smiles	zinc_id	inchikey	mwt	logp	reactive	purchasable	tranche_name	features
CC(=O)N[C@H](CC(=O)NNC(=O)c1sc(N2CCOCC2)nc1C)c1cccs1	10291988	NAEDOVFOWWFVPC-CYBMUJFWSA-N	437.547	1.378	50	20	IDGD	
COC[C@H](C)NC(=S)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	16187216	OEGBBJWRRWYBMI-NSHDSACASA-N	428.561	1.693	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)CCc2cnn(-c3ccccc3)c2)c2ccccc2c1=O	17190661	RZFYPNBWHOTTIN-UHFFFAOYSA-N	430.468	1.996	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(N2CCCC2)c(C(=O)NNC(=O)c2ccccn2)c1	20887893	NLGLNULECCADRD-UHFFFAOYSA-N	445.545	1.787	50	20	IDGD	
CCOC(=O)C1=NN(c2ccccc2)[C@H](C(=O)NNC(=O)COc2ccc(C#N)cc2)C1	111188150	LUFXYTUMEDFPDP-IBGZPJMESA-N	435.440	1.282	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Cn2nc(-c3ccccc3)ccc2=O)cc(OC)c1OC	117384924	SOBHLZISRFTZJP-UHFFFAOYSA-N	438.440	1.397	50	20	IDGD	
COc1ccc(CN2C[C@H](C(=O)NNC(=O)COc3cc(C)cc(C)c3)CC2=O)cc1	726521102	AHSYBIAOLLUSFM-GOSISDBHSA-N	425.485	1.887	50	20	IDGD	
Cn1c(SCC(=O)NNC(=O)c2ccc3c(c2)OCCO3)nnc1-c1cccs1	726751471	PHUYRTRQJZZHEK-UHFFFAOYSA-N	431.499	1.868	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3cc(F)cc4nc[nH]c34)cc2)CC1	728216214	UYCLKZIKKXMJDX-UHFFFAOYSA-N	432.481	1.395	50	20	IDGD	
C[C@@H](Oc1ccc2c(c1)CCC2)C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	728326006	ATRQOUBBYBHJPE-VLIAUNLRSA-N	440.452	1.473	50	20	IDGD	
C[C@@H](C(=O)Nc1cccc(F)c1)N1CCN(C(=O)NNC(=O)c2cccc(C#N)c2)CC1	728955128	YNIGUBSSJVAILE-HNNXBMFYSA-N	438.463	1.697	50	20	IDGD	
COCCNS(=O)(=O)c1cccc(C(=O)NNC(=O)Cn2ccc3ccccc32)c1	729450934	BDBAIHFLKUIXJJ-UHFFFAOYSA-N	430.486	1.027	50	20	IDGD	
O=C(NCCOc1ccccc1C(F)(F)F)NNC(=O)c1ccc(-n2cnnn2)cc1	730125108	NKXWAWNKEZCPKC-UHFFFAOYSA-N	435.366	1.704	50	20	IDGD	
COc1ccccc1C/C(C)=C/C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	730343102	CXFSLFOICRZGSH-IZLCOFNUSA-N	440.452	1.715	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N(C)C)o2)cc1Br	732032843	IWAKSWCWQUVHHW-UHFFFAOYSA-N	446.279	1.376	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)C2CCN(C(=O)OCc3ccccc3)CC2)C[C@H](C)O1	732262061	IIAWSXANGVALNM-ROUUACIJSA-N	446.548	1.682	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)/C(=C\c1cccnc1)NC(=O)c1ccccc1	733145653	VOQDLDKKUGUFQA-SFQUDFHCSA-N	449.492	1.491	50	20	IDGD	
CC[C@H](C#N)Oc1cccc(CNC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c1	733805693	UOLZZQAUYFVYPE-MRXNPFEDSA-N	430.486	1.915	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)c2cccc(-n3cnnn3)c2)CC1	734824983	PMGDLUWXRNBPGZ-UHFFFAOYSA-N	430.469	1.006	50	20	IDGD	
CC(C)c1ccccc1OCC(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	735117633	ZRCPBDYUMDZZIO-UHFFFAOYSA-N	447.561	1.663	50	20	IDGD	
O=C(NNC(=O)[C@H]1CC(c2c(F)cccc2F)=NO1)C1CCN(c2ncccn2)CC1	736013886	ZLKODFLCKCRMRH-MRXNPFEDSA-N	430.415	1.312	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)c2ccc(N3CCOCC3)nc2)cc1C	736770393	ARYJFRBFIWVZGH-UHFFFAOYSA-N	432.502	1.469	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)c2ccc(N3CCNC3=O)cc2)cc1C	736771677	TYAJHKAYKFADJS-UHFFFAOYSA-N	430.486	1.767	50	20	IDGD	
COc1cc([N+](=O)[O-])ccc1OC(=O)CN(C)S(=O)(=O)c1cccc([N+](=O)[O-])c1	737529074	AELNFENJVAVZTE-UHFFFAOYSA-N	425.375	1.738	50	20	IDGD	
Cc1cc(=O)c(C(=O)NNC(=O)COCc2ccccc2)nn1-c1ccccc1[N+](=O)[O-]	737636276	HUHLAIYCWUDZQI-UHFFFAOYSA-N	437.412	1.427	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)c1nccnc1C(=O)NCc1ccc(F)cc1	737926621	LBDYRYCIZPIOAI-UHFFFAOYSA-N	437.431	1.524	50	20	IDGD	
O=C(C[C@H]1CN(Cc2ccccc2)CCO1)NNC(=O)c1csc(N2CCOCC2)n1	740740049	MMWQULZODGWXMG-KRWDZBQOSA-N	445.545	1.032	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)c2nnn(C)c2C)c1	741658934	IKOYMPWQMOZXGS-UHFFFAOYSA-N	444.473	1.008	50	20	IDGD	
Cn1c(=NNC(=O)[C@H](CCC(N)=O)N2C(=O)c3ccccc3C2=O)sc2ccccc21	742243374	ZGOWFLLJWOLEMG-HNNXBMFYSA-N	437.481	1.102	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=S)N[C@H]2CCc3ccccc3C2)cc1	742976132	UGUPQEFQUAPWOY-SFHVURJKSA-N	446.598	1.668	50	20	IDGD	
COC(=O)c1ccc(S(=O)(=O)NNC(=O)c2ccccc2F)c(Br)c1	743251591	ADHSMYLIMGEIRV-UHFFFAOYSA-N	431.239	1.998	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)C[C@H]2CN(Cc3ccccc3)CCO2)c1	743307902	YTYRARPOCJOIKU-SFHVURJKSA-N	431.514	1.142	50	20	IDGD	
CC[C@H](C)NC(=O)[C@H](C)NC(=O)NNC(=O)[C@@H](C)Oc1cccc(Br)c1	744277821	OMUQJMMIRLZREZ-SDDRHHMPSA-N	429.315	1.850	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)N2CCN(CC(=O)NNC(=O)c3cccc(C)c3)CC2)c1	744407734	QIUMNBDEPCMJLS-IBGZPJMESA-N	438.528	1.676	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1c[nH]c(C(=O)N2CCCC2)c1	744621878	IUHHZLXLFANTNZ-UHFFFAOYSA-N	447.517	1.029	50	20	IDGD	
Cc1cc(C)cc(N2CC[C@H](C(=O)OCC(=O)NNC(=O)c3ccc(C#N)cc3)C2=O)c1	744850636	MMWWRBMPPJVSSW-IBGZPJMESA-N	434.452	1.532	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2cc(C)cc(F)c2)c1	747595247	LDFHWXSPGMBABB-UHFFFAOYSA-N	443.522	1.788	50	20	IDGD	
Cc1c(/C=C(\C#N)C(=O)NCCC(=O)N2CCN(c3ccccn3)CC2)cc(C#N)n1C	748242613	SXAZOADXFYTNMI-CPNJWEJPSA-N	431.500	1.362	50	20	IDGD	
Cc1ccc(-c2nnn(CC(=O)NNc3c(F)cc(C(=O)NC4CC4)cc3F)n2)cc1	748828781	LABBCZRBSDBDEI-UHFFFAOYSA-N	427.415	1.962	50	20	IDGD	
CCc1ccc(S(=O)(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)cc1C(=O)O	749750666	NNQYECVQFBUJEJ-UHFFFAOYSA-N	438.458	1.596	50	20	IDGD	
COc1ccc([C@H](C)CC(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1	750539232	NBSRZFPJITWSIQ-KUHUBIRLSA-N	428.441	1.719	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)c2cccc(CN3CCS(=O)(=O)CC3)c2)cc1	751292862	BUGCEWCYPPTMSH-UHFFFAOYSA-N	431.514	1.065	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NCCn2c(O)nc3ccccc32)cc1	753036164	BCIYFRWNYJHGDE-UHFFFAOYSA-N	432.462	1.181	50	20	IDGD	
CC(C)Oc1ccc(NC(=S)NNC(=O)c2ccc(CNS(C)(=O)=O)o2)cc1	754200028	MQZPXQNGHAFZNL-UHFFFAOYSA-N	426.520	1.747	50	20	IDGD	
O=C(Cc1ccc([N+](=O)[O-])cc1Br)NNC(=O)[C@@H]1COc2ccccc2O1	755037996	HWTTUASMIKVQME-HNNXBMFYSA-N	436.218	1.887	50	20	IDGD	
CSCC[C@@H](NC(=O)c1ccc2ccccc2n1)C(=O)NNC(=O)Cc1cc[nH]n1	755280121	UYOZVKDJRWHALN-QGZVFWFLSA-N	426.502	1.200	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Nc2ccc(OCC(=O)N(C)C)cc2)cc(OC)c1OC	755644708	AMHWNILFFMTZLI-UHFFFAOYSA-N	446.460	1.646	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2cccc(C(=O)N3CCOCC3)c2C)cc1OC	756184995	WIGBVYAKIFOOIS-UHFFFAOYSA-N	442.472	1.951	50	20	IDGD	
COc1c(Br)cc(Cl)cc1NC(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O	756430224	JWJIDTAFVUMGIT-ZCFIWIBFSA-N	443.707	1.202	50	20	IDGD	
CNS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2ccc(F)cc2Br)cc1	756641918	ZHWLQGDEKKDKMD-UHFFFAOYSA-N	445.270	1.963	50	20	IDGD	
CCn1cc([N+](=O)[O-])c(C(=O)NNC(=O)c2ccc(CSc3nncn3C)cc2)n1	756798596	BTMJDTPOTOPVLH-UHFFFAOYSA-N	430.450	1.307	50	20	IDGD	
COC(=O)c1cccc(CC(=O)NNC(=O)c2ccc(CSc3nncn3C)cc2)c1	758059661	RHCVWWZGFLDMBD-UHFFFAOYSA-N	439.497	1.898	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2COc3ccc(Br)cc32)c1	758403232	STFACHUAWOTYCM-CQSZACIVSA-N	439.287	1.790	50	20	IDGD	
CCS(=O)(=O)N1CCC(CNC(=O)NNC(=O)c2cc(C)nc3ccccc23)CC1	758744369	PTIJWMRTECJEFF-UHFFFAOYSA-N	433.534	1.549	50	20	IDGD	
O=C(NNC(=O)[C@@H]1C[C@H]2CCCC[C@@H]2N1C(=O)c1ccccc1)C(=O)Nc1ccccn1	758835731	YFUKYDXBUJFLID-SQNIBIBYSA-N	435.484	1.641	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cc(C(=O)NNc3nccn(C)c3=O)ccc2F)cc1	760131006	IQHKINZYANIEJF-UHFFFAOYSA-N	447.448	1.486	50	20	IDGD	
COc1cc(C=NNC(=O)CNC(=O)c2cccnc2)ccc1OC(=O)c1ccncc1	763193611	RWGIHKAGFOJTFI-UHFFFAOYSA-N	433.424	1.585	50	20	IDGD	
COc1ccc(Cn2ncc(C)c2NC(=O)C(=O)NNC(=O)c2ccccc2)cc1OC	763430234	OHTBVXBVVAFSSW-UHFFFAOYSA-N	437.456	1.657	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c(OC[C@H]2CCCO2)c1	763441729	ILMUEOFXWAZRIJ-MRXNPFEDSA-N	442.428	1.861	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2c[nH]c3ccccc23)cc1	763535708	JZYOBUIMTTWKBL-UHFFFAOYSA-N	443.485	1.254	50	20	IDGD	
CCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(OC)c(OC)c2)c(C)c1	763542400	FDJRGSYJDLRRSD-UHFFFAOYSA-N	428.445	1.162	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)nn1-c1cccc(Cl)c1	763559009	PXISQZKYQQFLTL-UHFFFAOYSA-N	441.831	1.963	50	20	IDGD	
Cc1cnn(-c2ccc(NC(=O)C(=O)NNC(=O)[C@@H]3COc4ccccc4O3)cc2F)c1	763570611	GYWBHVPXOVYVQF-SFHVURJKSA-N	439.403	1.246	50	20	IDGD	
Cc1nc(Br)ccc1NC(=O)C(=O)NNC(=O)[C@H]1COc2ccccc2O1	763570702	HQCKUFDRZVSTDK-CYBMUJFWSA-N	435.234	1.078	50	20	IDGD	
CCCCN(C)c1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1	763573063	XAQDIANHLZDDAJ-IBGZPJMESA-N	426.473	1.849	50	20	IDGD	
COCCCS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(C)oc2C)cc1	763581662	CMIOVPDWYMNOSQ-UHFFFAOYSA-N	437.474	1.106	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(OC(F)(F)F)cc2)cc1	763660782	GSRJYVNELXELRP-UHFFFAOYSA-N	427.335	1.759	50	20	IDGD	
CCN1CCc2ccc(NC(=O)C(=O)NNC(=O)c3nn(CC)c(=O)c4ccccc34)cc21	763787102	VXCSKFZQDIDZIM-UHFFFAOYSA-N	448.483	1.199	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(S(=O)(=O)NC3CC3)c2C)cc1	763829478	ALRRFQJYQNBHFL-UHFFFAOYSA-N	444.513	1.398	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cccc(-n3cnnn3)c2C)c1C	763839420	GPWZJCDPBUWHGI-OAHLLOKOSA-N	437.460	1.141	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1cccc(N2CCOC2=O)c1	763872628	OBSCGTMGIBFVPI-GFCCVEGCSA-N	430.392	1.336	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)C(=O)Nc1ccccc1OCC(F)(F)F	763917181	QVVKXIFYALDARS-UHFFFAOYSA-N	449.349	1.003	50	20	IDGD	
CCCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccc(F)cc2)cc1	763919124	LQUVAEUDDMCHRW-UHFFFAOYSA-N	436.465	1.306	50	20	IDGD	
CO[C@@H](C)C(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)c1	763974151	LVPVEOQLUYYTES-JTQLQIEISA-N	434.836	1.419	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)C(=O)Nc1ccnn1Cc1ccccc1F	763995136	MWWSGWYNLTUACY-UHFFFAOYSA-N	449.240	1.561	50	20	IDGD	
COc1cc(F)c(NC(=O)C(=O)NNC(=O)c2cc(Br)cn2C)cc1F	764001535	AIZWSNSIXBUEFY-UHFFFAOYSA-N	431.193	1.474	50	20	IDGD	
CCOc1cc(F)ccc1NC(=O)C(=O)NNC(=O)c1cc(Br)cn1C	764004656	KTRSSWQTJUWECG-UHFFFAOYSA-N	427.230	1.725	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc(CN2C(=O)CSC2=O)cc1	764040047	BVQBQCUVQOKSOL-UHFFFAOYSA-N	442.453	1.290	50	20	IDGD	
CN(C)C(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)ccc1Cl	764114982	KBFPVQOVWQSMEA-UHFFFAOYSA-N	439.255	1.801	50	20	IDGD	
CCOC(=O)Cn1ccc2cc(NC(=O)C(=O)NNC(=O)CCc3ccco3)ccc21	764168341	DFBXNIAVECSGCC-UHFFFAOYSA-N	426.429	1.516	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)C(=O)Nc1ccccc1CN1CCc2ccccc21	764268939	YVOOZDCWNOXVIY-UHFFFAOYSA-N	429.480	1.973	50	20	IDGD	
O=C(NNC(=O)c1cc(F)ccc1Br)C(=O)Nc1ccc(-n2cccn2)nc1	764270314	LKHJFBQREOCVPW-UHFFFAOYSA-N	447.224	1.569	50	20	IDGD	
CC(C)Cc1cc(NC(=O)C(=O)NNC(=O)c2cc(Br)ccc2O)n(C)n1	764279659	AQVKYHRVZAOMSW-UHFFFAOYSA-N	438.282	1.486	50	20	IDGD	
COC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(OC)cc2OC)cc1F	764286135	FTDMXBCUMUEXHE-UHFFFAOYSA-N	434.380	1.421	50	20	IDGD	
O=C(CCCc1cccs1)NNC(=O)C(=O)Nc1cccc(CN2CCOC2=O)c1	764339483	MWJULUDTYPGXGB-UHFFFAOYSA-N	430.486	1.809	50	20	IDGD	
O=C(CCCc1cccs1)NNC(=O)C(=O)Nc1cccc(-c2nnnn2C2CC2)c1	764341459	NMRZWJMLXJMPFO-UHFFFAOYSA-N	439.501	1.845	50	20	IDGD	
CNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1Cl	764352011	WPBLZFMXTVJIRF-UHFFFAOYSA-N	440.847	1.285	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2cccs2)[nH]n1)C(=O)Nc1ccccc1Cn1cncn1	764382671	OXJVOQKCBDAUSB-UHFFFAOYSA-N	436.457	1.178	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3c[nH]nc3-c3ccccn3)n[nH]2)cc1C	764386201	BQJHXWHRMKDPDM-UHFFFAOYSA-N	444.455	1.878	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1cccc(-c2ccc3c(c2)CCO3)c1	764400279	PAYMXHQZIGQQOO-AWEZNQCLSA-N	427.457	1.426	50	20	IDGD	
O=C(Cc1csc(N2CCCC2=O)n1)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	765617450	BFMHLGFYPZQRKU-UHFFFAOYSA-N	428.449	1.803	50	20	IDGD	
CC(C)Oc1ccccc1CC(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765739529	XFUWEPIGSCWMOP-UHFFFAOYSA-N	438.528	1.622	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNS(=O)(=O)c1cnc2c(Cl)c(C)nn2c1	766306854	JMXZXYTYIAWEGP-UHFFFAOYSA-N	439.881	1.478	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)[C@@H]1CCSc2ccccc21	766642132	JRIUGRUXMBZNIE-LJQANCHMSA-N	438.553	1.871	50	20	IDGD	
CC(=O)Nc1ccc(Cl)c(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1	767734841	ORVDFCYEDFIBHE-UHFFFAOYSA-N	438.893	1.624	50	20	IDGD	
CN(C)C(=O)COc1ccc(C(F)(F)C(=O)NNc2ccccc2S(C)(=O)=O)cc1	769607517	NPLJVIWCDYJDEM-UHFFFAOYSA-N	441.456	1.792	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)NCc2ncccn2)cc1	770051301	JCPHOHWRQCKQRG-WJDWOHSUSA-N	431.456	1.447	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)N[C@@H]1CCO[C@@]2(CCS(=O)(=O)C2)C1	770785437	QJQPLVIKANGYPI-WRSAYESZSA-N	445.925	1.174	50	20	IDGD	
CCCn1c(=O)nc(O)c2c(C(=O)O[C@@H](C)C(=O)NNC(=O)CC)cc(C(C)C)nc21	771992993	IJYPXSVPHRMJPP-NSHDSACASA-N	433.465	1.133	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)CN(C)C(=O)c1ccc(Br)o1	772036774	NQNMFFORSCSNGD-SNVBAGLBSA-N	432.271	1.239	50	20	IDGD	
O=C(COc1cccc(Br)c1)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772196660	MOZWJPJNLNVJAX-UHFFFAOYSA-N	440.681	1.945	50	20	IDGD	
C[C@@H]1C[C@@H](NC(=O)NNC(=O)Cc2cn3ccccc3n2)CCN1C(=O)OC(C)(C)C	772465582	WIYZIWKHQOQQAX-CABCVRRESA-N	430.509	1.995	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(OC(F)F)cn2)cc1OC	772555486	KRMYDLMZKAPWRW-UHFFFAOYSA-N	425.344	1.318	50	20	IDGD	
CCC1(O)CCC(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)CC1	772599148	YQLYRPKZYLLIRH-UHFFFAOYSA-N	438.550	1.499	50	20	IDGD	
CNS(=O)(=O)c1ccc(CCC(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)cc1	772969306	LQJDIJFXQLGAOA-ZDUSSCGKSA-N	439.921	1.796	50	20	IDGD	
Cn1ncc(C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c1Cc1ccccc1	773603546	ZKQNQIVMKCMMRE-UHFFFAOYSA-N	437.412	1.537	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2ccc(C(=O)N3CCC[C@H](C)C3)cc2C)n1	773731586	SANKTOFHFQKJSO-ZDUSSCGKSA-N	426.477	1.748	50	20	IDGD	
COc1ccc(S(=O)(=O)NC2CC2)cc1NC(=O)C(=O)NNc1cccc(Cl)c1	773739952	GLDMJIZGVKDCRQ-UHFFFAOYSA-N	438.893	1.871	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)CN2C(=O)c3ccccc3C2=O)C1	774247442	VDVOADICROHWOP-ZDUSSCGKSA-N	430.461	1.077	50	20	IDGD	
CS(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2ccccc2O)cc1C(F)(F)F	775213435	WHBZGNWDWZPBSS-UHFFFAOYSA-N	431.392	1.959	50	20	IDGD	
COC(=O)c1sc2ccccc2c1S(=O)(=O)NNC(=O)CNC(=O)OC(C)(C)C	777939892	RWDHRMFFFWCAHM-UHFFFAOYSA-N	443.503	1.522	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)c1nccnc1C(=O)Nc1ccc(Cl)cc1	778438706	VELGWRIQNPAXKP-UHFFFAOYSA-N	448.867	1.668	50	20	IDGD	
Cc1sc(=O)n(CC(=O)NNC(=O)CNC(=O)OC(C)(C)C)c1-c1ccc(F)cc1	778443822	YCTIIYUADLEOHN-UHFFFAOYSA-N	438.481	1.696	50	20	IDGD	
COc1cc(S(=O)(=O)NNC(=O)c2ccc(C#N)cc2)c(OC)cc1Br	780383056	NDJWUJZAQJZLGR-UHFFFAOYSA-N	440.275	1.961	50	20	IDGD	
Cc1oc(-c2cccc(C(F)(F)F)c2)nc1C(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1	782550818	ROZVOJWIYXGKIH-GFCCVEGCSA-N	446.407	1.800	50	20	IDGD	
Cn1c(=NNC(=O)C(=O)Nc2ccc(N3C(=O)CCCC3=O)cc2)sc2ccccc21	783351960	QFBVPCWRHHJMBE-UHFFFAOYSA-N	437.481	1.854	50	20	IDGD	
COC(=O)[C@@H](Cc1ccc(F)cc1)NNC(=O)CCN1CCN(c2ccccc2)CC1	783574166	TZCPJCLXLJECCC-OAQYLSRUSA-N	428.508	1.743	50	20	IDGD	
Cc1ccc(NNC(=O)C(=O)Nc2ccnn2Cc2cccc(Br)c2)nn1	783948319	YBEXLARWYQHRIX-UHFFFAOYSA-N	430.266	1.874	50	20	IDGD	
CC1(CNC(=O)NNC(=O)CNC(=O)c2ccco2)CCN(C(=O)OC(C)(C)C)CC1	784263883	RWGGYSGGCDAMPN-UHFFFAOYSA-N	437.497	1.377	50	20	IDGD	
O=C(NNc1ccnc(Br)c1)C(=O)Nc1ccc(CCN2CCOCC2)cc1	784836916	CALZDAZTFIIUIY-UHFFFAOYSA-N	448.321	1.801	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNc3cccc(S(C)(=O)=O)c3)cc2)C[C@@H](C)O1	784844059	FNDRXEKFTCACGB-GASCZTMLSA-N	446.529	1.786	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)C(=O)Nc1cccc(OC[C@H]2CCCO2)c1	785067188	ILAGRSYPOJUYID-GOSISDBHSA-N	437.456	1.221	50	20	IDGD	
COC(=O)CNC(=O)Cc1ccc(NC(=O)C(=O)NNc2ccc(OC)c(Cl)c2)cc1	785120072	FEBQZWGNDOCTMI-UHFFFAOYSA-N	448.863	1.262	50	20	IDGD	
COC[C@@H](C)n1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3cc(C)ccc3C)[nH]n2)n1	785131407	YWPDOVQGUMVGMJ-CQSZACIVSA-N	439.476	1.497	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1)c1ncnn1C	788884853	CYWOHWCDYDVYOE-OXJNMPFZSA-N	433.516	1.834	50	20	IDGD	
O=C(NNC(=O)C(=O)NC1CC1)N[C@@H]1CCCN(c2ccc(Cl)cc2Cl)C1=O	788916506	LRPFFAWIADKNOU-GFCCVEGCSA-N	428.276	1.098	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)N[C@H](C)c2nnnn2C2CC2)c2ccccc2c1=O	790711479	SEMOHBXXTUAWFH-GFCCVEGCSA-N	439.480	1.223	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)[C@](C)(O)CSc2cccc(F)c2)c2ccccc2c1=O	794774072	CDGGFJSZHJCZRR-HXUWFJFHSA-N	430.461	1.377	50	20	IDGD	
C=C(CBr)COC(=O)c1cc(S(=O)(=O)N(C)C)ccc1N1CCOCC1	795411256	OYMXVMUGSGXKIU-UHFFFAOYSA-N	447.351	1.881	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(OC(C)C)c(C(N)=O)c2)c1	796992425	RABMMNBWQKTZKV-UHFFFAOYSA-N	428.445	1.046	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)Nc2cccc(S(=O)(=O)NCc3ccco3)c2)n1	797640287	UIPKTBZAVIVVQI-UHFFFAOYSA-N	429.458	1.928	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NC(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)nc1	797652863	STUVBEKZJDYRST-UHFFFAOYSA-N	449.461	1.477	50	20	IDGD	
COC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)c1C	798042427	RFHUTRPCFKGRHO-UHFFFAOYSA-N	434.836	1.992	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)c2ccc(S(=O)(=O)N(C)C)cc2)cc1C	798308106	PRGQOFXRGQJXOB-HNNXBMFYSA-N	446.529	1.443	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NN=C1CCC12CCOCC2	799868521	WPMJUOVDBAMMKY-UHFFFAOYSA-N	435.546	1.703	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(S(=O)(=O)NNC(=O)c2ccc(C#N)cc2)c1	800835444	GIILACRVTUCEEP-UHFFFAOYSA-N	436.515	1.212	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1C(=O)c2ccc(F)cc2S1(=O)=O	801664226	NKHZGCAAUJQGNQ-UHFFFAOYSA-N	441.824	1.093	50	20	IDGD	
CC(C)(C)OC(=O)N1CCOC[C@@H]1CC(=O)NNC(=O)c1cc(-c2cccs2)[nH]n1	802936566	AMSKTSOYHUHLHG-LBPRGKRZSA-N	435.506	1.925	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCC(=O)NNc2nccnc2C2CCC2)cc1OCC	805465259	YRDHTLLNTJPTOF-UHFFFAOYSA-N	449.533	1.963	50	20	IDGD	
O=C1COC[C@@H](C[C@H]2CN(C(=O)C(=O)NNc3c(F)cccc3F)c3ccccc32)N1	806984291	POCOWCAIMVNHMK-QWHCGFSZSA-N	430.411	1.443	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2)ccc1F	806984508	KWBCIIAFAMCZKA-UHFFFAOYSA-N	425.398	1.066	50	20	IDGD	
Cc1ccccc1C(=O)NNS(=O)(=O)N(C)C1CCN(C(=O)OC(C)(C)C)CC1	808070053	IGKDYPCUAKDPGR-UHFFFAOYSA-N	426.539	1.806	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H]1CC[C@H](C(=O)NNC(=O)CC(C)C)N1Cc1ccccc1	809986946	PTFQOQCLAZARJB-KDURUIRLSA-N	445.564	1.407	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)NCC(=O)NNC(=O)C(C)(C)c2ccccc2)cc1	810372713	ILPDOIMBRYVYQF-UHFFFAOYSA-N	432.502	1.049	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)[C@H](C)NC(=O)c2cccs2)c2ccccc2c1=O	813300713	KOYGUZFFBVTDAY-LBPRGKRZSA-N	427.486	1.618	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCc2nncn2C1)C(=O)Nc1cccc(OCCc2ccccc2)c1	815691527	SQNGSSIFJIVQNJ-KRWDZBQOSA-N	448.483	1.248	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCc2nncn2C1)C(=O)Nc1cccc(C#Cc2cccs2)c1	815691840	CJVGPEBUMBNMAL-OAHLLOKOSA-N	434.481	1.088	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)CCNS(=O)(=O)c1cc(C)ccc1C	825615071	GOPMTMMNTKYYTR-UHFFFAOYSA-N	434.518	1.240	50	20	IDGD	
CN(C)C(=O)N1CCC(C(=O)NNC(=O)COc2ccc(Br)cc2)CC1	915807002	YBRITFCORDIUAT-UHFFFAOYSA-N	427.299	1.369	50	20	IDGD	
CN(C)C1(CNC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)CCCCC1	915890068	AHOMDJFIVRVGGD-UHFFFAOYSA-N	430.597	1.794	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)N[C@H](C)c2cccc(S(N)(=O)=O)c2)c2ccccc2n1	916196653	CCDITFADELMRFN-CYBMUJFWSA-N	427.486	1.896	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NC[C@@H]2COc3ccccc3C2)cc1	916199971	PTFHSAQXTWCCRF-MRXNPFEDSA-N	446.529	1.197	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCCNC(=O)NNC(=O)COc2cc(C)ccc2C)cc1	916278449	PPORGDRBPSOXCT-UHFFFAOYSA-N	434.518	1.300	50	20	IDGD	
O=C(O)COc1ccc(C=NNC(=O)CN2c3cccc4cccc(c34)S2(=O)=O)cc1	916367414	BIBHPRXWCWOJTI-UHFFFAOYSA-N	439.449	1.962	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)NCc1ccc(-n2cccn2)cc1	916519652	YWSDHWYZYPZEKO-UHFFFAOYSA-N	447.543	1.915	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)COc2ccccc2OC)sc(C)c1C	916562253	NYHYREXCTXASGV-UHFFFAOYSA-N	449.485	1.715	50	20	IDGD	
CC(C)(C)OC(=O)NNC(=O)NCc1ccc(S(=O)(=O)NC[C@@H]2CCCO2)cc1	916649921	XFGPSUZNUAFWDY-AWEZNQCLSA-N	428.511	1.383	50	20	IDGD	
C[C@@H](C(=O)Nc1cccc(F)c1)N1CCN(CC(=O)NNC(=O)c2cccs2)CC1	917124833	UQMNXKYLNIEZOY-AWEZNQCLSA-N	433.509	1.293	50	20	IDGD	
Cc1nccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)n1	917393855	YEGBBBLOTZORLM-UHFFFAOYSA-N	425.470	1.338	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C2(OC)CCN(C(=O)OC(C)(C)C)CC2)c1	917912612	RWQCHTZNJGGLBV-UHFFFAOYSA-N	437.493	1.881	50	20	IDGD	
O=C(CNC(=O)c1c[nH]c2ccccc2c1=O)NNC(=O)c1cc(-c2ccccc2)on1	917976838	PBCFXKKHAKYSFV-UHFFFAOYSA-N	431.408	1.374	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)NCCC(=O)NNC(=O)c2ccc(Cl)cc2O)cc1	918357926	PUBYJLQBKPQZGP-UHFFFAOYSA-N	439.877	1.378	50	20	IDGD	
CNS(=O)(=O)c1ccc([C@@H](C)NC(=O)NNC(=O)COc2cc(C)cc(C)c2)cc1	919779414	ROLRCVCVYTUHPI-OAHLLOKOSA-N	434.518	1.682	50	20	IDGD	
Cc1cccc(-n2ncc(C(=O)NNC(=O)N[C@@H]3CCS(=O)(=O)C3)c2C(F)(F)F)c1	919889623	QDOOZBSCXBHTIB-LLVKDONJSA-N	445.423	1.331	50	20	IDGD	
CC(C)NC(=S)NNC(=O)CSc1nnc(-c2ccncc2)n1Cc1ccco1	1116286262	OISVTUHSKPAWPF-UHFFFAOYSA-N	431.547	1.977	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc4n(n3)CCCC4)C2)C1	1778557800	SKMZHCQGEXUODZ-KUHUBIRLSA-N	439.354	1.694	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccn4cncc4c3)C2)C1	1778658014	GNVKKQVVHDERND-APWZRJJASA-N	435.322	1.951	50	20	IDGD	
C[C@H](NNc1ccccc1)C(=O)N1CCO[C@]2(CCN(C(=O)CO[Si](C)(C)C)C2)C1	1779294729	LZJIXHRUWDADGB-UWJYYQICSA-N	434.613	1.673	50	20	IDGD	
Cc1nc(CC(=O)N2CCO[C@@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)c(C)s1	1779296443	QQOSZGIJAVTULX-LJQANCHMSA-N	425.627	1.984	50	20	IDGD	
O=C(/C=N/O[C@@H]1CCCCO1)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(Cl)Cl)C2	1779427786	AKFSKFZKDUMAIF-MHDHHDOHSA-N	436.336	1.833	50	20	IDGD	
O=C(/C=C/C1CCCC1)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2	1780742367	GYZYEBYCRGZABH-SFMQXKJHSA-N	440.349	1.240	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)[C@H]3CC[C@@H]4CCC(=O)N4C3)CCO2)C1	1781231068	GBUXOOMTVBSODF-VZJWBNGJSA-N	446.375	1.454	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)Cc3ccc(F)c(C#N)c3)C2)C1	1781300273	PNGTVRVNHPQQEW-DJJJIMSYSA-N	438.297	1.853	50	20	IDGD	
O=C(Nc1ccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)cc1)C1CC1	1781465667	WYWATNWVGXJBDW-LAUBAEHRSA-N	435.908	1.078	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)n2cncn2)C1	1782534314	XYFAADIOXKWUAM-VMUDFCTBSA-N	428.331	1.136	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](C)Nc1ccccn1)CCO2	1783534333	SOIVLVHSNOXIGV-IYOUNJFTSA-N	425.327	1.495	50	20	IDGD	
CN1CCC(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Br)C[C@@H]32)CC1	1783656576	ISMRXQPVHZLNBN-JKQORVJESA-N	434.350	1.389	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CC3CCN(C)CC3)[C@H]2C1	1783656717	FVFXYKBJNGGSEI-IWCQGFGOSA-N	430.387	1.481	50	20	IDGD	
Cc1cc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]3C2)on1	1783968539	BHMQKMIYBZUGKJ-MZGVZZPPSA-N	428.327	1.536	50	20	IDGD	
Cc1ccc2nc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]4C3)ccc2c1	1784090607	JHYVDQRGJSUDPH-FEHORTKBSA-N	431.920	1.736	50	20	IDGD	
C[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)Br)C[C@@H]21)n1cccc1C=O	1786994863	LCOYQUVZBKOHPM-HZRXROBNSA-N	440.338	1.625	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C3CCN(c4ccccn4)CC3)C[C@@H]21)[C@@H](F)Cl	1787449717	VTDBERYYYQMQML-LSTDLKDCSA-N	438.931	1.812	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)C3CCC(O)CC3)CCC2)cc1)c1cccc(B(O)O)c1	1788149435	RGKFFSQHWBWKBT-UHFFFAOYSA-N	436.317	1.665	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4cnccc4[nH]3)C[C@@H]21)[C@H](F)Br	1789925734	IIPISMQAURIZOS-LVLWZLKYSA-N	439.285	1.847	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3c(F)ccc(O)c3F)[C@H]2C1	1790212647	HEWLGYUPNCVWCN-ASHKBJFXSA-N	432.851	1.518	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ncn(C(C)C)n3)C[C@@H]21	1790961833	RLGIKBFFCFMVBY-AJNGGQMLSA-N	442.358	1.626	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(C)(C)NCCC#N)C[C@@H]21	1791057575	GKKLCJGBXULEOA-AJNGGQMLSA-N	429.359	1.031	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1ccc(C2(NC(=O)c3ccc(O)nn3)CCC2)cc1	1791599819	WHAUMCZQKPQGBB-UHFFFAOYSA-N	426.477	1.303	50	20	IDGD	
Cc1nccn1[C@@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)CBr)C[C@@H]21	1791700700	MQQLMCPAHWPWOP-ZAZJUGBXSA-N	441.370	1.763	50	20	IDGD	
CCN1CCC(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]32)CC1	1792296470	WFWHJKNDJSPIRF-BOSXTWCSSA-N	434.408	1.934	50	20	IDGD	
Cc1ncc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)CBr)s1	1792873219	PBFNVBXIKHEHIK-VFFTVRQLSA-N	430.368	1.615	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CCN1C(=O)OC(C)(C)C	1793632098	SJIVYDFBHVUNNH-QRJUGERDSA-N	429.945	1.603	50	20	IDGD	
CC(C)(C)c1cnc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)cn1	1796189129	ZKCATKSIQOHOHK-BCDXTJNWSA-N	436.321	1.020	50	20	IDGD	
CCSc1cccnc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1	1796191655	LGVULKVXWAOVBB-BCDXTJNWSA-N	439.346	1.439	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](C)N1C[C@H]3C[C@H]3C1)C2	1796892059	XMLFBKLOJDHTSF-SZQYBFAVSA-N	440.548	1.099	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccnc(Cl)n1	1798078494	SZFJPAZBISBBCX-KQXIARHKSA-N	431.718	1.364	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(N(C)C)nc1	1798259903	KXECXUPFNDFJJC-FAYQHZLMSA-N	439.354	1.382	50	20	IDGD	
C=C[C@H](O)C(C)(C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2	1798394701	CYYNLBPZGOUXAF-FDMNTINTSA-N	429.521	1.332	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccnc2c1OCO2	1798474086	WWHZVIQLTAHGPP-IMEWIIRVSA-N	430.288	1.250	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(-n2ccnc2)ccn1	1798725722	VEPXQPGHTSPFDX-LORHWOILSA-N	431.924	1.878	50	20	IDGD	
COc1ccnc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCBr)C3)c1OC	1798767729	NTTHTNVDYCHSTD-JJLQDPRZSA-N	442.310	1.087	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1Cc3ccccc3O1)C2	1799275936	DNKGTDNVCHFXMT-BXNDMCELSA-N	427.328	1.816	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc3ccc(F)cn13)C2	1799279927	XRWLGXRFVCATKL-FIXGWNCBSA-N	443.306	1.913	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2	1800639381	SSXIHBDTEPFRTE-LSCVPOLPSA-N	426.149	1.535	50	20	IDGD	
CCOC(=O)O[C@@H](C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](Br)CC	1800643583	XWADGIGCVQIZPW-HPCHECBXSA-N	435.315	1.311	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CO[Si](C)(C)C)C3)C1	1800966167	NQPHMTAGGGTADI-KMOPNRPKSA-N	440.613	1.407	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CC(c3ccccc3)=NO1)C2	1800971257	SPCKGVKWOQBTKB-MGGVOPSTSA-N	435.908	1.023	50	20	IDGD	
COc1ccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Br)C3)cc1F	1801502401	AZAATNMIXFXOKQ-LZDSYCOUSA-N	447.276	1.657	50	20	IDGD	
CC[C@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCN1C(=O)C=CC1=O)C2	1801799119	PDLCMDGSCIFNMW-CRWXNKLISA-N	426.311	1.113	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)CC2CCOCC2)[C@@H]1c1cccnc1	1806935690	HLRXJDRZULTJKQ-XXBNENTESA-N	445.564	1.277	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)c2ccccc2O)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1	1807369549	NPNKFGJFBSTKRX-XMSQKQJNSA-N	445.284	1.100	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)Cn2cc([N+](=O)[O-])cn2)[C@@H]1c1cccnc1	1808250210	IOVPNKYNWOXMAB-QILLFSRXSA-N	434.884	1.910	50	20	IDGD	
Cc1cc(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)c[nH]1	1808776629	VNWMMTYELGQLFG-RXVVDRJESA-N	432.289	1.031	50	20	IDGD	
C=CCNC(=O)/C=C\C(=O)N1CCC2(CCCN(C(=O)CCBr)C2)CC1	1809064562	RDOQJZITHGKXQL-PLNGDYQASA-N	426.355	1.861	50	20	IDGD	
O=C(COc1ccc(O)nn1)N1CCC2(CCCN(C(=O)CCBr)C2)CC1	1809070673	SRCUWEYQELYRMZ-UHFFFAOYSA-N	441.326	1.577	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)[C@@H]1Cc2ccccc2O1	1809579348	FDWOWAGSRNNBPL-HNJRGHQBSA-N	429.904	1.691	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)C(Cl)Cl)[C@H]1c1cccnc1)c1n[nH]cc1[N+](=O)[O-]	1810638992	TVTYQVHNWAAMNU-GWCFXTLKSA-N	427.248	1.836	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)CCS(C)(=O)=O)[C@@H]1c1cccnc1	1812868195	UFYGDWGALLAJEP-JGGQBBKZSA-N	446.367	1.306	50	20	IDGD	
CCOc1cnc(C(=O)N2CC[C@H](CNC(=O)[C@@H](Cl)COC)[C@H]2c2cccnc2)cn1	1813029741	VNTUEXHGORQORI-JTDSTZFVSA-N	447.923	1.844	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)C2CCC(O)CC2)[C@H]1c1cccnc1	1813196910	BKAAIJPPXKEIDI-DQXZDLPLSA-N	445.564	1.012	50	20	IDGD	
COc1ccc([C@H](O)C(=O)Nc2cc([C@H]3CCCCN3C(=O)[C@H](O)CCl)[nH]n2)cc1	1814632435	HJKSSSAYZHOMRI-NUJGCVRESA-N	436.896	1.744	50	20	IDGD	
Nc1c(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)[C@H](O)CCl)[nH]n2)sc2nccnc12	1817433734	IWPNTGQDZIPMIP-WDEREUQCSA-N	449.924	1.902	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)CCc2ccco2)[nH]n1)c1cccc(B(O)O)c1	1817473941	HMAMVSXPUCDLIN-LJQANCHMSA-N	436.277	1.621	50	20	IDGD	
CC[C@@H](O)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)n[nH]1	1818110364	CHVLKEUZXKXDTR-ILLSNQCBSA-N	429.481	1.307	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)[C@@H](O)CCl)[nH]n2)cc1O	1821355981	PUYXNQYENZFFFM-WBVHZDCISA-N	449.895	1.979	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1)c1cc2cccnc2nc1O	1821423441	IVHNWWGMFKVPLU-HUUCEWRRSA-N	444.879	1.964	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](O)CCl)CC2)c1nn[nH]c1C(F)(F)F	1821639613	UOGWQGFTRAVVCM-FSPLSTOPSA-N	438.819	1.106	50	20	IDGD	
C[C@@H](C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1)n1cccc1	1822678464	YLFMMICIJSTHAD-DOTOQJQBSA-N	429.525	1.838	50	20	IDGD	
CN1CCN(C2(C(=O)Nc3nc4c(s3)C[C@@H](NC(=O)[C@@H](F)Cl)CC4)CC2)CC1	1822716068	VPWHJIXZFUNSAB-SMDDNHRTSA-N	429.949	1.370	50	20	IDGD	
CC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)COc1ccc(O)nn1)CC2	1822855737	PBYCFNUQKYQXTP-VHSXEESVSA-N	425.898	1.647	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](C)n2cnnn2)n[nH]1	1822858430	AJRLPKWJLSLLBS-GMXVVIOVSA-N	439.318	1.823	50	20	IDGD	
O=C(N[C@@H]1CCc2nc(NC(=O)[C@@H]3CC(c4ccccc4)=NN3)sc2C1)[C@H](O)CCl	1824427942	PYSZKDZWKISXHL-UHOFOFEASA-N	447.948	1.421	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)c2ccnc(F)c2)CC1	1824720093	KVPVPOFDYQJDLJ-HXUWFJFHSA-N	439.296	1.448	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3CCC=CO3)C2)C1	1830540814	SROOXLBYQXHVQY-VKJFTORMSA-N	431.327	1.167	50	20	IDGD	
CN(CC(=O)N1CCCC[C@@H]1C1CCN(C(=O)C(C)(C)CCl)CC1)C(=O)C(=O)O	1831159846	ANMAETHMBMRWMD-OAHLLOKOSA-N	429.945	1.414	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCCCCC(=O)OC)C2)C1	1831656349	DGVKWCLTAYDGGS-LAUBAEHRSA-N	446.972	1.974	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)COc2ccc(O)nn2)CC1	1831834736	HFDREFVWGBOQEW-HZPDHXFCSA-N	440.928	1.435	50	20	IDGD	
CCC(=O)N[C@H](C)C(=O)N1CCC(N2CCC(NC(=O)C(C)(C)CCl)CC2)CC1	1833213754	YPHVIALZUSXHNV-OAHLLOKOSA-N	429.005	1.738	50	20	IDGD	
Cc1ncc(C(=O)N2CCC(N3CCC(NC(=O)[C@@H](C)CBr)CC3)CC2)[nH]1	1833264706	IHXRKHDPSLGGGS-ZDUSSCGKSA-N	440.386	1.934	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)C(C)(C)C)CC2)CC1	1833286884	IZJLMVIKCMCKIT-CZUORRHYSA-N	432.403	1.748	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3ccc4cccnc4n3)CC2)CC1)[C@@H](O)CCl	1833309836	AWSWCTNXCWPSNI-IBGZPJMESA-N	445.951	1.415	50	20	IDGD	
Cc1c(C(=O)NC2CCN(C3CCN(C(=O)CO[Si](C)(C)C)CC3)CC2)cnn1C	1834279436	PXSVGZLYAQBXQE-UHFFFAOYSA-N	435.645	1.765	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)c3ccc(O)cc3F)C2)C1	1834823657	BCDAEIDMILRCIO-GOSISDBHSA-N	445.285	1.386	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C1(C(F)(F)F)CCC1)CCO2	1835473865	BDUPRBODUHGAIK-XJKSGUPXSA-N	442.862	1.429	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC1CCN(C2CCN(C(=O)c3cc(CO)on3)CC2)CC1	1835836028	BOHDGIFNYIPVKM-UHFFFAOYSA-N	438.601	1.204	50	20	IDGD	
COc1ccsc1C(=O)NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836037408	GQXIGXBIZKRQHF-HNNXBMFYSA-N	429.970	1.542	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)c3ccn(CCOC)n3)CC2)CC1	1836394325	SBVIPLGCHDNCSN-GOSISDBHSA-N	439.988	1.732	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)CSCC(=O)OC)CC2)CC1	1836394824	GWPCXAXIAYORCM-MRXNPFEDSA-N	434.002	1.482	50	20	IDGD	
CC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)c3nc4ccccn4n3)CC2)CC1	1836396074	RBABULQHPWUCJP-KRWDZBQOSA-N	432.956	1.932	50	20	IDGD	
Cc1cscc1C(=O)N1CCOC[C@@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1837713301	UWMWYNVAROKNKG-LJQANCHMSA-N	426.611	1.978	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc(OC)c(F)c3)C2)C1	1839143307	SIOHWIMHRPYJMH-IFXJQAMLSA-N	429.876	1.317	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(O)n3)C2)C1	1839963712	SZLPAUAAKNUDDC-FZKQIMNGSA-N	442.310	1.031	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cncc(O)c3)C2)C1	1839966856	RNCHPFFLOLCXTP-YJBOKZPZSA-N	442.310	1.031	50	20	IDGD	
CCc1noc(C)c1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)Br)CCO2	1840033325	ALJHLSDJFSVDBH-SGTLLEGYSA-N	444.326	1.399	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3c(F)cccc3Cl)C2)C1	1840153774	ARBVNSHGQTYVFB-LIRRHRJNSA-N	449.306	1.803	50	20	IDGD	
C[C@H](Oc1cccnc1)C(=O)N1CCOC[C@]2(CN(C(=O)C(Cl)Cl)CCO2)C1	1840190931	VXTJJPHLENKRBZ-SCLBCKFNSA-N	432.304	1.109	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3ccoc3)CCO2)C1	1840512561	DEASECYRXPYITI-HNAYVOBHSA-N	443.338	1.700	50	20	IDGD	
C[C@@H](Sc1cccs1)C(=O)N1CCCC12CN(C(=O)c1cnccc1C(=O)NN)C2	1844168686	NIIBJSWPAWKTQP-CYBMUJFWSA-N	445.570	1.744	50	20	IDGD	
COC(=O)C[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)[C@H](F)Cl)C2	1846212683	OQVMFWVQEHVBRN-AAEUAGOBSA-N	435.880	1.181	50	20	IDGD	
COc1cc(CNC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc(OC)c1OC	11761882	NDZVVNOUIJRSJF-UHFFFAOYSA-N	441.444	1.748	50	20	IDGD	
Cn1c(=O)n(CC(=O)NNC(=O)COc2ccc(Br)cc2)c2ccccc21	14322601	VKZZHWWFROYVHM-UHFFFAOYSA-N	433.262	1.329	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCc2ccccc2)cc1C(=O)NNc1nnc(C)c(O)n1	29067250	AMZOHVWLRJYINU-UHFFFAOYSA-N	428.474	1.429	50	20	IDGD	
C[C@]1(c2ccc(CNC(=O)NNC(=O)Cc3cccc4ccccc34)cc2)NC(=O)NC1=O	726282779	SLLNLOYDLHNMIC-XMMPIXPASA-N	445.479	1.968	50	20	IDGD	
C[C@@H]1CC(C)(C)C[C@]2(C1)NC(=O)N(CC(=O)NNc1nc(-c3ccncc3)no1)C2=O	726377426	YZDCHMIQYDPNAZ-ODXCJYRJSA-N	427.465	1.712	50	20	IDGD	
CC(C)(C)OC(=O)NC1(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)CCCC1	727115004	DZUOLTNXJFDHLS-UHFFFAOYSA-N	439.538	1.578	50	20	IDGD	
CC(=O)c1c(C)[nH]c(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)c1C	728213233	HFMLFJDTXDOIQT-UHFFFAOYSA-N	433.534	1.527	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(CNC(=O)NNC(=O)Cc2cccnc2)s1	728943929	ZJBJJGBFEYKKJN-UHFFFAOYSA-N	425.536	1.247	50	20	IDGD	
O=C(NNC(=O)[C@H](c1ccccc1)N1CCC(O)CC1)C1CCN(c2ncccn2)CC1	729536949	OZDQYOOOFAFPOW-FQEVSTJZSA-N	438.532	1.038	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)c2cc([N+](=O)[O-])cc(S(C)(=O)=O)c2)cn1	729691732	QBCBVXPYHLARPX-UHFFFAOYSA-N	425.448	1.033	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])o2)o1	732062135	RERATFZEONYYNM-AWEZNQCLSA-N	447.448	1.688	50	20	IDGD	
CSc1cccc(N2C[C@H](C(=O)NNC(=O)CCN3C[C@H](C)O[C@@H](C)C3)CC2=O)c1	732262393	SCMGVLZJWVCQIR-HRCADAONSA-N	434.562	1.408	50	20	IDGD	
C[C@@H]1C[C@H]1C(=O)Nc1cccc(C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c1	732327834	MEVCAFHREOQYAS-SJKOYZFVSA-N	440.412	1.807	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)[C@@H]2CC(=O)N(C[C@H]3CCCN3CC)C2)o1	733139207	FIAOCVAPWLMUBS-IAGOWNOFSA-N	433.553	1.215	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN[C@](C)(CO)c2cccc(C(F)(F)F)c2)n1	735493342	OJMAEIVGCYGYJJ-QGZVFWFLSA-N	430.452	1.658	50	20	IDGD	
COc1ccc(S(N)(=O)=O)cc1C(=O)NNc1nc(-c2cccnc2)nc(C)c1C	736695126	UGDZAGVIKMFLCQ-UHFFFAOYSA-N	428.474	1.568	50	20	IDGD	
CCn1c(=O)nc(O)c2c(C(=O)NNC(=O)COCc3ccccc3)cc(C(C)C)nc21	737922999	IGBAVAVXNLBMGW-UHFFFAOYSA-N	439.472	1.618	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@H](Cn2cccn2)c2ccccc2)c2ccccc2c1=O	741427586	RRYLYVBTEVMNKS-LJQANCHMSA-N	445.483	1.998	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NN=Cc1c(N2CCOCC2)nc2ccccn12	741808695	AGMLHJLJTJVTCN-UHFFFAOYSA-N	431.497	1.329	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(OC3CCOCC3)cc2)c1	742033354	MNYPSWJRAJFAHA-UHFFFAOYSA-N	447.513	1.570	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)cc1NC(=O)OC(C)(C)C	742578416	ZKTLTQFFTITJSI-ZDUSSCGKSA-N	426.495	1.473	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)[C@@]2(C)CCCN(C(=O)c3ccccc3)C2)C[C@@H](C)O1	743289192	PMCWUTOBZMFCHA-IXFSTUDKSA-N	430.549	1.576	50	20	IDGD	
COc1cccc(-c2noc([C@@H](C)NC(=O)NNC(=O)[C@H]3COc4ccccc4O3)n2)c1	743703153	IHSXPPVOTZMJKE-SJKOYZFVSA-N	439.428	1.977	50	20	IDGD	
C[C@]1(NNC(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CCS(=O)(=O)C1	745904124	MASFUUJOBHVWMA-ACJLOTCBSA-N	432.493	1.638	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)[C@H]1CC(=O)N(c2ccc(F)c([N+](=O)[O-])c2)C1	746553510	LZXSIGWPJDXQGE-LBPRGKRZSA-N	440.391	1.125	50	20	IDGD	
COc1cc(C)nc(NNC(=O)[C@@H](CC(C)C)/N=C2/NS(=O)(=O)c3ccccc32)n1	746623263	IYWUEXWHNGJPCA-CQSZACIVSA-N	432.506	1.390	50	20	IDGD	
CC(C)c1ccc(S(=O)(=O)N2CCC(C(=O)NNc3nccn(C)c3=O)CC2)cc1	747943511	ZWGZOJSSTDPYHB-UHFFFAOYSA-N	433.534	1.448	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2ccc([C@]3(C)NC(=O)NC3=O)cc2)ccc1OC(C)C	748011971	KNJUYRAGPPLOGE-QFIPXVFZSA-N	440.456	1.612	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2ccc(C)c(C(=O)NNC(=O)C(=O)N3CCCC3)c2)cc1	748246092	FROUXPLPCPHZRW-UHFFFAOYSA-N	444.513	1.488	50	20	IDGD	
CC[C@H](C(=O)N1CCC(NC(=O)NNC(=O)[C@@H](C)OCCOC)CC1)c1ccccc1	748623546	JRPUYGCGNKFZCG-APWZRJJASA-N	434.537	1.553	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(=O)n(CC(=O)NNc2ccc(OC(F)F)cc2)c1	748643644	ISPFCXVVQIAXAQ-UHFFFAOYSA-N	444.460	1.624	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2ccc3c(c2)NC(=O)[C@@H](C)N3C)cc(OC)c1OC	749865237	ZHRXCECFLRDFRO-LLVKDONJSA-N	428.445	1.564	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1	750149675	JYDIOZXZNWOGBH-UHFFFAOYSA-N	434.474	1.183	50	20	IDGD	
O=C(NCCNS(=O)(=O)Cc1ccon1)NNC(=O)c1ccc(Cl)cc1Cl	750659164	DDZRNRGSRSJMKS-UHFFFAOYSA-N	436.277	1.045	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)c2sccc2S(=O)(=O)Nc2cnn(C)c2)cc1	750718290	TYQDILKDKILJAB-UHFFFAOYSA-N	433.515	1.920	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)c2ccc(=O)n(-c3cccc(F)c3)c2)c2ccccc2c1=O	751297877	SSGZKZOOTJHATI-UHFFFAOYSA-N	433.399	1.298	50	20	IDGD	
O=C(NNC(=O)c1cccc2nc(O)oc12)c1cccc(S(=O)(=O)N2CCCCC2)c1	751539649	VMKRDCINJUEXPO-UHFFFAOYSA-N	444.469	1.783	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)CNC(=O)c1cccs1)c1noc(Cc2ccccc2)n1	753036849	DFUXBPAFEUHHPX-LBPRGKRZSA-N	428.474	1.543	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)N[C@@H]1CCCN(Cc2ccccn2)C1=O	753290852	RUSSNJYKXNJMLN-QGZVFWFLSA-N	449.471	1.108	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCC2(C)CCOCC2)c1	753554301	NMDIUSSTKBRHPQ-UHFFFAOYSA-N	426.539	1.478	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)N[C@@H]1CCN(Cc2ccc(C#N)cc2)C1=O	753736988	AKGBUVHANKJNFS-IFXJQAMLSA-N	439.447	1.596	50	20	IDGD	
CC(C)[C@@H](NS(=O)(=O)c1ccc2ccccc2c1)C(=O)NNC(=O)Cc1cc[nH]n1	755283955	HBLZSDUFMQQUBP-LJQANCHMSA-N	429.502	1.256	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)NNC(=O)c2cc(OC)ccc2Br)co1	755857228	GMMNCZRVUBBZTI-UHFFFAOYSA-N	432.252	1.034	50	20	IDGD	
CN1CCCCC/C1=N\S(=O)(=O)c1cccc(NC(=O)NNC(=O)Cc2cc[nH]n2)c1	756164945	IJAMQYDQUBDHBN-KOEQRZSOSA-N	447.521	1.398	50	20	IDGD	
COC(=O)Cn1ccc(NC(=O)NNC(=O)[C@@H](C)Oc2cccc(Br)c2)n1	756648310	VSPHCRFQGSMQPO-SNVBAGLBSA-N	440.254	1.439	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)N[C@H]1CCN(C(=O)CCc2ccccc2)C1	757275424	OSCCDDXZHBGRHQ-HNNXBMFYSA-N	441.444	1.478	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)[C@H](C)n2nnnc2C(C)(C)C)c1	758015697	IRJZWAXMJZRQCN-VIFPVBQESA-N	425.287	1.764	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)Nc1ccc2c(c1)CCC2	758155671	LVQGZAFYPULYDM-UHFFFAOYSA-N	444.513	1.663	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNS(=O)(=O)c1ccc(Br)o1	758946470	SHJZRCGJZMBXKW-UHFFFAOYSA-N	436.671	1.321	50	20	IDGD	
CCCNC(=O)NNC(=O)[C@@]12CCC(=O)N1c1ccccc1C(=O)N2Cc1ccccc1	759622617	VNHQITWCHZCWAI-HSZRJFAPSA-N	435.484	1.906	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)c2cnn(CCO[C@H]3CCCCO3)c2C)cc1	760123084	HPLDYANILJAKRE-FQEVSTJZSA-N	431.493	1.616	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)Nc2cccn(CCS(C)(=O)=O)c2=O)c1C	760774686	ZOHVPACEXORYGU-QGOAFFKASA-N	446.529	1.503	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)N[C@@H]1CCCN(CC(F)(F)F)C1=O	761741841	AGLWSIVLBGOMKZ-LLVKDONJSA-N	434.440	1.671	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)N[C@H]1CCCN(Cc2ccccc2)C1=O	761789089	ZXKZRHWWKFKNMB-INIZCTEOSA-N	427.417	1.436	50	20	IDGD	
Cc1cc(Cl)cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c1	763108607	LZLFFEHYLOIMCA-UHFFFAOYSA-N	437.905	1.744	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccccc1OC[C@H]1CCCCO1	763444014	PTTOIMXZGBHYFU-MRXNPFEDSA-N	442.428	1.942	50	20	IDGD	
COC(=O)Nc1cc(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3n2)ccc1F	763449741	HGSOIMAWSMIUDF-UHFFFAOYSA-N	425.376	1.952	50	20	IDGD	
COC(=O)N(C)Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3n2)cc1	763449780	ISHBKYSMOVTJFQ-UHFFFAOYSA-N	435.440	1.833	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2ccc(N3CCOCC3)cc2C)c1	763665929	RRBBHAFXQROYAV-UHFFFAOYSA-N	440.500	1.613	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(OCc2ccncc2)cc1	763814168	QRFOHCOKRVYAES-UHFFFAOYSA-N	445.435	1.697	50	20	IDGD	
COc1ccc2cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc3ccc(F)cc3)ccc2n1	763867882	YMVHVHNEVHHEIB-LBPRGKRZSA-N	426.404	1.936	50	20	IDGD	
CC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(C(C)=O)cc2)cc1	763878610	RYPRHUZPSNQEGW-ZDUSSCGKSA-N	426.429	1.401	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccc(NC(=O)OC(C)(C)C)cc2)n1	763881145	LKBPSEWYZXTVSB-UHFFFAOYSA-N	430.465	1.633	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccc(OC(F)F)cc2OC(F)F)n1	763881894	RFWHNJFFWRZPOE-UHFFFAOYSA-N	447.345	1.489	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(F)c(OC)cc2OC)cc1OC	763912770	SSXSCNASAVKFAT-UHFFFAOYSA-N	435.408	1.650	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc(C(=O)N2C[C@H](C)O[C@@H](C)C2)cc1	763955949	IROMEYZHUDNNBD-HOTGVXAUSA-N	438.484	1.644	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)C(=O)Nc1cccc2c1CCN(C(=O)OC(C)(C)C)C2	763992847	JVHBWCJSMOZZLG-UHFFFAOYSA-N	441.488	1.718	50	20	IDGD	
Cc1cc(S(C)(=O)=O)ccc1NC(=O)C(=O)NNC(=O)c1cccc2ccccc12	764047133	AVGYRNPAQOPEPG-UHFFFAOYSA-N	425.466	1.951	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccccc1N1C[C@H](C)O[C@@H](C)C1	764132873	RKWDFBLVJWJUJQ-HOTGVXAUSA-N	440.500	1.637	50	20	IDGD	
O=C(CC1CC1)NNC(=O)C(=O)Nc1cc(Br)ccc1N1CCOCC1	764142426	FKRNPPCHUKLFIY-UHFFFAOYSA-N	425.283	1.172	50	20	IDGD	
O=C(CC1CC1)NNC(=O)C(=O)Nc1ccc(-c2csc(N3CCOCC3)n2)cc1	764143993	SIIGFQUQRPRKMO-UHFFFAOYSA-N	429.502	1.533	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2O1)C(=O)Nc1ccc([S@@](=O)C(F)(F)F)cc1	764168253	PAANSEZGRXRILU-ILHIWHGASA-N	441.387	1.404	50	20	IDGD	
O=C(NNC(=O)c1cccc(OC(F)F)c1)C(=O)Nc1cnn(Cc2ccccn2)c1	764260538	ZVTXLNNITAVXEM-UHFFFAOYSA-N	430.371	1.328	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@H]2C)ccc1NC(=O)C(=O)NNC(=O)Cc1ccccn1	764263442	FXZFVBRXNNVNBV-MRXNPFEDSA-N	437.500	1.733	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1ccc(F)cc1OCC(F)F	764278052	QCIBOTAEKDPOEK-UHFFFAOYSA-N	427.335	1.340	50	20	IDGD	
CCCNS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc3ccccc3o2)cc1	764330573	BXRPIQZOESZCAX-UHFFFAOYSA-N	444.469	1.521	50	20	IDGD	
CCc1c(C(=O)NNC(=O)CNC(=O)c2cccnc2)cnn1-c1cccc(Cl)c1	764343886	UEUWQQVFAHOGNO-UHFFFAOYSA-N	426.864	1.674	50	20	IDGD	
CCN(CC)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1	764350716	IVUKMFHVNUAMFU-UHFFFAOYSA-N	448.483	1.754	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCc2cnn(CC(F)(F)F)c2)nc1	764373125	FXXFWBDAMNCKQI-UHFFFAOYSA-N	435.432	1.353	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNC(=O)CSc2ccccc2OC)cn1C	764392605	IAQFCEZGRLTAIM-UHFFFAOYSA-N	434.474	1.089	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=S)Nc3ccc4c(c3)OCO4)CC2)cc1	764519750	WXMJMJVUTCKQKA-UHFFFAOYSA-N	441.557	1.859	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)CCN2C(=O)COc3ccccc32)n[nH]1	765592799	RXCLIEIHUIQJHT-UHFFFAOYSA-N	435.440	1.662	50	20	IDGD	
Cc1nccn1CCCC(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	766664770	SRCAUCOPSLAKKI-UHFFFAOYSA-N	432.956	1.590	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCN([C@H](C)c3nccs3)CC2)cc1OC	767013476	WVBHYOFNVKXLEK-CQSZACIVSA-N	433.534	1.300	50	20	IDGD	
CC(=NNC(=O)c1ccc2c(c1)OCCO2)c1ccc(S(=O)(=O)N2CCNCC2)cc1	767488859	QKGBIMYQNRIMCU-UHFFFAOYSA-N	444.513	1.206	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)c3ccc(C[C@H]4CC(=O)NC4=O)cc3)n[nH]2)cc1	768268355	NCQSPYZWZJMZEA-SFHVURJKSA-N	445.479	1.919	50	20	IDGD	
COc1ccc(NNC(=O)[C@H]2CCCN2S(=O)(=O)c2cccs2)c([N+](=O)[O-])c1	768329499	WYJGGPVHDYAEHF-CYBMUJFWSA-N	426.476	1.961	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1csc(-c2ncccc2F)n1	768398976	XHXFRVNQKUZBNQ-UHFFFAOYSA-N	427.465	1.812	50	20	IDGD	
O=C(COC(=O)CCc1nc(C2CCCC2)no1)NNC(=O)[C@@H]1COc2ccccc2O1	770051099	BZKMAVPBFGLHGJ-INIZCTEOSA-N	444.444	1.190	50	20	IDGD	
CC[C@@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)c1sc(N2CCOCC2)nc1C	770208269	KQVBEEKWMVKZML-GFCCVEGCSA-N	427.527	1.352	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)COc1ccc(OCc2ccccc2)cc1)[C@@H]1CN(C)CCO1	770435311	MLEUOVZUWWGRAC-UTKZUKDTSA-N	442.516	1.694	50	20	IDGD	
Cc1[nH]ccc(=NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1Cl	771767103	USWUWBGSOZGMKO-UHFFFAOYSA-N	437.909	1.716	50	20	IDGD	
CN1CCN(Cc2cccc(NC(=O)C(=O)NNc3ccc(C(F)(F)F)cn3)c2)CC1	773665847	HIRQUOKDRVJPFK-UHFFFAOYSA-N	436.438	1.930	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cc3c(cc2[N+](=O)[O-])OCCCO3)cc1F	773889986	VBKGPIPXLCVULH-UHFFFAOYSA-N	432.364	1.603	50	20	IDGD	
COC(=O)CCN1CCN(C(=O)NNC(=O)c2ccc(COc3ccccc3)o2)[C@H](C)C1	774659766	RARIBJDXAOMHHY-MRXNPFEDSA-N	444.488	1.782	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)N2CC[C@H](OCCN3CCOCC3)C2)c1C	778333870	GKDKRIOLTFCTTA-VAZXNAHHSA-N	430.549	1.608	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)[C@@H](CC(C)C)N2C(=O)[C@H]3CC=CC[C@H]3C2=O)nc1C	778428529	NMEKOWQEVDIBBD-HLLBOEOZSA-N	443.504	1.771	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccnc(OC(C)C)c2)cc1	778707173	HQQOLAPYUOETCV-AWEZNQCLSA-N	428.445	1.625	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)Cc2c[nH]c3cccc(OC)c23)cc1OC	778866890	VSAKPVBPKLRHNF-UHFFFAOYSA-N	441.440	1.741	50	20	IDGD	
Cc1oc(C)c(S(N)(=O)=O)c1C(=O)NNc1ccc([N+](=O)[O-])cc1Br	779145168	IJBHLDGCORAFKI-UHFFFAOYSA-N	433.240	1.971	50	20	IDGD	
O=C(CCCOc1ccc2c(c1)NC(=O)CC2)NNC(=O)[C@H]1COc2ccccc2O1	781845931	DZNJSIULSVZVDX-LJQANCHMSA-N	425.441	1.718	50	20	IDGD	
COC(=O)c1ccc(NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c(OC)c1	782079615	JCZMKKZLKMNQDC-UHFFFAOYSA-N	425.401	1.195	50	20	IDGD	
CCOc1cc(N2CCOC(C)(C)C2)ccc1NC(=O)C(=O)NNC(=O)c1cccn1C	782120041	DLAWKGXUBHTEME-UHFFFAOYSA-N	443.504	1.439	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2cccc(OCc3cccc(C#N)c3)c2)CCS(=O)(=O)C1	783424877	GFVAXOIEPIBBGP-NRFANRHFSA-N	442.497	1.274	50	20	IDGD	
CCc1noc(-c2cc(Cl)ccc2NC(=O)C(=O)NN[C@@]2(C)CCS(=O)(=O)C2)n1	783427173	QOZKRXIOMSHDCP-KRWDZBQOSA-N	441.897	1.089	50	20	IDGD	
COc1cc(Br)cc(NC(=O)C(=O)NNc2ccc(-n3cccn3)nn2)c1	783432567	AMCKYAVXRJEXKN-UHFFFAOYSA-N	432.238	1.515	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNc2ccc(-n3cccn3)nn2)cc(OC)c1C(C)C	783432791	CYUXARFRVQTEEU-UHFFFAOYSA-N	425.449	1.885	50	20	IDGD	
COc1ccc(-c2nn(CCC#N)cc2/C=C(\C#N)C(=O)NCc2cn(C)nn2)cc1OC	783619385	WIVHIFQWELHWAK-CXUHLZMHSA-N	446.471	1.833	50	20	IDGD	
O=C(CSc1nnc(O)nc1O)NN=Cc1cn(-c2ccc(Cl)c(Cl)c2)nn1	783820753	IUSOANSADBQPPC-UHFFFAOYSA-N	441.260	1.413	50	20	IDGD	
Cc1c(NNC(=O)C(=O)Nc2ccccc2C(=O)N2CCOCC2)cccc1[N+](=O)[O-]	784358357	UDHNLTYGCATPLE-UHFFFAOYSA-N	427.417	1.457	50	20	IDGD	
O=C(NNc1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(C(=O)NCC(F)(F)F)cc1	784833755	NITRGOIMOQCPCF-UHFFFAOYSA-N	425.323	1.969	50	20	IDGD	
CCOC(=O)c1cn(C)nc1NC(=O)C(=O)NNc1c(F)cc(F)cc1Br	785010812	KMBDUEWBZYZBDQ-UHFFFAOYSA-N	446.208	1.719	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)Nc1c(F)c(F)c(F)c(F)c1F	785023566	LJPWOJUKSHNKRD-UHFFFAOYSA-N	434.233	1.396	50	20	IDGD	
Cn1ccnc(NNC(=O)C(=O)Nc2ccc3c(c2)CN(C(=O)OC(C)(C)C)CC3)c1=O	785090417	RKDLDNRSGFRGNM-UHFFFAOYSA-N	442.476	1.155	50	20	IDGD	
CC(C)CN1C[C@@H]2CN(C(=O)NNC(=O)c3cc(Br)c[nH]3)CCN2C1=O	787734426	DEPUUPNLYJXPOP-LBPRGKRZSA-N	427.303	1.209	50	20	IDGD	
Cn1nc(-c2ccc(F)cc2F)cc1NC(=O)C(=O)NNC(=O)c1ccc(Cl)nc1	789733334	JBOXMSDTDNXKBH-UHFFFAOYSA-N	434.790	1.813	50	20	IDGD	
O=C(NNc1nc2ccccn2n1)[C@H]1CCC[C@H](C(=O)NNc2nc3ccccn3n2)C1	791242847	LHAXAOKFWFZRBU-KBPBESRZSA-N	434.464	1.165	50	20	IDGD	
Cn1c(NNC(=O)[C@](C)(O)Cn2cc(C(F)(F)F)ccc2=O)nc2ccccc2c1=O	792177480	DUBGEFSQQGNUPQ-GOSISDBHSA-N	437.378	1.008	50	20	IDGD	
CC(=O)Nc1cc(S(=O)(=O)NNC(=O)CNC(=O)OCc2ccccc2)ccc1C	794599058	UPHCLSRCUAKOHD-UHFFFAOYSA-N	434.474	1.189	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=S)NCCCCC(F)(F)F)c1	794965272	BFGSREDMPKCLOY-UHFFFAOYSA-N	426.486	1.778	50	20	IDGD	
COc1ccc(N2C[C@H](C(=O)NNc3ccccc3S(=O)(=O)N(C)C)CC2=O)cc1	795161928	TULGDMOWYJACGP-CQSZACIVSA-N	432.502	1.442	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)c1ccc(S(=O)(=O)C(F)F)cc1	795180709	AJWBHDXSOIOKKG-UHFFFAOYSA-N	433.458	1.690	50	20	IDGD	
COC(=O)c1cc(F)c(Br)cc1NC(=O)C(=O)NNc1ncncc1Cl	797029780	KRBWGXPQSOQFBF-UHFFFAOYSA-N	446.620	1.900	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)N[C@H](Cn1ccccc1=O)c1ccccc1	799912536	WVGCPHHHMPHOJB-MRXNPFEDSA-N	439.497	1.412	50	20	IDGD	
O=C(NNC(=O)N1CCC(N2CCc3ccccc32)CC1)C1CCN(c2ncccn2)CC1	799918573	SZUUJAUSEWJYQR-UHFFFAOYSA-N	449.559	1.961	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)CNC(=O)c1ccc(F)cc1	801939505	FCTZGJAEFWYQFO-UHFFFAOYSA-N	437.811	1.222	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCCC[C@H]2C)cc1C(=O)NNC(=O)N=c1cc[nH]cc1	802034202	DKQCXOTZJJULSK-OAHLLOKOSA-N	431.518	1.842	50	20	IDGD	
C=C1c2ccccc2C(=O)N1[C@@H](C)C(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	802066274	SFFWVICNISKJTD-ZDUSSCGKSA-N	428.470	1.758	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2CCN(c3ccc(C#N)cc3F)C2)c1	804252825	QKIDTLUUSDWJSF-OAHLLOKOSA-N	430.461	1.388	50	20	IDGD	
CS(=O)(=O)c1cc(C(=O)NNc2ccc(-n3ccnc3)nn2)ccc1Br	804954675	MPCATYAXGVLZOG-UHFFFAOYSA-N	437.279	1.585	50	20	IDGD	
CC1(C)CC(=O)c2cc(NC(=O)C(=O)NNC(=O)CCOc3ccccc3)ccc2O1	806977432	JJVXJGVGIVEZLF-UHFFFAOYSA-N	425.441	1.985	50	20	IDGD	
Cc1cccn(Cc2c(F)cccc2NC(=O)C(=O)NNc2nccnc2Cl)c1=O	807009834	SQQWGPWVCMNGFA-UHFFFAOYSA-N	430.827	1.869	50	20	IDGD	
CN1CCN(C(=O)NNC(=O)[C@@H]2CCCN2C(=O)c2ccc3ccccc3c2O)CC1	807379966	KSPGGDIIVCJCDP-SFHVURJKSA-N	425.489	1.138	50	20	IDGD	
CSc1cnn(-c2ccccc2)c1NC(=O)C(=O)NNc1ccc(-n2ccnc2)nn1	807429424	RFPGBNWISONIKQ-UHFFFAOYSA-N	435.473	1.652	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2O)nn1-c1ccc(F)cc1F	808935062	HGSPZYIVHKPSMR-UHFFFAOYSA-N	445.382	1.329	50	20	IDGD	
CNC(=O)c1cc(Oc2ccc(NC(=O)C(=O)NNC(=O)C3CCCC3)cc2F)ccn1	810384140	DSVKFIHAJVOBKT-UHFFFAOYSA-N	443.435	1.649	50	20	IDGD	
COC[C@@]1(C(=O)NNc2nc3ccccc3c(=O)n2C)CCN(C(=O)OC(C)(C)C)C1	810398325	ATINBXLJSQGVCL-OAQYLSRUSA-N	431.493	1.650	50	20	IDGD	
N#Cc1cccc(S(=O)(=O)NCC(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)c1	810563283	BZKAODUTKJFWKM-UHFFFAOYSA-N	449.439	1.150	50	20	IDGD	
C[C@H]1CCCN(c2cc(C(=O)N3CCN(S(=O)(=O)CBr)CC3)ccn2)C1	812545279	ZHDDWVSHYZCTMI-AWEZNQCLSA-N	445.383	1.758	50	20	IDGD	
COC(=O)C[C@@H]1COCCN1C(=O)CCC(=O)C(C#N)=C1N(C)c2ccccc2N1C	813664949	CSIDTDGXQBCQQE-OAHLLOKOSA-N	426.473	1.448	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)Nc1cccc(C(=O)N2CCOCC2)c1	814597837	GXBJZSRZTOPBKC-UHFFFAOYSA-N	447.517	1.558	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCc2nncn2C1)C(=O)Nc1cccc(N2CCCCCC2)c1	815692311	OGARCMFOGMVUIE-OAHLLOKOSA-N	425.493	1.007	50	20	IDGD	
Cc1cc(N2CCCC2)ccc1NC(=O)C(=O)NNc1ccccc1S(=O)(=O)N(C)C	815751417	ZGMGWOMSVCGUEV-UHFFFAOYSA-N	445.545	1.927	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1ccccc1OC(F)(F)F	815752425	RLFSPJWWTPVCPO-UHFFFAOYSA-N	446.407	1.917	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCO1)C(=O)Nc1ccc(OC(F)(F)F)c(Br)c1	815778458	RWTORBNBBUSLKA-SNVBAGLBSA-N	440.172	1.613	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1	825785821	BJNZUMDWRSQDTM-UHFFFAOYSA-N	432.502	1.353	50	20	IDGD	
CCN(CCCNC(=O)NNC(=O)c1csc(N2CCOCC2)n1)c1ccccc1	913635930	IOPDXHYGTHKHCU-UHFFFAOYSA-N	432.550	1.840	50	20	IDGD	
C[C@@]12CCC(=O)N1c1ccccc1C(=O)N2CC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	914831955	WZDMFQGUVGQXTF-NRFANRHFSA-N	437.412	1.355	50	20	IDGD	
CC(C)c1cccc(OCC(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1	914875613	BBJYELLHMDNRGI-IBGZPJMESA-N	428.441	1.719	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)N2CCC[C@@H]2C(=O)NNC(=O)c2ccccc2C)o1	915062508	RRSJJWGGMOLZAN-OAHLLOKOSA-N	449.485	1.379	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2sccc2Br)ccc1Cl	916133492	SIYYBURHXMPEKP-UHFFFAOYSA-N	438.712	1.886	50	20	IDGD	
CC(C)(C)c1ccc(C(=O)NNC(=O)NCCCN2CCN(c3ncccn3)CC2)cc1	916267077	YIJAMMNFTYHRGR-UHFFFAOYSA-N	439.564	1.930	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)NC[C@H](c2ccccc2)N2CCOCC2)c1	916508620	BNRHPRWMOFWARG-HXUWFJFHSA-N	428.489	1.721	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NCCCC(=O)NC2CC2)c2ccccc2c1=O	916577629	SIQXOCKZYXWTSV-UHFFFAOYSA-N	428.493	1.199	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)NCCS(=O)(=O)NCc2ccccc2)c2ccccc21	916645448	WDVLCLKIBCISAF-UHFFFAOYSA-N	429.502	1.242	50	20	IDGD	
CCCn1c(C)cc(/C=C(/C#N)C(=O)OCC(=O)N2CCN(CC(=O)N(C)C)CC2)c1C	917226949	VRCWCOYMAAADLW-MOSHPQCFSA-N	443.548	1.198	50	20	IDGD	
Cc1ccc([C@@H](CNC(=O)NNC(=O)c2ccc3c(c2)OCCO3)N2CCOCC2)cc1	918099485	PDHSENWPFFLNDF-LJQANCHMSA-N	440.500	1.784	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)NCCNC(=O)c2ccc(Br)cc2)c1	918141139	KIWNBJQTHDHOOO-UHFFFAOYSA-N	448.321	1.889	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCC(C)(C)N2CCC[C@H](C)C2)c2ccccc2c1=O	919797742	SOBSKRLKTZEJGW-HNNXBMFYSA-N	428.537	1.871	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCC(NC(=O)NC3CCCCC3)CC2)n1	919803115	SWOVPGUDWFUDSC-UHFFFAOYSA-N	436.582	1.238	50	20	IDGD	
NS(=O)(=O)c1ccc(NC(=O)NNC(=O)Nc2ccc(Br)cc2)cc1	919898701	JAWTTZAVJZDQNM-UHFFFAOYSA-N	428.268	1.955	50	20	IDGD	
Cc1cc(Cl)c(C)c(S(=O)(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)c1Cl	919960920	LSVKVFUCTVDVHU-VIFPVBQESA-N	430.335	1.290	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNC(=O)N[C@H]2CCCN(S(C)(=O)=O)C2)cc1	920238481	FOCCXCNKIHTZBU-INIZCTEOSA-N	426.539	1.480	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NCc2cccc(C(=O)N3CCOCC3)c2)cc1	920811429	ICMZDAHCHAJDBS-UHFFFAOYSA-N	442.472	1.077	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)NNC(=O)NCc1cccc(C(=O)N2CCOCC2)c1	920812148	VDCDVHQXXJXZPY-UHFFFAOYSA-N	435.484	1.713	50	20	IDGD	
Cc1c(C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)ccc2cncn12	1337567966	WUSORZCAJDAERW-UHFFFAOYSA-N	440.935	1.875	50	20	IDGD	
CC[C@@H](NC(N)=O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@](C)(Cl)CCl)C2	1777983706	NTQWRBWGKXCRNQ-COCCGSRQSA-N	437.368	1.184	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)C/N=C/c3ccco3)C2)C1	1779133332	YAGPSWAPGVDQHN-VBZSBEMESA-N	426.311	1.559	50	20	IDGD	
O=C(/C=C/C(=O)N1CC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2)NCc1ccco1	1779211232	LUOGEIJSQPHFTL-WHLIDYPQSA-N	430.288	1.086	50	20	IDGD	
CC(C)=CCCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnccc1C(=O)NN)C2	1780655004	HKEMLARMXBNKSY-AUSIDOKSSA-N	443.548	1.559	50	20	IDGD	
Cc1nccnc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Br)C1	1780773714	MUEGCAMBOOZXTC-SUYBPPKGSA-N	429.290	1.603	50	20	IDGD	
CC(C)n1cnc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](F)Br)C2)n1	1780773866	ZBKWXDUBZGTKSD-PBFPGSCMSA-N	446.321	1.677	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)COc1cccnn1)C2)[C@@H](F)Br	1780777011	KFJKPFWXJLGDTQ-SRCQZFHVSA-N	445.289	1.060	50	20	IDGD	
COc1c(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](O)CCl)C3)ccc(F)c1F	1781040875	SYFLCYMZXLIODZ-STXHMFSFSA-N	446.878	1.701	50	20	IDGD	
CCOC(=O)N1CCC(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](Cl)CC)C3)C2)CC1	1781224475	WNMZRHBFFFKALD-OXJNMPFZSA-N	429.945	1.702	50	20	IDGD	
CC(C)(C)n1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)cn1	1781326744	SFHYAQZULZDYQV-CXAGYDPISA-N	431.306	1.772	50	20	IDGD	
CO[C@@H](C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1)c1ccccc1	1781328589	TVXHLHHTTUHZTN-IIDMSEBBSA-N	429.286	1.895	50	20	IDGD	
O=C(CS[C@@H]1CCCCO1)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781331482	LJHQRYTUPZXQAX-YCPHGPKFSA-N	439.347	1.767	50	20	IDGD	
CN1CCCn2nc(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)[C@@H](F)Cl)C4)cc2C1	1781428864	PHIUMHWZLMMOCD-MBOZVWFJSA-N	441.935	1.381	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H]1CCCO1)CCO2	1782864361	LINKCCBSSGJOOD-WFCRQVQFSA-N	431.439	1.881	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccnc(C(F)(F)F)c3)CCO2)C1	1783873048	JCWLSKPGZKGROP-CXAGYDPISA-N	435.830	1.798	50	20	IDGD	
CCn1nc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](Cl)COC)C3)C2)c2ccccc21	1783874806	HKPKGDQOBLILJE-IERDGZPVSA-N	434.924	1.754	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cnn(Cc4ccccc4)c3)CCO2)C1	1783877702	NOSZPTOUHHSMAK-DENIHFKCSA-N	446.935	1.629	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN3CCCCC3=O)C[C@@H]21	1783974269	JZFXFUKQVKWYBR-UGUYLWEFSA-N	444.370	1.010	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3c[nH]c4ccccc34)C[C@@H]21)[C@H](O)CCl	1784089588	GIKZKTRHQGQUHT-UUXHPUJUSA-N	433.936	1.680	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3c[nH]c4nccc-4c3Cl)C[C@@H]21)[C@@H](O)CCl	1784090789	MXVUUXWNSOBGBT-HJPIBITLSA-N	441.315	1.361	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3occc3Br)C[C@@H]21)[C@@H](O)CCl	1784091124	VWJYMMRDCXAGNV-UKJIMTQDSA-N	435.702	1.235	50	20	IDGD	
Cc1nccn1CCCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2	1784412018	PMSMSEGDFPBZOG-RDTXWAMCSA-N	427.343	1.585	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CC[C@H]4CCC(=O)N4C3)C[C@@H]21	1784620666	GIONWGYYPLZDRL-DYKIIFRCSA-N	439.984	1.775	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)Cc3ccc(O)cn3)C2)C1	1784637478	GXBZDVDFQVVPEA-SCLBCKFNSA-N	426.311	1.191	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@](C)(O)C(F)(F)F)[C@H]2C1	1784877512	PXBJDNQXIYRQBB-HJHSNUOESA-N	445.276	1.453	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3snnc3C3CC3)C[C@@H]21	1786406759	BCUUYDGSECXYRY-AVGNSLFASA-N	443.367	1.794	50	20	IDGD	
C[C@H]1CCc2c(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)[C@H](F)Br)C[C@@H]43)n[nH]c21	1787952780	WNTJLMDJVBFJCZ-UQMYLEDRSA-N	443.317	1.743	50	20	IDGD	
Cc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](O)CCl)C[C@@H]32)nc2ccccc12	1787967938	BQTFXABEAWWSSR-UQOODKLHSA-N	431.920	1.736	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC1(c2ccc(NC(=O)c3cn4cccnc4n3)cc2)CCC1	1789266880	KPXWVDQSCBDGJA-UHFFFAOYSA-N	449.515	1.850	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CSCc3[nH]cnc3C)C[C@@H]21	1789863021	AZKNSTXMHUTUEI-MPTYRVRUSA-N	428.986	1.948	50	20	IDGD	
O=C(CN1C(=O)CNC1=O)NC1(c2ccc(NC(=O)[C@@H](F)Br)cc2)CCC1	1790531975	KGQDYFKKVJJSIS-CQSZACIVSA-N	441.257	1.363	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cn(C(C)(C)C)nn3)C[C@@H]21	1791058890	LJLCLSHTKSVSJY-ABHRYQDASA-N	442.358	1.410	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccnc4ncccc34)C[C@@H]21	1791257144	QQVHLDUSPNPJOU-MGHWNKPDSA-N	432.908	1.477	50	20	IDGD	
CCN1CCC(C(=O)Nc2ccc(C3(NC(=O)c4cccc(B(O)O)c4)CCC3)cc2)CC1	1792356504	RGHBIRCXLBSKCO-UHFFFAOYSA-N	449.360	1.846	50	20	IDGD	
CCOc1ncccc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2	1792379535	CEBJFRBBTAWECO-ZMJPVWNMSA-N	430.274	1.374	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1(c2ccc(O)cc2)CC1	1793025608	DFSBMFDNFBVWJA-CWPLJXCYSA-N	432.593	1.865	50	20	IDGD	
COc1cccnc1CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2	1794031680	QOWFYDLYXMJBAU-CZAMWMTLSA-N	444.301	1.303	50	20	IDGD	
Cc1ccc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Br)C3)cn1	1794049319	VOJOFTNPPRHAHU-YALNPMBYSA-N	428.302	1.603	50	20	IDGD	
COc1ncc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@](C)(Cl)CCl)C3)cc1F	1794364899	VTIOPTPXAIKAKJ-AZGFTEDZSA-N	434.295	1.669	50	20	IDGD	
C[C@@H](Nc1cccnc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@](C)(Cl)CCl)C2	1795605660	JOSWZMUASBRAQD-HUYPOWGKSA-N	429.348	1.708	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(Cl)nc2n[nH]cc12	1796057228	GSQMHKDOFZJBDE-YJKIEOBBSA-N	442.303	1.068	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1Cc2ccccc2CN1	1796371901	KUSOKQIMWXHLNK-RCLSDMTESA-N	431.609	1.142	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccn3cncc3c1)C2	1796892611	XCOFBOATXAQRLT-MVUGMWCJSA-N	447.499	1.720	50	20	IDGD	
C[C@@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CO[Si](C)(C)C)C2)N1CSCSC1	1797844565	CTSQNDVDFQAWLZ-MPTYRVRUSA-N	447.699	1.471	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3ncncc3c1)C2	1797956736	BICYZIZMCLRIBW-XEMDLRDOSA-N	428.565	1.685	50	20	IDGD	
COc1nc(C)ccc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2	1798245341	SANOBUPIEZGOGC-YWVIFJGQSA-N	426.311	1.387	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc3ncccc13)C2	1798440151	DWUNYRCBBPHJMF-MUJYYYPQSA-N	444.495	1.799	50	20	IDGD	
CC(C)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(-n2ccnc2)ccn1	1798726814	PHELVZYREZGBEM-JLVBRIDZSA-N	431.924	1.736	50	20	IDGD	
COc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@](C)(Cl)CCl)C3)c(O)c1	1798836012	MIHMTKMINBAHGP-JZGBQWHFSA-N	431.316	1.840	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccc2ncnn2c1	1799083889	ARJXCJAPTJXTKF-QOIYZWAUSA-N	440.331	1.098	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C#CC1(O)CCCCC1)C2	1799277511	WKUWWHHERIHXCP-LORHWOILSA-N	431.360	1.511	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1Cc3ccccc3N1)C2)[C@H](F)Br	1799346539	BKXXBEMORGCUJS-URLPEUOOSA-N	426.286	1.303	50	20	IDGD	
CC1(C)CCC(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cccc(B(O)O)c2)C3)CC1	1799397044	ISNGPHSGUFHSLI-HATOLVCRSA-N	442.365	1.176	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc(O)cn1)C2	1800644190	MTKPKGADWNFIOC-DJZPMSPPSA-N	426.311	1.093	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1n[nH]c3c1CC[C@@H]3C)C2	1800757049	HJMIEXGYQOBUNY-NAYUARGSSA-N	425.327	1.446	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1cc(F)ccc1F	1804103145	ADVHPZGSJQVJFT-MUJYYYPQSA-N	443.454	1.458	50	20	IDGD	
Cc1cc(CC(=O)N2CCCC3(CCN(C(=O)c4cnccc4C(=O)NN)CC3)C2)on1	1806769696	PSRBSDMIMNPBHZ-UHFFFAOYSA-N	440.504	1.069	50	20	IDGD	
C=C(C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)C(F)(F)F	1807374056	WWKDTXWILDMVKI-WMZOPIPTSA-N	447.222	1.200	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC2(CCCN(C(=O)c3ncc[nH]3)C2)CC1	1807816748	QWDOMKWNODEBCN-MFKUBSTISA-N	425.493	1.389	50	20	IDGD	
O=C(CS(=O)(=O)N1CCCC1)NC[C@@H]1CCN(C(=O)[C@H](F)Cl)[C@@H]1c1cccnc1	1808414931	VWCWDKBAJNXOMA-UAGQMJEPSA-N	446.932	1.047	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2csnn2)[C@@H]1c1cccnc1)[C@H](F)Br	1808649187	LDDXJTHNIVQZCG-UHTWSYAYSA-N	428.287	1.943	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1cccc(F)c1	1811800837	PZWVTZRSIPJGPC-UGKGYDQZSA-N	447.275	1.534	50	20	IDGD	
COCCOCCOCCC(=O)NC[C@@H]1CCN(C(=O)[C@H](F)Cl)[C@@H]1c1cccnc1	1812932390	XURSEBGHFQGNEK-UHOSZYNNSA-N	445.919	1.692	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)COc2cccnc2)[C@H]1c1cccnc1	1813028842	WUUDMKXPNVXAOR-QRFRQXIXSA-N	432.908	1.815	50	20	IDGD	
O=C(/C=C\C(=O)N1CC[C@@H](CNC(=O)C(Cl)Cl)[C@H]1c1cccnc1)NC1CC1	1813076906	BGWYUOBDSNAWTH-MZVVEVKISA-N	425.316	1.726	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H](CNC(=O)CSCC(=O)O)[C@H]1c1cccnc1	1813086103	GPDJTOIYOPCVOS-DNVCBOLYSA-N	439.610	1.757	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2nn[nH]c2C(F)(F)F)[nH]n1)[C@@H](O)CCl	1814873482	OMKKEOKZHAXAIL-IUCAKERBSA-N	435.794	1.452	50	20	IDGD	
CC(C)(C)OCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1815591699	XLCVAPVGXDFJBE-KRWDZBQOSA-N	428.298	1.211	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)Cc2ccncc2)n[nH]1	1820720973	ABOZLIBYTDBQFR-QGZVFWFLSA-N	427.509	1.413	50	20	IDGD	
CNC(=S)NCCC(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](F)Br)n[nH]1	1820934979	DWSUFBASWNUKBK-GXFFZTMASA-N	449.350	1.576	50	20	IDGD	
C[C@H](Br)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](C)CS(C)(=O)=O)[nH]n1	1822183679	GIOPZFDJLXOLHZ-NTZNESFSSA-N	449.371	1.866	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)CCc2cn[nH]c2)[nH]n1	1822410729	ROPVTNGWVIUAMX-MRXNPFEDSA-N	430.513	1.131	50	20	IDGD	
Cn1ccc(=O)cc1C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1	1823006398	FBNWAIIAEBQYFD-AMIZOPFISA-N	443.298	1.758	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1[nH]nc3ncccc13)CC2	1825997948	DROYTGYGMIIPPY-ONGXEEELSA-N	434.909	1.894	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)COc3cccnn3)sc2C1	1826765067	HXJCZIAOAWMASX-ZJUUUORDSA-N	440.323	1.708	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cnc(N)s2)CC1	1826998615	PSKNQEAHRUADCL-HNNXBMFYSA-N	436.582	1.332	50	20	IDGD	
Cc1nccnc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827052172	BMWOXPRUUOUORR-FQEVSTJZSA-N	436.321	1.012	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)c2ccc(F)nc2)CC1	1829192051	NBZKAMXARAIKEH-HXUWFJFHSA-N	439.296	1.448	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccnc(F)c3)C2)C1	1830534588	CDFQIXFQLPXWEV-FZKQIMNGSA-N	444.301	1.322	50	20	IDGD	
Cc1nc(C)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)s1	1834075042	CJTRALCJPJXXSC-LJQANCHMSA-N	441.626	1.681	50	20	IDGD	
O=C(Cc1noc2ccccc12)NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1834815498	JOWITPKXVMRKJD-LJQANCHMSA-N	448.951	1.542	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccc4c(c3)OCO4)CCO2)C1	1835171293	WIFJRFFQHQOMHE-IIBYNOLFSA-N	438.908	1.432	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C1(C(F)(F)F)CCC1)CCO2	1835473864	BDUPRBODUHGAIK-CZUORRHYSA-N	442.862	1.429	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)/C=N/N3CCCCC3)CC2)CC1	1835732523	GQLXJXIZKUQWFV-CKMDTHJYSA-N	442.004	1.284	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CNc3ccccc3C)CCO2)C1	1835866912	MVDPKSCXCQTOKU-LAUBAEHRSA-N	439.940	1.117	50	20	IDGD	
CC(=O)N(C)CCC(=O)N1CCC(OC2CCN(C(=O)CCBr)CC2)CC1	1837040166	JCPIWZRAJFFCKB-UHFFFAOYSA-N	446.386	1.638	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cn4ccsc4n3)CCO2)C1	1837049117	PSZMBTZWOAYKKT-FZKQIMNGSA-N	426.926	1.483	50	20	IDGD	
COc1cccc(C(=O)N2CCOC[C@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)n1	1837712406	OXOAIMYVPAHXGC-FQEVSTJZSA-N	437.569	1.012	50	20	IDGD	
Cc1ncc(C(=O)N2CCOC[C@@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)s1	1837713344	YALOYBAMMRPGGQ-GOSISDBHSA-N	427.599	1.373	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCC(OC2CCN(C(=O)[C@@H]3CCC(=O)N3)CC2)CC1	1837737652	FDUGUVDKMUYDOZ-HNAYVOBHSA-N	434.364	1.500	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)Cc3ccn(C)n3)CC2)CC1	1837948935	DWJQJGZRHZXCMT-SFHVURJKSA-N	426.945	1.215	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3ccc(O)nc3)CC2)CC1	1838541243	DCSAPZYXDMPSNX-KRWDZBQOSA-N	425.913	1.653	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)ccc1F	1839321229	PSOLUCBFUYWMQG-CRAIPNDOSA-N	447.276	1.895	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccsc3)C2)C1	1840031897	GJPGKDOZJRVLSZ-CXAGYDPISA-N	431.352	1.530	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C)c(O)c(C)c3)C2)C1	1840156046	HRFPXDBARJVXFE-DYESRHJHSA-N	440.924	1.333	50	20	IDGD	
O=C(CCc1ccc(F)nc1)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840186979	YAINJQFNHDBDPU-GOSISDBHSA-N	434.295	1.413	50	20	IDGD	
O=C(c1cc(-c2cc[nH]n2)n2ccccc12)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1	1841351196	IVMDJPJEOQZWQJ-SFHVURJKSA-N	427.892	1.746	50	20	IDGD	
Cn1nc(C(F)(F)F)cc1C(=O)N1CCCC12CN(C(=O)[C@@H](F)Br)C2	1844509051	FBNOYEYSWGGWQV-SNVBAGLBSA-N	427.196	1.946	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@H]1[C@H]3CN(C(=O)OC(C)(C)C)C[C@H]31)C2	1846364837	MLRWUQXAZWMHGE-QKPAOTATSA-N	441.956	1.557	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc(-c2ccccc2)on1	1847198248	DJYWQWXSRZNLDC-ROUUACIJSA-N	425.489	1.530	50	20	IDGD	
C[C@@H]1CC[C@@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](O)CCl)CN1C(=O)OC(C)(C)C	1847240974	RXAUFWLATLPNLU-NRKLIOEPSA-N	443.972	1.824	50	20	IDGD	
CN(CC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H]1CCCCO1)NC(=O)NCc1ccccc1	1847313654	QZGOOELASRXSJF-UFYCRDLUSA-N	443.548	1.104	50	20	IDGD	
Cc1csc(=O)n1CCC(=O)NNC(=O)[C@H](C)Oc1cccc(Br)c1	14937234	DOSDNUOORJMXAP-NSHDSACASA-N	428.308	1.986	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C(C)C)c2)c1	15925776	YRSAAURUSLKPNU-UHFFFAOYSA-N	435.502	1.808	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)cc1	16509644	IFCJMCMXEQDPMU-UHFFFAOYSA-N	447.513	1.110	50	20	IDGD	
CCOc1ccc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)Cn3cccn3)cc2)cc1	27066661	PGMFYBDAMHHACI-UHFFFAOYSA-N	443.485	1.544	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)[C@@H]2CCCN(C(=O)c3ccc(F)cc3)C2)cc1	196486254	MJSZETXSCXYSBR-MRXNPFEDSA-N	428.464	1.946	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)c1cccc(OCc2cn3ccccc3n2)c1	725741993	YISISOHKMYFSON-UHFFFAOYSA-N	433.424	1.697	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@@H]2CCOc3c(OC)cccc32)c2ccccc2c1=O	726274547	RGVHCOVCCGXVMW-MRXNPFEDSA-N	437.456	1.893	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NCc1ccc([C@]2(C)NC(=O)NC2=O)cc1	726283127	WZSKBZPBPITBCO-QKVFXAPYSA-N	443.435	1.178	50	20	IDGD	
CC[C@H](Cc1ccccc1)NC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1	727943447	FFZVSFGESXBESW-GOSISDBHSA-N	432.546	1.967	50	20	IDGD	
CN(C)N(C(=O)c1ccc(Cl)c(S(=O)(=O)N2CCCC2)c1)[C@H]1CCS(=O)(=O)C1	728175592	CNHJYDRIMCFZNR-AWEZNQCLSA-N	449.982	1.230	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)c2ccccn2)cc1NC(=O)c1ccccn1	728501234	IBTDTLNPRCGAOT-UHFFFAOYSA-N	427.442	1.361	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2cc(C)nc3onc(C(C)C)c23)n1	728731349	QDNOQZYYJRUAKA-UHFFFAOYSA-N	431.474	1.966	50	20	IDGD	
CCC(CC)[C@H](CNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)N1CCOCC1	728944199	OMESOXZJRRGRIC-IBGZPJMESA-N	447.584	1.160	50	20	IDGD	
O=C(NCc1ccc(N2CCCC2=O)cc1)NNC(=O)C1CCN(c2ncccn2)CC1	728945270	ZAOMPBCFEQNEJT-UHFFFAOYSA-N	437.504	1.350	50	20	IDGD	
O=C(CCn1c(=O)nc(O)c2ccccc21)NNc1ccc(S(=O)(=O)C(F)F)cc1	728974431	NPNUVCZAJBKKDD-UHFFFAOYSA-N	438.412	1.632	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C1=NN(Cc2ccc(F)cc2)C(=O)CC1	729297359	HVZISYNXPVICQT-UHFFFAOYSA-N	428.420	1.539	50	20	IDGD	
CNS(=O)(=O)c1cccc([C@@H](C)NC(=O)NNC(=O)Cn2ccc3ccccc32)c1	729610743	ZHJACYSSFQLPBJ-CQSZACIVSA-N	429.502	1.641	50	20	IDGD	
Cc1ccc(NNC(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)nn1	730024859	RSXMRSKBPJCAJA-UHFFFAOYSA-N	437.483	1.867	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1cccc(Br)c1O	730104010	NZTZENDGKCFPTR-UHFFFAOYSA-N	441.307	1.831	50	20	IDGD	
CCN(C)c1ccccc1CNC(=O)NNC(=O)c1sc(N2CCOCC2)nc1C	730135960	QECXHSVYWWMFBY-UHFFFAOYSA-N	432.550	1.888	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)Cc2cccc(NS(C)(=O)=O)c2)cc1F	730290091	GRACKVVBFYYNHI-UHFFFAOYSA-N	426.495	1.766	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)Nc1cccc(C(=O)N2CCSCC2)c1	730900209	WQKIYYQRGOVBDO-UHFFFAOYSA-N	430.486	1.813	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN(C(=O)c2ccccc2)C1)c1nn(-c2ccccc2)cc1O	731224425	YNDKZEMXFNPICN-QGZVFWFLSA-N	433.468	1.891	50	20	IDGD	
Cc1noc(C)c1S(=O)(=O)N1CCC(C(=O)NNC(=O)NC2CCCCC2)CC1	731580515	MGHNCCYKQXUGDZ-UHFFFAOYSA-N	427.527	1.355	50	20	IDGD	
O=C(NNC(=O)[C@H](O)c1cccnc1)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	731866153	RBVMIXUJBIPPIJ-LJQANCHMSA-N	429.440	1.278	50	20	IDGD	
CC(CCCOc1ccccc1C(N)=O)=NNC(=O)Cc1csc(N2CCOCC2)n1	731924900	MNIXMBDWYNTTDE-UHFFFAOYSA-N	445.545	1.972	50	20	IDGD	
Cn1ccnc1[C@](O)(CCNC(=O)NNC(=O)NCc1ccc(Cl)cc1)C(F)(F)F	732996749	OCBUKWWSVIZFMH-MRXNPFEDSA-N	448.833	1.927	50	20	IDGD	
Cn1c(=NNC(=O)NCC2CCN(S(=O)(=O)C(F)F)CC2)sc2ccccc21	733045782	UJDMTNJEJDJPHC-UHFFFAOYSA-N	433.506	1.619	50	20	IDGD	
CCn1c(=O)nc(O)c2c(C(=O)NNc3nc4ccccc4c(=O)n3C)cc(C(C)C)nc21	733263435	AWPZBBZPPZWNEZ-UHFFFAOYSA-N	449.471	1.644	50	20	IDGD	
COC(=O)c1cc(NC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc(C(=O)OC)c1	733332918	SIFBNDBPYRBLAS-UHFFFAOYSA-N	437.412	1.912	50	20	IDGD	
CC(C)[C@@H](CNC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)NC(=O)OC(C)(C)C	734517633	RHRFVUWMRPNKFW-OAHLLOKOSA-N	432.485	1.156	50	20	IDGD	
C=CC[C@H](NC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1)c1ccncc1	734678175	FIPZGYZTUATCDR-SFHVURJKSA-N	431.518	1.658	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)N[C@@H](C)CN2CCN(c3ccccn3)CC2)c1	735588030	YRAJUDQYGVJUAF-IBGZPJMESA-N	440.548	1.618	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N1CCS(=O)(=O)[C@@H](C)[C@@H]1C	736372212	DTAXGZSASRPYCW-SRVKXCTJSA-N	448.339	1.465	50	20	IDGD	
CS(=O)(=O)[C@@H]1CCC[C@@H](NC(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)C1	741093543	SZFYPNSMUACULD-DGCLKSJQSA-N	443.469	1.962	50	20	IDGD	
CS(=O)(=O)CC[C@@H](Cc1cccc(Br)c1)C(=O)NNC(=O)NCC1CC1	741212078	MPIYWWDTTPIFPU-AWEZNQCLSA-N	446.367	1.783	50	20	IDGD	
O=C(NC[C@@H](O)c1c(F)cccc1Cl)NNC(=O)c1csc(N2CCOCC2)n1	741267047	PYJLSNTXIZXDJN-CYBMUJFWSA-N	443.888	1.450	50	20	IDGD	
CCCCN1C(=O)c2ccc(C(=O)OCC(=O)NNC(=O)c3cccc(C#N)c3)cc2C1=O	741818537	KVKRXOKGQZVFTC-UHFFFAOYSA-N	448.435	1.572	50	20	IDGD	
CCNC(=O)c1ccc(CNC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)cc1	743551166	PWOMLCRBRBEVHT-UHFFFAOYSA-N	433.490	1.376	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2noc(-c3cccc(F)c3)n2)c1	746093741	LUAPQJJHBQDPQI-UHFFFAOYSA-N	433.421	1.201	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)CC[S@@](=O)c2ccc3c(c2)OCCO3)c1	746094938	HUVSPWLFYAXBSZ-SSEXGKCCSA-N	434.470	1.434	50	20	IDGD	
O=C(NN=Cc1cnc2cnc(Br)cn12)C1CCN(c2ncccn2)CC1	746371008	TUWKFSIFFLNQOT-UHFFFAOYSA-N	429.282	1.649	50	20	IDGD	
C[C@@H](CCNC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)N(C)Cc1ccccc1	746772703	BIBVKUOVYKKCOH-INIZCTEOSA-N	436.516	1.788	50	20	IDGD	
CC(=NNC(=O)Cc1csc(N2CCOCC2)n1)c1ccc(NS(C)(=O)=O)cc1	747041921	LAUNAEZHCXRXKY-UHFFFAOYSA-N	437.547	1.434	50	20	IDGD	
N#Cc1ccc(C(=O)NNS(=O)(=O)c2cc(C(=O)O)sc2Br)cc1	747072607	IFZWSYBMVNHEKX-UHFFFAOYSA-N	430.261	1.704	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)[C@H]1CCCN(C(=O)c2ccccc2OC(F)F)C1	747324834	KQNZLCSCUDOVRX-HNNXBMFYSA-N	432.427	1.925	50	20	IDGD	
Cc1ccc2ncccc2c1S(=O)(=O)NNC(=O)C1CCN(c2ncccn2)CC1	748644393	XJBWPWVHRCGUSQ-UHFFFAOYSA-N	426.502	1.559	50	20	IDGD	
O=C(NNc1ccc(OCC(F)(F)F)cc1)[C@H]1CC(=O)N([C@@H]2CCS(=O)(=O)C2)C1	748694907	HEYKEGPPJFGQEB-WCQYABFASA-N	435.424	1.106	50	20	IDGD	
CC(C)(C)NC(=O)CN1CCC(CNC(=O)NNC(=O)Cn2ccc3ccccc32)CC1	751111548	OVFQQNXATBMHNS-UHFFFAOYSA-N	442.564	1.598	50	20	IDGD	
O=C(CC1CCCC1)NC1CCC(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)CC1	751295242	MLCMXUKDSSQWII-UHFFFAOYSA-N	439.520	1.679	50	20	IDGD	
CCOC(=O)[C@@H]1Cc2cc(S(=O)(=O)NNC(=O)C(C)(C)c3ccccc3)ccc2O1	751548284	OUGKXVGVHNXBIL-SFHVURJKSA-N	432.498	1.841	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)N[C@@H]2CCCN(c3cccnc3)C2=O)cc1	753356102	JIJTWMBYSJILFO-MRXNPFEDSA-N	446.489	1.016	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H]2C[C@H](OC)C2(C)C)c1	753549689	HKSKJVPFQXWIDN-CVEARBPZSA-N	426.539	1.475	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)N[C@H]2CCN(c3ccccn3)C2)c2ccccc2c1=O	753728942	DWMGNKFFOMZDLV-INIZCTEOSA-N	449.515	1.815	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)Nc2ccn(CCN3CCOCC3)n2)cc1OC	756647868	WIYZJNDENJHOQS-UHFFFAOYSA-N	432.481	1.089	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)[C@@](C)(O)CN3Cc4ccccc4C3=O)nc21	756830527	LDZHFRRGDQSCSZ-NRFANRHFSA-N	439.476	1.137	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccc3c(c2)C(=O)CCC3)c1	756881301	MTFSHXBEQMCGHL-UHFFFAOYSA-N	430.486	1.922	50	20	IDGD	
C[C@H](NC(=O)OC(C)(C)C)[C@H](C)C(=O)N1CCN(S(=O)(=O)CBr)CC1	757592536	JZNNVNVQKQNNJE-RYUDHWBXSA-N	442.376	1.362	50	20	IDGD	
C#CC[C@H](NC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)c1ccccc1	757775205	JXCFNMHDKHJIHQ-IBGZPJMESA-N	442.545	1.408	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)c1NC(=O)c1ccccc1F	758037121	YJGQXYWXMASTNP-LBPRGKRZSA-N	436.465	1.085	50	20	IDGD	
NC(=O)[C@@H](Cc1ccccc1)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	758143544	OAAHDLGTFAXIOJ-QGZVFWFLSA-N	444.538	1.880	50	20	IDGD	
CN1C(=O)C[C@H](C(=O)NNC(=O)CNC(=O)c2ccco2)[C@@H]1c1ccc(Cl)c(F)c1	758960136	KPYQOEQADMUQSI-GTNSWQLSSA-N	436.827	1.169	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)c1ccccc1)C(=O)NNc1ncccc1[N+](=O)[O-]	759302442	RONUBHWFPUEZIJ-CYBMUJFWSA-N	425.492	1.533	50	20	IDGD	
CC1(C)C(=O)N(C[C@@](C)(O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c2ccccc21	760052856	GJMXOJHVSVCHKH-FDDCHVKYSA-N	439.468	1.049	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NN=Cc2cnc(C3OCCO3)s2)c1	761744536	NETIBNOBCYULFS-UHFFFAOYSA-N	438.531	1.983	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)C(=O)Nc1cccc(OC[C@H]2CCCO2)c1	763446903	YETQAAQGCHSHRG-QGZVFWFLSA-N	428.401	1.552	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cccc(CN(C)C(=O)C(F)(F)F)c2)c(C)o1	763576631	PNRYPWVFELFQRB-UHFFFAOYSA-N	440.378	1.817	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(NC(C)=O)c(F)cc1F	763647884	RTMYIBWUBPHJIP-UHFFFAOYSA-N	436.371	1.097	50	20	IDGD	
CNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)cc1Cl	763745408	DVPWTRYNSXKRMF-UHFFFAOYSA-N	443.891	1.238	50	20	IDGD	
CC(C)n1cc2cc(NC(=O)C(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)ccc2n1	763790626	MARRIZZNNDKSKJ-UHFFFAOYSA-N	447.455	1.264	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)ccc1F	763851869	FYRUEPORMORFRM-CYBMUJFWSA-N	431.420	1.783	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2c(C)cnn2Cc2cc(F)ccc2F)n1	763883140	YJOCJPYRTQTDKD-UHFFFAOYSA-N	445.430	1.117	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cc3c(cc2C)OCO3)cc1OC	763912580	XVSGNAUDGMGHBR-UHFFFAOYSA-N	429.429	1.921	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cc3c(cc2C)OCO3)ccc1OC(C)C	763921249	KMHVFNMKLFGZAM-UHFFFAOYSA-N	429.429	1.919	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(C)cc3)[nH]n2)cc1F	764109952	DUROWIKQLDFZTG-UHFFFAOYSA-N	439.403	1.711	50	20	IDGD	
CN(C)CC(=O)NNC(=O)C(=O)Nc1ccc(Cl)cc1-c1nc(C2CCCC2)no1	764204589	VZFNHCUKTSXCEK-UHFFFAOYSA-N	434.884	1.695	50	20	IDGD	
CSc1nnnn1-c1cccc(NC(=O)C(=O)NNC(=O)CCC2CCCCC2)c1	764209459	BLQPGAGMVJXEPH-UHFFFAOYSA-N	431.522	1.831	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)C(=O)Nc2cc(F)ccc2OC[C@@H]2CCCO2)c1	764235867	SILYPFUZMOCLAR-INIZCTEOSA-N	426.404	1.655	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(OCC(F)(F)C(F)F)nc2)c1	764241884	NPCFHZGXULCGBD-UHFFFAOYSA-N	439.325	1.632	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)Cc2ccccn2)ccc1NC(=O)OC(C)(C)C	764270707	RCKZRMMHQWGVKW-UHFFFAOYSA-N	443.460	1.766	50	20	IDGD	
COc1c(Cl)cc(NC(=O)C(=O)NNC(=O)COc2ccccc2O)cc1Cl	764278630	SLETUTLLXYRYKP-UHFFFAOYSA-N	428.228	1.873	50	20	IDGD	
CCN(CC)C(=O)c1ccccc1NC(=O)C(=O)NNC(=O)c1cnn(-c2ccccc2)c1	764343506	RRSKIUKCSZRCIE-UHFFFAOYSA-N	448.483	1.754	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)[C@H](C)NS(=O)(=O)c2ccc(C#N)cc2)cc1C	764526455	ZODVVKVOJAUBGI-HNNXBMFYSA-N	430.486	1.068	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CSc2ccccc2O)cc1S(=O)(=O)NCC#N	765249071	JNTFVDYUDSPMNF-UHFFFAOYSA-N	434.499	1.056	50	20	IDGD	
O=C(COC(=O)c1ccc(=O)n(-c2ccccc2F)n1)NNC(=O)c1cccc(Cl)c1	766206371	VPXDJUXEMAEYKH-UHFFFAOYSA-N	444.806	1.643	50	20	IDGD	
CCc1ccccc1OCC(=O)NNS(=O)(=O)c1cc(Cl)ccc1OCC(N)=O	766312486	TXRWRTJOVZDMAC-UHFFFAOYSA-N	441.893	1.155	50	20	IDGD	
CC(=NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1)c1cncc(C)c1	767388402	SOWUCPPAMRJNTL-UHFFFAOYSA-N	429.546	1.545	50	20	IDGD	
CC(C)C[C@H](NC(=O)OCc1ccccc1)C(=O)N([C@@H]1CCS(=O)(=O)C1)N(C)C	768127264	PARMAGYKRGKVNY-MSOLQXFVSA-N	425.551	1.820	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)CCc3c(C)nc4nc(N)nn4c3C)n[nH]2)c1	768268465	BPDFCKPSTXLZCE-UHFFFAOYSA-N	447.503	1.724	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2ccc3c(=O)n(-c4ccccc4F)c(S)nc3c2)n[nH]1	768277830	XTWZXDPLBKXPOK-UHFFFAOYSA-N	438.444	1.920	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)CN1C(=O)N[C@]2(CCCC(C)(C)C2)C1=O	768566070	QNCAGPFNULZFNY-ZSEKCTLFSA-N	434.468	1.631	50	20	IDGD	
Cn1c(=O)n(C)c2nc(NC(=O)CCC(=O)NNC(=O)c3ccc4ccccc4n3)ccc21	769468780	ATXAMKUNWFPJCY-UHFFFAOYSA-N	447.455	1.000	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@@H](C)C(=O)NNC(=O)[C@H](NS(C)(=O)=O)C(C)(C)C	770750800	ZEYXEWBMQCJSRF-WFASDCNBSA-N	433.958	1.835	50	20	IDGD	
C[C@H]1CN(c2ccnc(C(=O)NNC(=O)c3csc(N4CCOCC4)n3)c2)C[C@H](C)O1	770813538	KJZGUHDNRJHSKH-KBPBESRZSA-N	446.533	1.063	50	20	IDGD	
Cc1cc(NC(=O)NNc2ccnc(Br)c2)n([C@H]2CCS(=O)(=O)C2)n1	771098975	MNENYPUFYNEXLR-NSHDSACASA-N	429.300	1.857	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)[C@H]3CCN(C)C3=O)c2)c(C)c1	771853258	RCUYMKOHGYPBSY-QGZVFWFLSA-N	444.513	1.344	50	20	IDGD	
NC(=O)c1cc(OC2CCN(CC(=O)NNC(=O)c3cccc(Cl)c3)CC2)ccn1	772343660	FOEVIYUTZALGQG-UHFFFAOYSA-N	431.880	1.138	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2)cccc1S(=O)(=O)NC1CC1	773642804	BXOFZAXEWOCPDI-UHFFFAOYSA-N	433.446	1.426	50	20	IDGD	
COC(=O)N1CCC([C@H](C)NCC(=O)NNC(=O)c2cc(Cl)ccc2OC)CC1	776809131	MSGOKGHAXDSFBG-LBPRGKRZSA-N	426.901	1.566	50	20	IDGD	
O=C(CC(=O)NNC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1)NCC(F)(F)F	779646530	QGRHPQMPONLSGK-UHFFFAOYSA-N	446.389	1.764	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2ccc(-c3ncn(C)n3)cc2)c2ccccc2c1=O	779727077	OOOKKXTUSHWSHD-UHFFFAOYSA-N	431.456	1.677	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)C1=CCN(C)CC1	781397362	ZGTPYGDNNNZFGP-OAHLLOKOSA-N	435.550	1.066	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@]2(C[C@@H]2C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)C1	781886764	RPMCBNULLVTCQU-QRQCRPRQSA-N	441.488	1.986	50	20	IDGD	
O=C(c1ccc(OC2CCCC2)nc1)N1CCN(S(=O)(=O)CBr)CC1	782044967	BVGDCTXTOCYYQW-UHFFFAOYSA-N	432.340	1.843	50	20	IDGD	
N#Cc1ccc(Cn2cnc(NC(=O)C(=O)NNc3ccc(Br)cn3)n2)cc1	784341465	NIEMKEMVWFYPRA-UHFFFAOYSA-N	441.249	1.437	50	20	IDGD	
O=C(NNc1nccnc1Cl)C(=O)Nc1ccnn1Cc1cnn(-c2ccccc2)c1	784776852	VYFDPASPBHIDEE-UHFFFAOYSA-N	437.851	1.642	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)C(=O)Nc1ccc(CCN2CCCCC2)cc1	785060544	IMBPBBSARPCYLB-UHFFFAOYSA-N	448.527	1.691	50	20	IDGD	
Cc1cc(C(=O)N2CCCC2)ccc1NC(=O)C(=O)NNC(=O)Cc1cn2ccccc2n1	785066500	CCWSRSDNLXFSMS-UHFFFAOYSA-N	448.483	1.207	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)cccc1OCC(F)(F)F	785068154	VATRKVISCAPKAG-UHFFFAOYSA-N	449.389	1.912	50	20	IDGD	
O=C(COC(=O)c1nc(Br)cs1)NNC(=O)c1cccc([N+](=O)[O-])c1	791475943	RDSNFAWSNVWBCB-UHFFFAOYSA-N	429.208	1.432	50	20	IDGD	
CN(NC(=O)[C@H](C#N)Cc1ccc(C#N)cc1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	792319683	XYCMOPIEXVPIPU-SFHVURJKSA-N	440.504	1.876	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)[C@H]2N(C(=O)OC(C)(C)C)CC2(C)C)c2ccccc2c1=O	792812313	RHKQUDFBKUCAKE-OAHLLOKOSA-N	429.477	1.340	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)nc1Br	793022378	WKXNKAJIXKTATL-UHFFFAOYSA-N	427.642	1.911	50	20	IDGD	
CCCCN(c1ccccc1)S(=O)(=O)c1cccc(NC(=O)C(=O)NNC(C)=O)c1	793023366	OQMFAALBWAMGEL-UHFFFAOYSA-N	432.502	1.788	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)NCc2ccc(NC(=O)N(C)C)cc2)cc1C	793496684	FHJJGYJMPYDPQS-UHFFFAOYSA-N	426.477	1.866	50	20	IDGD	
CC(=NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1)C1CN(C(=O)OC(C)(C)C)C1	794480088	DMZDSZNQHOENSF-UHFFFAOYSA-N	430.914	1.960	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)N1CC[C@@H](N2CCN(C(=O)OC(C)(C)C)CC2)C1	796616144	UFGUCRCCJCLUQS-IAGOWNOFSA-N	425.574	1.195	50	20	IDGD	
COC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)c1C	798042121	NECJMJCNVXLLHF-GFCCVEGCSA-N	432.408	1.866	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)NCCN(C)S(=O)(=O)c2ccc(F)cc2)c1	798098426	DFLPXOOEDBALAF-UHFFFAOYSA-N	437.497	1.156	50	20	IDGD	
CCN1C(=O)c2ccc(C(=O)NNC(=O)c3cc(C)nc4ccccc34)cc2S1(=O)=O	799009649	GYSXBQRVNPIFSQ-UHFFFAOYSA-N	438.465	1.782	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNS(=O)(=O)c2cccc3c2OCO3)cc1	800830990	OLLHNWNPLPZQAL-UHFFFAOYSA-N	447.498	1.459	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2cc(NS(C)(=O)=O)c(OC)c(OC)c2)cc1	802065417	ZAQKTKIMSVNYBB-UHFFFAOYSA-N	438.462	1.550	50	20	IDGD	
O=C(CN1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O)NNC(=O)Nc1ccc(Cl)cc1Cl	802087203	QBTILTGEPCEKDI-OXHZDVMGSA-N	427.244	1.309	50	20	IDGD	
C[C@H](C(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)n1ccc2ccccc2c1=O	805628657	KBZHYHBRPRHLKC-CYBMUJFWSA-N	438.396	1.475	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)c2ccccc21)c1nn(-c2ccccc2)cc1O	806346969	UVXKCLVKPWGVNQ-OAHLLOKOSA-N	426.454	1.300	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)Nc1cc(C(=O)OC)c(Br)cc1C	806738663	KKAOQQJGYGBJKZ-SNVBAGLBSA-N	432.271	1.748	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2nc3c(s2)CSCC3)cc1OC	806975418	YENNYEBVJHDDBR-UHFFFAOYSA-N	436.515	1.739	50	20	IDGD	
CCOC(=O)C(=O)c1cc(S(=O)(=O)NNC(=O)c2ccc3ccccc3c2)cn1C	808077631	GNZRIGOPQHDBBA-UHFFFAOYSA-N	429.454	1.547	50	20	IDGD	
Cc1nn(C)c2cc(NC(=O)C(=O)NNc3ccc(S(=O)(=O)C(F)F)cc3)ccc12	812978337	LLVVMEGXRAMZHT-UHFFFAOYSA-N	437.428	1.960	50	20	IDGD	
O=C(NN=C1CC(C(=O)O)(c2cccc(Br)c2)C1)N[C@@H]1CCS(=O)(=O)C1	814816183	OSQDYXXGPIYVDT-ZGTOLYCTSA-N	444.307	1.408	50	20	IDGD	
Cc1ncsc1C(=O)NNC(=O)C(=O)Nc1ccn(-c2ccc(Br)cc2)n1	815569262	MMNUKGPKYTUIMG-UHFFFAOYSA-N	449.290	1.799	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)N(C)C)c2cccnc12	815752177	HFJISQQOKLNDFA-UHFFFAOYSA-N	427.486	1.875	50	20	IDGD	
C[C@@H]1CCCCN1CC(=O)Nc1ccc(F)c(NC(=O)C(=O)NNc2ncncc2F)c1	815765001	BWXRAZNEPISCCJ-GFCCVEGCSA-N	447.446	1.650	50	20	IDGD	
Cc1c(C(=O)NNc2ccccc2S(=O)(=O)N(C)C)nnn1-c1cccc([N+](=O)[O-])c1	817053423	QNLAITKBQZYJOE-UHFFFAOYSA-N	445.461	1.491	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)c1sccc1S(=O)(=O)N1CCCC1	822564829	WXMXKUWNJGNKTL-CQSZACIVSA-N	437.499	1.134	50	20	IDGD	
CCc1ccc(NS(=O)(=O)c2cc(C(=O)N3CC[C@H](B(O)O)C3)ccc2OC)cc1	864234517	SEPLWVVWKTXMHG-INIZCTEOSA-N	432.307	1.747	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)CNS(=O)(=O)c1ccc2ccccc2c1	915787871	KYNSAXNHECBPTD-CQSZACIVSA-N	445.472	1.872	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)NCc1ccccc1CN1CCOCC1	915927435	MTMRTBXKFSXMNM-INIZCTEOSA-N	430.480	1.956	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCc2ccc(Cn3cncn3)cc2)c2ccccc2c1=O	916228056	VLRKXPKDLGTDGH-UHFFFAOYSA-N	446.471	1.200	50	20	IDGD	
CCC(CC)[C@H](CNC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)N1CCCC1	916256773	QNWZJCZNTQJJRW-SFHVURJKSA-N	428.537	1.778	50	20	IDGD	
CC[C@@H](CNC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)N1CCc2ccccc2C1	916445538	SFIJFBDVMBCVLT-IBGZPJMESA-N	444.557	1.871	50	20	IDGD	
O=C(NC[C@H](c1ccccc1)N1CCOCC1)NNC(=O)c1cc(Br)c[nH]1	916511695	YNOJJXYFAZYJSR-MRXNPFEDSA-N	436.310	1.795	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)NC[C@H](C)N2CCN(c3ccccc3)CC2)c1	916514271	ACJPCHJEOXNNKI-KRWDZBQOSA-N	441.532	1.859	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)[C@H]2Cc3ccccc3C(=O)O2)cc1	916550500	KRRDMSOIEFTZOV-QGZVFWFLSA-N	437.481	1.650	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(I)c(C(=O)NNc2ncccn2)c1	917365615	AFIOXEIGDYXRTB-UHFFFAOYSA-N	447.258	1.088	50	20	IDGD	
CC(=O)NCC1CCN(C(=O)NNC(=O)[C@H](C)Oc2cccc(Br)c2)CC1	918003263	YSVGHIMZGIOYEA-LBPRGKRZSA-N	441.326	1.805	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1Br)C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	918204413	CTSKMCZDXNRKMA-SNVBAGLBSA-N	449.240	1.792	50	20	IDGD	
CNS(=O)(=O)c1ccc([C@H](C)NC(=O)NNC(=O)COc2cc(C)ccc2C)cc1	919778424	ARWMNVDDYXHHKC-HNNXBMFYSA-N	434.518	1.682	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N[C@H](C)Cn2cccn2)cc1	920853413	CHNYRDZHJUSAFH-YAJBTMAUSA-N	447.499	1.742	50	20	IDGD	
O=C(NNC(=O)c1n[nH]c2c1CCCC2)/C(=C/c1cccnc1)NC(=O)c1ccccc1	1251810149	AQDKIOWEMDDSDT-UYRXBGFRSA-N	430.468	1.916	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)NCCCOC[C@H]2CCCO2)CC1	1318625614	FFRPXLPWYNWWPC-MRXNPFEDSA-N	428.530	1.550	50	20	IDGD	
CN(NC(=O)Cn1c(=O)oc2ccccc21)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	1320422844	UIKWVMDQUWDUAH-UHFFFAOYSA-N	433.465	1.230	50	20	IDGD	
CCOC(=O)N1CC[C@H](NC(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)C1	1320473900	LOVQKDJGOOXBCV-AWEZNQCLSA-N	427.502	1.195	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCCC(=O)N2CCC[C@@H](C)C2)c2ccccc2c1=O	1351924511	NQZJESQGQLZYDY-CQSZACIVSA-N	428.493	1.009	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)c3cc4cccnc4s3)C2)C1	1777758671	QAGKJJCDLWSFJQ-NRFANRHFSA-N	445.545	1.113	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3cn4ncccc4n3)C2)C1	1777950958	RISZPWITUDKLLD-ACJLOTCBSA-N	436.310	1.204	50	20	IDGD	
CN1CCCn2nc(C(=O)N3CCO[C@]4(CCN(C(=O)CO[Si](C)(C)C)C4)C3)cc2C1	1779299158	PHLYZPWDDAZYBP-NRFANRHFSA-N	449.628	1.014	50	20	IDGD	
C=C[C@H](O)C(C)(C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Br)C2	1779337858	DVJDOMLSBCPBRW-HNSFDTNUSA-N	435.334	1.764	50	20	IDGD	
Cc1cc(CC(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](C)CBr)C3)n[nH]1	1779457189	HSNKFNPABJEDFE-VVFCZOMOSA-N	441.370	1.806	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(Cl)Cl)C2)[C@H]1CC[C@H]2CCC(=O)N2C1	1780613031	UBKIZFUJSSSKQK-UJKGCTCZSA-N	446.375	1.705	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)CCn3c(=O)oc4ccccc43)CCO2)C1	1781215589	RXYOZVWHJVNSGK-YCRPNKLZSA-N	435.908	1.832	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)CCN3C(=O)c4ccccc4C3=O)CCO2)C1	1781215665	UTUDDOIGXDSNMQ-VGSWGCGISA-N	447.919	1.520	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(S(C)(=O)=O)c(F)c3)CCO2)C1	1781223633	QPEXIIRZAQYEQB-LIRRHRJNSA-N	446.928	1.690	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)c3nc(O)n4c3CCCC4)CCO2)C1	1781230508	TXFFINDZXUDTMR-RTBURBONSA-N	445.347	1.605	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(CCN(C(=O)C3(F)CC3)C2)C1	1782911020	ZRUIOVXMZYNAEQ-LJQANCHMSA-N	435.408	1.466	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)C3CCN(CC)CC3)CCO2)C1	1783352379	GAQRDTWUXJIHJR-APWZRJJASA-N	430.387	1.722	50	20	IDGD	
COc1ccc(CCC(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](C)Br)C3)C2)cn1	1783529283	HJFJUQHTUZJDDE-KUHUBIRLSA-N	440.338	1.636	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3nn(C)c4c3CCC4)CCO2)C1	1783533629	CHMAJKLJVNJOFN-XIKOKIGWSA-N	425.327	1.136	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccc4c(cnn4C)c3)CCO2)C1	1783534693	YBUQKVQWNQSZCP-ORAYPTAESA-N	435.322	1.800	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CC[C@]2(CN(C(=O)CCBr)CCO2)C1	1783849265	AMGXXJJUMMOSGQ-KHYOSLBOSA-N	443.338	1.357	50	20	IDGD	
CCOc1cccc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](Cl)COC)C3)C2)c1O	1783882087	VDFDOYWDEPRHFD-MGPUTAFESA-N	426.897	1.488	50	20	IDGD	
O=C(C(Cl)Cl)N1CC[C@]2(C1)CN(C(=O)[C@@H]1CCc3ccccc3[C@@H]1O)CCO2	1783943317	VTYJBAGMMVVHOP-GUXCAODWSA-N	427.328	1.916	50	20	IDGD	
CC(C)(C)n1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Br)C[C@@H]32)cn1	1785620990	YCZVXDLTOSWIFW-MXAVVETBSA-N	445.333	1.922	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)c1snnc1C1CC1	1787739871	SZNQTIHYMFJNIK-RMIALFOJSA-N	447.330	1.699	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)c1ccc2c(c1)OCO2	1787806652	WKRFCUQNSMYIHW-ZQIUZPCESA-N	439.306	1.794	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1ccc(C2(NC(=O)Cn3ccnn3)CCC2)cc1	1788647999	CIUTYLUUHDWMEA-JFLMPSFJSA-N	448.487	1.546	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cn3cc(Cl)cn3)C[C@@H]21	1789866066	LLZLZNIUVNLGFW-MJFSBKNWSA-N	437.755	1.753	50	20	IDGD	
Cn1cc(CCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]3C2)cn1	1789866377	QLZZQZJRLUCKRJ-FPXQBCRKSA-N	431.364	1.569	50	20	IDGD	
COC(=O)[C@@H]1CC[C@H](C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]3C2)C1	1789921159	ADRUUHHAIPBTKR-IWTMDLJTSA-N	449.317	1.246	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3Cc4ccccc4N3)[C@H]2C1	1790681978	ZBNPMFPCBKWICH-ZULIPRJHSA-N	431.609	1.854	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccn4c(C)cc(C)nc34)C[C@@H]21	1791256567	BSDGMNVUYMJNTN-WNHJNPCNSA-N	448.951	1.798	50	20	IDGD	
CCN1CCC(C(=O)Nc2ccc(C3(NC(=O)c4ccc(B(O)O)cc4)CCC3)cc2)CC1	1792356468	OKQPXLBNAKJISC-UHFFFAOYSA-N	449.360	1.846	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Cl)C1	1796364462	GBFWSDVHSNTKMF-SBJFKYEJSA-N	433.908	1.367	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C=C/C(=O)c1cccs1	1796448546	ZRRNUZFVQMJWGW-FNWDTHLHSA-N	441.347	1.860	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1coc(Cl)n1)C2	1796889743	FMRGKEZKNXMWNO-PNEZKNQNSA-N	432.868	1.714	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1nccc3nc[nH]c13)C2	1796892126	JQWXRCRRNPJPOI-FVCJKWQPSA-N	448.487	1.344	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cn3ncccc3n1)C2	1796892468	FWTLBQBPVPTHSP-LCFLCXBCSA-N	448.487	1.115	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CSc1ccc(C)cc1	1797124742	ZPKFSHZCBKDCDK-HIRMHNASSA-N	426.966	1.931	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccnc(Cl)n1	1798083147	WTMSIBILOXDJEA-NOHGZBONSA-N	431.718	1.507	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3nncn3c1)C2	1799277500	WCAJBTGRNIMFLG-HRJSJKBJSA-N	426.304	1.169	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C[C@H]1OCCc3ccccc31)C2	1800971447	YZWUYAHDTBFDNN-WWWUOXLMSA-N	436.936	1.534	50	20	IDGD	
Cc1ccc(OC(C)(C)C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C(Cl)Cl)nc1	1801017277	IKORQWKJRSGJRD-AGGWBTHJSA-N	430.332	1.941	50	20	IDGD	
C[C@H](NC(=O)c1ccccn1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](C)Br)C2	1801263867	MECDSULOIHOGMV-QKGCVVFFSA-N	437.338	1.622	50	20	IDGD	
CC(C)(C)OC(=O)N1CC=C(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Cl)C3)CC1	1801941507	KRYNVECJIMEDSB-FZKCQIBNSA-N	445.919	1.678	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc3ccnn3c2)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803148257	PRHJKFMFOSASQX-ZYSHUDEJSA-N	427.892	1.649	50	20	IDGD	
C=CCOCCCC(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1803560698	OGDKNODPHKWBFG-WMZHIEFXSA-N	445.564	1.443	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)CCC(F)(F)F)[C@@H]1c1cccnc1	1806832418	PYLKPGWYLUTUCV-BEFAXECRSA-N	443.470	1.803	50	20	IDGD	
COc1ccc(C(=O)N2CCCC3(CCN(C(=O)c4ccc(B(O)O)cc4)CC3)C2)s1	1807498855	FUDVFSFUXIZGKD-UHFFFAOYSA-N	442.346	1.595	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2nc3ncccn3n2)[C@@H]1c1cccnc1	1808265229	LDALVLRCKMMEGQ-HRCADAONSA-N	427.896	1.856	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)COc2ccc(O)nn2)[C@@H]1c1cccnc1	1808277339	COKJRGBYZDBYII-YZVOILCLSA-N	433.896	1.679	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)Cn2cc(C)c(O)nc2=O)[C@@H]1c1cccnc1	1808285725	SNOCZMHTKXJFDH-XYJFISCASA-N	447.923	1.376	50	20	IDGD	
C=C[C@H](O)C(C)(C)C(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1810254147	VPALOSHXRMBWFW-LQWHRVPQSA-N	445.564	1.034	50	20	IDGD	
COC(=O)C12CC(C(=O)NC[C@@H]3CCN(C(=O)[C@@H](O)CCl)[C@@H]3c3cccnc3)(C1)C2	1812834025	MBZIQFIBMXUDMD-VQQJLRODSA-N	435.908	1.030	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)Cc2cnccn2)[C@@H]1c1cccnc1	1812864966	YWQRYWSUFXJSIX-DHSIGJKJSA-N	432.322	1.904	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(-n3cnnc3)cc2)[nH]n1)[C@H](O)CCl	1814869835	CVZOSWGUYRGFHG-DLBZAZTESA-N	443.895	1.896	50	20	IDGD	
Cc1nccnc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819403391	IOAMTTDBFLWUCY-MRXNPFEDSA-N	449.475	1.126	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H]2C[C@H](O)CN2)n[nH]1	1820746678	OSCGYDKTDOMFPG-XWUBHJNHSA-N	428.331	1.156	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3nccnc3C(N)=O)sc2C1	1821032481	MJSRPAMWJNZUJX-VHSXEESVSA-N	436.925	1.665	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@H](O)CCl)CC2)c1cncc2cnccc12	1821208109	KDASQQDBFADHSA-IAQYHMDHSA-N	431.905	1.912	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN2CCCCC2=O)[nH]n1	1822373912	ARCXVEYLZMFAGF-HIFRSBDPSA-N	425.917	1.668	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](C)N2CCN(C)CC2)[nH]n1	1822374642	YLGZGVCMSNDDGA-ZMSDIMECSA-N	440.976	1.292	50	20	IDGD	
Cc1c(C(=O)N2CCC([C@@H]3CCCCN3C(=O)[C@H](O)CCl)CC2)cn2[nH]cnc(=O)c12	1824186608	UGUKORUIZSCDAS-DLBZAZTESA-N	449.939	1.164	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cncnc2)CC1	1826021157	GZCMAKFZLWALTJ-LJQANCHMSA-N	437.504	1.022	50	20	IDGD	
Cc1nn(C)c(C)c1C(=O)N[C@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1	1826082828	DHOZUNCIPNQNEB-ZDUSSCGKSA-N	447.565	1.092	50	20	IDGD	
O=C([C@@H](O)CCl)N1CCC([C@H]2CCCCN2C(=O)CSc2ncccn2)CC1	1827170389	JVDRUTXSHXNMAE-CVEARBPZSA-N	426.970	1.788	50	20	IDGD	
Cc1nccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)n1	1827884692	LRBBPUKHHDTMIL-OAQYLSRUSA-N	436.321	1.012	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccnc3Cl)CCO2)C1	1829501733	QWDRRRVEGJZACQ-SJCJKPOMSA-N	446.729	1.588	50	20	IDGD	
CC(C)N1CCC(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)CC1	1830358399	MURHEHFAOTZNGX-JOCHJYFZSA-N	444.016	1.828	50	20	IDGD	
COc1ccc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)cc1	1830359508	QFTZQDMZHYRDLE-QFIPXVFZSA-N	438.952	1.959	50	20	IDGD	
Cc1cccc2cc(C(=O)N3CCOC[C@]4(C3)CN(C(=O)[C@H](O)CCl)CCO4)[nH]c12	1830732132	VFMYKZFOMQYPJA-UTKZUKDTSA-N	435.908	1.146	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CC[C@@H](N)C(N)=O)CC1	1831550459	WHIZDQQIEVUVCO-ARFHVFGLSA-N	445.402	1.372	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2coc(Cl)n2)CC1	1831872010	KKIPTTRIWQQKIJ-INIZCTEOSA-N	439.944	1.934	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)c3ccco3)CC2)CC1	1833089619	JPEKCHBVKCHSTL-CXAGYDPISA-N	442.354	1.668	50	20	IDGD	
Cc1nc(CC(=O)N2CCC(N3CCC(NC(=O)[C@H](O)CCl)CC3)CC2)cs1	1833308460	STBMUOKQLVPVQY-QGZVFWFLSA-N	428.986	1.165	50	20	IDGD	
N#Cc1ccccc1OCC(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)CCl)CC2)CC1	1833313858	WURSKUVBRZFARO-IBGZPJMESA-N	448.951	1.108	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)CCBr)C3)C2)nc1C	1833690098	WFVWVSIWGVHVMG-IBGZPJMESA-N	440.338	1.553	50	20	IDGD	
CC(C)(C)n1cc(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)cn1	1833955779	RISPKZOJYLSNAA-SFHVURJKSA-N	439.988	1.423	50	20	IDGD	
O=C(c1cc(O)ccc1F)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836717449	DNNMPPJGRXNGER-GOSISDBHSA-N	428.888	1.743	50	20	IDGD	
CCn1ccc(C(=O)N2CCC(OC3CCN(C(=O)[C@@H](Cl)COC)CC3)CC2)n1	1837539473	CXJHXEWEHOQDIF-KRWDZBQOSA-N	426.945	1.769	50	20	IDGD	
C=CC(=O)N[C@@H](C)C(=O)N1CCC(OC2CCN(C(=O)[C@](C)(Cl)CCl)CC2)CC1	1838427816	IISGEAJRCGVZNW-VBKZILBWSA-N	448.391	1.912	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(C(C)C)no3)CCO2)C1	1838779011	OEGIZIZSYZWCKN-IFXJQAMLSA-N	429.901	1.122	50	20	IDGD	
CC(C)(C)[C@H](O)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2	1839150384	KYBUNEQMRGFTBE-BVGQSLNGSA-N	425.353	1.086	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1Cc3ccccc3N1)CCO2	1839735938	LLSMJUWGZWYOLY-UGKGYDQZSA-N	447.608	1.331	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3ccco3)C2)C1	1839962574	KUVCJMSABIXBIX-LPHOPBHVSA-N	443.338	1.842	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1839986272	KUMKLWWAYRFEAI-HXUWFJFHSA-N	447.960	1.233	50	20	IDGD	
CC(C)N[C@H](C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](C)Br)CCO2)C1)C(C)C	1840032128	OEMDIVRHGIINLV-TXPKVOOTSA-N	448.402	1.249	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4c(s3)CCC4)C2)C1	1840150228	IAESITOGLQBXSP-MGPUTAFESA-N	442.965	1.561	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3c(C)cccc3Cl)C2)C1	1840155002	MLCNYLRJZMUULA-UZLBHIALSA-N	445.343	1.972	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)nn1C(F)F	1840188959	OBWRINHCPVUVRG-INIZCTEOSA-N	441.262	1.460	50	20	IDGD	
CN(CC(=O)N1CC2(CCCN2C(=O)Cc2ccccc2)C1)NC(=O)NCc1ccccc1	1842697196	YMUIATDQSMPHPN-UHFFFAOYSA-N	449.555	1.779	50	20	IDGD	
Cc1ccc(COCC(=O)N2CCCC23CN(C(=O)CCC(=O)NN(C)C)C3)cc1C	1843436164	FLFFTRXZCVABOE-UHFFFAOYSA-N	430.549	1.396	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H]2CC[C@@H](C2)[C@H]1C(=O)N1CCCC12CN(C(=O)[C@H](O)CCl)C2	1846143377	YTGXTTBSBKLGNB-JONQDZQNSA-N	441.956	1.578	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)c1cncc(C(F)(F)F)c1)C2	1846385324	QJPLXCWFNNQDCZ-UHFFFAOYSA-N	427.427	1.290	50	20	IDGD	
Cc1cc(C)cc(CCC(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)c1	1846498877	UUIBVDHGSDCNPF-UHFFFAOYSA-N	435.528	1.752	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc(=O)nc2sccn12	1847498551	IKPKLMUZKOABTE-WOPDTQHZSA-N	439.335	1.602	50	20	IDGD	
CC(C)(C)OC(=O)N1CCO[C@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)C(Cl)Cl)C1	1847639802	NQGSNQHGABKODS-AVGNSLFASA-N	436.336	1.628	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)CCc2c(C)nn(C)c2C)c1	10127695	MEPBISSVRKXNAG-UHFFFAOYSA-N	435.550	1.461	50	20	IDGD	
Cc1nnc(NNC(=O)c2ccc(NS(=O)(=O)c3ccc(Cl)s3)cc2)[nH]c1=O	10899365	BHBJFLDCAFKPEO-UHFFFAOYSA-N	440.894	1.746	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)c2cnn(C(C)C)c2n1	11915732	GACSMKHKSCHYCT-UHFFFAOYSA-N	429.506	1.689	50	20	IDGD	
O=C(NNC(=O)c1cccn1-c1cccc(I)c1)C(=O)NC1CC1	64022935	KPDCVUHVVACWPZ-UHFFFAOYSA-N	438.225	1.122	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2c(C)nn3cccnc23)c1	108685914	QAANZHHCQPHYGW-UHFFFAOYSA-N	430.490	1.143	50	20	IDGD	
O=C(CCC1CCCCC1)NNC(=O)NCCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1	727481538	BVXZGYKZAFOUOV-UHFFFAOYSA-N	441.510	1.564	50	20	IDGD	
Cc1cc(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)c2c(C)noc2n1	728214176	MNYADZPLGKGRAA-UHFFFAOYSA-N	444.517	1.533	50	20	IDGD	
CCCCCCn1nc(C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)c2ccccc2c1=O	728372188	KQACOFYGJRRVML-CQSZACIVSA-N	434.518	1.173	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCC([C@H](C)NC(=O)OC(C)(C)C)CC2)n1	730267053	KONULHMYBXARNN-AWEZNQCLSA-N	439.582	1.767	50	20	IDGD	
COc1cc(C=NNC(=O)[C@@H]2CCS(=O)(=O)C2)ccc1OC(=O)c1ccc(F)cc1	730576706	UXHATYXAIGOMRS-OAHLLOKOSA-N	434.445	1.938	50	20	IDGD	
O=C(CC[C@H]1NC(=O)N(c2ccc(Cl)cc2)C1=O)NNC(=O)COc1ccccc1F	730768565	CDNHJCOUHDOEKP-OAHLLOKOSA-N	448.838	1.911	50	20	IDGD	
O=C(COC(=O)c1nn(-c2ccc(F)cc2)ccc1=O)NNC(=O)c1cccc(Cl)c1	731746739	UPAIWGIBCPHTFF-UHFFFAOYSA-N	444.806	1.643	50	20	IDGD	
CC(C)(CNC(=O)NNC(=O)COc1ccccc1-c1ccccc1)NS(C)(=O)=O	731761448	LWUHUKMTXWILJV-UHFFFAOYSA-N	434.518	1.391	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)CNC(=O)N2CCc3ccccc3C2)cc1OC	731865618	OELVFYPBONLRBG-UHFFFAOYSA-N	426.473	1.623	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)c1cc(S(=O)(=O)N2CCSCC2)c[nH]1)c1ccccc1	732132117	CHQHICADMIRVOV-MRXNPFEDSA-N	436.559	1.707	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NC[C@H](O)c1ccc(Cl)cc1Cl	732244477	GXBWAGAYAXPYKH-LBPRGKRZSA-N	431.301	1.849	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)c1ccc2c(c1)C(=O)N(C[C@H]1CCCO1)C2=O	732302860	SCDGFYPNUHPCHF-CQSZACIVSA-N	443.481	1.622	50	20	IDGD	
CS(=O)(=O)Nc1cc2ccccc2cc1C(=O)NNC(=O)COc1ccc(C#N)cc1	732985276	NTVPCUBPWTYDHH-UHFFFAOYSA-N	438.465	1.923	50	20	IDGD	
Cc1cc(C)nc(-n2nc(C)c(CC(=O)NNc3nc4ccccc4c(=O)n3C)c2C)n1	733263582	KUQSIMKVSJWQMA-UHFFFAOYSA-N	432.488	1.829	50	20	IDGD	
O=C(NCc1ccc(CN2CCC(O)CC2)cc1)NNC(=O)c1cnn(-c2ccccc2)c1	733350150	PDYYSJXCMNZTPB-UHFFFAOYSA-N	448.527	1.973	50	20	IDGD	
CN(C)C1(CNC(=O)NNC(=O)COc2ccc(Br)cc2)CCOCC1	733851407	XVMAQUKFJXSJNW-UHFFFAOYSA-N	429.315	1.269	50	20	IDGD	
CCc1nc(COc2ccc(C(=O)OCC(=O)NNC(=O)c3cccs3)cc2)no1	734589925	SNRGMZVSUQJBQD-UHFFFAOYSA-N	430.442	1.891	50	20	IDGD	
Cn1cc(-c2nc(C(=O)NNC(=O)NC3CCN(C(=O)OC(C)(C)C)CC3)cs2)cn1	734824702	IKPLUBIGAFDTEE-UHFFFAOYSA-N	449.537	1.887	50	20	IDGD	
O=C(CSc1nnnn1-c1ccc2c(c1)OCCO2)NNC(=O)c1ccc(F)cc1	734982648	UDNCLXSAMPPAHT-UHFFFAOYSA-N	430.421	1.126	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)[C@@H]2CCOc3ccccc32)CC1	735116775	FECJKDSVCJKAIW-MRXNPFEDSA-N	431.518	1.027	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2cc3c(s2)CCCC3)CC1	735116841	IFCWVDFMWBNRLC-UHFFFAOYSA-N	435.575	1.715	50	20	IDGD	
C[C@@H](CC(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1)c1ccc(F)cc1	735118326	RZZASKPMJDWHBM-HNNXBMFYSA-N	435.525	1.794	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CSc2nnc(-c3cccc(N(C)C)c3)n2N)cc1	735980776	LLIURJTTYBEMAE-UHFFFAOYSA-N	425.518	1.587	50	20	IDGD	
Cc1cc(S(C)(=O)=O)c(C)c(S(=O)(=O)NNC(=O)COCc2ccccc2)c1	737757073	ZTHZGWRHKUTOJU-UHFFFAOYSA-N	426.516	1.233	50	20	IDGD	
COc1ccc(S(=O)(=O)CCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1OC	740812407	HSVGPKUWXSJPED-UHFFFAOYSA-N	437.430	1.237	50	20	IDGD	
O=C(NNc1ncnc2[nH]cnc12)c1ccc([N+](=O)[O-])cc1I	743474262	ZESGSBOFYGMFQW-UHFFFAOYSA-N	425.146	1.623	50	20	IDGD	
NC(=O)c1ccccc1N1CC[C@@H](NC(=O)NNC(=O)c2cccc(Br)c2)C1	743604877	HUKKVRDAENJYQS-CQSZACIVSA-N	446.305	1.771	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)c2ccccc2c1=O	743737936	LGYACAWULJSCIH-UHFFFAOYSA-N	434.412	1.741	50	20	IDGD	
CCOc1cc(N)c(C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)cc1OCC	744872841	NGDVYRLCFNDHIR-UHFFFAOYSA-N	426.429	1.556	50	20	IDGD	
O=C(NC[C@@H](c1cccs1)N1CCOCC1)NNC(=O)c1cc([N+](=O)[O-])ccc1O	745278900	OCHALPMPYNRMMN-AWEZNQCLSA-N	435.462	1.379	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)N[C@H]2CCCN(c3ccn(C)n3)C2=O)c1C	745882563	HQICZYRVXULAEU-HOTGVXAUSA-N	428.493	1.330	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)N[C@@H]2CCCN(c3ccn(C)n3)C2=O)cc1	745884500	YJUXGZFCUYHVHU-WMLDXEAASA-N	444.492	1.112	50	20	IDGD	
Cc1cc(N2CC[C@@H](NC(=O)NNC(=O)c3cc4c(s3)CCCCC4)C2=O)n(C)n1	745907133	ZIZURUFLMFJMAF-CQSZACIVSA-N	430.534	1.808	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCN(Cc2cccc(O)c2)CC1	746458834	WHSVLXDHMFXUHJ-UHFFFAOYSA-N	432.908	1.633	50	20	IDGD	
Cc1cc(=O)n(CC(=O)NC(C)C)c(C)c1C(=O)NNC(=O)c1ccc(Cl)cc1F	747432031	UXGCREQKGYPGPK-UHFFFAOYSA-N	436.871	1.857	50	20	IDGD	
C[C@@H](c1ccncc1)N1CCC(NC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)CC1	748020466	HPIYAQQYSZUQDM-YWZLYKJASA-N	425.489	1.777	50	20	IDGD	
CCc1cc(N2CCC(NC(=O)NNC(=O)COc3ccccc3CC)CC2)ncn1	748663603	ONSPOMPPWKGCOA-UHFFFAOYSA-N	426.521	1.980	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)Cc1csc(NC(=O)Cc2cccs2)n1	751201536	KCGWPLDDXQKINB-UHFFFAOYSA-N	447.498	1.099	50	20	IDGD	
CC1(C)CN=C(N2CCN(C(=O)NNC(=O)c3cc(Br)c[nH]3)CC2)S1	754084195	FBEJTUPAOODIQP-UHFFFAOYSA-N	429.344	1.631	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1)S(C)(=O)=O	754098812	BFBWPDUSNCQLSS-OXQOHEQNSA-N	444.557	1.377	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@H](C)[C@@H](C)NC(=O)OC(C)(C)C)c2ccccc2c1=O	755312485	LAPXXSLIFZHJLA-CHWSQXEVSA-N	431.493	1.727	50	20	IDGD	
Cc1ccnc(NNC(=O)c2cccc(NS(=O)(=O)c3ccc4nnn(O)c4c3)c2)c1	755844184	VGQSRCSRZUVSCR-UHFFFAOYSA-N	439.457	1.930	50	20	IDGD	
CC(C)(C)c1nc(CN2CCN(CC(=O)NNC(=O)c3cccc(Cl)c3)CC2)no1	755946365	IGHRNOIWDYQKEM-UHFFFAOYSA-N	434.928	1.599	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)Nc1cccc(COc2ccc3c(c2)OCO3)c1	755964984	VEILUVIFMXREBJ-AWEZNQCLSA-N	447.469	1.582	50	20	IDGD	
Cc1oc(C(=O)OCC(=O)NN=C(c2ccccc2)c2ccccc2)cc1S(N)(=O)=O	756445339	DPHAOKAQSQSTDX-UHFFFAOYSA-N	441.465	1.961	50	20	IDGD	
CC(=O)N(Cc1ccc(NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1)C1CC1	756660689	OEWUBYSBIYFHEZ-UHFFFAOYSA-N	434.460	1.640	50	20	IDGD	
COc1cccc(-c2nsc(NC(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)n2)c1	757946712	QUHFHGWDTDQXNY-UHFFFAOYSA-N	437.445	1.656	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1ccc(-c2noc(-c3ccc(F)cc3)n2)cc1	758025485	MHZVZYCHRLIPHQ-NSHDSACASA-N	447.448	1.241	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)c1ccc[nH]1	760864164	VBBVTLJZPMLHOF-HNNXBMFYSA-N	449.533	1.060	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)OCC(=O)Nc2cc(-n3cnnn3)ccc2F)cc(C#N)n1C	761058528	CSZQDKFYYVPMMB-RZNTYIFUSA-N	434.391	1.409	50	20	IDGD	
CCN(CC(=O)NNC(=O)c1cccc(Cl)c1)CC(=O)Nc1ccc2c(c1)OCCO2	762549577	TWSSAFWCJKOYRE-UHFFFAOYSA-N	446.891	1.833	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)c2cc(-c3ccco3)nc3c(C(N)=O)ncn23)n1	762912845	MJDSJEVLQKIZHR-UHFFFAOYSA-N	435.448	1.481	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)c3cnc4c(c3)c(O)nc(=O)n4C)n[nH]2)cc1	763173449	NXNZCVQLARNFOG-UHFFFAOYSA-N	433.428	1.061	50	20	IDGD	
COCCOC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2c[nH]c3ccccc23)c1	763534334	FTJDPAMYUCFGAB-UHFFFAOYSA-N	439.428	1.763	50	20	IDGD	
Cc1ccnc(-c2cccc(NC(=O)C(=O)NNC(=O)[C@H]3COc4ccccc4O3)c2)n1	763571917	PNVKPTHTRQYYPA-GOSISDBHSA-N	433.424	1.378	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2cc(C)nn2-c2ccc(F)cc2)c1	763624147	JVAQVJMIYIVQOL-UHFFFAOYSA-N	425.420	1.793	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc2c(cc1Cl)OCCO2	763646358	GKSHIPGVRHXLJZ-UHFFFAOYSA-N	435.820	1.285	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccnn1Cc1ccc(C)s1	763663475	JGLICIOPHZYGDE-UHFFFAOYSA-N	443.485	1.475	50	20	IDGD	
O=C(CSc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1ccnn1Cc1ccccn1	763732429	CGMVBJPTIIEKJP-UHFFFAOYSA-N	444.904	1.858	50	20	IDGD	
O=C(CSc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1ccc(-n2nccn2)cc1	763732609	GCKQRBVZTJQXHY-UHFFFAOYSA-N	430.877	1.799	50	20	IDGD	
CCCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(N(C)C)c2)cc1	763757090	BHIOUYFSEBDVFD-UHFFFAOYSA-N	447.517	1.304	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cccc([C@@H]3CNC(=O)C3)c2)c1C	763849788	MZOIPKINNFDZCJ-RDJZCZTQSA-N	438.484	1.460	50	20	IDGD	
COCCn1nc(C)c(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)c1C	763855164	UWSAKKGAFOLMHW-MRXNPFEDSA-N	431.493	1.317	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(S(C)(=O)=O)cc2)cc1	763862210	VNDUKBDOCRCRPP-ZDUSSCGKSA-N	449.485	1.042	50	20	IDGD	
COc1cc(OC)c(OC)cc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccccc1F	763863847	DDTDGAXVFGVSRV-NSHDSACASA-N	435.408	1.405	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(CCN(C)C)cc2)cc1	763877580	LQBFDGGMUPRQKG-INIZCTEOSA-N	440.500	1.547	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccc(C(=O)NC3CCCC3)cc2C)n1	763893285	UADMHIFFWMKWLL-UHFFFAOYSA-N	440.504	1.267	50	20	IDGD	
C[S@@](=O)c1cccc(NC(=O)C(=O)NNC(=O)c2ccc(Br)s2)c1	763940463	HLFUJXOBDVQGAH-XMMPIXPASA-N	430.305	1.648	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1cccc(-c2nnc(C)n2C)c1	764010773	CUZXYJLTLZFZKF-UHFFFAOYSA-N	442.863	1.852	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(OC3CCOCC3)c(C)c2)c(O)c1	764104526	ABJMGRNYVHHNBO-UHFFFAOYSA-N	427.457	1.967	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(N3C[C@@H](C)O[C@H](C)C3)nc2)c(O)c1	764104611	BQECSDWZYGBUJS-ZIAGYGMSSA-N	427.461	1.109	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(N3CCCC3=O)c(Cl)c2)c(O)c1	764104875	GWDZVKJSHNGYAV-UHFFFAOYSA-N	430.848	1.881	50	20	IDGD	
Cc1cc(C)n(-c2ccc(NC(=O)C(=O)NNC(=O)c3ccc(Cl)cc3O)cn2)n1	764117808	SGBRUYUBRXFCTF-UHFFFAOYSA-N	428.836	1.643	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2ccc(OC[C@H]3CCCO3)cc2)cc1	764125099	RKJWGRPMOLPBGY-HXUWFJFHSA-N	441.484	1.972	50	20	IDGD	
CCOC(=O)c1cc(CC)sc1NC(=O)C(=O)NNC(=O)Cc1ccccc1OC	764131739	KRMDZUCYLQQIOU-UHFFFAOYSA-N	433.486	1.824	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)ccc1N1CCCC1=O	764239290	KGDZRHMUBYFSBK-UHFFFAOYSA-N	449.467	1.563	50	20	IDGD	
COc1cc(Br)c(NC(=O)C(=O)NNC(=O)c2scnc2C)cc1OC	764246872	RZTCNHJMVUNPNT-UHFFFAOYSA-N	443.279	1.631	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)ccc1OC(C)C	764266995	POINPIMXPQLYKC-UHFFFAOYSA-N	440.504	1.575	50	20	IDGD	
COc1cc(Br)c(NC(=O)C(=O)NNC(=O)Cc2cccnc2)cc1OC	764267243	FMKFHTJENONWOX-UHFFFAOYSA-N	437.250	1.190	50	20	IDGD	
COc1ccccc1Oc1ccc(NC(=O)C(=O)NNC(=O)Cc2cc[nH]n2)cc1F	764297001	LKIQYZIHZLRHQM-UHFFFAOYSA-N	427.392	1.678	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1ccn(-c2ccc(Cl)cc2Cl)n1	764399019	JEQMFVUZOQQNRI-JTQLQIEISA-N	444.275	1.317	50	20	IDGD	
CCOc1ccccc1OS(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(C)[nH]n2)c1	765587085	OWGPJRILLZUMRT-UHFFFAOYSA-N	444.469	1.959	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)[C@H]1CCC[C@@H](C(F)(F)F)C1	765731812	BYEMPLJTOGFGGR-DLBZAZTESA-N	440.466	1.961	50	20	IDGD	
C[C@@H](OC1CCCCCC1)C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765733638	OHGIOHTXUSIIHY-GOSISDBHSA-N	430.549	1.720	50	20	IDGD	
COc1cccc(OCC(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)c1	765748777	HUTMTAHVZXRCDP-UHFFFAOYSA-N	426.517	1.348	50	20	IDGD	
CC(C)Cn1c(N)c(C(=O)COC(=O)[C@H](Br)C(C)(C)C)c(=O)n(C)c1=O	766750642	SUOUJZRAUQVELT-LBPRGKRZSA-N	432.315	1.321	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1cc(COc2ccccc2F)on1	767086407	JGQVUIMLZMCUTI-UHFFFAOYSA-N	440.435	1.860	50	20	IDGD	
COC(=O)C(C)(C)[C@H](NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)c1ccccc1	767146182	VLOMRFKBANEDJK-QGZVFWFLSA-N	437.460	1.547	50	20	IDGD	
Cc1ccc(S(N)(=O)=O)c(C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)c1	767191793	IGQIHWPOVRLVAB-UHFFFAOYSA-N	443.485	1.008	50	20	IDGD	
COc1cccc(C(=O)NNS(=O)(=O)c2ccc(OC[C@@H]3CCOC3)c(F)c2)c1O	767450555	MTWXPLURILGJSM-GFCCVEGCSA-N	440.449	1.579	50	20	IDGD	
CC(C)(C)OC(=O)C1CCC(NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)CC1	769709246	NUCIOVDWIULTIU-UHFFFAOYSA-N	429.481	1.507	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccnn2-c2cccc(F)c2)cc1C	770774806	VXDMGSMAXGGDMF-UHFFFAOYSA-N	425.420	1.793	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)c2cc(-c3ccc4c(c3)CCO4)no2)c1	771427449	XOWKVYLFBVWCFH-UHFFFAOYSA-N	432.392	1.766	50	20	IDGD	
Cc1ccc2ncccc2c1S(=O)(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	771608124	SCNDINDXFYGGJK-UHFFFAOYSA-N	432.889	1.823	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H]2CCCCO2)c1	772221668	TXVYWSLTFPLFBO-GOSISDBHSA-N	433.486	1.826	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)C(=O)Nc2ccc(F)cn2)c2ccccc2c1=O	773525900	VHAOOSVUAGCYHI-UHFFFAOYSA-N	426.408	1.130	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)c(F)c1	774007255	CPRYFBFSOJGRFN-JTQLQIEISA-N	437.811	1.819	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1cccc(-c2nncn2C)c1	774008011	DLLINDSUOZGOCY-LBPRGKRZSA-N	442.863	1.689	50	20	IDGD	
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	775687617	CKVUFZTVSPFXGO-UZLBHIALSA-N	425.489	1.856	50	20	IDGD	
O=C(COc1ccccc1-c1ccccc1)NNC(=O)NC[C@@H]1COC2(CCOCC2)O1	777756035	GUUDDJTYQLHRBN-GOSISDBHSA-N	441.484	1.985	50	20	IDGD	
O=C(NNC(=O)[C@H](O)Cc1cccc(C(F)(F)F)c1)c1csc(N2CCOCC2)n1	778291542	GZNONTUMMSRKBG-CQSZACIVSA-N	444.435	1.363	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)c2cc(S(=O)(=O)N3CCCC3)c(C)o2)nc1C	778424860	DUXSZSMAOJCBIS-UHFFFAOYSA-N	437.478	1.405	50	20	IDGD	
CN(C)C(=O)COc1ccccc1C(F)(F)C(=O)NNC(=O)COc1ccc(F)cc1	778531616	JHNVURHWISLJEU-UHFFFAOYSA-N	439.390	1.611	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cc3c(cc2F)NC(=O)CC3)c1C	778708029	TWHGZDQIYUMUBU-CYBMUJFWSA-N	442.447	1.881	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@@H](C)CCNC(=O)OC(C)(C)C)c2ccccc2c1=O	779388595	ULXHIPFBAWPVLS-ZDUSSCGKSA-N	446.508	1.664	50	20	IDGD	
CCn1cc(CC(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)cn1	780171873	SUWUTPVAPIANQL-UHFFFAOYSA-N	430.468	1.665	50	20	IDGD	
CCNC(=O)N(C)NC(=O)c1ccc(Cl)c(S(=O)(=O)N2C[C@@H](C)O[C@H](C)C2)c1	780711008	HZJOOVGFFNCWOQ-VXGBXAGGSA-N	432.930	1.444	50	20	IDGD	
COCCOC(=O)c1c(NC(=O)C(=O)NNc2cccc(F)c2)sc(C(N)=O)c1C	783039688	JOAXPVZLHRTPNS-UHFFFAOYSA-N	438.437	1.180	50	20	IDGD	
O=C(NNc1cccc(F)c1)C(=O)Nc1ccc(F)c(S(=O)(=O)N2CCOCC2)c1	783040384	OPHBLPIQIIPYEJ-UHFFFAOYSA-N	440.428	1.068	50	20	IDGD	
CC(C)N(C)S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2cncc(Cl)n2)cc1	783259722	JWXCQACTKWXTIB-UHFFFAOYSA-N	426.886	1.241	50	20	IDGD	
Cc1ccc(NNC(=O)C(=O)Nc2ccc(S(=O)(=O)NC3=NCCCCC3)cc2)nc1	783486092	XKWFSJAKHSWKNF-UHFFFAOYSA-N	444.517	1.723	50	20	IDGD	
CC(=O)N(C)c1cccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)c1	784215967	KEEUADCSTHETFY-UHFFFAOYSA-N	445.501	1.192	50	20	IDGD	
Cc1c(NNC(=O)C(=O)Nc2ccc(F)c(-n3nnnc3C3CC3)c2)cccc1[N+](=O)[O-]	784354066	YFHMVYUYSCXFEI-UHFFFAOYSA-N	440.395	1.977	50	20	IDGD	
COc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NNc1ccnc(Br)c1	784828664	NPQKCWUVUPCIHG-UHFFFAOYSA-N	436.266	1.636	50	20	IDGD	
CCN1CCN(C(=O)c2ccc(NC(=O)C(=O)NNc3cccnc3Cl)cc2)CC1	784839252	SMGOWJPZWGXGAL-UHFFFAOYSA-N	430.896	1.595	50	20	IDGD	
CSc1nnnn1-c1cccc(NC(=O)C(=O)NNc2ccc(C(F)(F)F)nn2)c1	784886201	MBOCPCFMDFXMHA-UHFFFAOYSA-N	439.383	1.275	50	20	IDGD	
Cc1ccc(I)cc1NC(=O)C(=O)NNc1ccnc(N(C)C)n1	784970170	SPUSZGJEJKAROS-UHFFFAOYSA-N	440.245	1.537	50	20	IDGD	
CCOC(=O)c1cnn(C)c1NC(=O)C(=O)NNC(=O)CSc1ccc(Cl)cc1	786414102	JRFSSNDBDHOAOA-UHFFFAOYSA-N	439.881	1.128	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cnc(O)c3ccccc23)cc1	786687533	LUHXXDDISSDXSV-UHFFFAOYSA-N	428.470	1.331	50	20	IDGD	
Cc1ccc(C)c(S(=O)(=O)Oc2ccc(C(=O)NNC(=O)N3CCN(C)CC3)cc2)c1	788169319	MUMYZYNHVLKGSS-UHFFFAOYSA-N	446.529	1.673	50	20	IDGD	
COC(=O)[C@H](CNS(=O)(=O)CBr)Oc1ccc(Br)cc1	790475037	IPTVHQKTXGBMGA-JTQLQIEISA-N	431.102	1.641	50	20	IDGD	
CN(C)N(C(=O)[C@@H]1CCN(c2cc(Cl)ccc2Cl)C1=O)[C@H]1CCS(=O)(=O)C1	792851930	YTNHDFUBJCRDDX-QWHCGFSZSA-N	434.345	1.839	50	20	IDGD	
CCOC(=O)c1nn(C)cc1/C=C(/C#N)C(=O)Nc1c(C)n(C)n(-c2ccccc2)c1=O	792865304	DCLVQMXKMWJGFU-PTNGSMBKSA-N	434.456	1.940	50	20	IDGD	
COc1ccc(Cn2cc(NC(=O)C(=O)NNC(=O)c3cccc(OC)c3O)cn2)cc1	793026983	VZPRDHHIGMLSQJ-UHFFFAOYSA-N	439.428	1.054	50	20	IDGD	
CNS(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)c2ccc3ccccc3c2)cc1C	794579437	KFHXECMJJYEPIE-UHFFFAOYSA-N	433.511	1.680	50	20	IDGD	
O=C(NNC(=O)[C@H]1CN(Cc2ccccc2)CCC1(F)F)c1ccc(-n2cnnn2)cc1	794783824	JYIYFOWACHFYBG-GOSISDBHSA-N	441.442	1.581	50	20	IDGD	
Nc1cc(Cl)c(Cl)cc1C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	797484296	ZPOUTVLAFUTTKS-HNNXBMFYSA-N	440.239	1.720	50	20	IDGD	
CC(=O)N[C@](C)(C(=O)NNc1ncnc2ccsc12)c1ccc(S(C)(=O)=O)cc1	797744603	ZJKUVVUEIYMMAN-SFHVURJKSA-N	433.515	1.589	50	20	IDGD	
Cc1ccc(-n2cnnc2)c(C(=O)N2CCN(S(=O)(=O)CBr)CC2)c1	797973087	NRHCKIDOMVXDIK-UHFFFAOYSA-N	428.312	1.016	50	20	IDGD	
C[C@@H](c1ccc(S(N)(=O)=O)cc1)N(C)C(=O)NNC(=O)c1cnn(-c2ccccc2)c1	799927273	XOSVAXQWUZAWMB-AWEZNQCLSA-N	442.501	1.567	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNS(=O)(=O)c1c(Cl)cccc1Br	800837010	JLNSPVCFCXZQLN-UHFFFAOYSA-N	426.720	1.717	50	20	IDGD	
C[C@@]1(c2ccc(C(=O)NNC(=O)Nc3ccc(Br)cc3)cc2)NC(=O)NC1=O	801998241	VMSIVKZFYYZMCA-SFHVURJKSA-N	446.261	1.970	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccccc2)C1)Nc1ccc2c(c1)OCO2	802106669	PCSKOMYNIYYKGN-CQSZACIVSA-N	446.485	1.669	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)[C@H]1CCS(=O)(=O)c2ccccc21	802945805	MILMLTDALAPUCL-AWEZNQCLSA-N	425.507	1.400	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)[C@H]1CN(Cc2ccccc2)CCC1(F)F	803053909	IRGQZWQBKVCIJD-OAHLLOKOSA-N	426.464	1.816	50	20	IDGD	
CC(C)(CNC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)Oc1cc(F)cc(F)c1	804869160	VFGOYNGNMZIONC-UHFFFAOYSA-N	431.403	1.742	50	20	IDGD	
Cc1ccnc(C)c1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	806537665	OPDAHMHZYCNQEN-UHFFFAOYSA-N	433.490	1.186	50	20	IDGD	
CNC(=O)c1cccc(NC(=O)NNC(=O)c2cccc(OC)c2O)c1Br	806734859	GLPRIOHKTFNSKF-UHFFFAOYSA-N	437.250	1.989	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)Nc1cc(C(=O)OC)c(Br)cc1C	806738662	KKAOQQJGYGBJKZ-JTQLQIEISA-N	432.271	1.748	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2cc(F)c(N3CCOCC3)cc2F)c1	806973534	QMSAOBPAYLHTBV-UHFFFAOYSA-N	448.426	1.275	50	20	IDGD	
Cn1ncc(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)c1-c1ccccc1	806993206	UBHUFMSNBHMOOT-UHFFFAOYSA-N	431.456	1.302	50	20	IDGD	
CCS(=O)(=O)c1ccc([C@H](C)NC(=O)NNC(=O)COc2ccc(OC)cc2)cc1	807270765	XZTKSDDKHGMHHY-AWEZNQCLSA-N	435.502	1.959	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H]2C[C@@H](c3ccccc3)OC2=O)c1	809541982	SGWRRIBEUQSSCZ-SJORKVTESA-N	431.470	1.002	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)NCC(=O)NNC(=O)CCCc2ccccc2)cc1	810337066	FGQBAWVDIVXLHJ-UHFFFAOYSA-N	432.502	1.094	50	20	IDGD	
COC[C@@]1(C(=O)NNC(=O)COc2ccc(F)cc2)CCN(C(=O)OC(C)(C)C)C1	811871453	FPAKRNQITFIZOM-HXUWFJFHSA-N	425.457	1.626	50	20	IDGD	
O=C(NCCc1c[nH]c2cccc(Br)c12)NNC(=O)C(=O)Nc1ccccn1	812512788	JQSCALNRTCABDH-UHFFFAOYSA-N	445.277	1.837	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2ccc3c(C)nn(C)c3c2)c2ccccc2c1=O	812979530	WIFMMPUKAGTTGP-UHFFFAOYSA-N	447.455	1.011	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccc(-n3cccn3)c(F)c2)cc1	813033585	ALKCODNXKLNQKX-UHFFFAOYSA-N	446.464	1.344	50	20	IDGD	
Cc1csc2ncc(C(=O)NNC(=O)[C@@H]3CCCN(C(=O)OC(C)(C)C)C3)c(=O)n12	816511000	LRQWIVKBEGGFGF-GFCCVEGCSA-N	435.506	1.473	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(N3CCCS3(=O)=O)c2)cc1C	837299566	VUINEFREKCYWAH-UHFFFAOYSA-N	430.486	1.243	50	20	IDGD	
CN(C)N(C(=O)c1ccc(F)c(S(=O)(=O)NC(C)(C)C)c1)[C@@H]1CCS(=O)(=O)C1	914604515	NEBDNSWPSNACKM-CYBMUJFWSA-N	435.543	1.008	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)c1cc(S(=O)(=O)NC(C)C)ccc1F	914880391	KYQIDPACRWXBKE-UHFFFAOYSA-N	439.465	1.361	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NC[C@H](C(C)C)N2CCOCC2)nc1	916254053	FPZRQVQBANRZDQ-QGZVFWFLSA-N	442.586	1.095	50	20	IDGD	
Cc1ccc(C(=O)NCCNC(=O)NNC(=O)c2nnc(O)c3ccccc23)cc1F	916272281	JMOTVIRLMGHOAW-UHFFFAOYSA-N	426.408	1.157	50	20	IDGD	
CC(=NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1)c1ccc(N2CCOCC2)cc1	916276655	LAKYITCHZRKCKA-UHFFFAOYSA-N	444.557	1.993	50	20	IDGD	
COc1ccc2c(c1)C(=NNC(=O)c1ccc(S(=O)(=O)N3CCCC3)cc1)C(=O)N2	916323979	UNLXKAKUUQBKHX-UHFFFAOYSA-N	428.470	1.566	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)NCc2cccc(CN3CCCC3=O)c2)nc2ccccc21	916415126	JXSCREDGAIWGGP-UHFFFAOYSA-N	434.500	1.769	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CN2CCC(C(=O)NCc3ccc(F)cc3)CC2)cc1	917141698	NQUNYMBIJNZDRT-UHFFFAOYSA-N	426.492	1.924	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)CCCOc2cccc(F)c2)cc1	918292496	KPONZIALDMVOCV-UHFFFAOYSA-N	437.493	1.761	50	20	IDGD	
O=C(CN1CCC[C@@H](C(=O)Nc2ccc(Cl)cn2)C1)NNC(=O)c1ccc(F)cc1	919673795	YKBJVZIQQAHSFT-CQSZACIVSA-N	433.871	1.986	50	20	IDGD	
CCCCNC(=O)NNS(=O)(=O)c1cc2c(cc1Br)CCN2C(C)=O	920757229	GMEOISGWIWIABY-UHFFFAOYSA-N	433.328	1.651	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)NC[C@@H](c1cccc(F)c1)N1CCOCC1	921200469	XOFOECBDHOGSPB-IBGZPJMESA-N	430.480	1.781	50	20	IDGD	
O=C(COC(=O)c1cc2cc(Cl)ccc2[nH]1)NNC(=O)[C@H]1COc2ccccc2O1	928990805	XYBFIRCLLJIGPQ-QGZVFWFLSA-N	429.816	1.966	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCC(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)cc1	1317745611	BIWIQCNWBLHNEY-ZDUSSCGKSA-N	439.465	1.118	50	20	IDGD	
Cc1nn([C@@H]2CCS(=O)(=O)C2)c2nc(C3CC3)cc(C(=O)NNc3ncc(F)cn3)c12	1319577127	PXMFPRQFLFQLBP-CYBMUJFWSA-N	445.480	1.663	50	20	IDGD	
CCOC(=O)c1ccc(NNC(=O)CNS(=O)(=O)c2ccc(OCC)cc2)cc1C	1343634640	KPPDSUVLJGGKMX-UHFFFAOYSA-N	435.502	1.992	50	20	IDGD	
Cc1nc2ncccn2c1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2	1777901245	AMHQVCHFFBCRCZ-RTBURBONSA-N	440.331	1.718	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4cncn4c3)C2)C1	1778695324	GVBPIODJROBCRE-APWZRJJASA-N	435.322	1.951	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cnnc3ccccc13)CCO2	1779295639	UWSAPJQRHPADIC-NRFANRHFSA-N	428.565	1.925	50	20	IDGD	
C[C@@H](CS(C)(=O)=O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CO[Si](C)(C)C)C1	1779539748	KVKSDAZSIAQQSE-FRQCXROJSA-N	448.658	1.033	50	20	IDGD	
CCc1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](Cl)COC)C3)n(C)n1	1779768485	PGCGSDCRVZBJRY-XAUMDUMWSA-N	426.945	1.364	50	20	IDGD	
COc1cc(C(=O)N2CC[C@@]3(CN(C(=O)CCBr)CCO3)C2)cc(Cl)n1	1779792254	WNYGXIGDIAFPPH-QGZVFWFLSA-N	446.729	1.972	50	20	IDGD	
Cc1nccnc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Br)C2	1779875331	LHULLKCWKALVGW-HACGYAERSA-N	429.290	1.603	50	20	IDGD	
CCOc1ccc(C(=O)N2CC[C@@]3(CN(C(=O)CCBr)CCO3)C2)nn1	1780428231	WZYUQYFTPNZVPD-QGZVFWFLSA-N	427.299	1.104	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)CCO2)C1	1781233636	CKVRAUMONOOWRY-QZTJIDSGSA-N	446.287	1.980	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)nn1C(F)F	1781334469	NZSWVCFZCOCONJ-ABAIWWIYSA-N	439.232	1.721	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1cc(C)[nH]n1)C2	1781900967	GULSWMWRKCWMLW-FRQCXROJSA-N	441.370	1.948	50	20	IDGD	
COc1cc(C)c(C(=O)N2CC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c(C)c1	1781925107	IHHBHEHYOXXUHB-HSZRJFAPSA-N	446.548	1.129	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1ccc(C#N)cc1)C2	1782167268	JYOYSZMRTYJYJQ-WOIUINJBSA-N	433.936	1.868	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)C[C@H](N)c3cccnc3)CCO2)C1	1783344090	YQOIKRTVWJGDGH-TXPKVOOTSA-N	439.354	1.475	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccn(C(F)F)n3)CCO2)C1	1783349519	MPORLPPJRRSTPQ-MEDUHNTESA-N	435.269	1.895	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cnn(-c4cccnc4)c3)CCO2)C1	1783533293	YWXLHYWTRDFKNO-LIRRHRJNSA-N	448.321	1.494	50	20	IDGD	
Cc1cc2cc(C(=O)N3CCO[C@]4(CCN(C(=O)CCC(=O)NN(C)C)C4)C3)ccc2[nH]1	1783936171	DXNMDMMOJUTJHY-QHCPKHFHSA-N	441.532	1.293	50	20	IDGD	
O=C(C(Cl)Cl)N1CC[C@]2(C1)CN(C(=O)[C@@H]1CC(c3ccccc3)=NO1)CCO2	1783942058	GUMOQXZBELSTQW-KXBFYZLASA-N	426.300	1.813	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C34CC(c5ccccc5)(C3)C4)C[C@@H]21)[C@@H](O)CCl	1784096778	MVZLJYYCIQSJRE-FYJNAVQZSA-N	432.948	1.688	50	20	IDGD	
Cc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Br)C[C@@H]32)cnc1C	1785514394	MWUDYDJEEZBHSD-TUUVXOQKSA-N	428.302	1.982	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc(OCF)cn3)[C@H]2C1	1785687085	YGNRHNBJFYWXQA-YXWQFLTLSA-N	428.892	1.783	50	20	IDGD	
O=C1CN(CC(=O)Nc2ccc(C3(NC(=O)[C@@H](F)Br)CCC3)cc2)C(=O)N1	1786686429	FCBUULFSLVRRJI-CQSZACIVSA-N	441.257	1.363	50	20	IDGD	
COc1cc(C(=O)NC2(c3ccc(NC(=O)c4ccc(B(O)O)cc4)cc3)CCC2)nn1C	1788144265	CKAFVGSHYRUVRU-UHFFFAOYSA-N	448.288	1.170	50	20	IDGD	
CCCC(=O)N[C@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]2C1	1789870227	ABWYKHJUYKGKNT-FACIQBDNSA-N	436.380	1.507	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)c1ccc(O)c(F)c1	1790067681	VTYIIEDZUVYFSR-LWWSYDQCSA-N	433.249	1.815	50	20	IDGD	
COc1c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](O)CCl)C[C@@H]32)ccc(F)c1F	1790168359	MNIZWUWTWKFLDI-LVGORTOPSA-N	432.851	1.166	50	20	IDGD	
O=C1CN(CC(=O)NC2(c3ccc(NC(=O)[C@@H](F)Br)cc3)CCC2)C(=O)N1	1790532807	VDXWZEOFFPGZFO-CQSZACIVSA-N	441.257	1.363	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CC(=O)OC(C)(C)C)C[C@@H]21	1790958314	OZYZLBKNARNONW-AJNGGQMLSA-N	447.370	1.871	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cscn3)C[C@@H]21	1790962273	YLPHVHMEDCEQIV-MXAVVETBSA-N	430.368	1.839	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4ccccn4n3)C[C@@H]21	1791058117	ZAEGTJLHSZOKBX-RMRKRWHISA-N	435.322	1.711	50	20	IDGD	
CN(CC(=O)Nc1ccc(C2(NC(=O)[C@@](C)(Cl)CCl)CCC2)cc1)C(=O)C(=O)O	1791098457	OUQQGGGRPXOCLC-SFHVURJKSA-N	444.315	1.900	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1ccc(C2(NC(=O)c3csc(N)n3)CCC2)cc1	1791600032	OZGNHRWVPMHOFK-UHFFFAOYSA-N	430.534	1.846	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1(c3cccc(Cl)c3)CC1)C2)[C@@H](O)CCl	1792981712	PRLXTSFVSGWDPG-RMHZUWNSSA-N	427.328	1.561	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CC(c3ccccc3)=NN1)C2	1795116635	ZWIVTMOVXBELBC-LORHWOILSA-N	449.349	1.127	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc([N+](=O)[O-])cc3c1OCC3)C2)[C@H](F)Cl	1796366469	WGUISNYLOUOZKJ-VAECKANCSA-N	427.816	1.267	50	20	IDGD	
C[Si](C)(C)c1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Br)C3)co1	1797726026	ITZLSRFZUCQHAJ-AYRXBEOTSA-N	447.377	1.719	50	20	IDGD	
CCOC(=O)c1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CO[Si](C)(C)C)C3)ccn1	1798686621	SQFFFVRGUIAUOD-HGKCTWBKSA-N	449.580	1.313	50	20	IDGD	
CC(=O)NCCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O	1799221053	HIHRORQLFHURDG-MUJYYYPQSA-N	446.460	1.298	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3cccnn3c1)C2)[C@H](F)Br	1799347183	MNLGXINKEBTUML-NEBZKDRISA-N	425.258	1.228	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1(Br)CC1	1799355341	BZJUFUYTLCYQFG-WISYIIOYSA-N	438.160	1.535	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1cn2c(nc1=O)SCC2)C(Cl)Cl	1799843982	MZLUNGSEGAWRJY-ZSBIGDGJSA-N	431.345	1.333	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](O)CCNC(=O)OC(C)(C)C)C2	1800074902	IQEZZMCPFBLYHU-YIDVYQOGSA-N	431.961	1.918	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)Oc1ccccn1)C2	1800643964	ALVFLSAKDBMLQF-JBXGNFEISA-N	440.338	1.612	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cc(F)ccc1[N+](=O)[O-])C2)C(Cl)Cl	1801021153	KCVRFGPFGKYDBI-QHBPRCKVSA-N	434.251	1.670	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](O)c1ccccc1Cl	1801200335	HGMBQGQKQVFQKF-QMWOBKFGSA-N	431.316	1.217	50	20	IDGD	
CC(=O)NCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](Br)Cc1ccccc1)C2	1801661574	ZKVLBNWQCRTNTH-MHORFTMASA-N	436.350	1.767	50	20	IDGD	
COc1ncc(C(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)cc1F	1803140171	BCYHWAMIKPFBHQ-COXVUDFISA-N	436.871	1.544	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CCOC1	1803226199	NIMHYPDZONFYFP-LJIZCISZSA-N	429.945	1.793	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)CS(=O)(=O)CC)[C@H]1c1cccnc1	1803510080	PPFILHMYWVJVAE-SOLBZPMBSA-N	429.970	1.930	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)[C@H](C)CC(N)=O)[C@H]1c1cccnc1	1803672723	UYWLWSJOQHSDQL-FAXLKDOZSA-N	425.327	1.382	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)COc2cccnc2)[C@@H]1c1cccnc1	1804338201	CIECKAJAAQPSJH-QRFRQXIXSA-N	432.908	1.815	50	20	IDGD	
COc1cccc(CC(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@H]2c2cccnc2)n1	1804393407	ASCHUWKBRCDACZ-VPWXQRGCSA-N	432.908	1.333	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H](CNC(=O)c2ncnn2C)[C@H]1c1cccnc1	1805273096	LKUXALNWXZGXOG-BPLDGKMQSA-N	435.326	1.561	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC2(CCN(C(=O)CNC(=O)N(C)C)CC2)C1	1805382393	FKVKLCXERQIIOW-AWEZNQCLSA-N	431.375	1.520	50	20	IDGD	
Cc1ccsc1C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1805395763	DXUNNQYFFGRCGB-UYAOXDASSA-N	449.341	1.765	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC2(CCCN(C(=O)c3ccn(C(C)(C)C)n3)C2)CC1	1807676206	LPEDJLAKQIFARV-UHFFFAOYSA-N	446.596	1.856	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC2(CCCN(C(=O)c3ccnnc3)C2)CC1	1808174469	IZYYCRXGZAJSCM-WGOQTCKBSA-N	437.504	1.455	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)c2ccc[nH]2)[C@H]1c1cccnc1	1808417931	UABQGGNHVAPAQV-FIAMHUAMSA-N	447.499	1.863	50	20	IDGD	
CC(=O)NCCC(=O)N1CC[C@H](CNC(=O)[C@@H](F)Br)[C@@H]1c1cccnc1	1808678335	HPFSCFSNLGQJDH-VNQPRFMTSA-N	429.290	1.304	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CO)C(=O)N1CCC2(CCCN(C(=O)[C@H](F)Cl)C2)CC1	1810901288	NYDOYSPSURWNFK-KBPBESRZSA-N	435.924	1.638	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1cccc(F)c1	1811800835	PZWVTZRSIPJGPC-KNQAVFIVSA-N	447.275	1.534	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)[C@H](C)n2ccccc2=O)[C@@H]1c1cccnc1	1813031459	OCCKEZFKSWWGME-TXJVSEOTSA-N	446.935	1.764	50	20	IDGD	
CC(C)(CCl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CNCP(=O)(O)O)[nH]n1	1814693829	DMUKKXMGEZDWCQ-LBPRGKRZSA-N	435.849	1.392	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)C[C@H](NC)C(=O)O)sc2C1	1815087497	YXTRWHXUCRCSQK-YWVKMMECSA-N	447.355	1.291	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)Cc3ccn(C)n3)sc2C1	1815553528	QPRCZQXARAOWOX-ZJUUUORDSA-N	426.340	1.815	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](O)c2ccccc2)[nH]n1)c1cccc(B(O)O)c1	1817473455	VEDMAWIVNDHCPO-FPOVZHCZSA-N	448.288	1.129	50	20	IDGD	
Cc1onc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)c1C	1817473924	GYEPAQAJODJPJF-KRWDZBQOSA-N	437.265	1.314	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H]2CCC=CO2)n[nH]1	1819375549	WESSIAZYWUUOHY-SJORKVTESA-N	439.476	1.407	50	20	IDGD	
O=C(N[C@@H]1CCc2nc(NC(=O)[C@H]3CC(c4ccccc4)=NN3)sc2C1)[C@@H](O)CCl	1824427947	PYSZKDZWKISXHL-WQVCFCJDSA-N	447.948	1.421	50	20	IDGD	
CC[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CSC(=N)N)CC2	1825447166	QSHWTZLBYVLBQS-HTQZYQBOSA-N	434.385	1.855	50	20	IDGD	
Cc1cncc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)c1	1826009974	XFXJLDRQLLXNMQ-FQEVSTJZSA-N	429.565	1.996	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)/C=C/c1ccoc1)CC2	1826084024	XSWROOPHAABVDX-BOTMBNHJSA-N	431.518	1.735	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](O)c1ccccc1)CC2	1826085356	NZBUZMRJPBGFLD-IFXJQAMLSA-N	445.545	1.162	50	20	IDGD	
Cc1cnn([C@H](C)C(=O)N[C@@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)c1	1826092067	KKDYJRZNQUEEEL-ZIAGYGMSSA-N	447.565	1.194	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CCN2CCN(C)CC2)CC1	1826727010	YDSROWSWZASINW-UXHICEINSA-N	443.032	1.497	50	20	IDGD	
O=C(C(Cl)Cl)N1CCC([C@H]2CCCCN2C(=O)c2cc(=O)n3[nH]cnc3n2)CC1	1827048245	IXRCMJVAJRJTJV-CYBMUJFWSA-N	441.319	1.455	50	20	IDGD	
C[C@@]1(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2ccc(B(O)O)cc2)CC3)CC1(F)F	1828047760	UMRCVUSJXPITTR-SGTLLEGYSA-N	435.261	1.094	50	20	IDGD	
O=C(C1CC1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCN2C(=O)OCc1ccccc1	1828552001	ZJSZZAQDJXYXQU-PGRDOPGGSA-N	449.935	1.448	50	20	IDGD	
C=CCO[C@@H](C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1	1828923959	ZJKFEQHSRIAOCP-JXFKEZNVSA-N	443.548	1.510	50	20	IDGD	
C[C@]1(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)CC2)CC1(F)F	1828925269	IDWXBNWTQPROSQ-DYESRHJHSA-N	449.502	1.964	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccnc3S)CCO2)C1	1829798912	RCIIJLVJVRTWID-MSOLQXFVSA-N	448.372	1.677	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1CCCCO1)CCO2	1829926871	UDIVGOGYWKKPKC-RLFYNMQTSA-N	433.343	1.185	50	20	IDGD	
O=C(COc1cccc(Cl)c1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1830278521	DCTCHLYRORNXRR-AEFFLSMTSA-N	435.279	1.710	50	20	IDGD	
CN(C)C(=O)NCC(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](F)Br)CC1	1830378164	CJZONRLKBJHQHO-DZGCQCFKSA-N	435.338	1.568	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)COC(C)(C)C)C2)C1	1830535639	ROQGDIXVNUBHKS-KDOFPFPSSA-N	435.359	1.289	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)c(C)o1	1830537839	QCOSFZWKRNJNKO-BFUOFWGJSA-N	443.338	1.997	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3ccoc3)C2)C1	1830545687	LRPQBRNUJVVHOX-HNAYVOBHSA-N	443.338	1.700	50	20	IDGD	
O=C(c1cc(Cl)ccc1F)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1830719404	CSQRLHVURHKXTP-MAUKXSAKSA-N	435.279	1.149	50	20	IDGD	
O=C([C@H](F)Cl)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CCc3ccccc3[C@@H]1O)CCO2	1830824718	NHVVKGJRTUDLOJ-OEMYIYORSA-N	440.899	1.273	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(NC(C)=O)o3)C2)C1	1831651987	VKYHJWKOGJIWEN-QRWLVFNGSA-N	441.912	1.716	50	20	IDGD	
Cc1nn(C)c(C)c1C(=O)N1CCC([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1	1831870374	AJTHBCHGOQPZPL-IBGZPJMESA-N	446.596	1.643	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H](N)c2ccccn2)CC1	1831870846	GONMIWRRVLSTTP-UGKGYDQZSA-N	444.580	1.074	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)C(C)(C)NCCC#N)CC1	1831871804	XILKHTZGZNJQEH-IBGZPJMESA-N	448.612	1.261	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CCS(C)(=O)=O)CC1	1832399043	HBRXPZJSQFCLEJ-ZFWWWQNUSA-N	437.400	1.824	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@]3(F)CCCC=C3F)CC2)CC1)[C@H](O)CCl	1833313621	NCUGNEDMVRKSDZ-UZLBHIALSA-N	433.927	1.903	50	20	IDGD	
CCCC(=O)N[C@H](C)C(=O)NC1CCN(C2CCN(C(=O)[C@H](Cl)COC)CC2)CC1	1835820663	DMNSPHLQFKPUQD-CRAIPNDOSA-N	445.004	1.117	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCC(N2CCC(NC(=O)c3cnc(O)[nH]3)CC2)CC1	1835964229	HITKFKTWYZAGAS-GOSISDBHSA-N	432.352	1.537	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3ccc(O)nc3)CC2)CC1	1836144708	KIROSDXSUPCOIB-ZDUSSCGKSA-N	439.354	1.756	50	20	IDGD	
CCOC(=O)C1(C(=O)N2CCC(N3CCC(NC(=O)[C@@H](Cl)CC)CC3)CC2)CC1	1836397198	BFCRAUPGZVMVLZ-KRWDZBQOSA-N	427.973	1.919	50	20	IDGD	
C[C@@H]1C[C@@]1(C)C(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1	1837921590	RCWPCKOKHPOJJS-WAIKUNEKSA-N	428.338	1.025	50	20	IDGD	
O=C(c1csc(C(F)(F)F)n1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1838189333	LKMKBJNPVSMJRJ-YGRLFVJLSA-N	445.822	1.766	50	20	IDGD	
CCOc1cccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](Cl)COC)C3)C2)c1	1839020222	QYDKTCYZHGZGOK-GHTZIAJQSA-N	440.924	1.409	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3CCc4ccccc4O3)C2)C1	1839149024	QJZPJWKPCFFAAC-JLMWRMLUSA-N	436.936	1.854	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)Oc3ccccn3)C2)C1	1839149244	ZBWDNMMQLZJHIM-FTRWYGJKSA-N	425.913	1.323	50	20	IDGD	
O=C(COc1ccccc1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839199241	LACGIQLFGNSANR-AEFFLSMTSA-N	445.285	1.212	50	20	IDGD	
O=C(c1ccc(O)c([N+](=O)[O-])c1)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1839275061	IXOQMGMUVUCJSV-KRWDZBQOSA-N	448.259	1.174	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)COc3ccccc3C)C2)C1	1840152156	ZJKQKQVRBPZZKR-LAUBAEHRSA-N	440.924	1.084	50	20	IDGD	
Cc1nccn1CCCC(=O)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1840388717	HTIMSWKFMUUAEZ-SFHVURJKSA-N	433.336	1.232	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC2(CCCN2C(=O)c2nc(OC)ccc2[N+](=O)[O-])C1	1843586856	WCWOYTQWYXLOJN-NSHDSACASA-N	441.282	1.989	50	20	IDGD	
C#CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)CO[Si](C)(C)C)C1	1844379798	MNGCUKMLPPFCJU-INIZCTEOSA-N	437.613	1.958	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)c2cnc3cccc(Cl)c3c2)C1	1845700275	WVHSACIVNQFEEM-UHFFFAOYSA-N	449.703	1.699	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H]1CCC[C@@H](C(=O)N2CCCC23CN(C(=O)[C@@H](O)CCl)C3)C1	1846931744	GWBYXPKVHKHQHA-PMPSAXMXSA-N	443.972	1.873	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)(C)O)C1	1847092642	VCBZXFMOQXBECO-UONOGXRCSA-N	447.960	1.108	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](O)CCl)[C@H](F)C1	1847556281	GWIUQTOZCBVKIW-OWYFMNJBSA-N	447.935	1.383	50	20	IDGD	
O=C(Cn1nnc2ccccc2c1=O)NNC(=S)Nc1cccc(Br)c1	16108020	UARJUJPUGHXZEU-UHFFFAOYSA-N	433.291	1.572	50	20	IDGD	
COC(=O)c1ccc(C(=O)OC)c(S(=O)(=O)NNC(=O)c2cn(C)c3ccccc23)c1	17320129	PONRTDXSXABYCS-UHFFFAOYSA-N	445.453	1.375	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)cc1	24295845	QZVXPJZROPKVNL-KXBFYZLASA-N	449.504	1.902	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)c2cccc(CN3C(=O)CNC3=O)c2)cc1OC	28078331	UIPGHKVHBLEAMI-UHFFFAOYSA-N	426.429	1.221	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)CCNS(=O)(=O)c2c(C)cc(C)cc2C)cc1	104748154	XVVJTMAHBLTHQC-UHFFFAOYSA-N	432.546	1.848	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)N1CCN(Cc2cccc(Cl)c2)CC1	725873303	WMFJKWCKVZBVDA-UHFFFAOYSA-N	435.937	1.690	50	20	IDGD	
CO[C@@H](C)CCNC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	726714380	QKFAUNFDZZNVOS-LBPRGKRZSA-N	426.520	1.918	50	20	IDGD	
COc1ccc(Cl)cc1NCC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	727098960	KZPSCOCKFXGJTB-UHFFFAOYSA-N	440.909	1.472	50	20	IDGD	
C#Cc1cccc(NC(=S)NNC(=O)CN2C(=O)N[C@@](C)(c3ccc(C)cc3)C2=O)c1	727498646	XNEXYUBWAMFADB-QFIPXVFZSA-N	435.509	1.761	50	20	IDGD	
CCCS(=O)(=O)N1CCCC[C@@H]1C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	728211061	FPGIHUAQWXNOLU-QGZVFWFLSA-N	444.579	1.165	50	20	IDGD	
COc1ccc(CCC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)cc1	728212789	DYXYVNRTGGDWSE-UHFFFAOYSA-N	432.546	1.707	50	20	IDGD	
Cc1nc(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)nn1-c1c(Cl)cccc1Cl	728269825	YYGFULRIBKTXLL-SECBINFHSA-N	447.304	1.014	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2cc(C(F)(F)F)ccc2F)c1	728504235	GSDQEZVZUFOQKE-UHFFFAOYSA-N	440.396	1.871	50	20	IDGD	
COc1ccccc1[C@@H](C)CC(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	728658133	GKSDHIAIQXKTEU-IFXJQAMLSA-N	428.441	1.719	50	20	IDGD	
N#Cc1ccccc1N1CCN(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)CC1	728961986	UAHOQMOOISSPEZ-UHFFFAOYSA-N	434.504	1.128	50	20	IDGD	
Cc1ccccc1-c1nn(-c2ccccc2)cc1C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O	729277151	SPZQMDOTZSROCD-HNNXBMFYSA-N	441.513	1.546	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)NCc1ccc(CN2CCC(O)CC2)cc1	729621718	RUYBMVAAJJYJJB-UHFFFAOYSA-N	437.500	1.424	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)CCNS(=O)(=O)c2ccc(F)c(F)c2)cn1	729692133	KTEPICJXICPJOW-UHFFFAOYSA-N	445.473	1.055	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)[C@H](CC(C)C)N2C(=O)[C@H]3CC=CC[C@H]3C2=O)cn1	729692360	FVOHHNFSMSSWKO-XHSDSOJGSA-N	445.545	1.774	50	20	IDGD	
COc1cc(Cl)ccc1CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	730915188	ZNDNEBNZLLCXEA-UHFFFAOYSA-N	440.909	1.743	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Cc2ccccc2F)cc1S(=O)(=O)N1CCCC1	731328771	XALRFYBVOOCHPT-UHFFFAOYSA-N	435.477	1.623	50	20	IDGD	
COc1cc(-c2nn(CCC#N)cc2/C=C(\C#N)C(=O)NCC(N)=O)ccc1OC(F)F	731473749	XTDKRMMNJBNSKQ-NTUHNPAUSA-N	444.398	1.582	50	20	IDGD	
O=C(NCCCCN1CCC(Cc2ccccc2)CC1)NNC(=O)C(=O)N1CCCC1	731760945	JNAPGSAJEVDXIG-UHFFFAOYSA-N	429.565	1.674	50	20	IDGD	
CN(C)[C@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)c1cccc(Cl)c1	731863914	JQIISXKAHGOVPP-KRWDZBQOSA-N	438.937	1.654	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)Sc1nnc(N2CCOCC2)n1Cc1ccccc1	731906315	XWGCBKHARGZYDC-MRXNPFEDSA-N	446.577	1.837	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2ccc3c(c2)OCCO3)c(F)cc1F	732046002	PKVYEHXREFAPMX-UHFFFAOYSA-N	428.369	1.146	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2ccc(S(N)(=O)=O)cc2)cc1Br	732307043	LZEXVQDJBOHEJA-UHFFFAOYSA-N	428.264	1.180	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2csc(CNC(=O)OC(C)(C)C)n2)C[C@H](C)O1	732828843	VCCFAHLBPCBJRS-STQMWFEESA-N	441.554	1.428	50	20	IDGD	
C[C@@H]1CCCC[C@H]1CCNC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	734071644	NTOXWELMZKWOID-SJORKVTESA-N	438.598	1.860	50	20	IDGD	
Cc1nc2cc(O)nn2c(C)c1CC(=O)NNc1ccccc1S(=O)(=O)NC(C)(C)C	734253379	ZHAGEVVPRIOAPT-UHFFFAOYSA-N	446.533	1.814	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2nc(-c3cccc(Cl)c3)no2)c1	734534276	NAPCBEWELDGALK-UHFFFAOYSA-N	449.876	1.938	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)CCCn2ccccc2=O)c1	735028370	LFNHKKJHKIFZCG-UHFFFAOYSA-N	434.518	1.120	50	20	IDGD	
CCc1nc(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)nn1-c1ccccc1	735420447	ACWNOARCLBDDDJ-UHFFFAOYSA-N	447.543	1.803	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@@H]2CN(Cc3ccccc3)CCO2)c2ccccc2c1=O	741207648	PMUYLBAWHIJSSV-IBGZPJMESA-N	435.484	1.078	50	20	IDGD	
CC(C)c1nn([C@H]2CCS(=O)(=O)C2)cc1C(=O)NNC(=O)c1cccc2ncccc12	742645963	AWDOTMOWAUYIHS-AWEZNQCLSA-N	441.513	1.989	50	20	IDGD	
COc1cc(C(=O)NNc2ccc(Br)nc2)cc(NS(C)(=O)=O)c1OC	743404630	AXWYABBNRQRHRQ-UHFFFAOYSA-N	445.295	1.990	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NN[C@H](C(N)=O)c2ccc(Br)cc2F)cc1C	743464572	KEYGKGZCKXQGTB-HNNXBMFYSA-N	437.269	1.991	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)N[C@@H]2CCN(Cc3ccccc3)C2=O)cc1	743576794	JBUMSQXYERMYIK-QGZVFWFLSA-N	445.501	1.227	50	20	IDGD	
Cc1cccc(NC(=S)NNC(=O)c2ccc(S(=O)(=O)CC(=O)N(C)C)cc2)c1	743820370	RGRDUJVKZYSNSW-UHFFFAOYSA-N	434.543	1.488	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@@H]2CCCN(C(=O)c3ccncc3)C2)cc1	743831614	ZXFGNIWPLRFVLC-OAHLLOKOSA-N	445.501	1.190	50	20	IDGD	
CCO[C@@H](C)c1nc(CN2CCN([C@@H](C)C(=O)NNC(=O)CC(C)C)CC2)cs1	744412985	LOYXHCRVQYUQQX-HOTGVXAUSA-N	425.599	1.940	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)c1cnn(CC(=O)NC2CCCCC2)c1	746677572	DAUZVJQDAOHZLN-UHFFFAOYSA-N	428.493	1.214	50	20	IDGD	
CCc1ccc(C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)cc1[N+](=O)[O-]	746689318	JQGSAQIRWQVADD-UHFFFAOYSA-N	448.505	1.245	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)c2cnn(CC(=O)NC3CCCCC3)c2)cc1	747018567	UZFUZHSPVDJYQQ-UHFFFAOYSA-N	441.488	1.258	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN(C(=O)c2ccc(Cl)c(Cl)c2)C1)C(=O)N1CCCC1	748240814	KSOMXZGYSMTCFX-ZDUSSCGKSA-N	441.315	1.615	50	20	IDGD	
CC1(C)NC(=O)N(CCCC(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)C1=O	748520829	VIFSQVWHJVQERD-UHFFFAOYSA-N	436.412	1.534	50	20	IDGD	
COc1ccccc1NCC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	748620514	QMGCNZZPXYBQMD-UHFFFAOYSA-N	433.534	1.187	50	20	IDGD	
COc1cc(S(=O)(=O)NNC(=O)c2cccc(OC)c2O)c(Cl)cc1C(=O)O	749144272	VSWIWWLVEURWAI-UHFFFAOYSA-N	430.822	1.384	50	20	IDGD	
CCn1c(NNC(=O)c2ccc(F)c(S(=O)(=O)NC3CC3)c2)nc2ccccc2c1=O	750851894	ZMXLMIZCBJVYQD-UHFFFAOYSA-N	445.476	1.753	50	20	IDGD	
CC(C)(C)NC(=O)CN1CCC(CNC(=O)NNC(=O)c2c[nH]c3ccccc23)CC1	751110460	DKQVIPBIYPIRLO-UHFFFAOYSA-N	428.537	1.739	50	20	IDGD	
O=C(NNC(=O)c1ccc2ccccc2n1)c1cccc(CN2CCS(=O)(=O)CC2)c1	751285083	XBDZWKOXMFBNTQ-UHFFFAOYSA-N	438.509	1.540	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C2CCN(S(=O)(=O)c3cccnc3Cl)CC2)o1	752524849	RDBHCTCFXSMYIN-UHFFFAOYSA-N	426.882	1.498	50	20	IDGD	
Cc1n[nH]c(C)c1[C@@H](C)C(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	752577254	FVNUQVDXMPNWPC-CQSZACIVSA-N	432.956	1.749	50	20	IDGD	
CCc1ccccc1-n1cc(O)c(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)n1	752790225	WTLSNYXOUMWXMK-UHFFFAOYSA-N	442.501	1.508	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)CCCSC(C)(C)C)CC1	754465736	MVFFVNFFROGZMV-UHFFFAOYSA-N	429.612	1.773	50	20	IDGD	
CCc1c(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)cnn1CCC(C)C	756175434	VCPNZBQCKYFHRI-UHFFFAOYSA-N	439.520	1.707	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1cc(Cl)c(F)c(Cl)c1	756189131	JNMSIACKWOSJJW-UHFFFAOYSA-N	433.248	1.710	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCN(C(=O)OC(C)(C)C)C[C@@H]2C)cc1OC	756528465	MGUYPAXTMLWPNO-AWEZNQCLSA-N	436.509	1.406	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)N[C@@H]1CCN(C(=O)CCc2ccccc2)C1	756983379	LENZRJKITWQVPS-GOSISDBHSA-N	438.484	1.636	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CSc1nnc(CO)n1-c1ccccc1	758002545	GLMQSAWBKYQMND-UHFFFAOYSA-N	447.904	1.975	50	20	IDGD	
O=C(NNc1nc(O)c2ccccc2n1)[C@H]1CN(Cc2nc(O)c3ccccc3n2)CCO1	758296276	WYUMXBKNMCLOTN-QGZVFWFLSA-N	447.455	1.328	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)[C@@H]2COc3ccc(Br)cc32)cc1	758664340	BIWOHXZPZCNPOP-OAHLLOKOSA-N	444.241	1.801	50	20	IDGD	
CC(C)(C)OC(=O)NC1(C(=O)NNC(=O)C(=O)Nc2ccccn2)Cc2ccccc2C1	758831754	SHOQIFNJSVUIGI-UHFFFAOYSA-N	439.472	1.230	50	20	IDGD	
CCCn1c(C)cc(/C=C(/C#N)C(=O)NS(=O)(=O)c2nnc(NC(C)=O)s2)c1C	759507887	BOCFAEMFWMZDKH-ZSOIEALJSA-N	436.519	1.737	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@@](C)(O)CN2C(=O)C(C)(C)c3ccccc32)cc1OC	760053543	XZOLJMJFKJTNSS-QHCPKHFHSA-N	441.484	1.540	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CNC(=O)c2ccco2)c(I)c1	760494412	XLMHFJQYZVIQRA-UHFFFAOYSA-N	443.197	1.084	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCCC(=O)NNc1ccc(C(F)(F)F)nn1	760920812	CTKSFPVTDVKSQX-NSHDSACASA-N	446.430	1.844	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)c2ccc([N+](=O)[O-])n2C)c2ccccc2c1=O	761446533	RPWJMJVNQKFSEL-UHFFFAOYSA-N	426.433	1.908	50	20	IDGD	
C[C@H]1C[C@@H](C)CN(C(=O)c2ccccc2NC(=O)C(=O)NNC(=O)c2ccccc2O)C1	763526657	DXEBRZIVQDFTTH-GASCZTMLSA-N	438.484	1.910	50	20	IDGD	
CC[C@@H](C)NS(=O)(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)c2ccccc2O)c1	763530857	JJIAWKYFRKRJQG-CYBMUJFWSA-N	448.501	1.010	50	20	IDGD	
COC(=O)c1cc(F)ccc1NC(=O)C(=O)NNC(=O)c1cc(OC)c(OC)c(OC)c1	763540557	WOYXTVKRKSESLZ-UHFFFAOYSA-N	449.391	1.038	50	20	IDGD	
O=C(NNC(=O)c1c[nH]c2ccccc12)C(=O)Nc1ccccc1S(=O)(=O)C(F)F	763541068	NXWHVGXDYZSTSF-UHFFFAOYSA-N	436.396	1.564	50	20	IDGD	
C=CCNC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)COc2cccc(C)c2)cc1	763619613	YEFFZIUPRAHIMR-UHFFFAOYSA-N	425.445	1.467	50	20	IDGD	
CC[C@H](C)n1ncc(NC(=O)C(=O)NNC(=O)COc2ccc(OC)cc2)c1C1CC1	763660645	FPBQVKSKGKWGDP-ZDUSSCGKSA-N	429.477	1.905	50	20	IDGD	
CCC(=O)Nc1ccc(C)c(NC(=O)C(=O)NNC(=O)COc2ccccc2OC)c1	763663758	YZIPDQBNOBILCL-UHFFFAOYSA-N	428.445	1.517	50	20	IDGD	
CC(C)(C)OC(=O)c1ccccc1NC(=O)C(=O)NNC(=O)COc1ccc(C#N)cc1	763680279	FEFZTGAZVIEVCF-UHFFFAOYSA-N	438.440	1.678	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(C)c(C(=O)OC)c1	763682963	XGJYFACTWALMFZ-UHFFFAOYSA-N	429.429	1.345	50	20	IDGD	
Cc1cccc2c1N(C(=O)C(=O)NNC(=O)COc1ccc(Br)cc1)CC2	763694083	FAMSGGWZGPGWCZ-UHFFFAOYSA-N	432.274	1.873	50	20	IDGD	
O=C(CSc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1cccc(-n2ccnn2)c1	763734418	LBEAYMHMIQEYOM-UHFFFAOYSA-N	430.877	1.799	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2cccc(N(C)C)c2)cccc1C(=O)N1CCCC1	763760226	IJBHYFAPKYKKLS-UHFFFAOYSA-N	437.500	1.697	50	20	IDGD	
CCNC(=O)N1CCc2ccc(NC(=O)C(=O)NNC(=O)c3cc4c(s3)CCC4)cc21	763782237	AGXAHFYUZQKLNK-UHFFFAOYSA-N	441.513	1.729	50	20	IDGD	
COc1cc(Cl)c(C)cc1NC(=O)C(=O)NNC(=O)c1nnc(O)c2ccccc12	763790696	MWRBKPXIOVQQAV-UHFFFAOYSA-N	429.820	1.706	50	20	IDGD	
COc1cccc(-c2cc(NC(=O)C(=O)NNC(=O)COc3ccccc3C#N)n(C)n2)c1	763809263	UJZSLQYCMQYLCU-UHFFFAOYSA-N	448.439	1.132	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)cc1[N+](=O)[O-]	763855185	UXCZNQHDLBLZEG-ZDUSSCGKSA-N	430.417	1.774	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)NC(=O)[C@H](C)O2	763863875	DUOGSQPTSKASRB-QWRGUYRKSA-N	430.392	1.099	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccc(-n2cncn2)c(Cl)c1	763874134	ZUYYOVGRGHSWLK-LLVKDONJSA-N	446.826	1.613	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cccc(Cn3cccn3)c2)cc1	763875988	BXEPEVMBDWOWRN-MRXNPFEDSA-N	449.467	1.687	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cnc(-c3ccccc3)nc2)cc1	763877119	HPQHOPODHWWXOX-OAHLLOKOSA-N	447.451	1.900	50	20	IDGD	
COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccc(C(C)=O)cc1	763878705	SXKNTMFHHZVGIH-LBPRGKRZSA-N	444.400	1.359	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2cccc(OCc3cccc(C#N)c3)c2)n1	763884255	DRGQAMYWDFSQMQ-UHFFFAOYSA-N	446.467	1.737	50	20	IDGD	
O=C(CCSc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccc(C(=O)NC2CC2)cc1	763894897	FQFLODMPGSLONZ-UHFFFAOYSA-N	444.488	1.986	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc1-c1ncco1	763947730	CNGUARAYYRQGGH-UHFFFAOYSA-N	446.423	1.941	50	20	IDGD	
O=C(NNC(=O)c1ccc(COc2ccccc2)o1)C(=O)Nc1cccc(-n2cnnn2)c1	763949981	NQAFAOZLMUECLO-UHFFFAOYSA-N	447.411	1.234	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)n(-c2ccccc2F)n1	764003681	GSVLLLHBFHVSEW-UHFFFAOYSA-N	439.403	1.491	50	20	IDGD	
COc1cccc(-c2nsc(NC(=O)C(=O)NNC(=O)CCOc3ccccc3)n2)c1	764166041	FFWKOOVOIHEUCE-UHFFFAOYSA-N	441.469	1.769	50	20	IDGD	
O=C(CCc1ccco1)NNC(=O)C(=O)Nc1ccccc1I	764172065	ONDRSPUHOSHATE-UHFFFAOYSA-N	427.198	1.603	50	20	IDGD	
CCOC(=O)C1=CC(C(C)(C)C)=S=C1NC(=O)C(=O)NNC(=O)c1ccc(C#N)cc1	764181877	IBZZJWAEHKQVTD-UHFFFAOYSA-N	442.497	1.020	50	20	IDGD	
CS(=O)(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)c2c(Cl)cccc2Cl)c1	764220647	BLMIKUJNDLYHBX-UHFFFAOYSA-N	444.296	1.938	50	20	IDGD	
O=C(NNC(=O)c1c(Cl)cccc1Cl)C(=O)Nc1cnn(C[C@H]2CCCO2)c1	764222082	VTAFYDGSQRVNAC-LLVKDONJSA-N	426.260	1.769	50	20	IDGD	
COC(=O)c1c(C2CC2)csc1NC(=O)C(=O)NNC(=O)CCc1ccccc1O	764279008	WAHXGXNLEQJGDN-UHFFFAOYSA-N	431.470	1.836	50	20	IDGD	
O=C(NC1CC1)c1cc(F)c(NNC(=O)[C@H]2CC(=O)N(Cc3ccccn3)C2)c(F)c1	764329341	JKGLDBSPBZGKSU-ZDUSSCGKSA-N	429.427	1.744	50	20	IDGD	
Cc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)c1C(=O)N1CCCC1	764349010	BUCSROTWXMRCRC-UHFFFAOYSA-N	444.875	1.990	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc4c(c3)C(=O)NCC4)n[nH]2)cc1C	764389040	VXTITMZRCGAIOM-UHFFFAOYSA-N	446.467	1.379	50	20	IDGD	
COC(=O)c1c(C2CC2)csc1NC(=O)C(=O)NNC(=O)c1cncc(NC(C)=O)c1	764432557	FZWGKSOEJXGLKY-UHFFFAOYSA-N	445.457	1.165	50	20	IDGD	
Cc1onc(-c2ccccn2)c1C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	764528646	QWYCTYWZMBIUOH-UHFFFAOYSA-N	429.458	1.370	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)C[C@@H](C)c3c(C)n[nH]c3C)CC2)cc1	764753030	QMTHPWJCVSQWJB-QGZVFWFLSA-N	426.565	1.794	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)o1	765248048	NOKZMKNIXDFYJZ-UHFFFAOYSA-N	425.488	1.323	50	20	IDGD	
CC(=O)N[C@@H](Cc1c[nH]c2ccc(Br)cc12)C(=O)NNC(=O)c1cc(C)[nH]n1	765588051	RWXIPDFCQYHQRC-HNNXBMFYSA-N	447.293	1.470	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(CNC(=O)NNc2ccccc2S(C)(=O)=O)cc1	765659827	VTNSLJNOCMEOMW-UHFFFAOYSA-N	426.520	1.167	50	20	IDGD	
Cc1ccc(OCCC(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)c(C)c1	765737671	HYRXTCHYBFMNKA-UHFFFAOYSA-N	438.528	1.678	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)[C@@H]1C[C@@H]1c1c(F)cccc1F	765739393	WBZOTKGLHKGTGD-DLBZAZTESA-N	442.466	1.674	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)N1CCNC(=O)[C@H]1c1cccc(Br)c1	766246370	CIQIVVSIELQBRT-MLGOLLRUSA-N	425.327	1.504	50	20	IDGD	
CSc1cc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)ccc1F	766565502	USCCFWGNYKCUAF-UHFFFAOYSA-N	430.505	1.767	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1)N1CCc2ccccc2C1	766643341	KZDWWBVMYACBDY-IBGZPJMESA-N	449.555	1.039	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)c1cccc(F)c1F	766846802	OQLZFQUXQFOWDI-LLVKDONJSA-N	426.445	1.920	50	20	IDGD	
COC(=O)C1(C(=O)NNC(=O)c2cccc(S(=O)(=O)Nc3ccccc3OC)c2)CC1	766956746	YIDJVQTWTMNDBP-UHFFFAOYSA-N	447.469	1.210	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)c2ccc(N3C(=O)CCC3=O)c([N+](=O)[O-])c2)cc1C	767415409	OEEFKBBXPGGXNL-UHFFFAOYSA-N	440.412	1.705	50	20	IDGD	
CC(C)(O)C(=O)NNC(=O)[C@]12CCC(=O)N1c1ccccc1C(=O)N2Cc1ccccc1	768259070	FGSVHPXBUDCHFC-QHCPKHFHSA-N	436.468	1.084	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)CN1C(=O)N[C@@]2(CCCC(C)(C)C2)C1=O	768565809	KZMDPNFABQTNNO-JOCHJYFZSA-N	430.505	1.666	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](OCC(=O)NNC(=O)COc2ccc(F)cc2)C1	769050974	YYZGWRRYIOASEI-MRXNPFEDSA-N	425.457	1.768	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)NCc1ccc(N2CCN(C)CC2)nc1	770129360	WKMAKKNJBVQAMV-OAHLLOKOSA-N	446.939	1.785	50	20	IDGD	
CC(=O)N[C@H](CC(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)c1ccccc1	770279939	IVOULZZUFDTEFH-QGZVFWFLSA-N	428.401	1.167	50	20	IDGD	
CN(C(=O)c1ccncc1)c1ccc(CNC(=O)NNc2nc(O)c3cnn(C)c3n2)cc1	770400063	KWDGZZWSEIPCND-UHFFFAOYSA-N	447.459	1.567	50	20	IDGD	
CCS(=O)(=O)N1CCC(CNC(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)CC1	770649127	LRWYAXPKSZGWPE-CYBMUJFWSA-N	446.957	1.499	50	20	IDGD	
CCN1CCN(c2cccc(NC(=O)C(=O)NNC(=O)c3cccc(N(C)C)c3)c2)CC1	770773324	GGUZJFQMYKMUHB-UHFFFAOYSA-N	438.532	1.294	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N[C@@H]1CCO[C@]2(CCOC2)C1	771444142	NGSKCSPXDQHRIT-WPKBUWHJSA-N	442.310	1.885	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc(F)ccc1Br)[C@@H]1COc2ccccc2O1	771897391	DVYXYZFLIOKMFA-ZDUSSCGKSA-N	431.239	1.738	50	20	IDGD	
CCc1ccc(S(C)(=O)=O)cc1C(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772188415	OGNWNHPZPXHSJZ-UHFFFAOYSA-N	437.905	1.383	50	20	IDGD	
N#Cc1cccc(NNC(=O)C(=O)Nc2cc(N3CCCS3(=O)=O)ccc2Cl)c1	773688431	BJLONGBMGYVJKF-UHFFFAOYSA-N	433.877	1.833	50	20	IDGD	
O=C(NNc1c(F)cccc1F)C(=O)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1	773705877	KYEJSGOGRHFMBX-UHFFFAOYSA-N	440.428	1.068	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2ccc(C(=O)NCc3ccccc3F)cc2)n1	773726064	GULORENLROIEJO-UHFFFAOYSA-N	438.419	1.636	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)N(C)C(=O)CO2	774000983	BMOBAHFAKQDVME-LLVKDONJSA-N	446.847	1.249	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1cc2c(cc1F)CCC(=O)N2	774010212	WIBJDDYAPIGJFW-JTQLQIEISA-N	448.838	1.917	50	20	IDGD	
N#C/C(=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)OCc1nc(O)n[nH]1	774879297	AHTLYOIYAPXTNO-GHXNOFRVSA-N	441.835	1.553	50	20	IDGD	
C[C@@H](NCC(=O)NNC(=O)c1ccc(F)cc1)c1ccc(OCC(=O)NC2CC2)cc1	774964186	SBECQBYFEQITJH-CQSZACIVSA-N	428.464	1.595	50	20	IDGD	
CCO[C@H](CNC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1)c1ccccc1	775202867	YNMAAEPSDLAPKK-LJQANCHMSA-N	448.545	1.724	50	20	IDGD	
O=C(NNC(=O)c1c[nH]c2ccccc12)Nc1ccc(S(=O)(=O)N2CCOCC2)cn1	776060997	BRHSSFBVBWWRCZ-UHFFFAOYSA-N	444.473	1.050	50	20	IDGD	
CCOC(=O)N[C@H](C(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1)C(C)C	776201355	IWRBPLFQRGDAKN-AWEZNQCLSA-N	429.518	1.393	50	20	IDGD	
Nc1nc(Cl)cc(NNC(=O)c2cc(S(=O)(=O)N3CCCC3)ccc2Cl)n1	779373417	MWOWFWRGCNAPQE-UHFFFAOYSA-N	431.305	1.907	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NN=Cc2cnc(N)nc2)c1	781570736	AUYMXYJZEIKPQD-UHFFFAOYSA-N	426.458	1.632	50	20	IDGD	
COC(=O)[C@@H]1CN(C(=O)C(=O)NNc2ccc(Cl)cc2[N+](=O)[O-])c2ccccc2O1	783291287	ODBRCFOOUVFWAS-HNNXBMFYSA-N	434.792	1.659	50	20	IDGD	
C[C@@H]1CN(C(=O)Cn2cc(NC(=O)C(=O)NNc3ccc(Cl)cc3)cn2)C[C@@H](C)O1	783336003	DFVHSRUVTLVRCF-CHWSQXEVSA-N	434.884	1.254	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)c(OC)n1	783409221	QCJKWPHUXSPWQQ-UHFFFAOYSA-N	448.379	1.474	50	20	IDGD	
Cc1ccccc1NC(=O)NNC(=O)C(=O)Nc1ccc(C(=O)N2CCN(C)CC2)cc1	783416562	YTLFHEATBCOQKS-UHFFFAOYSA-N	438.488	1.174	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NN/C=C2\C(=O)NC(=O)c3ccccc32)c1	783679208	KAPFAUMEOYMMGI-AQTBWJFISA-N	442.497	1.263	50	20	IDGD	
N#Cc1ccc(NNC(=O)C(=O)Nc2cc(-n3cnnn3)ccc2F)cc1C(F)(F)F	784238709	SCAMECCZAKIGAI-UHFFFAOYSA-N	434.313	1.774	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)[C@H]2CC=CC[C@@H]2C(=O)N2CCOCC2)c1C	784293135	GHZQYFRUWVGWII-QYZOEREBSA-N	429.517	1.659	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)c1cnc(OCC2CC2)c(Cl)c1	784662934	AILIZWRULDCPIX-UHFFFAOYSA-N	427.889	1.993	50	20	IDGD	
O=C(CCCOc1ccc2c(c1)NC(=O)CC2)NNC(=O)c1nnc(O)c2ccccc12	784771831	UUFVYJAYPJNTJE-UHFFFAOYSA-N	435.440	1.840	50	20	IDGD	
COC[C@H](C)NS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccc(Cl)nc2)cc1	784871448	KTBPRANQHDNWCH-NSHDSACASA-N	441.897	1.130	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)C(=O)Nc1ccc(OC(F)F)c(Cl)c1	785060867	QDANTKKTRKHADU-UHFFFAOYSA-N	437.790	1.918	50	20	IDGD	
COCC(=O)N1CCc2cc(NC(=O)C(=O)NNc3ccc(C#N)c(Cl)c3)ccc21	785094935	MQFZRRBCRGKPAH-UHFFFAOYSA-N	427.848	1.829	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN1C1CC1)c1cccc(S(=O)(=O)NCc2ccccc2)c1	786635726	WPBVOGVSIZZNML-HXUWFJFHSA-N	442.541	1.553	50	20	IDGD	
COCCOc1ccc(F)cc1S(=O)(=O)NNC(=O)[C@@H]1COc2ccccc2O1	786713792	LBIWXOHTLFOWSI-INIZCTEOSA-N	426.422	1.000	50	20	IDGD	
N#C/C(=C/c1ccc(O)cc1)C(=O)N[C@@H]1CCCN(c2cc(N3CCOCC3)ncn2)C1	787352166	ZYDYFKVDCUQDEC-XLXASQRYSA-N	434.500	1.711	50	20	IDGD	
N#CCCCN1C(=O)CCc2cc(NC(=O)C(=O)NNC(=O)CCc3ccccc3)ccc21	787890117	VFGATTPQVZULSV-UHFFFAOYSA-N	447.495	1.988	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2cccc3c2OCC[C@H]3N(C)C)c1O	789734067	ZZAQXGQAZKSWMD-OAHLLOKOSA-N	428.445	1.186	50	20	IDGD	
CNC(=O)c1cc(Oc2ccccc2NC(=O)C(=O)NNc2nc3ccccn3n2)ccn1	792396036	WXTNGLNNPKBMQL-UHFFFAOYSA-N	446.427	1.358	50	20	IDGD	
O=C(NNC(=O)[C@@H]1[C@H]2[C@H]3C[C@@H]4[C@@H]5[C@H]3[C@H]1[C@@H]5C[C@H]42)c1ccc(S(=O)(=O)N2CCCC2)cc1	792805105	BQKWNQWZBGBPBX-QRXYLLQBSA-N	441.553	1.626	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(OC(C)C)nn2)cc1	793022101	PBHLERMGUWLVFR-ZDUSSCGKSA-N	431.449	1.216	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2cccn2C)c(C)n1Cc1ccc(S(N)(=O)=O)cc1	793284043	LJKISRDTNONYOR-UHFFFAOYSA-N	429.502	1.214	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)C(=O)Nc1cc(C(F)(F)F)ccc1Br	797006806	KXRQZRPGIVULLN-UHFFFAOYSA-N	434.172	1.899	50	20	IDGD	
CN1C(=O)COc2cc(NC(=O)C(=O)NNC(=O)c3cccc(OC(F)F)c3)ccc21	799259268	RSZBOIUIXDODQF-UHFFFAOYSA-N	434.355	1.043	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)C(=O)Nc1ccnc(OCc2ccccc2)c1	800622737	RBPFNYOTFCZTOF-UHFFFAOYSA-N	434.408	1.789	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CCCCOc2ccc(S(C)(=O)=O)cc2)cc1	801106072	NJQHASVKOBGBLD-UHFFFAOYSA-N	447.513	1.734	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)CCc3ncc(C(C)(C)C)o3)cc2)CC1	801617773	OFWVLLLCGCOMFU-UHFFFAOYSA-N	449.577	1.984	50	20	IDGD	
Cc1ccc(CN2C(=O)CC[C@@H]2C(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)cc1	802068004	VXZAQQYQQZLUTK-GOSISDBHSA-N	444.513	1.742	50	20	IDGD	
CCn1c(S)nc2cc(C(=O)NNC(=O)Nc3ccc4c(c3)OCO4)ccc2c1=O	802096713	BLMXKGCVPBGBKX-UHFFFAOYSA-N	427.442	1.900	50	20	IDGD	
COc1ccc(Cl)c(NC(=O)NNC(=O)CNC(=O)c2ccc(OC)c(OC)c2)c1	802114306	ZHJOXTUMFSMSDN-UHFFFAOYSA-N	436.852	1.949	50	20	IDGD	
CCCN(NC(=O)CNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)C(=O)OC(C)(C)C	804595170	KUZSYUSWGAPQRM-UHFFFAOYSA-N	442.538	1.345	50	20	IDGD	
Cn1cnnc1Sc1ccc(C(=O)NNc2ccc(-n3ccnc3)nn2)cc1[N+](=O)[O-]	804957993	ZABWRXDUTRFFNS-UHFFFAOYSA-N	438.433	1.607	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccc(C(=O)N(C)CC)c1	806973841	LQOZOTHBSHERMV-UHFFFAOYSA-N	442.472	1.342	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NC[C@@H](Cc2ccccc2)N(C)C)cc(OC)c1OC	807006613	PQBGGMOAIRYYCJ-QGZVFWFLSA-N	430.505	1.829	50	20	IDGD	
O=C(NCc1ccc(N2CCCS2(=O)=O)cc1)NNc1ccc2c(=O)[nH]ccc2c1	807113428	DVOMNHRBUKGNDG-UHFFFAOYSA-N	427.486	1.894	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)cnn1-c1ccc(Cl)cc1	808934499	IFDJECZQPIEGTL-UHFFFAOYSA-N	441.831	1.963	50	20	IDGD	
CCc1nnc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)s1	812595804	PWMIHSFYTMJJLU-UHFFFAOYSA-N	438.535	1.029	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)Nc1cccn(CC(F)(F)F)c1=O	814667032	KDRLCDNZDMBHEI-UHFFFAOYSA-N	433.412	1.810	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)C(=O)Nc2nnn(CCOc3ccc(F)cc3)c2C)n1	815558248	WRLYNTMWPCMMNV-UHFFFAOYSA-N	428.428	1.293	50	20	IDGD	
CC1CCN(S(=O)(=O)c2ccc(NC(=O)C(=O)NNc3ncncc3F)cc2)CC1	815765597	WTMUIFWEEFVSRN-UHFFFAOYSA-N	436.469	1.118	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)CCCS(=O)(=O)N2CCCC2)c1	818750058	CIIBWQAZSNPFGI-UHFFFAOYSA-N	448.339	1.885	50	20	IDGD	
N#C/C(=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)NNC(=O)CC1CC1	819135681	BAKHFYNGILXKCG-GDNBJRDFSA-N	440.891	1.933	50	20	IDGD	
COc1cccc(/C=C(/C#N)C(=O)O[C@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)c1	849204085	QHPUXYWPRGJWEE-NWFCWYBLSA-N	429.454	1.820	50	20	IDGD	
Cn1c(CCC(=O)NNc2ncccn2)nc2cc(S(=O)(=O)N3CCCCC3)ccc21	913044004	OVJGGUKMBMNSBL-UHFFFAOYSA-N	443.533	1.614	50	20	IDGD	
CC(=O)c1cccc(S(=O)(=O)NCC(=O)NNC(=S)Nc2cc(C)ccc2C)c1	913423138	TZLXQWCDCVLLLF-UHFFFAOYSA-N	434.543	1.802	50	20	IDGD	
COCCN1C[C@H](C(=O)NNC(=O)CCCOc2ccc(Cl)cc2Cl)CC1=O	914458577	FYYWWJKPIWKGPM-GFCCVEGCSA-N	432.304	1.795	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)[C@@H](Cc1ccc(F)cc1)n1nnnc1C	915684807	GKELPRAZGBKKKB-QGZVFWFLSA-N	442.451	1.530	50	20	IDGD	
COc1cc2c(cc1OC)C(=NNC(=O)CCN1CCN(c3ccccc3)CC1)C(=O)N2	915934819	IHCOJKIQGHFDRC-UHFFFAOYSA-N	437.500	1.689	50	20	IDGD	
C[C@@H](NC(=O)c1cccc(Cl)c1Cl)C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	916144494	BSVGZKZWPKQBGA-SNVBAGLBSA-N	448.270	1.549	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)NCc2ccc(S(=O)(=O)NC)s2)cc1OC	916232103	FHCNLZUZEJSROD-UHFFFAOYSA-N	442.519	1.208	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCCN2CCN(c3ccccc3)CC2)cc1OC	916514340	AZFWRQYAZALUPG-UHFFFAOYSA-N	427.505	1.470	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@H]2CCC[C@@H]23)cc1	916585277	WIVWIYMLVWFLRO-GYFISPQKSA-N	434.562	1.771	50	20	IDGD	
C[C@@H](Nc1nc2ccccc2s1)C(=O)NNC(=O)c1cnc2nc(O)nc(O)c2c1	916739954	DBZMXJOLVTVFHV-MRVPVSSYSA-N	425.430	1.307	50	20	IDGD	
O=C(CSc1ccc(C(F)(F)F)cn1)NNC(=O)c1csc(N2CCOCC2)n1	916830114	HALFLWUYQZDWJU-UHFFFAOYSA-N	447.464	1.947	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)CCOc2ccccc2Br)c2ccccc2c1=O	917915798	XMWYGJRLULVRBX-UHFFFAOYSA-N	445.273	1.926	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)COc1ccc(C#N)cc1)c1ccc(S(=O)(=O)N(C)C)cc1	918105687	UBEANZUMIUNFIO-AWEZNQCLSA-N	445.501	1.279	50	20	IDGD	
CN(C)C(=O)COc1ccccc1C=NNC(=O)CCN1CCN(c2ccccc2)CC1	920359112	SBQWZFWFVWJEAO-UHFFFAOYSA-N	437.544	1.816	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)CCCC[C@@H]1SC[C@H]2NC(=O)N[C@@H]21	921302513	XNCGRQXJTTYBLW-IIMJZQEZSA-N	444.561	1.472	50	20	IDGD	
CC(C)(C)c1ccc(C(=O)N[C@H](CCS(C)(=O)=O)C(=O)NNc2cccnn2)cc1	1116567539	MOMFMMZXUHNVRW-MRXNPFEDSA-N	433.534	1.451	50	20	IDGD	
COc1ccccc1C1(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)CCC1	1318256640	ZCLINVICQPHIRZ-UHFFFAOYSA-N	431.514	1.828	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCCCc2nc(C)cs2)cc1	1318346139	UFGYVZNUDDHSAT-UHFFFAOYSA-N	439.563	1.344	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)Cc2cnn(-c3ccccc3)n2)CC1	1318567255	REXWCXFIIYXBOS-UHFFFAOYSA-N	428.493	1.604	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)cc(O)n1	1319984137	QAAMNWJWIKJXQV-UHFFFAOYSA-N	429.440	1.872	50	20	IDGD	
COC(=O)c1cccc(Cl)c1S(=O)(=O)NNC(=O)c1cncn1-c1ccccc1	1321698018	IWUXSQVDVFTSQS-UHFFFAOYSA-N	434.861	1.936	50	20	IDGD	
CSCC[C@H](C(=O)NNC(=O)c1n[nH]c2c1CCCC2)N1C(=O)[C@H]2CCCC[C@H]2C1=O	1337223317	UIBIIMYKOKISSG-DVOMOZLQSA-N	447.561	1.346	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(-n3ccnc3)ccn1)C2)[C@@H](F)Cl	1778025033	JPMMXTBPEJCPQN-MBOZVWFJSA-N	435.887	1.929	50	20	IDGD	
Cn1cc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)c2cccnc21	1778768341	FNVHPSBCZBXNKD-KDOFPFPSSA-N	439.285	1.707	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)COc1cccnn1)C2	1779545961	WXGQLYLCLONAMP-OXQOHEQNSA-N	436.585	1.221	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H]1CC(=O)N(C3CCCC3)C1)CCO2	1781214964	GPMRVXLGUQVCHK-HZUJVAHNSA-N	425.957	1.625	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3nc4ccccc4n(C)c3=O)CCO2)C1	1781219390	OWIHQEDWFQQYSE-QKKBWIMNSA-N	432.908	1.394	50	20	IDGD	
O=C(c1cn2cc(F)ccc2n1)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781331425	KGTJRDJXTWTVDP-YOEHRIQHSA-N	443.248	1.607	50	20	IDGD	
O=C(/C=C/c1cccc(O)c1)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781335046	UYOGNWOHHGIOQQ-RPCWLKAMSA-N	427.270	1.926	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)Br)C1	1781998771	HDFAYZFBTGCQGV-YRWGSWDYSA-N	432.359	1.151	50	20	IDGD	
COC(=O)CSCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C(Cl)Cl)C1	1782214414	FKSOPAJLJLDJCT-BDJLRTHQSA-N	427.350	1.210	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccnc3c1OCO3)C2)C(Cl)Cl	1782218266	HGWKLUJKNZLVFJ-KZULUSFZSA-N	430.288	1.742	50	20	IDGD	
CCCCCc1ncc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)s1	1782712429	HWNKSTUHSLGJCR-AUUYWEPGSA-N	429.970	1.919	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)Cc3csc(C)n3)CCO2)C1	1783343879	KGBDXDLKENZCRZ-RHSMWYFYSA-N	430.368	1.997	50	20	IDGD	
Cc1ccc(OCC(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](C)Br)C3)C2)cc1	1783533107	QUJKHPWOAOZUQT-BEFAXECRSA-N	425.323	1.987	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](C)Br)C2)C1	1783539895	OUQITABOCFUYRD-COPLHBTASA-N	426.149	1.773	50	20	IDGD	
O=C(COc1ccc(O)cc1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21	1783842853	YVYUFWDXQIMFGH-SIUGBPQLSA-N	445.285	1.441	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)CCc3ccc(F)c(F)c3)CCO2)C1	1783869218	OLHPKADFMZYOJG-YWZLYKJASA-N	430.879	1.981	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(C#N)cc3Cl)CCO2)C1	1783882550	ZYELIWBJAUUSMH-VQIMIIECSA-N	426.300	1.909	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(O)nc(Cl)c3)[C@H]2C1	1785694724	XHIVYJKMNBUYBP-DEQVHRJGSA-N	432.304	1.288	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1(c2ccc(NC(=O)c3cnnn3C)cc2)CCC1	1786982468	GJBHYHRRLIAJFI-MZJWZYIUSA-N	448.487	1.697	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc(-c4ccccn4)nc3)C[C@@H]21)[C@H](F)Cl	1787443725	BJAZPLJTFCSOGU-CSFVBSKPSA-N	433.871	1.666	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3CCCN(C)C3)[C@H]2C1	1789740765	KKPNBLRBLWZIRF-NRKLIOEPSA-N	430.387	1.339	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CCN3C(=O)OC(C)(C)C)C[C@@H]21	1789857901	KQJLJKLJUFNFFZ-VIQHNZTISA-N	443.972	1.993	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]2C1)n1cccc1C=O	1789922974	VLQBZWXNLHPPLU-ZLTXHLNPSA-N	444.301	1.532	50	20	IDGD	
O=C([C@@H](F)Br)N1CC[C@H]2CO[C@@H](CNC(=O)C3(Br)CC3)[C@H]2C1	1789931150	ZCFRXZFQLOFELS-XWLWVQCSSA-N	442.123	1.584	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccnc(C(F)F)c3)C[C@@H]21	1791252224	DTUHBICDXJJJCH-YXWQFLTLSA-N	431.867	1.866	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cccc(F)c3F)C[C@@H]21	1791258077	YWBRZEBZXUTOQU-MPTYRVRUSA-N	430.879	1.741	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CCc4ccccc43)C[C@@H]21	1791293331	VZRRKGMMHNRMEZ-NRDMVMEKSA-N	442.560	1.069	50	20	IDGD	
CC(=O)NC(C)(C)C(=O)NC1(c2ccc(NC(=O)CCC(=O)NN(C)C)cc2)CCC1	1791599961	RWFUJQJZZMUYHC-UHFFFAOYSA-N	431.537	1.408	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cccc([N+](=O)[O-])c1	1792421413	HHQFWQVSKRJMNA-MBMVNNNZSA-N	440.294	1.510	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2	1792873983	IGIVCPJDMBINED-NZFPMDFQSA-N	430.112	1.298	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cnc2ccccn12	1792932418	CLSNZTCGDLRELR-VPTLXERWSA-N	430.581	1.318	50	20	IDGD	
Cn1c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](O)CCl)cc2c[nH]c3nccc-3c21	1793113832	UEMZVIGHCCZBPI-UMPJEAMMSA-N	429.908	1.858	50	20	IDGD	
CS(=O)(=O)c1ccc(Cl)c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](O)CCl)c1	1793117776	DHLXNAJTZYURJO-BUWBCJGYSA-N	449.356	1.595	50	20	IDGD	
COc1ccccc1CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2	1793149240	LARXZNAYSZJIHL-DACLVMHWSA-N	443.313	1.908	50	20	IDGD	
CC(C)N1CCC(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Br)C3)CC1	1793799674	SCMWAOSMQXFOOE-QKPAOTATSA-N	434.350	1.387	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccc(OC)cc1Cl	1793868235	PESVFOBWCDCBFA-CSHUHZATSA-N	445.343	1.735	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H]2[C@@H](C1)[C@@H]2C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Cl	1796369358	AIMJSNWFCZKQLC-RMCMBSFLSA-N	445.919	1.223	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cn(C)nc1C)C2	1796890826	MHBXGMABBSEXSV-YDOXXCSQSA-N	425.493	1.114	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)c1ccc(-c2ccccc2)nc1	1798363792	IPOAHCGJCWJQST-PIKOESSRSA-N	429.904	1.552	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccnc1C(=O)OC(C)C)C2	1799264859	ZIEOFBHNJCTAMN-YALNPMBYSA-N	437.924	1.867	50	20	IDGD	
COc1ccc([C@H](O)C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@](C)(Cl)CCl)cc1	1799273890	SOIJDOPZEGPWCX-BXNDMCELSA-N	445.343	1.555	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)c1ccc(OC(F)(F)F)cc1	1799493335	KHSAJBCHWOCDQM-NEBZKDRISA-N	436.814	1.388	50	20	IDGD	
Cc1ccn2c(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@H](C)CBr)C4)cnc2c1	1800080610	OFRAQKPKRBBQAA-ZXFNITATSA-N	449.349	1.877	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(C#N)c1Cl)C2	1800978676	HRLXFNBDHDYOQE-IARIHHJXSA-N	426.300	1.669	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc(SC)cc1)C2	1800980535	CNLJBZNUXHNHIO-HIRMHNASSA-N	426.966	1.794	50	20	IDGD	
CC#C[C@@H](CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](Cl)COC)c1ccc(O)cc1	1800981813	SGUPVUULPOKUAJ-BCOJKNMUSA-N	448.947	1.733	50	20	IDGD	
C[C@@H](Sc1ccccn1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2	1801318143	FOAKQAIQSKFKQK-GGUBGCTKSA-N	446.342	1.842	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1CC2(CCC2)C1	1801596283	IXCWFIHOPRYJDK-GJPBQQDYSA-N	441.532	1.290	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(C(=O)N(C)C)c1	1801912545	LMZNPKWXNKAIQS-RDGPPVDQSA-N	435.952	1.999	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H]1CCC[C@@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2	1802142149	OWSXGNDUOVKJCK-KARBZBNUSA-N	447.935	1.804	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@H](CNC(=O)C(O)O)[C@@H]1c1cccnc1	1802927920	OYVYUJMTVFTXRM-YAEMXKGMSA-N	442.422	1.283	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CC23CCCN2CCC3)[C@H]1c1cccnc1)[C@H](O)CCl	1803140393	CYIHNFSZOKVROC-NSHGMRRFSA-N	434.968	1.706	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]1c1cccnc1	1803148472	QGZPMCOEJZANSP-DTZQCDIJSA-N	427.885	1.249	50	20	IDGD	
CCS(=O)(=O)CC(=O)N1CC[C@H](CNC(=O)CCBr)[C@@H]1c1cccnc1	1806342314	MIMLQTWFNKQIJP-PBHICJAKSA-N	446.367	1.307	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)[C@@H]2CCCS2(=O)=O)[C@H]1c1cccnc1	1808277314	BTLAFVMUTRCLDN-QAETUUGQSA-N	427.954	1.682	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)COc2ccc(O)nn2)[C@H]1c1cccnc1	1808277338	COKJRGBYZDBYII-VCBZYWHSSA-N	433.896	1.679	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)c2ncc[nH]2)[C@@H]1c1cccnc1	1808414444	IEJOZJCZEVLIOV-GYPFKPTKSA-N	448.487	1.258	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)c1cnc2ncccn12	1809332730	QODVONMSUSBTJM-UAGQMJEPSA-N	428.880	1.044	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)CNC(=O)N(C)C)[C@H]1c1cccnc1	1812862627	AWHPKNZNZMDOQW-NOLJZWGESA-N	440.342	1.142	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccn(C(F)F)c2=O)[nH]n1)[C@@H](O)CCl	1814873366	QCIMCSJCJFSOKJ-STQMWFEESA-N	443.838	1.872	50	20	IDGD	
CCS(=O)(=O)CC(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCBr)n[nH]1	1816781779	LVBKCYJMJZJLHP-GFCCVEGCSA-N	435.344	1.622	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(O)nc(O)n2)n[nH]1	1818032145	SYBKSAIGNNWOGN-LDYMZIIASA-N	439.270	1.700	50	20	IDGD	
Cc1ccnc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)[nH]n2)c1	1818191718	NTKRMWQRIQTIKB-GOSISDBHSA-N	448.487	1.731	50	20	IDGD	
O=C1C[C@H](C(=O)N2CCCC[C@H]2c2cc(NC(=O)[C@@H](F)Br)n[nH]2)CCN1	1820936927	IFWZZGZUGQNFGG-OLUVUFQESA-N	430.278	1.619	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](O)CCl)CC2)c1cc(-n2ccnc2)ccn1	1821683925	ORKZTGSWXGQLKG-NHYWBVRUSA-N	446.920	1.549	50	20	IDGD	
CC(=O)OC[C@@H](OC(C)=O)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)C(Cl)Cl)n[nH]1	1822423803	MCJQNUOGZSDLQE-CHWSQXEVSA-N	449.291	1.700	50	20	IDGD	
CN1C(=O)CC[C@H]1C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1	1823007554	PQYOQUMIFJRMBJ-QOSJWCAFSA-N	433.303	1.366	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](CC)NC(N)=O)CC2	1825446886	KCLHNSSEIYJOQI-GUBZILKMSA-N	446.371	1.676	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CSc1nc[nH]n1)CC2	1825646719	BUEMCXJQOGHUNY-YUMQZZPRSA-N	445.368	1.749	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC([C@@H]2CCCCN2C(=O)C[C@@H](NC)C(=O)O)CC1	1826947517	CSQVNAOFARKNSQ-XHSDSOJGSA-N	446.386	1.842	50	20	IDGD	
C[C@H](C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@](C)(Cl)CCl)CC2)n1cnnn1	1826990243	XTEKNBMQNYYHBH-KEMUVXCRSA-N	432.337	1.539	50	20	IDGD	
O=C(C[C@@H]1CCCCO1)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827055598	FGEDHIHVNXWYJG-VXKWHMMOSA-N	442.365	1.559	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccc(C#N)cc3)C2)C1	1830354040	RAIVTZRBFPOMIJ-JOCHJYFZSA-N	433.936	1.822	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)[C@@H](C)CC)CCO2	1831517996	LRYNJHXKVXOGIQ-AFIMGQEJSA-N	435.359	1.023	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cccc(OC)n3)C2)C1	1831640522	NCLKGWWQPLWGPQ-UWJYYQICSA-N	439.940	1.497	50	20	IDGD	
Cc1ccc2[nH]cc(CC(=O)N3CCO[C@]4(COCCN(C(=O)[C@@H](O)CCl)C4)C3)c2c1	1832741335	QIOCVGBXLDLBJF-SIKLNZKXSA-N	449.935	1.075	50	20	IDGD	
Cc1ccncc1CCC(=O)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1833015929	YPUIHHRVNLNRKO-LJQANCHMSA-N	430.332	1.583	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)c3n[nH]cc3[N+](=O)[O-])CC2)CC1	1833533804	QSVWIXNOECVELK-HNNXBMFYSA-N	440.932	1.911	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccsc3)CCO2)C1	1833959262	DJQCPHNDUIEINX-GUYCJALGSA-N	431.352	1.849	50	20	IDGD	
CC[C@H](C)[C@H](O)C(=O)N1CCC(N2CCC(NC(=O)CCBr)CC2)CC1	1834422315	GKECPUAKRGSIMM-KSSFIOAISA-N	432.403	1.750	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)c3sccc3F)C2)C1	1834819862	ZTGNHMQCNIWJNO-INIZCTEOSA-N	435.315	1.742	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)Cc3cnc[nH]3)CC2)CC1	1835064006	GWVXFIFQBOIMHW-ZDUSSCGKSA-N	426.359	1.307	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnn4cc(C)cnc34)CCO2)C1	1836944790	WJVXGGHDYNSPEM-LAUBAEHRSA-N	449.939	1.515	50	20	IDGD	
C[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1)N1C[C@@H]2C[C@H]2C1	1837279266	SUNZTDICENZATA-MXTNKPTQSA-N	427.973	1.048	50	20	IDGD	
Cc1cc(/C=C/C(=O)N2CCO[C@]3(COCCN(C(=O)[C@](C)(Cl)CCl)C3)C2)no1	1837557030	CCOBLQMPXXPPJD-DUFJLWIISA-N	446.331	1.689	50	20	IDGD	
CCc1noc(C)c1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1	1838058758	WGCFUWOJTKBQJY-MOPGFXCFSA-N	448.347	1.852	50	20	IDGD	
Cc1ncncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1	1838094707	HWKPVGNCGZXHIF-ROUUACIJSA-N	431.320	1.091	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cnn4ccncc34)CC2)CC1	1838249822	NCIUMOPVDKNGTR-SFHVURJKSA-N	449.939	1.595	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccsc3)C2)C1	1839151890	HQQPDGPEATYPJA-ROUUACIJSA-N	435.373	1.983	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(F)nc3)C2)C1	1839153911	VTAUNVSHIFEDHT-QZTJIDSGSA-N	434.295	1.527	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccc(F)c(C#N)c3)CCO2)C1	1839187519	HPDYHAYOZIQZGG-UTKZUKDTSA-N	437.899	1.714	50	20	IDGD	
C=CCC(F)(F)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1839889647	HBMIICYWPWWSOT-SMDDNHRTSA-N	429.233	1.345	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(F)c[nH]3)C2)C1	1839966410	CVDMICZMXYHCGN-DYVFJYSZSA-N	432.290	1.397	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)COc3ccc(C)cc3)C2)C1	1840151576	GRCSLFUVXNVJQT-WIYYLYMNSA-N	440.924	1.084	50	20	IDGD	
CNc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](Cl)COC)CCO3)cc1	1840151935	RWEXATIYOZSAHA-FXAWDEMLSA-N	425.913	1.052	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4ccoc4c3)C2)C1	1840155325	XVTYENHGHIUSQL-UTKZUKDTSA-N	436.892	1.757	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3c(C)cc(C)cc3C)C2)C1	1840156825	VEYSSZBWGOIPON-XMSQKQJNSA-N	438.952	1.936	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H]3CCCN3C(C)C)CCO2)C1	1840581495	DFIONFCQQGEHID-LQWHRVPQSA-N	429.989	1.723	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(F)c(C)cc3F)CCO2)C1	1840708345	CNIFAINZMRUARK-YWZLYKJASA-N	446.878	1.597	50	20	IDGD	
Cc1cn2c(=O)c(C(=O)N3CCCC34CN(C(=O)CO[Si](C)(C)C)C4)cnc2s1	1843785346	QOGLNJOUVFJGQC-UHFFFAOYSA-N	434.594	1.733	50	20	IDGD	
C#CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)CCBr)C2	1847071752	VIWAKGOIRIJSDO-CQSZACIVSA-N	442.354	1.891	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@H]1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](C)CBr	1847499929	RIXPVTBWUGIAOV-SUJAAXHWSA-N	427.339	1.975	50	20	IDGD	
C=CC[C@H](CC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl)NC(=O)OC(C)(C)C	1847568005	JSNLWEPYPXQDPD-FXUDXRNXSA-N	429.945	1.647	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)[C@@H]2CC(=O)N(c3ccccc3Cl)C2)nc2ccccc21	16179060	VOZNJQCCPIJLNQ-CYBMUJFWSA-N	425.876	1.970	50	20	IDGD	
Cc1sc2ncn(CCC(=O)NNC(=O)c3n[nH]c(=O)c4ccccc34)c(=O)c2c1C	21038735	TWXHWRQAGIIQKU-UHFFFAOYSA-N	438.469	1.163	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cnn1-c1ccccc1	27082783	XGQBJJHCETVVMO-UHFFFAOYSA-N	433.877	1.556	50	20	IDGD	
O=C(Cn1c(=O)ccn(Cc2ccccc2)c1=O)NNC(=O)c1cc(-c2ccccc2)on1	28793392	YRECRAURJXROQY-UHFFFAOYSA-N	445.435	1.175	50	20	IDGD	
COC(=O)CCOc1ccc(S(=O)(=O)NNC(=O)c2ccc3ccccc3n2)cc1	117531293	UWUQUFICHGOQED-UHFFFAOYSA-N	429.454	1.800	50	20	IDGD	
COc1ccc(CN2C[C@@H](C(=O)NNC(=S)NCCc3cccs3)CC2=O)cc1	726631299	XUCJDPKFCDPJLN-HNNXBMFYSA-N	432.571	1.843	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)CS(=O)(=O)NC1CCC(C)CC1	726870004	LMMWORIKVWWSBR-UHFFFAOYSA-N	427.523	1.110	50	20	IDGD	
O=C(CN1C(=O)N[C@@]2(CCc3ccccc32)C1=O)NNC(=O)c1cccc(OC(F)F)c1	728486503	DKCASPFUMHMVEQ-OAQYLSRUSA-N	444.394	1.443	50	20	IDGD	
COc1ccc(CC(=O)NCc2ccc(C(=O)NNC(=O)Cc3cccnc3)cc2)cc1	728850511	RQFZIGBTOWSEFG-UHFFFAOYSA-N	432.480	1.953	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)COCc1ccccc1	728948273	DQGGZDBISKQZGX-KRWDZBQOSA-N	426.521	1.876	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)Cc2cccnc2)cc1Br	729183374	SKJNPNFAYPKDDL-UHFFFAOYSA-N	441.307	1.098	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)N1CCC[C@H](NS(=O)(=O)c2cccc(F)c2)C1	729494869	IFLCROKWJGQESI-INIZCTEOSA-N	434.493	1.931	50	20	IDGD	
NC(=O)c1ccc(SCC(=O)NNC(=O)c2cccc3ncccc23)c([N+](=O)[O-])c1	730226985	WHMAMFROFGGHHX-UHFFFAOYSA-N	425.426	1.795	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])cc1	731051822	QUWBEDQZNNJIPO-UHFFFAOYSA-N	434.836	1.767	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)N1CCN(S(=O)(=O)c2cc(C)ccc2C)CC1	731500975	WGDFJFXLHFTJEJ-UHFFFAOYSA-N	446.529	1.673	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)Cc2csc(NC(=O)c3ccco3)n2)C[C@H](C)O1	732259561	HJGZHZNHCUXCTQ-STQMWFEESA-N	435.506	1.178	50	20	IDGD	
Cc1nn(-c2ccccc2)c2ncc(C(=O)NNC(=O)CCN3C[C@H](C)O[C@@H](C)C3)cc12	732260024	NPVDXYBTRSODIG-HOTGVXAUSA-N	436.516	1.989	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)[C@H]2CCCN(C(=O)c3ccc(F)cc3)C2)C[C@@H](C)O1	732264808	XAICHVKMPJODRM-NUJGCVRESA-N	434.512	1.325	50	20	IDGD	
O=C(NNS(=O)(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)c1ccccc1F	733120602	FALLFWLQNLRZOT-UHFFFAOYSA-N	427.479	1.234	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NN=Cc1c(Cl)nc(N)nc1N1CCCC1	734303851	JCCWUMMFLQCLQM-UHFFFAOYSA-N	426.909	1.470	50	20	IDGD	
CN(CC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)[C@H]1CCCN(c2ccccc2)C1=O	734489053	SOAOSVMMVISGOX-SFHVURJKSA-N	425.445	1.483	50	20	IDGD	
CCOCC(=O)NNC(=O)NCc1cccc(NS(=O)(=O)c2ccc(OC)cc2)c1	734684235	MPIXIWZHECSOIW-UHFFFAOYSA-N	436.490	1.363	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@H]2CSc3ccccc32)cc1	735585838	IVPBLZZUYQGJAH-INIZCTEOSA-N	434.543	1.793	50	20	IDGD	
COCCN1CC[C@@H](NC(=O)NNC(=O)[C@@H](C)Oc2cccc(Br)c2)C1	736650581	XFEXUFBPNZIUCS-TZMCWYRMSA-N	429.315	1.268	50	20	IDGD	
CC(C)CNC(=O)N1CCC[C@H](CC(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)C1	741215988	PYGNAOOGROMSEP-OAHLLOKOSA-N	442.561	1.309	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)CNC(=O)c1cccs1)[C@H]1CN(Cc2ccccc2)CCO1	741273152	GGVPNTOCSHQUDU-DOTOQJQBSA-N	445.545	1.098	50	20	IDGD	
COC(=O)c1cc(Cl)cc(S(=O)(=O)NNC(=O)c2cc(OC)cc(OC)c2)c1	741648310	YZQSFIUUHRMPAS-UHFFFAOYSA-N	428.850	1.767	50	20	IDGD	
NC(=O)CS(=O)(=O)c1ccc(C(=O)NNc2nc(-c3ccc(Cl)cc3)no2)cc1	742670172	VZIBXNVKTQTJGC-UHFFFAOYSA-N	435.849	1.406	50	20	IDGD	
COC(=O)[C@H](NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)c1ccccc1F	743461932	PMBRIUVMOAAROG-GOSISDBHSA-N	435.477	1.759	50	20	IDGD	
CC(C)(C)C(=O)NNC(=O)CN1CCN(C(=O)c2ccc(Br)cc2)CC1	744393928	XDOQSUUTCSYXLH-UHFFFAOYSA-N	425.327	1.400	50	20	IDGD	
CC1CCC(N2C[C@H](C(=O)OCC(=O)NNC(=O)c3ccc(C#N)cc3)CC2=O)CC1	744999067	WEIGXMYCATVWMH-ZCDVPAHGSA-N	426.473	1.290	50	20	IDGD	
CC(=O)CCc1ccc(O[C@@H](C)C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1	745108122	WZLYUNKUPBSMHC-HNNXBMFYSA-N	436.468	1.684	50	20	IDGD	
Cc1nc(CN2CCC(CNC(=O)NNC(=O)Cc3cn4ccccc4n3)CC2)oc1C	746766890	YQKPXIJSZASRSM-UHFFFAOYSA-N	439.520	1.724	50	20	IDGD	
CC(C)Cn1c(=O)nc(O)c2c(C(=O)NNC(=O)Cc3ccncc3)cc(C3CC3)nc21	747428184	IRNXEYNDTHCUMC-UHFFFAOYSA-N	436.472	1.429	50	20	IDGD	
Cc1ccsc1[C@H]1C[C@@H]1C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	747975396	LLGDFBWAGYZNGI-ROUUACIJSA-N	426.542	1.765	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)c2ccc([C@@]3(C)NC(=O)NC3=O)cc2)cc1	748013350	PKIPUYRSTQRMCU-WHEQGISXSA-N	440.456	1.368	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)N(C)CC(=O)NNc2cccc([N+](=O)[O-])c2C)cc1	748693591	PEKIOQRKXJIBGU-UHFFFAOYSA-N	435.462	1.625	50	20	IDGD	
Cc1cc(Br)ccc1NNC(=O)c1ccc(S(=O)(=O)CC(N)=O)cc1	748744576	SYCOATLOZQFBBV-UHFFFAOYSA-N	426.292	1.773	50	20	IDGD	
Cc1cc(Br)ccc1NNC(=O)c1ccc2c(c1)S(=O)(=O)N=C1N=CNN12	748748880	VARORNNVLACRIN-UHFFFAOYSA-N	449.290	1.926	50	20	IDGD	
Cc1ccc(-c2nnc(S)n2CC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1	751069708	IDNQBYMVCPCRMN-INIZCTEOSA-N	425.470	1.530	50	20	IDGD	
C[C@@H]1CCCN(c2ccc(C(=O)NNC(=O)CNC(=O)c3ccco3)cc2[N+](=O)[O-])C1	751211690	JITYIGIUXBIWJJ-CYBMUJFWSA-N	429.433	1.615	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)c1cccn1Cc1ccncc1	751291157	SAGBYMAIYGZREJ-UHFFFAOYSA-N	432.528	1.905	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=S)N[C@H](C)C2CC2)ccc1OC	751617367	JHUJWBIQCMFVHL-GFCCVEGCSA-N	428.580	1.633	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)C[C@@H]3CSCCS3)cc2)CC1	752143125	AGUSELAACKUXHL-OAHLLOKOSA-N	430.621	1.305	50	20	IDGD	
COc1cc(OC)cc(N2C[C@@H](C(=O)NNC(=O)COc3ccc(C)c(C)c3)CC2=O)c1	752399762	VYERWYQSWJAQJF-INIZCTEOSA-N	441.484	1.900	50	20	IDGD	
COc1ccc(CCCC(=O)NNC(=O)c2csc(N3CCOCC3)n2)c(OC)c1	753891334	MSZBOFNBEGQOAX-UHFFFAOYSA-N	434.518	1.781	50	20	IDGD	
COc1cccc(-c2noc(SCC(=O)NNC(=O)CNC(=O)c3ccco3)n2)c1	755224115	YWZSPKNOEQONDM-UHFFFAOYSA-N	431.430	1.008	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)Nc2ccc(N3C[C@H](C)O[C@@H](C)C3)nc2)cc1	755867014	UMQLLNKOWVCHOT-GJZGRUSLSA-N	429.477	1.936	50	20	IDGD	
CNC(=O)c1cc(NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)ccc1Cl	756034938	BWSMELGMJDVDRA-UHFFFAOYSA-N	431.884	1.559	50	20	IDGD	
O=C(NNC(=O)c1c(O)cccc1O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	756765639	OVTPXGSQUXRHJF-UHFFFAOYSA-N	441.465	1.651	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)Nc2cc(C3CC3)nn2[C@H]2CCS(=O)(=O)C2)c1	756853951	AZIWKJMHEPRLPE-HNNXBMFYSA-N	447.517	1.660	50	20	IDGD	
COc1ccc(OC(F)F)c(CNC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c1	756961210	OFUWOLAFUAYLAF-UHFFFAOYSA-N	443.428	1.844	50	20	IDGD	
CS(=O)(=O)CCc1ccc(NC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1	757749760	XVJYGGNRCVQDCN-UHFFFAOYSA-N	427.486	1.926	50	20	IDGD	
COCc1nc(OC)c2c(C)c(C(=O)N([C@@H]3CCS(=O)(=O)C3)N(C)C)sc2n1	757867763	VEYBZSYEARSFMK-LLVKDONJSA-N	428.536	1.261	50	20	IDGD	
Cc1ccc(Cn2nc(C)c(CCC(=O)NNC(=O)C(=O)Nc3ccccn3)c2C)cc1	758830371	AHOKDOSZOHASLD-UHFFFAOYSA-N	434.500	1.970	50	20	IDGD	
COc1cc(F)cc(NNC(=O)CNS(=O)(=O)c2ccc3c(c2)OCCCO3)c1	759327721	ZSZRTCIBFTVJCB-UHFFFAOYSA-N	425.438	1.417	50	20	IDGD	
N#C/C(=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)N1CC[C@H](CO)C1	759703568	OMQIJXBKFFXZGF-CIKBWMHTSA-N	427.892	1.827	50	20	IDGD	
Cc1cc(C)nc(-n2nccc2NC(=O)C(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)n1	760280708	XDXJBQLBGQCYDM-UHFFFAOYSA-N	437.504	1.581	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)CCNC(=O)[C@H]1CCCN1C(=O)OC(C)(C)C	760812307	BAWBSDZKNGSNQC-OAHLLOKOSA-N	434.493	1.362	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)CN1C(=O)N[C@]2(CCCC[C@@H]2C)C1=O	761622932	ZXXAYBKMQPZYKV-RBZFPXEDSA-N	434.518	1.435	50	20	IDGD	
C[C@H]1CN(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)CCN1CC(F)(F)F	762576927	ODEQHNWTQDSJRO-ZDUSSCGKSA-N	429.447	1.002	50	20	IDGD	
Cc1cc(C)cc(C(=O)N2CCC[C@@H](C(=O)NNc3nccc(N4CCOCC4)n3)C2)c1	762856903	ZCUQZMKKGZCVJQ-GOSISDBHSA-N	438.532	1.926	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)CN(C)[C@@H]2CCSC2)c2ccccc2c1=O	763270913	ZBZBIOZDWLDMHZ-OAHLLOKOSA-N	431.562	1.785	50	20	IDGD	
CCOC(=O)c1cnn(-c2ccc(NC(=O)C(=O)NNC(=O)CC)cc2)c1C(F)(F)F	763442330	UKPMMZMMQRAGPK-UHFFFAOYSA-N	441.366	1.564	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1cccc(CN2CCCCC2)c1	763471311	HBJDWPQOUKBTTP-UHFFFAOYSA-N	425.445	1.980	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)NC(C)C)c(C)c2)cc1OC	763550161	JIKZZOFITYEELR-UHFFFAOYSA-N	442.472	1.550	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)cccc1C(=O)N1CCCC1	763551883	TWEFUTDDMWMXBG-UHFFFAOYSA-N	438.440	1.359	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)[nH]n1)C(=O)Nc1cnc(-c2ccccc2)nc1	763614029	OWXYRPMDIDHDKU-UHFFFAOYSA-N	427.424	1.933	50	20	IDGD	
CON(C)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(C)nc3ccccc23)cc1	763617131	UPBBFNKZJWKJPY-UHFFFAOYSA-N	435.440	1.576	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)COc2cc(C)ccc2C)cc(OC)c1OC	763667856	DGPHNDUAVBWISW-UHFFFAOYSA-N	431.445	1.494	50	20	IDGD	
O=C(NNC(=O)c1cccc(Cl)c1)C(=O)Nc1cccc(C(=O)N2CCSCC2)c1	763747952	JUPVVCCVYGMOIH-UHFFFAOYSA-N	446.916	1.929	50	20	IDGD	
CCOC(=O)/C=C/c1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)cc1	763855637	AASKWGNCHWWPIO-JWAFFJSPSA-N	443.431	1.955	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccnc(OCC(F)(F)F)c1	763858666	VQPGMGGEDOUGJC-JTQLQIEISA-N	444.341	1.715	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)NNC(=O)C(=O)Nc1cccc(Cl)c1-n1cncn1	763865732	SZPBYXLYHCNBGQ-UHFFFAOYSA-N	437.847	1.731	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cnn(Cc3ccccc3)c2)cc1	763872138	KORDMPNLOBPZLW-INIZCTEOSA-N	449.467	1.687	50	20	IDGD	
COC(=O)c1cc(F)ccc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccc(C(C)=O)cc1	763879527	XQOBAJRGVAUKEC-GFCCVEGCSA-N	445.403	1.368	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccc(CN3CCC(C)CC3)cc2)n1	763881819	QRVYWJUTYZREIR-UHFFFAOYSA-N	426.521	1.518	50	20	IDGD	
O=C(NNC(=O)c1ccc(Br)s1)C(=O)Nc1ccc(-c2ncon2)cc1	763939116	JBLXDCJCFIUFTA-UHFFFAOYSA-N	436.247	1.960	50	20	IDGD	
CC(=O)NCc1ccc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CC[C@@H](C)C3)cc1	763940392	HIDBFUJXFFSNFP-GFCCVEGCSA-N	428.514	1.909	50	20	IDGD	
CC(C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)on2)cc1	764004442	WFVMKWIQUOEVLD-UHFFFAOYSA-N	435.440	1.880	50	20	IDGD	
CCOC(=O)c1c(C2CC2)csc1NC(=O)C(=O)NNC(=O)[C@@H]1Cc2ccccc2O1	764168125	NTVHHVBAUWZDTQ-HNNXBMFYSA-N	443.481	1.892	50	20	IDGD	
COC(=O)c1c(NC(=O)C(=O)NNC(=O)c2ccc(C#N)cc2)sc2c1CCCC2	764181812	HEJBVXYSBXBDOS-UHFFFAOYSA-N	426.454	1.685	50	20	IDGD	
N#Cc1ccc(CS(=O)(=O)CC(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)cc1	764332809	BDBZTUGKXHNLRO-UHFFFAOYSA-N	448.451	1.787	50	20	IDGD	
CN(C)C(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)ccc1Cl	764345709	JFSOFMWQCWYWJF-UHFFFAOYSA-N	439.255	1.801	50	20	IDGD	
C[C@H]1CCCCN1CCOc1ccccc1C(=O)NNC(=O)CNC(=O)c1cccnc1	764345814	XEUYZABTYFUQPC-KRWDZBQOSA-N	439.516	1.526	50	20	IDGD	
COC(=O)c1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)c1cnn(-c2ccccc2)c1	764350891	MNFKXLOETGEHOS-UHFFFAOYSA-N	441.831	1.712	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)C(=O)Nc1ccc(-n2cccn2)c(Cl)c1	764367743	LTMFCVOSIARHBC-UHFFFAOYSA-N	427.848	1.828	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cccc(C)c3C#N)n[nH]2)cc1OC	764379354	WWUWAMQDZZDXHS-UHFFFAOYSA-N	448.439	1.674	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)cc1C	764381875	BFSWOAHUDQQSIQ-UHFFFAOYSA-N	427.442	1.633	50	20	IDGD	
C#CCOc1ccc(F)cc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	764388296	QIKPSTQZYNRFAG-UHFFFAOYSA-N	439.378	1.767	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1ccc(NC(=O)C2CC2)cc1	764398275	REQOZBCXUGHIID-UHFFFAOYSA-N	442.497	1.922	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H](O)[C@H](C)c2ccc(C)cc2)c1	764584907	LPBWBNNPAQERPP-UZLBHIALSA-N	447.557	1.951	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2cc(C(F)(F)F)ccn2)c1	765345828	TWIREKOLEMTMKO-UHFFFAOYSA-N	431.396	1.817	50	20	IDGD	
CCOC(=O)NNC(=O)C(=O)Nc1ccc(S(=O)(=O)N2C[C@@H](C)C[C@@H](C)C2)cc1	765413234	DUGIFASTLGBRNM-BETUJISGSA-N	426.495	1.069	50	20	IDGD	
CON(C)C(=O)[C@H](CCSC)NC(=O)NNC(=O)c1ccc(Br)s1	765640389	JLXCZRUFLRSWRG-QMMMGPOBSA-N	439.357	1.596	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)[C@H]3CCC[C@H](C)C3)CC2)cc1	765727851	JCMCTRMPUORTHQ-ROUUACIJSA-N	436.578	1.275	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3ccn(-c4ccccc4)n3)CC2)cc1	765747138	CGTWDGWFWQRPSJ-UHFFFAOYSA-N	432.528	1.760	50	20	IDGD	
O=C(CNC(=O)c1ccccc1)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	765752986	TXCMURIXPSOPFK-UHFFFAOYSA-N	443.935	1.035	50	20	IDGD	
NC(=O)c1ccc(/C=C/C(=O)N2CCC[C@@H]2C(=O)NNc2ncnc3ccsc23)cc1	766671375	JDRVRPUDKOYFGB-CDVVCGDMSA-N	436.497	1.938	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCc1ccc2c(n1)CCCC2	767759126	AEPZFRHMFVVYNF-UHFFFAOYSA-N	430.534	1.706	50	20	IDGD	
CC(C)(C)[C@H](Br)C(=O)N1CCN(c2cc(N3CCOCC3)ncn2)CC1	768175382	MEEMDAPKNXRROF-MRXNPFEDSA-N	426.359	1.771	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)[C@@H](c1ccccc1)N1CCC(O)CC1	768637109	CUOCUZAVZJELGU-HXUWFJFHSA-N	433.530	1.740	50	20	IDGD	
CCOC(=O)c1n[nH]c(C2CCN(CC(=O)NNC(=O)c3cc(C)c(CC)s3)CC2)n1	770038376	MNDGDVNVJUGMGI-UHFFFAOYSA-N	448.549	1.554	50	20	IDGD	
CNS(=O)(=O)c1cccc(CNC(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)c1	770342497	ROGBAJSLBRUVEZ-UHFFFAOYSA-N	448.509	1.021	50	20	IDGD	
CN1CCN(c2ccc(C=NNC(=O)c3ccc(Cl)c(S(N)(=O)=O)c3)cc2)CC1	771549657	IATZIYYHIPVSLE-UHFFFAOYSA-N	435.937	1.503	50	20	IDGD	
Cn1c(O)nc2ncc(-c3cccc(C(=O)NNc4nccc(N5CCOCC5)n4)c3)cc21	771826351	OFQGIWDRMXNLMH-UHFFFAOYSA-N	446.471	1.724	50	20	IDGD	
O=C(Cc1ccc(NC(=O)C2CC2)cc1)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772193537	WEBXLFKVPDASPO-UHFFFAOYSA-N	428.876	1.695	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)c2cc(S(C)(=O)=O)ccc2F)C1	773417656	HDVNWLLEAVGMCD-LBPRGKRZSA-N	443.497	1.637	50	20	IDGD	
COc1ccc(C(=O)N2CCCC2)cc1NC(=O)C(=O)NNc1cnc2ccccc2n1	773719743	YWIWJFJQZNDUBA-UHFFFAOYSA-N	434.456	1.956	50	20	IDGD	
COC(=O)[C@H](C)n1cccc1C=NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	774574688	IITZXUAXMHACCK-HNNXBMFYSA-N	448.501	1.007	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1N1CCOCC1	776108264	WNWUOZNKGJMTAU-UHFFFAOYSA-N	429.433	1.313	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)N[C@@H]1CCN(c2ccc(F)c(Cl)c2)C1=O	777753340	WZGBEUKQIRHSNX-MRXNPFEDSA-N	444.854	1.805	50	20	IDGD	
CC(C)n1nc(C(=O)NNS(=O)(=O)c2ccc3c(c2)OCO3)c2ccccc2c1=O	777913696	QCPDVVWYISHQAA-UHFFFAOYSA-N	430.442	1.329	50	20	IDGD	
O=C(NNC(=O)C1CCC1)c1cc(I)ccc1N1CCOCC1	778782519	FYYATONOXMGAAW-UHFFFAOYSA-N	429.258	1.689	50	20	IDGD	
COC(=O)CNC(=O)NN=C(C)c1ccc(S(=O)(=O)Nc2ccc(C(=O)O)cc2)cc1	779821493	XYHMAJYGTOCHJB-UHFFFAOYSA-N	448.457	1.382	50	20	IDGD	
Cc1cc(N2C[C@H](C(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)CC2=O)ccc1F	779839669	NTQBVBZIWNPAAL-CQSZACIVSA-N	433.461	1.352	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NCC2CCN(CC(F)(F)F)CC2)c2ccccc2c1=O	780632814	OQICMYJCNHNGOC-UHFFFAOYSA-N	440.426	1.152	50	20	IDGD	
O=C1CN(CCNC(=O)NNC(=O)c2cc(-c3ccccc3)nc3ccccc23)CCN1	781400376	JBRBXUYNFWXKQG-UHFFFAOYSA-N	432.484	1.278	50	20	IDGD	
C[C@H]1CN(C(=O)CCC(=O)C(C#N)=C2N(C)c3ccccc3N2C)CCN1CC(C)(C)O	781861540	KUGJYSOSSXBDJL-KRWDZBQOSA-N	439.560	1.961	50	20	IDGD	
C[C@H](NCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)c1cccc(NS(C)(=O)=O)c1	781910776	NOGLITMPBNBSHL-LBPRGKRZSA-N	435.462	1.078	50	20	IDGD	
O=C(CCSc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccc(OC2COC2)cc1	782119886	ARYUWLCRZJZOJP-UHFFFAOYSA-N	433.461	1.872	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NN=c2sc3ccccc3n2C)ccc1N1CCOCC1	783349232	FNDIVJPGCLYMTH-UHFFFAOYSA-N	425.514	1.955	50	20	IDGD	
Cc1ccc(C)c(NNC(=O)C(=O)Nc2ccc(C(=O)NCC(=O)N(C)C)c(Cl)c2)c1	783366578	LKXKFRAKICECFN-UHFFFAOYSA-N	445.907	1.857	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)NC(C)(C)C)cc1	784833587	OHFUGLVKYYYGCQ-UHFFFAOYSA-N	448.501	1.632	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)C(=O)NNc1cccnc1Cl	784847753	FFUNXZNCBQHYLC-UHFFFAOYSA-N	441.897	1.466	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)C(=O)Nc1cccc(COCc2ccco2)c1	785061203	UTIPMUCKWHMQKC-UHFFFAOYSA-N	447.451	1.973	50	20	IDGD	
C#CCOc1ccccc1NC(=O)C(=O)NNc1c(F)cc(C(=O)NC2CC2)cc1F	785099560	IQAKRXCMMXDEPT-UHFFFAOYSA-N	428.395	1.951	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)[C@@H]1CC(c2c(F)cccc2F)=NO1	786523751	UUUBTCXBVHGJTO-HNNXBMFYSA-N	436.802	1.575	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2cccc(CNC(=O)OC(C)(C)C)c2)C[C@@H](C)O1	787993406	SNFDXBWARKZECT-IYBDPMFKSA-N	434.537	1.972	50	20	IDGD	
COc1cccc(NC(=O)COc2ccc(C(=O)NNC(=O)N3CCN(C)CC3)cc2)c1	788167625	WBXBXOZWCVHJSK-UHFFFAOYSA-N	441.488	1.315	50	20	IDGD	
COc1ccc(-c2nnc(S)n2CCC(=O)NNc2ccccc2S(N)(=O)=O)cc1	788232469	SIVTYGWERIEFDJ-UHFFFAOYSA-N	448.530	1.423	50	20	IDGD	
N#Cc1cccc(-c2cc(C(=O)OCC(=O)NNC(=O)[C@@H]3COc4ccccc4O3)on2)c1	789127259	LUHRGKWXUCPFJG-IBGZPJMESA-N	448.391	1.357	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c(O)c1	789727453	ONFYBXQVARYVPZ-UHFFFAOYSA-N	435.502	1.896	50	20	IDGD	
CC(=O)N1CCc2ccc(S(=O)(=O)NNC(=O)C(C)(C)c3ccccc3)cc2CC1	790068294	HLGGSGWNSAGFBJ-UHFFFAOYSA-N	429.542	1.921	50	20	IDGD	
CCS(=O)(=O)c1ccc([C@H](C)NC(=O)NNC(=O)CNC(=O)c2cccs2)cc1	790691165	IFCHQNGWZWTAHE-LBPRGKRZSA-N	438.531	1.363	50	20	IDGD	
CCS(=O)(=O)c1ccc(CNC(=O)NNC(=O)CSc2ccccc2O)s1	792221631	CRLPKXPZJJIPPO-UHFFFAOYSA-N	429.545	1.870	50	20	IDGD	
COc1cc(C(F)(F)F)ncc1NC(=O)C(=O)NNC(=O)COc1cc(C)cc(C)c1	792268958	QPQWLMDZHBWLDW-UHFFFAOYSA-N	440.378	1.891	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)C(=O)Nc1ccc(N2CCCCC2)c2ncccc12	792355915	JSQNSQVZDQTMKV-UHFFFAOYSA-N	432.484	1.949	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(C)n2)cc1N1CCCCC1=O	797369622	BHQCNXWKQKEZGX-UHFFFAOYSA-N	425.445	1.315	50	20	IDGD	
C=C(C)[C@H]1OCC[C@@H]1CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	798117292	WXRGZZAHALYRIL-SJLPKXTDSA-N	436.534	1.396	50	20	IDGD	
CCOc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NNC(=O)COc1cc(C)cc(C)c1	799256996	FAPUAKXIPKCVSI-UHFFFAOYSA-N	430.417	1.775	50	20	IDGD	
Cc1ccc(-n2cc(O)c(C(=O)OCC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)n2)cc1	801370915	JFUMDTZGTXMDSQ-UHFFFAOYSA-N	439.384	1.413	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2nc(C)n(-c3n[nH]c(C(F)(F)F)n3)n2)cc1	802056957	IDFLPJUEZNUCOH-UHFFFAOYSA-N	425.331	1.188	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2cccnc2OCC(F)(F)F)cc1	802065484	BWVHHSAYZGVHBP-UHFFFAOYSA-N	432.380	1.893	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)CCc2nc(O)c3cnn(C)c3n2)cc1Cl	802075641	FKAZNPMDFSTRJK-UHFFFAOYSA-N	449.855	1.525	50	20	IDGD	
CNS(=O)(=O)c1ccc(C(=O)NNC(=O)Nc2cc(OC)c(Cl)cc2OC)cn1	802080369	CUJSFWSRTLPPSE-UHFFFAOYSA-N	443.869	1.127	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(OC(F)F)nc2)cc1	802566532	UJIWZNIIBUCQTF-LLVKDONJSA-N	436.371	1.439	50	20	IDGD	
O=C(NCc1ccc(S(=O)(=O)N2CCCC2)cc1)NNc1ccc(-n2ccnc2)nn1	804921524	DROQYPRWHPMRQB-UHFFFAOYSA-N	442.505	1.273	50	20	IDGD	
CN1CCN(C(=O)NNC(=O)Cc2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2)CC1	807381540	YHSVUSVVRLAIIC-UHFFFAOYSA-N	449.508	1.157	50	20	IDGD	
COC(=O)c1c(F)ccc(NC(=O)C(=O)NNc2ccc(Br)nc2)c1F	810396601	BXOKXMMFBRKQKL-UHFFFAOYSA-N	429.177	1.991	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)cc1	810585709	FMUJPJIXGFOJNJ-UHFFFAOYSA-N	431.449	1.264	50	20	IDGD	
CCCS(=O)(=O)Nc1ccc(C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)cc1	812729803	VELPOXBEMYECSI-UHFFFAOYSA-N	440.547	1.846	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)c1c(I)cnn1C	814103398	YOWIAGIRHPYMQY-QMMMGPOBSA-N	432.193	1.392	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)Nc1ccccc1CN1CCOCC1	814617278	GRMMYNFRNXFINP-UHFFFAOYSA-N	433.534	1.918	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccccn2)cc1S(=O)(=O)C1CCCC1	815564110	XRKFILCNVYVJNO-UHFFFAOYSA-N	430.486	1.506	50	20	IDGD	
Cc1csc(-c2ccc(NC(=O)C(=O)NNC(=O)[C@@H]3CCc4nncn4C3)cc2)n1	815692441	RDHPTUQYENCREV-CYBMUJFWSA-N	425.474	1.059	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2CCc3nncn3C2)cc1Cc1ccccc1	815692467	RQPWGNQXRASVJX-MRXNPFEDSA-N	448.483	1.226	50	20	IDGD	
CCCn1c(CCC(=O)NNc2nc[nH]n2)nc2cc(S(=O)(=O)N3CCCC3)ccc21	816634831	UHTGVZOGILIIBC-UHFFFAOYSA-N	446.537	1.425	50	20	IDGD	
CCOC(=O)[C@H](CC(=O)NNC(=O)[C@H](C)Oc1cccc(Br)c1)C(C)=O	816828550	IQZOWYJPJGSFLS-SMDDNHRTSA-N	429.267	1.522	50	20	IDGD	
CCCCCn1nc(C(=O)NNS(=O)(=O)N2C[C@H]3CC[C@H]2C3)c2ccccc2c1=O	821126926	AADRGBUALBCGPK-GJZGRUSLSA-N	433.534	1.550	50	20	IDGD	
O=C(COC(=O)c1cccc(OC[C@@H]2CCCO2)c1)NNC(=O)c1ccc([N+](=O)[O-])cc1	844474057	PJFXGJLFUZXLOO-SFHVURJKSA-N	443.412	1.771	50	20	IDGD	
Cc1ccc([C@]2(C)NC(=O)N(CC(=O)NNC(=O)COc3ccccc3F)C2=O)cc1	864020226	LCHUSELBYAWRPK-NRFANRHFSA-N	428.420	1.128	50	20	IDGD	
N#C/C(=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)OC[C@H]1CNC(=O)O1	914005699	UTKWRMCKVMICJI-ROCHPLJESA-N	443.847	1.637	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)Cn2cc(Br)ccc2=O)cc1	914864136	VRWODSPVTGHCLI-LBPRGKRZSA-N	438.278	1.624	50	20	IDGD	
C[C@@H](Oc1ccc2c(c1)CCC2)C(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	915483238	DLXNBISCOLAALK-CYBMUJFWSA-N	427.413	1.855	50	20	IDGD	
CNS(=O)(=O)Cc1ccc(CNC(=O)NNC(=O)c2ccc3ccccc3n2)cc1	916228442	CEWKGTCQEVCTQR-UHFFFAOYSA-N	427.486	1.428	50	20	IDGD	
CCc1ccccc1OCC(=O)NN=C(C)c1ccc(S(=O)(=O)N2CCNCC2)cc1	916303930	VFFPWSDKVQUGFX-UHFFFAOYSA-N	444.557	1.762	50	20	IDGD	
Cc1nn([C@@H]2CCS(=O)(=O)C2)c(Cl)c1C=NNC(=O)CCN1CCCCCC1	916356280	ZPPSQJNSLDJIMK-OAHLLOKOSA-N	429.974	1.921	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)NC1CCN(Cc2ccccn2)CC1	916382163	BDNKYLYTMXDZPP-UHFFFAOYSA-N	427.505	1.854	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2cnc3cc(C)ccn3c2=O)c2ccccc2c1=O	916728483	VJEVPGVLNKFZLU-UHFFFAOYSA-N	432.440	1.198	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)[C@@H]2CCCN(S(=O)(=O)c3ccc(C)cc3)C2)c1O	917361105	PEJPTMSVNSAOJQ-OAHLLOKOSA-N	447.513	1.571	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2ccc(-c3cnco3)cc2)cc1	917393692	SVKZJDQANPTJNW-UHFFFAOYSA-N	428.470	1.732	50	20	IDGD	
Cc1ccc(F)cc1S(=O)(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	917717775	LGVLQTVGTXNMLV-UHFFFAOYSA-N	441.506	1.542	50	20	IDGD	
N#Cc1ccc(S(=O)(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c(C(F)(F)F)c1	917727871	PCYMWIIFENPCTF-UHFFFAOYSA-N	437.363	1.176	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)no1	918008113	IEHRDZPBZROQOU-UHFFFAOYSA-N	446.427	1.085	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)Nc1cccc(CN2C(=O)CNC2=O)c1	920933562	WMAQRRHWCBHHOQ-LBPRGKRZSA-N	429.408	1.498	50	20	IDGD	
CC1(C)NC(=O)N(CCCC(=O)NNC(=O)COc2ccc(Br)cc2)C1=O	921193414	VBRNEHFTBNYGQH-UHFFFAOYSA-N	441.282	1.086	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)c2cc(Cl)ccc2-n2cnnn2)CC1	1116086070	UONBGCQSRXPWMV-UHFFFAOYSA-N	449.899	1.724	50	20	IDGD	
COc1ccc(/C=C(/C#N)C(=O)Nc2ccc(N3CCOCC3)cc2)cc1OCC(N)=O	1248407598	ZHPOEJATIKEBHF-ATVHPVEESA-N	436.468	1.942	50	20	IDGD	
COc1ccc(N(C(C)=O)c2nc(C=NNC(=O)[C@H]3CCS(=O)(=O)C3)cs2)cc1	1321784222	SYLVHSWPGIODEN-ZDUSSCGKSA-N	436.515	1.721	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)NCC(=O)N2CCCC2)c2ccccc2c1=O	1339312237	PCYSLBXUCJGMAW-UHFFFAOYSA-N	428.493	1.153	50	20	IDGD	
CN(NC(=O)c1n[nH]cc1Br)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	1346303928	UBNUVSYKDANCHP-UHFFFAOYSA-N	431.291	1.422	50	20	IDGD	
O=C(c1cc2cc[nH]c2cc1Cl)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1777997394	XRSPXISCVCVKPJ-APWZRJJASA-N	426.300	1.865	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc3cccn3cn2)C1	1778724205	MVYCXTGBYBNFJS-YRISNDGFSA-N	434.924	1.716	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1[nH]cnc1-c1cccnc1)CCO2	1779298786	NZNICJGQVXONHE-OAQYLSRUSA-N	443.580	1.767	50	20	IDGD	
CCOCC(=O)N1CCO[C@@]2(CCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1	1780096821	HJVXQYYSPAZYCN-FQEVSTJZSA-N	435.433	1.000	50	20	IDGD	
CC(C)(C)n1cc(C(=O)N2CC[C@]3(CN(C(=O)CCBr)CCO3)C2)nn1	1780353207	VNODFDJMQAWHJP-KRWDZBQOSA-N	428.331	1.262	50	20	IDGD	
C/C=C(\C)C(=O)N1CCO[C@@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1	1780968227	GYFQOMVMTLADOS-PKSGZFLJSA-N	443.548	1.129	50	20	IDGD	
C=C(CC(=O)OCC)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](Br)CC)CCO2	1781271554	DSTNYOIRNAKGPS-KBXCAEBGSA-N	431.327	1.499	50	20	IDGD	
COc1cccc(CCC(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](F)Br)C3)C2)n1	1781327069	WUMLKPPPUFIKMB-WMZOPIPTSA-N	444.301	1.543	50	20	IDGD	
C[C@@H](Oc1ccccc1)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781332662	ISKPXSFQJWMJAW-SIIHOXLZSA-N	429.286	1.974	50	20	IDGD	
O=C(c1c(F)ccc(O)c1F)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1781932393	NKLKZXDWZLZSCI-CZUORRHYSA-N	437.212	1.804	50	20	IDGD	
C[C@@H](NC(=O)OC(C)(C)C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Cl)C2	1782083154	XMYJBMHYBLBGGE-QGDIXAPHSA-N	435.924	1.948	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(C(N)=O)cc1)C2	1782177768	CAYGMKVBYMRJEV-CSODHUTKSA-N	437.924	1.167	50	20	IDGD	
O=C1CCc2ccc(C(=O)N3CC[C@]4(C3)CN(C(=O)[C@@H](F)Br)CCO4)cc21	1782313333	VBLVKRHIJZKPRE-APWZRJJASA-N	439.281	1.950	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)n2cccn2)C1	1782555036	SCEBZQUQLYJFDM-YKTARERQSA-N	441.370	1.989	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccn4nccc4c3)CCO2)C1	1783349573	NTZYIWLNHBLCRL-LPHOPBHVSA-N	435.322	1.951	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2	1783854531	OCZJXHDXPIAKQH-VZJWBNGJSA-N	447.359	1.808	50	20	IDGD	
CCc1nn(C)c(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](Cl)COC)C3)C2)c1Cl	1783873665	RYNYTVUGDHWHCH-SGTLLEGYSA-N	433.336	1.333	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(C(F)(F)F)nc3)CCO2)C1	1783877157	VQRIUJGJXHHTJD-SUMWQHHRSA-N	435.830	1.798	50	20	IDGD	
Cc1ccc(-n2ccnn2)c(C(=O)N2CCO[C@@]3(CCN(C(=O)C(Cl)Cl)C3)C2)c1	1783949988	QUGISOFZAVMJKU-LJQANCHMSA-N	438.315	1.823	50	20	IDGD	
Cc1cc(C)n(CCC(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)n1	1784321159	KPCXRDWNIXJPQO-CRAIPNDOSA-N	427.343	1.503	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](N)c3ccccn3)[C@H]2C1	1786869657	CEKHEZOXHPDQHJ-FZQIUNFVSA-N	429.348	1.297	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3csc4c3CCCO4)[C@H]2C1	1787260424	RTJYQZUCYSBMNB-SDNTUTLCSA-N	442.965	1.920	50	20	IDGD	
CCn1nc(C)cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)CBr)C[C@@H]21	1787286216	JTBUAMPWGPQTDM-DYWXZXKOSA-N	441.370	1.836	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4nc(CO)[nH]c4c3)[C@H]2C1	1787873555	SJSRLJFBWSMRFX-XSWJXKHESA-N	434.924	1.666	50	20	IDGD	
O=C(NC1(c2ccc(NC(=O)c3nc[nH]c3[N+](=O)[O-])cc2)CCC1)c1cccc(B(O)O)c1	1788611545	ADBBNIRAJQAFCS-UHFFFAOYSA-N	449.232	1.059	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3n[nH]c4c3CCCC4)C[C@@H]21	1788765260	WTMALLPSWMAZJO-ZVZYQTTQSA-N	434.613	1.733	50	20	IDGD	
CCc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)Br)C[C@@H]32)n(C)n1	1788946232	PGZOIYMBRJMPDI-DUPGQFARSA-N	427.343	1.359	50	20	IDGD	
CC(=O)N[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21)c1ccc(F)cc1	1789696056	HNELCQCVXJWLTA-HILJTLORSA-N	443.878	1.517	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cn4ccsc4n3)C[C@@H]21)[C@@H](F)Br	1789926444	YFCMJOWXGYOXDI-XRRVDJEJSA-N	445.314	1.680	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)c3ccco3)C[C@@H]21	1790960539	BVTLOZDZWVTRJD-IICXDKKESA-N	429.311	1.466	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4ncnn4c3)C[C@@H]21	1791056372	VYDOSNSTFPGKGE-MXAVVETBSA-N	436.310	1.106	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnn4c3CCC4)C[C@@H]21	1791063430	IUFKXMQRJIXXNR-DUPGQFARSA-N	425.327	1.206	50	20	IDGD	
Cc1nccn1[C@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)CBr)C[C@@H]21	1791700697	MQQLMCPAHWPWOP-WLGNDBIMSA-N	441.370	1.763	50	20	IDGD	
Cc1nccn1[C@H](C)C(=O)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1	1791929646	NXUHTFXJRRQOIY-MRXNPFEDSA-N	446.316	1.880	50	20	IDGD	
COc1ccc(CCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CCC(=O)NN(C)C)C3)cn1	1794158410	CCXLUBLINZMSSB-BCDXTJNWSA-N	431.537	1.034	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(N2CCCNC(=O)C2)n1	1794840136	CXDCQKFXDCYFHZ-YVSFHVDLSA-N	447.967	1.677	50	20	IDGD	
COc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)C(C)(C)CCl)C3)n1	1796717663	BLPQPBVHIZSCEL-JJLQDPRZSA-N	440.884	1.467	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1sc(N)nc1C)C2	1796892225	PFXSIWNGGXMCCG-MGGJZVGQSA-N	443.533	1.420	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(N2CCCC2)ccn1	1797053187	WWDXLCIDCZYLCI-GGPHIMKMSA-N	442.564	1.307	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2)c1n[nH]c2c(F)cccc12	1797487910	TVXVWIQAXJUFGG-QHBPRCKVSA-N	439.285	1.690	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccn(C(F)F)c1=O	1797994304	BCASRQJXEWRZBL-KQXIARHKSA-N	448.264	1.230	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc3cnccc3[nH]1)C2	1798440351	JCOSZGHFOCYGRJ-QDMKHBRRSA-N	433.472	1.127	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(-c3ccco3)no1)C2)[C@H](F)Br	1799346255	MGXKOMWGHNZVJA-OWLDWWDNSA-N	442.241	1.828	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3cccnn3n1)C2	1800642151	YPOMIIGILWXKEV-LMWOUKEDSA-N	436.310	1.106	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(=O)c3ccccc3o1)C2	1800970777	JDADYTAXBGEALQ-QPWUGHHJSA-N	434.876	1.250	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1ccc(OC)cc1F)C2	1800978059	KOMGJOULSXEAND-DOHHPOSVSA-N	442.915	1.610	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CC1CCC(C)(C)CC1)C2	1801012620	SFHKJSYPKSOTAZ-OPMZPASUSA-N	436.597	1.556	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@H]1CCN(C(=O)c2cc(O)ncn2)[C@H]1c1cccnc1	1803010687	JHAAEPVZMOVZAU-MRRJBJDNSA-N	448.321	1.928	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@H]1CCN(C(=O)Cn2nccn2)[C@H]1c1cccnc1	1803015800	OQKGRZZACNISFA-UNEWFSDZSA-N	435.326	1.410	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)Cn2nnc3ccccc32)[C@H]1c1cccnc1)[C@H](O)CCl	1803136792	VIKLFBIGUJMLJR-CVAIRZPRSA-N	442.907	1.132	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1CCSCC1	1804481119	GFOOOKNMPGWINJ-DZBUXLHASA-N	431.562	1.902	50	20	IDGD	
COc1cc(C(=O)NC[C@H]2CCN(C(=O)CO[Si](C)(C)C)[C@H]2c2cccnc2)n(C)n1	1804923578	LJKRZDVUFBGJPA-UZLBHIALSA-N	445.596	1.995	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)N1CCC2(CCCN(C(=O)[C@@H](C)CBr)C2)CC1	1805385344	WQTDQZAQELWMEU-LSDHHAIUSA-N	445.402	1.956	50	20	IDGD	
COCCOCC(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)Br)[C@H]1c1cccnc1	1806761693	KLSKMPLAOMKYNV-KMFMINBZSA-N	428.327	1.534	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@@H](CNC(=O)Cn2cncn2)[C@@H]1c1cccnc1	1807597435	VXTOHPCGWDOMTP-KMFMINBZSA-N	435.326	1.410	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)[C@H]2C[C@H]2F)[C@@H]1c1cccnc1	1807821154	WAGNJVIXONUZGJ-GCFKLVLTSA-N	440.479	1.579	50	20	IDGD	
Cn1cnc(C(=O)N2CC[C@H](CNC(=O)[C@@](C)(Cl)CCl)[C@@H]2c2cccnc2)n1	1808292594	ZAEWJEDZPCPLME-GLJUWKHASA-N	425.320	1.766	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)c1cn2cccnc2n1	1809776514	ZBXNODCRLWLEQW-BHYGNILZSA-N	428.880	1.044	50	20	IDGD	
Nc1c(C(=O)N2CCCC3(CCN(C(=O)[C@H](O)CCl)CC3)C2)sc2nccnc12	1809924294	RNYVDNZIRWMOJV-GFCCVEGCSA-N	437.953	1.718	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@H]1CCN(C(=O)CCS(C)(=O)=O)[C@@H]1c1cccnc1	1810548114	NMTJTLNCZHOHJQ-VQIMIIECSA-N	441.626	1.374	50	20	IDGD	
CCNC(=S)NCC(=O)NC[C@@H]1CCN(C(=O)[C@@H](Cl)CC)[C@H]1c1cccnc1	1812333191	SUXJOWALOVVHTP-ZOBUZTSGSA-N	425.986	1.589	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)[C@@H](O)Cc2ccccc2)[C@H]1c1cccnc1	1812773564	UNUJJDDHCFEJBK-IVAOSVALSA-N	445.947	1.945	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)CN2CCSCC2)[C@H]1c1cccnc1)C(Cl)Cl	1813074180	OREJYPOXIKPQLK-ZBFHGGJFSA-N	431.389	1.940	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)C2CCSCC2)[C@H]1c1cccnc1	1814238968	ORBBCHKCCHMQIA-WIYYLYMNSA-N	447.605	1.604	50	20	IDGD	
COCCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1)CC2	1814281068	DEDVTPUCWXHUIX-ZFILKEQLSA-N	432.506	1.226	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccnc2C(N)=O)n[nH]1	1816077003	APTSUHNRXZKJMT-OCCSQVGLSA-N	434.884	1.463	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)C1CCC1)CC2	1817277301	PJLPEASBUGMOHN-BTIIEKFUSA-N	428.518	1.989	50	20	IDGD	
CC(=O)C(C)(C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1	1817470502	SRNITRVAPHWMEO-QGZVFWFLSA-N	426.282	1.011	50	20	IDGD	
CC(C)(C)OCC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819401661	NCEYINVGYPFPSM-INIZCTEOSA-N	443.508	1.529	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)c3cccc(F)c3)sc2C1	1822048576	YZXKGOCIQUJSIQ-CQSZACIVSA-N	433.509	1.881	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](N)Cc2cscn2)[nH]n1	1822368493	GBSXFEVUIJSOTH-KCQAQPDRSA-N	440.957	1.682	50	20	IDGD	
Cc1ccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)cn1	1822412881	INNLEAHLCSOAGX-QGZVFWFLSA-N	427.509	1.792	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)C23CC(F)(C2)C3)CC1	1824577022	QSBQPADOTVGVFP-BVVFMGSASA-N	428.313	1.492	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(=O)n1O)CC2	1825994603	WONFNQAPIPYRHB-NXEZZACHSA-N	426.882	1.022	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnn3cc(C)cnc13)CC2	1826000070	JZQXKPRSNGRLAO-AAEUAGOBSA-N	448.936	1.974	50	20	IDGD	
Cc1cccc(CC(=O)N[C@@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)n1	1826082952	GWKIPLHKRWXCPF-OAHLLOKOSA-N	444.561	1.374	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1	1826083624	PGSJCGSRTVFFBJ-NEPJUHHUSA-N	429.974	1.836	50	20	IDGD	
CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](F)Cl)CC2	1826647170	KJIFKQSWLSRHLQ-GAJTVXKRSA-N	442.904	1.060	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)C(C)(C)NCCC#N)CC1	1826896093	BZJMRFNLZZWXRL-LJQANCHMSA-N	448.612	1.261	50	20	IDGD	
CN[C@H](CC(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H](C)Br)CC1)C(=O)O	1826947938	HEZZRRPQDAKTDC-YUELXQCFSA-N	432.359	1.452	50	20	IDGD	
O=C(/C=C/c1cccnc1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827049992	CMYXKZULKKCCFI-VMMLISQSSA-N	447.344	1.708	50	20	IDGD	
O=C(CC1CCOCC1)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827055222	VJSQTXZEFAIZDQ-JOCHJYFZSA-N	442.365	1.416	50	20	IDGD	
O=C(C1=CCCS1)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827055549	CHTFJNYQDMHIBJ-LJQANCHMSA-N	428.363	1.621	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@H](C)Br)CC1	1827567406	ULVDYIZKISRZNY-QEJZJMRPSA-N	431.375	1.836	50	20	IDGD	
CO/C=C(\C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1	1828798458	SLUYGVRMAHOEDT-JUWJPQTCSA-N	429.521	1.469	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cncs2)CC1	1828925638	OAFBSHOGJAPRBR-KRWDZBQOSA-N	442.545	1.689	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4ccccn4n3)C2)C1	1830361972	HWEQQIXWENCBDN-NRFANRHFSA-N	434.924	1.669	50	20	IDGD	
C=CCO[C@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](Br)CC)C2)C1	1831434514	YNKAAJWJXJCTOL-RKVPGOIHSA-N	433.343	1.207	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC[C@H]1C1CCN(C(=O)Cn2cnnn2)CC1	1831550385	VOSGVLFHPNHSBE-GJZGRUSLSA-N	427.347	1.466	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)CCN2CCCC2)CC1	1831876520	IFXWFOAQJCAQET-FQEVSTJZSA-N	435.613	1.465	50	20	IDGD	
O=C(/C=C/c1ccco1)N1CCO[C@@]2(COCCN(C(=O)CCBr)C2)C1	1833072733	QQIZSUKFEILBJQ-OAJJDEHYSA-N	427.295	1.534	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)CS[C@H]3CCCCO3)CC2)CC1)[C@@H](O)CCl	1833311791	DZSSNOSQERTVDX-HKUYNNGSSA-N	448.029	1.418	50	20	IDGD	
Cc1nc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)cs1	1834460345	ZZCPLAXZRZUYLD-BZNIZROVSA-N	432.340	1.305	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)C(F)(F)C(F)(F)C(=O)O)CC2)CC1)[C@H](F)Cl	1835079193	NLSJQXGQPUIVKE-NSHDSACASA-N	449.804	1.448	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(-n4cnnc4)cc3)CCO2)C1	1835498509	JGYQICLGKROEIW-NQIIRXRSSA-N	447.923	1.355	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)c1ccn(C(F)F)n1	1835951037	LNFFYABSEOWBOW-HNNXBMFYSA-N	433.887	1.063	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3cccnc3)CCO2)C1	1836152532	LXVUHNTYTSCNSZ-DNVCBOLYSA-N	440.338	1.112	50	20	IDGD	
Cn1ccnc1C(=O)N1CCC(N2CCC(NC(=O)[C@](C)(Cl)CCl)CC2)CC1	1836398647	PPXKAYOQTFIPNE-LJQANCHMSA-N	430.380	1.842	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)Cc3ccccn3)CC2)CC1)[C@H](F)Br	1836412337	FLXUUUHHOAJAEN-SFHVURJKSA-N	441.345	1.886	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)CCc3cn[nH]c3)CC2)CC1)[C@H](F)Br	1836414164	XDXXOJXGMAZRQX-KRWDZBQOSA-N	444.349	1.604	50	20	IDGD	
C/C(=C/C(=O)N1CCC(N2CCC(NC(=O)[C@H](F)Br)CC2)CC1)C(=O)O	1836414633	VELLEZIRJQGUIB-WOLCWHLNSA-N	434.306	1.279	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC(OC2CCN(C(=O)[C@@H]3CC=CCC3)CC2)CC1	1836677088	FCHWMEGRSVZJMH-GOSISDBHSA-N	440.349	1.335	50	20	IDGD	
O=C(CCBr)N1CCC(OC2CCN(C(=O)c3ncccn3)CC2)CC1	1837501019	ZEYAVKSAQDHRDE-UHFFFAOYSA-N	425.327	1.874	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)c3ccncn3)CC2)CC1	1838117437	FRTMVPBIVQQPEU-CYBMUJFWSA-N	425.327	1.872	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)CCc3ccoc3)CC2)CC1	1838789183	KBIHQYPQGATANL-UHFFFAOYSA-N	448.564	1.584	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cn(C)nc3C(F)F)C2)C1	1839144827	LKAZZQMKTBIKHO-UGSOOPFHSA-N	434.871	1.445	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3n[nH]c4ccc(C#N)cc34)C2)C1	1839147957	ICFYTHPHSQKHNE-IERDGZPVSA-N	445.907	1.522	50	20	IDGD	
O=C(C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2)c1ccccc1	1839197621	CFSWTWIZQPIDOB-MAUKXSAKSA-N	443.269	1.016	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)ccc1O	1839201750	IFJIJRQIDKQDTB-CRAIPNDOSA-N	445.285	1.461	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)ON=C(C)C)CCO2	1839228280	YCEADPKGTZSCBB-VKJFTORMSA-N	448.358	1.417	50	20	IDGD	
Cc1cc(O)c([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1839466712	PQDXWKJCNWBTCF-YJBOKZPZSA-N	445.831	1.213	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@]1(C)CC1(F)F)CCO2	1840823349	QFLIBCOCBHTJIJ-KCXAZCMYSA-N	439.297	1.519	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC2(CCCN2C(=O)CCNC(=O)c2ccc[nH]2)C1	1842014288	CTARAIACLUXSKQ-ZDUSSCGKSA-N	425.327	1.369	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC2(CCCN2C(=O)c2ccc(O)nn2)C1	1842338360	WOHMGYGHLMBHJV-ZDUSSCGKSA-N	439.900	1.131	50	20	IDGD	
CCN(CC)[C@H](C(=O)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1)c1ccccc1	1843015005	XTMVWACEVAHPTC-QFIPXVFZSA-N	449.360	1.267	50	20	IDGD	
Cc1ccn2c(=O)c(C(=O)N3CCCC34CN(C(=O)[C@@H](C)Br)C4)cnc2c1	1843787986	KWHPFZRSYHEYRH-CYBMUJFWSA-N	433.306	1.603	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@H]2CCN(C(=O)OC(C)(C)C)C2)C1	1843905760	RFPIPEQTIYYNAA-LSDHHAIUSA-N	429.945	1.701	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1cc(-c3ccccc3)on1)C2	1844263362	VXHNSFYEPJUAHO-UHFFFAOYSA-N	446.467	1.471	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1cnc(Cl)c(Cl)c1)C2	1844264627	RBPCZYZDUGXBMC-UHFFFAOYSA-N	449.298	1.518	50	20	IDGD	
O=C1CC[C@H](C(=O)N2CC3(CCCN3C(=O)[C@@H](Br)Cc3ccccc3)C2)N1	1845940687	DTZRGIAIKSGJHJ-JKSUJKDBSA-N	434.334	1.475	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@H]1C(=O)N1CCCC12CN(C(=O)[C@H](C)CBr)C2	1846337994	LRYLYOLEJYDQAN-RBSFLKMASA-N	427.339	1.976	50	20	IDGD	
Cn1cc(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)cn1	1848095632	HPXSBNYRDBWSJO-KKUMJFAQSA-N	425.917	1.368	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1c(C)nn(-c2ccccc2)c1O	1848333711	KPUADPQKNVDPBP-ULQDDVLXSA-N	432.908	1.956	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)/C(=C/c1ccccc1)NC(C)=O	8773926	QAUBAQFDZDGFTL-YVLHZVERSA-N	445.859	1.830	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)Cc1n[nH]c(=O)c2ccccc12	10913034	QBYGSJLQDFFFBC-UHFFFAOYSA-N	444.831	1.132	50	20	IDGD	
C=C1c2ccccc2C(=O)N1[C@@H](C)C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	14057359	VYHCTPPZNOGMFG-AWEZNQCLSA-N	442.497	1.213	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)CCNS(=O)(=O)c2ccc(Br)cc2)n1	14510834	IODFSFGQEOJIFY-UHFFFAOYSA-N	428.312	1.668	50	20	IDGD	
CCCn1c(CCC(=O)NNC(=O)c2ccccc2F)nc2cc(S(N)(=O)=O)ccc21	26691074	AYVXQUPYEACPEF-UHFFFAOYSA-N	447.492	1.627	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)c1ccc(F)c(S(=O)(=O)N2CCCC2)c1	46642527	YUAYDIGFWQPYNH-UHFFFAOYSA-N	439.440	1.589	50	20	IDGD	
Cc1nn([C@@H]2CCS(=O)(=O)C2)c(C)c1C=NNC(=O)c1cc(Br)c[nH]1	725841065	SVSOGWOVRQEMOE-GFCCVEGCSA-N	428.312	1.714	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)N1CCCN(C(=O)c2ccsc2)CC1	725873825	SEKWURUUJJUDML-UHFFFAOYSA-N	435.531	1.128	50	20	IDGD	
CCOc1ccc(OCc2ccc(C(=O)NNC(=O)[C@@H]3CCCN3C(N)=O)cc2)cc1	725906414	KTSRCEZZGRIETE-IBGZPJMESA-N	426.473	1.968	50	20	IDGD	
COCCCNC(=S)N(C)NC(=O)c1cc(S(=O)(=O)NC(C)(C)C)ccc1C	726076807	DPHWOVNWPAZOIZ-UHFFFAOYSA-N	430.596	1.559	50	20	IDGD	
COc1ccc(CN2C[C@H](C(=O)OCC(=O)NNC(=O)c3ccccc3)CC2=O)cc1	726681762	MWUFEGRILLDNEW-QGZVFWFLSA-N	425.441	1.048	50	20	IDGD	
CCn1nc(C)c(CNC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1C	727604666	CSDNAMMKDAXKOO-UHFFFAOYSA-N	448.549	1.449	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@@H]2C(=O)NNc2nc(-c3ccncc3)no2)s1	728072591	UACVWGVOOORCHF-CYBMUJFWSA-N	434.503	1.798	50	20	IDGD	
O=C(CN1C(=O)[C@H]2CCCC[C@H]2C1=O)NNC(=O)c1cc(F)ccc1Br	728550904	NFZQUIUXMBENHG-PHIMTYICSA-N	426.242	1.524	50	20	IDGD	
CC[C@@H](C)NC(=O)CN1CCN(C(=O)NNC(=O)c2ccc(Br)s2)CC1	728941879	DLOFIYHCBCNLLX-LLVKDONJSA-N	446.371	1.397	50	20	IDGD	
CC(=O)Nc1cc(F)c(S(=O)(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1Cl	729661969	DVIHTTWVJIZFSS-HNNXBMFYSA-N	443.840	1.587	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)cn1	729693250	PKROVFUSDWHPCK-UHFFFAOYSA-N	446.445	1.704	50	20	IDGD	
CS(=O)(=O)Cc1nc2ccccc2n1CC(=O)NNC(=O)c1cccc2ncccc12	730224830	BROFBHSCDAIPRQ-UHFFFAOYSA-N	437.481	1.590	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)[C@H]1CCN(c2ccc3c(c2)OCCO3)C1=O	730546683	GLYCTCFSBJAOCG-QGZVFWFLSA-N	434.452	1.613	50	20	IDGD	
CC(C)(C(=O)NNC(=O)N1CCC(C(=O)N2CCC(C(N)=O)CC2)CC1)c1ccccc1	731221786	HUVNYFTVZPMQIU-UHFFFAOYSA-N	443.548	1.141	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2cc(O)nc3ccc([N+](=O)[O-])cc23)c2ccccc2c1=O	731874894	WOXJSYWBZNVOLA-UHFFFAOYSA-N	448.395	1.653	50	20	IDGD	
C[C@H](Oc1ccc2c(c1)CCC2)C(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	732324171	FJKNVMZJRQQNOJ-ZDUSSCGKSA-N	427.413	1.855	50	20	IDGD	
CC(C)[C@@H](Oc1ccccc1C#N)C(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	732330128	PRFMZYZCWICTRT-LJQANCHMSA-N	440.412	1.874	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)[C@H]2CC(=O)N(C[C@H]3CCCN3CC)C2)o1	733139206	FIAOCVAPWLMUBS-DLBZAZTESA-N	433.553	1.215	50	20	IDGD	
O=C(NCCN1C(=O)CNC1=O)NNC(=O)c1cn(-c2ccccc2)nc1-c1ccccc1	733658138	UEYREMHBNCQQQA-UHFFFAOYSA-N	447.455	1.035	50	20	IDGD	
CC(=O)N(c1nc(C=NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cs1)C1CC1	734297358	JTWGTJZVJQBQEF-UHFFFAOYSA-N	435.531	1.673	50	20	IDGD	
CC(=O)N1CCc2ccc(S(=O)(=O)NNC(=O)c3cnn(-c4ccccc4)c3)cc21	734415783	ISFLYJHSQWVOND-UHFFFAOYSA-N	425.470	1.405	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc2c(c1)C(=O)NCC2)c1ccc(Br)s1	734807101	UOKZVMBDRYVCIB-UHFFFAOYSA-N	430.305	1.420	50	20	IDGD	
COc1ccc(-c2nn(CCC#N)cc2/C=C(/C#N)C(=O)NCC[S@@](C)=O)cc1OC	735044735	BUJCNRXBYMLELT-SUFIFVMZSA-N	441.513	1.883	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)CCc2ccc(N(C)C)cc2)CC1	735116890	JYFRXOOQTUJJSP-UHFFFAOYSA-N	446.577	1.160	50	20	IDGD	
CS(=O)(=O)c1ccc(Cl)c(S(=O)(=O)NNC(=O)COCc2ccccc2)c1	737756895	WPXSRWARHNLOSP-UHFFFAOYSA-N	432.907	1.270	50	20	IDGD	
CNC(=O)NNC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc(Br)s1	743885379	WKQATQRELPYUNQ-MRVPVSSYSA-N	425.330	1.014	50	20	IDGD	
COc1cc(/C=C\C(=O)NNC(=O)C(=O)NC(C)C)ccc1OCc1c(C)noc1C	744446658	HNQVCVLCRLDWSU-CLFYSBASSA-N	430.461	1.564	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1ccc(N2CCCC2)nc1	744619096	HPDMUMYBJHKKGI-UHFFFAOYSA-N	431.518	1.460	50	20	IDGD	
CCOC(=O)N[C@@H](CNC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)CC(C)C	745608313	WVTFEBVKIGTNAJ-CQSZACIVSA-N	443.526	1.587	50	20	IDGD	
C[C@H]1C[C@@H](NC(=O)NNC(=O)Nc2ccc(OC(F)F)cc2)C(=O)N1c1cnn(C)c1	745916349	CHTCAEVIBINKEF-IINYFYTJSA-N	437.407	1.551	50	20	IDGD	
C=CCOc1cn(-c2ccccc2)nc1C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	746599615	JLYAUKXJVYDAMI-UHFFFAOYSA-N	447.499	1.905	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)N[C@@H]1CC(=O)N([C@@H]2C[C@@H]2c2ccccc2)C1	746774098	UYCRCXVXMISYFV-GUDVDZBRSA-N	432.484	1.364	50	20	IDGD	
COC(=O)c1ccc(OC)c(S(=O)(=O)NNC(=O)c2cc(Br)c[nH]2)c1	747603184	XGCOWAVRWVBDEK-UHFFFAOYSA-N	432.252	1.196	50	20	IDGD	
CCc1cc(N2CCC(NC(=O)NNC(=O)COc3ccccc3OC)CC2)ncn1	748664476	VYGLCJBNWDREMJ-UHFFFAOYSA-N	428.493	1.426	50	20	IDGD	
CC(=O)NCc1ccc(S(=O)(=O)NCC(=O)NNc2cc(F)c(F)c(F)c2)s1	748804571	CRYPAXIGHIBGQS-UHFFFAOYSA-N	436.437	1.223	50	20	IDGD	
Cc1c(/C=C(\C#N)C(=O)OCC(=O)Nc2cc(S(C)(=O)=O)ccc2F)cc(C#N)n1C	750009108	FDDDAGHTRDWZCM-MKMNVTDBSA-N	444.444	1.837	50	20	IDGD	
CCOC(=O)[C@H]1Cc2cc(S(=O)(=O)NNC(=O)c3cccc4ncccc34)ccc2O1	751547528	KRXYIKZTUVWFHR-LJQANCHMSA-N	441.465	1.725	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@H](C(=O)NNC(=S)N[C@@H](C)C3CC3)C2)s1	751620630	KOPNOFIHKFCXIK-JSGCOSHPSA-N	430.621	1.751	50	20	IDGD	
O=C(CO)NNC(=O)c1ccc(NS(=O)(=O)c2ccc(Br)cc2)cc1	753440337	ZXCIDLCEIOBFSL-UHFFFAOYSA-N	428.264	1.003	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)CCC(=O)c1cccc(N)c1	753469917	AGLOGQIXAJWRSW-UHFFFAOYSA-N	433.848	1.898	50	20	IDGD	
C[C@](O)(C(=O)NNC(=O)c1csc(N2CCOCC2)n1)c1cccc(C(F)(F)F)c1	754843439	WXXZPJDQELMQCR-QGZVFWFLSA-N	444.435	1.667	50	20	IDGD	
COc1cccc(-c2noc([C@H](C)NCC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)n2)c1	755056268	ZUXSVQGHIJTEPY-LBPRGKRZSA-N	440.416	1.765	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)NC1CCN(S(=O)(=O)C(F)(F)F)CC1	755302203	OZKOMQCSQYOTAV-UHFFFAOYSA-N	426.392	1.013	50	20	IDGD	
CON(C)S(=O)(=O)c1ccc(NC(=O)NNC(=O)COc2cc(C)cc(C)c2)cc1	755536528	VRUALPPWCKURLM-UHFFFAOYSA-N	436.490	1.717	50	20	IDGD	
COc1ccc(S(=O)(=O)NC2CC2)cc1NC(=O)NNC(=O)c1cccc(C#N)c1	755612121	MGAQFGPSIPKHOB-UHFFFAOYSA-N	429.458	1.474	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)Nc2ccccc2C(=O)N2CCOCC2)cc1	755623368	OFHJWPGFWLLTPY-UHFFFAOYSA-N	426.473	1.953	50	20	IDGD	
COC(=O)c1cc2cc(NC(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)ccc2o1	755914909	WXTVNCBAQVFVHQ-UHFFFAOYSA-N	435.396	1.933	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)Nc1ccccc1OCCn1ccnc1	756469786	JWTVCSBZWGQEMX-UHFFFAOYSA-N	433.432	1.404	50	20	IDGD	
CCOC(=O)[C@@H](C)NC(=O)c1ccc(NC(=O)NNC(=O)c2ccc(C)cc2O)cc1F	756819533	STLXMWCLBXFXKU-GFCCVEGCSA-N	446.435	1.988	50	20	IDGD	
COc1cc(C)ccc1CNC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1	757748905	QQHFDNAGVAMVLI-UHFFFAOYSA-N	434.518	1.463	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(N2CCOCC2)c(NC(=O)NNC(=O)CC(C)(C)C)c1	757775698	KDGGDNVFYJLDRD-UHFFFAOYSA-N	441.554	1.362	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)NCCN2CCC(N(C)C)CC2)cc1Cl	759599284	WMVSCEYVAHZJTJ-UHFFFAOYSA-N	442.948	1.719	50	20	IDGD	
CCCn1nc(C(=O)NN=C2C(=O)N(C)c3cc(N(C)C)ccc32)c2ccccc2c1=O	761760599	SEVYQJSGAPHYIM-UHFFFAOYSA-N	432.484	1.983	50	20	IDGD	
C[C@H]1CN(Cc2ccccc2)C[C@@H](C)[C@@H]1NC(=O)NNC(=O)CNC(=O)c1ccco1	761790158	KNWZRRSULYKGGH-IGOJGBNBSA-N	427.505	1.496	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NN=C1CCOc2c1cc(Br)cc2[N+](=O)[O-]	761812006	KYVCOTVJKOBRBQ-UHFFFAOYSA-N	437.206	1.983	50	20	IDGD	
CCCS(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)c2ccccc2F)cc1F	762462724	NZQVQVAAVOOHQT-UHFFFAOYSA-N	433.458	1.740	50	20	IDGD	
O=C(NN=Cc1ccc(OCCBr)c(Cl)c1)N[C@@H]1CCS(=O)(=O)C1	763160963	BMVBEXQPJQYYMG-LLVKDONJSA-N	438.731	1.934	50	20	IDGD	
Cc1cc(S(=O)(=O)N2CCN(S(=O)(=O)CBr)CC2)cnc1Cl	763205589	AXRVUJSUCIFJLX-UHFFFAOYSA-N	432.749	1.032	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(N3CCCC3)c(F)c2)cc1	763660585	CEHNPJMUKYBISX-UHFFFAOYSA-N	430.436	1.599	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)C(=O)Nc1ccnn1-c1cccc(Cl)c1	763680041	RAUXIZVRRCVFSE-UHFFFAOYSA-N	431.811	1.830	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)C(=O)Nc1ccc(C(=O)N2CCCC2)cc1	763680256	SXLDVWCCBKJSGJ-UHFFFAOYSA-N	428.420	1.227	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(OCC(F)(F)F)nc1	763714219	RRHYEOKSSJZFJI-UHFFFAOYSA-N	440.378	1.750	50	20	IDGD	
O=C(CN1CCCc2ccccc21)NNC(=O)C(=O)N1C[C@H]2CCCN2c2ccccc21	763745761	JVSZVZWGHAINRY-GOSISDBHSA-N	433.512	1.602	50	20	IDGD	
C=CCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)cc1	763746313	SFOCAMHZAKIKFT-UHFFFAOYSA-N	435.484	1.141	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2ccn(-c3ccccc3Cl)n2)c1	763775196	NMUZVQANQCPTRL-UHFFFAOYSA-N	443.847	1.943	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(CNC(=O)OC(C)C)cc2)cc1	763808635	DNAOBLUCPIZDIN-UHFFFAOYSA-N	442.472	1.795	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)N2C[C@@H](C)Oc3ccccc32)cc1	763870653	BIWOKISSPVMFJQ-HIFRSBDPSA-N	425.441	1.618	50	20	IDGD	
CC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(C(C)=O)cc2)cc1	763878608	RYPRHUZPSNQEGW-CYBMUJFWSA-N	426.429	1.401	50	20	IDGD	
CN(C)C(=O)c1cccc(NC(=O)C(=O)NNC(=O)CCSc2ccc(F)cc2)c1	763894956	IFDPDJGDJVQBJZ-UHFFFAOYSA-N	432.477	1.796	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(OC(C)C)c(OC)c2)c(Cl)n1	763916255	KNDSEIXWPWTLIT-UHFFFAOYSA-N	436.852	1.939	50	20	IDGD	
O=C(Cc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1ccc(CN2CCOC2=O)cc1	763940677	MOLCOWWINOXYKX-UHFFFAOYSA-N	430.848	1.621	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CC[C@H](C)C3)cc1-n1cnnn1	763951037	YRCYZWHYMBLMSZ-NSHDSACASA-N	439.501	1.557	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)C(=O)Nc1ccc(C(=O)NCCc2ccccc2)cc1	763995034	DVCCRIWNUBRLBD-UHFFFAOYSA-N	433.468	1.397	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1ccc([S@@](C)=O)c(F)c1	764013097	UWJMFALOTBCSGM-MUUNZHRXSA-N	427.841	1.625	50	20	IDGD	
O=C(Cc1ccc2ccccc2c1)NNC(=O)C(=O)Nc1ccc2c(c1)S(=O)(=O)CC2	764091274	HSSHYMDGCWUICX-UHFFFAOYSA-N	437.477	1.498	50	20	IDGD	
C[C@@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3ccc(Cl)nc3)cc2)C[C@@H](C)O1	764093312	RXPKJHOGWZJZLY-CHWSQXEVSA-N	431.880	1.748	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccc(OCc2ccccc2)nc1	764136066	MYICUQXAIOXARO-UHFFFAOYSA-N	434.452	1.998	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2O1)C(=O)Nc1cccc(OC[C@@H]2CCCO2)c1	764154502	REMQZXJLYWSJQH-PKOBYXMFSA-N	425.441	1.334	50	20	IDGD	
CC1CCN(C(=O)c2ccc(NC(=O)C(=O)NNC(=O)CCc3ccco3)cc2)CC1	764166711	PKHUCOQANOKYGR-UHFFFAOYSA-N	426.473	1.870	50	20	IDGD	
CC(C)(C)CC(=O)NNC(=O)C(=O)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1	764197527	CAJUDNPGQQGHPO-KRWDZBQOSA-N	426.521	1.852	50	20	IDGD	
CN1CCC/C1=N\S(=O)(=O)c1cccc(NC(=O)C(=O)NNC(=O)CC(C)(C)C)c1	764198619	IASSAVVXSSBBMI-HZHRSRAPSA-N	437.522	1.022	50	20	IDGD	
Cc1ccc(C(=O)N2CCOCC2)cc1NC(=O)C(=O)NNC(=O)CCC1CCCCC1	764214746	CTBJGIPBQGUWMU-UHFFFAOYSA-N	444.532	1.914	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1ccc(OC[C@H]2CCCO2)cc1	764277644	LXUIFMCXZRRUBA-MRXNPFEDSA-N	429.429	1.115	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C(=O)Nc1ccc(F)cc1CS(C)(=O)=O)c1ccccc1	764327582	BYTBTKVGAABGBB-INIZCTEOSA-N	435.477	1.650	50	20	IDGD	
C=CCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)cc1	764382736	QZLGPCJRTQJZPA-UHFFFAOYSA-N	438.469	1.454	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NN=Cc3ccc(C#N)s3)CC2)cc1	764818436	LAOUUCVDDBIBJM-UHFFFAOYSA-N	431.543	1.385	50	20	IDGD	
N#Cc1cccc(S(=O)(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)c1	765120182	ZQSSBBIXJHPOPL-UHFFFAOYSA-N	447.948	1.339	50	20	IDGD	
COC(=O)NNC(=O)C(=O)Nc1ccc(CNC(=O)c2ccc(Br)cc2)cc1	765374747	YGXDFOKHNQARLO-UHFFFAOYSA-N	449.261	1.705	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)[C@@H](CC(F)F)NC(=O)OC(C)(C)C)nc2ccccc21	765530043	OTGSBEWGKMUBJE-GFCCVEGCSA-N	425.436	1.812	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)cc1S(C)(=O)=O	765806544	WRTGYKWUMLNMFF-UHFFFAOYSA-N	439.515	1.523	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)[C@H]2CC(=O)N(c3ccc(Cl)c(F)c3)C2)cc1	766320663	NKJWZBBXSZOYTH-ZDUSSCGKSA-N	430.823	1.930	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)Nc1ccc(CN2C(=O)CNC2=O)cc1	767221215	QXWUOTJACCFNEI-UHFFFAOYSA-N	447.473	1.299	50	20	IDGD	
O=C(COc1ccccc1NC(=O)C(=O)NNC(=O)c1ccccc1)Nc1cccnc1	768226283	KKGROAMAUNRZDY-UHFFFAOYSA-N	433.424	1.499	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)CN1C(=O)N[C@@]2(CCCC(C)(C)C2)C1=O	768927859	LQBCSUJIAWHYAB-OAQYLSRUSA-N	431.493	1.145	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)C(C)(C)c2cccc(F)c2)CC1	769105659	NTAZHBFDBVBSIX-UHFFFAOYSA-N	435.525	1.578	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)NC2CCN([C@@H]3CCCC[C@H]3O)CC2)cc1OC	769164265	ABUGMHZAELSFPK-QZTJIDSGSA-N	434.537	1.806	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)NCCCn1nc2n(c1=O)CCCC2	770261084	WSYYIPCMBMVQSE-CYBMUJFWSA-N	436.900	1.223	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCc2ccc3c(c2)COC3)cc1	770419318	QJYPOFINQQLAST-UHFFFAOYSA-N	432.502	1.176	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)N1CCn2c(nnc2C(F)(F)F)C1	770648375	GJJGEAFIZPOUFN-VIFPVBQESA-N	432.790	1.974	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)N2CCN(CC(=O)NNC(=O)c3cccc(C#N)c3)CC2)c1	770727364	CQMMATBWAUYJOL-UHFFFAOYSA-N	449.511	1.159	50	20	IDGD	
COc1ccccc1[C@@]1(C)NC(=O)N(CC(=O)NNc2oc(C(C)C)nc2C#N)C1=O	771383758	ZHOMICPZXFHFPO-HXUWFJFHSA-N	426.433	1.589	50	20	IDGD	
CCNS(=O)(=O)[C@H]1CCN(C(=O)CCC(=O)C(C#N)=C2N(C)c3ccccc3N2C)C1	771403193	KCZJZRANNQZVRG-HNNXBMFYSA-N	445.545	1.197	50	20	IDGD	
C[C@@]1(c2ccc(F)c(Cl)c2)NC(=O)N(CC(=O)NNC(=O)CNc2ccccc2)C1=O	771716561	IJMXLMXNHWVFJZ-FQEVSTJZSA-N	447.854	1.506	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)c2ccc(S(=O)(=O)NC(C)(C)C)cc2)c1	773074293	XLYBRPVSXSVGQT-UHFFFAOYSA-N	433.490	1.192	50	20	IDGD	
O=C(NNc1ccccc1[N+](=O)[O-])C(=O)Nc1cccc(Cn2nc3ccccn3c2=O)c1	773648925	XPBSMEWXSROVGD-UHFFFAOYSA-N	447.411	1.534	50	20	IDGD	
COc1ccc(S(=O)(=O)NC2CC2)cc1NC(=O)C(=O)NNc1ccccc1[N+](=O)[O-]	773655467	QHXLDXLEKGCUMB-UHFFFAOYSA-N	449.445	1.126	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)N[C@H](CS(C)(=O)=O)c2ccccc2)cc1C	774278715	JBTNYQBKPXCULK-QGZVFWFLSA-N	432.502	1.358	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)NOC2CCOCC2)cc1	775240945	MVRRGTUAPNEGCY-FOWTUZBSSA-N	439.472	1.568	50	20	IDGD	
Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)C(=O)NNC(=O)C(C)(C)C	775530600	TWRNDYAHNDOGCN-KRWDZBQOSA-N	426.521	1.771	50	20	IDGD	
CS(=O)(=O)N1CCN(c2ccc(NC(=O)NNc3ccccc3[N+](=O)[O-])cn2)CC1	775617636	OISXAZUILZVRSY-UHFFFAOYSA-N	435.466	1.220	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)on1)Nc1ccc(C[C@H]2NC(=O)NC2=O)cc1	775708053	MOVMZADJCUJDPB-OAHLLOKOSA-N	434.412	1.559	50	20	IDGD	
COC(=O)c1c(C)[nH]c(C(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)c1C	776203003	YNVPGRICGHNVMH-UHFFFAOYSA-N	437.497	1.667	50	20	IDGD	
COc1ccc(N2CCN(C(=O)/C=C/C(=O)NNC(=O)c3ccc(C#N)cc3)CC2)cc1	778251472	BFPKCUMFTBNDBR-ZHACJKMWSA-N	433.468	1.233	50	20	IDGD	
COc1ccc(Cn2ccc(NC(=O)C(=O)NNC(=O)Cc3ccc(F)cc3)n2)cc1	778708954	CFBRAZMUABUGMF-UHFFFAOYSA-N	425.420	1.408	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)c1cn(-c2cccc(Cl)c2)nn1	780174167	WPUVFBGENXBCAY-UHFFFAOYSA-N	433.881	1.289	50	20	IDGD	
O=C(NNc1ccc(Cl)c(F)c1)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(F)cc1	780956164	XFUPRNWKTAXSCO-WBMJQRKESA-N	431.848	1.885	50	20	IDGD	
CC(C)S(=O)(=O)c1ccc(CC(=O)NNC(=O)CCN2C[C@H](C)O[C@@H](C)C2)cc1	781417708	MFNVIBZRDNGMLJ-HOTGVXAUSA-N	425.551	1.058	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(N3CCN(C(C)=O)CC3)c2)cc1	782120444	IQQQNPHELQYJDA-UHFFFAOYSA-N	437.500	1.317	50	20	IDGD	
O=S(=O)(CBr)NC[C@H]1CCC[C@H](NS(=O)(=O)CBr)C1	782437528	NFINHOUFEHCWDE-IUCAKERBSA-N	442.195	1.089	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)C(=O)Nc1cccc(C(F)F)c1	782897266	MTTQDNOSNXRSDV-UHFFFAOYSA-N	439.444	1.625	50	20	IDGD	
Cc1ccc(NNC(=O)C(=O)Nc2cccc(S(=O)(=O)N3CCN(C)CC3)c2)cc1	783344627	DNGWELGOGIXIPC-UHFFFAOYSA-N	431.518	1.013	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2cccc(C[S@@](=O)c3ccccc3)c2)CCS(=O)(=O)C1	783426041	FOQMANKMKALNSD-ACSYHNTCSA-N	449.554	1.131	50	20	IDGD	
CCOc1ccc(C(F)(F)F)cc1NC(=O)C(=O)NNC(=O)CNC(=O)c1ccco1	784003823	BUCGJIDPZLMMAU-UHFFFAOYSA-N	442.350	1.213	50	20	IDGD	
Cc1ccc(N2CCN(C(=O)NNC(=O)c3csc(N4CCOCC4)n3)CC2)cc1	784172238	PREGZYPSWBUWKB-UHFFFAOYSA-N	430.534	1.465	50	20	IDGD	
O=C1CCc2ccc(NC(=O)C(=O)NNc3ccc(S(=O)(=O)C(F)F)cc3)cc2N1	784835589	DAWVLJMTKZDMAH-UHFFFAOYSA-N	438.412	1.649	50	20	IDGD	
COc1cccc(NNC(=O)C(=O)Nc2cc(OC)c(OC)cc2C(=O)N2CCCC2)n1	784853124	XYVBJUKEIIQXCU-UHFFFAOYSA-N	443.460	1.425	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)C(=O)Nc2ccc([C@@H](C)N3CCOCC3)cc2)c1	784855320	XPXJZEZUQWCVKO-OAHLLOKOSA-N	426.473	1.948	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1ccccc1OCC1CC1	785330014	BUUOMSBNRIIING-UHFFFAOYSA-N	433.486	1.969	50	20	IDGD	
C[C@H](C(=O)NNC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1)[C@@H](C)S(C)(=O)=O	788265461	LQNZKMDVTDDMIH-LSDHHAIUSA-N	441.513	1.765	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NC[C@@H](C)NC(=O)OC(C)(C)C)nc1	792254803	CUMIFFDAHKARAO-CYBMUJFWSA-N	444.558	1.651	50	20	IDGD	
COc1ccc(F)c2[nH]c(C(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)cc12	792807286	PUHYWZFTURDQQC-UHFFFAOYSA-N	434.449	1.641	50	20	IDGD	
Cn1ccc2ccc(NC(=O)C(=O)NNC(=O)c3cc(-c4ccccc4)on3)cc2c1=O	793026424	RBSDGUMDDXCCFT-UHFFFAOYSA-N	431.408	1.593	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCC2(S(C)(=O)=O)CC2)ccc1OCCC(C)C	793265320	HNJWVFZKCSNPTA-UHFFFAOYSA-N	427.523	1.641	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@@H]2[C@H]3CN(C(=O)OC(C)(C)C)C[C@H]32)c2ccccc2c1=O	794179632	CQHKLRCXUCGUPS-ZSHCYNCHSA-N	441.488	1.290	50	20	IDGD	
CCOC(=O)c1cc(S(=O)(=O)NNC(=O)c2cccn2C)c(F)cc1Br	795290415	MEFHVUJESGMIKN-UHFFFAOYSA-N	448.270	1.727	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2cc3c(C(F)F)nn(C)c3s2)n1	795728690	YIBAOBYTZRQVFO-UHFFFAOYSA-N	443.457	1.884	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)[C@@H](C)N(C)CC(F)(F)F	796293520	KXCZIPYKAWSFJH-SECBINFHSA-N	425.791	1.535	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)Nc1cnc(N2CCOCC2)c(Br)c1	799248908	FYIDRQUVGJKDMD-UHFFFAOYSA-N	435.282	1.471	50	20	IDGD	
CS(=O)(=O)NC1CC(NC(=O)/C(C#N)=C/c2cn(CCC#N)nc2-c2ccccc2)C1	801464308	VHPCBFGVWFPAEK-MHWRWJLKSA-N	438.513	1.567	50	20	IDGD	
O=C(NCCCCN1CCN(c2ccccc2)CC1)NNc1ccc(-n2ccnc2)nn1	804973331	UFDNVEFKZWAQGP-UHFFFAOYSA-N	435.536	1.891	50	20	IDGD	
CN(C)S(=O)(=O)C[C@@H](NC(=O)NNC(=O)c1cccc2ncccc12)C(F)(F)F	805767213	GRBYSOCRFUNVAR-CYBMUJFWSA-N	433.412	1.001	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1ccc2ncn(-c3ccc(Cl)cc3)c2c1	806788287	RRLIPCRHIDNZHM-NSHDSACASA-N	435.893	1.378	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3n2)cc2[nH]ccc12	808933653	QNMPKGPYZPYIKZ-UHFFFAOYSA-N	431.408	1.902	50	20	IDGD	
COCc1cc(Cl)cc(S(=O)(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c1	811681307	AKHWCKRGARGTQS-UHFFFAOYSA-N	432.907	1.513	50	20	IDGD	
CC(=NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)c1csc(C)n1	812382828	UAHQZVYTYKXJHS-UHFFFAOYSA-N	436.559	1.945	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)C(C)(C)c2ccc3c(c2)OCO3)c1	814211124	PWJKMWMWIOHQAX-UHFFFAOYSA-N	433.486	1.404	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)[C@@H](O)[C@H](O)c2nc3ccccc3s2)cc1	831306886	MKHAXLHXOSIOMD-UUWFMWQGSA-N	445.497	1.704	50	20	IDGD	
O=C(c1ccc(Cl)c(S(=O)(=O)N2CCc3ccccc32)c1)N1CC[C@@H](B(O)O)C1	864234711	UKYBTHAOHRMJJH-OAHLLOKOSA-N	434.710	1.780	50	20	IDGD	
Cn1ncc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1-n1cccc1	893480377	DFAPEGGYGADUMG-UHFFFAOYSA-N	442.501	1.070	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNS(=O)(=O)c1ccc(F)cc1Cl	903943020	ZEXGXECIFMVIFB-UHFFFAOYSA-N	434.902	1.704	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)c2ccc(S(=O)(=O)NC[C@@H]3CCCO3)cc2)c1	913445634	CERNVVXUQUHJEZ-SFHVURJKSA-N	447.513	1.292	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C[C@H](NC(N)=O)c2ccccc2C)cc(OC)c1OC	913660907	OZWBDPCYZOEUBZ-HNNXBMFYSA-N	430.461	1.582	50	20	IDGD	
CS(=O)(=O)c1ccc(Cl)c(S(=O)(=O)NNC(=O)c2ccc3c(c2)OCCO3)c1	914563804	FKBIQOPQXNXLOD-UHFFFAOYSA-N	446.890	1.138	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cc(-c3ccccc3)no2)cc1	915057887	JQRBEINETYSGGG-UHFFFAOYSA-N	428.470	1.732	50	20	IDGD	
O=C(NC[C@@H](c1ccc(F)cc1)N1CCOCC1)NNC(=O)[C@@H]1COc2ccccc2O1	915898072	QCRKEAKGDACDOF-PXNSSMCTSA-N	444.463	1.369	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)cc1	916112316	RPNJTBBKDLUAAW-UHFFFAOYSA-N	446.441	1.731	50	20	IDGD	
COc1cc(CCNC(=O)NNC(=O)COc2ccc(C)cc2)c([N+](=O)[O-])cc1OC	916220110	VVSJSQVZOPFFGG-UHFFFAOYSA-N	432.433	1.872	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)NCCc2nnc3n2CCCCC3)cc1	916235265	ICVFSWIQLFYKLT-OAHLLOKOSA-N	430.509	1.744	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCc2ccc(-n3ccnc3)nc2)c2ccccc2c1=O	916236664	PUHSYGRCXSSPDO-UHFFFAOYSA-N	432.444	1.141	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NC[C@@H]2CCS(=O)(=O)C2)ccc1OCCC(C)C	916375000	ATANUVAVEZXXGQ-AWEZNQCLSA-N	427.523	1.499	50	20	IDGD	
CN(C)CCOc1ccc(CNC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc1	916385901	HYXPSVYANOIHLN-UHFFFAOYSA-N	438.488	1.663	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)c1nnc(O)c2ccccc12)N1CCN(c2ccccc2)CC1	916515028	YDNRUPOSBPAOTN-INIZCTEOSA-N	449.515	1.490	50	20	IDGD	
C[C@@]1(C2CC2)NC(=O)N(CC(=O)OCC(=O)NN=C(c2ccccc2)c2ccccc2)C1=O	916523760	IZUCMTGBRQDWNR-DEOSSOPVSA-N	448.479	1.819	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)NCCCn2nc3n(c2=O)CCCC3)c1	916650269	YUIJCZUPMPCVSS-UHFFFAOYSA-N	444.536	1.612	50	20	IDGD	
CC(C)CS(=O)(=O)CCC(=O)NNC(=O)[C@H](C)Oc1cccc(Br)c1	916735396	RUHCKGBMRDZSFJ-LBPRGKRZSA-N	435.340	1.825	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)c2ccc3c(c2)S(=O)(=O)N(C(C)C)C3=O)cc1	916743712	ODZLLKIXMKPUTC-UHFFFAOYSA-N	431.470	1.388	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)N[C@H](c1ccc(F)cc1)[C@@H]1CCCO1	918126039	FBCXQVYXDJCCNY-ZWKOTPCHSA-N	425.424	1.666	50	20	IDGD	
CCS(=O)(=O)N1CCC[C@@H](C(=O)NNC(=O)c2ccc(OCCC(C)C)cc2)C1	918552512	WEJPGSDPYOIIPF-QGZVFWFLSA-N	425.551	1.934	50	20	IDGD	
O=C(NNC(=O)c1ccc(Br)s1)c1nc2ncc(Br)cn2n1	919809760	FGOYEXXSBRNTCW-UHFFFAOYSA-N	446.084	1.786	50	20	IDGD	
Cc1csc([C@](O)(CC(=O)NNC(=O)[C@H]2COc3ccccc3O2)C(F)(F)F)n1	920253411	BIYWQNNULPWPOG-MLGOLLRUSA-N	431.392	1.579	50	20	IDGD	
COC(=O)c1ccc(COc2ccc(C=NNC(=O)N[C@H]3CCS(=O)(=O)C3)cc2)cc1	920381760	TYSCJGXMGJDXGQ-SFHVURJKSA-N	445.497	1.872	50	20	IDGD	
CCNC(=O)CN1CCCN(C(=O)/C(C#N)=C/c2cc(C)n(C[C@@H]3CCCO3)c2C)CC1	920456143	YCPDPVSSAZZVIX-AMUNLKFJSA-N	441.576	1.861	50	20	IDGD	
COc1ccc(N2C[C@@H](C(=O)NNC(=O)NCCc3cccs3)CC2=O)c(OC)c1	920860331	SLNRDMYNPVFMCK-ZDUSSCGKSA-N	432.502	1.691	50	20	IDGD	
CC(C)(C)OC(=O)NCCc1nc(C(=O)NNC(=O)c2n[nH]c3c2CCCC3)cs1	1116863370	YMSFWXCMDZTNPK-UHFFFAOYSA-N	434.522	1.887	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(/C#N)C(=O)N2CCN(C(=O)N3CCOCC3)CC2)c1C	1317982399	UAMLIFWSZCAMIN-SBGXLDQMSA-N	443.548	1.816	50	20	IDGD	
COc1cc(Br)c(OC)c(C(=O)NNC(=O)CCN2C[C@@H](C)O[C@H](C)C2)c1	1318705408	ZXKNCVRPDNDICU-VXGBXAGGSA-N	444.326	1.727	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cncc(OCC(F)F)c2)c1	1322743370	JTADMORQWGXYDK-UHFFFAOYSA-N	428.417	1.051	50	20	IDGD	
Cc1cc(O[C@@H]2CCN(C)C2=O)ccc1NC(=O)NNC(=O)c1n[nH]c2c1CCCC2	1325142147	AQPRQBBHWYLCBQ-QGZVFWFLSA-N	426.477	1.673	50	20	IDGD	
COC(=O)Cc1csc(NC(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)n1	1325320509	FIAGDKIFOGHXQT-UHFFFAOYSA-N	441.510	1.658	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccccc1)NNc1cc([N+](=O)[O-])ccc1Br	1332710395	ROVFUXCDETVGGL-UHFFFAOYSA-N	429.252	1.779	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3nc(O)n4c3CCCC4)C2)C1	1779346961	AZDUQRSGTPWLDH-RBUKOAKNSA-N	445.347	1.605	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C=N/O[C@H]2CCCCO2)C1	1779428526	MURYFLLOXVJZBU-AZNCZSJYSA-N	445.944	1.283	50	20	IDGD	
O=C([C@@H](O)CCl)N1CCO[C@]2(CCN(C(=O)C3(c4ccc(F)c(F)c4)CC3)C2)C1	1780922616	PZASRMSHKXSMEW-QFBILLFUSA-N	428.863	1.426	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)c3[nH]nc4ncccc34)CCO2)C1	1781226793	ACQSIXVPHCRPHG-ROUUACIJSA-N	426.304	1.638	50	20	IDGD	
COc1ncccc1CCC(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781326263	MOQRJSNQVRSGRJ-CRAIPNDOSA-N	444.301	1.543	50	20	IDGD	
O=C1Cc2cc(C(=O)N3CCO[C@@]4(CCN(C(=O)[C@H](F)Br)C4)C3)ccc2N1	1781329504	GRHREKBAWGVNOY-MAUKXSAKSA-N	440.269	1.315	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](F)Br)C3)C2)c1	1781334943	QIJOTEMRWTYSMS-MAUKXSAKSA-N	442.285	1.779	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](Br)CC)C1	1781901327	KUXIHDQDDDNLSS-NXEZDXNNSA-N	444.370	1.365	50	20	IDGD	
O=C(c1cc(O)cc([N+](=O)[O-])c1)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1781938595	HWYXOJUREIPESV-BBRMVZONSA-N	446.229	1.434	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1cc(C)n(C)n1)C2	1782172670	ZDIAVTTYEHIMBW-MBOZVWFJSA-N	426.945	1.039	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@@]2(C1)CN(C(=O)c1cnccn1)CCO2	1782864332	TURHGDBGULESJK-KYIYGJGQSA-N	439.422	1.805	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)Cc3noc4ccccc34)CCO2)C1	1783532320	HCQWNEIQIUCRRC-YJYMSZOUSA-N	436.306	1.984	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cccc(-n4cncn4)c3)CCO2)C1	1783535305	BHRQYBKYPZDEQS-LIRRHRJNSA-N	448.321	1.494	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(C)nn3-c3ccccc3)CCO2)C1	1783875503	MXHJYXGUFYIYPO-GCJKJVERSA-N	446.935	1.878	50	20	IDGD	
CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCO[C@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783952911	WQSOVZLWHHADEA-XIKOKIGWSA-N	438.352	1.923	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCCn3ccnc3)C[C@@H]21	1783974126	JEGKQIZOXDUQEB-QAETUUGQSA-N	441.370	1.674	50	20	IDGD	
O=C(c1ccc(N2C(=O)C=CC2=O)cc1)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Cl)CCO2	1785221716	MRYSBLPFGKZZDY-XLIONFOSSA-N	435.839	1.094	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc(C)nc3)[C@H]2C1	1785836680	NAXSBGDRKTUNIJ-TUUVXOQKSA-N	425.327	1.552	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc(N(C)C)o3)[C@H]2C1	1785885755	ABJHGRIDQFGMHZ-VOAKCMCISA-N	429.315	1.117	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](N)c3cccc(Cl)c3)[C@H]2C1	1786886476	WDLSLUAIIHLFCA-XEIOYGOASA-N	444.359	1.573	50	20	IDGD	
COc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCBr)C[C@@H]32)ccc1O	1789600257	QSNWWCVEAQVPTA-ZQIUZPCESA-N	441.322	1.779	50	20	IDGD	
Cc1nnc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]3C2)s1	1789865763	FKTVYEXHTCYSFH-NEULZYRMSA-N	435.377	1.605	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CCc4nc[nH]c4C3)C[C@@H]21	1789872966	MKAJSJWXDWTOFL-YBLKDPSYSA-N	443.375	1.731	50	20	IDGD	
C[C@H](Cc1ccncc1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]2C1	1789925061	MEVKICMDYUGNQT-VFTHGPRRSA-N	442.329	1.930	50	20	IDGD	
O=C(NC1(c2ccc(NC(=O)c3cnn4c3CCC4)cc2)CCC1)c1cccc(B(O)O)c1	1790887913	MQZBRJOZXOYOPZ-UHFFFAOYSA-N	444.300	1.571	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccn4ccnc4c3)C[C@@H]21	1791055688	DVLDYIGNMVECTC-TUUVXOQKSA-N	435.322	1.711	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1ccc(C2(NC(=O)CC[C@@H](N)C(N)=O)CCC2)cc1	1791434793	ZTEBXXDVKNQJPR-BXUZGUMPSA-N	425.327	1.497	50	20	IDGD	
CC[C@H](NC(C)=O)C(=O)NC1(c2ccc(NC(=O)CCC(=O)NN(C)C)cc2)CCC1	1791595693	MJBWZOKPNMLQNM-SFHVURJKSA-N	431.537	1.408	50	20	IDGD	
C[C@@H](NC(=O)c1ccccc1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21	1792251000	SYZLDFHNVVTVCP-OEAJRASXSA-N	442.343	1.588	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1c[nH]c2cc(OC)ccc12	1793030686	XGZYIWYUDMUPMV-POXQLVPFSA-N	449.935	1.562	50	20	IDGD	
CO[C@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)CBr)C2)c1ccccc1	1795372633	YNSBUCQUYUQVGI-LHKMKVQPSA-N	439.350	1.995	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1(C#N)CC1	1795413134	QLCHMNLXBKPSEW-AONCJLBWSA-N	426.423	1.765	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](CN)c1ccccc1	1795670477	CPFHWQAEORYDKJ-JFMONLCZSA-N	438.366	1.350	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](CN)c1ccccc1	1795676008	XDVJOKSQYYJWMA-QRXRQMIZSA-N	428.360	1.555	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(Cl)nc2n[nH]cc12	1796057227	GSQMHKDOFZJBDE-FJHTZYQYSA-N	442.303	1.068	50	20	IDGD	
COC(=O)[C@@H]1CC[C@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CO[Si](C)(C)C)C1	1797953678	CCVGMNNKYBIUNY-WXQHOCMDSA-N	426.586	1.017	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c(c1)OCCO3)C2	1797955814	GECZCYDXTPMAMS-CWPLJXCYSA-N	434.565	1.513	50	20	IDGD	
CC[C@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc(N3CCCNC(=O)C3)n1)C2	1800069299	CLUUEGATDQQSFE-YVSFHVDLSA-N	447.967	1.677	50	20	IDGD	
CN(C)[C@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)c1ccc(Cl)cc1	1800303986	LUWXTHXCXDOJKY-PEZLKRJXSA-N	444.359	1.132	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnn3c1OCCC3)C2	1800643029	KHCSRENHZZPAQB-NEBZKDRISA-N	441.326	1.042	50	20	IDGD	
CN(C)c1ccc([N+](=O)[O-])c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C(Cl)Cl)c1	1801016705	VQJILKMRHYVQOW-QHBPRCKVSA-N	445.303	1.668	50	20	IDGD	
Cc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)Br)C3)cc(C)c1O	1801702298	AXWFFQLRUOMTDL-DMRZNYOFSA-N	425.323	1.996	50	20	IDGD	
CC(=O)N[C@H](C)C(=O)N1CC[C@H](CNC(=O)[C@H](C)CBr)[C@@H]1c1cccnc1	1803015369	MAPHHSIUJTZDBH-KFZJALRRSA-N	439.354	1.643	50	20	IDGD	
Cc1cccc(/C=C/C(=O)N2CCCC3(CCN(C(=O)c4cccc(B(O)O)c4)CC3)C2)n1	1804823546	IQGGMSQBRFSIGN-MDZDMXLPSA-N	447.344	1.628	50	20	IDGD	
COC(=O)CCC(=O)N1CC[C@@H](CNC(=O)CCBr)[C@H]1c1cccnc1	1806339488	MWGSTDSGAGKKSG-KBXCAEBGSA-N	426.311	1.826	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H](CNC(=O)CCBr)[C@@H]1c1cccnc1)n1cnnn1	1806347382	WGCNLAFVPNWIMY-XPKDYRNWSA-N	436.314	1.120	50	20	IDGD	
O=C(NCC(=O)N1CCCC2(CCN(C(=O)C(Cl)Cl)CC2)C1)c1cccnc1	1806872604	OUWRKDXCABSCCY-UHFFFAOYSA-N	427.332	1.846	50	20	IDGD	
O=C(CNc1ccc(F)cc1)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1	1807060953	FFNHYLAQJJPBOS-QKYXUNIQSA-N	434.899	1.938	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1CCN(C(=O)c2nc[nH]c2[N+](=O)[O-])[C@@H]1c1cccnc1	1810539932	ADSXWTLJSOQRBM-WMLDXEAASA-N	446.540	1.884	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)c1cc(O)cc([N+](=O)[O-])c1	1811677508	VITTZZOTLNSNBF-DOPJRALCSA-N	448.863	1.615	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)c2cccn(C)c2=O)[C@@H]1c1cccnc1	1812864412	HMAMQFYOGVLDIJ-JLJPHGGASA-N	447.333	1.883	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)C2=CCCS2)[C@@H]1c1cccnc1	1813067923	HJXVYMUCXWNXPW-OXQOHEQNSA-N	431.562	1.481	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)nc1	1813069778	BUPDRRFABVMNHU-PGRDOPGGSA-N	438.532	1.478	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2cncc(F)c2)[C@@H]1c1cccnc1	1813070945	MNQFHEAYIFJACQ-HRAATJIYSA-N	442.495	1.308	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2ccccc2F)[C@@H]1c1cccnc1	1813072677	IYAPYGKDDPSNPA-HTAPYJJXSA-N	441.507	1.913	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)CCn2ccnn2)[C@@H]1c1cccnc1	1813435972	MEVVARSBPALMBK-BQFCYCMXSA-N	449.353	1.943	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(F)cc1)CC2)c1ccc(B(O)O)cc1	1815343712	KOJQEXIMPAJRAW-INIZCTEOSA-N	439.277	1.502	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3[nH]nc4ncccc34)sc2C1	1816874485	NEXUCHUEBVRXPE-KOLCDFICSA-N	434.909	1.894	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(C3CC3)on2)[nH]n1)c1ccc(B(O)O)cc1	1817469667	CSNAJGBDWXWZFO-SFHVURJKSA-N	449.276	1.575	50	20	IDGD	
CO[C@H](C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)n[nH]1	1818113121	CJSFKHANECDKTI-CEYZDJRHSA-N	429.481	1.571	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H]1C[C@@H]1C1CC1)CC2	1819789936	AIPIRXHPYSBSDA-MRVWCRGKSA-N	440.529	1.414	50	20	IDGD	
C[C@@H](Cn1cncn1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CO[Si](C)(C)C)CC2	1820072428	GZCATIJJOVHFCY-STQMWFEESA-N	436.614	1.834	50	20	IDGD	
CC(C)NC(=O)OC(C)(C)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)CCl)CC2	1822574209	FECMDBGTWCIVOV-PWSUYJOCSA-N	446.957	1.568	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CS(C)(=O)=O)CC2	1822863082	FVVSEDBDMYTDAO-RTHLEPHNSA-N	428.363	1.336	50	20	IDGD	
COc1ccc([C@H](O)C(=O)N2CCCC[C@H]2C2CCN(C(=O)[C@H](O)CCl)CC2)cc1	1823948787	CSWBQYAFRRIMSR-ZCNNSNEGSA-N	438.952	1.948	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccoc2)CC1	1825052137	MVBZNZMOLBWZOF-VQKOGROQSA-N	436.317	1.906	50	20	IDGD	
COCCn1ccc(C(=O)N[C@H]2CCc3nc(NC(=O)[C@H](Cl)COC)sc3C2)n1	1825997852	DDVGWROIIVFEDQ-NWDGAFQWSA-N	441.941	1.466	50	20	IDGD	
CCC1(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)COC1	1827053398	MLTGQGHDDPNTBL-FQEVSTJZSA-N	428.338	1.026	50	20	IDGD	
C[C@@H](C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCC(=O)NN(C)C)CC2)c1ccccn1	1827074187	LHQDQUYIIMUNBZ-KGLIPLIRSA-N	444.561	1.627	50	20	IDGD	
COC1(CC(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2ccc(B(O)O)cc2)CC3)CCC1	1827404783	PKXKPHSUYVXPGZ-HNNXBMFYSA-N	443.334	1.008	50	20	IDGD	
CC[C@@H](O)C(=O)N1CCC([C@@H]2CCCCN2C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)CC1	1827677069	FDMBUVJVYGKWHL-PJHRTMSESA-N	431.537	1.511	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc([N+](=O)[O-])[nH]2)CC1	1831873847	APNXTHSKBLRVGT-KRWDZBQOSA-N	448.524	1.529	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC([C@@H]2CCCCN2C(=O)CN2C(=O)C=CC2=O)CC1	1831984324	REDUWQORVARXBS-KRWDZBQOSA-N	435.597	1.383	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3ccco3)CCO2)C1	1833050643	APQNOYXSWPXFTH-OALUTQOASA-N	433.332	1.905	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cccn4nccc34)CC2)CC1)[C@@H](O)CCl	1833312190	KSESHNUHTZUHDW-IBGZPJMESA-N	433.940	1.119	50	20	IDGD	
Cc1nc(C(=O)NC2CCN(C3CCN(C(=O)[C@H](O)CCl)CC3)CC2)ccc1F	1833957384	QBNPCHACYPJBNN-GOSISDBHSA-N	426.920	1.314	50	20	IDGD	
C[C@H](C(=O)N1CCC(N2CCC(NC(=O)CCBr)CC2)CC1)n1cncn1	1834423472	KQGXCAGAKOCQSP-CQSZACIVSA-N	441.374	1.196	50	20	IDGD	
O=C(CN1CCCCC1)NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1	1834612002	WBUKRPMFENYGQQ-UHFFFAOYSA-N	443.430	1.829	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cc4n(n3)CCCO4)CC2)CC1	1835568907	OTZCHGKIQLWCEN-QGZVFWFLSA-N	437.972	1.868	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3[nH]cc4c3CCC4)CC2)CC1	1836087043	QSLUGGGDLSGGHQ-LJQANCHMSA-N	436.984	1.942	50	20	IDGD	
CC/C=C(\C)C(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1	1837922190	VQOKISVCXBZHTK-YAXRCOADSA-N	428.338	1.335	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3c(C)ccn3C)CCO2)C1	1838822384	KVIDEZJFHUTGBP-DNVCBOLYSA-N	442.354	1.577	50	20	IDGD	
O=C(CCc1cnc2[nH]ccc2c1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1840080726	AJJCNSUSLMIOFO-FXAWDEMLSA-N	438.887	1.486	50	20	IDGD	
O=C(c1ccc(CO)c(F)c1)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1840784047	IBTHXFRXHVEJGL-SFHVURJKSA-N	435.279	1.192	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CCCSC1)CCO2	1840867066	CUGIVSZAZUSZHU-GRDNDAEWSA-N	435.384	1.369	50	20	IDGD	
COc1ccc(Br)cc1C(=O)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1	1841352770	MGJXPHREMYDUNG-CYBMUJFWSA-N	431.714	1.874	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC2(CCCN2C(=O)c2ccc[n+]([O-])c2)C1	1842145092	CTKDCVRUHGSSNY-HNNXBMFYSA-N	438.912	1.269	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC2(CCCN2C(=O)c2nc3ccccc3n(C)c2=O)C1	1843742929	SMNOGOKDQPYIAX-ZDUSSCGKSA-N	447.333	1.782	50	20	IDGD	
C[Si](C)(C)C#CCCCC(=O)N1CC2(CCCN2C(=O)c2cnccc2C(=O)NN)C1	1844264424	RIEUSPNZDXZSSI-UHFFFAOYSA-N	441.608	1.553	50	20	IDGD	
Cc1cc(F)c(C(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)cc1F	1844265548	NVQLAVCZYVJVAO-UHFFFAOYSA-N	429.427	1.403	50	20	IDGD	
C[C@H](NC(=O)c1ccccn1)C(=O)N1CC2(CCCN2C(=O)[C@@H](F)Br)C1	1845219920	QNHSIDJVZSPNHQ-WCQYABFASA-N	427.274	1.094	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@H](O)c1cccc(Br)c1)C2	1846363545	PBPDBOUZPYUQHF-HUUCEWRRSA-N	445.741	1.940	50	20	IDGD	
Cc1nn2cc(CC(=O)N3CC[C@H]4[C@@H]3CCN4C(=O)[C@H](C)Br)nc2s1	1847978715	QUNGGHSAGJSHKP-XDTLVQLUSA-N	426.340	1.627	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	15948133	GRJRLWUXNUXFFT-UHFFFAOYSA-N	428.470	1.183	50	20	IDGD	
O=C(Cc1csc(-c2cc(Br)cs2)n1)NNC(=O)C(=O)NC1CC1	71964580	IFGFUYBAKCMQBB-UHFFFAOYSA-N	429.321	1.603	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)c1ccc(N2CCCS2(=O)=O)cc1	105145512	WBOJFPCHCCAREF-UHFFFAOYSA-N	433.486	1.465	50	20	IDGD	
Cc1cc(C)nc(SCc2ccc(C(=O)NNC(=O)CN(C)S(C)(=O)=O)cc2)n1	105969521	MCZAJEJAPZGQPV-UHFFFAOYSA-N	437.547	1.038	50	20	IDGD	
CN(C1CCN(C(=O)NNC(=O)c2ccc(Br)s2)CC1)S(C)(=O)=O	725860453	OMIOSTYGAFKZLC-UHFFFAOYSA-N	439.357	1.221	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H](c2ccccc2)[C@H]2CCCO2)c1	726711369	DHOUKWYLZTTWHQ-MOPGFXCFSA-N	446.529	1.801	50	20	IDGD	
O=C(COC(=O)c1cnc(-c2ccccn2)s1)NNC(=O)[C@@H]1COc2ccccc2O1	728342019	DUYVWZCVEQRJKY-HNNXBMFYSA-N	440.437	1.349	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc2c(c1)C(=O)OC2)c1cc(F)ccc1Br	728514075	DFXORMMUTONNEM-UHFFFAOYSA-N	429.223	1.882	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCCOc2ccc(S(C)(=O)=O)cc2)cc1OC	730066539	LKAYBDLOQIQCMR-UHFFFAOYSA-N	437.474	1.130	50	20	IDGD	
CNS(=O)(=O)c1ccc([C@H](C)NC(=O)NNC(=O)c2cccc3ncccc23)cc1	730120243	GBJPNGFOVOXRKL-ZDUSSCGKSA-N	427.486	1.848	50	20	IDGD	
CCCn1nc(C(=O)NN=C2CCN(CCN3CCOCC3)CC2)c2ccccc2c1=O	731557596	SKUJKJFZJHDVBQ-UHFFFAOYSA-N	440.548	1.320	50	20	IDGD	
CN(C)[C@@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)c1cccc(Cl)c1	731863915	JQIISXKAHGOVPP-QGZVFWFLSA-N	438.937	1.654	50	20	IDGD	
COCCN(Cc1ccc2c(c1)OCO2)C(=O)NNC(=O)c1c(C)nc2ccccn12	732235801	KMADKOXUCWDILB-UHFFFAOYSA-N	425.445	1.874	50	20	IDGD	
CCCCCCN(C)CC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	732286475	XRYJQEJCEUGKQR-UHFFFAOYSA-N	425.599	1.578	50	20	IDGD	
CSCC[C@@H](C(=O)NNc1ccccc1S(C)(=O)=O)N1C(=O)c2ccccc2C1=O	732303578	IQEZIGJCPMVXPO-INIZCTEOSA-N	447.538	1.951	50	20	IDGD	
Cc1ccccc1NC(=O)NNC(=O)NCC1CCN(S(=O)(=O)C(F)(F)F)CC1	732676513	TZBYYSMOXMYGFV-UHFFFAOYSA-N	437.444	1.892	50	20	IDGD	
CSc1nc2nc(C)c(CC(=O)NNC(=O)c3cnn(-c4ccccc4)c3)c(C)n2n1	733109839	IPLCFRWVAROOOT-UHFFFAOYSA-N	436.501	1.652	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)NCCn2ccnc2C)cc1	733142496	ICELXHBAMOJBSP-AQTBWJFISA-N	447.499	1.662	50	20	IDGD	
CC(=O)[C@@H]1CC(C(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)=NN1c1ccccc1	733537289	AWXUGIYHNRRGRG-SFHVURJKSA-N	442.859	1.868	50	20	IDGD	
CC(C)Oc1cccc([C@@H](O)CNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1	735100423	SOJWPKHOSJKILY-IBGZPJMESA-N	442.520	1.544	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)C(=O)C(C)(C)C)c2)cc1	735836154	FBZKPZZTNCSJKW-UHFFFAOYSA-N	433.486	1.872	50	20	IDGD	
CCn1nc(C(=O)NN=Cc2c(N3CCOCC3)nc3ccccn23)c2ccccc2c1=O	741805889	VHMGVJVSDIYYKN-UHFFFAOYSA-N	445.483	1.665	50	20	IDGD	
CCC(=NNC(=O)N[C@H]1CCS(=O)(=O)C1)c1ccc(I)cc1	741810827	RLWCBXQSZKCQHO-LBPRGKRZSA-N	435.287	1.892	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Cc2ccc(Cl)cc2)cc(NS(C)(=O)=O)c1OC	742481053	WUTWHFIBMKYNDA-UHFFFAOYSA-N	441.893	1.732	50	20	IDGD	
C[C@H]1C[C@@H](NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)C(=O)N1c1ccccc1	743589402	UEWVWIDNGWWCOI-MAUKXSAKSA-N	437.504	1.217	50	20	IDGD	
CCn1c(=O)n(CC(=O)NNC(=O)c2cc(Br)ccc2O)c2ccccc21	743732113	LCIGOJXFGDBADK-UHFFFAOYSA-N	433.262	1.752	50	20	IDGD	
CCCCc1ccc(NC(=S)NNC(=O)CCN2C(=O)[C@H]3[C@H]4CC[C@@H](O4)[C@@H]3C2=O)cc1	743821894	XNEWOWLXPUOLGO-FPAYPSAMSA-N	444.557	1.899	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)sc1Br	744463089	ABEXKLNORKBWIE-UHFFFAOYSA-N	449.264	1.141	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H]1C(=O)OCC(=O)NNC(=O)c1ccc(C#N)cc1	745075488	XOWFNMHHNHAEQC-JKSUJKDBSA-N	430.461	1.556	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)N[C@@H]1CC(=O)N([C@H]2C[C@H]2c2ccccc2)C1	745913776	CPHBVWTWGZYVFY-KMFMINBZSA-N	439.428	1.401	50	20	IDGD	
CCC1CCC2(CC1)NC(=O)N(CC(=O)NNC(=O)c1ccc(CN(CC)CC)o1)C2=O	746397299	NUJZPHCQSUWLEB-UHFFFAOYSA-N	447.536	1.773	50	20	IDGD	
CC[C@@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(CC)CC)c1)C1CCOCC1	746425846	KIBNGQWGTZAGNU-GOSISDBHSA-N	440.566	1.866	50	20	IDGD	
COc1ccc([C@H](C)NC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)cc1	746962659	KFDRDHLRMDMLJL-HNNXBMFYSA-N	448.549	1.414	50	20	IDGD	
COC(=O)c1cc(C)c(C)c(S(=O)(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c1	747615733	HSEDYALKPGENIU-UHFFFAOYSA-N	428.470	1.899	50	20	IDGD	
Cc1ccsc1[C@H]1C[C@H]1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	747693925	RVXCLUPLFSXMPO-DLBZAZTESA-N	449.554	1.642	50	20	IDGD	
COc1cc(CN2CCN(CC(=O)NNC(=O)c3cccc(Cl)c3)CC2)cc(OC)c1	747844427	SLWKDGNLAKAHOG-UHFFFAOYSA-N	446.935	1.936	50	20	IDGD	
COc1cc(OC)cc(N2CC[C@H](NC(=O)NNC(=O)COc3ccccc3F)C2=O)c1	747956442	SZSPRPMHVDSGHG-KRWDZBQOSA-N	446.435	1.358	50	20	IDGD	
CSCC[C@H](NC(=O)c1ccc([N+](=O)[O-])o1)C(=O)NNC(=O)[C@H]1Cc2ccccc2O1	748273312	DVPZJJRNROWNKW-SWLSCSKDSA-N	448.457	1.190	50	20	IDGD	
Cc1cc(Br)ccc1NNC(=O)[C@@H](C)NS(=O)(=O)c1c(C)nn(C)c1C	748736902	KBHMIGHGHHBVAV-LLVKDONJSA-N	444.355	1.918	50	20	IDGD	
Cc1ccc(Br)cc1NC(=O)CCNC(=O)NNC(=O)C(=O)N1CCCC1	749016835	FBEIFLPXEYAYAF-UHFFFAOYSA-N	440.298	1.039	50	20	IDGD	
O=C(NCCC(=O)N1CCN(c2ccccn2)CC1)NNC(=O)c1cc2ccccc2o1	749560578	XWEPXFSTMWEYNN-UHFFFAOYSA-N	436.472	1.511	50	20	IDGD	
O=C(CCc1ccccc1)NNC(=O)c1cccc(S(=O)(=O)NC[C@@H]2CCCO2)c1	749958158	HITAVRXRCJHHBZ-SFHVURJKSA-N	431.514	1.538	50	20	IDGD	
CN(C(=O)OC(C)(C)C)[C@@H]1CCN(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)C1	750276371	NUMBWQHZVJQFCR-MRXNPFEDSA-N	447.540	1.375	50	20	IDGD	
O=C(O)CCC(=O)c1ccc(S(=O)(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1	751213045	MXYVGFYUIJYYSO-UHFFFAOYSA-N	442.453	1.543	50	20	IDGD	
CC(C)[C@@H](CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)c1cccnc1	751814050	RERUWDXJRMYIOF-GOSISDBHSA-N	433.534	1.716	50	20	IDGD	
Cn1c(NNC(=O)CCNS(=O)(=O)c2ccc(F)c(F)c2)nc2ccccc2c1=O	752906371	IGPDWOCQOHWKFY-UHFFFAOYSA-N	437.428	1.023	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NC[C@@H]2CCCO[C@H]2C(C)C)cc1	753035965	WDXCNJMVWWZNET-LPHOPBHVSA-N	440.566	1.397	50	20	IDGD	
O=C(COc1ccccc1Cc1ccccc1)NNC(=O)NC[C@@H]1CCCCS1(=O)=O	753275562	VDVINPAWLJCECX-IBGZPJMESA-N	445.541	1.954	50	20	IDGD	
O=C(NNC(=O)N1CCS(=O)(=O)[C@H]2CCCC[C@H]21)c1cccc(Br)c1	753919567	VHMQEIRLZFRIFX-KGLIPLIRSA-N	430.324	1.845	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)NNC(=O)CCCOc2ccc(Cl)cc2C)co1	755381372	LORBCAYEISNGFC-UHFFFAOYSA-N	429.882	1.770	50	20	IDGD	
CC(=O)Nc1cccc(NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1	755495953	ZBYNRFQNJKGTTR-UHFFFAOYSA-N	445.501	1.896	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)Nc2ccccc2C(=O)N2CCN(C)CC2)cc1C	755625361	YYYJOZHTTSCYTM-UHFFFAOYSA-N	439.516	1.923	50	20	IDGD	
CNC(=O)c1ccc(OC)c(NC(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)c1	755918907	KCRJQCJIEMINFZ-UHFFFAOYSA-N	432.433	1.547	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2ccc(N3CCNC(=O)C3)c(Cl)c2)cc1OC	755937294	FTHNRYDBMFGOQP-UHFFFAOYSA-N	447.879	1.760	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)c2nnc(O)c3ccccc23)c(OCC(=O)N(C)C)c1	756204227	UZAQNPMEMSAHHZ-UHFFFAOYSA-N	438.444	1.577	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)Nc2cc(C(=O)N3CCSCC3)ccc2C)n1	756329452	DNIWAUAGHGXULY-UHFFFAOYSA-N	430.534	1.850	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1C	756516992	VGSMCTAWRGMKCB-UHFFFAOYSA-N	444.477	1.199	50	20	IDGD	
CCOC(=O)[C@@H](C)NC(=O)c1ccc(NC(=O)NNC(=O)Cn2nc(C)cc2C)cc1	756790768	RWJXGAOZSVLOHF-CQSZACIVSA-N	430.465	1.034	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)c1cncc(I)c1	756863232	IVOUDCNYNMIPLK-UHFFFAOYSA-N	435.181	1.410	50	20	IDGD	
Cc1ccc(S(=O)(=O)Nc2ccc(C(=O)NNc3ccc(C(N)=O)nn3)cc2)cc1C	757400153	PZGIYHKKBBOQCX-UHFFFAOYSA-N	440.485	1.750	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NN=c2cc[nH]cc2Cl)o1	757406284	UUJODNQQGHIDEI-ZDUSSCGKSA-N	442.881	1.223	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)Nc1nc(SCc2ccccc2)ns1	757695873	LPJJROJKYSLJLY-LLVKDONJSA-N	427.533	1.418	50	20	IDGD	
COCc1nc2n(n1)C[C@@H](NC(=O)NNC(=O)c1ccc(OC(C)C)c(OC)c1)CC2	757791649	ZOPYMJYDZYHIDJ-AWEZNQCLSA-N	432.481	1.179	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cc(S(C)(=O)=O)cc(C)c2C)cc(OC)c1OC	758053189	FOOCDLMKCUUSGY-UHFFFAOYSA-N	436.486	1.808	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)NCc2ccc3c(c2)C(=O)NCC3)c1	758681603	AHMIGBAYIDNNQL-UHFFFAOYSA-N	447.289	1.888	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CN2CCN(Cc3cccc(Cl)c3)C(=O)C2)c1	758753731	IAWYRPXXLLZSPI-UHFFFAOYSA-N	425.876	1.317	50	20	IDGD	
CN(NC(=O)[C@H]1CC(=O)N(Cc2ccco2)C1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758781427	CRPSROOMWNCYQQ-HNNXBMFYSA-N	449.508	1.264	50	20	IDGD	
Cc1c(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)cnn1C	759609823	SKEKITYVUDPBES-UHFFFAOYSA-N	434.522	1.047	50	20	IDGD	
CCN(CC)C(=O)COc1ccc(NC(=O)C(=O)NNC(=O)C(C)(C)C)cc1Cl	761072111	KAHLUMKHGGYZHI-UHFFFAOYSA-N	426.901	1.719	50	20	IDGD	
CCCS(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)c2ccccc2F)c(OC)c1	761265551	AKTPEIZNTVJESU-UHFFFAOYSA-N	445.494	1.609	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)Nc1cccc(OC[C@H]2CCCO2)c1	763570118	DALBHSKSVVZLRH-APWZRJJASA-N	441.440	1.170	50	20	IDGD	
CC(C)(C)c1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccn(-c3ccncc3)n2)cc1	763599286	DPAFORSFXGTQLS-UHFFFAOYSA-N	436.472	1.730	50	20	IDGD	
Cc1cc(=O)n(C)cc1NC(=O)C(=O)NNC(=O)COc1ccccc1-c1ccccc1	763644777	ZQLWDIJAZVAANI-UHFFFAOYSA-N	434.452	1.526	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)C(=O)Nc1cc(Cl)cc2cccnc12	763804859	VINQKEPWJNFSAI-UHFFFAOYSA-N	443.803	1.961	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cc(CC(C)(C)C)nn2C)cc1	763873023	RIRZXTYHQCKYHT-AWEZNQCLSA-N	443.504	1.765	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2cccc(-c3ccc4c(c3)CCO4)c2)n1	763886142	RHWBWDWKWLURHA-UHFFFAOYSA-N	433.468	1.888	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)C(=O)Nc1ccn(CC(F)F)n1	763901277	MTBZFJFWPWRROT-UHFFFAOYSA-N	434.428	1.980	50	20	IDGD	
CC(C)(C)c1ncc(NC(=O)C(=O)NNC(=O)c2ccc(Br)s2)cn1	763938518	HMHBZVVSRIHQDZ-UHFFFAOYSA-N	426.296	1.998	50	20	IDGD	
COC(=O)c1csc(NC(=O)C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)c1C	763944668	OMFJRYHLMQUERB-UHFFFAOYSA-N	443.441	1.134	50	20	IDGD	
COCCOc1ccc(F)cc1NC(=O)C(=O)NNC(=O)c1cc(Br)c[nH]1	763994185	BEHFBVKLBDNKSX-UHFFFAOYSA-N	443.229	1.341	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)C(=O)N1CCc2c1cccc2C(F)(F)F	764005984	HPAQCFLTQRCNFG-UHFFFAOYSA-N	435.358	1.827	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)C(=O)Nc1cccc(-n2cccn2)c1	764203563	NBPXUUVMLCHSTE-UHFFFAOYSA-N	430.465	1.263	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)CCc2ccccc2O)cc1N1CCOC1=O	764289254	QDYQKKMYBCQBMW-UHFFFAOYSA-N	442.428	1.076	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)C(C)(C)c2ccccc2)cc1NS(C)(=O)=O	764313727	NQODZWXYCBDRCQ-UHFFFAOYSA-N	448.501	1.130	50	20	IDGD	
COc1ccc(C(=O)N2CCCC2)cc1NC(=O)C(=O)NNC(=O)Cc1ccccc1F	764319300	OEBYBRDJBZNNDJ-UHFFFAOYSA-N	442.447	1.399	50	20	IDGD	
COC(=O)C(C)(C)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)cc1	764349873	SQCWIFZKEVXIHM-UHFFFAOYSA-N	433.848	1.896	50	20	IDGD	
CC(=O)Nc1cc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)ccc1Cl	764351394	RETSGJQWQIPWHJ-UHFFFAOYSA-N	440.847	1.884	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2ccc(Cl)c(S(=O)(=O)N3CCC[C@H](C)C3)c2)n[nH]1	765586414	SXABRVCIPGWRJR-NSHDSACASA-N	439.925	1.867	50	20	IDGD	
C[C@@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(NC(=O)C(=O)NNc3cnccn3)cc2)C1	766258156	AYMGEPWOIYIIIM-ZIAGYGMSSA-N	432.506	1.225	50	20	IDGD	
Cn1ccnc(NNC(=O)CSc2nnc(-c3ccncc3)n2-c2ccccc2)c1=O	768203762	KLASYIWPQDERRW-UHFFFAOYSA-N	434.485	1.658	50	20	IDGD	
CCCCCCn1cc(S(=O)(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c(O)nc1=O	769620276	NDELSZYORFZBSV-UHFFFAOYSA-N	439.450	1.061	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)Nc1cccc(C(=O)NCCC(N)=O)c1	770418814	GXBCFNNUKRUMPY-GFCCVEGCSA-N	447.879	1.565	50	20	IDGD	
COCCN(CC(=O)NNc1nc(O)c2cnn(C(C)(C)C)c2n1)C(=O)OC(C)(C)C	770958915	SVIROWDMTLEXBM-UHFFFAOYSA-N	437.501	1.614	50	20	IDGD	
Cc1nn(C)c(C)c1S(=O)(=O)N[C@@H](C)C(=O)NNc1ccnc(Br)c1	771554005	UYVRKDGNAGOGHM-VIFPVBQESA-N	431.316	1.005	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)CSc1nnc(C2CCCCC2)n1N	771900171	GKHSQAZOYPTVDK-LBPRGKRZSA-N	426.543	1.257	50	20	IDGD	
Cc1cc(C)n(-c2ccc(C(=O)NNC(=O)C(=O)NCc3ccc(Cl)cc3)cn2)n1	772192653	NQAARWPZCGXSAS-UHFFFAOYSA-N	426.864	1.615	50	20	IDGD	
CC(C)(CCCO)CNC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	772626961	FPVYFRRTLRNWMU-UHFFFAOYSA-N	426.539	1.214	50	20	IDGD	
O=C(C[C@@H](O)c1cccc(F)c1)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	772809215	FTKMKCHOZNAANK-HXUWFJFHSA-N	448.926	1.868	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NN=Cc2c(Cl)cccc2S(C)(=O)=O)c1	773194653	XEKGIWSRNCUNQF-UHFFFAOYSA-N	443.934	1.758	50	20	IDGD	
Cc1nn(CCC(=O)NNC(=O)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)c(C)c1[N+](=O)[O-]	773419797	NYVTWGAVMIBLFU-CQSZACIVSA-N	438.485	1.593	50	20	IDGD	
COc1ccc(Cn2nccc2NC(=O)C(=O)NNc2ccccc2[N+](=O)[O-])c(OC)c1	773654534	GAMQPCSNFUEFRG-UHFFFAOYSA-N	440.416	1.939	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccc(-n2cncn2)c(F)c1	774009023	NBSLXXGDYSXPKP-NSHDSACASA-N	446.826	1.613	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)NCc3ccc(S(N)(=O)=O)cc3C)n[nH]2)cc1	775203813	XDMHEXGRXBXBPL-UHFFFAOYSA-N	442.501	1.485	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2c(C)cccc2F)c1	775248018	PSZRNOLGTGMLGK-UHFFFAOYSA-N	443.522	1.788	50	20	IDGD	
CC(C)NS(=O)(=O)c1cc(C(=O)NNc2cccc(S(C)(=O)=O)c2)ccc1F	776714411	CBVPNDSDHKDYHW-UHFFFAOYSA-N	429.495	1.673	50	20	IDGD	
O=C(Cc1cccnc1)NNS(=O)(=O)c1cc(Cl)ccc1OC[C@@H]1CCOC1	777623911	OLKRHJMOUCIDGD-CQSZACIVSA-N	425.894	1.703	50	20	IDGD	
Cc1cc(F)c([N+](=O)[O-])cc1S(=O)(=O)NNC(=O)CCCNC(=O)OC(C)(C)C	777937716	VFBJQWGIXKJWJH-UHFFFAOYSA-N	434.446	1.657	50	20	IDGD	
C[C@H](NC(=O)OC(C)(C)C)[C@@H]1CCN(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)C1	778589694	SVNATMCKNFXUFA-DZGCQCFKSA-N	444.496	1.252	50	20	IDGD	
COC[C@@H](C)n1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(C)c(C)c3)[nH]n2)n1	778712773	IECFKWKAMCBWMT-CQSZACIVSA-N	439.476	1.497	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ncncc2Cl)c(C)c1S(=O)(=O)NC1CC1	782160819	ZSIYBYGENKDSKO-UHFFFAOYSA-N	438.897	1.269	50	20	IDGD	
COCC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2Cl)cc1	782926391	SJVUFRWNESVJQE-UHFFFAOYSA-N	439.255	1.978	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNc2ccc(Cl)cc2)ccc1S(=O)(=O)N(C)C	783336931	VUGKCVJFGFQBLC-UHFFFAOYSA-N	426.882	1.681	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)c(OC)c1	784210248	KCMWFSDBMKGRKP-UHFFFAOYSA-N	434.474	1.226	50	20	IDGD	
COc1ncnc(N(C)C)c1NC(=O)C(=O)NNc1ccc(OCC(F)(F)F)cc1	784367914	DXFDJQKRALJJGN-UHFFFAOYSA-N	428.371	1.574	50	20	IDGD	
Cc1nc(Cn2cc(C(=O)NNC(=O)[C@H](C)Oc3c(C)cc(Cl)cc3C)nn2)no1	784724279	QSABDUHPZGMYHW-NSHDSACASA-N	433.856	1.517	50	20	IDGD	
C[C@@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(NC(=O)C(=O)NNc3ccccn3)cc2)C1	784801520	QMGRPPIFLKSWEP-HUUCEWRRSA-N	431.518	1.830	50	20	IDGD	
CCCNS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2cccc(C(=O)OC)c2)cc1	784851370	JDQUYNIZBPGACD-UHFFFAOYSA-N	434.474	1.243	50	20	IDGD	
CCNC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)c1C	789732437	SQWVFKXTYCRLAT-UHFFFAOYSA-N	441.444	1.307	50	20	IDGD	
CC(C)(C)OC(=O)NCCc1nc(C(=O)NNC(=O)[C@H]2COc3ccccc3O2)cs1	789941841	MMLFBFNWKLPVTB-OAHLLOKOSA-N	448.501	1.811	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])c1	790535358	IXFANVANQTWYTR-UHFFFAOYSA-N	429.813	1.795	50	20	IDGD	
O=C(NC[C@H]1CCSC1)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	790877432	MXIXXPGEFFDPNL-MRXNPFEDSA-N	448.570	1.862	50	20	IDGD	
CO[C@H]1CCOc2c(NC(=O)C(=O)NNC(=O)[C@@H]3COc4ccccc4O3)cccc21	790957561	UKHCWQZNWXXNOY-YOEHRIQHSA-N	427.413	1.083	50	20	IDGD	
Cc1cccc(=O)n1C[C@](C)(O)C(=O)NNc1ccccc1S(=O)(=O)NC(C)(C)C	792267093	HFEWNINWUHWMCT-FQEVSTJZSA-N	436.534	1.128	50	20	IDGD	
O=C(Cc1ccccn1)NNC(=O)C(=O)Nc1c2c(nn1-c1ccc(Cl)cc1)CCC2	792268342	MENIIPSQBNXIGU-UHFFFAOYSA-N	438.875	1.738	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCCCC2)cc1NC(=O)C(=O)NNc1ncccc1C	792376759	YUFWLWBKEXFWRR-UHFFFAOYSA-N	431.518	1.955	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2cccc(C)n2)s1	792789804	NYZSZXQJNARGLP-UHFFFAOYSA-N	425.536	1.626	50	20	IDGD	
CN(CC(N)=O)C(=O)c1cccc(NC(=O)C(=O)NNc2ccc(Br)cc2)c1	793034488	GLTICMJYHLRSLN-UHFFFAOYSA-N	448.277	1.088	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CCNS(=O)(=O)c2c(Cl)cccc2Cl)n1	794074579	CLFIHJNFAFMAJV-UHFFFAOYSA-N	431.301	1.826	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)CN2C(=O)C(F)(F)Oc3ccccc32)nc2ccccc21	794179964	GQVGUFBASIDGCM-UHFFFAOYSA-N	429.383	1.282	50	20	IDGD	
Cc1nn(C(C)C)c(C)c1CC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	794179974	GWOVUXQYEDZDBP-UHFFFAOYSA-N	447.561	1.869	50	20	IDGD	
Cc1cccc(CC2(O)CCN(CC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)CC2)c1	796485038	QJNQFSYHKODRHV-UHFFFAOYSA-N	426.473	1.734	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNC(=O)C(=O)Nc1cccc(N2CCCC2)c1	797368519	CCULWBZOZPGAHT-UHFFFAOYSA-N	439.472	1.299	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNC(=O)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl	797369069	NHJUKYNQJAWDRS-UHFFFAOYSA-N	449.807	1.261	50	20	IDGD	
O=C(NCC(F)(F)F)NNC(=O)C1(NS(=O)(=O)c2cccc(F)c2)CCCCC1	798314764	ACWPTPIJPZXJNA-UHFFFAOYSA-N	440.419	1.700	50	20	IDGD	
COc1cc(N2CCN(CC(=O)NNC(=O)c3ccc(OC)c(OC)c3)CC2)ccc1F	801964934	ZCWKTCTUJNOBMP-UHFFFAOYSA-N	446.479	1.435	50	20	IDGD	
COc1ccc(CN2C(=O)c3ccccc3C2=O)cc1C(=O)NNC(=O)N=c1cc[nH]cc1	802026505	FFLCZOUYBGROHX-UHFFFAOYSA-N	445.435	1.775	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)[C@@H](C)S(=O)(=O)C2CCOCC2)cc1Cl	802076325	HDVYMUPJCXPVAD-SNVBAGLBSA-N	449.913	1.492	50	20	IDGD	
CNS(=O)(=O)c1csc(C(=O)NNC(=O)Nc2cc(OC)c(Cl)cc2OC)c1	802084681	FOVPTGVVSHVELX-UHFFFAOYSA-N	448.910	1.793	50	20	IDGD	
COC(=O)c1cc(CNC(=O)NNC(=O)c2cc(Br)c[nH]2)ccc1OC	806968284	AFYZDQICQFMDTC-UHFFFAOYSA-N	425.239	1.717	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)C(=O)Nc1nc(-c2ccco2)cs1	806975879	SMILMXWOSFHNIY-UHFFFAOYSA-N	438.425	1.694	50	20	IDGD	
Cc1cccn(Cc2c(F)cccc2NC(=O)C(=O)NNC(=O)c2cccc(C#N)c2)c1=O	806977899	CZWAAIFBQAJDCQ-UHFFFAOYSA-N	447.426	1.616	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)OCC(=O)NC(=O)Nc2ccc3c(c2)OCO3)cc(C#N)n1C	809303064	FZLIEURNEMUZAR-RZNTYIFUSA-N	435.396	1.732	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)NCC(=O)NNc2cccc(C(F)(F)F)n2)cc1	810427851	OSASPLXZFWUDAO-UHFFFAOYSA-N	431.396	1.480	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)Nc2ccc(C[C@H]3CC(=O)NC3=O)cc2)cc1	812947172	KDHWYEONHGDRNK-AWEZNQCLSA-N	445.501	1.291	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)NS(=O)(=O)c2cncc(C#N)c2)c(C)n1C[C@H]1CCCO1	813984907	GEFAXHTTXFNWDO-VPDFPHFYSA-N	439.497	1.963	50	20	IDGD	
CC(C)C(=O)Nc1cc(C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)ccn1	815482932	KDDMBQIKSKKZNH-UHFFFAOYSA-N	429.389	1.202	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)COc2cccc(C)c2)cc1)[C@H]1C[C@@H]1C	815564861	VNJFTYZXMBNGSK-YWZLYKJASA-N	438.484	1.921	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)C(=O)Nc2scc(C(C)(C)C)c2C#N)c1	815570442	CICXUQRZSKOICP-UHFFFAOYSA-N	428.474	1.670	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)CNc2ccccc2OC)c1	825624716	QBJOFWPDANKHQI-UHFFFAOYSA-N	434.518	1.599	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)[C@@H]2CCCN2S(=O)(=O)c2ccc(C)cc2)c1	825786643	VYPSSLAWAWKTQP-IBGZPJMESA-N	446.529	1.416	50	20	IDGD	
CC(=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O)c1ccc(-c2ccc(F)cc2)s1	863968256	JSSNAAHLKFYZKK-UHFFFAOYSA-N	447.517	1.979	50	20	IDGD	
CCN1CCC[C@@H]1CNC(=S)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	884157300	XGXFQWTUUWFUFI-MRXNPFEDSA-N	439.607	1.064	50	20	IDGD	
CSC[C@H](C(=O)NNC(=O)c1ccc2ccccc2n1)N1C(=O)[C@H]2CCCC[C@H]2C1=O	912766816	PUEXULZPJTYIPT-RVKKMQEKSA-N	440.525	1.903	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccccc1C(F)(F)F)NNC(=O)c1cccc([N+](=O)[O-])c1	912771434	IUTWBWTXNDHZDQ-UHFFFAOYSA-N	446.363	1.353	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)O[C@H](C)C(=O)N2CCC[C@@H](C(N)=O)C2)c1C	913027175	JVAYMONHKFTAOU-XYDYMBQBSA-N	430.505	1.314	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C2=NN(c3ccc(F)cc3)[C@H](C(N)=O)C2)c1	913081420	OESXWYNAQQISBV-SFHVURJKSA-N	427.436	1.089	50	20	IDGD	
CS(=O)(=O)NCCCNC(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccccc1	914756477	GAIRPSTYJLDQFC-GHRIWEEISA-N	426.502	1.426	50	20	IDGD	
COc1nn(C)c2nc(C)c(CCC(=O)OCC(=O)NNC(=O)c3ccccc3)c(C)c12	914976171	UAWBNPXJKWGCOJ-UHFFFAOYSA-N	439.472	1.531	50	20	IDGD	
Cc1ccc(OCCNC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1	915891899	ZAGWBFHBWGIXQB-UHFFFAOYSA-N	425.533	1.917	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)NC2CCN(C(C)=O)CC2)cc(OCC)c1OCC	915931975	QXJHAODVAWUKJL-UHFFFAOYSA-N	436.509	1.838	50	20	IDGD	
COc1ccccc1[C@@H](NC(=O)NNC(=O)COc1ccc(C#N)cc1)c1nccn1C	916228295	KXDZUCZBPHMINA-HXUWFJFHSA-N	434.456	1.799	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NCc1ccc(N2CCN(C)CC2)nc1	916245740	WEYDQOAGXMNZRK-HNNXBMFYSA-N	430.484	1.270	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)NC[C@H]2CCS(=O)(=O)C2)cc(OCC)c1OCC	916375496	YQKBKHWMAAVGHV-CYBMUJFWSA-N	443.522	1.261	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H]2CCN3CCCC[C@@H]23)c1	916638599	JADUGHLEIHJXOW-ROUUACIJSA-N	437.566	1.288	50	20	IDGD	
CCN1C(=O)c2ccc(C(=O)NNc3nc4ccccc4c(=O)n3CC)cc2S1(=O)=O	917522083	HZBCGQQAIRCXTQ-UHFFFAOYSA-N	441.469	1.338	50	20	IDGD	
CN(CCCC(=O)NNC(=O)c1csc(N2CCOCC2)n1)C(=O)OC(C)(C)C	921302333	SLZZXUMSPAGQAC-UHFFFAOYSA-N	427.527	1.388	50	20	IDGD	
Cc1nn([C@@H]2CCS(=O)(=O)C2)c(Cl)c1C=NNC(=O)CNC(=O)c1cccs1	1115934333	UCQSDRAGBYMRGS-LLVKDONJSA-N	443.938	1.146	50	20	IDGD	
Cc1ccn2c(=O)c(C(=O)NNC(=O)C3CCN(C(=O)OC(C)(C)C)CC3)cnc2c1	1116085511	NQQAERCHYBWPRW-UHFFFAOYSA-N	429.477	1.411	50	20	IDGD	
CNS(=O)(=O)c1ccc(C)c(C(=O)NNC(=O)c2ccc(Br)cc2)c1	1317744845	LQAOFCFFYIVKBQ-UHFFFAOYSA-N	426.292	1.740	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)NCc1ccccc1N1CCN(C)CC1	1326470479	MSBXWZYTIOXVQX-UHFFFAOYSA-N	425.533	1.910	50	20	IDGD	
CCn1nc(C(C)C)cc1C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	1333508694	NZIYAFCPPWXRDP-UHFFFAOYSA-N	426.521	1.245	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2)c1noc2c1CCCC2	1777864305	XLMRBIVYWTVKOX-AKCHCHLHSA-N	425.913	1.281	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4occc4c3)C2)C1	1777948496	DYMSZZFEGHNTOY-QFIPXVFZSA-N	428.489	1.249	50	20	IDGD	
O=C(CS[C@@H]1CCCCO1)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1779083433	SYUXBZXWDHHORR-FMKPAKJESA-N	439.347	1.767	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)n(C(F)F)n1	1779297954	CSSGAXXYSAMFSN-SFHVURJKSA-N	430.528	1.882	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(-c4ccncc4)[nH]n3)C2)C1	1779594126	KULCWRJVAXPBAZ-NRFANRHFSA-N	443.580	1.767	50	20	IDGD	
CCOC(=O)c1cc(C(=O)N2CC[C@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)ccn1	1780321401	SOPBXCSFUXCDIW-NRFANRHFSA-N	437.924	1.967	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(OC)c(OC)c3)C2)C1	1780659506	WUVLHBWANBRTIR-QRWLVFNGSA-N	426.897	1.401	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CC(=O)Nc1cc(C)on1)C2	1780702733	RAOMKXDPWVSGCL-BXTJHSDWSA-N	440.928	1.843	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CC(=O)Nc1cc(C)on1)C2	1780702735	RAOMKXDPWVSGCL-STXHMFSFSA-N	440.928	1.843	50	20	IDGD	
CN1CCCC[C@@H]1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Br)C1	1780770422	NCRYGZDCGHCRES-ZXFNITATSA-N	434.350	1.675	50	20	IDGD	
Cc1n[nH]c(C)c1CC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)Br)C2	1780827626	WVFOESSWXUSHST-SMNXXWJPSA-N	441.370	1.866	50	20	IDGD	
CC(=O)N[C@@H](C(=O)N1CC[C@@]2(CN(C(=O)[C@@H](F)Cl)CCO2)C1)c1cccc(Cl)c1	1780930259	PRVGXXSQBHQODP-MDZRGWNJSA-N	446.306	1.882	50	20	IDGD	
O=C(Cc1cnc2ccccn12)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781325651	PFZZMGWVKWSWPA-FUHWJXTLSA-N	439.285	1.397	50	20	IDGD	
O=C(c1cc(F)cc([N+](=O)[O-])c1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1781768173	CXTFPVIUHQFVGY-CZUORRHYSA-N	448.220	1.868	50	20	IDGD	
CCC(=O)N[C@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)Br)C1	1781997398	UUCZSFKYTVFDCC-UHQDVWGKSA-N	432.359	1.198	50	20	IDGD	
CC[C@H](O)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](Br)Cc3ccccc3)C2)C1	1783018814	QHFMOIDDIQRCJH-UWVAXJGDSA-N	439.350	1.593	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cc(C)nn3CC)CCO2)C1	1783343353	UPIRFAQJWZSQHM-KBXCAEBGSA-N	427.343	1.828	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H]2[C@@H](C1)[C@@H]2C(=O)N1CC[C@@]2(CN(C(=O)[C@@H](F)Cl)CCO2)C1	1783502196	MXPDOFWFPXGDLF-SUFCVFMQSA-N	445.919	1.464	50	20	IDGD	
COc1cccnc1CCC(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](C)Br)C2)C1	1783530225	VDNZCPMYPARSHU-AUUYWEPGSA-N	440.338	1.636	50	20	IDGD	
Cc1ccc(OCC(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](C)Br)C3)C2)cc1	1783533109	QUJKHPWOAOZUQT-DNVCBOLYSA-N	425.323	1.987	50	20	IDGD	
Cc1cnc2c(C(=O)N3CCO[C@]4(CCN(C(=O)[C@H](C)Br)C4)C3)cnn2c1	1783534199	RCUWOBPICREJKB-UGSOOPFHSA-N	436.310	1.265	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1csc3c1CCCC3)CCO2	1783934997	MXLHWMXGBASYKV-JOCHJYFZSA-N	448.589	1.443	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(-c4cnco4)c3)C[C@@H]21)[C@@H](O)CCl	1784091952	FWMCDCNBGWCECR-DWRORGKVSA-N	433.892	1.535	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(CCN(C(=O)C3=COCC3)C2)C1	1784764301	ZMRJPWOSQINTSZ-OAQYLSRUSA-N	445.428	1.268	50	20	IDGD	
CC(C)Oc1ccc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)cc1C#N	1785192647	JPZWLVFHIVSWHK-UWJYYQICSA-N	435.908	1.389	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3ccc(F)nc3)[C@H]2C1	1785235706	HXVVVARCWREVKF-OEAJRASXSA-N	442.329	1.916	50	20	IDGD	
O=C(C1Cc2ccccc2C1)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1785683399	DSSLKNWQLSQPNP-QFBILLFUSA-N	425.298	1.922	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(Cl)ncn3)C[C@@H]21	1786406142	KUAAVNYFXOTVAB-GVXVVHGQSA-N	431.718	1.508	50	20	IDGD	
C=C[C@H](O)C(C)(C)C(=O)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1	1789492940	OYMVOEDDNBYTAB-FQEVSTJZSA-N	436.317	1.687	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnn4c3OCCC4)C[C@@H]21	1789872660	YABJPRNPJSIMFH-XPVILTJLSA-N	445.347	1.495	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]3C2)cnc1C	1789922557	OWGTVWJITFMZOC-TUUVXOQKSA-N	428.302	1.982	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)c1ccc2ccnn2c1	1790443050	GFICCTSRBQQZQQ-XIRDDKMYSA-N	435.322	1.713	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3ccc(O)cn3)[C@H]2C1	1791710538	FAVDDWCDJWGBCJ-DLLGKBFGSA-N	430.332	1.546	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(F)ccc1Br)C2)[C@@H](O)CCl	1792975626	WQVOBIQEYKUCGN-OWLDWWDNSA-N	449.704	1.391	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCl	1793113825	SXRUFOOLJZMTQR-ZWUHOBOKSA-N	439.852	1.372	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CC(c3ccccc3)=NN1)C2	1793453730	UEFGOPXIXIAOPZ-VYMYIBDJSA-N	432.952	1.750	50	20	IDGD	
CC(C)N1CCC(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@](C)(Cl)CCl)C3)CC1	1793799709	WMWQBGKDIRSMCR-AXVVYFOYSA-N	434.408	1.933	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnoc1C1CC1	1795004821	CIDDWNLGENVQQK-IKVITTDRSA-N	426.311	1.786	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C[C@H](N)c1cccnc1	1795681495	FEDBICNJDUCBML-IWSXDTNSSA-N	439.354	1.235	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H]1CC[C@H](O)CC1)C2	1796893150	LSOZLLDFJBAKCI-HMAARASZSA-N	429.521	1.310	50	20	IDGD	
CC(C)n1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)n1	1798440017	UMUQUQOTVHHMCO-QDMKHBRRSA-N	425.493	1.028	50	20	IDGD	
O=C(CC12CCCN1CCC2)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2	1799214683	RPHOZBZKJGKNKY-OCVGTWLNSA-N	432.334	1.285	50	20	IDGD	
C[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Br)n1cccc1C=O	1799346614	SWXAZAINCNRMPA-AMVBZWJASA-N	430.274	1.142	50	20	IDGD	
Cc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Br)n(C(F)F)n1	1799348910	RXHNUNKWAYRZHE-QCMRWSPLSA-N	439.232	1.480	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN(C)NC(=O)NCc1ccccc1	1799870013	XRCDCJZBYOERKG-FCGDIQPGSA-N	449.983	1.988	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CCCOC1)C2	1800334345	OJXYJLCDQPFEHQ-SQJQVPFXSA-N	445.466	1.888	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1CCC3(CC1)OCCO3)C2	1800762659	WRBRQFCCRZMFIQ-HNKHHVNMSA-N	445.354	1.293	50	20	IDGD	
C[C@@H](Oc1cccnc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@](C)(Cl)CCl)C2	1801404597	XWRDXJUAOPQMQI-HUYPOWGKSA-N	430.332	1.675	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCc1cccc(O)c1	1802552390	UWQYGBKLOZTWRH-BJWYYQGGSA-N	437.500	1.275	50	20	IDGD	
COc1ccc(CC(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@H]2c2cccnc2)cc1O	1802817634	HFOGVRYDRKEHJF-CDXJDZJCSA-N	447.919	1.644	50	20	IDGD	
COc1ccc(OCC(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)cc1	1803136271	AUPINSOAZROFIK-PBEJRMEISA-N	447.919	1.775	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc3cncn3c2)[C@H]1c1cccnc1)[C@H](O)CCl	1803142852	KXKWMWSOZMMBCF-IPELMVKDSA-N	427.892	1.649	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCCc1cccnc1	1803173133	ZDEUURVIANYTML-BCDXTJNWSA-N	436.516	1.355	50	20	IDGD	
CCC(=O)N[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@H]1c1cccnc1	1803434953	YPAXBTBTKZADRO-SHPPOPEUSA-N	443.317	1.693	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1(c2ccccc2F)CC1)c1cccc(B(O)O)c1	1804226220	CXLWHNGSDSHISU-REPLKXPHSA-N	436.292	1.489	50	20	IDGD	
CCOC(=O)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](F)Cl)C2	1804300954	RTFRUTLNYMNXIY-NDKCEZKHSA-N	449.907	1.615	50	20	IDGD	
COC(=O)NCC(=O)N1CC[C@@H](CNC(=O)CCBr)[C@H]1c1cccnc1	1806347079	SGFGRODXBWCSDV-XJKSGUPXSA-N	427.299	1.228	50	20	IDGD	
C=CCC(CC=C)C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1807359301	HQHVXSLZTMHETD-FYYLOGMGSA-N	447.344	1.849	50	20	IDGD	
C[C@@H]1CCC[C@@H]1C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1807361075	GRDJHGISQMMQRR-XEHJXZTKSA-N	435.333	1.517	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@@H](CNC(=O)c2cc(O)nc(O)n2)[C@@H]1c1cccnc1	1808295521	KSRFDQJOYGVYCO-BBRMVZONSA-N	433.896	1.867	50	20	IDGD	
CCn1nc(C(=O)N2CCC3(CCCN(C(=O)c4cccc(B(O)O)c4)C3)CC2)cc1C	1809978111	YTEGEJCOFNDUPP-UHFFFAOYSA-N	438.337	1.050	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2ccc(O)cc2)[C@@H]1c1cccnc1	1811934724	IGBAWJXNJLGBEV-GCJKJVERSA-N	439.516	1.480	50	20	IDGD	
CC(C)=NO[C@H](C)C(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1813073759	SNGMUVCDDWBSBR-PLMTUMEDSA-N	446.552	1.261	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)CCN2CCOC2=O)[C@@H]1c1cccnc1)C(Cl)Cl	1813079284	WXFMGWRCQCKCOT-UKRRQHHQSA-N	429.304	1.733	50	20	IDGD	
O=C1CC[C@@H](C(=O)Nc2cc([C@H]3CCCCN3C(=O)CCBr)[nH]n2)CN1	1814522793	IIBHLASRQVGZNM-DGCLKSJQSA-N	426.315	1.713	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccccc2-n2nccn2)[nH]n1)[C@H](O)CCl	1814873283	UKYDPPLPGKNCKT-IAGOWNOFSA-N	443.895	1.896	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)C(C)(C)NCCC#N)sc2C1	1814985345	FLOROUQNWFYLAA-VXGBXAGGSA-N	427.958	1.591	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)c3[nH]nnc3C)sc2C1	1815944072	MLEAAFZBZUKMLD-BDAKNGLRSA-N	427.328	1.969	50	20	IDGD	
Cc1ccoc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnccc1C(=O)NN)CC2	1817420850	SUPUGMQFHOFWMG-NSHDSACASA-N	440.485	1.583	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)/C=C/c2ccoc2)[nH]n1)c1ccc(B(O)O)cc1	1817470815	HUAMBUFHCZNGNS-QFXLTXBMSA-N	434.261	1.702	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2CCCS2)[nH]n1)c1ccc(B(O)O)cc1	1817475862	XAAPAEWBJICILB-IRXDYDNUSA-N	428.323	1.291	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@H](O)CCl)CC2)c1cc(N2CCCC2)ccn1	1817576722	FGQDNUKNFSKSPX-MLGOLLRUSA-N	449.964	1.964	50	20	IDGD	
CC(C)(C)[C@@H](O)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819401545	GZZBYAHGASHDLJ-RDJZCZTQSA-N	443.508	1.121	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)CN2CCCC2=O)[nH]n1)[C@H](F)Br	1820932332	GEUQRAYYCLKFSR-NHYWBVRUSA-N	430.278	1.715	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnn3c2CCC3)n[nH]1	1821455949	ZJTOLQCCLYZWCO-KRWDZBQOSA-N	442.524	1.231	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)Cc2ccccc2O)n[nH]1	1822012990	ISOXWSWYIMABBT-KRWDZBQOSA-N	442.520	1.723	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC([C@H]2CCCCN2C(=O)CNC(=O)N(C)C)CC1	1823877654	OPDNZELGYXCNKL-GDBMZVCRSA-N	445.402	1.908	50	20	IDGD	
C=CCO[C@H](C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1	1824504928	VZRCKGFTWUOMED-UTKZUKDTSA-N	428.338	1.191	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)c2ccnc(F)c2)CC1	1824720068	INTQKZGVNPHMFX-FQEVSTJZSA-N	439.296	1.448	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)[C@H]3CCNC(=O)C3)sc2C1	1826228796	PRZJNUWGNUTBFC-DCAQKATOSA-N	443.367	1.755	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC([C@@H]2CCCCN2C(=O)CNCP(=O)(O)O)CC1	1826804133	ZFGRTFBMGJECLG-INIZCTEOSA-N	449.561	1.182	50	20	IDGD	
C[C@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1)n1cccn1	1827059628	FCYKJRKGIQSOEI-UTKZUKDTSA-N	438.337	1.057	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccns2)CC1	1828926007	XEQYHKXHRGYTJV-QGZVFWFLSA-N	442.545	1.689	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnnc4ccccc34)C2)C1	1830362385	USUUGDALRADOER-QFIPXVFZSA-N	446.935	1.965	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1C[C@H]1C1CC1)CCO2	1830506328	YGQWIKVRBFQUKZ-CYJAXWMASA-N	429.355	1.662	50	20	IDGD	
O=C([C@H](O)CCl)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CCC[C@@H]4CCCC[C@H]43)C2)C1	1830732069	UFGQTDMCIIKGCT-OPKIRLMFSA-N	442.984	1.649	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)CNC(C)=O)CCO2	1831687334	LRTKIMTZVHOPAL-UZLBHIALSA-N	431.961	1.013	50	20	IDGD	
CS(=O)(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H](F)Br)CC1	1832402154	VBPFUFSIVUQPCE-DZGCQCFKSA-N	441.363	1.731	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)cn1	1833999403	MXBRCNDHELZCTQ-PBHICJAKSA-N	430.274	1.151	50	20	IDGD	
Cc1cccnc1C(=O)N1CCOC[C@]2(CN(C(=O)CCBr)CCO2)C1	1834819642	SHWBUBFMRKAZBT-SFHVURJKSA-N	426.311	1.245	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(CN(C(=O)CCc3ccccc3)CCO2)C1	1834838967	DETPPIUGQKGLDT-JOCHJYFZSA-N	434.609	1.927	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)/C=N/O[C@H]3CCCCO3)CC2)CC1)[C@H](F)Cl	1835083933	AAVKHMZCDHUHFD-BVZKRWNYSA-N	432.924	1.621	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)/C=N/O[C@@H]3CCCCO3)CC2)CC1)[C@H](F)Cl	1835083934	AAVKHMZCDHUHFD-HWPLOXAPSA-N	432.924	1.621	50	20	IDGD	
C=CCO[C@H](C)C(=O)N1CCC(N2CCC(NC(=O)[C@H](F)Br)CC2)CC1	1836413393	FJSVQBHUFRNDSL-CJNGLKHVSA-N	434.350	1.840	50	20	IDGD	
O=C(C1=NO[C@H](c2ccccc2)C1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1836587280	IDNBBGWISQGRRQ-SQGPQFPESA-N	439.871	1.495	50	20	IDGD	
O=C(c1cc2cccn2cn1)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836717173	LLQPZMWWTYMYAB-LJQANCHMSA-N	434.924	1.546	50	20	IDGD	
C=CC[C@H](C(=C)C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1837311078	YSKHYDKZQURQLS-RKVPGOIHSA-N	433.318	1.902	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCC(OC2CCN(C(=O)CCn3cncn3)CC2)CC1	1838637766	CVABCNKYKWVPLQ-IBGZPJMESA-N	446.379	1.903	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccc4c(c3)OCO4)C2)C1	1839143785	HZJBKJMHSIWIEC-IERDGZPVSA-N	438.908	1.432	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4c(c3)CNC4=O)C2)C1	1839145987	SNVUJYNIUDFAIR-UWJYYQICSA-N	435.908	1.017	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(Cl)c(O)cc3O)CCO2)C1	1839251706	GSMYYCCINXFFSM-BFUOFWGJSA-N	447.315	1.839	50	20	IDGD	
Cc1cc2cc(C(=O)N3CCO[C@@]4(COCCN(C(=O)[C@@H](O)CCl)C4)C3)ccc2[nH]1	1839614403	DQSWXENBAMTDEK-RXVVDRJESA-N	435.908	1.146	50	20	IDGD	
C/C=C/C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1	1839814724	FXHIMYDQDSIKQG-YEFOHOTDSA-N	447.444	1.166	50	20	IDGD	
O=C(Cc1ccc2c(c1)CCO2)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1839998431	VQSKNRZAGRMOFT-ICSRJNTNSA-N	426.872	1.155	50	20	IDGD	
Cc1cccc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)c1	1840032057	MQOCWUQTQWRNOU-JXFKEZNVSA-N	439.350	1.777	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3ccc(C)cc3)C2)C1	1840156443	SIUJJUXUSOKDSG-DENIHFKCSA-N	438.952	1.638	50	20	IDGD	
O=C([C@@H]1CCCSC1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1840865303	MVYSHZKLRGUNML-DVOMOZLQSA-N	439.347	1.277	50	20	IDGD	
COc1cc(/C=C/C(=O)N2CC3(CCCN3C(=O)[C@@H](O)CCl)C2)cc(OC)c1OC	1841353581	FNFBFVNJVJAQMT-NFAHFFEMSA-N	438.908	1.529	50	20	IDGD	
CC(C)(C)NCC(=O)N1CCCC12CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1842902301	ZYVPEKHLYPSOAX-AWEZNQCLSA-N	430.977	1.710	50	20	IDGD	
O=C(c1cc(-c2ccccc2)on1)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843009758	FQECSMSTTIYKKA-UHFFFAOYSA-N	431.257	1.152	50	20	IDGD	
O=C([C@H]1C[C@@H]1c1ccc(Cl)cc1)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843013946	HGEJYTXQGPOQNX-UXHICEINSA-N	438.720	1.641	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2ccc3n[nH]cc3c2)C1	1843255173	CQCUPQMQLNVNKW-AFUMVMLFSA-N	433.472	1.514	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC2(CCCN2C(=O)c2cc3n(n2)CCCNC3=O)C1	1843999106	CFWLVRMSLXRPLB-QGZVFWFLSA-N	428.320	1.070	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2ccc3nc[nH]c3c2)C1	1844052674	BULGGDFZGOPCHN-VULFUBBASA-N	433.472	1.514	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC12CN(C(=O)c1cc(Cl)c3nncn3c1)C2	1846177450	PXIBGDBZTXTGQY-SNVBAGLBSA-N	426.702	1.983	50	20	IDGD	
Cc1cc(C(=O)N2CC3(CCCN3C(=O)CCC(=O)NN(C)C)C2)n(-c2ccccc2)n1	1846384880	UZQJZHZZXIUBOR-UHFFFAOYSA-N	438.532	1.371	50	20	IDGD	
COC(=O)c1ccc(OCC(=O)N2CCCC23CN(C(=O)CCBr)C3)cc1	1847146418	OIBGESHUHADDDD-UHFFFAOYSA-N	439.306	1.840	50	20	IDGD	
C[C@H]1[C@@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](O)CCl)CCN1C(=O)OC(C)(C)C	1847568694	ISZDZFIUMHVTAR-QXKUPLGCSA-N	429.945	1.433	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CNC(=O)c1cccs1	1848219950	MCYWAIASYGWMJO-AGIUHOORSA-N	428.352	1.853	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)[C@H](C)NS(=O)(=O)c2ccc(Cl)cc2)cc1C	17203919	RTBLOASJQHMXLI-AWEZNQCLSA-N	439.921	1.850	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)CNC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)cc1	21161904	POPUBYMIZPIVIO-UHFFFAOYSA-N	448.819	1.291	50	20	IDGD	
CC(C)CC(=O)NNC(=O)c1ccc(Cl)c(S(=O)(=O)N2C[C@H](C)O[C@H](C)C2)c1	22699051	QTQKMJNONYVHJJ-BETUJISGSA-N	431.942	1.945	50	20	IDGD	
CCNS(=O)(=O)c1ccc(C)c(C(=O)NNC(=O)c2cc(Br)c[nH]2)c1	24124348	PSPKKNQCXKBDKL-UHFFFAOYSA-N	429.296	1.459	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2ccc3c(c2)CCN3S(C)(=O)=O)cc(OC)c1OC	45573738	PGNVTSQJLLLDKE-UHFFFAOYSA-N	449.485	1.109	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)C1=NN(Cc2ccc(F)cc2)C(=O)CC1	71925242	BKKBZBAJWJIIEE-UHFFFAOYSA-N	436.241	1.856	50	20	IDGD	
O=C(NNC(=O)c1ccccc1S(=O)(=O)N1CCCCC1)c1ccc2c(c1)OCCO2	105310483	NRQWQBXNTYUQOT-UHFFFAOYSA-N	445.497	1.707	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)Cn2cnc3ccc(Br)cc3c2=O)cc1	110883266	CJJMYJIPOINXBC-UHFFFAOYSA-N	444.289	1.727	50	20	IDGD	
Cc1cc(C)n(-c2ccc(C(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)cc2F)n1	303472596	QZVLGHJNNQQZAP-UHFFFAOYSA-N	434.431	1.950	50	20	IDGD	
CC(C)NC(=O)C(=O)NNC(=O)[C@@H]1C[C@H]2CCCC[C@@H]2N1C(=O)c1ccc(Cl)cc1	726155799	BONFXNDLKIICPW-PVAVHDDUSA-N	434.924	1.785	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@@H](C(=O)NNc3nc(-c4ccncc4)no3)C2)cc1	728072079	RVYWABFNDNXWMW-MRXNPFEDSA-N	442.501	1.984	50	20	IDGD	
CN(C)N(C(=O)CSc1nnc(-c2ccc(Cl)cc2)o1)[C@@H]1CCS(=O)(=O)C1	728180061	NBVHRYGJQJTOIO-CYBMUJFWSA-N	430.939	1.974	50	20	IDGD	
O=C(NNC(=O)c1ccc(OCC(F)(F)C(F)F)nc1)c1ccc(-n2cnnn2)cc1	729298950	IGSOLDXYRIFEPI-UHFFFAOYSA-N	439.329	1.411	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2cccc(Br)c2O)c2ccccc2c1=O	730103478	DDKIWXULRMIZKO-UHFFFAOYSA-N	431.246	1.959	50	20	IDGD	
COC1CCN(C2(CNC(=O)NNC(=O)[C@@H]3COc4ccccc4O3)CCCC2)CC1	730914492	QICITNRQQXBEHJ-IBGZPJMESA-N	432.521	1.580	50	20	IDGD	
CCCC[C@H](/N=C1/NS(=O)(=O)c2ccccc21)C(=O)NNC(=O)c1ccccc1OC	731493970	FKCOFMNJUQBZEM-INIZCTEOSA-N	444.513	1.754	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)CS(=O)(=O)NC1CCC(C)CC1	731597967	YZFCQYHOCSXHLL-UHFFFAOYSA-N	435.550	1.244	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CCn2nnc3ccccc3c2=O)cc1Br	732035561	JMDUDDDLOGCPQB-UHFFFAOYSA-N	446.261	1.414	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NC[C@H](C)N(C)Cc2ccccc2)nc1	732469412	DRKXWBKJMCSWTI-INIZCTEOSA-N	434.566	1.915	50	20	IDGD	
CC[C@@H](Cc1ccccc1)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	732727041	VWUGLDVFVKARBX-SFHVURJKSA-N	445.541	1.737	50	20	IDGD	
C[C@H](NC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)c1cccc(O)c1	732889099	KEGGVIHSLKJWRP-AWEZNQCLSA-N	434.522	1.111	50	20	IDGD	
CCCC[C@@H](NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)C(=O)Nc1cc(C)on1	732917717	FSLJMAOTOJQZFL-MRXNPFEDSA-N	437.522	1.665	50	20	IDGD	
COCCS(=O)(=O)c1ccc(C(=O)NNC(=O)NCc2ccc(Cl)cc2)cc1	733004512	LTIWIQQFBJHZMO-UHFFFAOYSA-N	425.894	1.904	50	20	IDGD	
CC(C)C[C@H](C(=O)NNC(=O)c1cnn(-c2ccccc2)c1)N1C(=O)[C@@H]2CC=CC[C@H]2C1=O	733108922	YUTLTYSFOFJDFX-VAMGGRTRSA-N	449.511	1.999	50	20	IDGD	
Cc1nc(CN2CCN(C(=O)NNC(=O)c3cnn(-c4ccccc4)c3)CC2)cs1	733348903	UJLZAOZWVOMITR-UHFFFAOYSA-N	425.518	1.809	50	20	IDGD	
CN(C)CC(=O)NNC(=O)c1ccc(I)c(Br)c1	733359213	HTJSYVPYZUAPJO-UHFFFAOYSA-N	426.052	1.376	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCC(C(=O)NNc3nccnc3Cl)CC2)cc1	734261144	WVCNWLCANNRVTB-UHFFFAOYSA-N	425.898	1.683	50	20	IDGD	
CC[C@@H](C)[C@H](NC(=O)N1CCCC1)C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	736073062	AQGADFRTNWXDCA-KDOFPFPSSA-N	437.566	1.791	50	20	IDGD	
O=C(NCc1cc(F)ccc1N1CCOCC1)NNC(=O)c1ccc2c(c1)OCCO2	740920691	MTVQLAXHNUFNLD-UHFFFAOYSA-N	430.436	1.578	50	20	IDGD	
O=C(CCS(=O)(=O)c1ccc2c(c1)OCCCO2)NNC(=O)Cc1ccccc1F	741187099	JAJRUUQJAQQZDZ-UHFFFAOYSA-N	436.461	1.541	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)c2cccc3ccccc23)cc1	741655910	MZNDMEMGANSPHN-UHFFFAOYSA-N	433.511	1.713	50	20	IDGD	
CN(CC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)Cc1ccc(N2CCOCC2)cc1	741732653	HJIPVWDYJVXZCT-UHFFFAOYSA-N	427.461	1.324	50	20	IDGD	
Cc1oc(-n2cccc2)c(C#N)c1C(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	742595711	VEKUMFVSFOGNCL-UHFFFAOYSA-N	437.368	1.777	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)Cc2ccc(C(=O)NNC(=O)Cc3cc[nH]n3)cc2)cc1	743289524	XZDLSKGAYKSYAG-UHFFFAOYSA-N	441.513	1.543	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)c2ccc(N3CCCS3(=O)=O)cc2C)cc1	743296088	GRLGXXXDBDHADR-UHFFFAOYSA-N	432.502	1.417	50	20	IDGD	
CCN(CC)c1ccc(CNC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)cn1	743551258	RAFALQNQOLBLRH-UHFFFAOYSA-N	434.522	1.867	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)Cn2c(=O)n(C)c3ccccc32)cc1Cl	743833851	JJKKTSOLWVOVNS-UHFFFAOYSA-N	433.852	1.864	50	20	IDGD	
CCc1c(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)[nH]c(C)c1C(C)=O	744620251	HFZBAWWSKPDCNA-UHFFFAOYSA-N	434.518	1.866	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)[C@H](C)Cc1c(C)nn(C)c1C	745273095	OEWRFTJGFKCGQM-LLVKDONJSA-N	436.896	1.882	50	20	IDGD	
Cn1ccc(N2CCC[C@H](NC(=O)NNC(=O)c3ccc(Cl)cc3Cl)C2=O)n1	745881799	BSTLHUXQWUOXAI-ZDUSSCGKSA-N	425.276	1.867	50	20	IDGD	
Cc1ccc(C)n1-c1ccc(C(=O)NNC(=O)N[C@@H]2CCCN(c3ccn(C)n3)C2=O)cc1	745883590	QESVCEADYSQHLJ-LJQANCHMSA-N	449.515	1.967	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)N[C@H]2C[C@@H](C)N(c3cnn(C)c3)C2=O)cc1	745919325	SCZYEQNEHCIQCN-LBTNJELSSA-N	444.492	1.111	50	20	IDGD	
O=C(COC[C@@H]1CCCO1)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	746386285	NVXJXDRDVGYGRH-SFHVURJKSA-N	447.513	1.122	50	20	IDGD	
CCC(CC)[C@@H](CCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)OC	747457840	ZCUHLVAWYVBCGI-QGZVFWFLSA-N	428.555	1.722	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(CCNC(=O)NNC(=O)Cc2ccncc2)s1	747500473	JZBZLLYUZTWGAO-UHFFFAOYSA-N	439.563	1.289	50	20	IDGD	
Cc1oc(C(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)cc1S(N)(=O)=O	748521384	PBUAQUKWRSCCFC-UHFFFAOYSA-N	427.382	1.286	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)N[C@H]1CCN(c2ccccc2Br)C1	748629265	CLNULRLAEZAADD-STQMWFEESA-N	429.315	1.410	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NC[C@@]2(N(C)C)CCSC2)cc1Br	748646950	JKYIVHPGTLKBFV-INIZCTEOSA-N	431.356	1.839	50	20	IDGD	
Cc1cc(C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)cc(S(N)(=O)=O)c1C	748828829	MQEFYZSAWMBOBB-UHFFFAOYSA-N	438.456	1.878	50	20	IDGD	
CCS[C@@H]1CCC[C@@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)C1	748964765	CSPDNCCZZSJVOK-HUUCEWRRSA-N	428.580	1.945	50	20	IDGD	
O=C(NNC(=O)c1cccc(F)c1I)C(=O)Nc1ccccn1	750404305	QKWGYGAVRVXURQ-UHFFFAOYSA-N	428.161	1.225	50	20	IDGD	
O=C(CC1CCCCC1)NC1CCC(C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)CC1	751362813	RFXYHWWJVZDGTN-JCYILVPMSA-N	442.582	1.149	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)[C@@H]2CC(=O)N(CCOc3ccccc3Cl)C2)c1	751888233	DBZBSXDKGKJBLB-MRXNPFEDSA-N	426.860	1.900	50	20	IDGD	
CC(C)[C@H]1OCCC[C@H]1CNC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	753033672	FNFSTMLWDZPYNQ-SIKLNZKXSA-N	431.581	1.980	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)Nc2nnc(C)n2C)cc1	753128096	PHNRFGIMGZRSEZ-GDNBJRDFSA-N	434.460	1.417	50	20	IDGD	
Cc1c(C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c(=O)oc2ccccc12	754614127	NGDPAYHYMOQFLU-UHFFFAOYSA-N	425.353	1.628	50	20	IDGD	
Cc1ccc(C(=O)Nc2ccccc2)cc1NC(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1	755825339	DLJSZLTWIFESSO-HNNXBMFYSA-N	430.486	1.835	50	20	IDGD	
O=C(NNC(=O)N1CCC[C@H]1Cn1cnc2ccccc21)c1ccc(-n2cnnn2)cc1	756051168	SCAXEXMFNBAHAH-KRWDZBQOSA-N	431.460	1.531	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2cccc(Cn3cncn3)c2)c1	756149761	KJZVPESOVWVPTB-UHFFFAOYSA-N	443.489	1.043	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)Nc2ccn(CCc3ccncc3)n2)c2ccccc2c1=O	756730200	MFPBDIBBLYJWQP-UHFFFAOYSA-N	432.444	1.234	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)[C@](C)(O)CN1Cc2ccccc2C1=O	756795413	ALOYMBMERHNAMF-HSZRJFAPSA-N	435.484	1.153	50	20	IDGD	
O=C(Cc1csc(N2CCOCC2)n1)NN=Cc1cc(O)c(O)c(Br)c1	757568830	NZORWTWYVSGRIZ-UHFFFAOYSA-N	441.307	1.846	50	20	IDGD	
COc1ccc(C[C@@H](C)C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1	758076349	SPTOLJCGRPBZNU-LLVKDONJSA-N	425.894	1.636	50	20	IDGD	
CCOCCCn1c(NNC(=O)C(C)(C)NC(=O)C(F)(F)F)nc2ccccc2c1=O	760329277	JWJFKENJMIFXRR-UHFFFAOYSA-N	443.426	1.723	50	20	IDGD	
O=C(NNS(=O)(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)NC1CCCC1	760343475	VVFDZMWYNLEMAN-UHFFFAOYSA-N	430.552	1.296	50	20	IDGD	
O=C(CCCC[C@@H]1SC[C@H]2NC(=O)N[C@H]21)NNC(=O)c1cc(-c2ccccc2)[nH]n1	762937965	OCWBRLQJZAXWMJ-SOLBZPMBSA-N	428.518	1.564	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cccc(C3OCCO3)c2)c1	763378915	LQLRRWVFHMSGRT-UHFFFAOYSA-N	447.513	1.837	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNS(=O)(=O)c1cc(Cl)ccc1[N+](=O)[O-]	763438556	BONLCNLAWTWZAM-UHFFFAOYSA-N	436.874	1.863	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2ccccc2Br)ccc1NC(C)=O	763483184	OSEONTOHLZGWQY-UHFFFAOYSA-N	449.261	1.816	50	20	IDGD	
CN(C)CCc1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2Br)cc1	763483882	VZCXEAWXQBOYBW-UHFFFAOYSA-N	433.306	1.953	50	20	IDGD	
O=C(NNC(=O)c1c[nH]c2ccccc12)C(=O)Nc1ccc(CN2C(=O)CCC2=O)cc1	763541014	NMLBFUKIXJXURW-UHFFFAOYSA-N	433.424	1.217	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cn(-c3ccccc3)nc2-c2ccccc2)nn1C	763601296	KMXPMLNLGBCCHX-UHFFFAOYSA-N	443.467	1.981	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2cccc([C@@H](C)N3CCOCC3)c2)c1	763619428	WPXSNRZYURLXBY-QGZVFWFLSA-N	440.500	1.553	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccccc2O[C@H]2CCOC2)cc1	763661318	MUDIGXWQLBZNEY-INIZCTEOSA-N	429.429	1.028	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc2c(cc1Cl)OCCO2	763712524	JBJWORDTMXMLBT-UHFFFAOYSA-N	433.848	1.839	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(NC(C)=O)ccc2C)cc1OC	763903698	SFVUNZNPIMUEBA-UHFFFAOYSA-N	428.445	1.760	50	20	IDGD	
NC(=O)COc1cccc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCCCC3)c1	763968486	PQVFCXPPHPRGOM-UHFFFAOYSA-N	430.486	1.281	50	20	IDGD	
CCOc1ccc(C(=O)N2CCCCC2)cc1NC(=O)C(=O)NNC(=O)c1cccn1C	763992249	BGGMAYCQTOLEJD-UHFFFAOYSA-N	441.488	1.450	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)C(=O)Nc1cccc(COC2CCCCC2)c1	763996922	HBOSDIGCGPLVIU-OAHLLOKOSA-N	437.518	1.057	50	20	IDGD	
Cc1ccc(Oc2ccc(NC(=O)C(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)cc2)cc1	763998259	NXKBGSJHGGSCBQ-CQSZACIVSA-N	431.470	1.308	50	20	IDGD	
C[C@@H]1Oc2ccc(NC(=O)C(=O)NNC(=O)Cc3cccc4ccccc34)cc2NC1=O	764035794	IGCJZBGGTPWFQF-ZDUSSCGKSA-N	432.436	1.888	50	20	IDGD	
CS(=O)(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2cccc(C(F)(F)F)c2)c1	764040863	ORMCYKDQIDFTRF-UHFFFAOYSA-N	429.376	1.509	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)ccc1C(=O)NC(C)C	764126014	DQJLEXGGUDMKSR-UHFFFAOYSA-N	432.864	1.892	50	20	IDGD	
C[S@](=O)Cc1cc(NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)ccc1Cl	764163476	JKSNRDIGLCOJSX-BCOMRZATSA-N	435.889	1.308	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1)C(=O)Nc1ccc(F)nc1	764179425	SZNYOYGRMKOFHD-FQEVSTJZSA-N	447.470	1.934	50	20	IDGD	
CCn1nc(C)c(NC(=O)C(=O)NNC(=O)c2cc(OC)ccc2Br)c1C	764231976	LAOHLNJFUGEXEH-UHFFFAOYSA-N	438.282	1.691	50	20	IDGD	
CN1CCCN(c2ccc(NC(=O)C(=O)NNC(=O)c3cccc4ncccc34)cc2)CC1	764260226	MRNNFPQMLMMUQJ-UHFFFAOYSA-N	446.511	1.776	50	20	IDGD	
Cc1nc(-c2cccc(NC(=O)C(=O)NNC(=O)c3cccc(OC(F)F)c3)c2)n[nH]1	764260368	WLQACTXXDGDPTP-UHFFFAOYSA-N	430.371	1.781	50	20	IDGD	
CC(=O)N1CCCc2cc(NC(=O)C(=O)NNC(=O)c3cccc(OC(F)F)c3)ccc21	764260447	ZADOESWMURLRTI-UHFFFAOYSA-N	446.410	1.987	50	20	IDGD	
COC(=O)c1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)c1ccc(O)c(Cl)c1	764348940	ANSMMSPNORRKTG-UHFFFAOYSA-N	426.212	1.885	50	20	IDGD	
Cc1cnn(-c2ccc(NC(=O)C(=O)NNC(=O)COCc3ccccc3)cc2F)c1	764367231	KSBYWSLRCCYXMN-UHFFFAOYSA-N	425.420	1.623	50	20	IDGD	
C[C@@H](NC(=S)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1)c1cccs1	764518503	FUARAZKOEQFFDS-OAHLLOKOSA-N	431.587	1.762	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2cccc(N(C)C)n2)c1	764725961	ABJBRQSHCHVVSG-UHFFFAOYSA-N	434.522	1.645	50	20	IDGD	
Cc1c(Br)cc(C(=O)NNC(=O)CSc2ccccc2O)c(=O)n1C	765010135	AXTRECHGMMMIIJ-UHFFFAOYSA-N	426.292	1.715	50	20	IDGD	
O=C(COC(=O)CCc1cncc2ccccc12)NNC(=O)[C@H]1COc2ccccc2O1	765571000	WTVWUJVPPFOWBK-HXUWFJFHSA-N	435.436	1.698	50	20	IDGD	
CC(C)Oc1cccc(CC(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)c1	765735373	LESLYWVIALVYNY-UHFFFAOYSA-N	438.528	1.622	50	20	IDGD	
Cc1noc(C)c1S(=O)(=O)N1CCC(C(=O)NNc2cnc3ccccc3n2)CC1	765989443	JXYGJLQTTMPNLY-UHFFFAOYSA-N	430.490	1.779	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1cccc(Cl)c1[N+](=O)[O-]	766653293	SBWJMHZECUXUFW-UHFFFAOYSA-N	445.863	1.467	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)c1ccc(Cl)c(S(C)(=O)=O)c1	767268041	AQAZNRNZEVZSHD-UHFFFAOYSA-N	438.889	1.599	50	20	IDGD	
COCc1c(C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)cnn1-c1ccccc1	767743387	SORKBJVKLYYTJT-UHFFFAOYSA-N	433.424	1.508	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(S(=O)(=O)CBr)CC2)cc1N(C)C	767850437	KGFRMHDAGISYKX-UHFFFAOYSA-N	440.385	1.050	50	20	IDGD	
COc1ccc(CN2CCCN(CC(=O)NNC(=O)c3cccc(Cl)c3)CC2=O)cc1	767931557	NGZRXNNWZWPYJO-UHFFFAOYSA-N	444.919	1.844	50	20	IDGD	
CN(c1ccccc1)S(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=O)C(C)(C)O)c1	768260576	GAWLRBLJWHSPBL-UHFFFAOYSA-N	425.894	1.697	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc2nc(O)[nH]c2cc1Br)NC1CCCCC1	768497932	UKDUCEUOEDFABD-UHFFFAOYSA-N	432.300	1.856	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)c2nnn(Cc3ccc(F)cc3)c2C)cc1	769553078	OFJHFTVIKOFZQA-UHFFFAOYSA-N	425.420	1.700	50	20	IDGD	
N#Cc1ccc(N2CCN(CC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)CC2)c(Cl)c1	769921723	UEYNOLFZBRCEFW-UHFFFAOYSA-N	442.863	1.703	50	20	IDGD	
CC(=O)N1CCN(S(=O)(=O)c2cccc(C(=O)OC[C@@H](C)CBr)c2)CC1	770326043	RJQTURVDPGOZEH-ZDUSSCGKSA-N	447.351	1.727	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)N[C@@H]1CCCN(c2ccn(C)n2)C1=O	770567244	ITKFJUGBJVEIGE-IUODEOHRSA-N	434.884	1.367	50	20	IDGD	
CC(C)(C(=O)OCC(=O)NNC(=O)c1ccc(Cl)cc1)N1C(=O)c2ccccc2C1=O	770645801	UGFUKDMZEXPQCH-UHFFFAOYSA-N	443.843	1.719	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)N1CCC(Oc2ccnc(C(N)=O)c2)CC1	771904454	KJZSQHWAJOTIJT-UHFFFAOYSA-N	437.460	1.034	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1cc(S(=O)(=O)NC(C)(C)C)ccc1Cl	772183484	YGTHCDYYJCWOMT-JTQLQIEISA-N	433.914	1.520	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)N[C@@H](c1ccc(F)c(Cl)c1)C(F)(F)F	772628409	MVKLLSFJCHCYNT-WKEGUHRASA-N	434.799	1.351	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)[C@@H](C)NS(=O)(=O)c1cccs1	772965353	XIIUPETWPZBDOV-MNOVXSKESA-N	431.923	1.683	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)c2nnn(-c3ccc(OC(F)F)cc3)c2C)c1	773086813	FYWFYAVJDGDEOO-UHFFFAOYSA-N	445.386	1.605	50	20	IDGD	
COc1ccc(SC)c(OC)c1C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	775715233	UUKYYUZBPMJGTF-UHFFFAOYSA-N	431.518	1.893	50	20	IDGD	
Nc1nc(Cl)cc(NNC(=O)[C@H]2CCN(c3cccc(Br)c3)C2=O)n1	779373675	USRCVAUGYBJXJG-SNVBAGLBSA-N	425.674	1.971	50	20	IDGD	
COc1cc(N2C[C@H](C(=O)NNc3cc(Cl)nc(N)n3)CC2=O)cc(OC)c1OC	779374762	DVMPVNLJFDFSCE-SECBINFHSA-N	436.856	1.234	50	20	IDGD	
O=C(NNc1ccc(Br)cc1F)C(=O)Nc1cc(-n2cnnn2)ccc1F	783080009	FODWCICUGSHXRI-UHFFFAOYSA-N	438.192	1.785	50	20	IDGD	
NC(=O)CCOc1ccc(NC(=O)C(=O)NNc2ccc(Br)cc2F)cc1	783081169	NQHGLZSDDGQEQB-UHFFFAOYSA-N	439.241	1.924	50	20	IDGD	
COC(=O)CNC(=O)c1ccc(NC(=O)C(=O)NNc2nccc3sccc23)cc1	783436198	VTEVRSUVGANMIM-UHFFFAOYSA-N	427.442	1.281	50	20	IDGD	
Cc1cn2cc(NC(=O)C(=O)NNc3ccccc3S(=O)(=O)NC(C)(C)C)ccc2n1	784834231	YGKFKCQVTJYBKU-UHFFFAOYSA-N	444.517	1.801	50	20	IDGD	
O=C(Cn1cc(NC(=O)C(=O)NNc2cccc(C(F)(F)F)n2)cn1)NC1CCCC1	784951506	NNTAZCPIIIEALT-UHFFFAOYSA-N	439.398	1.438	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)Nc1ccc(OC(F)F)c(F)c1	785023770	PNJIZDRWQYODEQ-UHFFFAOYSA-N	428.279	1.441	50	20	IDGD	
COCCn1ccc2ccc(NC(=O)C(=O)NNC(=O)Cc3cn4ccccc4n3)cc21	785059967	FBIVJNZAUILKRX-UHFFFAOYSA-N	434.456	1.264	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc(C(N)=O)c(C)c3)n[nH]2)c1	785131447	ZGXVRAFRTXZBGY-UHFFFAOYSA-N	434.456	1.501	50	20	IDGD	
O=C(NNc1nc(C(F)(F)F)cs1)C(=O)Nc1ccccc1CN1CCNC1=O	785146403	VFKPGJZAYIZROU-UHFFFAOYSA-N	428.396	1.769	50	20	IDGD	
COc1cc(F)cc(NNC(=O)C(=O)Nc2cccc(CN3CCN(C(C)=O)CC3)c2)c1	785234630	NXLSFTNEMSDHRO-UHFFFAOYSA-N	443.479	1.580	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1ccc(-c2ncco2)cc1	785330482	IVLBINUDFCGWDL-UHFFFAOYSA-N	430.442	1.836	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1ccc(N2CCCC2=O)cc1	785331267	RKFQWPQGPDYHGS-UHFFFAOYSA-N	446.485	1.307	50	20	IDGD	
C[C@H](C(=O)OCC(=O)NNC(=O)c1cccc(C#N)c1)C1CN(C(=O)OC(C)(C)C)C1	786985762	PJZZHZJLMZCENO-ZDUSSCGKSA-N	430.461	1.365	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCc2ncnn2-c2ccccc2)c2ccccc2c1=O	787348151	MYMRYZOPRVOKDC-UHFFFAOYSA-N	432.444	1.141	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)NNC(=O)[C@@H]1C[C@@H](O)CN1C(=O)OCc1ccccc1	787423743	FDCLTBRLYMNXEP-MSOLQXFVSA-N	446.891	1.942	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cccc(N3CCNC3=O)c2C)c2ccccc2n1	787541044	JTYQCQPIMVGHOZ-UHFFFAOYSA-N	446.467	1.781	50	20	IDGD	
Cc1cc(F)cc(-n2cc(C(=O)OCC(=O)NNC(=O)Cc3ccccc3C)nn2)c1	789056471	FFWQMJXENBOABX-UHFFFAOYSA-N	425.420	1.570	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc3c2OCC[C@@H]3N(C)C)c(OC)c1	789734647	MPEGWXRLMQTTIZ-KRWDZBQOSA-N	442.472	1.489	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cc([C@H]3CCCO3)nn2C)cc1OC	789741494	WOAWJAXIDGECMB-OAHLLOKOSA-N	445.476	1.469	50	20	IDGD	
C[C@H]1CCC2=S=C(C(=O)NNC(=O)C(=O)Nc3cc([C@H]4CCCOC4)nn3C)C=C2C1	790951580	JHZOWXGYNDBZCG-STQMWFEESA-N	445.545	1.238	50	20	IDGD	
COCCOC1CCC(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)CC1	793594205	VWYCGCPPYHEDKI-UHFFFAOYSA-N	441.550	1.372	50	20	IDGD	
CCOc1ccc([C@@H]2C[C@H]2NC(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1	798048116	IARRAJXDWPWVID-JKSUJKDBSA-N	431.518	1.879	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@@H]2C(=O)NNC(=O)c2ccc(OC)c(OC)c2)cc1	798349396	ZSYLVLMXLNOBBC-QGZVFWFLSA-N	427.457	1.778	50	20	IDGD	
COC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c1OC(C)C	799257869	TXAUSIARIXSPJK-UHFFFAOYSA-N	444.400	1.568	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2CN(C(=O)OC(C)(C)C)CCC2(F)F)cc1	801109759	AMCKIZIHBQUFKZ-CQSZACIVSA-N	440.447	1.973	50	20	IDGD	
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC(C(=O)NNc2ccc3c(=O)[nH]ccc3c2)CC1	803433139	OZLBOIJEMWGFHR-UHFFFAOYSA-N	444.517	1.412	50	20	IDGD	
O=C(CCc1nc(O)c2cnn(-c3ccccc3)c2n1)NNc1ccc(-n2ccnc2)nn1	804956590	UTWWWGNGGXJGDW-UHFFFAOYSA-N	442.443	1.573	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1cc(F)c(Br)c(Cl)c1	806721286	FZEOHHBFVXZBIO-RXMQYKEDSA-N	431.671	1.332	50	20	IDGD	
Cc1ccc(F)c(NNC(=O)C(=O)N2C[C@H](C[C@H]3COCC(=O)N3)c3ccccc32)c1	807014015	NYYJLZYSJGBCLW-GJZGRUSLSA-N	426.448	1.613	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3ccc(C(N)=O)c(Cl)n3)n[nH]2)cc1OC	807083688	CHTGNAFNFLOLPV-UHFFFAOYSA-N	444.835	1.316	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC[C@@H]2C)c1	807371419	LDZWVHWFPLODLH-HNNXBMFYSA-N	441.550	1.800	50	20	IDGD	
Cc1cc([N+](=O)[O-])ccc1NNC(=O)C(=O)Nc1ccc(N2C[C@H](C)O[C@H](C)C2)nc1	807455130	FWAVHGWXCJXUFG-OKILXGFUSA-N	428.449	1.994	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)NC1C[C@@H]2CC[C@H](C1)N2CC(=O)N(C)C	807513194	JVZNCISQALORJC-MQVJKMGUSA-N	449.577	1.201	50	20	IDGD	
COc1nnccc1NC(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	808901968	HKCQMCOEFJUFOV-UHFFFAOYSA-N	445.439	1.710	50	20	IDGD	
CCOc1cc(Br)c(F)cc1NC(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O	810339935	TXHHMOCCBZUAQQ-SSDOTTSWSA-N	441.279	1.077	50	20	IDGD	
Cc1cc(OCc2ccc(C(=O)NNC(=O)C(=O)Nc3cnnn3C)cc2)ccc1Cl	810384650	IEGCSEXVIWRDOX-UHFFFAOYSA-N	442.863	1.756	50	20	IDGD	
N#Cc1ccc(S(=O)(=O)NCC(=O)NNc2ccc(F)cc2Br)cc1	810681935	PPFBCYBFAQXWTO-UHFFFAOYSA-N	427.255	1.881	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)OCc2cnn(C)n2)cc1	811048809	CONMYBGRARTBIP-OQLLNIDSSA-N	435.444	1.213	50	20	IDGD	
O=C(NNC(=O)c1ccoc1)C(=O)Nc1ccc2c(c1)N(C(=O)Cc1ccccc1)CC2	815568763	SYQQFMHJYRSTAQ-UHFFFAOYSA-N	432.436	1.811	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2cc(C)c([N+](=O)[O-])cc2F)cc(OC)c1OC	821124143	OKDJPPJTPNYMLY-UHFFFAOYSA-N	443.409	1.691	50	20	IDGD	
O=S(=O)(NCc1ccc(S(=O)(=O)N2CCOCC2)cc1)c1ccc(CCl)cc1	913859394	SKDWCUOAEMKBRP-UHFFFAOYSA-N	444.962	1.925	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)CCCc2nc3ccccc3[nH]2)c1	914846231	DMPDEYYUPQKJGB-UHFFFAOYSA-N	429.502	1.597	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2CCCN(C(=O)Cc3ccccc3)C2)cc1C	914882046	RCIMCNRONRUJRE-IBGZPJMESA-N	436.512	1.871	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2cccs2)[nH]n1)c1cccc(S(=O)(=O)N2CCCC2)c1	915686211	YDUWFJYKQWVFPB-UHFFFAOYSA-N	445.526	1.998	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)NCCNC(=O)C(C)C)c2ccccc2c1=O	915907058	ZFURIFOBMWQKEW-UHFFFAOYSA-N	430.509	1.303	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NCc2ccccc2CS(=O)(=O)NC(C)C)cc1	916228498	DSEXOEXTONEZAI-UHFFFAOYSA-N	448.545	1.732	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)NC1CCN(S(C)(=O)=O)CC1	916237701	FFWSPPLJJBWCPV-AWEZNQCLSA-N	434.518	1.362	50	20	IDGD	
Nc1cc(C(F)(F)F)ccc1C(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	916540535	WAHGPTGRDPGRIR-UHFFFAOYSA-N	426.307	1.814	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2cc(C(=O)NNC(=O)C(C)(C)C)ccc2Cl)C[C@H](C)O1	917182653	QNFDFYAVVHKZNY-RYUDHWBXSA-N	431.942	1.945	50	20	IDGD	
CC(=NNC(=O)c1ccc(CN(C)C)o1)c1ccc(S(=O)(=O)NCCCN(C)C)cc1	917544173	YMPCAUQSZZNXPD-UHFFFAOYSA-N	449.577	1.725	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCCn2ccnc2C)c1	918224441	PZSWZEJNEIPHPV-UHFFFAOYSA-N	436.538	1.256	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)[C@@H]1COc2ccccc2O1)c1cccc(N2CCOC2=O)c1	920966282	JMRFHLNVCHJDFR-UGSOOPFHSA-N	426.429	1.875	50	20	IDGD	
CCn1c(NNC(=O)CCS(=O)(=O)c2ccc(OC)cc2)nc2ccccc2c1=O	1337301753	UOUVNMXTGYHIQW-UHFFFAOYSA-N	430.486	1.732	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4nonc4c3)C2)C1	1777714365	OTRQJUICCFDKOF-SGTLLEGYSA-N	437.294	1.697	50	20	IDGD	
O=C(c1cccn2cncc12)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1778686535	REUPGDXPCXPNMZ-WMLDXEAASA-N	425.258	1.468	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(-n4cccn4)nc3)C2)C1	1779690614	BPBLAIKJHJXCKV-LIRRHRJNSA-N	448.321	1.494	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)COCCNC(=O)OC(C)(C)C)C2)C1	1781202263	ZDYGSAJKMSABBG-FOIQADDNSA-N	447.960	1.375	50	20	IDGD	
Cc1cc(CCC(=O)N2CCO[C@]3(CCN(C(=O)[C@H](F)Br)C3)C2)ccn1	1781325624	GJIIWPBNKOTTMO-FUHWJXTLSA-N	428.302	1.843	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)n1ccnn1)C2	1781905227	KZMJZLCANJSXDL-ATNYBXOESA-N	442.358	1.527	50	20	IDGD	
O=C(c1cc[nH]n1)N1CCO[C@@]2(CCN(C(=O)[C@H](Br)Cc3ccccc3)C2)C1	1783018202	IYFPZSIFBXHETF-OXQOHEQNSA-N	447.333	1.859	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)CC(=O)OC(C)(C)C)CCO2)C1	1783342376	IPIHZCRHBJCTOZ-FZKQIMNGSA-N	433.343	1.722	50	20	IDGD	
C=CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@@]2(CN(C(=O)[C@@H](F)Cl)CCO2)C1	1783766657	NEVLFAOZSBIINH-LPMFXHHGSA-N	433.908	1.820	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cccc(C#N)c3Cl)CCO2)C1	1783882906	UOBUACAUBNJNRN-BEFAXECRSA-N	426.300	1.909	50	20	IDGD	
Cn1ncc(Br)c1C(=O)N1CCO[C@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783947834	JRMCDTWYXMJJTP-AWEZNQCLSA-N	440.125	1.430	50	20	IDGD	
Cc1cc(O)c([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783949888	OBBGVSKZEWVXLN-KRWDZBQOSA-N	432.260	1.856	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)c1cnc(OCF)cn1	1785689281	RWAUIXQJYPMQMI-WRZDFSGXSA-N	449.252	1.066	50	20	IDGD	
Cc1nc2ncccn2c1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(C)(C)CCl)C[C@@H]21	1787979997	HWDFMWWMDSBAGY-JYJNAYRXSA-N	433.940	1.896	50	20	IDGD	
Cc1noc(C)c1CC(=O)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1	1788140451	YMNVFSCJWRYHHE-UHFFFAOYSA-N	447.300	1.962	50	20	IDGD	
C[C@@H]1CCc2c(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]4C3)n[nH]c21	1788762674	KXJGLRRTNOQACY-OHFALNGGSA-N	434.613	1.904	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ncon3)[C@H]2C1	1789089440	VPSJMKYJMBCYCD-MJKMTRRRSA-N	443.410	1.548	50	20	IDGD	
COc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Cl)C[C@@H]32)c([N+](=O)[O-])cc1O	1789270931	HRXNINGRIQBVKO-JIVACREVSA-N	445.831	1.437	50	20	IDGD	
COCCOCC(=O)NC1(c2ccc(NC(=O)c3cnccc3C(=O)NN)cc2)CCC1	1789522455	GNJMYYODYDVIDE-UHFFFAOYSA-N	441.488	1.096	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]2C1)n1ccccc1=O	1789926378	VVQJLJGHQFJQSK-XSEXMBABSA-N	444.301	1.080	50	20	IDGD	
O=C(NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])[nH]3)cc2)CCC1)c1cccc(B(O)O)c1	1790184989	CUBRAAOGRCYBIT-UHFFFAOYSA-N	448.244	1.664	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)NC(=O)OC(C)(C)C)[C@H]2C1	1791156684	NSMWFVQZISNHCY-CWVYHPPDSA-N	447.960	1.133	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3ccccc3F)C[C@@H]21	1791292937	BUQPXPUUQQTOGU-BJLQDIEVSA-N	448.539	1.111	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccn(C(F)F)c3=O)C[C@@H]21)C(Cl)Cl	1791298221	JQXLVHUCUBCAFI-DLOVCJGASA-N	438.258	1.640	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CS[C@@H]1CCCCO1)C2	1792871206	RIBGFOUMURBMTH-CTTHAOKLSA-N	449.411	1.867	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1CN(C(=O)OC(C)(C)C)C1)C2	1793449880	PPMWFGCCGBMUOZ-YYIAUSFCSA-N	443.972	1.850	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)NC(=O)OC(C)(C)C)C2	1793452623	DMDCPDAGKAVOTM-RBGFHDKUSA-N	431.961	1.897	50	20	IDGD	
COc1cnc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Br)C3)c(F)c1	1794452479	QFMNMAWTVCQKGE-NVVZYBJKSA-N	434.237	1.123	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)[C@@H]1C[C@@H]1c1ccc(F)cc1	1796189569	DMXFZZKAFICUPS-PVIWCNJMSA-N	436.292	1.561	50	20	IDGD	
CC(C)COc1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CCC(=O)NN(C)C)C3)ccn1	1796915041	NARUQJOFBZISBR-REPLKXPHSA-N	445.564	1.741	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ncn(C(C)C)n1	1797105229	DJRUGVVSKHHHBZ-BDHJUDLHSA-N	440.508	1.245	50	20	IDGD	
C=CC[C@@H](C(=C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2	1797647661	QQVSQMRKADADPR-NVQWDPAISA-N	441.532	1.478	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1cc(F)cnc1Cl	1798045499	WLLWSHYSNXYEQB-IWXIMVSXSA-N	438.656	1.768	50	20	IDGD	
COc1cccc(OC)c1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2	1798827149	LBXMILBSDLGDSC-OXUXUCFPSA-N	445.285	1.598	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Cl)C3)C1	1799232664	MPZQVCIIMGVUNR-QMHWVQJVSA-N	447.935	1.758	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1cc(F)ccn1)C2	1799273812	JMOWQDYBLXGMGH-JBYDNAENSA-N	432.323	1.979	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CSc1ccncc1)C2	1799274040	PEUUOMGMNSGECX-VLWCASSMSA-N	432.373	2.000	50	20	IDGD	
C[C@@H](Oc1cccnc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@](C)(Cl)CCl	1799278437	GUKJJGBTPPZBOL-TWAUDHPGSA-N	430.332	1.675	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnn3cccc(F)c13)C2	1799279284	GMWCAEBEBKYRCJ-RHQBZFHZSA-N	443.306	1.913	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3cccnc3n1)C2)[C@@H](F)Br	1799349454	GKRLWOLTPFBHOC-AYRXBEOTSA-N	437.269	1.524	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccnn1-c1ccccc1)C2	1800978065	KUCSSPHIYSDORS-LORHWOILSA-N	432.908	1.329	50	20	IDGD	
Cc1cc(C)n(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)CBr)C3)n1	1801243987	OCZHWIYMLHBWGS-GMLZMKKNSA-N	441.370	1.511	50	20	IDGD	
COC[C@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](NC(C)=O)c1ccc(F)cc1)C2	1802283842	QTQJOULFTWFUQB-PJVZLEMVSA-N	439.915	1.895	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cn3ccccc3n2)[C@H]1c1cccnc1)[C@H](O)CCl	1803138932	HXKHVQJVNHZWPB-WDYCEAGBSA-N	427.892	1.649	50	20	IDGD	
Cc1nn(C)c(C)c1CC(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]1c1cccnc1	1803145743	IADQWHDJEUGXMU-POAQFYNOSA-N	433.940	1.280	50	20	IDGD	
Cc1nnc(CCC(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)s1	1804554660	GNZCJKWIKKYLQD-RLFYNMQTSA-N	437.953	1.480	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2cc(C(=O)O)ncn2)[C@@H]1c1cccnc1	1804972713	GDCNTROTAVEPSD-ZQIUZPCESA-N	447.879	1.143	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H]1C(=O)N1CCCC2(CCN(C(=O)[C@@H](O)CCl)CC2)C1	1806405456	NPHRLXWGYRBMNV-HOTGVXAUSA-N	443.972	1.827	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)n1cccc1	1807367493	LMPMTIPVYGRKAG-NQSCKRDGSA-N	446.316	1.144	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)s1	1807369455	KKTFYTHAGNMIJJ-NQIIRXRSSA-N	449.341	1.765	50	20	IDGD	
C[C@@H]1C[C@]1(C)C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1	1807772275	IVTXCOZQHMOTTH-LZOXNYCHSA-N	436.516	1.446	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)CNC(=O)c2cccnc2)[C@@H]1c1cccnc1	1808252172	ZHUFPVVKNIBPRL-IMFGXOCKSA-N	443.935	1.930	50	20	IDGD	
COCCC(=O)N1CC[C@@H](CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@H]1c1cccnc1	1808415597	ZDRRKRBBRGAIPE-YVIKVBFHSA-N	440.504	1.258	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H](CNC(=O)[C@@H](F)Br)[C@H]1c1cccnc1)n1cncn1	1808679667	AGECKNIONFDVEM-NMFUWQPSSA-N	439.289	1.631	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)c1nnsc1C1CC1	1808734199	WBEOPRSFPNWICF-LZWOXQAQSA-N	435.937	1.730	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2cn3cccnc3n2)[C@H]1c1cccnc1	1809778825	BVEZRYBQZVUAJR-XYJFISCASA-N	442.907	1.698	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)c1nc(O)n2c1CCCC2	1810584443	BBAFUHCIBHMCFJ-QILLFSRXSA-N	447.923	1.239	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)c2cccc(=O)n2C)[C@@H]1c1cccnc1	1812865189	SWOSEYNRDRUMFQ-DHSIGJKJSA-N	447.333	1.883	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)Cc2ccc3c(c2)OCO3)[nH]n1)[C@H](O)CCl	1814868584	ALERXDZCJPKDIK-LSDHHAIUSA-N	434.880	1.973	50	20	IDGD	
CS(=O)(=O)CC(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](F)Br)[nH]n1	1817057431	VUCUHJLJYRPREJ-JOYOIKCWSA-N	425.280	1.137	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](C)Br)CC2	1817310186	OBAYBSZINDPZCC-KKZNHRDASA-N	431.356	1.705	50	20	IDGD	
O=C1NCCCn2nc(C(=O)N3CCCC[C@H]3c3cc(NC(=O)[C@@H](F)Cl)n[nH]3)cc21	1818038982	HHDCTKHBEMZPDU-SWLSCSKDSA-N	437.863	1.580	50	20	IDGD	
CCc1cc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)CCC(=O)NN(C)C)CC3)n(C)n1	1820637243	JQDHYSKFFBAUEX-CYBMUJFWSA-N	447.565	1.038	50	20	IDGD	
CC[C@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(=O)n3[nH]cnc3n2)[nH]n1	1820853079	GPBMEDDIFTZKFR-GWCFXTLKSA-N	432.872	1.464	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)CCc2ccccn2)CC1	1825331432	VXZIADVRUJPQEV-QHCPKHFHSA-N	449.360	1.628	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(O)n[nH]1)CC2	1825447436	XBHFNNGAFBVWBN-SFYZADRCSA-N	428.312	1.971	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CN1CCSCC1)CC2	1825632299	RDTABKNNUNNDMD-QWRGUYRKSA-N	447.424	1.887	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCCn1cccc1)CC2	1826092303	YLBKUGWGKOWDIN-OAHLLOKOSA-N	446.577	1.710	50	20	IDGD	
O=C(c1ccc(F)nc1)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827058600	YDMAZUPRICORLH-FQEVSTJZSA-N	439.296	1.448	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cccs3)C2)C1	1830538346	CFKWQLVTEQCLSH-RDTXWAMCSA-N	445.379	1.778	50	20	IDGD	
Cc1oc(C(C)(C)C)cc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1830725908	SPYDTIXEZLWTTA-HRAATJIYSA-N	442.940	1.555	50	20	IDGD	
O=C(Cc1ccc(Cl)s1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1830726840	UGXPRLASZJDXBP-DYVFJYSZSA-N	437.345	1.000	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4nccn4c3)C2)C1	1831647523	XCUSONUBDASFCJ-UTKZUKDTSA-N	434.924	1.812	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCCC(F)(F)F)CCO2)C1	1832264965	GRAVVRFJOAYBIF-CZUORRHYSA-N	430.851	1.429	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ncc(OC)cc3F)CCO2)C1	1833630081	WZKGMNZMQVQKIV-YWZLYKJASA-N	443.903	1.707	50	20	IDGD	
Cc1cc(CC(=O)N2CCC(N3CCC(NC(=O)CCBr)CC3)CC2)on1	1834422710	ZKIDMNNYPKTWTL-UHFFFAOYSA-N	441.370	1.882	50	20	IDGD	
O=C(CCBr)NC1CCN(C2CCN(C(=O)CCN3CCCC3)CC2)CC1	1834424673	SBYCNQDVJYTSLR-UHFFFAOYSA-N	443.430	1.829	50	20	IDGD	
Cc1ccc(O)c(C(=O)N2CCOC[C@]3(CN(C(=O)CCBr)CCO3)C2)c1	1834823775	KCRZMKJPQTXRJZ-IBGZPJMESA-N	441.322	1.556	50	20	IDGD	
Cn1c(C(=O)N2CCC(N3CCC(NC(=O)CO[Si](C)(C)C)CC3)CC2)cccc1=O	1835834931	HVCLTHCYQSBQJT-UHFFFAOYSA-N	448.640	1.422	50	20	IDGD	
COc1ccnc(C(=O)NC2CCN(C3CCN(C(=O)[C@H](F)Cl)CC3)CC2)c1OC	1836208352	GRDWRIJHKSGZNX-SFHVURJKSA-N	442.919	1.818	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)c1cc(F)cc(F)c1	1836317234	VEMZRSSHKOGOIR-GOSISDBHSA-N	429.895	1.750	50	20	IDGD	
O=C(c1cccc2nc[nH]c12)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836717840	LSHHSIGSCYQHBG-SFHVURJKSA-N	434.924	1.775	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(C#N)c3)C2)C1	1837714620	LTGMUDUKORIPQT-NRFANRHFSA-N	431.565	1.480	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3nc(O)n4c3CCCC4)CCO2)C1	1837759124	QSZMROHDWSFJDA-JLTOFOAXSA-N	440.928	1.012	50	20	IDGD	
Cc1nc(C)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](C)CBr)C3)C2)o1	1837999533	GHDIHHCBVWJQIP-KPZWWZAWSA-N	444.326	1.392	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)c(C)n1C	1838384892	MSMSGVWXLRYVJH-CRAIPNDOSA-N	446.317	1.402	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccsc3)C2)C1	1839151888	HQQPDGPEATYPJA-MSOLQXFVSA-N	435.373	1.983	50	20	IDGD	
N#Cc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)cc1	1839202198	XOQOSPBJMVAUJQ-CRAIPNDOSA-N	440.269	1.319	50	20	IDGD	
C[C@H](Cc1ccco1)C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](F)Br)CCO2)C1	1839203448	LMXNHEOSPLAAQG-QIIPPGSGSA-N	447.301	1.605	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(=O)c3ccco3)C2)C1	1839962349	BPIWFANFVRLGMB-ACJLOTCBSA-N	443.294	1.092	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C)C2)C1	1839964457	RVKQRHLSGZBUGG-APWZRJJASA-N	440.338	1.634	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3cccc(C)c3)C2)C1	1840149998	DKXDOHRKINSAPH-SIKLNZKXSA-N	438.952	1.638	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cccc(F)c3)C2)C1	1840151703	LRSOHWGVILLWNY-XLIONFOSSA-N	428.888	1.078	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CSc3ccccc3)C2)C1	1840151705	MAVQGDJOUZIMCO-FXAWDEMLSA-N	442.965	1.489	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)CCCn3ccnc3)CCO2)C1	1840383715	AFGSDLGFAGCPHQ-OALUTQOASA-N	447.363	1.356	50	20	IDGD	
COC(=O)CCC(=O)N1CCCC12CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1842648141	OPIJSCUXGKJAHH-ZDUSSCGKSA-N	431.917	1.275	50	20	IDGD	
Cc1oc2cc(O)ccc2c1C(=O)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843011230	HFKLSCPUFFNOMD-UHFFFAOYSA-N	434.257	1.257	50	20	IDGD	
C[C@@H](C(=O)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1)c1ccc(Cl)cc1	1843012753	LFCNGKAQVAQZDA-OAHLLOKOSA-N	426.709	1.641	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2ccc3c[nH]nc3c2)C1	1843267375	YYFDYQLOMWLTIM-AFUMVMLFSA-N	433.472	1.514	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1cnn(C(C)(C)C)c1)C2	1843415442	HZRFALNSTWADTB-MFKUBSTISA-N	439.520	1.589	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)CCCCn2cccc2)C1	1844338937	MPOPVKBUPARPAQ-XIEYBQDHSA-N	438.532	1.996	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCCC12CN(C(=O)[C@H]1CCCS1(=O)=O)C2	1845871660	BNPUNLLMXCHLJJ-IKFRKZOMSA-N	449.479	1.652	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)c1ccc(N3N=C(C)CC3=O)cc1)C2	1846363474	LLOKUFANJQYPQG-QGZVFWFLSA-N	432.908	1.870	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)C2(c3ccccc3F)CC2)C1	1847016117	MVGBHUHEFVAFFR-UHFFFAOYSA-N	437.475	1.373	50	20	IDGD	
CCSc1ncccc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cnccc1C(=O)NN	1847194710	LFUDNTCAVFZWLT-IRXDYDNUSA-N	440.529	1.321	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc(-c2ccccc2)on1	1847198354	CMEFNNPSXHPCOB-OALUTQOASA-N	446.467	1.469	50	20	IDGD	
CC(C)(C)OC(=O)NCC[C@@H](O)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)C(C)(C)CCl	1847438323	MEZFYDBQCMRQHM-SOUVJXGZSA-N	431.961	1.729	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)Cc1cccc(C(F)(F)F)n1	1848194891	CXUBOQDYAMTQPB-GJZGRUSLSA-N	441.454	1.218	50	20	IDGD	
N#Cc1ccc(CCC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc1	10784945	MSPVMEIFAMETJE-UHFFFAOYSA-N	426.498	1.737	50	20	IDGD	
COc1ccccc1-c1nnc(SCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)n1C	22201002	FPLKSBSIZYQNGG-UHFFFAOYSA-N	442.457	1.952	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN(C)Cc1nc2ccccc2c(=O)[nH]1	28927262	FNPVNFICKINMHY-UHFFFAOYSA-N	429.864	1.478	50	20	IDGD	
COc1ccc2nc(C)c(C(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)cc2c1	29689445	RAIVVTDZUNHEEV-UHFFFAOYSA-N	442.497	1.877	50	20	IDGD	
CC(=NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1)c1ccc(N2CCOCC2)cc1	254584031	YVDWRWGUTXWBPZ-UHFFFAOYSA-N	436.921	1.978	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NCCNc1ncc(Cl)cc1Cl	725873225	LVDNGEJPBBRCMB-UHFFFAOYSA-N	431.305	1.622	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)[C@H](C)NS(=O)(=O)c2ccc(C)cc2)cc1OC	726190525	WGIBVQRNNJRDJR-HNNXBMFYSA-N	449.529	1.920	50	20	IDGD	
COc1cccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c1	726871493	UQBYTLHWRWMGME-UHFFFAOYSA-N	434.474	1.183	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@@H]2C(=O)NNc2nc(-c3cccnc3)no2)c(OC)c1	728079434	UZCTYRUFFWVDPZ-MRXNPFEDSA-N	438.444	1.897	50	20	IDGD	
O=C(NNC(=O)c1cc(F)ccc1Br)c1cccc(CN2C(=O)CNC2=O)c1	728550719	CLUIQEIQOKRFAR-UHFFFAOYSA-N	449.236	1.715	50	20	IDGD	
C[C@]1(NNC(=O)N[C@@H]2CCN(c3ccc(Br)cc3)C2)CCS(=O)(=O)C1	728755390	LWWZAGYSLAVUIM-CJNGLKHVSA-N	431.356	1.409	50	20	IDGD	
CCCCN1CCCC[C@@H]1CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	731284687	FDTOIUMKFLZJJF-QGZVFWFLSA-N	439.582	1.536	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)CN2C(=O)CCc3ccccc32)c2ccccc2c1=O	732053840	XQWGYICYWWBVFK-UHFFFAOYSA-N	433.468	1.718	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cccc(CS(N)(=O)=O)c2)cc1Br	732173681	CLIVSCBLGMDBOV-UHFFFAOYSA-N	442.291	1.321	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)N[C@@H]1CCN(c2ccccc2Cl)C1=O	732245528	YQCHVXKXNZEROU-GFCCVEGCSA-N	435.893	1.267	50	20	IDGD	
C[C@@H](CC(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)NC(=O)C1CCCCC1	732336068	BTZSSWOBUJZMMG-ZDUSSCGKSA-N	434.449	1.374	50	20	IDGD	
C[C@H]1CCCC[C@H]1OCC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	733088721	VGXFWLSUWKYKTQ-MAUKXSAKSA-N	439.534	1.064	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)NCCN2CCN(C(=O)C3CCCCC3)CC2)c1	733335827	DMOBZKWWFLJULO-UHFFFAOYSA-N	445.564	1.429	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)C(=O)c1cnn(-c2ccccc2)c1	733755405	YIBSTGKRCUDQLR-UHFFFAOYSA-N	446.511	1.415	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)C[C@@H]2C(=O)Nc3ccccc32)CC1	734824881	LLLFTXRLSQRFHM-HNNXBMFYSA-N	431.493	1.842	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNS(=O)(=O)c2ccc(N3CCOC3=O)cc2)cc1	740809937	LTTYZHLLBXMJAY-AWEZNQCLSA-N	449.485	1.819	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)[C@@H](c1cccc(F)c1)N1CCOCC1	741883658	RIVMSBFPKNDCFU-OAQYLSRUSA-N	431.464	1.824	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)c2ccc(S(=O)(=O)CC(=O)N(C)C)cc2)cc1	742037841	IQBUKDQVXZIHMJ-UHFFFAOYSA-N	449.554	1.410	50	20	IDGD	
O=C(CCN1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O)NNc1c(F)cc(F)cc1Br	742707663	CDFLUQBXIZIODO-OXHZDVMGSA-N	444.232	1.723	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)N[C@H](C)[C@@H](C)N2CCOCC2)cc1Cl	743627062	RTKAFLJXMHPIAR-VXGBXAGGSA-N	429.905	1.802	50	20	IDGD	
O=C(CCN1C(=O)[C@@H]2CCCC[C@H]2C1=O)NNC(=O)c1cc(Br)ccc1O	743732043	IPNIHJKAXYMMOJ-VXGBXAGGSA-N	438.278	1.481	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)Oc1cccc(F)c1	745878243	IKHRGOZKNJDYOS-ZDUSSCGKSA-N	438.481	1.488	50	20	IDGD	
CCC(CC)(CNC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)SC	745909950	HWXPJFWCYZLXRV-UHFFFAOYSA-N	444.627	1.566	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2ccc(NNC(=O)Cn3ccnc3)c([N+](=O)[O-])c2)cc1	746090616	HCRGAQNZOZHJJG-UHFFFAOYSA-N	446.445	1.744	50	20	IDGD	
Cc1noc(C)c1S(=O)(=O)N1CCC[C@H](C(=O)NNc2oc(C(C)C)nc2C#N)C1	746299665	YYDBQVQVGMGFQS-ZDUSSCGKSA-N	436.494	1.819	50	20	IDGD	
CC(C)(C)OC(=O)N1CCCC[C@H]1CNC(=O)NNC(=O)Cc1cn2ccccc2n1	746754637	BNNMJVCRBBFRHS-INIZCTEOSA-N	430.509	1.997	50	20	IDGD	
Cc1nc2c(C(N)=O)cnn2c(C)c1CCC(=O)NNC(=O)c1ccc(Cl)cc1F	747329636	MBGLCWKQMJOPQW-UHFFFAOYSA-N	432.843	1.631	50	20	IDGD	
C[C@@H](c1ccc([S@@](C)=O)cc1)N(C)C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	747491354	UAKGIYVPGATPST-GNDSEDMPSA-N	427.490	1.447	50	20	IDGD	
COc1cc(OC)cc(N2CC[C@H](NC(=O)NNC(=O)c3c[nH]c4ccccc34)C2=O)c1	747956854	WYYGUAGYJYSQOD-IBGZPJMESA-N	437.456	1.935	50	20	IDGD	
O=C1CN(S(=O)(=O)c2ccc(C(=O)NNc3ccc(Cl)cc3Cl)cc2)CCN1	748011765	ALPLSPLFFGUOPK-UHFFFAOYSA-N	443.312	1.871	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1nn(-c2ccc(F)cc2)cc1O	748013368	BFRWOYILCPSGIV-UHFFFAOYSA-N	446.464	1.393	50	20	IDGD	
C[C@H](NS(=O)(=O)c1ccc(C(N)=O)cc1)C(=O)NNc1ccccc1Br	748069037	WCHIYOBDDFINPK-JTQLQIEISA-N	441.307	1.358	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CC(=O)N(c2ccc3c(c2)Cc2ccccc2-3)C1)C(=O)N1CCCC1	748240818	YFDYEZAUNPGRHX-QGZVFWFLSA-N	432.480	1.381	50	20	IDGD	
CCc1cc(N2CCC(NC(=O)NNC(=O)c3ccc4c(c3)OCCO4)CC2)ncn1	748664479	VZVOGXYJNYONHM-UHFFFAOYSA-N	426.477	1.423	50	20	IDGD	
O=C(NNC(=S)NC[C@@H]1CCOC1)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	749646843	MIBOLTIDGZJEAG-INIZCTEOSA-N	437.529	1.534	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2ccc(C(=O)NNC(=O)CCc3ccccc3)cc2)C[C@H](C)O1	749804447	YQBSQJBXLXHXGO-IRXDYDNUSA-N	445.541	1.878	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1	751206796	NMRGPSOZEJPVOQ-UHFFFAOYSA-N	437.412	1.991	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNS(=O)(=O)c1cnn([C@H]2CCOC2)c1	751537922	DVMPTNOZGGQHQH-YOEHRIQHSA-N	430.486	1.775	50	20	IDGD	
C[C@@H](NC(=S)NNC(=O)C1CCN(S(=O)(=O)/C=C/c2ccccc2)CC1)C1CC1	751620786	MHTOSURCUXNIGU-ATGUSINASA-N	436.603	1.993	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CC23CC4CC(CC(C4)C2)C3)sc1S(N)(=O)=O	754179747	HUJGISYUIUZXBA-UHFFFAOYSA-N	427.548	1.772	50	20	IDGD	
C[C@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(NC(=O)NNC(=O)c3cnccn3)cc2)C1	755419416	CZYSFKPFGQJPGY-OKILXGFUSA-N	432.506	1.610	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(C(=O)NNC(=O)Cc2nc(-c3ccccc3)cs2)co1	755449010	NDOCUDVFXJVJSG-UHFFFAOYSA-N	434.499	1.657	50	20	IDGD	
CC(=O)N(Cc1ccc(NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1)C(C)C	756597023	JAVWQLBBYSUVPG-UHFFFAOYSA-N	436.476	1.886	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)[C@@H]1CCc2n[nH]cc2C1	757095616	IBNXZSOJJYUBDL-MRXNPFEDSA-N	430.940	1.133	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](Cc1ccccc1)C(=O)NNC(=O)C(=O)Nc1ccccn1	758831006	MMGQXDZWVVARQR-OAHLLOKOSA-N	427.461	1.304	50	20	IDGD	
O=C(NNC(=O)c1ccc(S(=O)(=O)Nc2ccccc2)cc1)C(=O)Nc1ccccn1	758831608	RKJHABVZTVIUAW-UHFFFAOYSA-N	439.453	1.282	50	20	IDGD	
O=C(NNC(=O)c1ccc(Br)s1)NC1CCN(c2cccnn2)CC1	758864562	UXJGIICJUKCMJH-UHFFFAOYSA-N	425.312	1.914	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H]1[C@H]1COCCC1=NNC(=O)CNC(=O)c1ccco1	762422782	AOQVIQQAFCHXQL-GOEBONIOSA-N	434.493	1.918	50	20	IDGD	
C[C@@H](Sc1ccccn1)C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	762535556	FCWIXUMRUKQXEF-OAHLLOKOSA-N	435.575	1.642	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)ccc1C(=O)NC(C)C	763446723	WHUIKEZKWSYAMB-UHFFFAOYSA-N	427.417	1.441	50	20	IDGD	
O=C(NNC(=O)c1ccccn1)C(=O)Nc1ccccc1-n1cc(Br)cn1	763463392	HOKANIDHGNJBSR-UHFFFAOYSA-N	429.234	1.430	50	20	IDGD	
O=C(NNC(=O)C1CC1)C(=O)Nc1ccc(CC(=O)N2CCN(c3ccccc3)CC2)cc1	763557288	GDGOBHVZNYZIRA-UHFFFAOYSA-N	449.511	1.074	50	20	IDGD	
CC(C)(C)[S@@](=O)Cc1cccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)c1	763557344	AMQNQEBUQMZMIB-HKBQPEDESA-N	445.497	1.862	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)Nc1cccc(-c2n[nH]c(C3CC3)n2)c1	763575100	PZTLJKRDTVSFIQ-KRWDZBQOSA-N	448.439	1.275	50	20	IDGD	
CCCCOC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1	763575633	ZYHIAYNCFBETOU-SFHVURJKSA-N	441.440	1.569	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(N3C[C@H](C)O[C@H](C)C3)nc2)c1	763629688	GKFDGTQTUZQQSO-IYBDPMFKSA-N	441.488	1.169	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1scc(C(=O)OC)c1C	763682116	OIRFSJVIBAFSJK-UHFFFAOYSA-N	435.458	1.407	50	20	IDGD	
Cc1ccc(C(=O)NC2CC2)cc1NC(=O)C(=O)NNC(=O)COc1ccc(Cl)cc1	763686405	LSTKBFHXRGGVRP-UHFFFAOYSA-N	444.875	1.706	50	20	IDGD	
CSc1cc2c(cc1NC(=O)C(=O)NNC(=O)c1cccc(N(C)C)c1)OCCO2	763757096	BOJJQCJRWVAULH-UHFFFAOYSA-N	430.486	1.645	50	20	IDGD	
CCOc1cc(C(=O)N(C)C)ccc1NC(=O)C(=O)NNC(=O)c1cccc(N(C)C)c1	763758161	PUUMMGQVBPAOOV-UHFFFAOYSA-N	441.488	1.253	50	20	IDGD	
O=C(NNC(=O)c1cc2c(s1)CCC2)C(=O)Nc1cc(N2CCCC2=O)ccc1F	763785770	RHFLIVZUZIHNGG-UHFFFAOYSA-N	430.461	1.902	50	20	IDGD	
O=C(CCCc1nc(-c2ccc(F)cc2)no1)NNC(=O)CNC(=O)c1cccnc1	763819983	IIPJZDCEFCEMJV-UHFFFAOYSA-N	426.408	1.171	50	20	IDGD	
N#Cc1ccccc1COc1cccc(C(=O)NNC(=O)CNC(=O)c2cccnc2)c1	763823455	HCMDKRARWFEWDA-UHFFFAOYSA-N	429.436	1.723	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CNC(=O)c2cccnc2)cc1NC(=O)OC(C)(C)C	763824710	MACUDSCIUHMOPL-UHFFFAOYSA-N	427.461	1.928	50	20	IDGD	
CN1CCCN(c2ccc(NC(=O)C(=O)NNC(=O)Cc3ccc(Cl)cc3)cc2)CC1	763941584	NXXUVCVQEPZAMW-UHFFFAOYSA-N	443.935	1.811	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1	763959325	FFKWPSLPSQQRBQ-UHFFFAOYSA-N	444.513	1.569	50	20	IDGD	
Cc1nc(COc2ccc(NC(=O)C(=O)NNC(=O)c3cc(Cl)ccc3O)cc2)no1	763974738	WWFJITOOPMBKMK-UHFFFAOYSA-N	445.819	1.716	50	20	IDGD	
CC[C@H](C)NS(=O)(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2ccc(C)cc2O)c1	764104523	AAXYFCBTWYCSGX-ZDUSSCGKSA-N	448.501	1.177	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(CCN3CCSCC3)cc2)c(O)c1	764109797	LCNWLFPYTDMPAF-UHFFFAOYSA-N	442.541	1.692	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2ccccc2S(=O)(=O)C(C)C)cc1	764125495	YCAWMCIUABAWPJ-UHFFFAOYSA-N	447.513	1.596	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2ccc(N3CCOCC3)cc2C)cc1	764127196	PZUATJFDARLXPU-UHFFFAOYSA-N	440.500	1.559	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1cccc(N2CCOC2=O)c1C	764132793	QFQZXSDETQCDDA-UHFFFAOYSA-N	426.429	1.289	50	20	IDGD	
COc1ccc(Br)c(NC(=O)C(=O)NNC(=O)c2cccc(OC)c2O)c1	764133535	WFRAFECJPKGOEJ-UHFFFAOYSA-N	438.234	1.572	50	20	IDGD	
CC[C@@H](C)NS(=O)(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)CC2CCCC2)c1	764187094	BGGWRTJBZMPCMD-CQSZACIVSA-N	438.550	1.571	50	20	IDGD	
CC(C)CCC(=O)NNC(=O)C(=O)N1C[C@@H](C(=O)N2CCCCC2)Oc2ccccc21	764198847	IDRXQKLPANASBM-SFHVURJKSA-N	430.505	1.377	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)ccc1N1C(=O)CCC1=O	764242536	GJMSCZVAGFOGGR-UHFFFAOYSA-N	447.451	1.389	50	20	IDGD	
COC(=O)C(C)(C)c1ccc(NC(=O)C(=O)NNC(=O)COCc2ccccc2)cc1	764365887	HJFGYJNJURPMLC-UHFFFAOYSA-N	427.457	1.440	50	20	IDGD	
COc1cc2nc(C)sc2cc1NC(=O)C(=O)NNC(=O)COCc1ccccc1	764367153	UTRWGLKKBVZLAC-UHFFFAOYSA-N	428.470	1.916	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1cnn(-c2ccncc2)c1	764394054	MWUHFBPGGAHRSX-UHFFFAOYSA-N	426.458	1.154	50	20	IDGD	
CO[C@@H](C)C(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)c1	764401179	NKJHBOABFUUYIH-LBPRGKRZSA-N	446.485	1.244	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)C(=O)Nc2sc(-c3ccccc3)nc2C)c1	764432659	IRAVKPTXHDTPSY-UHFFFAOYSA-N	438.469	1.872	50	20	IDGD	
COC(=O)[C@@H](NNC(=O)C1CCN(c2ncccn2)CC1)c1cc(OC)cc(OC)c1	764627762	HADJWSHJUACBQF-SFHVURJKSA-N	429.477	1.245	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)CCn2nnc3ccccc3c2=O)n[nH]1	765601665	RCGSLSVDTAXMQJ-UHFFFAOYSA-N	433.428	1.042	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccccc2F)cc1NC(=O)CCN(C)C	768240908	CQCIPPAQTUJAMH-UHFFFAOYSA-N	443.479	1.353	50	20	IDGD	
NS(=O)(=O)c1cccc2c(C(=O)NNC(=O)C(F)(F)Oc3ccccc3)nccc12	768485680	WYUVYEZERYQBFJ-UHFFFAOYSA-N	436.396	1.315	50	20	IDGD	
COC(=O)c1cccc(CCNC(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)c1	769005280	BAVFJOUTXDNQGL-UHFFFAOYSA-N	427.465	1.942	50	20	IDGD	
Cc1c(C=NNC(=O)c2cnccn2)c2ccccn2c1C=NNC(=O)c1cnccn1	771877581	TWVNDUFYEBRDEV-UHFFFAOYSA-N	427.428	1.356	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1cccnc1SCc1ccc(C(N)=O)cc1	771990898	CHMZFTRNGHNYSY-LBPRGKRZSA-N	430.486	1.576	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNS(=O)(=O)c1ccc([N+](=O)[O-])c(C(=O)O)c1	773250212	AXQXFFGIYYJWKK-SECBINFHSA-N	443.821	1.723	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NNC(=O)CCS(=O)(=O)C2CCCC2)C1	773412270	VCWMAUSCZIUBMQ-CQSZACIVSA-N	431.555	1.528	50	20	IDGD	
N#Cc1ccc(Cn2cnc(NC(=O)C(=O)NNc3ncc(Cl)cc3Cl)n2)cc1	773674228	YAFOVKCQBASGTD-UHFFFAOYSA-N	431.243	1.982	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(Br)cc1F)c1cc([N+](=O)[O-])ccc1O	775282092	FAGRZRAGUFKMRF-UHFFFAOYSA-N	434.199	1.825	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)CCNS(=O)(=O)c2ccc(F)c(F)c2)c1	776541194	JLZKVMLJHCLSGT-UHFFFAOYSA-N	433.458	1.180	50	20	IDGD	
COc1nc(C)c(Br)cc1C(=O)NNC(=O)CCN1C[C@@H](C)O[C@H](C)C1	777088427	DKCFZVXKMQGARH-GHMZBOCLSA-N	429.315	1.421	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)c1cccc(S(=O)(=O)Cc2ccccc2)c1	778437963	OBAVSSPVHPJQLT-UHFFFAOYSA-N	447.513	1.946	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)[C@H](O)[C@H](O)c2nc3ccccc3s2)o1	779500863	SIRAMJFWLYJCMI-SJORKVTESA-N	432.502	1.587	50	20	IDGD	
CC(C)(C)OC(=O)N1Cc2ccc(CNC(=O)NN[C@]3(C)CCS(=O)(=O)C3)cc2C1	780771058	LEVIHNPDNKNCIP-HXUWFJFHSA-N	438.550	1.818	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N2CCN(CC(C)(C)O)C[C@@H]2C)cc1Br	780990929	VBYWDESWRQRKST-LBPRGKRZSA-N	443.342	1.589	50	20	IDGD	
CC(C)(C=NNC(=O)c1csc(N2CCOCC2)n1)N1C(=O)c2ccccc2C1=O	782159185	QIBVHQAYBPJHNC-UHFFFAOYSA-N	427.486	1.770	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(CNC(=O)NNC(=O)NCc2ccc(Cl)cc2)c1	782535345	KISPLPMIPCDNRS-UHFFFAOYSA-N	439.925	1.804	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(NC(=O)C(=O)NNc2ccccc2Br)c1	782986993	HJSWPXKKEXOLQU-UHFFFAOYSA-N	441.307	1.781	50	20	IDGD	
Cc1cnn(-c2ccc(C(N)=O)cc2NC(=O)C(=O)NNc2ncccc2C(F)(F)F)c1	783121820	ZSPWXWWOIGCUCJ-UHFFFAOYSA-N	447.377	1.775	50	20	IDGD	
O=C(CCOc1cccc(I)c1)NNC(=O)Cc1cccnc1	783286101	QWCXITRHDMBVJX-UHFFFAOYSA-N	425.226	1.845	50	20	IDGD	
CCS(=O)(=O)c1cc(F)ccc1NC(=O)C(=O)NNc1ccc(Br)cn1	784338970	HSTPIQDQVJTMJZ-UHFFFAOYSA-N	445.270	1.859	50	20	IDGD	
COC1(C(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)CCOCC1	785721960	CEHSMROJWZETCJ-UHFFFAOYSA-N	439.515	1.506	50	20	IDGD	
CCOc1nc(C)ccc1C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	790116728	PEZGMVLFFYXDJJ-UHFFFAOYSA-N	432.502	1.648	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccc3c2OCC[C@H]3OC)cc1	790952291	QKHWULPELXJSFP-QGZVFWFLSA-N	429.429	1.330	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2ccc(F)c(S(C)(=O)=O)c2)cc1	791048906	IWQWSUBNBZEXML-UHFFFAOYSA-N	429.451	1.099	50	20	IDGD	
CCOc1ccc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)C3=CCOCC3)cc2)cc1	792775706	ALDCIUDLODVVMP-UHFFFAOYSA-N	445.497	1.994	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)NCCCNC(=O)c2cccc(Br)c2)n1	792954839	CAPLWLCARMUVDU-UHFFFAOYSA-N	434.294	1.917	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(C)c(Br)n2)cc1	793022666	AVJYPBNQBLQSMF-UHFFFAOYSA-N	437.250	1.326	50	20	IDGD	
COCCOC(=O)Nc1cccc(NC(=O)C(=O)NNc2ccc3c(=O)[nH]ccc3c2)c1	793066077	RNSPDUJYMYMDNA-UHFFFAOYSA-N	439.428	1.805	50	20	IDGD	
CCCS(=O)(=O)Nc1ccc(C(=O)NNc2ccccc2S(=O)(=O)N(C)C)cc1	795169478	QHGQLNMGWGXLGE-UHFFFAOYSA-N	440.547	1.846	50	20	IDGD	
C[C@@H](CS(=O)(=O)c1ccc(F)cc1)C(=O)NNc1ccccc1S(=O)(=O)N(C)C	795176880	GRGVOHFVNGIZRR-ZDUSSCGKSA-N	443.522	1.629	50	20	IDGD	
CCCc1[nH]nc(C(=O)OCC(=O)NNC(=O)c2cc(Cl)ccc2OC)c1[N+](=O)[O-]	796264643	AHJXAZWTKQZITH-UHFFFAOYSA-N	439.812	1.550	50	20	IDGD	
CCCc1c(NC(=O)C(=O)NN(C)C(=O)NCC)cnn1-c1cc(F)c(OC)cc1F	797089187	LENARGWIVNWJRG-UHFFFAOYSA-N	438.435	1.743	50	20	IDGD	
COC(=O)CNC(=O)NNS(=O)(=O)c1cc(C(F)(F)F)ccc1Br	799123721	FHMKITXWAOQCDW-UHFFFAOYSA-N	434.190	1.133	50	20	IDGD	
O=C(CNC(=O)c1cccc([N+](=O)[O-])c1)NNC(=O)Nc1ccc(Br)cc1	801994900	OYGASSZMKYHZMH-UHFFFAOYSA-N	436.222	1.940	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)CN2C(=O)N[C@@](C)(C3CC3)C2=O)c(OC)cc1Cl	802081722	ZPBJUBKGXSFNCF-SFHVURJKSA-N	439.856	1.230	50	20	IDGD	
COc1ccc(Cl)c(NC(=O)NNC(=O)c2ccc(CCNS(C)(=O)=O)cc2)c1	802115303	WQZSLEOMKHYMMK-UHFFFAOYSA-N	440.909	1.907	50	20	IDGD	
Cc1noc(C)c1S(=O)(=O)N1CCC(C(=O)NNc2nccnc2C2CCC2)CC1	805466475	SBBUELJVHFLUSS-UHFFFAOYSA-N	434.522	1.893	50	20	IDGD	
O=C(NNc1nccnc1C1CCC1)C(=O)Nc1ccc(CN2C(=O)CCCC2=O)cc1	807461863	YINVTJYHQDEVFW-UHFFFAOYSA-N	436.472	1.865	50	20	IDGD	
COC(=O)c1c(F)ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)c1C	810386288	SUEDIKMKNOZTJI-LLVKDONJSA-N	435.383	1.613	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNS(=O)(=O)CCc3cccs3)CC2)cc1	811690138	VLUBFYOLFCQBSO-UHFFFAOYSA-N	436.603	1.367	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@H]2COc3c(C)cccc3C2)cc1	812642847	GIPAIYKMINJXEU-QGZVFWFLSA-N	446.529	1.258	50	20	IDGD	
Cc1nc(C#N)c(N2CCC(C(=O)NNc3ccc(S(=O)(=O)N(C)C)cc3)CC2)o1	812726756	PAXNZMKNWZKMCX-UHFFFAOYSA-N	432.506	1.465	50	20	IDGD	
Cc1cnc(Br)c(NC(=O)C(=O)NNC(=O)c2c(C)nc3ccccn23)c1	812979168	BKYMXWUFRLWJAI-UHFFFAOYSA-N	431.250	1.508	50	20	IDGD	
COCC1(CNC(=O)NNC(=O)[C@@H](C)Oc2cccc(Br)c2)CCOCC1	813772201	CBVQCFACXNNQCY-CYBMUJFWSA-N	444.326	1.990	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCc2nncn2C1)C(=O)Nc1ccc(OCC2CCCCC2)cc1	815691343	MXHCJCTVHLEDEJ-MRXNPFEDSA-N	440.504	1.586	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCc2nncn2C1)C(=O)Nc1cccc(N2CCCCCC2)c1	815692310	OGARCMFOGMVUIE-HNNXBMFYSA-N	425.493	1.007	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCc2nncn2C1)C(=O)Nc1ccc2nc(C3CC3)sc2c1	815693349	UNWNHRAWLYRWMA-NSHDSACASA-N	425.474	1.114	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@@H]1CCN(Cc2ccccc2)C1	816828503	HNDZIWIYUOBXJG-QGZVFWFLSA-N	429.546	1.571	50	20	IDGD	
Cc1nnc(NNC(=O)c2cccc(S(=O)(=O)N3c4ccccc4C[C@H]3C)c2)nc1O	817281617	NIUWZNZAJKQFOJ-GFCCVEGCSA-N	440.485	1.782	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)Cc1ccc(-n2cnnn2)cc1	915064457	SDOWBKNNMCDTRY-LBPRGKRZSA-N	445.277	1.582	50	20	IDGD	
COc1cccc(C[C@H](C(=O)NNC(=O)c2cc(OC)cc(OC)c2)n2nnnc2C)c1	915691268	SNKKARIRMMQWGJ-LJQANCHMSA-N	440.460	1.252	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)NC[C@H]2CN(Cc3ccccc3)CCO2)c1	915894442	KCXXXVKLNCVRSG-FQEVSTJZSA-N	426.517	1.914	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)nc1)c1ccc(S(=O)(=O)NC[C@@H]2CCCO2)cc1	917253342	FMWIDPHQKAEJDP-AWEZNQCLSA-N	438.893	1.267	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)Cc2c(C)[nH]c(-c3ccncc3)nc2=O)cc1OC	917925072	QVQKMVBGIVNFSB-UHFFFAOYSA-N	437.456	1.551	50	20	IDGD	
CCN(CC)CCOc1ccc(C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1	918099729	AQUDLWXADURLCN-UHFFFAOYSA-N	433.530	1.886	50	20	IDGD	
O=C(CCOCc1ccccc1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	918140952	BXZARHJALFWOIE-UHFFFAOYSA-N	431.514	1.839	50	20	IDGD	
CC(C)[C@H](Oc1ccccc1C#N)C(=O)NNC(=O)c1csc(N2CCOCC2)n1	918285386	JWUHUPRHAZRQLQ-KRWDZBQOSA-N	429.502	1.716	50	20	IDGD	
O=C(Cc1ccc2ccccc2c1)NNC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	918779218	GYKMGPVUELZZMM-UHFFFAOYSA-N	430.428	1.033	50	20	IDGD	
O=C(NNC(=O)C1(c2ccc(Br)cc2)CCC1)N[C@@H]1CCS(=O)(=O)C1	919889971	XQLJPIMEJKXCOR-CYBMUJFWSA-N	430.324	1.388	50	20	IDGD	
Cc1ccc(NNC(=O)Cn2cnc3c(c(Br)nn3C)c2=O)cc1Cl	1115960620	YQDFKMVYZUXLOK-UHFFFAOYSA-N	425.674	1.998	50	20	IDGD	
O=C(COC(=O)c1ccc(Cn2cccc2)cc1)NNC(=O)[C@H]1COc2ccccc2O1	1318332051	JZTNQFHNMQSQLO-HXUWFJFHSA-N	435.436	1.681	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)c2cn(CC(=O)C(C)(C)C)nn2)CC1	1319156738	IDLGAMTZMDCWSA-UHFFFAOYSA-N	436.513	1.301	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)CCc2c(C)ncnc2O)c2ccccc2c1=O	1321600746	DJJPMBMETOBEAZ-UHFFFAOYSA-N	438.488	1.785	50	20	IDGD	
Cc1nc(-c2c(C)c(C)nn(C)c2=O)sc1C(=O)NNC(=O)c1n[nH]c2c1CCCC2	1337367048	BUTFPSHDTFMHER-UHFFFAOYSA-N	441.517	1.506	50	20	IDGD	
CNC(=O)Cc1ccccc1NC(=O)NNC(=O)COc1ccc(Br)cc1	1337766533	NJHGXVJFCYKSDU-UHFFFAOYSA-N	435.278	1.969	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3c(C)cc(C(N)=O)cc3C)C2)C1	1779012542	YJSKKVYJRICHFL-IIBYNOLFSA-N	437.924	1.100	50	20	IDGD	
C[C@H](NNc1ccccc1)C(=O)N1CCO[C@@]2(CCN(C(=O)CO[Si](C)(C)C)C2)C1	1779294727	LZJIXHRUWDADGB-LAUBAEHRSA-N	434.613	1.673	50	20	IDGD	
CN(C)c1cccc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)c1	1780643937	RENCJTNCCCWSEX-QAPCUYQASA-N	428.302	1.887	50	20	IDGD	
CC(C)CC(=O)N1CCO[C@@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1	1780970075	RHIULXFEALJEBR-HSZRJFAPSA-N	445.564	1.209	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(CCN(C(=O)c3ccccc3-n3nccn3)C2)C1	1781836727	WEXGAUGQNMQXHJ-LJQANCHMSA-N	448.321	1.496	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)Nc1nccs1)C2	1782172837	NKNFHRHAXZPKFZ-DEXNDLTESA-N	444.985	1.711	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4c(c3)NC(=O)CC4)C2)C1	1782515070	QOOJALLAOUEURY-IERDGZPVSA-N	435.908	1.269	50	20	IDGD	
C[C@H](CC(N)=O)C(=O)N1CCO[C@]2(CCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1	1782860863	DSATXIAKHBNHGW-FPOYXYOTSA-N	446.454	1.213	50	20	IDGD	
CCC[C@H]1CC[C@H](C(=O)N2CC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)CC1	1783362488	QVPAFYZJCDBDEI-JXQFQVJHSA-N	442.365	1.416	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1Cc3ccccc3CN1C)CCO2	1783873679	SFWWFJYOOOSJPJ-IPJJNNNSSA-N	435.952	1.127	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3n[nH]c4cc(Cl)ccc34)CCO2)C1	1783876808	ATXALZNMPHITTI-AUUYWEPGSA-N	441.315	1.914	50	20	IDGD	
CC(=O)N/C(=C\c1ccco1)C(=O)N1CCO[C@@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783947189	OXNLSHCRLOYANT-GIIHOQTISA-N	430.288	1.390	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(OCC4CC4)cc3)C[C@@H]21)[C@H](O)CCl	1784095452	IIIKGVHALQPWQU-FFGOWVMKSA-N	436.936	1.668	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3C[C@@H]3F)C[C@@H]21	1785075612	RSEKHSFIJXHZCR-KARBZBNUSA-N	447.935	1.456	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCC(=O)N3CCCC3)C[C@@H]21	1786400955	IODLBSJTJUMUKP-JYJNAYRXSA-N	444.370	1.154	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]3C2)c(-n2nccn2)c1	1787447906	JTBVLRCMMFJWQX-QXRTWZOPSA-N	435.887	1.703	50	20	IDGD	
O=C(CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]2C1)Nc1ccc(F)cc1	1787449011	LGNDPZKHESXRPT-FGVQXAILSA-N	429.851	1.668	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccnc(OC)c3)[C@H]2C1	1788909060	ONDSBBJHXINMEM-VGWMRTNUSA-N	440.338	1.857	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cn4ccccc4n3)C[C@@H]21)[C@@H](F)Br	1789922631	JWBHISBLWZBMAF-LMRQPLJMSA-N	439.285	1.618	50	20	IDGD	
Cc1ccc(C(=O)Nc2ccc(C3(NC(=O)c4ccc(B(O)O)cc4)CCC3)cc2)c(O)n1	1790115508	JIBWSJJHHGSUMJ-UHFFFAOYSA-N	445.284	1.837	50	20	IDGD	
CCCCC[C@@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21	1790892854	MHEFCKZCNFCMFJ-LGYWMIHWSA-N	430.354	1.176	50	20	IDGD	
CCc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](Br)CC)[C@H]3C2)nn1C	1790960728	QZNXFCLERNXPTM-QEWYBTABSA-N	441.370	1.749	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3ccc(F)cc3)C[C@@H]21	1791292925	BOZGXGZMJYKERI-IHPCNDPISA-N	448.539	1.111	50	20	IDGD	
CC(=O)Nc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]3C2)ccn1	1791294812	NMNIIYLMEFLHFT-IHRRRGAJSA-N	429.304	1.437	50	20	IDGD	
CC(C)n1cnc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)CBr)n1	1792867995	MQPCFUMPBFNQGP-YIYPIFLZSA-N	428.331	1.093	50	20	IDGD	
COc1ccc2[nH]cc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)c3cccc(B(O)O)c3)C4)c2c1	1798061689	SJBXMFAPMCYLDG-BCDXTJNWSA-N	447.300	1.422	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=N/N1CCCCC1	1798431643	OSEGYUWOFARGDS-HPOMMXTISA-N	441.536	1.230	50	20	IDGD	
CCC[C@H](NC(C)=O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](Br)CC	1800645197	VSPNBSIINNMJNI-DGADGQDISA-N	432.359	1.054	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1nc2cc([N+](=O)[O-])ccc2[nH]1	1800867505	VPRVJDYYXIKFGV-GFQSEFKGSA-N	435.868	1.977	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc2nn(C)cc2c1	1800910529	BFWPEFWPSMHRBK-BCDXTJNWSA-N	426.521	1.198	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1[C@H]3Sc4ccccc4[C@@H]31)C2	1800976975	MWEQKLDFZDUCGW-PHYLFGOOSA-N	436.961	1.718	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc3ccccc3n1C)C2	1802336583	NLJSERVGPGDKFK-BCDXTJNWSA-N	425.533	1.803	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H]2CC[C@@H]3CCC(=O)N3C2)[C@H]1c1cccnc1)[C@@H](O)CCl	1803140193	BKZINIPXHDIJHK-JAYZULETSA-N	448.951	1.088	50	20	IDGD	
O=C(CCNC(=O)c1ccc[nH]1)NC[C@@H]1CCN(C(=O)[C@H](F)Cl)[C@H]1c1cccnc1	1804460354	FZYMAOQJWGLJMR-WBAXXEDZSA-N	435.887	1.770	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)c2ccncc2)[C@H]1c1cccnc1	1805476768	TZDJFYHZOPJUQG-YLJYHZDGSA-N	445.483	1.109	50	20	IDGD	
Cc1nc(C(=O)NC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)co1	1805694512	OXYGNMMJURAYTC-OXJNMPFZSA-N	428.493	1.071	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)CCC(F)(F)F)[C@@H]1c1cccnc1	1806832425	PYLKPGWYLUTUCV-KXBFYZLASA-N	443.470	1.803	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)c1c[nH]c2cnccc12	1810061269	JINHXUGHHYTIGO-ZOCIIQOWSA-N	427.892	1.877	50	20	IDGD	
Nc1n[nH]c(CCC(=O)N2CC[C@H](CNC(=O)C(Cl)Cl)[C@@H]2c2cccnc2)n1	1813078447	PWSLZLDLEJHAKB-RISCZKNCSA-N	426.308	1.224	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)CSCC(=O)O)[C@H]1c1cccnc1	1813088706	LSWVIXOEBWMZNF-NORZTCDRSA-N	444.351	1.689	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)Cc3ccccn3)sc2C1	1815747882	BJAMRCDJMKQIKZ-CQSZACIVSA-N	430.534	1.066	50	20	IDGD	
Cc1cc(C)n(CC(=O)Nc2cc([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)n1	1815929820	LIYKJQNEMHSAKZ-KRWDZBQOSA-N	444.540	1.288	50	20	IDGD	
C[C@@](O)(CC(=O)O)CC(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCBr)n[nH]1	1816784223	ARGFOMMTEGIVIH-PXAZEXFGSA-N	445.314	1.803	50	20	IDGD	
CC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1816812746	SELPXIJMHMEMCU-INIZCTEOSA-N	427.465	1.083	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)C(F)(F)C(F)(F)C(=O)O)CC2)[C@H](F)Cl	1817116378	XHBOHGGKWUGCOV-FBCQKBJTSA-N	435.758	1.945	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc4n(n3)CCCO4)sc2C1	1819122066	GHSGQYJFKFSDIT-MNOVXSKESA-N	439.925	1.602	50	20	IDGD	
COC[C@H](NC(C)=O)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@](C)(Cl)CCl)n[nH]1	1820866740	SAIXINFPZPVVHP-IYOUNJFTSA-N	448.351	1.789	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)c3cc(CO)on3)sc2C1	1821706433	XUIYMGHKQSTCHW-SFYZADRCSA-N	429.296	1.633	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1CCc2nc(NC(=O)C3(F)CCC3)sc2C1	1827421212	LGYLNAFVWJULML-SNVBAGLBSA-N	432.481	1.260	50	20	IDGD	
Cc1ccc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)CCC(=O)NN(C)C)CC3)c(O)c1	1827568818	SXAYZDQPKYYHGV-ZDUSSCGKSA-N	445.545	1.756	50	20	IDGD	
COC(=O)c1ccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)[C@H](O)CCl)CC2)cn1	1827789342	WARCVTKBHGGMQL-ZWKOTPCHSA-N	437.924	1.701	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)/C=C\C(=O)NC2CC2)CC1	1828794039	AEEPSPGQEZBQSU-JKCVZHOFSA-N	425.957	1.695	50	20	IDGD	
O=C([C@H]1CCC(F)(F)C1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1829654805	AIPSCNBUSDCWID-HUBLWGQQSA-N	443.260	1.569	50	20	IDGD	
CN[C@H](CC(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@](C)(Cl)CCl)CC1)C(=O)O	1830317648	WQBKIJUJADHSJF-ZRGWGRIASA-N	436.380	1.905	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1830363689	JCZKGRPMMZPRPO-NHYWBVRUSA-N	429.714	1.398	50	20	IDGD	
C=C(CC(=O)OCC)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830363835	NMWGKKNLQGQTCK-FQEVSTJZSA-N	430.929	1.217	50	20	IDGD	
C/C(=C\c1cccs1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1830719831	LVZVTEFSSSSFSP-VZFRGVLESA-N	428.938	1.208	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)/C=N/O[C@@H]3CCCCO3)C2)C1	1831650144	DPLHWZZDNSLMSC-PXADHFOBSA-N	445.944	1.379	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)Oc3cccnc3)C2)C1	1831657848	BREYDIBDIBRJGR-MMOPVJDHSA-N	439.940	1.713	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)C3CCC(CO)CC3)CCO2)C1	1832523163	NMJHZKJNERDNHG-QAVIERHMSA-N	447.370	1.025	50	20	IDGD	
CC(C)n1nccc1C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)CCl)CC2)CC1	1833311916	FSNHVMCGFNXJBB-GOSISDBHSA-N	425.961	1.249	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3n[nH]c(C4CC4)c3F)CCO2)C1	1833685221	WKZKHSQLHZFYCP-YJYMSZOUSA-N	428.892	1.514	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)c(C)o1	1834096721	RDBUDJCZOCUFNI-UGSOOPFHSA-N	429.311	1.750	50	20	IDGD	
O=Cc1ccc(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)s1	1834802414	RCKJYWRHVUXHCK-INIZCTEOSA-N	427.954	1.346	50	20	IDGD	
CN(C)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)[C@@H](F)Cl)CC2)CC1	1835078634	QLVKMFOFDJQVOG-GOSISDBHSA-N	425.936	1.867	50	20	IDGD	
CN1CCCC[C@H]1C(=O)N1CCC(N2CCC(NC(=O)[C@@H](F)Br)CC2)CC1	1836413584	KKRNEQMXXUXYPH-DLBZAZTESA-N	447.393	1.733	50	20	IDGD	
COc1ncc(C(=O)N2CCC(OC3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)cc1F	1836714909	CBKXJQRYTAJMTM-KRWDZBQOSA-N	443.903	1.441	50	20	IDGD	
O=C(c1cc2ncccc2[nH]1)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836719330	PWHMULOVKCSZBG-LJQANCHMSA-N	434.924	1.775	50	20	IDGD	
Cc1cnc2c(C(=O)N3CCO[C@@]4(COCCN(C(=O)C(C)(C)CCl)C4)C3)cnn2c1	1836943554	DUQOZCKOEYJGHR-NRFANRHFSA-N	449.939	1.373	50	20	IDGD	
CC(C)n1nccc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1	1838024186	WMFPBPMMUUUYGJ-RBUKOAKNSA-N	447.363	1.770	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(-c4ccccn4)[nH]n3)CCO2)C1	1838051215	DSHUVPFMPBEUIZ-VFNWGFHPSA-N	447.923	1.559	50	20	IDGD	
C=CC(=O)N[C@@H](C)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](C)Br)CC2)CC1	1838428626	QWXBILCPBCCJLM-KGLIPLIRSA-N	444.370	1.459	50	20	IDGD	
O=C(C1CC(F)(F)C1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839197482	XWXAEUAYQHZVMV-BXUZGUMPSA-N	429.233	1.179	50	20	IDGD	
O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1[C@H]3C=CS[C@@H]31)CCO2	1839696717	UYXUKHPYQMJULU-UTXMOHQDSA-N	431.352	1.103	50	20	IDGD	
C=C(C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](Br)CC)C2)C1)C(F)(F)F	1839894917	YRVSDQCKGPKGRZ-WFASDCNBSA-N	443.260	1.735	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(Cl)o3)C2)C1	1840032970	OYPMNLKZHXTDID-ZBEGNZNMSA-N	435.702	1.786	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3nccc4occc34)C2)C1	1840151992	TVADFSJBLYMWEF-MGPUTAFESA-N	437.880	1.152	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(OC)c3)C2)C1	1840154362	VLJHKKHHIOWDKL-PXNSSMCTSA-N	426.897	1.019	50	20	IDGD	
CN(C)c1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)cn1	1840188966	OHACDWIYHZTGBS-SFHVURJKSA-N	431.320	1.021	50	20	IDGD	
C[C@@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1)c1ccccn1	1840503003	KSYJABHWWYYSDG-DYESRHJHSA-N	435.597	1.493	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CC[C@@H]3CCOC3)CCO2)C1	1840590152	FVPWXUPJKNHZKC-GJYPPUQNSA-N	447.370	1.433	50	20	IDGD	
CC(C)(C)OC(=O)N1CC2(CC[C@@H](C(=O)N3CCCC34CN(C(=O)[C@H](F)Cl)C4)O2)C1	1841080735	JQIVHWJLQPOUCU-KBPBESRZSA-N	445.919	1.893	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC2(CCCN2C(=O)c2cc(O)ncn2)C1	1841694081	MJDYRWWMCNJWGT-MKMNVTDBSA-N	425.395	1.885	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)c1ccnc(C)n1)C2	1844692583	NGCQLDQMUAMBFE-UHFFFAOYSA-N	439.428	1.749	50	20	IDGD	
O=C([C@@H](O)CCl)N1CC2(CCCN2C(=O)[C@H](O)c2cccc(Br)c2)C1	1845039761	NOSBVDGDGIQNGG-UONOGXRCSA-N	431.714	1.286	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H](O)[C@H](C(=O)N2CCCC23CN(C(=O)C(C)(C)CCl)C3)C1	1845103947	PDLMSYZOPIBQFL-CABCVRRESA-N	443.972	1.683	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2ccc3c(c2)CCCO3)C1	1846781885	YSFVIGKBUMTHCD-UHFFFAOYSA-N	435.484	1.141	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)/C=C/c1cccc(C)n1	1847250147	SONPRLVTEZKFLP-BUOJLWKXSA-N	434.500	1.739	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1ccnnc1O	1848099322	JDQKRRWMOYTAQN-IHRRRGAJSA-N	439.900	1.130	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2cc(C(=O)NNC(=O)C(=O)NC3CC3)ccc2C)cc1	9889983	TXCMAJXQJACFQA-UHFFFAOYSA-N	430.486	1.144	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(C(=O)OC)cc2)c1	21894545	GMWIJKFECHPLSH-UHFFFAOYSA-N	433.486	1.579	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NCc1ccc(N2CCSCC2)cc1	725873029	JIBFCPYFLPJOQH-UHFFFAOYSA-N	433.559	1.562	50	20	IDGD	
Cc1nccn1CCCC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	725879237	YMAPYXYOMSYIKA-UHFFFAOYSA-N	433.534	1.608	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)c2cnn(C)c2)c1	725897092	UVHFXUAASNNILK-UHFFFAOYSA-N	429.458	1.304	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)NCc1cccc(NC(=O)C2CCCC2)c1	726104126	XADXKWSENCARLV-UHFFFAOYSA-N	427.461	1.669	50	20	IDGD	
COc1ccc(CN2C[C@@H](C(=O)NNC(=O)Cc3nc4ccccc4n3C)CC2=O)cc1	726523810	ZOFROZQBEBBZLR-INIZCTEOSA-N	435.484	1.321	50	20	IDGD	
COc1cc(Br)c(CNC(=O)NN[C@]2(C)CCS(=O)(=O)C2)cc1OC	727228621	QCOYOACKKCVQNE-OAHLLOKOSA-N	436.328	1.347	50	20	IDGD	
Cc1cccn2cc(COc3ccc(C=NNC(=O)[C@H](C)NS(C)(=O)=O)cc3)nc12	728434838	QWVHFGWVAMMCMJ-HNNXBMFYSA-N	429.502	1.610	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNS(=O)(=O)c2ccc(O)c([N+](=O)[O-])c2)c1	728508775	ZILIOOCEFLGCTM-UHFFFAOYSA-N	446.235	1.695	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CNS(=O)(=O)c2cccc(C(F)(F)F)c2)c1	729372582	PPLZYSXSSURHLW-UHFFFAOYSA-N	426.376	1.317	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)N1CCC(C(=O)NCC(F)(F)F)CC1	729506680	JBOYDEKKMQWLQS-UHFFFAOYSA-N	425.411	1.773	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)c2cncc(-c3cnn(C)c3)c2)c2ccccc2c1=O	731186777	ULLHKODIRGJGHV-UHFFFAOYSA-N	431.456	1.848	50	20	IDGD	
COC(=O)c1cc(Br)ccc1S(=O)(=O)NNC(=O)c1ccccc1OC	731494265	SEPIAZHOPOIIIA-UHFFFAOYSA-N	443.275	1.868	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)N2CCN(S(N)(=O)=O)CC2)c(C)n1-c1ccccc1F	732066696	UCIIXWNHESCBBO-ATVHPVEESA-N	431.493	1.488	50	20	IDGD	
Cc1ccc(N(C)S(=O)(=O)c2cccc(C(=O)NNC(=O)c3c[nH]nc3C)c2)cc1	732084416	GESGBVIPOFZYGQ-UHFFFAOYSA-N	427.486	1.926	50	20	IDGD	
Cc1cc(Br)ccc1CNC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	732236087	OCGOVAHWGSNZMP-UHFFFAOYSA-N	430.266	1.877	50	20	IDGD	
Cn1c(N)c(C(=O)/C(C#N)=C/c2ccc(N3CCCCC3)c([N+](=O)[O-])c2)c(=O)n(C)c1=O	732578115	GUMLYYPTRSOPQT-GXDHUFHOSA-N	438.444	1.355	50	20	IDGD	
Cc1nn([C@@H]2CCS(=O)(=O)C2)c(C)c1C=NNC(=O)c1cnn(-c2ccccc2)c1	733078699	SKMNKUOILNRCGH-GOSISDBHSA-N	426.502	1.809	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)N(C)CC(=O)NNc2cnnc3ccccc23)cc1	733810672	UPFSYRGFXABJOX-UHFFFAOYSA-N	428.474	1.352	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)CCCN1C(=O)NC(C)(C)C1=O	734250663	CPQQLBNIASOFEP-UHFFFAOYSA-N	439.538	1.317	50	20	IDGD	
COc1ccc(CN2CC[C@H](NC(=O)NNC(=O)Cc3ccccc3OC)C2=O)cc1	734541372	HUZHGZWFOOUSNK-SFHVURJKSA-N	426.473	1.378	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)[C@H]2CS[C@@]3(C)CCC(=O)N23)CC1	734826107	XDYRAQJYMBWPBD-YJYMSZOUSA-N	441.554	1.170	50	20	IDGD	
COc1ccccc1N(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)c2cnn(C)c2)cc1	735450216	USAKBUVIVMSACW-UHFFFAOYSA-N	443.485	1.329	50	20	IDGD	
C[C@@H](CN1CCN(c2ccccn2)CC1)NC(=O)NNC(=O)COc1ccccc1F	735587865	YENQFBDHPIWVCW-INIZCTEOSA-N	430.484	1.141	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)NCc2cccc(C(F)(F)F)c2)o1	742453388	TUKXXUAJRKHRHB-UHFFFAOYSA-N	434.396	1.693	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)NCc1ccccc1-n1cccn1	743358583	MNBIELNDGNTBBK-UHFFFAOYSA-N	447.543	1.915	50	20	IDGD	
Cn1c(=O)c2cc(C(=O)NNC(=O)Nc3ccc(-c4ccccc4)cc3)cnc2n(C)c1=O	743827145	XUAQPGFELGTJRU-UHFFFAOYSA-N	444.451	1.766	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2ccnc(OCC(F)(F)F)c2)n1	745112687	VEAKAZJZZLHFLK-UHFFFAOYSA-N	432.380	1.335	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)Cc2csc(NC(=O)C(C)(C)C)n2)c1	745515662	GVXZRMQVFZILGE-UHFFFAOYSA-N	432.502	1.983	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2c(F)cccc2Cl)c1	746964515	ZYXAKSQSTRPVQX-UHFFFAOYSA-N	428.873	1.874	50	20	IDGD	
O=C(CCCCC/N=C1/NS(=O)(=O)c2ccccc21)NNC(=O)Cc1ccncc1	747429936	WHMRAFAPEFEXIZ-UHFFFAOYSA-N	429.502	1.071	50	20	IDGD	
O=C(Cn1cc2ccccc2n1)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	748517312	UEANBCFCRIPHPC-UHFFFAOYSA-N	441.513	1.672	50	20	IDGD	
C[C@]1(NNC(=O)NCc2ccc(NC(=O)c3ccc(F)cc3)cc2)CCS(=O)(=O)C1	749183209	LFLQIWMTLUUSJW-FQEVSTJZSA-N	434.493	1.959	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)c1cnc(-c2ncccn2)s1	749464727	DBIOYVPFYMSRQS-UHFFFAOYSA-N	437.529	1.573	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)NCc2ccccc2CS(C)(=O)=O)cc1C	749587925	UVHZOYAYKCOTSW-UHFFFAOYSA-N	432.502	1.317	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@](C)(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)C1	751556412	MQMSCMAGPVFIKL-FQEVSTJZSA-N	429.481	1.461	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)c1ccc(CS(=O)(=O)C(F)F)cc1	751573241	XVBURFGGRIADKM-UHFFFAOYSA-N	431.442	1.077	50	20	IDGD	
CCn1cc([C@@H]2C[S@@](=O)CCN2C(=O)NNC(=O)c2c(C)nc3ccccn23)cn1	753030532	HXLJBKLLSXNWIH-JGVYIQDASA-N	429.506	1.019	50	20	IDGD	
CCOC(=O)c1ccc(N2CC(NC(=O)NNC(=O)c3cnn(-c4ccccc4)c3)C2)nc1	753278322	DOWIACTYQVJTHT-UHFFFAOYSA-N	449.471	1.277	50	20	IDGD	
Cc1oc(S(=O)(=O)N(C)C)cc1C(=O)OCC(=O)NNC(=O)c1ccc(Cl)cc1	753509941	AKMBNNXRUUOAGJ-UHFFFAOYSA-N	443.865	1.110	50	20	IDGD	
C[C@]1(O)CCN(C(=O)/C(C#N)=C\c2cn(CCC(N)=O)nc2-c2ccc(Cl)cc2)C1	754368388	RZOCCOZFDHSCMN-SDQNTSPESA-N	427.892	1.969	50	20	IDGD	
CC(C)(C(=O)NNC(=O)NC1CCN(S(=O)(=O)C(F)(F)F)CC1)c1ccccc1	755159469	VUDVEBDQPAQHMI-UHFFFAOYSA-N	436.456	1.609	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)Nc1cccc(S(=O)(=O)NC2CC2)c1	755585473	NCQXIXQSRUKWHY-UHFFFAOYSA-N	427.486	1.935	50	20	IDGD	
COc1cc(CN2CC[C@H](NC(=O)NNC(=O)Cc3ccc(F)cc3)C2)cc(OC)c1	756105005	XNKONKVCORTWIP-SFHVURJKSA-N	430.480	1.990	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Nc2cc(F)cc(S(N)(=O)=O)c2)ccc1OC(C)C	756517601	YAEZZYJYXQQREQ-UHFFFAOYSA-N	440.453	1.735	50	20	IDGD	
CS(=O)(=O)CCc1ccc(NC(=O)NNC(=O)c2cc(Br)c[nH]2)cc1	757749598	SYTORSRPZKTGPJ-UHFFFAOYSA-N	429.296	1.831	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)c2cc3c(s2)CCC3)ccc1S(=O)(=O)N(C)C	757777666	XZXAHJZEZCOCKE-UHFFFAOYSA-N	438.531	1.962	50	20	IDGD	
O=C(COc1ccccc1C(F)(F)F)N1CCN(S(=O)(=O)CBr)CC1	758534853	KIVFFWYRRVZWIZ-UHFFFAOYSA-N	445.257	1.911	50	20	IDGD	
COc1ccc(Cl)cc1N1CC[C@H](NC(=O)NNC(=O)C(=O)Nc2ccccn2)C1	758742033	SPZZLARCZLAOPN-ZDUSSCGKSA-N	432.868	1.291	50	20	IDGD	
O=C(NC[C@@H]1CN(Cc2ccccc2)CCCO1)NNC(=O)c1cccc([N+](=O)[O-])c1	759362807	MLLUHEUXHWCHQY-LJQANCHMSA-N	427.461	1.830	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)CCNS(=O)(=O)c2ccc3ccccc3c2)nc1	759730841	MWGRIIVSZJPZGB-UHFFFAOYSA-N	428.470	1.833	50	20	IDGD	
C[C@H](C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1)c1cccc([N+](=O)[O-])c1	762143684	QGJGWRSWBJHSOX-HNNXBMFYSA-N	447.517	1.778	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2Br)c(Cl)n1	763482125	CXEPSGPHFKRFCV-UHFFFAOYSA-N	427.642	1.906	50	20	IDGD	
CCOC(=O)c1cnn(-c2cccc(NC(=O)C(=O)NNC(C)=O)c2)c1C(F)(F)F	763514918	AHXOSCDHAUTTKV-UHFFFAOYSA-N	427.339	1.174	50	20	IDGD	
O=C(NNC(=O)c1ccccc1O)C(=O)Nc1ccc(F)cc1-c1nc(C2CC2)no1	763525415	BGMHLSRUGVUKLZ-UHFFFAOYSA-N	425.376	1.858	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccncc3)nc3ccccc23)ncn1	763540055	UOAVGTYWXBPGPD-UHFFFAOYSA-N	443.423	1.495	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cc(Cl)ccc2F)cc(OC)c1OC	763540485	VXMZPCCBHMLSGD-UHFFFAOYSA-N	425.800	1.905	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(C)oc2C)c(OC(F)F)c1	763576183	HXLKEYPHNNZKKQ-UHFFFAOYSA-N	425.344	1.684	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(Cn3cncn3)cc2)c2ccccc2n1	763615258	CREMIQFVHBFIJL-UHFFFAOYSA-N	429.440	1.583	50	20	IDGD	
Cc1nn(-c2ccccc2)c(C)c1NC(=O)C(=O)NNC(=O)c1c(C)nc2ccccn12	763628845	GSFCORWWNCEUAC-UHFFFAOYSA-N	431.456	1.845	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2ccc([C@H](C)N3CCOCC3)cc2)c1	763629828	IPHFNWUWYHUSJF-KRWDZBQOSA-N	440.500	1.553	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)COc2cc(C)cc(C)c2)cc1NC(C)=O	763644102	FYOZBGMZEVQMRK-UHFFFAOYSA-N	428.445	1.435	50	20	IDGD	
COC(=O)CCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cccc(Cl)c2)cc1	763747896	GYMIDGXXCQLIKM-UHFFFAOYSA-N	446.847	1.033	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccccc2C(=O)N(C)C)c1C	763842014	WEZGOFNTXWXVAH-HNNXBMFYSA-N	426.473	1.559	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)N2C[C@@H](C)Oc3ccccc32)cc1	763859441	BCLRSVIJYUZZOC-CABCVRRESA-N	427.457	1.814	50	20	IDGD	
Cc1nc(-c2cccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc3ccccc3F)c2)no1	763866636	XFLOVHSNRDUVLI-NSHDSACASA-N	427.392	1.738	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)nc1)C(=O)Nc1ccc(OCC2CCOCC2)cc1	764091281	AGQSYYQXTDKLDT-UHFFFAOYSA-N	432.864	1.940	50	20	IDGD	
CCN(CC)CCOc1ccccc1NC(=O)C(=O)NNC(=O)c1ccc(C)cc1O	764105611	WASGAZGUYKTSMZ-UHFFFAOYSA-N	428.489	1.821	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccc(OC[C@@H]2CCCO2)cc1	764131440	GWHQSSAXZNKNFC-SFHVURJKSA-N	427.457	1.582	50	20	IDGD	
CC[C@@H](C)NS(=O)(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2ccc(C#N)cc2)c1	764183541	ZVTKFVGMLYDJSK-CYBMUJFWSA-N	443.485	1.035	50	20	IDGD	
Cc1cnn([C@H]2CCCc3ccccc32)c1NC(=O)C(=O)NNC(=O)Cc1cccnc1	764267842	AZOFJBHQTMNHCW-IBGZPJMESA-N	432.484	1.841	50	20	IDGD	
O=C(NNC(=O)c1cc(F)ccc1Br)C(=O)Nc1cnn(-c2ccccn2)c1	764270291	KJJAEWJGNSJFRJ-UHFFFAOYSA-N	447.224	1.569	50	20	IDGD	
COC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)c1	764386868	DTIBFGZPUDCANR-UHFFFAOYSA-N	440.391	1.794	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)C(=O)Nc1ccc(N2CCCC2=O)cc1	764404129	FZQVLYRBQUOUFP-UHFFFAOYSA-N	428.470	1.397	50	20	IDGD	
CCN1CCC(n2nccc2NC(=O)C(=O)NNC(=O)CSc2ccccc2O)CC1	764405641	VEADDLSORGTARO-UHFFFAOYSA-N	446.533	1.124	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COCCO1)C(=O)Nc1ccc(F)cc1-c1nc2ccccc2s1	764424719	KOWUGSXKODPIRD-HNNXBMFYSA-N	444.444	1.604	50	20	IDGD	
Cc1cc(C(C)(C)C)ccc1OCCCC(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1	765070569	LDPJKEMFQUQTPN-INIZCTEOSA-N	425.551	1.969	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)Nc1cccc([N+](=O)[O-])c1	765312512	HJOJGDLFIYASTI-UHFFFAOYSA-N	426.433	1.206	50	20	IDGD	
CCSc1cc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)ccn1	766653185	RRNFSFAYLZAUSX-UHFFFAOYSA-N	427.530	1.413	50	20	IDGD	
CC(C)(C)[C@@H](Br)C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	766751949	YNWXHOISAGFMQM-OCCSQVGLSA-N	429.267	1.327	50	20	IDGD	
Cc1noc(C)c1S(=O)(=O)NCC(=O)NNc1ccc(C(F)(F)F)cc1[N+](=O)[O-]	767862424	PJBNUEYLTYZTKG-UHFFFAOYSA-N	437.356	1.640	50	20	IDGD	
Cn1c(COc2ccccc2)nnc1SCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	768414266	MZUFUCPUWLJKOS-UHFFFAOYSA-N	442.457	1.856	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)c1nnn(-c2cccc([N+](=O)[O-])c2)c1C	768636201	PDODEVLWBJXFOS-UHFFFAOYSA-N	446.445	1.653	50	20	IDGD	
Cn1cc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c(-c2cccs2)n1	768675681	RXYYMSFYXIPALK-OAHLLOKOSA-N	442.453	1.293	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)/C=C\c2cccc(Cl)c2)c1	768867498	RXDALZOQJUVWTN-KTKRTIGZSA-N	443.934	1.825	50	20	IDGD	
CC(C)(CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)c1ccncc1	768986830	YCRKMYUBBGIIBE-UHFFFAOYSA-N	445.545	1.788	50	20	IDGD	
COC(=O)c1ccc(S(=O)(=O)NNC(=O)c2cc(C)n(-c3ccccc3)c2C)cn1	769622414	ZMLHTSRRISZVPT-UHFFFAOYSA-N	428.470	1.899	50	20	IDGD	
CSCCNC(=S)NNC(=O)c1cccc(S(=O)(=O)N2C[C@H](C)C[C@@H](C)C2)c1	769777980	KVXOLYDTTQPXGX-ZIAGYGMSSA-N	444.648	1.825	50	20	IDGD	
CCCNC(=O)CN1CCC(NC(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)CC1	770188587	LEWCLQUPJJLHTE-AWEZNQCLSA-N	439.944	1.428	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)[C@H]3CCN(c4ccccc4Br)C3=O)nc21	770968757	MXJRIQDTUDZXSK-SECBINFHSA-N	446.265	1.328	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)[C@@H]3CCCN(c4ncnc5sccc45)C3)nc21	770990100	LDZWOZOCRPAMLS-SNVBAGLBSA-N	425.478	1.433	50	20	IDGD	
N#C/C(=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)N[C@H](CO)C1CC1	771046464	PAJHOYQOXBJZAF-IDGGIGOKSA-N	427.892	1.873	50	20	IDGD	
Cc1ccn(CC(=O)NNC(=O)[C@@H]2Cc3ccccc3CN2Cc2ccccc2)c(=O)c1	772155374	JYOORPGIBVKBNI-QFIPXVFZSA-N	430.508	1.931	50	20	IDGD	
COC[C@@H](NC(=O)NNC(=O)c1csc(N2CCOCC2)n1)c1ccc(F)c(F)c1	773451519	ZPENZWUAJCFDTC-CQSZACIVSA-N	441.460	1.590	50	20	IDGD	
CS(=O)(=O)c1c(F)cc(NC(=O)C(=O)NNc2ccc(C(F)(F)F)cn2)cc1F	773667243	MKQIXIICUVVCSL-UHFFFAOYSA-N	438.334	1.864	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2cccc(OCC(=O)Nc3ccccc3)c2)n1	773724403	QAQBYIQNWBEXME-UHFFFAOYSA-N	436.428	1.585	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN[C@@H](C)c2cccc(N3CCCC3=O)c2)cc1OC	775281125	UGPLJKUWCLEYCG-HNNXBMFYSA-N	440.500	1.942	50	20	IDGD	
O=C(Cc1cccc2ccccc12)NNC(=O)N[C@H]1CCO[C@@]2(CCS(=O)(=O)C2)C1	776076094	IEIUHICSFGRRLV-UWJYYQICSA-N	431.514	1.449	50	20	IDGD	
CC(C)[C@H](NC1CCOCC1)C(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776201162	GICVKAZKECMPPY-KRWDZBQOSA-N	441.573	1.415	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)N[C@H]2CCCN(c3ccc(C#N)cc3)C2=O)cc1	780895357	ZJEXYRUXRCAKGL-IBGZPJMESA-N	432.440	1.335	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)[C@H]1CCN1C(=O)OC(C)(C)C	781342016	ZDNJMRNCNJXZSB-CYBMUJFWSA-N	441.868	1.662	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCc2ccccc2CN2CC[C@@H](O)C2)cc1OC	781780589	IBNXXYPPMWHQOA-GOSISDBHSA-N	428.489	1.415	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(OC3COC3)cc2)cc1	782121359	VRDZNIBKTPLIGR-AWEZNQCLSA-N	443.456	1.416	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)ccc1N(C)C	782897387	OOGDVAUNMNQMSM-UHFFFAOYSA-N	446.533	1.062	50	20	IDGD	
Cc1nnnn1-c1cc(NC(=O)C(=O)NNc2ccc(Br)cc2)ccc1F	783010090	WJMZFHGMPJVCPX-UHFFFAOYSA-N	434.229	1.954	50	20	IDGD	
Cc1c(COc2ccccc2)cccc1NC(=O)C(=O)NN[C@@]1(C)CCS(=O)(=O)C1	783426442	HKAQKKYWRAMOJV-NRFANRHFSA-N	431.514	1.711	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2ccccc2SCC(F)(F)F)CCS(=O)(=O)C1	783427268	NYBDFAYBQIHEBQ-AWEZNQCLSA-N	425.454	1.478	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2ccc(CCCc3ccccc3)cc2)CCS(=O)(=O)C1	783428539	XAXBTVBSSHWSCR-JOCHJYFZSA-N	429.542	1.998	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2ccc(NC(=O)C(=O)NN(C)c3ccccc3)cc2)C[C@@H](C)O1	783434399	LEBPHEWDRRYBFE-IYBDPMFKSA-N	446.529	1.591	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1ncn(C(C)(C)C)n1	784832953	IKHNPKQZAMPFFI-UHFFFAOYSA-N	437.526	1.192	50	20	IDGD	
COc1ccc(C(=O)N2CCN(C)CC2)cc1NC(=O)C(=O)NNc1cc(Cl)ccn1	784860669	LNJFLUUDFQMBOV-UHFFFAOYSA-N	446.895	1.213	50	20	IDGD	
CC1(C)CCC[C@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)C1	785905500	QHAAWMQRECUGIA-INIZCTEOSA-N	438.550	1.620	50	20	IDGD	
COC(=O)CCc1cccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)c1	786413553	BUJLWCOIQBXMRA-MRXNPFEDSA-N	441.484	1.962	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)CCC(=O)N2CCCC#N	787889071	JRRNPNADUUTENU-UHFFFAOYSA-N	449.467	1.678	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1nc2c(s1)CCCCCC2	789756389	CXTZTBAGPSXUDC-UHFFFAOYSA-N	435.531	1.380	50	20	IDGD	
CNS(=O)(=O)c1cccc(NC(=O)C(=O)NNc2cccc(F)c2[N+](=O)[O-])c1C	790994115	PUWDXLZVDITWDE-UHFFFAOYSA-N	425.398	1.032	50	20	IDGD	
CC(C)N(C)C(=O)c1ccc(Cl)c(NC(=O)C(=O)NNc2nc3ccccn3n2)c1	792392059	PQBXNUPMIXVSJS-UHFFFAOYSA-N	429.868	1.945	50	20	IDGD	
COC(=O)Cc1cccc(NC(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)n1	792407538	UWRHGCSUEKDDHR-UHFFFAOYSA-N	438.444	1.554	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)c2c[nH]c3ccc(I)cc3c2=O)n1	794083326	HLPTXFRNYTZJIO-UHFFFAOYSA-N	448.220	1.911	50	20	IDGD	
CCC(=O)c1ccc(Cl)c(S(=O)(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c1	794579026	ICDAUTBZUASYBK-UHFFFAOYSA-N	444.918	1.960	50	20	IDGD	
CN(C(=O)CSCC(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1)C1CCCCC1	794717699	AKLGIOBZQHMNSC-UHFFFAOYSA-N	442.607	1.904	50	20	IDGD	
CCCCCn1nc(C(=O)NNS(=O)(=O)c2c(C)cnn2C)c2ccccc2c1=O	795283964	OSMSZSHEYOETDH-UHFFFAOYSA-N	432.506	1.252	50	20	IDGD	
O=C(Cc1cccnc1)NNS(=O)(=O)c1cc(Br)c(F)cc1[N+](=O)[O-]	795314551	OCBGOMFFZFNZHF-UHFFFAOYSA-N	433.215	1.444	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(Cc3nnc4n3CCCCC4)cc2)n1	797369621	BGCYRRAHTRYUEB-UHFFFAOYSA-N	447.499	1.698	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2cc(N3CCOCC3)ccc2C)cc1	797535972	UMWGMIASCHLHJL-UHFFFAOYSA-N	440.500	1.559	50	20	IDGD	
CN(CCC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)C(=O)OCc1ccccc1	798126722	DABGDUFNFIKFBT-UHFFFAOYSA-N	448.501	1.902	50	20	IDGD	
Cc1ccc(-c2ccnn2C)cc1NC(=O)C(=O)NNC(=O)c1cc([N+](=O)[O-])ccc1O	799261659	MVNBSTKLWVGMOR-UHFFFAOYSA-N	438.400	1.409	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(F)c(S(=O)(=O)N3CCCC3)c2)cc1	801105234	BXNMECYJNKFELW-UHFFFAOYSA-N	448.476	1.318	50	20	IDGD	
O=C(COCC(=O)NNC(=O)Nc1ccc(Br)cc1)NCc1cccnc1	801994685	XUMUXULGPLIZPY-UHFFFAOYSA-N	436.266	1.330	50	20	IDGD	
COc1ccc(Cl)c(NC(=O)NNC(=O)CCNS(=O)(=O)c2cccs2)c1	802109884	JPQIJLFRMMDHJP-UHFFFAOYSA-N	432.911	1.931	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(N2C[C@@H](C(=O)NNc3ncccc3F)CC2=O)cc1	804219618	CJXLKZSNQIVPPJ-AWEZNQCLSA-N	449.508	1.747	50	20	IDGD	
CNS(=O)(=O)c1cc(NC(=O)NNC(=O)c2cc(-c3ccc(C)cc3)[nH]n2)ccc1F	806545599	YVDPLQBRAVQPMD-UHFFFAOYSA-N	446.464	1.899	50	20	IDGD	
CNS(=O)(=O)c1cc(NC(=O)NNC(=O)c2cccc(Br)c2)ccc1F	806545724	IFGZBJFQAAEXPA-UHFFFAOYSA-N	445.270	1.963	50	20	IDGD	
CN(C)CCn1ncc(C(=O)NNC(=O)CNC(=O)c2cccs2)c1-c1ccccc1	806736574	LTFSEFDWPNWETJ-UHFFFAOYSA-N	440.529	1.364	50	20	IDGD	
Cn1ncc(NC(=O)C(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])c1-c1ccccc1	806974333	FPJTWAAEIOMDIE-UHFFFAOYSA-N	438.400	1.160	50	20	IDGD	
COCc1csc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc3ccccc3c2)n1	806975128	OOZUMJSQTMQMPG-LBPRGKRZSA-N	428.470	1.996	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2cc(Cl)cc3c2OCC(=O)N3)cc1	806977313	DJPSZZHUVJLBCK-UHFFFAOYSA-N	446.847	1.398	50	20	IDGD	
CN1CCN(C(=O)NNC(=O)CCCCc2ccc(I)cc2)CC1	807382743	NXEQVNLNGSPDGY-UHFFFAOYSA-N	444.317	1.992	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)NC[C@@H](N3CCOCC3)C(F)(F)F)n[nH]2)cc1	807542011	XFXUYLLDETYULI-MRXNPFEDSA-N	440.426	1.592	50	20	IDGD	
COC(=O)c1cn(-c2cccc(NC(=O)C(=O)NNc3nccc4sccc34)c2)nn1	812983686	CQIHHPHGEYJVIA-UHFFFAOYSA-N	437.441	1.745	50	20	IDGD	
Cc1nsc(NC2CC2)c1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	814194297	FCDXOVGLSWBWBJ-UHFFFAOYSA-N	449.558	1.885	50	20	IDGD	
CCn1ncc(C(=O)NNC(=O)c2cccc(S(=O)(=O)Nc3ccccc3OC)c2)n1	814697788	CNTVKNYKXUAZPC-UHFFFAOYSA-N	444.473	1.182	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1cnc(C(F)(F)F)c(C#N)c1	814737121	XIUHHYMAAQZPAU-UHFFFAOYSA-N	440.407	1.648	50	20	IDGD	
CC(=NNC(=O)[C@H](C)Oc1cccc(Cl)c1)c1ccc(S(=O)(=O)CC(N)=O)cc1	814916402	HYBYXZIDKGLXMQ-ZDUSSCGKSA-N	437.905	1.907	50	20	IDGD	
Cn1ncc(C(=O)NNC(=O)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)c1Br	816509043	CDQZCECLACAPML-SNVBAGLBSA-N	430.303	1.591	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)c1cc([N+](=O)[O-])ccc1SCCO	817052556	GQANUDACOGDZDK-UHFFFAOYSA-N	440.503	1.686	50	20	IDGD	
C=CCn1c(=O)c2ccccc2n2c(SCC(=O)NNC(=O)c3ccncc3)nnc12	912768468	CBAPGWNRZWYJCT-UHFFFAOYSA-N	435.469	1.179	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)/C=C\c1ccccc1)C(=O)NNC(=O)c1ccncc1	912769100	XKYDTKSHOLTUMN-OOXMNIKJSA-N	434.543	1.555	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)CNS(=O)(=O)c2ccc(OC(F)(F)F)cc2)cc1	915783661	QERGTTBEIOFNIL-UHFFFAOYSA-N	445.419	1.887	50	20	IDGD	
COc1cc(C(C)=NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)ccc1O	916257924	GRVIWEPEQFWANF-UHFFFAOYSA-N	433.486	1.576	50	20	IDGD	
O=C(NCc1cccnc1OCC(F)(F)F)NNC(=O)c1nnc(O)c2ccccc12	916396955	AEROKVYXTCQFFC-UHFFFAOYSA-N	436.350	1.816	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)NCCC(=O)N1CCN(C)CC1	916433504	YPSVHQUQGKSPDJ-INIZCTEOSA-N	427.505	1.102	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)N[C@H](CN1CCCC1=O)c1ccccc1	916459955	SCBFRMGVKMYPKM-MRXNPFEDSA-N	441.444	1.668	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@@H](c2ccccc2)N2CCOCC2)c1	916508572	AEBZMFWIVPPJSN-IBGZPJMESA-N	446.529	1.108	50	20	IDGD	
Cc1cccc(C)c1OCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	916643813	IEZWNFVUQDWHRW-UHFFFAOYSA-N	434.518	1.577	50	20	IDGD	
COC(=O)COc1cccc(C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)c1	917530893	HTGKFHYNYKLHRN-UHFFFAOYSA-N	438.440	1.604	50	20	IDGD	
CNC(=O)COc1cccc(CNC(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)c1	918095781	GRJDCOCQSKIWCA-INIZCTEOSA-N	428.489	1.726	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCN(c2ccc(Cl)cc2)C1=O)c1csc(N2CCOCC2)n1	919689706	CGNBGPZJQFYMIJ-CQSZACIVSA-N	449.920	1.447	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)N[C@H]1CC(=O)N(c2ccccc2)C1	921078841	YJVGAXZREOCYNI-AWEZNQCLSA-N	444.517	1.038	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)[C@@H](CC(C)C)N2C(=O)[C@H]3CC=CC[C@H]3C2=O)c1	929085601	GJLIHXQIKJXCGC-CEXWTWQISA-N	443.500	1.831	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)c1ccc(N2CCC[C@@H](C(N)=O)C2)cc1	1321238917	DKDQYDKIBAXFCI-OAHLLOKOSA-N	446.529	1.557	50	20	IDGD	
COCCn1nc(C(=O)NNc2cc(C(F)(F)F)nc(-c3ccccn3)n2)ccc1=O	1321844997	PSKPBUQGPZIZED-UHFFFAOYSA-N	435.366	1.517	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)[C@H]1CC12CCS(=O)(=O)CC2	1325808881	XTVMERMAHQIUQX-SMDDNHRTSA-N	445.335	1.579	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)Cn2nc3n(c2=O)CCCCC3)c(OC)cc1Cl	1344719527	WRLOQKDTFUAKOX-UHFFFAOYSA-N	438.872	1.295	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H]1CC(c3ccccc3)=NN1)C2)[C@H](F)Cl	1778027924	CZMCNRHNCFTRCL-DCXXXQMHSA-N	436.915	1.801	50	20	IDGD	
CC(=O)N(C)[C@@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CO[Si](C)(C)C)C2	1778106516	YSLZFFHJDQXZGE-XAUMDUMWSA-N	427.618	1.219	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1n[nH]c3ccc(C#N)cc13)CCO2	1779298660	HLAMLBOYPBPGDA-OAQYLSRUSA-N	441.564	1.730	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(OC)nn3)C2)C1	1779902433	QZFNRRZPIGLRLT-PXAZEXFGSA-N	427.299	1.102	50	20	IDGD	
CCc1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](Cl)COC)C3)nn1C	1779910910	JQDVBNQQKOJDJK-XAUMDUMWSA-N	426.945	1.364	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(CN(C(=O)c3cnc[nH]3)CCO2)C1	1780094995	BNZJZDJJDCWTBL-FQEVSTJZSA-N	443.416	1.001	50	20	IDGD	
Cc1nc(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](F)Br)C2)no1	1780770785	BKBFIXCFYXXMST-DIOULYMOSA-N	433.278	1.125	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Cl)C2)c1ccc(O)c([N+](=O)[O-])c1	1780873651	VPFUWPZSQGZCQI-RVKKMQEKSA-N	429.832	1.962	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)Cc3ccc(C(=O)OC)s3)CCO2)C1	1781218062	MNJHCOKQRFWEPQ-KUHUBIRLSA-N	428.938	1.925	50	20	IDGD	
CN(C)c1cncc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)c1	1781326319	NHPICTNSYMKVHT-PBHICJAKSA-N	429.290	1.282	50	20	IDGD	
CO[C@H](C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1)c1ccccc1	1781328592	TVXHLHHTTUHZTN-RLFYNMQTSA-N	429.286	1.895	50	20	IDGD	
N#Cc1ccc(F)c(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)c1	1781965774	WNQYXILRERDWFD-WMLDXEAASA-N	428.233	1.831	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](CN)c1ccccc1)C2	1782170776	XJPRIZHAGDMUDA-JZJXAQOMSA-N	437.968	1.497	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(O)c(F)c1)C2	1782177943	AYLDMXANXMZFEB-WIBUTAKZSA-N	428.888	1.913	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)Cc3cnc4ccccn34)CCO2)C1	1783341896	FFCMCBSOMQTFIM-OXQOHEQNSA-N	449.349	1.880	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)[C@@H](N)Cc3cscn3)CCO2)C1	1783348121	VPVAIBQXSPCKCI-JKIFEVAISA-N	445.383	1.016	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)Cn3nnc4ccccc43)CCO2)C1	1783529750	MHPIKERXRAUKTF-UGSOOPFHSA-N	436.310	1.045	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3c[nH]c4cccc(OC)c34)CCO2)C1	1783880599	FYPAGDLGEFCCAB-BTYIYWSLSA-N	435.908	1.874	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)CC(C)(C)C(=O)OC(C)(C)C)CCO2)C1	1783881311	KTIZQOVCOXYXFF-BTYIYWSLSA-N	446.972	1.828	50	20	IDGD	
Cc1cc(C(N)=O)cc(C)c1C(=O)N1CCO[C@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783946563	PTGHJKOBWUQSLM-IBGZPJMESA-N	428.316	1.650	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4ncccc4[nH]3)C[C@@H]21	1786407377	VYECVUIGYSZHOO-DCGLDWPTSA-N	435.322	1.941	50	20	IDGD	
CC[C@H](NC)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C[C@@H]21	1786973550	VAEYLVHLJPCEAI-SNVXUZMMSA-N	446.498	1.849	50	20	IDGD	
C=CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]2C1	1787443728	RSGAMPWDTLFTPT-QXKUPLGCSA-N	447.935	1.970	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]3C2)cc1N(C)C	1787449867	YQQDYKBROVLXMB-DFEHZGFQSA-N	427.904	1.889	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3ON=C(c4ccccc4)O3)[C@H]2C1	1788516827	WMZOWWBEWXYJOA-OGNFBWPZSA-N	449.935	1.966	50	20	IDGD	
COc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCBr)C[C@@H]32)c(O)c1	1789481367	PCMVDWBROSABIZ-NUTKFTJISA-N	441.322	1.779	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)Cn3cncn3)C[C@@H]21	1790960892	SVLCNWBIYPZTAZ-GVRJEKJASA-N	442.358	1.067	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cn3cc(C)cn3)C[C@@H]21	1790962046	VCVQWYNUIJFNBA-JONQDZQNSA-N	427.343	1.345	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc4ncccn34)C[C@@H]21	1791056140	OXCOAHDFMHCZMF-ABHRYQDASA-N	436.310	1.106	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nc4ccccn4n3)C[C@@H]21	1791057118	CTMDYZZUWUFCCL-RFGFWPKPSA-N	436.310	1.106	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)ccc3O)C[C@@H]21	1791060499	FZTYQJNMNLXPEW-AZLWOZFGSA-N	427.295	1.475	50	20	IDGD	
Cc1cnn([C@H](C)C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Br)C[C@@H]32)c1	1791597577	QZXIQUPQSNPECR-QTVXIADOSA-N	431.306	1.423	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1ccc(C2(NC(=O)[C@@H]3CCC(=O)N3C)CCC2)cc1	1791600948	QRCKDEXMRLKACG-KRWDZBQOSA-N	429.521	1.114	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3c[nH]c4ncccc34)[C@H]2C1	1792206876	TXFQGWPLYYSQFK-KANFNMMFSA-N	448.951	1.729	50	20	IDGD	
CN1CCN(c2ccc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)[C@H](O)CCl)C4)cc2)CC1	1792529582	HDDOTRYZMVGCEI-GSEOLPGOSA-N	434.968	1.290	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccn3ccnc13)C2	1792870317	CEZUNCAAXFDXTE-HGTKMLMNSA-N	435.322	1.569	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnn3c(C)cc(C)nc13)C2	1793449942	UTXYSMORXIRZJV-MVJTYMMSSA-N	433.940	1.957	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)c1ccccc1Cl)C2	1795117053	KHIJTICBCJVGSS-CZAMWMTLSA-N	445.741	1.748	50	20	IDGD	
O=C1CSc2cc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@@H](F)Cl)ccc2N1	1796363636	UWVSNNIPEPQBJT-OXUXUCFPSA-N	427.885	1.468	50	20	IDGD	
C=CCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Cl	1796367426	INJCBULANIZVML-XFIYOXNOSA-N	447.935	1.970	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H]2C[C@H]2C[C@@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Cl	1796370690	KZFMWZDHUWULNS-OLHNTFIZSA-N	445.919	1.508	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2c(c1)NC(=O)CO2	1797449418	RDAMOOMCIVZOAG-YGTYGHESSA-N	435.908	1.628	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)Nc1cnccn1	1797778763	CXGOZXGBWWZXSX-HAFSJTIUSA-N	440.342	1.040	50	20	IDGD	
Cc1nc[nH]c1CSCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@](C)(Cl)CCl	1799276568	NNJKMLDTKPXINB-VLWCASSMSA-N	449.404	1.777	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CCc3ccccc31)C2)[C@H](F)Br	1799352317	PQRQZAMUAGRJQZ-KUHBDSFDSA-N	425.298	1.997	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc(B(O)O)c1)C2	1799775704	FLQLEVQFKKNSOU-BCDXTJNWSA-N	442.708	1.594	50	20	IDGD	
O=C(CCBr)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1CC[C@H]2CCC(=O)N2C1	1799927169	IYNRMNBDSKUICX-GVRJEKJASA-N	426.355	1.811	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(F)nc1F)C2	1800638241	VELWVFYKGKXLHF-IQOUGMIPSA-N	432.265	1.737	50	20	IDGD	
CCOc1cccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)c1O	1800695166	GWZHSPKWYLSPJN-BCDXTJNWSA-N	438.289	1.036	50	20	IDGD	
C[C@@H](NC(=O)OCc1ccccc1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](O)CCl)C2	1801942888	QVIGLRMXACWESW-SOVHRIKKSA-N	437.924	1.539	50	20	IDGD	
Cn1cc(C(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]2c2cccnc2)c(C(F)F)n1	1803139357	ONEJDULBSIDNIZ-XNRPHZJLSA-N	441.866	1.672	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H](CNC(=O)c2cnnn2C)[C@H]1c1cccnc1	1804740585	WMQADRXDKBIOEQ-XNRPHZJLSA-N	435.326	1.561	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1)c1ccc[n+]([O-])c1	1804778717	AECZIWWKZSFWQS-QAPCUYQASA-N	433.306	1.820	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)[C@H]1CC=CCC1	1808125567	QQGKMBCSCAFFKT-XJABCFGWSA-N	433.317	1.437	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)CC(F)(F)C(=O)O)[C@H]1c1cccnc1	1808295133	RODQEOLEWPQEJK-ZKYQVNSYSA-N	448.264	1.981	50	20	IDGD	
CC(=O)N[C@H](C)C(=O)N1CC[C@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]1c1cccnc1	1808317992	PUQGJTBUMXWIEQ-GABDYKALSA-N	429.348	1.848	50	20	IDGD	
O=Cc1ccc(C(=O)N2CCCC3(CCN(C(=O)c4ccc(B(O)O)cc4)CC3)C2)s1	1809982423	PADMSUNUDVIARB-UHFFFAOYSA-N	440.330	1.399	50	20	IDGD	
Cn1ccc(CC(=O)N2CC[C@@H](CNC(=O)CO[Si](C)(C)C)[C@@H]2c2cccnc2)n1	1810542741	XPKDPDMTSGCCIZ-UWJYYQICSA-N	429.597	1.915	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)[C@@H](COC)NC(C)=O)[C@H]1c1cccnc1	1810560319	YTRMALSQGIPCDT-FCGDIQPGSA-N	438.956	1.646	50	20	IDGD	
C[C@H](NC(=O)c1ccccn1)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Cl)[C@@H]1c1cccnc1	1812347686	PFWXHCWBWZYYGG-OXXUSNJHSA-N	447.898	1.835	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2ccc([N+](=O)[O-])[nH]2)[C@@H]1c1cccnc1	1813032716	LJCQXACJNRQONV-GRDNDAEWSA-N	435.868	1.891	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)Cn2ccnc2)[C@@H]1c1cccnc1	1813033291	LIMHXXQQKKRWOK-DSLXNQLJSA-N	433.940	1.874	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)[C@@H]2CCCS2)[C@H]1c1cccnc1	1813074455	RVHNFGGKDVBLAO-ZWOKBUDYSA-N	433.578	1.356	50	20	IDGD	
C[C@H](C(=O)NC[C@@H]1CCN(C(=O)[C@](C)(Cl)CCl)[C@H]1c1cccnc1)n1cnnn1	1813473723	OGVKYSRLILKHIN-OYUZRVEBSA-N	440.335	1.571	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)C1CCSCC1)CC2)c1ccc(B(O)O)cc1	1815347853	SRZQPINMPROVIY-OAHLLOKOSA-N	445.375	1.192	50	20	IDGD	
Cc1cnc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)[nH]n2)cn1	1816410080	MFWPCJHFVMDCMH-KRWDZBQOSA-N	449.475	1.126	50	20	IDGD	
O=C(CCC(F)(F)F)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1817095405	ZORXHZOBMGXWHA-OAHLLOKOSA-N	438.215	1.738	50	20	IDGD	
CC(=O)OC[C@H](OC(C)=O)C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](F)Cl)sc2C1	1817125368	MSAGNNDXGDJZPG-XHVZSJERSA-N	435.861	1.084	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)C1(C#N)CC1)CC2	1817279737	AQFSTAZWXRBRLK-BUGPSZFBSA-N	439.501	1.493	50	20	IDGD	
CN[C@@H](CC(=O)Nc1cc([C@H]2CCCCN2C(=O)CCBr)[nH]n1)C(=O)O	1817362849	CFPSFXFMONAQPB-NWDGAFQWSA-N	430.303	1.250	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](C)Nc2cnccn2)n[nH]1	1819422774	BWURLINAIDDGBE-KCQAQPDRSA-N	435.916	1.946	50	20	IDGD	
CC(C)(CCl)C(=O)N[C@@H]1CCc2nc(NC(=O)CCc3nc(N)n[nH]3)sc2C1	1819550382	RBDZLJFQKLECHO-SECBINFHSA-N	425.946	1.653	50	20	IDGD	
CCS(=O)(=O)CC(=O)N1CCCC[C@@H]1c1cc(NC(=O)CO[Si](C)(C)C)n[nH]1	1819591837	OTRNBZJBEYSBLE-CQSZACIVSA-N	430.603	1.688	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@@H](F)Br)[nH]n1)c1c[nH]c(=O)cn1	1820247459	FKYOCVNEZFPGLK-ZWNOBZJWSA-N	427.234	1.489	50	20	IDGD	
CCc1noc(C)c1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCC(=O)NN(C)C)CC2	1820654505	IFUVCLVYVDXBFV-LBPRGKRZSA-N	448.549	1.601	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(=O)cco2)[nH]n1	1822413401	UQGANSPLRWDZKK-HNNXBMFYSA-N	430.465	1.042	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1	1822416810	QGIDUIYYLKYYBW-AAEUAGOBSA-N	443.346	1.558	50	20	IDGD	
CC[C@@H](NC(C)=O)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](C)Br)sc2C1	1825635957	NEJDBWJGVPGGRA-FBIMIBRVSA-N	431.356	1.753	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@H]1CCc2nc(NC(=O)[C@H](C)n3cncn3)sc2C1	1826781729	HHSHVHALEXNJAH-VWYCJHECSA-N	441.355	1.939	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC[C@H]1C1CCN(C(=O)C(F)(F)Cl)CC1	1827055254	SRPPIFJJSMZHFX-INIZCTEOSA-N	428.672	1.431	50	20	IDGD	
O=C(c1cccc(F)n1)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827057542	HYUQEHUVACEKAT-HXUWFJFHSA-N	439.296	1.448	50	20	IDGD	
COC1(CC(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2cccc(B(O)O)c2)CC3)CCC1	1827405145	XQWGFVXZSOWJBH-OAHLLOKOSA-N	443.334	1.008	50	20	IDGD	
Cc1c[nH]cc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1	1827784137	WAPTUJDMXFGPCO-HXUWFJFHSA-N	438.532	1.869	50	20	IDGD	
N#Cc1c[nH]c(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)CC2)c1	1828924354	QRZGLRJXYZKWGJ-FQEVSTJZSA-N	449.515	1.432	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccno2)CC1	1828925350	KBPBBGBCYWWXFI-KRWDZBQOSA-N	426.477	1.220	50	20	IDGD	
Cc1nc[nH]c1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1	1828926143	AFRAFPSNWWVPQC-SFHVURJKSA-N	439.520	1.264	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)C3CC(F)(F)C3)CCO2)C1	1829992321	FDPRNZKBMXJAEP-XHDPSFHLSA-N	425.270	1.272	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc4ncccn34)C2)C1	1830362136	MGTXCWUKNOFNGB-FQEVSTJZSA-N	435.912	1.064	50	20	IDGD	
O=C([C@H](F)Cl)N1CCC([C@@H]2CCCCN2C(=O)Cn2cccc([N+](=O)[O-])c2=O)CC1	1831186720	BXNRQCUSGYPXRV-YOEHRIQHSA-N	442.875	1.911	50	20	IDGD	
CCS(=O)(=O)CC(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](C)Br)CC1	1831648424	FFOHEDAMMDGKSA-HIFRSBDPSA-N	437.400	1.824	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C=C/c3cc(C)on3)C2)C1	1831651336	ORBWSBVCWRMDKS-YWFTZVROSA-N	425.913	1.860	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@H](Cl)COC)CC1	1831830556	DXKYUNZACMPUNJ-DJIMGWMZSA-N	430.977	1.568	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2cnccn2)CC1	1832300537	WQRHAHDMKUKWDF-DORXLWPQSA-N	448.332	1.103	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)/C=C/c3ccoc3)CC2)CC1	1833753987	JUOGHLFLPSUHAK-ONEGZZNKSA-N	445.564	1.237	50	20	IDGD	
Cc1ccsc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1833945934	PMRFDMNJRHJCQC-BBRMVZONSA-N	435.315	1.817	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)s1	1833959269	CBAWSVWIMKSLSC-CZUORRHYSA-N	435.315	1.817	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](C)CBr)C3)C2)cn1	1833991502	UPVYASMOVYNNAG-KUHUBIRLSA-N	440.338	1.491	50	20	IDGD	
CCn1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@](C)(Cl)CCl)C3)C2)n1	1834409118	XOJKYRARCMDDMY-MSOLQXFVSA-N	433.336	1.209	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)CC(F)(F)F)CCO2)C1	1835327778	UXUJILHNHKLKFW-SMDDNHRTSA-N	431.249	1.426	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)c1ccncc1Cl	1835899123	PEIDZWQIDMWWPB-QGZVFWFLSA-N	429.348	1.520	50	20	IDGD	
O=Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)s1	1835946086	FAKQDVDEUXHLJM-CZUORRHYSA-N	449.298	1.321	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)c3cc(O)no3)CC2)CC1	1835973182	LPXAYMIRGRVEKG-GFCCVEGCSA-N	443.342	1.596	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](F)Cl)CC2)CC1)c1ccc(-n2cccn2)nc1	1835979028	WVGTUSLCQAYYKS-IBGZPJMESA-N	448.930	1.987	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)c1c(F)cccc1F	1836223738	JMKBPBMFLWDZTM-QGZVFWFLSA-N	429.895	1.750	50	20	IDGD	
O=C(c1nccc2nc[nH]c12)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836717797	KJGMGRYLEXYBIF-INIZCTEOSA-N	435.912	1.170	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4nccn4c3)C2)C1	1837713053	FBWBBAUFWMWDAK-OAQYLSRUSA-N	446.580	1.256	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(F)n3)CCO2)C1	1837908043	PFTLBAAJKXJMQF-ROUUACIJSA-N	434.295	1.527	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)CCN3CCCC3)CC2)CC1	1838785485	BNJURBNDFVKITB-IBGZPJMESA-N	429.989	1.725	50	20	IDGD	
CN1CCCC[C@H]1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2	1839150662	SWRXSEKCDBLYTM-SNRMKQJTSA-N	436.380	1.163	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccc(F)cn3)C2)C1	1839152430	ZACIDTBXKVJXIQ-MOPGFXCFSA-N	448.322	1.456	50	20	IDGD	
Cc1ccc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)o1	1839156361	NKPJQTGGTOEOOP-RBUKOAKNSA-N	433.332	1.823	50	20	IDGD	
O=C(c1cccnc1S)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839197080	HPDYVZFAYFLAGJ-MLGOLLRUSA-N	448.314	1.131	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cncc(C)c3)C2)C1	1839963777	VPJKZBOKVDKPBI-APWZRJJASA-N	440.338	1.634	50	20	IDGD	
CCc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](Br)CC)CCO3)no1	1839966282	ZUYBSKMAHGCBRQ-KDOFPFPSSA-N	444.326	1.481	50	20	IDGD	
Cc1nc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)sc1C	1840034578	PYMJKZMAMCKBGE-PIGZYNQJSA-N	446.367	1.613	50	20	IDGD	
Cc1ccc2[nH]cc(CC(=O)N3CC4(CCCN4C(=O)c4cccc(B(O)O)c4)C3)c2c1	1843013151	OAFVAQNWWZOXGX-UHFFFAOYSA-N	431.301	1.216	50	20	IDGD	
CC1(C)Cc2cccc(C(=O)N3CCCC34CN(C(=O)c3cnccc3C(=O)NN)C4)c2O1	1843301036	PEOSERZRZYUKQC-UHFFFAOYSA-N	449.511	1.529	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)COc1ccccc1C#N)C2	1843417139	ALYXKWDUYFAHNJ-WGOQTCKBSA-N	448.483	1.274	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)c2csc(C(F)(F)F)n2)C1	1844550317	KEFDTIOLFIUJGB-UHFFFAOYSA-N	433.456	1.352	50	20	IDGD	
CC(C)(C)OC(=O)NCC[C@@H](O)C(=O)N1CCCC12CN(C(=O)CCBr)C2	1845221641	KVYFJPKCAMPXDT-CYBMUJFWSA-N	448.358	1.251	50	20	IDGD	
C[C@@H]1[C@@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](O)CCl)CCN1C(=O)OC(C)(C)C	1847568692	ISZDZFIUMHVTAR-OLMNGRFOSA-N	429.945	1.433	50	20	IDGD	
CON(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)cc1	14939547	ZFFJYKQJPUNMRC-LBPRGKRZSA-N	425.438	1.236	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1cccc(OC[C@H]2CCCO2)c1	26352591	ZHACBSODOTYAIM-QGZVFWFLSA-N	446.529	1.921	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cnn(-c3ccccc3)c2C)cc1	26772729	OVIBKLLFXPLWAW-UHFFFAOYSA-N	441.513	1.571	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NCc1cc(Br)ccc1F	725874412	YJMLSLAINBLNQI-UHFFFAOYSA-N	429.271	1.910	50	20	IDGD	
C[C@@]1(c2ccc(CNC(=O)NNC(=O)c3ccc4ccccc4n3)cc2)NC(=O)NC1=O	726282558	OTBXBQQLVNZNNJ-QFIPXVFZSA-N	432.440	1.434	50	20	IDGD	
COc1cccc(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1	727350370	WQSPTYZMVGCXMJ-UHFFFAOYSA-N	439.515	1.103	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=S)NCCc2cccnc2)cc1	727691791	CMEFXROQHVENSS-UHFFFAOYSA-N	427.559	1.854	50	20	IDGD	
C[C@H]1Oc2ccccc2O[C@@H]1C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	728214925	UXIAHMYJCLBADU-QRWLVFNGSA-N	446.529	1.294	50	20	IDGD	
C=CCNS(=O)(=O)c1cc(C(=O)NNC(=O)c2cccc(OC(F)F)c2)ccc1F	728486747	IVFWHRNHNBPRIF-UHFFFAOYSA-N	443.403	1.966	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)NCCCNC(=O)OC(C)(C)C)c2ccccc2c1=O	729054235	NMQOQPDKRPKQDO-UHFFFAOYSA-N	446.508	1.836	50	20	IDGD	
NC(=O)[C@H]1CCCN1Cc1cccc(NC(=O)NNC(=O)Cn2ccc3ccccc32)c1	729493976	JLWGQWIPWOUMHK-HXUWFJFHSA-N	434.500	1.944	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H]1CNC(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	730829834	VIIRUIOAVXHUKI-HNNXBMFYSA-N	444.492	1.921	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)COc1ccccc1O)c1cccc(S(=O)(=O)N(C)C)c1	730910491	KMBITZAWJYJSMN-ZDUSSCGKSA-N	436.490	1.113	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)CNC(=O)c1c(Cl)cccc1[N+](=O)[O-]	731050456	KZOSGFBXLDJFCU-JTQLQIEISA-N	438.799	1.732	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)NCCS(=O)(=O)NCC3CCC3)cc2C1	731679375	JTBUBOBQSNNOAM-GFCCVEGCSA-N	428.580	1.536	50	20	IDGD	
NC(=O)c1cc(C(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)nn1-c1ccccc1	733540723	HPNIORZXLNASIB-UHFFFAOYSA-N	441.831	1.243	50	20	IDGD	
O=C(NCC1CCSCC1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	733653974	OJEMOYWTGJZRRB-UHFFFAOYSA-N	426.564	1.558	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNS(=O)(=O)c2ccc3c(c2)C(=O)NCC3)cc1	734806728	HBBLPEYIQJMJQK-CYBMUJFWSA-N	433.486	1.148	50	20	IDGD	
C[C@H]1CCCC[C@@H]1OCC(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	735117565	XQZMTQHIPXSLIT-HOTGVXAUSA-N	425.555	1.056	50	20	IDGD	
CCCCN1C(=O)CC[C@@H](C(=O)NNC(=O)c2cnn(C)c2)[C@@H]1c1ccc(OC)cc1	735446262	IRVKDCJLPBADMK-QUCCMNQESA-N	427.505	1.970	50	20	IDGD	
C[C@H]1[C@H](C)S(=O)(=O)CCN1C(=O)NNC(=O)c1ccc(Br)cc1Cl	736386382	DWMJEICEEWYMMI-IUCAKERBSA-N	438.731	1.964	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)CCn2cc(Br)cn2)cc1C	736796415	WBXPBRPVVHHEDN-UHFFFAOYSA-N	443.323	1.972	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)CNC(=O)c2ccc(F)c(F)c2)cc1C	736797917	YGSFLWXJCORFHY-UHFFFAOYSA-N	439.440	1.631	50	20	IDGD	
Cc1nc2c(c(O)nn2C)c(C)c1CCC(=O)NNC(=O)c1ccc2c(c1)OCCO2	742242706	FAWJSBHOGPYBCC-UHFFFAOYSA-N	425.445	1.456	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NNC(=O)c2cccc3ccccc23)cc1	743629867	GNQNXDLZMQBZNT-UHFFFAOYSA-N	441.469	1.924	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2nn(-c3ccc(F)cc3)ccc2=O)cc1	743829481	REKQAUZEUWAPLT-UHFFFAOYSA-N	445.432	1.242	50	20	IDGD	
CC(=O)N1CCc2ccccc2[C@H]1CC(=O)OCC(=O)NNC(=O)c1cccc(C#N)c1	744523870	WVBIQKJCQWLHEE-HXUWFJFHSA-N	434.452	1.398	50	20	IDGD	
Cc1nc2c(C#N)cnn2c(C)c1CCC(=O)OCC(=O)NNC(=O)c1cccc(C#N)c1	744705521	PJXHKHWIIPWAJG-UHFFFAOYSA-N	445.439	1.027	50	20	IDGD	
CC(C)COC(=O)N1CCC(C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)CC1	744922049	NKAPBFYQGLIVFR-UHFFFAOYSA-N	430.461	1.367	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)N[C@H]3C[C@@H](C)N(c4cnn(C)c4)C3=O)n[nH]2)cc1	745919460	UEDQYANLXPWURY-ACJLOTCBSA-N	436.476	1.257	50	20	IDGD	
CN(C)C(=O)NNC(=O)C1(NC(=O)NCc2cccc(Br)c2)CCCC1	746001669	RNXZIUDKSSINCN-UHFFFAOYSA-N	426.315	1.864	50	20	IDGD	
O=C(CC[S@@](=O)c1ccc2c(c1)OCCO2)NNC(=O)c1nnc(O)c2ccccc12	746097300	ZLLLVZIXJQJUBX-WJOKGBTCSA-N	442.453	1.066	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NC2CCN(C3CCCCC3)CC2)c2ccccc2c1=O	747593188	WLQJIWISKLXRFN-UHFFFAOYSA-N	426.521	1.675	50	20	IDGD	
COc1cc(/C=C\C(=O)NNC(=O)C(=O)N2CCCC2)ccc1OCc1c(C)noc1C	748247109	KUNPGAQKQZKSGH-CLFYSBASSA-N	442.472	1.662	50	20	IDGD	
COc1cc(OC)cc(N2CC[C@H](NC(=O)NNC(=O)COc3ccccc3C#N)C2)c1	748661027	ICKAZODURZFGBY-INIZCTEOSA-N	439.472	1.564	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc(Br)ccc1F)c1ccc2c(c1)OCCO2	748690516	FWBQWBSGYISTIR-UHFFFAOYSA-N	431.239	1.983	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)CNC(=O)OC(C)(C)C	749819459	PHPCCLVWMKBHQU-AWEZNQCLSA-N	435.529	1.184	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)N[C@H]1CCN(CCCc2ccccc2)C1=O	750267009	KJTRVDSOGDGBBM-HNNXBMFYSA-N	448.321	1.955	50	20	IDGD	
COc1cccc(C(=O)NNS(=O)(=O)c2ccc(OCCCC(=O)O)c(F)c2)c1O	751272314	TWSPEPIYMNMDLC-UHFFFAOYSA-N	442.421	1.407	50	20	IDGD	
C[C@@H](Oc1c(I)cc(Cl)c2cccnc12)C(=O)NNC(=O)CO	753443171	UAZGBRLMVVTXJW-SSDOTTSWSA-N	449.632	1.400	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NCC2(C(=O)NCC)CCC2)c2ccccc2c1=O	753747680	RXPPQUHBNCDUIL-UHFFFAOYSA-N	442.520	1.447	50	20	IDGD	
O=C(CCc1nc(-c2cc(Br)cs2)no1)NNC(=O)Cc1cc[nH]n1	755285978	IHIRMYRZHNGIAY-UHFFFAOYSA-N	425.268	1.606	50	20	IDGD	
CCc1c(NC(=O)C(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)cnn1CCC(C)C	756199402	RZGFACDNVRCWEJ-UHFFFAOYSA-N	432.437	1.505	50	20	IDGD	
COC(=O)c1cccc(NC(=O)C(=O)NNc2nc3ccccn3n2)c1Br	756201275	RMXFFTPXNBFZRF-UHFFFAOYSA-N	433.222	1.360	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)Nc1cnc2c(c1)CN(C(=O)OC(C)(C)C)CC2	757895752	LGUCRBVAOQNUKP-CYBMUJFWSA-N	437.497	1.579	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)N[C@H]2CCCS(=O)(=O)C2)c2ccccc2c1=O	758657049	FIZVIPGPLHVTBW-AWEZNQCLSA-N	449.533	1.108	50	20	IDGD	
Cc1c(Br)c2ccccc2n1CC(=O)NNC(=O)C(=O)Nc1ccccn1	758833680	ONKNRRDBISLWBG-UHFFFAOYSA-N	430.262	1.893	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)NC2CCN(c3cccnn3)CC2)c1	759613754	KDALXYHHHBHYFS-UHFFFAOYSA-N	449.309	1.861	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)NCC(=O)N(C)CCc1ccccn1	761687318	KGQWVVFIEGGXJH-UHFFFAOYSA-N	431.518	1.214	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)[C@@H]2CC23CCN(C(=O)OC(C)(C)C)CC3)C[C@@H](C)O1	763467989	ZUFVPUVGICBNDV-BBWFWOEESA-N	438.569	1.670	50	20	IDGD	
CC(C)(C)OC(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)c1	763548104	ITZNXPVCOWPLNZ-UHFFFAOYSA-N	441.440	1.699	50	20	IDGD	
COc1cc(OC)cc(OCCNC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c1	763674264	FNBAKKXPKAMTHH-UHFFFAOYSA-N	437.474	1.130	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)C(=O)Nc2cccc3[nH]ccc23)c2ccccc2c1=O	763790694	MWBDSZNHEDMPQY-UHFFFAOYSA-N	432.440	1.858	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccccc2C[S@@](C)=O)cc1	763878666	SLZLSNGDVQSDCC-AOYOOGHLSA-N	445.497	1.321	50	20	IDGD	
O=C(CCSc1ccc(F)cc1)NNC(=O)C(=O)Nc1cccc(N2CCNC2=O)c1	763895975	VNWKFUAFJRXVET-UHFFFAOYSA-N	445.476	1.624	50	20	IDGD	
C[C@H]1CCC2=S=C(C(=O)NNC(=O)C(=O)Nc3ccnn3Cc3ccccn3)C=C2C1	763941931	ZGUCMIFUILLPMO-ZDUSSCGKSA-N	438.513	1.250	50	20	IDGD	
CC(=O)Nc1cc(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)ccc1Cl	763995787	QPSRIDUKSZGFAI-UHFFFAOYSA-N	442.657	1.789	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1cccc(COCC2CC2)c1	764005619	CPOGQXNDDDXNQE-UHFFFAOYSA-N	425.441	1.784	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1OCC(F)F	764006192	LYRXQRBBBZXBNP-UHFFFAOYSA-N	435.383	1.810	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cc([N+](=O)[O-])c(C)cc2Br)n[nH]1	764108769	NOMQNJKHKYHBMP-UHFFFAOYSA-N	425.199	1.097	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(CN3C[C@@H](C)O[C@H](C)C3)c2)c(O)c1	764111673	YTTITYCHGMGYSD-HZPDHXFCSA-N	440.500	1.710	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccn(-c4ccncc4)n3)n[nH]2)cc1	764112128	WKBYPGHIGBPAFH-UHFFFAOYSA-N	430.428	1.366	50	20	IDGD	
CCn1cnnc1-c1cccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)c1	764127472	VXFDHJFRGVXVDK-UHFFFAOYSA-N	428.836	1.724	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2cc3c(cc2SC)OCCO3)c1O	764132392	NYVBTHLMUJGWQJ-UHFFFAOYSA-N	433.442	1.294	50	20	IDGD	
O=C(CCc1ccccc1)NNC(=O)C(=O)Nc1cnn(-c2cnc3ccccc3n2)c1	764191597	BOJGZFBJELXGOF-UHFFFAOYSA-N	429.440	1.534	50	20	IDGD	
C[C@@H](NC(=O)OC(C)(C)C)c1ccc(NC(=O)C(=O)NNC(=O)Cc2ccccn2)cc1	764267138	PHICFFNAOYKJAT-CQSZACIVSA-N	441.488	1.996	50	20	IDGD	
C[C@H](C#N)CSc1ccccc1NC(=O)C(=O)NNC(=O)COc1ccccc1O	764278188	LNWHZKUCDNCKIB-CYBMUJFWSA-N	428.470	1.809	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)C(=O)Nc1cc(C(=O)N2CCCCC2)ccc1Cl	764297601	DIKSQGJGVRJZKJ-UHFFFAOYSA-N	432.868	1.397	50	20	IDGD	
O=C(NNC(=O)c1cc2ccccc2o1)C(=O)Nc1ccc(NC(=O)[C@@H]2CCCO2)cc1	764332360	RIVWNYDKAVFWME-KRWDZBQOSA-N	436.424	1.950	50	20	IDGD	
CC(=O)N1CCCc2cc(NC(=O)C(=O)NNC(=O)c3cnn(-c4ccccc4)c3)ccc21	764343423	QDXHEPSCZHVBBX-UHFFFAOYSA-N	446.467	1.571	50	20	IDGD	
CCOC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)COCc2ccccc2)cc1C#N	764367084	TXOQHYNELRHONE-UHFFFAOYSA-N	439.428	1.429	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cc(C#N)ccc3OC)n[nH]2)cc1	764384635	HORFWFRDYFXKOZ-UHFFFAOYSA-N	432.440	1.919	50	20	IDGD	
CN(C)CCOc1cccc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)c1	764394220	PWKXZXIGUWJMIV-UHFFFAOYSA-N	432.502	1.211	50	20	IDGD	
CCn1c(NNC(=O)[C@H](C)NS(=O)(=O)c2cccc(C#N)c2)nc2ccccc2c1=O	764718365	XTAQFLJCQQQSEB-ZDUSSCGKSA-N	440.485	1.098	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3ccc(CNC(C)=O)cc3)n[nH]2)cc1OC	765597459	UFOHUPSFHYMVAF-UHFFFAOYSA-N	437.456	1.805	50	20	IDGD	
CC(C)COc1ncccc1C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	766642785	MPBDEEQMTTWRFO-UHFFFAOYSA-N	439.516	1.335	50	20	IDGD	
CCc1noc(CCCC(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)n1	766662727	DEAAGRSCXBRYQF-UHFFFAOYSA-N	448.955	1.573	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2	767272027	XAWORPJXXYUHSH-UHFFFAOYSA-N	429.385	1.221	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc1C	767825201	OUVGLYPUVWYLDQ-UHFFFAOYSA-N	447.513	1.628	50	20	IDGD	
CC/C=C(/C)C(=O)N1CSC[C@H]1C(=O)NNc1c(OC)cccc1S(C)(=O)=O	768630521	SYYNEKVTHTXRJK-OTAKNEKHSA-N	427.548	1.800	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)COc2ccc([N+](=O)[O-])c3cccnc23)c2ccccc2c1=O	769463086	VEYQONABLPCSRV-UHFFFAOYSA-N	448.395	1.230	50	20	IDGD	
Cc1cc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c(C(F)(F)F)o1	770478880	RMSZDWAPGRZRNH-CYBMUJFWSA-N	428.319	1.751	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)Nc1ccnn1-c1cccc(F)c1	770771747	ODOZCAQPSNSRQG-UHFFFAOYSA-N	449.240	1.512	50	20	IDGD	
Cc1occc1C(=O)Nc1nc(CC(=O)O[C@H](C)C(=O)NNC(=O)CC(C)C)cs1	772257018	KEPXCZUGYXCSCO-GFCCVEGCSA-N	436.490	1.965	50	20	IDGD	
O=C(NNC(=O)C1(OCc2ccccc2)CCOCC1)c1csc(N2CCOCC2)n1	772630011	HRUUEZFIOLFQJJ-UHFFFAOYSA-N	446.529	1.507	50	20	IDGD	
CC(C)(C)OC(=O)N1CCCC[C@H]1C(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772888257	HFGGFVLZZTYGND-HNNXBMFYSA-N	438.912	1.893	50	20	IDGD	
C[C@H]1CN(C(=O)c2ccc(NC(=O)C(=O)NNc3cnc4ccccc4n3)cc2)C[C@@H](C)O1	773719720	YTBZNFUOVIPLNI-GASCZTMLSA-N	448.483	1.961	50	20	IDGD	
CCCS(=O)(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(C)c(F)c2)c1	773886459	XCDGAFSKTVZTEY-UHFFFAOYSA-N	436.465	1.686	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1cnn(C)c1C(F)(F)F	774010003	UAVSYDBRPOHLOW-MRVPVSSYSA-N	433.774	1.646	50	20	IDGD	
COc1nc(C)c(Br)cc1C(=O)NNC(=O)CCN1C[C@H](C)O[C@H](C)C1	777088431	DKCFZVXKMQGARH-PHIMTYICSA-N	429.315	1.421	50	20	IDGD	
O=C(CN1CCNC(=O)[C@H]1c1ccccc1Br)NNC(=O)c1cccs1	777717600	VLLRBVRYPVMGIV-OAHLLOKOSA-N	437.319	1.445	50	20	IDGD	
O=C([C@@H]1CCCN1Cc1ccc(F)cc1)N1CCN(S(=O)(=O)CBr)CC1	777778076	VWGZQCMBFAELOL-INIZCTEOSA-N	448.358	1.617	50	20	IDGD	
Cc1ccc(C[C@@H](C)C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)cc1	779205451	YMRJGECXRUQSHG-QGZVFWFLSA-N	431.562	1.648	50	20	IDGD	
Cn1cnc(-c2ccc(C(=O)NNc3ccccc3S(=O)(=O)N3CCOCC3)cc2)n1	780596673	CEQZMCYDHBFVLM-UHFFFAOYSA-N	442.501	1.260	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](NC(=O)NNC(=O)Cc2cn3ccccc3n2)CC1	780683235	XWZRHXXDGDMLRS-OAHLLOKOSA-N	430.509	1.997	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)C(=O)Nc1ccccc1OCC1CC1	782897701	SHHOTHSDIZBOEN-UHFFFAOYSA-N	445.501	1.168	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2ccc(S(=O)(=O)N3CCCCC3)cc2)cc1	783034941	MRMTZANTMTWPSD-UHFFFAOYSA-N	432.502	1.952	50	20	IDGD	
CN(C)C(=O)COc1ccc(NC(=O)C(=O)NNc2ccc(Cl)cc2[N+](=O)[O-])cc1	783290502	ABBQPRUVHNCFIH-UHFFFAOYSA-N	435.824	1.797	50	20	IDGD	
C[C@H]1CCCN(Cc2ccc(NC(=O)C(=O)NNc3ccc(-n4cccn4)nn3)cc2)C1	783433218	OTYQWAKKNDMHKR-INIZCTEOSA-N	434.504	1.976	50	20	IDGD	
CN(NC(=O)CCCCN1CCOCC1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	783704668	QGZKIVXHYGDGRA-UHFFFAOYSA-N	427.546	1.125	50	20	IDGD	
Cc1cc(N2CCCC2)ccc1NC(=O)C(=O)NNC(=O)CNC(=O)c1cccs1	784004967	MHXJXSUHUVPOTI-UHFFFAOYSA-N	429.502	1.173	50	20	IDGD	
CC(C)Oc1cc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)ccn1	784215978	KRAHJYYKNXWXST-UHFFFAOYSA-N	433.490	1.391	50	20	IDGD	
O=C(NNC(=O)[C@H]1CC=CC[C@@H]1C(=O)N1CCOCC1)c1ccc(Br)s1	784295316	FNQNFRXSXWLOLQ-RYUDHWBXSA-N	442.335	1.713	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc4c(c3)OCC(=O)N4)n[nH]2)c1	785125446	DRDUAASTUZOHDD-UHFFFAOYSA-N	448.439	1.424	50	20	IDGD	
COc1cc(F)cc(NNC(=O)C(=O)Nc2ccc3c(c2)C(=O)N(CC2CC2)C3=O)c1	785237520	TVJZORBNSURBIH-UHFFFAOYSA-N	426.404	1.922	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1ccc(OC(F)F)c(F)c1	785340132	WVJCSSPQMLQSOT-UHFFFAOYSA-N	447.391	1.921	50	20	IDGD	
CC(=O)NCc1ccc(NC(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)cc1	785850094	IAFPVJLAAWGKJU-UHFFFAOYSA-N	448.524	1.964	50	20	IDGD	
O=C(NN=Cc1ccc(Br)cc1N1CCOCC1)[C@H]1CCS(=O)(=O)C1	788708076	DWRBENMMNPCVAJ-ZDUSSCGKSA-N	430.324	1.171	50	20	IDGD	
CC[C@H]1CCc2nc(NC(=O)C(=O)NNC(=O)COc3ccccc3[N+](=O)[O-])sc2C1	789731656	FHUHRQCDPTUFGW-NSHDSACASA-N	447.473	1.731	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2nnn(CC3CCCC3)c2C)c2ccccc2c1=O	789868418	DYTSRVXFYFWRJG-UHFFFAOYSA-N	437.504	1.971	50	20	IDGD	
COC(=O)c1csc(-c2cccc(CNC(=O)NN[C@@]3(C)CCS(=O)(=O)C3)c2)n1	790622581	CNWOQGBOGGEPLJ-SFHVURJKSA-N	438.531	1.478	50	20	IDGD	
C[C@H](CCc1ccc(I)cc1)NC(=O)NNC(=O)C(=O)NC1CC1	793351946	JSBDEJPOQBLACB-SNVBAGLBSA-N	444.273	1.221	50	20	IDGD	
Cc1c(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)nnn1Cc1ccncc1	794752539	QIPCPDODVITMKC-UHFFFAOYSA-N	448.531	1.003	50	20	IDGD	
CN(C(=O)OC(C)(C)C)[C@H](C(=O)NNC(=O)Cc1cn2ccccc2n1)c1cnn(C)c1	796884496	AGOVIRRMQYKLAC-SFHVURJKSA-N	441.492	1.366	50	20	IDGD	
O=C(NNC(=O)c1cccc2ncccc12)C(=O)Nc1ccc(F)c(N2CCOC2=O)c1	797003294	AWZIMBXFAJPISP-UHFFFAOYSA-N	437.387	1.730	50	20	IDGD	
Cc1c(C(=O)NNC(=O)CNC(=O)c2cccs2)nnn1CCOc1ccc(F)cc1	799926592	COMZVGYYCUDBEM-UHFFFAOYSA-N	446.464	1.057	50	20	IDGD	
O=C(NCCS(=O)(=O)CCc1ccccc1)NNC(=O)c1ccc2ccccc2n1	800066243	BJLMUMKGBGLMID-UHFFFAOYSA-N	426.498	1.836	50	20	IDGD	
COc1ccc([C@]2(C)NC(=O)N(CC(=O)NNC(=O)Nc3ccc(Cl)cc3)C2=O)cc1	802022777	QUBQOZBTRGKSOA-FQEVSTJZSA-N	445.863	1.969	50	20	IDGD	
O=C(CNC(=O)c1c[nH]c2ccccc2c1=O)NNC(=O)Nc1ccc(OC(F)F)cc1	802043922	WNGMMVFXKHGNLY-UHFFFAOYSA-N	445.382	1.712	50	20	IDGD	
CNS(=O)(=O)c1ccc(C(=O)NNC(=O)Nc2cc(OC)c(Cl)cc2OC)o1	802084797	KUCYYTNZZLEXNW-UHFFFAOYSA-N	432.842	1.325	50	20	IDGD	
COc1ccc(C(=O)CNC(=O)CCC(=O)NNC(=O)Nc2ccc3c(c2)OCO3)cc1	802097701	ZRRAIJKZCJNIEA-UHFFFAOYSA-N	442.428	1.356	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCc2ccc(C#N)c(Cl)c2)cc1	802444524	DLILHGBSCDMIKM-UHFFFAOYSA-N	449.920	1.671	50	20	IDGD	
N#Cc1ccc(OC2CCN(C(=O)NNC(=O)CNC(=O)c3cccs3)CC2)c(F)c1	805044500	VASCZBIFFTZJEE-UHFFFAOYSA-N	445.476	1.773	50	20	IDGD	
O=C(NC[C@H](c1ccco1)N1CCCCC1)NNC(=O)c1csc(N2CCOCC2)n1	806996983	YDFXEQVCKICZGT-MRXNPFEDSA-N	448.549	1.744	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCCc1ccc2c[nH]nc2c1	807244155	SVJIEQXKAKPBFD-UHFFFAOYSA-N	429.506	1.351	50	20	IDGD	
COC[C@@H](NC(=O)NNC(=O)c1csc(N2CCOCC2)n1)c1cccc(Cl)c1	808187018	WQSNKHCQDCDELS-CQSZACIVSA-N	439.925	1.965	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc3c(c2)SCC(=O)N3)c1	809940928	RZJBERUUAIENFC-UHFFFAOYSA-N	434.499	1.056	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN[C@H](C)c2ccc(N3CCCNC3=O)cc2)n1	812901988	CNCTVZDFJCQLLM-CQSZACIVSA-N	430.534	1.412	50	20	IDGD	
CN(C)c1nc2cc(NC(=O)C(=O)NNc3ccccc3S(=O)(=O)N(C)C)ccc2o1	815752577	XSTWSZBGDFRBEQ-UHFFFAOYSA-N	446.489	1.226	50	20	IDGD	
NS(=O)(=O)N1CCC[C@H](C(=O)NNC(=O)c2ccc(-c3ccc(F)cc3)s2)C1	816830220	WTYPJVKDHDSKQJ-LBPRGKRZSA-N	426.495	1.231	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)CN2C(=O)N[C@@]3(C[C@H](C)CC(C)(C)C3)C2=O)c1	825776107	BPDGPNWRCXRVKE-JLCFBVMHSA-N	445.520	1.391	50	20	IDGD	
COc1ccccc1NC(=S)NNC(=O)CCNS(=O)(=O)/C=C\c1ccccc1	913440031	IUWBIANJHFQNMK-OWBHPGMISA-N	434.543	1.993	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCc2ccc(C(=O)N3CCOCC3)cc2)cc1OC	913635932	IRYJPAGDPRQXMW-UHFFFAOYSA-N	442.472	1.320	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)NCCCN2C(=O)NC3(CCCCC3)C2=O)c2ccccc21	913638364	JZRZFNFPKZIULK-UHFFFAOYSA-N	440.504	1.767	50	20	IDGD	
CCn1c(=O)nc(O)c2c(C(=O)NNC(=O)COc3cccc(C)c3)cc(C3CC3)nc21	914126380	YMOZQBFVMOUFQS-UHFFFAOYSA-N	437.456	1.543	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)CN(C)S(C)(=O)=O)c3ccccc3n2)cc1	914710950	MLQUJOHVQQTAEL-UHFFFAOYSA-N	426.498	1.863	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN1C(=O)c1cc(Cl)cc(Cl)c1)[C@@H]1CCS(=O)(=O)C1	914719754	PQVIXLPIFLOLOD-QMTHXVAHSA-N	448.328	1.180	50	20	IDGD	
O=C(NCCCN1CCc2ccccc2C1)NNC(=O)c1nn(-c2ccccc2)cc1O	914827686	APLUYSKUCMMDCF-UHFFFAOYSA-N	434.500	1.970	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc3c(nc2O)CCC3)c1	916096579	WJEOLKTUNAYVPL-UHFFFAOYSA-N	432.502	1.381	50	20	IDGD	
Cc1cc(C)n(-c2ccc(CNC(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)cn2)n1	916419499	KXQCCYWEHGQQBJ-UHFFFAOYSA-N	442.501	1.432	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NC[C@@H](c1ccccc1)N1CCOCC1	916509517	QUCIMHRYBZFLAD-JXFKEZNVSA-N	430.480	1.997	50	20	IDGD	
Cc1ccc(CNC(=O)c2cccc(CNC(=O)NN[C@@]3(C)CCS(=O)(=O)C3)c2)cc1	916511024	IWXKJTRZPNTSGV-QFIPXVFZSA-N	444.557	1.806	50	20	IDGD	
N#Cc1ccc(NCCNC(=O)NNC(=O)COc2ccc(Br)cc2)nc1	916521953	UPCGJEQXTXZJIP-UHFFFAOYSA-N	433.266	1.537	50	20	IDGD	
COc1ccc(CNC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc1O	916641752	HKOCIIUYAYGBPS-UHFFFAOYSA-N	448.501	1.330	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)C(=O)NC1CC1)c1ccc(NC(=O)c2ccc(F)cc2)cc1	918125280	NDYSEDIUVHBKRN-GFCCVEGCSA-N	427.436	1.748	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)CCCOc2cccc(F)c2)ccc1Cl	918419249	DVQMJEZNEVFOKO-UHFFFAOYSA-N	429.857	1.747	50	20	IDGD	
CN(C)N(C(=O)C1CCN(C(=O)c2ccc(Cl)s2)CC1)[C@@H]1CCS(=O)(=O)C1	918557152	UOUXMNFZJFFBKG-CYBMUJFWSA-N	433.983	1.746	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2ccc(S(=O)(=O)NCCC#N)cc2)c2ccccc2n1	918691816	JNQXSSHVZDKKKJ-UHFFFAOYSA-N	437.481	1.810	50	20	IDGD	
CC[C@H](C)c1ccccc1N1C[C@H](C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)CC1=O	919883934	FGFCORDLTZEBRN-RRFJBIMHSA-N	436.534	1.071	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)NCc1ccc(OCC(=O)N(C)C)c(OC)c1	919909520	WVTOLDHUTVEJNA-UHFFFAOYSA-N	444.488	1.244	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)[C@@H]2CC(=O)N(c3ccc(OC)cc3)C2)o1	920249032	ZFZVSMVJLGLPRF-OAHLLOKOSA-N	428.489	1.944	50	20	IDGD	
Cc1nn(Cc2ccc(F)cc2)c2sc(C(=O)NNC(=O)CN3CCCC3=O)cc12	920827674	WFAYLIKNYMSOBU-UHFFFAOYSA-N	429.477	1.977	50	20	IDGD	
C[C@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)NNC(=O)NCCc2cccs2)C1=O	920861811	SJMRDHZSNRURRZ-LJQANCHMSA-N	433.465	1.227	50	20	IDGD	
O=C(NNC(=O)c1n[nH]c2c1CCCC2)c1ccccc1NS(=O)(=O)C(F)(F)F	1318534476	NSVCHGVPABWKKZ-UHFFFAOYSA-N	431.396	1.625	50	20	IDGD	
O=C(CN1CCC([C@H]2C(=O)Nc3ccccc32)CC1)NNC(=O)c1cccc([N+](=O)[O-])c1	1322781449	QWFTXKAHFYRVDL-HXUWFJFHSA-N	437.456	1.804	50	20	IDGD	
CCOC(=O)c1ncc(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)s1	1324843892	CGFCMPPOSVBPJE-UHFFFAOYSA-N	440.503	1.098	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)N(C)C(C)=O)C1	1778104980	ORLFHFINRXDRKG-HWLIBYHHSA-N	446.386	1.541	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)Cn3c(=O)n(C)c4ccccc43)C2)C1	1778164152	BSPIXJXIZAXFRC-BTYIYWSLSA-N	434.924	1.187	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(OC)ccn3)C2)C1	1779539623	BHNVDZDOPHRUHF-KDOFPFPSSA-N	426.311	1.707	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1C[C@@H]1F)CCO2	1780095077	FHAINFYCAPBTHZ-IIMJZQEZSA-N	435.408	1.322	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(OCCCO)cc3)C2)C1	1780126539	LTOKIVRUTUAPNS-WIYYLYMNSA-N	440.924	1.145	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)COc1cccnc1)C2)[C@H](F)Br	1780770960	MUXTXOLVDWBSQU-UWWQBHOKSA-N	444.301	1.665	50	20	IDGD	
O=C(c1ccn2nccc2c1)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781331499	LSQNWWNHIVBBHA-PBHICJAKSA-N	425.258	1.468	50	20	IDGD	
O=C1CCc2ccc(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)[C@H](O)CCl)C4)cc2N1	1781408780	FCUFBVUQVOOZSY-JBYIUTFZSA-N	449.935	1.299	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H]1CC[C@H](C(=O)OC)C1)C2	1782171797	GILXNVCYUMXFBY-QTIHUPTLSA-N	444.956	1.343	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccnc4ncccc34)C2)C1	1782342217	SXECHTCIIGYDRJ-ORAYPTAESA-N	433.306	1.857	50	20	IDGD	
O=C(c1cnc2ccc(F)cn12)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1782462545	NQWZOTQPYDWNKB-RHSMWYFYSA-N	443.248	1.607	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)Cc3ccc4c(c3)CCO4)C2)C1	1783422488	ZFHQJEFYBQVJSH-XOBRGWDASA-N	437.334	1.777	50	20	IDGD	
COc1c(Cl)ccnc1C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](C)Br)C2)C1	1783535569	AKGUBBLSVMRVEU-APPDUMDISA-N	446.729	1.971	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)COc3ccccc3OC)CCO2)C1	1783869115	OBKLLGDMQNCWBV-FOIQADDNSA-N	426.897	1.158	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@](C)(O)C(F)(F)F)[C@H]2C1	1784877650	RKFNTXUKDPQAPO-ADADXYTCSA-N	431.249	1.063	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(C(N)=O)cc3)C2)C1	1784925709	WAEVMXJTVGUHBM-ORAYPTAESA-N	438.322	1.260	50	20	IDGD	
CC[C@H](NC(C)=O)C(=O)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1	1785864860	FXJRKLJQDJVTSO-FQEVSTJZSA-N	437.305	1.029	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Cl)C[C@@H]21)c1cc(Cl)c2nncn2c1	1788558444	VMPKNZQJPLLGKO-DTCNJJKHSA-N	430.267	1.510	50	20	IDGD	
COc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Br)C[C@@H]32)c(O)c1	1789482437	ZGMZNTTYDCRFHD-NZBMOFRJSA-N	445.285	1.685	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3ccc(F)nc3)C[C@@H]21)[C@@H](F)Br	1789922043	CSNYCEIHHHSLPJ-AYMQEEERSA-N	446.292	1.824	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]2C1	1789924801	DUEFALKESPZIQB-AJBSGBCOSA-N	430.112	1.440	50	20	IDGD	
NC(=O)c1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]3C2)cc1	1789926501	AMIZPCTWVTVNDY-AJNGGQMLSA-N	442.285	1.069	50	20	IDGD	
COCc1c[nH]c(C(=O)Nc2ccc(C3(NC(=O)c4ccc(B(O)O)cc4)CCC3)cc2)c1	1790039232	ZZSHHMTXHPQEAL-UHFFFAOYSA-N	447.300	1.902	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)n3cc(C)cn3)C[C@@H]21	1790963772	LXPUBLKFIVOSBZ-VIQHNZTISA-N	441.370	1.906	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1ccc(C2(NC(=O)c3ccc(CO)o3)CCC2)cc1	1791600960	ALFGFLCSDHRVCZ-UHFFFAOYSA-N	428.489	1.893	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC1(c2ccc(NC(=O)[C@H]3CCNC(=O)C3)cc2)CCC1	1791660702	MPYKHGJNYYHNJW-HNNXBMFYSA-N	429.521	1.020	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(=O)c2ccccc2o1	1792765387	HPFZHRFXLWCQNN-QPWUGHHJSA-N	434.876	1.250	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccccc1F	1795221392	OTAGAYOKBGGFLC-FRQROOTJSA-N	427.314	1.989	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CC[C@H]1CNc2ccccc2C1	1795651079	DSPAWZAAOIYLMB-JHRANDQASA-N	449.979	1.894	50	20	IDGD	
NC[C@H](N)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCCCCCCCCCCl)C2	1796341864	RFCIDZAFMMEODS-DMUMMCEESA-N	431.021	1.612	50	20	IDGD	
CC1(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Cl)CN(C(=O)OC(C)(C)C)C1	1796370312	GLXKTYZOSKXIQE-OCVGTWLNSA-N	447.935	1.758	50	20	IDGD	
C[C@@H]1CCc2c(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@@H](F)Br)C4)n[nH]c21	1796972540	ZMYCACHWJOHSLJ-AGKDPIEYSA-N	429.290	1.353	50	20	IDGD	
CC(=O)Nc1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](F)Br)C3)ccn1	1797246546	TYVZYYGYYAOJOM-XFMPKHEZSA-N	427.274	1.982	50	20	IDGD	
Cc1c(Br)c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Cl)C3)nn1C	1798715264	VWHDIHRMWXVMPF-INTNWOOBSA-N	437.697	1.229	50	20	IDGD	
CC(C)c1ccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCC(=O)NN(C)C)C3)cc1	1800695897	ZHARYAGMWJWFDF-IRJINJETSA-N	444.576	1.315	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1c[nH]c3ncccc13)C2)C(Cl)Cl	1801021488	PZXBNYRAIRLZMH-YWVIFJGQSA-N	425.316	1.889	50	20	IDGD	
COC[C@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H]1CN(Cc3ccccc3)CCO1)C2	1802274382	WUNUPIOHXYJECV-HGJUEJDCSA-N	449.979	1.779	50	20	IDGD	
Cc1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CCC(=O)NN(C)C)nn1C(F)F	1802337042	RGZZANCTAAVKFN-BTTYYORXSA-N	426.468	1.211	50	20	IDGD	
CC(C)(C)n1cc(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)cn1	1804925215	BKGHTEKMWBMSIP-SZMVWBNQSA-N	433.940	1.952	50	20	IDGD	
COC(C)(C)C(=O)N1CCCC2(CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CC2)C1	1804963205	KYYUXOOMWKTAON-LFVJCYFKSA-N	431.537	1.777	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2cc(C(C)=O)[nH]n2)[C@H]1c1cccnc1	1805261057	DFHNWNQPPZPNLS-RLFYNMQTSA-N	433.896	1.581	50	20	IDGD	
O=C([C@@H]1CC(c2ccccc2)=NN1)N1CCC2(CCCN(C(=O)[C@@H](O)CCl)C2)CC1	1805525852	HDTJHWNEBHIKHF-OALUTQOASA-N	432.952	1.584	50	20	IDGD	
CS(=O)(=O)CCC(=O)N1CC[C@H](CNC(=O)CCBr)[C@@H]1c1cccnc1	1806345949	KSHDHVFAAAPUNU-PBHICJAKSA-N	446.367	1.307	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)Cc2cccs2)[C@H]1c1cccnc1	1807552314	SYBUKWRSKUALLB-HTAPYJJXSA-N	443.573	1.765	50	20	IDGD	
CCNC(=S)NCC(=O)N1CC[C@H](CNC(=O)[C@@H](Cl)CC)[C@H]1c1cccnc1	1808277362	DFVBIOYGKKCJLG-HLLBOEOZSA-N	425.986	1.589	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)C(C)(C)C#N)[C@H]1c1cccnc1	1808410610	VFDOFGSUXDQXTQ-CRICWCDVSA-N	449.515	1.771	50	20	IDGD	
COC(=O)c1ccc(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)cn1	1808589471	NQVWVJILCACXJX-WBAXXEDZSA-N	446.891	1.183	50	20	IDGD	
N=C(N)SCC(=O)N1CC[C@H](CNC(=O)[C@H](F)Br)[C@H]1c1cccnc1	1808661669	OJABGHVKELSLBZ-RTXFEEFZSA-N	432.319	1.405	50	20	IDGD	
O=C(Cc1ccccc1O)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1	1809974618	XFJWIDOQQAJTLE-UHFFFAOYSA-N	436.317	1.160	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1CCN(C(=O)Cn2ccncc2=O)[C@H]1c1cccnc1	1810543563	BXYAXJHQVZWGTG-UWJYYQICSA-N	443.580	1.196	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2cccc(F)c2)[C@H]1c1cccnc1	1811807683	SGQNOTPWIOOPDR-PGRDOPGGSA-N	441.507	1.913	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)CNC(C)=O)[C@@H]1c1cccnc1	1812623564	ROHXYQORIDWELA-ZOBUZTSGSA-N	425.327	1.397	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)CC(F)(F)C(=O)O)[C@@H]1c1cccnc1	1812865437	YKDWEPLNFXSZPZ-VHRBIJSZSA-N	448.264	1.981	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H](CNC(=O)[C@@H](C)n2cncn2)[C@@H]1c1cccnc1	1813397999	ZMEUULJIQXBFPJ-SRABZTEZSA-N	449.353	1.971	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)C#CC2CC2)n[nH]1	1815117427	ANVLSYPOBVURKK-MJDKSPQASA-N	435.488	1.949	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc(F)s2)[nH]n1)c1ccc(B(O)O)cc1	1817471099	RQPFLUSEJVCDGM-OAHLLOKOSA-N	442.281	1.910	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)Cc2ccc(F)cn2)n[nH]1	1817544752	ZUCXVMPXONJOSM-KRWDZBQOSA-N	445.499	1.552	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H]2CCOC2)[nH]n1	1818114420	ZITAVTDXDYKTDB-HTCGYUKTSA-N	441.492	1.572	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](F)Br)CC2)c1n[nH]cc1[N+](=O)[O-]	1820304172	MJHHPTCQMBVLSY-XUOSJQGZSA-N	447.246	1.691	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnn3c2OCCC3)[nH]n1	1822375451	DBINIHPPZXAPKK-HIFRSBDPSA-N	436.900	1.948	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)C2CC(F)(F)C2)CC1	1823853562	FTBXLLPAJNWGJW-LJQANCHMSA-N	434.292	1.645	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)cnc1C	1825391656	ZNOMDYLEHCWNFO-HSZRJFAPSA-N	449.360	1.925	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)CCN2CCCCC2)CC1	1826545406	JNARGSNSPPFJAT-OAQYLSRUSA-N	449.640	1.855	50	20	IDGD	
C=CCOCCCC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827049017	FUKZKZURJIYUSR-QFIPXVFZSA-N	442.365	1.583	50	20	IDGD	
O=C(CCc1cccnc1)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827052744	DAHKAZGLVJHQDZ-HSZRJFAPSA-N	449.360	1.628	50	20	IDGD	
O=C(C(Cl)Cl)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827060504	MERRDKSGIJMELN-MRXNPFEDSA-N	427.137	1.403	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4nn[nH]c4c3)C2)C1	1830366677	TZKFIBYBACOQLC-FQEVSTJZSA-N	435.912	1.293	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccnc2C(N)=O)CC1	1831827875	LRWAGKUISJSQMZ-SJORKVTESA-N	436.940	1.668	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)CC(=O)OC(C)(C)C)CC2)CC1	1833609374	HOWNKCYPAJETNI-KRWDZBQOSA-N	445.988	1.544	50	20	IDGD	
O=C(CCNC(=O)c1ccc[nH]1)NC1CCN(C2CCN(C(=O)[C@@H](F)Cl)CC2)CC1	1833799485	OSWBPJYUAWTILA-GOSISDBHSA-N	441.935	1.241	50	20	IDGD	
Cc1[nH]nc(C(=O)NC2CCN(C3CCN(C(=O)CO[Si](C)(C)C)CC3)CC2)c1F	1834018684	CKGYDSPHUBWLQV-UHFFFAOYSA-N	439.608	1.894	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@]3(CN(C(=O)CCBr)CCO3)C2)c(O)c1	1834826831	YATKFZHWCZLFOK-IBGZPJMESA-N	441.322	1.556	50	20	IDGD	
Nc1ncc(C(=O)N2CCC(N3CCC(NC(=O)[C@@H](F)Br)CC3)CC2)s1	1836412504	KDZXWWAXYKXVQD-CYBMUJFWSA-N	448.362	1.601	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc4n[nH]cc4c3)CCO2)C1	1836424606	SWJZJYLLUSPYBP-NRFANRHFSA-N	434.924	1.898	50	20	IDGD	
N#Cc1ccc(F)c(C(=O)N2CCC(OC3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)c1	1836717757	IWPWBZZRJURHTN-IBGZPJMESA-N	437.899	1.909	50	20	IDGD	
O=C(c1snnc1C1CC1)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836718077	RPXPTQRGOIQMKS-OAHLLOKOSA-N	442.969	1.627	50	20	IDGD	
O=C(O)c1cc(C(=O)N2CCC(OC3CCN(C(=O)[C@@H](F)Cl)CC3)CC2)ncn1	1837289312	VWNZGSKJCFQKCA-OAHLLOKOSA-N	428.848	1.321	50	20	IDGD	
C=CC[C@H](C)C(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1	1837921337	AYMBYDCPXHYRHX-KRWDZBQOSA-N	428.338	1.191	50	20	IDGD	
O=C(c1ncccc1C(F)(F)F)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1838142174	GEULTHFYICNHSW-BBRMVZONSA-N	439.793	1.705	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3ccc(OC)cn3)CC2)CC1	1838176476	HKPIICYQCJMCHF-SFHVURJKSA-N	439.940	1.956	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)Cc3cc(C)[nH]n3)CC2)CC1	1838413872	RJOIZCBQGGBXPW-GOSISDBHSA-N	426.945	1.513	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)c3cc(O)no3)CC2)CC1	1838482565	LFOZTFIFGGQUFL-NSHDSACASA-N	430.299	1.776	50	20	IDGD	
COc1cc(C#N)cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)c1	1838581846	SEJQPCHQFRCRSV-APWZRJJASA-N	425.844	1.171	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(O)cc3F)CCO2)C1	1839317550	IUNZHZRINGPCTP-KPZWWZAWSA-N	445.285	1.385	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3ccc(C#N)cc3)C2)C1	1840149661	WPKZULSFOCTGQT-SIKLNZKXSA-N	449.935	1.201	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4c(c3)COC4)C2)C1	1840152615	NJSNZAWHESIELS-RXVVDRJESA-N	438.908	1.041	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3ccc(C)cc3)C2)C1	1840156445	SIUJJUXUSOKDSG-KNQAVFIVSA-N	438.952	1.638	50	20	IDGD	
O=C(/C=C/c1ccc(Cn2ccnc2)cc1)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1	1841350403	ZQKAXJKSYBKBOM-GHOSXJJBSA-N	428.920	1.748	50	20	IDGD	
O=C(c1cc2c(F)cc(F)cc2[nH]1)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843013971	JJEHYULKDGJXHZ-UHFFFAOYSA-N	439.227	1.257	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2cccc3ccccc23)C1	1843623443	HJBIWWKYADLSDH-UHFFFAOYSA-N	429.480	1.969	50	20	IDGD	
CC(C)(C)OC(=O)N1CCCC[C@H]1C(=O)N1CCCC12CN(C(=O)[C@H](O)CCl)C2	1844256340	ASMJTCNWMLVUCU-LSDHHAIUSA-N	429.945	1.579	50	20	IDGD	
COc1cccc(Cl)c1C(=O)N1CC2(CCCN2C(=O)c2cnccc2C(=O)NN)C1	1844265524	LMSGQZYYZUJECU-UHFFFAOYSA-N	443.891	1.478	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)c2n[nH]cc2I)C1	1844466540	HESYMPBZXMQKHJ-SECBINFHSA-N	436.681	1.849	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)CCOCCOCCOCCOC)C1	1845245272	NNVRAFZEFZPWLY-GOSISDBHSA-N	448.988	1.684	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)C(Cl)(Cl)Cl)C1	1846036317	VYJBHOXBQZKDDA-UFFVCSGVSA-N	434.711	1.694	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@H](NC(=O)OC(C)(C)C)C1CC1)C2	1846362015	CFSSCQJNYREVGE-GJZGRUSLSA-N	429.945	1.747	50	20	IDGD	
COc1ccc2c(CC(=O)N3CC4(CCCN4C(=O)CCC(=O)NN(C)C)C3)c[nH]c2c1	1846383993	QSXCITBLUPLQQP-UHFFFAOYSA-N	441.532	1.295	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)CCCN1C(=O)NC(C)(C)C1=O	12689440	WKBIBTUFAPGXAJ-UHFFFAOYSA-N	429.502	1.990	50	20	IDGD	
COc1ccc(S(N)(=O)=O)cc1C(=O)NNC(=O)c1sc(-c2ccccc2)nc1C	12690460	WLYOLFSEOFHAER-UHFFFAOYSA-N	446.510	1.849	50	20	IDGD	
C[C@@H]1Oc2ccccc2O[C@H]1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	14287689	JCSMCEHKSYGYRT-IFXJQAMLSA-N	445.497	1.461	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)c3cc(C)no3)c2)cc1	17396714	XFIALTIRKHOTCS-UHFFFAOYSA-N	430.442	1.867	50	20	IDGD	
Cc1csc(SCc2ccc(C(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)cc2)n1	17642321	UHYTURWYROXHHN-CQSZACIVSA-N	425.557	1.940	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)CCCN1C(=O)NC(C)(C)C1=O	18052505	UHBKZFAYNUCBCK-AWEZNQCLSA-N	426.473	1.865	50	20	IDGD	
CCOC(=O)NNC(=O)CCc1nc2cc(S(=O)(=O)N3CCCCC3)ccc2n1C	21770353	FVVOGIVZMBUTQR-UHFFFAOYSA-N	437.522	1.458	50	20	IDGD	
COCCOC(=O)c1c(C)[nH]c(C(=O)NNC(=O)c2cc(Br)c[nH]2)c1C	107613601	SJFKZPWEIGMNDQ-UHFFFAOYSA-N	427.255	1.600	50	20	IDGD	
O=C(NCCc1ccn(-c2ccccc2)n1)NNC(=O)c1csc(N2CCOCC2)n1	725860870	YUXPDSRKELBPDZ-UHFFFAOYSA-N	441.517	1.352	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1F	726445197	UHWUZARVKNNYHA-UHFFFAOYSA-N	432.886	1.767	50	20	IDGD	
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC[C@H](C(=O)NNC(=O)CCCc2ccccc2)C1	728217576	KWQPGTVZNIWFQA-SFHVURJKSA-N	447.561	1.598	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)[C@H]2CS[C@@]3(C)CCC(=O)N23)c1	728529877	RNWTYVLLPCFGGQ-WBMJQRKESA-N	428.308	1.673	50	20	IDGD	
CN(C)CCCOc1ccc(CNC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1	728602261	GJYHQDDDRNGZND-UHFFFAOYSA-N	448.545	1.565	50	20	IDGD	
CSC[C@H](C(=O)NNC(=O)Cn1ccc2ccccc21)N1C(=O)[C@H]2CCCC[C@@H]2C1=O	729448431	QUEIDHVHFMOYOK-XYJFISCASA-N	442.541	1.696	50	20	IDGD	
CC(=NNC(=O)c1ccc(O)cc1)c1cccc(N(S(C)(=O)=O)S(C)(=O)=O)c1	729818216	KXPJSWFAILBPID-UHFFFAOYSA-N	425.488	1.272	50	20	IDGD	
C=CCN1CCC(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)CC1	730125246	PBNXIBLOZJAULV-UHFFFAOYSA-N	449.577	1.456	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)[C@@H]2COc3ccc(Cl)cc3C2)ccc1Cl	731784872	IZFLJRFUYLPUBK-NSHDSACASA-N	444.296	1.653	50	20	IDGD	
O=C(NCc1ccco1)NNC(=O)C1(NS(=O)(=O)c2cccc(F)c2)CCCCC1	732063156	NAKWWSOTZINVSP-UHFFFAOYSA-N	438.481	1.931	50	20	IDGD	
CCOc1ccccc1C(=O)N1CCC[C@@H]1C(=O)NNC(=O)CCN1C[C@@H](C)O[C@H](C)C1	732261354	CFKHUKLZCXKDOM-ZHALLVOQSA-N	446.548	1.337	50	20	IDGD	
CCOc1cc(/C=C(\C#N)C(=O)c2c(N)n(C)c(=O)n(C)c2=O)cc(Br)c1O	732578183	IUXXZXIPTVZAPN-BJMVGYQFSA-N	449.261	1.323	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)CCN/C(O)=C1\N=CC=CC1=O	733886496	MWALLFXYVBMCIR-FBMGVBCBSA-N	425.470	1.796	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)[C@H]1CCCCN1C(=O)c1cccs1	734239377	NTGLAYATXBMZMF-CYBMUJFWSA-N	439.538	1.598	50	20	IDGD	
C[C@@H]1CN(c2ccc(C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)cn2)C[C@@H](C)O1	734242227	XUAOCWCCXCWSLJ-ZIAGYGMSSA-N	436.513	1.164	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2cc(-c3ccccc3)no2)CC1	735118232	NURXNTADNUIAPD-UHFFFAOYSA-N	442.501	1.430	50	20	IDGD	
CCCCN(C)S(=O)(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	739667559	QHTBNUHVAKNVJO-UHFFFAOYSA-N	443.529	1.656	50	20	IDGD	
COc1ccc(C(=O)NNc2ncnc3[nH]cnc23)cc1S(=O)(=O)N1CCCCCC1	740746641	YQRLZLYHSWUOTH-UHFFFAOYSA-N	445.505	1.683	50	20	IDGD	
C[C@H](C(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)N1CCc2ccccc2C1	740988041	UYYQFECJRCGBGC-CQSZACIVSA-N	426.429	1.346	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(CC(=O)NNc2ccc(Br)nc2)C(=O)C1	741284209	JJNVNSDMWWAKCZ-UHFFFAOYSA-N	428.287	1.367	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2ccc(N3CCCS3(=O)=O)cc2C)cc1OC	741515564	XPGVTXWTAIWXSW-UHFFFAOYSA-N	433.486	1.627	50	20	IDGD	
CCCc1c(C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)nnn1-c1ccc(C(C)(C)C)cc1	741521520	LCJGJKQKTCVBSV-CQSZACIVSA-N	447.561	1.713	50	20	IDGD	
CC(C)(C)NC(=O)Nc1ccc(Cl)c(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)c1	741674361	XZNFAFCBORTUPC-LLVKDONJSA-N	445.929	1.391	50	20	IDGD	
CC(C)c1nn([C@H]2CCS(=O)(=O)C2)cc1C(=O)NNC(=O)COc1ccc(C#N)cc1	742471080	NLYSWYIEQSGJLZ-HNNXBMFYSA-N	445.501	1.078	50	20	IDGD	
CCCCOc1ccc(C(=O)NNS(=O)(=O)c2cccc(-n3cnnn3)c2)cc1OC	743731545	ZUBKRXYUFGBCGE-UHFFFAOYSA-N	446.489	1.473	50	20	IDGD	
CC(C)c1ncc(Cl)c(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)n1	743738228	XMEASPPAYZZWIK-UHFFFAOYSA-N	425.898	1.579	50	20	IDGD	
COc1ccc(C(=O)N2CCN(CC(=O)NNC(=O)c3cccc(C)c3)CC2)cc1OC	744386057	YHXUUQJIKNGGEY-UHFFFAOYSA-N	440.500	1.231	50	20	IDGD	
Cc1ccc(C)c(N2N=C(C(=O)OCC(=O)NNC(=O)c3ccc(C#N)cc3)CCC2=O)c1	744456067	WXILCLOPDVHJDP-UHFFFAOYSA-N	447.451	1.662	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)c2cccc(N3CCCS3(=O)=O)c2)c1	744543924	YMEAJNXPIUWKAS-UHFFFAOYSA-N	431.470	1.153	50	20	IDGD	
Cn1ccc(N2CCC[C@@H](NC(=O)NNC(=O)c3cc4c(s3)CCCCC4)C2=O)n1	745884304	UOCGMYFLWZZTPM-CQSZACIVSA-N	430.534	1.890	50	20	IDGD	
C[C@H](CCc1ccc2c(c1)OCO2)NC(=O)NNC(=O)c1csc(N2CCOCC2)n1	746232366	PKXQLPCOHGARAB-CYBMUJFWSA-N	447.517	1.674	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)NNC(=O)c1ccc(Cl)cc1F	747490316	IWDJIFLSRNIYAU-UHFFFAOYSA-N	442.860	1.061	50	20	IDGD	
Cc1nc(Cl)cc(NNC(=O)[C@@H]2CCCN2C(=O)/C=C\c2ccc(C(N)=O)cc2)n1	748333191	BXUKTKJIMVYYFJ-AJHXJQRKSA-N	428.880	1.685	50	20	IDGD	
CCc1cc(N2CCC(NC(=O)NNC(=O)c3cc(OC)cc(OC)c3)CC2)ncn1	748664574	ZNBVFNTXZMOBCG-UHFFFAOYSA-N	428.493	1.669	50	20	IDGD	
CN(C)[C@H]1CCC[C@@H](NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)C1	749591702	QZNUAFHWJOCIRS-SJORKVTESA-N	437.566	1.288	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)N[C@H]2CC(=O)N(C(C)C)C2)c2ccccc2c1=O	750643234	HFCXRECZJIHPLA-AWEZNQCLSA-N	428.493	1.150	50	20	IDGD	
C[C@@H]1C[C@H](NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)CCN1Cc1ccccc1	751097045	BBELASOEGMSVKL-SJLPKXTDSA-N	448.527	1.931	50	20	IDGD	
O=C(NNC(=O)c1occc1Br)c1cccc(S(=O)(=O)N2CCCC2)c1	751209171	WVBRAXUXFBFBNS-UHFFFAOYSA-N	442.291	1.901	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)NNc2ccccc2S(=O)(=O)NC(C)(C)C)c(C)o1	751391823	SWHVPSMFESVKSQ-UHFFFAOYSA-N	444.535	1.330	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2ncccc2OCC(F)(F)F)c2ccccc2c1=O	752502065	AQAGGDSMZUNLLM-UHFFFAOYSA-N	435.362	1.827	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2Cl)c1)N[C@H]1CCOC1	752699087	IURQLKRUNKHUOK-ZDUSSCGKSA-N	438.893	1.874	50	20	IDGD	
Cc1cc(C)c(C)c(S(=O)(=O)NCC(=O)NNc2nc3ccccc3c(=O)n2C)c1C	752907523	LGHHJWJNDMBNRC-UHFFFAOYSA-N	443.529	1.589	50	20	IDGD	
Nc1nc(Cl)cc(NNC(=O)c2sccc2S(=O)(=O)NCc2ccco2)n1	753450815	ZATVNYXUWAPXDI-UHFFFAOYSA-N	428.883	1.602	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(NC(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)c1	755367246	PNNNGIAIDYAJIL-UHFFFAOYSA-N	446.464	1.933	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCCCC2)cc1NC(=O)NNC(=O)c1ccccn1	755412032	ODFAUWPTPIJRGQ-UHFFFAOYSA-N	433.490	1.731	50	20	IDGD	
CCOC(=O)c1cnn(-c2ccc(NC(=O)NNC(=O)COC)cc2)c1C(F)(F)F	755912119	DTWBIAOFPUIFLU-UHFFFAOYSA-N	429.355	1.867	50	20	IDGD	
C[C@@]1(c2cccc(C(=O)OCC(=O)NNC(=O)c3cccc(Cl)c3)c2)NC(=O)NC1=O	756223192	SUSYUXUFYIUIRD-FQEVSTJZSA-N	444.831	1.013	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)Nc2c(C(=O)N3CCOCC3)oc3ccccc23)n1	756288021	ZQXHRXAIVKQFNV-UHFFFAOYSA-N	440.460	1.571	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN[C@@](C)(C(N)=O)c2cccc(Cl)c2)cc1OC	756602169	SADNHHFBOQAOCV-HXUWFJFHSA-N	434.880	1.109	50	20	IDGD	
O=C(CN1CCN(CC(=O)Nc2ccc(Cl)cc2)CC1)NNC(=O)c1cccs1	756651550	RSAMCUXEEBBJNA-UHFFFAOYSA-N	435.937	1.419	50	20	IDGD	
CN(C)c1nnc(-c2ccc(NC(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)cc2)o1	757720656	WVNVWOHGMSISLR-UHFFFAOYSA-N	434.420	1.245	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)Nc1cnn(-c2cnc3ccccc3n2)c1	757782468	GBJNVGBQAGMJBB-UHFFFAOYSA-N	441.415	1.258	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)Nc1ccc(F)c(S(=O)(=O)NC2CC2)c1	757871256	HGHKKCRDHLCJPC-UHFFFAOYSA-N	436.465	1.758	50	20	IDGD	
CC(C)Oc1ncc(C(=O)N2CCN(S(=O)(=O)CBr)CC2)cc1Cl	758535818	SQXZJOUHFIWZDF-UHFFFAOYSA-N	440.747	1.962	50	20	IDGD	
Cc1c(C(=O)OCC(=O)NNC(=O)c2cccs2)cnn1CCO[C@@H]1CCCCO1	758620143	QEPJKHOPFOWMPJ-QGZVFWFLSA-N	436.490	1.414	50	20	IDGD	
O=C(Cc1cc(O)nc(O)n1)NN=C1CCOc2c1cc(Br)cc2[N+](=O)[O-]	761813749	WWPCJSAHGQVGPI-UHFFFAOYSA-N	438.194	1.404	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)CN2C(=O)N[C@]3(C[C@@H](C)CC(C)(C)C3)C2=O)n1	762899332	BHNXVUDTMUMRMX-QKKBWIMNSA-N	431.541	1.903	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)[C@@H](C)Sc3nnnn3C3CC3)n[nH]2)cc1	763166600	VIEKGJGYRLPKMQ-LLVKDONJSA-N	426.506	1.902	50	20	IDGD	
Cc1nnnn1-c1cc(NC(=O)C(=O)NNC(=O)c2cc3ccccc3cc2O)ccc1F	763528674	XJHAKYADZWTZKY-UHFFFAOYSA-N	449.402	1.368	50	20	IDGD	
Cc1noc(COc2ccc(NC(=O)C(=O)NNC(=O)c3c[nH]c4ccccc34)cc2)n1	763536204	NNFUQVWZFPKAIT-UHFFFAOYSA-N	434.412	1.838	50	20	IDGD	
CCOc1cc(NC(=O)C(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)ccc1C	763539554	NFJDWVVCUCOXLH-UHFFFAOYSA-N	431.445	1.819	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(N3CCO[C@H](C)C3)cc2)cc1OC	763550377	LBUPKYXBHGWOFA-CQSZACIVSA-N	442.472	1.329	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)Nc1ccc(N2CCSCC2)cc1	763574590	FUCFTULNCLNZCV-GOSISDBHSA-N	442.497	1.166	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1	763625586	UXTPHHWHVOSHKD-UHFFFAOYSA-N	430.346	1.933	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(Oc3cccnc3)nc2)cc1	763661186	LAGDRDDPNSRPDR-UHFFFAOYSA-N	437.412	1.442	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccccc1-n1c(C)cnc1O	763662211	GEWAJQGCFGNHJX-UHFFFAOYSA-N	439.428	1.060	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(OC3CCC3)c(F)c2)cc1	763675456	WTYRUMDWFFBPNP-UHFFFAOYSA-N	426.404	1.794	50	20	IDGD	
CCN(Cc1ccccc1NC(=O)C(=O)NNC(=O)COc1ccccc1F)C(C)=O	763682169	YQHASAWNHSUABA-UHFFFAOYSA-N	430.436	1.359	50	20	IDGD	
CC(=O)N1CCCc2cc(NC(=O)C(=O)NNC(=O)CN3CCCc4ccccc43)ccc21	763728852	RWJKERZAVCTUPE-UHFFFAOYSA-N	449.511	1.524	50	20	IDGD	
COc1ccccc1SCC(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	763792792	ZOHSMLPOCYHNJK-INIZCTEOSA-N	432.454	1.318	50	20	IDGD	
CCOC(=O)c1cc(F)c(F)cc1NC(=O)C(=O)NNC(=O)COc1ccc(F)cc1	763838057	MKXPQGMEUGYWPH-UHFFFAOYSA-N	439.346	1.446	50	20	IDGD	
CN1CCN(c2ccc(NC(=O)C(=O)NNC(=O)Cc3ccc(F)cc3)cc2Cl)CC1	763919492	UNZMIJMTYAEESM-UHFFFAOYSA-N	447.898	1.560	50	20	IDGD	
Cc1ccc(C)c(-n2ncc(NC(=O)C(=O)NNC(=O)c3ccc4c(c3)OCCO4)c2C)c1	764006349	PKNJERYXGLOMAP-UHFFFAOYSA-N	449.467	1.968	50	20	IDGD	
O=C(NNC(=O)c1cccc2ccccc12)C(=O)Nc1cccn(CC(F)(F)F)c1=O	764049801	YBKNXWVLOQTOEX-UHFFFAOYSA-N	432.358	1.964	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccccc2-n2c(C)cnc2O)c1O	764130484	IWXFXBTZJPQDKY-UHFFFAOYSA-N	425.401	1.000	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccc(Cl)c(C[S@@](C)=O)c1	764139233	PDELNNNZKJGJOT-GDLZYMKVSA-N	437.905	1.556	50	20	IDGD	
C[C@@H]1CCCCN1CC(=O)Nc1ccc(F)c(NC(=O)C(=O)NNC(=O)CC2CC2)c1	764143587	WKUWMSJINAJPJX-CYBMUJFWSA-N	433.484	1.525	50	20	IDGD	
Cc1noc(COc2ccc(NC(=O)C(=O)NNC(=O)CCc3ccccc3O)cc2)n1	764280877	HGQAECFKMFWGCF-UHFFFAOYSA-N	439.428	1.381	50	20	IDGD	
CCOC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(OC)cc2OC)cc1	764284704	QGSMJGKKKBHJIG-UHFFFAOYSA-N	430.417	1.672	50	20	IDGD	
COc1cc(C=NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)ccc1OCC#N	764829814	HWJIXLMVEYYCIE-UHFFFAOYSA-N	435.484	1.506	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)[C@H]2C[C@H]2c2cc(F)c(F)c(F)c2)ccc1Cl	766634547	ZHYOATVGTUWBJI-UWVGGRQHSA-N	447.822	1.969	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)CCN1C(=O)COc2ccccc21	767273341	TVDRGWOXRCOXPZ-UHFFFAOYSA-N	425.441	1.044	50	20	IDGD	
CCNC(=O)N(C)NC(=O)[C@@H]1Cc2ccccc2CN1S(=O)(=O)c1ccc(F)cc1	768412988	MELNMJKWUSSYSM-SFHVURJKSA-N	434.493	1.634	50	20	IDGD	
COc1cc(N[C@H]2CCCN(CC(=O)NNC(=O)c3cccc(C#N)c3)C2)cc(OC)c1	768554806	ZBCLBAPCRTXMNK-SFHVURJKSA-N	437.500	1.913	50	20	IDGD	
COC(=O)c1cc(F)c(Br)c(S(=O)(=O)NNC(=O)Cc2cccnc2)c1	769870009	FKZBZZXIAWRVJQ-UHFFFAOYSA-N	446.254	1.322	50	20	IDGD	
CCNC(=O)N(C)NC(=O)CCNS(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1	770548221	CRNZXTVVGNEVTQ-UHFFFAOYSA-N	430.836	1.720	50	20	IDGD	
Cc1cc(=O)c(C(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)nn1-c1ccccc1	770965015	IOWRCOFXZIZQLR-UHFFFAOYSA-N	434.460	1.898	50	20	IDGD	
CS(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)c2ccc3ccccc3c2)cc1F	771141047	CLQFOLRIMXHCGS-UHFFFAOYSA-N	437.474	1.974	50	20	IDGD	
Cc1ccncc1[C@@H](C)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	771442717	VHVVZPNHGDDJKC-OAHLLOKOSA-N	447.517	1.116	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)C(=O)Nc2ccc(S(=O)(=O)N3CCC(C)CC3)cc2)n1	773483254	TUWFQXVNZKICMB-UHFFFAOYSA-N	446.533	1.596	50	20	IDGD	
O=C(COC(=O)[C@H]1CCN(C(=O)OCc2ccccc2)C1)NNC(=O)c1ccccc1	773584030	OCTGITWWOLCGGF-SFHVURJKSA-N	425.441	1.650	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)/C=C\c2cnc(OC)nc2)c2ccccc2c1=O	773742397	VFWBFBAZEVTSPQ-KHPPLWFESA-N	436.472	1.860	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)NC[C@H]1COC2(CCCCC2)O1	776070297	VCLTZJYSHDXEGP-FQEVSTJZSA-N	445.564	1.605	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)NCc1nc(C(F)(F)F)n[nH]1	776254203	NDJRNFLBWKYGAO-UHFFFAOYSA-N	437.176	1.495	50	20	IDGD	
O=C(NNC(=O)c1ccc2nsnc2c1)c1cccc(S(=O)(=O)N2CCCC2)c1	776703603	YYJDQUDUOFJMSX-UHFFFAOYSA-N	431.499	1.551	50	20	IDGD	
CC(=O)c1ccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c(F)c1	777273292	AKPLYAIJPLAQSB-UHFFFAOYSA-N	433.461	1.888	50	20	IDGD	
COCC(=O)N1CCc2cc(NC(=O)C(=O)NNC(=O)c3ccc(Cl)cc3F)ccc21	778710467	IAMRHPWNIDRUMH-UHFFFAOYSA-N	448.838	1.414	50	20	IDGD	
COCCn1cc(C(=O)NNC(=O)c2cc(-c3ccc(OC)c(OC)c3)[nH]n2)c(C)n1	782556395	PCYHPGSTRKSTBQ-UHFFFAOYSA-N	428.449	1.320	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)nc2ccccc21	782894960	SNZZHWOXAQINAS-UHFFFAOYSA-N	430.808	1.464	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)NC[C@@H]2COC(C)(C)O2)cc(OCC)c1OCC	783273465	YTYBPJCVDKXUPS-CQSZACIVSA-N	425.482	1.978	50	20	IDGD	
CN(C)CCC(=O)Nc1ccc(NC(=O)C(=O)NN=c2sc3ccccc3n2C)cc1	783352150	ZGLADYPLXQMPEC-UHFFFAOYSA-N	440.529	1.701	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N[C@H](C)C[C@@H](C)O)cc1	783628426	JDVIOJLABWXJPS-FNBYNPPRSA-N	425.489	1.617	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)C(=O)Nc1ccc(Sc2ccncc2)cc1	784002478	QHFQIXXPTQGXRM-UHFFFAOYSA-N	439.453	1.342	50	20	IDGD	
COCC[C@@H](Cc1ccco1)NC(=O)NNC(=O)c1sc(N2CCOCC2)nc1C	784171883	OVQVNBORNXUKBY-AWEZNQCLSA-N	437.522	1.473	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)C(=O)Nc1cccc(OCCF)c1	784214626	AWDSQPULAUCSBQ-UHFFFAOYSA-N	436.465	1.557	50	20	IDGD	
Cc1ccc(-n2nc(C)cc2NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2Cl)nn1	784383889	JIFAZOXXDIECHK-UHFFFAOYSA-N	430.812	1.923	50	20	IDGD	
Cc1cc(Br)ccc1NNC(=O)C(=O)Nc1ccc2[nH]nc(C(N)=O)c2c1	784413674	AJLHIBJQWJMAFT-UHFFFAOYSA-N	431.250	1.815	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNc2ccc(Cl)nn2)c(OCC(F)(F)F)c1	784791896	BOYJHWHSLZZMIQ-UHFFFAOYSA-N	447.757	1.940	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNc2ccc(Cl)nn2)cc(OC)c1Br	784792591	SVYSTKXFIFCWNS-UHFFFAOYSA-N	430.646	1.992	50	20	IDGD	
Cn1cc(Br)cc(NC(=O)C(=O)NNc2ccnc(Br)c2)c1=O	784828098	DPLGZMDDRGKNEW-UHFFFAOYSA-N	445.071	1.387	50	20	IDGD	
CC[C@@H](C)NS(=O)(=O)c1cccc(NC(=O)C(=O)NNc2cccc(C(=O)OC)c2)c1	784855254	UMUABWDGZWVICF-CYBMUJFWSA-N	448.501	1.632	50	20	IDGD	
CC(C)(C)OC(=O)NCCOc1ccc(NC(=O)C(=O)NNc2ncc(F)cn2)cc1	784958088	VXWMWNBROCPQLH-UHFFFAOYSA-N	434.428	1.601	50	20	IDGD	
CS(=O)(=O)N1CCc2c(NC(=O)C(=O)NNc3ccc(C#N)c(Cl)c3)cccc21	785092175	COGKDHKLXFHLGZ-UHFFFAOYSA-N	433.877	1.616	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1ccc(OCC(F)F)cc1	785330804	MTJQTRZVZBSRPY-UHFFFAOYSA-N	443.428	1.824	50	20	IDGD	
CC[C@@]1(C)Oc2ccc(NC(=O)C(=O)NNC(=O)c3nnc(O)c4ccccc34)cc2O1	785990567	IUIOXRCXRZBXFM-NRFANRHFSA-N	437.412	1.633	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(C3CCC3)cc2)c1	787541085	LUUXUDBKWUSNOZ-UHFFFAOYSA-N	444.513	1.604	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)N2CCN(C)CC2)ccc1OCC(=O)N1CCCCC1	788166183	JPDRUBQIULZOPV-UHFFFAOYSA-N	447.536	1.078	50	20	IDGD	
CN1CCN(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)c3ccccc3)c2)CC1	788169082	IFCPJOJJPDRNOY-UHFFFAOYSA-N	431.518	1.114	50	20	IDGD	
CN1CCN(C(=O)NNC(=O)c2cc(S(=O)(=O)N3CCCCC3)ccc2Cl)CC1	788169887	UZOJKWQVBJJJEN-UHFFFAOYSA-N	443.957	1.116	50	20	IDGD	
COCCONC(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2Cl)c1	789341601	HLWMHOHABPADCU-UHFFFAOYSA-N	442.881	1.663	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)[C@H]1CC(c2cccnc2)=NO1	790120288	CZEVHCUQRIWRIP-MEDUHNTESA-N	433.262	1.952	50	20	IDGD	
C[C@@](O)(CN1C(=O)NC2(CCCC2)C1=O)C(=O)NNc1ccc(C#N)c(C(F)(F)F)c1	793710993	TUDCYTMHWHGHJG-QGZVFWFLSA-N	439.394	1.636	50	20	IDGD	
CCOC(=O)c1ccc(NNC(=O)CNS(=O)(=O)c2ccccc2[N+](=O)[O-])cc1C	794656479	HBIDTIYLJOTFBW-UHFFFAOYSA-N	436.446	1.502	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H]2CN(CC(=O)NNC(=O)c3cccc(C#N)c3)CC[C@@H]21	795127512	FKJGYSKTDJKLLV-ROUUACIJSA-N	427.505	1.651	50	20	IDGD	
CCOC(=O)c1cc(S(=O)(=O)NNC(=O)c2ccc[nH]2)c(F)cc1Br	795291087	RXOXGWCSSBMVHL-UHFFFAOYSA-N	434.243	1.716	50	20	IDGD	
COCCNC(=O)c1cccc(S(=O)(=O)NNC(=O)c2ccc3ccccc3c2)c1	795298166	DCGBZPRKSFFQFJ-UHFFFAOYSA-N	427.482	1.839	50	20	IDGD	
CCOC(=O)c1ccc(OC)c(S(=O)(=O)NNC(=O)NCCc2cccs2)c1	795303568	XBPJWHXCXWZWIM-UHFFFAOYSA-N	427.504	1.669	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)C(=O)Nc2cccc3c2CCO3)c1	797004799	NMANVKJPQOIUDA-UHFFFAOYSA-N	434.246	1.792	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNC(=O)C(=O)Nc1ccc(Br)cc1	797370178	VIRSIZFWUVHNQM-UHFFFAOYSA-N	449.261	1.461	50	20	IDGD	
O=C(NNS(=O)(=O)c1c(Cl)cc(F)cc1Cl)c1ccc(-n2cnnn2)cc1	797815745	XRCYZSWLRPXMIY-UHFFFAOYSA-N	431.236	1.732	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)nn1)c1cccc(S(=O)(=O)NCc2ccccc2)c1	798154000	PWJBPDQNMIOZLY-UHFFFAOYSA-N	445.888	1.683	50	20	IDGD	
N#Cc1ccc(NNC(=O)c2ccc(S(=O)(=O)CC(N)=O)cc2)c(C(F)(F)F)c1	799752569	PITYZXXEARKAGT-UHFFFAOYSA-N	426.376	1.593	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc2c(cc1Cl)CCC2=O)c1cc([N+](=O)[O-])ccc1O	800837136	BKAZZJNVVSWPGW-UHFFFAOYSA-N	425.806	1.706	50	20	IDGD	
Cn1c(=O)c2cc(C(=O)NNC(=O)Nc3ccc(Cl)cc3Cl)cnc2n(C)c1=O	802094763	YQISRQJZXPWFRH-UHFFFAOYSA-N	437.243	1.406	50	20	IDGD	
COc1ccc(C2=NO[C@H](CNC(=O)NNC(=O)c3ccc4c(c3)OCCO4)C2)cc1	802371103	PGNVISYHDHIJRA-INIZCTEOSA-N	426.429	1.604	50	20	IDGD	
N#Cc1ncn(CCNC(=O)NNC(=O)Nc2ccc(Br)cc2Cl)n1	805824203	YEQBINBDDLKKMN-UHFFFAOYSA-N	427.650	1.602	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)C1(S(=O)(=O)c2ccc(F)cc2)CCCCC1	808611900	KWBKTDHASJXXCK-CYBMUJFWSA-N	428.482	1.791	50	20	IDGD	
CC(C)Nc1ccc(S(=O)(=O)NCC(=O)NNc2ccnc(F)c2)cc1[N+](=O)[O-]	810984825	OYCUULHVYVABKC-UHFFFAOYSA-N	426.430	1.371	50	20	IDGD	
Cc1cc(C)nc(-n2nc(C)cc2NC(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)n1	812916573	XQEOUHVDZCSJBG-UHFFFAOYSA-N	444.521	1.986	50	20	IDGD	
CCOC(=O)c1ccsc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	813033273	LXIYYPSLUFIJME-UHFFFAOYSA-N	440.503	1.257	50	20	IDGD	
CN(C)c1nccc(NNC(=O)C(=O)Nc2cccc(S(=O)(=O)C3CCCCC3)c2)n1	815605272	PTBGZRVIUPYUAE-UHFFFAOYSA-N	446.533	1.731	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNc2ccc3c(=O)[nH]ccc3c2)nnn1Cc1ccccc1F	815639391	WPAWGNDZEZTGBZ-UHFFFAOYSA-N	435.419	1.697	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2CCc3nncn3C2)cc1OCCC(C)C	815692145	KFVFSZBPTJSKHM-HNNXBMFYSA-N	428.493	1.360	50	20	IDGD	
CCOc1ccc(NNC(=O)C(=O)Nc2ccc(NS(=O)(=O)CC)c(OC)c2)cc1	815814991	GJUYSOZSIGAFGI-UHFFFAOYSA-N	436.490	1.937	50	20	IDGD	
CCn1c(NNC(=O)c2ccc(S(=O)(=O)NCCC#N)cc2)nc2ccccc2c1=O	849212865	SYQMCPKDKSVORB-UHFFFAOYSA-N	440.485	1.365	50	20	IDGD	
CSCC[C@H](NC(=O)c1ccccc1)C(=O)NNC(=O)[C@H]1COc2ccccc2O1	859439204	PKJGEFJJYRTOTG-MAUKXSAKSA-N	429.498	1.526	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)[C@H]2CCCN2S(=O)(=O)c2ccc(C)s2)cc1	899379130	PIZRJGFAESZPOK-MRXNPFEDSA-N	436.559	1.778	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)COc2ccc(F)cc2Br)C[C@@H](C)O1	912919395	MTMAYTVLKDRNHK-TXEJJXNPSA-N	432.290	1.614	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C2=NN(c3ccccc3)[C@@H](C(N)=O)C2)c(C)n1-c1ccccc1	913081492	RBIDNCIDFMMIMB-OAQYLSRUSA-N	444.495	1.975	50	20	IDGD	
O=C(CNS(=O)(=O)c1cccc(Br)c1)NNC(=O)c1ccc(Cl)cc1	913108715	FNHDSJKPBCZZGU-UHFFFAOYSA-N	446.710	1.842	50	20	IDGD	
CCN1CCN(S(=O)(=O)c2ccc(Cl)c(C(=O)NNC(=O)OC(C)(C)C)c2)CC1	913176157	DPWVFFHIJYLZEL-UHFFFAOYSA-N	446.957	1.836	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)CCNS(=O)(=O)/C=C\c1ccccc1	913463222	XUHIPHWQRWCSOR-SQFISAMPSA-N	431.514	1.756	50	20	IDGD	
CC(C)(C)OC(=O)NNC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1	913471537	BEWWXJPLZCLPGX-AWEZNQCLSA-N	428.467	1.694	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)COc2ccc(Br)cc2)ccc1-n1cnnn1	914749026	WGPHRYHGKGMUQE-UHFFFAOYSA-N	431.250	1.573	50	20	IDGD	
Cc1cccc(NC(=O)NCC(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)c1	915190952	VTSYCGKQFIFMCV-UHFFFAOYSA-N	436.472	1.869	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2ccc(-n3ccc(C)n3)cc2)cc1	915616668	PZOMWHUSJIYUOV-UHFFFAOYSA-N	441.513	1.571	50	20	IDGD	
CCOc1cc2c(cc1CNC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)O[C@@H](C)C2	915934081	VBDCQXZPOVAZBD-ZDUSSCGKSA-N	447.513	1.956	50	20	IDGD	
COc1cc(C(C)=O)ccc1OCCCC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	916144774	MAVOFINCWXNTAA-UHFFFAOYSA-N	438.444	1.494	50	20	IDGD	
O=C(NCC#Cc1ccccc1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	916246195	JTLNSKBNONMFJK-UHFFFAOYSA-N	426.498	1.467	50	20	IDGD	
O=C(NCc1cccc(NC(=O)C2CCC2)c1)NNC(=O)c1ccc(-n2cnnn2)cc1	916380781	QNFCOKYANAFZMQ-UHFFFAOYSA-N	434.460	1.545	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NCc2ccccc2CN2CCCC2=O)cc1	916413841	MCHFUSKFQFQVCE-UHFFFAOYSA-N	426.473	1.727	50	20	IDGD	
CCCNC(=O)c1cccc(CNC(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)c1	916478539	ISWPLEMBKGRFIX-UHFFFAOYSA-N	448.549	1.734	50	20	IDGD	
CCOc1ccc(/C=C(\C#N)C(=O)OCC(=O)Nc2ccc(S(N)(=O)=O)cc2)cc1	916597747	WKDSBEZVKOQXBP-RVDMUPIBSA-N	429.454	1.822	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)NC[C@]2(N3CCOCC3)CCSC2)c1C	916636687	JQDQCFOVVJVUNT-DYESRHJHSA-N	436.578	1.609	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)c1ccc2c(c1)S(=O)(=O)N(C1CC1)C2=O	916772950	XIBMHPJGKYXNRA-UHFFFAOYSA-N	449.872	1.730	50	20	IDGD	
CN(CCP(=O)(c1ccccc1)c1ccccc1)CC(=O)N[C@@H]1CCS(=O)(=O)C1	917107132	UWKOWQZXFWOXAK-GOSISDBHSA-N	434.498	1.236	50	20	IDGD	
N#Cc1ccc(CSCC(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1	917262317	REOYWAVKVRTIPL-SFHVURJKSA-N	441.465	1.322	50	20	IDGD	
CCNS(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)c2cc(Br)c[nH]2)c1	917938846	QOQCLYOOJQZVRP-UHFFFAOYSA-N	433.259	1.289	50	20	IDGD	
CCC[C@H](C)N1C[C@@H](C(=O)OCC(=O)NNC(=O)c2cc(Cl)ccc2OC)CC1=O	919586914	ZYBMRSUJLVVUFV-STQMWFEESA-N	439.896	1.690	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)c1ccccc1OCc1ccc(Cl)cc1	920297601	KDXNRBOYXWOLOB-GFCCVEGCSA-N	425.894	1.618	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cnn3c(C)cc(C)nc23)c1	1317793054	JOHVTTKMEYRVGQ-UHFFFAOYSA-N	444.517	1.451	50	20	IDGD	
COC(=O)C(=O)NNC(=O)NC[C@H](c1cccc(OC)c1OC)c1c[nH]c2ccccc12	1318875818	CCASXIZCXYZHPS-MRXNPFEDSA-N	440.456	1.820	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1ccc2nnc(C(F)F)n2c1	1319100054	TWBUDWHGBYHUFE-UHFFFAOYSA-N	437.432	1.343	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)Cn2cnc(-c3ccccc3)n2)CC1	1319568743	PVVATFRKHDYIDD-UHFFFAOYSA-N	428.493	1.740	50	20	IDGD	
COC(=O)C(=O)NNC(=O)N[C@@H](CNC(=O)OC(C)(C)C)c1ccc2ccccc2c1	1320309275	JXIZHGACHQKTKL-INIZCTEOSA-N	430.461	1.909	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NN=C[C@@H](C)CNC(=O)OC(C)(C)C)cc1	1327707734	XVRKGXQIRJNVJU-HNNXBMFYSA-N	426.539	1.878	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2ccc([S@@](C)=O)cc2)cc1	1342407933	KPKBFDWOCOAYLR-MUUNZHRXSA-N	438.531	1.206	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(C1)CN(C(=O)c1cccc3ccoc13)CCO2	1779036779	DOCUOBPFPFPGCI-HSZRJFAPSA-N	449.467	1.189	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cn3ncccc3n1)C2	1779544036	HZSMBDHUAAGAGO-DYESRHJHSA-N	445.596	1.708	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(CN(C(=O)c3ccco3)CCO2)C1	1780095743	VOVGTNUBDVCTTP-OAQYLSRUSA-N	443.412	1.870	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](C)NC(=O)c1ccc(F)cc1)CCO2	1781218274	OMHUQYJPMYOSMT-FNXXIHLHSA-N	439.915	1.791	50	20	IDGD	
CN(C)c1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](F)Br)C3)C2)nc1	1781328376	PFASUPCMTVEDHL-WMLDXEAASA-N	429.290	1.282	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781332894	GCROMPOQYVTXQD-MOROJQBDSA-N	447.301	1.262	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)C#CC3(O)CCCCC3)CCO2)C1	1783349647	QBADVMNWOOACEJ-UZLBHIALSA-N	441.366	1.688	50	20	IDGD	
CC(C)(C)OC(=O)N1CC=C(C(=O)N2CCO[C@]3(CCN(C(=O)C(Cl)Cl)C3)C2)C1	1783941432	CWUAYSBFGMAJPT-IBGZPJMESA-N	448.347	1.797	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc(N)s3)C[C@@H]21	1783967806	MELCCEWIYSJBRJ-RHYQMDGZSA-N	431.356	1.350	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=N/N3CCCCC3)C[C@@H]21	1783967846	YCQYPSATHGOMAV-CKCGSTQVSA-N	443.386	1.469	50	20	IDGD	
Cc1nccn1[C@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]2C1	1783975029	YKTSSMQYOXNANW-KUHBDSFDSA-N	441.370	1.763	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3C[C@@H]3F)[C@H]2C1	1784858419	NCVZWAJXYKKIHN-XHFQCFGWSA-N	449.435	1.471	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H](C(=O)N2CC[C@]3(CN(C(=O)[C@@H](F)Cl)CCO3)C2)C[C@H]2C[C@H]21	1785593893	GFSKOOVBZPFDGC-MKOKDDGESA-N	445.919	1.749	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4occc4c3)C[C@@H]21)c1ccc(B(O)O)cc1	1786979903	YQSJVNKDPGFUCV-VCOUNFBDSA-N	448.284	1.020	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H]1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]2C1	1787443623	OYSLOMOPGHOECR-YTFOTSKYSA-N	433.908	1.510	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)c1cccc(-c2ccccc2)n1	1787579945	HQWORGGCSSOJHE-USNOLKROSA-N	443.931	1.942	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc4cccn4cn3)[C@H]2C1	1788074331	JAMMEVOBIHGNLX-OAOQPFQOSA-N	449.349	1.959	50	20	IDGD	
CC(C)(NCCC#N)C(=O)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1	1788143933	XBKDINXQPNMFMP-UHFFFAOYSA-N	448.332	1.396	50	20	IDGD	
Cc1nc(F)ccc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21	1789063214	ZJWIKZUQGCQDHE-NHULGOKLSA-N	432.265	1.813	50	20	IDGD	
CC(C)(C)n1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]3C2)n1	1789922648	QGOMCGFARYZNOK-NZBPQXDJSA-N	445.333	1.922	50	20	IDGD	
C[C@@H](Cc1ccc(F)cc1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21	1790722420	BMXZPIKHXWKOCA-WPHMXFNYSA-N	426.916	1.584	50	20	IDGD	
CC(C)n1nc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C(C)(C)CCl)cc1C(=O)O	1792784188	CPVLDGKNVXCRHX-YWVIFJGQSA-N	440.928	1.630	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2	1792867758	KMZBMHPRPBKBBW-KQXIARHKSA-N	426.149	1.392	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccnc3ncccc13)C2	1792873938	HBKIRZGJSIZHDO-ZJOBFFGXSA-N	447.333	1.864	50	20	IDGD	
C[C@@H](Nc1ccccn1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCBr	1795115982	ZCKNZWVIPMOJLV-VWPFQQQWSA-N	425.327	1.257	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)c1cc(Br)cs1	1796485982	NOSUKSBMYYSYMH-INTNWOOBSA-N	437.743	1.314	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2	1796837193	ONZNCGVNCVPOGN-FAXLKDOZSA-N	439.285	1.536	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)[C@@H]1Cc2ccccc2O1	1797227078	NTBDBAFMMSXLJD-URLPEUOOSA-N	427.270	1.270	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccn(C(F)F)n1	1798160966	QIZVLBLLVOOWOC-HNCHTBHHSA-N	435.269	1.512	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(C(F)(F)F)ccn1	1798195365	YEIXFBNGWXXMNS-NDPMZMCLSA-N	435.830	1.557	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(F)ccc1F)C2	1798439776	DKVOZIQIXYJTIE-BTTYYORXSA-N	429.427	1.529	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cncc(C(F)(F)F)c1	1798947551	ZYPWETXUSWHTDZ-MUJYYYPQSA-N	441.454	1.725	50	20	IDGD	
Cc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)CBr)C3)ccc1O	1799551163	JKMKNQJKRVTNGY-JJAZEVLHSA-N	425.323	1.935	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1c(C)nc2ccc(F)cn12	1799953949	NYHDMIDDHKLMIO-IARIHHJXSA-N	438.887	1.239	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1cc2cccnn2c1	1800009034	QWQKFVRSTGUGSW-AYRXBEOTSA-N	425.258	1.228	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cncc(N(C)C)c1)C2	1800640413	WRBVMXLTSXYHTR-YALNPMBYSA-N	439.354	1.524	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CNC(=O)OC(C)(C)C)C2	1800644139	JYHYVZACDGMILV-XFMPKHEZSA-N	448.358	1.274	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(C#N)cc1Cl	1800691043	JDPLXFUUVWYJBU-MUJYYYPQSA-N	431.924	1.836	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(C)(C)CCl)C2	1800951422	DBBGPCWSNWILKF-ZHCJQAHYSA-N	426.941	1.596	50	20	IDGD	
C/C(=C\c1cccs1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCC(=O)NN(C)C	1801008984	LQROATCMVAQKPK-HUQGBOGLSA-N	434.562	1.114	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1CCN(C(=O)[C@@H]2CNC(=O)O2)[C@H]1c1cccnc1	1803011615	QVPNTLCLUYRKPF-UNQGMJICSA-N	439.310	1.227	50	20	IDGD	
C[C@H](Cc1ccncc1)C(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]1c1cccnc1	1803148881	YEAFSKWJNHHQRC-GEALJGNFSA-N	430.936	1.961	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2nc3ncccn3n2)[C@H]1c1cccnc1	1808265235	LDALVLRCKMMEGQ-JYJNAYRXSA-N	427.896	1.856	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1CCN(C(=O)[C@H]2CCC(=O)N2)[C@H]1c1cccnc1	1808296570	SCGWNIVGEBFRFR-MVWRLGRASA-N	427.332	1.602	50	20	IDGD	
Cc1ccoc1C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1808494414	OZEPQQWGRBIIFM-ICSRJNTNSA-N	433.273	1.296	50	20	IDGD	
Cc1[nH]ccc1C(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1808755914	UPHKEMRLCYPCRM-DYESRHJHSA-N	426.521	1.411	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)c1cccn2ccnc12	1809888163	WLQMIOANSICWJS-CGTJXYLNSA-N	427.892	1.649	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)[C@H]2CCCS2(=O)=O)[C@H]1c1cccnc1	1812497462	KTUANUFPBAUYGQ-YYIAUSFCSA-N	427.954	1.682	50	20	IDGD	
COCCOCC(=O)N1CC[C@H](CNC(=O)[C@@H](C)Br)[C@@H]1c1cccnc1	1812864277	LSZYCYYHBKDGMR-UNEWFSDZSA-N	428.327	1.534	50	20	IDGD	
C=CCNC(=O)/C=C\C(=O)N1CC[C@H](CNC(=O)[C@H](C)Br)[C@H]1c1cccnc1	1812864507	UNPOZIRDGSUEQV-SEKGHDJLSA-N	449.349	1.729	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)N1CC[C@H](CNC(=O)[C@@H](C)Br)[C@@H]1c1cccnc1	1812866126	BDFIFAPWPSHFIU-SMKXDYDZSA-N	437.338	1.562	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2coc(Cl)n2)[C@@H]1c1cccnc1	1813070332	HVQDZKZXMZKDIJ-KBXCAEBGSA-N	448.911	1.416	50	20	IDGD	
O=C1CC[C@@H](C(=O)Nc2cc([C@@H]3CCCCN3C(=O)CCBr)[nH]n2)CN1	1814522795	IIBHLASRQVGZNM-YPMHNXCESA-N	426.315	1.713	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)COC(=O)C(F)(F)F)[nH]n1)[C@@H](O)CCl	1814873755	UCMRCHSNEPCTQF-UWVGGRQHSA-N	426.779	1.107	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(O)cc1)CC2)c1ccc(B(O)O)cc1	1815343903	WAMAAHKGWPNRPY-OAHLLOKOSA-N	437.286	1.068	50	20	IDGD	
Cc1cc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@H](O)CCl)CC3)ncc1[N+](=O)[O-]	1817618543	FVMVBRNYMPBJBZ-NOZJJQNGSA-N	439.881	1.580	50	20	IDGD	
Cc1ccnc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)c1	1818190379	HUSSIZBUPKBXKQ-IBGZPJMESA-N	433.277	1.413	50	20	IDGD	
CC(=O)C[C@@H](C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819404214	DTKUNNWPVUTIOG-PXAZEXFGSA-N	441.492	1.329	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2c[nH]c(=O)cn2)[nH]n1)[C@H](F)Br	1820935870	WBNLWEJELCEIAD-MFKMUULPSA-N	427.234	1.489	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)COc2ccc(O)nn2)n[nH]1	1821667478	AEZOEOHHZYQVEE-YPMHNXCESA-N	438.872	1.230	50	20	IDGD	
O=C([C@@H]1CC[C@@H]2CCC(=O)N2C1)N1CCC([C@H]2CCCCN2C(=O)[C@H](O)CCl)CC1	1824185628	YXORMCXRTSJZKF-NCXUSEDFSA-N	439.984	1.607	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H]1CCC(=O)NC1)CC2	1825631173	CSGYLWMZKUNOHF-IVZWLZJFSA-N	429.340	1.365	50	20	IDGD	
Cc1cccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)n1	1827050636	BGAISVWABZAIQQ-JOCHJYFZSA-N	435.333	1.617	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H]2CC2(F)F)CC1	1828376979	QQTBNRXBQJPNMP-SJORKVTESA-N	435.475	1.574	50	20	IDGD	
CC[C@@H](NC(N)=O)C(=O)N1CCC([C@H]2CCCCN2C(=O)CO[Si](C)(C)C)CC1	1829101905	HNLBPVPAFXQHHB-IAGOWNOFSA-N	426.634	1.905	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2C[C@H](O)CN2)CC1	1830202425	LPBQRBMMWWNSST-HJWJTTGWSA-N	430.387	1.360	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CN2C(=O)CNC2=O)CC1	1830314208	UEPVYKZRWFOGKL-AUUYWEPGSA-N	447.363	1.394	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)o1	1830535851	UQHTYPSLRSHBRC-SCLBCKFNSA-N	429.311	1.689	50	20	IDGD	
CCNC(=S)NCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H](C)Br)CC1	1831092690	AJHPHHUAEFUBPU-DZGCQCFKSA-N	447.443	1.874	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCN2CCCCC2)CC1	1831871622	VPVOUTHCWBPYDL-OAQYLSRUSA-N	449.640	1.855	50	20	IDGD	
CC(C)c1nc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)co1	1833348215	MFTIDBBMEXEVKN-FZKQIMNGSA-N	444.326	1.651	50	20	IDGD	
C=CCNC(=O)/C=C\C(=O)N1CCC(N2CCC(NC(=O)[C@H](Cl)CCC)CC2)CC1	1833530808	XGLHQNCXDPPEJU-LIXSYLKWSA-N	439.000	1.824	50	20	IDGD	
CN1CCC[C@H]1C(=O)NC1CCN(C2CCN(C(=O)[C@@](C)(Cl)CCl)CC2)CC1	1833622077	DNLXVMJKICHETB-PXNSSMCTSA-N	433.424	1.889	50	20	IDGD	
Cc1nc(C)c(C(=O)N2CCO[C@]3(COCCN(C(=O)CCBr)C3)C2)s1	1834072590	NHQPOYMFGXEIRN-KRWDZBQOSA-N	446.367	1.615	50	20	IDGD	
Cc1csc(C(=O)N2CCOC[C@]3(CN(C(=O)CCBr)CCO3)C2)c1	1834818676	BOVRAXDGIQGAAU-KRWDZBQOSA-N	431.352	1.912	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)Cc3cccnc3)CC2)CC1	1834880778	DKSVRKCWVHLBPG-OAHLLOKOSA-N	437.382	1.979	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](OC)c1ccccc1)CCO2	1834928133	NUWWGHNNQDZAOA-DBXWQHBBSA-N	440.924	1.084	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccccn3)CCO2)C1	1836191834	YASPQRSWTQLPRI-MOPGFXCFSA-N	430.332	1.317	50	20	IDGD	
O=C(CSc1ncccn1)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836716568	CHLLJUUDZYAYKN-INIZCTEOSA-N	442.969	1.167	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)Cc3cncnc3)CC2)CC1	1837198947	MHUUBGHNWOVDQT-CQSZACIVSA-N	439.354	1.801	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccncc3Cl)C2)C1	1837715340	LLCTVWSLTYUDMT-LJQANCHMSA-N	441.988	1.657	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(O)nc3)CCO2)C1	1838651570	XLJNNXDMPVDOBL-MSOLQXFVSA-N	432.304	1.094	50	20	IDGD	
O=C(Cc1c(F)cccc1F)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1838996124	CCZWLQHWVMTJLB-GOSISDBHSA-N	437.270	1.767	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccsc3)C2)C1	1839963414	JKZOVJGKFMLILS-YOEHRIQHSA-N	431.352	1.992	50	20	IDGD	
O=C(CCc1cnc2[nH]ccc2c1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1840080729	AJJCNSUSLMIOFO-YLJYHZDGSA-N	438.887	1.486	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCCC12CN(C(=O)[C@@H](O)C(C)(C)C)C2	1841923888	BJLVRSCCIZAEFA-UONOGXRCSA-N	431.961	1.729	50	20	IDGD	
Cc1oncc1C(=O)N1CCCC12CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2	1842488937	WQJGHXKULYIJAL-UHFFFAOYSA-N	440.504	1.146	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)[C@@H](C)n2cccc2C=O)C1	1843020926	VEMNPJGUXKBGFD-DTVDJLOLSA-N	438.488	1.199	50	20	IDGD	
O=C([C@H](O)CCl)N1CC2(CCCN2C(=O)c2cn3ccc(Br)cc3n2)C1	1843989619	OCYHIKARSBUWEN-CYBMUJFWSA-N	441.713	1.514	50	20	IDGD	
O=C([C@@H](F)Br)N1CC2(CCCN2C(=O)c2cc(Cl)c3nncn3c2)C1	1844226634	HGISEZQNJRPCTQ-LLVKDONJSA-N	430.665	1.890	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)C(C)(C)c2ccccn2)C1	1846517274	KHLJXMHNICQQAM-WGOQTCKBSA-N	436.516	1.697	50	20	IDGD	
CN(CC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)C1CC(F)(F)C1)NC(=O)NCc1ccccc1	1847333134	LIWDKLZRVFEWON-ROUUACIJSA-N	449.502	1.580	50	20	IDGD	
Cc1nc(CC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)no1	1848095871	WPCIBWSZACMBGK-IHRRRGAJSA-N	441.916	1.254	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)N1CCN(S(=O)(=O)c2cccc([N+](=O)[O-])c2)CC1	9796673	NGZQITUOXZSBDH-UHFFFAOYSA-N	447.473	1.264	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=S)NCCc2cccs2)n(C)c1	11523606	MCWOBAREZYDKQD-UHFFFAOYSA-N	443.620	1.469	50	20	IDGD	
Cc1cc(C)n(-c2ccc(C(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)cc2)n1	16593857	SVDYALVCLIXFEU-UHFFFAOYSA-N	441.513	1.814	50	20	IDGD	
Cc1nc2nc(N)nn2c(C)c1CC(=O)NNC(=O)[C@H](C)Oc1ccc2ccccc2c1	18052894	KEEMEUZKWVQPDG-AWEZNQCLSA-N	433.472	1.634	50	20	IDGD	
COC1(C(=O)NNC(=O)CNC(=O)c2cccs2)CCN(C(=O)OC(C)(C)C)CC1	725740846	ZVPIHRPXFBJDFT-UHFFFAOYSA-N	440.522	1.041	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)[C@H]1CCCN(C(=O)c2ccc3n[nH]cc3c2)C1	725888716	BHSYUDHEPXXETQ-KRWDZBQOSA-N	435.484	1.814	50	20	IDGD	
CCCc1nc(C(=O)N([C@H]2CCS(=O)(=O)C2)N(C)C)nn1-c1ccccc1Cl	728161334	GRQQBKUYHZBSKA-ZDUSSCGKSA-N	425.942	1.979	50	20	IDGD	
C[C@H](OC[C@@H]1CCCCO1)C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	728214568	AJLSAQNGKXBTQY-WMZOPIPTSA-N	440.566	1.040	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2CCCN2c2ncnc3sccc23)c1	728464273	QBUPYKQHCMHBCR-HNNXBMFYSA-N	445.526	1.525	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(n2cc(C(=O)NNC(=O)Cc3cccnc3)nn2)CC1	728851603	ONRDWKLJVKTIAA-UHFFFAOYSA-N	429.481	1.249	50	20	IDGD	
CCOc1ccc(C(=O)CCC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1	728889383	GFSUKYIPJZDFAD-UHFFFAOYSA-N	425.489	1.902	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)/C=C/c1ccccc1)C(=O)NNC(=O)Cc1cccnc1	728893381	JQVLRADBMXYFHP-LVMGUKCRSA-N	448.570	1.484	50	20	IDGD	
O=C(NCCc1cnn(-c2ccccc2)c1)NNC(=O)C1CCN(c2ncccn2)CC1	728944513	ZZUWQBOILCWXKS-UHFFFAOYSA-N	434.504	1.452	50	20	IDGD	
CNC(=O)CN1CCC(NC(=O)NNC(=O)c2ccc(Br)cc2Cl)CC1	728945550	YJHQGAWVJKKBFV-UHFFFAOYSA-N	446.733	1.257	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)Cc2c(C)nc3cc(O)nn3c2C)cc1	729282728	HASFIIDTSIHLQR-AWEZNQCLSA-N	427.461	1.608	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)c2cnn[nH]2)cc1S(=O)(=O)Nc1cccc(Cl)c1	729455374	AIHDGRWDOGCUIC-UHFFFAOYSA-N	434.865	1.642	50	20	IDGD	
C[C@@H]1CCC[C@H](NC(=O)CN2CCN(C(=O)NNC(=O)c3cccc(C#N)c3)CC2)C1	731220607	MCQQPSLICHEVMK-APWZRJJASA-N	426.521	1.225	50	20	IDGD	
CC(=O)N1CCN(c2ccc(C(=O)NNC(=O)Cc3ccccc3F)cc2[N+](=O)[O-])CC1	731330198	CWVZUXQACMEBNF-UHFFFAOYSA-N	443.435	1.406	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(F)cc([N+](=O)[O-])c2)c1	731453052	GHFGNJQLSJTGBO-UHFFFAOYSA-N	438.437	1.839	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2cc3c(s2)CCC3)nnn1-c1ccc2c(c1)OCCO2	731454248	YTTOAMAUGBODBT-UHFFFAOYSA-N	425.470	1.972	50	20	IDGD	
Cc1ccc(NC(=S)NNC(=O)CN2C(=O)COc3ccc([N+](=O)[O-])cc32)cc1C	731500549	DXXVBJQBAFWFED-UHFFFAOYSA-N	429.458	1.955	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)COc2ccc(Oc3ccccn3)cc2)C[C@H](C)O1	732259869	KSAUNHMIGIBVNR-IRXDYDNUSA-N	428.489	1.899	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1	732264341	QPSGIWABHFCQMO-CYBMUJFWSA-N	447.473	1.529	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCCN2CCOC(C)(C)C2)cc1Br	732459725	YIAYJRAQNUOAGU-UHFFFAOYSA-N	429.315	1.513	50	20	IDGD	
O=C(CN1Cc2ccccc2C[C@@H]1C(=O)NCCc1ccc(F)cc1)NNC(=O)C1CC1	733194536	YWDJDUHUTVOMJH-OAQYLSRUSA-N	438.503	1.469	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc2c(c1)OCCCO2)NNc1cnnc2ccccc12	733812790	GTSHWZNKZRBFNB-UHFFFAOYSA-N	429.458	1.213	50	20	IDGD	
COc1ncc(C(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)cn1	733950398	SSJGHAXJWJMKOF-UHFFFAOYSA-N	430.428	1.262	50	20	IDGD	
CC1CCN(C(=O)C2CCN(CC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)CC2)CC1	734151700	KNLLPZUDFKHVRL-UHFFFAOYSA-N	431.493	1.326	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)Cc3c[nH]c4ccc(F)cc34)cc2)CC1	734549472	VRYXYDGFHOYBNQ-UHFFFAOYSA-N	445.520	1.929	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2cc(Cl)ccc2F)CC1	735117986	LQATYRBAOYTVDI-UHFFFAOYSA-N	427.889	1.567	50	20	IDGD	
O=C(NN=C1C(=O)Nc2c(Cl)cc(Br)cc21)N[C@@H]1CCS(=O)(=O)C1	735614394	WVDUSHDJRSRPIK-SSDOTTSWSA-N	435.687	1.245	50	20	IDGD	
O=C(NNC(=O)c1ccnc(-n2cccn2)c1)c1ccc(S(=O)(=O)N2CCCC2)cc1	739679431	YRXXZLZTOJVMPW-UHFFFAOYSA-N	440.485	1.127	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)N[C@H]1CCN(c2ccc(Cl)cc2)C1=O	740484179	JCFNSSNVKONMPV-HNNXBMFYSA-N	430.848	1.861	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)[C@H]1CN(Cc2ccccc2)CCO1	741215102	NZOTXCGLBIRGOR-HXUWFJFHSA-N	430.530	1.471	50	20	IDGD	
CS(=O)(=O)[C@H]1CCCCC1=NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	741452128	YOWYLXCROHLUCE-KRWDZBQOSA-N	427.548	1.544	50	20	IDGD	
Cc1ccc(-n2c(SCC(=O)NNC(=O)C(C)(C)C)nnc2N2CCOCC2)cc1	742451191	MIXDBFBNFJZMSF-UHFFFAOYSA-N	432.550	1.698	50	20	IDGD	
CC(C)(NS(C)(=O)=O)C(=O)NNc1ccc(S(=O)(=O)Nc2ccccc2)cc1	743335463	YEHLHXBPXPSVAJ-UHFFFAOYSA-N	426.520	1.258	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1ccccc1N1CCOCC1	744618754	AJVMTJZKCFLUOS-UHFFFAOYSA-N	446.529	1.301	50	20	IDGD	
CCCS(=O)(=O)c1ccccc1C(=O)OCC(=O)NNC(=O)c1cccc(C#N)c1	744733133	XLMWSKNMQQRITK-UHFFFAOYSA-N	429.454	1.360	50	20	IDGD	
C[C@@H]1C[C@H](NC(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)CCN1C	745856237	BWMONCFWSXRLDA-OXQOHEQNSA-N	448.531	1.815	50	20	IDGD	
O=C(NNC(=O)N1CCOCC1)/C(=C/c1cccs1)n1nnnc1-c1ccccc1	745987680	DYXLGZDSZXRACI-SSZFMOIBSA-N	425.474	1.473	50	20	IDGD	
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)Cc1cn2ccccc2n1	746636624	DOATXZJDGZYVKX-HXUWFJFHSA-N	446.511	1.889	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccccc1Cl)NNC(=O)Cc1cn2ccccc2n1	746702358	USRTZBNYPUZVGL-UHFFFAOYSA-N	435.893	1.046	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)CCc3nc(CSC)no3)n[nH]2)cc1OC	746856240	HZMSCLGKHMOKHG-UHFFFAOYSA-N	446.489	1.734	50	20	IDGD	
COc1ccc(CC(=O)NCc2ccc(C(=O)NNC(=O)Cc3ccncc3)cc2)cc1	747322568	AOCIESIXMYACCQ-UHFFFAOYSA-N	432.480	1.953	50	20	IDGD	
Cc1cc(F)ccc1-n1cc(O)c(C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)n1	751350700	HUDKGWKVCWIMPS-UHFFFAOYSA-N	432.433	1.504	50	20	IDGD	
COc1ccc(CCN2C[C@H](C(=O)NNC(=S)N[C@@H](C)C3CC3)CC2=O)cc1OC	751616818	JZNAHZOXDRPOFC-XJKSGUPXSA-N	434.562	1.389	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2cccc(C(=O)NNC(=S)N[C@H](C)C3CC3)c2)C[C@@H](C)O1	751619672	WIPLVGFMPGMFHB-HZSPNIEDSA-N	440.591	1.392	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NC[C@@H]2CCCO[C@@H]2C(C)C)cc1	753035966	WDXCNJMVWWZNET-QFBILLFUSA-N	440.566	1.397	50	20	IDGD	
C[C@H](C(=O)OCC(=O)NNC(=O)c1ccc(Cl)cc1)c1ccc(S(C)(=O)=O)cc1	753489490	QOGXFSNAUWTKGD-LBPRGKRZSA-N	438.889	1.851	50	20	IDGD	
CC(C)OCCCn1c(NNC(=O)c2cnc3c(c2)nnn3C)nc2ccccc2c1=O	755318937	BTWNSMFRWAEAMO-UHFFFAOYSA-N	436.476	1.645	50	20	IDGD	
Cc1ccc(Cc2cnc(NC(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)s2)cc1F	755485381	LRFBWORRCUXNEJ-SNVBAGLBSA-N	429.499	1.272	50	20	IDGD	
CCCCNS(=O)(=O)c1cccc(NC(=O)NNC(=O)c2cccc(OC)c2O)c1	755537524	VGCLCNYCPASDQK-UHFFFAOYSA-N	436.490	1.946	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)Nc1ccccc1C(=O)N1CCOCC1	755624508	UXZIGBISTCDEIO-UHFFFAOYSA-N	449.508	1.617	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)Nc1ccc(C)cc1OCC(=O)N(C)C	756201810	BPTXPWVXMCSKFK-UHFFFAOYSA-N	430.461	1.702	50	20	IDGD	
COC(=O)c1ccc(NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1C	756376157	CXXFTZOGVKFFON-UHFFFAOYSA-N	448.501	1.563	50	20	IDGD	
COC(=O)Cn1ccc(NC(=O)NNC(=O)COc2ccc(Br)cc2)n1	756647161	QYAJWGAOGAMOGP-UHFFFAOYSA-N	426.227	1.050	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)Nc2ccn(CCN3CCOCC3)n2)c1C	756647839	VWPXJVNSSHAFKT-QGZVFWFLSA-N	430.509	1.452	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1cccc(C(=O)NNc2ccc(C(N)=O)nn2)c1)c1ccccc1	757399519	NYSWPYDVTNIUBC-CYBMUJFWSA-N	440.485	1.372	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cccc(Br)c2F)c1	757760749	UYLHKIJWTOEMEZ-UHFFFAOYSA-N	444.282	1.913	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H]2COc3c(Cl)cccc32)c1	757793572	FNONTPRBZLXTRU-HNNXBMFYSA-N	438.893	1.668	50	20	IDGD	
CCN(CC)[C@@H](C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)c1cccc(C(F)(F)F)c1	758043673	JGWDUDORLUKEHY-BXUZGUMPSA-N	438.472	1.173	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2cccc(OCc3noc(C)n3)c2)n1	758773645	CVOHYWQCXORFDZ-UHFFFAOYSA-N	445.457	1.269	50	20	IDGD	
COc1cc(F)cc(NNC(=O)CCNS(=O)(=O)c2ccc3c(c2)OCCCO3)c1	759315219	QGFCGERLGZFWTL-UHFFFAOYSA-N	439.465	1.807	50	20	IDGD	
Cc1ccc(C)c(S(=O)(=O)NCCC(=O)NNC(=O)CCNC(=O)OC(C)(C)C)c1	760437814	LETIBWJIAADPLC-UHFFFAOYSA-N	442.538	1.034	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)c1ccc(I)c(O)c1	760872490	SUAKYXDJZSHYKN-UHFFFAOYSA-N	428.182	1.542	50	20	IDGD	
COc1ccc(C(=O)NCC(=O)NNC(=O)CSc2ccccc2OC)cc1OC	761632336	DPAADXFKXDQRTA-UHFFFAOYSA-N	433.486	1.382	50	20	IDGD	
O=C(NNc1nccc(N2CCOCC2)n1)c1csc(-c2ccc3c(c2)OCCO3)n1	762859963	ANMGSSOYSRCSKB-UHFFFAOYSA-N	440.485	1.965	50	20	IDGD	
COc1ccc(S(=O)(=O)C(F)(F)F)cc1NC(=O)C(=O)NNC(=O)c1ccccc1	763426267	VPCMLAOWUGACDM-UHFFFAOYSA-N	445.375	1.388	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)N[C@H](CN1CCOCC1)c1ccccc1	763466603	RYKIMVLXCGDPLN-QGZVFWFLSA-N	430.530	1.888	50	20	IDGD	
Cc1cc(F)cc(NC(=O)C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1	763512915	UYEXGYBYFGQGDQ-UHFFFAOYSA-N	448.476	1.318	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)C(=O)Nc2cnn(-c3ccccc3)n2)c1	763596353	XFAXXCLCDKETNJ-UHFFFAOYSA-N	436.472	1.864	50	20	IDGD	
Cc1nnc(-c2cccc(NC(=O)C(=O)NNC(=O)COc3ccccc3F)c2)n1C	763678272	BZWUSJBGTZCRMJ-UHFFFAOYSA-N	426.408	1.095	50	20	IDGD	
CCc1noc(C)c1NC(=O)C(=O)NNC(=O)COc1ccc(Br)cc1	763694632	KAVQWTJGSPJQCP-UHFFFAOYSA-N	425.239	1.473	50	20	IDGD	
COc1ccc(Br)c(NC(=O)C(=O)NNC(=O)c2cccc(N(C)C)c2)c1	763759167	WDZXUGHWNOVECA-UHFFFAOYSA-N	435.278	1.923	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)C(=O)Nc2cc(N3CCNC3=O)ccc2Cl)c1	763760824	UCGPJRCPAZZVCH-UHFFFAOYSA-N	444.879	1.335	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(-n3cnc4ccccc43)nc2)cc1	763809871	SRIKAPOEMLFKGJ-UHFFFAOYSA-N	444.451	1.894	50	20	IDGD	
Cc1nn(-c2ccccc2)c(C)c1NC(=O)C(=O)NNC(=O)COc1ccccc1C#N	763812600	HHXSVNWGWMGARB-UHFFFAOYSA-N	432.440	1.526	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)ccc1N1CCOCC1	763840581	MUGCPSFOGUSYLQ-UHFFFAOYSA-N	430.436	1.136	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)NC(=O)CO2	763855422	WKTOFAWMNJEKAT-ZDUSSCGKSA-N	448.435	1.724	50	20	IDGD	
CCCOC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)cc1	763855919	CJYCCBIPRUUGAA-CYBMUJFWSA-N	431.420	1.946	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)OC[C@@H]2COC(=O)O2)cc1	763892689	REXOMVNUOKBXBI-XMCSSRMMSA-N	440.412	1.420	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)C(=O)Nc2ccn(CCc3ccncc3)n2)cc1	763897527	ZVTCVRCOUURLPT-UHFFFAOYSA-N	438.513	1.707	50	20	IDGD	
COCCOc1ccc(C#N)cc1NC(=O)C(=O)NNC(=O)Cc1ccc(Cl)cc1	763936007	CFUPBARXXBUVBK-UHFFFAOYSA-N	430.848	1.565	50	20	IDGD	
CCOC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccc(Cl)cc2)cc1	763936905	RMKAOWFGEMFMKJ-UHFFFAOYSA-N	433.848	1.611	50	20	IDGD	
COCCCS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2C)cc1	763959820	KEHSQPZKEHKXQM-UHFFFAOYSA-N	433.486	1.205	50	20	IDGD	
O=C(NNC(=O)c1cc2c(s1)CCCCC2)C(=O)Nc1ccc(-n2cnnn2)cc1	763967768	GPKVJOJJPCOWLH-UHFFFAOYSA-N	425.474	1.392	50	20	IDGD	
C[C@@H]1C[C@@H](C)CN(C(=O)c2ccccc2NC(=O)C(=O)NNC(=O)CC(F)(F)F)C1	764111312	DYJYPWLBZNPPFE-VXGBXAGGSA-N	428.411	1.843	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2ccnc(OCC(F)(F)F)c2)cc1	764131247	JBONIJKUVBHWBP-UHFFFAOYSA-N	440.378	1.750	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccccc1S(=O)(=O)C(C)C	764133590	WMDJYILNJNHQSM-UHFFFAOYSA-N	433.486	1.206	50	20	IDGD	
O=C(CCc1ccco1)NNC(=O)C(=O)Nc1ccc(C(=O)NCCc2ccccc2)cc1	764177991	XGKSNJXJNBSIHO-UHFFFAOYSA-N	448.479	1.971	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)C(=O)Nc1ccc(NC(=O)[C@H]2CCCO2)cc1	764321473	XRIAPJBARLWOFY-QGZVFWFLSA-N	428.420	1.272	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc3ccccc3o2)cc1C(=O)OC	764330913	HQZXICDZOKVYRL-UHFFFAOYSA-N	439.380	1.406	50	20	IDGD	
COC(=O)c1cc(OC)c(OC)cc1NC(=O)C(=O)NNC(=O)c1cc2ccccc2o1	764331119	QOBORDMWDGDWHH-UHFFFAOYSA-N	441.396	1.636	50	20	IDGD	
CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NNC(=O)c1csc(N2CCOCC2)n1	765368205	LMJRSXSQDQNPGQ-AWEZNQCLSA-N	433.490	1.918	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)c2cc(I)cc([N+](=O)[O-])c2)n1	765536621	XQCDFLBPUYAQJA-UHFFFAOYSA-N	443.201	1.474	50	20	IDGD	
C[C@H](Cc1ccc(F)c(Br)c1)NC(=O)NNC(=O)CNC(=O)c1ccco1	765733061	MEMAEENHGFKDHW-SNVBAGLBSA-N	441.257	1.873	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)[C@H]1CC(=O)N(c2ccc(Cl)c(F)c2)C1	766295929	SVCMSWTXZRZFCL-GTNSWQLSSA-N	433.823	1.819	50	20	IDGD	
O=C(Cc1ccc([N+](=O)[O-])cc1)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	766667633	BEBCXGCHMZWRKP-UHFFFAOYSA-N	445.907	1.756	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)c1cccc(F)c1F	766846803	OQLZFQUXQFOWDI-NSHDSACASA-N	426.445	1.920	50	20	IDGD	
CC(CC(=O)NNC(=O)c1ccc(C#N)cc1)CC(=O)NNC(=O)c1ccc(C#N)cc1	767780104	XXFXNYMOTSXYDY-UHFFFAOYSA-N	432.440	1.068	50	20	IDGD	
COc1ccc(CN2CCCN(CC(=O)NNC(=O)c3cccc(C#N)c3)CC2=O)cc1	767930371	DWTMVFZPSBIGIM-UHFFFAOYSA-N	435.484	1.062	50	20	IDGD	
O=C(COC(=O)c1ccc(F)cc1C(F)(F)F)NNC(=O)[C@H]1COc2ccccc2O1	768094699	UPUQKSOYGZBCBW-OAHLLOKOSA-N	442.321	1.989	50	20	IDGD	
COc1ccccc1NC(=S)NNC(=O)c1nccc2c(S(N)(=O)=O)cccc12	768472415	XKBPSBKQNHONTI-UHFFFAOYSA-N	431.499	1.522	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)NC2CCN([C@H]3CCCC[C@@H]3O)CC2)cc1	769165513	ZFOALRIJSIDDQF-CZAAIQMYSA-N	448.564	1.951	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)NC(C(N)=O)C(N)=O)c(C)n1-c1ccc(Br)cc1	769756218	LHTWDIQKZJKOCZ-MDWZMJQESA-N	444.289	1.219	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)Cc2cc(F)ccc2Br)c1	771249852	ICWNLBIHEDOARI-UHFFFAOYSA-N	429.267	1.995	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)C1=NN(c2ccccc2)[C@H](C(=O)OC(C)(C)C)C1	772086102	ADIBSUMHCGKPEM-CJNGLKHVSA-N	432.477	1.452	50	20	IDGD	
CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O[C@@H](C)C(=O)NNC(=O)CC(C)C	772166855	HBGZOQJQTGXNTE-SGTLLEGYSA-N	434.468	1.479	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)c1ccnc(OCC(F)(F)F)c1	772196649	LQXRLCZHDDKYDT-UHFFFAOYSA-N	430.770	1.754	50	20	IDGD	
Cc1ccc(-n2nc(C)cc2NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)nn1	773494611	VRGJPMPEKJMITP-UHFFFAOYSA-N	445.443	1.069	50	20	IDGD	
CCOC(=O)[C@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNc2ccc(C#N)cc2)cc1F	773692971	PIIJHACNRGLPBK-LBPRGKRZSA-N	441.419	1.461	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)ccc1-n1cnnn1	774007520	AZEMVCPUXGYMLZ-LBPRGKRZSA-N	443.851	1.178	50	20	IDGD	
O=C(NNc1cnc2ccccc2n1)C1CCN(C2=NS(=O)(=O)c3ccccc32)CC1	774782864	CUCDLINEIRRFRH-UHFFFAOYSA-N	436.497	1.934	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCCC(=O)NNc1cnc2ccccc2n1	774794936	OHFPSSKFNBJGBS-INIZCTEOSA-N	428.493	1.979	50	20	IDGD	
COc1cccc([C@H]2[C@@H](C(=O)NNC(=O)Cc3cn4ccccc4n3)CC(=O)N2C2CC2)c1	776335073	XHZKDGMXZAGWDJ-CVDCTZTESA-N	447.495	1.785	50	20	IDGD	
CN(CCNC(=O)NNc1cccc(S(C)(=O)=O)c1)S(=O)(=O)c1cccs1	776626568	WOTJWFPCCLHOTE-UHFFFAOYSA-N	432.549	1.098	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)c1ccc2nsnc2c1	776710237	CSUPHGLPEKUHPZ-UHFFFAOYSA-N	444.948	1.924	50	20	IDGD	
O=C(COC(=O)[C@]1(F)CCN(C(=O)OCc2ccccc2)C1)NNC(=O)c1ccccc1	777233142	FACQHRARNPOGFS-QFIPXVFZSA-N	443.431	1.742	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)c2ccc(OC)c(S(=O)(=O)NC3CC3)c2)nc1C	778422135	VVLXJECVWBLXTG-UHFFFAOYSA-N	449.489	1.168	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1cc2c(O)ncnc2cn1	778471368	COPADQMCIAWWOS-UHFFFAOYSA-N	431.792	1.010	50	20	IDGD	
COc1ccc2nc(NNC(=O)CCC(=O)N3CCN(c4ncccn4)CC3)c(C)cc2c1	778482955	IJVVWELXCWASLA-UHFFFAOYSA-N	449.515	1.914	50	20	IDGD	
CCOC(=O)c1cc(F)cc(S(=O)(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)c1	778557412	QLBAAMODIGYSQD-UHFFFAOYSA-N	437.449	1.567	50	20	IDGD	
Cc1onc(CC(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)c1C#N	779384031	GOVZFRLFLXPSPN-UHFFFAOYSA-N	442.439	1.560	50	20	IDGD	
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	779390850	YJPUHQJFNLVNBB-LBPRGKRZSA-N	443.526	1.729	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)c2cn(C)nc2-c2cnn(C)c2)c1	780591846	CPNKSTHBIRXXNM-UHFFFAOYSA-N	433.266	1.667	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H](NC(=O)NNC(=O)[C@H]2COc3ccccc3O2)C1	782645834	AIMQPHQJFNZBAH-CKEIUWERSA-N	434.493	1.993	50	20	IDGD	
CC(=NNC(=O)C(=O)Nc1ccccn1)[C@@H]1CN(C(=O)OCc2ccccc2)CCO1	783853882	GVJCYWRJOFNGIS-KRWDZBQOSA-N	425.445	1.550	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)C(=O)Nc1cncc2ccccc12	784210311	MZUMHHWTVMQVJR-UHFFFAOYSA-N	425.470	1.757	50	20	IDGD	
C[C@H](c1cccc(NC(=O)C(=O)NNc2cccc(S(C)(=O)=O)c2)c1)N1CCOCC1	784839655	NIKNYSQFXAOESG-OAHLLOKOSA-N	446.529	1.565	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)Nc1cnccc1-c1cccc(F)c1	785023648	NDHGJPYIPJOJCJ-UHFFFAOYSA-N	439.359	1.901	50	20	IDGD	
COC(=O)c1cc(F)ccc1NC(=O)C(=O)NNC(=O)[C@H]1OCC[C@H]1c1ccccc1	789809590	AVYHMWZSCJCWSS-YOEHRIQHSA-N	429.404	1.271	50	20	IDGD	
NC(=O)CC[C@H](C(=O)NNc1cccc(F)c1[N+](=O)[O-])N1C(=O)c2ccccc2C1=O	791148416	XNZYCVFOJKCBML-CQSZACIVSA-N	429.364	1.107	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)[C@](C)(O)Cn1c(C)cccc1=O	792020852	FUBIRSVRVBGPQO-OAQYLSRUSA-N	426.498	1.801	50	20	IDGD	
COc1ccc(Cn2nccc2NC(=O)C(=O)NNc2nc3ccccn3n2)c(OC)c1	792393933	KCGVECKFHNLLNL-UHFFFAOYSA-N	436.432	1.073	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)c2cc(C3CC3)nc3c2c(O)nc(=O)n3C)cc1	792803994	YEBSWXDFZDBDBF-UHFFFAOYSA-N	437.456	1.314	50	20	IDGD	
Cc1nnnn1/C(=C\c1ccccc1)C(=O)NNC(=O)CNC(=O)OCc1ccccc1	794071385	IGJODMGXUZEQDO-PDGQHHTCSA-N	435.444	1.053	50	20	IDGD	
O=C(NN=Cc1c(F)ccc(O)c1F)c1cccc(S(=O)(=O)N2CCOCC2)c1	794453465	OPBKNOWLEUFRRG-UHFFFAOYSA-N	425.413	1.455	50	20	IDGD	
CC(=O)N[C@](C)(C(=O)NNc1cnc2ccccc2n1)c1ccc(S(C)(=O)=O)cc1	797752153	RGBFYJSQMDKVFA-FQEVSTJZSA-N	427.486	1.528	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2ccoc2C2(O)CCOCC2)c2ccccc2c1=O	798150135	GSGMUSZWIMQMCC-UHFFFAOYSA-N	426.429	1.082	50	20	IDGD	
Cc1ccccc1NC(=O)NNC(=O)[C@@H]1CCCN1S(=O)(=O)c1cccc([N+](=O)[O-])c1	798310853	XFTPOWIERZVAEH-KRWDZBQOSA-N	447.473	1.909	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1ccnc(OCc2ccccc2)c1	800622418	DTZSCVGKWJMQML-UHFFFAOYSA-N	436.424	1.531	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CCc2ccc(S(=O)(=O)NC3CC3)cc2)cc1	801105578	HXKIHPOJTSDJAJ-UHFFFAOYSA-N	444.513	1.154	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2nccn2-c2ccccc2)c1	801758633	CPKHWOZITZPRPJ-UHFFFAOYSA-N	428.474	1.589	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@@]23CCC(=O)N2c2ccccc2S3)cc1	802067485	FNTZJORKQGITAL-IBGZPJMESA-N	446.510	1.872	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)NC[C@@H]2CC(c3ccc4c(c3)CCO4)=NO2)cc1	802337259	KTMVBFWDNYYTFX-SFHVURJKSA-N	435.440	1.396	50	20	IDGD	
COc1ccc(C2=NO[C@@H](CNC(=O)NNC(=O)c3cc([N+](=O)[O-])ccc3O)C2)cc1F	802350182	WHLMYXSBUAMSNM-GFCCVEGCSA-N	447.379	1.585	50	20	IDGD	
CC(C)CSc1ccc(S(=O)(=O)NCC(=O)NNc2cnccn2)cc1[N+](=O)[O-]	802541361	LJZFYHSRLFQHGM-UHFFFAOYSA-N	440.507	1.555	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)Nc1ccc(F)c(S(=O)(=O)N(C)C)c1	806544188	XDLLPDQZWXMWRI-NSHDSACASA-N	442.444	1.835	50	20	IDGD	
N#Cc1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2O)cc1Br	806978597	HDSXHLGGHBPADB-UHFFFAOYSA-N	433.218	1.191	50	20	IDGD	
COC(=O)c1cc(Br)c(OC)cc1NC(=O)C(=O)NNc1cc(C)ncn1	807004143	IAXUMKQBQSPTFG-UHFFFAOYSA-N	438.238	1.425	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)NC[C@@H](N2CCOCC2)C(F)(F)F)c2ccccc2n1	807541526	NXGDQWJKTBSIAG-MRXNPFEDSA-N	425.411	1.750	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@H]1C[C@@H](c2ccccc2)OC1=O	809556812	OKKIMHGLHIIQTL-CABCVRRESA-N	430.486	1.354	50	20	IDGD	
CC(C)(C(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1csc(-c2cc(F)ccc2F)n1	809972757	MWBIIELYQSPBSM-SNVBAGLBSA-N	443.497	1.948	50	20	IDGD	
N#Cc1cc(Cl)nc(NNC(=O)CNS(=O)(=O)c2ccc(Br)cc2)c1	810835188	XDMCEOIRCSOTCX-UHFFFAOYSA-N	444.698	1.791	50	20	IDGD	
CNS(=O)(=O)c1ccc(C)c(C(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)c1	811824720	PGQRSSZKMINXQO-UHFFFAOYSA-N	439.877	1.175	50	20	IDGD	
O=C(NNS(=O)(=O)CCc1ccccc1Br)c1ccc2c(c1)OCO2	812269872	WSYUMJJGQNFZJQ-UHFFFAOYSA-N	427.276	1.985	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NN=C[C@H]1CCOC1)N(S(C)(=O)=O)CC2	812438777	PVTJOSOTXLSYOQ-CZUORRHYSA-N	425.507	1.091	50	20	IDGD	
COC(=O)CCc1ccc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)N(C)C)cc1	815750959	NXDZHIOFVMIRHK-UHFFFAOYSA-N	448.501	1.124	50	20	IDGD	
N#Cc1cc(C(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)cnc1C(F)(F)F	815933885	FIDRUZXBVVHSTH-UHFFFAOYSA-N	425.754	1.703	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@H](CS(C)(=O)=O)c2ccccc2)cc(OC)c1OC	816814583	WKJLFCUBTKYKOT-OAHLLOKOSA-N	436.486	1.302	50	20	IDGD	
CCC1CCC2(CC1)NC(=O)N(CC(=O)NNC(=O)CNc1ccc(OC)cc1)C2=O	825529740	NDLIEHWIQSEMIE-UHFFFAOYSA-N	431.493	1.145	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCC(=O)NNC(=S)NCCc2cccs2)cc1C	838817290	MAOZRXNKLDHEJN-UHFFFAOYSA-N	426.589	1.381	50	20	IDGD	
CC(=NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1ccc2c(c1)CCO2	839384005	SOIQGJMRBHKBQB-UHFFFAOYSA-N	429.498	1.796	50	20	IDGD	
Cn1cnnc1SCC(=O)Nc1cccc(C(=O)NNC(=O)CNc2ccccc2)c1	842507531	AHNCAKMSUAUUIK-UHFFFAOYSA-N	439.501	1.419	50	20	IDGD	
COc1ccccc1N1C[C@@H](C(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)CC1=O	849206060	AFQMOZSLPVJRNV-AWEZNQCLSA-N	445.859	1.706	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)c2ccccc2S(=O)(=O)N2CCCCC2)cc1	864016995	HOURYDRTDDBSQQ-UHFFFAOYSA-N	442.497	1.573	50	20	IDGD	
CCOc1ccc(NC(=S)NNC(=O)CNS(=O)(=O)c2c(F)cccc2F)cc1	913444048	YXARERAJTDYLHJ-UHFFFAOYSA-N	444.485	1.660	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)no1	914865167	XDAASKAOSLPJME-UHFFFAOYSA-N	429.458	1.718	50	20	IDGD	
C[C@H](CN1CCCCC1)C(=O)NNC(=S)Nc1cccc(S(=O)(=O)N(C)C)c1	916117695	IEDPPSYZCZDWBU-CQSZACIVSA-N	427.596	1.377	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)NCc2ccc(N3CCN(C)CC3)nc2)c2ccccc2n1	916245518	FXRMFODMKLGSGP-UHFFFAOYSA-N	433.516	1.834	50	20	IDGD	
CC(=NNC(=O)c1cccc(N(C)C)c1)c1ccc(S(=O)(=O)N2CCNCC2)cc1	916280896	LZWMWGLKHPIYLS-UHFFFAOYSA-N	429.546	1.501	50	20	IDGD	
CC[C@@H](CNC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)N1CCc2ccccc2C1	916448310	IVBBIAUAPKYFPV-IBGZPJMESA-N	434.504	1.443	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)NCCN2CCN(c3ccccc3)CC2)nc2ccccc21	916514529	FVXAVXYLEKNJJP-UHFFFAOYSA-N	435.532	1.268	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NCCN2CCN(c3ccccc3)CC2)cc1C	916514918	SWFBPOIAOQFGKK-UHFFFAOYSA-N	425.533	1.835	50	20	IDGD	
CN(CCCC(=O)NNC(=O)c1ccc(Cl)nc1)S(=O)(=O)c1ccc(F)cc1	917251205	VKYOASKENIAHRG-UHFFFAOYSA-N	428.873	1.736	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)C1=NO[C@@H](c2ccccc2)C1	919684855	MBPRQCKZEJMYID-LJQANCHMSA-N	442.497	1.750	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)N(C)CC(=O)N[C@H]2CCS(=O)(=O)C2)c(C)n1CCC(C)C	920291460	VKYHEFMWWGXOQV-FHTAPLDASA-N	448.589	1.820	50	20	IDGD	
O=C(CNC(=O)c1ccc(Br)s1)NNC(=O)NCCc1cccs1	920889171	OKBAELCLHTVVNC-UHFFFAOYSA-N	431.337	1.875	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)Nc2cccc(N3C(=O)CNC3=O)c2)c1C	920933573	WXUNMUCRBYWFBT-CQSZACIVSA-N	425.445	1.980	50	20	IDGD	
CN(CC(=O)NNC(=O)c1ccc(Br)cc1)S(=O)(=O)c1ccccc1	1115838680	XWWUZNQNENLBQA-UHFFFAOYSA-N	426.292	1.531	50	20	IDGD	
CC(C)CN1CCO[C@H](CNC(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)C1	1251923353	OJCTUWDPPSAMGW-QGZVFWFLSA-N	441.573	1.321	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1	1318021047	MCIKPRTURTWIGW-SFHVURJKSA-N	438.484	1.315	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2nc(C3CC3)n(-c3ccccc3)n2)n1	1318248396	FXFPJEDRUJJKDE-UHFFFAOYSA-N	440.485	1.457	50	20	IDGD	
COCCn1nc(C)c(NC(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)c1C	1320138244	DYTMEPXUBVGQNM-UHFFFAOYSA-N	438.529	1.946	50	20	IDGD	
O=C(NCc1ccc(Br)o1)NNC(=O)c1csc(N2CCOCC2)n1	1320847785	OGZIKDBHDZADMA-UHFFFAOYSA-N	430.284	1.479	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@@H]1CC(=O)N(C)c2ccccc21	1321541892	RYBWJQXSGPIKRT-CQSZACIVSA-N	429.502	1.199	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc3c(n2)OCCO3)C1	1777953659	DMYZYNYOUPUIQW-AVBTWRTFSA-N	437.924	1.998	50	20	IDGD	
O=C1COc2ccc(C(=O)N3CC[C@H]4OCCC[C@@]4(CNC(=O)[C@H](F)Cl)C3)cc2N1	1778026384	UBGBVXCGGYEGQP-OXFYSEKESA-N	439.871	1.679	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)Cn3c(=O)n(C)c4ccccc43)C2)C1	1778161571	HXMKKUUJGSJXGM-AOMKIAJQSA-N	448.951	1.577	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H]3ON=C(c4ccccc4)O3)C2)C1	1778871619	MZPQBLADALUZTL-WIYYLYMNSA-N	435.908	1.816	50	20	IDGD	
CC[S@](=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCBr)C2	1779218992	VCZJMQCZJWEEIV-DZSJAMLCSA-N	437.400	1.444	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ncn(-c4cccc(F)c4)n3)CCO2)C1	1781213462	JFNYTYNUUITJHQ-JXFKEZNVSA-N	435.887	1.867	50	20	IDGD	
CN(C)c1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)cn1	1781229609	GNSZBFOSHLZBOP-OALUTQOASA-N	429.348	1.827	50	20	IDGD	
O=C(c1ccc2[nH]ccc2n1)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781332133	UJUPAXAGBTXZGT-PBHICJAKSA-N	425.258	1.697	50	20	IDGD	
O=C(c1cc2cccnn2c1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1782385685	GXAOPGCBPSGCAS-RHSMWYFYSA-N	425.258	1.468	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cn4ccccc4n3)CCO2)C1	1783347826	POJQVPQHSAACAU-AUUYWEPGSA-N	435.322	1.951	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccc4ncnn4c3)CCO2)C1	1783349056	GURABKQLZOIDQO-KBXCAEBGSA-N	436.310	1.346	50	20	IDGD	
CNc1nsnc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]21	1783523747	PXVWKEGAFHYQAD-YPIXOSSWSA-N	436.365	1.409	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(CCN(C(=O)Cn3cnc4ccccc43)C2)C1	1783747906	MRBMCLFHSJHXGF-NRFANRHFSA-N	430.581	1.718	50	20	IDGD	
CC#C[C@H](CC(=O)N1CCO[C@]2(CCN(C(=O)[C@H](Cl)COC)C2)C1)c1ccc(O)cc1	1783879153	PDCQPJHKXULPFL-KKLQWCBXSA-N	448.947	1.973	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cc(OC)cc(OC)c3F)CCO2)C1	1783881026	INKNBAGVFHRDAD-MGPUTAFESA-N	444.887	1.540	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@]1(F)CCCCC1(F)F)CCO2	1783934364	FPLDERKSGJWNPG-RTBURBONSA-N	448.486	1.107	50	20	IDGD	
COc1ccc([N+](=O)[O-])c(C(=O)N2CCO[C@]3(CCN(C(=O)C(Cl)Cl)C3)C2)n1	1783947991	PYYFFJJKCULMLE-INIZCTEOSA-N	433.248	1.246	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](C)Cn3ccnc3)C2)C1	1784495811	ZTHQKSATTJVNGV-RVKKMQEKSA-N	427.343	1.380	50	20	IDGD	
COc1ccc(CC(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)cc1F	1784704346	MAVYKLJCPVSQQT-ORAYPTAESA-N	443.313	1.990	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(F)(C(=O)N2CC[C@@]3(CN(C(=O)[C@H](F)Cl)CCO3)C2)C1	1785685794	OLFSHWYCIUNTPF-YVEFUNNKSA-N	437.871	1.310	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccn(C(C)(C)C)n3)[C@H]2C1	1785702745	KDJVMDAHLNWYJT-MPTYRVRUSA-N	426.945	1.485	50	20	IDGD	
O=C(CC[C@H]1CNc2ccccc2C1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21	1786901188	RQEXIJYKGJZUQB-SVZPGXKISA-N	449.979	1.630	50	20	IDGD	
CC(C)N[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)Br)C[C@@H]21)C(C)C	1786961974	FNIUNUKAAIIZFT-WOYTXXSLSA-N	432.403	1.772	50	20	IDGD	
Cc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]32)c(O)n1	1789311070	UDWXFPAYTGKOBB-VFSPDHHESA-N	430.332	1.925	50	20	IDGD	
Cc1ncncc1C(=O)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1	1789829143	LXFPJOUTXFFENU-UHFFFAOYSA-N	430.273	1.526	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]2C1	1789871549	FWGUMQLNRGCCMJ-LLLAAFKUSA-N	439.336	1.764	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(OC)c3F)[C@H]2C1	1792108461	XUDUJGKFCGLLLR-FAYQHZLMSA-N	428.888	1.681	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)NC(=O)c3ccccc3)[C@H]2C1	1792249740	CBPGHWRFJFDLKP-WRNCNIFXSA-N	435.952	1.802	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1c(F)cccc1Cl	1792753038	CTCFVERTTOBMRX-ABXQLRGKSA-N	433.307	1.865	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)CBr)o1	1792871361	WHERHQZBPVKUDO-VFFTVRQLSA-N	442.310	1.472	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C=C/C1CC1	1793014320	OTLCCLIPDRPCCN-HMUZGSGMSA-N	441.956	1.674	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCl)[C@H]1Cc2[nH]nc(C(F)(F)F)c2C1	1793113023	YOFZLTMRKJKYRE-YNXVLUOKSA-N	434.846	1.381	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nccc(OC)c1OC)C2	1793448693	IIQSIOLYQHBMIR-FQLMCAECSA-N	425.913	1.710	50	20	IDGD	
O=C(Cc1ccc2c(c1)CCC2)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2	1793847194	SHHANLDRBGSMCB-NBMJBFSESA-N	439.325	1.998	50	20	IDGD	
Cc1ccc(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)cc1C	1794049178	WSZOSGDAMZPHNY-REPLKXPHSA-N	435.528	1.796	50	20	IDGD	
C[C@H](NC(=O)c1cnccn1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCBr	1795493327	DGWKIGRVUAZRHE-FQUUOJAGSA-N	438.326	1.018	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](C)n1cc(C)cn1)C2	1796893239	UXNIFZHGXLYEFI-INYIEUDKSA-N	439.520	1.525	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2c(c1)CC(=O)N2	1797333260	ZINKBNWZOJAMSP-HXFPYSNGSA-N	440.327	1.621	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc3c[nH]nc13)C2)[C@H](F)Br	1799346135	DHKYIWMUOJLIJX-WJNVRWDZSA-N	425.258	1.457	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Br	1799346865	CVMGPAFIBYUOSQ-LMWOUKEDSA-N	439.285	1.536	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c(C)nn(C)c1C)C2	1800640381	UYVWMZBZRHABSQ-HLPPOEQASA-N	427.343	1.414	50	20	IDGD	
C[C@H](NNc1ccccc1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCC(=O)NN(C)C	1802328753	DJQBAGFEKXHXNS-KANFNMMFSA-N	430.553	1.003	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cc(C(F)F)no2)[C@H]1c1cccnc1)[C@H](O)CCl	1803138310	JIUIMLDCJDNTJN-LNSITVRQSA-N	428.823	1.927	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2ccn(C)c2)[C@@H]1c1cccnc1	1805294859	HRNSKQXYEZDITL-UTKZUKDTSA-N	426.521	1.113	50	20	IDGD	
COC(=O)[C@H]1CC[C@H](C(=O)N2CCCC3(CCN(C(=O)[C@@H](O)CCl)CC3)C2)CC1	1806374094	POAMZPDSTBOGES-ULQDDVLXSA-N	428.957	1.797	50	20	IDGD	
Cc1ccsc1C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1807369915	YVDZLHMLMBYDPV-UYAOXDASSA-N	449.341	1.765	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2cccnc2C(N)=O)[C@@H]1c1cccnc1	1808251315	QVNWZNGTISFQMU-UWWQBHOKSA-N	429.908	1.913	50	20	IDGD	
CC(=O)Nc1cc(C(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@H]2c2cccnc2)ccn1	1808920295	WZOOFDFCTKLTTD-SCTDSRPQSA-N	445.907	1.354	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC2(CCCN(C(=O)COCc3ccccc3)C2)CC1	1809523796	WXYQFSSGSSGGRC-UHFFFAOYSA-N	444.576	1.807	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)[C@H](C)n2ccccc2=O)[C@@H]1c1cccnc1	1810518313	NJWWWPOXBALOQI-NFBUACBFSA-N	446.935	1.764	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)NC[C@H]1CCN(C(=O)CO[Si](C)(C)C)[C@H]1c1cccnc1	1810526826	HGMTVCDXUXOJDR-MDYRTPRTSA-N	432.597	1.630	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1CCN(C(=O)CCN2CCOCC2)[C@@H]1c1cccnc1	1810539618	DOAXSCCCIQGPFD-SIKLNZKXSA-N	448.640	1.661	50	20	IDGD	
O=C(c1cnc(O)nc1O)N1CCCC2(CCN(C(=O)[C@@H](F)Br)CC2)C1	1810870125	NHCHQUXOYPLGDH-LLVKDONJSA-N	431.262	1.423	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](O)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Cl)[C@H]1c1cccnc1	1811507560	RGIGZBAKHUWZQN-TTZDDIAXSA-N	444.891	1.465	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)Cn2ccncc2=O)[C@@H]1c1cccnc1	1812344931	GADDPGSMHPBREF-YEWWUXTCSA-N	448.321	1.128	50	20	IDGD	
COC[C@@H](NC(C)=O)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)C(C)(C)CCl)n[nH]1	1814697002	HSSKMMPFLFBGKS-HUUCEWRRSA-N	427.933	1.818	50	20	IDGD	
CC(=O)NCCC(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](C)CBr)n[nH]1	1814782945	FHXJZUDBCVDNQZ-FZMZJTMJSA-N	428.331	1.959	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@H]2Cc3ccccc3CN2)[nH]n1)[C@@H](O)CCl	1814871479	PWLSOWCHDCQQOQ-SQNIBIBYSA-N	431.924	1.716	50	20	IDGD	
CC1(C)CC(C(=O)N[C@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)C1	1815348106	DLPRLSQTLPMZAQ-HNNXBMFYSA-N	427.335	1.485	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ncc(Cl)cn2)n[nH]1	1816280045	HWJISGCHTCEQTJ-AWEZNQCLSA-N	448.915	1.532	50	20	IDGD	
CN1CCN(CC(=O)N2CCCC[C@@H]2c2cc(NC(=O)CCBr)n[nH]2)CC1	1816782531	SZHCMNOJWRBDBQ-OAHLLOKOSA-N	441.374	1.434	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)CC2CCOCC2)n[nH]1	1817165736	ATJXKWCAANRLBW-QGZVFWFLSA-N	434.541	1.592	50	20	IDGD	
CC[S@@](=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCBr)CC2	1819508029	LYSQJCKPSMJFJT-CCGUKBGLSA-N	436.397	1.999	50	20	IDGD	
CC[C@@H](Br)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](N)CCC(N)=O)[nH]n1	1822087662	MVNLYUKEJRXSMR-MDZLAQPJSA-N	443.346	1.168	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2[nH]cc3c2CCC3)[nH]n1	1822415032	RTJPJUMXSPINNS-QGZVFWFLSA-N	441.536	1.905	50	20	IDGD	
CC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CS(=O)(=O)N1CCCC1)CC2	1822846437	ZEJHLILYOCTFEG-VXGBXAGGSA-N	448.998	1.498	50	20	IDGD	
CN1N=C(C(=O)N[C@@H]2CCc3nc(NC(=O)[C@@H](F)Br)sc3C2)CCC1=O	1823002970	VUOYOVSGKAWJBY-JMCQJSRRSA-N	446.302	1.354	50	20	IDGD	
CN(C)C(=O)NCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCBr)CC1	1823881010	YXJWTMLAIHZOBG-OAHLLOKOSA-N	431.375	1.662	50	20	IDGD	
C=CCNC(=O)/C=C\C(=O)N[C@H]1CCc2nc(NC(=O)[C@H](C)Br)sc2C1	1825631705	KPYBPBHCUJUMIW-TWHAFNCTSA-N	441.351	1.697	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@H]1CCc2nc(NC(=O)CSCC(=O)O)sc2C1	1826114695	VYWDWPBRJSXWFW-JTQLQIEISA-N	431.612	1.724	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1CCc2nc(NC(=O)CN3C(=O)C=CC3=O)sc2C1	1826319871	TVQNKDNTNOVTAG-VVVCHXIZSA-N	445.328	1.216	50	20	IDGD	
COC1(CC(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2ccc(B(O)O)cc2)CC3)CCC1	1827404784	PKXKPHSUYVXPGZ-OAHLLOKOSA-N	443.334	1.008	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)cc(O)n1	1830358088	PLNUTHLZNNFXCF-FQEVSTJZSA-N	425.913	1.431	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)/C=N/N3CCCCC3)C2)C1	1830362170	NCZKJYCWWDAYOS-CNSRZQHFSA-N	428.961	1.180	50	20	IDGD	
CN1N=C(C(=O)N2CCC([C@@H]3CCCCN3C(=O)[C@H](F)Br)CC2)CCC1=O	1830375640	FKXFPNPDCQOALR-HOCLYGCPSA-N	445.333	1.905	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3CC=CCC3)C2)C1	1830533540	PYLONSZEOWEGFX-MDZRGWNJSA-N	429.355	1.830	50	20	IDGD	
O=C(c1cc(F)ccc1Cl)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1830733364	KLDBDYSBZNJERL-QAPCUYQASA-N	435.279	1.149	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3noc(C(C)C)n3)CCO2)C1	1832783550	LUICNJITNBNBRH-FOIQADDNSA-N	442.944	1.599	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3[nH]ccc3C)CCO2)C1	1833547413	BAXJTYXHSQLVGQ-KDOFPFPSSA-N	428.327	1.567	50	20	IDGD	
COc1ncccc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1	1834131224	STWXQNKOGIJSKR-RBUKOAKNSA-N	446.331	1.397	50	20	IDGD	
Cn1cc(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](F)Br)CC3)CC2)cn1	1834194472	DUJNQRSYXZVXMJ-OAHLLOKOSA-N	430.322	1.296	50	20	IDGD	
Cc1cncc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@](C)(Cl)CCl)C3)C2)c1	1834285127	IRIHOYRKTYMOBP-RTBURBONSA-N	430.332	1.696	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3csc(N)n3)CC2)CC1	1834752869	TZXXMXQOFVZXQE-AWEZNQCLSA-N	429.974	1.164	50	20	IDGD	
O=C(CCc1cccnc1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1836182715	RQCDHBZOHOCGOC-FUHWJXTLSA-N	444.301	1.161	50	20	IDGD	
CCc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)n[nH]1	1836280899	LKSJZMLDLNERAT-ZWKOTPCHSA-N	433.336	1.278	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3nc4ccccn4n3)CCO2)C1	1836393605	WCYYJYDIYOGKIC-QRWLVFNGSA-N	435.912	1.207	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](C)CS(C)(=O)=O)CC2)CC1	1836875794	MGFBDYIBBSYJIY-YOEHRIQHSA-N	437.002	1.683	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)c3ccco3)CC2)CC1	1837393921	VVOUJXGJNMENNG-UHFFFAOYSA-N	441.488	1.204	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc(OC)c(F)c3)C2)C1	1839143306	SIOHWIMHRPYJMH-AUUYWEPGSA-N	429.876	1.317	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc4ccoc4cn3)CCO2)C1	1839487139	SNTVKMYGQGRQEG-FOIQADDNSA-N	437.880	1.152	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(CN(C(=O)/C=C/c3cccc(O)c3)CCO2)C1	1839925584	AEERFZZBWUHITR-DORXLWPQSA-N	448.592	1.713	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccncc3F)C2)C1	1839964241	KXANVHQQHASUSL-KBXCAEBGSA-N	444.301	1.464	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)c3ccccc3)C2)C1	1840150271	HXPBZIUBJIOOIP-QKLQHJQFSA-N	428.888	1.407	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3cccs3)C2)C1	1840151217	XUFMSGIWZYWAST-QFBILLFUSA-N	430.954	1.391	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc4cccnc34)C2)C1	1840152734	RJPIXWGEANIDHS-GCJKJVERSA-N	447.919	1.559	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(C)cc(F)c3)C2)C1	1840154844	HOVIDDHRBZZPSK-PXNSSMCTSA-N	428.888	1.458	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3c(C)cccc3Cl)C2)C1	1840155000	MLCNYLRJZMUULA-OXJNMPFZSA-N	445.343	1.972	50	20	IDGD	
CC(C)(C)n1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)cn1	1840186383	LMZKHGWGJQHMEQ-GOSISDBHSA-N	433.336	1.512	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@]1(F)CCCC=C1F)CCO2	1840950770	AVHAIOXKDGOQCT-ZOCIIQOWSA-N	436.883	1.442	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2cnc(Cl)nc2)C1	1840974139	YWDZPUVRAHAKHA-WYMPLXKRSA-N	429.868	1.081	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@H]2CC(=O)CN2C(=O)OC(C)(C)C)C1	1841433899	CNAOWDAXXMEMRU-GJZGRUSLSA-N	443.928	1.022	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)[C@@H]1CNc3ccccc31)C2	1843415887	YNADNMITZLRPDT-CIRUFVMISA-N	434.500	1.533	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)c2ccc(-c3ccccc3)nc2)C1	1844602085	LIKNREZCGMSXAN-UHFFFAOYSA-N	435.528	1.939	50	20	IDGD	
CCNC(=S)NCC(=O)N1CCCC12CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)C2	1845760379	NTCXUXQEOAHZOB-OVCLIPMQSA-N	447.511	1.559	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)C1(F)CN(C(=O)OC(C)(C)C)C1)C2	1846365543	AQNFUCBXEAKZRU-ZDUSSCGKSA-N	433.908	1.403	50	20	IDGD	
O=C(OCc1ccccc1)N1CC(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](O)CCl)C1	1847562369	DFSCQDXRJYCNIB-BZSNNMDCSA-N	435.908	1.057	50	20	IDGD	
CSCc1nc2ccccc2n1CC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	15721210	SVRGYEWPKHZXHR-UHFFFAOYSA-N	436.497	1.607	50	20	IDGD	
CCn1nc(C(=O)N/N=C2\C(=O)Nc3cc4c(cc32)OCCCO4)c2ccccc2c1=O	17417359	DDGXABUPCZZTQT-UHFFFAOYSA-N	433.424	1.664	50	20	IDGD	
CCCCCCNC(=O)[C@@H]1CCCN(C(=O)NNC(=O)CNC(=O)c2cccs2)C1	725873440	NNTVGYMNMMPMCQ-OAHLLOKOSA-N	437.566	1.627	50	20	IDGD	
O=C(NCCCNC(=O)c1cccc(Br)c1)NNC(=O)c1ccccc1O	726259389	CYQODPKPLUHEOC-UHFFFAOYSA-N	435.278	1.919	50	20	IDGD	
CN(CCO)S(=O)(=O)c1ccc(C(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)cc1	728312147	FEYDADBTKCKVHB-UHFFFAOYSA-N	435.546	1.277	50	20	IDGD	
Cc1nnnn1[C@H](Cc1ccc(F)cc1)C(=O)NNC(=O)c1cccc(OC(F)F)c1	728484804	JSLMWEAUMYLPBT-MRXNPFEDSA-N	434.378	1.967	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)c1cccc(S(=O)(=O)N2CCc3ccccc32)c1	728852531	DWRFABLSMNVVBK-UHFFFAOYSA-N	436.493	1.837	50	20	IDGD	
CCS(=O)(=O)NCCCNC(=O)NNC(=O)c1sc(-c2ccccc2)nc1C	728942497	WHFCXOZKIHCLIE-UHFFFAOYSA-N	425.536	1.392	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1cn(Cc2ccccc2)nc1-c1ccccc1	729276185	YRUHWOBANAUEET-HNNXBMFYSA-N	441.513	1.297	50	20	IDGD	
O=C(CSCc1cc(=O)n2ccsc2n1)NNC(=O)Cn1ccc2ccccc21	729451169	LIDSDDFSIUYESK-UHFFFAOYSA-N	427.511	1.792	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NNC(=O)Cn2ccc3ccccc32)cc(OC)c1OC	729494487	UHNHIIJOGAVRLY-UHFFFAOYSA-N	441.444	1.343	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NC[C@@H]2CCCN2C(=O)OC(C)(C)C)c2ccccc2c1=O	730908667	FCKJCAFNCLSQAZ-ZDUSSCGKSA-N	444.492	1.277	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(F)(F)Oc2ccc(C=O)cc2)c2ccccc2c1=O	731597553	BJFSIZGNSHOBHQ-UHFFFAOYSA-N	430.367	1.662	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2nc(NCc3ccco3)ncc2Cl)C[C@H](C)O1	732263494	NJKYCOLUENFXDQ-STQMWFEESA-N	436.900	1.595	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN(C(=O)c2cccc3ccccc23)C1)[C@@H]1CCS(=O)(=O)C1	732644990	CIEJRELYJFTITF-IAGOWNOFSA-N	443.525	1.274	50	20	IDGD	
COC(=O)c1cc(OC(=O)c2ccc3c(c2)S(=O)(=O)N(C2CC2)C3=O)ccc1[N+](=O)[O-]	732651368	IPJVCDFDKCNNRW-UHFFFAOYSA-N	446.393	1.908	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1	733169936	HYZQRXQVXOADLU-HNNXBMFYSA-N	427.486	1.309	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)c2cc(Br)cnc2N(C)C)cc1	733605555	XPKAISJIQYFGLI-UHFFFAOYSA-N	435.278	1.837	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc2c(c1)nc(CCC(=O)NNc1ncccc1Cl)n2C	734247366	GNJCCYJQEZWAIN-UHFFFAOYSA-N	436.925	1.948	50	20	IDGD	
COCCOc1ccc(-n2nc(C)c(C(=O)NNC(=O)c3ccccc3OC)n2)cc1	735011515	JWFJBDUSEPACTD-UHFFFAOYSA-N	425.445	1.684	50	20	IDGD	
CN(c1ccccc1)S(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=O)c2cnn(C)c2)c1	735444115	CBBSLDJMGHODNC-UHFFFAOYSA-N	447.904	1.973	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)c1ccccc1S(=O)(=O)N1CCCCC1	737637443	AACBDBPSNNLEOI-UHFFFAOYSA-N	431.514	1.839	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)c1cc(N2CCOC2=O)ccc1F	741683339	XVLLCXRXAVAREH-UHFFFAOYSA-N	434.449	1.980	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc(NC(C)=O)c1OC	742535100	NJAXVNWFVVHYEF-UHFFFAOYSA-N	435.458	1.141	50	20	IDGD	
CC(C)=CC(=O)NCc1ccc(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1	742635365	MFRVVLZVPWEPRM-UHFFFAOYSA-N	436.516	1.737	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(F)c(Br)c1)[C@@H]1COc2ccccc2O1	743252306	VZRZDOCEXOVZES-AWEZNQCLSA-N	431.239	1.738	50	20	IDGD	
C[C@@H](C(=O)NC1CC1)N1CCN(C(=O)NNC(=O)c2cccc(Br)c2)CC1	743686454	CMUPTYYNHUEPIZ-LBPRGKRZSA-N	438.326	1.088	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CN2CCN(C(=O)[C@@H](C)Oc3ccccc3C)CC2)c1	744406817	JOEDKDLUQORFQE-LJQANCHMSA-N	438.528	1.676	50	20	IDGD	
CCO[C@@H](C)c1nc(CN2CCN(CC(=O)NNC(=O)c3cccs3)CC2)cs1	744412316	GGTLBSQAPZSXAY-AWEZNQCLSA-N	437.591	1.881	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	744642829	HHLLMPJWSDWGHN-MRXNPFEDSA-N	440.481	1.619	50	20	IDGD	
Cn1cc(N2CC[C@H](NC(=O)NNc3c(F)cc(F)cc3Br)C2=O)cn1	745830547	AZJQXISCUQHEOT-LBPRGKRZSA-N	429.225	1.892	50	20	IDGD	
CCc1ccc([C@@H](COC)NC(=O)NNC(=O)c2nn(CC)c(=O)c3ccccc23)o1	745847377	PEUBOZSGXGWGRG-MRXNPFEDSA-N	427.461	1.904	50	20	IDGD	
CC[C@@H](C)C[C@@H](C)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	745889308	GVIRZKDMTJFXBR-HUUCEWRRSA-N	426.539	1.476	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Br)cc2F)CC1)NNC(=O)NC1CC1	746165966	UIDNMIGWTJPXEO-UHFFFAOYSA-N	428.306	1.199	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)[C@H]1CCCN1Cc1ccccn1	746331775	IXMRSIPQYBCMST-LJQANCHMSA-N	445.545	1.210	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCc2c(F)cccc2Cl)cc1	746964431	XBJWFDOQLRBYBE-UHFFFAOYSA-N	442.900	1.939	50	20	IDGD	
COc1ccc([C@H](CNC(=O)NNC(=O)Cc2ccncc2)N2CCOCC2)cc1OC	747489417	FOCDIAIVNUNFKS-SFHVURJKSA-N	443.504	1.045	50	20	IDGD	
CCN1CCN(c2ccc(F)cc2[C@@H](C)NC(=O)NNC(=O)Cc2ccncc2)CC1	747586504	NCPGAYMVFRTSLI-MRXNPFEDSA-N	428.512	1.997	50	20	IDGD	
O=C(O)COc1ccc(S(=O)(=O)NNC(=O)c2cc3c(s2)CCC3)cc1Cl	748689604	NRKSOHPKEBVMRX-UHFFFAOYSA-N	430.891	1.977	50	20	IDGD	
Cc1ccc(NC(=O)[C@H]2CCCN(CC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)C2)nc1	748815963	BGZFVELLZKZLPX-INIZCTEOSA-N	440.460	1.410	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2CCCN(Cc3cccnc3)C2)c1	749160588	LUDXZLOFZYCZRS-GOSISDBHSA-N	445.545	1.005	50	20	IDGD	
Cc1cc(C)nc(SCc2ccc(C(=O)NNC(=O)[C@@H](C)N3CCN(C)CC3)cc2)n1	750658731	JEVLTXODCODTAU-QGZVFWFLSA-N	442.589	1.783	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)NCc2csc(CNC(=O)c3ccccc3)n2)n1	750665594	ZAIIGAXZDWAFBE-UHFFFAOYSA-N	441.517	1.417	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@H](C(=O)OCC(=O)NNC(=O)c2cc(Cl)ccc2OC)C1	750921607	KERVWDRSOAHGSN-NEPJUHHUSA-N	426.853	1.632	50	20	IDGD	
COC1CCN(CCNC(=O)CCC(=O)C(C#N)=C2N(C)c3ccccc3N2C)CC1	751059186	XDPGVHQXOJTFSL-UHFFFAOYSA-N	425.533	1.884	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)NCC1CCN(CC(=O)NC(C)(C)C)CC1	751112229	VCNPBFAKEMVZMM-UHFFFAOYSA-N	443.552	1.213	50	20	IDGD	
CC[C@@H](CS(=O)(=O)c1ccccc1)NC(=O)NNC(=O)COc1ccccc1OC	752127842	WQHLCARNQQKWCZ-HNNXBMFYSA-N	435.502	1.657	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)C(=O)Nc2ccc(OC)cc2)c2ccccc2c1=O	752808564	WRPKSSQWCZNGEY-UHFFFAOYSA-N	437.456	1.605	50	20	IDGD	
CC(=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O)c1ccc(Cl)c(C(F)(F)F)c1	754713129	CIEBFNKRWACPSM-UHFFFAOYSA-N	449.842	1.784	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(N2C[C@H](C(=O)NNc3cc(C)ccn3)CC2=O)cc1	755847278	OXENSENDHDTCFV-MRXNPFEDSA-N	445.545	1.917	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)Nc3cc(C(N)=O)ccc3C)n[nH]2)cc1OC	756262037	LKQLAQCJRFIMFJ-UHFFFAOYSA-N	438.444	1.968	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)Nc1cc(F)cc(N2CCOCC2)c1	756279632	IPFLMLJURKXKPS-UHFFFAOYSA-N	426.412	1.105	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCC[C@@H]2CN2C[C@@H](C)O[C@H](C)C2)cc1OC	756502289	SBADYQDYYSGAGR-JFIYKMOQSA-N	434.537	1.038	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)Nc2ccn(CCN3CCOCC3)n2)cc1	756647806	URDXPNMUPWHBAZ-MRXNPFEDSA-N	446.508	1.234	50	20	IDGD	
COc1c(F)cc(F)cc1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	757688029	XULFFYBAODAPMA-UHFFFAOYSA-N	428.417	1.690	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)NNC(=O)COc2ccc(C#N)cc2)cc1Cl	757738896	WNQJVHWBZATHEG-UHFFFAOYSA-N	432.820	1.995	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N[C@@H]2CN(C(=O)OC(C)(C)C)C[C@H]2C#N)cc1OC	758753116	DHJAMTQBENIGEV-ZIAGYGMSSA-N	433.465	1.407	50	20	IDGD	
COC(=O)c1cc(NC(=O)/C(C#N)=C\c2cc(C#N)n(C)c2C)cc(S(C)(=O)=O)c1	758846320	MMURKWOJOWZRMY-WCSRMQSCSA-N	426.454	1.941	50	20	IDGD	
COC(=O)c1cn([C@@H]2CCN(C(=O)NNC(=O)c3cccc(Br)c3)C2)nn1	760682527	VTNPWPKCDBAJAC-GFCCVEGCSA-N	437.254	1.129	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)c2ccccc2c1=O	763285648	WEFDALNLFUICBY-UHFFFAOYSA-N	433.384	1.102	50	20	IDGD	
O=Cc1ccc(OCCn2cc(C(=O)NNC(=O)Cc3ccccc3F)nn2)c(Cl)c1	763370592	NGWWBYUFLFDTAW-UHFFFAOYSA-N	445.838	1.966	50	20	IDGD	
O=C(NNC(=O)c1ccccc1)C(=O)Nc1cc(F)c(I)c(F)c1	763432165	ZQYSDAGIWUWEIA-UHFFFAOYSA-N	445.163	1.969	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)C(=O)Nc1cccc(C#Cc2ccccn2)c1	763442901	FNHKVTAYABCMEC-UHFFFAOYSA-N	429.392	1.789	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)ccc1Cl	763446455	UANDVOUIHPKJNM-UHFFFAOYSA-N	434.792	1.825	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1OCC	763570987	JYDAAOAOZWNQNB-GOSISDBHSA-N	429.429	1.410	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(C(=O)NC(C)C)cc2C)c1	763619630	ZGTWOMJJEVQOLX-UHFFFAOYSA-N	426.473	1.607	50	20	IDGD	
CCOc1cc2c(cc1NC(=O)C(=O)NNC(=O)c1c(C)nc3ccccn13)O[C@@H](C)C2	763625985	ZYNKJAXIWZGOQQ-LBPRGKRZSA-N	437.456	1.765	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2ccc(C(=O)N(C)C)c(Cl)c2)c1	763667563	BHJNTQFIWMLJJG-UHFFFAOYSA-N	446.891	1.824	50	20	IDGD	
C[C@@H](c1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2F)cc1)N1CCOCC1	763682051	VXWSMQNRFFIHOB-HNNXBMFYSA-N	444.463	1.384	50	20	IDGD	
NC(=O)c1cccc(NC(=O)C(=O)NNC(=O)COc2ccccc2Cc2ccccc2)c1	763717885	BTSDZUMBVLMJPP-UHFFFAOYSA-N	446.463	1.541	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)C(=O)Nc2cccc(F)c2F)c2ccccc2c1=O	763801160	IXGSHYHPGPTMHJ-UHFFFAOYSA-N	443.410	1.875	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)C(=O)Nc1ccc(OC(F)(F)F)cc1	763802691	FUEHFNUBRUSWIM-UHFFFAOYSA-N	442.306	1.658	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)N2CCc3cc(F)c(F)cc32)cc1	763861246	NFQALVWPWUGLJZ-GFCCVEGCSA-N	433.411	1.868	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccc(OC[C@@H]2CCCO2)cc1	763866912	RMYXHCPGHVVDBS-LIRRHRJNSA-N	445.447	1.937	50	20	IDGD	
Cc1nccn1-c1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)cn1	763867620	XRBYFNBVAOQCCO-GFCCVEGCSA-N	426.408	1.268	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)cc1C(=O)NC(C)C	763872241	MRKHRLNIUAZKOG-AWEZNQCLSA-N	444.463	1.826	50	20	IDGD	
CCOc1ccc(C(F)(F)F)cc1NC(=O)C(=O)NNC(=O)Cn1nc(C)cc1C	763881195	LOQCZGZTIKZGBS-UHFFFAOYSA-N	427.383	1.704	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccc(C(=O)N3CCCC[C@@H]3C)cc2)n1	763892238	CIBOJZITTPLPTK-HNNXBMFYSA-N	440.504	1.301	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)C(=O)Nc2cccn(CC(F)(F)F)c2=O)cc1	763897799	GKJCWPBDQNIKAQ-UHFFFAOYSA-N	442.419	1.597	50	20	IDGD	
Cc1cc(S(C)(=O)=O)ccc1NC(=O)C(=O)NNC(=O)C1=S=C2CC[C@@H](C)CC2=C1	763941190	KELYZQCSIRMALY-LLVKDONJSA-N	449.554	1.322	50	20	IDGD	
C[C@H]1CCC2=S=C(C(=O)NNC(=O)C(=O)Nc3ccnn3Cc3ccccc3)C=C2C1	763943810	UQHYQIKUYDUHCM-AWEZNQCLSA-N	437.525	1.855	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)C(=O)Nc1ccccc1O[C@@H]1CCOC1	763994261	BUBXBZPSNPKRKB-LLVKDONJSA-N	437.250	1.345	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)C(=O)Nc1cc2c(cc1Cl)OCO2	763994376	CMGTZHLHBRQHFM-UHFFFAOYSA-N	429.614	1.559	50	20	IDGD	
CN(C)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(Br)cn2C)cc1Cl	764002483	NATLLAOUJXSJOT-UHFFFAOYSA-N	442.701	1.907	50	20	IDGD	
Cc1cnn(-c2ccc(NC(=O)C(=O)NNC(=O)c3ccc4c(c3)OCCO4)cc2F)c1	764006051	JGNAKTSNBBJUHO-UHFFFAOYSA-N	439.403	1.491	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)on1)C(=O)Nc1ccc(Cn2cncn2)cc1	764017226	VMPLHSGIJQFPSG-UHFFFAOYSA-N	431.412	1.381	50	20	IDGD	
C[C@H](CS(=O)(=O)c1ccc(F)cc1)C(=O)NNC(=O)CSc1ccccc1O	764047675	VIEIFVLFPZRYIY-GFCCVEGCSA-N	426.491	1.881	50	20	IDGD	
CC(=O)NCc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(Br)c2)cc1	764063065	KFEPJLCJOFOKJD-UHFFFAOYSA-N	433.262	1.485	50	20	IDGD	
O=C1C[C@@H](c2cccc(NC(=O)C(=O)NNC(=O)c3cccc(Br)c3)c2)CN1	764063856	YZGQLYNIDUBCQM-CYBMUJFWSA-N	445.273	1.452	50	20	IDGD	
CCNC(=O)N1CCc2ccc(NC(=O)C(=O)NNC(=O)c3ccc(C)cc3O)cc21	764105462	SEJZZDQJYVCBTM-UHFFFAOYSA-N	425.445	1.192	50	20	IDGD	
CC(C)NC(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)c1	764162268	BKPORPMYVWRZNS-QGZVFWFLSA-N	444.875	1.568	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)Cc2ccccn2)sc2c1CC[C@H](C)C2	764263776	IWMGBQUHGLNHKS-LBPRGKRZSA-N	444.513	1.773	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cc(Br)ccc2O)ccc1N(C)C	764279990	KCXGVWMNZWWOLL-UHFFFAOYSA-N	435.278	1.929	50	20	IDGD	
COCC(=O)NNC(=O)C(=O)Nc1ccc(CN2C(=O)Cc3ccc(Cl)cc32)cc1	764295074	HFWTWRFESXRWIE-UHFFFAOYSA-N	430.848	1.162	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)Cc3ccncc3)cc2F)C[C@@H](C)O1	764352726	CLPHJVHWEZNEHF-OKILXGFUSA-N	429.452	1.163	50	20	IDGD	
COC(=O)c1cc(F)ccc1NC(=O)C(=O)NNC(=O)C(F)(F)Oc1ccccc1	764380079	OBUJJIXNKVYFJM-UHFFFAOYSA-N	425.319	1.370	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)C(=O)Nc1ccc(CCN2CCSCC2)cc1	764386319	FRQCFOXPGZNSAJ-UHFFFAOYSA-N	427.530	1.381	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(Br)c2ccccc12	764398886	YCHMHSZIWHEKKO-LLVKDONJSA-N	438.278	1.740	50	20	IDGD	
CCOC(=O)c1cnn2c(C(=O)NNC(=O)c3cc(-c4ccc(C)c(C)c4)[nH]n3)ccnc12	764753202	IOVIGAXWCJUSPE-UHFFFAOYSA-N	447.455	1.988	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)c1cccn(Cc2ccccc2)c1=O	765311633	ZHPRIFOSUSNNHI-UHFFFAOYSA-N	428.489	1.963	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)c3ccc(S(=O)(=O)N(C)C)cc3)n[nH]2)cc1	765572149	VTKDMBZSPJIJFU-UHFFFAOYSA-N	441.513	1.964	50	20	IDGD	
CCN(CC)C(=O)CCC(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	765757540	VIIOLSUVRWBPJM-UHFFFAOYSA-N	437.972	1.254	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)CC(=O)NNc2ccccc2S(C)(=O)=O)cc1F	766663262	OZDPRRIPKRQBEA-UHFFFAOYSA-N	428.463	1.349	50	20	IDGD	
CCOc1ccc(-n2c(C)cc(/C=C(/C#N)C(=O)NS(=O)(=O)CC(N)=O)c2C)cc1	766928130	QQZJGHGLNUWRBU-YBEGLDIGSA-N	430.486	1.331	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C3=NN(c4ccccc4)[C@H](C(N)=O)C3)n[nH]2)cc1C	768261870	CNPJHEKQZGHOFG-FQEVSTJZSA-N	445.483	1.575	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)Nc1cccc(CS(C)(=O)=O)c1	769232605	HSGOMBQOBLAXJY-UHFFFAOYSA-N	427.504	1.792	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)c3cccc([C@]4(C)NC(=O)NC4=O)c3)n[nH]2)cc1C	769280127	FMPCXDWMUMDGNJ-QHCPKHFHSA-N	446.467	1.823	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)c1csc(NC2CC2)n1	769302806	RVUBSJJXBJCBMI-UHFFFAOYSA-N	448.980	1.950	50	20	IDGD	
COc1ccccc1[C@H](CNC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)OC(C)C	770304588	BLQOBNXKKACWIZ-IBGZPJMESA-N	439.476	1.781	50	20	IDGD	
CCNc1ncc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)s1	770953749	HJXYJYXMGLIICC-UHFFFAOYSA-N	437.547	1.824	50	20	IDGD	
Cc1cc2c(cc1C)[C@H](C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1)CO2	771391892	LWXHZWNXUHEJSJ-QGZVFWFLSA-N	431.514	1.944	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNc2ccc(C(F)(F)F)cn2)c(OC)c(OC)c1	773670206	XVHCMTXYJRDEJQ-UHFFFAOYSA-N	442.350	1.986	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)NC[C@@H]1COC2(CCCC2)O1	773733402	JEKJWVJETWXHKM-CQSZACIVSA-N	428.283	1.844	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)NC[C@@H]2CC[C@H](C(=O)N(C)C)O2)cc1OC	774773766	YUFQHPLFJZXUBD-DOTOQJQBSA-N	436.509	1.454	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)c1cccc(C(=O)NNC(=O)c2ncccc2C)c1	775546520	RYXWVOYGWJPTBQ-UHFFFAOYSA-N	432.440	1.243	50	20	IDGD	
O=C(NNC(=O)C(=O)Nc1ccccn1)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1	776265160	OEBXZZUANSSSLX-LBPRGKRZSA-N	436.394	1.648	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc(OC(F)(F)F)cc1)NNc1ncncc1Cl	781806329	XXBQOASDMPZFEO-UHFFFAOYSA-N	439.803	1.840	50	20	IDGD	
CC(C)Oc1cc(F)ccc1NC(=O)C(=O)NNC(=O)Cc1nc2ccccc2n1C	782889250	XYMWGHAHMMMMCA-UHFFFAOYSA-N	427.436	1.828	50	20	IDGD	
CNC(=O)c1ccc(C)c(NC(=O)C(=O)NNC(=O)c2cc(-c3cc(C)ccc3C)[nH]n2)c1	785126871	SNDQUILZGQYPRC-UHFFFAOYSA-N	448.483	1.761	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3cc(C)ccc3C)[nH]n2)c(OC)n1	785129431	PGCDXNRJQMMXSS-UHFFFAOYSA-N	438.444	1.505	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2ccc(F)cc2S(=O)(=O)CC)n1	785225942	MDSSTUBGDYEGJW-UHFFFAOYSA-N	438.485	1.337	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(C)c(C(=O)N(C)C(C)C)c2)c1	787540914	GSFHVNMFBFKYAD-UHFFFAOYSA-N	440.500	1.949	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N2C[C@@H]3CN(C)C[C@@H]3C2)cc1	787631791	XZZJOQLGPOJZEV-OFGHHNNISA-N	448.527	1.361	50	20	IDGD	
CCCCOc1ccc(C(C)=NNC(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)cc1	789038843	SJYYVHBUPGZIJR-UHFFFAOYSA-N	426.477	1.153	50	20	IDGD	
CC(C)n1nc(-c2ccco2)cc1NC(=O)C(=O)NNC(=O)CNC(=O)c1cccs1	789759102	ZPUXHPFIOMGAKP-UHFFFAOYSA-N	444.473	1.301	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)CN1C(=O)N[C@@]2(C[C@H](C)CC(C)(C)C2)C1=O	790064275	ZQAWZDWXBXOERL-ZUOKHONESA-N	426.514	1.060	50	20	IDGD	
Cc1cccnc1NNC(=O)C(=O)Nc1ccc(S(=O)(=O)N2C[C@H](C)O[C@@H](C)C2)cc1	792375314	IEIJAUHXBVXOJP-GJZGRUSLSA-N	447.517	1.270	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NN=C[C@]23C[C@H]2CN(C(=O)OC(C)(C)C)C3)c1	792901878	YRZRDDOVPJDDLF-YWZLYKJASA-N	436.534	1.910	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)C(C)(C)C2CCOCC2)c1	794880403	TUAPEUSKTMWFHO-UHFFFAOYSA-N	425.551	1.931	50	20	IDGD	
CCc1ccc(N2C[C@H](C(=O)NNc3ccccc3S(=O)(=O)N(C)C)CC2=O)cc1	795180708	AIJRQOFZFCRUGO-MRXNPFEDSA-N	430.530	1.996	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H](Cc2ccc(F)cc2)n2nnnc2C)cc1C	798307681	BRKKXXORWVPXDK-SFHVURJKSA-N	439.451	1.307	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2nn(-c3ccc(Cl)cc3)cc2O)n1	801373531	YOFKSDZJDLILKD-UHFFFAOYSA-N	449.876	1.543	50	20	IDGD	
N#Cc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)Nc3ccccc3)CC2)cc1	801990331	FCVWLWWORMIDOJ-UHFFFAOYSA-N	427.486	1.812	50	20	IDGD	
CC(=O)c1cccc(S(=O)(=O)NCCC(=O)NNC(=O)Nc2cc(F)cc(F)c2)c1	802001692	QMYYQRVYYQXDSV-UHFFFAOYSA-N	440.428	1.689	50	20	IDGD	
COc1ccc(C2=NO[C@@H](CNC(=O)NNc3nc(O)c4cnn(C)c4n3)C2)cc1F	802342094	GFSPKOQLAHVSJF-SNVBAGLBSA-N	430.400	1.036	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)N[C@@H]1CCCN(C(=O)Cc2ccccc2)C1	802473797	QFCGEHKYLHJPTC-QGZVFWFLSA-N	426.473	1.335	50	20	IDGD	
C#Cc1cc(F)c(NC(=O)C(=O)NNC(=O)c2cc(Br)ccc2O)c(F)c1	802566687	BFIWCHAOYIRVQB-UHFFFAOYSA-N	438.184	1.814	50	20	IDGD	
COC(=O)c1cn(CCNC(=O)NNC(=O)c2cc3c(s2)CC[C@@H](C(C)(C)C)C3)nn1	807250931	OXZCBSYWPPGTGP-CYBMUJFWSA-N	448.549	1.921	50	20	IDGD	
COC(=O)c1cc(C)c(NC(=O)C(=O)NNc2ccc(-n3ccnc3)nn2)c(Cl)c1	807428401	CSGBVMPAJQMVBW-UHFFFAOYSA-N	429.824	1.493	50	20	IDGD	
CCCS(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1	808068491	ACFBNZJQQWTACC-KRWDZBQOSA-N	440.499	1.020	50	20	IDGD	
Cn1nc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)cc1C1CC1	810394069	WLGGQWTZVGHHLO-UHFFFAOYSA-N	431.396	1.673	50	20	IDGD	
C=CCOc1c(Br)cc(C=NNC(=O)[C@@H]2CCS(=O)(=O)C2)cc1OC	812455799	SMIDYVWCCPBOLK-GFCCVEGCSA-N	431.308	1.907	50	20	IDGD	
Cc1ccnn1-c1ccccc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	813033895	QGRVPTXLXWPQDR-UHFFFAOYSA-N	442.501	1.513	50	20	IDGD	
CCCc1nnc(SCC(=O)NNC(=O)c2cc(-c3ccc(CC)cc3)[nH]n2)n1N	813502190	NNDKUMLUEFRURT-UHFFFAOYSA-N	428.522	1.450	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)NC[C@@H]1C[C@H](F)CN1C(=O)OC(C)(C)C	813816113	JULHUHCIPMLJAD-KBPBESRZSA-N	440.472	1.752	50	20	IDGD	
CNC(=O)c1cc(Oc2cccc(NC(=O)C(=O)NNC(=O)c3ccccn3)c2)ccn1	815563556	GWQRCOXLXXVIOP-UHFFFAOYSA-N	434.412	1.028	50	20	IDGD	
N#C[C@@H](c1ccccc1)c1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2CCc3nncn3C2)cc1	815691398	OXLCYHWFJPYLNI-MJGOQNOKSA-N	443.467	1.282	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCc2nncn2C1)C(=O)Nc1cc(Cl)cc(C(F)(F)F)c1	815693313	SNVIERYMOAHVKS-QMMMGPOBSA-N	430.774	1.299	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C[C@@](O)(c2nccn2C)C(F)(F)F)cc1	818649174	LPWFCRQSQQRTPU-KZULUSFZSA-N	444.410	1.574	50	20	IDGD	
COC(=O)c1cccc(NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c1	861712683	ROLMBWJPTXUCJF-UHFFFAOYSA-N	425.489	1.838	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)CNS(=O)(=O)c2cc(C)ccc2C)cc1OC	913069655	ZMZBZKIJSOPYGS-UHFFFAOYSA-N	435.502	1.450	50	20	IDGD	
CC(=O)c1cccc(S(=O)(=O)NCC(=O)NNC(=O)CC23CC4CC(CC(C4)C2)C3)c1	913500018	ATBYMHPKTSCADP-UHFFFAOYSA-N	447.557	1.921	50	20	IDGD	
O=C(Cn1cnc2ccccc21)NNC(=O)c1cccc(S(=O)(=O)NCC2CC2)c1	914602656	IBLJIJKWXIRJAT-UHFFFAOYSA-N	427.486	1.186	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)[C@H]2CCCN2C(=O)C(C)(C)C)c2ccccc2c1=O	914846518	NNQDSRLISFTVKZ-MRXNPFEDSA-N	427.505	1.776	50	20	IDGD	
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)COc1ccc(C#N)cc1	915188365	HSTJUXQVMJEQAA-NRFANRHFSA-N	447.495	1.949	50	20	IDGD	
COc1cccc(C[C@H](C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)n2nnnc2C)c1	915800047	JGTOLEISBKKZRA-QGZVFWFLSA-N	425.405	1.143	50	20	IDGD	
COc1cc(C=NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)ccc1OCC(=O)O	916334102	FUJRAPFAIGTTEQ-UHFFFAOYSA-N	441.849	1.223	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)NCC[C@](O)(c2nccn2C)C(F)(F)F)cc1	916379057	YYFJPIOHJXAZRB-KRWDZBQOSA-N	445.467	1.991	50	20	IDGD	
CN1CCN(C(=O)c2ccc(CNC(=O)NNC(=O)c3cccc(Cl)c3)cc2)CC1	916390322	JUUKYWMGLNLRNQ-UHFFFAOYSA-N	429.908	1.872	50	20	IDGD	
Cc1nn([C@@H]2CCS(=O)(=O)C2)c(C)c1C=NNC(=O)[C@@H](C)CN1C[C@H](C)O[C@H](C)C1	917028281	DHOZTIUIMMIZKM-OIPACUDHSA-N	439.582	1.055	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(F)cc2)C1)c1ccc(Cl)nc1	917250853	ITSPCWTVZZGQNW-ZDUSSCGKSA-N	440.884	1.736	50	20	IDGD	
O=C(NCCS(=O)(=O)c1ccc(Cl)cc1)NNC(=O)c1cccc([N+](=O)[O-])c1	919786356	UEPYTQQVOCKUCC-UHFFFAOYSA-N	426.838	1.666	50	20	IDGD	
COc1cccc(C(=O)NNS(=O)(=O)c2cc(S(C)(=O)=O)ccc2Cl)c1O	919958590	RQHJVEOLSAYINO-UHFFFAOYSA-N	434.879	1.081	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Cc2ccc(S(=O)(=O)N3CCCCC3)s2)cc1	1317700867	XFAJSDMXOOSMNS-UHFFFAOYSA-N	437.543	1.935	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cn(C)cc2C(F)(F)F)cc1OC	1320100759	QHBUBXIEAKDFOG-UHFFFAOYSA-N	429.351	1.679	50	20	IDGD	
COC(=O)C(=O)NNC(=O)N[C@H](CNC(=O)OC(C)(C)C)c1ccc2ccccc2c1	1320309277	JXIZHGACHQKTKL-MRXNPFEDSA-N	430.461	1.909	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)/C=N/N3CCCCC3)C2)C1	1779013967	OQBYUDYJKLUTTH-RLTHDXANSA-N	429.359	1.319	50	20	IDGD	
C[C@H](Cn1cccn1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CO[Si](C)(C)C)C1	1779539579	DMODKTPXXLQTTM-DBXWQHBBSA-N	436.629	1.885	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc3n(n1)CCC3)C2	1779545705	XMNKTAORMLWHLE-WIYYLYMNSA-N	434.613	1.808	50	20	IDGD	
O=C(c1ccc(-c2ccccc2)nc1)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1779890332	SASBMQCXVTWZPJ-KNQAVFIVSA-N	429.904	1.792	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](F)Cl)CCO3)cc1NC(C)=O	1780211850	UTBJOXZDKWSOFB-LPHOPBHVSA-N	427.860	1.632	50	20	IDGD	
CCOc1ccc(C(=O)N2CC[C@]3(CN(C(=O)CCBr)CCO3)C2)nn1	1780428230	WZYUQYFTPNZVPD-KRWDZBQOSA-N	427.299	1.104	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccccc3-n3nccn3)C2)C1	1781840488	VFTGRKQTPDJONU-IFXJQAMLSA-N	448.321	1.494	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnc(O)[nH]1)C2	1781901195	IFHVFJDDFOWMMJ-CJBNDPTMSA-N	429.315	1.416	50	20	IDGD	
Cn1nc2c(c1C(=O)N1CC[C@H]3OCCC[C@@]3(CNC(=O)C(Cl)Cl)C1)CCC2	1782221249	OYXRYOAPAHISGB-AUUYWEPGSA-N	429.348	1.840	50	20	IDGD	
COc1cccc(CC(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](C)Br)C3)C2)n1	1783530381	XDFWWEFZQTVBEU-FZKQIMNGSA-N	426.311	1.246	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)Cc3cccnc3Cl)CCO2)C1	1783530522	ZZWDVGAPKWTOBU-SJKOYZFVSA-N	430.730	1.891	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3ccc(OC)c(O)c3)[C@H]2C1	1783786150	RIAIXRIXXRQKFT-FPXQBCRKSA-N	440.924	1.177	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)/C=C/C(=O)c3cccs3)CCO2)C1	1783874715	GUXOVLRUUQLUKA-DROOOQRISA-N	426.922	1.571	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)n3ccnc3)C[C@@H]21	1783964457	UEFRPWSUIGNYBJ-OWYFMNJBSA-N	427.343	1.455	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(Cl)c(F)cc3F)C[C@@H]21)[C@H](O)CCl	1784092694	MHFZNCGKNZKSJK-NAMSACQYSA-N	437.270	1.811	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCn3c(=O)oc4ccccc43)[C@H]2C1	1785195200	SHGYAQSICOGENE-FPXQBCRKSA-N	449.935	1.982	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](N)c3ccccn3)[C@H]2C1	1786866491	QVSIJXKPNPZMQW-UAHISNFZSA-N	439.354	1.092	50	20	IDGD	
CC(C)n1cnc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Br)C[C@@H]32)n1	1787670346	QOYKJIUHLLOZQQ-CYDGBPFRSA-N	432.294	1.143	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)c3n[nH]cc3[N+](=O)[O-])CCC2)cc1)c1cccc(B(O)O)c1	1788147753	BUYLVCUORDTWCV-UHFFFAOYSA-N	449.232	1.059	50	20	IDGD	
COc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)CBr)C[C@@H]32)nn1	1789100968	OFGAOODOMRZQFX-OSFYFWSMSA-N	441.326	1.110	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc4ncccn34)C[C@@H]21	1789868232	QXWMGPULCATFHR-VODUFIJXSA-N	440.331	1.559	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4n(n3)CCCO4)C[C@@H]21	1789868235	REDQMHRGHLWRRN-NGOJXBLDSA-N	445.347	1.495	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)NC(=O)OC(C)(C)C)C[C@@H]21	1791257835	VSHXUGXMTVFPRI-CWVYHPPDSA-N	447.960	1.133	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(F)c(OC)c3)[C@H]2C1	1791947030	UYCTWTUSFLFSCT-XSWJXKHESA-N	428.888	1.681	50	20	IDGD	
COc1ccc([C@H]2C[C@H]2C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)cc1	1793521681	XTNNOKJRPOUYJY-QGAVKGNSSA-N	448.328	1.431	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)Cn1cccn1	1794210036	DJPGNZNUCNFINK-RBZJEDDUSA-N	427.343	1.282	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(Cl)nc1F	1794246307	CROLLOAWNQRTFS-ORXSELOVSA-N	434.693	1.861	50	20	IDGD	
Cc1ccc2nc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)c3cccc(B(O)O)c3)C4)sc2c1	1795354817	MMRSVBJUPOQMRA-BCDXTJNWSA-N	449.341	1.850	50	20	IDGD	
CC(C)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnc(C(F)(F)F)cn1	1796067242	FVBYMKFKBTYHEX-GNXNZQSNSA-N	434.846	1.964	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1n[nH]c2c1CCCC2	1796166234	GRRFZDGMLWNZRM-FAXLKDOZSA-N	439.354	1.665	50	20	IDGD	
CN1CCc2cc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@H](F)Br)C4)ccc21	1797019236	MUEIYTQRLPGNHR-FSDCSDTHSA-N	440.313	1.573	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)[C@H]1C[C@@H]1c1ccc(Cl)cc1	1797189784	UZFLAJASROEGCZ-RBQNZQIVSA-N	427.328	1.633	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1Cc3ccccc3CN1)C2	1797954701	ACJATQDILFBIAP-JTJHWIPRSA-N	431.609	1.142	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cc(F)ccc1F)C2)[C@@H](F)Br	1799350565	XJBMGHCWSFIDLH-OXUXUCFPSA-N	435.240	1.787	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CC[C@@H]2CCC(=O)N2C1	1799933297	QBIYQPXXDRJAGB-PRFSMCDRSA-N	426.355	1.809	50	20	IDGD	
CS(=O)(=O)c1cncc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](F)Br)c1	1800157490	RERDRIGRYLAEFS-OPDFLTKYSA-N	448.314	1.427	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1C[C@@H]1F	1800373571	WDEVOESRPGKASZ-IWTMDLJTSA-N	433.908	1.066	50	20	IDGD	
CNC(=O)CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](Br)Cc1ccccc1	1801568073	QSVQZUWQSUHJMB-YVSFHVDLSA-N	436.350	1.767	50	20	IDGD	
COCCOCCOCCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](F)Br)C2	1802085856	LJHBAZXNTYHNER-FQLMCAECSA-N	439.322	1.385	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C[C@H]1COc3ccccc3O1)C2	1802333865	DHUZEFMNTUTXPQ-MHORFTMASA-N	444.532	1.228	50	20	IDGD	
COC(=O)[C@@H]1CC[C@H](C(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)C1	1803137358	MMJANFMHSOZNDW-XGAARHLOSA-N	437.924	1.276	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cc(C(F)F)no2)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803138308	JIUIMLDCJDNTJN-CORIIIEPSA-N	428.823	1.927	50	20	IDGD	
O=C1Cc2cccc(C(=O)N3CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]3c3cccnc3)c2N1	1803146369	AOOURBOKANHFHZ-OXFYSEKESA-N	442.903	1.496	50	20	IDGD	
Cn1cccc1C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1	1805351687	FSSZOYLURLRIND-OXQOHEQNSA-N	447.499	1.052	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@H]1C(=O)N1CCC2(CCCN(C(=O)[C@H](O)CCl)C2)CC1	1805528695	XJSIXAWPRNQIDP-BRWVUGGUSA-N	426.941	1.573	50	20	IDGD	
COC(=O)CCC(=O)N1CCCC2(CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CC2)C1	1809096418	BTVQQAYEGPFXQQ-LFVJCYFKSA-N	445.520	1.305	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)c3cccc(F)c3F)CC2)C1	1809969563	JXHYSJDAPKZGSV-UHFFFAOYSA-N	442.271	1.803	50	20	IDGD	
CCNC(=S)NCC(=O)NC[C@@H]1CCN(C(=O)[C@@H](Cl)CC)[C@@H]1c1cccnc1	1812333189	SUXJOWALOVVHTP-YQQAZPJKSA-N	425.986	1.589	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2nccs2)[C@H]1c1cccnc1	1813070357	IAZJNDNJJQWOAN-YJBOKZPZSA-N	430.534	1.231	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](F)Br)[nH]n1)c1cc(O)nc(O)n1	1818031475	HBDSUPXJFAVYCY-JOYOIKCWSA-N	443.233	1.607	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](O)NC(=O)OCC)n[nH]1	1819238367	UQXSZWFBLOMFKD-GHJWDPDVSA-N	429.905	1.874	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc4c(c3)CNC4=O)sc2C1	1819373578	FEJMLEPIRZFGMK-TZMCWYRMSA-N	448.932	1.866	50	20	IDGD	
CC(=O)OC[C@H](OC(C)=O)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](F)Cl)CC2	1819855377	JKUZHRRJHIRHCO-CDMKHQONSA-N	435.861	1.084	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](C)Br)n[nH]1	1822189036	NAOANJWWIHQRND-NQBHXWOUSA-N	443.346	1.893	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(O)cc2F)[nH]n1	1822415711	RHYDROVBEHNMMC-QGZVFWFLSA-N	446.483	1.933	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCc1nc(N)n[nH]1)CC2	1822867594	JTAHXTGDDQFTKL-ZKANADHPSA-N	446.364	1.625	50	20	IDGD	
CC(=O)c1cc(C(=O)N[C@@H]2CCc3nc(NC(=O)[C@H](F)Br)sc3C2)n[nH]1	1823001353	CXTLNYCPIZZOHS-KRTXAFLBSA-N	444.286	1.985	50	20	IDGD	
CCS(=O)(=O)CC(=O)N1CCCC[C@H]1C1CCN(C(=O)CCBr)CC1	1824465501	IYPMQVJZRDOUIR-HNNXBMFYSA-N	437.400	1.826	50	20	IDGD	
Cc1ccc(CC(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)cn1	1825293978	GTMDHMISCGYKMY-HSZRJFAPSA-N	449.360	1.546	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](C)NC(C)=O)CC2	1825451398	JWWHNZKGJCYICT-IEBDPFPHSA-N	431.356	1.753	50	20	IDGD	
CC[C@H](NC(C)=O)C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](C)Br)sc2C1	1825631929	NEJDBWJGVPGGRA-MIMYLULJSA-N	431.356	1.753	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CN1CCCCC1=O)CC2	1826003901	AKDXMRMEEYLMRB-NEPJUHHUSA-N	428.942	1.321	50	20	IDGD	
O=C([C@H]1CCCOC1)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827060083	OVONOLHUZXAFSF-PZJWPPBQSA-N	428.338	1.026	50	20	IDGD	
C[C@@]1(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cccc(B(O)O)c2)CC3)CC=CCC1	1827221479	OSSQJWHJFVBJTR-KSFYIVLOSA-N	439.346	1.795	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@H](O)CCl)CC2)c1ccc(CO)c(F)c1	1827903023	RWANKYMWIBSEPB-BXUZGUMPSA-N	427.885	1.600	50	20	IDGD	
CNC(=S)NCCC(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H](C)Br)CC1	1828931598	SFYLWGAGCZMXGA-HIFRSBDPSA-N	447.443	1.874	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H](O)N2CCOCC2)CC1	1829102635	BQYYGEDFGYKACT-GHTZIAJQSA-N	441.645	1.108	50	20	IDGD	
O=C([C@@H](O)CCl)N1CCC([C@H]2CCCCN2C(=O)Cc2ccc3ncnn3c2)CC1	1830154761	WGGZOXJZMYVGRP-MSOLQXFVSA-N	433.940	1.491	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4nonc4c3)C2)C1	1830362298	QIYLVHGDOQSZTN-HXUWFJFHSA-N	436.896	1.558	50	20	IDGD	
O=C(c1cc(O)nc(O)n1)N1CCC([C@@H]2CCCCN2C(=O)[C@H](F)Br)CC1	1830379002	ZPIHBFBXHIKOBZ-JSGCOSHPSA-N	445.289	1.812	50	20	IDGD	
O=C(/C=C\c1c[nH]c2ccccc12)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1830725076	DHXUAECCUQGUEM-VDXKNXLBSA-N	447.919	1.237	50	20	IDGD	
COc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)cc1Cl	1830738752	UQEWXEANNPAZLD-DNVCBOLYSA-N	447.315	1.018	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cn4ccsc4n3)C2)C1	1831650926	MHADXTCYUNRMQJ-LIRRHRJNSA-N	440.953	1.873	50	20	IDGD	
Cc1cccnc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)CBr)C2)C1	1831820605	BWEABKHAGCHKRE-HNAYVOBHSA-N	440.338	1.491	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)Cc2cscn2)CC1	1831871429	QHEFNDWMFPEXJC-GOSISDBHSA-N	435.594	1.678	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CCCC(F)(F)F)CCO2)C1	1832265679	XRHHJOLPBFGUSW-SWLSCSKDSA-N	445.276	1.959	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)C[C@H]3CCCCO3)CCO2)C1	1832339268	XSDKFUAINLKMGK-MDZRGWNJSA-N	447.370	1.433	50	20	IDGD	
COC1(CC(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CCC1	1832496112	IWIODHKODBHOLS-OAQYLSRUSA-N	442.365	1.559	50	20	IDGD	
O=C(Cc1cnccn1)NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1	1833371945	AVUMKHDCRIHQMK-KRWDZBQOSA-N	442.333	1.281	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)c3nc[nH]c3[N+](=O)[O-])CC2)CC1	1833532243	IOWRMFLUMLBNAU-OAHLLOKOSA-N	440.932	1.911	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)C(=O)c3ccco3)CC2)CC1	1833757126	HRYBPIXHNLOGBP-MRXNPFEDSA-N	425.913	1.288	50	20	IDGD	
O=C(CCBr)NC1CCN(C2CCN(C(=O)c3cc(O)no3)CC2)CC1	1834423067	BBRYXGPRYAMCSE-UHFFFAOYSA-N	429.315	1.350	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)C3CCSCC3)C2)C1	1834827874	SHJAHJPTJCBSLI-QGZVFWFLSA-N	435.384	1.371	50	20	IDGD	
Cn1ccc(CC(=O)NC2CCN(C3CCN(C(=O)[C@H](F)Br)CC3)CC2)n1	1834849238	XPWOWEILTVGAEU-KRWDZBQOSA-N	444.349	1.225	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)c1cc(C(F)F)no1	1834910362	ZURUZECXSFEOSQ-AWEZNQCLSA-N	434.871	1.397	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)CCc3nc(N)n[nH]3)CC2)CC1	1835665284	OWODRJXNWQDACB-MRXNPFEDSA-N	439.992	1.299	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](COC)NC(C)=O)CC2)CC1	1835840435	QGOMUVSSCJENLM-RBUKOAKNSA-N	445.004	1.117	50	20	IDGD	
CCc1cc(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](Cl)COC)CC3)CC2)nn1C	1836034417	QIRSUKREALZUDA-SFHVURJKSA-N	439.988	1.422	50	20	IDGD	
CC(C)c1cc(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)n[nH]1	1836157836	JDZLULCTZOGABL-SFHVURJKSA-N	425.961	1.318	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)Cc3cnc[nH]3)CC2)CC1)[C@H](F)Br	1836412683	QCCWMUQWAVQPJS-INIZCTEOSA-N	430.322	1.214	50	20	IDGD	
C[C@H](C(=O)N1CCC(N2CCC(NC(=O)[C@@H](F)Br)CC2)CC1)n1ccnn1	1836413515	GDQFWYYBSTZTSP-IUODEOHRSA-N	445.337	1.101	50	20	IDGD	
CN(C)c1ccc(C(=O)N2CCC(OC3CCN(C(=O)[C@H](O)CCl)CC3)CC2)cc1	1836717510	FGGVNQIQTVARBK-HXUWFJFHSA-N	437.968	1.965	50	20	IDGD	
Cc1cc2nc(C(=O)N3CCO[C@@]4(COCCN(C(=O)[C@H](F)Cl)C4)C3)[nH]c2cc1C	1837345928	QQKJCLHEESSTQM-OXJNMPFZSA-N	438.887	1.784	50	20	IDGD	
CC(C)O[C@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1	1837601907	HGVJPNKMOMZGMI-FHLIZLRMSA-N	425.353	1.493	50	20	IDGD	
Cc1cc(CCC(=O)N2CCOC[C@]3(C2)CN(C(=O)CO[Si](C)(C)C)CCO3)ccn1	1837710110	INDHCOGHEFZPOZ-QFIPXVFZSA-N	449.624	1.631	50	20	IDGD	
CCC(C)(C)C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1	1837920122	MCGXOHYUVWRIMU-UHFFFAOYSA-N	430.354	1.415	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)COCCO)CC2)CC1	1838647728	YBNBHQZLQHYRQM-INIZCTEOSA-N	435.359	1.167	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3[nH]cc4c3CCC4)C2)C1	1839153697	OOKKOLMGFYZDIQ-WOJBJXKFSA-N	444.359	1.810	50	20	IDGD	
CC1(C)CCC(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)CC1	1839229903	WJAVHCCYRNFSFY-UTKZUKDTSA-N	430.973	1.649	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3cc(C)ccc3C)CCO2)C1	1839936275	QYTUTHDAYNSNHN-KNQAVFIVSA-N	438.952	1.556	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)C(F)(F)Cl)C2)C1	1839967144	CAVRQPOSKNIONF-ZWNOBZJWSA-N	433.677	1.448	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(F)cc3OC)CCO2)C1	1840641454	GWLWHTGCVGCDQU-OXJNMPFZSA-N	444.887	1.158	50	20	IDGD	
CC(C)[C@H](CNC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1	1841354184	MFGJWVGDPYPATB-GJZGRUSLSA-N	431.961	1.586	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@H]1C[C@H](O)CN1C(=O)OC(C)(C)C)C2	1841668527	YZSGFAMIZBWNNU-XHSDSOJGSA-N	443.972	1.968	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@](C)(C(=O)N2CC3(CCCN3C(=O)[C@H](F)Cl)C2)[C@@H](O)C1	1843363894	FGMFTDDSMSLONH-NJSLBKSFSA-N	447.935	1.732	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)c1cc(C)on1)C2	1844692137	LGTBSNMUDRMFBI-UHFFFAOYSA-N	428.401	1.947	50	20	IDGD	
O=C([C@@H](Br)Cc1ccccc1)N1CC2(CCCN2C(=O)c2cc(CO)on2)C1	1844821309	CZKKKXGUUDEUBS-INIZCTEOSA-N	448.317	1.990	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H]1ON=C(c2ccccc2)O1	1847499323	WLSHWQNJEHJJDH-XPVILTJLSA-N	436.306	1.954	50	20	IDGD	
O=C(Cc1ccc(Br)c(F)c1)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl	1847563984	SRWMZDVWKOKDPS-SOUVJXGZSA-N	433.705	1.932	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)NCc1ccccc1S(=O)(=O)N(C)C	10258401	VRJCGKMDTVYMNC-UHFFFAOYSA-N	430.490	1.037	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)c1ccc2c(c1)C[C@@H](C)N2S(C)(=O)=O	14939580	KJKRDSAGQSMTMA-OLZOCXBDSA-N	435.477	1.765	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=O)[C@H]2COc3ccccc3O2)ccc1C	15794942	JDBBRTRNMNVBLU-GOSISDBHSA-N	447.513	1.627	50	20	IDGD	
CC(C)n1nc(C(=O)NNS(=O)(=O)c2cccc(C(=O)O)c2)c2ccccc2c1=O	16095356	JTFOOOLJFOTTEC-UHFFFAOYSA-N	430.442	1.299	50	20	IDGD	
C[C@]1(C2CC2)NC(=O)N(CC(=O)NNC(=O)c2cc(-c3ccco3)nc3ccccc23)C1=O	17409096	DMSNUPIJFRXBES-HSZRJFAPSA-N	447.451	1.976	50	20	IDGD	
Cn1c(=O)c2c(nc(Cl)n2CC(=O)/C(C#N)=C2\Nc3ccccc3S2)n(C)c1=O	18265109	DNOVMWOMVLBPKT-OQLLNIDSSA-N	428.861	1.609	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)CN2C(=O)CCOc3ccccc32)c2ccccc2c1=O	21204096	MCMFZUQOUWZCFB-UHFFFAOYSA-N	449.467	1.383	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)c1sccc1S(=O)(=O)N1CCCC1	25322763	WFAWKINHJNQGJR-GFCCVEGCSA-N	441.506	1.900	50	20	IDGD	
O=C(COC(=O)c1ccc(OC(F)(F)F)cc1)NNC(=O)[C@@H]1COc2ccccc2O1	104537095	KPICRZQSWDJCGN-HNNXBMFYSA-N	440.330	1.729	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)CCc2c(C)nc3c(C(N)=O)cnn3c2C)cc1C	110883970	RQBMSCZWRBCSHQ-UHFFFAOYSA-N	438.488	1.221	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Nc2ccccc2S(=O)(=O)N1)c1ccc(COc2ccccc2)o1	727764750	KPUQSKWMIYCEIA-GOSISDBHSA-N	442.453	1.350	50	20	IDGD	
O=C(C[C@@H](NC(=O)c1ccccc1)c1ccccc1)NNC(=O)[C@H]1CCS(=O)(=O)C1	728371601	ADUKGLHABCIILQ-ZWKOTPCHSA-N	429.498	1.130	50	20	IDGD	
Cc1nn(C)c2nc(C3CC3)cc(C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)c12	728848152	XLFUDQGYHMCXQU-UHFFFAOYSA-N	434.504	1.622	50	20	IDGD	
CCN(C)C(=O)c1cccc(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)c1	729300019	JGLWFPZMRPDJJW-UHFFFAOYSA-N	438.893	1.154	50	20	IDGD	
N#Cc1c(F)cccc1Oc1ccc(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)cc1	730213516	NORNHSVDYZMHQC-CYBMUJFWSA-N	432.433	1.621	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)c1ccc2c(c1)C(=O)N(C[C@@H]1CCCO1)C2=O	730780642	QHCBIHLEFCMULT-AWEZNQCLSA-N	439.424	1.007	50	20	IDGD	
CCOc1ccc(N2C(=O)/C(=C/NNC(=O)C(=O)NC(C)C)c3ccccc3C2=O)cc1	730982240	NDAVUQBDBPSUIR-CPNJWEJPSA-N	436.468	1.759	50	20	IDGD	
Cc1nn(C)c(C)c1S(=O)(=O)NNC(=O)c1nc(Cl)c(Cl)c(N)c1Cl	731053880	ZPFKQXBROGWBKK-UHFFFAOYSA-N	427.701	1.598	50	20	IDGD	
O=C(CN(Cc1ccco1)c1cccc(Cl)c1)NNC(=O)N[C@H]1CCS(=O)(=O)C1	732061408	HFUKDWSVDPYYHY-AWEZNQCLSA-N	440.909	1.457	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2c[nH]nc2C)cc1S(=O)(=O)N[C@H]1CCCC[C@@H]1C	732084081	KDHPWMSYUUFLEZ-LRDDRELGSA-N	449.533	1.659	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)NCc1cccnc1N1CCC(C(N)=O)CC1)c1ccccc1	732246079	MDMLALFPRMRZJX-LJQANCHMSA-N	438.532	1.808	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CCN2C[C@H](C)O[C@H](C)C2)c1I	732264213	REOLVSUUJRIWDL-BETUJISGSA-N	445.301	1.860	50	20	IDGD	
C[C@H](CSc1ccccc1)C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	732390766	GNEPUVRQGRFTMO-RDTXWAMCSA-N	430.482	1.945	50	20	IDGD	
COc1ccc(-n2c(C)cc(/C=C(\C#N)C(=O)c3c(N)n(C)c(=O)n(C)c3=O)c2C)cc1	732578342	LBYFKZJAAJFPTL-LFIBNONCSA-N	433.468	1.872	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)c1nn(-c2ccc(F)cc2)c2c1CCC2	734239620	GJJTZIIDXYRMEM-UHFFFAOYSA-N	446.483	1.969	50	20	IDGD	
CCOc1ccc(C(=O)NNS(=O)(=O)c2ccc(CS(C)(=O)=O)cc2)cc1OC	734806532	DMVNQSUTBXGCBE-UHFFFAOYSA-N	442.515	1.262	50	20	IDGD	
CC[C@H](Cc1cccc(Br)c1)C(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1	735271381	BKXOVGYVKSKUIG-OCCSQVGLSA-N	432.340	1.535	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2cc3c(s2)CC[C@@H](C)C3)nc2c1c(=O)n(C)c(=O)n2C	737767529	FDIHQRKQPACEEQ-SNVBAGLBSA-N	441.513	1.202	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)c1ccc(C)cc1)C(=O)NNc1ncnc2[nH]cnc12	740746408	ALSDHSAIOVVHPP-ZDUSSCGKSA-N	435.535	1.205	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)/C(C#N)=C/c1cc(C)n(C[C@H]2CCCO2)c1C	740852833	KTHJIWKSQSTPJZ-GTENMVSRSA-N	429.521	1.643	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)C1CCN(c2ccc(C(F)(F)F)cn2)CC1	740853156	VQMDPXMHPAAEMF-UHFFFAOYSA-N	429.443	1.769	50	20	IDGD	
O=C(NCc1nnnn1C1CC1)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1	743574757	XNTANHOGDGJKLB-FQEVSTJZSA-N	446.515	1.466	50	20	IDGD	
CS(=O)(=O)CC[C@@H](NC(=O)c1ccc(Cl)cc1)C(=O)NNC(=O)NC1CCCC1	744059562	TXOUKEDKZGXCTO-OAHLLOKOSA-N	444.941	1.146	50	20	IDGD	
COc1cc(/C=C/C(=O)NNC(=O)C(=O)NC(C)C)ccc1OCc1c(C)noc1C	744446660	HNQVCVLCRLDWSU-VQHVLOKHSA-N	430.461	1.564	50	20	IDGD	
O=C(Cc1ccc(OC(F)F)cc1)NNc1ccccc1S(=O)(=O)N1CCOCC1	744622123	NATOPLUUNSOBLS-UHFFFAOYSA-N	441.456	1.995	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)c2sccc2S(=O)(=O)N2CCCC[C@@H]2CCO)n1	745491385	MRSKOJLTWGSUMK-CQSZACIVSA-N	439.563	1.837	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)NCC(=O)N2CCN(c3ccccc3)CC2)cc1	745793611	YPXYYSIWCMCAJK-UHFFFAOYSA-N	439.520	1.437	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(Br)nc2)cc1OC	747001683	MEMMQXAGINGFCQ-UHFFFAOYSA-N	438.234	1.479	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNS(=O)(=O)c2ccc(F)c(C(=O)OC)c2)cc1	747596945	SNVPRWXSXJEEQA-GFCCVEGCSA-N	440.449	1.788	50	20	IDGD	
CC(C)CS(=O)(=O)CC(=O)NNc1ccc(S(=O)(=O)Nc2nccs2)cc1	747943099	NWDHOXANXXZRBR-UHFFFAOYSA-N	432.549	1.458	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(OCC(=O)NNC(=O)c2cc(F)ccc2Br)C1	748538142	LIRLVRGJQGXRTQ-UHFFFAOYSA-N	446.273	1.985	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)NCc1nnc2c(Cl)cc(C(F)(F)F)cn12	748616100	MMOJKUFUXUIHPG-MRVPVSSYSA-N	438.794	1.283	50	20	IDGD	
COc1ccc(OC)c(CC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1	751200391	NNVAEOGDVWKZBL-UHFFFAOYSA-N	447.513	1.492	50	20	IDGD	
COC(=O)c1cc2c(cc1NC(=O)C(=O)NNC(=O)CCCc1ccccc1)OCO2	753841869	VCSMZZKDVXRBBL-UHFFFAOYSA-N	427.413	1.311	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2ccc(NC(=O)NNC(=O)c3ccccc3O)cc2)C[C@H](C)O1	755423045	NOSTVJLJXYDGSG-KBPBESRZSA-N	448.501	1.657	50	20	IDGD	
COC(=O)CNC(=O)c1ccc(NC(=O)NNC(=O)c2cccc(Br)c2)cc1	755548344	QJHITLVLGIWPCE-UHFFFAOYSA-N	449.261	1.818	50	20	IDGD	
C[C@H]1Oc2ccc(NC(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)cc2NC1=O	755559608	VGKLZNHGAYLODK-LLVKDONJSA-N	447.473	1.123	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)cc1-n1cnnn1	755676578	BMRYWDSELACHST-UHFFFAOYSA-N	447.459	1.728	50	20	IDGD	
CCOC(=O)c1cnn(-c2cccc(NC(=O)NNC(=O)COC)c2)c1C(F)(F)F	755909115	LSWRPAFDAHPOHZ-UHFFFAOYSA-N	429.355	1.867	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)Nc1cccc(C[S@@](=O)Cc2ccccc2)c1	756595834	ZEOTTWHXMRQPLD-JWRCQZCYSA-N	449.554	1.723	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)CCN1c2ccccc2Sc2ccccc21	758053979	MVKNCJIDVLIAMS-ZDUSSCGKSA-N	434.543	1.765	50	20	IDGD	
Cc1ccc(-n2nc(C(=O)N3CCN(S(=O)(=O)CBr)CC3)cc2C)cc1	758512440	LSFFGUKJSRDIDT-UHFFFAOYSA-N	441.351	1.929	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN1C(=O)c1ccc2ccccc2c1O)C(=O)Nc1ccccn1	759098439	GKTDGYVOYFRCQU-KRWDZBQOSA-N	447.451	1.331	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)NCc1ccc(S(C)(=O)=O)c(Cl)c1	759282494	JQFFKQLLUANTCH-UHFFFAOYSA-N	425.894	1.825	50	20	IDGD	
CO[C@@](C)(C(=O)NNC(=O)CN1CCN(Cc2ccc(C)cc2)CC1)c1ccccc1F	760447837	HYASSRSNGQSJRX-XMMPIXPASA-N	442.535	1.961	50	20	IDGD	
Cn1ccc([C@H](NC(=O)NNC(=O)CNC(=O)c2cccs2)c2ccc(Cl)cc2)n1	762571047	JVGIJAMDCXAGQY-QGZVFWFLSA-N	446.920	1.985	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)c2ccc(OC)c(S(=O)(=O)NC(C)C)c2)n1	762915882	LKCCERMVXQUNSY-UHFFFAOYSA-N	436.538	1.775	50	20	IDGD	
C[C@H](O)c1cn(CC(=O)NNC(=O)COc2ccc(OCc3ccccc3)cc2)nn1	763013550	QOCGWNLYUYHOHY-HNNXBMFYSA-N	425.445	1.137	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)NCCCN1C(=O)NC2(CCCC2)C1=O	763460479	KPIXFYABMQZOLK-UHFFFAOYSA-N	435.506	1.069	50	20	IDGD	
O=C(NNC(=O)c1ccc2ccccc2n1)C(=O)Nc1ccccc1CN1C(=O)CCC1=O	763466924	PJJYKZJONXXVKX-UHFFFAOYSA-N	445.435	1.284	50	20	IDGD	
CCOCCOCc1cccc(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1	763574254	YAFGJSOHVZADTP-IBGZPJMESA-N	443.456	1.166	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)[nH]n1)C(=O)Nc1cccc(Cn2cncn2)c1	763614086	QFSRLSHKTOIUKB-UHFFFAOYSA-N	430.428	1.116	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(-c2nnc(C)o2)cc1	763683955	DQMAETLMRWVTPR-UHFFFAOYSA-N	439.428	1.609	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(-n3cccn3)c(Cl)c2)c1	763759784	BIVJWBQODPQOMS-UHFFFAOYSA-N	426.864	1.991	50	20	IDGD	
CCC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2nn(CC)c(=O)c3ccccc23)c1	763786955	SMXXBVKAQASYOJ-UHFFFAOYSA-N	435.440	1.409	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(-c3nnco3)ccc2C)cc1OC	763901854	KHPFOVYSQRHXDW-UHFFFAOYSA-N	439.428	1.852	50	20	IDGD	
O=C(Cc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1ccc(-n2cncn2)c(Cl)c1	763937034	ULGMLATYRJYRNG-UHFFFAOYSA-N	433.255	1.903	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Br)s2)c(OC)c1	763942153	WECADNPAHFAPKK-UHFFFAOYSA-N	428.264	1.928	50	20	IDGD	
CCC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc1	763944539	MVNZZXLURJECQF-UHFFFAOYSA-N	436.428	1.326	50	20	IDGD	
C[C@H]1Oc2ccc(NC(=O)C(=O)NNC(=O)c3cc(-c4ccccc4)on3)cc2NC1=O	764016105	GTNBSIDBKKMLIY-LLVKDONJSA-N	435.396	1.461	50	20	IDGD	
O=C(NNC(=O)c1cccc(C(F)(F)F)c1)C(=O)Nc1ccc(-n2cncn2)c(F)c1	764038059	ZEIWBTZECPGWEH-UHFFFAOYSA-N	436.325	1.825	50	20	IDGD	
Cc1cc(=O)c(C(=O)NNC(=O)CSc2ccccc2O)nn1-c1ccccc1F	764045162	CZGXLRBCLFFTDN-UHFFFAOYSA-N	428.445	1.939	50	20	IDGD	
CCCc1c(NC(=O)C(=O)NNC(=O)c2ccc(Cl)nc2)cnn1-c1cc(C)ccn1	764100218	XWGAVRPVIUMHGB-UHFFFAOYSA-N	441.879	1.976	50	20	IDGD	
CCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(CN(CC)CC)o2)cc1	764138277	FYZREUGUPWLMQE-UHFFFAOYSA-N	429.477	1.271	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)c2c(Cl)cccc2Cl)cn1	764221150	LAIWYIILIPOSGQ-UHFFFAOYSA-N	427.244	1.813	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)C(=O)Nc2cccc(C(=O)NCc3ccccc3)c2)c1	764236049	VCQWQCZJDPVFFG-UHFFFAOYSA-N	441.447	1.888	50	20	IDGD	
CS(=O)(=O)c1c(Cl)cccc1NC(=O)C(=O)NNC(=O)Cc1ccccc1F	764318524	AHOXYBSOIUVJJT-UHFFFAOYSA-N	427.841	1.211	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C(=O)Nc1cccc2c1CCN2S(C)(=O)=O)c1ccccc1	764331809	HTSGBOXJUTXBAL-HNNXBMFYSA-N	444.513	1.288	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ccc(C)o2)c(Br)cc1F	764368377	UYNYGMTZXQWUPV-UHFFFAOYSA-N	442.197	1.676	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)C(=O)Nc1cc(Cl)ccc1N1CCSCC1	764388165	BCBPPJFIMCFBJQ-UHFFFAOYSA-N	433.921	1.996	50	20	IDGD	
O=C(NNC(=O)[C@H]1COCCO1)C(=O)Nc1ccccc1SC[C@@H]1CC1(Cl)Cl	764430046	RDCSPSKPGBUPMZ-CMPLNLGQSA-N	448.328	1.474	50	20	IDGD	
Cc1ncc(CO)c(C=NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)c1O	764829123	VGQQFGXFNWJGHL-UHFFFAOYSA-N	431.924	1.509	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)N[C@H]1CCO[C@H](c2ccccc2)C1	765192132	FIBJGKVTWQMJSB-RDJZCZTQSA-N	431.518	1.844	50	20	IDGD	
O=C(NNC(=O)c1cnn2ncccc12)c1ccccc1NS(=O)(=O)c1cccs1	765973521	DUXXQMNVVPYGIZ-UHFFFAOYSA-N	442.482	1.666	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)CN1CCC(C(=O)NCCc2cccs2)CC1	766864045	MANVXLCZYFDZOT-UHFFFAOYSA-N	442.585	1.817	50	20	IDGD	
Cc1ccn(CC(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)c(=O)c1	770822790	JDSBGIVXVNGVNC-UHFFFAOYSA-N	446.510	1.480	50	20	IDGD	
Cc1cc2c(N3CCC[C@@H]3C(=O)NNC(=O)CCN3C[C@@H](C)O[C@H](C)C3)ncnc2s1	770949212	CCXJDGAHOFATAL-CKEIUWERSA-N	446.577	1.615	50	20	IDGD	
C[C@@H](CS(=O)(=O)c1ccc(F)cc1)C(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	770949729	GBMLFGYXLOWYLO-ZDUSSCGKSA-N	446.460	1.588	50	20	IDGD	
COc1ccccc1C(=O)N[C@H](CCS(C)(=O)=O)C(=O)NNc1nccnc1C(C)C	772871244	STDZWTVBIYNCRC-OAHLLOKOSA-N	449.533	1.285	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)OCc2ccnn2C)cc1	773473772	ORXPLUDIRLVXRB-LFIBNONCSA-N	434.456	1.818	50	20	IDGD	
O=C(NNc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(CN2C(=O)CCCC2=O)cc1	773644482	OPPOUSPVRKURPH-UHFFFAOYSA-N	425.401	1.716	50	20	IDGD	
Cc1ccc(C(=O)N2CCOCC2)cc1NC(=O)C(=O)NNc1ccc([N+](=O)[O-])cc1	773656532	NTOJUEDIRJDOHF-UHFFFAOYSA-N	427.417	1.457	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(C)c(F)c2)cc1C	773889062	JBMQCFXPXIIRQF-UHFFFAOYSA-N	436.465	1.604	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cccn(Cc3ccc(F)cc3)c2=O)cc1F	773890732	SPMIXXKZJMTTBL-UHFFFAOYSA-N	440.406	1.883	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)N2CCN(S(C)(=O)=O)[C@@H](C)C2)c(C)n1C[C@@H]1CCCO1	776438336	AIXYHOCIMDZLAR-PFPSPWBBSA-N	434.562	1.683	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)nn1CCC#N	783409742	UWZAOAZQLJWLHF-UHFFFAOYSA-N	444.395	1.481	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2ccn(-c3ccc(Cl)cc3Cl)n2)CCS(=O)(=O)C1	783424905	GINORCVGMIUEOO-MRXNPFEDSA-N	446.316	1.316	50	20	IDGD	
O=C(NN=Cc1cn(Cc2cccnc2)nn1)c1ccc(S(=O)(=O)N2CCCC2)cc1	783804979	BJKIZBBGXBQCRO-UHFFFAOYSA-N	439.501	1.270	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2ccc(OCCNC(=O)OC(C)(C)C)cc2)ncn1	783948253	WCSZVQGROZYLCG-UHFFFAOYSA-N	430.465	1.770	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)CNC(=O)c2cccs2)c(C(F)(F)F)c1	784004120	BLAHQJJUEHIQKA-UHFFFAOYSA-N	444.391	1.291	50	20	IDGD	
CS(=O)(=O)c1c(F)cc(NC(=O)C(=O)NNc2ccc(Br)cn2)cc1F	784338789	GLPPWXFSCKHAEN-UHFFFAOYSA-N	449.233	1.608	50	20	IDGD	
O=C(NNc1nccnc1Cl)C(=O)Nc1ccc(-n2nccn2)cc1C(F)(F)F	784776553	LJNUDCWRTOHPSL-UHFFFAOYSA-N	426.746	1.811	50	20	IDGD	
CN1CCC/C1=N/S(=O)(=O)c1cccc(NC(=O)C(=O)NNc2ccc(F)cc2)c1	784782308	BYKZHEHVQGMJPM-ULJHMMPZSA-N	433.465	1.720	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)C[C@H](NC(=O)OC(C)(C)C)C2CC2)c2ccccc2c1=O	785014197	SJABQKVXXTVDSB-HNNXBMFYSA-N	429.477	1.388	50	20	IDGD	
COC[C@@H](C)Oc1ccc(Cl)cc1S(=O)(=O)NNC(=O)CNC(=O)c1ccco1	786724435	ZKMMFRSVNSXIHY-LLVKDONJSA-N	445.881	1.086	50	20	IDGD	
NS(=O)(=O)c1ccccc1NNC(=O)C1CCN(C(=O)/C=C/c2ccccc2)CC1	788228748	OYFFVTWAIBTBHG-ZHACJKMWSA-N	428.514	1.729	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1ccc(Cl)cc1-n1cccn1	788330757	KXRAIEJFAYGCIZ-UHFFFAOYSA-N	441.831	1.697	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)NNC(=O)[C@H]1OCC[C@H]1c1ccccc1	789843159	VEZDVHWTWOEGEL-RDJZCZTQSA-N	449.508	1.226	50	20	IDGD	
COC(=O)c1ccc(S(=O)(=O)NNC(=O)COc2ccccc2O)cc1C(F)(F)F	790184321	KBTCMSBANBQGET-UHFFFAOYSA-N	448.375	1.586	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])o1)[C@H]1OCC[C@H]1c1ccccc1	790319519	QKMDHSVXTJDNEC-DAYGRLMNSA-N	442.428	1.513	50	20	IDGD	
O=C(CS(=O)(=O)Nc1ccc(N2CCCCC2)cc1)NNc1nc2ccccn2n1	791260879	VRLZPYKQWPSUHN-UHFFFAOYSA-N	429.506	1.605	50	20	IDGD	
CCn1c(NNC(=O)c2sc(S(N)(=O)=O)c(C)c2Cl)nc2ccccc2c1=O	791311353	KDUWGWGVBVYOPW-UHFFFAOYSA-N	441.922	1.844	50	20	IDGD	
O=C(NNC(=O)c1cccc(NN2C(=O)[C@H]3CC=CC[C@H]3C2=O)c1)c1ccc([N+](=O)[O-])cc1	792762179	NZOBPQXGAXPQJC-HDICACEKSA-N	449.423	1.948	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)C(=O)Nc1cccc(Br)n1	793027425	XZGRMUPPFHTWSO-UHFFFAOYSA-N	425.264	1.428	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)nc1Br	793065940	DPDHANMGMOEPFE-ZFWWWQNUSA-N	447.289	1.811	50	20	IDGD	
CC(C)(C)OC(=O)N1CCOC[C@@H]1CC(=O)NNC(=O)c1nnc(O)c2ccccc12	794774516	HDGAFDSTMKXAQI-LBPRGKRZSA-N	431.449	1.122	50	20	IDGD	
COc1c(C)cc(C(C)=NNC(=O)CSc2nn(C)c(=O)n(C)c2=O)cc1Cl	794886328	IOGQKYXLKFFGCK-UHFFFAOYSA-N	425.898	1.082	50	20	IDGD	
Cc1nc(COc2ccc(C(=O)NNc3ccccc3S(=O)(=O)N(C)C)cc2)no1	795168213	JVYRJABWTLOZMV-UHFFFAOYSA-N	431.474	1.964	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CN2C(=O)N[C@@](C)(c3ccc4ccccc4c3)C2=O)n1	795667340	WFNPFLFQWJXXAZ-QHCPKHFHSA-N	431.452	1.771	50	20	IDGD	
C[C@@H]1CCN(C(=O)OC(C)(C)C)[C@H](C)[C@@H]1NCC(=O)NNC(=O)c1cccc(C#N)c1	796646381	AYBRUKDKAZBUHK-SPYBWZPUSA-N	429.521	1.943	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)c2nnn(CCOc3ccc(F)cc3)c2C)cc1	800688053	MMGPVZSPBNDZRC-UHFFFAOYSA-N	442.451	1.686	50	20	IDGD	
CCS(=O)(=O)N1CCC[C@H](C(=O)NNC(=O)Nc2ccc(Br)cc2)C1	801996392	DHSZAYBGAWFPBW-NSHDSACASA-N	433.328	1.664	50	20	IDGD	
NS(=O)(=O)c1ccc(C(=O)NNC(=O)Nc2ccc(Br)cc2)c(F)c1	801996892	QEMOIAFGJXRQEM-UHFFFAOYSA-N	431.243	1.702	50	20	IDGD	
CC(=O)N[C@](C)(C(=O)NNc1ccc([N+](=O)[O-])cc1C)c1ccc(S(C)(=O)=O)cc1	805379103	YDSWEXHSVLNCRI-IBGZPJMESA-N	434.474	1.801	50	20	IDGD	
CCN(C)C(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2cccc(Br)c2)c1	806976470	QNJIBXDLFGHZMK-UHFFFAOYSA-N	447.289	1.941	50	20	IDGD	
CCC(C)(C)[C@@H]1CCc2nc(NC(=O)C(=O)NN[C@]3(C)CCS(=O)(=O)C3)sc2C1	807001175	RTALZCIMVLHHJF-CWTRNNRKSA-N	442.607	1.821	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)C(=O)Nc1nc(Cc2ccccc2)cs1	807020503	YRUNSHRWCMBMMR-UHFFFAOYSA-N	434.481	1.710	50	20	IDGD	
CCC(CC)NC(=O)[C@@H]1CN(C(=O)C(=O)NNc2cccc(F)n2)c2ccccc2O1	807393027	STPTWZJZWYZSOX-INIZCTEOSA-N	429.452	1.763	50	20	IDGD	
COc1nnccc1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	808902559	WUMLZLAGWJGENB-UHFFFAOYSA-N	434.478	1.126	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2nc3cc(Cl)ccn3n2)c2ccccc2c1=O	810249664	GSLDSPDTCROHQV-UHFFFAOYSA-N	426.824	1.579	50	20	IDGD	
Cc1onc(N)c1S(=O)(=O)NC(=O)/C(C#N)=C/c1cc(C)n(C[C@H]2CCCO2)c1C	810828356	QBJYLGOYPRUJON-WPBGYSLVSA-N	433.490	1.575	50	20	IDGD	
CC(=NNC(=O)CCN1CCN(c2ccccc2)CC1)c1ccc2[nH]c(=O)c(=O)[nH]c2c1	811630196	WBQGQYXFDHNOOQ-UHFFFAOYSA-N	434.500	1.269	50	20	IDGD	
CC(CCN1C(=O)c2ccccc2C1=O)=NNC(=O)Nc1ccc(S(N)(=O)=O)cc1	814965017	FHNLBZJYBCYZRJ-UHFFFAOYSA-N	429.458	1.518	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)CCCc2ccccc2)nnn1Cc1ccccc1F	815569431	SZBOEFMLUPTQJA-UHFFFAOYSA-N	438.463	1.883	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNc2cc(Cl)ccn2)nnn1CCOc1ccc(F)cc1	815602122	OTYWDMMSHLECNG-UHFFFAOYSA-N	433.831	1.935	50	20	IDGD	
Cc1cc(Cn2nnc(C(=O)NNc3c(F)cc(C(=O)NC4CC4)cc3F)c2C)on1	815856998	KWRVXESPJUNWGV-UHFFFAOYSA-N	431.403	1.859	50	20	IDGD	
CCC[C@@H](C(=O)OCC)S(=O)(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12	821127271	FUKOXENLPZZJLV-HNNXBMFYSA-N	438.506	1.273	50	20	IDGD	
O=C(NNc1ccc(F)cc1)c1cc(O)nc2ccc(S(=O)(=O)N3CCOCC3)cc12	912711000	IIGKXHZEZUVJQX-UHFFFAOYSA-N	446.460	1.857	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1ccccc1	915903820	GVYQJNADFKBAJU-MRXNPFEDSA-N	446.529	1.455	50	20	IDGD	
CCCn1nc(C(=O)NN=C(C)c2cccc(S(=O)(=O)NC)c2)c2ccccc2c1=O	915946294	FLLRRWYBCPHPTP-UHFFFAOYSA-N	441.513	1.869	50	20	IDGD	
CCn1c(O)nc2cc(C(=O)NNC(=O)c3ccc(OC(C)C)c(OC)c3)ccc2c1=O	916746690	YKCKKUPVNLLLPS-UHFFFAOYSA-N	440.456	1.993	50	20	IDGD	
COc1ccc([C@H]2CCCN2C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c(OC)c1	918779251	JADKFPPKMPXYSR-GOSISDBHSA-N	437.460	1.871	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)c2cc(C)c(C)c(S(=O)(=O)N(C)C)c2)cc1	919834147	PAWMPQXLHWEKBU-UHFFFAOYSA-N	433.530	1.956	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)NC[C@@H]1CCN(c2ccc(F)cc2)C1	920048819	POJBPCUFKMPNFY-AWEZNQCLSA-N	431.424	1.970	50	20	IDGD	
O=C(CCNS(=O)(=O)c1c(Cl)cccc1Cl)NNC(=O)NCc1ccco1	920889670	GYJFRTBGAKFNOH-UHFFFAOYSA-N	435.289	1.785	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)c1ccc2c(c1)C[C@H](C)N2S(C)(=O)=O	921234810	XUNXBUKJCDWXNB-AWEZNQCLSA-N	447.513	1.636	50	20	IDGD	
N#C/C(=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)N1C[C@@H]2C[C@]2(CO)C1	1116724618	YSCYQCHZZNTGLL-MFIDECFBSA-N	439.903	1.827	50	20	IDGD	
Cc1csc(CCCNC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)n1	1251514626	WFSKTFHPOQKETB-UHFFFAOYSA-N	430.578	1.927	50	20	IDGD	
CC(=O)N1CCC(CNC(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)CC1	1318314290	ANZOFKBLDYIWJL-UHFFFAOYSA-N	428.493	1.180	50	20	IDGD	
Nc1cnnc(NNC(=O)C2CCN(S(=O)(=O)c3ccc(F)c(F)c3)CC2)c1Cl	1319218552	FTFNJZUFJUYCQJ-UHFFFAOYSA-N	446.867	1.534	50	20	IDGD	
CC(C)NC(=S)NNC(=O)CN1CCN(Cc2ccc(Br)cc2F)CC1	1322212287	YWMFQFGQDKWTOU-UHFFFAOYSA-N	446.390	1.610	50	20	IDGD	
CN(C)Cc1cc(C(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)no1	1323346017	PXKDJPGQILAXNA-UHFFFAOYSA-N	449.514	1.673	50	20	IDGD	
Cc1ccc(C)c(NC(=S)NNC(=O)c2ccc(S(=O)(=O)NC[C@@H](C)O)cc2)c1	1335650749	OYKUEWFJJOWBOQ-CQSZACIVSA-N	436.559	1.594	50	20	IDGD	
Cn1c(=NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)sc2ccccc21	1337255109	QYZDPFYEKWMIKX-UHFFFAOYSA-N	432.527	1.506	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2[nH]nc3ncccc23)C1	1777913132	QBFFZPFHQLLSDW-IIBYNOLFSA-N	445.596	1.937	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Cl)C2)c1ccc2c(n1)OCCO2	1777953081	GGFHBLZLVXJWGL-ZRGWGRIASA-N	427.860	1.515	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)Cc3ccc4c(c3)CCCO4)C2)C1	1778270091	NRLVNZSIBBYWHM-AVRDEDQJSA-N	436.936	1.638	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4nncn4c3)C2)C1	1778596995	VILHOIFLIQDNPF-QZTJIDSGSA-N	426.304	1.409	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(CCN(C(=O)CS[C@@H]3CCCCO3)C2)C1	1779084553	QGSCZNXKXQYBGW-MOPGFXCFSA-N	430.643	1.928	50	20	IDGD	
O=C(c1nnc(-c2ccccc2)o1)N1CC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1779117346	ZFLUSVJNOXKDEQ-SFHVURJKSA-N	425.272	1.984	50	20	IDGD	
Cn1ccc2c(O)ncc(C(=O)N3CC[C@@]4(C3)CN(C(=O)C(C)(C)CCl)CCO4)c21	1779979498	XBXQRDRNHMSPIP-OAQYLSRUSA-N	434.924	1.987	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCc1cnccn1)C2)[C@@H](F)Br	1780776685	DNIRUGUAXJJXIP-QGPMSJSTSA-N	443.317	1.614	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)COC(=O)C(F)(F)F)CCO2)C1	1781230086	MVJXFAONHAAOGX-KGLIPLIRSA-N	435.226	1.158	50	20	IDGD	
COc1ccc([C@H](O)C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)cc1	1781325822	RSJWMKUAWWHTIT-DAYGRLMNSA-N	445.285	1.249	50	20	IDGD	
COc1cccc(CC(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](F)Br)C3)C2)c1	1781328427	PTUHKXSULBZVGE-WMZOPIPTSA-N	429.286	1.758	50	20	IDGD	
O=C(c1ccc2cnccc2n1)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781329952	ONHFWIAUGLDFML-QAPCUYQASA-N	437.269	1.764	50	20	IDGD	
CC(C)Cc1ccc(C(=O)N2CC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)cc1	1781920201	QOURAJURNNETHR-XMMPIXPASA-N	444.576	1.702	50	20	IDGD	
O=C1Cc2cccc(C(=O)N3CC[C@@]4(C3)CN(C(=O)[C@@H](F)Br)CCO4)c2N1	1782411379	DXSOYALUALMJMG-CRAIPNDOSA-N	440.269	1.315	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cnn4ncccc34)CCO2)C1	1783347605	MUZBYBGQJQUDCR-RDTXWAMCSA-N	436.310	1.346	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN3CCSCC3)[C@H]2C1	1783499074	JLQHBMNQVNIXPV-JONQDZQNSA-N	448.427	1.188	50	20	IDGD	
O=C(COc1cccc(Cl)c1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21	1783803029	GNXZNHAITVHJDE-STECZYCISA-N	431.316	1.298	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)Cn3ccc4c(F)cccc43)CCO2)C1	1783870670	FHYMZKNDACQSFP-HRAATJIYSA-N	437.899	1.864	50	20	IDGD	
C[C@H](C(=O)N1CCO[C@]2(CCN(C(=O)C(Cl)Cl)C2)C1)[S@@](=O)c1ccccc1	1783949499	KRLPDUDDDCHFEQ-SXBFAZIISA-N	433.357	1.816	50	20	IDGD	
CC(C)(C)OC(=O)N1C(=O)CC[C@@H]1C(=O)N1CC[C@]2(CN(C(=O)[C@H](F)Cl)CCO2)C1	1784192996	ULZIEGNCRJQTTI-SPKLELGKSA-N	447.891	1.277	50	20	IDGD	
O=C(c1ccc(F)cc1C(F)(F)F)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1785203240	LMOXMUBWEYYSET-YOEHRIQHSA-N	438.805	1.888	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(N4C(=O)C=CC4=O)cc3)C2)C1	1785222385	BBBFINOGHQDMSQ-HTAPYJJXSA-N	445.903	1.577	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ncc(Cl)cn3)[C@H]2C1	1785821933	XUFCUUPUGZGYDT-PYJNHQTQSA-N	445.745	1.897	50	20	IDGD	
C[C@@H](Nc1nccs1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21	1787486287	DOYSLCAFTKVFPL-MOLYVOAJSA-N	449.346	1.614	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)c1cnc2ncccn12	1788005524	RTAGZMUNWCGVJR-IMIFBBOLSA-N	440.273	1.013	50	20	IDGD	
Cc1cc(CC(=O)NC2(c3ccc(NC(=O)c4cccc(B(O)O)c4)cc3)CCC2)nn1C	1788145248	VOITVFKVEYEYEN-UHFFFAOYSA-N	446.316	1.399	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)c1c(F)cncc1F	1789007187	LNAIIOMQHFYOLN-COPCRZHJSA-N	436.228	1.644	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1ccc(C2(NC(=O)c3cc(=O)cco3)CCC2)cc1	1789522372	CHWTVOLTNUKACN-UHFFFAOYSA-N	447.451	1.700	50	20	IDGD	
Cn1ccc(=O)cc1C(=O)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1	1790049477	WOEBJMYYIVFLFC-UHFFFAOYSA-N	445.284	1.127	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc[nH]n3)C[C@@H]21	1790694183	ZWIBIRPTSGXMFY-GOFCJJFNSA-N	441.438	1.888	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3ccc4c(c3)CCO4)[C@H]2C1	1791005015	MIHRPOFIXLIZLD-JPLJXNOCSA-N	436.936	1.398	50	20	IDGD	
CN(C)[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](O)CCl)c1ccccc1Cl	1792983463	IOQYRWLYYLIRNA-WIZAYZPVSA-N	444.359	1.132	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H]1C[C@@H](O)C1)C2	1794141938	DTTPCVOHXNMUIP-KLOLGFOXSA-N	429.945	1.528	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2)c1cccc(OCC(F)(F)F)n1	1794335336	DCTDOSYYWVVTIH-RDBQEKCUSA-N	439.793	1.760	50	20	IDGD	
C[C@H](Nc1cccnc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@](C)(Cl)CCl)C2	1795605663	JOSWZMUASBRAQD-WXZWTWHISA-N	429.348	1.708	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cn1cccn1	1796308319	JPEHQHRDBSBNDO-MUJYYYPQSA-N	441.444	1.669	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccco1)C2	1798522583	AVODUYCOTPHSCJ-HBCWATKFSA-N	443.412	1.630	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(C)(C)Oc1ccc(C)cn1	1799095086	WVSREPOZVTXUFE-DFGXFYAUSA-N	439.940	1.391	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1(CNC(=O)OC(C)(C)C)CC1)C2	1799264699	NMNBKRGMYVABRG-QKPAOTATSA-N	443.972	1.898	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc3sc(C)cn3c1=O)C2	1799268308	UFVBGFGOUFSRGQ-AYRXBEOTSA-N	438.937	1.285	50	20	IDGD	
C/C=C(\C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN(C)NC(=O)NCc1ccccc1	1799869465	PZDLSCMRHYAYSS-LDDVZMJFSA-N	427.549	1.937	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc(Cl)nc1)C2	1800637810	IHDZKHVMYIFISA-YVECIDJPSA-N	431.718	1.507	50	20	IDGD	
COc1cccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)Br)n1	1800757331	PFMRSTMBSZLGGH-KOFHJDLBSA-N	426.311	1.006	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)Br)o1	1800759010	CVAXIOHCKZJUMT-BTABJRDXSA-N	428.283	1.225	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnn3cccc(F)c13)C2	1800761979	LHKKYEITOZRNCP-MCYUEQNJSA-N	439.285	1.460	50	20	IDGD	
C[C@H](S)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1800981695	ZLGVUHFLBHNACG-HPCHECBXSA-N	435.974	1.026	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1CCN(C(=O)OCC)CC1	1801987450	CETDMPYGANSUPQ-MHORFTMASA-N	443.972	1.852	50	20	IDGD	
CN1CCN(CC(=O)N2CC[C@@H](CNC(=O)C(C)(C)CCl)[C@H]2c2cccnc2)CC1	1802900571	BIVBGCIYXQYATR-AZUAARDMSA-N	436.000	1.600	50	20	IDGD	
COc1ccccc1CC(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1	1803148226	PJUDCZLOMKFQKS-LQWHRVPQSA-N	431.920	1.938	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)[C@@H]2C[C@@H]2F)[C@H]1c1cccnc1	1803972424	WAGNJVIXONUZGJ-RXDWQSTPSA-N	440.479	1.579	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)[C@](C)(O)C(F)(F)F)[C@@H]1c1cccnc1	1803998603	QFEAZERUSDXGTR-FHIRATQRSA-N	437.846	1.655	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC2(CCN(C(=O)c3cnc(O)nc3O)CC2)C1	1805383108	CQNIBQKHUYCRNL-GFCCVEGCSA-N	441.326	1.764	50	20	IDGD	
O=C(c1ccc(OCCCO)cc1)N1CCC2(CCCN(C(=O)[C@H](O)CCl)C2)CC1	1805523452	VTXHXOJPCFQRPK-LJQANCHMSA-N	438.952	1.892	50	20	IDGD	
COCCOCC(=O)NC[C@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1	1806757861	VYXWCLWYDNAODL-CRAIPNDOSA-N	428.327	1.535	50	20	IDGD	
C=CCC(CC=C)C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1807365416	OWFFIWAKVGTNSN-GGAORHGYSA-N	447.344	1.849	50	20	IDGD	
CN1CCCn2nc(C(=O)N3CC[C@H](CNC(=O)[C@@H](F)Cl)[C@@H]3c3cccnc3)cc2C1	1808322954	ZIVAQLDZFXJHDA-AYOQOUSVSA-N	448.930	1.968	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)Cc2cncnc2)[C@H]1c1cccnc1)[C@@H](F)Br	1808651395	KVVFBRLXHQPNNS-BHYGNILZSA-N	436.285	1.811	50	20	IDGD	
CCOC(=O)/C=C/C(=O)N1CC[C@H](CNC(=O)[C@@H](F)Br)[C@H]1c1cccnc1	1808662375	YXQBBJNAUMQYGC-IEXJJUNUSA-N	442.285	1.897	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)c1cc2ccccn2n1	1809053006	FUMQITXLZQJFAI-ZYSHUDEJSA-N	427.892	1.649	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)c3ccc(Cl)cn3)CC2)C1	1809970913	DKKBZEJRKNSIAM-UHFFFAOYSA-N	441.724	1.573	50	20	IDGD	
C[C@H](C(=O)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1)c1ccccn1	1809972867	SYAKYTIHUWKPRS-SFHVURJKSA-N	435.333	1.410	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@@H]1c1cccnc1)c1cnc(O)[nH]1	1810949957	GSKHOQHHXLVEHB-UHTWSYAYSA-N	426.246	1.520	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)CCc2cncnc2)[C@H]1c1cccnc1	1813030767	KZCWDUGFOQYPDM-BJLQDIEVSA-N	431.924	1.764	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)C(Cl)Cl)[C@H]1c1cccnc1	1813073957	MOWPDNHTKDOSRF-BBRMVZONSA-N	430.336	1.264	50	20	IDGD	
Cc1ccc(CC(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2cccc(B(O)O)c2)CC3)cc1	1813978617	MNVFFVUCTNWANR-GOSISDBHSA-N	449.341	1.600	50	20	IDGD	
Cc1cccc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)n1	1815355589	WUOPYLURBHHBNZ-OAHLLOKOSA-N	436.302	1.066	50	20	IDGD	
O=C(Cc1cscn1)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1817546033	JNHDJWMJIYTCCZ-KRWDZBQOSA-N	439.306	1.095	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCBr)CC2	1819684621	JDLAICIOKQJAPX-ZJUUUORDSA-N	446.371	1.548	50	20	IDGD	
Cn1ccc2c(O)ncc(C(=O)Nc3nc4c(s3)C[C@H](NC(=O)[C@H](O)CCl)CC4)c21	1821175561	IQVZTQPSOOCCFK-NOZJJQNGSA-N	449.920	1.561	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)n(C)n1	1822412663	CBZNLKLVDYQJJC-HNNXBMFYSA-N	430.513	1.131	50	20	IDGD	
Cc1cccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)n1	1822412721	GRJBAMUTPIZHOY-KRWDZBQOSA-N	427.509	1.792	50	20	IDGD	
COc1ccc([C@H](O)C(=O)N2CCCC[C@@H]2C2CCN(C(=O)[C@@H](O)CCl)CC2)cc1	1823948784	CSWBQYAFRRIMSR-AABGKKOBSA-N	438.952	1.948	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H]2CCC(=O)N2)CC1	1824094674	XUWGCYFLWBBGRZ-CWRNSKLLSA-N	428.371	1.916	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H]1CCC(=O)NC1)CC2	1825440289	OCQAHBKUQYEJQX-AXFHLTTASA-N	443.367	1.755	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc[n+]([O-])cc1)CC2	1825641027	HKTBBXAGVFJBSW-KOLCDFICSA-N	425.308	1.786	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)c2nccs2)CC1	1826111090	YRZQLWWJUNPFEG-SFHVURJKSA-N	427.335	1.370	50	20	IDGD	
O=C(c1ccc(O)nc1)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827052507	LZIBJDGUODFYTL-HXUWFJFHSA-N	437.305	1.014	50	20	IDGD	
CN1CCN(CC(=O)N2CCC([C@H]3CCCCN3C(=O)CO[Si](C)(C)C)CC2)CC1	1829103001	UUMBAOPANMJHBK-HXUWFJFHSA-N	438.689	1.705	50	20	IDGD	
COC(=O)[C@@H]1CC[C@@H](C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)C1	1830353614	GOKILIYJHXAYQI-ZOCZFRKYSA-N	444.956	1.297	50	20	IDGD	
C[C@H](Cc1ccccn1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830370294	POIUASYVMXYFET-VGSWGCGISA-N	437.968	1.982	50	20	IDGD	
Cc1ncsc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)CBr)CCO2	1830537803	PAUKERKNWJOZJB-PXAZEXFGSA-N	446.367	1.553	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)COc3ccc(O)cc3)C2)C1	1831639119	MHWJEATVGJNZSY-NQIIRXRSSA-N	440.924	1.635	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4n(n3)CCCC4)C2)C1	1831650216	FQCMRZNRRQGONE-LAUBAEHRSA-N	438.956	1.697	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cn4cccnc4n3)C2)C1	1831650483	IDLHZOPMMJJVCC-QRWLVFNGSA-N	435.912	1.207	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(F)(F)C(F)F)CCO2	1832193641	SQXWBKWBGNJKMY-ZANVPECISA-N	435.212	1.127	50	20	IDGD	
O=C(/C=C/c1ccco1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1833078822	XXWWHADYKXMEKY-PIXXYMSQSA-N	431.258	1.440	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](C)n3ccnc3)CC2)CC1	1833378883	WLPJVTHJVHTIQR-CRAIPNDOSA-N	425.961	1.270	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)c3ccc(F)c(F)c3)C2)C1	1834823819	MAYOMCPPRGRVLN-GOSISDBHSA-N	447.276	1.820	50	20	IDGD	
CC(C)c1nc(CC(=O)N2CCC(N3CCC(NC(=O)[C@H](F)Cl)CC3)CC2)no1	1835078512	KAPFQCWGLDAKJU-KRWDZBQOSA-N	429.924	1.842	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)Cc3cc(C)[nH]n3)CC2)CC1	1835788458	DWTNCBFOLVUFAY-GOSISDBHSA-N	425.961	1.086	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cnn(C)c3Cl)CC2)CC1	1836043367	NSOGGLLCZHNWTM-MRXNPFEDSA-N	446.379	1.513	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)Cc1ccsc1)CCO2	1836099614	JHQVKUINFJNIFV-LJQANCHMSA-N	426.611	1.599	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(CC(C)C)nn3C)CCO2)C1	1836338211	PSNMIWRFKHULFZ-DYESRHJHSA-N	440.972	1.706	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)CC(=O)NC)CC2)CC1	1836835567	WQZCBYIWEZRWBD-HNNXBMFYSA-N	432.359	1.295	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3nccnc3OC)CC2)CC1	1837292532	VXUQRWITUTYJNI-MRXNPFEDSA-N	440.928	1.351	50	20	IDGD	
Cn1cnc(C(=O)N2CCC(OC3CCN(C(=O)[C@@](C)(Cl)CCl)CC3)CC2)n1	1837383151	NHVUQSUNWADRNQ-SFHVURJKSA-N	432.352	1.664	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4ccnn4c3)C2)C1	1837715750	HUWXQXCLRMPNIN-OAQYLSRUSA-N	446.580	1.256	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnn(C)c3Cl)CCO2)C1	1838305623	OCMYXAPHAXIBFN-KBXCAEBGSA-N	433.336	1.551	50	20	IDGD	
CCc1cc(C(=O)N2CCC(OC3CCN(C(=O)[C@H](Cl)COC)CC3)CC2)n(C)n1	1838475466	NGJWQICMBYDPAL-GOSISDBHSA-N	440.972	1.849	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)NC(=O)OC(C)(C)C)C2)C1	1839148714	HACTWIDWFJQNAH-SIFCLUCFSA-N	447.960	1.373	50	20	IDGD	
O=C([C@@H]1CCCS1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839203324	IKAHXTBZBVCIDO-SLEUVZQESA-N	425.320	1.029	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3cccnc3)C2)C1	1840031726	ANTXEHPKXASMFB-DNVCBOLYSA-N	440.338	1.254	50	20	IDGD	
CC(C)(C)OC(=O)NCC[C@@H](O)C(=O)N1CC2(CCCN2C(=O)C(C)(C)CCl)C1	1841226976	PQVXLVLVOQIQEA-CQSZACIVSA-N	431.961	1.731	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC2(CCCN2C(=O)c2cc(O)nc(O)n2)C1	1843358883	SNVLKJXBNFFYOG-AWNIVKPZSA-N	441.394	1.590	50	20	IDGD	
Cc1cccc(C(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)c1Cl	1844265492	IXQDHLHGWINTSL-UHFFFAOYSA-N	427.892	1.778	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)N1CCCC12CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1844368875	DKCMIXUNBIBGJJ-KGLIPLIRSA-N	442.944	1.013	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)c2ccnnc2O)C1	1844611338	ZIAHWFOSJXJBNR-UHFFFAOYSA-N	441.400	1.147	50	20	IDGD	
CCN(C)[C@@H](C)C(=O)N1CCCC12CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1845746034	ZYAKYNBDLSVXOP-GJZGRUSLSA-N	430.977	1.662	50	20	IDGD	
O=C(Cn1cncn1)N1CC2(CCCN2C(=O)[C@H](Br)Cc2ccccc2)C1	1845941211	MDNWELVFNOVTBS-MRXNPFEDSA-N	432.322	1.488	50	20	IDGD	
Cc1ccc(S(=O)(=O)CC(=O)N2CC3(CCCN3C(=O)[C@H](C)Br)C2)cc1	1846176039	JNAPVFSCAKHFEG-AWEZNQCLSA-N	443.363	1.756	50	20	IDGD	
C#CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)[C@@H](C)Br)C1	1846180189	RZHLVMWXDGPNFE-ZIAGYGMSSA-N	442.354	1.890	50	20	IDGD	
C[C@H](Br)C(=O)N1CC2(CCCN2C(=O)c2ccc(N3C(=O)C=CC3=O)cc2)C1	1846891328	RHJWDBQOIBMIPJ-ZDUSSCGKSA-N	446.301	1.716	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)C23CC(c4ccccc4)(C2)C3)C1	1847137221	OZCZLQWYBQGJFQ-UHFFFAOYSA-N	430.313	1.305	50	20	IDGD	
CNS(=O)(=O)c1cccc([C@@H](C)NC(=O)NNC(=O)Cc2c[nH]c3ccccc23)c1	727610816	TZRTXPUWWNPNIY-CYBMUJFWSA-N	429.502	1.710	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NCCOc1ccccc1C(F)(F)F	730127910	OXIQMHSACYRVKR-UHFFFAOYSA-N	430.408	1.906	50	20	IDGD	
CC(C)Oc1ccc(NS(=O)(=O)CC(=O)NNC(=O)COc2ccccc2O)cc1	730782219	JGNDGWNHERTLNR-UHFFFAOYSA-N	437.474	1.148	50	20	IDGD	
Cc1c(C(=O)NNC(=O)CNC(=O)c2cccs2)nnn1-c1ccc(F)c(Cl)c1	731167687	DYSQHFBINNTLKM-UHFFFAOYSA-N	436.856	1.621	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)c1cn(-c2cccc([N+](=O)[O-])c2)nn1	731454022	YRYKUBLLXFDVDO-UHFFFAOYSA-N	426.389	1.414	50	20	IDGD	
O=C1CC[C@@H](C(=O)NNC(=O)c2cccc(S(=O)(=O)Nc3ccccc3Cl)c2)N1	732259594	SDPZLWIDYDWPEO-HNNXBMFYSA-N	436.877	1.180	50	20	IDGD	
CC(=O)c1cccc(S(=O)(=O)NCCC(=O)NNc2ccccc2S(C)(=O)=O)c1	732301851	KGMXWZSLPJCRFT-UHFFFAOYSA-N	439.515	1.104	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)CCNC(=O)C2CCCCC2)CC1	734825447	FVNXPZZULFUMHL-UHFFFAOYSA-N	439.557	1.803	50	20	IDGD	
COc1cc(OC)cc(C(=O)N2CCC(C(=O)NNc3ccnc(N(C)C)n3)CC2)c1	740104157	DGSIDXMAHBZBPS-UHFFFAOYSA-N	428.493	1.555	50	20	IDGD	
CS(=O)(=O)[C@@H]1CCC[C@@H](NC(=O)NNC(=O)c2ccc(F)cc2Br)C1	741093349	PQBASXXQTXALAR-GHMZBOCLSA-N	436.303	1.888	50	20	IDGD	
CN1CC(=O)N(CCCC(=O)OCC(=O)NN=C(c2ccccc2)c2ccccc2)C1=O	742287657	ICVSQZCXYUELQM-UHFFFAOYSA-N	436.468	1.773	50	20	IDGD	
Cc1cc2c(cc1C)O[C@@H](C(=O)NNC(=O)c1ccc(S(=O)(=O)N3CCCC3)cc1)C2	742474992	RMVBYFXGOYGHDN-HXUWFJFHSA-N	443.525	1.853	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)CCC(F)(F)F	742486831	ATHHXQZLUFBIKN-UHFFFAOYSA-N	437.440	1.130	50	20	IDGD	
CC(C)c1nn([C@@H]2CCS(=O)(=O)C2)cc1C(=O)NNC(=O)Cn1ccc2ccccc21	742642728	LXIPBVPIXNWJLT-MRXNPFEDSA-N	443.529	1.782	50	20	IDGD	
Cc1nn(C)c2sc(C(=O)N[C@H](C)C(=O)NNC(=O)c3ccc(Cl)cc3O)cc12	743317639	NBYXEDSYPLYYQA-SECBINFHSA-N	435.893	1.882	50	20	IDGD	
COc1ccccc1-c1noc([C@@H](C)NC(=O)NNC(=O)[C@H]2COc3ccccc3O2)n1	743705733	UYUQJPWMKRLBBA-SJKOYZFVSA-N	439.428	1.977	50	20	IDGD	
CC(=O)N1CCc2ccccc2[C@@H]1CC(=O)OCC(=O)NNC(=O)c1cccc(C#N)c1	744523868	WVBIQKJCQWLHEE-FQEVSTJZSA-N	434.452	1.398	50	20	IDGD	
Cc1cc(C)n(-c2ccc(CNC(=O)NNC(=O)c3cc([N+](=O)[O-])ccc3O)cn2)n1	745485619	ZGOUNVGFDUUOIP-UHFFFAOYSA-N	425.405	1.642	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNS(=O)(=O)c2cc(C)cc(F)c2)cc1	747596422	OBVODUQLUSSHLA-UHFFFAOYSA-N	429.495	1.073	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CC(=O)N(C2CC2)C1)[C@@H]1Cc2ccccc2CN1Cc1ccccc1	747779676	VRQPODBWTGONSA-IRLDBZIGSA-N	432.524	1.772	50	20	IDGD	
COCCOc1ccc(Cl)cc1C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	748700359	QERMNBYYRKJHTB-UHFFFAOYSA-N	426.878	1.844	50	20	IDGD	
COCCOc1ccc(Cl)cc1C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	748709218	YFVOFMBEHYPCOA-UHFFFAOYSA-N	433.896	1.833	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)CSc2nccn2C(C)(C)C)c1	749561262	NZYVAOWGZDYAKF-UHFFFAOYSA-N	439.563	1.442	50	20	IDGD	
O=C(CCc1cc(Cl)ccc1Br)NNC(=O)N[C@H]1CCS(=O)(=O)C1	750862782	BNRYDULCNASVMM-NSHDSACASA-N	438.731	1.553	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)NCC2CCN(CC(=O)NC(C)(C)C)CC2)c1	751112296	VRFAIPVJBYSMLM-UHFFFAOYSA-N	447.580	1.639	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N(C)C[C@H]2CCN(C(C)=O)C2)cc1Br	754855609	MKKLWPWFYYSHRK-GFCCVEGCSA-N	427.299	1.612	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCCCC2)cc1NC(=O)NNC(=O)c1cccnc1	755413204	UYRXRLSAHOHUGW-UHFFFAOYSA-N	433.490	1.731	50	20	IDGD	
CCN1CCN(c2ccc(NC(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)cc2)CC1	755471593	HLIZQCJPUDVXIJ-UHFFFAOYSA-N	449.515	1.542	50	20	IDGD	
COc1ccc(C(=O)N2CCN(C)CC2)cc1NC(=O)NNC(=O)c1ccccc1OC	756249008	RWCPGVNCZOOMJS-UHFFFAOYSA-N	441.488	1.558	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)Nc2cc(C3CC3)nn2[C@@H]2CCS(=O)(=O)C2)cc1	756857869	XEMUQACVUIESLV-OAHLLOKOSA-N	428.474	1.458	50	20	IDGD	
NC(=O)c1ccc(NNC(=O)c2ccc(NS(=O)(=O)/C=C/c3ccccc3)cc2)nn1	757402264	LYJDNGWLBNDSIC-OUKQBFOZSA-N	438.469	1.745	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)Nc2cc(Br)c(=O)n(C)c2)cc1	757679936	YEWKKHJNJXAXNE-UHFFFAOYSA-N	425.239	1.388	50	20	IDGD	
COc1ccnc(NNC(=O)NCCCN(C2CC2)S(=O)(=O)c2cccc(F)c2)n1	757689822	SJZRKXHQZJYRDI-UHFFFAOYSA-N	438.485	1.494	50	20	IDGD	
CN(C)N(C(=O)[C@H]1CN(C(=O)OC(C)(C)C)CCC1(F)F)[C@H]1CCS(=O)(=O)C1	757871589	OOABTHARQBPVDT-QWHCGFSZSA-N	425.498	1.371	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2ccc3c(c2)N(C)CC3)cc1	757917877	SEMWETRLJZMULV-UHFFFAOYSA-N	431.518	1.461	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)c1cc(Br)cc(C(F)(F)F)c1	758042965	CFSNGQKPLUYAFO-ZCFIWIBFSA-N	432.218	1.167	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)N2CCN(S(=O)(=O)CBr)CC2)no1	758519066	WVSHGJIGUVYVOU-UHFFFAOYSA-N	444.307	1.790	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)c2cnn(CCO[C@H]3CCCCO3)c2C)c1	758622030	SAKXDARJOHQRTR-FQEVSTJZSA-N	444.488	1.661	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)CC[C@@H]2NC(=O)N(c3ccc(Cl)cc3)C2=O)nc1	759739971	QGNLISBWCQWGJW-AWEZNQCLSA-N	431.836	1.870	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2cnc([C@@H]3CCCO3)s2)ccc1Cl	760265151	VXARITCYRHIHKZ-JTQLQIEISA-N	430.895	1.370	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)CC2(N3CCOCC3)CCCC2)n[nH]1	763150784	BXWXSBRQRVTJHC-UHFFFAOYSA-N	427.505	1.881	50	20	IDGD	
O=C(COc1ccccc1Br)NNC(=O)c1csc(N2CCOCC2)n1	763458323	QRVLVCNMSIDIOZ-UHFFFAOYSA-N	441.307	1.582	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)Nc1ccccc1CN1C(=O)CNC1=O	763481198	AXXHZOOZRUUCNM-UHFFFAOYSA-N	448.480	1.196	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2cccc(C)c2C)c1	763507715	BPQUOTJVTYUKMF-UHFFFAOYSA-N	446.529	1.734	50	20	IDGD	
O=C(NNC(=O)c1ccccc1O)C(=O)Nc1ccc(OCc2noc(C3CC3)n2)cc1	763526081	HJSAAHOQQFPKDC-UHFFFAOYSA-N	437.412	1.631	50	20	IDGD	
CCN1CCN(c2ccc(NC(=O)C(=O)NNC(=O)c3ccccc3O)c(C)c2)CC1	763526329	IYIVPVWBFHTCDH-UHFFFAOYSA-N	425.489	1.242	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2F)cc1OCC(F)F	763681160	LIXWLSBTEJONRU-UHFFFAOYSA-N	425.363	1.943	50	20	IDGD	
O=C(COc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1c(F)cccc1-n1cccn1	763686189	LFIPJTZSEQLAAV-UHFFFAOYSA-N	431.811	1.830	50	20	IDGD	
Cn1ccnc1-c1cccc(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)c1	763686888	WSWYOESSCDVGLP-UHFFFAOYSA-N	427.848	1.905	50	20	IDGD	
CNC(=O)c1ccc(C)c(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(C(C)=O)cc2)c1	763870674	BOYFJOJXPQZGKH-CQSZACIVSA-N	440.456	1.111	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc(Br)s2)nn1CCC#N	763940042	CUQZKPCJAFRYMV-UHFFFAOYSA-N	425.268	1.329	50	20	IDGD	
COC(=O)c1c(F)cccc1NC(=O)C(=O)NNC(=O)c1cc(Br)c[nH]1	763994938	JUUOEZKVTOKZCS-UHFFFAOYSA-N	427.186	1.103	50	20	IDGD	
COC(=O)c1cc2cc(NC(=O)C(=O)NNC(=O)c3cc(Br)c[nH]3)ccc2o1	763995237	OTHXSFGKGGBQAM-UHFFFAOYSA-N	449.217	1.710	50	20	IDGD	
C[C@H](c1ccccc1)n1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)n1	764004036	KQKIXTQZIYTLII-CQSZACIVSA-N	435.440	1.663	50	20	IDGD	
Cc1nnnn1-c1cc(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3c2)ccc1F	764065184	UUGIJDNUTNDJPR-UHFFFAOYSA-N	433.403	1.663	50	20	IDGD	
COC(=O)c1cc(OC)ccc1NC(=O)C(=O)NNC(=O)Cc1ccc2ccccc2c1	764091394	KFCKXDYBEYAGOP-UHFFFAOYSA-N	435.436	1.964	50	20	IDGD	
CO[C@@H](C)C(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)c1	764126363	IRAZWVVHXRYZTG-JTQLQIEISA-N	434.836	1.419	50	20	IDGD	
CCCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cccc(OC)c2O)cc1Cl	764133505	VYJTYJGLEJZARJ-UHFFFAOYSA-N	448.863	1.594	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F	764136986	XVKCUBMGULIBNY-UHFFFAOYSA-N	438.343	1.533	50	20	IDGD	
Cc1ncsc1C(=O)NNC(=O)C(=O)Nc1ccccc1C(=O)N1C[C@H](C)C[C@@H](C)C1	764247592	UDYWREQPXHLTLT-CHWSQXEVSA-N	443.529	1.969	50	20	IDGD	
O=C(Cc1ccccn1)NNC(=O)C(=O)Nc1ccc(OCCN2CCCCC2)cc1	764267438	VSTIHJYCJUMKGV-UHFFFAOYSA-N	425.489	1.275	50	20	IDGD	
CC(C)(C)OC(=O)N1CCc2cc(NC(=O)C(=O)NNC(=O)Cc3cccnc3)ccc21	764268658	OJKSMXYHVKXEGK-UHFFFAOYSA-N	439.472	1.708	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2O)nn1-c1cccc(Cl)c1	764279206	YMGBMQLZSXIVDV-UHFFFAOYSA-N	443.847	1.705	50	20	IDGD	
CCOC(=O)c1c(C)csc1NC(=O)C(=O)NNC(=O)c1cnn(-c2ccccc2)c1	764345315	FZCGQUXZJAQQJX-UHFFFAOYSA-N	441.469	1.819	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1ccc2c(c1)CCN2C(C)=O	764394122	WPXMOIUPRVCUHW-UHFFFAOYSA-N	442.497	1.482	50	20	IDGD	
COc1nccnc1NNC(=O)c1ccc(Cl)c(S(=O)(=O)NC[C@H]2CCCO2)c1	764482392	UWCAHQZXPBIYQN-GFCCVEGCSA-N	441.897	1.353	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNS(=O)(=O)c3cc(F)ccc3C)CC2)cc1	765127357	PRTVQVHDHQLQAV-UHFFFAOYSA-N	434.537	1.570	50	20	IDGD	
CCC(CC)NC(=O)[C@@H]1CN(C(=O)C(=O)NNC(=O)OC(C)(C)C)c2ccccc2O1	765392709	JZQPTCVEJQUXGI-INIZCTEOSA-N	434.493	1.641	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cc(Cl)c4c(c3)OCO4)CC2)cc1	765755761	RVXFBZRIXHQJBR-UHFFFAOYSA-N	444.919	1.956	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NN=C[C@H](C)CCC#N)N(S(C)(=O)=O)CC2	766000956	BSWWEVZYDJSMMT-RHSMWYFYSA-N	436.534	1.995	50	20	IDGD	
C[C@@H]1CCCCN1CC(=O)Nc1ccc(F)c(NC(=O)C(=O)NNc2cnccn2)c1	766260219	MDZJJWTUGSAWSE-CYBMUJFWSA-N	429.456	1.510	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3c(-c4ccncc4)noc3C)CC2)cc1	766647317	DHYFESUQAQJBLM-UHFFFAOYSA-N	448.527	1.932	50	20	IDGD	
C[C@H]1CC(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)C[C@H](C)O1	768124084	JXIAKYCIYOPABY-GJZGRUSLSA-N	438.550	1.761	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)c2ccccc2OCC(=O)N(C)C)n[nH]1	768273235	AOFHNWUSJOYYCU-UHFFFAOYSA-N	437.456	1.627	50	20	IDGD	
Cc1ccc(CS(=O)(=O)N2CCN(S(=O)(=O)CBr)CC2)cc1F	768889549	DATCXWIRSFELLA-UHFFFAOYSA-N	429.333	1.264	50	20	IDGD	
CC(C)(C)OC(=O)N1Cc2ccc(C(=O)NNC(=O)CNC(=O)c3ccco3)cc2C1	768986675	JRSJZHQUUQYTBW-UHFFFAOYSA-N	428.445	1.721	50	20	IDGD	
C[C@H](CBr)CN1CC(S(=O)(=O)N2CCN(C(=O)OC(C)(C)C)CC2)C1	770668402	YXCXLCPCQHEBJN-CYBMUJFWSA-N	440.404	1.584	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)N[C@H]1CC(=O)N(c2c(F)cccc2F)C1	770845606	ZJTIQMDINKLQGX-MEDUHNTESA-N	432.383	1.241	50	20	IDGD	
C[C@H]1OCC[C@@H]1C(=O)NNC(=O)c1ccc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1	770855416	DFFWITMZFHBLRB-PXAZEXFGSA-N	448.457	1.582	50	20	IDGD	
Cc1cccc(F)c1NNC(=O)[C@@H](CCS(C)(=O)=O)NS(=O)(=O)c1ccccc1	771706920	JMIGCOJZCDHUQP-MRXNPFEDSA-N	443.522	1.359	50	20	IDGD	
Cc1cccc(N2C(=O)N[C@H](CCC(=O)O[C@H](C)C(=O)NNC(=O)CC(C)C)C2=O)c1	772095355	CFTIIZAPDLJJKT-GDBMZVCRSA-N	432.477	1.325	50	20	IDGD	
C#CCNS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)c1	772953899	KUVCYDXTEUJWJI-CYBMUJFWSA-N	435.889	1.480	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)c1ccc(S(=O)(=O)N(C)C)cc1	772971240	YPKLPUBUQODMAZ-GFCCVEGCSA-N	425.894	1.819	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)Cn1c(S)nc2ccccc2c1=O	774905735	RFFDYJXUPNMDIH-NSHDSACASA-N	432.889	1.954	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)NCCc1ccc(OCC(F)(F)F)nc1	776244167	HCRDNEXMKIPHEW-UHFFFAOYSA-N	437.378	1.846	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)NNc2ccccn2)cc1	777473855	SYJSEEAXXACCPR-FOWTUZBSSA-N	431.456	1.879	50	20	IDGD	
C[C@H](NC(=O)CC(C)(C)C)C(=O)NNC(=O)c1ccc(CSc2nncn2C)cc1	778285841	GAQZYEZAVLRVFY-ZDUSSCGKSA-N	432.550	1.809	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)[C@@H](O)[C@@H](O)c2nc3ccccc3s2)cc1OC	779473180	KENAYQOKRZQAOG-DLBZAZTESA-N	431.470	1.559	50	20	IDGD	
O=C(NNc1cc(F)c(F)c(F)c1)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(F)cc1	780954639	CGTPZURQFBFBTI-ABAIWWIYSA-N	433.383	1.510	50	20	IDGD	
Cn1ccnc1-c1cccc(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)c1	782887430	OZMBQMLIFQNESG-UHFFFAOYSA-N	431.456	1.302	50	20	IDGD	
Cn1cc(NC(=O)C(=O)NNc2ccc(Br)cc2)cc(Br)c1=O	783009993	VVKTYOAALRBCQC-UHFFFAOYSA-N	444.083	1.992	50	20	IDGD	
COCCNC(=O)c1ccc(NC(=O)C(=O)NNc2cccc(C(=O)OC)c2)cc1Cl	784852589	WROQZKKXIANLSA-UHFFFAOYSA-N	448.863	1.585	50	20	IDGD	
O=C(NNc1cc(F)c(F)cc1F)C(=O)Nc1ccc(S(=O)(=O)N2CCCC2)cc1	784892913	DFKMHYHBINHNKW-UHFFFAOYSA-N	442.419	1.970	50	20	IDGD	
CCOc1cc2c(cc1NC(=O)C(=O)NNC(=O)Cc1cn3ccccc3n1)O[C@H](C)C2	785068043	RVPHCFYOEINVKZ-CYBMUJFWSA-N	437.456	1.385	50	20	IDGD	
O=C(NNc1c(F)cc(C(=O)NC2CC2)cc1F)C(=O)Nc1ccc(-c2ncon2)cc1	785099785	KUGSNUIJKRQMBJ-UHFFFAOYSA-N	442.382	1.989	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2cccc3c2OCC[C@H]3N(C)C)c1	789733244	ZTZVNCMZTZZATJ-GOSISDBHSA-N	426.473	1.545	50	20	IDGD	
Cc1cn(-c2ccccc2)nc1NC(=O)C(=O)NNC(=O)[C@H]1OCC[C@H]1c1ccccc1	789813408	SNTUQGDDVVXVAO-OALUTQOASA-N	433.468	1.839	50	20	IDGD	
O=C(NN=Cc1nccn1-c1ccccc1)C(=O)NN=Cc1nccn1-c1ccccc1	790141643	QJOKYUWWFYKLHZ-UHFFFAOYSA-N	426.440	1.658	50	20	IDGD	
O=C(NNc1nc2ccccn2n1)C(=O)Nc1ccnn1Cc1ccc(Cl)c(F)c1	792394034	KIMFRHDQOKLCBQ-UHFFFAOYSA-N	428.815	1.848	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CCCC[C@@H]2SC[C@@H]3NC(=O)N[C@H]23)cc1C	793202308	GGQYOUUDYKTIMP-ZOBUZTSGSA-N	433.534	1.115	50	20	IDGD	
CCn1c(NNC(=O)C[C@H]2COCCN2C(=O)OC(C)(C)C)nc2ccccc2c1=O	795020646	PIFJCJONGIKSES-AWEZNQCLSA-N	431.493	1.886	50	20	IDGD	
COC(=O)[C@@H](C)S(=O)(=O)NC(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccccc1	797282547	HLBXRNSMYKNKNU-DSQDWWTGSA-N	441.469	1.378	50	20	IDGD	
Cc1ccc(F)c(-n2cc(O)c(C(=O)OCC(=O)NNC(=O)c3ccc(C#N)cc3)n2)c1	801414393	KAFITWKNFPRGSF-UHFFFAOYSA-N	437.387	1.515	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCC[C@H]1C[C@H](C)O[C@H](C)C1	801737968	LWUNVDIHUTTWQR-AGGWBTHJSA-N	425.555	1.826	50	20	IDGD	
C[C@@H](CCNS(=O)(=O)c1ccccc1)NC(=O)NNC(=O)c1ccc2c(c1)OCCO2	801797344	YYSPEYNDBZQSMQ-AWEZNQCLSA-N	448.501	1.159	50	20	IDGD	
CC(C)[C@H](C(=O)NNC(=O)Nc1ccc(Br)cc1)N1CCCS1(=O)=O	801999989	NMEAIDNKOIMTCA-CYBMUJFWSA-N	433.328	1.662	50	20	IDGD	
Cc1cc([N+](=O)[O-])ccc1NNC(=O)Nc1ccc(N2CCN(S(C)(=O)=O)CC2)nc1	806268993	WJZUWVQAWROTHF-UHFFFAOYSA-N	449.493	1.528	50	20	IDGD	
O=C(NNC(=O)N1CCC[C@H](CNS(=O)(=O)C2CC2)C1)c1cccc2cccnc12	808257363	YAYIHPZEIGADGD-CQSZACIVSA-N	431.518	1.383	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CN2CCN([C@H]3CCN(C(=O)OC(C)(C)C)C3)CC2)c1	808772306	FVPNIYXZMYPMDH-IBGZPJMESA-N	445.564	1.383	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)OCC(=O)NC(=O)Nc2ccc3c(c2)OCCO3)cc(C#N)n1C	809301400	JMDYUSMRDCNONG-CHHVJCJISA-N	449.423	1.775	50	20	IDGD	
CSCc1cccnc1C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	809983511	MOWABRLOLMGDLX-UHFFFAOYSA-N	434.543	1.804	50	20	IDGD	
CCOc1cc(Br)c(F)cc1NC(=O)C(=O)NNC(=O)c1cc(C)[nH]n1	810384409	KHFDFDJLLHIMIH-UHFFFAOYSA-N	428.218	1.418	50	20	IDGD	
CC(C)(C)OC(=O)N1CCOc2ccc(NC(=O)C(=O)NNc3cnccn3)cc2C1	812978596	VHNBBLRNIWKXDX-UHFFFAOYSA-N	428.449	1.688	50	20	IDGD	
COc1c(F)cc(F)cc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	813033773	KTLVHEUEMZOHHU-UHFFFAOYSA-N	428.417	1.306	50	20	IDGD	
CC(C)(C(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1)c1csc(-c2ccccc2F)n1	814620218	ILFOARDCWKHBMV-NSHDSACASA-N	440.522	1.744	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)ccc1-c1ccncc1	815564927	XONIHQVRAWNPNP-FQEVSTJZSA-N	432.436	1.983	50	20	IDGD	
NS(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)c2ccc(COc3ccccc3)o2)c1	913234784	SYDKTXTVCREHCH-UHFFFAOYSA-N	433.417	1.720	50	20	IDGD	
COc1ccc(CSCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1[N+](=O)[O-]	914709736	WHYOERWSAKXIEK-QGZVFWFLSA-N	433.442	1.824	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NC[C@H](c2ccc(F)cc2)N2CCOCC2)cc1	915898379	VZQDMDNCNQFEHZ-HXUWFJFHSA-N	430.480	1.917	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2c(Cl)nc3ccccn23)ccc1Cl	916133565	YZMQNUSOOABSTC-UHFFFAOYSA-N	428.257	1.363	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cc(C(=O)NNC(=O)c2cn[nH]c2)ccc1Cl	916148206	LCBCCNKATHYQPY-UHFFFAOYSA-N	449.876	1.947	50	20	IDGD	
Cn1ccnc1[C@@](O)(CCNC(=O)NNC(=O)c1cc2c(s1)CCC2)C(F)(F)F	916379004	XJEDUNDFQLRQOA-INIZCTEOSA-N	431.440	1.755	50	20	IDGD	
O=C(NCc1cccc(C(=O)NC2CC2)c1)NNC(=O)c1nn(-c2ccccc2)cc1O	916648378	GBVBMRGWAKLASE-UHFFFAOYSA-N	434.456	1.614	50	20	IDGD	
O=C(CCSc1ccc(F)cc1)NNC(=O)NCCCn1nc2n(c1=O)CCCC2	916649384	ANNXCHPTSRADMI-UHFFFAOYSA-N	436.513	1.423	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2ccc(Cl)nc2)cc1S(=O)(=O)N1CCCC1	917249116	RZQSQXISJJPNLL-UHFFFAOYSA-N	438.893	1.603	50	20	IDGD	
COc1ccc(/C=C(\C#N)C(=O)OCC(=O)NCc2ccc(S(C)(=O)=O)cc2)cc1	918864218	MQSHZPCVBZTWRZ-GZTJUZNOSA-N	428.466	1.865	50	20	IDGD	
CCn1ncc2c(C(=O)NNC(=O)N[C@@H]3CCS(=O)(=O)C3)cc(-c3ccccc3)nc21	919889700	RSLOFNHCPQFDQB-CQSZACIVSA-N	442.501	1.249	50	20	IDGD	
Cc1noc(C)c1CSc1ccccc1C(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1	919889793	UJNAUOWDKLDNAE-CYBMUJFWSA-N	438.531	1.715	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1nnc(O)c2ccccc12)c1ccc(N2CCOCC2)cc1	920921670	OZKIJPKZUVJLEG-AWEZNQCLSA-N	436.472	1.877	50	20	IDGD	
CS(=O)(=O)c1ccc(OCCCCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1	921274265	WHMRAQITEAUPTN-IBGZPJMESA-N	448.497	1.627	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)c2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)o1	1318072201	XNCOPNTUBVFEAZ-QGZVFWFLSA-N	441.532	1.898	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)NCc2cccc(CN3CCN(C)CC3)c2)c1	1322422384	BAFMBGXFFBBALT-UHFFFAOYSA-N	441.532	1.595	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc3cnccc3[nH]2)C1	1779129214	KNQPOJZVWARCDZ-FQELHTAISA-N	434.924	1.944	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(C(F)(F)F)nn3C)C2)C1	1779657177	KIGIEPXMCWINRT-BDJLRTHQSA-N	438.834	1.136	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(-n4cccn4)nc3)C2)C1	1779690610	BPBLAIKJHJXCKV-AUUYWEPGSA-N	448.321	1.494	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(CN(C(=O)c3ccc[nH]3)CCO2)C1	1780097778	JTIAIAAVIZQXNN-NRFANRHFSA-N	442.428	1.606	50	20	IDGD	
CC(C)NC(=O)OC(C)(C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Cl)C2	1780584907	OMQIMNFTHAYOFV-PJIJBLCYSA-N	435.924	1.948	50	20	IDGD	
CC[S@@](=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@](C)(Cl)CCl)C1	1780711795	DEERLKTWTWEOFU-OUJRWXTJSA-N	441.421	1.895	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)C(C)(C)Oc3ccc(C)cn3)C2)C1	1780971399	XSCCEVWKUUSXGX-IIBYNOLFSA-N	439.940	1.631	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)CS(=O)(=O)c3ccc(C)cc3)CCO2)C1	1781213147	MIBQZGZLGJAJPE-YLJYHZDGSA-N	442.965	1.616	50	20	IDGD	
C[C@H](Oc1ccccc1)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781333722	ISKPXSFQJWMJAW-JOQOYGCGSA-N	429.286	1.974	50	20	IDGD	
O=C(c1cc2ccoc2cn1)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781334563	YOUQLDGKDQCFEK-WMLDXEAASA-N	426.242	1.962	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(C)nc1OC)C2	1782173854	SFMXIVYIWXJZAS-CBGDNZLLSA-N	439.940	1.780	50	20	IDGD	
CCC[C@@H](NC(C)=O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](Cl)COC)C1	1782177706	ABGANNVRCUZQKW-TVKQPGBESA-N	431.961	1.059	50	20	IDGD	
Cc1cc(C(=O)NCC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)C(Cl)Cl)C2)no1	1782218146	XUTVNJNYYYVJJH-FZKQIMNGSA-N	447.319	1.030	50	20	IDGD	
Cn1cc(CC(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)CCBr)C3)cn1	1782586189	WGBMLEKZVHSDST-CRAIPNDOSA-N	427.343	1.262	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)CCN3CCCCC3)CCO2)C1	1783343646	WESLGHGQZXKRNU-VQIMIIECSA-N	430.387	1.866	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)CN3CCc4sccc4C3)CCO2)C1	1783874196	ZQWCSNODDIDWOB-UZLBHIALSA-N	441.981	1.190	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cnn(Cc4ccccc4)c3)CCO2)C1	1783877706	NOSZPTOUHHSMAK-UGKGYDQZSA-N	446.935	1.629	50	20	IDGD	
Cc1nccn1CCCC(=O)N1CC[C@@]2(CN(C(=O)CCBr)CCO2)C1	1784404700	JFOFUDPOHDAHIM-SFHVURJKSA-N	427.343	1.587	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCN3CCN(C)CC3)C[C@@H]21	1784615936	VHFVKQLNLSUVLT-VJANTYMQSA-N	429.005	1.011	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CC(=O)OC(C)(C)C)[C@H]2C1	1784781408	JIARCLZMHDOWPY-XQLPTFJDSA-N	447.370	1.871	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4c(cnn4C)c3)[C@H]2C1	1788062254	AWAMLJSKVYXEHA-RMRDIRSESA-N	434.924	1.420	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)c3cnn4c3CCC4)CCC2)cc1)c1cccc(B(O)O)c1	1788150282	AMTVVDWDTAYFHF-UHFFFAOYSA-N	444.300	1.571	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)c1ccc2nc[nH]c2c1	1788330116	MRZRJMXQUDWEFH-APYUEPQZSA-N	439.285	1.847	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc([N+](=O)[O-])o3)C[C@@H]21)[C@@H](F)Br	1789920964	LCGQRIUXXYFGIN-LKAMGYQZSA-N	434.218	1.472	50	20	IDGD	
CCc1ncccc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]2C1	1789922588	PRVJFYTXDDGOJL-DLKVLKDVSA-N	428.302	1.928	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21	1790960979	DHMHAGUNUSXTJK-CYDGBPFRSA-N	440.176	1.925	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1c(F)cccc1Cl)c1cccc(B(O)O)c1	1792835224	XOCOKPSMHYNKCX-BJWYYQGGSA-N	444.699	1.653	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Br)C2	1792872298	XGWOHZWHAVHETR-PZWNZHSQSA-N	426.149	1.390	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@](C)(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](O)CCl)C1	1793112624	SJQKJXVXXFDVTN-CKBPBPHLSA-N	443.972	1.871	50	20	IDGD	
Cc1cccc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Br)C3)n1	1793911897	OCGZKEWDEBGYQZ-DLTLXFJOSA-N	428.302	1.603	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1scnc1C1CC1	1794844541	YFBGHRNUXBLXRS-BTTYYORXSA-N	440.529	1.585	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3ncsc3[nH]1)C2	1795115850	OEKZCOCLMWLIRM-WDAIWFPHSA-N	427.324	1.613	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](CN)c1ccccc1	1795676010	XDVJOKSQYYJWMA-YPLULLRNSA-N	428.360	1.555	50	20	IDGD	
COc1ccc(F)cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1	1796190629	RWWIGLXYERBSNB-BCDXTJNWSA-N	426.253	1.080	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/c1ccc([N+](=O)[O-])o1)C2	1797953948	WITBTUHMQNJHES-HILMWPRSSA-N	437.525	1.642	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)nc(Cl)c1)C2	1797954346	AAGLHNHXODXRIB-FVCICTRLSA-N	427.961	1.495	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2n(n1)CCCNC2=O	1797968988	MBBJYVXTICYQLO-RJAOAUJVSA-N	442.347	1.505	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1C[C@H](NC(=O)OC(C)(C)C)C1)C2	1799270910	CBKAOMPQZPQRPA-WBAHDQRJSA-N	443.972	1.897	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CSc1ccncc1)C2	1800639928	CJCONKSMNJNFDZ-IARIHHJXSA-N	442.379	1.937	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Nc1cccnc1)C2	1800640195	YQEUVVMUFQOQKQ-BIYBGRMPSA-N	439.354	1.645	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c(c1)CCCC3=O)C2	1800978493	SKOJUSKAQHQBGJ-WQDJSCAQSA-N	434.920	1.663	50	20	IDGD	
COc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C(Cl)Cl)c([N+](=O)[O-])cc1O	1801016696	UANVPJHEDGEADN-ICCCGROCSA-N	448.259	1.316	50	20	IDGD	
COc1cc(F)ccc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2	1801646512	NVFOHEDUIJTQAU-ANGCBRKESA-N	433.249	1.728	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)CN2CCSCC2)[C@H]1c1cccnc1	1802448188	HXMDKWXZSBUJRM-JENIJYKNSA-N	440.997	1.390	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)nn1C(F)F	1803140353	DJTSMPTWTLNOMJ-VNQPRFMTSA-N	441.866	1.901	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccnc3ncccc23)[C@H]1c1cccnc1)[C@H](O)CCl	1803147821	MEEFBHUDOASWTR-IPELMVKDSA-N	439.903	1.944	50	20	IDGD	
Cc1cccnc1C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1803800422	RJYVXKHHHOFGLV-SIKLNZKXSA-N	444.300	1.098	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@H]1c1cccnc1)c1cc(O)n[nH]1	1807289522	OGXVRYYLNXGASM-LEWSCRJBSA-N	426.246	1.520	50	20	IDGD	
Cc1nnc(CC(=O)NC[C@@H]2CCN(C(=O)CO[Si](C)(C)C)[C@H]2c2cccnc2)o1	1807470832	MERJVKNYOSGMNB-JXFKEZNVSA-N	431.569	1.873	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)c2cnco2)[C@H]1c1cccnc1	1808408725	JPEBMINTWPOWBF-VQMZYRHSSA-N	449.471	1.523	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2cc3cn[nH]c3cn2)[C@@H]1c1cccnc1	1810089053	HRMWBCWYVMPXMP-ALKREAHSSA-N	442.907	1.926	50	20	IDGD	
CC[C@@H](NC(C)=O)C(=O)N1CC[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]1c1cccnc1	1810537864	QHGUOQIJAPXYOY-NLWGTHIKSA-N	434.613	1.854	50	20	IDGD	
CCCNC(=O)CCC(=O)N1CC[C@H](CNC(=O)[C@H](Cl)COC)[C@H]1c1cccnc1	1813028701	UGSNOOPZGPGJTD-MBOZVWFJSA-N	438.956	1.648	50	20	IDGD	
C=C(C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1)C(F)(F)F	1813074440	RCHTZDAZFQQHFN-CRAIPNDOSA-N	441.454	1.579	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2ccc(C(N)=O)cc2)[C@H]1c1cccnc1	1813739028	CJCRVVJHPFNHJU-GBESFXJTSA-N	444.919	1.754	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)[C@H](O)CCl)n[nH]2)ncc1[N+](=O)[O-]	1814870671	AHYOWYNANJPNGB-UKRRQHHQSA-N	436.856	1.927	50	20	IDGD	
O=C(CN1CCOC1=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](F)Br)[nH]n1	1815028603	VHKQTXNINMBPFX-GXFFZTMASA-N	432.250	1.545	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)C23CC(F)(C2)C3)n[nH]1	1815286549	BSCXJFQLVGKLTM-VUZGARFFSA-N	441.467	1.606	50	20	IDGD	
Cc1nc(C)c(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)o1	1817476949	UOVQOLJQJFXPRX-QGZVFWFLSA-N	437.265	1.314	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCc2cnc[nH]2)[nH]n1	1822410117	ALKJTYPNAVVNFD-INIZCTEOSA-N	430.513	1.131	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccnc2S)[nH]n1	1822412191	MOSOJRHSZAOWLC-HNNXBMFYSA-N	445.549	1.772	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC([C@H]2CCCCN2C(=O)CN2CCOC2=O)CC1	1824336288	KYCBPMKELTWBNW-DZGCQCFKSA-N	430.343	1.842	50	20	IDGD	
O=C(N[C@@H]1CCc2nc(NC(=O)C(Cl)Cl)sc2C1)c1nc2ncccn2n1	1826097431	RXMNPECNHQRXHA-SSDOTTSWSA-N	426.289	1.610	50	20	IDGD	
O=C1CCCN1CC(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H](F)Br)CC1	1826728992	RCYFCEXMWIBXMW-PBHICJAKSA-N	432.334	1.919	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)CCc2ccc[nH]2)CC1	1827109305	YRAHYGUZBOSORP-QFIPXVFZSA-N	437.349	1.561	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccccn2)CC1	1828925981	VXWWDFZHWPEJQL-HXUWFJFHSA-N	436.516	1.627	50	20	IDGD	
CN(C)C(=O)NCC(=O)N1CCC([C@H]2CCCCN2C(=O)CO[Si](C)(C)C)CC1	1829099112	BXNJPQHRXHORLZ-QGZVFWFLSA-N	426.634	1.729	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)c2ncccc2F)CC1	1829462245	UGIUDIPXQWPNSU-GOSISDBHSA-N	433.528	1.827	50	20	IDGD	
CC(C)c1nc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)no1	1830357814	HDSJNIFHHXJDBZ-HXUWFJFHSA-N	442.944	1.457	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2coc(Cl)n2)CC1	1831872012	KKIPTTRIWQQKIJ-MRXNPFEDSA-N	439.944	1.934	50	20	IDGD	
Cn1nccc1C(=O)NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1834212757	KBABWQQTDTYJHL-OAHLLOKOSA-N	430.322	1.296	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)c3nc[nH]n3)CC2)CC1	1834951256	MQVAPCUDPYXLCP-GFCCVEGCSA-N	427.347	1.021	50	20	IDGD	
CC(C)N[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1)C(C)C	1835897519	DJKJDJJOECQIGK-FPOVZHCZSA-N	443.661	1.317	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@@H]3CCNC(=O)C3)CC2)CC1	1836922753	POHMMRRCGSIULL-QAPCUYQASA-N	427.973	1.919	50	20	IDGD	
C[Si](C)(C)c1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)co1	1837426472	UAMAUBCXPBZZOD-GOSISDBHSA-N	449.407	1.699	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)C/N=C/c3ccco3)CCO2)C1	1837566739	JNWUEFIORDGASU-DIRCNHEISA-N	446.331	1.391	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccn4ccnc4c3)C2)C1	1837713296	URDYCLYMYJVFMF-NRFANRHFSA-N	446.580	1.256	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)c3ccncn3)CC2)CC1	1838117438	FRTMVPBIVQQPEU-ZDUSSCGKSA-N	425.327	1.872	50	20	IDGD	
COc1nc(C)ccc1C(=O)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1838177918	JRASYKSSIKGLLX-GOSISDBHSA-N	432.304	1.272	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@H](C)N3CCN(C)CC3)CC2)CC1	1838627087	ISXHWOKVOLKHQZ-PXNSSMCTSA-N	443.032	1.638	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(O)c(OC)c3)CCO2)C1	1838974762	YWGFGCZEXBKMBI-QRWLVFNGSA-N	426.897	1.488	50	20	IDGD	
COc1ccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)c(C#N)c1	1839132952	URYYWWNKFJBZNM-UYAOXDASSA-N	439.871	1.100	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc(OC)c(C)c3)C2)C1	1839143140	MLJNKZITCKYJGT-OXQOHEQNSA-N	425.913	1.486	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CN3CCCCC3)C2)C1	1839151827	FCMHKEBRXOPQLR-RTBURBONSA-N	436.380	1.165	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(F)n3)C2)C1	1839153514	IXCGIHYQVNJIIQ-MSOLQXFVSA-N	434.295	1.527	50	20	IDGD	
O=C(CCc1ccccn1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839198046	RCMHXNDJBCXUQY-SJLPKXTDSA-N	444.301	1.161	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(C)cc(F)c3F)CCO2)C1	1839459388	QGWCYHYUQLLIFZ-QRWLVFNGSA-N	446.878	1.597	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)c1ccc(C)cc1)CCO2	1839949037	OKYCXEASKXHZPR-LQBOVUBWSA-N	438.952	1.809	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3conc3C)C2)C1	1839963663	RGKIVBIHTSZYMQ-PBHICJAKSA-N	430.299	1.227	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)COc3ccccc3F)CCO2)C1	1839969739	ZSQRRKKBRMECPJ-MGPUTAFESA-N	428.888	1.678	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C=C/C3CCCC3)C2)C1	1840034345	INJDLYRLXKDASL-RYUWCBOHSA-N	429.355	1.973	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(Cl)cc3)C2)C1	1840153779	ASKBRPHBZJOYDP-QFBILLFUSA-N	431.316	1.664	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(F)cc(F)c3)C2)C1	1840154004	HVQMDKLLTPJFCA-VQIMIIECSA-N	432.851	1.289	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(F)c3Cl)C2)C1	1840155029	NMYJPKQAJPADEF-KUHUBIRLSA-N	449.306	1.803	50	20	IDGD	
Cc1nnc(CCC(=O)N2CCOC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)s1	1840186499	NNXBPVOJGIERLK-INIZCTEOSA-N	437.349	1.039	50	20	IDGD	
COc1ccc(C)c(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)c1	1840189473	SXUWQNDFYARDHP-IBGZPJMESA-N	431.316	1.877	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)/C(C)=C/c3cccnc3)CCO2)C1	1840414486	NTUCJDUDOLCAQC-FCAYMYRWSA-N	437.924	1.195	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CCCS1)CCO2	1840578476	APDBPAOOJRHBGV-JJRVBVJISA-N	435.384	1.512	50	20	IDGD	
COC1(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)CCC1	1840616952	IGPAATOWYTUQMT-RHSMWYFYSA-N	437.306	1.093	50	20	IDGD	
O=C1CC[C@@H](C(=O)N2CCCC23CN(C(=O)[C@H](Br)Cc2ccccc2)C3)CN1	1841115050	YWRTUQABHPZCSO-IAGOWNOFSA-N	448.361	1.722	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC12CN(C(=O)C1(c3ccc(Cl)cc3)CC1)C2	1843015027	ZRXUMQVZSMMQSE-UHFFFAOYSA-N	438.720	1.569	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)c1cnc(O)[nH]1)C2	1844692837	PNSJTOGXGVFABM-UHFFFAOYSA-N	429.389	1.080	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)[C@@H]2CCc3ccccc3O2)C1	1846334621	GZMAHJNZDUKJSE-NTRYICDMSA-N	449.511	1.718	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)c1cc(S(C)(=O)=O)ccc1Cl)C2	1846365428	SZJONWGUWJPRQN-HNNXBMFYSA-N	449.356	1.814	50	20	IDGD	
Cc1nnc(NNC(=O)C2CCN(C(=O)c3ccc(Br)cc3)CC2)[nH]c1=O	11335434	CYOSGYHZTDSPID-UHFFFAOYSA-N	435.282	1.231	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(Cn3cccn3)cc2)cc1OC	14149691	VVNSKFDTDULKOR-UHFFFAOYSA-N	438.440	1.567	50	20	IDGD	
C[C@H](NS(=O)(=O)c1ccc(Cl)cc1)C(=O)NNC(=O)[C@H](C)Oc1ccccc1F	18054842	AUCPLGWFFLWPSV-RYUDHWBXSA-N	443.884	1.761	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N1CCN(c2cnccn2)CC1	26149164	WCXATCJKQWVRGW-ZDUSSCGKSA-N	449.309	1.569	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)[C@@H](NC(=O)COc2ccccc2)C(C)C)c1	26901152	WRNIZOLJMFGQIQ-FQEVSTJZSA-N	429.473	1.685	50	20	IDGD	
CN(C)c1ccc(C=NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)cc1	245284205	QQNQZBKOGXRRKK-UHFFFAOYSA-N	444.557	1.856	50	20	IDGD	
CCN1CCN(CCCCNC(=O)NNC(=O)c2ccc(Br)s2)CC1	302954678	OUBFNFFNLNTSSY-UHFFFAOYSA-N	432.388	1.872	50	20	IDGD	
O=C(CN1CCCN(C(=O)Oc2ccccc2)CC1)NNC(=O)c1ccc([N+](=O)[O-])cc1	725816458	VQNNKWMRSPLVFC-UHFFFAOYSA-N	441.444	1.563	50	20	IDGD	
CC(C)(C)NC(=S)NNC(=O)[C@@H](CCS(C)(=O)=O)NC(=O)c1ccccc1Cl	726141886	PHSAKQZVIWXVJH-CYBMUJFWSA-N	448.998	1.167	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)/C=C/c2ccccc2Cl)c1	727350748	VCRFDQGQOULRRR-ZHACJKMWSA-N	443.934	1.825	50	20	IDGD	
O=C(C[C@H](c1ccccc1)N1CCOC1=O)NNC(=O)c1csc(N2CCOCC2)n1	728264144	AAXWSKAYPZNZJS-MRXNPFEDSA-N	445.501	1.324	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)OCC(=O)NNC(=O)[C@@H]3COc4ccccc4O3)on2)cc1	728324187	REPBWENXMWNKCY-IBGZPJMESA-N	437.408	1.794	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)Cn2c(=O)cnc3ccccc32)c1	728529144	UAFMCFMOFXXQKQ-UHFFFAOYSA-N	431.246	1.629	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCCC[C@@H]2C)cc1C(=O)NNC(=O)Cc1cccnc1	728852134	NHOGAOSIBCXYIC-INIZCTEOSA-N	430.530	1.957	50	20	IDGD	
Cc1cccc2c1CC[C@H]2NC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	729621115	DMYMAAKNZDPQLC-LJQANCHMSA-N	444.561	1.640	50	20	IDGD	
C=C(C)CN1CCC(NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)CC1	730066347	HPCUUGTZBXIRBK-UHFFFAOYSA-N	449.577	1.456	50	20	IDGD	
COC(=O)[C@@H](c1ccc(Cl)cc1)N1CCN(CC(=O)NNC(=O)c2ccccc2)CC1	730259137	RRLQXISUFRPBJI-HXUWFJFHSA-N	444.919	1.633	50	20	IDGD	
O=C(CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)NNC(=O)COc1ccccc1O	730781543	QZVNJDONRXDFSC-UHFFFAOYSA-N	430.373	1.215	50	20	IDGD	
CC[C@H](C)NS(=O)(=O)c1ccc(C(=O)NNC(=O)CCN2C[C@H](C)O[C@@H](C)C2)cc1	732260552	FWOSLUKRANMPRP-JYJNAYRXSA-N	440.566	1.024	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)COc2ccccc2OCC(F)(F)F)C[C@@H](C)O1	732262570	UOBMRTBJOPCFDQ-OKILXGFUSA-N	433.427	1.653	50	20	IDGD	
COc1ccc2c(c1)OC[C@@H](C(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)C2	732332779	KVJLAFOQKXIHTG-AWEZNQCLSA-N	429.385	1.159	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NCCN2CCSCC2)c2ccccc2c1=O	732891852	HUURLUFXKMMECL-UHFFFAOYSA-N	432.550	1.189	50	20	IDGD	
COC(=O)c1ccc(Cl)c(S(=O)(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c1	733123002	MQSGGNDXIXVPAS-UHFFFAOYSA-N	434.861	1.936	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)c2cn(C)nc2C)c1	733252257	KNRJQQLPMYRIMO-UHFFFAOYSA-N	443.485	1.613	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CN(C)C)cc1S(=O)(=O)Nc1cc(Cl)ccc1F	733359653	VZQSVUABELAMMV-UHFFFAOYSA-N	442.900	1.911	50	20	IDGD	
CCc1nc(COc2ccc(C(=O)NNC(=O)CCN3C[C@@H](C)O[C@H](C)C3)cc2)no1	734541579	AXARRUDOSZIACT-HUUCEWRRSA-N	431.493	1.471	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNS(=O)(=O)c2c(F)cccc2F)CC1	734807570	WELQGGUXADKPRF-UHFFFAOYSA-N	434.465	1.857	50	20	IDGD	
CCC(=O)N1CCCC[C@H]1C(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	734821522	MREFLQYCNWTNKO-HNNXBMFYSA-N	425.530	1.507	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCc4sccc4C3)c2)cn1	735446287	KRTKFZFJAPPRFL-UHFFFAOYSA-N	445.526	1.303	50	20	IDGD	
Cc1ccc(C)n1-c1ccc(C(=O)NNC(=O)N[C@@H]2CCN(c3cnn(C)c3)C2=O)cc1	735584836	ZWLLSRYWWHARKA-LJQANCHMSA-N	435.488	1.577	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)[C@H]2CC(=O)N(Cc3ccco3)C2)cc1C	736742743	PIBUMTKDGKQAPS-ZDUSSCGKSA-N	433.486	1.565	50	20	IDGD	
COC(=O)c1ccc(N2CCN(C(=O)NNC(=O)COCc3ccccc3)[C@@H](C)C2)cc1	738497440	VHSDKOJPIYMENG-KRWDZBQOSA-N	440.500	1.941	50	20	IDGD	
CCS(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=O)CCN2C[C@@H](C)O[C@H](C)C2)c1	740922023	NRRJXNGBZKVDOL-CHWSQXEVSA-N	431.942	1.394	50	20	IDGD	
CC1(C)[C@H](NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)[C@H]2CCO[C@H]21	741426635	WIOYIPUBIPHRMN-BRWVUGGUSA-N	436.534	1.229	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NN=C(C)[C@@H]1CCOC1)N(S(C)(=O)=O)CC2	741756622	LCBFYFIEMOGYCA-WBVHZDCISA-N	439.534	1.481	50	20	IDGD	
CN(C)C(=O)CS(=O)(=O)c1ccc(C(=O)NNC(=O)Cc2c[nH]c3ccccc23)cc1	742036830	OKVJICDBGBEGDH-UHFFFAOYSA-N	442.497	1.034	50	20	IDGD	
COC(=O)c1ccc(F)c(S(=O)(=O)NNC(=O)c2cccc(Br)c2)c1	743264404	SFEQUXDTBQNIHJ-UHFFFAOYSA-N	431.239	1.998	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NCCCN1C(=O)COc2ccccc21	745857635	RLWVCKDNYGTGGB-AWEZNQCLSA-N	430.436	1.739	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)N[C@@H]1CCN(c2ccc(Cl)cc2)C1=O	746768310	CWGKAYISOFNCAG-MRXNPFEDSA-N	426.864	1.666	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1	747726266	CMFRLOHQGHBLCU-SNVBAGLBSA-N	439.222	1.134	50	20	IDGD	
Cc1cc(C(=O)NNS(=O)(=O)c2ccc(OCC(=O)O)c(C)c2)c2ccccc2n1	748689947	QWDRODVWQZDRIS-UHFFFAOYSA-N	429.454	1.938	50	20	IDGD	
O=C(NN=C(CO)c1ccc(F)cc1F)c1cccc(S(=O)(=O)N2CCOCC2)c1	749603803	MZNDKXMLJVLDKR-UHFFFAOYSA-N	439.440	1.112	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN(C(=O)c2ccc3n[nH]cc3c2)C1)c1cccc([N+](=O)[O-])c1	751282702	NZZHIAVTDBQHFM-OAHLLOKOSA-N	436.428	1.785	50	20	IDGD	
Cc1ccc(CNC(=O)NNC(=O)Cc2nc3ccccc3n2C)c(N2CCOCC2)c1	753946074	HMIHSOQUIXIFPD-UHFFFAOYSA-N	436.516	1.791	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)N[C@@H](C)CO[C@H]2CCOC2)c2ccccc2c1=O	753948652	PSCGLZBOBRTCKC-HOTGVXAUSA-N	445.520	1.725	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Nc2ccc(OC(F)F)cc2)sc1S(N)(=O)=O	754206486	YRROTBGLEBAVBP-UHFFFAOYSA-N	436.418	1.472	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cc(OC)c(O)c(OC)c2)cc1OC	754272958	YKNDQTBCYLJZIB-UHFFFAOYSA-N	434.401	1.045	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@@H]2CSCCS2)c1	756069200	WMDCASPVKFKFEH-CQSZACIVSA-N	446.620	1.510	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)Nc2cccc(C(=O)NCCC(N)=O)c2)cc1	756390154	FTEUJYKQGFMMAD-UHFFFAOYSA-N	429.502	1.545	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)Nc2ccn(CC(=O)N3CCOCC3)n2)c2ccccc2n1	756652890	BZKLAUDLQXOEFI-UHFFFAOYSA-N	437.460	1.065	50	20	IDGD	
COCCCn1ccc(NC(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)n1	756660364	WBMGQMQYDCMYBL-UHFFFAOYSA-N	427.465	1.677	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)CNC(=O)c2ccccc2C(F)(F)F)c1	756725692	KUSRPAAKSQPSFE-UHFFFAOYSA-N	448.357	1.311	50	20	IDGD	
C[C@@H]1CN(C(=O)Cn2cc(NC(=O)NNC(=O)c3c[nH]c4ccccc34)cn2)C[C@@H](C)O1	756839723	SLGICUTYWJQNMZ-ZIAGYGMSSA-N	439.476	1.467	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc(F)c(Br)cc1F)[C@H]1COc2ccccc2O1	756929072	YBRUTZRHNYFKKQ-CYBMUJFWSA-N	449.229	1.877	50	20	IDGD	
CCOc1ccc(C(=O)NNS(=O)(=O)c2cc(C(=O)O)cc(F)c2F)cc1OC	756929980	PECIUPLZPJOUBF-UHFFFAOYSA-N	430.385	1.694	50	20	IDGD	
O=C(CN(Cc1ccccc1)S(=O)(=O)c1ccc(Cl)cc1)NNC(=O)c1cnco1	758068176	MSOJDGCHYVNCCR-UHFFFAOYSA-N	448.888	1.980	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)c1cccnc1I	758428205	UOWNKXNRYHQDER-UHFFFAOYSA-N	448.261	1.752	50	20	IDGD	
C[C@@H]1CC[C@H](CC(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)C1	759111572	BPPYVHBYOJKUPM-AEFFLSMTSA-N	437.562	1.614	50	20	IDGD	
C[C@@H](CO)CCCNC(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	759634432	XEPBDJLYUZPPER-MRXNPFEDSA-N	437.504	1.741	50	20	IDGD	
C[C@@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)cn2)C[C@@H](C)O1	763442112	LIORQZRJKOUVLY-CHWSQXEVSA-N	442.432	1.003	50	20	IDGD	
COC(=O)C(C)(C)c1ccc(NC(=O)C(=O)NNC(=O)COc2cccc(C)c2)cc1	763624203	UEHDDIFWCWOQCO-UHFFFAOYSA-N	427.457	1.611	50	20	IDGD	
CCNS(=O)(=O)c1ccc(CNC(=O)NNC(=O)NCc2ccc(Cl)cc2)cc1	763654942	LPHXBQKPDUHIJH-UHFFFAOYSA-N	439.925	1.852	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cc(NC(=O)C(C)C)ccc2C)cc1	763661844	PJXUBQLQVBHLSA-UHFFFAOYSA-N	442.472	1.763	50	20	IDGD	
CN(C)C(=O)c1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)COc1ccccc1F	763681208	NNZGNKAASDAOHX-UHFFFAOYSA-N	436.827	1.346	50	20	IDGD	
CCc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1CC	763719375	XQECVPDFCXRNLJ-UHFFFAOYSA-N	446.529	1.461	50	20	IDGD	
COCC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)CC23CC4CC(CC(C4)C2)C3)cc1	763737132	XCUGBMPJBJPFKP-UHFFFAOYSA-N	442.516	1.964	50	20	IDGD	
Cc1cccc(C(=O)N2CCCC2)c1NC(=O)C(=O)NNC(=O)c1cccc(N(C)C)c1	763754425	PPVUKBKFLXWZOF-UHFFFAOYSA-N	437.500	1.697	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)C(=O)Nc1cccc(N2CCCC2)c1	763803920	PBYIGDZAQNEGEC-UHFFFAOYSA-N	427.417	1.360	50	20	IDGD	
CC(C)(C)OC(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)c1	763840307	QUUPEYLTCGRRMK-UHFFFAOYSA-N	445.447	1.875	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)c(Br)n1	763850585	OECQDNXIMHWKKY-SNVBAGLBSA-N	439.241	1.845	50	20	IDGD	
CC(C)n1nccc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1cccc(Br)c1	763882318	IPKARFKISCLMCA-NSHDSACASA-N	438.282	1.780	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(OC)c(OC)c(OC)c2)cc1OC	763903525	RYDVZHTWFIWZLW-UHFFFAOYSA-N	447.444	1.519	50	20	IDGD	
CNC(=O)c1ccc(C)c(NC(=O)C(=O)NNC(=O)c2ccc(OC(C)C)c(OC)c2)c1	763916338	MTALXKDLNYJXFZ-UHFFFAOYSA-N	442.472	1.550	50	20	IDGD	
CC(C)S(=O)(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)Cc2ccc(F)cc2)c1	763918781	MJUPTWAKZCSWAN-UHFFFAOYSA-N	435.477	1.478	50	20	IDGD	
CS(=O)(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)c2cccc3ccccc23)c1	764048984	OUHGIUDIAWRFEI-UHFFFAOYSA-N	425.466	1.784	50	20	IDGD	
CCN1CCN(c2ccc(NC(=O)C(=O)NNC(=O)c3ccc(Cl)nc3)c(C)c2)CC1	764093308	RTIOWCGDQYPKFG-UHFFFAOYSA-N	444.923	1.585	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(NC(=O)C(=O)NNC(=O)CC(F)(F)F)ccc1C	764114978	JRWZCIWGEYZCPO-UHFFFAOYSA-N	438.428	1.064	50	20	IDGD	
COCCOc1ccc(Br)cc1NC(=O)C(=O)NNC(=O)CC(F)(F)F	764116688	NXCDQLSGUMVCSG-UHFFFAOYSA-N	442.188	1.513	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2O1)C(=O)Nc1ccc(-n2cccn2)c(Cl)c1	764162736	FQSFNTRLXDETOP-QGZVFWFLSA-N	425.832	1.615	50	20	IDGD	
COc1cccc(-c2nsc(NC(=O)C(=O)NNC(=O)CCc3ccccc3)n2)c1	764186688	YGYOETVFGORQNF-UHFFFAOYSA-N	425.470	1.932	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)cc1Cl	764204309	KLTYNOYIYFUFJW-UHFFFAOYSA-N	428.873	1.739	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(OC(F)F)c2)cc1F	764249901	GMBUYWVOCVFOQX-UHFFFAOYSA-N	441.362	1.852	50	20	IDGD	
O=C(NNC(=O)c1cc(F)ccc1Br)C(=O)Nc1ccc2c(c1)OCCO2	764270119	GXZGMSWZZSJBEJ-UHFFFAOYSA-N	438.209	1.759	50	20	IDGD	
CCOc1cc(C(=O)N(C)C)ccc1NC(=O)C(=O)NNC(=O)CCc1ccccc1O	764281225	NEZANDIZISHHPG-UHFFFAOYSA-N	442.472	1.211	50	20	IDGD	
CC(C)(C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)CCc2ccccc2O)cc1	764281454	XGVAEMHPSMNKEB-UHFFFAOYSA-N	426.473	1.639	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)C(=O)Nc1nc2cc3c(cc2s1)OC(F)(F)O3	764352845	FEYMHEKFONVVLV-UHFFFAOYSA-N	435.368	1.341	50	20	IDGD	
CON(C)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)cc1	764378883	OPQCQGAGIRUATH-UHFFFAOYSA-N	436.371	1.078	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)C3=NO[C@H](c4ccccc4)C3)CC2)cc1	766639842	AQHFDNZKDKICHP-QFIPXVFZSA-N	435.528	1.778	50	20	IDGD	
C[C@@H](NC(=O)NNc1ccccc1S(C)(=O)=O)c1cccc(S(=O)(=O)N(C)C)c1	766945532	UDNAEJXBNHALIF-CYBMUJFWSA-N	440.547	1.728	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)c(C)nn1	767163368	IRDCRMLBXQJZSF-UHFFFAOYSA-N	428.456	1.870	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Cc2ccc(F)cc2Cl)cc1	767824678	LKUKYUXSJYCRQQ-UHFFFAOYSA-N	427.885	1.798	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)Cc3c(C)nc4[nH]n(C)c(=O)c4c3C)n[nH]2)c1	768264220	DJPBOUVUBJQERK-UHFFFAOYSA-N	447.499	1.889	50	20	IDGD	
COc1ccc(NNC(=O)c2cc(NS(C)(=O)=O)c(OC)c(OC)c2)c([N+](=O)[O-])c1	768335815	PFULPFXCVTVZCQ-UHFFFAOYSA-N	440.434	1.749	50	20	IDGD	
CC(C)[C@H](NC(=O)OC(C)(C)C)C(=O)NCC(=O)NNc1nc2ccccc2c(=O)n1C	768407176	MIRDAYWEWJWGTM-INIZCTEOSA-N	446.508	1.042	50	20	IDGD	
CC1(C)CCC[C@@]2(C1)NC(=O)N(CC(=O)NNC(=O)c1cc(-c3ccccc3)[nH]n1)C2=O	768571597	RWOYPVJQESJSEX-QFIPXVFZSA-N	438.488	1.729	50	20	IDGD	
CSCCNC(=S)NNC(=O)C1CCN(S(=O)(=O)c2ccccc2F)CC1	769770645	WZMFCYXBXLPPKN-UHFFFAOYSA-N	434.584	1.085	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccccc1	771848542	BTUFBXLGPKOCPO-DOTOQJQBSA-N	439.534	1.355	50	20	IDGD	
COc1ccc(OC)c(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)c1	772709093	BBJJZOBUHKAOBA-UHFFFAOYSA-N	434.474	1.226	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@H]2CCCN(C(=O)OC(C)(C)C)C2)cc2c1OCCO2	773417234	RBCRFOFXTOULSD-ZDUSSCGKSA-N	435.477	1.875	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2ccccc2C(=O)N(C)C2CCCCC2)n1	773725857	ANAVPBRDHHYJPF-UHFFFAOYSA-N	426.477	1.972	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2ccccc2OC(F)(F)F)ccc1Cl	775521476	PZWKXGQXBSAPSV-UHFFFAOYSA-N	437.783	1.961	50	20	IDGD	
O=C(CN1CCNC(=O)[C@H]1c1ccccc1Br)NNC(=O)c1ccccc1	777716287	HLDHVYLWZLBCMK-QGZVFWFLSA-N	431.290	1.383	50	20	IDGD	
COc1ccc2nc(NNC(=O)[C@H]3CC(=O)N([C@H]4CCS(=O)(=O)C4)C3)c(C)cc2c1	778482362	XQSPWQVERNTCQB-GJZGRUSLSA-N	432.502	1.031	50	20	IDGD	
COc1ccc(C(=O)NNc2ccnc(F)c2)cc1S(=O)(=O)NCc1ccccn1	781436603	NZQYWYLVMWLWPX-UHFFFAOYSA-N	431.449	1.860	50	20	IDGD	
CC(=O)N1CCN(c2cccc(NC(=O)NNC(=O)[C@H]3COc4ccccc4O3)c2)CC1	782081046	YGTAYUYLNJQXHY-HXUWFJFHSA-N	439.472	1.348	50	20	IDGD	
COC(=O)c1scc(C)c1NC(=O)C(=O)NNc1ccc(S(=O)(=O)C(F)F)cc1	782116394	FZXKZGDELIAQQW-UHFFFAOYSA-N	447.441	1.921	50	20	IDGD	
CN1CCN(C(=O)Cc2ccc(NC(=O)C(=O)NNc3ccc(F)cc3F)cc2)CC1	783339560	BRCLOYOTAQSNQF-UHFFFAOYSA-N	431.443	1.363	50	20	IDGD	
COc1cccc(Oc2ccc(NC(=O)C(=O)NNC(=O)C(=O)N3CCCC3)cc2)c1	783999825	KTVNTNZYSPZRMX-UHFFFAOYSA-N	426.429	1.196	50	20	IDGD	
CN(C)C(=O)COc1ccc(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2Cl)cc1	784382519	YBINBOCKOOZJTF-UHFFFAOYSA-N	435.824	1.797	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1cc(NC(=O)C(=O)NNc2nccnc2Cl)ccc1F	784776972	YPMPKECLQFVAAO-UHFFFAOYSA-N	444.876	1.428	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNc2cc(F)c(F)c(F)c2)c(C(=O)N(C)C)cc1OC	785088506	OSUVHCVCAHOURT-UHFFFAOYSA-N	440.378	1.905	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N2C[C@@H](O)C(C)(C)C2)cc1	791161864	PFUCCYPHCOYRCW-OUQXZNHLSA-N	437.500	1.570	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)[C@@](C)(O)CN1C(=O)C(C)(C)c2ccccc21	792797504	DLFVEARXGWXWDH-QHCPKHFHSA-N	425.485	1.461	50	20	IDGD	
CCn1ncnc1CNC(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1	792879064	DJRFAYQYGBMGQY-HXUWFJFHSA-N	433.516	1.756	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)[C@H]1[C@@H]2[C@@H]3[C@H]4[C@H]5C[C@@H]3[C@H]1[C@@H]5C[C@H]42	793591954	NYGXRDJTPGVMEZ-IPNWYOHZSA-N	429.542	1.545	50	20	IDGD	
Cc1onc(-c2ccc(Cl)cc2Cl)c1C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O	798109932	ZSPAVLFKYDUJFI-SSDOTTSWSA-N	435.289	1.656	50	20	IDGD	
CCO[C@@H]1C[C@](NC(=O)OC(C)(C)C)(C(=O)NNC(=O)NCC(F)(F)F)C1(C)C	798315591	LHVZZSIFQHVWED-HWPZZCPQSA-N	426.436	1.978	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)NCC2([S@@](C)=O)CC2)c2ccccc2c1=O	799716200	NEGNBATUBBMTPN-SSEXGKCCSA-N	433.534	1.442	50	20	IDGD	
Cn1ncc2c(O)nc(CCC(=O)NNc3cc([N+](=O)[O-])ccc3Br)nc21	800620469	QGCVRKKSJIOGRT-UHFFFAOYSA-N	436.226	1.816	50	20	IDGD	
Cn1c(=O)nc(O)c2cc(C(=O)NNC(=O)Nc3ccc(Br)cc3)cnc21	801998560	VMDUPHGUSHLUIC-UHFFFAOYSA-N	433.222	1.263	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NCC(=O)NNC(=O)Nc1ccc(OC(F)F)cc1	802045001	CZBWKSHQTWBNSY-UHFFFAOYSA-N	431.396	1.082	50	20	IDGD	
CN(CCC(N)=O)C(=O)/C(C#N)=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	804743262	CJDKPZOEVWBJGF-UVTDQMKNSA-N	428.880	1.320	50	20	IDGD	
COCCCOc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)nc2)cc1OC	806976057	BNFLQWXICBSRNT-UHFFFAOYSA-N	436.852	1.559	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NC[C@@H](c1ccccc1)N(C)C	806987952	LKMNFKOPQLHONZ-INIZCTEOSA-N	432.550	1.535	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)NCc1ccccc1CN1CCOCC1	807114101	JVCSSVNJGULYCD-UHFFFAOYSA-N	428.489	1.437	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)N[C@@H]1CCCN(C(=O)CCC(F)(F)F)C1	807573780	FGZFTLCGZYZJCK-CQSZACIVSA-N	430.427	1.902	50	20	IDGD	
COC[C@@]1(C(=O)NNC(=O)CNc2ccc(OC)cc2)CCN(C(=O)OC(C)(C)C)C1	810007796	QPOGOQGJPRCEQD-OAQYLSRUSA-N	436.509	1.528	50	20	IDGD	
O=C(NC[C@H]1CCCCN(Cc2ccccc2)C1)NNC(=O)c1ccc(-n2cnnn2)cc1	811851717	OPPMOXWIUQYLLO-LJQANCHMSA-N	448.531	1.909	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)[C@@H](CCS(C)(=O)=O)c2ccccc2)cc1	812732835	TVBSRZZVMZYQKX-SFHVURJKSA-N	439.559	1.599	50	20	IDGD	
CN(C)Cc1ccc(C(N)=O)cc1NC(=O)NNc1ccccc1S(=O)(=O)N(C)C	814655461	XWWQJVSEOKVFRQ-UHFFFAOYSA-N	434.522	1.246	50	20	IDGD	
CC(=NNC(=O)c1cc(S(=O)(=O)NCc2ccccc2)ccc1O)c1csnn1	814778419	DWHWEDLFWQQRPD-UHFFFAOYSA-N	431.499	1.876	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)c1cn(Cc2ccccc2)nn1	818819069	LOJWFJBPIQAALW-UHFFFAOYSA-N	430.262	1.929	50	20	IDGD	
CCn1c(NNC(=O)CNS(=O)(=O)c2ccc(C)c(C)c2)nc2ccccc2c1=O	823887116	BBCIDXCOTDBWCC-UHFFFAOYSA-N	429.502	1.455	50	20	IDGD	
Cc1ccc([C@]2(C)NC(=O)N(CC(=O)NNC(=O)COc3ccc(C)c(C)c3)C2=O)cc1	864001701	AKYQJMGWDXXTHA-QHCPKHFHSA-N	438.484	1.605	50	20	IDGD	
Cc1ccccc1C(=O)N[C@H](CC(C)C)C(=O)NNC(=O)CCN1C[C@H](C)O[C@H](C)C1	912921640	QETHACLLXYPIQM-WSTZPKSXSA-N	432.565	1.786	50	20	IDGD	
Cc1cc(Cl)ccc1OCCCC(=O)NNC(=O)CN1C(=O)[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O	913110595	PTHHWOFISCLIFF-WZBLMQSHSA-N	445.903	1.762	50	20	IDGD	
COc1ccccc1NC(=S)NNC(=O)CN1C(=O)N[C@@]2(CCc3ccccc32)C1=O	913440953	LNUJSKGSKPXIMB-OAQYLSRUSA-N	439.497	1.406	50	20	IDGD	
O=C(COC(=O)CCc1nc(-c2ccccn2)no1)NNC(=O)c1ccc(Cl)cc1	915398517	ZSKXXJZYBOXCGR-UHFFFAOYSA-N	429.820	1.722	50	20	IDGD	
COCCNC(=O)NNC(=O)CCN1CCN(C(c2ccccc2)c2ccccc2)CC1	915879368	ZPNAZGXYIWJHFW-UHFFFAOYSA-N	439.560	1.761	50	20	IDGD	
O=C(NCCN1CCN(Cc2ccccc2)CC1)NNC(=O)c1ccc2c(c1)OCCO2	915900975	AOXTVDGDDQKZOW-UHFFFAOYSA-N	439.516	1.220	50	20	IDGD	
CCCCS(=O)(=O)N1CCC[C@H]1C(=O)NNC(=O)[C@H](C)Oc1ccc(OCC)cc1	916036901	GUOBOJFZIXACQJ-YJBOKZPZSA-N	441.550	1.594	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)N[C@H](C)CCc1ccc(O)cc1	916235402	RJQFNZTZBKUXKI-CYBMUJFWSA-N	433.534	1.959	50	20	IDGD	
COc1cc(CNC(=O)NNC(=O)Cn2nc(C)cc2C)ccc1OCC(F)(F)F	916389065	MVDSGKMNCUIPGU-UHFFFAOYSA-N	429.399	1.980	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)NC[C@@H](C)N1CCN(c2ccccc2)CC1	916514956	VKUVULPOBMRSBM-GOSISDBHSA-N	441.532	1.615	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)NCc2nncn2CC)c2ccccc2c1=O	916580742	SFEIRGVEFUUYBE-UHFFFAOYSA-N	426.481	1.342	50	20	IDGD	
COc1cc(N2C[C@H](C(=O)NNC(=O)c3ccc(Cl)nc3)CC2=O)cc(OC)c1OC	917252316	KQBITPXRTZLBQI-GFCCVEGCSA-N	448.863	1.575	50	20	IDGD	
CC(C)c1ccc(C(=O)O)cc1S(=O)(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	917727506	IVFAKMBVQCKCEY-UHFFFAOYSA-N	430.446	1.107	50	20	IDGD	
C=CCNC(=O)c1cccc(S(=O)(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)c1	917728954	YPVKWIHJQYIMQF-UHFFFAOYSA-N	430.486	1.167	50	20	IDGD	
Cc1ccc([C@H](CNC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)N2CCOCC2)cc1	918099130	LDUSYPHNISBYPQ-IBGZPJMESA-N	427.461	1.921	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)NCCC(=O)N2CCOCC2)N(C)c2ccccc21	919708819	ZFTJBDZTRHUYQL-UHFFFAOYSA-N	425.489	1.022	50	20	IDGD	
CC(C)CCSc1ccc(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)cc1[N+](=O)[O-]	919886008	SNYONHOFVTUAJR-CYBMUJFWSA-N	444.535	1.864	50	20	IDGD	
COCCCNC(=O)NNC(=O)CSCC(=O)Nc1cccc(Br)c1	920889423	XAXQZQIHEKKNKC-UHFFFAOYSA-N	433.328	1.488	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)Nc2cccc(CN3CCC[C@H]3C(N)=O)c2)cc1	920930418	LZFOPUUJOFEQSO-IBGZPJMESA-N	425.489	1.676	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)c1ccc(N2CCCC2=O)cc1	920986283	XCSWQFAOWICUTB-AWEZNQCLSA-N	434.460	1.494	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NCc2nc(Cc3ccccc3)no2)c2ccccc2c1=O	921119050	FNTDPZXYULOYFW-UHFFFAOYSA-N	433.428	1.052	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)NC[C@H](c1cccc(F)c1)N1CCOCC1	921200470	XOFOECBDHOGSPB-LJQANCHMSA-N	430.480	1.781	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)/C(C#N)=C\c2cc(C#N)n(C)c2C)c2ccccc2c1=O	933448375	YTQJIYYJSCNHLU-DHDCSXOGSA-N	429.440	1.303	50	20	IDGD	
O=C(NNC(=O)c1n[nH]c2c1CCCC2)c1cccc(NN2C(=O)[C@H]3CC=CC[C@H]3C2=O)c1	1116877265	LJBNNOZJNIGPHH-IYBDPMFKSA-N	448.483	1.641	50	20	IDGD	
CC(C)c1nn([C@H]2CCS(=O)(=O)C2)cc1C(=O)NNc1ccc(C(F)(F)F)nn1	1118096152	KOCWYHWUANDSBQ-JTQLQIEISA-N	432.428	1.932	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CS(=O)(=O)Cc2cccc(Br)c2)cc1	1317988736	TYKSZBFSDLXDFW-UHFFFAOYSA-N	441.303	1.834	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNS(=O)(=O)c2cccc3c2OCO3)CC1	1325204972	BXAVIIXVELHUCU-UHFFFAOYSA-N	427.479	1.372	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H]2COc3c(F)cc(F)cc3C2)c1	1527970051	VOXKBAMDAAFQSN-ZDUSSCGKSA-N	425.413	1.316	50	20	IDGD	
O=C(NCCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Cl)C1)c1ccccc1	1778027607	MZFVYCUKJPTLCR-HGHGUNKESA-N	439.915	1.855	50	20	IDGD	
O=C(c1cc2cc(F)c(F)cc2[nH]1)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1778400481	XNZJZAYDSSQDMM-LPHOPBHVSA-N	427.835	1.489	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cn3cccnc3n2)C1	1778989164	LURNVRIPCGGSDK-YYFZDKIDSA-N	435.912	1.111	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@](C)(Cl)CCl)C2	1779534880	ILDNHBVROMUCHX-TWKYDXJASA-N	434.364	1.427	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccn(C(F)F)n3)C2)C1	1779613640	JGNBLMFPWFSISU-MEDUHNTESA-N	435.269	1.753	50	20	IDGD	
COc1cc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)cc(Cl)n1	1779796563	POEHTFLSVYCLNX-PIGZYNQJSA-N	446.729	1.971	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(CN(C(=O)c3cocn3)CCO2)C1	1780097206	SFLRVXBXXAFQPM-FQEVSTJZSA-N	444.400	1.265	50	20	IDGD	
C[C@@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Br)C1)n1ccnc1	1780770416	NAADIMZLMLJKEZ-ZOMKSWQUSA-N	431.306	1.649	50	20	IDGD	
NC(=O)c1ccccc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(Cl)Cl)C2	1780992395	FQAFQUHRKKOZOU-AUUYWEPGSA-N	428.316	1.717	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)[C@@H](N)Cc3cccnc3)CCO2)C1	1781230628	XNJUFQPTKUYETA-ZYSHUDEJSA-N	429.348	1.018	50	20	IDGD	
CC(C)(C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1)c1ccccn1	1781333890	HDEZPAVMXCWZCS-RDTXWAMCSA-N	428.302	1.880	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C1CCN(C)CC1)C2	1781995542	PDULYRZWVKPKGS-ZSZQSSIHSA-N	430.387	1.626	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@H]1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Cl)C2	1782160685	QMEIZWMXXITDJU-QHXDDQSASA-N	430.904	1.790	50	20	IDGD	
O=C(c1cnc2ccc(Cl)cc2c1)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1782271694	NVIDSBHZROXWDH-YLJYHZDGSA-N	438.311	1.931	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)Cc2ccc(O)cn2)C1	1782635967	PLDRPJJSYRTZJO-SQGPQFPESA-N	425.913	1.097	50	20	IDGD	
C[C@H](CC(=O)N1CC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1)Oc1ccccc1	1782879612	FAUFQRCIRAQJEU-WZONZLPQSA-N	446.548	1.047	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](C)Br)C3)C2)c(OC)c1	1783539174	YLEYQKMTYVSRMZ-YJYMSZOUSA-N	441.322	1.931	50	20	IDGD	
CC#C[C@@H](CC(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](Cl)COC)C2)C1)c1ccc(O)cc1	1783879155	PDCQPJHKXULPFL-NOXFTYBFSA-N	448.947	1.973	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)C(Cl)Cl)C3)C2)cc1NC(C)=O	1783948145	CMWWDDBTTHMTOD-LJQANCHMSA-N	444.315	1.901	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)c3ccccc3C3CC3)C2)C1	1784952217	LTCDYRXGJSYGSS-DEOSSOPVSA-N	449.511	1.320	50	20	IDGD	
O=C(CN1C(=O)CNC1=O)Nc1ccc(C2(NC(=O)[C@H](F)Br)CCC2)cc1	1786641094	GUDRPOMHYRKSFE-AWEZNQCLSA-N	441.257	1.363	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccnn3CCOC)[C@H]2C1	1787624874	OMFOONWIUNVSTI-CUSZFKRNSA-N	426.945	1.530	50	20	IDGD	
Cn1ccc(=O)cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]2C1	1789870626	RHGUBJUCOWLBAF-HAHWVIBASA-N	430.332	1.215	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(OC)n3)C[C@@H]21	1790960640	AALCAATXDIUUTM-AYDFFVQHSA-N	440.338	1.857	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)Cc3ccccc3)C[C@@H]21	1791063590	MFHDHKCRQVRCNX-HILJTLORSA-N	439.350	1.353	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cc(F)ccc3F)C[C@@H]21	1791256051	DOXFBEMLANHJAS-PTOXDTDZSA-N	430.879	1.741	50	20	IDGD	
CCOC(=O)C(C)(C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]21	1792227489	PPMDSLADALENCJ-WFTHSTBKSA-N	437.364	1.792	50	20	IDGD	
CC(C)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(S(C)(=O)=O)c1)C2	1792782852	GVLWIJDSYGBORO-SCAQPMJSSA-N	442.965	1.558	50	20	IDGD	
CC(C)(CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCl)NC(=O)OC(C)(C)C	1793108023	YOBOKDZRUOECII-XGUBFFRZSA-N	431.961	1.918	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc3c(c1)CCNCC3)C2	1793453890	YTKAQTXEYNSVJX-DMUMMCEESA-N	434.968	1.381	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1ccc2nccn2c1	1797081188	KWEWMXRXADQLMG-NEBZKDRISA-N	425.258	1.228	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1ccn2nccc2c1	1797555846	QFKGTEUOXLNVHY-NEBZKDRISA-N	425.258	1.228	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1CCC3(CC1)OCCO3)C2	1797957651	WRCRUIFAONEEFR-IZZQQSIFSA-N	440.613	1.361	50	20	IDGD	
N#Cc1ccc(F)c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)c1	1798441801	LEYHKAHIIZLJOV-QDMKHBRRSA-N	436.447	1.261	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCN1C(=O)c3ccccc3C1=O)C2	1799263670	RZZPKJXIXPTDMT-CSHUHZATSA-N	447.919	1.280	50	20	IDGD	
COc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Cl)C3)cc([N+](=O)[O-])c1OC	1799841856	YSAWHBUZSATKDF-YHYOWMERSA-N	445.831	1.350	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCc1ccc(N(C)C)cc1	1802686413	AGDFITIHHDOVTC-NUZGMZIFSA-N	443.592	1.696	50	20	IDGD	
C[C@H](CC(N)=O)C(=O)NC[C@@H]1CCN(C(=O)[C@](C)(Cl)CCl)[C@H]1c1cccnc1	1803672412	XHQJLLHOBJYBMW-BDOZRKEQSA-N	429.348	1.835	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2cc(C(=O)O)ncn2)[C@H]1c1cccnc1	1804969762	ZKBURYGBZZMEOE-JKIFEVAISA-N	431.880	1.907	50	20	IDGD	
Cc1cccnc1C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1807364671	TUFMTMSFFWTHGD-SIKLNZKXSA-N	444.300	1.098	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2cnccc2F)[C@@H]1c1cccnc1	1807829757	ZOZUBLVFMBPYGF-KKSFZXQISA-N	442.495	1.308	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)COCCO)[C@@H]1c1cccnc1	1808626981	APVLVHOAEMRUPW-ZOBUZTSGSA-N	428.327	1.270	50	20	IDGD	
C[C@@H]1CC[C@H](C(=O)NC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)O1	1809560118	YPUHMKSCPFGQGD-LNNXQNCSSA-N	431.537	1.028	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)CNC(=O)N(C)C)[C@@H]1c1cccnc1	1812862626	AWHPKNZNZMDOQW-JGGQBBKZSA-N	440.342	1.142	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2cnc(OC)cn2)[C@@H]1c1cccnc1	1813029125	CBVVARPNRFGJKA-RVKKMQEKSA-N	433.896	1.454	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)Cc2nnc(C)s2)[C@@H]1c1cccnc1	1813030803	LMMPSGVCRBSGEY-RVKKMQEKSA-N	437.953	1.744	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)CCn2ccnn2)[C@H]1c1cccnc1	1813435231	GPHYIDLYPYLMOW-JLJPHGGASA-N	435.326	1.553	50	20	IDGD	
CCOC(=O)C(C)(C)C(=O)NC[C@@H]1CCN(C(=O)[C@H](Cl)COC)[C@H]1c1cccnc1	1814174765	YTPGWDBEHWGDLO-BBWFWOEESA-N	439.940	1.931	50	20	IDGD	
C=CC[C@@H](C(=C)C)C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1	1815344241	PBNXQCXJZSBSOX-SJORKVTESA-N	439.346	1.817	50	20	IDGD	
CN1N=C(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)CCBr)[nH]n2)CCC1=O	1815620358	LVGXUGQQNOLWAG-ZDUSSCGKSA-N	439.314	1.795	50	20	IDGD	
O=C(CS(=O)(=O)N1CCCC1)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](F)Cl)CC2	1817271469	DEWKMHSXGFBSTA-NOZJJQNGSA-N	438.934	1.015	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CN2CCNC2=N)n[nH]1	1817298791	QCJVTHRVWBFEKC-JQWIXIFHSA-N	426.319	1.025	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)CCc2cccnc2)[nH]n1)c1ccc(B(O)O)cc1	1817471695	WXBRHAQZOZNKJR-HXUWFJFHSA-N	447.304	1.423	50	20	IDGD	
CN1CCN(CC(=O)Nc2nc3c(s2)C[C@H](NC(=O)CCBr)CC3)CC1	1818797073	JBLDFUMFQQCPSZ-GFCCVEGCSA-N	444.399	1.088	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](Cl)COC)[nH]n1	1819355859	XYHHTKDYVJKNKG-YRGRVCCFSA-N	428.921	1.363	50	20	IDGD	
CNC(=S)NCCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](Cl)COC)[nH]n1	1819408544	AHUSFEAOCKPPDC-YPMHNXCESA-N	430.962	1.140	50	20	IDGD	
Cc1ccc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cnccc4C(=O)NN)sc3C2)o1	1819793566	PSTLVIKTCLEAIK-NSHDSACASA-N	440.485	1.583	50	20	IDGD	
C[C@@H](CS(C)(=O)=O)C(=O)N[C@@H]1CCc2nc(NC(=O)CO[Si](C)(C)C)sc2C1	1820160158	FYQBQMUBJWDDHT-NWDGAFQWSA-N	447.655	1.587	50	20	IDGD	
CC(C)CNC(=O)C(=O)N[C@@H]1CCc2nc(NC(=O)CO[Si](C)(C)C)sc2C1	1820164679	CIQACIYQYVXCFQ-GFCCVEGCSA-N	426.615	1.679	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccncc2O)[nH]n1	1822414627	JFQKSPMFEXQZCF-OAHLLOKOSA-N	429.481	1.189	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)[C@@H]2CCCCO2)CC1	1823819558	YACZMPGNOXVTFQ-RTWAWAEBSA-N	428.338	1.169	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)C(F)(F)C(F)F)CC1	1824843528	PMEXYCLITVUOQN-MRXNPFEDSA-N	444.234	1.500	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1nccc3nc[nH]c13)CC2	1825998868	NWVNMTVHNPDCSE-NXEZZACHSA-N	434.909	1.894	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)c2csc(N)n2)CC1	1826966291	AAIKQLUFCKRFGS-MRXNPFEDSA-N	436.582	1.332	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(F)(F)C(F)F)CCO2	1832194009	WCPUPLQOPHSVTE-HZMBPMFUSA-N	449.239	1.517	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)Cc3noc4ccccc34)CC2)CC1)[C@@H](O)CCl	1833310950	YPVRFELTWFHVRV-IBGZPJMESA-N	448.951	1.542	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3c(F)ccc(O)c3F)CC2)CC1)[C@@H](O)CCl	1833312494	WGQFLLWFGBIWHC-INIZCTEOSA-N	445.894	1.455	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ncc(C)s3)CCO2)C1	1833805222	LBQZNVFVSCIICY-DYVFJYSZSA-N	446.367	1.695	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cc(O)n(C)n3)CC2)CC1	1833942931	WWGQORPGASDGRG-INIZCTEOSA-N	425.961	1.718	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)c3ncc(F)cc3F)C2)C1	1834819364	NCXXCEJWVHXQKI-QGZVFWFLSA-N	448.264	1.215	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3cccc(F)c3)CCO2)C1	1835027540	APJHGAWNVLARAM-AUUYWEPGSA-N	443.313	1.608	50	20	IDGD	
O=C(CCc1ccsc1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1836007688	XOZVYBBHSLYLID-DOTOQJQBSA-N	449.342	1.828	50	20	IDGD	
Cc1noc(N)c1C(=O)N1CCC(OC2CCN(C(=O)[C@H](F)Br)CC2)CC1	1837859835	FTVMUKGRZFNXQX-AWEZNQCLSA-N	447.305	1.868	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccn(C(C)C)n3)CCO2)C1	1838780379	CSVXXEJPJYQVIX-OXJNMPFZSA-N	426.945	1.942	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(F)cc3OC)C2)C1	1839148890	MQFRHNHHPAAFSX-OXQOHEQNSA-N	428.888	1.922	50	20	IDGD	
O=C([C@H](F)Br)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CCCS3)C2)C1	1839203325	IKAHXTBZBVCIDO-TYNCELHUSA-N	425.320	1.029	50	20	IDGD	
Cc1cc(F)cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)c1	1839284423	CWWPSHRXDKGBFS-IFXJQAMLSA-N	443.313	1.988	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(F)ccc3Cl)CCO2)C1	1839327608	UBKFHGKSAQIKPK-QFBILLFUSA-N	449.306	1.803	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3n[nH]c4ccc(C#N)cc34)CCO2)C1	1839489231	TZJGILFKXMBJSY-KKSFZXQISA-N	445.907	1.522	50	20	IDGD	
CCc1oncc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)Br)CCO2	1840032158	PBIGTHRBCAPZPK-SJCJKPOMSA-N	430.299	1.090	50	20	IDGD	
O=C(CCc1cc(F)ccn1)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840186832	WKHSDRPVJJMTEG-GOSISDBHSA-N	434.295	1.413	50	20	IDGD	
CC(=O)Nc1ccccc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840190659	GTZKGQOGIWBINV-LJQANCHMSA-N	444.315	1.519	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CC[C@H](O)CC1)CCO2	1840268942	GWKWGZUMURFQSP-IUVQAAGXSA-N	447.370	1.025	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)c(Cl)c1	1840693726	PJPKQWNDMQIZQC-QFBILLFUSA-N	431.316	1.318	50	20	IDGD	
O=C([C@H](O)CCl)N1CC2(CCCN2C(=O)c2cc(Br)ncc2Cl)C1	1842129747	PHBULYDYTBMNAJ-LLVKDONJSA-N	437.121	1.914	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)Cc2ccc(C(F)(F)F)cc2)C1	1842722318	OWVVXFKNJSKKTF-UHFFFAOYSA-N	446.234	1.445	50	20	IDGD	
O=C([C@H](O)CCl)N1CC2(CCCN2C(=O)c2cnn3c(-c4ccsc4)ccnc23)C1	1843217002	RBFRKCVCAHPSOD-MRXNPFEDSA-N	445.932	1.875	50	20	IDGD	
C[C@H]1CCC[C@@H]1C(=O)N1CCCC12CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2	1843967549	WIVCSWAVTKZPJD-ICSRJNTNSA-N	441.576	1.972	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@H]1C[C@@](C)(O)CN1C(=O)OC(C)(C)C)C2	1845167846	XDEMQRNRRAROCY-AUSJPIAWSA-N	443.972	1.968	50	20	IDGD	
O=C1C[C@@H](C(=O)N2CC3(CCCN3C(=O)[C@H](Br)Cc3ccccc3)C2)CCN1	1845942634	RWXMFQBNCNHKLD-DLBZAZTESA-N	448.361	1.722	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)c1cccc(OC3CCOCC3)n1)C2	1846362865	AZMLKVTWTXXXLC-INIZCTEOSA-N	437.924	1.710	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@H](NC(C)=O)c1ccc(F)cc1)C2	1846363335	CVIASAQYHBAKDM-DLBZAZTESA-N	425.888	1.460	50	20	IDGD	
C=C1C[C@@H](C(=O)N2CCCC23CN(C(=O)[C@@H](O)CCl)C3)N(C(=O)OC(C)(C)C)C1	1846448687	QFJLLFDICKPOBD-GJZGRUSLSA-N	427.929	1.355	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)COc1cccc2ccccc12	1848062477	MWCURMVCPHHSSW-PMACEKPBSA-N	438.528	1.793	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNS(=O)(=O)c1ccc2c(c1)CCCC2	16098524	VJCTWYLKNMWCKP-UHFFFAOYSA-N	436.559	1.790	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	25166078	XFNOCCIQGGBGND-UHFFFAOYSA-N	447.513	1.110	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)C(=O)N(C[C@@H]1CCCO1)C2=O)c1ccc2c(c1)OCO2	26963449	SINXBGSVKVHALH-AWEZNQCLSA-N	437.408	1.265	50	20	IDGD	
COc1cc(C(=O)NCC(=O)NNC(=O)Cc2ccc(F)cc2)ccc1OC(F)F	27244246	XZNXHSBNZULHAZ-UHFFFAOYSA-N	425.363	1.556	50	20	IDGD	
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)NNC(=O)c1cc(OC)c(OC)c(OC)c1	28807992	FCSINRLNQWKANT-UHFFFAOYSA-N	441.418	1.253	50	20	IDGD	
O=C(CN1C(=O)NC2(CCCC2)C1=O)NNC(=O)c1ccc(COc2ccccc2)o1	115098145	HWSKCMSGYLIYTJ-UHFFFAOYSA-N	426.429	1.484	50	20	IDGD	
O=C(CCNS(=O)(=O)/C=C\c1ccccc1)NNC(=O)c1cc(Br)c[nH]1	209397292	IPKQPDISYOBNMM-CLFYSBASSA-N	441.307	1.519	50	20	IDGD	
COc1cc2cc(C(=O)NNC(=O)CNC(=O)c3cccs3)[nH]c2c(OC)c1OC	725739598	JTPFMJNPVDGOMI-UHFFFAOYSA-N	432.458	1.446	50	20	IDGD	
C[C@H]1CN(c2ccc(CNC(=O)NNC(=O)CNC(=O)c3ccco3)cc2F)C[C@H](C)O1	725871654	PCUVUDLOPJHPON-KBPBESRZSA-N	447.467	1.293	50	20	IDGD	
COc1ccc(Br)c(CNC(=O)NNC(=O)CNC(=O)c2cccs2)c1	725874408	YBOADSNROBLXOH-UHFFFAOYSA-N	441.307	1.780	50	20	IDGD	
NC(=O)c1ccc(/C=C\C(=O)N2CCC[C@H]2C(=O)NNc2nc(-c3ccncc3)no2)cc1	728072195	ZPBAGGSFMDVAMI-AFCDSYGPSA-N	447.455	1.378	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)CCc1c(-c2ccccc2)[nH]c2ccc(F)cc12	729274868	GFHHXFVPIWVDFK-CYBMUJFWSA-N	446.504	1.992	50	20	IDGD	
O=C(CN1CCC[C@@H](NS(=O)(=O)c2cccc(F)c2)C1)NNC(=O)c1cccs1	729483266	SBKPBBSODIZBNU-CQSZACIVSA-N	440.522	1.091	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)NCCCN1CCC[C@@H](C(N)=O)C1	729495262	SHDVKGWMADBCIR-MRXNPFEDSA-N	444.561	1.650	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NCCCCN2CCN(c3ncccn3)CC2)cc1	729615303	YDVDRNPFEKABEQ-UHFFFAOYSA-N	441.536	1.097	50	20	IDGD	
CN(C)c1ccc(NC(=S)NNC(=O)CSc2ccc(C(N)=O)cc2[N+](=O)[O-])cc1	729690913	PFFNEHGPTPNAJN-UHFFFAOYSA-N	448.530	1.870	50	20	IDGD	
CCCOc1c(Cl)cc(C=NNC(=O)CSc2nnc(O)nc2O)cc1OC	730558698	ORGKITNLTMCEKF-UHFFFAOYSA-N	427.870	1.976	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)N1CCN(CC(=O)N2C[C@@H](C)C[C@H](C)C2)CC1	731501036	XSQKTXQPRYQURU-IRXDYDNUSA-N	431.537	1.172	50	20	IDGD	
CC(=O)N1CCN(S(=O)(=O)c2cccc(C(=O)NNc3c(F)cccc3F)c2)CC1	735697889	POZNTTFITQHFAZ-UHFFFAOYSA-N	438.456	1.575	50	20	IDGD	
CCCCS(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)c2cccc(C#N)c2)cc1	737756029	CQVJUMNRWXWERY-UHFFFAOYSA-N	436.515	1.723	50	20	IDGD	
C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	740903081	JMAHZLASBYTCTJ-QGZVFWFLSA-N	434.504	1.613	50	20	IDGD	
CS(=O)(=O)CCOCCNC(=O)NNC(=O)c1ccc(Br)cc1Cl	743588897	BHRDYILMRBBOEG-UHFFFAOYSA-N	442.719	1.108	50	20	IDGD	
Cc1nc([N+](=O)[O-])cn1CC(=O)NNC(=O)[C@H](C)Oc1cccc(Br)c1	743742134	NRLLAKXCXYUXTK-VIFPVBQESA-N	426.227	1.477	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)C1=NO[C@H](c2ccccc2)C1	744621730	FOVSMNWFDZCFIA-SFHVURJKSA-N	430.486	1.668	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)c1	744879229	SYPYYZGUNFLNDF-UHFFFAOYSA-N	434.368	1.270	50	20	IDGD	
COCCNS(=O)(=O)c1c[nH]c(C(=O)NNC(=O)c2ccc(Cl)cc2Cl)c1	746100184	GLHDAQKFPUVAAE-UHFFFAOYSA-N	435.289	1.321	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)[C@@H]1CCCN(C(=O)c2ccc3n[nH]cc3c2)C1	746636959	JCWABYGSBLZWQD-MRXNPFEDSA-N	445.483	1.453	50	20	IDGD	
Cc1nc(Cl)cc(NNC(=O)c2ccc(S(=O)(=O)N3C[C@H](C)O[C@H](C)C3)cc2)n1	747982922	GBQMMTVNKUEQLR-TXEJJXNPSA-N	439.925	1.993	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)n1	748127671	FMFBRPANFFHCCJ-UHFFFAOYSA-N	447.473	1.507	50	20	IDGD	
O=Cc1ccc(OCC(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)c([N+](=O)[O-])c1	748610558	NUUBNSRRFZDIPF-UHFFFAOYSA-N	429.357	1.926	50	20	IDGD	
Cc1oc(C)c(S(N)(=O)=O)c1C(=O)NNc1c(F)cc(C(=O)NC2CC2)cc1F	748829744	UTEWGVFUIUGBEM-UHFFFAOYSA-N	428.417	1.471	50	20	IDGD	
C[C@@H](Sc1ccnc2cc(Cl)ccc12)C(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1	749927694	UTCGHBANAJDWHA-PWSUYJOCSA-N	442.950	1.886	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc(OC(F)(F)F)cc1)NNC(=O)CC1CCCC1	749951381	DNLJITAQPLLAAL-UHFFFAOYSA-N	437.440	1.981	50	20	IDGD	
CC[C@@H](Oc1cccc(C)c1)C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	750405442	GBAUKCVURLLYJN-APWZRJJASA-N	428.441	1.683	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1)N1CCN(C)CC1	750663070	LGYIHPNNVQXLHZ-KRWDZBQOSA-N	433.516	1.331	50	20	IDGD	
O=C(O)c1cc([N+](=O)[O-])cc(S(=O)(=O)NNC(=O)c2cccc(Br)c2)c1	751142529	MHKLZNZFCCCABS-UHFFFAOYSA-N	444.219	1.679	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)c1ccc(F)cc1I	751202298	QPRNLSVHPWZYGI-UHFFFAOYSA-N	431.161	1.214	50	20	IDGD	
CCCC[C@@H](NC(=O)[C@@H](C)NC(=O)C(C)(C)C)C(=O)NNC(=O)c1ccc(Cl)nc1	755185834	NPKCBXWNHLKAIG-TZMCWYRMSA-N	439.944	1.722	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCC(=O)NNc1nc(-c2ccncc2)no1	755220672	FFPIAWZJPLXGCA-ZDUSSCGKSA-N	431.453	1.090	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc(OC)c1OC	755349889	XOFLUQRVGNCUPX-UHFFFAOYSA-N	430.465	1.572	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2coc(S(=O)(=O)N(C)C)c2)ccc1OC(C)C	755414656	FLUBMBBTZMTNGM-UHFFFAOYSA-N	425.463	1.401	50	20	IDGD	
CCN(CC)C(=O)COc1cccc(NC(=O)NNC(=O)c2cncc(NC(C)=O)c2)c1	755656818	PSRUYZMWYZBWJF-UHFFFAOYSA-N	442.476	1.754	50	20	IDGD	
CC(=O)NCC(=O)N1CCc2cc(C(=O)NNc3nc(C(F)(F)F)cs3)ccc21	755858386	RSALYAQONBCYFY-UHFFFAOYSA-N	427.408	1.944	50	20	IDGD	
COC(=O)c1nscc1S(=O)(=O)NNC(=O)[C@H](C)Oc1ccc2ccccc2c1	755957879	NQKWBCMHYILXAB-NSHDSACASA-N	435.483	1.860	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)Nc2ccc(OC[C@H]3CCCO3)cc2)c2ccccc2c1=O	755960406	MZZKUCSYMXIGLR-MRXNPFEDSA-N	437.456	1.958	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2nnc(-c3ccccc3)o2)cc(F)c1F	755967459	MCVHOWWZMUCGSH-UHFFFAOYSA-N	438.368	1.425	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)Nc1ccccc1CN1CCc2ccccc21	756135058	AQTMDMSDTNHCOU-QGZVFWFLSA-N	428.514	1.837	50	20	IDGD	
COCCCOc1ccccc1NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	756186392	HZGJTGBLXGLGEE-UHFFFAOYSA-N	425.445	1.815	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)Nc1ccccc1OCC(=O)N1CCOCC1	756872084	ANBGCKCJGPPEKW-UHFFFAOYSA-N	442.472	1.328	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)c1ccc(Br)cc1-n1cncn1	758061200	YESICTNZPDDXRO-UHFFFAOYSA-N	446.261	1.878	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)[C@H](C)n3nnnc3C(C)(C)C)n[nH]2)cc1OC	758371790	QSJXSVLXNWWPBJ-NSHDSACASA-N	442.480	1.400	50	20	IDGD	
CC(C)(C)OC(=O)NC1(CNC(=O)NNC(=O)C(=O)Nc2ccccn2)CCCCCC1	758694981	PEQMJPWRGFWBLZ-UHFFFAOYSA-N	448.524	1.968	50	20	IDGD	
COCCOc1cc(C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)nc2ccccc12	758849883	MHRXGYZKBOTGLN-UHFFFAOYSA-N	448.435	1.750	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NC[C@H]2CN(Cc3ccccc3)CCCO2)cc1OC	758860526	CWEAMOMPTCMIBX-IBGZPJMESA-N	442.516	1.939	50	20	IDGD	
CCO[C@@H]1C[C@@H](NC(=O)NNC(=O)COc2ccc(Br)cc2)[C@@]12CCCO2	759325460	YZHAAAGBABFVDJ-RKVPGOIHSA-N	442.310	1.885	50	20	IDGD	
COc1ccccc1[C@H](NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)c1ccccn1	760286605	ALFIOTSYDXJUMD-FQEVSTJZSA-N	444.455	1.800	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)c1csc(S(N)(=O)=O)c1	761415750	ORMZZFKPQQHMBK-MRVPVSSYSA-N	448.320	1.387	50	20	IDGD	
CC(=NNC(=O)Cc1nc2ccccc2n1C)c1c(C)nn(CCS(C)(=O)=O)c1C	763138258	MNOZJCTVIWAUQZ-UHFFFAOYSA-N	430.534	1.514	50	20	IDGD	
C[C@@H]1C[C@H](C(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)CCC1=O	763273063	XOKNPNHDBVNXPO-CRAIPNDOSA-N	443.525	1.931	50	20	IDGD	
O=Cc1ccc(OCCn2cc(C(=O)NNC(=O)Cc3cccnc3)nn2)c(Cl)c1	763350952	PLRFIRPIBMBWPK-UHFFFAOYSA-N	428.836	1.222	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1ccccc1C(=O)N1CCCCC1	763471876	OKOBSBFKDIZRCK-UHFFFAOYSA-N	439.428	1.621	50	20	IDGD	
Cn1ccnc1-c1csc(NC(=O)C(=O)NNC(=O)c2ccccc2Br)n1	763481990	CCNUOWKPYHHTSV-UHFFFAOYSA-N	449.290	1.706	50	20	IDGD	
CN1CCOc2ccc(NC(=O)C(=O)NNC(=O)COc3ccc(C(C)(C)C)cc3)cc21	763600474	QHIRZSWDEKVGBS-UHFFFAOYSA-N	440.500	1.978	50	20	IDGD	
CNC(=O)c1ccc(C)c(NC(=O)C(=O)NNC(=O)COc2cc(C)ccc2C(C)C)c1	763602707	WKTWKFFITZDLCG-UHFFFAOYSA-N	440.500	1.951	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2ccn(-c3ncccc3F)n2)c1	763665505	XDCWPMCNCVSSDN-UHFFFAOYSA-N	426.408	1.188	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)C(=O)Nc1ccc(OC(F)(F)F)cc1	763791934	YXNGOLQJACZDDU-UHFFFAOYSA-N	435.318	1.634	50	20	IDGD	
CS(=O)(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)Cc2c[nH]c3ccccc23)c1	763865717	RXEJXPZYUMMWBR-UHFFFAOYSA-N	448.888	1.553	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(N)=O)c(C)c2)cc1OC	763911453	OMLPRIAIZWJUDM-UHFFFAOYSA-N	428.445	1.291	50	20	IDGD	
COC(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Br)s2)cc1	763942111	UJSGHCJOWJABMI-UHFFFAOYSA-N	440.275	1.626	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc(Cl)c(S(=O)(=O)N(C)C)c1	763960503	QMHPQLGMMAGZNJ-UHFFFAOYSA-N	438.893	1.298	50	20	IDGD	
COCCn1cc(NC(=O)C(=O)NNC(=O)c2ccc(-c3ccc(F)cc3)s2)cn1	763976112	QTGUQMUCSXOBMP-UHFFFAOYSA-N	431.449	1.797	50	20	IDGD	
CCOCCOc1ccc(Br)cc1NC(=O)C(=O)NNC(=O)[C@H](C)CC	764081993	MENCRFTZODEQFM-LLVKDONJSA-N	430.299	1.996	50	20	IDGD	
NC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)c2c(Cl)cccc2Cl)cc1	764226178	IDEKJOJZPGSTQT-UHFFFAOYSA-N	425.228	1.257	50	20	IDGD	
Cc1nc(COc2ccc(NC(=O)C(=O)NNC(=O)Cn3ccc4ccccc43)cc2)no1	764240070	ZOKANVHOFQDPBA-UHFFFAOYSA-N	448.439	1.698	50	20	IDGD	
CCn1c(=O)n(CC)c2nc(NC(=O)CCC(=O)NNc3cc(C)nc(C)n3)ccc21	764310411	IQAGGQOQTYOYER-UHFFFAOYSA-N	426.481	1.507	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)C(=O)Nc1ccc(N2CCCC2=O)c(Cl)c1	764318862	JHGSXXDMFALDFG-UHFFFAOYSA-N	432.839	1.935	50	20	IDGD	
CCCS(=O)(=O)N1CCCC[C@H]1C(=O)NNc1c(F)cc(C(=O)NC2CC2)cc1F	764328355	AOMIUIANMQPWJS-INIZCTEOSA-N	444.504	1.894	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)C(=O)Nc1ccc(OCC(F)(F)F)nc1	764362744	HRUXZCKUIHNLDV-UHFFFAOYSA-N	426.351	1.325	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1cccnc1N1CCCCC1	764398586	UPJNVPJBXBROKO-UHFFFAOYSA-N	443.529	1.959	50	20	IDGD	
O=C(NNC(=O)[C@H]1COCCO1)C(=O)Nc1ccc(OC(F)F)c(Cc2ccccc2)c1	764425734	RSYFKBWQLNPAHZ-QGZVFWFLSA-N	449.410	1.380	50	20	IDGD	
Cn1c(=O)c2c(ncn2CC(=O)NN=C2CCCCc3ccc(Cl)cc32)n(C)c1=O	764812701	OYRCUSKMWLADQI-UHFFFAOYSA-N	428.880	1.334	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cc1[N+](=O)[O-]	765738690	MUBHGEWZZWIXPZ-UHFFFAOYSA-N	439.472	1.376	50	20	IDGD	
CN1CCO[C@H]([C@H](NC(=O)NNc2nc(O)c3cnn(C)c3n2)c2ccc(Cl)cc2)C1	766319498	LVPSDXMADYJVMR-LSDHHAIUSA-N	446.899	1.420	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(/C#N)C(=O)N2CCN(C(=O)[C@H]3CCCN3C)CC2)c1C	766332310	AZQPYHDVHGCAEI-OLOXMFFMSA-N	441.576	1.984	50	20	IDGD	
CN(C)Cc1cccc(C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)c1	766661310	WBAGWTFZEVMZJK-UHFFFAOYSA-N	443.979	1.980	50	20	IDGD	
CN(C)C(=O)COc1ccc(C(F)(F)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1	769352703	GNDTVPHXXVJEDM-UHFFFAOYSA-N	449.410	1.478	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)N[C@H]3CCN(C(=O)C4CCCC4)C3)nc21	770409483	BERMWHGHRMPMFE-ZDUSSCGKSA-N	430.513	1.704	50	20	IDGD	
CCN1CCC[C@@H]1CN1C[C@H](C(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)CC1=O	772997457	VDUPIYBABGSFLC-ZMSDIMECSA-N	436.940	1.588	50	20	IDGD	
CCc1ccc(NC(=O)C(=O)NNc2ncc(Cl)cc2Cl)cc1S(N)(=O)=O	773680532	SLLZCHXEHSGOQA-UHFFFAOYSA-N	432.289	1.680	50	20	IDGD	
COc1ccc(NC(=O)c2ccc(NC(=O)C(=O)NNc3nccc(OC)n3)cc2)cc1	773731606	SGLOUMPNBPNJJT-UHFFFAOYSA-N	436.428	1.828	50	20	IDGD	
COC(=O)[C@H](C)n1cccc1C=NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	774587817	WGDAWTQEIHHZRA-KRWDZBQOSA-N	425.489	1.130	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NCC(=O)NNc2ncc(Cl)cc2Cl)c1	775271433	JYIFACMENNPDPH-UHFFFAOYSA-N	446.316	1.512	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)N[C@@H]1CCN(c2ccc(F)c(Cl)c2)C1=O	777751782	GKDMQQUOJQFMCI-MRXNPFEDSA-N	445.838	1.865	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)CNC(=O)c1cccs1)[C@@H]1CCN(Cc2ccccc2)C1	778639264	APNIIXUHRGWZTM-DOTOQJQBSA-N	429.546	1.719	50	20	IDGD	
CN(C)C(=O)COc1ccccc1C(F)(F)C(=O)NNC(=O)COc1ccccc1O	778714672	OTEMVIKWWIOHIC-UHFFFAOYSA-N	437.399	1.177	50	20	IDGD	
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1	779389310	RIFSOSYCQYLJHG-CQSZACIVSA-N	435.529	1.327	50	20	IDGD	
Cc1cnccc1CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	779698943	QXAVSGPQHNKRCC-UHFFFAOYSA-N	431.518	1.709	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(F)cc1)c1ccccc1	780654451	GAJPYCGIWGHTQK-QRQLOZEOSA-N	449.504	1.291	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)[C@@]1(C)CCCN(C(=O)c2ccccc2)C1	780971162	JQIARGCOLMETDQ-QFIPXVFZSA-N	432.521	1.991	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(CNC(=O)NNC(=O)c2ccc3ccccc3n2)c1	782540081	YGHZJMMYVGYIIF-UHFFFAOYSA-N	427.486	1.629	50	20	IDGD	
COc1ccc(NNC(=O)Cn2c(=O)oc3cc(S(N)(=O)=O)ccc32)cc1Cl	782792557	NGUQTRBJWYYPKE-UHFFFAOYSA-N	426.838	1.047	50	20	IDGD	
COc1ncc(NC(=O)C(=O)NNc2ncc(C(F)(F)F)cc2Cl)cc1C(N)=O	782854440	SFLDYXYSOOEBAU-UHFFFAOYSA-N	432.746	1.338	50	20	IDGD	
Cc1oc2ccc(NC(=O)C(=O)NNC(=O)c3csc(N4CCOCC4)n3)cc2c1C	782896289	DXNFFUNQSFFXCL-UHFFFAOYSA-N	443.485	1.742	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1Cl)C(=O)Nc1cnn(C[C@H]2CCCO2)c1	782927430	QXIZMCHVJNXZMK-GFCCVEGCSA-N	426.260	1.769	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2ccc(SCc3cccnc3)cc2)CCS(=O)(=O)C1	783426847	OXHHRWXBAWDBAN-LJQANCHMSA-N	434.543	1.510	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2cc(F)c(F)cc2F)cc1	784892025	OFLAAOGQONKRCP-UHFFFAOYSA-N	430.408	1.872	50	20	IDGD	
Cc1cc(C)cc(-n2nc(NC(=O)C(=O)NNC(=O)Cc3cn4ccccc4n3)cc2C)c1	785060782	LUZNVDURVZFSRX-UHFFFAOYSA-N	445.483	1.774	50	20	IDGD	
CCOC(=O)c1cnn(C)c1NC(=O)C(=O)NNc1ccc(Br)c(F)c1	786420817	YHLYQLOOHSSECY-UHFFFAOYSA-N	428.218	1.580	50	20	IDGD	
N#C/C(=C/C1CC1)C(=O)OCC(=O)NCc1ccccc1S(=O)(=O)N1CCCCC1	786669675	LWIOAHMWBJJMFE-PDGQHHTCSA-N	431.514	1.881	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1)NOC[C@@H]1CCOC1	788327396	LCRKIQYLDYCLHO-MRXNPFEDSA-N	437.460	1.301	50	20	IDGD	
Cc1cc(-n2cccn2)ccc1NC(=O)C(=O)NNC(=O)c1cnn(-c2ccccc2)c1	789587073	VUMIEDUEZCPOBT-UHFFFAOYSA-N	429.440	1.766	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)cccc1NC(=O)N(C)C	792352713	HGKZPWASKABOAH-UHFFFAOYSA-N	441.444	1.259	50	20	IDGD	
COc1cc(Br)c(NC(=O)C(=O)NNc2nc3ccccn3n2)cc1OC	792395338	XGKOYQGGMRNPMM-UHFFFAOYSA-N	435.238	1.591	50	20	IDGD	
Cc1ccn(-c2ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc3ccccc3F)cc2)n1	793021816	KTESQKAZGSDMSM-CQSZACIVSA-N	425.420	1.873	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cccc(OC)c2O)c(F)cc1C	793024734	DZCIIVMJQPIYFL-UHFFFAOYSA-N	433.392	1.425	50	20	IDGD	
COC(=O)c1ccc(S(=O)(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)c(F)c1	794593596	UYHUQMZFZZZTJM-UHFFFAOYSA-N	433.458	1.227	50	20	IDGD	
Cc1c(F)cc(C(=O)O)cc1S(=O)(=O)NNC(=O)CNC(=O)OCc1ccccc1	794598646	KXWAVQDHRKGQCP-UHFFFAOYSA-N	439.421	1.068	50	20	IDGD	
COC(=O)[C@@H]1CN(C(=O)OC(C)(C)C)CCCN1CC(=O)NNC(=O)c1ccc(C)cc1	796685583	VRXQXRWNRNZAHV-KRWDZBQOSA-N	448.520	1.240	50	20	IDGD	
Cc1noc(C)c1C(C)(C)C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	797701419	OCQQTOLNMVXNSL-UHFFFAOYSA-N	434.518	1.815	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2ccc3c(c2)OCC(=O)N3C)c2ccccc2c1=O	799246091	OFLKJEXKUWZERI-UHFFFAOYSA-N	436.428	1.238	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cnn(CC)c2C(F)(F)F)cc1OC	799258609	HTCCDQUZQBAFRK-UHFFFAOYSA-N	443.382	1.729	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NC[C@H](O)c1cccc(Br)c1	799911473	FIKJFJFEMOPGNO-LBPRGKRZSA-N	441.307	1.304	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2cccn(Cc3ccccc3)c2=O)cc1	802068833	QOUFNJUNJKUGFV-UHFFFAOYSA-N	440.481	1.767	50	20	IDGD	
COc1ccc(C2=NO[C@H](CNC(=O)NNc3nc(O)c4cnn(C)c4n3)C2)cc1F	802342093	GFSPKOQLAHVSJF-JTQLQIEISA-N	430.400	1.036	50	20	IDGD	
CC(C)(C(=O)NNC(=O)[C@H]1COc2ccccc2O1)S(=O)(=O)c1ccc(Cl)cc1	806294417	NFVDCHSVVRFPTD-MRXNPFEDSA-N	438.889	1.880	50	20	IDGD	
CC[C@H](C)NS(=O)(=O)c1cccc(NC(=O)NNc2ccc(-n3ccnc3)nn2)c1	806353783	NMQGBFHCJGSYGE-ZDUSSCGKSA-N	430.494	1.888	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2cccs2)[nH]n1)C(=O)Nc1nc2c(s1)CSCC2	806979457	VTSKNFIUVDJNNB-UHFFFAOYSA-N	434.528	1.784	50	20	IDGD	
CC(C)(C(=O)NNC(=O)C(=O)Nc1cc(F)c(N2CCOCC2)cc1F)c1ccccc1	806979811	GOBOCKODJYVRJH-UHFFFAOYSA-N	446.454	1.865	50	20	IDGD	
CCc1nnc(NC(=O)[C@@H](C)[C@H](C)NC(=O)NNc2cccc(S(C)(=O)=O)c2)s1	807566539	XRXVGXSWMIEOJR-QWRGUYRKSA-N	440.551	1.793	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN[C@H](C)c1noc(COC(C)C)n1	810120012	LSIXXUIDBHEIFR-LLVKDONJSA-N	425.873	1.768	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)Cc2csc(NC(=O)c3ccco3)n2)cc1	812726420	DJTLDTGWASPHPO-UHFFFAOYSA-N	449.514	1.925	50	20	IDGD	
Cn1cnnc1COCC(=O)NNC(=O)c1cn(-c2ccccc2)nc1-c1ccccc1	814815246	RGSFIFRQLADJTP-UHFFFAOYSA-N	431.456	1.646	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1ccc2c(c1)C(=O)N(C)C2=O	825173297	QRRZLUWNZSEMIO-UHFFFAOYSA-N	445.815	1.192	50	20	IDGD	
CC(=NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)c1c(C)nc(O)nc1O	839384290	VPBLTXZMKQGIAW-UHFFFAOYSA-N	433.490	1.525	50	20	IDGD	
CSCC[C@H](C(=O)NNC(=O)CNc1ccc(C)cc1)N1C(=O)c2ccccc2C1=O	913431347	IILYHBLOGYKWIX-GOSISDBHSA-N	440.525	1.972	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)c2ccc(OCc3cccnc3)cc2)c2ccccc2c1=O	914280370	MFEKNZAPTZESSR-UHFFFAOYSA-N	429.436	1.982	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)c1cc(S(=O)(=O)N2CCCCC2)cn1C	914856616	BHIAOVKLDXZAIR-UHFFFAOYSA-N	448.545	1.602	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)CS(=O)(=O)C1CCCC1	916141541	GTJYOKQOTHJOOZ-LLVKDONJSA-N	433.324	1.721	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)NC[C@H](c2ccc(C)o2)N2CCOCC2)c1	916229356	OOKIIBNLYJDTTR-GOSISDBHSA-N	432.477	1.623	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)NCC[C@](O)(c2nccn2C)C(F)(F)F)c1	916377936	GVPCLXBXWBSNAX-KRWDZBQOSA-N	428.415	1.270	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NCc2ccc(CN3CCN(C)CC3)cc2)cc1	916387441	BXBZHNVZEBXWIU-UHFFFAOYSA-N	425.533	1.652	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCc2cccc(C(=O)N(C)C)c2)nc1	916484083	RQQKOBOMMCHDHX-UHFFFAOYSA-N	434.522	1.296	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)NC2CCN(CC(=O)NC)CC2)cc1OC	916516542	CHDMTGWEESEOMW-UHFFFAOYSA-N	435.525	1.029	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)Cn2ccc([N+](=O)[O-])n2)c2ccccc2c1=O	916735237	NAZCIEZNIVMYFB-UHFFFAOYSA-N	427.421	1.153	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)c3cc(S(N)(=O)=O)ccc3Cl)n[nH]2)cc1	917178509	LUJYLFZXYVLZPY-UHFFFAOYSA-N	433.877	1.761	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)N[C@@H](C)CN2CCCC2=O)c2ccccc2c1=O	918099833	AXSKXPDOOIGOAV-AWEZNQCLSA-N	428.493	1.152	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)c1cc([N+](=O)[O-])cc(S(C)(=O)=O)c1	920273753	ZTQHCWHSSGGKCJ-UHFFFAOYSA-N	437.430	1.237	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)c3ccc(C)s3)CC2)cc1	920280345	APELBQKUGZPDNX-UHFFFAOYSA-N	436.559	1.132	50	20	IDGD	
CNS(=O)(=O)c1ccc(CC(=O)NNC(=O)Nc2ccc(OC(F)F)cc2)cc1	1256685536	MKUPIEULSFJVTQ-UHFFFAOYSA-N	428.417	1.592	50	20	IDGD	
CNS(=O)(=O)c1ccc(CC(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)cc1	1320995481	TVIWQQNLMOODTQ-GFCCVEGCSA-N	425.894	1.406	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCc2ccc(N3CCCS3(=O)=O)c(F)c2)cc1	1321421529	ZEOSEYYLXBBWDH-UHFFFAOYSA-N	436.465	1.518	50	20	IDGD	
CCOC(=O)[C@H](C)NC(=O)c1ccc(NC(=O)NNC(=O)c2ccc(OC)cc2)cc1F	1325357764	XBFCDZCCVSFYOB-LBPRGKRZSA-N	446.435	1.982	50	20	IDGD	
CCOc1ccc(/C=C(\C#N)C(=O)N2CCN(c3nnc(C)c(C)c3C(N)=O)CC2)cc1	1326709108	CQKYHZGUNJDKHZ-QGOAFFKASA-N	434.500	1.847	50	20	IDGD	
CN1CCN(Cc2cccc(CNC(=O)NNC(=O)Cc3c[nH]c4ccccc34)c2)CC1	1338475114	FPEQLBMTKHTMJU-UHFFFAOYSA-N	434.544	1.988	50	20	IDGD	
COc1cc(CNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc(Cl)c1OC	1341263549	UJZAJPSZQPMXBB-UHFFFAOYSA-N	448.911	1.894	50	20	IDGD	
COC(=O)N1CCC(CNC(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)CC1	1346265339	WTNMOZDHUKHWHU-UHFFFAOYSA-N	441.529	1.442	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc[nH]c3nccc2-3)C1	1777895837	RBOZTLAIFROTMZ-CBGDNZLLSA-N	434.924	1.896	50	20	IDGD	
O=C(c1ccn2nccc2c1)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1778734185	GDKONMIEGOIBQH-YOEHRIQHSA-N	425.258	1.468	50	20	IDGD	
O=C(c1cc(-c2cccs2)on1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1779563703	GLNUYMXECKMBSP-SCLBCKFNSA-N	425.894	1.446	50	20	IDGD	
COc1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](O)CCl)C3)cc(Cl)n1	1779881716	BQJQVZPFLOOITH-IQUTYRLHSA-N	446.331	1.471	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)c(OC)c1	1780536900	PYNMDFMVVOSDBN-YJYMSZOUSA-N	441.322	1.931	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)/C=N/O[C@@H]3CCCCO3)CCO2)C1	1781229479	DPTBMJRMAOJJSS-FFAFJEAKSA-N	436.336	1.582	50	20	IDGD	
O=C([C@@H](F)Br)N1CC[C@]2(C1)CN(C(=O)C1(c3ccc(O)cc3)CC1)CCO2	1781326433	XRUPHUODWKEIME-QAPCUYQASA-N	441.297	1.944	50	20	IDGD	
O=C(c1cccc(Br)c1F)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1781559544	NVZMHIFNXICDRY-SUMWQHHRSA-N	449.704	1.631	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(CCN(C(=O)c3cccc(-n4cncn4)c3)C2)C1	1782017308	UREKSEZQVGUBCZ-NRFANRHFSA-N	443.580	1.562	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H]1CC[C@H]3CCC(=O)N3C1)C2)C(Cl)Cl	1782219375	YHGWWASYUMRIEW-IGMJJTELSA-N	446.375	1.705	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@]2(C1)CN(C(=O)c1ncc[nH]1)CCO2	1782863538	FZSJUZQZZPYHTH-NMQRCDEWSA-N	427.411	1.739	50	20	IDGD	
CC(C)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nc(O)n4c3CCCC4)C[C@@H]21	1783852164	PKTFVAGQQJDLPO-DZKIICNBSA-N	438.956	1.783	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)CCOc3ccc(F)cc3)CCO2)C1	1783869060	NJXWYHBOOMGSDV-XLIONFOSSA-N	428.888	1.678	50	20	IDGD	
CCOC(=O)[C@@H]1CCC[C@H](C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](Cl)COC)C3)C2)C1	1783870407	BLOJWGSNQHEECV-BIZBXSGISA-N	444.956	1.440	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)C3CCN(c4ccccc4)CC3)CCO2)C1	1783870896	JFSLOZWISKQZSB-OFNKIYASSA-N	449.979	1.987	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cc3cc[nH]c3cc1F)CCO2	1783935923	YGABKYQPEGVICP-JOCHJYFZSA-N	445.495	1.124	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ncc(F)cc3F)C[C@@H]21	1783970446	ZVECLGSHYDRZHZ-MPXAEWJHSA-N	446.292	1.984	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cncc(C(F)(F)F)c3)C[C@@H]21)[C@H](O)CCl	1784091162	KKUXKSVQTZGVIC-HPEDKQMDSA-N	435.830	1.293	50	20	IDGD	
Cc1nc2ccncc2cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]2C1	1784092093	GZXQSBPTJVALDU-IVJVFBROSA-N	432.908	1.131	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C34CC(C(=O)OC)(C3)C4)C[C@@H]21	1784622687	QMCUWOKKKRZYKB-ZRTOSOMMSA-N	426.941	1.717	50	20	IDGD	
CC(C)N1CCC(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Br)C[C@@H]32)CC1	1784997404	YWVNOUKMXZTVRL-QAETUUGQSA-N	448.377	1.777	50	20	IDGD	
CC(C)c1nc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CO[Si](C)(C)C)C[C@@H]32)no1	1785211252	QRFSAVWNDZAFMJ-JYJNAYRXSA-N	438.601	1.567	50	20	IDGD	
Cc1nc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Br)C[C@@H]32)ccc1F	1785626242	RQPQZFKXKCBPRG-LWWSYDQCSA-N	432.265	1.813	50	20	IDGD	
CN(C)c1ncc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Br)C[C@@H]32)o1	1785888129	DVNDGUNQMXRUSG-ZPFDUUQYSA-N	433.278	1.024	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)N(C)C(C)=O)[C@H]2C1	1787521061	BHWTXJRAPQTMBT-DGVSKKNDSA-N	432.359	1.006	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4ncnn4c3)[C@H]2C1	1788452458	KNILLHMVBINSDN-UNQGMJICSA-N	436.310	1.106	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC1(c2ccc(NC(=O)COc3ccc(O)nn3)cc2)CCC1	1791055864	PCIRLSWUGMMSOR-OAHLLOKOSA-N	434.880	1.949	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4n[nH]cc4c3)C[C@@H]21	1791057273	JYRHGDATLPBKSG-VXAPYIKBSA-N	435.322	1.940	50	20	IDGD	
CC(=O)N(C)CCC(=O)NC1(c2ccc(NC(=O)CCC(=O)NN(C)C)cc2)CCC1	1791599271	BPEZUXGNBMUFDD-UHFFFAOYSA-N	431.537	1.362	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)NC(=O)OC(C)(C)C	1792760989	ZGWUENNTUWKZRI-RBZJEDDUSA-N	431.961	1.897	50	20	IDGD	
C[C@H](CC(N)=O)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1794141603	RNHACJXHDIXLSQ-QMIVOQANSA-N	444.960	1.268	50	20	IDGD	
COc1ccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCBr)cc1C	1795111400	IMJYCWAYPIXLKG-CWPLJXCYSA-N	439.350	1.921	50	20	IDGD	
C[C@H](Nc1cccnc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Br)C2	1795611783	ROKQWZXBNKKWMS-YMSVYLFOSA-N	425.327	1.255	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@H](O)C[C@H]1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](F)Cl)C2	1796335391	GIIOVXXJQBHRCG-IWTMDLJTSA-N	433.908	1.529	50	20	IDGD	
COc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Cl)c([N+](=O)[O-])cc1O	1796366522	ZJPGLKQUJLSPJX-WUEYEGCSSA-N	431.804	1.047	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnnc2ccccc12	1797403370	RUBKCRVMAWNCMA-QDMKHBRRSA-N	445.483	1.194	50	20	IDGD	
CCCC(=O)N[C@@H](C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](Br)CC)C2	1797929622	PLDNXQKUPCEBKW-JAAXMTQOSA-N	432.359	1.054	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1csnn1)C2	1799219597	VUKAAFFBEIFREQ-CLLJXQQHSA-N	445.457	1.937	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCC(=O)N1CCCC1)C2	1799273767	HAACIIKBLIQRBQ-QOIYZWAUSA-N	434.364	1.215	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnn3cccc(F)c13)C2)[C@H](F)Br	1799346931	JDYYLVPTQIHULJ-FJHTZYQYSA-N	443.248	1.367	50	20	IDGD	
COc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)Br)C3)c(F)c1	1799521878	YITUIUNRBXGMMO-LSSIXWDNSA-N	429.286	1.821	50	20	IDGD	
COc1cc(F)ccc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)Br	1800763159	QMWZMRUKRMHKKD-OVZMXSCWSA-N	429.286	1.821	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nnc(-c3ccccc3)o1)C2	1800976692	CIAGZUPNYQSDLW-QKPAOTATSA-N	434.880	1.194	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1CCN(c3ccccn3)CC1)C2)C(Cl)Cl	1801017222	CQVNMKMWXLGRPN-SCAQPMJSSA-N	441.359	1.691	50	20	IDGD	
COC(=O)C[C@@H](NC(=O)OC(C)(C)C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](F)Cl)C2	1802020366	DCTSQXFLPXCEEP-OKWIKPQFSA-N	449.907	1.615	50	20	IDGD	
C[C@@H]1[C@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Cl)C3)CCN1C(=O)OC(C)(C)C	1802259190	YHVAVXCJFVDUNU-BKQXGZDCSA-N	447.935	1.756	50	20	IDGD	
CC1(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)CCCC1	1802620638	RPFSFYRZCCXGML-CTNGQTDRSA-N	435.333	1.661	50	20	IDGD	
CC(C)(CCl)C(=O)NC[C@@H]1CCN(C(=O)c2cnc(O)nc2O)[C@@H]1c1cccnc1	1802899512	QLKKWPSUXCIYDZ-DZGCQCFKSA-N	433.896	1.867	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)n1ccccc1=O	1803142830	KEOONVVIYYVIGO-NWGLXNPWSA-N	432.908	1.110	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)CCN2C(=O)C=CC2=O)[C@H]1c1cccnc1	1803686199	LGZJXUSZAZZEBA-WWMYMODYSA-N	446.935	1.810	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC2(CCN(C(=O)c3cnc(O)nc3O)CC2)C1	1805383118	CQNIBQKHUYCRNL-LBPRGKRZSA-N	441.326	1.764	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@H](CNC(=O)CN)[C@H]1c1cccnc1	1807036915	OJJMEZGFPKWMMW-MGPUTAFESA-N	441.444	1.193	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)[C@@H](N)c2ccccn2)[C@H]1c1cccnc1	1807166997	HNHQHEOEPQXLIR-UNQWWWNPSA-N	446.349	1.966	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H](CNC(=O)c2nc[nH]c2[N+](=O)[O-])[C@@H]1c1cccnc1	1808370849	FFUPKFLMIMMYRE-PBHICJAKSA-N	446.540	1.884	50	20	IDGD	
CCC(=O)N[C@H](C)C(=O)N1CC[C@H](CNC(=O)[C@@H](F)Br)[C@@H]1c1cccnc1	1808649195	LFOGALZYQKSXHE-XABYNWHXSA-N	443.317	1.693	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)[C@H]2CCC=CO2)[C@@H]1c1cccnc1	1810264858	VMAAERVVRKADBY-OPYAIIAOSA-N	429.521	1.153	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@H]1c1cccnc1)c1cc[n+]([O-])cc1	1811197214	BHHXKKKMTNVCEA-HRCADAONSA-N	437.269	1.725	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)CNC(C)=O)[C@H]1c1cccnc1	1812623563	ROHXYQORIDWELA-YQQAZPJKSA-N	425.327	1.397	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)CC2CCC2)[nH]n1	1819404361	IGDRGHHQFVSRAR-QGZVFWFLSA-N	425.493	1.904	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)CCc3nc(N)n[nH]3)sc2C1	1819552160	QOWAOISNZUJYDJ-NXEZZACHSA-N	425.946	1.796	50	20	IDGD	
COc1cc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)ccn1	1819786417	RTFYTZNMMVSPSS-INIZCTEOSA-N	443.508	1.492	50	20	IDGD	
Cc1cc(/C=C/C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)CCC(=O)NN(C)C)CC3)no1	1819944632	FARIHJSKTDSRGC-IYNGYCSASA-N	446.533	1.438	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](F)Cl)CC2)c1cc(=O)nc2sccn12	1821153463	SPQZCAJQEOKYDQ-JVXZTZIISA-N	441.897	1.973	50	20	IDGD	
COCCOCCOCCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1	1822253621	KBUWSFDLOWAHNW-JKSUJKDBSA-N	446.932	1.071	50	20	IDGD	
Cc1cccc(C)c1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2	1823514845	IKGLPPNCAPWXOG-KRWDZBQOSA-N	449.341	1.979	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H]3[C@H]4C=CS[C@@H]43)sc2C1	1824662422	AVASULKNFJWWEQ-KWAZRSOSSA-N	435.575	1.303	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H]3[C@@H]4C=CS[C@@H]34)sc2C1	1824662432	AVASULKNFJWWEQ-ZWUPXRALSA-N	435.575	1.303	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1CCc2nc(NC(=O)[C@H]3CCCS3(=O)=O)sc2C1	1824933526	FXILVVGXAFLOLQ-BXUZGUMPSA-N	445.639	1.484	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](C)Br)sc2C1	1825641586	PRWFVKRBOCBJKR-YIZRAAEISA-N	432.344	1.285	50	20	IDGD	
Cc1cc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)no1	1827056353	SUZCCCMEFNYGRK-FQEVSTJZSA-N	425.294	1.210	50	20	IDGD	
O=C(CC[C@@H]1CCOC1)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827060026	MIPHALPTUCJEEY-XMSQKQJNSA-N	442.365	1.416	50	20	IDGD	
Cc1ocnc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1	1829431420	XCBGVOBOFRHOKD-IBGZPJMESA-N	425.294	1.210	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3ccc(C#N)cc3)CCO2)C1	1829634335	LFKGTUJDFLXEQM-DENIHFKCSA-N	433.936	1.965	50	20	IDGD	
O=C(CCn1cncn1)N1CCC([C@H]2CCCCN2C(=O)[C@H](F)Br)CC1	1830381105	GYCAXJUZDAQLMD-ZBFHGGJFSA-N	430.322	1.978	50	20	IDGD	
Cc1c[nH]cc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2	1830538286	AUBLUCWTQNMTNU-UGSOOPFHSA-N	428.327	1.424	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)C3=CCCS3)CCO2)C1	1831544004	GGPSHRNZMQTWDE-CXAGYDPISA-N	433.368	1.495	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CS(C)(=O)=O)CC1	1831549163	MHNKATUCKMFCAX-HUUCEWRRSA-N	437.400	1.824	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](NC(C)C)C(C)C)C2)C1	1831646924	PBNDSIOCJYAKEI-WAOWUJCRSA-N	432.005	1.873	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)Cc2ncccn2)CC1	1831872092	NXACNKXEXFBXHV-SFHVURJKSA-N	430.553	1.012	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(F)(F)C(F)F)CCO2	1832193639	SQXWBKWBGNJKMY-TVQRCGJNSA-N	435.212	1.127	50	20	IDGD	
CCN1CCC(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1	1832952946	XRDKXQCXTZJGJK-OAQYLSRUSA-N	449.640	1.711	50	20	IDGD	
Cc1csc(CCC(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)c1	1832976408	PPIXWAJWFIDOAD-VQIMIIECSA-N	430.954	1.045	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3nc4ccccc4[nH]3)CC2)CC1)[C@H](O)CCl	1833310241	MTJUJPXIWUEWAO-GOSISDBHSA-N	433.940	1.348	50	20	IDGD	
Cc1cc(F)cc(CC(=O)N2CCC(N3CCC(NC(=O)[C@@H](O)CCl)CC3)CC2)c1	1833312752	BKXGXCWCRSMHTM-FQEVSTJZSA-N	439.959	1.848	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)C(OC)OC)CC2)CC1	1833391226	GSBDHUYXGUYYHR-OAHLLOKOSA-N	434.375	1.350	50	20	IDGD	
Cc1occc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)CBr)C2)C1	1834134099	VXDDOFDEOGQAES-UGSOOPFHSA-N	429.311	1.689	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3nccs3)CCO2)C1	1834437683	HONJKWPWLNLCJX-MLGOLLRUSA-N	432.340	1.387	50	20	IDGD	
CN(CC(=O)NC1CCN(C2CCN(C(=O)[C@H](F)Cl)CC2)CC1)C(=O)OC(C)(C)C	1834553290	LCAZDHLVIIJLFP-KRWDZBQOSA-N	448.967	1.959	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3cccnc3)CCO2)C1	1836158547	OTTKWSWVGRSUQJ-RTBURBONSA-N	430.332	1.317	50	20	IDGD	
CCc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)n[nH]1	1836280898	LKSJZMLDLNERAT-ROUUACIJSA-N	433.336	1.278	50	20	IDGD	
Cc1nn[nH]c1C(=O)N1CCC(N2CCC(NC(=O)[C@](C)(Cl)CCl)CC2)CC1	1836398314	GALQKCHDKACBIX-GOSISDBHSA-N	431.368	1.535	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCCCn3cccc3)CCO2)C1	1837623081	CYDZWZHMRFAIGW-WIYYLYMNSA-N	441.956	1.369	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)COC3CCCCC3)C2)C1	1837709403	ZVVRJKDDUIVKST-OAQYLSRUSA-N	442.629	1.644	50	20	IDGD	
C=CC[C@@H](C)C(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1	1837921338	AYMBYDCPXHYRHX-QGZVFWFLSA-N	428.338	1.191	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@H](COC)NC(C)=O)CC2)CC1	1838435052	MNZHAHGEYAETTJ-MSOLQXFVSA-N	431.961	1.154	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cc[n+]([O-])cc3)CC2)CC1	1838510991	WNUHPNFOIIVHQC-SFHVURJKSA-N	425.913	1.186	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3ccc(C)nc3O)CC2)CC1	1838543016	DZACGPFAOKJIRE-GOSISDBHSA-N	439.940	1.962	50	20	IDGD	
Cc1cc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)on1	1839150248	GNTQCUSSSAPOKX-MSOLQXFVSA-N	434.320	1.218	50	20	IDGD	
COc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)cn1	1839150259	GYZQGJFGCQJRDQ-RTBURBONSA-N	446.331	1.397	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(OC)ccc3C)CCO2)C1	1839360360	CGJHXILXYOSTJV-WIYYLYMNSA-N	440.924	1.327	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(F)ccc3F)C2)C1	1840034164	BVXRJRKSODFMNO-KZULUSFZSA-N	447.276	1.818	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(F)c(C)c3)C2)C1	1840155055	OHWSJJDWGRVBKG-JXFKEZNVSA-N	428.888	1.458	50	20	IDGD	
O=C(OCc1ccccc1)N1CC(C(=O)N2CC3(CCCN3C(=O)[C@@H](O)CCl)C2)C1	1841353944	ZDBKFZREEIXNDY-KRWDZBQOSA-N	435.908	1.058	50	20	IDGD	
Cc1ncoc1C(=O)N1CCCC12CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2	1842503524	BPCWGOJTDAMLIT-UHFFFAOYSA-N	440.504	1.146	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCCC12CN(C(=O)[C@@H]1CCc3nc(O)nc(O)c3C1)C2	1844377568	STNOCIWPAKEIAV-CYBMUJFWSA-N	434.569	1.048	50	20	IDGD	
CN1C(=O)CC[C@H]1C(=O)N1CCCC12CN(C(=O)[C@H](Br)Cc1ccccc1)C2	1845239006	PFCGBIJDJRIAPG-SJORKVTESA-N	448.361	1.817	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCc2ccc(N3CCOCC3)nc2)ccc1OC(C)C	9810552	OIBHYMAXJGMMLX-UHFFFAOYSA-N	443.504	1.858	50	20	IDGD	
CCc1ccccc1OCC(=O)NNS(=O)(=O)c1ccc2c(c1)CCCN2C(C)=O	15244279	PZXRSQFXENBEIA-UHFFFAOYSA-N	431.514	1.937	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Cc2csc(-c3ccccn3)n2)c1	16594016	KAQVZHTXSDRYPH-UHFFFAOYSA-N	445.526	1.459	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)c1nn(-c2ccccc2[N+](=O)[O-])c(C)cc1=O	17582167	MDFZJXRQDRLSGT-UHFFFAOYSA-N	447.411	1.480	50	20	IDGD	
Cc1cccc(NC(=O)CN2CCN(CC(=O)NNC(=O)c3cccs3)CC2)c1C	23297502	BDKDLYOXOGTHFJ-UHFFFAOYSA-N	429.546	1.382	50	20	IDGD	
CCOc1ccc(CCC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1	108844748	KBUXMPRTLYWRJS-UHFFFAOYSA-N	433.530	1.794	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)CN1C(=O)N[C@@]2(C[C@H](C)CC(C)(C)C2)C1=O	585675229	OEZPAQUKGLCREN-ALLJEULLSA-N	448.495	1.877	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)c2cccc(S(=O)(=O)Nc3cc(C)on3)c2)c1	725909603	RMFUBOJTVNWOHI-UHFFFAOYSA-N	444.469	1.932	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)CNC(=O)CC1CCCC1	725989872	GPQORVVLRQWIEG-UHFFFAOYSA-N	425.869	1.349	50	20	IDGD	
COCCCNC(=S)N(C)NC(=O)c1ccc(NS(=O)(=O)c2ccccc2)cc1	726076811	DRLAEISDYSOQHT-UHFFFAOYSA-N	436.559	1.975	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@H](C)NS(=O)(=O)c2ccc(C)cc2)ccc1OC(C)C	726238103	BFAKHHOBZXVTKY-HNNXBMFYSA-N	449.529	1.919	50	20	IDGD	
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC[C@@H](C(=O)NNc2nc(-c3ccncc3)no2)C1	728209832	IGBMATSMTBHWDC-CQSZACIVSA-N	446.493	1.016	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(Cl)c(S(=O)(=O)NNC(=O)C2CCCC2)c1	728259834	KRNJUOQELHGKNN-UHFFFAOYSA-N	437.971	1.870	50	20	IDGD	
CC(C)(C)NS(=O)(=O)CCNC(=O)NNC(=O)c1cc(F)ccc1Br	728745454	YMISHVZNNSXHRB-UHFFFAOYSA-N	439.307	1.250	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)[C@@H]2CCCN2C(=O)/C=C/c2ccc(C(N)=O)cc2)c1	728825635	IPBMNPUGVPBIPS-BLRBJFNZSA-N	431.452	1.123	50	20	IDGD	
CN(C)CCOc1ccc(CCNC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1	729233160	YRLGDGYFEGJEBC-UHFFFAOYSA-N	448.545	1.217	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)[C@@H]2C[C@@H](O)CN2C(=O)OCc2ccccc2)cc1	729528369	UHEXYOPCRBIZJW-QUCCMNQESA-N	441.484	1.547	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)[C@H]1CCN(c2ccc3c(c2)OCCO3)C1=O	730585834	PRYLWFZCMRKSBR-OAHLLOKOSA-N	440.456	1.079	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)[C@@H]1CCN(c2ccc3c(c2)OCCO3)C1=O	730591006	BQSVXUUMCMQJEA-INIZCTEOSA-N	425.441	1.297	50	20	IDGD	
O=C(NNC(=O)N1CCC([C@@H](O)c2ccc(F)cc2)CC1)c1ccc(-n2cnnn2)cc1	731043156	DPTKKYVGTSZGQZ-IBGZPJMESA-N	439.451	1.601	50	20	IDGD	
COc1ccc(CN([C@H]2CCS(=O)(=O)C2)[C@H](C)C(=O)NNC(=O)CC(C)C)cc1	731848716	MAGZYQVECSMIRR-WBVHZDCISA-N	425.551	1.266	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)[C@H]2CCCN(C(=O)Cc3ccccc3)C2)C[C@@H](C)O1	732260864	IPDAANRZRYNFJF-GGPKGHCWSA-N	430.549	1.114	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)c2cccc(NC(=O)CCn3ccnc3)c2)C[C@@H](C)O1	732261471	MXYRXUPEFRTIGD-IAGOWNOFSA-N	442.520	1.172	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)NCc2ccc(N(C)S(C)(=O)=O)cc2)cc1C	732475289	AYGZGOKTJJUHMH-UHFFFAOYSA-N	447.517	1.168	50	20	IDGD	
CON(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2ccc(Cl)cc2)c1	733003216	ANKYLMZLYGBXEV-UHFFFAOYSA-N	426.882	1.666	50	20	IDGD	
CC(C)OCCCn1c(NNC(=O)Cn2cc([N+](=O)[O-])cn2)nc2ccccc2c1=O	733265794	KYNNAAPZUSYMEO-UHFFFAOYSA-N	429.437	1.460	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)[C@H]1CC[C@H](C(F)(F)F)NC1=O	734250890	OAJUYBVUCQKDJJ-GXFFZTMASA-N	436.456	1.664	50	20	IDGD	
NS(=O)(=O)c1cc(Cl)c(Cl)c(C(=O)OCC(=O)NNC(=O)c2ccccc2)c1	734901908	HADNULVNKSSFHX-UHFFFAOYSA-N	446.268	1.259	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@H](CCN(C)C)C(C)(C)C)cc1	734952094	BVOMNYICNFTXCJ-QGZVFWFLSA-N	441.598	1.312	50	20	IDGD	
C[C@@H]1OC(C)(C)N(C(=O)OC(C)(C)C)[C@H]1C(=O)NNC(=O)[C@H]1COc2ccccc2O1	735837503	OYLXUCAJUYHXCE-APHBMKBZSA-N	435.477	1.734	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)NCC(=O)Nc1ccc(Br)cc1	738496708	UYKSCROQSPDUKU-UHFFFAOYSA-N	435.278	1.935	50	20	IDGD	
Cc1ccc(OCCC(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)c(Br)c1	742367353	UYVPMMYNTOARRS-LLVKDONJSA-N	434.312	1.044	50	20	IDGD	
CC(C)c1nn([C@H]2CCS(=O)(=O)C2)cc1C(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	742463297	LEXBUMFGBJZDJA-AWEZNQCLSA-N	435.462	1.349	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C[C@H](C)/N=C2/NS(=O)(=O)c3ccccc32)cc1	743320781	RBPARIOKONQESH-AWEZNQCLSA-N	444.513	1.293	50	20	IDGD	
CS(=O)(=O)NCCc1ccc(C(=O)NNC(=O)Nc2ccc(OC(F)F)cc2)s1	743832621	XOUQYBFRAXWJPZ-UHFFFAOYSA-N	448.473	1.908	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)CN2CCN(Cc3c(F)cccc3Cl)CC2)cc1	744384714	GPUQQDIFBOJCHF-UHFFFAOYSA-N	429.883	1.930	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@@H](C)CCOc2ccccc2)cc1	744455773	MGORBFJRLJESGQ-KRWDZBQOSA-N	433.530	1.868	50	20	IDGD	
C[C@H](OC[C@H]1CCCCO1)C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	744619870	BHRNOAILKQAVQN-JKSUJKDBSA-N	427.523	1.125	50	20	IDGD	
O=C(CCNC(=O)c1ccc2ccccc2c1)NNC(=O)c1ccc(-n2cnnn2)cc1	746578535	WZHLLWNEKBSZET-UHFFFAOYSA-N	429.440	1.397	50	20	IDGD	
C[C@@H](Oc1cccc(C=NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)c1)C(=O)O	746683019	QPKURNQKTSXYFB-SNVBAGLBSA-N	425.850	1.603	50	20	IDGD	
CC[C@H](NC(=O)NNC(=O)Cc1cn2ccccc2n1)c1ccccc1OCC(=O)NC	746759134	PPBDQERBHMPAOI-KRWDZBQOSA-N	438.488	1.483	50	20	IDGD	
COc1cc(C)nc(NNC(=O)NNC(=O)[C@@H](C)Oc2cccc(Br)c2)n1	747491932	YIHHOUNRRKVXIQ-SNVBAGLBSA-N	439.270	1.681	50	20	IDGD	
Cc1ccc(N2C(=O)C[C@@H](C(=O)NNC(=O)C(=O)N3CCCC3)[C@H]2c2cccs2)cc1	748246587	CXQKLMVSNMDPPH-APWZRJJASA-N	440.525	1.921	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@](F)(C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)C1	748285533	JFBIMPFSEAIQRX-HXUWFJFHSA-N	433.440	1.688	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)[C@@H]1CC(=O)N(c2cn[nH]c2)C1	748527239	KTBOJDBOHBTHCD-WDEREUQCSA-N	436.266	1.140	50	20	IDGD	
O=C(NNC(=S)NC[C@H]1CCOC1)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	749646846	MIBOLTIDGZJEAG-MRXNPFEDSA-N	437.529	1.534	50	20	IDGD	
C[C@@H](NC(=O)CC1CCCCC1)C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	749837685	FXVHZTNESRAQJM-CQSZACIVSA-N	438.550	1.173	50	20	IDGD	
COc1cc(C)c(C=NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1OC	751516016	DGPIKLZFEKXTPM-UHFFFAOYSA-N	447.513	1.797	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)N[C@H]1CCO[C@@H](c2ccc(F)cc2)C1	754136959	WYRDPICPDROBJA-FUHWJXTLSA-N	425.424	1.666	50	20	IDGD	
O=C(CCCc1ccccc1)NNC(=O)NC1CCN(S(=O)(=O)C(F)(F)F)CC1	755148490	LCICPXHRPILEHI-UHFFFAOYSA-N	436.456	1.654	50	20	IDGD	
CCOc1ccc(NC(=O)NNC(=O)[C@H](C)CC)cc1S(=O)(=O)N1CCOCC1	755545543	IOUVWOUEXWFXIB-CYBMUJFWSA-N	428.511	1.305	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)ccc1N1CCCC1=O	755591521	GNWNNKBWEXOXAW-SFHVURJKSA-N	426.429	1.815	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)Nc2ccc(C)cc2OCC(=O)N(C)C)c1	756204855	ZZJCIMSVVFBKKQ-UHFFFAOYSA-N	430.461	1.946	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)Nc1cc(Br)ccc1-n1cccn1	756488160	LGPFSIWGJMPWLM-LLVKDONJSA-N	426.271	1.839	50	20	IDGD	
CCN(CC)CCOc1ccc(NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1	756511263	MVONQDHRRSAYNQ-UHFFFAOYSA-N	438.492	1.849	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)Nc1cnn(CC(=O)NC2CC2)c1	756794819	DQBYHOJPJFRIGK-AWEZNQCLSA-N	436.472	1.935	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)Nc1cnn(-c2ccccc2Br)c1	757775160	GIOWJGVFCRIAKR-LLVKDONJSA-N	426.271	1.839	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(C)ncn2)c1	758042895	FCOYXOUAUVIFAP-UHFFFAOYSA-N	441.469	1.669	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)c1ccc(Sc2ccc([N+](=O)[O-])cc2)cc1	758050422	CHNOHDXSOGTPGZ-LLVKDONJSA-N	438.487	1.445	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CCCCCC[C@H]1C(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1	758184269	OLVZIZYIKDLFNV-RRFJBIMHSA-N	446.570	1.368	50	20	IDGD	
O=C(NNC(=O)[C@@]12CCC(=O)N1c1ccccc1C(=O)N2Cc1ccccc1)NC1CC1	759589568	FRWBXSPXIORJGP-HSZRJFAPSA-N	433.468	1.659	50	20	IDGD	
CCS(=O)(=O)N1CCC(C(=O)NNc2ccc(C(=O)OC)cn2)(c2ccccc2)CC1	759729495	VYRFSBBPGFNOIS-UHFFFAOYSA-N	446.529	1.695	50	20	IDGD	
C[C@@H](CC(=O)NNC(=O)Cc1ccc(Cl)cc1)NS(=O)(=O)c1cccnc1Cl	760300759	HKLLVQCLYPSVBI-NSHDSACASA-N	445.328	1.835	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C[C@@H](C)NS(=O)(=O)c1cccnc1Cl	760562447	UUYABBXZBNROMB-LLVKDONJSA-N	426.882	1.262	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1)c1cccc(C(=O)c2ccccc2)c1	761431884	VHSPDDJTZLDMGJ-KDOFPFPSSA-N	429.498	1.539	50	20	IDGD	
CCOC(=O)c1cnn(-c2ccc(NC(=O)NNC(=O)CN(C)C)cc2)c1C(F)(F)F	763266243	PJDFATOEOVDRTC-UHFFFAOYSA-N	442.398	1.782	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)N[C@@H]1CCCC[C@@H]1N1CCOCC1	763526752	PAWXOACMVIENKR-CVEARBPZSA-N	427.546	1.265	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2c(F)cc(F)cc2F)cc(OC)c1OC	763540763	ZMNXJPSNKJDAHD-UHFFFAOYSA-N	427.335	1.529	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)cc1F	763540781	ZTQASBXPRZVAII-UHFFFAOYSA-N	449.391	1.038	50	20	IDGD	
CCc1nnc(-c2cccc(NC(=O)C(=O)NNC(=O)c3ccc(OC)c(OC)c3)c2)o1	763550428	FWYACWJNVKDIQH-UHFFFAOYSA-N	439.428	1.716	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)Nc1ccc(F)cc1OCC(F)F	763572008	KMZLPUFNMFMOAD-HNNXBMFYSA-N	439.346	1.396	50	20	IDGD	
CCOC(=O)c1cc(F)c(F)cc1NC(=O)C(=O)NNC(=O)COc1cc(C)cc(C)c1	763648186	ABCCPPLZURIGTF-UHFFFAOYSA-N	449.410	1.923	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)cc1N1CCOC1=O	763695815	YDGSXHPJOKNOLQ-UHFFFAOYSA-N	446.847	1.770	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)C(=O)Nc2ccccc2N2CCCCC2)c2ccccc2c1=O	763786546	QIINKTSFXJYBFM-UHFFFAOYSA-N	448.483	1.324	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2cc(F)c(OC)cc2F)c2ccccc2c1=O	763787408	ZXVHAKJJMMVBSG-UHFFFAOYSA-N	445.382	1.103	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)OCC(=O)N2	763850914	BQEKTKXKWDKWHF-ZDUSSCGKSA-N	448.435	1.724	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cc(C(N)=O)ccc2C)cc1	763860448	HDWWZAOCQMPSRA-CYBMUJFWSA-N	428.445	1.046	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cc(CC(C)C)nn2C)cc1	763860503	HXMAOZRVNFPVCN-AWEZNQCLSA-N	431.493	1.571	50	20	IDGD	
COC(=O)C(C)(C)c1ccc(NC(=O)C(=O)NNC(=O)Cc2c[nH]c3ccccc23)cc1	763860638	KXDNKMCLJFPQMT-UHFFFAOYSA-N	436.468	1.947	50	20	IDGD	
Cn1c(=O)oc2cc(NC(=O)C(=O)NNC(=O)c3ccc(Br)s3)ccc21	763940449	HGVJRGAYQDSIIX-UHFFFAOYSA-N	439.247	1.355	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)CN(C(=O)OC(C)(C)C)CC2	763996276	OBFPVCFHMXYJMS-UHFFFAOYSA-N	441.488	1.718	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)[C@@H]1CC(=O)N(c2ccc3c(c2)OCCO3)C1	764042997	NNNITAFWGPWLRE-CYBMUJFWSA-N	443.481	1.456	50	20	IDGD	
Cn1c(=O)n(C)c2cc(NC(=O)C(=O)NNC(=O)c3cccc(Br)c3)ccc21	764063507	QBFDPQCOJRFPSI-UHFFFAOYSA-N	446.261	1.039	50	20	IDGD	
CCOC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)cc1C#N	764127075	SOSIRAFEGAUUQK-UHFFFAOYSA-N	445.819	1.885	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)CCN3C(C)=O)o1	764139527	WSKJCXOADSHIGL-UHFFFAOYSA-N	441.488	1.430	50	20	IDGD	
CCC(C)(C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)cc1	764152101	PJUXATVNADRUES-SFHVURJKSA-N	438.484	1.695	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2O1)C(=O)Nc1ccccc1C(=O)N1CCCCC1	764155353	ZFSYYHCHSOUZFZ-LJQANCHMSA-N	436.468	1.402	50	20	IDGD	
CCOCCCNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2ccc(C#N)cc2)c1	764181320	AXQVYCSLTRAZCZ-UHFFFAOYSA-N	437.456	1.114	50	20	IDGD	
CCN1CCN(c2ccc(NC(=O)C(=O)NNC(=O)CCc3ccccc3)c(C)c2)CC1	764191555	AEYPFGGSIWLCQI-UHFFFAOYSA-N	437.544	1.856	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)CCCc2ccccc2)cc1	764228235	WGJGNOOJUQLBBY-UHFFFAOYSA-N	432.502	1.557	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)C(=O)Nc1ccc(C(=O)NCc2ccccc2)cc1	764268678	OQWYQGNGNCEDBL-UHFFFAOYSA-N	431.452	1.340	50	20	IDGD	
CCn1cnnc1-c1cccc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c1	764350797	LTIVQLYBEPLANZ-UHFFFAOYSA-N	444.455	1.550	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)C(=O)Nc1cccc(C(=O)NCc2ccccc2)c1	764388787	JCKFEOMPOUSNPJ-UHFFFAOYSA-N	431.452	1.720	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(Sc2nc(C)cs2)cc1	764401918	ZKURHQVVCBPJRJ-LBPRGKRZSA-N	438.531	1.740	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NCc2ccc(N3CCCS3(=O)=O)cc2)cc1C	764774504	WYPXVHUWIDSAPG-UHFFFAOYSA-N	446.529	1.753	50	20	IDGD	
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	765315103	AQTUGHUKPCUHFG-HNAYVOBHSA-N	430.530	1.555	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)c1sccc1S(=O)(=O)C(F)F	765322990	NBAPJZLCZJZSBB-UHFFFAOYSA-N	441.478	1.810	50	20	IDGD	
CCOC(=O)NNC(=O)C(=O)Nc1ccc(CN2CCN(Cc3ccccc3)CC2)cc1	765407952	BZGIZIDGEPTCEP-UHFFFAOYSA-N	439.516	1.720	50	20	IDGD	
CC(C)(C)OC(=O)N1CCO[C@H](CC(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)C1	765565302	MVLMWIQELNVKPU-GFCCVEGCSA-N	435.506	1.925	50	20	IDGD	
COC(=O)c1cc(C(=O)NNC(=O)c2cc(-c3ccccc3OC)[nH]n2)cc([N+](=O)[O-])c1	765601771	UDYSAFRLIPWYTA-UHFFFAOYSA-N	439.384	1.855	50	20	IDGD	
O=C(Cc1ccc(OC(F)F)cc1)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765731683	AVWFUMUJCIUKMG-UHFFFAOYSA-N	446.454	1.436	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cc(OC)c1C	765737334	YCXXRBJHUUKJDL-UHFFFAOYSA-N	440.500	1.231	50	20	IDGD	
O=C(COCCc1ccccc1)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	765754896	AHWBBHQQTKNSLJ-UHFFFAOYSA-N	444.963	1.864	50	20	IDGD	
CN(Cc1ccccc1)S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2cnccn2)cc1	766260739	UVXFOMNUXJLHOY-UHFFFAOYSA-N	440.485	1.379	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)c3c(C)oc(C)c3C)CC2)cc1	766635830	GIXQHGLMRMOHAD-UHFFFAOYSA-N	448.545	1.281	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cccnc3-n3cccn3)CC2)cc1	766648660	JQMZNDFUZTVNQS-UHFFFAOYSA-N	433.516	1.155	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)Cn1cnc2ccccc21	766659892	HYJMCFCEYJJTQJ-UHFFFAOYSA-N	440.935	1.655	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)C2CCC(C(F)(F)F)CC2)CC1	769998827	AYUWPZNEJYCZDM-UHFFFAOYSA-N	449.499	1.830	50	20	IDGD	
COc1cc(C)nc(NNC(=O)[C@@H](C)NS(=O)(=O)c2cccc(C(F)(F)F)c2)n1	771027717	IHHPJSFRECZTIF-SNVBAGLBSA-N	433.412	1.623	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)[C@@H]3CCCCO3)CC2)cc1	772222400	NOYNQEWNJGYFLD-SFHVURJKSA-N	439.534	1.203	50	20	IDGD	
O=C(CCCNc1ccc([N+](=O)[O-])cc1)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772897782	MCPVNTACZIBSGL-UHFFFAOYSA-N	433.852	1.904	50	20	IDGD	
COC(=O)c1c(F)cccc1NNC(=O)c1nc(C)n(-c2n[nH]c(C(F)(F)F)n2)n1	773638231	KXHMZOZBOJZWQP-UHFFFAOYSA-N	428.306	1.395	50	20	IDGD	
CC(=O)N1CCN(Cc2ccc(NC(=O)C(=O)NNc3c(F)cccc3F)cc2)CC1	773705775	DVNPIQDTDGERRG-UHFFFAOYSA-N	431.443	1.711	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)NCc1ccc(S(N)(=O)=O)cc1C	775201252	INDDJYNZLRDROJ-UHFFFAOYSA-N	438.531	1.274	50	20	IDGD	
CC[C@H]1Oc2cc([C@@H](C)NCC(=O)NNC(=O)Cc3nc(C)cs3)ccc2NC1=O	775462936	GPGSJRBUXPORGW-IUODEOHRSA-N	431.518	1.602	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)NCc2ccccc2OCCN2CCOCC2)c1	776618989	MPXUQWRKVXTNIE-UHFFFAOYSA-N	448.545	1.627	50	20	IDGD	
COc1ccc(S(=O)(=O)C[C@@H](C)C(=O)NNc2cccc(S(C)(=O)=O)c2)cc1	776720576	DMVLEJMHFIGPEH-CYBMUJFWSA-N	426.516	1.652	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)c1ccc(S(=O)(=O)Nc2ccccc2)cc1	778443276	OKBBDMZEHNXPOS-UHFFFAOYSA-N	448.501	1.773	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)CC(=O)NCC(F)(F)F	779643636	XBHZGNVQGLEQJA-MRVPVSSYSA-N	426.189	1.432	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccccc1S(=O)(=O)NC1CC1)c1cc2c(s1)CCC2	780365933	PHTRSCXNKHDODE-UHFFFAOYSA-N	441.556	1.301	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)[C@H]1C[C@]12CCN(C(=O)OC(C)(C)C)C2	780715527	JUSXCCHOQJUHSM-XCLFUZPHSA-N	441.529	1.489	50	20	IDGD	
N#Cc1ccc(N2CCC[C@@H](NC(=O)NNC(=O)COc3ccccc3C#N)C2=O)cc1	780893504	AKNSCBLCCQIRIR-GOSISDBHSA-N	432.440	1.335	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)nc1Br	781557459	QUSBQGFJANHSKS-UHFFFAOYSA-N	440.250	1.953	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)NCc1ccccc1CN1CC[C@H](O)C1	781783533	YSMJAHOWPRVWLN-SFHVURJKSA-N	428.489	1.171	50	20	IDGD	
Cn1ncc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)c1C(F)(F)F	782123100	BJRNXBXPZCLFKE-UHFFFAOYSA-N	439.329	1.368	50	20	IDGD	
COC(=O)CCc1ccc(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)cc1	782892884	GRDOJFKLICZKSB-UHFFFAOYSA-N	437.456	1.008	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)nc2ccccc21	782894174	OCYAWWBIGXENKR-UHFFFAOYSA-N	430.808	1.464	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2ccc(C)c(S(=O)(=O)N3CCCCC3)c2)nc(C)n1	783325226	XNAPSEUUYSBYQS-UHFFFAOYSA-N	446.533	1.658	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)N1CCCN(c2nnc(C(F)(F)F)s2)CC1	786117460	LWDJRGIITRSGDL-UHFFFAOYSA-N	429.428	1.448	50	20	IDGD	
COC(=O)CCc1cccc(NC(=O)C(=O)NNC(=O)c2cc(OC)cc(OC)c2)c1	786415099	WQHIFPQQNCJHFQ-UHFFFAOYSA-N	429.429	1.209	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2cccc(F)c2)cc1S(=O)(=O)N1CCCC1	787556425	NRCXFKJZKOTZHN-UHFFFAOYSA-N	436.465	1.701	50	20	IDGD	
CNC(=O)CCCCC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	788624482	KYMVKRUFXTZYOZ-UHFFFAOYSA-N	438.531	1.616	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)ccc1Cl	789746163	INVUEYZTWZMRAG-UHFFFAOYSA-N	441.897	1.512	50	20	IDGD	
CCCCn1ncc(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1C(C)C	792268956	QOMYESXJPLRJSV-QGZVFWFLSA-N	429.477	1.733	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)C(=O)Nc1ccc(F)c(N2CCOC2=O)c1	797012756	TVTJTHQEQHPQHR-UHFFFAOYSA-N	448.432	1.366	50	20	IDGD	
CCc1ccnc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)c1	798119030	SPEJESHFVNKUQK-UHFFFAOYSA-N	445.545	1.963	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2CCCN2C(=O)OCC(F)(F)F)cc1C	798307922	JBGWTRAOKVGCJJ-ZDUSSCGKSA-N	430.383	1.553	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)NCCNS(=O)(=O)c2ccc(Cl)cc2F)c1	799368811	KUYTXOOTDSQPDB-UHFFFAOYSA-N	439.856	1.273	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)NCC2(OCCO)CCOCC2)c(C)n1C[C@H]1CCCO1	800670034	YUDGQCCYJHKXQC-DMMSUNFISA-N	431.533	1.865	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=O)COc2ccccc2O)ccc1F	801153052	PQJJSJRHTMYHJY-UHFFFAOYSA-N	439.465	1.402	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](n2cc(C(=O)NNC(=O)N=c3cc[nH]cc3)cn2)C1	802035483	HYKULOJSEVZOBI-INIZCTEOSA-N	429.481	1.739	50	20	IDGD	
N#CCCn1cc(/C=C(/C#N)C(=O)N2CC[C@@](O)(C(N)=O)C2)c(-c2ccc(Cl)cc2)n1	803163895	DTBWWBAKDDBXGH-SDQNTSPESA-N	438.875	1.473	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N2CC[C@H](C(=O)N3CCCC3)C2)cc1Br	805103779	DIUSNVHQPOZWSC-ZDUSSCGKSA-N	439.310	1.756	50	20	IDGD	
CN(CCO[Si](C)(C)C(C)(C)C)CC(=O)N1CCN(CC(=O)NC(C)(C)C)CC1	808706368	IEKJAYZIWWPJTJ-UHFFFAOYSA-N	428.694	1.999	50	20	IDGD	
CNC(=O)CNC(=O)c1cccc(NC(=O)C(=O)NNc2c(C)cccc2C(C)C)c1	813046855	JOTCNIXBNSYALD-UHFFFAOYSA-N	425.489	1.676	50	20	IDGD	
O=C([C@H](O)c1ccc(Cl)cc1F)N1CCN(S(=O)(=O)CBr)CC1	813510486	ZVQLSOOYBLJOBC-GFCCVEGCSA-N	429.695	1.339	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl	815751702	KUKXFXMDOJHFHI-UHFFFAOYSA-N	441.853	1.580	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)N(C)C)cc(OC)c1C	815751978	WZPWKXGHWRFGDZ-UHFFFAOYSA-N	436.490	1.344	50	20	IDGD	
Cc1ccc(C)c(S(=O)(=O)NCC(=O)NNC(=S)NCCc2cccs2)c1	838820579	NTWZTHMBHGUIHP-UHFFFAOYSA-N	426.589	1.381	50	20	IDGD	
CC(C)C[C@H](C(=O)NNC(=O)[C@@H]1COc2ccccc2O1)N1C(=O)[C@@H]2CC=CC[C@H]2C1=O	859449030	XTWQPNSWBYHTOS-NNFUDEMPSA-N	441.484	1.340	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)[C@H]2CC(=O)N(C(C)(C)C)C2)c2ccccc2c1=O	914750126	WJNVJWFQSUGMNP-HNNXBMFYSA-N	441.532	1.995	50	20	IDGD	
COc1ccc(COCC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1	916092532	WEWBAKHZHOBLHW-UHFFFAOYSA-N	447.513	1.458	50	20	IDGD	
CN(C)C(=O)N1CCC(C(=O)NNC(=O)c2ccc(CSc3nncn3C)cc2)CC1	916163952	JSAZMDZQAYEYAV-UHFFFAOYSA-N	445.549	1.262	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCc2cnn(Cc3ccccc3)c2)c2ccccc2c1=O	916579690	LGGNCQCLYDTXGI-UHFFFAOYSA-N	445.483	1.805	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H]2COc3ccccc3C2)c1	916636018	MSAIRWIUXCLXHB-KRWDZBQOSA-N	446.529	1.665	50	20	IDGD	
Cc1ccc(Cl)c(O[C@@H](C)C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1	917308306	ODSPZNQZSVIXDS-UGSOOPFHSA-N	448.859	1.946	50	20	IDGD	
COC(=O)CNS(=O)(=O)c1cccc(NS(=O)(=O)c2ccc(CCCl)cc2)c1	917743244	UMHFHBGKNDPWRG-UHFFFAOYSA-N	446.934	1.720	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)[C@H](CC(C)C)N2C(=O)[C@H]3CC=CC[C@H]3C2=O)c1O	919756923	NGVWYDAIOQOYDU-LZWOXQAQSA-N	429.473	1.528	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)N[C@@H](C)CN2CCC[C@@H](C)C2)nc1	919914338	GRGDKYBZDZCVMF-CVEARBPZSA-N	426.587	1.859	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNS(=O)(=O)c1ccc(C(=O)N(CC)CC)cc1	920309032	OQKMMRIITFWQCC-UHFFFAOYSA-N	449.529	1.956	50	20	IDGD	
COc1ccccc1CC(=O)NN=C(C)c1ccc(S(=O)(=O)N2CCNCC2)cc1	920376446	TUSDINYISNPNIH-UHFFFAOYSA-N	430.530	1.372	50	20	IDGD	
COc1ccc(C(C)=NNC(=O)N[C@H]2CCS(=O)(=O)C2)cc1CSc1ncccn1	920382054	VVVDMGOFPUAMKO-INIZCTEOSA-N	449.558	1.988	50	20	IDGD	
CCNC(=O)CN1CCCN(C(=O)/C(C#N)=C/c2cc(C)n(C[C@H]3CCCO3)c2C)CC1	920456145	YCPDPVSSAZZVIX-QJUACMODSA-N	441.576	1.861	50	20	IDGD	
CCCNC(=O)NNC(=S)Nc1cc(S(=O)(=O)N2CCOCC2)ccc1Cl	920997654	DFZDZZVPXSYQPS-UHFFFAOYSA-N	435.959	1.272	50	20	IDGD	
CN1CCN(Cc2cccc(CNC(=O)NNC(=O)COc3ccccc3C#N)c2)CC1	1318457959	LFMIAPHNPUBYJE-UHFFFAOYSA-N	436.516	1.215	50	20	IDGD	
CSc1nnc(CNC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)s1	1321602416	RPDFEOQFSZNKME-UHFFFAOYSA-N	429.553	1.006	50	20	IDGD	
CCc1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](F)Br)C3)n[nH]1	1777729837	YZOHMGTXJGSSSO-CKEIUWERSA-N	431.306	1.790	50	20	IDGD	
Cc1cn2c(=O)c(C(=O)N3CC[C@]4(C3)CN(C(=O)[C@@H](F)Cl)CCO4)cnc2s1	1777991616	WMDJGWHZFQVYPS-PXAZEXFGSA-N	428.873	1.042	50	20	IDGD	
COC(C)(C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C1	1778091860	VLMPERRLSXHSLJ-JBQOLUAXSA-N	447.536	1.059	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2nnsc2C2CC2)C1	1778294988	VSYQDDOUTRFDLG-IQUTYRLHSA-N	442.969	1.797	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccnc4c3OCO4)C2)C1	1780022780	JKGNHAJPYXYIIY-SGTLLEGYSA-N	440.294	1.285	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc([N+](=O)[O-])c4c3OCO4)C2)C1	1780237496	PJEIHZHFSDQDPM-BFUOFWGJSA-N	439.852	1.784	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccccc3F)C2)C1	1780479227	KPHDSYMZGDRTJJ-BHSKHCGUSA-N	441.463	1.403	50	20	IDGD	
C=C(CC(=O)OCC)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)Br)C2	1780741057	JLAVXBXIRZEDSV-SPYBWZPUSA-N	445.354	1.793	50	20	IDGD	
C[C@H](C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@](C)(Cl)CCl)C2)C1)n1ccccc1=O	1781229685	HZRAFRMTMMNZMQ-CCKFTAQKSA-N	430.332	1.476	50	20	IDGD	
N#Cc1cc(CC(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)ccc1F	1781299130	DKAMHHKSDJVCHR-WMZOPIPTSA-N	442.260	1.760	50	20	IDGD	
CCc1[nH]nc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)c1Cl	1781330863	IHBXHHFKOLOSCL-IUODEOHRSA-N	437.697	1.760	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cn1ccnc1)C2	1781900382	OIYGBZRQRJZVAN-IIDMSEBBSA-N	427.343	1.571	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CC1(O)CCC1)C2	1781904365	QCDDUQPRAMUCMY-HDMKZQKVSA-N	431.371	1.979	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(CCN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)C2)C1	1781937067	DHWTWLWCOFTSKM-KRWDZBQOSA-N	442.266	1.529	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc3nc[nH]c13)C2	1782173122	YCGYENHTCVGYIN-QLVMHMETSA-N	434.924	1.944	50	20	IDGD	
CCC[C@@H](NC(C)=O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CO[Si](C)(C)C)C2	1783186204	SHCZJOWXQZRTKU-DBXWQHBBSA-N	441.645	1.657	50	20	IDGD	
CO[C@@H](C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](C)Br)C2)C1)c1ccccc1	1783532874	ONBHTGVEPRGRHQ-GMBSWORKSA-N	425.323	1.987	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cnc4snnc4c3)CCO2)C1	1783537281	NIDGXLFLTZRYAJ-HWPZZCPQSA-N	440.323	1.313	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)CCc3cnc4[nH]ccc4c3)C2)C1	1783679119	YEBGYCCTHNTPQD-UTKZUKDTSA-N	434.924	1.579	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)COc3cccnc3)[C@H]2C1	1785147901	SGUZWQXOTKTASH-LLLHUVSDSA-N	440.338	1.614	50	20	IDGD	
CCN1CCC(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)CC1	1785638925	FIQBPLQJBSQXKV-KXBFYZLASA-N	430.387	1.579	50	20	IDGD	
O=C(CCc1cncnc1)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1	1788208227	QUMXPYHOUDBKAO-UHFFFAOYSA-N	444.300	1.537	50	20	IDGD	
Cn1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCBr)C[C@@H]32)c2cccnc21	1788460759	AEPKRSNQHRBSRP-QRTARXTBSA-N	449.349	1.952	50	20	IDGD	
CCOc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Br)C[C@@H]32)nn1	1789396503	IGMCKEKTNCKANC-TZQJONAQSA-N	445.289	1.159	50	20	IDGD	
CC(C)n1cnc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]3C2)n1	1789865891	IKYNMOQTFURVSG-NUXNZHGMSA-N	432.352	1.689	50	20	IDGD	
CCOC(CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)OCC	1791420513	PPQNFESWLYBIBD-QCQGSNGOSA-N	439.322	1.446	50	20	IDGD	
COc1c(Cl)cccc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21	1792023954	KPBQFBDJAGBGLX-YUDUHTQSSA-N	431.316	1.542	50	20	IDGD	
O=C(/C=C/C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2)NCc1ccccc1	1792941025	SLLWZQJBGRUBAA-AQCVZSBXSA-N	440.327	1.252	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1(c3ccc(O)cc3)CC1)C2	1795112973	IAJGAROJMLMWJR-ZSBFGKGUSA-N	437.334	1.798	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](NC(C)C)C(C)C	1796174116	FHIICAGUAYPJDR-PWTSDQHNSA-N	444.580	1.781	50	20	IDGD	
O=C(/C=C\c1c[nH]c2ccccc12)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1	1796188300	NIPPHXRSILMFAX-BMIDJGPBSA-N	443.312	1.813	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(CCN3CCCC3)nc1)C2)[C@H](F)Cl	1796363681	XCTCVPUMSKTQNN-NBMJBFSESA-N	438.931	1.458	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1CCCCC1)C2	1796441264	PITNAVSFBRHGAQ-PHHZKWSHSA-N	429.521	1.290	50	20	IDGD	
Cc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](O)CCl)C3)c2cc(O)ccc2n1	1797352090	LKXUHCCPWDGTLR-JSVGYJQLSA-N	433.892	1.052	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccn(C(F)F)n1)C2)[C@@H](F)Br	1799348865	CJKCOWDINBFZHL-JZSSXWJLSA-N	425.205	1.172	50	20	IDGD	
COc1ccc(F)cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Br	1799352266	NEXVHUWDQOSDTF-OWLDWWDNSA-N	433.249	1.728	50	20	IDGD	
Cn1cncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C#N)=C/c1ccc(F)cc1F	1800332379	FLPHCINKBBSAFT-QYFXKUKHSA-N	441.438	1.509	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)n1cccc1C=O)C2	1800756496	NJLBYBAFHYEAKB-AQDIXCGQSA-N	426.311	1.235	50	20	IDGD	
C[C@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(=O)nc3cccnn13)C2	1801962952	FDFYYQJSTCILBD-RVMXOQNASA-N	434.294	1.125	50	20	IDGD	
Cc1cnc2c(C(=O)N3CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]3c3cccnc3)cnn2c1	1803142987	QDDQRPPKSRNUGL-NXHRZFHOSA-N	442.907	1.352	50	20	IDGD	
Cc1nc(C(=O)NC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)co1	1805691298	VQCCYELJRWRPKJ-KXBFYZLASA-N	449.471	1.010	50	20	IDGD	
Cn1ncnc1C(=O)N1CC[C@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]1c1cccnc1	1808292639	ZUEGHQSYVXEHMR-HBUWYVDXSA-N	425.320	1.766	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)c2ccon2)[C@@H]1c1cccnc1	1808414896	PDNIPJDUVXEZPD-AMZMXHDESA-N	449.471	1.523	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)c1cn2c(F)cccc2n1	1812178037	OQEUWPAGXQEPFP-URLQWDBASA-N	445.882	1.788	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)COC(C)(C)C)[C@@H]1c1cccnc1	1813069141	VIIGVPNPLAHECW-DYESRHJHSA-N	433.553	1.276	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc(-n3cccn3)nc2)[nH]n1)[C@@H](O)CCl	1814873045	JLUIQEITSNUAFS-CVEARBPZSA-N	443.895	1.896	50	20	IDGD	
Cn1ccc2c(O)ncc(C(=O)N3CCCC[C@H]3c3cc(NC(=O)[C@@H](O)CCl)n[nH]3)c21	1814873909	SQCANWBXPNSZBZ-GJZGRUSLSA-N	446.895	1.908	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CN2CCOC2=O)n[nH]1	1815028855	RJYBAZYIXSCHTN-CMPLNLGQSA-N	428.287	1.637	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)C(C)(C)CNC(C)=O)n[nH]1	1815343046	VHJYGLBEJXAEPV-DZGCQCFKSA-N	427.933	1.818	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CN)[nH]n1	1815704412	SSHKFVCGZBIMAI-QWHCGFSZSA-N	428.921	1.493	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)cc(O)n1	1817475536	SDRSEVCAHBSDLU-GOSISDBHSA-N	449.276	1.118	50	20	IDGD	
Cc1cc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)cc(O)n1	1818051795	WCZDFHKFKPTDCM-GOSISDBHSA-N	449.276	1.118	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1	1822353220	KWDJSEUWLDURKW-SJXGUFTOSA-N	438.912	1.757	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@](C)(O)C(F)(F)F)[nH]n1	1822369982	KQKDZOXEJYLWMQ-ZSGNIPIJSA-N	426.823	1.969	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)C[C@@H]2CCCCO2)[nH]n1	1822410688	PKWKZMOKCRZOSD-RDJZCZTQSA-N	434.541	1.734	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2CCCCN2C)[nH]n1	1822412163	KVRQBINAOPWIOV-IRXDYDNUSA-N	433.557	1.259	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)Cc2cscn2)[nH]n1	1822413903	GHPOLYUYZIJPJL-OAHLLOKOSA-N	433.538	1.474	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CSc2nc[nH]n2)n[nH]1	1822713612	JEODBJCUGQVPKU-ZYHUDNBSSA-N	427.918	1.566	50	20	IDGD	
CC(C)(C)n1cc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)[C@@H](O)CCl)CC2)nn1	1824184727	DGAGNBAZEOUSRI-IRXDYDNUSA-N	425.961	1.866	50	20	IDGD	
Cc1[nH]nc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)c1F	1825610553	XRHBIGGIENABDX-MRXNPFEDSA-N	436.532	1.464	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CN1CCOCC1)CC2	1825642861	WFVOQGAYBCGZFO-QWRGUYRKSA-N	431.356	1.171	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CN1CCCCC1=O)CC2	1826003912	AKDXMRMEEYLMRB-VXGBXAGGSA-N	428.942	1.321	50	20	IDGD	
C[C@@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1)n1cccn1	1827055092	PNUVLWACUBUKFC-UWJYYQICSA-N	438.337	1.057	50	20	IDGD	
CC(=O)C(C)(C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827055530	BGWWCCDCNGYXQQ-FQEVSTJZSA-N	428.338	1.215	50	20	IDGD	
CC(=O)N1CCN(CC(=O)N2CCC([C@@H]3CCCCN3C(=O)[C@@H](F)Cl)CC2)CC1	1827607917	BOPMUZGTCBNKAZ-PKOBYXMFSA-N	430.952	1.305	50	20	IDGD	
Cc1c(F)cccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)Br)C2)C1	1830164039	UNWDDQLSBDVZEW-AUUYWEPGSA-N	443.313	1.988	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2	1830535247	KENVCYPCZKXIKZ-ZQIUZPCESA-N	439.778	1.881	50	20	IDGD	
COc1ccc(Cl)c(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)c1	1830738363	NWMUSHXDYKGVFE-VQIMIIECSA-N	447.315	1.018	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3c(C)c[nH]c3C)CCO2)C1	1830903689	KKAGKNIGBRIQKM-RXVVDRJESA-N	441.956	1.274	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H]2CCC(=O)NC2)CC1	1831649751	NGABTZQKULAJTE-IMJJTQAJSA-N	428.371	1.916	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1COc3ccccc3O1)CCO2	1832501030	YUGMBXBEPSMBKL-RRMPHLOHSA-N	438.908	1.300	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3ccc(OC)nc3)CCO2)C1	1832581325	DDWJZGFOAWTCOE-UTKZUKDTSA-N	439.940	1.497	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)CCOc3ccccc3)CC2)CC1)[C@H](O)CCl	1833308932	DVBXHNLRZJRSSH-HXUWFJFHSA-N	437.968	1.627	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ncc(Cl)cn3)CCO2)C1	1833781469	GCYXWGNAIFJYOR-KSSFIOAISA-N	431.320	1.608	50	20	IDGD	
O=C(CCc1ccc[nH]1)N1CCOC[C@]2(C1)CN(C(=O)CCBr)CCO2	1834822630	ZCTAVTURFATLFI-SFHVURJKSA-N	428.327	1.189	50	20	IDGD	
O=C(Cc1cccnc1)NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1	1834878665	URBVSMDBSQXXRN-UHFFFAOYSA-N	437.382	1.981	50	20	IDGD	
CCc1cnc(C(=O)NC2CCN(C3CCN(C(=O)[C@H](O)CCl)CC3)CC2)s1	1835838192	FKZKDPDIZGRTSD-MRXNPFEDSA-N	428.986	1.490	50	20	IDGD	
CCCC(=O)N[C@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](Cl)CCC)C2)C1	1837671018	ZDKRBJGNILOYIS-GUXCAODWSA-N	431.961	1.155	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)c(C)n1	1838360578	VDIUEINZEKSEQU-OAQYLSRUSA-N	435.597	1.620	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)ccn1	1840033463	GBZPTRLKLQJHLT-KBXCAEBGSA-N	426.311	1.243	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@]3(C)CC=CCC3)C2)C1	1840036962	UKPWTTWNZZFBCD-KFKAGJAMSA-N	429.355	1.973	50	20	IDGD	
Cc1cc(F)ccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)CCBr)C2)C1	1840776630	MHQSWOPNXMSQMG-LJQANCHMSA-N	443.313	1.989	50	20	IDGD	
Cc1cc(C(=O)N2CCCC23CN(C(=O)CCC(=O)NN(C)C)C3)c(C(F)(F)F)o1	1842459313	CAKSWXXUXJTCSS-UHFFFAOYSA-N	430.427	1.797	50	20	IDGD	
Cc1cc(C(=O)N2CCCC23CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C3)on1	1842460218	YDPHMMVNYMWJHB-ZDUSSCGKSA-N	426.901	1.932	50	20	IDGD	
CCN(CC)[C@H](C(=O)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1)c1ccccc1	1843012148	JGKROGKRVHMHKT-QFIPXVFZSA-N	449.360	1.267	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1ccc3ccnn3c1)C2	1843416609	FNXFZBIXUSTVQG-MFKUBSTISA-N	433.472	1.285	50	20	IDGD	
COc1ccc2nc(C(=O)N3CCCC34CN(C(=O)c3cccc(B(O)O)c3)C4)ccc2c1	1843747057	VGIVDXAWUVJHFE-UHFFFAOYSA-N	445.284	1.054	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)CC1(O)CCC1)C2	1844693526	OQRFAQFXZDXAEH-UHFFFAOYSA-N	431.445	1.642	50	20	IDGD	
C[C@H](C(=O)N1CC2(CCCN2C(=O)[C@H](Br)Cc2ccccc2)C1)n1cnnn1	1845943052	QJXVRLYLBHOQNJ-GDBMZVCRSA-N	447.337	1.444	50	20	IDGD	
CC(C)(C)OC(=O)N1C(=O)CC[C@H]1C(=O)N1CCCC12CN(C(=O)C(Cl)Cl)C2	1846485710	NBUANFKAHYELMI-NSHDSACASA-N	434.320	1.920	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@@H](C(=O)NNC(=O)CCc3ccccc3O)C2)cc1	21775927	SLPCQTAPLCASKQ-GOSISDBHSA-N	445.541	1.882	50	20	IDGD	
O=C(Cn1ccccc1=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	25402190	GRJIWFKTWBTTKI-UHFFFAOYSA-N	429.440	1.011	50	20	IDGD	
CSCC[C@@H](NC(=O)c1cccc(C)c1)C(=O)NNC(=O)CNC(=O)c1cccs1	725741049	KZUZLJKGWILNPG-OAHLLOKOSA-N	448.570	1.485	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)c(Cl)c1	730998277	RSGBCZGBZKWEMU-UHFFFAOYSA-N	425.894	1.739	50	20	IDGD	
COC(=O)C[C@H]1c2cc(OC)c(OC)cc2CCN1[C@@H](C)C(=O)NNC(=O)CC(C)C	732197014	JPYDWQPJRYAAQY-YOEHRIQHSA-N	435.521	1.748	50	20	IDGD	
O=C(COC(=O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1)NNC(=O)c1ccccc1	733560249	YPMQFXYCXYHMGP-CYBMUJFWSA-N	446.441	1.265	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)[C@@H]2CC(=O)N(C)[C@H]2c2cccc(Cl)c2)C[C@@H](C)O1	734543610	QJIGMONQYVUAJE-BBNKJRPNSA-N	436.940	1.506	50	20	IDGD	
CS(=O)(=O)CC[C@@H](Cc1cccc(Br)c1)C(=O)NNc1ncccn1	741208806	JONOALZHKGNBPW-ZDUSSCGKSA-N	427.324	1.976	50	20	IDGD	
O=C(NCc1ccco1)NNC(=O)c1sccc1S(=O)(=O)N1CCSCC1	742376093	ACRCUKQQILAVFK-UHFFFAOYSA-N	430.533	1.223	50	20	IDGD	
CC(C)(C)OC(=O)N(CC(=O)NNc1ccccc1S(C)(=O)=O)C[C@@H]1CCCO1	743369141	ZZFOUSZHXFMGRM-AWEZNQCLSA-N	427.523	1.949	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)[C@H]2CCN(c3ccc(Cl)cc3)C2=O)cc1	744842745	QVWKUIFKHCGPIE-KRWDZBQOSA-N	440.843	1.569	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)c1ccccc1OCc1cn2ccccc2n1	746367096	HBMHZAVJTVMEBG-AWEZNQCLSA-N	428.470	1.109	50	20	IDGD	
COC(=O)/C=C\c1ccc(S(=O)(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)cc1	747597479	YKOWSVZKCNQNRY-XFFZJAGNSA-N	431.470	1.438	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)c1ccc(S(=O)(=O)CCCC#N)cc1	748211365	JZKIMRZEBTXLFF-UHFFFAOYSA-N	425.470	1.795	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N[C@H]1CC(=O)N(C(C)(C)C)C1	750660168	PGCQRRRAVIJXHQ-AAEUAGOBSA-N	441.326	1.946	50	20	IDGD	
COc1cc(OC)cc(N2C[C@H](C(=O)NNC(=O)COc3cc(C)cc(C)c3)CC2=O)c1	752399033	OUMITKYVZWYMOJ-MRXNPFEDSA-N	441.484	1.900	50	20	IDGD	
CN1C(=O)N[C@]2(CCC[C@@H]2CNC(=O)NNC(=O)CSc2ccc(Cl)cc2)C1=O	753024649	OQEVBTAOBFCVPD-ZMZPIMSZSA-N	439.925	1.483	50	20	IDGD	
CCn1c(=O)c2ccccc2n(CC(=O)NNC(=O)c2cc(C)nc3ccccc23)c1=O	754777320	BYZZXIRYFRBYKA-UHFFFAOYSA-N	431.452	1.501	50	20	IDGD	
C[C@@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)NNc2ccc(C(F)(F)F)nn2)C1=O	755197174	ACGPLWKCGUXIRA-INIZCTEOSA-N	426.330	1.545	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)n([C@H]2CCS(=O)(=O)C2)n1	755529127	CEQCLYRRGAJGNM-CVEARBPZSA-N	449.533	1.788	50	20	IDGD	
CCNC(=O)COc1ccc(NC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc1	755644690	AFSALEXKQWOZQU-UHFFFAOYSA-N	438.444	1.559	50	20	IDGD	
Cc1cc(C(=O)NC(C)C)ccc1NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	756167635	GTOVKAPZLKFDCR-UHFFFAOYSA-N	436.472	1.847	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)Nc1ccc(S(=O)(=O)NCC(F)(F)F)cc1	756640386	LVQABFPLGARRLF-UHFFFAOYSA-N	431.396	1.318	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)Nc2ccnc(C(=O)N(C)C)c2)c2ccccc2c1=O	756646934	NGYHNCGMILBOQK-UHFFFAOYSA-N	437.460	1.541	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)cc1-n1cnnn1	756745785	FYHAGMTZEJIEST-UHFFFAOYSA-N	425.434	1.589	50	20	IDGD	
CC(C)(C)n1cc(NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cn1	756794628	JZEGCWFBDOWNPF-UHFFFAOYSA-N	434.522	1.889	50	20	IDGD	
CCCCN1C(=O)CC[C@@H](C(=O)NNc2ccc(C(N)=O)nn2)[C@H]1c1ccccc1OC	757400047	PRSDAMGNIAJHGB-FOIQADDNSA-N	440.504	1.807	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)[C@@H](Sc1cc(F)ccc1F)c1ccccc1	758029422	KSDIACOSBLAIAC-ZBEGNZNMSA-N	443.497	1.883	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Cc2cccc(C(=O)OC)c2)c1	758043189	KMRLKXQXGJGILY-UHFFFAOYSA-N	447.513	1.507	50	20	IDGD	
O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)N1CCN(S(=O)(=O)CBr)CC1	758511591	BKIFHVFNJJWKIF-UHFFFAOYSA-N	445.295	1.376	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@H](C#N)[C@@H](NC(=O)NNC(=O)c2cccc(OC(F)F)c2)C1	758774868	VHGSLOJEVJHPOZ-OCCSQVGLSA-N	439.419	1.991	50	20	IDGD	
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)C(=O)Nc1ccccn1	758835901	ZUUGKBJXTFZBRG-QGZVFWFLSA-N	436.472	1.032	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)CCNS(=O)(=O)c1cccs1	761632514	FPYKHNDCOGBFAC-UHFFFAOYSA-N	429.545	1.365	50	20	IDGD	
Cc1cc(Cl)c([N+](=O)[O-])cc1S(=O)(=O)NNC(=O)[C@@H]1COc2ccccc2O1	761887613	WGMCJADLSTXFOW-AWEZNQCLSA-N	427.822	1.706	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2c[nH]c3ccccc23)cc1C	763535438	CLMFRCDAQJXIPN-UHFFFAOYSA-N	443.485	1.638	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)c(C)c1	763540325	SRSORERKFSYALZ-UHFFFAOYSA-N	431.445	1.819	50	20	IDGD	
CC1CCN(c2ccc(NC(=O)C(=O)NNC(=O)[C@H]3COc4ccccc4O3)cc2)CC1	763571377	MSWQCZVYGUIVLF-HXUWFJFHSA-N	438.484	1.849	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)n(C2CCOCC2)n1	763694390	GQIYRBVOLUUFHN-UHFFFAOYSA-N	435.868	1.361	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)C(=O)Nc1ccnn1Cc1ccccc1	763803726	NBQIPPNJGNSOLL-UHFFFAOYSA-N	438.400	1.005	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)C(=O)Nc1cccc(NC(=O)C2CC2)c1	763803982	IXKQOOTVUYUHBO-UHFFFAOYSA-N	441.400	1.108	50	20	IDGD	
CCCCN1CCc2ccc(NC(=O)C(=O)NNC(=O)COc3ccccc3C#N)cc21	763814126	PUSPEMHWNKHECV-UHFFFAOYSA-N	435.484	1.886	50	20	IDGD	
CC(=O)N(Cc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C)cc2)cc1)C(C)C	763820019	DAMOLUSIJVCQIJ-UHFFFAOYSA-N	440.500	1.917	50	20	IDGD	
CCCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(CC)cc2)cc1	763831855	NVTHVWDLZAMLIS-UHFFFAOYSA-N	432.502	1.800	50	20	IDGD	
CCOC(=O)/C=C/c1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)cc1	763872870	PODNBRHFKQBBMZ-BLXFFLACSA-N	443.431	1.955	50	20	IDGD	
CN1C(=O)c2ccc(NC(=O)C(=O)NNC(=O)CCSc3ccc(F)cc3)cc2C1=O	763896053	WZOWVNIPVFWSDR-UHFFFAOYSA-N	444.444	1.320	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)OCCO3)cc1OC	763911363	LFVWTNIIPXYSLL-UHFFFAOYSA-N	429.429	1.655	50	20	IDGD	
CN1CCN(Cc2cccc(NC(=O)C(=O)NNC(=O)Cc3ccc(Cl)cc3)c2)CC1	763936118	DXJFNJSGDFRHOA-UHFFFAOYSA-N	443.935	1.416	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Br)s2)cn1	763940491	IIHOJIPBXJSSPD-UHFFFAOYSA-N	443.279	1.331	50	20	IDGD	
O=C(NNC(=O)c1ccc(COc2ccccc2)o1)C(=O)Nc1cnn(-c2ccncc2)c1	763949289	AUEABMVNUPTBBK-UHFFFAOYSA-N	446.423	1.839	50	20	IDGD	
CCCCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2C)cc1	763957658	IOCIWPOTHLAXOV-UHFFFAOYSA-N	432.502	1.937	50	20	IDGD	
Cc1cc(S(C)(=O)=O)ccc1NC(=O)C(=O)NNC(=O)C1=S=C2CCCCCC2=C1	763962214	NRZSUCMNPRDHFG-UHFFFAOYSA-N	449.554	1.467	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)CSc2ccccc2O)c1	764046166	AQYYZFATQDIEAB-UHFFFAOYSA-N	437.543	1.976	50	20	IDGD	
COc1ccc(CN2C[C@@H](C(=O)NNC(=O)CSc3ccccc3O)CC2=O)cc1	764048462	QPTHVPOBEKTKIA-HNNXBMFYSA-N	429.498	1.689	50	20	IDGD	
CCOCCOc1ccc(Br)cc1NC(=O)C(=O)NNC(=O)[C@@H](C)CC	764081994	MENCRFTZODEQFM-NSHDSACASA-N	430.299	1.996	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccccc2I)c(O)c1	764109962	NGCBUYGXZLYQGD-UHFFFAOYSA-N	439.209	1.705	50	20	IDGD	
COC(=O)c1cc(Br)ccc1NC(=O)C(=O)NNC(=O)CC(F)(F)F	764115601	UHWIBPMGIHLMCN-UHFFFAOYSA-N	426.145	1.274	50	20	IDGD	
CC[C@@H](C)Oc1cccc(NC(=O)C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1	764260010	MLKYGLGGDFKQGE-OAHLLOKOSA-N	440.504	1.656	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)C(=O)Nc1ccc(F)cc1I	764263255	BIMLTBANDXMAID-UHFFFAOYSA-N	442.188	1.154	50	20	IDGD	
Cc1cc(N2CCSCC2)ccc1NC(=O)C(=O)NNC(=O)CCc1ccccc1O	764281264	OTDHYSAJQLCLDQ-UHFFFAOYSA-N	442.541	1.973	50	20	IDGD	
CCOCC(=O)NNC(=O)C(=O)Nc1cccc(CS(=O)(=O)C2CCCCC2)c1	764325677	QORRAQNHRDGBLS-UHFFFAOYSA-N	425.507	1.057	50	20	IDGD	
CC(C)(C)NC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c1	764350411	FLNGZGFAHFKUHD-UHFFFAOYSA-N	448.483	1.800	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2ccc(-c3cc[nH]n3)cc2)n[nH]1	764376303	BIKBRBWSLUEFFI-UHFFFAOYSA-N	445.439	1.875	50	20	IDGD	
Cc1cc(Cl)ccc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	764467343	VKZZSHQROKCKIS-UHFFFAOYSA-N	437.905	1.744	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)OC(C)(C)C)c(C(=O)N2CCCC2)cc1OC	765388448	DBDNEWLCIAPQJL-UHFFFAOYSA-N	436.465	1.434	50	20	IDGD	
COc1ccc(S(N)(=O)=O)cc1C(=O)NNC(=O)c1cc(-c2ccc(C)c(C)c2)[nH]n1	765557605	BPWOUFNUFCTBPC-UHFFFAOYSA-N	443.485	1.424	50	20	IDGD	
CC(C)COc1cccc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)c1	765734312	YAZYXOCMUSMKNU-UHFFFAOYSA-N	438.528	1.940	50	20	IDGD	
Cc1ccc(C(=O)CCC(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)s1	765736452	SNLFUPZSYVXQDX-UHFFFAOYSA-N	442.541	1.625	50	20	IDGD	
O=C(NNc1cnccn1)C(=O)Nc1cccc(CS(=O)(=O)c2ccc(F)cc2F)c1	766257185	SPNMYZRQIRHRNE-UHFFFAOYSA-N	447.423	1.811	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)c1ccc(NC2CC2)nc1	766664820	VJKKSXKZPFJRPH-UHFFFAOYSA-N	442.951	1.888	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)[C@H](c1cccc(F)c1)N1CCOCC1	767354476	VJFCKZFHXBENJW-QFIPXVFZSA-N	443.475	1.441	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNS(=O)(=O)c2cc(Cl)c(F)c(C(=O)O)c2)cc1C	767735928	NKCJVDDPFRABIP-UHFFFAOYSA-N	443.840	1.742	50	20	IDGD	
CN(C)CCS(=O)(=O)c1ccccc1C(=O)NNC(=O)CSc1ccccc1O	767887572	UFVNYOIVLSDADW-UHFFFAOYSA-N	437.543	1.281	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3cnn(C)c3C(F)(F)F)n[nH]2)cc1OC	768277026	PAUPBNLPOBKVJN-UHFFFAOYSA-N	438.366	1.921	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3cn(C)nc3-c3ccncc3)n[nH]2)cc1OC	768278337	ZHILBRWMHJFYGW-UHFFFAOYSA-N	447.455	1.964	50	20	IDGD	
O=C(NNc1nc2ccccc2[nH]1)c1ccc2c(c1)S(=O)(=O)N(C[C@@H]1CCCO1)C2=O	768503761	IRCMGDFCUNOEGN-ZDUSSCGKSA-N	441.469	1.643	50	20	IDGD	
COc1ccc(-c2nn(CCC#N)cc2/C=C(\C#N)C(=O)NCc2ncn(C)n2)cc1OC	769123257	XYCOBUWBKYCPFG-CXUHLZMHSA-N	446.471	1.833	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)NCc2cccc(C(F)(F)F)c2)cn1	770224417	XKHYVTVXRDZYMY-UHFFFAOYSA-N	445.423	1.495	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)CCN3C(=O)[C@@H]4CCCC[C@H]4C3=O)nc21	770958846	PWJJUORSTGCICY-VXGBXAGGSA-N	429.481	1.295	50	20	IDGD	
O=C(CN1C(=O)[C@@H]2[C@@H](C1=O)[C@H]1C=C[C@H]2C1)NNC(=S)Nc1cccc(Br)c1	770994321	SPPKOHMLSVYLSW-CHPZLBCBSA-N	449.330	1.574	50	20	IDGD	
C[C@H](NS(=O)(=O)c1cccc(C(F)(F)F)c1)C(=O)NNc1ccnc(N(C)C)n1	771022015	ISXSCJREKXUKAF-JTQLQIEISA-N	432.428	1.372	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)C1(F)CCCC1	771912138	BPDZZDKQCOAOTP-UHFFFAOYSA-N	427.498	1.070	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)CCn1cnc2ccc(Br)cc2c1=O	771967284	FWWYNUMIKLKROU-SNVBAGLBSA-N	439.266	1.038	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)NCc2ccc(S(N)(=O)=O)cc2C)c1C	773362140	LFMQZHWYUOJIRN-ODLFYWEKSA-N	430.530	1.931	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NNC(=O)CNC(=O)OCC(F)(F)F)C1	773411548	NXSHZGZJYMBVFJ-SNVBAGLBSA-N	426.392	1.069	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cn(C)nc2C(F)(F)F)cc1	773527389	KKTUFINZWKOYPZ-SNVBAGLBSA-N	443.382	1.391	50	20	IDGD	
O=C1C[C@H](Cc2ccc(NC(=O)C(=O)NNc3ncc(Cl)cc3Cl)cc2)C(=O)N1	773678583	WTWTYQIQEXVECL-JTQLQIEISA-N	436.255	1.675	50	20	IDGD	
COC(=O)c1cc(OC)c(OC)c(OC)c1NC(=O)C(=O)NNc1cccc(C#N)c1	773680882	ITNMJEOHXMMTAI-UHFFFAOYSA-N	428.401	1.452	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2ccc(NC(=O)C3CC3)cc2C(F)(F)F)n1	773731702	UFGYNFRQKBWHSZ-UHFFFAOYSA-N	438.366	1.934	50	20	IDGD	
Cc1ccc(NC(=O)NNc2cccc(S(C)(=O)=O)c2)cc1S(=O)(=O)N(C)C	776464873	OMIJIWQSPCJKSE-UHFFFAOYSA-N	426.520	1.797	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc(Cl)cc(C(F)(F)F)c1)c1ccc(-n2cnnn2)cc1	777597115	NRRVLIFWKIHUFU-UHFFFAOYSA-N	446.798	1.958	50	20	IDGD	
COCc1cccc(CC(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)c1	777813473	QUFPKNVBZJFJNT-UHFFFAOYSA-N	444.963	1.994	50	20	IDGD	
CC[C@@H](C)[C@H](C)C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	779719193	LEJTXBHXBYBZLD-CVEARBPZSA-N	425.551	1.470	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CC(=NNC(=O)CSc2nnc(O)nc2O)c2ccccc21	779767557	GGLFXVVBDRSVTD-GFCCVEGCSA-N	446.489	1.865	50	20	IDGD	
COc1ccc(NNC(=O)Nc2cc(S(=O)(=O)N3CCOCC3)ccc2OC)nc1	782006180	CURVMCJHHLPAQD-UHFFFAOYSA-N	437.478	1.268	50	20	IDGD	
O=C(Nc1cnn(CC(=O)N2CCOCC2)c1)C(=O)NN(c1ccccc1)c1ccccc1	782822183	RYLJGQUTEHWRGU-UHFFFAOYSA-N	448.483	1.550	50	20	IDGD	
CCn1ncc2ccc(NC(=O)C(=O)NNc3ccc(S(=O)(=O)NC(C)C)cn3)cc21	783262114	BGMCYPRZHAATLG-UHFFFAOYSA-N	445.505	1.220	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NN[C@]2(C)CCS(=O)(=O)C2)c(OCc2ccccc2)c1	783426824	ONGODHXRRMJZMV-OAQYLSRUSA-N	431.514	1.711	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1ccc(Cl)c2ncccc12	784003968	BBHOAUPCGKIJMN-UHFFFAOYSA-N	431.861	1.466	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)c1cc2c(=O)n3ccccc3nc2n1C	784321780	DVQWXVMWUNLGTH-UHFFFAOYSA-N	425.832	1.923	50	20	IDGD	
Cc1cc(Br)ccc1NNC(=O)C(=O)Nc1ccc(C)c(S(N)(=O)=O)c1	784414244	HYCUSWCFEJMECS-UHFFFAOYSA-N	441.307	1.795	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccccc2Cl)cc1	784770489	LCKOFIKUDVHUKD-UHFFFAOYSA-N	426.882	1.347	50	20	IDGD	
COc1ccc(Cn2nccc2NC(=O)C(=O)NNc2cccc(S(C)(=O)=O)c2)cc1	784841175	MPDRJOVGXLLYGT-UHFFFAOYSA-N	443.485	1.425	50	20	IDGD	
COCCn1ccc2ccc(NC(=O)C(=O)NNC(=O)c3cc([N+](=O)[O-])ccc3O)cc21	785023955	RULSUSUQFWQKJN-UHFFFAOYSA-N	441.400	1.301	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@H](C(=O)NNc2nnc(-c3ccccn3)s2)[C@@H](C)O)cc1	788558638	SBHFZPYELMXHLT-DOMZBBRYSA-N	448.530	1.080	50	20	IDGD	
COCCNS(=O)(=O)c1cccc(C(=O)NNc2nnc(-c3ccccn3)s2)c1	788558677	SZKXNCLUQRZRQZ-UHFFFAOYSA-N	434.503	1.282	50	20	IDGD	
CC(C)(C)OC(=O)N1CC2(C[C@@H]2C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)C1	789290316	TUTFYKDKPRTENP-OAHLLOKOSA-N	428.445	1.119	50	20	IDGD	
O=C(CN1CCCc2ccccc21)NNC(=O)C(=O)Nc1nc2c(s1)CCCCC2	789731388	DMPNOXDFDGFRQA-UHFFFAOYSA-N	427.530	1.951	50	20	IDGD	
CN1C(=O)CCc2cc(NC(=O)C(=O)NNC(=O)[C@H]3OCC[C@H]3c3ccccc3)ccc21	789812709	MRKSFFPRMFPNDH-PXNSSMCTSA-N	436.468	1.254	50	20	IDGD	
C[C@]1(C2CC2)NC(=O)N(c2cccc(CNC(=O)NNC(=O)c3cccc(C#N)c3)c2)C1=O	790709760	RBKYJTYAKIXKPS-HSZRJFAPSA-N	446.467	1.927	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc3c2OCC[C@H]3OC)cc1OC	790956477	JFJRJGRGHIRYDR-OAHLLOKOSA-N	429.429	1.574	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(n2cc(C(=O)NNc3nc4ccccn4n3)nn2)CC1	791252286	CNEHJEQBLSWVIC-UHFFFAOYSA-N	427.469	1.650	50	20	IDGD	
COC(=O)c1occc1C=NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	794741639	CPUXTZRVYLYLKR-UHFFFAOYSA-N	449.485	1.170	50	20	IDGD	
CC(=O)N1CCCC[C@H]1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	794741767	PGJUEAOKDYWLGF-SFHVURJKSA-N	436.534	1.023	50	20	IDGD	
COC1(C(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)CCN(C(=O)OC(C)(C)C)CC1	798308408	YOGWTDIQUNFKDL-UHFFFAOYSA-N	448.520	1.805	50	20	IDGD	
CCOc1cccc(S(=O)(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)c1	799914238	HPEBHHKWNWQGRD-UHFFFAOYSA-N	441.531	1.024	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NC[C@@H]2CC(c3ccc(C)cc3)=NO2)c2ccccc2c1=O	800751239	VCVDXMSFQIIYOW-INIZCTEOSA-N	448.483	1.862	50	20	IDGD	
C[C@@H](Sc1ccccc1C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1)C(N)=O	801148122	RMGZPHLCTJLFKQ-GFCCVEGCSA-N	434.543	1.850	50	20	IDGD	
Cc1nc2c(c(O)nn2C)c(C)c1CCC(=O)NNC(=O)Nc1ccc2c(c1)OCO2	802092824	DWGDHUXLMNLVKF-UHFFFAOYSA-N	426.433	1.805	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)C(=O)Nc2cc(Cl)cc3c2OCC(=O)N3)c2ccccc21	806975581	FZBMRIXBJCXLQU-UHFFFAOYSA-N	441.831	1.562	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ccc(-n3ccnc3)nn2)c(OC[C@H]2CCCO2)c1	807429484	SFYOHKPQMLFVNH-OAHLLOKOSA-N	437.460	1.610	50	20	IDGD	
Cc1nc2ccc(NC(=O)NNC(=O)c3cccc(S(=O)(=O)N4CCCC4)c3)cn2n1	809897957	PEHPCVAUISDDLX-UHFFFAOYSA-N	443.489	1.289	50	20	IDGD	
NC(=O)c1ccc(OCC(F)F)c(NC(=O)NNC(=O)c2nnc(O)c3ccccc23)c1	810343849	VLCHULACSNCBDN-UHFFFAOYSA-N	446.370	1.545	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)CNS(=O)(=O)c1ccccc1C(F)(F)F	810355449	CLHNEDRBKZLCHD-UHFFFAOYSA-N	445.419	1.470	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])nn1C1CCCCC1	810385842	BUHFSYYYNLUVMT-UHFFFAOYSA-N	444.448	1.770	50	20	IDGD	
O=C(NNC(=O)N1CCC[C@@H](CNC(=O)C(F)(F)F)C1)c1cc(Br)c[nH]1	811851571	JFXNLJVLGIDWRA-QMMMGPOBSA-N	440.220	1.522	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2cccc(N3CCCC3=O)c2)cc1	813033057	CBGULXYVDCFHJJ-UHFFFAOYSA-N	445.501	1.146	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NN=Cc1ncc(Br)s1	814879108	QYEQHULQQFHLBG-UHFFFAOYSA-N	436.335	1.814	50	20	IDGD	
CC(C)C(=O)Nc1cc(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)ccn1	815734653	SLCWDMHELPFRMB-UHFFFAOYSA-N	447.517	1.454	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1ccccc1OC(F)F	815752004	XYQMKSMVLWYVAM-UHFFFAOYSA-N	428.417	1.620	50	20	IDGD	
CN(c1ccccc1)S(=O)(=O)c1cccc(NC(=O)C(=O)NNc2ncncc2F)c1	815764262	ZKESDMRLPIJAMT-UHFFFAOYSA-N	444.448	1.523	50	20	IDGD	
Cc1ccc(S(=O)(=O)Nc2ccccc2F)cc1C(=O)NNc1nnc(C)c(O)n1	817283013	UHEZKITVXXEBPK-UHFFFAOYSA-N	432.437	1.891	50	20	IDGD	
CNS(=O)(=O)c1cccc(CNC(=O)NNC(=O)c2ccc(Cl)cc2OC)c1	915259292	SBNRGJXPXUHIGN-UHFFFAOYSA-N	426.882	1.401	50	20	IDGD	
CCN(CC)CCNC(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	915879148	ZFGYUEMMWBSQIT-UHFFFAOYSA-N	436.520	1.674	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCc2nc3ccccc3n2C)nc1	915928351	PCHKQZRLPSCGJC-UHFFFAOYSA-N	431.522	1.825	50	20	IDGD	
C[C@H]1CN(C[C@H](C)C(=O)NN=C2C(=O)Nc3cc(N4CCOCC4)ccc32)C[C@@H](C)O1	915954405	DMTRJPGZSSEICE-HRCADAONSA-N	429.521	1.041	50	20	IDGD	
COc1cccc(NCC(=O)NN=C(C)c2ccc(S(=O)(=O)NCC(=O)O)cc2)c1	916359655	ICTBSGXPXYKXOX-UHFFFAOYSA-N	434.474	1.010	50	20	IDGD	
C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)C1	919785954	NYPBHDBEUIFQCQ-RDJZCZTQSA-N	434.500	1.713	50	20	IDGD	
C=CCNS(=O)(=O)c1cc(C(=O)NNC(=O)CCc2ccc(OC)cc2)ccc1F	920011861	AFZAXZMEYDVOGY-UHFFFAOYSA-N	435.477	1.692	50	20	IDGD	
Cc1ccc2c(c1)C(=O)N([C@H](C)C(=O)OCC(=O)NNC(=O)c1cccc(Cl)c1)C2=O	920058743	HUEFDLRANJKNTN-GFCCVEGCSA-N	443.843	1.637	50	20	IDGD	
O=C(COC(=O)[C@@H]1CCCN1C(=O)Cc1ccccc1)NNC(=O)c1ccc(Cl)cc1	920682928	PEQYMGCHBKJSDK-SFHVURJKSA-N	443.887	1.878	50	20	IDGD	
COCCNC(=O)/C(C#N)=C\c1cn(CCC(N)=O)nc1-c1ccc(Br)cc1	920847001	AOBQZIUJMADKRE-UVTDQMKNSA-N	446.305	1.858	50	20	IDGD	
CS(=O)(=O)CCNC(=O)/C(C#N)=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	920852063	QRHCBACUMKHZHX-UVTDQMKNSA-N	449.920	1.147	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)NC[C@@H]2CCCOC2)cc1	920855275	ZWDTUAWRSFQARL-GYXHFJGISA-N	437.500	1.884	50	20	IDGD	
O=C(NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)Nc1nc2c(s1)CCC2	920930015	DIAAIYZGQOMAFC-UHFFFAOYSA-N	435.531	1.883	50	20	IDGD	
Nc1cnnc(NNC(=O)c2sccc2S(=O)(=O)N2CCSCC2)c1Cl	1116298439	QPAPLWONXVQSRX-UHFFFAOYSA-N	434.956	1.268	50	20	IDGD	
C=C[C@@H](COC)NC(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2OC)c1	1320606368	VRMPWYYOZUSXBN-HNNXBMFYSA-N	448.501	1.641	50	20	IDGD	
Cc1nc2c3cccnc3nn2c(C)c1CCC(=O)NNC(=O)c1n[nH]c2c1CCCC2	1321860633	LHFPRTHTQPGWLF-UHFFFAOYSA-N	432.488	1.890	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCC[C@H]2CNc2cccc(C)n2)cc1OC	1324450439	JXXOZSYJGUFATB-KRWDZBQOSA-N	427.505	1.745	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1)c1nnnn1C	1348020115	WUHFDWBBWGZJHQ-DNVCBOLYSA-N	434.504	1.229	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2[nH]nc3ccncc23)C1	1777908083	DTJYIOIVASIXSF-DYESRHJHSA-N	445.596	1.937	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(Br)cn3)C2)C1	1779424865	DIRNTDHVQHLREZ-DYVFJYSZSA-N	446.729	1.541	50	20	IDGD	
CC(=O)O[C@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CO[Si](C)(C)C)C1)C(C)C	1779545286	AQWSVVVOKBDLLU-SLYNCCJLSA-N	442.629	1.940	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)[C@@H](O)Cc3ccccc3)CCO2)C1	1781233052	PHRCZBXRZHPHMV-FFZOFVMBSA-N	429.344	1.656	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cn1cc(Cl)cn1)C2	1782170704	UAJUHXXJCLLMAV-IIDMSEBBSA-N	433.336	1.304	50	20	IDGD	
Cc1ccsc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCC(=O)NN(C)C)C1	1782210782	LQYXZHOXXWCHAX-IIBYNOLFSA-N	436.578	1.557	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCCn2ccnc2)C1	1782484904	DWMRKLOHPJXNTE-SQGPQFPESA-N	426.945	1.431	50	20	IDGD	
COc1ccc(OCC(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](C)Br)C3)C2)cc1	1783527390	BRIRYRLXUAFADF-AUUYWEPGSA-N	441.322	1.687	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)CNC(=O)OC(C)(C)C)CCO2)C1	1783538434	CQXZNOFDKFYMMK-YVEFUNNKSA-N	434.331	1.124	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H]2C[C@]21C(=O)N1CC[C@@]2(CN(C(=O)[C@H](F)Cl)CCO2)C1	1783684287	FPQQELRLWBKRHZ-AFHBHXEDSA-N	445.919	1.750	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cccc3c1CCCC3)CCO2	1783937368	HEQHOSVXQOKWAY-XMMPIXPASA-N	442.560	1.382	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cccc3ccoc13)CCO2	1783937901	YIRJKANNHDGEIZ-QFIPXVFZSA-N	428.489	1.249	50	20	IDGD	
C[C@@H]1Oc2ccc(C(=O)N3CCO[C@]4(CCN(C(=O)C(Cl)Cl)C4)C3)cc2NC1=O	1783948281	HRBSCPKPFNURDG-WLRWDXFRSA-N	442.299	1.653	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3c(Cl)ccc4c3OCO4)C[C@@H]21)[C@@H](O)CCl	1784090690	KXDBVMUDZKVDRQ-UHXUCMFUSA-N	445.299	1.262	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)C34CC(C3)C4)C2)C1	1784829660	WNWYUHBFEOTTON-HCWAXHENSA-N	441.956	1.749	50	20	IDGD	
Cc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)CBr)C[C@@H]32)n(C)n1	1786024514	NJALTKWZDWHIMO-PCBIJLKTSA-N	427.343	1.353	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)c1scnc1C(F)(F)F	1786265634	NRTQMPMHKHUVRK-MMWGEVLESA-N	441.859	1.355	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(Cl)cnc3O)C[C@@H]21	1786404798	RELJVAPHSMVGEW-BPNCWPANSA-N	446.729	1.819	50	20	IDGD	
C[C@@H](Br)C(=O)NC1(c2ccc(NC(=O)CN3CC(=O)NC3=O)cc2)CCC1	1786686913	OGRRUYLHXQDBTM-LLVKDONJSA-N	437.294	1.456	50	20	IDGD	
CCOC(=O)N1CCC(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]3C2)CC1	1787451412	OHJBLQPJFADGBK-YHUYYLMFSA-N	433.908	1.369	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C/N=C/c3ccco3)[C@H]2C1	1788681444	UVXDUXOAOCDTJR-GGEPFGHSSA-N	426.311	1.462	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3(N4CCN(C)CC4)CC3)[C@H]2C1	1789805493	NIFMVAUHJGGDSI-VJANTYMQSA-N	441.016	1.154	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]21	1791060353	BNFSUOHBMXYFBT-VSBZFQJLSA-N	430.170	1.986	50	20	IDGD	
Cc1cnn([C@@H](C)C(=O)Nc2ccc(C3(NC(=O)c4cccc(B(O)O)c4)CCC3)cc2)c1	1791843038	ICSNSEDGQSNCNY-KRWDZBQOSA-N	446.316	1.880	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1ccc(C(F)(F)F)cn1)C2)[C@@H](O)CCl	1792975017	GTBDADSFNTVPQF-RBNVPPIJSA-N	449.857	1.222	50	20	IDGD	
C/C=C/C=C\C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1793879241	RQPBXQKPTGSAOR-SHEJJLPBSA-N	441.956	1.840	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc3c1OCCO3)C2	1795114501	PTMQMBQKGUNPLY-FVCICTRLSA-N	439.306	1.446	50	20	IDGD	
N#Cc1cccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)c1Cl	1796188581	XCUPMCLBQHDUPS-BCDXTJNWSA-N	437.692	1.457	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1cc(F)cc(F)c1	1796281692	SHSRQHNEAIRXHT-BJWYYQGGSA-N	443.454	1.458	50	20	IDGD	
COc1c(Cl)ccnc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2	1798687718	YTNHNBZZWLUNTK-GNXNZQSNSA-N	446.729	1.732	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc3ccnn13)C2	1799279564	RCZYQKJMZGHRSA-UESRRSCYSA-N	425.316	1.774	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cc(F)ccc1F)C2	1800763830	MDCXKDLMECYGIL-AKENFEQQSA-N	431.277	1.880	50	20	IDGD	
C[C@@H](S)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1800981697	ZLGVUHFLBHNACG-PEBLQZBPSA-N	435.974	1.026	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCn1nc(C)cc1C	1801247900	CKKVJLGBXBYKTK-DFGXFYAUSA-N	441.370	1.653	50	20	IDGD	
C[C@H](NC(=O)c1ccccc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2	1802115076	DDRQOAJBSMYSPY-MHEUCROKSA-N	428.316	1.198	50	20	IDGD	
C[C@H](NNc1ccccc1)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1	1802508316	AULDKWNGZADJQF-UHMOLFJZSA-N	445.951	1.692	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc3nn[nH]c3c2)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803148501	RDFZBEWJTMVHRJ-JCGIZDLHSA-N	428.880	1.272	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1)c1cccc(=O)n1O	1804954701	ZPCZOGZGQXLUEZ-KSSFIOAISA-N	449.305	1.585	50	20	IDGD	
C[C@@H](C(=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Cl)[C@H]1c1cccnc1)N1CCN(C)CC1	1807897515	AYBKPPJCOXHKEH-LEUOFYLZSA-N	425.936	1.258	50	20	IDGD	
C=C(CC(=O)OCC)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](Cl)COC)[C@H]1c1cccnc1	1808463155	CFPKOYNGXRXHMM-LNLFQRSKSA-N	437.924	1.851	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)c1snnc1C1CC1	1808850356	KUZMSNRUNXJEFH-DZKIICNBSA-N	435.937	1.730	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)C3(C(F)(F)F)CC3)CC2)C1	1809978885	WVBYCBYQOJBUDZ-UHFFFAOYSA-N	438.255	1.554	50	20	IDGD	
CC(=O)N/C(C)=C/C(=O)NC[C@@H]1CCN(C(=O)CO[Si](C)(C)C)[C@H]1c1cccnc1	1812320066	WCTMEXMSKOEDBV-RSSVORECSA-N	432.597	1.979	50	20	IDGD	
CC(=O)N[C@H](C)C(=O)NC[C@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1	1812649026	WWQUNTYPRSDINQ-SRCQZFHVSA-N	425.327	1.397	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)[C@@H](N)Cc2cccnc2)[C@H]1c1cccnc1	1813030563	JJIBJBOFDVHESF-FYQPLNBISA-N	445.951	1.306	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)[C@H](O)Cc2ccccc2)[C@H]1c1cccnc1	1813034760	WVVHLBKCYJDJSP-BURNTYAHSA-N	445.947	1.945	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)CC2CCC2)[C@@H]1c1cccnc1	1814118274	MNCBVGGNAKTVJG-UWJYYQICSA-N	436.516	1.590	50	20	IDGD	
CN[C@H](CC(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](C)CBr)n[nH]1)C(=O)O	1814779974	BRNXOCURQASMLM-UHTWSYAYSA-N	444.330	1.496	50	20	IDGD	
COc1cnc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)[C@@H](O)CCl)n[nH]2)c(F)c1	1814869747	ZHXIKOBDDNFNFE-KBPBESRZSA-N	425.848	1.858	50	20	IDGD	
Cc1nscc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1816259919	GIUXHAQOOWWPRR-QGZVFWFLSA-N	439.306	1.474	50	20	IDGD	
O=C(COc1ccccc1)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1816858819	JYXHFZWOXXLAKW-FQEVSTJZSA-N	448.288	1.474	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CS(C)(=O)=O)n[nH]1	1817059481	JVFPWMQGMKKRCO-JQWIXIFHSA-N	435.344	1.620	50	20	IDGD	
Cc1cscc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(B(O)O)cc1)CC2	1817568605	PTADJVGLIVUBOU-AWEZNQCLSA-N	441.343	1.732	50	20	IDGD	
Cc1nc[nH]c1CSCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1	1819320933	VIWGBMCDYLCJPC-LSDHHAIUSA-N	440.957	1.966	50	20	IDGD	
C[Si](C)(C)OCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CSCC(=O)O)CC2	1820168486	GLVAJDNFYRZHDA-JTQLQIEISA-N	431.612	1.724	50	20	IDGD	
COCCn1ccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)[C@@H](Cl)COC)n[nH]2)n1	1822370241	SOHBOTYNWUQDJO-XJKSGUPXSA-N	438.916	1.812	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](C)n2cnnn2)n[nH]1	1822853243	YWFZUBUABBGELT-NTZNESFSSA-N	439.318	1.681	50	20	IDGD	
COC1(CC(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)CCC1	1823070306	AVDALLMWYKAIQE-SFHVURJKSA-N	440.309	1.355	50	20	IDGD	
Cc1cccnc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1	1824701405	AENJXULLXXBVCY-IBGZPJMESA-N	429.565	1.996	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](N)CN)CC2	1824804201	HEWLWHFYDSVCLI-SBAYRHLTSA-N	446.483	1.226	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)Cn2cc([N+](=O)[O-])cn2)CC1	1825128193	DBVUSRKGTCIYJD-SJORKVTESA-N	441.916	1.665	50	20	IDGD	
COc1nccnc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1	1825512545	UMEOXHWBCFXXGO-QGZVFWFLSA-N	446.552	1.092	50	20	IDGD	
CC(C)(CCl)C(=O)N[C@@H]1CCc2nc(NC(=O)C[C@@](C)(O)CC(=O)O)sc2C1	1826067838	KUEKVBFCUAZGCI-MLCYQJTMSA-N	431.942	1.936	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)Cc1cscn1)CC2	1826085486	WLXGLHUVLMFGAT-NSHDSACASA-N	436.563	1.127	50	20	IDGD	
C[C@@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1)C1(O)CCC1	1827049344	RMTLMEQYTJJTJP-UWJYYQICSA-N	442.365	1.151	50	20	IDGD	
O=C(c1ccns1)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827056548	XUGDEXATICTFHC-GOSISDBHSA-N	427.335	1.370	50	20	IDGD	
CC(C)=NO[C@@H](C)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827056852	YXMKSBHDQNUWRI-LAUBAEHRSA-N	443.353	1.401	50	20	IDGD	
CCC(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)[C@@H](O)CCl)C2)C1	1828824081	UENHFXHYPDPXLG-LAUBAEHRSA-N	437.924	1.448	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](O)N2CCOCC2)CC1	1828965659	QOASDFSIMOARMP-ZWKOTPCHSA-N	429.989	1.522	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)CC(F)(F)F)C2)C1	1830537356	DXKLKBOBRKBDOF-RISCZKNCSA-N	431.249	1.426	50	20	IDGD	
CC(=O)N(C)CCC(=O)NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1833669775	BUTRXPIVWHCSDD-QGZVFWFLSA-N	449.365	1.117	50	20	IDGD	
O=C(COc1ccccc1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1834954341	NVIKMIHFVCSIPK-FUHWJXTLSA-N	445.285	1.212	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)CCc3ccc(O)nn3)CC2)CC1)[C@H](F)Cl	1835081408	OUHKXYCQKLUCAL-SFHVURJKSA-N	427.908	1.221	50	20	IDGD	
O=C(c1cc(O)ccc1O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836717989	NDHBAISWTKFESS-GOSISDBHSA-N	426.897	1.310	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cnc(O)nc3O)CC2)CC1	1836919012	CORZJMPXYGICLL-INIZCTEOSA-N	440.928	1.908	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](OC(C)=O)C(C)C)CCO2	1837214766	ZNBUVWXOKVUBAJ-SQGPQFPESA-N	432.945	1.438	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3[nH]cnc3-c3cccnc3)CCO2)C1	1838498405	MKOQDADVMCSQRM-HRAATJIYSA-N	447.923	1.559	50	20	IDGD	
C/C(=C/C(=O)N1CCC(OC2CCN(C(=O)[C@H](C)Br)CC2)CC1)C(=O)O	1838773532	MTADKXMFEFPNHX-HHQWOOOKSA-N	431.327	1.799	50	20	IDGD	
COc1cccc(C(=O)N2CCO[C@]3(COCCN(C(=O)CCBr)C3)C2)c1	1838927476	QKSYXMODMGNKDG-IBGZPJMESA-N	441.322	1.550	50	20	IDGD	
O=C(Cc1ccccc1F)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839199078	IJCWLLRQDWVTQO-SJLPKXTDSA-N	447.276	1.515	50	20	IDGD	
CCc1ccnc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)c1	1839199685	RWXGWQGPDXQVTG-CRAIPNDOSA-N	444.301	1.405	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)ccc1F	1839201576	BDYPVHQDYICASK-QAPCUYQASA-N	447.276	1.895	50	20	IDGD	
O=C(CCCn1cccc1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839203249	FVLQAUNZTIUDMU-SJLPKXTDSA-N	446.317	1.415	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc4cccnn4c3)CCO2)C1	1839559513	LZVQIDDATASGHF-NQIIRXRSSA-N	434.924	1.812	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3nccnc3C)C2)C1	1839966139	VSGMPRQONVXAIY-KSSFIOAISA-N	441.326	1.029	50	20	IDGD	
CC[C@H](C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](C)Br)CCO2)C1)N(CC)CC	1840030198	DCPHJRNDEDQTAT-FRQCXROJSA-N	448.402	1.347	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)cc1F	1840034215	FAVIHVZUQTZODX-AUUYWEPGSA-N	443.313	1.988	50	20	IDGD	
COc1ccc(F)cc1CC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1840250406	XZBQAXVJTFLMNN-HKUYNNGSSA-N	432.851	1.368	50	20	IDGD	
C[C@@H](Oc1cccnc1)C(=O)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1840454360	CWGMCOSFRHIEMW-FZKQIMNGSA-N	432.304	1.109	50	20	IDGD	
C[C@@H](Cc1ccco1)C(=O)N1CCO[C@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1	1840470965	IRWGCWCUJIPRCI-UWJYYQICSA-N	438.597	1.766	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(C)cc3O)CCO2)C1	1840669773	OQVZSZYOYTVEBZ-UZLBHIALSA-N	426.897	1.024	50	20	IDGD	
O=C([C@H](O)CCl)N1CC2(CCCN2C(=O)c2ccoc2I)C1	1843135850	FPGIVHKIESYXHA-SNVBAGLBSA-N	438.649	1.301	50	20	IDGD	
CC(C)c1nn2ccccc2c1C(=O)N1CCCC12CN(C(=O)c1cccc(B(O)O)c1)C2	1843220482	XTPZUTAVQBZHGE-UHFFFAOYSA-N	446.316	1.268	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)CCc1cccc(C#N)c1)C2	1843415145	QAVWTWPAMNFJHH-WPWMEQJKSA-N	446.511	1.828	50	20	IDGD	
COc1c(C(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)ccc(F)c1F	1844265061	QZBNQCIXUKZUMR-UHFFFAOYSA-N	445.426	1.103	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)[C@@H]2[C@@H]3Sc4ccccc4[C@H]32)C1	1844272207	BQOQUOFRJTZTQD-GBESFXJTSA-N	449.536	1.390	50	20	IDGD	
Cn1ncc(Br)c1C(=O)N1CC2(CCCN2C(=O)CO[Si](C)(C)C)C1	1844378130	JJCJCYRPVDRCDN-UHFFFAOYSA-N	429.391	1.851	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)Cc1cc3ccccc3n1C)C2	1846383941	KWPIUBQNYQEUQZ-UHFFFAOYSA-N	425.533	1.297	50	20	IDGD	
COCCOCCOCCOCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)C(C)(C)CCl	1847437579	BMQCJRCFNCKQEK-IRXDYDNUSA-N	434.961	1.149	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)c1sccc1S(=O)(=O)N1CCCCC1	10125927	QICVPHSUOBSEOC-UHFFFAOYSA-N	447.542	1.954	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)[C@H]2CC(=O)N(c3ccccc3OC)C2)cc1OC	12691709	DCKQYNDQOALQRK-HNNXBMFYSA-N	427.457	1.917	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)c2ccc3c(=O)n(C)c(S)nc3c2)cc1OC	12694082	RPTLSCYTCWNIOH-UHFFFAOYSA-N	428.470	1.704	50	20	IDGD	
CC(C)(C)NC(=S)NNC(=O)CNC(=O)c1ccccc1I	28716339	CXLYWUBHSLOCCD-UHFFFAOYSA-N	434.303	1.315	50	20	IDGD	
Cc1ccc(C)c(-n2ccnc2SCC(=O)NNC(=O)CNC(=O)c2ccco2)c1	725739398	FNBGDYDWGASENR-UHFFFAOYSA-N	427.486	1.752	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCCN(C(=O)Oc3ccccc3)CC2)n1	725815227	QANIHAJFWZWJOB-UHFFFAOYSA-N	431.518	1.348	50	20	IDGD	
CCOc1ccc(/C=C(\C#N)C(=O)OCC(=O)Nc2ccccc2S(N)(=O)=O)cc1	725917396	MQEMQIIYJLAAMI-RVDMUPIBSA-N	429.454	1.822	50	20	IDGD	
CN(C)N(C(=O)c1ccc(Cl)c(S(=O)(=O)N2CCCC2)c1)[C@@H]1CCS(=O)(=O)C1	728175597	CNHJYDRIMCFZNR-CQSZACIVSA-N	449.982	1.230	50	20	IDGD	
CCN(C)[C@@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)c1ccccc1	728602958	LZQKPJVXTFVJNE-HXUWFJFHSA-N	444.557	1.925	50	20	IDGD	
CC(=O)N[C@@H](CC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)c1c(F)cccc1F	728846959	XWILHFRDNDAQDD-KRWDZBQOSA-N	446.458	1.386	50	20	IDGD	
Cc1ccc(C)c(N2N=C(C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)CCC2=O)c1	728847432	FCWODHNBRKTEFU-UHFFFAOYSA-N	449.515	1.640	50	20	IDGD	
O=C(CCCNC(=O)c1ccc(F)cc1F)NNC(=O)C1CCN(c2ncccn2)CC1	728847749	NTQZDXCPHTVGBX-UHFFFAOYSA-N	446.458	1.329	50	20	IDGD	
CCCn1c(=O)nc(O)c2c(C(=O)NNC(=O)c3cccc(C#N)c3)cc(C(C)C)nc21	728870808	GEJLHZQGRBLDIW-UHFFFAOYSA-N	434.456	1.977	50	20	IDGD	
CC(C)CNS(=O)(=O)c1cc(C(=O)NNC(=O)c2cnn[nH]2)c(Cl)cc1Cl	729455546	KTSQBWZWHNAONO-UHFFFAOYSA-N	435.293	1.121	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)Cc3cc[nH]n3)c2)cc1	730091792	WSNSBOTWJAHBCT-UHFFFAOYSA-N	429.458	1.223	50	20	IDGD	
Cc1ccc2c(c1)[C@H](NC(=O)NNc1ccc(S(=O)(=O)N3CCN(C)CC3)cn1)CC2	730132967	YNSXOASRSJIJTA-LJQANCHMSA-N	444.561	1.640	50	20	IDGD	
CCOc1cccc(N2CCN(CC(=O)NNC(=O)c3ccc(OC)c(OC)c3)CC2)n1	730266213	QCHANHNVIWLSGY-UHFFFAOYSA-N	443.504	1.081	50	20	IDGD	
CCOc1cc2c(cc1[C@@H]1C[C@@H]1C(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1)O[C@H](C)C2	730535489	PSNRMEOCLZVWLJ-UYHMYPTGSA-N	437.518	1.030	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)c1occc1CS(=O)(=O)c1ccccc1	730777800	DINRCEDHWGQMAR-UHFFFAOYSA-N	430.438	1.799	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)[C@@H]1CCCN1C(=O)c1ccccc1OC(F)F	730781238	ISWHAHDQQVGKCM-AWEZNQCLSA-N	449.410	1.825	50	20	IDGD	
C[C@H]1CCC[C@H](NC(=O)CN2CCN(C(=O)NNC(=O)c3cccc(C#N)c3)CC2)C1	731220608	MCQQPSLICHEVMK-LPHOPBHVSA-N	426.521	1.225	50	20	IDGD	
O=C(NC[C@H](O)c1ccc(Cl)cc1Cl)NNC(=O)c1ccc(-n2cnnn2)cc1	732236508	XYXYEQVPRDCYAM-HNNXBMFYSA-N	436.259	1.647	50	20	IDGD	
O=C(O)COc1cccc(C=NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1	733201211	GRAIOTFKWFUCES-UHFFFAOYSA-N	431.470	1.698	50	20	IDGD	
COCCS(=O)(=O)CC(=O)NNc1nc2ccccc2c(=O)n1-c1cccc(C)c1C	733263958	CABZGCAQPFTUTH-UHFFFAOYSA-N	444.513	1.507	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)c1ccccc1F)C(=O)NNc1nccnc1Cl	734260545	UZPMZYZCJCDOOP-NSHDSACASA-N	433.918	1.812	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNS(=O)(=O)c2cccc3cccnc23)ccc1Cl	734740895	ZRPMPPQSQKKNQV-UHFFFAOYSA-N	440.890	1.159	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNS(=O)(=O)c2ccc(F)c(NC(C)=O)c2)cc1	736539923	SAYZWCGHKQHKES-GFCCVEGCSA-N	439.465	1.960	50	20	IDGD	
Cc1nc(-c2cccnc2)nc(NNC(=O)CCNS(=O)(=O)c2cccnc2)c1C	736697122	VCBXBXZVYCJAEB-UHFFFAOYSA-N	427.490	1.362	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(N2C[C@@H](C(=O)NNc3cccnn3)CC2=O)cc1	736698620	KMBOLUQAHSPFQH-AWEZNQCLSA-N	432.506	1.003	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)c1sc2nc3n(c(=O)c2c1C)CCCCC3	740852855	LTULDFOTVMISLL-UHFFFAOYSA-N	433.534	1.559	50	20	IDGD	
O=C(NNC(=O)N1CCC(OCCc2ccccc2)CC1)c1ccc(-n2cnnn2)cc1	742745863	OENJQKQSQPUPOW-UHFFFAOYSA-N	435.488	1.740	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2ncoc2-c2ccc3c(c2)OCCO3)C[C@H](C)O1	743290545	HOQYJUFJYONZTG-KBPBESRZSA-N	430.461	1.373	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCCCN2C(=O)COc3ccccc32)cc1OC	743521323	OQPOYSLHUZNSSW-UHFFFAOYSA-N	428.445	1.464	50	20	IDGD	
CS(=O)(=O)Nc1ccc(CNC(=O)NNC(=O)c2cccc(Br)c2)cc1	743536156	DYWNOZNUHGNVPR-UHFFFAOYSA-N	441.307	1.965	50	20	IDGD	
Cc1nn(C)c2sc(C(=O)N[C@H](C)C(=O)NNC(=O)Nc3ccc(N(C)C)cc3)cc12	743828934	PDLYUMVXVVADBO-GFCCVEGCSA-N	443.533	1.980	50	20	IDGD	
CN(C)[C@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)c1ccccc1	744313703	JDUNCUAAUGNTNF-FQEVSTJZSA-N	444.557	1.925	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1cc(O)nc2ccccc12	744621278	NLLOOTCSHAPGAG-UHFFFAOYSA-N	428.470	1.718	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)c2sccc2S(=O)(=O)C(F)F)cc1	744984377	NHBMWZOSIDQZSS-UHFFFAOYSA-N	443.409	1.234	50	20	IDGD	
COc1ccc(Cl)cc1N1C[C@@H](C(=O)NNC(=O)Cc2cn3ccccc3n2)CC1=O	746549267	OKLJACWNJXLVTP-ZDUSSCGKSA-N	441.875	1.739	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)[C@H]1CS[C@@H](Cc2ccccc2F)C(=O)N1	746636760	FOTFTBPDISIYNV-SJORKVTESA-N	441.488	1.006	50	20	IDGD	
CSCC[C@@H](NC(=O)Cc1ccccc1)C(=O)NNC(=O)Cc1cn2ccccc2n1	746636841	HMEAUCCEZPEZNJ-GOSISDBHSA-N	439.541	1.505	50	20	IDGD	
CS(=O)(=O)c1cc(Br)cc(C(=O)NNC(=O)Cc2ccncc2)c1F	747322951	DIFYTFSRNLIPFV-UHFFFAOYSA-N	430.255	1.390	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)c2nc(C)n(-c3n[nH]c(C(F)(F)F)n3)n2)cc1C	747346199	XLMKGKBCXLOOCF-UHFFFAOYSA-N	438.370	1.169	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)c2ocnc2C)c1	747349043	WKYAHOSNIZCIMI-UHFFFAOYSA-N	430.442	1.867	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)Cc1ccc(NS(=O)(=O)c2cccs2)cc1	747428867	YPVFTSBKXIJUTB-UHFFFAOYSA-N	430.511	1.877	50	20	IDGD	
CCC[C@@H](C)NC(=O)[C@@H]1CCCN(CC(=O)NNC(=O)c2ccc(OC)c(OC)c2)C1	747835322	NOVXRPOSZUXAIR-NVXWUHKLSA-N	434.537	1.482	50	20	IDGD	
NS(=O)(=O)c1ccc(N2CCOCC2)c(C(=O)NNc2ccc(F)c(F)c2F)c1	748217259	PBGALQPHMQQOFF-UHFFFAOYSA-N	430.408	1.345	50	20	IDGD	
Cc1nn(C)c(C)c1C(=O)NC1(C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)CCCC1	749322569	FVCUXNCXKBHYNT-UHFFFAOYSA-N	428.449	1.449	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNS(=O)(=O)c1ccc2c3c(cccc13)C(=O)N2	751282458	LQVBLXWHSHDGEZ-UHFFFAOYSA-N	430.467	1.207	50	20	IDGD	
O=C(COC(=O)[C@@H]1CC(=O)N(c2cn[nH]c2)C1)NN=C(c1ccccc1)c1ccccc1	751679851	RWQRSOFHEDRDPD-GOSISDBHSA-N	431.452	1.875	50	20	IDGD	
O=C(NNc1cc(C(F)(F)F)ccc1F)C1=NN([C@H]2CCS(=O)(=O)C2)C(=O)CC1	754154041	RSPMDMXZGKOXGS-JTQLQIEISA-N	436.387	1.453	50	20	IDGD	
O=C(CCC(=O)c1cc(Cl)sc1Cl)NNC(=O)N[C@H]1CCS(=O)(=O)C1	755229860	FUOZPQNEAWSHSD-ZETCQYMHSA-N	428.319	1.535	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2cc(F)cc(Cl)c2)c1	755407201	KFFWWFWDZWLFGJ-UHFFFAOYSA-N	435.886	1.353	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(N(C)C)c(NC(=O)NNC(=O)Cc2cccnc2)c1	755435192	QIJOKZSPWAUTGP-UHFFFAOYSA-N	448.549	1.574	50	20	IDGD	
CC[C@@H](C)C(=O)NNC(=O)Nc1ccc(CC(=O)N2CCN(c3ncccn3)CC2)cc1	755690956	HKLXVNBFIDJVPL-MRXNPFEDSA-N	439.520	1.567	50	20	IDGD	
CS(=O)(=O)CCn1ccc(NC(=O)NNC(=O)c2ccc(Br)s2)n1	756757349	AUIFSHOGEVBAKB-UHFFFAOYSA-N	436.313	1.218	50	20	IDGD	
O=C(Cn1cc(NC(=O)NNC(=O)c2ccc(Br)s2)cn1)NC1CC1	756796995	UQFZEPVAUWASGO-UHFFFAOYSA-N	427.284	1.452	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)Nc2ccc3c(c2)N(C)C(=O)CO3)cc1	756829248	FENMEPIEAFAHCE-CYBMUJFWSA-N	426.429	1.865	50	20	IDGD	
COCCCS(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1	757823891	UFIKKNNIKQNDNW-SFHVURJKSA-N	449.485	1.490	50	20	IDGD	
Cc1nn([C@H]2CCS(=O)(=O)C2)c(C)c1NC(=O)NNC(=O)c1cccc2ncccc12	757871063	DBJWRPYHDQVSHB-AWEZNQCLSA-N	442.501	1.874	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1cc(Br)cc(C(F)(F)F)c1	758042963	CFSNGQKPLUYAFO-LURJTMIESA-N	432.218	1.167	50	20	IDGD	
CC(C)OCCNC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	758717196	FSKQMXDMXZZYOZ-UHFFFAOYSA-N	426.520	1.918	50	20	IDGD	
CC1(C)CN(C2(CNC(=O)NNC(=O)C(=O)Nc3ccccn3)CCCCC2)CCO1	758756510	VWLMEVJDUVNPGQ-UHFFFAOYSA-N	432.525	1.164	50	20	IDGD	
CC(C)(C)OC(=O)N1Cc2ccccc2C[C@@H]1C(=O)NNC(=O)C(=O)Nc1ccccn1	758840694	WSVZXAFKFUTZLG-MRXNPFEDSA-N	439.472	1.530	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)[C@@](C)(O)CN1C(=O)C(C)(C)c2ccccc21	760053394	LSAKKGDMASHQJZ-QHCPKHFHSA-N	441.484	1.297	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)c1cc(I)ccc1F	762206399	KXAJSMMWOZRNGG-UHFFFAOYSA-N	430.173	1.976	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)c2ccc3c(c2)CCN3C(=O)CNC(C)=O)n1	762906735	NYFPRJFAVAEBNI-UHFFFAOYSA-N	425.493	1.105	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccn(CCC(C)C)n2)cc(OC)c1OC	763540735	YUYTXUQHMHIUMB-UHFFFAOYSA-N	433.465	1.355	50	20	IDGD	
CNC(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C(C)(C)C)cc2)cc1	763593976	FPKWJLFSVXFDLG-UHFFFAOYSA-N	440.500	1.438	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)C(=O)Nc2cc(C)nn2CCC#N)c1	763595775	DRCPCKJZMBFIHW-UHFFFAOYSA-N	426.477	1.702	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)c(C)c1	763604218	IRHJDLACACSWAH-UHFFFAOYSA-N	437.456	1.810	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc2c(c1)N(C)CCO2	763685512	WVRIRDGGYYIAMS-UHFFFAOYSA-N	428.445	1.079	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)Cc1cccc(S(=O)(=O)CC)c1	763727636	KTEWOKIKPYKJES-UHFFFAOYSA-N	428.514	1.782	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccc(N2CCOC2=O)cc1	763851952	WMFMLZRDDLGGFR-LBPRGKRZSA-N	430.392	1.336	50	20	IDGD	
CCS(=O)(=O)c1cc(F)ccc1NC(=O)C(=O)NNC(=O)Cc1ccc(Cl)cc1	763932244	LTYVNXZCMQYPFQ-UHFFFAOYSA-N	441.868	1.601	50	20	IDGD	
CN(C)c1c(Cl)cccc1NC(=O)C(=O)NNC(=O)c1cc(Br)c[nH]1	763995335	QDTGADLKVLYRGK-UHFFFAOYSA-N	428.674	1.896	50	20	IDGD	
Cc1ccc(COc2cccc(NC(=O)C(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)c2)cc1	764002897	VPDWIQOUPBAMAM-MRXNPFEDSA-N	445.497	1.095	50	20	IDGD	
O=C(Cc1ccsc1)NNC(=O)C(=O)Nc1ccc(OCCN2CCCCC2)cc1	764035074	ZVIHQSPKCSGURN-UHFFFAOYSA-N	430.530	1.941	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1OCC	764077080	HCIARFZQXMCZIZ-UHFFFAOYSA-N	449.485	1.287	50	20	IDGD	
CC[C@H](C)C(=O)NNC(=O)C(=O)Nc1cccc(CS(=O)(=O)Cc2ccccc2)c1	764081892	KNCQZRWOYCHIFP-HNNXBMFYSA-N	431.514	1.934	50	20	IDGD	
Cc1cc(N2CCOCC2)ccc1NC(=O)C(=O)NNC(=O)c1ccc(Cl)cc1O	764118051	YJWMXEIBVKNNDX-UHFFFAOYSA-N	432.864	1.590	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccc(CN(C(C)=O)C(C)C)cc1	764139372	UOFZGTRUODICBG-UHFFFAOYSA-N	440.500	1.781	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1)C(=O)Nc1ccc(F)nc1	764179429	SZNYOYGRMKOFHD-HXUWFJFHSA-N	447.470	1.934	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1cc(N2CCCC2=O)ccc1Cl	764279957	IZXRVUNGYGPHLF-UHFFFAOYSA-N	446.847	1.337	50	20	IDGD	
CC(=O)NCc1ccc(NC(=O)C(=O)NNC(=O)c2cc(Br)ccc2O)cc1	764280417	ORMRUZXKDZSBAU-UHFFFAOYSA-N	449.261	1.191	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)C(=O)Nc1cnn(-c2cnc3ccccc3n2)c1	764280858	GXWYHCWHMRWRDI-UHFFFAOYSA-N	445.439	1.240	50	20	IDGD	
COc1cccc(-c2cc(C(=O)NNC(=O)c3csc(N4CCOCC4)n3)n[nH]2)c1	764558957	LGYLRZHCVJERJV-UHFFFAOYSA-N	428.474	1.453	50	20	IDGD	
Nc1ncccc1C=NNC(=O)c1cc(S(=O)(=O)NCc2ccccc2)ccc1O	764668678	AKBZKZPWEWLIOC-UHFFFAOYSA-N	425.470	1.612	50	20	IDGD	
COc1cccc(/C=C(/C(=O)NNC(=O)CSc2ccccc2O)n2nnnc2C)c1	765247811	BMUWRVLLUPYVBW-WJDWOHSUSA-N	440.485	1.634	50	20	IDGD	
COCCn1cc(NC(=O)NNC(=O)c2cc(-c3ccc(OC)c(OC)c3)[nH]n2)cn1	765310065	JTKSTJQQDHKQTL-UHFFFAOYSA-N	429.437	1.403	50	20	IDGD	
CCn1c(S)nc2cc(C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)ccc2c1=O	765318032	ZBGDDPSXPZUCIY-UHFFFAOYSA-N	449.533	1.771	50	20	IDGD	
Cc1c(Cl)cccc1OCC(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765737474	ZTKILYDTIAKHBX-UHFFFAOYSA-N	444.919	1.633	50	20	IDGD	
CC(C)c1noc(CCC(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)n1	765750655	CLHANHAPDJWNRI-UHFFFAOYSA-N	448.955	1.744	50	20	IDGD	
COCCOc1ccc(C(F)(F)F)cc1NC(=O)C(=O)NNc1nccnc1OC	766261324	UALDDKXGHOPTGJ-UHFFFAOYSA-N	429.355	1.611	50	20	IDGD	
CN1C(=C(C#N)C(=O)COC(=O)[C@H]2CC(=O)N(Cc3ccccn3)C2)N(C)c2ccccc21	766935796	XDMSFMFYWIHFCO-INIZCTEOSA-N	445.479	1.864	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cnc(Cl)c(Br)c2)c(O)c1	768239381	MJZXJAHRKWHVEJ-UHFFFAOYSA-N	427.642	1.911	50	20	IDGD	
COc1ccc(C(=O)NNc2c(OC)cccc2S(C)(=O)=O)cc1N1CCNC1=O	768630374	RHCLAWVPIDYASX-UHFFFAOYSA-N	434.474	1.394	50	20	IDGD	
C[C@@]1(c2ccc(F)c(Cl)c2)NC(=O)N(CC(=O)NNC(=O)c2cccc(C#N)c2)C1=O	769925695	SZLROOSUCXNRSO-FQEVSTJZSA-N	443.822	1.579	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)NCCOc3ncc(C(F)(F)F)cc3Cl)nc21	770395651	BRTCRGKWPKBSHQ-UHFFFAOYSA-N	446.777	1.841	50	20	IDGD	
O=C(NNC(=O)N1CC=C(c2ccc3c(c2)OCCO3)CC1)c1ccc(-n2cnnn2)cc1	770754128	QBDBWUFGGCBMNB-UHFFFAOYSA-N	447.455	1.577	50	20	IDGD	
N#Cc1ccc(C(=O)NNS(=O)(=O)c2cc(C(=O)O)c(F)cc2Br)cc1	771141877	BHIZFLNSRUEUFL-UHFFFAOYSA-N	442.222	1.781	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1ccc(S(=O)(=O)N2C[C@H](C)C[C@@H](C)C2)cc1	771843916	AUDPXCJGIGGGFY-KFWWJZLASA-N	439.534	1.456	50	20	IDGD	
O=C(NCc1ccc(N2CCCS2(=O)=O)c(F)c1)NNC(=O)c1c[nH]c2ccccc12	773589688	PLGVEDULKSMEPQ-UHFFFAOYSA-N	445.476	1.991	50	20	IDGD	
NS(=O)(=O)c1cccc(N2C[C@@H](C(=O)NNc3ccc(C(F)(F)F)cn3)CC2=O)c1	775254875	HGNAKXNOYAAQHV-JTQLQIEISA-N	443.407	1.244	50	20	IDGD	
CCC(CC)n1nc(C)cc1C(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1	775639523	UXORJLXEDDWXGT-UHFFFAOYSA-N	435.550	1.943	50	20	IDGD	
O=C(COC(=O)c1cc(O)c2ccccc2c1O)NNC(=O)c1ccc([N+](=O)[O-])cc1	776552816	YBUGEJSWCMLFEV-UHFFFAOYSA-N	425.353	1.777	50	20	IDGD	
O=C(NNc1ccccn1)c1ccc(Br)c(S(=O)(=O)N2CCOCC2)c1	777472371	DWNVICSDASDNPE-UHFFFAOYSA-N	441.307	1.622	50	20	IDGD	
C[C@@H]1CCN(C(=O)OC(C)(C)C)[C@@H](C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)C1	778420675	UIVFDWOTCVPVRO-RHSMWYFYSA-N	444.488	1.898	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)c1cn(-c2cccc(C(F)(F)F)c2)nn1	778436474	KZXZNZJIJMIEGP-UHFFFAOYSA-N	428.371	1.572	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)[C@@H]1CCCOC1	780859833	LDRVCKHQODLRTE-NVXWUHKLSA-N	438.550	1.620	50	20	IDGD	
O=C(CCCNS(=O)(=O)c1ccc2c(c1)OCCCO2)NNc1ncncc1Cl	781833752	LPWHGERQKVQJCN-UHFFFAOYSA-N	441.897	1.493	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCc2cccc(S(=O)(=O)N(C)C)c2)cc1OC	782539143	QYKQIDAZTWBKNU-UHFFFAOYSA-N	436.490	1.098	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1ccccc1CCN(C)C	782703116	WTVCDUGNODXGPL-UHFFFAOYSA-N	430.530	1.678	50	20	IDGD	
O=C(Nc1ccn(CCN2CCOCC2)n1)C(=O)NN(Cc1ccccc1)c1ccccc1	782821257	KSJYOALIVVCTLU-UHFFFAOYSA-N	448.527	1.892	50	20	IDGD	
CCNC(=O)N1CCc2ccc(NC(=O)C(=O)NN=c3sc4ccccc4n3C)cc21	783349207	CQWTVJWLOSNGCS-UHFFFAOYSA-N	438.513	1.902	50	20	IDGD	
Cn1c(=NNC(=O)C(=O)Nc2cc(F)cc(N3CCOCC3)c2)sc2ccccc21	783349506	KGYROLJMUPNSKN-UHFFFAOYSA-N	429.477	1.786	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NN[C@]2(C)CCS(=O)(=O)C2)c(-c2nc(C3CC3)no2)c1	783424585	FQOIQBGVPDTQCD-LJQANCHMSA-N	433.490	1.059	50	20	IDGD	
O=C(NNc1ccc([N+](=O)[O-])cc1Cl)C(=O)Nc1ccccc1CN1C(=O)CCC1=O	784380544	WNGRLDFNMSXZAX-UHFFFAOYSA-N	445.819	1.979	50	20	IDGD	
CCc1c(C(=O)NNC(=O)CCN2C[C@H](C)O[C@@H](C)C2)nnn1Cc1ccc(F)cc1	787865562	SRTOIFNBYVHWPU-GJZGRUSLSA-N	432.500	1.288	50	20	IDGD	
CCc1c(C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)nnn1Cc1ccc(F)cc1	787865863	XQSFLVBNKAZONM-UHFFFAOYSA-N	449.446	1.994	50	20	IDGD	
Cc1noc(-c2ccc(C(F)(F)F)cc2NC(=O)C(=O)NNC(=O)Cc2cccnc2)n1	789734914	QSBWBVRGGAQEIF-UHFFFAOYSA-N	448.361	1.787	50	20	IDGD	
O=C(NNC(=O)N1CCC[C@@H](N2CCCS2(=O)=O)C1)c1cccc(Br)c1	789840962	YZFZQDGJHUISOX-CQSZACIVSA-N	445.339	1.303	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNS(=O)(=O)c1c(Cl)ccc(F)c1F	790068681	RMNJHGUHVRAXEF-UHFFFAOYSA-N	438.239	1.898	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)[C@@H](OC)C3CC3)c2)cc1	792013897	ZUYGQRVGZBZUNA-SFHVURJKSA-N	433.486	1.682	50	20	IDGD	
Cn1nc(C(F)F)c2cc(C(=O)NNC(=O)c3csc(N4CCOCC4)n3)sc21	792021141	HHPSJFJKEQONGL-UHFFFAOYSA-N	442.473	1.940	50	20	IDGD	
CC(C)OC(=O)CC[C@@H](C)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	792300378	GUWANTJNHQQRLJ-CYBMUJFWSA-N	428.511	1.001	50	20	IDGD	
CN(C)N(C(=O)Cc1csc(NC(=O)c2cccc(O)c2)n1)[C@H]1CCS(=O)(=O)C1	792854881	LGFIFSNANHYDNU-AWEZNQCLSA-N	438.531	1.136	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1cccc(Br)n1	793021578	FOUBDYNKZALBSR-VIFPVBQESA-N	425.214	1.537	50	20	IDGD	
CC(C)(C)OC(=O)NC(C)(C)c1cc(C=NNC(=O)CNC(=O)c2cccnc2)on1	793023974	GXMAJXPPOYEGCA-UHFFFAOYSA-N	430.465	1.710	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1	794075214	GNIXOWHYVCTUHF-UHFFFAOYSA-N	438.400	1.468	50	20	IDGD	
O=C(CN1CCNC(=O)[C@H]1c1ccc(Br)cc1)NNC(=O)c1ccccc1	796573853	DQKJHNPUBHZMHF-QGZVFWFLSA-N	431.290	1.383	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(OC(C)C)c(C(N)=O)c1	796991470	FBJQGFWQRYVGEB-UHFFFAOYSA-N	442.472	1.300	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccc(NC(=O)OC)c1C	798042136	NKTOBMGHHJXOAX-UHFFFAOYSA-N	428.445	1.901	50	20	IDGD	
Cc1ccc(C2=NO[C@H](CNC(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)C2)cc1	800753096	WRDDGSJHESAAPN-HNNXBMFYSA-N	434.456	1.379	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNS(=O)(=O)c1cc(Br)cnc1Cl	800837320	UDMUHQDOFMIMBM-UHFFFAOYSA-N	427.708	1.112	50	20	IDGD	
O=C(CCCN1C(=O)CNC1=O)NNC(=O)Nc1ccc(Br)cc1Cl	802039010	VIDKEHULIXOCBX-UHFFFAOYSA-N	432.662	1.587	50	20	IDGD	
Cc1c(/C=C(\C#N)C(=O)N[C@@H](C)CCNS(=O)(=O)c2ccccc2)cc(C#N)n1C	802323698	LTTOBSTXPZVJDM-LZNAANCOSA-N	425.514	1.985	50	20	IDGD	
O=C(NC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1)NNC(=O)c1cnn(-c2ccccc2)c1	802336031	UDWXDTWSGQDSMH-IBGZPJMESA-N	446.467	1.944	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)c1ccc(S(=O)(=O)NCc2ccco2)cc1	804953605	WRVDAQYBNOXLER-UHFFFAOYSA-N	439.457	1.491	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NCc1ccncc1OCc1ccccc1	805044672	YBEZYEWVNAXTNO-UHFFFAOYSA-N	439.497	1.983	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2Cc2ccccc2)ccn1	806973668	HZUQBVCQJTUCQA-UHFFFAOYSA-N	434.452	1.846	50	20	IDGD	
O=C(CCC1CCCCC1)NNC(=O)C(=O)Nc1ccc(F)c(N2C(=O)CCC2=O)c1	806978110	MXUGIGHFJGMJRB-UHFFFAOYSA-N	432.452	1.926	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)[C@@H]2CCCN2C(=O)C(F)(F)F)n[nH]1	807084446	LMUIZQFDYZYFRP-ZDUSSCGKSA-N	425.367	1.400	50	20	IDGD	
C[C@@]1(C2CC2)NC(=O)N(c2cccc(CNC(=O)NNc3nc4ccccn4n3)c2)C1=O	807238121	UIGWUUPUTBKMAC-NRFANRHFSA-N	434.460	1.781	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1csc(N2CCOCC2)n1)[C@H](c1ccccc1)N(C)C	807402261	FASMUSAYINOBOF-RHSMWYFYSA-N	432.550	1.615	50	20	IDGD	
O=C(NCCCn1cc(Br)cn1)NNC(=O)c1cc(Br)c[nH]1	807611110	ALUBYIDTTGNFPR-UHFFFAOYSA-N	434.092	1.771	50	20	IDGD	
COC(=O)c1c(F)ccc(NC(=O)C(=O)NNC(=O)c2ccc(OC)cc2OC)c1C	810387101	FSZFMCZHSHMISF-UHFFFAOYSA-N	433.392	1.338	50	20	IDGD	
NC(=O)c1ccc(NC(=O)C(=O)NNc2ccc3c(=O)[nH]ccc3c2)c(OCC(F)F)c1	810411949	WSYFATDRYSWISN-UHFFFAOYSA-N	445.382	1.353	50	20	IDGD	
O=C(NN=Cc1cc(I)cc([N+](=O)[O-])c1)C(=O)Nc1ccccn1	811644677	FNBYHQNHIFVWLJ-UHFFFAOYSA-N	439.169	1.683	50	20	IDGD	
O=C(NNC(=O)c1cccc(Br)c1)C(=O)N1CCN(c2ccccc2)CC1	812523614	WCCSZZLWBUEUMT-UHFFFAOYSA-N	431.290	1.559	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)cc1	813033276	LZRFNEWGVRDDLP-UHFFFAOYSA-N	436.490	1.044	50	20	IDGD	
C[C@@H]1CN(c2cccc(F)c2)CCN1C(=O)NNC(=O)c1csc(N2CCOCC2)n1	814271215	XRXIZPKYUIYKPJ-CQSZACIVSA-N	448.524	1.684	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NN=C1CCS[C@@H]1C)N(S(C)(=O)=O)CC2	814759092	QISWTLXMLUQSLC-WBMJQRKESA-N	441.575	1.950	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2ccc([C@H]3CCOC3)cc2)c2ccccc2c1=O	815565783	AALBHTLUAPTKBZ-HNNXBMFYSA-N	449.467	1.320	50	20	IDGD	
COCCN(C)NC(=O)c1cc(S(=O)(=O)NCCOc2ccccc2)ccc1Cl	816562242	DHVFYWHDTDLLRM-UHFFFAOYSA-N	441.937	1.920	50	20	IDGD	
CS(=O)(=O)c1ccc(-c2csc(CC(=O)NNC(=O)NCC(F)(F)F)n2)cc1	816565637	WOHBFHWWPOGQRZ-UHFFFAOYSA-N	436.437	1.649	50	20	IDGD	
O=C1CNC(=O)c2ccc(C(=O)NNc3cc([N+](=O)[O-])ccc3Br)cc2N1	816576097	JREDEHISDMGNBM-UHFFFAOYSA-N	434.206	1.796	50	20	IDGD	
Cc1ccc(N(CCC(=O)N2CC[C@@H](B(O)O)C2)S(=O)(=O)c2ccc(C)cc2)cc1	864234884	XVQBFEOHKAUFFY-GOSISDBHSA-N	430.335	1.964	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C2CCN(C(=O)c3cccnc3)CC2)cc1	913210950	UBFAVIPVRHYKHD-MRXNPFEDSA-N	440.500	1.947	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2cn(-c3ccc(Cl)cc3)nn2)c2ccccc2c1=O	914750545	LPIGULCKAVRCCU-UHFFFAOYSA-N	437.847	1.725	50	20	IDGD	
COc1cc(C(C)=O)ccc1OCCCC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	915857489	HSDOTOYHFVAZKO-UHFFFAOYSA-N	448.497	1.922	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NN=Cc2ccccc2N2CCO[C@H](C)C2)cc1	915945486	VKTVPYYEXJMJIZ-GOSISDBHSA-N	444.557	1.991	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NN=C2C(=O)Nc3cc(N4CCOCC4)ccc32)c1	915960094	YKIINZRHNUMNQR-UHFFFAOYSA-N	428.470	1.013	50	20	IDGD	
CCCCS(=O)(=O)N1CCC(C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)CC1	916037638	XEIAUKJGGSLBMR-CQSZACIVSA-N	429.514	1.582	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)NCc1ccc(C(=O)N2CCOCC2)cc1	916248815	QYKPKSLBNPDGBX-UHFFFAOYSA-N	430.436	1.208	50	20	IDGD	
CCn1cnc2c1c(=O)n(CC(=O)NN=Cc1ccc(C)o1)c(=O)n2Cc1ccccc1	916331075	DXXLNLPTBYSPNZ-UHFFFAOYSA-N	434.456	1.480	50	20	IDGD	
CN1CCN(Cc2ccc(CNC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)cc2)CC1	916387514	DSSXMFHTMWISMG-UHFFFAOYSA-N	426.477	1.486	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCc2nncn2-c2ccccc2)nc1	916580461	CJQSGHBAWXSQRB-UHFFFAOYSA-N	430.494	1.175	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NN=Cc2c(C)nn([C@@H]3CCS(=O)(=O)C3)c2Cl)cc1	917031502	KYVIBIYKWXWQGX-CQSZACIVSA-N	437.909	1.602	50	20	IDGD	
CCC(=O)N[C@@H](CCSC)C(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12	917387965	SWUQLZCBWHBFBS-HNNXBMFYSA-N	433.534	1.386	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1)c1ccccc1O	919809347	KUXDGEAQXXZHRM-ZDUSSCGKSA-N	448.457	1.162	50	20	IDGD	
Cc1nn(C(C)(C)C)c2nc(C3CC3)cc(C(=O)NNC(=O)N[C@H]3CCS(=O)(=O)C3)c12	919886903	WDVDHQZGPZMRML-ZDUSSCGKSA-N	448.549	1.503	50	20	IDGD	
O=C(NNC(=O)c1nc(-c2cccs2)n(-c2ccccc2)n1)N[C@H]1CCS(=O)(=O)C1	919888983	JJDQTVOIUHIZFN-LBPRGKRZSA-N	446.514	1.127	50	20	IDGD	
CN(C)C(=O)Cn1cc(C(=O)NNC(=O)c2cc3c(s2)CC[C@@H](C(C)(C)C)C3)nn1	919926222	KZKDUZBBBRKGCU-CYBMUJFWSA-N	432.550	1.654	50	20	IDGD	
Nc1c(I)cccc1C(=O)OCC(=O)NNC(=O)c1cccs1	920705799	LHYJJQVOZOOTJU-UHFFFAOYSA-N	445.238	1.553	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCCN1Cc1cccnc1)c1csc(N2CCOCC2)n1	1318654980	WFDGXOWLUJMCMY-QGZVFWFLSA-N	430.534	1.190	50	20	IDGD	
CC(C)[C@@H](C(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1)N1C[C@@H](C)O[C@H](C)C1	1318667453	FMSRJHYZKWCBAL-NUJGCVRESA-N	440.585	1.915	50	20	IDGD	
COCCOc1ccc(-n2nc(C)c(C(=O)NNC(=O)c3n[nH]c4c3CCCC4)n2)cc1	1339172930	LRIWQVGNWFJIEY-UHFFFAOYSA-N	439.476	1.278	50	20	IDGD	
Cc1cc(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CO[Si](C)(C)C)C2)nn1C	1779539977	YBXHHLLVTNVXNM-WIYYLYMNSA-N	436.629	1.636	50	20	IDGD	
CN(C)c1cccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)c1	1780643935	RENCJTNCCCWSEX-CRAIPNDOSA-N	428.302	1.887	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(OC)c(OC)c3)C2)C1	1780659508	WUVLHBWANBRTIR-YWZLYKJASA-N	426.897	1.401	50	20	IDGD	
COCCn1nccc1C(=O)N1CCO[C@]2(CCN(C(=O)[C@](C)(Cl)CCl)C2)C1	1781229953	NGBMBJJDESGDIB-QZTJIDSGSA-N	433.336	1.209	50	20	IDGD	
O=C(CCOc1ccccc1)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781328735	XWACQOJZHROOHL-AEFFLSMTSA-N	429.286	1.976	50	20	IDGD	
O=C(c1cnn2ccccc12)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781330323	WHDIPBVCQGARCP-YOEHRIQHSA-N	425.258	1.468	50	20	IDGD	
CC(=O)N(C)[C@@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)Br)C1	1781998769	HDFAYZFBTGCQGV-FHKFTOANSA-N	432.359	1.151	50	20	IDGD	
CC[C@@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](Cl)COC)C1)N(CC)CC	1782171937	HBNXMBVKVIODBZ-BMQTXXJKSA-N	432.005	1.875	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccn3ccnc13)C2	1782176298	ZPCDQQCQGMTFJQ-CSODHUTKSA-N	434.924	1.716	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)CCc3ccc(O)nn3)C2)C1	1782641800	XLPLVCUGKBCQKO-RDTXWAMCSA-N	441.326	1.118	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@]2(C1)CN(C(=O)c1cncnc1)CCO2	1782863643	GBYWDWVQHDUKPY-RWHUQTJRSA-N	439.422	1.805	50	20	IDGD	
CC[C@@H](NC)C(=O)N1CCO[C@]2(CCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1	1782864493	NAZJYPKJDYSXAA-WFCRQVQFSA-N	432.471	1.700	50	20	IDGD	
C=C1CC(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)C[C@@H]32)C1	1783461196	CMXLFRBKTDGPCQ-SKFHZHBLSA-N	427.505	1.066	50	20	IDGD	
COc1ccc(CC(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](C)Br)C3)C2)cc1	1783533560	ZZLMUEFYQGYFIG-KUHUBIRLSA-N	425.323	1.851	50	20	IDGD	
COc1cc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](C)Br)C3)C2)ccc1O	1783538954	ZDAMVGFJEYDOBB-XIKOKIGWSA-N	427.295	1.628	50	20	IDGD	
CC(=O)Nc1ccc(CC(=O)N2CCO[C@@]3(CCN(C(=O)C(Cl)Cl)C3)C2)cc1	1783947688	GXCBPEOVOFYERS-IBGZPJMESA-N	428.316	1.821	50	20	IDGD	
CCOC(CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]2C1)OCC	1783974856	VWUNZPLGMXAYHX-VGWMRTNUSA-N	449.386	1.786	50	20	IDGD	
CN(C)c1c(F)cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]3C2)cc1F	1784092258	LQAYLZQRBKKSBN-BHADISHBSA-N	445.894	1.224	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)CCCn3ccnc3)C2)C1	1784402993	IBAXBLZGRLHTMD-MAUKXSAKSA-N	427.343	1.667	50	20	IDGD	
O=C([C@@H](O)CCl)N1CCO[C@@]2(CCN(C(=O)[C@H]3CC[C@H](C(F)(F)F)CC3)C2)C1	1785380574	IYTPLHRZRIJIHO-AYMQEEERSA-N	426.863	1.785	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)Cc3ccc(F)cc3OC)C2)C1	1785660245	GSPYXCSTHYWOCP-OXQOHEQNSA-N	428.888	1.461	50	20	IDGD	
COc1nn(C)cc1C(=O)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1	1787242920	RBCUCVNXPPSBQX-UHFFFAOYSA-N	448.288	1.170	50	20	IDGD	
Cc1ccncc1CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]2C1	1789922683	RTFPTBIOMMYBBY-OVWQWFNUSA-N	442.329	1.993	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)Oc3ccccn3)[C@H]2C1	1791627523	XIJHIGODXPIURK-WOYTXXSLSA-N	425.913	1.082	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C/N=C/c1ccco1)C2	1792870876	LYPNTIPUDMWWCK-NSBGJDIASA-N	426.311	1.319	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](CC1CC1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCl	1793116404	MKLBVDDRXQUWOP-JJTUDDRGSA-N	443.972	1.918	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@](C)(O)C(F)(F)F	1793693899	AWFRQWMSVFVSQB-UKRLYRRISA-N	431.249	1.063	50	20	IDGD	
COC(=O)NCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1794144159	RYKKAEDANZJXEM-CRWXNKLISA-N	446.932	1.113	50	20	IDGD	
COCCOCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)C2	1795355551	KUJWKXYSTAKECA-RNCDSHHQSA-N	449.454	1.124	50	20	IDGD	
Cc1ccc(CCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)cc1F	1796189872	KUDXHTKRWFDVFX-WKCHPHFGSA-N	438.308	1.699	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1nccc2nc[nH]c12	1796236247	MKUYQRVWGSTHFH-NRWUCQMLSA-N	436.310	1.192	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(-n2cccn2)nc1	1798213790	AKULNHKBDSIYFN-FAYQHZLMSA-N	448.321	1.254	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(N(C)C)nc1	1798259904	KXECXUPFNDFJJC-JJAZEVLHSA-N	439.354	1.382	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)Nc1cccnc1)C2	1800640196	YQEUVVMUFQOQKQ-CTTHAOKLSA-N	439.354	1.645	50	20	IDGD	
Cc1ccn2c(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)c3cnccc3C(=O)NN)C4)cnc2c1	1801133202	FAHVZOIKHSIAPH-MUJYYYPQSA-N	447.499	1.207	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)Cn1ccnc1	1801375580	GQTWIHNTXWQPJA-RBGFHDKUSA-N	427.343	1.282	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(C(N)=O)cc1	1801658133	IUFWFFXZUNVCCO-QKPAOTATSA-N	438.322	1.162	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1ccc2c(c1)CCCO2	1801673245	ICQYHNIHZQYJPF-FSDCSDTHSA-N	441.297	1.905	50	20	IDGD	
CC(=O)NCCC(=O)N1CC[C@H](CNC(=O)CCBr)[C@H]1c1cccnc1	1806346304	FYYOAWHGOUNQGA-CRAIPNDOSA-N	425.327	1.399	50	20	IDGD	
CC(=O)NCCC(=O)N1CC[C@@H](CNC(=O)CCBr)[C@H]1c1cccnc1	1806346305	FYYOAWHGOUNQGA-MAUKXSAKSA-N	425.327	1.399	50	20	IDGD	
COc1cc(C(=O)N2CCCC3(CCN(C(=O)[C@H](F)Br)CC3)C2)n(C)n1	1807526129	BIJDWTIOTDYHIY-AWEZNQCLSA-N	431.306	1.964	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1CCN(C(=O)[C@@H]2CCC(=O)NC2)[C@H]1c1cccnc1	1808290810	YLRCWXAVIADTCF-MQJTVSLUSA-N	441.359	1.850	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)c1cnc2ccccc2n1	1808966100	YUANNMYVHXFZPN-RYGJVYDSSA-N	439.903	1.944	50	20	IDGD	
CC(=O)N/C(C)=C/C(=O)N1CC[C@@H](CNC(=O)CO[Si](C)(C)C)[C@@H]1c1cccnc1	1810544710	QVKUSEDKTZFFKE-RSSVORECSA-N	432.597	1.979	50	20	IDGD	
CC(C)(CCl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](O)N2CCOCC2)[nH]n1	1814697215	SGQDDXAIKRZSRJ-ZBFHGGJFSA-N	427.933	1.317	50	20	IDGD	
Cc1ccc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)cn1	1815339394	CQFVFNCKGADXKQ-MRXNPFEDSA-N	436.302	1.066	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cnccc2F)[nH]n1)c1cccc(B(O)O)c1	1817475301	NTBHEWXDRXMRJK-GOSISDBHSA-N	437.240	1.243	50	20	IDGD	
CC/C=C(\C)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1	1819801349	IUMLRVKHXZPTBG-KBVBDRTLSA-N	428.518	1.724	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](C)N2CCN(C)CC2)n[nH]1	1820789967	SLEWRZOYISJLBR-VYDXJSESSA-N	440.976	1.292	50	20	IDGD	
COC[C@H](NC(C)=O)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@](C)(Cl)CCl)n[nH]1	1820866742	SAIXINFPZPVVHP-PMUMKWKESA-N	448.351	1.789	50	20	IDGD	
CC[C@H](NC(C)=O)C(=O)N[C@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1	1822999598	VENMBKOMVXDLAY-AUTRQRHGSA-N	435.319	1.660	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)Cc2cnccn2)CC1	1824311298	XRAOEAUJQVXLJR-LJQANCHMSA-N	430.553	1.012	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1c(C)nn(C)c1C)CC2	1825994927	QUDLCMXQPIFOKM-NEPJUHHUSA-N	425.942	1.973	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)CCc2cnn(C)c2)CC1	1827092726	GAQLKBCIRCHGPD-HXUWFJFHSA-N	446.596	1.345	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](N)Cc2cscn2)CC1	1827549837	KCOUIQHCMFOKBF-BZSNNMDCSA-N	443.013	1.886	50	20	IDGD	
O=C(c1n[nH]c2c1CS(=O)(=O)C2)N1CCC([C@H]2CCCCN2C(=O)[C@H](F)Cl)CC1	1827607582	IEDRUUBMXCKZSF-ZBFHGGJFSA-N	446.932	1.606	50	20	IDGD	
C#CC(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1829267542	UBRJAJJUVADDIL-FQEVSTJZSA-N	438.311	1.875	50	20	IDGD	
CC(C)=NO[C@@H](C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1	1830416120	QNOPIEKAJHAAQW-UWJYYQICSA-N	443.353	1.401	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(F)cc3)C2)C1	1830543434	RYRAWJTURKTMHY-KUHUBIRLSA-N	443.313	1.927	50	20	IDGD	
COC(=O)[C@@H]1CC[C@@H](C(=O)N2CCO[C@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)C1	1830704931	CJIMIQHFDVGWAY-WHSLLNHNSA-N	444.956	1.297	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc4[nH]ncc4c3)C2)C1	1831651542	RAPVNPOVNDKJPB-OXJNMPFZSA-N	435.912	1.435	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@H](O)CCl)CC1	1831814253	XYKXOUKLECVLAD-ZSYWTGECSA-N	440.968	1.961	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(OC)n(C)n2)CC1	1831831652	GGSNLDCHHWRJBK-NVXWUHKLSA-N	426.945	1.916	50	20	IDGD	
Cc1onc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)c1C	1831981658	GPDAYODHTDHJIY-BBRMVZONSA-N	434.262	1.052	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@H](C)C3(O)CCC3)CC2)CC1	1833071588	HYCZUJSBYXIVGE-YJBOKZPZSA-N	429.989	1.363	50	20	IDGD	
CC(C)(C)n1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)cn1	1833457592	RZJBWQMCBQZNDS-SFHVURJKSA-N	433.336	1.512	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)C(=O)c3ccccc3)CCO2)C1	1834706808	UPQJRSJNLAWMGP-WOJBJXKFSA-N	443.327	1.562	50	20	IDGD	
CC[C@H](C)[C@H](O)C(=O)N1CCC(N2CCC(NC(=O)CO[Si](C)(C)C)CC2)CC1	1835834779	KGXINDTUMPNCFK-JXFKEZNVSA-N	427.662	1.817	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cc(=O)ccn3C)CC2)CC1	1836107280	DUWPTTZKSJYZGO-LJQANCHMSA-N	436.984	1.978	50	20	IDGD	
O=C(c1csc2c1CCCO2)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1836388926	LDANVQHDZWZVSJ-KDOFPFPSSA-N	432.901	1.678	50	20	IDGD	
O=C(c1n[nH]c2c(F)cccc12)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1837061204	RQKSCJHUKCTIID-SFHVURJKSA-N	445.278	1.576	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccn(C(F)F)c3=O)CCO2)C1	1837772115	LJXADDYIPZHNGZ-LIRRHRJNSA-N	447.866	1.331	50	20	IDGD	
Cn1ccc(CC(=O)N2CCC(OC3CCN(C(=O)CO[Si](C)(C)C)CC3)CC2)n1	1837948446	XGBMXZGOVFPCKO-UHFFFAOYSA-N	436.629	1.813	50	20	IDGD	
O=C(c1ncccc1C(F)(F)F)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1838142175	GEULTHFYICNHSW-CJNGLKHVSA-N	439.793	1.705	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnn4ccc(C)cc34)C2)C1	1839144134	RCYQLQFWNQKYTF-UTKZUKDTSA-N	434.924	1.730	50	20	IDGD	
Cc1ccc(F)c(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)c1	1839202155	WELNUQXLMMKWTH-MAUKXSAKSA-N	447.276	1.895	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(O)c(F)c3)C2)C1	1840035395	PXMVHJXYDZGFMD-KPZWWZAWSA-N	445.285	1.385	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)Cc3ccco3)C2)C1	1840036879	RNMQRIRQIFPOEN-YZVOILCLSA-N	443.338	1.698	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(Cl)ccn3)C2)C1	1840153321	KDYJSVBTWHNYHY-KBXCAEBGSA-N	432.304	1.059	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCCn3ccnc3C)CCO2)C1	1840388341	UIKAOAFWEZRHFN-XLIONFOSSA-N	426.945	1.446	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)N2CC3(CCCN3C(=O)CCBr)C2)c1	1842636824	YMMPTUCPPDRTBC-UHFFFAOYSA-N	429.336	1.692	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)c2cnn(Cc3ccccc3)c2)C1	1844486805	GUAHUWDOFXLYJM-UHFFFAOYSA-N	438.532	1.121	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC2(CCCN2C(=O)c2cc(CO)on2)C1	1844821319	DRPTTYJLHLDCHY-MKMNVTDBSA-N	428.395	1.869	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H]2C[C@]21C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl	1847563615	LENMHVRVNKMPIV-ZSORPBTDSA-N	427.929	1.187	50	20	IDGD	
CN1CCCC[C@H]1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1847576561	NCEJBVZGJNIFKM-QAETUUGQSA-N	442.988	1.805	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2c3cccc4cccc(c34)S2(=O)=O)cc1OC	15662997	WKNNLJYRPGQELY-UHFFFAOYSA-N	441.465	1.827	50	20	IDGD	
CCN(CC)c1ccc(C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1	15902107	AWODMOUSPXRIMD-UHFFFAOYSA-N	432.546	1.923	50	20	IDGD	
CC(C)Nc1ccc(S(=O)(=O)NCC(=O)NNC(=O)OC(C)(C)C)cc1[N+](=O)[O-]	17398674	VZZWAWVCNXRCFR-UHFFFAOYSA-N	431.471	1.249	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)CN1C(=O)N[C@@]2(CCCC[C@H]2C)C1=O	25413506	SWCFVKMZZSYFHM-SPLOXXLWSA-N	432.477	1.112	50	20	IDGD	
CNS(=O)(=O)c1ccc(C)c(C(=O)NNC(=O)c2ccc(Br)s2)c1	27320260	VHJFZVWQTDQQDN-UHFFFAOYSA-N	432.321	1.802	50	20	IDGD	
Cc1cc(C)n(-c2ccc(CCNC(=O)NNC(=O)CNC(=O)c3cccs3)cc2)n1	725874415	YMROKKIEHNCWKF-UHFFFAOYSA-N	440.529	1.854	50	20	IDGD	
CCOc1ccccc1[C@@H](CC(=O)NNC(=O)c1nnc(O)c2ccccc12)NC(C)=O	728265247	QJEYRHSSCJTCQO-QGZVFWFLSA-N	437.456	1.763	50	20	IDGD	
COc1cccc2c1OC[C@@H](NC(=O)NNC(=O)c1cc(OC)c(OC)c(OC)c1)C2	728398543	HCRMJCNUXIDGTE-AWEZNQCLSA-N	431.445	1.669	50	20	IDGD	
O=C(NNS(=O)(=O)c1cccc(C(F)(F)F)c1)C1CCN(c2ncccn2)CC1	728856111	HEKMFFQIVNENNC-UHFFFAOYSA-N	429.424	1.722	50	20	IDGD	
C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)C1	728949839	VSJBPBKOROAGTG-PXNSSMCTSA-N	437.548	1.859	50	20	IDGD	
CCCN(CCC)S(=O)(=O)c1ccc(C(=O)N([C@@H]2CCS(=O)(=O)C2)N(C)C)cc1	729172223	UDQAXWBRRQSEKM-QGZVFWFLSA-N	445.607	1.603	50	20	IDGD	
O=C(NNC(=O)c1cnc(C2CC2)s1)c1cccc(S(=O)(=O)N2CCOCC2)c1	729296074	TXOAWHMTPSITQW-UHFFFAOYSA-N	436.515	1.116	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)N[C@H](C)c2nnc3n2CCCCC3)nc1	729615426	FSASQPDOTUHPCG-CYBMUJFWSA-N	436.542	1.474	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCC2(N3CCCC3)CCOCC2)c2ccccc2c1=O	729622785	AJZIDUWKALGBCR-UHFFFAOYSA-N	442.520	1.005	50	20	IDGD	
CC(C)(C(=O)NNC(=O)CCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1ccccc1	731201634	QZFFYVSCBFFXDC-UHFFFAOYSA-N	434.474	1.388	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C1CCN(S(=O)(=O)c2c(C)noc2C)CC1	731491811	ZNJBLPCWXGIWKU-UHFFFAOYSA-N	436.490	1.162	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2cc(Cl)ccc2O)nnn1-c1cccc2c1CCN(C)C2	731748834	PTNHWAZMVKYCHP-UHFFFAOYSA-N	440.891	1.997	50	20	IDGD	
COc1ccc2c(c1)OC[C@H](C(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)C2	732332781	KVJLAFOQKXIHTG-CQSZACIVSA-N	429.385	1.159	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)NNC(=O)N[C@@H](Cc1ccccc1)CN1CCOCC1	732476196	AMLVQHHTRCBTBC-FQEVSTJZSA-N	435.528	1.984	50	20	IDGD	
O=C(CCNS(=O)(=O)c1cccc([N+](=O)[O-])c1)NNc1ccc(Br)nc1	732835935	CMZKUZYVVOXSOQ-UHFFFAOYSA-N	444.267	1.564	50	20	IDGD	
CCc1cc(N2CCC[C@@H](NC(=O)NNC(=O)COc3ccc(OC)cc3)C2)ncn1	732914021	JPRPOSNRPFJXLM-MRXNPFEDSA-N	428.493	1.426	50	20	IDGD	
Cc1nnnn1[C@H](Cc1cccc(F)c1)C(=O)NNC(=O)c1cnn(-c2ccccc2)c1	733110015	NGSLTZOCUCMIHY-LJQANCHMSA-N	434.435	1.551	50	20	IDGD	
COc1ccc(OC)c([C@@H](O)CNC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c1	733348527	PGSHDDQHZWXQBF-SFHVURJKSA-N	425.445	1.567	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NCCc1ccc(Br)cc1	735325943	MGWWOVMSISDOTK-UHFFFAOYSA-N	425.308	1.814	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)[C@H](C)Oc1cccc(Br)c1)CN1CCOCC1	739049568	PXWKTERJZZSWPI-KBPBESRZSA-N	443.342	1.515	50	20	IDGD	
Cc1ccc(C)c(NC(=S)NNC(=O)CN2CCN(C(=O)OC(C)(C)C)CC2=O)c1	741298661	GKSQTFNPRJHXHQ-UHFFFAOYSA-N	435.550	1.700	50	20	IDGD	
Cc1cc(N2CCCS2(=O)=O)ccc1C(=O)NNC(=O)[C@@H]1COc2ccccc2O1	741515109	SFYAYWOWXJCXAD-SFHVURJKSA-N	431.470	1.136	50	20	IDGD	
CCN(CC(=O)NNC(=O)Cc1nc(C)cs1)CC(=O)Nc1c(F)cccc1F	741926556	AKLRTVWYTQRIHG-UHFFFAOYSA-N	425.461	1.380	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNS(=O)(=O)c2ccc(N(C)C(C)=O)cc2)cc1	742026174	NBKXUVURSDVFOE-AWEZNQCLSA-N	435.502	1.845	50	20	IDGD	
CCCCc1ccc(NC(=S)NNC(=O)CN2C(=O)[C@H]3[C@H](C2=O)[C@H]2CC[C@H]3O2)cc1	743821308	LWRNHHNWSAPAEM-JOCBIADPSA-N	430.530	1.509	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Nc2ccc(N(C)C)cc2)cc(OC)c1OCC(N)=O	743827671	KYSMNDNIAYOUFE-UHFFFAOYSA-N	431.449	1.100	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccc(F)cc3F)CC2)c1	744393320	JBOYSJHGLAWYED-UHFFFAOYSA-N	427.411	1.055	50	20	IDGD	
Cc1ccc(F)c(NC(=S)NNC(=O)c2ccc(CCNS(C)(=O)=O)s2)c1	745195426	HUUIQVMDTJFNPF-UHFFFAOYSA-N	430.552	1.919	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCCCC(=O)OC(C)(C)C)cc1	745930437	DUBAIDLPKWMKME-UHFFFAOYSA-N	442.538	1.068	50	20	IDGD	
O=C(NNC(=O)c1cc(S(=O)(=O)N2CCCC2)ccc1O)c1cc2c(s1)CCC2	745991527	WZYAIKKQCNCYLR-UHFFFAOYSA-N	435.527	1.802	50	20	IDGD	
O=C(CCN/C(O)=C1/N=CC=CC1=O)NNC(=O)c1ccc(F)cc1Br	746136262	KEBSLPPLOUTBIE-PEZBUJJGSA-N	425.214	1.266	50	20	IDGD	
CCOc1ccc(Oc2cc(CNC(=O)NNC(=O)C(=O)N3CCCC3)ccn2)cc1	748460133	KBDJBIRMPIGSQP-UHFFFAOYSA-N	427.461	1.725	50	20	IDGD	
CC(=O)NCc1ccc(S(=O)(=O)NCC(=O)NNc2cccc([N+](=O)[O-])c2C)s1	748670734	XWMAPOCLVQGOOP-UHFFFAOYSA-N	441.491	1.022	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c(F)cc1F	748691437	QYJAOTKAVPTYJU-UHFFFAOYSA-N	439.440	1.369	50	20	IDGD	
CCN=c1nc(NCC)n2c(SCC(=O)NNc3ccc(C#N)c(Cl)c3)n[nH]c2n1	753296855	DZHDGVFCCGHULQ-UHFFFAOYSA-N	446.928	1.565	50	20	IDGD	
Nc1nc(Cl)cc(NNC(=O)c2ccc3c(c2)SC2=NS(=O)(=O)CCN23)n1	753455775	ZTUMQJGDXAVLAL-UHFFFAOYSA-N	425.883	1.081	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@H](C)C(=O)NNC(=O)c1ccc(CNS(C)(=O)=O)o1	753565856	LVIFQODZNYBFTD-GFCCVEGCSA-N	443.909	1.828	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)N[C@H]2C[C@@H](C)N(C3CC3)C2)c2ccccc2c1=O	753944906	OPOSDGFCJDEVGP-CABCVRRESA-N	426.521	1.766	50	20	IDGD	
CS(=O)(=O)NCc1ccc(C(=O)NNc2nc(-c3ccccn3)nc3c2CCC3)o1	754017412	MMYMLHUKZWILRG-UHFFFAOYSA-N	428.474	1.426	50	20	IDGD	
CN(Cc1nc[nH]n1)C(=O)/C(C#N)=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	754860030	WDIQFOHGSWWEQQ-RIYZIHGNSA-N	438.879	1.763	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)N[C@@H](C)CNC(=O)OC(C)(C)C	755225177	BLEHGOXYGUGCLX-NSHDSACASA-N	442.542	1.145	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)COc2ccc(C)c(C)c2)n([C@@H]2CCS(=O)(=O)C2)n1	755530029	DJVMJVDLXYUQPY-OAHLLOKOSA-N	435.506	1.400	50	20	IDGD	
CCCOc1cc(NC(=O)NNC(=O)[C@H]2COCCO2)c([N+](=O)[O-])cc1OCCC	755558922	QRGILBBEGFDQFK-MRXNPFEDSA-N	426.426	1.741	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)Nc1ccc(N2C[C@H](C)O[C@H](C)C2)nc1	755864353	HYSSQKBYZPWGOS-GASCZTMLSA-N	429.477	1.936	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CN2C[C@@H](CCN3CCCC3=O)c3ccccc32)c1	756598107	BTERWMKQLBTIHF-LJQANCHMSA-N	431.496	1.936	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)Nc2ccn(CCN3CCOCC3)n2)cc1OC	756646855	QBISNZHEVUCGPJ-UHFFFAOYSA-N	446.508	1.479	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1ccccc1-c1cc(F)c(F)c(F)c1	756855826	NPYGOBCKQGFAHM-SECBINFHSA-N	430.408	1.861	50	20	IDGD	
CC[C@H]1CN(CC(=O)NNC(=O)c2ccc(C#N)cc2)CC[C@@H]1NC(=O)OC(C)(C)C	757101267	HFJHUCSATXGXEB-WMZOPIPTSA-N	429.521	1.944	50	20	IDGD	
Cn1ccnc(NC(=O)NNC(=O)[C@H]2Cc3ccccc3CN2Cc2ccccc2)c1=O	757907692	WRVIASPKZXBZMU-LJQANCHMSA-N	432.484	1.560	50	20	IDGD	
COc1ccc(C(C)(C)C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)cc1OC	758146622	OVWGMZVNYQYQLE-UHFFFAOYSA-N	425.441	1.857	50	20	IDGD	
O=C(CN1CC[C@H](N2CC(=O)Nc3ccccc32)C1)NNC(=O)c1cccc(Cl)c1	759910209	LFEGDAXEBCWCKP-INIZCTEOSA-N	427.892	1.634	50	20	IDGD	
COCCC1(CNC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)CCC1	761781002	SKJSJVYAEQAKMY-UHFFFAOYSA-N	438.550	1.622	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)NC[C@@H](O)COc2ccc3c(c2)CCC(=O)N3)cc(C#N)n1C	762368080	IBUSRZMKDVEAQR-CJIFTPGHSA-N	433.468	1.553	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C1=NN(c2ccccc2)C(=O)[C@H](C)N1	762404801	MDMITFSKZBOTKQ-ZDUSSCGKSA-N	427.486	1.273	50	20	IDGD	
COc1ccc(C[C@H](C)CNC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1OC	762529596	SQBQUQWMGAYIHE-AWEZNQCLSA-N	439.476	1.502	50	20	IDGD	
C[S@](=O)Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)ccc1Cl	763442406	PFAYAEHJRNEFBW-LJAQVGFWSA-N	438.849	1.526	50	20	IDGD	
Cc1ncc(NC(=O)C(=O)NNC(=O)c2cc3c(C)nn(-c4ccccc4)c3s2)cn1	763539995	SSLIPCYAKPUFQC-UHFFFAOYSA-N	435.469	1.894	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)NC(=O)CS3)cc1OC	763550119	GFILWGWQRLLBAG-UHFFFAOYSA-N	430.442	1.148	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(-c3nnc(C)o3)c2)cc1	763662641	YKUFWFWSNZURGM-UHFFFAOYSA-N	425.401	1.219	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc2c(c1)NC(=O)CS2	763716618	JXGPZVPQKGRXKH-UHFFFAOYSA-N	428.470	1.458	50	20	IDGD	
CCNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)CSc2ccc(Cl)cc2)c1	763737181	ZABRAZRLBYDDAX-UHFFFAOYSA-N	434.905	1.968	50	20	IDGD	
CCOC(=O)COc1cccc(NC(=O)C(=O)NNC(=O)c2cccc(N(C)C)c2)c1	763754529	UIHAMCVMAROIJJ-UHFFFAOYSA-N	428.445	1.094	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2cc(Cl)ccc2OC)c2ccccc2c1=O	763786945	RWIGSUGBVMFJQN-UHFFFAOYSA-N	443.847	1.478	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)C(=O)Nc2ccc(F)cc2)c2ccccc2c1=O	763801197	LFOOSJNUGMNWCK-UHFFFAOYSA-N	425.420	1.735	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2cccc(CSC3CCOCC3)c2)n1	763884219	DEJRAVKSWOUMRR-UHFFFAOYSA-N	445.545	1.698	50	20	IDGD	
CCc1noc(C)c1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1cccc(Br)c1	763884847	YMPJRFFTXUMNTA-SNVBAGLBSA-N	439.266	1.861	50	20	IDGD	
CC(C)Cn1ccc2cc(NC(=O)C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)ccc21	763916591	HHQNEHDVTBLBFT-UHFFFAOYSA-N	446.471	1.673	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)C(=O)Nc1ccc(F)cc1OC(F)F	763944801	QEAHLJDKYPBNCL-UHFFFAOYSA-N	449.345	1.718	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@@H]2C)ccc1NC(=O)C(=O)NNC(=O)c1cccn1C	763992748	IHSMZMXCSOTTQR-HNNXBMFYSA-N	425.489	1.748	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccccc1-c1nnnn1C(C)C	764138235	AISYFHLWEOOTQK-UHFFFAOYSA-N	437.460	1.258	50	20	IDGD	
CCCCOc1ccc(OC)cc1NC(=O)C(=O)NNC(=O)[C@H]1Cc2ccccc2O1	764154126	OGIQHYWRMMNNBJ-LJQANCHMSA-N	427.457	1.964	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)CCCc2ccccc2)cc1NS(C)(=O)=O	764224440	QAYHNRMEWQXFFV-UHFFFAOYSA-N	448.501	1.176	50	20	IDGD	
Cn1ccnc1C(=O)c1ccc(NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)cc1	764242570	IAWPEPFSMVLGGD-UHFFFAOYSA-N	444.451	1.392	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2scnc2C)cc(OC)c1Br	764245669	IOAVQXZRHISDDI-UHFFFAOYSA-N	443.279	1.631	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2cc3ccccc3o2)cc1-n1nnnc1C	764331219	REQZXVHYCLXEJE-UHFFFAOYSA-N	435.400	1.125	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COCc2ccccc2)ccc1OC1CCOCC1	764365979	IQRFQTSQIQCHRO-UHFFFAOYSA-N	441.484	1.856	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)C(=O)Nc1cccc(NC(=O)c2ccoc2)c1	764366911	QQQRLAMTMTWSMH-UHFFFAOYSA-N	436.424	1.835	50	20	IDGD	
C[S@](=O)c1ccc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)cc1F	764401133	LHKGHIRSXMKOEP-NDEPHWFRSA-N	425.463	1.147	50	20	IDGD	
COc1nccnc1NNC(=O)CC1(CC(=O)NNc2nccnc2OC)CCCCC1	764469375	JJKJMIQVTYSEEB-UHFFFAOYSA-N	444.496	1.601	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)N[C@H]3CCN(c4ccc(Cl)c(F)c4)C3=O)nc21	764508458	MDXWTRSEUOQJHS-LBPRGKRZSA-N	434.819	1.293	50	20	IDGD	
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1	765243495	KYZBQBCETZPWTP-YLJYHZDGSA-N	437.548	1.544	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)CCCNC(=O)C(C)(C)C)CC2)cc1	765748660	NRTXSZOSAUSSGD-UHFFFAOYSA-N	431.581	1.203	50	20	IDGD	
CN1CCN(C[C@@H](NC(=O)NNc2ccccc2S(C)(=O)=O)c2ccccc2)CC1	765826255	TWUIDXASFNJQFC-LJQANCHMSA-N	431.562	1.705	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)N[C@H](c2ccc(Cl)cc2)[C@H]2CN(C)CCO2)n1	766320654	QOKXJMKQQOWGTO-IEBWSBKVSA-N	434.928	1.556	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)[C@H]1CS[C@@H](Cc2ccccc2F)C(=O)N1	766669055	FXKPNGMJOYVSQU-CVEARBPZSA-N	437.518	1.515	50	20	IDGD	
COc1ccc(C(=O)NNc2ncnc3ccsc23)cc1S(=O)(=O)N1CCOCC1	766674250	YOEUGDISJLYWNP-UHFFFAOYSA-N	449.514	1.478	50	20	IDGD	
CS(=O)(=O)CCn1cccc(NC(=O)NNc2ccc(F)cc2Br)c1=O	770078879	FUNWEXFRXXFERI-UHFFFAOYSA-N	447.286	1.943	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@@H]2C(=O)NNC(=S)NCCSC)c(OC)c1	770240071	MJUPQYYCLMIQDI-CQSZACIVSA-N	426.564	1.167	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)Nc1ccnn1[C@H]1CCS(=O)(=O)C1	770759241	NPDCZDOXTIEQRR-AAEUAGOBSA-N	441.897	1.516	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)C1=NN(c2ccccc2)[C@@H](C(=O)OC(C)(C)C)C1	772086105	ADIBSUMHCGKPEM-CZUORRHYSA-N	432.477	1.452	50	20	IDGD	
CCC[C@@H](NC(=O)Cc1ccccc1)C(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772182352	HRACHCKTTRKITR-GOSISDBHSA-N	444.919	1.631	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)OCC(=O)NN=C(c2ccccc2)c2ccccc2)ccn1	772429661	VSGUJPXPDMXUIU-UHFFFAOYSA-N	438.465	1.455	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NNC(=O)CCn2cnc3ccccc3c2=O)C1	773411057	IHQKFBBEJMJODP-OAHLLOKOSA-N	443.504	1.581	50	20	IDGD	
Cn1nc(-c2cc(F)cc(F)c2)cc1NC(=O)C(=O)NNC(=O)[C@@H]1Cc2ccccc2O1	773540051	GVYPIUGJSQMSNF-KRWDZBQOSA-N	441.394	1.455	50	20	IDGD	
N#Cc1ccnc(C(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)c1	774329685	LVMZKHAQOMBRJS-UHFFFAOYSA-N	427.467	1.890	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)C2=NN(Cc3ccc(F)cc3)C(=O)CC2)nc1C	778427777	FTCJFWSWDLPYRQ-UHFFFAOYSA-N	428.424	1.723	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3ccc4c(c3)CCN4C)cc2)CC1	779011464	JQJXVYOIZDJJCV-UHFFFAOYSA-N	429.546	1.372	50	20	IDGD	
Cc1nn([C@H]2CCS(=O)(=O)C2)c(Cl)c1C=NNC(=O)CCNC(=O)OC(C)(C)C	779807537	BMSVJOGOOPFRLE-LBPRGKRZSA-N	447.945	1.569	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)NCc2ncn(Cc3cccc(F)c3)n2)cc1C	780852576	REFIQYWFTBZWIE-UHFFFAOYSA-N	439.451	1.551	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NN=Cc2cc(Br)nn2C)c1	782113726	QUHVUJXGZWYTIR-UHFFFAOYSA-N	442.339	1.977	50	20	IDGD	
CC(=O)N1CCN(Cc2ccccc2NC(=O)C(=O)NNc2ncccc2Cl)CC1	782116165	DZFRXAGXBKDCEI-UHFFFAOYSA-N	430.896	1.481	50	20	IDGD	
CCN(CC)CCCC1CCN(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)CC1	782491168	DGUNZQGDQPFTDB-UHFFFAOYSA-N	428.541	1.851	50	20	IDGD	
CCOc1cc(C)ccc1NC(=O)C(=O)NNC(=O)c1sc(N2CCOCC2)nc1C	782898009	VZLSXAYVNMMEHA-UHFFFAOYSA-N	447.517	1.395	50	20	IDGD	
COCC[S@@](=O)Cc1cccc(NC(=O)C(=O)NN=c2sc3ccccc3n2C)c1	783349252	GTXNSKXJCOKVSP-SSEXGKCCSA-N	446.554	1.706	50	20	IDGD	
COCC(=O)N1CCc2cc(NC(=O)C(=O)NNC(=O)Nc3ccccc3C)ccc21	783411772	ZAQCFIAOXHKAFZ-UHFFFAOYSA-N	425.445	1.322	50	20	IDGD	
COc1ccc(Cn2ncc(C)c2NC(=O)C(=O)NNc2cc(C)ncn2)cc1OC	783948328	MIFXNMUMBAJWPI-UHFFFAOYSA-N	425.449	1.437	50	20	IDGD	
CCn1nnnc1-c1cccc(NC(=O)C(=O)NNc2ccnc(Br)c2)c1	784828613	MGBSVBUKPXHWCS-UHFFFAOYSA-N	431.254	1.599	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)c1	784838994	CXZDIAVRFKHHBS-UHFFFAOYSA-N	444.372	1.682	50	20	IDGD	
COC(=O)c1cccc(C#Cc2cccc(NC(=O)C(=O)NNc3ncc(F)cn3)c2)c1	784950493	RAQVUHDDWPQNOX-UHFFFAOYSA-N	433.399	1.884	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)C(=O)Nc1ccnn1CCc1ccccc1	785067211	JAZLWHQYCXHBTK-UHFFFAOYSA-N	431.456	1.102	50	20	IDGD	
COc1cc(F)cc(NNC(=O)C(=O)Nc2ccc(F)c(S(=O)(=O)NC3CC3)c2)c1	785241351	GHTNRFHZSPJVHS-UHFFFAOYSA-N	440.428	1.496	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@H]2CC(c3c(F)cccc3F)=NO2)c2ccccc2c1=O	785688804	JCOSQVKCHJETFE-MRXNPFEDSA-N	441.394	1.649	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccc(N2CCNC2=O)c1C	787541065	KUDIMGCGSZSEAS-UHFFFAOYSA-N	439.472	1.252	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)[C@H]1CCN(c2cccc(Br)c2)C1=O	788178342	NIQYWYWAYNVSLD-CQSZACIVSA-N	442.277	1.921	50	20	IDGD	
C=CCC1(C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)CCC1	790139074	KUHPNUZVTADGKR-UHFFFAOYSA-N	435.546	1.534	50	20	IDGD	
Cc1nc2cc(C(=O)NNC(=O)c3cccc(S(=O)(=O)N4CCCC4)c3)ccc2o1	791444691	DSGZEAVJWVIFPG-UHFFFAOYSA-N	428.470	1.996	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)C1=C(C)N(C)c2ncnn2[C@@H]1C	791462089	FEGXLSUJSIKQLW-LLVKDONJSA-N	448.867	1.229	50	20	IDGD	
CC[C@@H](C)[C@H](OC)C(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	792789077	HUPHPOPHINZNHI-BEFAXECRSA-N	433.530	1.987	50	20	IDGD	
C[C@](O)(CN1C(=O)NC2(CCCC2)C1=O)C(=O)NNC(=O)c1ccc(Cl)cc1Cl	792829265	QEUKHAPDERNGRE-KRWDZBQOSA-N	443.287	1.370	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2cccs2)[nH]n1)C(=O)Nc1cccc(Br)n1	793024583	FSXUQDFVXBOLMZ-UHFFFAOYSA-N	435.263	1.695	50	20	IDGD	
COc1cc(OC)cc(C(=O)N2CCC(C(=O)NNC(=O)c3cccc(C)n3)CC2)c1	794090423	SLDHJLJUIZPWGK-UHFFFAOYSA-N	426.473	1.721	50	20	IDGD	
Cc1c(Cl)cc(S(=O)(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1C(=O)O	794867262	VLXKFKMOAJTVAM-OAHLLOKOSA-N	426.834	1.496	50	20	IDGD	
CNC(=O)c1cc(Cl)cc(S(=O)(=O)NNC(=O)c2ccc3c(c2)OCO3)c1OC	795280430	HFIQKMGQZIKSRG-UHFFFAOYSA-N	441.849	1.060	50	20	IDGD	
CCOc1cc(N2CCN(CC(=O)NNC(=O)c3ccc(F)cc3)CC2)ccc1[N+](=O)[O-]	796463225	CTGOUQSFERQVIH-UHFFFAOYSA-N	445.451	1.716	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(C)c(C(=O)NN=c2sc3ccccc3n2C)c1	798304221	YDDJXCPIYKIEFX-UHFFFAOYSA-N	434.543	1.719	50	20	IDGD	
CCOC(=O)COc1ccc(NC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc1	800562049	QEHJGEJZVATTTN-UHFFFAOYSA-N	439.428	1.986	50	20	IDGD	
Cn1cc(Oc2ccccc2C(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)cn1	801182033	FTXJWPWIQPZCQE-UHFFFAOYSA-N	427.848	1.943	50	20	IDGD	
CC(C)[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1ccc(Br)cc1Cl	802041459	WYSIPRGSHHAEJP-LLVKDONJSA-N	441.735	1.829	50	20	IDGD	
O=C(NC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1)NNC(=O)c1cc(Br)c[nH]1	802338662	YNTFUUUEBPEGEG-ZDUSSCGKSA-N	448.277	1.849	50	20	IDGD	
O=C([C@H](O)c1cccc(C(F)(F)F)c1)N1CCN(S(=O)(=O)CBr)CC1	803038152	NTUHLDJSKXXUFV-GFCCVEGCSA-N	445.257	1.565	50	20	IDGD	
C[C@](O)(CN1Cc2ccccc2C1=O)C(=O)OCC(=O)NNC(=O)c1cccc(Cl)c1	803468782	ZAMQANPAUJNZJP-NRFANRHFSA-N	445.859	1.051	50	20	IDGD	
CC(C)(C)OC(=O)N1CCOC[C@@H]1CC(=O)OCC(=O)NNC(=O)c1cccs1	803947968	LUKAKBYQGKUNJK-LBPRGKRZSA-N	427.479	1.078	50	20	IDGD	
COC(=O)N(C)NC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(Br)s1	804124951	PGPOAJWYMVKJGO-VIFPVBQESA-N	440.341	1.783	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)N2CCC(C(=O)NNc3cccc(F)n3)CC2)o1	804767149	BIYOPUHFWORXFF-UHFFFAOYSA-N	440.453	1.534	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNc3ccc([N+](=O)[O-])cc3C)CC2)cc1	805374531	NDXFPQNPSMWNEU-UHFFFAOYSA-N	447.517	1.661	50	20	IDGD	
Cc1c(NC(=O)NNc2ccc(-n3ccnc3)nn2)nnn1CCOc1ccc(F)cc1	806526611	SOVCJRBNRAGKRR-UHFFFAOYSA-N	438.427	1.929	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1csc(-c2ccccc2)n1	807004309	KVHOUPOFYFSYJK-UHFFFAOYSA-N	429.483	1.388	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)c1ccnc2ccncc12	807094030	STLKUGRJVGSLSS-UHFFFAOYSA-N	438.919	1.862	50	20	IDGD	
CCOc1cc2c(cc1CNC(=O)NNC(=O)c1ccc(-n3cnnn3)cc1)O[C@@H](C)C2	807137399	KVKCHGKSGRSTLK-ZDUSSCGKSA-N	437.460	1.529	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)C(=O)Nc1cc(F)c(Br)cc1F	807429352	QEMQMVWKFUUKRY-UHFFFAOYSA-N	438.192	1.785	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1cnn(-c2ccc(F)cc2)c1C(F)(F)F	810390752	YGSLKRWNZUPHBY-UHFFFAOYSA-N	439.329	1.911	50	20	IDGD	
C[C@H]1C[C@H](NC(=O)NNC(=O)COc2ccc(F)cc2)c2ccsc2S1(=O)=O	812650420	WLOUWMJFIVKCAR-HZMBPMFUSA-N	427.479	1.904	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)[C@H]2CCCN2C(=O)Cc2ccccc2)cc1	812730614	OTZMUQXZVFXOEY-LJQANCHMSA-N	430.530	1.614	50	20	IDGD	
CC(C)S(=O)(=O)c1cccc(C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)c1	812733398	QHYLKRWASLIEIN-UHFFFAOYSA-N	425.532	1.876	50	20	IDGD	
Cc1nn(C)c2cc(NC(=O)C(=O)NNc3ccc(S(=O)(=O)NC(C)C)cn3)ccc12	812982860	AKMISBCSDZIAFV-UHFFFAOYSA-N	445.505	1.045	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccccc2OCC(F)F)cc1	813033339	OJGDUOZBSZYPPH-UHFFFAOYSA-N	442.444	1.663	50	20	IDGD	
CO[C@](C)(CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)C1CC1	813203310	GSPBDTJVTUDRCZ-HXUWFJFHSA-N	438.550	1.620	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1cn(Cc2ccccc2)nn1	815566634	ZUZIBEYARAHPAD-CYBMUJFWSA-N	426.408	1.019	50	20	IDGD	
C[C@H](C#N)Oc1ccccc1NC(=O)C(=O)NNc1ccccc1S(=O)(=O)N(C)C	815751706	KWOIIPFPQJJNED-CYBMUJFWSA-N	431.474	1.310	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@H]2CS[C@@H](Cc3ccccc3F)C(=O)N2)cc1OC	886540036	VOBHWLFNRBKOOF-QAPCUYQASA-N	447.488	1.447	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)c1ccccc1S(=O)(=O)N1CCCCC1	910816112	RLXXRLUVAFXIGB-UHFFFAOYSA-N	435.477	1.840	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)C2CCN(C(=O)/C=C\c3ccccc3)CC2)C[C@@H](C)O1	912921732	UQXLQCOJCDDLCD-FAPWYTRCSA-N	442.560	1.585	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)c2ccccc2S(=O)(=O)N2CCOCC2)c1	914774754	IUWQTCOCBAXPED-UHFFFAOYSA-N	447.513	1.164	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)[C@@H]2CCCN2C(=O)C(C)(C)C)cc1OC	915014236	JSVXPCMTLNXMJP-AWEZNQCLSA-N	435.477	1.045	50	20	IDGD	
O=C(NC[C@@H](c1ccc(F)cc1)N1CCOCC1)NNC(=O)[C@H]1COc2ccccc2O1	915898071	QCRKEAKGDACDOF-FXAWDEMLSA-N	444.463	1.369	50	20	IDGD	
O=C(NC[C@@H]1CC1(Cl)Cl)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	915907641	AYGLKPLDSOELMQ-LBPRGKRZSA-N	435.333	1.609	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCc2ccccc2Cn2cccn2)c2ccccc2c1=O	916228239	ZSJPUQBJUVKAIK-UHFFFAOYSA-N	445.483	1.805	50	20	IDGD	
CN(CCO)c1ccc(C=NNC(=O)CN2c3cccc4cccc(c34)S2(=O)=O)cc1	916368748	ZDSFXJJMRQQGSN-UHFFFAOYSA-N	438.509	1.927	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)N[C@@H]1CCCN(Cc2ccccc2)C1	916607722	MXVYBBGBWBSUPR-QGZVFWFLSA-N	444.561	1.588	50	20	IDGD	
CCN(CCCNC(=O)NNC(=O)c1nnc(O)c2ccccc12)C(=O)OC(C)(C)C	916630306	JGZUJEWNNINKBL-UHFFFAOYSA-N	432.481	1.927	50	20	IDGD	
CCS(=O)(=O)N1CCC[C@@H](C(=O)NNC(=O)[C@H](C)Oc2ccc3ccccc3c2)C1	918549430	SDFNDORGUZLHGE-MAUKXSAKSA-N	433.530	1.816	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)[C@H]2CCCN(CC(F)(F)F)C2)cc1OC	920647542	AUMFOHBDFYMXQA-ZDUSSCGKSA-N	447.410	1.282	50	20	IDGD	
CSCC[C@@H](NC(=O)c1ccccc1Br)C(=O)NNC(=O)NC1CC1	920766439	PNWVMGBIADPWMM-CYBMUJFWSA-N	429.340	1.793	50	20	IDGD	
Cc1cc(N2CCN(C)CC2)ccc1NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	920928474	GFWKYRSZRDZHQU-UHFFFAOYSA-N	449.515	1.460	50	20	IDGD	
CN1CC(=O)N(CCCC(=O)NNC(=O)c2ccccc2OCc2ccc(F)cc2)C1=O	921233809	TYCCOSJIGSGKRE-UHFFFAOYSA-N	442.447	1.840	50	20	IDGD	
O=C(CSc1ccc(C(=O)N2CCCC2)cn1)NNC(=O)c1cccc([N+](=O)[O-])c1	1317778132	WTEWWJLYUPJEKM-UHFFFAOYSA-N	429.458	1.779	50	20	IDGD	
Cc1nc2ncccn2c1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](C)Br)CCO2	1777903159	HCNIUJWTOWXDNJ-SGTLLEGYSA-N	436.310	1.265	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2)c1ccc2ncccc2c1	1778455350	FSAFPBVUCJTOJM-NNMXDRDESA-N	431.920	1.962	50	20	IDGD	
O=C(C/N=C/c1ccco1)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCBr)C2	1779442504	QFHQWZBAIKTBEF-AGJWPYNWSA-N	440.338	1.997	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2)c1[nH]cnc1-c1cccnc1	1780033582	DQIYKZNWSDUYSW-WHSLLNHNSA-N	447.923	1.199	50	20	IDGD	
C[C@H](C(=O)N1CCO[C@]2(CCN(C(=O)[C@](C)(Cl)CCl)C2)C1)n1cccc1C=O	1781226834	AUOUNAMQYWYSGU-NIKGAXFTSA-N	430.332	1.928	50	20	IDGD	
CC(C)(C)OC(=O)N[C@]1(C(=O)N2CC[C@]3(CN(C(=O)[C@H](F)Cl)CCO3)C2)CCOC1	1781308794	IRANNCQFXDRBJX-FASAQXTFSA-N	449.907	1.035	50	20	IDGD	
O=C(c1cc[nH]c2nccc1-2)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781331761	VPCAITIQORQFCC-SUMWQHHRSA-N	425.258	1.649	50	20	IDGD	
C[C@H](Oc1ccccn1)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781335059	ROVHFLJFTKGFEL-RVSPLBMKSA-N	430.274	1.369	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CN1CCCCC1)C2	1781997654	BWHGDGAJRGCHED-GPMSIDNRSA-N	430.387	1.770	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(O)ccc3O)C2)C1	1782042573	LAQDFOJPOJWVAF-KPZWWZAWSA-N	427.295	1.572	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCc1cnn(C)c1)C2	1782170227	CLFVTZMEKKYLKI-MBOZVWFJSA-N	426.945	1.120	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1c(F)c(C)nn1C)C2	1782171026	NUYCRFLHVHHUBN-IQUTYRLHSA-N	430.908	1.249	50	20	IDGD	
O=C([C@@H](O)CCl)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C2(c3ccccc3F)CC2)C1	1783192982	CFRYJGDBOIJJGO-WAOWUJCRSA-N	438.927	1.971	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(OC)n(C)n3)CCO2)C1	1783351260	HFROLWZFHLHOKL-SJCJKPOMSA-N	429.315	1.046	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccc4nccnc4c3)CCO2)C1	1783534552	WEMZVBZZZVRUCG-BFUOFWGJSA-N	433.306	1.857	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@]1(F)CCCCC1(F)F)CCO2	1783875655	SADLCKUKTUCYJD-RRQGHBQHSA-N	426.863	1.988	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)C3(NC(=O)OC(C)(C)C)CC3)C2)C1	1785714808	FTVYWQHOQMRDFH-AUUYWEPGSA-N	445.944	1.127	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)COCc3ccccc3)[C@H]2C1	1786711866	LMESGDUEPWABKK-UBDQQSCGSA-N	439.350	1.966	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3=CCCC3)C[C@@H]21	1787508947	URIZFEPJBDWLRO-QECDCCOMSA-N	427.505	1.210	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cn(C)nc3C(F)F)[C@H]2C1	1787736152	QUFTUDIDOITCMP-IMIFBBOLSA-N	434.871	1.205	50	20	IDGD	
C[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)n1ccccc1=O	1788747078	GWFPVCAHCUYFQW-UGUYLWEFSA-N	440.338	1.174	50	20	IDGD	
Cc1noc(CC(=O)NC2(c3ccc(NC(=O)c4cnccc4C(=O)NN)cc3)CCC2)n1	1789522753	NZMACGIAJBWGEB-UHFFFAOYSA-N	449.471	1.367	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C[C@@H](N)c3cccnc3)C[C@@H]21	1789866271	MUXFANMXDMEWEV-SAGLZJIZSA-N	443.375	1.688	50	20	IDGD	
N[C@@H](CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]2C1)c1cccnc1	1789922737	PDFLZMIWZPPNJI-BWJWTDLKSA-N	443.317	1.142	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C#CC3(O)CCCCC3)C[C@@H]21)[C@@H](F)Br	1789926361	VAKQNRGXEWBWTC-QBYUYEEZSA-N	445.329	1.355	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc4[nH]ncc4c3)C[C@@H]21	1791056349	UZPKTPJKGHXMIG-PKIAMQTDSA-N	436.310	1.335	50	20	IDGD	
COc1ccc(OCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Br)C3)cc1	1792725533	YIZVYZLVTFMBIX-CZAMWMTLSA-N	445.285	1.354	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1CCC(C(F)(F)F)CC1)C2)[C@@H](O)CCl	1792975099	JAZMMYZOSULVRP-AUJGNRQJSA-N	426.863	1.544	50	20	IDGD	
COCCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](Br)Cc1ccccc1)C2	1795349547	NMOBFGUTJDWRGG-SFNKJDCFSA-N	439.350	1.619	50	20	IDGD	
CCc1[nH]nc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)CBr)C3)c1Cl	1795902991	GPVQSSHBFVXRPJ-DYNIEEOBSA-N	447.761	1.860	50	20	IDGD	
CC#CC[C@@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)c1ccccc1	1796188721	LSDSYUKVUCDRSB-UEQSERJNSA-N	444.340	1.815	50	20	IDGD	
Cn1nc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@](C)(Cl)CCl)C3)c2c1CCC2	1797048608	QMJOWNRJZFDQFL-RHQBZFHZSA-N	429.348	1.348	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cc(F)cc(F)c1)C2	1797954745	FUEKWMFSWMLAIW-YVWYUNDQSA-N	426.536	1.948	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccn2cncc12	1798186990	RBXOTIXOKAYCIC-CKFWPPNZSA-N	447.499	1.720	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)c1ccc(-c2ccccc2)nc1	1798363791	IPOAHCGJCWJQST-HNJRGHQBSA-N	429.904	1.552	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc([N+](=O)[O-])[nH]1	1798747483	AGAWQLSTSBSRLC-MIJXAVMKSA-N	429.271	1.300	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CC[C@H]2CCC(=O)N2C1	1799149879	QVLBJWOOZQPWGF-FDWMWLBGSA-N	446.375	1.213	50	20	IDGD	
Cc1cccc2c(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@@H](F)Br)C4)n[nH]c12	1800072005	IUNOUEYEMKYCKT-YHYOWMERSA-N	439.285	1.765	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cc(F)ccc1OC	1801101231	AZCNSKBTUDEORB-QHHYFVSCSA-N	428.888	1.220	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C=C/c1ccc([N+](=O)[O-])o1)C2	1802333655	AWVDIVXZBWYJHZ-YOFSRQDISA-N	433.465	1.212	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CS[C@@H]1CCCCO1)C2	1802337470	MCLPBWUAQPIWMR-UIVXKWKOSA-N	426.583	1.257	50	20	IDGD	
C=CCNC(=O)/C=C\C(=O)NC[C@H]1CCN(C(=O)C(Cl)Cl)[C@H]1c1cccnc1	1802497441	HNMTWEOMLIFMFN-SWFLQVRRSA-N	425.316	1.750	50	20	IDGD	
CC(C)(CCl)C(=O)NC[C@@H]1CCN(C(=O)CCc2nc(N)n[nH]2)[C@H]1c1cccnc1	1802901071	LZZLHQVDZPMFJV-YOEHRIQHSA-N	433.944	1.686	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CCc2ccc(F)nc2)[C@H]1c1cccnc1)[C@@H](O)CCl	1803135552	FBUNSMVCLXOGMP-ZWOKBUDYSA-N	434.899	1.854	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)c1cnc(OCF)cn1	1805024730	AYYKKGOXLAWGFG-QRTARXTBSA-N	437.859	1.097	50	20	IDGD	
COCCOCC(=O)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@@H]1c1cccnc1	1806760166	ZTHWBICUOAMQSE-IMJJTQAJSA-N	432.290	1.441	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)cc1	1807374951	LPLZKUMXMBPXNT-FYYLOGMGSA-N	443.312	1.703	50	20	IDGD	
O=C(Cn1cc(Cl)cn1)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1	1807404126	SBFOVUURIQKHKV-YSVLISHTSA-N	426.304	1.237	50	20	IDGD	
CC(=O)N1CC[C@@H](CNC(=O)CN(C)NC(=O)NCc2ccccc2)[C@H]1c1cccnc1	1807453109	NCQFBNFLVHKMIK-RBBKRZOGSA-N	438.532	1.454	50	20	IDGD	
Cc1cc(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)nn1C(F)F	1811510145	MWDHPFPLTAVGLW-BPUTZDHNSA-N	441.866	1.901	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc3cccnc3nc2O)[nH]n1)[C@H](O)CCl	1814875002	LKQUAEPZIGTDLK-LSDHHAIUSA-N	444.879	1.964	50	20	IDGD	
O=C(C[C@H]1CCCCO1)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1	1815350300	OXJXFQRQAIKPEP-JKSUJKDBSA-N	443.334	1.008	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1	1817476383	DHPPIZDOESUJNH-KRWDZBQOSA-N	444.373	1.247	50	20	IDGD	
O=C1CCc2ccc(C(=O)Nc3cc([C@H]4CCCCN4C(=O)[C@@H](O)CCl)[nH]n3)nc2N1	1817809128	KRPSRUXJHUDBOU-CABCVRRESA-N	446.895	1.595	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)C#CC2CC2)[nH]n1	1818110659	MWNCQFSLDPGCOL-MJDKSPQASA-N	435.488	1.949	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)C2CC(=O)C2)[nH]n1	1818113988	BPZMPXMOYCZSMB-FQIOEHTJSA-N	439.476	1.515	50	20	IDGD	
Cc1cc2nnc(C(=O)Nc3nc4c(s3)C[C@@H](NC(=O)[C@@H](F)Cl)CC4)c(C)n2n1	1818248995	YCUVRSYQRRITBN-LKFCYVNXSA-N	437.888	1.958	50	20	IDGD	
CC[C@@H](Br)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CS(C)(=O)=O)[nH]n1	1822087812	NXGBPLRURURMCZ-PWSUYJOCSA-N	435.344	1.620	50	20	IDGD	
COCCOCCOCCC(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1	1822253617	KBUWSFDLOWAHNW-HZPDHXFCSA-N	446.932	1.071	50	20	IDGD	
C[C@](O)(CC(=O)O)CC(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](F)Br)[nH]n1	1822411441	YZMAKEOVHDDDOV-FUEDEBDSSA-N	449.277	1.708	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)C(=O)c2ccccc2)[nH]n1	1822413573	ZSUSJYDBOHCRGA-KRWDZBQOSA-N	440.504	1.658	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CN(CCO)CCO)CC1	1824015009	JGZGTLDHUHTTDY-SFHVURJKSA-N	432.005	1.158	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CN(C)C(=O)C(=O)O)CC1	1824615305	NRJLZTHVNDDJCL-HZPDHXFCSA-N	429.945	1.557	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)c2ccnc(F)c2)CC1	1824720092	KVPVPOFDYQJDLJ-FQEVSTJZSA-N	439.296	1.448	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(O)n(C)n1)CC2	1825637415	ZNCXKWUMNYMBKB-YUMQZZPRSA-N	428.312	1.591	50	20	IDGD	
Cc1nc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)co1	1825954688	ZWQVIVFXJMSGFP-LJQANCHMSA-N	440.504	1.529	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H](C)CN)CC1	1827681213	PTVSNGWWTITMRH-ZBBDXVTFSA-N	430.553	1.335	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)CC2(O)CCC2)CC1	1828925527	JSRODYDDQOFQSC-IBGZPJMESA-N	443.548	1.224	50	20	IDGD	
Cc1nn(C)c(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)c1F	1830357755	GDMMGQLSZZJZEY-IBGZPJMESA-N	430.908	1.203	50	20	IDGD	
Cc1nc(N)sc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830358907	GSFYGZOJKRFSPD-SFHVURJKSA-N	430.958	1.369	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)CNC(C)=O)C2)C1	1831640569	NRKABEKCIVLTST-UZLBHIALSA-N	431.961	1.013	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccn(CCOC)n3)C2)C1	1831647879	ZTYFFZQZOVRQSW-UZLBHIALSA-N	442.944	1.007	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccn4ccnc34)C2)C1	1831651189	NTJMOVAEFLNJSF-LAUBAEHRSA-N	434.924	1.812	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3Cc4ccccc4N3)C2)C1	1831657920	RODZYNDLMINNAC-LZNRXBQRSA-N	435.952	1.887	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1	1831833221	MNOGWINXWNBTHC-HOTGVXAUSA-N	425.913	1.980	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCC(=O)N3CCCC3)CCO2)C1	1832419777	SCDLYTWNVQCZDO-OAQYLSRUSA-N	443.972	1.110	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)cnc1C	1833301390	DLEBVFBCXCGIPQ-IFXJQAMLSA-N	440.338	1.552	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ncc(Cl)cn1)CCO2	1833787767	ZONLPRNRHQEIKY-GOSISDBHSA-N	442.976	1.052	50	20	IDGD	
CC(=O)N(C)[C@@H](C)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)Br)CC2)CC1	1835125395	PSKWCJWOHRLNBM-KGLIPLIRSA-N	445.402	1.208	50	20	IDGD	
O=C(CCc1ccc2c(c1)OCO2)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1835180504	JDKFEXIRIYNQGB-UYAOXDASSA-N	442.871	1.339	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3cnc(O)[nH]3)CC2)CC1	1835966594	CGSLWXIFJCOIBS-CQSZACIVSA-N	442.358	1.474	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3cc(CO)on3)CC2)CC1	1836189431	ROGXUIMQXFXBHQ-LBPRGKRZSA-N	443.342	1.136	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC1CCN(C2CCN(C(=O)c3cnc(O)[nH]3)CC2)CC1	1836400210	ZKOJXBALTDPFBU-GOSISDBHSA-N	432.352	1.537	50	20	IDGD	
Cc1ncc(C(=O)N2CCC(N3CCC(NC(=O)[C@@H](F)Br)CC3)CC2)[nH]1	1836413575	JVNUPVAZXSIASA-OAHLLOKOSA-N	430.322	1.594	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC(OC2CCN(C(=O)c3cnnn3C)CC2)CC1	1836670213	LAOYINOBIRSRTF-ZDUSSCGKSA-N	442.358	1.458	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)c3ccc(O)nn3)CC2)CC1	1837368888	XPOZMSOCMOCUCO-GFCCVEGCSA-N	441.326	1.578	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4ncoc4c3)C2)C1	1837712993	CCUYEVQTIXVPSS-NRFANRHFSA-N	447.564	1.749	50	20	IDGD	
O=C(NCC(=O)N1CCC(OC2CCN(C(=O)C(Cl)Cl)CC2)CC1)c1ccco1	1837963820	LHPDXTZGVHEQNL-UHFFFAOYSA-N	446.331	1.812	50	20	IDGD	
Cc1cc(C(=O)NCC(=O)N2CCC(OC3CCN(C(=O)[C@H](F)Cl)CC3)CC2)no1	1838083149	ZZIPIRLLADMBJI-KRWDZBQOSA-N	444.891	1.246	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(Cl)c(O)cc3O)C2)C1	1839147275	LYKAHJYFIODARK-YJYMSZOUSA-N	447.315	1.839	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(C)n3)C2)C1	1839963571	OJVCHVBUIRMVPP-BEFAXECRSA-N	440.338	1.634	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(F)cn3)C2)C1	1840031514	SFZZJLRMXKTMNI-SJCJKPOMSA-N	430.274	1.074	50	20	IDGD	
CC(C)n1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)n1	1840034531	OJESPYLHQOLSPK-KBXCAEBGSA-N	443.342	1.317	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(C4CC4)cc3)C2)C1	1840155106	PXBVIWHHFMGSDO-UGKGYDQZSA-N	436.936	1.888	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(F)cc3OC)C2)C1	1840155632	BUIBTIFACXLYSA-OXQOHEQNSA-N	444.887	1.158	50	20	IDGD	
O=C(c1n[nH]c2c(F)cccc12)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840188590	RUONEJMDRBPRCG-SFHVURJKSA-N	445.278	1.576	50	20	IDGD	
C/C(=C\c1cccnc1)C(=O)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1840414418	LVNZTWXSXMMAEV-CECLQJIQSA-N	428.316	1.745	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)CSc2ccc(F)cc2F)C1	1841565040	ODCSGKYWJHWYPI-UHFFFAOYSA-N	440.516	1.633	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)Cc2ccc(F)cc2Cl)C1	1841833880	XIIJFTSAPCBRLA-UHFFFAOYSA-N	430.672	1.219	50	20	IDGD	
Cc1nn(C)cc1C(=O)N1CC2(CCCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C1	1841923983	KTXSINLJPVOREP-HNNXBMFYSA-N	439.944	1.678	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)CCCc2ccncc2)C1	1842072631	RQJDZMVDDQUSSO-YZSQISJMSA-N	436.516	1.742	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)c2cc(C)nn2-c2cccc(=O)n2C)C1	1843132382	MMYHECZFYDLNCB-HNNXBMFYSA-N	431.924	1.714	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1ccc(F)nc1C)C2	1843416402	FIDCDHZLMMWQFH-AFUMVMLFSA-N	426.452	1.480	50	20	IDGD	
CN(CC(=O)N1CCCC12CN(C(=O)C1CCCC1)C2)NC(=O)NCc1ccccc1	1845038575	UTUASXNHUITZDV-UHFFFAOYSA-N	427.549	1.726	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)[C@H]2CCCN(C)C2)C1	1845055274	WLGQYXZFQUCOLM-INIZCTEOSA-N	444.488	1.679	50	20	IDGD	
C[C@H]1[C@@H](C(=O)N2CCCC23CN(C(=O)[C@@H](O)CCl)C3)CCCN1C(=O)OC(C)(C)C	1845144046	OGAGSQCHWOGXSG-JYJNAYRXSA-N	443.972	1.825	50	20	IDGD	
C[C@H](Br)C(=O)N1CC2(CCCN2C(=O)[C@H](O)CCNC(=O)OC(C)(C)C)C1	1845224069	WQKGQAKPEPEORC-QWHCGFSZSA-N	448.358	1.249	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)c2ccc(-c3ccc(O)nn3)cc2)C1	1845550507	FFMAKXGATMOFNK-MRXNPFEDSA-N	430.892	1.920	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC12CN(C(=O)c1nc(OC)ccc1[N+](=O)[O-])C2	1846070431	JNGAVXUFCLKFCJ-NSHDSACASA-N	441.282	1.989	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@H]1C[C@@H]3C[C@@H]3N1C(=O)OC(C)(C)C)C2	1846365695	PGULBBMVQVAKKQ-XUWVNRHRSA-N	441.956	1.842	50	20	IDGD	
Cc1cc(CC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)no1	1848098768	WTKLLUGRYSGBCJ-JYJNAYRXSA-N	440.928	1.859	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)C2CCN(S(C)(=O)=O)CC2)cc1OC	22137315	NDJSDGANUDUWIQ-UHFFFAOYSA-N	427.523	1.307	50	20	IDGD	
Cc1nc2c(C(N)=O)cnn2c(C)c1CCC(=O)NNC(=O)c1ccc2ccccc2n1	107687341	OTNLSFYBUSUZKU-UHFFFAOYSA-N	431.456	1.387	50	20	IDGD	
O=C(CCN1CCCC1=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	110697457	RUCBEYWKEKASHQ-UHFFFAOYSA-N	433.472	1.162	50	20	IDGD	
O=C(NCC1(c2ccc(Br)cc2)CCOCC1)NNC(=O)C(=O)NC1CC1	726275953	AISIIXOXJGITED-UHFFFAOYSA-N	439.310	1.106	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCCCc2nnc3n2CCCCC3)cc(OC)c1OC	727606984	KROKOAUTRXLWRZ-UHFFFAOYSA-N	446.508	1.607	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CCCc2ccccc2)cc1S(=O)(=O)NC1CC1	727741532	WNRRGWVVFYDZDH-UHFFFAOYSA-N	431.514	1.920	50	20	IDGD	
CS(=O)(=O)c1cc(Br)cc(C(=O)NNC(=O)c2cccc(C#N)c2)c1F	728826363	CTJANSYFMKCCRF-UHFFFAOYSA-N	440.250	1.938	50	20	IDGD	
C[C@@H](CC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)S(=O)(=O)c1ccc(F)cc1	729182029	CGOBPDWLJPKMQA-AWEZNQCLSA-N	449.508	1.232	50	20	IDGD	
NC(=O)c1ccc(C(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)nc1	729298620	OIDSXNAFBWLSQU-UHFFFAOYSA-N	442.435	1.014	50	20	IDGD	
CS(=O)(=O)c1ccc(OCCNC(=O)NNC(=O)COc2ccccc2F)cc1	730066394	JMJGYGLCRBDOIM-UHFFFAOYSA-N	425.438	1.017	50	20	IDGD	
C[C@@H]1CCCN(S(=O)(=O)c2cc(C(=O)NNC(=O)Cc3ccc(F)cc3)n(C)c2)C1	730205695	VORQERKEYIDAJJ-CQSZACIVSA-N	436.509	1.589	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)COc1ccccc1O)c1cc(F)ccc1N1CCC(O)CC1	730909316	ADBGYFMZCOAHFE-CQSZACIVSA-N	446.479	1.963	50	20	IDGD	
COc1ccccc1C(=O)NNS(=O)(=O)c1cc(Br)ccc1[N+](=O)[O-]	731493797	MKPNCNQKRWXOSS-UHFFFAOYSA-N	430.236	1.989	50	20	IDGD	
N#Cc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)NC3CCCCC3)CC2)cc1	731580601	NHIQBSYDYVCXHA-UHFFFAOYSA-N	433.534	1.622	50	20	IDGD	
CCOc1ccc(OCc2ccc(C(=O)NNC(=O)CN3CCN(C)CC3)cc2)cc1	732258420	NZHLXYOJHGHZSS-UHFFFAOYSA-N	426.517	1.673	50	20	IDGD	
C[C@H]1CN(CC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)C[C@@H](C)N1C(=O)OC(C)(C)C	733199588	HZEAINLYJYYYMD-OKILXGFUSA-N	435.481	1.686	50	20	IDGD	
CC(C)OCCCn1c(NNC(=O)[C@H]2CC(=O)N(C3CC3)C2)nc2ccccc2c1=O	733265578	GUWFNMPLBIRSQY-HNNXBMFYSA-N	427.505	1.666	50	20	IDGD	
N#Cc1nc(C2CC2)oc1N1CCN(C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)CC1	733348283	MDRHJWJCQGWUDZ-UHFFFAOYSA-N	446.471	1.786	50	20	IDGD	
CC(=O)N1CCN(c2ccc(C(=O)NNc3cnnc4ccccc34)cc2[N+](=O)[O-])CC1	733810654	SZWFJXHPLSHAJJ-UHFFFAOYSA-N	435.444	1.963	50	20	IDGD	
C[C@@H](SCc1ccccc1)C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	735117324	QXPJJJISCLBLRQ-MRXNPFEDSA-N	449.602	1.783	50	20	IDGD	
COc1ccc(N2C(=O)/C(=C\NNC(=O)c3cnn(C)c3)c3ccccc3C2=O)cc1OC	735462844	XPXLZNQMBLMGJS-PDGQHHTCSA-N	447.451	1.900	50	20	IDGD	
C[C@H](CN1CCN(c2ccccn2)CC1)NC(=O)NNC(=O)c1cccc(OC(F)F)c1	735518832	MOIJMJJENVQYRB-OAHLLOKOSA-N	448.474	1.838	50	20	IDGD	
CC[C@@H]1CCCCN1CCNC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1	737066261	ILXAWAVUTQAQSQ-QGZVFWFLSA-N	439.582	1.210	50	20	IDGD	
C[C@H]1CCC[C@H](NC(=O)CN2CCN(C(=O)NNC(=O)COCc3ccccc3)CC2)C1	738497449	VUXMJQBRPYORBN-ICSRJNTNSA-N	445.564	1.257	50	20	IDGD	
O=C(CC[S@](=O)c1ccc2c(c1)OCCO2)NNC(=O)c1ccc2c(c1)OCCO2	740740513	SUHHGECLDQVPRK-PMERELPUSA-N	432.454	1.188	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)CN2CCN(c3ccccn3)CC2)cc1OC	740749254	SJDWKHVBDQPOQF-UHFFFAOYSA-N	427.505	1.462	50	20	IDGD	
C[C@H](C(=O)NNC(=O)c1cc(Br)ccc1O)N1C(=O)NC2(CCCC2)C1=O	743731274	NTEBTAKZSWWMDV-SECBINFHSA-N	439.266	1.169	50	20	IDGD	
O=C1C[C@H](Cc2ccc(C(=O)NNC(=O)c3cccc(Br)c3)cc2)C(=O)N1	743731598	VSZHHCGRJUZPCO-AWEZNQCLSA-N	430.258	1.729	50	20	IDGD	
Cc1cc(Br)cc(C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)c1N	745014493	VNFHSYKAVZSFHW-UHFFFAOYSA-N	431.246	1.829	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1)c1cccc(CO)c1	745491380	MJJAAIVDBQMOGH-UHFFFAOYSA-N	439.493	1.732	50	20	IDGD	
O=C(NNC(=O)C(=O)N1CCCC1)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1	745903411	FSRSTLOXJAPOQB-ZDUSSCGKSA-N	425.436	1.210	50	20	IDGD	
Cc1ccc(N(C)S(=O)(=O)c2cccc(C(=O)NNC(=O)N3CCOCC3)c2)cc1	745995828	DTHVZWGXWWSGAE-UHFFFAOYSA-N	432.502	1.507	50	20	IDGD	
C#CCNS(=O)(=O)c1ccc(C(=O)NNc2nc(-c3ccccn3)nc3c2CCC3)cc1	747986815	BNELXSSNDVGDPW-UHFFFAOYSA-N	448.508	1.696	50	20	IDGD	
Cn1nc(SCC(=O)NN=C2CCCSc3ccc(Cl)cc32)c(=O)n(C)c1=O	748249703	DQWGTZFMFXGFTA-UHFFFAOYSA-N	439.950	1.631	50	20	IDGD	
Cc1oc(C)c(S(N)(=O)=O)c1C(=O)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1	748517987	CSFYPPOMDALKDI-UHFFFAOYSA-N	441.409	1.594	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCn2ccnc2C1)c1cccc(S(=O)(=O)N2CCCCC2)c1	749176773	UMLFUUMTWOQWOM-MRXNPFEDSA-N	431.518	1.081	50	20	IDGD	
O=C(NNC(=O)[C@H]1CN(Cc2nc(O)c3ccccc3n2)CCO1)c1cc2ccccc2o1	749475079	XCTQPFHWVRBKJP-LJQANCHMSA-N	447.451	1.744	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)[C@H]2CCCN2C(=O)c2ccc3c(c2)OCO3)nc2ccccc21	749559677	CNZBPKGKLKYSFZ-QGZVFWFLSA-N	449.467	1.297	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2ccc(Br)cc2[N+](=O)[O-])C[C@@H](C)O1	751059038	RWDCRQJQYSSGJX-PHIMTYICSA-N	429.271	1.618	50	20	IDGD	
Cc1nc(-c2ccccn2)nc(NNC(=O)c2ccc([C@]3(C)NC(=O)NC3=O)cc2)c1C	751066925	OJXGLWHGQJHJLH-QFIPXVFZSA-N	431.456	1.967	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N[C@@H](C)c2nc(C)no2)cc1	751395811	FPHNZZUWFUFVIZ-ATTDUZETSA-N	449.471	1.910	50	20	IDGD	
COc1ccc2c(c1)CC[C@H](NC(=O)NNC(=O)c1csc(N3CCOCC3)n1)C2	753288025	SHGUTBNHXNKTPK-HNNXBMFYSA-N	431.518	1.490	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)c2ccnc(O[C@H]3CCOC3)c2)c2ccccc2c1=O	754844766	XHHKKRIKPVBQQN-HNNXBMFYSA-N	437.456	1.615	50	20	IDGD	
O=C(COC(=O)c1scnc1Br)NNC(=O)[C@H]1COc2ccccc2O1	754967705	GYVNIVKKJXWUQE-SNVBAGLBSA-N	442.247	1.050	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)Nc1ccc(CN2C(=O)CCC2=O)cc1	755663947	QUHHOYWKZPKWNX-UHFFFAOYSA-N	440.456	1.966	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccc(CN3C(=O)CCC3=O)cc2)c1	755664008	SMXBYZUBQYKMNO-UHFFFAOYSA-N	444.469	1.206	50	20	IDGD	
C[C@H](Oc1ccc(Cl)cc1)C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	757979897	MYSIEVHMJDXSST-INIZCTEOSA-N	444.919	1.713	50	20	IDGD	
CCCc1noc2nc(-c3ccco3)cc(C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)c12	758036533	SBMSYXJHWFEWPE-JTQLQIEISA-N	435.462	1.134	50	20	IDGD	
O=C(NNC(=O)c1nc(Cl)ccc1F)c1ccc(S(=O)(=O)N2CCCC2)cc1	758077268	UXYDFQAQMQJMDK-UHFFFAOYSA-N	426.857	1.733	50	20	IDGD	
Cc1cc(S(=O)(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc(C(=O)O)c1Cl	759089417	AVTUSMXYPMIPBZ-CQSZACIVSA-N	426.834	1.496	50	20	IDGD	
COc1ccc(C(=O)N2CCN(CCI)CC2)c(OC)c1OC	759379855	NHXNPZYBQXOOCW-UHFFFAOYSA-N	434.274	1.905	50	20	IDGD	
NC(=O)CC[C@@H](NC(=O)OCc1ccccc1)C(=O)NNC(=O)c1ccc(Cl)cc1O	760139433	WPGYQNCIUQNVBQ-OAHLLOKOSA-N	448.863	1.367	50	20	IDGD	
O=C(NNc1nccc(N2CCOCC2)n1)c1ccc(Br)cc1-n1cncn1	760172698	IZAZPYMQUWPCOM-UHFFFAOYSA-N	445.281	1.413	50	20	IDGD	
O=C(NN=C1CCOc2c1cc(Br)cc2[N+](=O)[O-])[C@@H]1CCS(=O)(=O)C1	761805400	ZZPYEBFYVQQIHU-MRVPVSSYSA-N	432.252	1.395	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1)c1cccc([N+](=O)[O-])c1	762087396	OVQZGFSHUOMNOI-MRXNPFEDSA-N	439.472	1.304	50	20	IDGD	
C[C@H](O)c1cn(CC(=O)NNC(=O)c2nc(-c3ccccc3)n(-c3ccccc3)n2)nn1	762964845	RZWPQQXUGVPJFS-AWEZNQCLSA-N	432.444	1.040	50	20	IDGD	
Cn1cc(NC(=O)C(=O)NNC(=O)CCCOc2ccc(Cl)cc2Cl)ccc1=O	763499089	CSBCSWWPCCNVNF-UHFFFAOYSA-N	441.271	1.637	50	20	IDGD	
NC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cc3ccccc3cc2O)ccc1Cl	763526431	GFTBEPLPDUKFFR-UHFFFAOYSA-N	426.816	1.697	50	20	IDGD	
Cn1nc2c(c1NC(=O)C(=O)NNC(=O)COc1cccc(C(F)(F)F)c1)CCC2	763640254	URPOZVLKSCXILJ-UHFFFAOYSA-N	425.367	1.093	50	20	IDGD	
CCNS(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2cccc(OC(F)F)c2)cc1	763659436	NQMIRFFCJPDVFO-UHFFFAOYSA-N	442.444	1.730	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(N2CCCC2=O)ccc1F	763711360	ILUUZAGXQLYXCV-UHFFFAOYSA-N	442.447	1.680	50	20	IDGD	
CCOc1cc(C(=O)N(C)C)ccc1NC(=O)C(=O)NNC(=O)c1cccc(Cl)c1	763747866	PLVGPKOVUYSSCB-UHFFFAOYSA-N	432.864	1.840	50	20	IDGD	
COC(=O)C(C)(C)c1ccc(NC(=O)C(=O)NNC(=O)c2cccc(N(C)C)c2)cc1	763757148	DYHBSMLYWGQGCJ-UHFFFAOYSA-N	426.473	1.603	50	20	IDGD	
CNC(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(OCCC(C)C)cc2)cc1	763767435	IYEJJBNANJBFCC-UHFFFAOYSA-N	440.500	1.800	50	20	IDGD	
CC(C)Cn1ncc(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)c1C(C)C	763807906	IHUFVLRSQWLBTN-UHFFFAOYSA-N	426.477	1.699	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cccc(N3CCNC3=O)c2)c1C	763841757	SSVLBWYLYYYYBW-HNNXBMFYSA-N	439.472	1.386	50	20	IDGD	
COc1ccc(OC(F)F)c(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)c1	763849564	KFKUNRHGQKNVFJ-SNVBAGLBSA-N	441.362	1.989	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)C(=O)Nc2cc(C(F)(F)F)cnc2O)cc1	763898242	OLTOMZRWAOWMBZ-UHFFFAOYSA-N	428.392	1.993	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)C(=O)Nc2ncn(Cc3ccc(C#N)cc3)n2)cc1	763898325	PVOZMVQBAFYZCQ-UHFFFAOYSA-N	449.496	1.385	50	20	IDGD	
CN(C)CCn1ncc(C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1-c1ccccc1	763919832	ODEGHXHMFQFOQT-FQEVSTJZSA-N	435.484	1.713	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3ccc4c(c3)OCC(=O)N4)cc2C1	763944260	YDLFNOCWVYJBSL-SNVBAGLBSA-N	428.470	1.604	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)C(=O)Nc1cccc(C(=O)NC2CC2)c1	763996070	BKDSIMLHBHRCEB-UHFFFAOYSA-N	434.250	1.069	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)C(=O)Nc1ccc(NC(=O)CN2CCCCCC2)cc1	763997229	ZCVRVQVUPVJUDR-UHFFFAOYSA-N	440.504	1.239	50	20	IDGD	
Cc1nc(C)n(-c2ccccc2NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)n1	764004755	TWRHKCYDKHDMJR-UHFFFAOYSA-N	436.428	1.055	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1ccccc1O[C@@H]1CCOC1	764013154	VKGONJQNCSOBJB-CYBMUJFWSA-N	433.848	1.916	50	20	IDGD	
Cc1cc(S(C)(=O)=O)ccc1NC(=O)C(=O)NNC(=O)c1ccc(Cl)cc1O	764117790	SBTYETVNULKSRM-UHFFFAOYSA-N	425.850	1.157	50	20	IDGD	
CN(C)CCOc1ccc(NC(=O)C(=O)NNC(=O)CCc2ccccc2O)cc1Cl	764289645	XALQTMASTJBDJL-UHFFFAOYSA-N	448.907	1.705	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2c[nH]nc2C)n(-c2cccc(C(F)(F)F)c2)n1	764297470	SJGKVUIYIJVGDX-UHFFFAOYSA-N	435.366	1.631	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)C(=O)Nc1cccc(CCN2CCCC2)c1	764346360	XUCWOTIUKOSHHR-UHFFFAOYSA-N	446.511	1.910	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)ccc1Cl	764378054	IFTPAEPHCYDTQS-UHFFFAOYSA-N	441.774	1.884	50	20	IDGD	
CCn1c(=O)n(CC)c2nc(NC(=O)CCC(=O)NN=c3cc[nH]cc3Cl)ccc21	764566107	OHHSOOPRNPNVPE-UHFFFAOYSA-N	431.884	1.570	50	20	IDGD	
O=C(NNC(=O)[C@H](O)CCc1ccccc1)c1cccc(S(=O)(=O)N2CCCCC2)c1	764586725	ZWYRGGFSEGDDBV-HXUWFJFHSA-N	445.541	1.616	50	20	IDGD	
Cc1nn(C)c(=O)c(C(=O)NNC(=O)[C@H]2Cc3ccccc3CN2Cc2ccccc2)c1C	764938134	YHMGEPYJAXGEEK-OAQYLSRUSA-N	445.523	1.785	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)c1ccc(OCC(F)(F)F)cn1	765186696	UUADUMLBFRDLDV-UHFFFAOYSA-N	431.396	1.391	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)cc1	765313431	MMFDJHGNXFAVRI-UHFFFAOYSA-N	428.511	1.003	50	20	IDGD	
Cc1ccc2c(CC(=O)NNC(=O)CN3CCN(C(=O)c4ccccc4)CC3)c[nH]c2c1	765735035	GVDFRCDYRVAZCX-UHFFFAOYSA-N	433.512	1.624	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cc(C)nc4c3c(C)nn4C)CC2)cc1	765753064	AKIAUSWZQKCLRZ-UHFFFAOYSA-N	449.559	1.472	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)Cc3cc(F)c(F)cc3F)cc2)CC1	767962817	SDCSPUZRKAIRTF-UHFFFAOYSA-N	442.463	1.726	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)Cc2ccc3ccccc3c2)n(-c2ncccn2)n1	768239284	IXXHHLZIMFHKCQ-UHFFFAOYSA-N	429.440	1.453	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)c1ccccc1O)N1C(=O)c2ccc(Br)cc2C1=O	769647650	KIXUHZAXVHYBPS-VIFPVBQESA-N	432.230	1.600	50	20	IDGD	
CSCCNC(=S)NNC(=O)c1cc(S(=O)(=O)NC(C)(C)C)ccc1Cl	769767531	OWKDPEFRYIEDFY-UHFFFAOYSA-N	439.028	1.889	50	20	IDGD	
C[C@@H](NC(=O)c1n[nH]c2ccccc12)C(=O)NNc1nc(O)c2cnn(C(C)(C)C)c2n1	770966396	SVBUZEWAMAEVBT-SNVBAGLBSA-N	437.464	1.425	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)[C@@H]1CC(=O)N(c2cccc(Br)c2)C1	771984172	FKCIXUUJAWUSOV-GHMZBOCLSA-N	426.267	1.291	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)ccc1N1CCNC1=O	772194741	CZDFWHKLEBMOLU-UHFFFAOYSA-N	429.864	1.255	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H]2CCO[C@H](C(C)C)C2)c1	772607654	OTZOPIQFDHBINI-WMZOPIPTSA-N	440.566	1.865	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3ccc(OC(F)F)cn3)CC2)cc1	773393022	MAUVLPJXAYRNFG-UHFFFAOYSA-N	433.459	1.570	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)[C@@H]2CC(=O)N(Cc3ccco3)C2)C1	773411786	RIJVSWLTGVEIKM-LSDHHAIUSA-N	434.493	1.423	50	20	IDGD	
CCN1CCN(c2ccc(Cl)cc2NC(=O)C(=O)NNc2nc(C)cc(C)n2)CC1	773479396	GPYUJKPKGSHDQH-UHFFFAOYSA-N	431.928	1.971	50	20	IDGD	
O=C(NNc1cnc2ccccc2n1)[C@@H]1CCCN1S(=O)(=O)c1cccc([N+](=O)[O-])c1	774769225	JLYIWUALQAMQOQ-KRWDZBQOSA-N	442.457	1.834	50	20	IDGD	
COCCCOCC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	775646856	PEUIUXISGFGCLV-UHFFFAOYSA-N	427.504	1.363	50	20	IDGD	
O=C(CN1CCN(c2nnc(C(F)(F)F)s2)CC1)NNC(=O)c1ccc(F)cc1	776859474	DASZMACUKVDSRI-UHFFFAOYSA-N	432.403	1.279	50	20	IDGD	
CCCCSc1ccc([N+](=O)[O-])cc1C(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1	777367288	FZGXZXXPQXOYNR-NSHDSACASA-N	430.508	1.618	50	20	IDGD	
C[C@H](C(=O)NNC(=O)COc1ccc(Br)cc1)n1nnnc1C(C)(C)C	777786598	HAWMITSTFBTGBH-SNVBAGLBSA-N	425.287	1.521	50	20	IDGD	
COc1ccc(NNC(=O)[C@H](NS(=O)(=O)c2ccc(C)cc2)[C@@H](C)O)c([N+](=O)[O-])c1	779535623	KAKRWUGQMPNILG-SJKOYZFVSA-N	438.462	1.083	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)[C@H](O)[C@@H](O)c1nc2ccccc2[nH]1	779581989	JPGQOYDRJQIXKR-HZPDHXFCSA-N	437.481	1.850	50	20	IDGD	
CC(C)[C@H]1CN(C(=O)NNC(=O)CNC(=O)c2ccco2)CCN1C(=O)OC(C)(C)C	780977069	FAGBSQKBXZNZFP-CQSZACIVSA-N	437.497	1.328	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1cc(N(C)C)nc2ccccc12	780979132	NOVMLXSBYYVYOL-UHFFFAOYSA-N	440.529	1.977	50	20	IDGD	
CCS(=O)(=O)c1ccc(Br)c(C(=O)NNC(=O)Cc2cccnc2)c1	781647421	ZYRGKEOCDAHTCA-UHFFFAOYSA-N	426.292	1.641	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C(=O)Nc2ccc(NC(=O)C3CC3)cc2)nc2ccccc21	782892591	DUXWJNPGMADYGT-UHFFFAOYSA-N	434.456	1.250	50	20	IDGD	
CC(C)N(C)c1cccc(NC(=O)C(=O)NNC(=O)c2csc(N3CCOCC3)n2)c1	782897374	OAJREJTYTXCPPH-UHFFFAOYSA-N	446.533	1.224	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccc3ncccc3c2)nc1	783263086	HEYTWLWILTUOBU-UHFFFAOYSA-N	428.474	1.398	50	20	IDGD	
C#CCOc1cc(F)ccc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)NC(C)C)cn1	783263748	KVZARNZVRZELNT-UHFFFAOYSA-N	449.464	1.001	50	20	IDGD	
Cc1cc(F)ccc1-n1ccc(C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)n1	783280932	AYQIGIHGDGIYKC-UHFFFAOYSA-N	441.375	1.846	50	20	IDGD	
CN(c1ccc(NC(=O)C(=O)NNC(=O)C(=O)N2CCCC2)cc1F)C1CCCCC1	783996138	DPHGCEBGLHXLCX-UHFFFAOYSA-N	433.484	1.303	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2Cl)cc1-n1nnnc1C	784384620	PRZMGSQZXDUQEB-UHFFFAOYSA-N	446.811	1.623	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(OC)c(NC(=O)C(=O)NNc2ccnc(F)c2)c1	784846876	IDFQVEPVRYAZIA-UHFFFAOYSA-N	439.469	1.342	50	20	IDGD	
O=C(Cc1ccc(Cl)cn1)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	786391108	KICRKXYVLUODEW-UHFFFAOYSA-N	436.343	1.896	50	20	IDGD	
CC(=NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1cnn(C(C)C)c1C	787143722	AHMJRXNOOCOUPO-UHFFFAOYSA-N	433.534	1.947	50	20	IDGD	
N#C/C(=C\c1ccc(O)cc1)C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	787404614	UNIGXXPFXBTXMK-DTQAZKPQSA-N	428.470	1.463	50	20	IDGD	
CCC[C@H]1CCc2nc(NC(=O)C(=O)NNC(=O)COc3ccccc3O)sc2C1	789734581	KJRSCIBZAVUASF-LBPRGKRZSA-N	432.502	1.919	50	20	IDGD	
Cc1nc(Cl)ccc1NC(=O)C(=O)NNC(=O)c1cc(Br)ccc1O	789734657	MYVDBPBMHVSRNI-UHFFFAOYSA-N	427.642	1.911	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)[C@H](CCS(C)(=O)=O)c1ccccc1	789868938	MLSQWWVDSSJSGD-QGZVFWFLSA-N	442.541	1.965	50	20	IDGD	
CO[C@H]1CCOc2c(NC(=O)C(=O)NNC(=O)COc3cc(C)cc(C)c3)cccc21	790951525	HVTKLKUFEVRAHZ-SFHVURJKSA-N	427.457	1.938	50	20	IDGD	
Cn1nc([C@@H]2CCCOC2)cc1NC(=O)C(=O)NNC(=O)Cc1ccc2ccccc2c1	790952873	WYBOJKFRHQKVPA-GOSISDBHSA-N	435.484	1.796	50	20	IDGD	
CS(=O)(=O)CCOc1cccc(NC(=O)C(=O)NNc2cccc(F)c2[N+](=O)[O-])c1	790998252	DZIFJVNAXTVPJC-UHFFFAOYSA-N	440.409	1.239	50	20	IDGD	
O=C(NNc1cccc(F)c1[N+](=O)[O-])C(=O)Nc1ccc(F)c(-n2nnnc2C2CC2)c1	791000773	PDRQPAYRSMTYJQ-UHFFFAOYSA-N	444.358	1.808	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)NCc2ccc(S(=O)(=O)CCO)cc2)c1C	791969913	XHIDUQXWNYXTHV-MOSHPQCFSA-N	445.541	1.741	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@@H](C(=O)NNC(=O)c2ccc3ccccc3n2)[C@H](C)O)cc1	792544171	YEZNNEFPRZCKCY-IFXJQAMLSA-N	442.497	1.032	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)[C@H]2Cc3cc(Br)ccc3O2)C[C@@H](C)O1	792629485	POSSMLFIULHAQF-XHBSWPGZSA-N	426.311	1.399	50	20	IDGD	
COc1c(NC(=O)C(=O)NNc2ccc(Br)nc2)cc(Cl)cc1C(N)=O	793050740	MEWHQSGPBNTMNZ-UHFFFAOYSA-N	442.657	1.687	50	20	IDGD	
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)NNC(=O)CNC(=O)OCc2ccccc2)c1C	794598603	ITYBTZHUJCICJP-UHFFFAOYSA-N	436.446	1.448	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)c1cn2ccc(Br)cc2n1	796481384	FPTZERYXPGIMKR-UHFFFAOYSA-N	441.286	1.566	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2ccc(CC)cc2)cc1OCC	798149180	SHJPGSFOCINBSJ-UHFFFAOYSA-N	449.529	1.786	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C2CCN(c3ccc4nncn4n3)CC2)c2ccccc2n1	799007786	HMRTVTPJLAONHU-UHFFFAOYSA-N	430.472	1.659	50	20	IDGD	
COc1nccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)n1	801726341	DDAZTAJEEMTBFK-UHFFFAOYSA-N	434.478	1.126	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NCC(=O)NNC(=O)Nc1ccc(Br)cc1	801997880	QINCIVYQAUXNMF-UHFFFAOYSA-N	444.286	1.243	50	20	IDGD	
O=C(CCn1c(=O)oc2cc(S(=O)(=O)N3CCCC3)ccc21)NNc1cccc(F)n1	804767871	WUTMDPCDCFBSII-UHFFFAOYSA-N	449.464	1.447	50	20	IDGD	
N#Cc1ccc(NC(=O)C(=O)NNC(=O)CCc2ccccc2O)cc1Br	806978449	BXAMZIUMVVEQRD-UHFFFAOYSA-N	431.246	1.745	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)C(=O)Nc2nc(-c3ccc(C)s3)cs2)c1	806980412	PGUBHVNSJXOLSU-UHFFFAOYSA-N	444.498	1.933	50	20	IDGD	
COCC1(CNC(=O)NNC(=O)Cc2ccncc2)CCN(C(=O)OC(C)(C)C)CC1	807268745	SUNPPCKZPPVNFX-UHFFFAOYSA-N	435.525	1.618	50	20	IDGD	
CCn1cc(CNC(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)cn1	807516765	VDVVXUCTPHZHQJ-UHFFFAOYSA-N	445.483	1.805	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](C(=O)NNC(=O)c1nnc(O)c2ccccc12)C(F)(F)F	809933227	WLOJXQDGYAPSDV-NSHDSACASA-N	429.355	1.552	50	20	IDGD	
COC[C@@]1(C(=O)NNC(=O)COc2ccccc2F)CCN(C(=O)OC(C)(C)C)C1	809934275	OLQDCVJYOQIPPI-HXUWFJFHSA-N	425.457	1.626	50	20	IDGD	
COC[C@]1(C(=O)NNC(=O)c2cc(Br)c[nH]2)CCN(C(=O)OC(C)(C)C)C1	809973290	XCZDQRDSWUSPPM-KRWDZBQOSA-N	445.314	1.812	50	20	IDGD	
N#Cc1ccc(S(=O)(=O)NCC(=O)NNc2ccc(Br)cc2F)cc1	810683195	AVHNYBPNGJSHJO-UHFFFAOYSA-N	427.255	1.881	50	20	IDGD	
COc1ccc(S(=O)(=O)NCC(=O)NNc2cc(C#N)cc(Cl)n2)cc1OC	810835262	YOBILJKLTZZGHE-UHFFFAOYSA-N	425.854	1.045	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)CNS(=O)(=O)c2ccc(Br)cc2)c1	810975208	IZOFBXJYVGVITA-UHFFFAOYSA-N	442.291	1.657	50	20	IDGD	
CCc1nc2ccc(Cl)cn2c1C(=O)N1CCN(S(=O)(=O)CBr)CC1	812544865	VQVACSZABPHEQV-UHFFFAOYSA-N	449.758	1.990	50	20	IDGD	
CCOC(=O)c1ccc(NNC(=O)c2ccc(S(=O)(=O)CC(=O)N(C)C)cc2)cc1C	812721423	RVDUIUKFSNRYCL-UHFFFAOYSA-N	447.513	1.791	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2cccc(-c3nccn3C)c2)cc1	813034157	ZMFWBKYZDLICEH-UHFFFAOYSA-N	442.501	1.419	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)[C@H]1OCCc2sccc21	813870267	UMRNCVLSADXHLD-SUMWQHHRSA-N	430.534	1.787	50	20	IDGD	
COC(=O)C12CCC(C(=O)OCC(=O)NNC(=O)[C@H]3COc4ccccc4O3)(CC1)CC2	814590164	GYBZFCMWKSBJTR-NYYVNYEXSA-N	446.456	1.031	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)COc2ccc(Cl)c(F)c2)cc1OC	815300545	UJIPJFKQYAPFGK-UHFFFAOYSA-N	440.811	1.880	50	20	IDGD	
Cc1cccc(COc2cccc(NC(=O)C(=O)NNC(=O)[C@H]3CCc4nncn4C3)c2)c1	815691490	RLJFCIYHLCAFGA-KRWDZBQOSA-N	448.483	1.514	50	20	IDGD	
CCOC(=O)c1ccc(C#N)c(SCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)n1	818135528	QEPPHXZVRUFAJX-UHFFFAOYSA-N	429.414	1.591	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)[C@@H]2CCCCN2S(C)(=O)=O)c1	818745526	JJWZLVNFFHZDOK-ZDUSSCGKSA-N	434.312	1.493	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)NCCNS(=O)(=O)c2cccc(Cl)c2)c1	914539231	LWJUYPLQUWRGJI-UHFFFAOYSA-N	440.909	1.336	50	20	IDGD	
Cc1cc(F)c2c(c1)C(=NNC(=O)c1cccc(S(=O)(=O)N3CCOCC3)c1)C(=O)N2	914771919	CBGHWIOOHGMNBD-UHFFFAOYSA-N	446.460	1.241	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)N2CCCN(S(C)(=O)=O)CC2)c(C)n1C[C@H]1CCCO1	914847235	AIQYGVWAPHWULG-QRRJMBGHSA-N	434.562	1.685	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(Br)c([N+](=O)[O-])c2)c1	915164631	MEHWBUSLVSIVCW-UHFFFAOYSA-N	442.247	1.836	50	20	IDGD	
CC(C)[C@H](CNC(=O)NNC(=O)COc1ccc(Br)cc1)N1CCOCC1	916254279	SWYAIQBIDQERJD-INIZCTEOSA-N	443.342	1.515	50	20	IDGD	
Cc1nn([C@@H]2CCS(=O)(=O)C2)c(C)c1C=NNC(=O)c1nn(-c2ccccc2)cc1O	917028477	WVMHYLNMFIWUSL-MRXNPFEDSA-N	442.501	1.515	50	20	IDGD	
CN(CC(=O)NNC(=O)c1nnc(O)c2ccccc12)C(=O)c1ccc(Br)o1	917387554	APQYZSFGUBMQQE-UHFFFAOYSA-N	448.233	1.224	50	20	IDGD	
CC(=O)NCCc1ccc(S(=O)(=O)NNC(=O)c2cc(Br)c[nH]2)cc1	917730798	DGEIIQXABCHCCW-UHFFFAOYSA-N	429.296	1.079	50	20	IDGD	
O=C(NC[C@@H]1CCCOC1)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	918123903	DEEHBJVEFJDBDY-KRWDZBQOSA-N	435.484	1.815	50	20	IDGD	
CCN(CC)c1ccc(CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1	918229486	FKRLSCFNNWGYLY-UHFFFAOYSA-N	432.550	1.970	50	20	IDGD	
CS(=O)(=O)N[C@@H]1CCCN(C(=O)NNC(=O)c2ccc(COc3ccccc3)o2)C1	918779193	FGHKQNLWPXKNHT-CQSZACIVSA-N	436.490	1.227	50	20	IDGD	
CNS(=O)(=O)c1ccc([C@H](C)NC(=O)NNC(=O)COc2cc(C)cc(C)c2)cc1	919779412	ROLRCVCVYTUHPI-HNNXBMFYSA-N	434.518	1.682	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)[C@@H]1CCCN(CC(F)(F)F)C1	919825899	YXKOLZPQIQGSNG-QGZVFWFLSA-N	441.498	1.620	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)N[C@H](C)c1ccc(S(=O)(=O)N(C)C)cc1	919908712	JNBYZIRZBIRYBU-CQSZACIVSA-N	434.518	1.580	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2cccc(C(=O)NNC(=O)NCc3ccco3)c2)C[C@H](C)O1	920857402	HVOLUGRDUCEJRZ-KBPBESRZSA-N	436.490	1.222	50	20	IDGD	
CCCNC(=O)NNC(=O)c1ccc(OC)c(S(=O)(=O)N(C)Cc2ccccc2)c1	921042574	AXOAEXXSJRRXJP-UHFFFAOYSA-N	434.518	1.870	50	20	IDGD	
CN1C(=C(C#N)C(=O)COC(=O)CN2C(=O)[C@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2=O)N(C)c2ccccc21	922223167	WGHQPTUZLKWYJQ-MFRYECHYSA-N	446.463	1.227	50	20	IDGD	
O=C(Cc1ccc(S(=O)(=O)CC(F)(F)F)cc1)NNC(=O)c1n[nH]c2c1CCCC2	1251975756	AWPGKIUABUEJEC-UHFFFAOYSA-N	444.435	1.628	50	20	IDGD	
Cc1ccc([C@@]2(C)NC(=O)N(CC(=O)NNC(=O)c3cncn3-c3ccccc3)C2=O)cc1	1317870937	WAXBRIKJMMLVAP-HSZRJFAPSA-N	446.467	1.409	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)C2CN(C(=O)OC(C)(C)C)C2)CC1	1320927563	SRUJOFBQVJRQQS-UHFFFAOYSA-N	426.514	1.648	50	20	IDGD	
CC(C)(C)c1ccc(NNC(=O)NCc2cccnc2N2CCC(C(N)=O)CC2)nn1	1323001682	PHQKMUVBQMJRNP-UHFFFAOYSA-N	426.525	1.697	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2nc[nH]c2[N+](=O)[O-])C1	1778059850	PHCUMUXNFBMTPN-FZKQIMNGSA-N	439.545	1.297	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc4n(n3)CCCO4)C2)C1	1778558905	WQWXPNGMAWTGLD-UGSOOPFHSA-N	441.326	1.283	50	20	IDGD	
CC[S@](=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CO[Si](C)(C)C)C2	1779219377	CXRXGSNIGWTAES-TUZCJGOLSA-N	432.659	1.511	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CO[Si](C)(C)C)C1)N1C[C@H]2C[C@H]2C1	1779545540	VUFJJVNYQLNTHV-NFSXTHTRSA-N	437.657	1.692	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccccc3C(=O)OCCO)C2)C1	1780156734	VNDDGWLTZVEFQT-UTKZUKDTSA-N	438.908	1.297	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc([N+](=O)[O-])[nH]3)C2)C1	1780418743	CGKMWMYLTMQKKW-MEDUHNTESA-N	429.271	1.540	50	20	IDGD	
CC(=O)N(C)[C@@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@](C)(Cl)CCl)C1	1780712210	XIKFXVCBQNQMIK-LLBUTXAOSA-N	436.380	1.603	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc3nn(C)cc3c2)C1	1781240557	POXXZUCYYRUENK-LRXVAGHRSA-N	448.951	1.955	50	20	IDGD	
O=C(Cc1ccc2c(c1)OCO2)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781327912	DLCCKTVWYXRFNJ-FUHWJXTLSA-N	443.269	1.478	50	20	IDGD	
Cc1nc2ncccn2c1C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781329981	OZFKPLOCRAGJSL-SUMWQHHRSA-N	440.273	1.172	50	20	IDGD	
COc1ccc(F)cc1C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781335634	XYCJOHWZLCSXNU-YOEHRIQHSA-N	433.249	1.968	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)c3nc4ccc(F)cn4n3)C2)C1	1782569213	GTRZTZCIGQVOHU-MSOLQXFVSA-N	444.294	1.548	50	20	IDGD	
O=C([C@@H]1Cc2ccccc2N1)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1782841628	FPIXVRICEABZQC-RLFYNMQTSA-N	426.286	1.544	50	20	IDGD	
O=C(CCc1c[nH]c2ncccc12)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2	1783208364	UMIBJZPMYSANFJ-NJNPRVFISA-N	448.951	1.609	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](C)[S@@](=O)c1ccccc1)CCO2	1783881027	JGNDRUXVKXGXER-NTKIRWMFSA-N	442.965	1.266	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cc4cccnc4cc3F)C[C@@H]21)[C@H](O)CCl	1784092929	OBWMDEGNSLCNSM-UQOODKLHSA-N	449.910	1.496	50	20	IDGD	
C[C@@H](CN)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C[C@@H]21	1786785849	FKABUDWUJWVACZ-IJFVLIARSA-N	432.471	1.446	50	20	IDGD	
CCCC(=O)N[C@@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](Br)CC)C[C@@H]21	1788743993	OSXRRXQOWVBWNB-QXKUPLGCSA-N	446.386	1.444	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)c1ccn(-c2ccccc2)n1	1789347478	IHFIYLOMIIFQLK-CBVHJVASSA-N	432.908	1.065	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN(C)C(=O)OC(C)(C)C)C[C@@H]21	1789860879	FHSRUZPRJJTEPC-JONQDZQNSA-N	431.961	1.850	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(O)cn3)C[C@@H]21	1790960977	HBVDQXUAWRVVFC-PCBIJLKTSA-N	426.311	1.554	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(COC)c[nH]3)C[C@@H]21	1790962965	HCXBLICJIOJSEV-JKQORVJESA-N	442.354	1.928	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3c[nH]c4ccccc34)C[C@@H]21	1791254689	YTJDQOIXCSNUCR-DEYWJSPQSA-N	433.936	1.944	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc[nH]c3nccc1-3)C2	1792867350	ADFOEMYKYPYSCU-JFILPPLUSA-N	435.322	1.749	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3nccn3c1)C2	1792867497	CKYMKYBTWLJZRF-JJAZEVLHSA-N	435.322	1.569	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc3c(F)c(F)ccc3c1)C2)[C@@H](O)CCl	1792983220	DEGYRDATUWPFLF-YXPYIKCWSA-N	439.846	1.316	50	20	IDGD	
COc1ccccc1CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc(B(O)O)c1)C2	1793326617	DKDRRAXQAINGCQ-WKCHPHFGSA-N	436.317	1.260	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1cc(O)nc(Cl)c1	1794414529	ZHWOILDFVUYGJX-OTMMVIPVSA-N	436.665	1.334	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C(=O)c1ccccc1	1795435788	OMMCWTPBZYVBCQ-DHMPJCMBSA-N	435.484	1.642	50	20	IDGD	
COc1nccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Br)C3)c1F	1795910301	CHEPOWZTVOTQTF-FQPOAREZSA-N	434.237	1.123	50	20	IDGD	
CC(C)Cc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Br)C3)n(C)n1	1796017136	UQGLTDSGWWFUNW-VZAMPYOESA-N	445.333	1.512	50	20	IDGD	
COc1ccc2oc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3ccc(B(O)O)cc3)cc2c1	1796189041	PEVHNMVDSGEZGJ-REPLKXPHSA-N	448.284	1.687	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccn3cncc13)C2	1796892585	TXOMZYYVNPISAZ-CKFWPPNZSA-N	447.499	1.720	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2)c1cc(-c2cccnc2)[nH]n1	1798157509	QQQRIGKRDQODDU-ZSBFGKGUSA-N	448.321	1.460	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1c(F)ccc(O)c1F)C2	1798442094	WEWZXMKPUKMWQF-ZSBIGDGJSA-N	445.426	1.235	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc[nH]c3nccc1-3)C2	1799274953	FGBYRIUCKXBLNK-CVGJEZRXSA-N	425.316	1.954	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3ncncc3c1)C2)[C@H](F)Br	1799349823	LNHIIRQFXLRRSI-XRGAULLZSA-N	437.269	1.524	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2	1800642535	NMGFWLPPDZBZGN-SSRBZLIGSA-N	430.112	1.440	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C[C@@H]1CNc3ccccc3O1)C2)C(Cl)Cl	1801016883	ASEPJKCSYPGZRH-IPJQOSJUSA-N	428.316	1.643	50	20	IDGD	
C=C1C[C@@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Cl)C3)N(C(=O)OC(C)(C)C)C1	1801103895	IXRFHHLTYRNWHD-XFIYOXNOSA-N	445.919	1.676	50	20	IDGD	
C/C(=C\c1cccnc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2	1801351755	FNQHHFQXATXHHG-OQBSVPFQSA-N	426.286	1.765	50	20	IDGD	
CCOc1cccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CCC(=O)NN(C)C)c1O	1802338891	ZRIRXFXTAGQYBC-MUJYYYPQSA-N	432.521	1.416	50	20	IDGD	
COC(=O)c1ccc(C(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)cn1	1803139756	VSGBOJKNVHUXIL-FHLIZLRMSA-N	446.891	1.183	50	20	IDGD	
CC(C)(C)n1ccc(C(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)n1	1803141510	OLXBNADQTILDTA-BPQIPLTHSA-N	433.940	1.952	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1803689948	HNJMATASMWDLID-IHPCNDPISA-N	443.740	1.489	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@H](CNC(=O)Cc2ncccn2)[C@H]1c1cccnc1	1804693764	XCHPRTZIMRGUDU-LAUBAEHRSA-N	427.581	1.972	50	20	IDGD	
C[C@@H]1Oc2ccc(C(=O)N3CCC4(CCCN(C(=O)[C@H](O)CCl)C4)CC3)cc2NC1=O	1805525581	ZUGGQGICXMGRIY-WMLDXEAASA-N	449.935	1.851	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)c[nH]1	1807377186	ZCZSOTNFLBADDU-NQIIRXRSSA-N	432.289	1.031	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)c1c[nH]c2cnccc12	1810061257	JINHXUGHHYTIGO-GDIGMMSISA-N	427.892	1.877	50	20	IDGD	
COc1cc(C(=O)N2CC[C@H](CNC(=O)CO[Si](C)(C)C)[C@H]2c2cccnc2)n(C)n1	1810541888	WUOGCWUZSAKEEU-OXQOHEQNSA-N	445.596	1.995	50	20	IDGD	
O=C(CN1CCOCC1)Nc1cc([C@H]2CCCCN2C(=O)[C@H](F)Br)[nH]n1	1817149056	DXERFVUATNZCNO-DOMZBBRYSA-N	432.294	1.425	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnco1)CC2	1817275937	HPWZNZNOZCDNAK-DLDHGHKKSA-N	441.473	1.491	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cnccc3C(=O)NN)n[nH]2)n[nH]1	1819403424	LNRWSNRPWHWABF-INIZCTEOSA-N	437.464	1.059	50	20	IDGD	
CC1(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cnccc4C(=O)NN)sc3C2)CCCC1	1819789930	AHKGAZFGNWOYPQ-GFCCVEGCSA-N	442.545	1.948	50	20	IDGD	
Cc1cc2nnc(C(=O)N3CCC([C@@H]4CCCCN4C(=O)[C@H](O)CCl)CC3)c(C)n2n1	1824187957	WGFNUGXJSVMLMY-DLBZAZTESA-N	448.955	1.574	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cn(C)nc2OC)CC1	1825734509	JHBQMVSEIJLOGD-IAGOWNOFSA-N	426.945	1.916	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](C)n3cncn3)sc2C1	1826781728	HHSHVHALEXNJAH-OUAUKWLOSA-N	441.355	1.939	50	20	IDGD	
CCc1cc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)no1	1827057950	OGPGSRMJKPSMQO-OAQYLSRUSA-N	439.321	1.464	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)C23CC(F)(C2)C3)CC1	1828923780	XSBVPMNZGYKIQR-NWLLBJEDSA-N	443.523	1.811	50	20	IDGD	
CNC(=S)NCCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H](Cl)COC)CC1	1828931302	GVCJYYAAUYMBNO-JKSUJKDBSA-N	433.018	1.344	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccnc3S)CCO2)C1	1829790104	LXUMOSYNOLVBMO-LJQANCHMSA-N	427.954	1.705	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](O)c3ccco3)CCO2)C1	1829828267	BSAWWUSBCOKSMI-FHLIZLRMSA-N	435.304	1.006	50	20	IDGD	
O=C(C#Cc1ccc(Cl)cc1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1830468755	SPSBKVAROSNIBR-PKOBYXMFSA-N	429.275	1.682	50	20	IDGD	
CCn1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)n1	1830538238	ZEHCWSVAZHVUKD-RDTXWAMCSA-N	443.342	1.004	50	20	IDGD	
O=C([C@@H](O)CCl)N1CCO[C@@]2(COCCN(C(=O)C3(c4ccccc4)CCC3)C2)C1	1830738502	PGDTWTOVNWGXJC-RXVVDRJESA-N	436.936	1.164	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C1(c3ccc(O)cc3)CC1)CCO2	1830811753	XFZVBTGBJJXHCT-RXVVDRJESA-N	436.936	1.898	50	20	IDGD	
C#CC(=O)N1CCCC[C@@H]1C1CCN(C(=O)CN(C)NC(=O)NCc2ccccc2)CC1	1831325046	OGBKHJZJXQPTPR-OAQYLSRUSA-N	439.560	1.586	50	20	IDGD	
C=CCOCCCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](Br)CC)C2)C1	1831413319	VHKKIOMAPLXIOG-LPHOPBHVSA-N	447.370	1.599	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccnc(F)c3)CCO2)C1	1831907107	GXIXHVKZRULOMY-SJCJKPOMSA-N	430.274	1.074	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)cn1	1831943401	NAUBGQVXIQFBIX-FQEVSTJZSA-N	425.913	1.425	50	20	IDGD	
CC(=O)NCCC(=O)N1CCC(N2CCC(NC(=O)[C@@H](C)CBr)CC2)CC1	1833264331	DDNXSELGQKFDGS-AWEZNQCLSA-N	445.402	1.115	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)CSc3ccccc3)CC2)CC1)[C@@H](O)CCl	1833308940	DXLBIODMZFKIAL-IBGZPJMESA-N	440.009	1.950	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3ccc4c(c3)CCCO4)CC2)CC1)[C@H](O)CCl	1833312899	KKQNSBCWWGDZTF-HXUWFJFHSA-N	449.979	1.797	50	20	IDGD	
Cc1nccn1CCCC(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)CCl)CC2)CC1	1833313036	REFZDTRSAZILMS-IBGZPJMESA-N	439.988	1.143	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)NC(=O)CC)CC2)CC1	1833529705	HFACTUANKBKKMA-CRAIPNDOSA-N	429.005	1.880	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)[C@H](O)NC(=O)OCC)CC2)CC1	1833533752	ORXBZENTNQNUHC-AEFFLSMTSA-N	446.976	1.030	50	20	IDGD	
O=C1NCc2cc(C(=O)N3CCC(N4CCC(NC(=O)[C@H](F)Cl)CC4)CC3)ccc21	1835080743	WGNAYODYFJZZTR-SFHVURJKSA-N	436.915	1.650	50	20	IDGD	
Cn1cc(CCC(=O)N2CCO[C@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)cn1	1835988516	ZIEIPHWKPAIGPF-RBUKOAKNSA-N	447.363	1.045	50	20	IDGD	
Cc1ccccc1C(=O)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1	1836253068	YIBDJYFCKAGAPB-UHFFFAOYSA-N	449.360	1.174	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)COc3ccccc3F)C2)C1	1839148118	NDRGRCXPWYKAMQ-QRWLVFNGSA-N	428.888	1.678	50	20	IDGD	
O=C(/C=C/c1cccnc1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839197932	NEKNDNGVZXPUOF-CMDLKFMISA-N	442.285	1.242	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccn4nccc34)CCO2)C1	1839537756	AGFBDYUWEAPILO-OAQYLSRUSA-N	434.924	1.669	50	20	IDGD	
O=C(c1cccc2nc[nH]c12)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840187720	RYKUMSYHZRWTDU-SFHVURJKSA-N	427.288	1.437	50	20	IDGD	
O=C(CCCCn1cccc1)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840188571	QBHMNZTUAQALTD-IBGZPJMESA-N	432.348	1.919	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)CCc2cncc(C)c2)C1	1842036887	HCDBPBOSNVASRF-YZSQISJMSA-N	436.516	1.660	50	20	IDGD	
Cc1ccc(NCCC(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)c(C)c1	1844306667	ZXKBFKWJORBNQD-UHFFFAOYSA-N	435.333	1.302	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)Cc1[nH]nc3c(Cl)cccc13)C2	1846385496	NIHGLJXIYAQPSO-UHFFFAOYSA-N	446.939	1.335	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc(F)c(F)c1)NNC(=O)c1cc(Cl)ccc1O	10627395	IJJQBHNYBANMSN-UHFFFAOYSA-N	433.820	1.453	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)c2ccc3c(c2)C(=O)N(C[C@H]2CCCO2)C3=O)c1	17198730	HVJPTMXAKMJKTB-QGZVFWFLSA-N	437.452	1.610	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)c1ccc(S(=O)(=O)N(CC)CC)cc1	25413903	ATMBRFYETIDQPR-UHFFFAOYSA-N	449.529	1.956	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)cc1S(=O)(=O)NCC#N	726883904	OKKDEJYTJPGQGA-ZDUSSCGKSA-N	434.449	1.165	50	20	IDGD	
C[C@@H](CC(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1)NC(=O)C1CCCCC1	727365760	YJCSUUXNDJUZPA-NSHDSACASA-N	444.941	1.224	50	20	IDGD	
C[C@@H]1C[C@@H](C)CN(CCCCNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)C1	728946686	RJZWELNTOWKCSQ-QZTJIDSGSA-N	431.585	1.782	50	20	IDGD	
CS(=O)(=O)CCNC(=S)NNC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1	729158478	XYVIVLXHOXVSIU-UHFFFAOYSA-N	444.542	1.088	50	20	IDGD	
CCNC(=O)CCCC(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	729284523	XWUBCIPMAWOUGA-UHFFFAOYSA-N	435.488	1.456	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)CCNS(=O)(=O)/C=C/c2ccccc2)cn1	729693347	USPTWWYAFKQDGN-ZRDIBKRKSA-N	435.531	1.388	50	20	IDGD	
O=C(NN=c1cc[nH]c2ccccc12)C1CCN(C2=NS(=O)(=O)c3ccccc32)CC1	730289143	WSCABGTZOXOKFG-UHFFFAOYSA-N	435.509	1.961	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNS(=O)(=O)c1ccc2c(c1)C(=O)NC2=O	731594896	NMTVAOIDOKUQKW-GFCCVEGCSA-N	439.449	1.500	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])o1)c1cc(Br)c[nH]1	731875204	WAYQOWKBDMEIGP-SNVBAGLBSA-N	440.210	1.344	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)N(C)Cc1ccccc1	732246394	ROYOHJUTABPVMZ-QGZVFWFLSA-N	425.537	1.544	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)c1ccc2c(c1)C(=O)N(C[C@@H]1CCCO1)C2=O	732302858	SCDGFYPNUHPCHF-AWEZNQCLSA-N	443.481	1.622	50	20	IDGD	
CCOCCCn1c(NNC(=O)c2ccc3c(c2)NC(=O)CO3)nc2ccccc2c1=O	733266568	JPEDDODRCUENCN-UHFFFAOYSA-N	437.456	1.911	50	20	IDGD	
COC(=O)CCCOc1ccc(CNC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1	734176369	ZRAFBQSEUJYWKR-IBGZPJMESA-N	443.456	1.689	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)[C@H]1CCCN(C(=O)Nc2ccccc2)C1	734240344	OQKXVWSLUJNJGR-HNNXBMFYSA-N	448.524	1.786	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)C2CCN(C(=O)c3ccc(Br)cc3)CC2)cn1	735450348	WXDUGFRPBQWCEY-UHFFFAOYSA-N	434.294	1.496	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)c1cnn(-c2ccc(F)cc2)n1	737467584	SVBLGPCKICLQMP-UHFFFAOYSA-N	437.479	1.380	50	20	IDGD	
CC(=NNC(=O)c1ccnc(N(C)C)c1)c1cccc(S(=O)(=O)N2CCOCC2)c1	739412454	ZUUPBBVUKMPNNM-UHFFFAOYSA-N	431.518	1.323	50	20	IDGD	
O=C(NNc1ncccc1C(F)(F)F)c1ccc(S(=O)(=O)N2CCOCC2)cc1	740100824	RDIBHHOWWDHZGC-UHFFFAOYSA-N	430.408	1.878	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)Cc1ccc(S(=O)(=O)C(F)F)cc1	740640881	FFRMOQVEPJOCOS-UHFFFAOYSA-N	442.440	1.851	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CC[C@H](NC(=O)OC(C)(C)C)[C@@H](C)C2)n1	740879006	CUZFJFPIZORYNJ-JSGCOSHPSA-N	425.555	1.377	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1c[nH]c2c(C)cc(F)cc2c1=O	741741515	WFNBVNOIQZBJSE-UHFFFAOYSA-N	445.476	1.652	50	20	IDGD	
COc1ccccc1-c1noc([C@@H](C)NC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)n1	743705726	UYUQJPWMKRLBBA-PXAZEXFGSA-N	439.428	1.977	50	20	IDGD	
COC(=O)/C=C/c1cc(OC)c(OC)c(S(=O)(=O)NNC(=O)NC2CCCC2)c1	743729189	AJZVCSMXYUAKLS-CMDGGOBGSA-N	427.479	1.325	50	20	IDGD	
O=C(CCn1nnc2ccccc2c1=O)NNC(=O)c1cc(Br)ccc1O	743730147	PFBBLLXYGDUPLU-UHFFFAOYSA-N	432.234	1.111	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2cn(-c3ccccc3Cl)nn2)cc1	743830396	UCUSHIIADZKAAG-UHFFFAOYSA-N	434.865	1.791	50	20	IDGD	
CCOc1cc(C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)c([N+](=O)[O-])cc1OC	744518565	USSXNOPOIGUFOO-UHFFFAOYSA-N	442.384	1.492	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)CCn2c(=O)oc3cc(Cl)ccc32)c1	744595615	QJYSUAXSOGHQBS-UHFFFAOYSA-N	431.832	1.951	50	20	IDGD	
Cc1cc2c(cc1C)O[C@H](C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1)C2	744620547	IBJYLDAHLAQNFB-IBGZPJMESA-N	431.514	1.771	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)NNC(=O)c2ccoc2)cc1	747182596	QSTPRWRKBHVLDJ-MHWRWJLKSA-N	448.439	1.395	50	20	IDGD	
CC(C)(C)OC(=O)[C@H]1CN(C(=O)NNC(=O)c2cccc(Br)c2)CCO1	747508220	BHPJECXUNXRFBZ-CYBMUJFWSA-N	428.283	1.846	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)NC2CCN(C3CCN(C)CC3)CC2)cc1OC	747990727	WWHHGJHLPVBTBB-UHFFFAOYSA-N	433.553	1.597	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2c(F)c(F)cc(F)c2F)cc1OC	748218466	GFOSLNHUHYIDPY-UHFFFAOYSA-N	430.310	1.878	50	20	IDGD	
CNC(=O)CCNC(=O)/C(C#N)=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	748724310	ZJJMKACKSSZLKF-UVTDQMKNSA-N	428.880	1.238	50	20	IDGD	
CN(C)[C@@H]1CCC[C@@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)C1	749592858	WXYRKPFPKJMBFF-IAGOWNOFSA-N	437.566	1.288	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)Cc2ccc(OCc3ccccn3)cc2)C[C@H](C)O1	752611392	ZGWCJGSTDYSCCH-ROUUACIJSA-N	426.517	1.850	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1ccc2c(c1)CCC(=O)N2	753899618	YJNOGANKAHJTIY-UHFFFAOYSA-N	431.832	1.851	50	20	IDGD	
COC(=O)c1cc(C(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)cc([N+](=O)[O-])c1	753955694	WZGFWLWAVQVOLX-UHFFFAOYSA-N	435.776	1.653	50	20	IDGD	
O=C(NNc1cccnc1Cl)[C@H]1CCCN1S(=O)(=O)c1cccc([N+](=O)[O-])c1	754485480	WPHKWZQASXDREZ-CQSZACIVSA-N	425.854	1.940	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)C3=Cc4ccccc4OC3)cc2)CC1	754907861	PWDHMHIDCWFCHO-UHFFFAOYSA-N	428.514	1.542	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)Nc2ccc(NC(=O)NNC(=O)CO)cc2Cl)c1	755622296	ILWXJXOZKKGDJK-UHFFFAOYSA-N	440.865	1.141	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)Nc1cccc2c1OCCO2	756149831	KQYQBUKHGARLLN-UHFFFAOYSA-N	446.485	1.709	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)Nc1cccc(C(=O)N2CCOCC2)c1C	756184367	BXSUZTKZKOMWIP-UHFFFAOYSA-N	426.473	1.871	50	20	IDGD	
COCCS(=O)(=O)c1ccc(NC(=O)NNC(=O)Cc2c[nH]c3ccccc23)cc1	756556451	WXZWCNONXFXSIG-UHFFFAOYSA-N	430.486	1.983	50	20	IDGD	
CC[C@@H]1CC[C@@H](C(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)O1	756901017	GCMHWGCIPWASIP-MJGOQNOKSA-N	431.514	1.884	50	20	IDGD	
Cc1nc(C)n(-c2ccccc2NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)n1	757708740	KIHOTNLYSWGKCT-UHFFFAOYSA-N	428.474	1.754	50	20	IDGD	
CCS(=O)(=O)c1ccc(CCC(=O)OCC(=O)NNC(=O)c2cccc(C)c2)cc1	757781761	CSBCJARVKALLRD-UHFFFAOYSA-N	432.498	1.726	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cnc3ccc(F)cc3c2)cc1	758068736	OJEXMRRRNSOTDV-UHFFFAOYSA-N	430.461	1.764	50	20	IDGD	
O=C(NNC(=O)/C(=C\c1cccnc1)NC(=O)c1ccccc1)C(=O)Nc1ccccn1	758839294	CEHFGJMVYPWMCA-GHRIWEEISA-N	430.424	1.034	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNS(=O)(=O)c2cnc(Cl)n2C)cc1	759708828	OZZPHFQXIDYGGO-UHFFFAOYSA-N	441.926	1.118	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)C(=O)c3ccc(Cl)s3)CC2)cc1	760447145	ANLUZZGDRHJIDK-UHFFFAOYSA-N	434.949	1.858	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)n1	762902956	RZZLPVIFDRQXRY-UHFFFAOYSA-N	434.522	1.101	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)CSc3nnnn3CC(F)(F)F)n[nH]2)cc1	762954076	JQZSWKOTWVDCOB-UHFFFAOYSA-N	440.411	1.487	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)NCC(=O)N1CCc2ccccc2C1	763487211	ZPEQUYNXPPJMON-UHFFFAOYSA-N	433.509	1.207	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)CCCOc2ccc(Cl)cc2Cl)nn1C	763505347	LGNIJULOURQZKF-UHFFFAOYSA-N	428.276	1.980	50	20	IDGD	
Cc1cc(C(=O)N2CCC[C@@H](C)C2)ccc1NC(=O)C(=O)NNC(=O)c1ccccc1O	763527676	KLOXJHYMZRZZNJ-CQSZACIVSA-N	438.484	1.972	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(OCC(F)(F)F)nc2)cc1OC	763544435	XOMNBLWVDUIOPU-UHFFFAOYSA-N	442.350	1.440	50	20	IDGD	
COc1ccc(OC(C)C)c(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1	763571795	OTCSMUUUUMKISL-GOSISDBHSA-N	429.429	1.408	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)Nc1ccc(OCc2cccnc2)cc1	763572881	VFRZBTXMWYPVNO-FQEVSTJZSA-N	448.435	1.587	50	20	IDGD	
NC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)c2sc3ccccc3c2Cl)cc1	763578491	PXYFGORBWJBYFP-UHFFFAOYSA-N	446.872	1.819	50	20	IDGD	
CC(=O)NCc1ccc(NC(=O)C(=O)NNC(=O)COc2cc(C)ccc2C(C)C)cc1	763596484	HSMYETMLYYDGPX-UHFFFAOYSA-N	440.500	1.919	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(N3CCCN(C)CC3)cc2)c1	763625774	YGSHQVOSYSDEBC-UHFFFAOYSA-N	439.516	1.302	50	20	IDGD	
C=CCNC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C)c(C)c2)cc1	763665317	TXXPTTOYQGSMKD-UHFFFAOYSA-N	439.472	1.776	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2F)ccc1C(=O)NC(C)C	763678325	CQMDZTMNORIIHI-UHFFFAOYSA-N	430.436	1.437	50	20	IDGD	
C[C@H](c1cccc(NC(=O)C(=O)NNC(=O)c2cccc(N(C)C)c2)c1)N1CCOCC1	763754997	YVDNEQWDTRTDJT-MRXNPFEDSA-N	439.516	1.546	50	20	IDGD	
COCCOc1ccc(C#N)cc1NC(=O)C(=O)NNC(=O)c1cc2c(s1)CCC2	763782430	CPSDUZHSWVSBIF-UHFFFAOYSA-N	428.470	1.533	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)NC(=O)[C@H](C)O2	763873521	VEKGBBYUVRTLCV-QWRGUYRKSA-N	430.392	1.099	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cccc(NC(C)=O)c2)ccc1OC(C)C	763916287	LUFFSLQYAQOALO-UHFFFAOYSA-N	428.445	1.841	50	20	IDGD	
CCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(OC(C)C)c(OC)c2)cc1	763921792	OSMZFTPXLALVGZ-UHFFFAOYSA-N	442.472	1.632	50	20	IDGD	
COC(=O)CCCc1nnc(NC(=O)NNC(=O)CSc2ccccc2O)s1	763960266	QSGJIMBNCHBUQJ-UHFFFAOYSA-N	425.492	1.684	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1cc(Br)ccc1F	764005565	BBWBYXUKKQKHKX-UHFFFAOYSA-N	438.209	1.759	50	20	IDGD	
COC(=O)CCOc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2OC)cc1	764010658	BXTUCAVDSZDOIA-UHFFFAOYSA-N	449.847	1.690	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(F)cc2OCC(F)F)c1O	764131583	ILNYLVPDOACUDN-UHFFFAOYSA-N	427.335	1.584	50	20	IDGD	
Cc1ccc(C(=O)N2CCSCC2)cc1NC(=O)C(=O)NNC(=O)CC1CCCC1	764184025	MEMWKMJUVHRPPX-UHFFFAOYSA-N	432.546	1.850	50	20	IDGD	
O=C(NNC(=O)c1cccc2ncccc12)C(=O)Nc1ccccc1C(=O)N1CCCC1	764258041	SZZKSKLWHQZAQV-UHFFFAOYSA-N	431.452	1.871	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2cccc3ncccc23)cc1	764259315	FPHKSUFPZPQUEW-UHFFFAOYSA-N	441.469	1.396	50	20	IDGD	
COC(=O)c1c(C2CC2)csc1NC(=O)C(=O)NNC(=O)COc1ccccc1O	764279971	JTIIDQDJYOHLGT-UHFFFAOYSA-N	433.442	1.283	50	20	IDGD	
CSc1cc2c(cc1NC(=O)C(=O)NNC(=O)CCc1ccccc1O)OCCO2	764280520	BOLINWUZWSUDBH-UHFFFAOYSA-N	431.470	1.604	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C(=O)Nc1cccc(OCC(=O)N(C)C)c1)c1ccccc1	764326868	PSAJTKSDJCAOLI-SFHVURJKSA-N	426.473	1.433	50	20	IDGD	
CNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)cc1Cl	764405343	RYZVUQOFXGPBQE-UHFFFAOYSA-N	436.877	1.283	50	20	IDGD	
CC(C)(C)OC(=O)N1CCO[C@@H](CC(=O)NNC(=O)c2nnc(O)c3ccccc23)C1	764544203	DLQIMAGQCJTOFW-LBPRGKRZSA-N	431.449	1.122	50	20	IDGD	
COc1cc(C=NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cc(OC)c1O	764827398	IPGFBPVDANZSJH-UHFFFAOYSA-N	426.473	1.318	50	20	IDGD	
CC[C@@H](C)NS(=O)(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)OC(C)(C)C)c1	765398388	ITODWJFANSUZMT-GFCCVEGCSA-N	428.511	1.399	50	20	IDGD	
CC(C)(C)OC(=O)N1CCO[C@@H](CC(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)C1	765565303	MVLMWIQELNVKPU-LBPRGKRZSA-N	435.506	1.925	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)N[C@@H](c1cccc(F)c1)c1ccccn1	765642610	HOKMFPFWPALRQS-IBGZPJMESA-N	432.419	1.930	50	20	IDGD	
C[C@@H](OC[C@H]1CCCO1)C(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	766670329	XMQHKSIEJDBSAI-SJLPKXTDSA-N	438.956	1.189	50	20	IDGD	
CC(C)(C)[C@@H](Br)C(=O)N(CCCN1CCOCC1)[C@H]1CCS(=O)(=O)C1	768032463	BCOGPKZLKODBHG-GJZGRUSLSA-N	439.416	1.534	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cc(C(C)C)nn2-c2ncccn2)cc1	768236997	IWFZICGQMHEWEQ-UHFFFAOYSA-N	437.460	1.259	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)Cc3c(C)nc4nc(N)nn4c3C)n[nH]2)cc1	768270172	WJWIINASZDXNLJ-UHFFFAOYSA-N	433.476	1.280	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)c1	768290616	KZIGLAHHQLQZIM-UHFFFAOYSA-N	429.952	1.985	50	20	IDGD	
C[C@H](NC(=O)c1ccc(Br)s1)C(=O)NNc1nc(O)c2cnn(C)c2n1	770975014	SOJRBBVSALCFSD-LURJTMIESA-N	440.283	1.155	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)CCNS(=O)(=O)c3ccc4ccccc4c3)nc21	770985131	ZRAHBEYKRAYPKH-UHFFFAOYSA-N	441.473	1.034	50	20	IDGD	
O=C(NCCCn1nc2n(c1=O)CCCC2)NNc1ccc(Br)c(F)c1	771301946	LMGWPCFAYDFJAR-UHFFFAOYSA-N	427.278	1.999	50	20	IDGD	
Cc1nc(-c2ccc(S(=O)(=O)NNC(=O)C(=O)NCc3ccc(Cl)cc3)cc2)co1	771605782	BOFRCCZENAFPOR-UHFFFAOYSA-N	448.888	1.929	50	20	IDGD	
O=C(CCCNC(=O)c1ccc(F)cc1)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772188294	KDUOYBWIAWBIFY-UHFFFAOYSA-N	434.855	1.453	50	20	IDGD	
COc1ccc(-c2noc(CCCC(=O)NNC(=O)c3cncc(NC(C)=O)c3)n2)cc1	773068904	ARTSJNFJRNQHPK-UHFFFAOYSA-N	438.444	1.883	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNS(=O)(=O)c1ccc(OCC(=O)O)c(F)c1	773253266	YZCNGRSXPSPIJF-SNVBAGLBSA-N	446.840	1.720	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cn(C)nc2C(F)(F)F)cc1OC	773528594	FGJVYUYSUICTDB-UHFFFAOYSA-N	429.355	1.246	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3nc4cccnc4s3)cc2)CC1	773604404	TXFGOPMKKKPDJZ-UHFFFAOYSA-N	432.531	1.384	50	20	IDGD	
CC(C)N(C)S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2cnc3ccccc3n2)cc1	773718677	LPVSSQKTPUKJAT-UHFFFAOYSA-N	442.501	1.741	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1ccc(-c2cncnc2)cc1F	773764053	USUIPEFJEJXYJX-UHFFFAOYSA-N	442.476	1.959	50	20	IDGD	
CON(C)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)cc1	774007365	GYOVBDCCLHAXFX-LBPRGKRZSA-N	448.863	1.527	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)Nc1ccc(C[C@@H]2NC(=O)NC2=O)cc1	775705153	YMHGNQGTKCZDJV-BZNIZROVSA-N	429.408	1.196	50	20	IDGD	
C[C@@]1(NNC(=O)N[C@H]2CCN(c3ccccc3C(F)(F)F)C2=O)CCS(=O)(=O)C1	776183777	WCOLJOYLVVXJMQ-BLLLJJGKSA-N	434.440	1.192	50	20	IDGD	
CN(Cc1ccccc1)[C@@H](CNC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)C1CC1	776266614	VXODWWZWOWRQJV-FQEVSTJZSA-N	448.527	1.788	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1cn(-c2cccc(Cl)c2F)nn1	776322610	MUVJYFWCFQFYES-UHFFFAOYSA-N	444.858	1.527	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)c2cn(-c3cccc(Cl)c3F)nn2)c2ccccc2c1=O	776444832	PAVUTGAZWPVIBX-UHFFFAOYSA-N	441.810	1.382	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)NCCNS(=O)(=O)c2cccc(Cl)c2)c1	776610391	WDGSJXJCQXDEBH-UHFFFAOYSA-N	446.938	1.348	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)[C@@H](O)[C@H](O)c2nc3ccccc3s2)cc1OC	779489815	UUERKDMFZIODFR-ROUUACIJSA-N	445.497	1.949	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(NC(=O)c2ccncc2)cc1)c1cccc([N+](=O)[O-])c1	779824941	KPQPQNWUAFFYAR-UHFFFAOYSA-N	441.425	1.865	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)[C@H]1CCCN(C(=O)c2ccc(F)cc2)C1	780972043	XHYBRNAUSYAFAH-HNNXBMFYSA-N	436.484	1.740	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)c2cn(CCOC)nc2C)c2ccccc2c1=O	782538480	XPXHCRRHSXBNQS-UHFFFAOYSA-N	440.504	1.813	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(O)cc2)cc1NC(=O)c1ccncc1	782832714	RYHNOPDEQNDAPT-UHFFFAOYSA-N	433.424	1.748	50	20	IDGD	
COC(=O)c1cc(OC)c(OC)cc1NC(=O)C(=O)NNc1ncccc1C(F)(F)F	783118115	MTHFOTNWHSSGDB-UHFFFAOYSA-N	442.350	1.986	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)nn1[C@@H](C)C1CC1	783263081	HDWYKEFNQWKSLV-ZDUSSCGKSA-N	449.537	1.326	50	20	IDGD	
O=C(NNc1ccc(F)cc1F)C(=O)Nc1ccc(C(=O)NCCN2CCOCC2)cc1	783340833	XIOBWWLGMSTDQT-UHFFFAOYSA-N	447.442	1.109	50	20	IDGD	
Cc1ccc(-n2nc(C(C)(C)C)cc2NC(=O)C(=O)NN[C@]2(C)CCS(=O)(=O)C2)cc1	783426119	FVUXEOWCILWTRL-OAQYLSRUSA-N	447.561	1.615	50	20	IDGD	
COC(=O)[C@H]1CCCCN1C(=O)c1cccc(NC(=O)C(=O)NN(C)c2ccccc2)c1	783434583	RNPRRYKUPYFCJA-LJQANCHMSA-N	438.484	1.960	50	20	IDGD	
Cc1cc(Br)c(F)cc1NC(=O)C(=O)NNC(=O)CNC(=O)c1ccco1	784002924	XJESIVSBFXZVKN-UHFFFAOYSA-N	441.213	1.006	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1cc(F)ccc1Br	784003766	ODBHYQPPLYNYIH-UHFFFAOYSA-N	443.254	1.166	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1ccc(F)cc1Br	784004215	KYJSENDDRRKUSV-UHFFFAOYSA-N	443.254	1.166	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1ccc2nc(C3CC3)oc2c1	784004995	NOKVJLHRRADADP-UHFFFAOYSA-N	427.442	1.283	50	20	IDGD	
O=C(COC(=O)CCN1C(=O)[C@H]2CCCC[C@@H]2C1=O)NNC(=O)c1cccc(Cl)c1	784374848	HKIVEJSUOXDJBM-GJZGRUSLSA-N	435.864	1.210	50	20	IDGD	
Cc1ccc(-n2nc(NC(=O)C(=O)NNc3cccc(S(C)(=O)=O)c3)cc2C)cc1	784839290	INJIJOKYDDKZHX-UHFFFAOYSA-N	427.486	1.974	50	20	IDGD	
CN(C)c1nccc(NNC(=O)C(=O)Nc2ccc(-n3nccc3C(F)(F)F)cc2)n1	784968973	GDPMBIVJIVZDKY-UHFFFAOYSA-N	434.382	1.829	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)c(OCC(F)(F)F)c1	785059910	DEPCOCOMAZYEEA-UHFFFAOYSA-N	449.389	1.912	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)C(=O)Nc1cccc(OCc2cccnc2)c1	785061204	UTNAIQMDOOSPLB-UHFFFAOYSA-N	444.451	1.637	50	20	IDGD	
Nc1c(Cl)ccc(Cl)c1C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	785619668	ZDQARFDVMLLZOZ-CYBMUJFWSA-N	440.239	1.720	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)[C@H](CC(N)=O)NC(=O)c2ccccc2Cl)c1	786087180	SRFBYYOFBDHFFO-INIZCTEOSA-N	446.891	1.157	50	20	IDGD	
CN(C)Cc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccncc2)cc1Br	786416676	HVZLENGNKOGBNI-UHFFFAOYSA-N	434.294	1.234	50	20	IDGD	
CC(=O)N1CCc2ccc(S(=O)(=O)NNC(=O)c3cc4c(s3)CCC4)cc2CC1	790044862	GHMMFXLUPXMMCK-UHFFFAOYSA-N	433.555	1.807	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)N2CCC[C@@H](N3CCCS3(=O)=O)C2)c1C	790222355	PMZJUPQRDMODRX-UMSHPIDHSA-N	434.562	1.685	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)CN2CCc3cc(OC)c(OC)cc3C2)cc1	792801696	COWMFKHKWVVTPC-UHFFFAOYSA-N	427.501	1.851	50	20	IDGD	
CC(C)(C)c1ccc(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)cc1[N+](=O)[O-]	793051906	ZQGILFDOUFYCNY-UHFFFAOYSA-N	438.444	1.869	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)c1cncc(I)c1	795168680	SFIJCYWVRITPAS-UHFFFAOYSA-N	446.270	1.693	50	20	IDGD	
C=C(CBr)COC(=O)c1ccc(S(=O)(=O)N2CCN(C(C)=O)CC2)cc1	795359855	NOPFOTXMTQPNJT-UHFFFAOYSA-N	445.335	1.647	50	20	IDGD	
O=C(NNC(=O)c1cc(F)c(Br)c(Cl)c1)N[C@H]1CCS(=O)(=O)C1	795526962	GBYKOKQOSFJYQG-ZETCQYMHSA-N	428.667	1.373	50	20	IDGD	
Cn1cc(Oc2ccccc2C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cn1	801104582	STFGXZOQWTVTMP-UHFFFAOYSA-N	449.876	1.588	50	20	IDGD	
COc1ccc(Cl)c(NC(=O)NNC(=O)c2cnn3c2C[C@H](CNC(C)=O)CC3)c1	802116993	VZYPDUZNXSFZEL-GFCCVEGCSA-N	434.884	1.710	50	20	IDGD	
COc1ccccc1[C@]1(C)NC(=O)N(CC(=O)NNc2ccc3c(=O)[nH]ccc3c2)C1=O	803428659	CJKXJUKLRQPBDE-QFIPXVFZSA-N	435.440	1.447	50	20	IDGD	
COc1ccc(CN2CC[C@H](NC(=O)NNC(=O)c3cccc(C#N)c3)C2=O)c(OC)c1	805067648	YDUAAUYLHOYTLH-SFHVURJKSA-N	437.456	1.321	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)Nc2ccc(F)c(S(=O)(=O)NC)c2)cc1OC	806546838	YCAPMVZQLYTDSV-UHFFFAOYSA-N	440.453	1.608	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)[C@@H]2CCCN2C(=O)C(F)(F)F)c1	806786176	ZCOASCQIJXUBDI-NSHDSACASA-N	438.200	1.772	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2nc(C3CCOCC3)cs2)cc1C	806973285	IMXIYCCIDFFWHX-UHFFFAOYSA-N	432.502	1.819	50	20	IDGD	
COc1cc(F)cc(NNC(=O)C(=O)N2C[C@H](C[C@H]3COCC(=O)N3)c3ccccc32)c1	807025811	WKETWBRJIFXZDN-BBRMVZONSA-N	442.447	1.313	50	20	IDGD	
NS(=O)(=O)c1ccccc1CNC(=O)NNC(=O)c1ccc(COc2ccccc2)o1	807604921	NGBDCELEBSSYSC-UHFFFAOYSA-N	444.469	1.650	50	20	IDGD	
CCCCn1nc(C(=O)NN=Cc2ccc(F)c(S(N)(=O)=O)c2)c2ccccc2c1=O	807952403	MEAHBFUOGLMFLB-UHFFFAOYSA-N	445.476	1.747	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNS(=O)(=O)c1cc(Br)cc2cccnc12	808094719	YMAODAPSTQQJMI-UHFFFAOYSA-N	443.323	1.612	50	20	IDGD	
NC(=O)c1ccc(OCC(F)F)c(NC(=O)C(=O)NNc2ccc3c(=O)[nH]ccc3c2)c1	810411734	UHTFXABMGHBIDF-UHFFFAOYSA-N	445.382	1.353	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CNC2(Cc3ccc(F)cc3)CCOCC2)cc1OC	815131382	ZSFJKXBACKUPOO-UHFFFAOYSA-N	445.491	1.985	50	20	IDGD	
CNC(=O)Oc1cccc(NC(=O)C(=O)NNC(=O)c2ccccc2Br)c1	815563752	MWUIYEVFTXPHBA-UHFFFAOYSA-N	435.234	1.567	50	20	IDGD	
CCOc1ccc(OCc2ccc(C(=O)NNC(=O)C(=O)Nc3ncn(C)n3)cc2)cc1	815564272	DRYFHOOBIUESCP-UHFFFAOYSA-N	438.444	1.193	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1cccc(NC(=O)C(=O)NNc2cccc(Cl)n2)c1	815726965	BXNALZHPZKXPJS-UHFFFAOYSA-N	425.898	1.894	50	20	IDGD	
CS(=O)(=O)Nc1cccc(CNC(=O)NNC(=O)c2cc(Br)c[nH]2)c1	840461130	DOIWQTSLZNYAIW-UHFFFAOYSA-N	430.284	1.293	50	20	IDGD	
Cc1cccc(C(=O)NNC(=S)Nc2ccc(S(=O)(=O)N3CCOCC3)cc2)n1	887573042	MRYCHEPKTUJLTJ-UHFFFAOYSA-N	435.531	1.042	50	20	IDGD	
O=C(CSCc1cc(=O)n2ccsc2n1)NNC(=O)c1cc(-c2ccccc2)[nH]n1	896743429	URZFSQSIZGKQIP-UHFFFAOYSA-N	440.510	1.841	50	20	IDGD	
CCOc1ccc(C(=O)NNS(=O)(=O)c2cccc(S(C)(=O)=O)c2)cc1OC	903951885	IJMDQOHHBBIIHF-UHFFFAOYSA-N	428.488	1.121	50	20	IDGD	
NC(=O)CC[C@@H](NC(=O)OCc1ccccc1)C(=O)NNC(=O)c1ccc(Cl)cc1	913110588	OXUZAEKQASKZJI-MRXNPFEDSA-N	432.864	1.662	50	20	IDGD	
CCOC(=O)NNC(=O)CS[C@@H](C)C(=O)Nc1c(C)n(C)n(-c2ccccc2)c1=O	913180645	TYMRNUJHYPAKHR-ZDUSSCGKSA-N	435.506	1.322	50	20	IDGD	
CCOc1ccc(OCc2ccc(C(=O)NNC(=O)CC[C@@H]3NC(=O)NC3=O)cc2)cc1	913422765	ZBSKSGVDZIXWIS-SFHVURJKSA-N	440.456	1.414	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)NCC(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)cc1	913489427	PJITWDWXVMWYHH-UHFFFAOYSA-N	433.530	1.531	50	20	IDGD	
Cc1ccc(C(=O)NCCNC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc1F	914536335	SWLGZCOBYBWIEV-UHFFFAOYSA-N	440.435	1.399	50	20	IDGD	
O=C(CCNS(=O)(=O)c1cccnc1)NNC(=O)CSc1ccc(Cl)cc1	914829577	AVJQVTJDVAYNPQ-UHFFFAOYSA-N	428.923	1.343	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)c2cc(S(=O)(=O)N3CCCCC3)cn2C)cc1	914846283	FGYHVWMWYAUBGQ-UHFFFAOYSA-N	434.518	1.348	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)CNS(=O)(=O)c1cccs1	915188673	JVVKTAZSXDLQMA-ZDUSSCGKSA-N	433.511	1.795	50	20	IDGD	
O=C(NNC(=O)c1cc(S(=O)(=O)Nc2ccccc2F)c[nH]1)c1cccc([N+](=O)[O-])c1	916093146	JBBLEPGHZPIOFF-UHFFFAOYSA-N	447.404	1.938	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NCC1(NS(C)(=O)=O)CCCCC1	916253763	KHJCWOAVYJHIGK-ZDUSSCGKSA-N	430.502	1.176	50	20	IDGD	
CS(=O)(=O)NCCNC(=O)NNC(=O)c1ccc(COc2ccc(Cl)cc2)cc1	916294974	XEEOLLJGJOMUQD-UHFFFAOYSA-N	440.909	1.412	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NCCN2CCN(c3ccc(F)cc3)CC2)cc1C	916513603	GOSRGTKMPGMHKD-UHFFFAOYSA-N	443.523	1.974	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)N[C@H]1CCN2CCC[C@@H]2C1	916572897	FTCUZWUQYXSHNO-DLBZAZTESA-N	435.550	1.042	50	20	IDGD	
CC(C)(C)OC(=O)N(CCCNC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)C1CC1	916631195	IZXIZOSJYLQOSZ-UHFFFAOYSA-N	444.496	1.396	50	20	IDGD	
COc1cc(CNC(=O)NNC(=O)CC23CC4CC(CC(C4)C2)C3)ccc1OCC(N)=O	916640228	AQYOXPKWKCESBJ-UHFFFAOYSA-N	444.532	1.996	50	20	IDGD	
Cc1cccc(-n2nnc(C(=O)NNC(=O)c3sc(N4CCOCC4)nc3C)c2C)c1	917391947	PLLSFHCXWYPYDI-UHFFFAOYSA-N	441.517	1.560	50	20	IDGD	
Cc1nn2c(=O)c3ccccc3[nH]c2c1C=NNC(=O)c1csc(N2CCOCC2)n1	918710032	CPMBIKSYLRRXNH-UHFFFAOYSA-N	437.485	1.541	50	20	IDGD	
Cc1ccccc1-n1ncc(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)c1C(F)(F)F	919886701	UCTIPPCOKLGOGO-LLVKDONJSA-N	445.423	1.331	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)[C@H](Cc2cccc(F)c2)n2nnnc2C)cc1	920012545	UIACZLQYVJEUOL-IBGZPJMESA-N	426.452	1.693	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)Nc2cccnc2N2CCCC2)ccc1Cl	920417845	XUJDABNEJDAIHK-UHFFFAOYSA-N	438.897	1.449	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)Nc2cccc(CN3C(=O)CNC3=O)c2)cc1	920940678	UGJGQDXJMXOADL-UHFFFAOYSA-N	425.445	1.533	50	20	IDGD	
O=C(NCCCS(=O)(=O)c1ccccc1)NNC(=O)c1cc(Br)c[nH]1	921248278	UIQFAFQYZQOZCE-UHFFFAOYSA-N	429.296	1.585	50	20	IDGD	
Cc1nnc(CNC(=O)NNC(=O)[C@H]2Cc3ccccc3CN2Cc2ccccc2)n1C	1116012080	YQBUIQNRCDCSQT-HXUWFJFHSA-N	433.516	1.581	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@@H]2CCCCN2Cc2cccnc2)cc(OC)c1OC	1116024950	GGJZMJXFOSIURJ-KRWDZBQOSA-N	428.489	1.923	50	20	IDGD	
COc1cc(C=O)ccc1OCC(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1	1116083961	CUHBTVURUIZCSX-UHFFFAOYSA-N	435.477	1.681	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N2CC[C@](O)(C3CC3)C2)cc1	1321375934	NGFHOHGGBQVFQQ-HQXWMUDFSA-N	449.511	1.714	50	20	IDGD	
O=C(NNC(=O)N1CCO[C@H](c2ccc(Cl)s2)C1)c1ccc(-n2cnnn2)cc1	1323381033	YMKIUXRJRZIRIP-ZDUSSCGKSA-N	433.881	1.805	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)c2cncn2-c2ccccc2)cc1C(=O)N(C)C	1328420220	LUGFGGQXUXZREL-UHFFFAOYSA-N	443.485	1.206	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(C)(C)C#N)C2	1778091745	PUUIGGOOLJHIFV-ZZLSVPGXSA-N	442.520	1.184	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)/C=C3\C(=O)Nc4ccccc43)C2)C1	1778910029	YIPWUBCVKCUCDY-UPJOISEZSA-N	448.317	1.635	50	20	IDGD	
CN(CC(=O)N1CCO[C@@]2(CCN(C(=O)CO[Si](C)(C)C)C2)C1)C(=O)OC(C)(C)C	1779296417	ROOLAMMIEWRUTM-HXUWFJFHSA-N	443.617	1.535	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cccc(C(F)(F)F)n3)C2)C1	1779514391	CPTMTPDJZTWVOZ-SJKOYZFVSA-N	435.830	1.798	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(C(C)(C)C)n[nH]3)C2)C1	1779574476	FLTQTBYADXFTGU-XIKOKIGWSA-N	427.343	1.934	50	20	IDGD	
CC(=O)N/C(C)=C/C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CO[Si](C)(C)C)C2	1781462370	OJMXDJBKNGUZGU-IFPCECNESA-N	425.602	1.392	50	20	IDGD	
COc1cccc(/C=C/C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](O)CCl)C3)c1	1781943097	UHEAYKAJQUVSKI-YAUVMHPCSA-N	436.936	1.822	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)Cc1ccccc1)C2	1782178599	BHUFFJOITROGKJ-VQQMMKBISA-N	438.952	1.358	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H]2CCCN2C(C)C)C1	1782766962	FKPSPNPVLOCDIE-LXGFNABISA-N	429.989	1.627	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cc4n(n3)CCCC4)CCO2)C1	1783349691	RFOFZEVTVPZKKQ-KXBFYZLASA-N	439.354	1.836	50	20	IDGD	
Cc1nc2sccn2c1C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](C)Br)C2)C1	1783534543	VXUTYBRKLOIASY-PIGZYNQJSA-N	441.351	1.931	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]3C2)nn1	1783970554	WKMGJYNECRWJMS-ABHRYQDASA-N	441.326	1.110	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3CC(=O)N(C4CCCC4)C3)[C@H]2C1	1784967638	DAXRDROMQGOILL-FQQAFBJJSA-N	439.984	1.775	50	20	IDGD	
CC(=O)Nc1ccccc1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2	1785100825	SOADLXNBWVSWSI-BFUOFWGJSA-N	438.322	1.872	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3cncnc3)[C@H]2C1	1787041249	LDAWTBPBSGHMOY-IWCQGFGOSA-N	439.354	1.420	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)c1cn2cccnc2n1	1788309428	NMFDLMZSQRLQKR-YDHLFZDLSA-N	436.310	1.108	50	20	IDGD	
CCOC(=O)c1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](Cl)CC)[C@H]3C2)ccn1	1789862047	WVECTUPZJLLOHH-CUSZFKRNSA-N	437.924	1.869	50	20	IDGD	
CCOC(=O)C1(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]3C2)CC1	1789872676	YGMGVKBONMTXMU-WZTLGTBRSA-N	435.348	1.546	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4cn[nH]c4cn3)C[C@@H]21)[C@@H](F)Br	1789925755	IVQPQYMRXIBSCI-LHAJWOIZSA-N	440.273	1.242	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(OC)cc3F)C[C@@H]21	1791256600	CVYQRZSFSSUAAL-RPZXMPESSA-N	428.888	1.681	50	20	IDGD	
Cc1cc(CC(=O)Nc2ccc(C3(NC(=O)c4cnccc4C(=O)NN)CCC3)cc2)no1	1791806167	VHIIDDGHFQWWCI-UHFFFAOYSA-N	448.483	1.972	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CC1CCN(C)CC1	1792682765	CFRARGUXDSADJV-JAEJZPAFSA-N	442.564	1.491	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1CCc2ccccc2[C@@H]1O	1793182795	HYKLXJXNKATQSX-KXDCAWOKSA-N	442.560	1.294	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc[nH]n1	1793507577	QXVVIUBMKQXBNH-ODLYAQKHSA-N	427.411	1.498	50	20	IDGD	
Cc1ccn2ncc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@@H](C)Br)C4)c2c1	1796272075	BBVXJPFBSBQDHN-VWPFQQQWSA-N	435.322	1.629	50	20	IDGD	
CC(C)(C)OC(=O)N1CCO[C@H](C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](F)Cl)C1	1796805087	YUGMNISGNLSEMO-AIEDFZFUSA-N	433.908	1.795	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1=NO[C@H](c2ccccc2)C1	1797179207	NWFPQBFDAGVKOQ-NZKYLMMGSA-N	435.908	1.347	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1n[nH]c2ccc(F)cc12	1797480873	LMDQXMSVTLMZFZ-YPSFTXJRSA-N	443.248	1.596	50	20	IDGD	
Cc1ccn2ncc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3cnccc3C(=O)NN)c2c1	1798440492	XPSKRUFFGRLQII-MUJYYYPQSA-N	447.499	1.207	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COc1ccc(F)cc1)C2)[C@@H](F)Br	1799347709	PCWLIMIZUBDING-OXUXUCFPSA-N	433.249	1.485	50	20	IDGD	
O=C1COc2ccc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)[C@@H](F)Br)cc2N1	1800158484	NNINZLNZRCSILR-AZKPJATDSA-N	440.269	1.960	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(C3CC3)on1)C2	1800637772	ICKDHQCLFMVCLQ-OQMKEHIESA-N	426.311	1.929	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ncc(F)cc1F)C2	1800640066	JMEYSPQKYPBXSB-IQOUGMIPSA-N	432.265	1.737	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cccc(Cl)n1)C2	1800758479	ZXZRLZGCMCWLAT-LSSIXWDNSA-N	430.730	1.651	50	20	IDGD	
COC(=O)[C@H]1CCC[C@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCBr)C3)C1	1800961915	DVGGJRHIASEMGB-JGFGOLAASA-N	445.354	1.340	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(CO)c(F)c1	1801898818	JJDKVEWLBDCZKF-RMIITELYSA-N	443.313	1.552	50	20	IDGD	
CN(C)C(=O)c1cccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)C(C)(C)CCl)C3)c1	1801912550	LXZHJUORYUYUQI-BCDXTJNWSA-N	435.952	1.857	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnccc1C(F)(F)F)C2	1802333379	QHAUHFRPKOWLPK-BTTYYORXSA-N	441.454	1.725	50	20	IDGD	
CO[C@H](C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN(C)NC(=O)NCc1ccccc1)C2	1802388603	FAKPAULFQKUBNW-OQIJWPOYSA-N	431.537	1.006	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cc3cccn3cn2)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803142783	JDBBZGJCEZBZGE-ZYSHUDEJSA-N	427.892	1.649	50	20	IDGD	
CC(=O)O[C@H](C(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)C(C)C	1803143075	STCZHUMDEYEIAG-XDNAFOTISA-N	425.913	1.275	50	20	IDGD	
CC(=O)NC(C)(C)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)Br)[C@@H]1c1cccnc1	1803598824	TWPZCCWIOBAKRU-UHOFOFEASA-N	439.354	1.786	50	20	IDGD	
CC1(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)CCCC1	1807365787	PFYDUSYAPCJMQW-FPOVZHCZSA-N	435.333	1.661	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)c1ccc2c[nH]nc2c1	1808049994	ZAXCERLPCXHXQW-YTQUADARSA-N	427.892	1.877	50	20	IDGD	
Cc1nn[nH]c1C(=O)N1CC[C@H](CNC(=O)[C@H](F)Br)[C@H]1c1cccnc1	1808662752	QYKBGFXKPJTSDX-BNOWGMLFSA-N	425.262	1.518	50	20	IDGD	
Cc1ccc(F)c(C(=O)N2CCC3(CCCN(C(=O)c4ccc(B(O)O)cc4)C3)CC2)c1	1809969968	XIWRCJTWCKMXHS-UHFFFAOYSA-N	438.308	1.973	50	20	IDGD	
Cc1ccc(C(=O)N2CCC3(CCCN(C(=O)c4ccc(B(O)O)cc4)C3)CC2)c(O)c1	1809973193	YWYNOAKWKLZIBK-UHFFFAOYSA-N	436.317	1.539	50	20	IDGD	
CCc1cc(C(=O)N2CCCC3(CCN(C(=O)c4cnccc4C(=O)NN)CC3)C2)n[nH]1	1810290120	JZWKGTMOCIZUPH-UHFFFAOYSA-N	439.520	1.129	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC2(CCCN(C(=O)c3nccc4occc34)C2)CC1	1810311127	ISBJDWQNQNHUSK-UHFFFAOYSA-N	447.300	1.666	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@@H]1c1cccnc1)c1cc(CO)on1	1811590952	AJLXYBUFDRMOTR-NILFDRSVSA-N	441.257	1.572	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)CS(C)(=O)=O)[C@@H]1c1cccnc1	1813028510	RLVDATHFAAPVLN-QSPRXWTASA-N	445.969	1.022	50	20	IDGD	
O=C1C[C@H](C(=O)NC[C@@H]2CCN(C(=O)[C@H](F)Br)[C@@H]2c2cccnc2)CCN1	1813136423	UZVKDTZEJZISRD-JMGFVUJMSA-N	441.301	1.304	50	20	IDGD	
Cc1cccc(CC(=O)Nc2cc([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)n1	1814969408	RMWQWUXHERYRHO-HXUWFJFHSA-N	447.304	1.342	50	20	IDGD	
CCS(=O)(=O)N[C@@H](C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)C(C)(C)CCl)[nH]n1	1815164999	OLGYAXMZCQOPEW-GXTWGEPZSA-N	447.989	1.995	50	20	IDGD	
CN1N=C(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)CCBr)n[nH]2)CCC1=O	1816782161	PSQXFPOQUVALJA-CYBMUJFWSA-N	439.314	1.795	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)CCc2ccccn2)[nH]n1)c1ccc(B(O)O)cc1	1817470427	BETAYVJEGSXPHW-FQEVSTJZSA-N	447.304	1.423	50	20	IDGD	
Cc1ccc(CC(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)cn1	1817474059	KIZGRZREDGNWFH-HXUWFJFHSA-N	447.304	1.342	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(=O)n3[nH]nnc3n2)n[nH]1	1817812390	FPTRBBPXQYDNNM-GWCFXTLKSA-N	447.887	1.249	50	20	IDGD	
CCc1noc(C)c1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1	1819846596	YVGUKDOJEABYOQ-INIZCTEOSA-N	445.524	1.947	50	20	IDGD	
CC(=O)NC(C)(C)C(=O)N[C@H]1CCc2nc(NC(=O)CO[Si](C)(C)C)sc2C1	1820159980	CZWMWTQFHLGHTO-LBPRGKRZSA-N	426.615	1.821	50	20	IDGD	
CN(C)C(=O)NCC(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](F)Br)n[nH]1	1820934861	RCNGJMRDERPPEU-GXFFZTMASA-N	433.282	1.364	50	20	IDGD	
O=C(Cc1cncnc1)N[C@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1	1823001764	LQMFQRVFRYVLEV-ZANVPECISA-N	428.287	1.778	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H]2C[C@H](O)CN2)CC1	1824094181	HSURXHXAJOQWLE-HJWJTTGWSA-N	430.387	1.360	50	20	IDGD	
O=C(c1cscn1)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827056557	YCRGKKRWIYXWPW-LJQANCHMSA-N	427.335	1.370	50	20	IDGD	
C[C@]1(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cccc(B(O)O)c2)CC3)CC1(F)F	1828048079	VDCRWJSHKKCWDI-KPZWWZAWSA-N	435.261	1.094	50	20	IDGD	
CCOC(=O)N[C@H](O)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CCBr)CC1	1828758105	DXKHIMKMXRKUNG-GOEBONIOSA-N	448.358	1.456	50	20	IDGD	
CN(C)c1ncc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)o1	1830357936	IFEOZNXEKYHQDU-LJQANCHMSA-N	428.917	1.076	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3cccc(C#N)c3)CCO2)C1	1830461675	VZMANAANRWLPQY-KNQAVFIVSA-N	433.936	1.965	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(Cl)nn3)C2)C1	1831650123	DCIWEGXJNWCUQJ-UGSOOPFHSA-N	431.320	1.608	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2c[nH]c(=O)cn2)CC1	1831661391	QRKGBQYMXASIKL-SWLSCSKDSA-N	425.327	1.787	50	20	IDGD	
O=C(CN1CCCC1)NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1	1833101116	DFXLIQZDXJSNAG-KRWDZBQOSA-N	433.366	1.344	50	20	IDGD	
C[C@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)c3ccno3)CC2)CC1	1833262304	MYJOAJNKTFZIJM-CYBMUJFWSA-N	427.343	1.891	50	20	IDGD	
CN(C)c1cncc(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](F)Cl)CC3)CC2)c1	1833931499	QJVHNYBMDKOGAF-GOSISDBHSA-N	425.936	1.867	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(Cl)s3)CCO2)C1	1834059309	UIHANLNILAKOMU-SJCJKPOMSA-N	437.345	1.725	50	20	IDGD	
O=C(CCBr)NC1CCN(C2CCN(C(=O)Cc3cccnc3)CC2)CC1	1834421874	QLGVMNWHSXHHJH-UHFFFAOYSA-N	437.382	1.981	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)Cc3cscn3)CC2)CC1	1834841136	UWJPZBVNNBOLEO-KRWDZBQOSA-N	428.986	1.511	50	20	IDGD	
CCc1[nH]nc(C(=O)N2CCO[C@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)c1Cl	1836231932	BWFAEQLLYNYGSC-MRXNPFEDSA-N	439.727	1.499	50	20	IDGD	
COc1cc(C(=O)N2CCC(OC3CCN(C(=O)[C@H](O)CCl)CC3)CC2)ccn1	1836718452	OSLCXCBEARXEGG-QGZVFWFLSA-N	425.913	1.302	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cn4ccsc4n3)CCO2)C1	1837049116	PSZMBTZWOAYKKT-ACJLOTCBSA-N	426.926	1.483	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)c3cncn3C)CC2)CC1	1837515338	XUFBPYFSQGZOSB-ZDUSSCGKSA-N	427.343	1.816	50	20	IDGD	
CC(C)N[C@@H](C(=O)N1CCOC[C@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1)C(C)C	1837711887	VZCZUAMCJAIIFK-CTNGQTDRSA-N	443.661	1.317	50	20	IDGD	
COc1ccsc1C(=O)N1CCO[C@@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1	1838294419	ATKRSHDFYBYYFC-LJQANCHMSA-N	442.610	1.678	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)c(C)n1C	1838385195	DUPBKNCRHHPIJA-OAQYLSRUSA-N	437.613	1.563	50	20	IDGD	
C=CCC(F)(F)C(=O)N1CCC(OC2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1	1838756934	FDIGQZJTQHDGTB-UHFFFAOYSA-N	444.523	1.569	50	20	IDGD	
CC(C)c1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)n[nH]1	1839153954	WTGRXRXHAGIEPQ-MOPGFXCFSA-N	447.363	1.839	50	20	IDGD	
CN1CCC[C@H](C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)C1	1839154282	JEHSDCJYCKDNPH-IPELMVKDSA-N	436.380	1.021	50	20	IDGD	
Cc1ccc(F)cc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839197236	NPBQHRIGMJTJGS-QAPCUYQASA-N	447.276	1.895	50	20	IDGD	
C=CCC(F)(F)C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](F)Br)CCO2)C1	1839202670	MLSSTLQMCZDYRN-FZMZJTMJSA-N	429.233	1.345	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)cc2c[nH]nc12	1839512241	RYXFHQLTIGDUMA-LJQANCHMSA-N	441.315	1.745	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3c[nH]cc3C)C2)C1	1839964081	FVBAAQHZWMSPDR-CRAIPNDOSA-N	428.327	1.567	50	20	IDGD	
CC(C)c1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)no1	1840031422	PNEAQYWWDBXOEI-FZKQIMNGSA-N	444.326	1.651	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)c3ccccc3)C2)C1	1840150264	HXPBZIUBJIOOIP-ABSDTBQOSA-N	428.888	1.407	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(C)ccc3O)C2)C1	1840154296	RITSLCYELFYYFS-UZLBHIALSA-N	426.897	1.024	50	20	IDGD	
O=C(C(Cl)Cl)N1CCO[C@]2(COCCN(C(=O)C3(c4ccc(O)cc4)CC3)C2)C1	1840186272	DZZNCCVXPGFNOM-LJQANCHMSA-N	443.327	1.684	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2c(Cl)cncc2Cl)C1	1840996982	CYJKXSUVLUMUDG-UHFFFAOYSA-N	449.298	1.518	50	20	IDGD	
O=C(c1cn2c(C(F)(F)F)cccc2n1)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1	1841353191	JRISQHDIJKKWAA-LBPRGKRZSA-N	430.814	1.770	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@]1(O)CCN(C(=O)OC(C)(C)C)C1)C2	1841670635	JIUFNWHTKRJELI-BTYIYWSLSA-N	443.972	1.969	50	20	IDGD	
CCSc1ncccc1C(=O)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843009876	RNFPLZAVZVXPEY-UHFFFAOYSA-N	425.319	1.004	50	20	IDGD	
Cn1c(=O)n(CC(=O)N2CC3(CCCN3C(=O)CO[Si](C)(C)C)C2)c2ccccc21	1844378217	RWLMTEPORGCXCZ-UHFFFAOYSA-N	430.581	1.395	50	20	IDGD	
Cc1cc(C(=O)N2CC3(CCCN3C(=O)C(Cl)Cl)C2)n(-c2cccc(=O)n2C)n1	1846387269	CSURRBOUIKZYGC-UHFFFAOYSA-N	438.315	1.500	50	20	IDGD	
CC(=O)Nc1ccc(Cl)c(C(=O)N2CCCC23CN(C(=O)CCC(=O)NN(C)C)C3)c1	1846917522	COUGUBNNTMPCJZ-UHFFFAOYSA-N	449.939	1.488	50	20	IDGD	
O=C(c1cnn2c(-c3ccsc3)ccnc12)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl	1847560616	XSRUIPGXBNFQQZ-ULQDDVLXSA-N	445.932	1.873	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)[C@@H]1CC(=O)N(c2ccc3c(c2)OCCO3)C1	3523921	DKVOKNOXBNEXAP-CYBMUJFWSA-N	429.404	1.176	50	20	IDGD	
O=C(/C=C/c1ccc(I)o1)NNC(=O)[C@H]1COc2ccccc2O1	15795310	QHWGFNQFLWPLPO-STMXVASLSA-N	440.193	1.885	50	20	IDGD	
O=C(CN1CCN(CC(=O)NNC(=O)c2ccccc2Cl)CC1)NCc1ccccc1	22820683	QONPVNFVHLZYKY-UHFFFAOYSA-N	443.935	1.035	50	20	IDGD	
O=C(NNC(=O)c1sccc1S(=O)(=O)N1CCCC1)c1cc(Br)c[nH]1	25321942	NHYGSKNJGXGCBV-UHFFFAOYSA-N	447.336	1.698	50	20	IDGD	
C#CCNS(=O)(=O)c1cccc(C(=O)NNC(=S)Nc2ccc(OCC)cc2)c1	28633693	ZXXARCBUTUUYKY-UHFFFAOYSA-N	432.527	1.628	50	20	IDGD	
CC[S@@](=O)c1ccccc1C(=O)OCC(=O)NNC(=O)c1ccc(OC)c(OC)c1	104847780	IBMVMTPMIGBOBW-PMERELPUSA-N	434.470	1.449	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)N2CCN(CC(=O)N3CCCC3)CC2)c1C	302912223	OZULKQVDSRMXJW-QNGOZBTKSA-N	427.549	1.425	50	20	IDGD	
Cc1ccc(-c2nc(CCNC(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)co2)cc1	726711401	FGFQNPVXBADBPD-UHFFFAOYSA-N	432.444	1.812	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NN=Cc2ccc(N3CCOCC3)c(F)c2)cc1	727253486	GEPXRGJOMISIDO-UHFFFAOYSA-N	448.520	1.742	50	20	IDGD	
CNS(=O)(=O)c1cccc([C@H](C)NC(=O)NNC(=O)c2ccc(Cl)cc2OC)c1	727608389	QAAFTNAXDLNGEE-NSHDSACASA-N	440.909	1.962	50	20	IDGD	
COC(=O)NC(C)(C)C(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	729309361	WPVBCUCLOVCICP-UHFFFAOYSA-N	437.460	1.284	50	20	IDGD	
CCC[C@@H](C)NS(=O)(=O)c1cc(C(=O)NNC(=O)c2cnn[nH]2)c(Cl)cc1Cl	729455955	ILVUSXZNKKLCMR-MRVPVSSYSA-N	449.320	1.653	50	20	IDGD	
N#Cc1ccc(-c2ccc(OCC(=O)NNC(=O)c3ccc4c(c3)C(=O)NC4=O)cc2)cc1	729511427	PMXFMMJLRQDHND-UHFFFAOYSA-N	440.415	1.949	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)c2cc(S(=O)(=O)NC3CC3)ccc2C)cn1	729692077	JJYRRVIHYXSJOW-UHFFFAOYSA-N	435.531	1.471	50	20	IDGD	
COC(=O)c1cc(NC(=O)NNC(=O)c2ccc(OC)cc2OC)cc(C(=O)OC)c1	730017914	QOQSPKOORYSYTB-UHFFFAOYSA-N	431.401	1.744	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)N[C@H](C)CN2CCN(C)CC2)c1	730131085	OAPBFPZLLCZPNX-GFCCVEGCSA-N	428.331	1.038	50	20	IDGD	
CC(C)(C)C(=O)N1CSC[C@H]1C(=O)OCC(=O)NNC(=O)c1cccc(Cl)c1	730322919	NBXNKJRBBDXSMF-ZDUSSCGKSA-N	427.910	1.592	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)[C@@H]2CCCN(S(=O)(=O)Cc3ccccc3)C2)c1	730511689	BPZOJEZPLKJIAH-LJQANCHMSA-N	445.541	1.763	50	20	IDGD	
O=C(COc1ccccc1O)NNS(=O)(=O)c1cc(Br)cnc1Cl	730812365	PJXPTPLGFSSEEN-UHFFFAOYSA-N	436.671	1.592	50	20	IDGD	
O=C(NNC(=O)c1sccc1S(=O)(=O)C(F)F)c1cc(Br)c[nH]1	730999325	SDHRBIWFOKYMIM-UHFFFAOYSA-N	428.236	1.910	50	20	IDGD	
COc1ccc([C@@]2(C)NC(=O)N(CC(=O)NNC(=O)C(C)(C)c3ccccc3)C2=O)cc1	731174617	KQZAZUUPMHLNEY-HSZRJFAPSA-N	438.484	1.587	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1	732302647	MCJGLKIOTZDSPI-GFCCVEGCSA-N	438.487	1.808	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)C[C@H]2CCc3ccccc3C2)cc1	732548644	JEEZSYRFTFOTSC-KRWDZBQOSA-N	429.542	1.958	50	20	IDGD	
N#Cc1ccc(N2C(=O)N[C@@H](CCC(=O)NNC(=O)c3cccc4cccnc34)C2=O)cc1	733776567	LWIUMVOCXQPGDH-SFHVURJKSA-N	442.435	1.773	50	20	IDGD	
O=C(NCCN1C(=O)CCC1=O)NNC(=O)c1cc(-c2ccccc2)nc2ccccc12	733849286	ZORJTUZUTZOKGB-UHFFFAOYSA-N	431.452	1.995	50	20	IDGD	
Cc1ccc2nc(CSCC(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)cn2c1	734123395	MWIZALLJNOSJFY-UHFFFAOYSA-N	432.527	1.741	50	20	IDGD	
O=C(NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12)N[C@H]1CCN(C2CC2)C1	734285310	IVPDHUAGLRIBBG-KRWDZBQOSA-N	446.511	1.626	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H]2CCCN(c3cccc(F)c3)C2)c1	734949601	CMRHWYBRKXTLOW-MRXNPFEDSA-N	434.493	1.842	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)cc1	739679411	XZKPXUKUKIFDQQ-UHFFFAOYSA-N	448.501	1.649	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)CCCN(C)C1=NS(=O)(=O)c2ccccc21	741926466	UNSSCTPMCBSCKK-UHFFFAOYSA-N	430.486	1.317	50	20	IDGD	
Cn1c(=O)c2cc(C(=O)NNc3c(F)cc(F)cc3Br)cnc2n(C)c1=O	741978000	YSGSIGGOISUEAI-UHFFFAOYSA-N	440.204	1.430	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)[C@H](c1ccccc1F)N1CCOCC1	742677027	MVLJGUUWMNSHFI-INIZCTEOSA-N	439.488	1.054	50	20	IDGD	
O=C(O)COc1ccc(C=NNC(=O)Cc2cc(O)nc(S)n2)cc1Br	743434124	SGGHMNHHDGZYRE-UHFFFAOYSA-N	441.263	1.390	50	20	IDGD	
COc1ccc([C@]2(C)NC(=O)N(CC(=O)NNc3oc(C(C)C)nc3C#N)C2=O)cc1	746335539	PSNNAZIDIRGCJG-FQEVSTJZSA-N	426.433	1.589	50	20	IDGD	
Cc1ccc(NC(=O)[C@H]2CCCN(CC(=O)NNC(=O)Cc3nc(C)cs3)C2)nc1	746456726	FDYJXLDKENANKK-HNNXBMFYSA-N	430.534	1.196	50	20	IDGD	
C[C@@H](CN(C)C(=O)OC(C)(C)C)C(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	747523399	IYOROEHUQTWGKV-LBPRGKRZSA-N	428.511	1.746	50	20	IDGD	
Cc1cc(Br)ccc1C(=O)N1CCC[C@H](C(=O)NNc2nccn(C)c2=O)C1	747938344	RTTIRIYNYZCYNS-ZDUSSCGKSA-N	448.321	1.847	50	20	IDGD	
Cc1c(C(=O)NNC(=O)Cc2ccc3ccccc3c2)cnc2c1c(=O)n(C)c(=O)n2C	748058203	BKWYZZPPWCOVMI-UHFFFAOYSA-N	431.452	1.098	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)c1ccc(S(N)(=O)=O)c(Br)c1	748068917	UNYBYRPELAGJBE-UHFFFAOYSA-N	442.291	1.109	50	20	IDGD	
COc1ccc(C[C@H](NC(=O)NNC(=O)C(=O)N2CCCC2)c2ccc(OC)cc2)cc1	748446247	IFFZVRPFCIKAGM-FQEVSTJZSA-N	440.500	1.940	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(OCC(=O)NNC(=O)c2ccc(Br)s2)C1	748517615	ZVLAZPAJPQVVJY-UHFFFAOYSA-N	434.312	1.908	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCC(CNC(=O)OC(C)(C)C)CC2)n1	748808817	SHMULMBLAZJMQL-UHFFFAOYSA-N	425.555	1.378	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)CNS(=O)(=O)c1ccc(Cl)s1	749842951	OMTURJTXGDYDJX-UHFFFAOYSA-N	438.314	1.803	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)C[C@@H](O)c2ccc(Cl)cc2)cc1OC	750370288	BIQTZJVSASTMTQ-OAHLLOKOSA-N	436.848	1.785	50	20	IDGD	
CCOC(=O)[C@@H]1Cc2cc(S(=O)(=O)NNC(=O)c3cccc4ncccc34)ccc2O1	751547525	KRXYIKZTUVWFHR-IBGZPJMESA-N	441.465	1.725	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)Nc1cc(S(=O)(=O)N2CCCCC2)ccc1C	755393026	PNFPCFWREASBGY-HNNXBMFYSA-N	442.538	1.374	50	20	IDGD	
CN(C)C(=O)c1ccc(NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1	755446280	QKCDNVQBPWYHRE-UHFFFAOYSA-N	438.532	1.753	50	20	IDGD	
CN(C)C(=O)COc1ccc(NC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc1	755644850	BDCIELXDLVCQQH-UHFFFAOYSA-N	438.444	1.511	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1cccc(C(=O)Nc2cccc(F)c2)c1	756090111	ZINJQCPVPYQRJK-LLVKDONJSA-N	437.453	1.168	50	20	IDGD	
CCCS(=O)(=O)Nc1cccc(NC(=O)NNC(=O)c2cncc(NC(C)=O)c2)c1C	756434295	LBTLZNVKDWDCHV-UHFFFAOYSA-N	448.505	1.967	50	20	IDGD	
CC(C)CSCCCNC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	756748119	GALUEBCYOLFHQJ-UHFFFAOYSA-N	444.627	1.423	50	20	IDGD	
CCOC(=O)[C@@H](C)NC(=O)c1ccc(NC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1	756790209	NLYKBPRCMSMGMJ-GFCCVEGCSA-N	443.416	1.743	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)Nc2cnn(CCN3CCOCC3)c2)c1C	756826490	GMBFVOHVALOPRJ-KRWDZBQOSA-N	430.509	1.452	50	20	IDGD	
COc1ccc(C(=O)Nc2ccc(C(=O)NNC(=O)CNC(=O)c3ccco3)s2)cc1	757633416	SIKWPIAZPOJOAN-UHFFFAOYSA-N	442.453	1.793	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)Nc2ccccc2N(C)S(C)(=O)=O)cc1	757661622	OILITFZARQVZKC-AWEZNQCLSA-N	448.501	1.905	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)N[C@@H]2CCN(c3ncccc3Cl)C2)cc1C	757761570	FSAQRSXBTNBJCK-OAHLLOKOSA-N	430.896	1.900	50	20	IDGD	
O=C(c1csc(-c2cnccn2)n1)N1CCN(S(=O)(=O)CBr)CC1	758527401	KANFPQDTVBLHCU-UHFFFAOYSA-N	432.325	1.040	50	20	IDGD	
COc1cc(C(=O)NNC(=O)N[C@H]2CCCS(=O)(=O)C2)ccc1OCCC(C)C	758649310	MRAPSNZGLKAXRN-HNNXBMFYSA-N	427.523	1.641	50	20	IDGD	
COC(=O)c1cc(NC(=O)/C(C#N)=C/c2cc(C#N)n(C)c2C)cc(S(C)(=O)=O)c1	758846319	MMURKWOJOWZRMY-PJQLUOCWSA-N	426.454	1.941	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)[C@@H]2CC(=O)N(c3cccc(C)c3C)C2)n1	759922646	XQDTYSWRULNXGA-OAHLLOKOSA-N	444.513	1.355	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)CCC(=O)N1CCN(c2ccccc2)CC1	760451873	ZMCCZLGUKXHBNO-UHFFFAOYSA-N	447.536	1.178	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)c2ccc3c(c2)SC2=NS(=O)(=O)CCN23)nc1	760785586	OFFBSZIZPVNMEJ-UHFFFAOYSA-N	433.471	1.237	50	20	IDGD	
CCC(=O)c1cccc(S(=O)(=O)N2CCN(S(=O)(=O)CBr)CC2)c1	763205949	IDEUUWHTDVSDKG-UHFFFAOYSA-N	439.353	1.268	50	20	IDGD	
O=C(NNC(=O)c1ccccc1)C(=O)Nc1cc(N2CCCS2(=O)=O)ccc1Cl	763424858	DQRSUAFARATVPS-UHFFFAOYSA-N	436.877	1.280	50	20	IDGD	
CN1C(=O)c2ccc(NC(=O)C(=O)NNC(=O)c3cc4ccccc4cc3O)cc2C1=O	763522790	QRZMZFYYWHGXIP-UHFFFAOYSA-N	432.392	1.171	50	20	IDGD	
COCCOc1ccc(C#N)cc1NC(=O)C(=O)NNC(=O)c1ccc(OC)c(OC)c1	763551886	SQHHRSAPJAOQMH-UHFFFAOYSA-N	442.428	1.000	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2cccc(CS(C)(=O)=O)c2)c1	763645362	UWZSMBULFWTJHE-UHFFFAOYSA-N	433.486	1.013	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)C(=O)Nc1ccc(Br)cc1F	763678722	ICXNYCUBAOVGAE-UHFFFAOYSA-N	428.189	1.892	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cc(F)cc(N3CCOCC3)c2)cc1C	763679256	JMHXCDDGWAHDEX-UHFFFAOYSA-N	444.463	1.444	50	20	IDGD	
CS(=O)(=O)c1c(Cl)cccc1NC(=O)C(=O)NNC(=O)COc1ccccc1F	763680941	CSJWEURLXXNCGV-UHFFFAOYSA-N	443.840	1.048	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cc(F)cc(N3CCOCC3)c2)cc1	763820423	HDTKAAQFBZZMCI-UHFFFAOYSA-N	430.436	1.136	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)n1	763853094	HGVZOLGNJXAUFX-UHFFFAOYSA-N	444.429	1.092	50	20	IDGD	
CC(=O)N1CCCc2cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc3ccc(F)cc3)ccc21	763866681	QUOZBMXXIMGBOJ-ZDUSSCGKSA-N	442.447	1.678	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccnn2-c2ccccc2)cc1	763877432	JJVRKWCIVYEUIZ-HNNXBMFYSA-N	435.440	1.628	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)C(=O)N1CC2(CCC2)c2c(F)cccc21	763916598	HKIJCQRBWMRYTP-UHFFFAOYSA-N	435.419	1.031	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)C(=O)Nc1cnn(Cc2ccccc2)c1	763950129	SZYWOJIRXIRGOV-UHFFFAOYSA-N	445.439	1.222	50	20	IDGD	
CC(C)(C)NC(=O)c1ccccc1NC(=O)C(=O)NNC(=O)c1cc(Cl)ccc1O	763974529	RUHLQSUNYCWIMX-UHFFFAOYSA-N	432.864	1.974	50	20	IDGD	
CN(C)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)cc1Cl	763977253	LMMICVVBHWUIKJ-UHFFFAOYSA-N	439.255	1.801	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1cc2c(cc1[N+](=O)[O-])OCCCO2	764040366	GMDRCTBLTUTUMB-UHFFFAOYSA-N	430.373	1.164	50	20	IDGD	
CC[C@H](C)C(=O)NNC(=O)C(=O)Nc1ccnn1Cc1ccc(OC(F)(F)F)cc1	764082375	MTDLMIMYJNRMKE-NSHDSACASA-N	427.383	1.962	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2cccc(N3CCCCC3=O)c2)cc1	764125763	BABBHIMSNPTXMT-UHFFFAOYSA-N	438.484	1.931	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1cccnc1OCc1ccccc1	764136031	LWTREIMTRCVBGF-UHFFFAOYSA-N	434.452	1.998	50	20	IDGD	
CC(C)(C)OC(=O)c1ccccc1NC(=O)C(=O)NNC(=O)[C@@H]1Cc2ccccc2O1	764168555	QTNOIUQCVNSJMW-KRWDZBQOSA-N	425.441	1.732	50	20	IDGD	
CN(Cc1cccc(NC(=O)C(=O)NNC(=O)CCc2ccco2)c1)C(=O)C(F)(F)F	764169243	OLEKIMUFGNKSAC-UHFFFAOYSA-N	440.378	1.519	50	20	IDGD	
C[C@@H]1CN(Cc2cccc(NC(=O)C(=O)NNC(=O)CCc3ccco3)c2)C[C@@H](C)O1	764171458	LFPGIGBRKSULRH-HZPDHXFCSA-N	428.489	1.608	50	20	IDGD	
O=C(CC1CCCC1)NNC(=O)C(=O)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1	764178516	CBJKAFBBYLIEAV-UHFFFAOYSA-N	436.534	1.527	50	20	IDGD	
CCc1noc(-c2cc(Cl)ccc2NC(=O)C(=O)NNC(=O)Cc2ccccn2)n1	764264620	QJGXSRZWIJRZFM-UHFFFAOYSA-N	428.836	1.676	50	20	IDGD	
CSCc1cccc(NC(=O)C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1	764266979	OYPRQDXUESFQPN-UHFFFAOYSA-N	428.518	1.342	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)C(=O)Nc1ccc(CN2C(=O)CSC2=O)cc1	764314345	UMKZQNCTPCBIPG-UHFFFAOYSA-N	444.444	1.350	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)C(=O)Nc1cc(OC)c(OC)cc1C(=O)OC)c1ccccc1	764332196	OXPDQIFDMWEJGG-CQSZACIVSA-N	443.456	1.770	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1)C(=O)Nc1cnn(-c2ccccc2)n1	764387702	LXTBTXTYVCJFHU-UHFFFAOYSA-N	434.391	1.196	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)[C@H]1CC(=O)N(c2ccc(F)cc2F)C1	765310842	NBGHBNNBMLEJBX-LBPRGKRZSA-N	440.447	1.770	50	20	IDGD	
Cc1nc2c(c(O)nn2C)c(C)c1CC(=O)NNC(=O)CCCNC(=O)OC(C)(C)C	765320201	MLUHQKJCIQPWNB-UHFFFAOYSA-N	434.497	1.286	50	20	IDGD	
CC(C)(C)OC(=O)NNC(=O)C(=O)N1C[C@H](C(=O)N2CCCCC2)Oc2ccccc21	765391048	NYIOLUXQUUVDMR-MRXNPFEDSA-N	432.477	1.349	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)OC(C)(C)C)c(Br)cc1F	765392311	XJOHDQWBHIIIOA-UHFFFAOYSA-N	434.218	1.869	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)NNC(=O)c1cccc(Br)c1	765807487	PAQVSGRJKKSCRN-UHFFFAOYSA-N	427.280	1.824	50	20	IDGD	
O=C(CSCc1ccncc1)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	766661151	RZMWBESQQSOXQW-UHFFFAOYSA-N	447.992	1.933	50	20	IDGD	
O=C(CSc1cccc[n+]1[O-])NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	766664763	SIDCYPBDXKNAHW-UHFFFAOYSA-N	449.964	1.031	50	20	IDGD	
COc1cc(C=NNC(=O)CCN2CCN(c3ccccc3)CC2)c([N+](=O)[O-])cc1O	767032674	GGUSNBPAXWHQOQ-UHFFFAOYSA-N	427.461	1.971	50	20	IDGD	
Cc1ccc(S(N)(=O)=O)c(C(=O)NNC(=O)c2ccc(F)cc2Br)c1	767297956	ADTPRFXUOGGGTJ-UHFFFAOYSA-N	430.255	1.619	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)CC23CC4CC(CC(C4)C2)C3)n(-c2ncccn2)n1	768238726	TWODVEUYIBKKAI-UHFFFAOYSA-N	437.504	1.663	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)CSCC(=O)N2CCCCC2)n[nH]1	768273724	JENFECAQTZLJNH-UHFFFAOYSA-N	431.518	1.592	50	20	IDGD	
CCCS(=O)(=O)N1CCCC[C@@H]1C(=O)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	768280003	VXZMTWFLPDRITG-QGZVFWFLSA-N	437.497	1.571	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2c(C)cnn2Cc2ccccc2F)c(O)c1	769267448	SJRZTXVURAEELB-UHFFFAOYSA-N	425.420	1.793	50	20	IDGD	
CN(C)[C@H](CNC(=O)NNC(=O)CNC(=O)c1ccco1)c1cccc(C(F)(F)F)c1	769530448	LKSBAIYEWNFLRL-CQSZACIVSA-N	441.410	1.662	50	20	IDGD	
Cn1ccnc1[C@@H](O)[C@H]1CCCN(C(=O)NNC(=O)c2cccc(Br)c2)C1	770017484	ACVRCLDRATZLCE-ZFWWWQNUSA-N	436.310	1.983	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)N[C@H]1CCO[C@]2(CCS(=O)(=O)C2)C1	770785439	QJQPLVIKANGYPI-XAYKYTGQSA-N	445.925	1.174	50	20	IDGD	
COc1ccccc1[C@]1(C)NC(=O)N(CC(=O)NNC(=O)Cc2c[nH]c3ccccc23)C1=O	771229297	UDRDMNWPPOSEHX-QHCPKHFHSA-N	449.467	1.334	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1cnn([C@H]2CCCN(C(=O)OC(C)(C)C)C2)c1	772300797	NWCNZFQRLKZCLN-HIFRSBDPSA-N	437.497	1.558	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cn(C)nc3C(F)(F)F)n[nH]2)cc1	773540872	QMDVMPPXAUZXOZ-UHFFFAOYSA-N	435.366	1.537	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)c2cc(Cl)sc2S(N)(=O)=O)c1C	773714178	UMXBLHKDVJABGX-SNVBAGLBSA-N	431.923	1.894	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)ccc1F	774010255	XAWUCOIBQNUTFP-SNVBAGLBSA-N	437.811	1.819	50	20	IDGD	
COc1ccc(CN2CC[C@@H](NC(=O)NNc3cccc(S(C)(=O)=O)c3)C2=O)cc1	776621333	PUZJFJUEWIESDE-GOSISDBHSA-N	432.502	1.526	50	20	IDGD	
Cc1cc(C)c(NC(=O)C(=O)NNC(=O)COc2ccccc2O)cc1Br	777143981	QXEFCPFNZUBYID-UHFFFAOYSA-N	436.262	1.936	50	20	IDGD	
CCc1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)cc(O)n1	778221694	WZJXFDPFZKNKIY-UHFFFAOYSA-N	432.502	1.599	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)CSCc2cc(=O)n3ccsc3n2)nc1C	778421581	NVXGFYWRBWPXBJ-UHFFFAOYSA-N	434.503	1.408	50	20	IDGD	
CCn1c(NNC(=O)[C@H](O)[C@H](O)c2nc3ccccc3s2)nc2ccccc2c1=O	779475380	LGRNJZSGQKEGKH-CVEARBPZSA-N	425.470	1.564	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNS(=O)(=O)c1cnc(-c2ccccc2)nc1	780366810	ZTOHEEHTCITJFM-UHFFFAOYSA-N	428.470	1.931	50	20	IDGD	
O=C(CCCc1ccccc1)NNC(=O)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(F)cc1	780584260	XHYOVJHDMUEQDN-MJGOQNOKSA-N	449.504	1.120	50	20	IDGD	
COc1ccc(OC)c(S(=O)(=O)N2CCN(S(=O)(=O)CCCCCl)CC2)c1	780679217	ADDAYXXHQDZFKW-UHFFFAOYSA-N	440.971	1.359	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N[C@H](C)c2ncn(C)n2)cc1	781392393	MMTONQSANGBJSP-DWKHYPNZSA-N	448.487	1.347	50	20	IDGD	
CC[C@@H]1C[C@H](CC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)CCO1	781552736	ZBIMIPYJSPCTKQ-NVXWUHKLSA-N	439.534	1.064	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNS(=O)(=O)c1ccc(C(F)(F)F)nc1	782258697	MURQDXYPWPDZKH-UHFFFAOYSA-N	436.799	1.380	50	20	IDGD	
CC(C)(C)c1ccccc1NC(=O)C(=O)NNC(=O)c1csc(N2CCOCC2)n1	782897057	LORYLUMXJNCJMQ-UHFFFAOYSA-N	431.518	1.677	50	20	IDGD	
CSCCc1ccc(NC(=O)C(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1	782897983	URLJWIUZNNIBNC-UHFFFAOYSA-N	449.558	1.285	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cnc(NC(=O)OC(C)(C)C)cn2)cc(OC)c1OC	783031709	WJIVPGCKRDFXNC-UHFFFAOYSA-N	447.448	1.924	50	20	IDGD	
CCN1CCC(n2nccc2NC(=O)C(=O)NN=c2sc3ccccc3n2C)CC1	783349571	MKESNADGVVPAQS-UHFFFAOYSA-N	427.534	1.664	50	20	IDGD	
Cc1cc(Sc2ncccn2)ccc1NC(=O)C(=O)NNc1ccc(-n2cccn2)nn1	783433677	XZAYCYZTGNOOSN-UHFFFAOYSA-N	447.484	1.994	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1ccnn1-c1ccc(Cl)cc1	784004553	XWTIGKZHRFTKEW-UHFFFAOYSA-N	446.876	1.103	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)c2cnn([C@H]3CCCN(C(=O)OC(C)(C)C)C3)c2)n1	784587797	HVNCWFWSVHWUCB-KRWDZBQOSA-N	445.524	1.730	50	20	IDGD	
C[C@@H]1CN(c2ccc(NC(=O)C(=O)NNc3ccc(Br)nc3)cn2)C[C@@H](C)O1	784808834	GPWAQKKZZCWBOS-VXGBXAGGSA-N	449.309	1.935	50	20	IDGD	
CC(=O)N1CCN(Cc2ccc(NC(=O)C(=O)NNc3cccc([N+](=O)[O-])c3)cc2)CC1	784831147	IULJAPVTJJJWLS-UHFFFAOYSA-N	440.460	1.341	50	20	IDGD	
Cc1nc(C)n(-c2ccccc2NC(=O)C(=O)NNc2cccc(S(C)(=O)=O)c2)n1	784843733	CSTZBBIHBJNYKP-UHFFFAOYSA-N	428.474	1.369	50	20	IDGD	
CN(C)c1nccc(NNC(=O)C(=O)Nc2cc(C(F)(F)F)ccc2-n2cccn2)n1	784970357	GXGSSSLIUAZMNN-UHFFFAOYSA-N	434.382	1.829	50	20	IDGD	
CCS(=O)(=O)CCn1cc(C)c(NC(=O)NNC(=O)c2cc(-c3ccccc3)on2)n1	786730095	HGXKTZOZXLOKIL-UHFFFAOYSA-N	446.489	1.748	50	20	IDGD	
Cn1nc(-c2ccsc2)cc1NC(=O)C(=O)NNC(=O)c1ccc2c(c1)OCCO2	787543332	IFSSUUIQPVKKKT-UHFFFAOYSA-N	427.442	1.320	50	20	IDGD	
CCOC(=O)[C@H](C)NC(=O)[C@@H](C)NC(=O)NNC(=O)Nc1ccc(OC(F)F)cc1	787880196	FJMFZBMMMODITE-ZJUUUORDSA-N	431.396	1.080	50	20	IDGD	
CCCCOc1ccc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c(O)c1	789252920	YYQHITBDMWZOCB-IBGZPJMESA-N	444.440	1.715	50	20	IDGD	
O=C(NNC(=O)[C@@H](F)CC1CCCCC1)c1cccc(S(=O)(=O)N2CCOCC2)c1	792773430	RKMYUBZYYPELGG-SFHVURJKSA-N	441.525	1.777	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2[C@H](C)CN(C(=O)C(C)(C)C)C[C@H]2C)cc1OC	795140376	CHRFMRSDGGHKFR-HUUCEWRRSA-N	434.537	1.432	50	20	IDGD	
CO[C@@H](C(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1)c1cnn(C)c1	798863095	SPRUNKHAZNXZER-LJQANCHMSA-N	446.471	1.271	50	20	IDGD	
O=C(CC(F)(F)F)NNC(=O)Nc1cnc(N2CCOCC2)c(Br)c1	799249270	VMKYAJKYTQHCLP-UHFFFAOYSA-N	426.193	1.786	50	20	IDGD	
CCOc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NNC(=O)c1cc(Br)c[nH]1	799258601	HKEDBORDFDEFSO-UHFFFAOYSA-N	440.210	1.484	50	20	IDGD	
O=C(N=c1cc[nH]cc1)NNC(=O)c1ccc([N+](=O)[O-])cc1I	802033566	CWPNGJICBVFRBD-UHFFFAOYSA-N	427.158	1.483	50	20	IDGD	
O=C(Cc1ccsc1)NNC(=O)C(=O)Nc1ccc(NC(=O)CC(F)(F)F)cc1	802566531	UIXWVCBOZVBGRZ-UHFFFAOYSA-N	428.392	1.968	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccnc3c2ncn3C)c1	805154434	LZXOXSVMQHQEFX-UHFFFAOYSA-N	430.490	1.074	50	20	IDGD	
CN(C)S(=O)(=O)C[C@@H](NC(=O)NNC(=O)c1ccc(Cl)cc1F)C(F)(F)F	805767235	HGOSXTYXXNXXAN-SNVBAGLBSA-N	434.799	1.245	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)NC[C@H](N2CCOCC2)C(F)(F)F)cc1OC	805848716	UPJXFPSAIIUWTP-HNNXBMFYSA-N	434.415	1.301	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)NC[C@@H](N2CCOCC2)C(F)(F)F)cc1OC	805848717	UPJXFPSAIIUWTP-OAHLLOKOSA-N	434.415	1.301	50	20	IDGD	
COc1ccc(C(=O)N2CCOCC2)cc1NC(=O)NNc1ccc(-n2ccnc2)nn1	806238990	BPCMGZOSITYKGS-UHFFFAOYSA-N	438.448	1.292	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)c1ccc2ncn(-c3ccc(Cl)cc3)c2c1	806788286	RRLIPCRHIDNZHM-LLVKDONJSA-N	435.893	1.378	50	20	IDGD	
Cc1cc([N+](=O)[O-])ccc1NNC(=O)C(=O)Nc1ccc(O[C@H]2CCN(C)C2=O)cc1C	807456516	BHKJGQFYBVOGAW-SFHVURJKSA-N	441.444	1.903	50	20	IDGD	
CN(C)C(=O)COc1c(Cl)cc(S(=O)(=O)NNC(=O)c2ccc[nH]2)cc1Cl	808071393	XXZCNPSYWCXUNS-UHFFFAOYSA-N	435.289	1.412	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)N1CCC[C@H](CNS(=O)(=O)C2CC2)C1	808266194	JSRURMBLHLQSFA-OAHLLOKOSA-N	433.534	1.176	50	20	IDGD	
COc1cc(Cl)c(NC(=O)C(=O)NNC(=O)c2nnc(O)c3ccccc23)cc1C	808934975	ZZPJBMRJKAHPDG-UHFFFAOYSA-N	429.820	1.706	50	20	IDGD	
Cn1nc(NC(=O)C(=O)NNC(=O)COc2cccc(C(F)(F)F)c2)cc1C1CC1	810384652	IEIIMJGXQWCHMT-UHFFFAOYSA-N	425.367	1.481	50	20	IDGD	
COC(=O)c1c(F)ccc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)c1F	810387157	ILACFWHSFYZOJO-UHFFFAOYSA-N	443.309	1.509	50	20	IDGD	
CCNC(=O)N(C)NC(=O)C(=O)Nc1ccc(Oc2ccnc(C(=O)NC)c2)c(F)c1	810394797	DRVFPBLULZJPNS-UHFFFAOYSA-N	432.412	1.004	50	20	IDGD	
Cc1cc(C(F)(F)F)nn1CC(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	810462730	YLFUBISKCSMBFH-UHFFFAOYSA-N	447.439	1.375	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)CNS(=O)(=O)c3ccccc3F)n[nH]2)cc1	810585008	YSVJLRBITREWSG-UHFFFAOYSA-N	445.476	1.518	50	20	IDGD	
COCC1(C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)CCOCC1	810594216	XUGWZRHYCOJPRC-UHFFFAOYSA-N	438.956	1.048	50	20	IDGD	
COC[C@]1(CNC(=O)NNC(=O)[C@H]2COc3ccccc3O2)OCCc2ccccc21	811922125	LRDATLZCRXMBGO-KNQAVFIVSA-N	427.457	1.271	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccc(C(F)(F)F)nc2)cc1	813034035	WBWIQFIDAXZHSM-UHFFFAOYSA-N	431.396	1.433	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@](C)(OC)C2CC2)c1	813203429	LADHSXNBBYCIIS-IBGZPJMESA-N	426.539	1.476	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCc2cc(C)nc(N3CCCC3)n2)cc(OC)c1OC	813856626	KGAVHJWJKJHSSN-UHFFFAOYSA-N	444.492	1.555	50	20	IDGD	
O=C1CNC(=O)c2ccc(C(=O)NNC(=O)c3ccc(COc4ccccc4)o3)cc2N1	814250444	POTBTSWFFIASJE-UHFFFAOYSA-N	434.408	1.615	50	20	IDGD	
O=C(NN=C1COc2ccc(Cl)cc21)c1cccc(S(=O)(=O)N2CCOCC2)c1	814689102	UKVGHWDDWFKGEN-UHFFFAOYSA-N	435.889	1.887	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NN=C1CC(C(=O)O)(c2cccc(Br)c2)C1	814873995	ZGAYGFSVLBASEB-UHFFFAOYSA-N	445.273	1.863	50	20	IDGD	
CC(C)(C)c1csc(NC(=O)C(=O)NNC(=O)c2nnc(O)c3ccccc23)c1C#N	815566263	NRIXASYECNMIQO-UHFFFAOYSA-N	438.469	1.966	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2ccc([C@@H]3CCOC3)cc2)n[nH]1	815570200	VPJYCXXFQDUGEB-OAHLLOKOSA-N	449.467	1.989	50	20	IDGD	
Cc1nc2ccccc2c(=O)n1CC(=O)NNC(=O)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	816510645	BMLQTQSLHAFGSL-OAHLLOKOSA-N	443.504	1.499	50	20	IDGD	
Cc1cc(F)ccc1S(=O)(=O)Nc1ccccc1C(=O)NNc1nnc(C)c(O)n1	849366741	FPHMRJCOBOEAFV-UHFFFAOYSA-N	432.437	1.891	50	20	IDGD	
CSC[C@H](C(=O)NNC(=O)COc1ccc(C)cc1)N1C(=O)[C@H]2CCCC[C@H]2C1=O	901472739	HMFZWVFZYCSHQM-IXDOHACOSA-N	433.530	1.428	50	20	IDGD	
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC(=NNC(=O)COc2ccc(C#N)cc2)CC1	914559936	YWACOJSGFJVXQI-UHFFFAOYSA-N	430.490	1.234	50	20	IDGD	
CC(C)(C)C(=O)N1CCC[C@H]1C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	914708313	UNBWZVWTPVDUEW-IBGZPJMESA-N	429.565	1.383	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(N3C[C@H](C)O[C@@H](C)C3)nc2)cc1C	914882098	VBNIVPUMPIDVAT-HOTGVXAUSA-N	425.489	1.712	50	20	IDGD	
NC(=O)c1ccc(S(=O)(=O)N2CCN(C(=O)CCCC[C@H]3CCSS3)CC2)o1	915297100	AFRCASUVCRAHQE-ZDUSSCGKSA-N	447.604	1.926	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)NC[C@H]2CN(Cc3ccccc3)CCO2)cc1OC	915895154	VFNRNVQACFBVBB-IBGZPJMESA-N	442.516	1.939	50	20	IDGD	
Cc1nnc(O)c(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)c1C	916096440	RIFMKMAERNIKLP-UHFFFAOYSA-N	433.490	1.048	50	20	IDGD	
CC(C)[C@H](CNC(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12)N1CCOCC1	916254012	BLMXIPJNVQUJOY-SFHVURJKSA-N	444.536	1.278	50	20	IDGD	
CN1CCN(C(=O)c2ccc(CNC(=O)NNC(=O)Cc3ccc(Cl)cc3)cc2)CC1	916390863	SSRXJGYGGCQVNL-UHFFFAOYSA-N	443.935	1.801	50	20	IDGD	
C[C@H]1CN(c2ccc(CNC(=O)NNC(=O)[C@@H](C)Oc3ccccc3F)cn2)CCO1	916392568	BOCGNZZROKHDRO-LSDHHAIUSA-N	431.468	1.744	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)NCc2ccc(N3CCO[C@H](C)C3)nc2)c1	916392688	HZKSLIZISKJWNE-QGZVFWFLSA-N	427.505	1.833	50	20	IDGD	
C[C@H](NC(=O)c1ccoc1)C(=O)NNC(=O)c1ccc(CSc2nncn2C)cc1	917021795	TYZBRWHBVPPAKV-LBPRGKRZSA-N	428.474	1.280	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)CCc2ccc3ccccc3n2)c1	917360334	SHQRQUYKCYKGBO-UHFFFAOYSA-N	426.498	1.879	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNS(=O)(=O)c2ccc(CCNC(C)=O)cc2)cc1	917724980	DRQUSUNCXUURMA-HNNXBMFYSA-N	449.529	1.541	50	20	IDGD	
COc1ccc(OC2CCN(C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)CC2)cc1	918001553	BKSHBXMNTTXSOA-UHFFFAOYSA-N	437.460	1.569	50	20	IDGD	
Cc1ccc(-c2noc(CCC(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)n2)cc1F	918155344	JXKYFELTHBPLDY-UHFFFAOYSA-N	446.460	1.981	50	20	IDGD	
O=C(COc1ccccc1CNC(=O)NNc1cncc(Cl)n1)NC[C@@H]1CCCO1	918216678	AHUMZDGYWVQTTQ-AWEZNQCLSA-N	434.884	1.630	50	20	IDGD	
O=C(CN1CCC(NC(=O)Nc2ccccc2)CC1)NNC(=O)c1cccc([N+](=O)[O-])c1	919802925	DCMSODUUGMXHTI-UHFFFAOYSA-N	440.460	1.642	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)[C@H](CSC)N2C(=O)[C@@H]3CCCC[C@H]3C2=O)cc1	919836525	VWZCPKUBVSGPES-KURKYZTESA-N	447.557	1.682	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H](C)Cc2ccc(O)cc2)c1	919910975	FJAKQWBCFMIMPS-HNNXBMFYSA-N	448.545	1.998	50	20	IDGD	
Cc1cc(C)cc(OCCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1	919916994	UXHFSNPTZDCBOF-UHFFFAOYSA-N	434.518	1.577	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCC[C@@H]1CN1C[C@@H](C)O[C@H](C)C1	921192853	COJONGHEEUVDHL-BFYDXBDKSA-N	438.956	1.683	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2ccccc2Cl)cc1	1115813705	QMXGDDFBWOIEAK-UHFFFAOYSA-N	439.877	1.256	50	20	IDGD	
O=C(NCCc1coc(-c2ccccc2)n1)NNC(=O)C1CCN(c2ncccn2)CC1	1318263655	ZJKOVIWLRVIRHP-UHFFFAOYSA-N	435.488	1.921	50	20	IDGD	
COC(=O)C(=O)NNC(=O)NC[C@@H](c1cccc(OC)c1OC)c1c[nH]c2ccccc12	1318875809	CCASXIZCXYZHPS-INIZCTEOSA-N	440.456	1.820	50	20	IDGD	
O=C(NNC(=O)c1ncoc1[C@H]1CCCO1)c1cccc(S(=O)(=O)N2CCCC2)c1	1321854651	PNYYQMNGVWKBCP-OAHLLOKOSA-N	434.474	1.385	50	20	IDGD	
COCc1nc(OC)c2c(C)c(C(=O)NNC(=O)c3n[nH]c4c3CCCC4)sc2n1	1322067297	COEIHKIEROUEQG-UHFFFAOYSA-N	430.490	1.831	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCCN2C(=O)COc3ccccc32)ccc1OC(C)C	1325808387	QQQXWSWJSWWXMB-UHFFFAOYSA-N	442.472	1.852	50	20	IDGD	
O=C(c1cccn2ccnc12)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1778580920	HRZRDSGEPNMEKV-SUMWQHHRSA-N	425.258	1.468	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(=O)n1O)C2	1779540858	XRPPQTRWXQHJQD-OXQOHEQNSA-N	437.569	1.065	50	20	IDGD	
CCOc1ncc(Cl)cc1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](Cl)COC)CCO2	1779686773	CRYQMKUEWBJELH-BEFAXECRSA-N	446.331	1.831	50	20	IDGD	
COc1nc(C)ccc1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1779741149	PILXZXVEPKQNMU-SUMWQHHRSA-N	430.274	1.533	50	20	IDGD	
CCOC(=O)c1cccc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)c1F	1780108902	WIWUDECDLVHPBQ-YWZLYKJASA-N	442.871	1.046	50	20	IDGD	
O=C(c1ccc2cccnc2n1)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781330545	YWDFPYZVCYOIGV-RDTXWAMCSA-N	437.269	1.764	50	20	IDGD	
O=C(c1ccc(OC(F)(F)F)cc1)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1781556914	QSMVIIXCDFNTKR-PBHICJAKSA-N	436.814	1.628	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccn(C)n1)C2	1781900446	QDYXPVPGUUYXQQ-JCKWVBRZSA-N	427.343	1.721	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)COc2ccccc2F)C1	1781908754	LOWQAIUEXRHBSQ-FQELHTAISA-N	442.915	1.972	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)Oc2cccnc2)C1	1782573671	MVVCAYZSBDQJIF-NWUWZPLHSA-N	439.940	1.617	50	20	IDGD	
C/C=C(/C)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2	1783077135	VPHXREJNXMMCKC-XCDJISBRSA-N	429.945	1.915	50	20	IDGD	
CCCC(=O)N[C@H](C)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](Br)CC)C2)C1	1783348941	DIVVESWBVVUWKJ-QWQRMKEZSA-N	432.359	1.295	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](C)n1ccccc1=O)CCO2	1783349638	PRYRTKYLVRGLDT-YZVOILCLSA-N	440.338	1.413	50	20	IDGD	
COc1ncccc1CCC(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](C)Br)C2)C1	1783532587	PWCIFMNOHVDSLJ-LIRRHRJNSA-N	440.338	1.636	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](C)Br)C3)C2)c(OC)c1	1783539173	YLEYQKMTYVSRMZ-ORAYPTAESA-N	441.322	1.931	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)CCCNC(=O)OC(C)(C)C)CCO2)C1	1783884065	OIUUILLOMIJFJT-MGPUTAFESA-N	447.960	1.375	50	20	IDGD	
CC(C)[C@H](C(=O)N1CCO[C@@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1)c1ccccc1	1783933209	RUTFULQCEVAROR-LADGPHEKSA-N	444.576	1.629	50	20	IDGD	
Cc1ccn(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)CBr)C[C@@H]32)n1	1785368786	MJLGIKLFVULYHK-TUUVXOQKSA-N	427.343	1.202	50	20	IDGD	
Cc1ncc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCBr)[C@H]3C2)s1	1786407752	RHQDTDJNEKQTJY-QEJZJMRPSA-N	430.368	1.759	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](CN)c3ccccc3)[C@H]2C1	1786924611	MDYQCWUGZGTFSF-JFMONLCZSA-N	438.366	1.492	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(C)(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]3C2)C1	1787446888	XYPNHVPRPNQLHW-ZQDZILKHSA-N	447.935	1.758	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]2C1)[S@@](=O)c1ccccc1	1787450676	TVZCJJVBDQJBQR-LQELTKFPSA-N	430.929	1.697	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CS[C@@H]3CCCCO3)[C@H]2C1	1788646312	FRARFEFRNCFENV-IQWQSGHPSA-N	434.986	1.480	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(OC)ccn3)[C@H]2C1	1788892489	BJOMZGKYPWRGCS-FAYQHZLMSA-N	440.338	1.857	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)c1[nH]cc2c1CCC2	1789162575	CVMUUCHFJJBSNY-ATVPRXPUSA-N	428.302	1.787	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nc(OC)ccc3[N+](=O)[O-])C[C@@H]21	1789859455	CNOHKONLKTYTQM-ABHRYQDASA-N	440.884	1.609	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc(Cl)nc3)C[C@@H]21)[C@@H](F)Br	1789921004	PFKMWGIOLBFSFH-PDEGPIFNSA-N	435.681	1.414	50	20	IDGD	
COCc1oncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]2C1	1789922944	OMUHAKPDVSMTOE-HVTMNAMFSA-N	434.262	1.105	50	20	IDGD	
CC(C)=NO[C@H](C)C(=O)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1	1790564725	MWXMMIXLDXDKQY-MRXNPFEDSA-N	437.305	1.915	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)n3ccnc3)C[C@@H]21	1790958163	KTMUWCFNZYKPMH-CWVYHPPDSA-N	427.343	1.597	50	20	IDGD	
CC[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)Br)[C@H]2C1)N(CC)CC	1791054981	COZRHKZHHNUBJO-WOYTXXSLSA-N	432.403	1.870	50	20	IDGD	
CCc1[nH]nc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](C)Br)[C@H]3C2)c1F	1791057257	RMMKHLPHJUPOMS-ZPFDUUQYSA-N	431.306	1.488	50	20	IDGD	
O=C(NCCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](F)Br)C2)c1ccc[nH]1	1794307362	JFKXDRFOUADACP-NWJSVONSSA-N	429.290	1.463	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCNC(=O)c1ccc[nH]1	1794309068	ZURXYOBNRMRIBH-FQUUOJAGSA-N	425.327	1.556	50	20	IDGD	
COc1ccc(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)cc1C	1796189805	CKKQHSSRSRGFSU-WKCHPHFGSA-N	436.317	1.178	50	20	IDGD	
CCOc1ccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Cl)cc1OC	1796368384	KRWNDPMEKCEDPR-GTYSZEQSSA-N	428.888	1.760	50	20	IDGD	
C[C@@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Cl	1796371321	VGBCTJGCDVMZOD-USACIQFYSA-N	441.887	1.425	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C#CC1(O)CCCCC1	1797785694	WXJOREASKBFWMI-PNBKFKSVSA-N	427.339	1.058	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1Cc3[nH]nc(C(F)(F)F)c3C1)C2	1799272457	ROJGHGKFTFLBPN-UWSPEPLBSA-N	448.873	1.750	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(Cl)cc2nn[nH]c12	1799332354	CXBFGAYPFYPNBQ-BTTYYORXSA-N	447.927	1.236	50	20	IDGD	
C[C@@H](Oc1ccccc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2	1799379015	KPDIKVZHMJWLMG-QUEVPRLRSA-N	429.286	1.734	50	20	IDGD	
CC[C@@H](CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](O)CCl)C2)NC(=O)OC(C)(C)C	1800184307	VHZIFSAJJXBXQX-ARKGTOAJSA-N	431.961	1.918	50	20	IDGD	
C/C=C/C=C\C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1800481590	YYTOTGHWMWDVRJ-SHEJJLPBSA-N	441.956	1.840	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)Cn1ccnc1)C2	1800644194	MUVNWBDRGFWCKT-RBGFHDKUSA-N	427.343	1.282	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(F)cnc1Cl)C2	1800759011	DEXNFSGDOYHFKH-ORXSELOVSA-N	434.693	1.861	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc(NC(C)=O)cc1)C2	1800978584	VRWJHOQYWWOMHM-YNVMFWSZSA-N	437.924	1.031	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)S	1800985609	FXNSDLRNEYLMLT-MMPOEDRJSA-N	437.474	1.042	50	20	IDGD	
COC[C@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1c(-c3ccncn3)noc1C)C2	1802279053	KOSSENZFZPCNRV-XGUBFFRZSA-N	433.896	1.946	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC2(CCCN(C(=O)[C@H]3CCC(F)(F)C3)C2)CC1	1804769863	VIVBIUKRXUKPKI-KRWDZBQOSA-N	434.292	1.647	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)CCSC(=N)N)[C@H]1c1cccnc1	1807127974	YFPZQVGPVISVKY-NJZAAPMLSA-N	442.383	1.888	50	20	IDGD	
C[C@H](CC(N)=O)C(=O)N1CC[C@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]1c1cccnc1	1808289586	FQCNMTXEKBGLBV-OZSDWXKXSA-N	429.348	1.835	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC2(CCCN(C(=O)c3cncnc3)C2)CC1	1808505340	GFDABMGOYZBIKJ-WGOQTCKBSA-N	437.504	1.455	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cc(O)ncn2)[C@@H]1c1cccnc1)[C@@H](F)Br	1808648877	DROJTHCJUQAUSN-NILFDRSVSA-N	438.257	1.587	50	20	IDGD	
CNC(=S)NCCC(=O)N1CCC2(CCCN(C(=O)CCBr)C2)CC1	1809067245	UHTYBLHWLLKFLL-UHFFFAOYSA-N	433.416	1.487	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@@H](CNC(=O)CCc2nc(N)n[nH]2)[C@H]1c1cccnc1	1810145894	DUJDLJUUFNONDW-WMLDXEAASA-N	433.944	1.686	50	20	IDGD	
C=CCNC(=O)/C=C\C(=O)N1CC[C@H](CNC(=O)[C@@H](Cl)COC)[C@@H]1c1cccnc1	1813028139	LMFYYIUGWRWCHU-VQRWETBISA-N	434.924	1.200	50	20	IDGD	
Cc1occc1C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1813069851	CXFLSBCZFZMLGE-DYESRHJHSA-N	427.505	1.676	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2ccccc2O)[C@@H]1c1cccnc1	1813071817	YBEQAXDTJHJGIX-HTAPYJJXSA-N	439.516	1.480	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cccn3c(O)nnc23)[C@H]1c1cccnc1)C(Cl)Cl	1813080615	URCSZQSZPLHLQZ-JSGCOSHPSA-N	449.298	1.953	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H]2CCCCN2C)n[nH]1	1814897713	UHRJXIAWGSOHNO-IRXDYDNUSA-N	433.557	1.259	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](C)CS(C)(=O)=O)n[nH]1	1815232084	FYEGHEPSJGTUPH-NTZNESFSSA-N	449.371	1.866	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1ccc(F)s1	1816026761	LPWQMOISBLBJPL-OAHLLOKOSA-N	442.281	1.910	50	20	IDGD	
Cc1nscc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1	1817473544	ZQWMIZMOQOZJET-QGZVFWFLSA-N	439.306	1.474	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)c3c[nH]c(=O)cn3)sc2C1	1821474046	IBOHYBUSCFBMNH-BDAKNGLRSA-N	440.323	1.626	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)c3c[nH]c(=O)cn3)sc2C1	1821474681	VEMOSNRAQHPEHM-SFYZADRCSA-N	426.296	1.236	50	20	IDGD	
Cc1ccncc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1	1822413983	JUVNYQORGSNKRS-KRWDZBQOSA-N	427.509	1.792	50	20	IDGD	
Cc1noc(N)c1C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1	1823005300	ZBGVCTOXJHWRKH-QUBYGPBYSA-N	432.275	1.938	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)CCl)CC2)c1c(F)ccc(O)c1F	1823632684	DPASHRFMUDQWMD-HQJQHLMTSA-N	431.848	1.952	50	20	IDGD	
CC(=O)N/C(C)=C/C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCBr)CC2	1824468487	FSXPNCNVOLGSJJ-DJYGCBNOSA-N	429.340	1.880	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(F)cn2)CC1	1826142310	FFDQESGPRPULOL-IBGZPJMESA-N	433.528	1.827	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCCC[C@H]1C1CCN(C(=O)CN2CCOCC2)CC1	1829101885	ACVOPSUQYVWEOH-IBGZPJMESA-N	425.646	1.790	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(F)n2)CC1	1829229457	IKWOOAWHSLWFHG-GOSISDBHSA-N	433.528	1.827	50	20	IDGD	
C=CCC(F)(F)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H](C)CBr)CCO2)C1	1830544177	PNCZOWNQNWQCES-BBRMVZONSA-N	439.297	1.685	50	20	IDGD	
O=C(CSC1CCCC1)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1831363592	IXVVUCZHUQQDBL-KRWDZBQOSA-N	425.378	1.922	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(OC)cc3O)C2)C1	1831655265	VKJJZBARXGUZOH-LAUBAEHRSA-N	440.924	1.878	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3n[nH]c(C)c3F)CCO2)C1	1833674144	QIMTWFRDGIPWMK-YVEFUNNKSA-N	447.305	1.101	50	20	IDGD	
Cc1ncccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)CBr)C2)C1	1834035376	NUIPPTBNLFBQKW-IFXJQAMLSA-N	440.338	1.491	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC(N2CCC(NC(=O)c3ccc(=O)oc3)CC2)CC1	1834340577	ZWIBKQGDWPSCCE-UHFFFAOYSA-N	435.597	1.677	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)c3ncccc3F)C2)C1	1834823048	GLYMYYGIMCLTTI-QGZVFWFLSA-N	430.274	1.076	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)c3ccc(F)c(F)c3)C2)C1	1834823821	MAYOMCPPRGRVLN-SFHVURJKSA-N	447.276	1.820	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)Cc3cnc[nH]3)CC2)CC1	1835064553	XKGKNNJEHWHKIF-KRWDZBQOSA-N	440.386	1.697	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3cc(C#N)c[nH]3)CC2)CC1	1836170825	OKOLNBBWMCNLQA-ZDUSSCGKSA-N	436.354	1.855	50	20	IDGD	
CCOC(=O)C1(C(=O)N2CCC(N3CCC(NC(=O)[C@H](Cl)CC)CC3)CC2)CC1	1836397208	BFCRAUPGZVMVLZ-QGZVFWFLSA-N	427.973	1.919	50	20	IDGD	
O=C(c1c[nH]c2nccc-2c1)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836718048	QRNHHTHIZAGDOL-SFHVURJKSA-N	434.924	1.726	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)/C=C/c3cccnc3)C2)C1	1837709983	CACDGUAMOMVUGA-IRUYWQDXSA-N	433.581	1.403	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)C[C@@](C)(O)CC(=O)O)CC2)CC1	1838637339	SUJMDARYEOZEAP-OXJNMPFZSA-N	432.945	1.618	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3ccc[nH]3)C2)C1	1839152367	XFVOFJNSPSDQNT-OALUTQOASA-N	432.348	1.640	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3c(C)nn(C)c3C)CCO2)C1	1840434517	DKEMYFMUIHGMIE-RXVVDRJESA-N	440.972	1.443	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)CCCn3cccc3)CCO2)C1	1840461819	UXQRPKKWVDINOT-PMACEKPBSA-N	446.375	1.961	50	20	IDGD	
O=C([C@H](F)Br)N1CC2(CCCN2C(=O)c2ccc(N3CCOCC3)cn2)C1	1842266301	VEJZLUCDBRXEKX-HNNXBMFYSA-N	441.301	1.426	50	20	IDGD	
CC(=O)N[C@@H](Cc1cccc(F)c1)C(=O)N1CC2(CCCN2C(=O)CO[Si](C)(C)C)C1	1844379869	UYUSJZGUENZDQZ-IBGZPJMESA-N	449.599	1.928	50	20	IDGD	
CC(=O)N[C@H](C(=O)N1CC2(CCCN2C(=O)[C@H](F)Br)C1)c1ccc(F)cc1	1845218916	KHGIKLJODGKFNJ-GJZGRUSLSA-N	444.276	1.897	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCCC12CN(C(=O)c1c[nH]c(=O)cn1)C2	1845871466	FJVDMAYDZGXHIY-MKMNVTDBSA-N	425.395	1.472	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CCCC[C@@H]1C(=O)N1CCCC12CN(C(=O)[C@@H](O)CCl)C2	1846950089	SETKIAIOKNXFAS-XHSDSOJGSA-N	443.972	1.873	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](C)NC(=O)c1ccccn1	1847502363	OXKKEEXEWMABHV-VRKREXBASA-N	437.338	1.433	50	20	IDGD	
O=C(c1csc(-n2ncc3ccccc32)n1)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl	1847556787	OCAQFIBRTJOOSL-YESZJQIVSA-N	445.932	1.897	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cccc(N2CCCNC(=O)C2)n1	1847865264	MBSXKTNBJXWRCS-SZMVWBNQSA-N	447.967	1.631	50	20	IDGD	
CCOC(=O)c1c(C)[nH]c(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c1C	15315227	HYRABORUMWMYMS-UHFFFAOYSA-N	441.532	1.782	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)/C=C/c1ccccc1)C(=O)NNC(=O)c1cccn1C	115208473	BIYOUSNWRIOYBC-UKYUDJEDSA-N	436.559	1.498	50	20	IDGD	
Cc1c(Cl)cccc1NC(=O)CCNC(=O)NNC(=O)CNC(=O)c1cccs1	725873892	UKVMACVSSSVGJT-UHFFFAOYSA-N	437.909	1.799	50	20	IDGD	
CC(C)NC(=O)C(=O)NNC(=O)C1(c2ccccc2)CCN(C(=O)OC(C)(C)C)CC1	727119149	ZNENGFHKSSZHPA-UHFFFAOYSA-N	432.521	1.627	50	20	IDGD	
CC(=O)NCc1ccc(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)cc1	728214034	VLYOWHHVHXTVDV-UHFFFAOYSA-N	445.545	1.016	50	20	IDGD	
NS(=O)(=O)c1ccc(CC(=O)NNC(=O)c2cc(F)ccc2Br)s1	728549738	RZBFKDNWUDZWGG-UHFFFAOYSA-N	436.284	1.301	50	20	IDGD	
CC(C)COc1ncccc1C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	728669769	BAKQFEBBNZPYSQ-QGZVFWFLSA-N	429.429	1.261	50	20	IDGD	
COc1ccc(-n2ccc(C(=O)OCC(=O)NNC(=O)Cc3nc(C)cs3)n2)cc1	728729445	NTAPXJCTZYFMCU-UHFFFAOYSA-N	429.458	1.193	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)cc1NC(=O)c1ccccc1F	729274839	FLSDJHUCJJLUHE-LBPRGKRZSA-N	436.465	1.085	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)[C@@H](Cc1ccc(F)cc1)n1nnnc1C	729297512	OTPVTWMXGWQWET-MRXNPFEDSA-N	428.424	1.139	50	20	IDGD	
C=CCN(C)S(=O)(=O)c1ccc(NC(=O)NNC(=O)COc2ccccc2O)cc1	730895591	IPLWLIJPKFFOGE-UHFFFAOYSA-N	434.474	1.430	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)c1nnn(-c2cccc3ncccc23)c1C	731341338	BRFIMUOHHZZBLI-UHFFFAOYSA-N	432.440	1.973	50	20	IDGD	
O=C(NC[C@H](O)c1ccc2ccccc2c1)NNC(=O)C1CCN(c2ncccn2)CC1	731501102	LVAGQMDLYFPLCA-FQEVSTJZSA-N	434.500	1.910	50	20	IDGD	
O=C(NC[C@@H](O)c1ccc2ccccc2c1)NNC(=O)C1CCN(c2ncccn2)CC1	731501104	LVAGQMDLYFPLCA-HXUWFJFHSA-N	434.500	1.910	50	20	IDGD	
CN(C)C(=O)CN1CCC(NC(=O)NNC(=O)c2ccc(COc3ccccc3)o2)CC1	731762243	KIKXXFODBOUUMK-UHFFFAOYSA-N	443.504	1.355	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N[C@H](C)c2ccccc2)c1	732084364	BQJGBBVGBJOFCS-CYBMUJFWSA-N	427.486	1.832	50	20	IDGD	
CCc1cc(N2CCC[C@@H](NC(=O)NNC(=O)c3ccc(OC)c(OC)c3)C2)ncn1	732914247	JYYWOQSIMBPUQD-MRXNPFEDSA-N	428.493	1.669	50	20	IDGD	
CC(=O)N1c2ccc(S(=O)(=O)NNC(=O)c3cnn(-c4ccccc4)c3)cc2C[C@@H]1C	733123167	VZOAAWGNSBKGKR-AWEZNQCLSA-N	439.497	1.793	50	20	IDGD	
CCOCCCn1c(NNC(=O)CSc2cccc[n+]2[O-])nc2ccccc2c1=O	733268531	NGJGYFFCILKILE-UHFFFAOYSA-N	429.502	1.692	50	20	IDGD	
CS(=O)(=O)CC[C@@H](NS(=O)(=O)c1ccccc1)C(=O)NNc1ccc(F)cc1F	733363074	LHPYCHNJMQEAEK-MRXNPFEDSA-N	447.485	1.190	50	20	IDGD	
N#C/C(=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)NCCn1cccn1	734124172	XEWVMHVNODVIAL-VBKFSLOCSA-N	437.891	1.999	50	20	IDGD	
COc1cccc([C@@H](C)C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)c1	735118322	RSOJJMFLIHZYLZ-OAHLLOKOSA-N	433.534	1.273	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCc2cccc(-n3cncn3)c2)nc1	735583990	BCEAQVDUECICKG-UHFFFAOYSA-N	430.494	1.175	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1)c1ccc(F)nc1	735840662	LQCGGWVOPZTPMO-UHFFFAOYSA-N	428.445	1.774	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)c1nnn(-c2cccc(F)c2)c1C(F)(F)F	740852615	FLILCHIHTOXNQZ-UHFFFAOYSA-N	430.362	1.491	50	20	IDGD	
CN(CCCC(=O)NNC(=O)C(C)(C)c1ccccc1)C1=NS(=O)(=O)c2ccccc21	741925444	QKBDJCHKTQBGIL-UHFFFAOYSA-N	442.541	1.973	50	20	IDGD	
CCO[C@H](C)c1ncc(C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)s1	742479235	XWERSAQHHARLAK-LLVKDONJSA-N	425.536	1.917	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)[C@H]2SCCc3ccccc32)CC1	743417710	APCZPGKIMWPAHT-SFHVURJKSA-N	447.586	1.491	50	20	IDGD	
CN(Cc1ccccc1)C(=O)CNC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	743546826	BIGCOUGQTUYPEA-UHFFFAOYSA-N	433.490	1.084	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)CC/N=C2/NS(=O)(=O)c3ccccc32)c(Cl)c1	743825271	CBAYSHUTKOBEQR-UHFFFAOYSA-N	435.893	1.930	50	20	IDGD	
CCn1c(=O)c2ccccc2n(CC(=O)NNC(=O)Nc2ccc(OC(F)F)cc2)c1=O	743831881	HCHXCFFFEGMXMP-UHFFFAOYSA-N	447.398	1.637	50	20	IDGD	
O=C(NNc1ccc(Cl)nc1)N[C@H]1CCCN(c2cc(N3CCOCC3)ncn2)C1	745817059	SDOBPXDNRXWYKP-HNNXBMFYSA-N	432.916	1.657	50	20	IDGD	
CCSCC[C@@H](C)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	745924087	ZOHKQPPNDSNWSY-CQSZACIVSA-N	428.580	1.947	50	20	IDGD	
C[C@H]1CN(C(=O)c2ccc(CNC(=O)NNC(=O)c3ccc(C#N)cc3)cc2)C[C@H](C)O1	747105857	RSYNGQCGIFFKIO-HOTGVXAUSA-N	435.484	1.952	50	20	IDGD	
COC(=O)/C=C/c1ccc(S(=O)(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)cc1	747597480	YKOWSVZKCNQNRY-YRNVUSSQSA-N	431.470	1.438	50	20	IDGD	
NS(=O)(=O)c1ccc2c(c1)oc(=O)n2CC(=O)NNc1cccc(C(F)(F)F)c1	747987366	DOPVEUDIAHWRSI-UHFFFAOYSA-N	430.364	1.404	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1c(O)nc2ccccc2c1C	749332765	DNBYPJROENLPDQ-UHFFFAOYSA-N	427.486	1.925	50	20	IDGD	
CCn1c(=O)n(CC(=O)NNc2nc(Br)cn3ccnc23)c2ccccc21	750243390	HCPBYAPHIVEMBY-UHFFFAOYSA-N	430.266	1.771	50	20	IDGD	
CCOC(=O)c1sc(CNC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)nc1C	750671556	NPTRDIHZEHKDGD-UHFFFAOYSA-N	444.473	1.019	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)NCCNS(=O)(=O)c1ccc(Cl)s1	752174298	DTIKTVIMECCENA-UHFFFAOYSA-N	446.938	1.227	50	20	IDGD	
Cc1nn(C)c(=O)c(C(=O)NNC(=O)c2nc(-c3ccccc3)n(-c3ccccc3)n2)c1C	752898983	SEKOGCAJAYEFHC-UHFFFAOYSA-N	443.467	1.720	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)N[C@@H]2CCCN(Cc3ccccn3)C2=O)cc1	753289389	MGTYOWPOQLDLCJ-GOSISDBHSA-N	425.493	1.675	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2cnn(C)c2Br)c2ccccc2c1=O	753767749	DRIGCLOWBHIJMG-UHFFFAOYSA-N	433.266	1.377	50	20	IDGD	
C[C@H](NS(=O)(=O)c1cccc(C(=O)NNC(=O)Cc2cc[nH]n2)c1)c1ccccc1	755278847	FQEGYWMQVAHZMP-AWEZNQCLSA-N	427.486	1.453	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)Nc1cccc(N2CCS(=O)(=O)CC2)c1	756205196	DSCHRCYXSAXEBP-UHFFFAOYSA-N	433.446	1.296	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)Nc1ccc(OC)c(N2CCOC2=O)c1	756816853	BPEIAMBLMRZQOE-UHFFFAOYSA-N	430.417	1.892	50	20	IDGD	
C[C@H]1C[C@@H](C)C[C@]2(C1)NC(=O)N(CC(=O)NNC(=O)c1cccc(OC(F)F)c1)C2=O	756978168	QZXUGLDUYKMYER-OYHTYJOISA-N	438.431	1.796	50	20	IDGD	
NC(=O)c1ccc(NNC(=O)CCC[S@@](=O)c2ccc(Br)cc2)nn1	757400839	SFQUIJNZBMNQLP-RUZDIDTESA-N	426.296	1.369	50	20	IDGD	
C[C@H]1CCC[C@H](C)N1C(=O)COc1ccc(C(=O)NNc2ccc(C(N)=O)nn2)cc1	757402710	OJINZCGPMHIOSD-KBPBESRZSA-N	426.477	1.501	50	20	IDGD	
CC(C)CCn1nc(C(=O)NNC(=O)Nc2ccc(C(N)=O)nc2)c2ccccc2c1=O	757701086	WVFVAKKDMWJNID-UHFFFAOYSA-N	437.460	1.403	50	20	IDGD	
Cc1cccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c1F	757911874	ZQYJIFYXXUUKQA-UHFFFAOYSA-N	436.465	1.622	50	20	IDGD	
CCC[C@@H](NC(=O)NNC(=O)C(=O)Nc1ccccn1)C(=O)N1CCc2sccc2C1	758747953	UCTHQSSZHGXKOX-CQSZACIVSA-N	444.517	1.166	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H](C#N)[C@@H](NC(=O)NNC(=O)CSc2ccccc2O)C1	758758029	HZIZOAVVLWRYNM-STQMWFEESA-N	435.506	1.574	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2cccc(Br)c2F)n1	759148723	UETYQMOIZBESMB-UHFFFAOYSA-N	430.255	1.900	50	20	IDGD	
NC(=O)[C@H]1CC[C@H](CNC(=O)NNC(=O)COc2ccccc2Cc2ccccc2)O1	760204834	UMNGBCHBVJLCLI-IEBWSBKVSA-N	426.473	1.020	50	20	IDGD	
COC(=O)C12CCC(C(=O)NNC(=O)NC3CCN(C(=O)OC(C)(C)C)CC3)(CC1)C2	760343717	FIZGCMPTEMOEHT-UHFFFAOYSA-N	438.525	1.840	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)c1nc(-c2ccccc2)no1	760855998	MYKXDNZSJOQMQB-CYBMUJFWSA-N	447.455	1.731	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)c1cccc(CN2C(=O)CNC2=O)c1	761633847	SLBGTJXWEQAGKI-UHFFFAOYSA-N	428.470	1.300	50	20	IDGD	
CC[C@@H](N=c1nn[nH]n1-c1ccccc1)C(=O)NNC(=O)CSc1ccccc1OC	762374911	ZCNQBPYYKOJEDR-OAHLLOKOSA-N	441.517	1.223	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNS(=O)(=O)c2cnc3onc(CC)c3c2)cc1	762436744	FLTLHSMEDWIZJI-GFCCVEGCSA-N	434.474	1.961	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccccc2C[S@@](C)=O)c1	762913294	ASPSAXTZXJNPFE-MUUNZHRXSA-N	438.531	1.282	50	20	IDGD	
CCS(=O)(=O)N[C@@H](CCSC)C(=O)NNC(=O)c1cc(-c2ccc(C)cc2)[nH]n1	762956169	QBULJIGKDVZYFP-AWEZNQCLSA-N	439.563	1.207	50	20	IDGD	
CC(C)(C(=O)OCC(=O)NNC(=O)c1ccc(C#N)cc1)c1ccc([N+](=O)[O-])cc1F	762978155	DTXFUOFWLHGLFD-UHFFFAOYSA-N	428.376	1.888	50	20	IDGD	
CCc1cccc(NC(=O)C(=O)NNC(=O)c2cccc(S(=O)(=O)N(CC)CC)c2)c1	763507664	AGCDFCKEMDEKEY-UHFFFAOYSA-N	446.529	1.679	50	20	IDGD	
N#Cc1cc(Cl)ccc1-n1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2F)n1	763562018	RJXZHPPFGOBISV-UHFFFAOYSA-N	426.795	1.936	50	20	IDGD	
COC(=O)N(C)Cc1ccc(NC(=O)C(=O)NNC(=O)COc2cc(C)ccc2C)cc1	763668795	PQLBISQUVBFVFE-UHFFFAOYSA-N	442.472	1.667	50	20	IDGD	
CCCN1Cc2cccc(NC(=O)C(=O)NNC(=O)COc3ccccc3OCC)c2C1	763682809	WWSWKIWVNBRHQA-UHFFFAOYSA-N	440.500	1.976	50	20	IDGD	
Cn1c(=O)n(C)c2cc(NC(=O)C(=O)NNC(=O)CSc3ccc(Cl)cc3)ccc21	763736748	UNFHXJWDFQONQJ-UHFFFAOYSA-N	447.904	1.409	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2ccc(OC)c(OC)c2OC)c1	763771651	JQJCKJMMHAQLPL-UHFFFAOYSA-N	433.417	1.129	50	20	IDGD	
C[C@H](c1ccccc1)n1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)n1	763807532	DCNNSBGGHDGODN-OAHLLOKOSA-N	432.440	1.529	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3nc(N4CCOCC4)oc3c2)cc1	763833758	FVMUTSRARBNWEL-UHFFFAOYSA-N	437.456	1.627	50	20	IDGD	
CCNC(=O)c1ccc(C)c(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)c1	763849001	GVVUAVWKEVZMMO-CYBMUJFWSA-N	430.436	1.437	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNC(=O)Cn2nc(C)cc2C)c(C(F)(F)F)c1	763880224	DOXDGXJGLHYZTP-UHFFFAOYSA-N	427.383	1.704	50	20	IDGD	
CC(C)CCn1nccc1NC(=O)C(=O)NNC(=O)c1cc(Br)cn1C	764004262	AONXTRODQNDJKK-UHFFFAOYSA-N	425.287	1.430	50	20	IDGD	
CCc1nn(C)cc1NC(=O)C(=O)NNC(=O)c1ccc(Br)cc1Cl	764057933	LQDIRTLEOHGPIW-UHFFFAOYSA-N	428.674	1.798	50	20	IDGD	
CCOc1ccc(Br)cc1NC(=O)C(=O)NNC(=O)[C@H]1Cc2ccccc2O1	764169930	XFZOIWJJHGSLMA-MRXNPFEDSA-N	448.273	1.937	50	20	IDGD	
CCCNC(=O)[C@@H]1CN(C(=O)C(=O)NNC(=O)CCC2CCCCC2)c2ccccc2O1	764209435	ARSMURZLUJEQPP-IBGZPJMESA-N	444.532	1.815	50	20	IDGD	
O=C(CCCc1ccccc1)NNC(=O)C(=O)Nc1cccc(Cn2cccnc2=O)c1	764224299	OJDSIAZHVOVRQR-UHFFFAOYSA-N	433.468	1.400	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cc(F)ccc2Br)n(CCC#N)n1	764270026	BRSDVZMOMXFWCR-UHFFFAOYSA-N	437.229	1.407	50	20	IDGD	
O=C(Cc1cc[nH]n1)NNC(=O)C(=O)Nc1ccc(NC(=O)C2CC2)cc1C(F)(F)F	764286489	VTAFEOCVWUXTDP-UHFFFAOYSA-N	438.366	1.106	50	20	IDGD	
CC(C)(C(=O)NNC(=O)C(=O)Nc1cccc(Cl)c1-n1cncn1)c1ccccc1	764308615	GBZBOYFLIKJCNP-UHFFFAOYSA-N	426.864	1.984	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C(=O)Nc1ccc(NS(=O)(=O)CC)cc1)c1ccccc1	764332320	QDAKGYWVLFOODQ-KRWDZBQOSA-N	432.502	1.728	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)C2CCC2)cc1S(=O)(=O)N1CCCCCC1	764334320	DATZRPCNWJWKSV-UHFFFAOYSA-N	436.534	1.446	50	20	IDGD	
O=C(NNC(=O)C(F)(F)Oc1ccccc1)C(=O)Nc1cccnc1OCC(F)F	764369282	BPRTVGOYZGRNBZ-UHFFFAOYSA-N	430.314	1.483	50	20	IDGD	
COC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(C)c(C)c3)[nH]n2)c1	764386844	CVUSYRGGQUNJSO-UHFFFAOYSA-N	435.440	1.880	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)C(=O)Nc2cccc(C(=O)c3ccccc3)c2)c1	764432669	IZIBVGQWEXKZMB-UHFFFAOYSA-N	445.435	1.671	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)CCNC(=O)c2ccc(F)cc2)n[nH]1	765595634	OLKKNRQWMNZWON-UHFFFAOYSA-N	425.420	1.806	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1cccc(C(=O)N2CCSCC2)c1C	766261395	XJPOTXSOARMRIY-UHFFFAOYSA-N	430.490	1.064	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)nnn1Cc1ccc(F)cc1	766397532	AREZCOLWNMCQEX-UHFFFAOYSA-N	431.449	1.252	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)[C@H]2C[C@H]2c2cc(F)c(F)c(F)c2)n1	766781345	OKNBRRPQDHGXEJ-QWRGUYRKSA-N	427.404	1.906	50	20	IDGD	
CC(=O)N1CCN(c2ccccc2CNC(=O)NNc2ccccc2S(C)(=O)=O)CC1	766940716	DOAZNQUHZMMZTK-UHFFFAOYSA-N	445.545	1.585	50	20	IDGD	
CC(=O)Nc1ccccc1CC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	767429839	AVRZNNGVNKIGNR-UHFFFAOYSA-N	444.513	1.433	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)c2nccc3c(S(N)(=O)=O)cccc23)cc1	768481184	LOJOPZYRPJKHKO-UHFFFAOYSA-N	428.470	1.285	50	20	IDGD	
CSCCNC(=S)NNC(=O)c1cccc(NC(=O)CSc2nncn2C)c1	769769434	LYFZQEFDRMPTAQ-UHFFFAOYSA-N	439.592	1.018	50	20	IDGD	
CCc1nn(C)cc1/C=C(/C#N)C(=O)c1c(N)n(Cc2ccccc2)c(=O)n(CC)c1=O	770568483	FGSSONPBZFNVLM-WJDWOHSUSA-N	432.484	1.746	50	20	IDGD	
NC(=O)COc1cccc(NC(=O)C(=O)NNc2ccc(Br)c(F)c2)c1	770816349	WFUCGRBHFGNISL-UHFFFAOYSA-N	425.214	1.534	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)[C@@H](O)[C@H](O)c1nc2ccccc2s1	772998985	YVCIHABHGAEGNE-HNHYXYPQSA-N	435.889	1.959	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)c2ccc(CS(C)(=O)=O)cc2)C1	773411982	SPDHFPWJODFVBF-INIZCTEOSA-N	439.534	1.639	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccccc2[N+](=O)[O-])cc1	773651457	YFCPBZBGQJSYSU-UHFFFAOYSA-N	435.462	1.707	50	20	IDGD	
CON(C)S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ncc(Cl)cc2Cl)cc1	773676585	DJYKMTSEOOYSTJ-UHFFFAOYSA-N	448.288	1.652	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2cnn(Cc3nnc4n3CCCC4)c2)cc1Cl	773694518	CZWUHTBJYORMJE-UHFFFAOYSA-N	444.883	1.603	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2ccc(N3CCc4sccc4C3)nc2)n1	773724215	ONRGXGRSPSODJW-UHFFFAOYSA-N	425.474	1.586	50	20	IDGD	
O=C(CN1CCC(O)(c2c(F)cccc2F)CC1)NNC(=O)c1ccc([N+](=O)[O-])cc1	778239980	TULQOTNNPMONGC-UHFFFAOYSA-N	434.399	1.618	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccn([C@@H](C)COC)n3)n[nH]2)cc1	778713389	JODSUAVUQVSOKN-ZDUSSCGKSA-N	439.476	1.443	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cn(C)nc2-c2cnn(C)c2)cc1Br	780662656	SUXDYSOXGIAMEJ-UHFFFAOYSA-N	433.266	1.667	50	20	IDGD	
COc1ccc(NNC(=O)[C@H]2CCCN(S(=O)(=O)c3ccc([N+](=O)[O-])cc3)C2)nc1	781526739	ZZLUXKWZIHRJNX-ZDUSSCGKSA-N	435.462	1.542	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C)c(C)c(NC(=O)C(=O)NNc2ccc(OC)cn2)c1	782144850	FBRGCCUACHNSNS-UHFFFAOYSA-N	449.533	1.819	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NN=Cc3scnc3C3CC3)CC2)cc1	782254287	WORUKMWHSLGLEX-UHFFFAOYSA-N	447.586	1.786	50	20	IDGD	
CCOC(=O)[C@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNc2ccc(OC)cc2)cc1	783035905	IKYPHOXNMRGJJX-ZDUSSCGKSA-N	428.445	1.458	50	20	IDGD	
CNS(=O)(=O)c1cccc(NC(=O)C(=O)NNc2ncccc2C(F)(F)F)c1C	783120995	BTOGJYZFWZHZEH-UHFFFAOYSA-N	431.396	1.399	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2cc(F)c(F)cc2F)nc1	783264376	ODLBYNOYXIPFJG-UHFFFAOYSA-N	431.396	1.267	50	20	IDGD	
COC(=O)c1c(C2CC2)csc1NC(=O)C(=O)NNc1ccc(-n2cccn2)nn1	783437344	YDZUOGJOCULUHN-UHFFFAOYSA-N	427.446	1.470	50	20	IDGD	
CN(C)CC(=O)Nc1ccc(NC(=O)C(=O)NNc2ccnc(Br)c2)cc1	784828577	KKVCBDWVIFNBHM-UHFFFAOYSA-N	435.282	1.426	50	20	IDGD	
Cc1cc(C(=O)NC(C)C)ccc1NC(=O)C(=O)NNc1cccc(S(C)(=O)=O)c1	784841821	SPURLKZRRCAWEM-UHFFFAOYSA-N	432.502	1.619	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1cccc(NC(=O)C(=O)NNc2ccc(Cl)nc2)c1	784869775	KRDBRFRXVIEGRL-UHFFFAOYSA-N	425.898	1.894	50	20	IDGD	
Cc1ccc(F)c(NNC(=O)C(=O)Nc2ccc(N3CCN(C(=O)C4CC4)CC3)nc2)c1	784888282	RHNPGYSAKCYTSD-UHFFFAOYSA-N	440.479	1.670	50	20	IDGD	
O=C(COC(=O)c1ccc(CN2CCC(CO)CC2)cc1)NNC(=O)c1cccs1	785712500	SPFJOFJHSITFLK-UHFFFAOYSA-N	431.514	1.570	50	20	IDGD	
C[C@@]1(c2ccccc2)NC(=O)N(CC(=O)NNC(=O)c2cc(-c3ccccc3)on2)C1=O	789899691	LLXWGVGIAYDIJA-QFIPXVFZSA-N	433.424	1.570	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)CN1C(=O)N[C@](C)(c2ccccc2)C1=O	789909830	JQSOCIHIBDAWCB-HXUWFJFHSA-N	430.848	1.577	50	20	IDGD	
CNC(=O)c1cc2cc(NC(=O)C(=O)NNC(=O)Cn3ccc4ccccc43)ccc2[nH]1	792354902	DEKQBYZRBLVVDQ-UHFFFAOYSA-N	432.440	1.268	50	20	IDGD	
CN(C)N(C(=O)CSc1nncn1-c1cccc(Cl)c1)[C@H]1CCS(=O)(=O)C1	792848908	HIHBYJKQFZNOAE-AWEZNQCLSA-N	429.955	1.505	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)Nc1cc(S(=O)(=O)N2CCCC2)ccn1	797674431	VHEFRCMBRUTGAP-UHFFFAOYSA-N	433.490	1.270	50	20	IDGD	
O=C(NNc1ccnc(F)c1)C(=O)Nc1cnc(N2CCOCC2)c(Br)c1	799261739	PEAJFLWDBGZIOO-UHFFFAOYSA-N	439.245	1.297	50	20	IDGD	
N#Cc1ccc(NNC(=O)C(=O)Nc2ccccc2OCCC(N)=O)c(C(F)(F)F)c1	799840179	GQYQMYAZWYMILQ-UHFFFAOYSA-N	435.362	1.913	50	20	IDGD	
CNC(=O)CNC(=O)c1cccc(NC(=O)C(=O)NNc2cccc(C(F)(F)F)c2)c1	800628513	YDAHKGPTGGUTOI-UHFFFAOYSA-N	437.378	1.263	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)C[C@@H]2CSCCN2C(=O)OC(C)(C)C)cc1	801108000	CSBQNIUDPDMEDY-OAHLLOKOSA-N	436.534	1.824	50	20	IDGD	
COC[C@@H](O)CNC(=O)/C(C#N)=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	802225321	AIVGUQFBEFWVNW-AAKUMTKESA-N	431.880	1.109	50	20	IDGD	
CCS(=O)(=O)N1CCC(C(=O)NNC(=O)Cc2nc(-c3ccccc3)cs2)CC1	802580709	AHPXTRRUIKCLMM-UHFFFAOYSA-N	436.559	1.562	50	20	IDGD	
CCN1CCN(S(=O)(=O)c2ccc(Cl)c(C(=O)NNc3cccc(F)n3)c2)CC1	804768463	DIIZIQIQANZCSS-UHFFFAOYSA-N	441.916	1.957	50	20	IDGD	
COCCN1C(=O)c2ccc(C(=O)NNc3nccnc3C3CCC3)cc2S1(=O)=O	805465434	KQISPVWXYOIARH-UHFFFAOYSA-N	431.474	1.292	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)C(=O)Nc1csc(-c2ccccc2)n1	806974802	UMGRLHJMWJMEOO-UHFFFAOYSA-N	441.425	1.883	50	20	IDGD	
CNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)Nc2ccccc2C)c1Br	807000510	CTOGBMHHLOFVKV-UHFFFAOYSA-N	448.277	1.909	50	20	IDGD	
O=C(NNc1ncccc1F)C(=O)N1C[C@H](C(=O)N2CCCCC2)Oc2ccccc21	807300507	NTOSUBFXNCEVEZ-QGZVFWFLSA-N	427.436	1.471	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN(C)CCn2cc(Br)cn2)cc1OC	808802052	ZTDBMDUBWIGHDK-UHFFFAOYSA-N	440.298	1.056	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)cc2[nH]ccc12	808935445	XLPFKDICBAWSEX-UHFFFAOYSA-N	442.453	1.538	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3ccccc3-n3cnc(C#N)n3)cc2C1	810384444	KWMPJBFTKWGCTN-LBPRGKRZSA-N	449.496	1.725	50	20	IDGD	
CN(C)S(=O)(=O)CCNC(=O)NNC(=O)Nc1ccc(Br)cc1Cl	811978507	ZMTNFAOLADZYOT-UHFFFAOYSA-N	442.723	1.330	50	20	IDGD	
CSCc1cnc(C=NNC(=O)C(=O)NN=Cc2ncc(CSC)s2)s1	814692563	XJZAKRCBOZLYNC-UHFFFAOYSA-N	428.590	1.926	50	20	IDGD	
COCc1cc(NC(=O)C(=O)NNc2cccc(S(C)(=O)=O)c2)cc(C(=O)OC)c1	815558573	HRMKJZAEOBZZFQ-UHFFFAOYSA-N	435.458	1.105	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)C(=O)Nc2cccc3c2COC3=O)c1	815865746	DKLRBMCFYZALIR-UHFFFAOYSA-N	448.229	1.988	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)c2ccc(S(N)(=O)=O)nc2)c1	818767468	JKSIEZVHRGBFEQ-UHFFFAOYSA-N	429.252	1.035	50	20	IDGD	
CCCn1c(C)cc(/C=C(/C#N)C(=O)N2CCS(=O)(=NS(C)(=O)=O)CC2)c1C	820256184	XOBULALPMBQKGI-ATVHPVEESA-N	426.564	1.692	50	20	IDGD	
O=C(c1cc(-c2cccnc2)nc2c1cnn2Cc1cccnc1)N1CC[C@H](B(O)O)C1	864232231	XKVCALOVKDLLLD-KRWDZBQOSA-N	428.261	1.626	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)CSCc2cc(=O)n3ccsc3n2)cc1C	887701277	RTRPOFJPPKWBSC-UHFFFAOYSA-N	432.527	1.832	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)COc2ccc(C(=O)c3ccccc3)cc2)C[C@@H](C)O1	912919894	SOVLNECQBZEPKW-QZTJIDSGSA-N	439.512	1.943	50	20	IDGD	
O=C(NNC(=O)c1ccccc1S(=O)(=O)C(F)(F)F)c1ccc2c(c1)OCCO2	915142993	BUONCLKUZHQFOI-UHFFFAOYSA-N	430.360	1.826	50	20	IDGD	
COc1ccc(NCC(=O)NN=C(C)c2ccc(S(=O)(=O)NCC(=O)O)cc2)cc1	915916171	NATZTFPTLIXQRG-UHFFFAOYSA-N	434.474	1.010	50	20	IDGD	
CCn1cnc2c1c(=O)n(CC(=O)NN=Cc1ccccc1F)c(=O)n2Cc1ccccc1	916332409	VHXXVXFGZIHBDS-UHFFFAOYSA-N	448.458	1.717	50	20	IDGD	
CC(=NNC(=O)[C@@H](C)Oc1ccccc1F)c1ccc(S(=O)(=O)N2CCNCC2)cc1	916334572	CMSXUIROBUUKCU-MRXNPFEDSA-N	448.520	1.727	50	20	IDGD	
CN(CC(=O)NNC(=O)COc1ccccc1F)C(=O)c1ccc(Br)s1	916741350	YTWVSXQNCBKVEM-UHFFFAOYSA-N	444.282	1.948	50	20	IDGD	
O=C(COc1ccccc1CNC(=O)NNC(=O)CC(F)(F)F)NC[C@@H]1CCCO1	918081353	OMVLXQKMJXBOSJ-ZDUSSCGKSA-N	432.399	1.143	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCc2ccc(-n3ccnc3C)nc2)c2ccccc2c1=O	918113263	MABFBAAKBPVIHZ-UHFFFAOYSA-N	446.471	1.450	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)OCC(=O)c2ccc(S(N)(=O)=O)cc2)c1C	918808481	BTBGEZQAVPMNLN-WQRHYEAKSA-N	445.497	1.732	50	20	IDGD	
COc1ccc(/C=C\C(=O)OCC(=O)NNC(=O)c2ccc(OC)c(OC)c2)cc1O	919563758	DXLMJWUAMRLRJM-UITAMQMPSA-N	430.413	1.436	50	20	IDGD	
CNC(=O)COc1ccc(C(=O)NNC(=O)c2ccc(Br)s2)cc1OC	919690423	HPPGAVDHBNXFRG-UHFFFAOYSA-N	442.291	1.719	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCC(=O)Nc2ccc(Cl)cc2)nc1	919782666	BABDMEZZTQKTRT-UHFFFAOYSA-N	440.913	1.687	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1)c1ccccc1O	919809246	KUXDGEAQXXZHRM-CYBMUJFWSA-N	448.457	1.162	50	20	IDGD	
O=C(NN=Cc1cn2cc(Cl)ccc2n1)C(=O)NN=Cc1cn2cc(Cl)ccc2n1	920358472	SZDPNHVTDLGXGK-UHFFFAOYSA-N	443.254	1.889	50	20	IDGD	
COc1ccc(C)cc1-n1ccc(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)n1	920884911	TUSXFPCALYIQHV-UHFFFAOYSA-N	442.501	1.557	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2ccc(Br)cc2)ccc1O	1317901871	BZWPIMWFISAOGK-UHFFFAOYSA-N	429.248	1.565	50	20	IDGD	
CCC(CC)C(=O)N1CCC(NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)CC1	1323722161	NHKYHYWHJIECJC-UHFFFAOYSA-N	438.550	1.461	50	20	IDGD	
CCS(=O)(=O)Nc1cccc(C(=O)NNc2ccccc2S(=O)(=O)N(C)C)c1	1324581977	HBEFXHFKRRPGFF-UHFFFAOYSA-N	426.520	1.455	50	20	IDGD	
Cc1cc(-n2cncn2)ccc1C(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1	1329966404	JUNFTLJDZRHCFZ-UHFFFAOYSA-N	428.493	1.984	50	20	IDGD	
COCc1oncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CO[Si](C)(C)C)C2	1778344023	WNLKRHTVJMEART-YLJYHZDGSA-N	439.585	1.800	50	20	IDGD	
Cc1cccc2cc(C(=O)N3CC[C@@]4(CN(C(=O)CCC(=O)NN(C)C)CCO4)C3)[nH]c12	1778456321	WZBOYVHEVQASIN-HSZRJFAPSA-N	441.532	1.293	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4c(c3)CNC4=O)C2)C1	1778725695	FLEZCJIZCPRWCP-UXHICEINSA-N	440.327	1.610	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccncc2O)C1	1779614717	BERCLCNNKYXDSY-VVFCZOMOSA-N	440.338	1.946	50	20	IDGD	
CCOC(=O)c1cccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](F)Cl)CCO3)c1F	1780110514	KVVDOWRNPIECBA-HNAYVOBHSA-N	430.835	1.980	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1cscn1)C2)[C@H](F)Br	1780771255	HQPVHUBRSTUTLM-IVMMDQJWSA-N	434.331	1.890	50	20	IDGD	
Cc1ccccc1OCC(=O)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781327904	DGAZMAJTCIDDOH-FUHWJXTLSA-N	429.286	1.894	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)n1cncn1)C2	1781904498	YLHUJKAPRMSEMU-ATNYBXOESA-N	442.358	1.527	50	20	IDGD	
O=C(c1c(F)ccc(O)c1F)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1781932390	NKLKZXDWZLZSCI-BBRMVZONSA-N	437.212	1.804	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CSCC(=O)O)C2	1782002558	RJQGWUHJHXWXDC-XHBSWPGZSA-N	437.356	1.102	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ncc(Cl)cn1)C2	1782171282	XNKMULDAXITTEN-PMUMKWKESA-N	431.320	1.511	50	20	IDGD	
C[C@H](C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Br)C2)n1cncn1	1782532326	XLAWEKCGZIHHCZ-BRXULGCHSA-N	432.294	1.044	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H]3CC(c4ccccc4)=NN3)C2)C1	1782601675	BLPMJVKSGAFVDC-KPLVRAHFSA-N	432.952	1.990	50	20	IDGD	
Cc1nn[nH]c1C(=O)N1CCO[C@]2(CCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1	1782864823	UWWNPIVNDQDDOU-OMKLEDIQSA-N	442.426	1.442	50	20	IDGD	
O=C(c1cnc[nH]1)N1CCO[C@@]2(CCN(C(=O)[C@H](Br)Cc3ccccc3)C2)C1	1783019617	YCOPLXRYMLVGGD-OXQOHEQNSA-N	447.333	1.859	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)Cc3cnc(C)s3)CCO2)C1	1783352939	KCBQKBJXQZRKCI-PBHICJAKSA-N	430.368	1.997	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cn(C)nc3C(F)F)CCO2)C1	1783533950	CBMAWWXGZOTYDC-MGPLVRAMSA-N	435.269	1.585	50	20	IDGD	
Cc1cnc2c(C(=O)N3CCO[C@]4(CCN(C(=O)[C@@H](C)Br)C4)C3)cnn2c1	1783534192	RCUWOBPICREJKB-ACJLOTCBSA-N	436.310	1.265	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H]1CC[C@H](C(=O)OC)CC1)CCO2	1783870890	JDIQLQUKPIVJOY-AXHMDWHKSA-N	430.929	1.050	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cc4cnccc4nc3C)CCO2)C1	1783876520	YGRAWYKXRIQHGU-UWJYYQICSA-N	432.908	1.636	50	20	IDGD	
Cc1cc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]3C2)nn1C	1783964307	PUQOFJLAUPNACM-CSFVBSKPSA-N	441.370	1.282	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)c1ncc(F)cc1F	1784766624	UNPHTDWVRCAKFB-JKOKRWQUSA-N	432.265	1.738	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC1(c2ccc(NC(=O)CN3C(=O)CNC3=O)cc2)CCC1	1786641138	KNQWDFGXUARHEH-SFHVURJKSA-N	441.315	1.909	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccnc(C)n3)[C@H]2C1	1787694815	APESFOPBSIFTSM-AYDFFVQHSA-N	425.327	1.552	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cn3cc([N+](=O)[O-])cn3)C[C@@H]21	1789869196	YQZIXNJWQFBRRO-MJFSBKNWSA-N	448.307	1.007	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3CC(c4ccccc4)=NN3)[C@H]2C1	1790545405	OPJKGDSOLARKFL-CAVMOMJPSA-N	432.952	1.750	50	20	IDGD	
CC(C)c1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]3C2)n[nH]1	1791058697	CJCPNFRRPZPIMU-DVZHBHJUSA-N	427.343	1.910	50	20	IDGD	
O=C(CN1CCCCC1=O)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1	1791512909	BZIQAGVKEIWRIN-UHFFFAOYSA-N	449.316	1.127	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1	1791567711	FXAJYXOHTJPVPT-GOSISDBHSA-N	430.697	1.368	50	20	IDGD	
Cc1cnn([C@H](C)C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)Br)C[C@@H]32)c1	1791597902	FIVSFQQQWGYSFR-OWYFMNJBSA-N	427.343	1.516	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Oc1cccnc1)C2	1792873007	IOHNQXJBXQYIHB-WVCIDPQESA-N	440.338	1.470	50	20	IDGD	
CC(C)(C)OC(=O)NCCOCCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](O)CCl)C2	1793417029	PMERWXFRZHCFHK-QKPAOTATSA-N	447.960	1.156	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](CC)N(CC)CC	1793461601	GISIYNOSSZRKPZ-NNXHMXCWSA-N	432.403	1.870	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(Cl)nc1F)c1ccc(B(O)O)cc1	1794535495	HVEKYYLMYGPPRP-QDMKHBRRSA-N	431.660	1.120	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@]1(F)CCCCC1(F)F)C2	1796189050	QIGKNXZHBSWREI-AXVVYFOYSA-N	438.255	1.536	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1(c3ccc(F)cc3)CC1)C2	1796190051	SIBUDWUPILBZEC-WKCHPHFGSA-N	436.292	1.489	50	20	IDGD	
CC(C)(C)OC(=O)NCC1(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Cl)CC1	1796361800	UPOXUCYCEIUSSX-CRWXNKLISA-N	433.908	1.415	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1=NN(c2ccccc2)C(=O)C1	1796480652	DCGINZXJMULGHR-QHHYFVSCSA-N	432.908	1.386	50	20	IDGD	
Cc1ncccc1CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnccc1C(=O)NN	1798440618	FRKGOXISPBXMHC-BCDXTJNWSA-N	436.516	1.273	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1nc2ccc(F)cn2n1	1800134250	IBPOBWAUUVZVSG-WZTYKQCMSA-N	444.294	1.308	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nc3cc(C)c(C)cc3[nH]1)C2	1800976741	GCFVKXUFIRCTPH-BASYENTBSA-N	434.924	1.637	50	20	IDGD	
COC(=O)c1ccc(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CCC(=O)NN(C)C)cc1	1802339659	FYQBCKZVBJDFJX-REPLKXPHSA-N	444.532	1.027	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(F)cc(Cl)c1)c1cccc(B(O)O)c1	1803666529	NGQRWXSXMJHABJ-REPLKXPHSA-N	430.672	1.725	50	20	IDGD	
O=C(Cn1nnc2ccccc21)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1	1804014795	GNNYUKLWCSNKRI-QKYXUNIQSA-N	442.907	1.132	50	20	IDGD	
O=C(CSC1CCCC1)N1CCCC2(CCN(C(=O)c3ccc(B(O)O)cc3)CC2)C1	1805983562	JTCWNTLTTAGFGG-UHFFFAOYSA-N	444.406	1.887	50	20	IDGD	
CCNC(=S)NCC(=O)N1CC[C@H](CNC(=O)[C@H](Cl)CC)[C@H]1c1cccnc1	1808277361	DFVBIOYGKKCJLG-BFYDXBDKSA-N	425.986	1.589	50	20	IDGD	
COCCC(=O)N1CC[C@H](CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@H]1c1cccnc1	1808415594	ZDRRKRBBRGAIPE-MFWRVWTKSA-N	440.504	1.258	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC2(CCCN(C(=O)c3cncs3)C2)CC1	1808705747	WRMGATNRYNMAEB-UHFFFAOYSA-N	428.518	1.300	50	20	IDGD	
Cc1ocnc1C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1	1810302615	LLYNFOGCTTXHEI-BEFAXECRSA-N	449.471	1.010	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1ccccc1F	1811673406	NGQBHNPMJDZQOS-XMSQKQJNSA-N	447.275	1.534	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)[C@@H](N)Cc2cccnc2)[C@@H]1c1cccnc1	1813030562	JJIBJBOFDVHESF-FUMNGEBKSA-N	445.951	1.306	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2cc3ncccn3n2)[C@H]1c1cccnc1	1813031456	VMYNLBXZYXUVEO-GJYPPUQNSA-N	442.907	1.698	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)CSCC(=O)O)[C@H]1c1cccnc1	1813033857	VJEYCMDEUOIGSS-KEYYUXOJSA-N	429.926	1.159	50	20	IDGD	
C[C@@H]1CCC[C@@H]1C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1813070650	LDTDWOSSEDTNAT-NSAZKJPHSA-N	429.565	1.897	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)CS(C)(=O)=O)sc2C1	1814327500	FOKVHALWTAOFIU-RKDXNWHRSA-N	438.369	1.273	50	20	IDGD	
CN(CC(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](O)CCl)n[nH]1)C(=O)OC(C)(C)C	1814869561	SJORPPZKHIWVEF-UONOGXRCSA-N	443.932	1.868	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)C2CCC3(CC2)OCCO3)[nH]n1)[C@H](O)CCl	1814874687	AGGYCCKPSNSXBJ-HZPDHXFCSA-N	440.928	1.935	50	20	IDGD	
C=CCSCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1815654289	WQRLSLWBBNDPSY-INIZCTEOSA-N	443.533	1.633	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)Cn3cncn3)sc2C1	1815670318	HRKAPFCXLAIYFA-VHSXEESVSA-N	427.328	1.520	50	20	IDGD	
Cc1ccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)nc1C	1816235649	HOFMUFUIIWOCPT-FQEVSTJZSA-N	447.304	1.721	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(O)nc(O)n3)sc2C1	1817104121	VPRKOBJDADQQTJ-VGDKGRGNSA-N	446.316	1.806	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CN2CCNC2=N)n[nH]1	1817299080	WWXABZHQPNTHPK-WCQYABFASA-N	440.346	1.415	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(F)c2)[nH]n1)c1ccc(B(O)O)cc1	1817472730	ULPADIUTHBTDDO-IBGZPJMESA-N	436.252	1.848	50	20	IDGD	
O=C(O)c1cnncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)C(Cl)Cl)CC2	1820502428	MKUQDQWHCXRXJP-ZCFIWIBFSA-N	430.273	1.661	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC[C@H]1c1cc(NC(=O)Cn2ccncc2=O)n[nH]1	1821659269	YLWQNYKYFAKBDS-YPMHNXCESA-N	437.298	1.442	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)[C@H]1[C@H]2SC=C[C@H]21	1821707116	KIJXAQXVOAPUKZ-WQCNXYOZSA-N	438.318	1.271	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CN(C)C(=O)C(=O)O)n[nH]1	1821712982	IESJZTMYUGHPNG-YPMHNXCESA-N	427.889	1.352	50	20	IDGD	
COc1ccc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@H](O)CCl)CC3)cc1OC	1822102609	WDIBSTNIIIYWTB-DGCLKSJQSA-N	439.921	1.986	50	20	IDGD	
CN1CCC(CC(=O)N2CCCC[C@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)CC1	1822412797	TUMMANOHSXDJJY-SFHVURJKSA-N	447.584	1.507	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)cc(O)n1	1822413999	KAGKSCKSCIJUND-INIZCTEOSA-N	443.508	1.498	50	20	IDGD	
COC(=O)C12CC(C(=O)N3CCC([C@@H]4CCCCN4C(=O)[C@H](O)CCl)CC3)(C1)C2	1824184709	CUFAWUAHSIARQP-QIRGFQQVSA-N	426.941	1.549	50	20	IDGD	
Cc1n[nH]c(C)c1CC(=O)N[C@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1	1826088780	OQLNADHKMIKXGL-ZDUSSCGKSA-N	447.565	1.011	50	20	IDGD	
O=C(O)c1cnncc1C(=O)N[C@@H]1CCc2nc(NC(=O)C(Cl)Cl)sc2C1	1826099291	FYYITUDLBMOVHI-ZCFIWIBFSA-N	430.273	1.661	50	20	IDGD	
O=C(c1cc(O)nc(O)n1)N1CCC([C@@H]2CCCCN2C(=O)CCBr)CC1	1826356628	AKBBCOKPZNTBIU-AWEZNQCLSA-N	441.326	1.906	50	20	IDGD	
C=CCO[C@@H](C)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1	1828923962	ZJKFEQHSRIAOCP-OXJNMPFZSA-N	443.548	1.510	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830366508	RFYUUUXGLZOTHM-GUYCJALGSA-N	439.778	1.881	50	20	IDGD	
Cc1nc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)co1	1830537890	RUTRPEYTYLRBMK-YVEFUNNKSA-N	430.299	1.084	50	20	IDGD	
Cc1ccc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)o1	1830545428	JHGNHJCRCFPYJH-LIRRHRJNSA-N	443.338	1.618	50	20	IDGD	
O=C(CCCc1ccccc1F)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1830719486	DZIGPAYFPUVTBD-NQIIRXRSSA-N	442.915	1.205	50	20	IDGD	
Cc1n[nH]c(C)c1CC(=O)N1CCC([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1	1831873923	FUKCXGQUSRNAPN-HXUWFJFHSA-N	446.596	1.562	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCCC(F)(F)F)CCO2)C1	1832264964	GRAVVRFJOAYBIF-CJNGLKHVSA-N	430.851	1.429	50	20	IDGD	
Cc1nc(CC(=O)N2CCO[C@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)cs1	1832963077	LRFNNAHPORJOFQ-LJQANCHMSA-N	429.970	1.715	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)c1cc(Cl)cnc1O	1833022777	OHMOBJOGKRRIOE-INIZCTEOSA-N	445.347	1.226	50	20	IDGD	
Cc1ccccc1NCC(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)CCl)CC2)CC1	1833310859	WFQXYXNPLSHLBT-FQEVSTJZSA-N	436.984	1.578	50	20	IDGD	
C#CCO[C@H](C)C(=O)NC1CCN(C2CCN(C(=O)[C@H](C)Br)CC2)CC1	1833469029	JUJULLUWRSMRNT-LSDHHAIUSA-N	428.371	1.380	50	20	IDGD	
Cc1cnc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)cn1	1834084233	KASBRMCUZWWFNI-ROUUACIJSA-N	431.320	1.091	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)c1cnn2ccccc12	1835307886	BAWAESOYPHZQHK-LJQANCHMSA-N	433.940	1.119	50	20	IDGD	
C=C[C@H](O)C(C)(C)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](Cl)COC)CC2)CC1	1835718182	WCDYCKXUJABDMX-ROUUACIJSA-N	429.989	1.385	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)C[C@@H](N)c3cccnc3)CCO2)C1	1835824021	HDZXYZSHIIVHRF-WAOWUJCRSA-N	438.956	1.335	50	20	IDGD	
O=C(c1cccc2nc[nH]c12)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836717837	LSHHSIGSCYQHBG-GOSISDBHSA-N	434.924	1.775	50	20	IDGD	
CCC(=O)N[C@H](C)C(=O)N1CCC(OC2CCN(C(=O)[C@H](C)Br)CC2)CC1	1836817732	IRLMXKBXYDYVTP-UONOGXRCSA-N	446.386	1.683	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cc4cn[nH]c4cn3)CC2)CC1	1838356347	AGPLWRDJCUYHEA-QGZVFWFLSA-N	449.939	1.824	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(C)nc3C)CCO2)C1	1838363624	DGHGESAAQODHKZ-PXNSSMCTSA-N	425.913	1.022	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C#Cc3ccccc3)C2)C1	1839151405	QNFDCTKDHJRGCQ-NHCUHLMSSA-N	439.339	1.731	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](S)C(C)C)C2)C1	1839963108	ZZESKWVOAHAPAN-ZQIUZPCESA-N	437.400	1.571	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCCCn3cccc3)C2)C1	1840153389	MTEKOGHHRZUZJD-GHTZIAJQSA-N	441.956	1.369	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)C3CCC(O)CC3)CCO2)C1	1840274281	BYYVEAUCLLZRGR-BURPLHJFSA-N	437.364	1.230	50	20	IDGD	
O=C(C1CCSCC1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1840925039	JVTBEWADQSNLSF-BBRMVZONSA-N	439.347	1.277	50	20	IDGD	
CCN1CCC(C(=O)N2CCO[C@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)CC1	1840926056	NFPOZJNTOZKJQC-OAQYLSRUSA-N	429.989	1.440	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC12CN(C(=O)[C@@H]1CC[C@@H]3CCC(=O)N3C1)C2	1841288269	KGPIQHAGLXSBTR-RBSFLKMASA-N	426.355	1.622	50	20	IDGD	
C[C@H](Br)C(=O)N1CC2(CCCN2C(=O)[C@@H](CCN)NC(=O)OC(C)(C)C)C1	1842912537	ZUESXSQRXSAMLA-QWHCGFSZSA-N	447.374	1.215	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1cccc3ccnn13)C2	1843416738	VDKABIWDOISTSO-MFKUBSTISA-N	433.472	1.285	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCCC12CN(C(=O)/C=C/C(=O)NCc1ccccc1)C2	1844377051	PVNJNUPMPOXJGX-ZHACJKMWSA-N	429.593	1.914	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@H](C)NS(=O)(=O)c1ccc(C)cc1)C2	1845162810	PHERKQCVJQOEAH-DOTOQJQBSA-N	441.981	1.883	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)c2n[nH]c3c(Cl)cccc23)C1	1845592215	DLUDRVYWPNFXMT-UHFFFAOYSA-N	432.912	1.406	50	20	IDGD	
C=C[C@@H]1C[C@]1(NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)[C@@H](O)CCl)C2	1847081137	LPQOLJPHUPXXOE-LAPQFRIASA-N	427.929	1.259	50	20	IDGD	
N#Cc1ccc(CN2CCCN(CC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)CC2)cc1	10084818	UXVPBPWKTJTPQO-UHFFFAOYSA-N	436.472	1.435	50	20	IDGD	
O=C(CCNS(=O)(=O)c1cccc(Cl)c1)NNC(=O)c1cc(Cl)ccc1O	10627203	ADJDVJKMEBEEFH-UHFFFAOYSA-N	432.285	1.829	50	20	IDGD	
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)[C@H](C)Oc1ccccc1F	23567127	JIYISWWYZBFQNY-DJJJIMSYSA-N	426.448	1.969	50	20	IDGD	
O=C(NNC(=O)c1ccc(CNC(=O)C23CC4CC(CC(C4)C2)C3)cc1)C(=O)NC1CC1	45580442	XVGCYZVYUQYRPB-UHFFFAOYSA-N	438.528	1.559	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)c2nn(-c3ccccc3)c3c2CCC3)c2ccccc2c1=O	115404227	YDQUTJZFRDGJBJ-UHFFFAOYSA-N	428.452	1.683	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)NCCN2CCO[C@@H](C)C2)c2ccccc2c1=O	726262054	XBWJDWCZOMCSTA-INIZCTEOSA-N	444.536	1.251	50	20	IDGD	
COc1ccc(Cl)cc1N1CC[C@@H](NC(=O)NNC(=O)CNC(=O)c2ccco2)C1	726719378	RMRQWICQGNTROX-CYBMUJFWSA-N	435.868	1.281	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)NCC(=O)N(C)CCc3ccccn3)cc2C1	727473968	VCTKIJYLNRJPIY-AWEZNQCLSA-N	429.546	1.913	50	20	IDGD	
CCc1ccc([C@@H](C)C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1	727704475	MUJYMCPCOMJTLK-MRXNPFEDSA-N	445.541	1.835	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCOc2ccccc21)c1cccc(S(=O)(=O)N2CCCC2)c1	728177087	SZZQFXJUNJZELQ-GOSISDBHSA-N	429.498	1.798	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)CNC(=O)c2ccc(Br)s2)cc1	728204677	HNVWYEOKUOZKJD-UHFFFAOYSA-N	425.308	1.808	50	20	IDGD	
CC(C)C(=O)Nc1ccc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1	728322816	MVHNYDXYEKWDMH-SFHVURJKSA-N	441.440	1.425	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)Cc2ccc(-n3cnnn3)cc2)c1	728527455	JSHDCPSQTYRDOE-UHFFFAOYSA-N	431.250	1.437	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(OCC(=O)NNC(=O)CC(C)(C)C)c([N+](=O)[O-])c1	728608285	YBONFYCPWZYTNN-UHFFFAOYSA-N	444.510	1.588	50	20	IDGD	
CC(=NNC(=O)Cn1ccc2ccccc21)c1ccc(S(=O)(=O)N2CCNCC2)cc1	729637506	CUTHVFIGWIHRSX-UHFFFAOYSA-N	439.541	1.776	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN(C(=O)c2ccccc2)C1)C1CCN(c2ncccn2)CC1	731169643	RXRLVFFWYWUXSH-IBGZPJMESA-N	436.516	1.393	50	20	IDGD	
CCOC(=O)C1=NN(c2ccccc2)[C@@H](C(=O)NNC(=O)NCCc2cccs2)C1	731185124	QJGITWCDYZGGLE-QGZVFWFLSA-N	429.502	1.819	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1ccccc1F	731322826	PWYHEQABFABUSF-CQSZACIVSA-N	435.477	1.411	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)NCCN/C(O)=C1/N=CC=CC1=O	732466462	OGWPKLRRJDXCLN-ICFOKQHNSA-N	440.485	1.589	50	20	IDGD	
O=C(NCCCN1C(=O)NC2(CCCC2)C1=O)NNC(=O)c1cnn(-c2ccccc2)c1	733339485	WPQWCBRMCPWPHR-UHFFFAOYSA-N	439.476	1.071	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)NCCN2CCN(C(=O)C3CCCCC3)CC2)cc1	733351055	MDVPNGPSXHMYPP-UHFFFAOYSA-N	429.565	1.918	50	20	IDGD	
COC(=O)COc1cccc(CNC(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)c1	734670399	CWKJLOQFTDHXHY-UHFFFAOYSA-N	428.445	1.324	50	20	IDGD	
COc1ccc(CN2CC[C@H](NC(=O)NNC(=O)COc3ccc(F)cc3)C2=O)cc1	734685895	XBNBABUBUFQUAS-SFHVURJKSA-N	430.436	1.345	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)[C@H](O)C(C)(C)C)c2)cc1	735837038	PEIJMMWSVJHKOH-KRWDZBQOSA-N	435.502	1.664	50	20	IDGD	
C[C@H]1Cc2cc(S(=O)(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)cc(Cl)c2O1	736063923	OCUKVSQILKBEAZ-JTQLQIEISA-N	434.865	1.262	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNS(=O)(=O)C1=Cc2ccc(OC(F)F)cc2CC1	740812492	LPDUQMTWKYEHLE-UHFFFAOYSA-N	431.461	1.831	50	20	IDGD	
CC(=O)NCCc1ccc(S(=O)(=O)NNC(=O)c2cccc(Br)c2)cc1	743264412	SNRXDDYJXBEUPO-UHFFFAOYSA-N	440.319	1.751	50	20	IDGD	
CN1CCN(c2ncccc2CNC(=O)NNC(=O)Nc2ccc(OC(F)F)cc2)CC1	743564593	CFUHIVCLXQXCJW-UHFFFAOYSA-N	449.462	1.971	50	20	IDGD	
COc1cc(CNC(=O)NNC(=O)c2cccc(Br)c2)ccc1OCCO	743687961	SUKBXEAADBODLK-UHFFFAOYSA-N	438.278	1.973	50	20	IDGD	
O=C(NNC(=O)c1cccc(Br)c1)Nc1cccc(CN2C(=O)CNC2=O)c1	743814506	NGHOMQQJFULJOX-UHFFFAOYSA-N	446.261	1.967	50	20	IDGD	
COc1ccc(-c2noc(CN3CCN(CC(=O)NNC(=O)C(C)(C)C)CC3)n2)cc1	744385834	RBAKOJNCXLVFSV-UHFFFAOYSA-N	430.509	1.056	50	20	IDGD	
CC(=O)N1C=Cc2ccccc2[C@H]1CC(=O)OCC(=O)NNC(=O)c1cccc(C#N)c1	744522410	GVYVFINZEFIZIF-HXUWFJFHSA-N	432.436	1.827	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)Cn2cnc3c(oc4ccccc43)c2=O)c1	744583554	FKVBOLVCBOSLCU-UHFFFAOYSA-N	445.391	1.019	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)COc2cccc(NC(=O)C3CC3)c2)c1	744697511	GJDJOSHJVMHUCH-UHFFFAOYSA-N	436.424	1.290	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)cc1	744735612	VWQSRPHBOAPOJL-UHFFFAOYSA-N	434.368	1.270	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)c1ccc(F)c(S(=O)(=O)Cc2ncon2)c1	746241135	UZEJQKNXIKFBBW-UHFFFAOYSA-N	434.405	1.266	50	20	IDGD	
COC(=O)c1cn(CC(=O)NNc2nc3ccccc3c(=O)n2-c2ccc(C)cc2C)nn1	747392946	NETLTJIUJBWEFQ-UHFFFAOYSA-N	447.455	1.524	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)Nc2nccs2)cc1)C1(C(=O)NC2CC2)CCC1	747943395	HUXVLRIMXBPIKU-UHFFFAOYSA-N	435.531	1.836	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCC(=O)N(Cc2ccccc2)[C@@H]1c1ccccc1)C(=O)N1CCCC1	748239985	OSCWIJHAEHVMTA-RBBKRZOGSA-N	448.523	1.936	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1Cl	748640014	LJVDQZQYORUASL-UHFFFAOYSA-N	445.906	1.325	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@](F)(C(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)C1	748867108	VGKAOTKDIJFZRE-SFHVURJKSA-N	444.485	1.592	50	20	IDGD	
Cc1ccc2c(CCNC(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)c[nH]c2c1	749419425	GMLIVNFUEHYDRW-UHFFFAOYSA-N	443.529	1.913	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)NCCNC(=O)C(C)(C)C)c2ccccc2c1=O	749420045	GREWWPGSHOKTOE-UHFFFAOYSA-N	444.536	1.693	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)CSc2nccn2C(C)(C)C)c2ccccc2c1=O	749559611	BBJAOGSJVZHIHR-UHFFFAOYSA-N	428.518	1.921	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)N[C@@H]2CCN(c3cccc(Cl)c3)C2=O)nc2ccccc21	750669327	AJINIOQYZMZEFS-MRXNPFEDSA-N	440.891	1.905	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NCC2CCN(CC(=O)NC(C)(C)C)CC2)cc1C	751111586	QJIGFULZFMVZOL-UHFFFAOYSA-N	447.580	1.639	50	20	IDGD	
CC(C)(C)NC(=O)CN1CCC(CNC(=O)NNC(=O)c2ccc3c(c2)OCCO3)CC1	751112598	YODOZMDAYBMXSD-UHFFFAOYSA-N	447.536	1.029	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)c1ccc2c(c1)C[C@@H](c1ccccc1)OC2=O	751204957	TVKRNKGZVIWGJS-IBGZPJMESA-N	433.420	1.925	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3occc3Br)cc2)CC1	751389803	ZPZJHXOVRRNARU-UHFFFAOYSA-N	443.323	1.735	50	20	IDGD	
Cc1oc(-c2cnn(C)c2)nc1C(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	752520583	CSVVJNLVHMHDFC-UHFFFAOYSA-N	447.496	1.727	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)c1nc(Cc2ccccc2)no1	753039660	UOGSGYWKCFNVSA-ZDUSSCGKSA-N	433.432	1.341	50	20	IDGD	
Cc1ccc(C)n1-c1ccc(C(=O)NNC(=O)NC[C@@H]2CCN(S(C)(=O)=O)C2)cc1	753670977	PPMMZVFIOZIBJQ-INIZCTEOSA-N	433.534	1.320	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)N[C@@H]1CCN(Cc2ccc(C#N)cc2)C1=O	753725387	YBCFMOJABLXFQD-LJQANCHMSA-N	435.484	1.631	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N[C@H]2CC[C@H](O)CC2)cc1	753728363	LYUITHDQKBHDBZ-GNTDGTKGSA-N	437.500	1.761	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)NCCN3C(=O)[C@H]4[C@H]5C=C[C@@H](C5)[C@H]4C3=O)cc2C1	755082146	KTRHRGBVKNGJCV-HHDFAXHISA-N	442.541	1.624	50	20	IDGD	
COc1ccc(C)cc1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	755390149	WVVDUFBJMIMGEA-UHFFFAOYSA-N	448.501	1.491	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2ccc(C)c(-n3cnnn3)c2)c2ccccc2c1=O	755685806	FAFPBSZIFMMYFN-UHFFFAOYSA-N	433.432	1.167	50	20	IDGD	
COC(=O)N(C)Cc1ccc(NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1	756612171	UQMQGSPYIASKOE-UHFFFAOYSA-N	441.492	1.744	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)Nc1ccc(OC)c(S(=O)(=O)NC2CC2)c1	756682877	QJQDLQFWKZUYMP-UHFFFAOYSA-N	434.474	1.611	50	20	IDGD	
Cc1nn(C)c(OCC(F)(F)F)c1C=NNC(=O)c1csc(N2CCOCC2)n1	756824834	XRCBVYBQBHUCRG-UHFFFAOYSA-N	432.428	1.727	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)[C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])o2)c(OC)c1	757177018	MKVYGAYLVJFSQY-CYBMUJFWSA-N	432.389	1.731	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2cncc(C(=O)OC)c2)c1	757720439	DLGSXRRKQHEVHS-UHFFFAOYSA-N	449.489	1.365	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)c1ccc(-n2nccc2-c2ccc(F)cc2)cc1	758040047	NICWRSIZSVPKDS-CYBMUJFWSA-N	445.476	1.377	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NC[C@@H]1CSCCN1Cc1ccccc1	758958712	WTRCABGLOPUOCZ-MRXNPFEDSA-N	447.586	1.426	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)c1cn(Cc2cccc(F)c2)nn1	759179372	CNXAPOJSHGLUBY-UHFFFAOYSA-N	430.465	1.663	50	20	IDGD	
CCCNC(=O)NNC(=O)[C@]12CCC(=O)N1c1ccccc1C(=O)N2Cc1ccccc1	759622623	VNHQITWCHZCWAI-QHCPKHFHSA-N	435.484	1.906	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)COc2ccc(I)cc2)nc1	759726540	ZXCSAKCUPYFDPV-UHFFFAOYSA-N	427.198	1.995	50	20	IDGD	
COc1cccc(C(=O)NNS(=O)(=O)c2ccc(Br)c([N+](=O)[O-])c2)c1O	760344342	LLZSNBJUAIQRHR-UHFFFAOYSA-N	446.235	1.695	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(F)(F)[C@H](C(=O)NNc2nccc(N3CCOCC3)n2)C1	760858371	CBDCPTZGIQCYCU-ZDUSSCGKSA-N	442.467	1.649	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)c2ccccc2c1=O	762542230	BWZRSJCSRGXIHU-UHFFFAOYSA-N	427.392	1.720	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1)c1cnc2c(c1)c(O)nc(=O)n2C1CC1	763173166	LILQTIJXEPYLNZ-UHFFFAOYSA-N	449.402	1.436	50	20	IDGD	
C[C@@H](c1cccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)c1)N1CCOCC1	763547573	FFKHUZNSVBIPDW-AWEZNQCLSA-N	440.456	1.208	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(-c3nnco3)ccc2C)cc1OC	763549984	CRSWCLDEUFHNIA-UHFFFAOYSA-N	425.401	1.462	50	20	IDGD	
CC(C)(C)Oc1cc(F)ccc1NC(=O)C(=O)NNC(=O)[C@H]1COc2ccccc2O1	763572573	SCGGAYQTEQWIGG-QGZVFWFLSA-N	431.420	1.929	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)C(=O)Nc2nc3c(s2)COCC3)c1	763598212	XIFGHLRDDJOZGK-UHFFFAOYSA-N	432.502	1.813	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2ccc(C)c(N3CCOC3=O)c2)c1	763651113	UOVUUTSDMIGKRW-UHFFFAOYSA-N	440.456	1.733	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc3nc(C(F)F)[nH]c3c2)cc1	763659324	MECCGZGQTPCSSL-UHFFFAOYSA-N	433.371	1.674	50	20	IDGD	
Cc1cc(Br)ncc1NC(=O)C(=O)NNC(=O)COc1ccc(Cl)cc1	763695424	UJIZZDPAWVEIAB-UHFFFAOYSA-N	441.669	1.971	50	20	IDGD	
O=C(CN1CCCc2ccccc21)NNC(=O)C(=O)Nc1cccnc1N1CCCCC1	763728242	KQXJRPQIOLKXDY-UHFFFAOYSA-N	436.516	1.611	50	20	IDGD	
CCc1c(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)cnn1CC(C)C	763746466	XKNPKDLHJIKPDD-UHFFFAOYSA-N	426.521	1.640	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)C(=O)Nc2cc(CC)on2)c2ccccc2c1=O	763820598	LGOIDEPELMNLNW-UHFFFAOYSA-N	440.460	1.537	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(Br)c2)c(O)n1	763883789	QQOWSKLYWPJTPM-JTQLQIEISA-N	437.250	1.412	50	20	IDGD	
Cc1cc(C(=O)N2CCCC2)ccc1NC(=O)C(=O)NNC(=O)[C@H]1Cc2ccccc2O1	764167554	KSURPAYVYPBJSJ-LJQANCHMSA-N	436.468	1.321	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)c1cc2c(F)cc(Br)cc2[nH]1	764344497	DVMKAZSHTZJTAU-UHFFFAOYSA-N	434.225	1.656	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl	764345967	OPUYGPLGVVPTQY-UHFFFAOYSA-N	428.792	1.834	50	20	IDGD	
COC(=O)c1cc(F)c(F)cc1NC(=O)C(=O)NNC(=O)C(F)(F)Oc1ccccc1	764379582	FNPHIBKOLPOTDH-UHFFFAOYSA-N	443.309	1.509	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1)C(=O)Nc1ccc(-n2ccnc2)nc1	764389066	WHEMUKJRJKLCBH-UHFFFAOYSA-N	434.391	1.196	50	20	IDGD	
Cc1cc(OCc2cccc(F)c2)ccc1NC(=O)C(=O)NNC(=O)[C@@H]1COCCO1	764433285	MEAGCFLQBNPAFH-SFHVURJKSA-N	431.420	1.214	50	20	IDGD	
CCCCN(C)S(=O)(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	765119434	QIFBZFMFDNLZSS-UHFFFAOYSA-N	431.990	1.055	50	20	IDGD	
O=C(CSc1nnc(-c2ccco2)n1-c1ccccc1)NNC(=O)N1CCOCC1	765332425	XTLHKHWOHABXJE-UHFFFAOYSA-N	428.474	1.692	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NCC(=O)NNC(=O)c1cc2c(s1)CCCCCC2	766330925	ZJVJLTADWMYNSI-UHFFFAOYSA-N	438.550	1.809	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)CCc3c(C)noc3Cl)CC2)cc1	766650578	WPTJHLVGYYKYFF-UHFFFAOYSA-N	433.940	1.843	50	20	IDGD	
CCOC(=O)c1cnc(C)c(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)c1	767644667	WFAHEHIRUVDMQD-UHFFFAOYSA-N	448.501	1.345	50	20	IDGD	
CC(C)c1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2F)n(-c2ncccn2)n1	768234598	VUDVTDZPYJVVLR-UHFFFAOYSA-N	441.423	1.090	50	20	IDGD	
Cc1nc2[nH]n(C)c(=O)c2c(C)c1CC(=O)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	768276541	JXFNGHBVSZHPAD-UHFFFAOYSA-N	437.435	1.411	50	20	IDGD	
CCN(CC)CCOc1ccccc1CNC(=O)NNc1nc(O)c2cnn(C)c2n1	770341439	NGTYVLVZLFEBOC-UHFFFAOYSA-N	428.497	1.616	50	20	IDGD	
O=C(NNC(=O)[C@H]1CC(=O)N(c2c(F)cccc2F)C1)C1CCN(c2ncccn2)CC1	770719032	KCVYUMMXZPHDNT-AWEZNQCLSA-N	444.442	1.172	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)c3cnn(-c4cccc(Br)c4)c3)nc21	770972805	VFMDTNZGCGEHKD-UHFFFAOYSA-N	429.238	1.774	50	20	IDGD	
CN1CCN(c2ccc(C=NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)cc2)CC1	771556232	XGEYGFHAPWAJPD-UHFFFAOYSA-N	429.546	1.453	50	20	IDGD	
Cc1cccc([N+](=O)[O-])c1C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	772384524	GBBDRODVJMQBMF-UHFFFAOYSA-N	425.445	1.122	50	20	IDGD	
O=C(C[C@@H](O)c1cccc(F)c1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	772556123	USGFPLIZLUCOPK-GOSISDBHSA-N	435.477	1.495	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@H]12	772969218	KQGLFKGHSBNNQV-SIUGBPQLSA-N	440.953	1.981	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)C(=O)Nc1ccc(Br)cn1	773531139	KRTJKEOSXSQSGT-UHFFFAOYSA-N	445.233	1.135	50	20	IDGD	
COCCCS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccccc2[N+](=O)[O-])cc1	773654423	BBIBLXATEODTRS-UHFFFAOYSA-N	436.446	1.487	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2nccnc2C(C)C)cc1-n1nnnc1C1CC1	773998322	QPKSNMWXUDONHA-UHFFFAOYSA-N	437.464	1.544	50	20	IDGD	
CC(C)N1C(=O)C[C@H](C(=O)NNc2ccc(C(N)=O)nn2)[C@@H]1c1ccc(Cl)c(F)c1	776488405	NONVBTAFJXCBOY-GTNSWQLSSA-N	434.859	1.809	50	20	IDGD	
COC(=O)N1CCC([C@@H](C)NC(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)CC1	776845347	XLAVLAYCLLVDPU-GFCCVEGCSA-N	438.481	1.523	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)N[C@H]1CCN(c2ccc(F)c(Cl)c2)C1=O	777753339	WZGBEUKQIRHSNX-INIZCTEOSA-N	444.854	1.805	50	20	IDGD	
C[C@@H](NC(=O)CC(C)(C)C)C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	778292876	DSMFZSRQIXSMSK-CQSZACIVSA-N	438.550	1.173	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)CN2C(=O)N[C@@](C)(c3ccc(C)cc3)C2=O)nc1C	778423504	DLNWEDLNQGKLJE-NRFANRHFSA-N	440.460	1.180	50	20	IDGD	
C[C@H](NC(=O)OC(C)(C)C)[C@H]1CCN(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)C1	778589698	SVNATMCKNFXUFA-ZFWWWQNUSA-N	444.496	1.252	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ccccc2OC(F)(F)F)cc1OCC(N)=O	778802166	CMBYOIUEFVVNTP-UHFFFAOYSA-N	442.350	1.540	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)CC(=O)NCC(F)(F)F)c2ccccc2c1=O	779646684	RNXNHCBCVLPJIU-UHFFFAOYSA-N	441.410	1.416	50	20	IDGD	
CCOCCCn1c(NNC(=O)c2cnc(C(=O)OC)cn2)nc2ccccc2c1=O	779666930	PRRZCOSXIBVNEY-UHFFFAOYSA-N	426.433	1.157	50	20	IDGD	
O=C(NNC(=O)N1CC[C@H](COc2ccccc2)C1)c1csc(N2CCOCC2)n1	779963630	BHMZFRPYYDZHCG-HNNXBMFYSA-N	431.518	1.735	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)[C@@H]2CC(=O)N(c3ccc(F)c(C)c3)C2)n1	780178913	AONURWQQSUUNPQ-CYBMUJFWSA-N	448.476	1.185	50	20	IDGD	
O=C(N[C@@]1(C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)CCOC1)OCc1ccccc1	780848262	BMLFAAWSPHGOJQ-FQEVSTJZSA-N	428.401	1.441	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)[C@@H]2C[C@]23CCN(C(=O)OC(C)(C)C)C3)cc1	781285845	RSTBFSBHPKQRSM-AOMKIAJQSA-N	431.489	1.946	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NCc2ccccc2CN2CC[C@H](O)C2)cc1C	781949293	AVDWZEJYAQVEOA-FQEVSTJZSA-N	426.517	1.779	50	20	IDGD	
N#Cc1cccnc1-n1cc(NC(=O)C(=O)NNc2ccc(Cl)cc2[N+](=O)[O-])cn1	783289308	JVIXCLZNMUATSE-UHFFFAOYSA-N	426.780	1.782	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)C(=O)Nc1cc(Cl)ccc1OC1CCCC1	784004128	IKDNOWUOTOHMPY-UHFFFAOYSA-N	448.863	1.770	50	20	IDGD	
Cc1nc(Cn2nnc(C(=O)NNC(=O)c3cc(C)n(-c4ccccc4)c3C)c2C)no1	784697638	LLDDEFSXIKMXEM-UHFFFAOYSA-N	434.460	1.809	50	20	IDGD	
C[C@@H]1CN(Cc2cccc(NC(=O)C(=O)NNc3ccnc(N(C)C)n3)c2)C[C@@H](C)O1	784969506	NCLWLWPEYOTGCK-HUUCEWRRSA-N	427.509	1.234	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)C(=O)Nc1cccnc1Oc1ccccc1	785066546	DLKNIKDVMSZFCZ-UHFFFAOYSA-N	430.424	1.850	50	20	IDGD	
COc1ccc2nc(NNC(=O)C(=O)Nc3ccc(S(C)(=O)=O)nc3)c(C)cc2c1	785163358	DHWHPODUYYYGCD-UHFFFAOYSA-N	429.458	1.432	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)[C@@H]1[C@H](C(F)(F)F)[C@H]2CC[C@H]1O2	785597100	GIRWAIJTYADEMW-LUYZLQTOSA-N	449.451	1.507	50	20	IDGD	
Cc1nnc(-c2ccccc2C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)o1	786371311	JGHXESUJKSBPSB-UHFFFAOYSA-N	425.357	1.571	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@H](C)C(=O)NNC(=O)c1cc(N2CCNC(=O)C2)ccn1	786690023	ZRVOKTWTKGHKCO-CQSZACIVSA-N	445.907	1.517	50	20	IDGD	
O=C(CCc1ccc(O)nc1)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	787441538	QOSLMAYACDQNON-UHFFFAOYSA-N	431.924	1.338	50	20	IDGD	
CN1CCN(C(=O)NNC(=O)[C@H](c2ccc(Cl)cc2Cl)N2CCOCC2)CC1	788166740	QSZDDCDEUFDNEC-INIZCTEOSA-N	430.336	1.355	50	20	IDGD	
COc1cccc([C@H]2[C@H](C(=O)NNc3ccccc3S(N)(=O)=O)CC(=O)N2C2CC2)c1	788223959	QHHIQSLZXCEYLY-UZLBHIALSA-N	444.513	1.538	50	20	IDGD	
O=C(CCN1CCOCC1)Nc1cccc(CNC(=O)NNc2nc3ccccn3n2)c1	790232050	WZUBJVDVOMOHDA-UHFFFAOYSA-N	438.492	1.216	50	20	IDGD	
CCn1c(=O)n(CC)c2nc(NC(=O)CCC(=O)NNc3nc4ccccn4n3)ccc21	791243414	RKRCRDMMPPARGB-UHFFFAOYSA-N	437.464	1.143	50	20	IDGD	
CCCCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNc2nc3ccccn3n2)cc1	792395938	WGZUKNLMCRMHSS-UHFFFAOYSA-N	431.478	1.353	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc(N3C[C@@H](C)O[C@H](C)C3)ccn2)cc1C	798308941	FAWZENXJXDFLNK-HZPDHXFCSA-N	425.489	1.712	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)NCCNS(=O)(=O)c2ccc(Cl)cc2F)n1	799386034	AQTHPXXMQUSWAE-UHFFFAOYSA-N	429.861	1.105	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1ccnc(OCc2ccccc2)c1	800623803	WWNKWWUVEULQOV-UHFFFAOYSA-N	448.435	1.832	50	20	IDGD	
CC(C)n1nc(C(=O)NNS(=O)(=O)c2cccc3c2OCO3)c2ccccc2c1=O	800830634	FFRDKZMYLWYMET-UHFFFAOYSA-N	430.442	1.329	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2cccc(C(=O)NNC(=O)Nc3ccccc3)c2)C[C@@H](C)O1	801991888	ZQWGQLXQGOALAI-GASCZTMLSA-N	432.502	1.951	50	20	IDGD	
O=C(NNC(=O)C1=NN(CCO)C(=O)CC1)Nc1ccc(Br)cc1Cl	802037942	CRFVQJUUFPVUFB-UHFFFAOYSA-N	432.662	1.226	50	20	IDGD	
Cc1nn(-c2ccccn2)c(C)c1C=NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	802706894	AVNASWXGCSUMRR-UHFFFAOYSA-N	432.893	1.949	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)NC[C@@H](N1CCOCC1)C(F)(F)F	805369487	YKPPQWRUXQHSEQ-SMDDNHRTSA-N	438.834	1.701	50	20	IDGD	
COc1ccc(CS(C)(=O)=O)cc1NC(=O)NNC(=O)[C@H](C)Oc1ccc(F)cc1	806638576	KTCGKJTWRFWVPW-LBPRGKRZSA-N	439.465	1.999	50	20	IDGD	
Cn1ncc(CNC(=O)NNc2ccc(S(=O)(=O)NC3CCCCCCC3)cn2)n1	807570533	LWVORMXDJYXOKP-UHFFFAOYSA-N	436.542	1.428	50	20	IDGD	
NC(=O)c1ccc(OCC(F)F)c(NC(=O)C(=O)NNC(=O)c2cccc(Cl)c2)c1	810386125	MUATXBVREAMJSL-UHFFFAOYSA-N	440.790	1.483	50	20	IDGD	
COC(=O)c1cc(Br)cc(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c1	813368192	ZFUWQFDBAVNFDA-UHFFFAOYSA-N	445.233	1.286	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@H](O)c3ccc(Cl)cc3)CC2)cc1	813486849	CAYOXVTWCDKWAD-OAQYLSRUSA-N	430.936	1.647	50	20	IDGD	
Cc1nn(-c2ccccc2)c2nc(Cl)c(C=NNC(=O)[C@@H](C)NS(C)(=O)=O)cc12	814835458	RBWSIIIRXYCVER-GFCCVEGCSA-N	434.909	1.770	50	20	IDGD	
Cc1c(C=NNC(=O)Nc2ccc(S(N)(=O)=O)cc2)c(=O)n(-c2ccccc2)n1C	814970273	WNTNVGAKQZIEPS-UHFFFAOYSA-N	428.474	1.287	50	20	IDGD	
CN(C)c1ccc(C2(C(=O)OCC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)CC2)cc1	815305738	WQYPPSPWXQZMNX-UHFFFAOYSA-N	426.429	1.697	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)C[C@H](c2nccn2C)C(F)(F)F)c1	816810495	NTMCHRHGGHOCBO-CYBMUJFWSA-N	447.439	1.168	50	20	IDGD	
CCn1c(NNC(=O)CNS(=O)(=O)c2cc(C)ccc2C)nc2ccccc2c1=O	823893194	XFDXMQUGPRLKED-UHFFFAOYSA-N	429.502	1.455	50	20	IDGD	
COc1cc(Cl)ccc1S(=O)(=O)NNC(=O)c1sc(N2CCOCC2)nc1C	844254869	WCHUMRQOUTYPNW-UHFFFAOYSA-N	446.938	1.573	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)c1cc(S(=O)(=O)N(C)C)ccc1F	912604686	VASXBCUNHGPCQX-LLVKDONJSA-N	427.429	1.444	50	20	IDGD	
COc1ccc(N2C(=O)/C(=C/NNC(=O)CCN(C)C)c3ccccc3C2=O)cc1OC	912745977	XNQQJMHIQVCNSM-NBVRZTHBSA-N	438.484	1.804	50	20	IDGD	
CN(C)N(C(=O)c1ccc(F)c(S(=O)(=O)NC(C)(C)C)c1)[C@H]1CCS(=O)(=O)C1	914604517	NEBDNSWPSNACKM-ZDUSSCGKSA-N	435.543	1.008	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)NCc1cccnc1OCC(F)(F)F	916398558	YIJZCXCZYONUPS-UHFFFAOYSA-N	428.367	1.941	50	20	IDGD	
CC(C)CCCNC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	916437852	MFDQMEUHQDWXAF-UHFFFAOYSA-N	440.566	1.407	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)N[C@H](CN1CCCC1=O)c1ccccc1	916459794	MLIPSSGEMBOHME-GOSISDBHSA-N	448.483	1.886	50	20	IDGD	
CCOCCOCc1cccc(CNC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1	916512929	QDMLFMNUMOJVFA-HXUWFJFHSA-N	429.473	1.910	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)N[C@H](C)Cn2ccnc2)c2ccccc2c1=O	916623196	IZKXWBHISHJTGB-OAHLLOKOSA-N	425.493	1.816	50	20	IDGD	
O=C(NCc1ccc(S(=O)(=O)NC[C@H]2CCCO2)cc1)NNc1cncc(Cl)n1	916649712	QFNPUKFUPHLLFU-CYBMUJFWSA-N	440.913	1.414	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(-c3ccncc3)on2)c1	916734766	VOYVNTTWPUNWJM-UHFFFAOYSA-N	443.485	1.842	50	20	IDGD	
O=C(Cc1ccc2ccccc2c1)NNC(=O)CN1C(=O)N[C@@]2(CCc3ccccc32)C1=O	917195168	DTCVBJBABIDKIN-RUZDIDTESA-N	442.475	1.923	50	20	IDGD	
Cc1cccc(-n2nnc(C(=O)NNC(=O)c3csc(N4CCOCC4)n3)c2C)c1	917391944	PDJTUATUDSSSQD-UHFFFAOYSA-N	427.490	1.252	50	20	IDGD	
CC(=NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)c1cn(C)nc1C	917531605	BRVSGMUXSPRRQJ-UHFFFAOYSA-N	433.534	1.222	50	20	IDGD	
O=C(NCc1ccc(CN2CCCC2=O)cc1)NNC(=O)c1nn(-c2ccccc2)cc1O	918017756	FJYBKYCVPNAORY-UHFFFAOYSA-N	448.483	1.845	50	20	IDGD	
CS(=O)(=O)Cc1ccc(CNC(=O)NNC(=O)c2cc(Br)c[nH]2)cc1	918102352	RTDJURHEWCKZBF-UHFFFAOYSA-N	429.296	1.466	50	20	IDGD	
COc1ccc(CCCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1	918139795	ZKZLFODKQVBPJW-UHFFFAOYSA-N	434.518	1.522	50	20	IDGD	
Cc1ccc2c(c1)CC[C@H]2NC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	919920018	HYHDWUFWHZYAKJ-LJQANCHMSA-N	444.561	1.640	50	20	IDGD	
Cc1ccc(-c2ccc(C=NNC(=O)CSc3nn(C)c(=O)n(C)c3=O)s2)cc1	920480071	ZQQLRHKTPUZCIW-UHFFFAOYSA-N	429.527	1.758	50	20	IDGD	
C[C@@]1(NNC(=O)NCc2cc(Br)c3c(c2)OCCO3)CCS(=O)(=O)C1	921124901	URXMMFVASXHMCO-OAHLLOKOSA-N	434.312	1.101	50	20	IDGD	
CN(CCCC(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1)C(=O)OC(C)(C)C	921302141	OPNXHACLOVHSDQ-UHFFFAOYSA-N	448.929	1.396	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)[C@@H]2CS[C@]3(C)CCC(=O)N23)CC1	1116088802	ZQRURQQCSUDYAN-ORAYPTAESA-N	426.539	1.235	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)N[C@H]2CCOC3(CCOCC3)C2)c2ccccc2c1=O	1118105296	UKEITSGXSTXMEH-HNNXBMFYSA-N	443.504	1.650	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)NCCc2ccc3c(c2)OCO3)CC1	1251918209	AGCOSTWMVZQTRY-UHFFFAOYSA-N	434.493	1.935	50	20	IDGD	
Cc1ccc(CN2CCCN(C(=O)NNC(=O)CNC(=O)c3cccs3)CC2)cc1	1318191387	SLVJGPKZDXHLKO-UHFFFAOYSA-N	429.546	1.735	50	20	IDGD	
O=C(NC[C@H]1CC(=O)N(Cc2ccccc2)C1)NNC(=O)c1cncn1-c1ccccc1	1319527218	MSQRPEZCOHJKFA-GOSISDBHSA-N	432.484	1.865	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1cc(C(=O)NNC(=O)c2n[nH]c3c2CCCC3)ccc1F	1321593332	KAMOLAURORXYJQ-UHFFFAOYSA-N	437.497	1.579	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1C	1339205148	UDDJNLPBLSGOHR-UHFFFAOYSA-N	427.523	1.960	50	20	IDGD	
Cc1ccn2c(=O)c(C(=O)N3CC[C@@]4(C3)CN(C(=O)C(Cl)Cl)CCO4)cnc2c1	1777997476	WSTHQFCFGDNSJJ-LJQANCHMSA-N	439.299	1.250	50	20	IDGD	
COC(=O)c1ccc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](F)Cl)C2)cn1	1778026485	VWJWTAAGAZKXIS-ZRGWGRIASA-N	427.860	1.530	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)Cc3ccc(NC(C)=O)cc3)C2)C1	1778257249	TWAWTOXUFVXEAG-WIYYLYMNSA-N	437.924	1.271	50	20	IDGD	
O=C(c1cnc2[nH]ncc2c1)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1778416554	OBGBQSRFWLCYKZ-WBMJQRKESA-N	426.246	1.092	50	20	IDGD	
Cn1nc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)CO[Si](C)(C)C)C3)c2c1CCC2	1778670108	AKLGEVJVKSKIEO-XMSQKQJNSA-N	448.640	1.888	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc3cccn3cn2)C1	1778724204	MVYCXTGBYBNFJS-HGHGUNKESA-N	434.924	1.716	50	20	IDGD	
CCC1(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cnccc2C(=O)NN)C3)CCC1	1778886578	FYWOCQIUYYIFFO-WZONZLPQSA-N	443.548	1.393	50	20	IDGD	
O=C(c1nc(O)n2c1CCCC2)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1779348674	ZPQMMXYASDHOIW-CXAGYDPISA-N	445.289	1.059	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccnc(Cl)n3)C2)C1	1779500571	ZZPFUQSQQNULSS-BDJLRTHQSA-N	431.718	1.605	50	20	IDGD	
C=CC(=O)N[C@@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CO[Si](C)(C)C)C1	1779545822	ZXQMSWDUBPOLED-RZQQEMMASA-N	425.602	1.043	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2n[nH]cc2[N+](=O)[O-])C1	1779605770	DEJRPKHDDWXZGO-NSODJVPESA-N	444.286	1.229	50	20	IDGD	
COC[C@@H](C)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1	1780095607	QUALJPDGSALHJA-SZNDQCEHSA-N	449.460	1.246	50	20	IDGD	
C[C@H](Nc1cccnc1)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781330687	CYQJBNOQLIHDFW-QEORTHHSSA-N	429.290	1.402	50	20	IDGD	
O=C(c1cccc(N2CCOCC2)c1)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Cl)CCO2	1781736053	ZCJSWEQUVBHQCW-XLIONFOSSA-N	425.888	1.501	50	20	IDGD	
COc1cccc(/C=C/C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](O)CCl)C3)c1	1781943096	UHEAYKAJQUVSKI-NTORMRTESA-N	436.936	1.822	50	20	IDGD	
CCCC(=O)N[C@@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](Cl)COC)C1	1782176217	YGROYVDOCQUKID-ZFCANOHDSA-N	431.961	1.059	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1782861054	GGNLMTQFFUJPSP-QYBVRUJRSA-N	439.846	1.301	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)Cn3cnc4ccccc43)C2)C1	1783744494	SQAGAFWDAKBTFP-QRWLVFNGSA-N	449.349	1.897	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H]1CC(c3ccccc3)=NO1)CCO2	1783871041	MDVAWQMEZQAFOU-DJPFJPOOSA-N	435.908	1.263	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](S)C(C)C)[C@H]2C1	1784531331	GTZCYVBIKOJVBM-UKZVOZDVSA-N	449.577	1.055	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)[C@H]3SC(=N)NC3=O)C[C@@H]21	1784618729	QZQOZLUVTIKWPW-HCDMYHGNSA-N	444.985	1.176	50	20	IDGD	
Cc1ccc(S(=O)(=O)CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Cl)C[C@@H]32)cc1	1786607750	WFDYEDXRVWXCEX-OWIUFQIYSA-N	446.928	1.283	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1)c1ccc[n+]([O-])c1	1786999496	WZCTZJCUQAYPAJ-UHFFFAOYSA-N	431.257	1.061	50	20	IDGD	
C=C1CC(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)/C(C)=N/NC(=O)c4ccc[nH]4)[C@H]3C2)C1	1787507382	ROTYKMXLIIXLNT-SKFHZHBLSA-N	427.505	1.066	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(OC)cn3)[C@H]2C1	1787761314	PVFWRGMCLQBWHP-QEWYBTABSA-N	440.338	1.857	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21)c1ccc2nc(CO)[nH]c2c1	1787874232	MTYNTCMLIFNXRE-HUBLWGQQSA-N	441.315	1.452	50	20	IDGD	
O=C(CCCn1ccnc1)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1	1788149461	VGSFAFUWPOSAQZ-UHFFFAOYSA-N	446.316	1.791	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)c1cc2cc(F)c(F)cc2[nH]1	1788265251	XRBIAOZJGNCVCU-MQJTVAOZSA-N	441.862	1.639	50	20	IDGD	
C[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)Br)C[C@@H]21)n1ccccc1=O	1788750738	OIWULRSGNVHNER-YXMSTPNBSA-N	440.338	1.172	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CSc3ncccn3)C[C@@H]21)[C@H](F)Br	1789922180	FVKSHGKCQSACCK-MNXVOIDGSA-N	447.330	1.239	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4n(n3)CCCC4)C[C@@H]21)[C@H](F)Br	1789926474	ZKTSGJZUHCHGBA-MZGVZZPPSA-N	443.317	1.503	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(O)ccc3O)[C@H]2C1	1790265182	FSBFJXHEMRPGBM-WNZPGNDNSA-N	431.316	1.927	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)[C@@H](O)Cc1ccccc1	1790956233	GHWGZRKVKBJVFL-QUSNUVHPSA-N	443.313	1.260	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3ccc(C#N)cc3)C[C@@H]21	1791251057	SYVCCXMFGJGKAG-MUGJNUQGSA-N	433.936	1.724	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnn4cccc(F)c34)C[C@@H]21	1791256827	JAKUXIRNZPAHPM-QEWYBTABSA-N	438.887	1.321	50	20	IDGD	
O=C(CCc1cc(F)ccn1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2	1794024392	VYXKREUKJVSLFK-IVWMJMPLSA-N	428.302	1.528	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cn1ccc2sccc2c1=O	1794044973	XZEAPEKFTBEJPI-ZFHGCVPZSA-N	437.949	1.670	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)c1ccc(Cl)nc1Cl	1796188699	KCIPBINAZLRQFC-QDMKHBRRSA-N	448.115	1.634	50	20	IDGD	
CC[C@@H](C)[C@@H](N)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C#N)=C/c1ccc(F)cc1F	1800332624	TZSZIVPVYBYRFI-UAPBNUCKSA-N	446.498	1.835	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc(C(C)(C)C)cn1)C2	1800756582	ASUXKKCWECJHNF-JFILPPLUSA-N	439.354	1.761	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COc1ccc(Cl)c(F)c1)C2	1800970415	DHPIGIDDMDZCQY-ABXQLRGKSA-N	449.306	1.701	50	20	IDGD	
COC[C@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](COC)NC(=O)OC(C)(C)C)C2	1802277153	PXOPADMIMQSLGR-XFIYOXNOSA-N	447.960	1.418	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cnnc3ccccc23)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803139752	VHQVIQJXRITNDM-RYGJVYDSSA-N	439.903	1.944	50	20	IDGD	
CC(=O)Nc1ccccc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCC(=O)NN(C)C)C2	1803712173	YPUAHIHJPYSAEN-BJWYYQGGSA-N	429.521	1.270	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NC[C@@H]1CCN(C(=O)[C@@H](F)Cl)[C@H]1c1cccnc1	1804369204	PBNLFDDGENOZTH-JCGIZDLHSA-N	433.871	1.447	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](CC(N)=O)NC(=O)OC(C)(C)C	1804431348	CPAVDOKAEAQEBX-KHMAMNHCSA-N	444.960	1.411	50	20	IDGD	
O=C(CCN1Cc2ccccc2C1=O)N1CCC2(CCCN(C(=O)[C@H](O)CCl)C2)CC1	1805524278	NSROYNGEFIFNRA-LJQANCHMSA-N	447.963	1.863	50	20	IDGD	
COCCOCC(=O)NC[C@@H]1CCN(C(=O)[C@H](C)CBr)[C@@H]1c1cccnc1	1806753533	OKKMFTUATIHFJQ-UWWQBHOKSA-N	442.354	1.781	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CCC(F)(F)F)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807362742	ITLFKUGFHGUWRI-QFBILLFUSA-N	449.238	1.424	50	20	IDGD	
Cc1ccoc1C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1807364308	UBXJDGDQXLVSRR-ICSRJNTNSA-N	433.273	1.296	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)Cc2ccn(C)n2)[C@@H]1c1cccnc1	1807516776	GRKAKVBKJGGNHN-YEWWUXTCSA-N	434.338	1.847	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CN2CCOCC2)[C@H]1c1cccnc1)[C@H](F)Br	1808661219	HAYNBYLXKCUMTG-XIRDDKMYSA-N	443.317	1.110	50	20	IDGD	
CC(C)CNC(=O)C(=O)N1CC[C@H](CNC(=O)[C@H](F)Br)[C@H]1c1cccnc1	1808661727	CXTNOXAKMZYRCA-KFWWJZLASA-N	443.317	1.550	50	20	IDGD	
Cc1cc2nnc(C(=O)NC[C@@H]3CCN(C(=O)[C@H](F)Cl)[C@H]3c3cccnc3)c(C)n2n1	1809185394	FQJVCTBBTYEUDO-WBAXXEDZSA-N	445.886	1.990	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)c1ccc2cccnc2n1	1809724053	WRNSZRGZOXBBOZ-UHOSZYNNSA-N	439.903	1.944	50	20	IDGD	
Cc1cc(C#N)cc(C(=O)N2CCC3(CCCN(C(=O)c4ccc(B(O)O)cc4)C3)CC2)c1	1809969954	WJFZPZXEFDNQAZ-UHFFFAOYSA-N	445.328	1.705	50	20	IDGD	
COC(=O)C1(C(=O)N2CC[C@H](CNC(=O)CO[Si](C)(C)C)[C@@H]2c2cccnc2)CC1	1810548990	WQXBVZSHHRDWLU-AEFFLSMTSA-N	433.581	1.892	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1	1814060894	YUPBWKZIXCQSPK-UEXGIBASSA-N	442.903	1.638	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2CC[C@@H]3CCC(=O)N3C2)[nH]n1)[C@H](O)CCl	1814872415	JTZYOMICPRJACB-LUYZLQTOSA-N	437.928	1.403	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CN2CCS(=O)(=O)CC2)n[nH]1	1815672978	NKMCQORXVQGRCC-UKRRQHHQSA-N	445.973	1.150	50	20	IDGD	
CC(C)(C)OCC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1	1817469662	CQIBNISKCXQQBO-KRWDZBQOSA-N	428.298	1.211	50	20	IDGD	
C[C@@H](NC(=O)OC(C)(C)C)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](O)CCl)CC2	1825810364	QAFXXFZWXGGBBG-CKYFFXLPSA-N	446.957	1.568	50	20	IDGD	
CC(C)(CCl)C(=O)N[C@@H]1CCc2nc(NC(=O)C[C@](C)(O)CC(=O)O)sc2C1	1826067835	KUEKVBFCUAZGCI-MGNBDDOMSA-N	431.942	1.936	50	20	IDGD	
COc1cc(C(=O)N[C@@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)ccn1	1826087646	HGQTXQYYZWAVEF-CYBMUJFWSA-N	446.533	1.146	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1CCc2nc(NC(=O)CCn3cncn3)sc2C1	1826601960	STRRXAJCXAQPJJ-GHMZBOCLSA-N	441.355	1.768	50	20	IDGD	
O=C(Cc1cccnc1)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827054822	MACZRCDDPSNQAS-QFIPXVFZSA-N	435.333	1.237	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@H]1CCc2nc(NC(=O)CCS(C)(=O)=O)sc2C1	1827208957	SGDCVNGMMJSJGP-NSHDSACASA-N	433.628	1.341	50	20	IDGD	
Cc1ccn(C)c1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1	1829833779	ZQNHZISZUCFONJ-LJQANCHMSA-N	431.581	1.940	50	20	IDGD	
O=C(CCCc1ccccc1F)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1830719485	DZIGPAYFPUVTBD-GHTZIAJQSA-N	442.915	1.205	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc4ccccn34)C2)C1	1831647155	RHCCQPVKFVQGTR-HRAATJIYSA-N	434.924	1.812	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1	1831833219	MNOGWINXWNBTHC-CVEARBPZSA-N	425.913	1.980	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)CC[C@H]2CCOC2)CC1	1832456264	LYXBWDBDURVYPB-AZUAARDMSA-N	436.597	1.796	50	20	IDGD	
Cc1cc(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)on1	1832571710	ZXTSEOMEQLPOMA-ZWKOTPCHSA-N	434.320	1.218	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](F)Cl)CC2)CC1)[C@H]1COc2ccccc2O1	1833715388	GATLJMOFIUWRET-MOPGFXCFSA-N	439.915	1.932	50	20	IDGD	
O=C(CSc1ccncc1)NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1833765881	WGQXZSRAUKYTPC-SFHVURJKSA-N	440.997	1.345	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)c3[nH]cc4c3CCC4)C2)C1	1834823257	LQEUTEWONXVIJM-IBGZPJMESA-N	440.338	1.358	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC1CCN(C2CCN(C(=O)c3cccc(O)n3)CC2)CC1	1835833442	FYYFGFNLHBEPFT-UHFFFAOYSA-N	434.613	1.824	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc4c(c3)CNC4=O)CCO2)C1	1837147117	JTDYVENHPDCNSU-QFIPXVFZSA-N	449.935	1.265	50	20	IDGD	
O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(F)cc1)CCO2	1838954641	QTPPIFWPIJKFKT-SFHVURJKSA-N	429.286	1.681	50	20	IDGD	
O=C([C@@H]1CCCSC1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839203201	CYAABXBCBPZQGO-WWGRRREGSA-N	439.347	1.277	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)C3(O)CCC3)C2)C1	1839961768	ICDALWUSBIEILW-RLFYNMQTSA-N	447.370	1.167	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)c(C)o1	1840031454	QPUXEBVVIPLMDN-FZKQIMNGSA-N	429.311	1.750	50	20	IDGD	
COC(=O)c1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)c(C)c1	1840787168	SGKNPSIRRVAKEX-JXFKEZNVSA-N	442.871	1.386	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)c2coc(C)n2)C1	1842456007	XUBODGCEVMUFKB-UHFFFAOYSA-N	428.401	1.947	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)C2CCOCC2)C1	1842761380	YUPQSWIPAZDBPO-UHFFFAOYSA-N	431.445	1.764	50	20	IDGD	
CCn1nc(C)cc1C(=O)N1CC2(CCCN2C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C1	1843415736	GQEZMSDMSNXBAR-HZHRSRAPSA-N	425.493	1.162	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cccnc1Cl	1847171629	BQPQIOXQBNXTNP-GAVIZYNASA-N	428.880	1.684	50	20	IDGD	
Cn1cc(NC(=O)OC(C)(C)C)cc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl	1847556296	HXMGEGHMGTUSHV-OFQRWUPVSA-N	440.928	1.787	50	20	IDGD	
C[C@@H]1CCCN(C(=O)OC(C)(C)C)[C@@H]1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl	1847559584	OTDRVCNQMUWTSW-XAJHFOFHSA-N	443.972	1.824	50	20	IDGD	
Cc1cnc(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)cn1	1848095853	VSBCLLLGQHJNSF-BPUTZDHNSA-N	437.928	1.733	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cc(-c3ccccc3)n[nH]2)cc1	15841624	BUPINLLXDXTFJY-UHFFFAOYSA-N	427.486	1.838	50	20	IDGD	
O=C(COc1ccccc1Cl)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	15878140	JRDTXBFKWHOTNZ-UHFFFAOYSA-N	437.905	1.965	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2ccccc2OCC(=O)N(C)C)cc(OC)c1OC	27601071	FMGYVAHSXOZXJR-UHFFFAOYSA-N	431.445	1.254	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)c2cccc(CN3CCS(=O)(=O)CC3)c2)cc1C	116569182	CAPHXUXUSWNHFI-UHFFFAOYSA-N	445.541	1.374	50	20	IDGD	
COCCCNC(=S)N(C)NC(=O)c1cccc(S(=O)(=O)NCc2ccco2)c1	726077109	PZCSLYXLSYKPLS-UHFFFAOYSA-N	440.547	1.246	50	20	IDGD	
CCOC(=O)c1cc(C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)cc([N+](=O)[O-])c1	726862078	BNOPEULVULLORM-UHFFFAOYSA-N	448.457	1.969	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NC2CCN(CCCOC)CC2)nc1	727031416	RLINHNCJUULLMF-UHFFFAOYSA-N	442.586	1.239	50	20	IDGD	
Cn1ccc(S(=O)(=O)NNC(=O)[C@H]2Cc3ccccc3CN2Cc2ccccc2)n1	727359037	IIFFESTTZUEDOX-LJQANCHMSA-N	425.514	1.357	50	20	IDGD	
CNS(=O)(=O)c1cccc([C@H](C)NC(=O)NNC(=O)COc2cc(C)ccc2C)c1	727608843	XVLOWQKNDZGKOE-HNNXBMFYSA-N	434.518	1.682	50	20	IDGD	
CN(C)N(C(=O)CN1C(=O)NC2(CCC(C(C)(C)C)CC2)C1=O)[C@H]1CCS(=O)(=O)C1	728180384	ZQORDMFPYDKKKD-CHWWFWEZSA-N	442.582	1.006	50	20	IDGD	
C[C@@H]1C[C@@H](C)CN(S(=O)(=O)c2cccc(C(=O)NNC(=O)Cc3cccnc3)c2)C1	728852229	UVUIXZHKSGTTRU-HZPDHXFCSA-N	430.530	1.752	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)[C@@H]2CC(=O)N(C[C@H]3CCCN3CC)C2)cc1OC	729627775	UVQIBQNSGAGRFB-QZTJIDSGSA-N	446.548	1.578	50	20	IDGD	
O=C(COC(=O)c1c(Cl)cccc1[N+](=O)[O-])NNC(=O)[C@@H]1COc2ccccc2O1	730646316	BMZMELHFHMZYIL-AWEZNQCLSA-N	435.776	1.392	50	20	IDGD	
C[C@H]1CCCCN1S(=O)(=O)c1ccc(C(=O)NNC(=O)COc2ccccc2O)cc1	730781736	XTOOXLLOEPZGJN-HNNXBMFYSA-N	447.513	1.795	50	20	IDGD	
CCOc1ccc(N2C(=O)/C(=C\NNC(=O)C(=O)NC3CC3)c3ccccc3C2=O)cc1	730983940	ZWJGVPPASKWLBQ-UYRXBGFRSA-N	434.452	1.513	50	20	IDGD	
C[C@@H]1CCCCN1C(=O)CN1CCN(C(=O)NNC(=O)C(C)(C)c2ccccc2)CC1	731222058	MTSIXNZUHHRLIG-GOSISDBHSA-N	429.565	1.724	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)c1nccnc1C(=O)NCc1ccc(F)cc1	731344617	WCHVMQMZXGHZQP-UHFFFAOYSA-N	425.395	1.689	50	20	IDGD	
CCN(C1CCN(C(=O)NNC(=O)c2cccc(OC(F)F)c2)CC1)S(C)(=O)=O	731362633	HMPBEROXBRTJPG-UHFFFAOYSA-N	434.465	1.388	50	20	IDGD	
Cc1nn(-c2ccc(F)cc2)c(C)c1CC(=O)NNC(=O)CCN1C[C@H](C)O[C@@H](C)C1	732263112	JWJATGJYNDNDSX-GJZGRUSLSA-N	431.512	1.817	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)c1ccc(F)c(S(=O)(=O)NC2CC2)c1	733107221	WJEXHPDQTAMLSK-UHFFFAOYSA-N	443.460	1.527	50	20	IDGD	
CC(C)OCCCn1c(NNC(=O)c2ccc(-n3ccnc3)nn2)nc2ccccc2c1=O	733265937	MVSJTWBEKDJNKS-UHFFFAOYSA-N	448.487	1.944	50	20	IDGD	
O=C(NCC1(N2CCOCC2)CCCCC1)NNC(=O)c1cnn(-c2ccccc2)c1	733641664	ZBNUKFROCKQJPD-UHFFFAOYSA-N	426.521	1.851	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCOCC2)cc1C(=O)NNc1cnnc2ccccc12	733813048	JYVNCSPZBMHMCP-UHFFFAOYSA-N	443.485	1.416	50	20	IDGD	
CCCc1ccc(N2C[C@@H](C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)CC2=O)cc1	734239997	GWDYLDGCMATDKM-INIZCTEOSA-N	447.536	1.847	50	20	IDGD	
C[C@H](Cc1cccc(F)c1)C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	735116835	HXERGLRADNGZCR-OAHLLOKOSA-N	435.525	1.479	50	20	IDGD	
CC1CCN([C@H](C)CNC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)CC1	743341497	ZRDFQYSRXWSHSQ-HXUWFJFHSA-N	430.597	1.650	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)Cc2ccc(NC(=O)C3CC3)cc2)n1	745491752	BFAVCCGAHGAPDC-UHFFFAOYSA-N	430.486	1.276	50	20	IDGD	
Cc1cnc([C@@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)C2CC2)s1	745866353	VFXDCJCUZUVXCS-HNNXBMFYSA-N	437.547	1.797	50	20	IDGD	
C[C@@H]1OC(C)(C)N(C(=O)OC(C)(C)C)[C@@H]1C(=O)NNC(=O)CNC(=O)c1cccs1	746198625	XNFZWMPATRUGOP-FZMZJTMJSA-N	440.522	1.386	50	20	IDGD	
COc1cc(C)nc(NNC(=O)CS(=O)(=O)Nc2ccc(N3CCCCC3)cc2)n1	746628273	ZLTDUCFNRMMUCI-UHFFFAOYSA-N	434.522	1.669	50	20	IDGD	
O=C(CCN1C(=O)NC2(CCCC2)C1=O)NNc1nc(-c2ccccn2)nc2c1CCC2	748339163	LQUXSHKDRIQAKG-UHFFFAOYSA-N	435.488	1.725	50	20	IDGD	
CS(=O)(=O)c1cc(C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)ccc1Br	749112748	APBYICXHVMUBCB-UHFFFAOYSA-N	442.247	1.836	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)[C@H]1CCn2ccnc2C1	749258810	PVKLKOHGKRPSOB-KRWDZBQOSA-N	430.940	1.064	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)N[C@@H]2CCN(CCCc3ccccc3)C2=O)nc2ccccc21	750662022	WKAQDZPJDMEHEA-LJQANCHMSA-N	448.527	1.680	50	20	IDGD	
COc1cc(/C=C(/C#N)C(=O)c2c(N)n(C)c(=O)n(C)c2=O)ccc1OCC(F)(F)F	750893084	OJCNJXJIGPEYTG-WDZFZDKYSA-N	438.362	1.406	50	20	IDGD	
COCCN1C(=O)c2ccc(C(=O)Oc3ccc([N+](=O)[O-])cc3OC)cc2S1(=O)=O	751164954	LQIWITUQBSMWQX-UHFFFAOYSA-N	436.398	1.614	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)NNC(=O)c2ccc(OC(C)C)c(OC)c2)ccc1F	752400768	VBJNZEADZNGBOR-UHFFFAOYSA-N	439.465	1.604	50	20	IDGD	
COc1ccccc1-c1noc([C@@H](C)NCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)n1	755042573	XAQNPCXEHLORHU-GFCCVEGCSA-N	440.416	1.765	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)N[C@H]1CCN(c2c(F)cccc2F)C1=O	755085094	QZKJSVTZSDAXRI-NSHDSACASA-N	442.220	1.805	50	20	IDGD	
CCOc1ccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1	755338403	YKJSKKSGMWTTDB-UHFFFAOYSA-N	448.501	1.573	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)c2nnc(O)c3ccccc23)cc1S(=O)(=O)N(C)C	755394129	SCIZOHQEQJXSMZ-UHFFFAOYSA-N	444.473	1.361	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)NNC(=O)[C@@H](C)Oc2cccc(Br)c2)co1	755411750	FLAVPHZNWJQKFG-SECBINFHSA-N	446.279	1.179	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2cc(NC(C)=O)ccc2OC)c2ccccc2c1=O	755502960	YNDXCOSHIIIPGN-UHFFFAOYSA-N	438.444	1.850	50	20	IDGD	
O=C(CN1CCOCC1)Nc1ccc(NC(=O)NNC(=O)c2cc3c(s2)CCC3)cc1	755598042	DIONQCHMOUIWBB-UHFFFAOYSA-N	443.529	1.974	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)nc2)c1	755901186	BJKNAZLALWLIEC-UHFFFAOYSA-N	443.279	1.723	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)Nc1ccc(-n2nccn2)nc1	755948469	ZRTVELRFTUIQOB-UHFFFAOYSA-N	435.492	1.027	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)[C@H]1CCC(=O)N1Cc1ccc(Br)cc1	756691760	KDVORRLRAPNGLV-MRXNPFEDSA-N	431.290	1.725	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)NNc2cc(C(F)(F)F)nc(-c3cccnc3)n2)co1	756773239	YLEKBOQCSBQMHZ-UHFFFAOYSA-N	442.379	1.815	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1ccc(Oc2ccc(Cl)cn2)cc1	756791272	RJRBQOGCBCGGSW-JTQLQIEISA-N	427.870	1.618	50	20	IDGD	
CS(=O)(=O)CCOc1ccc(Cl)cc1NC(=O)NNC(=O)Cc1ccncc1	756813174	LGDXVMIDKVQWEJ-UHFFFAOYSA-N	426.882	1.554	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNS(=O)(=O)c1cc(C(=O)O)cc(F)c1F	756930200	SJKGAEANPFXIOM-UHFFFAOYSA-N	430.385	1.450	50	20	IDGD	
O=C(NNC(=O)c1ccc(F)cc1[N+](=O)[O-])c1cccc(S(=O)(=O)N2CCCC2)c1	757528133	AUIZIHGGOPEMLK-UHFFFAOYSA-N	436.421	1.593	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)c1ccc(Oc2ccc(C(C)(C)C)cc2)nc1	758041092	WLNXWPPKKQWMLV-CYBMUJFWSA-N	434.518	1.870	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2cccnc2Br)ccc1Cl	758156585	AWDMZMXLWGQZNM-UHFFFAOYSA-N	433.671	1.220	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)N[C@H]2CN(C(=O)OC(C)(C)C)C[C@@H]2C#N)cc1	758761953	RZBWLCFLXGRWQI-BBRMVZONSA-N	433.465	1.163	50	20	IDGD	
CN(NC(=O)c1cc(-n2cccn2)ccn1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758788157	XRPGZMLDINROFO-UHFFFAOYSA-N	429.481	1.517	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)[C@H]1COc2ccc(Br)cc21	759113990	QLANVRRAAJNPLX-LBPRGKRZSA-N	443.298	1.780	50	20	IDGD	
COCCCC(C)=NNC(=O)C[C@@H]1c2cc(OC)c(OC)cc2CCN1S(C)(=O)=O	759191185	CBIUKHRSBUIOJR-QGZVFWFLSA-N	441.550	1.871	50	20	IDGD	
C[C@@H](CC(=O)NNc1nc(-c2ccccc2)no1)NS(=O)(=O)c1cccnc1Cl	760567422	BZDFXDAUQKMXRE-NSHDSACASA-N	436.881	1.985	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	761786906	KZNYURCOKNWKNY-GOSISDBHSA-N	440.500	1.986	50	20	IDGD	
Cc1cc(Cl)c([N+](=O)[O-])cc1S(=O)(=O)NNC(=O)c1ccc2c(c1)OCCO2	761887413	XOKVNBIAAMNFLG-UHFFFAOYSA-N	427.822	1.951	50	20	IDGD	
Cc1n[nH]c(C)c1[C@@H](C)CC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	763385287	ASKKFMYIBJMYFP-ZDUSSCGKSA-N	433.534	1.766	50	20	IDGD	
O=C(COc1cccc(NC(=O)C(=O)NNC(=O)c2cccnc2)c1)Nc1ccccc1	763490913	FWDCVHZSLSZBQU-UHFFFAOYSA-N	433.424	1.499	50	20	IDGD	
CC1CCN(c2cccc(NC(=O)C(=O)NNC(=O)[C@H]3COc4ccccc4O3)c2)CC1	763579058	TVMFDCZJDVFXBK-HXUWFJFHSA-N	438.484	1.849	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cc(C(=O)N(C)C)ccc2C)c2ccccc2n1	763619312	RSFPMXBQCHBLTL-UHFFFAOYSA-N	433.468	1.953	50	20	IDGD	
CCOC(=O)c1c(F)cccc1NC(=O)C(=O)NNC(=O)c1c(C)nc2ccccn12	763628804	FWDULGMKFRLUGS-UHFFFAOYSA-N	427.392	1.358	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc2c(cnn2C(C)C)c1	763656838	GACQVGAQTBZAGP-UHFFFAOYSA-N	425.445	1.791	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)C(=O)Nc1ccccc1OC[C@@H]1CCCCO1	763681535	VJGQBBKEGATMFC-HNNXBMFYSA-N	445.447	1.939	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)C(=O)Nc1cc(F)ccc1F	763694456	JKSAMPFWJRNYGB-UHFFFAOYSA-N	428.189	1.892	50	20	IDGD	
O=C(CSc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1ccccc1Cn1cncn1	763736690	SXOXAHQZJOFLKN-UHFFFAOYSA-N	444.904	1.858	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(NS(C)(=O)=O)c(Cl)c2)cc1	763831047	SKKACXJCJMVWLZ-UHFFFAOYSA-N	438.893	1.674	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)c(OC)cc1Cl	763841774	SZCKAQINGUELEL-UHFFFAOYSA-N	425.800	1.661	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cccc(N3CCOC3=O)c2)c1C	763852139	VGWXLEHYTNXYCW-HNNXBMFYSA-N	440.456	1.813	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(C#N)c(Cl)c2)cc1	763878721	TTZMYELNZWABGS-LBPRGKRZSA-N	428.832	1.968	50	20	IDGD	
COCCn1cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2c(C)cc(Cl)cc2C)cn1	763880816	BUDSXHCLBODZDE-CYBMUJFWSA-N	437.884	1.353	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2sc(-c3ccccc3)nc2C)c(=O)n(C)c1	763899775	BKYYFBVGMCXWBI-UHFFFAOYSA-N	425.470	1.525	50	20	IDGD	
CON(C)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)CCSc2ccc(F)cc2)cc1	763904319	YQFIQKYYOUXEGZ-UHFFFAOYSA-N	448.476	1.727	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2C)cc1OCC(=O)NC1CC1	763956451	OGLKBLXYYQFCFS-UHFFFAOYSA-N	440.456	1.061	50	20	IDGD	
O=C(NNC(=O)c1cc(Cl)ccc1O)C(=O)Nc1ccc(S(=O)(=O)C(F)F)cc1	763976611	CCIVESOAEMNZTJ-UHFFFAOYSA-N	447.803	1.442	50	20	IDGD	
O=C1CSc2ccc(NC(=O)C(=O)NNC(=O)c3cc(Br)c[nH]3)cc2N1	763996098	VBHQOBITHRSREK-UHFFFAOYSA-N	438.263	1.221	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)ccc1Cl	763997298	IYICZTBJUMLKIP-UHFFFAOYSA-N	443.641	1.617	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2cc(Br)cn2C)c(Cl)n1	764001533	AFXWFINNNMEBAA-UHFFFAOYSA-N	430.646	1.244	50	20	IDGD	
C[C@H](Oc1ccccc1NC(=O)C(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1ccccc1	764001596	BFWBDXPDLIKFSS-GOEBONIOSA-N	445.497	1.347	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1ccc(O[C@H]2CCOC2)cc1	764013014	UKLZKYLKWHECKI-HNNXBMFYSA-N	433.848	1.916	50	20	IDGD	
CCOc1cc(C(=O)N(C)C)ccc1NC(=O)C(=O)NNC(=O)c1ccccc1OC	764040099	CVVBPASGRMOAKT-UHFFFAOYSA-N	428.445	1.195	50	20	IDGD	
Cc1ncsc1C(=O)NNC(=O)C(=O)Nc1ccnn1Cc1ccc(Cl)c(F)c1	764247642	VROPZMBRQRFIFJ-UHFFFAOYSA-N	436.856	1.889	50	20	IDGD	
CCOc1cc(C(=O)N(C)C)ccc1NC(=O)C(=O)NNC(=O)c1cccc2ncccc12	764252488	GWJNCNVNSJUQGG-UHFFFAOYSA-N	449.467	1.735	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1ccnc(Sc2ccccn2)c1	764274807	DALHFXQDBXSERJ-UHFFFAOYSA-N	439.453	1.498	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2O)n(-c2ccccc2F)n1	764278534	ZVDWOOKECHCKAW-UHFFFAOYSA-N	427.392	1.190	50	20	IDGD	
CC(C)n1cnnc1-c1ccccc1NC(=O)C(=O)NNC(=O)COCc1ccccc1	764362190	ALHVTRGHKBVHCR-UHFFFAOYSA-N	436.472	1.829	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)COCc2ccccc2)cccc1C(=O)N1CCCC1	764367809	MRGGCIOFFUJCHI-UHFFFAOYSA-N	438.484	1.534	50	20	IDGD	
O=C(NNC(=O)C(F)(F)Oc1ccccc1)C(=O)Nc1cccc(NC(=O)C2CC2)c1	764370022	KUVYMBPLMTYABL-UHFFFAOYSA-N	432.383	1.793	50	20	IDGD	
NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)cc1Cl	764377998	FZXXFRPCUJWYEZ-UHFFFAOYSA-N	426.763	1.197	50	20	IDGD	
O=C(NNC(=O)C(F)(F)Oc1ccccc1)C(=O)Nc1ccccc1O[C@@H]1CCOC1	764379335	BXMJZYAUNOFAKV-CQSZACIVSA-N	435.383	1.612	50	20	IDGD	
CC(C)(C)c1nsc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)n1	764387983	NKMPXDZKWBANBK-UHFFFAOYSA-N	431.453	1.765	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1)C(=O)Nc1ncn(Cc2ccccc2)n1	764389020	WHOQKDFRYWZORC-UHFFFAOYSA-N	448.418	1.255	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)[C@@H]3CCC[C@@H](C)C3)CC2)cc1	765727850	JCMCTRMPUORTHQ-QZTJIDSGSA-N	436.578	1.275	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(O)c(C(=O)NNC(=O)CSc2ccc(Cl)cc2)c1	766952101	OVWKKHBMDGAUCX-UHFFFAOYSA-N	443.934	1.849	50	20	IDGD	
O=S(=O)(CBr)N1CCN(S(=O)(=O)Cc2c(F)cccc2F)CC1	767850805	MTIHQEAGZORIJW-UHFFFAOYSA-N	433.296	1.094	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)C(=O)Nc1cnc(Cl)c(Br)c1	768229298	ATEQCPKTDSXMMP-UHFFFAOYSA-N	441.625	1.626	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)C(=O)Nc1ccc(Cc2nnc3n2CCCCC3)cc1	768241412	HTNHBQJKWCAFBV-UHFFFAOYSA-N	447.499	1.319	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)c3ccc(CS(N)(=O)=O)cc3)n[nH]2)c1	768265128	TYPDZRCHMMJUKP-UHFFFAOYSA-N	427.486	1.557	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)c1ccc(S(=O)(=O)C(F)F)cc1	768629103	FWVANUQGXLXREU-UHFFFAOYSA-N	434.442	1.852	50	20	IDGD	
Cn1c(NNC(=O)CN2C(=O)N[C@]3(CCCC(C)(C)C3)C2=O)nc2ccccc2c1=O	769089334	HRKPEXOMAYPLFJ-NRFANRHFSA-N	426.477	1.267	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)NC(C(N)=O)C(N)=O)c(C)n1-c1cccc(Cl)c1Cl	769757234	WBPAVRKAWYCVJJ-GHXNOFRVSA-N	434.283	1.763	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(CCC(=O)NNC(=S)NCCSC)cc1	769769148	KAJVJGHLUDVCHB-UHFFFAOYSA-N	432.637	1.508	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=S)NCCSC)ccc1Cl	769770031	YAUSWDBPHJZBEF-UHFFFAOYSA-N	439.028	1.842	50	20	IDGD	
O=C(NNC(=O)c1ccoc1Br)c1ccc(S(=O)(=O)N2CCCC2)cc1	770109262	CIXWDRDFJPWZES-UHFFFAOYSA-N	442.291	1.901	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)c2ccc(S(=O)(=O)N(C)C)nc2)cc1F	770227995	RTXQLOBNNWXFNU-UHFFFAOYSA-N	427.483	1.111	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)NCCOc3ccc4c(c3)OCO4)nc21	770344006	FKHOOOYQHIJJHE-UHFFFAOYSA-N	429.437	1.721	50	20	IDGD	
O=C(C[C@H](O)c1cccc(F)c1)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	772810600	KOQMKLJVPCTJEX-FQEVSTJZSA-N	448.926	1.868	50	20	IDGD	
Cn1nc(-c2cc(F)cc(F)c2)cc1NC(=O)C(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	773514203	GBIBQQLIYDWRMO-UHFFFAOYSA-N	444.354	1.673	50	20	IDGD	
COc1ccc(F)cc1CC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	773745666	PRXMTPJGJIXANO-UHFFFAOYSA-N	435.477	1.623	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)N[C@H](CS(C)(=O)=O)c2ccccc2)cc1	774285116	YUEMZAFYBXGVMV-DNVCBOLYSA-N	449.529	1.969	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCOCC2)cc1NC(=O)NNC(=O)c1ccccc1	775279723	FLMIWNIPUMTTAA-UHFFFAOYSA-N	434.474	1.183	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)NC[C@H]2CC[C@H](C(=O)N(C)C)O2)c1	775454852	NWJYLSDCDRWSOB-BXUZGUMPSA-N	443.298	1.038	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)Nc1ccnn1[C@@H]1CCS(=O)(=O)C1	776054585	GWSFOAIUAHMOLS-VXGBXAGGSA-N	425.442	1.002	50	20	IDGD	
CN(CCCC(=O)NNc1cccc(S(C)(=O)=O)c1)S(=O)(=O)c1ccc(F)cc1	776538519	UXMWAGULZCLXFA-UHFFFAOYSA-N	443.522	1.773	50	20	IDGD	
O=C(NNC(=O)c1ccc(Br)cc1C(F)(F)F)N[C@@H]1CCS(=O)(=O)C1	776704554	CWGGSYBAAJOQEM-MRVPVSSYSA-N	444.229	1.599	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)C[C@@H]2CCN(C(=O)OC(C)(C)C)C2)c2ccccc2c1=O	778295444	PGQHDTIBDWEABZ-ZDUSSCGKSA-N	429.477	1.342	50	20	IDGD	
O=C(NNc1ccccn1)Nc1cc(S(=O)(=O)N2CCOCC2)ccc1N1CCCC1	779000184	UUINMUCYIRZVER-UHFFFAOYSA-N	446.533	1.851	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NN=C3CCc4cc(O)ccc43)CC2)cc1	780237286	UOSDCNPFFWJYBE-UHFFFAOYSA-N	442.541	1.474	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)NCc2ccccc2CN2CC[C@@H](O)C2)c1	781956426	UGBAAUCUMUEZEU-HXUWFJFHSA-N	426.517	1.779	50	20	IDGD	
C[C@@H](C(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(O)cc2)c1)n1cccn1	782834554	YNHZUMZNSABTKO-ZDUSSCGKSA-N	436.428	1.188	50	20	IDGD	
Cc1cc(F)ccc1NNC(=O)C(=O)Nc1cnn(-c2ccccc2S(C)(=O)=O)c1	783447498	GNKROQLHFLEWFS-UHFFFAOYSA-N	431.449	1.805	50	20	IDGD	
O=C1C[C@@H](Cc2ccc(NC(=O)C(=O)NNc3ccccc3C(F)(F)F)cc2)C(=O)N1	784831834	VUUMWUAZNPKGJN-GFCCVEGCSA-N	434.374	1.992	50	20	IDGD	
COC(=O)c1cc(OC)c(OC)c(OC)c1NC(=O)C(=O)NNc1cccnc1Cl	784843943	XHRRSWFFBLOEMZ-UHFFFAOYSA-N	438.824	1.629	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2ccc(C(=O)N3CCCC3)cc2C)n1	785226291	GAWSUXKBABYLPC-UHFFFAOYSA-N	439.520	1.949	50	20	IDGD	
CN(NC(=O)Nc1ccc(-n2nccn2)cc1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	785844532	OOYQILIOIPGDNW-UHFFFAOYSA-N	444.496	1.908	50	20	IDGD	
Cc1nnnn1[C@@H](Cc1ccccc1)C(=O)OCC(=O)NNC(=O)c1cccc(Cl)c1	786129963	WMOWDPKRCMMIJJ-KRWDZBQOSA-N	442.863	1.423	50	20	IDGD	
C[C@@H]1[C@H](C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)CCN1C(=O)OC(C)(C)C	786378315	RRVVKYLAPSSJHR-CZUORRHYSA-N	430.461	1.508	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2ccc(C)c(N3CCNC3=O)c2)c1	787541346	PITTXECYLHLNQM-UHFFFAOYSA-N	439.472	1.306	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(C(=O)OC)c(C)cc2C)cc1OC	788330033	BCYHHDQKYUFNST-UHFFFAOYSA-N	443.456	1.897	50	20	IDGD	
CC(C)(C)OC(=O)N1CC2(C[C@@H]2C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)C1	789181727	BIGIZUUHUVQQEE-OAHLLOKOSA-N	430.509	1.097	50	20	IDGD	
COC(=O)CNC(=O)c1ccc(NC(=O)C(=O)NNc2ccc(Cl)c(OC)c2)cc1	789795828	FXDVMIOMPVFDDK-UHFFFAOYSA-N	434.836	1.333	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)[C@@H]2CCN(CC(F)(F)F)C2)cc1	792015427	WGOHCYGBZBVJKS-CQSZACIVSA-N	442.467	1.753	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)CCC(=O)c3cnn(C)c3)n[nH]2)cc1OC	793747939	DRSFLHMQYCRBMN-UHFFFAOYSA-N	426.433	1.252	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CCCNS(=O)(=O)c2ccc3c(c2)OCCCO3)n1	794083283	GWJXWOSJYPHIPD-UHFFFAOYSA-N	448.501	1.071	50	20	IDGD	
COc1ccc(-c2nn(CCC#N)cc2/C=C(\C#N)C(=O)N2CC(CC(N)=O)C2)cc1OC	794282122	ZDPIJZSNDJFUCS-RQZCQDPDSA-N	448.483	1.722	50	20	IDGD	
Cc1nn(Cc2ccccc2)c(N)c1C(=O)OCC(=O)NNC(=O)c1ccc(C#N)cc1	803934586	NUZWPMUMCNDAGQ-UHFFFAOYSA-N	432.440	1.312	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N(C)C[C@H](C)OC)cc1	804839154	YJVSNPRPGDSNNO-VUVCFOEZSA-N	425.489	1.834	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccc(NC(=O)NNc2ccc(-n3ccnc3)nn2)nc1	806435626	MXPCGQPZUGDCIQ-UHFFFAOYSA-N	431.482	1.283	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)C(=O)Nc1ccc(F)c(N2CCCNC2=O)c1	806979035	LFEYEVPVEQANAS-UHFFFAOYSA-N	443.435	1.048	50	20	IDGD	
COC(=O)c1cc(Br)c(OC)cc1NC(=O)C(=O)NNc1cccc(F)n1	807391914	AWBNCYUWYMSZDJ-UHFFFAOYSA-N	441.213	1.860	50	20	IDGD	
CC(C)(C)OC(=O)N1CCc2ccccc2[C@@H]1CNC(=O)NNC(=O)C(=O)NC1CC1	807437011	PCPRVLCPEZDTQB-INIZCTEOSA-N	431.493	1.130	50	20	IDGD	
CCc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	810385019	UUVNAYCJWLCQGS-UHFFFAOYSA-N	438.400	1.448	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)Nc2cccc(S(=O)(=O)N(C)C)c2)cc1	812912937	HADPAEVUQWGWKB-UHFFFAOYSA-N	441.535	1.336	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccc3c(c2)OC(F)(F)O3)cc1	813033024	AQZIOQASFCQWII-UHFFFAOYSA-N	442.400	1.340	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cccnc2)cc1S(=O)(=O)C1CCCC1	815563484	DMKQLOBEVREAJH-UHFFFAOYSA-N	430.486	1.506	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CC(F)(F)F)cc1S(=O)(=O)C1CCCC1	815568802	VDRWNPATVOJQNL-UHFFFAOYSA-N	435.424	1.750	50	20	IDGD	
CC(C)[C@H](NC(=O)COc1ccccc1)C(=O)NNC(=O)Nc1ccc2c(c1)OCO2	816597016	AFIRRPGQACWBKO-IBGZPJMESA-N	428.445	1.788	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C[C@@H](c2nccn2C)C(F)(F)F)cc(OC)c1OC	816814442	QSULWVOLLVPAEC-NSHDSACASA-N	430.383	1.943	50	20	IDGD	
Nc1nc(C(=O)NNC(=O)c2cc3c(s2)CCCCCC3)nc(N2CCOCC2)n1	816827905	JUAUTNXMYKDPDO-UHFFFAOYSA-N	431.522	1.086	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C2=NN(c3ccccc3)C(=O)CC2)cc(OC)c1OC	859257420	AYGOOLQAVOQJOM-UHFFFAOYSA-N	426.429	1.656	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCCN1C(=O)c1cccs1)c1ccc(-n2cnnn2)cc1	894382699	BGNFMSIFXMUNBD-OAHLLOKOSA-N	425.474	1.180	50	20	IDGD	
CC(C)NS(=O)(=O)c1cc(C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)ccc1F	914715445	WJHZIANGOUTPSZ-GFCCVEGCSA-N	441.456	1.880	50	20	IDGD	
O=C(COc1ccc(OCc2ccccc2)cc1)NNC(=O)N[C@@H]1CCS(=O)(=O)C1	915880411	LTNQXFHTXCXDGF-MRXNPFEDSA-N	433.486	1.162	50	20	IDGD	
COc1ccc([C@@H](CNC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)N(C)C)cc1OC	915897279	BOIJCBWCCIZTTL-MRXNPFEDSA-N	431.449	1.859	50	20	IDGD	
Cc1cnn(-c2ccc(C(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)cc2)c1	916094560	OABYFTMWYJDEPP-UHFFFAOYSA-N	427.486	1.506	50	20	IDGD	
CCn1cnc2c1c(=O)n(CC(=O)NN=Cc1ccc(C)cc1)c(=O)n2Cc1ccccc1	916331645	JBHBOJMKUMPXJF-UHFFFAOYSA-N	444.495	1.887	50	20	IDGD	
COc1cccc(NCC(=O)NN=C(C)c2ccc(S(=O)(=O)NCCC(=O)O)cc2)c1	916359920	REPMJHXVIRTIFC-UHFFFAOYSA-N	448.501	1.401	50	20	IDGD	
COc1cc(CNC(=O)NN[C@]2(C)CCS(=O)(=O)C2)ccc1OCC(F)(F)F	916389474	YFYVPTCEPCHONH-OAHLLOKOSA-N	425.429	1.517	50	20	IDGD	
COCc1c(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)oc2ccccc12	917362591	UAQFYFXQQKBKJN-UHFFFAOYSA-N	437.861	1.955	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)c(OC)c1OC	917698941	NUZGBOOYLHUVPW-UHFFFAOYSA-N	440.456	1.998	50	20	IDGD	
CNS(=O)(=O)c1ccc([C@@H](C)NC(=O)NNC(=O)COc2ccccc2OC)cc1	919778349	ACGNAFWLKNESNG-CYBMUJFWSA-N	436.490	1.074	50	20	IDGD	
Cn1c(=NNC(=O)[C@@H]2CCCN2C(=O)/C=C/c2ccc(C(N)=O)cc2)sc2ccccc21	920017866	GFSOSSAZULUZGV-WIDFDUDOSA-N	449.536	1.975	50	20	IDGD	
CCNC(=O)CN1CCCN(C(=O)/C(C#N)=C\c2cc(C)n(C[C@H]3CCCO3)c2C)CC1	920456146	YCPDPVSSAZZVIX-ZPWPBLDLSA-N	441.576	1.861	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)Nc2cccc(CN3CCC[C@@H]3C(N)=O)c2)cc1	920930934	WAAIDEDPSLOSAY-LJQANCHMSA-N	436.472	1.240	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@H](C)C(=O)NNC(=O)CNS(=O)(=O)c1ccccc1	1115812205	DWVHZFONYIUGCD-CQSZACIVSA-N	439.921	1.850	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1ccc(COc2ccccc2)o1)C(=O)NCC(F)(F)F	1317934889	CMAALXKRHGSXNE-NSHDSACASA-N	428.367	1.870	50	20	IDGD	
CC(=NNC(=O)c1n[nH]c2c1CCCC2)c1ccc(S(=O)(=O)NCCCN(C)C)cc1	1317998423	KSDONPWCTWHIOC-UHFFFAOYSA-N	446.577	1.673	50	20	IDGD	
CC(C)(C)OC(=O)NC1(C(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)CC1	1319128855	WGSBJGBSDZTBKE-UHFFFAOYSA-N	426.514	1.838	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)(C)O)cc1OC	1326047644	FFYDWKVWRZJWDE-OAHLLOKOSA-N	425.482	1.519	50	20	IDGD	
CNS(=O)(=O)c1ccc(Br)c(C(=O)NNC(=S)N[C@@H](C)C2CC2)c1	1329290122	CMQGWEDDNNUVJF-QMMMGPOBSA-N	435.369	1.265	50	20	IDGD	
O=C(NC[C@]1(N2CCOCC2)CCSC1)NNC(=O)c1cncn1-c1ccccc1	1337740888	HQXPZUSARGPDMH-HXUWFJFHSA-N	430.534	1.024	50	20	IDGD	
CS(=O)(=O)Nc1ccccc1CC(=O)NNC(=O)c1ccc(Br)s1	1338865652	ZLHJOAYXGYQDDU-UHFFFAOYSA-N	432.321	1.886	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnc4[nH]ncc4c3)C2)C1	1778413322	OYNTWBSSUHWBDW-SGTLLEGYSA-N	436.310	1.432	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cccn4ccnc34)C2)C1	1778577799	KJQJHVSOCQQHKN-AUUYWEPGSA-N	435.322	1.809	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H]1CCOC1)CCO2	1780099134	UMNGPANGIXDCNU-BTYIYWSLSA-N	447.444	1.000	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(CO)on2)C1	1780213653	BEPBOAROASPDBV-WBHUJUFNSA-N	444.326	1.325	50	20	IDGD	
COc1ccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](O)CCl)C3)c(F)c1	1780897914	DVUAZNLHFJUWEY-SQGPQFPESA-N	428.888	1.562	50	20	IDGD	
O=C1Cc2cccc(C(=O)N3CCO[C@@]4(CCN(C(=O)[C@H](F)Br)C4)C3)c2N1	1781333044	LGTVWBXWXAIPOW-MAUKXSAKSA-N	440.269	1.315	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](CC)NC(N)=O)C2	1781899869	BISYNYZIJDHHFR-UYAYXHRUSA-N	447.374	1.121	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1[nH]nnc1C)C2	1781900574	NISIZZORCFZGRR-OGHNNQOOSA-N	428.331	1.414	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](NC(C)=O)C(C)(C)C)C2	1782172492	VUODDAWNKQZCAS-PZTGFMGMSA-N	445.988	1.305	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)Cc3cccc([N+](=O)[O-])c3)CCO2)C1	1783868277	DXKXTZFJVYWWOI-LPHOPBHVSA-N	425.869	1.221	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H]1C[C@H]1c1ccc(OC)cc1)CCO2	1783870516	CSUCJDUWOFLXRF-OZIGNCPNSA-N	436.936	1.882	50	20	IDGD	
C#CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCO[C@@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783952077	MLGJEDXCZRIASI-ORAYPTAESA-N	448.347	1.537	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cscn3)C[C@@H]21	1783965759	POTRZBIBSAKDCV-JURCDPSOSA-N	430.368	1.696	50	20	IDGD	
COC(=O)[C@H]1CC[C@H](C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)C(C)(C)CCl)C[C@@H]32)C1	1784075618	JFJDCPVLOAPOQG-WOYTXXSLSA-N	428.957	1.820	50	20	IDGD	
COC(=O)[C@H]1CC[C@@H](C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CO[Si](C)(C)C)C[C@@H]32)C1	1784081632	WUIJEFZQCMDENW-FPSMNIFISA-N	440.613	1.407	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](CC(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](F)Cl)CCO3)C1	1784149231	NXATUEUOHJUAEU-IIMJZQEZSA-N	447.935	1.998	50	20	IDGD	
O=C(Cc1ccc(F)cn1)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21	1787032572	NVQRCHKFUBQJBK-RCBQFDQVSA-N	428.302	1.528	50	20	IDGD	
Cc1occ(C(F)(F)F)c1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21	1787663187	AOLWBXNXVQKEMI-IMIFBBOLSA-N	438.830	1.800	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)c1n[nH]c2ccccc12	1788332578	OFRCFJKGLSOMEL-ZAJUMQRFSA-N	439.285	1.847	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(Cl)nn3)[C@H]2C1	1788837876	NTPXDGKMICTAOB-MNXVOIDGSA-N	445.745	1.897	50	20	IDGD	
CC(=O)O[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]2C1)C(C)C	1789868108	NLZZKXQVGIGBRC-XHWCBRGXSA-N	437.364	1.790	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnn4cccnc34)C[C@@H]21)[C@H](F)Br	1789926472	ZJWVMWRYZDVXKS-PYJNHQTQSA-N	440.273	1.013	50	20	IDGD	
C[C@@H](Cc1ccccn1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]2C1	1789926648	DZSZRRFSNLTRPZ-XPYWIHLFSA-N	442.329	1.930	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nnsc3C3CC3)C[C@@H]21	1791058012	VOVJSLJPSFLINB-BQUFFADESA-N	443.367	1.792	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)NC1(c2ccc(NC(=O)CCC(=O)NN(C)C)cc2)CCC1	1791601160	QNVVOSISAFWRDY-OAHLLOKOSA-N	429.521	1.184	50	20	IDGD	
COC(=O)c1ccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C(C)(C)CCl)cc1	1792786106	OCTZHCNZOKGJOO-IZZQQSIFSA-N	436.936	1.870	50	20	IDGD	
COc1cccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)CBr)n1	1792868831	QZRIQEYFUKADQC-ZUMXRPEOSA-N	440.338	1.253	50	20	IDGD	
COC(=O)[C@@H]1CC[C@@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CO[Si](C)(C)C)C3)C1	1792969882	RFBHAMRNPKHPKN-MAPUTHEBSA-N	426.586	1.017	50	20	IDGD	
Cc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](O)CCl)c2cc(O)ccc2n1	1792981147	FVDQVRSIBZALGN-ATNYCFDYSA-N	433.892	1.052	50	20	IDGD	
CC(=O)Nc1ccc(Cl)c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](O)CCl)c1	1792983576	PMFQAWURYSOONM-CZAMWMTLSA-N	444.315	1.101	50	20	IDGD	
C=CC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCl	1793107127	NROONNGNIXEVFF-XFIYOXNOSA-N	429.945	1.694	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CC(=O)N(C3CCCC3)C1)C2	1793445870	UESJERRCRBBWAL-DAQZSUFXSA-N	439.984	1.775	50	20	IDGD	
C=CCCc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](Cl)COC)C3)c(O)n1	1794490942	PIBUPWVWTFDZQT-LTCOOKNTSA-N	437.924	1.363	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/c1ccc([N+](=O)[O-])o1)C2	1795113228	PNAXDBULPQDKJY-VIQOOVDJSA-N	442.266	1.576	50	20	IDGD	
Cc1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)cc1Cl	1796189579	DUZDBXONTZDCLI-REPLKXPHSA-N	426.709	1.894	50	20	IDGD	
Cc1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)cc2c[nH]nc12	1796193031	IYRWIVBFDXPXGY-ACDBMABISA-N	432.289	1.117	50	20	IDGD	
Cc1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)cc2c[nH]nc12	1798443050	ORFKVIQRQFHTKE-BJWYYQGGSA-N	447.499	1.435	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc([N+](=O)[O-])cc1F	1799492946	FCZWOIFASKHOGI-YHYOWMERSA-N	429.832	1.191	50	20	IDGD	
COc1c(Cl)ccnc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)Br	1800760208	ISAWAPSFTIXTBU-KQXIARHKSA-N	446.729	1.730	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc([N+](=O)[O-])cc1F)C2	1800977847	ZMILVCSRQRKXMZ-VAECKANCSA-N	429.832	1.191	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1c[nH]c3ncccc13)C2	1800983260	UNQXRNYESRFKKJ-LORHWOILSA-N	434.924	1.339	50	20	IDGD	
CC(C)c1ccc(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)cc1	1801857485	RHIMTMMGDRUBGF-NUNAXRQHSA-N	434.345	1.984	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc2c1CCCC2)c1cccc(B(O)O)c1	1803697935	UOYROULHEWINFN-WKCHPHFGSA-N	432.329	1.811	50	20	IDGD	
Cc1ccc(C(=O)NC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)o1	1803781917	GILGIFAXDQTWHL-JXFKEZNVSA-N	448.483	1.615	50	20	IDGD	
COc1nccnc1C(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)Br)[C@@H]1c1cccnc1	1804983280	YWNYSAVXZKCSKR-IVMMDQJWSA-N	448.321	1.983	50	20	IDGD	
CN1CCCn2nc(C(=O)N3CCC4(CCCN(C(=O)[C@@H](O)CCl)C4)CC3)cc2C1	1805525884	IDTCXHWHRTXLGP-SFHVURJKSA-N	437.972	1.163	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)[C@@H]1CC[C@H]2CCC(=O)N2C1	1807727253	RRTMNHSWNNCYOR-NMDDUFOESA-N	448.951	1.088	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)CNC(=O)C(F)(F)F)[C@@H]1c1cccnc1	1808277308	BMRWJOMWIUEEMV-KCQAQPDRSA-N	434.846	1.783	50	20	IDGD	
COCC(=O)N1CCCC2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)CC2)C1	1809195604	DTHLAYXPAHAKEX-UHFFFAOYSA-N	445.564	1.210	50	20	IDGD	
Cc1ccc(C(=O)N2CCC3(CCCN(C(=O)c4ccc(B(O)O)cc4)C3)CC2)cc1F	1809969951	WGTWFZMZBIKGCQ-UHFFFAOYSA-N	438.308	1.973	50	20	IDGD	
C[C@@H](Cc1ccncc1)C(=O)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1	1809980897	ZCBXSOFXGZIHIS-IBGZPJMESA-N	449.360	1.485	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@H]1CCN(C(=O)Cc2cnccn2)[C@@H]1c1cccnc1	1810537744	NIUAHGXRWLKBMV-DYESRHJHSA-N	427.581	1.972	50	20	IDGD	
CCNC(=S)NCC(=O)NC[C@@H]1CCN(C(=O)C(C)(C)CCl)[C@@H]1c1cccnc1	1812327983	CIJJUEHUOHCGMX-DOTOQJQBSA-N	440.013	1.836	50	20	IDGD	
CC(=O)NCCC(=O)N1CC[C@H](CNC(=O)[C@@H](C)Br)[C@@H]1c1cccnc1	1812868175	TVWPYWYWSMNYJQ-VMGRFDJRSA-N	425.327	1.397	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)C2(C)COC2)n[nH]1	1814558957	ZFLVQWWLDOTPHZ-CBFMJHRQSA-N	441.492	1.572	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ncn(-c3ccccc3)n2)[nH]n1)[C@H](O)CCl	1814871566	SFBMLBURDABGHV-HZPDHXFCSA-N	443.895	1.896	50	20	IDGD	
Cc1cc(C)n2ncc(C(=O)N3CCCC[C@@H]3c3cc(NC(=O)[C@@H](O)CCl)n[nH]3)c2n1	1814871691	VQIODEKZBONMQI-CVEARBPZSA-N	445.911	1.975	50	20	IDGD	
O=C1COc2ccc(C(=O)N3CCCC[C@H]3c3cc(NC(=O)[C@@H](O)CCl)n[nH]3)cc2N1	1814873323	PIYWGRNUAKCSEN-GJZGRUSLSA-N	447.879	1.646	50	20	IDGD	
Cc1nscc1C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1	1815337484	SSBDWIHAHOVEMU-CYBMUJFWSA-N	442.331	1.127	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H]1CCCSC1)CC2)c1ccc(B(O)O)cc1	1815347959	ZUNSHKBXQLOFBG-HIFRSBDPSA-N	445.375	1.192	50	20	IDGD	
C#CCCCCC(=O)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1	1815362012	YLQPWDBGNWDBMJ-MRXNPFEDSA-N	425.319	1.242	50	20	IDGD	
CNC(=S)NCCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](C)Br)CC2	1819810450	DWWXEMXRSHRHHD-IUCAKERBSA-N	448.412	1.323	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)N[C@@H]1CCc2nc(NC(=O)CO[Si](C)(C)C)sc2C1	1820165076	SSDFVLQHWSNWKL-MNOVXSKESA-N	427.603	1.354	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN2C(=O)CNC2=O)[nH]n1	1820862821	UVFDXDCYUZWGOO-APPDUMDISA-N	445.307	1.190	50	20	IDGD	
C[C@H](Br)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H]2CCC(=O)NC2)[nH]n1	1822184235	DCOIAPUSQBDEEP-GMXVVIOVSA-N	426.315	1.711	50	20	IDGD	
CC(=O)NC(C)(C)C(=O)N[C@H]1CCc2nc(NC(=O)[C@H](C)Br)sc2C1	1825636472	VYOMROJDTJRSPS-WPRPVWTQSA-N	431.356	1.753	50	20	IDGD	
Cc1ccc(CC(=O)N[C@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)o1	1826091825	FHTJBXHAFOAEOF-ZDUSSCGKSA-N	433.534	1.572	50	20	IDGD	
CNc1ccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)cc1	1826849876	CMLORVRIVXMBPB-HSZRJFAPSA-N	449.360	1.955	50	20	IDGD	
C[C@H](NC(=O)c1cnccn1)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H](F)Cl)CC1	1827608945	MRCQKVPTHDWFTC-IAOVAPTHSA-N	439.919	1.749	50	20	IDGD	
C[C@@H]1CC[C@H](C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)O1	1828405153	IIXCUXYZKDLCFA-CDHQVMDDSA-N	443.548	1.486	50	20	IDGD	
Cc1n[nH]c(C)c1CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830363602	FBLYMAYZOLEVDL-HXUWFJFHSA-N	426.945	1.290	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cncc4cnccc34)C2)C1	1830364690	PTNDCHMXCNOLSF-QFIPXVFZSA-N	446.935	1.965	50	20	IDGD	
CCc1nc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)co1	1830539500	HOPADLPLDMEDTK-UGSOOPFHSA-N	444.326	1.338	50	20	IDGD	
O=C(/C=C/c1cc2ccccc2o1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1830730890	GMUJISIVEDSQNB-IHMXKHASSA-N	448.903	1.502	50	20	IDGD	
COc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)cc1Cl	1830738753	UQEWXEANNPAZLD-HNAYVOBHSA-N	447.315	1.018	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2nc3ncccn3n2)CC1	1831832282	FTZJFRDFAMPDQR-HOTGVXAUSA-N	434.928	1.611	50	20	IDGD	
Cc1nccn1CC(=O)N1CCC([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1	1831874347	HHINUTLVMYHQBU-IBGZPJMESA-N	432.569	1.184	50	20	IDGD	
Cc1cnn([C@@H](C)C(=O)N2CCCC[C@@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)c1	1832186563	CENGYLNVEGCAQB-AZUAARDMSA-N	446.596	1.745	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3ccncc3Cl)CC2)CC1)[C@@H](O)CCl	1833311663	AACJUYKXABIJHS-KRWDZBQOSA-N	429.348	1.520	50	20	IDGD	
C[C@@H](Cc1ccncc1)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)CCl)CC2)CC1	1833312550	WYHRBCVICFJZJX-JXFKEZNVSA-N	436.984	1.432	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)C(C)C)CC2)CC1	1833350190	TUJBJZQDYSCJHM-SJORKVTESA-N	432.403	1.748	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(C)c(C)n3)CCO2)C1	1833694932	FDPMNXAHABQHPX-OXJNMPFZSA-N	425.913	1.022	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccn(C)c3)CCO2)C1	1833858920	ORPYCBKSHJFBED-QAPCUYQASA-N	428.327	1.269	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(F)cn3)CCO2)C1	1834473800	OVABFRQVTRZJHD-ACJLOTCBSA-N	444.301	1.322	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](CC)NC)CC2)CC1	1834794865	JFWPOWMOFOIHHS-IAGOWNOFSA-N	431.419	1.730	50	20	IDGD	
O=Cc1ccc(C(=O)NC2CCN(C3CCN(C(=O)[C@H](O)CCl)CC3)CC2)s1	1834802425	RCKJYWRHVUXHCK-MRXNPFEDSA-N	427.954	1.346	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)c3ccncc3F)C2)C1	1834821675	TUOYZUREVUUBSK-QGZVFWFLSA-N	430.274	1.076	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)c1cccn2cncc12	1835613435	AKRCPCRBYKPGDT-LJQANCHMSA-N	433.940	1.119	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1	1835829412	JEZIYTIOEKQLEC-CQSZACIVSA-N	443.386	1.034	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1)c1cccnn1	1835895592	DPLVQTQQHWUKHV-HNNXBMFYSA-N	428.306	1.352	50	20	IDGD	
CC(C)n1nccc1C(=O)NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1835944760	NPMAKDYQSUUULT-SFHVURJKSA-N	425.961	1.249	50	20	IDGD	
Cc1cnoc1C(=O)NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1	1836070357	YHGDOAYHJFPUHT-UHFFFAOYSA-N	427.343	1.953	50	20	IDGD	
N#Cc1c[nH]c(C(=O)NC2CCN(C3CCN(C(=O)[C@H](F)Br)CC3)CC2)c1	1836170464	OTICYJDXHPTMSC-INIZCTEOSA-N	440.317	1.762	50	20	IDGD	
C[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1)N1C[C@H]2C[C@H]2C1	1837287268	PPXWQTSHBLFIRH-BUSATUKNSA-N	448.391	1.019	50	20	IDGD	
COc1cccc(C(=O)N2CCOC[C@@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)n1	1837712407	OXOAIMYVPAHXGC-HXUWFJFHSA-N	437.569	1.012	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(Cl)cn3)CCO2)C1	1837899852	XNXZJRCAAIVECW-KSSFIOAISA-N	432.304	1.059	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(-c4ccncc4)[nH]n3)C2)C1	1839145828	RDQVJKBCZUOOIC-IIBYNOLFSA-N	447.923	1.559	50	20	IDGD	
O=C(C1CC2(CCC2)C1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839203512	NKCIYTIUUMLPES-KDOFPFPSSA-N	433.318	1.714	50	20	IDGD	
O=C([C@@H]1[C@@H]2C=CS[C@@H]12)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1839699899	XJMRWGHEHXGKOU-SUNOKAMTSA-N	435.315	1.008	50	20	IDGD	
COc1ccc(F)cc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840190773	LVYLTGDSRDGPDY-GOSISDBHSA-N	435.279	1.708	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)n1cccn1)CCO2	1840444088	CQQAPNUDICVFAV-VKJFTORMSA-N	443.342	1.074	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H]2COC[C@@]2(C(=O)N2CCCC23CN(C(=O)[C@@H](F)Cl)C3)C1	1841081675	JKBZWBSAEWPEMY-MNVSYLFESA-N	445.919	1.608	50	20	IDGD	
COc1ccc([N+](=O)[O-])c(C(=O)N2CC3(CCCN3C(=O)[C@H](C)CBr)C2)n1	1841286402	CIROGFWUGGWSNL-LLVKDONJSA-N	441.282	1.846	50	20	IDGD	
C[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1C(=O)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1	1841351146	HDJWEFZUGQBOLG-KKUMJFAQSA-N	429.945	1.293	50	20	IDGD	
O=C(c1ccccc1N1CCCCC1)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843012259	UPTZCPUUPLOZFC-UHFFFAOYSA-N	447.344	1.488	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)c1ccc[n+]([O-])c1)C2	1844692073	CLMOAQGGXFQTPH-UHFFFAOYSA-N	440.412	1.284	50	20	IDGD	
O=C(c1cc2cc(Br)ccn2n1)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl	1847563601	MQWWKXUOWHAMBQ-KKUMJFAQSA-N	441.713	1.512	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@@H]2CC(=O)N(Cc3ccco3)C2)cc1Br	13629295	FHJGBLSTTYEHAS-GFCCVEGCSA-N	436.262	1.860	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)COc1ccc(Br)cc1)C(=O)N1CCCC[C@H]1C	726615476	AUIDXSAARCRZFJ-CHWSQXEVSA-N	441.326	1.948	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(Br)cn2)c1	727363791	CYBJLZDOMZXSMG-UHFFFAOYSA-N	427.280	1.169	50	20	IDGD	
COc1ccc(C[C@H](NC(=O)NNC(=O)C(=O)NC2CC2)c2ccccc2)cc1OC	727605341	XZAOZNHJAWDKBV-KRWDZBQOSA-N	426.473	1.597	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCCN1CCOCC1(C)C	728401013	RZRYHACUMUUOCP-CYBMUJFWSA-N	443.342	1.658	50	20	IDGD	
COc1cc([N+](=O)[O-])c(C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1SC	728512329	PETWRCRZNMMKPY-UHFFFAOYSA-N	443.441	1.647	50	20	IDGD	
CCCN(C)CC(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2OC)c1	730273561	YFTIXIUNJYSEFZ-UHFFFAOYSA-N	434.518	1.599	50	20	IDGD	
O=C(COc1ccccc1O)NNS(=O)(=O)c1cc2c(cc1Cl)CCC(=O)N2	730812537	SSTSDMKRSGLOJW-UHFFFAOYSA-N	425.850	1.319	50	20	IDGD	
Cc1noc(C)c1S(=O)(=O)N1CCN(C(=O)/C(C#N)=C/c2cc(C#N)n(C)c2C)CC1	730830446	PCOAFWUPQXAZNW-RQZCQDPDSA-N	442.501	1.250	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(N2C[C@@H](C(=O)NNC(=O)C3CCC3)CC2=O)cc1	732141494	RPJAVZVIXNEGTR-HNNXBMFYSA-N	436.534	1.018	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)c1ccc(-c2nc(=O)o[nH]2)cc1	732265229	QDPFGWKBXQHCTN-UHFFFAOYSA-N	433.218	1.632	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N[C@H](C)[C@@H](C)N2CCOCC2)cc1Br	732464843	JVRNGCHXHXDNAB-VXGBXAGGSA-N	429.315	1.511	50	20	IDGD	
Cc1nn(C)c2[nH]c(=O)c(CCC(=O)NNC(=O)c3cnn(-c4ccccc4)c3)c(C)c12	733108525	QOCLRUCNKIKKSH-UHFFFAOYSA-N	433.472	1.458	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)NCCn2ccnc2C)cc1	733142497	ICELXHBAMOJBSP-QGOAFFKASA-N	447.499	1.662	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@]2(O)CCN(Cc3ccccc3)C2)cc(OC)c1OC	733884981	NBCPMBRGVIHSIZ-QFIPXVFZSA-N	429.473	1.110	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)C[C@H]2OCCc3ccccc32)CC1	735117971	KYAXKWJKEJZHHA-GOSISDBHSA-N	445.545	1.165	50	20	IDGD	
CN(Cc1ccccc1)C(=O)N1CCN(C(=O)NNC(=O)COCc2ccccc2)CC1	738496023	KFECMKPFJKMRJP-UHFFFAOYSA-N	439.516	1.814	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)NCCNc1nccc(C(F)(F)F)n1	739045392	LNMJPFPBZGFMPV-UHFFFAOYSA-N	426.399	1.879	50	20	IDGD	
O=C(NNS(=O)(=O)c1cccc(S(=O)(=O)NC2CC2)c1)c1cccc2ccccc12	741655908	MWRWXZLAQDJHNE-UHFFFAOYSA-N	445.522	1.904	50	20	IDGD	
COc1cc(C=O)c([N+](=O)[O-])cc1OCC(=O)NNC(=O)C(F)(F)Oc1ccccc1	741709249	DGRURCJNXTTZLV-UHFFFAOYSA-N	439.327	1.614	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@H]2CCC(=O)N2Cc2ccc(C)cc2)cc(OC)c1OC	742471251	AWMGCTKJLDLGTP-QGZVFWFLSA-N	441.484	1.973	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)[C@H](C)NC(=O)c1cc2c(C)nn(C)c2s1	743293687	HTMFCJYOHFEGLY-LBPRGKRZSA-N	444.517	1.330	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)NCCCN2C(=O)NC3(CCCC3)C2=O)cc1	743521849	UNSUIRLMGYARTL-UHFFFAOYSA-N	431.497	1.343	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)c1	744491702	VJMWAUIOZCTINK-UHFFFAOYSA-N	437.412	1.685	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)c2sc3nc4n(c(=O)c3c2C)CCC4)c1	744504849	HAOCGRMHQHYYIS-UHFFFAOYSA-N	440.481	1.639	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)CNC(=O)c2cccc(Br)c2)c1	744565372	XUZYRQCTLUQWFP-UHFFFAOYSA-N	448.273	1.492	50	20	IDGD	
CCN(CC(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1)C(=O)OC(C)(C)C	744620219	GNJWLLXJWGRHLA-UHFFFAOYSA-N	442.538	1.408	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)N[C@H]2CCCN(c3ccn(C)n3)C2=O)cc1OC	745883995	SOHWWISJPOXRJD-HNNXBMFYSA-N	444.492	1.357	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)NCCn2cnnc2C)cc1	746607259	QRAZRLIQYXIPCB-BOPFTXTBSA-N	448.487	1.057	50	20	IDGD	
COc1cc(C)nc(NNC(=O)NCc2ccc(C(=O)N3C[C@@H](C)O[C@H](C)C3)cc2)n1	746757307	OALWPLMHQDZKKG-HUUCEWRRSA-N	428.493	1.869	50	20	IDGD	
Cc1ccc2ncccc2c1S(=O)(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	748639135	AWIPHGWQPVTXDS-UHFFFAOYSA-N	448.526	1.417	50	20	IDGD	
CC(C)(C)OC(=O)NCC1CCN(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)CC1	748824222	JJAIUHMEFYDFQB-UHFFFAOYSA-N	444.496	1.253	50	20	IDGD	
Cc1nccn1CCNC(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	749215410	RCLGELHMKRKJMV-UHFFFAOYSA-N	445.487	1.538	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)c1cccc(CS(N)(=O)=O)c1	749389103	OBUOLTMBSFQSIA-UHFFFAOYSA-N	430.511	1.982	50	20	IDGD	
O=C(NNc1nc(Br)cn2ccnc12)[C@@H]1CC(=O)N(Cc2ccccn2)C1	750243705	MUMUBLXUUNEYTE-LLVKDONJSA-N	430.266	1.379	50	20	IDGD	
CN1CCN([C@@H](C(=O)NNc2nc(Br)cn3ccnc23)c2ccccc2)CC1	750248339	MNDYOMPVKSWDRB-MRXNPFEDSA-N	444.337	1.924	50	20	IDGD	
CCC(=O)NCc1cc(S(=O)(=O)NNC(=O)c2cc3c(s2)CCC3)ccc1OC	751538550	KVFCPSYINKJXQL-UHFFFAOYSA-N	437.543	1.895	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2c(Cl)cc(Cl)cc2Cl)cc1O)C(=O)NC1CC1	752788163	BBFLUJHITNRSOA-UHFFFAOYSA-N	432.651	1.578	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)[C@@H](C)c1ccc(S(C)(=O)=O)cc1	753276633	PIYVCIGNLLLHEQ-AWEZNQCLSA-N	428.514	1.953	50	20	IDGD	
N#Cc1ccc(NNC(=O)c2ccc(S(=O)(=O)N3CCNC(=O)C3)cc2)cc1Cl	753317912	WWVHVBCLYXCKHN-UHFFFAOYSA-N	433.877	1.089	50	20	IDGD	
Nc1nc(Cl)cc(NNC(=O)c2cc(S(=O)(=O)N3CCOCC3)ccc2Cl)n1	753455425	RGZRXZPZSATSMP-UHFFFAOYSA-N	447.304	1.143	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(NC(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)c1	755367203	OREAYJRGHXGOFE-UHFFFAOYSA-N	428.474	1.794	50	20	IDGD	
CCOc1ccc(NC(=O)NNC(=O)Cc2ccncc2)cc1S(=O)(=O)N(CC)CC	755450647	ODNWSMXQEZUXBM-UHFFFAOYSA-N	449.533	1.906	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2ccc3cnn(CCOC)c3c2)c2ccccc2c1=O	756269777	INUVYQFVCXPGDZ-UHFFFAOYSA-N	449.471	1.879	50	20	IDGD	
COCCOc1ccc(F)cc1NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	756331377	WFVOFYXSNHXTKT-UHFFFAOYSA-N	429.408	1.564	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)Nc1ccc(N(C)C(=O)CN2CCN(C)CC2)cc1	756360373	SFHNGJZBHLKJEG-UHFFFAOYSA-N	438.532	1.672	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)CN2C(=O)NC3(C[C@@H](C)C[C@H](C)C3)C2=O)cc1	757841792	PTJOOJTWGIMBQO-GJZGRUSLSA-N	444.488	1.046	50	20	IDGD	
O=C(NNC(=S)NC[C@H]1CCCCO1)c1cccc(S(=O)(=O)N2CCCC2)c1	758171922	JJCSEHQHIAEBIB-OAHLLOKOSA-N	426.564	1.149	50	20	IDGD	
C[C@@H](NC(=O)OC(C)(C)C)[C@@H]1CCCN(CC(=O)NNC(=O)c2ccc(C#N)cc2)C1	758797551	IJAHZOIJYBKXSQ-CRAIPNDOSA-N	429.521	1.944	50	20	IDGD	
CN1C(=O)C[C@H](C(=O)NNC(=O)COc2ccccc2O)[C@H]1c1ccc(Cl)c(F)c1	759009921	CZLUPKPOXWVJOU-HXPMCKFVSA-N	435.839	1.931	50	20	IDGD	
CCn1cnc2c1c(=O)n(CC(=O)NN=C(C)CCCOC)c(=O)n2Cc1ccccc1	759191285	CXJJBQGIGDTMGR-UHFFFAOYSA-N	440.504	1.347	50	20	IDGD	
COc1cc(F)cc(NNC(=O)C2CCN(S(=O)(=O)c3c(C)noc3C)CC2)c1	759314541	CADVBCLANNHDJJ-UHFFFAOYSA-N	426.470	1.983	50	20	IDGD	
O=C(Cc1cccc(I)c1)NNC(=O)Cc1cn2ccccc2n1	760585694	OBBFJGJONXIORF-UHFFFAOYSA-N	434.237	1.872	50	20	IDGD	
CC[C@@H](NC(=O)NNC(=O)COc1ccccc1O)[C@H]1CN(Cc2ccccc2)CCO1	760900088	URFMHOQDFXSJFV-WIYYLYMNSA-N	442.516	1.781	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(C(=O)N2CCCC2)c(F)c1)[C@@H]1COc2ccccc2O1	763417136	PIMYMYWTOANENX-SFHVURJKSA-N	449.460	1.211	50	20	IDGD	
CC(C)(C)c1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccc3c2OCCO3)cc1	763600677	SELYWLWJTYBONO-UHFFFAOYSA-N	427.457	1.920	50	20	IDGD	
CCOCCOCc1cccc(NC(=O)C(=O)NNC(=O)c2c(C)nc3ccccn23)c1	763630262	YLQVMRGMGWDKFH-UHFFFAOYSA-N	439.472	1.596	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccnc2N2CCCCC2)cc1	763659813	RRBUKEUAUFYQPF-UHFFFAOYSA-N	427.461	1.245	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2F)c(OC[C@@H]2CCCO2)c1	763681781	QODGQWVAEPBELO-HNNXBMFYSA-N	445.447	1.857	50	20	IDGD	
CN1CCN(Cc2cccc(NC(=O)C(=O)NNC(=O)c3cccc(Cl)c3)c2)CC1	763751400	YHHRHGLXHSMTJM-UHFFFAOYSA-N	429.908	1.487	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2cc(Cl)ccc2F)c2ccccc2c1=O	763786516	PFCBSIUFRSQTHA-UHFFFAOYSA-N	431.811	1.609	50	20	IDGD	
Cc1cc(Br)ccc1NC(=O)C(=O)NNC(=O)c1nnc(O)c2ccccc12	763791887	YIKOGJLEGBZQST-UHFFFAOYSA-N	444.245	1.806	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(OCc3noc(C)n3)cc2)cc1	763812555	UBNWXRNFNIVHCE-UHFFFAOYSA-N	439.428	1.430	50	20	IDGD	
Cc1ccccc1-c1cc(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)n(C)n1	763840450	LLHYCVWBXPIBJD-UHFFFAOYSA-N	425.420	1.700	50	20	IDGD	
COCCc1cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc3ccccc3c2)n(C)n1	763854822	UEVTYBIWWXCZRK-CQSZACIVSA-N	439.472	1.316	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1	763855429	OLUPQRIYKCXLEZ-UHFFFAOYSA-N	437.412	1.636	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)CCCC(=O)N2	763872819	PCIBUDWOTKHKRL-GFCCVEGCSA-N	428.420	1.654	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2nn(-c3ccccc3)cc2C)cc1OC	763900103	AJGPPXQDROUXKI-UHFFFAOYSA-N	437.456	1.988	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)C(=O)Nc1ccc(-n2cnnn2)cc1	763902090	PZBHQHDSZYMEAR-UHFFFAOYSA-N	448.468	1.494	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1cccc(Cl)c1-n1cncn1	764003160	AMKLVJBSZGGSET-UHFFFAOYSA-N	442.819	1.092	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cccc([C@@H]4CNC(=O)C4)c3)n[nH]2)cc1	764111634	PQXYEDUFZUVZOU-INIZCTEOSA-N	446.467	1.388	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)CC(F)(F)F)cc(OC)c1Br	764115459	QKVRCNFFEAMWCR-UHFFFAOYSA-N	428.161	1.505	50	20	IDGD	
CC[C@@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cccc(OC)c2O)cc1	764132662	PFROQSCKHZTBGU-GFCCVEGCSA-N	428.445	1.329	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(-n3nccn3)cc2)o1	764139502	VOOSBUXJHVQHTF-UHFFFAOYSA-N	425.449	1.102	50	20	IDGD	
CCOC(=O)C(C)(C)n1cc(NC(=O)C(=O)NNC(=O)c2cccc3cccnc23)cn1	764152099	PJUDXPBXCBHNRO-UHFFFAOYSA-N	438.444	1.129	50	20	IDGD	
C[C@@H]1CN(Cc2cccc(NC(=O)C(=O)NNC(=O)c3ccc(C#N)cc3)c2)C[C@@H](C)O1	764176151	AEURZOORBGQIPD-HZPDHXFCSA-N	435.484	1.567	50	20	IDGD	
CCn1nc(C)c(NC(=O)C(=O)NNC(=O)c2cc(F)ccc2Br)c1C	764277391	LQQHIPHJRCDQGF-UHFFFAOYSA-N	426.246	1.821	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)ccc1O)C(=O)Nc1cnn(-c2ccccc2)c1	764279868	GNLQXSXRNGJOFR-UHFFFAOYSA-N	444.245	1.740	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccn(CC(F)F)n3)n[nH]2)cc1	764386521	ALCAROSBTOJICR-UHFFFAOYSA-N	431.403	1.500	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)C(=O)Nc1cccc(N2C(=O)c3ccccc3C2=O)c1	764387113	MHUVCEBVQKPBEB-UHFFFAOYSA-N	443.419	1.590	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)C(=O)Nc1cccc(CN2C[C@H](C)O[C@@H](C)C2)c1	764404282	JGVFGYFVYBRAEH-ROUUACIJSA-N	438.528	1.933	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)c1cnc2[nH]cnc2c1	764753570	XUROEBPPQIYMLX-UHFFFAOYSA-N	427.896	1.190	50	20	IDGD	
CC(=O)N1CCN(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)CC12CCCCC2	765679231	UAALTNUZQFBPKF-UHFFFAOYSA-N	443.552	1.301	50	20	IDGD	
Cc1ccc(-c2ocnc2C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cc1	766635641	BOPYSIZBKHDWSP-UHFFFAOYSA-N	447.495	1.869	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2cc(C(=O)OCC)cnc2C)c2ccccc2c1=O	767177676	CADFEPYFQAVGDJ-UHFFFAOYSA-N	437.456	1.761	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2cn(-c3ccc(F)cc3C)nn2)c2ccccc2c1=O	767192260	VJODRBRMYMDWTR-UHFFFAOYSA-N	449.446	1.910	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cc3c(cc2F)NC(=O)CC3)cc1	767825861	UZPGNIZICCSWSL-UHFFFAOYSA-N	448.476	1.101	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)c1cn(-c2cccc([N+](=O)[O-])c2)nn1	768629055	NUWPIULIWNJUMS-UHFFFAOYSA-N	432.418	1.345	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)Nc1ccc(CS(C)(=O)=O)cc1	769233746	RKSYEWLVVAVHDI-UHFFFAOYSA-N	427.504	1.792	50	20	IDGD	
CC(C)(C)C(=O)NNC(=O)Nc1ccc(CC(=O)N2CCN(c3ncccn3)CC2)cc1	769948537	AONRKMPHXFRCKN-UHFFFAOYSA-N	439.520	1.567	50	20	IDGD	
Nc1ccc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c(C(F)(F)F)c1	770064033	IEEASYYDHWZBDA-HNNXBMFYSA-N	439.346	1.432	50	20	IDGD	
CCN1CCN(c2cccc(NC(=O)C(=O)NNC(=O)c3ccccc3OC)c2)CC1	770771754	OLNUSVPZWFIBPY-UHFFFAOYSA-N	425.489	1.237	50	20	IDGD	
COc1ccccc1-n1c(C)nnc1SCC(=O)NNc1nc(O)c2cnn(C)c2n1	770973648	OCYLCWKARWXXKE-UHFFFAOYSA-N	441.477	1.202	50	20	IDGD	
CC(C)(C)C(=O)NNC(=O)CN1C(=O)N[C@](C)(c2ccc(Br)cc2)C1=O	771250088	KWRINDKTBRFHPO-QGZVFWFLSA-N	425.283	1.410	50	20	IDGD	
CCC1(CC)[C@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)[C@H](C)[C@H]1OC	771433668	IOEQXFASSMNANS-IAOVAPTHSA-N	440.566	1.721	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1ccc(N(C)S(=O)(=O)c2ccc(C)cc2)cc1	771856477	DTQFKBYTGVZPSO-HNNXBMFYSA-N	447.513	1.923	50	20	IDGD	
COC(=O)c1ccc(C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)c(F)c1	771876060	UARAWGVZHZZYIJ-UHFFFAOYSA-N	426.404	1.978	50	20	IDGD	
CN(Cc1ccccc1)[C@H](CNC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)C1CC1	773131180	ISCXZJBAAPFECT-HXUWFJFHSA-N	434.504	1.517	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(C(=O)N3CCOCC3)ccc2C)cc1F	773885659	NQYXBTNYKQQRQQ-UHFFFAOYSA-N	442.447	1.315	50	20	IDGD	
Cc1nc(-c2cccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc3cccc(Cl)c3)c2)n[nH]1	774009983	SVWMCMKYEDGDRT-LLVKDONJSA-N	442.863	1.987	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2cc(C)oc2C)c1	776272300	SCUNAQCQLWNYAV-UHFFFAOYSA-N	429.520	1.550	50	20	IDGD	
CSC[C@H](C(=O)NNc1cccc(S(C)(=O)=O)c1)N1C(=O)[C@H]2CCCC[C@@H]2C1=O	776537355	CAGDQAFPRCWZHB-HRCADAONSA-N	439.559	1.440	50	20	IDGD	
COC(=O)Nc1ccc(S(=O)(=O)NNC(=O)c2ccc3ccccc3n2)cc1[N+](=O)[O-]	777591863	SXKRELXSKAXPNT-UHFFFAOYSA-N	445.413	1.945	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)nc(C(F)(F)F)n1	778290511	QJYMWBHZYAYQQM-UHFFFAOYSA-N	431.396	1.129	50	20	IDGD	
CN(NC(=O)c1cc(S(=O)(=O)NCc2cccnc2)c(Cl)cc1Cl)C(N)=O	778418066	IFHXWRGWBMSEDQ-UHFFFAOYSA-N	432.289	1.522	50	20	IDGD	
COc1ccc2nc(NNC(=O)C/N=C3/NS(=O)(=O)c4ccccc43)c(C)cc2c1	778477419	XENBEJWFVJVMNU-UHFFFAOYSA-N	425.470	1.734	50	20	IDGD	
Cc1nn(CC(F)(F)F)c(C)c1[C@@H](C)C(=O)NNC(=O)CCN1C[C@H](C)O[C@H](C)C1	778503135	JGAAQPKMFDZEEK-FRRDWIJNSA-N	433.475	1.812	50	20	IDGD	
C[C@H]1CCN(C(=O)OC(C)(C)C)[C@H](C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)C1	778725539	SZOBUWMWIWVFQW-RDJZCZTQSA-N	446.552	1.876	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@]2(C[C@@H]2C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)C1	780173014	BHWYOMCFFXHKCB-FOIQADDNSA-N	427.465	1.070	50	20	IDGD	
CS(=O)(=O)CC[C@H](NC(=O)c1ccccc1Cl)C(=O)NNc1ccnc(F)c1	781365467	OZDGZNZVSRXVQE-AWEZNQCLSA-N	428.873	1.551	50	20	IDGD	
CC[C@@H](C)NS(=O)(=O)Cc1cccc(NC(=O)C(=O)NNc2ccc(OC)cn2)c1	782141123	LVBLCHSBHZBIMH-CYBMUJFWSA-N	435.506	1.390	50	20	IDGD	
CC(C)Oc1ccc(F)cc1NC(=O)C(=O)NNC(=O)Cc1nc2ccccc2n1C	782887321	SMWSCAHKSHNPGI-UHFFFAOYSA-N	427.436	1.828	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NN=Cc1ncc(Br)cc1Br	783854403	QGWLCEDYXGOQHO-UHFFFAOYSA-N	441.083	1.882	50	20	IDGD	
Cc1ccc(Oc2ccccc2NC(=O)C(=O)NNC(=O)CNC(=O)c2ccco2)cc1	784002798	UPFOVGHWSSJDSF-UHFFFAOYSA-N	436.424	1.896	50	20	IDGD	
O=C(NNc1ccc(Br)nc1)C(=O)Nc1cccc(N2CCCNC2=O)c1	784811571	JVPDYVUCGLGWOJ-UHFFFAOYSA-N	433.266	1.846	50	20	IDGD	
CCNC(=O)N(C)NC(=O)C(=O)Nc1c(Br)cc(F)cc1Br	784915891	QZGVLNVTAZCBLG-UHFFFAOYSA-N	440.067	1.982	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2cccc(C(F)(F)F)n2)cc1	784952751	PRMVQRCLFSFUOV-UHFFFAOYSA-N	445.423	1.869	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1cccc2c1OCC[C@H]2N(C)C	789740311	FLRHTOOBHVRYMJ-SUMWQHHRSA-N	444.463	1.764	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccnn2-c2ccccc2)c1	792011509	HWPBBHAOGCHNJS-UHFFFAOYSA-N	441.513	1.978	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)[C@@](C)(O)Cn1cc(C(F)(F)F)ccc1=O)c1ccccc1	792155542	AKIZHVGJOPBVOU-BEFAXECRSA-N	425.407	1.959	50	20	IDGD	
COCCC[C@@H](Cc1ccccc1)NC(=O)NNC(=O)c1csc(N2CCOCC2)n1	792286173	SJXQXLUTVOEZDU-KRWDZBQOSA-N	447.561	1.962	50	20	IDGD	
CCOC(=O)Cn1cccc(NC(=O)C(=O)NNc2cc(Cl)cc(Cl)c2)c1=O	792435796	USCUXFMARSQFBX-UHFFFAOYSA-N	427.244	1.800	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)nc1Br	793023354	OFDDLNSIHXCEIV-UHFFFAOYSA-N	432.234	1.189	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)CN2C(=O)C(F)(F)Oc3ccccc32)cc1	796054237	UYXDFKXJFHGBLO-UHFFFAOYSA-N	433.367	1.318	50	20	IDGD	
O=C(NC[C@H]1CCCN1C1CCCCC1)NNC(=O)C1CCN(c2ncccn2)CC1	798064323	WDJUSSJIUOFXIU-LJQANCHMSA-N	429.569	1.821	50	20	IDGD	
COc1ccccc1CCNC(=O)CNC(=O)NNC(=O)c1cccc(Br)c1	798067291	DTOITOYWGOLFMQ-UHFFFAOYSA-N	449.305	1.761	50	20	IDGD	
COc1ccc(S(=O)(=O)NC2CC2)cc1NC(=O)NNc1ccc(-n2ccnc2)nn1	806184282	XNFJTPXVMQIVGP-UHFFFAOYSA-N	444.477	1.260	50	20	IDGD	
O=C(NNC(=O)c1ccccc1O)C(=O)Nc1cc(C(F)(F)F)cc(Br)n1	806973043	XDNBENJMDUHXPT-UHFFFAOYSA-N	447.167	1.968	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(C#N)c(Br)c2)cc1	806973445	BLSXYPRMFORFEE-UHFFFAOYSA-N	442.229	1.357	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)Cn2ncc3ccccc3c2=O)C1	808011228	RBZHMGOVGMJIIT-HNNXBMFYSA-N	429.477	1.191	50	20	IDGD	
C[C@@]1(CNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)OCCc2sccc21	811873992	FBEWIDOZQGXBOW-FQEVSTJZSA-N	430.534	1.573	50	20	IDGD	
O=C(NCc1cccc(N2C(=O)NC3(CCCC3)C2=O)c1)NNC(=O)c1ccccc1O	812561293	JICYMPFIKUASEH-UHFFFAOYSA-N	437.456	1.905	50	20	IDGD	
CCOCc1nc([C@H](C)NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)no1	812563264	FGXHRIMECRRHNQ-INIZCTEOSA-N	445.524	1.210	50	20	IDGD	
CC[C@@H](CNC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1)OC	812589215	ILCXDIWXYASWNG-KRWDZBQOSA-N	434.518	1.534	50	20	IDGD	
O=C(NNC(=O)C1(S(=O)(=O)c2ccccc2)CCOCC1)c1ccc([N+](=O)[O-])cc1	813362876	LEXCZTXMFOGNJU-UHFFFAOYSA-N	433.442	1.379	50	20	IDGD	
CCc1nc(C(C)C)ccc1C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	815353245	VRDOPSXXZPLKGG-LJQANCHMSA-N	427.457	1.912	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccc(N(C(C)=O)[C@@H]2C[C@H]2C)cc1	815568549	MHMNDBCGZXJGJS-AUUYWEPGSA-N	438.484	1.785	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C(=O)Nc1cc(COC)cc(C(=O)OC)c1)c1ccccc1	815570137	SJBOJMBQBHEGPL-SFHVURJKSA-N	427.457	1.899	50	20	IDGD	
CCOC(=O)c1cc(COC)cc(NC(=O)C(=O)NNc2ccc(C(F)(F)F)nn2)c1	815603068	SPWZJMNZTPZHSN-UHFFFAOYSA-N	441.366	1.900	50	20	IDGD	
CC(C)(C)Cc1nc2cc(NC(=O)C(=O)NNC(=O)[C@@H]3CCc4nncn4C3)ccc2o1	815691278	KTUITLBOWLTBID-GFCCVEGCSA-N	439.476	1.356	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1nc2c(s1)CSCC2	815751483	BCQHKMSLGPZNDA-UHFFFAOYSA-N	441.560	1.265	50	20	IDGD	
COc1cccc(COc2cccc(NC(=O)C(=O)NNC(=O)[C@H]3CCCO3)c2C)c1	815779652	PJNYCLRRDURULE-LJQANCHMSA-N	427.457	1.848	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)c2cccc(S(=O)(=O)Nc3cc(C)on3)c2)cc1	825606523	GCAKCOVEPUGZKX-UHFFFAOYSA-N	443.485	1.965	50	20	IDGD	
CC(C)C[C@@H](/N=C1/NS(=O)(=O)c2ccccc21)C(=O)NNC(=O)c1ccccc1F	859391690	VFGDACMNCVPQCL-MRXNPFEDSA-N	432.477	1.740	50	20	IDGD	
Cc1cc(C)c(C)c(S(=O)(=O)NCC(=O)NNC(=O)c2ccc3c(c2)OCO3)c1C	913415740	YQKWCBRLVCDREZ-UHFFFAOYSA-N	433.486	1.388	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2ccc(C(=O)NNC(=O)NC3CCCCC3)cc2)C[C@H](C)O1	913450949	FFGDJEKGDPFJND-GJZGRUSLSA-N	438.550	1.761	50	20	IDGD	
C[C@H](c1ccc(S(C)(=O)=O)cc1)N(C)C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	913463247	YYUFKPBPQZFBPP-CYBMUJFWSA-N	443.489	1.113	50	20	IDGD	
O=C(NNC(=S)NCCc1cccs1)c1ccc(S(=O)(=O)N2CCCC2)o1	914881333	CFXJVYCZFHPDCM-UHFFFAOYSA-N	428.561	1.477	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1cccs1)C(=O)OCC(=O)NNC(=O)c1ccc(Cl)cc1	915022220	UXFXYLFOXLTDTK-SNVBAGLBSA-N	445.906	1.073	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)cc1NC(=O)c1ccccc1F	915282389	BJKKLZPSGFOTCQ-CQSZACIVSA-N	433.461	1.582	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2ccc(NC(=O)C3CC3)cc2)ccc1Cl	915789082	GUFCCGLCRZXCSU-UHFFFAOYSA-N	436.877	1.411	50	20	IDGD	
COc1ccc(NCC(=O)NN=C(C)c2ccc(S(=O)(=O)NCCC(=O)O)cc2)cc1	915916106	JVKSGFYJEXBLDI-UHFFFAOYSA-N	448.501	1.401	50	20	IDGD	
COc1ccccc1NCC(=O)NN=Cc1c(C)nn([C@@H]2CCS(=O)(=O)C2)c1Cl	915920711	VRRCANHPVDTEOM-CYBMUJFWSA-N	439.925	1.775	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)NCCNS(=O)(=O)c2ccc(C)cc2)cc1	916278042	FFGAONKSXYDTFQ-UHFFFAOYSA-N	436.559	1.704	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)NCC[C@](O)(c1nccn1C)C(F)(F)F	916377467	TZKPGSAGINAKCB-INIZCTEOSA-N	449.817	1.866	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CN2CCN(C(=O)COc3ccc(Cl)cc3)CC2)cc1	917165241	VWDCJTBZRLGBGK-UHFFFAOYSA-N	444.919	1.633	50	20	IDGD	
CCc1ccc(C(=O)O)cc1S(=O)(=O)NNC(=O)c1cc(OC)c(OC)c(OC)c1	917718187	YNUKVXRRQBLMBO-UHFFFAOYSA-N	438.458	1.596	50	20	IDGD	
C[C@@H]1CCCN(S(=O)(=O)c2ccc(CNC(=O)NNC(=O)c3ccccc3O)cc2)C1	918227529	FXVFENVGHRNAMV-OAHLLOKOSA-N	446.529	1.957	50	20	IDGD	
O=C(COC(=O)[C@@H]1CCCN(C(=O)N2CCCC2)C1)NNC(=O)c1cccc(Cl)c1	919129133	KKWAGYWJTXLPTE-OAHLLOKOSA-N	436.896	1.572	50	20	IDGD	
COc1cccc([C@@H](C)C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c1	919678201	UMXVXRDLAYLCOX-OAHLLOKOSA-N	447.513	1.281	50	20	IDGD	
Cc1nnc(NNC(=O)CSCC(=O)Nc2cccc(Br)c2)nc1O	919744335	IDLDKFGMQZDXTI-UHFFFAOYSA-N	427.284	1.463	50	20	IDGD	
CNS(=O)(=O)c1ccc([C@H](C)NC(=O)NNC(=O)c2cc(OC)cc(OC)c2)cc1	919778438	BFAWSDIRIMZCDL-LBPRGKRZSA-N	436.490	1.317	50	20	IDGD	
O=C(NCc1cccc(NC(=O)[C@@H]2CCCO2)c1)NNC(=O)[C@H]1COc2ccccc2O1	920236307	AJDMGGLVIHXXEU-RBUKOAKNSA-N	440.456	1.475	50	20	IDGD	
C=CCn1c2ccccc2n2nc(C)c(C(C)=NNC(=O)N[C@H]3CCS(=O)(=O)C3)c12	920385170	WCMBRRKSUQFNHI-HNNXBMFYSA-N	428.518	1.994	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)NCc2cccc(C(=O)N3CCOCC3)c2)c1	920420209	SDNBQECJMQAJOB-UHFFFAOYSA-N	442.472	1.320	50	20	IDGD	
N#C/C(=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)NC[C@H]1COCCO1	920854915	UOTSAKAAVPUZNZ-YHTSIIMFSA-N	443.891	1.517	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)[C@H](C)OC[C@H]1CCCCO1	921225866	KXGSJZCGVYHQSP-GXTWGEPZSA-N	428.869	1.627	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1ccc(Br)cc1)c1cccc(S(N)(=O)=O)c1	1115854957	UADGFHCOKBEWIM-JTQLQIEISA-N	441.307	1.802	50	20	IDGD	
O=C(CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@@H]12)NNC(=O)c1cncn1-c1ccccc1	1318054451	LVIXWYOQZNCAOD-QILLFSRXSA-N	428.518	1.359	50	20	IDGD	
O=C1NCc2cc(C(=O)N3CC[C@@]4(C3)CN(C(=O)[C@@H](F)Br)CCO4)ccc21	1778725813	LHPNBQRBSRYGCU-RDTXWAMCSA-N	440.269	1.064	50	20	IDGD	
Cc1cc(CC(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](F)Br)C3)n[nH]1	1779461873	XBXUTZYKDMCBJX-FRFSOERESA-N	431.306	1.465	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2)c1cccc(C(F)(F)F)n1	1779683696	WZJJXTVFNUBRPA-DDUZABMNSA-N	449.857	1.828	50	20	IDGD	
COc1ccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](O)CCl)C3)cc1OC	1780382047	CKKPMATZFFXKRK-FQELHTAISA-N	440.924	1.431	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Br)C1)N1C[C@H]2C[C@@H]2C1	1780775037	VHRMKDCHUFYHNV-BJDQLAMTSA-N	446.361	1.531	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)c3cc4n(n3)CCCO4)CCO2)C1	1781230177	OLWYLXZEWCVUMH-ZWKOTPCHSA-N	431.320	1.345	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)COc2ccc(O)nn2)C1	1781491504	RCDVRDPJIUBAGD-JLTOFOAXSA-N	440.928	1.340	50	20	IDGD	
CCc1[nH]nc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](Cl)COC)C2)c1F	1782170907	FQCQIODAIIOREM-BBEGDGIKSA-N	430.908	1.493	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CNC(=O)C(F)(F)F)C1	1782234434	STSVZOFESMBAIO-OGHNNQOOSA-N	441.878	1.586	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(N(C)C)cn3)CCO2)C1	1783343520	JNJFAVFOGKHXGY-HNAYVOBHSA-N	439.354	1.765	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](C)n1ccccc1=O)CCO2	1783349637	PRYRTKYLVRGLDT-VCBZYWHSSA-N	440.338	1.413	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cn4cc(F)ccc4n3)CCO2)C1	1783533613	BMKRHJRSMFNMQK-XIKOKIGWSA-N	439.285	1.700	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)C(=O)c3ccc(Cl)cc3)CCO2)C1	1783870631	DCFFJBMLJKTAQO-DNVCBOLYSA-N	429.300	1.606	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)Cc1ccc(Cl)s1)CCO2	1783933593	RPPOZIZIVJXUPN-LJQANCHMSA-N	442.969	1.147	50	20	IDGD	
COC(=O)c1ccc(OCC(=O)N2CCO[C@@]3(CCN(C(=O)C(Cl)Cl)C3)C2)cc1	1783951449	BIIGCJZRJCXVKN-IBGZPJMESA-N	445.299	1.486	50	20	IDGD	
Cc1c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]3C2)cnn1C	1783967067	AKQIPKBBGRLSJO-MZGVZZPPSA-N	427.343	1.353	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(=O)c3ccc(Cl)cc3)[C@H]2C1	1784060999	HFTPZWDJHQJOQC-HJWJTTGWSA-N	443.327	1.756	50	20	IDGD	
COc1cc(OC)c(F)c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]3C2)c1	1784090976	FYJSDKUJEZQJMR-SIUGBPQLSA-N	444.887	1.036	50	20	IDGD	
C[C@H](Cc1ccccc1)C(=O)N1CC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1	1784209727	LCOJLRNFZFQNTR-WZONZLPQSA-N	430.549	1.068	50	20	IDGD	
O=C(CCNC(=O)c1ccc[nH]1)Nc1ccc(C2(NC(=O)[C@H](O)CCl)CCC2)cc1	1786829532	XTYKJZWSDABMQC-QGZVFWFLSA-N	432.908	1.868	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)c1cnn2ncccc12	1787378793	MUJUWUILKVQJCD-HQRZJTNHSA-N	440.273	1.013	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)c3cccc(O)n3)CCC2)cc1)c1cccc(B(O)O)c1	1788146052	XLJXLTRBVPKGEL-UHFFFAOYSA-N	431.257	1.529	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(Cl)c4nncn4c3)[C@H]2C1	1788559384	JCYOYPXRDRRGTB-PCBIJLKTSA-N	440.331	1.993	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3C[C@@]34C(=O)Nc3ccccc34)C[C@@H]21	1789864910	KDWBQPPSDSCXRE-IRDHXIRGSA-N	445.947	1.894	50	20	IDGD	
CCOc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]3C2)nn1	1789872755	WFLWGCHTOFYCJQ-NGOJXBLDSA-N	445.347	1.705	50	20	IDGD	
C[C@@H]1CCc2c(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]4C3)n[nH]c21	1789925696	HLXSQHJHCPLKSH-SSHPZETRSA-N	443.317	1.743	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4ccoc4c3)[C@H]2C1	1790397411	XJXDDGJNOXEREM-BJLQDIEVSA-N	442.516	1.399	50	20	IDGD	
C#CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C(C#N)=C/c3ccc(Br)cc3)C[C@@H]21	1790793705	SUZRPCJBJKGXAW-OLWHEGCOSA-N	442.313	1.969	50	20	IDGD	
Cc1ncc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](C)Br)[C@H]3C2)s1	1791065256	SMVMTHUWKJFSBP-LVGORTOPSA-N	430.368	1.757	50	20	IDGD	
Cc1cc(C)cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]3C2)c1	1791290674	JMRCOZSRHXNCDY-IHPCNDPISA-N	430.549	1.270	50	20	IDGD	
C=CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](O)CCl)C2	1793830340	YLOOJVRETHCSOC-YIDVYQOGSA-N	429.945	1.694	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnsn1	1794692700	HHMCSKKIAAVHJZ-RNJOBUHISA-N	443.957	1.922	50	20	IDGD	
N#Cc1cc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCBr)ccc1F	1795115111	JTLOKZRGNRKTKD-CCWDJLKJSA-N	438.297	1.614	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cccc(F)c1F)C2	1795116623	YLFWEBWIPHBWKV-IVWMJMPLSA-N	431.277	1.882	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)c1cc2c(Cl)cncc2s1	1795921450	JSMJFCPYDWHBEZ-HMVGFALLSA-N	444.340	1.753	50	20	IDGD	
C[C@H]1[C@@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Cl)CCN1C(=O)OC(C)(C)C	1796370878	OJHLHBAXVJXANQ-IATJYDTKSA-N	447.935	1.756	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1n[nH]c2cc(Cl)ccc12	1797510256	GZOBNDMAVDONAV-YHYOWMERSA-N	441.315	1.673	50	20	IDGD	
COc1cc(F)ccc1CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CO[Si](C)(C)C	1797958896	ADTZNVFNZPFSQY-VPTLXERWSA-N	438.572	1.818	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nc(O)n3c1CCCC3)C2	1799277197	SXLQRABKSYZNOY-NMRSOGARSA-N	445.347	1.365	50	20	IDGD	
COc1cccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)Br)c1F	1800764154	XAINYPISTJLKBY-OVZMXSCWSA-N	429.286	1.821	50	20	IDGD	
NC(=O)NCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](Br)Cc1ccccc1	1801572024	GFSDVLXPXVFESR-QKPAOTATSA-N	437.338	1.299	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cc1ccc3c(c1)CCC3)C2	1802332996	JSCYXSHDSZTXHG-WKCHPHFGSA-N	426.561	1.729	50	20	IDGD	
COC(=O)[C@@H]1CC[C@H](C(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@H]2c2cccnc2)C1	1803130471	QSDPXOIFJUCDAP-CENPHQPOSA-N	437.924	1.276	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)[C@H](C)CS(C)(=O)=O)[C@@H]1c1cccnc1	1803586836	FHKDOPDUYVSEAL-SIXLDLHFSA-N	429.970	1.786	50	20	IDGD	
COc1cccc(CC(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)n1	1804393402	ASCHUWKBRCDACZ-KNBMTAEXSA-N	432.908	1.333	50	20	IDGD	
Cc1cc[nH]c1C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1805004970	PVLMHFDUYGIERV-GHTZIAJQSA-N	432.289	1.031	50	20	IDGD	
Cc1ccc(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)nc1	1805870757	XVNVMUCZLPTDIJ-KNQAVFIVSA-N	444.300	1.098	50	20	IDGD	
Cc1csc(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)c1	1807358930	ANSBQQOOWNBYNU-GHTZIAJQSA-N	449.341	1.765	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC2(CCCN(C(=O)c3cccc4nc[nH]c34)C2)CC1	1810558683	MFEFEZVUHURYOG-UHFFFAOYSA-N	446.316	1.401	50	20	IDGD	
CC(=O)NC(C)(C)C(=O)N1CC[C@H](CNC(=O)[C@@H](C)Br)[C@H]1c1cccnc1	1812865853	YLTNTMAKLDAKPO-DAXOMENPSA-N	439.354	1.786	50	20	IDGD	
O=C1Cc2cccc(C(=O)N3CCCC[C@H]3c3cc(NC(=O)[C@@H](O)CCl)n[nH]3)c2N1	1814874802	FJSKCEPERNAEIH-GJZGRUSLSA-N	431.880	1.810	50	20	IDGD	
Cc1ncccc1C(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1	1815339965	XYPJSWCGXOAKND-HNNXBMFYSA-N	436.302	1.066	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](O)CCl)CC2)c1cnc(C(F)(F)F)cn1	1816084420	KQVGBWNMKANGMS-OIBJUYFYSA-N	449.842	1.777	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CN2CCCC2=O)n[nH]1	1817161775	PJIUOTJAXSWVPB-WCQYABFASA-N	426.315	1.808	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@H]2[C@H]3SC=C[C@H]32)[nH]n1)c1ccc(B(O)O)cc1	1817474784	FQQUAHXOGIXJEN-WQCNXYOZSA-N	438.318	1.271	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)C(=O)C2CC2)[nH]n1	1818110355	BXQMOFBSCNCOKC-SOAGAIGUSA-N	439.476	1.515	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3cn4cccnc4n3)sc2C1	1819030115	YGRHHOCXVDYZBS-WDEREUQCSA-N	434.909	1.665	50	20	IDGD	
CC(C)(C)NCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819402188	SUWUGVZJBDZHRT-MRXNPFEDSA-N	442.524	1.102	50	20	IDGD	
C[Si](C)(C)OCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnncc1C(=O)O)CC2	1820165681	LVTCFJFWWISJMZ-SNVBAGLBSA-N	449.565	1.709	50	20	IDGD	
C[C@H](Br)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](C)n2cnnn2)[nH]n1	1822192724	VWHJGVXFZVKCPM-NHCYSSNCSA-N	425.291	1.433	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)CC2CCOCC2)[nH]n1	1822413350	SLBYPNSDNMZGHF-QGZVFWFLSA-N	434.541	1.592	50	20	IDGD	
CN1CCC[C@@H](C(=O)N2CCCC[C@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)C1	1822415443	HEKWUNCRNVGQRP-WBVHZDCISA-N	433.557	1.117	50	20	IDGD	
COC(C)(C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1	1823828786	GMSDWHQURPNCKQ-GOSISDBHSA-N	431.537	1.343	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)Cn1ccccc1=O)CC2	1825640707	CJSPYNGJONBXLR-GHMZBOCLSA-N	439.335	1.700	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1[nH]nc3ccncc13)CC2	1825998620	KLPWQLGQMVDHOS-ONGXEEELSA-N	434.909	1.894	50	20	IDGD	
C[C@@](O)(CC(=O)O)CC(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCBr)CC2	1826069673	VGUCHJTWHIEAKG-ABKXIKBNSA-N	448.339	1.456	50	20	IDGD	
O=C(c1cscn1)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827056556	YCRGKKRWIYXWPW-IBGZPJMESA-N	427.335	1.370	50	20	IDGD	
O=C(c1ncc(Cl)cc1Cl)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1829606795	MVEVDXPIIYDJCA-BBRMVZONSA-N	440.686	1.993	50	20	IDGD	
Cc1ccoc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)CBr)CCO2	1830538754	OWCBPJZVOFGXCT-RDTXWAMCSA-N	429.311	1.689	50	20	IDGD	
Cc1ccc2nc(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)[C@H](O)CCl)CCO4)ccc2c1	1830727830	HQMDHOZZCJRCEC-DENIHFKCSA-N	447.919	1.213	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4ncccn4n3)C2)C1	1831651626	RZJXTJDGJCNUKQ-YWZLYKJASA-N	435.912	1.207	50	20	IDGD	
CSCC[C@@H](O)C(=O)N1CCC([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1	1831874555	KFSSBMNZGISFDU-QZTJIDSGSA-N	442.626	1.093	50	20	IDGD	
CSCC[C@@H](O)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1	1831898148	KGNAZNCCQQGQMA-QZTJIDSGSA-N	442.626	1.093	50	20	IDGD	
C[C@@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1)n1cccc1	1832108240	MRVIDAFUMUQWIX-AVRDEDQJSA-N	437.349	1.662	50	20	IDGD	
C[C@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)c3ncn(C)n3)CC2)CC1	1833262546	UYCIBDVKVSCYSB-CYBMUJFWSA-N	441.374	1.031	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)CNC(=S)NCC)CC2)CC1	1833534687	LNUYEKOHDHQZJW-KRWDZBQOSA-N	446.061	1.450	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCBr)CCO3)C2)cc1O	1834823938	NWMIHJWEBRKOQI-LJQANCHMSA-N	441.322	1.556	50	20	IDGD	
Cc1ccn2ncc(C(=O)NC3CCN(C4CCN(C(=O)[C@@H](O)CCl)CC4)CC3)c2c1	1835035493	RYQDGRMWNOKDHD-FQEVSTJZSA-N	447.967	1.428	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)c1cnn2ccccc12	1835307884	BAWAESOYPHZQHK-IBGZPJMESA-N	433.940	1.119	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)c1ccn2nccc2c1	1835626961	DFTVFUMHTZNMED-IBGZPJMESA-N	433.940	1.119	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC1CCN(C2CCN(C(=O)CSC(=N)N)CC2)CC1	1836398636	PKGVTPGWSYLLMU-QGZVFWFLSA-N	438.425	1.421	50	20	IDGD	
Nc1nc(C(=O)N2CCC(N3CCC(NC(=O)[C@H](F)Br)CC3)CC2)cs1	1836412489	IVCYDNROLFZPQB-ZDUSSCGKSA-N	448.362	1.601	50	20	IDGD	
O=C(CS[C@@H]1CCCCO1)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836717251	PQGVWCJRTTZOAY-IEBWSBKVSA-N	449.013	1.845	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(Cl)nn1)CCO2	1837838171	XCQWLHCJDMVFGE-GOSISDBHSA-N	442.976	1.052	50	20	IDGD	
O=C(c1cc(-c2ccccc2)no1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1837996601	KTWQJGLRMQJHOG-FXAWDEMLSA-N	437.855	1.946	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCCn3cccc3)C2)C1	1839154948	DFDQALMGNNAUIF-VQTJNVASSA-N	446.375	1.961	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)n3cccn3)C2)C1	1839967502	OGIBYOLOSRKPCR-RLFYNMQTSA-N	443.342	1.074	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3(C#N)CCC3)C2)C1	1839967641	STJPNQXMKZXZFX-KDOFPFPSSA-N	428.327	1.310	50	20	IDGD	
Cc1ccc(F)cc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)Br)CCO2	1840030660	RSZGTWPMYHSBMF-LIRRHRJNSA-N	443.313	1.988	50	20	IDGD	
CCN(CC)C[C@H](C)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2	1840034977	CAIXFLHHQRHTSC-FRQCXROJSA-N	448.402	1.204	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H]3C[C@H]4CC[C@@H]3O4)CCO2)C1	1840050335	FYJGGQQQYKYTDK-YXBKOPBNSA-N	435.348	1.247	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(C)cc3F)C2)C1	1840155276	VVQCBJHUIWWXPW-OXJNMPFZSA-N	428.888	1.458	50	20	IDGD	
COc1ncc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)cc1F	1840186704	SRPJQTFKDNIJLZ-KRWDZBQOSA-N	436.267	1.103	50	20	IDGD	
CN(C)c1cncc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)c1	1840186863	WQRAMUOMJWSSDB-GOSISDBHSA-N	431.320	1.021	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CCCn3cccc3)CCO2)C1	1840463262	YXJQWJUOIUYADC-QFBILLFUSA-N	442.354	1.508	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC2(CCCN2C(=O)CN(C)C(=O)c2ccccc2)C1	1841521619	PSQYRBQERFNUFN-HNNXBMFYSA-N	436.350	1.993	50	20	IDGD	
Cc1ccn2c(=O)c(C(=O)N3CCCC34CN(C(=O)[C@H](F)Br)C4)cnc2c1	1843787854	VTOOINABBSLMOJ-AWEZNQCLSA-N	437.269	1.510	50	20	IDGD	
COc1cc(C(=O)NNC(=O)COc2ccc(F)cc2)cc(Cl)c1OCC(N)=O	14367712	JZLVEIGNJNFQFG-UHFFFAOYSA-N	425.800	1.192	50	20	IDGD	
COC(=O)c1cc(C(=O)OC)cc(S(=O)(=O)NNC(=O)c2cn(C)c3ccccc23)c1	17320128	IUFWEVQTQIAQEC-UHFFFAOYSA-N	445.453	1.375	50	20	IDGD	
O=C(COc1cccc(Cl)c1)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	17458423	RPTZQYLZQRVHGM-UHFFFAOYSA-N	437.905	1.965	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=S)NCCSc2ccccc2)ccc1Cl	18141625	CIEDZWUVNJNRBP-UHFFFAOYSA-N	444.991	1.889	50	20	IDGD	
C[C@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)NNC(=O)Cc2c[nH]c3ccccc23)C1=O	23750752	AETPPKYDBDQIDT-JOCHJYFZSA-N	437.431	1.464	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)CN1C(=O)N[C@]2(CCCC[C@@H]2C)C1=O	25413502	SWCFVKMZZSYFHM-QKKBWIMNSA-N	432.477	1.112	50	20	IDGD	
COc1ccc([C@]2(C)NC(=O)N(CC(=O)NNC(=O)CNc3ccc(C)cc3)C2=O)cc1	105009510	UODWGTYQFRHPKR-QFIPXVFZSA-N	439.472	1.030	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)[C@@H]1CC(=O)N(Cc2ccc(OC)cc2)C1	726619750	COWKMVLQQIBEME-GOSISDBHSA-N	425.485	1.833	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)NCc2cccc(C(=O)NCCN(C)C)c2)c1	727479134	ABEKDAQUVFBQRH-UHFFFAOYSA-N	443.504	1.139	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3ccc(C(=O)N(C)C)cc3)cc2)CC1	728215327	ZDPOUFDEWBNBDS-UHFFFAOYSA-N	445.545	1.081	50	20	IDGD	
C[C@H](NC(=O)c1n[nH]c2ccccc12)C(=O)OCC(=O)NNC(=O)c1cccc(Cl)c1	728367132	XPOPSOWQGVCKSM-NSHDSACASA-N	443.847	1.339	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)CC1	728889430	IUINCNYMYHKPIS-UHFFFAOYSA-N	432.525	1.488	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCC[C@H](c2nnc3n2CCC3)C1	728915569	RSYPPTLFLXCYLX-ZDUSSCGKSA-N	432.912	1.527	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNS(=O)(=O)c1cc(C)cc(S(C)(=O)=O)c1C	730203289	MKMJYAGLCJPUDV-UHFFFAOYSA-N	446.934	1.992	50	20	IDGD	
N#C/C(=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)N1CCS(=O)CC1	731008208	MWCPBOAWYPSSHC-PTNGSMBKSA-N	445.932	1.577	50	20	IDGD	
CCCC[C@H](/N=C1/NS(=O)(=O)c2ccccc21)C(=O)NNC(=O)Cc1ccccc1F	731344386	IPVZTNFVJLLSFB-KRWDZBQOSA-N	446.504	1.813	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCCN2CCOCC2(C)C)cc1Br	732461343	DIARKQBVHHFOFP-UHFFFAOYSA-N	429.315	1.513	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NC[C@H]1OCCc2ccccc21	733335855	FMFIQSXECZDWLX-MRXNPFEDSA-N	431.518	1.546	50	20	IDGD	
CCN(CC)[C@H](C(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1)c1cccc(C(F)(F)F)c1	733915912	ZNVIGOVJYWVHDG-ZFWWWQNUSA-N	435.468	1.670	50	20	IDGD	
CN1C(=O)C[C@@H](C(=O)OCC(=O)NNC(=O)c2ccccc2)[C@H]1c1cccc(Cl)c1	734637504	RYYFNLITGMNAAG-VQIMIIECSA-N	429.860	1.864	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)COc2cccc([N+](=O)[O-])c2)CC1	734821476	KVIWOCVZRWAFHP-UHFFFAOYSA-N	437.453	1.704	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)Cc2ccc(S(=O)(=O)C(F)F)cc2)cn1	740943708	RTYAORULGIYLQF-UHFFFAOYSA-N	430.458	1.647	50	20	IDGD	
COc1ccc(Br)cc1C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	741558434	FIVIARPZTMRTPX-UHFFFAOYSA-N	434.294	1.925	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)CN2C(=O)[C@@H]3[C@H]4CC[C@@H](O4)[C@@H]3C2=O)c(C)n1-c1ccccc1	742469421	AGFARBGTKDVRFD-LFGUQSLTSA-N	436.468	1.018	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)Cc2csc(NC(=O)C(C)(C)C)n2)C[C@@H](C)O1	743290120	BICFDZNZPDHVPE-CHWSQXEVSA-N	425.555	1.317	50	20	IDGD	
C[C@H]1CN(c2ccc(CNC(=O)NNC(=O)Nc3ccc(N(C)C)cc3)cn2)CCO1	743550699	OEHNBWJVCCXCFD-HNNXBMFYSA-N	427.509	1.909	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)c(S(=O)(=O)NC[C@@H]2CCCO2)c1)NC1CCCC1	744052924	YQNLMZGLCIODLE-AWEZNQCLSA-N	444.941	1.684	50	20	IDGD	
CCCS(=O)(=O)Nc1cccc(C(=O)OCC(=O)NNC(=O)c2cccc(C)c2)c1	744546028	HWUDFZHCKRZCJV-UHFFFAOYSA-N	433.486	1.765	50	20	IDGD	
Cn1cc(-c2cccc(C(=O)OCC(=O)NNC(=O)[C@@H]3COc4ccccc4O3)c2)cn1	745222959	QMGQWENAALOIIX-IBGZPJMESA-N	436.424	1.231	50	20	IDGD	
C[C@H](O)CC(C)(C)CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	745848974	YZXRGKCRQOCRMC-AWEZNQCLSA-N	426.539	1.212	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@H]2C[C@H](C)N(c3ccccc3)C2=O)c2ccccc2c1=O	745880807	BLQOHXOCUGHDAE-KSSFIOAISA-N	448.483	1.554	50	20	IDGD	
Cc1ccc(OCCCC(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1C	747041264	XZRMKPRIZUCOPR-FQEVSTJZSA-N	442.468	1.993	50	20	IDGD	
Cc1nn(C)c(C)c1-c1cc(C(=O)NNC(=O)c2cc(Br)ccc2O)n[nH]1	747517395	VPDQNCKFQXNESF-UHFFFAOYSA-N	433.266	1.970	50	20	IDGD	
COc1ccc(C)cc1[C@@]1(C)NC(=O)N(CC(=O)NNc2cccc([N+](=O)[O-])c2)C1=O	748008687	RWFYELZIMWMLQV-HXUWFJFHSA-N	427.417	1.822	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(N2CCOCC2)c(C(=O)NNc2ccc(C#N)cc2)c1	748125991	GSPGGHHTCSNBKF-UHFFFAOYSA-N	429.502	1.402	50	20	IDGD	
CS(=O)(=O)Nc1ccc(F)cc1C(=O)NNc1ccc(S(=O)(=O)C(F)F)cc1	748611584	OUQHYPSJPSAFKF-UHFFFAOYSA-N	437.421	1.950	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)CCOc2ccc(C(N)=O)cc2)c2ccccc2c1=O	748689668	RKHMZQUVLLYHAL-UHFFFAOYSA-N	437.456	1.136	50	20	IDGD	
CC[C@@H](Nc1c([N+](=O)[O-])c(C)nn1C)C(=O)NNc1ccc(S(=O)(=O)C(F)F)cc1	749531912	WZSPIGIXDPYPSX-GFCCVEGCSA-N	446.436	1.967	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NC[C@@H]1CCCO[C@H]1C(C)C	752001277	ZDFICYCUDOQANW-GJZGRUSLSA-N	425.555	1.683	50	20	IDGD	
COc1cc(OC)cc(N2C[C@@H](C(=O)NNC(=O)Cc3ccccc3OC)CC2=O)c1	752294462	OFLGJWJDYIOSBD-HNNXBMFYSA-N	427.457	1.455	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1nn(-c2ccc(F)cc2)cc1O	752796435	GMVSLHAKGXOFEH-UHFFFAOYSA-N	425.424	1.185	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2ccc(OC(C)C)c(OC)c2)c(C)o1	754743155	AFXFCZJKPGPZNZ-UHFFFAOYSA-N	426.447	1.794	50	20	IDGD	
CSc1cc(Br)ccc1/C=C(/C#N)C(=O)c1c(N)n(C)c(=O)n(C)c1=O	755032690	SWWDJACNKFDNIR-POHAHGRESA-N	435.303	1.940	50	20	IDGD	
CCN(CC)C(=O)CCC(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	755102759	JXFWNXUWDTZQFF-UHFFFAOYSA-N	449.515	1.798	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)Nc1cccc(S(=O)(=O)NC2=NCCCCC2)c1	755495494	LYZYVSZGMCIXRR-UHFFFAOYSA-N	444.517	1.728	50	20	IDGD	
CCCCNS(=O)(=O)c1cccc(NC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1	755533603	CKGYTOKMMKEQOQ-SFHVURJKSA-N	448.501	1.758	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)Nc1ccc(NC(=O)CN2CCOCC2)cc1	755599781	PVFCWOPYWJRNOW-UHFFFAOYSA-N	427.461	1.432	50	20	IDGD	
C[C@H](NS(=O)(=O)c1cnn(C)c1)C(=O)NNc1ccc(Br)cc1Cl	755776698	KRCWAXKJIOKAPU-QMMMGPOBSA-N	436.719	1.646	50	20	IDGD	
COC(=O)CN1CCN(c2ccc(NC(=O)NNC(=O)Cc3ccc(F)cc3)cc2)CC1	756392166	HVWYWHFSBVZYMN-UHFFFAOYSA-N	443.479	1.516	50	20	IDGD	
O=C(COC(=O)CCc1cccc([N+](=O)[O-])c1)NNC(=O)[C@@H]1COc2ccccc2O1	756525149	HXNVBGPWHZMDDO-KRWDZBQOSA-N	429.385	1.058	50	20	IDGD	
CC(C)(C)c1ccc(OCC(=O)NNC(=O)Nc2ccn(CCN3CCOCC3)n2)cc1	756645441	FVEHFGYMNHSTQU-UHFFFAOYSA-N	444.536	1.745	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)Nc2ccc(S(=O)(=O)NCC3CC3)cc2)c1	756784653	PUNZBPVFFLADOT-UHFFFAOYSA-N	432.502	1.915	50	20	IDGD	
CC(C)(C)OC(=O)NCC(C)(C)C(=O)NNC(=O)c1csc(N2CCOCC2)n1	756899685	MMDMUNRVRCJHCT-UHFFFAOYSA-N	427.527	1.292	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)CN2C(=O)NC3(C[C@H](C)C[C@@H](C)C3)C2=O)cn1	757649081	UQPVNDGQEVVLMZ-VXGBXAGGSA-N	434.522	1.155	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)Nc1ccc2nc(N3CCOCC3)oc2c1	757777026	LKBGBVOYEYCPMI-SFHVURJKSA-N	439.428	1.657	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)Nc2ccc(C(=O)N3CCOCC3)cc2C)c1	757831015	OXUTWFLAJAVJMO-UHFFFAOYSA-N	442.472	1.951	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)[C@@H](Sc1ccccc1F)c1ccccc1	758028174	ZHNKCKLBJJCFNP-LRDDRELGSA-N	425.507	1.744	50	20	IDGD	
COC(=O)c1cc(F)ccc1S(=O)(=O)NNC(=O)c1cc(OC)c(OC)c(OC)c1	759091903	PELDXUYYAHIADS-UHFFFAOYSA-N	442.421	1.261	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNS(=O)(=O)c1cc([N+](=O)[O-])cc(C)c1F	760336095	XBVAOZDXFRUWDN-UHFFFAOYSA-N	427.410	1.830	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NCCOc2ccc(C(F)(F)F)cn2)cc1	761778063	DVWOLPACGOVGMO-UHFFFAOYSA-N	428.367	1.897	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2cc3ccccc3cc2O)cc(OC)c1OC	763527218	MVLFSKWZJCHMLS-UHFFFAOYSA-N	439.424	1.971	50	20	IDGD	
O=C(NNC(=O)c1c[nH]c2ccccc12)C(=O)Nc1ccc(NC(=O)[C@H]2CCCO2)cc1	763534493	GWWOBCFKSYKMLU-GOSISDBHSA-N	435.440	1.685	50	20	IDGD	
COCCOc1c(Cl)cccc1NC(=O)C(=O)NNC(=O)[C@@H]1COc2ccccc2O1	763570582	GJJWYQADOXJPPD-INIZCTEOSA-N	449.847	1.291	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)Nc1nc(-c2cccs2)cs1	763573050	WXRIQOUWYSZQSN-ZDUSSCGKSA-N	430.467	1.798	50	20	IDGD	
Cc1ccc(Br)cc1NC(=O)C(=O)NNC(=O)[C@H]1COc2ccccc2O1	763578761	PXPFIXFXNJPFBA-OAHLLOKOSA-N	434.246	1.683	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2csc(-c3ccccn3)n2)cc1	763661589	OWEHGCLMXMHPFS-UHFFFAOYSA-N	427.442	1.379	50	20	IDGD	
CCOC(=O)c1cc(F)c(F)cc1NC(=O)C(=O)NNC(=O)COc1ccccc1F	763682012	UMEYNBAIOZJSAW-UHFFFAOYSA-N	439.346	1.446	50	20	IDGD	
CCOc1ccccc1-n1nnnc1SCC(=O)NNC(=O)Cc1ccccc1C	763689510	WDMXUWNCGQDYIB-UHFFFAOYSA-N	426.502	1.852	50	20	IDGD	
COC(=O)[C@@H](C)Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)cc1	763858488	SYJCOKNRASVAGZ-KBPBESRZSA-N	445.447	1.731	50	20	IDGD	
COCCOc1ccc(C#N)cc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccccc1F	763858801	XLCMZMZOBPFBDP-ZDUSSCGKSA-N	444.419	1.276	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cnc3c(c2)c(C)nn3C)cc1	763859851	GKPDRXOMQGKHGR-CYBMUJFWSA-N	440.460	1.229	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)C(=O)Nc1cc2c(cc1[N+](=O)[O-])OCCCO2	763919793	VNQTZCJDYPRTOZ-UHFFFAOYSA-N	432.364	1.224	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(NC(C)=O)cc2)ccc1OC(C)C	763921257	KOWBRWJTCKEMIZ-UHFFFAOYSA-N	428.445	1.841	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3ccccc3CS(C)(=O)=O)cc2C1	763943037	PQOWRIRYMFYSIB-GFCCVEGCSA-N	449.554	1.817	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)C(=O)Nc1ccc(NC(=O)C2CC2)cc1	763949596	PZISJBOTAJTZST-UHFFFAOYSA-N	448.439	1.326	50	20	IDGD	
O=C(NNC(=O)c1ccc(COc2ccccc2)o1)C(=O)Nc1ccc2c(c1)C(=O)NCC2	763955278	LGGLQNYCUWDPAA-UHFFFAOYSA-N	448.435	1.544	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)C(=O)Nc1cccnc1OCC(F)F	763994396	CSUKQBXCBIBMKK-UHFFFAOYSA-N	432.181	1.216	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)Cc2cccc3ccccc23)cc1S(C)(=O)=O	764036277	MFAZVZBVQOKQDU-UHFFFAOYSA-N	439.493	1.880	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2cccc(Br)c2)cccc1-n1cnnn1	764058146	BMYOOCDGZANUPR-UHFFFAOYSA-N	444.249	1.133	50	20	IDGD	
CNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2cccc(Br)c2)c1C	764059006	MIFAPMVIHOHLQL-UHFFFAOYSA-N	433.262	1.517	50	20	IDGD	
CC[C@@H](C)C(=O)NNC(=O)C(=O)Nc1ccnn1Cc1c(OC)cc(OC)cc1OC	764083854	KNPSFINLEKHZEE-GFCCVEGCSA-N	433.465	1.089	50	20	IDGD	
Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)C(=O)NNC(=O)c1ccoc1	764159117	SBQWCXMDMADXIU-GOSISDBHSA-N	436.472	1.631	50	20	IDGD	
O=C(CCc1ccco1)NNC(=O)C(=O)Nc1cccn(Cc2ccc(F)cc2)c1=O	764168593	FDIAFZVXYIGFNI-UHFFFAOYSA-N	426.404	1.347	50	20	IDGD	
CC(C)(C)CC(=O)NNC(=O)C(=O)Nc1ncn(Cc2cccc(Br)c2)n1	764197560	DVKACOQHQYTITB-UHFFFAOYSA-N	437.298	1.611	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)C(=O)Nc1cnn(-c2ccccc2)c1	764203796	FHYFOKWLVSDIBW-UHFFFAOYSA-N	430.465	1.263	50	20	IDGD	
O=C(CCCc1ccccc1)NNC(=O)C(=O)Nc1ccc2c(c1)C(=O)N(CC1CC1)C2=O	764224519	QRMWJPVSTJXMHN-UHFFFAOYSA-N	448.479	1.801	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2c(Cl)cccc2Cl)cc1-n1cnnn1	764226103	FSAQMGBAKRQJIK-UHFFFAOYSA-N	434.243	1.677	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2O)ccc1Cl	764278142	SPZZXVXFQBRZSU-UHFFFAOYSA-N	435.820	1.387	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)C(=O)Nc2cccc(C(=O)Nc3ccc(Cl)cn3)c2)cn1	764357836	CICSGNQDJWKGCH-UHFFFAOYSA-N	441.835	1.121	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(Oc2ncccc2C#N)cc1C	764399677	LFNVULRWDIXSQX-AWEZNQCLSA-N	441.444	1.191	50	20	IDGD	
Cc1cn(-c2ccc(C#N)cn2)nc1NC(=O)C(=O)NNC(=O)c1ccc(Cl)cc1F	764421300	LGKKXTUQVQATEZ-UHFFFAOYSA-N	441.810	1.640	50	20	IDGD	
COc1nccnc1NNC(=O)c1cccc(S(=O)(=O)Nc2ccc3c(c2)OCO3)c1	764482447	WVPDLHFGFBMJLN-UHFFFAOYSA-N	443.441	1.772	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C[C@@H]1CN(C(=O)OC(C)(C)C)CCO1	764554780	WYLLRAQPEQBSGK-ZIAGYGMSSA-N	425.457	1.766	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNS(=O)(=O)c1ccc(Cl)cc1	765117183	BZFUVTIKLAEAAS-UHFFFAOYSA-N	436.921	1.108	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2cccs2)[nH]n1)c1cccc(S(=O)(=O)NCC2CC2)c1	765569096	FNWJSBCTZOGLKK-UHFFFAOYSA-N	445.526	1.901	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)[C@H]1C[C@@]12CCc1ccccc12	765738669	MJPFHMOSMWMUML-PXDATVDWSA-N	432.524	1.496	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)CCNC(=O)c3ccsc3)CC2)cc1	765748360	MOTIBRKPHWXYQM-UHFFFAOYSA-N	443.573	1.142	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)[C@@H]1CCCN1C(=O)Cc1ccccc1	767308126	OXIZYNDVDPGVGH-FQEVSTJZSA-N	437.496	1.462	50	20	IDGD	
O=C(NNC(=O)c1cc(Cl)cc(Br)c1F)N[C@H]1CCS(=O)(=O)C1	767681790	AZXHDRGBWOUXBS-ZETCQYMHSA-N	428.667	1.373	50	20	IDGD	
COCCn1c(SCC(=O)NNC(=O)Cc2ccccc2C)nnc1-c1ccncc1	767961593	JWQXEYBPKDSTKD-UHFFFAOYSA-N	440.529	1.777	50	20	IDGD	
CC(C)[C@H](NC(=O)OC(C)(C)C)C(=O)NCC(=O)NNC(=O)Cc1c[nH]c2ccccc12	768280797	WYJJIIJYFKDYPR-IBGZPJMESA-N	445.520	1.523	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)[C@H]1CCCN(C(=O)NC2CCCC2)C1	768629298	HTMWXGYMSDUHPL-AWEZNQCLSA-N	438.550	1.906	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)CCC(=O)N1CCc2sccc2C1	768639787	WKDAHVDNPRPTIL-UHFFFAOYSA-N	437.543	1.968	50	20	IDGD	
N#Cc1cc(Cl)nc(NNC(=O)CNS(=O)(=O)c2ccc(OC(F)(F)F)cc2)c1	769064346	XVQXCNKYIYUIBV-UHFFFAOYSA-N	449.798	1.927	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)N[C@@H]2CCO[C@@]3(CCSC3)C2)nc1	769239746	MOPVXHBZNZVDAB-DYVFJYSZSA-N	429.568	1.449	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CC(=O)N(c2c(F)cccc2F)C1)C1CCN(c2ncccn2)CC1	770719033	KCVYUMMXZPHDNT-CQSZACIVSA-N	444.442	1.172	50	20	IDGD	
COc1ccc([C@@]2(C)NC(=O)N(CC(=O)NNc3ccnc(Br)c3)C2=O)cc1	771533495	SDSGBXAJWYSKBH-GOSISDBHSA-N	448.277	1.763	50	20	IDGD	
CSc1nc(C)c(CCC(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)c(C)n1	772188802	YHVTYIIRTBDNCL-UHFFFAOYSA-N	435.937	1.865	50	20	IDGD	
O=C(Cn1nc(-c2ccccc2)ccc1=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772193229	RIOSQHMPGNOPSX-UHFFFAOYSA-N	439.859	1.028	50	20	IDGD	
Cn1nc(-c2cc(F)cc(F)c2)cc1NC(=O)C(=O)NNC(=O)COc1ccccc1O	773544688	BOBUGMAMZPKSDG-UHFFFAOYSA-N	445.382	1.236	50	20	IDGD	
CCOc1ccccc1C(=O)NCC(=O)NNC(=O)[C@H]1CCCN(C(=O)OC(C)(C)C)C1	774270550	KBMOOAWKCFDVHI-HNNXBMFYSA-N	448.520	1.610	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)c2cc(C)nc3ccccc23)cc1CC(=O)O	774610533	FVLHKMQWFKFVCH-UHFFFAOYSA-N	429.454	1.802	50	20	IDGD	
O=C(NNc1cnc2ccccc2n1)c1ccc(S(=O)(=O)NC[C@H]2CCCO2)cc1	774784533	UPPSQHFAMKWCIE-OAHLLOKOSA-N	427.486	1.844	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2N2CCOCC2)c(C)c1	776106848	HGNCPEAVPQEWQD-UHFFFAOYSA-N	427.461	1.921	50	20	IDGD	
CCOCCONC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	776200719	YYGXEYFSLIPKQU-UHFFFAOYSA-N	428.492	1.461	50	20	IDGD	
C[C@@H](Oc1ccc(C#N)cc1)C(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776206601	WACZGWQRPMWUOM-OAHLLOKOSA-N	431.493	1.961	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cc(C)n([C@H](C)C3CC3)n2)cc1	777273704	DCDHYGUXXUBXPC-OAHLLOKOSA-N	433.534	1.553	50	20	IDGD	
COc1ccc(Cn2cc(C(=O)NNC(=O)c3ccc4c(c3)OCCO4)cn2)cc1OC	777453163	MIKATMBCTJAMKB-UHFFFAOYSA-N	438.440	1.795	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N2CCN(CC(C)C)C(=O)C2)cc1Br	777517351	HGZSKNLLMMEHFV-UHFFFAOYSA-N	427.299	1.612	50	20	IDGD	
Cc1cc(NNC(=O)c2cc(I)ccc2N2CCOCC2)ncn1	779377740	SOVBTVGUGWZFSL-UHFFFAOYSA-N	439.257	1.983	50	20	IDGD	
COCC[C@@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)c1ccc(C)o1	779397118	VLXLOLSPADSYSE-MRXNPFEDSA-N	438.506	1.560	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@@H](C(=O)NNc2nc(-c3ccccc3)no2)[C@@H](C)O)cc1	779514057	JTFAPZIVNDTIEE-CZUORRHYSA-N	431.474	1.216	50	20	IDGD	
COC(=O)C1(CNC(=O)NNC(=O)c2ccc(OC)c(Br)c2)CCOCC1	781803959	WLRSJOZNCVBMTL-UHFFFAOYSA-N	444.282	1.372	50	20	IDGD	
O=C(NNc1ccc(-n2cccn2)nn1)C(=O)Nc1c2c(nn1-c1ccccc1)CCC2	783433230	POVGBDQDOQZODC-UHFFFAOYSA-N	429.444	1.419	50	20	IDGD	
CCNC(=O)N(C)NC(=O)C(=O)Nc1ccc(CC(=O)N(CC)c2ccccc2)cc1	784917037	GLQRUJLFNJGFKZ-UHFFFAOYSA-N	425.489	1.913	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3n2)cc1N1CCNC1=O	787542703	ASPYISWMYFMNSZ-UHFFFAOYSA-N	432.440	1.473	50	20	IDGD	
CCCn1nc(C(=O)NN=C2CCCc3nc(O)c(C(N)=O)cc32)c2ccccc2c1=O	788967096	OTSOJXQQVXWKRZ-UHFFFAOYSA-N	434.456	1.476	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	790064114	TWOZIGHENFDYLY-UHFFFAOYSA-N	449.529	1.715	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)c2ccccc21)c1cc(-c2ccc(F)cc2)[nH]n1	791054072	MUPKNSBFBZXKHJ-OAHLLOKOSA-N	428.445	1.938	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2F)nc1Br	793023815	WMMWYDPZGBYNAY-UHFFFAOYSA-N	425.214	1.457	50	20	IDGD	
CC(C)Oc1ccc(NC(=O)C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)nn1	793050296	MKRBYFXCSVUKNM-UHFFFAOYSA-N	434.403	1.516	50	20	IDGD	
C[C@@](O)(CN1C(=O)NC2(CCCC2)C1=O)C(=O)NNc1ccccc1OC(F)(F)F	793877342	WFJRBUJEWNIXIY-MRXNPFEDSA-N	430.383	1.644	50	20	IDGD	
Cc1nc(COc2ccccc2C(=O)NNC(=O)CNC(=O)OCc2ccccc2)no1	794064768	HXWPPUDJRSHFFK-UHFFFAOYSA-N	439.428	1.644	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CN2CCNC(=O)[C@H]2c2ccc(Br)cc2)cc1	796577008	WEDPGEZWQKEQQU-GOSISDBHSA-N	445.317	1.692	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCc1c(F)cc(F)c(F)c1F	797520849	NTFAYUUCHBHGAE-UHFFFAOYSA-N	447.414	1.989	50	20	IDGD	
COC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)c1C	798041885	HBQGALOJWIMWOC-UHFFFAOYSA-N	425.401	1.210	50	20	IDGD	
CCOc1ccc(NC(=S)NNC(=O)Cc2ccc(S(=O)(=O)N(C)C)cc2)cc1	798124084	GXRSIMUAGFXHDV-UHFFFAOYSA-N	436.559	1.896	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(CS(=O)(=O)C(F)F)cc2)cc1C	798309022	FPPWQGDJEOJUBO-UHFFFAOYSA-N	439.440	1.841	50	20	IDGD	
CN(CCO)S(=O)(=O)c1ccc(C(=O)NNc2ccc(Cl)cc2[N+](=O)[O-])cc1	798318654	HALVCAUTBCYCCT-UHFFFAOYSA-N	428.854	1.618	50	20	IDGD	
O=C(C[C@@H]1Sc2ccc(Cl)cc2NC1=O)NNC(=O)c1ccc(-n2cnnn2)cc1	799718151	QDUMIYDZKRXGMJ-HNNXBMFYSA-N	443.876	1.580	50	20	IDGD	
CN(C)CCN1C[C@@H](C(=O)NNC(=O)Nc2ccc(Br)cc2Cl)CC1=O	802041209	XUSGHRMKRSKUNN-JTQLQIEISA-N	446.733	1.665	50	20	IDGD	
Cc1nnnn1[C@H](Cc1cccc(F)c1)C(=O)NNC(=O)Nc1ccc(N(C)C)cc1	802120145	YZIXMZDNRAJSLW-GOSISDBHSA-N	426.456	1.823	50	20	IDGD	
O=C1COC[C@H](C[C@@H]2CN(C(=O)C(=O)NNc3ccc(Cl)c(F)c3)c3ccccc32)N1	807022986	XFQPPFVUXZFPLW-OCCSQVGLSA-N	446.866	1.958	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3cccc4c3OCC(=O)N4)cc2C1	810385195	XOWVGWGIWXCFOT-JTQLQIEISA-N	428.470	1.604	50	20	IDGD	
O=C(NCCc1nc2ccccc2s1)NNC(=O)c1csc(N2CCOCC2)n1	813525076	LSMSXLOMQZSFDH-UHFFFAOYSA-N	432.531	1.776	50	20	IDGD	
CCNC(=O)[C@@H](NC(=O)NNC(=O)[C@@H](C)Oc1cccc(Br)c1)C(C)C	814359603	KSPALRFISHRTDJ-RISCZKNCSA-N	429.315	1.708	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN[C@H](c2ccccc2)C2(CO)CCC2)cc1OC	814668540	VWMXURVUXRZCLG-OAQYLSRUSA-N	427.501	1.958	50	20	IDGD	
CS(=O)(=O)c1cccc(Cl)c1C=NNC(=O)Nc1ccc(S(N)(=O)=O)cc1	814968018	KYCWZQVZFCXMKF-UHFFFAOYSA-N	430.895	1.547	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2cc(Br)cn2C)cc2cccnc12	815567508	BLEUGAYOLOBKPH-UHFFFAOYSA-N	446.261	1.744	50	20	IDGD	
CCN1CCC(N2CCC(C(=O)NNc3ccc(S(=O)(=O)NC4CC4)cc3)CC2)CC1	816916084	UYELKXFYECCBFN-UHFFFAOYSA-N	449.621	1.767	50	20	IDGD	
COc1cccc(/C=C(\C(=O)NNC(=O)COc2cc(C)ccc2C)n2nnnc2C)c1	818023670	NWJTZMMTIMGVDN-XDHOZWIPSA-N	436.472	1.831	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)CCc2nc(O)c3c4c(sc3n2)CCC4)C[C@H](C)O1	822201311	AFXTUFZCQKSFCI-STQMWFEESA-N	447.561	1.465	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)CCc1ccco1	863950103	UNAJUFIXABJLIG-UHFFFAOYSA-N	435.502	1.013	50	20	IDGD	
N#CCCn1cc(/C=C(\C#N)C(=O)NCCC(=O)N2CCOCC2)c(-c2ccccc2)n1	914472238	VXUTUIMCKGMZBS-XDJHFCHBSA-N	432.484	1.736	50	20	IDGD	
Cc1noc(CCC(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)n1	914857564	FWTIKLZAXOEDJV-UHFFFAOYSA-N	435.487	1.634	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)[C@H]1CCCN(C(=O)Cc2ccccc2)C1	914880806	YIGLBOZSVJDXCB-SFHVURJKSA-N	425.485	1.703	50	20	IDGD	
CC(C)Cn1nc(C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c2ccccc2c1=O	915076982	AQYQIULJIOREKD-UHFFFAOYSA-N	442.497	1.531	50	20	IDGD	
COc1c(C)cc(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1C	915185747	OSMZBXZXBBAHTE-UHFFFAOYSA-N	441.531	1.186	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NC[C@@H](c2cccc(F)c2)N(C)C)c2ccccc2c1=O	915900724	CSXASJIBYNOZOA-SFHVURJKSA-N	440.479	1.802	50	20	IDGD	
CN(C)[C@H](CNC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)c1ccccc1Cl	915904300	GKEDQFLVLLKBOQ-QGZVFWFLSA-N	438.937	1.990	50	20	IDGD	
COc1ccc(C[C@H](NC(=O)NNC(=O)C(=O)NC2CC2)c2ccc(OC)cc2)cc1	915923407	PXDQUYBZPGWJCO-IBGZPJMESA-N	426.473	1.597	50	20	IDGD	
Cc1ccc([C@@H](CNC(=O)NNC(=O)c2ccc3c(c2)OCCO3)N2CCOCC2)o1	916228143	JKWWGILXBYLEFD-MRXNPFEDSA-N	430.461	1.377	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NCc2ccc(CN3CCN(C)CC3)cc2)cc1C	916387972	OPSSIKFXIYFVHR-UHFFFAOYSA-N	439.560	1.960	50	20	IDGD	
CN1CCN(CCCNC(=O)NNC(=O)COc2ccc(F)cc2)[C@@H](c2ccccc2)C1	916485144	POBLOMBAMYVZCM-OAQYLSRUSA-N	443.523	1.914	50	20	IDGD	
CC(C)(C)NS(=O)(=O)CCNC(=O)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1	916622221	AUVXOPOJCFBBCZ-UHFFFAOYSA-N	446.473	1.324	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)N[C@H]2CCN3CCCC[C@H]23)c2ccccc2c1=O	916638928	NLJUDMLBALLKOR-ZWKOTPCHSA-N	426.521	1.767	50	20	IDGD	
O=C(COc1ccccc1Cc1ccccc1)NNC(=O)c1cnc2nc(O)nc(O)c2c1	916724414	VNIQJZKZHJWZEK-UHFFFAOYSA-N	445.435	1.867	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)c(O)n1	916745690	GSEDCTAIMVPCHX-UHFFFAOYSA-N	440.481	1.649	50	20	IDGD	
O=C(NCCNC(=O)c1ccc(Br)cc1)NNc1ccc(-n2cccn2)nn1	918141180	NWSAPIYCOORJDY-UHFFFAOYSA-N	445.281	1.481	50	20	IDGD	
CC(C)(C)C(=O)NNC(=O)c1ccc(Br)c(S(=O)(=O)N2CCOCC2)c1	918583822	APRFSSRVYQBUFZ-UHFFFAOYSA-N	448.339	1.277	50	20	IDGD	
Cc1ccc(Cn2ncc3c(C(=O)NNC(=O)[C@@H]4CCS(=O)(=O)C4)cc(C)nc32)cc1	1115817515	JCUAXIMHMALYRJ-MRXNPFEDSA-N	441.513	1.292	50	20	IDGD	
CC[C@]1(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)CCN(C(=O)OC(C)(C)C)C1	1116334953	FJXFQVZIXAIOIK-QFIPXVFZSA-N	446.552	1.878	50	20	IDGD	
Cc1nn(C)cc1CCC(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	1321866701	IXJGDHGPZOUBCF-UHFFFAOYSA-N	444.499	1.824	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)c2cc3c(c(S(N)(=O)=O)c2)CCC3)c1C	1321968682	PQJDDSCZBCMDPT-AWEZNQCLSA-N	431.514	1.668	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)c3cc4[nH]ccc4s3)C2)C1	1778072225	PYANEYJVGZGZSX-FQEVSTJZSA-N	433.534	1.046	50	20	IDGD	
C=C1CC(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)C1	1778091821	SCZTZTFHIOHDKA-LVGVVDSRSA-N	441.532	1.601	50	20	IDGD	
O=C(c1ccc(N2CCCC2)c(F)c1)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1780143712	UAZBOWYCUXYJKL-WIYYLYMNSA-N	439.915	1.469	50	20	IDGD	
CCC(=O)N[C@@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Br)C1	1780770200	HTLALQYLJWSFQD-GMIGKAJZSA-N	436.322	1.106	50	20	IDGD	
N#Cc1cc(CC(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)ccc1F	1781299127	DKAMHHKSDJVCHR-FUHWJXTLSA-N	442.260	1.760	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cccc3nccn23)C1	1781316329	QJERMDOBPCTZBB-QLVMHMETSA-N	434.924	1.716	50	20	IDGD	
O=C(Cc1cnc2ccccn12)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781325654	PFZZMGWVKWSWPA-SJLPKXTDSA-N	439.285	1.397	50	20	IDGD	
Cc1nnc(CCC(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)s1	1781325699	HRUCICHDFSCXSV-HIFRSBDPSA-N	435.319	1.300	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cccc(N4CCOCC4)c3)C2)C1	1781738424	ZTQCSCKNTJUOEL-DENIHFKCSA-N	435.952	1.984	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(=O)c1cccn1C)C2	1782001723	JYOJAOSUUFMMGR-ZXYWRSMDSA-N	440.338	1.505	50	20	IDGD	
CC(C)(C)OC(=O)NC12CC(C(=O)N3CC[C@@]4(CN(C(=O)[C@@H](F)Cl)CCO4)C3)(C1)C2	1783437019	QMOZZNAJWUBZTQ-FKPJGTDNSA-N	445.919	1.798	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cn4cc(Cl)ccc4n3)CCO2)C1	1783876443	XVJWFPZMGCXVIN-LIRRHRJNSA-N	441.315	1.685	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cc(F)ccc1Cl)CCO2	1783934365	FGZNDFQOLHZFKN-FQEVSTJZSA-N	440.903	1.296	50	20	IDGD	
O=C(CCN1Cc2ccccc2C1=O)N1CCO[C@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783948222	XWZPEPDQDZLIED-HXUWFJFHSA-N	440.327	1.666	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CC3CCOCC3)C[C@@H]21	1783967701	JOKLCQYUTWHOLN-IWCQGFGOSA-N	431.371	1.814	50	20	IDGD	
C=CCCc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]3C2)c(O)n1	1784086055	CVORNODCEDMUPS-MGHWNKPDSA-N	437.924	1.099	50	20	IDGD	
COc1cccc2[nH]cc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]4C3)c12	1784091907	CICGUTVVSPTYKF-GKEYINFOSA-N	435.908	1.370	50	20	IDGD	
O=C(CCc1cccc(O)c1)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1784125973	ZFJZMBUGMDCPFR-WMZOPIPTSA-N	429.286	1.845	50	20	IDGD	
CC(C)c1nc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)Br)C[C@@H]32)no1	1785212202	GOMGIGMIASDOLQ-XUXIUFHCSA-N	443.342	1.499	50	20	IDGD	
NC[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCBr)[C@H]2C1)c1ccccc1	1786405902	JBUQDPHWTFHIET-MHORFTMASA-N	438.366	1.494	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)c1[nH]nc2ncccc12	1787344751	QCDJXQXMQFIETO-QVSJOPQTSA-N	440.273	1.242	50	20	IDGD	
O=C1CSc2cc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]4C3)ccc2N1	1787445548	IFCJTGONBYCVQA-MYLCLEHYSA-N	441.912	1.859	50	20	IDGD	
C[Si](C)(C)OCC(=O)Nc1ccc(C2(NC(=O)[C@@H](O)N3CCOCC3)CCC2)cc1	1789647980	XOSVNSPNKGOXAM-HXUWFJFHSA-N	435.597	1.623	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CCc4nc[nH]c4C3)C[C@@H]21)[C@@H](F)Br	1789926937	LRKJZYUSXZJXQJ-NQMOMTLDSA-N	443.317	1.185	50	20	IDGD	
C[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]2C1)n1ccccc1=O	1791056307	SDFFMDCXUBKEQV-YXMSTPNBSA-N	440.338	1.172	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnn(C)c3Cl)C[C@@H]21	1791059143	ORRPKZHXQKGJBB-UKJIMTQDSA-N	433.734	1.450	50	20	IDGD	
CC[S@@](=O)CCC(=O)NC1(c2ccc(NC(=O)CCC(=O)NN(C)C)cc2)CCC1	1791601072	KFWKAZWYQBFOQV-SSEXGKCCSA-N	436.578	1.652	50	20	IDGD	
CC(C)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CC(c3ccccc3)=NN1)C2	1792784673	OJFXLQXGLHSYKC-UKBAYJJMSA-N	432.952	1.607	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1CCC(CO)CC1)C2	1792868834	RDNAUNDFPRNNCE-QUPNRYDCSA-N	431.371	1.406	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1Cc3ccccc3O1)C2	1792870258	AQSCNMTYHPNETM-QMQAMEMWSA-N	437.334	1.611	50	20	IDGD	
Cc1cnn([C@@H](C)C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)CBr)c1	1792873337	UGSLEJKEVQUDRX-DGADGQDISA-N	427.343	1.373	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(F)cc(C(F)(F)F)c1)C2)[C@H](O)CCl	1792979735	DHJOHYBKIRYUAU-BAESOJJISA-N	438.805	1.647	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](O)CCl)C2)C1CC1	1793211253	FFLOTHGPRDRDGB-BQJWPVKWSA-N	443.972	1.918	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)[C@@H]1[C@H]2Sc3ccccc3[C@H]21	1796191452	OASZBUWTRLLVPY-HFABISMESA-N	448.353	1.506	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C=C/C(=O)c1cccs1	1796448547	ZRRNUZFVQMJWGW-QGKAELNQSA-N	441.347	1.860	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@](O)(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](F)Cl)C1	1796810105	PIDOWZJFCKPEPB-UUUMGPIQSA-N	433.908	1.531	50	20	IDGD	
CN1CCc2cc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)CCBr)C4)ccc21	1797017351	UOSMKKUKAOSMLU-HGKCTWBKSA-N	436.350	1.667	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1ccc2ncoc2c1	1797077701	QNYAGNPQGLCEAL-JLUCKKNBSA-N	426.242	1.722	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc2ncoc2c1	1797618171	IQPIOHFLGAJYRZ-QDMKHBRRSA-N	434.456	1.392	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(Cl)nc1Cl)c1ccc(B(O)O)cc1	1798707702	PTXRLODCZVBDSD-QDMKHBRRSA-N	448.115	1.634	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(F)c1[N+](=O)[O-])C2)[C@H](F)Br	1799349236	SFUWYHBPRUEDPP-NVVZYBJKSA-N	448.220	1.628	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)c(O)c(Cl)c1	1799770481	XPSYOSAIZBUSRK-NDPMZMCLSA-N	433.288	1.208	50	20	IDGD	
C[C@H](Oc1ccccc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2	1800625902	KPDIKVZHMJWLMG-IGNRKKQASA-N	429.286	1.734	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)ccc1F)C2	1800643100	LMJAQWWCFRFCFG-YHYOWMERSA-N	429.286	1.908	50	20	IDGD	
COC(=O)[C@H]1CC[C@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)Br)CC1	1800757984	ZFGKEPITHJSZBS-SDSMMKDESA-N	445.354	1.339	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cnc(C)s1	1801337571	KGAIBRWHWOUEHT-LMWOUKEDSA-N	430.368	1.757	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@H](CNC(=O)C(O)O)[C@H]1c1cccnc1	1802927917	OYVYUJMTVFTXRM-VGNCGENASA-N	442.422	1.283	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2nn[nH]c2C(F)(F)F)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803140555	GUOFNTAOWADTIM-GMXVVIOVSA-N	446.817	1.138	50	20	IDGD	
COc1nn(C)cc1C(=O)NC[C@H]1CCN(C(=O)CO[Si](C)(C)C)[C@H]1c1cccnc1	1805303127	JIGOHDMRZMGQBK-APWZRJJASA-N	445.596	1.995	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC2(CCN(C(=O)CN3CCCC3=O)CC2)C1	1805381895	BDRGVNOJQSZXGZ-HNNXBMFYSA-N	428.371	1.871	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)C2(C#N)CC2)[C@H]1c1cccnc1	1806849670	DQDXFQXJGCOXFH-WXBYGLBUSA-N	447.499	1.525	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)Cc2cnccn2)[C@H]1c1cccnc1)[C@@H](F)Br	1808649483	SEPCDANUXATQDC-RRQGHBQHSA-N	436.285	1.811	50	20	IDGD	
O=C(Cc1ccc(F)cc1)N1CCCC2(CCN(C(=O)c3ccc(B(O)O)cc3)CC2)C1	1809259206	YMLBVYDISPBDLD-UHFFFAOYSA-N	438.308	1.593	50	20	IDGD	
O=C(c1c[nH]c2nccc-2c1)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1	1809967122	WYBFIXFLUKGYJT-UHFFFAOYSA-N	446.316	1.353	50	20	IDGD	
CN1CCN(CC(=O)N2CC[C@H](CNC(=O)CO[Si](C)(C)C)[C@H]2c2cccnc2)CC1	1810546144	PFJNRVSJNFPBBV-DENIHFKCSA-N	447.656	1.186	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H](CNC(=O)[C@H]2CNC(=O)C2)[C@H]1c1cccnc1	1812643998	UHUWWHAYXHXHIM-UMHPPVOVSA-N	427.332	1.460	50	20	IDGD	
C[C@H](CBr)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H]2CNC(=O)C2)[nH]n1	1814782843	BGKPTXPVRFXVCI-WZRBSPASSA-N	426.315	1.569	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](O)CCl)n[nH]1	1814875679	GPGSNCLAIHPIBR-KGLIPLIRSA-N	443.932	1.916	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc(O)cn2)n[nH]1	1816640432	HHFRBOLKCFKNNP-MRXNPFEDSA-N	429.481	1.189	50	20	IDGD	
O=C1CCc2ccc(C(=O)Nc3nc4c(s3)C[C@@H](NC(=O)[C@@H](O)CCl)CC4)nc2N1	1816659481	OAGBSRWUGRLWRF-GWCFXTLKSA-N	449.920	1.248	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)CCl)CC2)c1cnc2ccccc2n1	1817952264	AKFDXTTYLGFLAQ-BMIGLBTASA-N	431.905	1.912	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCCC[C@H]1c1cc(NC(=O)CCc2nc(N)n[nH]2)n[nH]1	1819284876	TUCZGVWKDGOTKG-ZDUSSCGKSA-N	434.577	1.586	50	20	IDGD	
CC[C@@H](NC(C)=O)C(=O)N[C@@H]1CCc2nc(NC(=O)CO[Si](C)(C)C)sc2C1	1820158414	LOPHLJXBJBKDEA-CHWSQXEVSA-N	426.615	1.821	50	20	IDGD	
CC(C)n1nccc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCC(=O)NN(C)C)CC2	1820608978	ZJINYUABJGNQIW-CYBMUJFWSA-N	447.565	1.519	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnncc2C(=O)O)[nH]n1	1822373127	VAZLHLRAQLXKCC-GXTWGEPZSA-N	436.856	1.458	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)Cn2cc(C)c(O)nc2=O)n[nH]1	1823368079	HGFUMGUUVMDYLM-TZMCWYRMSA-N	436.900	1.690	50	20	IDGD	
O=C(c1nn[nH]c1C(F)(F)F)N1CCC([C@@H]2CCCCN2C(=O)[C@H](O)CCl)CC1	1824185463	JMWHVHIALGRUKZ-NWDGAFQWSA-N	437.850	1.657	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CNC(=O)c1ccco1)CC2	1825999007	LKAAJCVLWKHKFE-MNOVXSKESA-N	440.909	1.332	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3cccc([N+](=O)[O-])c3)CCO2)C1	1829625998	ZWIDUAMRRRFNIU-PXNSSMCTSA-N	439.896	1.611	50	20	IDGD	
Cc1ccn(C)c1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1	1829826247	YMNFMRFYRWSMFC-NRFANRHFSA-N	437.349	1.560	50	20	IDGD	
Cc1cccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@](C)(Cl)CCl)C3)C2)n1	1830921205	LQOPGJSEWJEBKF-WOJBJXKFSA-N	444.359	1.625	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2[C@H]3C=CS[C@@H]32)CC1	1831153159	OVQOANRCJIYITC-MHTWAQMVSA-N	440.374	1.475	50	20	IDGD	
Cc1cnn([C@@H](C)C(=O)N2CCCC[C@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)c1	1832186565	CENGYLNVEGCAQB-ICSRJNTNSA-N	446.596	1.745	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)C2CCSCC2)CC1	1832943123	CLCOWDFFWUEHIR-NRFANRHFSA-N	444.406	1.743	50	20	IDGD	
CC(C)(CCl)C(=O)NC1CCN(C2CCN(C(=O)c3nc[nH]c3[N+](=O)[O-])CC2)CC1	1833215441	RIEFYBKRZZKCTK-UHFFFAOYSA-N	440.932	1.768	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H]3Cc4ccccc4O3)CC2)CC1)[C@@H](O)CCl	1833309849	BHMNRFSPIUMEDI-AZUAARDMSA-N	435.952	1.161	50	20	IDGD	
COc1ccccc1CC(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)CCl)CC2)CC1	1833312318	PUBPYWOBTDJINK-IBGZPJMESA-N	437.968	1.409	50	20	IDGD	
CCc1ncccc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1833519344	PYVVNQMHPLXGIR-CRAIPNDOSA-N	444.301	1.405	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)CCN(C)C(C)=O)CC2)CC1	1833668696	YUBCSRLODVVLBA-IBGZPJMESA-N	429.005	1.834	50	20	IDGD	
C#CC(=O)N1CCC(N2CCC(NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CC2)CC1	1833727057	XOKNUOZUPOOZCH-KRWDZBQOSA-N	440.972	1.323	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3cccs3)CCO2)C1	1836083648	OCFAZQIJCLHJJD-KBXCAEBGSA-N	445.379	1.778	50	20	IDGD	
O=C([C@H](F)Br)N1CCOC[C@]2(C1)CN(C(=O)C1(F)CCCCC1)CCO2	1836617629	NHPMZMRMNLFWCL-BBRMVZONSA-N	439.297	1.806	50	20	IDGD	
O=C([C@@H](F)Br)N1CCOC[C@@]2(C1)CN(C(=O)C1(C(F)(F)F)CC1)CCO2	1836719674	OVEBSRNEFDASNB-ZWNOBZJWSA-N	447.223	1.476	50	20	IDGD	
CC(=O)NC(C)(C)C(=O)N1CCC(OC2CCN(C(=O)[C@H](C)Br)CC2)CC1	1836879128	VBOKIWOORPUBEW-ZDUSSCGKSA-N	446.386	1.683	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(F)n3)CCO2)C1	1837910069	DZVVUXONRBNJCT-SCLBCKFNSA-N	444.301	1.464	50	20	IDGD	
CN(C)c1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)cn1	1838193805	YFQBIOKGNRTBOH-NRFANRHFSA-N	438.956	1.483	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ncccc1F)CCO2	1838249403	UZYHJURCIVULLG-LJQANCHMSA-N	425.533	1.142	50	20	IDGD	
Cc1ccccc1C(=O)N1CCC(OC2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1	1838578168	BQJNEYLEIWRZQI-UHFFFAOYSA-N	444.576	1.980	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3ccnc(OC)c3)C2)C1	1839142309	LQUXVKKPHXOIIC-UWJYYQICSA-N	439.940	1.497	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccn(C(C)(C)C)n3)C2)C1	1839143142	MMLMVCAWOLNNOV-FOIQADDNSA-N	426.945	1.726	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3nccc(OC)c3OC)C2)C1	1839145684	CJXOQOCBMKTWFJ-VLIAUNLRSA-N	441.912	1.186	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4c(c3)NC(=O)CC4)C2)C1	1839147859	FATGXKQBVNKAMU-VGSWGCGISA-N	449.935	1.659	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3CCC[C@H](C(=O)OC)C3)C2)C1	1839149095	SZHKPUOZWFYVEY-IAGYGMIVSA-N	444.956	1.440	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)c(C)n1C	1839200365	JFZOWGZIMAMEEP-QAPCUYQASA-N	446.317	1.402	50	20	IDGD	
O=C1CCc2ccc(C(=O)N3CCO[C@]4(COCCN(C(=O)[C@@H](F)Cl)C4)C3)cc2N1	1839609170	UHXPNDLUUNSBOG-YLJYHZDGSA-N	439.871	1.176	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3=C(C)OCC3)C2)C1	1839964169	JAFOJDCEYYFZIY-CRAIPNDOSA-N	431.327	1.311	50	20	IDGD	
CCc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](Br)CC)CCO3)n[nH]1	1839964472	SLUYGDOIVXZILM-RDTXWAMCSA-N	443.342	1.216	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3onc4ccccc34)C2)C1	1840154764	FSPGQTFLWOFWKR-MGPUTAFESA-N	437.880	1.152	50	20	IDGD	
COc1nccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)c1F	1840188092	NEYYEQONCKZTJW-QGZVFWFLSA-N	436.267	1.103	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)N2CCCC23CN(C(=O)CCBr)C3)c1	1841171639	DCAXCPVITMMYIM-UHFFFAOYSA-N	429.336	1.692	50	20	IDGD	
CCc1cc(C(=O)N2CC3(CCCN3C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)n[nH]1	1841924492	SIECOABDOJMUSO-HNNXBMFYSA-N	439.944	1.921	50	20	IDGD	
CC(C)N(C)CC(=O)N1CC2(CCCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C1	1841925675	VQFMKUOGYULRKS-HNNXBMFYSA-N	430.977	1.662	50	20	IDGD	
O=C(c1ncccc1-c1ccccc1)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843011222	FSWZZFRVAQGZKI-UHFFFAOYSA-N	441.296	1.559	50	20	IDGD	
COC(=O)CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)[C@@H](F)Cl)C1	1843365453	RBHMIEUHXDBAOB-TZMCWYRMSA-N	449.907	1.571	50	20	IDGD	
COCCOCCOCCC(=O)N1CCCC12CN(C(=O)[C@](C)(Cl)CCl)C2	1846249176	IFPSKHYBMPPGLK-QGZVFWFLSA-N	425.353	1.496	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)c1cccc(C(F)(F)F)c1)C2	1846385567	UQOORSRTSUJBNK-UHFFFAOYSA-N	426.439	1.895	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@]2(O)CCN(C(=O)OC(C)(C)C)C2)C1	1846410350	NYJIVKWKFPQAFL-BTYIYWSLSA-N	443.972	1.969	50	20	IDGD	
CN(CC(=O)N1CC2(CCCN2C(=O)[C@H]2CCCS2)C1)NC(=O)NCc1ccccc1	1846720617	MSBGEMJDSLGFMN-GOSISDBHSA-N	445.589	1.432	50	20	IDGD	
CN(CC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)C1(C)CCC1)NC(=O)NCc1ccccc1	1847229215	OZLHYJISYNGORF-OALUTQOASA-N	427.549	1.725	50	20	IDGD	
O=C([C@@H](O)CCl)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](Br)Cc1ccccc1	1847564331	YKQROJIZUWPFNI-UGUYLWEFSA-N	429.742	1.794	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cncc(S(C)(=O)=O)c1	1848329549	MJWBQMQIZMBPCQ-ILXRZTDVSA-N	444.351	1.474	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNS(=O)(=O)c2ccc3c(c2)CCCN3C(C)=O)c1	15244466	YNXUSDGODHLTNB-UHFFFAOYSA-N	433.486	1.626	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	15884526	VIYCKOWNRMPHRD-UHFFFAOYSA-N	447.513	1.710	50	20	IDGD	
COc1ccc(-n2cnnc2SCC(=O)NNC(=O)c2ccc(OC)c(OC)c2)cc1	24759170	SLAWWHPIMLAOQJ-UHFFFAOYSA-N	443.485	1.846	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2ccc(N3C(=O)CCC3=O)cc2)cc(OC)c1OC	26687595	UWPQPLWPQKTZGP-UHFFFAOYSA-N	427.413	1.441	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Cc2nc3ccccc3n2C)cc1C	30715430	GCLBIXOZZYSFHB-UHFFFAOYSA-N	443.529	1.201	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@@H](C)C(=O)NNC(=O)c1ccc(CS(N)(=O)=O)cc1	728204094	SYVPMKKAHAHBEQ-ZDUSSCGKSA-N	439.921	1.974	50	20	IDGD	
COc1cccc(N2CC[C@@H](NC(=O)NNC(=O)COc3ccccc3[N+](=O)[O-])C2)c1	728221561	ZUAZECDANRKMMG-CQSZACIVSA-N	429.433	1.592	50	20	IDGD	
COc1ccc(C(C)=NNC(=O)[C@@H](C)NS(C)(=O)=O)cc1CSc1ncccn1	728435980	BMAXHYBOAFFXPD-CYBMUJFWSA-N	437.547	1.555	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CC(=O)N(CC(F)(F)F)C1)c1cc(F)ccc1Br	728549447	LXYNEKXVIFVNIH-SSDOTTSWSA-N	426.164	1.760	50	20	IDGD	
O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)NNC(=O)c1nnc(O)c2ccccc12	728754841	RNTMUTBMTVZQOK-KRWDZBQOSA-N	434.500	1.844	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CC[C@@H](CN(C)C(=O)OC(C)(C)C)C2)n1	729477786	NSMFMCNAPSVVTN-AWEZNQCLSA-N	425.555	1.330	50	20	IDGD	
CSC[C@H](C(=O)NNC(=O)c1cccc2ncccc12)N1C(=O)[C@H]2CCCC[C@H]2C1=O	730224934	FZUULKGYOQGGFM-SOLBZPMBSA-N	440.525	1.903	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)Cc1ccc(S(=O)(=O)N2CCCC2)s1	730782113	HNDXRLNWSXKWDS-UHFFFAOYSA-N	439.515	1.007	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NNc2ccccc2S(C)(=O)=O)n(C)c1	732302093	AEEIAYTVYPZZKE-UHFFFAOYSA-N	428.536	1.216	50	20	IDGD	
CC[C@H](C)C(=O)N1Cc2ccccc2C[C@@H]1C(=O)OCC(=O)NNC(=O)c1ccccc1	733532478	ZWCDWLKWZOORMN-OXJNMPFZSA-N	437.496	1.990	50	20	IDGD	
CCS(=O)(=O)C[C@H](C)NC(=O)NNC(=O)[C@H](C)Oc1cccc(Br)c1	733660308	OIWQYEKYUKOASK-QWRGUYRKSA-N	436.328	1.370	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)CC[C@@H]2NC(=O)N(c3ccc(C#N)cc3)C2=O)c1	733755229	VIOJTMXUVOTMRI-SFHVURJKSA-N	434.456	1.290	50	20	IDGD	
NC(=O)[C@H]1CCCN1Cc1cccc(NC(=O)NNC(=O)c2ccc(O)c(Cl)c2)c1	734160461	BJVYUUZPYPJCST-MRXNPFEDSA-N	431.880	1.962	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNS(=O)(=O)c2cccc3cccnc23)cc1	734739973	KGVQYBATWJRUCH-UHFFFAOYSA-N	448.526	1.173	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)[C@H]2C[C@@H]2c2c(F)cccc2F)ccc1Cl	734809242	JHPKBGDEMSINHE-UWVGGRQHSA-N	429.832	1.830	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)c2ccc(S(=O)(=O)Nc3ccc(Cl)cc3)cc2)cn1	735471478	ZQXBWNXFCNHUES-UHFFFAOYSA-N	433.877	1.949	50	20	IDGD	
CN(C)C(=O)CCCC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	735839852	KMAALGGXFNVFLI-UHFFFAOYSA-N	438.531	1.568	50	20	IDGD	
C[C@@H](C#N)C(=O)NNC(=O)CN(Cc1ccccc1)S(=O)(=O)c1ccc(Cl)cc1	736667312	OCUKUAXVQAHJDQ-AWEZNQCLSA-N	434.905	1.838	50	20	IDGD	
CC(C)(CCC(=O)NNC(=O)c1csc(N2CCOCC2)n1)NC(=O)OC(C)(C)C	737765992	JZXVJHSEODOVSN-UHFFFAOYSA-N	441.554	1.824	50	20	IDGD	
O=C(CC[S@@](=O)c1ccc2c(c1)OCCO2)NNC(=O)c1cc(Br)c[nH]1	740749451	ZGLFRVPTPHSXCL-AREMUKBSSA-N	442.291	1.507	50	20	IDGD	
CC(C)CNC(=O)N1CCC[C@H](C(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)C1	741362219	SWKRTBMIFQCMKF-HNNXBMFYSA-N	438.912	1.722	50	20	IDGD	
CCS(=O)(=O)NCc1ccc(C(=O)NNC(=O)c2ccc(OC(C)C)c(OC)c2)cc1	741658792	GHMGGKNPZABEHU-UHFFFAOYSA-N	449.529	1.997	50	20	IDGD	
COCCOCc1cc(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)ccc1F	741923635	YGQGEEFYEGMTAR-UHFFFAOYSA-N	431.468	1.456	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)[C@H]1CCCN(c2ncnc3sccc23)C1	742653651	OKTMRHQHAWMALP-ZDUSSCGKSA-N	427.486	1.840	50	20	IDGD	
Cc1nc(-c2ccccn2)nc(NNC(=O)CCN2C(=O)[C@H]3[C@H]4CC[C@@H](O4)[C@@H]3C2=O)c1C	743414656	XEFIXYVNNGWFNH-LMSBXDPUSA-N	436.472	1.151	50	20	IDGD	
O=C(NN=C1CCN(Cc2ccccc2)C1=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	743427643	SZAJJQKRPWORMZ-UHFFFAOYSA-N	440.525	1.989	50	20	IDGD	
O=C(NCCS(=O)(=O)NCC1CCC1)NNC(=O)c1cccc(Br)c1	743602724	NZNFIPLHQRKMTG-UHFFFAOYSA-N	433.328	1.113	50	20	IDGD	
C[C@@]1(C(=O)OCC(=O)NNC(=O)c2cccs2)CCCN(C(=O)c2ccccc2)C1	745346034	SQISRQJIUOAGMJ-OAQYLSRUSA-N	429.498	1.995	50	20	IDGD	
C#CCN1C(=O)C(=NNC(=O)[C@@H](C)CN2CCOCC2)c2cc(Br)ccc21	747042113	NKTBRTHOKGMHKC-ZDUSSCGKSA-N	433.306	1.218	50	20	IDGD	
COc1ccc(CNC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1C#N	747436056	XBXCBRLZSZSDCR-UHFFFAOYSA-N	445.501	1.026	50	20	IDGD	
Cn1c(=O)n(C)c2nc(NC(=O)CCC(=O)NNc3ccccc3Br)ccc21	748066193	NHTWOWKFMABZQS-UHFFFAOYSA-N	447.293	1.897	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)NCC(=O)N2CCN(c3ccccc3)CC2)c1	749222486	YNYDWPDHZHFHKW-UHFFFAOYSA-N	439.516	1.361	50	20	IDGD	
COCCS(=O)(=O)c1ccc(C(=O)NNC(=O)C2=S=C3CC[C@@H](C)CC3=C2)cc1	749564818	XTYYPYWAAOVFLU-CYBMUJFWSA-N	436.555	1.706	50	20	IDGD	
CC[C@H](NC(=O)NNC(=O)c1nn(-c2ccccc2)cc1O)c1nnc2n1CCCCC2	749580407	UALKEXAMYSWQAG-HNNXBMFYSA-N	438.492	1.991	50	20	IDGD	
CCN(CC)CCC(=O)NN=C1C(=O)N(Cc2ncon2)c2ccc(Br)cc21	750935201	OOAHNIHOESEOCL-UHFFFAOYSA-N	449.309	1.931	50	20	IDGD	
O=C(NNc1ncnc2[nH]cnc12)c1cc(NS(=O)(=O)c2cccs2)ccc1O	751068415	VHLSYEZJWGWSQD-UHFFFAOYSA-N	431.459	1.678	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)NNC(=O)CNC(=O)c2ccco2)c(C)n1C[C@@H]1CCCO1	751206481	HSMTYIKEIYQIPO-LTXFRBGYSA-N	439.472	1.361	50	20	IDGD	
Cc1ccc(-c2nnc(S)n2CC(=O)NNC(=O)CCN2C[C@H](C)O[C@H](C)C2)cc1	751426887	WRYYSRGWRGLNFX-GASCZTMLSA-N	432.550	1.189	50	20	IDGD	
CCCCOc1ccc(C(=O)NNS(=O)(=O)c2cnn([C@@H]3CCOC3)c2)cc1OC	751538984	UVBWTISYRLBHGE-OAHLLOKOSA-N	438.506	1.655	50	20	IDGD	
O=C(C[C@@H]1CSCCS1)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	752128188	YJTUGEJGKAGQCV-QGZVFWFLSA-N	443.038	1.844	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NCc1ccc(COC2CCOCC2)cc1	752154196	HTOXOZVWFICRTF-UHFFFAOYSA-N	446.529	1.704	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)NC1CCN(S(=O)(=O)C2CC2)CC1	753968238	SZUCXPMUECLOJJ-UHFFFAOYSA-N	430.914	1.249	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(C(=O)NCC(=O)NNc2cccnc2Cl)cc1	754480517	VZPOQWJOQOJOHX-UHFFFAOYSA-N	439.925	1.639	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)COc1ccc(OCc2ccccc2)cc1)S(C)(=O)=O	754672538	BUBRTOVUCXCXTR-OAHLLOKOSA-N	435.502	1.408	50	20	IDGD	
C[C@H](CC(=O)NNc1ccc(C(F)(F)F)nn1)NS(=O)(=O)c1cccnc1Cl	755191880	SWGLYWMENKBNAU-MRVPVSSYSA-N	438.819	1.744	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@H](C)[C@H](C)NC(=O)OC(C)(C)C	755312372	DMPMXMRWLOZZMI-NEPJUHHUSA-N	441.554	1.598	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)Nc2ccc(N3CCOCC3)cc2N2CCOCC2)o1	755456404	VFTWZOZEUNYDQO-UHFFFAOYSA-N	429.477	1.728	50	20	IDGD	
CCOC(=O)COc1cccc(NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c1	755655573	JWAHMFRVNXDMPD-UHFFFAOYSA-N	435.458	1.499	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@@H]2C)ccc1NC(=O)NNC(=O)[C@H](C)NS(C)(=O)=O	756246147	SWLXHSCUXRSLCP-KBPBESRZSA-N	439.538	1.100	50	20	IDGD	
COc1ccc(C2(NCC(=O)NNC(=O)c3ccc(OC)c(OC)c3)CCOCC2)cc1	756587202	ZUJPPSJRNCAWLG-UHFFFAOYSA-N	443.500	1.769	50	20	IDGD	
Cc1nn(-c2ccc(C(=O)NNc3ccc(C(N)=O)nn3)cc2)c(C)c1Br	757391908	HVXINNDHKNEVMD-UHFFFAOYSA-N	430.266	1.897	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCc2ccc3c(c2)C(=O)NCC3)ccc1OC(C)C	758688655	JHEICVZPGNJYOX-UHFFFAOYSA-N	426.473	1.913	50	20	IDGD	
CN(NC(=O)c1ccc(-n2cnnc2)cc1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758787585	SUASHOIASYAKOQ-UHFFFAOYSA-N	429.481	1.517	50	20	IDGD	
CCCn1ccnc1CCCN(C)C(=O)NNC(=O)c1csc(N2CCOCC2)n1	758856215	UFHJXXYCIGMIAG-UHFFFAOYSA-N	435.554	1.505	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NC[C@@H]1CC(=O)N(Cc2ccccc2)C1	759684637	VQHHYDJTBFXAAL-RDJZCZTQSA-N	428.464	1.972	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)Cc1ccccc1I	760440526	ZRGPVLXDVLYAHB-UHFFFAOYSA-N	447.273	1.896	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCCC(=O)NNC(=O)c1ccc2c(c1)OCO2	760798975	JYVRSLIXCIGHFP-AWEZNQCLSA-N	448.476	1.082	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)N[C@@H]1CCC[C@@H]2OCC[C@@H]21	761796573	YJXXQEYMAUDMMV-KURKYZTESA-N	436.534	1.373	50	20	IDGD	
CCOc1ccccc1OCC(=O)NN=C(C)c1c(C)nn(CCS(C)(=O)=O)c1C	763128186	YGAMWMVGBDWJRL-UHFFFAOYSA-N	436.534	1.862	50	20	IDGD	
CC(=NNC(=O)c1nnc(-c2ccccc2)o1)c1c(C)nn(CCS(C)(=O)=O)c1C	763162620	MKWOJROFUTVKOY-UHFFFAOYSA-N	430.490	1.749	50	20	IDGD	
CN(C)C(=O)c1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	763468620	NZXGXDVFXNPYBZ-UHFFFAOYSA-N	433.808	1.350	50	20	IDGD	
Cc1cc(F)cc(NC(=O)C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c1	763531823	RXRUDJFUISPIFG-UHFFFAOYSA-N	427.480	1.432	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(-n3cc(C)cn3)c(F)c2)c1	763631599	ZYNWNKMBJKKNBD-UHFFFAOYSA-N	425.420	1.793	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(NC(=O)CC(C)C)cc2)cc1	763661914	QRKMFBFYLFMSOV-UHFFFAOYSA-N	442.472	1.845	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2ccn(CCC(C)C)n2)c2ccccc2c1=O	763787298	WRPTYZBAKWFVSF-UHFFFAOYSA-N	439.476	1.059	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)C(=O)Nc1c(F)cccc1Br	763838776	ANSMLMFOXSGQCK-UHFFFAOYSA-N	428.189	1.892	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)c(F)cc1F	763850741	PBQDIFKVKVDKFB-LBPRGKRZSA-N	449.410	1.922	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cnn(CC(C)C)c2C)cc1	763862123	UNWDPORMANBMAL-HNNXBMFYSA-N	431.493	1.800	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1cc(C#N)ccc1OC(F)F	763872046	JRWXGMQRMVJGIT-JTQLQIEISA-N	436.346	1.852	50	20	IDGD	
Cc1cc(C(=O)N2CCCC2)ccc1NC(=O)C(=O)NNC(=O)Cc1ccc(F)cc1	763918158	BLRGJDNHVKNVRF-UHFFFAOYSA-N	426.448	1.699	50	20	IDGD	
COC(=O)c1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)c1cc(Cl)ccc1O	763974693	VWDIRPQCBMYHLD-UHFFFAOYSA-N	426.212	1.885	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1ccccc1O[C@@H]1CCOC1	764003791	JHAVZFAGBPNTHN-CQSZACIVSA-N	427.413	1.025	50	20	IDGD	
O=C1C[C@H](c2cccc(NC(=O)C(=O)NNC(=O)c3cccc(C(F)(F)F)c3)c2)CN1	764040904	QVLJRWSZSOFOIF-ZDUSSCGKSA-N	434.374	1.709	50	20	IDGD	
CC[C@@H](C)Oc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1	764077715	MJHYUOGLGUJHDR-CYBMUJFWSA-N	433.486	1.667	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)nc2)c(OC(F)F)c1	764102388	YWBLSXJZRYCUGA-UHFFFAOYSA-N	442.762	1.523	50	20	IDGD	
C[C@H]1C[C@@H](C)CN(C(=O)c2ccccc2NC(=O)C(=O)NNC(=O)CC(F)(F)F)C1	764111306	DYJYPWLBZNPPFE-TXEJJXNPSA-N	428.411	1.843	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)cccc1C(=O)N1CCCC1	764127387	VFWLCRKZPUVCCP-UHFFFAOYSA-N	444.875	1.990	50	20	IDGD	
CCCS(=O)(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)CCc2ccco2)c1C	764177220	KOAPBHGXOUPCSF-UHFFFAOYSA-N	436.490	1.458	50	20	IDGD	
O=C(CCc1ccccc1)NNC(=O)C(=O)Nc1cc2c(cc1[N+](=O)[O-])OCCCO2	764192859	LMXAOWCRCNTOOY-UHFFFAOYSA-N	428.401	1.475	50	20	IDGD	
CCOc1ncccc1NC(=O)C(=O)NNC(=O)c1cc(OC)ccc1Br	764232632	SAMQEMMJLCUZIT-UHFFFAOYSA-N	437.250	1.651	50	20	IDGD	
O=C(NNC(=O)c1cccc(OC(F)F)c1)C(=O)Nc1cccc(N2CCCNC2=O)c1	764249662	CJBJXARHBYOKBV-UHFFFAOYSA-N	447.398	1.607	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2ccc(F)c(I)c2)C[C@@H](C)O1	764321386	UUTNEBNJSVESKC-PHIMTYICSA-N	449.264	1.691	50	20	IDGD	
COC(=O)c1cc2cc(NC(=O)C(=O)NNC(=O)c3cnn(-c4ccccc4)c3)ccc2o1	764351490	SCVNMJPTMOJYPD-UHFFFAOYSA-N	447.407	1.805	50	20	IDGD	
CCOC(=O)c1cc(F)c(F)cc1NC(=O)C(=O)NNC(=O)COCc1ccccc1	764367992	QYKBYPZRMYFYFO-UHFFFAOYSA-N	435.383	1.444	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2c(C(=O)N3CCOCC3)oc3ccccc23)o1	764370522	DOILMPGOGWKCGN-UHFFFAOYSA-N	440.412	1.206	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(NC(=O)CN3CCCCCC3)cc2)o1	764371850	NILDUAUWDMITLA-UHFFFAOYSA-N	441.488	1.802	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1ncn(C2CCCCC2)n1	764392296	DGCMRRJTWMTFAK-UHFFFAOYSA-N	432.506	1.670	50	20	IDGD	
CCn1c(NNC(=O)CCC(=O)N2CCN(c3ccccc3)CC2)nc2ccccc2c1=O	764716811	LHXSYVVNHGNOOF-UHFFFAOYSA-N	448.527	1.989	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NN=CC[C@@H]1CCOC1)N(S(C)(=O)=O)CC2	765569399	KKTRCHKPOJBKFP-RHSMWYFYSA-N	439.534	1.481	50	20	IDGD	
COC(=O)NNC(=O)c1cc(S(=O)(=O)NCc2ccccn2)c(Cl)cc1Cl	765835209	CIEMNHYBKRKFNA-UHFFFAOYSA-N	433.273	1.868	50	20	IDGD	
CC(=O)Nc1ccc(Cl)c(C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c1	768102008	HWQZADQJUIFVAB-UHFFFAOYSA-N	434.792	1.825	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@@H](C(=O)NNC(=O)c2cc(-c3ccc(OC)c(OC)c3)[nH]n2)C1	768275636	DMPPWPKIMJJAQL-ZIAGYGMSSA-N	430.461	1.834	50	20	IDGD	
COc1ccc(N2C[C@@H](C(=O)NNc3c(OC)cccc3S(C)(=O)=O)CC2=O)cc1	768629260	HAKZDAKJSGEXRP-ZDUSSCGKSA-N	433.486	1.604	50	20	IDGD	
N#C/C(=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)O[C@@H]1CCNC1=O	769952074	VCVBFPAHWSBIQN-LRFDDAOPSA-N	427.848	1.418	50	20	IDGD	
COCCCS(=O)(=O)NCC(=O)NNC(=O)c1cc2c(s1)CC[C@@H](C(C)(C)C)C2	770126628	DBTAKQMCCBATIP-CQSZACIVSA-N	445.607	1.616	50	20	IDGD	
CCOc1ccccc1N1C[C@@H](C(=O)NNC(=O)c2ccc3c(c2)OCCO3)CC1=O	770394177	XUFNWPHTCVKZQP-HNNXBMFYSA-N	425.441	1.671	50	20	IDGD	
O=C(NNc1ccc(Br)c(F)c1)N[C@@H]1CCO[C@]2(CCS(=O)(=O)C2)C1	771342539	PSQKTEGSWBVNFU-IAQYHMDHSA-N	436.303	1.951	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)NCc1nc(COc2ccccc2)n[nH]1	771379089	UVUBSTZAZIIYFB-CYBMUJFWSA-N	428.424	1.821	50	20	IDGD	
CCNS(=O)(=O)c1ccc(C(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)cc1	772952431	HJTXHEOYWLNJAO-LBPRGKRZSA-N	425.894	1.867	50	20	IDGD	
CN1CCC/C1=N/S(=O)(=O)c1cccc(NC(=O)C(=O)NNc2ccc(C#N)cc2)c1	773697424	QUHFSTXXVLTSQE-BWAHOGKJSA-N	440.485	1.453	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ccc(C(F)(F)F)cc2)cc1OCC(N)=O	773762299	XIZZGBWIUWNDTB-UHFFFAOYSA-N	426.351	1.660	50	20	IDGD	
CS(=O)(=O)C[C@@H](NC(=O)NNC(=O)c1nn(-c2ccccc2)cc1O)c1ccccc1	774279838	NKYHXIMBRJWPTC-MRXNPFEDSA-N	443.485	1.308	50	20	IDGD	
Cc1cc(N2CCC[C@@H](NC(=O)NNC(=O)COc3ccccc3[N+](=O)[O-])C2)n(C)n1	775151235	ZCUCBWGZPCKIGY-CQSZACIVSA-N	431.453	1.015	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCN(C(=O)NC(C)(C)C)CC1	775721923	SSSRKVLQOZYZET-UHFFFAOYSA-N	425.917	1.235	50	20	IDGD	
CCOCCONC(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	776197633	PFFKVHSQQKMSST-UHFFFAOYSA-N	425.445	1.357	50	20	IDGD	
C[C@@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)NNc2cccc(S(C)(=O)=O)c2)C1=O	776528486	OTLZNXHDYIQTFU-IBGZPJMESA-N	434.449	1.140	50	20	IDGD	
COCCOc1cc(C(=O)NNC(=O)c2ccc(CSc3nncn3C)cc2)ccn1	777276854	XRPSZOQFIASLBK-UHFFFAOYSA-N	442.501	1.602	50	20	IDGD	
Cc1ccc(C(=O)NNS(=O)(=O)c2ccc(N3CCOC3=O)c([N+](=O)[O-])c2)c(O)c1	777611536	HDKUBNSKIJLFMS-UHFFFAOYSA-N	436.402	1.189	50	20	IDGD	
C[C@@H](C(=O)N1CCN(S(=O)(=O)CBr)CC1)N1CCc2ccccc2C1	777777914	SOMQTDRDHVPYRY-AWEZNQCLSA-N	430.368	1.260	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)C[C@@H]1CCN(C(=O)OC(C)(C)C)C1	777797259	IOKFYRWOFCOZAS-ZDUSSCGKSA-N	429.518	1.489	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNS(=O)(=O)c1c(Cl)ccnc1Cl	777937970	YWBGGHXYXZNMTO-UHFFFAOYSA-N	437.692	1.668	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)c1ccc(NS(=O)(=O)c2ccccc2)cc1	778432905	CNMIGKORCRTIPF-UHFFFAOYSA-N	448.501	1.773	50	20	IDGD	
CNC(=O)c1ccc(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2Br)cc1	778753325	QNSMUMDNEPVVEK-UHFFFAOYSA-N	436.222	1.799	50	20	IDGD	
Cn1c(=O)n(C)c2cc(NC(=O)C(=O)NNc3ccc(Br)cc3F)ccc21	783081180	NUXUWSFRXOMIQV-UHFFFAOYSA-N	436.241	1.860	50	20	IDGD	
CN(NC(=O)C(=O)Nc1ccc2c(ccn2CC(=O)N2CCOCC2)c1)c1ccccc1	783429859	OXLVJUYGTGPOKK-UHFFFAOYSA-N	435.484	1.606	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc2c(c1)CCN2C(=O)C(=O)NNc1nccc2sccc12	783436305	XDYHBERUYLEYHM-UHFFFAOYSA-N	445.526	1.579	50	20	IDGD	
Cc1c(NNC(=O)C(=O)Nc2ccccc2CN2C(=O)CCC2=O)cccc1[N+](=O)[O-]	784352008	HWWXGGHWLDLILP-UHFFFAOYSA-N	425.401	1.634	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CCc2ncc(NC(=O)C(=O)NNc3ccccn3)cc2C1	784791979	QOBFPOSLSYTCFQ-CQSZACIVSA-N	426.477	1.940	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ccnc(F)c2)cc1S(=O)(=O)N1CCCCC1	784846891	IUZDJFLWPLERAY-UHFFFAOYSA-N	435.481	1.786	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1cccc(NC(=O)C(C)C)c1	785331278	RUSYCVUFHQFVCX-UHFFFAOYSA-N	448.501	1.775	50	20	IDGD	
C[C@@H](OC(=O)/C(C#N)=C\C1CC1)C(=O)Nc1cccc(S(=O)(=O)N2CCOCC2)c1	786679130	WYFASRYWMIRRSM-VQCBNXJZSA-N	433.486	1.438	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CCc2ccccc2)cc1C(=O)N1CCOCC1	787541572	ACJQIPBRYFUHFA-UHFFFAOYSA-N	438.484	1.186	50	20	IDGD	
Cc1cccc(-n2c(S)nc3cc(C(=O)NNC(=O)C(C)(C)O)ccc3c2=O)c1C	787950540	NHGHBIQMVCFCID-UHFFFAOYSA-N	426.498	1.823	50	20	IDGD	
COc1ccc(C(=O)NCC(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)cc1OC	788092955	CDDDKUFTXNFXOR-UHFFFAOYSA-N	449.847	1.091	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c(C)cc1C	788330052	BKSUGQAZNAJAMD-KRWDZBQOSA-N	427.413	1.016	50	20	IDGD	
COc1ccc(F)c(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1OC	788491805	HNEPBYCBXDCCQS-UHFFFAOYSA-N	425.438	1.168	50	20	IDGD	
O=C(NNC(=O)N1CC(=O)N(CC2CC2)C1)[C@@H]1Cc2ccccc2CN1Cc1ccccc1	789830585	UBOZDRSSHPGTAD-QFIPXVFZSA-N	447.539	1.866	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)[C@@H]2CC(=O)C[C@@H](C)[C@H]2C(=O)NNc2nc(C)cc(C)n2)n1	791122567	AQFBOBIVOUDLMS-FDOKIQAASA-N	440.508	1.318	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)C(=O)Nc2cccc(F)n2)cc(OCC)c1OCC	793023107	HLFNAUGRMVZMMH-UHFFFAOYSA-N	434.424	1.817	50	20	IDGD	
Cc1nc(COc2ccc(NC(=O)C(=O)NNc3ccc4c(=O)[nH]ccc4c3)cc2)no1	793065433	MTJBMAGBSGXYGO-UHFFFAOYSA-N	434.412	1.880	50	20	IDGD	
O=C(NNC(=O)[C@@H](NC(=O)c1ccccc1)c1ccccc1)c1ccc(-n2cnnn2)cc1	793120350	BEKRFDSXPRVXSP-FQEVSTJZSA-N	441.451	1.595	50	20	IDGD	
COC(=O)Cn1ncc(NC(=O)C(=O)NNc2c(F)cc(F)cc2Br)c1C	797104937	RKVWSRAHGGOMOS-UHFFFAOYSA-N	446.208	1.487	50	20	IDGD	
O=C(NCc1ccncc1OCC(F)(F)F)NNC(=O)c1cc([N+](=O)[O-])ccc1O	798522279	HXQZMIALIUSVEW-UHFFFAOYSA-N	429.311	1.781	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)c1sccc1S(N)(=O)=O	800582392	UGFNPVFFUWIRKE-QMMMGPOBSA-N	448.320	1.387	50	20	IDGD	
Cc1c([N+](=O)[O-])ccc(F)c1NC(=O)C(=O)NNC(=O)c1cc(Br)c[nH]1	800622322	ACFGGHYYLOMUPU-UHFFFAOYSA-N	428.174	1.533	50	20	IDGD	
CC(=O)NCC(=O)N1CCc2cc(C(=O)NNC(=O)Nc3ccc(Cl)cc3)ccc21	802021893	CSUVHUINHPPWKW-UHFFFAOYSA-N	429.864	1.832	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)c2cc(S(=O)(=O)N(C)C)c[nH]2)c(OC)cc1Cl	802078469	OHRLVKQIJLGIBD-UHFFFAOYSA-N	445.885	1.402	50	20	IDGD	
Cc1nc(C(F)(F)F)ccc1NC(=O)C(=O)NNC(=O)c1cc([N+](=O)[O-])ccc1O	802571646	AHXAEUHWBGYWRW-UHFFFAOYSA-N	427.295	1.422	50	20	IDGD	
COc1ccc(S(C)(=O)=O)cc1S(=O)(=O)NNC(=O)c1ccc2ccccc2n1	802721010	RIOYUAYCMSUARB-UHFFFAOYSA-N	435.483	1.270	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)NCc2cc(C)nn2C)cc1	803459285	WKSXOGQLOMNBRU-BOPFTXTBSA-N	447.499	1.699	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1)n1ccc2ccccc2c1=O	806341638	NIEGWDAAOGKACZ-NSHDSACASA-N	448.888	1.325	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ccc(C)o2)c(C)cc1Br	806978833	HUUSKDHSRRIHMG-UHFFFAOYSA-N	438.234	1.845	50	20	IDGD	
Cc1cc([N+](=O)[O-])ccc1NNC(=O)C(=O)Nc1ccc(I)cn1	807455952	POOJOJPNYSZAFY-UHFFFAOYSA-N	441.185	1.985	50	20	IDGD	
O=C(NNc1nccnc1C1CCC1)C(=O)Nc1ccc(F)c(N2CCCNC2=O)c1	807462287	SKRKNLQQZSTDNM-UHFFFAOYSA-N	427.440	1.885	50	20	IDGD	
Cc1ccc(C)n1-c1ccc(C(=O)NNC(=O)NCc2ccccc2S(N)(=O)=O)cc1	807605511	NYCWBCZBVGLCTO-UHFFFAOYSA-N	441.513	1.886	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCc2ccccc2S(N)(=O)=O)ccc1OC(C)C	807606001	UZTDVVQGHZNMME-UHFFFAOYSA-N	436.490	1.274	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)[C@H](Cc1cnc[nH]1)NC(=O)CC(C)C	811102757	CRVBMAKEIYYUKQ-AWEZNQCLSA-N	437.522	1.039	50	20	IDGD	
O=C(NNC(=O)N1CCC[C@@H](CNC(=O)C(F)(F)F)C1)c1cnn(-c2ccccc2)c1	811880427	MMTBCYQLXCCRNT-ZDUSSCGKSA-N	438.410	1.617	50	20	IDGD	
Cc1cc(CNC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)cc(N2CCCC2)n1	811938170	REPFYUPDFBSKDI-UHFFFAOYSA-N	446.533	1.930	50	20	IDGD	
CC(C)C(=O)N[C@@H](CO)C(=O)NNC(=O)c1cn(-c2ccccc2)nc1-c1ccccc1	813384895	FZFVUYIQPKIPKA-IBGZPJMESA-N	435.484	1.433	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NN=C2CCCc3nc(O)c(C(N)=O)cc32)C1	814973600	INUPVFKXUZRKIZ-GFCCVEGCSA-N	431.493	1.690	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCc2nncn2C1)C(=O)Nc1ccc(COc2ccccc2)cc1	815691077	DYKRLXMXXNRZRN-INIZCTEOSA-N	434.456	1.206	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1ccc(OC(F)F)cc1F	815751739	MUMQKMZCOHQJEM-UHFFFAOYSA-N	446.407	1.759	50	20	IDGD	
CC(C)OCc1ccc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)N(C)C)cc1	815752080	AYIHQKBUANDCSA-UHFFFAOYSA-N	434.518	1.944	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NNC(=O)c2cccc(CS(C)(=O)=O)c2)C1	816510304	RKAVJDJUUJXFGT-MRXNPFEDSA-N	439.534	1.639	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)c2sccc2S(=O)(=O)N2CCCC2)c1	822443164	PSCUCLFAEPLCNL-UHFFFAOYSA-N	437.543	1.989	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2CC(=O)N(c3ccc(C)c(F)c3)C2)cc1C	844257526	CQSJRYMUJDGGPN-HNNXBMFYSA-N	426.448	1.890	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(/C#N)C(=O)O[C@H](C)C(=O)N2CCN(C(C)=O)CC2)c1C	853647614	BIJUKLDXATVEAV-QVQQZCKUSA-N	444.532	1.842	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)/C=C\c1ccccc1)C(=O)NNC(=O)c1ccccn1	866597778	FTOYVCYDBOGREO-VWILAXROSA-N	434.543	1.555	50	20	IDGD	
COc1cc(S(=O)(=O)N2CCOCC2)cc(C(=O)NNc2cccc(C)c2)c1OC	912636981	CUYQUTJRRRDCQI-UHFFFAOYSA-N	435.502	1.790	50	20	IDGD	
CN1CCC(NC(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)CC1	915898569	CUCUPPMTKDIESE-UHFFFAOYSA-N	434.500	1.483	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCc2nc3ccccc3n2CC)c2ccccc2c1=O	915928296	KVMVRVJGNJSOHC-UHFFFAOYSA-N	433.472	1.930	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCc2ccc(N3CCCC3=O)cc2)nc1	916219284	YVZXMGYDTVMUDI-UHFFFAOYSA-N	446.533	1.721	50	20	IDGD	
CCOCCOCc1cccc(CNC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1	916512928	QDMLFMNUMOJVFA-FQEVSTJZSA-N	429.473	1.910	50	20	IDGD	
Cc1nc(N2CCOCC2)nc(O)c1CCC(=O)NNC(=O)c1ccc2ccccc2c1	918111929	JUVJTXFHNQIAMI-UHFFFAOYSA-N	435.484	1.874	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c2ccccc12	919955699	LZZKNNGXXZEGCQ-UHFFFAOYSA-N	438.469	1.838	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)Nc1ccccc1CN1C(=O)CNC1=O	920933402	OCAGIJMEVOSEFX-LBPRGKRZSA-N	429.408	1.498	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)CC2(CC(=O)N3CCOCC3)CCCC2)c1	1116158329	AISDAOWIDJKBHU-UHFFFAOYSA-N	445.516	1.499	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)c1ccc([S@@](C)=O)cc1	1253663491	VFKYXVSRNZACRC-BODITIBLSA-N	438.531	1.924	50	20	IDGD	
CNC(=O)c1ccc(NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c(C)c1	1254703236	BZTOFCQGTFBWKM-UHFFFAOYSA-N	438.532	1.720	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NC[C@@H](OC)c2ccc(F)cc2)c2ccccc2c1=O	1319076266	DURUHNKBIJOVLZ-QGZVFWFLSA-N	427.436	1.887	50	20	IDGD	
COc1cc(CCNC(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)ccc1O	1328686433	XHSDECCWRVMONK-UHFFFAOYSA-N	436.509	1.921	50	20	IDGD	
O=C(c1cc2c(F)cc(F)cc2[nH]1)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1777795366	UUMWVCXTNJCDHH-LPHOPBHVSA-N	427.835	1.489	50	20	IDGD	
Cc1nc2ncccn2c1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](C)Br)CCO2	1777903157	HCNIUJWTOWXDNJ-KPZWWZAWSA-N	436.310	1.265	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cn4ncccc4n3)C2)C1	1777950960	RISZPWITUDKLLD-FZKQIMNGSA-N	436.310	1.204	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnn4ccncc34)C2)C1	1777976565	DCPWMOJMLPUYIF-ACJLOTCBSA-N	436.310	1.204	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc4cccn4cn3)C2)C1	1778051641	NTYWYNBGUVZXFG-BEFAXECRSA-N	435.322	1.951	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)Cc3ccc4c(c3)CCCO4)C2)C1	1778270092	NRLVNZSIBBYWHM-GCJKJVERSA-N	436.936	1.638	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4c(c3)CC(=O)N4)C2)C1	1778391846	DDHQYCXPHYKTIC-CWTRNNRKSA-N	436.306	1.408	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)C(=O)Nc3cccnc3)C2)C1	1779205673	BOOXOTADSUAHRP-KBXCAEBGSA-N	439.310	1.024	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccc(-n3cnnc3)cc1)CCO2	1779296328	OLRMHCGKUKBKBE-OAQYLSRUSA-N	443.580	1.562	50	20	IDGD	
COc1cnc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@](C)(Cl)CCl)C2)cn1	1780710119	IPLKVDSGJDHONO-NIKGAXFTSA-N	445.347	1.849	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(Cl)c(O)cc3O)C2)C1	1781473415	ZHGZQZHXZPLGLT-BTDLBPIBSA-N	447.713	1.978	50	20	IDGD	
C[C@H](O)C(=O)N1CCO[C@]2(CCN(C(=O)/C(C#N)=C/c3ccc(Br)cc3)C2)C1	1782870552	SZWZYUKYUHRYIJ-HBHISVEPSA-N	448.317	1.567	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cc4n(n3)CCC4)CCO2)C1	1783349345	KSBGJJRWFUYEOF-KDOFPFPSSA-N	425.327	1.446	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2	1783854530	OCZJXHDXPIAKQH-KQEPKPNTSA-N	447.359	1.808	50	20	IDGD	
CC(C)c1csc(C(=O)N2CCO[C@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)n1	1783936636	QRRQNWNBQALKSJ-FQEVSTJZSA-N	437.566	1.083	50	20	IDGD	
CCCC(=O)N[C@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]2C1	1783966957	NBCUOANYQOWGEJ-OWYFMNJBSA-N	446.386	1.302	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cccc4ncccc34)C[C@@H]21)[C@@H](O)CCl	1784086636	ZAJJRVJZSWZFIM-UHMOLFJZSA-N	431.920	1.357	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4c(F)cc(F)cc4[nH]3)C[C@@H]21)[C@@H](O)CCl	1784090435	GDBNGBBVXAGLKD-KLUHQITGSA-N	441.862	1.639	50	20	IDGD	
C[C@H](NC(=O)c1cnccn1)C(=O)NC1(c2ccc(NC(=O)[C@@H](O)CCl)cc2)CCC1	1786135105	YJQQDALWGMNWAH-GUYCJALGSA-N	445.907	1.329	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CSc3ccccc3)[C@H]2C1	1786558630	DSRRHTBMTDLCSO-WDSOQIARSA-N	448.589	1.131	50	20	IDGD	
O=C(CCBr)Nc1ccc(C2(NC(=O)[C@H](O)N3CCOCC3)CCC2)cc1	1787674916	BDYNSXNHUQKJIC-SFHVURJKSA-N	440.338	1.556	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4nccnc4c3)[C@H]2C1	1788031265	WJJLBVCQTKJHNS-GGXPGOJBSA-N	432.908	1.477	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)N3C[C@@H]4C[C@H]4C3)[C@H]2C1	1788515840	DRSCXHZJOIWBRN-TYXVVTFGSA-N	428.371	1.090	50	20	IDGD	
C=CCCC(C)(C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1	1788607827	MFYMIFYZUIEXFT-SNRMKQJTSA-N	443.548	1.271	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cn4ccccc4n3)C[C@@H]21	1788762641	JXBFJFFLHQYMDU-BQFCYCMXSA-N	430.581	1.779	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3CN(C(=O)OC(C)(C)C)C3)C[C@@H]21	1789860015	RKQHZQGEAXQJKX-LLLHUVSDSA-N	443.972	1.850	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)c1cccc2ccnn12	1790342461	WKEZBBSEQQVOGA-QRTARXTBSA-N	435.322	1.713	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3c4c(nn3C)CCC4)C[C@@H]21	1791063173	CGYFJUUQHYIFLK-DUPGQFARSA-N	439.354	1.286	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)COc3ccccc3OC)C[C@@H]21	1791250464	GILDKSZEIFSHRS-GGXPGOJBSA-N	440.924	1.308	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(OC)ccc3F)C[C@@H]21	1791256956	ZCSSZGVPMSFBSI-RPZXMPESSA-N	428.888	1.681	50	20	IDGD	
C[C@H](Br)C(=O)NC1(c2ccc(NC(=O)CN(CCO)CCO)cc2)CCC1	1791328803	OGTWLZRSGUZVRP-AWEZNQCLSA-N	442.354	1.191	50	20	IDGD	
CN(C)c1ccc(CCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](O)CCl)C[C@@H]32)cc1	1791465899	HYXXMRQDZFQTPD-LEAZDLGRSA-N	437.968	1.265	50	20	IDGD	
COc1cccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)CBr)c1	1792868369	XBVHTKHJKDLNDD-AMVTXUCVSA-N	439.350	1.858	50	20	IDGD	
C[C@@H](Cc1ccncc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)CBr	1792872099	LXSZGWGXKOKVPU-XWJBARJFSA-N	438.366	1.881	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(Br)cs1)C2)[C@H](O)CCl	1792978069	BJJGAMVWFCVTPG-INTNWOOBSA-N	437.743	1.314	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCl)C1CCN(Cc2ccccn2)CC1	1793110604	MEKVXBLNADMXPY-IYWMVGAKSA-N	434.968	1.532	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1(c2ccc(O)cc2)CC1	1793169597	ZGBYLAJVCVISNE-BJWYYQGGSA-N	449.511	1.374	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@]1(C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2	1793646681	ITVKDPYGDIEUIK-UPYQZRRNSA-N	447.935	1.900	50	20	IDGD	
Cc1ccncc1CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2	1794102556	OQZBQNPUNXVBNL-YALNPMBYSA-N	428.302	1.603	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ncc(Cl)cn1	1794537593	TUKJETITBBAMLM-HNCHTBHHSA-N	431.718	1.364	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(C(=O)O)ncn1	1794680902	SNFUQMWGCJZKSD-WRWGMCAJSA-N	425.283	1.600	50	20	IDGD	
O=C([C@@H](F)Br)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1(C(F)(F)F)CCC1	1795480317	PFCWCGKPZICJPM-LMLFDSFASA-N	431.224	1.999	50	20	IDGD	
CC(C)(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Cl)NC(=O)OC(C)(C)C	1796360907	DYXSZNCRYSFJGK-NEBZKDRISA-N	435.924	1.804	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(C)n(C(F)F)n1	1798677291	RMXYEALTCMWDCV-OPDFLTKYSA-N	449.296	1.963	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccccc1C(N)=O	1799622741	JELIMXVHYNZPKB-NFFDBFGFSA-N	438.322	1.020	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]1c1cccnc1	1803138158	XVHWNTZYPMAXEY-REBRKWNGSA-N	432.746	1.718	50	20	IDGD	
Cc1cc(NC(=O)CC(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)no1	1803139620	RQLKTXICQBRWDG-ZRGWGRIASA-N	449.895	1.012	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cn3cccnc3n2)[C@@H]1c1cccnc1)[C@H](O)CCl	1803143114	UJVVUXGEWAURHI-USXIJHARSA-N	428.880	1.044	50	20	IDGD	
C#CC(=O)N1CC[C@H](CNC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)[C@@H]1c1cccnc1	1804240883	KXGHYVHQYIZRIO-RYRKJORJSA-N	434.924	1.853	50	20	IDGD	
O=C(CCc1cc(F)ccn1)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1	1804441758	FCSFMRBRBIVNHG-ZAAXVRCTSA-N	434.899	1.854	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1(NC(=O)OC(C)(C)C)CC1	1804592767	DNWWAYWXVHXNMM-XGUBFFRZSA-N	429.945	1.936	50	20	IDGD	
CCC(=O)N[C@H](C)C(=O)N1CC[C@H](CNC(=O)CCBr)[C@@H]1c1cccnc1	1806343336	UZXDCVRLTGAORV-SIIHOXLZSA-N	439.354	1.787	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CCc2ccoc2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1	1807374158	IWNKWRDAJGMZCT-REWPJTCUSA-N	447.300	1.307	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc(O)nn2)[C@@H]1c1cccnc1)[C@@H](F)Br	1808651202	KGYXOMMAMPWUFR-NILFDRSVSA-N	438.257	1.587	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H](CNC(=O)[C@H](F)Br)[C@@H]1c1cccnc1)n1cncn1	1808679671	AGECKNIONFDVEM-RZFFKMDDSA-N	439.289	1.631	50	20	IDGD	
O=C(CC1CCOCC1)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1	1809976546	CNAAYYPTRBMRHY-UHFFFAOYSA-N	428.338	1.028	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)[C@@H]2C[C@H]3CC[C@@H]2O3)[C@H]1c1cccnc1	1812894538	ZOKMEQWQGIZKSO-FHRFECMSSA-N	443.548	1.028	50	20	IDGD	
CC(C)[C@H](S)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1815243272	IQLCNNFXCIYQFK-WBVHZDCISA-N	445.549	1.669	50	20	IDGD	
C[C@@H](C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1)n1cccc1	1815347683	KJTKQZFIGYOCBP-XJKSGUPXSA-N	438.318	1.111	50	20	IDGD	
CCc1ccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)cn1	1816324283	UIKNVKGWUPQNQK-FQEVSTJZSA-N	447.304	1.667	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1	1818110673	NMBAHKREFIUBIC-IJLMDXODSA-N	449.899	1.136	50	20	IDGD	
O=C(/C=C\C(=O)NC1CC1)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](F)Br)CC2	1819531818	SEWIFIUOPWKFSS-VBMBPTLOSA-N	445.314	1.580	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](C)Br)[nH]n1	1819585786	KRBFOWPGMHHKGG-WZRBSPASSA-N	426.315	1.876	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2n[nH]cc2[N+](=O)[O-])[nH]n1	1822372807	NLCYLAZMQHHLDX-GXSJLCMTSA-N	425.833	1.601	50	20	IDGD	
Cc1nnc(CC(=O)N2CCCC[C@@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)s1	1822413917	HDQPDYJMGIZCTA-CQSZACIVSA-N	448.553	1.177	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2nc(C)c(C)[nH]c2=O)CC1	1825448522	JMAGCAWLWCHDOO-IAGOWNOFSA-N	438.956	1.874	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(=O)ccn1C)CC2	1825645851	JTRQHKQEAHROBD-ZJUUUORDSA-N	439.335	1.851	50	20	IDGD	
Cc1cc(C(=O)N[C@@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)c(C)o1	1826080546	QFHICSVTHCNUOR-CYBMUJFWSA-N	433.534	1.952	50	20	IDGD	
COCC1(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)CC1	1827048867	AUEILYFBVIVKNA-HXUWFJFHSA-N	428.338	1.026	50	20	IDGD	
O=C(Cc1ccccc1)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827051246	QLMPYYDBNKQWCK-HSZRJFAPSA-N	434.345	1.842	50	20	IDGD	
Cc1ccnc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)c1	1827059967	YXYZRRNBHCFIDX-JOCHJYFZSA-N	435.333	1.617	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)ccn1	1829245023	KYVZKTGLBZBLNU-JOCHJYFZSA-N	435.333	1.617	50	20	IDGD	
N=C1NCCN1CC(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](F)Br)CC1	1830375687	WLXQQLWWJAQTPY-DZGCQCFKSA-N	432.338	1.137	50	20	IDGD	
O=C(Cc1cccc2ncccc12)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1831351326	XDJADKWXGBJQCV-PZJWPPBQSA-N	435.883	1.768	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3CCC(CO)CC3)C2)C1	1831641183	WPUNEJAWJHSXMS-JWYNLTDQSA-N	430.973	1.649	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3n[nH]c4c3CCCC4)C2)C1	1831646249	JYAILRWPBLSJJA-KKSFZXQISA-N	438.956	1.766	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3nc4ccccn4n3)C2)C1	1831647852	ZJKOKCFPUVPQAL-YWZLYKJASA-N	435.912	1.207	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnn4c3OCCC4)C2)C1	1831653215	BWHVJEGBQIZXQG-UZLBHIALSA-N	440.928	1.143	50	20	IDGD	
O=C([C@H](F)Br)N1CCC([C@@H]2CCCCN2C(=O)CN2C(=O)C=CC2=O)CC1	1831986642	SVWYGSPWDYLVLO-GUYCJALGSA-N	444.301	1.222	50	20	IDGD	
C=CCSCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](Br)CC)C2)C1	1832461523	YKPDYNKHHMPHOM-PBHICJAKSA-N	435.384	1.536	50	20	IDGD	
Cc1ccc(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)s1	1832882288	LNKFWBVAZLJABF-APWZRJJASA-N	430.954	1.045	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)Cc3cc(F)cc(F)c3)CC2)CC1)[C@@H](O)CCl	1833310661	NZPYBVPSTLPCQH-IBGZPJMESA-N	443.922	1.679	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)[C@H](CC)NC(N)=O)CC2)CC1	1833532616	ZGTCBTHLVCLWIA-SJORKVTESA-N	429.993	1.412	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)c3cncc(F)c3)C2)C1	1834819185	JROSIZMPUSXURL-KRWDZBQOSA-N	430.274	1.076	50	20	IDGD	
C[C@H](Nc1ccccn1)C(=O)NC1CCN(C2CCN(C(=O)[C@H](F)Cl)CC2)CC1	1835847115	KNCVHZNJBMMLEJ-KSSFIOAISA-N	425.936	1.988	50	20	IDGD	
C[C@]1(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](F)Br)CC3)CC2)CCCN1	1836384218	DSTMTHDDBYGLII-CRAIPNDOSA-N	433.366	1.391	50	20	IDGD	
Cc1cc(C(=O)N2CCC(OC3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)n(C(F)F)n1	1836718541	RCWVXRSILCZRPV-INIZCTEOSA-N	448.898	1.799	50	20	IDGD	
O=C(c1cnc(Cl)c(Cl)c1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1837915408	GKYDQPFZFSYYMN-WBMJQRKESA-N	440.686	1.993	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(C#N)cc3)CCO2)C1	1838952598	CTVUFOYZSLARGU-PMACEKPBSA-N	440.327	1.865	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnn(C(C)(C)C)c3)C2)C1	1839143252	PYACOZZQBYMUGA-OXQOHEQNSA-N	426.945	1.726	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)c(C)n1C	1839153433	HXXVGEVEWPZFNT-VQTJNVASSA-N	446.375	1.948	50	20	IDGD	
Cc1cccc(C)c1NC(=O)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1839157604	YVBQOSBZMOEORT-UZLBHIALSA-N	441.887	1.233	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(O)c(O)c(Cl)c3)CCO2)C1	1839433621	MHPIDFUNTGRWSW-DJJJIMSYSA-N	447.315	1.839	50	20	IDGD	
O=C(c1ccc2ccnn2c1)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1839571083	ACNAWAVPRSFXJM-SFHVURJKSA-N	427.288	1.208	50	20	IDGD	
O=C(c1nccc2occc12)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840188145	QIVKSCJHFGPPNC-GOSISDBHSA-N	428.272	1.702	50	20	IDGD	
C[C@@H](C(=O)N1CCO[C@]2(COCCN(C(=O)CCBr)C2)C1)c1ccccn1	1840500537	JCDAUNYJLCZKDK-BEFAXECRSA-N	440.338	1.427	50	20	IDGD	
C#CCO[C@@H](C)C(=O)N1CCCC12CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2	1841601106	FTIXDXVEMZNKLC-AWEZNQCLSA-N	429.429	1.375	50	20	IDGD	
CCCc1onc(C)c1C(=O)N1CCCC12CN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2	1843524889	WVZNSTPKWQDVNH-BUVRLJJBSA-N	440.504	1.887	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC2(CCCN2C(=O)c2cc(=O)nc3cccnn23)C1	1844674221	GUBJLSHPALTSPU-GFCCVEGCSA-N	434.294	1.080	50	20	IDGD	
COC(=O)CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)[C@H](F)Cl)C2	1845146317	NEAQXCAWNWPWCN-OCCSQVGLSA-N	449.907	1.571	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC2(CCCN2C(=O)c2cnc3c(c2)CCNCC3)C1	1845797798	WPGRWYLHRRUJPA-IBGZPJMESA-N	425.360	1.823	50	20	IDGD	
COC(=O)C[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)[C@@H](F)Cl)C2	1846212684	OQVMFWVQEHVBRN-DGCLKSJQSA-N	435.880	1.181	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@]2(O)CCN(C(=O)OC(C)(C)C)C2)C1	1846412024	JVKGFRPEMOKPOR-JLTOFOAXSA-N	429.945	1.579	50	20	IDGD	
Cc1ccc(C)c(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)C(=O)NC3CC3)cc2)c1	9890032	RLMNIBCCTLRMFL-UHFFFAOYSA-N	430.486	1.144	50	20	IDGD	
CCN1CCN(c2ccc(S(=O)(=O)N3CCOCC3)cc2NC=C(C#N)C#N)CC1	15241514	DQLAUVSYLJGVAF-UHFFFAOYSA-N	430.534	1.192	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cc(SC)ccc2[N+](=O)[O-])cc1OC	16196430	WZWYRCLBJUYWPI-UHFFFAOYSA-N	449.441	1.952	50	20	IDGD	
CON(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)cc1	19203591	ZMDKQRLQNHXVSI-HNNXBMFYSA-N	435.502	1.714	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CSc2nnc(-c3ccoc3C)n2N)cc1OC	21166083	VLVHZZMLRYLPQV-UHFFFAOYSA-N	432.462	1.131	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cnc3ccccc3n2)c1	28195975	VFSJXCXUFVSOMQ-UHFFFAOYSA-N	427.486	1.735	50	20	IDGD	
O=C(COC(=O)c1cnn(Cc2ccccc2)c1)NNC(=O)[C@@H]1COc2ccccc2O1	115278984	YCOIPNIRNUDIPX-IBGZPJMESA-N	436.424	1.076	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)c1ccc(S(=O)(=O)Nc2ccccc2)cc1	725740274	SKIGIPGBFCSYNR-UHFFFAOYSA-N	442.453	1.271	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)NC[C@@H](O)COc2ccc3c(c2)OCO3)c1C	725890575	RXZKUULHANYDEV-MMWCCMKASA-N	441.484	1.943	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)C2=Cc3cccc(OC)c3OC2)cc1OC	725976566	CMMMOLGARRDBOX-UHFFFAOYSA-N	442.424	1.493	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N=c2sccn2C)cc1	726533720	WIFODRNUSGXLHS-UTNLSVLTSA-N	436.497	1.869	50	20	IDGD	
Cc1cc(NC(=O)CSCC(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)no1	726862176	GHEBHTRAGZDDNI-UHFFFAOYSA-N	439.519	1.239	50	20	IDGD	
COCCN(C)CCNC(=O)NNC(=O)c1cc2c(C)nn(-c3ccccc3)c2s1	727032839	KXKMSYVQUXBSKW-UHFFFAOYSA-N	430.534	1.918	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@H]2CSCN2C(=O)OC(C)(C)C)c2ccccc2c1=O	727114398	RVQQLMKUAUNJOH-CQSZACIVSA-N	447.517	1.487	50	20	IDGD	
CCC[C@@H](NC(=O)NNC(=O)Cn1nc(C)cc1C)C(=O)N1CCc2sccc2C1	727227539	BDPIPIYTUMZRKO-MRXNPFEDSA-N	432.550	1.645	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CCc2nc(-c3ncccn3)no2)ccc1OC(C)C	727724434	YZWSKJZXOUGXCG-UHFFFAOYSA-N	426.433	1.716	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)o1	728213536	DPBALIHNDKZWQA-UHFFFAOYSA-N	449.577	1.814	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)CCn2nnc3ccccc3c2=O)c1	728529298	YDARRHCUJKDEJK-UHFFFAOYSA-N	446.261	1.414	50	20	IDGD	
CC[C@H](N=c1nn[nH]n1-c1ccccc1)C(=O)NNC(=O)c1cccc(OC(F)F)c1	729533877	VHQQCRIKRCPTNR-HNNXBMFYSA-N	431.403	1.337	50	20	IDGD	
C[C@@H](CN1CCN(C)CC1)NC(=O)NNC(=O)COc1ccccc1Cc1ccccc1	730129885	DGYGGSCDNGUFTO-IBGZPJMESA-N	439.560	1.623	50	20	IDGD	
CSCC[C@H](C(=O)NNC(=O)COc1ccccc1O)N1C(=O)[C@H]2CCCC[C@H]2C1=O	730780195	KATISDOBYWZSRS-QLFBSQMISA-N	449.529	1.215	50	20	IDGD	
CCOC(=O)C1CCN(C(=O)CN(C)C(=O)NNC(=O)C(C)(C)c2ccccc2)CC1	731222492	QWIZZBRPIYWIKF-UHFFFAOYSA-N	432.521	1.439	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN(C(=O)Nc2ccccc2)C1)c1ccc(-n2cnnn2)cc1	731853882	LGEYGHLEFKQFTI-INIZCTEOSA-N	434.460	1.367	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2cccc(NC(=O)CCn3ccnc3)c2)C[C@@H](C)O1	732261468	MXYRXUPEFRTIGD-CALCHBBNSA-N	442.520	1.172	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NC[C@@H]3CCc4ccccc43)nc2)CC1	732468833	LBQQQKSLUCNXMC-KRWDZBQOSA-N	444.561	1.374	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N[C@@H](C)c2nncn2C)cc1	733132851	XWMBNFUGSKMRMY-KNGSKEOJSA-N	448.487	1.347	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)c1nc(N2CCCC2)ncc1Cl	734240414	NTQNKQJTKVFMIJ-UHFFFAOYSA-N	427.893	1.199	50	20	IDGD	
O=C(NNc1cnccn1)[C@@H]1CCCN(S(=O)(=O)c2ccc(Br)s2)C1	734242413	DSQMKGCCCHWZCS-SNVBAGLBSA-N	446.352	1.845	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)cc1C(=O)N(C)C	734417621	BUEHTFUHBNDJEE-UHFFFAOYSA-N	435.546	1.923	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(\C#N)C(=O)N[C@@H]2CCN(CCN3CCOCC3)C2)c1C	734468289	QHJJXRDNZXGDSN-RRCLPCQVSA-N	443.592	1.742	50	20	IDGD	
COC(=O)COc1cccc(CNC(=O)NNC(=O)Cc2nc3ccccc3n2C)c1	734671430	MERIVXUBIQMTBK-UHFFFAOYSA-N	425.445	1.198	50	20	IDGD	
COc1ccc(CN2CC[C@H](NC(=O)NNC(=O)COc3ccc(C)c(C)c3)C2=O)cc1	734682875	DGXYLQOJCBWPHN-FQEVSTJZSA-N	440.500	1.822	50	20	IDGD	
COCCNS(=O)(=O)c1cccc(CNC(=O)/C(C#N)=C\c2cc(C#N)n(C)c2C)c1	735478575	PPDCZYKPHZIENX-ZDLGFXPLSA-N	441.513	1.353	50	20	IDGD	
CC(=NNC(=O)COCc1ccccc1)c1ccc(S(=O)(=O)N2CCOCC2)cc1	737438806	JKPXNFLOVOMKSZ-UHFFFAOYSA-N	431.514	1.765	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)NC1CCN(C(=O)c2ccccc2F)CC1	738967887	MEJDADXDHCQCQO-UHFFFAOYSA-N	428.464	1.978	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)CN2CCN(c3ccccn3)CC2)cc1OC	740749105	LOHQNTWFDDVGIH-UHFFFAOYSA-N	441.532	1.852	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)N[C@H](C)[C@H]2CN(Cc3ccccc3)CCO2)c1	741268243	WCWISMRKFPUVCH-WIYYLYMNSA-N	426.517	1.994	50	20	IDGD	
CS(=O)(=O)CC[C@@H](Cc1cccc(Br)c1)C(=O)NNc1cccnn1	741286661	BXAKJILPFGLDDN-ZDUSSCGKSA-N	427.324	1.976	50	20	IDGD	
O=C(CN1C(=O)[C@@H]2CCCC[C@H]2C1=O)NNC(=O)NCc1cccc(C(F)(F)F)c1	742457345	FQDQBOKXYDCKQX-ZIAGYGMSSA-N	426.395	1.711	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)[C@@H](c2ccccc2F)N2CCOCC2)nc2ccccc21	742474202	NGGNUZDANNCURL-OAQYLSRUSA-N	425.464	1.476	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@H](C(=O)NNC(=O)CNC(=O)c1ccco1)c1ccccc1	742611511	ACLDUHWOMSIWHJ-HNNXBMFYSA-N	430.461	1.465	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)N[C@@H](C)CN2CCN(c3ccccc3)CC2)c1	743509064	XMULYPIOSOLMED-IBGZPJMESA-N	425.533	1.915	50	20	IDGD	
CCCS(=O)(=O)N1CCC(NC(=O)NNC(=O)c2cccc(Br)c2)CC1	743534264	HOAYVTNARYBOBD-UHFFFAOYSA-N	447.355	1.597	50	20	IDGD	
CCOC(=O)NNC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(Br)s1	743734334	OJVQJHDIEABJTB-VIFPVBQESA-N	440.341	1.831	50	20	IDGD	
CN(CC(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1)C(=O)OC(C)(C)C	744622010	LZYUXEFNHYHRFG-UHFFFAOYSA-N	428.511	1.018	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNC(=O)N[C@@H]2C[C@H](C)N(c3cnn(C)c3)C2=O)cc1	745916134	AYVCMDDUSYYQEB-HNAYVOBHSA-N	442.520	1.983	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)c1cccc(-n2cccn2)c1	745928071	TWYDHGSKFCBAGP-INIZCTEOSA-N	434.504	1.970	50	20	IDGD	
Cc1cc(=O)n(CC(=O)NC(C)C)c(C)c1C(=O)NNC(=O)Cc1ccc(Cl)cc1	746099225	WQNNPJAHMGGORG-UHFFFAOYSA-N	432.908	1.647	50	20	IDGD	
CCC[C@@H](NC(=O)NCc1ccc(F)cc1)C(=O)NNC(=O)Cc1cn2ccccc2n1	746637620	ROAMTZGTODSYFO-GOSISDBHSA-N	440.479	1.831	50	20	IDGD	
CN(C)C(=O)NNS(=O)(=O)c1c(Br)cc(C(=O)O)cc1Br	747609582	UUOUVXHRCSGEIL-UHFFFAOYSA-N	445.089	1.374	50	20	IDGD	
NS(=O)(=O)c1ccc(OCCSCC(=O)NNc2ccc([N+](=O)[O-])cc2)cc1	747986235	MVYQIKBOGMTFQS-UHFFFAOYSA-N	426.476	1.498	50	20	IDGD	
CCc1cc(N2CCC(NC(=O)NNC(=O)[C@@H](C)Oc3ccc(F)cc3)CC2)ncn1	748663141	GDHXINRWMONTPO-CQSZACIVSA-N	430.484	1.945	50	20	IDGD	
COCCOCC(=O)NC1CCC(C(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)CC1	748696611	NQOHNYJRXMCSDQ-UHFFFAOYSA-N	435.565	1.688	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NNC(=O)c2cc3ccccc3o2)cc1	750289853	XWCFDFQUWPLANJ-UHFFFAOYSA-N	431.430	1.517	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)c2cc(Br)c[nH]2)c1	750843765	PTCOYRNZGJKDKQ-UHFFFAOYSA-N	433.259	1.241	50	20	IDGD	
O=C(NNC(=O)c1cc(Cn2cc(Br)cn2)on1)c1ccc2c(c1)OCCO2	751573321	KJHBXXWMEUJYSH-UHFFFAOYSA-N	448.233	1.528	50	20	IDGD	
O=C(CO)NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2-c2ccccc2)c1	753442160	AHDRSWATIQSCCA-UHFFFAOYSA-N	425.466	1.908	50	20	IDGD	
COC(=O)c1cc2c(cc1NC(=O)C(=O)NNc1ccc(Br)nc1)OCO2	753853475	UDISSPCVQMPADD-UHFFFAOYSA-N	437.206	1.441	50	20	IDGD	
O=C(Cc1ccc(I)cc1)NNC(=O)c1ccc(-n2cnnn2)cc1	754648863	BFVHHNIRYNBWIP-UHFFFAOYSA-N	448.224	1.271	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(N(C)C)c(NC(=O)NNC(=O)Cc2ccncc2)c1	755434248	LJAIDBPNAAJIRU-UHFFFAOYSA-N	448.549	1.574	50	20	IDGD	
CNC(=O)c1ccc(NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc1	755511210	WZDWGPCYTSEJMD-UHFFFAOYSA-N	445.501	1.297	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)Nc2cc(C)nn2[C@H]2CCS(=O)(=O)C2)cc1	755535772	RIELYNQZYNCXAB-HNNXBMFYSA-N	435.506	1.345	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)Nc2cccc(N3CCCS3(=O)=O)c2)c1	755885025	MEKVBVHDJHSTOH-UHFFFAOYSA-N	434.474	1.710	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2ccc(F)cc2Br)cn1	755902075	GFXVIJRMPWRBCZ-UHFFFAOYSA-N	431.243	1.853	50	20	IDGD	
COCCOCc1cccc(NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c1	755970740	VSJMPRATEUKDIX-UHFFFAOYSA-N	425.445	1.563	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)Nc1ccc(CN2C(=O)CSC2=O)cc1	756301684	XJPDOPJLZDGPRI-UHFFFAOYSA-N	439.453	1.985	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)NNC(=O)COc2ccccc2OC)cc1C	756513908	AIKFVDJPQQDHLG-UHFFFAOYSA-N	436.490	1.997	50	20	IDGD	
CNS(=O)(=O)c1ccc(C)c(NC(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)c1	756528066	UHCYHIYBMPOVGT-UHFFFAOYSA-N	428.474	1.760	50	20	IDGD	
COCCS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)cc1	756548588	AIOJBQPXOJQRNE-UHFFFAOYSA-N	443.485	1.963	50	20	IDGD	
CCCNS(=O)(=O)c1ccc(NC(=O)NNC(=O)COc2ccc(OC)cc2)cc1	756785487	VEPMHOHHWJAQSQ-UHFFFAOYSA-N	436.490	1.615	50	20	IDGD	
CCn1cc([N+](=O)[O-])c(C(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)n1	756831458	RXPCZGLMXPKXTM-UHFFFAOYSA-N	425.446	1.155	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2cc(Br)cn(C)c2=O)cc1OC	757598351	VNQPWWCKZOWRSF-UHFFFAOYSA-N	425.239	1.632	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)Nc1cnn(C(F)F)c1	757868015	ZIKGLAAFPBISJF-UHFFFAOYSA-N	442.448	1.919	50	20	IDGD	
Cc1nn(C)c(C)c1OCC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	758354831	NIKSJGSBNCWYTK-UHFFFAOYSA-N	449.533	1.052	50	20	IDGD	
NC(=O)[C@@H]1CC[C@@H](CNC(=O)NNC(=O)CCCOc2ccc(Cl)cc2Cl)O1	760204891	VUPYNTIMPWRAPV-FZMZJTMJSA-N	433.292	1.516	50	20	IDGD	
O=C(CNC(=O)[C@H]1c2ccccc2C(=O)N1Cc1ccccc1)NNc1ncc(F)cn1	760906141	ICQUNAALHZCHTB-LJQANCHMSA-N	434.431	1.572	50	20	IDGD	
O=C(NNC(=O)c1cc(N2CCCC2=O)ccc1Cl)c1ccc(-n2cnnn2)cc1	761135746	NYJCZERFNGOLHR-UHFFFAOYSA-N	425.836	1.517	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)c1ccccc1OCC(N)=O	761414265	GSRKAEFRIDBXRN-LLVKDONJSA-N	436.262	1.542	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)c1ccc(CCNS(C)(=O)=O)cc1	761447307	AVKLFEKFMHGYOP-UHFFFAOYSA-N	443.529	1.152	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2sccc2S(=O)(=O)N2CCc3ccccc3C2)n[nH]1	763118585	GMPKJDJQTXUSIW-UHFFFAOYSA-N	445.526	1.601	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)ccc1Cl	763439756	QUULIRVUYBVJCC-UHFFFAOYSA-N	449.913	1.741	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2ccc(C(=O)N(C)C)c(C)c2)c1	763665408	IBKGAEFRPZOZIF-UHFFFAOYSA-N	426.473	1.479	50	20	IDGD	
COCCOc1ccc(F)cc1NC(=O)C(=O)NNC(=O)COc1cc(C)ccc1C	763665885	QJYXIYCNCGCNIN-UHFFFAOYSA-N	433.436	1.633	50	20	IDGD	
C[C@H]1CN(c2ccccc2NC(=O)C(=O)NNC(=O)c2cccc(N(C)C)c2)C[C@@H](C)O1	763758640	SPDASOSVYIUFHX-IYBDPMFKSA-N	439.516	1.766	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2cccc(OCCN(C)C)c2)c1	763770923	AWISNFADSGWVSY-UHFFFAOYSA-N	430.461	1.044	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)[C@@H]1CC(=O)N(c2cccc3ccccc23)C1	763821921	ZTOUZCOFUFWZCT-QGZVFWFLSA-N	431.452	1.165	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)C(=O)Nc1cc(F)ccc1OC[C@H]1CCCO1	763838035	LUAQTLBOLNPJIG-MRXNPFEDSA-N	449.410	1.688	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccccc1OC[C@@H]1CCCCO1	763842110	BMAKLOYDHQINSD-KRWDZBQOSA-N	445.447	1.939	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccccc1CN1CCOCC1	763864627	DPJKQMKRSVYFDU-OAHLLOKOSA-N	444.463	1.211	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cnn(-c3ccncc3)c2)ccc1OC(C)C	763922667	YHCBLYOLNQFBMQ-UHFFFAOYSA-N	438.444	1.463	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1OC(C)C	764005617	CNZJIVWYRKHEAX-UHFFFAOYSA-N	429.429	1.653	50	20	IDGD	
CC(C)OCc1cccc(NC(=O)C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c1	764078637	ZBFMUTPUDAAMQE-UHFFFAOYSA-N	433.486	1.415	50	20	IDGD	
COc1ccc(I)c(NC(=O)C(=O)NNC(=O)CC(F)(F)F)c1	764113016	SDHJYRUPNUCKCF-UHFFFAOYSA-N	445.135	1.338	50	20	IDGD	
O=C(CCCc1ccccc1)NNC(=O)C(=O)Nc1ccc(N2CCCS2(=O)=O)cc1	764226169	HSOVCIOLOGDTSO-UHFFFAOYSA-N	444.513	1.335	50	20	IDGD	
CCOC(=O)c1ccn(-c2ccccc2NC(=O)C(=O)NNC(=O)c2scnc2C)n1	764245663	IHFWCFHBFYWIIH-UHFFFAOYSA-N	442.457	1.214	50	20	IDGD	
Cc1nnc(-c2cccc(NC(=O)C(=O)NNC(=O)c3cccc(OC(F)F)c3)c2)n1C	764259145	DFEFKFGVSVRVQW-UHFFFAOYSA-N	444.398	1.792	50	20	IDGD	
O=C(NNC(=O)c1cccc(OC(F)F)c1)C(=O)Nc1cccc(N2CCNC2=O)c1	764259503	JOXGBPUOFIWWRB-UHFFFAOYSA-N	433.371	1.217	50	20	IDGD	
COc1ccc(NC(=O)c2ccc(NC(=O)C(=O)NNC(=O)Cc3cccnc3)cc2)cc1	764268806	QLEMBKIGSXVCDD-UHFFFAOYSA-N	447.451	1.671	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2O)cc1C(=O)NC(C)C	764279210	YPCHXHYYXNSEAO-UHFFFAOYSA-N	428.445	1.004	50	20	IDGD	
CN(c1ccccc1NC(=O)C(=O)NNC(=O)C(C)(C)c1ccccc1)S(C)(=O)=O	764301369	BUGJAKVWRYEVCK-UHFFFAOYSA-N	432.502	1.146	50	20	IDGD	
C[C@@]1(c2ccc(C(=O)NNc3c(F)cc(C(=O)NC4CC4)cc3F)cc2)NC(=O)NC1=O	764334147	IRAACXCIWCEZMT-NRFANRHFSA-N	443.410	1.669	50	20	IDGD	
Cc1cc(NC(=O)[C@H](C)SCC(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)no1	765570246	XULKFVVYHPCMTP-JTQLQIEISA-N	434.503	1.956	50	20	IDGD	
COC(=O)c1ccc(C(=O)NNC(=O)c2cc(-c3ccc(OC)c(OC)c3)[nH]n2)nc1	765597337	RPBPHZAGCFWXOT-UHFFFAOYSA-N	425.401	1.350	50	20	IDGD	
C[C@@H](Cc1ccc(F)cc1)C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765736733	ABLUOUYAVXVRFJ-KRWDZBQOSA-N	426.492	1.610	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1ccc(Br)o1	765737080	VJZIAMPLECHKNR-UHFFFAOYSA-N	435.278	1.261	50	20	IDGD	
CC(=O)c1cccc(OCC(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)c1	766641659	KHRUDXVFHFWXLV-UHFFFAOYSA-N	438.528	1.542	50	20	IDGD	
CC(C)[C@H](C(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1)N1CCCC1=O	766659485	BPCRDWGQLCZHLQ-OAQYLSRUSA-N	449.983	1.252	50	20	IDGD	
COCCC(=O)N1CCC(NC(=O)NNC(=O)COc2cc(C)ccc2C(C)C)CC1	769164835	JLTUAKBQHNUYIN-UHFFFAOYSA-N	434.537	1.855	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)CN1C(=O)N[C@@](C)(c2ccc(F)c(Cl)c2)C1=O	769935160	ANRMROJBUHHUBL-FQEVSTJZSA-N	448.838	1.716	50	20	IDGD	
Cn1ccnc1[C@H](O)[C@@H]1CCCN(C(=O)NNC(=O)c2cccc(Br)c2)C1	770017482	ACVRCLDRATZLCE-UKRRQHHQSA-N	436.310	1.983	50	20	IDGD	
CN(C)c1cnc(C(=O)NNC(=O)c2nc(-c3ccccc3)n(-c3ccccc3)n2)cn1	770467110	WJACTOZAXDIQGS-UHFFFAOYSA-N	428.456	1.865	50	20	IDGD	
Cc1cc(OCc2ccc(C(=O)NNC(=O)Cn3ncn(C)c3=O)cc2)ccc1Cl	770550228	RSLOZMAMOZZIBT-UHFFFAOYSA-N	429.864	1.584	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)N1CCN([C@H](C)C(=O)NC2CC2)CC1	770646458	DTMPYHMAFREKBV-ZIAGYGMSSA-N	437.928	1.133	50	20	IDGD	
COc1ccc([C@@H](OC)[C@H](C)NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1	771906785	XLBQTHMAPOCNQT-UGSOOPFHSA-N	425.449	1.391	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)c1ccc(Cl)c(S(=O)(=O)N(C)C)c1	771941462	SIFBSFKODCSXTF-NSHDSACASA-N	433.914	1.329	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)CCCOc1ccc(I)cc1	772042150	FWMKLKXLYTUOLC-LLVKDONJSA-N	448.257	1.939	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)[C@H](NC(=O)c1ccc(OC)cc1)c1ccccc1	772074838	HGJJMZYTAOKOCU-AUUYWEPGSA-N	427.457	1.655	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)C[C@H](O)c3cccc(F)c3)CC2)cc1	772809143	DKDZFMRISWRULG-NRFANRHFSA-N	428.508	1.523	50	20	IDGD	
Cc1nc(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)ccc1Br	773686822	WSFCLDMKGIMOTF-UHFFFAOYSA-N	431.250	1.129	50	20	IDGD	
COCCOc1c(Cl)cc(NC(=O)C(=O)NNc2nccc(OC)n2)cc1Cl	773727311	VZDIZUYQMRXTDZ-UHFFFAOYSA-N	430.248	1.899	50	20	IDGD	
CC(=O)N1CCN(c2ccc(C(=O)NNc3cnc4ccccc4n3)cc2[N+](=O)[O-])CC1	774774123	BTYKTLKZUQEMDW-UHFFFAOYSA-N	435.444	1.963	50	20	IDGD	
O=C(CN[C@@H](c1ccc2c(c1)OCCO2)C1CC1)NNC(=O)c1ccc([N+](=O)[O-])cc1	776013782	ZJWYSSSIKVHJFK-HXUWFJFHSA-N	426.429	1.868	50	20	IDGD	
CN(NC(=O)c1ccc2c(c1)NC(=O)CS2)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776202603	UYVWIIUMHXZDNF-UHFFFAOYSA-N	449.533	1.980	50	20	IDGD	
CC(C)Cc1cc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc(O)n1	777274259	HYMXATUXZWLBBS-UHFFFAOYSA-N	446.529	1.845	50	20	IDGD	
O=C(NNc1ccccn1)c1cc(S(=O)(=O)N2CCCCC2)ccc1N1CCOCC1	777474457	GUWMZGWLGIFILF-UHFFFAOYSA-N	445.545	1.850	50	20	IDGD	
COc1cc(C=NNC(=O)Cc2cc(O)nc(S)n2)c([N+](=O)[O-])cc1OCC(F)F	778541177	ZMDRPXXHFCZXQE-UHFFFAOYSA-N	443.388	1.724	50	20	IDGD	
C[C@H](NC(=O)CC(C)(C)C)C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	779012724	UYHZJAJQJHUMKM-HNNXBMFYSA-N	439.582	1.007	50	20	IDGD	
COc1cccc([C@@H]2[C@H](NC(=O)NNC(=O)C(=O)Nc3ccccn3)CCN2C2CC2)c1	779400383	NOZUNAIQNJQYGU-IEBWSBKVSA-N	438.488	1.337	50	20	IDGD	
O=C(CC(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1)NCC(F)(F)F	779659651	BETCKIYZQBXYOG-GOSISDBHSA-N	448.445	1.830	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@@H]2CC(=O)N(c3ccc(F)c(C)c3)C2)cc(OC)c1OC	779719951	OXSARAGBYMFJMM-CQSZACIVSA-N	445.447	1.974	50	20	IDGD	
Cc1cc(N2C[C@@H](C(=O)OCC(=O)NNC(=O)Cc3ccccc3C)CC2=O)ccc1F	780182787	VSYVKINDTVZMNV-KRWDZBQOSA-N	441.459	1.729	50	20	IDGD	
Cc1nnc(CNC(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)s1	780896786	KPQQNEQCYNRYCN-UHFFFAOYSA-N	449.496	1.749	50	20	IDGD	
O=C(C[C@H](O)c1ccc(OCc2ccccc2)cc1)NNC(=O)N[C@H]1CCS(=O)(=O)C1	780906651	FKKQZSSVLRFKTR-HKUYNNGSSA-N	447.513	1.207	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2cccc(CN(C)C(=O)C(F)(F)F)c2)nc1	782145143	DVGRUFDJBVBLJZ-UHFFFAOYSA-N	425.367	1.693	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)N2C[C@@H](C(=O)N3CCCCC3)Oc3ccccc32)cc1	783034766	HSKUFEDDYSYHSR-FQEVSTJZSA-N	438.484	1.945	50	20	IDGD	
COCCOc1ccc(C#N)cc1NC(=O)C(=O)NNc1ccc(S(C)(=O)=O)cc1	783071063	IKZNFMQHRZTAAL-UHFFFAOYSA-N	432.458	1.069	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2cc(C3CCCC3)nn2-c2ccccc2)CCS(=O)(=O)C1	783423967	CDIVFFJYNQYANH-NRFANRHFSA-N	445.545	1.666	50	20	IDGD	
Cc1nn(CC(C)C)c(C)c1S(=O)(=O)NNC(=O)c1csc(N2CCOCC2)n1	783805997	LLRGTOVLWDOHPY-UHFFFAOYSA-N	442.567	1.072	50	20	IDGD	
Cc1ccnc(NNC(=O)C(=O)Nc2cc(S(=O)(=O)N(C)C)ccc2OC(C)C)c1	783931223	KZGOGUDIMQXSLN-UHFFFAOYSA-N	435.506	1.509	50	20	IDGD	
COc1cc(C)c(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)cc1OC	784210555	VECIWVMSWUABEB-UHFFFAOYSA-N	448.501	1.535	50	20	IDGD	
CC(C)CCn1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)n1	784216015	MFLYNUQGVSESMX-UHFFFAOYSA-N	434.522	1.452	50	20	IDGD	
Cc1cccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)c1F	784230188	LEYZNGDVGKSQPU-UHFFFAOYSA-N	449.508	1.152	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)cc1O	785614102	PZKAGZFXGLCJBI-UHFFFAOYSA-N	427.892	1.496	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)/C(C#N)=C\c3ccc(O)cc3)CC2)cc1	787440840	PELOZYZCDAVLEF-STZFKDTASA-N	433.512	1.573	50	20	IDGD	
COc1nc(Br)ccc1NC(=O)C(=O)NNC(=O)c1cc(Cl)ccc1O	789584877	STKQWHBEZSNDIS-UHFFFAOYSA-N	443.641	1.611	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)Nc1nc([C@H]2C[C@H]3CC[C@H]2C3)cs1	789731687	IHCHXPDWVORTTL-NEULZYRMSA-N	442.497	1.973	50	20	IDGD	
CCc1nc(NC(=O)C(=O)NNC(=O)c2cc(Br)ccc2O)sc1C	789734917	QSKNRUKOQRYBGC-UHFFFAOYSA-N	427.280	1.882	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccn(CC(F)F)n2)c1	789867842	ZKXGAPURJGHLHK-UHFFFAOYSA-N	429.449	1.254	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)CCn1cnc2sc3c(c2c1=O)CCCC3	790063351	HYOBVUABAKPYOO-UHFFFAOYSA-N	436.534	1.664	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)CCc2ccccc2O)cc(Cl)c1F	792268334	MABHNHIIOUXKMQ-UHFFFAOYSA-N	437.811	1.690	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)Nc1ccc2ccn(C)c(=O)c2c1	793022597	YMATZGHTEIDUMM-UHFFFAOYSA-N	446.261	1.039	50	20	IDGD	
COCCNC(=O)c1cccc(S(=O)(=O)NNC(=O)Cn2ccc3ccccc32)c1	795315022	QXJRDPCJHDHHGV-UHFFFAOYSA-N	430.486	1.027	50	20	IDGD	
O=C1NC(=O)C2(CCC(C(=O)NNc3cc([N+](=O)[O-])ccc3Br)CC2)N1	800617512	IISVDEPCXOFGPB-UHFFFAOYSA-N	426.227	1.569	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cn(-c3ccccc3Br)nn2)cc1	801107090	LYAIXLVLZUAPAI-UHFFFAOYSA-N	443.261	1.738	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H](c2cnn(C)c2)N(C)C(=O)OC(C)(C)C)cc1	801111373	PGCIJFUPGJMBJS-INIZCTEOSA-N	444.492	1.423	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)CCN2CCN(C(=O)[C@H]3CCCO3)CC2)c(Cl)c1	802047571	CUHRXEPZTOBRFO-QGZVFWFLSA-N	437.928	1.514	50	20	IDGD	
COc1ccc(C2=NO[C@H](CNC(=O)NNC(=O)c3cc(OC)cc(OC)c3)C2)cc1	802370198	DSOPTKCUICLFFT-SFHVURJKSA-N	428.445	1.850	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNc2cccc([N+](=O)[O-])c2)(S(C)(=O)=O)CC1	802823661	ZCZAUEXJKCNSTC-UHFFFAOYSA-N	442.494	1.852	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)[C@H]1CSCN1C(=O)c1ccc(Cl)cc1	804952355	NCOIKOJADSTNJH-CQSZACIVSA-N	429.893	1.974	50	20	IDGD	
Cc1cc([N+](=O)[O-])ccc1NNC(=O)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(F)cc1	805378370	PIZLMYGOJGKTNQ-PBHICJAKSA-N	438.437	1.310	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1cc(C(F)(F)F)ccc1Br	806505296	XQHSZVLZFJIWLK-LURJTMIESA-N	447.233	1.558	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)Nc2ccc(F)c(N3C(=O)CCC3=O)c2)c1	806743703	WMHNCMCXBZPLDA-UHFFFAOYSA-N	428.380	1.299	50	20	IDGD	
CN1CCN(C(=O)NNC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)OC(C)(C)C)CC1	807381704	FGJVQOCLQVOZIC-SFHVURJKSA-N	444.536	1.592	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)CNS(=O)(=O)c2cccc(C(F)(F)F)c2)c1O	810190843	AIHNBCTWTVESLX-UHFFFAOYSA-N	447.391	1.159	50	20	IDGD	
Cc1cc(C(F)(F)F)ncc1NC(=O)C(=O)NNC(=O)c1cc([N+](=O)[O-])ccc1O	810398792	PHOXKSRPHJHIJJ-UHFFFAOYSA-N	427.295	1.422	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)CNS(=O)(=O)c2c(C)c(C)cc(C)c2C)c1	810662145	BLUZYSVVTSEPSW-UHFFFAOYSA-N	447.517	1.013	50	20	IDGD	
CC[C@@H]1[C@@H](C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)CCN1C(=O)OC(C)(C)C	811300373	GBDHKAFRJSHGJL-DLBZAZTESA-N	444.488	1.898	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)N[C@@H]2CCC[C@H]3CN(C(C)=O)C[C@H]32)cc1	812433243	IWTYXCIJSZVQNV-HIBPSGHXSA-N	432.521	1.830	50	20	IDGD	
CC(=NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1)c1ccc(N2C(=O)CCC2=O)cc1	814214857	IVNJUZRVMDVBDY-UHFFFAOYSA-N	448.888	1.795	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cc(C#N)cc(N(C)C)c2)cc1	814364316	YDUCYUZDNOYXBI-UHFFFAOYSA-N	429.502	1.014	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1cn(Cc2ccccc2)nn1	815566532	XIJQBIQGMNAIPR-CYBMUJFWSA-N	426.408	1.019	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(C)c(S(=O)(=O)C3CCCC3)c2)n[nH]1	815568441	HQNHTHJJUQDZHD-UHFFFAOYSA-N	433.490	1.143	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)COCc2ccccc2)nnn1Cc1ccccc1F	815569693	DCKXOIRUIXAUKE-UHFFFAOYSA-N	440.435	1.077	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)N(C)C)cccc1-c1ncco1	815751758	NJFFXKFNIVRCDX-UHFFFAOYSA-N	443.485	1.982	50	20	IDGD	
O=C(CC1CC1)NNC(=O)c1cc(I)ccc1N1CCOCC1	819131328	ASNPZFSEDOECGK-UHFFFAOYSA-N	429.258	1.689	50	20	IDGD	
CN(C)[C@@H](CNC(=O)NNC(=O)c1nn(-c2ccccc2)cc1O)c1cccc(F)c1	838523661	ZLQUHYMYBKAKLH-KRWDZBQOSA-N	426.452	1.964	50	20	IDGD	
O=C(CSCC(=O)N1CCOCC1)NNC(=O)c1cc2c(s1)CCCCCC2	849200261	VEDVAKGDMWOIKR-UHFFFAOYSA-N	425.576	1.760	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)O[C@@H](C)C(=O)N2CCN(C(C)=O)CC2)c1C	853510750	RTABYUFBFPSVPS-NNIWKIFQSA-N	430.505	1.281	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)N2CCN(S(=O)(=O)N(C)C)CC2)c(C)n1C[C@@H]1CCCO1	914504005	IMKXNBOMDQYZEW-ACSPXDACSA-N	449.577	1.142	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)c2ccccc2S(=O)(=O)C(F)(F)F)cc1	915438934	GFZCKDLXFHMOMA-UHFFFAOYSA-N	444.387	1.907	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)CSCC(=O)NNC(=O)c2ccc(CC)cc2)cc1	915813903	KWPWAVOEOSIGHB-UHFFFAOYSA-N	442.541	1.767	50	20	IDGD	
COc1ccc([C@H](CNC(=O)NNc2cncc(Cl)n2)N2CCOCC2)cc1OC	915894556	DBCIMBZXPCIJFY-AWEZNQCLSA-N	436.900	1.847	50	20	IDGD	
C[C@H]1CN(c2ccccc2C=NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)CCO1	915944751	JAJOHNHRXGTIFZ-INIZCTEOSA-N	430.530	1.926	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NN=C1C(=O)Nc2cc(N3CCOCC3)ccc21	915948443	LQUVEHGVNNCNIH-UHFFFAOYSA-N	425.401	1.283	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2cc(-c3cccc(F)c3)no2)ccc1Cl	916133455	PZUBYAFPSMYAFS-UHFFFAOYSA-N	438.824	1.856	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCCCCN2CCC[C@@H](C)C2)c2ccccc2c1=O	916503936	KKHNRLJAFSLDHV-MRXNPFEDSA-N	428.537	1.873	50	20	IDGD	
O=C(COC(=O)CCc1ccc2ccccc2n1)NNC(=O)[C@@H]1COc2ccccc2O1	917236629	REFYHLQVFWHADG-FQEVSTJZSA-N	435.436	1.698	50	20	IDGD	
NC(=O)C1CCN(C(=O)C2CCN(S(=O)(=O)c3ccc(CCCl)cc3)CC2)CC1	917908573	NSTKFIHVIGVKHH-UHFFFAOYSA-N	441.981	1.593	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@@H](C)C(=O)NNC(=O)CN(C)C(=O)[C@@H](C)n1cccn1	918688773	DRPIRJGYMUVLBT-CABCVRRESA-N	435.912	1.788	50	20	IDGD	
CCCS(=O)(=O)N1CCCC[C@@H]1C(=O)OCC(=O)NNC(=O)c1cccc(Cl)c1	919475625	UHKIRGPPTOUKPW-OAHLLOKOSA-N	445.925	1.239	50	20	IDGD	
COC(=O)N1CCC(NC(=O)NNC(=O)COc2ccc(Br)cc2)CC1	920051335	HPGRLCDXAQLKPA-UHFFFAOYSA-N	429.271	1.389	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)N[C@@H]2CCCN(S(C)(=O)=O)C2)c(C)n1-c1ccccc1	920238711	JKBORGMCANAODK-MRXNPFEDSA-N	433.534	1.462	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)NCC2(c3ccc4c(c3)OCO4)CCOCC2)n1	920286427	YSUYAXDOZPQNPD-UHFFFAOYSA-N	429.477	1.307	50	20	IDGD	
CCOC(=O)C1CCC(NC(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)CC1	921122744	NANHLGIFBJNUHW-UHFFFAOYSA-N	427.527	1.516	50	20	IDGD	
COCCOc1ccc(S(C)(=O)=O)cc1NC(=O)NNC(=O)c1ccc(OC)cc1	1259131901	ZRVQMZRLUJYLFM-UHFFFAOYSA-N	437.474	1.590	50	20	IDGD	
CCS(=O)(=O)N[C@@H](CCSC)C(=O)NNC(=O)c1ccc(Br)cc1	1318314587	SMQQXEMDDAURDJ-LBPRGKRZSA-N	438.369	1.271	50	20	IDGD	
Cc1ccc(CNC(=O)NCC(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1	1318569899	VTEPMHFQOFYNGR-UHFFFAOYSA-N	447.536	1.589	50	20	IDGD	
O=C(NNS(=O)(=O)c1cccc(I)c1)c1n[nH]c2c1CCCC2	1318647239	PHIPQGOGHSDTJO-UHFFFAOYSA-N	446.270	1.516	50	20	IDGD	
O=C(COc1ccc(OCc2ccccc2)cc1)NNC(=O)NCC(=O)N1CCCC1	1318667373	KPGZVHXQGBMAOB-UHFFFAOYSA-N	426.473	1.597	50	20	IDGD	
O=C(NNC(=O)c1cncn1-c1ccccc1)c1sccc1S(=O)(=O)N1CCCC1	1337197307	MXFQQIVSCPXTFV-UHFFFAOYSA-N	445.526	1.793	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2nc[nH]c2[N+](=O)[O-])C1	1778062140	IXBPIHVWGYGESG-SSKCKEOISA-N	448.307	1.682	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnn4cccnc34)C2)C1	1778444972	AFCZHMXTQNAJBI-RDTXWAMCSA-N	436.310	1.346	50	20	IDGD	
COc1cnc(C(=O)N2CCO[C@@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)c(F)c1	1779296599	VDKJBDYHBUREDH-LJQANCHMSA-N	425.533	1.524	50	20	IDGD	
C[C@@H](Cn1cncn1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CO[Si](C)(C)C)C1	1779545374	HDHUBUJVRARNSG-SQGPQFPESA-N	437.617	1.280	50	20	IDGD	
CCOC(=O)c1cc(C(=O)N2CC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)ccn1	1780323579	LOUJBGSNYWFFMT-GOSISDBHSA-N	430.288	1.506	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)Cc2c(C)n[nH]c2C)C1	1780828611	NIEWWPSFLYHOCN-MBOZVWFJSA-N	426.945	1.337	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)C3(N4CCN(C)CC4)CC3)C2)C1	1781106347	PVOBANHNPJBKGC-PXNSSMCTSA-N	426.989	1.004	50	20	IDGD	
COc1ccnc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](F)Br)C3)C2)c1OC	1781333156	DPHGAJIMSVJNKT-WMLDXEAASA-N	446.273	1.233	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(Cl)Cl)C2)c1ccc2nn[nH]c2c1	1781442840	MNPKPPDBKHMDOH-RDTXWAMCSA-N	426.304	1.889	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccccc3-n3nccn3)C2)C1	1781840491	VFTGRKQTPDJONU-KUHUBIRLSA-N	448.321	1.494	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(=O)c1ccco1)C2	1781997438	WHZNBLXMPRAANV-RVZJWNSFSA-N	427.295	1.760	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CSc1ncccn1)C2	1782170815	ZIXBQOAPFNCMTG-QMTMVMCOSA-N	442.969	1.336	50	20	IDGD	
O=C(c1cnc2c(F)c(F)ccc2c1)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1782467681	LQWQDIBUKKXWMQ-YWZLYKJASA-N	439.846	1.556	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cn(C)nc3C(F)F)CCO2)C1	1783533948	CBMAWWXGZOTYDC-HWPZZCPQSA-N	435.269	1.585	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cnnc4ccccc34)CCO2)C1	1783534567	LRKGVHMUFWDCRI-DJJJIMSYSA-N	433.306	1.857	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)COc3ccccc3C#N)CCO2)C1	1783535922	BUWYPPSIUHIIFM-KUHUBIRLSA-N	436.306	1.550	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(Cl)nc4n[nH]cc34)CCO2)C1	1783875721	PLCKRVKLKRRVAT-UGSOOPFHSA-N	442.303	1.309	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)Cc3ccc([N+](=O)[O-])cc3F)CCO2)C1	1783881797	MWHBIYVBEBJCOL-KXBFYZLASA-N	443.859	1.360	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3cnccn3)[C@H]2C1	1784249955	QAQHUYCSWGJTEK-HNKHHVNMSA-N	425.327	1.172	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CSc3ncccn3)C[C@@H]21	1784617813	DRZIEDVJKSIIBY-JONQDZQNSA-N	426.970	1.956	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnn(C(C)(C)C)c3)[C@H]2C1	1785621358	VYMWCASYSBBNRE-HJWJTTGWSA-N	426.945	1.485	50	20	IDGD	
CC(=O)O[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCBr)[C@H]2C1)C(C)C	1786406831	JKKNIMUJZNHJTI-JKQORVJESA-N	433.343	1.339	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C[C@H](N)c3cccnc3)[C@H]2C1	1786932080	RAMINNYXKUHQGV-SRQBIAJPSA-N	439.354	1.235	50	20	IDGD	
CCn1nc(C)cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21	1787289538	DKDGGHUDIKJUBW-JURCDPSOSA-N	431.306	1.495	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3n[nH]c4c3CCCC4)[C@H]2C1	1787316307	SOVYHHFWRRLOJD-DSPQJCBJSA-N	439.354	1.665	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(OC)ccn3)[C@H]2C1	1788892490	BJOMZGKYPWRGCS-QEWYBTABSA-N	440.338	1.857	50	20	IDGD	
COc1ccnc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)Br)C[C@@H]32)c1	1788892809	VISSUWLKHNYCGL-DUPGQFARSA-N	426.311	1.467	50	20	IDGD	
Cc1nc[nH]c1C(=O)NC1(c2ccc(NC(=O)c3cnccc3C(=O)NN)cc2)CCC1	1789521484	LLFZWXQCWZOQOK-UHFFFAOYSA-N	433.472	1.778	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4ncccn4n3)C[C@@H]21	1789867985	KOKZPHULYFXPIB-NGOJXBLDSA-N	440.331	1.559	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]3C2)c(C)n1C	1789924863	ZSVZHPFGNHUQGU-QCEMKRCNSA-N	430.318	1.926	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1(c2ccc(NC(=O)Cn3nccn3)cc2)CCC1	1790575896	GICFCQDIAKAJQC-RWPZCVJISA-N	448.487	1.546	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)N3C[C@@H]4C[C@H]4C3)C[C@@H]21	1790961245	XOUHJYZOYQNHCO-GOMYCMKKSA-N	442.398	1.480	50	20	IDGD	
CCN(CC)C[C@@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]2C1	1791063102	ACOHJPVBPSBKLP-NRKLIOEPSA-N	432.403	1.727	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccn(C(F)F)n1)C2	1792871168	QHRHAMMUKRTJMK-HNCHTBHHSA-N	435.269	1.512	50	20	IDGD	
C[C@H](Oc1cccnc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCBr	1795116881	CILBNTVFPYINEX-ZJOBFFGXSA-N	426.311	1.224	50	20	IDGD	
C[C@@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2)n1cccc1C=O	1795749273	XEAWXJWBMNJLLS-ZJOBFFGXSA-N	426.311	1.236	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1[nH]nc2ccncc12	1796210449	AXKWRRRTLMCIBM-OHTBPHCPSA-N	436.310	1.192	50	20	IDGD	
Cc1cccc(C)c1SCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2	1797948570	SOLSFLAOKCAMSJ-DFGXFYAUSA-N	426.966	1.585	50	20	IDGD	
Cn1cc2cc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)CO[Si](C)(C)C)ccc2n1	1797957373	MOVVKSREXJINEZ-XEMDLRDOSA-N	430.581	1.628	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc(F)c1F)C2	1798441988	RBXNOWDEBZDSLY-CLLJXQQHSA-N	429.427	1.529	50	20	IDGD	
COc1cc(C)cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Br)c1	1799348680	MHTWEDCMZQSNOA-XRGAULLZSA-N	429.286	1.897	50	20	IDGD	
COc1cnc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)Br)c(F)c1	1800757633	HLPGUZHDORJTHW-NJBDSQKTSA-N	430.274	1.216	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(Cl)c(O)cc1O)C2	1800976966	DZOKCWVBQMKGNN-SKILGCBUSA-N	433.288	1.208	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(=O)Nc1c(C)cccc1C)C2	1800976973	FEGGOHMDSQDBNF-DFGXFYAUSA-N	437.924	1.085	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/c1ccc(O)cc1Cl)C2	1800981819	SYSODLYWXYOKLT-FTBITFSUSA-N	443.327	1.902	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C(Cl)Cl)cc1O	1801016763	ODULBWBRVSGXIZ-JJLQDPRZSA-N	430.288	1.358	50	20	IDGD	
O=C(CCc1cncc(C(F)(F)F)c1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2	1801232396	KAWQNWVSQLSXHW-IARIHHJXSA-N	449.857	1.222	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCCn1ccnc1	1801303832	QRKMJKMUDQMFJT-PNBKFKSVSA-N	427.343	1.284	50	20	IDGD	
COC[C@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc(N3CCOCC3)n1)C2	1802274507	YWDQNVAEEWWNRX-YVSFHVDLSA-N	436.940	1.424	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C[C@@H]1COc3ccccc3O1)C2	1802333872	DHUZEFMNTUTXPQ-XMTFNYHQSA-N	444.532	1.228	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H]1C[C@@H]1c1ccc(F)cc1)C2	1802334863	QPXXGELPQVMMDO-USYVTKNRSA-N	430.524	1.940	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)[C@@H]2C[C@H]2C2CC2)[C@H]1c1cccnc1	1802989168	OGGHDAJSBYMRQL-WQZMEWCLSA-N	448.527	1.446	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H]2Cc3ccccc3N2)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803148644	VUMSNSTYJYCXDN-FRYIKTPZSA-N	428.920	1.724	50	20	IDGD	
CC[C@H](C)CC(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1	1803365048	JORLCCWYWOGEAB-HZUJVAHNSA-N	438.532	1.836	50	20	IDGD	
COC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1	1806372054	MPABMGYUAGOVCV-KSSFIOAISA-N	426.311	1.826	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC2(CCCN(C(=O)c3cc4n(n3)CCNC4=O)C2)CC1	1808819557	SARGSUZCZSBFOK-UHFFFAOYSA-N	447.612	1.323	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)c1cccn2cncc12	1809990711	BHLRROHENSCKBA-ZYSHUDEJSA-N	427.892	1.649	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)COc2cccnn2)[C@@H]1c1cccnc1	1812868242	VTGBLSJKUXHNSL-JCKWVBRZSA-N	448.321	1.740	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2cn3cccnc3n2)[C@@H]1c1cccnc1	1813029899	ALGZYWVUTLEAOB-SOLBZPMBSA-N	442.907	1.698	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)COc2ccc(O)nn2)[C@@H]1c1cccnc1)C(Cl)Cl	1813081151	JHCVLCDITRBVQB-BLLLJJGKSA-N	440.287	1.466	50	20	IDGD	
CN(C)C(=O)NCC(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@](C)(Cl)CCl)[nH]n1	1814564194	XBGMMWXVWWAWKP-PXAZEXFGSA-N	433.340	1.909	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@H]2[C@H]3SC=C[C@H]32)[nH]n1)c1cccc(B(O)O)c1	1817476847	FDJOGIIDTGGBFN-WQCNXYOZSA-N	438.318	1.271	50	20	IDGD	
CCN(C)[C@H](C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819404103	YMSXZAQSUIDJPR-DYVFJYSZSA-N	442.524	1.054	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2n[nH]cc2[N+](=O)[O-])n[nH]1	1819659750	BEKSNOHYLMDROG-MWLCHTKSSA-N	425.833	1.601	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1	1819801080	YLQFDAOJKVODCU-CABZTGNLSA-N	436.925	1.385	50	20	IDGD	
C[C@H](Cn1cncn1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCBr)CC2	1820066297	MIYGHUFLEHYNOI-MNOVXSKESA-N	441.355	1.768	50	20	IDGD	
Cn1ccc(=O)cc1C(=O)N[C@@H]1CCc2nc(NC(=O)CO[Si](C)(C)C)sc2C1	1820166871	PFZDPRLRIRGMRX-GFCCVEGCSA-N	434.594	1.919	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1ccc(O)cc1	1820579053	XLLWSOPVFBHHQJ-IBGZPJMESA-N	434.261	1.415	50	20	IDGD	
CC[C@@H](Br)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CN2CCOCC2)[nH]n1	1822088481	WRCDNTLFJMUUFF-UKRRQHHQSA-N	442.358	1.908	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCc1nc(N)n[nH]1)CC2	1822867592	JTAHXTGDDQFTKL-PWJLMRLQSA-N	446.364	1.625	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)CCc2ccccn2)CC1	1825331437	WDQCVZVPLNCHKV-HSZRJFAPSA-N	449.360	1.628	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC([C@H]2CCCCN2C(=O)CC[C@@H](N)C(N)=O)CC1	1826931476	GOAAWCPZSXXSTH-FVQBIDKESA-N	445.402	1.230	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@H]2CCCO2)CC1	1827244373	IJYOFTAASBXBNC-RTBURBONSA-N	429.521	1.097	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H]2CCCOC2)CC1	1828925581	LWMFOLAYHFQPQU-XLIONFOSSA-N	443.548	1.345	50	20	IDGD	
Cc1[nH]ccc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2	1830538361	DAUMJWANWNJZOL-SCLBCKFNSA-N	428.327	1.424	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4nncn4c3)C2)C1	1831652312	YJYACENKIMVCGP-UZLBHIALSA-N	435.912	1.207	50	20	IDGD	
C[C@@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCBr)CC1)n1cnnn1	1832284974	KFLFTWRJDDHDMP-DZGCQCFKSA-N	427.347	1.639	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3nc(Cl)ccc3F)CC2)CC1)[C@@H](O)CCl	1833308296	QEPNIMGMEGQFSB-HNNXBMFYSA-N	447.338	1.659	50	20	IDGD	
CC(C)N1CCC[C@H]1C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)CCl)CC2)CC1	1833313043	ROMPACNJYGRBHB-RBUKOAKNSA-N	429.005	1.031	50	20	IDGD	
Cc1nscc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)Br)C2)C1	1833748706	IMDOMBDOYWUEIS-MEDUHNTESA-N	432.340	1.305	50	20	IDGD	
Cc1noc(C)c1C(=O)N1CCO[C@]2(COCCN(C(=O)CCBr)C2)C1	1834063046	YJAKNHQKPTYFOG-KRWDZBQOSA-N	430.299	1.146	50	20	IDGD	
Cc1ncsc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1834267669	FLAOTQPDCMXONP-DOMZBBRYSA-N	436.303	1.212	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCC(N2CCC(NC(=O)CN)CC2)CC1	1834671388	HPKOMHYQVKPOJE-LFIBNONCSA-N	431.487	1.402	50	20	IDGD	
CC(C)N[C@@H](C(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1)C(C)C	1835893056	PQLXNWHKDCHMDE-DYESRHJHSA-N	432.005	1.730	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3cc(O)no3)CC2)CC1	1835977419	RGGWGZDWRSAPIG-LLVKDONJSA-N	429.315	1.349	50	20	IDGD	
CC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)c3n[nH]cc3[N+](=O)[O-])CC2)CC1	1836396517	AABSMYOSAMJVIJ-AWEZNQCLSA-N	426.905	1.521	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@H](C)n3ccnc3)CC2)CC1	1836779968	JQSOSBNQGXAQGB-YJBOKZPZSA-N	426.945	1.697	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCC(OC2CCN(C(=O)[C@@H]3CCNC(=O)C3)CC2)CC1	1838637959	LVURUEPLKHQLPV-JLTOFOAXSA-N	448.391	1.748	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(F)cc(F)c3)CCO2)C1	1839003387	FJNMPLMGCQGWHI-LPHOPBHVSA-N	432.851	1.289	50	20	IDGD	
Cc1cc(C)nc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)c1	1839199911	ZLJWZFCYACQCNO-MAUKXSAKSA-N	444.301	1.459	50	20	IDGD	
C=CCC(F)(F)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1839889646	HBMIICYWPWWSOT-RISCZKNCSA-N	429.233	1.345	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(F)ccc3F)C2)C1	1840034163	BVXRJRKSODFMNO-KPZWWZAWSA-N	447.276	1.818	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(C)c(O)c3)C2)C1	1840154791	GYSPVMVPPMRDNH-JXFKEZNVSA-N	426.897	1.024	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(C)c(O)c3)C2)C1	1840154794	GYSPVMVPPMRDNH-UZLBHIALSA-N	426.897	1.024	50	20	IDGD	
O=C(c1onc2ccccc12)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840189782	LMKHXQSEQMRSFY-SFHVURJKSA-N	428.272	1.702	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCCCCC(=O)OC)CCO2)C1	1840233925	CTLXNKHMOWYICD-LAUBAEHRSA-N	446.972	1.974	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCn3nc(C)cc3C)CCO2)C1	1840347824	ZDJWIAQLUHEFPM-XLIONFOSSA-N	426.945	1.364	50	20	IDGD	
CCn1ccc(C(=O)N2CC3(CCCN3C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)n1	1841924214	JRDBSQHZODHVJP-HNNXBMFYSA-N	439.944	1.852	50	20	IDGD	
C[C@H](Br)C(=O)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1	1843442786	WTKZSJTVQPYPBO-ZDUSSCGKSA-N	433.306	1.766	50	20	IDGD	
CC(C)(C)OC(=O)NCCOCC(=O)N1CC2(CCCN2C(=O)CO[Si](C)(C)C)C1	1844378933	YGEMVNPUZWOKKF-UHFFFAOYSA-N	443.617	1.583	50	20	IDGD	
C=CCC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)[C@@H](O)CCl)C2	1845198988	WWVMFXFBWFNLPY-CABCVRRESA-N	429.945	1.649	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCCC12CN(C(=O)c1cn3[nH]cnc(=O)c3c1C)C2	1846071474	VQYYVDDVCJGNGO-CYBMUJFWSA-N	436.310	1.322	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC12CN(C(=O)COCCNC(=O)OC(C)(C)C)C2	1846178293	OFJWFIDYRXXNTP-CYBMUJFWSA-N	448.358	1.515	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)C1=NO[C@@H](c3ccccc3)C1)C2	1846384971	GGZRDLZVEWILST-GOSISDBHSA-N	427.505	1.080	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)/C=C/c1ccc(F)cc1F	1847985360	XYGMQPMZYBUIMD-OYLHTMGSSA-N	441.438	1.492	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)Cc2c(C)nc3nc(N)nn3c2C)cc1OC	12696972	NJSVXZYYXFFZAF-UHFFFAOYSA-N	427.465	1.124	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CCc2c(C)[nH]c(=O)c(C#N)c2C)cc(OC)c1OC	15662815	XAXKNYCKLOEVNR-UHFFFAOYSA-N	428.445	1.283	50	20	IDGD	
C[C@H](Oc1ccc(Cl)cc1)C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	16073157	LPHZCXJGFPEWLO-VIFPVBQESA-N	432.285	1.869	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)CCNS(=O)(=O)c2cc(C)ccc2C)c1	17202770	JVIFKJXPYWNHRR-UHFFFAOYSA-N	433.530	1.815	50	20	IDGD	
COc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NNC(=O)COc2ccc(C)c(C)c2)cc1	17238753	ZZTAYCXPVUYXCV-HNNXBMFYSA-N	435.502	1.205	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@H](C(=O)NNC(=O)COc2ccc(F)cc2)C(C)C)cc1	18101305	ZYYRPXMQFVLTKI-IBGZPJMESA-N	437.493	1.663	50	20	IDGD	
COc1ccc(-c2nnc(SCC(=O)NNC(=O)c3ccc(F)cc3)n2N)cc1OC	21229813	CPJWMGHXKSRUSS-UHFFFAOYSA-N	446.464	1.369	50	20	IDGD	
CCOC(=O)N1CCC(C(=O)NNC(=O)c2ccc(CSc3nncn3C)cc2)CC1	21290862	DSHLCIBZTFGSEB-UHFFFAOYSA-N	446.533	1.737	50	20	IDGD	
O=C(NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)Nc1cccc([N+](=O)[O-])c1	24238505	CUEXZPDYMJVKLH-UHFFFAOYSA-N	433.446	1.846	50	20	IDGD	
Cc1ccc([C@]2(C)NC(=O)N(CC(=O)NNC(=O)c3cc(-c4ccccc4)on3)C2=O)cc1	27264750	ATSLJTPZIAZJFH-QHCPKHFHSA-N	447.451	1.878	50	20	IDGD	
Nc1c(C(=O)OCC(=O)NNC(=O)c2ccccc2)ccc2c1C(=O)c1ccccc1C2=O	104577679	PYEBZHSVXHQPRR-UHFFFAOYSA-N	443.415	1.662	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1cc(C)cc([N+](=O)[O-])c1N	727899784	MRYMTMNPUWRTQJ-UHFFFAOYSA-N	436.808	1.765	50	20	IDGD	
CC/C=C(/C)C(=O)N1CSC[C@@H]1C(=O)NNC(=O)c1cc(OC)c(OC)c(OC)c1	727982490	HZCCKXFDJIDTOR-YRBHFNIASA-N	437.518	1.731	50	20	IDGD	
COc1cccc([C@@H](C)C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)c1	728216337	WTJFVLILHXIIPH-MRXNPFEDSA-N	432.546	1.878	50	20	IDGD	
Cc1cccc(N2C(=O)N[C@H](CCC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)C2=O)c1	730734594	DTTWYTCMNDDJOZ-MRXNPFEDSA-N	425.401	1.569	50	20	IDGD	
Cc1cccc(N2C(=O)N[C@@H](CCC(=O)NNC(=O)[C@@H]3COc4ccccc4O3)C2=O)c1	730740305	BVUFKHVYAHLMQV-YJBOKZPZSA-N	438.440	1.187	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNS(=O)(=O)c1ccc2c(c1)C(=O)NC2=O	731594920	OXRVQVDMYATAKJ-UHFFFAOYSA-N	442.478	1.625	50	20	IDGD	
O=C(NCc1ccc(F)cc1)c1nccnc1C(=O)NNc1nc(-c2ccncc2)no1	732065577	PRFZMLZUKMKRMV-UHFFFAOYSA-N	434.391	1.748	50	20	IDGD	
Cc1c(NC(=O)[C@H](C)SCC(=O)NNC(=O)C2CCC2)c(=O)n(-c2ccccc2)n1C	732142942	NHKKBUDEDPZEHH-AWEZNQCLSA-N	445.545	1.492	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)CCC(=O)N(CCC#N)c2ccccc2)C[C@@H](C)O1	732261503	NBDPIDLPAJAJDK-HDICACEKSA-N	429.521	1.360	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)N[C@H](Cc1ccccc1)CN1CCOCC1	732476736	UZRABALVUZZEQL-LJQANCHMSA-N	430.480	1.478	50	20	IDGD	
Cc1ccc(C(=O)N2CCC[C@@H](C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)C2)cc1	734241350	NCOIDHTWYAKASJ-QGZVFWFLSA-N	447.536	1.702	50	20	IDGD	
C[C@@H]1Oc2ccccc2O[C@H]1C(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	734824504	AQPNNDKBPWTOTL-SUMWQHHRSA-N	434.493	1.945	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)c3cnn(C)c3)cc2)cc1	735470587	CNCCCXAWWCONJV-UHFFFAOYSA-N	441.469	1.498	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)N[C@@H](C)C(=O)N2CCCC[C@H]2C)nc1	737047780	OFZAHANHXBEGRV-CABCVRRESA-N	440.570	1.528	50	20	IDGD	
C[C@@H]1CCC[C@@H](NC(=O)CN2CCN(C(=O)NNC(=O)COCc3ccccc3)CC2)C1	738497451	VUXMJQBRPYORBN-UYAOXDASSA-N	445.564	1.257	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNS(=O)(=O)c1ccc2ncccc2c1	740705933	QFOBVTBUMNPUPQ-UHFFFAOYSA-N	433.515	1.460	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)c2cc(C)c3c(O)nc(O)nc3n2)cc1	740749114	LZXSXGWBVSTPCO-NSHDSACASA-N	427.417	1.372	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(CC(=O)NNc2ccc(Cl)cc2[N+](=O)[O-])C(=O)C1	741212148	HETQBAUTBCXVMX-UHFFFAOYSA-N	427.845	1.771	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)COc1ccccc1F)[C@@H]1CN(Cc2ccccc2)CCO1	741266315	JDXAQVNQPCYFTQ-UZLBHIALSA-N	430.480	1.824	50	20	IDGD	
Cn1nnnc1-c1cccc(S(=O)(=O)NNC(=O)CC23CC4CC(CC(C4)C2)C3)c1	742025143	JDCDHSYMXQASFD-UHFFFAOYSA-N	430.534	1.793	50	20	IDGD	
Cc1noc(-c2ccccc2C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)n1	742035902	ALBQCSORAPCIPB-UHFFFAOYSA-N	428.474	1.721	50	20	IDGD	
Cc1nn(C)c(C)c1C[C@@H](C)C(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	742075972	FNZQRJVERFILNF-CYBMUJFWSA-N	436.557	1.945	50	20	IDGD	
CC(=O)N1CCc2ccccc2[C@@H]1CC(=O)OCC(=O)NNC(=O)c1ccc(C#N)cc1	744522065	BPNFOHXFPVMUEK-FQEVSTJZSA-N	434.452	1.398	50	20	IDGD	
CCN1CCN(C[C@H](C)CNC(=O)NNC(=O)c2ccc(F)cc2Br)CC1	745863867	YPVAVTQFTQAZSE-CYBMUJFWSA-N	444.349	1.806	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)c(NS(C)(=O)=O)c2)cc1C	747234323	POMXOYNBLNEQKU-UHFFFAOYSA-N	438.893	1.728	50	20	IDGD	
CC(=NNC(=O)Cc1ccncc1)c1ccc(S(=O)(=O)N(C)CCCC(=O)O)cc1	747645644	GNKATXBPCMLDMB-UHFFFAOYSA-N	432.502	1.650	50	20	IDGD	
COc1cc(CCNC(=O)NNC(=O)[C@H]2Cc3ccccc3O2)c([N+](=O)[O-])cc1OC	748342108	PVXLUOSZNLCFPI-GOSISDBHSA-N	430.417	1.489	50	20	IDGD	
NS(=O)(=O)c1ccc2c(c1)oc(=O)n2CC(=O)NNc1ccc(OC(F)(F)F)cc1	748502136	RFOUORSLVDJOTA-UHFFFAOYSA-N	446.363	1.284	50	20	IDGD	
Cc1cscc1C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	749309354	YVBCGZHUSQOALL-UHFFFAOYSA-N	437.543	1.471	50	20	IDGD	
C[C@@H](C(=O)OCC(=O)NNC(=O)c1ccc(Cl)cc1)N1C(=O)[C@H]2CCCC[C@@H]2C1=O	750280448	PRUWPMQWSVLOKS-CQDKDKBSSA-N	435.864	1.208	50	20	IDGD	
CCc1cc(NNC(=O)c2ccc([C@]3(C)NC(=O)NC3=O)cc2)nc(-c2ccccn2)n1	751068788	WJTHNYJQRQAVBX-QFIPXVFZSA-N	431.456	1.913	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)c2sccc2S(=O)(=O)NCc2ccco2)cc1	751396340	CJPIHKMILZNBTR-UHFFFAOYSA-N	430.467	1.766	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)c1nc(C2CCCCC2)no1	753000793	IUPUNOBRPWBDPV-LBPRGKRZSA-N	425.453	1.798	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(NC(=O)NNC(=O)Cc2cc[nH]n2)ccc1Cl	755431152	HEBHBFJAPMQYBF-UHFFFAOYSA-N	428.902	1.489	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2cc(-c3ccc(OC)c(OC)c3)[nH]n2)c(OC)n1	756253725	JVUNLEXPEPCKLZ-UHFFFAOYSA-N	442.432	1.973	50	20	IDGD	
COc1ccc(C(=O)N2CCOCC2)cc1NC(=O)NNC(=O)COc1ccc(F)cc1	756258835	VPPOJJICFZMTME-UHFFFAOYSA-N	446.435	1.538	50	20	IDGD	
CNC(=O)CCOc1ccc(NC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc1	756458227	KMNLWWNZHVRAER-UHFFFAOYSA-N	438.444	1.559	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)Nc1cc(C2CC2)nn1[C@H]1CCS(=O)(=O)C1	756857213	TVODYNYWEXTXMQ-INIZCTEOSA-N	447.517	1.490	50	20	IDGD	
Cc1ccnc(-n2nccc2NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)c1	760277361	IPHSWRIYQKIBJR-UHFFFAOYSA-N	432.238	1.066	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)c1cc(F)c(F)cc1I	760636779	YDZUZYOBNBBXGD-UHFFFAOYSA-N	439.200	1.635	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)N2CCC(S(C)(=O)=O)CC2)N(C)c2ccccc21	760955417	RCCYKKGWZKXSAY-UHFFFAOYSA-N	430.530	1.693	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)NC[C@H]2[C@H](C)OC(C)(C)N2C(=O)OC(C)(C)C)n1	762330785	QGWZBBNXQHAAEZ-GJZGRUSLSA-N	438.529	1.591	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)CS(=O)(=O)NC1CCC(C)CC1	762370029	DANJZBACUBJWJQ-UHFFFAOYSA-N	429.564	1.433	50	20	IDGD	
Cc1c(Br)cc(C(=O)O)cc1S(=O)(=O)NNC(=O)c1ccccc1O	763274763	KLTLKVJXUXDDJW-UHFFFAOYSA-N	429.248	1.785	50	20	IDGD	
CCN1CCN(c2ccc(Cl)cc2NC(=O)C(=O)NNC(=O)c2ccccn2)CC1	763468206	UNRIOKMORXFHEN-UHFFFAOYSA-N	430.896	1.277	50	20	IDGD	
O=C(NNC(=O)c1ccccc1Br)C(=O)Nc1ccc(NC(=O)C2CC2)nc1	763482832	KZXDLGAZUWSTTL-UHFFFAOYSA-N	446.261	1.592	50	20	IDGD	
CCOc1cc2c(cc1NC(=O)C(=O)NNC(=O)c1ccc3c(c1)OCO3)O[C@@H](C)C2	763550588	GKPXVVXWZBQFAU-NSHDSACASA-N	427.413	1.537	50	20	IDGD	
CC(C)(C)c1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccnn2-c2ccncc2)cc1	763594084	GLSXZOXOPGBHMT-UHFFFAOYSA-N	436.472	1.730	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(C)c(NC(C)=O)c2C)cc1	763659771	QVCIGWVQHIZANZ-UHFFFAOYSA-N	428.445	1.435	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2ccc(OCCN(C)C)cc2)c1	763669249	VUVJZCLBWYYQPK-UHFFFAOYSA-N	428.489	1.409	50	20	IDGD	
COC(=O)NCc1ccc(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)cc1	763745230	AXEFHDGIVAEMHJ-UHFFFAOYSA-N	439.472	1.081	50	20	IDGD	
Cc1ccc(NC(=O)C(C)C)cc1NC(=O)C(=O)NNC(=O)COc1ccccc1C#N	763806843	DYPQUGKUEUGNSZ-UHFFFAOYSA-N	437.456	1.626	50	20	IDGD	
CN(C)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)CCSc2ccc(F)cc2)cc1	763895941	UQLVSYPDVIGWEX-UHFFFAOYSA-N	432.477	1.796	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2sc(-c3ccccc3)nc2C)n(CCC#N)n1	763901691	JTOLIUKDYJIULV-UHFFFAOYSA-N	437.485	1.937	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccc(CN2C(=O)CSC2=O)cc1	763918713	GVNVOQMMEPPKCV-UHFFFAOYSA-N	444.444	1.350	50	20	IDGD	
O=C(CC(F)(F)F)NNC(=O)C(=O)Nc1cc(I)ccc1Cl	764115424	QCTGWOCRHFCYEV-UHFFFAOYSA-N	449.554	1.983	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2O1)C(=O)Nc1c(F)cc(Br)cc1F	764166828	FOGLJWCVSUOBDX-ZDUSSCGKSA-N	440.200	1.817	50	20	IDGD	
O=C(CN1CCCCCCC1)Nc1ccc(NC(=O)C(=O)NNC(=O)C2CCC2)cc1	764339553	UDSKHGPEKSJEOO-UHFFFAOYSA-N	429.521	1.777	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c2cccnc12	764351048	OGBQUZGZQFHBTR-UHFFFAOYSA-N	430.424	1.829	50	20	IDGD	
Cc1ccc(C(=O)NC2CC2)cc1NC(=O)C(=O)NNC(=O)c1cnn(-c2ccccc2)c1	764352071	ZGCGWPJFBUPYAD-UHFFFAOYSA-N	446.467	1.473	50	20	IDGD	
CCN(CC)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)cc1	764370230	PEQAVILBRGGRGF-UHFFFAOYSA-N	448.426	1.926	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2cccs2)[nH]n1)C(=O)Nc1cccc(NC(=O)C2CC2)c1	764382173	GKAFDHKPXSDBLM-UHFFFAOYSA-N	438.469	1.886	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)c3cccc(CS(N)(=O)=O)c3)n[nH]2)cc1	765571844	QAOLGMDVLWMZNX-UHFFFAOYSA-N	427.486	1.502	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1ccc(F)cc1I	766269656	DISZVPNJAXUJIA-UHFFFAOYSA-N	431.165	1.311	50	20	IDGD	
O=C(NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)N[C@H]1CCCc2c[nH]nc21	767227117	PLDUBQJHZIKHAO-INIZCTEOSA-N	432.506	1.216	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)[C@H]3CCCc4cccnc43)cc2)CC1	768089805	DISBVTHBELSDIH-IBGZPJMESA-N	429.546	1.581	50	20	IDGD	
CNC(=O)CCOc1ccc(NC(=O)NNc2c(OC)cccc2S(C)(=O)=O)cc1	769232295	LAZDIZMDEDOYIT-UHFFFAOYSA-N	436.490	1.762	50	20	IDGD	
CCN1CCN(C[C@H](C)CNC(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)CC1	770399746	HVNLQRLPPUTKJX-CQSZACIVSA-N	433.561	1.187	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@H](NS(C)(=O)=O)C(C)(C)C)cc1Br	770544983	HMAQLEZPVDZBJP-LBPRGKRZSA-N	436.328	1.183	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)[C@@H](NS(C)(=O)=O)C(C)(C)C)cc1OC	770645217	RRZXOTYMJYNLCK-MRXNPFEDSA-N	429.539	1.599	50	20	IDGD	
C[C@H](NS(=O)(=O)c1cccs1)C(=O)NNc1ccc(S(=O)(=O)C(F)F)cc1	771011591	HMIWJBNKUNEGBU-VIFPVBQESA-N	439.487	1.555	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1cc(Br)cc(S(C)(=O)=O)c1F	772064983	OURIMIADEDXOQT-SSDOTTSWSA-N	439.259	1.094	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)c1cn(-c2ccccc2Cl)nn1	772195960	UOJWOWPQRGQYIL-UHFFFAOYSA-N	433.255	1.652	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)[C@H]1CCN(c2cccc(Cl)c2)C1=O	772897725	LJKQHCNFMOOLJX-MRXNPFEDSA-N	449.294	1.810	50	20	IDGD	
Cc1ccn2c(=O)c(C(=O)NNC(=O)[C@@H]3CCCN(C(=O)OC(C)(C)C)C3)cnc2c1	773410641	FCAZEYUNSYYBDH-CQSZACIVSA-N	429.477	1.411	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(CN3C(=O)CCCC3=O)cc2)cc1F	773890010	VSZRZJLLMRQJEL-UHFFFAOYSA-N	440.431	1.573	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN(C)CCN(C)C1CCN(C)CC1	774730432	QIVBWYHYVBIIKG-UHFFFAOYSA-N	425.961	1.067	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)Nc2ccnn2[C@@H]2CCS(=O)(=O)C2)c1C	776059710	QYDAYALYGKAOSR-HUUCEWRRSA-N	435.506	1.480	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)c2c(F)ccc(S(=O)(=O)NC3CC3)c2F)c1	776721191	ORIYNKYGHGOAQE-UHFFFAOYSA-N	445.469	1.566	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)[C@H](CSC)N2C(=O)[C@H]3CCCC[C@H]3C2=O)nc1C	778427955	GZGCKATYQQTXOV-GUTXKFCHSA-N	449.533	1.312	50	20	IDGD	
COC[C@H](C)n1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(C)cc3)[nH]n2)n1	778712551	HUTKVCCMXCBBFB-ZDUSSCGKSA-N	425.449	1.189	50	20	IDGD	
COC(=O)CCCC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	780978000	BWQMGXQECVCODC-UHFFFAOYSA-N	433.486	1.269	50	20	IDGD	
CCN1CC[C@H](NC(=O)NNC(=O)C(=O)N2CCCC2)[C@H]1c1cc(F)c(F)c(F)c1	782760065	OKOZRTVQPRQZTC-GOEBONIOSA-N	427.427	1.192	50	20	IDGD	
Cn1nc(C2CCCCC2)cc1NC(=O)C(=O)NNC(=O)Cc1nc2ccccc2n1C	782885766	ICPHSYCKCXSFCX-UHFFFAOYSA-N	437.504	1.683	50	20	IDGD	
Cc1nc(-c2cccc(NC(=O)C(=O)NNC(=O)Cc3nc4ccccc4n3C)c2)no1	782894609	QLJBKXFCHMNQPO-UHFFFAOYSA-N	433.428	1.260	50	20	IDGD	
NS(=O)(=O)N1CCN(S(=O)(=O)c2ccc(S(F)(F)(F)(F)F)cc2)CC1	782982317	LMRNEEFSTVTVJJ-UHFFFAOYSA-N	431.430	1.854	50	20	IDGD	
Cn1cc(Br)cc(NC(=O)C(=O)NNc2ccccc2Br)c1=O	782989378	ZTGQNDKZZWZLEV-UHFFFAOYSA-N	444.083	1.992	50	20	IDGD	
O=C(Cn1cc(NC(=O)C(=O)NNc2ncccc2C(F)(F)F)cn1)NC1CCCC1	783121001	BXHMWDLTUFJMGT-UHFFFAOYSA-N	439.398	1.438	50	20	IDGD	
CCC(CC)NC(=O)[C@H]1CN(C(=O)C(=O)NNc2cc(C)nc(C)n2)c2ccccc2O1	783325253	GYKVVMGGGGBWCG-GOSISDBHSA-N	440.504	1.636	50	20	IDGD	
Cc1cc(OCc2cccc(F)c2)ccc1NC(=O)C(=O)NN[C@]1(C)CCS(=O)(=O)C1	783428778	XHZGHPXGDGDGEO-OAQYLSRUSA-N	449.504	1.850	50	20	IDGD	
C[C@@H]1CN(C(=O)C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)c2ccccc2O1	784214789	DTWAHXLKYMJLNR-CYBMUJFWSA-N	430.486	1.385	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ccc(Br)cn2)c(OC)c1OC	784339362	HLVPBELQWGUINJ-UHFFFAOYSA-N	425.239	1.952	50	20	IDGD	
COCCOc1cc(NC(=O)C(=O)NNc2cccc(S(C)(=O)=O)c2)ccc1OC	784839953	UZDXITBNHWZVRX-UHFFFAOYSA-N	437.474	1.206	50	20	IDGD	
C[C@@H]1CN(c2ccc(NC(=O)C(=O)NNc3ccnc(N(C)C)n3)cc2F)C[C@@H](C)O1	784970794	NEZACLMUJPPXMB-CHWSQXEVSA-N	431.472	1.377	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2cc(F)c(F)c(F)c2)cc1	785086985	LXJCEUDIURCSEU-UHFFFAOYSA-N	446.407	1.110	50	20	IDGD	
CCNC(=O)Nc1ccc(C)c(NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)c1	787542107	GDCJHOIPKXIYGB-UHFFFAOYSA-N	436.472	1.877	50	20	IDGD	
CN1CCC(n2ccc(NC(=O)C(=O)NNC(=O)c3ccccc3Br)n2)CC1	787543801	IQIOJQLVMJCVPG-UHFFFAOYSA-N	449.309	1.312	50	20	IDGD	
CC(C)(C)C(=O)NC1CCC(C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)CC1	789205948	IIBZDAJSFQIZCH-UHFFFAOYSA-N	448.476	1.620	50	20	IDGD	
Cc1nccn1-c1ccc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)cn1	789810784	QHIBTVVPROUBSB-HKUYNNGSSA-N	434.456	1.234	50	20	IDGD	
O=C(NNC(=O)c1c[nH]nc1-c1ccoc1)c1cccc(S(=O)(=O)N2CCCCC2)c1	789867101	KPWLABNRVVQTPV-UHFFFAOYSA-N	443.485	1.919	50	20	IDGD	
CSSCCNS(=O)(=O)c1cc2c(cc1Br)n(C)c(=O)n2C	790350467	VENUQUDWMPTEEF-UHFFFAOYSA-N	426.383	1.929	50	20	IDGD	
COc1ccccc1[C@@]1(C)NC(=O)N(CC(=O)NNc2cccc(F)c2[N+](=O)[O-])C1=O	790578934	IDHVQTBZCKRUPB-LJQANCHMSA-N	431.380	1.653	50	20	IDGD	
Cc1cc(O[C@H]2CCN(C)C2=O)ccc1NC(=O)C(=O)NNc1ccc2c(=O)[nH]ccc2c1	793070009	LEDWHILYPVYXSQ-IBGZPJMESA-N	449.467	1.528	50	20	IDGD	
COCC1(C(=O)NNC(=O)CNC(=O)OC(C)(C)C)CCN(C(=O)OC(C)(C)C)CC1	793782159	AYKXJVPYNOWEDG-UHFFFAOYSA-N	444.529	1.322	50	20	IDGD	
Cc1cc(Cn2nnc(C(=O)NNC(=O)c3ccc(F)cc3Br)c2C)on1	794242305	YPTDFIUXCQPZEA-UHFFFAOYSA-N	437.229	1.908	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)N1CCC[C@@H](C=NNC(=O)Cc2cn3ccccc3n2)C1	794514151	QEEHZRDZEMVPRR-INIZCTEOSA-N	442.520	1.742	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNC(=O)C(=O)Nc1ccnn1C1CCCC1	797369655	CVTTUGTYVBPRHS-UHFFFAOYSA-N	428.449	1.011	50	20	IDGD	
COC(=O)c1ccc(NC(=O)NNC(=O)c2cc(-c3ccc(OC)c(OC)c3)[nH]n2)nn1	799232465	DXXASXUCIPEKSK-UHFFFAOYSA-N	441.404	1.137	50	20	IDGD	
COc1ccc([C@@]2(C)NC(=O)N(CC(=O)NNC(=O)Nc3cc(F)cc(F)c3)C2=O)cc1	802006887	RVJBPGNBCPHIQV-HXUWFJFHSA-N	447.398	1.593	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@@H]2C(=O)NNC(=O)Nc2ccc3c(c2)OCO3)cc1	802102441	QJMSZHIDJFLVAU-MRXNPFEDSA-N	426.429	1.881	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(/C#N)C(=O)NS(=O)(=O)c2cnc3n2CCC3)c1C	802208936	DEZJAMRMOCIVAO-DUPVFGOHSA-N	431.518	1.867	50	20	IDGD	
CS(=O)(=O)c1ccccc1-n1cc(NC(=O)NNc2ccc(-n3ccnc3)nn2)cn1	806295075	UATYELWIRJBWIW-UHFFFAOYSA-N	439.461	1.400	50	20	IDGD	
Cc1cc(I)cc(NC(=O)C(=O)NNC(=O)CC(F)(F)F)c1	806977512	MVJHNAIDQIVWBW-UHFFFAOYSA-N	429.136	1.638	50	20	IDGD	
COc1ccc([C@@H](CNC(=O)NNC(=O)COc2ccccc2F)N2CCOCC2)cc1	806999068	XXIVBDZIXCYANK-LJQANCHMSA-N	446.479	1.617	50	20	IDGD	
Cc1ccc([C@@H](CNC(=O)NNC(=O)COc2ccccc2C#N)N2CCOCC2)o1	807023475	NYWXYEWMJHNFQE-QGZVFWFLSA-N	427.461	1.242	50	20	IDGD	
CC(C)c1nccnc1NNC(=O)C(=O)N1C[C@@H](C[C@H]2COCC(=O)N2)c2ccccc21	807065066	CNBVNFXGPTUZNJ-CABCVRRESA-N	438.488	1.079	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)NC[C@H]2c3ccccc3CCN2C(=O)OC(C)(C)C)cn1	807436040	AYWXWOHZOIAPCR-KRWDZBQOSA-N	428.493	1.899	50	20	IDGD	
CCc1nnc(NC(=O)[C@H](C)[C@@H](C)NC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)s1	807565527	MYRPJLBSKYHCHR-NXEZZACHSA-N	435.466	1.616	50	20	IDGD	
CCS(=O)(=O)N1CCC([C@@H](C)N(C)C(=O)NNC(=O)c2cccc3cccnc23)CC1	808257394	YTFPVIDYNSIYRV-OAHLLOKOSA-N	447.561	1.971	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc4c(c3)C(=O)OC4)n[nH]2)cc1	808935359	UCTMUQYUNOSOAI-UHFFFAOYSA-N	433.424	1.709	50	20	IDGD	
N#Cc1cccc(S(=O)(=O)NCC(=O)NNC(=O)c2c(Cl)cccc2Cl)c1	810338434	WJUXCWOLOSIOIN-UHFFFAOYSA-N	427.269	1.605	50	20	IDGD	
NC(=O)c1ccc(NNC(=O)Cc2sc(N3CCOCC3)nc2-c2ccccc2)nn1	810510993	GJSSGRVVCLDQFP-UHFFFAOYSA-N	439.501	1.221	50	20	IDGD	
C[C@@H]1Oc2ccccc2N(CC(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)C1=O	811789104	RAMPTCDHKZYCCD-LBPRGKRZSA-N	431.832	1.458	50	20	IDGD	
CC(=O)N1C[C@@H]2CCC[C@@H](NC(=O)NNc3ccc(S(=O)(=O)NC(C)C)cn3)[C@H]2C1	812432098	BLVZPBKQJCMOTD-BHYGNILZSA-N	438.554	1.041	50	20	IDGD	
O=C(NNC(=O)c1cc(F)ccc1Br)C(=O)N1CCN(c2ccccc2)CC1	812499849	NBOSXQQMSQWYDA-UHFFFAOYSA-N	449.280	1.698	50	20	IDGD	
Cc1c(Br)cc(C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)c(=O)n1C	812732111	SGKNPXQEBDKKNN-UHFFFAOYSA-N	443.323	1.463	50	20	IDGD	
COc1ccc([C@@H](O)C2CCN(CC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)CC2)cc1	812855197	HXCFCWQHOPLPMJ-OAQYLSRUSA-N	442.472	1.810	50	20	IDGD	
Cc1nn(C)c(-n2cccn2)c1C(=O)NNC(=O)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	816509986	JIBNKTQUKVJAAR-CQSZACIVSA-N	431.497	1.322	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)c1cc(Cl)c(OCC(N)=O)c(OC)c1	825649593	YHJCJQJXODPECX-UHFFFAOYSA-N	436.852	1.094	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)[C@@H]2CCCCN2S(=O)(=O)c2ccccc2)cc1	901424440	UEATYOSANWIGNP-IBGZPJMESA-N	431.514	1.765	50	20	IDGD	
CN(CC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)Cc1ccc(C(=O)NC2CC2)cc1	914574398	SCPVWPTXLONDPE-UHFFFAOYSA-N	425.445	1.380	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)[C@@H]2CC(=O)N(Cc3ccccn3)C2)c2ccccc2c1=O	914879055	XQOQRXDESZGELA-OAHLLOKOSA-N	448.483	1.011	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)NCc2ccc(CN3CCOCC3)cc2)cc1C	915928679	OZEUPYVCWKGFDY-UHFFFAOYSA-N	439.516	1.605	50	20	IDGD	
O=C(NCCNS(=O)(=O)c1ccccc1)NNC(=O)c1ccc(Cl)cc1Cl	916295863	XDDVIEKXPHVAQU-UHFFFAOYSA-N	431.301	1.916	50	20	IDGD	
Cc1cccc([C@H](CNC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)N2CCOCC2)c1	916435368	AESRMOURPHCJKL-RXVVDRJESA-N	440.500	1.539	50	20	IDGD	
O=P(CCN1CCN([C@@H]2CCS(=O)(=O)C2)CC1)(c1ccccc1)c1ccccc1	917056101	RBAIJSYHMWCFOJ-HXUWFJFHSA-N	432.526	1.805	50	20	IDGD	
COC(=O)[C@@H](C)Sc1ccccc1C(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	917915288	JQAFUNOLPHCJEI-GFCCVEGCSA-N	440.481	1.662	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1	918219109	FASGPAADNPRUNK-UHFFFAOYSA-N	446.479	1.705	50	20	IDGD	
COc1cc(OC)c(CNC(=O)NNC(=O)c2nnc(O)c3ccccc23)c(OC)c1	918231087	VJRZGEMRGFCILH-UHFFFAOYSA-N	427.417	1.505	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)CN1CCCCCCC1=O	919308751	LRZQOZXKVLOSFN-UHFFFAOYSA-N	425.869	1.446	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)[C@H]2CCCN(CC(F)(F)F)C2)c2ccccc2c1=O	919806562	FSDUSKLPPGXKIW-ZDUSSCGKSA-N	439.438	1.842	50	20	IDGD	
COc1ccc(-n2ccc(C(=O)NNC(=O)c3ccc(Cl)c(S(N)(=O)=O)c3)n2)cc1	919838937	VZSOXEQOPQGQNJ-UHFFFAOYSA-N	449.876	1.257	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)/C(=C/c2cccc(OC)c2)n2nnnc2C)cc1	920011955	FIMWAWUQKMXPNM-ZHZULCJRSA-N	436.472	1.777	50	20	IDGD	
O=C(CNC(=O)[C@@H]1c2ccccc2C(=O)N1Cc1ccccc1)NNC(=O)c1ccccn1	920251489	QOMUIIAJNUPMQI-NRFANRHFSA-N	443.463	1.356	50	20	IDGD	
CCCCOc1ccc(C(=O)NN=Cc2nc3c(c(O)nc(=O)n3C)n2C)cc1OC	920366756	XSUDXZSMWSXQRM-UHFFFAOYSA-N	428.449	1.324	50	20	IDGD	
O=C(NCC1CC1)NNC(=O)c1ccc(Cl)c(S(=O)(=O)NC[C@@H]2CCCO2)c1	920860163	IGOZWTGWALDSJK-ZDUSSCGKSA-N	430.914	1.151	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)NCCNC(=O)c1ccccc1C(F)(F)F	1317882494	HANPWNASNAQEIA-UHFFFAOYSA-N	442.369	1.984	50	20	IDGD	
COc1cccc(N2CCC(NC(=O)NNC(=O)COc3ccccc3[N+](=O)[O-])CC2)c1	1318035668	BGIOXAUUHGTXKZ-UHFFFAOYSA-N	443.460	1.982	50	20	IDGD	
Cc1ccn(-c2cccc(C(=O)NNC(=O)CN3CCN(C(=O)c4ccccc4)CC3)c2)n1	1319778445	HOTKATZFPHXLKH-UHFFFAOYSA-N	446.511	1.400	50	20	IDGD	
Cn1cc([C@H](NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c2ccccc2)cn1	1320079428	UDPONABIQCBRFS-GOSISDBHSA-N	431.456	1.401	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCc2ccc(OCC(=O)N(C)C)c(OC)c2)cc1	1323296756	IJZOYICSLULJHT-UHFFFAOYSA-N	430.461	1.315	50	20	IDGD	
COc1cc(C(=O)NNc2cncc(Br)c2)cc(NS(C)(=O)=O)c1OC	1341214901	NXGDMADDISLLQW-UHFFFAOYSA-N	445.295	1.990	50	20	IDGD	
C/C(=C\c1ccc(C)o1)C(=O)N1CC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1	1779155784	HMLIICRJWZQXJS-FOYQMUPJSA-N	432.521	1.194	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@]2(C1)CN(C(=O)C[C@H]1CNc3ccccc3O1)CCO2	1779297037	PEMVOIYCSLBDRA-JTSKRJEESA-N	447.608	1.931	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(CO)on2)C1	1780213650	BEPBOAROASPDBV-CDHAZOANSA-N	444.326	1.325	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H]1C(=O)N1CC[C@]2(CN(C(=O)C(Cl)Cl)CCO2)C1	1781015890	VPMBYIQJGCBIEX-KZULUSFZSA-N	436.336	1.629	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H]3CC[C@@H]4CCC(=O)N4C3)C2)C1	1781059838	TUZQTZHYVFQEPA-ZTENYAIWSA-N	442.354	1.001	50	20	IDGD	
CC(C)=CCCC(=O)N1CC[C@]2(C1)CN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)CCO2	1781121218	VVGAAEZFRVELPO-ZRZWOPFXSA-N	429.521	1.697	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)[C@@H]3COc4ccccc4O3)CCO2)C1	1781225567	ZZMXPRGBULPZDV-FFZOFVMBSA-N	443.327	1.893	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@](C)(Cl)CCl)C3)C2)o1	1781229535	FTNWRBSEGBRVRQ-QZTJIDSGSA-N	432.304	1.918	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc3[nH]ncc13)C2	1782173050	VDHOBSGVRMITKG-YRISNDGFSA-N	434.924	1.944	50	20	IDGD	
CC(=O)N[C@H](C)C(=O)N1CCO[C@@]2(CCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1	1782867657	WNLJEKNNAQBICB-JDORMIOJSA-N	446.454	1.226	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](C)NNc1ccccc1)CCO2	1783528090	JJFAJQHYMSWXJO-YZVOILCLSA-N	439.354	1.605	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)COc3ccccc3C#N)CCO2)C1	1783535921	BUWYPPSIUHIIFM-IFXJQAMLSA-N	436.306	1.550	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3CCC(CO)CC3)C[C@@H]21	1783968527	AZTKHLXGXMVQKN-ZZTPGCILSA-N	445.398	1.796	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccncc3O)C[C@@H]21	1783968962	CPZPEGAILRYHQF-DUPGQFARSA-N	426.311	1.412	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)CCCn3ccnc3C)C2)C1	1784411943	MIAZYSVNYAOOEA-VQIMIIECSA-N	441.370	1.975	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCC(=O)N3CCCC3)C[C@@H]21	1784616452	WFWGTEPGCZSJLN-FJIDUMEYSA-N	427.973	1.776	50	20	IDGD	
NC[C@H](N)C(=O)N1CCO[C@]2(CCN(C(=O)CCCCCCCCBr)C2)C1	1785669096	XZNVZLBPUOHCFT-LPHOPBHVSA-N	447.418	1.228	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC1(c2ccc(NC(=O)c3ccc(O)nn3)cc2)CCC1	1787227138	NXZRGGJTKJFSBZ-UHFFFAOYSA-N	447.455	1.242	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1)c1ccc(=O)oc1	1787586595	OXLWDJOGYUQUNT-UHFFFAOYSA-N	432.241	1.381	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nn[nH]c3C(F)(F)F)C[C@@H]21	1788763255	BIFAYOXVMAAUQT-SRVKXCTJSA-N	449.506	1.268	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nccc4nc[nH]c34)C[C@@H]21)[C@@H](F)Br	1789923155	VEIBBJQBFXFPON-PCVQNBPASA-N	440.273	1.242	50	20	IDGD	
CCOC(=O)C1(C(=O)Nc2ccc(C3(NC(=O)CCC(=O)NN(C)C)CCC3)cc2)CC1	1791160074	HAGYIVBIJHKWRB-UHFFFAOYSA-N	444.532	1.837	50	20	IDGD	
C[C@H](Cn1ccnc1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)CBr)C[C@@H]21	1791625410	SSDNRSZRWJIZQC-QEOTZNIISA-N	441.370	1.530	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)n[nH]1	1796142286	CJASHJUYQNQLRV-OPDFLTKYSA-N	441.916	1.499	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc(F)c(C#N)c1)C2	1797956151	DYNPQXSPESMYEJ-UPHUGPLXSA-N	433.556	1.681	50	20	IDGD	
Cc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)CBr)C3)c(C)n1C	1798390184	ZHAPBABQNMCWGW-FIUQPQMISA-N	426.355	1.876	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc[nH]n1)C2	1800332186	FLDDLASLHWPGPA-ODLYAQKHSA-N	427.411	1.498	50	20	IDGD	
O=C(Cc1ccc(F)cc1F)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2	1800659553	LHOUJVKJRLYUGF-OJXGSEEGSA-N	435.240	1.787	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C=C/c1ccc(OC)cc1F	1800835026	LIZJUNMSTIDPLS-KQLBXHFXSA-N	440.899	1.691	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cc([N+](=O)[O-])ccc1F)C2	1800974318	SAUHUTFXEMYPFZ-ZFHGCVPZSA-N	443.859	1.120	50	20	IDGD	
COc1ccc(CC(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)cc1O	1802817635	HFOGVRYDRKEHJF-DJPFJPOOSA-N	447.919	1.644	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1CCN(C(=O)CSC(=N)N)[C@H]1c1cccnc1	1803007726	FJTBVHQLEVRBCS-ZLDLUXBVSA-N	442.383	1.745	50	20	IDGD	
COC(OC)C(=O)N1CC[C@H](CNC(=O)[C@H](C)CBr)[C@@H]1c1cccnc1	1803010672	IQGBRBZLBIOSJD-YUELXQCFSA-N	428.327	1.737	50	20	IDGD	
C=CC(=O)N[C@@H](C)C(=O)N1CCC2(CCCN(C(=O)[C@@H](C)CBr)C2)CC1	1805385150	SWCGNYXYEBEMTA-GJZGRUSLSA-N	428.371	1.939	50	20	IDGD	
NC[C@H](C(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)c1ccccc1	1807248415	QBUZOQKQZSGPKI-VNTMZGSJSA-N	430.936	1.430	50	20	IDGD	
O=C(Cc1cccs1)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1807542611	JNEMPWMFRLWCML-XMSQKQJNSA-N	449.341	1.385	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC2(CCCN(C(=O)c3cnn(C)c3)C2)CC1	1808351506	JTWGZLZXTSMLNB-PCLIKHOPSA-N	439.520	1.399	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)C(Cl)Cl)[C@@H]1c1cccnc1)C(=O)Nc1cccnc1	1810465602	ORWLSMZSFFQKAU-DZGCQCFKSA-N	436.299	1.925	50	20	IDGD	
O=C(Cc1cn2c(nc1=O)SCC2)N1CCC2(CCCN(C(=O)[C@@H](F)Cl)C2)CC1	1810907296	IPEMMIPIIIWUGE-OAHLLOKOSA-N	442.944	1.657	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H](CNC(=O)CCNC(C)=O)[C@@H]1c1cccnc1	1812662734	CHHLUCJPNBMNGW-RYRKJORJSA-N	439.354	1.787	50	20	IDGD	
CCCC(=O)N[C@H](C)C(=O)N1CC[C@H](CNC(=O)[C@@H](Cl)COC)[C@H]1c1cccnc1	1813031097	JIBPYHLBRDULQR-VYCZESIESA-N	438.956	1.646	50	20	IDGD	
CC(C)[C@@H](S)C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1	1815337744	WJWXIYPUVKKJST-CZUORRHYSA-N	433.364	1.003	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](N)Cc3cccnc3)sc2C1	1817188329	TXLFIQCVSVCEBT-CABCVRRESA-N	447.637	1.872	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)C(Cl)Cl)[nH]n1)c1cccc(B(O)O)c1	1817479365	LSUYBXFXTPYETG-CYBMUJFWSA-N	425.081	1.199	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccnnc2)[nH]n1	1818111401	JGWDMVAEDWLETP-FCLYZYNOSA-N	449.475	1.640	50	20	IDGD	
C[C@@H]1C[C@@]1(C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819403826	HXOJLOXBFWVJEU-PTPDTQQLSA-N	425.493	1.760	50	20	IDGD	
CN1CCN(CC(=O)N2CCCC[C@@H]2c2cc(NC(=O)[C@H](F)Br)n[nH]2)CC1	1820933819	NYGCKGNEVSOCEL-CJNGLKHVSA-N	445.337	1.340	50	20	IDGD	
Cc1cccc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cccc(B(O)O)c2)CC3)c1	1822133671	AFIVMRSLOVEVCQ-KRWDZBQOSA-N	435.314	1.671	50	20	IDGD	
CCN(CC)C[C@H](C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1	1822416532	GVYXVKUDFDUZGK-FUHWJXTLSA-N	449.600	1.753	50	20	IDGD	
C[C@@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1)n1ccnc1	1824313685	ZNZZNQJHQOEVOH-LAUBAEHRSA-N	438.337	1.057	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](O)CCl)CC2	1825501578	GKTNBZHRAQKCPS-MWLCHTKSSA-N	432.930	1.180	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(OC)n(C)n1)CC2	1826002694	AZVYPESTERTNEE-VHSXEESVSA-N	427.914	1.365	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnn3c1OCCC3)CC2	1826004946	VSIPMSDZQMMBNY-PWSUYJOCSA-N	439.925	1.602	50	20	IDGD	
Cc1noc(N)c1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1	1826869273	KMNVWRGTLJMQBN-MRXNPFEDSA-N	434.541	1.172	50	20	IDGD	
CCc1oncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827050965	IBBOZGSTDYTWHD-HXUWFJFHSA-N	439.321	1.464	50	20	IDGD	
O=C(CN1CCCCC1)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827055235	VMXULEQSSCZOQS-QFIPXVFZSA-N	441.381	1.086	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccccn2)CC1	1828925980	VXWWDFZHWPEJQL-FQEVSTJZSA-N	436.516	1.627	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(O)cc2)CC1	1830041703	MIHZLISSURSVKD-QFIPXVFZSA-N	436.317	1.619	50	20	IDGD	
COc1ccc(OCC(=O)N2CCO[C@@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)cc1	1830242440	KGFFEPRVHNVSGZ-IBGZPJMESA-N	447.315	1.334	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CC(=O)OC(C)(C)C)C2)C1	1831639585	CPAGKLUIWOGMPT-FOIQADDNSA-N	432.945	1.582	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ncc(OC)cc3F)C2)C1	1831644206	RKFDVQHJLNKPSW-MGPUTAFESA-N	443.903	1.707	50	20	IDGD	
O=C(/C=C/c1ccoc1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1832651896	ZQDLPUIIMTWSKP-YSCDTDAQSA-N	431.258	1.440	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)[C@@H]3CCNC(=O)C3)CC2)CC1	1833534536	CPMSPOJSMMQDMG-CRAIPNDOSA-N	426.989	1.492	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(C)n3)CCO2)C1	1834049866	FSWVTJPLPOASNG-BEFAXECRSA-N	440.338	1.634	50	20	IDGD	
Cc1cc(C(=O)NC2CCN(C3CCN(C(=O)[C@H](F)Br)CC3)CC2)n(C)n1	1834189285	QXLOJWXVRPWLIB-INIZCTEOSA-N	444.349	1.604	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1)c1ccc(O)cn1	1834338100	CLWBMCUGGONPEP-MRXNPFEDSA-N	443.317	1.663	50	20	IDGD	
CCc1ccnc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)c1	1836360458	YKCRRJANEBQGIN-CRAIPNDOSA-N	444.301	1.405	50	20	IDGD	
CC(C)N[C@@H](C(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1)C(C)C	1836716711	KQLLIOLOOPFPTF-RTBURBONSA-N	432.005	1.607	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836717277	AAPPWIMLFJFQTM-WMLDXEAASA-N	429.772	1.821	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)Cc3cncnc3)CC2)CC1	1837198946	MHUUBGHNWOVDQT-AWEZNQCLSA-N	439.354	1.801	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(CN(C(=O)C/N=C/c3ccco3)CCO2)C1	1837564521	VBEBDMHBWNROLB-YUSOBQLHSA-N	437.569	1.006	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)c(O)c1OC	1839376694	NFDFDTPPRCIDAY-APWZRJJASA-N	446.859	1.014	50	20	IDGD	
COc1cc(Cl)ccc1CC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1839752969	FFIPDIXGENECHF-MJGOQNOKSA-N	449.306	1.882	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3(C(F)(F)F)CC3)C2)C1	1840033892	UKZUQSJEFVPMDL-FZMZJTMJSA-N	443.260	1.569	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccnc4ccccc34)C2)C1	1840152189	AOTGZERJLNANOL-PGRDOPGGSA-N	447.919	1.559	50	20	IDGD	
COc1ccc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)cc1F	1840190621	DVVGGCYSGWLGHX-LJQANCHMSA-N	449.306	1.637	50	20	IDGD	
O=C(CCc1c[nH]c2ncccc12)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1840871128	TZAJCSXOASOUKQ-PXNSSMCTSA-N	438.887	1.486	50	20	IDGD	
Cc1cc(CC(=O)N2CCCC23CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C3)on1	1841928878	NRZKTABIKRGHKV-HNNXBMFYSA-N	440.928	1.861	50	20	IDGD	
O=C1Nc2ccccc2Cn2nc(C(=O)N3CC4(CCCN4C(=O)[C@H](F)Cl)C3)cc21	1843364972	OWXMIEMNKONKOK-INIZCTEOSA-N	431.855	1.849	50	20	IDGD	
O=C(CCBr)N1CC2(CCCN2C(=O)[C@H]2C[C@@]23C(=O)Nc2ccccc23)C1	1846152797	HLWZOPSNDDGJDJ-VLIAUNLRSA-N	432.318	1.885	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC2(CCCN2C(=O)/C=C/c2cnccn2)C1	1846652604	OAONCIQVFFIEPB-JFDDCEBESA-N	449.939	1.825	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)C[C@H](O)CNC(=O)OC(C)(C)C	1847870160	NBGLHYXAFJUCGZ-VGWMRTNUSA-N	431.961	1.871	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NCc1ccccc1S(=O)(=O)N(C)C	10259533	YHRVRADNKNFWLU-ZDUSSCGKSA-N	438.481	1.374	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)c2nn(-c3ccccc3F)c(C)cc2=O)c1	15605037	DTDLHJXROWCKEN-UHFFFAOYSA-N	426.404	1.772	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)Nc3cccc(Cl)c3)c2)cn1	17520845	UHDMFMPFEYJLSD-UHFFFAOYSA-N	433.877	1.949	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(F)cc2)C1)NC1CCCCC1	725988359	CIUXWXBIVUUKNE-CQSZACIVSA-N	426.514	1.890	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)CNC(=O)c1ccco1)[C@H]1CCCN(C(=O)OC(C)(C)C)C1	726271887	XZCUPEGFCGVGRA-KBPBESRZSA-N	437.497	1.375	50	20	IDGD	
CC(C)(C(=O)NNC(=O)COc1ccc(Br)cc1)n1cc([N+](=O)[O-])cn1	726496765	JELLBQTVVQFORH-UHFFFAOYSA-N	426.227	1.515	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)c1ccc(=O)n(Cc2ccccc2)n1	726862608	WRLVLOSUQWAPLH-UHFFFAOYSA-N	439.497	1.489	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](C(=O)NNC(=O)CNC(=O)c1cccs1)c1ccccc1	727156299	CUNYWNVCNSKOGM-MRXNPFEDSA-N	432.502	1.891	50	20	IDGD	
C[C@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)NNc2nc(-c3cccnc3)no2)C1=O	728076953	OWCUHQRNPPUTNA-LJQANCHMSA-N	425.380	1.181	50	20	IDGD	
COc1ccc(Cl)cc1N1C[C@H](C(=O)N([C@H]2CCS(=O)(=O)C2)N(C)C)CC1=O	728178140	CDESOZOUDXMZCZ-OCCSQVGLSA-N	429.926	1.194	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)C1CCN(C(=O)c2cccnc2)CC1	728209552	GDSQTXSQYLVGDI-UHFFFAOYSA-N	443.529	1.518	50	20	IDGD	
NS(=O)(=O)c1ccc(Cl)c(C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)c1	728209983	NLJWJEWZAPLBNL-UHFFFAOYSA-N	444.922	1.185	50	20	IDGD	
CN1CCC(N2CCC(NC(=O)NNC(=O)c3cccc(OC(F)F)c3)CC2)CC1	728747653	MCTQKYNZMAGFBC-UHFFFAOYSA-N	425.480	1.791	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cnc(-c3ccco3)s2)cc1	728855806	OEPPKXQMCLAEMU-UHFFFAOYSA-N	434.499	1.793	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)N1CCN(S(=O)(=O)c2ccccc2Cl)CC1	728957286	QXHBHNOITQHUQB-UHFFFAOYSA-N	437.909	1.025	50	20	IDGD	
COc1cc(OC)cc(C(=O)NCC(=O)NNC(=S)Nc2ccc(N(C)C)cc2)c1	729690780	KPDDSNXPVHMBQO-UHFFFAOYSA-N	431.518	1.517	50	20	IDGD	
O=C(CCNS(=O)(=O)c1cccc([N+](=O)[O-])c1)NNC(=O)c1cccc2ncccc12	730225412	CXYBGQILPAWQBX-UHFFFAOYSA-N	443.441	1.273	50	20	IDGD	
Cc1c(C(=O)NNC(=O)Cn2ccc3ccccc32)nnn1-c1ccc2c(c1)OCCO2	731461803	FRAOPNGTARZQKL-UHFFFAOYSA-N	432.440	1.763	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)C[C@@H](C)O1	732261060	JUZPCMGAOGZSPG-BETUJISGSA-N	433.490	1.979	50	20	IDGD	
CCOc1cc(/C=C(/C#N)C(=O)c2c(N)n(C)c(=O)n(C)c2=O)cc(Br)c1O	732578184	IUXXZXIPTVZAPN-YHYXMXQVSA-N	449.261	1.323	50	20	IDGD	
CCOc1ncc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1Cl	732851694	ORCWNHWZEFRHAM-OAHLLOKOSA-N	435.820	1.278	50	20	IDGD	
COc1ccc(CN2CC[C@@H](NC(=O)NNC(=O)COc3ccc(C)c(C)c3)C2=O)cc1	734682877	DGXYLQOJCBWPHN-HXUWFJFHSA-N	440.500	1.822	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc2c(c1)C(=O)NCC2)c1ccc(COc2ccccc2)o1	734807042	RCEAWNCYLGCUPF-UHFFFAOYSA-N	441.465	1.768	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)nc2)CC1)NNC(=O)c1ccc([N+](=O)[O-])cc1	734835862	QFXNSCHKPYQFQZ-UHFFFAOYSA-N	432.868	1.222	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2cccc(C(F)(F)F)c2)CC1	735118780	YPNARXGUJNJNMG-UHFFFAOYSA-N	443.451	1.793	50	20	IDGD	
CCCCS(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)c2ccccc2O)cc1	737750338	DABVJZCKPSOZGO-UHFFFAOYSA-N	427.504	1.557	50	20	IDGD	
C[C@H]1CN(CC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)CC[C@H]1NC(=O)OC(C)(C)C	740881709	AYMXNLKOMRIWDQ-XJKSGUPXSA-N	435.481	1.591	50	20	IDGD	
CC(C)[C@@H](C(=O)OCC(=O)NNC(=O)c1cccc(Cl)c1)N1C[C@H](C)O[C@H](C)C1	741019272	DTOUGWZVOINLDF-IYOUNJFTSA-N	425.913	1.778	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)c1ccc(S(=O)(=O)CC(=O)N(C)C)cc1)c1ccccc1	741930227	OKXFYSLAXIILCD-SFHVURJKSA-N	431.514	1.503	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)[C@@H]1CCCN(C(=O)c2ccncc2)C1	742034609	MAZJYDVUXBDYSE-QGZVFWFLSA-N	434.500	1.694	50	20	IDGD	
O=C(CCSc1ccc(F)cc1)NNC(=O)CCN1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O	742479909	CIKPJSNKOYNMMY-DTDBQYNISA-N	435.477	1.008	50	20	IDGD	
Cc1cc(NC(=O)CSCC(=O)NNC(=O)c2cccc(Br)c2)no1	742772265	WHJYNJOHMWMFCL-UHFFFAOYSA-N	427.280	1.878	50	20	IDGD	
CCOc1ccc(NC(=S)NNC(=O)c2ccc(C[C@H]3CC(=O)NC3=O)cc2)cc1	743300970	NSBVHPMZUFIQOD-HNNXBMFYSA-N	426.498	1.922	50	20	IDGD	
CC(C)[C@@H](NC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)c1nnc2ccccn12	743583421	PGAFWGSYXLKZGJ-MRXNPFEDSA-N	445.505	1.866	50	20	IDGD	
CN(CC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)C[C@@H]1CCN(Cc2ccccc2)C1	744425949	NBNCXYYCZQSWIF-SFHVURJKSA-N	425.489	1.810	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CC(=O)NNC(=O)C(=O)Nc1ccccn1)c1ccccc1	746213781	YHBUMIKVLBSHGE-HNNXBMFYSA-N	427.461	1.824	50	20	IDGD	
CCn1c(=O)nc(O)c2c(C(=O)NNC(=O)Cc3cn4ccccc4n3)cc(C3CC3)nc21	746636935	ITTATXFAUZETSN-UHFFFAOYSA-N	447.455	1.046	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)Cc1cn2ccccc2n1)N1CCN(c2ccccc2)CC1	746750247	MHGWKOGJIGXNNZ-SFHVURJKSA-N	435.532	1.418	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2cccc(C#N)c2)cc(Br)cc1S(N)(=O)=O	747380693	OAMNFMAXVVYOQP-UHFFFAOYSA-N	437.275	1.351	50	20	IDGD	
Cc1c(C(=O)O)cc(Br)cc1S(=O)(=O)NNC(=O)c1cccc(C#N)c1	747613892	XQRIHHLTQFWERT-UHFFFAOYSA-N	438.259	1.951	50	20	IDGD	
COCCCNC(=O)NNC(=O)c1sccc1S(=O)(=O)Nc1ccc(C)cc1	749851284	JHSKUBCEBUVQAX-UHFFFAOYSA-N	426.520	1.838	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1ccc2c(c1)NC(=O)[C@H](C)N2C	749866384	METZYKRPJRXUKR-LBPRGKRZSA-N	444.517	1.140	50	20	IDGD	
Cc1cnc([C@@H](C)NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)s1	750665343	VVQSFVFNKVBRJW-CYBMUJFWSA-N	437.547	1.941	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)c1ccc(-c2ccc3c(c2)OCCO3)s1	751206254	APSVBIDUNJIODR-UHFFFAOYSA-N	427.438	1.970	50	20	IDGD	
Cc1occc1C(=O)Nc1nc(CC(=O)NNC(=O)CNC(=O)c2cccs2)cs1	751207036	YFUSTUMOTZASMN-UHFFFAOYSA-N	447.498	1.478	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C1CCN(C(=O)/C=C\c2ccccc2)CC1	751209142	LETSNEZJZUXMNV-HJWRWDBZSA-N	440.525	1.577	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NN/C=C1/C(=O)N(c2ccccn2)C(=O)c2ccccc21	751259019	FKEAJQZQDCBUJT-FOWTUZBSSA-N	447.476	1.722	50	20	IDGD	
C[C@@H](NC(=S)NNC(=O)CN1C(=O)COc2cc(Br)ccc21)C1CC1	751621482	WPNRFNUBWLGGRI-SECBINFHSA-N	427.324	1.468	50	20	IDGD	
CCOC(=O)c1ccc(N2CC(NC(=O)NNC(=O)[C@H](C)Oc3ccccc3F)C2)nc1	753283148	KIZRODZLANOWBN-ZDUSSCGKSA-N	445.451	1.384	50	20	IDGD	
COc1ccc([C@H]2[C@@H](C(=O)NNC(=O)CO)CCC(=O)N2c2ccc(OC)cc2)cc1	753442962	QRASEBHCPMXTIX-RXVVDRJESA-N	427.457	1.328	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)Nc2ccccc2C(=O)N2CCN(C)CC2)c1	755622887	JDMTWWRAVZMVFH-UHFFFAOYSA-N	439.516	1.923	50	20	IDGD	
O=C(NNC(=O)c1cc(Cl)ccc1O)Nc1cccc(N2CCS(=O)(=O)CC2)c1	756208213	VTXBXMCJFLNMRG-UHFFFAOYSA-N	438.893	1.747	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(NC(=O)NNC(=O)CCCc2ccccc2)cc1	756782990	CZNAGCORPBXKCO-UHFFFAOYSA-N	434.518	1.787	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Nc2ccc(-n3ncn(C)c3=O)cc2)cc(OC)c1OC	757862541	KEWXRAIVECPJDI-UHFFFAOYSA-N	442.432	1.063	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)CC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)c2ccccc2c1=O	758072765	ZEHBACZBZZSBDI-CQSZACIVSA-N	443.504	1.732	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)N[C@@H]2CN(C(=O)OC(C)(C)C)C[C@H]2C#N)c1	758774406	HIMCEKPEUZZDHN-HZPDHXFCSA-N	431.493	1.772	50	20	IDGD	
COc1ccc2c(c1)OC[C@@H]2CC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	760223314	KDYHKQXJJFKZNV-AWEZNQCLSA-N	433.486	1.273	50	20	IDGD	
COc1ccc2c(c1)OC[C@H]2CC(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	760649917	XPMUEPXRUUIEBS-OAHLLOKOSA-N	447.513	1.726	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1ccccc1C(=O)N1CCCC1	763467872	HYFPBLLYUQQIOY-UHFFFAOYSA-N	425.401	1.231	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2F)c(Br)n1	763680830	QTPYXFUHMIPOFJ-UHFFFAOYSA-N	425.214	1.457	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(N2CCCC2)c(F)c1	763814125	PUHOXXFKMLXMPK-UHFFFAOYSA-N	425.420	1.462	50	20	IDGD	
C[C@@H](c1cccc(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)c1)N1CCOCC1	763840313	RBWZTKNLKGBOOZ-HNNXBMFYSA-N	444.463	1.384	50	20	IDGD	
COC(=O)[C@H](C)Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)cc1	763858490	SYJCOKNRASVAGZ-KGLIPLIRSA-N	445.447	1.731	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccc(N3CCCC[C@@H]3C)cc2C)n1	763885389	KUEQHEYUQWFQHJ-INIZCTEOSA-N	426.521	1.973	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(NC(C)=O)c2C)cc1OC	763902150	RAHKZJRCKIXGBB-UHFFFAOYSA-N	428.445	1.760	50	20	IDGD	
COCCn1ncc2ccc(NC(=O)C(=O)NNC(=O)Cc3ccc(Cl)cc3)cc21	763930876	CDVYOXGNVBZVPJ-UHFFFAOYSA-N	429.864	1.665	50	20	IDGD	
O=C(NNC(=O)c1ccc(Br)s1)C(=O)Nc1ccc(Cn2cncn2)cc1	763939551	BAENSVDJRXBHNY-UHFFFAOYSA-N	449.290	1.550	50	20	IDGD	
Cc1nc(-c2ccc(NC(=O)C(=O)NNC(=O)c3cc(Br)c[nH]3)cc2)n[nH]1	763994977	KQKNCMQZQLHGDE-UHFFFAOYSA-N	432.238	1.270	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)C(=O)Nc1ccc(S(=O)(=O)c2ccc(F)cc2)cc1	763998415	HOMGWMKBTCFWKP-UHFFFAOYSA-N	444.444	1.397	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c2cccnc12	764078020	QFTVXQYLNRFZBT-UHFFFAOYSA-N	426.454	1.346	50	20	IDGD	
CC[C@@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(S(=O)(=O)N(C)C2CCCCC2)cc1	764083980	LEBJVSZIBLSKGO-CQSZACIVSA-N	438.550	1.772	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)CCc2ccccc2O)n([C@@H]2C[C@H]3CC[C@H]2C3)n1	764281181	LAVPYFAQXJQUCZ-BHYGNILZSA-N	425.489	1.977	50	20	IDGD	
CCN1CCN(Cc2ccc(NC(=O)C(=O)NNC(=O)Cc3ccccc3F)cc2)CC1	764319991	VTKNLNBLLJSTRX-UHFFFAOYSA-N	441.507	1.292	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cnc4c(c3)COCC4)n[nH]2)cc1	764384569	DMESTSRXPKZAMU-UHFFFAOYSA-N	434.456	1.507	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1F)C(=O)Nc1ccc(C(=O)N2CCOCC2)cc1	764410867	WBFZBVVKGHUZCV-UHFFFAOYSA-N	448.838	1.351	50	20	IDGD	
CCn1c(NNC(=O)[C@@H](C)NS(=O)(=O)c2cccc(C#N)c2)nc2ccccc2c1=O	764718363	XTAQFLJCQQQSEB-CYBMUJFWSA-N	440.485	1.098	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)[C@H](C)NS(=O)(=O)c2ccc(C#N)cc2)o1	765097422	GIWIWDBJEZALPS-AWEZNQCLSA-N	447.517	1.121	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)[C@@H](O)CCc1ccccc1	765176793	NTUWTXIFJFQZCU-NRFANRHFSA-N	444.963	1.599	50	20	IDGD	
CCOC(=O)NNC(=O)C(=O)Nc1ccccc1S(=O)(=O)N(C)C1CCCCC1	765414375	RJKDTYBXFBRXAY-UHFFFAOYSA-N	426.495	1.356	50	20	IDGD	
CS(=O)(=O)N1CCc2cc(C(=O)NNC(=O)c3cc(-c4cccs4)[nH]n3)ccc21	765569056	DNNXDMCLZATAMW-UHFFFAOYSA-N	431.499	1.535	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)CNC(=O)c3ccc(C#N)cc3)n[nH]2)cc1OC	765597418	SUZJEEAQCNMZPJ-UHFFFAOYSA-N	448.439	1.157	50	20	IDGD	
O=C(CCC(=O)N1CCN(c2ncccn2)CC1)NNC(=O)c1ccc(Cl)cc1F	765764702	AKRFPLUMQPSCNS-UHFFFAOYSA-N	434.859	1.159	50	20	IDGD	
O=C(NNc1cnccn1)C(=O)Nc1ccc(Cl)c(S(=O)(=O)N2CCCCC2)c1	766256993	ORESEKLOWJWQIC-UHFFFAOYSA-N	438.897	1.386	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)N1C[C@H](CC(=O)N(C)C)c2cc(Cl)ccc21	766265012	VBWUTJUBIMFYKC-NSHDSACASA-N	432.868	1.190	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)c1cc2c(=O)n3ccccc3nc2n1C	767271892	ROIPKOPLOMZFEO-UHFFFAOYSA-N	447.451	1.042	50	20	IDGD	
N#Cc1cnn(-c2ccc(C(=O)NNC(=O)c3cc(-c4ccc(F)cc4)[nH]n3)cc2)c1N	768276286	HIYFZUDAPOGCQS-UHFFFAOYSA-N	430.403	1.930	50	20	IDGD	
COc1ccc(Br)c(CC(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)c1	768702592	GLKJJENYANHPQR-UHFFFAOYSA-N	446.257	1.876	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H]2CCN(C(=O)OCc3ccccc3)C2)c1	770198825	GAMLRGBDLOHFFW-KRWDZBQOSA-N	445.497	1.510	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)CCNC(=O)Nc1ccc(Br)cc1	772024752	ZMBBWPOZLUUSRG-JTQLQIEISA-N	429.271	1.450	50	20	IDGD	
CC(C)(C)CC(=O)N1CSC[C@H]1C(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772889512	PPVGGDRRDMZRDO-AWEZNQCLSA-N	440.953	1.441	50	20	IDGD	
CN1CCN(C(=O)c2ccccc2NC(=O)C(=O)NNc2ccccc2[N+](=O)[O-])CC1	773655429	OJLGLSPNEQEEKL-UHFFFAOYSA-N	426.433	1.064	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)NC(=O)CO2	774010183	VRTROMOLXBQYAZ-JTQLQIEISA-N	432.820	1.224	50	20	IDGD	
O=C(COc1ccc(Cl)cc1)NNC(=O)Nc1ccc(C[C@@H]2NC(=O)NC2=O)cc1	775704323	ATXKXWXVVLNFMX-HNNXBMFYSA-N	431.836	1.322	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)COC2CCN(C(=O)OC(C)(C)C)CC2)c1	777097839	KEMABORUPAOSQY-UHFFFAOYSA-N	436.509	1.671	50	20	IDGD	
COc1ccc(Cn2cc(C(=O)NNC(=O)[C@H]3COc4ccccc4O3)cn2)cc1OC	777412799	UEXGUOMIOBYAKS-HXUWFJFHSA-N	438.440	1.550	50	20	IDGD	
COc1cc(OC)c(Cn2nccc2NC(=O)NNC(=O)Cc2cccnc2)c(OC)c1	779482755	MKZVQCUREROEBA-UHFFFAOYSA-N	440.460	1.748	50	20	IDGD	
CCNC(=O)N(C)NC(=O)CC(CC(=O)NN(C)C(=O)NCC)c1ccc(Cl)cc1	780711123	HERXICDLIFLKHN-UHFFFAOYSA-N	440.932	1.589	50	20	IDGD	
COC(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)c1	782887226	QZKHXFXSIWVTFF-UHFFFAOYSA-N	443.847	1.342	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)C(=O)Nc1ccc(Cl)c(Cl)c1	782896348	GFXABYZEWBKPFJ-UHFFFAOYSA-N	444.300	1.686	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)C(=O)Nc1ccc2ncccc2c1	782897181	LYJZGBMTELNSRY-UHFFFAOYSA-N	440.485	1.236	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)C(=O)Nc1ccc2[nH]ccc2c1	782898361	ZTYGLHURPOCLDI-UHFFFAOYSA-N	428.474	1.169	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2ccc(C(=O)N(C)[C@@H]3CCCN(C)C3)cc2)cc1	783036075	MEXZSYQZTHXJNG-LJQANCHMSA-N	439.516	1.943	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NN=c2cc[nH]cc2)cc1S(=O)(=O)N1CCCCCC1	783376393	NTHZDVYBVADTDR-UHFFFAOYSA-N	431.518	1.458	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)ccc1C(N)=O	783407814	GFKJCUGLZZCCPH-UHFFFAOYSA-N	444.391	1.469	50	20	IDGD	
CCCc1c(NC(=O)C(=O)NNc2ccc(-n3cccn3)nn2)cnn1-c1cc(C)ccn1	783437180	WANOIQYYDOKOQF-UHFFFAOYSA-N	446.475	1.586	50	20	IDGD	
O=C(NNC(=O)C(=O)N1CCCC1)C(=O)Nc1ccccc1Oc1cc(F)cc(F)c1	784002203	ATAKPVNZYJZXNR-UHFFFAOYSA-N	432.383	1.465	50	20	IDGD	
C[C@H](NC(=O)CNC(=O)COC(=O)/C(C#N)=C\c1ccc(O)cc1)c1ccc(F)cc1	784019392	FSRRVXAVUJQDHR-XGHPXPSOSA-N	425.416	1.975	50	20	IDGD	
CNS(=O)(=O)c1cccc(NC(=O)C(=O)NNc2ccc(Br)nc2)c1C	784811592	KTWDCYIIDCVAES-UHFFFAOYSA-N	442.295	1.142	50	20	IDGD	
O=C(NNc1ccc(Br)nc1)C(=O)Nc1ccc(N2CCOCC2)c(F)c1	784813988	VIJCGPIRWCMJHN-UHFFFAOYSA-N	438.257	1.902	50	20	IDGD	
CS(=O)(=O)N1CCc2c(NC(=O)C(=O)NNc3cc(F)c(F)cc3F)cccc21	784897795	YDIPBXOTAKSBLX-UHFFFAOYSA-N	428.392	1.508	50	20	IDGD	
N#Cc1ccc(Cn2cnc(NC(=O)C(=O)NNc3cccc(C(F)(F)F)n3)n2)cc1	784958707	QEUDZXXBNHJXDO-UHFFFAOYSA-N	430.350	1.694	50	20	IDGD	
CN(C)c1nccc(NNC(=O)C(=O)Nc2ccc(CC(=O)N(C)c3ccccc3)cc2)n1	784969786	PNQRVNNMIPXZCM-UHFFFAOYSA-N	447.499	1.830	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)[C@@H](C)N2CCc3ccccc32)cc1OC	788143565	LXERBWYFCRTJHW-CQSZACIVSA-N	427.457	1.459	50	20	IDGD	
O=C(NCCOCC(F)F)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	788322323	WUUYYXKGHBRTFG-UHFFFAOYSA-N	445.426	1.671	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	788867016	ONVDWFFBSMHAEP-UHFFFAOYSA-N	428.474	1.254	50	20	IDGD	
CS(=O)(=O)CCOc1ccc(Cl)cc1NC(=O)NNc1cc(Cl)nc(N)n1	789117209	AJCCUUMPTMELQF-UHFFFAOYSA-N	435.293	1.938	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1cccc2c1OCC[C@H]2N(C)C	789740869	JWJMVQCQQBGDPR-SCLBCKFNSA-N	444.463	1.764	50	20	IDGD	
CS(=O)(=O)CC[C@@H](C(=O)NNC(=O)c1cc(Br)c[nH]1)c1ccccc1	789875282	SRCFQOGNRSOKRV-CYBMUJFWSA-N	428.308	1.757	50	20	IDGD	
CC(=NNC(=O)c1cc(S(=O)(=O)NCc2ccccc2)ccc1O)c1ccc(O)nn1	790152902	ALZZVQPDTWBAGI-UHFFFAOYSA-N	441.469	1.520	50	20	IDGD	
Cn1nc([C@H]2CCCOC2)cc1NC(=O)C(=O)NNC(=O)Cc1ccc2ccccc2c1	790952874	WYBOJKFRHQKVPA-SFHVURJKSA-N	435.484	1.796	50	20	IDGD	
COc1cccc(C2=NO[C@H](C(=O)NNC(=O)c3cc(OC)c(OC)c(OC)c3)C2)c1	791445927	BIEAWFWBALVMAB-SFHVURJKSA-N	429.429	1.675	50	20	IDGD	
CC[C@@H](C)n1ncc(NC(=O)C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)c1C	792270757	GCZDEEBQRXBMPJ-LLVKDONJSA-N	449.537	1.164	50	20	IDGD	
CCOC(=O)c1csc([C@@H]2CCCN2CC(=O)NNC(=O)c2ccc(C#N)cc2)n1	792470897	MQCYZTSOQVZSAD-INIZCTEOSA-N	427.486	1.790	50	20	IDGD	
CS(=O)(=O)NCCc1ccc(C(=O)NNC(=O)c2cc3ccccc3cc2O)cc1	792520854	ISQRXUPOXHATBA-UHFFFAOYSA-N	427.482	1.712	50	20	IDGD	
CN(C)N(C(=O)CSc1nnc(C2CC2)n1Cc1ccccc1)[C@H]1CCS(=O)(=O)C1	792850048	NVMFBMSXGCVAEN-KRWDZBQOSA-N	449.602	1.788	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)o1	795169021	HVFMHLHZNLCLRO-UHFFFAOYSA-N	442.519	1.071	50	20	IDGD	
O=C(COC(=O)c1cc(F)ccc1-n1cccn1)NNC(=O)c1cccc([N+](=O)[O-])c1	796084382	HFTMLAQVLFBPNI-UHFFFAOYSA-N	427.348	1.538	50	20	IDGD	
CN(CCC(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1)C(=O)OC(C)(C)C	796836599	JCGXMEWMLVBVGQ-UHFFFAOYSA-N	442.538	1.408	50	20	IDGD	
CCCc1c(NC(=O)C(=O)NNC(=O)OCC)cnn1-c1cc(F)c(OC)cc1F	797013064	VMFZLTLYQSBLFN-UHFFFAOYSA-N	425.392	1.827	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2ccc(OC(F)F)c(C(F)(F)F)c2)CCS(=O)(=O)C1	797054770	LMECHMHWYTWMNZ-CQSZACIVSA-N	445.366	1.443	50	20	IDGD	
C[C@@](O)(CCc1ccccc1)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	801102398	PNDFAFLGJGDWSW-JOCHJYFZSA-N	445.541	1.616	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](CC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)C1CC1	802069133	XINGISUSVMNMTC-OAHLLOKOSA-N	440.522	1.936	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)c2csc(S(N)(=O)=O)c2)c(OC)cc1Cl	802078709	QZFPMGQLPBFTMJ-UHFFFAOYSA-N	434.883	1.533	50	20	IDGD	
COC(=O)c1c(F)cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)cc1F	802566333	JZEUPWNPOMBQDI-SECBINFHSA-N	439.346	1.444	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)N[C@@H]1CCCN(C(=O)CCC(F)(F)F)C1	804867526	DGNJWDGRLSIVFR-GFCCVEGCSA-N	434.390	1.868	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1cc(C(F)(F)F)ccc1Br	806505298	XQHSZVLZFJIWLK-ZCFIWIBFSA-N	447.233	1.558	50	20	IDGD	
COCCNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)Cc2cccc3ccccc23)c1	806976382	CGNQGQAGOKJBDX-UHFFFAOYSA-N	448.479	1.545	50	20	IDGD	
CC[C@H](C)N[C@@H](CNC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)c1ccco1	807439983	JJRQOBDXAYHGLB-BBRMVZONSA-N	426.477	1.600	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)NCc1ccccc1S(N)(=O)=O	807604884	MPLCYGPFHCMDNF-AWEZNQCLSA-N	442.497	1.785	50	20	IDGD	
Cc1cc(C(F)(F)F)nn1CC(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	810621613	OWRANBFGQQPNIH-UHFFFAOYSA-N	448.446	1.940	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)CNS(=O)(=O)c1ccc(Cl)cc1	811462680	VIEKPDJDPJXUEU-LLVKDONJSA-N	446.312	1.887	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NN=Cc3cn(C)nc3O)c2)cc1	814212777	XSFJURPVPAMQDF-UHFFFAOYSA-N	429.458	1.699	50	20	IDGD	
CCOc1nc2ccc(C(=O)OCC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)cc2[nH]1	815443424	XBRFVHRHEGBUDW-UHFFFAOYSA-N	427.373	1.488	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)cc2cccnc12	815566623	ZJQDSYQXEWOCEC-LBPRGKRZSA-N	426.404	1.936	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@@]2(c3ccccc3)CCC(=O)NC2)c2ccccc2c1=O	816805696	GASASUSUDSMNKA-QHCPKHFHSA-N	433.468	1.025	50	20	IDGD	
CC(=NNC(=O)c1cnccn1)c1ccc(S(=O)(=O)N2CCCC[C@@H]2C(=O)O)cc1	818286076	OYDCZJBLQRNCKO-QGZVFWFLSA-N	431.474	1.258	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)[C@H](CC(C)C)N2C(=O)[C@H]3CC=CC[C@@H]3C2=O)c1	863971748	DITLFVHJZKLAOD-FHWLQOOXSA-N	427.501	1.887	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)[C@@H]1CC(=O)N(Cc2ccccc2Cl)C1	863998959	GKAWJOMSNKGLPA-OAHLLOKOSA-N	431.876	1.924	50	20	IDGD	
CCN1CCC[C@H]1CNC(=S)NNC(=O)c1ccc(CSc2nncn2C)cc1	884065107	DOQILEROPRGXKP-INIZCTEOSA-N	433.607	1.701	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)c1ccccc1)N(S(C)(=O)=O)CC2	913161534	NEGYRCFYHNVYNF-KRWDZBQOSA-N	447.513	1.414	50	20	IDGD	
CN(Cc1ccc(C(=O)NC2CC2)cc1)C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	913462854	DWWNWWIPPZBFOU-UHFFFAOYSA-N	434.460	1.041	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)CSc1cccc[n+]1[O-]	914343895	SJQGAKHLIFIMRW-LLVKDONJSA-N	426.292	1.790	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NC2CC(C)(C)NC(C)(C)C2)c1	915881580	ZJSCMSDQOQJBRW-UHFFFAOYSA-N	425.555	1.190	50	20	IDGD	
COc1cccc([C@@H](CNC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)N(C)C)c1	915901425	UBQCDMYUBICGLK-GOSISDBHSA-N	434.518	1.346	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)NCCCN1C(=O)NC2(CCCC2)C1=O	915906082	HISYNPAADVVRNA-UHFFFAOYSA-N	431.493	1.213	50	20	IDGD	
CC(=NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1ccc(OCC#N)cc1	916258970	QXTSNBUUZKEDLJ-UHFFFAOYSA-N	442.497	1.764	50	20	IDGD	
CN1CCN(C(=O)c2ccc(CNC(=O)NNC(=O)Cc3ccc(F)cc3)cc2)CC1	916389840	AVZCTIYEXXBGGR-UHFFFAOYSA-N	427.480	1.286	50	20	IDGD	
Cc1cc(C)n(-c2ccc(CNC(=O)NNC(=O)c3nn(-c4ccccc4)cc3O)cn2)n1	916419491	KVKFDINPXXOQGV-UHFFFAOYSA-N	446.471	1.920	50	20	IDGD	
CCCNC(=O)c1cccc(CNC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c1	916478835	UNHHVEWLZQXUST-UHFFFAOYSA-N	432.502	1.374	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)CSc2nncs2)c2ccccc2c1=O	916735748	FPAXJAMTHUVDAO-UHFFFAOYSA-N	432.531	1.992	50	20	IDGD	
COCCOc1ccccc1CNC(=O)NNC(=O)c1sc(N2CCOCC2)nc1C	918775923	FJMXBPBBNKDAAH-UHFFFAOYSA-N	449.533	1.458	50	20	IDGD	
N#Cc1ccc(N2CCN(C(=O)NNC(=O)c3ccc(Br)s3)CC2)nc1	918778824	SDPLMMVZTJHPBM-UHFFFAOYSA-N	435.307	1.954	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H]2CCN(c3ccc(Cl)cc3)C2=O)c1	919712800	QWKMYJZXZQCENX-MRXNPFEDSA-N	435.889	1.558	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@H]2C(=O)NNC(=O)c2cccc(OC)c2O)c(OC)c1	919755767	CCQUIJFWELKAMA-INIZCTEOSA-N	443.456	1.484	50	20	IDGD	
O=C(NCc1ccc(-n2ccnc2)c(F)c1)NNC(=O)c1csc(N2CCOCC2)n1	920239015	SSNANNMUPZMMFB-UHFFFAOYSA-N	445.480	1.449	50	20	IDGD	
Cn1c(=O)nc(O)c2nc(CCC(=O)NNC(=O)c3cc4c(s3)CCCCCC4)[nH]c21	920275224	OTGHPPPVYXGCQL-UHFFFAOYSA-N	444.517	1.477	50	20	IDGD	
C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	920821187	WUVZNQXDWWNPKJ-SNVBAGLBSA-N	431.796	1.452	50	20	IDGD	
O=C(NCCc1cccs1)NNC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccccc2)C1	920859575	ZSKQFUFVUVUFFT-OAHLLOKOSA-N	436.559	1.722	50	20	IDGD	
O=C(NNc1cccc(Br)c1)C1=NN([C@@H]2CCS(=O)(=O)C2)C(=O)CC1	932478666	IXEAUDRJTMGHPW-GFCCVEGCSA-N	429.296	1.058	50	20	IDGD	
COc1ccc(C(=O)NNc2ccc(C(C)(C)C)nn2)cc1S(=O)(=O)N1CCOCC1	1318587323	YYDPPJXCTKBQBU-UHFFFAOYSA-N	449.533	1.561	50	20	IDGD	
O=C(NNC(=O)[C@]1(F)CCN(C(=O)OCc2ccccc2)C1)c1n[nH]c2c1CCCC2	1320096045	ZAKRSHKRQLGZLC-NRFANRHFSA-N	429.452	1.800	50	20	IDGD	
CNC(=O)Cc1ccccc1NC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	1320236772	BNNZRDQNNQQAQK-UHFFFAOYSA-N	438.532	1.340	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)[C@@H]2CC23CCS(=O)(=O)CC3)cc1C	1320941364	QHUBUZRWBYNDJG-LBPRGKRZSA-N	428.532	1.138	50	20	IDGD	
CCS(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2cncn2-c2ccccc2)cc1	1321016757	ZOYQQHJRVZYFTA-UHFFFAOYSA-N	427.486	1.810	50	20	IDGD	
COCCS(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2ccccc2Cl)cc1	1321119010	QURKTZJMZFWKBK-UHFFFAOYSA-N	425.894	1.904	50	20	IDGD	
O=C(NC[C@@H](c1ccccc1)N1CCOCC1)NNC(=O)c1cncn1-c1ccccc1	1321717705	BETCHXSODISGOG-FQEVSTJZSA-N	434.500	1.890	50	20	IDGD	
COC(=O)c1ccc(NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)c(C)c1	1323814889	AKNGUEDPFLWOHS-UHFFFAOYSA-N	448.501	1.563	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)CCc2nc3cccnc3[nH]2)c1	1327718205	NAOLPQRERZFXEN-UHFFFAOYSA-N	444.517	1.382	50	20	IDGD	
Cc1sc2ncc(C(=O)NNC(=O)C3CCN(C(=O)OC(C)(C)C)CC3)c(=O)n2c1C	1341777160	XPOWLRGPWBQGHR-UHFFFAOYSA-N	449.533	1.781	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4nonc4c3)C2)C1	1777718607	BZDJFCJRJKXQIJ-MSOLQXFVSA-N	427.288	1.903	50	20	IDGD	
O=C(c1ccc2[nH]ccc2n1)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1778491438	UNADJCQDVXORLO-WMLDXEAASA-N	425.258	1.697	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc4n(n3)CCCO4)C2)C1	1778558902	WQWXPNGMAWTGLD-FZKQIMNGSA-N	441.326	1.283	50	20	IDGD	
O=C(c1ccc2cncn2c1)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1778692353	KZRGUJDZQCPENA-WMLDXEAASA-N	425.258	1.468	50	20	IDGD	
C=CC[C@@H](C(=C)C)C(=O)N1CC[C@@]2(CN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CCO2)C1	1778882134	RPNRWAHHHIPPRV-OCAHMQCSSA-N	441.532	1.719	50	20	IDGD	
Cn1c(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@](C)(Cl)CCl)C2)cccc1=O	1780710369	QRQVGIXRLBUSLJ-UIAACRFSSA-N	444.359	1.749	50	20	IDGD	
Cc1ccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C3)c(F)c1	1780857167	HZYCEHBMPRXYIK-AUSIDOKSSA-N	448.539	1.635	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Cl)C2)c1ccc(O)c([N+](=O)[O-])c1	1780873648	VPFUWPZSQGZCQI-IIDMSEBBSA-N	429.832	1.962	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)C3(Br)CC3)CCO2)C1	1781234509	NUPCLNPHFSNSPK-KBPBESRZSA-N	428.154	1.980	50	20	IDGD	
O=C(c1n[nH]c(C2CC2)c1F)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781328005	GJBNSRLKGHSAEG-CZUORRHYSA-N	433.253	1.560	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Cl)C2)[C@H]1CC(c2ccccc2)=NN1	1781449860	VANHMPFYKOLMHO-NEYJZJCJSA-N	436.915	1.801	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1c(F)c(C)nn1C)C2	1782171028	NUYCRFLHVHHUBN-PJIJBLCYSA-N	430.908	1.249	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cnc4ncccn34)CCO2)C1	1783348022	SBHMECWNEONFKY-UGSOOPFHSA-N	436.310	1.346	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cc4n(n3)CCC4)CCO2)C1	1783349346	KSBGJJRWFUYEOF-KSSFIOAISA-N	425.327	1.446	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)/C=C/c3ccc([N+](=O)[O-])o3)CCO2)C1	1783529782	MVWNPMXHHNASSU-CRVRJFCGSA-N	442.266	1.814	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](C)Nc1cccnc1)CCO2	1783532487	IUVPLJYAYGLQFN-IYOUNJFTSA-N	425.327	1.495	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(-n4cccn4)nc3)CCO2)C1	1783538045	SAKOXLHGUGNKOM-LIRRHRJNSA-N	448.321	1.494	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)C(C)(C)CCl)[C@H]3C2)n1	1783846391	RDSWHKHCBHCGIA-ZOBUZTSGSA-N	436.940	1.898	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)Cc3c[nH]c4cc(OC)ccc34)CCO2)C1	1783871161	NINYVMLQUCBYBD-AVRDEDQJSA-N	449.935	1.803	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3[nH]cnc3-c3cccnc3)CCO2)C1	1783881367	LAIRCWZGYOIOKK-MGPUTAFESA-N	433.896	1.169	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)c1	1785111972	VJFDSVYEEHTAQF-YJBOKZPZSA-N	442.285	1.779	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc(OCF)cn3)[C@H]2C1	1785687266	URPMWUGFAOIKLN-DZKIICNBSA-N	440.548	1.227	50	20	IDGD	
CN(C)c1cncc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCBr)[C@H]3C2)c1	1786401098	OCVZBXYMQZSVAH-JQFCIGGWSA-N	439.354	1.526	50	20	IDGD	
Cc1nc(N)sc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21	1786918942	NHWCTAJMMJSIJJ-GMOBBJLQSA-N	435.319	1.318	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc(Br)nc3)C[C@@H]21)[C@@H](F)Cl	1787449374	PLGDDMRIDHXRSC-WFGGJUAMSA-N	448.720	1.901	50	20	IDGD	
Cc1cc(C(=O)NC2(c3ccc(NC(=O)c4cnccc4C(=O)NN)cc3)CCC2)nn1C	1789521316	WASSIYBKMNHOJB-UHFFFAOYSA-N	447.499	1.789	50	20	IDGD	
CN(C)c1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]3C2)nc1	1789868676	IURGAAFXAACTHH-GGLFYADGSA-N	443.375	1.977	50	20	IDGD	
Cc1ccc(CCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]3C2)cn1	1789922109	HGYASCRHQXBSNN-OVWQWFNUSA-N	442.329	1.993	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4nc[nH]c4c3)C[C@@H]21)[C@H](F)Br	1789925295	DPORLVIISKECBF-APYUEPQZSA-N	439.285	1.847	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCN(C)C(C)=O)C[C@@H]21	1790958709	ZWYZUDPYXYLWMM-VGWMRTNUSA-N	432.359	1.008	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21	1792125835	WYHRDXFTCUFDTL-AVGNSLFASA-N	438.352	1.685	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C=C/c3ccc(O)c(O)c3O)[C@H]2C1	1792218148	RMPWYRWFIZKBQR-FBAXNIALSA-N	438.908	1.814	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN1CCc2sccc2C1	1793896544	LPXNARTWEBCKCH-YYAJDYIMSA-N	425.982	1.713	50	20	IDGD	
Cc1cc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Br)C3)ccn1	1793915222	TZQWADMQMAOTRJ-YALNPMBYSA-N	428.302	1.603	50	20	IDGD	
Cn1nccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1794141119	LAQQIQOHBSDZMN-XGUBFFRZSA-N	439.944	1.804	50	20	IDGD	
CN(CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccno1)NC(=O)NCc1ccccc1	1795099606	GZGYYPZRAVFQLO-BCDXTJNWSA-N	440.504	1.273	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cn2cc(F)ccc2n1	1797430183	GLGUYBREAXFALS-OVZMXSCWSA-N	439.285	1.460	50	20	IDGD	
Cc1cc2cccc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)c3cccc(B(O)O)c3)C4)c2[nH]1	1797507706	XKUGMOGLNUAMAY-ACDBMABISA-N	431.301	1.722	50	20	IDGD	
Cc1nc2sccn2c1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2	1797544621	YLLGFZFXEXLPNW-DABQJJPHSA-N	441.351	1.692	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@]1(C)C[C@@H]1C)C2	1798524555	GFWGCWCUJUHOGJ-MRRNNNFUSA-N	445.472	1.769	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H]1CCOC1)C2	1799220432	NJGJJDYQYWWGNO-LVQVYYBASA-N	431.445	1.808	50	20	IDGD	
C[C@H](Nc1nccs1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@](C)(Cl)CCl	1799275368	QKRYYPUPUCTRIV-QLLRCSDMSA-N	435.377	1.769	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc3ccoc3c1)C2)[C@@H](F)Br	1799346190	IEMXJAMQSYJPGY-BAESOJJISA-N	426.242	1.722	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)CN(CC)CC	1800225961	LOBQAKNOQYMMSW-SIRPWMCASA-N	432.403	1.727	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3n[nH]cc3c1)C2	1800639621	KREKFKGOCGEFKR-JYYAWHABSA-N	435.322	1.940	50	20	IDGD	
Cc1cccc2c(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)c3ccc(B(O)O)cc3)C4)n[nH]c12	1801123541	YAAGJSNEGQILAV-BCDXTJNWSA-N	432.289	1.117	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C[C@@H](O)CNC(=O)OC(C)(C)C)C2	1802282840	IMUQVBQIIMFPRS-YIDVYQOGSA-N	447.960	1.154	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc3cc(O)ccc3n1)C2	1802336661	SKILPSZJLRKVII-BJWYYQGGSA-N	439.516	1.565	50	20	IDGD	
COc1c(Cl)ccnc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCC(=O)NN(C)C	1802337029	QPQGXMJXLYHHAE-BTTYYORXSA-N	437.928	1.368	50	20	IDGD	
C[C@@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnccc1C(=O)NN)C2)c1cccs1	1802852875	YZRJMZFOMJACLM-APIJFGDWSA-N	427.530	1.802	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2[nH]nc3ncccc23)[C@H]1c1cccnc1)[C@@H](O)CCl	1803140241	YQKLNFOECUKHRX-QRTARXTBSA-N	428.880	1.272	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H]2CCc3nc[nH]c3C2)[C@H]1c1cccnc1)[C@@H](O)CCl	1803147130	TUIZXYHFWVTUGC-UVDFWXMISA-N	431.924	1.215	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)[C@@H]2CNC(=O)O2)[C@@H]1c1cccnc1	1803649578	DCGMZGOJESMSCL-AJNGGQMLSA-N	439.310	1.369	50	20	IDGD	
O=C(CCBr)NC[C@@H]1CCN(C(=O)c2cc(CO)on2)[C@@H]1c1cccnc1	1806344042	VKTFOGUAIGQHEC-SUMWQHHRSA-N	437.294	1.667	50	20	IDGD	
Cc1nn[nH]c1C(=O)NC[C@@H]1CCN(C(=O)[C@H](C)CBr)[C@H]1c1cccnc1	1807797536	LSCFWGLNDWTIHH-WPGHFRTFSA-N	435.326	1.859	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1)c1cc(O)nc(O)c1	1807989339	AVCDVAQFMLLSSM-ACJLOTCBSA-N	449.305	1.992	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2csnn2)[C@@H]1c1cccnc1)[C@@H](F)Br	1808649182	LDDXJTHNIVQZCG-CYZMBNFOSA-N	428.287	1.943	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)c2cc(=O)ccn2C)[C@@H]1c1cccnc1	1811368078	YDDFGIWSOGCJOD-YEWWUXTCSA-N	447.333	1.883	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2cc(C(=O)O)ncn2)[C@H]1c1cccnc1	1813029829	YXQVUDXALMDDKS-KEYYUXOJSA-N	447.879	1.143	50	20	IDGD	
COC(=O)NCC(=O)NC[C@@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1	1813264287	CIQXURBOXFJVCM-BBRMVZONSA-N	427.299	1.228	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H]2C[C@@H]2F)[nH]n1	1818113769	XZTFQQCCJNJFHE-QAQAHDPMSA-N	429.456	1.894	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H]2CCCCO2)[nH]n1	1819400441	KRIKIQCGUSBWNC-SJORKVTESA-N	441.492	1.283	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)nn1C	1822413405	URLXMHNHYPSPHH-INIZCTEOSA-N	430.513	1.131	50	20	IDGD	
O=C(CCn1cncn1)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](F)Br)[nH]n1	1822682732	CMDDLBRVIZEJAP-BXUZGUMPSA-N	428.266	1.774	50	20	IDGD	
Cc1cccc(CC(=O)N2CCCC[C@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)n1	1824286556	PPRKQWUAQPKMJJ-NRFANRHFSA-N	443.592	1.925	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1CCc2nc(NC(=O)C3(F)CC3)sc2C1	1824843683	BFNURSHAOZUZCH-IVWJEFBKSA-N	432.481	1.691	50	20	IDGD	
CC(C)CNC(=O)C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](C)Br)sc2C1	1825642302	VKZJRRWRTWBVEN-ZJUUUORDSA-N	431.356	1.611	50	20	IDGD	
COc1cccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)n1	1825673011	OJLBWILHEWXZQQ-LJQANCHMSA-N	445.564	1.697	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnc(OCF)cn1)CC2	1825994161	QXHFGFWZHJTHCS-VHSXEESVSA-N	443.888	1.719	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H]2CCCCO2)CC1	1828922106	MEXHDNBHGUEFEH-WOJBJXKFSA-N	443.548	1.488	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccccc3O)C2)C1	1830535861	VKWSKOZGGJRPOX-AUUYWEPGSA-N	441.322	1.493	50	20	IDGD	
C=CCO[C@H](C)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H](C)CBr)CCO2)C1	1830536086	XXTVFIMJTZZDAJ-HDMKZQKVSA-N	433.343	1.065	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3cnc4ccccn34)CCO2)C1	1830654671	BBOWCOINTJFFSO-XMSQKQJNSA-N	448.951	1.741	50	20	IDGD	
O=C(c1cc(F)cc(Cl)c1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1830738796	TXAIGUBCJXHFCR-CRAIPNDOSA-N	435.279	1.149	50	20	IDGD	
COc1cccc(Cl)c1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1830738940	VXBCOKIMBYZOAH-IFXJQAMLSA-N	447.315	1.018	50	20	IDGD	
O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)C(F)(F)C(F)F)CCO2	1832184731	WMZFRZDOAONKFP-ZDUSSCGKSA-N	435.212	1.128	50	20	IDGD	
C[C@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)c3ncc[nH]3)CC2)CC1	1833262450	QGLRVDKVCKPOCQ-CYBMUJFWSA-N	426.359	1.626	50	20	IDGD	
CC[C@@H](C(=O)NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)N(CC)CC	1833535920	SOZNHNGYVOILOG-RBUKOAKNSA-N	431.021	1.278	50	20	IDGD	
COc1ncc(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](F)Cl)CC3)CC2)cc1F	1833966487	QMZCIFZVJWZABZ-MRXNPFEDSA-N	430.883	1.949	50	20	IDGD	
O=C(c1cnccc1C(F)(F)F)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1834111927	RMAWPCNJXXDPIR-XJKSGUPXSA-N	439.793	1.705	50	20	IDGD	
Cc1ncoc1C(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)Br)CC2)CC1	1834262432	HOVNNDVOVDQCQH-GFCCVEGCSA-N	427.343	1.952	50	20	IDGD	
CCn1nccc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)CBr)C2)C1	1834411171	HQHBIXSAEXONBK-KDOFPFPSSA-N	443.342	1.004	50	20	IDGD	
COc1ccc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCBr)CCO3)C2)s1	1834818902	FQHNAXIREGJZPV-QGZVFWFLSA-N	447.351	1.612	50	20	IDGD	
CC[C@H](C)[C@H](N)C(=O)N1CCC(N2CCC(NC(=O)CO[Si](C)(C)C)CC2)CC1	1835833540	PGBVXHYPBSNNEU-JXFKEZNVSA-N	426.678	1.783	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCC(OC2CCN(C(=O)[C@H]3CCNC(=O)C3)CC2)CC1	1836624102	BQFBZUNSTBMIAQ-HNNXBMFYSA-N	427.973	1.776	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(F)nc3)CCO2)C1	1837840085	DUPGDUCFDLSCGZ-UGSOOPFHSA-N	444.301	1.322	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)c3cnc(O)[nH]3)CC2)CC1	1838479512	HLBYIFXQVWFYEQ-CQSZACIVSA-N	443.342	1.901	50	20	IDGD	
CC(C)c1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCBr)C3)C2)n[nH]1	1838695101	DJTRLHKDNIGIEF-GOSISDBHSA-N	443.342	1.388	50	20	IDGD	
O=C(c1cccc2nccn12)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1839552985	GIEUIUOADODVDD-GOSISDBHSA-N	427.288	1.208	50	20	IDGD	
CCc1cnc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)s1	1840033489	HHNBAQSALRZORB-SJKOYZFVSA-N	446.367	1.559	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCCn3ccnc3)CCO2)C1	1840383717	AFGSDLGFAGCPHQ-RTBURBONSA-N	447.363	1.356	50	20	IDGD	
Cc1cc(Cl)cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)c1	1840696468	SFCILCGDUKWDGF-APWZRJJASA-N	431.316	1.318	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)Cc2cccc(C(F)(F)F)n2)C1	1842035341	DGQLBHKQTZIZJJ-UHFFFAOYSA-N	441.454	1.219	50	20	IDGD	
CC(C)(C)OC(=O)N1CCOC[C@H]1C(=O)N1CCCC12CN(C(=O)C(Cl)Cl)C2	1843347615	QHMPKMHPLOUGDE-LBPRGKRZSA-N	436.336	1.629	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2ccc3cccnc3n2)C1	1844022922	FPCNHZUGAGRFGY-JFLMPSFJSA-N	445.483	1.581	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)C1=NO[C@@H](c3ccccc3)C1)C2	1844264421	RENSDGHAJAFPGD-LJQANCHMSA-N	448.483	1.020	50	20	IDGD	
C[C@H]1[C@@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](O)CCl)CCCN1C(=O)OC(C)(C)C	1847565563	URUQAWABLWQJOD-WOYTXXSLSA-N	443.972	1.824	50	20	IDGD	
CCC(=O)N[C@H](C)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1847736590	NDVVHQBFRWHBGR-QPSCCSFWSA-N	444.960	1.235	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H]1CC(=O)N(Cc2cccs2)C1	1848148499	DEVZKJMYWGQFBS-HJWJTTGWSA-N	439.965	1.552	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)C1CCN(Cc2ccccn2)CC1	1848246105	TWSTYEJGXQXDDK-UFYCRDLUSA-N	434.968	1.749	50	20	IDGD	
CC(C)c1noc2ncc(C(=O)NNC(=O)c3ccc(Cl)c(S(N)(=O)=O)c3)cc12	10414549	KONOKDQNHDGSCD-UHFFFAOYSA-N	437.865	1.722	50	20	IDGD	
Nn1c(SCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)nnc1-c1cccc(Cl)c1	11310449	HOCGNEXJUFBNKJ-UHFFFAOYSA-N	447.864	1.774	50	20	IDGD	
COC(=O)CCn1c(SCC(=O)NNC(=O)c2ccccc2)nc2ccccc2c1=O	17181022	QATMBDVEOZEQOH-UHFFFAOYSA-N	440.481	1.513	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)OCc2nc(N)nc(N(C)C)n2)c(C)n1C[C@H]1CCCO1	24897898	MFMSJFKAFZYSAQ-JDZKTDJGSA-N	425.493	1.768	50	20	IDGD	
Cc1ccc([C@@H](CNC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)N2CCCC2)o1	725871676	KCFNORMRGZNMJX-QGZVFWFLSA-N	434.518	1.773	50	20	IDGD	
CN(C)N(C(=O)c1cccc(N2C(=O)c3ccccc3C2=O)c1)[C@H]1CCS(=O)(=O)C1	728178792	VEDQPUPCHMHTLA-INIZCTEOSA-N	427.482	1.593	50	20	IDGD	
CC(C)[C@H](C(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)S(=O)(=O)C1CCCCC1	728512156	MKAZPMNFXAOJII-GOSISDBHSA-N	448.545	1.467	50	20	IDGD	
NS(=O)(=O)c1ccc(CC(=O)NNC(=O)c2cc(F)ccc2Br)cc1	728612234	MFXQWYVYIBWARA-UHFFFAOYSA-N	430.255	1.239	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)Cc2c(C)nc3cc(O)nn3c2C)cc1	729282729	HASFIIDTSIHLQR-CQSZACIVSA-N	427.461	1.608	50	20	IDGD	
C[C@@H]1CCCCN1CCOc1ccccc1C(=O)NNC(=O)CNC(=O)c1ccco1	729532150	ZJNLXDMWNOCCJR-MRXNPFEDSA-N	428.489	1.724	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Cc2ccccc2F)cc1S(=O)(=O)NC(C)(C)C	731330393	PAFLQQBBGBHHTB-UHFFFAOYSA-N	437.493	1.915	50	20	IDGD	
CC1CCC(N2C[C@H](C(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)CC2=O)CC1	731341312	AKDHLOYWYZHVGS-SHARSMKWSA-N	425.489	1.122	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)NCC1CCN(S(=O)(=O)c2ccccc2)CC1	731500248	HSTIZFYRSLDCNF-UHFFFAOYSA-N	446.529	1.740	50	20	IDGD	
CNS(=O)(=O)C1CCN(C(=O)/C(C#N)=C/c2cc(C)n(C[C@@H]3CCCO3)c2C)CC1	732126146	CAJOEQPFVPBULL-GQEMFKIVSA-N	434.562	1.731	50	20	IDGD	
CNc1cc(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)cc(Cl)n1	732285742	LWEHTFAMOQGIJZ-UHFFFAOYSA-N	438.941	1.470	50	20	IDGD	
O=C(NN=Cc1nc(-c2ccc(Br)cc2)c[nH]1)N[C@H]1CCS(=O)(=O)C1	732712890	SEQSXHQPFLXYBJ-LBPRGKRZSA-N	426.296	1.659	50	20	IDGD	
CN1C(=O)C[C@H](C(=O)NNC(=O)COc2ccc(C#N)cc2)[C@@H]1c1cccc(Cl)c1	734417635	SQYOBMRTTJWQLX-PXNSSMCTSA-N	426.860	1.957	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NC[C@H]2CCc3ccccc3C2)cc1	735386726	XVKFGPRTALUHDU-KRWDZBQOSA-N	444.557	1.751	50	20	IDGD	
CC(C)c1nc(C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)nn1-c1cccc(F)c1	735461556	IAGOFFZFJRZEIZ-UHFFFAOYSA-N	449.446	1.852	50	20	IDGD	
CCc1ccc(O[C@H](C)C(=O)N2CCN([C@@H](C)C(=O)NNC(=O)CC(C)C)CC2)cc1	736620863	DSLCFNZKKKFLTI-ZWKOTPCHSA-N	432.565	1.743	50	20	IDGD	
Cc1nc(-c2cccnc2)nc(NNC(=O)CN2C(=O)COc3ccc([N+](=O)[O-])cc32)c1C	736690439	ANWHMGHJLIUBPA-UHFFFAOYSA-N	449.427	1.932	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc(NC(C)=O)c1OC	742478824	RIRVHHPGAKNGSA-UHFFFAOYSA-N	449.489	1.030	50	20	IDGD	
CC(C)c1nn([C@@H]2CCS(=O)(=O)C2)cc1C(=O)NNC(=O)COCc1ccccc1	742693231	XKXVZWCZFLNONO-MRXNPFEDSA-N	434.518	1.344	50	20	IDGD	
O=C(NNC(=O)c1cccc(OC(F)F)c1)N[C@H]1CC(=O)N(CCOc2ccccc2)C1	743587581	JTQVJGWWZKXMPK-HNNXBMFYSA-N	448.426	1.912	50	20	IDGD	
CNS(=O)(=O)c1ccc(C)c(C(=O)NNC(=O)Nc2ccc(OC(F)F)cc2)c1	743833020	YUGHJUSCZRIAEN-UHFFFAOYSA-N	428.417	1.971	50	20	IDGD	
CNS(=O)(=O)c1ccc(CCC(=O)NNC(=O)Nc2ccc(OC(F)F)cc2)cc1	743833108	FWDDYOGUJURBBV-UHFFFAOYSA-N	442.444	1.982	50	20	IDGD	
CC(C)[C@@H](C(=O)OCC(=O)NNC(=O)c1cccc(C#N)c1)S(=O)(=O)C1CCCCC1	744953421	KZVXPHXVGJUMLD-IBGZPJMESA-N	449.529	1.635	50	20	IDGD	
CC(=O)c1cccc(O[C@H](C)C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)c1	745108071	VAZIDZSZWYBTII-LLVKDONJSA-N	439.877	1.419	50	20	IDGD	
O=C(COC(=O)[C@H]1C[C@@H]1c1ccc2c(c1)OCCO2)NNC(=O)c1ccc([N+](=O)[O-])cc1	745285882	LVNALPGZFRTKGC-CVEARBPZSA-N	441.396	1.474	50	20	IDGD	
O=C(CCn1c(S)nnc1-c1cccs1)NNC(=O)Cc1cn2ccccc2n1	746702194	QLYDZVMAVWDJNW-UHFFFAOYSA-N	427.515	1.723	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN1C1CCCC1)c1ccc(S(=O)(=O)N2CCCC2)cc1	747649941	XJNHRRRJAPVYAL-IBGZPJMESA-N	434.562	1.639	50	20	IDGD	
COc1ccc(C(=O)NNc2nccn(C)c2=O)cc1S(=O)(=O)N[C@H]1CCCC[C@H]1C	747941468	GMQDDGJJBCHAII-HIFRSBDPSA-N	449.533	1.403	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)[C@](C)(O)[C@@H](C)c2ccccc2)cc1OC	748484866	UICCQSOLTDNLED-RCDICMHDSA-N	430.457	1.563	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)CSCC(=O)c1ccccc1	748547872	ZXBSQJIFGZOGFE-UHFFFAOYSA-N	434.543	1.665	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCCCNC(=O)c2ccccc2)nc1	750326786	QMCJBTAWWJKTJD-UHFFFAOYSA-N	448.549	1.558	50	20	IDGD	
CC(C)n1nc(C(=O)NNS(=O)(=O)c2cccc3c2OCCO3)c2ccccc2c1=O	751262922	RLMXYDJWBQTJKW-UHFFFAOYSA-N	444.469	1.372	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)NNC(=O)c2cccc(Br)c2)ccc1F	752521926	WFKGMLAQIWFFPU-UHFFFAOYSA-N	430.255	1.571	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)NC[C@H]2CCC[C@@]23NC(=O)N(C)C3=O)c1	753023292	MWSWDNFYNNGJFD-IVZQSRNASA-N	445.520	1.548	50	20	IDGD	
NC(=O)[C@H]1CC(C(=O)NNC(=S)NCCc2cccs2)=NN1c1ccc(F)cc1	753078338	OJWMPRHBCPNGRB-OAHLLOKOSA-N	434.522	1.045	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N[C@H](C)C[S@](C)=O)cc1	753149652	BXHBFYGABPRFMJ-HBZQIUCVSA-N	443.529	1.224	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)NCC(=O)NNc2ccc(C#N)c(Cl)c2)cc1	753297894	FEWYBTLTYJQACV-UHFFFAOYSA-N	436.877	1.810	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2ccc(CNS(C)(=O)=O)o2)ccc1OC(C)C	753564675	GSPCGLPYSIZSLD-UHFFFAOYSA-N	425.463	1.199	50	20	IDGD	
CNC(=O)CN1CCN(C(=O)/C(C#N)=C\c2cn(CCC#N)nc2-c2ccccc2)CC1	754390033	UPGRYRGFFHSNSX-RGEXLXHISA-N	431.500	1.261	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)[C@@H](C)c2ccc([N+](=O)[O-])cc2F)cc1OC	755064484	KIDGHFDOKOWEBK-NSHDSACASA-N	449.391	1.859	50	20	IDGD	
C[C@H](NC(=O)OC(C)(C)C)[C@@H](C)C(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	755381298	FFFGEQXQHBBOMW-NEPJUHHUSA-N	426.901	1.653	50	20	IDGD	
CN(C1CCCCC1)S(=O)(=O)c1ccc(NC(=O)NNC(=O)c2cnn(C)c2)cc1	755447532	QIEYDECJNMSGNM-UHFFFAOYSA-N	434.522	1.840	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)ccc1N1CCCC1=O	755591353	FUIYALJLOYVHGU-UHFFFAOYSA-N	436.432	1.264	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)c(Cl)c1)Nc1ccc(CC(=O)N2CCOCC2)cc1	755863088	ZLDZRPWEMBJERL-UHFFFAOYSA-N	432.864	1.913	50	20	IDGD	
COC(=O)c1ccc(NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1Cl	756643191	UAAGUALCIANUTB-UHFFFAOYSA-N	432.868	1.986	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)Nc3ccn(CCN4CCOCC4)n3)cc2C1	756646146	LIQPJUHHNRRWND-AWEZNQCLSA-N	432.550	1.868	50	20	IDGD	
COc1ccc(S(=O)(=O)NC(C)(C)C)cc1NC(=O)NNC(=O)Cc1cccnc1	756671823	IXJPHGKMJWBPBJ-UHFFFAOYSA-N	435.506	1.562	50	20	IDGD	
CNS(=O)(=O)c1cccc(NC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c1C	757722369	ZSTRXUIMURKSNI-UHFFFAOYSA-N	428.474	1.555	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2ccccc2CN2CCNC2=O)c2ccccc2c1=O	757925973	ZHHQMDQOFOLORL-UHFFFAOYSA-N	449.471	1.408	50	20	IDGD	
COC(=O)C12CCC(C(=O)NNC(=O)c3nn(C(C)C)c(=O)c4ccccc34)(CC1)C2	760066268	MHMUSSKTTLYAJL-UHFFFAOYSA-N	426.473	1.862	50	20	IDGD	
CSc1cccc(N2C[C@H](C(=O)NNC(=O)CCNC(=O)OC(C)(C)C)CC2=O)c1	760439859	MKMLVSIPGBCUGK-CYBMUJFWSA-N	436.534	1.824	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@H](CCC(N)=O)C(=O)NNc2c(C)cccc2F)cc1C	760515682	AKLRYFMJUUPSGY-QGZVFWFLSA-N	436.509	1.807	50	20	IDGD	
CC(=O)Nc1cc(NC(=O)C(=O)NNC(=O)c2ccccc2Br)ccc1F	763483128	NRYSMJIKWIHCOS-UHFFFAOYSA-N	437.225	1.946	50	20	IDGD	
COC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)c1C	763539110	IQMDFKAAYBHENB-UHFFFAOYSA-N	445.428	1.207	50	20	IDGD	
Cc1nn(-c2ccc(Br)cc2)cc1C(=O)NNC(=O)CNC(=O)c1ccco1	763564199	FHTNLSFHBHCFSZ-UHFFFAOYSA-N	446.261	1.727	50	20	IDGD	
CCCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)COc2cccc(C)c2)cc1	763622891	HPPIIZZJBZKHFJ-UHFFFAOYSA-N	448.501	1.312	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1cccc(C(=O)NC(C)(C)C)c1	763630256	YKOOFUWRJDWXJP-UHFFFAOYSA-N	436.472	1.571	50	20	IDGD	
COC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)COc2cc(C)cc(C)c2)cc1F	763651256	ZJPLGGKFWVBENA-UHFFFAOYSA-N	432.408	1.786	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N2CCC[C@H](S(C)(=O)=O)C2)cc1Br	763662326	XIAVLRVLRXLBBP-NSHDSACASA-N	434.312	1.321	50	20	IDGD	
Cc1cc(N2CCOCC2)ccc1NC(=O)C(=O)NNC(=O)COc1ccc(Cl)cc1	763685968	GWKCFQGCTXFVLI-UHFFFAOYSA-N	446.891	1.650	50	20	IDGD	
Cc1nc(-c2ccc(NC(=O)C(=O)NNC(=O)COc3ccc(Cl)cc3)cc2)n[nH]1	763694994	MZPIMBOIHWRDHX-UHFFFAOYSA-N	428.836	1.598	50	20	IDGD	
CC(C)C(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)cc1	763729426	ZJOAAPFGHSATJP-UHFFFAOYSA-N	437.500	1.820	50	20	IDGD	
CNS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)CC23CC4CC(CC(C4)C2)C3)cc1	763736906	UDDKSNABSQZRDM-UHFFFAOYSA-N	448.545	1.287	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)cc1NC(C)=O	763841984	VXYKFYVCSWRBPV-AWEZNQCLSA-N	442.472	1.824	50	20	IDGD	
COCCn1cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc3ccccc3c2)cn1	763851880	VZJPRUQPJPZHNM-CQSZACIVSA-N	425.445	1.236	50	20	IDGD	
C[C@H]1CCC2=S=C(C(=O)NNC(=O)C(=O)Nc3ccc(S(C)(=O)=O)cc3)C=C2C1	763939189	ALTFUKHWVXIVQD-NSHDSACASA-N	435.527	1.014	50	20	IDGD	
CC1(C)Cc2cc(NC(=O)C(=O)NNC(=O)c3nn(-c4ccccc4)cc3O)ccc2O1	763949729	REEXWJALMRCHKA-UHFFFAOYSA-N	435.440	1.691	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)C(=O)Nc1ccc(-n2cccn2)c(F)c1	763950164	UEAOQHHXYQWJTM-UHFFFAOYSA-N	449.402	1.302	50	20	IDGD	
COC(=O)c1c(F)cccc1NC(=O)C(=O)NNC(=O)c1cc(Br)cn1C	764005016	RKAHGHWKZGRPPA-UHFFFAOYSA-N	441.213	1.113	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1ccc(Oc2cccnc2)nc1	764006609	RAFHKANCDQWZQH-UHFFFAOYSA-N	435.396	1.440	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1cccc(Cn2cncn2)c1	764019229	JFTIGGMGPXJTAT-UHFFFAOYSA-N	428.836	1.388	50	20	IDGD	
O=C1COc2ccc(NC(=O)C(=O)NNC(=O)c3cccc(Br)c3)cc2N1	764063391	PGANCZTXEMWYMW-UHFFFAOYSA-N	433.218	1.180	50	20	IDGD	
CCN(CC)C(=O)COc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)nc2)c1	764097197	BKWQNZBUYNVQAU-UHFFFAOYSA-N	447.879	1.382	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2ccnn2Cc2ccccc2F)cc1	764125773	BLXOQPXMZAFTTN-UHFFFAOYSA-N	439.447	1.798	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)NCC(C)C)cc2C)c1O	764131483	PNXAHVXFUZRDQL-UHFFFAOYSA-N	442.472	1.495	50	20	IDGD	
CCCC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2cccc(OC)c2O)c1C	764132691	PLYHDOUIYKLXDE-UHFFFAOYSA-N	428.445	1.848	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2O1)C(=O)Nc1cccc(OC[C@H]2CCCO2)c1	764154493	REMQZXJLYWSJQH-IEBWSBKVSA-N	425.441	1.334	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2O1)C(=O)Nc1ccc(OC(F)F)c2ncccc12	764169043	SHCOYUOCKGAYNI-MRXNPFEDSA-N	442.378	1.926	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)CC2CCCC2)cc1OCC(=O)NC1CC1	764183160	CXSBSQKXCAJBLO-UHFFFAOYSA-N	432.477	1.019	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)C(=O)Nc1ccccc1C(F)(F)F	764260310	QPWWAZALFZMEHT-UHFFFAOYSA-N	436.394	1.498	50	20	IDGD	
CN(C)CCOc1cccc(NC(=O)C(=O)NNC(=O)c2cccc(OC(F)F)c2)c1	764260362	WJGXGQBNNPXKCU-UHFFFAOYSA-N	436.415	1.628	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C)c(NC(=O)CN3CCCCC3)c2)o1	764370470	CKAKNPNSSXBEJD-UHFFFAOYSA-N	441.488	1.721	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cc(C)ccc3F)n[nH]2)cc1OC	764379518	ZWXPFCOTHBFPIG-UHFFFAOYSA-N	441.419	1.941	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cnn(-c4ccccn4)c3)n[nH]2)cc1	764384965	OYOROKSZGPOJRF-UHFFFAOYSA-N	444.455	1.620	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)cc1NC(C)=O	764394909	WUAKVYVUYVCRAE-UHFFFAOYSA-N	432.458	1.237	50	20	IDGD	
N#Cc1cccnc1-n1cc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2F)cn1	764410929	WRXPUYCGGXWWKE-UHFFFAOYSA-N	427.783	1.331	50	20	IDGD	
O=C(CCC(=O)N1CCN(c2ccccn2)CC1)NNC(=O)C12CC3CC(CC(C3)C1)C2	764534382	PXMFACZJJOHENF-UHFFFAOYSA-N	439.560	1.874	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1cccc(N2CCCC2=O)c1	765732681	JPHRKXJMASKTPC-UHFFFAOYSA-N	449.511	1.032	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1ccc(-n2cccc2)cc1	765737420	ZDKAPNGWHJCUTM-UHFFFAOYSA-N	431.496	1.696	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cnn(-c4ccccc4)c3)CC2)cc1	765750090	ZFSYWAMVGAXLLF-UHFFFAOYSA-N	432.528	1.760	50	20	IDGD	
CCOc1ccc(N2C[C@@H](C(=O)NNc3c(OC)cccc3S(C)(=O)=O)CC2=O)cc1	768629219	OYOHCMSYASBMDP-AWEZNQCLSA-N	447.513	1.994	50	20	IDGD	
Cc1nc(-c2cccnc2)nc(NNC(=O)c2cccc([C@@]3(C)NC(=O)NC3=O)c2)c1C	769118574	XGZVZAUTHCHKQV-JOCHJYFZSA-N	431.456	1.967	50	20	IDGD	
COCCC(=O)N1CCC(NC(=O)NNC(=O)CSc2ccc(Cl)cc2)CC1	769166220	VOCWFGCFLNQCCX-UHFFFAOYSA-N	428.942	1.790	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)N[C@@H]2CCO[C@]3(CCSC3)C2)c2ccccc2c1=O	769229692	FITWYJOREVAZEY-SPLOXXLWSA-N	445.545	1.976	50	20	IDGD	
O=C(NNC(=O)c1cc(O)nc(C2CC2)c1)c1cccc(S(=O)(=O)N2CCCCC2)c1	770210508	YSMUYQUTCOXJEN-UHFFFAOYSA-N	444.513	1.914	50	20	IDGD	
C[S@@](=O)c1cccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1	770210638	ZXYFYTTYXYWNEB-MUUNZHRXSA-N	435.527	1.283	50	20	IDGD	
COc1ccc(CN2CCC(CNC(=O)NNc3nc(O)c4cnn(C)c4n3)CC2)cc1	770366678	JFHCQVJAGIUXIT-UHFFFAOYSA-N	440.508	1.616	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)[C@H]1CC(=O)N(c2ccccc2Br)C1	771986272	VWHXXULRGJSLHQ-QWRGUYRKSA-N	426.267	1.291	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1ccc(S(=O)(=O)N2CCC(C)CC2)s1	772094982	HKYGNIZUYFPWOJ-GFCCVEGCSA-N	431.536	1.271	50	20	IDGD	
COc1ccc(C)cc1-n1ccc(C(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)n1	772193591	WPZRJCSIASKAJD-UHFFFAOYSA-N	441.875	1.920	50	20	IDGD	
C[C@H]1C[C@H](NC(=O)NNC(=O)CNC(=O)OC(C)(C)C)CCN1C(=O)OC(C)(C)C	772483558	VEUJLTHLCZUGHD-QWHCGFSZSA-N	429.518	1.630	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	772716290	JLCMLFOOHXMESR-UHFFFAOYSA-N	432.908	1.390	50	20	IDGD	
CNS(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)cc1	773250185	AIDBZCGVDFPBBA-NSHDSACASA-N	447.922	1.025	50	20	IDGD	
CNS(=O)(=O)c1ccc(C(=O)NNC(=O)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1	773417070	PMGUMFQPZRAOAF-CQSZACIVSA-N	440.522	1.003	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)C(=O)Nc2ccc(C)c(S(=O)(=O)NC(C)(C)C)c2)n1	773482380	MVBXEONIKKAYDC-UHFFFAOYSA-N	434.522	1.560	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)c2cccc(OC(F)F)c2)cc1CC(=O)O	774618150	GOHDYLCHSOVGOE-UHFFFAOYSA-N	430.385	1.547	50	20	IDGD	
CC[C@@H](NCC(=O)NNC(=O)c1cccc(Cl)c1)c1ccccc1OCC(=O)NC	775130240	NLRTZBJGCRYBCW-QGZVFWFLSA-N	432.908	1.967	50	20	IDGD	
CN1CCCN(S(=O)(=O)c2cccc(NC(=O)NNC(=O)c3ccccc3)c2)CC1	775325733	XRWKVYFABSKGQK-UHFFFAOYSA-N	431.518	1.479	50	20	IDGD	
Cc1sc(=O)n(CC(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)c1C	776206562	UPCDOETZKGXPJB-UHFFFAOYSA-N	427.527	1.162	50	20	IDGD	
CC(=O)N1CCN(c2cccc(NC(=O)NNC(=O)c3nnc(O)c4ccccc34)c2)CC1	782079402	BMBAEQUUYFMWJU-UHFFFAOYSA-N	449.471	1.470	50	20	IDGD	
COC(=O)c1scc(C)c1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccc(C(C)=O)cc1	782120973	NSVXGXJNDOHVOT-GFCCVEGCSA-N	447.469	1.599	50	20	IDGD	
COC(=O)COc1ccc(C=NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1	782218251	FSCAYOHKZDOEGF-UHFFFAOYSA-N	445.497	1.787	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)cc1OCC(F)F	782894992	UPZWUUHIDGYNNZ-UHFFFAOYSA-N	445.426	1.854	50	20	IDGD	
C[C@H](Sc1ccccc1)c1ccc(NC(=O)C(=O)NNC(=O)C(=O)NC2CC2)cc1	782966518	NMMKFRVDNGBGIM-ZDUSSCGKSA-N	426.498	1.904	50	20	IDGD	
O=C(CCN1CCOCC1)Nc1cc(NC(=O)C(=O)NNc2cccc(F)c2)ccc1F	783040292	IREBPQHDZPYXMS-UHFFFAOYSA-N	447.442	1.707	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ccc(Br)cc2F)cc1-n1cnnn1	783084466	BCTLMPPDFUNLTJ-UHFFFAOYSA-N	434.229	1.954	50	20	IDGD	
Cc1ccnc(NNC(=O)C(=O)Nc2ccc(F)c(NC(=O)CCN3CCOCC3)c2)c1	783931514	RPWSWNXZODQDQT-UHFFFAOYSA-N	444.467	1.272	50	20	IDGD	
O=C(NNc1ccc(OC(F)F)cc1)C(=O)Nc1ccccc1C(=O)N1CCOCC1	784313865	XCNJSCUWHWNFMT-UHFFFAOYSA-N	434.399	1.842	50	20	IDGD	
CCCCNS(=O)(=O)c1cccc(NC(=O)C(=O)NNc2nccnc2Cl)c1	784777652	CXNADXYLLWOOCG-UHFFFAOYSA-N	426.886	1.290	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)F)cc1)C(=O)Nc1ccc(-n2ccnn2)cc1	784833565	OALLQAJPGRBCFD-UHFFFAOYSA-N	436.400	1.345	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)Nc1cccc(OC[C@H]2CCCO2)c1	785021800	CPAJGTVKANKORY-OAHLLOKOSA-N	444.400	1.258	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)C(=O)Nc3c[nH]nc3-c3ccccn3)n[nH]2)c1	785126965	WFAUSOMQLZDFAP-UHFFFAOYSA-N	444.455	1.878	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CCCc2cccs2)cc1N1CCNC1=O	787549577	NICAEYWCUJOWOX-UHFFFAOYSA-N	429.502	1.695	50	20	IDGD	
O=C(NCCc1ccccc1OC(F)F)NNC(=O)c1csc(N2CCOCC2)n1	788091362	BCXZZHIUFNLTAT-UHFFFAOYSA-N	441.460	1.768	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)C(=O)Nc2cc([C@H]3CCCOC3)nn2C)cc1	790952089	NVPZCVPBYDLMCE-AWEZNQCLSA-N	431.518	1.501	50	20	IDGD	
N#Cc1cccc(C(=O)NNS(=O)(=O)c2ccc(C(=O)O)cc2OC(F)(F)F)c1	792700064	YKPVARGFCXLKRF-UHFFFAOYSA-N	429.332	1.778	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)c1cccc(NN2C(=O)[C@@H]3CC=CC[C@H]3C2=O)c1	792790645	ZSYBXRHUOZQQGL-IAGOWNOFSA-N	448.435	1.768	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)N[C@H](CO)c1ccccc1OC(F)(F)F	792881659	JQIDLIJQFQGPFW-LLVKDONJSA-N	446.407	1.441	50	20	IDGD	
O=C(Cc1cc[nH]n1)NNC(=O)C(=O)Nc1cc(C(F)(F)F)ccc1Br	797004004	FYKKGOYQUDOVEK-UHFFFAOYSA-N	434.172	1.520	50	20	IDGD	
CCOc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NNC(=O)CSc1ccccc1O	799258498	BMYMJSQZBZWSPE-UHFFFAOYSA-N	434.430	1.577	50	20	IDGD	
C[C@H](c1ccc(S(N)(=O)=O)cc1)N(C)C(=O)NNC(=O)c1cc(Br)c[nH]1	799857357	OMFZLHWHBQTSDH-SECBINFHSA-N	444.311	1.472	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)Nc1ccc(F)cc1OCCC(F)(F)F	800593782	QKGVYDWXKMYCMN-VIFPVBQESA-N	427.376	1.744	50	20	IDGD	
CN(NC(=O)C(=O)Nc1cc2c(cc1N1CCCCC1)n(C)c(=O)n2C)c1ccccc1	800627248	GKKJCQJEEITOLR-UHFFFAOYSA-N	436.516	1.973	50	20	IDGD	
Cc1nc(C(=O)NNC(=O)Nc2ccc(N(C)C)cc2)nn1-c1n[nH]c(C(F)(F)F)n1	802121775	PHHQBKZXEKJSDY-UHFFFAOYSA-N	438.374	1.245	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1)C(=O)Nc1ccc(OC(F)F)nc1	802567764	XGAHQLKSJKVBSP-UHFFFAOYSA-N	434.334	1.612	50	20	IDGD	
COC(=O)c1cc(C)c(NC(=O)C(=O)NNc2cccc(S(C)(=O)=O)c2)c(Cl)c1	806969123	ZEKNUHHGIYTQMI-UHFFFAOYSA-N	439.877	1.920	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)C(=O)Nc1cc(C(F)(F)F)cc(Br)n1	806980312	UDJWOGMDDDIAIY-UHFFFAOYSA-N	435.160	1.294	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)NCC(=O)NNc2ncccc2C(F)(F)F)cc1	810426949	VBPGNOXGBZEORX-UHFFFAOYSA-N	431.396	1.480	50	20	IDGD	
COCC1(S(=O)(=O)NC(=O)/C(C#N)=C\c2cn(CCC#N)nc2-c2ccccc2)CC1	811157614	VLXYBHDSJRQMBF-ATVHPVEESA-N	439.497	1.996	50	20	IDGD	
CCOC(=O)c1ccc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1	811276525	NPWGBWWSTSINSI-QGZVFWFLSA-N	428.397	1.008	50	20	IDGD	
COC(=O)c1ccc(C)c(NC(=O)C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)c1	813033144	GXSVTCIPKRJPJD-UHFFFAOYSA-N	434.474	1.114	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)NCC2=CCCOC2)cc1	813712890	POUSXKQTGKKLBZ-WOJGMQOQSA-N	435.484	1.804	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H]2CCCN(c3ccccc3)C2=O)c1	814364191	VKHRCVYGAOJIHO-GOSISDBHSA-N	444.513	1.141	50	20	IDGD	
CC(=NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1nnn(-c2cccc(Br)c2)c1C	814781625	MANVJNVYIKRFEQ-GFCCVEGCSA-N	440.323	1.613	50	20	IDGD	
CC(=NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1)C1CCN(C)CC1	814877645	UEOVZPKHCROWCL-UHFFFAOYSA-N	435.594	1.135	50	20	IDGD	
Cc1ccc(C(=O)N2C[C@H](C)C[C@@H](C)C2)cc1NC(=O)C(=O)NNC(=O)[C@H]1CCCO1	815778945	KTLDWQHQKUDIOK-HBUWYVDXSA-N	430.505	1.378	50	20	IDGD	
CC(C)(C)OC(=O)N1CCCc2cc(NC(=O)C(=O)NNC(=O)[C@H]3CCCO3)ccc21	815779837	YBMTYHGPRRYXSG-MRXNPFEDSA-N	432.477	1.639	50	20	IDGD	
C[C@@H](Cc1cnc2ccccc2n1)C(=O)N1CCN(S(=O)(=O)CBr)CC1	815964384	GQVRAXMEUDJJBV-ZDUSSCGKSA-N	441.351	1.635	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)N2CC(CN3CCN(C)CC3)C2)c(C)n1C[C@@H]1CCCO1	820458384	DSBLSIQVVNYVOS-GSFLASDGSA-N	425.577	1.897	50	20	IDGD	
Cc1nc(N2CCOCC2)nc(O)c1CCC(=O)NN=c1sc2ccccc2n1C	821687351	BCKQWXABMLQCKH-UHFFFAOYSA-N	428.518	1.445	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)c1ccc2c(c1)C(=O)N(Cc1ccco1)C2=O	863998813	CKOHFINDBISHRA-UHFFFAOYSA-N	449.419	1.924	50	20	IDGD	
Cc1ccc(S(=O)(=O)Nc2ccc(C(=O)N3CC[C@H](B(O)O)C3)cc2)cc1[N+](=O)[O-]	864234770	VSDGZPYHYCHMHB-AWEZNQCLSA-N	433.251	1.393	50	20	IDGD	
C[C@@H]1CC(C)(C)C[C@@]2(C1)NC(=O)N(CC(=O)NNC(=O)COc1ccc(F)cc1)C2=O	910813573	VYWGCFVUGPARIK-LRTDBIEQSA-N	434.468	1.489	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccccc2)cc1	914775438	BVLHFAONJLNPER-OAHLLOKOSA-N	435.502	1.321	50	20	IDGD	
O=C(NCCCN1CCCC1)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	916196059	LSZAZMPTBOBADC-UHFFFAOYSA-N	437.566	1.291	50	20	IDGD	
COCC(=O)Nc1cccc(CNC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])c1	916383575	VXIJOZQLCHYBEL-UHFFFAOYSA-N	431.405	1.089	50	20	IDGD	
Cc1cccc(N2CCN(CCCCNC(=O)NN[C@]3(C)CCS(=O)(=O)C3)CC2)c1	916513530	AYJPPHGTXSPART-OAQYLSRUSA-N	437.610	1.278	50	20	IDGD	
O=C(CCSc1ccc(F)cc1)NNC(=O)NC[C@@]1(N2CCOCC2)CCSC1	916636697	JZXFAOIWVQTXBV-IBGZPJMESA-N	442.582	1.846	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNc3ccccc3[N+](=O)[O-])CC2)cc1	917016366	QQDGWWZXXBIMRA-UHFFFAOYSA-N	433.490	1.353	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)CN3C(=O)N[C@@]4(CCCC[C@H]4C)C3=O)n[nH]2)cc1	917175683	HSKQOCRMFOKHQZ-JLCFBVMHSA-N	438.488	1.647	50	20	IDGD	
CN(Cc1cc(Br)cs1)C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	918002129	RSIQTIKTMNHESJ-UHFFFAOYSA-N	436.295	1.973	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)NCc2ccc(CS(C)(=O)=O)cc2)cc1OC	918102629	XWSHOCKHXNXDJN-UHFFFAOYSA-N	435.502	1.783	50	20	IDGD	
Cc1cc(-c2noc(CCC(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)n2)ccc1F	918156553	SGVNULWZEJAYMR-UHFFFAOYSA-N	446.460	1.981	50	20	IDGD	
Cc1cc(C)cc(N2CC[C@H](C(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)C2=O)c1	919712818	SFTLDGOXDWIMLP-GOSISDBHSA-N	429.498	1.521	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)CNC(=O)c2cccc(Br)c2)cc1	919832512	CEGXYPMPCQJBOT-UHFFFAOYSA-N	434.290	1.968	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)c(C)n1CCC(C)C	919889168	KDOZBIAZSOCIMD-LTXFRBGYSA-N	435.550	1.576	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1cn(-c2ccccc2)nc1-c1ccccc1	920297970	HGCLUUPVZGBNGE-AWEZNQCLSA-N	427.486	1.238	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)NCc1cccc(C(=O)N2CCOCC2)c1	920812409	ZUSSGXCOEXOCHP-UHFFFAOYSA-N	430.436	1.208	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)n(-c2ccccn2)n1	920931630	YLMRAKZEQSQUSE-UHFFFAOYSA-N	443.489	1.293	50	20	IDGD	
C[C@H](c1ccncc1)N1CCC(NC(=O)NNC(=O)c2nnc(O)c3ccccc23)CC1	1116345848	AGBHXHVAYWPPMC-CQSZACIVSA-N	435.488	1.900	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)CN2C(=O)CCOc3ccccc32)CC1	1251911450	RBFGUPKDLKNFDC-UHFFFAOYSA-N	446.504	1.597	50	20	IDGD	
CCc1ccc(C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)cc1CC	1337238610	KPYFZKKUBUPKGH-UHFFFAOYSA-N	431.562	1.899	50	20	IDGD	
COCCn1nccc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(Cl)Cl)C2	1778235588	QHXVZUMMOPQKNL-RDTXWAMCSA-N	433.336	1.461	50	20	IDGD	
C=CC[C@H](C(=C)C)C(=O)N1CC[C@@]2(CN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CCO2)C1	1778882135	RPNRWAHHHIPPRV-UAZFOLIYSA-N	441.532	1.719	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)c3ccc(C4CC4)cc3)CCO2)C1	1779036996	LRLSXTVXPUICRZ-XMMPIXPASA-N	449.511	1.320	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(-c4ccncc4)[nH]n3)C2)C1	1779593430	PAGLCRNEISHUBM-DJJJIMSYSA-N	448.321	1.699	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)c3cnn4cccnc34)CCO2)C1	1781230273	OYXVKGNDMNMNOT-MSOLQXFVSA-N	426.304	1.409	50	20	IDGD	
COc1cncc(CCC(=O)N2CCO[C@]3(CCN(C(=O)[C@H](F)Br)C3)C2)c1	1781327026	WGTTZBHWYPBRBI-FUHWJXTLSA-N	444.301	1.543	50	20	IDGD	
Cn1ncc2c(C(=O)N3CCO[C@@]4(CCN(C(=O)[C@@H](F)Br)C4)C3)cccc21	1781329479	GNHPBRLZKADJMR-CRAIPNDOSA-N	439.285	1.707	50	20	IDGD	
CC(C)(C)n1cc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)nn1	1781335166	VAPCCFBNKJWSRD-WBMJQRKESA-N	432.294	1.167	50	20	IDGD	
O=C(COc1ccccc1F)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781335229	WKQJXYJVYYJMEX-RDJZCZTQSA-N	433.249	1.725	50	20	IDGD	
Cc1ccc(-n2ccnn2)c(C(=O)N2CC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)c1	1782169532	QSRFYXVMSPCKTR-LJQANCHMSA-N	438.315	1.823	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C[C@H](N)c1cccnc1)C2	1782170712	UTDFQKWNUXDVLN-LXGFNABISA-N	438.956	1.239	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc3cccnn3n1)C2	1782173553	IIZCGWVVXFAMDC-WRWLIDTKSA-N	435.912	1.111	50	20	IDGD	
Cc1cccc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CCC(=O)NN(C)C)C2)c1	1782212351	WDGJPZXCOAVAHU-AUSIDOKSSA-N	430.549	1.496	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CNC(=O)C(F)(F)F)C1	1782234435	STSVZOFESMBAIO-PBFPGSCMSA-N	441.878	1.586	50	20	IDGD	
O=C(CCCn1ccnc1)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Br)C2	1782487543	MHMTUTYFRPHXDS-QGPMSJSTSA-N	445.333	1.868	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)N1CC[C@]2(CN(C(=O)[C@H](Br)CC)CCO2)C1	1782711393	FUBICEAVBIUYJO-PBFPGSCMSA-N	435.315	1.551	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cc4cccnn4n3)CCO2)C1	1783353712	ZOIZBEWGAGXTNZ-KBXCAEBGSA-N	436.310	1.346	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)Cc3cc(F)ccc3[N+](=O)[O-])CCO2)C1	1783884121	QMJSJFQKRUXDBR-KXBFYZLASA-N	443.859	1.360	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cccc3cnccc13)CCO2	1783936558	XIDGNBAPXJXALC-QHCPKHFHSA-N	439.516	1.051	50	20	IDGD	
CN1Cc2ccccc2C[C@@H]1C(=O)N1CCO[C@@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783942388	NMVUMZVGCKTYAC-OXQOHEQNSA-N	426.344	1.677	50	20	IDGD	
COC1(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]3C2)CCC1	1783975611	OOFKAHSXZWQGHM-UGUYLWEFSA-N	431.371	1.956	50	20	IDGD	
C=CCOCCCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)CBr)C[C@@H]21	1784486704	JOCFDBHEDXOTBU-QAETUUGQSA-N	431.371	1.980	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)N3CCN(C)CC3)C[C@@H]21	1784620648	GBBOTHUCTPQRMT-FKSLSLAPSA-N	429.005	1.010	50	20	IDGD	
CC[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)Br)C[C@@H]21)N(CC)CC	1784632207	JFYICLZTAJZNSM-VIQHNZTISA-N	432.403	1.870	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3cc(F)ccn3)[C@H]2C1	1785241449	QDNDDNPUWKHTBE-RUGDWHBFSA-N	427.904	1.387	50	20	IDGD	
O=C(CCc1cc(F)ccn1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21	1785242603	LFNIRFQMXXHUCC-SIUGBPQLSA-N	446.292	1.824	50	20	IDGD	
CN(C)c1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCBr)[C@H]3C2)cn1	1786406001	BZIIJXNSXYLMEY-JYJNAYRXSA-N	439.354	1.526	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCN3CCCCC3)[C@H]2C1	1786574823	IZJQAKUXACJAAQ-XSLAGTTESA-N	444.414	1.873	50	20	IDGD	
COC(=O)N[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]2C1)c1ccccc1	1787443802	TYTKJRVSISOYBK-SMLCLMEVSA-N	441.887	1.598	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cn4ccsc4n3)[C@H]2C1	1788391916	JCAZAXUOJZUJPU-DZKIICNBSA-N	436.610	1.841	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1ccc(C2(NC(=O)Cc3cnccn3)CCC2)cc1	1789519989	XSJRCXLKUKGZLH-UHFFFAOYSA-N	445.483	1.466	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc4cccnc4nc3O)[C@H]2C1	1790366755	VLGMTRRNAPXEOT-HJWJTTGWSA-N	448.907	1.183	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)[C@H]1CCc2nc[nH]c2C1	1791526854	QUBQUDWPNFENGU-WSMBLCCSSA-N	439.354	1.279	50	20	IDGD	
COc1ccccc1C(=O)N1CC(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](F)Cl)C3)C1	1792920253	ZHCNLRUSIQDTFW-KRXQYRFLSA-N	437.899	1.940	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCl)C1CC1	1793107045	MXQMCQOCJJUZEN-BQJWPVKWSA-N	443.972	1.918	50	20	IDGD	
Cc1cccc(C)c1N1C[C@@H](C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](O)CCl)CC1=O	1793110966	SYWVOZVOEMBYEK-QXCZDIPSSA-N	447.963	1.894	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(S(C)(=O)=O)cn1	1794749198	HRPYQYIAXKISBR-FVCCEPFGSA-N	444.351	1.520	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccnc1OCC1CC1)c1cccc(B(O)O)c1	1794773665	DGRPGYIVLYOOJU-ACDBMABISA-N	449.316	1.116	50	20	IDGD	
C[C@H](Sc1cccs1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1	1796188795	RFKLXAXNDUQVQF-RUGDWHBFSA-N	444.387	1.861	50	20	IDGD	
Cc1c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CO[Si](C)(C)C)C3)ccc2c1OCCO2	1796248233	PRLLFPUJIXIFJB-CWPLJXCYSA-N	448.592	1.821	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2)[C@@H]1CN(Cc2ccccc2)CCO1	1797245419	JSDMLONLDFXPQE-XCDZQEORSA-N	439.915	1.011	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2cccnc2[nH]1	1797461104	XZDZOVXCJMDEJI-HLPPOEQASA-N	435.322	1.940	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnc2cc(C)ccn2c1=O	1797609038	FXUQWWRLRHSRML-IVSAIRAKSA-N	432.908	1.509	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnncc1C(=O)O	1798777507	WDZYHPPKCQKJFL-YFKTTZPYSA-N	425.283	1.458	50	20	IDGD	
COc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Br)C3)ccc1O	1798952741	FMPDAIFGZOODRM-BAESOJJISA-N	431.258	1.295	50	20	IDGD	
CN(C)c1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Br)cn1	1799349326	WMWXELBUDBWOFG-AYRXBEOTSA-N	429.290	1.041	50	20	IDGD	
O=C(CSc1ccccc1[N+](=O)[O-])N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2	1800908301	MWQGVPXAKJWCQM-OXUXUCFPSA-N	431.873	1.811	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)[C@@H]1CCc2ccccc21	1801114878	ZSORLXVERPTSGA-IMPMIVQMSA-N	425.298	1.997	50	20	IDGD	
CC(=O)NCCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1801687560	SLDFZFHTNXLWDK-FZKCQIBNSA-N	444.960	1.283	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc([N+](=O)[O-])c(OC)c1	1801839105	UVFOJWPWIQVDNH-LOUJCGABSA-N	441.868	1.060	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)c1ccccc1Cl)c1ccc(B(O)O)cc1	1802689738	IKGBWXYWYBIHPB-AXVVYFOYSA-N	442.708	1.005	50	20	IDGD	
COC(=O)NCC(=O)N1CC[C@H](CNC(=O)[C@H](C)CBr)[C@H]1c1cccnc1	1803018196	YLMPZGNXORJWSH-XNRPHZJLSA-N	441.326	1.474	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1CCOC1	1803226202	NIMHYPDZONFYFP-QMHWVQJVSA-N	429.945	1.793	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](CC(N)=O)NC(=O)OC(C)(C)C	1804431346	CPAVDOKAEAQEBX-AICCOOGYSA-N	444.960	1.411	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)c2ccco2)[C@@H]1c1cccnc1	1805377639	PXFCVZVKTVJTBM-KXBFYZLASA-N	434.456	1.307	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@H](O)C(=O)N1CCCC2(CCN(C(=O)[C@H](F)Cl)CC2)C1	1805408803	UTOSVVXLIJBYRZ-KBPBESRZSA-N	435.924	1.638	50	20	IDGD	
CC(C)CNC(=O)C(=O)N1CC[C@H](CNC(=O)CCBr)[C@H]1c1cccnc1	1806340601	HLJDOPRDSOICLG-NVXWUHKLSA-N	439.354	1.645	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)[C@H](N)c2ccccn2)[C@H]1c1cccnc1	1807166992	HNHQHEOEPQXLIR-PAYONLEZSA-N	446.349	1.966	50	20	IDGD	
C[C@@H]1CCC[C@@H]1C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1807377100	XOQUVLSYLWSIHZ-ZKMOHVOUSA-N	435.333	1.517	50	20	IDGD	
CN1CCN(CC(=O)NC[C@@H]2CCN(C(=O)C(C)(C)CCl)[C@H]2c2cccnc2)CC1	1809599296	MZZUHQGNTCMRNU-ICSRJNTNSA-N	436.000	1.600	50	20	IDGD	
Nc1n[nH]c(CCC(=O)NC[C@@H]2CCN(C(=O)C(Cl)Cl)[C@@H]2c2cccnc2)n1	1810156879	LCKQGYIEELYZLT-SMDDNHRTSA-N	426.308	1.224	50	20	IDGD	
C[C@H](C(=O)N1CC[C@@H](CNC(=O)CO[Si](C)(C)C)[C@@H]1c1cccnc1)n1cncn1	1810548460	RATYSWYIPQMUBI-AYBZRNKSSA-N	430.585	1.792	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)[C@H](C)CC(N)=O)[C@@H]1c1cccnc1	1812774245	NHIJSYHENKSXNI-VWNJHIHFSA-N	439.354	1.772	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)COCCO)[C@H]1c1cccnc1	1812776267	CQKFYVLNJZTOCE-VYDXJSESSA-N	428.327	1.270	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)CNC(=O)N(C)C)[C@H]1c1cccnc1	1812862623	AWHPKNZNZMDOQW-BJJXKVORSA-N	440.342	1.142	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)Cn2cc(Cl)cn2)[C@H]1c1cccnc1	1813030850	MXEFDHIWTQNSQO-HFTRVMKXSA-N	440.331	1.891	50	20	IDGD	
Cc1onc(C(=O)N2CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)c1C	1813067802	DSHQQDJASNVPNM-LAUBAEHRSA-N	442.520	1.379	50	20	IDGD	
C[C@@H](C(=O)N1CC[C@@H](CNC(=O)C(Cl)Cl)[C@H]1c1cccnc1)N1CCN(C)CC1	1813078787	KWRHHSJGFVUHKI-BHYGNILZSA-N	442.391	1.527	50	20	IDGD	
O=C(O)CSCC(=O)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@H]1c1cccnc1	1813086207	LFFHCVMXCUXBPE-CQDKDKBSSA-N	448.314	1.596	50	20	IDGD	
Cc1cc(C)n(CC(=O)Nc2cc([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)n1	1815929821	LIYKJQNEMHSAKZ-QGZVFWFLSA-N	444.540	1.288	50	20	IDGD	
Cc1nscc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1816259918	GIUXHAQOOWWPRR-KRWDZBQOSA-N	439.306	1.474	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](C)S)CC2	1817282302	BRWNZJOOXWNISG-GAKXBQIDSA-N	434.547	1.507	50	20	IDGD	
Cc1cccnc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1	1817473962	IMCXDCPLFWSYPE-GOSISDBHSA-N	433.277	1.413	50	20	IDGD	
O=C(Cc1cccnc1)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1817621187	VGFYCOLSBCPYRA-LJQANCHMSA-N	433.277	1.033	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H]3CC3(F)F)sc2C1	1818679828	XUCOBOKZHRWWGO-KCJUWKMLSA-N	436.444	1.023	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H]2C[C@@H]2F)n[nH]1	1821814984	WECNMUMNUGJOBS-QAQAHDPMSA-N	429.456	1.894	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CN(CCO)CCO)n[nH]1	1822022406	DDZJPDCIHWRLCF-ZBFHGGJFSA-N	429.949	1.096	50	20	IDGD	
CC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)C1(N3CCN(C)CC3)CC1)CC2	1822849319	HVRGAZZUIWZQOD-UONOGXRCSA-N	440.013	1.853	50	20	IDGD	
CN(CC(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H](O)CCl)CC1)C(=O)c1ccccc1	1824381635	RDDATMFKXPKCQN-PMACEKPBSA-N	449.979	1.978	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)CCN2C(=O)C=CC2=O)CC1	1824773527	GANOGPJTLBBIBJ-DLBZAZTESA-N	439.940	1.175	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)COc2cccnc2)CC1	1825067765	BVQJYYAQESNFKP-HXUWFJFHSA-N	445.564	1.453	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCc1ccc[nH]1)CC2	1826085090	DBADKVMQAYGGFX-CQSZACIVSA-N	432.550	1.389	50	20	IDGD	
Cc1nc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)cs1	1826123084	PEOKCTFNQARBRL-HXUWFJFHSA-N	441.362	1.678	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H]3[C@H]4COC[C@H]43)sc2C1	1827377650	FJSZMKCKAVDFTM-MOUCOTEISA-N	428.352	1.979	50	20	IDGD	
C[C@]1(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)CC2)CCCN1	1828924370	PITJHTTUASVQJU-WMZHIEFXSA-N	442.564	1.061	50	20	IDGD	
C[C@H](O)C(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)[C@H](F)Cl)C2)C1	1829325277	GJJYIDXZMJJEKF-UVFQYZLESA-N	441.887	1.354	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)C3CC(F)(F)C3)CCO2)C1	1829993344	ZXZPRDFZRFUHNN-XJKSGUPXSA-N	439.297	1.662	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)Cc3ccccc3)C2)C1	1830366242	LRPCZNDEQLDCTH-XMSQKQJNSA-N	438.952	1.311	50	20	IDGD	
O=C(Cc1ccc(Cl)s1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1830726841	UGXPRLASZJDXBP-GUYCJALGSA-N	437.345	1.000	50	20	IDGD	
COc1cccc(Cl)c1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1830738942	VXBCOKIMBYZOAH-KUHUBIRLSA-N	447.315	1.018	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C#CC3(O)CCCCC3)C2)C1	1831650913	MDWXEVJZWWNEAI-XMSQKQJNSA-N	440.968	1.549	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H](N)Cc2cscn2)CC1	1831833115	LEDPZWBEDSBNNR-SQNIBIBYSA-N	443.013	1.886	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)C[C@@H]3CCCCO3)CCO2)C1	1832350421	HJONAKIBMVRBQF-RLFYNMQTSA-N	433.343	1.185	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3ccc(F)nc3)CCO2)C1	1832837741	QNFJSIMLFUOIQO-OXQOHEQNSA-N	427.904	1.627	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnc(OC)c(F)c3)CCO2)C1	1833485769	SFEKRFMUHHGGIY-AUUYWEPGSA-N	429.876	1.317	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)s1	1833959373	QUGATDUYCJXSTO-SUMWQHHRSA-N	431.352	1.910	50	20	IDGD	
Cn1ccc(C(=O)NC2CCN(C3CCN(C(=O)[C@H](F)Br)CC3)CC2)c1	1834078762	GMQLXCMUGNQHEY-INIZCTEOSA-N	429.334	1.901	50	20	IDGD	
O=C(Cc1ccccc1F)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1835005768	QEOVFPCZLKHXDF-FUHWJXTLSA-N	447.276	1.515	50	20	IDGD	
CNc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](Cl)COC)C3)C2)cc1	1835610082	IOFFILIXTZTKFX-PXNSSMCTSA-N	425.913	1.052	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC1CCN(C2CCN(C(=O)c3csnn3)CC2)CC1	1835835348	WINGBQNWHTWGHN-UHFFFAOYSA-N	425.631	1.575	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC1CCN(C2CCN(C(=O)c3ccc(O)nc3)CC2)CC1	1835836235	UTIFFLOEGAAWAN-UHFFFAOYSA-N	434.613	1.824	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3ccc(OC)nc3)CC2)CC1	1836983499	XWNKMGPTKLZZEY-SFHVURJKSA-N	439.940	1.956	50	20	IDGD	
O=C(c1cc2ncsc2[nH]1)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1837753571	BEBQDCCYYNPHEB-MRXNPFEDSA-N	433.317	1.498	50	20	IDGD	
C/C=C/C(=O)N1CCC(OC2CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CC2)CC1	1838103212	PNXCZPZDVPTPDB-WAHZRSDSSA-N	429.521	1.695	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4c(c3)C(=O)CC4)C2)C1	1839148492	ZKLDPDNRWYEOIH-AVRDEDQJSA-N	434.920	1.903	50	20	IDGD	
Cc1nn(C)cc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2	1839150173	DEUPYWHZRIVOTP-QZTJIDSGSA-N	433.336	1.035	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)COc3cccnc3)C2)C1	1839150512	OFWFEWWPQIGLBV-MOPGFXCFSA-N	446.331	1.153	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)C#Cc3ccccc3)C2)C1	1840032067	MYPXMVKYMXUEPS-OXQOHEQNSA-N	435.318	1.278	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(C)cc(Cl)c3)C2)C1	1840155876	FRJNPQNFIRIGCO-PXNSSMCTSA-N	445.343	1.972	50	20	IDGD	
Cc1nn2cc(CC(=O)N3CCCC34CN(C(=O)[C@H](C)CBr)C4)nc2s1	1841785691	SJUNSHBQQBGHFG-LLVKDONJSA-N	440.367	1.876	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)CCS(=O)(=O)c2ccccc2)C1	1842744888	LSGMMAISTRANIA-INIZCTEOSA-N	428.938	1.308	50	20	IDGD	
O=C(CCc1ccc(F)c(F)c1)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843012725	JABFKAMCUNJRQG-UHFFFAOYSA-N	428.244	1.094	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)c2ncn3nc(N4CCOCC4)ccc23)C1	1843154141	DACGAPMLTXNLGD-HNNXBMFYSA-N	446.939	1.400	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)Cc1cccc(Cl)n1)C2	1843415575	PCZZIAQVBADPCW-AFUMVMLFSA-N	442.907	1.615	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)C1CCN(C)CC1)C2	1844691970	TWWWYQINLPJCHD-UHFFFAOYSA-N	444.488	1.679	50	20	IDGD	
CCc1ncsc1C(=O)N1CCCC12CN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2	1844838335	SMYGAFBBIBEXDP-YDZHTSKRSA-N	428.518	1.657	50	20	IDGD	
C[C@H]1C[C@]1(C)C(=O)N1CCCC12CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2	1845087770	DZIPQTJQIIRHKR-JTSKRJEESA-N	427.549	1.582	50	20	IDGD	
CNC(=O)CC(=O)N1CC2(CCCN2C(=O)/C(C#N)=C/c2ccc(Br)cc2)C1	1845872213	KSDLLNJJWZWIIG-OQLLNIDSSA-N	445.317	1.696	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)c1cc(Cl)cc(Cl)n1)C2	1846385209	DDRBFXLMYPKZCQ-UHFFFAOYSA-N	428.320	1.578	50	20	IDGD	
COc1ccccc1N(CCC(N)=O)C(=O)COC(=O)/C(C#N)=C/c1cc(C#N)n(C)c1C	10958129	CKSTUZBXSANYLB-LICLKQGHSA-N	449.467	1.573	50	20	IDGD	
O=C(CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)NNC(=O)[C@@H]1COc2ccccc2O1	14801185	QRHVNMXTDSNINP-KRWDZBQOSA-N	442.384	1.270	50	20	IDGD	
CC(C)(C)OC(=O)NCCc1ccc(CNC(=O)NNC(=O)C(=O)N2CCCC2)cc1	726273102	DDDZSIMXCHTZNL-UHFFFAOYSA-N	433.509	1.207	50	20	IDGD	
COc1ccc(CN2C[C@@H](C(=O)NNC(=O)CNc3ccccc3OC)CC2=O)cc1	726620674	XWDNJCDFYLFGNT-INIZCTEOSA-N	426.473	1.312	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)c2ccc(S(=O)(=O)N(C)C)cc2)cc1F	727498398	JVHMAERCGBSITA-UHFFFAOYSA-N	426.495	1.716	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)c2ccc(CNC(=O)C3CCCC3)cc2)c2ccccc2c1=O	727799506	NNHCYFURHWSRIR-UHFFFAOYSA-N	447.495	1.815	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)CN2C(=O)Cn3c(cc4ccccc43)C2=O)c(C)c1	728205302	YTGMTZSUGLNRNU-UHFFFAOYSA-N	433.468	1.500	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)CSC[C@@H]3CCCCO3)cc2)CC1	728214374	NCOCBQYMTGSRNU-KRWDZBQOSA-N	442.607	1.368	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1csc(-c2cnccn2)n1	728264450	INALJIFPIGUWFL-UHFFFAOYSA-N	431.503	1.276	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2ccccc2)c(Br)cc1F	728501858	SVZAQFBDUYBPPN-UHFFFAOYSA-N	431.239	1.998	50	20	IDGD	
COC(=O)c1cc(CN(C)C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)oc1C	728958797	FFXABWOAOJRDSO-UHFFFAOYSA-N	430.465	1.254	50	20	IDGD	
NC(=O)[C@H]1CCCN(Cc2cccc(CNC(=O)NNc3ccc(-n4cccn4)nn3)c2)C1	731119200	ZETZGYDLVQTWQX-SFHVURJKSA-N	449.519	1.186	50	20	IDGD	
COc1ccc(N2CCN(CCCNC(=O)NNC(=O)Cc3ccccc3F)CC2)cc1	731402126	QUNCRXLSSWJEHE-UHFFFAOYSA-N	443.523	1.920	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)c1nnn(-c2ccc3c(c2)OCCO3)c1C	731453505	IMLCKJUYRLIOLN-UHFFFAOYSA-N	433.428	1.378	50	20	IDGD	
CC(=O)N1CCCCC[C@H]1C1CCN(CC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)CC1	731667042	RSUPFSYRDNQUHT-FQEVSTJZSA-N	445.520	1.859	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)c2c[nH]nc2-c2ccc3c(c2)OCCO3)C[C@@H](C)O1	732263988	QMNAEHSHJFBJIB-ZIAGYGMSSA-N	429.477	1.108	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)[C@H](C)N2CCN(c3ccc(F)cc3)CC2)c1	732264970	KUIDQKQCMJZXAA-HNNXBMFYSA-N	430.480	1.815	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)c2c(N)n(C)c(=O)n(C)c2=O)c(C)n1-c1ccc2c(c1)OCO2	732578525	RGZDIFBILBIEJY-NVNXTCNLSA-N	447.451	1.592	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCCCC2)cc1S(=O)(=O)NNC(=O)NCC1CC1	733250077	YSQNOQKTCGCIBO-UHFFFAOYSA-N	430.552	1.072	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)Oc1ccccc1	733848922	BHIDYSVDVICXLP-INIZCTEOSA-N	446.529	1.883	50	20	IDGD	
CC(=O)N[C@@H](CC(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)c1ccc(Cl)cc1	734241006	ZGYBUOPAOPDVLB-HNNXBMFYSA-N	441.916	1.762	50	20	IDGD	
CC(C)[C@H](CNC(=O)NNC(=O)CNC(=O)c1cccs1)NC(=O)OC(C)(C)C	734526561	XFIRBIZKXRWWGN-LBPRGKRZSA-N	427.527	1.358	50	20	IDGD	
Cc1cccc(C)c1OCC(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	735116679	BQQHQDQEHBGIAV-UHFFFAOYSA-N	433.534	1.157	50	20	IDGD	
Cc1nonc1CNC(=O)/C(C#N)=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	736144130	GBWLNDWREOTDSY-RIYZIHGNSA-N	439.863	1.994	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN2CCN(c3ccc(C(N)=O)cc3)CC2)cc1C	736312510	UHGDHFHYPMAJIE-UHFFFAOYSA-N	429.546	1.301	50	20	IDGD	
CCCNC(=O)c1cccc(C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)c1	741206574	AGCFHGZEKCTWRA-UHFFFAOYSA-N	431.518	1.503	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)N[C@H]3C[C@@H]3c3cccc(F)c3)nc2)CC1	743357069	VPQBNWHHPCPFDG-MSOLQXFVSA-N	448.524	1.339	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)CN2CCN([C@@H](CO)c3ccc(Cl)cc3)CC2)cc1	744399412	MFQVSUAXFZKVDM-FQEVSTJZSA-N	441.919	1.324	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(CC(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)CC1	744879016	ICSJDSDJKHXDAW-UHFFFAOYSA-N	444.488	1.900	50	20	IDGD	
COc1ccc2c(c1)OCC[C@@H]2NC(=O)NNc1ccc(S(=O)(=O)NC(C)C)cn1	745861842	PHNDVTQBALIDPZ-INIZCTEOSA-N	435.506	1.927	50	20	IDGD	
CCOCCCn1c(NNC(=O)[C@@H]2CCCN2c2ncccn2)nc2ccccc2c1=O	747393871	VAMQLVPGESTDJX-SFHVURJKSA-N	437.504	1.725	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCn2ccnc2C1)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	747649848	VKUGPFLPBCCYRF-LJQANCHMSA-N	442.483	1.609	50	20	IDGD	
COc1cc(OC)cc(N2CC[C@H](NC(=O)NNC(=O)COCc3ccccc3)C2=O)c1	747957351	ZQTNRDSIJJHXML-IBGZPJMESA-N	442.472	1.356	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)NC2CCN(C3CCN(C)CC3)CC2)c1C	747990540	SLNPQZVQTSVERF-SFHVURJKSA-N	431.581	1.960	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)[C@@H]2CCCN2S(=O)(=O)c2cccs2)cc1	749126646	QDAMWXVSQKGYGK-INIZCTEOSA-N	437.543	1.690	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H]2CCC[C@@H](N(C)C)C2)c1	749589836	JGYOTPCNNHPDQA-DLBZAZTESA-N	439.582	1.534	50	20	IDGD	
COCCS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cc(-c3ccc(C)cc3)[nH]n2)cc1	749732147	NTXYQPHGQXSTMC-UHFFFAOYSA-N	442.497	1.880	50	20	IDGD	
O=C(NNc1nc(Br)cn2ccnc12)C1CCN(C(=O)c2cccnc2)CC1	750246348	KLZIYGQIKZJOAY-UHFFFAOYSA-N	444.293	1.882	50	20	IDGD	
CC[S@](=O)[C@@H]1CCC[C@@H](NC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)C1	750297297	QSYBKCCJTCKHFI-ZRBXUZRCSA-N	430.552	1.506	50	20	IDGD	
Cc1noc2ncc(S(=O)(=O)NNC(=O)c3nn(C(C)C)c(=O)c4ccccc34)cc12	750837676	PGSOJOYSZOJGHT-UHFFFAOYSA-N	442.457	1.445	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)NNC(=O)CNC(=O)c2ccco2)c(C)n1C[C@@H]1CCCO1	751206479	HSMTYIKEIYQIPO-BHEJFATLSA-N	439.472	1.361	50	20	IDGD	
CN1C(=O)N[C@]2(CCC[C@@H]2CNC(=O)NNC(=O)Nc2ccc(OC(F)F)cc2)C1=O	752022625	HJTCACACMZDNCS-MGNBDDOMSA-N	440.407	1.344	50	20	IDGD	
COc1ccc(C(=O)CCC(=O)NNc2nc(O)c3cnn(C)c3n2)c(OC)c1OC	752371646	LILLVSRFMTVMAQ-UHFFFAOYSA-N	430.421	1.201	50	20	IDGD	
CCOC(=O)c1ccc(N2CC(NC(=O)NNC(=O)c3cc(OC)cc(OC)c3)C2)nc1	753279999	PPWKATNGMGWVOG-UHFFFAOYSA-N	443.460	1.108	50	20	IDGD	
C[C@@H](CCNC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)N1CCCCC1	753419706	MIXYXZSSYLDTLB-FQEVSTJZSA-N	430.597	1.794	50	20	IDGD	
O=C(CN1CCOC[C@H]1C[C@H](O)c1cccs1)NNC(=O)c1ccc([N+](=O)[O-])cc1	753860777	ANMHQEWCJRBGAD-CVEARBPZSA-N	434.474	1.242	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)CCc2cn(C)c3ccccc23)c1	755040531	KVAFBLHHLGDEES-UHFFFAOYSA-N	428.514	1.822	50	20	IDGD	
CCOC(=O)COc1cccc(NC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)c1	755656691	OZGUEJPEBKTLOX-UHFFFAOYSA-N	439.428	1.986	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NN=Cc3ccccc3C#N)CC2)cc1	755792232	XPWSMCAVBRTKKG-UHFFFAOYSA-N	425.514	1.323	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)Nc1ccc(N2CCc3sccc3C2)nc1	755859446	PBQLWVMAUTYWPT-ZDUSSCGKSA-N	435.531	1.293	50	20	IDGD	
CC(C)(C)S(=O)(=O)N1CCC(NC(=O)NNC(=O)COCc2ccccc2)CC1	755897182	CJWUZVWTNIBOMQ-UHFFFAOYSA-N	426.539	1.126	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)Nc1cccc(C(=O)N2CCc3ccccc32)c1	756294150	MTIFDMVKPHTOPX-INIZCTEOSA-N	442.497	1.477	50	20	IDGD	
COCC[S@@](=O)Cc1cccc(NC(=O)NNC(=O)c2ccc3c(c2)OCCO3)c1	756615123	WHUIKENERRTSLM-SSEXGKCCSA-N	433.486	1.819	50	20	IDGD	
CC(C)CN1C(=O)C(=NNC(=O)[C@@H](C)NS(C)(=O)=O)c2cc(Br)ccc21	756889928	QKIRXHIPNJILTI-SNVBAGLBSA-N	445.339	1.210	50	20	IDGD	
NC(=O)c1ccc(NNC(=O)c2ccc(NC(=O)c3cc(F)cc(F)c3)cc2O)nn1	757400509	QTWVMGVKYSYFFC-UHFFFAOYSA-N	428.355	1.569	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)Nc2cccc3c2CCN3S(C)(=O)=O)c1	758297962	FEACLWSIJZFUGB-UHFFFAOYSA-N	434.474	1.492	50	20	IDGD	
O=C(NNc1nc(O)c2ccccc2n1)[C@H]1CCCN(S(=O)(=O)c2ccccc2)C1	758310419	CGUJSTTYPLDPAF-AWEZNQCLSA-N	427.486	1.879	50	20	IDGD	
O=C(COC(=O)c1ccccc1CN1CCOCC1)NNC(=O)c1ccc(Cl)cc1	758484521	WHBZJXIRRPUXHP-UHFFFAOYSA-N	431.876	1.790	50	20	IDGD	
C[C@@H](NC(=O)OC(C)(C)C)[C@H]1CCCN(C(=O)NNC(=O)CNC(=O)c2ccco2)C1	758861796	OCKQJDOUNGMDOX-KGLIPLIRSA-N	437.497	1.375	50	20	IDGD	
CC(C)NC(=O)N1CCC[C@H]1C(=O)NNC(=O)COc1ccc(Br)cc1	760264028	PJODIJHPHWKAJD-AWEZNQCLSA-N	427.299	1.558	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)[C@@H](C)N2C(=O)c3ccc(C)cc3C2=O)n[nH]1	763150709	ADUWYWJSQMTUCP-CYBMUJFWSA-N	447.451	1.839	50	20	IDGD	
CNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2ccccc2Br)c1C	763482152	FPLDOGANEIFIBX-UHFFFAOYSA-N	433.262	1.517	50	20	IDGD	
COCc1ccccc1NC(=O)C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	763529467	BYMIWQHUENETEK-UHFFFAOYSA-N	439.516	1.131	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cccc(-n3ccnc3)c2)cc(OC)c1OC	763538467	CDPSORKPSJWEQP-UHFFFAOYSA-N	439.428	1.298	50	20	IDGD	
Cc1ccc(N2CCOC2=O)cc1NC(=O)C(=O)NNC(=O)c1ccc2c(c1)OCO2	763558547	LDOSNYBWRPYGSR-UHFFFAOYSA-N	426.385	1.080	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccn(CC(F)F)n2)c(C)n1-c1ccccc1	763600293	DZJKNFAJGUZHTA-UHFFFAOYSA-N	430.415	1.955	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2cc(Cl)ccc2C(=O)N(C)C)c1	763648398	CVNBAAICCNKKFZ-UHFFFAOYSA-N	446.891	1.824	50	20	IDGD	
CCn1cnnc1-c1cccc(NC(=O)C(=O)NNC(=O)COc2ccc(OC)cc2)c1	763661521	PBQPFIPTFAZSEX-UHFFFAOYSA-N	438.444	1.139	50	20	IDGD	
CC(C)Cn1ncc(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)c1C(F)F	763673592	HGFQOYGFCYZNRC-UHFFFAOYSA-N	434.403	1.513	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(OC[C@H]3CCCO3)cc2)cc1	763675245	UHJHROASMIILAI-LJQANCHMSA-N	438.440	1.281	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc2c(c1)CCC(=O)N2	763681553	LRTZMVAWGHHYSR-UHFFFAOYSA-N	426.429	1.135	50	20	IDGD	
CC(=O)NCc1ccc(NC(=O)C(=O)NNC(=O)CSc2ccc(Cl)cc2)cc1	763734566	MJXGOVCOBWKGNC-UHFFFAOYSA-N	434.905	1.854	50	20	IDGD	
C[C@H](CC(=O)c1cccc(Br)c1)C(=O)NNC(=O)CNC(=O)c1cccnc1	763821771	XCIILAJAUHPVQD-GFCCVEGCSA-N	447.289	1.630	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)Cc1ccc(Cl)cc1Br	763824380	ILCLFTMPGYVWAW-UHFFFAOYSA-N	425.670	1.617	50	20	IDGD	
Cc1cn(-c2ccccc2)nc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccccc1F	763857653	NTEXUMRMRPETFO-CQSZACIVSA-N	425.420	1.873	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)Nc1cc(Br)c(F)c(C(=O)OC)c1	763894834	IVBFASLHZKFIAJ-QMMMGPOBSA-N	436.234	1.579	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)C(=O)Nc1ccccc1-c1ccccc1	763916177	BBCVGHYPCNWASE-UHFFFAOYSA-N	427.424	1.729	50	20	IDGD	
CS(=O)(=O)c1c(F)cc(NC(=O)C(=O)NNC(=O)Cc2ccc(Cl)cc2)cc1F	763932190	OMCYXTXAAXOUTB-UHFFFAOYSA-N	445.831	1.350	50	20	IDGD	
COCCOc1ccccc1NC(=O)C(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	763944627	NYTHYVMVPNSZCB-UHFFFAOYSA-N	439.428	1.003	50	20	IDGD	
CCn1cnnc1-c1cccc(NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)c1	763974053	JXSLPFROUKXTNJ-UHFFFAOYSA-N	428.836	1.724	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1ccc(-c2csnn2)cc1	764004475	XHRWQVFUBPKZOR-UHFFFAOYSA-N	425.426	1.376	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)[C@@H](NC(=O)c2cccs2)C(C)C)n1	764032918	JVIGQRJQVOMMGV-INIZCTEOSA-N	438.531	1.201	50	20	IDGD	
CC(C)NC(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)c2ccc(Cl)nc2)c1	764099192	RJKPZOUKJWUQLB-UHFFFAOYSA-N	438.271	1.926	50	20	IDGD	
COCCOc1cc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)ccc1OC	764126720	OSBGTPMPPOQFKT-UHFFFAOYSA-N	437.836	1.479	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1cc2c(cc1SC)OCCO2	764132402	NMHXTFRKIMAOFD-UHFFFAOYSA-N	431.470	1.517	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cccnc2-n2cccn2)o1	764139364	RNHGNLLWBUIVMK-UHFFFAOYSA-N	425.449	1.102	50	20	IDGD	
CCN(CC)C(=O)Cn1ccc2cc(NC(=O)C(=O)NNC(=O)c3ccoc3)ccc21	764160052	LXESFTVSJQNZPF-UHFFFAOYSA-N	425.445	1.502	50	20	IDGD	
CCN1CCN(Cc2ccc(NC(=O)C(=O)NNC(=O)c3ccc(C#N)cc3)cc2)CC1	764176837	HOFKGFPXLGWIRW-UHFFFAOYSA-N	434.500	1.095	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)ccc1O)C(=O)Nc1cccc(-n2ccnn2)c1	764279689	CCPRGLDDGYPZDP-UHFFFAOYSA-N	445.233	1.135	50	20	IDGD	
COC(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)CSc2ccccc2OC)cc1	764398116	ONSQIQSKBFNOJV-UHFFFAOYSA-N	431.470	1.289	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)/C=C\c1ccc(NS(C)(=O)=O)cc1	765316997	HXSRJUWAXRANST-XFXZXTDPSA-N	440.522	1.524	50	20	IDGD	
CC(C)(C)OC(=O)NNC(=O)C(=O)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1	765391041	NVBOMISDZLQIKM-MRXNPFEDSA-N	428.493	1.825	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)c1cn2ccccc2n1	765758450	NLPSWYAMGRTKQM-UHFFFAOYSA-N	426.908	1.567	50	20	IDGD	
COc1ccccc1C1(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)CC1	766636710	SBWAJCHBIAJCPJ-UHFFFAOYSA-N	436.512	1.332	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)CCN1C(=O)[C@H](C)Oc2ccccc21	767266031	QMKKNYSIERXYGL-INIZCTEOSA-N	439.468	1.432	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)C1CCN(C(=O)OCC(C)C)CC1	767321370	TWOPOGLPELOTJI-UHFFFAOYSA-N	433.505	1.733	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C[C@H](CNC(=O)OC(C)(C)C)OC)c2ccccc2c1=O	767430071	DXQIFFFRWIDBPA-CYBMUJFWSA-N	447.492	1.107	50	20	IDGD	
COc1ccc2c(c1)OC[C@H](NC(=O)NNc1ccc(S(=O)(=O)NC(C)C)cn1)C2	768112094	OHLRRHBBWYBYBU-CQSZACIVSA-N	435.506	1.407	50	20	IDGD	
C[C@H](C(=O)NNc1ncccc1[N+](=O)[O-])N1C(=O)c2ccc(Br)cc2C1=O	769652159	CQYHNYIPHOVSOX-MRVPVSSYSA-N	434.206	1.880	50	20	IDGD	
CSCCNC(=S)NNC(=O)c1ccc(S(C)(=O)=O)c(Br)c1	769768944	PAZYUOQMRKUMPN-UHFFFAOYSA-N	426.383	1.325	50	20	IDGD	
COc1ccc(C(=O)N[C@H](C(=O)NNc2nc(O)c3cnn(C)c3n2)c2ccccc2)cc1	770971617	MFMLHWWVHDTBJT-KRWDZBQOSA-N	447.455	1.692	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)c1cccc(I)c1N	772041900	FCVCCONTMUAZSN-SECBINFHSA-N	433.246	1.612	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)[C@H]1CCCN1C(=O)c1ccc(Br)cc1	772066651	ZRWCSRPDRLJWNT-BXUZGUMPSA-N	440.294	1.543	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)[C@@H]1CCCN(C(=O)c2ccc3n[nH]cc3c2)C1	772068673	NFMBFCGYWLYDLZ-GDBMZVCRSA-N	443.504	1.540	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cn(C)nc2-c2ccccc2)cc1	772556997	BIZBCAVJLSQNHY-UHFFFAOYSA-N	441.513	1.477	50	20	IDGD	
COC(=O)c1nc(Cl)ccc1S(=O)(=O)NNC(=O)[C@H](C)Oc1cccc(Cl)c1	773253390	ZVXMOVGQXTXYRU-VIFPVBQESA-N	448.284	1.952	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNS(=O)(=O)c1cccc(C(=O)N(C)C)c1	773266922	UGPXHLAABXKCIH-LBPRGKRZSA-N	425.894	1.819	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@@H](C(C)(C)C)C(F)(F)F)cc1	775977903	CQNRJYUTJJPJDJ-AWEZNQCLSA-N	438.472	1.923	50	20	IDGD	
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCN(S(=O)(=O)CBr)CC1	777779888	SWIJCBIIYNRJQK-ZDUSSCGKSA-N	448.339	1.128	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N[C@@H]2C[C@H](O)C2(C)C)cc1	779228361	AGCGIZUGCVQZHC-HKHIJJCUSA-N	437.500	1.617	50	20	IDGD	
N#Cc1ccc(N2CCC[C@@H](NC(=O)NNC(=O)c3nnc(O)c4ccccc34)C2=O)cc1	780894325	LVGRWDCDTIJJKJ-QGZVFWFLSA-N	445.439	1.347	50	20	IDGD	
O=C(NCC[C@H]1CCCCO1)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	780906041	BVDAWKYXCNZRIC-QGZVFWFLSA-N	438.550	1.764	50	20	IDGD	
O=C(NN=c1cc[nH]cc1)c1ccc(Br)c(S(=O)(=O)N2CCOCC2)c1	781020539	YUNBYGDKLSBBEL-UHFFFAOYSA-N	441.307	1.044	50	20	IDGD	
CCCOc1ccc(NC(=O)C(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1	782897543	QNAJOKNPGCCQMA-UHFFFAOYSA-N	433.490	1.168	50	20	IDGD	
O=C1C[C@H](c2cccc(NC(=O)C(=O)NNC(=O)c3ccc(Cl)cc3Cl)c2)CN1	782925848	CMRZIGDBLHPSFP-NSHDSACASA-N	435.267	1.997	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)C(=O)Nc1cc(Cl)ccc1N1CCCCC1	784001901	GCVHMFRYPKXIQR-UHFFFAOYSA-N	447.879	1.439	50	20	IDGD	
CCn1c(NNC(=O)[C@H]2CC=CC[C@H]2C(=O)N2CCOCC2)nc2ccccc2c1=O	784337218	NMRSQRKOOBZJMJ-JKSUJKDBSA-N	425.489	1.301	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2nc(C(F)(F)F)cs2)cc1-n1nnnc1C	785145087	CWDGGBMNIMPDCT-UHFFFAOYSA-N	442.383	1.536	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCC(=O)c2ccccc21)c1ccc(S(=O)(=O)N2CCCC2)cc1	785689969	WQNGHRLUHBEBPE-LJQANCHMSA-N	441.509	1.992	50	20	IDGD	
Cn1cc(-c2ncccc2NC(=O)C(=O)NNC(=O)Cc2ccc3ccccc3c2)cn1	786417612	SQRXLCBQZFNBFM-UHFFFAOYSA-N	428.452	1.964	50	20	IDGD	
C[C@]1(NNC(=O)N[C@H]2CCN(c3cccc(Br)c3)C2)CCS(=O)(=O)C1	787372186	YYYCQJCKSDZDPE-BBRMVZONSA-N	431.356	1.409	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)cc1N1CCNC1=O	787540694	DHYXFACJCBCFPH-UHFFFAOYSA-N	445.863	1.343	50	20	IDGD	
CC1=C(C(=O)NNC(=O)[C@@H](C)Oc2cccc(Br)c2)[C@@H](C)n2ncnc2N1C	788266589	XYPNCJXVHPKNEO-VXGBXAGGSA-N	449.309	1.940	50	20	IDGD	
COC(=O)c1sc(S(=O)(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)c(C)c1Cl	788492008	QMJAREMMJVEHRM-UHFFFAOYSA-N	449.850	1.734	50	20	IDGD	
COc1c(F)cc(CC(=O)NNc2nnc(-c3ccccn3)s2)cc1S(N)(=O)=O	788565402	QZKQEWINFCHHFE-UHFFFAOYSA-N	438.466	1.081	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)[C@@H](CCS(C)(=O)=O)c2ccccc2)cc1	789116127	KUKBQOCPUQGIMG-SFHVURJKSA-N	432.498	1.518	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)[C@H]1CCCc2c(O)cccc21	789812966	DPBKFJPWYRGEKV-FQEVSTJZSA-N	436.512	1.418	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)C(=O)Nc1ccccc1N1C[C@H]2CC[C@H]1C2	790959913	OKDHZVYDLJSMQV-RDJZCZTQSA-N	432.484	1.652	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)[C@H]2CCN(CC(F)(F)F)C2)c2ccccc2c1=O	791457835	HBNRKPUAHCJNFI-LBPRGKRZSA-N	425.411	1.452	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)[C@@H](C#N)Cc2ccc(C#N)cc2)c2ccccc2c1=O	792017085	XIMKPBKVDHOERL-QGZVFWFLSA-N	428.452	1.993	50	20	IDGD	
COc1cc(C(F)(F)F)ncc1NC(=O)C(=O)NNC(=O)COc1ccccc1F	792267571	IMEZVSCVSMGIMM-UHFFFAOYSA-N	430.314	1.413	50	20	IDGD	
CS(=O)(=O)C1(CNC(=O)NNC(=O)COc2ccccc2Cc2ccccc2)CC1	793267286	UGLCNPVLRKLLFY-UHFFFAOYSA-N	431.514	1.564	50	20	IDGD	
C[C@@H](CC(=O)NNc1ccccc1S(=O)(=O)N(C)C)S(=O)(=O)c1ccc(F)cc1	795160004	BMNQFEKUCSLYTN-ZDUSSCGKSA-N	443.522	1.772	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNS(=O)(=O)c1cc([N+](=O)[O-])cc(Cl)c1F	795280380	GFZUSPLTIOXKAD-UHFFFAOYSA-N	427.801	1.967	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)[C@H]3CCS(=O)(=O)c4ccccc43)nc21	796367771	SAGWTMRSXZZEPW-LBPRGKRZSA-N	430.490	1.691	50	20	IDGD	
CCOc1cc(N2CCN(CC(=O)NNC(=O)c3cccs3)CC2)ccc1[N+](=O)[O-]	796462503	DHAMWFXUJBZQBC-UHFFFAOYSA-N	433.490	1.638	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)NCCN(C)S(=O)(=O)c1ccc(F)cc1)c1ccccc1	798098115	OMEPJOUXAZVWMB-GOSISDBHSA-N	436.509	1.970	50	20	IDGD	
O=C(NNc1nc(-c2ccncc2)no1)c1cccc(S(=O)(=O)NCc2ccco2)c1	798322659	HNUBFPAPYIFYHQ-UHFFFAOYSA-N	440.441	1.960	50	20	IDGD	
COc1coc(C(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)cc1=O	798862918	OWDUICYKWOZRLH-UHFFFAOYSA-N	446.423	1.425	50	20	IDGD	
CCOc1ccccc1CN1CCN(CC(=O)NNC(=O)c2cccc(C#N)c2)[C@H](C)C1	799345246	WIKDETYKJMDGAK-GOSISDBHSA-N	435.528	1.924	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)NCCNS(=O)(=O)c2ccc(Cl)cc2F)cc1	799667050	XFTQRXAMIMNOGY-UHFFFAOYSA-N	442.900	1.964	50	20	IDGD	
Cc1cccc(-n2ncc(C(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)c2C(F)(F)F)c1	800521532	VKRDISHQIIXUOP-LLVKDONJSA-N	430.408	1.395	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1cccc(NN2C(=O)[C@@H]3CC=CC[C@H]3C2=O)c1	801882249	XQRABDPAGFXXQM-APHBMKBZSA-N	428.445	1.067	50	20	IDGD	
C[C@@]12CCC(=O)N1c1ccccc1C(=O)N2CC(=O)NNc1ccc(-n2ccnc2)nn1	804958595	DYDPKEYFGHCYHD-NRFANRHFSA-N	432.444	1.104	50	20	IDGD	
COCCNC(=O)c1cccc(NC(=O)NNC(=O)[C@@H](C)Oc2ccc(C(C)=O)cc2)c1	806627281	PQPUGZJPIJERLG-OAHLLOKOSA-N	442.472	1.886	50	20	IDGD	
CCCN1CCC[C@H]1CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	807549048	MCXUMOSFWKMWLM-KRWDZBQOSA-N	437.566	1.290	50	20	IDGD	
CC(C)Nc1ccc(S(=O)(=O)NCC(=O)NNc2cccc(F)n2)cc1[N+](=O)[O-]	811526185	RGQHFIAYTJHXIF-UHFFFAOYSA-N	426.430	1.371	50	20	IDGD	
COc1nc(N)nc(N2CCCC2)c1C=NNC(=O)[C@H]1CCCN(C(=O)OC(C)(C)C)C1	814974268	ZRRXSTGHCOVHFD-AWEZNQCLSA-N	447.540	1.765	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCc2nncn2C1)C(=O)Nc1ccc(-c2ccc(Cl)s2)nc1	815692915	FQPZOHUXEDAINB-SNVBAGLBSA-N	445.892	1.404	50	20	IDGD	
CC(C)(O)C(=O)NNC(=O)[C@@H]1CCCN1C(=O)OCc1ccc(Br)cc1	816359569	AMRCBJQDJMZVCO-ZDUSSCGKSA-N	428.283	1.468	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)N2CCC(NS(C)(=O)=O)CC2)c(C)n1C[C@H]1CCCO1	843901591	QZZLMHRDRVOYOP-VOMPUTFMSA-N	434.562	1.731	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)c1cccc(CN2C(=O)CSC2=O)c1	895901254	FHVPWJJGFKGHQS-UHFFFAOYSA-N	427.438	1.728	50	20	IDGD	
CCn1c(NNC(=O)CSCc2cc(=O)n3ccsc3n2)nc2ccccc2c1=O	898724370	DOGDALZTHLBBFC-UHFFFAOYSA-N	442.526	1.862	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)CCc2ccc(S(=O)(=O)NC3CC3)cc2)cc1	913466112	JPTYJACPBLEVAA-UHFFFAOYSA-N	431.514	1.595	50	20	IDGD	
CCOC(=O)N[C@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)N(CC)CC)c1)C(C)C	915062950	LBPNCSMEKDJFKJ-INIZCTEOSA-N	442.538	1.249	50	20	IDGD	
Cc1cccc(OCCNC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c1	915256421	RECCRDOJQBQGIN-UHFFFAOYSA-N	425.533	1.917	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)[C@H]2CCCN(C(=O)C3CC3)C2)c2ccccc2c1=O	915263106	OJYZIOOIYOATMP-HNNXBMFYSA-N	425.489	1.216	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2Cl)ccc1Cl	915789219	YWYWIAMQGBVFML-UHFFFAOYSA-N	433.229	1.624	50	20	IDGD	
O=C(NCCCn1ccnc1)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	915880468	BXCJDWPIIWVOHP-UHFFFAOYSA-N	445.483	1.676	50	20	IDGD	
CC(C)CN1CCO[C@H](CNC(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)C1	915922511	SGHSPGIKIFUGEB-CQSZACIVSA-N	438.472	1.963	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NN=Cc2ccc(OCCN(C)C)cc2)cc1	915945415	UCSQDGHDHMAVLY-UHFFFAOYSA-N	432.546	1.706	50	20	IDGD	
CC(=NNC(=O)c1ccc([N+](=O)[O-])cc1)c1ccc(S(=O)(=O)NCCC(=O)O)cc1	916243677	MLACBPQMKCQSPP-UHFFFAOYSA-N	434.430	1.502	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCCNC(=O)NNC(=O)Cc2c[nH]c3ccccc23)cc1	916276978	NZILSYDZZJALIT-UHFFFAOYSA-N	429.502	1.328	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCCCN(C)CC(F)(F)F)nc1	916581146	MXOYFYZJIMOVJE-UHFFFAOYSA-N	426.465	1.279	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=O)c2ccc(Cl)nc2)c1	917253434	KVQYXZITORDAAJ-UHFFFAOYSA-N	447.300	1.388	50	20	IDGD	
COc1ccc(S[C@@H](C)C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1	917918760	DPEBXFUBDGYZSN-JTQLQIEISA-N	443.934	1.938	50	20	IDGD	
O=C(NCc1ccc(Cl)nc1)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	918079870	ICMPPVZMFJGHLA-UHFFFAOYSA-N	437.909	1.664	50	20	IDGD	
Cc1csc(SCc2ccc(C(=O)NNC(=O)N[C@H]3CCS(=O)(=O)C3)cc2)n1	919888463	DFRGQMPXZQVSOV-AWEZNQCLSA-N	440.572	1.875	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2ccc(-n3c(C)cnc3O)cc2)cc(OC)c1OC	919970039	LVYJCQMWTJWJMX-UHFFFAOYSA-N	426.429	1.987	50	20	IDGD	
COCCOc1ccc(NC(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)cn1	920212936	PQOSTELBMCHKBP-UHFFFAOYSA-N	440.460	1.864	50	20	IDGD	
COc1ccc(OCc2ccccn2)c(C=NNC(=O)CSc2nnc(O)nc2O)c1	921258403	FPYOKIVADLIOKN-UHFFFAOYSA-N	442.457	1.508	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)CN1CCC(CN2C(=O)c3ccccc3C2=O)CC1	1116341081	ZCPZNHSTQFXCDU-UHFFFAOYSA-N	448.523	1.693	50	20	IDGD	
CC(C)(C)OC(=O)NCc1ccccc1CNC(=O)NN[C@@]1(C)CCS(=O)(=O)C1	1322308922	RRTMYCGTQOAQDR-IBGZPJMESA-N	426.539	1.592	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@@H]2CC23CCS(=O)(=O)CC3)cc1Br	1323348430	WYMZLZCDDSDRJI-NSHDSACASA-N	431.308	1.434	50	20	IDGD	
Cn1nc2ccccc2c1C(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	1324120241	PFLYYYMZJDVBHN-UHFFFAOYSA-N	440.935	1.806	50	20	IDGD	
COc1ccc([C@H](O)C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](F)Cl)C2)cc1	1778022649	NOGDLTQGMBCXTA-AXVVYFOYSA-N	428.888	1.777	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c(C)c1	1779032469	LCWPRACQKSMWCN-QHCPKHFHSA-N	437.500	1.059	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(CCN(C(=O)CS[C@@H]3CCCCO3)C2)C1	1779084562	QGSCZNXKXQYBGW-RTBURBONSA-N	430.643	1.928	50	20	IDGD	
COc1cccc(OC)c1C(=O)N1CCO[C@]2(CCN(C(=O)CO[Si](C)(C)C)C2)C1	1779300265	NVMNPSVHYLVXLF-NRFANRHFSA-N	436.581	1.999	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](N)Cc1cccnc1)C2	1779543571	GZNXXLBAQITKHE-NNMXDRDESA-N	448.640	1.317	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](COC)NC(C)=O)C1	1779552832	AIMZZDCRIUIXIW-WOCWXWTJSA-N	431.961	1.059	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccn(C(F)F)n3)C2)C1	1779615446	CMBOIDLGOKBTIK-CVEARBPZSA-N	425.263	1.958	50	20	IDGD	
CC(=O)N(C)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@](C)(Cl)CCl)C1	1780707981	ZEZRMKMORVRNFH-AYOQOUSVSA-N	436.380	1.605	50	20	IDGD	
O=C([C@@H]1CCCCN1Cc1ccccc1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1780881401	DPIFZZNUVKODBK-SXWKCWPCSA-N	449.979	1.471	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc(O)c(F)c2)C1	1780925070	UXFWPIZHIFWJJI-WIBUTAKZSA-N	428.888	1.913	50	20	IDGD	
O=C(c1cc2cccn2cn1)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781329478	GLKYTSKGQAPGJU-YOEHRIQHSA-N	425.258	1.468	50	20	IDGD	
Cc1ccc(C(=O)C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)cc1	1781334129	MJEXIYARAXVPET-QAPCUYQASA-N	427.270	1.698	50	20	IDGD	
O=C(c1cncc2cnccc12)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781334151	MNUKKXZCZKSFFP-MAUKXSAKSA-N	437.269	1.764	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc[n+]([O-])cc1)C2	1781903413	SPVZWRDYTYJXQI-GPMSIDNRSA-N	440.338	1.621	50	20	IDGD	
Cc1cnn(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](C)Br)C2)c1	1781998304	RGBMPEVDZGIGKM-HDMKZQKVSA-N	427.343	1.489	50	20	IDGD	
O=C(Cn1cnc2ccccc21)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2	1782096487	UYGZBLNNFTZNJS-DBXWQHBBSA-N	434.924	1.150	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1csc(C)n1)C2	1782170901	FGHKFUVFIMRWER-FRQCXROJSA-N	429.970	1.762	50	20	IDGD	
O=C(c1cccc2nccn12)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1782361763	PMDDILVTAGZEQS-WMLDXEAASA-N	425.258	1.468	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)n2cccn2)C1	1782562274	RVVMZWSZCQEVMY-OIPACUDHSA-N	427.343	1.741	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)[C@@H](C)Cn3cccn3)CCO2)C1	1783342615	CLBRZAFODYDQOR-RLFYNMQTSA-N	427.343	1.523	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)CNC(=O)OC(C)(C)C)C2)C1	1783401302	MCZLWSVOKVRWKC-PXAZEXFGSA-N	434.331	1.124	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](C)Br)C3)C2)c(O)c1	1783535764	CKDBBHVILAYIID-XIKOKIGWSA-N	427.295	1.628	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3nc(O)n4c3CCCC4)CCO2)C1	1783537624	PMYFMLMHUMXMRP-SGTLLEGYSA-N	441.326	1.152	50	20	IDGD	
O=C(C[C@@H]1CNc2ccccc2O1)N1CCO[C@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783946166	JIUIEDUJCIMCFH-BFUOFWGJSA-N	428.316	1.883	50	20	IDGD	
Cc1cnn(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]3C2)c1	1783966004	YMRUSTPUVPRNIS-VGWMRTNUSA-N	427.343	1.202	50	20	IDGD	
Cc1cc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)CBr)C[C@@H]32)nn1C	1784237092	RUNXWACUIRMOQT-QCPWZWHMSA-N	441.370	1.282	50	20	IDGD	
CC(=O)Nc1ccc(Cl)c(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)c1	1785270627	PFQBIXRTHXJQTK-LPHOPBHVSA-N	444.315	1.342	50	20	IDGD	
C[C@H]1Oc2ccc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]4C3)cc2NC1=O	1787447886	IJDZSJNVWRUJKY-QYTYKYCBSA-N	439.871	1.534	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccn(C(F)F)n3)[C@H]2C1	1788940533	BZGSGCWESRPUGC-YDHLFZDLSA-N	430.528	1.723	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21)C1=C2c3ccccc3C(=O)N2CC1	1789168214	MFVYEEDFODRUNO-ZQINRCPSSA-N	447.894	1.771	50	20	IDGD	
CC(C)n1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Br)C[C@@H]32)n1	1789371694	NTAFKNDZDUHQIW-NZBPQXDJSA-N	431.306	1.748	50	20	IDGD	
CCOC(=O)N[C@H](O)C(=O)Nc1ccc(C2(NC(=O)[C@@H](C)Br)CCC2)cc1	1789409781	UJEKNMLXSKUUQU-BDJLRTHQSA-N	442.310	1.968	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(O)n3)C[C@@H]21	1790960787	GDDRFIWVCMAYHY-XPCVCDNBSA-N	426.311	1.554	50	20	IDGD	
CCc1[nH]nc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](Br)CC)[C@H]3C2)c1F	1790961221	MQLOIRUQGJQXSF-MNXVOIDGSA-N	445.333	1.878	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccn(-c4ccccc4)n3)C[C@@H]21	1791254272	RSAGVPMLBIZBNB-BOLBYERCSA-N	446.935	1.719	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3c[nH]c4ncccc34)C[C@@H]21	1791256687	VCLFVYHXDADXHX-WNHJNPCNSA-N	448.951	1.729	50	20	IDGD	
Cc1scc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]3C2)c1C	1791288535	BFURUOLAVOZHBF-BQFCYCMXSA-N	436.578	1.331	50	20	IDGD	
CO[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)CBr)c1ccccc1	1792868512	ZQGREFVPJZKRFP-SOVHRIKKSA-N	439.350	1.995	50	20	IDGD	
C[C@H]1[C@@H](C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](O)CCl)CCN1C(=O)OC(C)(C)C	1793117418	KACPLADROIHRRB-CVWVJMLGSA-N	443.972	1.870	50	20	IDGD	
CN(CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C#CC1CC1)NC(=O)NCc1ccccc1	1793471326	GPKJSIQXJVQCFI-WKCHPHFGSA-N	437.544	1.384	50	20	IDGD	
Cc1nn(-c2ccccc2)c(O)c1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](O)CCl)C2	1794632298	YZMUKOLNKJLEOR-XLNGHYISSA-N	432.908	1.738	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccnc(C(F)(F)F)c1	1794886078	QYBKIOSNXWTRPD-QDMKHBRRSA-N	441.454	1.725	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1	1796188566	VCCWNVNNYHNYMQ-BCDXTJNWSA-N	442.708	1.594	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(C(F)(F)F)n1C	1796712582	MQKOLNQKOSWPIK-NWJSVONSSA-N	437.846	1.501	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](C)n1ccnc1C)C2	1796893006	GPKLFLHNWWNMLX-DSUDFGQDSA-N	439.520	1.525	50	20	IDGD	
CC1=CC[C@@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C3)CC1	1797128468	MJRNPOPCQKMHFZ-ZRPKMVPDSA-N	441.532	1.456	50	20	IDGD	
CC(C)(C)OC(=O)N1CCCC[C@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2	1797737233	DDBGXLYLOABNIU-QRJUGERDSA-N	447.935	1.900	50	20	IDGD	
Cc1ccc(CCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)nc1	1798440689	KSFDUGLPFWPWMM-BCDXTJNWSA-N	436.516	1.273	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H]1CCc3ccccc31)C2	1798443700	XRRGWSCUDYJMAM-ZMMAXQRCSA-N	433.512	1.667	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccnc(C(=O)OCC)c1	1798683903	UWVDWOARLPSMSD-KYHPRHEASA-N	437.924	1.869	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nc3cc([N+](=O)[O-])ccc3[nH]1)C2	1799271815	CGGKTNUTUJHCIG-DZJQYVJYSA-N	435.868	1.692	50	20	IDGD	
Cc1ccc(C(=O)C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)CBr)C3)cc1	1800882554	GXHKLERUAXGGRI-LLLHUVSDSA-N	437.334	1.798	50	20	IDGD	
COc1ccc(COCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C(Cl)Cl)cc1	1801018167	PMLYZIVDAPWIPB-XOIINTDNSA-N	431.316	1.605	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)Cc2cccs2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1	1807370891	MUFIVUBMWXSWOR-AVRDEDQJSA-N	449.341	1.385	50	20	IDGD	
CS(=O)(=O)c1ccc(C(=O)N2CCCC3(CCN(C(=O)[C@H](F)Cl)CC3)C2)nc1	1807679426	FUCKFQOBXHTWSL-HNNXBMFYSA-N	431.917	1.864	50	20	IDGD	
O=C(c1cnn(-c2cccnc2)c1)N1CCCC2(CCN(C(=O)[C@H](O)CCl)CC2)C1	1807705199	FTNFLBBSHANVEP-GOSISDBHSA-N	431.924	1.712	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1	1808263934	RHHGJSFMGNGJOD-FHLIZLRMSA-N	444.923	1.417	50	20	IDGD	
Cc1cc(C(=O)NC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)cn1C	1808731142	SAEOOZJINIVZPV-AVRDEDQJSA-N	440.548	1.421	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)c1cnc2ncccn12	1809332731	QODVONMSUSBTJM-USXIJHARSA-N	428.880	1.044	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2cc3cn[nH]c3cn2)[C@H]1c1cccnc1	1810089071	HRMWBCWYVMPXMP-URLQWDBASA-N	442.907	1.926	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC2(CCCN(C(=O)CSc3ncccn3)C2)CC1	1810127460	XDDPBOMGUOJKLP-UHFFFAOYSA-N	448.593	1.173	50	20	IDGD	
CC(C)CCC(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1	1810304234	BGPQDJTWKYIGKW-DYESRHJHSA-N	438.532	1.836	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@H]1CCN(C(=O)c2c[nH]c(=O)cn2)[C@H]1c1cccnc1	1810544402	MDJSXRUCGFQCAB-BEFAXECRSA-N	429.553	1.336	50	20	IDGD	
Cc1nc(C)c(C(=O)NC[C@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)o1	1810876398	HJXYGWJCTDGBTR-YLJYHZDGSA-N	442.520	1.379	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)c1cccn2nccc12	1812150875	CSMWMZLWHLXVBZ-IPELMVKDSA-N	427.892	1.649	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2cc3cccnn3n2)[C@@H]1c1cccnc1	1813030522	CXGOPFFERWQHAU-VDZJLULYSA-N	442.907	1.698	50	20	IDGD	
C[C@H](CBr)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H]2CCNC(=O)C2)[nH]n1	1814783691	SXJJIUUTNRPAOP-MBNYWOFBSA-N	440.342	1.959	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](C)Nc2cnccn2)n[nH]1	1819422777	BWURLINAIDDGBE-YDHLFZDLSA-N	435.916	1.946	50	20	IDGD	
Cc1ccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)c(O)n1	1820264755	XADKUCSPVREUTC-GOSISDBHSA-N	449.276	1.118	50	20	IDGD	
CC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CS(=O)(=O)N1CCCC1)CC2	1822846432	ZEJHLILYOCTFEG-NWDGAFQWSA-N	448.998	1.498	50	20	IDGD	
O=C(CN1CCCCC1=O)N[C@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1	1823013741	IHJZGXUEOTVEJT-XPTSAGLGSA-N	447.330	1.758	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(C(N)=O)cc1)CC2	1826008783	HDOJOFRNPVKLED-STQMWFEESA-N	436.921	1.722	50	20	IDGD	
O=C(c1ccsc1)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827050688	CVCYZIAETNCYFE-HXUWFJFHSA-N	426.347	1.975	50	20	IDGD	
O=C(CCc1cccnc1)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827054801	KTRSLDNPBYKVMD-QHCPKHFHSA-N	449.360	1.628	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC([C@@H]2CCCCN2C(=O)Cn2cnnn2)CC1	1827193219	QWOFMFAENDWQKB-ZFWWWQNUSA-N	427.347	1.324	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCCC[C@H]1C1CCN(C(=O)CCN2C(=O)C=CC2=O)CC1	1829099439	KSDLZQWGUYBZHJ-SFHVURJKSA-N	449.624	1.773	50	20	IDGD	
O=C(/C=C/c1ccc(F)cc1F)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1830726260	PXXUAUIHQUFBCG-ZRRAGKFRSA-N	444.862	1.034	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3cccc(C)n3)CCO2)C1	1832618682	NHECSSIWOZYRAC-WIYYLYMNSA-N	439.940	1.033	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3cccnc3C)CCO2)C1	1832640216	NWPFBWZIPADBGZ-GHTZIAJQSA-N	439.940	1.033	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)/C=C/c3ccco3)CCO2)C1	1833069217	LJNBVJHGVZZCQK-UPILZFLTSA-N	441.322	1.780	50	20	IDGD	
CC(C)(C)n1ccc(C(=O)N2CCC(N3CCC(NC(=O)[C@@H](O)CCl)CC3)CC2)n1	1833308069	HBLIKOUYSXOUIR-SFHVURJKSA-N	439.988	1.423	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)C(=O)NCC(C)C)CC2)CC1	1833532889	PRYICKHZTXJCLI-GOSISDBHSA-N	429.005	1.738	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3coc(Cl)n3)CCO2)C1	1833560016	MMFZGADJBBZDRE-MEBBXXQBSA-N	436.690	1.181	50	20	IDGD	
Cc1nocc1C(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)Br)CC2)CC1	1834250079	ZZGCNBUEXAJLOF-GFCCVEGCSA-N	427.343	1.952	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3CCCSC3)C2)C1	1834826265	IGZPRTBCACDVEF-PBHICJAKSA-N	435.384	1.371	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)c1c[nH]c2nccc-2c1	1835013119	FFIFGQXWJPLTQQ-SFHVURJKSA-N	433.940	1.299	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)c3cnoc3)CC2)CC1	1835148446	VUDHIEJYRLSFGE-ZDUSSCGKSA-N	427.343	1.891	50	20	IDGD	
N[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1)c1cccc(Cl)c1	1835730978	PZEYIZGQKHDZOM-HDMKZQKVSA-N	434.295	1.331	50	20	IDGD	
N[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1)c1cccc(Cl)c1	1835730979	PZEYIZGQKHDZOM-MPGHIAIKSA-N	434.295	1.331	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1)c1ccncc1O	1835877941	RBLURBRMWGCFBE-MRXNPFEDSA-N	443.317	1.663	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)c1cccc(F)c1F	1836316270	AHTLLOFHPAEGSY-KRWDZBQOSA-N	429.895	1.750	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)/C=C/c3cnc[nH]3)CC2)CC1)[C@@H](F)Br	1836414703	ZACTWNNNPXADRQ-WZHGYECESA-N	442.333	1.685	50	20	IDGD	
N#CCc1ccc(C(=O)N2CCC(OC3CCN(C(=O)[C@H](O)CCl)CC3)CC2)cc1	1836717544	FSMJTRFQHRYFMS-HXUWFJFHSA-N	433.936	1.965	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccn4ccnc4c3)CCO2)C1	1836982768	RXRNQXXNNXOVGR-DYESRHJHSA-N	434.924	1.812	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3ncc(Cl)cn3)CC2)CC1	1837359086	SJOHQXLDJOJLII-MRXNPFEDSA-N	445.347	1.996	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CCC=CO1)CCO2	1837418624	IMFBDCPSQVZRBQ-HDMKZQKVSA-N	431.327	1.309	50	20	IDGD	
Cc1noc(N)c1C(=O)N1CCC(OC2CCN(C(=O)CCBr)CC2)CC1	1837651952	VAVIHCOOTGZUEX-UHFFFAOYSA-N	443.342	1.962	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3nc(O)n4c3CCCC4)CCO2)C1	1837759127	QSZMROHDWSFJDA-XOBRGWDASA-N	440.928	1.012	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(F)c3)CCO2)C1	1838912808	VOMVPBHJZUPROO-SCLBCKFNSA-N	429.286	1.679	50	20	IDGD	
Cc1cccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)c1	1838940739	WVHIYHQQUWRFSX-CRAIPNDOSA-N	429.286	1.756	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CC=CCC1)CCO2	1839130186	NSQDBYFSFAXYFF-BXWFABGCSA-N	429.355	1.973	50	20	IDGD	
C=CCOCCCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839198533	HFHKNSDYPHRYCR-NVXWUHKLSA-N	437.306	1.116	50	20	IDGD	
CNc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)cc1	1839198887	FHLMZORBKHYOPC-CRAIPNDOSA-N	444.301	1.489	50	20	IDGD	
C=CCC(CC=C)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839199344	UQJGDQLVWMYMHD-CRAIPNDOSA-N	433.318	1.902	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3c(C)cccc3Cl)CCO2)C1	1839341647	GEULRFMZZURZAN-JXFKEZNVSA-N	445.343	1.972	50	20	IDGD	
C=C(C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](Br)CC)CCO2)C(F)(F)F	1839966938	UUXLMONBHVMBKF-IUODEOHRSA-N	443.260	1.735	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)C3CCC(CO)CC3)C2)C1	1840030469	NDYGAQLBNQJMBZ-GKSFYBEXSA-N	447.370	1.025	50	20	IDGD	
CC[C@H](C)[C@H](N)C(=O)N1CCCC12CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1842888736	AEKVNHBLPZNJBX-KKUMJFAQSA-N	430.977	1.695	50	20	IDGD	
C[C@H](Sc1cccs1)C(=O)N1CCCC12CN(C(=O)c1cnccc1C(=O)NN)C2	1844168687	NIIBJSWPAWKTQP-ZDUSSCGKSA-N	445.570	1.744	50	20	IDGD	
C[C@@H](C(=O)N1CC2(CCCN2C(=O)/C(C#N)=C/c2ccc(F)cc2F)C1)n1cncn1	1845871935	GRQYIQFXTJVXGH-WBNYAZSOSA-N	426.427	1.928	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC12CN(C(=O)[C@H]1CC[C@H]3CCC(=O)N3C1)C2	1846071974	ZKSYQOSYROIORM-KKUMJFAQSA-N	426.355	1.764	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@H]1C[C@H]3C[C@H]3N1C(=O)OC(C)(C)C)C2	1846365694	PGULBBMVQVAKKQ-QXSJWSMHSA-N	441.956	1.842	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)c2ccc(OCC3CC3)cc2)C1	1846864909	TWLFKQCAYFTLSF-UHFFFAOYSA-N	428.533	1.665	50	20	IDGD	
CC(C)(C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl)c1ncc(Br)cn1	1847560039	WPHRDIKVXMJJJC-AVGNSLFASA-N	445.745	1.318	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)CCC(=O)N1CC(=O)Nc2ccccc21	27266994	HBKSMKNVHUMMQE-UHFFFAOYSA-N	430.848	1.875	50	20	IDGD	
COc1ccc(CN2C[C@H](C(=O)NNC(=O)[C@H]3COc4ccccc4O3)CC2=O)cc1	726496693	GRBBKOJSWSFIJC-DNVCBOLYSA-N	425.441	1.031	50	20	IDGD	
CSCC[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)NNC(=S)NCC1CCC1	727866729	WDOJXENOPKLWHI-HNNXBMFYSA-N	439.563	1.742	50	20	IDGD	
CN(C)N(C(=O)c1ccc(S(=O)(=O)Nc2ccccc2)cc1)[C@H]1CCS(=O)(=O)C1	728175864	HRDULLWSSRFJBP-KRWDZBQOSA-N	437.543	1.593	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCC(C)(C)c2ccc(F)cc2)c1	728753055	KRBSDXQHJAPXEM-UHFFFAOYSA-N	436.509	1.998	50	20	IDGD	
CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)NNC(=O)C1CCN(c2ncccn2)CC1	728854372	UGUSLGYVMXPFPD-UHFFFAOYSA-N	434.478	1.173	50	20	IDGD	
COc1cccc(C2CC(=O)C(=CNNC(=O)C3CCN(c4ncccn4)CC3)C(=O)C2)c1	728981575	BUNRFDKGNUMCCW-UHFFFAOYSA-N	449.511	1.922	50	20	IDGD	
CN(C)C(=O)C[C@@H](NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)c1ccccc1	729051339	PWACZDBYEXBLLV-GOSISDBHSA-N	439.520	1.243	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NC[C@@H]2CCCN(C(C)C)C2)nc1	729618755	HXBWWLSSSDZQRV-INIZCTEOSA-N	426.587	1.859	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)[C@@H]1CCN(c2ccc3c(c2)OCCO3)C1=O	730585833	PRYLWFZCMRKSBR-HNNXBMFYSA-N	440.456	1.079	50	20	IDGD	
CC(=O)N1CCN(C(=O)CCNC(=O)/C(C#N)=C\c2cc(C)n(CC(C)C)c2C)CC1	730787864	WWTWIWLVYMOWSC-BKUYFWCQSA-N	427.549	1.865	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])c1	731050504	LYNBKVDEHPUDRH-UHFFFAOYSA-N	435.824	1.246	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])o1	732052513	MMZXNVMTRIOFQA-LBPRGKRZSA-N	426.389	1.210	50	20	IDGD	
O=C(CN1C(=O)N[C@]2(CCc3ccccc32)C1=O)NNC(=O)NCc1ccc(Cl)cc1	733003256	COACYXSUTFDSNS-NRFANRHFSA-N	441.875	1.564	50	20	IDGD	
Cc1nc(-c2ccccn2)nc(NNC(=O)CN(C)S(=O)(=O)c2cccnc2)c1C	734257013	YMVYFQLCXBOMCV-UHFFFAOYSA-N	427.490	1.314	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)[C@]2(O)CCN(Cc3ccccc3)C2)cc1	735836771	IMXYKHZSSCLAPY-HXOBKFHXSA-N	427.501	1.637	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)CN1C(=O)c2cc(Cl)c(Cl)cc2C1=O	737637987	OVZJOPGGSFPSDG-UHFFFAOYSA-N	436.251	1.954	50	20	IDGD	
O=C(NC[C@@H](O)c1ccccc1Cl)NNC(=O)c1csc(N2CCOCC2)n1	740904034	ZUPCLEGHMCXAED-CQSZACIVSA-N	425.898	1.311	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(CC(=O)NNC(=O)c2ccc3ccccc3c2)C(=O)C1	741212230	GQYRIXRUXBFJOL-UHFFFAOYSA-N	426.473	1.680	50	20	IDGD	
C[C@@H](CC(=O)c1cccc(Br)c1)C(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1	741662939	UKXOGHMJKOSXHI-CMPLNLGQSA-N	431.308	1.240	50	20	IDGD	
O=C(NN=Cc1c(N2CCOCC2)nc2ccccn12)c1csc(N2CCOCC2)n1	741811861	DXXRWTVXODCPPM-UHFFFAOYSA-N	441.517	1.228	50	20	IDGD	
CC(C)c1nn([C@@H]2CCS(=O)(=O)C2)cc1C(=O)NNC(=O)COc1ccc(F)cc1	742478956	XUVIIDVAHKXPEO-CQSZACIVSA-N	438.481	1.345	50	20	IDGD	
CC[C@@H](NC(=O)NNC(=O)Nc1ccc(N(C)C)cc1)c1cccc(S(N)(=O)=O)c1	743592927	OTVKCYYPPLFNCL-QGZVFWFLSA-N	434.522	1.887	50	20	IDGD	
COc1cccc(O[C@H](C)CNC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c1	745881130	FVLIRPPDUYYNCN-CYBMUJFWSA-N	425.445	1.354	50	20	IDGD	
CCOC(=O)C1(C(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)CC1	746094676	BUNSATUCWQXULX-UHFFFAOYSA-N	434.452	1.549	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)CN[C@@H](c2ccccc2)C(F)(F)F)c1	746123395	OSIDVFGHMTZRGH-INIZCTEOSA-N	429.420	1.744	50	20	IDGD	
O=C(NCCNS(=O)(=O)c1ccccc1[N+](=O)[O-])NNc1ccc(Cl)c(F)c1	746770987	WAPYZWGEKNZLCT-UHFFFAOYSA-N	431.833	1.992	50	20	IDGD	
CC(C)(C)OC(=O)NC1(CC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)CCC1	746848652	WVMHLDAVBPYQAT-UHFFFAOYSA-N	432.525	1.678	50	20	IDGD	
CC(C)OCCN1CCC(NC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)CC1	747591140	PAPGLIWENQUEDX-UHFFFAOYSA-N	441.554	1.315	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)N2CCCC2)c1)c1ccccc1	748247910	ZVQWYYNNUHLRIY-OAHLLOKOSA-N	444.513	1.110	50	20	IDGD	
Cc1nc(Cl)cc(NNC(=O)c2cc(S(=O)(=O)N3CCC[C@H](C)C3)cn2C)n1	748334331	IQDMLZKIHOILCE-NSHDSACASA-N	426.930	1.954	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CCOc2ccc(C(N)=O)cc2)cc1Br	748711924	OBLFKQSQDHTUPK-UHFFFAOYSA-N	436.262	1.787	50	20	IDGD	
O=C(NCC1(CN2CCOCC2)CCCCC1)NNC(=O)c1cc([N+](=O)[O-])ccc1O	751819405	SRENJOPCBRPMIC-UHFFFAOYSA-N	435.481	1.527	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(C(=O)NNC(=O)c2ccc(COc3ccccc3)o2)co1	755421183	OIWMRNJCNAJJBS-UHFFFAOYSA-N	433.442	1.777	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)Nc1ccc(=O)n(Cc2ccccc2)c1	755960359	LWVYHUQMGLFJRL-UHFFFAOYSA-N	447.499	1.756	50	20	IDGD	
CN1CC(=O)N(c2cccc(NC(=O)NNC(=O)[C@H]3COc4ccccc4O3)c2)C1=O	755991842	LSQBCJYJEZALGV-MRXNPFEDSA-N	425.401	1.078	50	20	IDGD	
CCCc1cnc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3OC)[nH]n2)s1	756170179	UILZFCMLCKPTEB-UHFFFAOYSA-N	428.474	1.894	50	20	IDGD	
O=C(COC(=O)c1ncccc1OCC(F)(F)F)NNC(=O)c1ccc([N+](=O)[O-])cc1	756466717	MCYMUBGFNLSYJO-UHFFFAOYSA-N	442.306	1.549	50	20	IDGD	
COC(=O)c1ccc(NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c(OC(F)F)c1	756535475	QGTFNFFGJSXEHC-UHFFFAOYSA-N	447.358	1.517	50	20	IDGD	
C[C@H]1C[C@@H](C)C[C@]2(C1)NC(=O)N(CC(=O)NNC(=O)[C@H](C)Oc1ccc(F)cc1)C2=O	756867089	IQUWPPFHCDOYAH-RZNKXZLBSA-N	434.468	1.487	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2ccc(C)c(S(=O)(=O)NC3CC3)c2)cc1OC	757866159	LPKOKIOTQCYUFY-UHFFFAOYSA-N	448.501	1.919	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)c1csc(-c2ccc(Cl)c(Cl)c2)n1	758048105	OXTICKIFTALIJN-SSDOTTSWSA-N	437.330	1.816	50	20	IDGD	
Cc1noc(C)c1S(=O)(=O)N1CCC[C@H](C(=O)NNc2nc(O)c3ccccc3n2)C1	758308760	BEXLJOKZBHKZPH-ZDUSSCGKSA-N	446.489	1.484	50	20	IDGD	
CCOc1ccc(-n2ncc(C(=O)NNC(=O)CCNC(=O)OC(C)(C)C)c2C)nn1	760440253	UIQBNTLOYVEOPC-UHFFFAOYSA-N	433.469	1.045	50	20	IDGD	
CCOC(=O)C[C@H](C)CNC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	760877165	DNVQOUKHWSIMNP-AWEZNQCLSA-N	440.522	1.004	50	20	IDGD	
O=C(COC(=O)c1cnc(-c2cccnc2)s1)NNC(=O)[C@@H]1COc2ccccc2O1	761611245	PPOUHVBTPJKRIR-HNNXBMFYSA-N	440.437	1.349	50	20	IDGD	
COc1ccc(Cn2nccc2NC(=O)C(=O)NNC(=O)c2ccccc2F)c(OC)c1	763555494	GKFSKXAWVBIGMB-UHFFFAOYSA-N	441.419	1.487	50	20	IDGD	
Cc1ccc(S(C)(=O)=O)cc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccccc2)[nH]n1	763604238	JXXXKNAGCJJGQA-UHFFFAOYSA-N	441.469	1.188	50	20	IDGD	
CCNS(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2cccc3ncccc23)cc1	763654271	DKLUMBCIMJMWMT-UHFFFAOYSA-N	427.486	1.677	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(N3CCCCC3)cc2)cc1	763660873	IVGXFHPHQCMTFM-UHFFFAOYSA-N	426.473	1.850	50	20	IDGD	
O=C(COc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1cccc(Cn2cccn2)c1	763695780	WUJWICXWYCURRC-UHFFFAOYSA-N	427.848	1.750	50	20	IDGD	
O=C(NNC(=O)C12CC3CC(CC(C3)C1)C2)C(=O)Nc1ccccc1N1CCOC1=O	763728333	SNCKBGNOCBBCBN-UHFFFAOYSA-N	426.473	1.946	50	20	IDGD	
Cc1ccn(C)c(=O)c1NC(=O)C(=O)NNC(=O)c1cc(-c2ccco2)nc2ccccc12	763765169	XVNSQKKZLXQGAI-UHFFFAOYSA-N	445.435	1.902	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2cccc(N3CCCC3)c2)c2ccccc2c1=O	763786961	SWSLIAOTPKTFKD-UHFFFAOYSA-N	448.483	1.416	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)C(=O)Nc1ccc(OCC2CC2)cc1	763803742	NIHYOPZEKOQELD-UHFFFAOYSA-N	428.401	1.549	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(F)ccc1Br	763814483	VGYOBVIIEFVVHH-UHFFFAOYSA-N	435.209	1.625	50	20	IDGD	
CNC(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)cc1	763839446	HAEYYJOEXZSHGA-HNNXBMFYSA-N	426.473	1.145	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cc(OC)cc(OC)c2)cc1	763861513	QIUVAOROMYNBHK-CYBMUJFWSA-N	431.445	1.656	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)cc1F	763865044	NGGZVTLATHMUOJ-GFCCVEGCSA-N	437.399	1.543	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cnn(-c3ccccc3)c2C)cc1	763871032	CUPITRFCJMMTSI-INIZCTEOSA-N	449.467	1.937	50	20	IDGD	
CCCC(=O)Nc1ccc(Cl)c(NC(=O)C(=O)NNC(=O)Cn2nc(C)cc2C)c1	763893740	YDIIIXMMTASFSI-UHFFFAOYSA-N	434.884	1.678	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(-n3cccn3)nc2)cc1OC	763910294	CGQZQIWTXFLIQI-UHFFFAOYSA-N	438.444	1.464	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc2nc(N3CCOCC3)sc2c1	763956462	OYGHCAFQLXICMW-UHFFFAOYSA-N	439.497	1.841	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1ccc(Br)cc1F	764006700	SRVXGKAJFWRKEJ-UHFFFAOYSA-N	438.209	1.759	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1cccc(N2CCCC2=O)c1	764011400	GWGPIQYGGIJCCR-UHFFFAOYSA-N	430.848	1.875	50	20	IDGD	
CNS(=O)(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cccc3ccccc23)ccc1C	764049685	VPFAMPKJOOAKSR-UHFFFAOYSA-N	440.481	1.456	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cnc4c(c3)c(C)nn4C)n[nH]2)cc1	764112413	XDYVXYXYIUISKW-UHFFFAOYSA-N	432.444	1.375	50	20	IDGD	
C[S@@](=O)Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)ccc1Cl	764125077	RBLXCEYFSAYTMW-MUUNZHRXSA-N	444.296	1.977	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1cccc(OC[C@@H]2CCCO2)c1	764132502	PHGCDVJXPPWRNJ-SFHVURJKSA-N	427.457	1.582	50	20	IDGD	
CC(C)[C@@H]1CC[C@@H](C)C[C@@H]1OC(=O)c1ccccc1NC(=O)C(=O)NNC(=O)CN(C)C	764204220	PDNVZOYZJCXNOJ-GJYPPUQNSA-N	446.548	1.952	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2scnc2C)cc1OCC1CCOCC1	764245321	DAQIPZCAAXEDSE-UHFFFAOYSA-N	432.502	1.965	50	20	IDGD	
CCOC(=O)c1c(CC(C)C)csc1NC(=O)C(=O)NNC(=O)Cc1cccnc1	764268323	HFILCPFRAXSUOE-UHFFFAOYSA-N	432.502	1.847	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)C1CCC(NC(=O)CC2CCCCC2)CC1	764341945	AFGUOHWCARWEAT-UHFFFAOYSA-N	443.548	1.604	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc(C)nc3N(C)C)n[nH]2)cc1	764384611	GIQLGPLVLVXLJV-UHFFFAOYSA-N	435.488	1.808	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1ccc(-n2nccn2)cc1	764394546	QXWHIPFBWIYQSU-UHFFFAOYSA-N	426.458	1.154	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1cc(F)c(OC)c(F)c1	764397761	MPSMVYNWYHYDQV-UHFFFAOYSA-N	425.413	1.860	50	20	IDGD	
Cc1c(Br)cc(C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)c(=O)n1C	764743121	MLRJQHGFQOBRFR-SNVBAGLBSA-N	426.242	1.824	50	20	IDGD	
O=C(O)c1ccc2c(C=NNC(=O)c3ccc(S(=O)(=O)N4CCCC4)cc3)n[nH]c2c1	765559908	MNUGMYLOSCARFR-UHFFFAOYSA-N	441.469	1.810	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@H]3CC(=O)N(C4CCCC4)C3)CC2)cc1	766648723	KLEPQZDCORTMNQ-FQEVSTJZSA-N	441.576	1.051	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)Cn3nc(C)c(Cl)c3C)CC2)cc1	766649038	MGBZRDHMBXAOEQ-UHFFFAOYSA-N	432.956	1.427	50	20	IDGD	
CC(C)OCCCn1c(NNC(=O)c2c([N+](=O)[O-])cnn2C)nc2ccccc2c1=O	766982815	NBDGDTNHJFNBLJ-UHFFFAOYSA-N	429.437	1.610	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)Nc1cnc(Cl)c(Br)c1	767915715	ISAZVOTUNIESCF-UHFFFAOYSA-N	437.645	1.940	50	20	IDGD	
NC(=O)[C@H]1CC(C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)=NN1c1ccc(F)cc1	768261996	CGJDGBHYFLWGKD-OAHLLOKOSA-N	441.448	1.159	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)[C@H]3CC(=O)N(Cc4ccccn4)C3)n[nH]2)cc1	768269054	GIXVTMWTBLSCMR-KRWDZBQOSA-N	432.484	1.844	50	20	IDGD	
C[C@H](C(=O)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1)N1C(=O)NC2(CCCC2)C1=O	768278444	HAORYTAJPNXVCB-LLVKDONJSA-N	428.424	1.230	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)[C@@H](O)[C@H](O)c1nc2ccccc2s1	768639435	QNCATICDEMAXSI-HOTGVXAUSA-N	437.499	1.246	50	20	IDGD	
COC(=O)CNC(=O)NNS(=O)(=O)c1cc(Br)c(Cl)cc1Cl	769864023	CZQGKURZAISBLS-UHFFFAOYSA-N	435.083	1.421	50	20	IDGD	
CNS(=O)(=O)c1ccc(C(=O)NNC(=O)[C@H](C)Oc2ccc3ccccc3c2)cn1	770208819	OKEDHYSULKFPAQ-ZDUSSCGKSA-N	428.470	1.371	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)N1CCN(C(=O)CN2CCCC2)CC1	770659620	TZCAUUHKBIKMNW-HNNXBMFYSA-N	437.928	1.088	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)NC2CCC(O)(c3cccnc3)CC2)cc1C	771359000	PGTMOBZDXCIBPJ-UHFFFAOYSA-N	425.489	1.798	50	20	IDGD	
Cn1cc(C=NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)c(-c2ccccc2)n1	771557611	GZQNEVUBMFCVLP-UHFFFAOYSA-N	430.512	1.995	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C[C@@H]1CSCCN1C(=O)OC(C)(C)C	772221959	QEFMNXLUTJCVBA-CQSZACIVSA-N	439.534	1.964	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)Nc2cnn(Cc3nnc4n3CCCC4)c2)cc1	772638686	BLGKWXWYSKGTMX-UHFFFAOYSA-N	440.464	1.100	50	20	IDGD	
C#CCOc1ccccc1NC(=O)C(=O)NNC(=O)c1cc(Br)ccc1O	773497568	XMZLLIQIEHLMOW-UHFFFAOYSA-N	432.230	1.566	50	20	IDGD	
Cn1nc(-c2cc(F)cc(F)c2)cc1NC(=O)C(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	773513333	AYZBWOWLYAIFAH-UHFFFAOYSA-N	444.354	1.673	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1cccnc1-c1cnn(C)c1	774007587	CIMJIZUSOLJNII-GFCCVEGCSA-N	442.863	1.689	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)c2cccc([N+](=O)[O-])c2N2CCOCC2)cc1	776451567	WRHFSCAJYLKSAT-UHFFFAOYSA-N	442.428	1.358	50	20	IDGD	
Cc1cc2ccccc2nc1NNC(=O)c1cc(S(=O)(=O)N2CCOCC2)cn1C	777476731	OJLMLTPPOIZZGK-UHFFFAOYSA-N	429.502	1.660	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNS(=O)(=O)c2ccc3c(c2)OCO3)cc1	777906401	AFEHECSJGBUOBG-UHFFFAOYSA-N	447.498	1.459	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)N2CC[C@@H](OCCN3CCOCC3)C2)c1C	778333869	GKDKRIOLTFCTTA-PHCAOYFPSA-N	430.549	1.608	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)/C(=C/c1cccnc1)NC(=O)c1ccccc1	778441424	KQPKZSAIDLUIKQ-ATVHPVEESA-N	439.472	1.525	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)CN3CCN(C)C(=O)C3)c3ccccc3n2)cc1	780161376	QOYKCXFZMGZWAF-UHFFFAOYSA-N	431.496	1.745	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](NC(=O)NNC(=O)[C@H]2COc3ccccc3O2)CC1	780668600	CKFVGFDHDDNNSQ-WMLDXEAASA-N	434.493	1.946	50	20	IDGD	
O=C(NNc1ncncc1Cl)C(=O)Nc1ccn(-c2ncccc2C(F)(F)F)n1	782165702	KMXNKZJMJDBQTE-UHFFFAOYSA-N	426.746	1.811	50	20	IDGD	
C=CCNC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)cc1	782895285	ZIDFFKTZIQCXLS-UHFFFAOYSA-N	449.471	1.209	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2ccc(N3CCOC3=O)cc2)c1	783021114	PHOMPDPTXQOVRZ-UHFFFAOYSA-N	432.458	1.191	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(NC(=O)C(=O)NNc2cncc(Cl)n2)ccc1C	783259295	YKJFLOVHRKHHDV-UHFFFAOYSA-N	440.913	1.551	50	20	IDGD	
CC(=O)Nc1ccc(C)c(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)c1	783262406	DAQIJPQICSQNPP-UHFFFAOYSA-N	448.505	1.117	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2cccc(-c3ncco3)c2)nc1	783265906	ZSRQPKPZPOVVAT-UHFFFAOYSA-N	444.473	1.505	50	20	IDGD	
Cc1ccc(Oc2ccc(NC(=O)C(=O)NN[C@]3(C)CCS(=O)(=O)C3)cn2)cc1C	783426509	MFHBKZORHCGMHI-HXUWFJFHSA-N	432.502	1.627	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2cc(C(F)(F)F)ccc2-n2cccn2)CCS(=O)(=O)C1	783427225	NGXPPHDSKBZUSN-INIZCTEOSA-N	445.423	1.028	50	20	IDGD	
CC(C)CCOc1ccc(NC(=O)C(=O)NNC(=O)CNC(=O)c2cccs2)cc1	784003578	JOOHWXIWSRPNCA-UHFFFAOYSA-N	432.502	1.689	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)C(=O)Nc1ccc(-n2cccn2)cc1	784210596	XIJXNOWUZXVGHO-UHFFFAOYSA-N	440.485	1.395	50	20	IDGD	
CC[C@H](C)NS(=O)(=O)Cc1cccc(NC(=O)C(=O)NNc2cccc([N+](=O)[O-])c2)c1	784831366	KSQVEAVGJYXFQX-ZDUSSCGKSA-N	449.489	1.895	50	20	IDGD	
COc1cc(F)ccc1NC(=O)C(=O)NNc1ccccc1S(=O)(=O)NC(C)(C)C	784832908	GMUBTHUTQCPGKD-UHFFFAOYSA-N	438.481	1.993	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc2c(c1)CCN2C(=O)C(=O)NNc1ccnc(F)c1	784852379	XYQZJQDAKLZURG-UHFFFAOYSA-N	435.481	1.284	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNc2cc(Cl)ccn2)cc1OC	784856507	OUSBMPNWTGNKBX-UHFFFAOYSA-N	427.870	1.587	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2ccc(S(=O)(=O)N(C)OC)cc2)cc1Cl	785116379	JHFDESADZJHSRI-UHFFFAOYSA-N	442.881	1.612	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1C	785747166	KIVSLSDFWWKGQE-SFHVURJKSA-N	427.413	1.098	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2cc(C(=O)NCC3CC3)ccc2C)n1	785993971	HICRAXVKUNNPCA-UHFFFAOYSA-N	439.520	1.853	50	20	IDGD	
COC(=O)NCCc1ccc(S(=O)(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)s1	788047371	MNMKHACBKBVQBW-UHFFFAOYSA-N	428.448	1.178	50	20	IDGD	
NC(=O)c1ccc(SCC(=O)NNc2nnc(-c3ccccn3)s2)c([N+](=O)[O-])c1	788563575	LSTKWFPRGYTDNA-UHFFFAOYSA-N	431.459	1.843	50	20	IDGD	
CCOC(=O)c1oc2ccc(S(=O)(=O)NNC(=O)C(=O)NC(CC)CC)cc2c1C	788746486	HEZXKHWVLZNBQV-UHFFFAOYSA-N	439.490	1.532	50	20	IDGD	
CC(C)(C)c1cc(NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)n(-c2ncccn2)n1	789271325	GGAVVLAGFIULMJ-UHFFFAOYSA-N	447.463	1.402	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ncc(C(C)(C)C)s2)nc1	789747634	VQBDVUVWNZQUKE-UHFFFAOYSA-N	440.551	1.604	50	20	IDGD	
CCc1[nH]nc(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c1Br	789866868	IQXVKZBVWHXISW-UHFFFAOYSA-N	449.353	1.708	50	20	IDGD	
CCc1[nH]nc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1Br	789869029	GQCWOOOTFLGBJZ-UHFFFAOYSA-N	444.311	1.060	50	20	IDGD	
COc1c(C(=O)N(C)C)cc(Cl)cc1S(=O)(=O)NNC(=O)NC1CCCCC1	790045401	OASVINZJCFFBIX-UHFFFAOYSA-N	432.930	1.876	50	20	IDGD	
CC(C)(C)OC(=O)Nc1ccc(CC(=O)NNC(=O)[C@H]2COc3ccccc3O2)nc1	791446665	GDABUYHMXNZSTP-QGZVFWFLSA-N	428.445	1.959	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccc3c(=O)[nH]ccc3c2)cc1	793071080	XKFRYLTYRYKVPW-UHFFFAOYSA-N	443.485	1.297	50	20	IDGD	
CCOC(=O)c1cc(S(=O)(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)c(F)cc1C	795325589	DTCHCZRQQCLHIT-UHFFFAOYSA-N	441.393	1.548	50	20	IDGD	
C[C@@H]1CCC[C@H](CNC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)[C@@H]1C	797541825	AGWFLYMALCMOQC-BRWVUGGUSA-N	438.598	1.716	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)NCC3(C#N)CC3)c2)cc1	797581568	YOOBNEQJINEAIX-UHFFFAOYSA-N	443.485	1.744	50	20	IDGD	
COc1ccc(/C=C(/C#N)C(=O)O[C@@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)cc1	798303593	PEYIKIFENZCQCY-WZMONFQBSA-N	429.454	1.820	50	20	IDGD	
O=C(NCCS(=O)(=O)CCc1ccccc1)NNC(=O)c1cnn(-c2ccccc2)c1	799926948	JJEPLLYUDIDZSH-UHFFFAOYSA-N	441.513	1.474	50	20	IDGD	
CNC(=O)CNC(=O)c1cccc(NC(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)c1	800596378	XIWVYQBBKPVAID-OAHLLOKOSA-N	441.488	1.399	50	20	IDGD	
Cn1nnc2c(C(=O)NNC(=O)[C@@H]3Cc4ccccc4CN3Cc3ccccc3)ccnc21	801145513	AMNIVHLJIBMSKN-FQEVSTJZSA-N	441.495	1.751	50	20	IDGD	
COc1ccc2c(c1)OCCN(C(=O)NNC(=O)C1CCN(c3ncccn3)CC1)C2	801746665	DGBKNLGXYRQPIA-UHFFFAOYSA-N	426.477	1.337	50	20	IDGD	
COc1ccc(CN2CC[C@@H](NC(=O)NNC(=O)Cc3ccc(F)cc3)C2=O)c(OC)c1	806027743	QRAJHPIKEQTCOL-GOSISDBHSA-N	444.463	1.517	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)[C@@H]1CCCN(C(=O)c2ccc3n[nH]cc3c2)C1	807369891	OATNGMKNBNPGNS-OAHLLOKOSA-N	431.493	1.352	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(C)cc2)C1	807370714	SOBDRPFOTKQWNG-MRXNPFEDSA-N	441.550	1.332	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)N[C@@H]2CCCN(C(=O)N3CCCC3)C2)cc1C	807459260	WQIKOOLQUYWBJR-QGZVFWFLSA-N	430.509	1.253	50	20	IDGD	
C=CCOc1c(Br)cc(C=NNC(=O)[C@H]2CCS(=O)(=O)C2)cc1OC	812455800	SMIDYVWCCPBOLK-LBPRGKRZSA-N	431.308	1.907	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)N3CCN(c4ccccc4)CC3)n[nH]2)cc1	812475238	VQWLANMLOREBFK-UHFFFAOYSA-N	432.484	1.495	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1ccc(Br)s1)c1cccc(S(N)(=O)=O)c1	813539813	ALCQAMDOFGCGBO-QMMMGPOBSA-N	447.336	1.863	50	20	IDGD	
CCOc1ccc(NNC(=O)C(=O)Nc2cc(N3CCCS3(=O)=O)ccc2F)cc1	815816705	JONDEEFRNFLKRF-UHFFFAOYSA-N	436.465	1.846	50	20	IDGD	
CCn1c(O)nc2cc(C(=O)NNc3ccccc3S(=O)(=O)N(C)C)ccc2c1=O	817053586	XYRNQXYJTLFWOE-UHFFFAOYSA-N	431.474	1.129	50	20	IDGD	
Cc1c(C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)cnn1-c1cccc(C(F)(F)F)c1	818950285	RFZPCINBBMRZHW-LLVKDONJSA-N	430.408	1.395	50	20	IDGD	
CCC1CCC2(CC1)NC(=O)N(CC(=O)NNC(=O)CNc1ccc(C)cc1C)C2=O	825751312	QVPFQZGEDMVRLE-UHFFFAOYSA-N	429.521	1.754	50	20	IDGD	
O=C(COC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1)NNC(=O)c1cccs1	844240192	SODVCNBZCZEHOY-UHFFFAOYSA-N	432.458	1.877	50	20	IDGD	
CC(=O)N1CCN(S(=O)(=O)c2cccc(C(=O)NNc3cc(C)cc(C)c3)c2)CC1	857494370	WQVQDSJYPPWWAV-UHFFFAOYSA-N	430.530	1.913	50	20	IDGD	
COc1cc(C(=O)NN=Cc2c(OC)nc(N)nc2N2CCCC2)cc(OC)c1OC	863951669	PVXNDFWBRZBMPJ-UHFFFAOYSA-N	430.465	1.457	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2ccc(S(=O)(=O)NC(C)(C)C)cc2)C[C@@H](C)O1	912921994	XYJUUQWHUQXSBP-GASCZTMLSA-N	440.566	1.024	50	20	IDGD	
Cc1ccc2ncc(C(=O)NNC(=O)c3nn(C(C)C)c(=O)c4ccccc34)c(=O)n2c1	912988114	AXBGTOQTIKAJHW-UHFFFAOYSA-N	432.440	1.369	50	20	IDGD	
O=C(COC(=O)CCc1ccc(S(=O)(=O)NC2CC2)cc1)NNC(=O)c1ccccc1	913355472	INPDOBAGAUWTTE-UHFFFAOYSA-N	445.497	1.064	50	20	IDGD	
N#Cc1cccc(S(=O)(=O)NCC(=O)NNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c1	913412893	BRRRCGYPJUHEKM-UHFFFAOYSA-N	443.363	1.907	50	20	IDGD	
C=CCNC(=S)NNC(=O)c1ccc(OC)c(S(=O)(=O)N2C[C@@H](C)C[C@@H](C)C2)c1	913435834	YQVIUIDRWUAAEH-OKILXGFUSA-N	440.591	1.657	50	20	IDGD	
O=C(COC(=O)C1CCN(C(=O)COc2ccccc2)CC1)NNC(=O)c1ccccc1	915031632	ZCKLDWOOVQGGQB-UHFFFAOYSA-N	439.468	1.308	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1cccc(NC(=O)NC(C)C)c1	915063979	WNYVUTRERBZZPP-UHFFFAOYSA-N	446.533	1.893	50	20	IDGD	
COc1ccc([C@H](CNC(=O)NNC(=O)COc2ccc(C#N)cc2)N(C)C)cc1OC	915898477	XUKMNAOKJDVTOS-SFHVURJKSA-N	441.488	1.588	50	20	IDGD	
COc1cc(C(=O)NNC(=O)COc2ccc(F)cc2)ccc1OCC(=O)NC(C)C	916131755	MFJXUQPQJIVKEM-UHFFFAOYSA-N	433.436	1.578	50	20	IDGD	
Cc1ccc([C@H](CN2CCOCC2)NC(=O)NNC(=O)COc2ccc(F)cc2)cc1	916216584	XAGNKLSCIOFJHC-FQEVSTJZSA-N	430.480	1.917	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)c1ccc2c(c1)OCCO2)N1CCN(c2ccccc2)CC1	916515032	YFNFBODIFADPCP-QGZVFWFLSA-N	439.516	1.613	50	20	IDGD	
COc1cc(CNC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)ccc1OCC(=O)N(C)C	916641445	HTSQNLXJJKCDFR-UHFFFAOYSA-N	445.432	1.215	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)N[C@H](C)c1ccc(OCC(=O)NC2CC2)cc1	919904365	JAUKJZFUQFWORT-OAHLLOKOSA-N	440.500	1.987	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)NCc1cccc(NC(=O)[C@@H]2CCCO2)c1	920236991	GQDCHYPGGRKYJG-SFHVURJKSA-N	430.436	1.853	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)NCc2cccc(C(=O)N3CCOCC3)c2)c1	920420050	QWRNGGHPUATJKY-UHFFFAOYSA-N	425.489	1.369	50	20	IDGD	
O=C(Cc1cn(-c2ccccc2)nc1-c1ccc(F)cc1)NNC(=O)CN1CCCC1=O	920805678	RXASXYUYCIISBU-UHFFFAOYSA-N	435.459	1.991	50	20	IDGD	
CCNC(=O)NNC(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccc(OC)c(OC)c1	920858375	FJAJMEGJXJCEER-GDNBJRDFSA-N	437.460	1.738	50	20	IDGD	
COCCCNC(=O)NNC(=O)CCC(=O)c1ccc(I)cc1	920862531	QHQHNHJTLLRYPE-UHFFFAOYSA-N	433.246	1.621	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)NC[C@H](c2cccc(F)c2)N2CCOCC2)c1	921199775	PONDQBZJHWJOIA-HXUWFJFHSA-N	446.479	1.860	50	20	IDGD	
O=C(NC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1)NNC(=O)c1cncn1-c1ccccc1	1256705466	JIBPLAYUMDIKOC-GOSISDBHSA-N	446.467	1.944	50	20	IDGD	
CN1C(=O)C[C@@H](C(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)c2ccccc21	1318546849	OBACZHPLYFEJIT-MRXNPFEDSA-N	445.520	1.867	50	20	IDGD	
CC(C)CC(=O)N1CCC(NC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)CC1	1339613640	MKPKLNZPFLDTFI-UHFFFAOYSA-N	439.538	1.463	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cncn1-c1ccncc1)C2)[C@H](F)Cl	1778023710	BWRPQKIACKBFKS-FUHIMQAGSA-N	435.887	1.929	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H]3ON=C(c4ccccc4)O3)C2)C1	1778870872	KDFCGZPPJMAQDX-ZLGUVYLKSA-N	435.908	1.959	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccnc(OC)c3)C2)C1	1779562382	LQHNDIHUZOHZTC-RDTXWAMCSA-N	426.311	1.707	50	20	IDGD	
COc1ccnc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](F)Br)C3)c1	1779701848	IKJADQDQMJPRRU-RVKKMQEKSA-N	444.301	1.908	50	20	IDGD	
CN(C)c1cccc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)c1	1780643938	RENCJTNCCCWSEX-YJBOKZPZSA-N	428.302	1.887	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)cc1C	1780683238	ZRTCAVYKQUYGFE-QHCPKHFHSA-N	437.500	1.059	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)c3cc4cn[nH]c4cn3)CCO2)C1	1781229249	AYPDJBXYPZPRLY-ZWKOTPCHSA-N	426.304	1.638	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc3ccnn3c2)C1	1781350443	MKPRPUXVACLGLU-WAOWUJCRSA-N	434.924	1.716	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3c(F)ccc(OC)c3OC)C2)C1	1781820811	DYZCDYVTVWUTGP-XCLFUZPHSA-N	444.887	1.540	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(C4CC4)cc3)C2)C1	1782026471	JNQFTNLOLIWUPX-QHCPKHFHSA-N	428.533	1.381	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CSCC(=O)O)C1	1782225517	MOOLFFRVSJHYEC-HWWQOWPSSA-N	437.356	1.102	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)C3CCN(c4ccccc4)CC3)CCO2)C1	1783870894	JFSLOZWISKQZSB-NFBKMPQASA-N	449.979	1.987	50	20	IDGD	
CCOC(=O)[C@@H]1CCC[C@H](C(=O)N2CCO[C@]3(CCN(C(=O)C(Cl)Cl)C3)C2)C1	1783939304	BZONCZWOYRTTMF-KSMMKXTCSA-N	435.348	1.990	50	20	IDGD	
CCn1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)CBr)C[C@@H]32)n1	1786169271	QGNNHCWRSDEEAK-YXWQFLTLSA-N	427.343	1.527	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(C)C)[C@H]2C1	1786354666	QFEBRYQTMYKPMN-FNHZYXHNSA-N	433.461	1.769	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC1(c2ccc(NC(=O)c3cncnc3)cc2)CCC1	1787442842	YTQOTMKQGSXOLV-UHFFFAOYSA-N	431.456	1.537	50	20	IDGD	
Cc1cnn([C@H](C)C(=O)NC2(c3ccc(NC(=O)c4cccc(B(O)O)c4)cc3)CCC2)c1	1788149242	FQYJQZBXBGNVOR-QGZVFWFLSA-N	446.316	1.880	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4c(c3)NC(=O)CO4)[C@H]2C1	1788360658	CBRUROZDVNOIHL-MPGHIAIKSA-N	449.935	1.876	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(Cl)c4nncn4c3)[C@H]2C1	1788559386	JCYOYPXRDRRGTB-ZIEJDFEHSA-N	440.331	1.993	50	20	IDGD	
C[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)n1ccccc1=O	1788749967	RNRWSGIQOCXSJK-YGJAXBLXSA-N	444.301	1.080	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(O)ccc3O)[C@H]2C1	1790265181	FSBFJXHEMRPGBM-FUELBLBUSA-N	431.316	1.927	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(C(F)(F)F)nc3)C[C@@H]21	1791251769	VKZLNKMVQMOMHF-XQLPTFJDSA-N	449.857	1.948	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CCc4ccccc4O3)C[C@@H]21	1791257824	VCQXBULVGHNHAB-TXTPUJOMSA-N	436.936	1.614	50	20	IDGD	
CC(=O)N[C@H](Cc1cccc(F)c1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCl	1793117780	DIYZHBXJCVKXMM-ZRSRNVLSSA-N	439.915	1.111	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCn1c(=O)oc2ccccc21	1793982245	JOKVBSJEXPSTFU-UIVXKWKOSA-N	449.935	1.982	50	20	IDGD	
CN(C)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1794142780	PHNRUGMNIAUCNQ-FZKCQIBNSA-N	430.977	1.708	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCBr)n1	1795111390	HQUFDJSZRXWFOU-FVCICTRLSA-N	439.310	1.028	50	20	IDGD	
COc1ccc(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)cc1F	1796190623	RITXFWZKBNQQDY-REPLKXPHSA-N	440.280	1.009	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc(F)n1)C2	1796891997	VEJIZCVLLOPPCA-SSJPOKSSSA-N	426.452	1.607	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Cl)C3)C1	1797222088	ZJMWLVFNNVWZHH-SBJFKYEJSA-N	433.908	1.367	50	20	IDGD	
O=C(CCBr)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2n(n1)CCCNC2=O	1797966312	DXJXLLSGADXYAH-CLLJXQQHSA-N	438.326	1.053	50	20	IDGD	
C[Si](C)(C)c1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)co1	1798414119	UDAVYFUVNISVJN-REPLKXPHSA-N	440.381	1.070	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Br	1799347831	XFSXWVDGZUDXAZ-HPENLJRUSA-N	430.112	1.440	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3[nH]ccc3n1)C2)[C@@H](F)Br	1799348975	FFXYIIATHRQCNQ-ANGCBRKESA-N	425.258	1.457	50	20	IDGD	
COCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](Br)Cc1ccccc1	1800435731	MCWIEPCAQLRTOJ-KYHPRHEASA-N	425.323	1.229	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc(O)cn1)C2	1800644191	MTKPKGADWNFIOC-RBNVPPIJSA-N	426.311	1.093	50	20	IDGD	
CS(=O)(=O)c1ccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C(Cl)Cl)cc1	1801016144	UKCRPMKCMXYVHH-YWVIFJGQSA-N	449.356	1.026	50	20	IDGD	
C[C@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCNC(=O)c1ccc[nH]1)C2	1801958436	BMPWHIAXILBFQV-FQUUOJAGSA-N	425.327	1.556	50	20	IDGD	
CC(C)(C)OC(=O)NCC(C)(C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](O)CCl)C2	1804619761	MWQIXXNDCHIJSM-XGUBFFRZSA-N	431.961	1.775	50	20	IDGD	
CS(=O)(=O)CCC(=O)N1CC[C@@H](CNC(=O)CCBr)[C@@H]1c1cccnc1	1806345954	KSHDHVFAAAPUNU-YOEHRIQHSA-N	446.367	1.307	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCC2(CCCN(C(=O)CCN3C(=O)C=CC3=O)C2)CC1	1806385840	VQAWTMLUSSJRIL-LJQANCHMSA-N	444.359	1.769	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccccc2F)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807359969	FYZZMNRCWIARIX-AVRDEDQJSA-N	447.275	1.534	50	20	IDGD	
CN1CCN(C2(C(=O)NC[C@@H]3CCN(C(=O)[C@H](F)Cl)[C@H]3c3cccnc3)CC2)CC1	1807943415	ZMJNZEFJLIVBKX-BZSNNMDCSA-N	437.947	1.402	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)[C@H]2CC=CCC2)[C@H]1c1cccnc1	1808137187	ZBZSHTYDUZRINX-DJPFJPOOSA-N	448.527	1.756	50	20	IDGD	
O=C(NCC(=O)N1CC[C@H](CNC(=O)[C@H](F)Cl)[C@@H]1c1cccnc1)c1cccnc1	1808308327	JCQVUIHVAJRLFD-JLSDUUJJSA-N	433.871	1.447	50	20	IDGD	
C[C@H](CC(N)=O)C(=O)N1CC[C@H](CNC(=O)[C@H](F)Br)[C@@H]1c1cccnc1	1808649421	RLIVLVZAIVUIHL-DWZYQQQCSA-N	429.290	1.289	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)/C=N/N2CCCCC2)[C@H]1c1cccnc1	1810289069	OKBYGIAQRQJQRQ-NJUJKJDKSA-N	435.956	1.813	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)C23CC(C2)C3)[C@H]1c1cccnc1	1810309093	OZEQGTZHLCVMIS-WOWQTKCMSA-N	434.500	1.200	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)c1nc2ccc(F)cn2n1	1812288466	KFOJKJNEQONZQU-YSVLISHTSA-N	446.870	1.183	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)CSCC(=O)O)[C@H]1c1cccnc1	1812867143	FGRRPXAEFGSUNI-RBOXIYTFSA-N	444.351	1.689	50	20	IDGD	
CC(=O)C[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1813011101	FUYWWLUSVVQZLU-UQASEVPWSA-N	431.537	1.076	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2cncc(F)c2)[C@H]1c1cccnc1	1813070955	MNQFHEAYIFJACQ-KKSFZXQISA-N	442.495	1.308	50	20	IDGD	
COC(=O)CSCC(=O)N1CC[C@@H](CNC(=O)C(Cl)Cl)[C@@H]1c1cccnc1	1813075772	JEYQOUBYFDRVHB-WFASDCNBSA-N	434.345	1.797	50	20	IDGD	
COCCCC(=O)Nc1cc([C@H]2CCCCN2C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[nH]n1	1814748115	TULFJDBCCKHPQL-PTZPRWATSA-N	443.508	1.962	50	20	IDGD	
Cc1ccccc1C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1	1815343825	QVTITWGBUOAPRH-MRXNPFEDSA-N	435.314	1.671	50	20	IDGD	
C[C@@H]1CCC[C@@H]1C(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1	1815344051	DMISCMWSQCEBOP-KCXAZCMYSA-N	427.335	1.485	50	20	IDGD	
O=C(CCBr)N[C@@H]1CCc2nc(NC(=O)c3ccnnc3O)sc2C1	1821095211	OZOSAOCAOFHKQQ-MRVPVSSYSA-N	426.296	1.650	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)Cn2ccncc2=O)n[nH]1	1821656950	SLXYNXDBMIBHFA-UGSOOPFHSA-N	441.319	1.895	50	20	IDGD	
CC(C)CNC(=O)C(=O)N[C@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1	1823005335	WZKMWEABFDCRAM-KWQFWETISA-N	435.319	1.518	50	20	IDGD	
Cc1cc(CC(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)on1	1825016076	ADXIGDSNKZIUCC-NRFANRHFSA-N	439.321	1.139	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CC(F)(F)C(=O)O)CC2	1825642501	WITIJAKAASQYFF-RQJHMYQMSA-N	440.266	1.949	50	20	IDGD	
COCc1oncc1C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](Cl)COC)sc2C1	1825999160	RQXFJVQCRVCTKX-MWLCHTKSSA-N	428.898	1.757	50	20	IDGD	
O=C(CCC(F)(F)F)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827055412	ZKDUUGXBDBDIJS-GOSISDBHSA-N	440.271	1.942	50	20	IDGD	
Cc1cnc2c(C(=O)N3CCCC[C@@H]3C3CCN(C(=O)[C@@H](O)CCl)CC3)cnn2c1	1828594009	GRLPIYAVIPNKNP-MSOLQXFVSA-N	433.940	1.871	50	20	IDGD	
O=C([C@H](O)CCl)N1CCC([C@@H]2CCCCN2C(=O)COC(=O)C(F)(F)F)CC1	1828833158	JGQGMTOADLATDZ-QWHCGFSZSA-N	428.835	1.311	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(OC)c(F)c3)CCO2)C1	1830151706	NPZHENVOTOOWOO-YWZLYKJASA-N	444.887	1.158	50	20	IDGD	
O=C(c1cc(=O)c2ccccc2o1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1830310087	QMIBBNMEOXIYIU-PXNSSMCTSA-N	438.839	1.397	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnn(C(C)(C)C)c3)C2)C1	1830357922	HWOZFQLAUYYZKA-NRFANRHFSA-N	440.972	1.973	50	20	IDGD	
COc1ccc([C@H](C)C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)cc1	1830450899	USCSGMVPYFYEHT-NQYLQCIDSA-N	428.888	1.790	50	20	IDGD	
O=C(C(Cl)Cl)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CCc3ccoc3C1)CCO2	1830940303	IDLPITNYJCGJKG-LIRRHRJNSA-N	431.316	1.645	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(O)nc2)CC1	1831873139	BGMQZDZGCSULEG-GOSISDBHSA-N	431.537	1.394	50	20	IDGD	
Cc1ncc(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](C)CBr)CC3)CC2)[nH]1	1833578010	QGCPDZXJMSUFJT-ZDUSSCGKSA-N	440.386	1.934	50	20	IDGD	
O=C(c1ccc(C(F)(F)F)nc1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1834274349	BORJNSYRBUZMCL-XJKSGUPXSA-N	439.793	1.705	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)c1noc2c1CCCC2	1834994760	ITFBSNWTTOTAJY-QGZVFWFLSA-N	438.956	1.338	50	20	IDGD	
CCc1[nH]nc(C(=O)N2CCO[C@@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)c1Cl	1836231931	BWFAEQLLYNYGSC-INIZCTEOSA-N	439.727	1.499	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC(OC2CCN(C(=O)[C@@H]3C[C@H]3C3CC3)CC2)CC1	1836657033	KYCVXNFJFGVOKR-FCHUYYIVSA-N	440.349	1.025	50	20	IDGD	
Cc1nn(C)c(C)c1C(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836714137	QXGXGWJKCUBPPL-KRWDZBQOSA-N	426.945	1.249	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc4ncccn4n3)CCO2)C1	1836866216	BAIOKIVOOPFBRQ-QRWLVFNGSA-N	435.912	1.207	50	20	IDGD	
C[C@H](CC(N)=O)C(=O)N1CCC(OC2CCN(C(=O)[C@@](C)(Cl)CCl)CC2)CC1	1836911106	RKQRVTCPBLPWMF-YJYMSZOUSA-N	436.380	1.733	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cnc(N)s3)CC2)CC1	1837901178	PYUJCSIBWVQTPW-AWEZNQCLSA-N	430.958	1.591	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccc4ncnn4c3)CCO2)C1	1839047534	UIIWNACHBLBXMI-LAUBAEHRSA-N	449.939	1.136	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(Cl)nc(OC)c3)C2)C1	1839145927	ICGSKBJEOMCFEA-IFXJQAMLSA-N	446.331	1.831	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3ccco3)C2)C1	1839150821	YIIFHKQNWRBIPI-OALUTQOASA-N	433.332	1.905	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)ON=C(C)C)C2)C1	1839965674	HKTOIQDDOOGNAF-RLFYNMQTSA-N	448.358	1.417	50	20	IDGD	
Cc1ccc(C(=O)C(=O)N2CCO[C@@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)cc1	1840097066	URFZUCYBHMLWQJ-QFIPXVFZSA-N	436.936	1.899	50	20	IDGD	
C[C@]1(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCBr)C3)C2)CC=CCC1	1840553135	GUTJDXZEBMZLAH-RBUKOAKNSA-N	429.355	1.974	50	20	IDGD	
COc1cccc(Cl)c1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1	1840735941	XRPQZLJATGPKME-KUHUBIRLSA-N	447.315	1.018	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H](O)[C@H](C(=O)N2CC3(CCCN3C(=O)C(C)(C)CCl)C2)C1	1841226742	CBCOCRHGNGAJFB-CABCVRRESA-N	443.972	1.683	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)[C@@H](NC(C)C)C(C)C)C1	1842998114	NXSUCZJCZRVMHJ-LEBHPONQSA-N	430.553	1.346	50	20	IDGD	
O=C(c1n[nH]c2cc(Cl)ccc12)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843011448	FGRHLJBHYXZVMB-UHFFFAOYSA-N	438.680	1.027	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2cc(C(F)(F)F)ccn2)C1	1844510986	RFTXXEKORKTFRK-UHFFFAOYSA-N	448.405	1.230	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)[C@@H](C)n1cccn1)C2	1844693369	WLWBJRHFTXWDDX-CQSZACIVSA-N	441.444	1.795	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H]1CCN1C(=O)OC(C)(C)C	1847957145	BZDZSLVMJZBPDV-XDQVBPFNSA-N	430.343	1.981	50	20	IDGD	
Nn1c(SCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)nnc1-c1ccccc1Cl	8646998	KKERJESJJKZVOA-UHFFFAOYSA-N	447.864	1.774	50	20	IDGD	
Cc1nc2c3ccccc3nn2c(C)c1CCC(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1	10301985	LGCRZMNZESGMTE-CQSZACIVSA-N	429.502	1.014	50	20	IDGD	
O=C(COC(=O)[C@H]1COc2ccc(Cl)cc2C1)NNC(=O)c1cccc([N+](=O)[O-])c1	16796717	HVAACMIATVBLOR-CYBMUJFWSA-N	433.804	1.804	50	20	IDGD	
Cc1cc(Cl)ccc1OCCCC(=O)NNC(=O)Cc1c(C)nc2nc(N)nn2c1C	17396144	PTRQDBFODFHQBY-UHFFFAOYSA-N	445.911	1.834	50	20	IDGD	
CCOc1ccc(N2C[C@H](C(=O)OCC(=O)NNC(=O)c3cccs3)CC2=O)cc1	21166666	DOFKXKSKPKTCOS-CYBMUJFWSA-N	431.470	1.504	50	20	IDGD	
O=C(CCCNC(=O)NC1CCCCC1)NNC(=O)c1nn(-c2ccccc2)cc1O	105572628	CYPSLYLVSREBBP-UHFFFAOYSA-N	428.493	1.751	50	20	IDGD	
CCCC(=O)N1CCC[C@@H](C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)C1	108316769	IAEPPFSELMTNNE-OAHLLOKOSA-N	427.505	1.777	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN1C(=O)c1ccc2c(c1)OCO2)c1cc(-c2ccccc2)n[nH]1	116447906	IBZWBDKMNYLFRJ-SFHVURJKSA-N	447.451	1.871	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)CNC(=O)CCC2CCCC2)c2ccccc2c1=O	726523730	VIYJSTRTXJHRHU-UHFFFAOYSA-N	427.505	1.825	50	20	IDGD	
Cc1c(/C=C(\C#N)C(=O)N2CCN(S(=O)(=O)c3ccc(C#N)cc3)CC2)cc(C#N)n1C	728218873	DARYNXDQXVOTDN-YBFXNURJSA-N	448.508	1.517	50	20	IDGD	
O=C(COC(=O)c1cccn1Cc1ccccc1)NNC(=O)[C@H]1COc2ccccc2O1	728320035	YAVKXGDBROKNJB-HXUWFJFHSA-N	435.436	1.681	50	20	IDGD	
CS(=O)(=O)NCCc1ccc(C(=O)NNC(=O)c2cccc(OC(F)F)c2)s1	728487144	UTDSXPAWIRPTMK-UHFFFAOYSA-N	433.458	1.516	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)CCS(=O)(=O)C2CCCC2)c1	728528052	ZOCAKRLTGHZDPA-UHFFFAOYSA-N	433.324	1.966	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	728715127	JWHBALSTHFGUGX-IBGZPJMESA-N	426.517	1.969	50	20	IDGD	
COc1ccc(/C=C(\C#N)C(=O)O[C@@H](C)C(=O)Nc2cccc(S(N)(=O)=O)c2)cc1	728881755	OSMXUHVLGFXGRD-LERPTODRSA-N	429.454	1.820	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)N1CCc2sccc2C1	728945085	IUXNFRNHYWVTAG-HNNXBMFYSA-N	443.577	1.532	50	20	IDGD	
COC(=O)c1c(CC(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)[nH]c(C(C)=O)c1C	730075578	OYDGMRQPNCOORI-UHFFFAOYSA-N	448.501	1.439	50	20	IDGD	
O=C(CSc1nnc(O)nc1O)NN=Cc1csc(-c2cccc([N+](=O)[O-])c2)n1	733076206	GSNDHIPETCMMMP-UHFFFAOYSA-N	433.431	1.557	50	20	IDGD	
COCCOc1ccc(-n2nc(C)c(C(=O)NNC(=O)Cc3ccc(F)cc3)n2)cc1	735030071	BDKYEVNZBYNADV-UHFFFAOYSA-N	427.436	1.744	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)Cc2c(F)cccc2Cl)CC1	735117366	SPZXQIMOXXCBCT-UHFFFAOYSA-N	441.916	1.496	50	20	IDGD	
COC[C@@H](C)n1c(SCC(=O)NNC(=O)c2cnn(C)c2)nnc1-c1ccccc1	735446238	GRKMMMSEUKFQBU-CYBMUJFWSA-N	429.506	1.439	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N2CCS(=O)(=O)[C@@H](C)[C@@H]2C)cc1Br	736387424	QALYQTXIKJMNQT-UWVGGRQHSA-N	434.312	1.320	50	20	IDGD	
COc1ccc(S(=O)(=O)CCC(=O)NNc2nc3ccccc3c(=O)n2C)cc1OC	740824267	FJRLHNUUKHYGNT-UHFFFAOYSA-N	446.485	1.258	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)c1ccccc1OCC(=O)Nc1ccccc1F	740851210	UTLBVIYGEDMVGS-UHFFFAOYSA-N	444.463	1.909	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCC[C@@H](C)C2)cc1	740853127	UDHXEUVSOWEFNJ-CQSZACIVSA-N	438.550	1.173	50	20	IDGD	
O=C(CCS(=O)(=O)c1ccc2c(c1)OCCCO2)NNC(=O)COCc1ccccc1	741192530	NFCWSHNPQAUCKI-UHFFFAOYSA-N	448.497	1.376	50	20	IDGD	
CS(=O)(=O)CC[C@H](NC(=O)c1ccccc1Cl)C(=O)NNC(=O)NC1CCCC1	744059568	ULMVAZONBJLNDY-HNNXBMFYSA-N	444.941	1.146	50	20	IDGD	
CC(C)NC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccc3c(c2)OCO3)c1	745147090	UAMFAITZDSNDBS-UHFFFAOYSA-N	434.474	1.246	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)[C@@H]1CCCN1C(=O)Nc1ccc2c(c1)OCCO2	746239435	BXWGRMHNTMQOLQ-INIZCTEOSA-N	440.456	1.924	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)c1cn(-c2cccc(C(F)(F)F)c2)nn1	746549510	QQBSUGMMBGUIGI-UHFFFAOYSA-N	429.362	1.938	50	20	IDGD	
Cn1cc(C(=O)NNS(=O)(=O)c2cc(Br)cc(C(F)(F)F)c2)cn1	746598512	GSICUBXWRUMCBY-UHFFFAOYSA-N	427.202	1.825	50	20	IDGD	
CSCC[C@H](NC(=O)c1ccccc1)C(=O)NNC(=O)Cc1cn2ccccc2n1	746640348	BHABUMSWEHYNIV-KRWDZBQOSA-N	425.514	1.576	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNc3cc(Cl)nc(C)n3)CC2)cc1	747983238	KXWMVPHZIPFLMJ-UHFFFAOYSA-N	438.941	1.196	50	20	IDGD	
CNS(=O)(=O)c1csc(C(=O)NNC(=O)c2ccc(OC(C)C)c(OC)c2)c1	748695855	UCSQBTUXFFODAE-UHFFFAOYSA-N	427.504	1.527	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)NCC1(CN2CCOCC2)CCCCC1	751604003	VTQFOXUZHLLDDK-UHFFFAOYSA-N	434.537	1.687	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)NCc2ccc(C(N)=O)o2)c2ccccc2c1=O	753015523	DRCPXNUSHDLJOV-UHFFFAOYSA-N	440.460	1.423	50	20	IDGD	
Cc1cc(S(=O)(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)c(F)cc1F	753361362	MCTFTXWSOFISOF-UHFFFAOYSA-N	439.849	1.197	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Cc2cc(Cl)cc3c2OCC3)c1	754846203	PYDATOJQSKQXIL-UHFFFAOYSA-N	437.905	1.529	50	20	IDGD	
O=C(COC(=O)Cc1cc(Cl)cc2c1OCC2)NNC(=O)[C@@H]1COc2ccccc2O1	755091485	FKTMBZWKOHIQLL-KRWDZBQOSA-N	446.843	1.348	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)N[C@@H]1CCN(c2ncccc2F)C1	755300699	CPPZSUJJMOAQSN-CYBMUJFWSA-N	425.424	1.335	50	20	IDGD	
C[C@H](NC(=O)OC(C)(C)C)[C@H](C)C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	755313018	PPOYRTRGHNQCIN-UWVGGRQHSA-N	448.929	1.298	50	20	IDGD	
CCNC(=O)c1cccc(NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c1	755513403	JEVYAFRMBINPSJ-UHFFFAOYSA-N	438.532	1.801	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)c2cc(S(N)(=O)=O)c(C)o2)cc1Cl	755670680	QSBLZHLRNSVRQY-UHFFFAOYSA-N	432.842	1.373	50	20	IDGD	
CCCC[C@H](NC(=O)[C@H](C)NC(=O)C(C)(C)C)C(=O)NNC(=O)c1ccc(C)cc1O	755694398	KISJZXMQNIWEPW-HOCLYGCPSA-N	434.537	1.687	50	20	IDGD	
Cc1nnnn1-c1cc(NC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)ccc1F	756335601	IPZRLEIXAALQDG-UHFFFAOYSA-N	437.395	1.468	50	20	IDGD	
COCCS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2nnc(O)c3ccccc23)cc1	756549390	FMAMPMMYODJZSN-UHFFFAOYSA-N	445.457	1.222	50	20	IDGD	
Cc1cc(S(N)(=O)=O)cc(NC(=O)NNC(=O)COc2ccc(Cl)cc2)c1C	756634943	OXCMLMOHJRFFEE-UHFFFAOYSA-N	426.882	1.836	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)COCc2ccccc2)cc1S(=O)(=O)NC1CC1	756680757	CBBNUPDTFKJUES-UHFFFAOYSA-N	448.501	1.505	50	20	IDGD	
CCn1nnnc1-c1cccc(NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1	756682893	APEYZFBZUSHDNP-UHFFFAOYSA-N	436.480	1.219	50	20	IDGD	
CCCNS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2nnc(O)c3ccccc23)cc1	756774235	AXIKPUJGOULFRV-UHFFFAOYSA-N	444.473	1.490	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)Nc1ccc(F)c(-n2nnnc2C2CC2)c1	756776960	DWDBXRPAMRQBNP-UHFFFAOYSA-N	425.380	1.874	50	20	IDGD	
COc1cccc(OC)c1CC(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	756899801	QIMHPTYFLLNQML-UHFFFAOYSA-N	427.866	1.008	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2cc(Br)c(=O)n(C)c2)cc1OC	757690365	SZAADLGYJXGXQM-UHFFFAOYSA-N	425.239	1.632	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c(Br)n1	757738826	FODUXBQVHBCWQD-UHFFFAOYSA-N	431.250	1.866	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1Br	758166906	MHBXMVYQAAOVIZ-UHFFFAOYSA-N	432.238	1.900	50	20	IDGD	
COc1cc(C(C)=NNC(=O)C(=O)Nc2ccccn2)ccc1S(=O)(=O)C(F)F	758386769	AFAYACLXHGEERX-UHFFFAOYSA-N	426.401	1.565	50	20	IDGD	
CC(C)(C)OC(=O)Nc1ccc(CCNC(=O)NNC(=O)C(=O)Nc2ccccn2)cc1	758847414	SCYIYSIUJVHABP-UHFFFAOYSA-N	442.476	1.940	50	20	IDGD	
CS(=O)(=O)c1ccc(CNC(=O)NNC(=O)COc2ccccc2F)cc1Cl	758855689	RABHJHLOBWRFRK-UHFFFAOYSA-N	429.857	1.792	50	20	IDGD	
COc1ccc(CNC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c(F)c1	758864252	AIRQQGIFIVUEIH-UHFFFAOYSA-N	429.496	1.877	50	20	IDGD	
CN(C)C1CCN(CCNC(=O)NNC(=O)c2ccc(F)cc2Br)CC1	759594581	HTRPHIMMYHJICQ-UHFFFAOYSA-N	430.322	1.558	50	20	IDGD	
CCOC(=O)C[C@@H](C)CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	760874345	FJKPKGBAPHGNCN-CQSZACIVSA-N	440.522	1.004	50	20	IDGD	
CCn1c(S)nc2cc(C(=O)NNc3nccc(N4CCOCC4)n3)ccc2c1=O	762856547	RCAVGKUTWKFOKC-UHFFFAOYSA-N	427.490	1.089	50	20	IDGD	
COC(=O)c1cc(Br)c(F)cc1NC(=O)C(=O)NNC(=O)c1ccccn1	763468485	ZNVZGUVRJIGXJL-UHFFFAOYSA-N	439.197	1.170	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccccc2O[C@H]2CCOC2)cc1OC	763550397	LSSYRVFGHRFFOR-AWEZNQCLSA-N	429.429	1.271	50	20	IDGD	
CCn1cnnc1-c1ccccc1NC(=O)C(=O)NNC(=O)COc1ccc(OC)cc1	763660879	JCGITQAJESOGFY-UHFFFAOYSA-N	438.444	1.139	50	20	IDGD	
CN(C)c1ccccc1NC(=O)C(=O)NNC(=O)COc1ccc(Br)cc1	763694061	HFRRBMQTQLYVBC-UHFFFAOYSA-N	435.278	1.680	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2c(C)c(C)nn2-c2ccc(C#N)cc2)cc1	763809786	PMUSMGCFVIOISH-UHFFFAOYSA-N	446.467	1.834	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)[C@@H](Cc1ccccc1)NC(=O)c1ccccc1	763824295	HISNPUNDWMISOX-HXUWFJFHSA-N	445.479	1.000	50	20	IDGD	
CCn1cnnc1-c1ccccc1NC(=O)C(=O)NNC(=O)COc1ccc(F)cc1	763838241	QWCTXEDAIUORGX-UHFFFAOYSA-N	426.408	1.269	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2cc(Cl)ccc2OC[C@H]2CCCO2)n1	763879941	ABNVZAXKTQZHFI-OAHLLOKOSA-N	449.895	1.497	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cnn1CC(C)C	763944797	QCQOTKZZTSNUFQ-UHFFFAOYSA-N	425.449	1.139	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc(C(=O)NCC(C)C)cc1C	764048693	SDZGQFOJUGNSEG-UHFFFAOYSA-N	426.473	1.789	50	20	IDGD	
COc1ccc(CN(C)C)cc1NC(=O)C(=O)NNC(=O)c1cccc(Br)c1	764059643	VVSWCIGZMAODCL-UHFFFAOYSA-N	449.305	1.919	50	20	IDGD	
O=C(CC(F)(F)F)NNC(=O)C(=O)Nc1cc(-c2nnc3n2CCCCC3)ccc1F	764117831	WZMJFWNCNSYTOI-UHFFFAOYSA-N	442.373	1.849	50	20	IDGD	
CC(C)(C)S(=O)(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(C#N)cc2)c1	764182495	NKTMOBBDRLUQRV-UHFFFAOYSA-N	442.497	1.671	50	20	IDGD	
NC(=O)CCSc1ccccc1NC(=O)C(=O)NNC(=O)Cn1ccc2ccccc21	764239400	LWRGCIWRUDBFAR-UHFFFAOYSA-N	439.497	1.395	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)C(=O)Nc1cccc(COc2ccc3c(c2)OCO3)c1	764267651	ILIXOWRNHQVHPX-UHFFFAOYSA-N	448.435	1.718	50	20	IDGD	
CC(C)[C@H](C)N1Cc2cccc(NC(=O)C(=O)NNC(=O)COc3ccccc3O)c2C1	764275782	UUOMCUGHXNAFJH-HNNXBMFYSA-N	440.500	1.917	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)Cc2cc[nH]n2)n(-c2ccccc2C(F)(F)F)n1	764285688	KDCGZHCSYIQHHD-UHFFFAOYSA-N	435.366	1.251	50	20	IDGD	
CN1CCCN(c2ccc(NC(=O)C(=O)NNC(=O)CCc3ccccc3O)cc2)CC1	764288790	MEBMXTUYOYXBKZ-UHFFFAOYSA-N	439.516	1.253	50	20	IDGD	
C[C@@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)C(C)(C)c3ccccc3)cn2)C[C@@H](C)O1	764309223	NONVMWYEZMWONP-HZPDHXFCSA-N	439.516	1.759	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2c3c(nn2C)CCC3)cc1Br	764326811	OMVMIWCENDVUBU-UHFFFAOYSA-N	436.266	1.080	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)C(=O)Nc1cc(C(=O)OC)cc(OC)c1OC)c1ccccc1	764327494	ADICCSKQOWCQGN-OAHLLOKOSA-N	443.456	1.770	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C(=O)Nc1ccc(C(=O)OC)c(C(=O)OC)c1)c1ccccc1	764328036	AWJKOSJUMFLBKM-HNNXBMFYSA-N	441.440	1.540	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C(=O)Nc1cc(Br)cn(C)c1=O)c1ccccc1	764330935	ZDOWFFQDYQUCPD-ZDUSSCGKSA-N	435.278	1.428	50	20	IDGD	
CC(C)NC(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)COCc2ccccc2)c1	764367846	NVQDCYQYRZOGDR-UHFFFAOYSA-N	446.891	1.781	50	20	IDGD	
CCn1nc(C)c(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3OC)[nH]n2)c1C	764377973	UJYGUPVIVLSRQB-UHFFFAOYSA-N	425.449	1.318	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1)C(=O)Nc1ncn(C2CCCCC2)n1	764386767	CFKUMEWUIDUHEO-UHFFFAOYSA-N	440.439	1.712	50	20	IDGD	
CN(CC(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1)[C@H]1CCSC1	764753289	UPKWLAULQANOBE-SFHVURJKSA-N	440.013	1.042	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NN=Cc3ccc4c(c3)CCO4)CC2)cc1	764816647	MOHUJXZOOFSZRQ-UHFFFAOYSA-N	442.541	1.387	50	20	IDGD	
CCCOc1ccc(C(=O)NNS(=O)(=O)c2ccc(O)c(NC(C)=O)c2)cc1OC	765030148	QIWIOOSKXWCAMX-UHFFFAOYSA-N	437.474	1.771	50	20	IDGD	
O=C(CCC(=O)N1CCN(c2ccccn2)CC1)NNC(=O)CSc1ccccc1O	765248003	CUJCTADXHNZRAY-UHFFFAOYSA-N	443.529	1.156	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)c1cc(Br)c(C)n(C)c1=O	765514841	YZAWOAMGDKGCJU-UHFFFAOYSA-N	444.307	1.625	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1)c1cccc(CN2C(=O)CNC2=O)c1	765615220	BWSWUPFASJVHOW-UHFFFAOYSA-N	436.403	1.342	50	20	IDGD	
O=C(NNC(=O)c1nc2ncc(Br)cn2n1)c1cc(-c2ccc(F)cc2)[nH]n1	765618812	OSZMLIZZXGMLHB-UHFFFAOYSA-N	445.212	1.491	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)c1ccc(=O)n(-c2ccccc2F)n1	765761510	YMSYQALZQOBQEF-UHFFFAOYSA-N	443.460	1.569	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1ccnn1Cc1ccccc1Br	766264637	NHNRSLQPQYYCHE-UHFFFAOYSA-N	446.265	1.574	50	20	IDGD	
O=C(/C=C\c1cncc(F)c1)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	766660343	KHLUTUGPGOEEFU-WAYWQWQTSA-N	431.899	1.853	50	20	IDGD	
C[C@@H]1CCCN(C(=O)C(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)C1	767422407	VIDMQYUHUDFZQH-MRXNPFEDSA-N	447.495	1.464	50	20	IDGD	
CC(C)c1cc(NC(=O)C(=O)NNC(=O)CCCc2ccccc2)n(-c2ncccn2)n1	768238882	GSPDVHGXTRDOKZ-UHFFFAOYSA-N	435.488	1.895	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)/C=C\c1ccccc1)C(=O)NNC(=O)c1cc(C)[nH]n1	768277361	JUQDKCARDVJQIO-KLQCNHIUSA-N	437.547	1.191	50	20	IDGD	
C[C@@H]1CCC[C@@H]1CC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	768964175	CEASIXOUHFRYDJ-SJLPKXTDSA-N	437.562	1.614	50	20	IDGD	
COc1ccc2c(c1)nc(CNC(=O)NNC(=O)c1cc(OC)c(OC)c(OC)c1)n2C	770309071	YPDFDRFPTFOJDH-UHFFFAOYSA-N	443.460	1.752	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)[C@@H](NS(C)(=O)=O)C(C)(C)C)c1	770949995	IRVVANRKCXRJLY-GFCCVEGCSA-N	436.328	1.183	50	20	IDGD	
CN1C(=O)N[C@]2(CCC[C@@H]2CNC(=O)NNc2ccc(Br)c(F)c2)C1=O	771335278	SVDJZJQJLGKMIV-ABKXIKBNSA-N	428.262	1.935	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)[C@H]1CCCN1C(=O)Cc1cccs1	772893351	WBLYGTGPADFYQG-MRXNPFEDSA-N	448.932	1.399	50	20	IDGD	
O=C(COC(=O)c1cncnc1-c1ccccc1)NNC(=O)[C@@H]1COc2ccccc2O1	773607182	MUVFCKMKODYXNX-SFHVURJKSA-N	434.408	1.288	50	20	IDGD	
C[C@H](NCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)c1cccc(N2CCOC2=O)c1	775262720	CXFYXICULIGZRO-ZDUSSCGKSA-N	427.417	1.663	50	20	IDGD	
O=C(NNc1cnccn1)c1cc(S(=O)(=O)N2CCOCC2)ccc1N1CCCCC1	775278325	GBTBQSWSAWJOBU-UHFFFAOYSA-N	446.533	1.245	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1ccc(NC(=O)NNC(=O)CN(C)C)cc1)[C@H]1C[C@H]2CC[C@H]1C2	775460094	PCQHJEOGGCXDDC-LDDOYCOJSA-N	437.566	1.504	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)CN2C(=O)N[C@@]3(CCCC(C)(C)C3)C2=O)nc1C	778421483	BRHIIPIOMNDFHK-HXUWFJFHSA-N	432.481	1.296	50	20	IDGD	
Cc1ccc(C)c(-n2c(C)nnc2SCC(=O)NNC(=O)CNC(=O)OC(C)(C)C)c1	778442773	DYTAXFUVEXRNDQ-UHFFFAOYSA-N	448.549	1.957	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)NCc1nnc2ccc(C(F)(F)F)cn12	778587227	RAJGDFBROAAQCT-UHFFFAOYSA-N	431.375	1.103	50	20	IDGD	
N#Cc1ccc(N2CCC[C@@H](NC(=O)NNC(=O)c3cnn(-c4ccccc4)c3)C2=O)cc1	780015533	VKXXUJBGSJADDJ-HXUWFJFHSA-N	443.467	1.884	50	20	IDGD	
COc1ccc(NNC(=O)c2cc(S(=O)(=O)N3CCOCC3)ccc2Cl)nc1	781527192	BWSDLZCBRZFMJX-UHFFFAOYSA-N	426.882	1.521	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NCc1ccccc1CN1CC[C@H](O)C1	781954844	OGGSDEQQYYZSKY-BEFAXECRSA-N	430.480	1.690	50	20	IDGD	
CCN1CC[C@H](NC(=O)NNC(=O)C(=O)N2CCCC2)[C@@H]1c1cc(F)c(F)c(F)c1	782760066	OKOZRTVQPRQZTC-HOCLYGCPSA-N	427.427	1.192	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)c2cccc(NS(=O)(=O)C(F)(F)F)c2)nc1C	782780535	GISXKEPAKUKBAD-UHFFFAOYSA-N	447.395	1.980	50	20	IDGD	
O=C(NNc1nc2ccccc2s1)C(=O)Nc1ccc(F)c(S(=O)(=O)NC2CC2)c1	782815936	JAGGDYKVXWIUNH-UHFFFAOYSA-N	449.489	1.958	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)c2csc(N3CCOCC3)n2)c(C)c1F	782910470	KCYOVENAQGKKIB-UHFFFAOYSA-N	430.483	1.059	50	20	IDGD	
Cc1cc(C)cc(NNC(=O)C(=O)Nc2ccc(C(=O)NCC(=O)N(C)C)c(Cl)c2)c1	783359018	HGBUMWSLUFIQNC-UHFFFAOYSA-N	445.907	1.857	50	20	IDGD	
CCNS(=O)(=O)c1ccc2c(c1)N(C(=O)C(=O)NNc1c(C)cc(C)cc1C)CC2	783366474	IMMJARRBIODCGF-UHFFFAOYSA-N	430.530	1.942	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2cccc(S(C)(=O)=O)c2)c(Br)n1	784844843	QQXCWYLOUAFSQO-UHFFFAOYSA-N	427.280	1.638	50	20	IDGD	
C[C@H]1CCCCN1CC(=O)Nc1ccc(F)c(NC(=O)C(=O)NNc2ncc(F)cn2)c1	784950401	YXSJJUNBHXSNNF-LBPRGKRZSA-N	447.446	1.650	50	20	IDGD	
Cc1ccnc(Oc2ccc(NC(=O)C(=O)NNC(=O)Cc3cn4ccccc4n3)cc2)n1	785060877	RBCBSFBMXHIHJO-UHFFFAOYSA-N	445.439	1.554	50	20	IDGD	
Cc1cc2ccccc2nc1NNC(=O)C(=O)Nc1cc(S(N)(=O)=O)cc(C)c1C	785160450	XXBXOIUROAZZHR-UHFFFAOYSA-N	427.486	1.889	50	20	IDGD	
COc1cc(F)cc(NNC(=O)C(=O)Nc2ccc(S(=O)(=O)N(C)OC)cc2)c1	785235259	RSDSLGPXXUOQEC-UHFFFAOYSA-N	426.426	1.098	50	20	IDGD	
C[C@@H]1[C@@H](C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)CCN1C(=O)OC(C)(C)C	786251496	WRIDASWWDKIGKS-OLZOCXBDSA-N	429.518	1.487	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C)c(C(=O)N(C)C(C)C)c2)c(O)c1	787543518	XZFXBEIMKITJBS-UHFFFAOYSA-N	426.473	1.889	50	20	IDGD	
O=C(NNC(=O)[C@@H](F)C(F)(F)F)c1cccc(S(=O)(=O)NCc2ccccc2)c1	788264274	BVOSDYNATDIYKX-CQSZACIVSA-N	433.383	1.827	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@H]2CC23CN(C(=O)OC(C)(C)C)C3)c2ccccc2c1=O	789133430	JBFDUGJUVGFWAJ-OAHLLOKOSA-N	441.488	1.434	50	20	IDGD	
CN(CC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)[C@H]1CCN(Cc2ccccc2)C1=O	789520262	GTSSDPVTUHGOGO-SFHVURJKSA-N	425.445	1.089	50	20	IDGD	
CN(C)[C@@H]1CCOc2c(NC(=O)C(=O)NNC(=O)CCc3ccccc3O)cccc21	789734253	IEPWKDHZGGRJNV-QGZVFWFLSA-N	426.473	1.496	50	20	IDGD	
CC(C)Oc1cc(NC(=O)C(=O)NNc2ccc(Br)nc2)ccc1C(N)=O	789763426	JIYJSXPZJWDDGS-UHFFFAOYSA-N	436.266	1.812	50	20	IDGD	
COc1cc(C=NNC(=O)N2CCN(C)CC2)cc(I)c1OC	790174611	SUWYEKRKCZLJDS-UHFFFAOYSA-N	432.262	1.599	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)C(=O)Nc1cccc(N2C(=O)CCCC2=O)c1	792356380	NZUVETCPQCKXSF-UHFFFAOYSA-N	447.451	1.471	50	20	IDGD	
CN(C(=O)OC(C)(C)C)[C@H](C(=O)NNC(=O)NCCc1cccs1)c1cnn(C)c1	795588319	NZTFWJAFJRYIAF-HNNXBMFYSA-N	436.538	1.963	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)C(=O)Nc2ccc(F)c(N3CCOC3=O)c2)cc1	797000676	UODQVTZUPOPTFE-UHFFFAOYSA-N	446.460	1.969	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CNC(=O)OCc2ccccc2)cc1OC(C)C	797368976	KQFAKAHDLJUEKX-UHFFFAOYSA-N	442.472	1.795	50	20	IDGD	
Cn1c(=O)n(C)c2cc(N3CCCCC3)c(NC(=O)NNC(=O)Cc3ccncc3)cc21	800593117	VWAHOBIJXWLQQZ-UHFFFAOYSA-N	437.504	1.658	50	20	IDGD	
CN(C)CCS(=O)(=O)c1ccccc1C(=O)NNC(=O)Nc1ccc(N(C)C)cc1	802124628	RLMJKCSUUXOMPO-UHFFFAOYSA-N	433.534	1.554	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)C(=O)Nc1ccc(-c2ccc(Cl)s2)nc1	802571012	FJRSZXNSELDXAO-UHFFFAOYSA-N	447.860	1.572	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)Nc1cc2n(n1)CCCC2	806719748	DBVGERQUBAMBEW-UHFFFAOYSA-N	446.533	1.861	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(Cl)cc3c2OCC(=O)N3)c(OC)c1	806978473	COMQVLXHVMFZPE-UHFFFAOYSA-N	448.819	1.088	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)NCCCN1C(=O)c2ccccc2C1=O	807494811	NSWYDRWEWWVLKY-CYBMUJFWSA-N	428.420	1.610	50	20	IDGD	
COC(=O)C1(CS(=O)(=O)NNC(=O)c2ccc(OC(C)C)c(OC)c2)CCCC1	811678681	YJHCJQYWRCGCIS-UHFFFAOYSA-N	428.507	1.780	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2cccc(S(=O)(=O)C3CCOCC3)c2)cc1	815584983	UHPVEFQUGIZUMW-UHFFFAOYSA-N	433.486	1.730	50	20	IDGD	
Cc1noc(-c2ccc(C(F)(F)F)cc2NC(=O)C(=O)NNC(=O)[C@H]2CCCO2)n1	815778342	MYWQKUJPOPYLBG-GFCCVEGCSA-N	427.339	1.329	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)[C@H](C)S(=O)(=O)C2CCOCC2)c1	816717819	RSXQDCBQYGZRDG-JTQLQIEISA-N	449.323	1.661	50	20	IDGD	
COCc1nnc(-c2cccc(C(=O)NNc3ccccc3S(=O)(=O)N(C)C)c2)o1	817053157	FXSHGAAZOXMHRP-UHFFFAOYSA-N	431.474	1.890	50	20	IDGD	
O=C(NNc1ncncc1F)c1cccc(NS(=O)(=O)c2ccc3c(c2)OCCO3)c1	817067979	TXMJIGIMZCUCQR-UHFFFAOYSA-N	445.432	1.945	50	20	IDGD	
Cc1ccc(-n2cnnc2SCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1C	840512775	RWJXKQXUPYWRML-GOSISDBHSA-N	439.497	1.964	50	20	IDGD	
COc1cc(OC)cc(C(=O)NN=Cc2c(N3CCOCC3)nc3ccccn3c2=O)c1	874069469	WFEDLJIOJDLZCF-UHFFFAOYSA-N	437.456	1.312	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2cc(C(=O)O)n(C)c2)ccc1OCCC(C)C	912980494	JAYLTHRAEPSIHG-UHFFFAOYSA-N	439.490	1.780	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc2ccccc2c1)NNC(=O)Cn1cnc2ccccc21	913495805	NNCPEOTVMOCQJQ-UHFFFAOYSA-N	437.481	1.315	50	20	IDGD	
O=C(NC[C@@H]1CCCO1)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	915879535	REAVLIDGPIUNEO-KRWDZBQOSA-N	432.502	1.288	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)NCCNC(=O)c1ccc(C)c(F)c1	916272497	YJYFJLXMOTZKRE-UHFFFAOYSA-N	432.452	1.672	50	20	IDGD	
COc1cc(C=NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc(OC)c1O	916323809	PGXXPZXPEZDPQB-UHFFFAOYSA-N	433.486	1.958	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)NC1CCN(CCc2ccccc2)CC1	916382807	PVDSARWZUIMTKI-UHFFFAOYSA-N	434.504	1.313	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)NCc2cccnc2N2CCOCC2)c1C	916400237	XNHNRNZHCWLKCP-QGZVFWFLSA-N	427.505	1.833	50	20	IDGD	
CC1CCN(CCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)CC1	916451718	MLFBHNQECACVBY-UHFFFAOYSA-N	437.566	1.147	50	20	IDGD	
O=C(NC[C@@H](c1ccccc1)N1CCc2sccc2C1)NNC(=O)C(=O)NC1CC1	916511364	PYDLPAHEYOEHEV-KRWDZBQOSA-N	427.530	1.457	50	20	IDGD	
O=C(NCCCNc1ccc(C(F)(F)F)cn1)NNC(=O)c1ccc(-n2cnnn2)cc1	916519374	DLHUHRCINRQMAD-UHFFFAOYSA-N	449.397	1.522	50	20	IDGD	
Cc1cccc(-n2nnc(C(=O)NNC(=O)c3ccc(Cl)c(S(N)(=O)=O)c3)c2C)c1	917918713	AOOBAZVSZDVNSP-UHFFFAOYSA-N	448.892	1.260	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3C[C@H](C)O[C@@H](C)C3)c2)c(O)c1	918341293	RJXOGDUSAMMBMG-GJZGRUSLSA-N	447.513	1.573	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCC(=O)Nc2ccc(Cl)cc2)c2ccccc2c1=O	919782852	GNZNFWQLSWGMNK-UHFFFAOYSA-N	442.863	1.653	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)CN2C(=O)N[C@](C)(c3ccc(F)cc3)C2=O)cc1	919836437	PQFCJYUNYJBYFP-JOCHJYFZSA-N	442.447	1.382	50	20	IDGD	
O=C(CCC(=O)c1ccc(-c2ccccc2)cc1)NNC(=O)N[C@@H]1CCS(=O)(=O)C1	919885712	QUXFOPSNSQMCPM-GOSISDBHSA-N	429.498	1.834	50	20	IDGD	
CC(C)Oc1ccc(S(=O)(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)c2ccccc12	919960715	CSGAZCVEPKGLDV-CYBMUJFWSA-N	441.531	1.307	50	20	IDGD	
Cc1cc(C(=O)NNS(=O)(=O)c2cccc(-n3cnnn3)c2)c(C)n1-c1ccccc1	920245831	SHNTWYNMYKWNKR-UHFFFAOYSA-N	437.485	1.693	50	20	IDGD	
O=C(NCC1CCN(Cc2ccccc2)CC1)NNC(=O)c1ccc(-n2cnnn2)cc1	920285030	JYLPBFJPMWJMJN-UHFFFAOYSA-N	434.504	1.519	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)NCc1cccc(C(=O)N2CCOCC2)c1	920422934	NAKBOEBTLXDKHE-UHFFFAOYSA-N	446.891	1.965	50	20	IDGD	
O=C(CN1C(=O)CNC1=O)NNC(=O)c1ccc(CSc2nc3ccccc3[nH]2)cc1	1251257302	MKCHROSODMODIL-UHFFFAOYSA-N	438.469	1.168	50	20	IDGD	
CCC(CC)C(=O)N1CCC(NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)CC1	1318267895	SJJRKOVSFANVQG-UHFFFAOYSA-N	445.568	1.451	50	20	IDGD	
CCCCn1c(=O)nc(O)c2c1nc(CCC(=O)NNc1ccn(C)n1)n2CC(C)C	1344047363	AKKJNDBWEMCATR-UHFFFAOYSA-N	430.513	1.564	50	20	IDGD	
O=C(c1ccc2nc[nH]c2c1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1778511756	UDRVZIHFGFCBJA-RHSMWYFYSA-N	425.258	1.697	50	20	IDGD	
Cc1nc2sccn2c1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1778718772	DBCPIMKHGVDCBL-BLLLJJGKSA-N	445.314	1.838	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)C(C)(C)n3nc(C)ccc3=O)C2)C1	1779232050	BDTZMDXGSCTKFE-HRAATJIYSA-N	438.956	1.524	50	20	IDGD	
COc1ncc(C(=O)N2CCO[C@@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)cc1F	1779296209	JUSQRTSIQUXJAE-LJQANCHMSA-N	425.533	1.524	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(-c4ccncc4)[nH]n3)C2)C1	1779593431	PAGLCRNEISHUBM-ORAYPTAESA-N	448.321	1.699	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)c3cccc(C#N)c3Cl)C2)C1	1780193449	ZOYGOTBRCPABCV-NRFANRHFSA-N	447.923	1.028	50	20	IDGD	
CCOc1ccc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)nn1	1780426734	HPXJCAJUXQYUFE-CJNGLKHVSA-N	431.262	1.009	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H]3CCN3C(=O)OC(C)(C)C)C2)C1	1781016833	IHEBZVPARNZKHI-SXGZJXTBSA-N	429.945	1.843	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)c(F)c1	1781334034	USFXOHDUAJKCSM-RHSMWYFYSA-N	433.249	1.968	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)c3cccc(F)c3Cl)C2)C1	1781683789	UILPOIWVQWLLFP-FQEVSTJZSA-N	440.903	1.296	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)Br)C1	1781998770	HDFAYZFBTGCQGV-HOPMXRPOSA-N	432.359	1.151	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)n1ccnc1C)C2	1782179315	WYQMANREIRRGJZ-XNWPKKHHSA-N	426.945	1.520	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)nc2nccn12	1782354343	JEHSRCJIFDSMGA-RBUKOAKNSA-N	440.331	1.718	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cc(OC)n(C)n3)CCO2)C1	1783351262	HFROLWZFHLHOKL-YVEFUNNKSA-N	429.315	1.046	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](C)NC(=O)OC(C)(C)C)CCO2	1783529205	SUNDHWYKVVKZTL-LXIYXOSZSA-N	448.358	1.513	50	20	IDGD	
CC(C)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=N/O[C@H]3CCCCO3)C[C@@H]21	1783851542	CNPXOXSYSMTTGH-CETKDWOKSA-N	429.945	1.760	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cc(F)c(N(C)C)c(F)c3)CCO2)C1	1783882969	RYOVZFDGMSQNDY-JLTOFOAXSA-N	445.894	1.728	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3c(F)cccc3Cl)C[C@@H]21)[C@H](O)CCl	1784084524	WOCIJYMDULTXMG-BHADISHBSA-N	433.307	1.601	50	20	IDGD	
Cc1nn(C)c(C)c1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21	1784702553	FTELYXZMGOHVKS-ABHRYQDASA-N	431.306	1.321	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)C3(F)CCC3)C2)C1	1784874778	YNBXZSPNABHWDN-LIRRHRJNSA-N	447.935	1.841	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3Cc4ccccc4CN3C)[C@H]2C1	1785024388	KEBZKFWQDVZXHQ-FCMAGTKHSA-N	449.979	1.277	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)COc3cccnc3)[C@H]2C1	1785144314	UURJWZIQDLQNIZ-OTRWWLKZSA-N	440.338	1.471	50	20	IDGD	
C[C@H](Nc1cccnc1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CO[Si](C)(C)C)C[C@@H]21	1786862257	KPMNZWWPNPEKHZ-CAMMJAKZSA-N	434.613	1.713	50	20	IDGD	
O=C(Cc1ncccn1)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1	1786952632	SREIVDVHKATGAX-UHFFFAOYSA-N	430.273	1.147	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@]3(C)C[C@@H]3C)C[C@@H]21	1787507561	DOLIQLDBLGRNGN-TVFIILNASA-N	429.521	1.146	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)c1ccc2c(c1)OCO2	1787807667	ZCNLUEJZUUDIEH-APYUEPQZSA-N	443.269	1.699	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3nnc4cc(C)nn4c3C)[C@H]2C1	1787910911	VUCQQBZMJKFGQG-VGWMRTNUSA-N	434.928	1.352	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)c1ccnc(Br)c1	1788819661	LMVGLNMTSRUURO-FQUUOJAGSA-N	446.729	1.037	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC1(c2ccc(NC(=O)c3cc4n(n3)CCC4)cc2)CCC1	1789356055	WECPBMCQFIERHC-UHFFFAOYSA-N	438.532	1.950	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C=C/c3cnccn3)[C@H]2C1	1791699878	LXHNTGXRFBXGQU-OIUMSMNJSA-N	427.332	1.706	50	20	IDGD	
COc1cccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)CBr)n1	1792870810	VQOBXUYYLJMXCK-JFILPPLUSA-N	426.311	1.324	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)ccc1F)C2	1792874638	VIZCIYMEGVNYEC-LSSIXWDNSA-N	429.286	1.766	50	20	IDGD	
Cc1ccc2[nH]cc(CC(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)c3cccc(B(O)O)c3)C4)c2c1	1794233932	SCEVQNPOIUAQAN-WKCHPHFGSA-N	445.328	1.651	50	20	IDGD	
O=C(COCc1ccccc1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2	1795424724	DEZNRQSZFZLQLR-YALNPMBYSA-N	429.286	1.483	50	20	IDGD	
Cc1ccn2ncc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@@H](C)CBr)C4)c2c1	1796269022	JATQYOVINCRZCI-AFIMGQEJSA-N	449.349	1.877	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CC[C@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Cl)C1	1796365174	VBJSAUFYRZVSHQ-UGYDUONOSA-N	447.935	1.804	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1cc2cccnc2[nH]1	1797459712	SYEXOIIDPMIRSK-ZMJPVWNMSA-N	425.258	1.457	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc2cncn2c1	1798194100	YVBKTSWLYAXVBA-MVUGMWCJSA-N	447.499	1.720	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1c[nH]c2cnccc12	1798240095	TWTXOFAOPNNDME-BTTYYORXSA-N	433.472	1.127	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(N(C)C)cc1	1798935155	DKUOZXGEYXYOPV-SCNOPHJPSA-N	438.366	1.987	50	20	IDGD	
Cc1nc[nH]c1CSCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@](C)(Cl)CCl	1799276572	NNJKMLDTKPXINB-ZDFLXESQSA-N	449.404	1.777	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(F)cc([N+](=O)[O-])c1	1799629081	WTDMGXIVQGXLMK-VZAMPYOESA-N	429.832	1.191	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnc2ccc(F)cn12	1800064023	KNESNEGJWGMUOB-JZGBQWHFSA-N	443.306	1.913	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](F)Br)[C@H]1CC[C@@H]2CCC(=O)N2C1	1800161676	CGRSFTZOVOVSLO-ZNTUPDCTSA-N	430.318	1.716	50	20	IDGD	
CC(C)[C@H]1CC[C@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cccc(B(O)O)c2)C3)CC1	1800654740	MWCXVJNZFWVQKL-IIHZSMLWSA-N	442.365	1.032	50	20	IDGD	
Cc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)Br)nc2nccn12	1800761977	LELAVGYGNASLHN-XPCVCDNBSA-N	436.310	1.024	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1(c2ccccc2)CCC1	1800917302	OYLJTHDGEQGWIA-OPMZPASUSA-N	442.560	1.071	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)Br)C3)C1	1800967344	OVRXOXZURVEIBV-FBRBKTQXSA-N	445.354	1.339	50	20	IDGD	
CC[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCC(=O)NN(C)C)c1ccccc1	1801013022	KQRDUCFGZYKUGR-VQQMMKBISA-N	430.549	1.143	50	20	IDGD	
CCC[C@@H](NC(C)=O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](Br)CC)C2	1802037811	IYZIEWILSUZHDR-YIDVYQOGSA-N	432.359	1.054	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)COc1ccc(C(=O)OC)cc1)C2	1802282495	ILXQHNXLYQKMJG-KYHPRHEASA-N	438.908	1.744	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@H]1CCN(C(=O)Cn2cncn2)[C@H]1c1cccnc1	1803008218	JIIKONWYJDRRCN-UNEWFSDZSA-N	435.326	1.410	50	20	IDGD	
CCOC(=O)C(C)(C)C(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]1c1cccnc1	1803148918	QZPDUTUBJBIOIF-BZUAXINKSA-N	425.913	1.276	50	20	IDGD	
CCOC(=O)N1CCC(C(=O)N2CCC3(CCCN(C(=O)[C@@H](O)CCl)C3)CC2)CC1	1805528966	CCHPKKJJUPTZJO-KRWDZBQOSA-N	443.972	1.686	50	20	IDGD	
CC(=O)NCCC(=O)N1CC[C@H](CNC(=O)CCBr)[C@@H]1c1cccnc1	1806346306	FYYOAWHGOUNQGA-QAPCUYQASA-N	425.327	1.399	50	20	IDGD	
Cc1ccncc1C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1807361951	JYLXLFXPJUNCON-UGKGYDQZSA-N	444.300	1.098	50	20	IDGD	
Cc1ccoc1C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1807375847	QFUUNYPINXQDOJ-UYAOXDASSA-N	433.273	1.296	50	20	IDGD	
COc1nccc(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)c1F	1807711228	KDTSLPRHAJGQQV-QRTARXTBSA-N	436.871	1.544	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1CCN(C(=O)Cn2cncn2)[C@@H]1c1cccnc1	1808294909	CRMFDEIMLCQSLX-LESCRADOSA-N	425.320	1.615	50	20	IDGD	
COC(=O)C1(C(=O)N2CC[C@H](CNC(=O)[C@@H](F)Br)[C@H]2c2cccnc2)CC1	1808677826	DFTMDLLCBIVUJL-MGPQQGTHSA-N	442.285	1.731	50	20	IDGD	
CCOC(=O)C(C)(C)C(=O)N1CC[C@H](CNC(=O)[C@H](Cl)COC)[C@@H]1c1cccnc1	1813036987	AAYQLNLGWYYIMB-ZACQAIPSSA-N	439.940	1.931	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)Cc2cccs2)[C@@H]1c1cccnc1	1813070080	DGOSITRJHVDBCH-HTAPYJJXSA-N	443.573	1.765	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)C(=O)c2ccco2)n[nH]1	1815757883	KJQOKNPRXXANHR-CQSZACIVSA-N	430.465	1.251	50	20	IDGD	
O=C(CC1CCOCC1)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1817164228	FTZPGOMFAZBMLC-IBGZPJMESA-N	440.309	1.212	50	20	IDGD	
Cc1ccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)nc1C	1817473182	KJVBVTHNDXGDSX-FQEVSTJZSA-N	447.304	1.721	50	20	IDGD	
Cc1ccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)c(C)n1	1817477084	YLOGKFNTEUVZDF-FQEVSTJZSA-N	447.304	1.721	50	20	IDGD	
Cc1ncc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2ccc(B(O)O)cc2)CC3)s1	1817889803	RUDMUXOTLMARSI-ZDUSSCGKSA-N	442.331	1.127	50	20	IDGD	
CCOC(=O)N[C@@H](O)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCBr)[nH]n1	1819239130	CQCRPTDGBLCJJN-NHYWBVRUSA-N	446.302	1.251	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)C1CCCCC1)CC2	1819795218	KHHYCPKSYUWXRD-ZDUSSCGKSA-N	442.545	1.948	50	20	IDGD	
O=C(CC(F)(F)C(=O)O)N[C@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1	1823002427	DBHPCUCLJWCPCZ-SSDLBLMSSA-N	444.229	1.856	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)[C@H]2CCCCO2)CC1	1823819556	YACZMPGNOXVTFQ-NHCUHLMSSA-N	428.338	1.169	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)on1	1825966379	PBUICKLMJIAUTA-GOSISDBHSA-N	440.504	1.529	50	20	IDGD	
Cc1nc(C(=O)N[C@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)ccc1F	1826080405	IUVAYDQYOJMLDP-LBPRGKRZSA-N	448.524	1.584	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1CCc2nc(NC(=O)CCn3ccnn3)sc2C1	1826877422	FHMSRUNMHMOTOV-QLJPJBMISA-N	431.349	1.973	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(=O)n3[nH]nnc3n2)CC1	1827400119	ZWRGVORZMQIVDK-GOEBONIOSA-N	449.943	1.453	50	20	IDGD	
Cc1nccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)n1	1827884690	LRBBPUKHHDTMIL-NRFANRHFSA-N	436.321	1.012	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(F)nc3F)CCO2)C1	1829525438	RWBWYZTVNKSOOU-LJQANCHMSA-N	431.867	1.695	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3Cc4ccccc4O3)C2)C1	1830362396	UYSWZUQKPVNHSI-PGRDOPGGSA-N	436.936	1.712	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccnn3CCOC)C2)C1	1831647573	XTWZNHLFZAMJKN-OXJNMPFZSA-N	442.944	1.007	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CN2CCNC2=N)CC1	1831650506	LSCIBXVEJVKOQV-DZGCQCFKSA-N	428.375	1.229	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccn4ccnc4c3)C2)C1	1831652326	YSWCUCVIRODRIP-UWJYYQICSA-N	434.924	1.812	50	20	IDGD	
CCc1oncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1	1831872072	NBGLSFJTABDMFJ-GOSISDBHSA-N	433.553	1.843	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1Cc3ccccc3CN1C)CCO2	1832472842	SZAZNPDPCXMFFJ-SXWKCWPCSA-N	449.979	1.517	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)nn1C	1834122564	VQONGTQZZPIYOQ-ROUUACIJSA-N	433.336	1.035	50	20	IDGD	
O=C(Cc1ccc(F)c(F)c1)NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1834530490	PEJPDKXZNVMZPW-LJQANCHMSA-N	443.922	1.679	50	20	IDGD	
Nc1ncc(C(=O)NC2CCN(C3CCN(C(=O)CCBr)CC3)CC2)s1	1834766257	PIJMOGDCBOSTCD-UHFFFAOYSA-N	444.399	1.696	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](N)Cc3cscn3)CC2)CC1	1835049831	YKUVBYYOXFYQBT-MSOLQXFVSA-N	442.029	1.602	50	20	IDGD	
N[C@H](CC(=O)N1CCC(N2CCC(NC(=O)[C@H](F)Cl)CC2)CC1)c1cccnc1	1835080346	QDGMKXSVLVBYNF-MJGOQNOKSA-N	425.936	1.578	50	20	IDGD	
O=C(NCC(=O)N1CCC(N2CCC(NC(=O)[C@H](F)Cl)CC2)CC1)c1ccco1	1835080593	YKARVYJPONLWQX-KRWDZBQOSA-N	428.892	1.115	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)CC(F)(F)F)CCO2)C1	1835327777	UXUJILHNHKLKFW-RISCZKNCSA-N	431.249	1.426	50	20	IDGD	
O=C(C(Cl)Cl)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1Cc3ccccc3O1)CCO2	1836654028	LXXYNTWEIPSGOE-HNAYVOBHSA-N	429.300	1.250	50	20	IDGD	
CC(C)(C)OC(=O)CC(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836713304	CZWLBPBHVDGQEQ-INIZCTEOSA-N	432.945	1.317	50	20	IDGD	
O=C(c1ccn2ccnc2c1)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1836989568	YOADIUSGVAOBJU-SFHVURJKSA-N	427.288	1.208	50	20	IDGD	
Cc1cc(/C=C/C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)no1	1837557278	GVDRSKSOZPEHAO-LUQLLCLNSA-N	446.273	1.143	50	20	IDGD	
Cc1ccc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)cc1	1839199302	MKGXORQREYEMTI-MJGOQNOKSA-N	443.313	1.684	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CC3CCOCC3)C2)C1	1839963559	OHFCKWRIPJBNGC-APWZRJJASA-N	447.370	1.433	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)/C=C/c3cnc[nH]3)C2)C1	1839967246	GVBFBPRUJXALED-AWXCJNTOSA-N	441.326	1.053	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4c(c3)COC4)C2)C1	1840152616	NJSNZAWHESIELS-WIYYLYMNSA-N	438.908	1.041	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C1(C#N)CCC1)CCO2	1840812485	UJHQRPSBSDYATN-KSSFIOAISA-N	428.327	1.168	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)c1cccnc1CS(C)(=O)=O)C2	1841667085	PBEZANWYKPSABN-OAHLLOKOSA-N	427.954	1.851	50	20	IDGD	
C[C@@H](Sc1cccs1)C(=O)N1CCCC12CN(C(=O)c1cccc(B(O)O)c1)C2	1844167985	XMDFRXXNAOCNIR-CQSZACIVSA-N	430.360	1.426	50	20	IDGD	
CC[C@H](NC(C)=O)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1847295661	IWPIVMWHURASAZ-VGWMRTNUSA-N	444.960	1.235	50	20	IDGD	
O=C(CCc1ccc(F)c(F)c1)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cccc(B(O)O)c1	1847410905	ABUKHTIYYZOSIQ-PMACEKPBSA-N	428.244	1.093	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CCc1ccc(C)nc1	1848185542	UEOVMNJJIKNFRS-FMEPYYHXSA-N	436.516	1.658	50	20	IDGD	
C[C@H]1Oc2ccccc2N(CCC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)C1=O	10159924	ALKUNRNIVXMFOI-CQSZACIVSA-N	435.440	1.543	50	20	IDGD	
Cc1csc(SCc2ccc(C(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)cc2)n1	17642323	UHYTURWYROXHHN-AWEZNQCLSA-N	425.557	1.940	50	20	IDGD	
COc1cccc(CCC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1	23424147	PONSPTGAXWHZDY-UHFFFAOYSA-N	431.514	1.874	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](NS(=O)(=O)c1ccc2c(c1)OCCCO2)C(C)C	24607600	UPHLSBOMKXORDM-SFHVURJKSA-N	427.523	1.344	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1cnn(-c2ccccc2F)c1C	36803180	CAYGRRFYQUKSBO-UHFFFAOYSA-N	444.492	1.996	50	20	IDGD	
Cc1nc(S(=O)(=O)NCCC(=O)NNC(=O)c2ccc(Cl)cc2Cl)cn1C	725879142	CAIWBRPFUQQUDK-UHFFFAOYSA-N	434.305	1.165	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])c(C)c1	726504419	WBYORXNGCSFUIU-GOSISDBHSA-N	440.456	1.907	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)N1CCC[C@H]1c1cccc2c1OCCO2	727479490	LQHJTZGMZUCCNP-AWEZNQCLSA-N	430.486	1.827	50	20	IDGD	
CN1CCN(C[C@@H](NC(=O)NNC(=O)c2nnc(O)c3ccccc23)c2ccccc2)CC1	727945776	MNRBTHAXDUJUPZ-LJQANCHMSA-N	449.515	1.268	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(OC)c(C(=O)NNc2nc(-c3ccncc3)no2)c1	728072621	VBRIVWRBYUGTIG-UHFFFAOYSA-N	446.489	1.928	50	20	IDGD	
COc1cc(C=NNC(=O)[C@@H](C)NS(C)(=O)=O)cc(Br)c1OC(F)F	728433711	DXYBHGDOXMJMNP-SSDOTTSWSA-N	444.254	1.447	50	20	IDGD	
CCOC(=O)C1=NN(c2ccccc2)[C@H](C(=O)OCC(=O)NNC(=O)c2ccccc2)C1	728633441	KQQRIGPWYUIYLO-SFHVURJKSA-N	438.440	1.189	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)N1CCN(CC(=O)Nc2ccccc2Cl)CC1	728958548	PYIWJZANIIYFOR-UHFFFAOYSA-N	430.896	1.275	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)N[C@@H](C)c2nnc3n2CCC3)c2ccccc2c1=O	730934246	GOGCGLDVGBTAHF-ZDUSSCGKSA-N	438.492	1.440	50	20	IDGD	
CC(C)(C(=O)NNC(=O)c1ccc(S(=O)(=O)NC[C@@H]2CCCO2)cc1)c1ccccc1	731201064	FSEAMVCPHPYJMJ-SFHVURJKSA-N	445.541	1.883	50	20	IDGD	
CC(C)(C(=O)NNC(=O)NCCCCN1CCN(c2ncccn2)CC1)c1ccccc1	731220445	HMBYLAQJIXPGNU-UHFFFAOYSA-N	439.564	1.687	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)N1CCN(CC(=O)N2CCCc3ccccc32)CC1	732204537	YINWOQVCZCGZRG-SFHVURJKSA-N	429.565	1.165	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NC[C@H]3CCc4ccccc43)nc2)CC1	732468834	LBQQQKSLUCNXMC-QGZVFWFLSA-N	444.561	1.374	50	20	IDGD	
O=C(CN1CCN([C@@H](CO)c2ccc(Cl)cc2)CC1)NNC(=O)c1ccc(F)cc1	732668326	YJIWNOOVNOZRKT-IBGZPJMESA-N	434.899	1.591	50	20	IDGD	
CCOCCCn1c(NNC(=O)c2csc(NC(C)=O)n2)nc2ccccc2c1=O	733266154	RREFBVMPWOPVRR-UHFFFAOYSA-N	430.490	1.995	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2cnn(C)c2)cc(S(=O)(=O)N2CCC(C)CC2)c1C	735445197	NCFIJERALHPGCO-UHFFFAOYSA-N	433.534	1.532	50	20	IDGD	
CCOc1cc(CCCNC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)ccc1OC	736369714	AWJGCUBKIJTJMH-UHFFFAOYSA-N	439.476	1.646	50	20	IDGD	
CN(Cc1ccc(S(C)(=O)=O)cc1)C(=O)NNC(=O)c1cc(Br)c[nH]1	740903989	YKIDSKISZBVHPX-UHFFFAOYSA-N	429.296	1.667	50	20	IDGD	
CC(C)[C@@H](C(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)N1C[C@@H](C)O[C@H](C)C1	741024995	BNYDSUWBCREBQP-LBTNJELSSA-N	436.465	1.033	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)COc1ccccc1O)[C@@H]1CN(Cc2ccccc2)CCO1	741276633	AFRVJVGASHNUCK-UZLBHIALSA-N	428.489	1.391	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)c2ccc(F)c(S(=O)(=O)Cc3ncon3)c2)cc1	742241203	FWDLXQCMAGACBS-UHFFFAOYSA-N	432.433	1.820	50	20	IDGD	
C[C@@]1(C2CC2)NC(=O)N(CC(=O)NNC(=O)NCc2cccc(C(F)(F)F)c2)C1=O	742459017	BTKOCUNBJCRHIS-KRWDZBQOSA-N	427.383	1.256	50	20	IDGD	
CC(C)(C)C(=O)Nc1nc(CC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cs1	742480710	NDQGBGLCBGXVIN-UHFFFAOYSA-N	428.478	1.107	50	20	IDGD	
O=C(NNc1ncnc2[nH]cnc12)C1CCN(S(=O)(=O)/C=C/c2ccccc2)CC1	743470585	GWFDPMFWXPTYBJ-DHZHZOJOSA-N	427.490	1.509	50	20	IDGD	
CCc1ccc(N2CCN(C(=O)NNC(=O)c3csc(N4CCOCC4)n3)CC2)cc1	743509515	FISJJRSVSHPOIL-UHFFFAOYSA-N	444.561	1.719	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)CN2CCN(Cc3nc(-c4ccccc4)no3)CC2)cc1	744386975	KHSUPGDYCTVLKV-UHFFFAOYSA-N	445.483	1.187	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CN2CCC(C(=O)Nc3ccc(Cl)cn3)CC2)c1	744389136	LCEAJLWFTORXLU-UHFFFAOYSA-N	440.891	1.718	50	20	IDGD	
O=C(NCCNS(=O)(=O)c1cccc([N+](=O)[O-])c1)NNc1cc(F)c(F)c(F)c1	746756127	HXRRVKKSIBCUTI-UHFFFAOYSA-N	433.368	1.617	50	20	IDGD	
C[C@@H](c1ccncc1)N1CCC(NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)CC1	747938330	OUNOYUBRWVHCKV-HNNXBMFYSA-N	435.492	1.227	50	20	IDGD	
COC(=O)c1ccccc1S(=O)(=O)N1CCC(C(=O)NNc2ccc(C#N)cc2)CC1	748113097	JCLGVAJSWAGDAI-UHFFFAOYSA-N	442.497	1.889	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)[C@@H]1CC(=O)N(c2cn[nH]c2)C1	748527232	KTBOJDBOHBTHCD-GHMZBOCLSA-N	436.266	1.140	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3ccc4nc(S)oc4c3)cc2)CC1	748619905	MWLHDCMXEVXWBM-UHFFFAOYSA-N	447.542	1.810	50	20	IDGD	
CC(C)[C@H](NC(=O)OCc1ccccc1)C(=O)NNC(=O)[C@H]1COc2ccccc2O1	750554567	XSICAVGWJJLJKB-MOPGFXCFSA-N	427.457	1.925	50	20	IDGD	
C#CCN1C(=O)C(=NNC(=O)CNC(=O)c2ccco2)c2cc(Br)ccc21	750936487	FGSHZOFDVUZYDG-UHFFFAOYSA-N	429.230	1.272	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)CCNC(=O)C2CCCCC2)cc1	751291724	XZWQFTPKNCZUGK-UHFFFAOYSA-N	444.561	1.955	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CNC(=O)[C@H]2c3ccccc3C(=O)N2Cc2ccccc2)o1	752779797	SIXZVVJGOMVVJG-OAQYLSRUSA-N	446.463	1.863	50	20	IDGD	
C[C@H](CCC(C)(C)C)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	753999120	PEGSDKWTXRFCFR-OAHLLOKOSA-N	425.551	1.931	50	20	IDGD	
COc1ccc(C2(C(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)CCC2)cc1OC	754844417	VDFVSZVRYDMZHK-UHFFFAOYSA-N	436.468	1.834	50	20	IDGD	
O=C(NNc1ccc(C(F)(F)F)nn1)c1cc(S(=O)(=O)N2CCSCC2)c[nH]1	755187924	XIDPDWPIAYCAOO-UHFFFAOYSA-N	436.441	1.318	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCCCC2)cc1NC(=O)NNC(=O)CC(F)(F)F	755409809	AIHIFIZJXWCZRH-UHFFFAOYSA-N	438.428	1.975	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)n(-c2cccc(C(F)(F)F)c2)n1	755595288	RYWFSDLXTGRRBZ-SNVBAGLBSA-N	448.427	1.290	50	20	IDGD	
CNC(=O)c1cccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1C	755657561	KLCLWSSASQYYOX-UHFFFAOYSA-N	433.490	1.071	50	20	IDGD	
Cn1cc(S(=O)(=O)N2CCOCC2)cc1C(=O)NNc1ccccc1C(F)(F)F	755945459	OZJHIVAVZGXYJX-UHFFFAOYSA-N	432.424	1.822	50	20	IDGD	
COCCOC(=O)Nc1cccc(NC(=O)NNC(=O)COc2ccccc2C#N)c1	756223008	WSMLWGLKJFCKCL-UHFFFAOYSA-N	427.417	1.985	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)Nc2cc(-n3cnnn3)ccc2F)cc1	756336582	WWGWFWKGXLMGNF-LBPRGKRZSA-N	429.412	1.820	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1NS(C)(=O)=O	756515874	HTAOJZTVMKZCPC-UHFFFAOYSA-N	447.521	1.226	50	20	IDGD	
CCOC(=O)C1CCN(C(=O)c2ccc(NC(=O)NNC(=O)c3cccnc3)cc2)CC1	756683758	VIXPQWBEQGUCLA-UHFFFAOYSA-N	439.472	1.963	50	20	IDGD	
O=C(NNC(=O)c1ccn(-c2ccc(Cl)cc2)n1)c1csc(N2CCOCC2)n1	756867516	NTWVSQUIXVSWHU-UHFFFAOYSA-N	432.893	1.894	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNS(=O)(=O)c2cc(C(=O)O)cc(F)c2F)cc1	756930003	QCAPVIQMNGRJHX-SNVBAGLBSA-N	444.412	1.839	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)Nc1cccc(S(=O)(=O)NCc2ccco2)c1	757867626	TZNDAOBOYLRPJD-UHFFFAOYSA-N	429.458	1.928	50	20	IDGD	
COC[C@H](NC(=O)NNC(=O)C(=O)Nc1ccccn1)c1cccc(C(F)(F)F)c1	758795983	GLSXXGFTRDNRCF-ZDUSSCGKSA-N	425.367	1.757	50	20	IDGD	
CO[C@](C)(C(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1)c1ccccc1F	760053686	OJEYFYAZUHKHCR-FQEVSTJZSA-N	437.493	1.464	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)C(=O)Nc1ccnn1Cc1ccc(F)cc1	760276922	FZLKMVBXGKVNFO-UHFFFAOYSA-N	425.420	1.495	50	20	IDGD	
CC1(C)C(=O)N(C[C@](C)(O)C(=O)NNC(=O)Cc2cn3ccccc3n2)c2ccccc21	760393954	ANEJOWAHSCEFDG-QHCPKHFHSA-N	435.484	1.100	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2cc(C)n(-c3cc(C)on3)c2C)n1	761949807	PDBLNRVVFREBHJ-UHFFFAOYSA-N	431.474	1.702	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H]1[C@@H]1COCCC1=NNC(=O)CNC(=O)c1ccco1	762422779	AOQVIQQAFCHXQL-GDBMZVCRSA-N	434.493	1.918	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)[C@H]2CCCN2S(=O)(=O)c2ccc(C)s2)n1	762913507	QSRDQNFEIBFOQY-CQSZACIVSA-N	438.579	1.989	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccccn2)c(OCC(F)(F)F)c1	763466109	DGATYBYXKIOMNF-UHFFFAOYSA-N	440.334	1.209	50	20	IDGD	
COC(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2Br)cc1	763484271	ZJARPOZFRKBJTN-UHFFFAOYSA-N	434.246	1.564	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cccnc2)n(-c2ccccc2C(F)(F)F)n1	763491820	PFKFNUCKIDOGAS-UHFFFAOYSA-N	432.362	1.994	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cccc(OCCF)c2)cc(OC)c1OC	763538602	DSVAGSPBSCIVJB-UHFFFAOYSA-N	435.408	1.460	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)cc1C	763540402	UPAIMXJSZBVFRX-UHFFFAOYSA-N	445.428	1.207	50	20	IDGD	
CC[C@@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1	763573010	PMTLCICWNZIWLF-FZKQIMNGSA-N	440.456	1.141	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(N3CCOC[C@H]3C)cc2)c1	763619320	SCEYFAUMPQWVEH-MRXNPFEDSA-N	426.473	1.385	50	20	IDGD	
COCCCOc1cccc(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)c1	763734620	MFJAWVDBCIWSGQ-UHFFFAOYSA-N	440.500	1.641	50	20	IDGD	
CCN(CC)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cccc(N(C)C)c2)cc1	763753085	FBQDKIXUHHMMEN-UHFFFAOYSA-N	425.489	1.634	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3cccc(N(C)C)c3)cn2)C[C@@H](C)O1	763760829	UKUNTJAGEYKULV-GASCZTMLSA-N	440.504	1.161	50	20	IDGD	
CCOc1cc(F)ccc1NC(=O)C(=O)NNC(=O)c1nn(CC)c(=O)c2ccccc12	763787325	XIHQEAADIVNRJR-UHFFFAOYSA-N	441.419	1.354	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)C(=O)Nc1ccccc1Br	763789757	AVGJAURMBCIISW-UHFFFAOYSA-N	430.218	1.498	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)c(Br)n1	763807846	HFTFMTCQYIRWPQ-UHFFFAOYSA-N	432.234	1.189	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(N3CCCN(C)CC3)cc2)cc1	763822420	ZXSVQVHLLTWXPJ-UHFFFAOYSA-N	439.516	1.302	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccccc1C(=O)N1CCCC1	763873913	XYSLTBQQVWSIRI-CQSZACIVSA-N	442.447	1.615	50	20	IDGD	
CNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2c(C)cc(Cl)cc2C)cc1	763883943	SMOSTQREVJZQPH-ZDUSSCGKSA-N	446.891	1.870	50	20	IDGD	
C[C@@H]1COCCN1c1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)on2)cc1	764003163	AOQLOXKJTGEGNM-OAHLLOKOSA-N	449.467	1.966	50	20	IDGD	
Cc1ccc(C(=O)N2C[C@H](C)C[C@@H](C)C2)cc1NC(=O)C(=O)NNC(=O)c1cnccn1	764023693	CWTKCAYTYFFPKN-ZIAGYGMSSA-N	438.488	1.303	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)N3CCCC[C@H]3C)cc2C)n[nH]1	764106366	LIIATTYIBOCBAZ-CQSZACIVSA-N	426.477	1.441	50	20	IDGD	
COc1cc(OC)c(OC)cc1NC(=O)C(=O)NNC(=O)Cn1ccc2ccccc21	764239304	KVHVSJWKPOFKEP-UHFFFAOYSA-N	426.429	1.453	50	20	IDGD	
COC(=O)c1c(NC(=O)C(=O)NNC(=O)c2scnc2C)sc2c1CCCCC2	764246295	MPJXUSUUANJVSG-UHFFFAOYSA-N	436.515	1.968	50	20	IDGD	
CCn1nnnc1-c1cccc(NC(=O)C(=O)NNC(=O)c2cccc(OC(F)F)c2)c1	764251666	XAAIFLIWQCLSCR-UHFFFAOYSA-N	445.386	1.361	50	20	IDGD	
CCCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccccc2F)cc1	764318131	AYQHOBHDLSQUFV-UHFFFAOYSA-N	436.465	1.306	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2cccs2)[nH]n1)C(=O)Nc1ccc(NC(=O)C2CC2)cc1	764377976	UMDFUBHUYZEYKX-UHFFFAOYSA-N	438.469	1.886	50	20	IDGD	
O=C(NNC(=O)C(F)(F)Oc1ccccc1)C(=O)Nc1ccc(NC(=O)C2CC2)nc1	764379411	DZMQICRUHACSKJ-UHFFFAOYSA-N	433.371	1.188	50	20	IDGD	
CN1C(=O)CCc2cc(NC(=O)C(=O)NNC(=O)CSc3ccccc3O)ccc21	764395078	ZJZFKGDURPHHSY-UHFFFAOYSA-N	428.470	1.179	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1	765319561	GGIAGLBGQGCQEK-UHFFFAOYSA-N	432.437	1.846	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CC(F)F)C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	765622736	CSGMSJCALZXIPZ-LBPRGKRZSA-N	435.449	1.400	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)Cc3cn(C)c4ccccc34)CC2)cc1	766641722	LFERODBYUQUXDQ-UHFFFAOYSA-N	433.556	1.994	50	20	IDGD	
COc1ccccc1C(C)(C)C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	766651163	KUYNYRQZTQRBDN-UHFFFAOYSA-N	438.528	1.578	50	20	IDGD	
C=CCOc1cc(OC)ccc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	766949497	GADZWBPVVVOULN-UHFFFAOYSA-N	433.486	1.585	50	20	IDGD	
O=C(NNC(=O)c1c[nH]c2ccc(Br)cc2c1=O)C(=O)Nc1ccccn1	768029790	CWNHTLUQUVHHPI-UHFFFAOYSA-N	430.218	1.085	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)c2ncn(-c3ccccc3)n2)cc1	768301327	IAWRAQQZJSVCLZ-UHFFFAOYSA-N	434.485	1.763	50	20	IDGD	
Cc1cccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)c1Br	769266162	MGWXEQBOIVLXAE-UHFFFAOYSA-N	434.246	1.928	50	20	IDGD	
Nc1ccc(C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c(C(F)(F)F)c1	770058006	PLBBMQXVZQLKLF-UHFFFAOYSA-N	426.307	1.814	50	20	IDGD	
CS(=O)(=O)c1cc(S(=O)(=O)NNC(=O)COCc2ccccc2)c(Cl)s1	770636328	SAEXKHPIYHSPBQ-UHFFFAOYSA-N	438.936	1.331	50	20	IDGD	
NC(=O)COc1ccc(NC(=O)C(=O)NNc2ccc(Br)c(F)c2)cc1	770815495	HPDLVMPIBCRBKA-UHFFFAOYSA-N	425.214	1.534	50	20	IDGD	
COC[C@@H](C)NC(=O)Cc1noc(CCC(=O)C(C#N)=C2N(C)c3ccccc3N2C)n1	771058435	LHPMBYGNZUJJJU-CQSZACIVSA-N	438.488	1.586	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1cccc(S(=O)(=O)N(C)C2CCCCC2)c1	771905270	SQDVNBRISSVRAT-CQSZACIVSA-N	439.534	1.743	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H]2CCO[C@@H](C(C)C)C2)c1	772607648	OTZOPIQFDHBINI-SJLPKXTDSA-N	440.566	1.865	50	20	IDGD	
CCC(=O)c1cccc(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1	772862311	XGRBUHKINHLCOF-UHFFFAOYSA-N	439.515	1.153	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNS(=O)(=O)c1ccc(C(=O)OC)c(F)c1	773249815	PTRJRDNVQBSLNO-UHFFFAOYSA-N	426.422	1.400	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2cc(C)c(Br)cn2)c1	773523762	HHLCGMUUZYYPNI-UHFFFAOYSA-N	437.250	1.569	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1cnn(CC(F)(F)F)c1	774001597	IPXQTYFFAXDEGO-VIFPVBQESA-N	433.774	1.652	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2cn(C)nc2-c2cnn(CC)c2)c2ccccc2c1=O	777414584	YKCICEGMMJYTRC-UHFFFAOYSA-N	448.487	1.498	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)/C=C/C(=O)Nc1ccc2n[nH]cc2c1	778949182	BDGWPPRWFZHTTI-CMDGGOBGSA-N	430.465	1.510	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@@H](C(=O)NNC(=O)c2cccc3ccccc23)[C@@H](C)O)cc1	779519953	NIGLIVMJHZELIH-FOIQADDNSA-N	441.509	1.637	50	20	IDGD	
CC(=O)N1CCN(c2cccc(NC(=O)NNC(=O)c3ccc4c(c3)OCCO4)c2)CC1	782081821	MFOLKTIYHABQQM-UHFFFAOYSA-N	439.472	1.593	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(CNC(=O)NNc2cccc(S(C)(=O)=O)c2)c1	782767772	KQBFFVOTMCKVTN-UHFFFAOYSA-N	426.520	1.167	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2csc(N3CCOCC3)n2)ccc1OC(C)C	782898004	VSXYNFXVXDXPRF-UHFFFAOYSA-N	447.517	1.475	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2ccc(Br)cc2F)n(-c2ncccn2)n1	783080019	GJUWQHDBNOPQGK-UHFFFAOYSA-N	434.229	1.954	50	20	IDGD	
CS(=O)(=O)c1c(F)cc(NC(=O)C(=O)NNc2ncccc2C(F)(F)F)cc1F	783121725	VINAIWUQXLTYCU-UHFFFAOYSA-N	438.334	1.864	50	20	IDGD	
CCNS(=O)(=O)c1ccc2c(c1)N(C(=O)C(=O)NNc1ncnc3ccsc13)CC2	783255851	YYPVODMHDIYTGN-UHFFFAOYSA-N	446.514	1.022	50	20	IDGD	
Cc1cc(N2CCSCC2)ccc1NC(=O)C(=O)NNc1ccc(-n2cccn2)nn1	783437143	TWEYLLWDFQEJEB-UHFFFAOYSA-N	438.517	1.606	50	20	IDGD	
CN1C(=O)c2ccc(NC(=O)C(=O)NNc3nc(-c4ccc(Cl)cc4)no3)cc2C1=O	784795303	PPIAPRPHUYPAGH-UHFFFAOYSA-N	440.803	1.698	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ncccc2Cl)cc1OCC(=O)NC1CC1	784818226	VQNYRXQKXFGVDT-UHFFFAOYSA-N	433.852	1.483	50	20	IDGD	
C[C@@H]1CCCN(S(=O)(=O)c2ccc(NC(=O)C(=O)NNc3ccnc(F)c3)cc2)C1	784849523	XMFDLFUTXATOBJ-CYBMUJFWSA-N	435.481	1.723	50	20	IDGD	
O=C(NNc1cc(Cl)ccn1)C(=O)N1C[C@@H](C(=O)N2CCCCC2)Oc2ccccc21	784856051	DLAAGFJNNDMJCB-KRWDZBQOSA-N	443.891	1.985	50	20	IDGD	
COCCOc1c(Cl)cc(NC(=O)C(=O)NNc2ccnc(N(C)C)n2)cc1Cl	784970999	PGHDPOJIRZKCOT-UHFFFAOYSA-N	443.291	1.956	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)N[C@H]1CCN(c2cccc(Br)c2)C1	787369613	LHKNUFFNMGKXRM-OCCSQVGLSA-N	429.315	1.410	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C)c(C(=O)N3CCOCC3)c2)cc1F	787560969	XXMYLONMGHMXBO-UHFFFAOYSA-N	442.447	1.315	50	20	IDGD	
CCC1CCC2(CC1)NC(=O)N(CC(=O)NNC(=O)c1cc(-c3ccccc3)on1)C2=O	789899714	NWMBLGBRLWWHGH-UHFFFAOYSA-N	439.472	1.993	50	20	IDGD	
CN1C(=O)C[C@H](C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)[C@H]1c1ccc(Cl)c(Cl)c1	790218967	YJENGPQCCNCTKL-ZIBATOQPSA-N	448.328	1.095	50	20	IDGD	
Cc1ccn(C[C@@](C)(O)C(=O)NNC(=O)c2ccc(F)cc2Br)c(=O)c1	790559490	KPRBKXXQRMFYAN-QGZVFWFLSA-N	426.242	1.271	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N2C[C@H](O)C(C)(C)C2)cc1	791161866	PFUCCYPHCOYRCW-XLCPLWEUSA-N	437.500	1.570	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cc(OC)cc(OC)c2)c(F)cc1C	793021640	HTGPYLAJIDFBCM-UHFFFAOYSA-N	447.419	1.728	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNS(=O)(=O)CC2(C(=O)OC)CCCCC2)cc1	793351522	YQBNBGOUZRNVAK-HNNXBMFYSA-N	442.534	1.927	50	20	IDGD	
Cc1nn(C(C)C)c(C)c1CC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	794196570	QVGIGGGQSQWDDV-UHFFFAOYSA-N	447.561	1.869	50	20	IDGD	
COC(=O)c1cc(F)cc(NC(=O)C(=O)NNC(=O)c2c(C)nc3ccccn23)c1F	796991205	AJZRIPSSNHDRNO-UHFFFAOYSA-N	431.355	1.107	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1F)C(=O)Nc1ccc(F)c(N2CCOC2=O)c1	797009694	BNAUVCRVZIALMU-UHFFFAOYSA-N	438.774	1.975	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNC(=O)Nc1ccccc1CN1CCNC1=O	797640113	IFXFGOHHQPIFRB-UHFFFAOYSA-N	440.460	1.291	50	20	IDGD	
CSc1ccc(CCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1	798118236	KIAVWOYFCCLERK-UHFFFAOYSA-N	436.559	1.846	50	20	IDGD	
O=C(CN1C(=O)c2ccc(Cl)cc2S1(=O)=O)NNC(=O)c1ccc(Cl)cc1	800840427	LAMMPJRFHIFGGA-UHFFFAOYSA-N	428.253	1.599	50	20	IDGD	
C[C@@H](Sc1ccccc1C(=O)OCC(=O)NNC(=O)c1ccc(Cl)cc1)C(N)=O	801486249	HUZVFMDTGNPXCB-LLVKDONJSA-N	435.889	1.924	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](OCC(=O)NNC(=O)Nc2ccc3c(c2)OCO3)C1	802104950	MZPMWOFFZPAMLP-AWEZNQCLSA-N	436.465	1.984	50	20	IDGD	
C#CCNS(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2cc(OC)ccc2Cl)c1	802114730	DGXFCUCEYLXNQV-UHFFFAOYSA-N	436.877	1.727	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)Nc2ccc(S(=O)(=O)[C@H](C)C#N)cc2)cc1	806461560	SQPBPNLWCGTMHO-CYBMUJFWSA-N	432.458	1.613	50	20	IDGD	
Cc1ccc(-c2csc(NC(=O)C(=O)NNC(=O)CNC(=O)c3ccco3)n2)s1	807004608	QCHKSEMIDKSMPT-UHFFFAOYSA-N	433.471	1.289	50	20	IDGD	
O=C(NCc1ccccc1CN1CCOCC1)NNC(=O)[C@@H]1COc2ccccc2O1	807025864	DRMMMHWRLUWCLN-FQEVSTJZSA-N	426.473	1.189	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)C1(S(=O)(=O)c2ccc(F)cc2)CCCCC1	808611909	KWBKTDHASJXXCK-ZDUSSCGKSA-N	428.482	1.791	50	20	IDGD	
C#CC[C@]1(C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)CCCN1C(=O)OC(C)(C)C	809605469	JTLLNMHCSGNMLI-OAQYLSRUSA-N	449.529	1.644	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)C(=O)Nc1cccc2c1OCC(=O)N2	810386406	XSPBOTBSAUAICJ-ZDUSSCGKSA-N	448.435	1.724	50	20	IDGD	
COC(=O)c1cn(CC(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)c2ccccc12	812731719	RMIAZQCBMWTDCP-UHFFFAOYSA-N	430.486	1.822	50	20	IDGD	
CC(C)C[C@H](C)n1nccc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	813033394	RDBCYJZJQFKYES-AWEZNQCLSA-N	436.538	1.822	50	20	IDGD	
CCOC(=O)Nc1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)cc1	813033973	TXGNQNMIZQRHIQ-UHFFFAOYSA-N	449.489	1.587	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)C2CCC(OC[C@@H]3CCCO3)CC2)c1	815346118	ZQEKGWCFNWOKBF-KVZIAJEVSA-N	429.473	1.617	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1ccc(N)c(OC(F)(F)F)c1	857431048	APDYPAKLSYQCBT-UHFFFAOYSA-N	445.423	1.844	50	20	IDGD	
C[C@H]1CC(C)(C)C[C@]2(C1)NC(=O)N(CC(=O)NNC(=O)COc1ccc(C#N)cc1)C2=O	864017025	JZLVHKYRKCZKAA-FPTDNZKUSA-N	441.488	1.221	50	20	IDGD	
Cn1cc(/C=C\C(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)cn1	877204351	ANDIPULIZKOPTA-XFXZXTDPSA-N	428.456	1.596	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCCN2CCc3ccccc3C2)cc(OC)c1OC	913465381	UYWFXOAKWGSHTH-UHFFFAOYSA-N	428.489	1.715	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)[C@@H]1CCCN1C(=O)c1ccc(Cl)c(Cl)c1	914719811	RUWNUORWFTVRAB-FZMZJTMJSA-N	448.328	1.180	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)[C@@H]2CCCCN2S(=O)(=O)c2cccs2)c1	915695489	JLZXQVKPJJUHDF-INIZCTEOSA-N	437.543	1.826	50	20	IDGD	
CN1CCC(NC(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)CC1	915898708	VDMYSKLKKJMUAQ-UHFFFAOYSA-N	434.504	1.427	50	20	IDGD	
O=C(NCCc1cccnc1)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	916262622	KZYLOYMTVUMNMM-UHFFFAOYSA-N	431.518	1.443	50	20	IDGD	
Cc1nn([C@H]2CCS(=O)(=O)C2)c(Cl)c1C=NNC(=O)COc1ccc(C#N)cc1	916300047	JXOSKUOGFSIDFW-AWEZNQCLSA-N	435.893	1.605	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc(Br)ccc1[N+](=O)[O-])c1ccc([N+](=O)[O-])cc1	917713409	IMADIARDBWINDD-UHFFFAOYSA-N	445.207	1.889	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)NCc2ccc(CS(C)(=O)=O)cc2)nc2ccccc21	918101865	KLWDISMYGVHWHZ-UHFFFAOYSA-N	429.502	1.191	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)c1cc(F)ccc1NS(C)(=O)=O	920422196	GTPUEGNIZPXICW-UHFFFAOYSA-N	433.465	1.571	50	20	IDGD	
CC(=O)c1cccc(S(=O)(=O)NCC(=O)NNc2cncc(Br)c2)c1	1117641308	RUGOEKKYUZJMFJ-UHFFFAOYSA-N	427.280	1.468	50	20	IDGD	
O=C(C(Cl)Cl)N1CCO[C@@]2(CCN(C(=O)[C@@H]3ON=C(c4ccccc4)O3)C2)C1	1778874398	JTCVQWQNBREASD-ZWKOTPCHSA-N	428.272	1.355	50	20	IDGD	
C[C@@H](NNc1ccccc1)C(=O)N1CCO[C@@]2(CCN(C(=O)CO[Si](C)(C)C)C2)C1	1779294726	LZJIXHRUWDADGB-DYESRHJHSA-N	434.613	1.673	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C1CCCC1)C2	1779371251	XHQPTHDCDHOHFM-XMSQKQJNSA-N	429.521	1.003	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2[nH]cc3c2CCC3)C1	1780009502	VADOMEBUTVZELY-WZONZLPQSA-N	445.564	1.004	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)Cc3ccc(C(=O)OC)s3)C2)C1	1780900277	OIKHCZTXXWDSNB-IFXJQAMLSA-N	428.938	1.925	50	20	IDGD	
O=C(c1nc2ccccc2o1)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781331963	BRYAQQJYLUGJCW-CXAGYDPISA-N	426.242	1.962	50	20	IDGD	
Cc1cccn2ncc(C(=O)N3CCO[C@@]4(CCN(C(=O)[C@H](F)Br)C4)C3)c12	1781332283	FUUPLRXHNYZBLI-MAUKXSAKSA-N	439.285	1.777	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(C)(C)NCCC#N)C2	1781998013	MIZVCZTUFGURCA-SPYBWZPUSA-N	443.386	1.566	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)Cc3nnc(C)s3)CCO2)C1	1783342032	IDHNKTKKWGVYBC-MLGOLLRUSA-N	431.356	1.392	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(N(C)C)cn3)CCO2)C1	1783343513	JNJFAVFOGKHXGY-BEFAXECRSA-N	439.354	1.765	50	20	IDGD	
CC(C)N1CCC(C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](C)Br)C3)C2)CC1	1783530140	SLWWXLIAIYQYTG-KXBFYZLASA-N	430.387	1.720	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(OC)cc(OC)c3F)CCO2)C1	1783881030	INKNBAGVFHRDAD-YWZLYKJASA-N	444.887	1.540	50	20	IDGD	
C#CCCCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2	1783903384	ROLFWZGMACQRTE-HRAATJIYSA-N	441.956	1.752	50	20	IDGD	
CC(C)c1csc(C(=O)N2CCO[C@@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)n1	1783936641	QRRQNWNBQALKSJ-HXUWFJFHSA-N	437.566	1.083	50	20	IDGD	
Cc1onc(-c2ccncn2)c1C(=O)N1CCO[C@@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783948494	PHONEKJHNGCLPU-GOSISDBHSA-N	440.287	1.687	50	20	IDGD	
C[C@@H](Cn1cccn1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]2C1	1783969090	INCMQBUZSLXDFR-WOYTXXSLSA-N	441.370	1.530	50	20	IDGD	
CCc1nn(C)c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](Cl)COC)C[C@@H]32)c1Cl	1785707792	TUNPOIFNDUXMOR-ABHRYQDASA-N	447.363	1.483	50	20	IDGD	
O=C(CN1CCS(=O)(=O)CC1)Nc1ccc(C2(NC(=O)[C@@H](F)Cl)CCC2)cc1	1786688746	DJTOBQJPRIIYPY-MRXNPFEDSA-N	431.917	1.385	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ncn(C(C)C)n3)[C@H]2C1	1787672012	VQSYLJUIGQWAGX-AJNGGQMLSA-N	442.358	1.626	50	20	IDGD	
CC(=O)O[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)C(C)C	1788479460	FMFYQLJNZCIIDY-LXFSFDBISA-N	437.306	1.244	50	20	IDGD	
C/C=C/C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C[C@@H]21	1790796632	SPUUYKJSEMCYDV-GLGJLECESA-N	429.945	1.674	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3nnc(C)o3)C[C@@H]21	1790961426	KAMXRWATYVDRAK-XUXIUFHCSA-N	429.315	1.074	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1ccc(C2(NC(=O)CCN3CCOCC3)CCC2)cc1	1791600243	VKCHDCMIHWYVDA-UHFFFAOYSA-N	445.564	1.216	50	20	IDGD	
COC(=O)[C@@H]1CC[C@@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)CBr)C1	1792868555	FFKSYDZZDGFYFQ-FBRBKTQXSA-N	445.354	1.196	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COc1ccccc1F)C2	1792871983	GZGWUZPGEHAHKH-ZUMXRPEOSA-N	443.313	1.825	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1CC(=O)N(Cc2cccs2)C1)[C@H](O)CCl	1794239447	GXPUQWDRVXUYQK-KSXIZUIISA-N	439.965	1.335	50	20	IDGD	
Cc1nc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)CBr)C3)ccc1F	1794353430	WCANMLCNPXFYGT-YGSHXTJESA-N	428.302	1.763	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1CNc2ccccc21	1796066784	FFSKBHYUCYAKNL-FZAPOCCLSA-N	448.527	1.968	50	20	IDGD	
Cc1cc(Cl)ccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1	1796189636	JYLLTLSYPPPDEB-REPLKXPHSA-N	426.709	1.894	50	20	IDGD	
COc1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)ccn1	1796891923	OWKUBJPDFHPHFT-FWKYCFCSSA-N	438.488	1.476	50	20	IDGD	
COc1cscc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnccc1C(=O)NN	1798440432	PVDBCWKMEUGZHC-CLLJXQQHSA-N	429.502	1.321	50	20	IDGD	
COc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)Br)C3)c(O)c1	1798835607	PIEFXEHJNNWGDW-LSSIXWDNSA-N	427.295	1.387	50	20	IDGD	
C[C@H](NC(=O)c1ccc(F)cc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2	1799050909	GUOPJCYJVCHRFU-APDPGRRMSA-N	429.851	1.068	50	20	IDGD	
COC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O	1799217800	HTXRYHXTCBQAMY-QDMKHBRRSA-N	447.444	1.725	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](CC)NC(=O)OC(C)(C)C)C2	1799271345	NIRVXBIUXYZAED-NPJQDHAYSA-N	431.961	1.897	50	20	IDGD	
COc1nccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@](C)(Cl)CCl)c1F	1799274630	BADKNXJJDUOMTI-WZTYKQCMSA-N	434.295	1.669	50	20	IDGD	
CC[C@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](O)CCNC(=O)OC(C)(C)C)C2	1800074900	IQEZZMCPFBLYHU-QRJUGERDSA-N	431.961	1.918	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnn2cccc(F)c12	1800122554	QFUNYSXIWPYPTH-ZSBFGKGUSA-N	434.544	1.528	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ncc[nH]1)C2	1800332278	AJFHVIRLHMSWDB-INHOUBOVSA-N	427.411	1.498	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccccc1-n1nccn1)C2	1800759721	DRQUGCNRMQSKLU-VWPFQQQWSA-N	448.321	1.254	50	20	IDGD	
Nc1c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C(Cl)Cl)sc2nccnc12	1801016141	UGPHVXYCHNNPMW-DIYOJNKTSA-N	430.317	1.280	50	20	IDGD	
C[C@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](C)[C@H]1SC(=N)NC1=O)C2	1801961196	FXXQDFUZTWMCCM-ZNSALQAWSA-N	431.356	1.210	50	20	IDGD	
C[C@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1nc(O)n3c1CCCC3)C2	1801962927	DEBONGSJZADUIM-RVMXOQNASA-N	425.327	1.960	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnc3ccc(F)cn13)C2	1802338069	JZYKGJRRYVIWFZ-MUJYYYPQSA-N	430.484	1.098	50	20	IDGD	
COC[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C(Cl)Cl	1802340846	NAIPDMYIMKBNTR-YVECIDJPSA-N	438.352	1.968	50	20	IDGD	
CC[C@H](NC(C)=O)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)Br)[C@@H]1c1cccnc1	1802548842	UNELEOQSWABRPI-ISWURRPUSA-N	439.354	1.786	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2c[nH]c3nccc-3c2)[C@@H]1c1cccnc1)[C@H](O)CCl	1803138418	AGWKWRCLYOJCDX-CGTJXYLNSA-N	427.892	1.829	50	20	IDGD	
COc1cc(C(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)ccc1O	1803142365	YZAZRDCFRRYSPZ-AYBZRNKSSA-N	433.892	1.715	50	20	IDGD	
CCC(=O)N[C@H](C)C(=O)NC[C@H]1CCN(C(=O)CO[Si](C)(C)C)[C@H]1c1cccnc1	1803435970	TYNSIYFDGCFSAE-MDYRTPRTSA-N	434.613	1.854	50	20	IDGD	
C/C(=C/C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)C(=O)O	1804167684	ZSGKMXWIBJITFD-SMOBVYMQSA-N	443.928	1.788	50	20	IDGD	
O=C(CCBr)NC[C@H]1CCN(C(=O)c2ccc(O)nn2)[C@H]1c1cccnc1	1806339191	JPUDPUBNHLKORC-DYVFJYSZSA-N	434.294	1.682	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@H](CNC(=O)CCN2CCOCC2)[C@H]1c1cccnc1	1806951898	ISRJOEOCCAJQBK-SIKLNZKXSA-N	448.640	1.661	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)[C@@H](C)N2CCN(C)CC2)[C@H]1c1cccnc1	1807928338	BSBCQNVUVLHRGH-BTHPGYMESA-N	436.000	1.741	50	20	IDGD	
CC(=O)NC(C)(C)C(=O)N1CC[C@H](CNC(=O)[C@H](F)Br)[C@@H]1c1cccnc1	1808649053	IZSOEYAFKGOYNZ-ILXRZTDVSA-N	443.317	1.693	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CN2CCOCC2)[C@@H]1c1cccnc1)[C@@H](F)Br	1808661217	HAYNBYLXKCUMTG-USXIJHARSA-N	443.317	1.110	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)[C@@H]3CNc4ccccc43)CC2)C1	1809976543	CEAZPAMPUHLXFK-OAQYLSRUSA-N	447.344	1.421	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2n[nH]cc2[N+](=O)[O-])[C@H]1c1cccnc1	1810638391	MCEGVFNBRAUOFQ-HEHGZKQESA-N	436.856	1.286	50	20	IDGD	
CCc1oncc1C(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1813071707	UHRVBEFGTCBCPY-HRAATJIYSA-N	442.520	1.325	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)C2=COCCC2)[C@H]1c1cccnc1	1813073369	IUZGUWDACDDYPE-UTKZUKDTSA-N	429.521	1.155	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)[C@]2(C)CC2(F)F)[C@H]1c1cccnc1	1813075194	ZYRRFMPBTUGSDW-QSFXBCCZSA-N	437.491	1.506	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)CCN2C(=O)C=CC2=O)[C@@H]1c1cccnc1)C(Cl)Cl	1813075281	AESXGVPHMUPHJO-CXAGYDPISA-N	439.299	1.206	50	20	IDGD	
N[C@H](C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](F)Br)CC2)c1ccccn1	1815018457	DTKXYEMKICTJQI-JCOFBHIZSA-N	442.314	1.841	50	20	IDGD	
CO[C@@H](C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)n[nH]1	1818113124	CJSFKHANECDKTI-IZYKNMJJSA-N	429.481	1.571	50	20	IDGD	
CO/C=C(\C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1819277758	BZPIKDLLSZQTIN-LPQFERQCSA-N	427.465	1.264	50	20	IDGD	
Cn1cccc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819402110	NJIMVCFEUQJDAG-MRXNPFEDSA-N	436.476	1.366	50	20	IDGD	
Cc1cc(C(=O)NCC(=O)Nc2nc3c(s2)C[C@@H](NC(=O)C(Cl)Cl)CC3)no1	1819933025	IORIGPXWSGYOQY-QMMMGPOBSA-N	446.316	1.585	50	20	IDGD	
CC(C)(C)c1cc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@H](O)CCl)CC3)[nH]n1	1820554771	ZILKOAOKXSUDQT-JOYOIKCWSA-N	425.942	1.989	50	20	IDGD	
C[C@@H](C(=O)Nc1cc([C@H]2CCCCN2C(=O)C(Cl)Cl)[nH]n1)N1CCN(C)CC1	1820790150	XUGHJEZTTLCWOD-GXTWGEPZSA-N	431.368	1.841	50	20	IDGD	
C=C(C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)C(F)(F)F	1821991743	CTYBIPFJKPFNMH-HNNXBMFYSA-N	436.199	1.514	50	20	IDGD	
CC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CNC(=O)c1cccnc1)CC2	1822841947	YLQRQHVNRHXNAT-CHWSQXEVSA-N	435.937	1.898	50	20	IDGD	
COC(C)(C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1	1823828787	GMSDWHQURPNCKQ-SFHVURJKSA-N	431.537	1.343	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H](C)n2cnnn2)CC1	1824096302	OKHVHDQSDQTAJL-IIAWOOMASA-N	441.374	1.885	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CSCC(=O)O)CC2	1825647015	HRFIARWETHAOTA-HTQZYQBOSA-N	436.353	1.656	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)COC(=O)C(F)(F)F)CC2	1826000128	LWEKCLMJYRMBEG-SFYZADRCSA-N	443.831	1.414	50	20	IDGD	
Cc1nc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)co1	1827050956	HTZUTHJYXIGVMM-FQEVSTJZSA-N	425.294	1.210	50	20	IDGD	
C[C@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H](F)Cl)CC1)[C@H]1SC(=N)NC1=O	1827614249	YXXDYRGSOAANKR-DEQVHRJGSA-N	432.949	1.943	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)CC[C@H](N)C(N)=O)CC1	1829102281	NBOXJEZHXNQFGN-DLBZAZTESA-N	426.634	1.050	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccnc3S)CCO2)C1	1829791715	IYZNSQCCZMDTKN-KXBFYZLASA-N	427.954	1.848	50	20	IDGD	
O=C([C@H](O)CCl)N1CCC([C@@H]2CCCCN2C(=O)[C@H]2CC[C@@H]3CCC(=O)N3C2)CC1	1830208815	FTUUBURWZRMXSA-ZSYWTGECSA-N	439.984	1.607	50	20	IDGD	
C[C@@H](Oc1cccnc1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830369845	CGJHCPOYNIKYSV-IERDGZPVSA-N	439.940	1.570	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc4[nH]ncc4c3)C2)C1	1831651546	RAPVNPOVNDKJPB-UZLBHIALSA-N	435.912	1.435	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccn4ccnc4c3)C2)C1	1831652320	YSWCUCVIRODRIP-LAUBAEHRSA-N	434.924	1.812	50	20	IDGD	
O=C([C@H](F)Br)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)c1ccccc1)CCO2	1832224592	AKDRNMHIWZDZJJ-RVKKMQEKSA-N	447.276	1.844	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)CSc3ccncc3)CCO2)C1	1832701206	INXYCWJVRRJABC-FQEVSTJZSA-N	441.981	1.895	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3ccc(F)c(F)c3)CC2)CC1)[C@H](O)CCl	1833313922	TYOOWXRYQLMNCN-GOSISDBHSA-N	429.895	1.750	50	20	IDGD	
CC(=O)C[C@H](C)C(=O)N1CCC(N2CCC(NC(=O)CCBr)CC2)CC1	1834423669	UAMWVLLMMLYXFM-AWEZNQCLSA-N	430.387	1.958	50	20	IDGD	
CC1=C(C(=O)NC2CCN(C3CCN(C(=O)[C@H](F)Br)CC3)CC2)CCO1	1834918337	CFVZKQSTZZUEDN-INIZCTEOSA-N	432.334	1.943	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@H](C)Nc3cnccn3)CC2)CC1	1835748210	TWFWJYNUPFMRCK-YJBOKZPZSA-N	436.988	1.866	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H](CN)c3ccccc3)CCO2)C1	1835813474	QLPPIEUAMLIUOS-AVRDEDQJSA-N	437.968	1.450	50	20	IDGD	
CC(C)n1ccc(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)n1	1836182828	WWDHKZWWHNKGMR-SFHVURJKSA-N	425.961	1.249	50	20	IDGD	
CCNC(=O)N[C@@H](C)C(=O)N1CCC(OC2CCN(C(=O)C(C)(C)CCl)CC2)CC1	1836623770	PKQPXIHZGQILQO-HNNXBMFYSA-N	445.004	1.958	50	20	IDGD	
O=C(CCBr)N1CCC(OC2CCN(C(=O)[C@@H]3[C@H]4COC[C@H]43)CC2)CC1	1837654816	YQJMXDMOPFRVSF-VQFNDLOPSA-N	429.355	1.662	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)s1	1837712426	QCSHRQNBMOZHQC-IBGZPJMESA-N	426.611	1.978	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3nc4ccccc4o3)C2)C1	1837715754	IHOKDIJRXLZVKV-OAQYLSRUSA-N	447.564	1.749	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](C)Cn3cncn3)CC2)CC1	1838421043	MLEUVKRZMNMGPR-YJBOKZPZSA-N	425.961	1.930	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)[C@@H]3CNC(=O)C3)CC2)CC1	1838754002	FJOGCGDCHLZQJP-BBRMVZONSA-N	444.370	1.295	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccccc3F)CCO2)C1	1838853554	VNIIYSGBKFQQCZ-AUUYWEPGSA-N	443.313	1.927	50	20	IDGD	
CCc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)n(C)n1	1839153089	AJBKZSBJTLTVRO-RBUKOAKNSA-N	447.363	1.289	50	20	IDGD	
O=C(c1ccc(F)cc1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839201536	AKDRLSVBBOEAJE-WMLDXEAASA-N	433.249	1.586	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(F)n3)C2)C1	1840033404	CIOWZFRTYODOIT-SJCJKPOMSA-N	430.274	1.074	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3ccsc3)C2)C1	1840151418	AVSKNOSYXLBVQR-LPHOPBHVSA-N	430.954	1.391	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(Cl)cn3)C2)C1	1840153366	MADFOCODTWQJFF-KDOFPFPSSA-N	432.304	1.059	50	20	IDGD	
Cc1cccnc1CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840186904	WZOWHAOLBGACFS-IBGZPJMESA-N	430.332	1.583	50	20	IDGD	
O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)CC[C@H]1CCOC1)CCO2	1840587824	IHCIWXILONLJAR-YJBOKZPZSA-N	433.343	1.045	50	20	IDGD	
COc1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)c1F	1840794507	JPXUUMHXFIJVDG-SFHVURJKSA-N	435.279	1.708	50	20	IDGD	
C=CCO[C@H](C)C(=O)N1CC2(CCCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C1	1841924053	QISXVLWZPNBCFF-CABCVRRESA-N	429.945	1.913	50	20	IDGD	
C[C@@H](C(=O)N1CC2(CCCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C1)n1cccn1	1841925371	OWFQLJRBPULEHC-GJZGRUSLSA-N	439.944	1.780	50	20	IDGD	
Cc1cc(C(=O)N2CCCC23CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C3)nn1C	1842428051	QNDAZNYXPYGQGG-HNNXBMFYSA-N	439.944	1.678	50	20	IDGD	
N=C(N)NCC(=O)N1CCCC12CN(C(=O)CCCCCCCCBr)C2	1842885243	PYSITVLYNOMHKE-UHFFFAOYSA-N	430.391	1.798	50	20	IDGD	
Cn1c(=O)n(C)c2cc(C(=O)N3CCCC34CN(C(=O)[C@@H](F)Br)C4)ccc21	1843734488	JZZNPTMYBBLEHG-CQSZACIVSA-N	439.285	1.385	50	20	IDGD	
Cn1c(=O)n(CC(=O)N2CCCC23CN(C(=O)[C@@](C)(Cl)CCl)C3)c2ccccc21	1843860230	AZRQKOQQHWZRJZ-IBGZPJMESA-N	439.343	1.780	50	20	IDGD	
COc1ccc2[nH]cc(C(=O)N3CCCC34CN(C(=O)c3cnccc3C(=O)NN)C4)c2c1	1844050835	YKZGRPHWVYVWRH-UHFFFAOYSA-N	448.483	1.306	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCCC12CN(C(=O)[C@H]1CCc3nc(O)nc(O)c3C1)C2	1844377569	STNOCIWPAKEIAV-ZDUSSCGKSA-N	434.569	1.048	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)c2oncc2C)C1	1844618641	VFPLZLQNBHBOHO-UHFFFAOYSA-N	428.401	1.947	50	20	IDGD	
Cc1n[nH]cc1C(=O)N1CCCC12CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1844773807	FSDJVUJIRXGZMS-AWEZNQCLSA-N	425.917	1.667	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2cccc(N(C)C)c2)C1	1844907518	GRXMSBNTSIDCCK-PCLIKHOPSA-N	436.516	1.704	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)c2ccc(N3CCCCC3)cc2)C1	1845382007	FHLIERPGXIRYKA-UHFFFAOYSA-N	447.344	1.488	50	20	IDGD	
COc1ccc(/C=C(\C)C(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)cc1	1845833965	ASQKANQZCJDSNB-GHRIWEEISA-N	434.301	1.296	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)C1CCC(C(F)(F)F)CC1)C2	1846384086	AZSZUNQDDXPUKR-UHFFFAOYSA-N	432.487	1.932	50	20	IDGD	
COc1ccc(N2C[C@@H](C(=O)NNC(=S)NCCc3cccs3)CC2=O)c(OC)c1	11523702	ZQWDIMMJXLEFEN-ZDUSSCGKSA-N	448.570	1.856	50	20	IDGD	
CC(=O)N[C@@H](CC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)c1cccs1	14057428	KRRUBPQNIHQELE-HNNXBMFYSA-N	438.531	1.027	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)c1ccc2c(c1)C[C@H](C)N2S(C)(=O)=O	14939581	KJKRDSAGQSMTMA-STQMWFEESA-N	435.477	1.765	50	20	IDGD	
C[C@@]1(NNC(=O)NC[C@@H](c2cccc(Cl)c2)N2CCOCC2)CCS(=O)(=O)C1	727034920	YAPWKZSYCGCBBE-FUHWJXTLSA-N	430.958	1.094	50	20	IDGD	
CCOc1ccc(OCC)c(NC(=S)NNC(=O)c2cc(S(N)(=O)=O)cn2C)c1	727496367	LYVABSOTZFBWIJ-UHFFFAOYSA-N	441.535	1.101	50	20	IDGD	
Cc1c(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)[nH]c2c1C(=O)CCC2	728213217	GVASHCQCMYVADC-UHFFFAOYSA-N	445.545	1.535	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)C[C@H]2CCS(=O)(=O)C2)c2ccccc2c1=O	728214192	ADVLOPUKWFCHQG-CQSZACIVSA-N	434.518	1.173	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN1c1ncnc2sccc12)c1ccc2c(c1)OCCO2	728462656	QLZYJOIRTGNOKJ-AWEZNQCLSA-N	425.470	1.893	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)CNS(=O)(=O)c2cccs2)c1	728529611	HAHAUGWBPCLRMV-UHFFFAOYSA-N	448.320	1.259	50	20	IDGD	
CC1(C)Cc2ccc(C(=O)NNC(=O)c3ccc(Cl)c(S(N)(=O)=O)c3)c(O)c2O1	728960403	SSCLNBCGSXNXRT-UHFFFAOYSA-N	439.877	1.481	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)c2cn(-c3cccc([N+](=O)[O-])c3)nn2)o1	731455158	ALAZYQVWGZKKMB-UHFFFAOYSA-N	427.421	1.685	50	20	IDGD	
COc1ccc(-n2ccc(C(=O)OCC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)n2)cc1	732331310	BJRWTIIBULEUQN-UHFFFAOYSA-N	439.384	1.407	50	20	IDGD	
O=C(NNC(=O)c1ccccc1NS(=O)(=O)C(F)(F)F)c1ccc([N+](=O)[O-])cc1	732748719	CIJVPQSZYMOWFG-UHFFFAOYSA-N	432.336	1.931	50	20	IDGD	
CS(=O)(=O)NCCc1ccc(C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)s1	733108261	DHKDQCNNSHRZHO-UHFFFAOYSA-N	433.515	1.100	50	20	IDGD	
CCC(CC)[C@@H](CNC(=O)NNC(=O)c1cnn(-c2ccccc2)c1)N1CCOCC1	733338214	ZDMPDJOWRKIQAU-HXUWFJFHSA-N	428.537	1.953	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)[C@@H]1CC(c2cc(F)ccc2F)=NO1	734241353	CBDSHPAPGOSHLR-AWEZNQCLSA-N	427.408	1.313	50	20	IDGD	
Cc1nn([C@@H]2CCS(=O)(=O)C2)c(C)c1C=NNC(=O)NCCNC(=O)OC(C)(C)C	734303813	GSUNNUKYJRELNA-CQSZACIVSA-N	442.542	1.017	50	20	IDGD	
C[C@@H]1CN(Cc2ccccn2)CCC1=NNC(=O)Cc1csc(N2CCOCC2)n1	734364329	YUMBVJNRNOPNQO-MRXNPFEDSA-N	428.562	1.931	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)c1cccnc1S[C@@H](C)C(=O)N1CCCC1	740852578	DEMPXGOGXUZMPR-ZDUSSCGKSA-N	435.550	1.250	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)[C@@H]1COc2ccccc2O1)[C@H]1CN(Cc2ccccc2)CCO1	741280946	KPFNEWKEIMAZNT-DQLDELGASA-N	440.500	1.446	50	20	IDGD	
CC(C)(C)OC(=O)N(CC(=O)NNC(=O)Cn1cnc2ccccc21)C[C@@H]1CCCO1	742034016	UKDZJJAMADOTSU-HNNXBMFYSA-N	431.493	1.600	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)c1ccc(-c2noc(-c3ccc(F)cc3)n2)cc1	742491518	XBUIJDJUAHPASI-HNNXBMFYSA-N	444.444	1.738	50	20	IDGD	
COc1cc(I)c(C(=O)NNc2ncnc3[nH]cnc23)cc1OC	743468317	BYFSRVPPSLESCS-UHFFFAOYSA-N	440.201	1.732	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)N[C@@H]1CC(=O)N([C@@H]2C[C@@H]2c2ccccc2)C1	743509951	NRXQRQGKQUUKGP-KZNAEPCWSA-N	438.484	1.561	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)c2cc(S(=O)(=O)N3CCCCC3)cn2C)cc1	743826782	NVAOISQXAXQEFI-UHFFFAOYSA-N	448.549	1.732	50	20	IDGD	
Cc1oc(C(=O)O)cc1S(=O)(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	746055337	FACLIFFGENTYQE-UHFFFAOYSA-N	446.482	1.178	50	20	IDGD	
O=C(CCN/C(O)=C1/N=CC=CC1=O)NNC(=O)c1cc(F)ccc1Br	746216275	QIALKTXQSALYMQ-PEZBUJJGSA-N	425.214	1.266	50	20	IDGD	
CS(=O)(=O)c1ccc(OCCCCC(=O)NNC(=O)Cc2cn3ccccc3n2)cc1	746550024	LNKYAYUUJSBUNR-UHFFFAOYSA-N	444.513	1.677	50	20	IDGD	
Cn1ncc2cc(C(=O)NNC(=O)c3cccc(S(=O)(=O)N4CCCCC4)c3)cnc21	747348811	RPUAMPYKTQECIN-UHFFFAOYSA-N	442.501	1.218	50	20	IDGD	
O=C(CNC(=O)[C@@H]1c2ccccc2C(=O)N1Cc1ccccc1)NNC(=O)CC(F)(F)F	747473547	HEQZSGFTFNMTIK-SFHVURJKSA-N	448.401	1.600	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)NCc1cccc(NC(=O)c2ccc(F)cc2)c1	748617232	JNKHEOZLBDVFHZ-AWEZNQCLSA-N	432.452	1.960	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NCC(=O)N2CCN(c3ccccc3)CC2)cc1	749222583	ZMYIEWKPGBYESH-UHFFFAOYSA-N	425.489	1.053	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)c1ccccc1OCc1cn2ccccc2n1	751203960	AYOPRCXIQVUXEN-UHFFFAOYSA-N	433.424	1.697	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2csc(-c3ccccn3)n2)ccc1Cl	751294739	QCFUUFOMOLKTCV-UHFFFAOYSA-N	437.890	1.581	50	20	IDGD	
O=C(NC[C@H](O)CS(=O)(=O)c1cccs1)NNC(=O)c1cccc2ccccc12	752181528	RUZULFHYNJXSKX-AWEZNQCLSA-N	433.511	1.680	50	20	IDGD	
COc1cc(OC)cc(N2C[C@@H](C(=O)NNC(=O)c3ccc(Cl)cc3O)CC2=O)c1	752520780	WFDGMVTYKJVQQW-NSHDSACASA-N	433.848	1.877	50	20	IDGD	
CN1C(=O)N[C@@]2(CCC[C@H]2CNC(=O)NNC(=O)CCSc2ccc(F)cc2)C1=O	753023726	OIMGQIYCSKGDKX-HXPMCKFVSA-N	437.497	1.359	50	20	IDGD	
C[C@@H]1Cc2cc(S(N)(=O)=O)ccc2N1C(=O)COC(=O)/C(C#N)=C/c1ccc(O)cc1	754538086	CFSLISBMJITONO-BPKVKKHESA-N	441.465	1.468	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)c(C)o1	754740848	LQPXEFOFYMTPKO-UHFFFAOYSA-N	428.419	1.024	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(NC(=O)NNC(=O)Cn2nc(C)cc2C)ccc1C	755394077	RDKBYEMWNMZRPL-UHFFFAOYSA-N	436.538	1.692	50	20	IDGD	
CNC(=O)c1ccc(NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1Cl	756139587	KJUWFBSYEMSUJZ-UHFFFAOYSA-N	431.884	1.559	50	20	IDGD	
CC[C@H]1CN(CC(=O)NNC(=O)c2cccc(C#N)c2)CC[C@H]1NC(=O)OC(C)(C)C	757113856	ZSZLWTNYTBYGMQ-FUHWJXTLSA-N	429.521	1.944	50	20	IDGD	
CN(C(=O)c1ccc(C(=O)NNC(=O)CNC(=O)c2cccnc2)cc1)c1ccccc1	757650933	PDBKSZBDYQMQSG-UHFFFAOYSA-N	431.452	1.549	50	20	IDGD	
Cc1cc(C(=O)N2CCOCC2)ccc1NC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	757828880	AGUFGKHYRAZPGK-UHFFFAOYSA-N	427.417	1.842	50	20	IDGD	
COC(=O)c1cccc(CC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)c1	759661709	XFVWGOVVVLAZMF-UHFFFAOYSA-N	446.529	1.095	50	20	IDGD	
CC(C)(C)C(=O)NNC(=O)C(=O)Nc1ccc(NC(=O)[C@H]2CCCO2)cc1C(F)(F)F	761071271	AUJHENZATUBQRH-CYBMUJFWSA-N	444.410	1.955	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)C1CC1	763497578	GZVOZPOIILWXPG-INIZCTEOSA-N	447.540	1.327	50	20	IDGD	
CN(C)c1ccc(NC(=O)C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1	763530760	HRWZPXUMLLJKOC-UHFFFAOYSA-N	438.532	1.051	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cccc([C@@H](C)OC)c2)cc(OC)c1OC	763540078	QHFUGAMCOYVMIR-GFCCVEGCSA-N	431.445	1.820	50	20	IDGD	
COC(=O)Cc1ccccc1NC(=O)C(=O)NNC(=O)COc1cc(C)ccc1C(C)C	763596381	GNQSVFVBWPCKQL-UHFFFAOYSA-N	441.484	1.999	50	20	IDGD	
O=C(COc1cccc(C(F)(F)F)c1)NNC(=O)C(=O)Nc1ccnn1CC1CC1	763638558	AOZAFDQHBDSNNA-UHFFFAOYSA-N	425.367	1.477	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2cccn(Cc3ccccc3)c2=O)c1	763651098	UJJHACWKCFJPIZ-UHFFFAOYSA-N	448.479	1.678	50	20	IDGD	
CCNS(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2ccc(Cl)cc2OC)cc1	763654238	BUZRRFQFMFWCOR-UHFFFAOYSA-N	440.909	1.791	50	20	IDGD	
CC[C@@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2OC)cc1	763656923	KBVHJHBYVTXPPF-CQSZACIVSA-N	442.472	1.388	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(N3CCCC3)c(F)c2)cc1	763682551	VYFMDINWVZCWBO-UHFFFAOYSA-N	425.420	1.462	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2Cc2ccccc2)c(=O)n(C)c1	763718861	PFHVSJJDOGVOSF-UHFFFAOYSA-N	448.479	1.449	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2cnc(Cl)cc2C)c2ccccc2c1=O	763786885	RIESUQZPEJYHNB-UHFFFAOYSA-N	428.836	1.173	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)C(=O)Nc1ccccc1Br	763804289	RNWQWHBCVHWNMS-UHFFFAOYSA-N	437.206	1.522	50	20	IDGD	
CCOC(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)c1	763867581	XDHQSMKOVUDBSB-ZDUSSCGKSA-N	431.420	1.485	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cccc([N+](=O)[O-])c2C)cc1	763872280	NGUCTSRJBPQNRQ-CYBMUJFWSA-N	428.401	1.659	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cnc(-c3ccccc3)nc2)cc1	763877116	HPQHOPODHWWXOX-HNNXBMFYSA-N	447.451	1.900	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2nnc(C(C)(C)C)s2)cc1	763878663	SLIJONPGRPYGQK-NSHDSACASA-N	433.490	1.592	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNC(=O)CCSc2ccc(F)cc2)cn1C	763901682	JLWUWGZLNCCYAC-UHFFFAOYSA-N	436.465	1.609	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(N)=O)cc2F)cc1OC	763910351	FROJIHRCNISSSD-UHFFFAOYSA-N	432.408	1.122	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cccnc2-n2cccn2)cc1OC	763912316	VNOYNTITIHVBCN-UHFFFAOYSA-N	438.444	1.464	50	20	IDGD	
COCCn1nc(C)c(NC(=O)C(=O)NNC(=O)c2ccc(Br)s2)c1C	763938540	HVCBENBSXMQLFB-UHFFFAOYSA-N	444.311	1.370	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)Nc1ccc(-n2cccn2)c(F)c1	764003134	ZDKOXSURLPQHQI-UHFFFAOYSA-N	449.240	1.512	50	20	IDGD	
CN(C)CCc1ccc(NC(=O)C(=O)NNC(=O)c2cc(Br)cn2C)cc1	764005325	YKBLAMQZQMQBGI-UHFFFAOYSA-N	436.310	1.291	50	20	IDGD	
COC(=O)c1ccc(-n2cc(C)cn2)c(NC(=O)C(=O)NNC(=O)Cc2ccsc2)c1	764035263	QNASDCVSOXIQKJ-UHFFFAOYSA-N	441.469	1.357	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc(S(C)(=O)=O)cc3)n[nH]2)cc1	764110965	NEFQJLBLHOGJBL-UHFFFAOYSA-N	441.469	1.188	50	20	IDGD	
Cc1ccc(-c2nnco2)cc1NC(=O)C(=O)NNC(=O)c1cnn(-c2ccccc2)c1	764350775	LGDFILKRBXCCBC-UHFFFAOYSA-N	431.412	1.630	50	20	IDGD	
CC(=O)N1CCc2cc(NC(=O)C(=O)NNC(=O)c3cnn(-c4ccccc4)c3)ccc21	764351257	QKDQKEDSRKHATO-UHFFFAOYSA-N	432.440	1.181	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COCCO1)C(=O)Nc1cccc(OCc2ccc(Cl)cc2)c1	764426064	SMDKIPCXEUVGGQ-KRWDZBQOSA-N	433.848	1.420	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1	764688474	ORHZBHWSPYYMKE-UHFFFAOYSA-N	448.439	1.793	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)c1cc([N+](=O)[O-])ccc1N1CCOCC1	765247353	CWNYPLCLWKONBF-UHFFFAOYSA-N	432.458	1.690	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)COc3cccc([N+](=O)[O-])c3)CC2)cc1	765756582	XPHFFUPQXUVOFI-UHFFFAOYSA-N	441.488	1.247	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)C=C3CCC(C)CC3)CC2)cc1	766636177	MCQNPAUYABPZPB-UHFFFAOYSA-N	448.589	1.585	50	20	IDGD	
CC(C)c1cc(NC(=O)C(=O)NNC(=O)c2cccc3cccnc23)n(-c2ncccn2)n1	768240619	ZGFQNGGAEDTKHR-UHFFFAOYSA-N	444.455	1.734	50	20	IDGD	
CC(=O)N1CCN(c2ccc(C(=O)NNC(=S)Nc3ccccn3)cc2[N+](=O)[O-])CC1	768585945	XKINBUATQGDJSP-UHFFFAOYSA-N	443.489	1.290	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)NC(C(N)=O)C(N)=O)c(C)n1-c1cc(Cl)ccc1Cl	769756094	KJAOFOOSLWKSAP-WUXMJOGZSA-N	434.283	1.763	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)NCCN1C(=O)c2ccccc2C1=O	770315465	ILRAQGWTMLOJLS-GFCCVEGCSA-N	430.848	1.734	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)N1CCN(c2ccc([N+](=O)[O-])nc2)CC1	770649954	RNCNICBCFZDBSL-CYBMUJFWSA-N	448.867	1.974	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)[C@H]3CCCN(C(=O)CCOc4ccccc4)C3)nc21	770973277	CIWVVLKJJYDRNJ-AWEZNQCLSA-N	439.476	1.220	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)CSc3nncn3-c3cccc(Cl)c3)nc21	770974294	SYWJAPYJNLLFMF-UHFFFAOYSA-N	431.869	1.538	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)CNC(=O)c1ccc(Br)cc1	771867946	NDQKSPURDLSZKL-LLVKDONJSA-N	428.283	1.304	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)CN1C(=O)N[C@@]2(C[C@H](C)CC(C)(C)C2)C1=O	771971225	YFWDVPXYDUMRJQ-HKZYLEAXSA-N	438.525	1.248	50	20	IDGD	
Cc1nc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)ccc1Br	773519334	GKDFIBYWYVSYBE-UHFFFAOYSA-N	443.261	1.942	50	20	IDGD	
CS(=O)(=O)NCc1ccc(NC(=O)C(=O)NNc2ccc(C(F)(F)F)cc2)cc1	773761690	BXZXFQYWWFTAQB-UHFFFAOYSA-N	430.408	1.836	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NC[C@@H]2COC3(CCCC3)O2)nc1	774313041	XHKOAZGIECYANT-CQSZACIVSA-N	427.527	1.424	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)[nH]n1)Nc1ccnn1[C@@H]1CCS(=O)(=O)C1	776058968	MWKIOECPJWRYIT-CYBMUJFWSA-N	429.462	1.099	50	20	IDGD	
CSCCCCCNC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	776257066	PYVBSDPXAAKZME-UHFFFAOYSA-N	428.580	1.948	50	20	IDGD	
COc1ccc(C(=O)CNC(=O)CCC(=O)NNc2cccc(S(C)(=O)=O)c2)cc1	776715086	PFIIHFWPIVXKCG-UHFFFAOYSA-N	433.486	1.321	50	20	IDGD	
CC(C)(C)CC(=O)N1CCC[C@@H]1C(=O)N1CCN(S(=O)(=O)CBr)CC1	777833264	WDGBIOWTBVVNDM-CYBMUJFWSA-N	438.388	1.240	50	20	IDGD	
CCOC(=O)N1CCC([C@@H](C)NCC(=O)NNC(=O)c2ccc(OC)c(OC)c2)CC1	778227848	TZUNIVPPCQLZOA-CQSZACIVSA-N	436.509	1.311	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)[C@H]2CC(=O)N(c3ccc4c(c3)OCCO4)C2)nc1C	778422233	MXFSUQIAZSXAGR-ZDUSSCGKSA-N	441.444	1.229	50	20	IDGD	
Cc1csc([C@@](O)(CC(=O)NNC(=O)CNC(=O)OC(C)(C)C)C(F)(F)F)n1	778434245	XAFMHFBHTXBZEY-AWEZNQCLSA-N	426.417	1.264	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)c2c[nH]nc2-c2cnn(CC)c2)cc1C	778499881	NKMJPYKBTOFFPX-UHFFFAOYSA-N	430.490	1.843	50	20	IDGD	
CCOC(=O)c1cc(F)cc(S(=O)(=O)NNC(=O)COc2ccccc2OCC)c1	778557099	SBRPVFFAZHHGRO-UHFFFAOYSA-N	440.449	1.790	50	20	IDGD	
O=C1CN(CCNC(=O)C(=O)Nc2ccccc2S[C@@H](Cl)C(F)(F)F)CCN1	781541756	ORCFCSJYXRLBRV-OAHLLOKOSA-N	438.859	1.392	50	20	IDGD	
Cc1nn(-c2ccc(S(N)(=O)=O)cc2)c(C)c1CCC(=O)NNC(=O)CC1CCCC1	781924076	WYWOINIXWDGIMO-UHFFFAOYSA-N	447.561	1.797	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C(=O)Nc2ccc(O[C@@H]3CCOC3)cc2)nc2ccccc21	782893087	HNEGMWSILLAMMF-MRXNPFEDSA-N	437.456	1.070	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2cccc(CN3CCN(C(C)=O)CC3)c2)cc1	783034920	LZXCEAMORCFUTA-UHFFFAOYSA-N	425.489	1.441	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)NC2CCC(Oc3ncccc3C#N)CC2)cc1	783040633	ZYOYYVYAANPJAB-UHFFFAOYSA-N	434.456	1.924	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NN[C@@]2(C)CCS(=O)(=O)C2)cc1Cc1ccccc1	783427960	RPYAVMWVGFEJQC-NRFANRHFSA-N	431.514	1.423	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNc2nc(-c3ccc(Cl)cc3)no2)cccc1-n1cnnn1	784795799	VQCFABPCNSEXPT-UHFFFAOYSA-N	439.823	1.756	50	20	IDGD	
O=C(NNc1cccc([N+](=O)[O-])c1)C(=O)Nc1cccc(S(=O)(=O)N2CCCCC2)c1	784833886	UWLLXAKPGAWFSC-UHFFFAOYSA-N	447.473	1.851	50	20	IDGD	
COc1cc(F)cc(NNC(=O)C(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)c1	785236249	BUVKKLLHDAAOSN-UHFFFAOYSA-N	436.465	1.151	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1cnn(-c2ccc(F)cc2)n1	786139742	ILBJPIAEOATBCY-UHFFFAOYSA-N	447.810	1.686	50	20	IDGD	
Cc1ccnc(-n2nccc2NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1	788298800	BQMCVJYMGITWRP-UHFFFAOYSA-N	443.489	1.293	50	20	IDGD	
COc1ccc(F)c(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)c1OC	788517459	PBQRLOIZPWDPBC-UHFFFAOYSA-N	444.463	1.062	50	20	IDGD	
COc1ccc(C(=O)N2CCN(C)CC2)cc1NC(=O)NNc1cc(Cl)nc(N)n1	789067573	IKMHLVQNGOYYQU-UHFFFAOYSA-N	434.888	1.257	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2cc(Br)cc(C(=O)N3CCCC3)c2)ncn1	790957689	FMAMHSCPTYZYHG-UHFFFAOYSA-N	447.293	1.865	50	20	IDGD	
COc1cccc(C2=NO[C@H](C(=O)N3CCN(S(=O)(=O)CBr)CC3)C2)c1	792299170	BGFAWTWCUFDOCI-HNNXBMFYSA-N	446.323	1.015	50	20	IDGD	
C[C@@H]1CN(c2ccc(NC(=O)C(=O)NNc3nc4ccccn4n3)cc2F)C[C@@H](C)O1	792391924	LGNZWPSLZPTTOA-CHWSQXEVSA-N	427.440	1.564	50	20	IDGD	
CCNS(=O)(=O)c1ccc(F)c(C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)c1	794716219	BZMBTZHBDWIZPK-UHFFFAOYSA-N	444.510	1.131	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)CN[C@H](CO)c1ccccc1OC(F)(F)F	796526874	ZELYGZADMSNDOH-MRXNPFEDSA-N	425.407	1.907	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NC(=O)NNC(=O)CSc2ccc(Cl)cc2)nc1	797653383	QTNJWKBCMNPWEJ-UHFFFAOYSA-N	443.938	1.930	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NCC2([S@](C)=O)CCC2)c2ccccc2c1=O	798120633	PIKWNNBPXVSOKC-PMERELPUSA-N	433.534	1.442	50	20	IDGD	
CC(C)Cn1c(=O)nc(O)c2c(C(=O)NNC(=O)NCC(F)(F)F)cc(C3CC3)nc21	798316562	PIXSDDXMYVFXSO-UHFFFAOYSA-N	442.398	1.537	50	20	IDGD	
NS(=O)(=O)c1ccsc1C(=O)NNC(=O)COc1ccccc1-c1ccccc1	799488064	ALHXCFHECXBIKH-UHFFFAOYSA-N	431.495	1.903	50	20	IDGD	
CCOC(=O)Oc1ccc(C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)cc1	800317001	JPQLEOZTGLQUEE-UHFFFAOYSA-N	434.474	1.898	50	20	IDGD	
CC(C)(C)[C@H](NC(N)=O)C(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1	800328114	HFZRFYBUFYSBQF-WOJBJXKFSA-N	437.544	1.844	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@]1(C)CCN(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)C1	800983748	SZKRSZNZTQBAML-FQEVSTJZSA-N	444.496	1.253	50	20	IDGD	
COc1cc(OC)c2cc(C(=O)NNC(=O)C(=O)Nc3ccc(C)cc3)[nH]c2c1OC	801106434	UZECILAKSSVWEO-UHFFFAOYSA-N	426.429	1.902	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCCC2C[C@@H](C)O[C@H](C)C2)cc1	802510478	PJQYODNCYXOKGG-HZPDHXFCSA-N	440.566	1.540	50	20	IDGD	
O=C(Cc1cc2c(cc1Br)OCCO2)NNc1ccc(-n2ccnc2)nn1	804956446	NRHKHZLSPHTJJI-UHFFFAOYSA-N	431.250	1.882	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)Nc2cc(CS(C)(=O)=O)ccc2OC)c1	806639621	USEMRHBZFJDGLN-UHFFFAOYSA-N	437.474	1.724	50	20	IDGD	
COCCc1ccnc(NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c1	806659964	LNZKUJQTXSPFSQ-UHFFFAOYSA-N	426.521	1.636	50	20	IDGD	
O=C(NNC(=O)C(F)(F)Oc1ccccc1)C(=O)Nc1nc2c(s1)CSCC2	806979176	NTSGVZVHSYKUOR-UHFFFAOYSA-N	428.442	1.690	50	20	IDGD	
O=C(NNC(=O)c1cc2ccccc2o1)C(=O)Nc1ccc(F)c(N2CCCNC2=O)c1	806980098	ONIWXSUYBYNOHG-UHFFFAOYSA-N	439.403	1.891	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2cccc(F)n2)cc1S(=O)(=O)N1CCCCC1	807392487	QHCJDPGJYFAJQN-UHFFFAOYSA-N	435.481	1.786	50	20	IDGD	
Cc1nc(S(=O)(=O)NNC(=O)c2ccc(Cl)cc2F)c(Br)n1C	808096534	NVMHAJIXGADUEU-UHFFFAOYSA-N	425.667	1.907	50	20	IDGD	
COC[C@@]1(C(=O)NNC(=O)c2cc(OC)cc(OC)c2)CCN(C(=O)OC(C)(C)C)C1	809948990	VARINFJLHIADMJ-OAQYLSRUSA-N	437.493	1.738	50	20	IDGD	
CCS(=O)(=O)NCc1ccc(C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)cc1	812732883	VAVHVTLYDGUTDD-UHFFFAOYSA-N	440.547	1.133	50	20	IDGD	
CO[C@H]1Cc2ccc(NC(=O)C(=O)NNc3ccc(S(=O)(=O)N(C)C)cc3)cc2C1	813033174	IDCSQJBKFHJBIT-KRWDZBQOSA-N	432.502	1.132	50	20	IDGD	
Cc1ccnc(NNC(=O)C(=O)Nc2ccc([N+](=O)[O-])c(I)c2)c1	815593003	YFTGIMXATNDICR-UHFFFAOYSA-N	441.185	1.985	50	20	IDGD	
C[C@@H]1CCCCN1C(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@H]2CCCO2)cc1Cl	815778170	FTAVGXUDWKGFJA-MLGOLLRUSA-N	436.896	1.620	50	20	IDGD	
O=C(NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1)c1cc2ncccn2n1	816830341	BYKLTUWYDIPTOL-UHFFFAOYSA-N	442.482	1.666	50	20	IDGD	
COc1cccc(/C=C(/C(=O)NNC(=O)COc2ccc(F)cc2)n2nnnc2C)c1	818029857	OQMSYLYWXRFOBE-WQRHYEAKSA-N	426.408	1.354	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)c2cn(Cc3noc(C)n3)nn2)c1	818750965	SIYGLHKUQZBLSG-UHFFFAOYSA-N	436.226	1.324	50	20	IDGD	
CSC[C@H](C(=O)NNC(=O)c1cccc(N(C)C)c1)N1C(=O)[C@H]2CCCC[C@H]2C1=O	904225086	SUTHOSAMEMXFDJ-IXDOHACOSA-N	432.546	1.420	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)c1c(Cl)nc2ccccn12	916099323	BTWLLFMZKCQKSK-UHFFFAOYSA-N	426.908	1.961	50	20	IDGD	
O=C(NCC#Cc1ccccc1)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	916246443	YFOLHBQBPJAYEI-UHFFFAOYSA-N	440.525	1.857	50	20	IDGD	
C[C@H]1CN(C[C@H](C)C(=O)NN=Cc2ccccc2OCC(=O)N2CCCC2)C[C@@H](C)O1	916372161	OJLBMVVEIZVEIG-GBESFXJTSA-N	430.549	1.883	50	20	IDGD	
C[C@]1(NNC(=O)NCc2ccc(N3CCc4ccccc4C3)nc2)CCS(=O)(=O)C1	916431016	BGODZOPUZXUKSG-NRFANRHFSA-N	429.546	1.525	50	20	IDGD	
C[C@H](CN1CCOCC1)NC(=O)NNC(=O)COc1ccccc1Cc1ccccc1	916470059	IDUPTVFWWSRMPK-GOSISDBHSA-N	426.517	1.707	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)c2ccc(Cl)nc2)cc1	917745887	BUDXDLJMOAPYIH-UHFFFAOYSA-N	446.938	1.389	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2ccc(Cl)nc2)c1	918081086	YCIONFIYUDRWNV-UHFFFAOYSA-N	439.925	1.910	50	20	IDGD	
CC(C)CN1CCO[C@@H](CNC(=O)NNC(=O)c2ccc(F)cc2Br)C1	918188525	LIUUXMPATBUIAT-ZDUSSCGKSA-N	431.306	1.889	50	20	IDGD	
CN(CC(=O)NNC(=O)c1ccc(F)cc1Br)S(=O)(=O)c1cccnc1	918341755	ANQPPWRTNNDOGA-UHFFFAOYSA-N	445.270	1.065	50	20	IDGD	
C[C@H](Cc1cccc(O)c1)NC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	919784410	PUWSYOJTLBEKFR-OAHLLOKOSA-N	446.529	1.752	50	20	IDGD	
CC(=O)NC1(c2noc(CCC(=O)NNC(=O)c3ccccc3O)n2)CCCCCC1	919809372	NTGFMUKPVUONOT-UHFFFAOYSA-N	429.477	1.855	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)Nc2ccc(CN3C(=O)CNC3=O)cc2)c1C	920933073	HQSKLUHUMNQNRB-HNNXBMFYSA-N	439.472	1.975	50	20	IDGD	
CN1CCN(C[C@H](NC(=O)NNC(=O)c2cncn2-c2ccccc2)c2ccccc2)CC1	1318269558	CEAVUCFXFYLKGT-NRFANRHFSA-N	447.543	1.805	50	20	IDGD	
Cc1nnc(CNC(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)n1C	1318599664	WBABAXLNOBJWFY-UHFFFAOYSA-N	446.471	1.026	50	20	IDGD	
CCOC(=O)c1ncc(C(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)s1	1346580958	RGJQHHZKRHLMEA-UHFFFAOYSA-N	441.510	1.569	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](N)Cc2cccnc2)C1	1778053631	OOWGUADAKBMZDY-VQQMMKBISA-N	436.984	1.873	50	20	IDGD	
CCO/C=C/C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1	1780098092	BIXOUPUQZBZXHF-ISPXXFMDSA-N	447.444	1.514	50	20	IDGD	
COc1cc(C#N)cc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)c1	1780175466	JWGBRJVJZLXCRT-BFUOFWGJSA-N	436.306	1.794	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cccc(C#N)c3)C2)C1	1780597851	VHPIKECMKRQONE-VUEBRRCKSA-N	448.483	1.136	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H]1CCC(=O)NC1)C2	1780706012	DMTPOTIEXIIIDI-TUFGIGEDSA-N	434.364	1.263	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)c3cccc4c3NC(=O)C4)CCO2)C1	1781232218	HVTJPPXSGOXMJS-VQTJNVASSA-N	440.327	1.861	50	20	IDGD	
Cc1cncc(CCC(=O)N2CCO[C@]3(CCN(C(=O)[C@H](F)Br)C3)C2)c1	1781325675	GYBMTPZMHVSIAF-FUHWJXTLSA-N	428.302	1.843	50	20	IDGD	
O=C(Cc1ccc2c(c1)OCO2)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781327914	DLCCKTVWYXRFNJ-WMZOPIPTSA-N	443.269	1.478	50	20	IDGD	
O=C(c1n[nH]c(C2CC2)c1F)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781328001	GJBNSRLKGHSAEG-BBRMVZONSA-N	433.253	1.560	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)c(OC)c1	1781335228	VQKHFLHGDWEPGG-QAPCUYQASA-N	445.285	1.838	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)n2cncn2)C1	1782532927	DEHTVALJTUBCEO-BASYENTBSA-N	442.358	1.527	50	20	IDGD	
COC[C@H](C)C(=O)N1CCO[C@]2(CCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1	1782862118	PBUOARQMYOGNME-UDVCIYDASA-N	433.455	1.984	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(NC(C)=O)o3)CCO2)C1	1783349667	QSMRKHDTLXOASU-UGSOOPFHSA-N	442.310	1.855	50	20	IDGD	
COc1ccc(Cl)c(CC(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)c1F	1784052846	HHVIJHZFZRQFBD-LIRRHRJNSA-N	449.306	1.460	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@]3(F)CCCCC3(F)F)C[C@@H]21)[C@H](O)CCl	1784093477	WCQHPOFUAVFQKQ-JEJJNBGPSA-N	426.863	1.483	50	20	IDGD	
Cc1cc(C)n(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)Br)C[C@@H]32)n1	1785342418	KLSMYJHRBNIIAF-UGUYLWEFSA-N	427.343	1.263	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(Cl)nc3F)[C@H]2C1	1785490327	UEPYYWFEXOLRAX-PYJNHQTQSA-N	434.295	1.721	50	20	IDGD	
CC1(CC(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](F)Cl)CCO3)CN(C(=O)OC(C)(C)C)C1	1785709753	QPGRLDYLRHXLBS-MGPUTAFESA-N	447.935	1.998	50	20	IDGD	
Cc1nccn1CCCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCBr)[C@H]2C1	1786407621	BRGBTYYWSUGQGY-ULQDDVLXSA-N	441.370	1.736	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21	1786409053	UDTLIGJFGJYRGG-GMOBBJLQSA-N	430.112	1.442	50	20	IDGD	
O=C(CCN1CCCCC1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21	1786577849	OUAAHIOWKOLBLN-JKQORVJESA-N	434.350	1.533	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc4c3cnn4C)[C@H]2C1	1788067525	KGFMMWPDZDNJEQ-UHEFJODHSA-N	434.924	1.420	50	20	IDGD	
CCOC(=O)N[C@@H](O)C(=O)Nc1ccc(C2(NC(=O)[C@@H](F)Br)CCC2)cc1	1789407113	WXDNEGKGZOGQOJ-DOMZBBRYSA-N	446.273	1.876	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CC34CCCN3CCC4)[C@H]2C1	1789822915	IYWUPZDMTJBVGM-QAETUUGQSA-N	442.398	1.768	50	20	IDGD	
CCOc1ncccc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]2C1	1789920894	FKUJIRNGGUQNDG-CYUUQNCZSA-N	444.301	1.764	50	20	IDGD	
Cc1nccn1[C@@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]2C1	1789927287	SYZVUAIMMGKVPZ-PSWFKFNGSA-N	431.306	1.423	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3cnccn3)C[C@@H]21)[C@@H](F)Br	1789927564	ZANRBMAPQNFDRD-ATVPRXPUSA-N	429.290	1.079	50	20	IDGD	
CC[C@H](NC)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C(C#N)=C/c3ccc(F)cc3F)[C@H]2C1	1790694083	CHULBQXBAZDYNF-SNVXUZMMSA-N	446.498	1.849	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cncn3-c3ccncc3)C[C@@H]21)C(Cl)Cl	1791294247	OQRDXJLWBSSLIZ-NOLJZWGESA-N	438.315	1.664	50	20	IDGD	
Cc1cc(Br)cnc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2	1794964916	JDJHJHRDQZWRQY-RDBQEKCUSA-N	434.693	1.890	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/C1CCCC1)C2	1796443958	SIOPYUYXHJCAGI-QGXUUIPSSA-N	441.532	1.456	50	20	IDGD	
C[C@@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@](C)(Cl)CCl)C2)n1ccccc1=O	1797935501	IIOFQTWYNVSRBA-WXZWTWHISA-N	430.332	1.235	50	20	IDGD	
Cc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)CBr)C3)c(O)n1	1798651982	XDHWHMHHYAMNEG-IKVITTDRSA-N	426.311	1.330	50	20	IDGD	
CCOc1cccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Br)c1O	1799348235	DWYTWHMYQZJPKR-VAECKANCSA-N	445.285	1.685	50	20	IDGD	
N#Cc1ccc(F)c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Br)C3)c1	1799747883	YBANTQVXUNBLBY-JLUCKKNBSA-N	428.233	1.591	50	20	IDGD	
COCCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](Br)Cc1ccccc1	1800437094	WBUAZTPBAKTXFK-SFNKJDCFSA-N	439.350	1.619	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccccc1C(N)=O)C2	1800643365	RBWBHLXGHDGXFZ-VZAMPYOESA-N	438.322	1.162	50	20	IDGD	
CCOc1ncccc1C(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]1c1cccnc1	1803137792	RVLHBDKGZUVXJA-KBAYOESNSA-N	432.908	1.795	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1803694357	HWTXZFQOVNAJKE-ABSDTBQOSA-N	437.972	1.868	50	20	IDGD	
COc1nccnc1C(=O)NC[C@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1	1804971696	PJOAJMJKFLWOQX-RHSMWYFYSA-N	448.321	1.985	50	20	IDGD	
COC(=O)[C@H]1CC[C@H](C(=O)N2CCC3(CCCN(C(=O)[C@H](O)CCl)C3)CC2)CC1	1805517520	JBQTYPOHOVUQST-BRWVUGGUSA-N	428.957	1.797	50	20	IDGD	
O=C(c1cc(-c2ccncc2)[nH]n1)N1CCC2(CCCN(C(=O)[C@H](O)CCl)C2)CC1	1805523105	OOKLZUHUFAJKFL-GOSISDBHSA-N	431.924	1.916	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CN2CCOCC2)[C@H]1c1cccnc1)[C@@H](F)Br	1808661214	HAYNBYLXKCUMTG-BHYGNILZSA-N	443.317	1.110	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)[C@H](Cl)COC)[C@H]1c1cccnc1	1810238759	ILFGTOLCDVMLOK-XBVQOTNRSA-N	439.944	1.049	50	20	IDGD	
C=CCC(F)(F)C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1812671448	GDYCKRDRKKVCCO-QFBILLFUSA-N	437.491	1.672	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)Cn2ccnn2)[C@@H]1c1cccnc1	1812777949	ZNLDFRVWROOQFD-YQQAZPJKSA-N	435.326	1.553	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)COc2cccnn2)[C@H]1c1cccnc1	1812868244	VTGBLSJKUXHNSL-YEWWUXTCSA-N	448.321	1.740	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1	1813016918	IILYRIBFMKXYFZ-QTMHVTGLSA-N	449.935	1.443	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)/C=C/c2ccco2)[C@H]1c1cccnc1	1813070679	KTSPDBMNSWYMDO-QSFPYNRASA-N	439.516	1.767	50	20	IDGD	
CNc1nsnc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](Cl)COC)[nH]n1	1814434633	JLLKWCBLRDUVGT-MWLCHTKSSA-N	427.918	1.863	50	20	IDGD	
O=C(NCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](O)CCl)n[nH]1)c1cccs1	1814867440	LDFPDOOIZMXJPC-OLZOCXBDSA-N	439.925	1.493	50	20	IDGD	
O=C(C[C@@H]1CCCCO1)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1815602014	FABGMDSYULDXND-PKOBYXMFSA-N	440.309	1.355	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)N[C@@H]1CCc2nc(NC(=O)[C@@H](F)Cl)sc2C1	1817118226	UXMWWEVHUSQYAH-QMTHXVAHSA-N	425.873	1.415	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3ncn(C(C)C)n3)sc2C1	1817689832	BTZZDKVRXGCZQQ-WDEREUQCSA-N	426.930	1.795	50	20	IDGD	
CC1=C(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cnccc3C(=O)NN)n[nH]2)CCO1	1819402734	IXWYIBFUBMPRFY-QGZVFWFLSA-N	439.476	1.408	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](COC(C)=O)OC(C)=O)n[nH]1	1819432166	ARPDKYIVACWFAQ-BPUTZDHNSA-N	442.900	1.914	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)C(=O)Nc2cccnc2)n[nH]1	1819530808	FTLSUNULXBSKKQ-HIFRSBDPSA-N	434.884	1.689	50	20	IDGD	
Cc1ccoc1C(=O)N[C@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1	1819797115	LNOCXBSCLJAIBR-NSHDSACASA-N	440.485	1.583	50	20	IDGD	
O=C(Cc1ccncc1)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1820715819	KTSHHCCHUUCTDY-IBGZPJMESA-N	433.277	1.033	50	20	IDGD	
CC(=O)N/C(=C\c1ccco1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1	1821223524	WQEZMHFPSURPRU-DKJKAOOUSA-N	449.895	1.772	50	20	IDGD	
O=C(O)CSCC(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](F)Br)[nH]n1	1822428026	YXVMRBPIDGHCGN-NOZJJQNGSA-N	437.291	1.910	50	20	IDGD	
CC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)Cn1cc(C)c(O)nc1=O)CC2	1822858094	WHDPHIUWMVPDQS-GHMZBOCLSA-N	439.925	1.343	50	20	IDGD	
Cc1nccn1CC(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1	1823009222	MWCABEHJTLSJNE-RNCFNFMXSA-N	430.303	1.951	50	20	IDGD	
O=C(CCn1cncn1)N[C@@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1	1823013536	CZBFDKLNUGSFJX-PRHODGIISA-N	431.291	1.427	50	20	IDGD	
CCS(=O)(=O)CC(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H](C)Br)CC1	1824468652	FMHGZULQRRGGRM-HIFRSBDPSA-N	437.400	1.824	50	20	IDGD	
CC(=O)N/C(C)=C/C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](F)Br)CC2	1824475197	HTXIJGAYGCPQMY-XDVGGKMYSA-N	433.303	1.786	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CSC(=N)N)CC2	1825447168	QSHWTZLBYVLBQS-SFYZADRCSA-N	434.385	1.855	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CNC(=O)c1ccco1)CC2	1825999005	LKAAJCVLWKHKFE-GHMZBOCLSA-N	440.909	1.332	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)C(C)(C)NCCC#N)CC2	1825999664	SVPFZYJLJJSQAU-NWDGAFQWSA-N	427.958	1.591	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CC[C@@H](N)C(N)=O)CC1	1826938288	SPQZQFFOMMEKRI-XHSDSOJGSA-N	445.402	1.372	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccn3c(O)nnc23)CC1	1827538481	NYGXCKRMVSGENQ-DLBZAZTESA-N	449.939	1.922	50	20	IDGD	
CC[C@@H](NC(N)=O)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCBr)CC1	1827560641	WLHBZNYEGWVUEI-HUUCEWRRSA-N	431.375	1.838	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnn(C(C)(C)C)c3)C2)C1	1830357924	HWOZFQLAUYYZKA-OAQYLSRUSA-N	440.972	1.973	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)cn1C	1830538269	AFJBBPKWPXNJJF-KUHUBIRLSA-N	442.354	1.435	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnn4cccnc34)C2)C1	1831651241	OEUZFLCSKCTMKN-OXJNMPFZSA-N	435.912	1.207	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc4c3NC(=O)C4)C2)C1	1831653275	DFNZENHVQXRFGT-JTSKRJEESA-N	449.935	1.659	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)C3(C(=O)OCC)CC3)C2)C1	1831656117	AXFOGMRJFKMVQD-DNVCBOLYSA-N	430.929	1.194	50	20	IDGD	
Cc1ncncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1	1831873243	FLCYAZXPVKYVTB-IBGZPJMESA-N	430.553	1.391	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2cnc[nH]2)CC1	1832096516	FVGRMTKUEJYEHS-MHNQQFQPSA-N	436.321	1.036	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)c1ccccc1)CCO2	1832231987	LQOFGGHTOSVHEF-ABSDTBQOSA-N	428.888	1.407	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC([C@@H]2CCCCN2C(=O)CCS(C)(=O)=O)CC1	1832398421	IVDRPMJFLQLYQN-KRWDZBQOSA-N	432.659	1.892	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCC(N2CCC(NC(=O)[C@@H]3CCC(=O)NC3)CC2)CC1	1833118297	NJVMLLNMGGSJQM-OAHLLOKOSA-N	426.989	1.349	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccccc3O)CCO2)C1	1833759069	WHLCWHACLJXTMA-DNVCBOLYSA-N	441.322	1.636	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](C)CBr)C3)C2)no1	1834343561	LQOCHZOUJGUYQZ-PXAZEXFGSA-N	430.299	1.084	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccnn3CC)CCO2)C1	1834417694	OJNOQWDZBCKPLV-KSSFIOAISA-N	443.342	1.147	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)CCN3CCOCC3)CC2)CC1	1834635103	RRLZSTMZPTULNF-HXUWFJFHSA-N	443.032	1.688	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cnc4snnc4c3)CC2)CC1)[C@@H](F)Cl	1835084260	TYVGZUNJKOXTGU-OAHLLOKOSA-N	440.932	1.806	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3csc(N)n3)CCO2)C1	1835796656	BDLKBABCCRGAMR-HZPDHXFCSA-N	437.349	1.032	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC(OC2CCN(C(=O)C3CN(C)C3)CC2)CC1	1836673941	KTBPXXSJBWQXMB-AWEZNQCLSA-N	430.387	1.578	50	20	IDGD	
COC(=O)[C@@H]1CC[C@@H](C(=O)N2CCC(OC3CCN(C(=O)[C@H](O)CCl)CC3)CC2)C1	1836711546	RZFZWLUVZRRVJY-IIDMSEBBSA-N	444.956	1.174	50	20	IDGD	
O=C(c1ccc2[nH]ccc2n1)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836717110	IPVNDFYPPIJGEW-IBGZPJMESA-N	434.924	1.775	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)C/N=C/c3ccco3)CCO2)C1	1837559907	JSDDZUCPGAEORK-VRFIZVPASA-N	425.913	1.562	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4cncn4c3)C2)C1	1837713076	FXERYIBXRZOMDQ-NRFANRHFSA-N	446.580	1.256	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@H](N)c3ccccn3)CC2)CC1	1837876054	YIXHEVUWEXFMLL-PKOBYXMFSA-N	438.956	1.334	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(F)c3F)CCO2)C1	1839000272	XCIARHHFSRMMIM-KPZWWZAWSA-N	447.276	1.818	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnn4ccc(C)cc34)C2)C1	1839144132	RCYQLQFWNQKYTF-DYESRHJHSA-N	434.924	1.730	50	20	IDGD	
Cc1cccnc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2	1839150439	MPDCSGZFJLEWCE-RTBURBONSA-N	430.332	1.696	50	20	IDGD	
C[C@H](Cn1ccnc1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2	1839155033	GWHZAPQNQXPVDX-MNEFBYGVSA-N	447.363	1.212	50	20	IDGD	
O=C(c1onc2ccccc12)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1839547874	TWQQPYSZBVQRMH-GOSISDBHSA-N	428.272	1.702	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3c[nH]c4ccccc34)C2)C1	1840154127	LZQZYLOHZAOHKP-PGRDOPGGSA-N	449.935	1.421	50	20	IDGD	
O=C(CCc1cc(F)ccn1)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840186838	WKHSDRPVJJMTEG-SFHVURJKSA-N	434.295	1.413	50	20	IDGD	
COc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)c(C)c1	1840189449	RSBLGPKYCGIUBI-IBGZPJMESA-N	431.316	1.877	50	20	IDGD	
C[C@H]1CC[C@H](C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)CC1	1840530730	IIZBDMBNOMACRY-YRBFXIGRSA-N	435.334	1.960	50	20	IDGD	
Cc1ccc(C(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)cc1Cl	1841150587	LAZLDPLIUACEEI-UHFFFAOYSA-N	427.892	1.778	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)N2CC3(CCCN3C(=O)[C@@H](O)CCl)C2)CC1	1841351360	MKGJRKIPOBBPNJ-CVEARBPZSA-N	443.972	1.827	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCCC12CN(C(=O)[C@@H]1C[C@H]3CC[C@@H]1O3)C2	1841925464	YTQQNNJNWPBYQT-WCVJEAGWSA-N	441.956	1.889	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)[C@H](C)n1cncn1)C2	1844693338	TYFHZCTVTKZLTF-ZDUSSCGKSA-N	442.432	1.190	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)Cc1ccc(Br)nc1)C2	1846363489	LWWWRADLYIDINB-CYBMUJFWSA-N	430.730	1.844	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)c2cc(S(C)(=O)=O)ccc2Cl)C1	1846925553	SIXZJNPGIBFCIW-OAHLLOKOSA-N	449.356	1.814	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc(O)ncn1	1847892582	ZVFWEKZGEIBDGY-PAENEARDSA-N	425.395	1.883	50	20	IDGD	
Cc1ccc([C@]2(C)NC(=O)N(CC(=O)NNC(=O)Cc3c[nH]c4ccccc34)C2=O)cc1	24453622	NZRWEEIDJOMYCZ-QHCPKHFHSA-N	433.468	1.633	50	20	IDGD	
COc1ccc(-c2noc(CCCC(=O)NNC(=O)c3n[nH]c(=O)c4ccccc34)n2)cc1	31593314	GWRNQICGLGYPBP-UHFFFAOYSA-N	448.439	1.766	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(C)c(C(=O)NNC(=O)Cc2c[nH]c3ccccc23)c1	32750923	KZXUMZOYGFLGRD-UHFFFAOYSA-N	444.513	1.405	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)N2CCC[C@@H](NS(C)(=O)=O)C2)N(C)c2ccccc21	108783763	AWKGDPRDCFQEMO-OAHLLOKOSA-N	445.545	1.197	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCCN(C(=O)OCC(C)C)CC1	725802161	MABPTLKPOZKUFC-UHFFFAOYSA-N	440.928	1.910	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)c3ncccc3O)c2)cc1	725879936	RQFGQMKYKPGSDB-UHFFFAOYSA-N	442.453	1.671	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)CCNC(=O)c2n[nH]c3ccccc23)cc1	726884161	YGAZFJFBEKJODE-AWEZNQCLSA-N	439.472	1.696	50	20	IDGD	
C[C@H](NC(=O)NNc1ccc(-n2cccn2)nn1)c1cccc(S(=O)(=O)N(C)C)c1	727609136	HKWSZXJGIQUNAA-ZDUSSCGKSA-N	430.494	1.300	50	20	IDGD	
C[C@H]1C[C@H](C)CN(C(=O)CN2CCN(C(=O)NNC(=O)CCCc3ccccc3)CC2)C1	727846110	KYTLWGAVEWJIQU-PMACEKPBSA-N	443.592	1.872	50	20	IDGD	
CNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cc(OC)ccc2Br)cc1	728529300	YDKAMDAPYYSUQT-UHFFFAOYSA-N	442.291	1.441	50	20	IDGD	
C[C@@]12CCC(=O)N1c1ccccc1C(=O)N2CC(=O)NNC(=O)CCc1ccccc1O	730033634	KAHRIONPQBSGIC-QHCPKHFHSA-N	436.468	1.471	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)c1cccc(S(=O)(=O)NC[C@H]2CCCO2)c1	730034417	RKZWUPADLPDJHB-QGZVFWFLSA-N	447.513	1.243	50	20	IDGD	
O=C(CSCc1cc(=O)n2ccsc2n1)NNC(=O)c1cccc2ncccc12	730226198	ATZZFNAEAQVVEV-UHFFFAOYSA-N	425.495	1.999	50	20	IDGD	
CON(C)S(=O)(=O)c1cc(C(=O)NNc2nc(-c3cccnc3)no2)ccc1Cl	732110478	BCPTZDBTBUKDED-UHFFFAOYSA-N	438.853	1.724	50	20	IDGD	
COC(=O)Nc1ccccc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	733123227	CAUPJEBVRQIEJX-UHFFFAOYSA-N	446.485	1.724	50	20	IDGD	
C[C@@H]1CC(C)(C)C[C@@]2(C1)NC(=O)N(CC(=O)NNc1nc3ccccc3c(=O)n1C)C2=O	733262375	SWKACRATDXCVKS-MCMMXHMISA-N	440.504	1.513	50	20	IDGD	
O=C(NC[C@@H]1CCCN1Cc1ccccc1)NNC(=O)c1csc(N2CCOCC2)n1	734162669	GFLSGNWUSZQYMR-KRWDZBQOSA-N	444.561	1.588	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)c2csc(-c3cnccn3)n2)CC1	734820964	BSHWLSREUWVTDO-UHFFFAOYSA-N	447.521	1.944	50	20	IDGD	
CC(=O)N/C(=C/c1ccccc1)C(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	734821932	PBWADXVNUJSAAF-NBVRZTHBSA-N	445.520	1.894	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)c2ccc(S(C)(=O)=O)o2)CC1	734822049	QUTRNTKTMFXMEM-UHFFFAOYSA-N	430.483	1.027	50	20	IDGD	
COc1ccc(COCC(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)cc1	734825258	XNADIJLPAWRYHU-UHFFFAOYSA-N	436.509	1.942	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)CCN2CCN(c3ccccn3)CC2)cc1OC	741143946	BQLHVMPCXWIPKM-UHFFFAOYSA-N	427.505	1.462	50	20	IDGD	
O=C(NNC(=O)[C@@H](c1ccccc1F)N1CCOCC1)c1nn(-c2ccccc2)cc1O	743292532	DTANGDBARNFSQF-HXUWFJFHSA-N	439.447	1.552	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NCc2ccnc(N3CCCC3)c2)cc1	743529828	XLKCMLVVGPIXBU-UHFFFAOYSA-N	432.506	1.621	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)NC2CCN(CCS(C)(=O)=O)CC2)c(Cl)c1	743603250	ZYMHLCVTFOYXSS-UHFFFAOYSA-N	431.946	1.493	50	20	IDGD	
CN1CCN(C)[C@H](CNC(=O)NNC(=O)Nc2ccc(Br)cc2Cl)C1	743606287	XNJWUQKXEADZKN-LLVKDONJSA-N	433.738	1.684	50	20	IDGD	
C[C@@H](C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1)N1CCc2ccccc21	744620894	QKGKBFHYRMADIU-INIZCTEOSA-N	430.530	1.602	50	20	IDGD	
COc1ccnc(NNC(=O)CNC(=O)[C@@H]2c3ccccc3C(=O)N2Cc2ccccc2)n1	745843803	UUKAROAVHKWCEH-FQEVSTJZSA-N	446.467	1.442	50	20	IDGD	
Cc1noc(C(F)(F)F)c1C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	746092267	HVERJWFOFXCQRT-UHFFFAOYSA-N	425.411	1.975	50	20	IDGD	
CCS(=O)(=O)c1ccc(N2CCC(NC(=O)NNc3nc(C)cc(OC)n3)CC2)cc1	746756039	ULMFQMDKMHOUNU-UHFFFAOYSA-N	448.549	1.882	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)n1	747125074	TWJZXFJYIAYRBA-UHFFFAOYSA-N	446.363	1.925	50	20	IDGD	
O=C(NCc1ccc(C(=O)N2CCOCC2)cc1)NNC(=O)c1cccc2cccnc12	747463283	BZAZLZRRVORPGM-UHFFFAOYSA-N	433.468	1.851	50	20	IDGD	
CN(CCNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)Cc1ccc(F)cc1	748978161	XADXUOPMGZCTIG-UHFFFAOYSA-N	429.500	1.295	50	20	IDGD	
Cc1nccn1C[C@@H](C)CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	749196033	JTJKCXJFSJFZQY-HNNXBMFYSA-N	448.549	1.256	50	20	IDGD	
COC(=O)c1ccc(N2CCN(CC(=O)NNC(=O)c3ccc(F)cc3)[C@@H](C)C2)cc1	749914709	NFXVGVGHCAGYOJ-HNNXBMFYSA-N	428.464	1.584	50	20	IDGD	
Cc1ccc(CNC(=O)NNC(=O)CNC(=O)c2cccs2)c(N2CCOCC2)c1	753895003	OJUQMKDJEBVYJV-UHFFFAOYSA-N	431.518	1.154	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)c(Br)n1	755412325	YJZKXGAYPDQWCM-UHFFFAOYSA-N	426.296	1.520	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3ccc(O)c([N+](=O)[O-])c3)CC2)cc1	755517642	QAAZOIGTAVOPFP-UHFFFAOYSA-N	427.461	1.188	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)Nc2ccc(N3CCNC(=O)C3)c(Cl)c2)cc1	755937698	LGXSSPMJWVHLDA-UHFFFAOYSA-N	431.880	1.816	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)cc1	756204537	CFRMHKISOVWHBM-UHFFFAOYSA-N	443.485	1.025	50	20	IDGD	
CC[C@@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)[C@@H]1CCCO1	756736219	DFCIXMJUHROHAG-MSOLQXFVSA-N	438.550	1.763	50	20	IDGD	
CCOC(=O)[C@H](C)NC(=O)c1ccc(NC(=O)NNC(=O)Cn2nc(C)cc2C)cc1F	756818838	PYXIALFKWJEXOR-ZDUSSCGKSA-N	448.455	1.173	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)Nc1cccn(CC(F)(F)F)c1=O	757659466	YZJJDHVICCTGQT-UHFFFAOYSA-N	439.398	1.270	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2cnc(OC)c(C(N)=O)c2)cc1Br	757691170	DAORFOLJYCTQGQ-UHFFFAOYSA-N	438.238	1.427	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2nnc(CC(F)(F)F)s2)c2ccccc2c1=O	757719799	FWXVHHNKMMKBAX-UHFFFAOYSA-N	441.395	1.839	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)c2cccnc2I)nc2ccccc21	757720025	ITAUGRAGTIZDNM-UHFFFAOYSA-N	435.225	1.577	50	20	IDGD	
CCc1ccc(S(C)(=O)=O)cc1C(=O)OCC(=O)NNC(=O)c1cccc(Cl)c1	758942441	ZXIZDWSJVYKZOS-UHFFFAOYSA-N	438.889	1.924	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)NC[C@@H]1CSCCN1Cc1ccccc1	759204236	WONJBWJCWYLNGY-MRXNPFEDSA-N	437.566	1.459	50	20	IDGD	
CCCn1nc(C)c(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1C	759679595	UAJVSEJIKOIYBX-UHFFFAOYSA-N	433.534	1.769	50	20	IDGD	
CCc1nc(COc2ccc(C(=O)NNc3nccc(N4CCOCC4)n3)cc2)no1	762862604	WUSBQXIMIGEKQP-UHFFFAOYSA-N	425.449	1.595	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(C(=O)N2CCCC2)c(F)c1)c1ccc(Cl)nc1	763420404	IKPWKDXJTSXMGY-UHFFFAOYSA-N	426.857	1.733	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)N[C@@H]1CCN(c2ccc(Cl)c(F)c2)C1	763461391	YIMHBEXFISWPPC-CYBMUJFWSA-N	444.858	1.678	50	20	IDGD	
O=C(NNC(=O)c1ccccc1Br)C(=O)Nc1ncn(Cc2ccccc2)n1	763482636	IUHBFSKMCQJNGA-UHFFFAOYSA-N	443.261	1.489	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)C(=O)Nc2ccc3c(c2)OCC(=O)N3)c1	763597533	OSMBTORKZPLMEC-UHFFFAOYSA-N	440.456	1.614	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cnn(-c2ccccc2Cl)c1	763663840	ONOWCOJZQVRTCG-UHFFFAOYSA-N	443.847	1.699	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc2oc(N(C)C)nc2c1	763712413	GTMHVEKQHGSRMO-UHFFFAOYSA-N	425.445	1.621	50	20	IDGD	
O=C(CC12CC3CC(CC(C3)C1)C2)NNC(=O)C(=O)Nc1cc(-n2cnnn2)ccc1F	763735954	PIRVWEFTFJAJDQ-UHFFFAOYSA-N	441.467	1.494	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cccc(Cl)c2)cc1	763748131	NDJDETVLMZNODE-UHFFFAOYSA-N	438.893	1.426	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)C(=O)Nc2cccc(NC(=O)c3ccncc3)c2)c1	763757069	AHAHZXUXGKERMP-UHFFFAOYSA-N	446.467	1.800	50	20	IDGD	
Cc1ccc(C(N)=O)cc1NC(=O)C(=O)NNC(=O)c1ccc(OCCC(C)C)cc1	763766679	BVHQNWZNQMACHY-UHFFFAOYSA-N	426.473	1.919	50	20	IDGD	
Cc1c(Cl)cc(F)c(NC(=O)C(=O)NNC(=O)c2nnc(O)c3ccccc23)c1F	763791801	XAHRVUUAEFYQFJ-UHFFFAOYSA-N	435.774	1.975	50	20	IDGD	
CC(C)OCc1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])cc1	763804996	QGWMIAJWCWTDFW-UHFFFAOYSA-N	430.417	1.685	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccnn2Cc2ccccc2F)cc1	763810881	DGVKEBYZSUXAFO-UHFFFAOYSA-N	425.420	1.544	50	20	IDGD	
COc1ccc(CN(C)C)cc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1cccc(C)c1C	763841767	SYAXAGFCCLASGE-INIZCTEOSA-N	442.516	1.927	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccccc2C[S@](C)=O)c1C	763851896	GAWHTLFFQAHORA-JGVYIQDASA-N	431.514	1.735	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccc(OCC3CCOCC3)cc2)n1	763883357	ZZQFWHCTYODMBZ-UHFFFAOYSA-N	429.477	1.091	50	20	IDGD	
COC(=O)c1cc(C)ccc1NC(=O)C(=O)NNC(=O)c1ccc(OC(C)C)c(OC)c1	763915694	DZCGURCDTXFTQZ-UHFFFAOYSA-N	443.456	1.977	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3ccccc3Cn3cncn3)cc2C1	763943058	QEZGMYUFMWDXBH-CYBMUJFWSA-N	438.513	1.912	50	20	IDGD	
CO[C@H](C)C(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)c1	763974152	LVPVEOQLUYYTES-SNVBAGLBSA-N	434.836	1.419	50	20	IDGD	
CN1CC(=O)N(c2cccc(NC(=O)C(=O)NNC(=O)c3ccc4ccccc4c3)c2)C1=O	764066541	JHTKSLAXDCYJSQ-UHFFFAOYSA-N	445.435	1.638	50	20	IDGD	
CC[C@@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(Cl)c(S(=O)(=O)N2CCCC2)c1	764081995	AAQFBJVRJCRWCV-LLVKDONJSA-N	430.914	1.257	50	20	IDGD	
C[C@H](c1cccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)nc2)c1)N1CCOCC1	764091326	BIAWTKGJJZARHD-CYBMUJFWSA-N	431.880	1.528	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccnn3Cc3ccc(C)o3)n[nH]2)cc1	764109861	CJNUFPIWQCCQNI-UHFFFAOYSA-N	447.455	1.931	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cnn(-c4ccccc4)c3)n[nH]2)cc1	764109913	DJTVPHPGZYPHSG-UHFFFAOYSA-N	429.440	1.971	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2O1)C(=O)Nc1cc(F)ccc1OCC(F)(F)F	764151933	AQSPZWDGXGAQNP-OAHLLOKOSA-N	441.337	1.856	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)CCC(C)C)c(C(=O)N2CCCCC2)cc1OC	764203448	SJFXIXSKUNBTSN-UHFFFAOYSA-N	448.520	1.852	50	20	IDGD	
O=C(NNC(=O)c1c(Cl)cccc1Cl)C(=O)Nc1cccnc1N1CCOCC1	764221743	YCFGTPIKGBFNHC-UHFFFAOYSA-N	438.271	1.625	50	20	IDGD	
Cc1cccc(-n2c(NNC(=O)[C@@H]3CN4CCCN3CC4)nc3ccccc3c2=O)c1C	764237787	ORNZFNNJKLDQKX-NRFANRHFSA-N	432.528	1.836	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)Cc2cccnc2)ccc1NC(=O)OC(C)(C)C	764267662	IOXBDYMYABZOOC-UHFFFAOYSA-N	443.460	1.766	50	20	IDGD	
CN(C(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)Cc2cccnc2)cc1)c1ccccc1	764268500	VSSYXPQCUPQGET-UHFFFAOYSA-N	445.479	1.616	50	20	IDGD	
Cc1ccc(Cn2cccc(NC(=O)C(=O)NNC(=O)Cc3ccccc3F)c2=O)cc1	764312974	FVFCAOKNSKUPNX-UHFFFAOYSA-N	436.443	1.673	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)c2ccc(CN3C(=O)CNC3=O)cc2)n[nH]1	765593171	TUHVXXCGEWPKJM-UHFFFAOYSA-N	448.439	1.212	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)c2cccc(NS(C)(=O)=O)c2)n[nH]1	765601242	JLPVILFIWGTHHM-UHFFFAOYSA-N	429.458	1.532	50	20	IDGD	
CSCc1ccc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cc1	765732593	JFLYXUDOHZWCHK-UHFFFAOYSA-N	426.542	1.769	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1cc(Cl)cc([N+](=O)[O-])c1	765733717	QRLFNYKQCVIQPC-UHFFFAOYSA-N	445.863	1.467	50	20	IDGD	
CSc1cc(C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)ccc1F	766319952	LIPXOJIAPWBRPL-UHFFFAOYSA-N	425.507	1.938	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)CSc3ccc(O)cc3)CC2)cc1	766640444	GHQHYOPDTXESNQ-UHFFFAOYSA-N	428.558	1.758	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)c2cccc([C@@]3(C)NC(=O)NC3=O)c2)cc1	768915093	XSJOHEZKHIPXIT-MCMMXHMISA-N	440.456	1.368	50	20	IDGD	
CN1C(=O)C[C@@H](NC(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)[C@H]1c1ccc(Cl)cc1	768985791	DHRROPAITBCRMD-RHSMWYFYSA-N	447.835	1.870	50	20	IDGD	
CCOC(=O)c1nn(C)cc1C=NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	769764368	YIONNDAXDXRVKE-UHFFFAOYSA-N	447.517	1.535	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)c2cc(Br)cc([N+](=O)[O-])c2)cc1	770156460	OIRFDOUYJBRICE-UHFFFAOYSA-N	447.201	1.847	50	20	IDGD	
Cc1cccc(F)c1NNC(=O)C(=O)Nc1cnn(-c2ccccc2S(C)(=O)=O)c1	770819745	WVNYKHINOOGACQ-UHFFFAOYSA-N	431.449	1.805	50	20	IDGD	
O=C(CCC(=O)N1CCN(c2ncccn2)CC1)NNc1ccnc(Br)c1	771552923	YYZYMOYIZGCFGA-UHFFFAOYSA-N	434.298	1.206	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)C1CCN(S(=O)(=O)/C=C/c2ccccc2)CC1	771930769	BUNVOQUZRTUIHC-GOFCXVBSSA-N	437.518	1.188	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)[C@@H](C(C)C)N2CCCS2(=O)=O)c1	772631059	PISCKOAXLQMOBJ-LJQANCHMSA-N	425.551	1.705	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)C(=O)Nc2cc(C)cc(C)n2)c2ccccc2c1=O	773524508	JLIURPJFAJXWOK-UHFFFAOYSA-N	436.472	1.608	50	20	IDGD	
Cc1ccc(S(=O)(=O)C[C@@H](C)NC(=O)NNC(=O)Cc2nc3ccccc3n2C)cc1	776196913	WBMSEDOWWIZRKQ-OAHLLOKOSA-N	443.529	1.617	50	20	IDGD	
Cn1c(O)nc2ncc(-c3cccc(C(=O)OCC(=O)NNC(=O)c4ccccc4)c3)cc21	776472894	LICMEHJXQJUKHQ-UHFFFAOYSA-N	445.435	1.959	50	20	IDGD	
O=C(NCC(=O)N1CCOCC1)NNC(=O)c1cc(-c2ccccc2)nc2ccccc12	776637404	SHGWYYCGMDPCCF-UHFFFAOYSA-N	433.468	1.705	50	20	IDGD	
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	779390847	YJPUHQJFNLVNBB-GFCCVEGCSA-N	443.526	1.729	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)[C@@H](O)[C@@H](O)c2nc3ccccc3s2)o1	779500855	SIRAMJFWLYJCMI-DLBZAZTESA-N	432.502	1.587	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@H](C(=O)NNc2cccc(Br)c2)[C@H](C)O)cc1	779535802	FKYFRNMKGZKAIK-LRDDRELGSA-N	442.335	1.929	50	20	IDGD	
CCOC(=O)COc1c(Br)cc(C)cc1C=NNC(=O)NCC(=O)OC	781595363	PMTCTSDTSIRYLB-UHFFFAOYSA-N	430.255	1.506	50	20	IDGD	
O=C(COC(=O)c1cccc(NS(=O)(=O)C(F)(F)F)c1)NNC(=O)c1ccccc1	782427606	UIYBJLRUGNLJEI-UHFFFAOYSA-N	445.375	1.566	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NCc1cccc(S(=O)(=O)N(C)C)c1	782764331	WOAVKDIJRXOISP-ZDUSSCGKSA-N	438.481	1.374	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2cccc(CS(=O)(=O)c3ccccc3)c2)ncn1	783944843	RAZGYSSUGBMYHC-UHFFFAOYSA-N	425.470	1.841	50	20	IDGD	
CCOC(=O)/C=C\c1ccc(NC(=O)C(=O)NNc2cccc(S(C)(=O)=O)c2)cc1	784839304	JFWMIJYXNPEERC-XFXZXTDPSA-N	431.470	1.748	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)C(=O)Nc2cc(OC)c(OC)cc2C(=O)OC)c1	784853400	GPCOJPLITJZFDO-UHFFFAOYSA-N	431.401	1.359	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)C(=O)Nc2ccc(C)c(C(=O)N3CCOCC3)c2)c1	787541387	VMCFYRUCKMZZCN-UHFFFAOYSA-N	440.456	1.336	50	20	IDGD	
CN(NS(=O)(=O)c1ccc(C#N)cc1F)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	788915306	JGFDEAIMHZGRET-UHFFFAOYSA-N	441.485	1.495	50	20	IDGD	
O=C(c1ccc(O[C@@H]2CCOC2)cc1)N1CCN(S(=O)(=O)CBr)CC1	790013790	KAZHUXYZUMBGGZ-OAHLLOKOSA-N	433.324	1.294	50	20	IDGD	
O=C(CCOCC(F)F)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	790113860	MCKYORNPWRIPGR-UHFFFAOYSA-N	441.456	1.598	50	20	IDGD	
C[C@]12CCN(C(=O)NNC(=O)c3csc(N4CCOCC4)n3)C[C@@H]1C2(Cl)Cl	790655277	HGAFEQCXMFOXOB-NHYWBVRUSA-N	434.349	1.850	50	20	IDGD	
C[C@@H]1CCC2=S=C(C(=O)NNC(=O)C(=O)Nc3cc([C@@H]4CCCOC4)nn3C)C=C2C1	790951573	JHZOWXGYNDBZCG-CHWSQXEVSA-N	445.545	1.238	50	20	IDGD	
CC(=O)N1CCCN(c2ccc(F)cc2NC(=O)C(=O)NNc2ncccc2C)CC1	790964325	SOPGQQKSMUDFAC-UHFFFAOYSA-N	428.468	1.670	50	20	IDGD	
O=C(NNc1nc2ccccn2n1)C(=O)Nc1ccc2c(ccn2CCN2CCOCC2)c1	792392028	ORQDGUUISNZCBY-UHFFFAOYSA-N	448.487	1.098	50	20	IDGD	
O=C(NNc1cc(Cl)cc(Cl)c1)C(=O)Nc1cnn(CC(=O)N2CCOCC2)c1	792437489	FWFQYZIHQFYBRT-UHFFFAOYSA-N	441.275	1.131	50	20	IDGD	
COc1c(NC(=O)C(=O)NNC(=O)c2ccccc2O)cc(Cl)cc1C(=O)N(C)C	793023770	VZTIXAIKDFRZNZ-UHFFFAOYSA-N	434.836	1.156	50	20	IDGD	
O=C(NNS(=O)(=O)C[C@@H]1CCCOC1)[C@@H]1Cc2ccccc2CN1Cc1ccccc1	795305314	MBFDIWGZQOSSRR-KNQAVFIVSA-N	443.569	1.991	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)c2ccc(C#N)cc2)(n2cccn2)CC1	795841837	DJUDLEVLPZVSOP-UHFFFAOYSA-N	438.488	1.942	50	20	IDGD	
Cn1cc(-c2cc(F)ccc2NC(=O)C(=O)NNC(=O)COc2ccccc2F)cn1	796992067	LNAPJPGFWZMAPI-UHFFFAOYSA-N	429.383	1.530	50	20	IDGD	
CSc1cccc(NC(=O)C(=O)NNC(=O)CNC(=O)OCc2ccccc2)c1C	797368581	DTCWXPILUPNAMY-UHFFFAOYSA-N	430.486	1.729	50	20	IDGD	
O=C(NNc1nc2ccccn2n1)C(=O)Nc1ccc(Cl)c(CN2CCOCC2)c1	797540257	VTIKRWUJEONROG-UHFFFAOYSA-N	429.868	1.297	50	20	IDGD	
C[C@H](c1ccccc1)N(C)C(=O)CN(C)CC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	800500286	QAXKUIQBEZDEQG-OAHLLOKOSA-N	427.461	1.507	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)N[C@@H]1CCCN(C(=O)Cc2ccccc2)C1	800983831	VZAVKPNKBDVBJM-OAHLLOKOSA-N	448.321	1.955	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)S(=O)(=O)N(C1CC1)C2=O)Nc1ccc2c(c1)OCO2	802105131	PSGGYZGSYYDYNX-UHFFFAOYSA-N	444.425	1.189	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(OC(F)F)nc2)cc1	802566212	DVYMPDCQLFRPGF-NSHDSACASA-N	438.387	1.635	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)[C@@H]2CCN(c3ccc(C#N)cc3F)C2)n1	805591412	SSSCPKAGSVICIM-CQSZACIVSA-N	445.476	1.222	50	20	IDGD	
O=C1COC[C@H](C[C@H]2CN(C(=O)C(=O)NNc3ccc(F)c(F)c3F)c3ccccc32)N1	806968042	VDHLHWOJACPDKY-RYUDHWBXSA-N	448.401	1.583	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)cc2[nH]ccc12	808934724	SJZZCLRBAKPVCT-LLVKDONJSA-N	442.403	1.647	50	20	IDGD	
COc1ccc(Sc2nsc(NC(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)n2)cc1	809922309	CYMYMQPTBANZJN-VIFPVBQESA-N	443.532	1.285	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CNS(=O)(=O)c2ccc(Cl)c(C(F)(F)F)c2)o1	810489982	NBUVFFGSUSHIGK-UHFFFAOYSA-N	439.799	2.000	50	20	IDGD	
C[C@@H]1CN(C(=O)NNC(=O)c2ccc(Br)cc2Cl)C[C@@H](C)S1(=O)=O	811875105	SMSFQEJWVUMQDQ-RKDXNWHRSA-N	438.731	1.964	50	20	IDGD	
C[C@@H]1Oc2ccccc2N(CC(=O)NNC(=O)COc2ccc(Br)cc2)C1=O	811878219	JIDVABLPHBQBSC-LBPRGKRZSA-N	448.273	1.789	50	20	IDGD	
CCCc1nnc(SCC(=O)NNC(=O)c2ccc(OC)c(Br)c2)n1N	813450364	QSMRXWAFBABOFC-UHFFFAOYSA-N	443.327	1.269	50	20	IDGD	
COc1ccc(-c2nnc(SCC(=O)NNC(=O)c3cccc(Cl)c3)n2N)cc1	813837752	VOCHOOFVHILTGY-UHFFFAOYSA-N	432.893	1.874	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)c1ccn(-c2ccc(Br)cc2)n1	814317541	UXXWOAWAQZNDSK-UHFFFAOYSA-N	443.261	1.221	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)C[C@H]2CCCS(=O)(=O)C2)cc(OCC)c1OCC	814715495	YPBLSXKBEXQYIO-CQSZACIVSA-N	442.534	1.859	50	20	IDGD	
CCOc1nc2ccc(C(=O)OCC(=O)NNC(=O)[C@@H]3COc4ccccc4O3)cc2[nH]1	815441992	RAYILIJBBLWXHO-KRWDZBQOSA-N	440.412	1.106	50	20	IDGD	
COCCOc1ccc(Br)cc1NC(=O)C(=O)NNc1ncncc1F	815765395	PCHWONKRXXVAAG-UHFFFAOYSA-N	428.218	1.485	50	20	IDGD	
Cc1nccc(CCC(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)n1	815827481	BGNGJNLKVRMUQK-UHFFFAOYSA-N	430.940	1.336	50	20	IDGD	
CCn1c(NNC(=O)CN2C(=O)N[C@](C)(c3ccccc3)C2=O)nc2ccccc2c1=O	823892816	JPKQBWQNFJLKCC-JOCHJYFZSA-N	434.456	1.327	50	20	IDGD	
O=C(COC(=O)c1cccc(OC[C@H]2CCCO2)c1)NNC(=O)c1ccc([N+](=O)[O-])cc1	844474056	PJFXGJLFUZXLOO-GOSISDBHSA-N	443.412	1.771	50	20	IDGD	
CC(C)C[C@H](C(=O)NNC(=O)COc1ccccc1F)N1C(=O)[C@H]2CC=CC[C@H]2C1=O	864020688	RQHPSVGFFXRUHB-HLLBOEOZSA-N	431.464	1.718	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)CSCC(=O)N1CCCCC1	871019706	DELSZCHQQRCEKO-UHFFFAOYSA-N	444.351	1.721	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-])c1csc(N2CCOCC2)n1	912980661	ZIODAOITLPJQJP-UHFFFAOYSA-N	447.882	1.165	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)CSCc2cc(=O)n3ccsc3n2)cc1	913253176	YLOABVFFCHCDET-UHFFFAOYSA-N	446.510	1.302	50	20	IDGD	
C[C@@]12CCC(=O)N1c1ccccc1C(=O)N2CC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	913553274	PDUIGDHPVRXTNB-NRFANRHFSA-N	437.412	1.355	50	20	IDGD	
COC(=O)c1ccc(Cl)c(S(=O)(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1	914564467	IIECWNMTKNFGOE-CQSZACIVSA-N	426.834	1.276	50	20	IDGD	
COc1ccnc(NNC(=O)[C@H](CCSC)NS(=O)(=O)/C=C\c2ccccc2)n1	914763184	WYWMDMJAJKRLOA-WVUXNXBLSA-N	437.547	1.640	50	20	IDGD	
CCOc1ccccc1C(=O)N1CCC[C@H]1C(=O)NNC(=O)[C@H]1COc2ccccc2O1	914774743	IOAYOMHWHQMTJM-OXJNMPFZSA-N	439.468	1.677	50	20	IDGD	
CCN1CCN(S(=O)(=O)c2ccc(Cl)c(C(=O)NNC(=O)C3CCCC3)c2)CC1	914845009	JTRKMNJSDXEGBB-UHFFFAOYSA-N	442.969	1.617	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)Cc2cc3ccccc3nc2O)ccc1Cl	916133478	RGFNJEVJGHNLDW-UHFFFAOYSA-N	434.861	1.245	50	20	IDGD	
COc1cc(CCNC(=O)NNC(=O)c2ccc3c(c2)OCCO3)c([N+](=O)[O-])cc1OC	916219082	LIGISBOHQQXDOG-UHFFFAOYSA-N	446.416	1.570	50	20	IDGD	
COc1cc(C=NNC(=O)CCN2CCCCCC2)ccc1OCC(=O)N1CCOCC1	916358342	ODQAYRKNZFZOCU-UHFFFAOYSA-N	446.548	1.649	50	20	IDGD	
CC(=O)Nc1cccc(CNC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)c1	916373808	VFISPULPUNBQCQ-UHFFFAOYSA-N	447.517	1.105	50	20	IDGD	
COc1cccc(CCNC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1	916382059	LNOSRQGGOIJORZ-UHFFFAOYSA-N	446.529	1.666	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)N3CCN(c4ccc(C(N)=O)cn4)CC3)cc2C1	916519881	ZOCLYNVUERIPJO-ZDUSSCGKSA-N	442.545	1.543	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)CNC(=O)c1ccc(Br)s1	916727836	OKMPUZOQSMIIEO-SECBINFHSA-N	444.282	1.994	50	20	IDGD	
Cn1nc(SCC(=O)NN=Cc2ccc(F)c(-c3cccs3)c2)c(=O)n(C)c1=O	917544903	NYLZJDMVMMZHCJ-UHFFFAOYSA-N	433.490	1.589	50	20	IDGD	
NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NNC(=O)Cc3c[nH]c4ccccc34)cc2)C1	918117969	LVIQDLSLBKQRHN-KRWDZBQOSA-N	448.527	1.943	50	20	IDGD	
O=C(NNC(=O)c1cccc(-n2nccc2-c2ccccc2)c1)N[C@@H]1CCS(=O)(=O)C1	920293570	RSARXLYSNIHLMC-QGZVFWFLSA-N	439.497	1.670	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)NCc2cnn(C)c2)cc1	920852375	WUIAVYAXWRASPV-RQZCQDPDSA-N	433.472	1.391	50	20	IDGD	
COCCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2cccs2)c1	920862590	ZXXKRIMXMGOBKM-UHFFFAOYSA-N	426.520	1.207	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)nc2)c2ccccc2c1=O	920930241	GOBBCPGSWRDTQS-UHFFFAOYSA-N	444.473	1.242	50	20	IDGD	
C[C@@H]1CN(Cc2csc(NC(=O)NNC(=O)COc3ccccc3C#N)n2)C[C@@H](C)O1	920930691	TYAVKOQMUVJXCU-ZIAGYGMSSA-N	444.517	1.856	50	20	IDGD	
O=C(Cc1csc(NC(=O)Cc2cccs2)n1)NNC(=O)c1n[nH]c2c1CCCC2	1317864040	NQOOAPMMMPPLTQ-UHFFFAOYSA-N	444.542	1.991	50	20	IDGD	
CN(CC(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1)Cc1ccccc1	1319780207	SZOVSXZUDGGDES-UHFFFAOYSA-N	443.979	1.737	50	20	IDGD	
CNS(=O)(=O)c1ccc(CC(=O)NNC(=O)COc2cc(C)ccc2C(C)C)cc1	1320154620	PEHVGVONKYXLLN-UHFFFAOYSA-N	433.530	1.795	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cccc4c3OCCO4)C2)C1	1777839930	IREBDXNXGKMGEQ-BFUOFWGJSA-N	439.306	1.685	50	20	IDGD	
Cc1cc(NC(=O)CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](F)Cl)C2)no1	1778026025	KHJHEJSXBCUVKU-XHBKTUGNSA-N	430.864	1.360	50	20	IDGD	
Cn1cnc(C(=O)N2CCO[C@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)c1C(F)(F)F	1779295340	JIQCCMKNQVNYGY-KRWDZBQOSA-N	448.518	1.734	50	20	IDGD	
Cc1ccn2ncc(C(=O)N3CCO[C@@]4(CCN(C(=O)CO[Si](C)(C)C)C4)C3)c2c1	1779295900	XZLTWDRJAZPXSU-OAQYLSRUSA-N	430.581	1.938	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)n2ccccc2=O)C1	1779530887	JPHNDTGNCIIMRS-BIZBXSGISA-N	439.940	1.177	50	20	IDGD	
COc1ccnc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)c1	1779535101	NGMILNKEWSJFAK-UGSOOPFHSA-N	426.311	1.565	50	20	IDGD	
O=C(c1cnc(-c2ccccc2)s1)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1779750285	IJHGOUDLLFAZNK-QRWLVFNGSA-N	435.933	1.853	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](C)S)CCO2	1780098496	MWISULIDCHOEHN-HXPMCKFVSA-N	437.474	1.282	50	20	IDGD	
CN(C)c1ncc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](F)Br)C2)o1	1780771275	YWCNVHNFGPHTLR-IIYDPXPESA-N	447.305	1.559	50	20	IDGD	
COc1ccc(CC(=O)N2CC[C@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)c(C#N)c1	1781173946	YJFRTHXLNOJGGN-JOCHJYFZSA-N	445.592	1.791	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)Cn3c(=O)n(C)c4ccccc43)CCO2)C1	1781219370	OQCOLUXTYSOJIA-YCRPNKLZSA-N	434.924	1.187	50	20	IDGD	
NC(=O)c1ccccc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C(Cl)Cl)C1	1782219374	YFNFIUVQOVFDPM-AUUYWEPGSA-N	428.316	1.717	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(CCN(C(=O)c3cnn4cccc(F)c34)C2)C1	1782550793	DPMHDNOLYUAEGZ-HXUWFJFHSA-N	434.544	1.768	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cc4ncccn4n3)CCO2)C1	1783349096	HESREVRSRUNPRP-SCLBCKFNSA-N	436.310	1.346	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)CN(C)C(=O)OC(C)(C)C)CCO2)C1	1783532126	DLUXDNRFBUOXPI-FZKQIMNGSA-N	448.358	1.467	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](C)n1cccc1C=O)CCO2	1783532817	NPOKAVXKNIJADF-IYOUNJFTSA-N	426.311	1.475	50	20	IDGD	
Cc1ccc(CC(=O)N2CCO[C@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc1C	1783933369	IWXLKOROQBZRFQ-QHCPKHFHSA-N	430.549	1.049	50	20	IDGD	
Cc1ccc(C)c(CC(=O)N2CCO[C@@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)c1	1783936174	FEOWYGZKUZFUCT-HSZRJFAPSA-N	430.549	1.049	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)C#CC3(O)CCCCC3)C[C@@H]21	1786406339	OCMGPEFQZCUGML-ULQDDVLXSA-N	441.366	1.450	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)Nc3cccnc3)[C@H]2C1	1786866459	WXEYZPFMGFTQRV-JBJRXJHCSA-N	439.354	1.645	50	20	IDGD	
O=C1CC(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]3C2)=Cc2ccccc2N1	1787448207	YDKSBTAYBPXYFJ-CJCBUOBESA-N	435.883	1.926	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4nonc4c3)[C@H]2C1	1787882781	WLADRDSMSSWRCN-SDPXSBNPSA-N	437.294	1.600	50	20	IDGD	
Cn1c(=O)n(C)c2cc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)[C@H](F)Cl)C[C@@H]43)ccc21	1787959827	MHLGZRHVWBWWJX-PYTWLRIVSA-N	438.887	1.005	50	20	IDGD	
O=C(Cc1cscn1)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1	1788140812	ZUDODUNHXITGNJ-UHFFFAOYSA-N	435.314	1.813	50	20	IDGD	
C[C@H](Oc1cccnc1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]2C1	1788766230	XYUHHIZPOOZBRO-CAMMJAKZSA-N	435.597	1.680	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CCN3C(=O)OC(C)(C)C)C[C@@H]21	1789857899	KQJLJKLJUFNFFZ-KSWRQPAISA-N	443.972	1.993	50	20	IDGD	
Cn1ncc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]3C2)c1Cl	1789924787	WSQBFOZSBAPIOC-PDEGPIFNSA-N	437.697	1.357	50	20	IDGD	
C[C@@H](C(=O)Nc1ccc(C2(NC(=O)CCC(=O)NN(C)C)CCC2)cc1)n1ccnn1	1791105686	VSQFCOXFHYRUTR-HNNXBMFYSA-N	427.509	1.346	50	20	IDGD	
Cc1nccn1CC(=O)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1	1791106078	HAFHRFIFASOHTE-UHFFFAOYSA-N	432.289	1.319	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1ccc(C2(NC(=O)c3cc(CO)on3)CCC2)cc1	1791601200	UVGHGIJDUFKZCU-UHFFFAOYSA-N	429.477	1.288	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC1(c2ccc(NC(=O)[C@H]3CCCOC3)cc2)CCC1	1792295589	CEYRJSOGSXUZBS-HNNXBMFYSA-N	437.500	1.859	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cccc2ncccc12	1793327882	BNERTCFYBMMJMN-VWFIUDSGSA-N	431.920	1.621	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnn(C)c1C(F)(F)F	1794573981	DIEMQOJJVOJKCP-CLLJXQQHSA-N	444.458	1.064	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCBr)C1	1795116898	DSYRHTWMBPHHQQ-SVZOTFJBSA-N	445.354	1.340	50	20	IDGD	
CO[C@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnccc1C(=O)NN)C2)c1ccccc1	1795807474	DYRCYOWABYECMT-CLWJZODNSA-N	437.500	1.325	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)c1ccccc1	1795819341	UGRZMTFMFVIOKC-GBQRPGIHSA-N	437.500	1.492	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCN1CCN(C)CC1	1795882149	HYBYECNKOIABLA-NXOAAHMSSA-N	429.403	1.293	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(S(C)(=O)=O)c(F)c1)C2	1799271540	QWKMUIJICWEQHY-UMPJEAMMSA-N	446.928	1.450	50	20	IDGD	
CC(=O)N1CCN(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@](C)(Cl)CCl)CC1	1800082678	SZRQAUYKTZIGCL-RCJHGTSTSA-N	433.380	1.025	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccnc2c(O)cccc12	1800097424	PWVZBGQVWWBZEK-JRATXPSKSA-N	448.317	1.927	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cocn1)C2)[C@@H](Br)Cc1ccccc1	1800435503	IYJWUGQPSRBDNI-DFGXFYAUSA-N	448.317	1.884	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccnc3c1OCO3)C2	1800642010	QRJHVFYKVRROEV-XCCSTKFXSA-N	440.294	1.187	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](C)Cn1ccnc1	1802984938	NDAZEQYSRAAWSO-CZRLGECOSA-N	439.520	1.291	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cc3cccnn3n2)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803142184	XVMFPKCBLGLYTP-JCGIZDLHSA-N	428.880	1.044	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cccc3ccnn23)[C@@H]1c1cccnc1)[C@H](O)CCl	1803146484	BFGSIFAGJZYQLT-KFKAGJAMSA-N	427.892	1.649	50	20	IDGD	
O=C(/C=C/c1ccco1)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1804616859	ZUOMIGKZDCDLRN-APEGBLAYSA-N	445.284	1.387	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1cccs1	1805385218	SECKDMSBZCCDCF-FXAWDEMLSA-N	435.314	1.456	50	20	IDGD	
Cc1cc(C(N)=O)cc(C)c1C(=O)N1CCC2(CCCN(C(=O)[C@H](O)CCl)C2)CC1	1805523657	YBMKPHFHFVAUES-QGZVFWFLSA-N	435.952	1.847	50	20	IDGD	
COc1cccc(CC(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)c1	1806551803	HTHLYRARAFROMV-FBBABVLZSA-N	431.920	1.938	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)s1	1807363703	PPWPKVMVMBRKLD-RXVVDRJESA-N	449.341	1.765	50	20	IDGD	
O=C(c1ccc(F)c(F)c1)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1	1809978069	TXRIVSYKGSUMAD-UHFFFAOYSA-N	442.271	1.803	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)c2cccc(=O)n2O)[C@@H]1c1cccnc1	1812865688	RUAMJZOIEVFJAE-RVSPLBMKSA-N	449.305	1.584	50	20	IDGD	
CN(C)C(=O)NCC(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](F)Br)[nH]n1	1814564167	VWLUHASCGMLXKX-ZWNOBZJWSA-N	433.282	1.364	50	20	IDGD	
O=C(CN1CCOCC1)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](F)Br)CC2	1814569240	XJLMYBFJBHYTEQ-NOZJJQNGSA-N	435.319	1.078	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)CCN3CCOCC3)sc2C1	1814648169	CGKHYMZXSPGRKU-VXGBXAGGSA-N	445.383	1.561	50	20	IDGD	
N[C@@H](C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCBr)CC2)c1ccccn1	1815011783	HXWMHVVKQIHLIH-ZUZCIYMTSA-N	438.351	1.935	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)C2=NN(C)C(=O)CC2)n[nH]1	1815626266	XMSXLVGNZCHTCM-GXFFZTMASA-N	439.314	1.793	50	20	IDGD	
Cc1ncsc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1816492091	SPINKMBXFSFMGJ-MRXNPFEDSA-N	439.306	1.474	50	20	IDGD	
O=C(CCNC(=O)c1ccc[nH]1)N[C@@H]1CCc2nc(NC(=O)[C@H](F)Cl)sc2C1	1817116498	BLVAEQKABGIBRS-OTYXRUKQSA-N	427.889	1.738	50	20	IDGD	
Cc1ccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)cc1O	1817472628	PNXSQPNKQRLSJS-IBGZPJMESA-N	448.288	1.723	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2C[C@]2(F)Cl)[nH]n1)c1ccc(B(O)O)cc1	1817475750	RIDGBQUIYAHHFC-ZUEVXXBESA-N	434.664	1.320	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1)c1ncn(-c2ccccc2)n1	1818197987	UKQRKCXGVNOBNT-CVEARBPZSA-N	443.895	1.896	50	20	IDGD	
CC[C@H](NC(C)=O)C(=O)N[C@@H]1CCc2nc(NC(=O)CO[Si](C)(C)C)sc2C1	1820158420	LOPHLJXBJBKDEA-OLZOCXBDSA-N	426.615	1.821	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(=O)oc2)[nH]n1	1822412960	LRFIKGOANXKGAM-OAHLLOKOSA-N	430.465	1.042	50	20	IDGD	
C[C@H](C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@](C)(Cl)CCl)[nH]n1)n1cnnn1	1822860499	GZGJLAVMJJZSNA-SIVJFFJCSA-N	429.312	1.886	50	20	IDGD	
CC(C)[C@H](S)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1	1824537659	LTYDZJJWXAZEEL-UXHICEINSA-N	432.395	1.554	50	20	IDGD	
Cc1noc(C)c1C(=O)N[C@@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1	1826080344	CRIBIGLODYDTLY-GFCCVEGCSA-N	434.522	1.347	50	20	IDGD	
CCc1ccc(C(=O)N[C@@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)cn1	1826080775	XRZAXHJQKONCRV-OAHLLOKOSA-N	444.561	1.699	50	20	IDGD	
Cc1cnn([C@@H](C)C(=O)N[C@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)c1	1826092064	KKDYJRZNQUEEEL-KBPBESRZSA-N	447.565	1.194	50	20	IDGD	
O=C(C(Cl)Cl)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827054652	IFWPXMYXBJTBMW-MRXNPFEDSA-N	427.137	1.403	50	20	IDGD	
Cc1cnc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)cn1	1827055668	BVOMEEBQSKRCET-OAQYLSRUSA-N	436.321	1.012	50	20	IDGD	
C[C@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H](F)Cl)CC1)[C@H]1SC(=N)NC1=O	1827666593	BWRBPEQAANTPLY-ASEORRQLSA-N	432.949	1.943	50	20	IDGD	
Cn1cc(F)cc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1	1827943151	AHVRXNWJBCHROM-HXUWFJFHSA-N	441.312	1.391	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)[C@]3(C)CC3(F)F)sc2C1	1828054696	JGFAMHLILRGKOQ-BTDLBPIBSA-N	429.493	1.473	50	20	IDGD	
CCOc1ccsc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](Cl)COC)C2)C1	1829554105	GBEDKCWOVSVIAQ-IFXJQAMLSA-N	446.953	1.471	50	20	IDGD	
Cc1nn(C)c(C)c1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830354427	YPSGZVVOCAILGH-HXUWFJFHSA-N	426.945	1.372	50	20	IDGD	
O=C(CCc1c[nH]c2ccccc12)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1830722566	DGRGBAPGRBDIPQ-DENIHFKCSA-N	449.935	1.157	50	20	IDGD	
O=C(c1cccc2ccccc12)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1830728130	PTRCGTMGMRRHBW-KNQAVFIVSA-N	432.904	1.510	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3cnnn3C)CC2)CC1	1833901820	QSVUHYIRZTZIJC-OAHLLOKOSA-N	441.374	1.174	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCC(N2CCC(NC(=O)[C@H]3CCC(=O)N3)CC2)CC1	1834589555	GDYYGEJFWWFFGV-DNVCBOLYSA-N	433.380	1.073	50	20	IDGD	
C[C@H](Nc1cccnc1)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](F)Cl)CC2)CC1	1834719278	HTTXSIFRJWRZSM-KBXCAEBGSA-N	425.936	1.988	50	20	IDGD	
CC(C)NCCC(=O)NC1CCN(C2CCN(C(=O)CO[Si](C)(C)C)CC2)CC1	1834782395	LBACHFWJZUOAMY-UHFFFAOYSA-N	426.678	1.798	50	20	IDGD	
CCn1nc(C)cc1C(=O)N1CCOC[C@]2(CN(C(=O)CCBr)CCO2)C1	1834822606	XQMPXYPKXVYZBP-SFHVURJKSA-N	443.342	1.066	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)C(C)(C)F)CC2)CC1	1835118386	WTVRQROVYSBLBV-CVKSISIWSA-N	448.543	1.440	50	20	IDGD	
CC(=O)N(C)[C@@H](C)C(=O)N1CCC(N2CCC(NC(=O)CO[Si](C)(C)C)CC2)CC1	1835837790	VPSROVUUCGPXFI-INIZCTEOSA-N	440.661	1.276	50	20	IDGD	
Cc1cnn(CC(=O)N2CCC(N3CCC(NC(=O)[C@H](F)Br)CC3)CC2)c1	1836412768	TYYXMTRVQIGFPT-KRWDZBQOSA-N	444.349	1.454	50	20	IDGD	
CCc1nc(C(=O)N2CCOC[C@@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)co1	1837715206	CDBKDSQDRWDPQC-LJQANCHMSA-N	425.558	1.159	50	20	IDGD	
CO[C@H](C)C(=O)N1CCC(OC2CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CC2)CC1	1838103237	SAWVNVQQLCAXDT-DTVDJLOLSA-N	447.536	1.154	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](COC)NC(C)=O)CC2)CC1	1838435053	MNZHAHGEYAETTJ-QZTJIDSGSA-N	431.961	1.154	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)c3ccccc3)CC2)CC1	1838567239	XTFPBSYRHMFMSH-UHFFFAOYSA-N	430.549	1.672	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(C)c(F)c3)CCO2)C1	1838916523	XGGZTOMOMNZRJN-JXFKEZNVSA-N	428.888	1.458	50	20	IDGD	
CC(C)[C@H](S)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2	1839150637	RVKPOBPLKJXIIP-JQFCIGGWSA-N	427.394	1.634	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc4ccnn34)CCO2)C1	1839496959	LYDZYNNJAXOYQE-UTKZUKDTSA-N	434.924	1.812	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1[C@H]3C=CS[C@@H]31)CCO2	1839696548	ABHGEMINUHDDLK-NWGLXNPWSA-N	426.611	1.169	50	20	IDGD	
Cc1nc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)cs1	1840031222	JCOXYFJIFNZYCT-SJCJKPOMSA-N	446.367	1.234	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CCC[C@@H](C(=O)OC)C1)CCO2	1840147013	GASXJQZJHLEJRM-PZTGFMGMSA-N	444.956	1.440	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(C)c3F)C2)C1	1840149767	ZPIHIEFYNHTOMT-JXFKEZNVSA-N	428.888	1.458	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3scnc3C3CC3)C2)C1	1840151063	VPFRULCSHWOTSM-LIRRHRJNSA-N	443.953	1.344	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)C3(C(F)(F)F)CC3)C2)C1	1840153318	KCYUWTIQGMSISR-IUODEOHRSA-N	428.835	1.039	50	20	IDGD	
CO[C@H](C(=O)N1CCOC[C@]2(CN(C(=O)C(Cl)Cl)CCO2)C1)c1ccccc1	1840188029	KLUJPAHSUGDJGC-HNAYVOBHSA-N	431.316	1.634	50	20	IDGD	
COc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)cc1OC	1840188759	ALDUNYQBNPHSPB-IBGZPJMESA-N	447.315	1.578	50	20	IDGD	
O=C(c1cnn2cccc(F)c12)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840189847	ORIJDNVTGJKLQP-GOSISDBHSA-N	445.278	1.347	50	20	IDGD	
N#Cc1ccccc1OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840190273	NPXIWMNEJUTWKM-IBGZPJMESA-N	442.299	1.197	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H]2CC[C@@H](C2)[C@H]1C(=O)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1	1841353597	GQFLKWSQWHZSOZ-JONQDZQNSA-N	441.956	1.578	50	20	IDGD	
COc1ncc(C(=O)N2CC3(CCCN3C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)cc1F	1843415628	SXHMLVZHTARPOW-DHRITJCHSA-N	442.451	1.180	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)C2(C(F)(F)F)CC2)C1	1843945296	QKIUJUSOUBAGJA-WYMPLXKRSA-N	425.411	1.666	50	20	IDGD	
CN(CC(=O)N1CCCC12CN(C(=O)Cc1ccccc1)C2)NC(=O)NCc1ccccc1	1845038746	NONHGEIVGJVEMH-UHFFFAOYSA-N	449.555	1.779	50	20	IDGD	
CC(=O)NCCC(=O)N1CCCC12CN(C(=O)[C@H](Br)Cc1ccccc1)C2	1846009913	XWYFHVKLIYWZHX-QGZVFWFLSA-N	436.350	1.722	50	20	IDGD	
C#CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)[C@H](Cl)COC)C2	1847068928	IXPHXGQFBPXVLW-HUUCEWRRSA-N	427.929	1.360	50	20	IDGD	
NC(=O)NCC(=O)N1CCCC12CN(C(=O)CCCCCCCCBr)C2	1847108446	OVYHVOZGLBVUAQ-UHFFFAOYSA-N	431.375	1.984	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)C1(c2ccc(O)cc2)CC1	1847591091	JHNHLFDNABFNSN-BLXYJZHJSA-N	449.511	1.760	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)COc2ccc(OC)cc2)c1	3607193	APYHIHHKULUAQN-UHFFFAOYSA-N	435.502	1.566	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)c2ccc(CCNS(C)(=O)=O)s2)cc1C	17238491	SEACHFFHEIUBEZ-UHFFFAOYSA-N	425.532	1.297	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(/C#N)C(=O)N2CCN(CC(=O)N3CCCC3)CC2)c1C	105338575	PIMKSZIDODSFJS-MAGMUUGSSA-N	441.576	1.986	50	20	IDGD	
CCCCCCOc1ccc(C(=O)NNC(=O)C2=CC=CN3CCS(=O)(=O)N=C23)cc1	105502481	POGLCZKWSXCNGP-UHFFFAOYSA-N	446.529	1.904	50	20	IDGD	
N#Cc1ccc(N2CCN(CC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)CC2)c(F)c1	110301165	IGUQHMPWHHQXRK-UHFFFAOYSA-N	426.408	1.189	50	20	IDGD	
Cc1nn(Cc2ccccc2)c(C)c1CNC(=O)NNC(=O)CNC(=O)c1cccs1	726088245	VYMAIWWLURVWGL-UHFFFAOYSA-N	440.529	1.870	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NCC1(N2CCSCC2)CCCC1	726097843	OXRXKOJFENXCCC-UHFFFAOYSA-N	425.580	1.170	50	20	IDGD	
O=C(NCCCc1nnc2n1CCCCC2)NNC(=O)c1nn(-c2ccccc2)cc1O	727607976	XFWQIUHYHPWJKR-UHFFFAOYSA-N	438.492	1.473	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)CCc2nc(-c3ncccn3)no2)c2ccccc2c1=O	727706631	TZTYBTUIFGUXAC-UHFFFAOYSA-N	448.443	1.040	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)NCCCN2CCC[C@H]2C(=O)N(C)C)c1C	728072884	LCSGISNGKJHYGI-MEPUESOJSA-N	429.565	1.717	50	20	IDGD	
COc1ccc(C2(C(=O)OCC(=O)NNC(=O)[C@H]3COc4ccccc4O3)CCC2)cc1	728344921	SOVCAZDGKCMEAP-LJQANCHMSA-N	440.452	1.648	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)[C@H]1CCCN(C(=O)c2ccc3n[nH]cc3c2)C1	730032923	NGLTZZDSWSTZSH-KRWDZBQOSA-N	435.484	1.901	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)NCCOc2ccc(S(C)(=O)=O)cc2)cc1C	730066768	PDBPLIYGYOGDAA-UHFFFAOYSA-N	448.501	1.055	50	20	IDGD	
CSC[C@H](C(=O)NNC(=O)c1cccc2ncccc12)N1C(=O)[C@@H]2CCCC[C@H]2C1=O	730224932	FZUULKGYOQGGFM-JFIYKMOQSA-N	440.525	1.903	50	20	IDGD	
O=C(CC[C@@H]1NC(=O)N(c2ccc(Cl)cc2)C1=O)NNC(=O)c1ccc2c(c1)OCO2	730768672	FZCVHMZYJWKDGL-AWEZNQCLSA-N	444.831	1.735	50	20	IDGD	
C[C@H]1CCCN(S(=O)(=O)c2ccc(C(=O)NNC(=O)COc3ccccc3O)cc2)C1	730782602	RMAQSQUWUILYNH-HNNXBMFYSA-N	447.513	1.653	50	20	IDGD	
COc1cc(Cl)ccc1CNC(=O)NNC(=O)c1csc(N2CCOCC2)n1	730821584	QRXFSIUTMKYBQU-UHFFFAOYSA-N	425.898	1.786	50	20	IDGD	
O=C(NNc1nc(-c2ccncc2)no1)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1	732069180	WJOPWAFYPAWGRK-NSHDSACASA-N	429.418	1.849	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)cc1	732264335	QMDBHJCXEMMQLN-AWEZNQCLSA-N	447.473	1.529	50	20	IDGD	
Cc1ccc(CCNC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cn1	732472951	FPXKXKPCIRAVEO-UHFFFAOYSA-N	431.518	1.361	50	20	IDGD	
NC(=O)c1ccc(SCC(=O)NNC(=O)NCc2ccc(Cl)cc2)c([N+](=O)[O-])c1	733003724	IIMBXLLUMKVKQI-UHFFFAOYSA-N	437.865	1.970	50	20	IDGD	
O=C(NCCn1cccn1)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	734279499	QUDKGCTWHKHXIU-UHFFFAOYSA-N	434.503	1.390	50	20	IDGD	
COc1ccc(CN2CC[C@@H](NC(=O)NNC(=O)c3c(C)nc4ccccn34)C2=O)cc1	734515987	BWJGHBWSYHAIAK-QGZVFWFLSA-N	436.472	1.396	50	20	IDGD	
COc1ccc(S(=O)(=O)Nc2ccccc2C(=O)NNC(=O)c2cnn(C)c2)cc1	735473370	SYTYRBVVICTPPP-UHFFFAOYSA-N	429.458	1.304	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@H](Cc2ccccc2)n2nnnc2C)cc(OC)c1OC	735629881	CFEGPXKKBBRYOL-INIZCTEOSA-N	440.460	1.252	50	20	IDGD	
CC(C)NC(=O)C(=O)NNC(=O)c1ccn(-c2c(Cl)cc([N+](=O)[O-])cc2Cl)n1	736067560	SKDSMDNQIWWXQF-UHFFFAOYSA-N	429.220	1.373	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NN=C1C(=O)Nc2c(I)cccc21	740762444	RQNFCCQRMXJCCY-UHFFFAOYSA-N	428.230	1.368	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)c2ccc(CNC(=O)C(C)(C)C)cc2)c2ccccc2c1=O	741661088	SCGXSIFDMDDHLW-UHFFFAOYSA-N	435.484	1.671	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNS(=O)(=O)c3cccc(-c4nnnn4C)c3)cc2C1	742025411	GGYFDBGKQRSBSX-NSHDSACASA-N	432.531	1.687	50	20	IDGD	
CCCS(=O)(=O)N1CCCC[C@H]1C(=O)NNC(=O)c1cccc(Br)c1	742769787	SXHPDMQDIOCDMK-AWEZNQCLSA-N	432.340	1.804	50	20	IDGD	
CCO[C@H]1C[C@H](NC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)C12CCCC2	743510356	VRPAWUSVDBYBRL-GJZGRUSLSA-N	437.566	1.970	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)CCCOc2ccc(S(C)(=O)=O)cc2)c1	743607325	JKGOXIDSJGAJEB-UHFFFAOYSA-N	436.486	1.728	50	20	IDGD	
COCCCNC(=O)NNC(=O)c1ccc(S(=O)(=O)NCc2cccs2)cc1	743900892	MYTWNWVDVGLYFV-UHFFFAOYSA-N	426.520	1.207	50	20	IDGD	
CCN1CCN(C[C@@H](C)CNC(=O)NNC(=O)c2cccc(Br)c2)CC1	745861263	AWKMIFWDYRJUNP-AWEZNQCLSA-N	426.359	1.667	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCC2(CC)CCOCC2)c1	745934470	YNNYORDUPLFQBC-UHFFFAOYSA-N	440.566	1.868	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)NNC(=O)c1cc(S(=O)(=O)N2CCCC2)ccc1O	745990353	CNLCUHSCSAFJOL-UHFFFAOYSA-N	442.497	1.662	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)c1ccc(Cl)c(Cl)c1)C(=O)NNC(=O)N(C)C	746013110	UXFMDBIHIVAPDM-GFCCVEGCSA-N	443.378	1.696	50	20	IDGD	
CN(C)N(C(=O)CCCN1C(=O)c2cccc3cccc(c23)C1=O)[C@H]1CCS(=O)(=O)C1	746949224	ILENGDKSSZKPBT-INIZCTEOSA-N	443.525	1.708	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)/C(=C\C2=S=CC=C2)n2nnnc2-c2ccccc2)cc1	747176358	UODADAWJGCTHBD-CPNJWEJPSA-N	441.476	1.791	50	20	IDGD	
N#CCCn1cc(/C=C(\C#N)C(=O)NNC(=O)C(=O)N2CCCC2)c(-c2ccccc2)n1	748240910	LNKKUXUQBBWQKI-GHRIWEEISA-N	431.456	1.141	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)N[C@H]1CCN(c2ccc(C(F)(F)F)cc2)C1=O	748635886	SPIKHEDSPJYINQ-FZMZJTMJSA-N	432.399	1.193	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)N[C@H]1CCCSC1	748969398	ZWBZWBBFTIBJQN-HNNXBMFYSA-N	426.564	1.701	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)N2CCN(CCn3cncn3)CC2)c(C)n1C[C@@H]1CCCO1	749397655	QKYIQIJGSZCEMH-JFLYLQGUSA-N	437.548	1.627	50	20	IDGD	
CC[S@](=O)[C@H]1CCC[C@@H](NC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)C1	750267719	OKJMEEOENGYRAN-JFTGJMIGSA-N	443.595	1.312	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)[C@H]1CC(=O)N(c2cc(Cl)cc(Cl)c2)C1	751202810	JBFXFYPUWABLFG-JTQLQIEISA-N	439.255	1.517	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)c1ccc(-n2cc(Br)cn2)cc1	751209547	RPFJISBZINDHJI-UHFFFAOYSA-N	448.302	1.887	50	20	IDGD	
CC(=O)NC[C@@H]1CCn2ncc(C(=O)NNC(=O)c3cc(-c4cc(C)ccc4C)[nH]n3)c2C1	753258839	MUAWKOUQPNBFMK-MRXNPFEDSA-N	449.515	1.663	50	20	IDGD	
C[C@H](C[S@@](C)=O)NC(=O)NNc1ccc(S(=O)(=O)NC2CCCCCCC2)cn1	753358460	JUGWNQTVHIMNHB-GMYLUUGSSA-N	445.611	1.866	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)c1cccc(I)c1O	754833640	IJOIDVCNIAZOTD-CYBMUJFWSA-N	440.193	1.598	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NC(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1	755361209	VWHDQNYHQCBHBK-UHFFFAOYSA-N	448.501	1.955	50	20	IDGD	
N#CCc1ccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1	755537616	ZIPMWHPBAFPZIL-UHFFFAOYSA-N	443.485	1.240	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)Nc1cccc(S(=O)(=O)NC2CC2)c1	755586386	VVRHPBXCAMQGEL-UHFFFAOYSA-N	442.295	1.684	50	20	IDGD	
O=C(CN1CCOCC1)Nc1ccc(NC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1	755601300	ZROWUSOWVDZBGL-UHFFFAOYSA-N	442.432	1.332	50	20	IDGD	
COCCOc1cccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1	756009167	FXHVWCJLXDCAHK-UHFFFAOYSA-N	436.490	1.429	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)N2CCN(CC(=O)Nc3ccc(Cl)cc3)CC2)cc1	756064501	CGDDKANBPINDID-UHFFFAOYSA-N	440.891	1.822	50	20	IDGD	
CN(C1CC1)S(=O)(=O)c1ccc(NC(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1	756401602	IXVKKOWHOXEPPO-UHFFFAOYSA-N	446.485	1.707	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)Nc2ccc(C)c(S(N)(=O)=O)c2)cc1	756637859	JVSPIHUWIBVBSB-CYBMUJFWSA-N	434.474	1.465	50	20	IDGD	
COCCNC(=O)Cn1cc(NC(=O)NNC(=O)CC23CC4CC(CC(C4)C2)C3)cn1	756845846	WIEVAPDFPVOLEE-UHFFFAOYSA-N	432.525	1.405	50	20	IDGD	
CC(C)CN1CC[C@@H](CNC(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)C1	757291295	SOGBUKXAIDFWMK-INIZCTEOSA-N	428.537	1.899	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)ncn1	757759270	RSLJQHAYABJQEH-UHFFFAOYSA-N	445.439	1.710	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1	758024087	BGLJPFOREHCUSD-NSHDSACASA-N	436.877	1.703	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C2=NN(c3ccccc3)C(=O)[C@H](C)N2)n[nH]1	763156180	XCCTVINYNLUKAZ-ZDUSSCGKSA-N	447.455	1.185	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NN=C1CCOc2c1cc(Br)cc2[N+](=O)[O-]	763195351	NXTGGNHFRLYSIR-UHFFFAOYSA-N	448.233	1.785	50	20	IDGD	
O=C(NNC(=O)c1cccc(F)n1)c1cccc(S(=O)(=O)NCc2ccccc2)c1	763272016	AYYHUGKLKQAGGH-UHFFFAOYSA-N	428.445	1.774	50	20	IDGD	
CC(C)S(=O)(=O)c1ccccc1NC(=O)C(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	763465569	AJPGCHQSVSMUTK-UHFFFAOYSA-N	434.430	1.177	50	20	IDGD	
O=C(NNC(=O)c1ccccc1Br)C(=O)Nc1ccn(-c2ccncc2)n1	763484323	WUMRSNKDWGMRAK-UHFFFAOYSA-N	429.234	1.430	50	20	IDGD	
C[S@](=O)c1cccc(NC(=O)C(=O)NNC(=O)COc2ccc(C(C)(C)C)cc2)c1	763593256	AHZXZYLRQSKDPI-PMERELPUSA-N	431.514	1.886	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)COc2cc(C)ccc2C)cc1	763664414	BDRFVSNSIYSVQH-UHFFFAOYSA-N	448.501	1.230	50	20	IDGD	
COC(=O)c1cc(Cl)ccc1NC(=O)C(=O)NNC(=O)c1nnc(O)c2ccccc12	763789877	DRPQVXWXDNIHGO-UHFFFAOYSA-N	443.803	1.175	50	20	IDGD	
CCC(=O)Nc1ccc(Cl)c(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)c1	763839222	GCHIFVYMEXHQLO-UHFFFAOYSA-N	436.827	1.993	50	20	IDGD	
Cc1cc(Br)ncc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccc(F)cc1	763873647	WXBFMFUIWSBGMX-JTQLQIEISA-N	439.241	1.845	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)C(=O)Nc2ccc(F)c(C(=O)N(C)C)c2)cc1	763890922	IJYTWCYPBAXFMN-UHFFFAOYSA-N	432.477	1.714	50	20	IDGD	
Cc1nc(-c2cccc(NC(=O)C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)c2)cs1	763916948	LECNGUFVTNDNTA-UHFFFAOYSA-N	448.468	1.494	50	20	IDGD	
CC(C)(C)[C@@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3cccc(C(N)=O)n3)cc2C1	763940052	IGQGRHOJJXYPAG-GFCCVEGCSA-N	443.529	1.793	50	20	IDGD	
CC(=O)N1CCCc2cc(NC(=O)C(=O)NNC(=O)c3cc(Cl)ccc3O)ccc21	763978319	IJBDDMFZUWAKBJ-UHFFFAOYSA-N	430.848	1.744	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2OC)ccc1NC(C)=O	764011003	FHKILVFWBWIXHE-UHFFFAOYSA-N	434.836	1.715	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccccc3N3CCOC3=O)n[nH]2)cc1	764112379	WPFMIVRBKDEUHA-UHFFFAOYSA-N	448.439	1.741	50	20	IDGD	
CN(C)C1CCN(c2ccc(NC(=O)C(=O)NNC(=O)CC(F)(F)F)cc2F)CC1	764114989	KEUIHLLPSHKCMQ-UHFFFAOYSA-N	433.406	1.394	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2O1)C(=O)Nc1ccc(-n2cccn2)c(Cl)c1	764162735	FQSFNTRLXDETOP-KRWDZBQOSA-N	425.832	1.615	50	20	IDGD	
C[C@@H](C(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)CC2CCCC2)c1)n1cccn1	764178522	CFDOQBUHFFFZBD-AWEZNQCLSA-N	426.477	1.749	50	20	IDGD	
Cc1cnc(O)n1-c1ccccc1NC(=O)C(=O)NNC(=O)Cn1ccc2ccccc21	764239234	IAEMOUHWFKRIKV-UHFFFAOYSA-N	432.440	1.627	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)cccc1N1CCOC1=O	764243197	OTXJKUPGGYPRHJ-UHFFFAOYSA-N	435.440	1.692	50	20	IDGD	
O=C(NNC(=O)c1cccc(OC(F)F)c1)C(=O)Nc1ccc(-n2cncn2)c(F)c1	764249707	CRDAHDWETKGJLE-UHFFFAOYSA-N	434.334	1.408	50	20	IDGD	
Cc1cc(C)nc(Sc2ccc(NC(=O)C(=O)NNC(=O)c3c[nH]nc3C)cc2)n1	764296027	SFIZWBGMKQFVPN-UHFFFAOYSA-N	425.474	1.676	50	20	IDGD	
C[C@@H](c1ccc(NC(=O)C(=O)NNC(=O)Cc2ccccc2F)cc1)N1CCOCC1	764314487	YCGBXAQLAZSRFW-HNNXBMFYSA-N	428.464	1.548	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)C(=O)Nc1ccc(CN2C(=O)CCCC2=O)cc1	764319686	ROUPIBFDDVXJON-UHFFFAOYSA-N	440.431	1.193	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)Cc3ccccc3F)cc2)C[C@@H](C)O1	764319835	BOCLIFCPLBHIDB-GASCZTMLSA-N	428.464	1.768	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C(=O)Nc1cc(F)cc(N2CCOCC2)c1)c1ccccc1	764328023	IWTWLQJVQTZXKZ-IBGZPJMESA-N	428.464	1.942	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)C(=O)Nc1cc(S(=O)(=O)NC)ccc1C)c1ccccc1	764328996	IVJKAVFJYYGLNG-MRXNPFEDSA-N	432.502	1.183	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1cccc(-c2nnc(C)o2)c1	764392348	DSLJSTFEUVGZSZ-UHFFFAOYSA-N	441.469	1.932	50	20	IDGD	
N#C[C@@H](c1ccccc1)c1ccc(NC(=O)C(=O)NNC(=O)[C@H]2COCCO2)cc1Cl	764427439	ZSOIZPFLRJDDDS-FUHWJXTLSA-N	442.859	1.497	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)c1ccc(Br)s1)S(=O)(=O)C1CCOCC1	764568946	ODVQUBQHHZWAKG-QMMMGPOBSA-N	425.326	1.254	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)CC(=O)NNC(=O)CSc2ccccc2O)cc1F	765248717	IOGQVOVPSHJBCF-UHFFFAOYSA-N	440.474	1.447	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)[C@@H](C)NC(=O)c3ccoc3)n[nH]2)cc1OC	765595720	DCUOKOZGPGABMB-LLVKDONJSA-N	427.417	1.266	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cn(CCC(C)C)nn3)CC2)cc1	765750087	ZEFPYPIKQMTNON-UHFFFAOYSA-N	427.553	1.211	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)/C=C3/CC[C@@H](C)C3)CC2)cc1	766636082	JAJIGBIKZDZFEY-OLCHLOJWSA-N	434.562	1.195	50	20	IDGD	
Cc1nn(C)c(Cl)c1C(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	766661250	UYTUSNCVNSIJFK-UHFFFAOYSA-N	439.347	1.614	50	20	IDGD	
Cc1ccc(C(=O)NC2CCN(CC(=O)NNC(=O)Cc3ccccc3C)CC2)s1	766867358	PQEHUEGROWTLBK-UHFFFAOYSA-N	428.558	1.949	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@H]2CCN(C3CCCCC3)C2=O)c2ccccc2c1=O	767171049	OUPOQLXGUQFHJX-KRWDZBQOSA-N	440.504	1.294	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)c2cc(S(=O)(=O)N(C)C)ccc2O)o1	767320406	GVFGCDNTKJVPFW-UHFFFAOYSA-N	438.506	1.152	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)[C@H](C)c1ccc(S(C)(=O)=O)cc1	767366617	SHKNLTANUDPVHW-OAHLLOKOSA-N	432.498	1.435	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cc3ccccc3cc2O)n(-c2ncccn2)n1	768234316	SOAAEWZJYZCQFL-UHFFFAOYSA-N	431.412	1.229	50	20	IDGD	
COc1cc(N[C@@H]2CCCN(CC(=O)NNC(=O)c3cccc(C#N)c3)C2)cc(OC)c1	768554805	ZBCLBAPCRTXMNK-GOSISDBHSA-N	437.500	1.913	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)F)cc1)Nc1ccn(CCN2CCOCC2)n1	770035149	SYXXUPIYQQXLIY-UHFFFAOYSA-N	444.464	1.360	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)NCCc2ccon2)cc1	770101801	OPSXTBAVWCYQHY-VBKFSLOCSA-N	434.456	1.688	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)NCc1ccc2c(c1)CCS2(=O)=O	770545981	OUERUXHNINPILI-GFCCVEGCSA-N	437.905	1.968	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)CCCNC(=O)c2cccnc2)c1	772225266	HBSYPQXQMVTTGU-UHFFFAOYSA-N	435.278	1.824	50	20	IDGD	
COc1cc(/C=C(\C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)c2ccccc2)ccc1O	772376422	UAEPAWGQFRIEGF-FEEIMYBTSA-N	445.497	1.459	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cnn(C2CCCC2)c1C	773525654	NLSIISXRVOXESC-UHFFFAOYSA-N	429.477	1.870	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)C(=O)Nc1ccc(C(F)(F)F)cn1	773530037	IIBJDHAOMXQZGY-UHFFFAOYSA-N	434.334	1.391	50	20	IDGD	
CN(C)C(=O)CS(=O)(=O)c1ccc(C(=O)NNc2ccc(C(F)(F)F)cn2)cc1	775265816	UGSXBSZPFRWRQH-UHFFFAOYSA-N	430.408	1.719	50	20	IDGD	
C=CCOc1cccnc1C(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	775541663	CJXWWISGUBSFOD-UHFFFAOYSA-N	443.935	1.879	50	20	IDGD	
C=CCNS(=O)(=O)c1cc(C(=O)NNc2cccc(S(C)(=O)=O)c2)ccc1F	776720568	DFHIBEQDALVGDS-UHFFFAOYSA-N	427.479	1.450	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@@H]2CCO[C@H](CC(C)C)C2)cc1	777751126	CXJHARXTEPWYLO-IAGOWNOFSA-N	440.566	1.540	50	20	IDGD	
CC(C)CS(=O)(=O)N1CCC(NC(=O)NNC(=O)Cc2c[nH]c3ccccc23)CC1	777768948	SISVFGZIZHAEOQ-UHFFFAOYSA-N	435.550	1.491	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)COc1ccc(C(=O)c2ccccc2)cc1	778440552	JLVAHIBXVHLLAP-UHFFFAOYSA-N	427.457	1.969	50	20	IDGD	
CCOC(=O)N1CCC([C@@H](C)NC(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)CC1	779675504	XCMWMXCNYCAPJE-OAHLLOKOSA-N	433.509	1.829	50	20	IDGD	
CCn1c(=O)n(CC)c2nc(NC(=O)CCC(=O)NNc3cccc(OC)n3)ccc21	780772774	XYXSBKSZYFVTCI-UHFFFAOYSA-N	427.465	1.503	50	20	IDGD	
N#CCCn1cc(/C=C(/C#N)C(=O)OCC(=O)NC(N)=O)c(-c2ccc(Cl)cc2)n1	782092630	IQQRMJANSCGAHI-JYRVWZFOSA-N	426.820	1.762	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)CCSc2ccc(F)cc2)c(OC)c1	782121393	XBDJNKMXZCZMCK-UHFFFAOYSA-N	449.460	1.889	50	20	IDGD	
CC(C)n1ncc2cc(NC(=O)C(=O)NNC(=O)Cc3nc4ccccc4n3C)cnc21	782885873	LNYIUPIRMWBGGW-UHFFFAOYSA-N	434.460	1.228	50	20	IDGD	
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)NNC(=O)Cn1ccc2ccccc21	783826651	LPGLMNUCLXCRER-UHFFFAOYSA-N	432.414	1.346	50	20	IDGD	
CC(C)Cn1ncc(NC(=O)C(=O)NNc2cccc(S(C)(=O)=O)c2)c1C(F)F	784843572	ATQUKJZMBYHXTD-UHFFFAOYSA-N	429.449	1.962	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNc3ccc(C(F)(F)F)nn3)cn2)C[C@H](C)O1	784891432	OYVAFFFBQZFUDG-QWRGUYRKSA-N	439.398	1.586	50	20	IDGD	
CNS(=O)(=O)c1ccc2c(c1)N(C(=O)C(=O)NNc1cccc(C(F)(F)F)n1)CC2	784951904	YCLUPZQSRQJREO-UHFFFAOYSA-N	443.407	1.041	50	20	IDGD	
CN(C)c1nccc(NNC(=O)C(=O)Nc2ccc(Oc3ccc(Cl)nn3)cc2)n1	784971171	UUTZWJNBUGKCOF-UHFFFAOYSA-N	428.840	1.860	50	20	IDGD	
COc1ccc(OC(C)C)c(NC(=O)C(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)c1	785022892	ACRGDVRBQCLFAZ-UHFFFAOYSA-N	432.389	1.496	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)[C@H]1CC(c2c(F)cccc2F)=NO1	786169434	AIDPCSKOCOQGGE-CYBMUJFWSA-N	427.408	1.313	50	20	IDGD	
CN(CC(=O)NNc1ccc(-n2ccnc2)nn1)C(=O)c1ccc(Br)s1	788179624	YGXPGPPTUZJOJI-UHFFFAOYSA-N	436.295	1.702	50	20	IDGD	
CN(C)[C@@H]1CCOc2c(NC(=O)C(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)cccc21	789730364	PAUACCZUSXTDJB-MRXNPFEDSA-N	427.417	1.380	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2cc(C#N)cn2C(C)(C)C)nc1	789746608	NDKOCJFJZZEICA-UHFFFAOYSA-N	447.521	1.278	50	20	IDGD	
N#Cc1cccc(-c2cc(C(=O)NNC(=O)c3ccc(Cl)c(S(N)(=O)=O)c3)on2)c1	789871532	PJALSTAMFGMUIP-UHFFFAOYSA-N	445.844	1.589	50	20	IDGD	
O=C(CCS(=O)(=O)c1ccc2c(c1)OCCO2)NNc1cccc(F)c1[N+](=O)[O-]	790586405	WVQDBRUZCFUNRE-UHFFFAOYSA-N	425.394	1.812	50	20	IDGD	
O=C(NNc1cccc(F)c1[N+](=O)[O-])C(=O)Nc1cccc(S(=O)(=O)NC2CC2)c1	790998881	KQEAUUBCZWGYBK-UHFFFAOYSA-N	437.409	1.256	50	20	IDGD	
O=C(NNC(=O)N1CCC(Oc2ccc(F)nc2)CC1)c1ccc(-n2cnnn2)cc1	791010071	NYPCMONCHUSRBR-UHFFFAOYSA-N	426.412	1.094	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCN([C@H](C#N)c3cccc(Cl)c3)CC2)n1	791621833	XBWZRXLGDBFHDC-QGZVFWFLSA-N	446.964	1.677	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)C(=O)Nc1ccc(Cc2nnc3n2CCC3)cc1	792266250	OTAVZGPIDRDURS-UHFFFAOYSA-N	436.447	1.283	50	20	IDGD	
COCCOc1cc(NC(=O)C(=O)NNc2ccc3c(=O)[nH]ccc3c2)ccc1OC	793069332	ASXWUTBFOAQFBB-UHFFFAOYSA-N	426.429	1.644	50	20	IDGD	
COCC(=O)N1CCc2cc(NC(=O)C(=O)NNc3ccc4c(=O)[nH]ccc4c3)ccc21	793069553	NEFQDTQVDIZTQU-UHFFFAOYSA-N	435.440	1.145	50	20	IDGD	
O=C(NNS(=O)(=O)c1c(Cl)cc(Cl)cc1[N+](=O)[O-])[C@@H]1CCc2nncn2C1	793450441	MHEUNIZVYSDNEG-SSDOTTSWSA-N	435.249	1.065	50	20	IDGD	
C[C@H]1CN(C(=O)CCC(=O)C(C#N)=C2N(C)c3ccccc3N2C)C[C@@H](C)S1(=O)=O	794157747	NEJCXKJGUCHSKB-GASCZTMLSA-N	430.530	1.691	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)N1CCC[C@@H](C=NNC(=O)COc2ccccc2C#N)C1	794476935	ULWNSODUHYFQEI-INIZCTEOSA-N	443.504	1.802	50	20	IDGD	
CC1CCC(OCC(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)CC1	795110225	SJNNCFUJSGMMMJ-UHFFFAOYSA-N	425.555	1.056	50	20	IDGD	
Cc1ccc(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)cn1	795276905	UXVGJAMSHOWDNH-UHFFFAOYSA-N	438.531	1.188	50	20	IDGD	
CCN1CCN(c2ccc(Cl)cc2NC(=O)C(=O)NNC(=O)c2cccc(C)n2)CC1	797370596	HSAWLDOZMOUEQQ-UHFFFAOYSA-N	444.923	1.585	50	20	IDGD	
C#Cc1cncc(C(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)c1	798154966	XWLGBFWZLRRJKA-UHFFFAOYSA-N	426.479	2.000	50	20	IDGD	
CCCCNS(=O)(=O)c1ccc(C)c(NC(=O)C(=O)NNC(=O)c2ccc(C)o2)c1	799834414	DWHASTQUDIJRTA-UHFFFAOYSA-N	436.490	1.375	50	20	IDGD	
COCCn1cc(CNC(=O)NNC(=O)COc2ccc(Br)cc2)cn1	800008129	PJMWEFQJNYVEPM-UHFFFAOYSA-N	426.271	1.201	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1ccccc1Oc1cnn(C)c1	801104714	YGUYGXZQHKAKKE-UHFFFAOYSA-N	442.501	1.889	50	20	IDGD	
CCS(=O)(=O)N[C@@H](CCSC)C(=O)NNC(=O)Nc1ccc(OC(F)F)cc1	802046120	ALPCGIAVYINAFS-LBPRGKRZSA-N	440.494	1.502	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2ccc(CSc3nc[nH]n3)cc2)cc1	802067628	XQENIMQBAXGCLR-UHFFFAOYSA-N	446.514	1.967	50	20	IDGD	
COc1ccc(C2=NO[C@H](CNC(=O)NNC(=O)c3ccc(OC)c(OC)c3)C2)cc1	802368894	WZCKCXJWVGTKLF-INIZCTEOSA-N	428.445	1.850	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCCC(=O)NNc1ccc(-n2ccnc2)nn1	804958163	MEVVNLPXPVRBEA-AWEZNQCLSA-N	444.496	1.011	50	20	IDGD	
Cc1c(C(F)(F)F)nn(C)c1NC(=O)C(=O)NNC(=O)c1cc(-c2ccccc2)on1	806977226	ZTXOHTGVHXRQSS-UHFFFAOYSA-N	436.350	1.802	50	20	IDGD	
COCCCOc1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)cc1OC	806977499	MENOZBSXJPPKIM-IBGZPJMESA-N	443.456	1.200	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)c(Cl)c1)C(=O)Nc1ccc(F)c(N2CCCNC2=O)c1	806978757	GLKUYDXGBXXTCL-UHFFFAOYSA-N	449.826	1.504	50	20	IDGD	
COCc1csc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)n1	807001366	XZMVKAMMVBVJMP-UHFFFAOYSA-N	438.409	1.665	50	20	IDGD	
CN1CCN(C(=O)c2ccccc2NC(=O)C(=O)NNc2nccnc2C2CCC2)CC1	807462573	HEJANALKVJSHSQ-UHFFFAOYSA-N	437.504	1.214	50	20	IDGD	
COc1cc(Cl)c(NC(=O)C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1C	808934537	JYRMHTZFOGXWSL-UHFFFAOYSA-N	443.847	1.304	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)Nc1cc(C(N)=O)ccc1OCC(F)F	810342917	HNZBKRVEGOOHJQ-UHFFFAOYSA-N	433.371	1.533	50	20	IDGD	
CC(C)CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)NNc1c(F)cc(C(=O)NC2CC2)cc1F	810563690	QDTGFOMJRYMEKM-QGZVFWFLSA-N	448.474	1.797	50	20	IDGD	
O=C([C@@H]1CCN(c2ccccc2F)C1)N1CCN(S(=O)(=O)CBr)CC1	810911579	DSWKIDFDBRQKTE-CYBMUJFWSA-N	434.331	1.478	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@H]2C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)cc1	812726536	HOZIVPRMIKBMMA-IBGZPJMESA-N	446.529	1.693	50	20	IDGD	
Cc1cc(Cl)cnc1NC(=O)C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	812980219	PLTSPEMXSAWIIC-UHFFFAOYSA-N	444.923	1.342	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@](C)(O)C2CCC2)c1	813363817	UVWMOZXXCUPFKW-NRFANRHFSA-N	447.513	1.808	50	20	IDGD	
COCCN1[C@H]2CC[C@H]1CC(=NNC(=O)c1ccc(S(=O)(=O)N3CCCC3)cc1)C2	814741436	AXWVVIYNIAEAAO-OALUTQOASA-N	434.562	1.830	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)c3ccc4c(c3)NC(=O)CNC4=O)n[nH]2)cc1C	815887647	OSOIWXKTRFMGLQ-UHFFFAOYSA-N	432.440	1.450	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(N2C[C@@H](C(=O)NNC(=O)CC3CC3)CC2=O)cc1	819109848	MIZIQHBTFWXXNG-HNNXBMFYSA-N	436.534	1.018	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)CN2C(=O)c3ccccc3C2=O)c2ccccc2c1=O	824624007	YVIQXWBHSXBVKF-UHFFFAOYSA-N	433.424	1.035	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)CN1C(=O)N[C@@]2(C[C@H](C)CC(C)(C)C2)C1=O	912604616	OJBVCHMIQWJRSS-ALLJEULLSA-N	448.495	1.877	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)cc(C#N)n1C	913286864	LOLWEQCNCUMPNG-UUASQNMZSA-N	425.832	1.770	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)Cc2ccc(-n3cccn3)cc2)c2ccccc2c1=O	915620260	XAWIXNNUXAABBB-UHFFFAOYSA-N	430.468	1.996	50	20	IDGD	
CCOc1cc(C=NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)ccc1OC	916258532	DBVAPZNMDUYHPW-UHFFFAOYSA-N	447.513	1.879	50	20	IDGD	
CCn1cnc2c1c(=O)n(CC(=O)NN=Cc1cccs1)c(=O)n2Cc1ccccc1	916332260	SVQNUIXUISJHDV-UHFFFAOYSA-N	436.497	1.640	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCc2cccc(OC)c2)c1	916382093	OKOHNZKWAWEFGI-UHFFFAOYSA-N	448.545	1.912	50	20	IDGD	
CCN1CCN(Cc2ccc(CNC(=O)NNC(=O)COc3ccccc3F)cc2)CC1	916418349	JATPORWZOSTQII-UHFFFAOYSA-N	443.523	1.873	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)cc1NC(C)=O	916567578	RKBOAMWPKQBCAW-UHFFFAOYSA-N	434.474	1.219	50	20	IDGD	
COc1cc(CNC(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)ccc1OCC(N)=O	916640306	CJBOOQOZPBEQMA-OAHLLOKOSA-N	444.488	1.474	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCCC[C@H]2c2noc(C3CC3)n2)cc1OC	917183564	MRBSKXSSJMCWAC-HNNXBMFYSA-N	429.477	1.952	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=O)c2ccc(C)cc2O)ccc1OC	918340670	AWUWFNJWWWUCDA-UHFFFAOYSA-N	435.502	1.815	50	20	IDGD	
CCOc1ccc(-c2nc(C)c(C(=O)NNC(=O)N[C@H]3CCS(=O)(=O)C3)s2)cc1	919885987	OQWCMSBFSMZEKU-ZDUSSCGKSA-N	438.531	1.648	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)NC(C)(C)C)o2)o1	920248791	PYRRTFBWNSCPME-UHFFFAOYSA-N	440.522	1.866	50	20	IDGD	
O=C(NNC(=O)c1cc2ccccc2cc1NC(=O)C1CC1)N[C@@H]1CCS(=O)(=O)C1	920746530	XAYQWDDQOCYKFT-OAHLLOKOSA-N	430.486	1.319	50	20	IDGD	
CNC(=O)c1ccc(NC(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)c(C)c1	1321700729	FKEHVONBTLNBLQ-UHFFFAOYSA-N	448.524	1.996	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)c2ccc(Cn3cncn3)cc2)CC1	1322956557	DKDNDFIINOKZBJ-UHFFFAOYSA-N	428.493	1.735	50	20	IDGD	
O=C(NNC(=O)[C@H]1Nc2ccccc2S(=O)(=O)N1)Nc1ccc(Br)cc1	1340042284	ADXNYBVETBZLAD-ZDUSSCGKSA-N	440.279	1.332	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)nc2nccn12	1779298220	BTFWJIBLFHBXEY-FQEVSTJZSA-N	431.569	1.333	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2n[nH]cc2[N+](=O)[O-])C1	1779601732	YKZPFLSFAAGUBM-FZKQIMNGSA-N	427.889	1.710	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Cl)C2)c1cc(-n2ccnc2)ccn1	1780215959	URVBHMUJMMWCBP-MBOZVWFJSA-N	435.887	1.929	50	20	IDGD	
O=C(c1ccc([N+](=O)[O-])c2c1OCO2)N1CC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1780237286	XGDVYUYOCIVTEP-KRWDZBQOSA-N	446.243	1.571	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Br)C1)n1cccn1	1780777066	LWMWHUBDBZVQHN-VMUDFCTBSA-N	431.306	1.649	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](O)NC(=O)OC(C)(C)C)C1	1781050714	VISYQEGGKFTZFE-VOMKJEOTSA-N	447.960	1.361	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc4c(c3)n(C)c(=O)n4C)CCO2)C1	1781219793	VCAJBKBKHZPOEW-BTYIYWSLSA-N	434.924	1.338	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc4c(n3)OCCO4)CCO2)C1	1781226886	CFQDLLUUSINGEA-MOPGFXCFSA-N	444.315	1.533	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)CSc3ncccn3)CCO2)C1	1781227219	IKEHNDXZBKLSKX-SJORKVTESA-N	433.361	1.635	50	20	IDGD	
O=C([C@H](F)Br)N1CC[C@]2(C1)CN(C(=O)C1(c3ccc(O)cc3)CC1)CCO2	1781326436	XRUPHUODWKEIME-YJBOKZPZSA-N	441.297	1.944	50	20	IDGD	
O=C(c1ccc(Br)c(O)c1)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1781694959	IKHOHIMKRNMNLS-YOEHRIQHSA-N	447.713	1.198	50	20	IDGD	
CCC(=O)N[C@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](Br)CC)C1	1781897631	NGJOYUCYPJOCGM-DEXNDLTESA-N	446.386	1.589	50	20	IDGD	
CCCC(=O)N[C@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)Br)C1	1781998181	UXAKDEUKGRLFFN-DEXNDLTESA-N	446.386	1.589	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)c3cc4ccsc4[nH]3)C2)C1	1782294215	SHGRBAUZUQKZRV-HXUWFJFHSA-N	433.534	1.046	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3c[nH]c4cccc(OC)c34)C2)C1	1782375537	KKJSJJSNPGPFEJ-QVKFZJNVSA-N	435.908	1.874	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H]1CCOC1)CCO2	1782867625	MPVAVKPTKGCBOJ-BVFXMFMDSA-N	431.439	1.738	50	20	IDGD	
O=C(c1ncc[nH]1)N1CCO[C@]2(CCN(C(=O)[C@@H](Br)Cc3ccccc3)C2)C1	1783018608	NRXMWSFNFRCNBM-JXFKEZNVSA-N	447.333	1.859	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3cccc([N+](=O)[O-])c3)[C@H]2C1	1783439426	ZFEHFCSQFFYGMV-DKIMLUQUSA-N	439.896	1.371	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)NC(=O)OC(C)(C)C)[C@H]2C1	1783822089	NSMWFVQZISNHCY-GVRJEKJASA-N	447.960	1.133	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(Cl)cnc3OC)CCO2)C1	1783869315	OSBXWYARNAIIJO-KSSFIOAISA-N	432.304	1.441	50	20	IDGD	
O=C(CC(=O)N1CCO[C@]2(CCN(C(=O)C(Cl)Cl)C2)C1)Nc1ccc(F)cc1	1783948181	FEHINIMMHASLHZ-GOSISDBHSA-N	432.279	1.788	50	20	IDGD	
Cc1onc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]3C2)c1C	1783968550	BIINAGACBVUAMN-KJEVXHAQSA-N	428.327	1.916	50	20	IDGD	
C[Si](C)(C)c1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]3C2)co1	1784093073	POYRIPHEXUWKOZ-HNKHHVNMSA-N	428.989	1.018	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)CCCn3ccnc3)C2)C1	1784402992	IBAXBLZGRLHTMD-CRAIPNDOSA-N	427.343	1.667	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(N4CCOCC4)cc3)C[C@@H]21)[C@@H](F)Cl	1787447149	OEIPJZKLDUESQV-DSLXNQLJSA-N	439.915	1.651	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnn4c(C)cc(C)nc34)[C@H]2C1	1787910376	UVOWCXPZQQEFGG-OWLYRPNTSA-N	449.939	1.193	50	20	IDGD	
CNC(=S)NCCC(=O)Nc1ccc(C2(NC(=O)[C@H](Cl)COC)CCC2)cc1	1789527632	JNFUCWUTQWHJIM-OAHLLOKOSA-N	426.970	1.858	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc(Cl)nc3)C[C@@H]21	1790960524	BKDGZYQDAJJASS-DEQVHRJGSA-N	445.745	1.897	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cn3nc(C)cc3C)C[C@@H]21	1790961235	MWKMENCLUKUUGY-QAETUUGQSA-N	441.370	1.653	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3sc(N)nc3C)C[C@@H]21	1790961772	QLPLOEQFMQZBRF-RVMXOQNASA-N	445.383	1.801	50	20	IDGD	
Cc1nn(C)c(C)c1CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21	1791636135	BBWHLBMNCDIBRO-QEWYBTABSA-N	445.333	1.250	50	20	IDGD	
COc1ccc(Cl)c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](O)CCl)C[C@@H]32)c1	1791900982	SUPKGVDAABWNOR-GQGQLFGLSA-N	431.316	1.542	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)c1cc(F)ccc1Br	1792687201	LKAAFMUASJQCGC-OWLDWWDNSA-N	449.704	1.391	50	20	IDGD	
COc1nccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)Br)C3)c1F	1795911583	LNNZZAYYYAIIDX-NJBDSQKTSA-N	430.274	1.216	50	20	IDGD	
Cc1ccc2[nH]c(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3ccc(B(O)O)cc3)cc2c1	1796189100	WOHQFLJSZGKIAY-ACDBMABISA-N	431.301	1.722	50	20	IDGD	
COc1ccc([C@@H]2C[C@@H]2C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)cc1	1796189951	NRQFBBWTROKSBN-QWCYLASJSA-N	448.328	1.431	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc2c(n1)OCCO2)[C@@H](F)Br	1796720772	HIHKQFYOETUEDL-FBKDDSFISA-N	428.258	1.795	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1ccc2c(c1)CCCO2)c1cccc(B(O)O)c1	1797844238	YSGXFRBGNXVCQB-KOUNCHBCSA-N	448.328	1.186	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COc1ccccc1C#N)C2	1799282688	VPLVUIDWWZEPOU-ZDUSMZPESA-N	440.327	1.763	50	20	IDGD	
COc1cccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCBr)C3)c1C	1801649259	ZJBJSYDNGUTJDQ-ZSBFGKGUSA-N	425.323	1.992	50	20	IDGD	
CC(=O)Nc1ccccc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2	1801781455	WGBILKOPPVDPBX-NOXHYTERSA-N	442.285	1.539	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1nc(Cl)ccc1F)C2	1802332990	JBPHHRHUXGDXAN-CLLJXQQHSA-N	425.892	1.499	50	20	IDGD	
CN1CCN(CC(=O)N2CC[C@@H](CNC(=O)C(C)(C)CCl)[C@@H]2c2cccnc2)CC1	1802900573	BIVBGCIYXQYATR-ICSRJNTNSA-N	436.000	1.600	50	20	IDGD	
CN1CCC(CC(=O)N2CCCC3(CCN(C(=O)CCC(=O)NN(C)C)CC3)C2)CC1	1805011896	LGUXBTSKWBXLCD-UHFFFAOYSA-N	435.613	1.323	50	20	IDGD	
Cc1[nH]ccc1C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1807364030	RVEJVLZJPVWTKR-GHTZIAJQSA-N	432.289	1.031	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)CCc2cncnc2)[C@H]1c1cccnc1	1807507586	GFZYKQKDAFTULA-CMKODMSKSA-N	431.924	1.764	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)CN2CCN(C)CC2)[C@@H]1c1cccnc1	1809598325	JNPYOIYNCZUUCJ-DYXWJJEUSA-N	436.000	1.742	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)c3c(F)cncc3F)CC2)C1	1809978075	UXPIGFQFLQADFC-UHFFFAOYSA-N	443.259	1.198	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)N1CC[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]1c1cccnc1	1810541635	LIHSPVOKJXNDIX-XYJFISCASA-N	435.601	1.386	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC2(CCCN(C(=O)c3cc[nH]c4nccc3-4)C2)CC1	1810631597	MGSZSSLHIJVFLJ-UHFFFAOYSA-N	446.316	1.353	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)CCC(=O)N2CCCC2)[nH]n1)[C@@H](O)CCl	1814867308	HUFXMPDTPRHAGL-CABCVRRESA-N	425.917	1.404	50	20	IDGD	
CCOCC(=O)N[C@H]1CCc2nc(NC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)sc2C1	1817277214	MCGAJYVQPDAKTL-ZFILKEQLSA-N	432.506	1.226	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)C2CCSCC2)[nH]n1)c1ccc(B(O)O)cc1	1817475489	OTVKJZRRWXYTRH-SFHVURJKSA-N	442.350	1.539	50	20	IDGD	
Cc1[nH]ccc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnccc1C(=O)NN)CC2	1817727388	DSFIVVCFIMPWLF-LLVKDONJSA-N	439.501	1.318	50	20	IDGD	
Cc1cc(C(=O)NCC(=O)N2CCCC[C@H]2c2cc(NC(=O)[C@H](F)Cl)n[nH]2)no1	1818039411	BDWYVMWYLQHFJW-WFASDCNBSA-N	426.836	1.663	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)C(=O)Nc2cccnc2)n[nH]1	1819530807	FTLSUNULXBSKKQ-DZGCQCFKSA-N	434.884	1.689	50	20	IDGD	
C[C@@](O)(CC(=O)O)CC(=O)N1CCCC[C@H]1c1cc(NC(=O)CO[Si](C)(C)C)n[nH]1	1819597420	YIKNVTAEHQEGGT-LIRRHRJNSA-N	440.573	1.869	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)CN2CCOCC2)[nH]n1)[C@H](F)Br	1820931902	ATZPDDIOLQJBRA-DOMZBBRYSA-N	432.294	1.425	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H]2CCCS2(=O)=O)[nH]n1	1822377680	YLSLSHQAXRIHAP-IACUBPJLSA-N	432.930	1.233	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)Cc2ccc(F)cn2)[nH]n1	1822413924	HMHNVNGXQFUEMA-KRWDZBQOSA-N	445.499	1.552	50	20	IDGD	
CC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CNC(=O)c1cc(C)on1)CC2	1822849171	HPTDPHJABXHEPC-QWRGUYRKSA-N	439.925	1.799	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CNCP(=O)(O)O)CC1	1824010697	FWGQWFUUNNVADP-OAHLLOKOSA-N	437.905	1.596	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC([C@H]2CCCCN2C(=O)C2=NN(C)C(=O)CC2)CC1	1824927264	APFIKVDGPJJHBG-XJKSGUPXSA-N	441.370	1.998	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCC([C@H]2CCCCN2C(=O)C[C@H]2NC(=O)NC2=O)CC1	1825069938	GHKFUXREJRMWBM-HUUCEWRRSA-N	426.945	1.469	50	20	IDGD	
C=C(C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2)C(F)(F)F	1825263967	FEPRUOGJTFDQIN-LBPRGKRZSA-N	439.224	1.167	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(O)nc(O)c1)CC2	1825998864	NOKKCZKBDBUOEU-NXEZZACHSA-N	426.882	1.429	50	20	IDGD	
Cc1ncsc1C(=O)N[C@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1	1826080407	IWCHZVLXPZMGNE-NSHDSACASA-N	436.563	1.507	50	20	IDGD	
Cc1ccc(O)c(C(=O)N[C@@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)c1	1826088280	CTJYPVKYZRLGFP-CYBMUJFWSA-N	445.545	1.756	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(C#N)cc1)CC2	1826088748	NDCJQIVZEFHIMI-OAHLLOKOSA-N	440.529	1.614	50	20	IDGD	
CCc1cc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)n(C)n1	1829327649	ZHIBZOBVLVYKOV-IBGZPJMESA-N	446.596	1.589	50	20	IDGD	
C#CC(=O)N1CCC([C@H]2CCCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)CC1	1830165686	JSTRJBWKELLXKE-OAQYLSRUSA-N	439.560	1.586	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cn3cc(Cl)cn3)C2)C1	1830357526	FIVQANBNGBPIBB-GOSISDBHSA-N	433.336	1.258	50	20	IDGD	
Cc1cccnc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)CBr)CCO2	1830535432	NVPLEFZHDGXRQJ-DNVCBOLYSA-N	440.338	1.491	50	20	IDGD	
CCn1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)n1	1830538237	ZEHCWSVAZHVUKD-KSSFIOAISA-N	443.342	1.004	50	20	IDGD	
CC#CC[C@H](C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2)c1ccccc1	1830732461	YUTMPQXURPDBDP-JTAQYXEDSA-N	448.947	1.240	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCCC(=O)OC(C)(C)C)CCO2)C1	1830803217	GDAKFQBSHPTMPP-HRAATJIYSA-N	446.972	1.972	50	20	IDGD	
C=CCOCCCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1831412076	CBTSSZXPTFHBOM-DOTOQJQBSA-N	437.306	1.116	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](CCC)NC(C)=O)C2)C1	1831659477	SLLDOLFJPRKESY-ABSDTBQOSA-N	431.961	1.155	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1	1831834519	DIXVKJRFDYSOHS-IAGOWNOFSA-N	430.977	1.233	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2cnccn2)CC1	1832299221	FGNIKHWVBRZYQN-UVIRAJKCSA-N	448.332	1.103	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3nc(C)sc3C)CCO2)C1	1833151656	VKOJKNLCPKGJJO-BEFAXECRSA-N	429.970	1.776	50	20	IDGD	
CC[C@H](C)[C@H](O)C(=O)NC1CCN(C2CCN(C(=O)[C@H](C)CBr)CC2)CC1	1833494543	DRJRDHPIWOCSIA-DAYGRLMNSA-N	446.430	1.996	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)[C@@H]3CCCN3C)CC2)CC1	1833623656	QQZLQZWGMHPUPR-ROUUACIJSA-N	443.430	1.826	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](C)Cn3cccn3)CC2)CC1	1833890497	ZIRZGGBOKXRMLX-LPHOPBHVSA-N	439.988	1.345	50	20	IDGD	
CCOC(=O)/C=C/C(=O)NC1CCN(C2CCN(C(=O)[C@H](C)Br)CC2)CC1	1834405841	LRWDGVRIHYSFLC-NNTXTVRGSA-N	444.370	1.461	50	20	IDGD	
Cc1nn[nH]c1C(=O)N1CCC(N2CCC(NC(=O)CCBr)CC2)CC1	1834421827	OHEGFGMXBABJMN-UHFFFAOYSA-N	427.347	1.083	50	20	IDGD	
Cc1nc(C)c(C(=O)N2CCOC[C@]3(CN(C(=O)CCBr)CCO3)C2)o1	1834823117	JPEUUCMPKLWQLP-KRWDZBQOSA-N	430.299	1.146	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)COc3ccc(C)cc3)CCO2)C1	1835166274	FATJUOPMXKRIIN-WIYYLYMNSA-N	440.924	1.084	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)C(=O)Nc3cccnc3)CC2)CC1	1835802593	VRNXRACQFQFBBB-IBGZPJMESA-N	449.983	1.999	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](C)N3CCN(C)CC3)CC2)CC1	1836375390	XNKLRIPWQLISNY-YLJYHZDGSA-N	442.048	1.211	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@H](C)Cn3cccn3)CC2)CC1	1837222725	XEGARZDJVZGPOO-VQIMIIECSA-N	440.972	1.772	50	20	IDGD	
CC(C)n1nccc1C(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1838018234	BBZXTPQSTSQCRG-HXUWFJFHSA-N	426.945	1.799	50	20	IDGD	
COC(=O)C1(C(=O)N2CCC(OC3CCN(C(=O)[C@@H](F)Br)CC3)CC2)CC1	1838648219	MKFOSYLXNTUGNT-CQSZACIVSA-N	449.317	1.629	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)/C=C3\C(=O)Nc4ccccc43)C2)C1	1839145297	CKIGTWXLDXJGBO-VCLZSNQESA-N	447.919	1.496	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccncc3)C2)C1	1839154539	QQFAKKJTQSDYQJ-OALUTQOASA-N	430.332	1.317	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(O)ccc3O)CCO2)C1	1839445663	FLSMGWPVHXUHPF-FQEVSTJZSA-N	426.897	1.433	50	20	IDGD	
CCC(=O)C(=O)N1CCO[C@]2(COCCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1	1839831847	SEOGFWBPWJRHKZ-NAVGAYGYSA-N	447.438	1.307	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)CC(C)=O)CCO2	1840133018	RWWKPZRILQZVAT-XUWXXGDYSA-N	433.343	1.232	50	20	IDGD	
O=C(c1c(F)ccc(O)c1F)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840189158	ARFOLPXNCOBAAM-QGZVFWFLSA-N	439.242	1.544	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2cc(C)cnc2Cl)C1	1842560867	HCOHTSFUJYSVSG-AFUMVMLFSA-N	442.907	1.994	50	20	IDGD	
Cc1snc2sc(C(=O)N3CC4(CCCN4C(=O)c4cccc(B(O)O)c4)C3)cc12	1843013875	YHBNLUAVESKDCM-UHFFFAOYSA-N	441.343	1.477	50	20	IDGD	
O=C([C@@H]1C[C@@H]1c1ccc(Cl)cc1)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843013948	HGEJYTXQGPOQNX-WOJBJXKFSA-N	438.720	1.641	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2ccn(C(C)C)n2)C1	1844815028	LKCUQQGXQOCQND-HZHRSRAPSA-N	425.493	1.415	50	20	IDGD	
CN1CCCn2nc(C(=O)N3CCCC34CN(C(=O)[C@](C)(Cl)CCl)C4)cc2C1	1845727276	IHMBFMLFBCXYKL-GOSISDBHSA-N	428.364	1.772	50	20	IDGD	
CCCC[C@H](NC1=NS(=O)(=O)c2ccccc21)C(=O)NNC(=O)c1ccccc1O	10125699	ATOVOOIWRTVZOR-HNNXBMFYSA-N	430.486	1.451	50	20	IDGD	
COc1ccc(Cn2nnnc2SCC(=O)NNC(=O)c2ccc(Cl)cc2)cc1	15047624	XWJHFWZUUMKZKS-UHFFFAOYSA-N	432.893	1.937	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2ccc3c(c2)NC(=O)[C@H](C)S3)c2ccccc2c1=O	15939775	NYIFMNRIIJFTBB-NSHDSACASA-N	437.481	1.924	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)c2cncn2-c2ccccc2)cc1NC(C)=O	22275137	BZAHLQRPMQHPLY-UHFFFAOYSA-N	429.458	1.463	50	20	IDGD	
O=C(CN1CCN(CC(=O)Nc2ccccc2)CC1)NNC(=O)c1ccccc1Cl	23665010	AYGUJYGXKISXEH-UHFFFAOYSA-N	429.908	1.357	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NCC(=O)NNC(=O)c2ccccc2C)c1	45947881	AAZBRJDZENSYND-UHFFFAOYSA-N	446.529	1.217	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)c2ccc(N3CCCS3(=O)=O)cc2)cc1OC	105163755	WIRNLRFYMJHMPU-UHFFFAOYSA-N	433.486	1.709	50	20	IDGD	
O=C(CN1CCN(C(=O)CC2CCCCC2)CC1)NNC(=O)c1cccc([N+](=O)[O-])c1	110301087	BOVBRYXGQYWUFE-UHFFFAOYSA-N	431.493	1.470	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)c3sccc3C)CC2)cc1	727348375	CIDDIWSHURNHMV-UHFFFAOYSA-N	436.559	1.132	50	20	IDGD	
CC(=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O)c1ccc(Cl)c(Cl)c1O	727651205	MZRRTPAIXGMYGA-UHFFFAOYSA-N	432.289	1.124	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)N[C@@H](CN1CCN(C)CC1)c1ccccc1	727945017	IGJHIEPFUGYFDE-UTKZUKDTSA-N	443.523	1.912	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(C)c(C(=O)NNc2nc(-c3ccccc3)no2)c1	728081483	YYIXOQPASAWZFT-UHFFFAOYSA-N	431.474	1.727	50	20	IDGD	
O=C(NNC(=O)c1cnc2c(c1)c(O)nc(=O)n2C1CC1)c1cccc(OC(F)F)c1	728544449	CQQGVSGJSUOIHH-UHFFFAOYSA-N	431.355	1.508	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1sc(N2CCCC2)nc1Cl	728845752	JRUCQVQZEXWGQZ-UHFFFAOYSA-N	435.941	1.864	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c([N+](=O)[O-])cc1OC	728847334	AUDASHYWRCFDBU-UHFFFAOYSA-N	444.448	1.470	50	20	IDGD	
CN(C)N(C(=O)c1ccc(I)c(F)c1)[C@H]1CCS(=O)(=O)C1	729170801	JHHLZFAOOYGTJI-JTQLQIEISA-N	426.251	1.536	50	20	IDGD	
CC[C@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)c1nc(C)cs1	729623930	NYGFRZFHTDTRKZ-AWEZNQCLSA-N	425.536	1.797	50	20	IDGD	
CC(C)(C)C(=O)N1CSC[C@@H]1C(=O)OCC(=O)NNC(=O)c1cccc(Cl)c1	730322918	NBXNKJRBBDXSMF-CYBMUJFWSA-N	427.910	1.592	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)C(C)(C)c2ccccc2)c(C(=O)OC)s1	731177318	CGFSNKVQGLRRDG-UHFFFAOYSA-N	440.499	1.609	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cc(C(=O)NNC(=O)c3c[nH]nc3C)ccc2F)cc1	732086796	IIZNRNUPNCTPIE-UHFFFAOYSA-N	447.448	1.741	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)c1cc(-c2ccco2)nc2c(C(N)=O)ncn12	732301883	LNYWDDLVMLABQC-UHFFFAOYSA-N	440.441	1.249	50	20	IDGD	
O=C(COC(=O)CCC(=O)c1ccc(F)cc1F)NNC(=O)c1cccc([N+](=O)[O-])c1	732329132	JCLJCBRTUOWYKM-UHFFFAOYSA-N	435.339	1.840	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)NCCC(=O)NNc2cc(F)c(F)cc2F)cc1	734554800	ICMMOTYUZYOCDR-UHFFFAOYSA-N	430.408	1.874	50	20	IDGD	
O=C(COC1CCOCC1)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	735270321	NNLQNRZBRVZMHD-UHFFFAOYSA-N	447.513	1.122	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2ccc(C)c(C(=O)NNC(=O)c3cnn(C)c3)c2)cc1	735471006	JGFVFMMMWCHTAW-UHFFFAOYSA-N	443.485	1.613	50	20	IDGD	
Cc1ccc(Nc2cccc(C(=O)NNC(=O)c3csc(N4CCOCC4)n3)c2)nn1	736065988	YZXIJYHAUJFALJ-UHFFFAOYSA-N	439.501	1.897	50	20	IDGD	
O=C(N[C@@H](C(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1)c1ccccc1)OCc1ccccc1	737778116	GSCBJAFXIPBVFA-ZWKOTPCHSA-N	445.497	1.236	50	20	IDGD	
O=C(NNc1ncnc2[nH]cnc12)C1CCN(S(=O)(=O)c2ccc3c(c2)CCC3)CC1	740745942	GWDFLSWHPGEAEB-UHFFFAOYSA-N	441.517	1.386	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)c2cc(C)c(OCC(=O)N3CCCCC3)c(C)c2)n1	741663063	WTGSZKMNIFKRJV-UHFFFAOYSA-N	441.532	1.969	50	20	IDGD	
O=C(CCNc1ncc(C(F)(F)F)cc1Cl)NNC(=O)CNC(=O)c1ccco1	742063337	YYMORCWQNDFRBD-UHFFFAOYSA-N	433.774	1.726	50	20	IDGD	
CC(=O)N[C@@H](Cc1c[nH]c2ccc(Br)cc12)C(=O)NNC(=O)c1cnn(C)c1	742079701	ULSNXOIIDVHVEW-INIZCTEOSA-N	447.293	1.172	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NN=Cc1ccc(C#N)o1)N(S(C)(=O)=O)CC2	743428780	LMJLESZWLACZPV-QGZVFWFLSA-N	446.485	1.568	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1cc(-c2ccc(F)cc2)[nH]n1	744621004	KRNMSEWOWBBFFD-UHFFFAOYSA-N	445.476	1.994	50	20	IDGD	
N#CCn1c(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)cc2ccccc21	744621271	NIKJKDDNUSEAIL-UHFFFAOYSA-N	439.497	1.943	50	20	IDGD	
Cc1cc(C)n(-c2ccc(CC(=O)OCC(=O)NNC(=O)c3ccc(C#N)cc3)cc2)n1	744758107	VJOXXPDJOSCIQZ-UHFFFAOYSA-N	431.452	1.908	50	20	IDGD	
Cc1ccc(C)c(S(=O)(=O)Nc2ccccc2C(=O)NNC(=O)N2CCOCC2)c1	745991673	CFTQPVBJCOADAW-UHFFFAOYSA-N	432.502	1.791	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)c1cccc(S(=O)(=O)NCC2CC2)c1	746640322	AMGLHRFQHCSVBO-UHFFFAOYSA-N	427.486	1.026	50	20	IDGD	
Cc1nn(C)c(C)c1[C@H](C)C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	746817900	LDPZWPHJJWIHOR-ZDUSSCGKSA-N	433.534	1.386	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1cnc2cc(C)nn2c1C	746924228	OVGHZXNFBSYTMD-UHFFFAOYSA-N	431.836	1.626	50	20	IDGD	
O=C(Nc1ccccc1)Nc1ccc(C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)s1	747364941	CYQVYCMOKVPSQY-LBPRGKRZSA-N	437.503	1.523	50	20	IDGD	
CCOC(=O)c1cccc(S(=O)(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)c1	749152022	OIRYBQHFOQPBDN-UHFFFAOYSA-N	438.458	1.512	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)[C@@H]2CCCN2C(=O)c2ccc3c(c2)OCO3)c1	749560662	DFUFGOVNCUVEQR-KRWDZBQOSA-N	425.441	1.555	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCn2cncc2C1)c1ccccc1NS(=O)(=O)c1cccs1	749568341	KAPBULBIRZQSIB-CYBMUJFWSA-N	445.526	1.769	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@H](C)N2C(=O)[C@@H]3CCCC[C@H]3C2=O)cc(OC)c1OC	750548053	NWGWKWZKRIPSEF-IACUBPJLSA-N	433.461	1.037	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)CCc3nc[nH]n3)c2)c(C)c1	750605252	BHFLOXWDYGXVDP-UHFFFAOYSA-N	442.501	1.616	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c(Br)c1	751083323	SSEGXDAPHFVXER-UHFFFAOYSA-N	427.276	1.936	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1Br)C(=O)NNC(=O)CNC(=O)c1cccs1	751206200	GXMNVEHGQMFXAY-SECBINFHSA-N	444.282	1.994	50	20	IDGD	
CCOC(=O)[C@@H]1Cc2cc(S(=O)(=O)NNC(=O)CCCc3ccccc3)ccc2O1	751547883	MKKAXBXRMZQZQG-IBGZPJMESA-N	432.498	1.886	50	20	IDGD	
C[C@@H](NC(=S)NNC(=O)CN(C)S(=O)(=O)c1ccc(Br)cc1)C1CC1	751618028	GMEWVQNUAJCVBH-SNVBAGLBSA-N	449.396	1.363	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)c1ccc(F)cc1F	753046865	MCECWZRRXNKZBQ-NSHDSACASA-N	426.445	1.920	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)CSc2nc(-c3ccccc3)no2)c1	755040668	ZYHNYYKWGJROIU-UHFFFAOYSA-N	432.483	1.693	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@@H](CC(C)C)N2CCCCC2=O)c2ccccc2c1=O	755045793	LRTSGDVPDQKSAP-QGZVFWFLSA-N	427.505	1.605	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)NCCN3C(=O)[C@H]4[C@H]5C=C[C@@H](C5)[C@H]4C3=O)cc2C1	755082154	KTRHRGBVKNGJCV-VQOQZMAISA-N	442.541	1.624	50	20	IDGD	
COc1cc(CN2CC[C@H](NC(=O)NNC(=O)COc3cccc(C)c3)C2)cc(OC)c1	755088344	XBYDZVPGEMVNFG-SFHVURJKSA-N	442.516	1.996	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)N[C@@H]1CCN(c2c(F)cccc2F)C1=O	755166398	PAPBUVXTCZJUBF-QGZVFWFLSA-N	440.410	1.900	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)NNC(=O)c2cncc(NC(C)=O)c2)cc1Cl	757738724	UAPZHKDIOXCYTH-UHFFFAOYSA-N	435.824	1.712	50	20	IDGD	
Cn1c(N)c(C(=O)/C(C#N)=C\c2cn(-c3ccccc3)nc2C(C)(C)C)c(=O)n(C)c1=O	758419010	TYLPRVYVOHSOGR-KAMYIIQDSA-N	432.484	1.939	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccc(F)cc2)cc1Br)C(=O)Nc1ccccn1	758837392	AUAAINALYIRKPO-UHFFFAOYSA-N	447.224	1.569	50	20	IDGD	
CC1(C)C(=O)N(C[C@](C)(O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c2ccccc21	760052859	GJMXOJHVSVCHKH-MBSDFSHPSA-N	439.468	1.049	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cnc([C@@H]3CCCO3)s2)cc1	760264583	SDNZYVXCQCWOCS-AWEZNQCLSA-N	438.531	1.385	50	20	IDGD	
Cc1c(I)cccc1C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	760300788	HSFJOXSHIJDMMO-UHFFFAOYSA-N	448.224	1.650	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)CCn1c(S)nc2ccccc2c1=O	760439275	IZRKHRCDFNHNHL-UHFFFAOYSA-N	435.506	1.138	50	20	IDGD	
CC1(C)C(=O)N(C[C@@](C)(O)C(=O)NNc2cccc(S(C)(=O)=O)c2)c2ccccc21	760489220	DAKJNQLAJCRZPT-OAQYLSRUSA-N	431.514	1.609	50	20	IDGD	
C[C@H](CC(=O)NNC(=O)CCCc1ccccc1)NS(=O)(=O)c1cccnc1Cl	760520471	QKRFWQJRNIJIIB-CQSZACIVSA-N	438.937	1.962	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)NC1CCN([C@H]2CCCC[C@H]2O)CC1	761743581	VRERHYNSBFYCES-DLBZAZTESA-N	436.578	1.886	50	20	IDGD	
O=C(NNC(=O)c1ccncc1)C(=O)Nc1ccnn1Cc1ccccc1Br	763463261	CWROBLWKPFCWOP-UHFFFAOYSA-N	443.261	1.489	50	20	IDGD	
CCNC(=O)N1CCc2ccc(NC(=O)C(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)cc21	763468681	RLMCWZCGCWLJPP-UHFFFAOYSA-N	440.416	1.087	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)Nc1ccc(F)cc1OCC1CC1	763570787	IABUNIROZYXNBR-GOSISDBHSA-N	429.404	1.540	50	20	IDGD	
CCOC(=O)c1cc(F)c(F)cc1NC(=O)C(=O)NNC(=O)[C@@H]1COc2ccccc2O1	763571351	MLXYSRJVIMVRHP-INIZCTEOSA-N	449.366	1.067	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc(OC)c1C(C)C	763573210	QHDABJFZWLZVTA-SFHVURJKSA-N	443.456	1.753	50	20	IDGD	
COc1ccc(C(C)(C)C)cc1NC(=O)C(=O)NNC(=O)[C@H]1COc2ccccc2O1	763573414	RYENHATXZNIHMH-GOSISDBHSA-N	427.457	1.919	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)Nc1ccc2c(c1)OC1(CCCC1)O2	763573878	VTRDHPWOEXUHRW-GOSISDBHSA-N	439.424	1.654	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)[nH]n1)C(=O)Nc1cccc(N2CCCNC2=O)c1	763604216	IORVDHAQXMHMKD-UHFFFAOYSA-N	447.455	1.396	50	20	IDGD	
CCCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)cc1	763727366	DJKGNPSHEYWUCW-UHFFFAOYSA-N	437.500	1.365	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2cccc(-c3nnc(C)n3C)c2)c1	763771557	CDAMIIDNGJZHCZ-UHFFFAOYSA-N	438.444	1.207	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccccc1N1CCOC1=O	763865402	KHSYWZXNEFMHQF-LBPRGKRZSA-N	430.392	1.336	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(C)nc2N(C)C)cc1	763870647	BICSNIWCUIALIX-AWEZNQCLSA-N	427.461	1.212	50	20	IDGD	
COC(=O)N(C)Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)cc1	763873091	QRJLRDVCUJVWSM-ZDUSSCGKSA-N	446.435	1.577	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccc3c(c2)OC2(CCCCC2)O3)n1	763881267	MRTUEBSXCJYWEW-UHFFFAOYSA-N	427.461	1.718	50	20	IDGD	
CNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2c(C)cc(Cl)cc2C)c1	763884997	ZYIYPOVRYKWTHZ-CYBMUJFWSA-N	446.891	1.870	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cnn(C[C@@H]3CCCO3)c2)cc1OC	763910326	DTPXOSDEPUCPRY-INIZCTEOSA-N	445.476	1.259	50	20	IDGD	
CN1CCN(Cc2cccc(NC(=O)C(=O)NNC(=O)c3cc(Cl)ccc3O)c2)CC1	763976848	GESLHQZSMLJRBU-UHFFFAOYSA-N	445.907	1.193	50	20	IDGD	
CC(C)COc1cccc(NC(=O)C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c1	764078673	ZRSPXSJGOSJUSK-UHFFFAOYSA-N	433.486	1.525	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)cc1C(=O)NC(C)C	764245145	NKWXCDAERTZVBW-UHFFFAOYSA-N	435.484	1.874	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(OC(F)F)c2)cc1N1CCOC1=O	764252172	CHPHRKVACJBHML-UHFFFAOYSA-N	448.382	1.953	50	20	IDGD	
Cc1cc(I)ccc1NC(=O)C(=O)NNC(=O)Cc1cccnc1	764266001	IBBVWGNBMCVTIJ-UHFFFAOYSA-N	438.225	1.323	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)C(=O)Nc1ccc(C(=O)N(C)C)cc1OC)c1ccccc1	764327603	CLKNWNIYJSWHSJ-MRXNPFEDSA-N	426.473	1.677	50	20	IDGD	
O=C(NNC(=O)C1CCC1)C(=O)Nc1cc(Br)ccc1N1CCOCC1	764336154	ZREVDJRKRLLCCJ-UHFFFAOYSA-N	425.283	1.172	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3OC)[nH]n2)cc1	764377922	SOBQBBUAPCNXFV-UHFFFAOYSA-N	437.412	1.272	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)ccc1C(=O)NC(C)C	764380211	RZWQMECLVZQYEC-UHFFFAOYSA-N	448.426	1.891	50	20	IDGD	
COc1cccc(-c2nsc(NC(=O)C(=O)NNC(=O)Cc3ccccc3C)n2)c1	764411017	GRZHUELSKNFWSG-UHFFFAOYSA-N	425.470	1.851	50	20	IDGD	
Cc1ccc(F)c(OCC(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)c1	765737381	YSIJZMQANYZXNN-UHFFFAOYSA-N	428.464	1.118	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	765752248	PTHWYNQJEUNNOP-UHFFFAOYSA-N	430.936	1.856	50	20	IDGD	
O=C(NCc1nc(C2CC2)cs1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	767149420	ZOQDYZGRKYSWGW-UHFFFAOYSA-N	449.558	1.949	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)NCc2cccnn2)cc1	768578642	HWSIYXCZCZXVFK-WJDWOHSUSA-N	431.456	1.447	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3csc(NC4CC4)n3)cc2)CC1	769017836	WSPCMZPADWWBMR-UHFFFAOYSA-N	436.563	1.410	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)NC1CCN([C@H]2CCCC[C@H]2O)CC1	769160513	JGGUGHFWYHKFJN-DOTOQJQBSA-N	435.481	1.072	50	20	IDGD	
CC[C@@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	770212705	RGWQFLHMSXGWIH-CQSZACIVSA-N	428.511	1.001	50	20	IDGD	
COc1ccc([C@H](CNC(=O)NNc2nc(O)c3cnn(C)c3n2)N(C)C)cc1OC	770336095	NIYKEEWNIXHVHH-ZDUSSCGKSA-N	430.469	1.015	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)N[C@H]3CCCC[C@@H]3N3CCOCC3)nc21	770410534	ASRLESFYCINAFL-GJZGRUSLSA-N	432.529	1.556	50	20	IDGD	
Cc1cccc(F)c1NNC(=O)C(=O)Nc1cnn(CC(=O)N2C[C@H](C)O[C@@H](C)C2)c1	770822110	UKWBAIJRTJXRQR-KBPBESRZSA-N	432.456	1.048	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)cc1	771010999	CUVNQXYNJXBZAM-LBPRGKRZSA-N	447.485	1.801	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)c1ccc2c(c1)C(=O)N(C[C@H]1CCCO1)C2=O	771933363	GKJVFPWXEHRDKA-UKRRQHHQSA-N	445.472	1.200	50	20	IDGD	
Cc1ccc(CN2C(=O)CC[C@@H]2C(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)cc1	772883430	AIGJNMUUEYXJHD-GOSISDBHSA-N	442.903	1.603	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccco3)nc3ccccc23)nn1C	773494605	VNGMARNOPWJQNO-UHFFFAOYSA-N	434.412	1.637	50	20	IDGD	
O=C(NNc1ccc2ccccc2n1)C(=O)Nc1ccc(F)c(N2CCCS2(=O)=O)c1	773661729	LWWYJBLMTTVXHP-UHFFFAOYSA-N	443.460	1.996	50	20	IDGD	
CN1CCN(C(=O)Cc2ccc(NC(=O)C(=O)NNc3cccc(Cl)c3)cc2)CC1	773729717	VGAUMEUMTZGDIV-UHFFFAOYSA-N	429.908	1.738	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCCCCC(=O)OC(C)(C)C)c2ccccc2c1=O	774342266	ZLKWQNAPRSBOIM-UHFFFAOYSA-N	431.493	1.872	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)COc2ccccc2O)cc1C(F)F	776035905	OEPHRFHFZWIANG-UHFFFAOYSA-N	429.401	1.965	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)NC[C@H]2COC3(CCCCC3)O2)c2ccccc2c1=O	776064625	LWJBZOYRJBDMDT-HNNXBMFYSA-N	443.504	1.997	50	20	IDGD	
CN(C(=O)OC(C)(C)C)[C@@H](C(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)c1cnn(C)c1	776312992	VGYJADIZKGRIGI-OAHLLOKOSA-N	432.437	1.698	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)c3cnc(S)[nH]3)c2)cc1	776321004	QBSHKNRVYLGHBQ-UHFFFAOYSA-N	447.498	1.583	50	20	IDGD	
O=C(NC[C@H]1COC2(CCCCCC2)O1)NNC(=O)c1nn(-c2ccccc2)cc1O	776952304	KAVILBPYTMKFKI-INIZCTEOSA-N	429.477	1.988	50	20	IDGD	
CC(C)C[C@H](C(=O)N1CCN(S(=O)(=O)CBr)CC1)N1CCCCC1=O	777779683	PKMFAQWUCBJXDM-CQSZACIVSA-N	438.388	1.240	50	20	IDGD	
Cc1nn(CC(F)(F)F)c(C)c1[C@H](C)C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	778227402	VSJHYHYFZYALMU-JTQLQIEISA-N	436.398	1.603	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CN(C)[C@@H](C)c2cccc(N3CCCS3(=O)=O)c2)cc1	778227803	XIRDEQMUVPDNCZ-KRWDZBQOSA-N	444.557	1.989	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)CO[C@H]2CCCN(C(=O)OC(C)(C)C)C2)nc1C	778422505	PTQPQWZNHHRCGG-AWEZNQCLSA-N	437.497	1.821	50	20	IDGD	
COc1cc(Br)c(NC(=O)C(=O)NNc2ncncc2Cl)cc1OC	782158409	CLXMMYALICMDPG-UHFFFAOYSA-N	430.646	1.992	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2ccc(-n3cccn3)nn2)n(-c2ccc(Cl)cc2)n1	783436277	JFAKYFKXWQVYHB-UHFFFAOYSA-N	437.851	1.892	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2ccc(NC(=O)CN3CCCCCC3)cc2)ncn1	783947956	OKENOPRMCJPALS-UHFFFAOYSA-N	425.493	1.681	50	20	IDGD	
CN(C)C(=O)COc1cccc(NC(=O)C(=O)NNc2ccc(Br)cn2)c1	784341123	WIOOMJDFTRHDIO-UHFFFAOYSA-N	436.266	1.393	50	20	IDGD	
CCCCNS(=O)(=O)c1cccc(NC(=O)C(=O)NNc2ccc(Cl)nn2)c1	784792319	OOZMUTFUKWPMSI-UHFFFAOYSA-N	426.886	1.290	50	20	IDGD	
COCCn1ncc2ccc(NC(=O)C(=O)NNc3ccc(Br)nc3)cc21	784808769	DXHMSZSJJAUHDK-UHFFFAOYSA-N	433.266	1.922	50	20	IDGD	
CN1CCN(C(=O)Cc2ccc(NC(=O)C(=O)NNc3cc(Cl)ccn3)cc2)CC1	784861204	FFMWDKWTLCMDCO-UHFFFAOYSA-N	430.896	1.133	50	20	IDGD	
CCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3cc(C)ccc3C)[nH]n2)cc1	785125438	DJWTWETZGUXXBB-UHFFFAOYSA-N	448.483	1.843	50	20	IDGD	
O=C(NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)NNC(=O)C(=O)Nc1ccccn1	787340591	ICCGAFOYCVVURL-UHFFFAOYSA-N	426.311	1.478	50	20	IDGD	
Cc1cc(C)nc(-n2nc(C)c(CC(=O)NNc3ccccc3S(N)(=O)=O)c2C)n1	788230699	TXVJPSJGXHGTFL-UHFFFAOYSA-N	429.506	1.229	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(Cl)cc2-n2cccn2)cc1OC	788331882	USRABNRVFVMCRW-UHFFFAOYSA-N	443.847	1.943	50	20	IDGD	
O=C1COc2ccc(C=NNC(=O)c3ccc(S(=O)(=O)N4CCCC4)cc3)cc2N1	788703916	SBUGMDJNXUYKSO-UHFFFAOYSA-N	428.470	1.566	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCC(=O)c2cccn21)c1cccc(S(=O)(=O)N2CCCC2)c1	788725903	SNVDOOALPYZCRH-QGZVFWFLSA-N	430.486	1.251	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN(C)[C@@H]2CCN(Cc3ccccc3)C2=O)cc1OC	789524612	AUTQOHWEBADLFH-GOSISDBHSA-N	440.500	1.198	50	20	IDGD	
C[C@H](NS(=O)(=O)c1cccc(C(=O)NNC(=O)CN2CCCC2=O)c1)c1ccccc1	789857908	LGYYVGKMAGIZJI-HNNXBMFYSA-N	444.513	1.110	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)CN1C(=O)N[C@@]2(C[C@@H](C)CC(C)(C)C2)C1=O	790064273	ZQAWZDWXBXOERL-RNODOKPDSA-N	426.514	1.060	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)CCOCC(F)(F)C(F)F	790119891	DFDQLQBLOQIMGM-UHFFFAOYSA-N	428.408	1.356	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)N[C@H](c1cncc(Br)c1)C1CC1	790693385	VSJDPODQGSYNOK-HNNXBMFYSA-N	436.266	1.649	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)NCC(=O)Nc2ccc(I)cc2)n1	790888894	JOUIIIPDIVSEOP-UHFFFAOYSA-N	440.245	1.963	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N2C[C@@H](O)C(C)(C)C2)cc1	791161862	PFUCCYPHCOYRCW-NXIIHZOPSA-N	437.500	1.570	50	20	IDGD	
Cc1cccc(=O)n1C[C@@](C)(O)C(=O)NNC(=O)c1ccc(Br)cc1Cl	792140974	HFRYKJKJKGRNHM-QGZVFWFLSA-N	442.697	1.785	50	20	IDGD	
Cc1c(Br)cc(N)cc1C(=O)OCC(=O)NNC(=O)c1ccc(C#N)cc1	792402936	CZEGUDUHLVAHMB-UHFFFAOYSA-N	431.246	1.829	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)CC3OCCO3)c2)c(C)c1	792774079	NKVLLMYARMQEMZ-UHFFFAOYSA-N	433.486	1.628	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@@H]2[C@H]3[C@H]4C[C@@H]5[C@H]6[C@@H](C[C@H]53)[C@@H]2[C@@H]64)cc1	792804879	YDAZGNSULVEHSD-RDLBJEFKSA-N	429.542	1.157	50	20	IDGD	
CC(C)Oc1ccc(NC(=O)C(=O)NNC(=O)c2cn(C)c3ccccc23)cc1C(N)=O	796998188	BHBDNQMRTFGNJT-UHFFFAOYSA-N	437.456	1.464	50	20	IDGD	
CN(CCNC(=O)NNC(=O)Cc1ccc(F)cc1)S(=O)(=O)c1ccc(F)cc1	798098332	YJGKHEHBFWFDIF-UHFFFAOYSA-N	426.445	1.158	50	20	IDGD	
CNC(=O)CNC(=O)c1cccc(NC(=O)NNC(=O)CSc2ccccc2OC)c1	800596114	JMPUQYGLNDXMJJ-UHFFFAOYSA-N	445.501	1.116	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)c2nn(-c3ccc(F)cc3F)cc2O)c1	801414592	RJLACDSAUFLOCG-UHFFFAOYSA-N	441.350	1.346	50	20	IDGD	
Cc1ccc(S(=O)(=O)NC2CC2)cc1C(=O)NNC(=O)Nc1ccc2c(c1)OCO2	802103567	UPYRIRDOYWHUBH-UHFFFAOYSA-N	432.458	1.631	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCc2nc3cc(C)ccc3n2C)c2ccccc2c1=O	802322114	XZWTUTMKTHTRTP-UHFFFAOYSA-N	433.472	1.756	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(N2C[C@H](C(=O)NNc3ncccc3F)CC2=O)cc1	804219619	CJXLKZSNQIVPPJ-CQSZACIVSA-N	449.508	1.747	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)N1CCN([C@H]2CCN(Cc3ccccc3)C2)CC1	805096979	HMCIPCSNKCNLBC-FQEVSTJZSA-N	437.544	1.942	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1cnc(C2CCCC2)nc1N	806338623	RQMDBFJWFMEGEM-UHFFFAOYSA-N	431.522	1.393	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C2(S(=O)(=O)c3ccccc3)CCOCC2)cc1C	809144991	VLTYWHUXUZZKRK-UHFFFAOYSA-N	446.525	1.853	50	20	IDGD	
O=C(COC(=O)c1cnnc(-c2ccccc2)c1)NNC(=O)[C@H]1COc2ccccc2O1	811287013	QGMHOABWIWEFEO-LJQANCHMSA-N	434.408	1.288	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NC[C@]2(C)OCCc3sccc32)c2ccccc2c1=O	812551205	VNTVOTODLKVCFU-NRFANRHFSA-N	441.513	1.910	50	20	IDGD	
CC(=NNC(=O)c1cccc(OC(F)F)c1)c1ccc(S(=O)(=O)CC(N)=O)cc1	814835157	JFUKYHIXPFZURX-UHFFFAOYSA-N	425.413	1.701	50	20	IDGD	
COC(=O)COc1c(C)cc(C=NNC(=O)Nc2ccc(S(N)(=O)=O)cc2)cc1C	814968315	YKIDOJLCDIFNDT-UHFFFAOYSA-N	434.474	1.658	50	20	IDGD	
COCc1cc(NC(=O)C(=O)NNC(=O)c2cc3ccccc3o2)cc(C(=O)OC)c1	815570079	QGSQUXLVQWKDDK-UHFFFAOYSA-N	425.397	1.766	50	20	IDGD	
CCC(C)(C)OCc1ccccc1NC(=O)C(=O)NNC(=O)[C@@H]1CCc2nncn2C1	815692006	HNFXYELYZKFKOY-CQSZACIVSA-N	428.493	1.332	50	20	IDGD	
Cc1ccc2ncc(C(=O)NNC(=O)[C@H]3CCCN(C(=O)OC(C)(C)C)C3)c(=O)n2c1	816510336	SGWBURUEYPADDI-AWEZNQCLSA-N	429.477	1.411	50	20	IDGD	
O=C(NNC(=O)c1sccc1S(=O)(=O)N1CCOCC1)c1cc2c(s1)CCC2	818515647	OVGVRHLKKGEWOD-UHFFFAOYSA-N	441.556	1.394	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)c2cc(S(N)(=O)=O)oc2C)c1	818745630	LLGCBBTWKVGHBY-UHFFFAOYSA-N	432.252	1.541	50	20	IDGD	
COc1cc(Cl)ccc1S(=O)(=O)NNC(=O)c1csc(N2CCOCC2)n1	844254699	GEBUSLJJUJEGHV-UHFFFAOYSA-N	432.911	1.265	50	20	IDGD	
COc1ccc(/C=C(/C#N)C(=O)O[C@H](C(=O)N[C@]2(C)CCS(=O)(=O)C2)C(C)C)cc1	913229084	FJZPVSNOHXFDJA-NZVOZMKDSA-N	434.514	1.863	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)o1	914753211	OUULGBIQYFHCOF-UHFFFAOYSA-N	427.866	1.801	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1ccc2c(c1)CCCC(=O)N2	915063935	SEUGIFZUHXVQTH-UHFFFAOYSA-N	429.502	1.638	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)[C@H](C)Oc2cccc(Br)c2)c2c(O)nn(C)c2n1	915188762	QEEKBDGWNOOMKW-JTQLQIEISA-N	448.277	1.973	50	20	IDGD	
COc1ccc([C@H](CNC(=O)NNC(=O)c2cccc(N(C)C)c2)N2CCOCC2)cc1	915897128	WQSBMHBUODPYOT-NRFANRHFSA-N	441.532	1.779	50	20	IDGD	
CN1CCN([C@H](CNC(=O)NNC(=O)c2cccc(N(C)C)c2)c2cccs2)CC1	915902663	ZCKJEWQPHZEVLW-GOSISDBHSA-N	430.578	1.747	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCN(c2ccccc2Br)C1=O)c1ccc2c(c1)OCO2	916093150	AAJTWJLIGQDRAE-LBPRGKRZSA-N	446.257	1.992	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)c2cc(Cl)c(-n3cnnn3)cc2OC)cc1	916159452	AAVXOSLGJDCYGJ-UHFFFAOYSA-N	431.840	1.206	50	20	IDGD	
Cc1cccc([C@@H](CNC(=O)NNC(=O)COc2ccc(F)cc2)N2CCOCC2)c1	916435994	RFPREPMBTCAVBD-HXUWFJFHSA-N	430.480	1.917	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@H](c2ccccc2)N2CCOCC2)c1	916508573	AEBZMFWIVPPJSN-LJQANCHMSA-N	446.529	1.108	50	20	IDGD	
COc1cc(CNC(=O)NNC(=O)c2cn(C)c3ccccc23)ccc1OCC(N)=O	916640350	COUZIVKXPCKWRT-UHFFFAOYSA-N	425.445	1.195	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)NCc2ccc(CS(C)(=O)=O)cc2)cc1	918101492	FAWGQRFUMYVKFG-HNNXBMFYSA-N	449.529	1.928	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)CCNS(=O)(=O)c1c(C)cc(C)cc1C	919820549	OPUPRSICAAZWGF-UHFFFAOYSA-N	433.530	1.679	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)CN2C(=O)N[C@@]3(CCc4ccccc43)C2=O)cc1	919836509	VGWYWSPTEVFUIB-HSZRJFAPSA-N	436.468	1.169	50	20	IDGD	
Cc1nn(C)c2nc(Cl)c(C=NNC(=O)Cc3csc(N4CCOCC4)n3)cc12	920369627	NYFPXIXCGBJAMZ-UHFFFAOYSA-N	433.925	1.916	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)c1ccc(N2CCCC2=O)cc1	920983277	HPSDCQLUHSOUDS-AWEZNQCLSA-N	448.483	1.766	50	20	IDGD	
CCCNC(=O)NNC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(Br)cc2)C1	921040950	QWQDNGFOTFIOMX-GFCCVEGCSA-N	447.355	1.590	50	20	IDGD	
O=C(NC[C@H]1CCN(c2ccc(F)c(F)c2)C1)NNC(=O)[C@@H]1COc2ccccc2O1	921076718	IXMRMBMDIGUSHF-YJYMSZOUSA-N	432.427	1.962	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)c1ccc2c(c1)C[C@@H](C)N2S(C)(=O)=O	921234812	XUNXBUKJCDWXNB-CQSZACIVSA-N	447.513	1.636	50	20	IDGD	
CN(C)[C@@H]1CCCC[C@@H]1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	1318405524	BSKQDLKTKZXDRC-ZWKOTPCHSA-N	437.566	1.288	50	20	IDGD	
O=C(NNC(=O)c1ccccc1Cl)c1cc(S(=O)(=O)N2CCSCC2)c[nH]1	1322036184	RAANHXMSVDZDTG-UHFFFAOYSA-N	428.923	1.480	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)N[C@@H](C)CC(=O)OC(C)(C)C	1327238572	MFPRJQSCVVJMRN-NSHDSACASA-N	427.527	1.352	50	20	IDGD	
C[C@H]1CCCN(C(=O)CCNC(=O)NNC(=O)COc2ccc(Br)cc2)C1	1346003890	XTBAWSBJKAWVCR-ZDUSSCGKSA-N	441.326	1.807	50	20	IDGD	
O=C(c1c[nH]c2ncccc12)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1777710907	NNQFLOJCRHBKGK-DYVFJYSZSA-N	425.258	1.697	50	20	IDGD	
O=C(c1ccn2cncc2c1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1778658527	QIJAMMKYDSEJID-RHSMWYFYSA-N	425.258	1.468	50	20	IDGD	
C[C@@H](Nc1ccccn1)C(=O)N1CC[C@]2(CN(C(=O)CCBr)CCO2)C1	1779321735	OHAHENNRMASNQY-KDOFPFPSSA-N	425.327	1.497	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(C1)CN(C(=O)C(C)(F)F)CCO2	1780096875	JSIYJZYMMWKPLF-IBGZPJMESA-N	441.387	1.619	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(CCN(C(=O)[C@H]3C[C@H]3F)C2)C1	1781085619	CFWJAZJEAKUOHN-NBQZKYEYSA-N	435.408	1.322	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cnc4sc(C)cn4c3=O)CCO2)C1	1781218459	HVWJATKTRCNVDT-IFXJQAMLSA-N	438.937	1.525	50	20	IDGD	
CCOC(=O)N1CCC(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](Cl)CC)C3)C2)CC1	1781224478	WNMZRHBFFFKALD-OXQOHEQNSA-N	429.945	1.702	50	20	IDGD	
COc1ccc([C@H](O)C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](F)Br)C3)C2)cc1	1781325828	RSJWMKUAWWHTIT-RLFYNMQTSA-N	445.285	1.249	50	20	IDGD	
O=C(c1cc(O)nc(Cl)c1)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781326718	RQHSTXFEUXDYRU-SWLSCSKDSA-N	436.665	1.575	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(NC(=O)C4CC4)cc3)C2)C1	1781470577	RTXYIOWWKGHXIB-XMSQKQJNSA-N	449.935	1.732	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(O)c([N+](=O)[O-])c3)C2)C1	1781542916	YYCZMIKEPONSRR-IBGZPJMESA-N	437.525	1.595	50	20	IDGD	
CC[C@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](Cl)COC)C1)N(CC)CC	1782171943	HBNXMBVKVIODBZ-XKGFGPFHSA-N	432.005	1.875	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H]2CCNC(=O)C2)C1	1782268955	HYZFQDUJMPUXKU-QABNGEJJSA-N	434.364	1.263	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)COc2ccccc2C#N)C1	1783133697	AJANAJUYTZACEF-LRXVAGHRSA-N	449.935	1.705	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cnc4[nH]ncc4c3)CCO2)C1	1783348859	CNHTWYRXPZAECL-KDOFPFPSSA-N	436.310	1.575	50	20	IDGD	
C[C@H](O)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](Br)Cc1ccccc1)CCO2	1783525793	OAIUTVFVMQLQST-ZSZQSSIHSA-N	425.323	1.203	50	20	IDGD	
Cc1c(F)ccc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](C)Br)C3)C2)c1N	1783532556	KCCYMMLWEDOXBT-XIKOKIGWSA-N	428.302	1.943	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)NC(=O)OC(C)(C)C)[C@H]2C1	1783822091	NSMWFVQZISNHCY-QXKUPLGCSA-N	447.960	1.133	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)C[C@@H]3COc4ccccc4O3)CCO2)C1	1783870853	HIQKPTZCTYNYKB-XFQAVAEZSA-N	438.908	1.300	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cnccn3)C[C@@H]21	1783964484	VQKBLNXADPZPST-VRKREXBASA-N	425.327	1.030	50	20	IDGD	
Cc1nn(C)c(C)c1CC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2	1784512603	LGZDZKMHEBNIJS-RBUKOAKNSA-N	431.364	1.646	50	20	IDGD	
Cc1cc(Cl)cc(C(=O)N2CC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)c1	1785043151	NRDFCCPYBXWCGY-QFIPXVFZSA-N	442.708	1.086	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(-c4ncc[nH]4)cc3)C2)C1	1785156688	ZNDYHDCIEJRFIR-DYESRHJHSA-N	432.908	1.774	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(C(=O)OC)cc3C)C2)C1	1785279205	OWCKQRJLSGCMPH-UWJYYQICSA-N	438.908	1.479	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cn3ccccc3=O)[C@H]2C1	1787016216	HIYNKESHUQEERS-XLPNERPQSA-N	430.332	1.064	50	20	IDGD	
Cc1snc2sc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)[C@H](O)CCl)C[C@@H]43)cc12	1787279230	SVBIMCLQDAGQCN-DEQVHRJGSA-N	443.978	1.859	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)c1c[nH]c2nccc-2c1Cl	1787346926	UXZXIRKHLSOUGC-HPEDKQMDSA-N	441.315	1.361	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc([N+](=O)[O-])[nH]3)[C@H]2C1	1789392880	MKQGVIMHKGEGSS-MNXVOIDGSA-N	443.298	1.690	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4nonc4c3)C[C@@H]21)[C@@H](F)Br	1789922754	MCBUWMJUBWPBHQ-LWWSYDQCSA-N	441.257	1.507	50	20	IDGD	
Nc1ccccc1/C=C/C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]2C1	1789922771	QETVQDAEDRRWEY-JRWYWPFWSA-N	440.313	1.952	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccn4nccc34)[C@H]2C1	1790397729	HGEHVCDFOGDNMR-DNUAJFIVSA-N	449.349	1.959	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc4nccn34)[C@H]2C1	1790411425	AJHBFSPPGYKJMQ-AESZEHBQSA-N	449.349	1.959	50	20	IDGD	
O=C(C[C@H]1NC(=O)NC1=O)NC1(c2ccc(NC(=O)[C@H](F)Br)cc2)CCC1	1790532888	WKPWNNZVXZDNCC-YPMHNXCESA-N	441.257	1.409	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)COc3ccccc3F)C[C@@H]21	1791063419	IGOBPOQLZODVJN-FHIRATQRSA-N	443.313	1.968	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC1(c2ccc(NC(=O)Cn3cc(C)c(O)nc3=O)cc2)CCC1	1792225760	ACQMUSOXALHMGG-MRXNPFEDSA-N	448.907	1.645	50	20	IDGD	
C[C@@H](NNc1ccccc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@](C)(Cl)CCl)C2	1792507897	BZLBMEPXYZZYDF-ITNJMCAHSA-N	443.375	1.818	50	20	IDGD	
Cc1cc(Cl)ccc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCC(=O)NN(C)C)C2	1792666541	LDCTYPFFQCOWEY-YVWYUNDQSA-N	436.940	1.225	50	20	IDGD	
CC(C)(C)OC(=O)N(CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCl)C1CC1	1793105599	FKHVORNRQYGLAP-UKMLZYKCSA-N	429.945	1.624	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc(O)c3ccn(C)c13)C2	1793448303	BFRIGZQPDDSHJG-RMHZUWNSSA-N	434.924	1.890	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](Br)Cc1ccccc1)C2)C(F)F	1795165949	XDOXOLJXBITEGF-LXTVHRRPSA-N	431.277	1.847	50	20	IDGD	
Cn1ccc2cccc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3ccc(B(O)O)cc3)c21	1796188938	COQKLDPBSIELKA-ACDBMABISA-N	431.301	1.424	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)c1cnccc1C(F)(F)F	1796190852	STPMWKJQZCWVHP-MUJYYYPQSA-N	447.222	1.346	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cn1cncn1)[C@H](Br)Cc1ccccc1	1796292280	GYNNYEKKGGQMNX-XMTFNYHQSA-N	446.349	1.923	50	20	IDGD	
O=C(CCCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Cl)Nc1ccccc1	1796361479	RLEGLPNEEDVSIM-FTUNRGFVSA-N	425.888	1.919	50	20	IDGD	
COC(=O)C[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](F)Cl	1796809972	BPPCOEYJFMYWRI-WPLOAARJSA-N	449.907	1.615	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1csc2c1CCCC2	1797393169	MMJKTSOCBIHMDE-USGNIVHTSA-N	448.589	1.203	50	20	IDGD	
Cc1cnc(Cl)c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Br)c1	1799347443	LFHGAXLFPILXGB-LYIQGSDWSA-N	434.693	1.937	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@](C)(O)C(F)(F)F)C2	1800640130	KSBTUPITQPAOFT-UKRLYRRISA-N	431.249	1.063	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H]2C[C@@]2(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Cl)C3)C1	1800714483	JTAWKCABHGJWOC-CMVVLZHBSA-N	445.919	1.367	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)ccc1O	1800754583	QZCOZLCOPBYHPN-JWBKOJIWSA-N	439.472	1.484	50	20	IDGD	
COc1ccc(F)cc1CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2	1801100867	PEOZRDHQGOFGNJ-CZAMWMTLSA-N	447.276	1.657	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)[C@@H]2C[C@@H]2F)[C@@H]1c1cccnc1	1803972427	WAGNJVIXONUZGJ-WETNBHBUSA-N	440.479	1.579	50	20	IDGD	
Cc1ccc(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)s1	1805409023	MRNGKFGODPDHKG-WIYYLYMNSA-N	449.341	1.765	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC2(CCCN(C(=O)C[C@@H]3CCCCO3)C2)CC1	1806596345	XGLWCBMGLXNCBK-KRWDZBQOSA-N	443.548	1.489	50	20	IDGD	
COc1cccc(C(=O)N2CCCC3(CCN(C(=O)CCC(=O)NN(C)C)CC3)C2)n1	1807878424	DBRQJRBFOMKXFN-UHFFFAOYSA-N	431.537	1.308	50	20	IDGD	
COCCn1ccc(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](Cl)COC)[C@@H]2c2cccnc2)n1	1808659040	GARWDFMFJHBRQI-JENIJYKNSA-N	449.939	1.498	50	20	IDGD	
Cc1ccncc1CCC(=O)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1	1809975047	QUOIJYJGAQSQDM-UHFFFAOYSA-N	449.360	1.547	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2cc(C(C)=O)[nH]n2)[C@H]1c1cccnc1	1813029274	HDMJCZWOUXZPFB-VKJFTORMSA-N	433.896	1.581	50	20	IDGD	
C[C@H](NC(=O)c1ccccc1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](O)CCl)n[nH]1	1814875566	DASVESDJOVIZCX-XKQJLSEDSA-N	447.923	1.820	50	20	IDGD	
CNCCCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1)CC2	1814962212	QROUISUKAQQFNS-UQJRAWQTSA-N	445.549	1.189	50	20	IDGD	
N[C@H](C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](F)Br)CC2)c1ccccn1	1815018455	DTKXYEMKICTJQI-HJIKLVIJSA-N	442.314	1.841	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](C)NS(=O)(=O)CC)n[nH]1	1815167450	KKTLDIMLPLTCLR-SGMGOOAPSA-N	433.962	1.747	50	20	IDGD	
Cc1noc(C)c1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1816401705	FRZLEBMCETXYAD-KRWDZBQOSA-N	437.265	1.314	50	20	IDGD	
CC(C)CNC(=O)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCBr)n[nH]1	1816781315	WXZLCWFFTUGWNC-ZDUSSCGKSA-N	428.331	1.959	50	20	IDGD	
O=C1C[C@@H](C(=O)N2CCCC[C@H]2c2cc(NC(=O)CCBr)n[nH]2)CCN1	1816784810	NYFKHSXXMLYLRL-AAEUAGOBSA-N	426.315	1.713	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](N)Cc3cccnc3)sc2C1	1817192598	QDDJBCSPEFHCOC-MJBXVCDLSA-N	437.953	1.274	50	20	IDGD	
Cc1ccnc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)c1	1818190558	MPCVZORCYMGZCK-LJQANCHMSA-N	433.277	1.413	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](O)CCl)CC2)c1n[nH]c2ccc(F)cc12	1819205593	DYYBIDPDRIJGLC-TVQRCGJNSA-N	437.884	1.984	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cnccc3C(=O)NN)n[nH]2)n[nH]1	1819403425	LNRWSNRPWHWABF-MRXNPFEDSA-N	437.464	1.059	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](C)N3CCN(C)CC3)sc2C1	1822693196	PFGPQKANRKAVEF-RDBSUJKOSA-N	428.002	1.708	50	20	IDGD	
O=C(N[C@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1)c1ccc[n+]([O-])c1	1823001459	FYIZKXXWBPSBMF-JOYOIKCWSA-N	429.271	1.693	50	20	IDGD	
O=C(Cn1ccccc1=O)N[C@@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1	1823002369	DAGGVOIAYCXURJ-OTYXRUKQSA-N	443.298	1.608	50	20	IDGD	
COc1cc(C(=O)N[C@@H]2CCc3nc(NC(=O)[C@H](F)Br)sc3C2)nn1C	1823007057	KMRSHYSHAMEONO-KRTXAFLBSA-N	446.302	1.802	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H]2CCCS2)n[nH]1	1823010722	IFELMYCZRMEKSH-CVEARBPZSA-N	443.533	1.610	50	20	IDGD	
O=C(NCCC(=O)N1CCC([C@H]2CCCCN2C(=O)[C@H](O)CCl)CC1)c1ccc[nH]1	1824180691	LUVFEXVYRXUMJK-QZTJIDSGSA-N	438.956	1.354	50	20	IDGD	
Cc1ncoc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827050941	HGKWZXYZCOINNF-IBGZPJMESA-N	425.294	1.210	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)C(F)(F)Cl)CC1	1828925538	KFGJMINQWHOGKQ-OAHLLOKOSA-N	443.882	1.750	50	20	IDGD	
Cc1noc(C)c1CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830358172	MNRTWOJUJQPZGR-NRFANRHFSA-N	441.956	1.945	50	20	IDGD	
Cc1cnn([C@H](C)C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)c1	1830370320	QAARBOPFVIJODV-UZLBHIALSA-N	426.945	1.474	50	20	IDGD	
C=CCOCCCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)Br)C2)C1	1831412789	DLCIEJAEQZKMQR-CRAIPNDOSA-N	433.343	1.209	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@](C)(O)C(F)(F)F)CC2)CC1	1833644168	MDVRDWYLLACKNC-PBHICJAKSA-N	427.895	1.889	50	20	IDGD	
Cc1cnc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)s1	1833805290	MJFJEFQOZISUTQ-LRDDRELGSA-N	432.340	1.305	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)CCc3ccco3)CC2)CC1	1833842854	POYPCPBHQUCIMC-UHFFFAOYSA-N	447.580	1.157	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3ccnn3C)CC2)CC1	1834214592	RXFNVQABCNTXDC-CYBMUJFWSA-N	426.359	1.389	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3csc(N)n3)CC2)CC1	1834752870	TZXXMXQOFVZXQE-CQSZACIVSA-N	429.974	1.164	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)COc3ccccc3)CCO2)C1	1834953958	HMLYZXAYLJUVEM-UXHICEINSA-N	445.343	1.758	50	20	IDGD	
Cc1ccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)cc1	1835084397	CSVZRMDVAISYDO-MJGOQNOKSA-N	443.313	1.684	50	20	IDGD	
CN1CCc2cc(C(=O)NC3CCN(C4CCN(C(=O)[C@@H](O)CCl)CC4)CC3)ccc21	1835381790	NXESQHKHXDFZDS-NRFANRHFSA-N	448.995	1.464	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCC(OC2CCN(C(=O)CN3C(=O)C=CC3=O)CC2)CC1	1836625251	KDKQXDRXYNCCKC-UHFFFAOYSA-N	439.940	1.175	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC(OC2CCN(C(=O)[C@H]3CCC(=O)N3)CC2)CC1	1836670152	BBHXZUYJPBPIKI-CZUORRHYSA-N	444.370	1.295	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)CCc3cn[nH]c3)CC2)CC1	1837160042	ALILIIJVUFJAAT-GOSISDBHSA-N	426.945	1.595	50	20	IDGD	
O=C(c1cnn2c1OCCC2)N1CCC(OC2CCN(C(=O)[C@@H](F)Cl)CC2)CC1	1838084681	HKZNRSUPVVXLED-MRXNPFEDSA-N	428.892	1.812	50	20	IDGD	
CC(=O)N(C)[C@@H](C)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](C)Br)CC2)CC1	1838106781	LFMXAHKOVIKQRS-KGLIPLIRSA-N	446.386	1.635	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3ccc(Cl)nn3)CC2)CC1	1838449084	RMNDRYWVLCHGCM-HNNXBMFYSA-N	445.347	1.996	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)/C=C/c3cccc(O)c3)CCO2)C1	1839926510	XFCYBFWBZLDYPC-PYEWKGIHSA-N	438.908	1.116	50	20	IDGD	
CCc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)cn1	1840030910	AJSHEHLWMVZDEO-IFXJQAMLSA-N	440.338	1.497	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4cccc(C)c4[nH]3)C2)C1	1840153393	NENPVSBSXIJRPH-HTAPYJJXSA-N	449.935	1.800	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3c(F)cccc3F)C2)C1	1840153897	FGYNYHJQCNKGGY-FOIQADDNSA-N	446.878	1.218	50	20	IDGD	
Cc1cnc(Cl)c(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)c1	1840187954	HGCPFPOZORFBDD-QGZVFWFLSA-N	436.723	1.917	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)cc1	1840726589	BOQHWDNNOFPYBZ-VQIMIIECSA-N	427.860	1.249	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)[C@@H]2C[C@@H]2c2ccc(F)c(F)c2)C1	1841397682	UZEMRVWNQRPYLZ-QZTJIDSGSA-N	440.255	1.265	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@H]1CN(C(=O)OC(C)(C)C)CCO1)C2	1845163321	QEQREPJFAJWVTE-GJZGRUSLSA-N	429.945	1.843	50	20	IDGD	
CS(=O)(=O)Cc1ccc(C(=O)N2CC3(CCCN3C(=O)[C@@H](F)Br)C2)cn1	1845217149	HXTIZAZGHRHHHM-CYBMUJFWSA-N	448.314	1.134	50	20	IDGD	
COc1cc(C)c(C(=O)N2CC3(CCCN3C(=O)CCC(=O)NN(C)C)C2)cc1OC	1846385652	FCRCYRVDNISENO-UHFFFAOYSA-N	432.521	1.202	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@H]2C[C@@H]3C[C@@H]3N2C(=O)OC(C)(C)C)C1	1847080236	ICNZZSSOYAKESA-XUWVNRHRSA-N	441.956	1.842	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1	28604867	NABBCQBADOIPKV-UHFFFAOYSA-N	447.513	1.110	50	20	IDGD	
CC(C)C[C@@H](/N=C1/NS(=O)(=O)c2ccccc21)C(=O)NNC(=S)NC(C)(C)C	726138977	CODNFUSWMJKOIE-CYBMUJFWSA-N	425.580	1.434	50	20	IDGD	
CSCC[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)NNC(=S)NCC1CCC1	727866730	WDOJXENOPKLWHI-OAHLLOKOSA-N	439.563	1.742	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=O)c2cccc(OC(F)F)c2)n(C)c1	728486464	CSBJESLJPYVTTG-UHFFFAOYSA-N	444.460	1.732	50	20	IDGD	
COc1ccc(S(N)(=O)=O)cc1C(=O)NNC(=O)c1cc(F)ccc1Br	728550794	HJAYAIUZXGTIJT-UHFFFAOYSA-N	446.254	1.319	50	20	IDGD	
CC(C)[C@H](C(=O)NNC(=O)C1CCN(c2ncccn2)CC1)n1nnc(-c2ccccc2)n1	728846853	UASSBLUTWVEKDH-GOSISDBHSA-N	449.519	1.391	50	20	IDGD	
CCOC(=O)c1ccc(Br)c(S(=O)(=O)NNC(=O)Cc2cccnc2)c1	728856302	NANCNEKVJRJJNW-UHFFFAOYSA-N	442.291	1.573	50	20	IDGD	
O=C(COc1ccccc1Cc1ccccc1)NNC(=O)NC[C@@H]1CN2CCC[C@H]2CO1	729620137	WKYZHQWOCFPCGL-LEWJYISDSA-N	438.528	1.850	50	20	IDGD	
O=C(NN=c1cc[nH]c2ccccc12)c1ccc(S(=O)(=O)NC[C@H]2CCCO2)cc1	730289135	WHNBYVJTGQOCEK-MRXNPFEDSA-N	426.498	1.871	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)[C@@H]1CCN(c2ccc3c(c2)OCCO3)C1=O	730515605	VTPUYSYFTRYTMJ-HIFRSBDPSA-N	443.431	1.565	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)NCCCN1CCN(Cc2ccccc2)CC1	731359864	PZYJVPDBULZLNW-UHFFFAOYSA-N	427.524	1.907	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)N[C@H]1CCN(c2ccccc2Cl)C1=O	732245529	YQCHVXKXNZEROU-LBPRGKRZSA-N	435.893	1.267	50	20	IDGD	
O=C(COC(=O)c1ccc(Br)cc1O)NNC(=O)c1cccc([N+](=O)[O-])c1	732331167	JERNAXHATAOTCA-UHFFFAOYSA-N	438.190	1.681	50	20	IDGD	
CC(C)c1ccc(-n2c(NNC(=O)CCNS(C)(=O)=O)nc3ccccc3c2=O)cc1	733264365	NCQSHCMEAIOXLB-UHFFFAOYSA-N	443.529	1.892	50	20	IDGD	
Cc1ccc(C#N)cc1S(=O)(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12	734118589	LRBFCWSQIYVQNG-UHFFFAOYSA-N	425.470	1.781	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)Cn1c(=O)cnc2ccccc21	734251847	PKTHMCIKFAQRBI-UHFFFAOYSA-N	429.502	1.617	50	20	IDGD	
CCOC(=O)c1cc(S(=O)(=O)NNC(=O)c2cccc(C#N)c2)cc([N+](=O)[O-])c1C	734807414	OULSFCDHYVCQCN-UHFFFAOYSA-N	432.414	1.575	50	20	IDGD	
COc1ccc(CN2C(=O)c3ccccc3C2=O)cc1C(=O)NNC(=O)c1cnn(C)c1	735445477	WYQKIQPNUWRVPQ-UHFFFAOYSA-N	433.424	1.300	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)[C@@]2(O)CCN(Cc3ccccc3)C2)cc1	735836769	IMXYKHZSSCLAPY-GAJHUEQPSA-N	427.501	1.637	50	20	IDGD	
O=C(COCc1ccccc1)NNS(=O)(=O)c1cc(Br)cc([N+](=O)[O-])c1	737757066	ZJOGKPNPHDEZDJ-UHFFFAOYSA-N	444.263	1.884	50	20	IDGD	
C[C@H](NS(=O)(=O)c1ccc(Cl)cc1)C(=O)NNC(=O)COCc1ccccc1	737923516	PGOPYEFSJSIMHU-ZDUSSCGKSA-N	425.894	1.371	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)c1ccc(S(=O)(=O)Nc2ccccc2)cc1	740852688	DTGZJICKXFIJIO-UHFFFAOYSA-N	432.502	1.553	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)N[C@@H](C)[C@@H]2CN(Cc3ccccc3)CCO2)c1	741277706	CPAGXCRWNYCIJU-KKSFZXQISA-N	442.516	1.937	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCN(Cc2cccc(F)c2)C(=O)C1	741798995	QJLUNESGVPQVJG-UHFFFAOYSA-N	448.882	1.593	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)C[C@H](C)/N=C2/NS(=O)(=O)c3ccccc32)cc1	742480233	HWNWIUMQIGEHAJ-AWEZNQCLSA-N	446.554	1.752	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)N[C@@H]2CC(=O)N(CCOc3ccccc3)C2)c1	743508382	OYHRJMQHPYMFTI-QGZVFWFLSA-N	426.473	1.384	50	20	IDGD	
COCCOC[C@@H]1CCN(C(=O)NNC(=O)[C@H](C)Oc2cccc(Br)c2)C1	743522134	VVLMCDUKLGOLOY-UONOGXRCSA-N	444.326	1.942	50	20	IDGD	
COc1ccc(O[C@@H](C)CNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1	743589725	XGXCKCIOQRFICW-HNNXBMFYSA-N	428.493	1.500	50	20	IDGD	
CCO[C@@H](C)c1noc(CN2CCN(C(=O)NNC(=O)COCc3ccccc3)CC2)n1	743625976	ZYPPAJMPJJDKEY-INIZCTEOSA-N	446.508	1.242	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc2c(c1)N(CC(=O)NNC(=O)c1ccccc1Cl)CC2	744402262	QGFGYLLIBNBWPE-UHFFFAOYSA-N	436.921	1.414	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)CNC(=O)c2c(F)cccc2Cl)cc1	744986826	AHQCOYOVVZVCMC-UHFFFAOYSA-N	432.795	1.085	50	20	IDGD	
CO[C@@]1(C)CC(=NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)C1(C)C	746559455	WSJBDUDONKPMPW-NRFANRHFSA-N	437.562	1.947	50	20	IDGD	
COc1cc(C)nc(NNC(=O)C2CCN(S(=O)(=O)c3ccc4c(c3)CCC4)CC2)n1	746623778	PVVDQUZVTRJSQH-UHFFFAOYSA-N	445.545	1.826	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNS(=O)(=O)c2cc(C(=O)O)cc(Cl)c2C)c1	747595903	JYQDWVJHNNPMPU-UHFFFAOYSA-N	428.850	1.987	50	20	IDGD	
O=C(NNC(=O)C1CCN(S(=O)(=O)c2cccc(C(F)(F)F)c2)CC1)c1ccc[nH]1	747663109	ZOYCYORZIDGLQZ-UHFFFAOYSA-N	444.435	1.895	50	20	IDGD	
O=C(CCN1C(=O)[C@H]2CCCC[C@H]2C1=O)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1	748512676	SNOMOKHNXGGPFR-OKILXGFUSA-N	447.435	1.989	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)Cn1cnc2sccc2c1=O	748594963	ZZYUXUJEFMJLIM-UHFFFAOYSA-N	435.531	1.678	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)[C@H](C)Nc2ccccc2OCC(=O)N2CCOCC2)c1	748601470	KUBMFSNWARYXJL-KRWDZBQOSA-N	440.500	1.494	50	20	IDGD	
CCCCO[C@@H]1C[C@@H](NC(=O)NNC(=O)c2csc(N3CCOCC3)n2)C1(C)C	748968899	JBBBCKOTFDAMHD-HUUCEWRRSA-N	425.555	1.908	50	20	IDGD	
C[C@@H]1CN(S(=O)(=O)c2ccc(C(=O)NNC(=O)CCc3ccccc3)cc2)C[C@@H](C)O1	749804446	YQBSQJBXLXHXGO-IAGOWNOFSA-N	445.541	1.878	50	20	IDGD	
N#CCCn1cc(/C=C(\C#N)C(=O)NS(=O)(=O)N2CCOCC2)c(-c2ccccc2)n1	750723131	AJORROQXDZJXOA-GHRIWEEISA-N	440.485	1.064	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)c1ccc(Br)c(O)c1	750809968	NXRRZEWRYFTUSO-UHFFFAOYSA-N	427.280	1.523	50	20	IDGD	
O=C(NCc1cc(Cl)cc2c1OCC2)NNC(=O)C1CCN(c2ncccn2)CC1	754183604	IXSIWCOQRJYUBZ-UHFFFAOYSA-N	430.896	1.812	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)[C@@]23CCC(=O)N2c2ccccc2S3)c2ccccc2c1=O	754717084	KNFOMALFTLBJII-NRFANRHFSA-N	435.465	1.324	50	20	IDGD	
CS(=O)(=O)Cc1ccccc1NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1	756268551	BOENCAMMNFCCQX-UHFFFAOYSA-N	432.506	1.091	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)Nc2ccc(C)c(S(N)(=O)=O)c2)cc1	756637900	KXKPXAUAWIVFBU-CYBMUJFWSA-N	436.490	1.661	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)Nc2ccc(NS(C)(=O)=O)cc2)cc1	756703419	ATLNDOHZYIJULW-ZDUSSCGKSA-N	434.474	1.881	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cc(C(=O)NNC(=O)C(C)(C)O)ccc1Cl	756797911	UGWRGJJUDOBPIP-UHFFFAOYSA-N	441.893	1.681	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccn(-c3ncccc3F)n2)c1	757782322	CFZNPMDDLFFLPS-UHFFFAOYSA-N	447.452	1.123	50	20	IDGD	
CC(=O)N1CC[C@@H](NC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])c2ccccc21	757793641	JPRSGOPRSMDPTB-OAHLLOKOSA-N	427.417	1.802	50	20	IDGD	
COCc1nc(OC)c2c(C)c(C(=O)N([C@H]3CCS(=O)(=O)C3)N(C)C)sc2n1	757867768	VEYBZSYEARSFMK-NSHDSACASA-N	428.536	1.261	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3ccc(Cl)c(C#N)c3)cc2)CC1	758015891	CZHRVWCLDXTHCY-UHFFFAOYSA-N	433.921	1.905	50	20	IDGD	
CC(=NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1)c1ccc(N)cc1C	758118447	OVUSOEZSPAKXFL-UHFFFAOYSA-N	443.573	1.732	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)N[C@@H]2CCO[C@H](c3ccc(F)cc3)C2)c2ccccc2c1=O	758715370	QJJQTVCULPWZNC-QAPCUYQASA-N	439.447	1.937	50	20	IDGD	
Cc1nc2c3ccccc3nn2c(C)c1CCC(=O)NNC(=O)C(=O)Nc1ccccn1	758833893	KHPRWNGPLSIVGB-UHFFFAOYSA-N	431.456	1.613	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1	759266835	RMKDEEIDOUAAEZ-UHFFFAOYSA-N	444.488	1.898	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)NC1CCN(c2cccnn2)CC1	759645830	VIQQLAQZFSKLCO-UHFFFAOYSA-N	449.309	1.617	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)[C@H]2CCCN(S(=O)(=O)c3ccc(F)cc3)C2)nc1	759730457	HZIZJCIOZKPKOK-AWEZNQCLSA-N	436.465	1.551	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)c1cnn(-c2ccccn2)c1C(F)(F)F	760439408	LFZXIAMQYYTRKO-UHFFFAOYSA-N	442.398	1.962	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)NCc1ccc(N2CCOCC2)nc1	761223991	YLMMIALUZBRYTO-UHFFFAOYSA-N	431.518	1.550	50	20	IDGD	
CCOC(=O)[C@H]1CCC(=NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)[C@@H](C)C1	761267766	UJIMUFQPIXACRU-HKUYNNGSSA-N	428.533	1.916	50	20	IDGD	
O=C(NNC(=O)c1ccncc1)C(=O)Nc1ccc(S(=O)(=O)c2ccc(F)cc2)cc1	763461951	FJUPXPCGLNPHSP-UHFFFAOYSA-N	442.428	1.453	50	20	IDGD	
Cc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NNC(=O)c1ccccc1Br	763483382	QSKFCSMESFQOSH-UHFFFAOYSA-N	447.289	1.859	50	20	IDGD	
CC[C@H](C)NS(=O)(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)c2ccccc2O)c1	763530858	JJIAWKYFRKRJQG-ZDUSSCGKSA-N	448.501	1.010	50	20	IDGD	
COc1ccc(NC(C)=O)cc1NC(=O)C(=O)NNC(=O)c1cc(C)nc2ccccc12	763615123	ASCYUZZCYNZRFT-UHFFFAOYSA-N	435.440	1.910	50	20	IDGD	
CCOc1cc2c(cc1NC(=O)C(=O)NNC(=O)COc1ccccc1F)O[C@H](C)C2	763681318	SNFBMTVCSWRGLH-GFCCVEGCSA-N	431.420	1.713	50	20	IDGD	
CN(C)C(=O)c1cc(NC(=O)C(=O)NNC(=O)CC23CC4CC(CC(C4)C2)C3)ccn1	763736956	VPEXZTARBGDECU-UHFFFAOYSA-N	427.505	1.476	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)C(=O)Nc1ccc2c(c1)OC1(CCCC1)O2	763790610	LOMTWSGLADODBN-UHFFFAOYSA-N	449.423	1.777	50	20	IDGD	
CN(C)c1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)c1nnc(O)c2ccccc12	763790612	LWDSVDHUJBYDDG-UHFFFAOYSA-N	428.836	1.455	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)C1CCN(C(=O)OCc2ccccc2)CC1	763819964	IFHIBRYLQVIAKY-UHFFFAOYSA-N	439.472	1.008	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)Cc1csc(-c2ccccc2Cl)n1	763824468	KXZPFRCXMYKDCT-UHFFFAOYSA-N	429.889	1.978	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(C(=O)NC)c2)cc1OC	763912759	SIGQBAHFOGILTQ-UHFFFAOYSA-N	442.472	1.633	50	20	IDGD	
CSc1nnnn1-c1cccc(NC(=O)C(=O)NNC(=O)Cc2ccc(Cl)cc2)c1	763936636	MTHLEWTWGILTBW-UHFFFAOYSA-N	445.892	1.366	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1ccn(-c2ccccc2Cl)n1	764007095	ZNZRIBCMZCIRTH-UHFFFAOYSA-N	441.831	1.697	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccccc2C(=O)N2CCC(C)CC2)c(O)c1	764108021	ACZOVXAWPCNUSR-UHFFFAOYSA-N	438.484	1.972	50	20	IDGD	
Cn1c(C(C)(C)C)nc2cc(NC(=O)C(=O)NNC(=O)[C@H]3Cc4ccccc4O3)ccc21	764153126	IXTJZJSIXVFPAK-GOSISDBHSA-N	435.484	1.960	50	20	IDGD	
CCCNC(=O)[C@H]1CN(C(=O)C(=O)NNC(=O)CCc2ccccc2)c2ccccc2O1	764193996	XNCBPRXGBMUCFR-LJQANCHMSA-N	438.484	1.087	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(OC)c(NC(=O)C(=O)NNC(=O)CCC(C)C)c1	764198833	HIKPNPNGGMCHFI-UHFFFAOYSA-N	442.538	1.248	50	20	IDGD	
CS(=O)(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)CCCc2ccccc2)c1	764224786	SKXKLSISFGLDDR-UHFFFAOYSA-N	437.905	1.852	50	20	IDGD	
C[C@@H]1COCCN1c1ccc(NC(=O)C(=O)NNC(=O)c2cccc3ncccc23)cc1	764252477	GHHAFLIZQDHDAX-OAHLLOKOSA-N	433.468	1.860	50	20	IDGD	
CC(C)(C)Oc1ccccc1NC(=O)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	764259844	KGTZMVGDBPEPNI-UHFFFAOYSA-N	440.504	1.656	50	20	IDGD	
C[S@](=O)Cc1cc(NC(=O)C(=O)NNC(=O)CCc2ccccc2O)ccc1Cl	764288477	HLWWIFXKFQVZAN-LJAQVGFWSA-N	437.905	1.643	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c(Br)n1	764342042	AAPZXPDNPRRYSN-UHFFFAOYSA-N	443.261	1.738	50	20	IDGD	
CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	765369221	OTIAVOAQQZUDJJ-OAHLLOKOSA-N	448.501	1.875	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3c(C)noc3C(F)(F)F)CC2)cc1	766647221	BKHIIJSIFGYZLW-UHFFFAOYSA-N	439.438	1.889	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cncc(-c4cnn(C)c4)c3)CC2)cc1	766647299	DDNPYXUBNLFVAW-UHFFFAOYSA-N	447.543	1.369	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)COc1ccc2c(C)cc(=O)oc2c1	767239793	FSWCNZAGCMYWFE-UHFFFAOYSA-N	438.436	1.722	50	20	IDGD	
CC(C)C(=O)NNS(=O)(=O)c1ccc(F)c2ncc(I)cc12	768269498	PUZATPVYOZXULR-UHFFFAOYSA-N	437.234	1.944	50	20	IDGD	
CC[C@@H](Nc1c([N+](=O)[O-])c(C)nn1C)C(=O)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	768276375	ICTKPWDYMHSADA-CYBMUJFWSA-N	444.427	1.818	50	20	IDGD	
NS(=O)(=O)c1cccc2c(C(=O)NNC(=O)c3cc(-c4ccccc4)on3)nccc12	768468129	JDWMNPAFRKFTSJ-UHFFFAOYSA-N	437.437	1.612	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)Nc1cccc(OCC(=O)N(C)C)c1	769227731	JAVUZGHVRQFIPQ-UHFFFAOYSA-N	436.490	1.714	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)NC(C(N)=O)C(N)=O)c(C)n1-c1cccc(C(F)(F)F)c1	769757427	YBNJKRMQEIVJOL-QPEQYQDCSA-N	433.390	1.475	50	20	IDGD	
COC(=O)CCCOc1ccc(CNC(=O)NNc2nc(O)c3cnn(C)c3n2)cc1	770394569	CRJMYGDBXJKZSD-UHFFFAOYSA-N	429.437	1.227	50	20	IDGD	
C[C@@H](NC(=O)c1ccc(Br)s1)C(=O)NNc1nc(O)c2cnn(C)c2n1	770975016	SOJRBBVSALCFSD-ZCFIWIBFSA-N	440.283	1.155	50	20	IDGD	
CC(C)(C)OC(=O)N1CCSC[C@H]1CC(=O)NNC(=O)COc1ccccc1O	772081346	MPVDYEDSKYDVMA-CYBMUJFWSA-N	425.507	1.661	50	20	IDGD	
CNC(=O)COc1cccc(CC(=O)OCC(=O)C(C#N)=C2N(C)c3ccccc3N2C)c1	772362899	JCWPAQWZYYSHQA-UHFFFAOYSA-N	448.479	1.788	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)ncc1Br	773544638	AMBDBSLZFUAZAX-UHFFFAOYSA-N	430.262	1.893	50	20	IDGD	
CS(=O)(=O)N1CCc2c(NC(=O)C(=O)NNc3ccc4ccccc4n3)cccc21	773655444	PFXFJKWEWYTLOR-UHFFFAOYSA-N	425.470	1.639	50	20	IDGD	
COC(=O)CNC(=O)c1ccc(NC(=O)C(=O)NNc2cccc(C(F)(F)F)c2)cc1	773743676	GWLCVNBPRXUWPG-UHFFFAOYSA-N	438.362	1.690	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccccc1C(F)(F)F)NNc1nc(-c2ccncc2)no1	774412189	JQEQIOJABQZEDZ-UHFFFAOYSA-N	442.379	1.572	50	20	IDGD	
O=C(Nc1cccc(C(=O)N2CCN(S(=O)(=O)CBr)CC2)c1)C1CC1	777777505	KGRBWZHRLITYEY-UHFFFAOYSA-N	430.324	1.475	50	20	IDGD	
O=C(c1ccc(C(=O)N2CCN(S(=O)(=O)CBr)CC2)cc1)c1cc[nH]c1	777831633	GFSMQDPSTWELOP-UHFFFAOYSA-N	440.319	1.686	50	20	IDGD	
COc1ccc(N2CCN(C(=O)/C=C/C(=O)NNc3cccc([N+](=O)[O-])c3)CC2)cc1	778391441	LLFVKVKZMGPJAN-MDZDMXLPSA-N	425.445	1.952	50	20	IDGD	
O=C(COc1ccccc1-c1ccccc1)NNC(=O)[C@H](O)[C@H](O)c1nc2ccccc2[nH]1	779580427	ZQPMWLUXENFVNV-FCHUYYIVSA-N	446.463	1.851	50	20	IDGD	
COc1cccc(NNC(=O)NCc2ccccc2OCC(=O)NC[C@H]2CCCO2)n1	779982051	IYIOHMJOGGGUPF-MRXNPFEDSA-N	429.477	1.591	50	20	IDGD	
Cc1cc(N2C[C@@H](C(=O)OCC(=O)NNC(=O)c3ccc(C#N)cc3)CC2=O)ccc1F	780182084	MOYJXUKLEYXDOA-INIZCTEOSA-N	438.415	1.363	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(C)c(NC(=S)NNC(=O)Nc2noc(C)n2)c1	781111632	NMESHLXRIJBEBG-UHFFFAOYSA-N	441.539	1.740	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)[C@H]2C[C@@]23CCN(C(=O)OC(C)(C)C)C3)c1	781288687	XFDOULZPDHRJJL-OPAMFIHVSA-N	431.489	1.946	50	20	IDGD	
COC(=O)[C@@H]1[C@@H](O)CCCN1C(=O)CCC(=O)C(C#N)=C1N(C)c2ccccc2N1C	781456709	ILARKDYXBOBLQC-ICSRJNTNSA-N	426.473	1.182	50	20	IDGD	
CCc1noc(-c2ccc(C)c(NC(=O)C(=O)NNc3ccc(-n4cccn4)nn3)c2)n1	783432940	INBIDIMBICFRRY-UHFFFAOYSA-N	433.432	1.665	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1ccc(CCC(F)(F)F)cc1	784005009	ODWXXABNDZJOEV-UHFFFAOYSA-N	442.419	1.759	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)[C@H]2CC=CC[C@H]2C(=O)N2CCOCC2)cc1OC	784296211	LJPDMTXQCGYCDM-ZWKOTPCHSA-N	445.516	1.686	50	20	IDGD	
O=C(NNc1ccnc(F)c1)C(=O)Nc1ccc2c(ccn2CC(=O)N2CCOCC2)c1	784847779	BVKLZGMYGVIJOD-UHFFFAOYSA-N	440.435	1.116	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)C(=O)Nc1cccc(C(=O)N2CCCCC2)c1	785067866	QLWVOMHAVANGLY-UHFFFAOYSA-N	448.483	1.289	50	20	IDGD	
Cc1cc(NC(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)ccc1C(N)=O	785847523	LLHXDFCVJGLZHD-UHFFFAOYSA-N	434.497	1.735	50	20	IDGD	
CCS(=O)(=O)CCn1cc(C)c(NC(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)n1	786715524	HHODADZUCALKLB-UHFFFAOYSA-N	437.566	1.995	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCc2ccc(S(C)(=O)=O)s2)cc(OC)c1OC	786873730	HEBXTISSZIJHKI-UHFFFAOYSA-N	443.503	1.322	50	20	IDGD	
CN1CCN(C(=O)NNC(=O)[C@@H]2CCCN(C(=O)c3ccc(Cl)c(Cl)c3)C2)CC1	788165465	BYMKPYHDNZUDKS-CQSZACIVSA-N	442.347	1.834	50	20	IDGD	
COc1ccc(C(=O)NNc2ccc(-n3ccnc3)nn2)cc1S(=O)(=O)N1CCCC1	788175010	OVOPIRRZYVLYRA-UHFFFAOYSA-N	443.489	1.212	50	20	IDGD	
COc1ccc(C(=O)NNc2ccccc2S(N)(=O)=O)nc1I	788223542	JMQMUMXUMOJDCU-UHFFFAOYSA-N	448.242	1.099	50	20	IDGD	
CCOC[C@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(CC)CC)c1)C(C)C	788877925	QAPLXYUEHLZKTM-KRWDZBQOSA-N	428.555	1.722	50	20	IDGD	
Cc1cc(C)nc(-n2nccc2NC(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)n1	789309325	IJBVDHMEGUGEAB-UHFFFAOYSA-N	432.485	1.737	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)CCn1c(S)nc2ccccc2c1=O	791723767	ZFYCDNUUWCQPRK-UHFFFAOYSA-N	428.470	1.310	50	20	IDGD	
O=C(NNc1nc2ccccn2n1)Nc1cccc(S(=O)(=O)NCc2ccco2)c1	792348506	YOUCFLNBFKTMSU-UHFFFAOYSA-N	427.446	1.949	50	20	IDGD	
Cc1nnnn1[C@H](Cc1cccc(F)c1)C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	794732110	VCCYKRIJLQJUSH-GOSISDBHSA-N	447.496	1.298	50	20	IDGD	
CCOC(=O)c1cc(S(=O)(=O)NNC(=O)NCC2CC2)c(F)cc1Br	795302887	PMWNUGDHBRDBMV-UHFFFAOYSA-N	438.275	1.667	50	20	IDGD	
Cc1nc2c3cccnc3nn2c(C)c1CCC(=O)NNc1nc(O)c2cnn(C)c2n1	796449279	PAUFHHKMZVMWMP-UHFFFAOYSA-N	432.448	1.353	50	20	IDGD	
C[C@H]1Oc2ccc(NC(=O)NNC(=O)CNC(=O)OCc3ccccc3)cc2NC1=O	797611107	UBFPEHBVIFEHTG-GFCCVEGCSA-N	427.417	1.485	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(C(=O)NNc2cc([N+](=O)[O-])ccc2Br)n(C)c1	800616560	NULRPAMFYCTKRW-UHFFFAOYSA-N	446.283	1.703	50	20	IDGD	
O=C(CCn1nnc2ccccc2c1=O)NNc1cc([N+](=O)[O-])ccc1Br	800620506	RJWRFQWWOVHUGG-UHFFFAOYSA-N	433.222	1.996	50	20	IDGD	
O=C(CN1C(=O)[C@H]2[C@H](C1=O)[C@H]1CC[C@H]2O1)NNC(=O)Nc1ccc(Cl)cc1Cl	802087202	QBTILTGEPCEKDI-HBJVGIJOSA-N	427.244	1.309	50	20	IDGD	
Cc1c(Br)cc(I)cc1C(=O)NNC(=O)C(C)(C)O	803159748	QHBBORUHNQLADQ-UHFFFAOYSA-N	441.063	1.894	50	20	IDGD	
CC1(C)CC(=O)c2cc(NC(=O)C(=O)NNC(=O)Cc3cn4ccccc4n3)ccc2O1	807019857	MPHWZUJEHHVYRJ-UHFFFAOYSA-N	435.440	1.407	50	20	IDGD	
Cc1ccc([C@H](CNC(=O)NNC(=O)COc2ccccc2C#N)N2CCOCC2)o1	807023474	NYWXYEWMJHNFQE-KRWDZBQOSA-N	427.461	1.242	50	20	IDGD	
COc1cccnc1CC(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	807092662	FHMWUJAEPISFNJ-UHFFFAOYSA-N	431.924	1.251	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)Cc1csc(NC(=O)c2cccc(O)c2)n1	807369593	AOJWFDUXNHDQMQ-UHFFFAOYSA-N	436.490	1.580	50	20	IDGD	
CCc1nc(C(=O)NNC(=O)N2CCN(C)CC2)nn1-c1c(Cl)cccc1Cl	807378974	OEQKJLXQQJFIJF-UHFFFAOYSA-N	426.308	1.738	50	20	IDGD	
CC(C)Cc1ccc([C@@H](CNC(=O)NNC(=O)CNC(=O)c2ccco2)N(C)C)cc1	807601698	MEVAUJMBKXCPGK-GOSISDBHSA-N	429.521	1.841	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1cncc(C(F)(F)F)c1	809704285	YFNGDPGXWDFFRX-UHFFFAOYSA-N	430.408	1.878	50	20	IDGD	
CC1(C)CCCc2sc(NC(=O)C(=O)NNC(=O)COc3ccc(C#N)cc3)nc21	810384935	LOVFMHHAUDEHMP-UHFFFAOYSA-N	427.486	1.794	50	20	IDGD	
CCOc1ccc([C@@H](O)C2CCN(CC(=O)NNC(=O)Cc3nc(C)cs3)CC2)cc1	812863817	LTBJMSVXIHLNBR-JOCHJYFZSA-N	446.573	1.986	50	20	IDGD	
CN(CCOc1ccc(S(N)(=O)=O)cc1)C(=O)NNC(=O)c1ccc2ccccc2c1	814279136	IUHFDXNJOKDWIY-UHFFFAOYSA-N	442.497	1.852	50	20	IDGD	
Cc1c(NC(=O)NNC(=O)[C@H]2CCc3nncn3C2)cccc1S(=O)(=O)NC(C)(C)C	814647217	RLTVUZRNEDWAQF-ZDUSSCGKSA-N	449.537	1.079	50	20	IDGD	
COc1cc(C(=O)N(C)C)ccc1NC(=O)NNc1ccccc1S(=O)(=O)N(C)C	814661891	VPHBJZBGUBDQQD-UHFFFAOYSA-N	435.506	1.796	50	20	IDGD	
C[C@@](O)(C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)c1ccc(Cl)cc1	814708477	LQOYBGWQZAUZNL-QFIPXVFZSA-N	430.936	1.907	50	20	IDGD	
Cc1cc(OCc2ccc(C(=O)NNC(=O)C(=O)Nc3ncn(C)n3)cc2)ccc1Cl	815564953	YMBMFZKUBBIIRO-UHFFFAOYSA-N	442.863	1.756	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCc2nncn2C1)C(=O)Nc1ccccc1COCc1ccccc1	815692575	VGPAHHYCBCQRCY-QGZVFWFLSA-N	448.483	1.343	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1cccc(-c2cnco2)c1	815752249	KNYDMMSSRBQIIL-UHFFFAOYSA-N	429.458	1.674	50	20	IDGD	
O=C(CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])NNC(=O)[C@@H]1CCc2nncn2C1	816883534	FIWVFRHLJLRIPL-SNVBAGLBSA-N	441.370	1.417	50	20	IDGD	
CNC(=O)[C@H](C)NC(=O)/C(C#N)=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	817055857	YZLMRXNQJYUFGQ-IGVUGNCQSA-N	428.880	1.237	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)[C@@H]2Cc3ccccc3CN2C(C)=O)c2ccccc2c1=O	834683956	NZJWZUFWKJKWRN-FQEVSTJZSA-N	447.495	1.541	50	20	IDGD	
Cc1c(C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)cnn1-c1ccc(Br)cc1	893185844	UEMROCNWEOETDS-NSHDSACASA-N	441.307	1.139	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN1C(=O)c1cc(Cl)ccc1Cl)[C@H]1CCS(=O)(=O)C1	914719719	ONEDJRVFEFYDJU-IINYFYTJSA-N	448.328	1.180	50	20	IDGD	
CC(=O)c1ccc(CC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1	915802892	WMQJUMYHNHCWJW-UHFFFAOYSA-N	429.498	1.677	50	20	IDGD	
N#Cc1ccc(CS(=O)(=O)CC(=O)NNC(=O)CCSc2ccc(F)cc2)cc1	916140596	JHOWFPGGCHOWCG-UHFFFAOYSA-N	435.502	1.942	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)NCC1(NS(C)(=O)=O)CCCCC1	916253672	FSARBATXYOOQNV-UHFFFAOYSA-N	442.538	1.047	50	20	IDGD	
CCOCc1ccc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1	916426348	MXMRDMXASNFYFZ-UHFFFAOYSA-N	434.518	1.618	50	20	IDGD	
O=C(COC(=O)CS(=O)(=O)Cc1ccc(Cl)s1)NNC(=O)c1ccccc1	916533154	LQILRELRVOVHAQ-UHFFFAOYSA-N	430.891	1.321	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNS(=O)(=O)C2=Cc3ccccc3CC2)cc1	916567461	HXKBWICGSYARJR-UHFFFAOYSA-N	449.554	1.553	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)N[C@H]2CCN3CCC[C@@H]3C2)c2ccccc2c1=O	916573080	HJWDPCWEHMJZDU-JKSUJKDBSA-N	426.521	1.767	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNS(=O)(=O)c2cc(F)ccc2[N+](=O)[O-])cc1	917725385	NODHZBZSMJRUFO-LLVKDONJSA-N	427.410	1.910	50	20	IDGD	
Cc1ccc2nc(CSCC(=O)NNC(=O)c3csc(N4CCOCC4)n3)cn2c1	920275550	ZNXICUQDSNJUQW-UHFFFAOYSA-N	446.558	1.630	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)c2cccc(NC(=O)CCn3ccnc3)c2)cc1	920407093	FAYKNQBOKTUJGM-UHFFFAOYSA-N	432.440	1.624	50	20	IDGD	
O=C(NNC(=O)c1cc(S(=O)(=O)N2CCSCC2)c[nH]1)c1ccc(Cl)cc1	921018861	FSMVESBDMHYVJV-UHFFFAOYSA-N	428.923	1.480	50	20	IDGD	
COCCCN1CCC(NC(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)CC1	1116091200	XJQFDLQPZLYMSE-UHFFFAOYSA-N	441.573	1.465	50	20	IDGD	
NS(=O)(=O)c1ccc(C(=O)NNC(=O)c2ccccc2Cl)cc1Br	1116350939	RZQXZQJOHFLZBX-UHFFFAOYSA-N	432.683	1.825	50	20	IDGD	
COc1ccc(S(=O)(=O)CCC(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)cc1	1116410716	RDCIMOQOIDULAG-UHFFFAOYSA-N	446.460	1.849	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)c2cccc(N3CCNC3=O)c2)cc1C	1318617481	IDBLGWTVMLTWCU-UHFFFAOYSA-N	430.486	1.767	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)c1cn(-c2ccc(Br)cc2)nn1	1320145158	ZPTYQJDXEVMHDU-UHFFFAOYSA-N	439.270	1.316	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)c2ccnc(O[C@H]3CCOC3)c2)CC1	1320381594	DWXVGTZNPLFHGW-INIZCTEOSA-N	434.493	1.657	50	20	IDGD	
C[C@H]1CCCN(S(=O)(=O)c2cc(C(=O)NNc3nncc(N)c3Cl)n(C)c2)C1	1322654592	BXGYNEQLGCZWCI-JTQLQIEISA-N	427.918	1.228	50	20	IDGD	
COc1c(C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)cnn1-c1ccccc1	1342839887	DRYXNRNPGIIPEI-UHFFFAOYSA-N	442.501	1.557	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)c2ccc(S(=O)(=O)NC[C@@H](C)O)cc2)c1C	1346622043	YGQKSAVXRPHPAA-GDBMZVCRSA-N	449.529	1.191	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3nc4ccccc4n(C)c3=O)C2)C1	1777889665	BTEWWSREQGDWHK-SPLOXXLWSA-N	432.908	1.394	50	20	IDGD	
CC(=O)Nc1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](F)Cl)C3)ccn1	1778402762	SZSRKZLZCWWAKC-IDHHARJASA-N	426.876	1.702	50	20	IDGD	
Cc1cnc2c(C(=O)N3CC[C@]4(C3)CN(C(=O)[C@@H](F)Br)CCO4)cnn2c1	1778526046	IASJZIRRVGNEIW-DYVFJYSZSA-N	440.273	1.172	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@]2(CN(C(=O)/C=N/O[C@H]3CCCCO3)CCO2)C1	1779297255	YUVAXKQQCUKPJP-VIEQMYLGSA-N	427.574	1.197	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccnc4c3OCO4)C2)C1	1780030796	ZWKWIZBRVKJYKW-UGSOOPFHSA-N	440.294	1.427	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCOCCOCCOC)C2	1780709635	PXTVKVPJPUCECU-WAOWUJCRSA-N	448.988	1.587	50	20	IDGD	
CCN1CCC(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](F)Br)C2)CC1	1780778549	LTNVGXOTLRKSAB-JTDSTZFVSA-N	448.377	1.923	50	20	IDGD	
O=C(c1nccc2[nH]ccc12)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781332006	YFIQAOFGOFAFSF-RHSMWYFYSA-N	425.258	1.697	50	20	IDGD	
C[C@H](Cc1ccccn1)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781335673	ZCRKSMBSZMIDBV-SIIHOXLZSA-N	428.302	1.781	50	20	IDGD	
CC(=O)N[C@@](C)(C(=O)N1CC[C@@]2(CN(C(=O)[C@@H](F)Cl)CCO2)C1)c1ccccc1F	1781415938	IGVAIJQNQWHAFQ-NSISKUIASA-N	443.878	1.541	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H]1CCCN1C)C2	1781901160	KWPHEKQQKGVIQQ-YIOZNXECSA-N	430.387	1.768	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)cc1O	1782135039	CUODRNRTIVFYSY-SFHVURJKSA-N	430.288	1.598	50	20	IDGD	
O=C(c1nc2cc([N+](=O)[O-])ccc2[nH]1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Cl)CCO2	1782181869	HCWZYEHFBCLVQL-CXAGYDPISA-N	425.804	1.449	50	20	IDGD	
O=C(/C=C/c1cnc[nH]1)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Br)C2	1782431301	BWYYJAUJFZRTLA-RJZPRWFTSA-N	429.290	1.627	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cc4cccnn4c3)CCO2)C1	1783354149	UYRXKKJHUCECSA-APWZRJJASA-N	435.322	1.951	50	20	IDGD	
CC(C)(C)OC(=O)NC12CC(C(=O)N3CC[C@]4(CN(C(=O)[C@@H](F)Cl)CCO4)C3)(C1)C2	1783437022	QMOZZNAJWUBZTQ-ZXJZPGAYSA-N	445.919	1.798	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccc4c(c3)OCO4)CCO2)C1	1783535136	ZHEUEUWCUNLGFF-KPZWWZAWSA-N	425.279	1.642	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(-c4ncc[nH]4)cc3)CCO2)C1	1783884908	VOQDDGSNTQHCLD-LAUBAEHRSA-N	432.908	1.774	50	20	IDGD	
Cn1c(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]3C2)cc2ccccc21	1784084529	WRJGGGJBJXZVLG-UUXHPUJUSA-N	433.936	1.300	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)C3CC4(CCC4)C3)C2)C1	1784843960	UKKXPYOXMUBXTC-DZQSVEARSA-N	441.532	1.531	50	20	IDGD	
Cc1nn(C)c(C)c1C(=O)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1	1786494626	QGOXVWSARXXPOH-UHFFFAOYSA-N	446.316	1.778	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ncn(-c4cccc(F)c4)n3)C[C@@H]21)[C@@H](F)Cl	1787444359	WHBUXDZVSZBARM-VCOSZWKGSA-N	439.850	1.534	50	20	IDGD	
CC(C)N(C)CC(=O)NC1(c2ccc(NC(=O)c3cnccc3C(=O)NN)cc2)CCC1	1789523685	LSMQXPVJJAGHOU-UHFFFAOYSA-N	438.532	1.773	50	20	IDGD	
CC(C)N[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]2C1)C(C)C	1789922665	NVTIKSXXUYATPV-GVRJEKJASA-N	436.366	1.679	50	20	IDGD	
C[C@@H](O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](Br)Cc3ccccc3)[C@H]2C1	1790780298	VZSDURQHZCNYSB-QSGXVVIFSA-N	439.350	1.353	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3C[C@@]34C(=O)Nc3ccccc34)[C@H]2C1	1791066734	SGVMJIGSJSXTLE-MSRFIVAGSA-N	445.947	1.894	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3c[nH]c4ccccc34)C[C@@H]21	1791254692	YTJDQOIXCSNUCR-RNVRALISSA-N	433.936	1.944	50	20	IDGD	
Cc1nccn1[C@@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]21	1791705259	UPYAPDGUKIICKN-DOQDNZIXSA-N	431.364	1.969	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)c1c(F)ccc(Cl)c1F	1792039045	OWZRNIKWVBOVCH-NUZBWSBOSA-N	437.270	1.811	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Cl	1796365947	HKUCABVIQBDGMN-OXUXUCFPSA-N	443.815	1.258	50	20	IDGD	
CCOC(=O)c1ncn2c1CC[C@@H](C(=O)N[C@@H]1C[C@@H]3CC[C@H](C1)N3C(=O)[C@@H](F)Cl)C2	1796811265	MOJVBLUBSDCEKR-GODIYZJISA-N	440.903	1.795	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cn2ccsc2n1	1797482310	HAGMEJKSLVJKTG-FMSGJZPZSA-N	441.351	1.630	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@](C)(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](O)CCl)C3)C1	1797757898	NICAUCCHCJSSDU-VPEYGQHGSA-N	443.972	1.871	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1CN(Cc2ccccc2)CCO1)[C@H](O)CCl	1797853205	CSTAYJGXZDDHLK-USYVTKNRSA-N	435.952	1.125	50	20	IDGD	
COc1cc(OC)cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Br)C3)c1	1798898689	JZKFOKQVJJDUHW-VZAMPYOESA-N	445.285	1.598	50	20	IDGD	
CC(=O)N[C@@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2)c1ccc(F)cc1	1799055895	FIRYESBFQQJWPS-IEHFGQBSSA-N	429.851	1.127	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(=O)nc2cccnn12	1799189990	VLBSRVVTGIHDDZ-XJFOESAGSA-N	448.321	1.515	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccccc1C(=O)OCCO	1799270865	YCQPSXDGDPBWEH-BASYENTBSA-N	438.908	1.341	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1Cc3ccccc3CN1)C2	1799275270	OBLJHHXSRKJENS-NAIAOIPJSA-N	440.371	1.527	50	20	IDGD	
Cc1cc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Br)ccn1	1799344885	WUBFVCPRXPQDMP-YALNPMBYSA-N	428.302	1.603	50	20	IDGD	
C[C@@H](Oc1ccccc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Br	1799347620	SQOARBTWXMZWOC-QUEVPRLRSA-N	429.286	1.734	50	20	IDGD	
CC[C@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)OC(C)(C)C)C2	1800078087	HQKVWBGKMBKAIQ-AICCOOGYSA-N	444.960	1.411	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccc(Cl)cc1OC	1800356059	RVIZWDXUQUPKQZ-MVWRLGRASA-N	445.343	1.735	50	20	IDGD	
C[C@H](O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C#N)=C/c1ccc(Br)cc1)C2	1800753186	DLSDTKWGEVJPGC-QGSZRHHWSA-N	448.317	1.326	50	20	IDGD	
COCCOCCOCCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](C)Br	1801967137	ZACCFTUSUYLSHY-JONQDZQNSA-N	435.359	1.478	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc3c1cnn3C)C2	1802335919	BCDNCLLACGAOOS-MUJYYYPQSA-N	426.521	1.198	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1CCN(C(=O)CSC(=N)N)[C@@H]1c1cccnc1	1803007720	FJTBVHQLEVRBCS-OSAQELSMSA-N	442.383	1.745	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H](CNC(=O)CCN2C(=O)C=CC2=O)[C@H]1c1cccnc1	1803911615	BUBXJKBFQRNALT-OXQOHEQNSA-N	446.935	1.668	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccccc2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1	1807376060	SPVJLTAQAWWVRK-UNMCSNQZSA-N	429.285	1.395	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CS(=O)(=O)N2CCCC2)[C@@H]1c1cccnc1)[C@@H](F)Cl	1808313350	WRTNUKPQDWDITE-USXIJHARSA-N	446.932	1.047	50	20	IDGD	
C[C@@H](Cn1cncn1)C(=O)N1CCC2(CCCN(C(=O)CCBr)C2)CC1	1809067441	ZTFLOYJCAYPUJK-HNNXBMFYSA-N	426.359	1.930	50	20	IDGD	
CC(=O)OC[C@H](OC(C)=O)C(=O)NC[C@@H]1CCN(C(=O)[C@H](F)Cl)[C@H]1c1cccnc1	1810339218	WKYOEBKXKJPPJJ-QAETUUGQSA-N	443.859	1.117	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)[C@H]1C[C@]1(F)Cl	1813153172	OWJKHTQGQVTUMF-NWUWZPLHSA-N	445.687	1.006	50	20	IDGD	
O=C(CCC(F)(F)F)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2	1814432089	IMMSBCJIKQWTNK-LBPRGKRZSA-N	441.240	1.391	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)C1(F)CCCCC1)CC2)c1ccc(B(O)O)cc1	1815344339	UPUDDHQEDPIRHC-OAHLLOKOSA-N	445.325	1.721	50	20	IDGD	
Cc1ccn2ncc(C(=O)Nc3nc4c(s3)C[C@H](NC(=O)[C@@H](O)CCl)CC4)c2c1	1816930604	AYAJNDBMNBKFGW-ABAIWWIYSA-N	433.921	1.925	50	20	IDGD	
CNc1ccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)cc1	1817274598	XMHYZJGHFFGIRD-FQEVSTJZSA-N	447.304	1.751	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCCC[C@H]1c1cc(NC(=O)Cn2cnnn2)n[nH]1	1817617685	YZBLLZCVSKCINI-PWSUYJOCSA-N	425.291	1.262	50	20	IDGD	
O=C(CCc1cccnc1)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1817631249	VHZJHESRWRKNJE-FQEVSTJZSA-N	447.304	1.423	50	20	IDGD	
CC(C)O[C@H](C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1819504053	MKZULOJIVYVXBH-RDTXWAMCSA-N	428.298	1.209	50	20	IDGD	
Cc1cc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)c(C)n1C	1820058913	DURDITBIGKBPNV-FQEVSTJZSA-N	449.320	1.665	50	20	IDGD	
COc1cc(C(=O)N[C@H]2CCc3nc(NC(=O)CO[Si](C)(C)C)sc3C2)nn1C	1820166964	RRRFUFGLZFRHBF-NSHDSACASA-N	437.598	1.963	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CNC(=O)OC)n[nH]1	1822625860	FPTDLQRRWWAAFY-ZYHUDNBSSA-N	430.303	1.931	50	20	IDGD	
C=C(CC(=O)OCC)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](Cl)COC)CC2	1822930333	LBUFKXXOZXEVCT-NEPJUHHUSA-N	429.926	1.818	50	20	IDGD	
Cc1cnc2c(C(=O)N3CCC([C@H]4CCCCN4C(=O)[C@@H](O)CCl)CC3)cnn2c1	1824186513	NJJSLTLHMSABFG-MSOLQXFVSA-N	433.940	1.871	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](O)CCl)CC2)C1CCC2(CC1)OCCO2	1824896537	MHOVSDXVHWRRKD-JSGCOSHPSA-N	443.953	1.588	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)Cn1nnc3ccccc31)CC2	1825994953	QVFNMHFLKLPGDB-RYUDHWBXSA-N	448.936	1.754	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)C#Cc2ccccc2)CC1	1826523389	PPSDOYRSXFSCEQ-XMMPIXPASA-N	444.340	1.651	50	20	IDGD	
COc1ccc(Cl)c(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)c1	1830738356	NWMUSHXDYKGVFE-APWZRJJASA-N	447.315	1.018	50	20	IDGD	
CC[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1)N(CC)CC	1831662167	NLTOGXNYFZXMHZ-UTKZUKDTSA-N	432.005	1.828	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2C[C@@]2(F)Cl)CC1	1831963629	KNBWTHCFIDFNGA-FTRWYGJKSA-N	430.952	1.904	50	20	IDGD	
O=C(/C=C/c1ccc(F)cc1F)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1832136992	IFDCHRUTUAMGPD-WWHDKEQJSA-N	432.826	1.969	50	20	IDGD	
Cc1ncc(C(=O)NC2CCN(C3CCN(C(=O)CCBr)CC3)CC2)[nH]1	1833578202	NDXNTWUXBWBKIC-UHFFFAOYSA-N	426.359	1.688	50	20	IDGD	
COc1cccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)n1	1833769133	VVBSUJKGZYXJID-RBUKOAKNSA-N	446.331	1.397	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cccc(=O)n3O)CC2)CC1	1833961207	PAGSAHUMTZLUNC-QGZVFWFLSA-N	438.956	1.678	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccncc3)CCO2)C1	1834020155	NVLOWLPUPQUHAI-CRAIPNDOSA-N	426.311	1.325	50	20	IDGD	
CCn1nccc1C(=O)NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1	1834277589	WBNWYTKSOPYJAV-INIZCTEOSA-N	444.349	1.779	50	20	IDGD	
C=CCO[C@H](C)C(=O)N1CCC(N2CCC(NC(=O)CCBr)CC2)CC1	1834422273	AQDKJBYAUHLVFM-OAHLLOKOSA-N	430.387	1.934	50	20	IDGD	
CC(C)c1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)no1	1834498825	KYNLPEXECISUSI-RHSMWYFYSA-N	448.289	1.559	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)CC3CCOCC3)CC2)CC1	1834632011	ZSYOWXQYACBYIG-IBGZPJMESA-N	429.989	1.629	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@]3(CN(C(=O)CCBr)CCO3)C2)ccc1O	1834823725	FZUDCDSKHHQVDJ-IBGZPJMESA-N	441.322	1.556	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)[C@H]3C[C@H]3F)CC2)CC1	1835117817	NBZLWHZHNJWFNM-CYNFWEFXSA-N	446.527	1.050	50	20	IDGD	
O=C(Cc1ccc(F)c(F)c1)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1835142393	GXQSODXAAKNLDC-SFHVURJKSA-N	437.270	1.767	50	20	IDGD	
O=C(Cc1ccc2c(c1)OCO2)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1835172055	JHWAZKOZSAXUHC-IBGZPJMESA-N	445.299	1.218	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCC(N2CCC(NC(=O)c3cc(CO)on3)CC2)CC1	1836188967	NUPTVLABUADXIR-LJQANCHMSA-N	447.363	1.588	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3nccc4[nH]ccc34)C2)C1	1837711311	CZXJWXLITQQVEC-NRFANRHFSA-N	446.580	1.484	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)CC3CCOCC3)C2)C1	1837711393	GHDCBWZVSAHJDA-HXUWFJFHSA-N	428.602	1.111	50	20	IDGD	
N[C@@H](Cc1cccnc1)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](F)Cl)CC2)CC1	1838083253	IBDHGROJHTYKOY-ZWKOTPCHSA-N	426.920	1.484	50	20	IDGD	
Nc1n[nH]c(CCC(=O)N2CCC(OC3CCN(C(=O)C(Cl)Cl)CC3)CC2)n1	1838368773	GHFYCNLWLTYILZ-UHFFFAOYSA-N	433.340	1.122	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1839072098	ZYBBZMRPKCMBJY-HXUWFJFHSA-N	440.327	1.971	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(NC(C)=O)n3)C2)C1	1839142700	WOBDLZLWSGYABH-QRWLVFNGSA-N	438.912	1.127	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(-c4ccncc4)[nH]n3)C2)C1	1839145827	RDQVJKBCZUOOIC-IERDGZPVSA-N	447.923	1.559	50	20	IDGD	
COc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)cn1	1839150258	GYZQGJFGCQJRDQ-RBUKOAKNSA-N	446.331	1.397	50	20	IDGD	
O=C(CCc1ccccc1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839198213	XDLOPYOCMWXLIJ-HKUYNNGSSA-N	443.313	1.766	50	20	IDGD	
O=C(C(Cl)Cl)N1CCOC[C@@]2(C1)CN(C(=O)C1(Br)CC1)CCO2	1839208566	VFBOZNHKWNLZJL-CYBMUJFWSA-N	430.126	1.174	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cn4c(F)cccc4n3)CCO2)C1	1839555476	CPLCOHCEXGWIGC-JLTOFOAXSA-N	438.887	1.561	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3(CC)COC3)C2)C1	1839966351	BNNLWPMHRZIKMX-KSSFIOAISA-N	433.343	1.043	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)COc3ccccc3F)CCO2)C1	1839969740	ZSQRRKKBRMECPJ-QRWLVFNGSA-N	428.888	1.678	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3cccc(F)c3F)CCO2)C1	1839982803	BMWVYIGNEYHUBS-FOIQADDNSA-N	446.878	1.218	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)cc1	1840034631	RPEBETVQLPXSAN-BEFAXECRSA-N	425.323	1.848	50	20	IDGD	
COc1cc(Cl)cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)c1	1840740264	BXNLFPSXBRMLTR-LPHOPBHVSA-N	447.315	1.018	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)Cc2cc(F)ccc2Cl)C1	1841831252	DOLBOEFVXZOJNY-UHFFFAOYSA-N	430.672	1.219	50	20	IDGD	
O=C(/C=C/C(=O)N1CC2(CCCN2C(=O)CCBr)C1)NCc1ccccc1	1842637116	HJVBZNBGYCDADC-BQYQJAHWSA-N	434.334	1.847	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1ccc3c(c1)CC(=O)N3)C2	1843416182	INHWXOZYPLOKBX-VULFUBBASA-N	448.483	1.132	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)[C@H](C)Oc1cccnc1)C2	1843417293	RYAVXSKTJWOYJR-JZCUADNKSA-N	438.488	1.186	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)c2cc([N+](=O)[O-])ccc2OC(C)=O)C1	1844693364	WGFRRGCZSLQLEA-OAHLLOKOSA-N	439.852	1.591	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCCC12CN(C(=O)[C@@H]1CCC(=O)NC1)C2	1845870269	YDSSLUFHXUXFLV-FUXXUDPSSA-N	428.439	1.601	50	20	IDGD	
COc1ccc([C@H]2C[C@@H]2C(=O)N2CC3(CCCN3C(=O)CCC(=O)NN(C)C)C2)cc1	1846383869	DDHWCVNZWMXJAJ-MOPGFXCFSA-N	428.533	1.375	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)c1ncccc1-c1ccccc1)C2	1846384876	UEICPKRWZCKYKV-UHFFFAOYSA-N	435.528	1.939	50	20	IDGD	
COc1ccc(/C=C/C(=O)N2CC3(CCCN3C(=O)CCC(=O)NN(C)C)C2)c(F)c1	1846386010	UJXLLGVJCCUVPU-RMKNXTFCSA-N	432.496	1.424	50	20	IDGD	
CC(C)(C)OC(=O)N1CCCC[C@H]1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl	1847562565	AXILPMJTCXMNJG-VGWMRTNUSA-N	429.945	1.578	50	20	IDGD	
O=C(COC(=O)CCC(=O)c1ccc2c(c1)OCCCO2)NNC(=O)c1ccccc1	10469996	SZXPGXCUZRMYRV-UHFFFAOYSA-N	426.425	1.815	50	20	IDGD	
CN(NC(=O)CCC(=O)N1CCN(S(=O)(=O)c2ccccc2)CC1)c1ccccc1	15133649	VNFABNIRPPIHAN-UHFFFAOYSA-N	430.530	1.467	50	20	IDGD	
CCCn1nc(C(=O)NNS(=O)(=O)c2ccc(C(=O)O)cc2)c2ccccc2c1=O	16095581	HFTWRJLQWXLRGZ-UHFFFAOYSA-N	430.442	1.128	50	20	IDGD	
CN(CC(=O)NNC(=O)CC12CC3CC(CC(C3)C1)C2)C1=NS(=O)(=O)c2ccccc21	17343310	LNMFWSWLDZZJLG-UHFFFAOYSA-N	444.557	1.821	50	20	IDGD	
CCC1CCC2(CC1)NC(=O)N(CC(=O)NNC(=O)c1c(C)nc3ccccn13)C2=O	17580738	GJQLVDVWSGCGEZ-UHFFFAOYSA-N	426.477	1.295	50	20	IDGD	
O=C(CN1C(=O)COc2ccc([N+](=O)[O-])cc21)NNC(=S)Nc1cccc(Cl)c1	26855777	DPJVXRIYNVWSKP-UHFFFAOYSA-N	435.849	1.991	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cc(S(N)(=O)=O)cn2C)ccc1OCCC(C)C	27235679	HNAFRFKSQYEMDZ-UHFFFAOYSA-N	438.506	1.181	50	20	IDGD	
COC(=O)c1ccc(N2CCN(CC(=O)NNC(=O)Cc3nc(C)cs3)[C@H](C)C2)cc1	250942517	WNIVIJZYFMBBGZ-OAHLLOKOSA-N	445.545	1.139	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)c2nc3ncc(Br)cn3n2)cc1F	727499069	JGYCZVDLXQJMLA-UHFFFAOYSA-N	440.258	1.666	50	20	IDGD	
CC(=O)Nc1ccc(F)c(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)c1	728216138	SGXXYUOVIOVKID-UHFFFAOYSA-N	449.508	1.477	50	20	IDGD	
CC(=O)NCC(=O)N1CCC[C@@H]1C(=O)NNC(=O)c1cc2c(s1)CC[C@H](C(C)(C)C)C2	728512754	JAYBCADHAOUDRL-JKSUJKDBSA-N	448.589	1.787	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)Cn2nc(-c3ccccc3)oc2=O)c1	728528593	HYLFXEAVIOTDSN-UHFFFAOYSA-N	447.245	1.736	50	20	IDGD	
O=C(CN1CCN(C(=O)NNC(=O)c2cccc(OC(F)F)c2)CC1)Nc1ccccc1	728599796	RVQRPAXAGPJENL-UHFFFAOYSA-N	447.442	1.899	50	20	IDGD	
CS(=O)(=O)N1CCCC[C@H]1C(=O)NNC(=O)c1ccc(Br)cc1Cl	728829358	JDCIHCZQHJXGFV-LBPRGKRZSA-N	438.731	1.678	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNS(=O)(=O)c1ccc2c(c1)C[C@@H](C)O2	729965088	SNTWMGTWLLEIHK-LLVKDONJSA-N	438.531	1.235	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NC[C@H](O)c1cccc(C(F)(F)F)c1	730826470	KJOHSRLXEYRWQI-LBPRGKRZSA-N	430.408	1.561	50	20	IDGD	
O=C(NNC(=O)[C@@H]1C[C@@H]1c1ccc(OCc2ccccc2)cc1)[C@H]1CCS(=O)(=O)C1	732535118	RTBWUHUEXSUVKO-DFQSSKMNSA-N	428.510	1.951	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1	733108932	ZEATXGPPPOBPRX-UHFFFAOYSA-N	441.513	1.978	50	20	IDGD	
CCc1c(C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)cnn1Cc1ccccc1	734242165	WCXXJTWBEUKJJA-UHFFFAOYSA-N	430.509	1.963	50	20	IDGD	
CCOC(=O)c1cc(S(=O)(=O)NNC(=O)c2ccc(C#N)cc2)cc([N+](=O)[O-])c1C	734807499	SHDVPSLACRDAGV-UHFFFAOYSA-N	432.414	1.575	50	20	IDGD	
COc1ccc([N+](=O)[O-])c(C(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)c1	734825106	URDOXMIIYHVJJJ-UHFFFAOYSA-N	437.453	1.947	50	20	IDGD	
CC[C@@H](Nc1ccccc1)C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	735117467	UMYBIMUBOPEJEQ-QGZVFWFLSA-N	432.550	1.352	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)NC1CCN(C[C@H]2CCOC2)CC1	736391922	HOKYBKMJUHORNN-OAHLLOKOSA-N	428.493	1.023	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)ccc1N1CCNC1=O	743829658	ZXLMXLVBMVEHFR-UHFFFAOYSA-N	431.474	1.395	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CN2CCN(C(=O)CCC3CCCCC3)CC2)c1	744389166	MPNFRFFPCDQCGB-UHFFFAOYSA-N	425.533	1.824	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN2CCc3ccc(S(=O)(=O)NC)cc32)cc1C	744404809	FMTSYTQBAOEZRT-UHFFFAOYSA-N	436.559	1.351	50	20	IDGD	
CCOC(=O)c1c(C)[nH]c(C=NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)c1C	744729465	VRUTYWSKDOXYPT-UHFFFAOYSA-N	434.518	1.887	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)[C@@H]2CCCN2C(=O)OCC(F)(F)F)cc1	744945804	JGXQOBOCELFOCU-ZDUSSCGKSA-N	442.350	1.026	50	20	IDGD	
O=C(COC(=O)c1ccc(C[C@@H]2CC(=O)NC2=O)cc1)NNC(=O)c1ccc(Cl)cc1	745108882	XEZGWNXSPPEBJR-OAHLLOKOSA-N	443.843	1.163	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)NC2CCN(CCN(C)C)CC2)cc1Cl	745453184	IAVCKOYKVMSIBC-UHFFFAOYSA-N	442.948	1.719	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)[C@H](c2ccccc2F)N2CCOCC2)c1	745499853	QKUBZRIRSYKKAA-FQEVSTJZSA-N	429.448	1.512	50	20	IDGD	
COc1cc(C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)cc(OC)c1OC(F)F	745604705	VIMJFZKUGZGZJA-UHFFFAOYSA-N	449.366	1.795	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)N2CCOCC2)cc(S(=O)(=O)N2CCC(C)CC2)c1C	745992654	GTIDLFRRFHUVNC-UHFFFAOYSA-N	438.550	1.411	50	20	IDGD	
O=C(NCc1ccccc1Br)NNC(=O)c1csc(N2CCOCC2)n1	746222307	BTMMTCWFLKHBAY-UHFFFAOYSA-N	440.323	1.886	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)(F)F)cc1)[C@@H]1CC(=O)N(Cc2ccccn2)C1	748519834	FGHLYCQVJZPCET-GFCCVEGCSA-N	442.419	1.867	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)NC[C@@H]1CCN(c2cccc(Br)c2)C1	748625009	KGFXVVBDIUQODB-KGLIPLIRSA-N	443.342	1.657	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)Cc1nc(-c2ccco2)oc1C	749561328	PEKYBRPSYJJSTC-UHFFFAOYSA-N	431.474	1.848	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)CCc2ccccc2)cc1	749803603	KCGIGCMMAFRVGV-UHFFFAOYSA-N	432.502	1.046	50	20	IDGD	
CO[C@H](C)c1noc(CN2CCCN(C(=O)NNC(=O)c3cccc(C#N)c3)CC2)n1	750274444	ASYMJMROMBPXCK-CQSZACIVSA-N	427.465	1.211	50	20	IDGD	
N#C/C=C(\c1ccccc1)N1CCN(S(=O)(=O)c2ccc(S(N)(=O)=O)cc2)CC1	750792088	ZSDCMTIRJOLEDL-VXLYETTFSA-N	432.527	1.205	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)c2cc(S(=O)(=O)NC)oc2C)cc1OC	751299906	PXFMOCRYIAAMRK-UHFFFAOYSA-N	425.463	1.368	50	20	IDGD	
Cc1ccc(C(=O)NNS(=O)(=O)c2ccc(S(=O)(=O)N3CCCCC3)cc2)o1	753085982	OKIDRJJRAYXANC-UHFFFAOYSA-N	427.504	1.386	50	20	IDGD	
CCc1cc(Br)ccc1NNC(=O)[C@@H]1CC(=O)N([C@H]2CCS(=O)(=O)C2)C1	753175463	KFSDOOIZCVPQEB-OCCSQVGLSA-N	444.351	1.490	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)N[C@H]1CCN(Cc2ccc(C#N)cc2)C1=O	753291830	ZYHYFMXPWYYJMJ-KRWDZBQOSA-N	441.875	1.965	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N2CCOC[C@@H](C)C2)cc1	754230860	WUCOMTUOPPENMI-GYXHFJGISA-N	437.500	1.836	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2cc(OC)c(O)c(OC)c2)c2ccccc2c1=O	754383686	XWYXXMCCFMNUJD-UHFFFAOYSA-N	426.429	1.604	50	20	IDGD	
CC(=O)NCC(=O)N1CCc2cc(C(=O)NNc3ccc(-c4ccccc4)nn3)ccc21	754470013	RSCRQHVJFAJKRE-UHFFFAOYSA-N	430.468	1.926	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)NCCC(=O)NNc2ccc(C(F)(F)F)nn2)cc1	755293406	JVZKJIOLGNPAMG-UHFFFAOYSA-N	431.396	1.510	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N2CCOCC2)cc1NC(=O)NNC(=O)CC1CC1	755441994	LLQWMIONGOKBPM-UHFFFAOYSA-N	426.495	1.059	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)Nc1ccc(N2CCCS2(=O)=O)cc1	755596081	YLQAPKPXOFAIDJ-UHFFFAOYSA-N	442.457	1.342	50	20	IDGD	
COC(=O)CCNC(=O)c1ccc(NC(=O)NNC(=O)c2ccc(Cl)cc2O)cc1	755602891	GGCZFJIWLZCPQG-UHFFFAOYSA-N	434.836	1.805	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)Nc1ccc(CC(=O)N2CCOCC2)cc1	755861144	BICNQOHPLJMJPH-UHFFFAOYSA-N	430.436	1.459	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2cccc(OCC(=O)OC)c2)c2ccccc2c1=O	755911177	XBJNRSQQZIXANX-UHFFFAOYSA-N	439.428	1.435	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)Nc1ccc(C(=O)N2CCOCC2)cc1	755932618	CBJJXPOSLRCTQE-AWEZNQCLSA-N	430.436	1.918	50	20	IDGD	
CN1CCC/C1=N\S(=O)(=O)c1ccc(NC(=O)NNC(=O)Cc2cccnc2)cc1	756074351	YGHSHSJTFWPKSC-JJIBRWJFSA-N	430.490	1.290	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)N1CCN(CC(=O)Nc2ccccc2F)CC1	756074652	YIWYOUOECRQPKK-UHFFFAOYSA-N	429.452	1.445	50	20	IDGD	
COC(=O)c1cccc(NC(=O)C(=O)NNc2ncncc2Cl)c1Br	756177016	ULSRIVYSTWDCSS-UHFFFAOYSA-N	428.630	1.761	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)N[C@H]1CCN(c2c(F)cccc2F)C1=O	756209538	BMAOQWUTLINLDH-ZDUSSCGKSA-N	435.343	1.328	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)CN2C(=O)N[C@]3(C[C@@H](C)C[C@@H](C)C3)C2=O)c1	756863762	MOBGECPBCSYOQK-NGVSDPCNSA-N	432.477	1.212	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)Nc1ccn(CC(F)(F)F)n1	757748033	OXFWISGOOLMKKO-UHFFFAOYSA-N	439.442	1.810	50	20	IDGD	
CCn1c(SCC(=O)NN=C2CCC3(CC2)NC(=O)NC3=O)nnc1-c1ccccc1	758118455	OYBWBMALBQYHOC-UHFFFAOYSA-N	441.517	1.682	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)NC[C@H]1CSCCN1Cc1ccccc1	759204234	WONJBWJCWYLNGY-INIZCTEOSA-N	437.566	1.459	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2ccc(-c3nnc(S)o3)cc2)c2ccccc2c1=O	759375918	FQEJONZNMJRMEH-UHFFFAOYSA-N	436.453	1.830	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NN=C1CCC(O)CC1)N(S(C)(=O)=O)CC2	761767665	RCUSEWMTQIHVQN-LWKPJOBUSA-N	439.534	1.360	50	20	IDGD	
O=C(C#Cc1ccc2c(c1)OCO2)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	761785508	JCHRRISCWKRGRT-UHFFFAOYSA-N	441.465	1.013	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)[C@H]3CS[C@@]4(C)CCC(=O)N34)n[nH]2)cc1OC	763149031	NTQQSCVFMNGMRV-VLIAUNLRSA-N	445.501	1.309	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)c2cc(S(=O)(=O)NC(C)C)c[nH]2)n[nH]1	763152523	HBHINTRNKXXAKD-UHFFFAOYSA-N	446.489	1.175	50	20	IDGD	
C[C@H](C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1)c1cccc([N+](=O)[O-])c1	763400564	XPYXYVZYIUDOGQ-YVEFUNNKSA-N	429.385	1.229	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccnn2Cc2ccccc2F)cc1OC	763550164	JORGUQBKIXTIPJ-UHFFFAOYSA-N	441.419	1.487	50	20	IDGD	
Cc1ccc(Cn2cccc(NC(=O)C(=O)NNC(=O)c3ccc4c(c3)OCO4)c2=O)cc1	763550707	FYCIFPRCOIMHDH-UHFFFAOYSA-N	448.435	1.333	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2cc(C(=O)N(C)C)ccc2C)c1	763648283	BSKCWQSQFRUREV-UHFFFAOYSA-N	426.473	1.479	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccc(Br)cc2)n(CCC#N)n1	763693838	BOJHQDIRYIIMPG-UHFFFAOYSA-N	449.265	1.033	50	20	IDGD	
CNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(C(C)=O)cc2)c1C	763873211	SMQPMKJBVSZNMZ-CQSZACIVSA-N	440.456	1.111	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1cnn(Cc2ccncc2)c1	763874048	YXGDWXSOBNQKAV-ZDUSSCGKSA-N	426.408	1.019	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cccc(Cn3cccn3)c2)cc1	763875981	BXEPEVMBDWOWRN-INIZCTEOSA-N	449.467	1.687	50	20	IDGD	
CSc1c(F)cc(NC(=O)C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc1F	763944725	OWFVQWJGLKYOTN-UHFFFAOYSA-N	447.423	1.978	50	20	IDGD	
NC(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(COc3ccccc3)o2)cc1	763948893	GAUZGOLGOJQWRJ-UHFFFAOYSA-N	436.424	1.286	50	20	IDGD	
Cc1cc(C(=O)N2CCSCC2)ccc1NC(=O)C(=O)NNC(=O)Cc1ccsc1	764035069	ZOUQHPYFIXLRKU-UHFFFAOYSA-N	446.554	1.574	50	20	IDGD	
CNC(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)CCc2ccc(OC)cc2)c1	764124599	LOLNFQOSYQHBSU-UHFFFAOYSA-N	432.864	1.427	50	20	IDGD	
N#Cc1cc(Cl)ccc1-n1ccc(NC(=O)C(=O)NNC(=O)CCc2ccco2)n1	764168838	HFFKRTGYAPNIRL-UHFFFAOYSA-N	426.820	1.709	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)C(=O)Nc2nc3cc4c(cc3s2)OC(F)(F)O4)cc1	764177277	NEGQMHDMEBHNJV-UHFFFAOYSA-N	445.363	1.889	50	20	IDGD	
COC(=O)N(C)c1ccc(NC(=O)C(=O)NNC(=O)c2cccc(OC(F)F)c2)cc1	764260201	SZFZHTYNZLYCNG-UHFFFAOYSA-N	436.371	1.890	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)C(=O)Nc1ccc(OC(F)F)cc1	764261059	XCRKGHHPLIEARO-UHFFFAOYSA-N	434.403	1.081	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)C(=O)Nc1cccc(C(=O)NCc2ccccn2)c1	764318898	LWQMPJVOPLVEIS-UHFFFAOYSA-N	449.442	1.479	50	20	IDGD	
CCOCC(=O)NNC(=O)C(=O)Nc1cc(C)nn1-c1cc(C(F)(F)F)ccc1Cl	764325940	BICIHMCSNCRZEG-UHFFFAOYSA-N	447.801	1.975	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)C(=O)Nc1cc(Br)cn(C)c1=O)c1ccccc1	764330933	ZDOWFFQDYQUCPD-CYBMUJFWSA-N	435.278	1.428	50	20	IDGD	
CCOc1cc(NC(=O)C(=O)NNC(=O)Cc2ccncc2)c([N+](=O)[O-])cc1OCC	764353283	HGKNQYVGKSKKJD-UHFFFAOYSA-N	431.405	1.116	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2cccc3c2ccn3C)n[nH]1	764377354	NYHQUYCVTWXBBV-UHFFFAOYSA-N	432.440	1.977	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cc(C(N)=O)ccc3F)n[nH]2)cc1C	764386361	AEOJGVDMZAZGGL-UHFFFAOYSA-N	438.419	1.331	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1ccc(C(N)=O)c(Cl)c1	764393246	FCDXIYMFEBMGGP-UHFFFAOYSA-N	436.877	1.326	50	20	IDGD	
COc1nccnc1NNC(=O)[C@@H](CCSC)NS(=O)(=O)/C=C\c1ccccc1	764465515	YIXARMWOJVJCDB-UZGISAJGSA-N	437.547	1.640	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)[C@@H](C)NS(=O)(=O)c2ccc(C#N)cc2)cc1C	764526456	ZODVVKVOJAUBGI-OAHLLOKOSA-N	430.486	1.068	50	20	IDGD	
C[C@]1(c2ccccc2)NC(=O)N(CC(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)C1=O	765565340	OOGGOKAVFKEURA-HXUWFJFHSA-N	438.469	1.366	50	20	IDGD	
O=C(CSCc1ccncc1)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	766662743	DTDFVGKCXSUOTR-UHFFFAOYSA-N	447.992	1.933	50	20	IDGD	
CC(=O)NC1(C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)CCCCC1	766664908	XMLBCHBGQFIDEI-UHFFFAOYSA-N	449.983	1.444	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)C[C@H](NC(N)=O)c1ccccc1C	767278414	DPXJHGPBRFLGKU-SFHVURJKSA-N	426.473	1.336	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NNC(=O)CN2C(=O)COc3ccccc32)C1	769685487	MIEBMJGMHNOBTL-CQSZACIVSA-N	432.477	1.207	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)OC[C@@H](C)CBr)CC2)cc1	770384744	ZVNOAHGWLOUZQQ-HNNXBMFYSA-N	433.368	1.876	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)N[C@@H]3CCCN(c4ccc(OC(F)F)cc4)C3)nc21	770399880	MTOXDTCJVJNTML-LLVKDONJSA-N	448.434	1.965	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)CCc1c(C)nc2nc(C(F)(F)F)nn2c1C	771917212	QBJLZTFTBMCWHO-SNVBAGLBSA-N	430.387	1.182	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCCS1(=O)=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1	772614894	PJLHUXLHTLEJQK-LEWJYISDSA-N	441.553	1.728	50	20	IDGD	
Cc1ccc(I)cc1NC(=O)C(=O)NNC(=O)CCc1ccco1	773495962	HUPOBGDCKRTQKK-UHFFFAOYSA-N	441.225	1.911	50	20	IDGD	
COC(=O)Nc1ccc(S(=O)(=O)NNC(=O)c2ccc(C)c(F)c2)cc1[N+](=O)[O-]	777651529	VNTLJRISMDSPGZ-UHFFFAOYSA-N	426.382	1.844	50	20	IDGD	
Cc1c(S(=O)(=O)NNC(=O)CNC(=O)OC(C)(C)C)cnn1-c1ccc(Cl)cc1	777939397	MVLLHVUUMLHQJY-UHFFFAOYSA-N	443.913	1.668	50	20	IDGD	
CC[C@H](C)NS(=O)(=O)c1ccc(C(=O)NNC(=O)CNC(=O)OC(C)(C)C)cc1	778442993	KTAQCVDTOADDAV-LBPRGKRZSA-N	428.511	1.049	50	20	IDGD	
O=C(CC(=O)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1)NCC(F)(F)F	779659653	BETCKIYZQBXYOG-SFHVURJKSA-N	448.445	1.830	50	20	IDGD	
C[C@@H]1C(=O)CC[C@@H](C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)C1(C)C	780154819	DLBMSFLCPVWWJK-PBHICJAKSA-N	435.546	1.874	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccccc2CCN(C)C)cc1	782701771	KCYWUGCPMFTMSA-MRXNPFEDSA-N	440.500	1.547	50	20	IDGD	
COc1ccc(Cl)c(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)c1	784212636	CZIOKPJDEVXVGJ-UHFFFAOYSA-N	438.893	1.871	50	20	IDGD	
O=C(NNc1cc(Cl)ccn1)C(=O)Nc1ccc(N2CCN(C(=O)C3CC3)CC2)nc1	784861295	VIVDMIYTTFBLHN-UHFFFAOYSA-N	443.895	1.270	50	20	IDGD	
COC(=O)c1ccccc1NC(=O)C(=O)NNC(=O)c1cc(-c2cc(C)ccc2C)[nH]n1	785126337	OKXAVQUWRDEYFH-UHFFFAOYSA-N	435.440	1.880	50	20	IDGD	
CN(C)CC(=O)Nc1ccc(NC(=O)C(=O)NNc2nc(C(F)(F)F)cs2)cc1	785146349	URGQQHBCTUDBNL-UHFFFAOYSA-N	430.412	1.744	50	20	IDGD	
COc1cc(F)cc(NNC(=O)C(=O)Nc2ccc(OC)c(NS(C)(=O)=O)c2)c1	785246530	MSQXQBMBKOFTJE-UHFFFAOYSA-N	426.426	1.296	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1cc(CN(C)C)ccc1C	785330752	LFKNAJDBKFCYTI-UHFFFAOYSA-N	434.518	1.551	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)COc2cc(C)cc(C)c2)c(C)cc1C	788332326	ZSSUTUPDELRVEO-UHFFFAOYSA-N	427.457	1.872	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(OC)c(NC(=O)NNc2cc(Cl)nc(N)n2)c1	788996587	WYKVFIFVFJBNIF-UHFFFAOYSA-N	443.917	1.900	50	20	IDGD	
CC(C)(C)OC(=O)CCc1cccc(NC(=O)C(=O)NN[C@@]2(C)CCS(=O)(=O)C2)c1	792353812	QBNOZQZDKNLSDE-FQEVSTJZSA-N	439.534	1.097	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2ccc3c(c2)N(CC(F)F)CCS3)CCS(=O)(=O)C1	793039772	BXFNZGZLBNRYGC-QGZVFWFLSA-N	448.517	1.000	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)[C@H](O)[C@H](O)c2nc3ccccc3s2)cc1	794717600	QPEJRUWHVKRDAI-CVEARBPZSA-N	436.515	1.084	50	20	IDGD	
CCn1ncc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)c1C(F)(F)F	799258852	NXMVQXXMKOSLBK-SECBINFHSA-N	431.346	1.614	50	20	IDGD	
Cc1cn(-c2ccc(Cl)cc2)nc1NC(=O)C(=O)NNc1ccc(-n2cccn2)nn1	799261233	UDEQNKDXVOXSKV-UHFFFAOYSA-N	437.851	1.892	50	20	IDGD	
O=C(NCCNS(=O)(=O)c1ccc(F)cc1F)NNC(=O)c1cccc(Cl)c1	799674805	BEWUKYYRZQCGLM-UHFFFAOYSA-N	432.836	1.541	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)c1sccc1S(N)(=O)=O	800582391	UGFNPVFFUWIRKE-MRVPVSSYSA-N	448.320	1.387	50	20	IDGD	
CC(=O)NC[C@@H]1CCn2ncc(C(=O)NNC(=O)Nc3ccc(OC(F)F)cc3)c2C1	802046449	CHMSYRLXZDRLNY-GFCCVEGCSA-N	436.419	1.650	50	20	IDGD	
O=C(CCC/N=C1/NS(=O)(=O)c2ccccc21)NNC(=O)Nc1ccc2c(c1)OCO2	802099960	GACXRUBBCLCQAT-UHFFFAOYSA-N	445.457	1.087	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)NCCC(=O)NNC(=O)Nc2ccc(N(C)C)cc2)cc1	802124040	ANURSTCJVMUWAA-UHFFFAOYSA-N	447.517	1.477	50	20	IDGD	
COc1ccc(-c2nn(CCC#N)cc2/C=C(\C#N)C(=O)NCc2cnn(C)n2)cc1OC	805207761	YLRPFATVODJPMG-CXUHLZMHSA-N	446.471	1.833	50	20	IDGD	
O=C(NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)Nc1cccc2c1CNC2=O	806754363	QSROLTIUTHRYMK-UHFFFAOYSA-N	443.485	1.181	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2c(C)c(C(F)(F)F)nn2C)cc1OC	806975379	WTKVZASZEJMWFK-UHFFFAOYSA-N	443.382	1.554	50	20	IDGD	
COC(=O)c1cc(C)c(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)c(Cl)c1	807020159	RGCDMMCURRPHNG-UHFFFAOYSA-N	443.847	1.411	50	20	IDGD	
NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)CCc2ccccc2)c(OCC(F)F)c1	810386972	ZJJSNNNSRXWSSZ-UHFFFAOYSA-N	434.399	1.148	50	20	IDGD	
Cc1nc(-c2ccccn2)nc(NNC(=O)CNS(=O)(=O)c2cccc(C#N)c2)c1C	810407455	GSWNXVNLJULRCE-UHFFFAOYSA-N	437.485	1.449	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(=NNC(=O)Cc2cc(O)nc(O)n2)[C@H]([C@H]2CCOC2)C1	812226854	VEHFWPLJZHPVAP-JSGCOSHPSA-N	435.481	1.196	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@H](F)C[C@H]1CNC(=O)NNC(=O)COc1ccccc1C#N	813814414	OOYKCEIGSVBRMH-GJZGRUSLSA-N	435.456	1.615	50	20	IDGD	
CC(=NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1cc(Br)ccc1OCC(=O)O	814781863	OALBPIHQBFDICP-SNVBAGLBSA-N	433.280	1.187	50	20	IDGD	
COCc1cc(NC(=O)C(=O)NNC(=O)C(C)(C)c2ccccc2)cc(C(=O)OC)c1	815569190	KCTLXSLIRAWOHL-UHFFFAOYSA-N	427.457	1.683	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)c1cnn(C)c1I	817055095	MDOXSUSGOQXLIR-UHFFFAOYSA-N	449.274	1.032	50	20	IDGD	
CCCN1C(=O)c2ccccc2N2C(=O)CC[C@]12C(=O)NNC(=O)c1cccc(N(C)C)c1	821780677	FVXDXPVSUVQKKW-DEOSSOPVSA-N	449.511	1.903	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CSc1nnc(O)n1C[C@@H]1CCCO1	844261562	QQAQGVKNIJWIFA-NSHDSACASA-N	441.897	1.378	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)CN1C(=O)[C@H]2CCCC[C@@H]2C1=O	871059503	LYCSROBJOGKAFL-KBPBESRZSA-N	438.278	1.151	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)CCNS(=O)(=O)c1cccc(C(C)=O)c1	871623910	QONBKINGBPFDRL-UHFFFAOYSA-N	447.513	1.346	50	20	IDGD	
Cc1ccccc1C(=O)NNS(=O)(=O)c1ccc(S(=O)(=O)N2CCCCC2)cc1	906445275	YWSHBUAHORGYPZ-UHFFFAOYSA-N	437.543	1.793	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cccnc2N2CCCC2)cc1OC	913269115	UFQMUEREWLIILX-UHFFFAOYSA-N	428.445	1.317	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cn(-c3ccc(C)cc3)nn2)cc1OC	915525417	RKWLGOXCVRFDJV-UHFFFAOYSA-N	439.428	1.211	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)C2=NN(Cc3ccccc3)C(=O)CC2)c1	915858345	YZLPONOAVRJSTL-UHFFFAOYSA-N	428.470	1.030	50	20	IDGD	
COc1cc(C=NNC(=O)c2sc(N3CCOCC3)nc2C)c([N+](=O)[O-])cc1OC	916339495	MOOMDXYLVOLZJY-UHFFFAOYSA-N	435.462	1.977	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NCC(C)(C)c3ccccc3)nc2)CC1	916516372	UFJROXDQXLFXTK-UHFFFAOYSA-N	446.577	1.622	50	20	IDGD	
COc1cc(CNC(=O)NNC(=O)COc2ccc(F)cc2)ccc1OCC(=O)N(C)C	916641423	FIMZQORBKQMHRA-UHFFFAOYSA-N	448.451	1.211	50	20	IDGD	
COc1cccc(SCC(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1	917291152	NTDCXMBUTPEMPS-KRWDZBQOSA-N	432.454	1.318	50	20	IDGD	
CN1CCN(C(C)(C)CNC(=O)NNC(=O)c2ccc(F)cc2Br)CC1	918203259	ZJXJJRTYDFGGBN-UHFFFAOYSA-N	430.322	1.558	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCC[C@@H](C)C3)cc2)c1O	919757111	YGSGJYMHMAVZPZ-CQSZACIVSA-N	447.513	1.896	50	20	IDGD	
Cc1cc(C)nc(SCc2ccc(C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)cc2)n1	920297527	BCYDIAGHXXFGPF-CYBMUJFWSA-N	437.547	1.084	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)N2CCC(=NNC(=O)NCC(F)(F)F)CC2)cc1	920373737	OEBSWTZRPAWPQT-UHFFFAOYSA-N	435.428	1.647	50	20	IDGD	
O=C(COC(=O)c1cccnc1SC(F)F)NNC(=O)[C@H]1COc2ccccc2O1	921160330	MERSSORGODHMOZ-CYBMUJFWSA-N	439.396	1.541	50	20	IDGD	
CNS(=O)(=O)c1ccc(Br)c(C(=O)NNc2cccc(C(=O)OC)c2)c1	1254373298	BHGZFRPSDIOTIJ-UHFFFAOYSA-N	442.291	1.901	50	20	IDGD	
CCNS(=O)(=O)c1ccc(CC(=O)NNC(=O)c2cncn2-c2ccccc2)cc1	1254767880	DSWLEJDTFUODJQ-UHFFFAOYSA-N	427.486	1.174	50	20	IDGD	
Cc1nn([C@H]2CCS(=O)(=O)C2)c(C)c1C=NNC(=O)c1cccc(S(C)(=O)=O)c1	1317827619	LYIDQJWSBXPUOE-HNNXBMFYSA-N	438.531	1.027	50	20	IDGD	
Cc1nnnn1[C@H](Cc1ccc(F)cc1)C(=O)NNC(=O)c1cncn1-c1ccccc1	1317876070	ZLTNBQWWESXVQL-GOSISDBHSA-N	434.435	1.551	50	20	IDGD	
Cc1cc(C)n2ncc(C(=O)NNC(=O)NC3CCN(C(=O)OC(C)(C)C)CC3)c2n1	1318591367	SGKLQSPDWVAZOI-UHFFFAOYSA-N	431.497	1.690	50	20	IDGD	
CCC(CC)(CNC(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1)C(=O)OC	1319640493	QGMARFGVZPTNRD-UHFFFAOYSA-N	428.530	1.943	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)Cc3ccccc3NS(C)(=O)=O)n[nH]2)cc1	1320325127	IEZXWDXYZHBDQX-UHFFFAOYSA-N	427.486	1.760	50	20	IDGD	
CN(CC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)Cc1ccccc1	1337935048	UGUFVVXWFNLJHQ-UHFFFAOYSA-N	430.530	1.364	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4nonc4c3)C2)C1	1777718611	BZDJFCJRJKXQIJ-ZWKOTPCHSA-N	427.288	1.903	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCBr)C2)c1nc[nH]c1[N+](=O)[O-]	1778059156	ZSNMUNXXDJEOOT-BDJLRTHQSA-N	444.286	1.230	50	20	IDGD	
COCCn1ccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)C(C)(C)CCl)C3)n1	1778240519	ASQJGNDMGPUYRW-DYESRHJHSA-N	440.972	1.922	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnn3ccncc23)C1	1778685547	JAJGLVZSVJMIRX-WIYYLYMNSA-N	445.596	1.708	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)/C=N/O[C@H]3CCCCO3)C2)C1	1779105087	IGGCAUSHPWYHRF-YKUHDHSLSA-N	446.342	1.519	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccncc1O)C2)[C@H](F)Br	1780774664	HGAYQIDMAYGZHG-JKIFEVAISA-N	430.274	1.605	50	20	IDGD	
C[C@H](Nc1ccccn1)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781331914	RTXJKGYKGWEHIC-RVSPLBMKSA-N	429.290	1.402	50	20	IDGD	
O=C(c1ccc2nn[nH]c2c1)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781335221	WGYJYRYKYOMRLF-CZUORRHYSA-N	426.246	1.092	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)COc2ccc(O)nn2)C1	1781493288	WBGUUQIZKQKHEM-BXTJHSDWSA-N	440.928	1.482	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C1(C)CCCCC1)C2	1782214036	JNTNYLWJZXQHNU-WZONZLPQSA-N	436.597	1.844	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc4n(n3)CCCN(C)C4)C2)C1	1782559019	MDKXEEHDQDEFRR-UWJYYQICSA-N	437.972	1.570	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)Cc3cc(Cl)ccc3OC)C2)C1	1782978135	CSJQYBPUNSCYLP-OXQOHEQNSA-N	445.343	1.975	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cccn4cncc34)CCO2)C1	1783349442	LVHQROCNBJEHQI-HNAYVOBHSA-N	435.322	1.951	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)/C=N/O[C@@H]3CCCCO3)CCO2)C1	1783349550	NGOMCZOXSLOACD-SMABWXKKSA-N	446.342	1.519	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)Cn3cnc4ccccc43)CCO2)C1	1783539953	PSEXZBVUBFQOQV-IFXJQAMLSA-N	435.322	1.650	50	20	IDGD	
O=C(CSc1ccccc1[N+](=O)[O-])N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1783781442	HOSSINNTGWGNJI-KDOFPFPSSA-N	443.909	1.117	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1783854197	JTTMXBGMYIYKRD-AHXJXLJNSA-N	447.301	1.262	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1[C@H]3Sc4ccccc4[C@@H]31)CCO2	1783877959	SQUOKXPJKWYJCH-DFBFWZJZSA-N	436.961	1.958	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cscn3)C[C@@H]21	1783965758	POTRZBIBSAKDCV-DHMWGJHJSA-N	430.368	1.696	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(O)nc3)C[C@@H]21	1783970734	ZSNPEKZEUWWPLH-MXAVVETBSA-N	426.311	1.412	50	20	IDGD	
Cc1ccc(CCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Br)C[C@@H]32)cn1	1785262147	BNDWKYAAFUEPFS-OVWQWFNUSA-N	442.329	1.993	50	20	IDGD	
CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@@]2(CN(C(=O)C(Cl)Cl)CCO2)C1	1785348862	UAIBEFXDLNMSAG-XIKOKIGWSA-N	438.352	1.923	50	20	IDGD	
Cc1scc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]32)c1C	1786248852	OBEVSZRTQHZPGH-BQFCYCMXSA-N	436.578	1.331	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)COCc3ccccc3)[C@H]2C1	1786711863	LMESGDUEPWABKK-DKIMLUQUSA-N	439.350	1.966	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC1(c2ccc(NC(=O)c3cccc(=O)n3C)cc2)CCC1	1787247665	BHGRMTVYYLGXAF-UHFFFAOYSA-N	439.516	1.506	50	20	IDGD	
Nc1c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]3C2)sc2nccnc12	1787445839	OJCMJWLCCCZWKV-RUMNANIHSA-N	427.889	1.401	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)c3ccc(O)cn3)CCC2)cc1)c1cccc(B(O)O)c1	1788145965	LDAMCEPPSPZBCL-UHFFFAOYSA-N	431.257	1.529	50	20	IDGD	
COC(=O)[C@@H]1CC[C@@H](C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]3C2)C1	1789921163	ADRUUHHAIPBTKR-UMBPPFEGSA-N	449.317	1.246	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc4ccnn34)C[C@@H]21)[C@@H](F)Br	1789923650	ZQOIQCYMIGJLCT-DLKVLKDVSA-N	439.285	1.618	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4cccnn4c3)C[C@@H]21)[C@@H](F)Br	1789925168	PKIFIRWDNUMHEY-VCOSZWKGSA-N	439.285	1.618	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3n[nH]c4ccccc34)C[C@@H]21)[C@H](F)Br	1789926371	VIVJHMSWCYTDFO-ZAJUMQRFSA-N	439.285	1.847	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(-n4cncn4)c3)[C@H]2C1	1790250153	FGUJUCJTZFAAII-WNHJNPCNSA-N	431.924	1.878	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Cl)C[C@@H]21)c1ccc(-c2ccc(O)nn2)cc1	1790300217	LPVXDQXRHXXDNO-RIVXBTQJSA-N	448.882	1.977	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCSC(=N)N)C[C@@H]21	1790961073	GGBRCVRREZKAFL-CYDGBPFRSA-N	435.388	1.156	50	20	IDGD	
O=C(CCCn1ccnc1)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1	1791823027	HQKFQQBGGJYOJY-UHFFFAOYSA-N	446.316	1.791	50	20	IDGD	
Cc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](O)CCl)ccc1Br	1792978623	JKEVMAZXUZYZPJ-OCVGTWLNSA-N	445.741	1.560	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2	1793447039	TWGNITQSTJXSQW-BCMCZCDPSA-N	437.928	1.118	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](N)c1cccc(Cl)c1	1795629893	KJNJJECNDFKHKH-MIGXYKPQSA-N	444.757	1.713	50	20	IDGD	
Cn1ncc2c(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@H](F)Br)C4)cccc21	1797090423	RMXIABZEGNBVTM-OJXGSEEGSA-N	439.285	1.467	50	20	IDGD	
C[C@H](C#N)c1cccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)c1	1798443487	BCOIIDKHYUZICU-DQEVTTJGSA-N	446.511	1.878	50	20	IDGD	
C[C@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2)[S@@](=O)c1ccccc1	1800217483	WCJMOFXZSPPKGI-QVTFYQADSA-N	433.357	1.576	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CO[Si](C)(C)C)C2	1800955804	UHUDLTWPFRIYMU-FSNPWBFUSA-N	438.597	1.183	50	20	IDGD	
C[C@H](Oc1cccnc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2	1801398737	HPURBNFNRSYIBA-ZJOBFFGXSA-N	426.311	1.224	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@@H]1c1cccnc1)c1csnn1	1803753065	IFQFKDLLDKIMAP-CYZMBNFOSA-N	428.287	1.943	50	20	IDGD	
CC(C)(C)OC(=O)N1CC=C(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](O)CCl)C3)CC1	1804031234	AGXOSJWWEYIURS-YYIAUSFCSA-N	441.956	1.792	50	20	IDGD	
O=C(/C=C/c1ccco1)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1804616865	ZUOMIGKZDCDLRN-WFXHXQAFSA-N	445.284	1.387	50	20	IDGD	
Cc1onc(-c2ccncn2)c1C(=O)N1CCC2(CCCN(C(=O)[C@H](O)CCl)C2)CC1	1805523120	PBDCJLUYRBXDQZ-MRXNPFEDSA-N	447.923	1.885	50	20	IDGD	
C[C@@H]1Oc2ccc(C(=O)N3CCC4(CCCN(C(=O)[C@@H](O)CCl)C4)CC3)cc2NC1=O	1805525582	ZUGGQGICXMGRIY-YOEHRIQHSA-N	449.935	1.851	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCC2(CCCN(C(=O)CN3CCS(=O)(=O)CC3)C2)CC1	1806700239	MUVAPYOMZYOMKJ-QGZVFWFLSA-N	448.029	1.356	50	20	IDGD	
O=C(c1cccc(=O)n1O)N1CCCC2(CCN(C(=O)[C@H](F)Br)CC2)C1	1807556131	MJFTWLURZLILIT-AWEZNQCLSA-N	430.274	1.621	50	20	IDGD	
C[C@H](C(=O)NC[C@@H]1CCN(C(=O)[C@H](F)Cl)[C@@H]1c1cccnc1)N1CCN(C)CC1	1807862111	AYBKPPJCOXHKEH-SPUZQDLCSA-N	425.936	1.258	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cc(O)no2)[C@H]1c1cccnc1)[C@H](F)Br	1808667893	GRVYDWIHGGBAKK-BPNCWPANSA-N	427.230	1.785	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2ccc3nn[nH]c3c2)[C@H]1c1cccnc1	1812302073	QJZHQRHFSZCMKS-TXPKVOOTSA-N	442.907	1.926	50	20	IDGD	
CC(=O)N/C(C)=C/C(=O)NC[C@@H]1CCN(C(=O)[C@H](C)Br)[C@H]1c1cccnc1	1812322203	KBAHCSMOANIOAD-MTSLXNDJSA-N	437.338	1.911	50	20	IDGD	
CC(=O)N/C(C)=C/C(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)Br)[C@H]1c1cccnc1	1812322205	KBAHCSMOANIOAD-SNPDJNHFSA-N	437.338	1.911	50	20	IDGD	
Cc1csc(C(=O)N[C@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)c1	1815337300	RGNDGDCQFXIUBK-AWEZNQCLSA-N	441.343	1.732	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ncc[nH]2)n[nH]1	1816247519	FYRXEGZRAPDUOT-FCUAXUHVSA-N	437.464	1.573	50	20	IDGD	
Cc1ncoc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1816538716	ZOIKQYIIHMVMPD-OAHLLOKOSA-N	438.448	1.324	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cocn2)n[nH]1	1816601976	INZJPWUAFWKQEV-UPVZUOOXSA-N	438.448	1.838	50	20	IDGD	
O=C(CN1CCOCC1)Nc1cc([C@H]2CCCCN2C(=O)CCBr)[nH]n1	1817146398	XPWJVMCUQIRSNP-CQSZACIVSA-N	428.331	1.519	50	20	IDGD	
Cc1nnc(CC(=O)Nc2cc([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)s1	1817576435	GCXVOIQCRYGIOX-CQSZACIVSA-N	448.553	1.177	50	20	IDGD	
C[C@](O)(CC(=O)O)CC(=O)N1CCCC[C@@H]1c1cc(NC(=O)CO[Si](C)(C)C)n[nH]1	1819597417	YIKNVTAEHQEGGT-AUUYWEPGSA-N	440.573	1.869	50	20	IDGD	
CC(C)(C)OCC(=O)N[C@@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1	1819793540	PPRFQDLQSZBNHH-LLVKDONJSA-N	446.533	1.183	50	20	IDGD	
Cc1noc(CC(=O)N[C@H]2CCc3nc(NC(=O)[C@H](F)Br)sc3C2)n1	1823005179	XRBWZWNMLGZZRA-MADCSZMMSA-N	432.275	1.680	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CS(C)(=O)=O)CC1	1824093012	KCFQENFJDCSUAT-DZGCQCFKSA-N	437.400	1.682	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](C)n3ccnn3)sc2C1	1824680517	ZNCIGPYSHSHODB-OUAUKWLOSA-N	441.355	1.939	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)Cc1cccs1)CC2	1826085457	VBALSFBNGZUMET-GFCCVEGCSA-N	435.575	1.732	50	20	IDGD	
Cc1cnn([C@@H](C)C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)CCC(=O)NN(C)C)CC3)c1	1826752982	WJQLZAAOGBRBPU-KBPBESRZSA-N	447.565	1.194	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](N)CCC(N)=O)CC1	1826822481	MTCHOSBKVIIJJP-PMPSAXMXSA-N	445.402	1.372	50	20	IDGD	
Cc1cc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)on1	1827050626	AWJCYDKJEFAUIR-LJQANCHMSA-N	425.294	1.210	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827052241	QOOQKVBTKSWMRN-HXUWFJFHSA-N	446.429	1.451	50	20	IDGD	
C=CCSCC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827056012	NYRQIOVDUYYAPY-FQEVSTJZSA-N	430.379	1.519	50	20	IDGD	
Cc1ncncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1	1829361811	BNMKUUNYRMKQBT-LJQANCHMSA-N	430.553	1.391	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3=CCCS3)C2)C1	1830536079	XUZZEKCMMJLGEK-DYVFJYSZSA-N	433.368	1.495	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CCCCN1C)CCO2	1830762907	LPHKCQCUCYBQNY-MDZRGWNJSA-N	446.386	1.101	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@](C)(O)C(F)(F)F)C2)C1	1831640524	NDYZLWNRFAXOHN-APHBMKBZSA-N	430.851	1.164	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)C(=O)C3CC3)CC2)CC1	1833277397	NCOYWKYOVOYXQW-CYBMUJFWSA-N	428.371	1.568	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(O)n3)CCO2)C1	1834193695	YGROLTGXTYZMDZ-MSOLQXFVSA-N	432.304	1.094	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)CCN(C)C)CC2)CC1	1834616131	BXVVCXIOCGJVPT-KRWDZBQOSA-N	431.419	1.683	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](F)Cl)CC2)CC1)c1ccc(-n2cnnc2)cc1	1834651553	XZGRUKFOOUHSPF-IBGZPJMESA-N	448.930	1.987	50	20	IDGD	
O=C(Cc1cccc(F)c1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1835025509	ZNHOVZQRHMAPQV-AEFFLSMTSA-N	447.276	1.515	50	20	IDGD	
CO[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1)c1ccccc1	1835285676	QDZDNDZVRYHMND-KXBFYZLASA-N	431.316	1.634	50	20	IDGD	
Cc1ccccc1C(=O)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1	1836253081	YZHHOAPXPJOXCL-UHFFFAOYSA-N	449.360	1.174	50	20	IDGD	
CCc1ccnc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)c1	1836360464	YKCRRJANEBQGIN-YJBOKZPZSA-N	444.301	1.405	50	20	IDGD	
Cc1nc(CC(=O)N2CCC(OC3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)c(C)s1	1836715266	OCXNTYBTKQEAMM-SFHVURJKSA-N	443.997	1.901	50	20	IDGD	
O=C(NCCC(=O)N1CCC(OC2CCN(C(=O)[C@@H](F)Cl)CC2)CC1)c1ccc[nH]1	1837148093	WJZWEUGUFKGLKD-GOSISDBHSA-N	442.919	1.668	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4cncn4c3)C2)C1	1837713077	FXERYIBXRZOMDQ-OAQYLSRUSA-N	446.580	1.256	50	20	IDGD	
Cc1cc(C(=O)N2CCC(OC3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)c[nH]1	1838160640	MEKKWHTXJQHLRB-UHFFFAOYSA-N	433.553	1.308	50	20	IDGD	
C=C(Oc1ccccc1O)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](Cl)CC)CCO2	1839144510	CORCTUXISIOLJE-IIBYNOLFSA-N	438.908	1.759	50	20	IDGD	
Cc1ccn(C)c1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2	1839153681	OETKILHBBQWRMJ-RTBURBONSA-N	432.348	1.640	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CC3CCOCC3)C2)C1	1840032121	OEBFYLOEAYEMCH-KBXCAEBGSA-N	433.343	1.043	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1	1840033647	MJGFLWDNUGNLSI-BBRMVZONSA-N	437.407	1.078	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3cncc(C)c3)C2)C1	1840150730	PRQRIIYMMKIMLU-WIYYLYMNSA-N	439.940	1.033	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4ncoc4c3)C2)C1	1840152625	NZADTGYJGOXRIK-FOIQADDNSA-N	437.880	1.152	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)/C=C/C3CCCCC3)C2)C1	1840154889	JFFVSBLFOAHSGV-QQINGMOHSA-N	428.957	1.833	50	20	IDGD	
O=C(c1cnn2ccccc12)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840187522	GSAAUJOUWSFUFQ-SFHVURJKSA-N	427.288	1.208	50	20	IDGD	
CC(C)(C)c1cnc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)cn1	1840187835	ZQMMDJUDNAKKJW-IBGZPJMESA-N	445.347	1.648	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)C3CCC(O)CC3)CCO2)C1	1840274285	BYYVEAUCLLZRGR-QIRNKGDASA-N	437.364	1.230	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(C)cc3Cl)CCO2)C1	1840697398	VDMBUZVZLAJHTA-YLJYHZDGSA-N	445.343	1.972	50	20	IDGD	
C[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1C(=O)N1CCCC12CN(C(=O)[C@H](O)CCl)C2	1841794045	YOZUHKXASFAWOQ-BZUAXINKSA-N	443.972	1.683	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)c2cnc(C)nc2)C1	1842333810	FOSUTUZASIUCRV-UHFFFAOYSA-N	439.428	1.749	50	20	IDGD	
COc1ccc(Cl)c(C(=O)N2CC3(CCCN3C(=O)c3cccc(B(O)O)c3)C2)c1	1843015155	OARVXIKBZWRPEN-UHFFFAOYSA-N	428.681	1.159	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1ccnc(C(F)F)c1)C2	1844263834	ZRFWWBQUDATLHL-UHFFFAOYSA-N	430.415	1.149	50	20	IDGD	
O=C1Nc2ccccc2Cn2nc(C(=O)N3CCCC34CN(C(=O)[C@@H](F)Cl)C4)cc21	1844640813	ZZTZDKHXVNKAFF-MRXNPFEDSA-N	431.855	1.849	50	20	IDGD	
C[C@@H](C(=O)N1CC2(CCCN2C(=O)/C(C#N)=C/c2ccc(F)cc2F)C1)n1ccnn1	1845871766	LVNVVXBWGZYAHW-FSEGOYHTSA-N	426.427	1.928	50	20	IDGD	
C[C@@H](C(=O)N1CCCC12CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)C2)n1cncn1	1846601677	WQCXCZGUARHCQB-WBNYAZSOSA-N	426.427	1.928	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2cccc(C(=O)NNC(=S)NC(C)(C)C)c2)C[C@H](C)O1	14895277	DIMLPUOOEAHVFY-STQMWFEESA-N	428.580	1.392	50	20	IDGD	
O=C(CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)NNC(=O)c1ccc2c(c1)OCO2	21190450	IQQLSGQXFNPIMX-UHFFFAOYSA-N	428.357	1.473	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COc2cccc(C)c2)cc1S(=O)(=O)NC(C)(C)C	28581112	ZBNIPJWBBGIDPT-UHFFFAOYSA-N	449.529	1.920	50	20	IDGD	
O=C(CNC(=O)c1cc(-c2ccccc2)on1)NNC(=O)c1cc(Br)c[nH]1	109867254	AVHAXAYPUGCRTF-UHFFFAOYSA-N	432.234	1.623	50	20	IDGD	
Cc1nc(CNC(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)nc2ccccc12	726717355	SBBZVEKITIOMSN-UHFFFAOYSA-N	429.506	1.846	50	20	IDGD	
O=C(CCn1cnc2ccc(Br)cc2c1=O)NNC(=S)NCC1CCC1	727865848	BUSBCZOGTDVART-UHFFFAOYSA-N	438.351	1.845	50	20	IDGD	
Cc1c(/C=C(\C#N)C(=O)N2CCN(C(=O)c3ccc4nc[nH]c4c3)CC2)cc(C#N)n1C	728190083	BICISAOYXWKXLF-GIJQJNRQSA-N	427.468	1.973	50	20	IDGD	
CC(=NNC(=O)[C@H]1CCS(=O)(=O)C1)c1ccc(OCC(=O)Nc2ccccc2)cc1	730576067	LLAFZPKCEKZICF-KRWDZBQOSA-N	429.498	1.979	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NC[C@@H](C(C)C)N2CCOCC2)cc1Br	732237782	HWPBGBUBEUJVKN-HNNXBMFYSA-N	443.342	1.759	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)[C@@H]2CC(c3cc(F)ccc3F)=NO2)c2ccccc2c1=O	732653724	GTDFMTMIGKJPIA-INIZCTEOSA-N	427.367	1.166	50	20	IDGD	
Cc1cccc(-n2c(NNC(=O)CCCN3C(=O)CNC3=O)nc3ccccc3c2=O)c1C	733264147	DYJZOTFKKMEWEF-UHFFFAOYSA-N	448.483	1.778	50	20	IDGD	
CCOCCCn1c(NNC(=O)[C@H]2CC(=O)N(C(C)(C)C)C2)nc2ccccc2c1=O	733268447	LRUQGQSRPDNCLO-HNNXBMFYSA-N	429.521	1.913	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	733521393	QQOOPKRQVPBCMV-AWEZNQCLSA-N	436.421	1.299	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(N2C[C@H](C(=O)NNc3cc(C)ncn3)CC2=O)cc1	734254174	MICLUFDCFAWMLA-OAHLLOKOSA-N	446.533	1.312	50	20	IDGD	
Cc1cc(NNC(=O)c2cccc(NS(=O)(=O)c3ccc4nnn(O)c4c3)c2)ncn1	734255102	ARJDGGDBYADVBV-UHFFFAOYSA-N	440.445	1.325	50	20	IDGD	
Cn1cc(C(=O)NNC(=S)Nc2cc(C(F)(F)F)ccc2Cl)c(=O)n(C)c1=O	735114349	HASVVRBAQCQERJ-UHFFFAOYSA-N	435.815	1.388	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H](C)c2cn(C)nc2C)c1	739035803	XMRSXPFZLPIDBC-ZDUSSCGKSA-N	436.538	1.464	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CN2CCN(c3ccccn3)CC2)ccc1OC(C)C	740748879	BUCLJVDCGPIWCW-UHFFFAOYSA-N	427.505	1.461	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)cc1C1CC1	742032721	XEGPXKGAOBPRKA-UHFFFAOYSA-N	431.518	1.547	50	20	IDGD	
Cc1cc2c(cc1C)O[C@@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)N3CCCC3)c1)C2	742468420	UCTADRYHCWGRMH-HXUWFJFHSA-N	443.525	1.853	50	20	IDGD	
CC(C)c1c(C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)cnn1-c1ccccn1	744701780	RZXYOSDLIRNLEE-UHFFFAOYSA-N	432.440	1.880	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)c2cc(Br)cnc2Cl)cc1	744910549	RUJUPXLYKBCPSP-UHFFFAOYSA-N	437.637	1.987	50	20	IDGD	
C[C@@H]1C[C@@H](NC(=O)NNC(=O)Nc2ccc(OC(F)F)cc2)C(=O)N1c1cnn(C)c1	745916351	CHTCAEVIBINKEF-QMTHXVAHSA-N	437.407	1.551	50	20	IDGD	
CC(C)(C(=O)NNC(=O)[C@@H](CCC(N)=O)N1C(=O)c2ccccc2C1=O)c1ccccc1	746239729	QEJIXKKEMJBTFK-QGZVFWFLSA-N	436.468	1.042	50	20	IDGD	
CCS(=O)(=O)N1CCC(C(=O)NNc2nc(C)cc(OC)n2)(c2ccccc2)CC1	746623179	ITPAOHPZHQUVTC-UHFFFAOYSA-N	433.534	1.620	50	20	IDGD	
COc1cc(C)nc(NNC(=O)NCc2ccccc2OCC(=O)NC[C@@H]2CCCO2)n1	746757113	DSVIQLIDTYGUPB-INIZCTEOSA-N	444.492	1.294	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@H](C)CN(C)C(=O)OC(C)(C)C	746821488	KSHBMFHTOALASZ-GFCCVEGCSA-N	441.554	1.552	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)c1ccc(C)cc1)C(=O)NNC(=O)Cc1ccncc1	747428126	FTIVFAVFSAPUIG-QGZVFWFLSA-N	436.559	1.180	50	20	IDGD	
COC(=O)c1ccc(OC)c(S(=O)(=O)NNC(=O)c2cccc(OC(F)F)c2)c1	747613433	JEIHDAYBBIXJEZ-UHFFFAOYSA-N	430.385	1.707	50	20	IDGD	
CCn1c(NNC(=O)CNC(=O)c2cc(-c3ccccc3)on2)nc2ccccc2c1=O	749386276	IFGNBMZHDLRWLZ-UHFFFAOYSA-N	432.440	1.945	50	20	IDGD	
NC(=O)c1ccc(/C=C\C(=O)N2CCC[C@H]2C(=O)NNC(=O)CCc2ccccc2)cc1	749800079	JIDXUMIRHWROJM-HFZJLKNISA-N	434.496	1.570	50	20	IDGD	
O=C(NCc1csc(CNC(=O)c2ccccc2)n1)NNC(=O)c1ccccc1O	750665168	RSFXMBFQLRPGRS-UHFFFAOYSA-N	425.470	1.923	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)C1CCN(C(=O)c2ccc(Cl)s2)CC1	751203500	QJIOEJHWVQYMPS-UHFFFAOYSA-N	438.893	1.424	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNS(=O)(=O)c1ccc(OCC2CCCCC2)cc1	751281266	CLHXUCJNNZYSJS-UHFFFAOYSA-N	435.502	1.978	50	20	IDGD	
Cc1n[nH]c(C)c1[C@H](C)C(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	752577248	FVNUQVDXMPNWPC-AWEZNQCLSA-N	432.956	1.749	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N[C@@H](C)c2nc[nH]n2)cc1	752640357	VHGIKQSNEILAGY-NCPSJORJSA-N	434.460	1.337	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCCn2c(O)nc3ccccc32)c2ccccc2c1=O	753038965	RPFNWOAIKVNRRN-UHFFFAOYSA-N	435.444	1.116	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)c2cc(S(=O)(=O)N(C)C)oc2C)o1	753293635	JMQWEWDYWZYDKB-UHFFFAOYSA-N	426.495	1.348	50	20	IDGD	
Cc1oc(S(=O)(=O)N(C)C)cc1C(=O)NNC(=O)c1ccc(F)cc1Br	753295078	MPXRHVPYVXNHAQ-UHFFFAOYSA-N	448.270	1.815	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNc3ccc(C#N)c(Cl)c3)CC2)cc1	753297938	GVXNDDCTPYLHEU-UHFFFAOYSA-N	447.948	1.970	50	20	IDGD	
CNS(=O)(=O)c1cc(NC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])ccc1C	755516636	VCRGYSYVBCJNFC-UHFFFAOYSA-N	437.434	1.043	50	20	IDGD	
CCCCn1nc(C(=O)NN=Cc2cnc(N3CCN(C)CC3)nc2)c2ccccc2c1=O	755541675	GYSACLDCLZUPOY-UHFFFAOYSA-N	448.531	1.502	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)Nc1ccccc1C(=O)N1CCN(C)CC1	755622290	ILOFQPNFTYQOJM-UHFFFAOYSA-N	439.516	1.868	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)N2CCN([C@@H](C)C(=O)N3CCCC3)CC2)c1C	755727846	KYRUXUHKGKLQFW-RAGBYUADSA-N	441.576	1.813	50	20	IDGD	
CSc1nnnn1-c1cccc(NC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1	755734954	PLYXCOBFCGCXAL-HNNXBMFYSA-N	427.446	1.377	50	20	IDGD	
CN(C)C(=O)COc1cccc(NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c1	755960225	HQXAKWPLSJFIRE-UHFFFAOYSA-N	434.474	1.024	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)Nc1cccc(C(=O)Nc2cccc(F)c2)c1	756088729	FYPDCILKZAVTCE-ZDUSSCGKSA-N	434.449	1.665	50	20	IDGD	
O=C(NNC(=O)c1cccc2ncccc12)Nc1cccc(N2CCS(=O)(=O)CC2)c1	756208222	VYZOJGFXXUYMCG-UHFFFAOYSA-N	439.497	1.936	50	20	IDGD	
CNS(=O)(=O)c1ccc(C)c(NC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])c1	756526809	OHZVZTZPZBKRGA-UHFFFAOYSA-N	437.434	1.043	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1	756610556	PIYPEBZIDITWAN-LLVKDONJSA-N	437.434	1.478	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2cnn(-c3ccccc3)c2)cc1	756707552	IZQBPYVSXVTRMJ-UHFFFAOYSA-N	442.501	1.654	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(C)(C)CNC(=O)OC(C)(C)C)c2ccccc2c1=O	756899635	LGGYWJWSNNOPBW-UHFFFAOYSA-N	431.493	1.728	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)c2c(C)nc3ccccn23)ccc1S(=O)(=O)N(C)C	757775311	GPOVJLJVJDXJNX-UHFFFAOYSA-N	446.489	1.368	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)c2c(C)nc3ccccn23)cc1S(=O)(=O)NC1CC1	757868355	ZPPJWEUQGIIKKV-UHFFFAOYSA-N	442.501	1.858	50	20	IDGD	
Cc1cnn(-c2ccc(C(N)=O)cc2NC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1	757875147	MAKMZNZYSYTQHQ-GOSISDBHSA-N	436.428	1.272	50	20	IDGD	
CC(C)(C)Oc1cccc(CCC(=O)NNC(=O)c2csc(N3CCOCC3)n2)n1	758372834	VBSOZGOQSONBBO-UHFFFAOYSA-N	433.534	1.946	50	20	IDGD	
O=C(NNC(=O)N1CCN(c2ncc(F)cn2)CC1)c1ccc(COc2ccccc2)o1	759211527	KWICWQGHDINGSB-UHFFFAOYSA-N	440.435	1.964	50	20	IDGD	
CC(C)NC(=O)NNC(=O)[C@]12CCC(=O)N1c1ccccc1C(=O)N2Cc1ccccc1	759644611	VDKYQHHJMGWJIM-QHCPKHFHSA-N	435.484	1.905	50	20	IDGD	
N#C/C(=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)NN1CCCC1=O	762646877	MJDMIDKSNIMXPB-UVTDQMKNSA-N	426.864	1.639	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)ccc1OC1CCOCC1	763441794	JQKLGCJOJFFKSQ-UHFFFAOYSA-N	442.428	1.861	50	20	IDGD	
COCC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2Br)cc1	763482131	DIWZNVPIQQTRSY-UHFFFAOYSA-N	449.261	1.434	50	20	IDGD	
Cc1nn(C)c2ncc(NC(=O)C(=O)NNC(=O)c3ccccc3Br)cc12	763483144	NWFLKAHPKHXTSQ-UHFFFAOYSA-N	431.250	1.439	50	20	IDGD	
CN(C)CCCOc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)cc1	763548810	SEXYMNXGTANHSU-UHFFFAOYSA-N	428.445	1.146	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)C(=O)Nc2cnn(-c3ncccn3)c2)c1	763598043	SJIXCQFGXODHRK-UHFFFAOYSA-N	437.460	1.259	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)nn1-c1ccccc1	763604874	ORZWIEVNVCVGKE-UHFFFAOYSA-N	429.440	1.971	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)COc2cc(C)cc(C)c2)ccc1Cl	763648454	DKWGRHQHNFNJLN-UHFFFAOYSA-N	433.848	1.908	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(S(C)(=O)=O)cc2C)cc1C	763667171	RJAQSZOJPNTAPB-UHFFFAOYSA-N	433.486	1.180	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)C(=O)Nc1ccc(-n2cncn2)c(Cl)c1	763680392	GUWPOKWKSGNGPZ-UHFFFAOYSA-N	432.799	1.225	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3cccc(N(C)C)c3)cc2)C[C@@H](C)O1	763753513	GMXBCOUWCMRRIJ-IYBDPMFKSA-N	439.516	1.766	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)C(=O)N1CCc2ccc(Br)cc21	763838968	CLRFASHLDXYBFX-UHFFFAOYSA-N	436.237	1.704	50	20	IDGD	
CCOC(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)c1	763849886	LVIGQPAXYWGLJY-CYBMUJFWSA-N	431.420	1.485	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cccc(OCCF)c2)cc1	763873704	XVBQKBPCCVCXJI-CQSZACIVSA-N	431.420	1.791	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)C(=O)Nc2cccc(-c3nnc(C)n3C)c2)cc1	763898132	LAGAYLCMMQHIPV-UHFFFAOYSA-N	438.513	1.977	50	20	IDGD	
CC(C)N(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)CSc2ccccc2O)cc1	764047339	GIXIJGYENIMJKQ-UHFFFAOYSA-N	437.543	1.974	50	20	IDGD	
COC(=O)CSCc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(C)cc2O)c1	764109909	MMGXKAJUCVDQGN-UHFFFAOYSA-N	431.470	1.507	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1O)C(=O)Nc1ccc(N2C(=O)CCCC2=O)cc1	764115688	UIFIFTXQLVMSQM-UHFFFAOYSA-N	444.831	1.489	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3ccc(Cl)cc3O)cn2)C[C@H](C)O1	764126011	DQHLTYNGDVQECE-RYUDHWBXSA-N	447.879	1.454	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(NC(C)=O)ccc2OC)o1	764138182	FAFLCPYAVQKSST-UHFFFAOYSA-N	445.476	1.488	50	20	IDGD	
CCN(CC(=O)NNC(=O)c1ccc(C#N)cc1)CC(=O)Nc1ccc2c(c1)OCCO2	764155532	CZQNFPSDPIBKAV-UHFFFAOYSA-N	437.456	1.051	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(C#N)cc2)cc1OCc1ccncc1	764177842	SRLXJSDAZHOVDK-UHFFFAOYSA-N	445.435	1.941	50	20	IDGD	
O=C(CCc1ccccc1)NNC(=O)C(=O)Nc1ccc(N2CCOCC2)c2ccncc12	764193088	YBYHWPWDSIENLX-UHFFFAOYSA-N	447.495	1.790	50	20	IDGD	
CN(C)CC(=O)NNC(=O)C(=O)Nc1ccc(OCC(F)(F)F)c(C(F)(F)F)c1	764212917	RENLZSZDICQETM-UHFFFAOYSA-N	430.305	1.294	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)C(=O)Nc1cc(Cl)ccc1OC[C@@H]1CCCO1	764268338	ICHPNWLTHITFFM-HNNXBMFYSA-N	432.864	1.621	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1cnn(-c2ccccc2Cl)c1	764278660	UADFPDLDAPIYGQ-UHFFFAOYSA-N	429.820	1.396	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)Cc2ccncc2)n(-c2cccc(C(F)(F)F)c2)n1	764355472	BLDXBMVCUKLRCY-UHFFFAOYSA-N	446.389	1.923	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2cnn(-c3ccccc3)n2)n[nH]1	764377932	SXIUREALWJOKLQ-UHFFFAOYSA-N	446.427	1.066	50	20	IDGD	
N#Cc1ccc(OC(F)F)c(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)c1	764401953	UIVXOYFEJZXFEL-UHFFFAOYSA-N	436.396	1.743	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNc1ccc(C(N)=O)nn1	764566715	VMKKGMBTJIGCDY-INIZCTEOSA-N	439.476	1.636	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNc2ncncc2Cl)cc(Br)c1F	764673325	OXTHWVKMYJXFII-UHFFFAOYSA-N	446.620	1.900	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)N[C@@H]1CCO[C@@H](c2ccccc2)C1	765192130	FIBJGKVTWQMJSB-NVXWUHKLSA-N	431.518	1.844	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)[C@@H]1CCCN1C(=O)Cc1ccccc1	765312893	GLTFQVZBVCNFFR-KRWDZBQOSA-N	432.521	1.672	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)cc1F	765395649	AWNCQSZACOQKFI-UHFFFAOYSA-N	436.465	1.562	50	20	IDGD	
O=C(CN1C(=O)COc2ccc([N+](=O)[O-])cc21)NNC(=O)c1cc(-c2cccs2)[nH]n1	765569402	HWAPLZKXLRXGLH-UHFFFAOYSA-N	442.413	1.233	50	20	IDGD	
CN(C)c1ccc(C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)cn1	765753001	UHBUGCQARTYXCP-UHFFFAOYSA-N	430.940	1.380	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cccc(-c4nnc(C)o4)c3)CC2)cc1	766648238	IZLRKRCMDKAEND-UHFFFAOYSA-N	448.527	1.932	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)c1ccccc1S(=O)(=O)C(C)C	767283529	LOZFPBWRYDMXOG-UHFFFAOYSA-N	432.498	1.724	50	20	IDGD	
O=C(NNC(=O)c1ncn(-c2ccccc2)n1)c1cccc(S(=O)(=O)N2CCCC2)c1	768274210	OWKRCLNRIIITTR-UHFFFAOYSA-N	440.485	1.127	50	20	IDGD	
COc1ccc(C(=O)NCCNC(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)cc1	770261943	MNMDBRKHYYGSJQ-ZDUSSCGKSA-N	434.880	1.876	50	20	IDGD	
NS(=O)(=O)c1cc(F)cc(NC(=O)C(=O)NNc2ccc(Br)c(F)c2)c1	770815987	OBUVXMUAAMKTAV-UHFFFAOYSA-N	449.233	1.457	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)[C@H](CC(C)C)N1C(=O)[C@H]2CC=CC[C@H]2C1=O	771851709	CJMJQHVOSRDNNX-NXOAAHMSSA-N	435.521	1.478	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCCNC(=O)NNC(=O)c2ccc(Cl)cc2F)s1	772632562	YPXWVVOHCBOXFQ-UHFFFAOYSA-N	434.902	1.772	50	20	IDGD	
Cc1noc(-c2ccccc2)c1NC(=O)C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	773497059	TWMXZPJBSFTILZ-UHFFFAOYSA-N	442.453	1.453	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)c2cc(Cl)sc2S(N)(=O)=O)cc1OC	773712388	HSHCMEDZDAIPDD-UHFFFAOYSA-N	433.895	1.531	50	20	IDGD	
COc1ccc(-c2nnc(NC(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)s2)cc1	775837748	OECOBKKHCDOXNN-UHFFFAOYSA-N	437.445	1.656	50	20	IDGD	
Cn1c(CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)nc2cc(Cl)ccc21	777412402	SLACTZSZGQCPBM-UHFFFAOYSA-N	449.924	1.664	50	20	IDGD	
COc1cc(C(=O)CCC(=O)NNc2nccc(N3CCOCC3)n2)cc(OC)c1OC	777524241	UXQVLBSEDZYRNX-UHFFFAOYSA-N	445.476	1.445	50	20	IDGD	
O=C([C@@H]1CCCN1Cc1ccccc1)N1CCN(S(=O)(=O)CBr)CC1	777777983	VRPDDXDNKGHTJJ-INIZCTEOSA-N	430.368	1.477	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)CN2C(=O)N[C@](C)(c3ccc(C)cc3)C2=O)nc1C	778423505	DLNWEDLNQGKLJE-OAQYLSRUSA-N	440.460	1.180	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)CN1CCC[C@@H](S(=O)(=O)NC2CCCC2)C1	782056189	QHPVCOFFSZVCGZ-LJQANCHMSA-N	436.578	1.011	50	20	IDGD	
Cc1cc(C)c(S(=O)(=O)NNC(=O)CNC(=O)OC(C)(C)C)c(C)c1CC(=O)O	782259383	ZNJDYLAMYQIOIP-UHFFFAOYSA-N	429.495	1.073	50	20	IDGD	
Cc1c(NC(=O)C(=O)NN=c2sc3ccccc3n2C)c(=O)n(-c2ccccc2)n1C	783350034	UUNUJUIQSZFCEI-UHFFFAOYSA-N	436.497	1.608	50	20	IDGD	
N#CCc1ccc(OCc2ccccc2NC(=O)C(=O)NNC(=O)C(=O)N2CCCC2)cc1	784000166	XEGKHFQUNWZYAJ-UHFFFAOYSA-N	449.467	1.040	50	20	IDGD	
Cc1ccc(NC(=O)C(C)(C)C)cc1NC(=O)C(=O)NNC(=O)CNC(=O)c1ccco1	784002611	SUGDVLYTNMEJFX-UHFFFAOYSA-N	443.460	1.089	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ccc(Br)cn2)cc1NS(C)(=O)=O	784341680	RDEVCXCCEFOVBY-UHFFFAOYSA-N	442.295	1.606	50	20	IDGD	
O=C(NNc1ccc(Cl)nn1)C(=O)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1	784786117	DZPBGNHPJPPBNE-HNNXBMFYSA-N	440.895	1.855	50	20	IDGD	
COC(=O)c1cc(OC)c(OC)c(OC)c1NC(=O)C(=O)NNc1ccc(Cl)nc1	784871178	GBVWYUCHLJNFJG-UHFFFAOYSA-N	438.824	1.629	50	20	IDGD	
CC(C)n1nnnc1-c1ccccc1NC(=O)C(=O)NNc1ccc(C(F)(F)F)nn1	784886811	YLELQXHMLNQBCX-UHFFFAOYSA-N	435.370	1.812	50	20	IDGD	
Cc1cc(Br)cc(NC(=O)C(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)c1	785021757	BSAOVRVYYTYBQO-UHFFFAOYSA-N	437.206	1.771	50	20	IDGD	
COCCS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccc(C#N)c(Cl)c2)cc1	785094405	CRYCIHOVWZIJHQ-UHFFFAOYSA-N	436.877	1.714	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2ccc(C)cc2OCC(=O)N(C)C)n1	785226042	DGZYCVUCOSIOFH-UHFFFAOYSA-N	443.508	1.180	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1ccc(OC(F)F)cc1	785330481	IVILGLMZTZYSQS-UHFFFAOYSA-N	429.401	1.782	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@@H]2CCC(=O)c3ccccc32)cc1	785687544	YJVJQVFADRMGIJ-GOSISDBHSA-N	429.498	1.523	50	20	IDGD	
Cc1nc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)NC(C)(C)C)sc1C	789728298	ZGYFPKWWKUGUNZ-UHFFFAOYSA-N	425.536	1.919	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c(-c2ccoc2)n1	789868425	FFOQMWBIVATPGC-UHFFFAOYSA-N	443.485	1.539	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2ccc3c(c2)OCCO3)nnn1Cc1ccc(F)cc1F	790245674	JGVGBSJVQKKJGV-UHFFFAOYSA-N	429.383	1.759	50	20	IDGD	
O=C(NNC(=O)c1ccnn1-c1ccccc1)c1ccc(S(=O)(=O)N2CCCC2)cc1	792017164	YXYWEMLBCRVMCZ-UHFFFAOYSA-N	439.497	1.732	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNc2cccc(S(C)(=O)=O)c2)cc(-n2cccn2)c1	792351207	QRDDICWBDWIBQF-UHFFFAOYSA-N	429.458	1.366	50	20	IDGD	
C[C@](O)(Cn1cc(C(F)(F)F)ccc1=O)C(=O)NNC(=O)c1ccc(Cl)cc1O	792633490	XCKCPFZQDBATKQ-INIZCTEOSA-N	433.770	1.438	50	20	IDGD	
COc1ccc(Cn2cc(NC(=O)C(=O)NNC(=O)c3ccc4ccccc4n3)cn2)cc1	793023302	LQPUWVZEXWWXLG-UHFFFAOYSA-N	444.451	1.888	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)C(=O)Nc1cccc(Cl)n1	793023592	SDTNCDFZCBCCEI-UHFFFAOYSA-N	427.642	1.662	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)c2cccc(NN3C(=O)[C@H]4CC=CC[C@@H]4C3=O)c2)cc1	793290652	UVNJGUYDJHQRHA-OALUTQOASA-N	429.436	1.911	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c(OC)c(C)c1OC	796990260	AVTOFRMFDHDFPY-UHFFFAOYSA-N	432.389	1.329	50	20	IDGD	
CCCCNS(=O)(=O)c1ccc(C)c(NC(=O)C(=O)NNC(=O)CC(F)(F)F)c1	799834732	IPAJPSYEBQKFTJ-UHFFFAOYSA-N	438.428	1.112	50	20	IDGD	
COc1cccc(C=NNC(=O)CN2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)c1F	799883288	WVACYWITTTXTEB-UHFFFAOYSA-N	448.520	1.599	50	20	IDGD	
COc1ccc(Cl)c(NC(=O)NNC(=O)c2ccc([C@@]3(C)NC(=O)NC3=O)cc2)c1	802113338	NCCVVRXSLPATRD-LJQANCHMSA-N	431.836	1.870	50	20	IDGD	
Cc1cc(Br)c(C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)cc1N	803853701	VUZGXAOODWSSKP-UHFFFAOYSA-N	431.246	1.829	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)[C@H]2C[C@@H](c3ccccc3)OC2=O)c2ccccc2c1=O	809545725	IETYNPNUZIOCSY-MSOLQXFVSA-N	434.452	1.872	50	20	IDGD	
CN(NC(=O)[C@H]1C[C@H](c2ccccc2)OC1=O)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	809763122	KALXNPFHIRLNJF-IAGOWNOFSA-N	446.504	1.927	50	20	IDGD	
CCS(=O)(=O)c1ccc(NC(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)cc1	812918760	YLXCHPASOWDJDM-UHFFFAOYSA-N	426.520	1.879	50	20	IDGD	
COC(=O)c1cn(-c2cccc(NC(=O)NNC(=O)c3nnc(O)c4ccccc34)c2)nn1	812979322	OGCJTLPMXIFATM-UHFFFAOYSA-N	448.399	1.169	50	20	IDGD	
O=C(COC(=O)c1ccc(OC(F)F)c(F)c1)NNC(=O)[C@H]1COc2ccccc2O1	815484071	BTSCEGFKXUGCCD-OAHLLOKOSA-N	440.330	1.571	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3cnn(-c4ccccn4)c3N)n[nH]2)cc1OC	815886784	JBQNTMVLFASMPA-UHFFFAOYSA-N	448.443	1.332	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)CN2C(=O)C(F)(F)Oc3ccccc32)cc1	816781744	VLNZFEDAWTZGPB-UHFFFAOYSA-N	440.428	1.398	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@H](CCC(N)=O)C(=O)NNc2ccc(F)cc2F)cc1C	825198165	DIRLWHKPLMIKIT-QGZVFWFLSA-N	440.472	1.637	50	20	IDGD	
O=C(NCc1ccccc1)NC1(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)CCCC1	894382787	PZUZOMLCZIBUFL-UHFFFAOYSA-N	448.487	1.236	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)CNS(=O)(=O)c1ccc2ccccc2c1	913459285	KHEZXYJGVAWOOM-UHFFFAOYSA-N	441.509	1.907	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@H](C)C(=O)NNC(=O)CNS(=O)(=O)c1cccs1	915188583	BFDVZCNJZYEKQS-GFCCVEGCSA-N	445.950	1.912	50	20	IDGD	
CC(=O)Nc1cc(C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)ccc1C	915638507	YQVHGGIQNPOYNG-UHFFFAOYSA-N	432.502	1.344	50	20	IDGD	
COc1ccc([C@H](CNC(=O)NNC(=O)c2ccccc2O)N2CCOCC2)cc1OC	915895801	YKNRVJAGRUMZRA-KRWDZBQOSA-N	444.488	1.427	50	20	IDGD	
CCCS(=O)(=O)N1CCC(NC(=O)NNC(=O)[C@H](C)Oc2ccccc2F)CC1	916383517	KIDUOXXESONYBY-ZDUSSCGKSA-N	430.502	1.128	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)N[C@@H](CN2CCCC2=O)c2ccccc2)nc2ccccc21	916459952	SAAIHYCNBGIWCH-SFHVURJKSA-N	434.500	1.810	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@@H]2C(=O)NNC(=O)c2ccc(Cl)nc2)c(OC)c1	917252593	PDNIAMGMFODSJY-OAHLLOKOSA-N	432.864	1.818	50	20	IDGD	
COc1cccc(CCNC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c1OC	918216873	BUTPYMOBOGXUOK-UHFFFAOYSA-N	425.445	1.137	50	20	IDGD	
O=C(CCCS(=O)(=O)N1CCCC1)NNC(=O)c1ccc(F)cc1Br	918346048	LDUGNGBPBXFZEP-UHFFFAOYSA-N	436.303	1.555	50	20	IDGD	
Cc1cnc(O)n1-c1ccc(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1	918758925	IKCIMBVGGPEQPJ-UHFFFAOYSA-N	428.474	1.254	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2ccc(F)c(C(F)(F)F)c2)c1	920082595	NMTBCHMMWZWEMJ-UHFFFAOYSA-N	440.396	1.871	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NCc2cccnc2N2CCN(C)CC2)cc1C	921247421	DSSPWAMRURGEIE-UHFFFAOYSA-N	426.521	1.360	50	20	IDGD	
COc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NNC(=O)c2cncn2-c2ccccc2)cc1	1115816193	IVXMOWOGAZGYJG-AWEZNQCLSA-N	443.485	1.009	50	20	IDGD	
COc1ccccc1-c1noc([C@H](C)NCC(=O)NNC(=O)Cc2nc(C)cs2)n1	1254686633	PLSFQLWYYRNSGN-LBPRGKRZSA-N	430.490	1.551	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)NCC(=O)N2CCc3ccccc32)CC1	1318623503	OEULLCDXGBXWGQ-UHFFFAOYSA-N	445.520	1.553	50	20	IDGD	
CN1CCN(c2ccc(C=NNC(=O)C3CCN(c4ncccn4)CC3)cc2F)CC1	1338542470	JEIIFBOHSAHZNF-UHFFFAOYSA-N	425.512	1.734	50	20	IDGD	
Cc1nc2ccc(S(=O)(=O)N3CCN(S(=O)(=O)CBr)CC3)cc2o1	1338808494	JYVXNYBVLGIMRF-UHFFFAOYSA-N	438.325	1.125	50	20	IDGD	
C[C@H]1CCc2c(C(=O)N3CC[C@]4(CN(C(=O)CCBr)CCO4)C3)n[nH]c21	1777850293	LHJSIUHPTJNOOT-SGTLLEGYSA-N	425.327	1.688	50	20	IDGD	
C[C@@H]1CCc2c(C(=O)N3CC[C@@]4(C3)CN(C(=O)[C@@H](F)Br)CCO4)n[nH]c21	1777851823	BUKIOLRIAXGOQF-LGFNAOKASA-N	429.290	1.593	50	20	IDGD	
CC(=O)Nc1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)C(Cl)Cl)C3)ccn1	1778405366	SOIHBDDQBUXCHS-AUUYWEPGSA-N	443.331	1.971	50	20	IDGD	
C=C(Oc1ccccc1O)C(=O)N1CCO[C@@]2(CCN(C(=O)CO[Si](C)(C)C)C2)C1	1779295378	LABAHHLZIKTHMN-OAQYLSRUSA-N	434.565	1.966	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCc1cnccn1)C2	1779545812	KTWKINKMTCYBRE-WIYYLYMNSA-N	434.613	1.775	50	20	IDGD	
Cc1nccnc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Br)C2	1779875332	LHULLKCWKALVGW-SUYBPPKGSA-N	429.290	1.603	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(C1)CN(C(=O)C1(F)CC1)CCO2	1780098733	SVCHIRXRWZOELE-LJQANCHMSA-N	435.408	1.466	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)[C@@H]1SC(=N)NC1=O)C2	1780702527	KBELBSVGVDIJFZ-ROOHJGOOSA-N	444.985	1.320	50	20	IDGD	
Cc1c(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](F)Br)C2)cnn1C	1780771907	SHPWFISSTAKXAP-CKEIUWERSA-N	431.306	1.547	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H]1C[C@@]13C(=O)Nc1ccccc13)CCO2	1781221355	CPVGQUXIEFBXCQ-AERDPVEMSA-N	431.920	1.744	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(S(C)(=O)=O)c(F)c3)CCO2)C1	1781223625	QPEXIIRZAQYEQB-AUUYWEPGSA-N	446.928	1.690	50	20	IDGD	
CC(=O)N[C@H](C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1)C(C)(C)C	1781325001	HKEMSIPWNFBRAT-XNJGSVPQSA-N	436.322	1.058	50	20	IDGD	
O=C(c1cc(C(F)F)no1)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781330840	HLSAVWOTWTUVNL-QMTHXVAHSA-N	426.189	1.746	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](O)Cc2ccccc2)C1	1781894281	UUYGAESBMRLJRB-TXTKFYIRSA-N	448.636	1.955	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cn3cccnc3n1)C2	1782175338	HOKFVWQLJULSHY-YYFZDKIDSA-N	435.912	1.111	50	20	IDGD	
O=C(c1cn2c(F)cccc2n1)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1782373330	HQDVIMYBRHNIED-WMLDXEAASA-N	443.248	1.607	50	20	IDGD	
O=C(C(Cl)Cl)N1CCO[C@]2(CCN(C(=O)[C@H]3CC(c4ccccc4)=NN3)C2)C1	1782608992	WTGKERAMMNKDNW-BEFAXECRSA-N	425.316	1.386	50	20	IDGD	
CC[C@H]1CC[C@H](C(=O)N2CC[C@@]3(CN(C(=O)c4cnccc4C(=O)NN)CCO3)C2)CC1	1783607761	BJJIQYGWOWOOQZ-QQMNAOGKSA-N	443.548	1.345	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCSC(=N)N)C[C@@H]21	1783967719	JSXLSHOJYIMWIT-VOAKCMCISA-N	435.388	1.014	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)c1nccc2[nH]ccc12	1787336637	KUZHBFKGCBQMEF-YLUJIRGKSA-N	439.285	1.847	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cn4ncccc4n3)[C@H]2C1	1788016433	GPBHXMFGCBVEQU-OSFYFWSMSA-N	436.310	1.106	50	20	IDGD	
CCn1nc(C(=O)NC2(c3ccc(NC(=O)c4ccc(B(O)O)cc4)cc3)CCC2)cc1C	1788142422	XDSPKDWMVOQMTJ-UHFFFAOYSA-N	446.316	1.953	50	20	IDGD	
CN(C)c1ncc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]3C2)o1	1789922399	MCPVYPYRCCDTGK-MRBYEJRBSA-N	433.278	1.024	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc4c(c3)CCNCC4)[C@H]2C1	1790619455	ZHILPDMJOOKKSF-BOLBYERCSA-N	434.968	1.381	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)n3ccccc3=O)C[C@@H]21	1791056304	SDFFMDCXUBKEQV-OWYFMNJBSA-N	440.338	1.172	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)COc3cc(C)ccc3C)C[C@@H]21	1791252871	UQMIMFUXFKFRKV-GNBUJSLZSA-N	438.952	1.916	50	20	IDGD	
Cn1ncc2c(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]4C3)cccc21	1791294936	YAKSIJHSQDJZOM-PJODQICGSA-N	425.316	1.970	50	20	IDGD	
COc1ccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)CBr)cc1	1792868431	YAQZKOORRYSMLI-AMVTXUCVSA-N	439.350	1.858	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1n[nH]c3c(Cl)cccc13)C2)[C@@H](O)CCl	1792980549	SPLSURSMGJSUDP-DJBIQUGXSA-N	427.288	1.019	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCc1ccc(F)nc1	1794293191	GKGXFJNELLYESK-MUJYYYPQSA-N	440.479	1.104	50	20	IDGD	
Cc1ccccc1OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Br)C2	1795303992	SGVPFRZTHFTGPJ-ZXFNITATSA-N	425.323	1.747	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)c1c(F)ccnc1Cl	1796188204	BLDSCANNASOJET-QDMKHBRRSA-N	431.660	1.120	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H]1CCC[C@@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Cl	1796371317	VADGSIWJHCSETC-PLZKBRGSSA-N	447.935	1.804	50	20	IDGD	
Cc1cccc2c(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)CO[Si](C)(C)C)n[nH]c12	1797957243	HQKIEQZAIUTUDJ-CCWDJLKJSA-N	430.581	1.926	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccn2nccc2c1	1798227825	XWVOPCYZRPOQGD-BECFQBPISA-N	447.499	1.720	50	20	IDGD	
Cc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)CBr)C3)nn1C(F)F	1798674764	YUCKBXLNBBWHAN-ZKCLLBTKSA-N	449.296	1.821	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(Cl)nc1Cl)c1cccc(B(O)O)c1	1798707650	ITXHTMMZSPOEOI-QDMKHBRRSA-N	448.115	1.634	50	20	IDGD	
Cc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@](C)(Cl)CCl)nc2nccn12	1799279214	CBQLBOPSQCUMQR-FCIKYMEBSA-N	440.331	1.477	50	20	IDGD	
COc1ncccc1CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Br	1799344911	XULGIUSOUWZLKO-OCVGTWLNSA-N	444.301	1.303	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c[nH]c3ncccc13)C2)[C@@H](F)Br	1799346886	DQDRXNZZZGYROT-RDBQEKCUSA-N	425.258	1.457	50	20	IDGD	
COc1cccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Br)c1C	1799347471	QEDCEKJQJPBSFQ-DACLVMHWSA-N	443.313	1.826	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cncc(N(C)C)c1)C2	1800758293	RZWIPXOVFLVUJB-OEYIWLLWSA-N	425.327	1.134	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)Br	1800763204	STGOABNDRPUEGO-KLOLGFOXSA-N	443.338	1.115	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1[C@@H](O)CCN1Cc1ccccc1	1801385513	SVMLHHMBBFDYLN-STHVQZNPSA-N	449.979	1.514	50	20	IDGD	
C[C@@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(=O)nc3cccnn13)C2	1801962950	FDFYYQJSTCILBD-FVCCEPFGSA-N	434.294	1.125	50	20	IDGD	
CCOC(=O)N1CCC(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)C(C)(C)CCl)C3)CC1	1801987409	AOTRURVQYNGZTA-BJWYYQGGSA-N	443.972	1.710	50	20	IDGD	
C[C@H](C(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1)C1(O)CCC1	1802469720	VHOTWNUXSFXNEW-HGHGUNKESA-N	445.564	1.012	50	20	IDGD	
CCS(=O)(=O)CC(=O)NC[C@@H]1CCN(C(=O)CO[Si](C)(C)C)[C@@H]1c1cccnc1	1803513212	OXKPRCWGRSJULQ-QFBILLFUSA-N	441.626	1.374	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)c2ccc[n+]([O-])c2)[C@@H]1c1cccnc1	1804781712	CRVGHDQGKXNSFI-QRTARXTBSA-N	433.306	1.818	50	20	IDGD	
COc1nn(C)cc1C(=O)NC[C@H]1CCN(C(=O)CO[Si](C)(C)C)[C@@H]1c1cccnc1	1805303132	JIGOHDMRZMGQBK-VQIMIIECSA-N	445.596	1.995	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)C(C)(C)NCCC#N)[C@@H]1c1cccnc1	1807149137	CZNZBZKMQGRBFD-SQNIBIBYSA-N	435.956	1.623	50	20	IDGD	
Cc1cccc(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)n1	1807369093	AIRKAANEFCOHGG-SIKLNZKXSA-N	444.300	1.098	50	20	IDGD	
CCc1cc(C(=O)NC[C@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)n[nH]1	1807776780	WYCSIYAZLBRVQR-IERDGZPVSA-N	441.536	1.060	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H](CNC(=O)[C@H](C)NC=O)[C@H]1c1cccnc1	1808345702	NRMZYWKASKQUHI-OCVGTWLNSA-N	425.327	1.253	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)c3cccc4[nH]ncc34)CC2)C1	1809978559	XKONJCDJABLBAA-UHFFFAOYSA-N	446.316	1.401	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)C(F)(F)Cl)[C@H]1c1cccnc1	1813072537	DASOPQZEMUXMML-BBRMVZONSA-N	431.871	1.292	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@H](O)CCl)CC2)c1ccc(-n2cnnc2)cc1	1814699764	XPYUATXEQPNPMR-IUODEOHRSA-N	446.920	1.549	50	20	IDGD	
C=CCSCC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1815654290	WQRLSLWBBNDPSY-MRXNPFEDSA-N	443.533	1.633	50	20	IDGD	
Cc1cc2nnc(C(=O)N[C@@H]3CCc4nc(NC(=O)[C@@H](F)Cl)sc4C3)c(C)n2n1	1817122528	JRAHJRFSJYOKMZ-YMTOWFKASA-N	437.888	1.958	50	20	IDGD	
C[C@]1(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)CC1(F)F	1817480053	XMPVSHFJBYZVKN-DNVCBOLYSA-N	432.236	1.441	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)CS(=O)(=O)N2CCCC2)[nH]n1)[C@@H](F)Cl	1818037153	GDSVIKHLMDFUDO-IUODEOHRSA-N	435.909	1.362	50	20	IDGD	
C=CC[C@H](C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819403847	ILXBJRJHOPRRNM-SUMWQHHRSA-N	425.493	1.926	50	20	IDGD	
CCc1nc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)co1	1819895677	GZUJCPNANQHWFE-KRWDZBQOSA-N	437.265	1.260	50	20	IDGD	
C[C@H](Cn1cncn1)C(=O)N[C@@H]1CCc2nc(NC(=O)CO[Si](C)(C)C)sc2C1	1820165377	FHGVIMUNXOJVKR-CHWSQXEVSA-N	436.614	1.834	50	20	IDGD	
Cc1cc(C)cc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2cccc(B(O)O)c2)CC3)c1	1822155186	KODNOGZQTYKMDG-GOSISDBHSA-N	449.341	1.979	50	20	IDGD	
C[C@@H](NC(=O)OC(C)(C)C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1	1822275356	YHRIXSCXBMPNJB-BNOWGMLFSA-N	443.932	1.915	50	20	IDGD	
Cc1cc(CC(=O)N2CCCC[C@@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)nn1C	1822412438	QZHJUDJHUFYTEL-QGZVFWFLSA-N	444.540	1.059	50	20	IDGD	
CC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](COC(C)=O)OC(C)=O)CC2	1822850554	STIWEQNIEXLQMR-SGMGOOAPSA-N	445.925	1.567	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)Cn1ccncc1=O)CC2	1822869277	HXAWXOBHHBTCIF-BMLIUANNSA-N	444.344	1.548	50	20	IDGD	
COC(=O)[C@@H]1CC[C@H](C(=O)N2CCC([C@H]3CCCCN3C(=O)[C@H](O)CCl)CC2)C1	1824176520	OXWWIOCBADWBEJ-BSDSXHPESA-N	428.957	1.795	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)C(=O)c2ccco2)CC1	1825062840	SPPHKPXGSCMDIO-KRWDZBQOSA-N	432.521	1.455	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)C[C@@H](NC)C(=O)O)CC2	1825446938	LXUUXRHPZFRXCU-ATZCPNFKSA-N	447.355	1.291	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CSc1nc[nH]n1)CC2	1826008897	JUNPPFOFEIZGNF-IUCAKERBSA-N	430.943	1.219	50	20	IDGD	
Cc1ccc(C(=O)N[C@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)cc1O	1826088717	KQDNQLISDMKDOL-AWEZNQCLSA-N	445.545	1.756	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(C#N)c1)CC2	1826089059	XUSODISCCPGHGT-OAHLLOKOSA-N	440.529	1.614	50	20	IDGD	
O=C(CN1CCOCC1)N1CCC([C@H]2CCCCN2C(=O)[C@@H](F)Br)CC1	1830375454	UMCZRLGVMSEMDX-NVXWUHKLSA-N	434.350	1.629	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@]3(C)CC3(F)F)C2)C1	1830545193	HQHPTIMDACNLSK-WQVCFCJDSA-N	439.297	1.519	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cn(C(C)(C)C)nn3)C2)C1	1831654366	KOCRQQQSHVCTSM-FOIQADDNSA-N	441.960	1.511	50	20	IDGD	
C[C@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)c3cnc(O)[nH]3)CC2)CC1	1833263022	GNTOWIDJXAYDGJ-GFCCVEGCSA-N	442.358	1.332	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cnc4ccoc4c3)CC2)CC1)[C@@H](O)CCl	1833310894	XWELBRNMIUVOMY-SFHVURJKSA-N	434.924	1.613	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H]3CCc4ccccc4C3)CC2)CC1)[C@@H](O)CCl	1833312595	ZCXDFQLIZZWVHR-KNQAVFIVSA-N	448.007	1.963	50	20	IDGD	
C[C@@H](C(=O)N1CCC(N2CCC(NC(=O)CCBr)CC2)CC1)C1(O)CCC1	1834421472	IRGSBIFDHIHFAV-HNNXBMFYSA-N	444.414	1.894	50	20	IDGD	
COc1nccc(C(=O)NC2CCN(C3CCN(C(=O)[C@H](O)CCl)CC3)CC2)c1F	1834906551	GJPHZEXSVFGNJL-MRXNPFEDSA-N	442.919	1.014	50	20	IDGD	
C[C@H](Nc1cnccn1)C(=O)N1CCC(N2CCC(NC(=O)[C@H](F)Cl)CC2)CC1	1835084081	KDUSFERPRIAAHK-GUYCJALGSA-N	426.924	1.383	50	20	IDGD	
C=C[C@H](O)C(C)(C)C(=O)NC1CCN(C2CCN(C(=O)CO[Si](C)(C)C)CC2)CC1	1835713012	GKPGFFMROFBBNE-IBGZPJMESA-N	439.673	1.983	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3ccc(CO)o3)CC2)CC1	1835928577	BGZIMRKMWNJSQK-CYBMUJFWSA-N	442.354	1.741	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccn4cncc4c3)C2)C1	1837712943	AOZLCVYRBOHUJQ-OAQYLSRUSA-N	446.580	1.256	50	20	IDGD	
COc1ccnc(C(=O)N2CCO[C@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)c1	1837950798	ZUXXSRNDZQJZRF-HXUWFJFHSA-N	425.913	1.425	50	20	IDGD	
CN(C)c1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)cn1	1838193806	YFQBIOKGNRTBOH-OAQYLSRUSA-N	438.956	1.483	50	20	IDGD	
CC(C)O[C@@H](C)C(=O)N1CCC(OC2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1	1838416067	HTICUMSARCENOT-KRWDZBQOSA-N	440.585	1.172	50	20	IDGD	
Cc1ncc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)s1	1839152600	FMWQHZQKWFLJMW-IRXDYDNUSA-N	436.361	1.758	50	20	IDGD	
Cc1ccn(C)c1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2	1839153680	OETKILHBBQWRMJ-RBUKOAKNSA-N	432.348	1.640	50	20	IDGD	
Cc1cscc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839200529	JMMORNCBSQPVIV-CZUORRHYSA-N	435.315	1.817	50	20	IDGD	
O=C(CCc1ccoc1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839203552	ONELWAZMYOWAFI-NVXWUHKLSA-N	433.274	1.359	50	20	IDGD	
O=C(c1cc(F)cc([N+](=O)[O-])c1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1839353798	QRZHNEGDKUVZAN-WMLDXEAASA-N	433.795	1.338	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C1(F)CC1)CCO2	1839759071	WNSSEFYTQZCEEQ-ZZKIFARHSA-N	449.429	1.830	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C#N)c[nH]3)C2)C1	1839966002	RICAWWVSCCSEJC-KDOFPFPSSA-N	439.310	1.130	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3CCC(CO)CC3)C2)C1	1840030471	NDYGAQLBNQJMBZ-XTUQQUOLSA-N	447.370	1.025	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3ccsc3)C2)C1	1840151417	AVSKNOSYXLBVQR-APWZRJJASA-N	430.954	1.391	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc4cc(C)[nH]c34)C2)C1	1840152884	XPDOEIVSHGCQLI-XMSQKQJNSA-N	449.935	1.800	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(C)cc(F)c3F)C2)C1	1840155365	ZDPQKCIRKAPZBW-QRWLVFNGSA-N	446.878	1.597	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C#N)ccc3F)C2)C1	1840155392	ZWJWIKWEVDXIJO-OXJNMPFZSA-N	439.871	1.021	50	20	IDGD	
C=CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1	1840174360	YRHHOYPBNUBMJJ-OAQYLSRUSA-N	447.444	1.166	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CCN3CCCC3)CCO2)C1	1840940951	NEHDWJWJRFRPFO-LPHOPBHVSA-N	446.386	1.102	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)c1ccc(CS(C)(=O)=O)nc1)C2	1841667801	GYBWCBSBAYINOI-INIZCTEOSA-N	427.954	1.851	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)c2ccc(O)cn2)C1	1842573239	ONNFIRKZSZKSPG-UHFFFAOYSA-N	440.412	1.752	50	20	IDGD	
COc1ccc(OC)c(CCC(=O)N2CCCC23CN(C(=O)CCC(=O)NN(C)C)C3)c1	1842785403	WVADKIXFETWLTI-UHFFFAOYSA-N	446.548	1.213	50	20	IDGD	
O=C(c1ccc(C(F)(F)F)cc1)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843011740	MZTMUIZWJLZFRP-UHFFFAOYSA-N	432.207	1.516	50	20	IDGD	
Cn1ncc(I)c1C(=O)N1CC2(CCCN2C(=O)[C@H](F)Cl)C1	1843364054	OCHFWOOYCGSGOP-JTQLQIEISA-N	440.644	1.376	50	20	IDGD	
COC(=O)CCCCCC(=O)N1CC2(CCCN2C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C1	1843416979	KJGWQHBFKAKLSI-LFVJCYFKSA-N	445.520	1.447	50	20	IDGD	
CCOC(=O)N[C@H](O)C(=O)N1CCCC12CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)C2	1844159599	MRIOVEXNJRCXDZ-LEHPZIBWSA-N	448.426	1.140	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)[C@H](C)n2ccnn2)C1	1845814297	UQAUQAXPNLLQFD-ZDUSSCGKSA-N	442.432	1.190	50	20	IDGD	
C[C@H](C(=O)N1CC2(CCCN2C(=O)[C@@H](Br)Cc2ccccc2)C1)n1cnnn1	1845943055	QJXVRLYLBHOQNJ-ZBFHGGJFSA-N	447.337	1.444	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCCC12CN(C(=O)c1ccc3c(n1)NC(=O)CC3)C2	1846069856	ACGWOMAFQMGVQR-CYBMUJFWSA-N	435.322	1.957	50	20	IDGD	
CC(C)(C)OC(=O)N1CCCC[C@@H]1C(=O)N1CCCC12CN(C(=O)[C@@H](O)CCl)C2	1846197586	ASMJTCNWMLVUCU-CABCVRRESA-N	429.945	1.579	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)c1ccc3sccc3c1O)C2	1846385638	CFDVGFGBUOZVAY-UHFFFAOYSA-N	430.530	1.797	50	20	IDGD	
CCN(CC)[C@H](C(=O)N1CC2(CCCN2C(=O)CCC(=O)NN(C)C)C1)c1ccccc1	1846385958	PBISHBDHBUOXIY-QFIPXVFZSA-N	443.592	1.646	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H]1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl	1847558490	MNXFFBOUYNDFGK-XFIYOXNOSA-N	429.945	1.481	50	20	IDGD	
CCC(=O)N[C@@H](C)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)/C(C#N)=C/c1ccc(F)cc1F	1847742236	XRRSXLUUIDYPCO-QDIBRQOTSA-N	430.455	1.988	50	20	IDGD	
CCS(=O)(=O)N1CCC(C(=O)NNC(=O)c2sc(-c3ccccc3)nc2C)CC1	12689954	PGQVGGSTMWTUDR-UHFFFAOYSA-N	436.559	1.941	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)c2cnc3n(c2=O)CCS3)cc(OCC)c1OCC	15662976	HAACLYXIRRBNAA-UHFFFAOYSA-N	448.501	1.620	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C1CCN(c2ccccc2[N+](=O)[O-])CC1	15795162	YHUYOYFVUGONRJ-LJQANCHMSA-N	426.429	1.799	50	20	IDGD	
Cc1cc(SCC(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)c(C)cc1Br	16785557	SDCASRTVLCAXAP-NSHDSACASA-N	435.365	1.740	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)CCn2c(=S)[nH]c3ccccc3c2=O)nc2ccccc21	17411433	YCILBMMJLXDEGH-UHFFFAOYSA-N	436.497	1.726	50	20	IDGD	
Cc1nc2nc(N)nn2c(C)c1CC(=O)NNC(=O)[C@@H](C)Oc1ccc2ccccc2c1	18052892	KEEMEUZKWVQPDG-CQSZACIVSA-N	433.472	1.634	50	20	IDGD	
CC(C)(C)NC(=S)NNC(=O)c1ccc(Cl)c(S(=O)(=O)NC[C@@H]2CCCO2)c1	28716663	WWXOLOVIILCSLZ-LBPRGKRZSA-N	448.998	1.705	50	20	IDGD	
CCNc1nc(NCC)n2c(SCC(=O)NNC(=O)c3ccc(CC)cc3)nnc2n1	108208104	HNRSJTWQIDSESW-UHFFFAOYSA-N	443.537	1.499	50	20	IDGD	
CCN(CCNC(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12)C1CC1	726281370	OTNITSKIEPHLEC-UHFFFAOYSA-N	448.527	1.873	50	20	IDGD	
CC(=O)NC(C)(C)C(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccc(C)cc2C)c1	726765058	BCBIMHHARVTOQX-UHFFFAOYSA-N	446.529	1.780	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)C[C@@H](C)NC(=O)C1CCCC1	727202113	XMXZWKJPBLOAAO-GFCCVEGCSA-N	439.896	1.738	50	20	IDGD	
COc1ccccc1/C(C)=C/C(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1	727364093	LULTZUCFNBPJHZ-DTQAZKPQSA-N	431.514	1.875	50	20	IDGD	
CC(C)(C)OC(=O)N(CCNC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)C1CC1	727473641	NMQOQXFIWCRXPW-UHFFFAOYSA-N	430.469	1.006	50	20	IDGD	
Cn1c(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc(Cl)c1Cl	728322536	JDMQHHIDYFWEKN-CYBMUJFWSA-N	428.228	1.476	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNS(=O)(=O)c2cc(F)ccc2Cl)ccc1Cl	728502601	NQFGRYOYRDFAJI-UHFFFAOYSA-N	442.277	1.403	50	20	IDGD	
COC(=O)c1sccc1S(=O)(=O)NNC(=O)c1cc(OC)ccc1Br	728508501	RFDIRKFRJFWTNR-UHFFFAOYSA-N	449.304	1.929	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)Cn2cnc3c(C)cccc3c2=O)c1	728529941	VFCBUWWZXFRYBK-UHFFFAOYSA-N	445.273	1.937	50	20	IDGD	
O=C(NCc1cccc(CN2CCCC2)c1)NNC(=O)C1CCN(c2ncccn2)CC1	728945056	HAACLLCGABDRRM-UHFFFAOYSA-N	437.548	1.819	50	20	IDGD	
CC(C)Oc1ccc(NC(=S)NNC(=O)Cc2ccc(S(N)(=O)=O)s2)cc1	728986133	NIEZATUCHFLBCU-UHFFFAOYSA-N	428.561	1.743	50	20	IDGD	
C[C@H](NS(=O)(=O)c1ccc(Cl)cc1)C(=O)NNC(=O)Cn1ccc2ccccc21	729448640	ZRZUDOLSYBQCKJ-ZDUSSCGKSA-N	434.905	1.809	50	20	IDGD	
COC(=O)c1c(CC(=O)OCC(=O)NNC(=O)c2ccc(C)cc2)[nH]c(C(C)=O)c1C	730035599	JWGNWIBDSIRXSG-UHFFFAOYSA-N	429.429	1.168	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)Nc2cc3c(cc2Cl)OCCO3)c2ccccc2c1=O	730707610	HQUPIWDHBNOUIU-UHFFFAOYSA-N	429.820	1.825	50	20	IDGD	
CC(C)(C(=O)NNC(=O)c1cc(S(N)(=O)=O)c(Br)s1)c1ccccc1	731231669	YIDQNMKEDMHSII-UHFFFAOYSA-N	446.348	1.897	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)NCc1cccc(CN2CCC[C@@H](C(N)=O)C2)c1	731499828	JTLDKIDKYSFMHK-GOSISDBHSA-N	439.516	1.537	50	20	IDGD	
CCNS(=O)(=O)CCNC(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccccc1	731647441	KGCZWLHQWZABOU-LGMDPLHJSA-N	426.502	1.426	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2ccc(C(=O)NNC(=O)c3c[nH]nc3C)cc2)cc1	731853298	ZWFOZBCQEJOGQP-UHFFFAOYSA-N	429.458	1.602	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)CN1C(=O)Cn2c(cc3ccccc32)C1=O	732306130	ZMFULELJDSFBHD-UHFFFAOYSA-N	426.454	1.171	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@H](C)c2cnn(C(C)C)c2)cc1	732892722	GHTNGWCMJPESKQ-OAHLLOKOSA-N	436.538	1.485	50	20	IDGD	
CN(C)Cc1c(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)oc2ccccc12	733884993	OHXVSCHXAQRQGB-UHFFFAOYSA-N	429.502	1.862	50	20	IDGD	
C[C@]1(NNC(=O)N[C@@H]2CCN(c3cccc(OC(F)(F)F)c3)C2)CCS(=O)(=O)C1	734067330	JQFGFINCZZNMQE-WBMJQRKESA-N	436.456	1.545	50	20	IDGD	
C[C@@H](CC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1cccc(F)c1	734767704	BSTCCXUNAKQYGW-HNNXBMFYSA-N	449.504	1.801	50	20	IDGD	
C[S@@](=O)CCNC(=O)/C(C#N)=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	735045867	KQTRPYZTOHRCAA-NMEOXOFNSA-N	433.921	1.481	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN2CCC(C(=O)NCC(F)(F)F)CC2)cc1C	736308058	GYAGWSUICQHHDU-UHFFFAOYSA-N	434.484	1.770	50	20	IDGD	
CC(C)n1cc(S(=O)(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)cn1	741656870	MRLPKDCLVACISC-UHFFFAOYSA-N	430.531	1.356	50	20	IDGD	
O=C(Cc1cc(O)nc(O)n1)NN=Cc1sc(N2CCOCC2)nc1-c1ccccc1	743447862	QONWVDHYXGIMAH-UHFFFAOYSA-N	440.485	1.541	50	20	IDGD	
CS(=O)(=O)N1CCC[C@H](NC(=O)NNc2c(F)cc(F)cc2Br)C1	745777929	ZBMCYCIEJZZQAK-VIFPVBQESA-N	427.271	1.777	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)N[C@@H]2[C@H]3CCCO[C@@H]3C2(C)C)nc1	745859914	HEIXCEMFKKZZHX-OIISXLGYSA-N	425.555	1.942	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)[C@H]1CN(Cc2nc(O)c3ccccc3n2)CCO1	746239778	ICYYPMCXGIXPCU-GOSISDBHSA-N	437.456	1.006	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)c1ccc(CS(N)(=O)=O)cc1	746306734	SHIKTLNMERNDDT-UHFFFAOYSA-N	430.511	1.982	50	20	IDGD	
CN1CCN([C@@H](CNC(=O)NNC(=O)Cc2cn3ccccc3n2)c2cccs2)CC1	746743443	LFJJMPDNZOEPBE-KRWDZBQOSA-N	441.561	1.257	50	20	IDGD	
COc1ccc2c(c1)OC[C@H](C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1)C2	747412247	NLZBIQKFLWEBGT-GFCCVEGCSA-N	439.877	1.008	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc2c(c(C(=O)O)c1)OCCO2)c1ccc(Cl)cc1F	747618779	VNECEQWZGIFGLJ-UHFFFAOYSA-N	430.797	1.572	50	20	IDGD	
Cc1nc(Cl)cc(NNC(=O)c2cccc(S(=O)(=O)NC[C@H]3CCCO3)c2)n1	747982952	HAYCQPPACSAXNU-CYBMUJFWSA-N	425.898	1.653	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)[C@H]1CCCN1C(=O)c1ccc2c(c1)OCO2	749715588	MWCPMBMPUKRETH-QGZVFWFLSA-N	439.468	1.809	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2c(F)cccc2Br)n1	750380107	ZXBVMBXVCSSGQG-UHFFFAOYSA-N	430.255	1.900	50	20	IDGD	
CCOc1nc(C(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)co1	753984821	IWPMYXAUDDBLDH-UHFFFAOYSA-N	433.428	1.850	50	20	IDGD	
COCCN(C)S(=O)(=O)[C@@H]1CCCN(C(=O)/C(C#N)=C/c2cc(C#N)n(C)c2C)C1	754708557	IFGBIVNNYYEUOJ-RPXHZFJKSA-N	433.534	1.011	50	20	IDGD	
COCCOc1cc(NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)ccc1OC	755697043	NJWHQTKOMLQKLD-UHFFFAOYSA-N	444.492	1.580	50	20	IDGD	
C[C@@H]1CN(c2ccc(NC(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)cc2)C[C@@H](C)O1	756273646	JZLBYFYYVIPQBD-HUUCEWRRSA-N	436.476	1.742	50	20	IDGD	
COCC(=O)NNC(=O)Nc1cc(I)ccc1Br	756335137	CLABHZWJBWGKLT-UHFFFAOYSA-N	428.024	1.853	50	20	IDGD	
COc1ccc2c(c1)C=C(C(=O)OCC(=O)NNC(=O)[C@@H]1COc3ccccc3O1)CO2	756465479	JJSFMLLZKTZGJA-IBGZPJMESA-N	440.408	1.002	50	20	IDGD	
NS(=O)(=O)c1cc(F)cc(NC(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)c1	756516815	SOQXEAOHQTZNPK-UHFFFAOYSA-N	436.400	1.469	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)Nc1ccc(OCc2noc(C3CC3)n2)cc1	756610520	PGLJNCWBRLSVCX-GFCCVEGCSA-N	435.462	1.113	50	20	IDGD	
O=C(Oc1ccc([N+](=O)[O-])c2ccccc12)C1=NN([C@@H]2CCS(=O)(=O)C2)C(=O)CC1	757421059	BHYVTGWINNQKLM-GFCCVEGCSA-N	431.426	1.819	50	20	IDGD	
Cn1cc(NC(=O)NNC(=O)c2cc(Br)c[nH]2)cc(Br)c1=O	757679769	WLSIXZVMAILESG-UHFFFAOYSA-N	433.060	1.705	50	20	IDGD	
CCS(=O)(=O)c1ccc(CCC(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)cc1	757784768	AECOKMLQZABOIL-UHFFFAOYSA-N	443.481	1.289	50	20	IDGD	
Cc1nn([C@@H]2CCS(=O)(=O)C2)c(C)c1NC(=O)NNC(=O)Cc1ccc(Cl)cc1	757871740	LPLBDHFIHZIDGT-OAHLLOKOSA-N	439.925	1.908	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1ccc(NC(=O)OC(C)(C)C)cc1Cl	758047327	LZMMEMLUBSTOOX-VIFPVBQESA-N	434.902	1.386	50	20	IDGD	
CCCc1c(C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)nnn1-c1cccc(C(C)C)c1	758049397	ZJSQKVRKSUAOMD-CYBMUJFWSA-N	436.538	1.042	50	20	IDGD	
Cn1ccc(NC(=O)/C(C#N)=C\c2ccc(OCCn3cc(C(=O)O)nn3)c(Cl)c2)n1	759088592	CCUPXTSUJDONTJ-JYRVWZFOSA-N	441.835	1.988	50	20	IDGD	
COc1cc(-n2cnnn2)c(Cl)cc1C(=O)NNC(=O)CCNC(=O)OC(C)(C)C	760432677	PVXSQPVBMQDOQA-UHFFFAOYSA-N	439.860	1.000	50	20	IDGD	
Cc1c(I)cccc1C(=O)NNC(=O)CNC(=O)c1ccco1	760493438	RBFGCGABHWLYBP-UHFFFAOYSA-N	427.198	1.384	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)NCCS(=O)(=O)Cc1ccccc1	761668535	HAEHAXRMCFTVAS-UHFFFAOYSA-N	437.543	1.733	50	20	IDGD	
O=C(CCC(=O)c1ccc2c(c1)OCCCO2)NNc1nccc(N2CCOCC2)n1	762862665	XUNZQVGKMNNBTL-UHFFFAOYSA-N	427.461	1.581	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)CN2C(=O)COc3cc(Br)ccc32)n1	762912175	AZOHBWXJGGHUCD-UHFFFAOYSA-N	449.309	1.954	50	20	IDGD	
Cc1cc(C)cc(NC(=O)C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1	763510106	YYJFBJHIGALARG-UHFFFAOYSA-N	444.513	1.488	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccnn2CCc2ccccc2)cc1OC	763550231	AYMGQKWDAOACNL-UHFFFAOYSA-N	437.456	1.543	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)[nH]n1)C(=O)Nc1ccccc1N1CCOC1=O	763601148	OXHOUKNPBVZFMY-UHFFFAOYSA-N	434.412	1.433	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2ccc(C)nc2Br)c1	763666054	VXDUFKFJWUUNAD-UHFFFAOYSA-N	435.278	1.934	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ccc(OCCC(C)C)cc2)cn1C	763769138	HETSNUAXSUTZGY-UHFFFAOYSA-N	430.461	1.636	50	20	IDGD	
O=C(NNC(=O)c1cc2c(s1)CCC2)C(=O)Nc1ccc(CN2CCCC2=O)cc1	763781209	GUXZGOXKJQQBDL-UHFFFAOYSA-N	426.498	1.759	50	20	IDGD	
CC(C)C(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)cc1	763849130	HTDHZCXEBVRBGZ-CYBMUJFWSA-N	430.436	1.974	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)Nc1cccc(C(=O)N2CCOCC2)c1	763925750	MTOPCKIYPWQHPG-UHFFFAOYSA-N	430.486	1.810	50	20	IDGD	
CCN(Cc1ccccc1NC(=O)C(=O)NNC(=O)c1ccc2c(c1)OCCO2)C(C)=O	764007039	YCMLKBSLLMSCRE-UHFFFAOYSA-N	440.456	1.226	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1cc(C(C)(C)C)nn1-c1ccccn1	764047545	HOQLBANFYRPVKO-UHFFFAOYSA-N	436.472	1.973	50	20	IDGD	
O=C1C[C@@H](Cc2ccc(NC(=O)C(=O)NNC(=O)c3ccc4ccccc4c3)cc2)C(=O)N1	764066291	FITJMKLCAXZSEC-GOSISDBHSA-N	444.447	1.445	50	20	IDGD	
CN(C)C(=O)C[C@@H]1CN(C(=O)C(=O)NNC(=O)CCc2ccco2)c2ccc(Cl)cc21	764172247	SNWSHALIGBGASA-CYBMUJFWSA-N	446.891	1.622	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)CCc2ccccc2)c(OC(F)F)c1	764191640	DESMLXNAGOEMIT-UHFFFAOYSA-N	435.383	1.793	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)c(=O)n(-c2ccccc2)n1C	764239809	VZHYGXKYQNQCGY-UHFFFAOYSA-N	446.467	1.225	50	20	IDGD	
O=C(NNC(=O)c1cccc2ncccc12)C(=O)Nc1cccc(N2CCCNC2=O)c1	764258127	VEGVXDHHRKEXJS-UHFFFAOYSA-N	432.440	1.554	50	20	IDGD	
CC(C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cccc(OC(F)F)c2)cc1	764259371	FXOBWEGHMKUQMY-UHFFFAOYSA-N	434.399	1.826	50	20	IDGD	
O=C(Cc1ccccn1)NNC(=O)C(=O)Nc1ccc(-n2nccn2)cc1C(F)(F)F	764266307	AHXGFDSYJZXXQU-UHFFFAOYSA-N	433.350	1.010	50	20	IDGD	
CCCCN1CCc2ccc(NC(=O)C(=O)NNC(=O)COc3ccccc3O)cc21	764275280	LMIMZFKULOTEOD-UHFFFAOYSA-N	426.473	1.720	50	20	IDGD	
CCCCn1ncc(NC(=O)C(=O)NNC(=O)c2cc(Br)ccc2O)c1C	764279109	YNVNMQRIWNJFAI-UHFFFAOYSA-N	438.282	1.859	50	20	IDGD	
O=C(CNC(=O)c1cccc([N+](=O)[O-])c1)NNc1c(F)cc(C(=O)NC2CC2)cc1F	764333297	GSWRRTXUJLAEHG-UHFFFAOYSA-N	433.371	1.638	50	20	IDGD	
CN(C)C(=O)C[C@H]1CN(C(=O)C(=O)NNC(=O)Cc2ccncc2)c2ccc(Cl)cc21	764353950	NPQSHCGONPEDQZ-AWEZNQCLSA-N	443.891	1.034	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)C(=O)Nc1ccc(N2C(=O)CCCC2=O)cc1	764362400	FMPHMLMDYLFJJV-UHFFFAOYSA-N	438.440	1.033	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)[C@@H]2CN(C(=O)OC(C)(C)C)CCO2)cc1	764560650	XTZCMQFSUUJFID-YOEHRIQHSA-N	437.493	1.636	50	20	IDGD	
O=C(CSc1nnc(-c2ccco2)n1-c1ccccc1)NNC(=O)C(=O)NC1CC1	764605455	BVQSSXRLIZBWOI-UHFFFAOYSA-N	426.458	1.045	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCN(c2cccc(F)c2)C(=O)C1	765058543	BHFXENAGGMZHRN-UHFFFAOYSA-N	434.855	1.598	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)NNC(=O)c2cc(-c3ccc(C)c(C)c3)[nH]n2)c(C)o1	765560151	PYAUNMXBAGGQCG-UHFFFAOYSA-N	431.474	1.578	50	20	IDGD	
COc1ccc(N2C[C@H](C(=O)NNC(=O)c3cc(-c4cccs4)[nH]n3)CC2=O)cc1	765568988	BHKZNTCBMYQZEF-GFCCVEGCSA-N	425.470	1.961	50	20	IDGD	
O=C(NCCS(=O)(=O)CC1CC1)NNC(=O)c1ccc(Br)cc1Cl	765753358	JHJRAZFLRUHCEZ-UHFFFAOYSA-N	438.731	1.871	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)N[C@H]2CN(Cc3ccccc3)C[C@H]2C)nc1	765892735	MNZXEFXJRDKJLW-APWZRJJASA-N	446.577	1.915	50	20	IDGD	
O=C(NNc1ncnc2[nH]cnc12)c1cc(I)cc([N+](=O)[O-])c1	766192538	NVMWABXLDJRCSY-UHFFFAOYSA-N	425.146	1.623	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1cccc(C(=O)Nc2ccc(Cl)cn2)c1	766272345	TYPYVSKJFODIDU-UHFFFAOYSA-N	441.835	1.868	50	20	IDGD	
CN1CCO[C@H]([C@@H](NC(=O)NN[C@@]2(C)CCS(=O)(=O)C2)c2ccc(Cl)cc2)C1	766319475	LVDVNCZDFSOVHJ-BQFCYCMXSA-N	430.958	1.093	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)Cc3ccc([N+](=O)[O-])cc3)CC2)cc1	766647275	CQYQOPSZGNLNRG-UHFFFAOYSA-N	425.489	1.411	50	20	IDGD	
Cc1noc(Cl)c1CC(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	766670740	YUBNQJZDRXEJCO-UHFFFAOYSA-N	440.331	1.798	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)c1cc(O)nc2ccc([N+](=O)[O-])cc12	767344762	HGDKFYJJXLKDDJ-UHFFFAOYSA-N	438.396	1.704	50	20	IDGD	
Cc1ccc(CN2C(=O)CC[C@H]2C(=O)OCC(=O)NNC(=O)Cc2ccccc2C)cc1	767358216	QFHHLRBHIUNQKM-FQEVSTJZSA-N	437.496	1.728	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)[C@@H](c2ccccc2)N2CCN(C)CC2)n[nH]1	768282061	VJMKYPYXLKQCDI-JOCHJYFZSA-N	448.527	1.835	50	20	IDGD	
COc1cccc(OC)c1C(=O)NNC(=O)CN1CCN(Cc2ccc(C)cc2)CC1	768290572	KLWZPFWJFFSBCJ-UHFFFAOYSA-N	426.517	1.591	50	20	IDGD	
COc1cc2c(c(OC)c1OC)CCN(CC(=O)NNC(=O)c1ccc(C)cc1)CC2	770250695	GQECAEVTSWKFOQ-UHFFFAOYSA-N	427.501	1.883	50	20	IDGD	
C[C@H]1CN(c2ccnc(C(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)c2)C[C@@H](C)O1	770813731	OYYLSTFRQKKZHO-OKILXGFUSA-N	436.472	1.017	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)c1ccc2c(c1)CCCN2S(C)(=O)=O	771952009	JSBPJTPILLTODG-ZDUSSCGKSA-N	425.507	1.138	50	20	IDGD	
CCn1c(=O)c2ccccc2n(CC(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)c1=O	772990726	PSCGWWXSHIYMAU-CYBMUJFWSA-N	444.875	1.451	50	20	IDGD	
CN1CCN(C(=O)NNC(=O)[C@H](Cc2ccccc2)NC(=O)OCc2ccccc2)CC1	773673996	RCUVIOLLZGRJSD-FQEVSTJZSA-N	439.516	1.512	50	20	IDGD	
CCCCNS(=O)(=O)c1cccc(NC(=O)C(=O)NNc2cnc3ccccc3n2)c1	773722651	JKMAFGDLGBKZCR-UHFFFAOYSA-N	442.501	1.790	50	20	IDGD	
COc1ccc(C(=O)N2CCCC2)cc1NC(=O)C(=O)NNC(=O)c1ccc(C)c(F)c1	773889221	QRERUAZYFQGXQN-UHFFFAOYSA-N	442.447	1.778	50	20	IDGD	
O=C(NNc1ccc(F)c(F)c1F)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(F)cc1	780952254	SUBIUIAOEYXOKH-YGRLFVJLSA-N	433.383	1.510	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCN(C(=O)OC(C)(C)C)[C@@H](C(C)C)C2)n1	781983834	HIOBFQFCWOHIFM-OAHLLOKOSA-N	439.582	1.719	50	20	IDGD	
COc1ccc(C(=O)NNc2ccccc2S(=O)(=O)NC(C)(C)C)cc1-n1cnnn1	782016913	KULQUVPLNQQJJX-UHFFFAOYSA-N	445.505	1.505	50	20	IDGD	
COC(=O)c1scc(C)c1NC(=O)C(=O)NNC(=O)Cc1nc2ccccc2n1C	782888090	SCGPERHFPPSGPP-UHFFFAOYSA-N	429.458	1.058	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2cncc(Cl)n2)cc1NC(=O)CN1CCCCC1	783258168	BVIQRMXHQSSUNZ-UHFFFAOYSA-N	445.911	1.945	50	20	IDGD	
CN(C)c1ccc(C(F)(F)F)cc1NC(=O)C(=O)NNc1ccc(-n2cccn2)nn1	783432620	BEBOTGWFWZXAJH-UHFFFAOYSA-N	434.382	1.829	50	20	IDGD	
CN1CCCN(S(=O)(=O)c2cccc(NC(=O)C(=O)NN(C)c3ccccc3)c2)CC1	783434333	IPUQLAAESQWBRQ-UHFFFAOYSA-N	445.545	1.119	50	20	IDGD	
COCCNC(=O)c1ccc(NC(=O)C(=O)NNc2ncccc2Cl)cc1Cl	784815473	BXJUKHXLVAMLRK-UHFFFAOYSA-N	426.260	1.846	50	20	IDGD	
NC(=O)CNC(=O)c1cccc(NC(=O)C(=O)NNc2c(Cl)cc(F)cc2Cl)c1	784877828	DRUOXRNXAZNZLI-UHFFFAOYSA-N	442.234	1.429	50	20	IDGD	
O=C(NNc1c(F)cc(F)cc1Br)C(=O)Nc1cccc(-n2cnnn2)c1	785009420	SDHUHEFSSLEPNS-UHFFFAOYSA-N	438.192	1.785	50	20	IDGD	
CNS(=O)(=O)c1cc(NC(=O)C(=O)NNc2ccc(OC)c(Cl)c2)ccc1C	785113458	DINMOQPSHHVBJN-UHFFFAOYSA-N	426.882	1.647	50	20	IDGD	
CCOC(=O)N(C)c1ccc(NC(=O)C(=O)NNc2nccc(N(CC)CC)n2)cc1	785225188	GAGHGHKXJCKWBX-UHFFFAOYSA-N	429.481	1.997	50	20	IDGD	
CS(=O)(=O)c1cc(NC(=O)C(=O)NNc2ccc(Br)cn2)ccc1Cl	788337262	KAAFXLOUXZLICJ-UHFFFAOYSA-N	447.698	1.983	50	20	IDGD	
CC(C)(C)OC(=O)N1CC2(C[C@H]2C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)C1	789907552	JVMWWQDAMBQZCV-AWEZNQCLSA-N	427.461	1.596	50	20	IDGD	
Cc1ccc(CN2CC[C@H](NC(=O)NNC(=O)c3cnn(-c4ccccc4)c3)C2=O)cc1	790700871	KFSSXVAEQZARKS-FQEVSTJZSA-N	432.484	1.926	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2cc(F)ccc2N2CCCN(C(C)=O)CC2)nc1	790960757	UNAYKGQHPFXWIG-UHFFFAOYSA-N	444.467	1.370	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNc2ccc3c(=O)[nH]ccc3c2)c(OC)c(C)c1OC	793064782	FDZVKQNALUQXKH-UHFFFAOYSA-N	426.429	1.944	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)c2c(C)nn(C)c2-n2ccnc2C)n[nH]1	793750061	PHZDIAKOTKBJBM-UHFFFAOYSA-N	434.460	1.696	50	20	IDGD	
Cc1sc2ncn(CCC(=O)NNc3ccccc3S(=O)(=O)N(C)C)c(=O)c2c1C	795168390	OTGCSASGLPQKMG-UHFFFAOYSA-N	449.558	1.859	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H]2[C@@H](C1)[C@@H]2C(=O)OCC(=O)NNC(=O)c1ccc(Cl)cc1	796082896	WZFBIBGTFABBRR-FOLVSLTJSA-N	437.880	1.757	50	20	IDGD	
COC(=O)c1c(Br)ccc(NC(=O)C(=O)NNC(=O)c2cccc(C)n2)c1C	797370017	DVBMBHLKLOMGQW-UHFFFAOYSA-N	449.261	1.647	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2cc(Cl)ccc2C(=O)N2CCCC2)n1	797370494	DYGQYOWTDXVHFE-UHFFFAOYSA-N	429.864	1.679	50	20	IDGD	
O=C(NNc1cnc2ccccc2n1)c1ccc(F)c(S(=O)(=O)N2CCOCC2)c1	801196039	VDKZDMSSCHVNII-UHFFFAOYSA-N	431.449	1.547	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)Cc2ccc(S(N)(=O)=O)cc2)c(OC)cc1Cl	802084920	PDPFZGRFUJSYIV-UHFFFAOYSA-N	442.881	1.400	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)CCN2CCN(C(=O)OC(C)(C)C)CC2)cc1	802123689	RIIWOHSILZMJMZ-UHFFFAOYSA-N	434.541	1.848	50	20	IDGD	
COC(=O)c1c(F)cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)cc1F	802566334	JZEUPWNPOMBQDI-VIFPVBQESA-N	439.346	1.444	50	20	IDGD	
O=C(CCS(=O)(=O)c1ccc2c(c1)OCCCO2)NNc1ccc2c(=O)[nH]ccc2c1	803427818	FTACCAOTZSGXAX-UHFFFAOYSA-N	443.481	1.997	50	20	IDGD	
CN1CCC/C1=N\S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ncccc2F)cc1	807302905	SWTKZXDUKLSOGA-BUVRLJJBSA-N	434.453	1.115	50	20	IDGD	
COC[C@]1(C(=O)NNC(=O)c2ccc3c(c2)OCCO3)CCN(C(=O)OC(C)(C)C)C1	809986501	HBLDKUOENVOLOR-NRFANRHFSA-N	435.477	1.492	50	20	IDGD	
Cc1cccc(C(C)C)c1NNC(=O)c1cccc(S(=O)(=O)N2CCNC(=O)C2)c1	812764910	MRIDLOJYVZBCMQ-UHFFFAOYSA-N	430.530	1.996	50	20	IDGD	
CC(=NNC(=O)Nc1ccc(S(N)(=O)=O)cc1)[C@H]1CN(Cc2ccccc2)CCO1	814968290	XIHVQLJUUGAONC-LJQANCHMSA-N	431.518	1.732	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)C(=O)Nc1ccn(-c2ccc(Br)cc2)n1	815570468	CTOMBYRCJFYUSF-UHFFFAOYSA-N	443.261	1.738	50	20	IDGD	
CS(=O)(=O)c1ccc(Oc2ccc(NC(=O)C(=O)NNC(=O)[C@H]3CCCO3)cc2)cc1	815779712	RXIMMCMNYXIXTI-QGZVFWFLSA-N	447.469	1.147	50	20	IDGD	
CCOc1ccc(NNC(=O)CS(=O)(=O)N2CCN(c3cccc(C)c3)CC2)cc1	817896085	OWLFCLSZYUQQQD-UHFFFAOYSA-N	432.546	1.989	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)CNc3ccccc3)CC2)cc1	823327524	PODNDBJPZJETRC-UHFFFAOYSA-N	430.530	1.655	50	20	IDGD	
CC(C)CSc1ccc(S(=O)(=O)NCC(=O)NNC(=O)C2CC2)cc1[N+](=O)[O-]	913415763	DYZSLZCLXVXSAQ-UHFFFAOYSA-N	430.508	1.179	50	20	IDGD	
CN1C(=C(C#N)C(=O)COC(=O)c2ccc(S(=O)(=O)N(C)C)o2)N(C)c2ccccc21	915030919	YGUVCPMQADMQQB-UHFFFAOYSA-N	444.469	1.577	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(-c3cccc(F)c3)no2)c1	915635517	IUGDJZFWMOIFHP-UHFFFAOYSA-N	432.433	1.806	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2sccc2Br)cc1	915686266	RPIGOENFYLHVFB-UHFFFAOYSA-N	446.348	1.901	50	20	IDGD	
COc1cccc(C[C@@H](C(=O)NNC(=O)Cc2c[nH]c3ccccc23)n2nnnc2C)c1	915697463	QRPUENKQZMSDIE-FQEVSTJZSA-N	433.472	1.645	50	20	IDGD	
O=C(NC[C@@H]1CN(Cc2ccccc2)CCO1)NNC(=O)c1nnc(O)c2ccccc12	915895024	UFNHPGGNMKITBG-MRXNPFEDSA-N	436.472	1.180	50	20	IDGD	
CNS(=O)(=O)Cc1ccc(CNC(=O)NNC(=O)Cc2c[nH]c3ccccc23)cc1	916229166	SRHCVZHYVQWJHN-UHFFFAOYSA-N	429.502	1.290	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NC[C@H](c2ccsc2)N(C)C)nc1	916449959	UTLXPHBNDBKBMN-OAHLLOKOSA-N	426.568	1.759	50	20	IDGD	
C[C@@H](CN1CCOCC1)NC(=O)NNC(=O)COc1ccccc1Cc1ccccc1	916470061	IDUPTVFWWSRMPK-SFHVURJKSA-N	426.517	1.707	50	20	IDGD	
C[C@H](NC(=O)c1ccc(Br)s1)C(=O)NNC(=O)COc1ccccc1F	916720204	NYABXYSYSJBYNW-VIFPVBQESA-N	444.282	1.994	50	20	IDGD	
Cc1c(CC(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)nnn1-c1ccccc1	919609302	KXFFGNYVMAOQRE-UHFFFAOYSA-N	427.848	1.776	50	20	IDGD	
CCNS(=O)(=O)c1ccc(C)c(C(=O)NNC(=O)c2ccc(CN(CC)CC)o2)c1	920248358	CAMOFWSPZXSTJJ-UHFFFAOYSA-N	436.534	1.803	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)c2nc(S(C)(=O)=O)n3ccccc23)cc1OC	920275560	ZPXMXGZXJBIPKB-UHFFFAOYSA-N	432.458	1.220	50	20	IDGD	
O=C(NNC(=O)c1cncn1-c1ccccc1)N[C@@H]1CC(=O)N([C@@H]2C[C@@H]2c2ccccc2)C1	1116176453	YUCFZDHFZXVIKF-MISYRCLQSA-N	444.495	1.973	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCc2cccc(OCC#N)c2)nc1	1318526587	VBJSYDJQPMVDLV-UHFFFAOYSA-N	432.506	1.841	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)[C@H]2CC23CCS(=O)(=O)CC3)cc1Cl	1325261871	IOYXHKPSJSCQQN-SNVBAGLBSA-N	431.898	1.725	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(CCN(C(=O)c3cnnc4ccccc34)C2)C1	1777724641	YXLYUWDQZKYMBF-LJQANCHMSA-N	433.306	1.858	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cn4ncccc4n3)C2)C1	1777954569	DLYHLPCQZYBHDW-UGSOOPFHSA-N	436.310	1.346	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(-c4cccnc4)[nH]n3)C2)C1	1779611856	WCPXRZRBXRVVLV-FOIQADDNSA-N	433.896	1.169	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccnc4c3OCO4)C2)C1	1780030789	ZWKWIZBRVKJYKW-FZKQIMNGSA-N	440.294	1.427	50	20	IDGD	
C[C@@H](Cn1ccnc1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Br)C1	1780776643	CATWPYVXCAJTEC-JTOWHCCKSA-N	445.333	1.724	50	20	IDGD	
O=C([C@@H](F)Br)N1CC[C@]2(C1)CN(C(=O)C(F)(F)c1ccco1)CCO2	1781334663	QIXXSSRTQZCARP-RISCZKNCSA-N	425.201	1.892	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(-n4cccn4)cc3)C2)C1	1781719926	WXDKHIXKQJZBIN-NQIIRXRSSA-N	432.908	1.570	50	20	IDGD	
O=C([C@H](F)Cl)N1CCO[C@]2(CCN(C(=O)[C@H]3Cc4[nH]nc(C(F)(F)F)c4C3)C2)C1	1782847017	KJPPSPUAJOOUTF-YYFNMXAFSA-N	438.809	1.508	50	20	IDGD	
C[C@H](NC(=O)c1ccccc1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Cl)C2	1783257841	YBNLOYXRVSWRKH-YHXHNGJMSA-N	439.915	1.853	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3[nH]nc4ncccc34)CCO2)C1	1783347249	CWPYPTSUEJLYHV-FZKQIMNGSA-N	436.310	1.575	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](Br)CC)C2)C1	1783354637	DHJQLDVIFBEKTI-XNJGSVPQSA-N	435.315	1.551	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cnn(C(C)(C)C)c3)CCO2)C1	1783532085	ITYFMLPDAPAWKG-FZKQIMNGSA-N	427.343	1.865	50	20	IDGD	
Cc1cccc2[nH]c(C(=O)N3CCO[C@]4(CCN(C(=O)CCC(=O)NN(C)C)C4)C3)cc12	1783934469	GWVNLTJZVUQCLF-QHCPKHFHSA-N	441.532	1.293	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H]3CCOC3)C2)C1	1784721445	TWHDXACTSPJVES-BVFXMFMDSA-N	431.439	1.738	50	20	IDGD	
O=C(c1ccc(OCC2CC2)c(F)c1)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1785254072	SAKGEBSNJAPJRS-UWJYYQICSA-N	440.899	1.658	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cn3ccc(C)n3)[C@H]2C1	1785373900	HLIKWGNVUFVVMN-VGWMRTNUSA-N	427.343	1.345	50	20	IDGD	
CCn1nc(C)cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCBr)[C@H]2C1	1786406048	NUEJVNGTSOTOAS-DZKIICNBSA-N	427.343	1.590	50	20	IDGD	
C#CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]2C1	1787451276	FLQDALDSHWPUEE-QMHWVQJVSA-N	445.919	1.417	50	20	IDGD	
COc1ncccc1C(=O)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1	1788145973	MRVQSNPIGXAIOI-UHFFFAOYSA-N	445.284	1.832	50	20	IDGD	
Cc1nccn1[C@@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21	1791701638	BHRYHSLNPYULGI-TUUVXOQKSA-N	427.343	1.517	50	20	IDGD	
C[C@@H](NNc1ccccc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2	1792508408	NAHUKGPTYIYMSD-CNRIWFPOSA-N	443.317	1.272	50	20	IDGD	
CN(CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc[nH]n1)NC(=O)NCc1ccccc1	1793740558	CGJBMZUNSCRHAE-BCDXTJNWSA-N	439.520	1.008	50	20	IDGD	
CC(=O)Nc1ccccc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCBr	1795117095	MMFBENYJZVDGSR-ZSBFGKGUSA-N	438.322	1.633	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)c1ccc2cnccc2c1	1796189099	WBUFSJQNAFUIFT-KOUNCHBCSA-N	429.285	1.480	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2)[C@@H]1Cc2ccccc2CN1	1796325014	ABVIXQDENZMFFQ-ZMMAXQRCSA-N	436.350	1.076	50	20	IDGD	
C[C@H](NC(=O)c1ccc(F)cc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Cl	1796367693	PKBFAFAWWXJCPH-APDPGRRMSA-N	429.851	1.068	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1snnc1C1CC1	1796704451	CMVLOUSNWSAIGR-FOUMNBMASA-N	443.367	1.650	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1nc(OC)ccc1[N+](=O)[O-]	1796720263	BXZWXSPBLRFWKI-OXIQGZBJSA-N	426.857	1.219	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1C[C@@H](O)C1	1797717242	PZYPFZXNMGASRC-KLOLGFOXSA-N	429.945	1.528	50	20	IDGD	
C[C@H](Sc1cccs1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(B(O)O)cc1)C2	1798280114	LLBMFRBEWORDDO-RUGDWHBFSA-N	444.387	1.861	50	20	IDGD	
CO[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Br)c1ccccc1	1799346107	CEILKHPMWGLFQQ-QRJUGERDSA-N	429.286	1.654	50	20	IDGD	
O=C1CCc2ccc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@H](F)Br)cc21	1799347201	MUMWFDKWBSPKHG-RMHZUWNSSA-N	439.281	1.709	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(Cl)cnc1O)C2	1800638317	YJCMHIWDNKOLAU-DJBIQUGXSA-N	446.729	1.817	50	20	IDGD	
CC(=O)Nc1ccccc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Br)C2	1801780497	LUFZSXKXHNKYFY-MBMVNNNZSA-N	438.322	1.632	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)C[C@@H]2NC(=O)NC2=O)[C@@H]1c1cccnc1	1804341643	LBDSDXCYOPJJPT-AESZEHBQSA-N	435.912	1.093	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@H](CNC(=O)c2ccc[n+]([O-])c2)[C@H]1c1cccnc1	1804783546	STIKLFVUIHUAOE-FXAWDEMLSA-N	428.565	1.886	50	20	IDGD	
CCOC(=O)c1cc(C(=O)N2CCC3(CCCN(C(=O)[C@@H](O)CCl)C3)CC2)ccn1	1805525165	GDMPRMGSGRUZIX-KRWDZBQOSA-N	437.924	1.703	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)c2ccno2)[C@@H]1c1cccnc1	1805626488	YSSVZBBPWPGHJI-YRJCQSRDSA-N	449.471	1.523	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)NS(=O)(=O)CC)[C@@H]1c1cccnc1	1808244755	OJFITGRTCVSLST-BSWAZPDLSA-N	444.985	1.433	50	20	IDGD	
O=C(c1ccc(F)nc1)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1	1809978431	CAQIGYRIKKQFRK-UHFFFAOYSA-N	425.269	1.059	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)c1ccn2nccc2c1	1810045608	TZJYZBCFGYDZNQ-YTQUADARSA-N	427.892	1.649	50	20	IDGD	
CC/C=C(\C)C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1	1810307044	CMUKITZURNTKMT-ARKAMOEASA-N	436.516	1.756	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@H]1CCN(C(=O)CN2CCCCC2=O)[C@H]1c1cccnc1	1810547318	DSJRSLCHJBWCPL-GCJKJVERSA-N	446.624	1.951	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2cc(C(C)=O)[nH]n2)[C@@H]1c1cccnc1	1813029272	HDMJCZWOUXZPFB-RLFYNMQTSA-N	433.896	1.581	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)C2=CCCS2)[C@H]1c1cccnc1	1813067925	HJXVYMUCXWNXPW-UZLBHIALSA-N	431.562	1.481	50	20	IDGD	
Cc1[nH]ccc1C(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1813071643	VIWGEHXNZUYYPW-UWJYYQICSA-N	426.521	1.411	50	20	IDGD	
Cc1cc(NC(=O)CC(=O)N2CCCC[C@@H]2c2cc(NC(=O)[C@H](O)CCl)n[nH]2)no1	1814871400	OKEANOIXAISLAN-CHWSQXEVSA-N	438.872	1.327	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2nc3ccc(F)cn3n2)[nH]n1)[C@@H](O)CCl	1814875046	MSNSECWPSZSMBJ-STQMWFEESA-N	435.847	1.497	50	20	IDGD	
O=C(/C=C/c1ccccc1)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1	1815355147	PHFHHPZSZJPSTA-ZPHJMFTNSA-N	447.325	1.762	50	20	IDGD	
CC1(C)CC(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)C1	1815361513	ICVRYSHRBILDQA-OAHLLOKOSA-N	427.335	1.485	50	20	IDGD	
O=C(CCBr)N[C@@H]1CCc2nc(NC(=O)c3nc[nH]c3[N+](=O)[O-])sc2C1	1817196350	RNOKHNOIZCZVER-SSDOTTSWSA-N	443.283	1.785	50	20	IDGD	
Cc1ccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)nc1C	1817470887	KXFFSNBIHYDJIK-HXUWFJFHSA-N	447.304	1.721	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1ccoc1Cl	1820390682	KAWAKQASMQDXJQ-INIZCTEOSA-N	442.668	1.956	50	20	IDGD	
CN1N=C(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)[C@@H](F)Br)n[nH]2)CCC1=O	1820932206	ZIFCNSKDNIVGAO-BXUZGUMPSA-N	443.277	1.701	50	20	IDGD	
C[C@H](C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1)n1cccn1	1822416737	MMVGLVJZLDBCPU-ZBFHGGJFSA-N	430.513	1.233	50	20	IDGD	
CC(=O)N[C@H](C)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](C)CBr)CC2	1825210941	DQVJSVPZKBKLLS-FXPVBKGRSA-N	431.356	1.611	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCC(=O)NN(C)C)CC2	1825647875	VYCYABDHFFYSDD-UWVGGRQHSA-N	446.371	1.212	50	20	IDGD	
CN1CCC[C@H]1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1	1828923361	GGZHKBSCAADZRU-PMACEKPBSA-N	442.564	1.013	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H]2CCC=CO2)CC1	1828924017	GOKAZGGSHFKZGM-UXHICEINSA-N	441.532	1.611	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCC(=O)N3CCCC3)C2)C1	1830357928	HYVGZDAFZBKHMG-OAQYLSRUSA-N	443.972	1.110	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)C[C@H](N)c3cccnc3)C2)C1	1830358901	GIIILZIOJFGKRL-UWJYYQICSA-N	438.956	1.193	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)cc1Cl	1830720362	YIYUFJXFPLJMDC-APWZRJJASA-N	431.316	1.318	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccnc3OC)C2)C1	1831643800	HAKLBSFKPIJXFL-OXQOHEQNSA-N	425.913	1.568	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccnc(OC)c3)C2)C1	1831652068	WAEJAFAIHLZFSV-JXFKEZNVSA-N	425.913	1.568	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3c(C)n[nH]c3C)C2)C1	1831654490	UCOGSDRDQFTJGM-YLJYHZDGSA-N	426.945	1.433	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)[C@@H]2CCCOC2)CC1	1832868694	VJWTWMGMVIWSOE-TZIWHRDSSA-N	428.338	1.026	50	20	IDGD	
O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)CCc1cccnc1)CCO2	1836177270	JCGAKWQIXDWELD-IBGZPJMESA-N	440.338	1.256	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CC[C@@H](C)O1)CCO2	1836601895	UBLBISDUZKYHKG-ADAWSYLGSA-N	433.343	1.041	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC(OC2CCN(C(=O)Cn3cccn3)CC2)CC1	1836670170	BHTNATIQOUDOOD-HNNXBMFYSA-N	441.370	1.913	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(CC#N)cc3)C2)C1	1837715078	UMIYQUHPGXZIFJ-QFIPXVFZSA-N	445.592	1.674	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(Cl)cn3)CCO2)C1	1837899853	XNXZJRCAAIVECW-RDTXWAMCSA-N	432.304	1.059	50	20	IDGD	
O=C(c1ccnnc1O)N1CCC(OC2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1838514128	FBUBLQMVZUOXJL-CQSZACIVSA-N	445.289	1.485	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(OC)cc3)CCO2)C1	1838967409	BTICLBJORAWTHE-PXNSSMCTSA-N	426.897	1.019	50	20	IDGD	
Cc1cc(C)n(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)n1	1839150412	LVYOUJGOFCNOMK-MOPGFXCFSA-N	447.363	1.193	50	20	IDGD	
CN1CCCC[C@H]1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2	1839150659	SWRXSEKCDBLYTM-KFKAGJAMSA-N	436.380	1.163	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)/C=C/c3cccc(O)c3)CCO2)C1	1839926509	XFCYBFWBZLDYPC-DPTMFGANSA-N	438.908	1.116	50	20	IDGD	
Cc1ccc(C(=O)C(=O)N2CCO[C@@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)cc1	1840099196	VCPDUQBIOZTPIN-JOCHJYFZSA-N	448.592	1.486	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccnc(C(F)F)c3)C2)C1	1840150820	QXWVHZWCOMFUDM-IFXJQAMLSA-N	447.866	1.343	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4sccc4[nH]3)C2)C1	1840153195	HCBOIOVLASRWLM-ORAYPTAESA-N	441.937	1.553	50	20	IDGD	
O=C(c1cn2ccccc2n1)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840187647	OZFIDNPMYAJENM-GOSISDBHSA-N	427.288	1.208	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(F)cc(Cl)c3)CCO2)C1	1840711002	BYLFLKBLRZJQHW-LPHOPBHVSA-N	449.306	1.803	50	20	IDGD	
CC(=O)Nc1ccccc1C(=O)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1840725969	QATBJXUNMGDMTC-LJQANCHMSA-N	444.315	1.519	50	20	IDGD	
C[C@@H](O)[C@H](NC(=O)c1ccccc1)C(=O)N1CCCC12CN(C(=O)CO[Si](C)(C)C)C2	1841224180	RQKUOGINAJZLMZ-APWZRJJASA-N	447.608	1.221	50	20	IDGD	
CC(C)[C@@H](C(=O)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1)N1Cc2ccccc2C1=O	1841348134	LTLPDBLBTJHOIM-MSOLQXFVSA-N	433.936	1.470	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)c2nc(-c3ccccc3)ns2)C1	1843120443	FFOAOHUVPNYGTI-UHFFFAOYSA-N	442.545	1.395	50	20	IDGD	
C[C@H](Br)C(=O)N1CC2(CCCN2C(=O)c2nc3ccccc3n(C)c2=O)C1	1843744590	AYRRWCGGPFMWMG-LBPRGKRZSA-N	433.306	1.534	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)c2cnc(-c3ccccc3)s2)C1	1844547147	HMUONLXWDHJOFB-UHFFFAOYSA-N	447.325	1.621	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC12CN(C(=O)[C@H](CCO)NC(=O)OC(C)(C)C)C2	1846175158	IGKAERXDPRUUHY-OLZOCXBDSA-N	448.358	1.249	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)c1ccc(N3CCCC3)c(F)c1)C2	1846385260	JOBKAAMODGWPKZ-UHFFFAOYSA-N	445.539	1.616	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)[C@H](C)Cc2ccccn2)C1	1846522238	ASXXHMIXIWFXOS-MSZQUAHTSA-N	436.516	1.598	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)c1c[nH]nc1-c1ccc2c(c1)OCCO2	10126543	VARPGOZUPBWOSI-UHFFFAOYSA-N	446.423	1.814	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)CCc2nc(-c3ccsc3)no2)c1	15429609	RSUDORZMDPXDNX-UHFFFAOYSA-N	449.514	1.442	50	20	IDGD	
CCCn1nc(C(=O)NNS(=O)(=O)c2ccc3c(c2)CCC3)c2ccccc2c1=O	16095584	ICVJLOXHMINQGH-UHFFFAOYSA-N	426.498	1.919	50	20	IDGD	
Cc1cccc(-c2n[nH]c(=S)n2CC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c1	17193278	AFWPUPHZMNWNKC-UHFFFAOYSA-N	449.496	1.624	50	20	IDGD	
COC(=O)/C=C\c1cc(OC)c(OC)c(S(=O)(=O)NNC(=O)c2ccccc2F)c1	96311184	QZQGRLSHEWWSQQ-HJWRWDBZSA-N	438.433	1.652	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCN(C(=O)c3cc(C)oc3C)CC2)cc1OC	108165517	CUEXPBYBSVBNMS-UHFFFAOYSA-N	444.488	1.133	50	20	IDGD	
COc1ccc(CN2CCN(C(=O)NNC(=O)CNC(=O)c3cccs3)CC2)cc1F	725872979	UJBVOPSSLOEQPV-UHFFFAOYSA-N	449.508	1.184	50	20	IDGD	
O=C(NNC(=S)NCCc1ccccn1)c1cccc(S(=O)(=O)N2CCCC2)c1	726120814	WHTSEZRIBORXTN-UHFFFAOYSA-N	433.559	1.218	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)NC2CCN(c3ccc(C#N)cn3)CC2)cc1C	727605234	FKGFWJFRPFKDRP-UHFFFAOYSA-N	435.488	1.508	50	20	IDGD	
CSC[C@H](C(=O)NNc1nc(-c2cccnc2)no1)N1C(=O)[C@@H]2CCCC[C@H]2C1=O	728079579	YHRWNTLJWXRJEO-MGPQQGTHSA-N	430.490	1.482	50	20	IDGD	
CCCc1nc(C(=O)N([C@@H]2CCS(=O)(=O)C2)N(C)C)nn1-c1ccccc1Cl	728161330	GRQQBKUYHZBSKA-CYBMUJFWSA-N	425.942	1.979	50	20	IDGD	
C[C@H]1CCCCN1S(=O)(=O)c1cccc(C(=O)N([C@H]2CCS(=O)(=O)C2)N(C)C)c1	728180720	WVDVSNFQJNZAJQ-RDJZCZTQSA-N	443.591	1.356	50	20	IDGD	
CCNC(=O)COc1ccc(C=NNC(=O)C2CCN(c3ncccn3)CC2)cc1OC	728783347	LLMWWMYPVMUXPE-UHFFFAOYSA-N	440.504	1.367	50	20	IDGD	
CC(=O)Nc1ccc(CCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1	729059087	RUMCBTFTMAZSHW-UHFFFAOYSA-N	447.517	1.082	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCCN(C)C(=O)OC(C)(C)C)nc1	729611173	JEMKQDGKOKSTAP-UHFFFAOYSA-N	430.531	1.261	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12)N(C)C1CC1	729617418	NZLFJTLUGISHHZ-INIZCTEOSA-N	448.527	1.872	50	20	IDGD	
Cn1nc(SCC(=O)NN=Cc2cccc(Oc3ccccc3)c2)c(=O)n(C)c1=O	730568952	HRGFBTATGAFWME-UHFFFAOYSA-N	425.470	1.514	50	20	IDGD	
CCOC(=O)[C@H]1CCCN(C(=O)CN(C)C(=O)NNC(=O)C(C)(C)c2ccccc2)C1	731222942	ZODSHROCBDVBMD-INIZCTEOSA-N	432.521	1.439	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)c1cccc(S(=O)(=O)NC[C@@H]2CCCO2)c1	731366509	WHSIIUANBXNFCD-INIZCTEOSA-N	435.477	1.287	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NCCCC(=O)N2CCc3ccccc32)c2ccccc2c1=O	732475390	DLVMOWSBSFENTO-UHFFFAOYSA-N	448.483	1.247	50	20	IDGD	
CS(=O)(=O)Nc1cccc(CNC(=O)NNC(=O)NCc2ccc(Cl)cc2)c1	732990595	PLOUOIGMDCRVRV-UHFFFAOYSA-N	425.898	1.925	50	20	IDGD	
O=C(CCc1ccccc1)NNC(=O)NCCN1CCN(C(=O)C2CCCCC2)CC1	733351001	JXFIBOQWJSJIOC-UHFFFAOYSA-N	429.565	1.674	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)[C@H]1CC(=O)N(c2ccc3c(c2)CCC3)C1	734240806	ZPJJBNFABWZILN-INIZCTEOSA-N	445.520	1.383	50	20	IDGD	
CN1C(=O)C[C@@H](C(=O)NNC(=O)CNC(=O)c2cccs2)[C@@H]1c1cccc(Cl)c1	734391886	NRWDYSDHQVJDJN-DYVFJYSZSA-N	434.905	1.498	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)N[C@@H]2CCN(CCN3CCOCC3)C2)c1	734686777	UUEYDCKYVLOLPY-LJQANCHMSA-N	447.580	1.234	50	20	IDGD	
C[C@H](NC(=O)C1CCCC1)C(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	734826006	SQKXCTOHVACVOW-ZDUSSCGKSA-N	425.530	1.411	50	20	IDGD	
COc1ccc(S(=O)(=O)C[C@@H](C)C(=O)NNC(=O)NCCc2cccs2)cc1	735038095	FJPPSXBDVGVAGM-CYBMUJFWSA-N	425.532	1.740	50	20	IDGD	
C[C@@H]1CCCN(S(=O)(=O)c2cc(C(=O)NNC(=O)c3cnn(C)c3)ccc2Cl)C1	735446349	QYFJZIYNCLWERL-GFCCVEGCSA-N	439.925	1.569	50	20	IDGD	
O=C(CCNS(=O)(=O)c1cccc([N+](=O)[O-])c1)NNc1cccc(C(F)(F)F)n1	740136230	IMJUAMVSORZERE-UHFFFAOYSA-N	433.368	1.820	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)[C@H]1CC12CCN(C(=O)OC(C)(C)C)CC2	740843393	SIQKAXQHTHFNLP-CYBMUJFWSA-N	426.514	1.696	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)CSc2nnc(-c3ccccc3Cl)n2N)cc1	742445343	RGFCZUQDCPQYKC-UHFFFAOYSA-N	427.877	1.737	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)[C@H](C)n2nnc(-c3ccccc3)n2)c2ccccc2c1=O	742475013	SCCKYCPHRKHQGV-AWEZNQCLSA-N	446.471	1.653	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc2c(cc1Cl)OCCO2)c1cc([N+](=O)[O-])ccc1O	743268834	MWJBAOYPKBLYKK-UHFFFAOYSA-N	429.794	1.348	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)[C@@H]2C[C@@]23CCc2ccccc23)CC1	743420070	UNRQPGWYTFTCDK-PGRDOPGGSA-N	441.557	1.365	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)c2ccccc2S(=O)(=O)C(F)(F)F)c1	744725808	UYEQCWGISBVDHM-UHFFFAOYSA-N	444.387	1.907	50	20	IDGD	
C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)OCC(=O)NNC(=O)c1cccc(C#N)c1	744870701	ZCSPWXJEUJKUCG-LLVKDONJSA-N	446.803	1.892	50	20	IDGD	
Cc1cccc([C@H](CNC(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)N2CCOCC2)c1	745489638	RTYNDVHZEMEQLI-SFHVURJKSA-N	443.460	1.626	50	20	IDGD	
CCN1CCN(C[C@@H](C)CNC(=O)NNC(=O)c2ccc(OC(C)C)c(OC)c2)CC1	745862730	NOTHZCJOBGCGFJ-KRWDZBQOSA-N	435.569	1.700	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)C1CCN(C(=O)CCOc2ccccc2)CC1	746550868	WZVMZBRHKLTQHK-UHFFFAOYSA-N	449.511	1.732	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(OCC(F)(F)F)cc1)c1ccc(-n2cnnn2)cc1	747406600	DQENZEOUOIEHMB-UHFFFAOYSA-N	442.379	1.227	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)c2cnc3c(c2C)c(=O)n(C)c(=O)n3C)c(Cl)c1	748085120	NKQYCKHRVMUYLT-UHFFFAOYSA-N	430.852	1.369	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@](F)(C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)C1	748301587	GAQQRLOIQAANJD-IBGZPJMESA-N	442.513	1.920	50	20	IDGD	
Cc1cc(Br)ccc1NNC(=O)[C@H]1CC(=O)N(CCN2CCOCC2)C1	748737446	VVFMRPHLDPTMRL-AWEZNQCLSA-N	425.327	1.381	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)NCC(=O)NNc2cccc3cnccc23)cc1	748762975	LVYYKLDDWPYAEX-UHFFFAOYSA-N	428.470	1.833	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)NCC(=O)NNc2cc(F)c(F)c(F)c2)cc1	748810836	KXTAAMCKHPBASE-UHFFFAOYSA-N	431.392	1.702	50	20	IDGD	
COC[C@@](C)(CC(=O)OC)NC(=O)CCC(=O)C(C#N)=C1N(C)c2ccccc2N1C	749429487	TXFWHGJVILQVTB-JOCHJYFZSA-N	428.489	1.741	50	20	IDGD	
O=C(NCc1ccccc1CN1CCC(O)CC1)NNC(=O)c1cnn(-c2ccccc2)c1	749590750	NTLFWWLXZFEBGL-UHFFFAOYSA-N	448.527	1.973	50	20	IDGD	
CCO[C@@H]1C[C@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)C1(CC)CC	749617587	QBTQOXBXNMEWDD-DLBZAZTESA-N	440.566	1.865	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN[C@](C)(C(N)=O)c2cccc(C(F)(F)F)c2)n1	750056316	JBOGKQIECQSCHQ-KRWDZBQOSA-N	443.451	1.151	50	20	IDGD	
O=C(NNc1nc(Br)cn2ccnc12)[C@@H]1CN(Cc2ccccc2)CCO1	750248782	VLIYDIRUWPTCCL-AWEZNQCLSA-N	431.294	1.836	50	20	IDGD	
CCOC(=O)C1(C(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)CCC1	751549071	RLHNPMKDWACVPJ-UHFFFAOYSA-N	448.479	1.939	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)c2cc(S(=O)(=O)NC)oc2C)cc1C	751746530	RHCNWBQANPACJP-UHFFFAOYSA-N	443.503	1.046	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)NC[C@@H]2CCC[C@@]23NC(=O)N(C)C3=O)cc1OC	752025512	YHMWWQFCLQCTSJ-LHSJRXKWSA-N	447.492	1.149	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)NNC(=O)[C@@H](C)Oc2cccc(Br)c2)o1	752357523	SZWMBGBMTGJJDS-SNVBAGLBSA-N	425.239	1.793	50	20	IDGD	
Cn1c(=O)n(C)c2nc(NC(=O)CCC(=O)NNc3ccc(C#N)c(Cl)c3)ccc21	753312607	FLHMIHIEHODTBG-UHFFFAOYSA-N	427.852	1.659	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN(C)[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1OC	756543731	MIWWURPHYKFFGQ-HNNXBMFYSA-N	436.509	1.406	50	20	IDGD	
CC(C)S(=O)(=O)Cc1cccc(NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c1	756557866	XELSVSHNVVTMRD-UHFFFAOYSA-N	443.489	1.452	50	20	IDGD	
CS(=O)(=O)c1ccccc1-n1cc(NC(=O)NNC(=O)COCc2ccccc2)cn1	756704496	FYMALZGYZRFJNJ-UHFFFAOYSA-N	443.485	1.645	50	20	IDGD	
CCCNS(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1	756774978	FPNHLFZHNDLFCD-KRWDZBQOSA-N	434.474	1.368	50	20	IDGD	
CCc1cnc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)s1	756793174	TUJRCUDAOKAZGJ-UHFFFAOYSA-N	439.519	1.193	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)Nc1cc(C2CC2)nn1[C@H]1CCS(=O)(=O)C1	756854165	CKGVBAQBGMWUHQ-AWEZNQCLSA-N	448.461	1.495	50	20	IDGD	
NC(=O)c1ccc(NNC(=O)[C@H]2CCCN(C(=O)c3ccc(Cl)c(Cl)c3)C2)nn1	757403213	XGDMAXPFTYSSBJ-NSHDSACASA-N	437.287	1.878	50	20	IDGD	
C[C@@H](NC(=O)OC(C)(C)C)[C@H]1CCCN(CC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)C1	758786180	YVMXKKUHOSDNGV-ZBFHGGJFSA-N	449.508	1.981	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)N=c2cc[nH]cc2I)cc1	760029972	QGWOPUCKZSQMJA-UHFFFAOYSA-N	440.241	1.902	50	20	IDGD	
NC(=O)[C@@H]1CC[C@H](CNC(=O)NNC(=O)c2cc(-c3ccccc3)nc3ccccc23)O1	760204303	QGKFQZRXJCGQLY-QRWLVFNGSA-N	433.468	1.879	50	20	IDGD	
CCCS(=O)(=O)Nc1cccc(C(=O)NNC(=O)CCNC(=O)OC(C)(C)C)c1	760440090	QWZQYZWXIKVREZ-UHFFFAOYSA-N	428.511	1.514	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)N1CCO[C@H]([C@H](C)NC(=O)OC(C)(C)C)C1	760713890	DZAWOZJJRPPHJN-ZFWWWQNUSA-N	446.508	1.611	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)NNC(=O)CSc2ccccc2OC)ccc1OC	761622870	ZKEYSYVXSGRRFN-UHFFFAOYSA-N	439.515	1.165	50	20	IDGD	
C[C@H]1Sc2ccc(C(=O)OCC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)cc2NC1=O	761623285	YCCONCGETWZUCQ-SNVBAGLBSA-N	444.425	1.646	50	20	IDGD	
O=C(CCc1nc(C2CCCC2)no1)NNc1ccccc1S(=O)(=O)N1CCOCC1	762233872	JOQSLPJYEPBCOU-UHFFFAOYSA-N	449.533	1.824	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(C(=O)NNc2nccc(N3CCOCC3)n2)cc1	762852474	LWFUTBFKNREBJW-UHFFFAOYSA-N	434.522	1.101	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NN/C=C1/C(=O)N(c2ccccn2)C(=O)c2ccccc21	763107665	LEPAKIHGDBYLNC-QGOAFFKASA-N	442.435	1.055	50	20	IDGD	
CN(C)CCOc1ccc(NC(=O)C(=O)NNC(=O)c2cc3ccccc3cc2O)cc1	763528087	SBJMXHCHDWISMC-UHFFFAOYSA-N	436.468	1.886	50	20	IDGD	
CC(=O)Nc1ccc(Cl)c(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1	763574780	IIMKVMWCVIWVNV-MRXNPFEDSA-N	432.820	1.224	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cnn(-c2ccccc2F)c1	763646575	IEIMECSKXIMAHJ-UHFFFAOYSA-N	427.392	1.185	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(-n3cncn3)c(Cl)c2)cc1	763660830	HVDBOBMFXBUZIB-UHFFFAOYSA-N	444.835	1.094	50	20	IDGD	
CC(=O)Nc1ccc(C)c(NC(=O)C(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])c1	763803891	OUZDVUIXYJWIIU-UHFFFAOYSA-N	429.389	1.027	50	20	IDGD	
CCOC(=O)c1c(C)csc1NC(=O)C(=O)NNC(=O)COc1ccccc1C#N	763812146	DJLCAJZNWPPSNB-UHFFFAOYSA-N	430.442	1.270	50	20	IDGD	
COC(=O)c1cc(F)ccc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1cccc(C)c1C	763850069	NWWWODKHZRQBAF-ZDUSSCGKSA-N	431.420	1.783	50	20	IDGD	
O=C(CCSc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccc(-n2cnnn2)cc1	763895716	QIBBPFWSOMLACF-UHFFFAOYSA-N	429.437	1.070	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(-n3nccn3)cc2)ccc1OC(C)C	763921174	ILXIQIBZDPDMGU-UHFFFAOYSA-N	438.444	1.463	50	20	IDGD	
CCOc1ccc(C#N)cc1NC(=O)C(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	763949553	POUVVIDOEWOKFT-UHFFFAOYSA-N	434.412	1.248	50	20	IDGD	
COc1cc(C(=O)N(C)C)ccc1NC(=O)C(=O)NNC(=O)c1cc(Cl)ccc1O	763973567	BDZDKYOTNODXGX-UHFFFAOYSA-N	434.836	1.156	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1c(F)c(F)c(F)c(F)c1F	764005978	HLNGJRRNIGKIMN-UHFFFAOYSA-N	431.273	1.553	50	20	IDGD	
CC(C)OC(=O)c1c(NC(=O)C(=O)NNC(=O)c2cnccn2)sc2c1CCCC2	764023983	HGHQMJZSXZKKGU-UHFFFAOYSA-N	431.474	1.382	50	20	IDGD	
O=C1C[C@H](Cc2ccc(NC(=O)C(=O)NNC(=O)c3ccc4ccccc4c3)cc2)C(=O)N1	764066292	FITJMKLCAXZSEC-SFHVURJKSA-N	444.447	1.445	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cccc(-c3cn(Cc4ccccc4)nn3)c2)n[nH]1	764106762	RGKUOSCJEAUCJR-UHFFFAOYSA-N	444.455	1.425	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)ccc1Cl	764125665	ZQOSBIZSPJSKBV-UHFFFAOYSA-N	426.212	1.885	50	20	IDGD	
O=C(CCCc1ccccc1)NNC(=O)C(=O)Nc1ccc(C(=O)N2CCOCC2)cc1	764224287	NVMKEGRUTUMJPH-UHFFFAOYSA-N	438.484	1.268	50	20	IDGD	
CCOc1cc(Cl)ccc1NC(=O)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	764266537	MKUPOWHDKYSGFT-UHFFFAOYSA-N	446.895	1.531	50	20	IDGD	
Cc1nc(-c2ccc(NC(=O)C(=O)NNC(=O)COc3ccccc3O)cc2)cs1	764279949	ITDZFEJPKOTFEY-UHFFFAOYSA-N	426.454	1.989	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)C(C)(C)c2ccccc2)cc1	764314721	YSZMNPONILXMMO-UHFFFAOYSA-N	446.529	1.437	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)c(Br)n1	764346298	VUPWLMXUUWWKSL-UHFFFAOYSA-N	427.642	1.911	50	20	IDGD	
COC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)c1	764377199	LJDIAQRYDWPHDG-UHFFFAOYSA-N	428.430	1.716	50	20	IDGD	
O=C(NNC(=O)C(F)(F)Oc1ccccc1)C(=O)Nc1cccc(N2CCCC2=O)c1	764380403	ZSXUYHVRBRPMDY-UHFFFAOYSA-N	432.383	1.571	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)C(=O)Nc1ccccc1C(=O)N1C[C@H](C)C[C@@H](C)C1	764389632	UHNIZDXSPUFGEN-HUUCEWRRSA-N	437.500	1.908	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1ccc(CCN(C)C)cc1	764394584	SDUCTZNIHAJQSU-UHFFFAOYSA-N	430.530	1.678	50	20	IDGD	
Cc1ccc([C@H](C)[C@H](O)C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1	764586434	VGONRCXBGQXCKN-JXFKEZNVSA-N	445.541	1.705	50	20	IDGD	
O=C(CCC(=O)N1CCN(c2ncccn2)CC1)NNC(=O)c1cc(-c2ccccc2)on1	764634338	DVIBEFBNQSVULH-UHFFFAOYSA-N	449.471	1.022	50	20	IDGD	
O=C(COC(=O)CCc1cncc2ccccc12)NNC(=O)[C@@H]1COc2ccccc2O1	765570999	WTVWUJVPPFOWBK-FQEVSTJZSA-N	435.436	1.698	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)N[C@@H]2CCC[C@H]2C(=O)NC)cc(OCC)c1OCC	765778870	QLACJYLWWWFZMF-HUUCEWRRSA-N	436.509	1.741	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)N[C@@H]1CC(=O)N(c2ccc(Cl)c(F)c2)C1	766555323	YDJMEWXLSHCCIR-DIFFPNOSSA-N	448.838	1.755	50	20	IDGD	
O=C(NNC(=O)c1ccc(F)c(Cl)c1)c1cccc(S(=O)(=O)N2CCOCC2)c1	767803465	DPBQKKNJCBCNKY-UHFFFAOYSA-N	441.868	1.575	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCN(C(=O)CCC(=O)NNc3ccccc3)CC2)cc1	767854751	LWUZJSVOFFMUNZ-UHFFFAOYSA-N	446.529	1.452	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)NC1CCN([C@@H]2CCCC[C@H]2O)CC1	769160515	JGGUGHFWYHKFJN-NVXWUHKLSA-N	435.481	1.072	50	20	IDGD	
CC1(C)[C@@H](NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)C[C@H]1OCc1ccccc1	770305142	DVJOETNDTKKWIG-RBUKOAKNSA-N	435.488	1.990	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)NCCc3nc(-c4ccc(Cl)cc4)no3)nc21	770394859	FLQXBOPUYNJDCY-UHFFFAOYSA-N	429.828	1.641	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)[C@H](Cc3ccccc3)NC(=O)c3ccccc3)nc21	770990792	ORWSAYRIDTWOSA-KRWDZBQOSA-N	431.456	1.553	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)CN1C(=O)N[C@@](C)(c2ccc(Br)cc2)C1=O	771235315	NPUGJFDTHSUDGM-SFHVURJKSA-N	448.277	1.016	50	20	IDGD	
Cc1ccncc1[C@H](C)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	771438883	IAUWIAYNBDGNCZ-HNNXBMFYSA-N	431.518	1.880	50	20	IDGD	
Cc1c(C=NNC(=O)c2cnn(C)c2)c2ccccn2c1C=NNC(=O)c1cnn(C)c1	771878467	GECDEUWWLFIILN-UHFFFAOYSA-N	431.460	1.243	50	20	IDGD	
O=C(NNC(=O)N1CCc2sc(Br)cc2C1)c1ccc(-n2cnnn2)cc1	771946880	KESWSNLHSDWZRI-UHFFFAOYSA-N	448.306	1.899	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1ccc(S(=O)(=O)N2CCC(C)CC2)s1	772094985	HKYGNIZUYFPWOJ-LBPRGKRZSA-N	431.536	1.271	50	20	IDGD	
O=C(CCN1CCN(C(c2ccccc2)c2ccccc2)CC1)NNC(=O)c1nc[nH]n1	773252102	REXXMYKKRJLKIN-UHFFFAOYSA-N	433.516	1.363	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NNC(=O)c2cc(S(C)(=O)=O)ccc2F)C1	773417654	HDVNWLLEAVGMCD-GFCCVEGCSA-N	443.497	1.637	50	20	IDGD	
CC(C)[C@@H](NC1CCOCC1)C(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776201163	GICVKAZKECMPPY-QGZVFWFLSA-N	441.573	1.415	50	20	IDGD	
C[C@@H]1OC(C)(C)N(C(=O)OC(C)(C)C)[C@H]1C(=O)OCC(=O)NNC(=O)c1ccccc1	776477905	LGJGPUKWZDWZQM-XJKSGUPXSA-N	435.477	1.751	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)N[C@@H]2C[C@@H](OCC)[C@@H]2OC)c2ccccc2c1=O	776519621	ANGYGHOOJXEQAS-JFIYKMOQSA-N	431.493	1.333	50	20	IDGD	
CN1CCN(Cc2ccc(CNC(=O)NNc3cccc(S(C)(=O)=O)c3)cc2)CC1	776610091	REEYFAMTWIPKRD-UHFFFAOYSA-N	431.562	1.664	50	20	IDGD	
O=C(NNC(=O)N1CC[C@@](O)(c2ccc(F)cc2)C1)C1CCN(c2ncccn2)CC1	776908043	OJTWMNPKOJGWRY-NRFANRHFSA-N	428.468	1.166	50	20	IDGD	
COCCO[C@@H]1COCC[C@H]1NC(=O)NNC(=O)c1cc(OC)ccc1Br	777280343	ZMAWPRQNTPUXRT-HUUCEWRRSA-N	446.298	1.222	50	20	IDGD	
CC(C)NC(=O)C(=O)NNS(=O)(=O)c1cc(Cl)ccc1OC[C@@H]1CCCCO1	777599775	LHKVCWXTRNRCLH-ZDUSSCGKSA-N	433.914	1.122	50	20	IDGD	
COc1ccc(N2CCN(C(=O)/C=C/C(=O)NNc3ccccc3[N+](=O)[O-])CC2)cc1	778220452	FZSLMNHCSNJHIO-ZHACJKMWSA-N	425.445	1.952	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=O)CNC(=O)OC(C)(C)C)ccc1C	778443839	YMYQKLZEEUQZHN-UHFFFAOYSA-N	442.538	1.311	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)c1ccccc1SCC(=O)N1CCCC1	778444883	BHTQDWZJEQTLEP-UHFFFAOYSA-N	436.534	1.687	50	20	IDGD	
C[C@@H](NC(=O)OC(C)(C)C)[C@H]1CCN(CC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)C1	778973905	BMASWZGYBKGGAT-HIFRSBDPSA-N	435.481	1.591	50	20	IDGD	
C[C@H]1C(=O)CC[C@@H](C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)C1(C)C	780154822	DLBMSFLCPVWWJK-YOEHRIQHSA-N	435.546	1.874	50	20	IDGD	
CC[C@@H]1C[C@H](CC(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)CCO1	782118800	WHRZZLWOOIYENO-HZPDHXFCSA-N	425.555	1.056	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)cc1OCC	782885341	JYYGVWHYMWQWMX-UHFFFAOYSA-N	439.472	1.699	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C(=O)Nc2ccc(OC3CCC3)c(F)c2)nc2ccccc21	782894148	MZDNFAGWNWLFSI-UHFFFAOYSA-N	439.447	1.972	50	20	IDGD	
CC[C@H](C)Oc1cccc(NC(=O)C(=O)NNC(=O)c2csc(N3CCOCC3)n2)c1	782898020	WKMXDKZOOHFFLI-ZDUSSCGKSA-N	447.517	1.557	50	20	IDGD	
O=C(NNc1ncccc1C(F)(F)F)C(=O)Nc1ccc2nc3n(c(=O)c2c1)CCC3	783117573	DYLXHJIPHLUKHF-UHFFFAOYSA-N	432.362	1.838	50	20	IDGD	
C[C@H](C(=O)Nc1ccc(NC(=O)C(=O)NNc2ccc(F)cc2F)cc1)n1cncn1	783340113	MICSMYPIWWFDAL-LLVKDONJSA-N	429.387	1.838	50	20	IDGD	
COc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)C(=O)NNc1c(C)cc(C)cc1C	783367074	LDEYBEBTDXHJGP-UHFFFAOYSA-N	434.518	1.953	50	20	IDGD	
Cc1nc(N2CCOCC2)ccc1NC(=O)C(=O)NNc1ccc([N+](=O)[O-])cc1Cl	784381750	JHKIHUHKPYLCOC-UHFFFAOYSA-N	434.840	1.870	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ccnc(Br)c2)c(OC)c1OC	784831274	YIXOCSHBRGMNKE-UHFFFAOYSA-N	425.239	1.952	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNc2ccc(Cl)c(F)c2)ccc1S(=O)(=O)N(C)C	785178993	KCCFSNAJQPTXJO-UHFFFAOYSA-N	444.872	1.820	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1cccnc1OCC(F)F	785330515	JINYANFPQJJSTA-UHFFFAOYSA-N	444.416	1.219	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)C(F)(F)c2ncccc2C)c1	786607874	FVZXXWGXTPYGOZ-UHFFFAOYSA-N	440.472	1.974	50	20	IDGD	
C[C@H](OC(=O)/C(C#N)=C\C1CC1)C(=O)Nc1cccc(S(=O)(=O)N2CCOCC2)c1	786679126	WYFASRYWMIRRSM-HNDQUVLASA-N	433.486	1.438	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(OC)c(C(=O)NNc2ccc(-n3ccnc3)nn2)c1	788175365	RWLPQDITMNMQRO-UHFFFAOYSA-N	445.505	1.458	50	20	IDGD	
CS(=O)(=O)[C@@H]1CCCC(=NNC(=O)CN2c3cccc4cccc(c34)S2(=O)=O)C1	788420209	GXRADUPOKNCTAQ-OAHLLOKOSA-N	435.527	1.808	50	20	IDGD	
COc1ccc(OC)c([C@H]2C[C@H]2C(=O)N2CCN(S(=O)(=O)CBr)CC2)c1	788526060	PLVGARFMWSGWDB-UKRRQHHQSA-N	447.351	1.634	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cc(C#N)cn2C(C)(C)C)cc1	789741219	RCVOCNKXQCVOIF-CQSZACIVSA-N	439.472	1.871	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2OC)c1)C(=O)OC	790105146	ZWNCOLVHURCGFW-OAHLLOKOSA-N	449.485	1.456	50	20	IDGD	
COC(=O)[C@@H](CNS(=O)(=O)CBr)Oc1ccc(Br)cc1	790475043	IPTVHQKTXGBMGA-SNVBAGLBSA-N	431.102	1.641	50	20	IDGD	
C[C@@]12CCN(C(=O)NNC(=O)c3csc(N4CCOCC4)n3)C[C@@H]1C2(Cl)Cl	790655279	HGAFEQCXMFOXOB-XHDPSFHLSA-N	434.349	1.850	50	20	IDGD	
Cc1ccc(CN2CC[C@@H](NC(=O)NNC(=O)Cc3nc4ccccc4n3C)C2=O)cc1	790696245	MUKDECBSWMMCLU-GOSISDBHSA-N	434.500	1.556	50	20	IDGD	
Cc1cccnc1NNC(=O)C(=O)Nc1ccc(S(=O)(=O)N2CCC[C@@H](C)C2)cc1	792378961	ZRCPUTHFEUDYRT-CQSZACIVSA-N	431.518	1.892	50	20	IDGD	
O=C(NNC(=O)c1cc(O)ccc1[N+](=O)[O-])c1cccc(S(=O)(=O)N2CCCCC2)c1	794741396	MPHFZWRRQBQFPS-UHFFFAOYSA-N	448.457	1.550	50	20	IDGD	
CCOc1cc(NC(=O)C(=O)NNC(=O)CNC(=O)OCc2ccccc2)ccc1C	797368502	BQFIZMPIEFXOJP-UHFFFAOYSA-N	428.445	1.406	50	20	IDGD	
O=S(=O)(CBr)NCCC1CCN(S(=O)(=O)CBr)CC1	801699514	CDIWJPXEMFNUEB-UHFFFAOYSA-N	442.195	1.043	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)Nc2ccnc(OC)n2)c2ccccc2c1=O	801725139	GHYLBSXEIRDNRX-UHFFFAOYSA-N	425.449	1.852	50	20	IDGD	
O=C(N=c1cc[nH]cc1)NNC(=O)c1cc([N+](=O)[O-])ccc1I	802024154	JGRFRMNBLYUQQP-UHFFFAOYSA-N	427.158	1.483	50	20	IDGD	
O=C(N=c1cc[nH]cc1)NNC(=O)[C@H]1CCCN(C(=O)c2ccccc2OC(F)F)C1	802025122	SOSGTQVPBWHLCP-ZDUSSCGKSA-N	433.415	1.810	50	20	IDGD	
CCn1c(=O)c(=O)[nH]c2cc(C(=O)NNC(=O)Nc3cc(OC)ccc3Cl)ccc21	802116656	MHRRUGUFEJQFBG-UHFFFAOYSA-N	431.836	1.838	50	20	IDGD	
O=C(CCc1cccc(CCC(=O)NNc2ncc(F)cn2)c1)NNc1ncc(F)cn1	802914042	SJNQIFZTXFRHSI-UHFFFAOYSA-N	442.430	1.697	50	20	IDGD	
CC(C)N1C(=O)c2ccc(C(=O)NNc3ccc4c(=O)[nH]ccc4c3)cc2S1(=O)=O	803435201	OTXRHRVPSXYQOH-UHFFFAOYSA-N	426.454	1.838	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)COCc1nnc(C)s1	803726934	DEBNMWYKUTYJOV-UHFFFAOYSA-N	428.854	1.030	50	20	IDGD	
O=C1COc2c(cc(Cl)cc2NC(=O)C(=O)NNC(=O)c2c[nH]c3ccccc23)N1	806972479	AWJBFDOVPHJHHP-UHFFFAOYSA-N	427.804	1.552	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2cccc3cc(Br)cnc23)CCS(=O)(=O)C1	807001125	QRMJEPVFTQOUNI-INIZCTEOSA-N	441.307	1.134	50	20	IDGD	
O=C(NNC(=O)N1CCC[C@H](CNS(=O)(=O)C2CC2)C1)c1cccc(OC(F)F)c1	808264422	BPVKDERLUAYXQB-GFCCVEGCSA-N	446.476	1.436	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N2CC[C@H](CS(C)(=O)=O)C2)cc1Br	814299979	HESVMKPBISXGFH-JTQLQIEISA-N	434.312	1.179	50	20	IDGD	
Cc1cc(C#N)cnc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	814698439	FKVSODJJHGOIEG-UHFFFAOYSA-N	427.486	1.511	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)N(C)C)nn1[C@@H](C)C1CC1	815751752	NEYFCSNWJSIPEN-ZDUSSCGKSA-N	434.522	1.495	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1nc2c(s1)CCCCC2	815752140	FHYNTPYEXJXASU-UHFFFAOYSA-N	437.547	1.744	50	20	IDGD	
COC(=O)c1cc(NNC(=O)c2cccc(S(=O)(=O)NC[C@H]3CCCO3)c2)ccc1C	816690180	KGTRLBKLVARODM-QGZVFWFLSA-N	447.513	1.996	50	20	IDGD	
COc1ccc(-n2cnnc2SCC(=O)NNC(=O)c2cc(OC)cc(OC)c2)cc1	818830766	BCRNAOFHCXYDRU-UHFFFAOYSA-N	443.485	1.846	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)c1cc([N+](=O)[O-])ccc1Sc1nc[nH]n1	822013714	KAFRWKQZDABZON-UHFFFAOYSA-N	432.393	1.843	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c(C)c1	913164236	ASZMIENEVYQUMW-UHFFFAOYSA-N	446.529	1.197	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CN(C)[C@H]2CCS(=O)(=O)C2)ccc1OCCC(C)C	914531804	FTZXTCYULJDREA-INIZCTEOSA-N	441.550	1.000	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)c2cc(S(=O)(=O)N3CCCCC3)cn2C)c1	914846263	FGDLDJQQOQXEIO-UHFFFAOYSA-N	434.518	1.348	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc([C@H](C)NC(=O)NN[C@@]2(C)CCS(=O)(=O)C2)cc1	915901805	LKYQRSHBTFJVGG-KSSFIOAISA-N	446.595	1.159	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)NCc2ccc(S(N)(=O)=O)s2)cc1	915906137	LYKYFUOROCWBEQ-LLVKDONJSA-N	442.519	1.092	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)ccc1OCC(=O)NC(C)C	916138348	HEPQHLTXBLVUSR-AWEZNQCLSA-N	447.463	1.966	50	20	IDGD	
CC(C)[C@H](CNC(=O)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1)N1CCOCC1	916254589	ZLAUUOCAZBNJKN-HNNXBMFYSA-N	438.472	1.963	50	20	IDGD	
CN(CCO)c1ccc(C=NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1	916261827	GAWBDCOKSSONPY-UHFFFAOYSA-N	430.530	1.664	50	20	IDGD	
O=C(NC[C@H]1CCN(C2CC2)C1)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	916577957	OBTQKLJBUOOTND-MRXNPFEDSA-N	449.577	1.290	50	20	IDGD	
COCCN1C(=O)c2ccc(C(=O)NNC(=O)c3cccc(Cl)c3)cc2S1(=O)=O	916741075	OXXKLWKUVJYKQI-UHFFFAOYSA-N	437.861	1.206	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)c(C)c1	917721857	KDILWBJMBHNRGR-UHFFFAOYSA-N	430.486	1.918	50	20	IDGD	
Cc1ccc([C@H](CNC(=O)NNC(=O)c2c(C)nc3ccccn23)N2CCOCC2)cc1	918099518	RFSPDOSZXKBXDA-IBGZPJMESA-N	436.516	1.969	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)N3CCC[C@@H](CNS(C)(=O)=O)C3)cc2C1	918779519	YAXJLGWAXRIYNV-STQMWFEESA-N	428.580	1.489	50	20	IDGD	
Cc1nnc(CNC(=O)NNC(=O)[C@@H]2Cc3ccccc3CN2Cc2ccccc2)n1C	1116012079	YQBUIQNRCDCSQT-FQEVSTJZSA-N	433.516	1.581	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)cc2c1CCC2	1116347554	PCMZNPZGBVVLGP-UHFFFAOYSA-N	445.469	1.576	50	20	IDGD	
CCOC(=O)Cc1cccc(S(=O)(=O)NNC(=O)c2cncn2-c2ccccc2)c1	1117130716	QACATBSXZVAFHI-UHFFFAOYSA-N	428.470	1.601	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)Nc1cnn(Cc2cccnc2)c1	1323831179	VMASTDGFWLCPFQ-UHFFFAOYSA-N	448.531	1.691	50	20	IDGD	
O=C(NNS(=O)(=O)c1cccc(S(=O)(=O)NC2CC2)c1)c1ccccc1Cl	1337181573	UUKKZLBQGBAYNB-UHFFFAOYSA-N	429.907	1.404	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=S)Nc1cccc(F)c1F	1341051416	JIEJBLLLSSNTMQ-UHFFFAOYSA-N	433.484	1.740	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3nc4ccccc4n(C)c3=O)C2)C1	1777886911	LEYJKPORAHXRLN-QRQCRPRQSA-N	446.935	1.785	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Br)C2)c1nc[nH]c1[N+](=O)[O-]	1778062778	RRKKJRQCEVBCIO-XDMRBOTDSA-N	448.249	1.136	50	20	IDGD	
CC(=O)Nc1ccc(CC(=O)N2CC[C@@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)cc1	1778255973	CJIIEIWRIBUYOQ-QFIPXVFZSA-N	447.608	1.869	50	20	IDGD	
Cc1cnc2c(C(=O)N3CC[C@]4(C3)CN(C(=O)[C@@](C)(Cl)CCl)CCO4)cnn2c1	1778525414	FUMIQYXIDGWGGL-OALUTQOASA-N	440.331	1.718	50	20	IDGD	
O=C(c1cn2cc(F)ccc2n1)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1778545475	PNZWPINODIOWAR-WMLDXEAASA-N	443.248	1.607	50	20	IDGD	
Cc1nc2sccn2c1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2	1779152564	MFENMFGLNBEQPE-IQUTYRLHSA-N	440.953	1.431	50	20	IDGD	
O=C(/C=C\C(=O)NC1CC1)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Br)C2	1779230742	QMYGEVODIOMFJC-MDWWKSDDSA-N	446.317	1.026	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@]2(C1)CN(C(=O)CS[C@H]1CCCCO1)CCO2	1779296829	HKGKOMZXTBUYAH-OALUTQOASA-N	430.643	1.928	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(C)n(CC)n3)C2)C1	1779718873	LNBLLXSUSDCSBY-KBXCAEBGSA-N	427.343	1.828	50	20	IDGD	
Cn1c(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](F)Cl)CCO3)cc2c[nH]c3nccc-3c21	1780036968	LMBPKHIFSBFMAU-OXQOHEQNSA-N	433.871	1.984	50	20	IDGD	
Cc1nc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@](C)(Cl)CCl)C3)C2)c(=O)[nH]c1C	1781225432	WVAOJDLUJNJZLS-QZTJIDSGSA-N	431.320	1.067	50	20	IDGD	
O=C(c1cnc2ccoc2c1)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781332052	YRQZYPSYZURWFM-PBHICJAKSA-N	426.242	1.962	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](F)Br)C3)C2)nn1C(F)F	1781334476	NZSWVCFZCOCONJ-XHDPSFHLSA-N	439.232	1.721	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)n1ccnc1C)C2	1782179312	WYQMANREIRRGJZ-WVSUBDOOSA-N	426.945	1.520	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)Cc2c(C)nn(C)c2C)C1	1782553385	MJJMEVCDTIINBI-DBXWQHBBSA-N	440.972	1.347	50	20	IDGD	
CC(=O)NCCC(=O)N1CCO[C@@]2(CCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1	1782866686	GXIXALPUYVMWBW-BPNKPRMTSA-N	446.454	1.228	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(CCN(C(=O)[C@H](O)Cc3ccccc3)C2)C1	1783334663	UZKKSZJOHWPDOO-VQIMIIECSA-N	425.323	1.205	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(CO)c(F)c3)CCO2)C1	1783536873	HTBKUNAYJPFGGH-SGTLLEGYSA-N	429.286	1.545	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CC3CCN(C)CC3)[C@H]2C1	1783657036	UEYOWYSHMUCRMV-XSLAGTTESA-N	444.414	1.872	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3c[nH]c4cccc(OC)c34)CCO2)C1	1783880603	FYPAGDLGEFCCAB-VFNWGFHPSA-N	435.908	1.874	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1CCC[C@@H]3CCCC[C@@H]31)CCO2	1783934529	IQFWXNKTAGSYSZ-KTIHBUSBSA-N	448.608	1.796	50	20	IDGD	
O=C(COc1ccc(Cl)c(F)c1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21	1784422086	YTSQTBKRBZCOFM-SCTFDZSOSA-N	449.306	1.437	50	20	IDGD	
COc1ncccc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)Br)C[C@@H]21	1786013445	WQKUNBKJQIZOAA-DHMWGJHJSA-N	426.311	1.467	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)COc3ccc(O)cc3)C[C@@H]21	1786404775	OFVRACLEAPWMCU-JQFCIGGWSA-N	441.322	1.536	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21)c1ccc(-n2cnnc2)cc1	1786769667	MZMZKRXQVBESGQ-BPUTZDHNSA-N	438.315	1.664	50	20	IDGD	
C[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)n1cccc1C=O	1786991430	BBBCQLLGQHSRHL-OHFALNGGSA-N	440.338	1.626	50	20	IDGD	
O=C(CCN1CCCC1)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1	1788145045	AVWUVJZYFWDFEY-UHFFFAOYSA-N	435.333	1.600	50	20	IDGD	
CC(=O)O[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]21)C(C)C	1788480729	YLRXRQGMDDOJLA-GMHRPJKWSA-N	437.364	1.790	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC1(c2ccc(NC(=O)c3ccncn3)cc2)CCC1	1788698039	OWVNRNRJYDZRIC-UHFFFAOYSA-N	431.456	1.537	50	20	IDGD	
COc1cccc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]3C2)n1	1789868769	LPDOJOOAPDAMOJ-PEMDQYIBSA-N	444.359	1.849	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3[nH]nc4ncccc34)C[C@@H]21)[C@H](F)Br	1789923182	WQAOTXLOSSQVAG-HVTMNAMFSA-N	440.273	1.242	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN3CCSCC3)C[C@@H]21	1790962440	YPYFYWZGVFYADX-JONQDZQNSA-N	448.427	1.188	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(Cl)nn3)C[C@@H]21	1791056293	RLWRABLKVPCNFZ-ZPFDUUQYSA-N	431.718	1.507	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4nn(C)cc4c3)C[C@@H]21	1791061077	QDQPPTGYZMCCOJ-XJOINEQPSA-N	449.349	1.950	50	20	IDGD	
C[C@H](NNc1ccccc1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]2C1	1791292580	XEQNQYIDIGUNHO-SDADXPQNSA-N	429.348	1.775	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3ncc[nH]3)[C@H]2C1	1791478647	LAMBJNCPMXXJIH-AJNGGQMLSA-N	427.343	1.353	50	20	IDGD	
Cc1ccc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)CBr)nc1	1792870579	SDBZTVGCUFJYDQ-OAFZBRQQSA-N	438.366	1.943	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCl)c1nc2ccc(C(F)(F)F)cn2n1	1793109660	DSXRTZKIJUQMGI-YVECIDJPSA-N	445.829	1.600	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)n1cccc1C=O	1795752071	FMQBVKHMMZGMTO-AQDIXCGQSA-N	426.311	1.235	50	20	IDGD	
COc1cc(F)ccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1	1796190687	YJUMHLOKDGGVDF-BCDXTJNWSA-N	426.253	1.080	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1CCN(S(C)(=O)=O)CC1	1797705349	SGJCOFJWYJVWGT-YYIAUSFCSA-N	434.002	1.704	50	20	IDGD	
COc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)Br)ccc1O	1800760618	WBRCFUQHUJIYSB-VFFTVRQLSA-N	427.295	1.387	50	20	IDGD	
COc1cccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)Br)c1C	1800762493	CDOWSWSXTSWTHX-ZJOBFFGXSA-N	425.323	1.990	50	20	IDGD	
CO[C@@H](C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](Br)Cc1ccccc1)C2	1801043437	RIBNUOVUUHLBRF-MWTISTBLSA-N	439.350	1.617	50	20	IDGD	
O=C1CC[C@@H](C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](Br)Cc2ccccc2)N1	1801568191	UOYLMKSIMLFESC-ADHGMGHFSA-N	448.361	1.909	50	20	IDGD	
CC[C@@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCOCCOCCOC)C2	1801804959	JNVPASMQFMKKHM-YYIAUSFCSA-N	449.386	1.868	50	20	IDGD	
COc1cccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCBr)C3)c1F	1801922671	GQCUOSNSQVHMOK-DPIQGUFMSA-N	429.286	1.823	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)[C@@H]1CC=CCC1	1803026618	QQGKMBCSCAFFKT-NQSCKRDGSA-N	433.317	1.437	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cnc3snnc3c2)[C@@H]1c1cccnc1)[C@H](O)CCl	1803140897	IXYWTGVAAWVZIE-APHBMKBZSA-N	446.920	1.401	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)C(F)(F)C(F)F)[C@H]1c1cccnc1	1804012372	ARIMAZVRNPGIIH-XJKSGUPXSA-N	447.433	1.361	50	20	IDGD	
O=C(Cc1ncccn1)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@@H]1c1cccnc1	1804694170	HBSWOLSBEAMYKM-IAOVAPTHSA-N	436.285	1.811	50	20	IDGD	
O=C(Cc1cccc(Cl)n1)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1	1804698256	DTIFMKLLTXZFIB-ZSZQSSIHSA-N	437.327	1.978	50	20	IDGD	
Cc1ncccc1C(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1805503873	GCDIPZAWBRTAJI-GCJKJVERSA-N	438.532	1.478	50	20	IDGD	
Cn1ncnc1C(=O)N1CC[C@H](CNC(=O)[C@](C)(Cl)CCl)[C@@H]1c1cccnc1	1808292641	ZUEGHQSYVXEHMR-QWQRMKEZSA-N	425.320	1.766	50	20	IDGD	
N[C@@H](Cc1cccnc1)C(=O)N1CCC2(CCCN(C(=O)CCBr)C2)CC1	1809065896	FHKXGYZHPBFRMA-KRWDZBQOSA-N	437.382	1.968	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)c1cnn2ccncc12	1809381223	MXGRCRZSYKJCOG-WBAXXEDZSA-N	428.880	1.044	50	20	IDGD	
O=C1NCCCn2nc(C(=O)N3CCC4(CCCN(C(=O)[C@@H](F)Cl)C4)CC3)cc21	1810905698	NHRJVPMWWKCRJF-OAHLLOKOSA-N	425.892	1.396	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](F)Cl)[C@@H]1c1cccnc1)c1cc(=O)nc2cccnn12	1811336185	PKVWTYRDEUXXLQ-VHSSKADRSA-N	444.854	1.339	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1	1812808431	PCUNHYPWOROQRB-YQQAZPJKSA-N	440.928	1.212	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)Cc2cnn(C)c2)[C@@H]1c1cccnc1	1812867755	MMTOWCQTEGGDDH-QANKJYHBSA-N	434.338	1.847	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)[C@H](N)c2ccccn2)[C@H]1c1cccnc1	1813032224	VCXWYMNWFKWQEG-DKKFBQAASA-N	431.924	1.436	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@H]1CCc2nc(NC(=O)CCC#N)sc2C1	1814492951	MDJRIRDFIBDWIW-JBBSTVMTSA-N	427.490	1.493	50	20	IDGD	
O=C(NCCC(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](O)CCl)n[nH]1)c1ccc[nH]1	1814866995	BTBZXYOLPGOZJS-GJZGRUSLSA-N	436.900	1.150	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CSCC(=O)OC)n[nH]1	1815224208	CXJAKXITEXXWLW-YPMHNXCESA-N	432.930	1.562	50	20	IDGD	
Cc1cc(C)cc(C(=O)N[C@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)c1	1815343605	CVVZMYUXWCSDAK-SFHVURJKSA-N	449.341	1.979	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)C(F)(F)C(F)F)n[nH]1	1815544467	MJLRWTDAXWRWSW-NSHDSACASA-N	436.410	1.675	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2CCCSC2)[nH]n1)c1cccc(B(O)O)c1	1817479331	QGTIQZGFTVJLLS-QAPCUYQASA-N	442.350	1.539	50	20	IDGD	
Cc1c[nH]cc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819403024	SSTPOQVVYFHVGZ-KRWDZBQOSA-N	436.476	1.664	50	20	IDGD	
Cc1ccn(C)c1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1820356448	BFGBYSBPHXFSNL-SFHVURJKSA-N	435.293	1.356	50	20	IDGD	
C=CCNC(=O)/C=C\C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](F)Br)n[nH]1	1820933749	CRRPVRPYMAUQOO-OPXNRTNISA-N	442.289	1.951	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1	1822192109	OYWAPURLHGKTQO-DGCLKSJQSA-N	443.346	1.558	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])o2)[nH]n1	1822412237	OJXANAFLECCLAR-ZDUSSCGKSA-N	447.452	1.590	50	20	IDGD	
C[C@@H]1C[C@]1(C)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnccc1C(=O)NN)CC2	1822650436	NINIETOQYVBRPF-NLQQUQSOSA-N	428.518	1.414	50	20	IDGD	
Cc1noc(CC(=O)N[C@@H]2CCc3nc(NC(=O)[C@H](F)Br)sc3C2)n1	1823005177	XRBWZWNMLGZZRA-KRTXAFLBSA-N	432.275	1.680	50	20	IDGD	
C=CCNC(=O)/C=C\C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H](Cl)COC)CC1	1823749409	NPEOKNGKDKGOQO-OPDSQHBBSA-N	425.957	1.718	50	20	IDGD	
Cc1nccn1CC(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](F)Br)CC2	1824710162	VNEMFAZIEGLBTA-RNCFNFMXSA-N	430.303	1.951	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)CCc2cn[nH]c2)CC1	1825187718	OSBTUPQMUZGFPG-LJQANCHMSA-N	432.569	1.335	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CN1CCCC1=O)CC2	1825640643	BULGDDMZICDHLJ-ZJUUUORDSA-N	429.340	1.461	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccnc(F)c1)CC2	1826082935	GPWUYFNTTTWNGD-LBPRGKRZSA-N	434.497	1.276	50	20	IDGD	
COC[C@H](NC(C)=O)C(=O)N1CCC([C@H]2CCCCN2C(=O)CCBr)CC1	1826358613	JDZVVANGAWCWCE-DLBZAZTESA-N	446.386	1.542	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2nc[nH]c2[N+](=O)[O-])CC1	1827651427	XBYQNMNUXZITCH-KGLIPLIRSA-N	427.889	1.805	50	20	IDGD	
CC(=O)Nc1ccccc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](O)CCl)CC2	1827717808	AAWSKVMQFDRKSA-NHYWBVRUSA-N	436.921	1.927	50	20	IDGD	
C#CCCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1)CC2	1828091849	VSPAEQBPOWDRQS-XIXVAHAYSA-N	426.502	1.603	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CCc4nc[nH]c4C3)C2)C1	1830370089	HVAAHSWHYCBLOS-VFNWGFHPSA-N	438.956	1.236	50	20	IDGD	
O=C(/C=C/c1ccc(F)cc1F)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1832136991	IFDCHRUTUAMGPD-ULIAPGIUSA-N	432.826	1.969	50	20	IDGD	
Cc1ncc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)cn1	1833814635	DBIZKOMBYGMWQV-ZWKOTPCHSA-N	431.320	1.091	50	20	IDGD	
N[C@H](CC(=O)NC1CCN(C2CCN(C(=O)[C@H](F)Cl)CC2)CC1)c1cccnc1	1834762170	BLISBNWUJXRBBW-MJGOQNOKSA-N	425.936	1.578	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@]3(CN(C(=O)CCBr)CCO3)C2)nc1	1834819702	YRMIVRNYROVSDT-SFHVURJKSA-N	426.311	1.245	50	20	IDGD	
Cc1nc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCBr)CCO3)C2)sc1C	1834823128	JYVTTZUDDIOAEZ-QGZVFWFLSA-N	446.367	1.615	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)Cc3cscn3)CC2)CC1	1834841137	UWJPZBVNNBOLEO-QGZVFWFLSA-N	428.986	1.511	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)/C=C/c3cc(C)on3)CC2)CC1	1835778899	WSJOJQZVTUZZGX-RTLBZRNLSA-N	438.956	1.822	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc4n(n3)CCC4)CCO2)C1	1837093753	BYDRGYKRHSOOFX-RBUKOAKNSA-N	445.347	1.136	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CCC=CO1)CCO2	1837418625	IMFBDCPSQVZRBQ-MPGHIAIKSA-N	431.327	1.309	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc4nc[nH]c34)C2)C1	1837711813	RHQUXKJWDSINDK-NRFANRHFSA-N	446.580	1.484	50	20	IDGD	
COc1cc(C(=O)N2CCOC[C@@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)ccn1	1837715484	SKMOYQMOMGIZLF-HXUWFJFHSA-N	437.569	1.012	50	20	IDGD	
CCc1nc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)co1	1838138637	CPVWPNQXGFKUAC-ZWKOTPCHSA-N	434.320	1.543	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)CCNC(=S)NC)CC2)CC1	1838396312	RIYSTRSPKCTBLH-MRXNPFEDSA-N	433.018	1.486	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)c(OC)c1	1838879864	MAPLUTZZJQLPDC-LPHOPBHVSA-N	430.860	1.308	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)c(O)c1	1838890042	CXKLLYFPKKAGQS-SFHVURJKSA-N	433.288	1.275	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cccc([N+](=O)[O-])c3)C2)C1	1839141956	ZFJSMNSEYYCDJO-FXAWDEMLSA-N	439.896	1.611	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CCc4ccccc4O3)C2)C1	1839149026	QJZPJWKPCFFAAC-LQBOVUBWSA-N	436.936	1.854	50	20	IDGD	
CCc1oncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2	1839151518	VCJQMDBLRFLETA-ROUUACIJSA-N	434.320	1.543	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ncccc3F)C2)C1	1839153946	WHPIYFPIKFDHJW-MSOLQXFVSA-N	434.295	1.527	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)cc1O	1839266552	IONDVEHMACIQEC-OAQYLSRUSA-N	436.581	1.622	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3(F)CC3)C2)C1	1839744034	LFEXAXNQAFZADC-JUALLIRVSA-N	449.429	1.830	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CN3CCCCC3)C2)C1	1839963204	DEHBTMKFRDLVGF-VQIMIIECSA-N	446.386	1.102	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3ccc[nH]3)C2)C1	1840031772	BVHRHTWYRZMYAS-RDTXWAMCSA-N	428.327	1.187	50	20	IDGD	
C=CCC(F)(F)C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](C)Br)CCO2)C1	1840035378	PFWAMNXTUQELTG-WFASDCNBSA-N	425.270	1.438	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3cccnc3C)C2)C1	1840149934	BYKFIDRJJRMNGC-WIYYLYMNSA-N	439.940	1.033	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3cccc(O)c3)CCO2)C1	1840268282	PJADOYUTFPAJOF-NQIIRXRSSA-N	440.924	1.035	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C13CCC(CC1)CC3)CCO2	1840543908	GAVJFSTUCNLIJN-YPTYLKSTSA-N	428.957	1.667	50	20	IDGD	
CC(C)C[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1	1841353817	RFYFHHASUNAIBY-HUUCEWRRSA-N	431.961	1.729	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H]1C(=O)N1CC2(CCCN2C(=O)CCBr)C1	1842637324	BCAPREWQTOFVLG-CYBMUJFWSA-N	430.343	1.984	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)CCc1c[nH]c3ncccc13)C2	1844265561	OQWGFBBRDACKEX-UHFFFAOYSA-N	447.499	1.011	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H](C(=O)N2CCCC23CN(C(=O)[C@H](F)Cl)C3)[C@H]2OCC[C@H]21	1846184252	CRFNNFGUYPVMHH-YJNKXOJESA-N	445.919	1.749	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@H](Cc1cccc(F)c1)NC(C)=O)C2	1846365670	NMJBZDUDKBTBNX-ROUUACIJSA-N	439.915	1.330	50	20	IDGD	
Cc1cc(NC(=O)CC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](C)CBr)no1	1847499265	ZYXRANUHQXRNJC-DRZSPHRISA-N	427.299	1.544	50	20	IDGD	
Cc1ncncc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1848099219	GGUZNIXQQAXUTH-JYJNAYRXSA-N	437.928	1.733	50	20	IDGD	
Cc1nn[nH]c1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1848099352	JOOZWPVOCAPPQI-AVGNSLFASA-N	426.905	1.061	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2ccc(C)c(C(=O)NNC(=O)C(=O)NC3CC3)c2)cc1	9889982	YPZMNABFLIQBGZ-UHFFFAOYSA-N	430.486	1.144	50	20	IDGD	
Cc1c(/C=C(\C#N)C(=O)OCC(=O)N(CCC(N)=O)c2ccc(F)cc2)cc(C#N)n1C	10958130	PLWMBNNJXIMFBW-CXUHLZMHSA-N	437.431	1.703	50	20	IDGD	
O=C(Cc1ccc2c(c1)CCO2)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	11331267	MFMVKXQFKRFMEC-UHFFFAOYSA-N	429.498	1.410	50	20	IDGD	
Cc1nc2c(c(C)nn2C)c(C)c1CCC(=O)NNC(=O)c1n[nH]c(=O)c2ccccc12	11553532	VGJTXMVQADEJCU-UHFFFAOYSA-N	433.472	1.524	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)CCN2C(=O)[C@@H](C)Oc3ccccc32)cc1	16192190	YKRHDPBPKVDFFH-OAHLLOKOSA-N	425.441	1.503	50	20	IDGD	
CC(C)CCn1nc(C(=O)NN/C=C2/C(=O)NC(=O)c3ccccc32)c2ccccc2c1=O	16720334	LYOXSVDTBKVOOW-CPNJWEJPSA-N	445.479	1.988	50	20	IDGD	
O=C(CCc1nc2ccccc2[nH]1)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	16971388	ZXKKITDMKRFGJB-UHFFFAOYSA-N	441.513	1.741	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1Br	22023575	RJBNDJMFROLQJB-UHFFFAOYSA-N	443.275	1.852	50	20	IDGD	
COc1cccc(C=NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1O	254874149	FSWRNTOUICUTCU-UHFFFAOYSA-N	447.513	1.505	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)[C@@H](C)N2C(=O)NC3(CCCC3)C2=O)cc1OC	726522198	FSKREYHJNMFNSW-CQSZACIVSA-N	446.504	1.888	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)C(C)(C)NC(C)=O)c2)cc1	726765252	IKYVWXCYAPPBCQ-UHFFFAOYSA-N	448.501	1.172	50	20	IDGD	
C[C@@H](C#N)Oc1ccc(C=NNC(=O)C(=O)NN=Cc2ccc(O[C@H](C)C#N)cc2)cc1	727683257	DRYHDKJKBLZQPC-IYBDPMFKSA-N	432.440	1.869	50	20	IDGD	
O=C(CCCc1ccccc1)NNS(=O)(=O)c1ccc(C(=O)N2CCOCC2)cc1	727721343	FQNTZTYHVBTWCB-UHFFFAOYSA-N	431.514	1.491	50	20	IDGD	
COc1cc(C(=O)NCC(=O)NNc2nc(-c3cccnc3)no2)cc(OC)c1OC	728076333	ZCXQNULPAKDZIW-UHFFFAOYSA-N	428.405	1.031	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)Nc2cccc(C(=O)NCCC(N)=O)c2)c1C	728491782	BCNXMUUWCBYADH-UNOMPAQXSA-N	437.500	1.902	50	20	IDGD	
CCOC(=O)C1=NN(c2ccccc2)[C@H](C(=O)OCC(=O)NNC(=O)c2cccs2)C1	728635239	RDRNJHICMICAKS-HNNXBMFYSA-N	444.469	1.250	50	20	IDGD	
C[C@H]1C[C@@H](C)CN(S(=O)(=O)c2cccc(C(=O)NNC(=O)Cc3cccnc3)c2)C1	728852230	UVUIXZHKSGTTRU-IYBDPMFKSA-N	430.530	1.752	50	20	IDGD	
Cc1ncsc1CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	729615723	CLKYUHOPHSQNHJ-UHFFFAOYSA-N	437.547	1.770	50	20	IDGD	
COC(=O)c1ccc(C(F)(F)F)cc1S(=O)(=O)NNC(=O)c1cccc(OC)c1O	730203269	LSJWUJQAOVOYAA-UHFFFAOYSA-N	448.375	1.830	50	20	IDGD	
CC/C=C(\C)C(=O)N1CSC[C@H]1C(=O)OCC(=O)NNC(=O)c1cccc(Cl)c1	730318755	BTJQOVNZFIBZOY-LYOQKUPSSA-N	439.921	1.902	50	20	IDGD	
O=C(Oc1ccc(C=NNC(=O)[C@@H]2CCS(=O)(=O)C2)cc1)c1cccc([N+](=O)[O-])c1	730577921	MIFGMHQPYIGTKW-OAHLLOKOSA-N	431.426	1.699	50	20	IDGD	
CC(C)C[C@H](/N=C1/NS(=O)(=O)c2ccccc21)C(=O)NNC(=O)Cc1ccccc1F	731344749	GVTNUAAPUCCUDC-KRWDZBQOSA-N	446.504	1.669	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2cccc3ncccc23)nnn1-c1ccc2c(c1)OCCO2	731474935	GZYKIGBDUNJDEW-UHFFFAOYSA-N	430.424	1.970	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)NCc1ccccc1S(=O)(=O)NC(C)(C)C	731497999	IYLXCKIZIAIFOP-UHFFFAOYSA-N	434.518	1.916	50	20	IDGD	
Cc1cccc(-c2nnc(S)n2CC(=O)NNC(=O)CCN2C[C@H](C)O[C@@H](C)C2)c1	732260904	JAHCIIINKWUTDG-GJZGRUSLSA-N	432.550	1.189	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(Cl)c(C(=O)NNc2ccccc2S(C)(=O)=O)c1	732306032	VHMMWGKDDKZCLY-UHFFFAOYSA-N	431.923	1.751	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCCc2ccc(F)cc2F)cc1	732703021	JQLXERDQXPBZKB-UHFFFAOYSA-N	440.472	1.467	50	20	IDGD	
Cn1c(NNC(=O)c2ccc3c(c2)C(=O)N(C[C@@H]2CCCO2)C3=O)nc2ccccc2c1=O	733260564	HREQLPBMXNXPMG-AWEZNQCLSA-N	447.451	1.465	50	20	IDGD	
C[C@@]1(NNC(=O)N[C@@H]2CCN(c3ccc(C(F)(F)F)cc3)C2=O)CCS(=O)(=O)C1	733851463	ZNUBBGQESIDRNW-CZUORRHYSA-N	434.440	1.192	50	20	IDGD	
Cc1nc(COc2ccc(C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)cc2)no1	734242231	XXYMWAOWIAICCV-UHFFFAOYSA-N	434.453	1.426	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)N2CCC(C(=O)NNc3cc(C)ncn3)CC2)o1	734254338	QXDLJLMIAYLBPE-UHFFFAOYSA-N	437.478	1.099	50	20	IDGD	
Cc1cc(NNC(=O)[C@@H](NS(=O)(=O)c2ccc(Br)cc2)C(C)C)ncn1	734254560	PRJSXOCMUTWVNY-HNNXBMFYSA-N	442.339	1.994	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2cccc(C(=O)NNc3nccnc3Cl)c2)C[C@H](C)O1	734261072	OTHUQJXVTVFQEC-RYUDHWBXSA-N	425.898	1.685	50	20	IDGD	
Cc1sc(=O)n(CCC(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)c1C	734824950	OKLUQSCJQNKGAM-UHFFFAOYSA-N	441.554	1.647	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)c2cccnc2N2CCOCC2)CC1	734826079	WFHWYKPIHUGWSE-UHFFFAOYSA-N	448.524	1.262	50	20	IDGD	
C[C@@H](CN1CCN(c2ccccn2)CC1)NC(=O)NNC(=O)COc1ccc(F)cc1	735587167	SOKSAYHXIDCGIU-INIZCTEOSA-N	430.484	1.141	50	20	IDGD	
Cc1c(NC(=O)CSCC(=O)NNc2cccnn2)c(=O)n(-c2ccccc2)n1C	736702127	BULPQVPADPIHEM-UHFFFAOYSA-N	427.490	1.089	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)NCc1ccc(CN2CCC(O)CC2)cc1	738497020	IPCQDTDTYNTLBW-UHFFFAOYSA-N	426.517	1.691	50	20	IDGD	
Cn1nc(C(=O)NN=Cc2c(N3CCOCC3)nc3ccccn23)c2ccccc2c1=O	741805385	PTGZUUNUMKAZIQ-UHFFFAOYSA-N	431.456	1.182	50	20	IDGD	
C[C@@H](OC(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccccc1)C(=O)N1CCNC1=O	741818874	HCTWOBVDSSINRZ-UHVIJJLKSA-N	432.440	1.854	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Cc2ccccc2F)cc(NS(C)(=O)=O)c1OC	742652907	FLRKTEYHSRZWKW-UHFFFAOYSA-N	425.438	1.218	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NCCN2CCc3ccccc3C2)cc1	743521941	WSMIHJIBVISNRH-UHFFFAOYSA-N	431.518	1.484	50	20	IDGD	
NC(=O)[C@@H]1CCCN(CCCNC(=O)NNC(=O)Nc2ccc(OC(F)F)cc2)C1	743594928	XTKFAHXPYNIBBL-GFCCVEGCSA-N	428.440	1.211	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)c2ccc(S(=O)(=O)NCCC#N)cc2)cc1	743828634	WSAJSJVIURCJKQ-UHFFFAOYSA-N	430.490	1.411	50	20	IDGD	
CCCCN1C(=O)CC[C@H](C(=O)NNC(=O)C(=O)NC(C)C)[C@H]1c1ccc(OC)cc1	744447098	XGBRQTGQOPFGFF-PKOBYXMFSA-N	432.521	1.447	50	20	IDGD	
CC(C)Cn1nc(C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)c2ccccc2c1=O	744560541	NUVBHOLOBTZFHK-UHFFFAOYSA-N	447.451	1.542	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)N[C@@H]2C[C@H](C)N(c3ccccc3)C2=O)nc1	745882502	OYMMTINSHUYFIR-WMLDXEAASA-N	446.533	1.588	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)Oc1ccc(F)cc1	745892106	MIUDIKLNIAQRBO-ZDUSSCGKSA-N	438.481	1.488	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)c1cccc(-n2cccn2)c1	745930175	BCVKTHFZANPPMB-AWEZNQCLSA-N	427.486	1.981	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)N(C)CC(=O)NNc2oc(C(C)C)nc2C#N)cc1	746335988	YXVBDPXPGSZEDZ-UHFFFAOYSA-N	434.478	1.392	50	20	IDGD	
C[C@@]12CCC(=O)N1c1ccccc1C(=O)N2CC(=O)NNC(=O)NCCc1cccs1	746591644	JGDMFANDGAMVNB-NRFANRHFSA-N	441.513	1.620	50	20	IDGD	
CC[C@@H](NC(=O)NNC(=O)Cc1cn2ccccc2n1)c1cccc(S(N)(=O)=O)c1	746758741	JQLUQKBVFIORFZ-MRXNPFEDSA-N	430.490	1.006	50	20	IDGD	
CCOC(=O)C1CCN(C(=O)CN(C)C(=O)NNC(=O)c2cc3ccccc3o2)CC1	750288467	JLVDKCXJMVIMRI-UHFFFAOYSA-N	430.461	1.521	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)NNC(=O)c2ccc(OC(C)C)c(OC)c2)c(C)o1	751299800	NYCJAWOFLUGWRA-UHFFFAOYSA-N	425.463	1.367	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)c1ccc(CS(=O)(=O)C(F)F)cc1	751459460	GPRRXHYSRUADID-UHFFFAOYSA-N	426.397	1.670	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)c2cc(Cn3cc(Br)cn3)on2)cc1	752611407	MFVLLUODFCIKFK-UHFFFAOYSA-N	449.265	1.564	50	20	IDGD	
N#Cc1ccc(CN2CC[C@H](NC(=O)NNC(=O)c3cccc(OC(F)F)c3)C2=O)cc1	753131329	RRLUBHQTOUKPEZ-KRWDZBQOSA-N	443.410	1.905	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)CN(C(=O)OC(C)(C)C)C2CC2)c1	753388300	LBDXOWBLGGOPIV-UHFFFAOYSA-N	440.522	1.097	50	20	IDGD	
C[S@@](=O)c1ccc(NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1F	756770768	NNHYEQSJTSBIHE-WJOKGBTCSA-N	447.536	1.928	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc(Br)cc1)NN=c1cc[nH]cc1Cl	757420034	HNEUHTNGXSHTAK-UHFFFAOYSA-N	433.715	1.731	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)Nc1cccc2c1CCN2S(C)(=O)=O	758296600	ROQJONPCNAFIBO-GFCCVEGCSA-N	436.465	1.768	50	20	IDGD	
COCCS(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2cccc(N(C)C)c2)cc1	759260419	OYOYRCCSQRFBII-UHFFFAOYSA-N	434.518	1.317	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)Cn1nnc(-c2ccc(Cl)cc2)n1	762401090	CAAWEUUQFQTNNK-UHFFFAOYSA-N	432.893	1.942	50	20	IDGD	
Cc1cc(C)cc(C(=O)N2CCC[C@H](C(=O)NNc3nccc(N4CCOCC4)n3)C2)c1	762856904	ZCUQZMKKGZCVJQ-SFHVURJKSA-N	438.532	1.926	50	20	IDGD	
C[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	763132881	MOIPFOLXWJRETD-CJNGLKHVSA-N	444.496	1.252	50	20	IDGD	
COc1ccccc1OC[C@H](C)CNC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	763460466	JLYOMIHUIMDTRU-CQSZACIVSA-N	425.449	1.330	50	20	IDGD	
Cc1ccc(NC(=O)C2CC2)cc1NC(=O)C(=O)NNC(=O)c1c(C)nc2ccccn12	763630061	VNJVJCOUCPXEFM-UHFFFAOYSA-N	434.456	1.699	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)cc1Br	763681634	LXWUEYTWIYCTQB-UHFFFAOYSA-N	431.246	1.794	50	20	IDGD	
Cc1cc(C(=O)N2CCCC2)ccc1NC(=O)C(=O)NNC(=O)COc1ccc(C#N)cc1	763682560	WFZQMYMGCQPERO-UHFFFAOYSA-N	449.467	1.268	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(OC[C@@H]3CCCO3)cc2)c1	763753053	DLLUOYZTEZGTFI-IBGZPJMESA-N	426.473	1.710	50	20	IDGD	
Cc1cc(C(=O)NC(C)C)ccc1NC(=O)C(=O)NNC(=O)COc1ccccc1C#N	763807448	BYHYQOUUSKAHOG-UHFFFAOYSA-N	437.456	1.170	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccc(NC(=O)[C@@H]2CCCO2)cc1	763843742	UCKDNLYJOFSDRT-KRWDZBQOSA-N	444.419	1.108	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)N(C)CC3)cc1	763860429	GXGDJCJVGDURSI-AWEZNQCLSA-N	426.473	1.631	50	20	IDGD	
COC(=O)Cc1ccccc1NC(=O)C(=O)NNC(=O)CCSc1ccc(F)cc1	763894917	GLPORWIYJZIWKJ-UHFFFAOYSA-N	433.461	1.810	50	20	IDGD	
COC(=O)c1cc(Cl)ccc1NC(=O)C(=O)NNC(=O)c1cc(Br)c[nH]1	763995840	AIKUPAIFEFULJT-UHFFFAOYSA-N	443.641	1.617	50	20	IDGD	
Cn1nc(C2CCCCC2)cc1NC(=O)C(=O)NNC(=O)c1ccc2c(c1)OCCO2	764003282	FBJPTJQMXVITBC-UHFFFAOYSA-N	427.461	1.639	50	20	IDGD	
O=C(NNC(=O)C1CCCC1)C(=O)Nc1cnc(Br)c(Br)c1	764069576	XUDMWFBBFYIVDY-UHFFFAOYSA-N	434.088	1.883	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccccc2CN2CCSCC2)c(O)c1	764105176	LJUHAGYVNDATGC-UHFFFAOYSA-N	428.514	1.649	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(OCC3CCOCC3)cc2)c(O)c1	764108588	BKELLOULJNZVDS-UHFFFAOYSA-N	427.457	1.906	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)N3CCCC3)cc2C)c1O	764130139	BWVDYHBLVZRHRW-UHFFFAOYSA-N	440.456	1.345	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1cccc(C#Cc2ccccn2)c1	764130957	BRYMXODHFAMOGZ-UHFFFAOYSA-N	428.448	1.819	50	20	IDGD	
CCCN1CCN(c2ccc(NC(=O)C(=O)NNC(=O)c3ccoc3)cc2Cl)CC1	764160543	URTWVDPOOAYXOC-UHFFFAOYSA-N	433.896	1.865	50	20	IDGD	
Cc1nc(COc2ccc(NC(=O)C(=O)NNC(=O)[C@@H]3Cc4ccccc4O3)cc2)no1	764168520	QHOROWIVHKYYAM-KRWDZBQOSA-N	437.412	1.047	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)C(=O)Nc1ccnn1Cc1ccc(C(F)(F)F)cc1	764298125	OATNMPJSPBHZKC-UHFFFAOYSA-N	435.366	1.381	50	20	IDGD	
NC(=O)[C@H]1CC(C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)=NN1c1ccccc1	764329034	FHXJBRMCCSYKIC-QGZVFWFLSA-N	442.426	1.420	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C(=O)Nc1ccnn1C1CCN(CC)CC1)c1ccccc1	764331941	KHJINOPFBMXKJV-SFHVURJKSA-N	426.521	1.820	50	20	IDGD	
Cn1ccnc1C(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)cc1	764345732	JOMIEDXHPLOLDU-UHFFFAOYSA-N	441.831	1.410	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1	764398044	CBCMNMRMBMTLTN-ZDUSSCGKSA-N	444.419	1.627	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1ccc(OC)c(OC)c1OC	764398242	QHGCGUISYXAMAN-UHFFFAOYSA-N	449.485	1.599	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](OCC(=O)OCC(=O)NNC(=O)c2ccccc2)C1	768066392	VLQQAGWVVUNJMZ-MRXNPFEDSA-N	435.477	1.407	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c2ncccc12	768236373	BDUANRSXGRRUDI-UHFFFAOYSA-N	446.427	1.009	50	20	IDGD	
CCCCn1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c(C)n1	770208614	KRZDITQLSOBMBK-UHFFFAOYSA-N	433.534	1.851	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)NCc1cccc(S(N)(=O)=O)c1	770245881	OKHWDSJRUVMJQQ-NSHDSACASA-N	426.882	1.285	50	20	IDGD	
COC[C@H](C)NS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2c(C)cccc2F)cc1	770815903	UXBSAHKIWVHIHC-ZDUSSCGKSA-N	438.481	1.529	50	20	IDGD	
Cc1nnc(SCC(=O)NNc2nc(O)c3cnn(C)c3n2)n1Cc1ccccc1	770974574	XKIFGBGORLETQN-UHFFFAOYSA-N	425.478	1.253	50	20	IDGD	
CCOC(=O)N1[C@H](c2ccc(C)o2)CC[C@@H]1C(=O)NNc1nc(O)c2cnn(C)c2n1	770982978	KGGZNYQYLGWOQC-QWHCGFSZSA-N	429.437	1.776	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)NNc2nc(O)c3cnn(C)c3n2)c(C)n1C[C@@H]1CCCO1	770990168	MCLVLCCQXMPVJV-YMDFIQGPSA-N	436.476	1.717	50	20	IDGD	
Cc1ccc(S(=O)(=O)C2(C(=O)NNc3nc(O)c4cnn(C)c4n3)CCCC2)cc1	770991561	SXFZPANFDRBBIE-UHFFFAOYSA-N	430.490	1.607	50	20	IDGD	
CSc1nc2nc(C)c(CC(=O)NNC(=O)CNc3ccc(C)cc3C)c(C)n2n1	771522967	BUIJBLNJCFNVKY-UHFFFAOYSA-N	427.534	1.882	50	20	IDGD	
C[C@@H](NC(=O)c1ccc(Cl)cc1)C(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772202123	YQLRWUPLZJSHCW-LLVKDONJSA-N	437.283	1.576	50	20	IDGD	
O=C(NNC(=O)c1cc(Cl)ccc1O)Nc1cnn(Cc2nnc3n2CCCC3)c1	772636962	YRPSEWQSRXHIME-UHFFFAOYSA-N	430.856	1.685	50	20	IDGD	
Cc1cc(S(N)(=O)=O)cc(C(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)c1C	772993576	CQLMZWVTTGGWSZ-LBPRGKRZSA-N	425.894	1.833	50	20	IDGD	
CC[C@@H](C)NS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cncc(NC(C)=O)c2)cc1	773069578	FZLPZLXZCBRJPV-GFCCVEGCSA-N	433.490	1.192	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(NC(=O)C(=O)NNc2cccc(C#N)c2)ccc1C	773688590	MHQWSBCOCIOGTO-UHFFFAOYSA-N	429.502	1.979	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2ccc(C(=O)N(C)C3CCCCC3)cc2)n1	773724451	RMEYLKQZGVNLQP-UHFFFAOYSA-N	426.477	1.972	50	20	IDGD	
CSCC[C@H](C(=O)NNc1cc(Cl)nc(N)n1)N1C(=O)[C@H]2CCCC[C@@H]2C1=O	773860931	KBEBFYWBUIQTML-GARJFASQSA-N	426.930	1.452	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(S(=O)(=O)NC3CC3)c2C)cc1F	773889173	NGSFKWVEOPNMKM-UHFFFAOYSA-N	448.476	1.283	50	20	IDGD	
Cc1cccc(F)c1S(=O)(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	775252748	STYJTWUFKFMCGI-UHFFFAOYSA-N	441.506	1.542	50	20	IDGD	
COCCN1C(=O)c2ccc(C(=O)NNc3ncc(Cl)cc3Cl)cc2S1(=O)=O	775269766	QKCCKILLIISWTB-UHFFFAOYSA-N	445.284	1.936	50	20	IDGD	
C[C@H](NC(=O)c1ccc(Br)s1)C(=O)NNC(=O)CNC(=O)OC(C)(C)C	778443396	PJYMJLJDXGSITB-QMMMGPOBSA-N	449.327	1.301	50	20	IDGD	
O=C(CNC(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1)NCC1CC1	778642426	NCCMBZXVUQJFTQ-OAQYLSRUSA-N	435.528	1.470	50	20	IDGD	
CC(C)(C)OC(=O)N1CC=C(CNC(=O)NNC(=O)Cc2cn3ccccc3n2)CC1	779679899	HIBRYWIQXPEDAV-UHFFFAOYSA-N	428.493	1.774	50	20	IDGD	
Cc1c(C(=O)N([C@H]2CCS(=O)(=O)C2)N(C)C)nnn1Cc1ccc(C(F)(F)F)cc1	782005628	BTXVYBSCHZSSCV-HNNXBMFYSA-N	445.467	1.760	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2cccc(NC(=O)c3cccs3)c2)CCS(=O)(=O)C1	783424591	FQXXECGOWPUGDA-SFHVURJKSA-N	436.515	1.137	50	20	IDGD	
N#Cc1ccccc1Oc1ccc(NC(=O)C(=O)NNC(=O)CNC(=O)c2ccco2)cc1	784002434	FQSAWLSOSRFKAN-UHFFFAOYSA-N	447.407	1.459	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NC[C@H]2CCCCS2(=O)=O)cc1Br	784319670	MPGQQZLSLREJBX-LLVKDONJSA-N	434.312	1.369	50	20	IDGD	
COc1cccc(NNC(=O)C(=O)Nc2cccc(NC(=O)CN3CCCCCC3)c2)n1	784851441	ASSUHSZMVIOUBI-UHFFFAOYSA-N	440.504	1.987	50	20	IDGD	
O=C(NNc1cc(F)c(F)c(F)c1)C(=O)Nc1ccc(N2CCCS2(=O)=O)cc1	785083449	NFXGOTUQINIGOP-UHFFFAOYSA-N	428.392	1.726	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2cc(F)c(F)c(F)c2)cc1	785086701	GWWHXLMENIJBTB-UHFFFAOYSA-N	430.408	1.872	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1OC(C)C	787542637	CGRMFKAXXXSMGF-UHFFFAOYSA-N	433.486	1.585	50	20	IDGD	
CC(C)CN1C[C@@H]2CN(C(=O)NNC(=O)c3cnn(-c4ccccc4)c3)CCN2C1=O	787865309	XJWYNDUNRYAXSB-SFHVURJKSA-N	425.493	1.305	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cc(-n3cccn3)ccc2C)cc1	789584568	NXQPOLVPTUTHKT-INIZCTEOSA-N	449.467	1.937	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)[C@H]2COCCN2C2CCCC2)c2ccccc2c1=O	790065136	JTVZFFUCWIMFLI-GOSISDBHSA-N	427.505	1.382	50	20	IDGD	
O=C(NNS(=O)(=O)c1cccc(S(=O)(=O)N2CCCCCC2)c1)C1CCCC1	790394313	PKLMDOOTOHJTBV-UHFFFAOYSA-N	429.564	1.751	50	20	IDGD	
COc1nccnc1NNC(=O)C12CCC(C(=O)NNc3nccnc3OC)(CC1)CC2	790931138	KPZMCYPHVVNQIY-UHFFFAOYSA-N	442.480	1.211	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)CCc2cnc3ccccc3c2)ccc1Cl	792016500	RAOWNQVDHKBNRR-UHFFFAOYSA-N	432.889	1.929	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)N[C@H](C)CCC(=O)OC(C)C	792303556	NKADLHPFRVDYKO-GFCCVEGCSA-N	427.527	1.352	50	20	IDGD	
COC(=O)c1ccc(N2CCCC2)c(NC(=O)C(=O)NNc2ccc3c(=O)[nH]ccc3c2)c1	793069114	FZIIUONZSBPHEL-UHFFFAOYSA-N	449.467	1.997	50	20	IDGD	
Cc1ccc2c(c1)CC[C@@H](C(=O)NNC(=O)CN1CCN(C(=O)c3ccccc3)CC1)O2	793682388	MYCSFANYLYMIBQ-NRFANRHFSA-N	436.512	1.294	50	20	IDGD	
CSCCNC(=S)NNC(=O)c1cccc(NN2C(=O)[C@@H]3CC=CC[C@H]3C2=O)c1	793764047	FWDWYDYZSMEOFV-HUUCEWRRSA-N	433.559	1.437	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)[C@@H](C)N2C(=O)c3ccc(Br)cc3C2=O)n1	794076015	KYZJBFXLLMREKS-SNVBAGLBSA-N	431.246	1.598	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)N2CCC(=NNC(=O)c3ccc(O)c(O)c3)CC2)cc1	794551313	OTUURRPXFMFKRQ-UHFFFAOYSA-N	446.485	1.627	50	20	IDGD	
Cc1c(I)cc([N+](=O)[O-])cc1C(=O)NNC(=O)c1cccn1C	800805805	CTKWLFPSMQQDLG-UHFFFAOYSA-N	428.186	1.921	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=O)Nc2ccccc2)c1	801986085	WTVXMKPIDXFVOD-UHFFFAOYSA-N	426.882	1.731	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)[C@](C)(O)Cn2ccc(C)cc2=O)c(OC)cc1Cl	802082925	RVWABNGOSHEFIS-LJQANCHMSA-N	438.868	1.431	50	20	IDGD	
COc1ccc(S(C)(=O)=O)cc1S(=O)(=O)NNC(=O)C(C)(C)c1ccccc1	802721733	CAZHVAHWDALPHK-UHFFFAOYSA-N	426.516	1.386	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)[C@]1(C(F)(F)F)CCN(C(=O)OC(C)(C)C)C1	805649196	NRXBJAXNSXBYBM-HWPZZCPQSA-N	425.404	1.665	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)[C@@H](c1cnn(C)c1)N(C)C(=O)OC(C)(C)C	806558554	GERGZMQWQUBUSR-GOSISDBHSA-N	431.493	1.727	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)C(=O)Nc1cc(F)c(Br)c(Cl)c1	806979097	MSEKOUPXGTXNNI-UHFFFAOYSA-N	429.633	1.965	50	20	IDGD	
COCCOc1ccc(S(C)(=O)=O)cc1NC(=O)C(=O)NNc1cc(C)ccc1C	806997933	ZESIDRKCQZJMSN-UHFFFAOYSA-N	435.502	1.814	50	20	IDGD	
CCC(C)(C)[C@H]1CCc2nc(NC(=O)C(=O)NN[C@@]3(C)CCS(=O)(=O)C3)sc2C1	807001174	RTALZCIMVLHHJF-BUXKBTBVSA-N	442.607	1.821	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)[C@@H](NC(=O)c1ccccc1)c1ccccc1	807081665	GGRNBWUPDMOBHV-FQEVSTJZSA-N	431.452	1.130	50	20	IDGD	
O=C(NNc1ncccc1F)C(=O)Nc1ncn(Cc2cccc(Br)c2)n1	807300782	VHXRFCFJWZKABD-UHFFFAOYSA-N	434.229	1.705	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)cc2[nH]ccc12	808934668	PUTDWVCPWQVCFS-UHFFFAOYSA-N	430.804	1.713	50	20	IDGD	
COCC1(C(=O)NNC(=O)c2cccc(OC)c2O)CCN(C(=O)OC(C)(C)C)CC1	810191349	XMRGILHOWAQGOV-UHFFFAOYSA-N	437.493	1.826	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)c2ccc3c(=O)n(C)c(S)nc3c2)cc1	812730020	YEZUUQGNUTWDPL-UHFFFAOYSA-N	433.515	1.229	50	20	IDGD	
CNS(=O)(=O)c1cccc(NC(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)c1C	812955145	NHKKCEOZRSVSAR-UHFFFAOYSA-N	441.535	1.302	50	20	IDGD	
COC(=O)c1cn(-c2cccc(NC(=O)C(=O)NNc3ccc(C(F)(F)F)cn3)c2)nn1	812981431	ZFEZBOZOBQEUHN-UHFFFAOYSA-N	449.349	1.550	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN1C(=O)Nc1ccccc1)C1CCN(c2ncccn2)CC1	813440460	OBERQFCWRNWOGD-SFHVURJKSA-N	437.504	1.537	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCC(CC)(CC)OC)c1	813872957	MGFQQQCOHBAQAH-UHFFFAOYSA-N	428.555	1.866	50	20	IDGD	
CN(C)c1cc(C#N)cc(C(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)c1	814410931	HCBLUVZKMWJRPV-UHFFFAOYSA-N	430.509	1.968	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)Cc2ccc(C(=O)NN=C3COCCOC3)cc2)cc1	814702236	OFVSZSHIYVWFHK-UHFFFAOYSA-N	431.514	1.948	50	20	IDGD	
COCc1cc(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3n2)cc(C(=O)OC)c1	815563787	NXNIMOIBJIMSJA-UHFFFAOYSA-N	436.424	1.568	50	20	IDGD	
Cc1cc(C)c(NC(=O)C(=O)NNC(=O)[C@H]2CCc3nncn3C2)cc1Br	815691781	BDKXZXIUXYXLPF-NSHDSACASA-N	435.282	1.006	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)c1ccc(-n2cccn2)nc1	874341851	DYGVHUXBYOEYDY-UHFFFAOYSA-N	440.485	1.127	50	20	IDGD	
Cc1c(/C=C(\C#N)C(=O)N2CCN(S(=O)(=O)Cc3ccccc3)CC2)cc(C#N)n1C	900039084	PTHBYNOPFPDGCQ-UDWIEESQSA-N	437.525	1.786	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccccc2)cc1	914775437	BVLHFAONJLNPER-HNNXBMFYSA-N	435.502	1.321	50	20	IDGD	
O=C(COC(=O)c1ccc2c(c1)CCCC(=O)N2)NNC(=O)c1ccc([N+](=O)[O-])cc1	915436860	RDRRDXRHXBQFCH-UHFFFAOYSA-N	426.385	1.488	50	20	IDGD	
Cc1nc2ccccc2n1CCCNC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	915906659	CUSMXGNZTYGCRH-UHFFFAOYSA-N	429.502	1.783	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)NCCCOC[C@@H]1CCCO1	916209395	KOBRPBOXLVGYDX-HNNXBMFYSA-N	430.299	1.744	50	20	IDGD	
CCOc1ccc(C=NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1OC	916258574	FYMBYFIENRNQEL-UHFFFAOYSA-N	447.513	1.879	50	20	IDGD	
CCS(=O)(=O)N1CCC(NC(=O)NNC(=O)CSc2ccc(Cl)cc2)CC1	916260399	ZNMBHJIBDOFROK-UHFFFAOYSA-N	434.971	1.577	50	20	IDGD	
O=C(NCCN1CCN(c2ccccc2)CC1)NNC(=O)c1ccc2c(c1)OCCO2	916514858	QKUXLJUGFXTSRH-UHFFFAOYSA-N	425.489	1.224	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)NCc1ccc(S(=O)(=O)N(C)C)cc1	916646585	BEVPXXXOHUGCKU-UHFFFAOYSA-N	430.490	1.037	50	20	IDGD	
COCCN1C(=O)c2ccc(C(=O)NNC(=O)c3c[nH]c4ccccc34)cc2S1(=O)=O	916745740	KREHGMAOLGLQAP-UHFFFAOYSA-N	442.453	1.034	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CSc2nc3nc(C)c(C)c(C)n3n2)cc1OC	917251546	ZTWATYDJRITOAF-UHFFFAOYSA-N	430.490	1.620	50	20	IDGD	
O=C(NNS(=O)(=O)c1cccc(S(=O)(=O)NC2CC2)c1)c1ccc2ccccc2c1	917749112	IIPHTSLMCLXDHY-UHFFFAOYSA-N	445.522	1.904	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)NC[C@@H]3CCCO3)c2)c(O)c1	918337316	HPTOGTFVJJZAHX-HNNXBMFYSA-N	433.486	1.233	50	20	IDGD	
COc1cc(CNC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)ccc1C	919791368	MDLYKNNBEFZDQH-UHFFFAOYSA-N	446.529	1.932	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)C(=O)c2ccc3c(c2)CCC3)cc1	920414873	OPEWQYKEAJKTJP-UHFFFAOYSA-N	429.498	1.135	50	20	IDGD	
N#C/C(=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)NCC(=O)NC1CC1	920848827	HWKGIXMFFWZPCC-ZROIWOOFSA-N	440.891	1.381	50	20	IDGD	
N#C/C(=C/c1cn(CCC(N)=O)nc1-c1ccc(Br)cc1)C(=O)NCCCO	920852935	BIZASXRQGNGQBW-UVTDQMKNSA-N	446.305	1.594	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@@H](C(C)C)N1C[C@H](C)O[C@H](C)C1	921202943	MEKJZGQOTKFVID-IJEWVQPXSA-N	439.582	1.183	50	20	IDGD	
Cc1ccc([N+](=O)[O-])cc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	921277512	RNHCORAYVRYIHZ-UHFFFAOYSA-N	432.458	1.763	50	20	IDGD	
CC(=O)NCC(=O)N1CCc2cc(C(=O)NNc3cncc(Br)c3)ccc21	1116395472	LLGIQTDJNLZLTQ-UHFFFAOYSA-N	432.278	1.626	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)[C@@H]2CC23CCS(=O)(=O)CC3)c(OC)cc1Cl	1116936102	BIPKIYHAIKAKLT-JTQLQIEISA-N	431.898	1.725	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)COc1ccc(Cl)cc1Br	1253070715	AUESHFULZSWPDV-UHFFFAOYSA-N	441.669	1.454	50	20	IDGD	
COC(=O)[C@H](NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1)c1ccccc1Cl	1322960741	AGTZGFOUHJNXFJ-GOSISDBHSA-N	439.921	1.804	50	20	IDGD	
Cc1ccn2c(=O)c(C(=O)N3CC[C@]4(C3)CN(C(=O)C(C)(C)CCl)CCO4)cnc2c1	1777993853	DDLJBDBKOCOBGH-QFIPXVFZSA-N	446.935	1.711	50	20	IDGD	
O=C(c1cn2ccsc2n1)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1778628505	HNDUZAOEROVTNW-XHDPSFHLSA-N	431.287	1.530	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(CCN(C(=O)CS[C@H]3CCCCO3)C2)C1	1779084559	QGSCZNXKXQYBGW-RBUKOAKNSA-N	430.643	1.928	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccncc2O)C1	1779619047	BQKWSJSCGHWPEC-CDHAZOANSA-N	426.311	1.698	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(Cl)ncn3)C2)C1	1779819350	XOGIVGWVFZGSCF-BDJLRTHQSA-N	431.718	1.747	50	20	IDGD	
C[C@]1(C(=O)N2CC[C@@]3(CN(C(=O)/C(C#N)=C/c4ccc(F)cc4F)CCO3)C2)CCCN1	1781143781	WYAOUVOKZXCXLU-RRBHZOCGSA-N	444.482	1.844	50	20	IDGD	
C=C(CC(=O)OCC)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](C)CBr)CCO2	1781264268	RKEIVTSGQUXPKO-KDOFPFPSSA-N	431.327	1.357	50	20	IDGD	
Cn1ncc2cc(C(=O)N3CCO[C@]4(CCN(C(=O)[C@@H](F)Br)C4)C3)ccc21	1781330168	RXALJFRNVATPRH-QAPCUYQASA-N	439.285	1.707	50	20	IDGD	
O=C(c1ccc(O)c([N+](=O)[O-])c1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1781539965	DLAAXAVPAHMVEY-CZUORRHYSA-N	446.229	1.434	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(C=O)s1)C2	1782170329	IKQTWHLUTKACSE-ZSZQSSIHSA-N	428.938	1.942	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)COCc1ccccc1)C2	1782170611	SNBWPWGBMGYFIY-NNMXDRDESA-N	438.952	1.971	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc([N+](=O)[O-])o3)CCO2)C1	1783338203	DUNLSKJERBOLPB-BZNIZROVSA-N	430.255	1.805	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc([N+](=O)[O-])[nH]3)CCO2)C1	1783351136	FNKMRWXQDYLJEO-BZNIZROVSA-N	429.271	1.540	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)Cc3c(C)n[nH]c3C)CCO2)C1	1783351458	AVNNNKNHYHRPJZ-YJBOKZPZSA-N	427.343	1.572	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccn4ccnc4c3)C[C@@H]21	1783967933	ZKAMHBYSDDLOET-IWCQGFGOSA-N	449.349	1.959	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3C[C@@H]3c3ccc(F)c(F)c3)C[C@@H]21)[C@H](O)CCl	1784084460	SRRPSNJGWRAGDK-ACIZPKGOSA-N	442.890	1.648	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCBr)[C@H]3C2)cc(O)n1	1786405837	DURGKKKQDXOBSM-QEJZJMRPSA-N	426.311	1.474	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(-c4ccco4)no3)[C@H]2C1	1787284663	IZBYIJLTJHPICL-FLTUCWPJSA-N	437.880	1.782	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]3C2)C1	1787447353	ULKRVDKQDRLJFD-MXAVVETBSA-N	433.908	1.367	50	20	IDGD	
Cc1ccc(COCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](O)CCl)C[C@@H]32)cc1C	1787530065	KGDBOHSKRHHSGR-HAGHYFMRSA-N	438.952	1.399	50	20	IDGD	
CN[C@@H](CC(=O)Nc1ccc(C2(NC(=O)CCBr)CCC2)cc1)C(=O)O	1788060750	DEMLDZSPCNJUIR-AWEZNQCLSA-N	426.311	1.968	50	20	IDGD	
Cc1nccnc1C(=O)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1	1788142130	CXXCZQKNBZVHJF-UHFFFAOYSA-N	430.273	1.526	50	20	IDGD	
N#Cc1c[nH]c(C(=O)NC2(c3ccc(NC(=O)c4ccc(B(O)O)cc4)cc3)CCC2)c1	1788144563	OFNSWFGYQNFDJK-UHFFFAOYSA-N	428.257	1.628	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4cccn4cn3)C[C@@H]21	1788762622	IOOUWPZTZYOQMT-IEZWGBDMSA-N	430.581	1.779	50	20	IDGD	
Cc1nc2ncccn2c1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]2C1	1788762731	QHTNVKCMIYSMBE-ULQDDVLXSA-N	445.596	1.483	50	20	IDGD	
CN(C)c1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]32)cn1	1789027372	RCIINKMMDUTNCJ-ULMVMLMRSA-N	443.375	1.977	50	20	IDGD	
COc1cc(OC)c(F)c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Cl)C[C@@H]32)c1	1789236342	LJVSHKADTRNKSL-CDUAKIRFSA-N	432.851	1.971	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]3C2)cn1	1789921616	RVTGVRGDRRDPAV-PWNZVWSESA-N	430.274	1.374	50	20	IDGD	
COc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]3C2)ccn1	1789924387	AYVKCUMSZQZBHL-PWNZVWSESA-N	430.274	1.374	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]3C2)nc1	1791057110	CJQWGHMGFPOKLH-DSPQJCBJSA-N	426.311	1.467	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)Nc3nccs3)C[C@@H]21	1791254417	MIGLSYVHDPIUCI-YTFOTSKYSA-N	430.958	1.177	50	20	IDGD	
CC(C)N1CCC[C@H]1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21	1791810413	NNGKIUIZKVWHFO-QXKUPLGCSA-N	434.350	1.529	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)c1cc(F)ccc1Br	1792687200	LKAAFMUASJQCGC-ANGCBRKESA-N	449.704	1.391	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](NC(=O)OC)c1ccccc1	1792802950	AGDQUOBPMJPWGJ-CWQOZTLDSA-N	437.924	1.691	50	20	IDGD	
C[C@H](Oc1ccccn1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)CBr	1792873106	LWJAADFXWXQRGG-JGFGOLAASA-N	440.338	1.470	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CCCCN1Cc1ccccc1)C2)[C@@H](O)CCl	1792978558	GFDSTUFEJGQTQS-SSTJLMRISA-N	449.979	1.230	50	20	IDGD	
CCS(=O)(=O)N[C@H](C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@](C)(Cl)CCl)C2	1793535773	DHSVQLZZNWOGSB-GUYIQFIESA-N	428.382	1.189	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C=C/c1ccco1	1794141395	AXBDJHCMZXHHKB-NNBMIFGRSA-N	439.472	1.016	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccnc(C(F)(F)F)c1)c1cccc(B(O)O)c1	1794883716	CIPMCGQZPJCGPP-BJWYYQGGSA-N	447.222	1.346	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ncccn1	1795187250	MFTLYNJREXDTKS-XGUBFFRZSA-N	437.928	1.861	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1ccc(Cl)cc1	1795662507	QXKHVZORKZUEMU-BJWYYQGGSA-N	441.919	1.833	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cn1cnnn1)[C@@H](Br)Cc1ccccc1	1796297923	LTBOMLCEWOGZEN-YVSFHVDLSA-N	447.337	1.318	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@](C)(Cl)CCl)C2	1796892827	XLKSCCJVQXBNPU-QBKBXNBMSA-N	442.347	1.995	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cn2cc(F)ccc2n1	1797429737	NYDFQIUSSHQREV-JZGBQWHFSA-N	443.306	1.913	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccn2cncc12	1797525571	PGAYVYSINAAXFA-YXPYIKCWSA-N	435.322	1.711	50	20	IDGD	
CCc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](Br)CC)C3)nn1C	1798325663	KMHCUSJKDLUEOU-FAXLKDOZSA-N	427.343	1.359	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cc1ccc(F)c(F)c1)C2	1798439252	SNFZPKGRUDFLCK-QDMKHBRRSA-N	443.454	1.458	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1(C)CCC1)C2	1798521604	PTGPDNXRHJFTPS-CCWDJLKJSA-N	445.472	1.914	50	20	IDGD	
CC(=O)N[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@](C)(Cl)CCl)C(C)(C)C	1799273753	GHZCYMOTFLSDRD-ZIUCBDDQSA-N	436.380	1.363	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1(Br)CC1)C2	1799277123	UCVBGPOZEDAAJA-FBKDDSFISA-N	428.154	1.740	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1n[nH]c3cccc(F)c13)C2	1800761967	KUVIBNJAPSZUAP-YYHMBLRTSA-N	439.285	1.689	50	20	IDGD	
C=C1C[C@@H](C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](O)CCl)C3)N(C(=O)OC(C)(C)C)C1	1802505425	UBMZNHZHGPTRQK-QEOTZNIISA-N	441.956	1.790	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)[C@@H]2C[C@H]2C2CC2)[C@@H]1c1cccnc1	1802992079	HGHXENAHGCFAOI-MOXWOTFGSA-N	427.549	1.507	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC2(CCCN(C(=O)[C@H]3CCc4ccoc4C3)C2)CC1	1805703601	XCWHLYIQEBNMQN-IBGZPJMESA-N	444.576	1.989	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC2(CCCN(C(=O)c3csnn3)C2)CC1	1806224334	YAEIJHKUNBCJLJ-HYARGMPZSA-N	443.533	1.517	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)c[nH]1	1807377189	ZCZSOTNFLBADDU-RXVVDRJESA-N	432.289	1.031	50	20	IDGD	
CS(=O)(=O)c1cncc(C(=O)N2CCCC3(CCN(C(=O)[C@@H](F)Cl)CC3)C2)c1	1807479558	WLHYUBVYSXZROS-OAHLLOKOSA-N	431.917	1.864	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2cc(C(=O)O)ncn2)[C@@H]1c1cccnc1	1808249950	HPEBRXXLLXIXTE-JKIFEVAISA-N	431.880	1.907	50	20	IDGD	
COCCOCC(=O)N1CC[C@H](CNC(=O)[C@](C)(Cl)CCl)[C@@H]1c1cccnc1	1808295888	MWUSTTNQHWIGEY-HHXXYDBFSA-N	432.348	1.987	50	20	IDGD	
CC(C)CNC(=O)C(=O)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@H]1c1cccnc1	1808447800	WFWVOCKIZXELQG-KKUMJFAQSA-N	443.317	1.550	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)c1ccc2[nH]ccc2n1	1809788748	VQEJSMJYIXKGKA-KYNGSXCRSA-N	427.892	1.877	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC2(CCCN(C(=O)Cc3ccsc3)C2)CC1	1810117206	KLWLLTTUKBLMRF-UHFFFAOYSA-N	441.557	1.834	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)CNC(=O)c2cc(C)on2)[C@H]1c1cccnc1	1810380131	JOWBRTZOJUEEOT-TXPKVOOTSA-N	447.923	1.831	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1ccccc1	1811664501	WCUYOBARKLAAJA-RBBKRZOGSA-N	429.285	1.395	50	20	IDGD	
CC(=O)NCCC(=O)NC[C@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1	1812656592	QJDFYIUAJKTXKJ-CRAIPNDOSA-N	425.327	1.399	50	20	IDGD	
COc1cnc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)[C@@H](O)CCl)n[nH]2)c(F)c1	1814869748	ZHXIKOBDDNFNFE-KGLIPLIRSA-N	425.848	1.858	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](F)Br)CC2	1817021428	GEIPNQYCAVDTTF-FWWHASMVSA-N	436.307	1.193	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H]2CCC(=O)N2C)n[nH]1	1820956763	KZEUUNXVTFTVIH-DRZSPHRISA-N	426.315	1.806	50	20	IDGD	
CCC(=O)N[C@H]1CCc2nc(NC(=O)CN(C)NC(=O)NCc3ccccc3)sc2C1	1822518759	SPIVDHDGXURIHJ-HNNXBMFYSA-N	444.561	1.811	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)C2=NNC(=O)C2)CC1	1824092008	LWSDMYOYRMKZIY-SWLSCSKDSA-N	427.343	1.513	50	20	IDGD	
COCCn1ccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)[C@H](O)CCl)CC2)n1	1824182756	JECFBWCZTCIPAP-QZTJIDSGSA-N	426.945	1.363	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)C23CC(F)(C2)C3)CC1	1824577024	QSBQPADOTVGVFP-YUVSOPLDSA-N	428.313	1.492	50	20	IDGD	
CO[C@@H](C)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1)CC2	1826155413	ZLXUOQVYKWMILT-MXZWCWCWSA-N	432.506	1.224	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)CC2CCOCC2)CC1	1826735155	KGUSFGMOKPSEDI-FQEVSTJZSA-N	436.597	1.796	50	20	IDGD	
O=C(CCc1ccccn1)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827050742	XFAPYSZCAJRPHJ-HSZRJFAPSA-N	449.360	1.628	50	20	IDGD	
Cc1ccc(CC(=O)Nc2nc3c(s2)C[C@H](NC(=O)CCC(=O)NN(C)C)CC3)o1	1827091176	VTLFDRKWTAHOQT-CYBMUJFWSA-N	433.534	1.572	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3ccc(C#N)cc3)CCO2)C1	1829635490	JOOYZSAJNDBMAF-DENIHFKCSA-N	449.935	1.201	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(C)nn3CC)C2)C1	1831647264	SXGIVNYJGKCETP-OXJNMPFZSA-N	426.945	1.689	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)C3(Br)CC3)C2)C1	1831654057	PSTJSIWHIHQPFR-XJKSGUPXSA-N	437.762	1.778	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3cnc[nH]3)CCO2)C1	1832813098	DTSCJRIEVUCFHB-ROUUACIJSA-N	433.336	1.035	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](CC)NC(C)=O)CC2)CC1	1833529953	KGOFBSNPJKMPRP-RBUKOAKNSA-N	429.005	1.880	50	20	IDGD	
Cc1nocc1C(=O)NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1834248431	MCGHLJYQMYFRJI-OAHLLOKOSA-N	431.306	1.859	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cc(Cl)ncn3)CC2)CC1	1836027926	YSECWQRYGFWCSF-HNNXBMFYSA-N	444.363	1.569	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1)c1cc[n+]([O-])cc1	1836052651	PSYTZISUYKOLGH-INIZCTEOSA-N	443.317	1.196	50	20	IDGD	
O=C(c1ccnc(Cl)n1)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836717919	FDLGGAATBRZZKM-HNNXBMFYSA-N	431.320	1.342	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(Cl)ccn3)CCO2)C1	1837867367	OSIOPQMYRKHZMC-KBXCAEBGSA-N	432.304	1.059	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)OC(=O)NC(C)C)CCO2	1839073729	CXJHMJSHLIUPKG-YWZLYKJASA-N	447.960	1.373	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(-n4cnnc4)cc3)C2)C1	1839144284	UIIAILVGZNKOPC-RXVVDRJESA-N	447.923	1.355	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3Cc4ccccc4CN3)C2)C1	1839144519	CVGBGZCWBKQZEL-JQVVWYNYSA-N	435.952	1.175	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccc(F)c(C#N)c3)C2)C1	1839147075	GEYUMMYYBAFOOK-UWJYYQICSA-N	437.899	1.714	50	20	IDGD	
O=C(CCc1cccs1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839197658	DSXQBCAQWTUHHX-RDJZCZTQSA-N	449.342	1.828	50	20	IDGD	
O=C(Cc1cccc(F)c1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839199209	KFXWLGXGHKMXQM-SJLPKXTDSA-N	447.276	1.515	50	20	IDGD	
O=C1CCc2ccc(C(=O)N3CCO[C@]4(COCCN(C(=O)[C@H](F)Cl)C4)C3)cc2N1	1839609167	UHXPNDLUUNSBOG-FXAWDEMLSA-N	439.871	1.176	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)c3ccccc3)C2)C1	1840030847	YCNPDFIVTFCLDZ-URLQWDBASA-N	443.313	1.937	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(F)c3C)C2)C1	1840149201	HSHNGKIGSIJKHP-OXQOHEQNSA-N	428.888	1.458	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)C3CCC(F)(F)CC3)C2)C1	1840150286	IALLRVFPFUJGCC-QAPCUYQASA-N	438.899	1.522	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(OC)ccc3F)C2)C1	1840156144	JFBPHYCSCKXHGQ-OXQOHEQNSA-N	444.887	1.158	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC12CN(C(=O)c1ccc(S(C)(=O)=O)cn1)C2	1841286236	QQQOAQVLPICIGF-GFCCVEGCSA-N	444.351	1.333	50	20	IDGD	
Cc1snc2sc(C(=O)N3CCCC34CN(C(=O)c3cccc(B(O)O)c3)C4)cc12	1843242071	IRTFVGYGMWXLOI-UHFFFAOYSA-N	441.343	1.477	50	20	IDGD	
CO[C@@H](C(=O)N1CC2(CCCN2C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C1)c1ccccc1	1843415697	BQFMGVLAZOJWII-DUYBAWCLSA-N	437.500	1.712	50	20	IDGD	
Cc1ccc(NCCC(=O)N2CCCC23CN(C(=O)CCC(=O)NN(C)C)C3)c(C)c1	1844307771	XQDVYIWJGRBKRG-UHFFFAOYSA-N	429.565	1.682	50	20	IDGD	
CN(CC(=O)N1CCCC12CN(C(=O)C1(C)CCC1)C2)NC(=O)NCc1ccccc1	1845038243	IYTULCLLVRPHSE-UHFFFAOYSA-N	427.549	1.726	50	20	IDGD	
O=C([C@@H]1C[C@@]12C(=O)Nc1ccccc12)N1CC2(CCCN2C(=O)[C@@H](F)Br)C1	1845219611	AIJIEIAWCBQOKM-CFZJUORYSA-N	436.281	1.790	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1ccc([N+](=O)[O-])o1	1847167900	DNXOQTQXDBRMBM-IGVYIQQOSA-N	428.405	1.137	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](CCO)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)C(C)(C)CCl	1847437371	XUUGKLMZSOUCIE-ILXRZTDVSA-N	431.961	1.729	50	20	IDGD	
CCCCn1nc(C(=O)NN/C=C2/C(=O)NC(=O)c3ccccc32)c2ccccc2c1=O	16721451	FKNOHEQSAZSZQN-QGOAFFKASA-N	431.452	1.742	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)[C@@H]2CCCN2S(=O)(=O)c2ccc(C)cc2)c1	17059256	DMJJLHCZQJZYBR-IBGZPJMESA-N	447.513	1.627	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc2c1O[C@@H](C)C2	21779082	JFDZMQZGYYTNMY-AWEZNQCLSA-N	447.513	1.409	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2Cc3c(OC)ccc(OC)c3[C@@H](O)C2)cc1OC	26159831	CSJWVTFPVULZPU-HNNXBMFYSA-N	445.472	1.031	50	20	IDGD	
NS(=O)(=O)c1ccc(C(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)cc1Cl	726062521	ASXUVUFLNYDRMC-UHFFFAOYSA-N	446.268	1.259	50	20	IDGD	
Cc1cc(C(=O)N2CCC[C@H]2C(=O)NNC(=O)COc2ccccc2F)ccc1[N+](=O)[O-]	726523156	CWADQBQZHXJSAM-KRWDZBQOSA-N	444.419	1.873	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C[C@@H](C)NC(=O)C2CCCCC2)c2ccccc2c1=O	727365245	OYTDQAGMMRNGOL-CQSZACIVSA-N	427.505	1.653	50	20	IDGD	
CCS(=O)(=O)N1CCC(C(=O)NNC(=O)c2cc(OC)ccc2Br)CC1	728528525	DAUAFEUAYBQFTP-UHFFFAOYSA-N	448.339	1.280	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(n2cc(C(=O)NNC(=O)CNc3ccccc3)nn2)CC1	729513765	OOQDPDMQNYIVIV-UHFFFAOYSA-N	443.508	1.723	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](CCNC(=O)NNC(=O)c2nnc(O)c3ccccc23)C1	730142017	VNQGZIWFJOYQSR-ZDUSSCGKSA-N	444.492	1.927	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)c1cc(S(=O)(=O)N2CCC[C@@H](C)C2)cn1C	730176512	WYCAFFYBXMBRGR-OAHLLOKOSA-N	448.545	1.458	50	20	IDGD	
O=C(NN=Cc1sc(N2CCOCC2)nc1-c1ccccc1)[C@H]1CCS(=O)(=O)C1	730576774	VZIWTYOXYKUAJF-HNNXBMFYSA-N	434.543	1.532	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)NCCS(=O)(=O)c1ccc(Cl)cc1	730899206	RAEOYRWJRJRXFN-UHFFFAOYSA-N	427.866	1.229	50	20	IDGD	
O=C(COC(=O)CNC(=O)c1c(F)cccc1Cl)NNC(=O)c1ccc(Cl)cc1	731082241	XHNUZNVLLBYLGF-UHFFFAOYSA-N	442.230	1.867	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)Cn2ccc3ccccc32)cc1S(=O)(=O)NCC#N	731197466	VIOBPAAVWDMSIH-UHFFFAOYSA-N	425.470	1.213	50	20	IDGD	
CC(C)N(C)S(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)Cc2ccccc2F)c1	731330343	LBKHONCPWXBGRC-UHFFFAOYSA-N	425.457	1.997	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@H](C)N1CCc2ccccc2C1	731866682	YJBXKERFMRUYFP-HNNXBMFYSA-N	429.546	1.496	50	20	IDGD	
CC(C)c1ccc(-c2nc(CC(=O)NNC(=O)N[C@@H]3CCS(=O)(=O)C3)cs2)cc1	732061142	CPTUJRVBJJCSKK-OAHLLOKOSA-N	436.559	1.994	50	20	IDGD	
CC(C)[C@H](Oc1ccccc1C#N)C(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	732330126	PRFMZYZCWICTRT-IBGZPJMESA-N	440.412	1.874	50	20	IDGD	
O=C(Cn1ncn2nccc2c1=O)NNC(=O)c1cc(-c2ccco2)nc2ccccc12	732750312	MNLGTSXPIQGPNA-UHFFFAOYSA-N	429.396	1.160	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)[C@H](c1ccccc1)N1CCCCC1=O	734241547	IFSFIHISEQDTSF-KRWDZBQOSA-N	433.509	1.595	50	20	IDGD	
Cc1[nH]c2ccccc2c1CC(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	735117352	SARKPTJPIWLWFD-UHFFFAOYSA-N	442.545	1.493	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)c2nnc3ccccc3c2O)CC1	735659061	LKAUGBBBNCACLU-UHFFFAOYSA-N	430.465	1.679	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)N2CCN(CC(=O)NNC(=O)c3ccc(F)cc3)CC2)c1	736620839	DNSHSNMFTGZGFK-KRWDZBQOSA-N	442.491	1.507	50	20	IDGD	
O=C(NNc1cccnn1)[C@@H]1CCCN(S(=O)(=O)c2ccc(Br)cc2)C1	736702056	VYXPSGOGRVWGFM-GFCCVEGCSA-N	440.323	1.783	50	20	IDGD	
Cc1nc(-c2c(C)c(C)nn(C)c2=O)sc1C(=O)NNC(=O)COCc1ccccc1	737923149	MEZYCDOXUIENNV-UHFFFAOYSA-N	441.513	1.807	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2Br)c1	739512715	WDKDOKKRBROOSX-UHFFFAOYSA-N	442.247	1.836	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)[C@@](C)(O)c2cccc(C(F)(F)F)c2)n1	741346154	CGABMYFKIFQUFV-KRWDZBQOSA-N	445.419	1.611	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)c2ccc(CNS(=O)(=O)CC)cc2)o1	741674289	JCRKBUWOZXNXIX-UHFFFAOYSA-N	436.534	1.636	50	20	IDGD	
CCc1nnc(S)n1CCNC(=O)CCC(=O)C(C#N)=C1N(C)c2ccccc2N1C	742188858	RLGCUSPLEJYJBL-UHFFFAOYSA-N	439.545	1.916	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)N[C@H](C)CN1CCN(c2ccccc2)CC1	743509599	HUZLOQCXYAELIH-GOSISDBHSA-N	441.532	1.615	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)NCC[C@](O)(c2nccn2C)C(F)(F)F)cc1	743559819	OBMDRKGXXPMLQM-KRWDZBQOSA-N	443.430	1.662	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1cncc(Br)c1	744621460	XLFULSZWPQQSGO-UHFFFAOYSA-N	441.307	1.622	50	20	IDGD	
CCOC(=O)N1CCN(C(=O)[C@@H](C)OC(=O)/C(C#N)=C/c2cc(C#N)n(C)c2C)CC1	744631391	DOLWOFOWPSVXCM-ZXMBATIKSA-N	427.461	1.345	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)COc2ccc(C=O)cc2Br)cc1	745588086	ARCUKIDTMNFTLF-UHFFFAOYSA-N	449.257	1.953	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)N[C@@H]3C[C@H]3C3CCCCC3)nc2)CC1	745858517	RFMPMNOIEKMQJH-ZWKOTPCHSA-N	436.582	1.613	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)N[C@@H]2CC(=O)N([C@@H]3C[C@H]3c3ccccc3)C2)cc1	745914075	HQZASSXTLAQBDK-YZGWKJHDSA-N	433.468	1.424	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)CC2CN(C(=O)OC(C)(C)C)C2)c2ccccc2c1=O	746096750	LVZCIDCBFKCQRL-UHFFFAOYSA-N	443.504	1.995	50	20	IDGD	
O=C(Cc1ccc2ccccc2c1)NNC(=O)NCCNS(=O)(=O)c1cccnc1	746326921	VHRODFDGSVDDBZ-UHFFFAOYSA-N	427.486	1.086	50	20	IDGD	
NC(=O)CC[C@H](C(=O)NNc1cccc(Br)c1)N1C(=O)c2ccccc2C1=O	748020859	RAHYCVWKCFFPAB-OAHLLOKOSA-N	445.273	1.823	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NNc2cccc(F)c2)o1	748090241	HEXAHPJTJBLHIJ-AWEZNQCLSA-N	425.438	1.892	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)CNC(=O)NCc2ccc([N+](=O)[O-])cc2)cc1	748212247	JIUBLDNKGWORAF-UHFFFAOYSA-N	431.474	1.642	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)N[C@H]1CCN(c2ccc(Br)cc2)C1	748629743	DOTGFEQDENDTGV-OCCSQVGLSA-N	429.315	1.410	50	20	IDGD	
CC(=O)NCc1ccc(S(=O)(=O)NCC(=O)NNc2ccc(OC(F)F)cc2)s1	748637326	NILGKEGRJGNGBH-UHFFFAOYSA-N	448.473	1.407	50	20	IDGD	
O=C(NCC1CCOCC1)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	749187592	ZGRKOZDQOBDSBC-UHFFFAOYSA-N	435.484	1.815	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)[C@@H]1CCCN1C(=O)c1ccc2c(c1)OCO2	749471931	ZVVJQCAPKOFCTP-IFXJQAMLSA-N	439.424	1.007	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)Cc2nc(-c3ccco3)oc2C)cc1OC	750181457	OQUGPOFPDHUDPW-UHFFFAOYSA-N	443.412	1.807	50	20	IDGD	
C[C@H](NC(=S)NNC(=O)c1ccc(F)c(S(=O)(=O)N2CCCCC2)c1)C1CC1	751621319	SROZTPLLKNRREX-LBPRGKRZSA-N	428.555	1.908	50	20	IDGD	
COc1ccc2c(c1)CC[C@@H](NC(=O)NNC(=O)c1csc(N3CCOCC3)n1)C2	753288031	SHGUTBNHXNKTPK-OAHLLOKOSA-N	431.518	1.490	50	20	IDGD	
COc1cc([N+](=O)[O-])ccc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	755314659	YGIIBXZVWWDYSU-UHFFFAOYSA-N	448.457	1.463	50	20	IDGD	
N#Cc1cccc(COc2ccc(NC(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)cc2F)c1	756355884	UIXDZKAXTFZSDR-HNNXBMFYSA-N	446.460	1.864	50	20	IDGD	
COC(=O)c1ccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1C	756378841	IDPJTIIYKIXXRC-UHFFFAOYSA-N	434.474	1.498	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)Nc1ccn(CCc2ccncc2)n1	756731103	XBBBALFQWYJHQO-UHFFFAOYSA-N	432.444	1.879	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)c2cccnc2I)c1	757836225	IBOFFVWQSWOSLW-UHFFFAOYSA-N	445.238	1.165	50	20	IDGD	
O=C(NC[C@@H](c1cccc(Cl)c1)N1CCCC1)NNC(=O)C(=O)Nc1ccccn1	758683075	GCMIUMXVQVJVKP-INIZCTEOSA-N	430.896	1.841	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)N[C@@H]2CN(C(=O)OC(C)(C)C)C[C@@H]2C#N)c1	758755172	SKNSTDZISOXBFI-XJKSGUPXSA-N	433.465	1.407	50	20	IDGD	
CCCC(=O)N1CCC[C@H](C(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)C1	758787014	RDCPVKKVXNKFIY-INIZCTEOSA-N	439.557	1.661	50	20	IDGD	
COc1ccc(C[C@@H](C)C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cc1	759607051	DPZGNDWVWSMKRG-GOSISDBHSA-N	438.528	1.479	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1ccnn1-c1cc(C)ccn1	760291902	QTPYDOQMSVDSOT-UHFFFAOYSA-N	440.485	1.463	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)Cn1cnc(-c2ccccc2)n1	761194941	DGUWOYGEGBQQBP-UHFFFAOYSA-N	433.516	1.305	50	20	IDGD	
CC(=NNC(=O)c1cc(Br)c[nH]1)c1c(C)nn(CCS(C)(=O)=O)c1C	763148895	ILQAJZOXRNZGTL-UHFFFAOYSA-N	430.328	1.789	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccccc1CN1CCSCC1	763442436	QKZLXNIPQIHAJQ-UHFFFAOYSA-N	443.485	1.543	50	20	IDGD	
COCCOc1ccc(C(F)(F)F)cc1NC(=O)C(=O)NNC(=O)c1ccncc1	763463127	APHVTMJBPVTIOR-UHFFFAOYSA-N	426.351	1.525	50	20	IDGD	
Cc1ccc(F)cc1NC(=O)C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	763528908	BAHJHRVFDKUYHJ-UHFFFAOYSA-N	427.480	1.432	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)Nc1cccnc1OCc1ccccc1	763571055	KGMPZERKNIDUSV-LJQANCHMSA-N	448.435	1.587	50	20	IDGD	
O=C(NNC(=O)c1ccccc1F)C(=O)Nc1ccc(OCC(F)(F)C(F)F)nc1	763574897	LSHRIAFXMZAWJM-UHFFFAOYSA-N	432.305	1.900	50	20	IDGD	
C[S@@](=O)Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2F)ccc1Cl	763680466	IZVPAJSRDKVIPV-GDLZYMKVSA-N	441.868	1.523	50	20	IDGD	
Cc1ccc(-n2cc(C)cn2)c(NC(=O)C(=O)NNC(=O)c2nnc(O)c3ccccc23)c1	763789872	DPZXVRGEICHCID-UHFFFAOYSA-N	445.439	1.538	50	20	IDGD	
CN(C)C(=O)c1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)ccc1Cl	763808308	JUDFMAOOJZIYGN-UHFFFAOYSA-N	443.847	1.078	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)C[C@@H](NC(=O)c1ccccc1)c1ccccc1	763825526	QZLHBAMHHOTPHZ-HXUWFJFHSA-N	445.479	1.520	50	20	IDGD	
COC(=O)NCc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)cc1	763863774	BXPWQUAISWSPCS-LBPRGKRZSA-N	432.408	1.235	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1cccnc1N1CCCCC1	763867256	ZDVOHTUYVPSRLH-CQSZACIVSA-N	429.452	1.764	50	20	IDGD	
CCc1cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(Br)c2)n(C)n1	763884854	YPXAYPRSDYHQIT-SNVBAGLBSA-N	438.282	1.298	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(CNC(C)=O)cc2)ccc1OC(C)C	763916396	OSNUFYWQXVBAOJ-UHFFFAOYSA-N	442.472	1.518	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)C(=O)Nc1cc(Br)cnc1-n1cccn1	763957703	GMEJHVIAVZUAIW-UHFFFAOYSA-N	443.261	1.738	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)C(=O)Nc1cccc(Cl)c1SC(F)F	764003032	WUJIWXVTGYIPQA-ZETCQYMHSA-N	441.865	1.175	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)on1)C(=O)Nc1cccnc1OCC(F)F	764003166	AQCKLXHORIXSQT-UHFFFAOYSA-N	431.355	1.780	50	20	IDGD	
C[S@@](=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)on2)cc1F	764004183	UAYHMKNEDGGYQP-SSEXGKCCSA-N	430.417	1.618	50	20	IDGD	
COc1ccccc1COc1cccc(NC(=O)C(=O)NNC(=O)c2cnccn2)c1C	764023613	AODZMDYZWVYVRF-UHFFFAOYSA-N	435.440	1.772	50	20	IDGD	
CC(C)N1CCN(c2cccc(NC(=O)C(=O)NNC(=O)Cc3ccsc3)c2)CC1	764036162	YKXZJSVPORJWHX-UHFFFAOYSA-N	429.546	1.607	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccccc2N2CCCCC2)c1	764076669	DYDIHFDTEMTVHD-UHFFFAOYSA-N	444.513	1.480	50	20	IDGD	
COC(=O)c1c(F)cccc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccc(C)cc2)[nH]n1	764111140	ODSPSNGMFVLRPK-UHFFFAOYSA-N	439.403	1.711	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccc(Cl)c(C(=O)N(C)C)c1	764132643	ZIFXTQIZKSNJMA-UHFFFAOYSA-N	432.864	1.379	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)cc(OC)c1C(C)C	764153168	JPIUXQPOUDYPHW-SFHVURJKSA-N	427.457	1.917	50	20	IDGD	
CC(=O)Nc1ccc(C)c(NC(=O)C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)c1	764204532	XWEJRENKSYZRIY-UHFFFAOYSA-N	435.481	1.344	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)C(=O)Nc1cccc(Cl)c1-n1cccn1	764280852	GVOXAERKWCHPLT-UHFFFAOYSA-N	427.848	1.950	50	20	IDGD	
COc1cccc(COc2cccc(NC(=O)C(=O)NNC(=O)Cc3cc[nH]n3)c2C)c1	764285822	MTLJGUZEDGNAHC-UHFFFAOYSA-N	437.456	1.634	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)C1=NN(c2ccccc2)[C@H](c2ccccc2)C1	764342784	RJPFUCVUZBWREH-NRFANRHFSA-N	442.479	1.966	50	20	IDGD	
Cc1cc(C)n(-c2ccc(NC(=O)C(=O)NNC(=O)c3ccc(O)c(Cl)c3)cn2)n1	764349464	KWMKLHXNILPILA-UHFFFAOYSA-N	428.836	1.643	50	20	IDGD	
COC(=O)c1cc(Cl)ccc1NC(=O)C(=O)NNC(=O)c1ccc(O)c(Cl)c1	764349492	QDJFAFKVRCWNET-UHFFFAOYSA-N	426.212	1.885	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)C(=O)Nc1cnn(-c2ccc(C(F)(F)F)cc2)c1	764353978	NZEMFPHCEFROKL-UHFFFAOYSA-N	432.362	1.615	50	20	IDGD	
CN(C(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)c2cnn(C)c2)cc1)c1ccccc1	764362861	JCRCUOVLTPDJEQ-UHFFFAOYSA-N	434.456	1.025	50	20	IDGD	
O=C(NNC(=O)C(F)(F)Oc1ccccc1)C(=O)Nc1cccc(N2CCOC2=O)c1	764379385	DAZPSQXPMSVMRH-UHFFFAOYSA-N	434.355	1.401	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)C(=O)Nc1ccc(S(=O)(=O)NCCC(C)C)cc1	764389803	ZYUNOKMRBPONML-UHFFFAOYSA-N	447.517	1.114	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)[C@H](C)NS(=O)(=O)c2cccc(C#N)c2)c1C	764553118	RFFJNOYYIMDNFF-JKSUJKDBSA-N	444.513	1.457	50	20	IDGD	
COc1cc2c(cc1OC)CN(C(=O)CCC(=O)NNC(=O)Cc1ccc(F)cc1)CC2	764575534	IVHWSGTUSAFLKC-UHFFFAOYSA-N	443.475	1.898	50	20	IDGD	
COc1cc2c(cc1OC)CN(C(=O)CCC(=O)NNC(=O)c1ccc(Cl)nc1)CC2	764901919	KMCZSUJRQLRWTC-UHFFFAOYSA-N	446.891	1.878	50	20	IDGD	
COc1ccccc1OCCC(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765735026	GSVKSTZKTDUHIH-UHFFFAOYSA-N	440.500	1.070	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@H](C)Oc3ccccc3F)CC2)cc1	765753953	GSMJSLNBYSRHCF-SFHVURJKSA-N	428.508	1.867	50	20	IDGD	
C[C@@H](O)C(=O)N1CCN(C(=O)/C(C#N)=C\c2cn(CCC#N)nc2-c2ccccc2)CC1	766017243	ZQBXNDOIUOPTOL-SQFNAUOLSA-N	432.484	1.422	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)C[C@@H](C)NC(=O)C3CCCC3)CC2)cc1	766647257	CFWBCUFSELQVLU-LJQANCHMSA-N	443.592	1.345	50	20	IDGD	
CCc1ccc(N2C[C@H](C(=O)OCC(=O)NNC(=O)Cc3ccccc3C)CC2=O)cc1	767257247	KRHLAKHFJPISAL-LJQANCHMSA-N	437.496	1.844	50	20	IDGD	
CCn1c(SCC(=O)NNc2nc(O)c3cnn(C)c3n2)nnc1-c1cccs1	770980538	QDMNPAXJGLHMEX-UHFFFAOYSA-N	431.507	1.644	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)C(=O)N2CCC[C@@H](C)C2)c2ccccc2c1=O	771606315	OFFPMJSCQWXYSX-OAHLLOKOSA-N	427.505	1.606	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNS(=O)(=O)c1ccc(C(F)(F)F)cc1	771606372	HOVPFGKOLJSJDJ-UHFFFAOYSA-N	435.811	1.985	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)C[C@@H]2CSCCN2C(=O)OC(C)(C)C)C[C@@H](C)O1	772374225	NVKUYGCMPASZCX-OWCLPIDISA-N	444.598	1.376	50	20	IDGD	
CN(C)c1ccc(S(=O)(=O)N(C)C)cc1NC(=O)C(=O)NNc1c(F)cccc1F	773706221	YLUFHMWTPBXQEL-UHFFFAOYSA-N	441.460	1.363	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(C)c(F)c2)c(OCC(=O)N(C)C)c1	773890005	VRFGGCCLBGJRAP-UHFFFAOYSA-N	430.436	1.309	50	20	IDGD	
CCCCCCCCn1nc(C)c(S(=O)(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)c1C	775257568	MZFFNZGBNBOQNR-INIZCTEOSA-N	448.611	1.605	50	20	IDGD	
C[C@H]1C[C@H](C(=O)NNC(=O)c2ccccc2F)[C@H](C(=O)NNC(=O)c2ccccc2F)C1	775764072	AXODXWOGAXDWTP-DVSIDAKKSA-N	444.438	1.849	50	20	IDGD	
COc1ccc(C(=O)N2CCOCC2)cc1NC(=O)NNc1cccc(S(C)(=O)=O)c1	776467445	XQSPMPKKWWDDNB-UHFFFAOYSA-N	448.501	1.720	50	20	IDGD	
COCCO[C@@H]1COCC[C@H]1NC(=O)NNC(=O)[C@H](C)Oc1ccc2ccccc2c1	777278932	LJOIARRHZTZEAX-CWFSZBLJSA-N	431.489	1.758	50	20	IDGD	
C[C@H](c1cccc(N2CCCS2(=O)=O)c1)N(C)C(=O)NNC(=O)Cc1cccnc1	777507208	FKYQEFIHNUAMKE-OAHLLOKOSA-N	431.518	1.598	50	20	IDGD	
O=C(N1CCN(S(=O)(=O)CBr)CC1)C1(c2ccccc2)CCOCC1	777833156	UCTXCRHMHKFAFH-UHFFFAOYSA-N	431.352	1.561	50	20	IDGD	
COCCC[C@H](C)C(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	777966137	IVWWCFFOTUVJRL-INIZCTEOSA-N	433.530	1.989	50	20	IDGD	
COc1ccc(Cn2cc(C(=O)NNC(=O)COc3ccc(F)cc3)cn2)cc1OC	778293983	YOJIIHGTZYBACV-UHFFFAOYSA-N	428.420	1.928	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)[C@H]2CC(=O)N(c3ccccc3OCC)C2)nc1C	778425033	JYDGIFFYPCMGNZ-AWEZNQCLSA-N	427.461	1.857	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)[C@H]2CCCN(S(=O)(=O)c3ccccc3)C2)nc1C	778427765	FSQGQZFTWSNMEK-HNNXBMFYSA-N	447.517	1.506	50	20	IDGD	
Cc1nnc(SCC(=O)NNC(=O)CNC(=O)OC(C)(C)C)n1Cc1ccccc1	778443896	ZOOZZRFHPUFTOG-UHFFFAOYSA-N	434.522	1.399	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)[C@@]12CCC(=O)N1c1cc(Cl)ccc1S2	778445911	WGKDFNYJLJQEAY-SFHVURJKSA-N	440.909	1.941	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)[C@H](O)[C@H](O)c2nc3ccccc3s2)cc1OC	779489809	UUERKDMFZIODFR-MSOLQXFVSA-N	445.497	1.949	50	20	IDGD	
CSc1ccccc1S(=O)(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	780399092	WYDKHCKDBHVTPQ-UHFFFAOYSA-N	448.570	1.176	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@]2(C[C@@H]2C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)C1	781886761	RPMCBNULLVTCQU-IVZQSRNASA-N	441.488	1.986	50	20	IDGD	
CCc1ccc(NC(=O)C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)cc1CC	782896293	FAYPUXFZYVYCQY-UHFFFAOYSA-N	445.545	1.813	50	20	IDGD	
C=CCN(C)S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ncnc3ccsc23)cc1	783261999	LOTYUABITXOJHB-UHFFFAOYSA-N	446.514	1.580	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2ccc(Oc3ccc(Cl)nn3)cc2)CCS(=O)(=O)C1	783428339	UYCWGPIBHWFJSF-KRWDZBQOSA-N	439.881	1.059	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)C2(Cc3ccc(F)cc3)CC2)cc1	783508579	SVRJUOGREMZDHM-UHFFFAOYSA-N	433.505	1.925	50	20	IDGD	
C[C@H](CC#N)Sc1ccccc1NC(=O)C(=O)NNC(=O)CNC(=O)c1ccco1	784001685	BHZNMFYLXLZHKP-GFCCVEGCSA-N	429.458	1.190	50	20	IDGD	
O=C(NNC(=O)C(=O)N1CCCC1)C(=O)Nc1ccc(Oc2ccnc3ccccc23)cc1	784003061	PNUYAAFXJGDQPB-UHFFFAOYSA-N	447.451	1.735	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)C(=O)Nc1ccc2c(c1)ncn2-c1ccccc1	784004434	NBMAEGMYQBLFJH-UHFFFAOYSA-N	446.423	1.134	50	20	IDGD	
Cc1nc(N2CCOCC2)ccc1NC(=O)C(=O)NNc1ccc(Br)cn1	784338747	APVVKJLCIXAWIF-UHFFFAOYSA-N	435.282	1.466	50	20	IDGD	
O=C(COC(=O)CCN1C(=O)[C@H]2CCCC[C@H]2C1=O)NNC(=O)c1ccc(Cl)cc1	784386481	UFFNOWYOLWSRAG-GASCZTMLSA-N	435.864	1.210	50	20	IDGD	
N#Cc1c(F)cccc1-n1ccc(NC(=O)C(=O)NNc2ccc(C(F)(F)F)nn2)n1	784888573	ZMNAATLUFFKFJQ-UHFFFAOYSA-N	434.313	1.774	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2cccc(Cl)c2N2CCOCC2)n1	785226920	LDKSRMGNOLKDOE-UHFFFAOYSA-N	447.927	1.895	50	20	IDGD	
O=C(CCCc1ccc(O)c(F)c1)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	787125266	GXTRLCGKKKKXGD-UHFFFAOYSA-N	442.491	1.459	50	20	IDGD	
COc1cc(C(=O)NCC(=O)Nc2cccc(NC(=O)NN(C)C)c2)cc(OC)c1OC	788259348	OVVWKEPOTCUEKL-UHFFFAOYSA-N	445.476	1.679	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)ccc1O)C(=O)Nc1nc2c(s1)CCCC2	789735210	UTIYYSSEMBLILM-UHFFFAOYSA-N	439.291	1.890	50	20	IDGD	
CC(C)(C)OC(=O)N1CC2(C[C@H]2C(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)C1	789757543	ALHMIIMEUXJLGF-LBPRGKRZSA-N	431.497	1.987	50	20	IDGD	
CCn1c(CNC(=O)NNC(=O)C(=O)N2CCCC2)nc2cc(Br)ccc21	790758067	AZZKXCTXTGFGHI-UHFFFAOYSA-N	437.298	1.272	50	20	IDGD	
CCc1c(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)cnn1C(CC)CC	792268064	KSKHQXOYNGZGEU-UHFFFAOYSA-N	426.477	1.843	50	20	IDGD	
C[C@@H]1C[C@@H](C)CN(C(=O)c2ccccc2NC(=O)C(=O)NNc2nc3ccccn3n2)C1	792387806	IOZXPOHXEOWQGQ-HUUCEWRRSA-N	435.488	1.929	50	20	IDGD	
O=C(O)c1ccc(S(=O)(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c(OC(F)(F)F)c1	792700027	XDRIXJZVFCMBRE-UHFFFAOYSA-N	449.319	1.815	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)c1c(F)ccc(S(=O)(=O)NC2CC2)c1F	792798962	USKUYDPUZFHMOK-UHFFFAOYSA-N	439.440	1.418	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)nc1Br	793022311	VBZMSAWZOBTONF-UHFFFAOYSA-N	445.071	1.643	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1)C(=O)Nc1cccc(Br)n1	793024203	CUFYZLQDUUATJO-UHFFFAOYSA-N	447.224	1.773	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2nnn(Cc3ccncc3)c2C)cc(OC)c1OC	794758272	TVJBMEWSBBVGAP-UHFFFAOYSA-N	426.433	1.130	50	20	IDGD	
O=C(CN1CCNC(=O)[C@H]1c1ccc(Br)cc1)NNC(=O)c1cccs1	796574593	HOZAKASECWBGSA-OAHLLOKOSA-N	437.319	1.445	50	20	IDGD	
C=CCNC(=S)NNC(=O)CCC(=O)N[C@@H](C)C(=O)c1ccc(Br)cc1	798305010	QFSSQQVIXPHYOH-NSHDSACASA-N	441.351	1.598	50	20	IDGD	
COCCCn1nccc1C=NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	802713041	ZTRWSMXYYVXCOJ-UHFFFAOYSA-N	432.956	1.841	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1csc(N2CCOCC2)n1)c1nccn1-c1ccccc1	804868045	SUHMXFWUNNHYQH-CQSZACIVSA-N	441.517	1.871	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)NCCNS(=O)(=O)c1ccc(Cl)cc1C	807545784	LDJJXPUHIPNCMY-UHFFFAOYSA-N	438.937	1.808	50	20	IDGD	
CCc1nnc(NC(=O)[C@@H](C)[C@@H](C)NC(=O)NNc2cccc(S(C)(=O)=O)c2)s1	807566540	XRXVGXSWMIEOJR-WDEREUQCSA-N	440.551	1.793	50	20	IDGD	
CC(C)SCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	807573738	ZUYYHQNMZBHUKU-UHFFFAOYSA-N	428.580	1.947	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2noc3c2CCCC3)c1	807619778	RPRDAUNBRXKICW-UHFFFAOYSA-N	449.533	1.728	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)N2CCC[C@@H](CNS(=O)(=O)C3CC3)C2)c1C	807900230	UTFYKIDKNRGZDP-HRVJUDJTSA-N	448.589	1.979	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)Cc2c(F)cc([N+](=O)[O-])cc2F)n1	808563311	MSGCCBGIKSZCDK-UHFFFAOYSA-N	428.373	1.114	50	20	IDGD	
Cc1cc(C)c(C)c(S(=O)(=O)NCC(=O)NNC(=O)CCc2ccccc2O)c1C	810356973	ZCCWVUZYDQAHGC-UHFFFAOYSA-N	433.530	1.684	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(Br)cc1)NNc1ncccc1[N+](=O)[O-]	810528329	QSXLQMCPKMYVIF-UHFFFAOYSA-N	430.240	1.174	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@@H]2COc3c(C)cccc3C2)cc1	812642844	GIPAIYKMINJXEU-KRWDZBQOSA-N	446.529	1.258	50	20	IDGD	
CC(C)CNC(=O)N1CCC[C@H](C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)C1	812731892	ZFARYLBIBKZPDN-HNNXBMFYSA-N	425.555	1.458	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NN=Cc3cccc(C(=O)O)c3)CC2)cc1	814876780	CRJSEUYBPISCDM-UHFFFAOYSA-N	444.513	1.150	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2O1)C(=O)Nc1ccc(Br)c(C2CC2)n1	815568755	SONKPMFHIPQMES-CQSZACIVSA-N	445.273	1.811	50	20	IDGD	
Cc1c(COc2ccccc2)cccc1NC(=O)C(=O)NNC(=O)[C@H]1CCc2nncn2C1	815692246	NBUHYXGQFDRLGP-INIZCTEOSA-N	448.483	1.514	50	20	IDGD	
Cc1nc(C(F)(F)F)ccc1NC(=O)C(=O)NNc1ccccc1S(=O)(=O)N(C)C	815751200	UDZANRMGHHCHTK-UHFFFAOYSA-N	445.423	1.741	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1cccnc1N1CCCCC1	815751578	FQPQIXKSQQMETJ-UHFFFAOYSA-N	446.533	1.404	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)N1C[C@H]2CCCN2c2ccccc21	815752383	PVCKVJSCZDZLFE-OAHLLOKOSA-N	443.529	1.396	50	20	IDGD	
Cc1cc(OCc2ccc(C(=O)NNC(=O)[C@@H]3CC(=O)NC(=O)N3)cc2)ccc1Cl	816815524	XASZQZFNSFPABP-INIZCTEOSA-N	430.848	1.587	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)CN1C(=O)[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O	913037240	RELACPOXTUUQTL-XJNFMUPTSA-N	436.493	1.687	50	20	IDGD	
Cc1ccccc1-n1ncc(C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)c1C(F)(F)F	914718736	ACRKEXUKSYOTNG-NSHDSACASA-N	430.408	1.395	50	20	IDGD	
COc1ccc2c(c1)C[C@@H](C(=O)NNC(=O)c1nn(C(C)C)c(=O)c3ccccc13)CO2	914781377	BHJYBMJWABEHFO-OAHLLOKOSA-N	436.468	1.998	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)[C@H]2CC(c3cccc(F)c3)=NO2)c2ccccc2c1=O	915133417	POCIYMSLJLKTAY-GOSISDBHSA-N	437.431	1.900	50	20	IDGD	
CC(=NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)c1ccc(O)cc1O	915915006	JTLTZGBEVMUGLZ-UHFFFAOYSA-N	447.513	1.592	50	20	IDGD	
Cc1nn([C@H]2CCS(=O)(=O)C2)c(Cl)c1C=NNC(=O)COc1ccccc1F	916300551	LBNAVQSNWMDNQA-LBPRGKRZSA-N	428.873	1.873	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)NCC[C@@](O)(c1nccn1C)C(F)(F)F	916377473	BUYQYVCCSMKCAO-GOSISDBHSA-N	443.426	1.532	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)NC1CCN(C(=O)c2ccccc2F)CC1	916379559	HVRBVPRDKRJWGA-UHFFFAOYSA-N	444.463	1.848	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)NCc2ccc(CN3CCN(C)CC3)cc2)c1	916388103	URRUFRMJHHYWCA-UHFFFAOYSA-N	439.560	1.960	50	20	IDGD	
O=C(NCc1ccc(OCC(F)(F)F)nc1)NNC(=O)c1ccc2c(c1)OCCO2	916397609	VNDKQDGPSBPEKJ-UHFFFAOYSA-N	426.351	1.938	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCc2nncn2-c2ccccc2)nc1	916580464	CUFMVNNJIIPFMD-UHFFFAOYSA-N	444.521	1.519	50	20	IDGD	
O=C(NCCS(=O)(=O)Cc1ccccc1)NNC(=O)c1nn(-c2ccccc2)cc1O	916635984	KPSCEHUMLINPLA-UHFFFAOYSA-N	443.485	1.137	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)c1ccc2c(c1)S(=O)(=O)N(C1CC1)C2=O	916742261	ACONFXNPAJCTST-NSHDSACASA-N	447.444	1.361	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)CCn2cc(Br)cn2)c2ccccc2c1=O	917914454	GCTNBNJVKJTZSQ-UHFFFAOYSA-N	447.293	1.788	50	20	IDGD	
COc1cccc(CCNC(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)c1OC	918016097	DMSIHQNZQILTSF-UHFFFAOYSA-N	433.461	1.916	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNS(=O)(=O)c2ccc([C@H](C)NC(C)=O)s2)c1	918399564	QCWSRBJVVIAQTH-JTQLQIEISA-N	427.504	1.586	50	20	IDGD	
COc1ccnc(NNC(=O)c2cc(S(=O)(=O)N(C)C)ccc2N2CCCCC2)n1	919713309	SHXPCSYAQSTSGD-UHFFFAOYSA-N	434.522	1.483	50	20	IDGD	
CS(=O)(=O)Nc1ccc(O)c(C(=O)NNC(=O)Cc2nc(-c3ccccc3)cs2)c1	919809069	BRBFOPKWECOWDP-UHFFFAOYSA-N	446.510	1.891	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@@H](C)NC(=O)OCc2ccccc2)c2ccccc2c1=O	920250308	NXJJFSXZOYPERC-CQSZACIVSA-N	437.456	1.492	50	20	IDGD	
CN1CCN(c2ncccc2CNC(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)CC1	921200131	UEWIGXLHUYYDSG-UHFFFAOYSA-N	426.565	1.880	50	20	IDGD	
CNC(=O)c1cccc(C(=O)NNC(=O)COc2ccc(-c3ccc(C#N)cc3)cc2)n1	1116281281	PMWPOPLVCYAJBD-UHFFFAOYSA-N	429.436	1.820	50	20	IDGD	
O=C(NCCCS(=O)(=O)c1ccccc1)NNC(=O)c1cncn1-c1ccccc1	1318114155	AIYVXAKPGAJCQY-UHFFFAOYSA-N	427.486	1.680	50	20	IDGD	
C[C@H](OC1CCCCC1)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	1318546356	MVIOBASJIIMILW-HNNXBMFYSA-N	439.534	1.206	50	20	IDGD	
O=C(NNC(=O)c1cc2c(cn1)OCCC2)c1cccc(S(=O)(=O)N2CCCCC2)c1	1320003020	ZBTSNTUXIJPNMH-UHFFFAOYSA-N	444.513	1.656	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)c1ccc(N2CCC[C@H](C(N)=O)C2)cc1	1324037995	VTQWZLGBHDEOQS-KRWDZBQOSA-N	440.500	1.627	50	20	IDGD	
Cc1ccn2ncc(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)[C@@H](O)CCl)C4)c2c1	1777940535	CUTRTEJHDAKHFF-WAOWUJCRSA-N	434.924	1.370	50	20	IDGD	
C[C@H](Nc1nccs1)C(=O)N1CCO[C@]2(CCN(C(=O)CO[Si](C)(C)C)C2)C1	1779295645	VBEGNIMEVBPQNH-KSSFIOAISA-N	426.615	1.625	50	20	IDGD	
COC(=O)c1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@](C)(Cl)CCl)C3)C2)cn1	1781229856	MXBIYQQRPSUZIT-RTBURBONSA-N	444.315	1.548	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)cc1F	1781325081	IRPGDLSSUXPYNS-PBHICJAKSA-N	433.249	1.968	50	20	IDGD	
Cc1cccc2c(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)[C@H](O)CCl)C4)n[nH]c12	1781386038	AQGUEROPEUGPNR-WHSLLNHNSA-N	434.924	1.599	50	20	IDGD	
Cc1nccn1CC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@](C)(Cl)CCl)C2	1781558405	RVFALYSTIACZAC-ATZDWAIDSA-N	431.364	1.942	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(OC)c(OC)c3O)C2)C1	1781826963	OCHLBCYAFUCEAX-VBKZILBWSA-N	426.897	1.870	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)COc1ccc(F)cc1)C2	1782170798	YSXKCBUGSUJQOB-WAOWUJCRSA-N	442.915	1.972	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)Cn1cccn1)C2	1782170866	CPMWYPQZSOVLDG-WOCWXWTJSA-N	426.945	1.287	50	20	IDGD	
CN(C)CCC(=O)N1CCO[C@]2(CCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1	1782864872	XXIKDLKKEMCORY-JRVGGCGHSA-N	432.471	1.653	50	20	IDGD	
O=C([C@H](O)CCl)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C2(c3ccccc3F)CC2)C1	1783192981	CFRYJGDBOIJJGO-DBXWQHBBSA-N	438.927	1.971	50	20	IDGD	
CC(C)(C)OC(=O)N1CC2(C[C@@H]2C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](F)Cl)CCO3)C1	1783448925	CVHKCEZEJNIWRH-LAPQFRIASA-N	445.919	1.608	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@H](C(=O)N2CC[C@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)C1	1783863867	NIMIPDXUDJZILC-FVJLSDCUSA-N	440.613	1.647	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)[C@@H](C)CNC(=O)OC(C)(C)C)CCO2)C1	1783870460	CGXFPGIMTPMYLG-AVYPCKFXSA-N	447.960	1.231	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cc3[nH]ccc3s1)CCO2	1783936057	QQGKXMFKAPHSFF-HXUWFJFHSA-N	433.534	1.046	50	20	IDGD	
CC(=O)N[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(C)(C)CCl)C[C@@H]21)C(C)(C)C	1784312590	QEQAQYPKFGLRSD-LUKYLMHMSA-N	429.989	1.782	50	20	IDGD	
CC(C)(C)OC(=O)CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]21	1784781248	ZTYUYBVZOLFXOW-WFTHSTBKSA-N	437.364	1.934	50	20	IDGD	
C#CCCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2	1785418019	HTAFOHXFUJBRMA-MGPUTAFESA-N	427.929	1.362	50	20	IDGD	
CCc1[nH]nc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](Br)CC)C[C@@H]32)c1F	1785794890	QSDJISIUMUIYLS-MNXVOIDGSA-N	445.333	1.878	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)n3cccc3C=O)[C@H]2C1	1786995918	ZGEHNCNUFXQVQV-SRIISGBFSA-N	425.913	1.095	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Cl)C[C@@H]21)C1=NN(c2ccccc2)C(=O)C1	1787539407	AVVHTJFZEXDCRL-WIRVQXDCSA-N	436.871	1.293	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)c1nnsc1C1CC1	1787680600	DZBGGJQOZZIZEM-AVGNSLFASA-N	443.367	1.794	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)c3ccc(F)nc3)CCC2)cc1)c1cccc(B(O)O)c1	1788147803	IMKVSBRZAQXEAS-UHFFFAOYSA-N	433.248	1.962	50	20	IDGD	
COc1ccnc(C(=O)NC2(c3ccc(NC(=O)c4cccc(B(O)O)c4)cc3)CCC2)c1	1788147899	NHBVQZMEZXUZOQ-UHFFFAOYSA-N	445.284	1.832	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]2C1)n1ccccc1=O	1789870736	SVYDGFGSYMPGBX-HYUNPYRHSA-N	444.359	1.625	50	20	IDGD	
Cc1cc(C)n(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]3C2)n1	1789921991	AJFNEGHSYGRQIK-YXWQFLTLSA-N	431.306	1.170	50	20	IDGD	
COc1ncc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]3C2)cc1C	1789922226	GKUDJEDWTOBQQZ-CYUUQNCZSA-N	444.301	1.682	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3c[nH]c4nccc-4c3)C[C@@H]21)[C@@H](F)Br	1789923228	ZJIZDMTZOYKIPS-CYUUQNCZSA-N	439.285	1.798	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(-c4ccncc4)[nH]n3)C[C@@H]21)C(Cl)Cl	1791298120	CHXWJHVWABHOCJ-XEZPLFJOSA-N	438.315	1.869	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc(-c3ccccc3)s1)C2)[C@@H](O)CCl	1792981429	ZPTGVYFNCAZXAY-IVSAIRAKSA-N	435.933	1.613	50	20	IDGD	
CO[C@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCl	1793106258	BSOZXZNHJOVRPV-RDGWLKQMSA-N	447.960	1.153	50	20	IDGD	
C#CC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCl	1793117130	AVYOCFWBPXTAPV-QRJUGERDSA-N	427.929	1.141	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CC(c3ccccc3)=NN1)C2	1793453727	UEFGOPXIXIAOPZ-FPPGBKCQSA-N	432.952	1.750	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCc1cncnc1	1795803666	IDZXNSUTVDRFHV-FAYQHZLMSA-N	425.327	1.030	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1(C)CN(C(=O)OC(C)(C)C)C1	1797275922	KCHKFUOHXKNKBP-QKPAOTATSA-N	443.972	1.850	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NO[C@@H](c2ccccc2)C1	1797755850	KXSXBJRMVAWFGE-AJYBTWMASA-N	441.532	1.515	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)Nc1ccccn1	1797976107	JATBGUBHMNZAFZ-AQDIXCGQSA-N	425.327	1.255	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(Br)cn1	1798032591	HFFVTONJCSBKRW-WJNVRWDZSA-N	446.729	1.301	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H]1CCc3ccoc3C1)C2	1798439486	CEAFVHVGWCNPTG-WCXIOVBPSA-N	437.500	1.335	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1(C)CN(C(=O)OC(C)(C)C)C1)C2	1799268273	SOCMKSLUJOWBMZ-FZKCQIBNSA-N	443.972	1.850	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@](C)(Cl)CCl)o1	1799277260	UVQRUQYRJNUDFL-ABXQLRGKSA-N	432.304	1.678	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2)[C@@H]1Cc2[nH]nc(C(F)(F)F)c2C1	1800321661	XVBZPJJJOLWNGS-ZPOVSZSPSA-N	438.809	1.267	50	20	IDGD	
CCOc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](Br)CC)nn1	1800642622	SLYRNQUCOZGTOW-OQMKEHIESA-N	441.326	1.252	50	20	IDGD	
CCOC(=O)O[C@@H](C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](Br)CC	1800643585	XWADGIGCVQIZPW-QNSTZXKLSA-N	435.315	1.311	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ncsc1Br)C2)C(Cl)Cl	1801016264	SFJSTWKEIBWRFN-RNLVFQAGSA-N	443.150	1.913	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCc1cccc([N+](=O)[O-])c1)C2	1802332449	CWISETRHBKJCSX-BCDXTJNWSA-N	445.520	1.539	50	20	IDGD	
Cn1c(=O)n(C)c2cc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)C(Cl)Cl)ccc21	1802341836	IXAYHZXNMGFNIA-CLLJXQQHSA-N	425.316	1.933	50	20	IDGD	
O=C(c1ccccc1-n1nccn1)N1CCC2(CCCN(C(=O)[C@H](O)CCl)C2)CC1	1805527082	RKPAAWDUUOEKMF-GOSISDBHSA-N	431.924	1.712	50	20	IDGD	
CC[C@@H](NC(C)=O)C(=O)N1CC[C@@H](CNC(=O)CCBr)[C@@H]1c1cccnc1	1806337427	HUVITGLUMAZQNB-JZXOWHBKSA-N	439.354	1.787	50	20	IDGD	
O=C(CCC(F)(F)F)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1806826180	SZHPOGUFSZPLHT-VQIMIIECSA-N	449.238	1.424	50	20	IDGD	
O=C(/C=C/c1ccsc1)N1CCCC2(CCN(C(=O)c3ccc(B(O)O)cc3)CC2)C1	1807203025	QOGURBVPFKIPTO-FARCUNLSSA-N	438.358	1.986	50	20	IDGD	
C=CCSCC(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1807363373	OMCSKFFSWUFWOQ-GHTZIAJQSA-N	439.346	1.000	50	20	IDGD	
O=C(Cc1ccc2ncnn2c1)NC[C@@H]1CCN(C(=O)[C@@H](F)Cl)[C@@H]1c1cccnc1	1807406817	AIJPOXZXFHCIBR-KFKAGJAMSA-N	430.871	1.907	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCC2(CCCN(C(=O)[C@H](C)CN)C2)CC1	1809649876	DCFQNPIZMINQLX-OAHLLOKOSA-N	446.504	1.960	50	20	IDGD	
C[C@@H]1CCC[C@@H]1C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1809656112	HXGKUWTZKQPILH-ZKMOHVOUSA-N	435.333	1.517	50	20	IDGD	
Cc1nc(C(=O)N2CCC3(CCCN(C(=O)c4cccc(B(O)O)c4)C3)CC2)ccc1F	1809975080	SDUTWAPMFRGMNU-UHFFFAOYSA-N	439.296	1.368	50	20	IDGD	
O=C(CN1CCCCC1=O)NC[C@@H]1CCN(C(=O)C(Cl)Cl)[C@@H]1c1cccnc1	1812976496	GOHKOXPPOQJFGM-WMLDXEAASA-N	427.332	1.904	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)CCN2CCOCC2)[C@@H]1c1cccnc1	1813030234	FNKPXUFRAUMEIR-CMKODMSKSA-N	438.956	1.064	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)CCc2ccc[nH]2)[C@H]1c1cccnc1	1813071141	NUMWFMAUWNJGOM-MBSDFSHPSA-N	440.548	1.421	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1ccsc1)CC2)c1cccc(B(O)O)c1	1815355161	PQRUFKXYQBMZIZ-CQSZACIVSA-N	427.316	1.424	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1)c1ccc2c(c1)CNC2=O	1819201784	JIRQFHXAHXVQKF-JKSUJKDBSA-N	431.880	1.559	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819403802	GMMGWQCUGZXYFG-DZGCQCFKSA-N	433.900	1.732	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CNC(=O)c2cccnc2)[nH]n1	1822366982	GFENZSGXPDBQDT-GDBMZVCRSA-N	448.911	1.481	50	20	IDGD	
CCn1nc(C)cc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1	1822413934	IBGNAWYNTSSOAJ-INIZCTEOSA-N	444.540	1.613	50	20	IDGD	
CC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](C)NS(=O)(=O)CC)CC2	1822840340	YUABUCNCZKOGLC-VWYCJHECSA-N	436.987	1.400	50	20	IDGD	
CCc1ccnc(C(=O)N[C@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)c1	1826085191	JHODOAZKRSHVAY-AWEZNQCLSA-N	444.561	1.699	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnncc2C(=O)O)CC1	1829254668	JLGHYHVOOJUNFI-IAGOWNOFSA-N	438.912	1.662	50	20	IDGD	
Cc1nccnc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1	1829437760	ZOKRBZNDSVFILG-HXUWFJFHSA-N	436.321	1.012	50	20	IDGD	
Cc1cc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)no1	1830545780	MQXDLIDIWQRJHI-ACJLOTCBSA-N	444.326	1.013	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C1(COC)CC1)CCO2	1831383209	KPSZSJBLRCGINX-KSSFIOAISA-N	433.343	1.043	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnn4ccccc34)C2)C1	1831646099	FNHJIDJGKFRLPI-UTKZUKDTSA-N	434.924	1.812	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(CC)nn3C)C2)C1	1831651522	QKENUUWSSVIUQL-OXJNMPFZSA-N	426.945	1.460	50	20	IDGD	
CC(C)(C)OC(=O)CC(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1831986046	IUSQRAXUIHUMDE-HXUWFJFHSA-N	432.945	1.440	50	20	IDGD	
C[C@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)CCN(C)C)CC2)CC1	1833262311	NGLPULUUEMABAO-OAHLLOKOSA-N	431.419	1.541	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)Cc3cccnc3Cl)CC2)CC1)[C@H](O)CCl	1833308271	NYXHBWMQNZOYDM-QGZVFWFLSA-N	443.375	1.449	50	20	IDGD	
O=C(/C=N/O[C@H]1CCCCO1)NC1CCN(C2CCN(C(=O)[C@H](F)Cl)CC2)CC1	1835767597	GJSBEWDSHIZMFG-BVZKRWNYSA-N	432.924	1.621	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)c1cncc2cnccc12	1836087509	ADOWOSBQWOTTAH-HXUWFJFHSA-N	445.951	1.415	50	20	IDGD	
C[C@H](C(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)n1cccc1C=O	1836716546	BELFDURXMPKCLY-BEFAXECRSA-N	439.940	1.460	50	20	IDGD	
C#CCO[C@@H](C)C(=O)N1CCC(OC2CCN(C(=O)[C@H](C)Br)CC2)CC1	1836861498	BQZQBKCBBAECLY-GJZGRUSLSA-N	429.355	1.807	50	20	IDGD	
Cc1nn[nH]c1C(=O)N1CCC(OC2CCN(C(=O)CCBr)CC2)CC1	1837653479	FNIMXNILVUKZBS-UHFFFAOYSA-N	428.331	1.510	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc4ccoc4c3)C2)C1	1837711242	AEDYKKSVCQBBDD-OAQYLSRUSA-N	447.564	1.749	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(CO)o3)CCO2)C1	1837970222	GNRLAFUQWMETDH-QZTJIDSGSA-N	435.304	1.078	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCC(OC2CCN(C(=O)Cn3nccn3)CC2)CC1	1838638738	KEBQNLHUOLFDFO-GOSISDBHSA-N	432.352	1.513	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccccc3)CCO2)C1	1838849091	ROXKRWWIWGTURJ-DNVCBOLYSA-N	425.323	1.788	50	20	IDGD	
CCc1nn(C)c(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](Cl)CC)CCO3)c1Cl	1839143168	NLKODSHHUBOTHH-ORAYPTAESA-N	447.363	1.723	50	20	IDGD	
COCc1c[nH]c(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)c1	1839153647	MXAKPPXOVGGMCA-OALUTQOASA-N	448.347	1.467	50	20	IDGD	
C[C@H](C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2)n1cccc1	1839154876	APMSLULRIBPVNC-LZQZEXGQSA-N	432.348	1.742	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(CC#N)cc3)CCO2)C1	1839364316	YGYCKQDDBDGXQD-NQIIRXRSSA-N	435.908	1.076	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3nc4ccccc4o3)CCO2)C1	1839503830	ZGDXEEBRICBIKT-VLIAUNLRSA-N	437.880	1.152	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccn(CC)n3)C2)C1	1839963523	NHEIZROXKAUZKB-KBXCAEBGSA-N	443.342	1.147	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccnc3)C2)C1	1839963878	ZJMHZEBYAHONJK-MAUKXSAKSA-N	426.311	1.325	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3csc(C)c3C)C2)C1	1840150706	PLCWAUAHWXDDKB-QFBILLFUSA-N	430.954	1.689	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3cc(F)ccc3OC)CCO2)C1	1840250747	MMCGQJGOHGUXJW-UTKZUKDTSA-N	442.915	1.851	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)C3CC4(CCC4)C3)CCO2)C1	1840604862	BPGMESTVNKMTPC-KUHUBIRLSA-N	429.355	1.807	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H]2C[C@@]2(C(=O)N2CC3(CCCN3C(=O)[C@H](O)CCl)C2)C1	1841353536	CWLHAXDAJMLPOQ-ARGWCVDVSA-N	427.929	1.047	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@H](O)C[C@H]1C(=O)N1CCCC12CN(C(=O)C(Cl)Cl)C2	1843105263	QVEIGFDVAKOMAH-RYUDHWBXSA-N	436.336	1.364	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@]2(NC(=O)OC(C)(C)C)CCOC2)C1	1845208868	CYJBKVXHZRUJBG-XOBRGWDASA-N	445.944	1.127	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC12CN(C(=O)COCCNC(=O)OC(C)(C)C)C2	1846178294	OFJWFIDYRXXNTP-ZDUSSCGKSA-N	448.358	1.515	50	20	IDGD	
COc1cc(F)cc(/C=C/C(=O)N2CCCC23CN(C(=O)CCC(=O)NN(C)C)C3)c1	1846262665	RCRMRVNUKJDHAY-FNORWQNLSA-N	432.496	1.424	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@](C)(C(=O)N2CCCC23CN(C(=O)[C@H](O)CCl)C3)C1	1847015923	ABGTVLOJUFYTNC-FOIQADDNSA-N	443.972	1.827	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](NC(=O)c1ccccc1)[C@@H](C)O	1847434657	CCPOZSKMNSIRRD-RFZNHBKKSA-N	435.952	1.775	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@H](C)C(=O)NNC(=O)CS[C@H]1CCS(=O)(=O)C1	726198701	PNOUPPNRZNDASJ-OCCSQVGLSA-N	434.967	1.792	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](NC(=O)COc2ccccc2)C(C)C)cc1	726276240	NWXQZKVMJVZSMV-IBGZPJMESA-N	426.473	1.301	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NN=Cc2cc(C(=O)OC)ccc2O)c1	726737165	ARGSKNXCTQSEQB-UHFFFAOYSA-N	433.486	1.973	50	20	IDGD	
COc1ccc(-c2nn(CCC#N)cc2/C=C(\C#N)C(=O)N2CCCNC(=O)C2)cc1OC	726779968	JUWHHLMPBJMDHF-GZTJUZNOSA-N	448.483	1.736	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3cccc4c3OCCO4)cc2)CC1	728216057	OTQIFTTYGCTAGD-UHFFFAOYSA-N	432.502	1.151	50	20	IDGD	
COc1ccc(NC(C)=O)cc1S(=O)(=O)NNC(=O)c1cccc(OC(F)F)c1	728510403	IXSSZNRBSXKLOQ-UHFFFAOYSA-N	429.401	1.878	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2cc(F)cc3nc(C)c(C)nc23)n1	728732253	JBJNXFPPDRHWGG-UHFFFAOYSA-N	431.449	1.698	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)NCc1cccc(C(=O)N2CCOCC2)c1	729498872	YFBZNYXLDOIYLA-UHFFFAOYSA-N	435.484	1.644	50	20	IDGD	
CCOc1ccc(N2C[C@@H](C(=O)NNC(=S)Nc3ccc(OC)nc3)CC2=O)cc1	729693378	WHVKWTWSOGOWJI-ZDUSSCGKSA-N	429.502	1.860	50	20	IDGD	
CC(=NNC(=O)c1ccccc1F)c1cccc(N(S(C)(=O)=O)S(C)(=O)=O)c1	729818439	SSBLCXAXJOYCGS-UHFFFAOYSA-N	427.479	1.705	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCCOc1ccc(F)c(F)c1	730129335	WRWAQSMMIXTTPH-UHFFFAOYSA-N	441.460	1.589	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@@H](C(=O)NNC(=O)Cc3ccccc3F)C2)s1	731328787	YHINIZWFIXRWTN-OAHLLOKOSA-N	439.534	1.986	50	20	IDGD	
Cc1nn(-c2ccccc2)c2sc(C(=O)NNC(=O)CN3CCC(=O)NC3=O)cc12	731957703	XJIXGZUECVHKFC-UHFFFAOYSA-N	426.458	1.098	50	20	IDGD	
C[C@H]1C[C@H](C)CN(S(=O)(=O)c2ccc(S(=O)(=O)NNC(=O)C3CCC3)cc2)C1	732047922	KXXIBWMOTHGCBE-KBPBESRZSA-N	429.564	1.463	50	20	IDGD	
O=C(CN1C(=O)N[C@@]2(CCc3ccccc32)C1=O)NNC(=O)c1cnn(-c2ccccc2)c1	733108467	JSUQWCCNCPNHSY-HSZRJFAPSA-N	444.451	1.027	50	20	IDGD	
C=CCNS(=O)(=O)c1cccc(C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c1	733170193	RWOALLXXRHXNIZ-UHFFFAOYSA-N	425.470	1.411	50	20	IDGD	
CN(CC(=O)NNC(=O)c1ccc(F)cc1)C[C@H](O)COc1ccc(C(F)(F)F)cc1	733997073	JWYBJYZAPFBPND-INIZCTEOSA-N	443.397	1.977	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc2c(c1)N(CC(=O)NNC(=O)c1cccc(Cl)c1)CC2	734489045	SBCHSDUKLXYQTB-UHFFFAOYSA-N	436.921	1.414	50	20	IDGD	
O=C(NCCn1ccnc1)NNc1ccc(S(=O)(=O)NC2CCCCCCC2)cn1	735577662	WGDABAKPASLANH-UHFFFAOYSA-N	435.554	1.996	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Cc2ccccc2OC(F)F)cc1	735647561	SBSBPUSOQNEQMY-UHFFFAOYSA-N	441.456	1.607	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)[C@@H]2CSCN2C(=O)C(C)(C)C)cc1C	736818875	MFTRMFWHWNXWLP-LBPRGKRZSA-N	441.575	1.871	50	20	IDGD	
O=C(NNC(=O)N1CCN(c2ccc([N+](=O)[O-])nc2)CC1)c1cccc(Br)c1	743685300	BLCFLWWDCDAQFH-UHFFFAOYSA-N	449.265	1.929	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(C(=O)NNC(=O)c2cccc(Br)c2)ccc1F	743836910	WDXTWVGNLPNAMF-UHFFFAOYSA-N	444.282	1.913	50	20	IDGD	
Cc1nc(SCC(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)c(C#N)c(C)c1C	744578015	MLKZXQBZQINVPH-UHFFFAOYSA-N	437.481	1.847	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)[C@@H]2CCCN(C(=O)c3ccccc3)C2)cc1	744993619	FPDJIRROSAMODA-LJQANCHMSA-N	434.452	1.415	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)N[C@H]2CCN(c3cc(C)nn3C)C2=O)c1	745904303	AOILEENJSHKZGZ-KRWDZBQOSA-N	442.520	1.675	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@@H](C)CN(C)C(=O)OC(C)(C)C)cc(OC)c1OC	746816560	SEVIDAYNZVEQSE-LBPRGKRZSA-N	425.482	1.976	50	20	IDGD	
Cc1csc([C@@](O)(CC(=O)NNC(=O)Cc2nc3ccccc3n2C)C(F)(F)F)n1	746818047	MLDHEODCMKNCNK-KRWDZBQOSA-N	441.435	1.868	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)c2cnc3c(cnn3C)c2)c2ccccc2c1=O	747345531	OYHJIANTWQFPDH-UHFFFAOYSA-N	433.472	1.943	50	20	IDGD	
COc1ccc(S(N)(=O)=O)cc1C(=O)NNc1nc(-c2ccccn2)nc2c1CCC2	747988821	STXOTKCONBYTMH-UHFFFAOYSA-N	440.485	1.440	50	20	IDGD	
CCCCS(=O)(=O)N1CCC[C@@H]1C(=O)NNc1ccc(S(=O)(=O)C(F)F)cc1	748611180	GMKZNHBOUKLFHH-CQSZACIVSA-N	439.506	1.720	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)NCc2ncc(C)o2)cc1	750071419	AXCRNDYQNQPBEP-CXUHLZMHSA-N	434.456	1.954	50	20	IDGD	
CCOC(=O)c1sc(CNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)nc1C	750276074	NFYYZYVDVRMWAJ-UHFFFAOYSA-N	447.521	1.165	50	20	IDGD	
CCCCN1C(=O)CC[C@H](C(=O)NNC(=O)C(=O)NC2CC2)[C@H]1c1ccccc1OC	750873364	NXXZUDNAKREQRC-QFBILLFUSA-N	430.505	1.201	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(OCC(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)C1	751061171	SMHYOMMSWRUFGN-UHFFFAOYSA-N	435.449	1.762	50	20	IDGD	
COc1ccc2c(c1)CC[C@H](NC(=O)NNC(=O)c1sc(N3CCOCC3)nc1C)C2	753288105	SQYLTSYABXHWFX-INIZCTEOSA-N	445.545	1.798	50	20	IDGD	
CCCC[C@@H](NC(=O)[C@@H](C)NC(=O)C(C)(C)C)C(=O)NNc1cc(Cl)nc(N)n1	753450338	TWWSCCRMUOSSML-GHMZBOCLSA-N	427.937	1.381	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NCC(C)(C)C3CCCC3)nc2)CC1	753674693	RGAHTMBVQDXAEP-UHFFFAOYSA-N	438.598	1.860	50	20	IDGD	
COc1c(S(=O)(=O)NNC(=O)c2ccc[nH]2)cc(Br)c(C)c1[N+](=O)[O-]	755001516	LHKNCWOJVGRWCY-UHFFFAOYSA-N	433.240	1.626	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)NNC(=O)COc3ccccc3[N+](=O)[O-])cn2)C[C@@H](C)O1	755864226	GSTVMHLJJGVCGM-OKILXGFUSA-N	444.448	1.835	50	20	IDGD	
CCc1c(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)cnn1CCC(C)C	756154410	BTJOJKMMRWZNKJ-UHFFFAOYSA-N	429.477	1.663	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@H]2C)ccc1NC(=O)NNC(=O)[C@H](C)NS(C)(=O)=O	756246152	SWLXHSCUXRSLCP-KGLIPLIRSA-N	439.538	1.100	50	20	IDGD	
COc1cc(C#N)ccc1Oc1ccc(NC(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)cc1	756297631	NHRZVBPOJSAPRB-AWEZNQCLSA-N	444.469	1.947	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)COc2ccc(C)c(C)c2)cc1-n1nnnc1C	756321206	SHOACACTFSKTMK-UHFFFAOYSA-N	425.449	1.828	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)Nc2ccc(C)c(S(N)(=O)=O)c2)cc1OC	756639069	WHNSHNZHKIPPDC-UHFFFAOYSA-N	436.490	1.906	50	20	IDGD	
C[C@H]1C[C@H](C)CC2(C1)NC(=O)N(CC(=O)NNC(=O)c1cc(-c3cccs3)[nH]n1)C2=O	757650979	QKKPQGUEXDSMMG-RYUDHWBXSA-N	444.517	1.646	50	20	IDGD	
COC(=O)c1cc(NC(=O)NNC(=O)Cc2c[nH]c3ccccc23)cc(S(C)(=O)=O)c1	757674447	UZDFWFUFWQKZPB-UHFFFAOYSA-N	444.469	1.753	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)Nc1ccc(F)c(S(=O)(=O)NC2CC2)c1	757873142	HZCGKYUKKDMTRO-UHFFFAOYSA-N	437.409	1.641	50	20	IDGD	
C[C@@H]1CN(S(=O)(=O)c2ccc(C(=O)NNc3ncccc3[N+](=O)[O-])cc2)C[C@@H](C)O1	759298321	WXBBTECBIDZAHZ-CHWSQXEVSA-N	435.462	1.545	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(=O)n(CC(=O)NNc2cc(F)cc(OC)c2)c1	759318973	CYZWVKSHMKPPHM-UHFFFAOYSA-N	426.470	1.170	50	20	IDGD	
Cc1ccc(F)c(NNC(=O)[C@H](CCS(C)(=O)=O)NS(=O)(=O)c2ccccc2)c1	760141458	LSRFLHUAMWNOFW-INIZCTEOSA-N	443.522	1.359	50	20	IDGD	
CN(C)c1ccc2c(c1)N(C)C(=O)C2=NNC(=O)Cc1csc(N2CCOCC2)n1	761778748	XNBHRTZHZDHWQA-UHFFFAOYSA-N	428.518	1.085	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)c3c(C)oc(C)c3S(N)(=O)=O)n[nH]2)cc1	763161569	BXGNUQIDTWSKEO-UHFFFAOYSA-N	431.474	1.571	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2cccnc2)cc1NC(=O)OC(C)(C)C	763492491	XZYQUNVSIOUKHE-UHFFFAOYSA-N	429.433	1.837	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)C(=O)Nc2cnn(C[C@H]3CCCO3)c2)c1	763598505	ZYYUTJURIFHCHD-QGZVFWFLSA-N	443.504	1.659	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1ccnc(OCC(F)(F)F)c1	763628910	HMXHPSNCTBLDAZ-UHFFFAOYSA-N	436.350	1.379	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccccc2-n2nc(C)nc2C)cc1	763660695	FUBRDFRHKMMNAI-UHFFFAOYSA-N	438.444	1.058	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(Br)nc1C	763717195	QFLGEBJXKJNJEL-UHFFFAOYSA-N	435.278	1.880	50	20	IDGD	
Cc1nc(COc2ccc(NC(=O)C(=O)NNC(=O)c3cccc(N(C)C)c3)cc2)no1	763758030	LRVDRMHEVFCNJB-UHFFFAOYSA-N	438.444	1.423	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2cc(NC(C)=O)ccc2Cl)c1	763770952	BXPITJXFGYXFLS-UHFFFAOYSA-N	434.836	1.715	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)ccc1C(=O)N(C)C	763852555	YJVRZKDZYNLUFY-CYBMUJFWSA-N	430.436	1.389	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)Cc2c[nH]c3ccccc23)cc1F	763860330	DMSRWNOBVMYAFN-UHFFFAOYSA-N	428.420	1.661	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(F)cc2OCC#N)cc1OC	763901256	IVBATGWEQUYLNA-UHFFFAOYSA-N	430.392	1.535	50	20	IDGD	
O=C(NNC(=O)c1ccc[nH]1)C(=O)Nc1ccc(S(=O)(=O)c2ccc(F)cc2)cc1	763980655	KUQXSIXOUZGPJP-UHFFFAOYSA-N	430.417	1.386	50	20	IDGD	
CC(C)N(C)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1F	764003310	FRNLCWSVTJYLFB-UHFFFAOYSA-N	430.436	1.841	50	20	IDGD	
N#Cc1ccc(Cn2cnc(NC(=O)C(=O)NNC(=O)c3ccc4ccccc4c3)n2)cc1	764061914	OTTUFAOHNOSFBU-UHFFFAOYSA-N	439.435	1.751	50	20	IDGD	
O=C(CC(F)(F)F)NNC(=O)C(=O)Nc1ccccc1CS(=O)(=O)c1ccccc1	764114996	KNHIOFSHZZCMLJ-UHFFFAOYSA-N	443.403	1.699	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cccc(OC)c2O)ccc1Cl	764132346	NJGOMYPWZXRXLD-UHFFFAOYSA-N	435.820	1.631	50	20	IDGD	
CCc1noc(-c2ccc(C)c(NC(=O)C(=O)NNC(=O)[C@@H]3Cc4ccccc4O3)c2)n1	764162994	GTNJLOXBWPWBJN-KRWDZBQOSA-N	435.440	1.697	50	20	IDGD	
Cc1cc(C(=O)NC(C)C)ccc1NC(=O)C(=O)NNC(=O)c1cnn(-c2ccccc2)c1	764343013	LVSRGBBYEMDLOG-UHFFFAOYSA-N	448.483	1.719	50	20	IDGD	
Cc1cn(-c2ccc(C#N)cn2)nc1NC(=O)C(=O)NNC(=O)c1ccc(O)c(Cl)c1	764355686	FYKBGVBGGIUZCO-UHFFFAOYSA-N	439.819	1.206	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)c2cnn(C)c2)sc2c1CCCS2	764357862	CSZNZCJYJDTTNY-UHFFFAOYSA-N	437.503	1.096	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1cc(NC(=O)c2ccccc2)ccc1C	764398055	CGFKTAPFJNVNKF-OAHLLOKOSA-N	442.472	1.385	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NN=Cc3ccc(Cl)nc3)CC2)cc1	764816796	CQRMEVBFGULHKP-UHFFFAOYSA-N	435.937	1.500	50	20	IDGD	
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	765316494	SUGGWACXMMLBQH-BEFAXECRSA-N	445.545	1.946	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNc3ncnc4ccsc34)CC2)cc1	766674152	WQMQFWMKUXWJGS-UHFFFAOYSA-N	446.558	1.449	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)[C@H](NS(=O)(=O)c2ccc3ccccc3c2)C(C)C)n[nH]1	768273816	KBTZLOXTXDROHL-GOSISDBHSA-N	429.502	1.635	50	20	IDGD	
Cc1cc([N+](=O)[O-])c(S(=O)(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)cc1C	771605894	DFHYWZGHANLIHE-UHFFFAOYSA-N	440.865	1.491	50	20	IDGD	
CN(C)C(=O)Nc1ccc(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c(Cl)c1	772105297	FHSVDELPZMPDSL-UHFFFAOYSA-N	445.911	1.901	50	20	IDGD	
CCOc1ccc(C(=O)NCC(=O)NNC(=O)c2cncc(NC(C)=O)c2)cc1OCC	773081812	MLVJFZDADGOKOH-UHFFFAOYSA-N	443.460	1.028	50	20	IDGD	
CN(C)c1ccc(C2CCN(C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)CC2)cc1	773133818	BJFKLRNZNBQLCJ-UHFFFAOYSA-N	434.504	1.962	50	20	IDGD	
CN(C)c1ccc(S(=O)(=O)N(C)C)cc1NC(=O)C(=O)NNc1cccc(Cl)c1	773729048	IABIAWWIWVUNCY-UHFFFAOYSA-N	439.925	1.738	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNc2nccnc2C(C)C)cccc1S(=O)(=O)NC1CC1	773992316	OHRDKFFPLPOISA-UHFFFAOYSA-N	432.506	1.431	50	20	IDGD	
CC(C)c1nccnc1NNC(=O)C(=O)Nc1ccc(NC(=O)NC[C@H]2CCCO2)cc1	773998644	SDQUSYNEAIKCTR-MRXNPFEDSA-N	441.492	1.982	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1cnn(-c2ccccc2)n1	774001322	DXDSWUBYSGFYGE-GFCCVEGCSA-N	428.836	1.474	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN[C@@H](CC(=O)N(C)C)c2ccccc2)cc1OC	775218514	SHJDATTWMGLWFK-KRWDZBQOSA-N	428.489	1.274	50	20	IDGD	
O=C(NNC(=O)c1cc(OC(F)F)cc(OC(F)F)c1)N[C@H]1CCS(=O)(=O)C1	775671804	BLALGEWFZOZTED-QMMMGPOBSA-N	429.348	1.021	50	20	IDGD	
CCOC(=O)c1c(NC(=O)NNC(=O)c2cccc(OC)c2O)c(C#N)cn1CCOC	775765857	PWKZWBHUUKYLSF-UHFFFAOYSA-N	445.432	1.364	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccnc(OC(C)C)c2)cc1	778707560	NEVQVNSEZWOQDG-AWEZNQCLSA-N	430.461	1.821	50	20	IDGD	
COc1cccc(NNC(=O)[C@H](CCS(C)(=O)=O)NC(=O)c2ccc(Cl)cc2)n1	781024464	ZOKYTCRWFUKJDT-AWEZNQCLSA-N	440.909	1.420	50	20	IDGD	
Cc1ccc(NC(=O)c2ccccc2)cc1NC(=O)C(=O)NN[C@@]1(C)CCS(=O)(=O)C1	783427146	QDADRKLEFCHPFP-NRFANRHFSA-N	444.513	1.384	50	20	IDGD	
CC(C)(C)OC(=O)N[C@]1(C(=O)NNc2ncnc3[nH]cnc23)[C@H]2CCCO[C@H]2C1(C)C	783899527	IYEDSWOLQBLBAS-SCLGINMFSA-N	431.497	1.895	50	20	IDGD	
COc1cc(C(=O)N(C)C)ccc1NC(=O)C(=O)NNc1ccc(Br)cn1	784338770	BBMPXLAPTUYZMS-UHFFFAOYSA-N	436.266	1.636	50	20	IDGD	
CN(C1CCCCC1)S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2cccnn2)cc1	784858523	PFGIHQDYMWLPTG-UHFFFAOYSA-N	432.506	1.512	50	20	IDGD	
CCNC(=O)N(C)NC(=O)C(=O)Nc1c(C)cnn1[C@@H]1CCN(Cc2ccccc2)C1	784916338	OHOCJFSWBJERJZ-QGZVFWFLSA-N	427.509	1.270	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2ncc(F)cn2)n(-c2cccc(Br)c2)n1	784949980	SPQOUSUNTOCUDO-UHFFFAOYSA-N	434.229	1.954	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)C(=O)Nc1ccc(OCC(F)(F)F)cc1	785067839	PWBUDCRYPZDIIX-UHFFFAOYSA-N	435.362	1.604	50	20	IDGD	
COc1cc(F)cc(NNC(=O)C(=O)Nc2cnn(-c3ccccc3S(C)(=O)=O)c2)c1	785241417	IVOYZFVLTTVSSG-UHFFFAOYSA-N	447.448	1.505	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)[C@H](O)Cc2cccc(C(F)(F)F)c2)c1	785744907	LRMZKAJDGJRDHF-MRXNPFEDSA-N	435.358	1.485	50	20	IDGD	
CN(C)Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(O)cc2)cc1Br	786422700	OWYAKNSZTCRLKN-UHFFFAOYSA-N	435.278	1.616	50	20	IDGD	
O=C(CCc1ccc(O)nc1)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	786612901	FFUQOTXTVZWCGM-UHFFFAOYSA-N	432.502	1.356	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cc(OC)cc(OC)c2)c(C)cc1C	788330486	HPDULWNCFUWPRE-UHFFFAOYSA-N	429.429	1.507	50	20	IDGD	
CN1CCC/C1=N\S(=O)(=O)c1cccc(NC(=O)NNc2cc(Cl)nc(N)n2)c1	789043443	IBUGNOHRKSUKIF-ZVHZXABRSA-N	438.901	1.674	50	20	IDGD	
COc1cc(CC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc(OC)c1O	789867091	JPYKNUDSBJFETQ-UHFFFAOYSA-N	442.516	1.312	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2nnc(O)c3ccccc23)nnn1Cc1ccc(F)cc1F	790117149	VLIOCMALQKTUTO-UHFFFAOYSA-N	439.382	1.637	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)[C@H]2CC(c3cccnc3)=NO2)CC1	790651494	QBJRGFZDGNJUCN-MRXNPFEDSA-N	432.481	1.305	50	20	IDGD	
CCn1nc(C(=O)NN=C(C)c2cc(S(N)(=O)=O)c(C)cc2C)c2ccccc2c1=O	794471444	RVIJOMIIXWYAFO-UHFFFAOYSA-N	441.513	1.835	50	20	IDGD	
C=C(CBr)COC(=O)CNC(=O)c1ccc(S(=O)(=O)N(CC)CC)cc1	795312555	OONRRELOBKRIPO-UHFFFAOYSA-N	447.351	1.941	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)CN2C(=O)c3ccccc3N3C(=O)CC[C@@]23C)cc1	802052257	MFLBOXNGYNUAAO-QFIPXVFZSA-N	437.456	1.847	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)CCc2nc(O)c3ccccc3n2)cc1	802067185	OYRIXTQHNXWKGF-UHFFFAOYSA-N	429.458	1.524	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)[C@@H]2CCCCN2S(C)(=O)=O)cc1Cl	802075270	PGODEWBBHKGTSW-LBPRGKRZSA-N	434.902	1.324	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)NCCC2(O)CCC2)cc1	803704129	UINJABROUBXMJN-GHRIWEEISA-N	437.500	1.762	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)N[C@@H]1CCCN(C(=O)N2CCCC2)C1	804869029	JPPZWATUTFEPBJ-GFCCVEGCSA-N	427.303	1.401	50	20	IDGD	
CCc1ccc(N2CCN(C(=O)NNC(=O)CNC(=O)c3ccco3)CC2)cc1Cl	805044715	YTJIIPSGMVPKKO-UHFFFAOYSA-N	433.896	1.788	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CCN2C[C@@H](C)O[C@H](C)C2)cc(Br)c1OC	806339499	GKUFOJBRABXRBF-VXGBXAGGSA-N	444.326	1.727	50	20	IDGD	
N[C@](C(=O)NNC(=O)C1CCN(c2ncccn2)CC1)(c1cccc(F)c1)C(F)(F)F	806793947	VSOGARCZJGEAOA-SFHVURJKSA-N	440.401	1.396	50	20	IDGD	
Cc1cc([N+](=O)[O-])ccc1NNC(=O)C(=O)Nc1cc(C(=O)N2CCOCC2)ccc1C	807455587	PLSOTXJGFNTPLE-UHFFFAOYSA-N	441.444	1.766	50	20	IDGD	
O=C(COC(=O)C1(c2cccnc2)CCCC1)NNC(=O)[C@H]1COc2ccccc2O1	808568368	KFSTYHDNSOKKIK-GOSISDBHSA-N	425.441	1.424	50	20	IDGD	
Cn1nnc2c1C[C@@H](C(=O)NNC(=O)[C@H]1Cc3ccccc3CN1Cc1ccccc1)CC2	810273106	IMLSALPYZDSSMU-WMZHIEFXSA-N	444.539	1.695	50	20	IDGD	
CCOc1cc(Br)c(F)cc1NC(=O)C(=O)NNC(=O)c1c[nH]nc1C	810387435	WGGQVFIFCHOFLC-UHFFFAOYSA-N	428.218	1.418	50	20	IDGD	
C[C@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)[C@H]1OCCc2sccc21	814210629	HSMAHVZPQMRATH-YVEFUNNKSA-N	437.543	1.710	50	20	IDGD	
CC(C)NC(=O)C(=O)NNC(=O)C1(Cc2ccc(F)cc2Br)CCOCC1	814379849	YLYDXMUWUZPCLT-UHFFFAOYSA-N	444.301	1.600	50	20	IDGD	
CNC(=O)c1cccc(NC(=O)C(=O)NNc2cccc(Cl)n2)c1Br	815726575	KQSXTBQZTIJBRH-UHFFFAOYSA-N	426.658	1.939	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)CSc1nncn1-c1ccc(C)cc1	876010406	NSESVUXKLHLFIR-UHFFFAOYSA-N	427.486	1.903	50	20	IDGD	
COC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCN(c3ccc(F)cc3)CC2)c1	913176811	XCHGJGHKKJJAST-UHFFFAOYSA-N	436.465	1.337	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1cnn(-c2ccccn2)c1C	914749083	AMIOJPXUYYIDME-UHFFFAOYSA-N	427.490	1.252	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(NC(=S)NNC(=O)CNc2ccccc2F)c1	916112966	YXVHPHXUHXORCK-UHFFFAOYSA-N	425.511	1.506	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)NC[C@@H](c2ccc(C)o2)N2CCOCC2)c1	916228061	GQPDYBCOABMBDC-IBGZPJMESA-N	430.505	1.988	50	20	IDGD	
COc1cc(CNC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)ccc1O	916373618	KNLBMVYJCPDRPB-UHFFFAOYSA-N	448.501	1.330	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)NCc2ccc(S(=O)(=O)N(C)C)cc2)c1	916646942	WZUWNPRYKUHKDW-UHFFFAOYSA-N	436.490	1.098	50	20	IDGD	
O=C(NN=Cc1c[nH]nc1-c1ccc2c(c1)OCO2)c1csc(N2CCOCC2)n1	917539594	BUYVDXVNTISHRX-UHFFFAOYSA-N	426.458	1.862	50	20	IDGD	
CC(C)NC(=O)C(=O)NNC(=O)[C@@H]1CCC(=O)N(Cc2ccccc2)[C@H]1c1ccccc1	917622077	IZMXHMMSTSGMRP-CTNGQTDRSA-N	436.512	1.839	50	20	IDGD	
COc1ccc(-n2ccc(C(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)n2)cc1	919806289	XAVVUXJZLWFCNT-UHFFFAOYSA-N	443.485	1.206	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)N[C@H]1CC(=O)N(c2ccccc2)C1	921078395	WEQZTHALIUQUKK-AWEZNQCLSA-N	447.289	1.964	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)OCC(=O)N2CCC(C(N)=O)CC2)c(C)n1C[C@@H]1CCCO1	1115811385	AIJBYSVBIHYCSL-FJZBCQJGSA-N	442.516	1.458	50	20	IDGD	
CS(=O)(=O)Nc1ccccc1CC(=O)NNC(=O)c1cccc(Br)c1	1116136170	VDTDBHVBNMMOOJ-UHFFFAOYSA-N	426.292	1.824	50	20	IDGD	
O=C(NCc1cccc(OCC(F)(F)F)n1)NNC(=O)[C@@H]1COc2ccccc2O1	1116849739	GNHJZBILQXCOBT-AWEZNQCLSA-N	426.351	1.693	50	20	IDGD	
CC(C)c1noc(CCNC(=O)NNC(=O)COc2ccc(Br)cc2)n1	1321682992	RGFPWGHNTXWTON-UHFFFAOYSA-N	426.271	1.907	50	20	IDGD	
CC(=O)NC[C@H]1CCn2ncc(C(=O)NNc3ccc(S(=O)(=O)C(F)F)cc3)c2C1	1326306581	WMRHESVESWPBBP-LBPRGKRZSA-N	441.460	1.335	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H](C(=O)N2CC[C@]3(CN(C(=O)[C@H](F)Cl)CCO3)C2)C1	1778233980	LIRUTLGZCCKLBH-BIENJYKASA-N	433.908	1.608	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCNC(=S)NC)C1	1779375885	NRHIYAQUWCBPHB-QMTMVMCOSA-N	433.018	1.392	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(O)cn1)C2)[C@H](F)Br	1780771102	CNLTUTRTPDSMKU-JKIFEVAISA-N	430.274	1.605	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H]1Cc3ccccc3CN1)C2	1782172526	DZVAPMMQARTVNQ-GLHSZLCASA-N	449.979	1.469	50	20	IDGD	
O=C(c1onc2ccccc12)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1782348756	BNCJQRYZHPEFRJ-RHSMWYFYSA-N	426.242	1.962	50	20	IDGD	
Cn1cccc1C(=O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Br)C2	1782611066	XXOBLXIDNKRTNV-DDUZABMNSA-N	444.301	1.412	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1CCCO1)CCO2	1782866867	LINKCCBSSGJOOD-ZMMSGNDHSA-N	431.439	1.881	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3nccc4nc[nH]c34)CCO2)C1	1783347498	JWFXKLNCZGLKGS-KPZWWZAWSA-N	436.310	1.575	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)C(=O)Nc3cccnc3)CCO2)C1	1783350041	ZKFDJSNKMZCDHZ-KBXCAEBGSA-N	439.310	1.024	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cc(-c4cccnc4)[nH]n3)CCO2)C1	1783536162	FGHQRGAJXJHULX-ORAYPTAESA-N	448.321	1.699	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(C)(C)CCl)[C@H]2C1	1783856264	UCPJEIKHCBUFBG-JCECYMMASA-N	440.968	1.987	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(NC(C)=O)c(O)c3)CCO2)C1	1783881838	NDODQQQAXMDYGF-MGPUTAFESA-N	439.896	1.048	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(F)c(N(C)C)c(F)c3)CCO2)C1	1783882980	RYOVZFDGMSQNDY-VLIAUNLRSA-N	445.894	1.728	50	20	IDGD	
C[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)CBr)C[C@@H]21)n1ccnc1	1784253676	FTPLJDVYPAWMHP-QXKUPLGCSA-N	427.343	1.455	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)C3(C(C)C)CCC3)C2)C1	1784857632	CRKFNNKOEOFWJI-ALAMRGAJSA-N	443.548	1.777	50	20	IDGD	
CCOc1cnc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CO[Si](C)(C)C)C[C@@H]32)cn1	1785607466	VBYFMDWPJSDNMK-ZOBUZTSGSA-N	436.585	1.320	50	20	IDGD	
CC(=O)NCC(C)(C)C(=O)Nc1ccc(C2(NC(=O)CCC(=O)NN(C)C)CCC2)cc1	1786457955	CAJDYDOHLFVHFM-UHFFFAOYSA-N	445.564	1.656	50	20	IDGD	
Cc1nc(N)sc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21	1786918943	NHWCTAJMMJSIJJ-QFOLPQNPSA-N	435.319	1.318	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(O)nc(O)c3)[C@H]2C1	1787291949	IYBADMWPOUUVAV-XWUBHJNHSA-N	442.310	1.117	50	20	IDGD	
Cn1cnc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Cl)C[C@@H]32)c1C(F)(F)F	1787642864	YSZPGBIGBDKIMT-YVNDNENWSA-N	426.798	1.567	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)Br)[C@H]2C1	1791063974	ZJLZWJBLBSTIIZ-NDKCEZKHSA-N	435.315	1.311	50	20	IDGD	
C[C@H](C(=O)Nc1ccc(C2(NC(=O)CCC(=O)NN(C)C)CCC2)cc1)n1ccnn1	1791105688	VSQFCOXFHYRUTR-OAHLLOKOSA-N	427.509	1.346	50	20	IDGD	
C[C@@H](Cc1ccccc1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2C1	1791293320	UYBKBZGKHSRSDF-VMXMFDLUSA-N	444.576	1.218	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3Cc4ccccc4CN3)C[C@@H]21)C(Cl)Cl	1791295598	PPDYXHSQALSKBA-QAETUUGQSA-N	426.344	1.484	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](CN)c1ccccc1)C2	1792867952	ONTJXQUIYGXNIM-FWEDZOCSSA-N	438.366	1.350	50	20	IDGD	
CCc1[nH]nc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)CBr)c1F	1792870190	LWFXSJWPVARLAP-DYNIEEOBSA-N	431.306	1.345	50	20	IDGD	
COc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)CBr)cc1	1792872689	WPDVEBRFBPHJQJ-FAYQHZLMSA-N	425.323	1.929	50	20	IDGD	
C[C@H](CBr)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnn3c1OCCC3)C2	1792990869	OQEBPIBQZNFUIE-YIYPIFLZSA-N	425.327	1.948	50	20	IDGD	
Cc1cnc(Cl)c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)c1	1795347431	JNVCUZBRFFFALT-BTTYYORXSA-N	442.907	1.608	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCC1CCCC1)C2	1796441294	VDDDTBNDBLBHSP-CUCQEMJRSA-N	443.548	1.680	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CS[C@@H]1CCCCO1	1797800174	ODLXZXJDIKNNKP-CNRIWFPOSA-N	435.384	1.619	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Br	1799343532	ZRXGCFJDKAZQKL-KAMPLNKDSA-N	430.112	1.298	50	20	IDGD	
Cc1cccnc1CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Br	1799344827	WKIKTUQJBKITJZ-DLTLXFJOSA-N	428.302	1.603	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1(c3ccc(O)cc3)CC1)C2	1800753863	ADHAEEIDRJKNIH-ZJOBFFGXSA-N	437.334	1.797	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)NC(=O)OC(C)(C)C	1800863485	ZGWUENNTUWKZRI-IBEHDNSVSA-N	431.961	1.897	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnn2c1OCCC2	1800937596	IZIZAFHARYFAAL-YIYPIFLZSA-N	425.327	1.948	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)COCc1ccc(OC)cc1	1801108145	MNPUYRXGTYECAE-YNVMFWSZSA-N	440.924	1.055	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)[C@H](O)c1ccccc1Cl	1801199387	BTFONDLSYYDFFF-QFWNWRTJSA-N	449.704	1.654	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1(F)CCC1	1801619132	GCTSGFVYAQRIPQ-XGUBFFRZSA-N	447.935	1.600	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(N2C(=O)C=CC2=O)cc1	1801868908	MCOHRRAYTPJPSU-DOHHPOSVSA-N	445.903	1.337	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCc1cnccn1	1803043051	CSANUKUGTXAQKZ-MVUGMWCJSA-N	437.504	1.181	50	20	IDGD	
CC(C)(C)OC(=O)CC(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]1c1cccnc1	1803136700	TZFQQHSWEQUDLE-IIDMSEBBSA-N	425.913	1.419	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccccc1[N+](=O)[O-])c1cccc(B(O)O)c1	1804338868	YTXIDBQFPPQUIS-FCJRBGQTSA-N	449.272	1.240	50	20	IDGD	
COc1cnc(C(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@H]2c2cccnc2)c(F)c1	1805078782	VMLUNSCVQWPAAW-XCRHUMRWSA-N	436.871	1.544	50	20	IDGD	
COC(=O)c1ccc(CC(=O)N2CCC3(CCCN(C(=O)[C@@H](O)CCl)C3)CC2)cc1	1805528673	XFFAPIYHFQLULY-SFHVURJKSA-N	436.936	1.847	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)CN2CCOCC2)[C@H]1c1cccnc1	1806913071	PPNNQCXPQRLBIT-YXJHDRRASA-N	439.354	1.203	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc(O)cc2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1	1807374447	HIBLKQCHFHQICM-UGKGYDQZSA-N	445.284	1.100	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)[C@H](C)N2CCN(C)CC2)[C@H]1c1cccnc1	1807904792	BSBCQNVUVLHRGH-FRYIKTPZSA-N	436.000	1.741	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)[C@]3(F)CCCC=C3F)CC2)C1	1809972055	AFXPVZNYMDOFCQ-QHCPKHFHSA-N	446.303	1.957	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)c[nH]1	1810303020	OKAVKSLAJISBJY-OXQOHEQNSA-N	447.499	1.350	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2ccccc2C(N)=O)[C@H]1c1cccnc1	1811289060	FRMKQTANOLQCCB-AYOQOUSVSA-N	444.919	1.754	50	20	IDGD	
CCNC(=S)NCC(=O)NC[C@@H]1CCN(C(=O)[C@H](Cl)CC)[C@@H]1c1cccnc1	1812333190	SUXJOWALOVVHTP-ZMSDIMECSA-N	425.986	1.589	50	20	IDGD	
C[C@H](C(=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@@H]1c1cccnc1)n1ccnn1	1812398996	ZTYXZONQEAPSSB-FAAHXZRKSA-N	439.289	1.631	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)Cc2cnn(C)c2)[C@H]1c1cccnc1	1813459979	OUYNIDHHDGUYOR-FDQGKXFDSA-N	434.338	1.847	50	20	IDGD	
CN(C)C(=O)NCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCBr)[nH]n1	1814561014	LBDKYRFABJODNV-LBPRGKRZSA-N	429.319	1.458	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](C)NS(=O)(=O)CC)n[nH]1	1815167449	KKTLDIMLPLTCLR-OBJOEFQTSA-N	433.962	1.747	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1cccs1)CC2)c1cccc(B(O)O)c1	1815355110	NDCYDRPHJMNGIV-CYBMUJFWSA-N	427.316	1.424	50	20	IDGD	
O=C(/C=C/c1ccco1)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1815947654	COOSXWDLMFUZME-JBVUFVISSA-N	434.261	1.702	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccon1)CC2	1817277247	NKAFGXOWGBRSJQ-BPDROILWSA-N	441.473	1.491	50	20	IDGD	
CC(=O)Nc1cc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@H](O)CCl)CC3)ccn1	1817904033	AZZDPANIZOXROI-DGCLKSJQSA-N	437.909	1.322	50	20	IDGD	
COCc1c[nH]c(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)CCC(=O)NN(C)C)CC3)c1	1821292309	KSORDOBMAPJWMH-ZDUSSCGKSA-N	448.549	1.216	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1	1822374328	JGDIKJRUMBAXEV-GXTWGEPZSA-N	428.921	1.029	50	20	IDGD	
CN1CCC(CC(=O)N2CCCC[C@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1	1823862873	SFYAROAHGJYCSG-NRFANRHFSA-N	449.640	1.711	50	20	IDGD	
Cc1cc(C)n(CC(=O)N2CCCC[C@@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)n1	1825244626	HQFOFLRXOTWJRV-HXUWFJFHSA-N	446.596	1.493	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(O)nc(O)c1)CC2	1825641042	GNGQRANQQNZNSJ-APPZFPTMSA-N	441.307	1.959	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](Cl)COC)sc2C1	1826000103	KWPWRFRVOWFKEU-MXWKQRLJSA-N	431.946	1.017	50	20	IDGD	
CCC[C@H](NC(C)=O)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](Cl)COC)CC2	1828131443	BZFJYAGRVUOBEJ-SCRDCRAPSA-N	430.958	1.614	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H](F)Br)CC1	1829091624	IIVFIMLHDJQNRG-XPKDYRNWSA-N	432.334	1.987	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(Cl)nc3)CCO2)C1	1829511794	FOEPRJKJRYYNGH-SJKOYZFVSA-N	446.729	1.588	50	20	IDGD	
C[C@@H]1CC[C@H](C(=O)N2CCOC[C@@]3(CN(C(=O)[C@@H](C)CBr)CCO3)C2)O1	1830540958	XCGNNIHJTDCXRM-LUXYFRNMSA-N	433.343	1.041	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)cn1	1831943402	NAUBGQVXIQFBIX-HXUWFJFHSA-N	425.913	1.425	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3ccco3)CCO2)C1	1833044675	RGQQMEGNLNINPI-DNVCBOLYSA-N	443.338	1.700	50	20	IDGD	
COc1ccc(CC(=O)N2CCC(N3CCC(NC(=O)[C@H](O)CCl)CC3)CC2)cc1	1833308841	AJLZNVUHLXOOFL-HXUWFJFHSA-N	437.968	1.409	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cccc(=O)n3O)CC2)CC1	1833961205	PAGSAHUMTZLUNC-KRWDZBQOSA-N	438.956	1.678	50	20	IDGD	
O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)c1ccnc(Cl)c1)CCO2	1834180691	CBWQBSUNDATCJA-KRWDZBQOSA-N	446.729	1.590	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CCN3CCCCC3)CCO2)C1	1835135432	JZIORQSMNYAJOT-QFBILLFUSA-N	446.386	1.102	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCC(OC2CCN(C(=O)[C@@H]3CCNC(=O)C3)CC2)CC1	1836624103	BQFBZUNSTBMIAQ-OAHLLOKOSA-N	427.973	1.776	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(Cl)cn1)CCO2	1837897700	GRUBTYXAUQQADX-LJQANCHMSA-N	441.988	1.657	50	20	IDGD	
CCC[C@@H](NC(C)=O)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](Cl)COC)CC2)CC1	1838785944	LGKVHVBIHOOIGN-RBUKOAKNSA-N	445.988	1.544	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)COc3ccccc3OC)C2)C1	1839141514	KJKVWEXMMOWESX-HRAATJIYSA-N	440.924	1.548	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cccc(OC)n3)C2)C1	1839142126	FKEQBUUDRUUPML-OXQOHEQNSA-N	425.913	1.107	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)COc3cc(Cl)ccn3)C2)C1	1839145443	HXOWBRXANOZHNG-DNVCBOLYSA-N	446.331	1.588	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)C#Cc3ccccc3)C2)C1	1839151407	QNFDCTKDHJRGCQ-SFTDATJTSA-N	439.339	1.731	50	20	IDGD	
O=C(/C=C/c1cccs1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839198760	ATRDKQAMUDJZBZ-GILVVUIESA-N	447.326	1.908	50	20	IDGD	
CC(C)=NO[C@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1	1839226338	LTGCUUZVVOKZOH-OLMNPRSZSA-N	438.352	1.480	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(F)c3Cl)CCO2)C1	1839324605	PVKNJDXLISFPSO-KUHUBIRLSA-N	449.306	1.803	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc4c3NC(=O)C4)CCO2)C1	1839572221	MHKGJVFFASDHCY-HTAPYJJXSA-N	449.935	1.659	50	20	IDGD	
CCOC(=O)O[C@@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1839680503	JNSBRPJCWNUNKL-LIRRHRJNSA-N	434.917	1.269	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cccs3)C2)C1	1839963962	BFMZVLCDTRMWCY-MAUKXSAKSA-N	445.379	1.921	50	20	IDGD	
CCc1noc(C)c1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2	1840033326	ALJHLSDJFSVDBH-XIKOKIGWSA-N	444.326	1.399	50	20	IDGD	
O=C(c1cc2cnccc2[nH]1)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840188736	ZRIUMQXKBGJDHW-SFHVURJKSA-N	427.288	1.437	50	20	IDGD	
O=C(C(Cl)Cl)N1CCO[C@]2(COCCN(C(=O)[C@H]3CCc4ccccc4O3)C2)C1	1840191002	ZEXTYELUBXCENT-UZLBHIALSA-N	443.327	1.640	50	20	IDGD	
C=CC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1	1841352608	AOKCMSMUGMCPTO-MSOLQXFVSA-N	449.935	1.661	50	20	IDGD	
O=C(Cc1cc(Br)ccc1O)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1	1841352616	AZFBTGRABRHTLY-AWEZNQCLSA-N	431.714	1.500	50	20	IDGD	
CCN(CC)C[C@@H](C)C(=O)N1CC2(CCCN2C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C1	1843416986	LFAKVEVPMXEAPH-LXUZAUPUSA-N	430.553	1.302	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)[C@H](C)n1cc(C)cn1)C2	1843417351	YUCJCCWLSBWYEW-WTJYETQFSA-N	425.493	1.090	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)N1CCCC12CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)C2	1844231538	XGDZRNGKBQSIJC-BRYYZUPOSA-N	445.470	1.783	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC2(CCCN2C(=O)[C@H]2CC[C@H]3CCC(=O)N3C2)C1	1845074780	FIYIKMBBUAVRKV-KKUMJFAQSA-N	426.355	1.764	50	20	IDGD	
CC(C)(C)OC(=O)N1CC2(CC(C(=O)N3CCCC34CN(C(=O)[C@H](O)CCl)C4)C2)C1	1846136596	WEVKSNBHXRUWOZ-OAHLLOKOSA-N	441.956	1.437	50	20	IDGD	
CC(=O)C[C@@H](C)C(=O)N1CCCC12CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2	1846328262	YJURNAOLQUFYCC-CYBMUJFWSA-N	431.445	1.952	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@]1(O)CCN(C(=O)OC(C)(C)C)C1	1847867881	LVBPZHZZGMNDNW-OSAWLIQMSA-N	443.972	1.968	50	20	IDGD	
Cc1cccc2c1N=C(O)/C2=N/NC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	3573884	VCLOBWFFFKTWPA-UHFFFAOYSA-N	428.470	1.752	50	20	IDGD	
CNS(=O)(=O)c1ccc(Cl)c(C(=O)OCC(=O)NNC(=O)c2ccc(C)cc2)c1	11106938	OJNGOIXXTWGTHK-UHFFFAOYSA-N	439.877	1.175	50	20	IDGD	
CCn1c(NNC(=O)CCc2ccc(S(=O)(=O)NC)cc2)nc2ccccc2c1=O	11159274	HSVUDEJDFLCCSL-UHFFFAOYSA-N	429.502	1.400	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Cn2nc(-c3ccccc3)oc2=O)ccc1OC(C)C	16497109	LJELFDSALGFMHI-UHFFFAOYSA-N	426.429	1.760	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cc(S(C)(=O)=O)ccc2Cl)cc(OC)c1OC	23655438	LZUFFPXPLVMUAG-UHFFFAOYSA-N	442.877	1.844	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)Cn1c(S)nnc1-c1cccs1	25414395	NCNGLMWWKWNAQU-UHFFFAOYSA-N	433.515	1.920	50	20	IDGD	
Cc1c(/C=C(\C#N)C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc(C#N)n1C	25672312	COSCEPJXRUFTHN-XSFVSMFZSA-N	445.527	1.472	50	20	IDGD	
COc1ccc(C(=O)NCC(=O)NNC(=O)c2cc(-c3ccccc3)on2)cc1[N+](=O)[O-]	28792771	BZWSWOFKUCWHSJ-UHFFFAOYSA-N	439.384	1.449	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNS(=O)(=O)c2cc([N+](=O)[O-])ccc2OC)cc1	28808353	MRWCJKRMADLWKG-LBPRGKRZSA-N	439.446	1.779	50	20	IDGD	
Cc1nc2cc(F)ccc2cc1C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	115377925	VFDDTPLKMHGDMV-IBGZPJMESA-N	439.399	1.827	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NCc1cccc(OCc2ccccn2)c1	725874008	URJDQWWKQZTLFU-UHFFFAOYSA-N	439.497	1.983	50	20	IDGD	
C[C@]1(c2ccc(CNC(=O)NNC(=O)c3cccc4cccnc34)cc2)NC(=O)NC1=O	726281814	DUDVRYVLGIYWNI-JOCHJYFZSA-N	432.440	1.434	50	20	IDGD	
COc1ccc(OCCCS(=O)(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1	727355453	SBJNONRZVBZXSR-UHFFFAOYSA-N	442.515	1.132	50	20	IDGD	
C#Cc1cccc(NC(=S)NNC(=O)c2cc(Cl)c(OCC(N)=O)c(OC)c2)c1	727498170	SQIYCEHUZGRIDO-UHFFFAOYSA-N	432.889	1.825	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(Cl)c([N+](=O)[O-])c1)C1CCN(c2ncccn2)CC1	728856472	SAYJDTPTJDGMJN-UHFFFAOYSA-N	440.869	1.264	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)Cc2cccnc2)c(Br)cc1F	728856600	WZTCDPOLKWKESC-UHFFFAOYSA-N	446.254	1.322	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CCCCC/N=C2/NS(=O)(=O)c3ccccc32)c1	728872075	KMSFCSYGYNDJCA-UHFFFAOYSA-N	439.497	1.618	50	20	IDGD	
CCN(CC)[C@H](CNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)c1ccco1	729051368	RKISYBAXAKEZJC-QGZVFWFLSA-N	429.525	1.700	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cccc3ncccc23)cc1	730225542	JNNMZAWXKJCTHL-UHFFFAOYSA-N	428.470	1.234	50	20	IDGD	
CC(Cc1ccc(-c2ccccc2)cc1)=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O	730569120	OICRYEADPVGIKG-UHFFFAOYSA-N	437.525	1.973	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)c1ccc(C)c(S(=O)(=O)NCC#N)c1	731184507	ZRAQTFFIHRDTEI-UHFFFAOYSA-N	436.877	1.534	50	20	IDGD	
O=C(NNC(=O)c1cc(O)nc2ccc([N+](=O)[O-])cc12)c1csc(N2CCOCC2)n1	731874394	IBMIEGXSYRIBMF-UHFFFAOYSA-N	444.429	1.217	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N2CCN(C(=O)N(C)C)CC2)cc1Br	732255707	KSDHDKWJZMRIIS-UHFFFAOYSA-N	428.287	1.111	50	20	IDGD	
O=C(COC(=O)[C@H]1CCCN(CC(F)(F)F)C1)NNC(=O)c1cccc([N+](=O)[O-])c1	732331531	DKOJUMCWRQSXIU-LBPRGKRZSA-N	432.355	1.173	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)c1cc(Cl)nc(N2CCCC2)c1	732949041	CMHNEIFKBJDQRK-UHFFFAOYSA-N	436.925	1.703	50	20	IDGD	
CS(=O)(=O)c1ccc(OCCCC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1	733110198	GROFXWCCERSTKN-UHFFFAOYSA-N	442.497	1.896	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)[C@H]1CCCN(C(=O)c2ccccc2)C1	734242083	RNRPLBAQKSRSCN-INIZCTEOSA-N	433.509	1.394	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)CNC(=O)c1cc(F)cc(F)c1	734252705	CMWMOFVTKGCQRB-UHFFFAOYSA-N	440.472	1.915	50	20	IDGD	
COc1ccc([C@H]2[C@H](C(=O)NNC(=O)COc3ccccc3O)CCC(=O)N2C)cc1	734433287	CDOLEUTXXJAQPT-IERDGZPVSA-N	427.457	1.537	50	20	IDGD	
CC(C)[C@H](CNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)NC(=O)OC(C)(C)C	734526979	JXIKWPHUWDLUBF-INIZCTEOSA-N	449.556	1.573	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N[C@H](C)CN2CCN(c3ccccn3)CC2)cc1OC	735517720	FSGDNECICBAPSR-MRXNPFEDSA-N	442.520	1.254	50	20	IDGD	
O=C(CCNC(=O)c1ccc(Br)cc1)NNC(=O)COCc1ccccc1	737636755	DRDAOEGQHWDCJC-UHFFFAOYSA-N	434.290	1.933	50	20	IDGD	
Cc1ccc(OCC(=O)N2CCN(C(=O)NNC(=O)COCc3ccccc3)CC2)cc1	738496755	WVGWBWYCLGBIQT-UHFFFAOYSA-N	440.500	1.476	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCCCOC[C@@H]1CCOC1	740903204	JMKVVALJJIUIKG-KBPBESRZSA-N	444.326	1.990	50	20	IDGD	
CCn1c(NNC(=O)[C@H]2CCCCN2C(=O)c2ccc(O)nn2)nc2ccccc2c1=O	742243214	OTLSMMJRLBPPGH-MRXNPFEDSA-N	437.460	1.050	50	20	IDGD	
CC(C)(C)OC(=O)NCc1ccc(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)o1	742635512	SBHARHDMYGGJPS-UHFFFAOYSA-N	444.492	1.772	50	20	IDGD	
CCc1nsc(N2CCCN(C(=O)NNC(=O)c3cc(Br)c[nH]3)CC2)n1	743507880	FQRHNYJPGAAPDY-UHFFFAOYSA-N	442.343	1.758	50	20	IDGD	
CCn1c(O)nc2cc(C(=O)NNC(=O)c3cc(Br)ccc3O)ccc2c1=O	743731256	MYQQNZVSEAMLFB-UHFFFAOYSA-N	447.245	1.665	50	20	IDGD	
Cc1nc(COc2ccccc2C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)no1	744530927	CAWJSMQEPMHQIQ-UHFFFAOYSA-N	435.396	1.447	50	20	IDGD	
O=C(NCCCC(=O)N1CCc2ccccc21)NNC(=O)c1cc([N+](=O)[O-])ccc1O	745816063	RYQKPSXDKRYBAI-UHFFFAOYSA-N	427.417	1.614	50	20	IDGD	
CCCN(CC)CCNC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	746770370	NDNZNEOSMSJXED-UHFFFAOYSA-N	425.555	1.147	50	20	IDGD	
Cc1cc(C(=O)NNS(=O)(=O)c2ccc(-n3cnnn3)cc2)c(C)n1-c1ccccc1	747410660	ZVJDJQDYRQMORK-UHFFFAOYSA-N	437.485	1.693	50	20	IDGD	
O=C(Cn1c(=O)ccn(Cc2ccccc2)c1=O)NNC(=O)c1cccc2cccnc12	747428823	OFFXQYRFATYUAU-UHFFFAOYSA-N	429.436	1.068	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)CCCN1C(=O)c2ccc(Br)cc2C1=O	747597344	ISAXMACYSDHZMU-UHFFFAOYSA-N	433.262	1.625	50	20	IDGD	
O=C(CCNC(=O)c1ccco1)NNc1ccc(S(=O)(=O)Nc2nccs2)cc1	747943587	KFVRDEVYHBGEJT-UHFFFAOYSA-N	435.487	1.800	50	20	IDGD	
NS(=O)(=O)c1ccc(OCC(=O)NNC(=O)c2ccc(COc3ccccc3)o2)cc1	749403008	DVWWDWWJUDRFSA-UHFFFAOYSA-N	445.453	1.346	50	20	IDGD	
CC(C)(C)N1C[C@H](NC(=O)NNC(=O)COc2ccc(Br)cc2)CC1=O	750659239	FJIPMQKRXWTKMY-GFCCVEGCSA-N	427.299	1.558	50	20	IDGD	
O=C(NN=C1C(=O)N(Cc2ncon2)c2ccc(Br)cc21)c1ccccn1	750913124	WFRWMYUWDOANDK-UHFFFAOYSA-N	427.218	1.908	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)[C@@H](CCS(C)(=O)=O)NC(=O)c2ccc(Cl)cc2)o1	752779857	UQWGGFLJSOCGPY-CQSZACIVSA-N	441.893	1.236	50	20	IDGD	
Cc1c(Br)cc(C(=O)NNC(=O)CNC(=O)c2cccnc2)cc1[N+](=O)[O-]	753298481	JOWVYTPTNNWROS-UHFFFAOYSA-N	436.222	1.252	50	20	IDGD	
O=C(CCOC1CCOCC1)NNc1ccc(S(=O)(=O)Nc2nccs2)cc1	753341188	GCLSYPQXPKUXKN-UHFFFAOYSA-N	426.520	1.973	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)NC[C@H]2CCCN2S(C)(=O)=O)c(C)n1-c1ccccc1	753697605	RADRPVBVWNIKFY-QGZVFWFLSA-N	433.534	1.462	50	20	IDGD	
COC(=O)c1cc2c(cc1NC(=O)C(=O)NNc1ccc(C(F)(F)F)nn1)OCO2	753853959	YMXVAKLLLIYDSQ-UHFFFAOYSA-N	427.295	1.093	50	20	IDGD	
COCC(C)(C)C=NNC(=O)C[C@@H]1c2cc(OC)c(OC)cc2CCN1S(C)(=O)=O	754918181	RACNJIYOHWCTPX-MRXNPFEDSA-N	441.550	1.727	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCCC(=O)NNc2ccc(C(F)(F)F)nn2)cc1	755189468	KMLNZHNGYLZOBR-UHFFFAOYSA-N	433.412	1.706	50	20	IDGD	
CSC[C@H](C(=O)NNc1ccc(C(F)(F)F)nn1)N1C(=O)[C@H]2CCCC[C@@H]2C1=O	755191543	IQZOAPPJZLBHMK-GARJFASQSA-N	431.440	1.845	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)c2coc(S(=O)(=O)N(C)C)c2)cc1	755409368	GPGGTDKEUMDRSD-GFCCVEGCSA-N	425.463	1.157	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Nc2cccc(-n3cnnn3)c2C)cc(OC)c1OC	755443361	GFMRZUKXENBADD-UHFFFAOYSA-N	427.421	1.463	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc1	755798589	ZIQDSIFYHKSXEE-UHFFFAOYSA-N	425.401	1.596	50	20	IDGD	
CN1CCC/C1=N\S(=O)(=O)c1ccc(NC(=O)NNC(=O)c2ccc(C#N)cc2)cc1	756071538	GMZNSEZOTRMDPM-XIEYBQDHSA-N	440.485	1.838	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)Nc1cc(Cl)ccc1OC[C@H]1CCCO1	756207351	QUKRYZOKRXNQGO-DGCLKSJQSA-N	431.898	1.485	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)Nc2ccc(C)c(N3CCCS3(=O)=O)c2)c1O	756707422	ZBNVOKPZRKWZDZ-UHFFFAOYSA-N	434.474	1.716	50	20	IDGD	
CC(C)CN1C(=O)C(=NNC(=O)[C@@H]2CCS(=O)(=O)C2)c2cc(Br)ccc21	756882375	WCCBPAGPUREMSY-LLVKDONJSA-N	442.335	1.707	50	20	IDGD	
CC[C@H]1CN(CC(=O)NNC(=O)c2cccc(C#N)c2)CC[C@@H]1NC(=O)OC(C)(C)C	757113860	ZSZLWTNYTBYGMQ-WMZOPIPTSA-N	429.521	1.944	50	20	IDGD	
CC(=NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1cc(F)cc(F)c1O	757451212	LBXBHAHOVFBEJH-UHFFFAOYSA-N	439.440	1.845	50	20	IDGD	
O=C(COC(=O)c1cncc(-c2ccccc2)c1)NNC(=O)[C@H]1COc2ccccc2O1	758111807	ZGWRMLGKBKRGGV-HXUWFJFHSA-N	433.420	1.893	50	20	IDGD	
O=C(NNc1nc(O)c2ccccc2n1)c1cccc(S(=O)(=O)NC[C@@H]2CCCO2)c1	758310411	BVOVORMJHYZEFI-AWEZNQCLSA-N	443.485	1.550	50	20	IDGD	
O=C(NCc1cccc(NC(=O)c2ccccn2)c1)NNC(=O)C(=O)Nc1ccccn1	758706552	CGQQMAYUIRDPLK-UHFFFAOYSA-N	433.428	1.198	50	20	IDGD	
CN1C(=O)C[C@@H](C(=O)NNC(=O)C(=O)Nc2ccccn2)[C@H]1c1ccc(Cl)c(F)c1	759364850	PKBKTHGDIOVZQS-BDJLRTHQSA-N	433.827	1.180	50	20	IDGD	
C[C@@H](CO)CCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	759630347	BNTWFNMZDNRGSH-OAHLLOKOSA-N	426.539	1.214	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cnn(CCO[C@@H]3CCCCO3)c2C)cc1C	759755994	CXNQACQZJJSWTG-LJQANCHMSA-N	443.504	1.751	50	20	IDGD	
Cn1c(=O)c2c(nc(Cl)n2CC(=O)/C(C#N)=C2/Nc3ccccc3S2)n(C)c1=O	760069645	DNOVMWOMVLBPKT-DHDCSXOGSA-N	428.861	1.609	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1ccc(F)c(Cl)c1F	761105748	JQNIJAKIBCZRQD-UHFFFAOYSA-N	436.846	1.837	50	20	IDGD	
O=C(NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)NC1CCC(F)(F)CC1	761776750	VKRYWUOGOBWYDP-UHFFFAOYSA-N	430.477	1.993	50	20	IDGD	
O=C(NCc1ccc(C(=O)Nc2ccc(F)cc2)cc1)NNC(=O)C(=O)N1CCCC1	761779053	CRLYLBPCMNZXSL-UHFFFAOYSA-N	427.436	1.531	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2ccccc2)cccc1S(=O)(=O)NC(C)(C)C	763419370	CYGNQLVQBHIZGS-UHFFFAOYSA-N	432.502	1.472	50	20	IDGD	
COC(=O)c1cc(Br)c(F)cc1NC(=O)C(=O)NNC(=O)c1ccncc1	763464562	NPDFXOBAGUQHRH-UHFFFAOYSA-N	439.197	1.170	50	20	IDGD	
CCOc1cc(NC(=O)C(=O)NNC(=O)c2ccccc2O)c([N+](=O)[O-])cc1OCC	763527595	ONNHFICEBSJNLT-UHFFFAOYSA-N	432.389	1.498	50	20	IDGD	
COc1ccc(OC(C)C)c(NC(=O)C(=O)NNC(=O)c2ccc(OC)c(OC)c2)c1	763550258	BOESDENOYOMMIH-UHFFFAOYSA-N	431.445	1.899	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)N2C[C@H](CC(=O)N(C)C)c3cc(Cl)ccc32)c(C)o1	763581643	CGIBVWMQAYHCCS-ZDUSSCGKSA-N	446.891	1.920	50	20	IDGD	
COCCn1ncc2ccc(NC(=O)C(=O)NNC(=O)COc3ccc(C)c(C)c3)cc21	763666477	FXTWKAFMPDJYBP-UHFFFAOYSA-N	439.472	1.464	50	20	IDGD	
CC(C)n1cnnc1-c1ccccc1NC(=O)C(=O)NNC(=O)COc1ccc(C#N)cc1	763675695	YWVVKTVHBGUYBR-UHFFFAOYSA-N	447.455	1.563	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccc(N2CCCC2)c1	763681372	KLRAUWXWTJIYSO-UHFFFAOYSA-N	426.473	1.850	50	20	IDGD	
C[S@@](=O)Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)ccc1Cl	763682736	YZLCJALAHDWGKH-SSEXGKCCSA-N	448.888	1.255	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2ccccc2OCC2CC2)c2ccccc2c1=O	763786424	NUNBKIKUJVTSKY-UHFFFAOYSA-N	449.467	1.605	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccccc1C(=O)N1CCCC1	763837549	ILMGSMXQRJBDRH-UHFFFAOYSA-N	428.420	1.227	50	20	IDGD	
COC(=O)c1cc(OC)ccc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccccc2)on1	764010795	DJDLTARSYIOSJQ-UHFFFAOYSA-N	438.396	1.537	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)[C@@H]1CCCN1S(=O)(=O)c1cccs1	764043773	WGUITJKFEOKPRG-LBPRGKRZSA-N	441.556	1.547	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccccc1CN1C[C@H](C)O[C@@H](C)C1	764047632	JPNAQPIZQZMHSY-HOTGVXAUSA-N	440.500	1.704	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(Br)c2)cc1[N+](=O)[O-]	764063736	XHCNFYZJNQLTJA-UHFFFAOYSA-N	437.206	1.766	50	20	IDGD	
Cc1nnnn1-c1cccc(NC(=O)C(=O)NNC(=O)Cc2ccc3ccccc3c2)c1	764083208	QADHFYJRKYWYRA-UHFFFAOYSA-N	429.440	1.453	50	20	IDGD	
CC(C)(C)[S@@](=O)Cc1cccc(NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)c1	764164640	SASWOXKMORACJW-OKXSDPAFSA-N	443.525	1.823	50	20	IDGD	
CC(C)(C)NS(=O)(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)CC2CCCC2)c1	764184854	SVGZDSNOZHYMOW-UHFFFAOYSA-N	438.550	1.571	50	20	IDGD	
O=C(CCc1ccccc1)NNC(=O)C(=O)Nc1ccc(CCN2CCSCC2)cc1	764192865	PVQRWLUJRAGVSK-UHFFFAOYSA-N	440.569	1.997	50	20	IDGD	
CCOC(=O)c1cnn(-c2cccc(NC(=O)C(=O)NNC(=O)CCC(C)C)c2)c1C	764204537	XXRAPKQLQQRUMQ-UHFFFAOYSA-N	429.477	1.880	50	20	IDGD	
CS(=O)(=O)CCc1ccc(NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)cc1	764245410	SYTIJOKALRRHHE-UHFFFAOYSA-N	442.497	1.015	50	20	IDGD	
CCNC(=O)N1CCc2ccc(NC(=O)C(=O)NNC(=O)c3cc4ccccc4o3)cc21	764331496	XFGKXVAUOMZRHU-UHFFFAOYSA-N	435.440	1.925	50	20	IDGD	
COc1cc(C(=O)N(C)C)ccc1NC(=O)C(=O)NNC(=O)c1ccc(O)c(Cl)c1	764349112	IQIBBFIXMSIIQA-UHFFFAOYSA-N	434.836	1.156	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)c(Cl)c1)C(=O)Nc1cccc(CN2CCCC2=O)c1	764349665	SCDJIOWEWZQZRT-UHFFFAOYSA-N	430.848	1.568	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(Br)cnc2-n2cccn2)o1	764370599	GAHSCURZQXGTJC-UHFFFAOYSA-N	433.222	1.331	50	20	IDGD	
COC(=O)c1csc(NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)c1C	764383049	VDFZCQSOYGATPU-UHFFFAOYSA-N	433.471	1.694	50	20	IDGD	
COc1cc(C)ccc1Oc1ccc(F)cc1NC(=O)C(=O)NNC(=O)[C@@H]1COCCO1	764424027	GBPJHWKUBFUYIC-SFHVURJKSA-N	447.419	1.436	50	20	IDGD	
O=C(NNC(=O)[C@H]1COCCO1)C(=O)Nc1ccc(Br)c(Cl)c1Cl	764432673	JILQQENTPUIJAM-MRVPVSSYSA-N	441.065	1.257	50	20	IDGD	
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	765315102	AQTUGHUKPCUHFG-DNVCBOLYSA-N	430.530	1.555	50	20	IDGD	
CC(C)(C)OC(=O)NNC(=O)C(=O)Nc1cc(Cl)ccc1OCCS(C)(=O)=O	765399319	VFNJAVDNVYWCTC-UHFFFAOYSA-N	435.886	1.258	50	20	IDGD	
O=C(CSc1ccc(F)c(F)c1)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765735383	LVNILEGAANPNQL-UHFFFAOYSA-N	448.495	1.662	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)[C@@H]1C[C@@]12CCc1ccccc12	765738670	MJPFHMOSMWMUML-SQJMNOBHSA-N	432.524	1.496	50	20	IDGD	
CON(C)C(=O)[C@H](CCSC)NC(=O)NNC(=O)Nc1ccc(OC(F)F)cc1	765878945	INWJDTFXRHYYMG-LBPRGKRZSA-N	435.453	1.765	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)N2CCN(C(=O)[C@@H]3CCCN3C)CC2)c1C	766345251	HXQYBRYXWRATJF-MEPUESOJSA-N	427.549	1.423	50	20	IDGD	
COCCC(=O)N1CCC(NC(=O)NNC(=O)Nc2ccc(OC(F)F)cc2)CC1	767961510	QUEFWYNESULOSO-UHFFFAOYSA-N	429.424	1.651	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)c3ccc(N4NC(=O)CCC4=O)cc3)n[nH]2)cc1	768267879	GALJTZYVACPMHU-UHFFFAOYSA-N	446.467	1.872	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)NC1CCN([C@H]2CCCC[C@@H]2O)CC1	769158852	ATVSKZBAPXFZLV-ROUUACIJSA-N	434.537	1.562	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)NCc1ccc(N2CCOCC2)nc1	770131061	DCPHCEXWJAKXJN-CQSZACIVSA-N	433.896	1.870	50	20	IDGD	
O=C(COc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1ccnn1-c1cccc(F)c1	770772644	AORDUVWDDFNPPX-UHFFFAOYSA-N	431.811	1.830	50	20	IDGD	
CSCC[C@H](NC(=O)c1ccco1)C(=O)NNc1nc(O)c2cnn(C(C)(C)C)c2n1	770958920	SYDSWXOCMYZHTC-LBPRGKRZSA-N	447.521	1.875	50	20	IDGD	
O=C(Cc1cc(Br)ccc1F)NNC(=O)C1CCN(c2ncccn2)CC1	771256852	OVLBZIAZDIXAKQ-UHFFFAOYSA-N	436.285	1.985	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)c1ccc2c(c1)C(=O)N(C[C@H]1CCCO1)C2=O	771933359	GKJVFPWXEHRDKA-DZGCQCFKSA-N	445.472	1.200	50	20	IDGD	
O=C(Cn1ncc2ccc([N+](=O)[O-])cc21)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772193668	YRPUNRJDRZSOLP-UHFFFAOYSA-N	430.808	1.062	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)NCCN(C)S(=O)(=O)c2cccs2)c2ccccc2n1	772623359	FABOVHPDUBEUBW-UHFFFAOYSA-N	447.542	1.869	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NNC(=O)[C@]2(C)Cc3ccccc3C(=O)O2)C1	773421109	QWNLCJRUTPBLLB-QRQCRPRQSA-N	431.489	1.953	50	20	IDGD	
COCc1ccc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)NC(C)(C)C)cc1	773488420	GWFFIRJBIYLVQE-UHFFFAOYSA-N	434.518	1.992	50	20	IDGD	
COc1cc(Cl)ccc1NC(=O)C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C	773497546	WWHQCGSJIMHECQ-UHFFFAOYSA-N	428.873	1.739	50	20	IDGD	
CCOC(=O)[C@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNc2ccc3ccccc3n2)cc1	773655379	SGHOFAWRZGJEIW-AWEZNQCLSA-N	449.467	1.998	50	20	IDGD	
O=C(NNc1ccc2ccccc2n1)C(=O)Nc1cccc(N2CCCS2(=O)=O)c1	773662496	WRCJHJSIQHQCIH-UHFFFAOYSA-N	425.470	1.857	50	20	IDGD	
O=C1C[C@@H](Cc2ccc(NC(=O)C(=O)NNc3ccc(C(F)(F)F)cc3)cc2)C(=O)N1	773768630	WHDKNZVROCCDSQ-GFCCVEGCSA-N	434.374	1.992	50	20	IDGD	
O=C(c1ccc(OCC(F)(F)F)nc1)N1CCN(S(=O)(=O)CBr)CC1	777777939	UHSMRUZJXSDFOS-UHFFFAOYSA-N	446.245	1.463	50	20	IDGD	
Cc1nn(CC(F)(F)F)c(C)c1[C@H](C)C(=O)NNC(=O)CCN1C[C@@H](C)O[C@H](C)C1	778503136	JGAAQPKMFDZEEK-UPJWGTAASA-N	433.475	1.812	50	20	IDGD	
COc1cc(OC)c(NC(=O)C(=O)NNC(=O)c2cccc(C#N)c2)cc1Br	778710597	OYTNLSOBVXRLCX-UHFFFAOYSA-N	447.245	1.738	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@H](C(=O)NNc2ccccc2Br)[C@H](C)O)cc1	779537046	OBUKMINNCHAGPF-LRDDRELGSA-N	442.335	1.929	50	20	IDGD	
CC(C)n1nc(C(=O)NNS(=O)(=O)c2cn3c(n2)CCCC3)c2ccccc2c1=O	779830448	SJVJKKQCZKGLTF-UHFFFAOYSA-N	430.490	1.134	50	20	IDGD	
COC[C@H](CNC(=O)NNc1ccc(S(=O)(=O)NC2CCCCCCC2)cn1)OC	781386825	ASACDQNRSAAYDJ-INIZCTEOSA-N	443.570	1.760	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2Cl)cn1	782925526	JYTBXDXXRPFOEV-UHFFFAOYSA-N	431.257	1.192	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2cccc3ccncc23)nc1	783263103	HOHPZPPGWJBTAU-UHFFFAOYSA-N	428.474	1.398	50	20	IDGD	
Cc1cnn(-c2ccc(C(N)=O)cc2NC(=O)C(=O)NN=c2sc3ccccc3n2C)c1	783351756	JPODYKOREYZHIB-UHFFFAOYSA-N	449.496	1.403	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2nccn(C)c2=O)n(-c2ccccc2C(F)(F)F)n1	785090050	LNHGWHJWLLDIGA-UHFFFAOYSA-N	435.366	1.375	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2ccc(CN3C(=O)CNC3=O)cc2)cc1Cl	785120106	HBSBGBBEDMXACB-UHFFFAOYSA-N	431.836	1.482	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2ccc(CN3CCOC3=O)cc2)n1	785225349	HDYNDAHAJYZORM-UHFFFAOYSA-N	427.465	1.357	50	20	IDGD	
COCCNc1nnc(SCC(=O)NNC(=O)c2cc(Cl)ccc2OC)s1	786600884	OHZRAXWZSNJHCB-UHFFFAOYSA-N	431.927	1.812	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)C1CCN(C(=O)c2ccc(F)cc2F)CC1	788181042	JWVLMHOMWXQKTB-UHFFFAOYSA-N	427.415	1.936	50	20	IDGD	
CCn1cccc(CNC(=O)NNC(=O)[C@H](C)Oc2cccc(Br)c2)c1=O	789298235	KRYLCIHBRHFBEV-LBPRGKRZSA-N	437.294	1.929	50	20	IDGD	
CC(=O)Nc1cc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)ccc1F	789810802	QKHCXKCRJFWDDG-YJBOKZPZSA-N	428.420	1.443	50	20	IDGD	
Cc1ccn(C[C@](C)(O)C(=O)NNC(=O)c2ccc(Br)cc2Cl)c(=O)c1	790642336	RXGCKGISJJNPML-KRWDZBQOSA-N	442.697	1.785	50	20	IDGD	
C[C@@]1(C2CC2)NC(=O)N(c2cccc(CNC(=O)NNC(=O)c3cccc(C#N)c3)c2)C1=O	790709761	RBKYJTYAKIXKPS-QHCPKHFHSA-N	446.467	1.927	50	20	IDGD	
COc1cc(S(=O)(=O)N2CCOCC2)cc(C(=O)NCCSSC)c1OC	791114033	UALKHZGUAFNFTQ-UHFFFAOYSA-N	436.577	1.466	50	20	IDGD	
CN(C)c1cccc(CCC(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)c1	792238079	QOZVJOMYOBAZST-UHFFFAOYSA-N	437.544	1.291	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(NC(=O)N(C)C)c2C)c1	792352145	BWOUOAHOBIAPIH-UHFFFAOYSA-N	427.461	1.562	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)C(=O)Nc1cc(-c2ccccc2)ccc1Cl	792355595	UTKKLAPDEXWLEU-AWEZNQCLSA-N	435.889	1.528	50	20	IDGD	
COc1ccc([C@@H]2C[C@H]2NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1	793384295	SZUPQSIQYPEGMZ-RBUKOAKNSA-N	446.529	1.511	50	20	IDGD	
CC(=NNC(=O)c1csc(N2CCOCC2)n1)c1cc(S(N)(=O)=O)c(C)cc1C	794484178	WWRKRLJHVVGODO-UHFFFAOYSA-N	437.547	1.398	50	20	IDGD	
COC(=O)c1ccc(S(=O)(=O)NNC(=O)c2cc(Br)c[nH]2)cc1OC	799120496	RYYNUNVNKMJFJJ-UHFFFAOYSA-N	432.252	1.196	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cnn(CC)c1C(F)(F)F	799257688	PLEIHROZVAIOCG-UHFFFAOYSA-N	427.383	1.649	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)CN2C(=O)c3ccc(Br)cc3C2=O)cc1	802052474	AUNIYIYGYOXMHQ-UHFFFAOYSA-N	447.245	1.907	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2ccc(-c3ccc(Cl)s3)nc2)CCS(=O)(=O)C1	802569186	CCOVCFNXEPGMGH-INIZCTEOSA-N	428.923	1.600	50	20	IDGD	
C[C@](O)(CSc1cccc(F)c1)C(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	803000965	YESPXFMJPQOKTJ-IBGZPJMESA-N	439.896	1.786	50	20	IDGD	
CCN(C)C(=O)c1cccc(NC(=O)C(=O)NNC(=O)CSc2ccccc2OC)c1	806979361	RKVQZNBTOWJXPJ-UHFFFAOYSA-N	444.513	1.665	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NCCCN1C(=O)c2ccccc2C1=O	807495115	UYEFLZHLDZHWIF-ZDUSSCGKSA-N	428.420	1.610	50	20	IDGD	
C[C@@H]1Oc2ccccc2[C@@H]1NC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	812429965	BUZGDJUDYWYAHX-IFXJQAMLSA-N	444.513	1.937	50	20	IDGD	
CCOC(=O)c1ccc(NNC(=O)CN2CCN(C(=O)OC(C)(C)C)CC2=O)cc1C	812716874	RJSBVSXUNJZAQX-UHFFFAOYSA-N	434.493	1.694	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H](O)c2ccc(Cl)cc2)c1	813363125	CSTMKBKHMZPZEC-KRWDZBQOSA-N	439.921	1.865	50	20	IDGD	
O=C(CNC(=O)NNC(=O)c1cccc(OC(F)F)c1)NCCN1CCCCCC1	814295825	HARWGWKMCBPLRH-UHFFFAOYSA-N	427.452	1.224	50	20	IDGD	
CCOC(=O)c1cc(COC)cc(NC(=O)C(=O)NNC(=O)Cc2ccc(Cl)cc2)c1	815567161	QBCITSPAMSKAFT-UHFFFAOYSA-N	447.875	1.992	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)cc1)[C@@H]1C[C@@H]1C	815568278	BMEGRDCITGFHQF-VIZZQPHQSA-N	436.468	1.538	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)/C=C/CN(C)CC(F)(F)F)n[nH]2)cc1OC	815887216	YGKLYGTXVISMFE-SNAWJCMRSA-N	441.410	1.905	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(Br)c(C(=O)NCC(Cl)Cl)c1	816605187	OOFLEKMUFLNMCI-UHFFFAOYSA-N	434.139	1.907	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)Cn2c(=O)nc(O)c3ccccc32)c1	816717458	CIRUYCXAGBWYIL-UHFFFAOYSA-N	447.245	1.795	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)NNC(=O)CC2CC2)cc1	819126323	NINSFHGIOXKLJA-LFIBNONCSA-N	436.472	1.289	50	20	IDGD	
Cc1cc(C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c2c(C)nn(C)c2n1	899606152	OZDGJVSCXSEESI-UHFFFAOYSA-N	426.389	1.111	50	20	IDGD	
COc1cccc(/C=C(\C#N)C(=O)OCC(=O)N2CCN(c3oc(C)nc3C#N)CC2)c1	915378073	YCUKEIBBLWPCML-LICLKQGHSA-N	435.440	1.662	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)CS(=O)(=O)Cc1ccc(C#N)cc1	915806531	ORJGXVUMZNZIMQ-UHFFFAOYSA-N	431.470	1.098	50	20	IDGD	
NC(=O)c1cc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)ccc1F	916376122	CRWGTZOXNVGJOW-UHFFFAOYSA-N	449.464	1.176	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)N1CCC[C@@H](C)C1	916450280	ISDDCAHQNRXAHI-CABCVRRESA-N	425.555	1.001	50	20	IDGD	
CC(C)(C)C(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccc3c(c2)OCO3)c1	917181389	DCOQCGVLGAZSJG-UHFFFAOYSA-N	433.486	1.701	50	20	IDGD	
O=C(CN1C(=O)c2ccc(Br)cc2C1=O)NNC(=O)c1ccc(Cl)nc1	917250711	GCMWYJIUWJOOJZ-UHFFFAOYSA-N	437.637	1.555	50	20	IDGD	
O=C(NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12)c1n[nH]c2c1CCC2	918678754	FCUCGAVLUKSYFK-UHFFFAOYSA-N	428.452	1.731	50	20	IDGD	
Cc1cc(CC(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)c(C)n1-c1ccc(Cl)cc1	919883167	BFFVUTONJCOFBH-INIZCTEOSA-N	438.937	1.808	50	20	IDGD	
CN(C)C(=O)C[C@@H](NC(=O)NNC(=O)c1nn(-c2ccccc2)cc1O)c1ccccc1	920048596	ZEUCAQTYZQPLTL-QGZVFWFLSA-N	436.472	1.742	50	20	IDGD	
COc1cc(OCC(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)ccc1[N+](=O)[O-]	921109739	QGKZBFYKGWNOJA-UHFFFAOYSA-N	437.792	1.640	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)N[C@H]1CCCN(C(=O)c2ccccc2)C1	1115952207	GEHAZGNLJBIXIC-HNNXBMFYSA-N	434.456	1.584	50	20	IDGD	
C[C@@H](O)CNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2ccc(Cl)cc2F)cc1	1262610016	GAZWHTFMPHNGNU-SNVBAGLBSA-N	429.857	1.213	50	20	IDGD	
CN1C(=O)C[C@H](C(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)c2ccccc21	1318615794	YLGSGNBHBMWRSQ-INIZCTEOSA-N	430.505	1.931	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1cncc(OCC(F)F)c1	1319293516	YYPDMSYJUWJRCI-UHFFFAOYSA-N	427.433	1.402	50	20	IDGD	
COc1ccc([C@]2(C)NC(=O)N(CC(=O)NNc3cncc(Br)c3)C2=O)cc1	1319627934	YNQGVDMOZICPNT-SFHVURJKSA-N	448.277	1.763	50	20	IDGD	
CC(C)OCCCn1c(NNC(=O)Cn2cc(C3CC3)nn2)nc2ccccc2c1=O	1322564276	LZTSBXWMLUNMGM-UHFFFAOYSA-N	425.493	1.824	50	20	IDGD	
CN(NC(=O)c1cc(=O)n(C)c2ccccc12)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	1343281567	ZAZXQDPDHKMPGO-UHFFFAOYSA-N	443.504	1.788	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2nccc3[nH]ccc23)C1	1777904643	BWHGFFCHIQWVLW-LUQKVYGDSA-N	434.924	1.944	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H]2Cc3ccccc3CN2)C1	1778035770	CKKUJUBILPQNAT-DZCCDHAISA-N	449.979	1.469	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4cncn4c3)C2)C1	1778695329	GVBPIODJROBCRE-VQIMIIECSA-N	435.322	1.951	50	20	IDGD	
O=C(/C=N/O[C@@H]1CCCCO1)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1779104704	FXSOBVGMPJWPFR-OLGKWTEQSA-N	436.278	1.036	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)cc1	1779300632	XDFFAGFANOUQQH-OAQYLSRUSA-N	433.581	1.940	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(Br)cn3)C2)C1	1779424868	DIRNTDHVQHLREZ-GUYCJALGSA-N	446.729	1.541	50	20	IDGD	
Cc1cc(CC(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](C)CBr)C3)n[nH]1	1779457186	HSNKFNPABJEDFE-URKNILKWSA-N	441.370	1.806	50	20	IDGD	
O=C(c1ccc([N+](=O)[O-])c2c1OCO2)N1CC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1780237287	XGDVYUYOCIVTEP-QGZVFWFLSA-N	446.243	1.571	50	20	IDGD	
Cn1ccc(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](F)Br)C2)n1	1780771915	SVFHYSAZYNIJJQ-FRFSOERESA-N	431.306	1.167	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](NC(=O)OC)c1ccccc1)CCO2	1781211055	HGAKQDJZOXSVHA-LZJOCLMNSA-N	437.924	1.931	50	20	IDGD	
O=C(c1cc(O)nc(Cl)c1)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781326716	RQHSTXFEUXDYRU-DOMZBBRYSA-N	436.665	1.575	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H]1CCC(=O)NC1)C2	1781897363	ISLALNODVZPVAQ-DEXNDLTESA-N	444.370	1.200	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C(Cl)Cl)C1	1782220848	BEXDTCQIULZGHH-KZULUSFZSA-N	438.352	1.829	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H]2CCc3nc[nH]c3C2)C1	1782459846	IYTYRIREPPPZSD-PVMRSWARSA-N	438.956	1.282	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)Cc2cnn(C)c2)C1	1782584349	JDVIAYQDDUMPHF-ZSZQSSIHSA-N	441.370	1.508	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)Cc3c(C)noc3C)CCO2)C1	1783344559	UQAYFHDSOMAUTA-MAUKXSAKSA-N	428.327	1.837	50	20	IDGD	
COc1cccnc1CCC(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](C)Br)C2)C1	1783530227	VDNZCPMYPARSHU-KUHUBIRLSA-N	440.338	1.636	50	20	IDGD	
Cc1nc[nH]c1CSCC(=O)N1CCO[C@]2(CCN(C(=O)[C@H](C)Br)C2)C1	1783533581	AMHCDJYUHCNSLN-YVEFUNNKSA-N	445.383	1.565	50	20	IDGD	
COc1cccc(OC)c1C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](C)Br)C2)C1	1783536267	FRIRDAVGMMNEBO-YJYMSZOUSA-N	441.322	1.931	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](C)Oc1cccnc1)CCO2	1783540624	ZVKNLLKOKIOMRC-PMUMKWKESA-N	426.311	1.462	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(OC)c(OC)c3O)CCO2)C1	1783881144	PFLQMZJSEUUFJI-VBKZILBWSA-N	442.896	1.107	50	20	IDGD	
CCN(CC)C[C@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]2C1	1783974642	UIIAHPMWGCHVJF-ATIWLJMLSA-N	446.430	1.975	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H]3CCc4nc[nH]c4C3)C2)C1	1784346005	UVZOZQJMIPKPJF-LPMFXHHGSA-N	439.354	1.376	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](C)Oc3ccccn3)C2)C1	1784480593	LJHIQIYNKOPEDS-CLCXKQKWSA-N	440.338	1.710	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)CCc3c[nH]c4ncccc34)C2)C1	1785489019	YPURSYOVIDMQTE-UTKZUKDTSA-N	434.924	1.579	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(Br)cn3)C[C@@H]21)[C@@H](F)Cl	1787446452	KNFLSGLQOZOYJS-DTCNJJKHSA-N	434.693	1.972	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc4ccccc4n3)[C@H]2C1	1787802811	RUSANBKDPTWHMK-XLPNERPQSA-N	432.908	1.477	50	20	IDGD	
CCc1cc(C(=O)NC2(c3ccc(NC(=O)c4ccc(B(O)O)cc4)cc3)CCC2)n[nH]1	1788140770	VDGGGORLFWTFTL-UHFFFAOYSA-N	432.289	1.713	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cn(C)c4ncccc34)[C@H]2C1	1788465129	XDUXPWACZZSLFS-RMRKRWHISA-N	449.349	1.950	50	20	IDGD	
CCOC(=O)N[C@@H](O)C(=O)NC1(c2ccc(NC(=O)[C@H](F)Br)cc2)CCC1	1790536335	PIAVKGRWHUTPAI-JSGCOSHPSA-N	446.273	1.876	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3CC=CC[C@@H]3C(=O)OC)[C@H]2C1	1791236841	YVHQNAABFPTJFD-QQCJEOGWSA-N	426.941	1.739	50	20	IDGD	
CO[C@@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C[C@@H]21	1791318368	VXIOJDPXXSFBEC-QXKUPLGCSA-N	447.960	1.133	50	20	IDGD	
O=C(CN(CCO)CCO)Nc1ccc(C2(NC(=O)[C@H](F)Br)CCC2)cc1	1791328588	SAHYNZQYMGVFDJ-INIZCTEOSA-N	446.317	1.098	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)Oc3ccccn3)[C@H]2C1	1791626271	AADNXVVTBYYAOO-OWYFMNJBSA-N	440.338	1.612	50	20	IDGD	
CCOc1ncccc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2	1792379533	CEBJFRBBTAWECO-XCCSTKFXSA-N	430.274	1.374	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCCc1ccccc1F	1792951969	PPOAAXKALCOLGM-FEJSZKPUSA-N	448.539	1.111	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccnc1-c1cccc(F)c1)C2)[C@@H](O)CCl	1792977473	VXCWOTOVKZFNQZ-QXGSTGNESA-N	447.894	1.691	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CCc2ccccc2[C@H]1O	1793039074	ZXVBRWLNUQUWKO-OYPHABEOSA-N	446.620	1.724	50	20	IDGD	
CC[C@H](NC)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1794142441	AILFKLRRZCWGCE-QRJUGERDSA-N	430.977	1.755	50	20	IDGD	
CCc1nn(C)c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](Cl)COC)C3)c1Cl	1794424863	BKEGANWRDINGKT-NWJSVONSSA-N	433.336	1.093	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)c1c[nH]c(-c2ccc(F)cc2)c1	1794435785	HWKDYIFASCTZOR-QXGSTGNESA-N	435.883	1.624	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccnc(C(F)(F)F)c1)c1ccc(B(O)O)cc1	1794884349	ZBKKXEZZIWGWFH-BJWYYQGGSA-N	447.222	1.346	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ncnn1C	1794911257	NBQDOLXXZBXLKS-BTTYYORXSA-N	442.432	1.214	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnc(N(C)C)o1)C2	1796889802	IKFSQFULYNZXRG-JWBKOJIWSA-N	441.492	1.126	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1n[nH]c3ccccc13)C2	1796892455	DOORIUAIXSHREA-MVRRYPJTSA-N	447.499	1.949	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccncc1Cl	1798058398	GXPDFXOJBCNKNO-OHTBPHCPSA-N	430.730	1.969	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(F)c1[N+](=O)[O-]	1799634784	RMVLEGUEBZIHBS-NJBDSQKTSA-N	444.257	1.721	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccccc1C(N)=O)C2	1800643364	RBWBHLXGHDGXFZ-NOXHYTERSA-N	438.322	1.162	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCc1cccc(O)c1	1801126294	OCFXWHGPTPMKMO-LJGDNWOOSA-N	425.323	1.698	50	20	IDGD	
CC(C)(CCl)C(=O)NC[C@H]1CCN(C(=O)c2nccnc2C(N)=O)[C@@H]1c1cccnc1	1802905032	WXOJPIVKHPDKEV-RHSMWYFYSA-N	444.923	1.555	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)[C@H](C)NS(=O)(=O)CC)[C@@H]1c1cccnc1	1803507158	NRAHMOHNFVAAGH-ORQFMDKSSA-N	444.985	1.433	50	20	IDGD	
COc1cc(C(=O)NC[C@@H]2CCN(C(=O)C(Cl)Cl)[C@@H]2c2cccnc2)n(C)n1	1804929107	PUNUMWQKTIKTQV-SWLSCSKDSA-N	426.304	1.947	50	20	IDGD	
O=C(c1nc2cc([N+](=O)[O-])ccc2[nH]1)N1CCC2(CCCN(C(=O)[C@@H](O)CCl)C2)CC1	1805525899	ALXGMVDGUJFADU-INIZCTEOSA-N	449.895	1.916	50	20	IDGD	
O=C(CN1CCCC1=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@@H]1c1cccnc1	1806926308	YRYMTKVCUNKEIH-IAOVAPTHSA-N	441.301	1.400	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)CSC(=N)N)[C@@H]1c1cccnc1	1807008319	JGKNSBZCODFXFZ-YDHLFZDLSA-N	442.383	1.888	50	20	IDGD	
Cc1occc1C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1807364009	RQCWOYVFSVKKJX-RXVVDRJESA-N	433.273	1.296	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)c1nccc2[nH]ccc12	1808087232	RXAGUFWPKCGXED-UCLAIMLFSA-N	427.892	1.877	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)c1cc2cccnc2[nH]1	1809895315	FTVQPOPHDNGZAV-JQHSSLGASA-N	427.892	1.877	50	20	IDGD	
O=C(C#CC1(O)CCCCC1)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1	1810329716	GFPIAFIVKISZFS-CMKODMSKSA-N	433.936	1.386	50	20	IDGD	
CCn1nc(C)cc1C(=O)N1CCCC2(CCN(C(=O)c3cccc(B(O)O)c3)CC2)C1	1810535311	DXTXRFWRJKSGMX-UHFFFAOYSA-N	438.337	1.050	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@@H](O)C(=O)N1CCC2(CCCN(C(=O)[C@H](F)Cl)C2)CC1	1810902577	KUFVBWHPLLUBJF-KGLIPLIRSA-N	435.924	1.638	50	20	IDGD	
Cc1ccc(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)cc1	1811960107	SVQTWKMIBNYEOU-FYYLOGMGSA-N	443.312	1.703	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)CSc2nc[nH]n2)[C@H]1c1cccnc1	1813032786	GLHALPJVFUOSJA-DZKIICNBSA-N	438.941	1.252	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2ccccc2C(N)=O)[C@@H]1c1cccnc1	1813034129	BLFZGLFWTUIKMD-AYOQOUSVSA-N	444.919	1.754	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)[C@@H]1CCC(F)(F)C1	1814387677	PEQBLGZIPXPDNT-PBHICJAKSA-N	446.263	1.831	50	20	IDGD	
Cc1cc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)nn1C	1816428345	FCSRCMFZRKYDRF-MRXNPFEDSA-N	430.513	1.131	50	20	IDGD	
Cc1ncsc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1	1817473131	HQASIIZOEKEUJD-MRXNPFEDSA-N	439.306	1.474	50	20	IDGD	
CC(C)n1nccc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1	1822415071	RTJZIKHBIUKLMM-MRXNPFEDSA-N	444.540	1.866	50	20	IDGD	
CC(=O)OC[C@H](OC(C)=O)C(=O)N1CCCC[C@H]1c1cc(NC(=O)C(Cl)Cl)n[nH]1	1822423810	MCJQNUOGZSDLQE-STQMWFEESA-N	449.291	1.700	50	20	IDGD	
O=C(CN1CCCC1=O)N[C@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1	1823004049	OWJFSVWDAMXEMA-ISVAXAHUSA-N	433.303	1.368	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H]3CCC(=O)N3C)sc2C1	1823053909	DMNJPWCAXLTTLF-KKZNHRDASA-N	429.340	1.459	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(O)ncn1)CC2	1825636508	WJUGCMSLDFAQLL-HTQZYQBOSA-N	426.296	1.648	50	20	IDGD	
Cc1nc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)co1	1825953378	BUORETKUMFZNLU-FQEVSTJZSA-N	425.294	1.210	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cccnc1C(N)=O)CC2	1825993033	DKMLAACGOIBSKW-MWLCHTKSSA-N	437.909	1.117	50	20	IDGD	
Cc1ccnc(C(=O)N[C@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)c1	1826086434	VGQDBPMDUUOMQP-ZDUSSCGKSA-N	430.534	1.445	50	20	IDGD	
O=C(CCc1cccnc1)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827054799	KTRSLDNPBYKVMD-HSZRJFAPSA-N	449.360	1.628	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@H](F)Cl)CC1	1827609113	NFZMTZWMNAQDPL-CVEARBPZSA-N	425.892	1.453	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@H]2CCCS2)CC1	1832438698	NNOPETOHDDHDMW-RTBURBONSA-N	445.589	1.814	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)CC[C@H]2CCOC2)CC1	1832456267	LYXBWDBDURVYPB-ICSRJNTNSA-N	436.597	1.796	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)/C=C/c3ccoc3)CCO2)C1	1832651639	OQNCKHCGRBZNBR-CJIROOEOSA-N	431.316	1.986	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)C(=O)c3ccco3)CCO2)C1	1832663944	IWEUFSBBPHWTKZ-MSOLQXFVSA-N	433.288	1.155	50	20	IDGD	
C[C@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)c3cnco3)CC2)CC1	1833265090	QBWQSTOGMGDDFJ-CYBMUJFWSA-N	427.343	1.891	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cn4ccsc4n3)CC2)CC1)[C@H](O)CCl	1833310648	XWKQWCIMHCTIOJ-MRXNPFEDSA-N	439.969	1.181	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3n[nH]c(C4CC4)c3F)CCO2)C1	1833677120	AXQAFSWPAZGBBO-HXUWFJFHSA-N	442.919	1.761	50	20	IDGD	
COc1cnc(C(=O)N2CCC(N3CCC(NC(=O)[C@@H](F)Cl)CC3)CC2)c(F)c1	1835078381	CGPPYFIEVCADLN-QGZVFWFLSA-N	430.883	1.949	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)/C=C\C(=O)NC3CC3)CC2)CC1	1835657783	JHUDLUCKBCYJNG-RURPWVQCSA-N	439.000	1.800	50	20	IDGD	
C=CC(=O)N[C@@H](C)C(=O)NC1CCN(C2CCN(C(=O)[C@H](C)Br)CC2)CC1	1835830967	HZTRBWIFKUPIQA-KBPBESRZSA-N	443.386	1.032	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)[C@@]3(C)CCCN3)CC2)CC1	1836384998	QSRAKNRZONWPJN-AUUYWEPGSA-N	429.403	1.484	50	20	IDGD	
O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(F)n1)CCO2	1837905546	SMVROZMWDGBMDL-QGZVFWFLSA-N	430.274	1.076	50	20	IDGD	
O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)c1ncccc1F)CCO2	1838246377	SBDCDGOVEMHCDJ-QGZVFWFLSA-N	430.274	1.076	50	20	IDGD	
CCc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)n[nH]1	1839152428	YYDPQYXQHBNKEY-ROUUACIJSA-N	433.336	1.278	50	20	IDGD	
CCc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)no1	1839153255	DKXCSVJBFCCMGD-QZTJIDSGSA-N	434.320	1.543	50	20	IDGD	
Cc1ccsc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839198040	RCHFCRAIQFNIEA-BBRMVZONSA-N	435.315	1.817	50	20	IDGD	
Cc1ccc(O)c(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)c1	1839201678	FUVPXCJTCVWBHX-CRAIPNDOSA-N	445.285	1.461	50	20	IDGD	
O=C([C@H](F)Br)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CCCSC1)CCO2	1840865306	MVYSHZKLRGUNML-XEZPLFJOSA-N	439.347	1.277	50	20	IDGD	
CC[C@H](NC(C)=O)C(=O)N1CC2(CCCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C1	1841924095	UQTJIFSWRVJQCZ-GJZGRUSLSA-N	444.960	1.237	50	20	IDGD	
Cc1cnoc1C(=O)N1CCCC12CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1844617279	QYNFSGARFFHWSP-ZDUSSCGKSA-N	426.901	1.932	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2cc(C)nn2C(F)F)C1	1844786919	XUYCYPOWRIAJOY-ZMOGYAJESA-N	447.446	1.538	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)[C@H]2CCc3cccc(Cl)c32)C1	1845865362	GIMFQGHWUFISNE-SFHVURJKSA-N	438.720	1.567	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@H]1CN(C(=O)OC(C)(C)C)CCO1)C2	1846365663	MULLWRJGFIHKNS-HUUCEWRRSA-N	445.944	1.080	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@H]1C[C@H](NC(=O)OC(C)(C)C)C1)C2	1846365811	WYQGWRKHBBEYLR-RBSFLKMASA-N	429.945	1.747	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H]1CCCCN1C	1847580835	XJLCNXHNMHLGHZ-FHWLQOOXSA-N	444.488	1.820	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1	16785852	CAJLQIMYWJUEQQ-OAHLLOKOSA-N	432.458	1.403	50	20	IDGD	
C=CCn1c(S)nc2cc(C(=O)NNC(=O)CNC(=O)c3cccs3)ccc2c1=O	725902446	NATFAFWMUDGPRF-UHFFFAOYSA-N	443.510	1.124	50	20	IDGD	
O=C(NNc1nc(-c2ccncc2)no1)c1ccc(S(=O)(=O)NCc2ccco2)cc1	726370733	KQBAEORJXJXZHD-UHFFFAOYSA-N	440.441	1.960	50	20	IDGD	
O=C1CN(C(=O)c2ccc(CNS(=O)(=O)c3ccc(CCCCl)cc3)cc2)CCN1	726974873	UASNQCPMZVPADX-UHFFFAOYSA-N	449.960	1.909	50	20	IDGD	
CCCOC(=O)c1ccc(S(=O)(=O)NNC(=O)c2cc(Br)c[nH]2)cc1	727795473	IRTTZQQTSLDTSZ-UHFFFAOYSA-N	430.280	1.967	50	20	IDGD	
O=C(NNC(=O)c1c(Cl)cccc1Cl)NNC(=O)[C@H]1COc2ccccc2O1	727847040	PITNUBKEYWGDQI-CYBMUJFWSA-N	425.228	1.809	50	20	IDGD	
CC(=O)NCC(=O)N1CCC[C@@H]1C(=O)NNC(=O)c1ccc(-c2ccc(F)cc2)s1	728513435	IZNNSPIKHGYVTE-OAHLLOKOSA-N	432.477	1.442	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)CCc2nc(-c3ncccn3)no2)c1	728526807	SSJSUOJNSHOSJB-UHFFFAOYSA-N	447.249	1.692	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@@H](C(=O)NNC(=O)c3cccc(C#N)c3)C2)s1	728825106	GGUVEMSILXVIEY-MRXNPFEDSA-N	432.527	1.790	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)N1CCc2sccc2C1	728945087	IUXNFRNHYWVTAG-OAHLLOKOSA-N	443.577	1.532	50	20	IDGD	
CCOc1ccc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)c3cocn3)cc2)cc1	729297046	RISFVXUWTONYGX-UHFFFAOYSA-N	430.442	1.949	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)c2ccc(Cl)c(NS(C)(=O)=O)c2)cn1	729691540	DLMWDNQHOMEBQM-UHFFFAOYSA-N	429.911	1.747	50	20	IDGD	
O=C(COc1ccccc1OCc1ccccc1)NNC(=O)N[C@H]1CCS(=O)(=O)C1	730774628	WFULFLVIEIOIQT-INIZCTEOSA-N	433.486	1.162	50	20	IDGD	
Cc1cc(NC(=O)CN2CCN(C(=O)NNC(=O)C(C)(C)c3ccccc3)CC2)no1	731221592	FLFVAKYIJFTHKZ-UHFFFAOYSA-N	428.493	1.258	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2nn(-c3ccccc3F)c(C)cc2=O)cc1C	731992602	QKJCLFXUCJCXNL-UHFFFAOYSA-N	437.431	1.697	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)N[C@H]2CCN(CC(F)(F)F)C2=O)N(C)c2ccccc21	732560993	UVSSMEZSCKUFCG-AWEZNQCLSA-N	449.433	1.936	50	20	IDGD	
CSCC[C@@H](NC(=O)Cc1ccccc1)C(=O)NNC(=O)c1c(C)nc2ccccn12	732751053	JALANOSQKPSEFF-QGZVFWFLSA-N	439.541	1.884	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN1C(=O)c1ccc2c(c1)OCO2)c1cnn(-c2ccccc2)c1	733108427	PYHSAKHEYYHLRK-SFHVURJKSA-N	447.451	1.667	50	20	IDGD	
CN(C)CCOc1ccc(CCNC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1	733347006	KWFJOAODQXYCTA-UHFFFAOYSA-N	436.516	1.999	50	20	IDGD	
N#Cc1ccc(N2C(=O)N[C@H](CCC(=O)NNC(=O)CCOc3ccccc3)C2=O)cc1	733776535	KKWGTQNXYRLWJV-GOSISDBHSA-N	435.440	1.380	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)c2cnc(-c3ncccn3)s2)CC1	734825302	YKFKGRYJYPHLTQ-UHFFFAOYSA-N	447.521	1.944	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2cnc(-c3ccco3)s2)CC1	735117968	KODJJIMWMRBMBL-UHFFFAOYSA-N	448.530	1.491	50	20	IDGD	
C[C@@H](Oc1cccnc1)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	735459757	FCVGAHLKFPWVRP-OAHLLOKOSA-N	432.502	1.485	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)NC[C@@H](c2ccc(Cl)cc2)N2CCOC(C)(C)C2)cn1	735514443	ZMWLLEUZXOOHGL-KRWDZBQOSA-N	434.928	1.870	50	20	IDGD	
C[C@H](NC(=O)NNc1ccc(S(=O)(=O)NC2CCCCCCC2)cn1)C(=O)N(C)C	735580692	WRDZJMNHTHRXQP-AWEZNQCLSA-N	440.570	1.576	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccc(OC)cc3)CC2)cc1C	736307845	GCZHQIHYGONFOR-UHFFFAOYSA-N	444.557	1.847	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)N[C@H](C)C(=O)N2CCCC[C@@H]2C)nc1	737047783	OFZAHANHXBEGRV-LSDHHAIUSA-N	440.570	1.528	50	20	IDGD	
COCC(=O)N[C@H](C(=O)NNC(=O)[C@H](C)Oc1cccc(Br)c1)C(C)C	741207147	JFKYNVDJIPUKIO-NHYWBVRUSA-N	430.299	1.151	50	20	IDGD	
Cc1nn(C)c(C)c1S(=O)(=O)N[C@@H](C)C(=O)NNC(=O)c1ccc(Cl)cc1Cl	742035226	CTWBRZYCVXMQHZ-VIFPVBQESA-N	448.332	1.472	50	20	IDGD	
Cc1nnnn1[C@H](Cc1ccccc1)C(=O)NNC(=O)c1cccc(Br)c1	742770203	WGPHVAVQQJFCDX-MRXNPFEDSA-N	429.278	1.989	50	20	IDGD	
O=C(NNC(=O)C1CCN(C(=O)c2cccnc2)CC1)c1cc(Br)ccc1O	743730466	ZEGNOYDBDNWPHB-UHFFFAOYSA-N	447.289	1.863	50	20	IDGD	
CCc1nc(C(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)nn1-c1ccccc1F	743830342	BYEGLKBKIJVFEH-UHFFFAOYSA-N	446.464	1.839	50	20	IDGD	
CC(C)(C)C(=O)NNC(=O)CN1CCN(c2ccc([N+](=O)[O-])cc2C(F)(F)F)CC1	744397014	WMNJGKPVQIRHRR-UHFFFAOYSA-N	431.415	1.929	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@H]2CCN(Cc3ccccc3)C2=O)c2ccccc2c1=O	744878184	QOIHTTHGOOFOPY-SFHVURJKSA-N	448.483	1.162	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)[C@@H]2CCCN2C(=O)OCC(F)(F)F)c1	744946901	RCVOMZSKQKXWPH-ZDUSSCGKSA-N	431.367	1.463	50	20	IDGD	
COc1ccc(Br)cc1C(=O)OCC(=O)NNC(=O)c1cccc(C#N)c1	745121892	UDXMAQKWKKRVCW-UHFFFAOYSA-N	432.230	1.947	50	20	IDGD	
CNS(=O)(=O)c1ccc(CNC(=O)NNC(=O)Nc2ccc(N(C)C)cc2)s1	745406383	DNEIVVPYCKWQEP-UHFFFAOYSA-N	426.524	1.258	50	20	IDGD	
Cn1cccc1CNC(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	745925277	JXJUGWZIRZDYHM-UHFFFAOYSA-N	430.468	1.928	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)c1cc(S(=O)(=O)N2CCCC2)ccc1O	745989270	OQVKOUHDRUIKMZ-UHFFFAOYSA-N	448.501	1.058	50	20	IDGD	
C[C@H](C(=O)NNC(=O)c1cc2c(s1)CCCCC2)N1C(=O)[C@H]2[C@H](C1=O)[C@H]1CC[C@H]2O1	746099507	ABXBNQDBUVRVPY-BOFATEMHSA-N	431.514	1.329	50	20	IDGD	
Cc1noc(C)c1S(=O)(=O)NC1(C(=O)NNC(=O)c2ccc(Cl)nc2)CCCC1	746128889	OIKRMSCRASFIBS-UHFFFAOYSA-N	441.897	1.392	50	20	IDGD	
CCS(=O)(=O)N1CCC(C(=O)NNC(=O)COc2cc(C)ccc2C(C)C)CC1	747452366	HJUNDWNJAGEYRD-UHFFFAOYSA-N	425.551	1.706	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)[C@]1(O)CCN(Cc2ccccc2)C1	748594886	ZKRUAPTZEKPOKD-QFIPXVFZSA-N	446.573	1.844	50	20	IDGD	
O=C(CCc1ccccc1)NNC(=O)c1ccc(S(=O)(=O)NC[C@H]2CCCO2)cc1	749852179	YEUSZGUKLQCUMG-GOSISDBHSA-N	431.514	1.538	50	20	IDGD	
C[C@H]1C(=O)Nc2cc(C(=O)OCC(=O)NNC(=O)c3cccc(Cl)c3)ccc2N1C	750570669	BIUHLGRUBFAIOF-NSHDSACASA-N	430.848	1.735	50	20	IDGD	
COc1cc(OC)cc(N2C[C@H](C(=O)NNC(=O)COc3cc(C)ccc3C)CC2=O)c1	752398532	HWZMEFQECUFCQA-MRXNPFEDSA-N	441.484	1.900	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)Nc3cnc4c(c3)c(=O)n(C)c(=O)n4C)cc2C1	755847116	QMLDRNLPYZDYOG-SNVBAGLBSA-N	442.501	1.285	50	20	IDGD	
CC1(C)C(=O)Nc2ccc(S(=O)(=O)NNC(=O)c3cnn(-c4ccccc4)c3)cc21	755968264	IXMRRXNIFTUWBV-UHFFFAOYSA-N	425.470	1.725	50	20	IDGD	
Cc1nnnn1-c1cc(NC(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)ccc1F	756335900	NUJYKYOADMRDPU-UHFFFAOYSA-N	436.448	1.567	50	20	IDGD	
CN(C1CCCCC1)S(=O)(=O)c1cccc(NC(=O)NNC(=O)Cc2cc[nH]n2)c1	756628800	XXMKXXGFLVVPJG-UHFFFAOYSA-N	434.522	1.758	50	20	IDGD	
O=C(CN1CCN(CC(=O)Nc2ccccc2F)CC1)NNC(=O)c1cccc(Cl)c1	756642791	PEBMCQBYFDKIGS-UHFFFAOYSA-N	447.898	1.496	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)Nc1ccc2nc(N3CCOCC3)oc2c1	757901641	XWEJRCKBTIQLQA-UHFFFAOYSA-N	427.417	1.602	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)c1ccccc1)C(=O)NNc1nc(O)c2ccccc2n1	758308872	GIYKDNJJAOFIOQ-MRXNPFEDSA-N	447.542	1.879	50	20	IDGD	
COc1cc(Cl)cc(C=NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)c1O	758877808	FNGSTJWGBVQBHO-UHFFFAOYSA-N	430.892	1.962	50	20	IDGD	
Cc1c(NC(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)cnc(Cl)c1Br	760067783	DABYAXVNUXQWAD-ZETCQYMHSA-N	425.692	1.393	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)c2ccc(=O)n(-c3cnn(C)c3)c2)cc1OC	760799429	NVABACRCPBSAND-UHFFFAOYSA-N	439.472	1.833	50	20	IDGD	
O=C(NNc1nccc(N2CCOCC2)n1)c1cccc(I)c1	762866297	FIQLJWJUNFVUNM-UHFFFAOYSA-N	425.230	1.675	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)[C@@H]3CCCN3c3ncccn3)n[nH]2)cc1OC	763146642	CVHMSYKDOVYVST-INIZCTEOSA-N	437.460	1.314	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c(OCCN(C)C)c1	763467391	CZMOHFRELAAICK-UHFFFAOYSA-N	429.433	1.243	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cccnc2)cc1NC(=O)CN1CCCCC1	763491196	GMBWVQITOVAHAE-UHFFFAOYSA-N	438.488	1.214	50	20	IDGD	
CNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)CCCOc2ccc(Cl)cc2C)cc1	763502869	ZMZKPEGZIILLCW-UHFFFAOYSA-N	446.891	1.953	50	20	IDGD	
CN(C1CC1)S(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2F)cc1	763568453	KWBMICQXJQBFAU-UHFFFAOYSA-N	434.449	1.008	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cccc(C(=O)N3CCSCC3)c2C)c(C)o1	763586240	LZWYCAIBISGNCA-UHFFFAOYSA-N	444.513	1.794	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cc(C)n(-c3ccccc3)c2C)nn1CCC#N	763601224	FYYNWNRKXVITSZ-UHFFFAOYSA-N	433.472	1.912	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)[nH]n1)C(=O)Nc1ccc2c(c1)OC(F)(F)O2	763602258	YDEZOGQZOMGUFP-UHFFFAOYSA-N	429.339	1.798	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cccc(S(C)(=O)=O)c2)c2ccccc2n1	763615724	GZRPNZCDHZXBFI-UHFFFAOYSA-N	426.454	1.346	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(C(=O)N(C)C)c(Cl)c2)c1	763629696	GRMMSENJVRNDTM-UHFFFAOYSA-N	432.864	1.515	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccnn1Cc1cccc(C)c1	763663485	JJQDKYYBLFEYMC-UHFFFAOYSA-N	437.456	1.413	50	20	IDGD	
CCn1cnnc1-c1ccccc1NC(=O)C(=O)NNC(=O)COc1cc(C)ccc1C	763668937	SZKMWSFVSOGKNY-UHFFFAOYSA-N	436.472	1.747	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(CCS(C)(=O)=O)cc2)cc1C	763680450	PUKYFSRFVOKIBY-UHFFFAOYSA-N	447.513	1.055	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)C(=O)Nc1ccccc1N1CCCC1	763803216	DZHHHJXCCGOOMG-UHFFFAOYSA-N	427.417	1.360	50	20	IDGD	
Cc1ccccc1C(=O)N[C@@H](CC(C)C)C(=O)NNC(=O)CNC(=O)c1cccnc1	763818915	PYUHUZBZJHBPGJ-SFHVURJKSA-N	425.489	1.112	50	20	IDGD	
C[C@H]1CCCN(c2ccc(C(=O)NNC(=O)CNC(=O)c3cccnc3)cc2[N+](=O)[O-])C1	763818920	QBASNUKTTJEYMU-AWEZNQCLSA-N	440.460	1.417	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)C(=O)Nc1ccc(-n2cnnn2)cc1	763854238	OQXCDBUBBQJUHM-CQSZACIVSA-N	445.439	1.369	50	20	IDGD	
COC(=O)N(C)Cc1ccc(NC(=O)C(=O)NNC(=O)Cc2c[nH]c3ccccc23)cc1	763865358	OXSIQTSQPDMSDF-UHFFFAOYSA-N	437.456	1.695	50	20	IDGD	
COc1c(NC(=O)C(=O)NNC(=O)c2ccc(Br)s2)cccc1C(N)=O	763942078	SZZFMXPFFGMRHT-UHFFFAOYSA-N	441.263	1.018	50	20	IDGD	
Cc1ccnc(-c2cccc(NC(=O)C(=O)NNC(=O)c3ccc4c(c3)OCCO4)c2)n1	764006897	VJDIHQIIJMRMCX-UHFFFAOYSA-N	433.424	1.623	50	20	IDGD	
CCN(CC)C(=O)Cn1ccc2cc(NC(=O)C(=O)NNC(=O)C3CCCC3)ccc21	764076586	FTNYSZKJPLWAAU-UHFFFAOYSA-N	427.505	1.786	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(C(C)(C)C)nn2-c2ccccn2)c(O)c1	764105173	LFRQZXQRJGNWEC-UHFFFAOYSA-N	436.472	1.979	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccn(CC(F)(F)F)n3)n[nH]2)cc1	764110207	GMSHVZSWOGVNOZ-UHFFFAOYSA-N	435.366	1.544	50	20	IDGD	
CCOC(=O)N(C)c1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)cc1	764154197	PBGDYUVLYNCOAP-KRWDZBQOSA-N	426.429	1.369	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)C(=O)N1CCc2cc(F)c(F)cc21	764204915	VKNRRKGJORISGQ-UHFFFAOYSA-N	426.420	1.306	50	20	IDGD	
CCCC(=O)Nc1ccc(Cl)c(NC(=O)C(=O)NNC(=O)COc2ccccc2O)c1	764275097	IPHDFYZPBVMXQD-UHFFFAOYSA-N	448.863	1.949	50	20	IDGD	
CC(=O)N(C)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(Br)ccc2O)cc1	764278702	WFJVPBYRIKCYLJ-UHFFFAOYSA-N	449.261	1.537	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)C(=O)Nc1cc(Br)cc(C(F)(F)F)c1	764298434	RXPDOOUMMZUJEK-UHFFFAOYSA-N	434.172	1.899	50	20	IDGD	
C[S@@](=O)Cc1cc(NC(=O)C(=O)NNC(=O)Cc2ccccc2F)ccc1Cl	764314371	VIOSYSSHVJNHNL-MUUNZHRXSA-N	425.869	1.686	50	20	IDGD	
CS(=O)(=O)CCOc1cccc(NC(=O)C(=O)NNC(=O)c2cc3ccccc3o2)c1	764331539	XULKSXWSVLOCBT-UHFFFAOYSA-N	445.453	1.256	50	20	IDGD	
O=C(CCCc1cccs1)NNC(=O)C(=O)Nc1cnn(-c2cnc3ccccc3n2)c1	764342036	SPPNVZZJUYAAGK-UHFFFAOYSA-N	449.496	1.986	50	20	IDGD	
Cc1ccc(C(=O)NC2CC2)cc1NC(=O)C(=O)NNC(=O)c1ccc(O)c(Cl)c1	764349152	FWBNUSJXIRUTFL-UHFFFAOYSA-N	430.848	1.646	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)C(=O)N3CCc4ccc(C)cc43)n[nH]2)cc1OC	764379478	YSVQTDDNULHYEN-UHFFFAOYSA-N	449.467	1.753	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1)C(=O)Nc1ccc(-n2cccn2)nc1	764386782	CKMXOSOIKYLERU-UHFFFAOYSA-N	434.391	1.196	50	20	IDGD	
COC(=O)c1cc(F)ccc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	764389144	ZZOYMHLRTUDPCK-UHFFFAOYSA-N	443.366	1.541	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2F)c(C)c1	764410434	GOSLDKRBMYMLTR-UHFFFAOYSA-N	437.811	1.739	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2cccs2)[nH]n1)c1ccc(F)c(S(=O)(=O)NC2CC2)c1	765565155	LLEYOYGHPJUTHN-UHFFFAOYSA-N	449.489	1.793	50	20	IDGD	
COc1cc(SC#N)ccc1OS(=O)(=O)CCNS(=O)(=O)c1ccccc1	765719806	ADNHKVOKEBQTQE-UHFFFAOYSA-N	428.513	1.955	50	20	IDGD	
O=C(CN1CCCCCCC1)Nc1ccc(NC(=O)C(=O)NNc2cnccn2)cc1	766260796	XQWLPBMIWBDSKJ-UHFFFAOYSA-N	425.493	1.763	50	20	IDGD	
O=C(NNC(=O)c1ccc(N2C(=O)CCC2=O)c([N+](=O)[O-])c1)c1cccc(OC(F)F)c1	766609423	OYLCOJQXGKDQRC-UHFFFAOYSA-N	448.338	1.924	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)c1ccc(F)c(S(=O)(=O)NC2CC2)c1	766669936	NKXHCSLVXREXMZ-UHFFFAOYSA-N	427.479	1.427	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)N1CCNC(=O)[C@@H]1c1ccccc1Br	767731925	KOCNMCUQRFNTNB-LRDDRELGSA-N	425.327	1.504	50	20	IDGD	
C[C@H](C(=O)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1)N1C(=O)[C@@H]2CCCC[C@H]2C1=O	768280411	ZXSWNTHWZIRGAO-KCPJHIHWSA-N	427.436	1.541	50	20	IDGD	
CCCCCCn1cc(S(=O)(=O)NNC(=O)C(C)(C)c2ccccc2)c(O)nc1=O	769634326	VXGKCHPGSAUIEW-UHFFFAOYSA-N	436.534	1.817	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2ccnn2-c2cccc(F)c2)cc1	770772028	SAHSEXOJKPXBGD-UHFFFAOYSA-N	425.420	1.739	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)CNC(=O)NCc3ccc(F)cc3)nc21	770965989	ITAXAFYMZZBQNF-UHFFFAOYSA-N	430.444	1.369	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)ccc1F	770966525	MCOFDWSGZHLFLD-UHFFFAOYSA-N	437.457	1.091	50	20	IDGD	
O=C(CS[C@@H]1CCS(=O)(=O)C1)NNC(=S)Nc1cccc(Br)c1	770996482	OTHJOMVLTMJXQG-LLVKDONJSA-N	438.394	1.687	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)O[C@@H](C)C(=O)NNC(=O)CC(C)C)s1	771932903	ZJRYBFLFLJYMDD-KBPBESRZSA-N	445.563	1.335	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)c1cnc2c(c1)c(O)nc(=O)n2C1CC1	772955109	PIAYPBCEEKIWCI-SNVBAGLBSA-N	443.847	1.714	50	20	IDGD	
Cc1ccc(I)cc1NC(=O)C(=O)NNC(=O)c1cccn1C	773500250	RZUJCXOLVNPLLH-UHFFFAOYSA-N	426.214	1.338	50	20	IDGD	
N#CC1=CCN(C(=O)[C@@H](CCC(N)=O)NS(=O)(=O)c2cccc(C(F)(F)F)c2)CC1	773544938	OTWYEDFBHNIVJI-OAHLLOKOSA-N	444.435	1.300	50	20	IDGD	
O=C(NNc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(C(=O)N2CCOCC2)c(Cl)c1	773644086	YUWQUQXXXYEWRW-UHFFFAOYSA-N	447.835	1.802	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2ccc(C)c(NC(=O)CN3CCCCC3)c2)n1	773730622	IPJITQBUYADBHK-UHFFFAOYSA-N	441.492	1.300	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2cccc(Cl)c2C)n([C@H]2CCS(=O)(=O)C2)n1	773768043	JMSLYTNAIGOLMA-LBPRGKRZSA-N	425.898	1.595	50	20	IDGD	
CCOC(=O)N1CCC[C@@H]([C@@H](C)NC(=O)NNC(=O)c2cc(Br)c[nH]2)C1	776844080	DLLYUFFCDVOHLP-GHMZBOCLSA-N	430.303	1.978	50	20	IDGD	
O=C(NNC(=O)N1CCO[C@@H](c2ccc(F)cc2F)C1)C1CCN(c2ncccn2)CC1	777508204	LOAZYPPTCOZWHB-GOSISDBHSA-N	446.458	1.786	50	20	IDGD	
COC(=O)Nc1ccc(S(=O)(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)cc1[N+](=O)[O-]	777619615	LZNDFBJRCMLDPU-HNNXBMFYSA-N	436.402	1.086	50	20	IDGD	
O=C(c1ccc(N2CCCC2=O)cc1)N1CCN(S(=O)(=O)CBr)CC1	777779130	FTOPPUNOAWBXHW-UHFFFAOYSA-N	430.324	1.253	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)c1cc(F)cc([N+](=O)[O-])c1Br	778441180	JOVMAJCQVWQAQA-UHFFFAOYSA-N	435.206	1.782	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)c1cnn(Cc2ccc(OC)c(OC)c2)c1	779367736	FFFIWLHMQHYLDE-UHFFFAOYSA-N	439.472	1.830	50	20	IDGD	
O=C(CSc1ccccc1O)NNS(=O)(=O)[C@H]1CCCN(C(=O)C2CCCC2)C1	781533035	WVFDWLHFUSIREC-HNNXBMFYSA-N	441.575	1.616	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)C(=O)Nc1ccc2c(c1)CCC(=O)N2CC(F)(F)F	782125176	WVMGEWFNGTXGEB-UHFFFAOYSA-N	449.389	1.252	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)c2ncccc12	782888801	YPKZEQVESWEEHI-UHFFFAOYSA-N	432.440	1.459	50	20	IDGD	
CS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccc(-c3n[nH]c(C4CC4)n3)cc2)cc1	783071720	OKAVQMNENFVOQQ-UHFFFAOYSA-N	440.485	1.834	50	20	IDGD	
CNC(=O)COc1ccc(NC(=O)C(=O)NNc2ccc(Br)c(C)c2)cc1	783923625	UXZQJAZRROAHMN-UHFFFAOYSA-N	435.278	1.964	50	20	IDGD	
O=C(NNC(=O)C(=O)N1CCCC1)C(=O)Nc1cccc(CSCc2ccccc2)c1	784000250	SJBPLKAGBAHCTE-UHFFFAOYSA-N	440.525	1.828	50	20	IDGD	
COC(=O)CNC(=O)c1ccc(NC(=O)C(=O)NNc2ccccc2C(F)(F)F)cc1	784825086	RZFHBDGTRVOGGE-UHFFFAOYSA-N	438.362	1.690	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)c(OC)c1	784835687	SUAOIZRLWNJUGJ-UHFFFAOYSA-N	429.401	1.782	50	20	IDGD	
C[C@@H]1COCCN1c1ccc(NC(=O)C(=O)NNc2cccc(S(C)(=O)=O)c2)cc1	784842044	UGJHZJHLWOAGAY-CQSZACIVSA-N	432.502	1.397	50	20	IDGD	
COc1cccc(NNC(=O)C(=O)Nc2ccnn2Cc2cnn(-c3ccccc3)c2)n1	784844103	UKFOBSLYHHJNCE-UHFFFAOYSA-N	432.444	1.603	50	20	IDGD	
C[C@H](c1ccccc1)n1ccc(NC(=O)C(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)n1	785023442	IRYVXBRCBJKMED-GFCCVEGCSA-N	438.400	1.506	50	20	IDGD	
N#Cc1ccc(NNC(=O)C(=O)Nc2cccc(S(=O)(=O)NC3CC3)c2)cc1Cl	785094938	MVOWKPYOHHLETK-UHFFFAOYSA-N	433.877	1.734	50	20	IDGD	
CN1CC(=O)N(c2cccc(NC(=O)C(=O)NNc3ccc(C#N)c(Cl)c3)c2)C1=O	785094994	NPCHAYWGQITJDB-UHFFFAOYSA-N	426.820	1.692	50	20	IDGD	
Cn1cc(-c2ncccc2NC(=O)C(=O)NNC(=O)Cc2cccc3ccccc23)cn1	786417750	YCBASCHDALVFPU-UHFFFAOYSA-N	428.452	1.964	50	20	IDGD	
Cc1ccc(NC(=O)[C@@H](C)OC(=O)/C(C#N)=C\C2CC2)cc1S(=O)(=O)N1CCOCC1	786679240	YADUCDRNGFAXMF-QJISPJEISA-N	447.513	1.746	50	20	IDGD	
O=C(CCC(=O)N1CC(=O)Nc2ccccc21)NNC(=O)NCc1ccc(Cl)cc1	787434077	QOTOZUQQGQZAQS-UHFFFAOYSA-N	429.864	1.936	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)[C@H]1CCCN1c1ccccc1	787438817	FKSHJSSMBHAZIL-OAQYLSRUSA-N	435.528	1.261	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CC(=O)c2ccccc21)c1cccc(S(=O)(=O)N2CCCC2)c1	789604894	MZZFHKVTEHPODX-GOSISDBHSA-N	427.482	1.602	50	20	IDGD	
O=C(NNC(=O)[C@H]1OCC[C@H]1c1ccccc1)C(=O)Nc1cccc(Cn2cccn2)c1	789810469	NXAMZQSUAXFXHJ-PMACEKPBSA-N	433.468	1.590	50	20	IDGD	
O=C(Cc1cc[nH]n1)NNC(=O)Nc1cc(Br)cc(C(=O)N2CCCC2)c1	790599084	RSGFXEQUSVMFJM-UHFFFAOYSA-N	435.282	1.804	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1cc([C@@H]2CCCOC2)nn1C	790952983	YRJDOCNHPBDDQS-QWHCGFSZSA-N	433.440	1.007	50	20	IDGD	
CN1CCC/C1=N/S(=O)(=O)c1cccc(NC(=O)NNc2nc3ccccn3n2)c1	792248076	OQSLATMNEIMBNV-JLPGSUDCSA-N	428.478	1.691	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)[C@@H]3CCN(CC(F)(F)F)C3)n[nH]2)cc1OC	792280187	DHQKQEDIKKBAEM-GFCCVEGCSA-N	441.410	1.739	50	20	IDGD	
COCc1cc(C(=O)OC)cc(S(=O)(=O)NNC(=O)c2c(C)nc3ccccn23)c1	793350920	RVXQUGJPIAAQAL-UHFFFAOYSA-N	432.458	1.199	50	20	IDGD	
Cc1ccccc1[C@H](CC(=O)NNC(=O)CNC(=O)OCc1ccccc1)NC(N)=O	794060672	NDOQMJGGVVNRRB-KRWDZBQOSA-N	427.461	1.168	50	20	IDGD	
CC(=O)Nc1cc(S(=O)(=O)NNC(=O)CNC(=O)OCc2ccccc2)ccc1F	794596516	HKECRUBRXAOZIM-UHFFFAOYSA-N	438.437	1.020	50	20	IDGD	
C=CCNC(=S)NNC(=O)[C@@H]1Cc2ccccc2CN1S(=O)(=O)c1ccc(C)cc1	798306588	MQLVCMSFPLPTIM-IBGZPJMESA-N	444.582	1.792	50	20	IDGD	
CC(C)Oc1c(N)cccc1C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	798702318	USNWZFFFFFANQU-QGZVFWFLSA-N	429.429	1.200	50	20	IDGD	
C[C@H]1CN(c2ccnc(C(=O)NNC(=O)Nc3ccc(S(C)(=O)=O)cc3)c2)C[C@H](C)O1	802068228	FXCLPASKCRAJDM-KBPBESRZSA-N	447.517	1.565	50	20	IDGD	
O=C(Cc1nc(-c2ccccc2)cs1)NNC(=O)CN1C(=O)[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O	802577953	XWJSMPLZMJVQEO-WZBLMQSHSA-N	436.493	1.307	50	20	IDGD	
CCc1ccc(NC(=O)C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1Cl	806974659	QQVBNUVJENXCBZ-UHFFFAOYSA-N	427.848	1.549	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)c1ccc(Cl)c(S(=O)(=O)N2CCCC2)c1	807369341	VZQIWIOAQOROFQ-UHFFFAOYSA-N	447.941	1.675	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCC(=O)NNc2ccc(Cl)nc2)cc1OCC	810461224	ULULHDZODNPHKU-UHFFFAOYSA-N	428.898	1.954	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)N(C[C@@H]2CCCO2)[C@@H]2CCS(=O)(=O)C2)c1C	811966824	FUOKATWBUGYKPQ-RPZZFCEOSA-N	449.573	1.853	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCc2nncn2C1)c1nc(-c2ccccc2)n(-c2ccccc2)n1	814217302	AVMZBCDCWHHVED-INIZCTEOSA-N	428.456	1.549	50	20	IDGD	
O=C1CNC(=O)c2ccc(C(=O)NNc3ccc(S(=O)(=O)C(F)(F)F)cc3)cc2N1	815854080	MTIXPAOBNUIWSA-UHFFFAOYSA-N	442.375	1.419	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)C2CCC(OC[C@H]3CCCO3)CC2)cc1	816596699	MMNYVGNVQQLSBH-BDVYOWHSSA-N	439.534	1.997	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)c1ccccc1-n1cnnn1	849201999	JWMBTSULAAHYFU-LLVKDONJSA-N	431.250	1.653	50	20	IDGD	
Cc1cc(C)c(N2C[C@@H](C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)CC2=O)c(C)c1	914752298	LULMBXQZMHLPPX-KRWDZBQOSA-N	433.472	1.402	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2nc(N3CCCC3)ncc2Cl)cc(OC)c1OC	916033995	UNENEXFRDDPLLQ-UHFFFAOYSA-N	435.868	1.831	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NCc2ccccc2Cn2cccn2)c2ccccc2c1=O	916227756	KWHCDHQTESDHSD-UHFFFAOYSA-N	431.456	1.323	50	20	IDGD	
Cc1n[nH]cc1CCCNC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	916259978	RIAPTAAUNMQTPU-UHFFFAOYSA-N	434.522	1.079	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NCC[C@](O)(c1nccn1C)C(F)(F)F	916378801	UHNNRVLXALWXLY-DIFFPNOSSA-N	447.389	1.497	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCCNc1ccc(C#N)cn1	916520401	HSIXOMPGVFJBJR-LBPRGKRZSA-N	447.293	1.926	50	20	IDGD	
CC(=O)NCCc1ccc(S(=O)(=O)NNC(=O)c2ccc(Br)s2)cc1	917727625	NALPDZIVZKLQSU-UHFFFAOYSA-N	446.348	1.813	50	20	IDGD	
O=C(NNC(=O)c1ccccc1S(=O)(=O)N1CCOCC1)c1ccc2ccccc2c1	918622495	PICCNYZABHLBLO-UHFFFAOYSA-N	439.493	1.936	50	20	IDGD	
CS(=O)(=O)N1CCCC[C@@H]1C(=O)OCC(=O)NN=C(c1ccccc1)c1ccccc1	919245386	MKZTZSFYINLGHS-LJQANCHMSA-N	443.525	1.913	50	20	IDGD	
CC(C)[C@@H](C(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)n1nnc(-c2ccccc2)n1	919692847	YCNXCTUNUHBPAT-SFHVURJKSA-N	446.471	1.245	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)CN2C(=O)N[C@](C)(c3ccc(C)cc3)C2=O)cc1	919835671	OJMSZCLFBKYYNC-HSZRJFAPSA-N	438.484	1.551	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)CCc1c(C)nc2c(c(OC)nn2C)c1C	920424772	ZQXCMYQMAOPLGR-UHFFFAOYSA-N	441.488	1.761	50	20	IDGD	
NS(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2ccc(Br)cc2)s1	1317865902	CWILQKFDYBITLL-UHFFFAOYSA-N	433.309	1.302	50	20	IDGD	
CC(C)(C)c1ccc(NNC(=O)NCc2ccc(S(=O)(=O)N3CCOCC3)cc2)nn1	1318590017	VLVOFSKBYTYHTE-UHFFFAOYSA-N	448.549	1.621	50	20	IDGD	
N#CCc1ccc(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1	1330731442	OCTUPYNOOBFZCB-UHFFFAOYSA-N	448.526	1.160	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2ccccc2Cl)c(C(=O)OC)s1	1338293788	NMSREFWUWAQISE-UHFFFAOYSA-N	432.863	1.598	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H]3CN(Cc4ccccc4)CCO3)C2)C1	1778278494	LCDJVLHMQMEPLC-MZKRTTBSSA-N	449.979	1.735	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@@H](C(=O)N2CCO[C@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)C1	1779301838	VPQZLTKWTHMZHR-LZJOCLMNSA-N	440.613	1.647	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ncccc3Br)C2)C1	1779652434	CSXNBQPNKAKFOI-GUYCJALGSA-N	446.729	1.541	50	20	IDGD	
COc1cc(C(=O)N2CC[C@]3(CN(C(=O)CCBr)CCO3)C2)cc(Cl)n1	1779792253	WNYGXIGDIAFPPH-KRWDZBQOSA-N	446.729	1.972	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(CN(C(=O)c3cnc[nH]3)CCO2)C1	1780095000	BNZJZDJJDCWTBL-HXUWFJFHSA-N	443.416	1.001	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)n(C(F)F)n1	1780313089	RMKFAACVADQXBD-MEDUHNTESA-N	435.269	1.814	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1cnccn1)C2	1780707870	VJNIKJYAXZHMMY-ATZDWAIDSA-N	429.348	1.769	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnc(Cl)nc1)C2)[C@@H](F)Br	1780770106	BTULTGYVYOEQTM-XHBSWPGZSA-N	449.708	1.948	50	20	IDGD	
CN1CCC[C@H](C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](F)Br)C2)C1	1780773656	KUIJYYGGRCJVFC-JTOWHCCKSA-N	434.350	1.533	50	20	IDGD	
COc1cccc(CCC(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)n1	1781327065	WUMLKPPPUFIKMB-AEFFLSMTSA-N	444.301	1.543	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](O)NC(=O)OC(C)(C)C)C2)C1	1781853818	QITBHWFVVMUWKK-CKFHNAJUSA-N	433.933	1.067	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C23CC(C(=O)OC)(C2)C3)C1	1781960675	FHPIFZJTQSITGE-GJWIZFIESA-N	426.941	1.861	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc3ncnn3c1)C2)C(Cl)Cl	1782217981	GKOKTJKNNZTREZ-FZKQIMNGSA-N	426.304	1.661	50	20	IDGD	
O=C([C@@H](F)Br)N1CCO[C@@]2(CCN(C(=O)C(F)(F)c3ccco3)C2)C1	1782723326	PNOFUMDIXVKGNS-RISCZKNCSA-N	425.201	1.892	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cn4c(F)cccc4n3)CCO2)C1	1783538530	XYTJRBGLJMOYLW-KZULUSFZSA-N	439.285	1.700	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccnc3S)[C@H]2C1	1783548811	PHLOZCWHPIGNQG-IMIFBBOLSA-N	428.352	1.747	50	20	IDGD	
CCSc1cccnc1C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](Cl)COC)C2)C1	1783880413	BNQHTSILTMKKPQ-LIRRHRJNSA-N	427.954	1.891	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(OC)c(N(C)C)c3)CCO2)C1	1783880539	JYLCMIWLYSJQFA-IERDGZPVSA-N	439.940	1.459	50	20	IDGD	
CCn1nc(C(C)C)cc1C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](Cl)COC)C2)C1	1783881699	MIMICIJAGFFJPQ-YWZLYKJASA-N	426.945	1.724	50	20	IDGD	
COc1cc(CC(=O)N2CCO[C@@]3(CCN(C(=O)C(Cl)Cl)C3)C2)ccc1[N+](=O)[O-]	1783947310	SIARVMHCBUJKQT-SFHVURJKSA-N	446.287	1.780	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc(F)cn3)C[C@@H]21	1783965241	DISKYROBLKWTEX-OQUILHJVSA-N	442.329	1.774	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc(N)s3)C[C@@H]21	1783967804	MELCCEWIYSJBRJ-BJDJZHNGSA-N	431.356	1.350	50	20	IDGD	
C[C@H](Oc1cccnc1)C(=O)N1CC[C@@]2(CN(C(=O)CCBr)CCO2)C1	1784549101	XHSAVXAJFIZVCQ-KBXCAEBGSA-N	426.311	1.464	50	20	IDGD	
O=C(CCn1c(=O)oc2ccccc21)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Cl)C[C@@H]21	1785194483	MOLJEFCJOHLXSH-RASHJEQFSA-N	439.871	1.499	50	20	IDGD	
Cc1nc2ccncc2cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21	1788285893	KNSIQTLCVXPGEE-IVJVFBROSA-N	432.908	1.131	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CC[S@](=O)CC)[C@H]2C1	1788490374	BPSFLEPAIQSSBH-YCTKJRKISA-N	437.400	1.298	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)n3ccccc3=O)[C@H]2C1	1788750736	OIWULRSGNVHNER-QRJUGERDSA-N	440.338	1.172	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](CN)c3ccccc3)C[C@@H]21	1788765305	ZMQSHPDKIQGIAL-YRPNKDGESA-N	433.625	1.560	50	20	IDGD	
C[C@@H](Cn1cncn1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]2C1	1789870536	MHGDDXHGJSUHNV-QHLBIMPKSA-N	432.352	1.130	50	20	IDGD	
C=C(CC(=O)OCC)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21	1789892314	PHAQUFHIEVMJQA-PWNZVWSESA-N	435.290	1.166	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(O)cc3F)[C@H]2C1	1790082255	LMYJIQMNASSODJ-KHJVZFFJSA-N	429.286	1.908	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN(C)C(=O)OC(C)(C)C)C[C@@H]21	1791251701	PWNRNAGDVZTGMZ-VGWMRTNUSA-N	447.960	1.087	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc4c(c3)CCO4)C[C@@H]21	1791258066	YCNRZTCRACTHHE-GNBUJSLZSA-N	436.936	1.398	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1ccc(C2(NC(=O)c3cnc(O)nc3O)CCC2)cc1	1791600172	SIXGKAFAONAPPW-UHFFFAOYSA-N	442.476	1.009	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1(c2ccc(NC(=O)C3CN(C)C3)cc2)CCC1	1792006375	KVYFCGFASGIIBE-JFLMPSFJSA-N	436.516	1.816	50	20	IDGD	
CC(C)Oc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](O)CCl)C[C@@H]32)cc1C#N	1792055994	SHHGGABMKLHIDL-BOLBYERCSA-N	449.935	1.538	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COc1ccc(F)cc1)C2	1792868023	QNZSMRDLZAQTAP-FLTUCWPJSA-N	443.313	1.825	50	20	IDGD	
Cc1ccc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Br)C3)nc1	1794091136	GAYISEUTVCDMKK-RMHZUWNSSA-N	428.302	1.603	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1(C)COC1)C2	1794141613	SSWRGGNJBUUIDY-XGUBFFRZSA-N	429.945	1.793	50	20	IDGD	
CNCCCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)C2	1795594933	CBWXVNWNUSISII-JFABSOQWSA-N	432.471	1.461	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)[C@H]1C[C@H]1c1ccc(Cl)cc1	1797189782	UZFLAJASROEGCZ-FSJXUFIESA-N	427.328	1.633	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1coc([Si](C)(C)C)c1	1797727487	RXQUXHOLOAWACK-IVSAIRAKSA-N	428.989	1.282	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C=N/O[C@H]1CCCCO1	1797817111	YJAQLWQBPHZPSJ-XPLDTJOOSA-N	446.342	1.279	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(OC)c(NC(C)=O)c1	1798608245	FEPYBEQRIXMMSB-RCJHGTSTSA-N	437.924	1.874	50	20	IDGD	
CN1CCCn2nc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)CO[Si](C)(C)C)cc2C1	1798628670	DTSKKQZUNSOFGJ-BJWYYQGGSA-N	433.629	1.822	50	20	IDGD	
COC(=O)Nc1cccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CO[Si](C)(C)C)C3)c1	1799427365	VSGDTSUPGBIONY-HGKCTWBKSA-N	449.580	1.920	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1c(O)cc(O)cc1O	1799658112	ZOJFVYVIPHEUEL-KDAHECLUSA-N	433.288	1.243	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1c(F)ccc(O)c1F	1799729275	LTHQKNVPTNYAFU-KFRQHLNQSA-N	433.249	1.657	50	20	IDGD	
COc1cccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)Br)C3)c1C	1800822450	CZORJUFPYDVOCA-JNNRSPCRSA-N	439.350	1.919	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cc(F)ccc1F	1801976004	ZXAHQMMJNVQKJY-YVWYUNDQSA-N	426.536	1.948	50	20	IDGD	
C#CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](Cl)CC)C2	1802129068	YSRTYDQNOITMRV-NNXHMXCWSA-N	441.956	1.510	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](O)CCl)C3)C1	1802578501	QOEUWVCXRHRMHS-NQNKBUKLSA-N	443.972	1.871	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)COc2ccc(F)cc2)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803139324	WUEWIDAWCUNQSB-ZAAXVRCTSA-N	435.883	1.905	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2n[nH]c(C3CC3)c2F)[C@H]1c1cccnc1)[C@@H](O)CCl	1803141269	MLLFOKHGQKJYCI-DEYYWGMASA-N	435.887	1.741	50	20	IDGD	
CCC(=O)N[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)[C@H](C)Br)[C@H]1c1cccnc1	1803436566	GEZJTTVJKMHSJU-YXPYIKCWSA-N	439.354	1.786	50	20	IDGD	
CCC[C@H](NC(C)=O)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2	1804206794	KBXNLZMYTAEVGF-ZKUSUILTSA-N	444.536	1.063	50	20	IDGD	
Cc1csc(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)c1	1807358936	ANSBQQOOWNBYNU-NQIIRXRSSA-N	449.341	1.765	50	20	IDGD	
C#CCCCCC(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1807366892	HXVAGOMHHOSIDM-REWPJTCUSA-N	433.317	1.275	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC2(CCCN(C(=O)c3cccnc3C(N)=O)C2)CC1	1807381496	IOAIKDLFDGCRSF-ZDUSSCGKSA-N	437.338	1.809	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)Br)[C@H]1c1cccnc1	1808233339	LJMGUOCCIURCJF-UNQGMJICSA-N	440.342	1.318	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@H]1CCN(C(=O)[C@@H]2CCC(=O)N2)[C@@H]1c1cccnc1	1808296569	SCGWNIVGEBFRFR-DZASIIFFSA-N	427.332	1.602	50	20	IDGD	
Cn1ncc2c(C(=O)NC[C@@H]3CCN(C(=O)[C@@H](O)CCl)[C@@H]3c3cccnc3)cccc21	1809428949	VPXBPFUMDFEKSJ-RYGJVYDSSA-N	441.919	1.888	50	20	IDGD	
CC(=O)N[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)[C@@](C)(Cl)CCl)[C@@H]1c1cccnc1	1812657695	XCJJRQBWZZXNRK-XIEZEKGWSA-N	429.348	1.848	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)CN2CCOC2=O)[C@H]1c1cccnc1	1812864950	YNVJTXLXLJCZSE-BJJXKVORSA-N	439.310	1.323	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CSCC(=O)OC)n[nH]1	1815224206	CXJAKXITEXXWLW-DGCLKSJQSA-N	432.930	1.562	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H]1CCC(F)(F)C1)CC2)c1ccc(B(O)O)cc1	1815336001	WFEXGUVERWEOCF-OCCSQVGLSA-N	449.288	1.484	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3nc4ccccn4n3)sc2C1	1816659302	AYKAYJFCKPAPRY-WDEREUQCSA-N	434.909	1.665	50	20	IDGD	
CNc1ccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)cc1	1817274601	XMHYZJGHFFGIRD-HXUWFJFHSA-N	447.304	1.751	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CN2CCNC2=N)n[nH]1	1817299078	WWXABZHQPNTHPK-DGCLKSJQSA-N	440.346	1.415	50	20	IDGD	
Cc1cccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)n1	1817470493	CCWSFGWULNHPCN-IBGZPJMESA-N	433.277	1.413	50	20	IDGD	
CN1CCN(CC(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@@](C)(Cl)CCl)CC3)CC1	1818802927	OQYSVSCIUDCMDM-SGTLLEGYSA-N	448.420	1.539	50	20	IDGD	
Cc1ccncc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819402536	AYTNVHHCECVQMH-GOSISDBHSA-N	448.487	1.731	50	20	IDGD	
C[C@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)/C=C\C(=O)NC3CC3)sc2C1	1819532981	YANIYELWJPVLNH-HPJPHGGJSA-N	441.351	1.673	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](COC)NC(C)=O)sc2C1	1820184867	XDADYSFKDFZXSU-DYEKYZERSA-N	430.958	1.614	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@H](F)Br)CC2)c1cc(CO)on1	1821704141	OJEJVEBIPPIVHA-KBUNVGBDSA-N	433.259	1.540	50	20	IDGD	
C[C@@H](C(=O)Nc1nc2c(s1)C[C@H](NC(=O)C(Cl)Cl)CC2)N1CCN(C)CC1	1822697116	IXZPZZUWSHBZNA-WDEREUQCSA-N	434.393	1.495	50	20	IDGD	
CC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCN1CCN(C)CC1)CC2	1822844108	URGOGYJTKNSGSN-KGLIPLIRSA-N	428.002	1.710	50	20	IDGD	
O=C([C@@H]1Cc2ccccc2CN1)N1CCC([C@H]2CCCCN2C(=O)[C@H](O)CCl)CC1	1824182997	NCVTXUUXGDUJRP-PWRODBHTSA-N	433.980	1.920	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3c(O)cc(O)cc3O)C2)C1	1830363955	UUICJQVDYYYQQE-FQEVSTJZSA-N	442.896	1.138	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)C3CCC(O)CC3)C2)C1	1830544040	LQNIMXJGTQNXNA-YHRBYZFPSA-N	447.370	1.025	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)n3ccccc3=O)C2)C1	1831651515	QJSKNKZSHWJPPY-FIKGOQFSSA-N	439.940	1.273	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)C2CCSCC2)CC1	1832943403	NGEROPPQSASDSC-OAQYLSRUSA-N	444.406	1.743	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cn4ccsc4n3)CC2)CC1)[C@@H](O)CCl	1833310647	XWKQWCIMHCTIOJ-INIZCTEOSA-N	439.969	1.181	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)c1ccnc(C(F)F)c1	1833921414	NKEXONASPIQPLL-KRWDZBQOSA-N	444.910	1.804	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3ccc(F)c(C)n3)CC2)CC1	1833962560	FWSRAPNQIVAEHX-QGZVFWFLSA-N	440.947	1.968	50	20	IDGD	
O=C(CCc1ccsc1)NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1834825208	AHVSCJYOXSWOKR-SFHVURJKSA-N	427.998	1.852	50	20	IDGD	
CN(C)c1ccc(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](F)Cl)CC3)CC2)cn1	1836005160	CTEJLMXKXVFWKY-GOSISDBHSA-N	425.936	1.867	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)CS[C@@H]3CCCCO3)CCO2)C1	1837501244	IHMGAWLPFOQJMD-XLIONFOSSA-N	449.013	1.968	50	20	IDGD	
C#CCCCCC(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1	1837920958	MMOHWMKRZFFPHV-UHFFFAOYSA-N	440.349	1.172	50	20	IDGD	
O=C(c1cccn2c(O)nnc12)N1CCC(OC2CCN(C(=O)[C@H](F)Cl)CC2)CC1	1838061501	PWTPPBSTRPPXFA-HNNXBMFYSA-N	439.875	1.582	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)CBr)C2)C1	1839141351	GBFASUPYKPBMBR-XEZPLFJOSA-N	425.751	1.491	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)C3CCC4(CC3)OCCO4)CCO2)C1	1839773786	MXRMJHRJNWCVPT-FXAWDEMLSA-N	444.956	1.394	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)Cc1ccccc1O)CCO2	1839908490	HYZVDPLFBMKCMM-NRFANRHFSA-N	436.581	1.243	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)COc3ccccc3F)CCO2)C1	1839969738	ZSQRRKKBRMECPJ-FOIQADDNSA-N	428.888	1.678	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccccc3O)C2)C1	1840035443	RNWIELOXMFUZOT-AUUYWEPGSA-N	441.322	1.175	50	20	IDGD	
CCc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](Cl)COC)CCO3)cc(C)n1	1840152771	SLTBNBVYNYOJNI-RXVVDRJESA-N	439.940	1.276	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H](C)Cc3ccccc3)CCO2)C1	1840301115	DDCKOMOEJLHVKQ-JLMWRMLUSA-N	438.952	1.575	50	20	IDGD	
CC(C)(C)OC(=O)NC1(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)CC1	1840956370	RYLARAKNCDRACB-ACJLOTCBSA-N	449.907	1.035	50	20	IDGD	
CC(C)[C@H](C(=O)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1)c1ccc(F)cc1	1843015180	QUHKERAGVGEICX-NRFANRHFSA-N	438.308	1.762	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)c2cc3c(F)cc(F)cc3[nH]2)C1	1843703959	QNHDOGUMNSZGPR-UHFFFAOYSA-N	439.227	1.257	50	20	IDGD	
O=C([C@@H](Br)Cc1ccccc1)N1CC2(CCCN2C(=O)c2c[nH]c(=O)cn2)C1	1844763978	SCGVIKLDTAGSPM-HNNXBMFYSA-N	445.317	1.593	50	20	IDGD	
COC(=O)CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)[C@H](F)Cl)C2	1845146316	NEAQXCAWNWPWCN-JSGCOSHPSA-N	449.907	1.571	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)c2c[nH]c3c(Cl)cccc23)C1	1845681972	DFMLCOQTNABPTK-UHFFFAOYSA-N	437.692	1.632	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)[C@@H](C)n2ccnn2)C1	1845814296	UQAUQAXPNLLQFD-CYBMUJFWSA-N	442.432	1.190	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)COc1cccc3ccccc13)C2	1846384106	DORJXVCWTZEPST-UHFFFAOYSA-N	438.528	1.795	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CC[C@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](O)CCl)C1	1847559585	SVSBLCNFABMOLZ-QRJUGERDSA-N	429.945	1.481	50	20	IDGD	
CC(C)(C)OC(=O)NC12CC(C(=O)N3CC[C@H]4[C@@H]3CCN4C(=O)[C@@H](O)CCl)(C1)C2	1847562288	AMXGELQBJXJYKD-ONLHCCILSA-N	427.929	1.235	50	20	IDGD	
CCOc1ccc(NS(=O)(=O)c2ccc(C(=O)NNc3nnc(C)c(=O)[nH]3)cc2)cc1	11266039	GPWDFRXVESXRRL-UHFFFAOYSA-N	444.473	1.430	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)[C@@H]2CC(=O)N(c3ccc4c(c3)OCCO4)C2)cc1C	15886445	FICVOJMQEAHSIS-MRXNPFEDSA-N	439.468	1.654	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc1	17513623	NPSURKQGPCEEIL-UHFFFAOYSA-N	428.470	1.183	50	20	IDGD	
CC(C)n1nc(C(=O)NNS(=O)(=O)c2ccc3c(c2)CC(=O)N3)c2ccccc2c1=O	26318802	XNZUABYEDWCILR-UHFFFAOYSA-N	441.469	1.095	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1cnn(-c2ccccc2)c1C	27193302	SSPMEXLOXQKSSQ-UHFFFAOYSA-N	426.502	1.857	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)c1cccc(NS(=O)(=O)c2ccccc2)c1	725739982	PVSZANDLLWXLAS-UHFFFAOYSA-N	442.453	1.271	50	20	IDGD	
COc1ccc(Br)cc1CNC(=O)NNC(=O)CNC(=O)c1cccs1	726249774	LKKPLYCSMCNCMQ-UHFFFAOYSA-N	441.307	1.780	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NC[C@@H]1CCCN(Cc2cccs2)C1	726250059	QVRWLRHXZWMYTI-AWEZNQCLSA-N	435.575	1.782	50	20	IDGD	
O=C(CN1CCN(C(=O)c2c(F)cccc2F)CC1)NNC(=O)c1cccc(Cl)c1	727831522	GUSRXLWVCOIRRV-UHFFFAOYSA-N	436.846	1.837	50	20	IDGD	
CSC[C@H](C(=O)NNc1nc(-c2ccncc2)no1)N1C(=O)[C@H]2CCCC[C@@H]2C1=O	728073319	FLYNFVNKRCDHPR-MELADBBJSA-N	430.490	1.482	50	20	IDGD	
CCOc1ccc(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)cc1OC	728212918	LLBMVJKGURRMEE-UHFFFAOYSA-N	448.545	1.787	50	20	IDGD	
C[C@@H](Oc1ccc(F)c(F)c1)C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	728336312	JTXMZCDWCCZNCM-PIGZYNQJSA-N	436.367	1.263	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CS(=O)(=O)Cc2cccc(Br)c2)c1	728825980	ZUIGSTXHWKGRDV-UHFFFAOYSA-N	436.287	1.697	50	20	IDGD	
O=C(Cc1cccnc1)NNS(=O)(=O)c1cc(Br)cc(C(=O)O)c1F	728856621	YMKYUMFLPPCPHF-UHFFFAOYSA-N	432.227	1.234	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(OCC(F)(F)C(F)F)nc2)c1	729177224	VVIFCWHASSMTOB-UHFFFAOYSA-N	449.382	1.839	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)c2c(F)ccc(S(=O)(=O)NC3CC3)c2F)cc1	729833345	FPNJHCMOXBEBRJ-UHFFFAOYSA-N	439.440	1.554	50	20	IDGD	
CCCCN1C(=O)CC[C@H](C(=O)NNC(=O)Cc2cc[nH]n2)[C@@H]1c1ccc(OC)cc1	730102458	DYBZSJRVLKQDOF-RXVVDRJESA-N	427.505	1.888	50	20	IDGD	
CC(C)COc1cn(-c2ccccc2)nc1C(=O)NNC(=O)CNC(=O)c1ccco1	730750921	XODMCLIPMVBOPO-UHFFFAOYSA-N	425.445	1.691	50	20	IDGD	
O=C(CNC(=O)c1c(Cl)cccc1[N+](=O)[O-])NNC(=O)c1cccc2ncccc12	731052491	TWUROGQSRRSVDK-UHFFFAOYSA-N	427.804	1.987	50	20	IDGD	
CC(C)(C(=O)NNC(=O)NCCNS(=O)(=O)c1cccc(Cl)c1)c1ccccc1	731219607	AIWWXHKKXGPGSE-UHFFFAOYSA-N	438.937	1.927	50	20	IDGD	
C[C@@H](CC(=O)NNC(=O)c1cccc(N(C)C)c1)NS(=O)(=O)c1cccnc1Cl	731891931	SYAAQXIDNRIVGV-LBPRGKRZSA-N	439.925	1.319	50	20	IDGD	
O=C(NNC(=O)C1CCN(S(=O)(=O)c2cccc(OC(F)(F)F)c2)CC1)C1CCC1	732140889	DZZAIMOINVGZBZ-UHFFFAOYSA-N	449.451	1.933	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2cnn(-c3ccccn3)c2C(F)(F)F)C[C@H](C)O1	732262584	UPCBSNHKKWASQD-STQMWFEESA-N	440.426	1.546	50	20	IDGD	
COc1nn(C)c2nc(C)c(CCC(=O)NNC(=O)CCN3C[C@@H](C)O[C@H](C)C3)c(C)c12	732264912	XYXILZWRJCQELF-ZIAGYGMSSA-N	446.552	1.173	50	20	IDGD	
Cc1cccc(N2C(=O)N[C@H](CCC(=O)NNc3ccccc3S(C)(=O)=O)C2=O)c1	732304688	YFKFULPCELLYKU-MRXNPFEDSA-N	430.486	1.747	50	20	IDGD	
O=C(COC(=O)c1cnc(-c2ccccn2)s1)NNC(=O)c1cccc([N+](=O)[O-])c1	732337678	SOJMQEVPYKQJSD-UHFFFAOYSA-N	427.398	1.731	50	20	IDGD	
C=CCNS(=O)(=O)c1cc(C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)ccc1F	733108746	XMUVYUPDORXQSW-UHFFFAOYSA-N	443.460	1.551	50	20	IDGD	
COc1ccc(CN2CC[C@H](NC(=O)NNC(=O)Cc3c[nH]c4ccccc34)C2=O)cc1	734683643	IZCRZAADQRJEFR-FQEVSTJZSA-N	435.484	1.851	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2cc(Cl)c(Cl)n2C)CC1	735118355	SYKPVDMEJJGJGF-UHFFFAOYSA-N	447.348	1.420	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)[C@]2(O)CCN(Cc3ccccc3)C2)cc1	735836772	IMXYKHZSSCLAPY-SBUREZEXSA-N	427.501	1.637	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)[C@@H]1CC(=O)N(c2cc(Cl)cc(Cl)c2)C1	740851256	WNUKFCDALSSNTJ-SNVBAGLBSA-N	429.304	1.799	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)[C@H]1CCCN(C(=O)COc2ccccc2)C1	741206389	CSDUXRWPHJRYBG-KRWDZBQOSA-N	441.484	1.539	50	20	IDGD	
CC(=NNC(=O)C[C@@H](C(=O)NN=C(C)c1ccc(C)o1)N1CCOCC1)c1ccc(C)o1	741766125	JNFSQIISYWMZBH-SFHVURJKSA-N	443.504	1.961	50	20	IDGD	
CC(=O)N[C@@H](Cc1c[nH]c2ccc(Br)cc12)C(=O)NNC(=O)c1c[nH]nc1C	742069557	ILAYFLVLQOZIKT-INIZCTEOSA-N	447.293	1.470	50	20	IDGD	
O=C(NNS(=O)(=O)c1c[nH]c(C(=O)N2CCCC2)c1)c1cccc(Br)c1	743264408	SFYNVFWNCXLIDW-UHFFFAOYSA-N	441.307	1.637	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)[C@@H]2CS[C@@H](Cc3ccccc3F)C(=O)N2)cc1	743828830	JHRMJZQZFAENRY-ROUUACIJSA-N	445.520	1.887	50	20	IDGD	
Cc1cccc([C@@H](CC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)NC(N)=O)c1	743830361	CUTMFPSXBJMVPK-MRXNPFEDSA-N	433.490	1.351	50	20	IDGD	
Cc1nc(COc2ccccc2C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)no1	744532466	RMMHCAAKNPGYMX-UHFFFAOYSA-N	435.396	1.447	50	20	IDGD	
COC1(C(=O)OCC(=O)NNC(=O)c2cccc(C)c2)CCN(C(=O)OC(C)(C)C)CC1	744826663	XVEQMMDAOVSEDI-UHFFFAOYSA-N	449.504	1.715	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NC(C)C)cc1S(=O)(=O)N[C@@H]1CCCC[C@H]1C	745147439	YZPHMIKMVVJGAS-UKRRQHHQSA-N	426.539	1.905	50	20	IDGD	
CC(C)C(=O)N(C)Cc1ccc(C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)cc1	745173825	HUWYQWGHBKOGQQ-UHFFFAOYSA-N	436.468	1.791	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)NCCc1ccccc1[N+](=O)[O-]	745882377	WDKLGKJCXDKQED-UHFFFAOYSA-N	440.504	1.680	50	20	IDGD	
O=C(CSc1nnc(-c2cccnc2)n1-c1ccccc1)NNC(=O)N1CCOCC1	745992915	NABIATLBPBBALK-UHFFFAOYSA-N	439.501	1.494	50	20	IDGD	
C[C@H]1C[C@H](C)CN(S(=O)(=O)c2cccc(C(=O)NNC(=O)Cc3ccncc3)c2)C1	747318610	AESUEOFIXVWAAR-HOTGVXAUSA-N	430.530	1.752	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(n2cc(C(=O)NNC(=O)Cc3ccncc3)nn2)CC1	747324885	PPACJFTUJPSSEE-UHFFFAOYSA-N	429.481	1.249	50	20	IDGD	
Cc1cccc(NS(=O)(=O)c2ccc(C(=O)NNC(=O)C(=O)N3CCCC3)cc2)c1C	748247395	ZVVQFPRQWNLKCN-UHFFFAOYSA-N	444.513	1.488	50	20	IDGD	
Cc1cccc(N2CCN(S(=O)(=O)CC(=O)NNc3cccc([N+](=O)[O-])c3C)CC2)c1	748683118	QSHKMAUOHINQSI-UHFFFAOYSA-N	447.517	1.807	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)NCC(=O)N2CCN(c3ccccc3)CC2)cc1	749220947	PAOFNWMRPFLFIY-UHFFFAOYSA-N	441.557	1.766	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=O)CCc2ccccc2)c1	749851996	VHYHANIVFPGEEK-UHFFFAOYSA-N	439.921	1.659	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)c1ccc(Br)cc1[N+](=O)[O-]	751016973	FAKOFKLZNFFLIG-UHFFFAOYSA-N	446.258	1.826	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)[C@H]1CCCN(C(=O)c2ccc(Cl)cc2)C1	751211125	MNUCWWAIAWMSSL-AWEZNQCLSA-N	448.932	1.831	50	20	IDGD	
COC(=O)c1ccc(Cl)cc1S(=O)(=O)NNC(=O)c1nnc(-c2ccccc2)o1	751271576	PFINVARJDXCBFP-UHFFFAOYSA-N	436.833	1.800	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(n2cc(C(=O)NNC(=O)Cc3ccc(F)cc3)nn2)CC1	751294655	HDHVBTXCAAQPMF-UHFFFAOYSA-N	446.483	1.993	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)Nc1cccc(C(=O)NCCC(N)=O)c1	756389161	AUYQTUNCBWKKKZ-LBPRGKRZSA-N	431.424	1.051	50	20	IDGD	
O=C(NNC(=O)c1c(Cl)cccc1Cl)Nc1ccn(CC(=O)N2CCOCC2)n1	756659137	NAOICBLTKMEUNP-UHFFFAOYSA-N	441.275	1.515	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)Nc2ccc(C)c(N3CCCS3(=O)=O)c2)cc1	756704248	JBTLEDWIAGPFHS-UHFFFAOYSA-N	448.501	1.775	50	20	IDGD	
Cc1c(NC(=O)NNC(=O)COc2ccc(C#N)cc2)cccc1S(=O)(=O)NC1CC1	756707655	VQNXNHJVCIUXPO-UHFFFAOYSA-N	443.485	1.539	50	20	IDGD	
CCOC(=O)[C@H](C)NC(=O)c1ccc(NC(=O)NNC(=O)CCc2ccccc2O)cc1	756791063	UATQZQVCSKCICJ-AWEZNQCLSA-N	442.472	1.859	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2ccnn2Cc2ccccn2)c2ccccc2c1=O	757786491	NMBMRRCGKPAKDB-UHFFFAOYSA-N	432.444	1.523	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)Nc2c(C)nn([C@H]3CCS(=O)(=O)C3)c2C)cc1C	757870826	ACACYHYYXACODN-INIZCTEOSA-N	449.533	1.708	50	20	IDGD	
COc1ccc([C@H](CNC(=O)NNC(=O)C(=O)Nc2ccccn2)N2CCCCC2)cc1	758666372	TYYZQKAWILUDMP-SFHVURJKSA-N	440.504	1.586	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H](C#N)[C@@H](NC(=O)NNC(=O)c2ccc3c(c2)OCCO3)C1	758759356	LHDDJHZRPMRLCG-KBPBESRZSA-N	431.449	1.161	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)NCCOc1ccc(C(F)(F)F)cn1	760717411	YKAAOEARWQBISP-UHFFFAOYSA-N	428.367	1.897	50	20	IDGD	
C[C@@H]1CCCCN1CC(=O)Nc1ccc(F)c(NC(=O)C(=O)NNC(=O)C(C)(C)C)c1	761073788	YIUWOZSEYKRXCY-CYBMUJFWSA-N	435.500	1.771	50	20	IDGD	
CC(C)CNS(=O)(=O)c1ccc(C(=O)NNc2nccc(N3CCOCC3)n2)cc1	762869276	UIZXPYPFLUJHRZ-UHFFFAOYSA-N	434.522	1.004	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(C)c(C(=O)NNc2nccc(N3CCOCC3)n2)c1	762869494	XVEQEWVPXCAMRS-UHFFFAOYSA-N	448.549	1.409	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1cn(C2CC2)c2cc(Cl)c(F)cc2c1=O	763011343	XNNFXPXORGELNL-SECBINFHSA-N	441.868	1.325	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNS(=O)(=O)c1ccc(F)c2ncccc12	763439745	QJXRWPYJSHKHBK-UHFFFAOYSA-N	426.470	1.988	50	20	IDGD	
O=C(NNC(=O)c1ccc2ccccc2n1)C(=O)Nc1cccc(CN2CCCC2=O)c1	763449747	HPIGMCXESXYRCC-UHFFFAOYSA-N	431.452	1.757	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(OCc2cccnc2)cc1	763467387	CUPXOGAADSVSHR-UHFFFAOYSA-N	435.396	1.969	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F	763550866	IFCZBOXDSKOVCU-UHFFFAOYSA-N	438.299	1.325	50	20	IDGD	
Cc1ccnc(Oc2ccc(NC(=O)C(=O)NNC(=O)c3ccc4c(c3)OCO4)cc2)n1	763557679	CXDXPIBXCMVVNX-UHFFFAOYSA-N	435.396	1.706	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)C2CC2)cc1)[C@@H]1C[C@H]2CC[C@H]1C2	763558363	NPIGHHJWRJMKDS-SDCOAXJVSA-N	448.545	1.286	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)Nc1cccnc1OCc1ccccc1	763571048	KGMPZERKNIDUSV-IBGZPJMESA-N	448.435	1.587	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(F)c(-n3nnnc3C)c2)c2ccccc2n1	763615730	HEGNBBVIBHOQCT-UHFFFAOYSA-N	448.418	1.366	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccnn2Cc2ccc(C)o2)cc1	763658861	FTLMEKRGMJFBQG-UHFFFAOYSA-N	427.417	1.006	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)nn1-c1cccc(F)c1	763680870	GYZBHGLXJAHQPO-UHFFFAOYSA-N	436.403	1.356	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(NC(C)=O)ccc1OC	763685924	ZULHGKFJKBUULS-UHFFFAOYSA-N	444.444	1.217	50	20	IDGD	
COC(=O)c1cc(OC)c(OC)cc1NC(=O)C(=O)NNC(=O)c1cccc(Cl)c1	763750984	VQDWLGQAXUVMHW-UHFFFAOYSA-N	435.820	1.544	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)C[C@@H](OC)C3)cc1	763859800	FWQUFAMEQQSDGF-XOBRGWDASA-N	441.484	1.752	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccc(C)c(NC(=O)c3ccncc3)c2)n1	763893261	SLLXOEKLXRDHGB-UHFFFAOYSA-N	449.471	1.242	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1ccc(-n2nc(C)cc2C)nc1	764010780	DEIDJZSDJKUBTM-UHFFFAOYSA-N	442.863	1.946	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1cccc(NC(=O)[C@H](C)OC)c1	764012569	SJJRMVDSIOZZJY-NSHDSACASA-N	448.863	1.722	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2cc(C3CC3)nn2-c2ccccc2)c1O	764132339	NFIKMRCQKSAXCU-UHFFFAOYSA-N	435.440	1.864	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cnn(-c3ccccn3)c2)o1	764138165	DQWFQSMNYRXFRH-UHFFFAOYSA-N	425.449	1.102	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)nn1-c1ccccc1Cl	764154407	QITSPINIGREJFJ-QGZVFWFLSA-N	439.859	1.924	50	20	IDGD	
O=C(CCc1ccco1)NNC(=O)C(=O)Nc1ccc(OCc2noc(C3CC3)n2)cc1	764169659	QTNXRKRBLYOZIG-UHFFFAOYSA-N	439.428	1.838	50	20	IDGD	
CSc1nnnn1-c1cccc(NC(=O)C(=O)NNC(=O)CCCc2ccccc2)c1	764223466	CFMWGYADGXLVSY-UHFFFAOYSA-N	439.501	1.493	50	20	IDGD	
O=C(Cc1ccccn1)NNC(=O)C(=O)Nc1ccc(OCC(F)(F)C(F)F)nc1	764270549	OJFJGANFZQYHAY-UHFFFAOYSA-N	429.330	1.084	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2O)ccc1C(=O)OC(C)(C)C	764278096	QRWILPREJQSXMG-UHFFFAOYSA-N	443.456	1.821	50	20	IDGD	
Cc1nc(-c2cccc(NC(=O)C(=O)NNC(=O)c3cnn(-c4ccccc4)c3)c2)n[nH]1	764343548	SFIPFWYRHQFTIS-UHFFFAOYSA-N	430.428	1.366	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2cnc(Cl)cc2C)n[nH]1	764376825	ILZWUAXLZSILDX-UHFFFAOYSA-N	428.836	1.842	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccccc3F)n[nH]2)cc1OC	764379238	SQKFKKNBZIOWCU-UHFFFAOYSA-N	427.392	1.633	50	20	IDGD	
CCNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)c1	764387288	INRIWQNWNKZDGU-UHFFFAOYSA-N	438.419	1.365	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1c[nH]nc1-c1ccccc1	764393618	JLHAHVYDKQIQOO-UHFFFAOYSA-N	425.470	1.964	50	20	IDGD	
O=C(NNC(=O)[C@H]1COCCO1)C(=O)Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1	764434020	PMSDFSVDCDNRAJ-SNVBAGLBSA-N	429.273	1.226	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCC2CC(OC(C)(C)C)C2)c1	764503955	DAOQQNFMYLOPKH-UHFFFAOYSA-N	440.566	1.865	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)NCc1cccc(N2CCCS2(=O)=O)c1	765193629	LFMYBNFFYDMMEO-UHFFFAOYSA-N	436.465	1.275	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)CCc2c(C)nc3ncnn3c2C)n[nH]1	765595651	OQQCMZBJIYRBCL-UHFFFAOYSA-N	434.460	1.534	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](CC(F)F)C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	765622734	CSGMSJCALZXIPZ-GFCCVEGCSA-N	435.449	1.400	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)/C=C\c3ccsc3)CC2)cc1	765728590	MAKRMAIGSCGGCR-DAXSKMNVSA-N	448.570	1.224	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)NCC(=O)NNc2ncnc3ccsc23)cc1	766679376	ZJMOJASRNLUSQM-UHFFFAOYSA-N	435.487	1.290	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)c2cc(NS(C)(=O)=O)ccc2O)n[nH]1	768281288	IDZQWKVBMCOASQ-UHFFFAOYSA-N	445.457	1.237	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)N[C@H]2CCOC3(CCOCC3)C2)nc1	769203598	DBJDXLIXBNNENL-AWEZNQCLSA-N	427.527	1.123	50	20	IDGD	
N#Cc1cnc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c(Cl)c1	769470613	MCMNRSYTLSVARH-UHFFFAOYSA-N	433.877	1.466	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)c(C(F)(F)F)o1	770209877	WGGIMEHWAKQKAS-UHFFFAOYSA-N	425.772	1.982	50	20	IDGD	
COc1cc2c(c(OC)c1OC)CCN(CC(=O)NNC(=O)c1cccc(C#N)c1)CC2	770254146	YUXWHASRVXQVPA-UHFFFAOYSA-N	438.484	1.446	50	20	IDGD	
COCCNC(=O)C1CCN(C(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)CC1	770659821	VRYNRTWREWWPTR-CYBMUJFWSA-N	426.901	1.323	50	20	IDGD	
CO[C@@H](c1ccc(F)cc1)[C@@H](C)NC(=O)NNC(=O)c1csc(N2CCOCC2)n1	770754937	YBAUPZXFXKLCDP-MLGOLLRUSA-N	437.497	1.839	50	20	IDGD	
C[C@H](NS(=O)(=O)c1cccc(C(F)(F)F)c1)C(=O)NNC(=O)c1ccccc1O	770951194	PQNSJZWUJJNIHG-JTQLQIEISA-N	431.392	1.539	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1ccc(Cl)c(S(=O)(=O)N2CCCCC2)c1	771880580	HSTBZVMZZRQLNJ-LBPRGKRZSA-N	445.925	1.617	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)C[C@H](NC(C)=O)c1ccc(Br)cc1	771900545	DYHZQUKUMPSXAD-HZMBPMFUSA-N	428.283	1.506	50	20	IDGD	
Cn1cc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c(-c2ccccc2)n1	772166413	UVMKBGLGFRUZQV-SFHVURJKSA-N	436.424	1.231	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1ccc(OC(F)F)cn1	772548843	XVYYEKQPVCORTD-UHFFFAOYSA-N	429.763	1.963	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)N[C@@H]1[C@@H]2CCc3ccccc3[C@@H]21	772631885	SWOMQLRZLZYQCZ-IXDOHACOSA-N	427.530	1.961	50	20	IDGD	
C[C@@H]1CN(C(=O)c2ccc(NC(=O)C(=O)NNc3ccccc3[N+](=O)[O-])cc2)C[C@@H](C)O1	773654495	XISIPSRJRGVTLM-ZIAGYGMSSA-N	441.444	1.926	50	20	IDGD	
N#Cc1cccc(NNC(=O)C(=O)Nc2ccc(C(=O)N3CCOCC3)c(Cl)c2)c1	773681017	KNSAEZDTONEEJI-UHFFFAOYSA-N	427.848	1.766	50	20	IDGD	
COc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)C(=O)NNc1cccc(Cl)c1	773736144	HNXDNHRJBBARJZ-UHFFFAOYSA-N	426.882	1.681	50	20	IDGD	
CCOc1cc(N2CCN(C)CC2)ccc1NC(=O)C(=O)NNc1nccnc1C(C)C	773991334	AHQQZANWBRYQLE-UHFFFAOYSA-N	441.536	1.832	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccccc1C(=O)N(C)C	774007381	HODMEFNMCZDINN-GFCCVEGCSA-N	432.864	1.595	50	20	IDGD	
O=C(NNS(=O)(=O)C1=Cc2ccccc2OCC1)C1CCN(c2ncccn2)CC1	775279504	ZJLLFRWGPYHZFW-UHFFFAOYSA-N	429.502	1.467	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1cnc2sc(C)c(C)n2c1=O	775643200	NVLSMMMNOICCCT-UHFFFAOYSA-N	448.530	1.049	50	20	IDGD	
O=C([C@@H]1CCCN(CC(F)(F)F)C1)N1CCN(S(=O)(=O)CBr)CC1	777776961	ASMUCUOWBVIGBT-LLVKDONJSA-N	436.294	1.087	50	20	IDGD	
O=C(NNc1ccccc1OC(F)(F)F)c1ccc2c(c1)S(=O)(=O)N=C1N=CNN12	779216143	AGEWHWLEWKDHRM-UHFFFAOYSA-N	440.363	1.753	50	20	IDGD	
Cc1onc(CC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)c1C#N	779491460	PJQNMBGAJKVTTG-UHFFFAOYSA-N	431.474	1.033	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)[C@H]1CCCOC1	780859835	LDRVCKHQODLRTE-WBVHZDCISA-N	438.550	1.620	50	20	IDGD	
Cc1ccc(F)cc1C(=O)C(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	782015126	RFQDIRGUNQWVOG-UHFFFAOYSA-N	446.910	1.935	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2cnn([C@H](C)C3CC3)c2)nc1	783258596	KWRMYMYYJNPXFT-GFCCVEGCSA-N	435.510	1.018	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2ccc3nc(-c4ccc(F)cc4)oc3c2)CCS(=O)(=O)C1	783425494	IABQWBDBCQOPGE-HXUWFJFHSA-N	446.460	1.770	50	20	IDGD	
CCn1c2ccccc2c2cc(NC(=O)C(=O)NN[C@@]3(C)CCS(=O)(=O)C3)ccc21	783426955	KUTPIIPZEPYFDJ-NRFANRHFSA-N	428.514	1.951	50	20	IDGD	
N#C/C(=C\c1cn(Cc2cccnc2)nn1)C(=O)Nc1cc2c(cc1[N+](=O)[O-])OCCO2	783700658	ULNQQZGVARQXHW-MKMNVTDBSA-N	433.384	1.946	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NN=Cc2cn(Cc3cccnc3)nn2)CC1	783845174	HHPCVRDTKXORDF-UHFFFAOYSA-N	428.497	1.754	50	20	IDGD	
CC[C@@H](C)Sc1ccc(NC(=O)C(=O)NNC(=O)CNC(=O)c2ccco2)c(C)c1	784003820	BSRKJNYIMCPDBX-CYBMUJFWSA-N	432.502	1.995	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2CO[C@@H](C)C2)c1	784147039	WSRQOAAMUIRUHX-ZFWWWQNUSA-N	433.486	1.682	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)C(=O)Nc2ccc(N3CCOCC3)c3ccncc23)c1	784855302	WXVPGAPHNKVVDE-UHFFFAOYSA-N	449.467	1.940	50	20	IDGD	
CC[C@H](O[C@@H]1CCC[C@H](C)C1)C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	786352672	SAWJXDYYIABDDN-RCJHGTSTSA-N	434.489	1.891	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Nc2ccn(C3CCN(C)CC3)n2)cc(OC)c1OC	786697636	CJXAPTQKQIBQLM-UHFFFAOYSA-N	432.481	1.642	50	20	IDGD	
O=C(NCCOCC(F)F)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	788317571	CJXVQXIFNAMSBZ-UHFFFAOYSA-N	445.430	1.614	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(Cl)c(S(C)(=O)=O)c2)cc1	788330913	NDYLAWVPRXAGKS-UHFFFAOYSA-N	439.877	1.217	50	20	IDGD	
CCC(=NNC(=O)C[C@H]1c2cc(OC)c(OC)cc2CCN1S(C)(=O)=O)c1cn[nH]c1	788977466	OBRKDZWRKHGZOK-KRWDZBQOSA-N	449.533	1.606	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(-c2ccco2)nn1C(C)C	789731604	GHTIKVDRKHGSBJ-UHFFFAOYSA-N	441.444	1.898	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)[C@@H]3CC(=O)c4ccccc43)cc2)CC1	789818017	AROSBACOHGIXKH-LJQANCHMSA-N	428.514	1.436	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNc3cccc(F)c3[N+](=O)[O-])cn2)C[C@H](C)O1	790998650	QMKCUWBLJGSRKU-RYUDHWBXSA-N	432.412	1.824	50	20	IDGD	
C[C@@](O)(Cn1cc(C(F)(F)F)ccc1=O)C(=O)NNC(=O)c1cc(-c2ccccc2)[nH]n1	792014252	HXFWQPFDAAWCJA-LJQANCHMSA-N	449.389	1.469	50	20	IDGD	
Cc1cc2n[nH]cc2cc1NC(=O)C(=O)NNC(=O)COc1ccc(Br)cc1	792269332	XGMUXSCEBQCGRS-UHFFFAOYSA-N	446.261	1.799	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2ccc(OC)c(OC)c2)cc(-n2cccn2)c1	792351103	OZLHHXFPPKPVKR-UHFFFAOYSA-N	439.428	1.298	50	20	IDGD	
Cc1c(Cl)cc(S(=O)(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1C(=O)O	794865102	HWIQLLNHGYLCFH-UHFFFAOYSA-N	426.834	1.741	50	20	IDGD	
Cc1cc(S(C)(=O)=O)cc(C(=O)NNc2ccccc2S(=O)(=O)N(C)C)c1C	795161914	SHPBGQKGSRIIQI-UHFFFAOYSA-N	425.532	1.714	50	20	IDGD	
O=C(NNC(=O)c1ccncc1)Nc1ccc(NS(=O)(=O)Cc2ccccc2)cn1	797653690	HTOOJTDDTUIJNB-UHFFFAOYSA-N	426.458	1.885	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2CCCN(C(=O)NC3CCCC3)C2)cc1C	798309839	PDBUCYCGSGEDEY-INIZCTEOSA-N	429.521	1.754	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C1=NO[C@@H](CNC(=O)OC(C)(C)C)C1	798992531	JLGIWLVBGLTETB-LLVKDONJSA-N	442.494	1.211	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)Nc2ccc(O[C@@H]3CCN(C)C3=O)cc2C)c1O	799238623	CWYPNYLCOFWRQI-QGZVFWFLSA-N	428.445	1.785	50	20	IDGD	
CCCC[C@H](C)C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	799857821	YHNWUIYHMCJVKH-INIZCTEOSA-N	425.551	1.614	50	20	IDGD	
O=C(Cn1[nH]cc2c(=O)ncnc1-2)NNC(=O)Nc1c(Cl)cc(Cl)cc1Cl	802070670	DCOZMNHUXNUYIY-UHFFFAOYSA-N	430.639	1.884	50	20	IDGD	
Cc1nnnn1/C(=C\c1ccc(F)cc1)C(=O)NNC(=O)Nc1ccc2c(c1)OCO2	802095354	AFPOBTBVXLGHQR-NVNXTCNLSA-N	425.380	1.700	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)C(=O)Nc2nc(Cc3ccccc3)cs2)c1	806980230	LTPYEVUSNMMPEH-UHFFFAOYSA-N	438.469	1.487	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNS(=O)(=O)c2nc(C)n(C)c2Br)cc1C	808070260	LSENUKJEDHVCHV-UHFFFAOYSA-N	444.311	1.056	50	20	IDGD	
COC(=O)C[C@H](C)CC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	809556785	KWWOCKXBVWMNPS-OAHLLOKOSA-N	447.513	1.515	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(Cl)c(Cl)c1)NNc1nc(-c2cccnc2)no1	810338868	AFWDUYIKFCTLCW-UHFFFAOYSA-N	443.272	1.860	50	20	IDGD	
CC(=O)c1cccc(S(=O)(=O)NCC(=O)NNC(=O)c2cccc3ccccc23)c1	810433881	QDTUFPZPQQZQPG-UHFFFAOYSA-N	425.466	1.782	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)CNS(=O)(=O)c3ccccc3F)n[nH]2)cc1C	810584172	AHAIACDDXSAPCK-UHFFFAOYSA-N	445.476	1.572	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(=NNC(=O)[C@@H]2CCS(=O)(=O)C2)[C@H]([C@H]2CCOC2)C1	812224141	BTXIPAWXMBOPDE-ZNMIVQPWSA-N	429.539	1.187	50	20	IDGD	
CCOC(=O)Nc1scnc1C(=O)NNC(=O)c1nn(CC)c(=O)c2ccccc12	813365530	KNWHVQNFGHVYLS-UHFFFAOYSA-N	430.446	1.516	50	20	IDGD	
CS(=O)(=O)C[C@@H]1CCN(C(=O)NNC(=O)c2ccc(Br)cc2Cl)C1	814296422	XHVVBZBNIWLJHL-SECBINFHSA-N	438.731	1.823	50	20	IDGD	
O=S(=O)(CBr)N1CCN(S(=O)(=O)CC23CCC(CC2)CC3)CC1	814389461	JBICYUNFRSCNJD-UHFFFAOYSA-N	429.402	1.586	50	20	IDGD	
CC(C)(C)OC(=O)NC1CC(=NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)C1	814878967	NZAYPXSLUORSCS-UHFFFAOYSA-N	429.521	1.604	50	20	IDGD	
CC(C)[C@@H](NS(=O)(=O)C1CC1)C(=O)NNC(=O)COc1ccccc1-c1ccccc1	816805680	DZYAOZCOLODTTB-OAQYLSRUSA-N	445.541	1.986	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)c2c(Br)nnn2C)c1	818763949	SWWQEYNUZRRJDH-UHFFFAOYSA-N	433.060	1.884	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)[C@H]2CC(=O)N(c3ccc(C)c(F)c3)C2)n1	844514259	VLGZZEDPEUCJEC-ZDUSSCGKSA-N	448.476	1.185	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)CCNS(=O)(=O)/C=C\c1ccccc1	912861312	OQQURLHNSRYNPV-IKESIWSLSA-N	435.477	1.721	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)CNS(=O)(=O)c2ccc(C)cc2)cc1OC	913069444	DKDPBQRVIOQTQM-UHFFFAOYSA-N	449.529	1.922	50	20	IDGD	
O=C(NNC(=O)c1nc(NCc2ccco2)ncc1Cl)c1ccc(-n2cnnn2)cc1	916144516	BPRSJMIRFRDJIK-UHFFFAOYSA-N	439.823	1.386	50	20	IDGD	
O=C(COc1ccccc1-c1ccccc1)NNC(=O)NCCNC(=O)c1cccnc1	916443638	QTJHFIHCZVGIAA-UHFFFAOYSA-N	433.468	1.888	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)CNC(=O)c1ccc(Br)s1	916734383	DWBBBXDNLPSMSO-VIFPVBQESA-N	444.282	1.994	50	20	IDGD	
COCCOc1cccc(C=NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c1	917532046	FGTLAHJRCHLRRH-UHFFFAOYSA-N	447.513	1.497	50	20	IDGD	
Cc1ccc(NC(=O)C2CCN(C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)CC2)nc1	918002093	PLCSJTCTMKAOLM-UHFFFAOYSA-N	449.475	1.071	50	20	IDGD	
NS(=O)(=O)c1ccc(OCCSCC(=O)NNC(=O)NC2CCCCC2)cc1	918552605	ZLGXTLRVERVOBC-UHFFFAOYSA-N	430.552	1.109	50	20	IDGD	
C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)NNC(=O)c2csc(N3CCOCC3)n2)C1	919786008	OKYXGMMIVYFVAT-RDJZCZTQSA-N	444.561	1.759	50	20	IDGD	
COCCn1cc(NC(=O)NNC(=O)c2cc(-c3ccccc3OC)[nH]n2)ccc1=O	1116586036	QQPNPXGDGIIUGB-UHFFFAOYSA-N	426.433	1.360	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)Nc2ccc3c(c2)NC(=O)CO3)CC1	1325339666	SJLVOIVEZWGQBJ-UHFFFAOYSA-N	433.465	1.817	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(N2C[C@H](C(=O)O)CC2=O)cc1)c1ccccc1Cl	1337309748	KDCWOOLFQWPEIN-LLVKDONJSA-N	437.861	1.401	50	20	IDGD	
COCCOc1ccc(NC(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)cn1	1342365376	FTURKNDTCVYDMI-UHFFFAOYSA-N	437.497	1.907	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)c3nn[nH]c3C(F)(F)F)C2)C1	1780364326	KOUUWPGIZNTFOV-KGLIPLIRSA-N	444.241	1.503	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(F)(F)C(F)(F)C(=O)O)C2	1780699789	HWYURPVIMBACIR-UEKVPHQBSA-N	446.825	1.873	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(Cl)ncn1)C2)[C@H](F)Br	1780773801	NDCFOLHDXMDXHP-PVXIVEMSSA-N	449.708	1.948	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ncccn1)C2	1781899706	DDINXQGSLRHBDA-PMUMKWKESA-N	425.327	1.778	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCn1nc(C)cc1C)C2	1782177878	FJSKRQMQOGOSQG-WAOWUJCRSA-N	440.972	1.658	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4nn[nH]c4c3)C2)C1	1782583316	FICDCNGHQRVEMT-SCLBCKFNSA-N	436.310	1.575	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](C)n1cc(C)cn1)CCO2	1783354523	SKYAIPYZUXDTPP-RVKKMQEKSA-N	427.343	1.756	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3c(O)cc(O)cc3O)CCO2)C1	1783535742	BTZXSFQRPGOVGZ-DYZYQPBXSA-N	429.267	1.030	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)Cc1ccccc1)CCO2	1783539591	MDPUUSXFZWCGAY-QOKNQOGYSA-N	425.323	1.203	50	20	IDGD	
C=C1C[C@@H](C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](F)Cl)CCO3)N(C(=O)OC(C)(C)C)C1	1784089344	BNZIBRDCMVLUOC-AUSJPIAWSA-N	445.919	1.916	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](C)Oc3ccccn3)C2)C1	1784480595	LJHIQIYNKOPEDS-VCBZYWHSSA-N	440.338	1.710	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CO[Si](C)(C)C)C[C@@H]32)n1	1785532684	DPGDSBQZDJPVPZ-BQFCYCMXSA-N	448.596	1.485	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)c1noc2c1CCCC2	1787308106	KUSIGNCJVNOUQR-YLUJIRGKSA-N	444.301	1.837	50	20	IDGD	
Cc1cc(C(=O)NC2(c3ccc(NC(=O)c4ccc(B(O)O)cc4)cc3)CCC2)n(C)n1	1788140439	XVRVGHUFOAVZEI-UHFFFAOYSA-N	432.289	1.470	50	20	IDGD	
CCCNC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]2C1	1789868451	XKUJMJRCRSXJDK-XMDUPGNXSA-N	436.380	1.509	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)[C@H](F)Br	1789923249	AMVVTIALMANOHC-WYCDGMCDSA-N	434.075	1.347	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4cccnc4nc3O)C[C@@H]21	1791256817	IPEQHSXMHMMVQZ-LLLHUVSDSA-N	448.907	1.183	50	20	IDGD	
CCOc1ncccc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2	1792379238	AGKOMBRCAXMYJU-YWVIFJGQSA-N	426.311	1.469	50	20	IDGD	
O=C([C@@H](F)Br)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1(c2ccc(O)cc2)CC1	1793028262	WTTNUMXRRZFQSL-NOXHYTERSA-N	441.297	1.704	50	20	IDGD	
COC(=O)N(CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCl)Cc1ccccc1	1793116714	RLSGGBYSKLTWPZ-XMTFNYHQSA-N	437.924	1.493	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cccc(F)c1	1795233093	UZGRQUNYAMTQIH-LJGDNWOOSA-N	427.314	1.989	50	20	IDGD	
COc1ccc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Cl)cc1OC	1796364899	OKRRRHMYJMCKTB-FTUNRGFVSA-N	428.888	1.760	50	20	IDGD	
C=CC[C@H](CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Cl)NC(=O)OC(C)(C)C	1796369759	CSFUFNOCKSBFLK-QZCUMHFISA-N	447.935	1.970	50	20	IDGD	
CC1(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Cl)CN(C(=O)OC(C)(C)C)C1	1796370317	GLXKTYZOSKXIQE-XRGAULLZSA-N	447.935	1.758	50	20	IDGD	
CC(C)c1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCC(=O)NN(C)C)C3)cc1	1798961639	WWSGTOLBSUGQSL-HATOLVCRSA-N	430.549	1.386	50	20	IDGD	
CC(C)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CC[C@@H]2CCC(=O)N2C1	1799144789	SIADJNVYHWUOKF-XLKGFZLASA-N	425.957	1.242	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)NC(=O)c1ccc(F)cc1)C2	1799268929	OFKTVCNTKIYNLT-UIVXMWCNSA-N	439.915	1.551	50	20	IDGD	
CC(C)N1CCC(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@](C)(Cl)CCl)CC1	1799273985	OBCJTZYXCZHMKV-CLWJZODNSA-N	434.408	1.933	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@](C)(Cl)CCl	1799279449	OQGYOQZLNAWALG-KCRLFOLJSA-N	425.309	1.374	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cn3ccccc3n1)C2)[C@H](F)Br	1799347783	SFALOFRKVSGVAF-JLUCKKNBSA-N	425.258	1.228	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3nccnc3c1)C2)[C@@H](F)Br	1799347921	XLLFIZLWYIVWGZ-NOXHYTERSA-N	437.269	1.524	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2)c1ccc(N2CCCOC2=O)cc1	1799815913	CFUFRZRATCMHTK-FSDCSDTHSA-N	439.871	1.771	50	20	IDGD	
Cc1ccn2c(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@@H](C)CBr)C4)cnc2c1	1800080606	OFRAQKPKRBBQAA-AFIMGQEJSA-N	449.349	1.877	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1[C@H]3Sc4ccccc4[C@H]31)C2	1800976970	MWEQKLDFZDUCGW-JLNKEJEHSA-N	436.961	1.718	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)Br)C3)c1	1801787397	MROYRRMNAUATHY-RMIITELYSA-N	438.322	1.632	50	20	IDGD	
COC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C(Cl)Cl	1802340843	NAIPDMYIMKBNTR-RNJOBUHISA-N	438.352	1.968	50	20	IDGD	
COc1nc(C)ccc1C(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]1c1cccnc1	1803141990	VXAWXSZKPPZXTG-KBAYOESNSA-N	432.908	1.713	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]1c1cccnc1	1803146948	FHJJHXZAQIHHFX-INMHGKMJSA-N	440.928	1.212	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)c2ccno2)[C@H]1c1cccnc1	1805626484	YSSVZBBPWPGHJI-RUVVGEKZSA-N	449.471	1.523	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)[C@@H]2CC=CCC2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807359061	DJPRWNIGCOMOBW-UZKOGDIHSA-N	433.317	1.437	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC2(CCCN(C(=O)CCc3cccnc3)C2)CC1	1810185701	IURPDJXRHLRQLY-UHFFFAOYSA-N	429.565	1.618	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)c1ccc2ccnn2c1	1812201015	COIDHZDSYBLLIA-IPELMVKDSA-N	427.892	1.649	50	20	IDGD	
NC(=O)c1ncccc1C(=O)N1CC[C@H](CNC(=O)C(Cl)Cl)[C@@H]1c1cccnc1	1813078652	VGBODKDKHNMUTL-DOMZBBRYSA-N	436.299	1.699	50	20	IDGD	
C[C@H](C(=O)N1CC[C@@H](CNC(=O)C(Cl)Cl)[C@@H]1c1cccnc1)N1CCN(C)CC1	1813078797	KWRHHSJGFVUHKI-PVAVHDDUSA-N	442.391	1.527	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H](CNC(=O)CCS(C)(=O)=O)[C@H]1c1cccnc1	1813574487	WATYLHXFBBPQGC-NVXWUHKLSA-N	429.970	1.787	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)CN3CCCC3=O)sc2C1	1814600577	GHFDTWSKKARUAU-GHMZBOCLSA-N	443.367	1.851	50	20	IDGD	
Cc1cccnc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1815397142	GPJNGCRZCILQHM-KRWDZBQOSA-N	448.487	1.731	50	20	IDGD	
C[C@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)c3nc[nH]c3[N+](=O)[O-])sc2C1	1817205389	LTXVTMDDMDAETL-BQBZGAKWSA-N	443.283	1.784	50	20	IDGD	
COc1ccnc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)c1	1817472697	ZYNGGZICEDNMTI-IBGZPJMESA-N	449.276	1.113	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1)c1cccn2c(O)nnc12	1817964399	ANMZOPLKAOJKBY-QWHCGFSZSA-N	433.856	1.064	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](O)CCl)CC2)c1cnnc2ccccc12	1818179020	FYUXNKYIUFZZNB-BONVTDFDSA-N	431.905	1.912	50	20	IDGD	
Cc1cc2nnc(C(=O)Nc3nc4c(s3)C[C@H](NC(=O)[C@@H](F)Cl)CC4)c(C)n2n1	1818248998	YCUVRSYQRRITBN-YMTOWFKASA-N	437.888	1.958	50	20	IDGD	
CCCC(=O)N[C@@H](C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1	1819565508	MTUQIXFXRRIOAD-GOEBONIOSA-N	449.556	1.080	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1ncccc1F	1819972741	UKAFDJUIBGMGEN-KRWDZBQOSA-N	437.240	1.243	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)CN2CCSCC2)CC1	1823725036	XVWONAYJCZMGFK-ZWKOTPCHSA-N	432.030	1.909	50	20	IDGD	
O=C1COc2ccc(C(=O)N3CCC([C@@H]4CCCCN4C(=O)[C@@H](O)CCl)CC3)cc2N1	1824184870	AGOILMNNGVRZPQ-ROUUACIJSA-N	449.935	1.851	50	20	IDGD	
CC[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(O)n(C)n1)CC2	1825445383	UYOMJGDUFZYUKW-DTWKUNHWSA-N	442.339	1.982	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCc1cnn(C)c1)CC2	1825999930	YBNXDKXDTODGOD-STQMWFEESA-N	425.942	1.675	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)CCn3ccnn3)sc2C1	1826879862	VZNUEGMSJXFENM-WDEREUQCSA-N	441.355	1.910	50	20	IDGD	
C[C@@]1(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)CC1(F)F	1827055317	UOAIIYGVOFBSIY-RXVVDRJESA-N	434.292	1.645	50	20	IDGD	
Cc1n[nH]c(C)c1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827058245	VIUYRUFRUKTQKQ-HXUWFJFHSA-N	438.337	1.253	50	20	IDGD	
CC[C@H](NC)C(=O)N1CCC([C@H]2CCCCN2C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)CC1	1827680504	MCMSRMKZHQTSTE-NONYBHDDSA-N	444.580	1.738	50	20	IDGD	
C=C[C@@H](O)C(C)(C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1	1828882952	TTYWFHHAUXATKS-NHCUHLMSSA-N	442.365	1.173	50	20	IDGD	
CC(C)O[C@@H](C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1	1829020691	WGHNBMCKPHZGEE-UWJYYQICSA-N	430.354	1.413	50	20	IDGD	
N#Cc1cccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)c1	1829952103	DEPOBCHTIYNXET-QHCPKHFHSA-N	445.328	1.785	50	20	IDGD	
O=C(CCn1ccnn1)N1CCC([C@@H]2CCCCN2C(=O)[C@H](F)Br)CC1	1830381314	ISNWTKBYONASKH-HOCLYGCPSA-N	430.322	1.978	50	20	IDGD	
O=C(Cc1cc(F)ccc1Cl)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1830726580	QXMNIAJGPRPGDL-LPHOPBHVSA-N	449.306	1.078	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)Cc2ccncc2)CC1	1831874427	PFAWUPRGZYWLTH-FQEVSTJZSA-N	429.565	1.617	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H]3CCc4ccccc4O3)CC2)CC1)[C@H](O)CCl	1833312961	NMQZQOIRPKIHBP-TZIWHRDSSA-N	449.979	1.552	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)CSCC(=O)O)CC2)CC1	1833535033	OSONMDFMRCOCBL-INIZCTEOSA-N	434.002	1.783	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1)c1cccc(O)n1	1834200293	WFMGZUXATJXJBD-MRXNPFEDSA-N	443.317	1.663	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3ccccc3)CCO2)C1	1834842100	QYJVMWLLAAPSCU-JXFKEZNVSA-N	439.350	1.859	50	20	IDGD	
N[C@@H](Cc1cscn1)C(=O)NC1CCN(C2CCN(C(=O)[C@H](F)Cl)CC2)CC1	1835049252	PUCMWOUNNZOFEM-HOTGVXAUSA-N	431.965	1.119	50	20	IDGD	
O=C(COc1cccnc1)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836715718	XDKDESQBJWIESD-SFHVURJKSA-N	425.913	1.059	50	20	IDGD	
O=C(Cn1cccn1)N1CCC(OC2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1837973948	JQXXMMQXFWMWDI-MRXNPFEDSA-N	431.306	1.572	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)[C@@H]3CNC(=O)C3)CC2)CC1	1838754005	FJOGCGDCHLZQJP-XJKSGUPXSA-N	444.370	1.295	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(F)c3[N+](=O)[O-])C2)C1	1839147597	WXDTUTKXGDYFQP-LIRRHRJNSA-N	443.859	1.821	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3cnccn3)C2)C1	1839155150	KTLNDKZCUFRTIN-OALUTQOASA-N	445.347	1.102	50	20	IDGD	
O=Cc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)s1	1839199502	OZLWYDYPCUFAPT-CZUORRHYSA-N	449.298	1.321	50	20	IDGD	
CCC(=O)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)CCO2	1839744205	UQPCLLYBYLXEMC-NAVGAYGYSA-N	447.438	1.307	50	20	IDGD	
C[C@H](Cc1ccc(F)cc1)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1	1839762965	LSDIRNAIDBZTCV-FPDPHYFHSA-N	442.915	1.060	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3[nH]ccc3C)C2)C1	1839962325	ATSXYVIBLAGPIG-KBXCAEBGSA-N	428.327	1.567	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(Cl)o3)C2)C1	1840032969	OYPMNLKZHXTDID-MEDUHNTESA-N	435.702	1.786	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc4cccnc34)C2)C1	1840152736	RJPIXWGEANIDHS-XMSQKQJNSA-N	447.919	1.559	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4sccc4[nH]3)C2)C1	1840153193	HCBOIOVLASRWLM-BFUOFWGJSA-N	441.937	1.553	50	20	IDGD	
COc1cc(F)ccc1CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840190156	HSLYDKNLZVPKDD-LJQANCHMSA-N	449.306	1.637	50	20	IDGD	
COc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)ccc1F	1840190825	PMDRNOIPMBQWHZ-GOSISDBHSA-N	435.279	1.708	50	20	IDGD	
Cc1nccn1CCCC(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1840386016	CZPIOXHFKJGDCX-OAQYLSRUSA-N	440.972	1.693	50	20	IDGD	
CCOC(=O)N(CC(=O)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1)Cc1ccco1	1841354194	MHXIJFGCRWZGHL-HNNXBMFYSA-N	427.885	1.041	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)[C@H]2C[C@H]2c2ccc(F)c(F)c2)C1	1841397683	UZEMRVWNQRPYLZ-ROUUACIJSA-N	440.255	1.265	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2cnn(C(C)(C)C)c2)C1	1842205824	VHMUKTVEKOAQJL-MFKUBSTISA-N	439.520	1.589	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)c2nc(-c3ccccc3)ns2)C1	1843119464	VGISCOUNUSPSFJ-UHFFFAOYSA-N	448.313	1.016	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)c2cnc(Cl)c(Cl)c2)C1	1844449748	LYBWDXNFZVUORL-UHFFFAOYSA-N	428.320	1.578	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1O)C2	1845164929	LKASHXPSZLJUTO-JYJNAYRXSA-N	443.972	1.825	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC12CN(C(=O)c1cccc(N3CCOCC3)n1)C2	1846176918	MGXBQSGKURAFQA-CQSZACIVSA-N	437.338	1.519	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC[C@H]2[C@@H]1CCN2C(=O)C1(c2ccccc2)CCCC1	1847426363	ZFENRYOYEIPXCH-VXKWHMMOSA-N	432.329	1.694	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)no1	1848095824	SAMPKRPZMZLPDG-KKUMJFAQSA-N	426.901	1.931	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)c2ccc3c(c2)CCCN3S(C)(=O)=O)cc1OC	14936139	XXIFNVQSZVJPTF-UHFFFAOYSA-N	447.513	1.881	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)/C=C/c1ccccc1)C(=O)NNC(=O)c1ccccn1	17328502	FTOYVCYDBOGREO-GWKQRERASA-N	434.543	1.555	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)c3ccccn3)CC2)cc1	17328815	BAWIEHAXOLSJMT-UHFFFAOYSA-N	430.486	1.146	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)Cc1cccs1	21786278	GIPRSIYIYOVKFE-UHFFFAOYSA-N	437.543	1.092	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN(C)CC(=O)Nc2c(C)cc(C)cc2C)cc1OC	28967756	XWIJQIWEVYTZFW-UHFFFAOYSA-N	442.516	1.961	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C[C@@](O)(c1nccn1C)C(F)(F)F	105568609	QHJYPVNPCIZOLL-QGZVFWFLSA-N	430.383	1.185	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2ccc(C)c(S(C)(=O)=O)c2)c2ccccc2c1=O	117273987	QJOSCYXXYGKMFX-UHFFFAOYSA-N	428.470	1.203	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)NCc1ccccc1N1CCN(C(C)=O)CC1	726272360	JPFVHEWQGXUCCS-UHFFFAOYSA-N	439.516	1.437	50	20	IDGD	
CC1=NN(c2ccc(C(=O)OCC(=O)NNC(=O)[C@@H]3COc4ccccc4O3)cc2)CC1	728328952	ZUCUMTORFJVSQU-IBGZPJMESA-N	438.440	1.417	50	20	IDGD	
O=C(COC(=O)c1csc(-c2cnccn2)n1)NNC(=O)c1ccc([N+](=O)[O-])cc1	728383044	BRXVOXBICXDZOB-UHFFFAOYSA-N	428.386	1.126	50	20	IDGD	
O=C(NC[C@H]1CCN(CCc2ccccc2)C1)NNC(=O)c1nnc(O)c2ccccc12	728754842	RNTMUTBMTVZQOK-QGZVFWFLSA-N	434.500	1.844	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1cnn(-c2ccccc2Cl)c1	728846541	ZFIKILGNNSAWIN-UHFFFAOYSA-N	425.880	1.993	50	20	IDGD	
Cc1nc(CN2CCN(C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)CC2)cs1	728959573	NRVPXLLEKLBAPQ-UHFFFAOYSA-N	444.565	1.017	50	20	IDGD	
O=C(NCc1cccc(C(=O)NC2CC2)c1)NNC(=O)C1CCN(c2ncccn2)CC1	729049288	JCOBJTOTRRKSFD-UHFFFAOYSA-N	437.504	1.116	50	20	IDGD	
C=CCNS(=O)(=O)c1cc(C(=O)NNC(=O)Cn2ccc3ccccc32)ccc1F	729450641	IFOORKLSXUTHQF-UHFFFAOYSA-N	430.461	1.706	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCN(c2ccc3c(c2)OCCO3)C1=O)c1ccc([N+](=O)[O-])cc1	730512785	XDKLPEQGKJZBQP-HNNXBMFYSA-N	426.385	1.180	50	20	IDGD	
CON(C)S(=O)(=O)c1cc(C(=O)NNc2nc(-c3ccncc3)no2)ccc1Cl	732065519	MCBAYPNHQCERCF-UHFFFAOYSA-N	438.853	1.724	50	20	IDGD	
C[C@H](C(=O)NNC(=O)Cc1nc2ccccc2n1C)N1CCN(c2ccc(F)cc2)CC1	732260424	SWHGONHVKYWICT-MRXNPFEDSA-N	438.507	1.613	50	20	IDGD	
CCCOc1cn(-c2ccccc2)nc1C(=O)NNC(=O)CCN1C[C@H](C)O[C@@H](C)C1	732263128	KHDWMXPDMSKRFJ-IRXDYDNUSA-N	429.521	1.921	50	20	IDGD	
Cc1nc(-c2c(C)c(C)nn(C)c2=O)sc1C(=O)NNc1ccccc1S(C)(=O)=O	732304783	UHVDVTTZZSWGRG-UHFFFAOYSA-N	447.542	1.989	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCC[C@@H]1C(=O)N1CCCC1)C1CCN(c2ncccn2)CC1	732761936	QMOLWYXRDQCJLU-MSOLQXFVSA-N	428.537	1.269	50	20	IDGD	
O=C(NCC1CCN(S(=O)(=O)C(F)F)CC1)NNC(=O)c1ccc2ccccc2n1	733041762	HGDZPHZSIYKBMU-UHFFFAOYSA-N	441.460	1.443	50	20	IDGD	
Cc1nc(-c2ccccn2)nc(NNC(=O)CN(C)S(=O)(=O)c2ccccc2)c1C	734256656	INFOEOBGEOJNJF-UHFFFAOYSA-N	426.502	1.919	50	20	IDGD	
C[C@H]1CCC[C@H](OCC(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)C1	735118225	NLFIMCXRQCNUKS-HOTGVXAUSA-N	425.555	1.056	50	20	IDGD	
CCOCCCN1CCC(=NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)[C@H](C)C1	735228167	ROYGWIHRJDJHGG-GOSISDBHSA-N	438.594	1.856	50	20	IDGD	
CCCn1nc(C(=O)NNS(=O)(=O)c2cnc(Cl)c(C)c2)c2ccccc2c1=O	735265551	IWJDWNFJPLNVBC-UHFFFAOYSA-N	435.893	1.787	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)N[C@H]1CCN(c2cnn(C)c2)C1=O	735584526	WGFOFTBCHOEXFJ-LIRRHRJNSA-N	436.472	1.477	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)c2sc(S(N)(=O)=O)cc2C)cc1C	736801654	AKHCYEVIAJNIIM-UHFFFAOYSA-N	445.544	1.254	50	20	IDGD	
CC(C)(C)Cc1nc(-c2cccc(C(=O)NNC(=O)N[C@@H]3CCS(=O)(=O)C3)c2)no1	741671525	HHJZNXLIGCWMKF-CQSZACIVSA-N	435.506	1.456	50	20	IDGD	
O=C(C[C@@H](C(=O)NN=Cc1cccc(F)c1)N1CCOCC1)NN=Cc1cccc(F)c1	741766358	KLHUPPOLNUKIHH-FQEVSTJZSA-N	443.454	1.656	50	20	IDGD	
Cc1nn(C)c2sc(C(=O)N[C@H](C)C(=O)NNC(=O)COc3ccc(C#N)cc3)cc12	742033433	OGBSDYVJGLRZQR-GFCCVEGCSA-N	440.485	1.160	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@H]2SCCc3sccc32)cc1	742472817	UVRSQOAYBATRNV-KRWDZBQOSA-N	439.584	1.855	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)CNC(=O)c2cc3ccccc3[nH]2)c2ccccc2c1=O	742474876	ZMDSLSSTRZTPAV-UHFFFAOYSA-N	432.440	1.089	50	20	IDGD	
CCCCOCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	743356683	OZGYEJLXYNQKGO-UHFFFAOYSA-N	426.539	1.622	50	20	IDGD	
Cc1nc(O)c(C#N)c(C)c1CCC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	743829507	SEBLJZYNUDCRIX-UHFFFAOYSA-N	431.474	1.465	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)N[C@@H]2CCN(c3ccccc3F)C2=O)cc1	745817319	YEPUIPFUFNEIBI-OAHLLOKOSA-N	449.464	1.370	50	20	IDGD	
Cn1ccc(N2CCC[C@@H](NC(=O)NNC(=O)CSc3ccc(Cl)cc3)C2=O)n1	745883918	QTWISRVSEHDNMY-CQSZACIVSA-N	436.925	1.692	50	20	IDGD	
COc1ccc([C@]2(C)NC(=O)N(CC(=O)NNC(=O)c3ccc(Cl)cc3F)C2=O)cc1	747329034	DZVRXJXPLMPTCI-FQEVSTJZSA-N	448.838	1.716	50	20	IDGD	
COc1ccc(Cl)cc1NC(=O)CCNC(=O)NNC(=O)Cc1cn2ccccc2n1	747590300	CGJXMDIXHZWHSY-UHFFFAOYSA-N	444.879	1.898	50	20	IDGD	
COc1cc(CN2CCN(CC(=O)NNC(=O)c3ccc(F)cc3)CC2)cc(OC)c1	747843187	NKCPQLVFWCXTOV-UHFFFAOYSA-N	430.480	1.422	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)NC[C@]2(N(C)C)CCSC2)c1	748647125	JXBRNHGAKBXFED-MRXNPFEDSA-N	431.356	1.839	50	20	IDGD	
CC(C)OCCS(=O)(=O)NCC(=O)NNc1ccc(Br)cc1Cl	748849026	CUDUEKQTXXPAKY-UHFFFAOYSA-N	428.736	1.890	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2ccc(C(=O)c3cc[nH]c3)cc2)n1	748900422	XBARJQNCDXIBLS-UHFFFAOYSA-N	426.454	1.558	50	20	IDGD	
CNS(=O)(=O)c1csc(C(=O)OCC(=O)C(C#N)=C2N(C)c3ccccc3N2C)c1	748912276	GCDCMASNXNTISB-UHFFFAOYSA-N	446.510	1.703	50	20	IDGD	
Cc1ccccc1CC(=O)N1CCN(CC(=O)NNC(=O)c2cccc(Cl)c2)CC1	749907060	NWXMORXEWCYCFD-UHFFFAOYSA-N	428.920	1.796	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cccc(Cl)c2[N+](=O)[O-])cc1OC	750534714	CQDYWGUWCFRBIE-UHFFFAOYSA-N	437.792	1.883	50	20	IDGD	
CC(C)[C@H](NC(=O)C12CC3CC(CC(C3)C1)C2)C(=O)NNC(=O)CNC(=O)c1ccco1	751207512	YITRUOJHEZNVTA-HAVBXNNZSA-N	444.532	1.514	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)c1ccc(Br)c([N+](=O)[O-])c1	751211981	YZGUVLODCBMVOM-UHFFFAOYSA-N	427.236	1.610	50	20	IDGD	
C[C@H]1C[C@H](CNC(=O)OC(C)(C)C)CN1C(=O)NNC(=O)CNC(=O)c1cccs1	752153630	GBGNXIAUPZPPLN-QWHCGFSZSA-N	439.538	1.454	50	20	IDGD	
C[C@@H]1C[C@@H](CCNC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)CN1Cc1ccccc1	752996891	HVTKUWADHPRIIV-IEBWSBKVSA-N	448.531	1.907	50	20	IDGD	
Cc1cc(Cl)c(S(=O)(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1[N+](=O)[O-]	753065833	LAUPGLKYLIWEGB-UHFFFAOYSA-N	447.878	1.583	50	20	IDGD	
CCOC(=O)c1ccc(N2CC(NC(=O)NNC(=O)c3cccc(N(C)C)c3)C2)nc1	753280003	PQDDXUIPMYULRI-UHFFFAOYSA-N	426.477	1.157	50	20	IDGD	
CC(C)(C)SCCCC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	753887202	OEYAGAFTTAXLSB-UHFFFAOYSA-N	443.591	1.780	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1ccc(C(N)=O)cc1)C(=O)NNc1cc(C(F)(F)F)ccc1F	754148349	ILUCISFQFBVNNB-SECBINFHSA-N	448.398	1.754	50	20	IDGD	
NC(=O)c1ncn2c(C(=O)NNc3ccc(C(F)(F)F)nn3)cc(-c3ccco3)nc12	755198820	XQDSJAHZQBZXGG-UHFFFAOYSA-N	432.322	1.654	50	20	IDGD	
O=C(CSc1nnc(-c2cccnc2)n1Cc1ccco1)NNC(=O)Cc1cc[nH]n1	755280700	XURIBYHKRHDTNB-UHFFFAOYSA-N	438.473	1.187	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)Nc3cccnc3-n3cncn3)n[nH]2)cc1OC	756290899	FBNNBKCXWLXZPV-UHFFFAOYSA-N	449.431	1.536	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2cccc3c2ccn3C)cc1	756316976	SFNOAZIOIGUKJM-UHFFFAOYSA-N	429.502	1.960	50	20	IDGD	
CCc1ccc(S(=O)(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1CC	756930264	UAGFVLHFBLTKMH-UHFFFAOYSA-N	445.950	1.736	50	20	IDGD	
Cc1nn([C@@H]2CCS(=O)(=O)C2)c(C)c1NC(=O)NNC(=O)c1ccc2ccccc2n1	757872206	WJFFSTJEEXBEEO-OAHLLOKOSA-N	442.501	1.874	50	20	IDGD	
N#Cc1c(F)cccc1-n1ccc(NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)n1	757983803	AHKYRPUWRSIZLR-UHFFFAOYSA-N	432.379	1.325	50	20	IDGD	
CN(NC(=O)c1ccc(CNC(N)=O)cc1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758781718	GPCJHSAPEGQJKS-UHFFFAOYSA-N	434.497	1.104	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN(c2ncnc3sccc23)C1)C(=O)Nc1ccccn1	758838837	GQZPGYMMTDINIS-LBPRGKRZSA-N	425.474	1.089	50	20	IDGD	
Cc1nnc(-c2cccc(C(=O)OCC(=O)NNC(=O)[C@H]3COc4ccccc4O3)c2)o1	758978807	OFNNITCYGWOPBG-QGZVFWFLSA-N	438.396	1.189	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)CCC(=O)c1ccc2c(c1)OCCCO2	760443148	PZNZTMVPOHUYKE-UHFFFAOYSA-N	435.477	1.873	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCCC(=O)NNc1nc(-c2ccncc2)no1	760872441	WYJHNFGLSIEBOQ-AWEZNQCLSA-N	445.480	1.481	50	20	IDGD	
O=C(NNc1nccc(N2CCOCC2)n1)[C@@H]1CC(=O)N(c2cccc3ccccc23)C1	762854275	XOQXEZZXOGXCTE-QGZVFWFLSA-N	432.484	1.963	50	20	IDGD	
CN1C(=O)C[C@@H](C(=O)NNc2nccc(N3CCOCC3)n2)[C@H]1c1cccc(Cl)c1	762860690	HGJNRJDUQWFZBK-CRAIPNDOSA-N	430.896	1.629	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)c1	762938479	PRGKMJCNRKHSHB-UHFFFAOYSA-N	431.430	1.401	50	20	IDGD	
COC[C@H](C)NC(=O)/C(C#N)=C\c1ccc(OCCn2cc(C(=O)O)nn2)c(Cl)c1	763113455	ILCVASQMCYFDMA-OBTCNRAFSA-N	433.852	1.767	50	20	IDGD	
CC(=O)N1c2ccc(S(=O)(=O)NNC(=O)CSc3ccccc3O)cc2C[C@H]1C	763412688	NIDPEXCENBCBQK-GFCCVEGCSA-N	435.527	1.792	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ccccc2)c(Br)cc1F	763419766	GYTUQIVJOASJLO-UHFFFAOYSA-N	438.209	1.775	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(F)cc1Br	763441669	GAVZTHAGCOZQSU-UHFFFAOYSA-N	425.170	1.896	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(C)nn1[C@@H]1C[C@H]2CC[C@H]1C2	763656507	CEHQUOPYXCKLKV-HRCADAONSA-N	441.488	1.726	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cc(NC(C)=O)c(F)cc2F)cc1	763659437	NVSZMKNUBSFPCG-UHFFFAOYSA-N	436.371	1.097	50	20	IDGD	
Cc1ccccc1-n1nccc1NC(=O)C(=O)NNC(=O)CN1CCCc2ccccc21	763729155	VKRFZTJCHSZRDC-UHFFFAOYSA-N	432.484	1.719	50	20	IDGD	
Cn1ccnc1C(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cccc(Cl)c2)cc1	763752763	PALRLSUNSHUPSF-UHFFFAOYSA-N	425.832	1.704	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)C(=O)Nc2cnn(-c3cnc4ccccc4n3)c2)c1	763759600	ZSAJWYPNJDSAQD-UHFFFAOYSA-N	444.455	1.281	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(C)cc2C(=O)OC)cc1	763859661	DQQWQRJYQRNVEO-AWEZNQCLSA-N	443.456	1.734	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)C(=O)Nc2cccc(OCCN(C)C)c2)cc1	763892039	ULTVZOPEHNYMQO-UHFFFAOYSA-N	430.530	1.814	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(Cl)ccc2C(=O)OC)cc1OC	763904548	ZSSBDZWWQJKUNS-UHFFFAOYSA-N	449.847	1.934	50	20	IDGD	
CCOc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NNC(=O)Cc1ccc(F)cc1	763918789	MRCUHJDZGKUGIH-UHFFFAOYSA-N	430.436	1.255	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc(S(=O)(=O)N(C)C2CC2)cc1	763957431	DADWLBBOQGKUKH-UHFFFAOYSA-N	430.486	1.178	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1ccc(O[C@@H]2CCOC2)cc1	764003665	FYJFOAIERSWYJO-MRXNPFEDSA-N	427.413	1.025	50	20	IDGD	
COCCOc1ncccc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccc(C)cc2)[nH]n1	764110947	MZLVSFNHVMSVBK-UHFFFAOYSA-N	438.444	1.205	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccnn1Cc1ccc(C)s1	764139580	VYFCFMWGKYYAFY-UHFFFAOYSA-N	427.486	1.639	50	20	IDGD	
C[C@@H]1CN(c2ccccc2NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)C[C@@H](C)O1	764152317	CZABNOSTWZKJHZ-SXGZJXTBSA-N	438.484	1.390	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2O1)C(=O)Nc1ccc(-c2nnc3n2CCCC3)cc1	764163745	LPZQDIBBGFNRLV-GOSISDBHSA-N	446.467	1.371	50	20	IDGD	
CS(=O)(=O)c1c(F)cc(NC(=O)C(=O)NNC(=O)CCc2ccccc2)cc1F	764191644	DJUNSRPMCNIJFJ-UHFFFAOYSA-N	425.413	1.087	50	20	IDGD	
CCCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cccc(C#N)c2)cc1Cl	764238836	YJUVZZCGLHNJEP-UHFFFAOYSA-N	427.848	1.751	50	20	IDGD	
CCOC(=O)c1c(CC(C)C)csc1NC(=O)C(=O)NNC(=O)Cc1ccccn1	764265024	XIFBTAKMBYXUDF-UHFFFAOYSA-N	432.502	1.847	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)C(C)(C)c3ccccc3)cn2)C[C@@H](C)O1	764309228	NONVMWYEZMWONP-IYBDPMFKSA-N	439.516	1.759	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)C(=O)Nc1ccc(Cl)c(C(=O)NC2CC2)c1	764319787	SWLKKZDEDKCCJW-UHFFFAOYSA-N	432.839	1.700	50	20	IDGD	
CCOc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NNC(=O)c1ccc(O)c(Cl)c1	764348897	BMVWMJMOIDOXIS-UHFFFAOYSA-N	448.863	1.546	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)C(=O)Nc2cccc(-c3cn(Cc4ccccc4)nn3)c2)cn1	764358791	IKYGZWSGFJRRCJ-UHFFFAOYSA-N	444.455	1.127	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)C(=O)Nc2cc(C)nn2[C@@H]2C[C@H]3CC[C@H]2C3)c1	764433235	NBTAORJFTAQNPU-GRDNDAEWSA-N	439.476	1.306	50	20	IDGD	
COc1cc(C=NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)c([N+](=O)[O-])cc1O	764826331	DFFCONQJDMJDEF-UHFFFAOYSA-N	441.488	1.885	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNS(=O)(=O)c3ccc(C)c(C)c3)CC2)cc1	765127297	OHAVSXBIQXBMEF-UHFFFAOYSA-N	430.574	1.739	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)CCc2cncc3ccccc23)c1	765330095	ZPUNUBBQDPVMCQ-UHFFFAOYSA-N	426.498	1.879	50	20	IDGD	
CCOC(=O)NNC(=O)C(=O)Nc1ccc(NC(=O)[C@@H]2CCCO2)cc1C(F)(F)F	765407143	DBSSKQNOZBRXJG-LBPRGKRZSA-N	432.355	1.539	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)CNC(=O)c3cccc([N+](=O)[O-])c3)n[nH]2)c1	765575957	LTKZOKXZIFYLRE-UHFFFAOYSA-N	436.428	1.793	50	20	IDGD	
CC(C)OC(=O)CCCNC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	765906610	RZESFUITGXHPIT-UHFFFAOYSA-N	440.522	1.147	50	20	IDGD	
C[C@H]1CN(Cc2ccccc2)[C@H](C)CN1C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	766517500	GVUHHLBIIRKWDD-SJORKVTESA-N	434.504	1.612	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)C[C@@H](c1ccccc1)N1CCOC1=O	767329865	NXCNPSUMLNDSDN-IBGZPJMESA-N	439.468	1.812	50	20	IDGD	
CCOC(=O)c1cnn2c(C(=O)NNc3c(OC)cccc3S(C)(=O)=O)ccnc12	768642066	XUIMDYXUROKERB-UHFFFAOYSA-N	433.446	1.075	50	20	IDGD	
CCOC(=O)N1CC[C@@H](NC(=O)NNC(=O)[C@@H](C)Oc2cccc(Br)c2)C1	770325032	MYECFUWXDZXEKX-DGCLKSJQSA-N	443.298	1.778	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)N1CCN(c2cc(C#N)ccn2)CC1	770659773	VKZUDMLFWRKDEZ-AWEZNQCLSA-N	428.880	1.937	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)c2cc(-c3ccc4c(c3)CCO4)no2)c2ccccc2c1=O	771227763	IAQRHHJHONNOOW-UHFFFAOYSA-N	431.408	1.598	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc(F)ccc1Br)c1ccc2c(c1)OCCO2	771899037	WZRAXYHCAKLMOW-UHFFFAOYSA-N	431.239	1.983	50	20	IDGD	
CCn1cc(S(=O)(=O)NNC(=O)c2ccc(OC(C)C)c(OC)c2)c([N+](=O)[O-])n1	772568684	LGFKKVYLNSQQPD-UHFFFAOYSA-N	427.439	1.230	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)[C@H](C)n2nnnc2C(C)(C)C)c2ccccc2c1=O	777787485	USQIXRRRUBFIGX-LBPRGKRZSA-N	426.481	1.284	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(OCC(F)F)ccn2)c1	777957769	FZTMBLRAKNGSLY-UHFFFAOYSA-N	428.417	1.051	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)N[C@@H](CO)c1ccc(C(F)(F)F)cc1	778641701	RVLLIWIZDKTFRQ-LBPRGKRZSA-N	430.408	1.561	50	20	IDGD	
Cc1cc(N2C[C@@H](C(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)CC2=O)ccc1F	780314517	DNDDKGUNANULHW-ZDUSSCGKSA-N	437.431	1.195	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)N1CCN([C@@H]2CCCN(Cc3ccccc3)C2=O)CC1	780314665	KDMYWWPOKWAMAW-TZIWHRDSSA-N	443.592	1.377	50	20	IDGD	
Cn1cc(-c2nn(C)cc2C(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)cn1	780951587	ZMDLGJLCDPYNKB-UHFFFAOYSA-N	428.396	1.871	50	20	IDGD	
COc1ccc(C[C@@H](C)C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)cc1OC	781237469	YNADDFQQSUBPCW-CYBMUJFWSA-N	448.545	1.945	50	20	IDGD	
C[C@@H]1CCC[C@H](OCc2cccc(NC(=O)C(=O)NN[C@@]3(C)CCS(=O)(=O)C3)c2)C1	783426790	KFHXXZVIUVEUKF-YWMUFLPLSA-N	437.562	1.918	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2ccc(C(F)(F)C(F)(F)F)cc2)CCS(=O)(=O)C1	783427255	NTFNISWPNSMHKJ-CYBMUJFWSA-N	429.367	1.477	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2ccc(-n3cccn3)nn2)ccc1-n1nnnc1C(C)C	783432807	DJKHBRCWZMHYTG-UHFFFAOYSA-N	447.463	1.152	50	20	IDGD	
CC(=NNC(=O)Cc1cc(O)nc(S)n1)[C@@H]1CN(C(=O)OCc2ccccc2)CCO1	783822465	UWKDDBJGQZLTEF-INIZCTEOSA-N	445.501	1.543	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2ccc(-c3csc(N4CCOCC4)n3)cc2)ncn1	783945046	FYUHQODOORWYMM-UHFFFAOYSA-N	439.501	1.827	50	20	IDGD	
Cc1ccnc(-c2ccc(NC(=O)C(=O)NNC(=O)CNC(=O)c3cccs3)cc2)n1	784005405	ZGVACKHBHCYQSL-UHFFFAOYSA-N	438.469	1.029	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCNC(=O)[C@H]1c1ccccc1F	784514247	TWPYTDHYZCHOBV-GOSISDBHSA-N	434.855	1.422	50	20	IDGD	
Cc1ccc(-n2nc(C)cc2NC(=O)C(=O)NNc2ccc(Br)nc2)nn1	784808815	FWMGUABHQHGNGC-UHFFFAOYSA-N	431.254	1.518	50	20	IDGD	
CCS(=O)(=O)c1cc(F)ccc1NC(=O)C(=O)NNc1ccc(Br)nc1	784809762	VGXJGIRJHFNDKT-UHFFFAOYSA-N	445.270	1.859	50	20	IDGD	
CN(C)c1nccc(NNC(=O)C(=O)Nc2ccc(CCN3CCSCC3)cc2)n1	784969871	AVVMPHAEGDTDSP-UHFFFAOYSA-N	429.550	1.216	50	20	IDGD	
Cc1cnn(Cc2ccccc2F)c1NC(=O)C(=O)NNC(=O)Cc1cn2ccccc2n1	785061606	YLVHRMBRRXEHMJ-UHFFFAOYSA-N	449.446	1.355	50	20	IDGD	
COC(=O)Cc1ccc(NC(=O)C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)cc1	785099294	CWLXTYFEWXCLBR-UHFFFAOYSA-N	446.410	1.654	50	20	IDGD	
O=C(COC(=O)C1(Cc2ccccc2F)CC1)NNC(=O)[C@H]1COc2ccccc2O1	785808617	HJKGNOYFVZOJBT-GOSISDBHSA-N	428.416	1.679	50	20	IDGD	
Cn1cccc1C(=O)NNS(=O)(=O)c1cccc(S(=O)(=O)N2CCCCCC2)c1	790385415	HEZQTRONFNAFTF-UHFFFAOYSA-N	440.547	1.213	50	20	IDGD	
Cn1nc([C@H]2CCCOC2)cc1NC(=O)C(=O)NNC(=O)COc1ccc(Cl)cc1	790951840	MGEQCMSAABABGU-LBPRGKRZSA-N	435.868	1.132	50	20	IDGD	
COc1c(C(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)cccc1[N+](=O)[O-]	793814934	SWGGRCDWJVBKKR-UHFFFAOYSA-N	437.453	1.853	50	20	IDGD	
COc1cccc(-c2nc(C(=O)NNC(=O)CNC(=O)OCc3ccccc3)no2)c1	794064077	UPWGRDHQHDZSGG-UHFFFAOYSA-N	425.401	1.433	50	20	IDGD	
CC(C)[C@@H](O)C(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2Cl)c1	794739941	AOEHTMAGRPFYIM-MRXNPFEDSA-N	425.894	1.919	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)c1cn2ccc(Br)cc2n1	794775740	OSJYRSDLWFNGKQ-UHFFFAOYSA-N	427.218	1.820	50	20	IDGD	
CCn1c(=O)c(C(=O)/C(C#N)=C\c2ccoc2C(=O)OC)c(N)n(Cc2ccccc2)c1=O	798178700	UXXRPDGLSMWZBP-WJDWOHSUSA-N	448.435	1.830	50	20	IDGD	
O=C(NNc1ccccc1F)C(=O)Nc1cnc(N2CCOCC2)c(Br)c1	799260196	PWVPIKRJLDTUKH-UHFFFAOYSA-N	438.257	1.902	50	20	IDGD	
C[C@@H](Sc1ccccc1C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)C(N)=O	801156663	AOILHUCECMRRRK-LLVKDONJSA-N	425.511	1.121	50	20	IDGD	
COC(=O)c1c(F)cc(NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)cc1F	802567123	JAHCIRXZOJVFHL-UHFFFAOYSA-N	449.395	1.603	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3cc(O)ccc3[N+](=O)[O-])n[nH]2)cc1OC	802937568	YNYQWIKVKKGRNB-UHFFFAOYSA-N	427.373	1.783	50	20	IDGD	
O=C(COC(=O)[C@@H]1CCCN(C(=O)c2ccncc2)C1)NNC(=O)c1cccc(Cl)c1	803488666	AXTGMQVUQXPNBY-MRXNPFEDSA-N	444.875	1.592	50	20	IDGD	
COC(=O)c1cc(Br)c(OC)cc1NC(=O)C(=O)NNC(=O)CC(C)C	806975295	SPLTVTDHBDQGQB-UHFFFAOYSA-N	430.255	1.376	50	20	IDGD	
CN(NC(=O)c1ccc(C(N)=O)c(Cl)n1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	807242439	BJIPNVTZSBOWOC-UHFFFAOYSA-N	440.888	1.083	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)Nc1cccc2c1COC2=O	808911510	OYCVLTIYBCXYRI-UHFFFAOYSA-N	444.469	1.608	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2ccc(Cl)cc2F)cc1	810467791	BWWFVJKFDIMSGK-UHFFFAOYSA-N	442.856	1.177	50	20	IDGD	
CSc1nc(C)c(CCC(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)c(O)n1	812730819	YBXKQZHZGQVDEJ-UHFFFAOYSA-N	425.536	1.539	50	20	IDGD	
COC[C@]1(C(=O)NNC(=O)C(=O)Nc2ccc(C)cc2)CCN(C(=O)OC(C)(C)C)C1	813374125	UGRLKUFTAPUTRV-NRFANRHFSA-N	434.493	1.355	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)N[C@H]3CC34CCN(C(=O)OC(C)(C)C)CC4)nc21	813802519	MVEDRXPFSODTQL-LBPRGKRZSA-N	432.485	1.485	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)Nc1ccccc1C(=O)N1CCOCC1	814543364	RGQHSMHNCPCDFE-UHFFFAOYSA-N	447.517	1.558	50	20	IDGD	
CC(=NNC(=O)N=c1cc[nH]cc1)c1ccc(S(=O)(=O)N2CCCC[C@@H]2C(=O)O)cc1	815002218	QMAFJYJKQCIJAR-GOSISDBHSA-N	445.501	1.677	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(OC(=O)NC)c2)cc1OC	815567058	NMHAKICQXKOYLC-UHFFFAOYSA-N	444.444	1.602	50	20	IDGD	
CC[C@@H](C)C(=O)NNC(=O)C(=O)Nc1nnn(Cc2ccc(C(F)(F)F)cc2)c1C	815567675	HGVPMQZWROFHTG-SNVBAGLBSA-N	426.399	1.786	50	20	IDGD	
COCc1cc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)cc(C(=O)OC)c1	815568316	CUUGKZWQBZWFBW-UHFFFAOYSA-N	435.820	1.378	50	20	IDGD	
Cn1c(NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)nc2ccccc21	816576905	NLYYMIUWOQUSEF-UHFFFAOYSA-N	443.529	1.670	50	20	IDGD	
CC(=O)c1ccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc1O	816829983	LWLFMFRPLCFTIQ-UHFFFAOYSA-N	431.470	1.454	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)CNS(=O)(=O)c2c(C)c(C)cc(C)c2C)c1	825776901	OFAOPWXREIQICF-UHFFFAOYSA-N	448.545	1.467	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)[C@@H](O)[C@@H](O)c2nc3ccccc3s2)cc1	831306884	MKHAXLHXOSIOMD-OCBCSQNSSA-N	445.497	1.704	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNC(=O)CNS(=O)(=O)c2cccc(F)c2)cc1	913524759	FPXMAJGOYALIJI-UHFFFAOYSA-N	437.493	1.990	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)c2cc(S(=O)(=O)N3CCCCC3)cn2C)c1	914839472	WUYZEGYLPBIIJD-UHFFFAOYSA-N	448.545	1.657	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)ccc1Br	915268732	UHZHMBZADXKXIC-UHFFFAOYSA-N	443.235	1.080	50	20	IDGD	
CC(=NNC(=O)CNc1ccc(C)cc1)c1ccc(S(=O)(=O)N2CCNCC2)cc1	915921842	LTMIDRGGOSGKAO-UHFFFAOYSA-N	429.546	1.541	50	20	IDGD	
Cc1cc(C=NNC(=O)c2nn(C)c(=O)c3ccccc23)c(C)n1CCN1CCOCC1	915947427	UHJUEOMDDDDICF-UHFFFAOYSA-N	436.516	1.448	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NN=Cc1c[nH]nc1C)N(S(C)(=O)=O)CC2	915951764	NUIRFTZTCHEXHA-MRXNPFEDSA-N	435.506	1.135	50	20	IDGD	
C[C@H](Cn1cccn1)NC(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	916462485	BMFKRYOCSRSEHQ-MRXNPFEDSA-N	445.483	1.674	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)NCc3cccc(S(N)(=O)=O)c3)n[nH]2)cc1	916623934	GBJJOAARCHYFSU-UHFFFAOYSA-N	428.474	1.177	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCc2cn3cc(C)ccc3n2)cc1	918129814	UQXILSWNLPJJGF-UHFFFAOYSA-N	444.517	1.102	50	20	IDGD	
O=C(NCc1ccc(OCc2ccccn2)cc1)NNC(=O)c1ccc(-n2cnnn2)cc1	918233642	KFLPTRMJFSRQMK-UHFFFAOYSA-N	444.455	1.781	50	20	IDGD	
Nc1c(C(=O)NNC(=O)COc2ccc(Br)cc2)cc(F)cc1[N+](=O)[O-]	918402267	MZQRAEMETBKLSW-UHFFFAOYSA-N	427.186	1.919	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNS(=O)(=O)c2ccc(CCNC(C)=O)s2)c1	918725577	MCEAETDZOGQZLR-UHFFFAOYSA-N	427.504	1.067	50	20	IDGD	
CCCN1CC[C@@H](CNC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)C1	919797989	ZZUKLHVVCPSYNY-INIZCTEOSA-N	437.566	1.147	50	20	IDGD	
COc1cc(C=NNC(=O)N[C@H]2CCS(=O)(=O)C2)ccc1OC(=O)c1ccccc1F	920379694	AFEFTVZZJLJQCP-AWEZNQCLSA-N	449.460	1.874	50	20	IDGD	
COc1ccc(CNC(=O)CNC(=O)NNC(=O)c2ccc(Br)s2)cc1	920764221	NHCNUOYIMWFQOO-UHFFFAOYSA-N	441.307	1.780	50	20	IDGD	
COC(=O)c1cc(NC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc(C(=O)OC)c1	920932615	SNYZUDFBWDMRQQ-MRXNPFEDSA-N	429.385	1.253	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)CO[C@H]3CCOC3)c2)c(C)c1	1116199095	LLOALZXSWSLAKA-KRWDZBQOSA-N	447.513	1.671	50	20	IDGD	
CN(C)c1ncccc1C=NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	1117482686	YLSQVQZCNGNLHW-UHFFFAOYSA-N	445.545	1.251	50	20	IDGD	
CNS(=O)(=O)c1ccc(CC(=O)NNc2cc([N+](=O)[O-])ccc2Br)cc1	1118334379	WLZFFTBUHJTQSP-UHFFFAOYSA-N	443.279	1.951	50	20	IDGD	
CNS(=O)(=O)c1ccc(CC(=O)NNC(=O)Nc2ccc(Br)cc2)cc1	1321449809	UZPGGNGZJLGDMB-UHFFFAOYSA-N	441.307	1.753	50	20	IDGD	
CCOC(=O)c1cc(Cl)cc(S(=O)(=O)NNC(=O)c2n[nH]c3c2CCCC3)c1	1324142247	CHTIGIPZILPGJG-UHFFFAOYSA-N	426.882	1.742	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)[C@H]2CC(=O)N(Cc3ccco3)C2)CC1	1328626985	RUXAUHALVOQKEG-HNNXBMFYSA-N	434.493	1.423	50	20	IDGD	
COCCCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C1	1778091927	ZROYRBQYBZCJBA-UPRBLEQPSA-N	447.536	1.061	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4cncn4c3)C2)C1	1778690915	PXIBZUDIPXELSZ-AUUYWEPGSA-N	435.322	1.809	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccnc1C(N)=O)C2	1779539847	MYBIPQYVIMBUKT-IIBYNOLFSA-N	448.596	1.160	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccnnc2O)C1	1779966700	UXVGWGDKXUOFBI-HBUWYVDXSA-N	441.326	1.483	50	20	IDGD	
N#Cc1cccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](O)CCl)C3)c1Cl	1780097178	OGPFUZGPCHUBFL-JXXFODFXSA-N	440.327	1.939	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCc1nc(N)n[nH]1)C2	1780712935	ZKRHWQWHTPPDDJ-OCBCSQNSSA-N	447.367	1.070	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H]3CCN3C(=O)OC(C)(C)C)C2)C1	1781014946	FBUFLCARGBZTQN-BXTJHSDWSA-N	445.944	1.080	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)Cc3ccc(F)c(C#N)c3)C2)C1	1781300274	PNGTVRVNHPQQEW-ORAYPTAESA-N	438.297	1.853	50	20	IDGD	
COc1cccnc1CCC(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781325406	CWRDUXQHTAJSPT-AEFFLSMTSA-N	444.301	1.543	50	20	IDGD	
O=C(c1cnn2cccc(F)c12)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781335054	VEWZAWKFHBIFIA-RHSMWYFYSA-N	443.248	1.607	50	20	IDGD	
O=C(c1cccn2nccc12)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1782333402	RPUYGYCUXCWJPO-YOEHRIQHSA-N	425.258	1.468	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3nc4ccc(F)cn4n3)C2)C1	1782570227	FIKIZFAGXRBCDR-DIFFPNOSSA-N	440.273	1.095	50	20	IDGD	
O=C([C@@H](F)Br)N1CCO[C@@]2(CCN(C(=O)C(Cl)(Cl)Cl)C2)C1	1783266309	XNEOKGGOWLDZEF-XCBNKYQSSA-N	426.497	1.877	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)CSc3ncccn3)CCO2)C1	1783341272	CMXWRFNXUIIKSU-CXAGYDPISA-N	443.367	1.572	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](C)n1ccnc1C)CCO2	1783352908	JJYYXZIMEXESRO-DHSIGJKJSA-N	427.343	1.756	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)C(=O)c3ccc(Cl)cc3)CCO2)C1	1783870630	DCFFJBMLJKTAQO-BEFAXECRSA-N	429.300	1.606	50	20	IDGD	
COc1ccc(CC(=O)N2CCO[C@@]3(CCN(C(=O)C(Cl)Cl)C3)C2)c([N+](=O)[O-])c1	1783947018	LMPAWYFKGMUWQF-SFHVURJKSA-N	446.287	1.780	50	20	IDGD	
CCn1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]3C2)n1	1783967825	MLLPUJHXGKWFEM-YXWQFLTLSA-N	427.343	1.527	50	20	IDGD	
COc1cccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCBr)C[C@@H]32)n1	1785809483	ZXBROVSCLSKZRB-YDHLFZDLSA-N	426.311	1.469	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccnn3CC)[C@H]2C1	1786181391	UEGMMHGXVFIVGI-YXWQFLTLSA-N	427.343	1.670	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21)c1[nH]cnc1-c1cccnc1	1789197234	JYUNFXLZKDEVKJ-IHRRRGAJSA-N	438.315	1.869	50	20	IDGD	
COc1nc(C)ccc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]2C1	1789924477	GEFGWQXGWUCESH-MXAVVETBSA-N	444.301	1.682	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(Cl)c(O)cc3O)[C@H]2C1	1789995043	AEPNMTDSRJNBML-DBDKUZAISA-N	447.315	1.598	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](Cl)COC)C[C@@H]21	1790963551	IJFZJUPXZGWDID-HPCHECBXSA-N	425.751	1.393	50	20	IDGD	
COC[C@H](Cl)C(=O)NC1(c2ccc(NC(=O)COc3ccc(O)nn3)cc2)CCC1	1791055862	PCIRLSWUGMMSOR-HNNXBMFYSA-N	434.880	1.949	50	20	IDGD	
C=C(CC(=O)OCC)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)Br)[C@H]2C1	1791060858	KNPYDNPZUHVFAL-AJNGGQMLSA-N	431.327	1.259	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3cccc(C#N)c3)C[C@@H]21	1791249905	UGDFWBBGYDOKGB-HAGHYFMRSA-N	433.936	1.724	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(-c4cccnc4)[nH]n3)C[C@@H]21	1791255413	QOUVRQIDKJPZKA-FPXQBCRKSA-N	447.923	1.319	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1ccc(C2(NC(=O)[C@H](O)N3CCOCC3)CCC2)cc1	1791568867	LCXBIVJGZBTGNZ-APWZRJJASA-N	425.913	1.025	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(C(F)(F)F)c1F)C2)[C@@H](O)CCl	1792980113	LUZZGMNNPSWVPI-FJHTZYQYSA-N	438.805	1.647	50	20	IDGD	
COCCn1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](C)CBr)C3)n1	1797066315	FKALSDKYAOFMDL-XQLPTFJDSA-N	427.343	1.812	50	20	IDGD	
COc1cc(OC)cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)Br)C3)c1	1798899333	VJRZIMRLZYYHIJ-DPYKFYPSSA-N	441.322	1.690	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccccc1O	1800570585	YRZHQUAYPBABQE-BASYENTBSA-N	425.323	1.698	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)nc(Cl)c1)C2	1800639230	LYHSCSMZIVTPLY-OXIQGZBJSA-N	446.729	1.817	50	20	IDGD	
COc1cccc(OC)c1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)Br	1800760628	XECDHKWDFQFSHJ-JRATXPSKSA-N	441.322	1.690	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1ccc([N+](=O)[O-])cc1F	1801528162	VHAWMADRNUMIDF-MUJYYYPQSA-N	449.483	1.288	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CC1CCC1	1802026458	KKHWTWSOPKQVKN-DFGXFYAUSA-N	443.972	1.898	50	20	IDGD	
C[C@H](NC(=O)c1ccccc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CO[Si](C)(C)C)C2	1802114578	PBUYBXNKPAVMQW-BOLBYERCSA-N	447.608	1.246	50	20	IDGD	
COc1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CCC(=O)NN(C)C)C3)ccc1[N+](=O)[O-]	1803823840	STLDZYRSVSYAOQ-MUJYYYPQSA-N	447.492	1.228	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1)c1ccc(O)nn1	1805267432	IRFMBNMSHKSDTL-GUYCJALGSA-N	434.294	1.682	50	20	IDGD	
CC(=O)NC(C)(C)C(=O)N1CC[C@H](CNC(=O)CCBr)[C@@H]1c1cccnc1	1806341708	FGLUAQOZZIHGIM-WBVHZDCISA-N	439.354	1.787	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)c1cccc2nc[nH]c12	1808002253	TVGFUIANRILYRT-FNHZYXHNSA-N	427.892	1.877	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)CCC#N)[C@H]1c1cccnc1	1808414853	MWFRFUTZPYPCGN-PWCMAEROSA-N	435.488	1.525	50	20	IDGD	
Cn1nc(C(=O)N2CC[C@H](CNC(=O)[C@@H](F)Br)[C@H]2c2cccnc2)cc1O	1808651208	KHUDPXZYQOATQW-KCPJHIHWSA-N	440.273	1.531	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)c1ccc2nccn2c1	1809415270	WXAYSAQCRSZBJW-KVSKMBFKSA-N	427.892	1.649	50	20	IDGD	
C=C(CC(=O)OCC)C(=O)N1CC[C@H](CNC(=O)[C@H](Cl)COC)[C@@H]1c1cccnc1	1813032135	GHNLBPYCPRWNCN-LMMKCTJWSA-N	437.924	1.851	50	20	IDGD	
O=C(Nc1cccnc1)C(=O)N1CC[C@H](CNC(=O)C(Cl)Cl)[C@@H]1c1cccnc1	1813077368	HEWWXXIBPBGJGD-HIFRSBDPSA-N	436.299	1.925	50	20	IDGD	
CCC[C@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](O)N2CCOCC2)[nH]n1	1815319334	IGWJNTSDLHFEAV-JCKWVBRZSA-N	427.933	1.460	50	20	IDGD	
CCC1(C(=O)N[C@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)CCC1	1815356363	FTWFOLQCKFZCMC-HNNXBMFYSA-N	427.335	1.629	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](O)CCl)CC2)c1cc(N2CCCC2)ccn1	1817576710	FGQDNUKNFSKSPX-BLLLJJGKSA-N	449.964	1.964	50	20	IDGD	
CC(C)NCCC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819402983	QTIKTAWCQUKQNY-KRWDZBQOSA-N	442.524	1.102	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccnc1)CC2	1819794672	AXCJHFUNSBPYMW-LBPRGKRZSA-N	437.485	1.076	50	20	IDGD	
C[C@@H]1C[C@]1(C)C(=O)N[C@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1	1819798052	SFYJZUJOPXSHIX-NLQQUQSOSA-N	428.518	1.414	50	20	IDGD	
CCS(=O)(=O)CC(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](F)Br)n[nH]1	1820931387	OKJUNEHTDVORCG-GXFFZTMASA-N	439.307	1.527	50	20	IDGD	
COc1cc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)CCBr)CC3)nn1C	1821765631	FHXOSDZIYBOAGZ-SECBINFHSA-N	442.339	1.896	50	20	IDGD	
Cc1ccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)cn1	1822412879	INNLEAHLCSOAGX-KRWDZBQOSA-N	427.509	1.792	50	20	IDGD	
O=C(c1cc(O)nc(O)n1)N1CCC([C@H]2CCCCN2C(=O)CCBr)CC1	1826356629	AKBBCOKPZNTBIU-CQSZACIVSA-N	441.326	1.906	50	20	IDGD	
O=C([C@H](O)N1CCOCC1)N1CCC([C@H]2CCCCN2C(=O)CCBr)CC1	1826358244	BNNLNKPXFJDPGE-APWZRJJASA-N	446.386	1.042	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)COc3cccnn3)sc2C1	1826765064	HXJCZIAOAWMASX-VHSXEESVSA-N	440.323	1.708	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CCc2nc(N)n[nH]2)CC1	1828806956	UAVLCNBEISXCBY-OCCSQVGLSA-N	441.374	1.723	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)/C(C)=C/c3cccs3)CCO2)C1	1829706992	ZTCVTWWCLYNVAQ-CLLWQVOUSA-N	442.965	1.862	50	20	IDGD	
O=C(c1cc(=O)c2ccccc2o1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1830310090	QMIBBNMEOXIYIU-YLJYHZDGSA-N	438.839	1.397	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3cccc(C#N)c3)CCO2)C1	1830461677	VZMANAANRWLPQY-UGKGYDQZSA-N	433.936	1.965	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccccc3)C2)C1	1830538074	VDAZJDTWXIJCCL-UZLBHIALSA-N	439.350	1.717	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3ccoc3)C2)C1	1830545683	LRPQBRNUJVVHOX-BEFAXECRSA-N	443.338	1.700	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(Cl)cnc3O)C2)C1	1831639002	JHTNZLBTKZGJKA-KXBFYZLASA-N	446.331	1.918	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)C3(Br)CC3)C2)C1	1831654056	PSTJSIWHIHQPFR-CZUORRHYSA-N	437.762	1.778	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)/C=C/c3ccoc3)CCO2)C1	1832651641	OQNCKHCGRBZNBR-WTJLDUFHSA-N	431.316	1.986	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)C(C)(C)C)CC2)CC1	1833282765	HJRXLXAKIHQKAA-YOEHRIQHSA-N	446.430	1.996	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H]3Cc4ccccc4N3)CC2)CC1)[C@@H](O)CCl	1833312626	ZMVXKVFJPONXNP-PMACEKPBSA-N	434.968	1.195	50	20	IDGD	
C[C@H](Oc1cccnc1)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)CCl)CC2)CC1	1833313097	VIKRXDNKOWGWLU-KXBFYZLASA-N	438.956	1.020	50	20	IDGD	
CC(C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)C1	1834727692	ASVOKEJGDOXKNY-YWZLYKJASA-N	447.960	1.231	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H]3CC[C@@H]4CCC(=O)N4C3)CC2)CC1)[C@@H](F)Cl	1835082208	VQZHAHSIWULVFH-LSBZLQRGSA-N	442.963	1.493	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)Cc3ccccc3)CC2)CC1)[C@@H](F)Cl	1835083787	UVXYEPVCFWVXDF-RBUKOAKNSA-N	425.932	1.696	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CSc3ccccc3)CCO2)C1	1835094269	OLAKENPGJFTWOK-YLJYHZDGSA-N	442.965	1.489	50	20	IDGD	
CC(C)CNC(=O)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)Br)CC2)CC1	1835129299	OZHBOLNYDGAATK-CQSZACIVSA-N	445.402	1.114	50	20	IDGD	
C[C@H](C(=O)NC1CCN(C2CCN(C(=O)C(Cl)Cl)CC2)CC1)N1C[C@H]2C[C@@H]2C1	1835676657	IYJXOEVIOUELIC-RBSFLKMASA-N	431.408	1.702	50	20	IDGD	
Cc1c(C(=O)N2CCC(N3CCC(NC(=O)CO[Si](C)(C)C)CC3)CC2)cnn1C	1835833521	NNXONDBIUUXGAO-UHFFFAOYSA-N	435.645	1.765	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(F)c(C)c3N)CCO2)C1	1835875523	YZDJMNKOQBUCLB-FOIQADDNSA-N	443.903	1.040	50	20	IDGD	
CCc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@](C)(Cl)CCl)C3)C2)n[nH]1	1836280897	LKSJZMLDLNERAT-QZTJIDSGSA-N	433.336	1.278	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H]3[C@H]4COC[C@H]43)CC2)CC1)[C@@H](F)Br	1836414596	SVMVBIPWOMMCAQ-FXUDXRNXSA-N	432.334	1.141	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccn4cncc34)CCO2)C1	1837108147	SJMFSLNMJNOBSV-NRFANRHFSA-N	434.924	1.669	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3[nH]cc4c3CCC4)C2)C1	1837715303	IAHZNQYVSFBDTI-NRFANRHFSA-N	435.597	1.425	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)Cn3ccnn3)CC2)CC1	1837981806	WTGLBGMWILXLLG-CYBMUJFWSA-N	428.331	1.060	50	20	IDGD	
Cn1nc(C(F)(F)F)cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1838078428	NSXHEBJBCWWLCV-DOMZBBRYSA-N	442.797	1.043	50	20	IDGD	
C[C@@H]1C[C@@]1(C)C(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1	1838394796	YHYSRJOOVSJGLZ-IQMFZBJNSA-N	443.548	1.343	50	20	IDGD	
CCCc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](Cl)COC)C3)C2)cc1	1839016769	ZHZFTQAKRPRFMF-DENIHFKCSA-N	438.952	1.963	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cccc(F)c3F)C2)C1	1839147988	JAUQWNDHGIRIGJ-FOIQADDNSA-N	430.879	1.981	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)n(C)n1	1839151231	LJTQIQVHQKRWNM-ZWKOTPCHSA-N	433.336	1.035	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CCCSC3)C2)C1	1839156377	NUEHOAJOXBFYOE-JLSDUUJJSA-N	439.405	1.822	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(F)c3[N+](=O)[O-])CCO2)C1	1839356705	SPCVXYVSPZUIDV-KUHUBIRLSA-N	443.859	1.821	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(C(C)(C)C)n[nH]3)C2)C1	1840153398	NEPBWZMWRHCJKV-VBKZILBWSA-N	442.944	1.031	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccccc3C3CC3)CCO2)C1	1840658304	WQPWLBASYSYNJB-SIKLNZKXSA-N	436.936	1.888	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)C3CCN(CC)CC3)CCO2)C1	1840927042	GALXCAAGYKYFLH-GHTZIAJQSA-N	429.989	1.582	50	20	IDGD	
Cc1ccc(OCCC(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)cc1	1841179976	CAUXSEPYTVCWRG-UHFFFAOYSA-N	437.500	1.280	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC12CN(C(=O)[C@@H](O)CNC(=O)OC(C)(C)C)C2	1841285079	BBZNUBWFEWZUAI-STQMWFEESA-N	448.358	1.106	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1ccnc(C(F)F)c1)C2	1843415560	OJDXCBGLOIKADA-LGJNPRDNSA-N	444.442	1.970	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)[C@H]1CCCN(C)C1)C2	1844693022	OSLVZRLGOFJFHB-INIZCTEOSA-N	444.488	1.679	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@H]2CCCN2C(=O)OC(C)(C)C)C1	1846202455	JOVBDQVLNWNJKF-LSDHHAIUSA-N	429.945	1.843	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)c2ccc(OCC3CC3)cc2)C1	1846861049	HHMMOUZTZQMIHI-UHFFFAOYSA-N	434.301	1.286	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1c(Cl)cncc1Cl	1847202377	MOALFXQBVGAUKM-GJZGRUSLSA-N	449.298	1.516	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cnc2c(c1)CCNCC2	1847502227	NBBMDZBEGLUFTR-KKXDTOCCSA-N	435.366	1.616	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@@H]2CC(=O)N(Cc3ccccc3)C2)cc(OC)c1OC	13623011	JGFULZSACFAUGV-MRXNPFEDSA-N	427.457	1.522	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)CNC2=NS(=O)(=O)c3ccccc32)c1	24399673	WSIFRQXQXQRRML-UHFFFAOYSA-N	444.513	1.383	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(OC)c(OC)c2)c1	26960232	WUPNKZVDJLTRPA-UHFFFAOYSA-N	435.502	1.809	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)N[C@@H](C)CC(=O)Nc2cccc(N3CCCC3)c2)n1	726279833	LHBMEJKCOWBCHV-HNNXBMFYSA-N	441.536	1.848	50	20	IDGD	
N#C/C(=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)N1CCCNC(=O)C1	726778066	IUOGOXQPXIRVOY-GDNBJRDFSA-N	440.891	1.334	50	20	IDGD	
CN(C)CCNC(=O)c1cccc(CNC(=O)NNC(=O)Cc2ccc(Cl)cc2)c1	727480106	UWIKSJLZWNQLQF-UHFFFAOYSA-N	431.924	1.705	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)CCNC(=O)c2ccc([N+](=O)[O-])cc2)cc1F	727500119	SYOYBIQTFJGLOX-UHFFFAOYSA-N	435.437	1.880	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)cc(Cl)c1OCCC(C)C	728384628	NVKLSFDWMIJYDV-GFCCVEGCSA-N	432.926	1.969	50	20	IDGD	
CCCN(CC)C(=O)c1ccc(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1	729299682	GTADAYDJBZAOLE-UHFFFAOYSA-N	445.545	1.927	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(C)c(C(=O)NNC(=O)Cn2ccc3ccccc32)c1	729450243	QLIVFBOJSMDRQI-UHFFFAOYSA-N	444.513	1.336	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCN(c2ccc3c(c2)OCCO3)C1=O)c1cc(Br)c[nH]1	730519078	FXKNJUAVIUFXAV-GFCCVEGCSA-N	449.261	1.363	50	20	IDGD	
CC(C)C[C@H](C(=O)NNC(=O)COc1ccccc1O)N1C(=O)[C@H]2CC=CC[C@H]2C1=O	730778496	IYGLNETWKHDVHH-OWCLPIDISA-N	429.473	1.284	50	20	IDGD	
CC(C)(C(=O)NNC(=O)N1CCN(CC(=O)N2CCc3ccccc32)CC1)c1ccccc1	731222423	XMFMDBIZOVNCJT-UHFFFAOYSA-N	449.555	1.912	50	20	IDGD	
O=C(COC(=O)[C@@H](c1ccccc1)N1CCC(O)CC1)NNC(=O)c1cccc(Cl)c1	731247542	IBOMLAJHIQXABK-HXUWFJFHSA-N	445.903	1.842	50	20	IDGD	
CSCC[C@H](C(=O)NNC(=O)Cc1ccccc1F)N1C(=O)[C@H]2CCCC[C@@H]2C1=O	731329505	UKPABIISMHMHMC-YQQAZPJKSA-N	435.521	1.813	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNC(=O)NC2CCN(CC(=O)N(C)C)CC2)cc1	731761875	LGEWHLREPIMKNS-UHFFFAOYSA-N	433.553	1.608	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CNC(=O)c2cc(F)cc(F)c2)cc1Br	732305799	QVOPPINQVHGQFE-UHFFFAOYSA-N	442.216	1.927	50	20	IDGD	
COc1ccc([C@@H]2[C@@H](C(=O)NNC(=O)COc3ccccc3OC)CCC(=O)N2C)cc1	734417675	IQLOKUSPUVLKNG-HTAPYJJXSA-N	441.484	1.840	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)NCc1cccc(S(=O)(=O)NCCOC)c1)c1ccccc1	735518423	JLFBZAHVRYYMDK-LJQANCHMSA-N	448.545	1.636	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)CN(Cc2cccnc2)c2ccccc2)c1	735648831	AGFFZRGSHALTTA-UHFFFAOYSA-N	438.509	1.953	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc(OC(F)(F)F)cc1)NNc1ccc(Cl)nn1	735688855	BDISRSYYFFSQNN-UHFFFAOYSA-N	439.803	1.840	50	20	IDGD	
C[C@@H]1NC(C(=O)NNC(=O)NCc2cccc(C(F)(F)F)c2)=NN(c2ccccc2)C1=O	742452729	DHXYPLMZLMYXIX-LBPRGKRZSA-N	448.405	1.874	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)cc1NC(=O)OC(C)(C)C	742578407	ZKTLTQFFTITJSI-CYBMUJFWSA-N	426.495	1.473	50	20	IDGD	
CNS(=O)(=O)c1ccc([C@H](C)NC(=O)NNC(=O)Nc2ccc(N(C)C)cc2)cc1	743559092	XDPMDGSYXLIJSQ-ZDUSSCGKSA-N	434.522	1.758	50	20	IDGD	
COc1ccc(C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)cc1Br	744584284	YZSJLQRCSHZOCV-UHFFFAOYSA-N	432.230	1.947	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)C[C@H](c2ccccc2)N2CCOC2=O)c1	744949718	AOZSJTNOMQURDN-GOSISDBHSA-N	436.424	1.446	50	20	IDGD	
O=C(NC[C@H](c1ccc(F)cc1)N1CCOCC1)NNC(=O)c1cc([N+](=O)[O-])ccc1O	745289404	JURAWUMUONNBKF-QGZVFWFLSA-N	447.423	1.457	50	20	IDGD	
CC(C)(C)OC(=O)N(CC(=O)NNC(=O)Cc1cn2ccccc2n1)C[C@@H]1CCCO1	746555655	FMBZNWGSSDJIFL-INIZCTEOSA-N	431.493	1.440	50	20	IDGD	
CC(C)n1nc(C(=O)NNS(=O)(=O)c2cc(C(=O)O)cs2)c2ccccc2c1=O	747847463	GRQNTXUQQMVJJN-UHFFFAOYSA-N	436.471	1.360	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NCC(=O)N1CCN(c2ccccc2)CC1	749219526	BFYOBIRVAQUVQK-MRXNPFEDSA-N	443.479	1.272	50	20	IDGD	
CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)NNc1ccccc1S(C)(=O)=O	749535218	PPMVNMSGKPLKJQ-GOSISDBHSA-N	432.477	1.901	50	20	IDGD	
CCOC(=O)[C@H]1Cc2cc(S(=O)(=O)NNC(=O)c3cc4c(s3)CCC4)ccc2O1	751539444	YOPIREWWMZJULF-OAHLLOKOSA-N	436.511	1.727	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2c[nH]nc2-c2ccccc2F)ccc1Cl	755048456	FGFJVCNYPKOPSP-UHFFFAOYSA-N	437.840	1.591	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)Nc2cc(C(=O)NCC(F)(F)F)ccc2C)n1	755912794	IQCOVQVOFZJSAB-UHFFFAOYSA-N	426.399	1.953	50	20	IDGD	
Cc1ccc(NC(=O)c2ccccc2)cc1NC(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O	755913115	OEEBGUDAUFGUIM-CYBMUJFWSA-N	433.490	1.338	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)Nc2ccc(N3CCNC(=O)C3)c(Cl)c2)c1	755938891	YQWXNUYBGNOENQ-UHFFFAOYSA-N	430.896	1.809	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2cnn(Cc3ccccc3)c2)c1	756706715	DGPIOWTYJBEHFQ-UHFFFAOYSA-N	442.501	1.648	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)Nc1ccc(S(=O)(=O)NCC2CC2)cc1	756782984	CYPPFXHVZSCPMU-UHFFFAOYSA-N	442.501	1.798	50	20	IDGD	
O=C(CCN1C(=O)CNC1=O)Nc1ccc(NC(=O)NNc2ncccc2Cl)cc1	758018580	XAZDNYYWYYZBOP-UHFFFAOYSA-N	431.840	1.764	50	20	IDGD	
CCCc1noc2nc(-c3ccco3)cc(C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)c12	758036535	SBMSYXJHWFEWPE-SNVBAGLBSA-N	435.462	1.134	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1ccc(-c2ccc(Br)cc2)n1C	758048741	VEKVGYDHEYURNM-JTQLQIEISA-N	443.323	1.153	50	20	IDGD	
O=C([C@H]1CCCCN1Cc1ccccc1)N1CCN(S(=O)(=O)CBr)CC1	758512277	KEKGJEAYKRQHON-QGZVFWFLSA-N	444.395	1.868	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)[C@](C)(O)CN1C(=O)C(C)(C)c2ccccc21	758887650	SSXDWMMNOAIHEB-JLCFBVMHSA-N	433.505	1.187	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)[C@@](C)(O)CN2C(=O)C(C)(C)c3ccccc32)c1	760054080	SCNKLWPCLXSIBK-DEOSSOPVSA-N	439.512	1.905	50	20	IDGD	
O=C(NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1)c1ccc([N+](=O)[O-])cn1	761837210	ZKNAGQVFBRXOQG-UHFFFAOYSA-N	447.454	1.927	50	20	IDGD	
O=C(NNc1nccc(N2CCOCC2)n1)c1ccc(=O)n(Cc2ccccc2Cl)c1	762847389	ISUPDQKCUGZAME-UHFFFAOYSA-N	440.891	1.934	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)CN2C(=O)N[C@@]3(C[C@H](C)CC(C)(C)C3)C2=O)n1	762899336	BHNXVUDTMUMRMX-SPLOXXLWSA-N	431.541	1.903	50	20	IDGD	
O=C(COC(=O)c1cc(Cl)cc(Cl)n1)NNC(=O)[C@@H]1COc2ccccc2O1	762948784	JAPCJZIAQIGRLL-ZDUSSCGKSA-N	426.212	1.533	50	20	IDGD	
CCOc1cc(C(=O)N(C)C)ccc1NC(=O)C(=O)NNC(=O)c1ccc2ccccc2n1	763450824	UKYVFVNTKBSUCD-UHFFFAOYSA-N	449.467	1.735	50	20	IDGD	
Cc1ccc(C(=O)N2C[C@H](C)C[C@@H](C)C2)cc1NC(=O)C(=O)NNC(=O)c1ccccn1	763464011	PVGPMJZJMGVJTR-HUUCEWRRSA-N	437.500	1.908	50	20	IDGD	
Cc1cc2cc(NC(=O)C(=O)NNC(=O)CCN3CCN(c4ccccc4)CC3)ccc2[nH]1	763531881	STNZUDBALNKIFE-UHFFFAOYSA-N	448.527	1.775	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2-c2ccccc2)n(CCC#N)n1	763641009	AKXLEZXORZFSAZ-UHFFFAOYSA-N	446.467	1.937	50	20	IDGD	
CCN(Cc1ccccc1NC(=O)C(=O)NNC(=O)COc1cc(C)cc(C)c1)C(C)=O	763649859	ZGWXAIJGSAONIX-UHFFFAOYSA-N	440.500	1.837	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)COc2ccccc2F)cnn1-c1ccccc1F	763679877	DWYOETKNNLCZAU-UHFFFAOYSA-N	429.383	1.624	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccnn1Cc1ccc(C)o1	763713052	LAQVCYPUMCYCBP-UHFFFAOYSA-N	425.445	1.560	50	20	IDGD	
Cc1cc(S(C)(=O)=O)ccc1NC(=O)C(=O)NNC(=O)C12CC3CC(CC(C3)C1)C2	763728493	UOIMKGTYWCROAP-UHFFFAOYSA-N	433.530	1.701	50	20	IDGD	
CC(C)Oc1ccc(F)cc1NC(=O)C(=O)NNC(=O)c1nnc(O)c2ccccc12	763790661	MOMOWGPRSVWKEA-UHFFFAOYSA-N	427.392	1.661	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)NC(=O)[C@H](C)O3)c1C	763850509	OONOEDBTATZCTD-KBPBESRZSA-N	440.456	1.576	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)Cc2c[nH]c3ccccc23)c(C)c1	763864507	CCKHZYSDPWYPBS-UHFFFAOYSA-N	438.440	1.357	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)C[C@H](OC)C3)ccc1OC(C)C	763916924	YXFMTSZAZZGFPZ-GOSISDBHSA-N	441.484	1.996	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)c2c(C)nn(C)c2-n2ccnc2C)cc1	763926013	VHEVUPNWLRCCNM-CQSZACIVSA-N	426.477	1.850	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)c(Br)n1	763978274	HPEZABOGFKKIPL-UHFFFAOYSA-N	427.642	1.911	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cccn2C)n([C@H]2CCN(Cc3ccccc3)C2)n1	763995519	IOIIJQTWCBOZHW-SFHVURJKSA-N	449.515	1.377	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc(Br)cc2Cl)c(=O)n(C)c1	764059298	RDYUMUHSIJDBDA-UHFFFAOYSA-N	441.669	1.509	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccc(C(=O)NCC(C)C)cc1	764136370	POFKBBIECYTHCR-UHFFFAOYSA-N	426.473	1.410	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(C(=O)NCc3ccccc3)c2)cc1	764176710	FXBKBPRHJIYCTE-UHFFFAOYSA-N	441.447	1.888	50	20	IDGD	
CO[C@@H](C)C(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)c1	764240020	XTGHZFJQGZEPAC-AWEZNQCLSA-N	437.456	1.401	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)c(Cl)c1)C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F	764349467	PLFDUGXOZXEPLR-UHFFFAOYSA-N	444.734	1.955	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)c3cccn3C(C)C)CC2)cc1	764752712	NIYZFLCOFDYOJO-UHFFFAOYSA-N	447.561	1.145	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)Nc3ccc(S(N)(=O)=O)cc3)n[nH]2)c1	765308139	XMGVERGWFZCGJW-UHFFFAOYSA-N	428.474	1.807	50	20	IDGD	
O=C(NCCCCN1CCN(c2ncccn2)CC1)NNc1ncnc2ccsc12	765753053	UOTWYTZRAIZYAF-UHFFFAOYSA-N	427.538	1.710	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)CS(=O)(=O)c1cccc(Br)c1	766662113	JRNPIVJIERBAMA-UHFFFAOYSA-N	447.332	1.770	50	20	IDGD	
COc1cccc(C(=O)NNS(=O)(=O)c2ccc(OC[C@H]3CCOC3)c(F)c2)c1O	767450556	MTWXPLURILGJSM-LBPRGKRZSA-N	440.449	1.579	50	20	IDGD	
Cc1nn([C@@H]2CCS(=O)(=O)C2)c(Cl)c1C=NNC(=O)c1ccc2c(c1)OCCO2	767484952	DNQWODWYDZANRE-CYBMUJFWSA-N	438.893	1.740	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)[C@H](C)NS(=O)(=O)c1ccc(C#N)cc1	767734174	JJZIRKNKUDGNFL-AWEZNQCLSA-N	430.486	1.014	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CSc1nnc(-c2cnccn2)n1C	768407034	NFKCAWAHSLAYAS-UHFFFAOYSA-N	433.881	1.487	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)cc1	768454552	NEABICVGUBFCOF-UHFFFAOYSA-N	445.457	1.466	50	20	IDGD	
COc1ccnc(NNC(=O)c2c[nH]c3ccc(I)cc3c2=O)n1	769478453	AOOSWACTGSADNF-UHFFFAOYSA-N	437.197	1.688	50	20	IDGD	
CNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cc(C)n(-c3ccccc3)c2C)cn1	770207268	AONRLVFWNMTFNZ-UHFFFAOYSA-N	427.486	1.472	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(F)c(NC(=O)C(=O)NNc2c(F)cccc2Cl)c1	770808229	RMRFHDQSWJFDGZ-UHFFFAOYSA-N	432.836	1.950	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)C3(S(=O)(=O)c4ccccc4)CC3)nc21	770968954	QBCWPGMQMKUJDV-UHFFFAOYSA-N	430.490	1.737	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1cccc(C(F)(F)F)c1)C(=O)NNC(=O)Cc1ccccc1F	771008302	HBCADJMBNAEYEO-LLVKDONJSA-N	447.410	1.901	50	20	IDGD	
COc1ccccc1[C@@]1(C)NC(=O)N(CC(=O)NNC(=O)c2c[nH]c3ccccc23)C1=O	771237313	YVEDXEMADAPXKK-JOCHJYFZSA-N	435.440	1.405	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)[C@H](c1ccc(Cl)cc1Cl)N1CCOCC1	772160318	CEHKKIGSTRDWMX-BZNIZROVSA-N	432.304	1.856	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)ncc1Br	773550414	POTKCHKVONKANF-UHFFFAOYSA-N	443.261	1.738	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccc(S(C)(=O)=O)cc1	774008397	HNMBTXDLXJKYOI-NSHDSACASA-N	439.877	1.297	50	20	IDGD	
COc1cc(C)nc(NNC(=O)c2cccc(C(=O)NNc3nc(C)cc(OC)n3)c2)n1	775538007	GUIZQDSACZYQGC-UHFFFAOYSA-N	438.448	1.414	50	20	IDGD	
CN(NC(=O)C(=O)NCCCc1ccccc1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776201859	MJGXBANKZAYLJZ-UHFFFAOYSA-N	447.536	1.371	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2cc3c(cc2F)NC(=O)CC3)c1	778706941	IYZILSFKGFYZSA-UHFFFAOYSA-N	428.420	1.492	50	20	IDGD	
N#CC1=CCN(C(=O)CCC(=O)N2CCN(S(=O)(=O)c3ccc(F)cc3)CC2)CC1	780684761	JIHKCBHFTMRAGB-UHFFFAOYSA-N	434.493	1.121	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H](C)[C@@H]2CCCOC2)c1	780864078	ZOSJEIDDFJMBHT-GDBMZVCRSA-N	426.539	1.476	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)NCc1ccccc1CN1CC[C@@H](O)C1	781949429	BXCJKGNVFFUYFS-HXUWFJFHSA-N	426.517	1.725	50	20	IDGD	
Cc1ccc(C)c(Sc2ccc(NC(=O)C(=O)NNC(=O)C(=O)NC3CC3)cc2)c1	782967701	VVSHGUKCZKLJOJ-UHFFFAOYSA-N	426.498	1.819	50	20	IDGD	
Cc1ccc(C)c(NNC(=O)C(=O)Nc2cnn(CC(=O)N3C[C@@H](C)O[C@H](C)C3)c2)c1	783361309	DWZVIZATEFMAQQ-HZPDHXFCSA-N	428.493	1.218	50	20	IDGD	
NC(=O)c1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)c(F)c1	783407990	ILPABQMHRQPARX-UHFFFAOYSA-N	448.354	1.300	50	20	IDGD	
Cc1nnnn1-c1cc(NC(=O)C(=O)NNc2ccc(Br)cn2)ccc1F	784339987	QZZWQWBMQLJHKD-UHFFFAOYSA-N	435.217	1.349	50	20	IDGD	
CN1CCCN(S(=O)(=O)c2cccc(NC(=O)C(=O)NNc3ccc(F)cc3)c2)CC1	784783976	SFEIULWLFGNOLJ-UHFFFAOYSA-N	449.508	1.234	50	20	IDGD	
C#CCOc1cccc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)NC(C)(C)C)c1	784832875	FKKDOSGKWAILSA-UHFFFAOYSA-N	444.513	1.857	50	20	IDGD	
COC(=O)c1ccc(OC(C)C)c(NC(=O)C(=O)NNc2cccc(S(C)(=O)=O)c2)c1	784844579	NOYIIMFAOXSKEK-UHFFFAOYSA-N	449.485	1.746	50	20	IDGD	
CCNC(=O)N(C)NC(=O)C(=O)Nc1ccc(S(=O)(=O)N(CC)c2ccccc2)cc1	784915967	LIYFIYWCGUSJCJ-UHFFFAOYSA-N	447.517	1.533	50	20	IDGD	
C[C@@H]1CN(S(=O)(=O)N2CCN(C(=O)/C(C#N)=C\c3ccc(F)cc3)CC2)C[C@@H](C)O1	785193968	USYRHTRZVRKHFP-YSRDQRMMSA-N	436.509	1.231	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1ccccc1O[C@@H](C)C#N	785331281	RUTUFDBCZKHPHY-LBPRGKRZSA-N	432.458	1.471	50	20	IDGD	
CCS(=O)(=O)CCn1cc(C)c(NC(=O)NNC(=O)c2cc(OC)cc(OC)c2)n1	786725231	PDKLXKRXLMRLGU-UHFFFAOYSA-N	439.494	1.110	50	20	IDGD	
CCc1ncc(S(=O)(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)s1	788918650	YPVKMYKNJFYOHM-UHFFFAOYSA-N	433.556	1.503	50	20	IDGD	
CC(C)c1cc(NC(=O)NNC(=O)c2nnc(O)c3ccccc23)n(-c2ncccn2)n1	789261111	VVCVUMVYFOTIKJ-UHFFFAOYSA-N	433.432	1.901	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1cc([C@H]2CCCO2)nn1C	789783647	WNZFZBIBPZJIFY-XHDPSFHLSA-N	435.868	1.478	50	20	IDGD	
O=C(NCCOc1ccc(S(=O)(=O)C(F)(F)F)cc1)NNc1nc2ccccn2n1	790437984	FRKOZYGFSIPGMO-UHFFFAOYSA-N	444.395	1.728	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N1CC[C@@H](N2CCCC2=O)C1	791010460	VISURTLIPRAYOU-GXTWGEPZSA-N	439.310	1.654	50	20	IDGD	
CSSCCNC(=O)CCC(=O)N1CCN(S(=O)(=O)c2ccccc2)CC1	791149747	ABPKIVHOHSGURE-UHFFFAOYSA-N	431.605	1.427	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)c(F)cc1C	793024813	FNAHCNQDIAKUSO-QGZVFWFLSA-N	429.404	1.400	50	20	IDGD	
NC(=O)Cc1occc1C(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	794961509	YXVYOZBEWZCOQD-UHFFFAOYSA-N	445.439	1.084	50	20	IDGD	
O=C(CN1CCN([C@H]2CCN(Cc3ccccc3)C2)CC1)NNC(=O)c1ccc(F)cc1	796384266	NMFNEGHPAYCNTJ-QFIPXVFZSA-N	439.535	1.479	50	20	IDGD	
COC(=O)c1cc(F)cc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)c1F	797007259	PKFIESGHBSRVFR-UHFFFAOYSA-N	443.309	1.509	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNC(=O)C(=O)Nc1cccnc1-c1ccccc1	797368549	DGYWLHODIFHZML-UHFFFAOYSA-N	447.451	1.761	50	20	IDGD	
C[C@H](Sc1ccccc1C(=O)OCC(=O)NNC(=O)c1cccc(Cl)c1)C(N)=O	801490462	MBRHYCPQCFBNTF-NSHDSACASA-N	435.889	1.924	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)N[C@@H](C)CCNS(=O)(=O)c2ccccc2)cc1	801795835	FFYNSLLNXMVUKQ-INIZCTEOSA-N	448.545	1.715	50	20	IDGD	
COC(=O)N(C)NC(=O)C1CCN(S(=O)(=O)c2cccc(OC(F)(F)F)c2)CC1	804124182	BTMTWOUUFAZPBT-UHFFFAOYSA-N	439.412	1.715	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)c1csc(N2CCOCC2)n1)n1ccc2ccccc2c1=O	806338956	VUQYDWAEFUFZSY-ZDUSSCGKSA-N	427.486	1.317	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@](N)(c2cccc(F)c2)C(F)(F)F)c1	806444660	CIRGCWGVKDXRNH-INIZCTEOSA-N	433.383	1.407	50	20	IDGD	
CCN(C)C(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2ccc(OC)cc2OC)c1	806978825	LPXNOBXWXKKCRR-UHFFFAOYSA-N	428.445	1.195	50	20	IDGD	
Cc1ccc(F)c(NNC(=O)C(=O)N2C[C@@H](C[C@H]3COCC(=O)N3)c3ccccc32)c1	807014014	NYYJLZYSJGBCLW-CABCVRRESA-N	426.448	1.613	50	20	IDGD	
COc1ccc(C)cc1CCNC(=O)NNC(=O)c1sc(N2CCOCC2)nc1C	807018921	UZFCDMIRTYDFLC-UHFFFAOYSA-N	433.534	1.792	50	20	IDGD	
CN1CCN(C(=O)NNC(=O)c2ccc(=O)n(CCOc3ccccc3Cl)c2)CC1	807379039	RBKLEICGWDMJHB-UHFFFAOYSA-N	433.896	1.183	50	20	IDGD	
O=C(NCc1cnn2ccccc12)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	807463227	PZKQZWLJEQZIFG-UHFFFAOYSA-N	442.501	1.263	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCCCn2cc(Br)cn2)cc1OC	807612202	PGKUHQHGXRYZQF-UHFFFAOYSA-N	426.271	1.697	50	20	IDGD	
CN(C)CCN1C(=O)C(=NNC(=O)CCN2CCN(c3ccccc3)CC2)c2ccccc21	807944923	VPZQZMUEMLZOMZ-UHFFFAOYSA-N	448.571	1.627	50	20	IDGD	
O=C1COc2c(cccc2NC(=O)C(=O)NNC(=O)c2cccc(Br)c2)N1	810384766	PEXGZKUNNJAHIH-UHFFFAOYSA-N	433.218	1.180	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)C(=O)Nc1cc(C(N)=O)ccc1OCC(F)F)c1ccccc1	810386995	AQEMBKSSAHXRCZ-CQSZACIVSA-N	448.426	1.709	50	20	IDGD	
CC(C)S(=O)(=O)c1ccc(CC(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)cc1	812726736	KPRKSECKVASWBW-UHFFFAOYSA-N	439.559	1.805	50	20	IDGD	
NS(=O)(=O)c1ccc(NC(=O)NN=Cc2cc(Br)c3c(c2)OCO3)cc1	814966464	UIJBHEPVFQYHKK-UHFFFAOYSA-N	441.263	1.981	50	20	IDGD	
CCOCCCn1c(NNC(=O)c2ccc(C(=O)OC)n2C)nc2ccccc2c1=O	815604630	VTRAJQKFWSJMCF-UHFFFAOYSA-N	427.461	1.705	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCCCC2)cc1NC(=O)C(=O)NNc1ncncc1F	815763852	DLIKUVIRFWDLKE-UHFFFAOYSA-N	436.469	1.181	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2CCO[C@@H](c3ccccc3)O2)c1	816810228	DXHDVFNWZDFUPO-FXAWDEMLSA-N	433.486	1.202	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)Cc1cnn(-c2ccccc2)c1	818861890	XHNKSCYEHLEXQK-UHFFFAOYSA-N	426.502	1.478	50	20	IDGD	
C[C@H](NS(=O)(=O)c1ccc(Cl)cc1)C(=O)NNC(=S)NCCc1cccs1	825206601	KCLHAAXCHHQGIG-NSHDSACASA-N	447.007	1.806	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2nc(SC)ncc2Cl)cc1OC	825421125	HMAPUKCADSNZNW-UHFFFAOYSA-N	440.865	1.487	50	20	IDGD	
Cn1cnnc1SCC(=O)Nc1cccc(C(=O)NNC(=O)NC2CCCCC2)c1	836546161	YIVJQNILPBOWKI-UHFFFAOYSA-N	431.522	1.823	50	20	IDGD	
CN(Cc1ccccc1)S(=O)(=O)c1ccc(Cl)c(C(=O)N2CC[C@H](B(O)O)C2)c1	864234764	VQRQJELPQGNDAN-HNNXBMFYSA-N	436.726	1.850	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)c1cnc2c(c1)c(O)nc(=O)n2C1CC1	900314204	VXNMKEZLFDBYGA-UHFFFAOYSA-N	429.820	1.569	50	20	IDGD	
N#C/C(=C\c1cn(CCC(N)=O)nc1-c1cccc(Br)c1)C(=O)NCCCO	914531415	PXJJZOVQKRXTLD-NTEUORMPSA-N	446.305	1.594	50	20	IDGD	
Cc1ccc(OCC(=O)NN=C2CCN(S(=O)(=O)c3c(C)n[nH]c3C)CC2)cc1C	914554561	MPQHXWXBMOKMBY-UHFFFAOYSA-N	433.534	1.979	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)c1	914780625	XVRZRXNNPHKOPB-UHFFFAOYSA-N	431.449	1.541	50	20	IDGD	
CCOc1ccccc1C(=O)N1CCC[C@@H]1C(=O)OCC(=O)NNC(=O)c1ccccc1	915006307	TUCIVTRDLQEMBG-GOSISDBHSA-N	439.468	1.694	50	20	IDGD	
COc1cccc(C[C@@H](C(=O)NNC(=O)COc2cc(C)cc(C)c2)n2nnnc2C)c1	915695567	SBLCHURAOQUBPP-FQEVSTJZSA-N	438.488	1.617	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)N2CCC[C@H](CNS(C)(=O)=O)C2)c(C)n1C[C@@H]1CCCO1	915747461	UCGZYIYKJSONLB-SCNANUJSSA-N	448.589	1.979	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCCn2cnc3ccccc32)c1	915926428	LFIRPQTYBDNTBR-UHFFFAOYSA-N	444.517	1.321	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)NCc1ccccc1S(=O)(=O)N(C)C	916237879	SFTYUFHHWFKWIS-CYBMUJFWSA-N	438.481	1.374	50	20	IDGD	
CC(=NNC(=O)COc1ccc(C)c(C)c1)c1ccc(S(=O)(=O)N2CCNCC2)cc1	916297621	AORKGHPTZDPUKF-UHFFFAOYSA-N	444.557	1.817	50	20	IDGD	
O=C(COc1ccccc1Cc1ccccc1)NNC(=O)NC[C@@H]1CCS(=O)(=O)C1	916375177	MDLYFAMNQXSEHI-KRWDZBQOSA-N	431.514	1.421	50	20	IDGD	
O=C(Cc1cccc2ccccc12)NCC(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	917362897	QXHWRJGDFILSTE-UHFFFAOYSA-N	443.463	1.851	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)Nc3cc(C)on3)c2)c(O)c1	918337950	XUPHYGLOTYHKBO-UHFFFAOYSA-N	430.442	1.873	50	20	IDGD	
COCCNS(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(Cl)cc2O)c1	918359215	QHKBDKQBSKYVRU-UHFFFAOYSA-N	427.866	1.045	50	20	IDGD	
CCN1CCN(Cc2ccccc2CNC(=O)NNC(=O)Cc2ccccc2OC)CC1	919904054	RANOSKPPPKDTFR-UHFFFAOYSA-N	439.560	1.906	50	20	IDGD	
Cc1cc(N2CCC(NC(=O)NNC(=O)c3cncn3-c3ccccc3)CC2)nc(C)n1	1116212250	MLDABFHHEINACP-UHFFFAOYSA-N	434.504	1.892	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=S)NC[C@@H]2CCCCO2)c1	1116388387	KBLSNVUDKFPBIM-HNNXBMFYSA-N	428.580	1.395	50	20	IDGD	
CC(=O)NC[C@@H]1CCn2ncc(C(=O)NNc3nc(Br)cn4ccnc34)c2C1	1116776845	UCPYNTKUTPSAPE-LLVKDONJSA-N	447.297	1.144	50	20	IDGD	
CSCc1noc(CCC(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)n1	1319566924	ZJHBPZMEMJQDOF-UHFFFAOYSA-N	427.527	1.660	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)[C@H]2CC23CCS(=O)(=O)CC3)cc1	1323048581	MAGCRRDTVCAEPB-OAHLLOKOSA-N	449.558	1.083	50	20	IDGD	
O=C(Cc1c[nH]c2cnccc12)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	1324979864	NHNSNNNYEYJRPC-UHFFFAOYSA-N	440.935	1.724	50	20	IDGD	
CCCNC(=O)[C@@H](C)NC(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1	1341770819	YLJMYVSOJLQJHK-DYESRHJHSA-N	437.544	1.859	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3n[nH]c4c3CC[C@H]4C)C2)C1	1777845144	CVARCYALGIADMC-VPZZIHKRSA-N	439.354	1.934	50	20	IDGD	
COc1cc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)ccc1O	1781334403	NLANWXAUPDQAHA-PBHICJAKSA-N	431.258	1.535	50	20	IDGD	
CCc1noc(C)c1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCC(=O)NN(C)C)C1	1782212379	YYESQZWYHHWVBC-VGOFRKELSA-N	449.552	1.046	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H]3Cc4ccccc4N3)C2)C1	1782838050	WVMNNCDTUNDRPE-LIVBEALHSA-N	436.350	1.884	50	20	IDGD	
CN(C)CCC(=O)N1CCO[C@@]2(CCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1	1782864868	XXIKDLKKEMCORY-BVZCLVNKSA-N	432.471	1.653	50	20	IDGD	
COC(=O)C12CC(C(=O)N3CC[C@@]4(C3)CN(C(=O)[C@@](C)(Cl)CCl)CCO4)(C1)C2	1783444909	KIPWJYSKTYSNSU-MKCYZYCBSA-N	433.332	1.396	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)Cn3ccc4c(F)cccc43)CCO2)C1	1783870673	FHYMZKNDACQSFP-KKSFZXQISA-N	437.899	1.864	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3c(OC)cccc3OC)CCO2)C1	1783882618	QYTBQIBZVODCOT-JLTOFOAXSA-N	426.897	1.401	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc(F)cn3)C[C@@H]21	1783965242	DISKYROBLKWTEX-PYTWLRIVSA-N	442.329	1.774	50	20	IDGD	
C[C@](O)(C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCBr)[C@H]2C1)C(F)(F)F	1786400877	CFFFXMBKTGXGBW-RMIALFOJSA-N	431.249	1.064	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cn4ccccc4n3)[C@H]2C1	1787842028	SLBSKEMSGZQHIQ-YXWQFLTLSA-N	435.322	1.711	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc4ncccn34)[C@H]2C1	1788005401	IGJWJQMNLJKNSB-VODUFIJXSA-N	440.331	1.559	50	20	IDGD	
CC(C)(NCCC#N)C(=O)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1	1788029419	RYJAMBDVQHDJGJ-UHFFFAOYSA-N	448.332	1.396	50	20	IDGD	
C[C@@H](C(=O)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1)C1(O)CCC1	1788140541	WFXFUPYVLPFXKY-INIZCTEOSA-N	436.317	1.665	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3c[nH]c4nccc-4c3)C[C@@H]21	1788765288	YNGYJASUMPIHSF-SZMVWBNQSA-N	430.581	1.959	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ncccc3F)[C@H]2C1	1789051002	PULLCYRMROEOSC-ABHRYQDASA-N	428.302	1.845	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)c3ccccc3)C[C@@H]21	1789866905	ZPHPCOCXPAYXNY-RXBWTVHKSA-N	429.344	1.936	50	20	IDGD	
COc1cnc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]3C2)c(F)c1	1789922121	HTQOFSAWJUDXTK-YARBFKLUSA-N	448.264	1.513	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)[C@H]1CCc2cccc(Cl)c21	1790688352	DAWAQQFTGQDHPW-OIDVLUPKSA-N	441.355	1.949	50	20	IDGD	
CCC[C@@H](NC(C)=O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](Br)CC)[C@H]2C1	1790963257	ARRUPZVZMLKXLP-SIRPWMCASA-N	446.386	1.444	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccn4ccnc34)C[C@@H]21	1791056121	OGJOVVPNOVZIFB-VRKREXBASA-N	435.322	1.711	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)Oc3cccnc3)C[C@@H]21	1791256908	YNBJUEQQHFAOFT-KSIDHJATSA-N	425.913	1.082	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)Cc1ccccn1)C2	1792872145	NVTDLUGVROQCSB-MAPUTHEBSA-N	438.366	1.881	50	20	IDGD	
COc1ccccc1C(=O)N1CC(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](O)CCl)C3)C1	1792907363	GPQKXOFVQBLIDC-DFGXFYAUSA-N	449.935	1.005	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H]2C[C@H]2C[C@@H]1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCl	1793117665	XDXDPANEWCGADG-OPCFMFSHSA-N	441.956	1.622	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cccc(Cl)n1	1794193807	JDQJJUSQUZICDU-JRATXPSKSA-N	444.757	1.898	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(N2CCOCC2)cn1	1794441051	FDAAFKGSZRVGGR-HIRMHNASSA-N	436.940	1.139	50	20	IDGD	
CCOC(=O)c1ncn2c1CC[C@H](C(=O)N[C@@H]1C[C@@H]3CC[C@H](C1)N3C(=O)[C@H](F)Cl)C2	1796811268	MOJVBLUBSDCEKR-LHLGERLTSA-N	440.903	1.795	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cn3c(F)cccc3n1)C2	1797957708	YVWJPNPUKRCRNG-HBCWATKFSA-N	434.544	1.528	50	20	IDGD	
COc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCBr)C3)c(O)c1	1798833926	WWEMFIVVBKYBCD-DPIQGUFMSA-N	427.295	1.389	50	20	IDGD	
N=C(N)NCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCCCCCCCCCCl	1799223835	CIBMOAMEKULCMJ-XEMDLRDOSA-N	444.020	1.809	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1=C3c4ccccc4C(=O)N3CC1)C2	1799268883	MVYRPXKLFQAUPM-FTUNRGFVSA-N	443.931	1.864	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c[nH]c3nccc-3c1)C2	1799275428	RMGMUCOPFSUOJE-YGTYGHESSA-N	425.316	1.954	50	20	IDGD	
C[C@H](Cc1ccncc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)CBr)C2	1800191050	QJRTZAHRDUWYFX-QKGUJMCYSA-N	438.366	1.881	50	20	IDGD	
CO[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)Br)c1ccccc1	1800757097	ULPUGVVVZWFVJU-CMZRPVNOSA-N	425.323	1.747	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cn1cnc2ccccc21	1800889817	UMYKLPNLSVOVDB-ZUMXRPEOSA-N	435.322	1.409	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(OC)cc(OC)c1F)C2	1800978363	BJXPPLRXUBYQBS-ABXQLRGKSA-N	444.887	1.300	50	20	IDGD	
COC[C@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C[C@H](O)CNC(=O)OC(C)(C)C)C2	1802282830	IMUQVBQIIMFPRS-QRJUGERDSA-N	447.960	1.154	50	20	IDGD	
CC(C)[C@H](S)C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1803599288	WLFKABWXWKWJQP-SXLOBPIMSA-N	441.362	1.035	50	20	IDGD	
COc1cc(C(=O)NC[C@H]2CCN(C(=O)CO[Si](C)(C)C)[C@@H]2c2cccnc2)n(C)n1	1804923577	LJKRZDVUFBGJPA-OXQOHEQNSA-N	445.596	1.995	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@H]1C(=O)N1CCC2(CCCN(C(=O)[C@@H](O)CCl)C2)CC1	1805528697	XJSIXAWPRNQIDP-ZACQAIPSSA-N	426.941	1.573	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@H](CNC(=O)CN)[C@H]1c1cccnc1	1807041685	IRCZVOIMPLYTJA-FBVTXZAOSA-N	425.439	1.931	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@H]1CCN(C(=O)c2cnc(O)nc2O)[C@@H]1c1cccnc1	1810540580	FQNDBKLXGYQFSA-RHSMWYFYSA-N	445.552	1.454	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)CCS(C)(=O)=O)[C@H]1c1cccnc1	1812868196	UFYGDWGALLAJEP-NOLJZWGESA-N	446.367	1.306	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)N1CC[C@H](CNC(=O)[C@H](Cl)COC)[C@@H]1c1cccnc1	1813030648	FFQRJRVTNLYAPA-DZUCGIPZSA-N	439.944	1.049	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2ccccc2F)[C@H]1c1cccnc1	1813072678	IYAPYGKDDPSNPA-JTSKRJEESA-N	441.507	1.913	50	20	IDGD	
O=C(/C=C/c1ccoc1)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1	1815350194	JOECXCYPQFLRAZ-RRGWEWPQSA-N	437.286	1.355	50	20	IDGD	
CC(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)[nH]n1	1817021753	OAFDHVBKGFNANR-SFHVURJKSA-N	427.509	1.768	50	20	IDGD	
CC(=O)OC[C@H](OC(C)=O)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](F)Cl)[nH]n1	1819430725	BJTSJJCINAYBLD-YDHLFZDLSA-N	432.836	1.431	50	20	IDGD	
Cn1c(C(=O)N[C@H]2CCc3nc(NC(=O)CO[Si](C)(C)C)sc3C2)cccc1=O	1820160978	MQVZDPHOEKPPIZ-LBPRGKRZSA-N	434.594	1.919	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](O)N2CCOCC2)[nH]n1	1820865832	CFAGVTPEHDTYCB-SIIHOXLZSA-N	448.351	1.289	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)CCN2CCOC2=O)[nH]n1)[C@@H](F)Br	1820933102	AEKJAUWGSHMGJV-BXUZGUMPSA-N	446.277	1.935	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](N)CCC(N)=O)[nH]n1	1822087661	MVNLYUKEJRXSMR-GVXVVHGQSA-N	443.346	1.168	50	20	IDGD	
C[C@H](Cn1cccn1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1	1822410222	BZADUPVFBOCCHR-NVXWUHKLSA-N	444.540	1.308	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](O)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](F)Cl)CC2	1823565641	DLCIBEQXVAVPSX-JVQVWZCXSA-N	436.893	1.433	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@H]1CCc2nc(NC(=O)[C@H](C)n3ccnn3)sc2C1	1824680519	ZNCIGPYSHSHODB-VWYCJHECSA-N	441.355	1.939	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC([C@H]2CCCCN2C(=O)Cn2cnnn2)CC1	1827198595	DQIBYGAOWDPHNC-LSDHHAIUSA-N	427.347	1.466	50	20	IDGD	
CC[S@@](=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1	1828786611	UMKCIHHPOYIGPN-VPTFNQTCSA-N	442.626	1.138	50	20	IDGD	
CN(C)C(=O)NCC(=O)N1CCC([C@H]2CCCCN2C(=O)[C@H](F)Br)CC1	1830378166	CJZONRLKBJHQHO-HIFRSBDPSA-N	435.338	1.568	50	20	IDGD	
Cc1ccoc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)CBr)CCO2	1830538752	OWCBPJZVOFGXCT-KDOFPFPSSA-N	429.311	1.689	50	20	IDGD	
CCCOc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)cc1	1830733849	VSSQJNDHPOYQFJ-WIYYLYMNSA-N	440.924	1.145	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccnn3C(C)C)C2)C1	1831649711	ANDOJFGZUCEPEF-UZLBHIALSA-N	426.945	1.942	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1831654966	ZISLLDJTZYUHFI-YWPYICTPSA-N	429.714	1.541	50	20	IDGD	
Cc1ccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)cn1	1833131872	VOCQIHJTIQAPHP-OAQYLSRUSA-N	435.597	1.240	50	20	IDGD	
CC(=O)N[C@@H](C)C(=O)N1CCC(N2CCC(NC(=O)[C@H](C)CBr)CC2)CC1	1833265001	UWNXXUJEGXPEOG-KGLIPLIRSA-N	445.402	1.114	50	20	IDGD	
Cc1ccc(CCC(=O)NC2CCN(C3CCN(C(=O)[C@H](O)CCl)CC3)CC2)nc1	1833823016	ASQAXVIWMTXTKA-HXUWFJFHSA-N	436.984	1.494	50	20	IDGD	
Cc1cccc(CC(=O)N2CCOC[C@]3(CN(C(=O)CCBr)CCO3)C2)n1	1834819394	NXWBRCUUYMJQLQ-IBGZPJMESA-N	440.338	1.174	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3ccn4cncc4c3)CC2)CC1	1835606717	YVIQGKRUYNZQTN-FQEVSTJZSA-N	447.967	1.773	50	20	IDGD	
CC(C)N[C@@H](C(=O)N1CCO[C@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1)C(C)C	1835897517	DJKJDJJOECQIGK-CTNGQTDRSA-N	443.661	1.317	50	20	IDGD	
COc1ncc(C(=O)N2CCC(OC3CCN(C(=O)[C@H](O)CCl)CC3)CC2)cc1F	1836714910	CBKXJQRYTAJMTM-QGZVFWFLSA-N	443.903	1.441	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cnc(N(C)C)o3)CC2)CC1	1837387937	CUEZCEDGSBWKQY-MRXNPFEDSA-N	442.944	1.607	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ncccc3F)CCO2)C1	1838252641	ZWGUWXFCSDZSEQ-PXAZEXFGSA-N	430.274	1.074	50	20	IDGD	
C/C(=C/C(=O)N1CCC(OC2CCN(C(=O)[C@@H](F)Br)CC2)CC1)C(=O)O	1838649270	AQKODNZXKSKFNJ-JQPIKURYSA-N	435.290	1.706	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(Cl)cc3)CCO2)C1	1838960236	CADIYWVDOBZAGS-QFBILLFUSA-N	431.316	1.664	50	20	IDGD	
O=C(CC12CCCN1CCC2)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1839119018	COPVSYQTNNKEKN-IBGZPJMESA-N	434.364	1.265	50	20	IDGD	
O=C(c1coc(Cl)n1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839198060	RNGLOGFAWHMFQC-HZMBPMFUSA-N	440.653	1.089	50	20	IDGD	
O=C(Cc1ccc(F)cc1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839198723	APEDKLWMZBKZRS-WMZOPIPTSA-N	447.276	1.515	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)ccc1O	1839201753	IFJIJRQIDKQDTB-YJBOKZPZSA-N	445.285	1.461	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc4c(c3)C(=O)CC4)CCO2)C1	1839528801	NCRDPQNMKSYKEO-AVRDEDQJSA-N	434.920	1.903	50	20	IDGD	
C[C@H](Cc1ccncc1)C(=O)N1CCO[C@@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1	1839659612	QNGLOUSQUFRLLR-XMSQKQJNSA-N	449.624	1.568	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccnn3CC)C2)C1	1839963156	BICOKHCIYOZDQG-RDTXWAMCSA-N	443.342	1.147	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cn3cnc4ccccc43)CCO2)C1	1840100883	LZJJPKUXUZTZHN-HTAPYJJXSA-N	448.951	1.900	50	20	IDGD	
CC(C)(C)c1ccc(C(=O)N2CC3(CCCN3C(=O)c3cccc(B(O)O)c3)C2)s1	1843013723	FCSWLYYELBPSEW-UHFFFAOYSA-N	426.347	1.856	50	20	IDGD	
CC(C)Oc1ccc(C(=O)N2CC3(CCCN3C(=O)c3cccc(B(O)O)c3)C2)cc1C#N	1843015756	XRGZZXXDRZYFBW-UHFFFAOYSA-N	447.300	1.156	50	20	IDGD	
CCc1nc2ccc(Cl)cn2c1C(=O)N1CCCC12CN(C(=O)[C@@H](O)CCl)C2	1843310590	UKJBBALLZGPFNC-AWEZNQCLSA-N	425.316	1.967	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)C1	1845038326	PTUFRPDNBSAQPS-SFHVURJKSA-N	449.983	1.944	50	20	IDGD	
Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC12CN(C(=O)CCC(=O)NN(C)C)C2	1845494175	UMSWTZJGBUCHLY-UHFFFAOYSA-N	435.456	1.232	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC12CN(C(=O)C1(N3CCN(C)CC3)CC1)C2	1846071708	INEJXCOZEJIQCZ-HNNXBMFYSA-N	427.387	1.143	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CCC[C@H](C(=O)N2CCCC23CN(C(=O)[C@H](O)CCl)C3)C1	1846355771	GWBYXPKVHKHQHA-ARFHVFGLSA-N	443.972	1.873	50	20	IDGD	
COc1cc(Br)ccc1CC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl	1847564075	QDKSCAUOCLNAIL-KKUMJFAQSA-N	445.741	1.802	50	20	IDGD	
CC(C)CCSc1ccc(C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)cc1[N+](=O)[O-]	9930722	CBHFWQXWLVZCAX-CYBMUJFWSA-N	429.520	1.929	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)CNC(=O)c1cnc2ccccc2c1O	107931527	CIIKVFYLEXRMGT-UHFFFAOYSA-N	428.832	1.793	50	20	IDGD	
CNS(=O)(=O)c1cccc([C@@H](C)NC(=O)NNC(=O)c2ccc(OC)c(OC)c2)c1	727610911	XEHRDEKZJFCNHD-GFCCVEGCSA-N	436.490	1.317	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)C2CCC3(CC2)NC(=O)NC3=O)cc1OC	727764736	JJOAOZYEUKEVKG-UHFFFAOYSA-N	432.477	1.404	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)N[C@H](CN2CCN(C)CC2)c2ccccc2)c1	727843788	SUPVKUAOUGZNOP-OAQYLSRUSA-N	425.533	1.693	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)CCc2c(C)nc3c(C(N)=O)cnn3c2C)c(C)c1	728205061	IUJCBUKOJAOCJG-UHFFFAOYSA-N	437.504	1.254	50	20	IDGD	
COc1cc(S(=O)(=O)NNC(=O)c2cccc(OC(F)F)c2)cc(C(=O)O)c1OC	728510912	YATNXWPQIKHPHY-UHFFFAOYSA-N	446.384	1.627	50	20	IDGD	
CC(C)(C)CC(=O)NNC(=O)C1CCN(c2ccc3nnc(C(F)(F)F)n3n2)CC1	728608197	PKDKLRMRAVQYSG-UHFFFAOYSA-N	427.431	1.943	50	20	IDGD	
CC(=O)N1C=Cc2ccccc2[C@H]1CC(=O)NNC(=O)C1CCN(c2ncccn2)CC1	728847461	GLKUZEVKCWQPAM-HXUWFJFHSA-N	434.500	1.805	50	20	IDGD	
O=C(COC(=O)Cc1csc(-c2ccccn2)n1)NNC(=O)c1cccc([N+](=O)[O-])c1	729820216	IHIDIFKQKUIPMK-UHFFFAOYSA-N	441.425	1.660	50	20	IDGD	
CS(=O)(=O)Nc1cccc(CC(=O)NNC(=O)c2ccc(F)cc2Br)c1	730210933	HBYDDMYIWWTBBZ-UHFFFAOYSA-N	444.282	1.963	50	20	IDGD	
Cc1cccc(N2C(=O)N[C@@H](CCC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)C2=O)c1	730734593	DTTWYTCMNDDJOZ-INIZCTEOSA-N	425.401	1.569	50	20	IDGD	
O=C(CC[C@H]1NC(=O)N(c2ccc(Cl)cc2)C1=O)NNC(=O)COc1ccccc1O	730778608	JAWWYJWKAGKPFG-CQSZACIVSA-N	446.847	1.477	50	20	IDGD	
O=C(CN1CCN(CC(=O)N2CCCc3ccccc32)CC1)NNC(=O)c1cccs1	731355997	NBKQXYSCZVBFAP-UHFFFAOYSA-N	441.557	1.106	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)N1CCN(CC(=O)N(C)C2CCCCC2)CC1	731500830	PQBOKAYXIVFSEB-UHFFFAOYSA-N	431.537	1.458	50	20	IDGD	
COc1ccc(-c2nnc(S)n2CC(=O)NNc2ccccc2S(C)(=O)=O)cc1	732302561	JPSHDEDYQRBZMO-UHFFFAOYSA-N	433.515	1.789	50	20	IDGD	
CNS(=O)(=O)c1cccc(CNC(=O)NNC(=O)NCc2ccc(Cl)cc2)c1	732992100	RKGRWRPTOXYKMS-UHFFFAOYSA-N	425.898	1.462	50	20	IDGD	
Cc1cc(S(=O)(=O)NNC(=O)CNC(=O)c2ccco2)c(C)cc1Br	735026847	DNHXKLXSEXSSQR-UHFFFAOYSA-N	430.280	1.398	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)C(F)(F)c2ccccc2)CC1	735117328	RCIOARABAVFYKA-UHFFFAOYSA-N	425.461	1.253	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1Br	739734868	YQOUYEYYZFVDJW-UHFFFAOYSA-N	446.258	1.826	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)c2cc(OCc3ccccc3)ccn2)c2ccccc2c1=O	742474850	YNCWIXBAZAHGSK-UHFFFAOYSA-N	429.436	1.982	50	20	IDGD	
O=C(CN1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O)NNc1c(F)cc(F)cc1Br	742709018	UBQMPJQOEHRYQX-WFFHOREQSA-N	430.205	1.333	50	20	IDGD	
COc1ccc(CC[C@@H](C)NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1	743340854	CONPRLKMDSNXCV-OAHLLOKOSA-N	448.545	1.911	50	20	IDGD	
C[C@@H]1CN(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)CCN1C(=O)OC(C)(C)C	743589235	RHANKMBSPJGQKB-OAHLLOKOSA-N	447.540	1.375	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2ccc(C#N)c(Cl)c2)c2ccccc2c1=O	743737844	DRLFXIQZHYNJQN-UHFFFAOYSA-N	438.831	1.341	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)c2ccc(S(N)(=O)=O)cc2)cc1Cl	743833916	MDMACUZTRSXBJJ-UHFFFAOYSA-N	428.854	1.471	50	20	IDGD	
O=Cc1ccc(OCCC(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)cc1	744620131	DCCFWBAOHOHKSQ-UHFFFAOYSA-N	433.486	1.432	50	20	IDGD	
Cc1ccc([C@@H](NC(=O)NNC(=O)c2cnn(C)c2)c2cccc(S(C)(=O)=O)c2)cc1	745908692	NJBQFSCBJXHLON-LJQANCHMSA-N	441.513	1.866	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)[C@@]1(O)CCN(Cc2ccccc2)C1	746094818	SWTAUEXSKJSLTO-HXUWFJFHSA-N	448.317	1.612	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)c1cc2c(s1)CC[C@@H](C)C2)N1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O	746100486	NBXQXRWOAMQMAM-QGEZMENXSA-N	431.514	1.185	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)[C@H](Cc1ccccc1)NC(=O)c1cccnc1	746636998	JSWGBYVZWRAWMJ-FQEVSTJZSA-N	442.479	1.461	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)NCc1ccccc1NS(=O)(=O)c1ccccc1	747584789	GLNWSJQNMODEDD-UHFFFAOYSA-N	439.497	1.956	50	20	IDGD	
Cc1nc(Cl)cc(NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)n1	747981951	MUFFOIYQNFNQGD-UHFFFAOYSA-N	439.925	1.535	50	20	IDGD	
C[C@H](C(=O)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1)N1C(=O)[C@H]2CCCC[C@@H]2C1=O	748519939	FTSXDIBBDUPHKA-SWHYSGLUSA-N	447.435	1.987	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)NCCCOC2CCN(Cc3ccccc3)CC2)n1	748971344	SCBASPOTFIZMSH-UHFFFAOYSA-N	442.564	1.902	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(=O)n(CC(=O)NNC(=O)c2cc3ccccc3o2)c1	749467348	GPACFNPEJBXWLK-UHFFFAOYSA-N	446.485	1.086	50	20	IDGD	
Cn1c2ccccc2n2c(SCC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)nnc12	751139578	LWXRXUDBWGAAFL-UHFFFAOYSA-N	425.430	1.683	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)c1cccc(NC(=O)CCn2ccnc2)c1	751206077	BCIUYTUARBBZGV-UHFFFAOYSA-N	440.485	1.164	50	20	IDGD	
CC[C@H](CS(=O)(=O)c1ccccc1)NC(=O)NNC(=O)c1ccc2c(c1)OCCO2	752702952	GQPLTVFKKUBGEV-OAHLLOKOSA-N	433.486	1.654	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)c1nc(Cc2ccccc2)no1	753039653	UOGSGYWKCFNVSA-CYBMUJFWSA-N	433.432	1.341	50	20	IDGD	
O=C(CO)NNC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc2ccccc2c1	753451390	DQLRTBUHNMJQNV-OAQYLSRUSA-N	430.464	1.802	50	20	IDGD	
N#Cc1ccc(CN2CC[C@@H](NC(=O)NNC(=O)Cc3c[nH]c4ccccc34)C2=O)cc1	753722819	LAPADXIFQMWSKY-HXUWFJFHSA-N	430.468	1.714	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN[C@H](C)c2nc(Cc3ccccc3)no2)cc1OC	755101581	KLQIWXREVAXRNN-CQSZACIVSA-N	439.472	1.789	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NN=Cc1cc(F)ccc1O	755490292	MEOHECFTTBVASD-UHFFFAOYSA-N	435.477	1.635	50	20	IDGD	
CN1CCC/C1=N/S(=O)(=O)c1cccc(NC(=O)NNC(=O)c2cccc(C#N)c2)c1	756032333	SLZGSDKPKIQRIU-BWAHOGKJSA-N	440.485	1.838	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)Nc1cccc(OCCS(C)(=O)=O)c1	756298521	XXWGUAYIMVTVGP-CYBMUJFWSA-N	439.465	1.869	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2ccc3c(c2)NC(=O)CC3)cc1	756746231	ISNXHNAMJDGAJB-UHFFFAOYSA-N	445.501	1.353	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(C(=O)NNc2nc(-c3ccccn3)nc3c2CCC3)co1	756780511	ZWQDGVDOYOOHNN-UHFFFAOYSA-N	428.474	1.628	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)Nc1ccc(S(=O)(=O)NCC2CC2)cc1	756786058	XBOWEYANCWLCAZ-UHFFFAOYSA-N	432.458	1.570	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)Nc1ccn(-c2ccc(Cl)cc2Cl)n1	757893225	YRWWBFAWZKQXTQ-SECBINFHSA-N	432.289	1.767	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H]1CCc2ncc(NC(=O)NNC(=O)c3cnccn3)cc2C1	757929326	QEXGZJMBZOHUGO-ZDUSSCGKSA-N	427.465	1.720	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N[C@H]2CN(C(=O)OC(C)(C)C)C[C@H]2C#N)c(OC)c1	758757142	FYGVZZYIFFQGLE-DOMZBBRYSA-N	433.465	1.407	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2C(F)(F)F)cc1O)C(=O)Nc1ccccn1	759098386	CQRAZWFIMRBIKB-UHFFFAOYSA-N	434.334	1.391	50	20	IDGD	
Cn1ncc(C(=O)NNC(=O)COc2ccc(Br)cc2)c1Br	760163629	MTNMWMGGLFVIGM-UHFFFAOYSA-N	432.072	1.785	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)CCc2nc(C3CCCC3)no2)cc1	761783982	KXNZUXFEPANQIU-UHFFFAOYSA-N	449.533	1.436	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)c2cc(S(=O)(=O)N3CCC[C@H](C)C3)cn2C)n1	762907028	BWORVWBCYFHNIL-HNNXBMFYSA-N	449.581	1.839	50	20	IDGD	
O=C(NNC(=O)c1cc2ccccc2cc1O)C(=O)Nc1ccn(-c2ncccc2F)n1	763526544	HWFNKFKKGQPNOS-UHFFFAOYSA-N	434.387	1.665	50	20	IDGD	
COc1cc(F)ccc1NC(=O)C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	763531547	OUMLPYKJPWPGIE-UHFFFAOYSA-N	443.479	1.133	50	20	IDGD	
C[C@H]1CN(C(=O)c2ccc(NC(=O)C(=O)NNC(=O)c3ccccc3F)cc2)C[C@@H](C)O1	763560974	GWWJGXJSDRRGBB-OKILXGFUSA-N	442.447	1.475	50	20	IDGD	
C[C@@H](C(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2ccccc2F)c1)n1cccn1	763561386	ISAPJZJIJWRQEH-ZDUSSCGKSA-N	438.419	1.622	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)Nc1cccc(OC2CCCC2)c1	763569798	CBQAYHLNIQBNKO-LJQANCHMSA-N	425.441	1.934	50	20	IDGD	
Cc1cc(N(C)C)ccc1NC(=O)C(=O)NNC(=O)COc1ccc(Br)cc1	763695116	OZFVHXQDSMPKLA-UHFFFAOYSA-N	449.305	1.988	50	20	IDGD	
Cn1c(=O)oc2c(NC(=O)C(=O)NNC(=O)CSc3ccc(Cl)cc3)cccc21	763735351	NXMLTYPKKFKVHH-UHFFFAOYSA-N	434.861	1.663	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)C(=O)Nc2cccc(Br)c2)c2ccccc2c1=O	763790475	IZAVTSMFNPMOTN-UHFFFAOYSA-N	444.245	1.096	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)C(=O)Nc1ccc2nc(C3CC3)oc2c1	763804108	KNFGMUSXCGIXSH-UHFFFAOYSA-N	439.384	1.778	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])cc1OC(F)F	763804433	SEUPRDZUNKHVGJ-UHFFFAOYSA-N	438.343	1.670	50	20	IDGD	
N#Cc1c(F)cccc1-n1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)n1	763843393	QEQCJAKUSXDRBA-UHFFFAOYSA-N	440.366	1.187	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cc(OC)c(OC)cc2F)cc1	763862199	VLMPOJDGCYBYNE-LBPRGKRZSA-N	449.435	1.795	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccnn2-c2ccccc2)cc1	763862403	WWMHAPSTSVUZGP-OAHLLOKOSA-N	437.456	1.824	50	20	IDGD	
CS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccc(F)cc2)cc1Cl	763920162	GQYSGYZVHHGAEV-UHFFFAOYSA-N	442.856	1.179	50	20	IDGD	
Cc1nnc(-c2cccc(NC(=O)C(=O)NNC(=O)c3cc(Cl)ccc3O)c2)n1C	763974140	LNPWSQUOCOSFIA-UHFFFAOYSA-N	428.836	1.549	50	20	IDGD	
Cc1ccc(Cn2nccc2NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)o1	763995852	RKRHFOKVBYAAGY-UHFFFAOYSA-N	435.238	1.323	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1ccc(OC[C@@H]2CCCO2)cc1	764003236	ADOBHUWKPQJPJE-KRWDZBQOSA-N	441.440	1.415	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1ccc(F)c(C(=O)N(C)C)c1	764012032	MURCWVSILXUOIJ-UHFFFAOYSA-N	436.827	1.589	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(OCC3CC3)cc2)c1	764076647	DJSQTSRKLDKXTE-UHFFFAOYSA-N	431.470	1.279	50	20	IDGD	
CN1CCN(c2ccccc2NC(=O)C(=O)NNC(=O)Cc2ccc3ccccc3c2)CC1	764081903	LUAOOWUAXDQODH-UHFFFAOYSA-N	445.523	1.920	50	20	IDGD	
CN(C1CCCCC1)S(=O)(=O)c1cccc(NC(=O)C(=O)NNC(=O)CC2CC2)c1	764143002	NGBQIHFDFKEUQS-UHFFFAOYSA-N	436.534	1.526	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)c(OC[C@@H]2CCCO2)c1	764163796	MLJPMUSXCBUHKQ-JXFKEZNVSA-N	439.468	1.642	50	20	IDGD	
COCC(=O)NNC(=O)C(=O)Nc1ccc(CN2CCN(c3cccc(C)c3)CC2)cc1	764300591	TZDCGZFGYVWLMU-UHFFFAOYSA-N	439.516	1.050	50	20	IDGD	
C[S@](=O)Cc1ccccc1NC(=O)C(=O)NNC(=O)C(F)(F)Oc1ccccc1	764379285	VEMUOBYKHWNMRN-LJAQVGFWSA-N	425.413	1.323	50	20	IDGD	
COC(=O)c1csc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)c1	764388003	PFCMHZMMLUMSMV-UHFFFAOYSA-N	431.405	1.464	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)C(=O)Nc1cccc(CN2C[C@H](C)O[C@H](C)C2)c1	764389742	WPMPMSKKYDLLMO-IYBDPMFKSA-N	425.489	1.399	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)C(=O)Nc1ccc(NC(=O)C2CC2)nc1	764404534	KXSFITKRHIKSKS-UHFFFAOYSA-N	429.458	1.014	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)nc(O)n2CC(F)(F)F)c1ccc(-n2cnnn2)cc1	764580628	WBVZMKPZWHPDHR-UHFFFAOYSA-N	446.349	1.355	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NN=C(Cc1ccc(Br)cc1)C(F)(F)F	764686252	FQWVLNGUNBSOEA-QMMMGPOBSA-N	430.246	1.964	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)c1ccc(=O)n(-c2ccccc2F)n1	766209227	DXKREGVGDARJFV-UHFFFAOYSA-N	438.415	1.227	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)N[C@@H]2CCC[C@@H]2C(=O)NC)c2ccccc2c1=O	766282909	CKHZUTGERKCVLC-JKSUJKDBSA-N	428.493	1.055	50	20	IDGD	
C[C@H](Sc1ccccn1)C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	766656296	YVIQFPSPIJVXET-INIZCTEOSA-N	427.530	1.168	50	20	IDGD	
O=C(Cc1ccc([N+](=O)[O-])cc1)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	766663643	KYVQZVSYWYVGHE-UHFFFAOYSA-N	445.907	1.756	50	20	IDGD	
CC(C)OCCCn1c(NNC(=O)C(=O)N2CCC[C@H](C)C2)nc2ccccc2c1=O	767922003	NDQXTEWOYVFMDR-INIZCTEOSA-N	429.521	1.913	50	20	IDGD	
Nn1c(SCC(=O)NNC(=O)c2cccs2)nnc1-c1cc(-c2ccccc2)[nH]n1	768441600	PTLKHWMWHKOWAJ-UHFFFAOYSA-N	440.514	1.664	50	20	IDGD	
Cc1cnn(Cc2ccccc2F)c1NC(=O)C(=O)NNC(=O)c1ccc(Cl)nc1	769267441	SGAKGBPVKSYFFK-UHFFFAOYSA-N	430.827	1.827	50	20	IDGD	
COC(=O)c1ccc(S(=O)(=O)NNC(=O)[C@H](C)Oc2ccc3ccccc3c2)cn1	769627123	QRZCCTWKBWVMQE-ZDUSSCGKSA-N	429.454	1.798	50	20	IDGD	
C[C@]1(c2ccc(F)c(Cl)c2)NC(=O)N(CC(=O)NNC(=O)NC2CCCCC2)C1=O	770212450	PIEAXSOYQLVKDL-LJQANCHMSA-N	439.875	1.909	50	20	IDGD	
COC(=O)N1CC(NC(=O)NNC(=O)COc2ccc(OCc3ccccc3)cc2)C1	770428333	MDYDAKKFOJIYSH-UHFFFAOYSA-N	428.445	1.425	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)[C@H](NS(C)(=O)=O)C(C)(C)C)cc1OC	770645210	RRZXOTYMJYNLCK-INIZCTEOSA-N	429.539	1.599	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)[C@]3(C(F)(F)F)CCN(Cc4ccccc4)C3)nc21	770992930	XVLTWLISRLUMPK-SFHVURJKSA-N	435.410	1.967	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)Cc1ccccc1I	771268151	UICQYFPVMREOKQ-UHFFFAOYSA-N	434.237	1.872	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	771884178	YSISKCOINOOVBE-AWEZNQCLSA-N	433.486	1.268	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)N[C@H]1CCN(c2cccc(Br)c2)C1=O	772352252	ADJUTHABHMQJAS-HNNXBMFYSA-N	432.278	1.523	50	20	IDGD	
CC(C)c1nccnc1NNC(=O)c1cc(S(=O)(=O)N(C)C)ccc1N1CCOCC1	772832750	GDUWBFMNYCOXSP-UHFFFAOYSA-N	448.549	1.444	50	20	IDGD	
COc1cc(Br)c(S(=O)(=O)NNC(=O)NC2CCCC2)cc1C(=O)O	772854898	CJYWYBQIFFBBEI-UHFFFAOYSA-N	436.284	1.591	50	20	IDGD	
COc1ccc(O)c(S(=O)(=O)NNC(=O)c2ccc(OC)c(Br)c2)c1	775672891	UAPXXCVHYSWZFE-UHFFFAOYSA-N	431.264	1.795	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)N2CCN(S(C)(=O)=O)[C@@H](C)C2)c(C)n1C[C@H]1CCCO1	776438334	AIXYHOCIMDZLAR-ABCQUNSGSA-N	434.562	1.683	50	20	IDGD	
COc1cccc([C@@H]2[C@H](C(=O)NNC(=O)COc3ccccc3O)CC(=O)N2C2CC2)c1	776475916	OEZLDXABQNEEAM-VGOFRKELSA-N	439.468	1.679	50	20	IDGD	
COc1cc(OC)cc(N2CC[C@H](N(C)CC(=O)NNC(=O)c3cccs3)C2=O)c1	777616902	VALSWCYRPWAZRO-INIZCTEOSA-N	432.502	1.264	50	20	IDGD	
Cc1nn(CC(C)C)c(C)c1CCC(=O)N1CCN(S(=O)(=O)CBr)CC1	777779911	TXRVMSMWYSECBH-UHFFFAOYSA-N	449.415	1.915	50	20	IDGD	
COCC1(C(=O)NNC(=O)c2cccc(S(=O)(=O)Nc3ccccc3OC)c2)CC1	778522191	QBJOWDLTOPNXHN-UHFFFAOYSA-N	433.486	1.684	50	20	IDGD	
COC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(NC(=O)NNC(=O)C(C)C)cc2)C1	782549983	MPOAETMDNJHWNF-CYBMUJFWSA-N	426.495	1.069	50	20	IDGD	
Cc1ccc(-c2ncccc2NC(=O)C(=O)NNC(=O)COc2ccccc2O)s1	782701710	ALLVHRSVYLXWOF-UHFFFAOYSA-N	426.454	1.989	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2Cl)cccc1-n1cnnn1	782924989	GBBCIEMXOGATDP-UHFFFAOYSA-N	434.243	1.677	50	20	IDGD	
COCCOC(=O)c1c(NC(=O)C(=O)NNc2cc(C)cc(C)c2)sc(C(N)=O)c1C	783357371	RMFYNEGHPRETDP-UHFFFAOYSA-N	448.501	1.657	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNc2ccc(-n3cccn3)nn2)c(OC(F)F)c1	783433366	RHTNTUXRKXIJAX-UHFFFAOYSA-N	447.358	1.132	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(F)c(NC(=O)C(=O)NNc2ccc(OC(F)F)cc2)c1	784311446	UVSNUFZOQUHIDJ-UHFFFAOYSA-N	446.407	1.759	50	20	IDGD	
CN(C1CCCCC1)S(=O)(=O)c1ccccc1NC(=O)C(=O)NNc1cccnn1	784862963	QZVLVMRZOQJRSK-UHFFFAOYSA-N	432.506	1.512	50	20	IDGD	
COCCCS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2cc(F)c(F)c(F)c2)cc1	785083255	JTJNLRFFJJOTEJ-UHFFFAOYSA-N	445.419	1.996	50	20	IDGD	
CCc1cc(Br)ccc1NNC(=O)C(=O)Nc1cnn(CC(=O)NC2CC2)c1	785097891	RMURHHFVJUGWFI-UHFFFAOYSA-N	449.309	1.568	50	20	IDGD	
COC(=O)Cc1ccccc1NC(=O)C(=O)NNC(=O)c1cc(-c2cc(C)ccc2C)[nH]n1	785126232	MVSJZOLTZSJCKW-UHFFFAOYSA-N	449.467	1.809	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)CCCC[C@@H]2SC[C@@H]3NC(=O)N[C@H]23)c1C	785300104	ZTTUUNFKJQFOAP-YEWFCNIMSA-N	434.562	1.944	50	20	IDGD	
CN1CCN(C(=O)NNC(=O)c2nc(-c3cccs3)n(-c3cccc(F)c3)n2)CC1	788168825	FCXWPVHTJGTIPY-UHFFFAOYSA-N	429.481	1.737	50	20	IDGD	
COCCCn1c(S)nc2cc(C(=O)NNC(=O)Cc3ccc(F)cc3)ccc2c1=O	789105616	VYKFERAUVGBVKN-UHFFFAOYSA-N	444.488	1.865	50	20	IDGD	
COc1cc(NNC(=O)C(=O)Nc2ccc(OC)c(NS(C)(=O)=O)c2)ccc1Cl	789795901	IMZDXYGJMLKWSW-UHFFFAOYSA-N	442.881	1.811	50	20	IDGD	
CCc1nn(C)c(CC)c1CC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	790103586	JHKWLCLMKJURTO-UHFFFAOYSA-N	447.561	1.333	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(Cc3nnc4n3CCC4)cc2)cc1	792268031	JXYIRFSHQISSBG-UHFFFAOYSA-N	432.484	1.777	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC(NC(=O)NNC(=O)c3cccc(C)n3)CC2)cc1	792804850	XHCRHFMNUPDNEY-UHFFFAOYSA-N	431.518	1.496	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)C(=O)Nc1cccc(Br)n1	793026691	TWUVOKOIEGKHKC-UHFFFAOYSA-N	429.234	1.430	50	20	IDGD	
COc1ccc(Cn2cc(NC(=O)C(=O)NNC(=O)[C@@H]3Cc4ccccc4O3)cn2)cc1	793027074	XDYZKNDJCVGGKF-IBGZPJMESA-N	435.440	1.030	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)c2ccc(Cl)c(S(C)(=O)=O)c2)cc1	794717828	BXNWBYKGNULMKR-UHFFFAOYSA-N	431.923	1.751	50	20	IDGD	
CN(C)S(=O)(=O)C[C@@H](NS(=O)(=O)c1ccc(CCCCl)cc1)C(F)(F)F	795602523	FALUWWYDDYJNLL-CYBMUJFWSA-N	436.905	1.959	50	20	IDGD	
C[C@H]1CN(Cc2csc(NC(=O)NNc3ccc(-n4ccnc4)nn3)n2)C[C@H](C)O1	796656097	QTNVADIJUYIPJI-STQMWFEESA-N	429.510	1.877	50	20	IDGD	
CO[C@H](C(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1)c1cnn(C)c1	798940452	IIIPFLWNLPUKTB-YADHBBJMSA-N	433.512	1.882	50	20	IDGD	
CCOC(=O)[C@]1(COC)CCCN(CC(=O)NNC(=O)c2cc(Cl)ccc2OC)C1	799198515	HBMNGBWBPHFVQZ-HXUWFJFHSA-N	441.912	1.401	50	20	IDGD	
Cc1cc(O[C@H]2CCN(C)C2=O)ccc1NC(=O)NNC(=O)COc1ccc(F)cc1	799241518	UECHRDBRVZBICX-SFHVURJKSA-N	430.436	1.975	50	20	IDGD	
Cc1ccc(-n2ncc(C(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)c2C(F)(F)F)cc1	800520596	GDGVCHYILRWNRP-LLVKDONJSA-N	430.408	1.395	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)NC[C@@H]2CCCC[C@H]2NS(C)(=O)=O)c1C	804495785	SIPYTQGUZUHPEP-FNXZGFMZSA-N	436.578	1.883	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)N[C@@H](CS(=O)(=O)N(C)C)C(F)(F)F)cc1	806564503	DHYVODJVDGLJRF-LBPRGKRZSA-N	442.485	1.240	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)Nc1nc(C2CCOCC2)cs1	806729012	HGTKQFNCIFFHAZ-UHFFFAOYSA-N	431.522	1.896	50	20	IDGD	
CN(C)CCN1C(=O)C(=NNC(=O)c2csc(N3CCOCC3)n2)c2ccccc21	807952047	CVDSBYMZHICDTL-UHFFFAOYSA-N	428.518	1.022	50	20	IDGD	
Cc1cc(=O)cc(C)n1CCCC(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	811032351	JFZTYDOQQOKXLC-UHFFFAOYSA-N	449.552	1.881	50	20	IDGD	
C[C@@]1(CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)OCCc2sccc21	811851883	WUBPFEHBBOBJOB-SFHVURJKSA-N	437.547	1.473	50	20	IDGD	
COCCNC(=O)c1cccc(NC(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)c1	812984379	ZQGFHSRISWTXNR-UHFFFAOYSA-N	435.506	1.462	50	20	IDGD	
CN(C)c1cc(C#N)cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1	814360301	HICGXFAPNKJDTH-UHFFFAOYSA-N	441.513	1.484	50	20	IDGD	
COCc1cc(NC(=O)C(=O)NNC(=O)c2cn(C)c3ccccc23)cc(C(=O)OC)c1	815566894	IOXMEUPBCQEXNM-UHFFFAOYSA-N	438.440	1.511	50	20	IDGD	
Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C(=O)NNc1ccccc1S(=O)(=O)N(C)C	815750938	NFQGRWUPTUVIRO-UHFFFAOYSA-N	435.462	1.544	50	20	IDGD	
CCCN1C(=O)c2ccccc2N2C(=O)CC[C@@]12C(=O)NNc1cc(Cl)nc(N)n1	816046954	QGXBFDXYULCFRD-LJQANCHMSA-N	429.868	1.544	50	20	IDGD	
CCc1ccc(NS(=O)(=O)c2cc(C(=O)NNc3cnnn3C)ccc2OC)cc1	816771266	FQPBOQCRKMGAOV-UHFFFAOYSA-N	430.490	1.944	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCOCC2)cc1C(=O)NNc1cccc(Cl)n1	817010114	MVUIBJCRYVUNIF-UHFFFAOYSA-N	426.882	1.521	50	20	IDGD	
Cc1ccc([C@@](O)(CC(=O)NNC(=O)c2csc(N3CCOCC3)n2)C(F)(F)F)o1	818653217	UCJJWBZTLBRBRF-INIZCTEOSA-N	448.423	1.482	50	20	IDGD	
COc1cccc(/C=C(/C#N)C(=O)O[C@@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)c1	849204086	QHPUXYWPRGJWEE-OJNRTJSBSA-N	429.454	1.820	50	20	IDGD	
C[C@@H](CN1CCCCCC1)C(=O)NN=Cc1c(N2CCOCC2)nc2ccccn2c1=O	874089807	CNPPRAYRYNDRCS-SFHVURJKSA-N	440.548	1.493	50	20	IDGD	
CC(C)C[C@H](C(=O)NNC(=O)COc1ccc(F)cc1)N1C(=O)[C@H]2CC=CC[C@H]2C1=O	910865368	TWYUREXRBLOYFF-FGTMMUONSA-N	431.464	1.718	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c1C	915164143	HCXJJUJDOGRWMY-WQRHYEAKSA-N	444.513	1.523	50	20	IDGD	
COc1ccc2c(ccn2CC(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c1	915592610	MFXGKGNNVQXBPM-UHFFFAOYSA-N	426.385	1.563	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(-c3cccnc3)on2)c1	916096638	RFNIONOZRFJERU-UHFFFAOYSA-N	443.485	1.842	50	20	IDGD	
CCNC(=O)COc1ccc(C=NNC(=O)[C@H](C)CN2C[C@@H](C)O[C@H](C)C2)cc1OC	916365858	LYRPASFLNXAPTK-BRWVUGGUSA-N	434.537	1.406	50	20	IDGD	
CC(C)NS(=O)(=O)c1cccc(CNC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c1	916489341	JTGORKGWXPAMMN-UHFFFAOYSA-N	435.462	1.426	50	20	IDGD	
CCCC(=O)Nc1ccc(CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1	916514070	RRAHTULLMQJTKA-UHFFFAOYSA-N	446.533	1.863	50	20	IDGD	
CCOC(=O)N1CCC(NC(=O)CCCNC(=O)NNC(=O)c2cc(C)oc2C)CC1	916640004	VMXQIXNITHZQPA-UHFFFAOYSA-N	437.497	1.358	50	20	IDGD	
O=C(NCCOc1ccc2c(c1)OCO2)NNC(=O)c1nn(-c2ccccc2)cc1O	916647153	NSQCMWXNVKWLNJ-UHFFFAOYSA-N	425.401	1.330	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NC2CCN(Cc3ccncc3)CC2)nc1	918226511	LNCUBGJWGAUEQU-UHFFFAOYSA-N	447.565	1.454	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)c1ccccc1)C(=O)NNC(=O)c1ccc(C)cc1O	918338642	JSCJWEZRFLZFGM-INIZCTEOSA-N	437.543	1.562	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCNC(=O)C[C@@H]1c1ccccc1	919674241	LLPROQSRYWYCHZ-QGZVFWFLSA-N	430.892	1.673	50	20	IDGD	
CCOc1ccc(NC(=O)CNC(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)cc1	920343154	OQEIEKOMCCREPJ-UHFFFAOYSA-N	427.461	1.610	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2ccc(C)c(C(=O)NNC(=O)CN3CCCC3=O)c2)cc1	920825699	FKVWRKAALUAURQ-UHFFFAOYSA-N	444.513	1.488	50	20	IDGD	
O=C(NCc1cccc(OCCN2CCOCC2)c1)NNc1ccc(-n2cccn2)nn1	920919833	BRROPGDIYUQIBY-UHFFFAOYSA-N	438.492	1.200	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN(S(=O)(=O)Cc2ccccc2)C1)c1n[nH]c2c1CCCC2	1318380966	MMOSDPGYFAKYDI-INIZCTEOSA-N	445.545	1.292	50	20	IDGD	
CN(C)C(=O)c1cccc(CCNC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)c1	1318840655	SZNVSNUIALJZSB-UHFFFAOYSA-N	447.517	1.370	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4nccn4c3)C2)C1	1778016932	XVUIOGAURNCPTG-HNAYVOBHSA-N	435.322	1.951	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2)c1cn2ccsc2n1	1779089561	FTDLKYKPZQTAFK-HBUWYVDXSA-N	426.926	1.123	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](C)Nc3ccccn3)C2)C1	1779330700	MVFYNKHXOMLHPB-SUNYJGFJSA-N	425.327	1.495	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)/C=C/C3CCCCC3)C2)C1	1781285463	AHSNBMDCWPVSLR-BMOUEYTDSA-N	441.532	1.265	50	20	IDGD	
O=C(Cc1cccc(Cl)n1)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781325829	JAYKASWSROIBMO-ZBFHGGJFSA-N	434.693	1.798	50	20	IDGD	
O=C(c1cc2cccn2cn1)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781329474	GLKYTSKGQAPGJU-RHSMWYFYSA-N	425.258	1.468	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCn1cncn1)C2	1781903889	GKSCCMLCOPCRRH-HDMKZQKVSA-N	442.358	1.356	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)n1ccnn1)C2	1781905229	KZMJZLCANJSXDL-BASYENTBSA-N	442.358	1.527	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)C2)C1	1781938280	AEXUHFDVEWPUAO-DIFFPNOSSA-N	442.266	1.527	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccc4c(n3)OCCO4)CCO2)C1	1783534166	FWDZGLUIHYCKHN-KZULUSFZSA-N	440.294	1.080	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H]1CC(c3ccccc3)=NN1)CCO2	1783535334	BJSYEBHSUIFAOW-NQYLQCIDSA-N	449.349	1.366	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)N2CC[C@]3(CN(C(=O)[C@H](F)Cl)CCO3)C2)C1	1783550072	RPYXYAXVYRSOBL-QEEYODRMSA-N	447.935	1.998	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)[C@H](C)CNC(=O)OC(C)(C)C)CCO2)C1	1783870474	CGXFPGIMTPMYLG-SXGZJXTBSA-N	447.960	1.231	50	20	IDGD	
CCOc1cccc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](Cl)COC)C3)C2)c1O	1783882090	VDFDOYWDEPRHFD-YWZLYKJASA-N	426.897	1.488	50	20	IDGD	
Cn1c(=O)c(C(=O)N2CCO[C@@]3(CCN(C(=O)C(Cl)Cl)C3)C2)nc2ccccc21	1783947912	MIUWZOJDFYOSQO-LJQANCHMSA-N	439.299	1.181	50	20	IDGD	
Cc1cccc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]3C2)n1	1783964138	LBOAQVWDUUBSDS-KCMWZYNZSA-N	438.366	1.943	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]3C2)cc(O)n1	1783965739	OHUUVGBZQYDVQM-XTBFLFJDSA-N	440.338	1.720	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)Cn3cccn3)C[C@@H]21	1783969069	INCMQBUZSLXDFR-NRKLIOEPSA-N	441.370	1.530	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3n[nH]c4c(Cl)cccc34)C[C@@H]21)[C@@H](O)CCl	1784092811	WFLHONJYARHRMF-LVGORTOPSA-N	441.315	1.409	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)cc1	1785106874	PIMAAJBJIQPVRH-YJBOKZPZSA-N	442.285	1.779	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)CCNC(=O)c3ccccc3)C2)C1	1785328277	CRMMEXGOVXQIAV-JOCHJYFZSA-N	435.952	1.901	50	20	IDGD	
CC(=O)Nc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)C(Cl)Cl)C[C@@H]32)ccn1	1787775254	DKBJMGZFDPIXAT-IHRRRGAJSA-N	429.304	1.437	50	20	IDGD	
CN[C@H](CC(=O)Nc1ccc(C2(NC(=O)[C@H](F)Br)CCC2)cc1)C(=O)O	1788063905	CQIDHUZTJWOLOU-OCCSQVGLSA-N	430.274	1.874	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccn4cncc34)[C@H]2C1	1788419377	BSVXOXDSSBNOAJ-DNUAJFIVSA-N	449.349	1.959	50	20	IDGD	
C[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CO[Si](C)(C)C)C[C@@H]21)n1ccccc1=O	1788746566	OCRRBDFHGXPWBG-OWSLCNJRSA-N	435.597	1.241	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3c(OC)cccc3OC)[C@H]2C1	1789473870	LLVWETDZHJEBRR-XSWJXKHESA-N	440.924	1.551	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4ccnn4c3)[C@H]2C1	1790444410	UIPWNJGJFTXHBX-QCPWZWHMSA-N	435.322	1.711	50	20	IDGD	
CCOC(=O)C1(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)Br)C[C@@H]32)CC1	1790720532	BCEVDOQAOWUUIF-RFGFWPKPSA-N	431.327	1.093	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C34CCC(CC3)CC4)C[C@@H]21	1791293341	XFKJLXYSUFYITI-VJSAIMCRSA-N	434.581	1.310	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1ccc(C2(NC(=O)CCc3cnn(C)c3)CCC2)cc1	1791600347	YFRURCGIAYNNGO-UHFFFAOYSA-N	440.548	1.860	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccc(C#N)cc1	1792559209	QNWRWUGSDIKRTI-ZMMAXQRCSA-N	434.334	1.864	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(Cl)c(F)c(Cl)c1)C2)[C@H](O)CCl	1792980459	PJXDTCZTGVERNY-YJKIEOBBSA-N	439.698	1.935	50	20	IDGD	
C[C@@H](CNC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2	1792988717	UCSMNCWMQPLXJD-RVMXOQNASA-N	438.352	1.541	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC=C(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](O)CCl)C1	1793110999	VYIHDTGZURBBNH-YYIAUSFCSA-N	441.956	1.792	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCC#N	1795416917	CIVUUBUGCBFSOK-FQLMCAECSA-N	428.917	1.012	50	20	IDGD	
O=C(Cc1ccc2c(c1)CCCO2)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1	1796191464	OVFSAOQHFMBFEZ-KOUNCHBCSA-N	448.328	1.186	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccnc2ccccc12)c1cccc(B(O)O)c1	1797281606	QPJBKIPVSCAEHF-REPLKXPHSA-N	429.285	1.480	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1cccn2cncc12	1797523860	QQEXZNRHRVBGTG-BAESOJJISA-N	425.258	1.228	50	20	IDGD	
C[C@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2)N1CSCSC1	1797846364	ORJLEHAYVDYNEU-WISYIIOYSA-N	428.407	1.423	50	20	IDGD	
COc1nccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CO[Si](C)(C)C)c1F	1797954962	WXRCJEHVUBVZFR-FVCICTRLSA-N	425.533	1.284	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(N(C)C)c1	1798882727	IZWYQCUGYQCRHM-NYCLONFESA-N	438.366	1.987	50	20	IDGD	
CN1CCN(C2(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)[C@@H](F)Br)CC2)CC1	1800162352	VLHLWZBVRDWSEX-LXTVHRRPSA-N	431.350	1.095	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc([N+](=O)[O-])o1)C2	1800638259	WEIYONBWIXSTNZ-FBKDDSFISA-N	430.255	1.565	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C13CC(C(=O)OC)(C1)C3)C2	1800643963	ABKGHMQXVPXMSJ-ZCGWNNTKSA-N	443.338	1.093	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3cc(O)ccc3n1)C2	1800758366	XTNDBAWRZQNIAP-NASWQRNTSA-N	448.317	1.927	50	20	IDGD	
CC(C)(C)OC(=O)N1CC2(C[C@@H]2C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](O)CCl)C3)C1	1801879963	UMGZQKBXSWBKIX-JKJDWNRSSA-N	441.956	1.481	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1CCc2ccccc2O1	1802240073	VOWRBSAFZGOIOV-AJYBTWMASA-N	428.533	1.391	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc3c(c1)NC(=O)CC3)C2	1802338564	OJYRQQFVMDYHJQ-BCDXTJNWSA-N	441.532	1.196	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)COc2ccccc2F)[C@@H]1c1cccnc1)[C@H](O)CCl	1803148053	NOBIATBYMKGORN-XAUMDUMWSA-N	435.883	1.905	50	20	IDGD	
COc1nn(C)cc1C(=O)NC[C@@H]1CCN(C(=O)CO[Si](C)(C)C)[C@H]1c1cccnc1	1805303129	JIGOHDMRZMGQBK-LPHOPBHVSA-N	445.596	1.995	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)c2ccccn2)[C@H]1c1cccnc1	1805446969	SPFWJPRKGJRCLG-OXQOHEQNSA-N	445.483	1.109	50	20	IDGD	
C[C@H](CS(C)(=O)=O)C(=O)N1CCCC2(CCN(C(=O)[C@@H](C)Br)CC2)C1	1806047664	NWFIFZMLRSUPBW-ZIAGYGMSSA-N	437.400	1.682	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)no1	1810297831	FFJYFQDGIFJHJW-KXBFYZLASA-N	449.471	1.010	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2ccc(F)cc2)[C@H]1c1cccnc1	1811906209	WNPNDPLYRMBXNT-PGRDOPGGSA-N	441.507	1.913	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1ccc(O)cc1	1811933378	ZBSMVICZBCJANC-DENIHFKCSA-N	445.284	1.100	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)[C@@H]2CNC(=O)O2)[C@@H]1c1cccnc1	1812774533	XNZFJKIXKXSOTM-ZQDZILKHSA-N	439.310	1.369	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](C)Cn3cncn3)sc2C1	1820078496	MSHCIFQROSSFTM-SRVKXCTJSA-N	426.930	1.237	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)n2)[nH]n1)[C@@H](F)Br	1820931930	BHMOPLOEUSDPOK-JOYOIKCWSA-N	443.233	1.607	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](F)Br)n[nH]1	1820934779	AXCYQBRSBLVNCH-IRUJWGPZSA-N	447.309	1.800	50	20	IDGD	
CNc1nsnc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](Cl)COC)n[nH]1	1822366893	MXLPZDFJVCNJAL-GXSJLCMTSA-N	427.918	1.863	50	20	IDGD	
Cc1onc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)c1C	1822410524	LIPNYJPFWTUWFH-OAHLLOKOSA-N	431.497	1.693	50	20	IDGD	
C[C@@H](C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1)n1cccn1	1822802406	GNHFCDDCKSGXTH-GOEBONIOSA-N	430.513	1.233	50	20	IDGD	
Cn1c(C(=O)N[C@H]2CCc3nc(NC(=O)[C@H](F)Br)sc3C2)cccc1=O	1823001337	CUKHVAJBMAKUQM-SDBXPKJASA-N	443.298	1.758	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CC[C@H](N)C(N)=O)CC1	1824094396	VOLYHPWOCYWJFJ-VNQPRFMTSA-N	445.402	1.230	50	20	IDGD	
O=C(c1nc2ccc(F)cn2n1)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)CC1	1824187996	MCOYQJISWBHNHA-HOTGVXAUSA-N	437.903	1.701	50	20	IDGD	
CC(C)NCCC(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1	1828926306	DUPDJURKBXKDBP-HXUWFJFHSA-N	444.580	1.307	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)C2=COCCC2)CC1	1831914409	BSWHSIXVEBABEV-OAQYLSRUSA-N	426.322	1.294	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3ccco3)CCO2)C1	1833044678	RGQQMEGNLNINPI-HNAYVOBHSA-N	443.338	1.700	50	20	IDGD	
CC[C@H](C)[C@H](O)C(=O)N1CCC(N2CCC(NC(=O)[C@H](C)CBr)CC2)CC1	1833264722	JDEGDBRHMWIUGQ-DAYGRLMNSA-N	446.430	1.996	50	20	IDGD	
CN1CCc2cc(C(=O)N3CCC(N4CCC(NC(=O)[C@@H](O)CCl)CC4)CC3)ccc21	1833309915	DOUYVZHGECNLRB-NRFANRHFSA-N	448.995	1.464	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)CC(=O)OC(C)(C)C)CC2)CC1	1833609376	HOWNKCYPAJETNI-QGZVFWFLSA-N	445.988	1.544	50	20	IDGD	
Cn1ccnc1C(=O)N1CCC(N2CCC(NC(=O)CCBr)CC2)CC1	1834421158	LXGULSLIBLTSPR-UHFFFAOYSA-N	426.359	1.390	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)Cc3ccn(C)n3)CC2)CC1	1834848041	LCKCSUPFPBHHQF-CQSZACIVSA-N	440.386	1.318	50	20	IDGD	
Cn1nc2c(c1C(=O)N1CCC(N3CCC(NC(=O)[C@@H](F)Cl)CC3)CC1)CCC2	1835081443	QLHOREFMIUKRBG-GOSISDBHSA-N	425.936	1.628	50	20	IDGD	
C[C@@H](C(=O)NC1CCN(C2CCN(C(=O)[C@H](F)Cl)CC2)CC1)n1ccccc1=O	1835826537	VIXAPUHRXYESEP-KSSFIOAISA-N	426.920	1.515	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cc(OC)n(C)n3)CC2)CC1	1836203715	LRZSWYVDCLTKIE-INIZCTEOSA-N	425.961	1.631	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnccc3F)CCO2)C1	1836319786	ZHDSLAPAJZFCJZ-SJKOYZFVSA-N	430.274	1.074	50	20	IDGD	
CN1CCC[C@@H](C(=O)NC2CCN(C3CCN(C(=O)CCBr)CC3)CC2)C1	1836351991	XIZQZKDBPNOPEB-MRXNPFEDSA-N	443.430	1.685	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)/C=N/N3CCCCC3)CCO2)C1	1837440647	RCGUALUPHFOOQO-XLKWYTADSA-N	428.961	1.180	50	20	IDGD	
CC1CCN(CC(=O)N2CCOC[C@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)CC1	1837710236	QAECIDAMDONSNQ-OAQYLSRUSA-N	441.645	1.026	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(Cl)cn3)CCO2)C1	1837899851	XNXZJRCAAIVECW-KDOFPFPSSA-N	432.304	1.059	50	20	IDGD	
Cc1nn[nH]c1C(=O)N1CCC(OC2CCN(C(=O)[C@](C)(Cl)CCl)CC2)CC1	1838001611	YYPWFZWTMBUMNX-GOSISDBHSA-N	432.352	1.962	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(F)ccc3F)CCO2)C1	1838860444	HUOCXGIXAJLXFF-HNAYVOBHSA-N	432.851	1.289	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(F)c1F)CCO2	1838998504	DLEVPNRBPWLNHG-HXUWFJFHSA-N	442.535	1.886	50	20	IDGD	
C=C(Oc1ccccc1O)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](Cl)CC)CCO2	1839144508	CORCTUXISIOLJE-HRAATJIYSA-N	438.908	1.759	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(C#N)cc(OC)c3)C2)C1	1839146676	RZXDLSQUALIPCE-RXVVDRJESA-N	435.908	1.654	50	20	IDGD	
CCn1nc(C)cc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2	1839152166	PSAIGWBNHLSWBS-RBUKOAKNSA-N	447.363	1.518	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3ncc[nH]3)C2)C1	1839154902	BEKCDAXUMAGJOM-MSOLQXFVSA-N	433.336	1.035	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)c(C)o1	1839197568	BFQRLAVQRNJVOD-PBHICJAKSA-N	433.274	1.657	50	20	IDGD	
O=C(c1cc(Cl)c(O)cc1O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1839252182	PLPSTDOAGUOWFY-WMLDXEAASA-N	437.251	1.356	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CC[C@@H]3CCOC3)CCO2)C1	1840590153	FVPWXUPJKNHZKC-JTDSTZFVSA-N	447.370	1.433	50	20	IDGD	
COc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)ccc1[N+](=O)[O-]	1840757997	LHBYYIRSSHAAJN-CRAIPNDOSA-N	445.831	1.208	50	20	IDGD	
CC(C)(C)OC(=O)N1CC2(CC[C@H](C(=O)N3CCCC34CN(C(=O)[C@@H](F)Cl)C4)O2)C1	1841080741	JQIVHWJLQPOUCU-ZIAGYGMSSA-N	445.919	1.893	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)c1cccnc1CS(C)(=O)=O)C2	1841667084	PBEZANWYKPSABN-HNNXBMFYSA-N	427.954	1.851	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)CCc2cccc(C)n2)C1	1841942007	ASFHUDLKGDWMJN-YZSQISJMSA-N	436.516	1.660	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)[C@@H]1Cc3ccccc3N1)C2	1843417028	PICKPOKEHOHFCM-CRXVIZHGSA-N	434.500	1.361	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1ccn(-c3ccccc3)n1)C2	1844264628	RGBFPTRZGORAGY-UHFFFAOYSA-N	445.483	1.002	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2cc(Cl)cc(Cl)n2)C1	1844568206	VRZFLLXKGMPVFX-UHFFFAOYSA-N	449.298	1.518	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCCC12CN(C(=O)Cn1ccncc1=O)C2	1845871838	WADSBTAQGMEAQP-LZYBPNLTSA-N	439.422	1.332	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(CC(=O)N2CCCC23CN(C(=O)[C@H](F)Cl)C3)CC1	1846968729	WTOGTYBLSDEGNE-HNNXBMFYSA-N	432.924	1.277	50	20	IDGD	
CC(=O)C[C@@H](C)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1848098675	POWFQPGNRPWWKS-OEAJRASXSA-N	429.945	1.936	50	20	IDGD	
COc1ccc(-c2nnc(SCC(=O)NNC(=O)[C@H]3COc4ccccc4O3)o2)cc1	8633395	WGJZITFFLHGXIR-MRXNPFEDSA-N	442.453	1.825	50	20	IDGD	
CCn1ncc2c(C(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)cc(-c3ccccc3)nc21	12799442	UMBKMQYIUCGOIN-AWEZNQCLSA-N	427.486	1.314	50	20	IDGD	
Cc1ccc([C@H](CNC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)N2CCCC2)o1	726271014	LNCAIRISUUCYOQ-KRWDZBQOSA-N	438.488	1.616	50	20	IDGD	
COc1ccc(CN2C[C@@H](C(=O)NNC(=O)c3cc(-c4ccccc4)[nH]n3)CC2=O)cc1	726619637	NVKFTGVAOURJKI-KRWDZBQOSA-N	433.468	1.895	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)CSC[C@H]2CCCCO2)cc1	727364338	SNIBKHMBLPQEBJ-OAHLLOKOSA-N	429.564	1.065	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)NCCN2CCOC(C)(C)C2)c1	728749631	ZJQSXPIRZGLYOZ-UHFFFAOYSA-N	429.315	1.513	50	20	IDGD	
O=C(NNC(=O)N1CCCN(Cc2ccccc2)CC1)C1CCN(c2ncccn2)CC1	728958656	DIWPOVUIFFRTEK-UHFFFAOYSA-N	437.548	1.642	50	20	IDGD	
O=C(CNC(=O)c1ccc2c(c1)OCO2)NNc1ccc(S(=O)(=O)C(F)F)cc1	728974210	HNXBNLDVIGEBFG-UHFFFAOYSA-N	427.385	1.285	50	20	IDGD	
C=C(C)CN1CCC(NC(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)CC1	730067046	UMSZDPOSUWDHGI-UHFFFAOYSA-N	426.521	1.962	50	20	IDGD	
NC(=O)c1ccc(/C=C/C(=O)N2CCC[C@H]2C(=O)NNC(=O)Cc2ccccc2F)cc1	731329902	CLYNIBHQRPEVEO-DLENHJPASA-N	438.459	1.319	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)[C@H](CCSC)NC(=O)c1cccc([N+](=O)[O-])c1	731494365	OJVMPCYWJCWVSC-INIZCTEOSA-N	446.485	1.916	50	20	IDGD	
CCCc1c(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)nnn1-c1cccc(Cl)c1	731617735	SCCXNJQAKVMSTP-GFCCVEGCSA-N	440.913	1.004	50	20	IDGD	
CN(C)S(=O)(=O)c1ccsc1C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	732068886	OMNPDWXYPVGRKE-UHFFFAOYSA-N	444.560	1.196	50	20	IDGD	
CC[C@H](C)NS(=O)(=O)c1ccc(C(=O)NNC(=O)CCN2C[C@H](C)O[C@H](C)C2)cc1	732260551	FWOSLUKRANMPRP-HRCADAONSA-N	440.566	1.024	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)NCCNC(=O)c2c(F)cccc2F)cc1OC	732996682	JEYOLTCUMVGHQX-UHFFFAOYSA-N	436.415	1.746	50	20	IDGD	
O=C(CCCC[C@@H]1SC[C@H]2NC(=O)N[C@@H]21)NNC(=O)c1cnn(-c2ccccc2)c1	733170263	VUBULSFOSLWSFP-RYRKJORJSA-N	428.518	1.359	50	20	IDGD	
Cc1ncc2c(n1)CCC[C@@H]2NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	734950820	JGZAMGIAYBEABN-KRWDZBQOSA-N	432.506	1.057	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)CC(C)(C)NC(=O)OC(C)(C)C	739680088	JOHRIBIVRKWWCE-UHFFFAOYSA-N	441.554	1.743	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)c1cccc(NS(=O)(=O)c2ccccc2)c1	740850897	DRMVAXVBZPVDMY-UHFFFAOYSA-N	432.502	1.553	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)CCN2CCN(c3ccccn3)CC2)cc1OC	741144614	XCEAIIFFTGDDBW-UHFFFAOYSA-N	441.532	1.852	50	20	IDGD	
Cc1nn(C)c2sc(C(=O)N[C@H](C)C(=O)NNC(=O)Cc3c[nH]c4ccccc34)cc12	742036833	OLZLSJPBECCGPU-GFCCVEGCSA-N	438.513	1.933	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccccc1F)NNC(=O)c1cccc(Br)c1	742768985	DDCAUHOXHNLBJW-UHFFFAOYSA-N	444.282	1.718	50	20	IDGD	
COc1ccccc1-n1cc(S(=O)(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cn1	743252236	RPVMZPQFSYJSEK-SFHVURJKSA-N	430.442	1.030	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2C[C@@]23CCCc2ccccc23)c1	743283756	FIVLKVYYYMJFRY-SIKLNZKXSA-N	427.526	1.992	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)NCc1cccc([N+](=O)[O-])c1	743346747	QBHUBTCDGIGNND-UHFFFAOYSA-N	426.477	1.638	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@@H]2C[C@H]2c2cccc(F)c2)cc1	743356450	MSHDFTNQJDBDSV-ZWKOTPCHSA-N	434.493	1.641	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)[C@H]2CCCN(C(=O)Nc3ccccc3)C2)cc1	744595071	WYWKEXBSUZGPIE-SFHVURJKSA-N	449.467	1.807	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NCc2cccc(N3CCOC3=O)c2)cc1	745731253	XDWIYSXUIWBKAY-UHFFFAOYSA-N	447.473	1.583	50	20	IDGD	
CN(CCCC(=O)NNC(=O)Cc1cn2ccccc2n1)S(=O)(=O)c1ccc(F)cc1	746548647	LJBAIIZRXWKZRP-UHFFFAOYSA-N	447.492	1.264	50	20	IDGD	
Cc1csc([C@](O)(CC(=O)NNC(=O)Cn2cnc3ccccc32)C(F)(F)F)n1	746817920	MFJJMSWPGPZYBE-MRXNPFEDSA-N	427.408	1.789	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=O)c2ccc(Cl)cc2F)n(C)c1	747329563	OZYNFIKKPIDGFF-UHFFFAOYSA-N	430.889	1.923	50	20	IDGD	
CC(C)(C)CC(=O)N1CCC[C@@H]1C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	748162581	UYPJATDNZJMNPI-HXUWFJFHSA-N	443.592	1.773	50	20	IDGD	
CC[C@H](Nc1c([N+](=O)[O-])c(C)nn1C)C(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	749521151	NMZHIIKWODQYBS-ZDUSSCGKSA-N	442.436	1.180	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2cc(OC)ccc2Br)oc1C	751142749	MNWZRUKOIMYCAC-UHFFFAOYSA-N	447.263	1.769	50	20	IDGD	
O=C(NCc1ncccc1F)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	752683838	DRUPHYIRJHXUKI-UHFFFAOYSA-N	435.481	1.540	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ccc(C)c(F)c2)c(C)c([N+](=O)[O-])c1	753839861	DMTIVVNPNVMJSI-UHFFFAOYSA-N	432.364	1.537	50	20	IDGD	
CC(C)C[C@H](CCO)CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	754376050	SRLXEADEBCAJBQ-INIZCTEOSA-N	440.566	1.460	50	20	IDGD	
CCOc1ccc(NC(=O)NNC(=O)c2cnn(C)c2)cc1S(=O)(=O)N(CC)CC	755452305	YZTKFHZSXHSHIB-UHFFFAOYSA-N	438.510	1.316	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)c1ccc2nc[nH]c2n1	755517687	QVYRGBOURGHMQA-UHFFFAOYSA-N	427.896	1.190	50	20	IDGD	
COc1ccc(OC(F)F)c(CNC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c1	756914974	XLALSVZWZUEEAN-UHFFFAOYSA-N	433.375	1.417	50	20	IDGD	
CC[C@H]1CN(CC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)CC[C@@H]1NC(=O)OC(C)(C)C	757111075	QCSVIHXIDOCBQT-YOEHRIQHSA-N	449.508	1.981	50	20	IDGD	
CCOc1cc(C(=O)NNc2ccc(C(N)=O)nn2)ccc1OCC(=O)N1CCCCC1	757402130	HOOGMCTXFYCHRO-UHFFFAOYSA-N	442.476	1.122	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)Nc1ccc2nc(N3CCOCC3)oc2c1	757776194	BUKMEFLJPILCDL-UHFFFAOYSA-N	436.428	1.768	50	20	IDGD	
CCO[C@@H]1C[C@H](NC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)[C@]12CCCO2	759322807	QYFFVWBKKBCGIB-HDMKZQKVSA-N	426.495	1.152	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)c1ccc(S(=O)(=O)Nc2nccs2)cc1	763053145	SHQNHYLXDNFIEZ-UHFFFAOYSA-N	446.510	1.922	50	20	IDGD	
O=C(NNC(=O)c1ccccc1O)C(=O)Nc1ccc(F)cc1I	763530776	ZIYAZEUXQYTHLO-UHFFFAOYSA-N	443.172	1.536	50	20	IDGD	
CCn1cnnc1-c1ccccc1NC(=O)C(=O)NNC(=O)c1ccc(OC)c(OC)c1	763551278	VEDPPUYNNVTFDR-UHFFFAOYSA-N	438.444	1.382	50	20	IDGD	
C[C@@H](C#N)CSc1ccccc1NC(=O)C(=O)NNC(=O)[C@@H]1COc2ccccc2O1	763578339	ORHMASNRXQFARA-GUYCJALGSA-N	440.481	1.864	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccnn1Cc1ccccc1F	763657512	ODMPPWBARKLPKV-UHFFFAOYSA-N	441.419	1.244	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(C)c(OCC(F)F)c1	763664374	VRFUQOOAKUVPRY-UHFFFAOYSA-N	437.399	1.812	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccnc2N2CCCCC2)cc1C	763666505	HHMFTRWEDCANBL-UHFFFAOYSA-N	425.489	1.854	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc3c(c2)NC(=O)[C@@H](C)O3)cc1C	763666544	IUGWBMBVUSZQKZ-CYBMUJFWSA-N	426.429	1.188	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccnc(OCC(F)(F)F)c2)cc1	763681621	LWEGHPWCFPTTIU-UHFFFAOYSA-N	437.334	1.059	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCC3)cc1N1CCOC1=O	763784535	YVOVICIUXGJZKP-UHFFFAOYSA-N	444.469	1.602	50	20	IDGD	
CC(C)C(=O)NNC(=O)C(=O)Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1	763817185	DXTLRSMBCKWAPG-UHFFFAOYSA-N	437.544	1.793	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccnn2Cc2ccc(C)s2)cc1	763820743	OBFCPFJWJAOXEX-UHFFFAOYSA-N	427.486	1.775	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)OCC(=O)N3)c1C	763853482	ZPTXWJOBAVNDLT-ZDUSSCGKSA-N	426.429	1.188	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cccc(NC(C)=O)c2)cc1	763861372	OQMFVXPRIPEQCA-CYBMUJFWSA-N	428.445	1.597	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)oc(=O)n3C)cc1	763861439	POEXACMVOWLHNR-GFCCVEGCSA-N	442.428	1.084	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(OC)c([N+](=O)[O-])c2)cc1OC	763910654	CHPYWCNPCBVQNU-UHFFFAOYSA-N	446.416	1.801	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(OCCC(C)C)c(OC)c2)cn1	763913960	HEXSCPFITSADRE-UHFFFAOYSA-N	430.461	1.923	50	20	IDGD	
O=C(NNC(=O)c1cc2c(s1)CCCCCC2)C(=O)Nc1ccc(-n2nccn2)nc1	763914474	MTXBHFGPRZDOJN-UHFFFAOYSA-N	439.501	1.783	50	20	IDGD	
Cc1cnn(Cc2cc(F)ccc2F)c1NC(=O)C(=O)NNC(=O)Cc1ccc(F)cc1	763919991	XKDSAAIEDSIZIZ-UHFFFAOYSA-N	445.401	1.986	50	20	IDGD	
Cc1cn(-c2ccccc2)nc1NC(=O)C(=O)NNC(=O)c1cc(Br)c[nH]1	763998774	SRDVBSKZXJAFST-UHFFFAOYSA-N	431.250	1.671	50	20	IDGD	
CCOC(=O)C1CCN(C(=O)c2ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)CC)cc2)CC1	764082039	AHPLTVIXOMHOMN-AWEZNQCLSA-N	446.504	1.234	50	20	IDGD	
Cc1cnn(Cc2cc(F)ccc2F)c1NC(=O)C(=O)NNC(=O)c1ccc(Cl)nc1	764092740	MJUAYLOMYDHGPS-UHFFFAOYSA-N	448.817	1.966	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(CC(=O)N3CCc4ccccc43)cc2)n[nH]1	764097383	CGNXSQOQUMDXBV-UHFFFAOYSA-N	446.467	1.250	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccccc2N2CCOC2=O)o1	764139221	OJHMKICMTBNUTI-UHFFFAOYSA-N	443.460	1.478	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2O1)C(=O)Nc1ccc2nc(-c3ccccn3)oc2c1	764165338	XBQYTWUTEKUZJN-IBGZPJMESA-N	443.419	1.979	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)CCC2CCCCC2)cc1	764211207	NOGQTGIXLKGTSD-UHFFFAOYSA-N	438.550	1.820	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2c(Cl)cccc2Cl)cc1S(N)(=O)=O	764221346	NGSWSNIDKHLOGB-UHFFFAOYSA-N	445.284	1.349	50	20	IDGD	
COC(=O)[C@@H]1CN(C(=O)C(=O)NNC(=O)CCCc2ccccc2)c2ccccc2O1	764226529	NPNPHZQXRROHML-SFHVURJKSA-N	425.441	1.124	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)C(=O)Nc1ccc(OCC(F)(F)F)nc1	764243296	RDCCJTPCDMRILC-UHFFFAOYSA-N	435.362	1.764	50	20	IDGD	
CC(C)(C(=O)NNC(=O)C(=O)Nc1cc(N2CCNC2=O)ccc1Cl)c1ccccc1	764309584	QXLDPVJYYOYYHH-UHFFFAOYSA-N	443.891	1.933	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1	764345236	PAPUCKFFOOSVDK-UHFFFAOYSA-N	435.396	1.973	50	20	IDGD	
O=C(NNC(=O)C(F)(F)Oc1ccccc1)C(=O)N1C[C@@H]2CCCN2c2ccccc21	764379639	GLDLWONKDLICAB-AWEZNQCLSA-N	430.411	1.821	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1ccccc1O[C@@H](C)C#N	764392619	ILIQHUVMVFIEIR-ZDUSSCGKSA-N	428.470	1.864	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)CSc2ccccc2OC)c(F)c1	764398170	PFCXGMGLELYCAV-UHFFFAOYSA-N	435.433	1.499	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)C(=O)Nc1cccc(CN2C[C@@H](C)O[C@H](C)C2)c1	764404278	JGVFGYFVYBRAEH-QZTJIDSGSA-N	438.528	1.933	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccccc2)C1	765248468	SHQBWSQKHFULIY-OAHLLOKOSA-N	449.554	1.733	50	20	IDGD	
CCNS(=O)(=O)c1ccc(C)c(C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)c1	765314311	ZKWCZVLHKXOQKT-UHFFFAOYSA-N	442.538	1.359	50	20	IDGD	
C[C@@H](Oc1ccccc1Cl)C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765737187	XFAPATVVSINONK-MRXNPFEDSA-N	444.919	1.713	50	20	IDGD	
CON=Cc1ccc(C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)cc1	766664927	YAURZODJSYKANK-UHFFFAOYSA-N	443.935	1.899	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)CN1CCN(c2c(C#N)cnc3ccccc23)CC1	766863081	IXHZBXJQGQMAHD-UHFFFAOYSA-N	442.523	1.927	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)C(=O)C1	766897679	KFCRUYPWVGUHMN-UHFFFAOYSA-N	428.920	1.683	50	20	IDGD	
O=C(NNC(=O)c1ccc(Br)c(Cl)c1F)N[C@@H]1CCS(=O)(=O)C1	767683568	IBTHSPUSAGYQNX-ZCFIWIBFSA-N	428.667	1.373	50	20	IDGD	
C[C@H](NS(=O)(=O)c1cccc(C#N)c1)C(=O)NNC(=O)c1cc2ccccc2cc1O	767828664	WSQOZIKRSFPSHX-ZDUSSCGKSA-N	438.465	1.545	50	20	IDGD	
CCCCCn1cc(CNC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c(C)n1	768118197	JIAYFULAEJOFLV-UHFFFAOYSA-N	425.493	1.773	50	20	IDGD	
COc1cc2c(cc1NC(=O)C(=O)NNC(=O)COc1cccc(C)c1)NC(=O)CC2	768232784	KNWPPSCDYAOYNB-UHFFFAOYSA-N	426.429	1.053	50	20	IDGD	
CC(C)n1nc(C(=O)NNS(=O)(=O)c2csc([N+](=O)[O-])c2)c2ccccc2c1=O	768866582	MUMAYLJOJLMOTE-UHFFFAOYSA-N	437.459	1.570	50	20	IDGD	
CC(=O)N1CCc2c(NC(=O)C(=O)NNC(=O)C(F)(F)Oc3ccccc3)cccc21	769268409	ZPZUFQTZEGUCJI-UHFFFAOYSA-N	432.383	1.353	50	20	IDGD	
O=C(NNC(=O)c1cnc(Cl)cn1)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	769470436	GIFURVZZPVVQCQ-UHFFFAOYSA-N	434.847	1.907	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N[C@H](C)[C@H]1CN(C)CCO1	769967575	PIDLZSOPLLKPSN-TYNCELHUSA-N	429.315	1.266	50	20	IDGD	
CC(C)c1nccnc1NNC(=O)[C@@H]1CCCN1S(=O)(=O)c1cccc([N+](=O)[O-])c1	772844857	PFPLDWQVCJTPEL-HNNXBMFYSA-N	434.478	1.805	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)CCN1CCN(c2ccccn2)CC1	772971166	XVENBIKTODYKLW-MRXNPFEDSA-N	431.924	1.862	50	20	IDGD	
CNC(=O)C(C)(C)CNC(=O)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1	772996115	COXZVLDENIRDLZ-FQEVSTJZSA-N	437.544	1.716	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NNC(=O)c2cn(Cc3cccc(F)c3)nn2)C1	773411796	RMQYHUVDVXRZND-OAHLLOKOSA-N	446.483	1.874	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NNC(=O)[C@@]2(C)Cc3ccccc3C(=O)O2)C1	773421093	QWNLCJRUTPBLLB-IVZQSRNASA-N	431.489	1.953	50	20	IDGD	
CCCNC(=O)[C@@H]1CN(C(=O)C(=O)NNc2ccc3ccccc3n2)c2ccccc2O1	773661961	NEQUILZOGZLUPB-IBGZPJMESA-N	433.468	1.998	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)NC(=O)CO2	774010184	VRTROMOLXBQYAZ-SNVBAGLBSA-N	432.820	1.224	50	20	IDGD	
COC(=O)CCN1CCN(C(=O)NNC(=O)c2cccc(Br)c2)[C@H](C)C1	774739571	GQCBWSSUUMXNFG-GFCCVEGCSA-N	427.299	1.373	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)[C@@H]2CCCN2S(=O)(=O)c2cccs2)c1	776527851	LAJIFCOAFKYVAN-AWEZNQCLSA-N	429.545	1.448	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNS(=O)(=O)c1cc(F)c(Br)cc1F	777940082	VTSAQNXQNSTCEQ-UHFFFAOYSA-N	444.254	1.562	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)COc1cccc(NC(=O)c2ccco2)c1	778436396	JKGKCXAJCCPYFE-UHFFFAOYSA-N	432.433	1.583	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)c2cccc(-c3nnc(CCOC)o3)c2)nc1C	778966608	KMJZLTVNCSOOKP-UHFFFAOYSA-N	426.433	1.958	50	20	IDGD	
CC(C)[C@H]1C[C@H](CC(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)CCO1	782118259	TWGRSVKFVMOANG-IAGOWNOFSA-N	439.582	1.302	50	20	IDGD	
COc1cccc(-c2nsc(NC(=O)C(=O)NNc3ccc(S(C)(=O)=O)cc3)n2)c1	783071489	LMYTXLPSUHYCQJ-UHFFFAOYSA-N	447.498	1.699	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)CCS(=O)(=O)C1	783425375	HTPZRPPMPHUCSJ-HXUWFJFHSA-N	428.470	1.487	50	20	IDGD	
CN(Cc1ccccc1)c1ccccc1NC(=O)C(=O)NNC(=O)CNC(=O)c1ccco1	784001697	BSVCGURJGWRFJB-UHFFFAOYSA-N	449.467	1.432	50	20	IDGD	
CNC(=O)c1cc(NC(=O)C(=O)NNc2ccc(Br)nc2)ccc1Cl	784806740	PNKVVCYWBFULCV-UHFFFAOYSA-N	426.658	1.939	50	20	IDGD	
O=C(NNc1ccc(Br)nc1)C(=O)Nc1cc(C2CC2)nn1-c1ncccn1	784807200	WKYBSCBWRIHKIE-UHFFFAOYSA-N	443.265	1.779	50	20	IDGD	
COC(=O)CNC(=O)Cc1ccc(NC(=O)C(=O)NNc2ccc(C#N)c(Cl)c2)cc1	785086543	RPOYPHKHUMFSOL-UHFFFAOYSA-N	443.847	1.125	50	20	IDGD	
COC(=O)CCc1cccc(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)c1	786414142	KDIYSRWFQADOGI-UHFFFAOYSA-N	438.484	1.331	50	20	IDGD	
CCNC(=O)Nc1ccc(C)c(NC(=O)C(=O)NNC(=O)c2ccc(OC)cc2OC)c1	787541651	BKCATVFNFFGYKL-UHFFFAOYSA-N	443.460	1.553	50	20	IDGD	
Cc1csc(C(=O)N([C@H]2CCS(=O)(=O)C2)N(C)C)c1I	787889820	MHKXRQWDFVUYEX-VIFPVBQESA-N	428.317	1.767	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)c(C)cc1C	788330295	FQBWKTYYCBUEPE-UHFFFAOYSA-N	427.413	1.261	50	20	IDGD	
COC(=O)c1cncc(S(=O)(=O)NNC(=O)c2cc(C)n(-c3ccccc3)c2C)c1	788477167	JHUDIYZQHDBMTR-UHFFFAOYSA-N	428.470	1.899	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)[C@H](CCS(C)(=O)=O)c2ccccc2)c1	789110073	VZWRMWNLVHDQDW-GOSISDBHSA-N	432.498	1.518	50	20	IDGD	
CC(C)(C)C(=O)NC1CCC(C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)CC1	789202989	QAZRZSWZVQRBTD-UHFFFAOYSA-N	428.489	1.584	50	20	IDGD	
COc1nc(Br)ccc1NC(=O)C(=O)NNC(=O)c1ccc(O)c(Cl)c1	789587518	ZWUVNOPZJPCWAR-UHFFFAOYSA-N	443.641	1.611	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)[C@@](C)(O)Cn2cc(C(F)(F)F)ccc2=O)cc1C	792014536	JPWYZYLADXODJS-IBGZPJMESA-N	441.406	1.461	50	20	IDGD	
COc1ccc(S(=O)(=O)C(F)(F)F)cc1NC(=O)C(=O)NNc1ncccc1C	792375387	JMMZJOBEUZOMBC-UHFFFAOYSA-N	432.380	1.774	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)CN(C)CCN1CCN(Cc2ccccc2)CC1	796275550	BKQRZSUBZAZTFQ-UHFFFAOYSA-N	437.588	1.435	50	20	IDGD	
COc1cc2c(cc1S(=O)(=O)NNC(=O)CC13CC4CC(CC(C4)C1)C3)OCC(=O)N2	797428324	VVJSDZJEWNCZDX-UHFFFAOYSA-N	449.529	1.942	50	20	IDGD	
C=CCNC(=S)NNC(=O)c1cc(NC(=O)c2cc(OC)cc(OC)c2)ccc1O	798305209	VJISCDRGHNNPDG-UHFFFAOYSA-N	430.486	1.957	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(Cl)c(CN(C)C)c2)cc1OC	799257316	IEMATCMHPFKYPF-UHFFFAOYSA-N	434.880	1.819	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCCCNC(=O)/C=C\c2ccccc2)c1	800072894	MIFCBCOOGIDOEC-QXMHVHEDSA-N	444.513	1.254	50	20	IDGD	
COC(=O)N(C)NC(=O)c1ccc(NC(=O)C[C@H]2SC(N3CCCC3)=NC2=O)cc1	804125172	NMWIQSWHEVMEJI-CQSZACIVSA-N	433.490	1.452	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2nc(C3CCOCC3)cs2)cc1	806977290	CMXXPJNWWCTLCW-UHFFFAOYSA-N	432.502	1.764	50	20	IDGD	
O=C1COC[C@@H](C[C@H]2CN(C(=O)C(=O)NNc3ccc([N+](=O)[O-])cc3)c3ccccc32)N1	806984535	LWHXHCWLHRABCW-DZGCQCFKSA-N	439.428	1.073	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)/C(=C/c1ccco1)n1nnnc1-c1ccccc1	807370130	VTRAKKFHGAWOPT-VKAVYKQESA-N	440.460	1.868	50	20	IDGD	
COC(=O)c1cc(NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc2[nH]ccc12	808872449	PVCOSTKQSATNNZ-UHFFFAOYSA-N	437.460	1.814	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(Oc2cccnc2)cc1	808934438	FMERBKJBBAEUAA-UHFFFAOYSA-N	431.408	1.910	50	20	IDGD	
Cc1cc([N+](=O)[O-])ccc1NNC(=O)C(=O)Nc1ccc(C(N)=O)cc1OCC(F)F	810415712	GXHNWCKEFNROFP-UHFFFAOYSA-N	437.359	1.728	50	20	IDGD	
Cn1ncc(COC(=O)/C(C#N)=C/c2cn(CCC(N)=O)nc2-c2ccc(Cl)cc2)n1	811031424	RDNUXNHPCWZFDS-RIYZIHGNSA-N	439.863	1.858	50	20	IDGD	
CC(C)CC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)NNC(=O)[C@H](C)Oc1cccc(Cl)c1	811461420	ARAHKJMOVWAORF-GUYCJALGSA-N	435.912	1.751	50	20	IDGD	
CN(C)S(=O)(=O)CCNC(=O)NNC(=O)c1cc(-c2ccccc2)nc2ccccc12	812692400	XTVXUFTYFWSVTA-UHFFFAOYSA-N	441.513	1.737	50	20	IDGD	
COCC1(CNC(=O)NNC(=O)c2cc(OC)ccc2Br)CCOCC1	813771936	MYTUJMSBRVVNTM-UHFFFAOYSA-N	430.299	1.845	50	20	IDGD	
Cc1ccc2c(c1)C(=O)N([C@H](C)C(=O)NNc1ccccc1S(=O)(=O)N(C)C)C2=O	817055191	QLNISUCKKLJRLY-CYBMUJFWSA-N	430.486	1.373	50	20	IDGD	
O=C(NNc1ncncc1F)c1ccc(NS(=O)(=O)c2ccc3c(c2)OCCO3)cc1	817082140	OSHCBGOZMJINEN-UHFFFAOYSA-N	445.432	1.945	50	20	IDGD	
COc1ccc([N+](=O)[O-])cc1NS(=O)(=O)c1ccc(C(=O)NNC(=O)CC2CC2)cc1	819136137	NBZZYZKTCLFVHO-UHFFFAOYSA-N	448.457	1.965	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@@H](C)C(=O)NNC(=O)C1CCN(S(C)(=O)=O)CC1	836608843	RYNULEHITMTROM-ZDUSSCGKSA-N	431.942	1.543	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@@H](C)N2C(=O)[C@H]3CCCC[C@H]3C2=O)cc(OC)c1OC	859241727	NWGWKWZKRIPSEF-BNOWGMLFSA-N	433.461	1.037	50	20	IDGD	
COC[C@@H](C)n1c(C)cc(/C=C(/C#N)C(=O)OCC(=O)NC2CCN(C(C)=O)CC2)c1C	897620467	OXVLVVYADIVZDA-IWEBCOIVSA-N	444.532	1.890	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)CNS(=O)(=O)c2cccc(C#N)c2)c1	913419342	HVNUUJCJAYCIGT-UHFFFAOYSA-N	444.513	1.495	50	20	IDGD	
CC(=O)N[C@@H](CC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)c1ccc(Cl)cc1	915164910	SMGYWRZIJDRJSO-KRWDZBQOSA-N	437.905	1.772	50	20	IDGD	
CN(C)N(C(=O)[C@H]1CC(=O)N(Cc2cccc(C(F)(F)F)c2)C1)[C@@H]1CCS(=O)(=O)C1	915830351	XWYCLPYRRGAFLD-GOEBONIOSA-N	447.479	1.546	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)c1	916093897	COFKNQLPCJULPP-UHFFFAOYSA-N	432.414	1.666	50	20	IDGD	
CCC(CC)[C@@H](CNC(=O)NNC(=O)c1nn(-c2ccccc2)cc1O)N1CCOCC1	916256336	SKMFJXHIAMDSRR-GOSISDBHSA-N	444.536	1.659	50	20	IDGD	
COc1cc(OC)cc(C(=O)NN=C(C)c2ccc(S(=O)(=O)N3CCOCC3)cc2)c1	916314499	GNVXZLMZXUYXGV-UHFFFAOYSA-N	447.513	1.879	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)NC1CCC2(CC1)OCCO2	916412436	DXMSNCHTTBGMEP-UHFFFAOYSA-N	431.537	1.215	50	20	IDGD	
C[C@H]1CCCCN1[C@@H](C)CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	916446741	AVBLBTNZSQFXBD-GJZGRUSLSA-N	425.555	1.144	50	20	IDGD	
Cc1cccc(C)c1OCCNC(=O)NNC(=O)c1sc(N2CCOCC2)nc1C	916643966	NRCARBKAYWTRPI-UHFFFAOYSA-N	433.534	1.928	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)CCNS(=O)(=O)c3ccccc3F)n[nH]2)cc1	917175886	MLJPTYVCNKCHEE-UHFFFAOYSA-N	445.476	1.654	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)c2cnns2)c1	917391897	LZMYNVPDQRONHD-UHFFFAOYSA-N	433.471	1.422	50	20	IDGD	
CC(C)S(=O)(=O)CC(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	917559833	NSMYEZSMELETPI-UHFFFAOYSA-N	442.497	1.029	50	20	IDGD	
CNC(=O)NNC(=O)c1ccc(OC)c(S(=O)(=O)Nc2cc(OC)cc(OC)c2)c1	919879447	GNFRHPBLEDKURO-UHFFFAOYSA-N	438.462	1.087	50	20	IDGD	
Cc1ccccc1C1(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)CCOCC1	920031245	ACZULEWCYADOOM-UHFFFAOYSA-N	430.530	1.798	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)[C@H]2CCCN(Cc3cccnc3)C2)c2ccccc2c1=O	920255444	WXDLHLQZKOECCN-SFHVURJKSA-N	448.527	1.875	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NCc2cccc(C(=O)NC[C@H]3CCCO3)c2)cc1	920349167	VFIWQVGMIZZYEJ-HXUWFJFHSA-N	440.500	1.813	50	20	IDGD	
O=C(COc1ccc(Cl)cc1)NNC(=O)Nc1cccc(CN2C(=O)CNC2=O)c1	920931410	OKAURXUGRUIIFF-UHFFFAOYSA-N	431.836	1.624	50	20	IDGD	
CCCNC(=O)NNC(=O)c1cc(S(=O)(=O)N2CCc3ccccc32)ccc1OC	921041774	MFYNEBXIUVDYPP-UHFFFAOYSA-N	432.502	1.801	50	20	IDGD	
O=C(NC1CC1)c1cccc(S(=O)(=O)NNC(=O)c2cncn2-c2ccccc2)c1	1317918275	TYCSBVORHWSQMH-UHFFFAOYSA-N	425.470	1.388	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccccc1)NNc1ccc([N+](=O)[O-])cc1Br	1323924366	VOCVNBVKOYRLRP-UHFFFAOYSA-N	429.252	1.779	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)NC1CCC(O)(c2cccnc2)CC1	1342821522	CXVPKVOJAVSARD-UHFFFAOYSA-N	446.533	1.149	50	20	IDGD	
O=C([C@H](O)CCl)N1CCO[C@@]2(CCN(C(=O)C3(c4cccc(Cl)c4)CC3)C2)C1	1778066763	DAHGVUMBHXNLIV-APWZRJJASA-N	427.328	1.801	50	20	IDGD	
CCNC(=O)N[C@@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CO[Si](C)(C)C)C1	1779545430	LITNUWUSASYLOK-RZQQEMMASA-N	442.633	1.059	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H]1CCN1C(=O)OC(C)(C)C)CCO2	1781215049	HDVCJDVMEWXZOW-AUSJPIAWSA-N	429.945	1.843	50	20	IDGD	
CN(C)c1cccc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)c1	1781334169	MNXZIMDRNSZNDX-QAPCUYQASA-N	428.302	1.887	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C=N/N1CCCCC1)C2	1781997604	DQPYFCMODBFBGC-DLZNAHKKSA-N	443.386	1.755	50	20	IDGD	
CCc1cc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](C)Br)C2)n[nH]1	1781998308	RGLUFAPQGNEUSS-CDHAZOANSA-N	427.343	1.883	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc3cn[nH]c3cn1)C2	1782175745	QJRILDDMSVXUIC-JNAXZKDPSA-N	435.912	1.339	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2	1783355078	IZAYSMYLFVEDGJ-UHIISALHSA-N	426.149	1.773	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)C3=Cc4ccccc4NC(=O)C3)CCO2)C1	1783881122	JFUVKTIVFZTGLN-JTSKRJEESA-N	447.919	1.496	50	20	IDGD	
O=C(CCS(=O)(=O)c1ccccc1)N1CCO[C@@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783947591	VQBHXZLTZDAMMS-SFHVURJKSA-N	449.356	1.484	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)c3ccccc3)C[C@@H]21	1783968131	QSYGRFVQEDKZGB-QSGXVVIFSA-N	439.350	1.731	50	20	IDGD	
CCCNC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)Br)C[C@@H]21	1784376023	LCPKCEXSVREYPR-AJNGGQMLSA-N	432.359	1.056	50	20	IDGD	
CCc1oncc1C(=O)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1	1787554874	TVPFYILEXPBZMR-UHFFFAOYSA-N	433.273	1.978	50	20	IDGD	
Cc1cc(C(=O)Nc2ccc(C3(NC(=O)c4ccc(B(O)O)cc4)CCC3)cc2)cc(O)n1	1788592778	RIZWRSDRJNCROT-UHFFFAOYSA-N	445.284	1.837	50	20	IDGD	
CC(=O)O[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]2C1)C(C)C	1788764666	RDKNXPSEWVSNDH-LSTDLKDCSA-N	428.602	1.405	50	20	IDGD	
CC(C)N1CCC(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]3C2)CC1	1788765679	ODEXVNAJPFXXIJ-UFYCRDLUSA-N	439.673	1.938	50	20	IDGD	
O=C1CC(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Cl)C[C@@H]32)=Cc2ccccc2N1	1789155462	DNQMJTBNPZKMGL-CJCBUOBESA-N	435.883	1.926	50	20	IDGD	
CC(C)N1CCC(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]3C2)CC1	1789921450	JOQYDJLSGRHRHK-QAETUUGQSA-N	448.377	1.777	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)[C@H](O)Cc1ccccc1	1790955830	WSTYPLQFKOZMQQ-FJIDUMEYSA-N	439.350	1.355	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)Cc3ccccc3)[C@H]2C1	1790957570	SNKKKVSYXBVSEO-FUJDEKNSSA-N	439.350	1.353	50	20	IDGD	
CCOc1cnc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](C)Br)[C@H]3C2)cn1	1791057397	UNAZEHCLAGTZJF-ABHRYQDASA-N	441.326	1.252	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21	1791082145	FFYSHMONWSNONN-QMHWVQJVSA-N	447.935	1.900	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CSc1ncccn1	1795839918	MIVAOKVNJOFHNG-XFMPKHEZSA-N	443.367	1.332	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1n[nH]c2c1CS(=O)(=O)C2	1796384660	MISKMYSVYMVRBK-WMEBDMIVSA-N	449.360	1.326	50	20	IDGD	
Cc1nc[nH]c1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)C2	1796609900	KLSUGPYQBJOZNU-QYFXKUKHSA-N	441.438	1.807	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CO)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CO[Si](C)(C)C)C2	1796741785	WMHWTRLIJZVLBC-FZKCQIBNSA-N	443.617	1.362	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc3[nH]ccc3n1)C2	1796892567	QVEUIVYSEWZKMX-CWNKPHDYSA-N	447.499	1.949	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1nn(C)c2c1CCC2	1797048773	FXZKUWBBOILDJN-LMWOUKEDSA-N	439.354	1.286	50	20	IDGD	
C[C@@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2)N1CSCSC1	1797846366	ORJLEHAYVDYNEU-YFKTTZPYSA-N	428.407	1.423	50	20	IDGD	
C[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Br)n1cccc1C=O	1799346620	SWXAZAINCNRMPA-ZZVJUGKHSA-N	430.274	1.142	50	20	IDGD	
CC(C)(C)c1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Br)[nH]n1	1799348908	DAEBZAXLJUYLMR-DJBIQUGXSA-N	431.306	1.601	50	20	IDGD	
Cc1ccc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Br)c(C)n1	1799352483	YXYNVZMHSPLGJR-CYGHRXIMSA-N	442.329	1.911	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2cccnn2c1	1800008708	BCAWPCUPXFUAMG-QHHYFVSCSA-N	425.316	1.774	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2ccnn2c1	1800026494	RKHGODLTXJIKPZ-QHHYFVSCSA-N	425.316	1.774	50	20	IDGD	
CC(C)N1CCC(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)Br)CC1	1800757967	YNNVYFXROHJEOL-LLLHUVSDSA-N	430.387	1.480	50	20	IDGD	
Cc1nc2sccn2c1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)Br	1800759193	KMDDMBSSAKTZNI-SYEHKZFSSA-N	441.351	1.691	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CCc2ccccc2O1)c1cccc(B(O)O)c1	1802234588	OTQNMGZOUVOCAJ-IIZPIQPGSA-N	434.301	1.012	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cccn3nccc23)[C@H]1c1cccnc1)[C@H](O)CCl	1803148658	WCDFWBVQHCMTHM-IPELMVKDSA-N	427.892	1.649	50	20	IDGD	
CN1C(=O)CC[C@H]1C(=O)N1CC[C@H](CNC(=O)[C@@H](F)Br)[C@@H]1c1cccnc1	1808676002	KDGVCLUOZCFNPO-BFJAYTPKSA-N	441.301	1.399	50	20	IDGD	
CN1C(=O)CC[C@H]1C(=O)NC[C@@H]1CCN(C(=O)[C@@](C)(Cl)CCl)[C@H]1c1cccnc1	1808772960	HXAWCOMWXIDWRO-PYWIUJKZSA-N	441.359	1.945	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)c1cc2cccnn2n1	1811264468	XKIBADHQHZBXLL-WBAXXEDZSA-N	428.880	1.044	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)Cn2ccncc2=O)[C@@H]1c1cccnc1	1812868737	LEHLSLKTFWFJJW-DHSIGJKJSA-N	448.321	1.128	50	20	IDGD	
CC1(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)[nH]n2)CCC1	1814401974	FKNYUNOBHOUMJS-MRXNPFEDSA-N	425.493	1.904	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)/C=N/O[C@H]2CCCCO2)[nH]n1)[C@H](O)CCl	1814872708	KAVKKAWMROTBOP-NINBBDOOSA-N	427.889	1.531	50	20	IDGD	
CCC[C@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](COC)NC(C)=O)[nH]n1	1815321270	RPNJKHSKUWDUQE-IMJJTQAJSA-N	427.933	1.960	50	20	IDGD	
C[C@H](O)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)n[nH]1	1815705079	WKYXJBYWVSILSV-UBHSHLNASA-N	443.932	1.915	50	20	IDGD	
O=C(CCN1CCOC1=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](F)Br)CC2	1818694431	JTJYCGFTRWOERZ-QPUJVOFHSA-N	449.302	1.588	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCN2CCOCC2)[nH]n1	1822184830	WUWSDAZOCHSSGE-HIFRSBDPSA-N	442.358	1.908	50	20	IDGD	
C[C@@H](C(=O)N1CCCC[C@H]1c1cc(NC(=O)C(Cl)Cl)n[nH]1)N1CCN(C)CC1	1822420945	GPUTWFPZHQAKSK-JSGCOSHPSA-N	431.368	1.841	50	20	IDGD	
CC(=O)NC(C)(C)C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1	1822998426	CWFNCQQQVHJYOK-GZMMTYOYSA-N	435.319	1.660	50	20	IDGD	
COc1cc(C(=O)N[C@@H]2CCc3nc(NC(=O)[C@@H](F)Br)sc3C2)n(C)n1	1823001858	MBXHFTSCCDVJQV-JMCQJSRRSA-N	446.302	1.802	50	20	IDGD	
O=C(CSc1nc[nH]n1)N[C@@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1	1823014080	NXFUUVIRSLACKV-LHLIQPBNSA-N	449.331	1.656	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)[C@H](O)c2ccco2)CC1	1823772860	AUQPBHSALYWJDI-DYESRHJHSA-N	434.537	1.306	50	20	IDGD	
CN1N=C(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)[C@@H](F)Br)CC2)CCC1=O	1824925734	FMFMZSSFBTUXCA-GDBMZVCRSA-N	445.333	1.905	50	20	IDGD	
O=C(Cc1ccc2c(c1)CCO2)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](O)CCl)CC2	1825528902	JPIMJMDGHUNGFS-ZFWWWQNUSA-N	435.933	1.832	50	20	IDGD	
CCOC(=O)/C=C/C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](C)Br)sc2C1	1825642997	YQMDUVNKKYIJIN-UHHSMLKOSA-N	430.324	1.958	50	20	IDGD	
C=CCNC(=O)/C=C\C(=O)N[C@H]1CCc2nc(NC(=O)[C@H](Cl)COC)sc2C1	1825990896	GHJQYGKHZQHWNG-QHDQMSKJSA-N	426.926	1.167	50	20	IDGD	
CN(C)C(=O)NCC(=O)N1CCC([C@@H]2CCCCN2C(=O)CCBr)CC1	1826354806	MTPWDIJLWGCJBP-HNNXBMFYSA-N	431.375	1.662	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC([C@H]2CCCCN2C(=O)CN(C)C)CC1	1826426480	YFIAHBNNOQWAQN-GXDFBKAQSA-N	430.553	1.302	50	20	IDGD	
CC[C@H](C)[C@@H](O)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827050751	XKXKHXLHAZOWHX-ZLGUVYLKSA-N	430.354	1.007	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H]2CCCO2)CC1	1828925092	DHKOKLBFNCUWSV-MOPGFXCFSA-N	429.521	1.097	50	20	IDGD	
CN(CC(=O)N1CCC([C@@H]2CCCCN2C(=O)CO[Si](C)(C)C)CC1)C(=O)C(=O)O	1829104209	UFGHMUSDYNYLCT-INIZCTEOSA-N	441.601	1.001	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3ccc[nH]3)C2)C1	1830538713	NOCMTNSRBAUNIG-HNAYVOBHSA-N	442.354	1.435	50	20	IDGD	
COc1nn(C)cc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1	1831871428	FESKNTAKOQAXMM-SFHVURJKSA-N	448.568	1.035	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCC(N2CCC(NC(=O)[C@@H]3CCC(=O)NC3)CC2)CC1	1833122171	ZNBWPDFZDYGKEA-VLIAUNLRSA-N	447.407	1.321	50	20	IDGD	
C[C@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)c3cnsn3)CC2)CC1	1833262103	INCAGDFMJVEMSL-GFCCVEGCSA-N	444.399	1.754	50	20	IDGD	
Cc1ccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)cc1	1835085612	MBDZLBDKZBVDSJ-OXJNMPFZSA-N	439.350	1.777	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)NC1CCN(C2CCN(C(=O)C(C)(C)CCl)CC2)CC1	1835706022	HDRPPGGXMBEHBG-OAHLLOKOSA-N	444.020	1.531	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](F)Cl)CC2)CC1)c1cccn(C(F)F)c1=O	1835857869	DCNFPDFPPFQZJY-OAHLLOKOSA-N	448.873	1.963	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC(N2CCC(NC(=O)c3cc(CO)on3)CC2)CC1	1836187997	WKKSSEVWXCBSER-UHFFFAOYSA-N	438.601	1.204	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)c3ccnn3CCOC)CC2)CC1	1836393933	CLHCRHNAIQQRSX-GOSISDBHSA-N	439.988	1.732	50	20	IDGD	
O=C([C@H](O)CCl)N1CCC(OC2CCN(C(=O)[C@H]3CCc4ccoc4C3)CC2)CC1	1836713603	HXFKHXSFZDFFED-QFBILLFUSA-N	438.952	1.983	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@H]3CCNC(=O)C3)CC2)CC1	1836922755	POHMMRRCGSIULL-YJBOKZPZSA-N	427.973	1.919	50	20	IDGD	
O=C(c1cnc(OCF)cn1)N1CCC(OC2CCN(C(=O)[C@H](F)Cl)CC2)CC1	1837307225	MWKNDBMAZGERTL-INIZCTEOSA-N	432.855	1.929	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)CCBr)C2)C1	1837712050	CKYYSGDGCWGKJV-MRXNPFEDSA-N	437.407	1.079	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(Cl)ncn3)CCO2)C1	1838254379	SQPXZJQATNBUHI-SFHVURJKSA-N	431.320	1.465	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)[C@H](C)NC=O)CC2)CC1	1838640510	YZPZEFCFYNJHDZ-XJKSGUPXSA-N	432.359	1.293	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(O)nc3)CCO2)C1	1838655277	WEQMVEMLZVFGGD-KSSFIOAISA-N	442.310	1.031	50	20	IDGD	
Cc1ccc(O)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCBr)C3)C2)c1	1838892107	LHQQQXPYTWEFJA-LJQANCHMSA-N	441.322	1.556	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(C)ccc3O)CCO2)C1	1838894425	SIYCHQDHQOTTCJ-JXFKEZNVSA-N	426.897	1.024	50	20	IDGD	
O=C(c1cccc(F)c1Cl)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1	1839322692	VHHLAAFBJUZJAW-KSSFIOAISA-N	435.279	1.149	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CC(F)(F)F)C2)C1	1839963307	HLMMIPHVXBUBIM-RISCZKNCSA-N	431.249	1.569	50	20	IDGD	
Cc1nc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)cs1	1840031224	JCOXYFJIFNZYCT-YVEFUNNKSA-N	446.367	1.234	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccnc(C(F)F)c3)C2)C1	1840150822	QXWVHZWCOMFUDM-LIRRHRJNSA-N	447.866	1.343	50	20	IDGD	
CC(C)N1CCC(C(=O)N2CCOC[C@@]3(CN(C(=O)C(Cl)Cl)CCO3)C2)CC1	1840186574	KZVKKQCMJMNULQ-IBGZPJMESA-N	436.380	1.367	50	20	IDGD	
C[C@@H](Oc1ccccn1)C(=O)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1840427792	ROAWFBQCDPYUPG-FZKQIMNGSA-N	432.304	1.109	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC2(CCCN2C(=O)c2cnsn2)C1	1842224435	LRWKWRLNDPFLLH-NSHDSACASA-N	429.930	1.487	50	20	IDGD	
CC(C)(C)OC(=O)NCC[C@@H](O)C(=O)N1CC2(CCCN2C(=O)CCBr)C1	1842638944	PCADMUCCBWVXME-CYBMUJFWSA-N	448.358	1.251	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)CC[C@H]2CNc3ccccc3C2)C1	1842955424	YWQLPIPORVSSQS-GOSISDBHSA-N	447.344	1.248	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)N1CCCC12CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)C2	1843338738	DLSSJEWYPJTBOK-AAKUMTKESA-N	431.443	1.522	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H]2O[C@H](C[C@@H]2C(=O)N2CC3(CCCN3C(=O)[C@@H](F)Cl)C2)C1	1843365393	NOWCHEWIOASAIE-LXTVHRRPSA-N	445.919	1.749	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)/C=C/c1cc3ccccc3o1)C2	1844264276	APWKMCSIXYHAID-VOTSOKGWSA-N	445.479	1.962	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)c2ccc3sccc3c2O)C1	1845659903	ZEQIDKCSVOVEBN-UHFFFAOYSA-N	436.298	1.418	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)c1ccc(N3CCN(C)CC3)cc1)C2	1846360180	ZGISTILDKGYWNB-IBGZPJMESA-N	434.968	1.509	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)[C@@H]1[C@H]3Sc4ccccc4[C@@H]31)C2	1846385108	TWLFVLPNRWDVBM-AABGKKOBSA-N	428.558	1.451	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)c1ccco1	1847276617	QPXSTPJBUUVZRK-BXWFABGCSA-N	443.412	1.662	50	20	IDGD	
COc1cc(N2CCC(C(=O)N3CC[C@H]4[C@@H]3CCN4C(=O)[C@@H](F)Cl)CC2)ncn1	1847667986	CJXAPBKLNLDODX-GRDNDAEWSA-N	425.892	1.438	50	20	IDGD	
O=C(COC(=O)[C@@H]1CC(=O)Nc2cc(F)ccc21)NNC(=O)c1cccc([N+](=O)[O-])c1	12935352	PERPQIBAFVMOOR-CQSZACIVSA-N	430.348	1.164	50	20	IDGD	
CSc1ccc([N+](=O)[O-])c(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1	16226047	FNQXCZCQFBTMKV-UHFFFAOYSA-N	438.487	1.642	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)c1ccc(S(=O)(=O)N(C)C(C)C)cc1	26069231	SEZXTTKOMYCLNR-UHFFFAOYSA-N	449.529	1.954	50	20	IDGD	
Cc1cccc(NC(=S)NNC(=O)CN(C)C2=NS(=O)(=O)c3ccccc32)c1C	725907522	GPKIVQFAZLIZTP-UHFFFAOYSA-N	431.543	1.702	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2oc3ccccc3c2CO)cc1OC	726017702	KQZJIETVHPUNQT-UHFFFAOYSA-N	428.397	1.560	50	20	IDGD	
COCCCNC(=S)N(C)NC(=O)CCNS(=O)(=O)c1c(C)cc(C)cc1C	726077233	RIKNDNUUDYOPKW-UHFFFAOYSA-N	430.596	1.154	50	20	IDGD	
COCCCNC(=S)N(C)NC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(F)cc2)C1	726078225	GNVHOQDTAHHFJT-CQSZACIVSA-N	446.570	1.100	50	20	IDGD	
Cc1cc(C(=O)NNC(=S)NCc2ccc(S(N)(=O)=O)cc2)c2ccccc2n1	726436639	DORXCDLDLWGAKM-UHFFFAOYSA-N	429.527	1.500	50	20	IDGD	
O=C(NNC(=S)NCC1CCC1)c1cccc(S(=O)(=O)NC[C@H]2CCCO2)c1	727866022	KUWUXRHFWGSCSV-OAHLLOKOSA-N	426.564	1.053	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(Br)s1)C1CCN(c2ncccn2)CC1	728855856	CZMWYIGPQVCSNG-UHFFFAOYSA-N	446.352	1.527	50	20	IDGD	
CC[C@H](NC(=O)NNC(=O)[C@@H](C)Oc1ccccc1F)c1cccc(S(N)(=O)=O)c1	729613515	UBXYWIBRIVLXCE-WBMJQRKESA-N	438.481	1.722	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)c2sc3nc4n(c(=O)c3c2C)CCC4)cn1	729692412	GWEJRLJZHKIDHQ-UHFFFAOYSA-N	430.515	1.748	50	20	IDGD	
NC(=O)C1CCN(c2ncccc2CNC(=O)NNC(=O)c2cccc3ncccc23)CC1	730126947	WBMLKJRBYFZJOZ-UHFFFAOYSA-N	447.499	1.476	50	20	IDGD	
CCS(=O)(=O)N(C)C1CCN(C(=O)NNC(=O)c2cc3c(s2)CC[C@H](C)C3)CC1	731358149	FYDQAVMLOSVEHQ-ZDUSSCGKSA-N	442.607	1.973	50	20	IDGD	
COc1ccccc1C(=O)NNS(=O)(=O)c1ccc(Br)c(C(=O)O)c1	731494230	UXTMNRLZLZDZCQ-UHFFFAOYSA-N	429.248	1.779	50	20	IDGD	
CCc1ccccc1NC(=O)CN1CCN(C(=O)NNC(=O)c2ccccc2OC)CC1	731500456	FOGYGJYZEOGEMX-UHFFFAOYSA-N	439.516	1.868	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)c1cc(S(=O)(=O)N2CCCCC2)ccc1Cl	731853215	UGMKUDRKOMGMQQ-UHFFFAOYSA-N	425.898	1.621	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(N2C[C@H](C(=O)NNC(=O)C3CCC3)CC2=O)cc1	732141495	RPJAVZVIXNEGTR-OAHLLOKOSA-N	436.534	1.018	50	20	IDGD	
CCCc1nnc(S)n1CC(=O)NNC(=O)c1ccc(OC)c(Br)c1	732176643	WRUAWQMPSZVDGT-UHFFFAOYSA-N	428.312	1.752	50	20	IDGD	
CCCn1c(=O)n(CCC(=O)NNC(=O)CCN2C[C@@H](C)O[C@H](C)C2)c2ccccc21	732259557	HHSYPPPUUYUERE-IAGOWNOFSA-N	431.537	1.250	50	20	IDGD	
COc1ccc(C(=O)NNc2ccccc2S(C)(=O)=O)cc1S(=O)(=O)NC(C)C	732304214	UBUIAXUHJQRUIS-UHFFFAOYSA-N	441.531	1.542	50	20	IDGD	
CCS(=O)(=O)c1ccc(C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1	732333497	RUIRPEUQGVJPBZ-UHFFFAOYSA-N	435.414	1.006	50	20	IDGD	
C[C@@H](CS(C)(=O)=O)N(C)C(=O)NNC(=O)c1ccc(Br)cc1Cl	732677585	QSBOKSRKIHDZLN-QMMMGPOBSA-N	426.720	1.822	50	20	IDGD	
CC(C)N1CC[C@H](NC(=O)NNC(=O)[C@@H](C)Oc2cccc(Br)c2)C1=O	734162566	MAASKHWWNLIMTH-RISCZKNCSA-N	427.299	1.556	50	20	IDGD	
CC(=O)NCC(=O)N1CCc2cc(C(=O)NNC(=O)c3cccc(OC(F)F)c3)ccc21	735635184	XZNITOZBWJPYDR-UHFFFAOYSA-N	446.410	1.388	50	20	IDGD	
C[C@@]1(c2ccc3ccccc3c2)NC(=O)N(CC(=O)NNc2ncnc3[nH]cnc23)C1=O	743472994	IFCWELHUEMABDZ-NRFANRHFSA-N	430.428	1.416	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)[C@@H]1CC(c2ccccc2)=NO1	744620898	QKXXVIKYTLSRHU-SFHVURJKSA-N	430.486	1.344	50	20	IDGD	
CC(=NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1ccc([S@@](C)=O)cc1	746365709	BEEMPSDLKSRAKG-GDLZYMKVSA-N	449.554	1.599	50	20	IDGD	
Cn1ncnc1COc1ccc(S(=O)(=O)NNC(=O)C(C)(C)c2ccccc2)cc1	746592161	VLECOOOLEQSZFS-UHFFFAOYSA-N	429.502	1.681	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)[C@H](C)Oc1cccc(C=O)c1	746758118	WZZFJQYKGVCEGY-LBPRGKRZSA-N	434.832	1.933	50	20	IDGD	
Cc1c(CC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cccc1[N+](=O)[O-]	747705027	IZPQJFYDIJDRAU-UHFFFAOYSA-N	425.489	1.805	50	20	IDGD	
COc1cc(OC)cc(N2CC[C@@H](NC(=O)NNC(=O)COc3ccc(F)cc3)C2=O)c1	747956180	SUVFVRSVARNGFZ-GOSISDBHSA-N	446.435	1.358	50	20	IDGD	
C[C@@H](C(=O)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1)N1C(=O)NC2(CCCC2)C1=O	748520546	RPDGPKGHXADXCS-JTQLQIEISA-N	448.423	1.676	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNS(=O)(=O)c2ccc(OCC(=O)O)c(C)c2)cc1C	748690506	FIJAACMFZXFTNA-UHFFFAOYSA-N	435.458	1.023	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)[C@H]2CCCN2S(=O)(=O)c2cccs2)nc2ccccc21	749161115	UPBLEKZNULKRLL-OAHLLOKOSA-N	447.542	1.178	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)[C@@H]2CCCN2C(=O)c2ccc3c(c2)OCO3)cc1	749559629	BOQDBCQOWLPDQS-KRWDZBQOSA-N	425.441	1.555	50	20	IDGD	
CC(C)(C)OC(=O)N1CSC[C@H]1C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	751325625	LPNJMCGTEKRWFQ-ZDUSSCGKSA-N	429.520	1.161	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccc(C(=O)N3CCCC3)cc2)c1	755608604	FMWPBMKIQUZNHH-UHFFFAOYSA-N	430.486	1.793	50	20	IDGD	
COC(=O)CNC(=O)Cc1ccc(NC(=O)NNC(=O)c2ccc(O)c(Cl)c2)cc1	755863444	KLOQTKMLTHLINY-UHFFFAOYSA-N	434.836	1.344	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)Nc1ncc(Cc2ccccc2)s1	756163222	GMPPLMQIBHBGHO-QGZVFWFLSA-N	438.465	1.660	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1ccc(Cl)cc1OCC(F)(F)F	756575605	IDAVYNUZNWIHQQ-ZETCQYMHSA-N	432.808	1.372	50	20	IDGD	
CC[C@@H]1CN(CC(=O)NNC(=O)Cc2nc(C)cs2)CC[C@@H]1NC(=O)OC(C)(C)C	757110293	MJTVAMOIWRYPDG-CABCVRRESA-N	439.582	1.767	50	20	IDGD	
COC(=O)c1csc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1	757680355	OUJVFMYJEFBRKN-UHFFFAOYSA-N	426.476	1.252	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)N=c2cc[nH]cc2[N+](=O)[O-])c2ccccc2c1=O	757805057	AAICSPMKXWHAIV-UHFFFAOYSA-N	439.432	1.778	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)CN2C(=O)N[C@]3(C[C@@H](C)C[C@@H](C)C3)C2=O)c1	757833764	CVWOAJUMAAVKNE-YEZVWNJWSA-N	444.488	1.046	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)[C@@H]2COc3ccc(Br)cc32)c2ccccc2c1=O	758071624	LYLMUXKSFPOEEG-CQSZACIVSA-N	443.257	1.633	50	20	IDGD	
O=C(c1ccn(-c2ccccc2Cl)n1)N1CCN(S(=O)(=O)CBr)CC1	758527136	IZEGJYHTTSDJFP-UHFFFAOYSA-N	447.742	1.966	50	20	IDGD	
Cc1c(/C=C(\C#N)C(=O)Nc2cc(N3CCCS3(=O)=O)ccc2O)cc(C#N)n1C	759702433	ILDUZDLGSGLBSN-OVCLIPMQSA-N	425.470	1.996	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccncc2)c(OCC(F)(F)F)c1	763461761	CMSUGQKZJADLKI-UHFFFAOYSA-N	440.334	1.209	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)NCc1cccc(CN2CCOCC2)c1	763473847	VDYSHJPKTZIFKD-UHFFFAOYSA-N	430.530	1.847	50	20	IDGD	
COc1ccc(F)cc1NC(=O)C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	763531759	QRTUTIINZKHGEC-UHFFFAOYSA-N	443.479	1.133	50	20	IDGD	
COc1ncnc(N(C)C)c1NC(=O)C(=O)NNC(=O)COc1ccc(C(C)(C)C)cc1	763593967	FNSFAZXVXRVSOU-UHFFFAOYSA-N	444.492	1.014	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccccc2N2CCOC2=O)c2ccccc2n1	763614733	IEAJFPMRPPVOAA-UHFFFAOYSA-N	433.424	1.900	50	20	IDGD	
O=C(COc1cccc(C(F)(F)F)c1)NNC(=O)C(=O)Nc1cnn(-c2ccncc2)c1	763639619	JSNWDYNKEVJEDX-UHFFFAOYSA-N	448.361	1.451	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2cccc(N(C)C)c2)ccc1Br	763756742	DTJCOZSXEJBOEF-UHFFFAOYSA-N	435.278	1.923	50	20	IDGD	
Cc1c(C#N)cccc1NC(=O)C(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12	763790479	JYGNVLFMTATRPL-UHFFFAOYSA-N	432.440	1.557	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)C(=O)Nc1ccc(F)cc1OCC1CC1	763804940	YCBPAVMEULCAEN-UHFFFAOYSA-N	446.391	1.688	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccccc2-c2nncn2C(C)C)cc1	763809278	MJFHHINMMPGVTF-UHFFFAOYSA-N	436.472	1.999	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cccc(-n3nnnc3C)c2)c1C	763841132	NUWWUKLJQGYCLE-CQSZACIVSA-N	437.460	1.141	50	20	IDGD	
CCc1cc(NC(=O)C(=O)NNC(=O)c2nn(CCC(C)C)c(=O)c3ccccc23)no1	763842075	AUVLQKKGJKYRFD-UHFFFAOYSA-N	440.460	1.393	50	20	IDGD	
COCCOc1cc(NC(=O)C(=O)NNC(=O)Cc2c[nH]c3ccccc23)ccc1OC	763865809	XKDJRQHWXZNBGN-UHFFFAOYSA-N	440.456	1.530	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1cc(C(F)(F)F)cnc1O	763872102	KCLIMKUXHMQSTH-QMMMGPOBSA-N	430.314	1.499	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccccc2-n2cncn2)cc1	763872575	OPYMKUILOOEPIJ-AWEZNQCLSA-N	436.428	1.023	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(C(=O)N(C)C)c2)cc1OC	763912416	ZOXSTCHYTKWYOF-UHFFFAOYSA-N	442.472	1.586	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccc(CN2C(=O)CCCC2=O)cc1	763919387	PIXSCDUOODYLIL-UHFFFAOYSA-N	440.431	1.193	50	20	IDGD	
NC(=O)CCOc1ccccc1NC(=O)C(=O)NNC(=O)c1cc2c(s1)CCCCC2	763968481	PQHACLAJNFUEET-UHFFFAOYSA-N	444.513	1.671	50	20	IDGD	
Cc1ccc(C(=O)NC2CC2)cc1NC(=O)C(=O)NNC(=O)c1cc(Cl)ccc1O	763973643	DBRKIEBPHSKPBS-UHFFFAOYSA-N	430.848	1.646	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)Nc1nnc(C(C)(C)C)s1	764004859	PGACKGQYQRFCDD-UHFFFAOYSA-N	429.300	1.336	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1cccc(C(=O)NCc2ccccn2)c1	764040833	NKBFEPDCQAWOEQ-UHFFFAOYSA-N	447.451	1.420	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)Cc2ccc3ccccc3c2)cc1	764085050	OAXNXQGYVDVMBB-UHFFFAOYSA-N	425.466	1.572	50	20	IDGD	
CN1CCC(N(C)c2ccc(NC(=O)C(=O)NNC(=O)c3ccc(Cl)nc3)cc2)CC1	764097951	IEGAQCJFGWVBBX-UHFFFAOYSA-N	444.923	1.665	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(-n3ccnn3)cc2)o1	764138113	BPPXBFCCJDJFSQ-UHFFFAOYSA-N	425.449	1.102	50	20	IDGD	
CSc1nnnn1-c1cccc(NC(=O)C(=O)NNC(=O)c2cccc3cccnc23)c1	764149637	XHPJIPWSJDXDQO-UHFFFAOYSA-N	448.468	1.332	50	20	IDGD	
O=C(COC(=O)COC/C=C/c1ccccc1)NNC(=O)[C@@H]1COc2ccccc2O1	764196122	LTUSKTIJOJUHAX-AIADIJKESA-N	426.425	1.247	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)C(=O)Nc2cccc(I)c2)c1	764238237	RGTMAJSKMXKMPF-UHFFFAOYSA-N	434.193	1.563	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)C(=O)Nc1ccc(Cl)cc1Cl	764258837	AMAJCTLCICQZQM-UHFFFAOYSA-N	437.287	1.786	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1ccc2c(c1)nc1n2CCCCC1	764275701	QXDYTWMRYQWXMR-UHFFFAOYSA-N	437.456	1.633	50	20	IDGD	
COC(=O)c1cc(F)c(F)cc1NC(=O)C(=O)NNC(=O)CCCc1cccs1	764339328	KBNJTYOXTYFAPA-UHFFFAOYSA-N	425.413	1.922	50	20	IDGD	
C[C@@H]1COCCN1c1ccc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1	764344034	XZSHDDGSFKELKM-MRXNPFEDSA-N	448.483	1.497	50	20	IDGD	
CCc1onc(C)c1NC(=O)C(=O)NNC(=O)c1cc(-c2ccc(OC)c(OC)c2)[nH]n1	764377421	DTYDUGDTFYSCQZ-UHFFFAOYSA-N	442.432	1.352	50	20	IDGD	
O=C(NNC(=O)C(F)(F)Oc1ccccc1)C(=O)Nc1cnn(Cc2ccncc2)c1	764379739	IVBZXVZEGAKSEG-UHFFFAOYSA-N	430.371	1.084	50	20	IDGD	
Cn1c(=O)oc2cc(NC(=O)C(=O)NNC(=O)c3cc(-c4ccc(F)cc4)[nH]n3)ccc21	764387643	LYITVHYCNXWMFI-UHFFFAOYSA-N	438.375	1.060	50	20	IDGD	
CN(C)C(=O)c1cc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)ccc1F	764393160	CVGMQZGBFUSALG-UHFFFAOYSA-N	434.449	1.111	50	20	IDGD	
Cn1c(S(=O)(=O)NNC(=O)c2nc(Cl)c(Cl)c(N)c2Cl)cnc1Cl	765032360	VEYXSOGNEFPQJB-UHFFFAOYSA-N	434.092	1.634	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)ccc1OC	765566476	XJWJUBSKLUNCKN-UHFFFAOYSA-N	435.487	1.130	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)Cn2nc(-c3ccccc3)oc2=O)n[nH]1	765587612	FPWVLABZRMUNJV-UHFFFAOYSA-N	434.412	1.363	50	20	IDGD	
CSc1nc(O)nc(C)c1C(=O)NNC(=O)CN1CCN(Cc2ccc(C)cc2)CC1	766650367	TUCBZJPNEMXJNN-UHFFFAOYSA-N	444.561	1.100	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)NOCC(F)(F)F)cc1	766763318	QGNVOQYTGJPBIF-JYRVWZFOSA-N	437.378	1.951	50	20	IDGD	
O=C(NCCNS(=O)(=O)c1ccccc1[N+](=O)[O-])NNc1ncnc2ccsc12	767024825	JPIBTDAZGJYFNY-UHFFFAOYSA-N	437.463	1.204	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)C[C@H]2CN(C(=O)OC(C)(C)C)CCO2)c1	767490808	IPPGPDMNMPIEGI-INIZCTEOSA-N	435.477	1.325	50	20	IDGD	
COc1ccccc1N1C[C@@H](C(=O)NNc2c(OC)cccc2S(C)(=O)=O)CC1=O	768612448	NDOVKANGEWLMGA-ZDUSSCGKSA-N	433.486	1.604	50	20	IDGD	
COCCC1(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)CC1	769215199	KGFLLLLYUWDNOX-UHFFFAOYSA-N	438.550	1.622	50	20	IDGD	
NS(=O)(=O)c1ccc(NC(=O)COC(=O)[C@@]23CC[C@@H](C[C@@H]2Br)C3)cc1	769982725	RLHRTDKBAVSDMY-YNZJMPHRSA-N	431.308	1.769	50	20	IDGD	
CSCCNC(=S)NNC(=O)[C@H]1CCCN1C(=O)c1ccccc1OC(F)F	770240117	MUDROCKFUYTADY-GFCCVEGCSA-N	432.518	1.751	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)NC3CCN([C@@H]4CCCC[C@H]4O)CC3)nc21	770411324	GDHMFFDOICVUTR-HZPDHXFCSA-N	446.556	1.681	50	20	IDGD	
Cc1cc(C(=O)NNc2ccc(Br)c(F)c2)nc2c1c(=O)n(C)c(=O)n2C	771680691	LVWHFAPVZOYYDB-UHFFFAOYSA-N	436.241	1.599	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)c1cn(-c2ccccc2Br)nn1	771994889	TYJCIYGAUULNKM-NSHDSACASA-N	438.282	1.769	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)cc2c1OCCO2	773417233	RBCRFOFXTOULSD-CYBMUJFWSA-N	435.477	1.875	50	20	IDGD	
O=C(Cc1ccc2ccccc2c1)NNC(=O)Nc1ccnn1[C@H]1CCS(=O)(=O)C1	776055394	JBYHFWUVKANMLA-KRWDZBQOSA-N	427.486	1.791	50	20	IDGD	
CSCCCCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	776258549	VDOWSCCBICSKBI-UHFFFAOYSA-N	428.580	1.948	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2[C@@H](C)CN(C(=O)OC(C)(C)C)C[C@H]2C)n1	778291515	GIDBWFZMNXCJIT-OKILXGFUSA-N	425.555	1.471	50	20	IDGD	
COc1ccc(Cn2nccc2NC(=O)NNC(=O)Cc2cc[nH]n2)c(OC)c1OC	779462593	VOCUKNMDEZODAC-UHFFFAOYSA-N	429.437	1.076	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NC[C@@H]2CC(=O)N(C3CC3)C2)cc1Br	780892316	KUNJTJVFYMEUGJ-JTQLQIEISA-N	425.283	1.413	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)Cc1ccc(S(=O)(=O)C(C)C)cc1	781306599	NEJOPAACSVTKMJ-UHFFFAOYSA-N	446.525	1.653	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ncccc2C(F)(F)F)cc1NS(C)(=O)=O	783119532	HPDZDZAIFSRBGE-UHFFFAOYSA-N	447.395	1.562	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccc(COC(C)C)cc2)nc1	783264960	UQXFWKJBJNOVJS-UHFFFAOYSA-N	449.533	1.775	50	20	IDGD	
Cc1cc(F)ccc1NNC(=O)C(=O)Nc1ccc(NC(=O)CN2CCOCC2)cc1	783445662	ZAAMEXLNJQWPDH-UHFFFAOYSA-N	429.452	1.487	50	20	IDGD	
Cc1cc(F)ccc1NNC(=O)C(=O)Nc1ccc(CC(=O)N2CCN(C)CC2)cc1	783446116	HIHLUUGNGGUUQZ-UHFFFAOYSA-N	427.480	1.532	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)C(=O)Nc1ncn(C2CCCCC2)n1	784210517	RXOMMMFGSSCVAA-UHFFFAOYSA-N	447.521	1.306	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)C(=O)Nc2ccc3oc(=O)n(CCN(C)C)c3c2)c1	784854661	KSLJXTKJYGLNKR-UHFFFAOYSA-N	441.444	1.025	50	20	IDGD	
O=C(NNc1ccc(C(F)(F)F)nn1)C(=O)Nc1cccn(Cc2ccccc2)c1=O	784891163	GJWPEFHTJBUMRC-UHFFFAOYSA-N	432.362	1.787	50	20	IDGD	
CC(C)OC(=O)c1c(NC(=O)C(=O)NNc2nccn(C)c2=O)sc2c1CC[C@@H](C)C2	785090447	RXCUQHJSTFLAPS-LLVKDONJSA-N	447.517	1.614	50	20	IDGD	
Cc1ccc(-n2cccn2)cc1NC(=O)C(=O)NNC(=O)C(F)(F)Oc1ccccc1	789587103	WQVDMOKYVKZKIZ-UHFFFAOYSA-N	429.383	1.938	50	20	IDGD	
O=C(NNC(=O)[C@H]1OCC[C@H]1c1ccccc1)C(=O)Nc1ccnn1CCc1ccccc1	789809605	BHPWHFCAHNTFBJ-FPOVZHCZSA-N	447.495	1.784	50	20	IDGD	
Cc1ccc(-c2nnc(S)n2CCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1	790089660	GYBWMHGDTIWVBK-QGZVFWFLSA-N	439.497	1.920	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)Nc1ccccc1N1C[C@H]2CC[C@H]1C2	790956862	MWEQETDOCWOISP-AVYPCKFXSA-N	436.468	1.601	50	20	IDGD	
CC[C@H](C)[C@H](OC)C(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	792789083	HUPHPOPHINZNHI-KXBFYZLASA-N	433.530	1.987	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1	793024859	GUWOPXZXTLPDTB-UHFFFAOYSA-N	435.234	1.994	50	20	IDGD	
CN(C)C(=O)Nc1ccc(CNC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc1	793497905	ZUXFEVOXKWIONK-UHFFFAOYSA-N	437.460	1.816	50	20	IDGD	
COC(=O)C[C@H]1CCC(=NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)[C@@H]1C	794452729	BKIBUGDDWFAPCA-HUUCEWRRSA-N	437.518	1.403	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2c(F)ccc(C)c2Br)n1	797000143	RGRQFEXFXKCGNQ-UHFFFAOYSA-N	426.246	1.496	50	20	IDGD	
CCNC(=O)N(C)c1cccc(NC(=O)C(=O)NNc2nccc(N(CC)CC)n2)c1	797102347	AGKOPWPBDIQEFT-UHFFFAOYSA-N	428.497	1.570	50	20	IDGD	
O=C(NCc1ccncc1OCC(F)(F)F)NNC(=O)[C@H]1COc2ccccc2O1	798525285	PPMXFCVIKGORAE-OAHLLOKOSA-N	426.351	1.693	50	20	IDGD	
CO[C@@H](C(=O)NNc1nc2ccccc2c(=O)n1CCCOC(C)C)c1cnn(C)c1	798967172	QIUZQKBHUXLOSM-GOSISDBHSA-N	428.493	1.776	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N1CC[C@@H](S(C)(=O)=O)C1	799859397	HBBTUNHQEDAFOK-GXFFZTMASA-N	434.312	1.076	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2CC(=O)N(C(C)(C)C)[C@@H]2c2cnn(C)c2)cc1	801110841	HSSNEXOWHGHLAT-SJLPKXTDSA-N	440.504	1.203	50	20	IDGD	
CC(=O)N1CCN(S(=O)(=O)c2cc(C(=O)NNc3ccc(C#N)cc3)ccc2F)CC1	801176360	VNYYVEXICSKUJG-UHFFFAOYSA-N	445.476	1.307	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2ccc(S(=O)(=O)NC[C@@H]3CCCO3)cc2)cc1	802052149	LBSHYMNUFBRMDY-KRWDZBQOSA-N	448.501	1.619	50	20	IDGD	
CCCN(NC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)C(=O)OC(C)(C)C	804592588	QRHAQNFFCTXKRW-UHFFFAOYSA-N	427.523	1.999	50	20	IDGD	
CSSCCNc1ccc(S(=O)(=O)NCCN2CCOCC2)cc1[N+](=O)[O-]	804700300	XAGZCOUVIDBNPK-UHFFFAOYSA-N	436.581	1.628	50	20	IDGD	
O=C(NNC(=O)N1CCC(C(=O)Nc2ccccc2)CC1)c1ccc(-n2cnnn2)cc1	807135485	JHWPXBLTUKQRKE-UHFFFAOYSA-N	434.460	1.367	50	20	IDGD	
COc1ccc(CNC(=O)NNC(=O)c2c(Cl)cccc2Cl)cc1S(N)(=O)=O	808263650	CTOLSWMQWNQQRD-UHFFFAOYSA-N	447.300	1.794	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1ccnc(N2CCC[C@H](C)C2)c1	812450649	PNVPONQRZCNXSK-AWEZNQCLSA-N	444.561	1.994	50	20	IDGD	
CN(c1ccccc1NC(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1)S(C)(=O)=O	812952447	WTROJODIJPSTPM-UHFFFAOYSA-N	441.535	1.481	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)C1CCC(OC[C@H]2CCCO2)CC1	815408389	HAYVVIVIPSOTLK-NKELODKYSA-N	431.537	1.595	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)cc(OC)c1C	815629098	UIJZITYRXYMOAK-LPHOPBHVSA-N	427.457	1.671	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCc2nncn2C1)C(=O)Nc1cc(Cl)cc(C(F)(F)F)c1	815693312	SNVIERYMOAHVKS-MRVPVSSYSA-N	430.774	1.299	50	20	IDGD	
COc1cc(F)c(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)N(C)C)cc1F	815751202	UEUXAPLFGWBLBX-UHFFFAOYSA-N	428.417	1.306	50	20	IDGD	
CCOc1ccc(NNC(=O)C(=O)N2CCc3cc(S(=O)(=O)N(C)C)ccc32)cc1	815816049	FHWXABAKKUGMJD-UHFFFAOYSA-N	432.502	1.368	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)[C@@](C)(O)Cn2c(C)cccc2=O)c1	818750976	TXUJVYRNPDVHJC-SFHVURJKSA-N	438.278	1.600	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)N[C@H]2CCc3c(nc(C)n3CCO)C2)c1C	819745097	QJJXVHIASCAPAX-CBXNMNPBSA-N	425.533	1.829	50	20	IDGD	
O=C(CN1CCN(CC(=O)NNC(=O)c2cccc(Cl)c2)CC1)NCc1ccccc1	822107296	YJUKIFLSIFCRAJ-UHFFFAOYSA-N	443.935	1.035	50	20	IDGD	
O=C(NN=C1CCN(Cc2ccccc2)C1)c1cccc(S(=O)(=O)N2CCOCC2)c1	839383706	NQOMXGLEQMNOPT-UHFFFAOYSA-N	442.541	1.699	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)Cc2c(C)nc3nc(SC)nn3c2C)c1	849366773	KTLQDOJGOBIBFX-UHFFFAOYSA-N	429.506	1.274	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)[C@H]2CCCN(C(=O)Cc3ccccc3)C2)cc1	914942468	LHOSTLIXUGBSGN-FQEVSTJZSA-N	437.496	1.781	50	20	IDGD	
CNS(=O)(=O)c1ccc(C(=O)NNC(=O)COc2ccccc2Cc2ccccc2)o1	915059938	IVHAVEBEPYWWOG-UHFFFAOYSA-N	443.481	1.619	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCCOc2ccccc2F)nc1	915889906	QDNQOHBSRQEVQW-UHFFFAOYSA-N	425.486	1.956	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)NCCN2CCN(Cc3ccccc3)CC2)c1	915902588	WVVLLYGQRFDXTR-UHFFFAOYSA-N	439.560	1.830	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)CCCn1cnc2ccccc21	916134533	OCGCGBXPIVUIQK-UHFFFAOYSA-N	428.518	1.879	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)N[C@@H](C)c2cccc(S(N)(=O)=O)c2)cc1OC	916197048	LQOCNLCJFPMGKH-LBPRGKRZSA-N	436.490	1.447	50	20	IDGD	
O=C(NCc1ccccc1CS(=O)(=O)N1CCOCC1)NNc1cncc(Cl)n1	916229578	QVKSBPFDXYONID-UHFFFAOYSA-N	440.913	1.118	50	20	IDGD	
COc1cc(C=NNC(=O)C(N)=O)ccc1OS(=O)(=O)c1ccc(Cl)c(Cl)c1	916272454	VWLPNDZAXUPKEL-UHFFFAOYSA-N	446.268	1.705	50	20	IDGD	
CC(=NNC(=O)c1nnc(O)c2ccccc12)c1ccc(OCC(=O)N2CCOCC2)cc1	916320433	UTMKCGZYNTVUHN-UHFFFAOYSA-N	449.467	1.727	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)NCc2ccc(N3CCO[C@@H](C)C3)nc2)c1	916393012	QFBFIZBBVAIIDS-KRWDZBQOSA-N	427.505	1.833	50	20	IDGD	
CCOC(=O)N[C@H](CNC(=O)NNC(=O)c1csc(N2CCOCC2)n1)CC(C)C	916632327	UUOOIUGUKVNYSR-ZDUSSCGKSA-N	442.542	1.085	50	20	IDGD	
CC(=O)NCc1ccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc1	921160021	MYLVSBGHLAXMAD-UHFFFAOYSA-N	444.513	1.182	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2cncn2-c2ccccc2)cc1C	1317710216	WPDWAMCVFABJHT-UHFFFAOYSA-N	427.486	1.229	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)CC(C3CC3)C3CC3)CC2)cc1	1319420512	CFGRSTMPISNWLV-UHFFFAOYSA-N	448.589	1.275	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2ccc(Cn3cccc3)cc2)ccc1Cl	1322510580	OYOOAOHSGNAICS-UHFFFAOYSA-N	432.889	1.912	50	20	IDGD	
CC1=CC[C@H](C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C3)CC1	1778750050	KTFWNHJIJJYJEL-YCRNBWNJSA-N	434.581	1.620	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](C)n3ccccc3=O)C2)C1	1779265575	WVXURZIYMLZVJQ-SPYBWZPUSA-N	440.338	1.270	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CC1CCC1)C2	1779374947	HRTPWOJFZZGTRK-XMSQKQJNSA-N	429.521	1.003	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C=C(/C)C(=O)O)C2	1781904441	WODXRDBIQYZGIG-VBCUROGJSA-N	431.327	1.705	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@H](C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)C1	1783866775	XAKOHGNAKVXQEK-AHXJXLJNSA-N	449.317	1.486	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cnccc3C(F)(F)F)CCO2)C1	1783877458	YTTVDJJSQJGOHD-YOEHRIQHSA-N	435.830	1.798	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccccc3OC(F)F)CCO2)C1	1783883892	MTYYVTDEIXXHQW-IFXJQAMLSA-N	432.851	1.985	50	20	IDGD	
CCc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]3C2)no1	1783970574	WVMLOPPKKPKUFC-DUPGQFARSA-N	428.327	1.861	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](C)Oc3cccnc3)C2)C1	1784539709	NOZAVRKMHCQGDO-VCBZYWHSSA-N	440.338	1.710	50	20	IDGD	
O=C(Cc1cccnc1Cl)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21	1785166822	LQWNOGSDBPJACB-PWNZVWSESA-N	448.720	1.948	50	20	IDGD	
Cc1ccc2nc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)[C@H](O)CCl)C[C@@H]43)ccc2c1	1787863755	DWOMMUIRQSMTSJ-FEHORTKBSA-N	431.920	1.736	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc4cc(C)ccn4c3=O)[C@H]2C1	1788041579	CUCIRMALXNKJGR-DKIMLUQUSA-N	446.935	1.614	50	20	IDGD	
O=C([C@@H](O)CCl)N1CC[C@H]2CO[C@@H](CNC(=O)C3(c4cccc(Cl)c4)CC3)[C@H]2C1	1788086850	AJTKXEIFEVCXLJ-MGHWNKPDSA-N	441.355	1.951	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)c1ccc(Cl)nc1Cl	1788828375	NYKIYLUAWIKFFU-BQUFFADESA-N	436.723	1.581	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(Cl)nn3)[C@H]2C1	1788837752	BIQKBQXYVDUBPR-BLFANLJRSA-N	431.718	1.507	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccnc3S)C[C@@H]21)[C@@H](F)Br	1789920928	ICNZLHSXDPOEIL-XYJRDEOASA-N	432.315	1.654	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)COc3cccnc3)C[C@@H]21)[C@@H](F)Br	1789922494	NRTYSCZAYMLUQP-ATVPRXPUSA-N	430.274	1.131	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)c1ccc(-c2cccnc2)cc1	1789983878	UYJRGSZEDFRNOL-TUFLPTIASA-N	443.931	1.942	50	20	IDGD	
CN1CCCn2nc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)C(Cl)Cl)C[C@@H]43)cc2C1	1790524652	TYIWLNBXFAQFOS-NOLJZWGESA-N	444.363	1.116	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cn(C)nc3C(F)F)C[C@@H]21	1791255015	ZLZHRGVHWBFUQG-VTPLQMEGSA-N	434.871	1.205	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC1(c2ccc(NC(=O)c3cncc(O)c3)cc2)CCC1	1791468305	CIXDGGOWCUSMTI-UHFFFAOYSA-N	446.467	1.847	50	20	IDGD	
CC(C)N1CCC(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)CBr)CC1	1792869046	ZXKMRRKTBAKZBN-NRSFXHEJSA-N	444.414	1.727	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCN1C(=O)Cc2ccccc2C1=O)[C@H](F)Cl	1793199932	HSUIMFOODNEZPX-YGTYGHESSA-N	435.883	1.774	50	20	IDGD	
CC(C)c1nc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Br)C3)no1	1794002674	XIOUFBUKWLUCJQ-DJBIQUGXSA-N	433.278	1.016	50	20	IDGD	
COC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)C2	1795134673	NDDMSUCHBLHUHU-JXOOJLASSA-N	447.438	1.415	50	20	IDGD	
CCOCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN(C)NC(=O)NCc1ccccc1)C2	1795606655	YEBKPDDQLIIRNF-REPLKXPHSA-N	431.537	1.007	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)COCc1ccccc1	1795863544	OVNWLEHHUJZFRG-BCDXTJNWSA-N	437.500	1.154	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc(Cl)cc1[N+](=O)[O-])C2)[C@@H](F)Cl	1796361358	ONXYCYJEHDLMPA-OXUXUCFPSA-N	434.251	1.915	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Cl)C1CC1	1796361871	WZZUAERSGJJNCQ-QZCUMHFISA-N	447.935	1.804	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CC(c3ccccc3)=NN1)C2	1797957281	KAJQPNWIJFRATC-SHJAMOMRSA-N	444.608	1.194	50	20	IDGD	
C[C@H](Cc1ccncc1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnccc1C(=O)NN	1798443135	VNCVCPNNANBARA-NRSFXHEJSA-N	436.516	1.211	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cn1ccc3sccc3c1=O)C2	1799263461	MBBCEZSAGIWEON-HRJSJKBJSA-N	437.949	1.670	50	20	IDGD	
Cc1nnc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)Br)s1	1800756311	AGDSEGSDTVRKEV-BTABJRDXSA-N	431.356	1.152	50	20	IDGD	
Cc1c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C(Cl)Cl)ccc2c1OCCO2	1801016114	HYFCZVWXPDIQJC-JJLQDPRZSA-N	429.300	1.773	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](COC)NC(=O)OC(C)(C)C)C2	1802277156	PXOPADMIMQSLGR-YIDVYQOGSA-N	447.960	1.418	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1csc3c1CCCO3)C2	1802332597	DYFXDPKLXHNNRD-QDMKHBRRSA-N	434.562	1.698	50	20	IDGD	
C=CCNC(=O)/C=C\C(=O)NC[C@@H]1CCN(C(=O)C(Cl)Cl)[C@H]1c1cccnc1	1802497434	HNMTWEOMLIFMFN-DEUPEYTOSA-N	425.316	1.750	50	20	IDGD	
COc1ccc(CC(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)cc1	1803138271	INFYUGGZJPGVJC-LMNJBCLMSA-N	431.920	1.938	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H]1CCC[C@@H]1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](O)CCl)C2	1804408886	CHPJCEFKJAGRRW-FQMQPWHVSA-N	443.972	1.918	50	20	IDGD	
O=C(/C=C/c1ccc(O)c(O)c1O)N1CCC2(CCCN(C(=O)[C@@H](O)CCl)C2)CC1	1805529014	FOSMIOQFCYYJJT-WMHVBEDNSA-N	438.908	1.648	50	20	IDGD	
CN1CCN(CCC(=O)NC[C@@H]2CCN(C(=O)[C@H](F)Cl)[C@H]2c2cccnc2)CC1	1806914431	PULYLEXCFYSOJJ-WDSOQIARSA-N	425.936	1.259	50	20	IDGD	
Nc1ccccc1/C=C/C(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1	1807209726	AKIFRPIYTSYFCJ-QRJDGWPFSA-N	428.920	1.983	50	20	IDGD	
C[C@H](C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)n1cccc1	1807367476	LMPMTIPVYGRKAG-AGHHOFFYSA-N	446.316	1.144	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)c2cccs2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1	1807369772	UTJKNHAOUDWYMJ-XLIONFOSSA-N	435.314	1.456	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)CCc2ccoc2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1	1807374155	IWNKWRDAJGMZCT-NFBKMPQASA-N	447.300	1.307	50	20	IDGD	
COCCOCC(=O)N1CC[C@H](CNC(=O)[C@H](F)Br)[C@@H]1c1cccnc1	1808661317	IERVULYEIYEVEO-KBMXLJTQSA-N	432.290	1.441	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)c1cnn2ccccc12	1809068460	DFCZJHONMCTHRB-IPELMVKDSA-N	427.892	1.649	50	20	IDGD	
Cc1nc2ncccn2c1C(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1	1809294503	KIYXGKGSXAXYNQ-XYJFISCASA-N	442.907	1.352	50	20	IDGD	
CC(=O)NC(C)(C)C(=O)N1CC[C@H](CNC(=O)CO[Si](C)(C)C)[C@@H]1c1cccnc1	1810537510	JAAJBGHXULHLOH-MJGOQNOKSA-N	434.613	1.854	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@H](CNC(=O)c2n[nH]cc2[N+](=O)[O-])[C@H]1c1cccnc1	1810640853	VQJHKEOJBQMXPW-KBXCAEBGSA-N	446.540	1.884	50	20	IDGD	
CC(=O)N[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@@H]1c1cccnc1	1812657025	DKGJNAHSLFFGCN-AQNFWKISSA-N	429.290	1.303	50	20	IDGD	
O=C(CN1CCCC1=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](F)Br)CC2	1814597295	AFZIEUBTCSDGJX-AMIZOPFISA-N	433.303	1.368	50	20	IDGD	
C[C@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](N)c3ccccn3)sc2C1	1815022240	KHECPEKJDYESTD-BHDSKKPTSA-N	438.351	1.934	50	20	IDGD	
Cc1ccc(CC(=O)N[C@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)cc1	1815339824	QREJJCOQPYPCKH-SFHVURJKSA-N	449.341	1.600	50	20	IDGD	
Cc1cccc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)n1	1815355587	WUOPYLURBHHBNZ-HNNXBMFYSA-N	436.302	1.066	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)CC2CCOCC2)n[nH]1	1817165735	ATJXKWCAANRLBW-KRWDZBQOSA-N	434.541	1.592	50	20	IDGD	
Cn1cc(F)cc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1	1817471883	TYDXNARQZBUFII-QGZVFWFLSA-N	439.256	1.187	50	20	IDGD	
Cc1ncc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)CCC(=O)NN(C)C)CC3)s1	1817894773	YIKUAKFIWBPUSK-NSHDSACASA-N	436.563	1.507	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H]1CCNC(=O)C1)CC2	1822869919	OYKOFXKIPMABBY-YMNVWFMLSA-N	433.361	1.818	50	20	IDGD	
O=C(CC(F)(F)C(=O)O)N[C@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1	1823002423	DBHPCUCLJWCPCZ-CDUCUWFYSA-N	444.229	1.856	50	20	IDGD	
CN1C(=O)CC[C@H]1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](F)Br)CC2	1823051225	GSSYQHAILQDLTO-FDOIEUKUSA-N	433.303	1.366	50	20	IDGD	
Cc1cccc(C)c1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2	1823514846	IKGLPPNCAPWXOG-QGZVFWFLSA-N	449.341	1.979	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](O)CCl)CC2)c1c(F)ccc(O)c1F	1823632686	DPASHRFMUDQWMD-WRWORJQWSA-N	431.848	1.952	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)c2ccns2)CC1	1825676867	WKPJKGYWTCNBFA-GOSISDBHSA-N	427.335	1.370	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](O)CCl)CC2	1825958924	OKVIHSWMBKKDRL-GFQSEFKGSA-N	441.937	1.410	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)Cc1cccc(OC)n1)CC2	1825993618	LXMDZOFBDINBEV-STQMWFEESA-N	438.937	1.955	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)c2nccs2)CC1	1826111089	YRZQLWWJUNPFEG-GOSISDBHSA-N	427.335	1.370	50	20	IDGD	
CC[C@H](NC)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)CC1	1827037145	OZTGUCDTHJUIDQ-NONYBHDDSA-N	444.580	1.738	50	20	IDGD	
CSCC(C)(C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827055828	LKZKWHXTROJESB-FQEVSTJZSA-N	446.422	1.989	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccn4cncc34)C2)C1	1830362392	UXLVMDAXVSYWNX-NRFANRHFSA-N	434.924	1.669	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2CCCS2(=O)=O)CC1	1831286313	VYQYSAZMKXFKEG-BPUTZDHNSA-N	449.411	1.967	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@H]2CNC(=O)C2)CC1	1831553009	FAIFYARUGJHHRC-PMPSAXMXSA-N	428.371	1.916	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnnc(Cl)c3)C2)C1	1831644556	ZPAWWPYGPHBQED-RDTXWAMCSA-N	431.320	1.608	50	20	IDGD	
CS(=O)(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCBr)CC1	1832394356	BIDFFGDQBUGTRF-OAHLLOKOSA-N	437.400	1.826	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3ccc(OC)nc3)CCO2)C1	1832581326	DDWJZGFOAWTCOE-UWJYYQICSA-N	439.940	1.497	50	20	IDGD	
O=C(Cc1ccc(Cl)s1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1832602802	HIOITCACRLIVDG-GDBMZVCRSA-N	425.309	1.935	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cnc(Cl)nc3)CC2)CC1	1833015231	SUUVJQVLVDVATM-MRXNPFEDSA-N	444.363	1.569	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)C(F)(F)C(F)F)CC2)CC1	1833649779	UUWXYQXFWWMROL-ZDUSSCGKSA-N	431.858	1.712	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)C3CCC(CO)CC3)C2)C1	1834819461	OHWSIRXYKXZYIZ-RJYAGPCLSA-N	447.370	1.027	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cc4ccccn4n3)CC2)CC1	1835302682	IQOKDQKCZPJNQR-LJQANCHMSA-N	447.967	1.773	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)NC1CCN(C2CCN(C(=O)[C@H](Cl)CCC)CC2)CC1	1835827819	YSFNHYYWMITEHL-CRAIPNDOSA-N	426.989	1.656	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(F)c(C)c3N)CCO2)C1	1835873164	NQKFCESQGBCRJZ-FOIQADDNSA-N	427.904	1.804	50	20	IDGD	
COc1ccc(C)c(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)c1	1836452690	XFSILVVVWBDRIL-FQEVSTJZSA-N	437.968	1.789	50	20	IDGD	
O=C(c1ccc2n[nH]cc2c1)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836717478	CVFUKJTYLNAKPM-LJQANCHMSA-N	434.924	1.775	50	20	IDGD	
Cc1nc2ccncc2cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1836837541	RYHGMZPKIQYSEL-PXNSSMCTSA-N	436.871	1.543	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnn4cccnc34)CCO2)C1	1836844400	KWWZYFHYUDZSEW-JXFKEZNVSA-N	435.912	1.207	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)CN3CCN(C)CC3)CC2)CC1	1836922769	PBASQZAVZWKWNB-FQEVSTJZSA-N	443.032	1.640	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@](C)(Cl)CCl)C3)C2)c(C)n1C	1838385725	ZHPIYPVNWFIFLD-UXHICEINSA-N	446.375	1.948	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)COc3ccc(O)cc3)C2)C1	1839141857	VHGNISAKESLPOM-YLJYHZDGSA-N	426.897	1.245	50	20	IDGD	
O=C(C#Cc1ccccc1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839199523	PIWRDYACWGAUGX-PKOBYXMFSA-N	439.281	1.185	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CCCOC3)C2)C1	1839967108	ANTWLEIBMZFBOF-RLFYNMQTSA-N	433.343	1.043	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cncc(O)c3)CCO2)C1	1840063116	QCMPWNPUDOXXSX-MSOLQXFVSA-N	432.304	1.094	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(F)cc(Cl)c3)C2)C1	1840156875	XDHQHRBLRVFJIY-LPHOPBHVSA-N	449.306	1.803	50	20	IDGD	
COc1cc(C#N)cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)c1	1840188779	BQGSDIXNJJTJRO-IBGZPJMESA-N	442.299	1.441	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)c1ccccc1Cl)CCO2	1840318091	NWCRUFVJFOYZEL-VPWXQRGCSA-N	445.343	1.847	50	20	IDGD	
COc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)ccc1F	1840683902	ZRXYFZIPCVILSP-SFHVURJKSA-N	435.279	1.708	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@]1(C)CC1(F)F)CCO2	1840829579	KAYQTAYLZVHVSX-TUKIKUTGSA-N	425.270	1.272	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)C2CCN(c3ccccc3)CC2)C1	1841311310	SQEZRCKGFTZQSQ-UHFFFAOYSA-N	441.576	1.479	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@@H](O)CC(=O)N1CC2(CCCN2C(=O)CO[Si](C)(C)C)C1	1844378785	HUXYDOGQPHCGNQ-HNNXBMFYSA-N	443.617	1.317	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2ccnn2C(C)C)C1	1844488096	ZKZFXRBHEJIRCR-BUVRLJJBSA-N	425.493	1.415	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC2(CCCN2C(=O)C2(N3CCN(C)CC3)CC2)C1	1845101565	YBBGDCQWIQNCEP-OAHLLOKOSA-N	427.387	1.001	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCCC12CN(C(=O)CCc1nc(N)n[nH]1)C2	1845871300	MSMXYVCTWARASR-RIYZIHGNSA-N	441.442	1.408	50	20	IDGD	
CC(C)(C)OC(=O)N1CC2(CC[C@@H](C(=O)N3CC[C@H]4[C@@H]3CCN4C(=O)[C@@H](F)Cl)O2)C1	1847286810	IFLGDTMKIAETDA-ZQDZILKHSA-N	445.919	1.891	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H](O)[C@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)C(C)(C)CCl)C1	1847437869	APEPJRVALFLYFL-UGUYLWEFSA-N	443.972	1.681	50	20	IDGD	
CC[C@H](C)[C@@H](N)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1848099166	HIZAMBVBRRYDBL-UVPYHEFZSA-N	430.977	1.694	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1cccc(C[S@@](C)=O)c1	10777836	QFMIKGZPYBHJKJ-LJAQVGFWSA-N	438.889	1.845	50	20	IDGD	
O=C(CSc1nnc(N2CCOCC2)n1-c1ccccc1)NNC(=O)c1cccs1	17277765	ZXPBJICDUHPPMG-UHFFFAOYSA-N	444.542	1.719	50	20	IDGD	
Cc1ccc(-n2nc(C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)c3c2CCC3)cc1	29758715	CVACMLGITDSKTI-UHFFFAOYSA-N	428.456	1.720	50	20	IDGD	
O=C(Cn1cc([N+](=O)[O-])cn1)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1	215844511	XYKLZFQMTIOFFU-FQEVSTJZSA-N	434.456	1.566	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)[C@H](c2ccccc2)N2CCN(C)CC2)cc1	727766271	OONODDYEHICFFG-AVRDEDQJSA-N	440.544	1.989	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)CS(=O)(=O)NC3CCC(C)CC3)n[nH]2)cc1	728068410	CTIUJFKFCRHFFP-UHFFFAOYSA-N	433.534	1.644	50	20	IDGD	
O=C(NNc1nc(-c2ccccc2)no1)C1CCN(S(=O)(=O)c2cccnc2)CC1	728081071	VYECCKFHIQNYKF-UHFFFAOYSA-N	428.474	1.676	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)N([C@@H]2CCS(=O)(=O)C2)N(C)C)ccc1C	728179557	LWRCBXZABQSUEN-MRXNPFEDSA-N	431.580	1.131	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2ccc(N3CCCCCC3)nc2)n1	728722181	AXYDJVOUFGQHEM-UHFFFAOYSA-N	431.518	1.774	50	20	IDGD	
CC(C)[C@H](CNC(=O)NNC(=O)c1cc(F)ccc1Br)N1CCN(C)CC1	728742906	UJDAAGFGOQYVLT-INIZCTEOSA-N	444.349	1.804	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)NNC(=O)Cc2cccnc2)c(Br)c1	728856243	KJHDNYTXUGQWIV-UHFFFAOYSA-N	442.291	1.573	50	20	IDGD	
CC(=O)Nc1ccc(CCNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1	728961640	JPBREOHOTXTDGA-UHFFFAOYSA-N	425.493	1.225	50	20	IDGD	
COCCNC(=O)CSc1ccccc1C(=O)NNC(=O)Cn1ccc2ccccc21	729448290	IKBUVUXPOFQGBV-UHFFFAOYSA-N	440.525	1.957	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCN(c2ccc3c(c2)OCCO3)C1=O)c1ccc2ccccc2n1	730512391	OGCLUVPGBJQHCO-INIZCTEOSA-N	432.436	1.820	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)NCCS(=O)(=O)N3CCSCC3)cc2C1	730577865	CWKZZKOORNGJNV-LBPRGKRZSA-N	446.620	1.196	50	20	IDGD	
Cc1c(C(=O)NNC(=O)COc2ccc(C#N)cc2)nnn1-c1cccc2ncccc12	731341882	UOPJXDWFOPKQPC-UHFFFAOYSA-N	427.424	1.836	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)c1cn(C2CCN(C(=O)OC(C)(C)C)CC2)nn1	731491475	MFVREJQRIMQSND-UHFFFAOYSA-N	444.492	1.934	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)cc1	732050324	SHNRDJLKWZMTOD-AWEZNQCLSA-N	443.441	1.359	50	20	IDGD	
CCCOc1cn(-c2ccccc2)nc1C(=O)NNC(=O)CCN1C[C@H](C)O[C@H](C)C1	732263126	KHDWMXPDMSKRFJ-CALCHBBNSA-N	429.521	1.921	50	20	IDGD	
O=C(NNC(=O)c1ccccc1NS(=O)(=O)C(F)(F)F)c1ccc2c(c1)OCCO2	732752925	LAJKPXLLCMHSRE-UHFFFAOYSA-N	445.375	1.794	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)N1CCC(N(CC(F)(F)F)S(C)(=O)=O)CC1	732991731	JHPGCZPPLZUGEA-UHFFFAOYSA-N	436.456	1.638	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2cc(C(C)C)no2)c1	734071534	GSKDBXGYYLTBDK-UHFFFAOYSA-N	437.522	1.973	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)N[C@@H]2CCN(c3cnn(C)c3)C2=O)c(C)n1C[C@H]1CCCO1	735447903	GWHXHLXQKKXKSP-JLJRMFSBSA-N	436.516	1.846	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(CCNC(=O)NNC(=O)COCc2ccccc2)CC1	738991586	QOEHEWVFUNHSQF-UHFFFAOYSA-N	435.525	1.086	50	20	IDGD	
COc1ccc(S(=O)(=O)CCC(=O)NNC(=O)c2ccc3ccccc3n2)cc1OC	740812551	OEQZSOPUDCSLSI-UHFFFAOYSA-N	443.481	1.877	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H]2[C@H]3CCO[C@H]3C2(C)C)c1	741426610	VVFWXBFYGBMNHL-BRWVUGGUSA-N	438.550	1.475	50	20	IDGD	
CC(=O)N[C@H](Cc1c[nH]c2ccc(Br)cc12)C(=O)NNC(=O)c1cccnc1	742032761	ZSXBIGZGTNBRTR-QGZVFWFLSA-N	444.289	1.834	50	20	IDGD	
Cc1nn(C)c2sc(C(=O)N[C@@H](C)C(=O)NNC(=O)c3ccc4c(c3)OCO4)cc12	742033263	MBLGQISCLWMDBV-JTQLQIEISA-N	429.458	1.251	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)c1cn(Cc2ccccn2)nn1	742478282	KHXLJGYZJKNRGY-LBPRGKRZSA-N	445.277	1.712	50	20	IDGD	
O=C(CN1CCN(Cc2cn3cc(Cl)ccc3n2)CC1)NNC(=O)c1ccccc1	742598076	WLZBFHJNHSZVIL-UHFFFAOYSA-N	426.908	1.567	50	20	IDGD	
Cc1c(Br)cc(S(=O)(=O)NNC(=O)NCc2ccco2)cc1[N+](=O)[O-]	743257109	QPYFJYXGSMGJCK-UHFFFAOYSA-N	433.240	1.951	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NCc2ccc(OCC3CC3)nc2)cc1	743579950	YHALFAWGFJXRHP-UHFFFAOYSA-N	433.490	1.810	50	20	IDGD	
Cc1cccc(NC(=O)CN2CCN(CC(=O)NNC(=O)c3ccc(C#N)cc3)CC2)c1C	744384329	BEPVQAJAXZGXML-UHFFFAOYSA-N	448.527	1.192	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)CSc2ccc3c(c2)OCCO3)c1	744500586	QDMPYYXYDGCBEF-UHFFFAOYSA-N	427.438	1.426	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNS(=O)(=O)c2c(F)cccc2[N+](=O)[O-])cc1	745822743	NFWKBNXQEKHWHG-NSHDSACASA-N	427.410	1.910	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NCc2c(C)nn(C)c2C)c2ccccc2c1=O	745911936	ABWMPGVYNUJGHG-UHFFFAOYSA-N	425.493	1.691	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)c2cccc(CN3CCS(=O)(=O)CC3)c2)c1	747337834	UMCIAPABNBIIGH-UHFFFAOYSA-N	431.514	1.065	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Cc2cccc([N+](=O)[O-])c2C)c1	747693066	LRSQHHYZRIINTG-UHFFFAOYSA-N	448.501	1.937	50	20	IDGD	
N#Cc1cccc(NNC(=O)CCC(=O)N2CCN(S(=O)(=O)c3ccccc3)CC2)c1	748029627	KYNRHBNVQNTQFY-UHFFFAOYSA-N	441.513	1.315	50	20	IDGD	
Cc1c(NNC(=O)c2cc(S(N)(=O)=O)ccc2N2CCOCC2)cccc1[N+](=O)[O-]	748683022	ONCVNULTISBCDM-UHFFFAOYSA-N	435.462	1.144	50	20	IDGD	
COc1ccc(-c2nn(CCC#N)cc2/C=C(\C#N)C(=O)N[C@H](C)CC(N)=O)cc1OC	748715994	JCNFPSCBUUBOND-DWKHYPNZSA-N	436.472	1.768	50	20	IDGD	
O=C(NNC(=O)c1cc2c(s1)CCC2)c1cccc(CN2CCS(=O)(=O)CC2)c1	751291446	VKWGHYOAADGSGJ-UHFFFAOYSA-N	433.555	1.542	50	20	IDGD	
CC(C)C(=O)NNC(=O)[C@@H](CCS(C)(=O)=O)NC(=O)c1ccc(C(C)(C)C)cc1	751297723	QVRAZSYSVVTLCD-MRXNPFEDSA-N	425.551	1.321	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)c2cc(Br)ccc2n1	751363951	YVKNAMQRHNQTCK-NSHDSACASA-N	441.307	1.437	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)Cc2cc(=O)n(CC(C)C)[nH]2)c1	752097701	YIYCCCXGINPTPH-UHFFFAOYSA-N	425.283	1.607	50	20	IDGD	
O=C(NC[C@@H]1CCCCS1)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	753256425	UMPYKPAXUFKCRS-HNNXBMFYSA-N	426.564	1.701	50	20	IDGD	
NC(=O)c1ccc(CC(=O)NNc2ccc(S(=O)(=O)Nc3nccs3)cc2)cc1	754249944	YWVIFMAPQZGKLK-UHFFFAOYSA-N	431.499	1.729	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@H](CC(C)C)N2CCCCC2=O)c2ccccc2c1=O	755045789	LRTSGDVPDQKSAP-KRWDZBQOSA-N	427.505	1.605	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NN=Cc1cnc([C@@H]2CCCO2)s1	755786559	BBHIUHDVBYJTPZ-SFHVURJKSA-N	427.530	1.903	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)Nc3cc(C(N)=O)ccc3F)n[nH]2)cc1OC	756065946	JRTNTPWSPOEKJV-UHFFFAOYSA-N	442.407	1.798	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2ccccc2CS(C)(=O)=O)c2ccccc2c1=O	756268561	BUUNBPQMQMTSCB-UHFFFAOYSA-N	443.485	1.428	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@H](C)C(=O)NNC(=O)Nc1ccn(CC(=O)N(C)C)n1	756310806	JSYYVAHIPGRMDW-CYBMUJFWSA-N	436.900	1.862	50	20	IDGD	
CNC(=O)CCOc1ccc(NC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])cc1	756456074	CWBOSKXMSAPJHA-UHFFFAOYSA-N	431.405	1.341	50	20	IDGD	
C[C@@](NCC(=O)NNC(=O)c1cccc(C#N)c1)(C(N)=O)c1cccc(C(F)(F)F)c1	756601477	PKZLOSKYNFDZRI-IBGZPJMESA-N	433.390	1.328	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)Nc2cc(S(=O)(=O)N(C)C)ccc2F)c1O	756687464	ZREVJAVKDLTCDG-UHFFFAOYSA-N	426.426	1.257	50	20	IDGD	
C[C@H]1C[C@@H](C)C[C@]2(C1)NC(=O)N(CC(=O)NNC(=O)Cn1ccc3ccccc31)C2=O	756974043	IPJJFCAGCMYAAO-YEZVWNJWSA-N	425.489	1.535	50	20	IDGD	
O=C(NNC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1)c1ccc2nnnn2c1	757627078	IJOLSSNUBOZNAE-UHFFFAOYSA-N	425.412	1.447	50	20	IDGD	
COCc1nc(C)c(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)s1	758042636	AMXCWXKIPBXMIV-UHFFFAOYSA-N	438.531	1.457	50	20	IDGD	
C[C@@H](CN1CCOCC1)C(=O)NN=Cc1ccc(OCCN2CCOCC2)c(Cl)c1	759191056	AYPBZBACQHJEJE-KRWDZBQOSA-N	438.956	1.469	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)C2=NOC3(CCN(C(=O)OC(C)(C)C)CC3)C2)nc1	760469377	CSPFTLSVQDAGPH-UHFFFAOYSA-N	433.465	1.857	50	20	IDGD	
COc1ccc2c(c1)[C@@H](C(=O)NNC(=O)CN1CCN(C(=O)c3ccccc3)CC1)CC2	762089050	YPCITGVNPWRHQS-FQEVSTJZSA-N	436.512	1.330	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)C(F)=C1CCCC1	763009142	LETCJHDKLCIYJW-UHFFFAOYSA-N	439.509	1.585	50	20	IDGD	
O=C(NNC(=O)c1cccc(Cl)c1F)c1cccc(S(=O)(=O)N2CCOCC2)c1	763108619	MSXFKLRDKLYCQY-UHFFFAOYSA-N	441.868	1.575	50	20	IDGD	
Cc1ccc(I)cc1C(=O)NNC(=O)CNC(=O)c1ccco1	763321488	KZWGWKVJELTZRC-UHFFFAOYSA-N	427.198	1.384	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NN=Cc1c(N2CCOCC2)nc2ccccn12	763386722	QDMPZLYLCGCZCE-UHFFFAOYSA-N	430.509	1.926	50	20	IDGD	
CCC(CC)NC(=O)[C@@H]1CN(C(=O)C(=O)NNC(=O)c2ccccc2)c2ccccc2O1	763423818	VZNCXUJVJQWSIN-IBGZPJMESA-N	438.484	1.547	50	20	IDGD	
NC(=O)CCOc1ccccc1NC(=O)C(=O)NNC(=O)c1ccccc1Br	763483414	RIPVAQZDPBXDBT-UHFFFAOYSA-N	449.261	1.103	50	20	IDGD	
CC(C)(C)NC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)c1	763551225	LEQDSTIGHXSIMN-UHFFFAOYSA-N	426.429	1.343	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3ccc4c(c3)OCO4)cc2)CCO1	763552063	WBAWULDAWDHTSU-ZDUSSCGKSA-N	426.429	1.040	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)Nc1cccc(OC(F)(F)F)c1	763572321	QMSBZEMKQHIDJB-CQSZACIVSA-N	425.319	1.511	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cccc(CN3C[C@H](C)O[C@H](C)C3)c2)c(C)o1	763584317	ZZYKIURETSPUKB-GASCZTMLSA-N	428.489	1.905	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)n([C@@H]2C[C@H]3CC[C@H]2C3)n1	763807133	LFDVRUVUYSSNAH-YQQAZPJKSA-N	436.472	1.589	50	20	IDGD	
CC(C)C(=O)NNC(=O)C(=O)Nc1cc(Br)cnc1OCC(F)(F)F	763816121	FMCKFPCAAFXPPA-UHFFFAOYSA-N	427.177	1.527	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)N(C)C)cc2)c1C	763841192	OKZQNHAGUDKHGS-OAHLLOKOSA-N	426.473	1.559	50	20	IDGD	
Cc1cc(C(=O)NC(C)C)ccc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccccc1F	763850540	NZNQXJLLRVBZEN-AWEZNQCLSA-N	444.463	1.826	50	20	IDGD	
CCOC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(C(C)=O)cc2)cc1	763873694	XOOVYQVATTYUIN-CQSZACIVSA-N	441.440	1.619	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccc(N2CCCC2=O)c(F)c1	763873903	XWTXYNUAZPIVSC-GFCCVEGCSA-N	446.410	1.645	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2c3c(nn2C)CCC3)ccc1OCCC(C)C	763915106	ZUTCVCNLSDTUNA-UHFFFAOYSA-N	443.504	1.742	50	20	IDGD	
Cc1ncc(-c2ccc(NC(=O)C(=O)NNC(=O)c3nn(-c4ccccc4)cc3O)cc2)o1	763951205	ZWKAHJADVRGABF-UHFFFAOYSA-N	446.423	1.941	50	20	IDGD	
COC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)cc1F	763995923	AVXWQNCWGQFAHN-UHFFFAOYSA-N	442.201	1.494	50	20	IDGD	
COC(=O)c1ccsc1NC(=O)C(=O)NNC(=O)c1cc(Br)cn1C	764004273	BGADCYOASGSHKW-UHFFFAOYSA-N	429.252	1.035	50	20	IDGD	
Cn1ccnc1-c1csc(NC(=O)C(=O)NNC(=O)c2cccc(Br)c2)n1	764063013	IYJMRBODZMSVLC-UHFFFAOYSA-N	449.290	1.706	50	20	IDGD	
CCOC(=O)c1c(F)cccc1NC(=O)C(=O)NNC(=O)CCc1ccc(OC)cc1	764133003	ZOXALWOWFWUCHV-UHFFFAOYSA-N	431.420	1.730	50	20	IDGD	
Cn1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3CN2Cc2ccccc2)n1	764178740	IUBVDDLGERJVAF-IBGZPJMESA-N	432.484	1.133	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)COC3)c1	764230517	AVXIEPCEOYLEPN-UHFFFAOYSA-N	434.246	1.888	50	20	IDGD	
COc1cc(OC)c(NC(=O)C(=O)NNC(=O)c2cccc(OC(F)F)c2)cc1F	764254006	XPTVWPCBVLHEDM-UHFFFAOYSA-N	427.335	1.844	50	20	IDGD	
COc1c(F)cc(F)cc1NC(=O)C(=O)NNC(=O)c1cc(Br)ccc1O	764276363	CNJXBYMJDSCVOC-UHFFFAOYSA-N	444.188	1.841	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)c(Cl)c1)C(=O)Nc1cccc(Cl)c1-n1cncn1	764349476	PPDHXSZSQKTQQD-UHFFFAOYSA-N	435.227	1.679	50	20	IDGD	
O=C(CCCOCc1ccccc1)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765736391	QRZLUWYRBTZUPE-UHFFFAOYSA-N	438.528	1.589	50	20	IDGD	
COc1ccc(C=NNC(=O)CSc2nnc(O)nc2O)c(OCc2cccnc2)c1	766432839	CJPZDPRBROUAJO-UHFFFAOYSA-N	442.457	1.508	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@@H](C)n3cnc4ccccc43)CC2)cc1	766647192	ASSIEOPJYHWTII-LJQANCHMSA-N	434.544	1.871	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2ccc(F)cc2Br)n(-c2ncccn2)n1	768231141	ZVPUACMFHQMPRG-UHFFFAOYSA-N	434.229	1.954	50	20	IDGD	
CCNC(=O)N(C)NC(=O)/C(C#N)=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	768409796	LMDUGCBXAZDNHP-GXDHUFHOSA-N	443.895	1.678	50	20	IDGD	
C[C@H]1CN(c2ccc(CNC(=O)NNc3nc(O)c4cnn(C)c4n3)cc2F)C[C@@H](C)O1	770352088	UEDGOPKJHQYRBW-TXEJJXNPSA-N	444.471	1.648	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)N[C@@H]3CCC[C@H](S(C)(=O)=O)C3)nc21	770396403	HXVIGAISFCVBBT-MNOVXSKESA-N	425.515	1.269	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)N[C@H](C)CCN2CCN(C)CC2)cc1Cl	770584585	FBFXKEFUNOWUKD-CYBMUJFWSA-N	442.948	1.719	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNS(=O)(=O)N1CCC2(CCCCC2)CC1	771606388	HZGMARUTSDPKJG-UHFFFAOYSA-N	442.969	1.868	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)Nc1cnn(Cc2nnc3n2CCCC3)c1	772636965	YSZCIJNEMKSKEO-UHFFFAOYSA-N	428.428	1.230	50	20	IDGD	
CN(C)CCn1c(=O)oc2ccc(NC(=O)C(=O)NNc3ccc([N+](=O)[O-])cc3)cc21	773639512	RBBKMLJQNQWNKX-UHFFFAOYSA-N	428.405	1.146	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2cc(Cl)cc(Br)c2OC)n1	773724772	WTLYEHRGVHRTNJ-UHFFFAOYSA-N	430.646	1.992	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2ccc(C(=O)N3CCC(C)CC3)cc2C)n1	773730973	PGCZDTHAZBWRPE-UHFFFAOYSA-N	426.477	1.748	50	20	IDGD	
Cc1n[nH]c(C)c1CC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	776323775	SKJBUXXXGKQTSQ-UHFFFAOYSA-N	441.513	1.509	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)[C@@H]1[C@@H](C)OC(C)(C)N1C(=O)OC(C)(C)C	776476342	HIPXBLAKSXBUJU-IPYPFGDCSA-N	429.514	1.872	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(OCC(=O)NNC(=O)c2ccc3c(c2)OCCO3)CC1	777104520	SVYBLVJAVDFGMV-UHFFFAOYSA-N	435.477	1.635	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CN2CCNC(=O)[C@@H]2c2ccccc2Br)c1	777715573	CDPXLYYRKWICEL-SFHVURJKSA-N	445.317	1.692	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)[C@@H](CSC)N2C(=O)[C@H]3CCCC[C@H]3C2=O)nc1C	778427960	GZGCKATYQQTXOV-VNHYZAJKSA-N	449.533	1.312	50	20	IDGD	
O=S(=O)(CCCCCl)N1CCN(S(=O)(=O)c2cccc3nsnc23)CC1	780669204	GTLQZIXUJKIMEU-UHFFFAOYSA-N	438.984	1.346	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2cccc(S(=O)(=O)/N=C3/CCCN3C)c2)cc1	783037568	SAWAYARVAJFNRX-MOHJPFBDSA-N	445.501	1.590	50	20	IDGD	
CCC(C)(C)NC(=O)c1ccc(NC(=O)C(=O)NNc2ccc(-n3cccn3)nn2)cc1	783433813	ZJHTXISAESFWDM-UHFFFAOYSA-N	436.476	1.663	50	20	IDGD	
CN(NC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	783703764	CZHDGMHQLVSLRE-UHFFFAOYSA-N	439.473	1.162	50	20	IDGD	
CCC(CC)NC(=O)[C@H]1CN(C(=O)C(=O)NNc2cc(C)ccn2)c2ccccc2O1	783928860	IGTUBTTVVCSWPQ-GOSISDBHSA-N	425.489	1.932	50	20	IDGD	
COC(=O)[C@@H]1CCCCN1C(=O)c1cccc(NC(=O)C(=O)NNc2cc(C)ccn2)c1	783934786	ZIZJOTLGOQDGBW-KRWDZBQOSA-N	439.472	1.640	50	20	IDGD	
Cc1ccc(-n2cc(C)cn2)c(NC(=O)C(=O)NNC(=O)CNC(=O)c2cccs2)c1	784003640	KASNGPQPXBTVBV-UHFFFAOYSA-N	440.485	1.067	50	20	IDGD	
Cn1cc(NC(=O)C(=O)NNc2ccc(Br)cn2)cc(Br)c1=O	784341488	OIWUEPUUTQNWSZ-UHFFFAOYSA-N	445.071	1.387	50	20	IDGD	
C[C@@H]1CN(c2ccc(NC(=O)C(=O)NNc3ccnc(Br)c3)cn2)C[C@@H](C)O1	784837268	KWSCJVIDVBYBCK-VXGBXAGGSA-N	449.309	1.935	50	20	IDGD	
C[C@H]1[C@H](C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)CCN1C(=O)OC(C)(C)C	786378319	RRVVKYLAPSSJHR-XJKSGUPXSA-N	430.461	1.508	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1cccnc1-c1cnn(C)c1	786415105	WVRNMCGJJYHILO-LBPRGKRZSA-N	426.408	1.175	50	20	IDGD	
N#C/C(=C\c1ccc(O)cc1)C(=O)N1CCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)CC1	786644798	GVODHALEKJFMCM-DTQAZKPQSA-N	442.453	1.740	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)cccc1N1CCNC1=O	787548212	BNLIOTNRIHDBQH-UHFFFAOYSA-N	431.836	1.283	50	20	IDGD	
CO[C@H]1CCOc2c(NC(=O)C(=O)NNC(=O)COc3ccccc3[N+](=O)[O-])cccc21	790953044	ZKQXSMIEABWXCR-HNNXBMFYSA-N	444.400	1.230	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)OCc2nc(N)nc(N(C)C)n2)c(C)n1C[C@H]1CCCO1	791150349	MFMSJFKAFZYSAQ-VHEJECIDSA-N	425.493	1.768	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1cccc(NC(=O)N(C)C)c1C	792352070	APFNQLSAADPINF-UHFFFAOYSA-N	427.461	1.426	50	20	IDGD	
CN(C)N(C(=O)c1cc(NS(C)(=O)=O)cc(C(F)(F)F)c1)[C@@H]1CCS(=O)(=O)C1	792855257	QTGSRDRUUFXMRR-CYBMUJFWSA-N	443.469	1.183	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@H](C)c2ccc3c(c2)OCO3)cc1	794183319	QYWSRCMIOLNMNZ-CQSZACIVSA-N	433.486	1.295	50	20	IDGD	
CN(Cc1ccccc1)C1CCC(=NNC(=O)CSc2nn(C)c(=O)n(C)c2=O)CC1	797787480	QWCRUKOBVHGNSK-UHFFFAOYSA-N	444.561	1.118	50	20	IDGD	
CN(C)[C@H](C(=O)NNC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1)c1cncn1C	798153775	FIDNQBXRCYAKGL-IBGZPJMESA-N	444.499	1.732	50	20	IDGD	
CCCCNS(=O)(=O)c1ccc(C)c(NC(=O)C(=O)NNc2cc(C)nc(C)n2)c1	799836163	ZDWNLKDGQLBNIL-UHFFFAOYSA-N	434.522	1.562	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2csc(-c3ccccc3)n2)cc1	806973549	QYTBZDGRNAXMIQ-UHFFFAOYSA-N	426.454	1.984	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)NCc3cc(F)c(F)cc3Br)nc21	807526311	BNNGGMBYIWURAS-UHFFFAOYSA-N	428.197	1.936	50	20	IDGD	
Cc1cc(O)nc2cc(C(=O)NNC(=O)c3ccc(Cl)c(S(N)(=O)=O)c3)ccc12	809555531	ABCWKMOGAJAMTQ-UHFFFAOYSA-N	434.861	1.624	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CNS(=O)(=O)c2cccc(Br)c2)c(O)c1	810172816	QOQBADLGLZCGSE-UHFFFAOYSA-N	442.291	1.203	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1cc(Cl)ncc1Br	810348448	NFHDZJUDKRSYHE-UHFFFAOYSA-N	439.701	1.965	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(Cl)c(Cl)c1)NNC(=O)COCc1ccccc1	810423857	HKXQHCMKPBFVTR-UHFFFAOYSA-N	446.312	1.636	50	20	IDGD	
CCNC(=O)N(C)NC(=O)[C@@H](CCSC)NS(=O)(=O)c1ccc2ccccc2c1	810854226	OSOJUHIOMVDSOM-QGZVFWFLSA-N	438.575	1.932	50	20	IDGD	
O=C(CNS(=O)(=O)c1c(Cl)cccc1Cl)NNc1ccc(-n2ccnc2)nn1	811455914	YVEZKWOBSARCHS-UHFFFAOYSA-N	442.288	1.391	50	20	IDGD	
CC(=NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12)c1ccc2[nH]c(=O)c(=O)[nH]c2c1	811632933	GNKAOYBBUFZZAB-UHFFFAOYSA-N	432.440	1.661	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCCc2c[nH]c3ccc([N+](=O)[O-])cc23)c1	812444494	HXHHAWBLCGVEDQ-UHFFFAOYSA-N	445.457	1.666	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)c2cnn(CC(=O)NC3CCCCC3)c2)cc1	812733640	ZSZRYCLGVADBTI-UHFFFAOYSA-N	448.549	1.339	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)NCC(=O)NCCN2CCCCCC2)cc1OC	814424104	CETZTIQGLMVTOQ-UHFFFAOYSA-N	435.525	1.030	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)C1(c2ccc(N(C)C)cc2)CC1	814735954	HWZGBTBKDQZZGW-UHFFFAOYSA-N	429.546	1.847	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCc2nncn2C1)C(=O)Nc1cc(-c2ccccc2)ccc1Cl	815692121	JRDJFQXYBCWNPV-HNNXBMFYSA-N	438.875	1.947	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)N(C)Cc2ccccc2S(N)(=O)=O)c1C	817261597	UXPBJIXNZLTEMO-UNOMPAQXSA-N	430.530	1.964	50	20	IDGD	
O=C([C@@H]1CCCCN1C(=O)c1ccc(Br)c(F)c1)N1CC[C@@H](B(O)O)C1	864234690	TZBMQOILXTULTQ-DOMZBBRYSA-N	427.079	1.658	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NC2CCN(Cc3ccccc3)CC2)c2ccccc2c1=O	913459103	HXVFIOQHPDNVTR-UHFFFAOYSA-N	434.500	1.542	50	20	IDGD	
CN1/C(=C(/C#N)C(=O)Cn2cc(S(=O)(=O)N3CCCC3)ccc2=O)Nc2ccccc21	913589490	SZFZLUYOVIYOMQ-PGMHBOJBSA-N	439.497	1.499	50	20	IDGD	
Cn1c(=O)nc(O)c2c(C(=O)NNC(=O)c3ccc4ccccc4n3)cc(C3CC3)nc21	913962214	KJJDMPYIPDWMSR-UHFFFAOYSA-N	430.424	1.535	50	20	IDGD	
O=C(CCS(=O)(=O)c1ccc2c(c1)CCC2)NNC(=O)[C@H]1COc2ccccc2O1	915273763	HSXLZPDXZFGGHC-LJQANCHMSA-N	430.482	1.327	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)N[C@@H]1CCCc2occc21	916576037	FFFCTVBFKMGJKP-QGZVFWFLSA-N	448.501	1.322	50	20	IDGD	
O=C(NC[C@]1(N2CCOCC2)CCSC1)NNC(=O)c1ccc(Br)s1	916636858	MXXWMITUEZYZOV-OAHLLOKOSA-N	449.396	1.663	50	20	IDGD	
CNS(=O)(=O)c1ccc(CCC(=O)NNC(=O)c2cc(-c3ccc(C)cc3)[nH]n2)cc1	917178577	XPYOXEBRVGGGPT-UHFFFAOYSA-N	441.513	1.687	50	20	IDGD	
C[C@@H](CN1CCC[C@@H](C)C1)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	919915455	VGCJSAAGWCRWLC-CABCVRRESA-N	425.555	1.001	50	20	IDGD	
O=C(Cc1c[nH]c2cnccc12)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	1261254544	RKPOJMURVVLAMG-UHFFFAOYSA-N	427.486	1.351	50	20	IDGD	
NS(=O)(=O)c1cccc(CNC(=O)NNC(=O)c2ccc(Br)cc2)c1	1317868923	YMIWNNYQKPHBGO-UHFFFAOYSA-N	427.280	1.241	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C(=O)NCC(C)C)C1	1778117248	YXGBRQGJXFEQAG-SPYBWZPUSA-N	446.386	1.446	50	20	IDGD	
Cc1nnc(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CO[Si](C)(C)C)C2)s1	1779543702	NIRCKJNIJNFJRG-DNVCBOLYSA-N	440.642	1.754	50	20	IDGD	
COc1cccc(OC)c1C(=O)N1CC[C@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1780538956	NASHEWIQBLWGNS-NRFANRHFSA-N	436.581	1.999	50	20	IDGD	
Cc1cnn([C@H](C)C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](F)Br)C2)c1	1780777458	SORMQEASMYLSGF-ZXFNITATSA-N	445.333	1.957	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)CS(=O)(=O)c3ccc(C)cc3)CCO2)C1	1781213140	MIBQZGZLGJAJPE-FXAWDEMLSA-N	442.965	1.616	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)COc3ccc(C(=O)OC)cc3)CCO2)C1	1781226511	ZPGKOGGMLFFNNJ-LAUBAEHRSA-N	438.908	1.699	50	20	IDGD	
O=C(c1ccc(CO)c(F)c1)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781333066	BLUNDPVBTCYERQ-PBHICJAKSA-N	433.249	1.452	50	20	IDGD	
COc1cccc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)c1F	1781335011	RATGDHXUMJXZAT-PBHICJAKSA-N	433.249	1.968	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)c3c(O)cc(O)cc3O)C2)C1	1781814844	UXZITHZUUGGDEP-ROUUACIJSA-N	433.288	1.483	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnnn1C)C2	1781901821	XUMUREQREJUOAD-DXCKQFNASA-N	428.331	1.116	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@H](C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](O)CCl)C3)C1	1782161088	BMPJVGFZCBYUEZ-YWCWZJBTSA-N	444.956	1.079	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H]1CNc3ccccc31)C2	1782170721	VDAFXICKHFKJQJ-ZHDKGAKHSA-N	435.952	1.963	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(N(C)C)nc3)CCO2)C1	1783352071	MSNGHILHAMXJBO-KXBFYZLASA-N	439.354	1.765	50	20	IDGD	
COc1cccnc1CCC(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](C)Br)C2)C1	1783530228	VDNZCPMYPARSHU-LIRRHRJNSA-N	440.338	1.636	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](C)Br)C3)C2)ncc1[N+](=O)[O-]	1783533965	CGIILLAKWVHKGF-PXAZEXFGSA-N	441.282	1.525	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3CCN(C)CC3)[C@H]2C1	1783598439	DDRJESKJQQOMOZ-NXOAAHMSSA-N	430.387	1.481	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)Cn3cnc4ccccc43)C2)C1	1783744491	SQAGAFWDAKBTFP-MGPUTAFESA-N	449.349	1.897	50	20	IDGD	
CC(C)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccn4c(O)nnc34)C[C@@H]21	1783850814	ULZPZXRXZNHHEG-QEJZJMRPSA-N	435.912	1.293	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](C)N(C)C(=O)OC(C)(C)C)CCO2	1783880015	DPHXZSAETHWKQK-SXGZJXTBSA-N	447.960	1.326	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)Cc3cc(Cl)ccc3OC)CCO2)C1	1783880848	HUNDDBUNVKIDQM-JXFKEZNVSA-N	445.343	1.975	50	20	IDGD	
O=C(c1cc(F)ccc1C(F)(F)F)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1785211667	QXXAEWZOVHAUQZ-WMLDXEAASA-N	438.805	1.888	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H]3CCCSC3)C2)C1	1785473136	NWRGVLOKHIQJJA-AHBLATNWSA-N	447.561	1.094	50	20	IDGD	
CCS(=O)(=O)N[C@H](C)C(=O)NC1(c2ccc(NC(=O)[C@@H](O)CCl)cc2)CCC1	1786129455	MZHVNGMQPITWGW-DOMZBBRYSA-N	431.942	1.048	50	20	IDGD	
COC(=O)CCCCCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCBr)[C@H]2C1	1786407620	BCTVEROHQRGGSW-JYJNAYRXSA-N	447.370	1.875	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nc4cc([N+](=O)[O-])ccc4[nH]3)C[C@@H]21)[C@@H](F)Cl	1787449220	DMRXDIGWJXBBCQ-LHAJWOIZSA-N	439.831	1.599	50	20	IDGD	
Cc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](O)CCl)C[C@@H]32)nc2ccccc12	1787967937	BQTFXABEAWWSSR-QHERXFFYSA-N	431.920	1.736	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4cncn4c3)[C@H]2C1	1788428327	NTDAEESLSGGAAG-QCPWZWHMSA-N	435.322	1.711	50	20	IDGD	
O=C(NC1(c2ccc(NC(=O)c3ccncc3O)cc2)CCC1)c1ccc(B(O)O)cc1	1789701795	QVWPOPILGYAWNU-UHFFFAOYSA-N	431.257	1.529	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnoc3C3CC3)C[C@@H]21)[C@@H](F)Br	1789922346	IGVLNLCYEZGCSI-GZCFXPHUSA-N	430.274	1.836	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4cccnc4[nH]3)C[C@@H]21)[C@@H](F)Br	1789925514	FYIRTYWHNFXSJK-NZBPQXDJSA-N	439.285	1.847	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccccc3C(N)=O)[C@H]2C1	1790130623	QOTXENHFKQEEJP-WBAXXEDZSA-N	433.581	1.230	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccncc3O)C[C@@H]21	1790960316	AEILANZINZIGGB-PCBIJLKTSA-N	426.311	1.554	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](CN)c3ccccc3)C[C@@H]21	1791057947	LXKDIUDHHRDDGN-WJNMYVKJSA-N	438.366	1.492	50	20	IDGD	
C[C@H](Oc1ccccn1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]2C1	1791065133	RIBQGGIIHJYDMQ-YXMSTPNBSA-N	440.338	1.612	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3C[C@H]4CC[C@@H]3O4)[C@H]2C1	1791087036	WDNPBBVZBMVIPG-HIXZSHCBSA-N	429.355	1.565	50	20	IDGD	
COc1ccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@](C)(Cl)CCl)C3)cc1O	1792730527	IGTGRHQCYXWTLZ-ZZXMYQEDSA-N	445.343	1.769	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1C[C@H]1c1ccc(F)c(F)c1	1793047731	CUXOYVZEVNNXFF-AOWFHFJHSA-N	442.890	1.912	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H]1C[C@H](C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](O)CCl)C1	1793117889	IRHNROHMHNAFLO-CMXYNOPPSA-N	429.945	1.528	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1cc(F)ccc1Cl)c1cccc(B(O)O)c1	1793984334	UIWWBBFDSRLYFH-REPLKXPHSA-N	444.699	1.653	50	20	IDGD	
Cc1ccccc1-c1ncccc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2	1796008054	IUDHHZJGIBWPDA-WOUAJJJCSA-N	443.931	1.860	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2cc(O)ccc2n1	1796862660	LATLLKNDSAMBTD-VPTLXERWSA-N	443.576	1.995	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)nc2ccccc12	1796913896	NYHGCBDKIAAVKK-USGNIVHTSA-N	443.576	1.995	50	20	IDGD	
CCc1noc(C)c1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)CBr)C2	1798174148	XKBXUOWHBANVOW-YGSHXTJESA-N	428.327	1.780	50	20	IDGD	
Cc1c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@](C)(Cl)CCl)C3)cn2[nH]cnc(=O)c12	1799154429	DHDAFNMPTKUBOL-RJAOAUJVSA-N	440.331	1.819	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cn3ncccc3n1)C2	1799275491	SNPWADGHUQGKIY-TYYYEBLRSA-N	426.304	1.169	50	20	IDGD	
CC(C)Oc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](O)CCl)C3)cc1Cl	1799461280	PZDCYUUHPODISQ-CXHZTBPHSA-N	445.343	1.930	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1nc2cc([N+](=O)[O-])ccc2[nH]1	1799875574	HZOCXHBSBPHESR-DDFXLWFNSA-N	435.868	1.692	50	20	IDGD	
C[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(Cl)Cl)[S@@](=O)c1ccccc1	1801016539	HRCSNXPNPVFFIZ-QVTFYQADSA-N	433.357	1.576	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccn(-c3ccccc3)n1)C2	1802336298	JGVLJOYGXWNWNN-GGPHIMKMSA-N	438.532	1.497	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCc1cnc3[nH]ccc3c1)C2	1802339823	NYURUGCDKREJFF-REPLKXPHSA-N	440.548	1.507	50	20	IDGD	
CC[C@H](NC(C)=O)C(=O)NC[C@H]1CCN(C(=O)CO[Si](C)(C)C)[C@@H]1c1cccnc1	1802547627	HHSXBRODLKQMMF-WSTZPKSXSA-N	434.613	1.854	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H]2CCc3nc[nH]c3C2)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803147126	TUIZXYHFWVTUGC-OPGCRTJHSA-N	431.924	1.215	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)Cc2ccc3c(c2)CCO3)[C@@H]1c1cccnc1)[C@H](O)CCl	1803148067	NWODBNUAJDIGLK-NNMXDRDESA-N	443.931	1.865	50	20	IDGD	
CCOC(=O)C(C)(C)C(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]1c1cccnc1	1803148920	QZPDUTUBJBIOIF-OAGGEKHMSA-N	425.913	1.276	50	20	IDGD	
COc1cccc(CC(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)n1	1804393404	ASCHUWKBRCDACZ-RIFZZMRRSA-N	432.908	1.333	50	20	IDGD	
O=C(CC1CCCC1)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1806190329	VBENIMJUWZDULD-REWPJTCUSA-N	435.333	1.661	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)CC(F)(F)F)[C@@H]1c1cccnc1	1806840531	GIKBCEBCBXWNEK-KDOFPFPSSA-N	429.443	1.413	50	20	IDGD	
C=CCC(F)(F)C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1807367161	QYMJJHFEASIANM-HKUYNNGSSA-N	443.259	1.292	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cc[n+]([O-])cc2)[C@@H]1c1cccnc1)[C@H](F)Br	1808676345	PKIXJLUIRGQTNR-XHSDSOJGSA-N	437.269	1.725	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)c1cn2cccnc2n1	1809776516	ZBXNODCRLWLEQW-UAGQMJEPSA-N	428.880	1.044	50	20	IDGD	
Cn1ccc(=O)cc1C(=O)NC[C@@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1	1811361099	UBGAVWUOKKBASF-HNAYVOBHSA-N	447.333	1.885	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)[C@H](C)n2ccccc2=O)[C@H]1c1cccnc1	1813031452	OCCKEZFKSWWGME-CAIZAGQASA-N	446.935	1.764	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2ccn(C)c2)[C@H]1c1cccnc1	1813070790	LXFFIUGCHFSGGY-UTKZUKDTSA-N	426.521	1.113	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](C)CS(C)(=O)=O)n[nH]1	1815232083	FYEGHEPSJGTUPH-MDZLAQPJSA-N	449.371	1.866	50	20	IDGD	
Cc1onc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)c1C	1815450593	ISMMRDWKJPCAPS-QGZVFWFLSA-N	437.265	1.314	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](C)[C@@H]3SC(=N)NC3=O)sc2C1	1817249530	DZZLWUXHUMXOKJ-XBWDGYHZSA-N	443.982	1.875	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cccc(F)c2)[nH]n1)c1cccc(B(O)O)c1	1817476819	REZWEQXYONIVJY-LJQANCHMSA-N	436.252	1.848	50	20	IDGD	
Cc1nc(C)c(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)o1	1819799409	FOMHZIKMWDZVAQ-QGZVFWFLSA-N	437.265	1.314	50	20	IDGD	
Cc1nc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)cs1	1822412980	MGRYCVVINLGSJQ-OAHLLOKOSA-N	433.538	1.854	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccccc1C(N)=O)CC2	1826006615	KSYINVRCSXHEKE-ZWNOBZJWSA-N	436.921	1.722	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccncn2)CC1	1828926507	LNSODIIFPAMDOX-IBGZPJMESA-N	437.504	1.022	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cccnc1S)CCO2	1829796504	BZRFFAWWHQAFEC-IBGZPJMESA-N	439.610	1.292	50	20	IDGD	
CCn1nc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)cc1C	1830365578	ZXWCFOUFYGAREI-HXUWFJFHSA-N	426.945	1.546	50	20	IDGD	
Cc1oncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2	1830537613	LGBPYRGDKIZZDM-YVEFUNNKSA-N	430.299	1.084	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CN3CCC(C)CC3)CCO2)C1	1831097767	BQXBWSWIVVDPPB-NQIIRXRSSA-N	429.989	1.582	50	20	IDGD	
O=C(C[C@@H]1OCCc2ccccc21)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1831246754	YYZKPJDZSNUFSE-DSKINZAPSA-N	440.899	1.681	50	20	IDGD	
CSCC[C@H](O)C(=O)N1CCC([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1	1831874552	KFSSBMNZGISFDU-MSOLQXFVSA-N	442.626	1.093	50	20	IDGD	
Cc1ccn2ncc(C(=O)N3CCC(N4CCC(NC(=O)[C@@H](O)CCl)CC4)CC3)c2c1	1833310519	LSDTVLPIQMZMDX-FQEVSTJZSA-N	447.967	1.428	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cc(C)n(C)n3)CC2)CC1	1834175866	OPRQTWZUKQZXMD-KRWDZBQOSA-N	425.961	1.168	50	20	IDGD	
COC(=O)[C@@H]1CC[C@@H](C(=O)N2CCC(N3CCC(NC(=O)[C@H](F)Cl)CC3)CC2)C1	1835079468	YRSZAMSELNCHLT-CPUCHLNUSA-N	431.936	1.682	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)C#Cc3ccccc3)CCO2)C1	1835102141	MMHALQXYKORMON-OXJNMPFZSA-N	435.318	1.278	50	20	IDGD	
C=C[C@H](O)C(C)(C)C(=O)NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1	1835717272	OXEIGUUQVNKNES-HOTGVXAUSA-N	448.377	1.822	50	20	IDGD	
O=C(C(Cl)Cl)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CNc3ccccc31)CCO2	1835723065	QASNWHIUNJPACU-AUUYWEPGSA-N	428.316	1.456	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1)c1ccnnc1O	1836063358	XOSHPSDAUYPSMN-AWEZNQCLSA-N	444.305	1.058	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1Cc3ccccc3CN1)CCO2	1836498934	OOSQDTKHUAOPEP-MZKRTTBSSA-N	449.979	1.565	50	20	IDGD	
O=C([C@H](F)Cl)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1[C@H]3c4ccccc4S[C@H]31)CCO2	1837473900	XSASHSQUPQWACP-QOSLBHJFSA-N	440.924	1.865	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)CC[C@@H]3CCOC3)C2)C1	1837717715	MKTJUISQRDNVNE-XLIONFOSSA-N	428.602	1.111	50	20	IDGD	
O=C(c1ccc(Cl)nc1Cl)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1837825642	SZJHVCFSWIOXAE-LRDDRELGSA-N	440.686	1.993	50	20	IDGD	
CCc1ncsc1C(=O)N1CCO[C@]2(COCCN(C(=O)CCBr)C2)C1	1838836951	PPGCJPWLUYHUPY-KRWDZBQOSA-N	446.367	1.561	50	20	IDGD	
COc1ccccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)Br)C2)C1	1838877764	XVPIGJDFUWTEMN-IFXJQAMLSA-N	441.322	1.549	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(N(C)C)cc3)CCO2)C1	1838964307	YRXKZEVSQYVFRZ-WIYYLYMNSA-N	439.940	1.076	50	20	IDGD	
CCc1noc(C)c1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2	1839153811	SMRFBHSOWCHENN-OALUTQOASA-N	448.347	1.852	50	20	IDGD	
C[C@@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1)c1ccc(O)cc1	1839171395	UKBIOEFRXBBEND-YJYMSZOUSA-N	431.316	1.756	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(O)ccc3O)CCO2)C1	1839446181	HGLSYTWKRSVKNG-JXFKEZNVSA-N	426.897	1.575	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3C[C@@H]3F)C2)C1	1839743852	AFMHVGHURQAUDR-SZYHELCZSA-N	449.429	1.686	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3ncccc3C)C2)C1	1840151098	VGCCJNUVCJIUNF-UTKZUKDTSA-N	439.940	1.033	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C(C)=C/c3ccc(C)o3)C2)C1	1840153169	GQEKLNVICNEGQV-BFRZJPPNSA-N	440.924	1.702	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccc(C)o3)CCO2)C1	1840508725	LRWHILGFGPZZLG-QFBILLFUSA-N	443.338	1.760	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)[C@H](C)n2ccnc2)C1	1841467285	ZSXLRFNHEWVDKL-AWEZNQCLSA-N	441.444	1.795	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC2(CCCN2C(=O)c2ccc(CS(C)(=O)=O)nc2)C1	1843216505	QHUWKOLALRXDLM-QGZVFWFLSA-N	448.372	1.680	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)c2c[nH]c3cc(Cl)ccc23)C1	1843699644	XVPCPZGYPONELG-UHFFFAOYSA-N	437.692	1.632	50	20	IDGD	
COc1ccc(Cl)c(C(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)c1	1844265600	UFLZIGMSMQWXHR-UHFFFAOYSA-N	443.891	1.478	50	20	IDGD	
C[C@@H]1Oc2ccc(C(=O)N3CCCC34CN(C(=O)[C@H](F)Br)C4)cc2NC1=O	1844730160	BMYFCHVQMKFKRH-HZMBPMFUSA-N	440.269	1.914	50	20	IDGD	
COc1cccc2c1C[C@@H](C(=O)N1CCCC13CN(C(=O)CCC(=O)NN(C)C)C3)CC2	1845927519	VMVJEQZYWTVEFA-SFHVURJKSA-N	442.560	1.377	50	20	IDGD	
Cc1cc(C(=O)N2CC3(CCCN3C(=O)CCC(=O)NN(C)C)C2)c2cc(O)ccc2n1	1846385145	WQGZIMFBADRHCL-UHFFFAOYSA-N	439.516	1.439	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CCOc1ccc(F)cc1	1847406886	YLGZDKOUGPATDW-OALUTQOASA-N	441.463	1.109	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCOCC3)cc2)c1	15879171	FVDDWDAEQJJIFW-UHFFFAOYSA-N	447.513	1.164	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)c1cc(Cl)c(OCC(N)=O)c(OC)c1	21028479	DJJAKCLPIRIBFM-UHFFFAOYSA-N	442.255	1.950	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)NNC(=O)c2cc(-c3ccccc3)on2)ccc1OC	27261185	KHYWPLPGDJSKRB-UHFFFAOYSA-N	430.442	1.333	50	20	IDGD	
N#Cc1c(F)cccc1N1CCN(C(=O)NNC(=O)CNC(=O)c2cccs2)CC1	725873466	NWEUTRFQFBILHN-UHFFFAOYSA-N	430.465	1.052	50	20	IDGD	
COc1ccc(CN2C[C@H](C(=O)NNC(=O)c3ccc4c(c3)OCCO4)CC2=O)cc1	726499558	HIIMRJFNCTWPRC-MRXNPFEDSA-N	425.441	1.276	50	20	IDGD	
Cc1cc(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)cc([N+](=O)[O-])c1	728215888	KZDHPHLBJKDSRB-UHFFFAOYSA-N	433.490	1.596	50	20	IDGD	
CCCNC(=O)NNS(=O)(=O)c1ccc(S(=O)(=O)N2C[C@H](C)C[C@@H](C)C2)cc1	728262594	HBFPXTFNJJREKB-ZIAGYGMSSA-N	432.568	1.256	50	20	IDGD	
CC1CCN(C(=S)SCC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)CC1	728847807	QDNAVSOTJGDHMT-UHFFFAOYSA-N	436.607	1.590	50	20	IDGD	
COCCCNC(=O)[C@@H](C)N1CCN(S(=O)(=O)c2ccc(CCCl)cc2)CC1	728935989	JKRRWWUPLQWGPB-MRXNPFEDSA-N	431.986	1.315	50	20	IDGD	
C[C@H](CCc1ccc2c(c1)OCO2)NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1	728951208	BCHSIFNBPCWDEF-OAHLLOKOSA-N	440.504	1.773	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)[C@H]2CCCN(S(=O)(=O)Cc3ccccc3)C2)cc1	730514064	CKBMEPLBIAGWKB-IBGZPJMESA-N	445.541	1.763	50	20	IDGD	
CC(C)(C)OC(=O)N1CCCC[C@H]1C(=O)NNC(=O)c1csc(N2CCOCC2)n1	730515781	YRRAKJPQWQFLIU-AWEZNQCLSA-N	439.538	1.530	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)CNC(=O)c1c(Cl)cccc1[N+](=O)[O-]	731050059	CKQFFEIUDPTNAQ-UHFFFAOYSA-N	430.808	1.395	50	20	IDGD	
O=C(NCCS(=O)(=O)NCC1CCC1)NNC(=O)c1cc2c(s1)CCCCC2	731686116	QYCOQKODCCNFKS-UHFFFAOYSA-N	428.580	1.681	50	20	IDGD	
CCS(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c1	731892375	ZMZVWQVCAPAQOH-UHFFFAOYSA-N	434.865	1.184	50	20	IDGD	
COC(=O)c1cccc(S(=O)(=O)NNC(=O)c2ccc(OC)c(Br)c2)c1	732049070	VPUGSVCDCWSIEQ-UHFFFAOYSA-N	443.275	1.868	50	20	IDGD	
N#CCOc1ccc(CC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc1	732053524	QRPPPXWILZBYDH-UHFFFAOYSA-N	442.497	1.377	50	20	IDGD	
Cc1nc(-c2ncccn2)sc1C(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	732328058	YOQGHADGVRUBPN-UHFFFAOYSA-N	442.413	1.435	50	20	IDGD	
O=C(NNS(=O)(=O)c1c[nH]c(C(=O)N2CCCC2)c1)c1cnn(-c2ccccc2)c1	733123037	NYUDVWDUHUAZBB-UHFFFAOYSA-N	428.474	1.060	50	20	IDGD	
CNS(=O)(=O)[C@H]1CCCN(C(=O)CCC(=O)C(C#N)=C2N(C)c3ccccc3N2C)C1	733275569	HWLGFQZRFIPVKH-HNNXBMFYSA-N	445.545	1.197	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2cc3cc(F)ccc3o2)CC1	735519593	FQIRBWUIFGYUQJ-UHFFFAOYSA-N	433.465	1.660	50	20	IDGD	
CN(CCN1CCN(c2ccccc2)CC1)CC(=O)NNC(=O)c1ccccc1Cl	738338322	ABLHOJXPFFHCCV-UHFFFAOYSA-N	429.952	1.855	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2cc(F)ccc2O1)c1cccc(S(=O)(=O)N2CCCC2)c1	740634906	PEHNRNZBZBXRDL-GOSISDBHSA-N	433.461	1.375	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)N[C@H](Cn2cccn2)c2ccccc2)c2ccccc2c1=O	741426870	QWXAWRAQIZGARV-GOSISDBHSA-N	431.456	1.516	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=S)N[C@H]2CCOc3ccccc32)c1	741476308	LCSRSIGZHTUBFD-INIZCTEOSA-N	434.543	1.570	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)ccc1-n1cncn1	742033234	KRBXQBOWYYRBMR-UHFFFAOYSA-N	433.516	1.549	50	20	IDGD	
O=C(NNC(=O)[C@H](c1cccc(F)c1)N1CCOCC1)c1nnc(O)c2ccccc12	742033646	DQOLPHYAGAJUIP-SFHVURJKSA-N	425.420	1.309	50	20	IDGD	
CC(C)c1nn([C@H]2CCS(=O)(=O)C2)cc1C(=O)NNC(=O)c1cc2c(s1)CCC2	742473883	IYARFWWWRPVPBH-ZDUSSCGKSA-N	436.559	1.991	50	20	IDGD	
Cc1nn(C)c2sc(C(=O)N[C@H](C)C(=O)NNc3ccccc3S(C)(=O)=O)cc12	743366849	COPYUQRLEMBYMY-LLVKDONJSA-N	435.531	1.608	50	20	IDGD	
CSc1nc(C)c(CCC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)c(O)n1	743829378	NULQESFSJHQGJY-UHFFFAOYSA-N	439.519	1.402	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NCc2noc(-c3cccs3)n2)c2ccccc2c1=O	745281835	ZDKBZBQRKLGGNT-UHFFFAOYSA-N	425.430	1.189	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)NC[C@H](C)CN2CCN(C)CC2)cc1Cl	745861653	DFYWIFQYFPKLPZ-ZDUSSCGKSA-N	442.948	1.576	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@H](C)c2nc(C(C)(C)C)no2)c2ccccc2c1=O	745918146	YFWYESNJYUWEQW-LLVKDONJSA-N	427.465	1.802	50	20	IDGD	
COC(=O)c1ccsc1N1CC[C@H](NC(=O)NNC(=O)c2ccccc2OC)C1=O	746778747	DRPBMMJOGGAPLZ-ZDUSSCGKSA-N	432.458	1.293	50	20	IDGD	
CC(=O)N[C@@H](Cc1c[nH]c2ccc(Br)cc12)C(=O)NNc1nccn(C)c1=O	747945250	FQVQGVXHJRQCHF-HNNXBMFYSA-N	447.293	1.215	50	20	IDGD	
Cc1nc(Cl)cc(NNC(=O)c2cccc(S(=O)(=O)N3C[C@@H](C)O[C@H](C)C3)c2)n1	747982190	UWMIXXDCCKCLAE-VXGBXAGGSA-N	439.925	1.993	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)NC1CCN(C2CCN(C)CC2)CC1	747987288	MZBVXRFGQZYCHS-UHFFFAOYSA-N	433.553	1.353	50	20	IDGD	
O=C(CCC(=O)N1CCN(S(=O)(=O)c2ccccc2)CC1)NNc1ccccc1F	748050316	ZODNILJKRXHIFW-UHFFFAOYSA-N	434.493	1.582	50	20	IDGD	
NS(=O)(=O)c1cccc(N2C[C@@H](C(=O)NNc3cccc4c3CCCC4)CC2=O)c1	748588622	POECUEXDUJABQZ-HNNXBMFYSA-N	428.514	1.709	50	20	IDGD	
NC(=O)CS(=O)(=O)c1ccc(C(=O)NNc2ccc(OCC(F)(F)F)cc2)cc1	748703752	SBAKVVVFSJKENH-UHFFFAOYSA-N	431.392	1.644	50	20	IDGD	
CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)NNC(=O)c1c(C)nc2ccccn12	749334397	DROUHKGZZZMRRU-GOSISDBHSA-N	436.447	1.772	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2cc3ccccc3o2)c(C(=O)OC)s1	749868054	QQOBIGHFFIUMEO-UHFFFAOYSA-N	438.439	1.691	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCc2cnc(N(C)C)n2C)cc1Br	751807359	RPNTXSYPJHJOPE-UHFFFAOYSA-N	425.287	1.401	50	20	IDGD	
Cc1noc(C2CCC(NC(=O)NNC(=O)c3nn(-c4ccccc4)cc3O)CC2)n1	753349956	PCAKUYCIBRDCCF-UHFFFAOYSA-N	425.449	1.940	50	20	IDGD	
O=C(COCCNC(=O)c1ccccc1)NNC(=O)c1cc(Br)ccc1O	753418824	REDIYPZOFWVSQZ-UHFFFAOYSA-N	436.262	1.362	50	20	IDGD	
C[C@@H](NCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)c1nc(-c2cccc(F)c2)no1	755039331	NEMWHZANBUJLKO-LLVKDONJSA-N	428.380	1.896	50	20	IDGD	
O=C(Cc1cc[nH]n1)NNC(=O)c1ccc(Br)cc1I	755267744	AWKJBHFQMMVLFQ-UHFFFAOYSA-N	449.046	1.781	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1cccc(NC(=O)NNC(=O)COc2ccc(C#N)cc2)c1	755516059	PPKSHBCKNYVUIK-UHFFFAOYSA-N	445.501	1.867	50	20	IDGD	
CON(C)S(=O)(=O)c1ccc(NC(=O)NNC(=O)Cn2ccc3ccccc32)cc1	755538825	UXPCKYCLXIACNX-UHFFFAOYSA-N	431.474	1.676	50	20	IDGD	
COC(=O)c1cc(NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c(F)cc1F	755850872	BUTMEZCYXQYWGE-UHFFFAOYSA-N	431.355	1.465	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(F)c(NC(=O)NNC(=O)COc2ccccc2F)c1	756686122	TWMYOBWSTXVHSE-UHFFFAOYSA-N	428.417	1.447	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1N1CCCS1(=O)=O	756702513	AAONGXYFGLFOPN-UHFFFAOYSA-N	433.446	1.910	50	20	IDGD	
CCOC(=O)Cc1nnc(NC(=O)NNC(=O)c2cc(-c3ccccc3OC)[nH]n2)s1	757754959	FBGHYXWOFRQXNV-UHFFFAOYSA-N	445.461	1.509	50	20	IDGD	
Cn1c(=O)oc2c(NC(=O)NNC(=O)CCN3CCN(c4ccccc4)CC3)cccc21	757758187	RKXUKNSLNRJGBU-UHFFFAOYSA-N	438.488	1.497	50	20	IDGD	
CN(CCCC(=O)NNc1nc(O)c2ccccc2n1)C1=NS(=O)(=O)c2ccccc21	758308955	IQRQWUBZRWRUPR-UHFFFAOYSA-N	440.485	1.640	50	20	IDGD	
O=C(CCCN1C(=O)c2cccc3cccc(c23)C1=O)NNC(=O)C(=O)Nc1ccccn1	758834434	OYUNHRUJFIMOKB-UHFFFAOYSA-N	445.435	1.397	50	20	IDGD	
CC(C)C[C@H](CCC(=O)NNC(=O)c1cccn1C)C(=O)NNC(=O)c1cccn1C	759112349	YVVGDLMKAZWABS-HNNXBMFYSA-N	430.509	1.028	50	20	IDGD	
N#C/C(=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)N1CC[C@H](CO)C1	759703571	OMQIJXBKFFXZGF-FSEGOYHTSA-N	427.892	1.827	50	20	IDGD	
CCS(=O)(=O)c1cc(F)ccc1NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	760013861	IHXPUWGPSHLSPP-UHFFFAOYSA-N	447.448	1.333	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)[C@@H]2COc3ccc(Br)cc32)C[C@@H](C)O1	760120517	XVWTYHXAAWCQBU-TYNCELHUSA-N	426.311	1.572	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2nccn3cc(C)nc23)c1	761390884	LCDWIKDCWSDIDT-UHFFFAOYSA-N	430.490	1.143	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNS(=O)(=O)c1ccc(Cl)c(Br)c1	761949368	HHDNZAYYHJRCMU-UHFFFAOYSA-N	436.671	1.435	50	20	IDGD	
Cc1nnnn1[C@@H](Cc1ccc(F)cc1)C(=O)NNC(=O)c1cc(-c2cccs2)[nH]n1	763157590	IKPRTRHDOUCGPL-INIZCTEOSA-N	440.464	1.817	50	20	IDGD	
O=C(NNC(=O)C(F)(F)C1(O)CCC1)c1ccccc1NS(=O)(=O)c1cccs1	763272912	UXXGZPVLAPZDPI-UHFFFAOYSA-N	445.469	1.860	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNS(=O)(=O)c1ccc(Cl)c(C(=O)O)c1	763439835	VSPKUDFJJYGPFC-UHFFFAOYSA-N	435.886	1.653	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1Cl	763468423	KCVPDQAOXNTUOO-UHFFFAOYSA-N	436.808	1.673	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)C(=O)Nc1cccc2ccncc12	763532392	ZHBBFNBNUVCODM-UHFFFAOYSA-N	446.511	1.533	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2ccccc2S(=O)(=O)C(F)F)c1	763624249	LFXASNCKUJRRJZ-UHFFFAOYSA-N	441.412	1.156	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1ccc(OCC(F)(F)F)cc1	763629717	RLMKXAHPZFNGTC-UHFFFAOYSA-N	435.362	1.984	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)COc2cccc(C(F)(F)F)c2)c(N(C)C)n1	763638967	GFWAATBYBSAUOM-UHFFFAOYSA-N	439.394	1.640	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2ccccc2S(=O)(=O)C(C)C)c1	763644000	CTBZOIHBWNOGKM-UHFFFAOYSA-N	447.513	1.650	50	20	IDGD	
CN(C)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCC3)cc1Cl	763783431	OCVAWPOXMKWXLE-UHFFFAOYSA-N	434.905	1.992	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)ccc1OC1CCOCC1	763839003	XFEKRZFXDYUKOL-UHFFFAOYSA-N	445.447	1.857	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccnn1Cc1ccccc1	763871113	CXDXPRDDJKDQDM-CQSZACIVSA-N	425.420	1.624	50	20	IDGD	
COC(=O)c1cc(F)ccc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccc(C(C)=O)cc1	763879528	XQOBAJRGVAUKEC-LBPRGKRZSA-N	445.403	1.368	50	20	IDGD	
CC[C@@H](C)n1nc(NC(=O)C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc1C	763944072	LGTFMFMMFRXERH-GFCCVEGCSA-N	425.449	1.454	50	20	IDGD	
CC(C)C[C@H](C)n1nccc1NC(=O)C(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	763947885	DEBMOTOTUZPNAE-AWEZNQCLSA-N	439.476	1.781	50	20	IDGD	
COC(=O)CCc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2OC)cc1	764011013	FSSMVCXYUQANDZ-UHFFFAOYSA-N	433.848	1.854	50	20	IDGD	
COc1ccc(OC(C)C)c(NC(=O)C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c1	764078605	XSXVLAWGNRLAAR-UHFFFAOYSA-N	449.485	1.286	50	20	IDGD	
COCCOc1c(Cl)cccc1NC(=O)C(=O)NNC(=O)[C@H]1Cc2ccccc2O1	764166578	CZPKWMGMZKNCRQ-MRXNPFEDSA-N	433.848	1.455	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(C#N)cc2)cc1OCc1cccnc1	764176957	IJCQOGJXBBYSDK-UHFFFAOYSA-N	445.435	1.941	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)C(=O)Nc2cccc(N3CCN(CC4CC4)CC3)c2)c1	764238251	RMTRWYZAZKFECC-UHFFFAOYSA-N	446.511	1.490	50	20	IDGD	
CCn1cnnc1-c1ccccc1NC(=O)C(=O)NNC(=O)c1cccc2ncccc12	764257513	JRTVCKXGRUIXIN-UHFFFAOYSA-N	429.440	1.913	50	20	IDGD	
CCCOc1cccc(NC(=O)C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1	764266013	IEQOFIUAECNMCW-UHFFFAOYSA-N	426.477	1.268	50	20	IDGD	
CN(C(=O)c1ccc(NC(=O)C(=O)NNC(=O)Cc2cc[nH]n2)cc1)C1CCCCC1	764292518	CNLKUWJUHVLTNZ-UHFFFAOYSA-N	426.477	1.143	50	20	IDGD	
CC(C)(C(=O)NNC(=O)C(=O)Nc1ccc(CS(C)(=O)=O)c(F)c1)c1ccccc1	764301441	DXSLVVXHMCCNFX-UHFFFAOYSA-N	435.477	1.434	50	20	IDGD	
O=C(NNC(=O)C1CCC1)C(=O)Nc1ccc(CCn2nnc(-c3ccccc3)n2)cc1	764338537	HYLRPIQRSTWKFS-UHFFFAOYSA-N	433.472	1.469	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)C12C[C@H]3C[C@@H](CC(Br)(C3)C1)C2	764343799	SGMVNNPXQDDSLS-NYYJTOMGSA-N	435.322	1.693	50	20	IDGD	
COc1cc(C)ccc1Oc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccncc2)cn1	764356250	SDPRSEPOSRYWHP-UHFFFAOYSA-N	435.440	1.915	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)C(=O)Nc1ccc(CC(=O)N(C)c2ccccc2)cc1	764386588	ZTWWVYKCRLKPCP-UHFFFAOYSA-N	445.479	1.995	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NN=Cc1cccnc1N)N(S(C)(=O)=O)CC2	764663728	XFDWLTFCSQIDMG-MRXNPFEDSA-N	447.517	1.080	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)CN2C(=O)NC3(CCCCC3)C2=O)n[nH]1	765587610	FGUYUZGPPVPNCE-UHFFFAOYSA-N	440.460	1.101	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)N[C@H](c1cccc(F)c1)c1ccccn1	765642612	HOKMFPFWPALRQS-LJQANCHMSA-N	432.419	1.930	50	20	IDGD	
Cc1nn(C(F)F)c(C)c1CC(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765736447	SIPCAODFFWBXHD-UHFFFAOYSA-N	448.474	1.043	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1cccc(F)c1I	766261228	PXIAOHWBWOFAJU-UHFFFAOYSA-N	431.165	1.311	50	20	IDGD	
CCc1nn(C)c(CC)c1S(=O)(=O)NNC(=O)c1ccc(OC)c(Br)c1	766316145	AYCCKRWXEHNYQC-UHFFFAOYSA-N	445.339	1.939	50	20	IDGD	
CN(C)c1ncccc1C(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	766664769	SQGJZIATBQCJGL-UHFFFAOYSA-N	430.940	1.380	50	20	IDGD	
O=C(COC(=O)[C@H]1CC(=O)N(Cc2ccccn2)C1)NNC(=O)c1ccc(Cl)cc1	766923464	JVIFAKUDPNXCIA-AWEZNQCLSA-N	430.848	1.088	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)N[C@H]2CCN(C3CCCCC3)C2=O)nc1	767172189	YSMWDMWEPBZTNT-INIZCTEOSA-N	438.554	1.328	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)c1cccc(N2CCCS2(=O)=O)c1	767267011	VTVVOIKDJINJLQ-UHFFFAOYSA-N	445.497	1.082	50	20	IDGD	
CC(C)(C)OC(=O)N1CCO[C@H](C(=O)NNC(=O)c2cc(Br)ccc2O)C1	768158809	BEEWVPZPGRKBKV-ZDUSSCGKSA-N	444.282	1.552	50	20	IDGD	
CN(C)C(=O)c1cc(F)ccc1NC(=O)C(=O)NNC(=O)c1cc2ccccc2cc1O	768232061	JREQEPRCDPONED-UHFFFAOYSA-N	438.415	1.786	50	20	IDGD	
CCc1[nH]nc(C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)c1[N+](=O)[O-]	768290003	BVMPRVRQHPPFQS-UHFFFAOYSA-N	449.899	1.113	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)COC1CN(C(=O)OC(C)(C)C)C1	768635396	AYLSABJKTLSCCC-UHFFFAOYSA-N	429.495	1.178	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCC(C)(C)c2ccncc2)cc1	768980750	JBERIGYGTPSWAI-UHFFFAOYSA-N	433.534	1.319	50	20	IDGD	
Cc1noc(C)c1S(=O)(=O)NCC(=O)NNC(=O)c1cc2c(s1)CC[C@H](C)C2	769375129	JIIHECQTPRIGHA-VIFPVBQESA-N	426.520	1.217	50	20	IDGD	
CC(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1	769923072	KHEIHJHILTVFLU-UHFFFAOYSA-N	431.518	1.336	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)c1ccc2nc(C(F)(F)F)cn2c1	770208821	OMERQFJNINKLGJ-UHFFFAOYSA-N	440.407	1.721	50	20	IDGD	
Cc1nc(NCC(=O)NNC(=O)C(=O)NC(C)C)c2cc(-c3ccccc3)sc2n1	770744317	AJCWFEXVYYPLOI-UHFFFAOYSA-N	426.502	1.751	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N[C@@H]2CC(=O)N(c3c(F)cccc3F)C2)cc1OC	770758061	QYLITYZRVMBIRV-GFCCVEGCSA-N	434.399	1.732	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c2ncccc12	770772310	WBJKARNTRIIMED-UHFFFAOYSA-N	430.424	1.829	50	20	IDGD	
Cc1cccc(F)c1NNC(=O)C(=O)Nc1ccc(N2CCN(C(=O)C3CC3)CC2)nc1	770816436	VJFZWHZHMLLHNS-UHFFFAOYSA-N	440.479	1.670	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1ccccc1-n1ncc(Cl)c(Cl)c1=O	771964923	ASGGKUMAVRRQGA-VIFPVBQESA-N	427.244	1.642	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)[C@H]1CCCN(C(=O)COc2ccccc2)C1	772147617	YJAPHRFHKFXACQ-IRXDYDNUSA-N	433.505	1.429	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)[C@@H]1CCCN1C(=O)c1ccccc1	772896566	ADGYNUQRBQEPDY-KRWDZBQOSA-N	428.876	1.408	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NNC(=O)CCN2C(=O)c3ccccc3C2=O)C1	773411832	AOSOSXXLZXTIPW-CQSZACIVSA-N	444.488	1.467	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)C(=O)Nc2ccc3c(ccn3CCN3CCOCC3)c2)n1	773481716	KCWXYXATVHFYRZ-UHFFFAOYSA-N	437.504	1.462	50	20	IDGD	
CC(C)CC(=O)NNC(=O)c1cc(I)ccc1N1CCOCC1	778387120	BLDAWNWKEXFFLC-UHFFFAOYSA-N	431.274	1.935	50	20	IDGD	
COCCc1nnc(-c2cccc(C(=O)OCC(=O)NNC(=O)c3cccc(C#N)c3)c2)o1	778926057	SNKZXNVWRBZJEP-UHFFFAOYSA-N	449.423	1.415	50	20	IDGD	
Cc1cc(C(=O)N2CCN(S(=O)(=O)CBr)CC2)nc(C(F)(F)F)n1	779051496	ILAHMCQARNXZMB-UHFFFAOYSA-N	431.234	1.244	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)Nc2ccc(F)c(S(=O)(=O)NC3CC3)c2)c1	779088102	RQZWISKUYCGZFQ-UHFFFAOYSA-N	442.494	1.819	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)NC[C@@H]2CC(=O)N(C3CC3)C2)c1	780885056	BAUQOTCRAGUPGE-JTQLQIEISA-N	425.283	1.413	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)C[C@](C)(O)c3ccccc3)cc2)CC1	780992523	ZGYMLIXYUCEQSB-NRFANRHFSA-N	432.546	1.364	50	20	IDGD	
CCN(CC)C(=O)CCC1CCN(CC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)CC1	782516129	GZITZGJGBPFWTL-UHFFFAOYSA-N	433.509	1.716	50	20	IDGD	
CS(=O)(=O)CCn1ccc(NC(=O)C(=O)NN(c2ccccc2)c2ccccc2)n1	782821572	OBTCYYZTQOBGNY-UHFFFAOYSA-N	427.486	1.736	50	20	IDGD	
CCc1ccc(NC(=O)C(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1CC	782897259	MRWGYRQBXHDUNJ-UHFFFAOYSA-N	431.518	1.504	50	20	IDGD	
NC(=O)c1n[nH]c2ccc(NC(=O)C(=O)NNC(=O)c3ccc(Cl)cc3Cl)cc12	782926767	LEULNZUYUPVICL-UHFFFAOYSA-N	435.227	1.368	50	20	IDGD	
CCC(CC)NC(=O)[C@H]1CN(C(=O)C(=O)NNc2cncc(Cl)n2)c2ccccc2O1	783259000	TXOIBQSWVOLZFJ-OAHLLOKOSA-N	446.895	1.672	50	20	IDGD	
Cc1ccnc(NNC(=O)C(=O)N2CCc3cc(S(=O)(=O)N4CCCCC4)ccc32)c1	783931375	NYNSXNDNDCNITF-UHFFFAOYSA-N	443.529	1.597	50	20	IDGD	
COc1ccc(C(=O)N2CCN(C)CC2)cc1NC(=O)C(=O)NNc1ccc(F)cc1	784782938	JTJFEEUFHQYFQJ-UHFFFAOYSA-N	429.452	1.304	50	20	IDGD	
O=C1COc2cc(NC(=O)C(=O)NNc3ccc(S(=O)(=O)C(F)F)cc3)ccc2N1	784836216	TYCQCEZSTXLVFA-UHFFFAOYSA-N	440.384	1.096	50	20	IDGD	
CC1CCN(S(=O)(=O)c2ccc(NC(=O)C(=O)NNc3ccnc(F)c3)cc2)CC1	784847018	MILKSIAJPHZJDM-UHFFFAOYSA-N	435.481	1.723	50	20	IDGD	
C[C@H]1C[C@H](C)CN(S(=O)(=O)c2ccc(NC(=O)C(=O)NNc3ccnc(F)c3)cc2)C1	784848676	LEJNPOFUHGVEIF-KBPBESRZSA-N	449.508	1.969	50	20	IDGD	
NC(=O)[C@@H]1CCC[C@@H](C(=O)NNC(=O)c2nc(-c3ccccc3)n(-c3ccccc3)n2)C1	786687828	ITARMAXBPCCUAH-IAGOWNOFSA-N	432.484	1.987	50	20	IDGD	
CCNC(=O)Nc1ccc(C)c(NC(=O)C(=O)NNC(=O)c2ccc(OC)c(OC)c2)c1	787540658	CNVNMWUSXJYIGN-UHFFFAOYSA-N	443.460	1.553	50	20	IDGD	
COCCOCC(=O)NC1CCC(C(=O)NNc2nnc(-c3ccccn3)s2)CC1	788565657	TUJHVSYTNLATHD-UHFFFAOYSA-N	434.522	1.381	50	20	IDGD	
C=CCc1cccc(C(C)C)c1NC(=O)C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	789584998	UYQQTTZPUCPYMD-UHFFFAOYSA-N	433.472	1.914	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2CC(c3cccnc3)=NO2)c1	790104316	RTOKVZKDVTYEHK-SFHVURJKSA-N	445.501	1.066	50	20	IDGD	
CCCS(=O)(=O)Nc1cccc(NC(=O)C(=O)NNc2cccc(F)c2[N+](=O)[O-])c1	790998926	LMRDGASCMHMGIH-UHFFFAOYSA-N	439.425	1.967	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@@H](C(=O)NNC(=O)c2cccc(Cl)c2)[C@H](C)O)cc1	792120442	RTZLAVSLWJZCQN-BLLLJJGKSA-N	425.894	1.137	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)Cc2ccc(F)cc2)cc(Cl)c1F	792269600	RLKPQDDMKFAIOB-UHFFFAOYSA-N	425.775	1.733	50	20	IDGD	
CCN(C(=O)OC(C)(C)C)[C@H](C)CNC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	792313070	TWPCFRMTZAOYST-CYBMUJFWSA-N	446.508	1.523	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)c2nc(Cl)c(Cl)c(N)c2Cl)cn1	795280853	ULPAGDYRRWRANP-UHFFFAOYSA-N	426.669	1.651	50	20	IDGD	
Cc1nn(Cc2ccccc2)c(N)c1C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	796144291	UFWITWMCFJFONV-UHFFFAOYSA-N	434.504	1.290	50	20	IDGD	
CCNC(=O)N(C)c1cccc(NC(=O)C(=O)NNC(=O)COc2ccccc2F)c1	796992780	XHXADMLFXPHWBJ-UHFFFAOYSA-N	431.424	1.156	50	20	IDGD	
Cc1cc(O[C@@H]2CCN(C)C2=O)ccc1NC(=O)NNC(=O)c1ccc2c(c1)OCCO2	799240804	LYDVIRLQFBUOPN-GOSISDBHSA-N	440.456	1.842	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)N[C@@H]1CCCN(C(=O)Cc2ccccc2)C1	802475260	GFBSOUXDCTVZSN-OAHLLOKOSA-N	441.444	1.478	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)NC2CCC3(CC2)NC(=O)NC3=O)c(C)n1C[C@H]1CCCO1	804730831	DOTOBHOHPCJZDM-JMMKGUAHSA-N	439.516	1.828	50	20	IDGD	
O=C1COC[C@@H](C[C@@H]2CN(C(=O)C(=O)NNc3ccc([N+](=O)[O-])cc3)c3ccccc32)N1	806984538	LWHXHCWLHRABCW-UKRRQHHQSA-N	439.428	1.073	50	20	IDGD	
C[C@H](C(=O)N1CCN(S(=O)(=O)CBr)CC1)n1ccc2ccccc2c1=O	807196331	KGCWCCYTSLVBDT-CYBMUJFWSA-N	442.335	1.389	50	20	IDGD	
CN(C)NC(=O)Nc1cccc(NC(=O)CCC(=O)N2CCN(c3ccccn3)CC2)c1	807951188	LJTKZCOTHOWRTI-UHFFFAOYSA-N	439.520	1.747	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)C2(c3ccccc3)CC(=O)C2)c1	809957727	VTZZOGVVKOGZIL-UHFFFAOYSA-N	443.525	1.779	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccccc1F)NNC(=O)c1ccc(F)cc1Br	810172404	ICOFVAYUACKQHL-UHFFFAOYSA-N	448.245	1.467	50	20	IDGD	
COC(=O)c1c(F)ccc(NC(=O)C(=O)NNc2ccc(Br)cn2)c1F	810394898	IPARHMHRNBPTLG-UHFFFAOYSA-N	429.177	1.991	50	20	IDGD	
CCOCc1nc([C@H](C)NC(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)no1	812564161	NYSOZNCSSREMAO-NSHDSACASA-N	427.487	1.075	50	20	IDGD	
CCCN(CC)C[C@@H](C)NC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	812677950	ACQSIAFPNMMYMU-MRXNPFEDSA-N	439.582	1.536	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)Nc2ccc(CNS(C)(=O)=O)cc2)cc1	812946332	ZISJZPZGRMTMCE-UHFFFAOYSA-N	441.535	1.135	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)cc1)[C@H]1C[C@H]1C	815566524	XFVANUXHGVGUOR-KUHUBIRLSA-N	449.467	1.484	50	20	IDGD	
CS(=O)(=O)c1ccc(-c2csc(CC(=O)NNC(=O)N=c3cc[nH]cc3)n2)cc1	816595993	JXFMQUOFJDZORI-UHFFFAOYSA-N	431.499	1.426	50	20	IDGD	
CN1CCN([C@H](C(=O)NNc2ccccc2S(=O)(=O)N(C)C)c2ccccc2)CC1	817052635	KAKIIYKNMGCKJB-FQEVSTJZSA-N	431.562	1.369	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)CCNS(=O)(=O)c1cccc(Cl)c1	825649511	VKUQBIZIEAPXMH-UHFFFAOYSA-N	440.909	1.277	50	20	IDGD	
O=C(NNC(=O)[C@H](O)[C@@H](O)c1nc2ccccc2s1)c1cc(Br)c[nH]1	843450685	PIZMVKNHCCKYGS-VXGBXAGGSA-N	425.264	1.242	50	20	IDGD	
Cc1c(-c2noc(CCC(=O)C(C#N)=C3N(C)c4ccccc4N3C)n2)c(O)nc(=O)n1C	904907319	XYPRKSHYKQMNHF-UHFFFAOYSA-N	447.455	1.667	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)NCc1ccc(S(N)(=O)=O)s1	915906231	TYGSCHZAWNFTOA-GFCCVEGCSA-N	448.526	1.847	50	20	IDGD	
O=C(NNC(=O)c1cccc(NC(=O)c2cccc(Br)c2)c1)C(=O)NC1CC1	916041109	ZFVCFSNNHULLOE-UHFFFAOYSA-N	445.273	1.741	50	20	IDGD	
O=C(Cc1ccc2ccccc2c1)NNC(=O)NCCCN1CCN(c2ncccn2)CC1	916263931	KNUXRLIBXDYAMK-UHFFFAOYSA-N	447.543	1.715	50	20	IDGD	
COc1cc(C=NNC(=O)c2sc(N3CCOCC3)nc2C)ccc1OCC(=O)O	916339677	RMKVDAUTKIUSPO-UHFFFAOYSA-N	434.474	1.524	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)NCC[C@@](O)(c1nccn1C)C(F)(F)F	916378601	PRKUWMDAJAUSQP-QGZVFWFLSA-N	439.398	1.160	50	20	IDGD	
Cn1cc(S(=O)(=O)N2CCOCC2)cc1C(=O)NNC(=O)c1ccc2ccccc2c1	918112124	PLHYYQRAMYGIJY-UHFFFAOYSA-N	442.497	1.274	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)NCCS(=O)(=O)c2ccccc2)cc1OC	918229628	KTSPNNLDYXEODM-UHFFFAOYSA-N	435.502	1.902	50	20	IDGD	
CNC(=O)NNC(=O)c1cc(O)nc2ccc(S(=O)(=O)Nc3ccc(F)cc3)cc12	919877930	NZHJNBZJDNZJJQ-UHFFFAOYSA-N	433.421	1.454	50	20	IDGD	
CCOC(=O)c1ccc(CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1	919919093	HLWREVIFNVQTRO-UHFFFAOYSA-N	433.490	1.301	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)CCCNS(=O)(=O)c2ccc(F)cc2)cc1	920213024	OQZQKMUYNYDVKI-UHFFFAOYSA-N	437.493	1.673	50	20	IDGD	
Cc1ccc(OCc2nc(/C=C(\C#N)C(=O)c3c(N)n(C)c(=O)n(C)c3=O)cs2)cc1	920398795	NALWUIKOMOSZBR-MDWZMJQESA-N	437.481	1.800	50	20	IDGD	
CCOc1ccc(OCc2ccc(C(=O)NNC(=O)CCNS(C)(=O)=O)cc2)cc1	920406500	QFEXCELRZCWMHE-UHFFFAOYSA-N	435.502	1.365	50	20	IDGD	
COCCS(=O)(=O)c1ccc(C(=O)NNC(=O)c2ccc(Br)cc2)cc1	1251424565	YHTKNGAWEAOYOT-UHFFFAOYSA-N	441.303	1.944	50	20	IDGD	
CS(=O)(=O)CC[C@@H](NS(=O)(=O)/C=C/c1ccccc1)C(=O)N1CC=C(C#N)CC1	1321049147	RKBBHAJMJUGYEE-MOVXZBDNSA-N	437.543	1.062	50	20	IDGD	
CCOC(=O)[C@@H]1CN(C(=O)OC(C)(C)C)CCN1CC(=O)NNC(=O)c1ccc(C)cc1	1322786561	PTKLZNILLMEFCL-KRWDZBQOSA-N	448.520	1.240	50	20	IDGD	
O=C(NNC(=O)c1n[nH]c2c1CCCC2)Nc1ccc2nc(N3CCOCC3)oc2c1	1323844996	MLXGGLINKZIVAC-UHFFFAOYSA-N	425.449	1.733	50	20	IDGD	
CC(C)(C)c1ccc(NNC(=O)c2cccc(S(=O)(=O)NC[C@@H]3CCCO3)c2)nn1	1339250660	CEKNRHIZDMMUFZ-HNNXBMFYSA-N	433.534	1.988	50	20	IDGD	
O=C(c1ccc2nc(CO)[nH]c2c1)N1CC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1777706443	ZQRNFQNHTQRITI-GOSISDBHSA-N	427.288	1.302	50	20	IDGD	
O=C(c1ccn(C(F)F)n1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1779617040	OUJKTRJFDZAJCC-QMTHXVAHSA-N	425.205	1.412	50	20	IDGD	
O=C(c1cc([N+](=O)[O-])cc2c1OCC2)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Cl)CCO2	1780093580	NULOHNFWGHPCFN-CRAIPNDOSA-N	427.816	1.508	50	20	IDGD	
COc1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](F)Br)C3)nn1C	1780245008	BMJFAACYJFNCTK-HACGYAERSA-N	447.305	1.247	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)[C@H]1SC(=N)NC1=O)C2	1780702526	KBELBSVGVDIJFZ-QEAYJNAZSA-N	444.985	1.320	50	20	IDGD	
O=C(C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Br)C1)c1ccco1	1780771041	RDFBXONZNNGUFT-HACGYAERSA-N	431.258	1.667	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2)c1cn2c(F)cccc2n1	1781318944	PYKSLOKUMMKESZ-BXTJHSDWSA-N	438.887	1.201	50	20	IDGD	
CC(C)(C)c1cnc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)cn1	1781329634	ICFDZFFIASNEEK-RDTXWAMCSA-N	443.317	1.908	50	20	IDGD	
CCOc1ccc(Cl)cc1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1781743578	SYGJHJQKVQVFDB-BEFAXECRSA-N	431.316	1.782	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)C1(O)CCC1)C2	1781995857	XRVVZNVLOHEMTO-BASYENTBSA-N	431.371	1.835	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cc4n(n3)CCCC4)CCO2)C1	1783349689	RFOFZEVTVPZKKQ-DNVCBOLYSA-N	439.354	1.836	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H]3C[C@@]34C(=O)Nc3ccccc34)C2)C1	1783492377	BZZNHSYEDITPFR-AVIJNYRZSA-N	445.947	1.991	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2	1783529640	WDMHELQBLDWATC-COPLHBTASA-N	426.149	1.631	50	20	IDGD	
COc1cc(OC)cc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](C)Br)C3)C2)c1	1783538812	XPPHEYSQNFFKBU-YJYMSZOUSA-N	441.322	1.931	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cccnc3OCC3CC3)CCO2)C1	1783873346	NYEBBONCBRDHGK-LAUBAEHRSA-N	437.924	1.568	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3c[nH]c4ccc(OC)cc34)CCO2)C1	1783877958	SFOHKTKXDITEFW-UWJYYQICSA-N	435.908	1.874	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cccc3ccccc13)CCO2	1783935565	VRJKWUVSESCHIK-DEOSSOPVSA-N	438.528	1.656	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)C3CCN(CC)CC3)C2)C1	1785647537	IWSGYQPVXFVGGY-LPHOPBHVSA-N	430.387	1.722	50	20	IDGD	
CC[C@H](Cl)C(=O)NC1(c2ccc(NC(=O)CN3CCS(=O)(=O)CC3)cc2)CCC1	1786690052	DKNZOIUGVAGXON-KRWDZBQOSA-N	441.981	1.868	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)c1ccc2c(c1)CCCC2=O	1787999657	XGWNSRHYYVOQPC-UHMOLFJZSA-N	434.920	1.399	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)c1csc2c1CCCC2	1788312998	JJFSLKRXCCRQBJ-SDNTUTLCSA-N	426.966	1.820	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C#CC3(O)CCCCC3)[C@H]2C1	1788637481	VQGCDSDAGFEQNU-QZWWFDLISA-N	441.366	1.448	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3(F)CC3)C[C@@H]21	1789221822	IMUGVCYIECZIPX-OWQGQXMQSA-N	449.435	1.616	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ncc(Cl)cn3)C[C@@H]21)[C@@H](F)Br	1789922522	OISOWKRFHHHGIT-PDEGPIFNSA-N	435.681	1.414	50	20	IDGD	
Cn1nc2c(c1C(=O)N1CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]3C1)CCC2	1789925013	KVEHKJLUROSHSF-YLUJIRGKSA-N	443.317	1.193	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC1(c2ccc(NC(=O)c3cc[n+]([O-])cc3)cc2)CCC1	1789956283	ZPEWPIRQQKCWLK-UHFFFAOYSA-N	425.489	1.441	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(O)c([N+](=O)[O-])c3)[C@H]2C1	1790023092	IIMNQWRXKFBCGE-ZJOBFFGXSA-N	425.869	1.911	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccncc3F)C[C@@H]21	1790962199	WUKOCYWEUHRUJS-PCBIJLKTSA-N	428.302	1.988	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)c3ccccc3)C[C@@H]21	1791287996	MEWKYGNJNOZSST-NTLWEQJWSA-N	434.512	1.050	50	20	IDGD	
CN1CCCn2nc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)C(C)(C)CCl)cc2C1	1792784872	YMEPELCXNHXRMM-JLVBRIDZSA-N	437.972	1.187	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3cc(F)c(F)cc3[nH]1)C2)[C@H](O)CCl	1792981292	JDOFOKGOORIKBM-ZWUPXRALSA-N	427.835	1.249	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2	1793879814	FVSQSZFLYGKTOE-FPYNETTCSA-N	442.315	1.243	50	20	IDGD	
Cc1ccc2[nH]cc(CC(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3cccc(B(O)O)c3)c2c1	1796190000	QBIRPDWCHYXLMK-WKCHPHFGSA-N	445.328	1.651	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)[C@H](O)c1ccccc1Cl	1796190596	OQLYIGJOEMEPKA-AXVVYFOYSA-N	442.708	1.005	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](Br)Cc1ccccc1)C2)c1cnoc1	1796527433	HXJZQYRQNFXUKK-MHORFTMASA-N	448.317	1.884	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1[C@H]2Sc3ccccc3[C@@H]21)c1ccc(B(O)O)cc1	1798451736	BNATVMCNEOAWIU-JUOVRFQDSA-N	448.353	1.506	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnn(C)c1Cl	1799027551	MZJWNEZFDZLUIZ-MGGJZVGQSA-N	445.911	1.459	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cc(F)ccc1[N+](=O)[O-])C2	1799272082	ZFEGAHIAKCDDCK-ZFHGCVPZSA-N	427.860	1.883	50	20	IDGD	
Cn1nc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@](C)(Cl)CCl)c2c1CCC2	1799275358	QETHQUDGQRBNMF-CVGJEZRXSA-N	429.348	1.348	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccn3cncc13)C2	1799275716	ATGDLWJJRIFHGB-UESRRSCYSA-N	425.316	1.774	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)c1ccccc1Cl)C2)[C@@H](F)Br	1799351897	FFIIBFDRLBIJNC-QFWNWRTJSA-N	449.704	1.654	50	20	IDGD	
COc1c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCBr)C3)ccc(F)c1F	1799675796	YJYUZTLYHDPWFT-CULMDFNYSA-N	447.276	1.962	50	20	IDGD	
COc1c(C)cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)cc1C	1800607731	ZZVPMLPSALKLGA-WKCHPHFGSA-N	436.317	1.557	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)n1cc(C)cn1)C2	1800644326	PNKJZFQYNFDGSR-RBGFHDKUSA-N	427.343	1.516	50	20	IDGD	
C[C@H](Oc1ccccn1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@](C)(Cl)CCl)C2	1801366215	CLKQABOIRVJBDV-WXZWTWHISA-N	430.332	1.675	50	20	IDGD	
CN(C)C(=O)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](Br)Cc1ccccc1	1801568528	ZGVONNCTCISLBH-YYIAUSFCSA-N	436.350	1.719	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnc(C(F)(F)F)cn1)C2	1802333465	YHVVOWLWXHEQIM-CLLJXQQHSA-N	442.442	1.120	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cn3ccsc3n2)[C@H]1c1cccnc1)[C@@H](O)CCl	1803142872	LOCXVPMJOMDRJB-BPUTZDHNSA-N	433.921	1.710	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC2(CCCN(C(=O)[C@H]3C[C@@H]3C3CC3)C2)CC1	1805360329	RWRZCQBUQNXPCW-MSOLQXFVSA-N	425.533	1.576	50	20	IDGD	
Cn1ncc(C(=O)N2CCC3(CCCN(C(=O)[C@H](O)CCl)C3)CC2)c1C(F)(F)F	1805517820	IGFCMHMNRWZGQN-CYBMUJFWSA-N	436.862	1.883	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@@H](CNC(=O)[C@H]2CCC(=O)N2)[C@H]1c1cccnc1	1806818194	BBKZPLLVOUYEJH-DUFGSWQCSA-N	437.338	1.397	50	20	IDGD	
N=C(N)SCC(=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@H]1c1cccnc1	1807005817	HWUHYFOMIZGVCB-WCFLWFBJSA-N	432.319	1.405	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H](CNC(=O)c2cc(O)n[nH]2)[C@@H]1c1cccnc1	1807284013	ONSOZJLXPHCFRF-KFNAQCHYSA-N	436.310	1.861	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1CCN(C(=O)CN2CCCC2=O)[C@H]1c1cccnc1	1808295349	GUOVPOPSNRIKDU-QSFXBCCZSA-N	441.359	1.946	50	20	IDGD	
COC[C@H](NC(C)=O)C(=O)NC[C@H]1CCN(C(=O)C(C)(C)CCl)[C@H]1c1cccnc1	1810558575	GKDPIXLTDBKLLR-SQNIBIBYSA-N	438.956	1.504	50	20	IDGD	
COC(=O)NCC(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)Br)[C@H]1c1cccnc1	1813268934	MALJLCBRRIVUFN-ZLDLUXBVSA-N	427.299	1.227	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@](C)(O)C(F)(F)F)n[nH]1	1815533540	NKCRBVHCUYGZDM-ZVWUFJHRSA-N	426.823	1.969	50	20	IDGD	
O=C(Cc1ccc2c(c1)OCO2)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1	1816997758	IEIWZWRBRIALKR-LSDHHAIUSA-N	434.880	1.973	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccnn2)[nH]n1	1818112702	HLXGFIAIJGBWHU-VEMXNMSTSA-N	449.475	1.640	50	20	IDGD	
CO[C@@H](C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)n[nH]1	1818113127	CJSFKHANECDKTI-WJROLRPUSA-N	429.481	1.571	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)C(=O)Nc1cccnc1)CC2	1826000199	OGIPKNMKVJMSNA-JQWIXIFHSA-N	437.909	1.343	50	20	IDGD	
C[C@@H](CS(C)(=O)=O)C(=O)N[C@@H]1CCc2nc(NC(=O)C(Cl)Cl)sc2C1	1826093412	ZQGUHVFYDHGVRB-JGVFFNPUSA-N	428.363	1.540	50	20	IDGD	
O=C1NCCn2nc(C(=O)N3CCCC[C@H]3C3CCN(C(=O)C(Cl)Cl)CC3)cc21	1826199799	WULVMRZPYXVLBM-AWEZNQCLSA-N	442.347	1.664	50	20	IDGD	
CN[C@H](CC(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@H](C)Br)CC1)C(=O)O	1826947936	HEZZRRPQDAKTDC-CFVMTHIKSA-N	432.359	1.452	50	20	IDGD	
Cc1ccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)nc1	1827051366	VQDMWWXOSNLMSB-JOCHJYFZSA-N	435.333	1.617	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(F)c3C)CCO2)C1	1830164162	XTABBCZNPUOSNU-JXFKEZNVSA-N	428.888	1.458	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C=C/c3ccoc3)C2)C1	1830535332	MRGXSNVSBFHXAH-HMSPERNYSA-N	441.322	1.780	50	20	IDGD	
C=CCOCCCC(=O)N1CCO[C@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1	1831410911	HEVIVQQMPUUWKJ-HXUWFJFHSA-N	428.602	1.277	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3nnc(C)s3)C2)C1	1831645573	DTURCQVPGBUYBC-KBXCAEBGSA-N	430.958	1.253	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cn4ccsc4n3)C2)C1	1831650919	MHADXTCYUNRMQJ-IFXJQAMLSA-N	440.953	1.873	50	20	IDGD	
COc1cccnc1CCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1832864234	KEPXHZFKJKSDCS-IEBWSBKVSA-N	429.876	1.014	50	20	IDGD	
Cc1cccc(C(=O)NC2CCN(C3CCN(C(=O)[C@H](O)CCl)CC3)CC2)c1F	1833155204	CLTBWFFXMIXDAR-GOSISDBHSA-N	425.932	1.919	50	20	IDGD	
C[C@@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)C3(C)COC3)CC2)CC1	1833261342	QRXCGPWWWGOYAS-AWEZNQCLSA-N	430.387	1.626	50	20	IDGD	
C[C@H](C(=O)N1CCC(N2CCC(NC(=O)[C@H](F)Br)CC2)CC1)n1ccnc1	1836414075	VXNQNPPXVVBCMB-CJNGLKHVSA-N	444.349	1.706	50	20	IDGD	
CCc1ncsc1C(=O)N1CCOC[C@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1837714485	IIEXITVZCLSPMH-IBGZPJMESA-N	441.626	1.627	50	20	IDGD	
CCn1nc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)cc1C	1838152618	OVRVDIIQOQSOHG-KDOFPFPSSA-N	443.342	1.065	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc4cccnn4n3)CCO2)C1	1838423224	JPVVDNUWYSINMS-OXQOHEQNSA-N	435.912	1.207	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)[C@H]3CC=CCC3)CC2)CC1	1838633836	PSIFVBZNHJFPQM-SFHVURJKSA-N	434.581	1.714	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cn4c(F)cccc4n3)C2)C1	1839148088	LXXXXSNKVZQBJB-JLTOFOAXSA-N	438.887	1.561	50	20	IDGD	
CCn1nc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)cc1C	1839153829	SWDIKGNKCYHXLX-RTBURBONSA-N	447.363	1.518	50	20	IDGD	
O=C(Cc1ccccc1O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839202871	RVHUUYZCVLEVKB-AEFFLSMTSA-N	445.285	1.082	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CCCC(F)(F)F)C2)C1	1840030193	CXZJFMCHBIDOQX-DOMZBBRYSA-N	445.276	1.959	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C)cc(C)n3)C2)C1	1840151428	BAXCWQIMJVTRJN-UZLBHIALSA-N	425.913	1.022	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)[C@H]3C[C@@]3(F)Cl)CCO2)C1	1840246532	FSXVYSZZDLZQHD-MEYUZBJRSA-N	431.719	1.604	50	20	IDGD	
COc1ccc([C@@H](O)C(=O)N2CC3(CCCN3C(=O)[C@@H](C)CBr)C2)cc1	1841285417	UQWHYVUOIXRZCX-XJKSGUPXSA-N	425.323	1.963	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CC[C@H](C(=O)N2CCCC23CN(C(=O)[C@H](O)CCl)C3)C1	1841477127	XJQFHKSJGJESNC-RRFJBIMHSA-N	429.945	1.483	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@H]2CC(=O)N(Cc3ccccc3)C2)C1	1841505730	QYMUWTGAFLPQCW-QZTJIDSGSA-N	433.936	1.492	50	20	IDGD	
CN(CC(=O)N1CC2(CCCN2C(=O)c2ccn(C)c2)C1)NC(=O)NCc1ccccc1	1842345887	GKNMVTDWGVGFTQ-UHFFFAOYSA-N	438.532	1.188	50	20	IDGD	
O=C(c1cc(Cl)c2nncn2c1)N1CC2(CCCN2C(=O)CCBr)C1	1842638071	LXBSONXFBOULPJ-UHFFFAOYSA-N	426.702	1.985	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC2(CCCN2C(=O)CCS(=O)(=O)c2ccccc2)C1	1842744920	OHBXQUCKKVSCIC-CQSZACIVSA-N	443.363	1.837	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2cccc3ncsc23)C1	1844102018	LCYNDBGKDQBGLO-UHFFFAOYSA-N	436.497	1.426	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)c1cn(C)nc1C)C2	1844691906	MNIICYSLOXBUHO-UHFFFAOYSA-N	441.444	1.693	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)c2ccc(OCC3CC3)cc2F)C1	1845271624	ZCLIGDPQDISAIX-UHFFFAOYSA-N	446.523	1.805	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCCC12CN(C(=O)[C@@H]1CCNC(=O)C1)C2	1845872019	QMDZXVKOKZBUDY-FUXXUDPSSA-N	428.439	1.601	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC2(CCCN2C(=O)[C@@H]2CCNC(=O)C2)C1	1846424559	PUKNRLKDLKHRMM-FUXXUDPSSA-N	428.439	1.601	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)CNS(=O)(=O)c1c(C)noc1C	12690106	IWPTVRWFTCDDLQ-UHFFFAOYSA-N	449.514	1.463	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)CCNC(=O)c2ccsc2)c2ccccc2c1=O	17163184	JOXHADXZFDCMDD-UHFFFAOYSA-N	427.486	1.449	50	20	IDGD	
Cc1nc2nc(N)nn2c(C)c1CCC(=O)NNC(=O)CSc1ccc(Cl)cc1	17185413	MMLDCOITZXRRMN-UHFFFAOYSA-N	433.925	1.849	50	20	IDGD	
COc1cc(Br)c(S(=O)(=O)NNC(=O)c2ccccc2O)cc1OC	17319742	XHRSDSOZLHVALS-UHFFFAOYSA-N	431.264	1.795	50	20	IDGD	
CCCCOc1ccc(C(=O)NNS(=O)(=O)c2ccc3c(c2)CC(=O)N3)cc1OC	26318909	MSOVCEBLJRWZER-UHFFFAOYSA-N	433.486	1.992	50	20	IDGD	
CCOC(=O)[C@@H]1CCCN(C(=O)CN(C)C(=O)/C(C#N)=C/c2cc(C#N)n(C)c2C)C1	726174553	BTYOXPQZAPJWKB-TWIVVOHQSA-N	425.489	1.372	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)NCc1ccc([C@]2(C)NC(=O)NC2=O)cc1	726283381	YIUKBKISOMJPKX-GTJPDFRWSA-N	443.435	1.178	50	20	IDGD	
O=C(CCCCc1ccc(I)cc1)NNC(=O)C(=O)N1CCCC1	727732403	NUEJXAWRDCZBDW-UHFFFAOYSA-N	443.285	1.774	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3cnn(-c4ccccc4)c3)cc2)CC1	728213750	PJBAFYYSCKTIFN-UHFFFAOYSA-N	440.529	1.565	50	20	IDGD	
COc1cc(I)c(C(=O)NNC(=O)Cc2cccnc2)cc1OC	728851844	YHIHWNCVNLZOJF-UHFFFAOYSA-N	441.225	1.707	50	20	IDGD	
CCN(CC)c1ccc(CNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cn1	728947690	QJFSVPCEEFFEEA-UHFFFAOYSA-N	426.525	1.465	50	20	IDGD	
COc1ccc(CCNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c(OC)c1	728952555	YKLYYTOMIYCREV-UHFFFAOYSA-N	428.493	1.283	50	20	IDGD	
O=C(CN1CCC[C@H](NS(=O)(=O)c2cccc(F)c2)C1)NNC(=O)c1ccccc1	729482303	NFNIHJAYIFSQPI-KRWDZBQOSA-N	434.493	1.030	50	20	IDGD	
Cc1nc2[nH]n(C)c(=O)c2c(C)c1CC(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	730284348	UAVDSALQQIPCFX-UHFFFAOYSA-N	444.517	1.005	50	20	IDGD	
C[C@H]1CCCN(S(=O)(=O)c2cc(C(=O)NNC(=S)NCC3CCC3)n(C)c2)C1	730290226	JFPAERCNOSNGAR-ZDUSSCGKSA-N	427.596	1.355	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)[C@H]2CCN(c3ccc4c(c3)OCCO4)C2=O)cc1	730515158	QCMCYPXTEYVETH-QGZVFWFLSA-N	425.441	1.346	50	20	IDGD	
O=C(NCCc1ccc(Br)cc1F)NNC(=O)c1ccc(-n2cnnn2)cc1	731043596	HJUPDDDZDDSIGQ-UHFFFAOYSA-N	448.256	1.751	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NCCOC[C@H]2CCOC2)c2ccccc2c1=O	731762573	FEGRIEPZJONPMQ-HNNXBMFYSA-N	431.493	1.194	50	20	IDGD	
Cc1cc(S(=O)(=O)N2CCN([C@@H](C)C(=O)NNC(=O)CC(C)C)CC2)c(C)s1	731849884	JVDDRELKNIZNOR-AWEZNQCLSA-N	430.596	1.253	50	20	IDGD	
O=C(NNC(=O)c1ccccc1F)N[C@@H]1CCCN(c2cc(N3CCOCC3)ncn2)C1	732914117	KFWCBDMXJLOPSJ-OAHLLOKOSA-N	443.483	1.065	50	20	IDGD	
O=C(NNC(=O)N1CCN(c2cccc([N+](=O)[O-])c2)CC1)c1cnn(-c2ccccc2)c1	733349860	KDLUQWVPJKDUCK-UHFFFAOYSA-N	435.444	1.957	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)CC[C@H]1NC(=O)N(c2ccc(C#N)cc2)C1=O	733777173	QGRQQURCHUURCY-MRXNPFEDSA-N	445.439	1.181	50	20	IDGD	
Cc1cc(C)c2cc(C(=O)NNc3ncccc3S(=O)(=O)N3CCN(C)CC3)[nH]c2c1	735117334	RGUPIFLCYVLYBC-UHFFFAOYSA-N	442.545	1.873	50	20	IDGD	
CCCCn1c(C)cc(/C=C(\C#N)C(=O)N[C@H]2CC(=O)N(CCN3CCOCC3)C2)c1C	736150836	BEISJWSPXGWODY-AMUNLKFJSA-N	441.576	1.861	50	20	IDGD	
O=C(NNc1cc(F)c(F)cc1F)NC1CCN(S(=O)(=O)C2CCOCC2)CC1	737058002	PNZFUIFODHQEMB-UHFFFAOYSA-N	436.456	1.703	50	20	IDGD	
CON(C)S(=O)(=O)c1cc(C(=O)NNC(=O)COCc2ccccc2)ccc1Cl	737634958	QNLHNJPRXGSNBZ-UHFFFAOYSA-N	441.893	1.500	50	20	IDGD	
C[C@@H](Cc1ccccc1F)C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	738543525	QURYXKXXPDVFQV-HNNXBMFYSA-N	435.525	1.479	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)CCc1c(C)nc2nc(C(F)(F)F)nn2c1C	740852101	KPGRXMYEMRYLSH-UHFFFAOYSA-N	443.430	1.145	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)[C@@H]2CCCCN2C(=O)c2ccc(O)nn2)c1C	741740643	CTEWGEJNEWTIJV-RDJZCZTQSA-N	441.488	1.409	50	20	IDGD	
CS(=O)(=O)Nc1ccc(O)c(C(=O)NNC(=O)c2cc(Br)ccc2O)c1	743732225	PWZXYRSVJWLXQI-UHFFFAOYSA-N	444.263	1.307	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)CCc2nnc(-c3ccsc3)o2)cc1	743830294	BNCLEBAOYGACRS-UHFFFAOYSA-N	435.487	1.987	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)[C@@H](C(C)C)n2nnc(-c3ccccc3)n2)c1	744847353	WHWDUVSUHBMJKJ-LJQANCHMSA-N	436.472	1.850	50	20	IDGD	
CCCCNC(=O)c1ccc(CNC(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)cc1	745614202	FEWYCELAKGIUPB-UHFFFAOYSA-N	429.433	1.975	50	20	IDGD	
O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)NNC(=O)c1cc([N+](=O)[O-])ccc1O	745802250	DNBUZBLNFLYRJC-INIZCTEOSA-N	427.461	1.809	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)c2cn(CC(=O)C(C)(C)C)nn2)c2ccccc2c1=O	746096784	MRTBTKZOIYDRSD-UHFFFAOYSA-N	439.476	1.259	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@H](C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)C1	746332850	QHGGARYGCOXWPJ-LSDHHAIUSA-N	425.507	1.130	50	20	IDGD	
COc1cc(C)nc(NNC(=O)[C@H](CCSC)NS(=O)(=O)c2ccccc2F)n1	746631388	YYYDUGARUWNUSG-ZDUSSCGKSA-N	443.526	1.476	50	20	IDGD	
Cc1cc(S(=O)(=O)Nc2ccc(C(=O)NNc3nccn(C)c3=O)cc2)ccc1F	747937353	CLZOMJJPOPNBPL-UHFFFAOYSA-N	431.449	1.786	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNc1cccc([N+](=O)[O-])c1	748004846	ROVSNKCMRTVSDX-UHFFFAOYSA-N	434.474	1.692	50	20	IDGD	
CCC[C@@H](C)CC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	748604875	ODUDHXAPCAFALV-MRXNPFEDSA-N	425.551	1.614	50	20	IDGD	
C[C@@H](C(=O)OCC(=O)NNC(=O)c1cccc(Cl)c1)N1C(=O)[C@H]2CCCC[C@@H]2C1=O	750280508	QAVGQAXFBZZVCM-CQDKDKBSSA-N	435.864	1.208	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@@H]2CCN(C)c3ccccc32)cc1	750712852	BOACGKNHTWVGEM-GOSISDBHSA-N	430.530	1.387	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)Cn3ccc(C(F)(F)F)n3)n[nH]2)cc1OC	751297557	KRFNYZHZQOHILF-UHFFFAOYSA-N	438.366	1.770	50	20	IDGD	
NC(=O)[C@@H]1CC(C(=O)NNC(=S)NCCc2cccs2)=NN1c1ccc(F)cc1	753078326	OJWMPRHBCPNGRB-HNNXBMFYSA-N	434.522	1.045	50	20	IDGD	
C[C@H]1C[C@H](CCNC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)CCO1	753336949	RYMHWHVRFBNNID-JKSUJKDBSA-N	438.550	1.620	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)sc1S(N)(=O)=O	754184762	UCYPANSFOIKOCN-NSHDSACASA-N	427.504	1.249	50	20	IDGD	
C[C@H](C(=O)N1CCCC1)N1CCN(C(=O)NNC(=O)c2cccc(OC(F)F)c2)CC1	755148319	HFUBDZTWRUEQBB-CQSZACIVSA-N	439.463	1.271	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)Nc1cccc(C(=O)N2CCOCC2)c1	755926117	GBYSGVXIJVDUSR-UHFFFAOYSA-N	449.508	1.617	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)Nc2cc(C(N)=O)ccc2F)c2ccccc2c1=O	756065867	IOLLIXPBGZYTMF-UHFFFAOYSA-N	440.435	1.901	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)Nc1cc(N2CCCS2(=O)=O)ccc1F	756155530	RIBGMSJXUQKLLG-UHFFFAOYSA-N	447.448	1.469	50	20	IDGD	
COC(=O)Cn1ccc(NC(=O)NNC(=O)c2ccc(OC)c(Br)c2)n1	756646567	OJFISWHNNHHFKM-UHFFFAOYSA-N	426.227	1.294	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)Nc3cnn(CC(=O)NC4CC4)c3)n[nH]2)cc1	756795063	GCTJLVNKSZNSIN-UHFFFAOYSA-N	436.476	1.581	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)Nc2cnn(CC(=O)N3C[C@H](C)O[C@@H](C)C3)c2)cc1	756839734	SSAXIRGPHKTDCU-HOTGVXAUSA-N	444.492	1.059	50	20	IDGD	
CC(C)[C@@H](NS(=O)(=O)c1ccc2ccccc2c1)C(=O)NNc1ccc(C(N)=O)nn1	757409277	ZUDOFEKEDXCSBX-GOSISDBHSA-N	442.501	1.175	50	20	IDGD	
Cn1cc(-c2nc3ccccn3c2NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cn1	757665416	PZWGJLNLQKLYSV-UHFFFAOYSA-N	443.431	1.177	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1ccc2cc(Br)ccc2c1	757704927	WOKHUOHHSCDFIH-VIFPVBQESA-N	429.296	1.693	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H]1CCC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	758096253	RREKHDFHJXPDKW-HNNXBMFYSA-N	429.481	1.603	50	20	IDGD	
CC(=NNC(=O)C(=O)Nc1ccccn1)c1ccc(S(=O)(=O)N2CCCCC2)cc1	758381979	USHRCDJRMCVKRK-UHFFFAOYSA-N	429.502	1.735	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)NCCc2cn3cc(Br)cc(C)c3n2)n1	758692753	WJWMXTNSXQYUPJ-UHFFFAOYSA-N	448.325	1.792	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@H](NC(=O)NNC(=O)c2nnc(O)c3ccccc23)[C@H](C#N)C1	758761460	QZZYJNZPKAXUMQ-BXUZGUMPSA-N	441.448	1.038	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COc2ccccc2O)nc1I	761157056	QPKFAPVJENHUNM-UHFFFAOYSA-N	443.197	1.240	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)NCCNS(=O)(=O)c1cccs1	761744170	SPXWXRPFQJYHNE-UHFFFAOYSA-N	444.560	1.158	50	20	IDGD	
CCC(=O)N1CC[C@@H](NC(=O)NNC(=O)[C@H](C)Oc2cccc(Br)c2)C1	762081716	HZRLIWPIZXTDEU-WCQYABFASA-N	427.299	1.558	50	20	IDGD	
Cc1ccc(I)cc1C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	763151160	WRUMOXDPMJLJTK-UHFFFAOYSA-N	448.224	1.650	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCN(S(=O)(=O)CBr)CC2)c(C)c1C	763205858	HLIXEPZIKASODG-UHFFFAOYSA-N	441.369	1.301	50	20	IDGD	
O=C(NNC(=O)c1ccc2ccccc2n1)C(=O)Nc1cccn(Cc2ccccc2)c1=O	763467735	WPHGVMRWXMYJQF-UHFFFAOYSA-N	441.447	1.845	50	20	IDGD	
CCOC(=O)/C=C\c1ccc(NC(=O)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1	763468511	LOOJFAXZUVLBCF-FLIBITNWSA-N	426.385	1.571	50	20	IDGD	
CCNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2ccccc2Br)c1	763483633	UQHCTZJXZYYNKI-UHFFFAOYSA-N	433.262	1.599	50	20	IDGD	
CC[C@@H](NC(=O)NNC(=O)CSc1ccccc1O)c1cccc(S(N)(=O)=O)c1	763497779	IPADPHQKHJLZBJ-CQSZACIVSA-N	438.531	1.613	50	20	IDGD	
Cc1cc(Cl)ccc1OCCCC(=O)NNC(=O)C(=O)Nc1cccc(C(N)=O)c1	763509582	LBODHUZOQVWMJU-UHFFFAOYSA-N	432.864	1.692	50	20	IDGD	
O=C(NNC(=O)c1ccccc1O)C(=O)Nc1ccc(OC(F)F)cc1OC(F)F	763528162	NCIKKNJWKLSOKU-UHFFFAOYSA-N	431.298	1.995	50	20	IDGD	
CCn1nccc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccncc2)nc2ccccc12	763539250	NPOLTIYTKZGJFJ-UHFFFAOYSA-N	429.440	1.913	50	20	IDGD	
C=CCOc1cccc(NC(=O)C(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)c1	763540637	XNBOAZUCSBUVOI-UHFFFAOYSA-N	429.429	1.677	50	20	IDGD	
CC(C)(C)c1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(C(N)=O)c(Cl)c2)cc1	763600272	PEWOLCWRUOXXNB-UHFFFAOYSA-N	446.891	1.901	50	20	IDGD	
COc1cc(OC)c(OC)cc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccccc2)[nH]n1	763604812	LVCAIWZTSDIFHZ-UHFFFAOYSA-N	439.428	1.502	50	20	IDGD	
COC(=O)c1c(C2CC2)csc1NC(=O)C(=O)NNC(=O)c1c(C)nc2ccccn12	763625453	RJHKFECQKNXFLO-UHFFFAOYSA-N	441.469	1.768	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)COc2cccc(C)c2)c(Br)c1	763628975	CUFOVWJLKBVDJE-UHFFFAOYSA-N	436.262	1.931	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1cc(F)c(N2CCCC2)c(F)c1	763629368	IHXAEICEDVRWRD-UHFFFAOYSA-N	442.426	1.921	50	20	IDGD	
COC(=O)c1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)COc1ccc(OC)cc1	763662683	ZPDJJONFOWLICX-UHFFFAOYSA-N	435.820	1.300	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2ccccc2N2CCN(C)CC2)c1	763665033	CJAJDKKJNUDBIU-UHFFFAOYSA-N	439.516	1.220	50	20	IDGD	
CC(=O)N1CCCc2cc(NC(=O)C(=O)NNC(=O)COc3ccc(Cl)cc3)ccc21	763684179	GLGBUURLGNAVAR-UHFFFAOYSA-N	444.875	1.804	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccnn1CCc1ccccc1	763717190	QDAXJYACCYZPRC-UHFFFAOYSA-N	435.484	1.853	50	20	IDGD	
CCOc1cc(C(=O)N(C)C)ccc1NC(=O)C(=O)NNC(=O)c1cc2c(s1)CCC2	763784264	DUSVRRYIIXDPJA-UHFFFAOYSA-N	444.513	1.737	50	20	IDGD	
CN(C)c1c(Cl)cccc1NC(=O)C(=O)NNC(=O)c1nnc(O)c2ccccc12	763791815	YUFUBBQDGPFTQM-UHFFFAOYSA-N	428.836	1.455	50	20	IDGD	
N#Cc1ccc(OC(F)F)c(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)c1	763807263	NXTGPLSLHVJFPR-UHFFFAOYSA-N	429.339	1.196	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)Nc2ccccc2C(=O)N2CCN(C)CC2)cc1	763829772	LITNFZGXPLFTOG-UHFFFAOYSA-N	437.500	1.036	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)OC(F)(F)O2	763848182	AKNYHZDANUCCHS-VIFPVBQESA-N	425.319	1.701	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccc(OCC(F)(F)F)nc1	763850683	PVPIQNPOPRAIAU-SNVBAGLBSA-N	444.341	1.715	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccccc1Cn1cncn1	763873070	QGKYKMCQDNNNFC-CYBMUJFWSA-N	426.408	1.019	50	20	IDGD	
COc1ccc(OC)c(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(C(C)=O)cc2)c1	763873159	RYBJMPLJWWOSRU-CYBMUJFWSA-N	429.429	1.460	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cnc3c(c2)c(C)nn3C)cc1OC	763902622	VNPALUJBWWJANN-UHFFFAOYSA-N	426.433	1.084	50	20	IDGD	
O=C(NNC(=O)c1ccc(Br)s1)C(=O)Nc1ccc(-n2nccn2)cc1	763940458	RQZXKUHVKCHSGC-UHFFFAOYSA-N	435.263	1.491	50	20	IDGD	
Cc1cc(C)cc(-n2nc(NC(=O)C(=O)NNC(=O)c3ccc4c(c3)OCCO4)cc2C)c1	764005939	GKKPCAWPVOWNEK-UHFFFAOYSA-N	449.467	1.968	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)on2)cc(OC)c1OC	764016647	LBLUAJGOGJVIPB-UHFFFAOYSA-N	440.412	1.767	50	20	IDGD	
CCS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cccc(C(F)(F)F)c2)cc1	764040573	MTDJEFGBZKENPD-UHFFFAOYSA-N	443.403	1.899	50	20	IDGD	
COc1cc(C(=O)N(C)C)ccc1NC(=O)C(=O)NNC(=O)c1ccc(Cl)cc1O	764127502	WJZPVGFETSIEEG-UHFFFAOYSA-N	434.836	1.156	50	20	IDGD	
COc1cc2nc(C)sc2cc1NC(=O)C(=O)NNC(=O)[C@H]1Cc2ccccc2O1	764168470	PGDYASLSEXKUOC-MRXNPFEDSA-N	426.454	1.703	50	20	IDGD	
CN(C)C(=O)c1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)CCc1ccccc1O	764281395	WGJRDJWAGIUZOW-UHFFFAOYSA-N	432.864	1.466	50	20	IDGD	
CC(C)OC(=O)c1c(NC(=O)C(=O)NNC(=O)Cc2cc[nH]n2)sc2c1CC[C@@H](C)C2	764293513	QCFZMQJTXHEOJR-LLVKDONJSA-N	447.517	1.490	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cc3ccccc3o2)c(OC)c(OC)c1	764331395	VUUIQEWKZZGTHG-UHFFFAOYSA-N	441.396	1.636	50	20	IDGD	
C#CCNS(=O)(=O)c1ccc(C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)cc1	764335675	UGHRGTGDDMZFCL-UHFFFAOYSA-N	448.451	1.525	50	20	IDGD	
CN(C)c1nnc(-c2ccc(NC(=O)C(=O)NNC(=O)c3ccc(O)c(Cl)c3)cc2)o1	764349457	OZUFZRFBDBRZNR-UHFFFAOYSA-N	444.835	1.561	50	20	IDGD	
COC(=O)C(C)(C)c1ccc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1	764350663	HLNMJHMGJFOJNM-UHFFFAOYSA-N	449.467	1.723	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)ccc1C(=O)NC(C)C	764350730	JJRWUUCYNVAKKD-UHFFFAOYSA-N	448.483	1.719	50	20	IDGD	
CCS(=O)(=O)c1cccc(CC(=O)NNC(=O)c2cc(Br)ccc2O)c1	764459283	ZYJSTOYXPFDLSR-UHFFFAOYSA-N	441.303	1.952	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@@H]2CN(C(=O)OC(C)(C)C)CCO2)ccc1OC(C)C	764569870	CNSFZSGVTGQULG-KRWDZBQOSA-N	437.493	1.879	50	20	IDGD	
COc1ccsc1C=NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	764659772	OYPZDFTUUGHMFH-UHFFFAOYSA-N	437.543	1.861	50	20	IDGD	
C[C@H]1CN(c2ccc(C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)cn2)C[C@@H](C)O1	765322046	GJHFZPFUEOBNND-GASCZTMLSA-N	435.525	1.761	50	20	IDGD	
O=C(CCCOc1ccc2c(c1)OCO2)NNC(=O)C1CCN(c2ncccn2)CC1	765418833	AEWAXDJQXCNAMU-UHFFFAOYSA-N	427.461	1.428	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)cc1F	765422708	BGDOKBOOWURDMG-UHFFFAOYSA-N	441.507	1.671	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)CSc2nnc(-c3cccnc3)n2-c2ccccc2)n[nH]1	765582523	AUJTZPMMJAJEFJ-UHFFFAOYSA-N	434.485	1.914	50	20	IDGD	
O=C(CCN1C(=O)[C@@H]2CCCC[C@H]2C1=O)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	765618797	OIHPOVPZXBSNTQ-HUUCEWRRSA-N	427.436	1.542	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)[C@H]3CC34CCCC4)CC2)cc1	765729425	RYLUAKVKQRBUTI-GOSISDBHSA-N	434.562	1.029	50	20	IDGD	
Cc1cccc([C@H](CC(=O)OCC(=O)NNC(=O)Cc2ccccc2C)NC(N)=O)c1	767278576	HJOUTWWCYMBAGM-SFHVURJKSA-N	426.473	1.336	50	20	IDGD	
C[C@H]1CCCN(C(=O)C(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)C1	767422401	VIDMQYUHUDFZQH-INIZCTEOSA-N	447.495	1.464	50	20	IDGD	
CC(=O)Nc1ccccc1CC(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	767991697	PXJCLVPSHFWSJB-UHFFFAOYSA-N	432.502	1.352	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1)N1C(=O)[C@H]2CCCC[C@H]2C1=O	768280413	ZXSWNTHWZIRGAO-TUKIKUTGSA-N	427.436	1.541	50	20	IDGD	
CCCCS(=O)(=O)N1CCC(C(=O)NNc2c(OC)cccc2S(C)(=O)=O)CC1	768613984	YOIBRPOTZRKOLE-UHFFFAOYSA-N	447.579	1.384	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNS(=O)(=O)c2csc([N+](=O)[O-])c2)CC1	768882164	RAASBDLSOKUDFG-UHFFFAOYSA-N	449.511	1.548	50	20	IDGD	
CC(C)(C)OC(=O)NC1CCN(CC(=O)NNC(=O)c2ccc3c(c2)OCCO3)CC1	769085861	FBGZQWSUBTZDRW-UHFFFAOYSA-N	434.493	1.208	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)Nc1ccc(F)c(-n2nnnc2C)c1	769233051	UAQFIPNEECTRIL-UHFFFAOYSA-N	435.441	1.671	50	20	IDGD	
C[C@]1(c2ccc(F)c(Cl)c2)NC(=O)N(CC(=O)NNC(=O)NCc2ccco2)C1=O	770221259	AIYWRPJHRQDYAQ-GOSISDBHSA-N	437.815	1.370	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)Cn3nnc(-c4ccc(Cl)cc4)n3)nc21	770958884	RPAJGJNZSCMSTR-UHFFFAOYSA-N	442.871	1.737	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)[C@H]1CCN(c2cccc(Br)c2)C1=O	772033694	VORXQEAIBHRRIH-GWCFXTLKSA-N	426.267	1.291	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)NCCNS(=O)(=O)c2ccc(C)s2)c2ccccc2n1	772631968	SZXKWQSKVPPNRT-UHFFFAOYSA-N	447.542	1.836	50	20	IDGD	
CCOC(=O)c1cnn2c(C(=O)NNC(=O)[C@H](C)Oc3cccc(Cl)c3)ccnc12	773000258	ZDFKYFQFAPETBP-NSHDSACASA-N	431.836	1.788	50	20	IDGD	
CN(C)CC(=O)Nc1ccc(NC(=O)C(=O)NNc2ncc(Cl)cc2Cl)cc1	773677471	NIHVVVIJIILJHQ-UHFFFAOYSA-N	425.276	1.970	50	20	IDGD	
O=C(NNc1ccc(C(F)(F)F)cc1)C(=O)Nc1cnn(CCN2CCOCC2)c1	773761329	QILITVBOJVRSQZ-UHFFFAOYSA-N	426.399	1.316	50	20	IDGD	
CC(C)c1nccnc1NNC(=O)C(=O)Nc1ccc(NC(=O)NC[C@@H]2CCCO2)cc1	773998641	SDQUSYNEAIKCTR-INIZCTEOSA-N	441.492	1.982	50	20	IDGD	
CC[C@H]1Oc2cc([C@@H](C)NCC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)ccc2NC1=O	775462638	BDWORYVPBYMAHX-SJKOYZFVSA-N	441.444	1.816	50	20	IDGD	
COc1ccc2nc(NNC(=O)[C@H](C)NS(=O)(=O)c3c(C)nn(C)c3C)c(C)cc2c1	778477149	PXOOLPJEKMTEOV-ZDUSSCGKSA-N	446.533	1.712	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)N[C@@H]2CCn3ccnc3C2)c2ccccc2c1=O	779666603	TXOQPHBMLRFEMO-OAHLLOKOSA-N	437.504	1.742	50	20	IDGD	
CCNC(=O)N(C)NC(=O)[C@@H](CCSC)NS(=O)(=O)c1ccc(OCC)cc1	780710956	HZOIPPSLGAVXGO-OAHLLOKOSA-N	432.568	1.178	50	20	IDGD	
Cc1cc(C)c(S(=O)(=O)NNC(=O)c2ccc3c(c2)OCCO3)c(C)c1CC(=O)O	782249222	GRHFHMQYESIDJS-UHFFFAOYSA-N	434.470	1.633	50	20	IDGD	
CCSc1cccc(NC(=O)C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)c1	782898365	ZUAYZIJZXCXVDU-UHFFFAOYSA-N	449.558	1.800	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)Nc2ccccc2C)c(C(=O)N(C)C)cc1OC	783415421	CFMYSTJROWQGOY-UHFFFAOYSA-N	443.460	1.505	50	20	IDGD	
CCN(CC)CCn1ccc2cc(NC(=O)C(=O)NN[C@]3(C)CCS(=O)(=O)C3)ccc21	783425178	BSSKLUCLVPQYEU-OAQYLSRUSA-N	449.577	1.120	50	20	IDGD	
Cc1cc(F)ccc1NNC(=O)C(=O)Nc1ccc(N2CCN(C(=O)C3CC3)CC2)nc1	783449463	QBBKZFNJTYMPRN-UHFFFAOYSA-N	440.479	1.670	50	20	IDGD	
O=C(NN=Cc1cn(Cc2cccnc2)nn1)c1cccc(S(=O)(=O)N2CCCC2)c1	783778024	UOMHQSBLSSSKHB-UHFFFAOYSA-N	439.501	1.270	50	20	IDGD	
COC(=O)c1cc(OC)c(OC)cc1NC(=O)C(=O)NNc1cccc([N+](=O)[O-])c1C	784353728	UPIRYOSORNCYOG-UHFFFAOYSA-N	432.389	1.789	50	20	IDGD	
COC[C@@H](C)NS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccccc2Cl)cc1	784773603	HVKLIYQAPRBBQR-GFCCVEGCSA-N	440.909	1.735	50	20	IDGD	
NC(=O)C1CCN(c2ccccc2NC(=O)C(=O)NNc2cccc([N+](=O)[O-])c2)CC1	784831664	OIMXQBRECLMKIJ-UHFFFAOYSA-N	426.433	1.378	50	20	IDGD	
NC(=O)c1ccc(F)c(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)c1	784835732	GQQYFEUTRSBKLM-UHFFFAOYSA-N	430.364	1.003	50	20	IDGD	
Cc1cc(CN2C(=O)c3ccccc3C2=O)cc(C(=O)NNC(=O)c2cccn2C)c1O	787928501	VHXADIPOLOBHJG-UHFFFAOYSA-N	432.436	1.910	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1)c1ncnn1C	788884443	JAKMIOYOBXXJOJ-NSHDSACASA-N	449.518	1.383	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(CC(F)(F)F)cc1)c1ccc(-n2cnnn2)cc1	790386958	OKUMNTJFCCAUKW-UHFFFAOYSA-N	426.380	1.390	50	20	IDGD	
NS(=O)(=O)c1ccc(C(=O)NNc2cccc(F)c2[N+](=O)[O-])cc1Br	790586205	RVYDDVOKKGAENG-UHFFFAOYSA-N	433.215	1.901	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1cccc(N2CCC2=O)c1	790965222	JNDWEQPIOKBKRB-LBPRGKRZSA-N	430.848	1.630	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1cnn(-c2ccc(C)cc2)c1C(C)C	792267149	VYIKUKMCVXPNTN-OAHLLOKOSA-N	431.493	1.442	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)Cn1c(=O)nc(O)c2ccccc21	792962697	JYESGUUAHGFFAX-UHFFFAOYSA-N	447.245	1.091	50	20	IDGD	
CC(C)(C)OC(=O)N1CCOC[C@H]1CC(=O)NNC(=O)c1cc(Br)c[nH]1	794823310	JBBBQJYHYPSUIU-LLVKDONJSA-N	431.287	1.564	50	20	IDGD	
CC(=O)N[C@@](C)(C(=O)NNC(=O)Nc1ccccc1C)c1ccc(S(C)(=O)=O)cc1	798312857	NEFJQJDEHHCJTP-HXUWFJFHSA-N	432.502	1.603	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc(S(=O)(=O)N3CCCC3)c(C)o2)cc1	801108991	WSQOBXSNWSMUQC-UHFFFAOYSA-N	434.474	1.081	50	20	IDGD	
CC(C)(C(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)c1cc(F)cc(C#N)c1	803926195	PPPPLMWBICLNID-UHFFFAOYSA-N	428.376	1.888	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc2c(c1)nc(CCC(=O)NN(C)C(=O)OC)n2C	804124431	RGYCCFJZAGFWOK-UHFFFAOYSA-N	425.511	1.266	50	20	IDGD	
CCc1nnc(NC(=O)[C@H](C)[C@H](C)NC(=O)NNC(=O)c2c(C)nc3ccccn23)s1	804867891	NTEITFYIJFXZDI-MNOVXSKESA-N	444.521	1.664	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3cn(C4CC4)c(C)cc3=O)n[nH]2)cc1OC	807083585	AHVXSMDQYYQGOJ-UHFFFAOYSA-N	437.456	1.974	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)[C@@H](NS(=O)(=O)c1ccc(C)cc1)C(C)C	807370639	PQCJJSPEUFMMQL-INIZCTEOSA-N	429.539	1.235	50	20	IDGD	
C[C@H]1[C@@H](NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)CCN1Cc1ccccc1	807619830	BXFRRRLXMYOGII-KXBFYZLASA-N	434.500	1.541	50	20	IDGD	
CCOc1ccc(C(=O)NNS(=O)(=O)c2cccc(C(=O)N(C)CC)c2)cc1OC	808070475	XCUQJCSQTNBWFL-UHFFFAOYSA-N	435.502	1.809	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1ccnc(C(F)(F)F)c1	809703348	IZOGEMDUMXRMSG-UHFFFAOYSA-N	430.408	1.878	50	20	IDGD	
CC(=O)[C@H]1CC(C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)=NN1c1ccccc1	812729856	VYQFAIWETDTUEM-LJQANCHMSA-N	429.502	1.604	50	20	IDGD	
COC(=O)c1cn(-c2cccc(NC(=O)NNC(=O)[C@@H](C)Oc3ccccc3F)c2)nn1	812979350	PNEOVZQPEAPGES-GFCCVEGCSA-N	442.407	1.813	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N(C)Cc2nncn2C)cc1	813695586	DFYRKEIHTJXNCH-YBEGLDIGSA-N	448.487	1.128	50	20	IDGD	
CC(C)(C)c1n[nH]cc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	814698977	XAASNVKTQCUSDM-UHFFFAOYSA-N	433.534	1.957	50	20	IDGD	
CNC(=O)c1cc(Oc2cccc(NC(=O)C(=O)NNc3ccc(Cl)nn3)c2)ccn1	815558271	XNIQGIQZACVGND-UHFFFAOYSA-N	441.835	1.759	50	20	IDGD	
COC(=O)N(C)c1ccc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)N(C)C)cc1	815751277	VVEFYUWSHNBTLN-UHFFFAOYSA-N	449.489	1.221	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)c1cc(Br)cc2nc(O)[nH]c12	816814419	QCLFURQDWFPJIT-ZDUSSCGKSA-N	433.218	1.632	50	20	IDGD	
Cc1c(NC(=O)CSCC(=O)NNc2ncncc2F)c(=O)n(-c2ccccc2)n1C	817081125	RNFJQTYIHHBAHE-UHFFFAOYSA-N	445.480	1.229	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1ccc(SCc2cn3ccccc3n2)cc1	818853360	JILJSNYUUNHBOE-OAHLLOKOSA-N	444.538	1.822	50	20	IDGD	
COc1ccc([N+](=O)[O-])cc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)CC2CC2)c1	819140227	FEXYAIDVGSDTJY-UHFFFAOYSA-N	448.457	1.965	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)CCc2nc(-c3ccc(OC)cc3)no2)cc1	825553976	GMMQIBCALKXRQD-UHFFFAOYSA-N	425.445	1.946	50	20	IDGD	
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC(=NNC(=O)Cn2c(C)nc3ccccc32)CC1	914559821	UJARMCVUNYPEET-UHFFFAOYSA-N	443.533	1.642	50	20	IDGD	
Cn1cc(C(=O)NNS(=O)(=O)c2ccc(C(=O)N3CCOCC3)cc2)c2ccccc21	915187175	NWLIKQYUPNNXMH-UHFFFAOYSA-N	442.497	1.274	50	20	IDGD	
CC(=NNC(=O)COc1ccccc1F)c1ccc(S(=O)(=O)N2CCOCC2)cc1	916301611	ZAJYXPTUIGMRSY-UHFFFAOYSA-N	435.477	1.766	50	20	IDGD	
CN(C)CCOc1ccc(CNC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1	916388255	CBCPVNJNZBGUEN-UHFFFAOYSA-N	438.488	1.018	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCCCN2CCc3ccccc32)nc1	916456507	GICJRVRIBZGOHP-UHFFFAOYSA-N	432.550	1.847	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCc2cccnc2OC(C)C)cc1	916511899	CUKFZRPJWKPDQT-UHFFFAOYSA-N	449.533	1.328	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCc2cccc(CN(C)C)c2)cc1	916568908	LOWVVWLZBQAIQX-UHFFFAOYSA-N	447.561	1.208	50	20	IDGD	
O=C(Cn1nc(-c2ccccc2)ccc1=O)NNC(=O)c1nn(-c2ccccc2)cc1O	916752668	ZPUHPZCKKNCPEI-UHFFFAOYSA-N	430.424	1.263	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCN(C(=O)c2cc(C)oc2C)CC1	917167270	ZBFSGWNDXLEUME-UHFFFAOYSA-N	448.907	1.777	50	20	IDGD	
COC(=O)NCC(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2Cl)c1	918285333	GARJTZMOOLPOKC-UHFFFAOYSA-N	440.865	1.258	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)NCc2cccc(N3CCOC3=O)c2)cc1C	919658929	WFBNMFQYKSREFT-UHFFFAOYSA-N	425.445	1.729	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)c2cn(-c3ccccc3Br)nn2)c1O	919756017	OFHNWFWRCAGSES-UHFFFAOYSA-N	432.234	1.819	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)[C@H]1CS[C@@]2(C)CCC(=O)N12	920768394	MFWGETYMZJWKJM-GDKCJGSASA-N	442.335	1.818	50	20	IDGD	
O=C(NNC(=O)c1cc(S(=O)(=O)N2CCSCC2)c[nH]1)c1cccc(Cl)c1	921021048	ZJJNSKMBADCPAL-UHFFFAOYSA-N	428.923	1.480	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)NCc2cccnc2N2CCN(C)CC2)cc1	921247461	FJWXXKAMRVSULT-UHFFFAOYSA-N	428.562	1.765	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)c1ccc(Br)c(F)c1	921302103	NWQBWSPFANHNLC-UHFFFAOYSA-N	429.271	1.956	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)N2CCC(OCC(N)=O)CC2)N(C)c2ccccc21	1318809826	OYUJCADNICAACI-UHFFFAOYSA-N	425.489	1.150	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)N[C@@H]2CCN(c3cnn(C)c3)C2)cc1Cl	1318889743	MPJPHDMOEKUFNA-LLVKDONJSA-N	437.888	1.705	50	20	IDGD	
O=C(NCC(F)(F)F)c1cccc(S(=O)(=O)NNC(=O)c2n[nH]c3c2CCCC3)c1	1321784045	SOWMIPXVWBBCKA-UHFFFAOYSA-N	445.423	1.204	50	20	IDGD	
O=C(NNC(=O)c1ccn(-c2ccncc2)n1)c1cccc(S(=O)(=O)N2CCCC2)c1	1322007146	OUDPQSFYDUEYFQ-UHFFFAOYSA-N	440.485	1.127	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NN=Cc2c(Cl)nc(OC)n2C)c1	1330305289	OOEIPAIPIXGIHW-UHFFFAOYSA-N	427.914	1.877	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3nc4ccccc4n(C)c3=O)C2)C1	1777886908	LEYJKPORAHXRLN-IVZQSRNASA-N	446.935	1.785	50	20	IDGD	
Cc1cnc2c(C(=O)N3CC[C@@]4(CN(C(=O)CO[Si](C)(C)C)CCO4)C3)cnn2c1	1778527348	RCSWOYCKXUUDKE-HXUWFJFHSA-N	431.569	1.333	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)c3cc4sccc4[nH]3)C2)C1	1778701976	FJIYKMCIMJYNOJ-HXUWFJFHSA-N	433.534	1.046	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCc2nc(N)n[nH]2)C1	1779239227	UIVXGTWGZLLMPV-PJIJBLCYSA-N	426.949	1.241	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCBr)C2)c1ccc(CO)o1	1779708981	QOYWFFBPOROBNU-CRAIPNDOSA-N	429.311	1.684	50	20	IDGD	
COc1cc(C#N)cc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)c1	1780175472	JWGBRJVJZLXCRT-YJYMSZOUSA-N	436.306	1.794	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)c(O)c1	1780552948	KGQQHRKVSHYUEF-WMLDXEAASA-N	431.258	1.535	50	20	IDGD	
CN(C)c1ncc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](F)Br)C2)o1	1780771277	YWCNVHNFGPHTLR-PBFPGSCMSA-N	447.305	1.559	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)Cc3ccc([N+](=O)[O-])c(OC)c3)CCO2)C1	1781218458	PDQBWFJXQYHYKY-QRWLVFNGSA-N	439.896	1.993	50	20	IDGD	
COc1ccc([C@H](O)C(=O)N2CCO[C@@]3(CCN(C(=O)[C@](C)(Cl)CCl)C3)C2)cc1	1781226132	VSJDGTDWADLCAK-DBVUQKKJSA-N	445.343	1.795	50	20	IDGD	
CCOC(CC(=O)N1CCO[C@@]2(CCN(C(=O)[C@@](C)(Cl)CCl)C2)C1)OCC	1781232446	FYJZVSMHFDECMN-ROUUACIJSA-N	425.353	1.842	50	20	IDGD	
O=C([C@@H]1Cc2ccccc2O1)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781329990	PHBFGWIIZOJZRA-MPGHIAIKSA-N	427.270	1.511	50	20	IDGD	
O=C(c1cc2ncccc2[nH]1)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1782211643	XHYQFMHUADJOAH-YOEHRIQHSA-N	425.258	1.697	50	20	IDGD	
Cn1nc2c(c1C(=O)N1CC[C@@]3(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)CCC2	1782439742	JXPKCLWNDQLYIT-RBUKOAKNSA-N	429.348	1.589	50	20	IDGD	
C[C@@H](NC(=O)c1ccccc1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Cl)C2	1783257840	YBNLOYXRVSWRKH-VGKBRBPRSA-N	439.915	1.853	50	20	IDGD	
COc1ccc([C@H](O)C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](C)Br)C3)C2)cc1	1783527801	GMQXISQTCSBRAW-ACWOFJMJSA-N	441.322	1.342	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2	1783857010	GVDNGVKYPBCYGN-GJRWTSMGSA-N	443.338	1.355	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(C)(C)NCCC#N)C[C@@H]21	1783967169	CTECBTHUMIQDGX-VGWMRTNUSA-N	443.386	1.279	50	20	IDGD	
Cc1cc(C(=O)Nc2ccc(C3(NC(=O)c4cnccc4C(=O)NN)CCC3)cc2)nn1C	1787356841	MPTXGYIQYGUFMZ-UHFFFAOYSA-N	447.499	1.789	50	20	IDGD	
CC1(C)Cc2cccc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)[C@H](O)CCl)C[C@@H]43)c2O1	1787367398	RACVBSXFDSTPHL-OWLYRPNTSA-N	436.936	1.593	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3c(Br)cnn3C)[C@H]2C1	1787777866	QPISAVMSLVBKJW-IMIFBBOLSA-N	447.761	1.793	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cn3c(=O)n(C)c4ccccc43)[C@H]2C1	1788140283	PHBQVGNXYKNHCP-FPXQBCRKSA-N	448.951	1.337	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc(Cl)nc3)C[C@@H]21	1789868184	RQYAKGDYDYQLRM-PYERRIOISA-N	435.739	1.960	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3cccc(O)c3)C[C@@H]21)[C@H](F)Br	1789925934	YXNLBGUBUCJMFX-MBGYTDRXSA-N	443.313	1.995	50	20	IDGD	
CCOc1ccc(Cl)cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21	1790121549	XFDFBXCVUNETHK-RPZXMPESSA-N	445.343	1.932	50	20	IDGD	
C[C@H](C(=O)NC1(c2ccc(NC(=O)CCC(=O)NN(C)C)cc2)CCC1)n1cccn1	1791603378	UNKSMRVKKPSWMH-MRXNPFEDSA-N	426.521	1.951	50	20	IDGD	
C[C@H](Cn1ccnc1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21	1791627017	WYVWWJJEJLNUIV-UGUYLWEFSA-N	427.343	1.284	50	20	IDGD	
C[C@H](C(=O)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1)n1cccn1	1791878490	FFEHGUNMEHMABL-MRXNPFEDSA-N	432.289	1.572	50	20	IDGD	
CC(C)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1ON=C(c3ccccc3)O1)C2	1792782996	LKKPPOBAVICERA-RCJHGTSTSA-N	435.908	1.576	50	20	IDGD	
C[C@@H]1[C@@H](C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](O)CCl)CCN1C(=O)OC(C)(C)C	1793117423	KACPLADROIHRRB-RGGMIXCSSA-N	443.972	1.870	50	20	IDGD	
O=C(CCc1cccc([N+](=O)[O-])c1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2	1793701233	BXVXLFIGKJUOBF-YWVIFJGQSA-N	430.288	1.921	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C(F)(F)C(F)(F)C(=O)O	1793978233	OIPNAFNHFOPGPI-MAUMQABQSA-N	433.196	1.763	50	20	IDGD	
Cc1cccnc1CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)CBr)C2	1793990423	GFUGMBMSQHKCCV-GGXPGOJBSA-N	438.366	1.943	50	20	IDGD	
COc1ccc(CCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)cc1	1796191219	MMQWQOOERHCTIW-WKCHPHFGSA-N	436.317	1.260	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1nccc2nc[nH]c12	1796677890	ITNQWARBUSGZQQ-FVCJKWQPSA-N	448.487	1.344	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1nc2ccccc2[nH]1	1796817704	QYTIICWZDHVGAK-JFILPPLUSA-N	435.322	1.797	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cn2ncccc2n1	1797042656	GFDAMQAWIFDTSB-OQMKEHIESA-N	436.310	1.106	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccn2ccnc12	1797456152	WZVUUDOERBHRRO-FCIKYMEBSA-N	425.316	1.774	50	20	IDGD	
Cc1onc(-c2ccncn2)c1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(C)(C)CCl)C2	1798488369	WOVUMPGSYCXHLE-XOIINTDNSA-N	447.923	1.908	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCS(=O)(=O)c1ccccc1)C2	1799266075	TXVRPNOZHRVWNP-HIRMHNASSA-N	442.965	1.457	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3nccn3c1)C2)[C@@H](F)Br	1799347261	KHERLPARGRTHRJ-AYRXBEOTSA-N	425.258	1.228	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CS[C@@H]1CCCCO1)C2)[C@H](F)Br	1799350382	XYTDNERIDFPGAR-BJBXXJATSA-N	439.347	1.526	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1nc2ccc(F)cn2n1	1800134249	IBPOBWAUUVZVSG-MSNRECKUSA-N	444.294	1.308	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C)=C/c1ccc(OC)cc1	1800295843	HUUXTXLPJXMVKF-UXNJRRTJSA-N	436.936	1.942	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(-n3ccnc3)ccn1)C2	1800760659	YVELODLHUWZHDX-ZJOBFFGXSA-N	448.321	1.254	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1C[C@@]12C(=O)Nc1ccccc12	1800761288	YMIAFFTXKMTSMV-WJVNXMQGSA-N	445.947	1.894	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cccc(F)c1F)C2	1800762694	YYFWVXFONGWIRG-AKENFEQQSA-N	431.277	1.880	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(C)cc1-n1nccn1)C2	1800979322	ZUMGWGSNADQVDH-HIRMHNASSA-N	447.923	1.033	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CCc2nc[nH]c2C1	1801266208	XZPYOUPADKXALK-MNLSVMLLSA-N	439.354	1.135	50	20	IDGD	
COc1cc(F)cc(/C=C/C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CCC(=O)NN(C)C)c1	1802339809	MKQXLESHDRERDJ-HFQWOMLFSA-N	446.523	1.859	50	20	IDGD	
COc1ccc(F)cc1CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(B(O)O)cc1)C2	1802498837	LZZUNRBSIXRUID-ACDBMABISA-N	440.280	1.009	50	20	IDGD	
CC(C)(CCl)C(=O)NC[C@@H]1CCN(C(=O)[C@@H]2CCCS2(=O)=O)[C@@H]1c1cccnc1	1802902004	IJFDDZXFQQZYOY-YESZJQIVSA-N	441.981	1.930	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)[C@@H](C)Cn2cccn2)[C@H]1c1cccnc1	1804724007	YWHFJTUJGMVNPA-WZGPROSRSA-N	433.940	1.874	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H]1C(=O)N1CCC2(CCCN(C(=O)[C@H](O)CCl)C2)CC1	1805518008	NJAJUYDZYIXSRI-HZPDHXFCSA-N	443.972	1.827	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)c2cocn2)[C@@H]1c1cccnc1	1806019385	XZBLNCQURKXGAN-VQMZYRHSSA-N	449.471	1.523	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)c[nH]1	1807360810	CUBZSBJNNVMJEJ-NQIIRXRSSA-N	432.289	1.031	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)Cc2cncnc2)[C@H]1c1cccnc1)[C@H](F)Br	1808651398	KVVFBRLXHQPNNS-XIRDDKMYSA-N	436.285	1.811	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)N1CC[C@H](CNC(=O)[C@@H](F)Br)[C@@H]1c1cccnc1	1808662499	MDOCTAWSISMERI-BQDHKBFISA-N	443.317	1.645	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)C2(F)CCC2)[C@@H]1c1cccnc1	1810308764	NSRDXBNQMFUDCC-MAUKXSAKSA-N	440.479	1.292	50	20	IDGD	
CCc1ccnc(C(=O)N2CCCC3(CCN(C(=O)c4ccc(B(O)O)cc4)CC3)C2)c1	1810396013	WKYNPUNJIASDQW-UHFFFAOYSA-N	435.333	1.482	50	20	IDGD	
Cc1nnc(CCC(=O)N2CCCC[C@@H]2c2cc(NC(=O)[C@H](O)CCl)n[nH]2)s1	1814868362	YYOURQYZFFCHKG-CHWSQXEVSA-N	426.930	1.794	50	20	IDGD	
CC(=O)Nc1cc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)[C@H](O)CCl)n[nH]2)ccn1	1814871042	IEUJIIYIJYNVDK-LSDHHAIUSA-N	434.884	1.669	50	20	IDGD	
CCc1[nH]nc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)c1F	1816258180	QMIMEXKDGKIHQE-CQSZACIVSA-N	448.503	1.513	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1ccns1	1816273161	ABCOXXGAKMWWFZ-OAHLLOKOSA-N	425.279	1.166	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)[C@@H](O)c1ccccc1	1817075552	KHHXCMJERBCSAQ-FPOVZHCZSA-N	448.288	1.129	50	20	IDGD	
Cc1nscc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1	1817470774	GUYRSDLYZTZVJD-KRWDZBQOSA-N	439.306	1.474	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cscn2)[nH]n1)c1ccc(B(O)O)cc1	1817471365	WJXIKTKCIIEBDG-MRXNPFEDSA-N	425.279	1.166	50	20	IDGD	
COC[C@H](NC(C)=O)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@](C)(Cl)CCl)[nH]n1	1819611688	KTVGTWYSZUWZMA-SUNYJGFJSA-N	448.351	1.789	50	20	IDGD	
C[C@](O)(CC(=O)O)CC(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCBr)[nH]n1	1822402938	APRWDCSGCBRZNT-YVEFUNNKSA-N	445.314	1.803	50	20	IDGD	
O=C(N[C@@H]1CCc2nc(NC(=O)[C@H]3CC(c4ccccc4)=NN3)sc2C1)[C@H](O)CCl	1824427933	PYSZKDZWKISXHL-DAXOMENPSA-N	447.948	1.421	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCn1ccnn1)CC2	1825647628	RVUBSJHOAFTYOH-ZJUUUORDSA-N	427.328	1.520	50	20	IDGD	
C=C[C@H](O)C(C)(C)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827052141	PQYDOIZEFTXDAH-RTWAWAEBSA-N	442.365	1.173	50	20	IDGD	
O=C(C1=CCCS1)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827055548	CHTFJNYQDMHIBJ-IBGZPJMESA-N	428.363	1.621	50	20	IDGD	
CCOC(=O)N[C@H](O)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CO[Si](C)(C)C)CC1	1829102894	QWGIXQCLMQNILN-FUHWJXTLSA-N	443.617	1.522	50	20	IDGD	
N#Cc1ccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)cc1	1830013291	WFJSEDDPTMBUSI-HSZRJFAPSA-N	445.328	1.785	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C[C@@H](N)c3cccnc3)C2)C1	1830358898	GIIILZIOJFGKRL-DYESRHJHSA-N	438.956	1.193	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(F)nc3)C2)C1	1830539171	DNPJLJOISFSSQI-ACJLOTCBSA-N	444.301	1.322	50	20	IDGD	
O=C(c1ccc(Cl)cc1F)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1830720054	RVLKSKVXFXRCPP-QAPCUYQASA-N	435.279	1.149	50	20	IDGD	
CCCNC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](Cl)CCC)CCO2	1831640721	QMTCYJDAWJUMFV-UZLBHIALSA-N	431.961	1.157	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(O)nc(Cl)c3)C2)C1	1831643931	LSISIWLNJRUVHH-KUHUBIRLSA-N	446.331	1.918	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](C)CBr)C3)C2)o1	1831785959	PHQXVILYDLUWRQ-ACJLOTCBSA-N	429.311	1.689	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CN2CCN(C)CC2)CC1	1831830533	DUQPQBYIDUZMND-MOPGFXCFSA-N	429.005	1.107	50	20	IDGD	
O=C1C[C@@H](C(=O)N2CCCC[C@H]2C2CCN(C(=O)CCBr)CC2)CCN1	1831936088	WBIFPHONGBXNHX-HOTGVXAUSA-N	428.371	1.917	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3cccnc3Cl)CCO2)C1	1832716512	MOBHOMHGSURBJI-HXUWFJFHSA-N	444.359	1.999	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccnc3OC)CCO2)C1	1834125293	OWMHCLNAZDPNJB-OXQOHEQNSA-N	425.913	1.568	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3CCC(F)(F)C3)C2)C1	1834818977	CAOZOZARENLRTK-CJNGLKHVSA-N	439.297	1.663	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)c3ccoc3Cl)C2)C1	1834823751	IJPWDMWGNHGZLK-INIZCTEOSA-N	435.702	1.788	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CNc3ccc(F)cc3)CCO2)C1	1835583166	JQNFHYCBLVCRQC-YLJYHZDGSA-N	427.904	1.711	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1CNc3ccccc31)CCO2	1835718444	WZCKDZHGNZJNMI-XMSQKQJNSA-N	447.608	1.504	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3cccnc3)CCO2)C1	1836152531	LXVUHNTYTSCNSZ-BEFAXECRSA-N	440.338	1.112	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)c3cccn4c(O)nnc34)CC2)CC1	1836393974	DTAMVJZYDRSZJF-QGZVFWFLSA-N	448.955	1.638	50	20	IDGD	
O=C(CCCn1cccc1)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836720668	ZEFHVNCAUJFVFR-LJQANCHMSA-N	425.957	1.867	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)CCNC(=S)NC)CC2)CC1	1836922448	KKOPSBNVNNGUBX-QGZVFWFLSA-N	447.045	1.877	50	20	IDGD	
C[C@@H](C(=O)N1CCC(OC2CCN(C(=O)CCBr)CC2)CC1)n1cncn1	1837654770	VAYFQCSHQKIBGL-AWEZNQCLSA-N	442.358	1.623	50	20	IDGD	
CCc1cnc(C(=O)N2CCO[C@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)s1	1837721974	JFCIGHQEBKBTML-IBGZPJMESA-N	441.626	1.627	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(CO)o3)CCO2)C1	1837970224	GNRLAFUQWMETDH-ROUUACIJSA-N	435.304	1.078	50	20	IDGD	
CCc1ncsc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](Cl)COC)C2)C1	1838838932	HTIYLMYLNNZELZ-FZKQIMNGSA-N	431.942	1.029	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(OC)cc3F)CCO2)C1	1839293051	NVSHGOKOAAXSEE-UZLBHIALSA-N	444.887	1.158	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc4[nH]c(C)cc4c3)CCO2)C1	1839616649	HHXMNMKTOKUYKT-PGRDOPGGSA-N	449.935	1.800	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cccnc3)C2)C1	1839964132	HOZYFCQBNAFWDI-VQIMIIECSA-N	440.338	1.254	50	20	IDGD	
CCc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](Br)CC)CCO3)no1	1839966284	ZUYBSKMAHGCBRQ-RDTXWAMCSA-N	444.326	1.481	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3cccnc3C)C2)C1	1840149931	BYKFIDRJJRMNGC-GHTZIAJQSA-N	439.940	1.033	50	20	IDGD	
O=C(c1cn2c(Br)cccc2n1)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1	1841351185	IJGBFAWKLRNVFY-LBPRGKRZSA-N	441.713	1.514	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1[C@@H](C(=O)N1CC3(CCCN3C(=O)[C@@H](O)CCl)C1)C2	1841354662	NDYZHUSLLIQMLK-VGWMRTNUSA-N	441.956	1.578	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCCC12CN(C(=O)CCn1cncn1)C2	1841925233	BQWORFBIEBNXDB-AWEZNQCLSA-N	440.932	1.004	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)c2ccc3sc(N)nc3c2)C1	1842963200	XRKUKBWMCNMNGV-UHFFFAOYSA-N	430.534	1.069	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)COc1ccccc1F)C2	1843416851	HRLRRBPVPDQHAS-MFKUBSTISA-N	441.463	1.542	50	20	IDGD	
CC(C)(C)c1ccc(C(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)s1	1843558870	BLKBWDFDSSYATK-UHFFFAOYSA-N	426.347	1.856	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)c1cc(=O)cco1)C2	1844692382	QIXINBISDUFICM-UHFFFAOYSA-N	441.396	1.604	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1O	1847235075	SQDVHUNPSVYIMJ-WOYTXXSLSA-N	443.972	1.824	50	20	IDGD	
CC(C)(C)OC(=O)N1CC2(CC[C@@H](C(=O)N3CC[C@H]4[C@@H]3CCN4C(=O)[C@H](F)Cl)O2)C1	1847286794	IFLGDTMKIAETDA-AJNGGQMLSA-N	445.919	1.891	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)OC	1847944369	MJAGUTBDIHWOHZ-YXMSTPNBSA-N	447.960	1.370	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)/C=C/c2ccc([N+](=O)[O-])cc2)cc1OC	10758178	BFEAIJNYOKBZPS-BJMVGYQFSA-N	429.385	1.630	50	20	IDGD	
CN(CC(=O)NNC(=S)NCCc1cccs1)S(=O)(=O)c1ccc(Cl)cc1	11509663	YSXIQNPNWFZZJB-UHFFFAOYSA-N	447.007	1.760	50	20	IDGD	
CON(C)S(=O)(=O)c1ccc(C(=O)NNC(=S)NCCc2cccs2)cc1	11520367	BJQWDYRGOKWFLU-UHFFFAOYSA-N	428.561	1.282	50	20	IDGD	
O=C(NNS(=O)(=O)c1cccc(S(=O)(=O)NC2CC2)c1)c1ccc(Cl)cc1	26158028	JQGWRMVAMZBTSS-UHFFFAOYSA-N	429.907	1.404	50	20	IDGD	
CN(C)CC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccc(C(F)(F)F)c1	727761531	MFBNSBYVHGAPNS-UHFFFAOYSA-N	444.435	1.829	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	728213155	FTAAUZVIOLCOQA-UHFFFAOYSA-N	448.545	1.544	50	20	IDGD	
CC(=O)c1cccc(O[C@H](C)C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1	728338166	GOCPRWURVWHAII-KUHUBIRLSA-N	442.424	1.187	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)N2CCC[C@H](NS(=O)(=O)c3cccc(F)c3)C2)cc1	729499270	CSUKHFYNNBKAOD-KRWDZBQOSA-N	445.476	1.495	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)[C@@H]1C[C@@H](O)CN1C(=O)OCc1ccccc1	729512769	OHXLNBAISKMMIV-WBVHZDCISA-N	447.875	1.882	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCc2nnnn2-c2ccccc2)ccc1OC(C)C	730582361	STCOBMNRJKUCRM-UHFFFAOYSA-N	425.449	1.602	50	20	IDGD	
CCN1CCN(C(=O)CC2CCN(CC(=O)NNC(=O)c3cccc(Cl)c3)CC2)CC1	731214327	DAIKGPORBMZMEM-UHFFFAOYSA-N	449.983	1.367	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCCC(=O)N2CCCCC2)cc1Br	732239810	ZCJZBUBVEHVPCM-UHFFFAOYSA-N	427.299	1.804	50	20	IDGD	
CCOCCCn1c(NNC(=O)C2(S(C)(=O)=O)CCCC2)nc2ccccc2c1=O	733269012	XJMBJFRIJQIPKN-UHFFFAOYSA-N	436.534	1.624	50	20	IDGD	
C[C@H](C(=O)NNC(=O)c1cnn(-c2ccccc2)c1)N1CCN(c2ccc(F)cc2)CC1	733365219	VWRRYPFCWNBWEL-QGZVFWFLSA-N	436.491	1.983	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](NC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])C1	734217218	GAJYDNBISGXUFX-CYBMUJFWSA-N	437.453	1.704	50	20	IDGD	
CC(C)(C)CC(=O)N1CSC[C@H]1C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C	734241319	MRRBIURYMWUQDX-LBPRGKRZSA-N	431.559	1.179	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)CNC(=O)c1ccc(C#N)cc1	734251733	LMSMAEQLYRBLQH-UHFFFAOYSA-N	429.502	1.508	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(N2C[C@@H](C(=O)NNc3cc(C)ncn3)CC2=O)cc1	734254169	MICLUFDCFAWMLA-HNNXBMFYSA-N	446.533	1.312	50	20	IDGD	
CCOCCCN1CC[C@H](NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)[C@@H](C)C1	734544345	QZCBNBMLOKMPSH-YJBOKZPZSA-N	440.566	1.171	50	20	IDGD	
O=C(Cc1cccnc1)NNS(=O)(=O)c1cc2c(cc1Br)CCC(=O)N2	734807606	XDWAEIZSURYXSL-UHFFFAOYSA-N	439.291	1.281	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2cc3ccccc3cc2O)CC1	735117464	UIOGOEQXFSTKGN-UHFFFAOYSA-N	441.513	1.633	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H](Cc2ccccc2)C2CC2)c1	737066301	JFHVIYVDGQMAGO-IBGZPJMESA-N	430.530	1.902	50	20	IDGD	
CN(C)c1nccc(NNC(=O)c2ccc([N+](=O)[O-])cc2I)n1	740102936	IKSCFTHUXYZXLL-UHFFFAOYSA-N	428.190	1.812	50	20	IDGD	
O=C(NN=Cc1c(N2CCOCC2)nc2ccccn12)C1CCN(c2ncccn2)CC1	741809539	GLMZIDJJENRYAC-UHFFFAOYSA-N	434.504	1.328	50	20	IDGD	
Cc1ccc(N2CCC[C@H](NC(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)C2=O)cc1	743510053	PAPPFYMEDXDJEA-SFHVURJKSA-N	434.460	1.110	50	20	IDGD	
O=C(CCNC(=O)c1ccsc1)NNc1ccccc1S(=O)(=O)N1CCOCC1	744620022	FBSWNKIMQFXCGO-UHFFFAOYSA-N	438.531	1.032	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1ccn(-c2ccc(F)cc2)n1	744621616	VSAPTUWHEMLDSN-UHFFFAOYSA-N	445.476	1.789	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NCCNC(=O)CC2CCCCC2)cc1	745792733	RTPDNWJFUYBWLI-UHFFFAOYSA-N	439.538	1.512	50	20	IDGD	
O=C(CNC(=O)[C@@H]1c2ccccc2C(=O)N1Cc1ccccc1)NNC(=O)C1CCCC1	745843467	KRLRCLUJUHTGAQ-NRFANRHFSA-N	434.496	1.838	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)N[C@@H]2CC(=O)N([C@@H]3C[C@H]3c3ccccc3)C2)cc1C	745915232	XTBHTEQHVAEXGS-HSALFYBXSA-N	449.511	1.729	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)N[C@@H]2C[C@H](C)N(c3cnn(C)c3)C2=O)c(C)n1-c1ccccc1	745916661	FGSQYHCZKFQPGN-MGPUTAFESA-N	449.515	1.966	50	20	IDGD	
CC[C@H](Nc1c([N+](=O)[O-])c(C)nn1C)C(=O)NNC(=O)c1cccc(OC(F)F)c1	746215093	HPPURKAIPPWVLD-LBPRGKRZSA-N	426.380	1.890	50	20	IDGD	
CN(C)CCOc1ccccc1CNC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	746725611	GWNXWTNBBZZDGI-UHFFFAOYSA-N	434.518	1.175	50	20	IDGD	
NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NNC(=O)Cc3cn4ccccc4n3)cc2)C1	746754830	DTQOBHBOTDEJMM-KRWDZBQOSA-N	449.515	1.109	50	20	IDGD	
Cc1nn(Cc2cccc(Br)c2)c(C)c1C(=O)NNC(=O)N1CCOCC1	747909769	YDXZETRGMRZGIC-UHFFFAOYSA-N	436.310	1.997	50	20	IDGD	
COC[C@@H](NC(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12)C1CC1	750447518	VBULAOPMZFWHPI-LJQANCHMSA-N	435.484	1.814	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)N[C@H]2CC(=O)N(C(C)(C)C)C2)nc1	750662932	QIVHQWHEQCRMBN-ZDUSSCGKSA-N	426.543	1.138	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)c2sccc2S(=O)(=O)Nc2cnn(C)c2)c1	750717731	AIMMZJYBZKULHB-UHFFFAOYSA-N	449.514	1.431	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)[C@H]1CCn2cncc2C1	750915411	WAXXRERNTUFHDG-INIZCTEOSA-N	430.940	1.064	50	20	IDGD	
CCc1ccccc1OCC(=O)NNS(=O)(=O)c1ccc(C(=O)CCC(=O)O)cc1	751201782	CPNGEORUVYZPJN-UHFFFAOYSA-N	434.470	1.685	50	20	IDGD	
Cc1ccc(OCc2nc(CC(=O)NNC(=O)CNC(=O)c3ccco3)cs2)cc1	751204720	NYTVWAXDWWWSQT-UHFFFAOYSA-N	428.470	1.743	50	20	IDGD	
CN(C)c1ccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c(F)c1	751548735	LIBXMHQSAIRPDU-UHFFFAOYSA-N	434.493	1.751	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)[C@]1(C)CCCN(C(=O)OC(C)(C)C)C1	751970661	DZHUBPSRNVWPBF-HXUWFJFHSA-N	443.545	1.879	50	20	IDGD	
CS(=O)(=O)N1CC[C@@H](CNC(=O)NNC(=O)Nc2ccc(-c3ccccc3)cc2)C1	753094496	VTYDKPLNZLHBBY-HNNXBMFYSA-N	431.518	1.971	50	20	IDGD	
COc1ccc(N2CCN(CC(=O)NNC(=O)c3ccc(OC)c(OC)c3)CC2)cc1F	753859920	BDURFGYOJQDVPF-UHFFFAOYSA-N	446.479	1.435	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)c2cc(OC)c(S(N)(=O)=O)s2)cc1OC	754180047	KHCQJGRLRZOEQZ-UHFFFAOYSA-N	443.503	1.276	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2cc(Br)cc(C#N)c2)cc1OC	754260113	SRVUNFPXXMJPHQ-UHFFFAOYSA-N	440.275	1.961	50	20	IDGD	
C[C@H](Cc1cc(Br)ccc1F)NC(=O)NNC(=O)C(=O)Nc1ccccn1	755096073	LQSDGWYWSUMGSD-SNVBAGLBSA-N	438.257	1.883	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2ccc(-n3cnnn3)cc2)cc1Br	755434585	IVLCYBIPRBGGJT-UHFFFAOYSA-N	432.238	1.900	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N(CC)CC)cc1NC(=O)NNC(=O)Cc1ccncc1	755440423	ACNFPXAPBXGHGB-UHFFFAOYSA-N	449.533	1.906	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)Nc2ccc(S(=O)(=O)NC3=NCCCCC3)cc2)n[nH]1	755499706	KEALAZGWNMSRDN-UHFFFAOYSA-N	433.494	1.435	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)C(=O)Nc1cc(Cl)c(F)c(Cl)c1	756155731	SEWODNVPHPCPKC-UHFFFAOYSA-N	438.206	1.508	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)[C@@](C)(O)CN1Cc2ccccc2C1=O	756798510	XYNAGCONMFJPCF-QFIPXVFZSA-N	427.457	1.019	50	20	IDGD	
CCS(=O)(=O)c1ccc(CCC(=O)NNC(=O)Cc2nc3ccccc3n2C)cc1	756864652	VPGSDYSKXPFJRE-UHFFFAOYSA-N	428.514	1.690	50	20	IDGD	
NC(=O)c1ccc(NNC(=O)[C@@H]2CCCN(C(=O)c3ccc(Cl)c(Cl)c3)C2)nn1	757403212	XGDMAXPFTYSSBJ-LLVKDONJSA-N	437.287	1.878	50	20	IDGD	
Cc1nn([C@H]2CCS(=O)(=O)C2)c(C)c1NC(=O)NNC(=O)c1ccc(O)c(Cl)c1	757871881	QMFOCEKEDWZFEA-LBPRGKRZSA-N	441.897	1.685	50	20	IDGD	
O=C(c1ccc(Br)nc1)N1CCN(S(=O)(=O)CBr)CC1	758518177	PPONGKDZOMLBGX-UHFFFAOYSA-N	427.118	1.284	50	20	IDGD	
COc1cccc(Oc2ncccc2CNC(=O)NNC(=O)C(=O)Nc2ccccn2)c1	758805296	UTZYNOPEUOOZBS-UHFFFAOYSA-N	436.428	1.747	50	20	IDGD	
O=C(COc1ccc(Br)cc1Cl)NNC(=O)C(=O)Nc1ccccn1	758831573	RDAHQNGIPVVSNT-UHFFFAOYSA-N	427.642	1.662	50	20	IDGD	
CCCn1nc(C(=O)NNS(=O)(=O)c2cccc(C(=O)O)c2C)c2ccccc2c1=O	763279311	WZJKZSCZVULORQ-UHFFFAOYSA-N	444.469	1.436	50	20	IDGD	
CCOC(=O)c1cc(CC)sc1NC(=O)C(=O)NNC(=O)c1ccc(OC)c(OC)c1	763541774	AYXBUADLNZVKGO-UHFFFAOYSA-N	449.485	1.904	50	20	IDGD	
CCOC(=O)c1cc(F)c(F)cc1NC(=O)C(=O)NNC(=O)c1ccc2c(c1)OCO2	763550956	JSZFZFQAQVUFTB-UHFFFAOYSA-N	435.339	1.270	50	20	IDGD	
CCOC(=O)c1c(F)cccc1NC(=O)C(=O)NNC(=O)c1ccc(OC)c(OC)c1	763552408	ZUBRWYGAZSFOHV-UHFFFAOYSA-N	433.392	1.419	50	20	IDGD	
C#CCOc1cccc(NC(=O)C(=O)NNC(=O)COc2cccc(C(F)(F)F)c2)c1	763639807	SFPSDJZHUASIGX-UHFFFAOYSA-N	435.358	1.882	50	20	IDGD	
COCCn1ccc2ccc(NC(=O)C(=O)NNC(=O)COc3ccccc3C#N)cc21	763808493	XCCXHRJDXOIWMP-UHFFFAOYSA-N	435.440	1.324	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(OCC(F)(F)F)nc2)cc1	763809896	UGFSRFJWPLCIDQ-UHFFFAOYSA-N	426.351	1.496	50	20	IDGD	
COCCn1cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc3ccccc3c2)cn1	763851876	VZJPRUQPJPZHNM-AWEZNQCLSA-N	425.445	1.236	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)c(OC)c1OC	763864705	GHKGUTDXTWQAOL-LLVKDONJSA-N	435.408	1.405	50	20	IDGD	
Cc1cccc(C(=O)N2CCCC2)c1NC(=O)C(=O)NNC(=O)Cc1ccc(F)cc1	763919990	AYNJZGKJRUPELV-UHFFFAOYSA-N	426.448	1.699	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)C2=S=C3CCCCCC3=C2)cc1C	763969671	ZPIHPBNPZPBILG-UHFFFAOYSA-N	429.498	1.850	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1ccccc1CS(C)(=O)=O	764013274	WJTVDXBWLZDGBZ-UHFFFAOYSA-N	439.877	1.293	50	20	IDGD	
CCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2OC)c(C)c1	764013339	WVTRZDFQBUCGBA-UHFFFAOYSA-N	432.864	1.806	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2O1)C(=O)Nc1ccc2c(c1)nc1n2CCCCC1	764168525	QJXILIUJOKFJOD-IBGZPJMESA-N	433.468	1.852	50	20	IDGD	
CC(C)CCC(=O)NNC(=O)C(=O)Nc1ncn(Cc2cccc(Br)c2)n1	764203150	NDDMYFDYAORYOI-UHFFFAOYSA-N	437.298	1.611	50	20	IDGD	
CNC(=O)c1ccc(OC)c(NC(=O)C(=O)NNC(=O)c2c(Cl)cccc2Cl)c1	764226182	IKHPVVZNQPHNPQ-UHFFFAOYSA-N	439.255	1.761	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(/C#N)C(=O)NNC(=O)CNC(=O)c2cccnc2)c1C	764344213	UZQUTZFFUJHTJM-VRKJEAOJSA-N	438.488	1.192	50	20	IDGD	
O=C(CN1CCC(C(=O)NCCCN2CCCCC2)CC1)NNC(=O)c1ccc(F)cc1	764384295	XFAROKGTOVTCGG-UHFFFAOYSA-N	447.555	1.291	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)[C@H](c1ccccc1F)N1CCOCC1	765318755	PCVGAACNVCTJAL-SFHVURJKSA-N	438.500	1.651	50	20	IDGD	
COc1cc(C(=O)NNC(=O)N[C@@H]2CCN(C3CCCCC3)C2=O)cc(OC)c1OC	765631594	SQUUARSANYDQMU-OAHLLOKOSA-N	434.493	1.590	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)NCCc1ccc(OCC(=O)NC2CC2)cc1	765663114	RERWMXGLMCQNLP-UHFFFAOYSA-N	446.529	1.616	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1ccc(N2CCc3sccc3C2)nc1	766260933	MXQSXPRWIZHTDJ-UHFFFAOYSA-N	425.474	1.586	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CC(=O)N(c2ccc(Cl)c(F)c2)C1)[C@@H]1COc2ccccc2O1	766295925	SVCMSWTXZRZFCL-DIFFPNOSSA-N	433.823	1.819	50	20	IDGD	
CCCS(=O)(=O)Nc1ccccc1C(=O)OCC(=O)NNC(=O)Cc1ccccc1C	767291085	JVHHVBXTBLENRR-UHFFFAOYSA-N	447.513	1.694	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NC2CCN([C@H]3CCC[C@@H]3O)CC2)cc(OC)c1OC	767927286	JYVXJEWQUYISCF-HOTGVXAUSA-N	436.509	1.034	50	20	IDGD	
COc1ccc(CCN2C[C@H](C(=O)NNC(=S)Nc3ccccn3)CC2=O)cc1OC	768581849	VYIIHFYNWICJMA-OAHLLOKOSA-N	443.529	1.508	50	20	IDGD	
C[C@]1(c2cccc(C(=O)NNC(=O)Cc3nc(-c4ccccc4)cs3)c2)NC(=O)NC1=O	768929808	SQZSFLMFMMZLPT-JOCHJYFZSA-N	449.492	1.868	50	20	IDGD	
COc1ccc(N(CCC(=O)NN(C)C(N)=O)S(=O)(=O)c2ccc(C)c(C)c2)cc1	770439636	QVFZPMFSFYTCEO-UHFFFAOYSA-N	434.518	1.939	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(C(=O)NNc2ccnc(Br)c2)cc1	771540152	GSMUHKFKVXAORG-UHFFFAOYSA-N	429.296	1.526	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)NCCN(C)S(=O)(=O)c2cccs2)cc1	772016623	QFIANZCYZXBZSE-UHFFFAOYSA-N	440.551	1.471	50	20	IDGD	
CCN1CCC[C@@H]1CN1C[C@H](C(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)CC1=O	772997453	VDUPIYBABGSFLC-BFYDXBDKSA-N	436.940	1.588	50	20	IDGD	
COc1cc(SC)ccc1NC(=O)C(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	773525914	VJYOHFQCTOSIEH-UHFFFAOYSA-N	441.469	1.064	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2ccc(Cl)c(-n3nnnc3C3CC3)c2)n1	773729908	CFFSAHGRCHNQCV-UHFFFAOYSA-N	429.828	1.074	50	20	IDGD	
O=C(NNc1cnc2ccccc2n1)c1cccc(S(=O)(=O)NC[C@@H]2CCCO2)c1	774780173	UXNAJFWCBIZGTH-HNNXBMFYSA-N	427.486	1.844	50	20	IDGD	
CCOC(=O)c1c(NC(=O)NNC(=O)c2ccccc2OC)c(C#N)cn1CCOC	775764739	FOSGZGUJXTWGDK-UHFFFAOYSA-N	429.433	1.658	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)Nc1ccnn1[C@@H]1CCS(=O)(=O)C1	776054472	GLKJMSZQAOMCQF-GFCCVEGCSA-N	439.519	1.196	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)Nc2ccc(S(=O)(=O)NC(C)(C)C)cn2)c1	776063084	OYJPODRIGIUSHG-UHFFFAOYSA-N	434.522	1.691	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2N2CCOCC2)cc1OC	776285276	KOZIVIYWVDRTKQ-UHFFFAOYSA-N	430.417	1.523	50	20	IDGD	
C[C@H](CN1CCN(c2ccccc2)CC1)NC(=O)NNc1cccc(S(C)(=O)=O)c1	776620858	YSMOEEVKNKQEEC-QGZVFWFLSA-N	431.562	1.927	50	20	IDGD	
N#C/C(=C/c1ccc(O)cc1)C(=O)N1CCN(S(=O)(=O)c2c[nH]c3ncccc23)CC1	776633080	VCKPUQHXYKQEGR-VBKFSLOCSA-N	437.481	1.709	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1)N[C@H]1CCC[C@@H]1CCO	779710322	CKZDIKCJDLIDKG-XLIONFOSSA-N	449.515	1.884	50	20	IDGD	
Cc1cc(N2C[C@H](C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)CC2=O)ccc1F	779903284	GLAJNERZBSONJX-MRXNPFEDSA-N	440.479	1.341	50	20	IDGD	
CC(C)OCCCn1c(NNC(=O)c2cccn3c(O)nnc23)nc2ccccc2c1=O	780937853	JGQHAVMLYKZNPD-UHFFFAOYSA-N	437.460	1.717	50	20	IDGD	
Cc1cc(OC(C)C)ccc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)NC(C)C)cn1	783264836	RZFDZKVENCTVNC-UHFFFAOYSA-N	449.533	1.946	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)c(N(C)C)n1	783408111	IRVDBSBXEAOPGF-UHFFFAOYSA-N	445.423	1.831	50	20	IDGD	
CC(C)OC(=O)c1ccc(Cl)c(NC(=O)C(=O)NN[C@@]2(C)CCS(=O)(=O)C2)c1	783427360	RQYFYKLODRIQHH-KRWDZBQOSA-N	431.898	1.042	50	20	IDGD	
CN(NC(=O)c1cc(F)ccc1[N+](=O)[O-])C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	783704100	JGHVMNGGDIXOQV-UHFFFAOYSA-N	425.417	1.983	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H]2CN(C(=O)NNC(=O)CNC(=O)c3ccco3)C[C@@H]21	784263365	MHWZZYLZKYYXDU-QLFBSQMISA-N	449.508	1.375	50	20	IDGD	
O=C(NNc1ccc(F)c(F)c1F)C(=O)Nc1ccc(N2CCCS2(=O)=O)cc1	784814779	LAIHOJYSIRZGMT-UHFFFAOYSA-N	428.392	1.726	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc2c(c1)CCN2C(=O)C(=O)NNc1cc(F)c(F)c(F)c1	785086606	AYDIXTYROWSZDI-UHFFFAOYSA-N	442.419	1.387	50	20	IDGD	
CCCNS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2nccc(N(CC)CC)n2)cc1	785238646	ZAUPWTZNXNRPQK-UHFFFAOYSA-N	449.537	1.093	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2cccc3c2OC(C)(C)C3)nc1	789594854	MHYNKKBZZLRPNB-UHFFFAOYSA-N	447.517	1.564	50	20	IDGD	
COC(=O)c1nn(C)c(C)c1/C=C(/C#N)C(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1	792865021	ASFPTBUMIAEWFD-QINSGFPZSA-N	438.444	1.679	50	20	IDGD	
N#CC[C@H](CC(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1)c1ccccc1	793681676	JGFYRIQNPSZYGK-OAQYLSRUSA-N	433.512	1.679	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(=O)c3ccc(F)cc3o2)c1	794764349	SOESEWWYNFENQV-UHFFFAOYSA-N	433.417	1.257	50	20	IDGD	
CSC[C@@H](C)C(=O)N1CCC(C(=O)NNc2ccccc2S(=O)(=O)N(C)C)CC1	795181043	GVETZCUFTWSKHY-CQSZACIVSA-N	442.607	1.618	50	20	IDGD	
O=C(NNC(=O)c1ccc(C(F)(F)F)cc1N1CCCC1)N[C@H]1CCS(=O)(=O)C1	795528840	YSBVJNLZGQRUIJ-LBPRGKRZSA-N	434.440	1.437	50	20	IDGD	
Cn1cc(-c2cc(F)ccc2NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)cn1	796992361	OMYVCPSWABGPKL-UHFFFAOYSA-N	436.403	1.263	50	20	IDGD	
Cc1ccc(-n2cnnc2)c(C(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)c1	797877449	TWGIBQRNDBHAMN-UHFFFAOYSA-N	443.508	1.919	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1ccc(OCC(F)(F)F)c(Cl)c1	800569384	WBTBYOBYRKSPPU-ZETCQYMHSA-N	432.808	1.372	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NC[C@@H]2CCCC(F)(F)C2)cc1	800718810	NPOBTPPTMQRLTO-CQSZACIVSA-N	432.493	1.771	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)NCCNS(=O)(=O)c1ccc(F)cc1Cl	800983484	KSMOMNOOOOQMBF-UHFFFAOYSA-N	428.873	1.710	50	20	IDGD	
CN(CCc1cccc([N+](=O)[O-])c1)C(=O)NNC(=O)c1csc(N2CCOCC2)n1	800983556	NICOLPZSIRACGF-UHFFFAOYSA-N	434.478	1.417	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2cc(CCOC)ccn2)c1	806658671	WMLNQCFGQJUZDE-UHFFFAOYSA-N	449.533	1.768	50	20	IDGD	
CCN(CC)CC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(C)c(F)c2)c1	806985750	HOCHGWDXOHULBL-UHFFFAOYSA-N	443.479	1.814	50	20	IDGD	
Cc1ccccc1NC(=O)NNC(=O)C(=O)Nc1ccc(F)c(N2CCCNC2=O)c1	807000459	BEOWDOZVCLMNQN-UHFFFAOYSA-N	428.424	1.845	50	20	IDGD	
COC(=O)c1cc(C)c(NC(=O)C(=O)NNc2ccc(-n3cccn3)nn2)c(Cl)c1	807002243	UFROOUWBIQEKHQ-UHFFFAOYSA-N	429.824	1.493	50	20	IDGD	
O=C1COC[C@@H](C[C@H]2CN(C(=O)C(=O)NNc3cc(Cl)ccn3)c3ccccc32)N1	807013228	LPYXHYQAEQNHGF-GXTWGEPZSA-N	429.864	1.214	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H](C)CN(C)C)c1	807575808	KDHWQKSRJKACGL-AWEZNQCLSA-N	449.533	1.390	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)N[C@@H]1CCCN(C(=O)CCC(F)(F)F)C1	807575832	KTEMITQREXROST-CYBMUJFWSA-N	440.426	1.541	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)NCCCn2cc(Br)cn2)nc2ccccc21	807613811	QSRUEBXVHVBXDG-UHFFFAOYSA-N	434.298	1.496	50	20	IDGD	
C[C@@H]1CCCN(c2cc(C(=O)NNC(=O)c3csc(N4CCOCC4)n3)ccn2)C1	812452042	PKNTVTVMTHKMLU-CQSZACIVSA-N	430.534	1.686	50	20	IDGD	
Cc1cc(CN2CCN(C(=O)NNC(=O)c3ccc(Br)s3)CC2)on1	813539825	ATNBIZZOIHNGKF-UHFFFAOYSA-N	428.312	1.979	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N1CC[C@]2(CCN(C)C2)C1	814270599	AFONOCQLZWUSEF-UGSOOPFHSA-N	425.327	1.985	50	20	IDGD	
O=C(CC(F)(F)F)NNC(=O)C(=O)Nc1ccn(-c2ccc(Br)cc2)n1	815568673	PWMCRDNUEBNDJO-UHFFFAOYSA-N	434.172	1.673	50	20	IDGD	
O=C(NNc1ncncc1F)C(=O)Nc1ccc2c(c1)N(C(=O)Cc1ccccc1)CC2	815764634	OIZZFGTXZVQPCO-UHFFFAOYSA-N	434.431	1.829	50	20	IDGD	
COC(=O)c1cc(NNC(=O)CCc2c(C)nc(N3CCOCC3)nc2O)ccc1C	816689332	DJOPCUFSJLYPCS-UHFFFAOYSA-N	429.477	1.498	50	20	IDGD	
N#Cc1cc(F)ccc1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	818377503	GPXWCPMOMOMLRC-UHFFFAOYSA-N	431.449	1.948	50	20	IDGD	
O=C(CNS(=O)(=O)c1c(Cl)cccc1Cl)NNC(=O)c1cccc([N+](=O)[O-])c1	912770571	XBHPUHWXDKWJJP-UHFFFAOYSA-N	447.256	1.641	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)c2ccccc2I)C[C@@H](C)O1	912920953	GUGNOKDSDBLEAN-VXGBXAGGSA-N	431.274	1.552	50	20	IDGD	
C[C@@H](Oc1ccccc1Cl)C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	914333724	QELRBHIAMUAXPO-SECBINFHSA-N	432.285	1.869	50	20	IDGD	
COc1ccnc(NNC(=O)c2ccc(Br)c(S(=O)(=O)N(C)C)c2)n1	914763018	JVBVZFWDYMUVPO-UHFFFAOYSA-N	430.284	1.255	50	20	IDGD	
COc1cc(CNC(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)cc(OC)c1OC	915932162	UKXVGHGNLXFTGT-UHFFFAOYSA-N	430.461	1.798	50	20	IDGD	
Cc1ccc(C)n1-c1ccc(C(=O)NNC(=O)NC2CCN(S(C)(=O)=O)CC2)cc1	916237780	LIKHEHOAKXPAJB-UHFFFAOYSA-N	433.534	1.462	50	20	IDGD	
O=C(COc1ccc(OCc2ccccc2)cc1)NNC(=O)NCC(=O)N1CCCCC1	916473557	QIVQDYMAZSUFJX-UHFFFAOYSA-N	440.500	1.987	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NC[C@@H](C)N2CCc3ccccc3C2)c2ccccc2c1=O	916604576	IMQJRHOCHYCTNT-MRXNPFEDSA-N	448.527	1.807	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCCOc2c(C)cccc2C)cc1	916644064	SDZZHERRTGWTRN-UHFFFAOYSA-N	448.545	1.642	50	20	IDGD	
CN1C(=C(C#N)C(=O)COC(=O)[C@H](CO)NC(=O)c2ccccc2)N(C)c2ccccc21	917501896	HAOXRYYVQVDYDM-KRWDZBQOSA-N	434.452	1.211	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)c(C)c1	917723698	JIYHTSUIKSJBPD-UHFFFAOYSA-N	426.520	1.228	50	20	IDGD	
CCCC(=O)N1CCC[C@H]1C(=O)NNC(=O)c1cccc(S(=O)(=O)N(CC)CC)c1	917901062	OCWXEQNWFVPTJP-KRWDZBQOSA-N	438.550	1.269	50	20	IDGD	
Cc1nccn1-c1ccc(CNC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])cn1	918113346	VLFCPELWJQSCKZ-UHFFFAOYSA-N	425.405	1.393	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cc(-c3ccc(C)o3)[nH]n2)cc1OC	919325680	PDPYPAGTVGUDPE-UHFFFAOYSA-N	428.401	1.613	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCC(C)(C)N2CCC[C@H](C)C2)nc1	919797792	VWGNGJJFFLZFHM-HNNXBMFYSA-N	426.587	1.905	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)NCc1cccc(S(=O)(=O)NC(C)C)c1	919904416	LRERRCUVOMQSCC-UHFFFAOYSA-N	434.518	1.455	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)Cc1ccc(S(=O)(=O)N2CCCCC2)cc1	920006212	AXWDINIIDNHXBN-UHFFFAOYSA-N	445.541	1.802	50	20	IDGD	
COc1ccccc1-c1nn(-c2ccccc2)cc1C(=O)NNC(=O)CN1CCCC1=O	920825901	MFSVBDUDFLEJAW-UHFFFAOYSA-N	433.468	1.931	50	20	IDGD	
O=C(NCCc1cccs1)NNC(=O)[C@H]1CS[C@@H](Cc2ccccc2F)C(=O)N1	920859305	BLHRQFXNDLJHLS-CVEARBPZSA-N	436.534	1.603	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)NCCNS(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1	921247946	NSHBVNVWGRGURH-UHFFFAOYSA-N	435.462	1.080	50	20	IDGD	
COc1ccc(CN2CC[C@H](NC(=O)NNC(=O)c3cncn3-c3ccccc3)C2=O)cc1	1318880269	NQONIZGCZNODIS-IBGZPJMESA-N	448.483	1.626	50	20	IDGD	
CC(C)c1nn([C@@H]2CCS(=O)(=O)C2)cc1C(=O)NNc1nc2ccccc2c(=O)n1C	1319123139	JSGWXJJVVSGNLY-CYBMUJFWSA-N	444.517	1.370	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)N[C@@H]1CCO[C@@]2(CCS(=O)(=O)C2)C1	1324924265	NMTCVEYGCDOXNO-PXAZEXFGSA-N	431.898	1.029	50	20	IDGD	
O=C(c1cnnc2ccccc12)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1777728584	YDMZBXLEWCZJNQ-QAPCUYQASA-N	437.269	1.764	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnn4c(C)cc(C)nc34)C2)C1	1777779828	MRRPEYPFYDPWGQ-OXJNMPFZSA-N	435.912	1.043	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H]3[C@H]4Sc5ccccc5[C@H]43)C2)C1	1779049035	MPZHKZBUNIWQFN-KDBGDGBXSA-N	436.961	1.958	50	20	IDGD	
COc1ncccc1CCC(=O)N1CCO[C@@]2(CCN(C(=O)CO[Si](C)(C)C)C2)C1	1779294388	PUFQAAHLLMAVDT-OAQYLSRUSA-N	435.597	1.704	50	20	IDGD	
COc1ccc2[nH]cc(C(=O)N3CC[C@@]4(C3)CN(C(=O)C(Cl)Cl)CCO4)c2n1	1780047174	ZGGHMYWXPBEYTR-GOSISDBHSA-N	427.288	1.819	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(CO)o1)C2)[C@H](F)Br	1780774654	GPUGWRMBPJDHQM-JKIFEVAISA-N	433.274	1.590	50	20	IDGD	
CC(=O)N[C@H](C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1)C(C)(C)C	1781324999	HKEMSIPWNFBRAT-PBFPGSCMSA-N	436.322	1.058	50	20	IDGD	
CC(C)Oc1ccc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)c(F)c1	1782065820	UASJTHRCJMZZNN-XLIONFOSSA-N	428.888	1.656	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cn3ccccc3n1)C2	1782172582	GTOOGJBTOBKCHR-QLVMHMETSA-N	434.924	1.716	50	20	IDGD	
C[C@@H](C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)CBr)C2)n1cncn1	1782526024	LPARNAGFURCRDA-OIPACUDHSA-N	442.358	1.384	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)Cc3cc(Cl)ccc3OC)C2)C1	1782978133	CSJQYBPUNSCYLP-OXJNMPFZSA-N	445.343	1.975	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(CCN(C(=O)COc3ccccc3F)C2)C1	1783354703	CXBKDVRJKLSRHO-GOSISDBHSA-N	429.286	1.819	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)C(C)(C)CCl)[C@H]3C2)nc2nccn12	1783853459	DQDWTORZCLEEHB-ZOBUZTSGSA-N	433.940	1.896	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)Cc3c[nH]c4cc(OC)ccc34)CCO2)C1	1783871164	NINYVMLQUCBYBD-GCJKJVERSA-N	449.935	1.803	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccn4c(C)cc(C)nc34)CCO2)C1	1783880867	HWNCBYZUYKZZQD-UTKZUKDTSA-N	434.924	1.648	50	20	IDGD	
CC(C)c1ccc(CC(=O)N2CCO[C@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc1	1783937103	PHELLRULOSNDLC-DEOSSOPVSA-N	444.576	1.555	50	20	IDGD	
CC#C[C@@H](CC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](Cl)COC)CCO2)c1ccc(O)cc1	1784012798	CCPHBQRMBSJCPM-JXHRLWIKSA-N	448.947	1.973	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(Br)cn3)C[C@@H]21)[C@@H](O)CCl	1784090981	GCXJOCOWAONCEK-LVGORTOPSA-N	446.729	1.037	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3CC(c4ccccc4)=NO3)[C@H]2C1	1784406906	DRSIQBATJIUTTM-CAVMOMJPSA-N	449.935	1.413	50	20	IDGD	
CCc1[nH]nc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)CBr)C[C@@H]32)c1F	1785790426	RRMMVZCXDSIMAT-MNXVOIDGSA-N	445.333	1.736	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)c3ccccc3)[C@H]2C1	1786671809	XDLYWPSBEHKVHX-YYESSZKYSA-N	425.323	1.483	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3CC(C)(C)C3)C[C@@H]21	1787508067	BORAIWYIFOXDIS-IIYRHJEWSA-N	443.548	1.536	50	20	IDGD	
CCc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)CBr)C[C@@H]32)no1	1788984506	XTHRNZSDYFUPOQ-DUPGQFARSA-N	428.327	1.861	50	20	IDGD	
Cc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Br)C[C@@H]32)c(C)n1	1789111303	OZSOZDOKUMTMMI-TUUVXOQKSA-N	428.302	1.982	50	20	IDGD	
O=C(NC1(c2ccc(NC(=O)c3cccc(F)n3)cc2)CCC1)c1cccc(B(O)O)c1	1789736686	JVLPEUNDBPVIRH-UHFFFAOYSA-N	433.248	1.962	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(-c4cc[nH]n4)cc3)[C@H]2C1	1790189045	XYSJXRWTUKTTFT-JPLJXNOCSA-N	446.935	1.924	50	20	IDGD	
CCOC(=O)O[C@@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](Br)CC)C[C@@H]21	1790609792	ILKIZGOSGXUIOO-YTFOTSKYSA-N	449.342	1.701	50	20	IDGD	
CN1CC(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)/C(C#N)=C/c4ccc(F)cc4F)[C@H]3C2)C1	1790695843	XBWMHEUOMJKVNG-ZGUZDIQNSA-N	444.482	1.413	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc(OC)cn3)C[C@@H]21	1790961014	HEIJUZVPFOPMRT-ABHRYQDASA-N	441.326	1.252	50	20	IDGD	
Cc1nn(C)c(C)c1CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)Br)C[C@@H]21	1791638353	ZHEFFWHFKKMNGZ-UMPQAUOISA-N	441.370	1.343	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)n3cccn3)[C@H]2C1	1791642101	AYTBQJQXMMRJQJ-QXKUPLGCSA-N	427.343	1.597	50	20	IDGD	
C[C@H](NNc1ccccc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@](C)(Cl)CCl)C2	1792507894	BZLBMEPXYZZYDF-FXTXOLNPSA-N	443.375	1.818	50	20	IDGD	
Cc1cccc(/C=C/C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)n1	1792547384	WAVLNLACDIATLH-KXXXJKOBSA-N	434.500	1.354	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1(C(F)(F)F)CC1)C2	1792871440	YTCDKVLUCFBDGK-WISYIIOYSA-N	427.261	1.950	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CCc2ccoc2C1	1793124009	NTSDFNOXNUQOGL-YIIZKNBGSA-N	425.323	1.758	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)[C@H]1COc2ccccc2O1	1793842471	LXUYWUMKXYZFDE-MOEWQIFZSA-N	443.269	1.107	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(F)cc1F)c1ccc(B(O)O)cc1	1793919368	HKMGDEACRHTJOJ-BXKBSFEHSA-N	440.255	1.610	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnn(C(C)(C)C)c1	1794351343	VFMDBHJKNHWRPK-MHEUCROKSA-N	427.343	1.625	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)nc(Cl)c1	1794414372	MTCBAINQPVYGLO-UOHMRFDXSA-N	436.723	1.880	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(OC(F)F)cn1	1794459273	QBINSBCEHRBJSX-NJBDSQKTSA-N	448.264	1.670	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccc2c(c1)OCO2	1795313054	PSMOVMNQMVFJMZ-NASWQRNTSA-N	439.306	1.331	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN(C)C(=O)OC(C)(C)C	1795336335	CNBOWEKRHHPLMK-JYYAWHABSA-N	431.961	1.850	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(C)nn1-c1ccccc1	1796475176	VXDWVSRAWLNVGK-YNVMFWSZSA-N	446.935	1.638	50	20	IDGD	
C[C@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@](C)(Cl)CCl)C2)[C@H]1SC(=N)NC1=O	1796881160	ZIFJLSDWHABODS-IBDUMEDKSA-N	435.377	1.663	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCc1cncnc1)C2	1796892115	IQBHRKBRNNFRBD-MVUGMWCJSA-N	437.504	1.181	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H]1CCCSC1)C2	1796892994	FLTIYLVPMDBPDI-CXRKSGDCSA-N	431.562	1.902	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1ccc2cnccc2n1	1796893333	BUPXJKCXOWVBKO-VZAMPYOESA-N	437.269	1.524	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2cccnc2n1	1797355860	RRTGNLAFHZFQMH-FAYQHZLMSA-N	447.333	1.864	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2cccnc2n1	1797359762	PQXVKSJYCSESTJ-ZIEJDFEHSA-N	433.306	1.616	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccn(C(C)C)n1	1798726532	SACCTQGHYFDWMS-HLPPOEQASA-N	427.343	1.841	50	20	IDGD	
CC(C)c1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2ccc(B(O)O)cc2)C3)cc1	1798959603	PUGMSPNHUGCGHG-VTYHHJSWSA-N	436.317	1.007	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CCc3nc[nH]c3C1)C2	1799278327	ATBSVVZMMHQJOJ-FLEUSKLQSA-N	429.348	1.341	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)cc([N+](=O)[O-])c1	1799731691	JIVHUECCLGLYPU-ZSBFGKGUSA-N	437.525	1.355	50	20	IDGD	
N#Cc1ccc2[nH]nc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)CCBr)C4)c2c1	1799883229	CYBRQWJRYBNBOY-FVCICTRLSA-N	446.305	1.423	50	20	IDGD	
O=C(Cc1ccc([N+](=O)[O-])cc1F)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2	1800403049	SFFJOCAFTJELMR-QHBPRCKVSA-N	434.251	1.670	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](CC)N(CC)CC)C2	1800639865	AJZAQRUGOIVJJZ-NNXHMXCWSA-N	432.403	1.870	50	20	IDGD	
CC#C[C@H](CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](Cl)COC)C2)c1ccc(O)cc1	1801058725	OVHIBZAQJKPRPX-FHZCGSGISA-N	448.947	1.733	50	20	IDGD	
CCOC(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)CBr)C2)OCC	1801147561	UJYMPYNOLBLQIS-ZJOBFFGXSA-N	435.359	1.396	50	20	IDGD	
CC(C)(CCl)C(=O)NC[C@@H]1CCN(C(=O)CCS(C)(=O)=O)[C@H]1c1cccnc1	1802904030	HTSCTMQOJINNGL-RDJZCZTQSA-N	429.970	1.787	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2nc3ccccn3n2)[C@H]1c1cccnc1)[C@H](O)CCl	1803139106	KJYCAOSPYFQRPU-UXLLHSPISA-N	428.880	1.044	50	20	IDGD	
CC(=O)NC(C)(C)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)Br)[C@H]1c1cccnc1	1803598820	TWPZCCWIOBAKRU-KCXAZCMYSA-N	439.354	1.786	50	20	IDGD	
COc1nccnc1C(=O)NC[C@@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1	1804971702	PJOAJMJKFLWOQX-YOEHRIQHSA-N	448.321	1.985	50	20	IDGD	
CN1CCCC[C@H]1C(=O)N1CCCC2(CCN(C(=O)c3cnccc3C(=O)NN)CC2)C1	1805558947	YDSQGMQHKDSKMP-IBGZPJMESA-N	442.564	1.014	50	20	IDGD	
COc1cnc(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](C)Br)[C@H]2c2cccnc2)cn1	1806046571	JXQNOWDIKZJACX-IFIJOSMWSA-N	448.321	1.983	50	20	IDGD	
COCCOCCOCCC(=O)N1CC[C@H](CNC(=O)[C@H](F)Cl)[C@H]1c1cccnc1	1808320240	IHNZHHFLYQUZOS-QRQLOZEOSA-N	445.919	1.692	50	20	IDGD	
CC(=O)Nc1cc(C(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)ccn1	1808920298	WZOOFDFCTKLTTD-YQVWRLOYSA-N	445.907	1.354	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2cc(OC)n(C)n2)[C@H]1c1cccnc1	1811636771	ZSKULOXGCBQARC-RLFYNMQTSA-N	435.912	1.397	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)[C@@H]2C[C@H]3CC[C@@H]2O3)[C@H]1c1cccnc1	1812894539	ZOKMEQWQGIZKSO-SXUUSABNSA-N	443.548	1.028	50	20	IDGD	
CCc1cc(C(=O)N2CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)n[nH]1	1813070566	IUBPIFPWPCNSHZ-KKSFZXQISA-N	441.536	1.060	50	20	IDGD	
Cc1ocnc1C(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1813074741	WMXAARBFKQTADM-JXFKEZNVSA-N	428.493	1.071	50	20	IDGD	
CC(C)/C=C/C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1	1813695002	XTKUUKCBNXLXPZ-HAYFENEFSA-N	436.516	1.612	50	20	IDGD	
CCOC(=O)C(C)(C)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1	1814166736	IYXGESYIPWZTSQ-JYJNAYRXSA-N	425.913	1.276	50	20	IDGD	
C[C@@H](CBr)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCS(C)(=O)=O)[nH]n1	1814783622	QXVJSVIBCUKQLE-WCQYABFASA-N	449.371	1.868	50	20	IDGD	
CC(=O)N[C@H](C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](O)CCl)n[nH]1)C(C)(C)C	1814863989	FCSKXMKWLFHJLG-OFQRWUPVSA-N	427.933	1.552	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@H]1CCc2nc(NC(=O)CCSC(=N)N)sc2C1	1814946191	UKSNGXUCQMKYIQ-JTQLQIEISA-N	429.644	1.923	50	20	IDGD	
Cc1ccc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)cc1	1815360209	BSFFALZSZICLBG-KRWDZBQOSA-N	435.314	1.671	50	20	IDGD	
N[C@@H](Cc1cccnc1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)C(Cl)Cl)CC2	1817192403	IXAAVWIPGJBDNL-QWRGUYRKSA-N	428.345	1.824	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cnccc2F)[nH]n1)c1ccc(B(O)O)cc1	1817471650	UQLMLKVMIMODJP-SFHVURJKSA-N	437.240	1.243	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)/C=C\C(=O)NC3CC3)sc2C1	1819532596	DBQPNFUHSMZSRR-MVSYMCDOSA-N	426.926	1.144	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccnc2S)CC1	1823760097	DLFFSKOVHTXGDN-SFHVURJKSA-N	447.605	1.977	50	20	IDGD	
Cc1cc(CC(=O)N2CCCC[C@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)nn1C	1824301366	HPRKWWWXXKEGGF-FQEVSTJZSA-N	446.596	1.264	50	20	IDGD	
C=CCO[C@@H](C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1	1824504930	VZRCKGFTWUOMED-UWJYYQICSA-N	428.338	1.191	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H]3[C@H]4C=CS[C@H]43)sc2C1	1824662427	AVASULKNFJWWEQ-LMCLETFFSA-N	435.575	1.303	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)C(=O)c1ccccc1)CC2	1826080732	VPCDBMKJTIOROZ-AWEZNQCLSA-N	443.529	1.311	50	20	IDGD	
O=C(c1ccncc1F)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827052898	NLCPBUGNEDASOR-NRFANRHFSA-N	439.296	1.448	50	20	IDGD	
COC1(CC(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)CCC1	1827054453	FRSRTBLIDQRVID-OAQYLSRUSA-N	442.365	1.559	50	20	IDGD	
O=C1NCCn2nc(C(=O)N3CCC([C@@H]4CCCCN4C(=O)[C@H](F)Cl)CC3)cc21	1827607146	QWVHPTZAQNARDH-HOCLYGCPSA-N	425.892	1.394	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3c(C)noc3C)C2)C1	1831640617	OKCRLBRUWOHPKP-XLIONFOSSA-N	427.929	1.698	50	20	IDGD	
Cc1cccnc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1	1831835369	UUCYEJCZIARKCR-RTBURBONSA-N	430.332	1.696	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)c3ccco3)CC2)CC1	1833089626	JPEKCHBVKCHSTL-SUMWQHHRSA-N	442.354	1.668	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)CCl)CC2)CC1	1833306678	WZNAMHUVZJSJNW-IUODEOHRSA-N	438.794	1.189	50	20	IDGD	
CC[C@@H](C)[C@@H](O)C(=O)N1CCC(N2CCC(NC(=O)CCBr)CC2)CC1	1834422316	GKECPUAKRGSIMM-RDTXWAMCSA-N	432.403	1.750	50	20	IDGD	
COCCn1ccc(C(=O)N2CCC(N3CCC(NC(=O)[C@H](F)Cl)CC3)CC2)n1	1835079679	NABDXHLDAMWRGD-KRWDZBQOSA-N	429.924	1.249	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)c1n[nH]c2ccccc12	1835561270	NKIVPZGCUQZLLB-GOSISDBHSA-N	433.940	1.348	50	20	IDGD	
O=C(Cn1cnc2ccccc21)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836719160	OMZDAUMSFHVMSA-HXUWFJFHSA-N	448.951	1.635	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@H](C)CS(C)(=O)=O)CC2)CC1	1836875792	MGFBDYIBBSYJIY-RHSMWYFYSA-N	437.002	1.683	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cc(OC)nn3C)CC2)CC1	1837278600	YCNCKOJYQXINIJ-MRXNPFEDSA-N	442.944	1.295	50	20	IDGD	
C[C@@H](C(=O)N1CCC(OC2CCN(C(=O)CCBr)CC2)CC1)n1ccnn1	1837655148	UJGBBIFCJSNKEO-AWEZNQCLSA-N	442.358	1.623	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C(F)F)no3)C2)C1	1837711995	YOPBTQCDJRDDGO-SFHVURJKSA-N	447.511	1.534	50	20	IDGD	
C[C@@H](Nc1ccccc1)C(=O)N1CCOC[C@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1837715541	WDXGPWSUKMVGDV-GCJKJVERSA-N	449.624	1.795	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC(OC2CCN(C(=O)CN3CCCC3=O)CC2)CC1	1837809148	KNIRPTKVQYWTFZ-UHFFFAOYSA-N	439.629	1.459	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(Cl)ncn3)CCO2)C1	1838254862	YCJYAKFHLGRKPU-FZKQIMNGSA-N	431.320	1.608	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@H](C)N3C[C@H]4C[C@@H]4C3)CC2)CC1	1838370715	SWEOUTYVMHIALC-XLSPSMHOSA-N	442.000	1.579	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)CCc3ncc[nH]3)CC2)CC1	1838785589	IUBQGLURFBOEAE-KRWDZBQOSA-N	426.945	1.595	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3c(F)ccnc3Cl)C2)C1	1839142021	BTYNEDOBIJQLCS-KZULUSFZSA-N	434.295	1.962	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3cc(F)ccn3)C2)C1	1839142753	ZLQXIYDHAOKSDE-YLJYHZDGSA-N	427.904	1.627	50	20	IDGD	
O=C(CCC(F)(F)F)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839199480	ORNLVZWUYXSFLW-DGCLKSJQSA-N	435.212	1.476	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)ccc1O	1839309916	UZIDPNNAINPGNL-LIRRHRJNSA-N	441.322	1.554	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3nccs3)C2)C1	1839963318	HRORBUZBKUJOKV-LRDDRELGSA-N	432.340	1.387	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc(C)s3)C2)C1	1839964530	URVLXTQQRYZWNQ-DYVFJYSZSA-N	446.367	1.695	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(F)cn3C)C2)C1	1840033017	QPBJLEHHJBVSBH-SJKOYZFVSA-N	432.290	1.018	50	20	IDGD	
C[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1)n1cccc1	1840353489	KEFYJEPOWQEFSM-KEYYUXOJSA-N	432.290	1.196	50	20	IDGD	
O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CCCSC1)CCO2	1840863825	UQLYKRKYVPVSKR-WMLDXEAASA-N	435.384	1.371	50	20	IDGD	
O=C(c1cc(Br)cc2cn[nH]c12)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1	1841350895	AFRHAIIHMJKKPO-ZDUSSCGKSA-N	441.713	1.742	50	20	IDGD	
Cc1cc(C)c(OCC(=O)N2CCCC23CN(C(=O)CCC(=O)NN(C)C)C3)c(C)c1	1841531070	FQCNLTCZTQMGEH-UHFFFAOYSA-N	430.549	1.567	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)c2cc(C)nn2C)C1	1842441749	FQPIIDXFDMBSQC-UHFFFAOYSA-N	441.444	1.693	50	20	IDGD	
C[C@H](C(=O)N1CCCC12CN(C(=O)[C@H](F)Br)C2)N1CSCSC1	1844318699	DNBJSFZFAKGVOT-MNOVXSKESA-N	426.377	1.923	50	20	IDGD	
O=C(c1nc2cc([N+](=O)[O-])ccc2[nH]1)N1CC2(CCCN2C(=O)[C@H](F)Br)C1	1845219514	UCHSAJGORFOEFC-LBPRGKRZSA-N	440.229	1.979	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H]2CC[C@@H](C2)[C@@H]1C(=O)N1CCCC12CN(C(=O)[C@@H](O)CCl)C2	1846143379	YTGXTTBSBKLGNB-YHUYYLMFSA-N	441.956	1.578	50	20	IDGD	
O=C(CCc1nc(-c2ccc(F)cc2)no1)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl	1847556012	BJCVTMSNOIYHFT-JYJNAYRXSA-N	436.871	1.610	50	20	IDGD	
C[C@@H](CC(N)=O)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](Br)Cc1ccccc1	1847859264	YAZQSMMDXIPBGF-ORQFMDKSSA-N	436.350	1.706	50	20	IDGD	
Cc1oncc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1848095623	GTGAENZLCBSABD-KKUMJFAQSA-N	426.901	1.931	50	20	IDGD	
O=C(NNc1ccccc1[N+](=O)[O-])[C@@H]1C[C@H](O)CN1S(=O)(=O)c1ccc(Cl)cc1	725891070	PWWYZCDSFOFFCS-LRDDRELGSA-N	440.865	1.515	50	20	IDGD	
CNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2ccc(COc3ccccc3)o2)cc1	726269056	KVZFNGCANMQPPY-UHFFFAOYSA-N	429.454	1.842	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)N[C@@H](C)c2cc(F)ccc2N2CCN(C)CC2)n1	726279550	PXCPHZSXYAWREF-INIZCTEOSA-N	431.516	1.482	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)NCCCc1nnc2n1CCCCC2	727608022	YMDZQQNLHYHBGJ-UHFFFAOYSA-N	431.453	1.255	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)[C@H](c2ccccc2)N2CCN(C)CC2)cc1OC	727764927	VLLTZHMHGFWZNW-NRFANRHFSA-N	426.517	1.844	50	20	IDGD	
O=C(CCNC(=O)c1ccc([N+](=O)[O-])cc1)NNc1ccc(S(=O)(=O)NC2CC2)cc1	728210559	ORIVULMTWJSWIJ-UHFFFAOYSA-N	447.473	1.299	50	20	IDGD	
COc1ccc([N+](=O)[O-])c(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)c1	728216358	XPDLHZGJIYSGTL-UHFFFAOYSA-N	449.489	1.296	50	20	IDGD	
CCOCCOc1ccc(Br)cc1C=NNC(=O)[C@H](C)NS(C)(=O)=O	728434913	RMQHLQXBVHPUOA-NSHDSACASA-N	436.328	1.252	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)[C@@H]1CC(=O)N(c2ccc(F)c([N+](=O)[O-])c2)C1	729662903	ZFHARXFOGCKIPQ-CQSZACIVSA-N	439.403	1.889	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)Nc1ccc(S(=O)(=O)C[C@@H]2CCCO2)cc1	731401054	JWEAFIQAFBPAEG-HNNXBMFYSA-N	449.485	1.577	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)N1CCN(S(=O)(=O)c2cccc(Cl)c2)CC1	732195146	IHLRBWHPNRQORN-CQSZACIVSA-N	430.958	1.228	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(Cl)nc(NC)c2)c1	732257950	BBWPOSBDFLURJG-UHFFFAOYSA-N	439.925	1.882	50	20	IDGD	
CN(C)c1nc2sc(C(=O)OCC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)cc2s1	732329016	FYKNLMPHPBATHF-UHFFFAOYSA-N	449.470	1.950	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@H]2CC(c3cc(F)ccc3F)=NO2)cc(OC)c1OC	732629068	GJNMFMWGBSOYMZ-QGZVFWFLSA-N	435.383	1.945	50	20	IDGD	
CC(C)n1cc([C@@H](C)NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cn1	732892315	AULPBKSPKQLDLN-OAHLLOKOSA-N	448.549	1.954	50	20	IDGD	
Cn1c(NNC(=O)c2ccccc2NS(=O)(=O)C(F)(F)F)nc2ccccc2c1=O	733261516	QZRDIMBKLPFXQB-UHFFFAOYSA-N	441.391	1.952	50	20	IDGD	
CCOc1ccc(N2C[C@@H](C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)CC2=O)cc1	734241041	AHZKXTBGJZJHBX-AWEZNQCLSA-N	449.508	1.293	50	20	IDGD	
CCc1cc(NNC(=O)c2ccc3c(c2)[nH]c(=O)c(=O)n3CC)nc(-c2ccccn2)n1	734356911	MXJHDPAMFLMLBU-UHFFFAOYSA-N	431.456	1.881	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)c2ccc(-n3cnnc3)cc2)CC1	734826143	YTBHIHPKIFRCLO-UHFFFAOYSA-N	429.481	1.611	50	20	IDGD	
CCn1cc(CNC(=O)/C(C#N)=C\c2cn(CCC(N)=O)nc2-c2ccc(OC)cc2)cn1	735659656	SGNTXKLNSRITJW-ZDLGFXPLSA-N	447.499	1.874	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2ccc(C(=O)NNc3ccc(Cl)nn3)cc2)C[C@@H](C)O1	735688585	AZWXERPUSVAZEU-TXEJJXNPSA-N	425.898	1.685	50	20	IDGD	
O=C(N[C@H](C(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1ccccc1)OCc1ccccc1	737778105	GSCBJAFXIPBVFA-MSOLQXFVSA-N	445.497	1.236	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)[C@@H]2CCCCN2Cc2ccccc2)n1	741356210	ZHMWMIKFWJZBLQ-KRWDZBQOSA-N	430.530	1.739	50	20	IDGD	
CC(C)(C)CC(=O)Nc1ccc(Cl)c(C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)c1	741894380	HQLQMOZMACWZIP-NSHDSACASA-N	429.926	1.910	50	20	IDGD	
Cn1nnnc1-c1cccc(S(=O)(=O)NNC(=O)c2cccc(Br)c2)c1	743263325	CMMWDFHQCIGUDU-UHFFFAOYSA-N	437.279	1.263	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)c3ccc(C[C@@H]4CC(=O)NC4=O)cc3)n[nH]2)cc1	743309658	PFFOTXVGFICAPQ-QGZVFWFLSA-N	431.452	1.665	50	20	IDGD	
CS(=O)(=O)N1CCN(C(=O)NNC(=O)c2ccc(Br)cc2Cl)CC1	743588908	BRKUCACFUYJVMA-UHFFFAOYSA-N	439.719	1.034	50	20	IDGD	
O=C(NNC(=O)c1cccc(Br)c1)Nc1cccc(N2C(=O)CNC2=O)c1	743814340	DNIQOZNIOVNZTD-UHFFFAOYSA-N	432.234	1.972	50	20	IDGD	
CNC(=O)COc1ccc(C(=O)NNC(=O)Nc2ccc(OC(F)F)cc2)cc1OC	743831871	GRUBIZXGAZLAEV-UHFFFAOYSA-N	438.387	1.888	50	20	IDGD	
C[C@H](c1ccc(F)cc1F)N1CCN(CC(=O)NNC(=O)c2cccc(C#N)c2)CC1	744398774	PSBDODBIZJHQSL-OAHLLOKOSA-N	427.455	1.976	50	20	IDGD	
Cc1noc(-c2ccccc2C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)n1	744619682	VLXMXADWMHVVNT-UHFFFAOYSA-N	443.485	1.823	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1cccc(-n2cccn2)n1	744620662	JMXMXQWHUOOFCB-UHFFFAOYSA-N	428.474	1.045	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)c1	745093300	KDKYBIMHAHEJIE-LJQANCHMSA-N	438.459	1.914	50	20	IDGD	
Nc1ccc(C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1Br	745465083	UPAYQXZMMZELPW-UHFFFAOYSA-N	437.206	1.558	50	20	IDGD	
COc1cc(C=NNC(=O)[C@@H](C)CN2C[C@H](C)O[C@H](C)C2)cc(Cl)c1OCC(N)=O	745986566	LHQIKEKCTVVOHU-MELADBBJSA-N	440.928	1.408	50	20	IDGD	
O=C(NNC(=O)c1ccc(F)c(S(=O)(=O)Cc2ncon2)c1)c1ccc(Cl)nc1	746128224	ADJDHFBXRXIQPZ-UHFFFAOYSA-N	439.812	1.306	50	20	IDGD	
CN(C)[C@H](CNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)c1ccc(Cl)cc1	746776069	BMIDIXYCYPZUBD-GOSISDBHSA-N	445.955	1.980	50	20	IDGD	
COc1cc(OC)cc(N2CC[C@H](NC(=O)NNC(=O)COc3ccc(F)cc3)C2)c1	748660366	GREDMARNXLPQHU-HNNXBMFYSA-N	432.452	1.831	50	20	IDGD	
Cc1c(C(=O)Oc2ccc([N+](=O)[O-])cc2Br)cnc2c1c(=O)n(C)c(=O)n2C	748847432	VSXXSRMXWNGQFF-UHFFFAOYSA-N	449.217	1.831	50	20	IDGD	
O=C(NCCC1CCN(CC(F)(F)F)CC1)NNC(=O)c1ccc(-n2cnnn2)cc1	748967382	NWLUNIXESDDXMK-UHFFFAOYSA-N	440.430	1.271	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)C2(c3ccccc3)CCC2)CC1	749535747	DEKFWVKFLZGEPB-UHFFFAOYSA-N	429.546	1.583	50	20	IDGD	
Cc1nn(-c2cncc3nnnn23)c(C)c1CC(=O)NNC(=O)c1cc2ccccc2o1	749856350	FTXHQCNVZOJHLW-UHFFFAOYSA-N	431.416	1.072	50	20	IDGD	
O=C(O)CCC(=O)c1ccc(S(=O)(=O)NNC(=O)c2ccc(Cl)cc2O)cc1	751210214	CYTRZEGVYSMEHA-UHFFFAOYSA-N	426.834	1.716	50	20	IDGD	
COC(=O)COc1c(C)cc(C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1C	752290428	SYIKCYWAWZVCSS-UHFFFAOYSA-N	434.470	1.334	50	20	IDGD	
O=C(NN=C1CCCC[C@H](N2C(=O)c3ccccc3C2=O)C1)N[C@H]1CCS(=O)(=O)C1	752728253	YFTYWRXIXJRGIZ-GJZGRUSLSA-N	432.502	1.458	50	20	IDGD	
C#CC(=O)NNC(=O)COc1c(I)cc(Cl)c2cccnc12	753891732	QAPZHVSUFMCJJZ-UHFFFAOYSA-N	429.601	1.652	50	20	IDGD	
O=C(NNC(=O)c1cccc(OC(F)F)c1)NC1CCN(S(=O)(=O)C2CC2)CC1	753903927	DEZBLPLZNLIDAY-UHFFFAOYSA-N	432.449	1.189	50	20	IDGD	
CC(C)C[C@H](C)OCCC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	755038101	ZZFYXGOQIZHFRQ-INIZCTEOSA-N	441.550	1.310	50	20	IDGD	
COC(=O)CCc1ccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1	756432911	LBGAYINZHCAQIG-UHFFFAOYSA-N	448.501	1.509	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)Nc2cc(F)cc(S(N)(=O)=O)c2)o1	756517852	ZUXXCOIBQCFVRP-UHFFFAOYSA-N	427.458	1.374	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)c2cccc(Br)c2)cc1S(N)(=O)=O	756637948	MUTABINZTJCMLS-UHFFFAOYSA-N	427.280	1.871	50	20	IDGD	
Cc1cc(COc2ccc(C(=O)NNc3ccc(C(N)=O)nn3)cc2Br)on1	757404982	WBUNCFVCEYWFRT-UHFFFAOYSA-N	447.249	1.970	50	20	IDGD	
CC[C@@H](C)NS(=O)(=O)c1cccc(NC(=O)NNC(=O)c2ccc3c(c2)OCO3)c1	757710985	NUDHDDVJKONTCN-GFCCVEGCSA-N	434.474	1.959	50	20	IDGD	
Cc1ccc(-n2cc(C(=O)NNC(=O)N[C@H]3CCS(=O)(=O)C3)c(C(C)(C)C)n2)cc1	758446455	PZWVPFKPGVEHTI-AWEZNQCLSA-N	433.534	1.609	50	20	IDGD	
O=C(Cc1ccccc1OC(F)F)N1CCN(S(=O)(=O)CBr)CC1	758511633	CKZHQDNGWFKJDF-UHFFFAOYSA-N	427.267	1.657	50	20	IDGD	
CN(CC(=O)N1CCN(S(=O)(=O)CBr)CC1)c1nc2ccccc2s1	758516659	FECLPTGFHIAROD-UHFFFAOYSA-N	447.380	1.559	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)c2ccc(S(=O)(=O)NC[C@H]3CCCO3)cc2)nc1	759734714	OPVYPNIQRYXHQO-OAHLLOKOSA-N	434.474	1.082	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)N=c1cc[nH]cc1I	760035334	UVGSPFQNKXRBBF-VIFPVBQESA-N	444.204	1.867	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)CS[C@@H](C)C(=O)Nc1cc(C)on1	761618472	FGDTZLKDAGGGHM-LBPRGKRZSA-N	438.531	1.992	50	20	IDGD	
Cc1c(/C=C(\C#N)C(=O)NC[C@@H](O)COc2ccc3c(c2)CCC(=O)N3)cc(C#N)n1C	762368079	IBUSRZMKDVEAQR-BKMCDNFVSA-N	433.468	1.553	50	20	IDGD	
CC(C)(C(=O)NNC(=O)c1csc(N2CCOCC2)n1)c1ccc([N+](=O)[O-])cc1F	762550432	AIKUBYRINORRBF-UHFFFAOYSA-N	437.453	1.766	50	20	IDGD	
COc1ccc(C[C@H](C)CNC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1OC	762656106	RKVAZFZHVHNRBL-AWEZNQCLSA-N	449.529	1.930	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)NC[C@H]1CCN(C)[C@@H]1c1ccc(Cl)c(F)c1	763090267	BDNMPOTUGUUDSQ-SUYBPPKGSA-N	430.908	1.854	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CNc2ccc(C)cc2)nc1I	763273389	MAGCYGGCSCXBTD-UHFFFAOYSA-N	440.241	1.876	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(Br)cc1F	763445412	HEEXTFGNFHREIF-UHFFFAOYSA-N	425.170	1.896	50	20	IDGD	
Cc1cc(N2CCSCC2)ccc1NC(=O)C(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	763447137	ZEROUJYQNVNSNM-UHFFFAOYSA-N	443.485	1.856	50	20	IDGD	
CNC(=O)c1ccc(C)c(NC(=O)C(=O)NNC(=O)COc2ccc(C(C)(C)C)cc2)c1	763596303	VGJKUQYPTSAHTH-UHFFFAOYSA-N	440.500	1.817	50	20	IDGD	
CC(C)(C)c1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(-n3cnnn3)cc2)cc1	763600044	MDXDTEHZQSCDTK-UHFFFAOYSA-N	437.460	1.125	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1ccc(-n2cncn2)c(Cl)c1	763628300	INMVZBVQXGUQOL-UHFFFAOYSA-N	438.835	1.277	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)C(=O)Nc1cnn(Cc2ccccc2)c1	763802862	BISUPUHFFUVRSI-UHFFFAOYSA-N	438.400	1.005	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(Br)ccc1F	763807722	QQYYVJOUBNUAKD-UHFFFAOYSA-N	435.209	1.625	50	20	IDGD	
COc1ccc(-c2noc(CCCC(=O)NNC(=O)CNC(=O)c3cccnc3)n2)cc1	763824817	ROHOKPZEEMPWAY-UHFFFAOYSA-N	438.444	1.040	50	20	IDGD	
CCOC(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)c1	763841395	QXOXWMDMQFOIEG-MRXNPFEDSA-N	441.484	1.962	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cccc(C(=O)N(C)C)c2)c1C	763847529	CKRQVKJWNASWJD-OAHLLOKOSA-N	426.473	1.559	50	20	IDGD	
CC(=O)N1CCc2cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc3cccc(C)c3C)ccc21	763848536	ITQACDRVCPUAJE-OAHLLOKOSA-N	438.484	1.766	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1c(F)cccc1-n1cccn1	763865069	HWWUXEXJENTKNI-GFCCVEGCSA-N	429.383	1.704	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)OC(F)(F)O2	763866648	QOHKNESBKFDASX-VIFPVBQESA-N	425.319	1.701	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2c(C)cnn2[C@H]2CCCc3ccccc32)n1	763883144	YMAFTQKQJFFCOH-IBGZPJMESA-N	449.515	1.717	50	20	IDGD	
CC(C)CC(=O)NNC(=O)C(=O)Nc1ccc(S(=O)(=O)N(C)C2CCCCC2)cc1	763887879	FIGQVJMRWIFZCS-UHFFFAOYSA-N	438.550	1.772	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)C(=O)Nc2ccc3c(c2)C(=O)N(C)CC3)cc1	763897677	BDYVGMJDXJMOLF-UHFFFAOYSA-N	426.498	1.501	50	20	IDGD	
CCNC(=O)c1ccc(C)c(NC(=O)C(=O)NNC(=O)c2ccc(OCC)c(OC)c2)c1	763900127	FYYXIMXDLRFKPI-UHFFFAOYSA-N	442.472	1.552	50	20	IDGD	
COC(=O)c1ccc(F)c(NC(=O)C(=O)NNC(=O)c2ccc(Br)s2)c1	763939199	LRNGFGGDJRZBIF-UHFFFAOYSA-N	444.238	1.836	50	20	IDGD	
COC(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CC[C@H](C)C3)c1	763940944	VJXNACCGCXLOIG-LBPRGKRZSA-N	429.498	1.988	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)C(=O)Nc1ccc(C(=O)NC2CC2)cc1	763995843	RICWUKMCQRJZAK-UHFFFAOYSA-N	434.250	1.069	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cc(Br)cn2C)nn1[C@H](C)C1CC1	764005128	VEOWLZMMZSOAMP-SNVBAGLBSA-N	437.298	1.663	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccc(-n2cnc3ccccc32)nc1	764133504	VPGZKHMUHCSCKW-UHFFFAOYSA-N	444.451	1.758	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1c2c(nn1-c1ccccc1)CCC2	764138315	BLBLKDIEZXDZAZ-UHFFFAOYSA-N	433.468	1.698	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)ccc1-n1nnnc1C(C)C	764152888	HLIMOSCDGDFOEM-SFHVURJKSA-N	449.471	1.184	50	20	IDGD	
CCc1noc(-c2ccc(C)c(NC(=O)C(=O)NNC(=O)[C@H]3Cc4ccccc4O3)c2)n1	764162996	GTNJLOXBWPWBJN-QGZVFWFLSA-N	435.440	1.697	50	20	IDGD	
Cc1nnc(-c2ccccc2C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)o1	764397198	VXWHMEXXSYOXIR-UHFFFAOYSA-N	429.458	1.370	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)c1ccc(S(=O)(=O)C(F)F)cc1	765317780	TWMLNPITVRQQGC-UHFFFAOYSA-N	435.449	1.749	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C2CCN(S(=O)(=O)c3ccc4c(c3)CCC4)CC2)n[nH]1	765580884	GXHQQZJMOUKTNT-UHFFFAOYSA-N	431.518	1.069	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3cccc(-n4cnnn4)c3)n[nH]2)cc1OC	765599789	QGRJPCQECCKUKY-UHFFFAOYSA-N	434.416	1.144	50	20	IDGD	
CC(C)n1ccc(CC(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)n1	766659912	JBRDKNPRNCLXEA-UHFFFAOYSA-N	432.956	1.625	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)CCC(=O)c1ccc2c(c1)OCCO2	767236033	FSNCWLBHVMIXBV-UHFFFAOYSA-N	440.452	1.662	50	20	IDGD	
C[C@H](C(=O)NNc1ccccc1S(=O)(=O)NC(C)(C)C)S(=O)(=O)C1CCOCC1	768064744	QRROVJVPESEIAQ-CYBMUJFWSA-N	447.579	1.189	50	20	IDGD	
C[C@]1(c2cccc(C(=O)NNC(=O)c3cccc(Br)c3)c2)NC(=O)NC1=O	769147919	UBTHGZSUDOQAEF-GOSISDBHSA-N	431.246	1.579	50	20	IDGD	
CCNC(=O)N(C)NC(=O)c1ccc(NC(=O)C[C@H]2SC(N3CCCC3)=NC2=O)cc1	770548232	DDIMZQHEUHLNNI-OAHLLOKOSA-N	446.533	1.415	50	20	IDGD	
C[C@@H]1Oc2ccccc2N(CCC(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)C1=O	770957808	FRTTUALELRBNMG-LBPRGKRZSA-N	439.476	1.934	50	20	IDGD	
Cc1nc(-c2ccccn2)nc(NNC(=O)c2ccc(S(=O)(=O)N(C)C)nc2)c1C	771734436	DJDPFLAYCAIKQL-UHFFFAOYSA-N	427.490	1.558	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1cc(S(=O)(=O)Nc2ccccc2F)c[nH]1	772014934	DJGZBVQPJJEHTC-SNVBAGLBSA-N	426.426	1.057	50	20	IDGD	
Cc1ccn(CC(=O)NNC(=O)[C@H]2Cc3ccccc3CN2Cc2ccccc2)c(=O)c1	772155373	JYOORPGIBVKBNI-JOCHJYFZSA-N	430.508	1.931	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)[C@@](C)(O)CN1Cc2ccccc2C1=O	772968108	CHELTAPWLNMADH-ASSNKEHSSA-N	431.876	1.662	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C(=O)Nc2ccc(Br)cn2)nc2ccccc21	773612967	MXAFZUFSPSNZMU-UHFFFAOYSA-N	431.250	1.059	50	20	IDGD	
O=C(NNc1ncc(Cl)cc1Cl)C(=O)Nc1cccc(CN2C(=O)CNC2=O)c1	773682013	CCOWFXCEVQVIDR-UHFFFAOYSA-N	437.243	1.522	50	20	IDGD	
CCOC(=O)Cn1cccc(NC(=O)C(=O)NNc2ccc(C(F)(F)F)cc2)c1=O	773768017	APXAIJPNHUFJNE-UHFFFAOYSA-N	426.351	1.512	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(F)cc2CS(C)(=O)=O)cc1F	773889157	PPULODADXSUTTA-UHFFFAOYSA-N	425.413	1.218	50	20	IDGD	
Cc1cc(=O)c(C(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)cn1C	774326200	AUSQSHUZWMMPQO-UHFFFAOYSA-N	443.467	1.470	50	20	IDGD	
CSc1nc2nc(C)c(CC(=O)NNC(=O)CCNC(=O)OC(C)(C)C)c(C)n2n1	780970470	COLONRRKVVWXDF-UHFFFAOYSA-N	437.526	1.068	50	20	IDGD	
CC[C@@H](C)n1ncc(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)c1C1CC1	782892585	DSRUHXLEHWXKPD-CYBMUJFWSA-N	437.504	1.947	50	20	IDGD	
N#C[C@H](c1ccccc1)c1ccc(NC(=O)C(=O)NNC(=O)C(=O)NC2CC2)cc1Cl	782966628	PEAORCICHIBRRB-MRXNPFEDSA-N	439.859	1.360	50	20	IDGD	
O=C(NN=c1cc[nH]cc1)C(=O)Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1	783377052	XKXDPTSHIVHPSJ-UHFFFAOYSA-N	444.539	1.950	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccc(Cl)nn2)cc1	784791795	AXWIEPPPPSYKSS-UHFFFAOYSA-N	426.886	1.242	50	20	IDGD	
O=C(NNc1cccnc1Cl)C(=O)Nc1cccc(S(=O)(=O)N2CCCCC2)c1	784842119	KHKSHCZLEJNTHK-UHFFFAOYSA-N	437.909	1.991	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@]2(O)CCc3ccccc3C2)c1	785671141	XFPACCVMXGPLQZ-JOCHJYFZSA-N	445.541	1.398	50	20	IDGD	
Cc1nnnn1[C@H](Cc1ccccc1)C(=O)OCC(=O)NNC(=O)c1ccc(Cl)cc1	786126077	AVOGMHFFZRRQDN-QGZVFWFLSA-N	442.863	1.423	50	20	IDGD	
COCCOc1ccc(F)cc1S(=O)(=O)NNC(=O)c1cc(Br)c[nH]1	786725470	VTHCQQDHQWCZFW-UHFFFAOYSA-N	436.259	1.565	50	20	IDGD	
O=C(NNc1ccc(-n2cccn2)nn1)N[C@@H]1CCCN(Cc2ccc(F)cc2F)C1=O	786973198	OVOYAOLSXXMLTP-MRXNPFEDSA-N	442.430	1.758	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1ccc2c(c1)CC(=O)N2C	789740561	WOBAXWKEZFTFKH-UHFFFAOYSA-N	428.470	1.092	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2csc(N3CCOCC3)n2)ccc1Cl	789749298	MUZBNPGYPPWYCT-UHFFFAOYSA-N	439.881	1.041	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNS(=O)(=O)c2cc(Cl)ccc2F)ccc1Cl	790045416	OOSIFACYAFMDEJ-UHFFFAOYSA-N	442.277	1.403	50	20	IDGD	
Cn1nccc1[C@@H]1CCCC(=NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)C1	790281381	HAOHFIRUVOQOJJ-MRXNPFEDSA-N	445.545	1.885	50	20	IDGD	
NS(=O)(=O)c1ccc2c(c1)oc(=O)n2CC(=O)NNc1cc(Cl)cc(Cl)c1	791734751	WCWUQVPXUUZIFK-UHFFFAOYSA-N	431.257	1.692	50	20	IDGD	
Cc1cccnc1NNC(=O)Nc1cc(S(=O)(=O)N(C)C)ccc1N1CCOCC1	792345656	YQPZTQNIRMSJGC-UHFFFAOYSA-N	434.522	1.626	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N2CCn3cncc3C2)cc1	793504345	MLTHVLVDGYGDPK-YVLHZVERSA-N	445.483	1.580	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN[C@@H](CO)c2ccc(Br)c(F)c2)n1	795351521	XLIBOCUZGMOTIF-ZDUSSCGKSA-N	445.314	1.366	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNC(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl	797369663	CZTSEMYNEBVONQ-UHFFFAOYSA-N	449.807	1.261	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)Cc1ccc([S@](C)=O)cc1	797924640	YRLQZNMEXGLMBL-LJAQVGFWSA-N	438.889	1.633	50	20	IDGD	
CCCCNS(=O)(=O)c1ccc(C)c(NC(=O)C(=O)NNC(=O)c2ccccc2)c1	799835220	XUEOLNYRAOUSSV-UHFFFAOYSA-N	432.502	1.473	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2O1)C(=O)Nc1ccc(OCC(F)(F)F)c(F)c1	800623609	SFTQBEAQBNIRTO-HNNXBMFYSA-N	441.337	1.856	50	20	IDGD	
C[C@H](CCNS(=O)(=O)c1ccccc1)NC(=O)NNC(=O)Cn1ccc2ccccc21	801749729	RBKWGQLVLIEIOA-MRXNPFEDSA-N	443.529	1.729	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)CCNC(=O)[C@H]2CCCN2C(=O)OC(C)(C)C)cc1	802059385	ZIQAYESUWPAKOG-MRXNPFEDSA-N	449.508	1.754	50	20	IDGD	
CCn1cc(-c2nn(C)cc2C(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)cn1	802063594	LRDPCGREKXWVSY-UHFFFAOYSA-N	431.478	1.174	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N(C)[C@@H]2CCCOC2)cc1	804287795	OYASXOUCJXOVPK-XYSGSMRZSA-N	437.500	1.978	50	20	IDGD	
COCCCOc1ccc(NC(=O)C(=O)NNC(=O)c2c[nH]c3ccccc23)cc1OC	806972721	IQWRGBIWIPUGSW-UHFFFAOYSA-N	440.456	1.992	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)NC[C@@H](N1CCOCC1)C(F)(F)F	807540435	UTGCEBXRVZIKBY-CQSZACIVSA-N	436.456	1.381	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C2(S(=O)(=O)c3ccccc3)CCOCC2)cc1OC	807930754	XVVXISCDVYKWJE-UHFFFAOYSA-N	448.497	1.488	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)C2(c3cccnc3)CCCC2)cc1OC	808565787	XFNLROYUOIPWGM-UHFFFAOYSA-N	427.457	1.915	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)[C@H]2C[C@H](c3ccccc3)OC2=O)c2ccccc2c1=O	809545728	IETYNPNUZIOCSY-QZTJIDSGSA-N	434.452	1.872	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2CCN(c3ccccc3F)C2)c1	809940510	LFBWXIKJQWPUGE-OAHLLOKOSA-N	434.493	1.364	50	20	IDGD	
Cc1ncc2n1CC[C@@H](C(=O)NNC(=O)CN1CCN(Cc3ccccc3Cl)CC1)C2	810594235	YAAJTXSWKKNZSS-QGZVFWFLSA-N	444.967	1.373	50	20	IDGD	
Cc1cnc(Br)c(NC(=O)C(=O)NNC(=O)COc2ccc(C)c(C)c2)c1	812980569	WTGCDOKDQKYMRF-UHFFFAOYSA-N	435.278	1.934	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)C(=O)Nc1ccn(-c2ccc(Br)cc2)n1	815570069	PUBWTIMLKLZKJM-UHFFFAOYSA-N	443.261	1.358	50	20	IDGD	
Cc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NNc1ccccc1S(=O)(=O)N(C)C	815751906	UFEYZFCNSCSYKN-UHFFFAOYSA-N	447.517	1.029	50	20	IDGD	
CCOC(=O)Cc1cccc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)N(C)C)c1	815752292	MGQQKTZIKPLVHR-UHFFFAOYSA-N	448.501	1.124	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)[C@H]2CCCS(=O)(=O)C2)c2ccccc2c1=O	816828305	ABDXWZZLXNNSJT-AWEZNQCLSA-N	434.518	1.173	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)[C@H]1CC(=O)N(c2cc(Cl)ccc2OC)C1	825624067	DJJNIEQOJVLRIT-ZDUSSCGKSA-N	446.891	1.970	50	20	IDGD	
CC[C@@H](C)[C@@H](C(=O)OCC(=O)NNC(=O)c1ccccc1)N1C(=O)c2ccccc2C1=O	844204246	MQQUXLPUAWXCHA-KUHUBIRLSA-N	437.452	1.702	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)c1cccc(N2C(=O)CCC2=O)c1	856534999	KLVSIBVFPFHZLI-UHFFFAOYSA-N	449.511	1.313	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)Cc2ccc(S(=O)(=O)N3CCCCC3)cc2)cc1	901365825	ROCPPICYHFSRJM-UHFFFAOYSA-N	445.541	1.939	50	20	IDGD	
CSC[C@H](C(=O)NNC(=O)COc1ccc(F)cc1)N1C(=O)[C@@H]2CCCC[C@H]2C1=O	910865615	WYNGJOISGFUNCR-BZUAXINKSA-N	437.493	1.259	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)N1CCN(CC(=O)N2CCCC[C@@H]2C)CC1	913462920	IMQKALVCNQIINM-INIZCTEOSA-N	441.536	1.016	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)CNC(=O)c2ccncc2)c2ccccc2c1=O	914831985	ZJWGQXHVRKDRGS-UHFFFAOYSA-N	436.472	1.173	50	20	IDGD	
O=C(COc1ccc(OCc2ccccc2)cc1)NNC(=O)NCCN1CCOCC1	915884981	YGRFEQLWVJUFML-UHFFFAOYSA-N	428.489	1.307	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NC[C@@H](c2ccc(F)cc2)N2CCOCC2)cc1	915898378	VZQDMDNCNQFEHZ-FQEVSTJZSA-N	430.480	1.917	50	20	IDGD	
COc1cc(OC)c(C=NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)c(OC)c1	916337660	GKCTYYNCSGGFAP-UHFFFAOYSA-N	427.866	1.777	50	20	IDGD	
COc1cc(C=NNC(=O)CN2c3cccc4cccc(c34)S2(=O)=O)cc(O)c1O	916367407	BCRXCAUXEVJGND-UHFFFAOYSA-N	427.438	1.919	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)COCc3ccccc3)CC2)cc1	916558354	LYXUAPIZRREZSB-UHFFFAOYSA-N	445.541	1.760	50	20	IDGD	
Cc1nc(N2CCOCC2)nc(O)c1CCC(=O)NNc1ccc(Cl)cc1[N+](=O)[O-]	917213968	DOIIZJDOFTWNJE-UHFFFAOYSA-N	436.856	1.965	50	20	IDGD	
CC(C)(C)NS(=O)(=O)CCNC(=O)NNC(=O)c1ccc(F)cc1Br	918211389	MMOVDJNRPVUKSR-UHFFFAOYSA-N	439.307	1.250	50	20	IDGD	
COc1ccc(CNC(=O)NNC(=O)c2nnc(O)c3ccccc23)c(OC)c1OC	918227595	VLEKZQPZOQCQQT-UHFFFAOYSA-N	427.417	1.505	50	20	IDGD	
CS(=O)(=O)Nc1cccc2c1CCN(CC(=O)NNC(=O)c1ccccc1Cl)C2	918740895	ZQGALXGAZJFMPC-UHFFFAOYSA-N	436.921	1.531	50	20	IDGD	
O=C(COC(=O)CCn1cc(Br)cn1)NNC(=O)c1ccc(Cl)cc1	919572736	COHXBJWHEBRTAB-UHFFFAOYSA-N	429.658	1.694	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)[C@@H]2CCCCN2S(=O)(=O)c2ccccc2)c1O	919756658	GWTANPFDKZBOBV-INIZCTEOSA-N	433.486	1.405	50	20	IDGD	
C[C@H]1CCCN(C[C@H](C)NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)C1	919915457	VGCJSAAGWCRWLC-GJZGRUSLSA-N	425.555	1.001	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCc2ccc(-n3ccnc3)c(F)c2)nc1	920239594	JTHYWDZPOYDRTQ-UHFFFAOYSA-N	447.496	1.919	50	20	IDGD	
CNC(=O)NNC(=O)c1ccccc1SCC(=O)NCCc1ccc(OC)c(OC)c1	920746293	VTIZDKKVDPGYNF-UHFFFAOYSA-N	446.529	1.729	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)Nc2cccc(CN3CCC[C@H]3C(N)=O)c2)c1	920930996	ZYOYJGBKUIMQJC-IBGZPJMESA-N	439.516	1.985	50	20	IDGD	
O=C(NNc1ccc(Br)cc1)C1=NN([C@H]2CCS(=O)(=O)C2)C(=O)CC1	932509234	JFUQVUICTRSEQB-LBPRGKRZSA-N	429.296	1.058	50	20	IDGD	
Cn1ccc(NNC(=O)c2cc(S(=O)(=O)N3CCOCC3)c(Cl)cc2Cl)n1	1116838143	WZZQDYGFYHHZOS-UHFFFAOYSA-N	434.305	1.505	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)NCCc2nc(Cc3ccccc3)no2)nc2ccccc21	1123642238	LMWZNEHIZWUGIV-UHFFFAOYSA-N	433.472	1.663	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(N2CCCS2(=O)=O)cc1)c1ccccc1Cl	1318185740	WZBRCWYGJHHEIZ-UHFFFAOYSA-N	429.907	1.503	50	20	IDGD	
CCCc1nnc(S)n1CC(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1	1318621289	MISDIUFWSZVAJA-UHFFFAOYSA-N	426.543	1.314	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)NC1CCN(c2cccc(F)c2)CC1	1318754184	FMRIUZBBWDPEQN-UHFFFAOYSA-N	448.524	1.732	50	20	IDGD	
Cc1nn([C@H]2CCS(=O)(=O)C2)c2nc(C3CC3)cc(C(=O)NNc3ncc(F)cn3)c12	1319577129	PXMFPRQFLFQLBP-ZDUSSCGKSA-N	445.480	1.663	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(=O)nc3sccn13)C2)[C@H](F)Cl	1778031243	SXFPHHAKHDXPAV-UVBSCNOISA-N	442.900	1.418	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(CCN(C(=O)c3nc(O)n4c3CCCC4)C2)C1	1779346198	HWDZAZJDPUFCIZ-SFHVURJKSA-N	441.326	1.154	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnc(N)s1)C2	1779543718	OBHDJCFQFBHACQ-RDTXWAMCSA-N	426.615	1.704	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Cl)C2)c1ccc(-n2cccn2)nc1	1779813465	HSNBHPFNBDTPER-WRWLIDTKSA-N	435.887	1.929	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)ccc1Br	1780869343	NQLRXXLWUOWHBC-MAUKXSAKSA-N	445.741	1.801	50	20	IDGD	
CCc1cc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](C)Br)C2)nn1C	1781998400	ZVDMKSFDMUUBDQ-VVFCZOMOSA-N	441.370	1.893	50	20	IDGD	
N#Cc1cc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)cc(C(F)(F)F)c1	1782031024	QOEWCNAVVDOHRP-YJBOKZPZSA-N	445.825	1.620	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc3nncn3c1)C2	1782175013	AIOUGAXBAQCCLE-RZQQEMMASA-N	435.912	1.111	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)Nc1cnccn1)C2	1782176024	URUPTVSLWHMHGO-QCBUCWTNSA-N	439.944	1.045	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)COc1ccccc1C#N)C2	1782178962	RBLXWODZJLIMAR-LRXVAGHRSA-N	449.935	1.705	50	20	IDGD	
COCCOCC(=O)N1CCO[C@]2(CCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1	1782864070	FVKKKOXLENXNRZ-IHSQGBLNSA-N	449.454	1.365	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3c(O)cc(O)cc3O)CCO2)C1	1783535744	BTZXSFQRPGOVGZ-QGHHPUGFSA-N	429.267	1.030	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc([N+](=O)[O-])cc3F)CCO2)C1	1783881337	RPBXTRUDMYJKCC-RDTXWAMCSA-N	429.832	1.431	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C=C/C3CC3)[C@H]2C1	1784128469	DFZTVCNNOYZKDV-RKKLMNDLSA-N	427.505	1.066	50	20	IDGD	
CC1CCN(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]32)CC1	1784320188	JYEJRKFFBNVZIN-BOSXTWCSSA-N	434.408	1.934	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc(OCF)cn3)C[C@@H]21	1784615893	CKLZXOPUFSGUEB-YXWQFLTLSA-N	428.892	1.783	50	20	IDGD	
CCC(=O)N[C@H](C)C(=O)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1	1786294218	SVQGBVMPOFLXLC-OAHLLOKOSA-N	437.305	1.029	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)c1ccncc1C(F)(F)F	1787659718	LXCPUTZZIDYSFU-FATJJJSSSA-N	435.830	1.293	50	20	IDGD	
C[C@H](Sc1cccs1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21	1788483443	ZISZPXPIYIMUMH-LXFSFDBISA-N	432.995	1.808	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]3C2)c(O)c1	1788763313	IXGYLUPZWDXKJO-FNHZYXHNSA-N	436.581	1.846	50	20	IDGD	
COCc1c[nH]c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)CBr)C[C@@H]32)c1	1789208358	YXELXKQCDRMGQJ-DYWXZXKOSA-N	442.354	1.785	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1ccc(C2(NC(=O)[C@@H](O)c3ccco3)CCC2)cc1	1789519956	TYXNBUQDDLONDS-IBGZPJMESA-N	449.467	1.759	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21	1789871777	FJNXJDJTBZTJPA-MOUCOTEISA-N	434.133	1.893	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=N/O[C@@H]3CCCCO3)C[C@@H]21	1791055693	DZZMDROXROMNRB-HOQDUREWSA-N	446.342	1.279	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4nc(C)ccc4o3)C[C@@H]21	1791254775	ROVHYLIWMOICSJ-XLPNERPQSA-N	435.908	1.983	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(=O)c1ccc(Cl)cc1	1792948823	ZOPMXBWMAVWKML-XRGAULLZSA-N	429.300	1.366	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](C)Cn1cccn1	1794494960	HFCGCZKLXFVQAV-CZRLGECOSA-N	439.520	1.291	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnnc(Cl)c1	1794501455	YYKBPSUFABDNGK-WCDSHICPSA-N	443.895	1.516	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cncn1-c1ccncc1)C2	1795112417	GIQVJUYZLSEQPZ-ZSBFGKGUSA-N	448.321	1.256	50	20	IDGD	
N#Cc1ccccc1OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCBr	1795117500	YFRWCHNRPWIBMO-CCWDJLKJSA-N	436.306	1.312	50	20	IDGD	
C[C@@H](CN)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](Br)Cc1ccccc1)C2	1795514556	DREJJLMTZCVQDL-JFMONLCZSA-N	438.366	1.177	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1cc(C(F)F)no1	1795916104	BNHCWUDHYWWVRQ-SSDHTEECSA-N	426.189	1.506	50	20	IDGD	
C[C@H](Nc1ccccn1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2	1797977569	HSPLLXQYDLBWRA-QIRZIZBZSA-N	429.290	1.162	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(OC)c(OC)cc1C	1799706282	IOJSAKNMGRBXOK-QHHYFVSCSA-N	440.924	1.469	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)c1ccc2c(Cl)ccnc2c1	1799886421	LXZOPTSIFHAXIM-JGTCGTHISA-N	438.311	1.691	50	20	IDGD	
Cc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Br)C3)cc2c[nH]nc12	1799919806	TVKXFZKPJBYJJD-OCVGTWLNSA-N	439.285	1.765	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccnc3c(O)cccc13)C2	1800979767	ZYLVQWJZPYWMEO-ZDFLXESQSA-N	433.892	1.397	50	20	IDGD	
CCOCCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1801493975	FQTLVWAIXNSYSC-IVSAIRAKSA-N	447.960	1.135	50	20	IDGD	
COC[C@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1c(Br)cnn1C)C2	1802274247	WFBAUFGTIANUFM-NOHGZBONSA-N	433.734	1.688	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H]1CC(c3ccccc3)=NO1)C2	1802334990	VEITVFMFTXDPDJ-DMUMMCEESA-N	441.532	1.191	50	20	IDGD	
C[C@H](NNc1ccccc1)C(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]1c1cccnc1	1803138096	WJBFIPGPQVLNNY-JQERWDHBSA-N	445.951	1.692	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cc[nH]c3nccc2-3)[C@@H]1c1cccnc1)[C@H](O)CCl	1803138512	BOPMQKCQRGNFKF-BMGDILEWSA-N	427.892	1.829	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(F)cc(F)c1F	1803695937	XXOLBGIMOQTWGU-BTTYYORXSA-N	426.439	1.729	50	20	IDGD	
Cn1ncnc1C(=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@H]1c1cccnc1	1805280412	ZEGYDTYAXAHBKK-RWMBFGLXSA-N	425.262	1.220	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)c2ncnn2C)[C@H]1c1cccnc1	1805281131	GKMMFVFILTUBHV-SOUVJXGZSA-N	435.326	1.703	50	20	IDGD	
O=C([C@H](O)CCl)N1CCCC2(CCN(C(=O)[C@@H]3CC(=O)N(C4CCCC4)C3)CC2)C1	1805517398	HARBSGVTFMWQGW-SJLPKXTDSA-N	439.984	1.608	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC2(CCCN(C(=O)C[C@H]3CCCCO3)C2)CC1	1806596347	XGLWCBMGLXNCBK-QGZVFWFLSA-N	443.548	1.489	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)c1nccc2[nH]ccc12	1808087228	RXAGUFWPKCGXED-FNHZYXHNSA-N	427.892	1.877	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H]2[C@H]3COC[C@H]32)[C@@H]1c1cccnc1)[C@H](F)Br	1808680033	GOLMOTZNVVARPR-IJOLSIAMSA-N	426.286	1.670	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H](CNC(=O)[C@H](F)Br)[C@H]1c1cccnc1)n1cnnn1	1808681496	UNTHHFVOXYEJDQ-ZRJCITRHSA-N	440.277	1.026	50	20	IDGD	
O=C(CCN1CCOC1=O)NC[C@@H]1CCN(C(=O)C(Cl)Cl)[C@@H]1c1cccnc1	1809532082	JTLQCEXXDOLSAY-DZGCQCFKSA-N	429.304	1.733	50	20	IDGD	
Cc1ccc(F)cc1C(=O)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1	1809978000	QZXRSIXUWMQQRO-UHFFFAOYSA-N	438.308	1.973	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)c2ccccn2)[C@@H]1c1cccnc1	1810297695	CTDXNWQLWLAUSW-OXQOHEQNSA-N	445.483	1.109	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1CCN(C(=O)c2ccc(O)nn2)[C@@H]1c1cccnc1	1810541001	RJFWKIVAFTYITN-HNAYVOBHSA-N	429.553	1.748	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1CCN(C(=O)Cn2ccncc2=O)[C@@H]1c1cccnc1	1810543560	BXYAXJHQVZWGTG-LAUBAEHRSA-N	443.580	1.196	50	20	IDGD	
Cc1ccc(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)cc1	1811959117	IHQBRDDNXJVKRH-GMAHTHKFSA-N	443.312	1.703	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)COc2cccnc2)[C@@H]1c1cccnc1	1813028838	WUUDMKXPNVXAOR-IMFGXOCKSA-N	432.908	1.815	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2ccc(F)cn2)[C@H]1c1cccnc1	1813070030	DGACRPZHXXRNNG-KKSFZXQISA-N	442.495	1.308	50	20	IDGD	
Cc1nc(C(=O)N2CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)co1	1813071798	XRSCNFVUIOBHAM-OXJNMPFZSA-N	428.493	1.071	50	20	IDGD	
CCOCC(=O)N[C@@H]1CCc2nc(NC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)sc2C1	1817277212	MCGAJYVQPDAKTL-IVWKQIGUSA-N	432.506	1.226	50	20	IDGD	
Cc1c(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)[C@@H](F)Cl)n[nH]2)cn2[nH]cnc(=O)c12	1818041661	UFVGGZQVSQQFHP-IUODEOHRSA-N	435.847	1.894	50	20	IDGD	
COC(=O)c1ccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)[C@@H](O)CCl)[nH]n2)cn1	1818222082	NHRRIMRUJYITLD-CABCVRRESA-N	435.868	1.497	50	20	IDGD	
Cc1[nH]ccc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1818315824	CPIGOYVMRASILY-QGZVFWFLSA-N	436.476	1.664	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ncon2)n[nH]1	1820017031	OREFGIJESMUFKP-BMYBCIMUSA-N	439.436	1.233	50	20	IDGD	
O=C([C@H]1Cc2ccccc2CN1)N1CCC([C@H]2CCCCN2C(=O)[C@H](O)CCl)CC1	1824182994	NCVTXUUXGDUJRP-NJDAHSKKSA-N	433.980	1.920	50	20	IDGD	
O=C(CCBr)N1CCC([C@H]2CCCCN2C(=O)CN2CCOC2=O)CC1	1824331560	PKPKQOWCRWAWTD-OAHLLOKOSA-N	430.343	1.843	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)CN3CCCCC3=O)sc2C1	1825868007	NCIWRIJBLKVLNF-GHMZBOCLSA-N	443.367	1.851	50	20	IDGD	
Cc1ccncc1C(=O)N[C@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1	1826086292	QHJFLCFZNUEMIU-ZDUSSCGKSA-N	430.534	1.445	50	20	IDGD	
Cc1nc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)cs1	1826123082	PEOKCTFNQARBRL-FQEVSTJZSA-N	441.362	1.678	50	20	IDGD	
O=C1NCCn2nc(C(=O)N3CCCC[C@@H]3C3CCN(C(=O)C(Cl)Cl)CC3)cc21	1826199800	WULVMRZPYXVLBM-CQSZACIVSA-N	442.347	1.664	50	20	IDGD	
N#CCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Cl)CCN2C(=O)OCc1ccccc1	1829052620	PNBXPNGUVNIVMX-YLJYHZDGSA-N	436.871	1.887	50	20	IDGD	
C[C@H](O)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Cl)CCN2C(=O)OCc1ccccc1	1829057586	ZHCARNAQHJCYKS-NBQZKYEYSA-N	441.887	1.354	50	20	IDGD	
O=C(c1cccnc1S)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1829798924	RZGBUOXSZNIBKQ-MLGOLLRUSA-N	448.314	1.131	50	20	IDGD	
Cn1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)c2cccnc21	1830361929	HCAMLSMKLHFIGF-QFIPXVFZSA-N	448.951	1.908	50	20	IDGD	
C[C@@H]1CCc2c(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)C(C)(C)CCl)CCO4)n[nH]c21	1830362126	MBHADIIBAPYSBG-SPLOXXLWSA-N	438.956	1.794	50	20	IDGD	
O=C(Cc1ccc(Cl)s1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1830726839	UGXPRLASZJDXBP-CXAGYDPISA-N	437.345	1.000	50	20	IDGD	
Cc1cc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)on1	1832571709	ZXTSEOMEQLPOMA-ROUUACIJSA-N	434.320	1.218	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)CNC(=O)N(C)C)CC2)CC1	1833143622	WRZMJPOUHHIBAV-KRWDZBQOSA-N	429.993	1.237	50	20	IDGD	
C=CCO[C@@H](C)C(=O)NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1	1833473578	KLONAKWJWCGDND-HNNXBMFYSA-N	430.387	1.934	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@@](C)(O)C(F)(F)F)CC2)CC1	1833644169	MDVRDWYLLACKNC-RHSMWYFYSA-N	427.895	1.889	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)c3nccn3C)CC2)CC1	1834268976	PYDAZLDSCIIVMZ-CQSZACIVSA-N	440.386	1.636	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)c3cn(C)cn3)CC2)CC1	1834284646	DMZCVBCVNSGBIC-CQSZACIVSA-N	440.386	1.636	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)Cc3ccc(F)cc3)C2)C1	1834822533	SZTZAJDMNHJFNY-IBGZPJMESA-N	443.313	1.610	50	20	IDGD	
O=C(Cc1ccsc1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1836102160	LNSLWMGRDGGTKO-ZBFHGGJFSA-N	435.315	1.438	50	20	IDGD	
CC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)C34CC(C(=O)OC)(C3)C4)CC2)CC1	1836397596	JSPNYIQQRRVNHO-YTXWROIDSA-N	439.984	1.919	50	20	IDGD	
CC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)CNC(=O)C(F)(F)F)CC2)CC1	1836397599	JVUKFIPLGXSEBR-AWEZNQCLSA-N	440.894	1.254	50	20	IDGD	
Cn1ccc(CC(=O)N2CCC(N3CCC(NC(=O)[C@H](F)Br)CC3)CC2)n1	1836412784	UVJIJGDDGMNFIW-KRWDZBQOSA-N	444.349	1.225	50	20	IDGD	
C[C@@H](Nc1ccccn1)C(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836718471	PMZUCQUOQTZSAZ-CRAIPNDOSA-N	438.956	1.480	50	20	IDGD	
Cn1nncc1C(=O)N1CCC(OC2CCN(C(=O)[C@](C)(Cl)CCl)CC2)CC1	1837231416	NGJZFNOLCOTHLR-GOSISDBHSA-N	432.352	1.664	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(C)c4n[nH]cc4c3)C2)C1	1839148222	RMUCDGOHGQWFGC-UTKZUKDTSA-N	434.924	1.959	50	20	IDGD	
O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)Cc1ccccc1O)CCO2	1839907610	IBGWCGSZPWRQDF-IBGZPJMESA-N	441.322	1.176	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)/C=C/c3ccoc3)C2)C1	1839962345	BMPLTEKKHAHZKO-FPZJGVQBSA-N	441.322	1.923	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C)n(C)c3)C2)C1	1839964179	JKONYAYALVFKQY-QFBILLFUSA-N	442.354	1.577	50	20	IDGD	
O=C(c1ccc2nc[nH]c2c1)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840188436	JDPCUEKNYNAXIT-SFHVURJKSA-N	427.288	1.437	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H](C)Cc3ccco3)CCO2)C1	1840472526	JRAWYGHSOASWBB-KNBMTAEXSA-N	428.913	1.168	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H]2CC[C@@H](C2)[C@@H]1C(=O)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1	1841353596	GQFLKWSQWHZSOZ-CAOSSQGBSA-N	441.956	1.578	50	20	IDGD	
CN1CCCC[C@@H]1C(=O)N1CC2(CCCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C1	1841924044	PCFBPUFKVUWDRJ-JKSUJKDBSA-N	442.988	1.806	50	20	IDGD	
CCn1nc(C(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)c2ccccc21	1844264080	BXDDQAGHKABVRX-UHFFFAOYSA-N	447.499	1.186	50	20	IDGD	
C[C@@H]1C[C@]1(C)C(=O)N1CC2(CCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)C1	1845039276	YPOABBIFPKNQDF-VGSWGCGISA-N	427.549	1.582	50	20	IDGD	
CCCCc1ccc(NC(=S)NNC(=O)C2=CN3CCS(=O)(=O)N=C3C=C2)cc1	15717825	MFIFQFWYSQEBDA-UHFFFAOYSA-N	433.559	1.844	50	20	IDGD	
COC(=O)c1c(C)[nH]c(C(=O)OCC(=O)NNC(=O)c2cc(Cl)ccc2OC)c1C	22203657	FWYFHVAZSFRYAI-UHFFFAOYSA-N	437.836	1.698	50	20	IDGD	
NC(=O)CCn1c(SCC(=O)NNC(=O)c2ccccc2)nnc1-c1cccs1	23370473	PDCAECGTPJAYBS-UHFFFAOYSA-N	430.515	1.435	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)NNC(=O)CNC(=O)c1ccco1	725740381	DWVPYMJWLOMFGX-HNNXBMFYSA-N	430.461	1.293	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NNC(=O)c1cc2c(s1)CCCCC2	725873288	MFHFZTDMGHEDEZ-UHFFFAOYSA-N	435.531	1.484	50	20	IDGD	
CC(=O)N1CCN(c2ccccc2CNC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)CC1	726274090	MXSNDAXWGXDKIN-UHFFFAOYSA-N	440.460	1.408	50	20	IDGD	
CC(=O)Nc1cc(NC(C)=O)cc(C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)c1	726867843	WRMLLBKQEQYOBS-UHFFFAOYSA-N	445.501	1.801	50	20	IDGD	
COc1ccccc1C(=O)N[C@H](CCS(C)(=O)=O)C(=O)NNc1cc(C)cc(C)c1	728056457	WHVPJHRMXVAIOD-GOSISDBHSA-N	433.530	1.988	50	20	IDGD	
CCc1noc2ncc(C(=O)OCC(=O)NNC(=O)c3ccc(OC)c(OC)c3)cc12	728102017	DGJSKZKDDXHTKB-UHFFFAOYSA-N	428.401	1.420	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNS(=O)(=O)c1cccc(-n2cnnn2)c1	728170519	ZBJSJQVYMZPBEJ-CQSZACIVSA-N	438.469	1.593	50	20	IDGD	
C[C@H](Oc1ccc(C#N)cc1)C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	728212999	QFJHEXFHWHVZIW-INIZCTEOSA-N	443.529	1.405	50	20	IDGD	
Cn1c(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c(Cl)c2ccccc21	728328495	VKQRGUCGRRTPQP-MRXNPFEDSA-N	443.843	1.976	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NCCN2CCOCC2(C)C)c2ccccc2c1=O	728401405	YKUCCNSGLWTGAT-UHFFFAOYSA-N	444.536	1.251	50	20	IDGD	
CN1CCC(CCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)CC1	728753094	WNPDANFQGRVFGD-UHFFFAOYSA-N	437.566	1.147	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)C1CCC(NC(=O)C2CCCC2)CC1	728846596	PJMQHDSXLMGNES-UHFFFAOYSA-N	442.564	1.706	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2cccc3c2O[C@H](C)C(=O)N3)c2ccccc2c1=O	729299345	ALPCDSICORNAGY-GFCCVEGCSA-N	435.440	1.601	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)NCCCC(=O)N1CCc2ccccc21	732235355	AOMCENYSJDDFIK-UHFFFAOYSA-N	426.473	1.774	50	20	IDGD	
CCCC[C@H](NNC(=O)Cc1csc(N2CCOCC2)n1)C(=O)Nc1cc(C)on1	732917795	LGDCYFKAXHDSGA-HNNXBMFYSA-N	436.538	1.637	50	20	IDGD	
C[C@H]1C[C@H](C)CC[C@H]1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	733651373	MTNQKSCPWQNAIA-RVKKMQEKSA-N	438.550	1.476	50	20	IDGD	
CC1CCN(C(=O)C2CCN(CC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)CC2)CC1	734152802	VMAJISUKVMJZCK-UHFFFAOYSA-N	431.493	1.326	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)[C@@H]1CCCN1C(=O)Cc1ccccc1	734239535	RLTABFLCSCADOQ-INIZCTEOSA-N	433.509	1.075	50	20	IDGD	
C=CC[C@H](NC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)c1ccncc1	734678357	GJLNQXUMQKYOEY-SFHVURJKSA-N	445.549	1.356	50	20	IDGD	
COC(=O)[C@@H](NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1)c1cccc(Cl)c1	735507008	GIVIACRBHAASHL-SFHVURJKSA-N	439.921	1.804	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)NCCCc1ccc(O)cc1	735760720	AWGVWOFWPKAOEO-UHFFFAOYSA-N	425.533	1.868	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)c1ccnc(N2CCCCC2)n1	739473790	MZZJHCVQOJOVSR-UHFFFAOYSA-N	437.548	1.440	50	20	IDGD	
CN(CCCC(=O)NNC(=O)c1ccc2c(c1)OCO2)C1=NS(=O)(=O)c2ccccc21	742033956	WMRKZGCHTHFQES-UHFFFAOYSA-N	444.469	1.037	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)[C@@H](c1cccc(F)c1)N1CCOCC1	742075572	FBALKIXQABUOCO-MRXNPFEDSA-N	439.488	1.054	50	20	IDGD	
O=C(NNc1c(F)cc(F)cc1Br)[C@H]1CC(=O)N(CCN2CCOCC2)C1	742108059	CIRRHNQBPNOWBX-NSHDSACASA-N	447.280	1.351	50	20	IDGD	
CC(C)c1ccc(-n2cc(O)c(C(=O)NNC(=O)CCN3C[C@H](C)O[C@H](C)C3)n2)cc1	743292065	WHOOFWLCHSYDGE-IYBDPMFKSA-N	429.521	1.962	50	20	IDGD	
C=CCNC(=S)NNC(=O)[C@@H](Cc1c[nH]c2ccc(Br)cc12)NC(C)=O	743819587	AAONNGMULNMPMX-OAHLLOKOSA-N	438.351	1.659	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2cc(=O)n(-c3ccc(C)cc3)[nH]2)c2ccccc2c1=O	746096148	AGPPMSQJZGFZCF-UHFFFAOYSA-N	432.440	1.279	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)[C@@H]1CCCN1C(=O)NCc1cccc(Br)c1	746235625	ZTNALKDYMDRJLQ-HNNXBMFYSA-N	449.309	1.616	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)[C@H]2CCCN2Cc2ccccn2)CC1	746271962	QMQQTKKMLPPJNN-GOSISDBHSA-N	446.552	1.776	50	20	IDGD	
Cc1ccc(C(F)(F)F)cc1S(=O)(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	747596888	RFPOUBLYJYSCGB-UHFFFAOYSA-N	426.380	1.613	50	20	IDGD	
Cc1ccc(F)c(NC(=S)NNC(=O)c2cnc3c(c2C)c(=O)n(C)c(=O)n3C)c1	748077028	XWRJNFGTKASIBC-UHFFFAOYSA-N	430.465	1.020	50	20	IDGD	
C[C@@]1(c2ccc(C(=O)NNC(=O)c3cc(F)ccc3Br)cc2)NC(=O)NC1=O	748538856	YLGRMUMEULYGDT-SFHVURJKSA-N	449.236	1.718	50	20	IDGD	
Cc1oc(C)c(S(N)(=O)=O)c1C(=O)NNc1ccccc1S(=O)(=O)NC(C)(C)C	748594090	PBYBUTLEYBJJBP-UHFFFAOYSA-N	444.535	1.378	50	20	IDGD	
N#Cc1ccc(C=NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)s1	748782366	PRKHMSRNJQQYFL-UHFFFAOYSA-N	432.527	1.724	50	20	IDGD	
CC[C@H](Oc1cccc(C)c1)C(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1	749329820	GSZNIDCFCBOGLK-IBGZPJMESA-N	433.530	1.929	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)c2ccc3c(c2)NC(=O)[C@@H](C)N3C)c2ccccc2c1=O	749866765	TYXCMYIECBNUIR-CYBMUJFWSA-N	448.483	1.829	50	20	IDGD	
C[C@@H](C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1)c1ccc(Cl)s1	750243296	ZANNAXYFSYTEQW-GFCCVEGCSA-N	443.982	1.979	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNS(=O)(=O)c2cc(F)c(F)c(C(=O)O)c2)cc1	751143188	WWNFSPLSPRXFAS-JTQLQIEISA-N	444.412	1.839	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1ccccc1N1CCOCC1	751292743	ALVVSFPIYPQUOW-UHFFFAOYSA-N	431.518	1.200	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)c2cc(S(=O)(=O)N(C)C)c(C)o2)o1	753594837	VLWHBCGORZRHHG-UHFFFAOYSA-N	426.495	1.348	50	20	IDGD	
COCCN(C)S(=O)(=O)[C@@H]1CCCN(C(=O)NNC(=O)CCCc2ccccc2)C1	755238413	JSBQVNONQOTZCM-GOSISDBHSA-N	440.566	1.123	50	20	IDGD	
O=C(Cc1cc[nH]n1)NNC(=O)[C@@H]1CCCN1C(=O)NCc1cccc(Br)c1	755267924	DNYUTIOQWCCMAR-HNNXBMFYSA-N	449.309	1.236	50	20	IDGD	
O=C(CN1CCOCC1)Nc1ccc(NC(=O)NNC(=O)c2cc(Cl)ccc2O)cc1	755600685	VGUZUQWFYKPTEZ-UHFFFAOYSA-N	447.879	1.783	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2cc(F)ccc2Br)cn1	755906783	XRLLBJCYGGFWCK-UHFFFAOYSA-N	431.243	1.853	50	20	IDGD	
CC(C)(C)S(=O)(=O)N1CCC(NC(=O)NNC(=O)c2ccc3ccccc3n2)CC1	755907791	UFUKNNNAAIUSJB-UHFFFAOYSA-N	433.534	1.772	50	20	IDGD	
COc1ccc(C(F)(F)C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cc1	756003301	NEAQEQWVSJRXMH-UHFFFAOYSA-N	446.454	1.392	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)[C@H](C)CS(=O)(=O)c2ccc(F)cc2)c1	756709108	CBFIRAKPUPMPOJ-CQSZACIVSA-N	436.461	1.548	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)Nc1ccccc1OCC(=O)N1CCOCC1	756875213	UDDIEEKBBYYAGM-UHFFFAOYSA-N	430.436	1.459	50	20	IDGD	
CC[C@H](C)NS(=O)(=O)c1cccc(NC(=O)NNC(=O)COc2ccc(C#N)cc2)c1	757707908	CKNHIGIPFGRUMT-AWEZNQCLSA-N	445.501	1.867	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)Nc3ccc(-n4ncn(C)c4=O)cc3)n[nH]2)cc1	757863921	VPQMVYOULONUQM-UHFFFAOYSA-N	446.471	1.990	50	20	IDGD	
O=C1CSc2ccc(C(=O)N3CCN(S(=O)(=O)CBr)CC3)cc2N1	758522388	HCWDLLRZFQKIBU-UHFFFAOYSA-N	434.337	1.171	50	20	IDGD	
O=C(c1ccnc(OCC(F)F)c1)N1CCN(S(=O)(=O)CBr)CC1	758524037	SDAKWDBJCIAPOC-UHFFFAOYSA-N	428.255	1.166	50	20	IDGD	
COCCOc1cccc(C(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)c1	758782833	ZIDQQIHORXFHIA-UHFFFAOYSA-N	436.509	1.961	50	20	IDGD	
CSCC[C@H](NC(=O)c1cccc(C)c1)C(=O)NNC(=O)C(=O)Nc1ccccn1	758831628	RSXQZSUGPMQJLX-HNNXBMFYSA-N	429.502	1.028	50	20	IDGD	
CCOC(=O)c1cnn(-c2ccc(C(=O)NNC(=O)C(=O)Nc3ccccn3)cc2)c1C	758835936	ZPTMXJFBSWTHQG-UHFFFAOYSA-N	436.428	1.152	50	20	IDGD	
CSc1nc(C(C)(C)C)nc(C)c1C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	760300129	AVQKGGSTUNXJMH-UHFFFAOYSA-N	426.506	1.855	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)c1cc(S(=O)(=O)NCCCN(C)C)ccc1C	761755762	YVIZRKMTUQTGCJ-UHFFFAOYSA-N	432.546	1.608	50	20	IDGD	
CC(C)c1cccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)n1	761784364	AJXZJLKPGGGSAI-UHFFFAOYSA-N	432.502	1.301	50	20	IDGD	
CCC(=O)N1CC[C@H](NC(=O)NNC(=O)[C@@H]2Cc3ccccc3CN2Cc2ccccc2)C1	762381694	DAGYSWYRXIJQMY-VXKWHMMOSA-N	449.555	1.955	50	20	IDGD	
CCc1ccc(NC(=O)C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1C	763532339	VYWXXOYDWJFIPM-UHFFFAOYSA-N	437.544	1.856	50	20	IDGD	
N#Cc1c(F)cccc1-n1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)n1	763548434	LMENXNVFTVPNKV-UHFFFAOYSA-N	436.359	1.011	50	20	IDGD	
C[C@@H]1CN(c2ccccc2NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)C[C@@H](C)O1	763548760	PWEDVGXEPMQSRO-ZIAGYGMSSA-N	440.456	1.429	50	20	IDGD	
C[C@@H](Cn1ncc2ccccc2c1=O)NC(=O)NNC(=O)CCCNC(=O)OC(C)(C)C	763555401	UXBGUWYCQYGXPP-AWEZNQCLSA-N	446.508	1.420	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)Nc1ccc(F)cc1C(F)(F)F	763573082	QCLQTOPEBVVRRJ-CQSZACIVSA-N	427.310	1.770	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)Nc1ccccc1OC(F)(F)F	763573998	WLRXFNMTFYRDNK-CQSZACIVSA-N	425.319	1.511	50	20	IDGD	
Cc1nnc(-c2cccc(NC(=O)C(=O)NNC(=O)c3cc(-c4ccccc4)[nH]n3)c2)o1	763604967	NNTIYHIOVAJJCF-UHFFFAOYSA-N	431.412	1.835	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1cccc(CN2CCCCC2=O)c1	763628626	KVIYVMARQIMDBR-UHFFFAOYSA-N	448.483	1.555	50	20	IDGD	
CCN(Cc1ccccc1NC(=O)C(=O)NNC(=O)COc1cccc(C)c1)C(C)=O	763631577	ZCZHRWYJDWGJTB-UHFFFAOYSA-N	426.473	1.528	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2nc(-c3ccccc3F)cs2)cc1	763673720	IZLVBQFDDXSAIY-UHFFFAOYSA-N	439.428	1.986	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)C(=O)Nc2cccc(OC)c2)c2ccccc2c1=O	763801471	SAFMVSLYCYITGP-UHFFFAOYSA-N	437.456	1.605	50	20	IDGD	
Cc1ccnn1-c1ccccc1NC(=O)C(=O)NNC(=O)COc1ccccc1[N+](=O)[O-]	763804373	MIMSCHOCWUXKGA-UHFFFAOYSA-N	438.400	1.254	50	20	IDGD	
CCOC(=O)N(C)c1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)cc1	763848337	BVKHCSSTLFOLSC-ZDUSSCGKSA-N	446.435	1.972	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(CS(C)(=O)=O)cc2)c1C	763850348	OJBDUFNHXLVNSX-OAHLLOKOSA-N	447.513	1.401	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)C(=O)Nc1ccccc1-n1cncn1	763855236	VEQSSCBJSOJUML-OAHLLOKOSA-N	444.451	1.974	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccc(S(=O)(=O)C3CCCC3)cc2)n1	763880458	FXKOBEQLKRBJMB-UHFFFAOYSA-N	447.517	1.002	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3ccn(Cc4ccncc4)n3)cc2C1	763942480	NBKGBWVQGOCVNC-ZDUSSCGKSA-N	438.513	1.912	50	20	IDGD	
O=C(CCc1ccco1)NNC(=O)C(=O)Nc1cccc(C(=O)N2CCSCC2)c1	764168317	BXLRBGIAOLAEHM-UHFFFAOYSA-N	430.486	1.187	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)C(=O)Nc1cccc(-c2cnco2)c1	764202258	ASVHSBRMYOQRPH-UHFFFAOYSA-N	431.449	1.732	50	20	IDGD	
CCC(CC)NC(=O)[C@@H]1CN(C(=O)C(=O)NNC(=O)CCC(C)C)c2ccccc2O1	764203210	OVTRKQLURRJAEG-SFHVURJKSA-N	432.521	1.669	50	20	IDGD	
C=CCNC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)cc1	764243347	USKZPDGTMCTLLE-UHFFFAOYSA-N	434.456	1.735	50	20	IDGD	
CSc1cccc(NC(=O)C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1C	764268150	XUQDHTHLBDWISL-UHFFFAOYSA-N	428.518	1.509	50	20	IDGD	
COCC(=O)NNC(=O)C(=O)Nc1cc(Cl)c(NC(=O)c2ccncc2)c(Cl)c1	764303540	MZJKXXMROKXKFG-UHFFFAOYSA-N	440.243	1.373	50	20	IDGD	
O=C(CCNS(=O)(=O)c1cccnc1)NNc1c(F)cc(C(=O)NC2CC2)cc1F	764334037	GRYAWFYGIDWUEA-UHFFFAOYSA-N	439.444	1.064	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(S(=O)(=O)N(C)C(C)C)ccc2C)o1	764369460	FUTVLDRATSRRSP-UHFFFAOYSA-N	436.490	1.325	50	20	IDGD	
C[S@@](=O)c1ccc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)cc1F	764379746	IXMBGEWPEULAJH-GDLZYMKVSA-N	429.376	1.321	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)cc1	764387217	GENRQPSBXRJNQZ-UHFFFAOYSA-N	445.432	1.019	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)cnn1-c1ccccc1	764393525	HBBQHUYOADIVQC-UHFFFAOYSA-N	425.470	1.765	50	20	IDGD	
CC(C)n1ncc2cc(/C=C\C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)c(=O)[nH]c21	765320500	OHMOTFOQKIDFBJ-HJWRWDBZSA-N	446.508	1.771	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)Cn3c(=O)cnc4ccccc43)n[nH]2)cc1OC	765599031	PNBQOIINYCVRHA-UHFFFAOYSA-N	448.439	1.265	50	20	IDGD	
CCS(=O)(=O)NCc1ccc(C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)cc1	765615501	HPDTWGYENLZWDY-UHFFFAOYSA-N	445.476	1.730	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)c2cc3c(s2)CCC3)cc1F	765641943	MGLVOHXWYDWGAX-UHFFFAOYSA-N	447.535	1.761	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NN=Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])cc1	765995658	WZRJXGXUQZTSIX-UHFFFAOYSA-N	435.418	1.582	50	20	IDGD	
O=C(NNc1cnccn1)C(=O)Nc1ccc(NC(=O)[C@@H]2CCCO2)cc1C(F)(F)F	766259149	RGVZLHYUHNXOQQ-ZDUSSCGKSA-N	438.366	1.695	50	20	IDGD	
CCOc1ccc(C(=O)NNS(=O)(=O)c2cc([N+](=O)[O-])c(O)cc2C)cc1OC	766313074	VQJBGHLKAUENJX-UHFFFAOYSA-N	425.419	1.639	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1ccccc1OC1CCC1	766635882	ICVMJHMKMMCTLD-UHFFFAOYSA-N	436.512	1.837	50	20	IDGD	
COC(=O)[C@H](c1cccc(Cl)c1)N1CCN([C@H](C)C(=O)NNC(=O)CC(C)C)CC1	766974194	ZLUJWCWQBMNQEB-BEFAXECRSA-N	438.956	1.754	50	20	IDGD	
Cc1nn(CC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1-c1ccccc1	767415463	PTWLZBKHJBMVHX-UHFFFAOYSA-N	441.513	1.570	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3cncc(-c4cnn(C)c4)c3)n[nH]2)cc1OC	768275693	DMXOYUOHLZSHPJ-UHFFFAOYSA-N	447.455	1.964	50	20	IDGD	
Cc1ccc(C(=O)NNC(=S)Nc2ccccn2)cc1S(=O)(=O)N1CCOCC1	768585091	CXMOQPNAMJGJGU-UHFFFAOYSA-N	435.531	1.042	50	20	IDGD	
COc1cc(OCC(=O)NNc2c(OC)cccc2S(C)(=O)=O)ccc1[N+](=O)[O-]	768640168	XPDZLUDYFHTEPX-UHFFFAOYSA-N	425.419	1.538	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)NC2CCN([C@@H]3CCC[C@H]3O)CC2)cc1OC	769157428	VGLFIYNRWTZQII-QZTJIDSGSA-N	434.537	1.806	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(C)c2Br)cc1	769256553	TYRPJLGQRPWOAY-UHFFFAOYSA-N	436.262	1.931	50	20	IDGD	
CO[C@H](CNC(=O)OC(C)(C)C)CC(=O)NNc1nc(Br)cn2ccnc12	770034531	QUKNEHUZPBETCV-JTQLQIEISA-N	443.302	1.865	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)c(C)c1C	771605918	FEBFGKKJKBKUIN-UHFFFAOYSA-N	425.894	1.591	50	20	IDGD	
Cc1ccc(S(=O)(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)cc1[N+](=O)[O-]	771607545	NRMJSKCFTXWHJL-UHFFFAOYSA-N	426.838	1.183	50	20	IDGD	
CC1(C)CCC[C@H]1C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	771913245	KUYUYVKPJIKFJM-SFHVURJKSA-N	437.562	1.614	50	20	IDGD	
Cc1cc(S(=O)(=O)NCCNC(=O)NNC(=O)Cn2ccc3ccccc32)c(C)s1	771974455	ATYTUNKYBQNRFT-UHFFFAOYSA-N	449.558	1.629	50	20	IDGD	
CC(C)(C)OC(=O)Nc1cccc(CC(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)c1	772158172	OGGDRPUJMNPWJW-AWEZNQCLSA-N	426.495	1.094	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)C1CCN(C(=O)c2cccnc2)CC1	772885071	UMRAIAVGILEVOY-UHFFFAOYSA-N	443.891	1.051	50	20	IDGD	
O=C(NNc1cnc2ccccc2n1)C(=O)Nc1ccc(CN2C(=O)CSC2=O)cc1	773722293	CMPCTBQVRUZRBG-UHFFFAOYSA-N	436.453	1.907	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@H](C(=O)NNc2ncc(Cl)cc2Cl)[C@H](C)O)cc1	775265321	LQEKBWYAPQQOQT-HZMBPMFUSA-N	433.317	1.868	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN([C@H]2CCCN(C(=O)NNC(=O)C(C)(C)C)C2)C(=O)C1	776878378	XYBNHVAGCMAGAW-AWEZNQCLSA-N	425.530	1.317	50	20	IDGD	
Cc1cc(Br)c(S(=O)(=O)NNC(=O)CNC(=O)OC(C)(C)C)s1	777940299	YXLAEGOUULHWIW-UHFFFAOYSA-N	428.330	1.653	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)C1CCN(C(=O)/C=C/c2ccccc2)CC1	778434296	YMUNQIPVXKQUNK-MDZDMXLPSA-N	430.505	1.611	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)[C@H]1CC(=O)N(c2ccc(Cl)c(F)c2)C1	778437301	YJLDLSDSVCJMRZ-JTQLQIEISA-N	428.848	1.504	50	20	IDGD	
CCc1ccc(NC(=O)C(=O)NNc2ccccc2OC(F)(F)F)cc1S(N)(=O)=O	778800368	WTQRQRMXXMUOBJ-UHFFFAOYSA-N	446.407	1.877	50	20	IDGD	
COC(=O)c1cnc(C(=O)NNC(=O)COc2ccc(-c3ccc(C#N)cc3)cc2)cn1	779643701	WTHKLZYWMMOYBD-UHFFFAOYSA-N	431.408	1.642	50	20	IDGD	
CC(C)[C@H](NS(=O)(=O)c1ccc2c(c1)OCCCO2)C(=O)NNc1ccnc(F)c1	781365301	FGXSUSGFYOENGO-SFHVURJKSA-N	438.481	1.828	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H](C)C2=CCN(C)CC2)c1	781397513	CJCGAWBYPYURAY-OAHLLOKOSA-N	437.566	1.312	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2ccc(OC)c(Br)n2)c2ccccc2c1=O	781928938	BYFRWNKEQIYOKS-UHFFFAOYSA-N	446.261	1.657	50	20	IDGD	
Cc1nccc(-c2cccc(NC(=O)C(=O)NNC(=O)Cc3nc4ccccc4n3C)c2)n1	782886488	LRTCLCHQCYHBQE-UHFFFAOYSA-N	443.467	1.667	50	20	IDGD	
CSc1cccc(NC(=O)C(=O)NNC(=O)c2csc(N3CCOCC3)n2)c1C	782896414	ICLFAIIJWYQUHB-UHFFFAOYSA-N	435.531	1.410	50	20	IDGD	
O=C(NCc1ccc(N2CCOC2=O)cc1)NNC(=O)C1CCN(c2ncccn2)CC1	783003096	XMWMBAARUSORLB-UHFFFAOYSA-N	439.476	1.180	50	20	IDGD	
CN(C)CC(=O)Nc1ccc(NC(=O)C(=O)NNc2ccc(Cl)cc2[N+](=O)[O-])cc1	783291033	KDNCRIFQXQEKHT-UHFFFAOYSA-N	434.840	1.830	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NN[C@]2(C)CCS(=O)(=O)C2)cc1Cc1ccccc1	783427962	RPYAVMWVGFEJQC-OAQYLSRUSA-N	431.514	1.423	50	20	IDGD	
O=C1CCc2ccc(NC(=O)C(=O)NNc3ccc(S(=O)(=O)NC4CC4)cc3)cc2N1	784210459	PYUGKMBXVLMFRZ-UHFFFAOYSA-N	443.485	1.094	50	20	IDGD	
CC(=O)N(C)c1ccccc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	784213922	RIAKRJWPTLELFL-UHFFFAOYSA-N	445.501	1.192	50	20	IDGD	
CCOC(=O)[C@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNc2ccc(F)cc2)cc1F	784785370	USHWWUJJHNYQID-NSHDSACASA-N	434.399	1.728	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)Nc1ccc(Br)c(F)c1	785022273	FAWRAJKMBMIFIG-UHFFFAOYSA-N	441.169	1.602	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)Nc1ccc2c(cnn2C(F)F)c1	785022902	AOLHQKYUCVGCBT-UHFFFAOYSA-N	434.315	1.445	50	20	IDGD	
Cc1nc(Cn2nnc(C(=O)NNC(=O)c3cc(-c4ccc(C)c(C)c4)[nH]n3)c2C)no1	785183192	RSJJJSIWXCLYLN-UHFFFAOYSA-N	435.448	1.408	50	20	IDGD	
COc1cc(OC)c(NC(=O)C(=O)NNc2c(OC)cccc2S(C)(=O)=O)cc1F	785330012	BTNJGCFKVWPLJS-UHFFFAOYSA-N	441.437	1.337	50	20	IDGD	
O=C(NNC(=O)[C@H]1CC(c2c(F)cccc2F)=NO1)c1csc(N2CCOCC2)n1	785699908	HRQCQCATDAMMSY-CQSZACIVSA-N	437.428	1.212	50	20	IDGD	
COC(=O)COc1ccc(C=NNC(=O)c2nnc(-c3ccccc3)o2)cc1[N+](=O)[O-]	788714964	SOLLEWONPJZCGU-UHFFFAOYSA-N	425.357	1.961	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCc3ccccc3C2=O)cc1Br	788750897	JCFLETHBMQNXCF-UHFFFAOYSA-N	432.274	1.917	50	20	IDGD	
CCC(=NNC(=O)C[C@@H]1c2cc(OC)c(OC)cc2CCN1S(C)(=O)=O)c1cn[nH]c1	788977469	OBRKDZWRKHGZOK-QGZVFWFLSA-N	449.533	1.606	50	20	IDGD	
Cc1ccc(-n2cccn2)cc1NC(=O)C(=O)NNC(=O)c1cc(Br)cn1C	789584878	STWGUVTVBQSNGF-UHFFFAOYSA-N	445.277	1.681	50	20	IDGD	
Cc1nc(Br)ccc1NC(=O)C(=O)NNC(=O)[C@H]1OCC[C@H]1c1ccccc1	789810912	UGDULJPVXLUEDR-BBRMVZONSA-N	447.289	1.811	50	20	IDGD	
COc1ccc(CC(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)nc1	789880940	ZKMQXRPYVLDHPX-UHFFFAOYSA-N	446.510	1.956	50	20	IDGD	
CCOC(=O)NNC(=O)C(=O)Nc1cc(Br)cc(C(=O)N2CCCC2)c1	790952309	MHRMAMUDZAPESO-UHFFFAOYSA-N	427.255	1.401	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(NC(=O)N(C)C)c2C)cc1	792352127	BGLIFWRAGALMOZ-UHFFFAOYSA-N	443.460	1.262	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2cc(Cl)c(C)c(C(=O)O)c2)cc1OC	794865922	MXKIWWPNDFDZMS-UHFFFAOYSA-N	428.850	1.987	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H]2CN(CC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)CC[C@@H]21	795099297	MLKJPTUGNFBULM-RDJZCZTQSA-N	447.492	1.687	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)[C@H]2[C@H]3[C@@H]4C[C@@H]5[C@@H]6C[C@@H]([C@@H]3[C@@H]64)[C@@H]52)cc1OC	796324201	NQZMUVZTWVZCSY-ZKYOCWMQSA-N	426.469	1.402	50	20	IDGD	
COC(=O)c1cc(F)cc(NC(=O)C(=O)NNC(=O)c2cccc3ncccc23)c1F	797009853	XCQCYNUGOJWIAR-UHFFFAOYSA-N	428.351	1.699	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)c(N3CCNC3=O)c2)cc1C	798308681	KNKRYJIJEOGIRY-UHFFFAOYSA-N	429.864	1.886	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NCC(=O)NNc1cc([N+](=O)[O-])ccc1Br	800619741	VAVVXCBMBDUQDI-UHFFFAOYSA-N	446.258	1.441	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)N(CCO)CCN2CCOCC2)c(C)n1C[C@H]1CCCO1	801174651	YMUDMEIGJWYXHL-ONQWYEKWSA-N	430.549	1.344	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)Nc2ccc(Br)cc2Cl)ccn1	802042435	QYXPBYUZCXUKFJ-UHFFFAOYSA-N	448.686	1.611	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)N[C@H]1CCN(C(=O)Nc2ccccc2)C1	802499510	GLNLELCVUSKIOP-ZDUSSCGKSA-N	428.405	1.551	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2ccc(S(=O)(=O)[C@H](C)C#N)cc2)cc1OC	806458765	NTMPCFYJCPNIAA-GFCCVEGCSA-N	432.458	1.856	50	20	IDGD	
O=C1CC(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)(c2cccc(Cl)c2)C1	809980598	QNOMZNVVEGYYHR-UHFFFAOYSA-N	434.905	1.695	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)c2cn(-c3cccc([N+](=O)[O-])c3)nn2)cc1	812726261	ABYHQONEBGQHGE-UHFFFAOYSA-N	431.434	1.183	50	20	IDGD	
CCn1nc(C(=O)NN=Cc2ccc(Cl)c(S(N)(=O)=O)c2)c2ccccc2c1=O	814739176	DWCDJMNZTJPFSP-UHFFFAOYSA-N	433.877	1.481	50	20	IDGD	
CC(=NNC(=O)N[C@H]1CCS(=O)(=O)C1)c1cc(Br)ccc1OCC(=O)O	814814304	GSWWNCMOYRIQKO-NSHDSACASA-N	448.295	1.123	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)N1C[C@@H]2CCCN2c2ccccc21	815752382	PVCKVJSCZDZLFE-HNNXBMFYSA-N	443.529	1.396	50	20	IDGD	
COc1ccc(OC)c(C2=NO[C@H](C(=O)NNc3ccccc3S(=O)(=O)N(C)C)C2)c1	817051682	OSOGKWWHFOFJIP-SFHVURJKSA-N	448.501	1.590	50	20	IDGD	
COc1cc(C(=O)NCC(=O)NNC(=O)CNc2ccc(C)cc2)cc(OC)c1OC	913431629	YHPHFJXDNOBDKM-UHFFFAOYSA-N	430.461	1.010	50	20	IDGD	
Cc1cc(Cl)ccc1OCCCC(=O)NNC(=O)CN(C)[C@H]1CCS(=O)(=O)C1	914531878	KRUPIVMCAWJHSF-HNNXBMFYSA-N	431.942	1.074	50	20	IDGD	
CC(C)CCC[C@@H](C)NC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	915884396	TYSMRRVODMXAEV-MRXNPFEDSA-N	426.587	1.859	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cc(Cl)c(-n3cnnn3)cc2OC)cc1OC	916034301	ARKCLPORQNBZDO-UHFFFAOYSA-N	432.824	1.416	50	20	IDGD	
C[C@H](NC(=O)c1cccc(Cl)c1Cl)C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	916144493	BSVGZKZWPKQBGA-JTQLQIEISA-N	448.270	1.549	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)NC[C@H]1COc2ccccc2C1	916198622	AJXYCYMGRAKZAY-IBGZPJMESA-N	437.544	1.780	50	20	IDGD	
CCN(CC)Cc1ccc(CNC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1	916213686	FLOWMNAHKBUYFP-UHFFFAOYSA-N	436.516	1.920	50	20	IDGD	
CC(C)[C@@H](CNC(=O)NNC(=O)COc1ccc(Br)cc1)N1CCOCC1	916254281	SWYAIQBIDQERJD-MRXNPFEDSA-N	443.342	1.515	50	20	IDGD	
COc1ccccc1OCC(=O)NN=C(C)c1ccc(OCC(=O)N2CCOCC2)cc1	916295727	AOTRWLWODWKHKC-UHFFFAOYSA-N	441.484	1.852	50	20	IDGD	
C[C@H](C(=O)Nc1cccc(F)c1)N1CCN(CC(=O)NNC(=O)c2ccccc2)CC1	917124338	LMZIFGCYCGFWBD-MRXNPFEDSA-N	427.480	1.232	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)c2ccc3c(=O)n4c(nc3c2)CCCCC4)C[C@@H](C)O1	917363126	SQSFSPWXOPQWHC-HZPDHXFCSA-N	441.532	1.383	50	20	IDGD	
NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NNC(=O)COc3ccc(F)cc3)cc2)C1	918117601	HCKYIYBWJFNBFA-MRXNPFEDSA-N	443.479	1.437	50	20	IDGD	
CN(C)N(C(=O)C1CCN(C(=O)c2ccc(Cl)s2)CC1)[C@H]1CCS(=O)(=O)C1	918557158	UOUXMNFZJFFBKG-ZDUSSCGKSA-N	433.983	1.746	50	20	IDGD	
O=C(O)c1cc2c(c(S(=O)(=O)NNC(=O)c3nnc(-c4ccccc4)o3)c1)CCC2	919961718	KVEAIHPAIUGPFB-UHFFFAOYSA-N	428.426	1.547	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCC(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)cc1	1115819717	URWDNNNKBGZZBC-INIZCTEOSA-N	449.529	1.595	50	20	IDGD	
CCc1nn(C)c(CC)c1S(=O)(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1	1253891078	GXLSOPOULZQUEK-UHFFFAOYSA-N	443.570	1.502	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2ccc(Br)s2)cc2c1CCC2	1318714307	RJAUNMNNXMXSHS-UHFFFAOYSA-N	444.332	1.722	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCCc2coc(-c3ccccc3)n2)c1	1321435761	LEUVNJKKGJFCGW-UHFFFAOYSA-N	428.470	1.932	50	20	IDGD	
C=CCN(C)S(=O)(=O)c1ccc(NC(=O)NNC(=O)c2n[nH]c3c2CCCC3)cc1	1323818965	YBYNOSAKNMZDFV-UHFFFAOYSA-N	432.506	1.562	50	20	IDGD	
Nc1cnnc(NNC(=O)C2CCN(S(=O)(=O)c3cc(F)ccc3F)CC2)c1Cl	1324008878	ICZWBQHCKBDPNA-UHFFFAOYSA-N	446.867	1.534	50	20	IDGD	
C[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Cl)C1	1778023121	ZHUQNNBMYRNILD-SSHHRWTQSA-N	435.924	1.948	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc4ncccn4n3)C2)C1	1778467557	PTGPMKWBZFSDGI-SCLBCKFNSA-N	436.310	1.346	50	20	IDGD	
O=C(c1cn2cc(F)ccc2n1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1778545473	PNZWPINODIOWAR-RHSMWYFYSA-N	443.248	1.607	50	20	IDGD	
CC1=CC[C@@H](C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2ccc(B(O)O)cc2)C3)CC1	1778748938	SJHHCLRLSFJODP-MEKIYTOJSA-N	440.349	1.240	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)C[C@@H]3CNc4ccccc4O3)C2)C1	1778934891	XGCHUWIFTYRKGP-XFQAVAEZSA-N	437.924	1.333	50	20	IDGD	
C[C@H](Nc1ccccn1)C(=O)N1CC[C@]2(CN(C(=O)[C@@H](F)Br)CCO2)C1	1779328184	DAZSVIMPNYZIMN-DXCKQFNASA-N	429.290	1.402	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(CN(C(=O)c3cnco3)CCO2)C1	1780095664	TYWVCZMJZBQLFK-HXUWFJFHSA-N	444.400	1.265	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@](C)(Cl)CCl)C1	1780711616	KAKTWHXQLZNZLP-RUZGCFLTSA-N	437.368	1.184	50	20	IDGD	
O=C(c1ccc2ncncc2c1)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781332345	XQIMPSISAODGOI-CRAIPNDOSA-N	437.269	1.764	50	20	IDGD	
COc1ccnc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)c1OC	1781333152	DPHGAJIMSVJNKT-PBHICJAKSA-N	446.273	1.233	50	20	IDGD	
COc1ccnc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)c1OC	1781333154	DPHGAJIMSVJNKT-RHSMWYFYSA-N	446.273	1.233	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CN2CCCCC2=O)C1	1782100229	LEDXVFNFKOJLLU-CSODHUTKSA-N	427.973	1.920	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](C)n1ccccc1=O)CCO2	1783534309	SNIXXLMTDIFAQP-IYOUNJFTSA-N	426.311	1.023	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(O)c([N+](=O)[O-])c3)CCO2)C1	1783537542	ONAODYVCVRYKDN-GTNSWQLSSA-N	442.266	1.527	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(-c4cc[nH]n4)cc3)CCO2)C1	1783882082	VBYHGKFNDVBFER-UTKZUKDTSA-N	432.908	1.774	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CC(F)(F)C(=O)O)C[C@@H]21	1783965371	KAEHCFFPBMEROG-RHYQMDGZSA-N	441.269	1.107	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3cccc([N+](=O)[O-])c3)C[C@@H]21)[C@@H](O)CCl	1784086628	YXLQGIVHQIHFKK-DKIMLUQUSA-N	439.896	1.107	50	20	IDGD	
CC(C)n1cnc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Br)C[C@@H]32)n1	1787670353	QOYKJIUHLLOZQQ-ZDEQEGDKSA-N	432.294	1.143	50	20	IDGD	
O=C(/C=N/N1CCCCC1)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1	1788145769	YWEQXEQOAHAROB-YZSQISJMSA-N	448.332	1.586	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)c3cc(=O)cco3)CCC2)cc1)c1cccc(B(O)O)c1	1788146051	XKHYPASQQPOXKE-UHFFFAOYSA-N	432.241	1.381	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC1(c2ccc(NC(=O)c3cnn4cccnc34)cc2)CCC1	1789253354	SNSXNNZQNDOUGW-UHFFFAOYSA-N	449.515	1.850	50	20	IDGD	
Cn1cc(CCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]3C2)cn1	1789922323	IFTKNJWOGCYBJL-RZLSGREXSA-N	431.306	1.023	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1ccc(C2(NC(=O)c3nccnc3C(N)=O)CCC2)cc1	1791569556	XMJYAIRPGCIKAC-AWEZNQCLSA-N	431.880	1.577	50	20	IDGD	
O=C(Cc1cc(F)ccc1[N+](=O)[O-])NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Cl)C[C@@H]21	1792229384	HLUCAXLKQSGSSN-CDUAKIRFSA-N	431.823	1.791	50	20	IDGD	
O=C(/C=C/c1ccccc1[N+](=O)[O-])NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21	1792244953	CNJUONGNIYCQPB-OLNGHUQWSA-N	437.880	1.187	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cnc2ccccn12	1792933311	RDJDFGTXELAITG-FLTUCWPJSA-N	435.322	1.250	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1COc2ccccc2O1	1793846992	YBEOKGSOYQHNTC-ZWNONLRRSA-N	439.306	1.199	50	20	IDGD	
COc1ccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](O)CCl)C3)c(Cl)c1	1793861919	LAAGIGSFMIILEW-VLWCASSMSA-N	431.316	1.080	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC=C(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Cl)C3)C1	1793873523	YNOYHQAXYCXTIW-QKPAOTATSA-N	445.919	1.678	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCNC(=O)c1ccc[nH]1	1794305281	TXXQGNDZZMPIFK-XQLPTFJDSA-N	439.354	1.804	50	20	IDGD	
Cc1ccccc1OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2	1795304148	YISPOPOVOUJOKK-CCWDJLKJSA-N	425.323	1.748	50	20	IDGD	
Cc1cc(Cl)ccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1	1796185842	WENBHYBMAYDWJJ-REPLKXPHSA-N	426.709	1.894	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)c1cc2cc[nH]c2cc1F	1796191921	PVBSRZVLNKDQJU-BCDXTJNWSA-N	435.264	1.552	50	20	IDGD	
CC(=O)N[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Cl)c1cccc(Cl)c1	1796367906	ZTRXSVQIFMLACP-IEHFGQBSSA-N	446.306	1.641	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(F)cc1)C2	1796441521	MTPQKPGARHFURN-WVNFENISSA-N	441.463	1.163	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2c(c1)OCCO2	1796791213	ITYAXPFLMXKFAG-CWPLJXCYSA-N	434.565	1.513	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1nc2ccccc2[nH]1	1796823139	PHLWPTXFVGHPDG-OQMKEHIESA-N	435.322	1.940	50	20	IDGD	
COC(=O)c1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](F)Br)C3)cn1	1797032526	HFDSNAKOESNEPM-GFQSEFKGSA-N	428.258	1.811	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2ncccn2n1	1797381513	ZAAQEPYUTVEEOR-ZWUHOBOKSA-N	436.310	1.106	50	20	IDGD	
Cc1cc(NC(=O)CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@](C)(Cl)CCl)no1	1799275492	SORUNJGJSXQAEK-GWLLULGVSA-N	447.319	1.138	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)NC(=O)OC(C)(C)C	1800597828	SUGAJCZNLSHKOR-WPLOAARJSA-N	448.358	1.641	50	20	IDGD	
CC(=O)Nc1ccccc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)Br	1800763952	PMZMAIHQOYWOSL-DPYKFYPSSA-N	438.322	1.632	50	20	IDGD	
COc1ccccc1CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCC(=O)NN(C)C	1802334677	NUBPELLAHYPDRR-REPLKXPHSA-N	430.549	1.639	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@H]1CCN(C(=O)CSC(=N)N)[C@H]1c1cccnc1	1803007711	FJTBVHQLEVRBCS-KYOSRNDESA-N	442.383	1.745	50	20	IDGD	
Cc1cc(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)c(C)o1	1805562243	SWAJCSDHMSPLEN-KNQAVFIVSA-N	447.300	1.605	50	20	IDGD	
CCOC(=O)/C=C/C(=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@@H]1c1cccnc1	1806297591	MGBKNEKXJGIRPK-ZJTGAIKZSA-N	442.285	1.897	50	20	IDGD	
Cc1cc(CCC(=O)N2CCCC3(CCN(C(=O)CCC(=O)NN(C)C)CC3)C2)ccn1	1806811569	SEIMGRAUEGAVKS-UHFFFAOYSA-N	443.592	1.927	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@H]1CCN(C(=O)CN2CCOC2=O)[C@@H]1c1cccnc1	1808290948	ZRUWTXANKDBFFQ-OGWOLHLISA-N	443.331	1.776	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@H]1c1cccnc1)[C@H](F)Cl	1808319005	KLQHOWXAOZWWOE-CQDKDKBSSA-N	444.941	1.482	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)c2cc[n+]([O-])cc2)[C@@H]1c1cccnc1	1811197394	CDWQGLXIERVHTA-XKQJLSEDSA-N	433.306	1.818	50	20	IDGD	
Cc1c[nH]cc1C(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1813070543	JZWFJLWSZSGIQB-UWJYYQICSA-N	426.521	1.411	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1CCc2nc(NC(=O)Cn3cccn3)sc2C1	1815707250	ZOQHHCYNHARWCL-WDEREUQCSA-N	426.340	1.983	50	20	IDGD	
COc1ncccc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1	1817471414	YZICUAHPGHVEBX-SFHVURJKSA-N	449.276	1.113	50	20	IDGD	
Cc1cc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2cnccc2C(=O)NN)CC3)c[nH]1	1817756165	LXSVTVQKVNLLPL-GFCCVEGCSA-N	439.501	1.318	50	20	IDGD	
C[C@H](Br)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCN2CCOCC2)[nH]n1	1822184828	WUWSDAZOCHSSGE-DZGCQCFKSA-N	442.358	1.908	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnc(N(C)C)o2)[nH]n1	1822412732	HKHBVUGMYHORFO-CQSZACIVSA-N	446.512	1.143	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnn3c2CCC3)[nH]n1	1822415688	PCVZWCNHYDXSQG-KRWDZBQOSA-N	442.524	1.231	50	20	IDGD	
C=C[C@@H](O)C(C)(C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1	1822416150	RWGMIYSUMSFTOU-JKSUJKDBSA-N	434.541	1.348	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)N[C@H]1CCc2nc(NC(=O)[C@](C)(Cl)CCl)sc2C1	1822863940	UXRBOOGKZFOOHH-OMQMVUIESA-N	436.365	1.738	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](CC)NC(N)=O)CC2	1825446888	KCLHNSSEIYJOQI-LPEHRKFASA-N	446.371	1.676	50	20	IDGD	
CCS(=O)(=O)N[C@H](C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](F)Cl)CC1	1827608267	NWIWVRZNLNRBSC-VHDGCEQUSA-N	425.954	1.468	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H](F)Cl)CC1	1827609117	NFZMTZWMNAQDPL-HZPDHXFCSA-N	425.892	1.453	50	20	IDGD	
Cc1cc(C(=O)NCC(=O)N2CCCC[C@H]2C2CCN(C(=O)[C@H](F)Cl)CC2)no1	1828986327	LQFLCHHLTBBFIN-RDJZCZTQSA-N	428.892	1.867	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H](F)Br)CC1	1829091622	IIVFIMLHDJQNRG-XNRPHZJLSA-N	432.334	1.987	50	20	IDGD	
Cc1cccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)c1F	1830101952	YYGFLUKHSJXUJS-MAUKXSAKSA-N	447.276	1.895	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@H](F)Br)CC1	1830378049	HPSVENLOCJBORM-MJBXVCDLSA-N	435.338	1.744	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3nccs3)C2)C1	1830537086	BFNGRCBQGBSRCQ-WBMJQRKESA-N	432.340	1.244	50	20	IDGD	
CC(C)c1ccc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)cc1	1830734946	BEJTYRVOOGNDAN-UGKGYDQZSA-N	438.952	1.409	50	20	IDGD	
CCCNC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](Cl)CCC)C2)C1	1831195500	DEELRCWMHMUXIN-OXQOHEQNSA-N	431.961	1.157	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3c4c(nn3C)CCC4)C2)C1	1831653133	BAJXNHGKFNSQKG-HRAATJIYSA-N	438.956	1.386	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)CS(=O)(=O)CC)CC2)CC1	1833451207	OIWNPRJGQVVDEF-KRWDZBQOSA-N	436.018	1.400	50	20	IDGD	
CCOc1cnc(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](F)Cl)CC3)CC2)cn1	1833950943	ORPPSPNCXNTYOM-QGZVFWFLSA-N	427.908	1.595	50	20	IDGD	
Cn1ccc(CC(=O)N2CCC(N3CCC(NC(=O)CCBr)CC3)CC2)n1	1834421931	WCYOOSSMBFTRKH-UHFFFAOYSA-N	440.386	1.319	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(O)cn3)CCO2)C1	1834588035	FAFLFYNGORSDEL-QZTJIDSGSA-N	432.304	1.094	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccc(F)cc3)CCO2)C1	1835052161	TWOWCKCBJXONGH-KUHUBIRLSA-N	443.313	1.608	50	20	IDGD	
COc1nccc(C(=O)N2CCC(N3CCC(NC(=O)[C@@H](F)Cl)CC3)CC2)c1F	1835079838	VREJLFWCHHVWMH-MRXNPFEDSA-N	430.883	1.949	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@H]3Cc4ccccc4O3)CC2)CC1	1835478658	CJJUZAYYLGHOCV-PZJWPPBQSA-N	449.979	1.816	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)CCNC(=S)NC)CC2)CC1	1835741932	TVMXOMJKZLNHNF-MRXNPFEDSA-N	432.034	1.059	50	20	IDGD	
CN1CCCC[C@@H]1C(=O)N1CCC(N2CCC(NC(=O)CO[Si](C)(C)C)CC2)CC1	1835835073	MICYJXGYSRDORU-HXUWFJFHSA-N	438.689	1.894	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cc(C(C)C)[nH]n3)CC2)CC1	1836159137	HWWMHCQQXRXIMU-QGZVFWFLSA-N	439.988	1.972	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)C3CCC(O)CC3)CC2)CC1)[C@H](F)Br	1836414282	BYXOMGHBHNMRBJ-IMRCBTMISA-N	448.377	1.800	50	20	IDGD	
COc1ccc2[nH]cc(C(=O)N3CCO[C@]4(COCCN(C(=O)[C@H](F)Cl)C4)C3)c2c1	1836923809	VKWPNRYGKNOQOZ-FXAWDEMLSA-N	439.871	1.781	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1n[nH]c3ccccc13)CCO2	1836941123	KLFZCCUJZVIBLB-NRFANRHFSA-N	446.580	1.484	50	20	IDGD	
CCOC(=O)/C=C/C(=O)N1CCC(OC2CCN(C(=O)CO[Si](C)(C)C)CC2)CC1	1837638948	NMZSWLQBMUHGIV-VOTSOKGWSA-N	440.613	1.956	50	20	IDGD	
CC(=O)N/C(C)=C/C(=O)N1CCC(OC2CCN(C(=O)CCBr)CC2)CC1	1837655012	JWNVSFPHYODKJG-BUHFOSPRSA-N	444.370	1.810	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccnc3S)C2)C1	1837708611	MGUROIVNUAIAQP-IBGZPJMESA-N	439.610	1.292	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4cccnc4[nH]3)C2)C1	1837713262	RIVLVXXWMOGWEM-NRFANRHFSA-N	446.580	1.484	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)[C@H]3CCC(=O)N3)CC2)CC1	1837783436	FCESKGHSTJGTKT-IUODEOHRSA-N	430.343	1.047	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccnc(OC)c3)CCO2)C1	1837973995	NTGIHHCYOBAJDU-OXQOHEQNSA-N	425.913	1.568	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(OCC)nn3)CCO2)C1	1838829485	AXSGPKVIAURFAA-YWZLYKJASA-N	440.928	1.353	50	20	IDGD	
COc1ccccc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)Br)C2)C1	1838877766	XVPIGJDFUWTEMN-LIRRHRJNSA-N	441.322	1.549	50	20	IDGD	
Cc1cnc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)cn1	1839151148	JMMVWIUJQGCRLC-MSOLQXFVSA-N	431.320	1.091	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3C[C@H]4CC[C@@H]3O4)C2)C1	1839155158	LSNXOBAWPJKKIZ-HIGHGGLBSA-N	435.348	1.247	50	20	IDGD	
O=C(C(Cl)Cl)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1Cc3ccccc3N1)CCO2	1839736949	RNWSMNFTPJLSRL-HNAYVOBHSA-N	428.316	1.283	50	20	IDGD	
C/C=C/C(=O)N1CCOC[C@@]2(C1)CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)CCO2	1839744209	UXPNIVMHMOJFML-XOGKJJLSSA-N	431.439	1.904	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(F)cn3C)C2)C1	1840033016	QPBJLEHHJBVSBH-SJCJKPOMSA-N	432.290	1.018	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(F)ccc3C)C2)C1	1840149350	MHSTXZRLCWVNBO-YLJYHZDGSA-N	428.888	1.458	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(F)(F)Cl)CCO2	1840286613	GFTVLGCQOAMHPK-MFKMUULPSA-N	433.677	1.448	50	20	IDGD	
Cc1nccn1CCCC(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1840386015	CZPIOXHFKJGDCX-NRFANRHFSA-N	440.972	1.693	50	20	IDGD	
CC(C)N1CCC[C@H]1C(=O)N1CCO[C@]2(COCCN(C(=O)CCBr)C2)C1	1840582278	XFVZIMJOOVGMJY-LPHOPBHVSA-N	446.386	1.101	50	20	IDGD	
O=C(c1c[nH]c2cccc(Cl)c12)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843014085	VTUAMFSHRSTESK-UHFFFAOYSA-N	437.692	1.632	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)[C@@H](C)n1ccnn1)C2	1844693229	KXWOAQSBRQRYAP-CYBMUJFWSA-N	442.432	1.190	50	20	IDGD	
COc1ccnc(C(=O)N2CCCC23CN(C(=O)[C@H](C)CBr)C3)c1OC	1844840648	UIDKNOGUFFGGHL-GFCCVEGCSA-N	426.311	1.947	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@H]1CN(C(=O)OC(C)(C)C)CCO1)C2	1846360452	MULLWRJGFIHKNS-CABCVRRESA-N	445.944	1.080	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2ccccc2OC(F)F)C1	1846859892	HPVIEJBAVZVLPN-UHFFFAOYSA-N	445.426	1.417	50	20	IDGD	
CC[C@H](C)[C@H](O)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O	1847831234	DHEWTGDEFKOFFF-ZQINRCPSSA-N	433.461	1.743	50	20	IDGD	
Cn1cnc(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)c1	1848095955	ZDTXYANZIHZAHE-QEJZJMRPSA-N	425.917	1.368	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(CNC(=O)NNC(=O)Cc2ccc(F)cc2)cc1	10408776	DEPQIEFXXHPGDE-UHFFFAOYSA-N	436.509	1.929	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)Cc2ccc(C(=O)NNC(=O)c3cnn(C)c3)cc2)cc1	17442894	QSKVWYKBOZBNLD-UHFFFAOYSA-N	441.513	1.624	50	20	IDGD	
CCc1ccc(N2C[C@H](C(=O)OCC(=O)NNC(=O)Cc3nc(C)cs3)CC2=O)cc1	105214560	LQUIFLGQTQJDGY-OAHLLOKOSA-N	444.513	1.300	50	20	IDGD	
CCCS(=O)(=O)N1CCCC[C@@H]1C(=O)NNC(=O)c1ccc(Br)s1	108751897	UTKNTMFZYRZBMT-SNVBAGLBSA-N	438.369	1.866	50	20	IDGD	
Cc1ccc(CN2C[C@@H](C(=O)NNc3ccc(S(=O)(=O)NC4CC4)cc3)CC2=O)cc1	110884060	ZZUAKIOFHYGHNP-KRWDZBQOSA-N	442.541	1.928	50	20	IDGD	
Cc1ccccc1CN1CCCN(CC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)CC1	116758915	ZKHIIFOJZBKNFS-UHFFFAOYSA-N	425.489	1.872	50	20	IDGD	
CCN(CC)CCOc1ccc(C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1	117597868	WZBWTELUTJKFKO-UHFFFAOYSA-N	437.500	1.729	50	20	IDGD	
CN(C)N(C(=O)[C@@H]1CS[C@]2(c3ccc(F)cc3)CCC(=O)N12)[C@H]1CCS(=O)(=O)C1	728179661	NPSRBDHVQQXGRY-BXWFABGCSA-N	441.550	1.209	50	20	IDGD	
CN(C)N(C(=O)c1ccc2c(c1)C(=O)N(Cc1ccco1)C2=O)[C@H]1CCS(=O)(=O)C1	728180190	PYPMYIWNBKFWPR-AWEZNQCLSA-N	431.470	1.182	50	20	IDGD	
C=CCNC(=O)c1cccc(S(=O)(=O)NNC(=O)c2cccc(OC(F)F)c2)c1	728510540	NCFGCQCDTFTSMP-UHFFFAOYSA-N	425.413	1.827	50	20	IDGD	
Cc1cnc2c(S(=O)(=O)NNC(=O)C3CCN(c4ncccn4)CC3)cccc2c1	728853795	BKNPXXMXYRADFT-UHFFFAOYSA-N	426.502	1.559	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)CCc2c(C)nc3[nH]n(C)c(=O)c3c2C)cc1OC	729281820	FIHVJQCJDBJKBY-UHFFFAOYSA-N	441.488	1.680	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)[C@H](Cc1ccc(F)cc1)n1nnnc1C	729297511	OTPVTWMXGWQWET-INIZCTEOSA-N	428.424	1.139	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@H]2C(=O)NNC(=O)CNc2ccccc2)c(OC)c1	729513239	DUGMUNAWDFJCOM-SFHVURJKSA-N	426.473	1.568	50	20	IDGD	
Cc1ccc(-n2c(C)cc(C=NNC(=O)CSc3nn(C)c(=O)n(C)c3=O)c2C)cc1	730568901	GFSVOXMJRMRPFO-UHFFFAOYSA-N	440.529	1.437	50	20	IDGD	
CC(C)n1nc(C(=O)NNS(=O)(=O)CCOCC(F)(F)F)c2ccccc2c1=O	731902346	NJQDNPDFKFDMTE-UHFFFAOYSA-N	436.412	1.121	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@H]2Cc3ccccc3CN2Cc2ccccc2)ccc1=O	732064977	LWSHVYUXTOCFJK-OAQYLSRUSA-N	431.496	1.651	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)[C@@H]2CC(=O)N(c3cccc4ccccc34)C2)C[C@@H](C)O1	732259434	DLQROHBCTHQMMX-ZIFCJYIRSA-N	438.528	1.839	50	20	IDGD	
Cc1cc(C)cc(C(=O)N2CCC[C@H](C(=O)NNC(=O)CCN3C[C@H](C)O[C@H](C)C3)C2)c1	732264734	WLVYEQQCXSDDFL-ZCNNSNEGSA-N	444.576	1.802	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)NCCCNC(=O)c2ccc(F)cc2)nc2ccccc21	732468183	FPTQOWKORGBUEE-UHFFFAOYSA-N	426.452	1.405	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCc2ccc(Cl)cc2)cc(OC)c1OCC(N)=O	733003599	UZFVODFESICHQN-UHFFFAOYSA-N	436.852	1.366	50	20	IDGD	
O=C(NNC(=O)[C@H]1CC(=O)N(c2ccc(F)cc2F)C1)c1cnn(-c2ccccc2)c1	733108105	GBEBAPCHRSQAJP-ZDUSSCGKSA-N	425.395	1.965	50	20	IDGD	
C[C@H](CNC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)Oc1ccccc1	733849047	CZTCJGHSDMUTEL-MRXNPFEDSA-N	448.549	1.111	50	20	IDGD	
CN(C)[C@H](CNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)c1c(F)cccc1F	734675427	ISIBAUPXKQKWMC-QGZVFWFLSA-N	447.490	1.605	50	20	IDGD	
COc1ccccc1[C@H](C)CC(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	735117090	AVFIBPCWJYDLJA-MRXNPFEDSA-N	447.561	1.663	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NN=C(C)[C@H]1CCOC1)N(S(C)(=O)=O)CC2	741756615	LCBFYFIEMOGYCA-DOTOQJQBSA-N	439.534	1.481	50	20	IDGD	
COc1ccc(Cc2nnc(SCC(=O)NNC(=O)c3ccc(C#N)cc3)n2N)cc1	742445340	MVFWTRABSDOJRT-UHFFFAOYSA-N	437.485	1.016	50	20	IDGD	
Cc1nc(-c2ccccn2)nc(NNC(=O)CCN2C(=O)[C@H]3[C@H](C2=O)[C@H]2CC[C@H]3O2)c1C	743414655	XEFIXYVNNGWFNH-JOCBIADPSA-N	436.472	1.151	50	20	IDGD	
CNS(=O)(=O)c1ccc([C@@H](C)NC(=O)NNC(=O)Nc2ccc(N(C)C)cc2)cc1	743559089	XDPMDGSYXLIJSQ-CYBMUJFWSA-N	434.522	1.758	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)N[C@H]1CC(=O)N(CCOc2ccccc2)C1	743636261	GSJAOSZGFDMBKR-HNNXBMFYSA-N	446.891	1.973	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)COc2cccc(N3CCCC3=O)c2)cc1	744524608	HNRNOPVPLSZWCQ-UHFFFAOYSA-N	436.424	1.068	50	20	IDGD	
C[C@H]1C[C@@H](C)CN(C[C@@H](C)NC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)C1	745768331	VXFSITDIQKUAMK-QLFBSQMISA-N	425.555	1.792	50	20	IDGD	
O=C(CCCc1ccccc1)NNC(=O)c1cc(S(=O)(=O)N2CCCC2)ccc1O	745992699	XAKFTXPCHXTXMF-UHFFFAOYSA-N	431.514	1.961	50	20	IDGD	
C[C@](O)(Cc1ccccc1)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	746093925	VIZBTONOSUEXJH-QFIPXVFZSA-N	445.541	1.616	50	20	IDGD	
CSCC[C@@H](NC(=O)c1ccc2ccccc2n1)C(=O)NNc1nnc(C)c(O)n1	747863967	PQZCOBUTVFWPAH-OAHLLOKOSA-N	427.490	1.429	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1=O	748632988	FRLPEXSZJGMNPA-DOMZBBRYSA-N	444.435	1.165	50	20	IDGD	
CN1CCC[C@@H](NC(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)C1=O	748663629	PCWPLEXZIAPFKV-GOSISDBHSA-N	448.483	1.010	50	20	IDGD	
O=C(NCC1CCOCC1)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	749187597	ZXGFBKRPOXJONX-UHFFFAOYSA-N	438.531	1.920	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H](CCC#N)c2ccccc2)c1	749219412	CDOKWSGNJYWCIS-SFHVURJKSA-N	429.502	1.926	50	20	IDGD	
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)NNC(=O)CNC(=O)c1cccs1	749588896	PDKWJSVPHRSTLL-NVXWUHKLSA-N	429.546	1.719	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)CNS(=O)(=O)c2ccc(Cl)s2)c1	749838640	RFOMZHJGVUIWTD-UHFFFAOYSA-N	433.895	1.158	50	20	IDGD	
COC(=O)[C@H]1CCC[C@H](C(=O)OCC(=O)NNC(=O)c2cc(Cl)ccc2OC)C1	750921612	KERVWDRSOAHGSN-RYUDHWBXSA-N	426.853	1.632	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@H](C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)C1	751060721	KRSZZCBDTPTHGX-JKSUJKDBSA-N	438.550	1.045	50	20	IDGD	
CC(Cc1ccc(C(F)(F)F)cc1)=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O	751133835	GYIHBPHNZIFVSQ-UHFFFAOYSA-N	429.424	1.325	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Cc2cccc(Br)c2)c1	751289300	BSNDWBCKIPLHSZ-UHFFFAOYSA-N	440.319	1.703	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)[C@@H]2CCCN(C(=O)c3ccc4n[nH]cc4c3)C2)c1	751296723	LWNOLAGEJUEYRI-QGZVFWFLSA-N	434.500	1.942	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CCCNS(=O)(=O)c2ccc3c(c2)OCCCO3)o1	752524253	AFQZOSRICBUWKB-UHFFFAOYSA-N	437.474	1.269	50	20	IDGD	
C[C@@H](C[S@@](C)=O)NC(=O)NNc1ccc(S(=O)(=O)NC2CCCCCCC2)cn1	753358461	JUGWNQTVHIMNHB-HJFSHJIFSA-N	445.611	1.866	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)N[C@@H]2[C@@H]3CCO[C@@H]3C23CCC3)c2ccccc2c1=O	754677588	WHSKLUUKWYIWEI-JQHSSLGASA-N	425.489	1.879	50	20	IDGD	
C[C@H](C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1)c1ccc([N+](=O)[O-])cc1F	755068743	SNGPHSZOHVYLKA-GTNSWQLSSA-N	447.375	1.368	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1	755358700	GKTLFYWDEPFTRP-ZCFIWIBFSA-N	436.334	1.815	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)Nc2cc(S(=O)(=O)N3CCCCC3)ccc2N(C)C)n[nH]1	755434136	GEOMRLQPEMBTSM-UHFFFAOYSA-N	449.537	1.425	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)n([C@@H]2CCS(=O)(=O)C2)n1	755538121	ZQYKNLFFSOAZSU-CHWSQXEVSA-N	439.469	1.310	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)Nc1ccc(N2CCCC2=O)c(Cl)c1	755590694	ANTUYSLPBXWLFR-UHFFFAOYSA-N	440.851	1.909	50	20	IDGD	
COc1cc(C=NNC(=O)Cc2cn3ccccc3n2)c([N+](=O)[O-])cc1OCC(=O)O	755754817	FLMRJXDPFXJWRE-UHFFFAOYSA-N	427.373	1.407	50	20	IDGD	
O=C1CN(c2ccc(NC(=O)NNC(=O)COc3ccc(F)cc3)cc2Cl)CCN1	755938683	XIRATIOVLKNJNI-UHFFFAOYSA-N	435.843	1.647	50	20	IDGD	
CCOC(=O)[C@H](C)NC(=O)c1ccc(NC(=O)NNC(=O)COc2ccc(C)cc2)cc1	756790642	QIPXGWCFIHDYHW-HNNXBMFYSA-N	442.472	1.908	50	20	IDGD	
CCOc1cc(C#N)cc(Br)c1OCC(=O)NNc1ccc(C(N)=O)nn1	757408362	SGOIPTSPPRSVMM-UHFFFAOYSA-N	435.238	1.130	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)Nc1ccc(-n2ncn(C)c2=O)cc1	757862442	IBTOWJDJHCNNIZ-UHFFFAOYSA-N	428.474	1.525	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1ccccc1NCCc1ccc(Cl)cc1	758028141	ZCGBYSBNXMRPHP-ZDUSSCGKSA-N	438.937	1.693	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N[C@H]2CN(C(=O)OC(C)(C)C)C[C@@H]2C#N)c(OC)c1	758757180	FYGVZZYIFFQGLE-WFASDCNBSA-N	433.465	1.407	50	20	IDGD	
O=C(NC[C@@H]1CSCCN1Cc1ccccc1)NNC(=O)[C@H]1COc2ccccc2O1	759199906	HBJJOCGYCOIGHD-YLJYHZDGSA-N	442.541	1.774	50	20	IDGD	
C[C@@H](CC(=O)NNC(=O)c1cccc(Cl)c1)NS(=O)(=O)c1cccnc1Cl	760263514	FDALPGGQNXPLNV-JTQLQIEISA-N	431.301	1.907	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NCCOc2ncccc2Cl)cc1	760834373	OYDOSTBAOUIQCC-UHFFFAOYSA-N	427.870	1.553	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)C(=O)Nc1c(F)cccc1Br	763445425	HITAOEPNWZGADM-UHFFFAOYSA-N	425.170	1.896	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)c2ccncc2)sc2c1CCCS2	763461936	FDQJZYSONBSDFL-UHFFFAOYSA-N	434.499	1.758	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccncc2)n(-c2ccccc2C(F)(F)F)n1	763462411	OOFWCXIPYSYQFB-UHFFFAOYSA-N	432.362	1.994	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)C(=O)Nc1ccccc1Cl	763530274	HFPFJSYRKDLJLQ-UHFFFAOYSA-N	429.908	1.638	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2ccccc2O)cc(OC)c1Br	763531612	PQVDBVYNPMKCHA-UHFFFAOYSA-N	438.234	1.572	50	20	IDGD	
CCCOc1cccc(NC(=O)C(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)c1	763538546	DBUVIURAFWADCV-UHFFFAOYSA-N	431.445	1.901	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(OCC(F)(F)F)nc2)cc1C	763664316	ADFXDODNVIARHO-UHFFFAOYSA-N	440.378	1.804	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2cc(N3CCCC3=O)ccc2F)c1	763665893	QOBMJWFNFMPDSX-UHFFFAOYSA-N	442.447	1.734	50	20	IDGD	
CNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2cc(C)ccc2C)cc1Cl	763668645	OSAYOZATXXWLCI-UHFFFAOYSA-N	432.864	1.481	50	20	IDGD	
Cn1c(C2CC2)nc2cc(NC(=O)C(=O)NNC(=O)COc3ccc(C#N)cc3)ccc21	763675704	ZEYVQOKPERZRBF-UHFFFAOYSA-N	432.440	1.487	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)COc2ccc(C)c(C)c2)ccc1Cl	763680576	RFKPSEAOKAEOCS-UHFFFAOYSA-N	433.848	1.908	50	20	IDGD	
O=C(COc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1cccc(Cn2cncn2)c1	763695013	NFJZCCGOKLZIOL-UHFFFAOYSA-N	428.836	1.145	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)C(=O)Nc2cc(N3CCCC3=O)ccc2F)c1	763752917	ATOURCINFKTVED-UHFFFAOYSA-N	427.436	1.418	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(N(C)C)c2)cc1Cl	763760928	WSCVAEXOTDUPDI-UHFFFAOYSA-N	434.880	1.831	50	20	IDGD	
NS(=O)(=O)c1ccc(C(=O)NNc2nnc(-c3ccccc3)n2-c2ccccc2)cn1	763780754	VYJJSURPUSPEHQ-UHFFFAOYSA-N	435.469	1.734	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)cccc1N1CCOC1=O	763852893	YUCWPGJWFKEXNB-CYBMUJFWSA-N	444.419	1.644	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)Cn2nc(C)cc2C)sc2c1CCC2	763891745	SFPJUFGBDNQZMG-UHFFFAOYSA-N	433.490	1.013	50	20	IDGD	
Cc1nc(COc2ccc(NC(=O)C(=O)NNC(=O)Cc3ccc(F)cc3)cc2)no1	763918441	CZVOEIBKZMSAPB-UHFFFAOYSA-N	427.392	1.425	50	20	IDGD	
CCOC(=O)c1c(C)csc1NC(=O)C(=O)NNC(=O)c1cc(Br)c[nH]1	763995859	AKZQKSJLDYQRDP-UHFFFAOYSA-N	443.279	1.724	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)c(C)c1	763995916	RZSBAMAUAJNDEK-UHFFFAOYSA-N	439.266	1.511	50	20	IDGD	
O=C(NNC(=O)c1ccc[nH]1)C(=O)Nc1ccnn1Cc1ccc(OC(F)(F)F)cc1	763999091	NESJDMNJGRSMHG-UHFFFAOYSA-N	436.350	1.558	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1cccc(Cl)c1-n1cncn1	764020444	YPWQLNNYMMVJSV-UHFFFAOYSA-N	449.254	1.982	50	20	IDGD	
O=C(NNC(=O)c1cnccn1)C(=O)Nc1ccc(Br)c(Cl)c1Cl	764023998	HIDVFSVACPCRMI-UHFFFAOYSA-N	433.049	1.946	50	20	IDGD	
O=C(NNC(=O)c1ccc2ccccc2c1)C(=O)Nc1cccn(CC(F)(F)F)c1=O	764062476	YKIYJKRGLSSLRH-UHFFFAOYSA-N	432.358	1.964	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2O1)C(=O)Nc1cnn(-c2ccccc2Cl)c1	764163819	MPXIUYWZNVNFQL-QGZVFWFLSA-N	425.832	1.615	50	20	IDGD	
Cc1ncsc1C(=O)NNC(=O)C(=O)Nc1ccc(-n2nccn2)cc1C(F)(F)F	764247316	QMYHGERCVVIUOZ-UHFFFAOYSA-N	439.379	1.451	50	20	IDGD	
CCN(CC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)CC1CCN(c2ccccn2)CC1	764281157	ZSJUSRLVWIDINQ-UHFFFAOYSA-N	440.504	1.989	50	20	IDGD	
O=C(CCCS(=O)(=O)N1CCCC1)NNc1c(F)cc(C(=O)NC2CC2)cc1F	764333034	CRISPGMJXFSBMQ-UHFFFAOYSA-N	430.477	1.506	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1ccccc1O[C@H](C)C#N	764392618	ILIQHUVMVFIEIR-CYBMUJFWSA-N	428.470	1.864	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1cc(NC(C)=O)ccc1C	764392660	KDBLFPSEEDGCRJ-UHFFFAOYSA-N	430.486	1.840	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)N[C@H](Cc1ccccc1)CN1CCOCC1	764408453	IERZXADTVIJWPX-GOSISDBHSA-N	444.557	1.758	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)C(=O)Nc2ccc3nc(C4CC4)sc3c2)c1	764432137	CNLDDAJIPSQRIL-UHFFFAOYSA-N	438.469	1.927	50	20	IDGD	
COc1cccc(CC(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)c1	765755974	JPQYIDPODSHJAH-UHFFFAOYSA-N	430.936	1.856	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1cc(Cl)ccc1C(=O)N1CCCCC1	766260149	AMIZLFOFCOUDBP-UHFFFAOYSA-N	432.868	1.847	50	20	IDGD	
COc1cc2c(cc1NC(=O)C(=O)NNC(=O)C13CC4CC(CC(C4)C1)C3)NC(=O)CC2	768237402	JUGYKGGDCZPROJ-UHFFFAOYSA-N	440.500	1.882	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2n[nH]c(C(C)C)c2Br)n1	768624186	ITGHMEFLWQEYQP-UHFFFAOYSA-N	444.311	1.607	50	20	IDGD	
CSCCNC(=S)NNC(=O)CN1C(=O)NC2(CCC(C(C)(C)C)CC2)C1=O	769768887	HDGVAURICDXHNK-UHFFFAOYSA-N	429.612	1.372	50	20	IDGD	
COCCOc1ncccc1CNC(=O)NNc1nc(O)c2cnn(C(C)(C)C)c2n1	770340530	IJCBRZHRAIDTSX-UHFFFAOYSA-N	430.469	1.533	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)[C@@H]1CCN(C(=O)OCc2ccccc2)C1	770348920	FRAJLJQGRQNSRM-OAHLLOKOSA-N	430.486	1.284	50	20	IDGD	
C[C@@H](CBr)CN1CCN(S(=O)(=O)c2ccc3c(c2)NC(=O)CO3)CC1	770667713	SEUWZHABERKVFV-LBPRGKRZSA-N	432.340	1.355	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)CCc3nc(O)c4c5c(sc4n3)CCCC5)nc21	770967780	FXOUABAOXVBUHQ-UHFFFAOYSA-N	440.489	1.734	50	20	IDGD	
C[C@H](NS(=O)(=O)c1ccc(C(N)=O)cc1)C(=O)NNc1ccc(Br)cc1	770968058	IXJFBUQOWNHCHH-JTQLQIEISA-N	441.307	1.358	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)c3cccc(CS(=O)(=O)NC(C)(C)C)c3)nc21	770980725	TYLJPMMYMAHQQG-UHFFFAOYSA-N	433.494	1.044	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)[C@@H]1CC(=O)N(c2c(F)cccc2F)C1	771148808	JMOJRQRXWQASOS-OAHLLOKOSA-N	445.422	1.559	50	20	IDGD	
CS(=O)(=O)Cc1nc2ccccc2n1CC(=O)NNc1ccnc(Br)c1	771551713	KJEJYKUSPDTYKX-UHFFFAOYSA-N	438.307	1.882	50	20	IDGD	
Cc1cccc(N2C[C@H](C(=O)NNC(=O)C(=O)NCc3ccc(Cl)cc3)CC2=O)c1C	772195799	SNBAXBNAZXMRIQ-MRXNPFEDSA-N	442.903	1.774	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)o1	772952676	IXUSZMZGBHADNN-LBPRGKRZSA-N	441.893	1.946	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccc(CC(=O)N(C)C)cc1	774007569	BXQNXICWLRROQB-CYBMUJFWSA-N	446.891	1.524	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNS(=O)(=O)c1ccc(Br)cc1F	775287127	KAMYQYYGPJLGFK-UHFFFAOYSA-N	426.264	1.422	50	20	IDGD	
CCN(C)C(=O)CNC(=O)/C(C#N)=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	775953329	GXYLFAIFWYTHQK-XNTDXEJSSA-N	442.907	1.580	50	20	IDGD	
Cc1cccc2c(=O)c(C(=O)NNC(=O)c3ccc(Cl)c(S(N)(=O)=O)c3)c[nH]c12	776101450	HMSFZLABNLUKSI-UHFFFAOYSA-N	434.861	1.212	50	20	IDGD	
O=C(NN=Cc1cccc(Br)c1OC(F)F)N[C@H]1CCS(=O)(=O)C1	776766767	ULHCXPMJSPTPFM-VIFPVBQESA-N	426.239	1.871	50	20	IDGD	
O=C([C@H]1CCCN1Cc1ccc(F)cc1)N1CCN(S(=O)(=O)CBr)CC1	777778081	VWGZQCMBFAELOL-MRXNPFEDSA-N	448.358	1.617	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)CCC(=O)N2CC(=O)Nc3ccccc32)nc1C	778421555	DMXSJUVHOJYTKO-UHFFFAOYSA-N	426.433	1.170	50	20	IDGD	
O=C(CN1CCC[C@@H]1c1ccc2c(c1)OCCO2)NNC(=O)c1ccc([N+](=O)[O-])cc1	779326027	PRSXSSJKHVQNJY-QGZVFWFLSA-N	426.429	1.964	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2ccc(C#N)c(Cl)c2)CC1	779380321	PNZOKJXJXHSYSD-UHFFFAOYSA-N	434.909	1.300	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2ccc(OC3CCCC3)nc2)ccc1Cl	781664397	YVHMNOHIGQQFIB-UHFFFAOYSA-N	438.893	1.779	50	20	IDGD	
CC(C)[C@H]1C[C@@H](CC(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)CCO1	781996791	WQCMNKGZRWJSJY-FUHWJXTLSA-N	425.551	1.992	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccc(Br)cc2F)cn1	783081167	NMOQUMDMXLTSAY-UHFFFAOYSA-N	431.243	1.469	50	20	IDGD	
CCCOc1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)c(C)c1	783263692	JTQMLPFQGFHEPK-UHFFFAOYSA-N	449.533	1.947	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2ccccc2OCC(=O)Nc2cccnc2)nc(C)n1	783327205	ZUNDMFAXYPOXAF-UHFFFAOYSA-N	435.444	1.588	50	20	IDGD	
Cc1ccccc1NC(=O)NNC(=O)C(=O)Nc1ccc(CN2C(=O)CSC2=O)cc1	783416838	CEWJYVMCVRSDBS-UHFFFAOYSA-N	441.469	1.982	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)[C@@H]1CC=CC[C@H]1C(=O)N1CCOCC1	784456828	OVEYSGFDTCNBKG-HZPDHXFCSA-N	433.530	1.376	50	20	IDGD	
O=C(NNc1nc(-c2ccccn2)nc2c1CCC2)[C@@H]1CC=CC[C@@H]1C(=O)N1CCOCC1	784784007	LQVJBTABOGSOHA-SJORKVTESA-N	448.527	1.912	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)C(=O)NNc1ccc(Cl)nc1	784875430	SGSIWNCAVITNHU-UHFFFAOYSA-N	441.897	1.466	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2nccn(C)c2=O)n(-c2cccc(Br)c2)n1	785089789	GGPKKINYFSFHAN-UHFFFAOYSA-N	446.265	1.119	50	20	IDGD	
CC[C@]1(C)Oc2ccc(NC(=O)C(=O)NNC(=O)COc3ccc(OC)cc3)cc2O1	785992052	VIERDTYDVVWYFO-OAQYLSRUSA-N	429.429	1.758	50	20	IDGD	
CC(=O)CSCC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	786633416	BRLZZVVVNMQNAT-UHFFFAOYSA-N	435.527	1.248	50	20	IDGD	
O=C1CN(c2ccnc(C(=O)NNc3ccc(S(=O)(=O)C(F)(F)F)cc3)c2)CCN1	787134723	FBJCCPCOTKKDOH-UHFFFAOYSA-N	443.407	1.068	50	20	IDGD	
CN(C)[C@@H]1CCOc2c(NC(=O)C(=O)NNC(=O)COc3ccccc3F)cccc21	789732324	OVWPTFVENBOFIY-MRXNPFEDSA-N	430.436	1.376	50	20	IDGD	
CN(C)[C@H]1CCOc2c(NC(=O)C(=O)NNC(=O)COc3ccc(F)cc3)cccc21	789740346	FPKUNLRNAFNRGH-KRWDZBQOSA-N	430.436	1.376	50	20	IDGD	
C[S@@](=O)C1(CNC(=O)NNC(=O)COc2ccc(OCc3ccccc3)cc2)CC1	799715277	CJLLTHLPXDOQNQ-SSEXGKCCSA-N	431.514	1.886	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2CSCN2C(=O)c2ccc(Cl)cc2)cc1	801109291	JMKHDIGAQKTBFM-MRXNPFEDSA-N	446.916	1.950	50	20	IDGD	
Cc1cc(F)cc2c1S(=O)(=O)N(CC(=O)NNC(=O)c1ccccc1Cl)C2=O	804917280	MHGLQBUORRMWDN-UHFFFAOYSA-N	425.825	1.393	50	20	IDGD	
COCCNC(=O)[C@H](C)OC(=O)c1ccc(NC(=O)NNC(=O)c2ccc(C)o2)cc1	806750845	MOIDWSCHKGPIPQ-ZDUSSCGKSA-N	432.433	1.362	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2ccc3c(c2)CCC=C3)CC1	806872962	PRTXZIXPFBQPJJ-UHFFFAOYSA-N	427.530	1.734	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1nc(Cc2ccccc2)cs1	806974891	YCWGHRLXAICLJZ-UHFFFAOYSA-N	435.465	1.770	50	20	IDGD	
Cc1ccc([C@H](CNC(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)N2CCOCC2)o1	807023249	GRWWNCCVUVSJSV-QAPCUYQASA-N	434.468	1.898	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNc2nc3ccccn3n2)c(C)cc1Br	807033484	RFOWGQJXOCKXOT-UHFFFAOYSA-N	447.249	1.669	50	20	IDGD	
Cc1cc([N+](=O)[O-])ccc1NNC(=O)C(=O)Nc1cccc(N2C(=O)CN(C)C2=O)c1	807455219	HSNNNZGGZLFPTH-UHFFFAOYSA-N	426.389	1.383	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)NC2CCC3(CC2)NC(=O)NC3=O)c1	807546429	MTKIURVMTGJYBC-UHFFFAOYSA-N	431.493	1.348	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H](N2CCN(C(=O)NNC(=O)c3cccc(C#N)c3)CC2)C1	808264881	SBCTWPVYUCFTDW-GOSISDBHSA-N	442.520	1.540	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(Oc3ccnc(C#N)c3)cc2)c1O	810386616	JYBMHAOMCCTXDY-UHFFFAOYSA-N	447.407	1.859	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(Cl)cc1)NNC(=O)CSc1ccccc1O	810807214	KCMNQGKQCXYHKZ-UHFFFAOYSA-N	429.907	1.264	50	20	IDGD	
CC(C)n1ncc2cc(C(=O)OCC(=O)NNC(=O)[C@H]3COc4ccccc4O3)cnc21	811624719	OLKQATDOOASBFW-QGZVFWFLSA-N	439.428	1.156	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)Nc2ccc(F)c(N3C(=O)CCC3=O)c2)cc1	812984394	DQVTUXYFNBAEDQ-UHFFFAOYSA-N	449.464	1.878	50	20	IDGD	
CN(C)NC(=O)Nc1cccc(NC(=O)CC/N=C2/NS(=O)(=O)c3ccccc32)c1	816406707	ZCFVYWHLDDOBQK-UHFFFAOYSA-N	430.490	1.352	50	20	IDGD	
Cc1nc(N2CCOCC2)nc(O)c1CCC(=O)NNc1ncnc(Cl)c1C(C)C	816486979	ZHDORCLXPQAVRK-UHFFFAOYSA-N	435.916	1.970	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C[C@@H](c2nccn2C)C(F)(F)F)c2ccccc2c1=O	816805891	LLBARTUXUNFADV-ZDUSSCGKSA-N	436.394	1.647	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)c1cc2c(=O)n3ccccc3nc2n1C	817052774	OZHKXFHDEUCLIY-UHFFFAOYSA-N	440.485	1.193	50	20	IDGD	
Cc1nc2[nH]n(C)c(=O)c2c(C)c1CCC(=O)NNc1ccccc1S(=O)(=O)N(C)C	817053645	ACHMISLVUXPNBK-UHFFFAOYSA-N	446.533	1.205	50	20	IDGD	
O=C(NNC(=S)NCCc1cccs1)[C@H]1CCCN1C(=O)c1ccc2c(c1)OCO2	819432162	NPLABWAUTURQKX-OAHLLOKOSA-N	446.554	1.819	50	20	IDGD	
Cc1cc(C)c(OCC(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c(C)c1	824090551	AUBUROUHIYHEIR-GOSISDBHSA-N	428.441	1.521	50	20	IDGD	
CCCCn1c(C)cc(/C=C(\C#N)C(=O)N2CCN(C(=O)CN3CCOCC3)CC2)c1C	827873498	WDBFWPXJMSNWPV-CJLVFECKSA-N	441.576	1.815	50	20	IDGD	
O=C(CCN1CCN(C(c2ccccc2)c2ccccc2)CC1)NNC(=O)Cn1cncn1	879821159	LWBPEALYQDJIQL-UHFFFAOYSA-N	447.543	1.223	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)COc2ccc(Br)cc2F)C[C@@H](C)O1	912920195	XSOUHSXEGKKXQH-VXGBXAGGSA-N	432.290	1.614	50	20	IDGD	
C=CCNC(=S)NNC(=O)c1ccc(Cl)c(S(=O)(=O)NC[C@H]2CCCO2)c1	913435793	UIYGLCBQPRHKPH-GFCCVEGCSA-N	432.955	1.092	50	20	IDGD	
O=C(NC[C@@H](c1ccc(F)cc1)N1CCOCC1)NNc1ccc(-n2cccn2)nn1	915898137	SFROTLCTAKSPIL-KRWDZBQOSA-N	426.456	1.501	50	20	IDGD	
Cc1ccc([C@@H](CNC(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)N2CCOCC2)o1	916227564	CLJUJUPLTRBSHL-NVXWUHKLSA-N	434.468	1.898	50	20	IDGD	
CNS(=O)(=O)c1ccc(CNC(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)s1	916233533	ZSYHXFVIUNSHEM-ZDUSSCGKSA-N	440.547	1.571	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCC2(c3ccccc3)CC2)cc1	916234472	GQBOWNJTEHHEDN-UHFFFAOYSA-N	430.530	1.678	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCCc2cnn(-c3ccccc3)c2)c2ccccc2c1=O	916245028	OUWDWLLNGMAQSM-UHFFFAOYSA-N	445.483	1.789	50	20	IDGD	
CN(C)CCN1CCC(NC(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)CC1	916382997	VYGOKZFUTZEUFT-UHFFFAOYSA-N	437.488	1.632	50	20	IDGD	
CCOc1ccc2cc(C(=O)NNC(=O)CN(C)S(=O)(=O)c3ccc(C)cc3)[nH]c2c1	916736396	OBJCBDONRFPUOC-UHFFFAOYSA-N	444.513	1.957	50	20	IDGD	
O=C(CN1CCCN(C(=O)c2ccsc2)CC1)NNC(=O)c1ccc([N+](=O)[O-])cc1	917409568	SEMRIKDPHPMUNZ-UHFFFAOYSA-N	431.474	1.265	50	20	IDGD	
CN(CC(=O)N([C@@H]1CCS(=O)(=O)C1)N(C)C)C(=O)c1ccc(Br)s1	917621920	KSODXVSXMGTTAA-SNVBAGLBSA-N	438.369	1.075	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)CNC(=O)NCc1ccco1	917922517	UYFFNCMJAVZJGK-LLVKDONJSA-N	439.266	1.456	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2csc(-c3cnn(C)c3)n2)cc1OC	919425336	KPKZFCOZUZAHPP-UHFFFAOYSA-N	445.457	1.179	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCC(=NNC(=O)COc3ccc(C#N)cc3)CC2)cc1	920361396	OCRCMPGABAVIKI-UHFFFAOYSA-N	442.497	1.903	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2nc3c(s2)CCCC3)cc1	920931229	HVRDKIVLUWPNBS-UHFFFAOYSA-N	437.547	1.804	50	20	IDGD	
CC(=O)N1CCc2ccc(S(=O)(=O)NNC(=O)c3cncn3-c3ccccc3)cc21	1318861290	GNJOAYLTAKLLRU-UHFFFAOYSA-N	425.470	1.405	50	20	IDGD	
Cc1nccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](C)Br)C3)n1	1778311945	ATFPESACPPHHME-WBHUJUFNSA-N	425.327	1.696	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Br)C1	1780776851	GRHAKMFTJRYJNJ-MCYUEQNJSA-N	429.714	1.445	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)C(C)(C)Oc3ccc(C)cn3)C2)C1	1780971401	XSCCEVWKUUSXGX-KKSFZXQISA-N	439.940	1.631	50	20	IDGD	
COC(=O)[C@@H]1CC[C@H](C(=O)N2CCO[C@]3(CCN(C(=O)[C@](C)(Cl)CCl)C3)C2)C1	1781225582	MZIYVJBTXVDSFO-WTVLQJKYSA-N	435.348	1.642	50	20	IDGD	
O=C(Cc1cnc2ccccn12)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781325656	PFZZMGWVKWSWPA-WMZOPIPTSA-N	439.285	1.397	50	20	IDGD	
CCN(CC)C[C@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](Cl)COC)C1	1782179378	JNUFLKGRMGDZQF-LXGFNABISA-N	432.005	1.732	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4ccoc4c3)C2)C1	1782327110	AGVLCCZYJPPRAZ-QFIPXVFZSA-N	428.489	1.249	50	20	IDGD	
CCS(=O)(=O)c1ccc(CC(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](F)Cl)CCO3)cc1	1783017197	JTCGYLOZJUUKPL-PKOBYXMFSA-N	446.928	1.387	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cccc(=O)n3C)CCO2)C1	1783344986	VIBDHRYZVRIBCF-FZKQIMNGSA-N	426.311	1.002	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cnn(C(C)(C)C)c3Cl)CCO2)C1	1783873513	QEYHTOYNMIUQNC-AUUYWEPGSA-N	447.363	1.989	50	20	IDGD	
CCc1[nH]nc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Br)C[C@@H]32)c1F	1785793976	AQQMULNZFWBMKK-FIRSBJHFSA-N	435.269	1.395	50	20	IDGD	
O=C1COc2ccc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]4C3)cc2N1	1787446284	ABJIXQYCDGIRDZ-HJXMPXNTSA-N	425.844	1.145	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)[C@@H](F)Br)CCC2)cc1)c1ccc(B(O)O)cc1	1788144625	WDQGTPDGDVIDRN-MRXNPFEDSA-N	449.085	1.805	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)[C@H]1[C@H]2c3ccccc3S[C@H]21	1788618895	YDCNFYQLZXQADS-HRAVXQGUSA-N	436.961	1.454	50	20	IDGD	
COc1cc(C#N)cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)C(Cl)Cl)C[C@@H]32)c1	1789259523	UKVBWGDRDNBXRI-RCBQFDQVSA-N	426.300	1.964	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnn4cccnc34)C[C@@H]21)[C@@H](F)Br	1789926471	ZJWVMWRYZDVXKS-DOERSZECSA-N	440.273	1.013	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3c(C)n[nH]c3C)[C@H]2C1	1789976594	JSCYWOIWACBBAO-HJWJTTGWSA-N	441.370	1.722	50	20	IDGD	
CCN(CC)C[C@@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)CBr)C[C@@H]21	1790595695	VJHAAOUMLJXAPD-ZBRFXRBCSA-N	446.430	1.975	50	20	IDGD	
O=C(Cc1ccccc1O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21	1790898838	UNGFHDAVQSUEII-GZIXRCOHSA-N	429.286	1.605	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)Cc3ccccc3)[C@H]2C1	1790956109	PZZMNJZSCAMVAB-MUGJNUQGSA-N	434.609	1.421	50	20	IDGD	
Cc1nccn1CCCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)Br)[C@H]2C1	1791064614	ATKVUVAEMSXCQP-HJWJTTGWSA-N	441.370	1.735	50	20	IDGD	
O=C(CN1C(=O)CSC1=S)Nc1ccc(C2(NC(=O)[C@@H](O)CCl)CCC2)cc1	1792314711	QAWAVXHCWHHYJV-ZDUSSCGKSA-N	441.962	1.581	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@]3(F)CCCC=C3F)[C@H]2C1	1792330853	UJIRMGXMKASGMF-VCAMNPENSA-N	442.507	1.085	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CNc1ccc(F)cc1)C2	1792868075	SPDRYXWBCXOZKB-FLTUCWPJSA-N	442.329	1.858	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CSc1ccc(F)cc1F)C2)[C@H](O)CCl	1792974863	FVXHZNSNZMDRCI-KOZDUTSQSA-N	434.892	1.246	50	20	IDGD	
C[C@H](CBr)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)COC(=O)C(F)(F)F)C2	1792987552	UMSUEEQDVBOTSS-CHWFTXMASA-N	429.233	1.761	50	20	IDGD	
COc1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](O)CCl)cc([N+](=O)[O-])c1OC	1793114360	DNEWUJDXBUZCIU-QVHKTLOISA-N	441.868	1.464	50	20	IDGD	
O=C(Cc1ccc2c(c1)OCO2)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2	1795312028	SPTZWAZPOLZHLB-LZDSYCOUSA-N	443.269	1.238	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(-n2cnnc2)cc1	1795491720	QUCVGIWPGZJBSR-NBMJBFSESA-N	431.924	1.878	50	20	IDGD	
O=C(CCc1ccccc1Cl)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1	1796191234	NSXJGYSNYIHBJL-ACDBMABISA-N	440.736	1.904	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)c1cnc(Cl)c(Cl)c1	1796191836	DVQKIKIVPCYIFT-MUJYYYPQSA-N	448.115	1.634	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1nccc2[nH]ccc12	1796208351	RUKDKSWKVIZRLM-YJKIEOBBSA-N	425.258	1.457	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1	1796439475	GWBDJQQZKFVDFZ-WJYJWUEYSA-N	437.928	1.118	50	20	IDGD	
CCCc1onc(C)c1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc(B(O)O)c1)C2	1797083592	HMPWAGMSRVQJOV-BCDXTJNWSA-N	425.294	1.181	50	20	IDGD	
C[C@@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnccc1C(=O)NN)c1cccs1	1798443651	SDPSJTJXOXMTFU-APIJFGDWSA-N	427.530	1.802	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CS[C@@H]1CCCCO1	1798477795	HAGURMKIOKLBRO-NXEZDXNNSA-N	447.561	1.197	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(-n2ccnc2)ccn1	1798728621	CZAJHXXEMSHTEM-VWPFQQQWSA-N	448.321	1.254	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(OC)cc1O	1798835402	DRJRDASORYRDGD-RBNVPPIJSA-N	441.322	1.778	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](NC(=O)OC(C)(C)C)C1CC1)C2	1799269190	DJBPNOPHBDSYBB-JJTUDDRGSA-N	443.972	1.897	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1(NC(=O)OC(C)(C)C)CC1)C2	1799273691	MXWBWLLQKVHPJL-XGUBFFRZSA-N	429.945	1.651	50	20	IDGD	
CN1CCN(C2(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)[C@@H](F)Br)C4)CC2)CC1	1799977917	LRKHYIGKNKIEHS-LXTVHRRPSA-N	431.350	1.095	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccnc2c(O)cccc12	1800097469	TWATWLRVFHWNFS-ZDFLXESQSA-N	433.892	1.397	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)Cc2cccnc2Cl)[C@H]1c1cccnc1)[C@H](O)CCl	1803136384	PQSBSNXXEUJRRM-JZXOWHBKSA-N	437.327	1.978	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)Cc2cnccn2)[C@H]1c1cccnc1	1803300831	MWQDEBFYEXWFPF-DHSIGJKJSA-N	432.322	1.904	50	20	IDGD	
CCS(=O)(=O)CC(=O)N1CCCC2(CCN(C(=O)[C@H](F)Br)CC2)C1	1805969683	PWOUTSFZEKMMCE-ZDUSSCGKSA-N	427.336	1.343	50	20	IDGD	
O=C(Cc1ccc2ncnn2c1)NC[C@@H]1CCN(C(=O)[C@H](F)Cl)[C@H]1c1cccnc1	1807406820	AIJPOXZXFHCIBR-SNRMKQJTSA-N	430.871	1.907	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H](CNC(=O)Cn2ccnn2)[C@@H]1c1cccnc1	1807694256	YWXGQOYGRTWHEB-VYDXJSESSA-N	435.326	1.553	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1	1807998170	IZYXZOVVAJUSMA-YEWWUXTCSA-N	434.880	1.461	50	20	IDGD	
N[C@@H](Cc1cscn1)C(=O)N1CC[C@H](CNC(=O)[C@@H](F)Cl)[C@H]1c1cccnc1	1808313126	SHOXGJSCFWMYDU-SLBVQIDZSA-N	425.917	1.648	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)c1cnc2ccccn12	1809213977	GKECPWOLQVKJFN-KVSKMBFKSA-N	427.892	1.649	50	20	IDGD	
CC1=CC[C@H](C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)CC1	1809479243	WHDWOXQZQQQRND-HARLFGEKSA-N	447.344	1.827	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)o1	1810292112	WRTXABYLKQUJEK-HDMKZQKVSA-N	434.880	1.552	50	20	IDGD	
Cc1ccc(=O)n(C(C)(C)C(=O)NC[C@@H]2CCN(C(=O)[C@H](F)Cl)[C@H]2c2cccnc2)n1	1810492571	YMOQDEQWYPBHPQ-SZMVWBNQSA-N	449.914	1.922	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H](CNC(=O)Cn2ccncc2=O)[C@H]1c1cccnc1	1812339813	LPLXWRBYRHVHBY-VQIMIIECSA-N	431.924	1.609	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)[C@H]2C[C@@H]2F)[C@@H]1c1cccnc1	1812476281	WAGNJVIXONUZGJ-PUEUITJWSA-N	440.479	1.579	50	20	IDGD	
C[C@H](NC(=O)OC(C)(C)C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1	1814674833	YHRIXSCXBMPNJB-IACUBPJLSA-N	443.932	1.915	50	20	IDGD	
O=C1CCc2ccc(C(=O)N3CCCC[C@H]3c3cc(NC(=O)[C@H](O)CCl)n[nH]3)nc2N1	1814870499	USDZQMGYNLEBJO-LSDHHAIUSA-N	446.895	1.595	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC[C@H]1c1cc(NC(=O)C23CC(F)(C2)C3)n[nH]1	1815285354	DPFHFNOWDHRPFR-ATIQYGATSA-N	426.257	1.288	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1ccoc1Cl)CC2)c1cccc(B(O)O)c1	1815360837	OPDUBFRNTGSGMA-LBPRGKRZSA-N	445.693	1.609	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)c(C)o1	1817470614	FHIDMSASSYXIAX-LJQANCHMSA-N	436.277	1.919	50	20	IDGD	
O=C(COC(=O)C(F)(F)F)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1	1819311481	AXRNCGLTKQYANV-UWVGGRQHSA-N	426.779	1.107	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)CCc3nc(N)n[nH]3)sc2C1	1819561989	VAXWRNUYCNLWBQ-SFYZADRCSA-N	442.343	1.172	50	20	IDGD	
CC[C@@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CS(=O)(=O)N2CCCC2)[nH]n1	1820857232	QWJQNCDSFMWSOV-HIFRSBDPSA-N	445.973	1.845	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(OC)nn3)sc2C1	1821073511	YARRSDZQPQQBBC-ZJUUUORDSA-N	425.898	1.421	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)Cn2ccncc2=O)n[nH]1	1821655634	AUJDYSKDHIKMDF-OAHLLOKOSA-N	432.557	1.510	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cncc(O)c2)n[nH]1	1822233326	IPAAIUFKZUHTRI-MRXNPFEDSA-N	429.481	1.189	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCN2CCN(C)CC2)[nH]n1	1822368330	HHVSJLZFASYTNY-WBVHZDCISA-N	440.976	1.293	50	20	IDGD	
O=C(CCn1cncn1)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](F)Br)[nH]n1	1822682736	CMDDLBRVIZEJAP-SMDDNHRTSA-N	428.266	1.774	50	20	IDGD	
Cn1ccc(CC(=O)N[C@H]2CCc3nc(NC(=O)[C@H](F)Br)sc3C2)n1	1823003501	LLRYUCSYNICRCF-SDBXPKJASA-N	430.303	1.722	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@H](O)CCl)CC2)c1cc(O)cc([N+](=O)[O-])c1	1823640452	OQXQKTJLFJXLIJ-NOZJJQNGSA-N	440.865	1.582	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H]2CCC(=O)N2)CC1	1824094683	XUWGCYFLWBBGRZ-VNQPRFMTSA-N	428.371	1.916	50	20	IDGD	
O=C([C@H]1Cc2ccccc2CN1)N1CCC([C@H]2CCCCN2C(=O)[C@@H](O)CCl)CC1	1824182995	NCVTXUUXGDUJRP-NJYVYQBISA-N	433.980	1.920	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)COc3ccc(O)nn3)sc2C1	1824561474	SDODDDAGVCPVTG-ZJUUUORDSA-N	425.898	1.647	50	20	IDGD	
Cc1onc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)c1C	1824753261	ZXDAPTNWHDYWHQ-GOSISDBHSA-N	433.553	1.898	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)/C=C/c1ccoc1)CC2	1826084026	XSWROOPHAABVDX-ZRFDWSJLSA-N	431.518	1.735	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC([C@@H]2CCCCN2C(=O)Cn2cncn2)CC1	1827185764	OULYHQAFJRSYBT-HOCLYGCPSA-N	426.359	1.929	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@H](O)N2CCOCC2)CC1	1829102637	BQYYGEDFGYKACT-RXVVDRJESA-N	441.645	1.108	50	20	IDGD	
Cc1ocnc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1	1829432846	OSZWRAJCIQOTNT-SFHVURJKSA-N	440.504	1.529	50	20	IDGD	
Cc1cnn([C@H](C)C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)c1	1830370318	QAARBOPFVIJODV-OXQOHEQNSA-N	426.945	1.474	50	20	IDGD	
C=CCOCCCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1831412078	CBTSSZXPTFHBOM-RDJZCZTQSA-N	437.306	1.116	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3ccnc(C)c3)CCO2)C1	1832627511	LGTPLIWUEODSPS-NQIIRXRSSA-N	439.940	1.033	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)COc3cccnc3)CCO2)C1	1832679627	BJOBBHKHLDYWJW-RBUKOAKNSA-N	446.331	1.153	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2CCCOC2)CC1	1832867136	DUGZMCACRBJDQH-CTNGQTDRSA-N	428.338	1.026	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnc(OC)c(C)c3)CCO2)C1	1834574412	DEEVVKVILJNSFD-UTKZUKDTSA-N	439.940	1.876	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)[C@H]3CCCO3)CC2)CC1	1834903037	FSWFPXMKHYDXSZ-DLBZAZTESA-N	430.387	1.911	50	20	IDGD	
CN(C)c1cncc(C(=O)N2CCC(N3CCC(NC(=O)[C@H](F)Cl)CC3)CC2)c1	1835078834	YHCGUHUUMMQEAH-SFHVURJKSA-N	425.936	1.867	50	20	IDGD	
CNc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)cc1	1835609632	BOFQTPXGQDEVLD-LIRRHRJNSA-N	440.338	1.582	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)C[C@H](N)c3cccnc3)CCO2)C1	1835824022	HDZXYZSHIIVHRF-WFXMLNOXSA-N	438.956	1.335	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cc4cccnn4n3)CC2)CC1	1836078512	KIRBHVUIXBPVJD-SFHVURJKSA-N	432.956	1.932	50	20	IDGD	
Cn1cnc(C(=O)N2CCC(N3CCC(NC(=O)[C@@](C)(Cl)CCl)CC3)CC2)c1	1836398757	STWPMCJQGRAGCF-IBGZPJMESA-N	430.380	1.842	50	20	IDGD	
O=C([C@@H](O)Cc1ccccc1)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836719182	PERIFSFSJIAESQ-PMACEKPBSA-N	438.952	1.188	50	20	IDGD	
O=C(c1ccc2[nH]ccc2n1)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1836909110	QRCBJBDKAZJFDY-SFHVURJKSA-N	427.288	1.437	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3coc([Si](C)(C)C)c3)CCO2)C1	1837425169	GPEAKANZQOFYQT-OXQOHEQNSA-N	443.016	1.912	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccnc(Cl)n3)CCO2)C1	1837919930	VKJDOBHYXXVMSP-SFHVURJKSA-N	431.320	1.465	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cnn4cccnc34)CC2)CC1	1838309735	PDNRGWHPPUOBAK-SFHVURJKSA-N	449.939	1.595	50	20	IDGD	
COc1cccc(OC)c1C(=O)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1838883210	STVFJZLBSGBAJL-LJQANCHMSA-N	447.315	1.578	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cccc(Cl)n3)C2)C1	1839142544	RPNPPGGSMVDDFR-HNAYVOBHSA-N	430.332	1.751	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3noc4c3CCCC4)C2)C1	1839143576	AUCWQFRXECAFKC-QRWLVFNGSA-N	425.913	1.641	50	20	IDGD	
Cc1ncncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2	1839153668	OABQUYPNONJPOV-ROUUACIJSA-N	431.320	1.091	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccnc(C)c3)C2)C1	1839965400	XNESEKVLFPEZLS-VQIMIIECSA-N	440.338	1.634	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccc(F)cc3)C2)C1	1840032111	NZSFNGNJLTXAGQ-KUHUBIRLSA-N	443.313	1.608	50	20	IDGD	
Nc1ccccc1/C=C/C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840187998	JKILADNHKFGHRV-ZMBJWTFHSA-N	428.316	1.542	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)c2ncc(Cl)cc2Cl)C1	1841000066	DGPYVTLOJALZKM-UHFFFAOYSA-N	428.320	1.578	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@H]2CCN(C(=O)OC(C)(C)C)C[C@H]2O)C1	1841028065	SDJVOMDNUNRSOC-OWCLPIDISA-N	443.972	1.825	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC2(CCCN2C(=O)Cc2cnccn2)C1	1841460674	XMWZQQFSFBINNN-HNNXBMFYSA-N	437.928	1.355	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)[C@@H](C)Nc2ccccc2)C1	1844213760	ZCMWOKDQTCVNHM-MSZQUAHTSA-N	436.516	1.824	50	20	IDGD	
Cc1cc(C)cc(CCC(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)c1	1844265224	HEBLLCNFYGSFLJ-UHFFFAOYSA-N	435.528	1.752	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@H]1C[C@H](F)CN1C(=O)OC(C)(C)C)C2	1846365736	SEYSIAVXGDWNFM-KKUMJFAQSA-N	447.935	1.791	50	20	IDGD	
C#CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)[C@@H](Cl)COC)C2	1847068933	IXPHXGQFBPXVLW-LSDHHAIUSA-N	427.929	1.360	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)c1ccc(OCC(F)(F)F)nc1	14324784	MRKMBJSUZOHDKL-UHFFFAOYSA-N	431.396	1.391	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1	15524780	TYLPKOLJSHMSTQ-UHFFFAOYSA-N	447.513	1.110	50	20	IDGD	
C[C@H]1C[C@H](C)CN(C(=O)CN2CCN(CC(=O)NNC(=O)c3ccccc3Cl)CC2)C1	23370333	KAIFSZZCOSZJRJ-IRXDYDNUSA-N	449.983	1.223	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(S(=O)(=O)NC(C)(C)C)cc2)cc1	24805195	MMUFJFGSGFVTNO-UHFFFAOYSA-N	447.513	1.690	50	20	IDGD	
COc1cc(C=NNC(=O)CNc2ccccc2)ccc1OCC(=O)N1CCOCC1	254822551	KBDICKNMHDRTDD-UHFFFAOYSA-N	426.473	1.495	50	20	IDGD	
O=C(NNC(=O)[C@@H]1C[C@H]2CCCC[C@H]2N1C(=O)c1ccc(Cl)cc1)C(=O)N1CCCC1	726160883	MTEDPDJSEMFPQT-NXHRZFHOSA-N	446.935	1.883	50	20	IDGD	
C[C@@H](CC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)NC(=O)C1CCCC1	727096031	HAKVSUHMHUNTMR-SFHVURJKSA-N	429.565	1.431	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cc([N+](=O)[O-])cc3c2OCCO3)cc(OC)c1OC	727292840	JGNKCFFXLURXBE-UHFFFAOYSA-N	433.373	1.467	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNS(=O)(=O)c2sc(NC(C)=O)nc2C)cc1	727351139	GDAUAGSQAHKMAF-LLVKDONJSA-N	442.519	1.586	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)[C@H]2CCCN(S(=O)(=O)c3c(C)n[nH]c3C)C2)cc1	728203214	IFXSSKZOISUOEV-KRWDZBQOSA-N	433.534	1.451	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(Cl)c(S(=O)(=O)NNC(=O)c2ccc[nH]2)c1	728261445	RJLYPPDDWMLCKH-UHFFFAOYSA-N	434.927	1.322	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)C[C@H](c2ccccc2)N2CCOC2=O)c2ccccc2c1=O	728264751	LKGDJKGCTSAPSB-QGZVFWFLSA-N	435.440	1.278	50	20	IDGD	
O=C(COC(=O)c1cnc(-c2ccccc2)nc1)NNC(=O)[C@@H]1COc2ccccc2O1	728332332	IHFZOASFZZFKCV-SFHVURJKSA-N	434.408	1.288	50	20	IDGD	
CN(C)CCOc1ccc(CCNC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1	729232120	DVCHKWHFYUBDPX-HXUWFJFHSA-N	428.489	1.340	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)c2ccc(F)c(S(=O)(=O)NC(C)C)c2)cn1	729692308	OYBNUHFRBRNWTO-UHFFFAOYSA-N	441.510	1.547	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)[C@@H]1CCCN(C(=O)c2ccc3n[nH]cc3c2)C1	730032924	NGLTZZDSWSTZSH-QGZVFWFLSA-N	435.484	1.901	50	20	IDGD	
COC(=O)CCOc1ccc(S(=O)(=O)NNC(=O)c2cccc3ncccc23)cc1	730204177	MBEMTVYHKHKWBG-UHFFFAOYSA-N	429.454	1.800	50	20	IDGD	
CCCc1[nH]nc(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c1[N+](=O)[O-]	731599219	SYOUTTMIZOJAJN-UHFFFAOYSA-N	429.481	1.244	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)[C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)cc1	732264338	QMDBHJCXEMMQLN-CQSZACIVSA-N	447.473	1.529	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NCc2ccc(Br)cc2F)c2ccccc2c1=O	732472539	CURHGLHTMZFDSC-UHFFFAOYSA-N	448.252	1.979	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)(F)F)cc1)N[C@H]1CCN(CC(F)(F)F)C1=O	732589549	DBRLSHONODMKMU-JTQLQIEISA-N	448.345	1.769	50	20	IDGD	
CCC[C@H](NC(=O)Cc1ccccc1)C(=O)NNC(=O)c1nn(CC)c(=O)c2ccccc12	732653644	FJRDJBPRTBXGFB-IBGZPJMESA-N	449.511	1.705	50	20	IDGD	
Cc1cccc(-n2c(NNC(=O)c3cn(C)c(=O)nc3O)nc3ccccc3c2=O)c1C	733265070	WIWULZRYDXQBCJ-UHFFFAOYSA-N	432.440	1.559	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)N[C@H]1CCCN(c2ccccc2)C1	734516318	GKYQRPYKOLLUJG-INIZCTEOSA-N	444.561	1.901	50	20	IDGD	
CN(C)N(C(=O)c1nn(-c2ccc(F)cc2)cc1Br)[C@H]1CCS(=O)(=O)C1	735425000	WZCHBHXHFYRASA-ZDUSSCGKSA-N	445.314	1.880	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)c1cccc(NC(=O)[C@@H]2Cc3ccccc3O2)c1	740850113	UCDPLGVEGGTFKL-IBGZPJMESA-N	438.484	1.695	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)c1nnn(-c2ccccc2F)c1C(F)(F)F	740852921	PQPFGQXYVICDBA-UHFFFAOYSA-N	430.362	1.491	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2ccc3c(c2)NC(=O)CCN3C)cc(OC)c1OC	741745369	ZCRKGHXDYJOEEX-UHFFFAOYSA-N	428.445	1.566	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@H](c2cccc(F)c2)N2CCOCC2)cc(OC)c1OC	741881346	MNLRVEOLUVWXRA-IBGZPJMESA-N	447.463	1.686	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)[C@@H](C)NC(=O)c2cc3c(C)nn(C)c3s2)c1	742033250	LELHSOQQISBAIF-CQSZACIVSA-N	443.529	1.905	50	20	IDGD	
CCS(=O)(=O)N[C@H](CCSC)C(=O)NNC(=O)c1cccc(Br)c1	742771493	WYIYBQZVGAMXAS-GFCCVEGCSA-N	438.369	1.271	50	20	IDGD	
O=C(NNC(=O)[C@@H](c1cccc(F)c1)N1CCOCC1)c1nn(-c2ccccc2)cc1O	743292975	PFDXSSJFFFFSEN-HXUWFJFHSA-N	439.447	1.552	50	20	IDGD	
O=C(NC[C@]1(N2CCOCC2)CCSC1)NNC(=O)c1cccc(Br)c1	743558021	UZQSPXVRUFMTMQ-QGZVFWFLSA-N	443.367	1.601	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NCc2ccc3c(c2)OCCCO3)cc1	743582086	BSHNIBURDLCLSB-UHFFFAOYSA-N	434.474	1.787	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NNC(=O)CCCc2ccccc2)cc1	743585232	FRLFRUCOLNLCHO-UHFFFAOYSA-N	433.490	1.480	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)N[C@@H]1CC(=O)N([C@@H]2C[C@H]2c2ccccc2)C1	743702297	OKJWSSHERDIHJZ-FGTMMUONSA-N	436.468	1.559	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN(C(=O)c2ccncc2)C1)c1cc(Br)ccc1O	743730102	MSMZGEGRICLKKB-CYBMUJFWSA-N	447.289	1.863	50	20	IDGD	
CN(C)C(=O)Nc1cccc(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)c1	744619809	ZGNGSPZKBYDATE-UHFFFAOYSA-N	447.517	1.558	50	20	IDGD	
Cc1nn(C)c2sc(C(=O)NNc3ccccc3S(=O)(=O)N3CCOCC3)cc12	744621470	XSUDEJPBBVNVGA-UHFFFAOYSA-N	435.531	1.721	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)NCCN1CCN(C(=O)OC(C)(C)C)CC1	744896283	XFLLJSCMMVVQBU-UHFFFAOYSA-N	449.552	1.511	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)N[C@H]2CC(=O)N(CCOc3ccccc3)C2)cc1	745848620	UQVQNQNSIIFRQT-KRWDZBQOSA-N	426.473	1.384	50	20	IDGD	
C[C@@H]1C[C@@H](NC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])C(=O)N1c1ccccc1	745880776	BAWZBPJWHHFSRV-UKRRQHHQSA-N	427.417	1.498	50	20	IDGD	
O=C(NNC(=O)c1cc(S(=O)(=O)N2CCCC2)ccc1O)c1ccc2ccccc2n1	745990936	LLPHNZDYWKOQHS-UHFFFAOYSA-N	440.481	1.800	50	20	IDGD	
C[C@@H](CCc1ccc2c(c1)OCO2)NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	746966567	QVZIOLKMUCAXCL-ZDUSSCGKSA-N	437.456	1.628	50	20	IDGD	
O=C(NCCCN1CCN(c2ncccn2)CC1)NNC(=O)c1ccc(Cl)cc1F	747489186	BJIWKVHVOBLYAV-UHFFFAOYSA-N	435.891	1.425	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(NC(=S)NNC(=O)Cc2cn3ccccc3n2)c1	747664405	WOVRYSVYWWMCRO-UHFFFAOYSA-N	432.531	1.145	50	20	IDGD	
Cc1ccc(C)c(S(=O)(=O)Oc2ccc(C(=O)NNC(=O)C(=O)N3CCCC3)cc2)c1	748246759	OYVSSIFYFYJVTD-UHFFFAOYSA-N	445.497	1.455	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)N[C@H](c1ccccc1)c1cccc(S(C)(=O)=O)c1	748636067	IRJGDBOEFPCBNP-DNVCBOLYSA-N	449.529	1.561	50	20	IDGD	
COC(=O)/C=C1/SCC(=O)N1CCCOC(=O)/C(C#N)=C/c1cc(C#N)n(C)c1C	748862093	AAGRCGFGWQVTPM-RXMDKCFGSA-N	428.470	1.635	50	20	IDGD	
O=C(CNC(=O)c1ccc2c(c1)OCO2)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1	749283881	ISTCNJAGJJQYPX-UHFFFAOYSA-N	445.375	1.582	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CNC(=O)c2cccs2)ccc1OCc1cscn1	751208851	INRMKIKYKIGFDC-UHFFFAOYSA-N	446.510	1.983	50	20	IDGD	
C[C@H](NC(=S)NNC(=O)C1CCN(S(=O)(=O)/C=C\c2ccccc2)CC1)C1CC1	751620798	MHTOSURCUXNIGU-SZGZABIGSA-N	436.603	1.993	50	20	IDGD	
O=C(COC(=O)c1c(F)ccc([N+](=O)[O-])c1F)NNC(=O)[C@@H]1COc2ccccc2O1	752558029	FTXBIANPPBLUMX-ZDUSSCGKSA-N	437.311	1.017	50	20	IDGD	
CC(C)[C@@H]1OCCC[C@H]1CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	753033262	BBZQUAYAJLCEPT-RDJZCZTQSA-N	426.539	1.332	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)Cn2c(C)cc(O)cc2=O)c2ccccc2c1=O	753077556	WZEHDXWQWNLGKU-UHFFFAOYSA-N	439.472	1.224	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)[C@H](C)Oc2ccccc2F)n([C@@H]2CCS(=O)(=O)C2)n1	755538125	ZQYKNLFFSOAZSU-QWHCGFSZSA-N	439.469	1.310	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)Nc2ccc(NC(=O)CN3CCOCC3)cc2)cc1	755600793	WBENUNIRGQLDNY-UHFFFAOYSA-N	441.488	1.497	50	20	IDGD	
O=C(NCCN1C(=O)[C@@H]2[C@@H](C1=O)[C@H]1C=C[C@H]2C1)NNC(=O)c1ccc(Cl)cc1Cl	756092701	DBNLIHFXYVPCRP-CHPZLBCBSA-N	437.283	1.745	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)Nc2cc(S(N)(=O)=O)cc(C)c2C)cc1OC	756633692	KNLJZDPDFIOCQY-UHFFFAOYSA-N	436.490	1.825	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(F)c(NC(=O)NNC(=O)COc2ccc(C#N)cc2)c1	756681502	CDUNQGCLEXGKFS-UHFFFAOYSA-N	435.437	1.179	50	20	IDGD	
CN(C)C(=O)Cn1cnc(NC(=O)NNC(=O)c2ccc(Br)cc2Cl)n1	756770059	ITYXYSCHJHKCRZ-UHFFFAOYSA-N	444.677	1.249	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)Nc2cnn(CC(=O)N3C[C@H](C)O[C@H](C)C3)c2)cc1	756839736	SSAXIRGPHKTDCU-IYBDPMFKSA-N	444.492	1.059	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)c1cccc(I)c1O	757736264	FFEUNIHZSURVPN-UHFFFAOYSA-N	441.225	1.879	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@H](NC(=O)NNC(=O)c2cccc(OC(F)F)c2)[C@H](C#N)C1	758774871	VHGSLOJEVJHPOZ-TZMCWYRMSA-N	439.419	1.991	50	20	IDGD	
O=C(CSc1nnc(-c2cccs2)n1C1CC1)NNC(=O)C(=O)Nc1ccccn1	758835328	YGWPBZOCUOZPFS-UHFFFAOYSA-N	443.514	1.615	50	20	IDGD	
O=C(NC[C@H]1CSCCN1Cc1ccccc1)NNC(=O)c1cc([N+](=O)[O-])ccc1O	759325342	XAXRVAVJNZZPQK-INIZCTEOSA-N	445.501	1.862	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)NCCCN1CCC[C@@H]1C(=O)N(C)C	761680440	NUPKVIVJAJMREW-OAHLLOKOSA-N	437.566	1.060	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)N[C@H]1CCCN(CC(F)(F)F)C1=O	761741842	AGLWSIVLBGOMKZ-NSHDSACASA-N	434.440	1.671	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)N[C@@H](C)c2cn(-c3ccccc3)nn2)nc1	761785835	IFRBHOMFKJMPGM-AWEZNQCLSA-N	444.521	1.736	50	20	IDGD	
CCn1cnc2c1c(=O)n(CC(=O)NN=Cc1ccc(C)cn1)c(=O)n2Cc1ccccc1	761805749	YCCJTBRVPREKBK-UHFFFAOYSA-N	445.483	1.282	50	20	IDGD	
COC(=O)c1cn([C@H]2CCCN(C(=O)NNC(=O)c3cc4c(s3)CC[C@@H](C)C4)C2)nn1	762556758	QPOICIWKTXEQSM-OCCSQVGLSA-N	446.533	1.943	50	20	IDGD	
COc1ccc(-c2noc(CCC(=O)NNc3nccc(N4CCOCC4)n3)n2)cc1	762855645	JAJLMPLOYBNUEX-UHFFFAOYSA-N	425.449	1.448	50	20	IDGD	
CCCCS(=O)(=O)N1CCC[C@@H]1C(=O)NNC(=O)c1cc(-c2cccs2)[nH]n1	763162162	JJXQXXTZQHVRIB-CQSZACIVSA-N	425.536	1.494	50	20	IDGD	
C[C@H](CC(=O)NNC(=O)CNC(=O)c1ccco1)[C@H]1CCCN(C(=O)OC(C)(C)C)C1	763324726	YXDMSGOQBRZCTB-CABCVRRESA-N	436.509	1.830	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)ccc1N1CCSCC1	763467260	AFHMPOLFCJVSOH-UHFFFAOYSA-N	443.485	1.856	50	20	IDGD	
COC(=O)N(C)Cc1ccc(NC(=O)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1	763468903	XMAOYCWMVUXFJJ-UHFFFAOYSA-N	429.389	1.193	50	20	IDGD	
Cc1nccn1-c1ccc(NC(=O)C(=O)NNC(=O)c2cc3ccccc3cc2O)cn1	763521463	FCQWINKIZIZRBV-UHFFFAOYSA-N	430.424	1.834	50	20	IDGD	
COCCOc1ccc(F)cc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccccc2)[nH]n1	763600439	HKSXRZHZKYFNPB-UHFFFAOYSA-N	441.419	1.641	50	20	IDGD	
CC[C@@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2cc(C)cc(C)c2)cc1	763646747	JAYPPDAXBMIDCX-MRXNPFEDSA-N	440.500	1.997	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccnc(Sc3ccccn3)c2)cc1	763682246	UACNZKBHWLKQOH-UHFFFAOYSA-N	448.464	1.664	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(C)nn1-c1ccccc1	763684413	LDTPMLJNOBBXCA-UHFFFAOYSA-N	437.456	1.744	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2cc(C(=O)N(C)C)ccc2C)c1	763775510	USXBUPZYHKKFOF-UHFFFAOYSA-N	428.445	1.114	50	20	IDGD	
CC(C)(C)NC(=O)Nc1ccc(Cl)c(C(=O)NNC(=O)CNC(=O)c2cccnc2)c1	763820080	LDSWDPJTPVSPNT-UHFFFAOYSA-N	446.895	1.846	50	20	IDGD	
CCOC(=O)c1c(F)cccc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccc(F)cc1	763872034	JJVTXUOEFXMXLX-LLVKDONJSA-N	435.383	1.695	50	20	IDGD	
COc1c(NC(=O)C(=O)NNC(=O)CCSc2ccc(F)cc2)cccc1C(N)=O	763895958	VJFYGTMWIWWQDN-UHFFFAOYSA-N	434.449	1.202	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccnc(OCC(F)(F)C(F)F)c1	763919156	RSGYXROFQAVBNW-UHFFFAOYSA-N	446.332	1.829	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc(Br)s2)ccc1C(N)=O	763941071	OGURIUJPSIJQHF-UHFFFAOYSA-N	425.264	1.318	50	20	IDGD	
N#Cc1cccnc1-n1cc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCCCC3)cn1	763967875	KHQJVGACQNLDMF-UHFFFAOYSA-N	449.496	1.869	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)C(=O)Nc1ccc(N2CCCC2)c(F)c1	763996673	FIXKQSUJCWHQFL-UHFFFAOYSA-N	438.257	1.916	50	20	IDGD	
Cc1nn(-c2ccccc2)c(C)c1NC(=O)C(=O)NNC(=O)c1ccc2c(c1)OCCO2	764004175	TWIYHTHBBFLYRB-UHFFFAOYSA-N	435.440	1.660	50	20	IDGD	
O=C(NNC(=O)C1CCCC1)C(=O)Nc1ccc(Cl)c(S(=O)(=O)N2CCCC2)c1	764065797	BJIVZMUDVNKGJR-UHFFFAOYSA-N	442.925	1.401	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1O)C(=O)Nc1ccc(NC(=O)[C@@H]2CCCO2)cc1	764114897	HEFPXEWSMNKEQX-INIZCTEOSA-N	446.847	1.563	50	20	IDGD	
CCN(CC)C(=O)c1ccccc1NC(=O)C(=O)NNC(=O)Cc1ccccc1OC	764132781	PZZYUFIGIFLEEA-UHFFFAOYSA-N	426.473	1.506	50	20	IDGD	
NC(=O)C1CCN(c2ccccc2NC(=O)C(=O)NNC(=O)CCC2CCCCC2)CC1	764211856	QYZXTWDSDDQSKH-UHFFFAOYSA-N	443.548	1.835	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)C(=O)Nc1ccc(S(=O)(=O)c2ccc(F)cc2)cc1	764297714	WBSHERMBECCDCT-UHFFFAOYSA-N	445.432	1.090	50	20	IDGD	
CCn1cc(NC(=O)C(=O)NNC(=O)c2ccc(OC)c(Br)c2)ccc1=O	764327038	UDZHLZKOZSWNEH-UHFFFAOYSA-N	437.250	1.039	50	20	IDGD	
Cc1ccc2c(c1)[C@@H](NC(=O)NNC(=O)c1ccc(S(=O)(=O)N3CCCC3)cc1)CO2	764377136	XQYFHAKHNOWTDW-SFHVURJKSA-N	444.513	1.857	50	20	IDGD	
CCOc1ccc(OC)cc1NC(=O)C(=O)NNC(=O)c1cc(-c2cccs2)[nH]n1	764382473	LOWDNCHWMTVFDP-UHFFFAOYSA-N	429.458	1.945	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1ccn(Cc2ccncc2)n1	764393879	SKBDDANTMUWUOA-UHFFFAOYSA-N	440.485	1.213	50	20	IDGD	
COC(=O)C(C)(C)c1ccc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)cc1	764400694	GMEOCRTVOODKMB-UHFFFAOYSA-N	445.497	1.721	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)c3cc(S(=O)(=O)N(C)C)oc3C)n[nH]2)c1	765580934	HUXCOKOJGQYVMA-UHFFFAOYSA-N	445.501	1.920	50	20	IDGD	
O=C(CCc1cccc(Cl)c1)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765734733	CSPQGVSDEYEIEB-UHFFFAOYSA-N	428.920	1.878	50	20	IDGD	
CS(=O)(=O)CC[C@@H](NC(=O)OCc1ccccc1)C(=O)NNc1nc2ccccc2[nH]1	768494297	GGQJYBIYUNCYHR-QGZVFWFLSA-N	445.501	1.736	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)CN1C(=O)N[C@]2(CCCC(C)(C)C2)C1=O	768559686	GVMVCPYVVSOSNH-NRFANRHFSA-N	432.477	1.112	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C[C@@H]1CN(Cc2ccccc2)CCO1	768636977	APBXNGRIFAEWQW-QGZVFWFLSA-N	433.530	1.833	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)c(C(C)(C)C)n1	768949501	VTFMXQVYMNXLGK-UHFFFAOYSA-N	446.983	1.950	50	20	IDGD	
CS(=O)(=O)Nc1ccc(O)c(C(=O)NNC(=O)NCc2cccc(C(F)(F)F)c2)c1	769724891	MJVFXNYMLNJBQD-UHFFFAOYSA-N	446.407	1.927	50	20	IDGD	
O=C(CCc1cccc2c1OCO2)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	770207633	GSOZBVLZHQQXAG-UHFFFAOYSA-N	445.497	1.594	50	20	IDGD	
COc1ccc(-n2nc(C(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)cc2C)cc1	770643764	DEADZYDERIYGHF-UHFFFAOYSA-N	428.470	1.668	50	20	IDGD	
C[C@H]1CN(c2ccnc(C(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)c2)C[C@@H](C)O1	770831103	GIXTYVPQKCOQRV-OKILXGFUSA-N	432.502	1.174	50	20	IDGD	
COc1ccc(-c2nc(C(=O)NNc3nc(O)c4cnn(C)c4n3)cs2)cc1OC	770973829	IEDMUAVJQVTMEB-UHFFFAOYSA-N	427.446	1.967	50	20	IDGD	
CC(C)(C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1)N1C(=O)c2ccccc2C1=O	771305792	UHTZDQAMXPRRAG-UHFFFAOYSA-N	442.497	1.645	50	20	IDGD	
O=C(CCc1cccc2c1OCO2)NNc1ccccc1S(=O)(=O)N1CCOCC1	771391881	LTVPFDCXSDTIRF-UHFFFAOYSA-N	433.486	1.512	50	20	IDGD	
CN(C)CCS(=O)(=O)c1ccccc1C(=O)NNc1ccnc(Br)c1	771561055	KHXDRXCWZWZVLL-UHFFFAOYSA-N	427.324	1.936	50	20	IDGD	
COc1ccc(S(=O)(=O)NCCC(=O)NNc2ccc(F)c([N+](=O)[O-])c2)cc1OC	771589744	FRAQOMGPONMYEU-UHFFFAOYSA-N	442.425	1.563	50	20	IDGD	
CN1CCN(C[C@@H](NC(=O)NNc2cccc(S(C)(=O)=O)c2)c2ccccc2)CC1	776619721	KKFHXJPOFAHRLW-HXUWFJFHSA-N	431.562	1.705	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)N[C@@H]2CC(=O)N([C@H]3C[C@@H]3c3ccccc3)C2)c1	776623752	PIQTWBDJGGHTEY-QRQLOZEOSA-N	428.514	1.873	50	20	IDGD	
CC(C)(C)OC(=O)NCc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccncc2)cc1	778714149	PVWKPQISRBQSEE-UHFFFAOYSA-N	427.461	1.435	50	20	IDGD	
O=C(NNc1ccc([N+](=O)[O-])cc1Br)C(=O)Nc1ccc(-n2nccn2)nc1	778759757	QCOVRYKHOVNVMO-UHFFFAOYSA-N	447.209	1.415	50	20	IDGD	
O=C(CSc1ccccc1O)NNS(=O)(=O)[C@@H]1CCCN(C(=O)c2ccccc2)C1	779631480	IZINQQUZSKLGMJ-MRXNPFEDSA-N	449.554	1.740	50	20	IDGD	
Cc1cc(C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)nn1-c1cccc(C#N)c1	780199784	KEUFZYUFIJOMQK-UHFFFAOYSA-N	428.408	1.542	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)C[C@@H]2CCO[C@H](C(C)C)C2)cc1	781575951	BILCPTOMMNWSQY-AEFFLSMTSA-N	425.551	1.604	50	20	IDGD	
CCOc1cc(N2CCN(C)CC2)ccc1NC(=O)C(=O)NNc1ccc(OC)cn1	782145214	NFSZRHFQVUXQKN-UHFFFAOYSA-N	428.493	1.323	50	20	IDGD	
Cn1c(=NNC(=O)C(=O)Nc2cccc(S(=O)(=O)NC3CC3)c2)sc2ccccc21	783352373	ROAPTNWIJCNNNU-UHFFFAOYSA-N	445.526	1.251	50	20	IDGD	
O=C(NC1CC1)c1cc(F)c(NNC(=O)[C@@H]2CC=CC[C@H]2C(=O)N2CCOCC2)c(F)c1	784448090	FMBABBSXOVWXPZ-HZPDHXFCSA-N	448.470	1.741	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)CCOc1cccc(I)c1	785130656	DVLJMEHZACHGHP-UHFFFAOYSA-N	447.273	1.512	50	20	IDGD	
Cn1cc(Br)cc(NC(=O)C(=O)NNc2nc(C(F)(F)F)cs2)c1=O	785147221	BPHSDYJBDMYYML-UHFFFAOYSA-N	440.201	1.705	50	20	IDGD	
COc1cc(F)cc(NNC(=O)C(=O)Nc2ccc(OC)c(OCC(=O)NC3CC3)c2)c1	785235297	UPOOAUWQENUZLU-UHFFFAOYSA-N	446.435	1.582	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)C(F)(F)c2ncccc2C)cc1	786642264	XRRBRWBPHKVIEI-UHFFFAOYSA-N	426.445	1.258	50	20	IDGD	
CC(C)N1C(=O)C[C@@H](C(=O)NNC(=O)N2CCN(C)CC2)[C@@H]1c1ccc(Cl)c(F)c1	788168767	BVWCNVJEXXKMCK-KDOFPFPSSA-N	439.919	1.765	50	20	IDGD	
COc1ccc(OC)c([C@@H]2C[C@H]2C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c1	788196366	DSITVJAHMMXKST-DOTOQJQBSA-N	443.412	1.720	50	20	IDGD	
Cc1ccccc1C1(C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)CCC1	788588105	MITOMSYORTUPMZ-UHFFFAOYSA-N	443.573	1.891	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Nc2ccc(-c3cnn(C)c3)nn2)cc(OC)c1OC	788785598	ABJSUNVHNAIOJZ-UHFFFAOYSA-N	427.421	1.369	50	20	IDGD	
CN(NS(=O)(=O)c1ccccc1[N+](=O)[O-])C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	788916513	PIJIKHBGLUREHW-UHFFFAOYSA-N	443.482	1.393	50	20	IDGD	
COc1ccc2c(c1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)CCC2	792452736	LULDCLLAACUSKS-UHFFFAOYSA-N	432.502	1.901	50	20	IDGD	
Cc1nnnn1[C@@H](Cc1cccc(F)c1)C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	794732111	VCCYKRIJLQJUSH-SFHVURJKSA-N	447.496	1.298	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)c1	796386613	XNRJQLYSTIHEAO-QHCPKHFHSA-N	446.555	1.211	50	20	IDGD	
COC(=O)[C@@H]1CN(C(=O)OC(C)(C)C)CCCN1CC(=O)NNC(=O)c1cccc(C)c1	796676580	GEZXPPCNQGYNFL-KRWDZBQOSA-N	448.520	1.240	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)Cc2ccncc2)(n2cccn2)CC1	796907081	MFUGOEWOIQTLDK-UHFFFAOYSA-N	428.493	1.394	50	20	IDGD	
CO[C@@H](C(=O)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1)c1cnn(C)c1	798940449	IIIPFLWNLPUKTB-FCHUYYIVSA-N	433.512	1.882	50	20	IDGD	
CCOc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NNC(=O)c1cn(C)c2ccccc12	799259324	YLPGWSWGRVHJRJ-UHFFFAOYSA-N	425.401	1.885	50	20	IDGD	
COc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NNC(=O)Nc2cc(F)cc(F)c2)cc1	802007498	LNMUACWKLPMACD-JTQLQIEISA-N	428.417	1.493	50	20	IDGD	
C[C@@](O)(Cn1cc(C(F)(F)F)ccc1=O)C(=O)NNC(=O)Nc1ccc2c(c1)OCO2	802104944	MPNOCUJXMVRDMS-QGZVFWFLSA-N	442.350	1.200	50	20	IDGD	
COc1ccccc1O[C@H]1CCCN(C(=O)NNC(=O)CNC(=O)c2cccs2)C1	805044455	SUIPGMJYYPKKOI-AWEZNQCLSA-N	432.502	1.771	50	20	IDGD	
COCCN1C(=O)c2ccc(C(=O)NNc3ccc([N+](=O)[O-])cc3C)cc2S1(=O)=O	805378850	OINXUIPIQCGRIJ-UHFFFAOYSA-N	434.430	1.451	50	20	IDGD	
COc1ccc(N2CCN(CCNC(=O)NNc3ccc4c(=O)[nH]ccc4c3)CC2)cc1	806620338	SRYSKLMDPHJRMV-UHFFFAOYSA-N	436.516	1.985	50	20	IDGD	
COC(=O)c1cc(C)c(NC(=O)C(=O)NNC(=O)CCc2ccccc2O)c(Cl)c1	806979234	WNTGDNJROHILNA-UHFFFAOYSA-N	433.848	1.859	50	20	IDGD	
COC(=O)c1cn(CCNC(=O)NNC(=O)c2cc(C)n(-c3ccccc3)c2C)nn1	807251072	JMSIDMAGCOWVMH-UHFFFAOYSA-N	425.449	1.116	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)c1ccc(Br)c(S(C)(=O)=O)c1	807369473	VJFPUHMJHRCJSD-UHFFFAOYSA-N	437.312	1.403	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNc2ccc(-n3ccnc3)nn2)cccc1OCC(F)(F)F	807429016	OARWBBZECCYQLR-UHFFFAOYSA-N	435.366	1.994	50	20	IDGD	
O=C(COc1ccccc1O)NNS(=O)(=O)c1cc([N+](=O)[O-])c(Cl)cc1Cl	809815661	NAEKCFXMQMQGHM-UHFFFAOYSA-N	436.229	1.996	50	20	IDGD	
Cn1nncc1NC(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2Cl)c1	809899587	RHXKHMUOLNOZCJ-UHFFFAOYSA-N	449.880	1.736	50	20	IDGD	
Cc1c(Cl)c(C(F)(F)F)nn1CC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	809933249	XIBQTQLCBPKZOE-UHFFFAOYSA-N	442.785	1.572	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)CNS(=O)(=O)c2cccc(Br)c2)cc1	810267633	BOJKLNBOKAAFQB-UHFFFAOYSA-N	437.275	1.060	50	20	IDGD	
Cc1nc(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)ccc1-c1ccccc1	810384283	BTQJRVJGQNEPQZ-IBGZPJMESA-N	432.436	1.983	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)c2cccnc2I)cc1	812732234	XONIENGTAMABAK-UHFFFAOYSA-N	446.270	1.693	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@H](C)C(=O)NNC(=O)CN1C(=O)[C@H]2CC=CC[C@H]2C1=O	814738703	JZYMIAJXKHQLDN-BMFZPTHFSA-N	433.892	1.823	50	20	IDGD	
COCc1cc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2OC)cc(C(=O)OC)c1	815567793	MFOFPYPFUWRKPV-UHFFFAOYSA-N	449.847	1.681	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1cc2c(cc1Cl)OCO2	815751905	UDYVBEUMMUHQFP-UHFFFAOYSA-N	440.865	1.401	50	20	IDGD	
CCn1c(CCC(=O)NNc2ncncc2F)nc2cc(S(=O)(=O)N(C)C)ccc21	817081833	KBGCQKPLEJAKMX-UHFFFAOYSA-N	435.485	1.312	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)CN2C(=O)N[C@](C)(c3ccc(F)cc3)C2=O)c1	818484574	UDVHYCADSKFDLE-OAQYLSRUSA-N	428.420	1.128	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)NC[C@H](CO)Cc2cnn(C)c2)c(C)n1C[C@@H]1CCCO1	819666446	RLFYCQVMEFFQRS-NHHWWCSGSA-N	425.533	1.892	50	20	IDGD	
COC(=O)c1c(F)cccc1NNC(=O)CN1C(=O)N[C@](C)(c2ccc(F)cc2)C1=O	819710351	HRTALVLNCUSZBN-HXUWFJFHSA-N	432.383	1.662	50	20	IDGD	
O=C(CNc1ccccc1)NNC(=O)C1CCN(S(=O)(=O)/C=C\c2ccccc2)CC1	823328520	GBHIZQACCQKKAX-SSZFMOIBSA-N	442.541	1.959	50	20	IDGD	
O=C(NNC(=O)[C@@H](O)[C@@H](O)c1nc2ccccc2s1)c1cc(Br)c[nH]1	843450683	PIZMVKNHCCKYGS-NWDGAFQWSA-N	425.264	1.242	50	20	IDGD	
CC(C)C[C@H](/N=C1/NS(=O)(=O)c2ccccc21)C(=O)NNC(=O)c1ccccc1F	859391689	VFGDACMNCVPQCL-INIZCTEOSA-N	432.477	1.740	50	20	IDGD	
CCC1(CC)NC(=O)N(CC(=O)NNC(=O)COc2ccc(Br)cc2)C1=O	871018943	JJWVFQUEZQIQMB-UHFFFAOYSA-N	441.282	1.086	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CS[C@@H](Cc2ccccc2F)C(=O)N1)c1c[nH]c2ccccc12	896280625	GPRMGPQOWSJNFD-ROUUACIJSA-N	426.473	1.911	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)Cc2ccc(S(=O)(=O)N3CCOCC3)s2)cc1	906477154	RCRUHFINEOYLRO-UHFFFAOYSA-N	437.543	1.335	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)CNS(=O)(=O)c2ccc3ccccc3c2)c1	913446064	IIWMMBRDUKWKNO-UHFFFAOYSA-N	441.509	1.961	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)[C@H]1CC[C@H](C(F)(F)F)NC1=O	914829712	NHLUYTGSIBWVJV-WDEREUQCSA-N	438.200	1.432	50	20	IDGD	
CCn1c(NNC(=O)c2[nH]c(C)c(C(=O)OCCOC)c2C)nc2ccccc2c1=O	915639413	XKTZCJWEAHJTHT-UHFFFAOYSA-N	427.461	1.921	50	20	IDGD	
Cc1cc(C)n(CCCNC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)n1	915889567	HUFGWKPIPNZMKF-UHFFFAOYSA-N	448.549	1.319	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NC[C@@H](c1cccs1)N1CCN(C)CC1	915902136	QDPQVNRVFYDFGZ-YJBOKZPZSA-N	449.552	1.974	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NCc2cn3ccccc3n2)c2ccccc2c1=O	915910204	VXEDTTRVKOPWMQ-UHFFFAOYSA-N	433.472	1.989	50	20	IDGD	
Cn1ncc2c1CCC[C@H]2NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	916604499	IRVQPGTYPIFLIV-QGZVFWFLSA-N	446.533	1.226	50	20	IDGD	
CC(=NNC(=O)C(=O)Nc1ccc(C)cc1)c1ccc(S(=O)(=O)N2CCOCC2)cc1	917031150	FOSPWBYRPZYAHL-UHFFFAOYSA-N	444.513	1.495	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)c2csnn2)c1	917899909	MXXDFMWWYMZHSE-UHFFFAOYSA-N	433.471	1.422	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CS[C@H](Cc2ccccc2F)C(=O)N1)c1ccc2ccccc2n1	935742359	HMWCSKUYIMCRQZ-RBUKOAKNSA-N	438.484	1.978	50	20	IDGD	
CC(C)c1nn([C@H]2CCS(=O)(=O)C2)cc1C(=O)NNc1nc2ccccc2c(=O)n1C	1319123140	JSGWXJJVVSGNLY-ZDUSSCGKSA-N	444.517	1.370	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)c1cc2c(c(S(N)(=O)=O)c1)CCC2	1320849604	TUDRFKZBNRANCK-LLVKDONJSA-N	437.905	1.705	50	20	IDGD	
Cc1nn(CC(F)(F)F)c(C)c1CC(=O)NNC(=O)C1CCN(c2ncccn2)CC1	1323150302	IKDPRTBRRNQOGR-UHFFFAOYSA-N	439.442	1.459	50	20	IDGD	
O=C(c1ccc2ncoc2c1)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1778010312	IUNFDLAQFQXDOS-YOEHRIQHSA-N	426.242	1.962	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2)c1ccc2c(c1)OCCO2	1778442191	ZINYLURQHPQETE-FQELHTAISA-N	438.908	1.185	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2)c1cc2sccc2[nH]1	1779143463	VHDOKSWTYLGWCQ-IDHHARJASA-N	425.938	1.957	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Cl)C2)c1ccccc1-n1nccn1	1781040228	HEEJFQXUEYDZHL-FUHIMQAGSA-N	435.887	1.929	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2)c1ccc(-c2cc[nH]n2)cc1	1781064433	IGQWZCAWKOPLDP-NNMXDRDESA-N	446.935	1.804	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc3cccnn3c2)C1	1781328991	UMEYIXRMZLFKLW-DBXWQHBBSA-N	434.924	1.716	50	20	IDGD	
O=C(c1cc2ccccn2n1)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781329647	IGRJAOBXINKLOG-RHSMWYFYSA-N	425.258	1.468	50	20	IDGD	
O=C(CC12CCCN1CCC2)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781333019	CUHZAJAYSJNPLZ-YJBOKZPZSA-N	432.334	1.525	50	20	IDGD	
CCOc1ccc(Cl)cc1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1781743582	SYGJHJQKVQVFDB-HNAYVOBHSA-N	431.316	1.782	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCSC(=N)N)C2	1781998007	MHOMPFUUMDLQJS-HWWQOWPSSA-N	435.388	1.300	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1nccc3[nH]ccc13)C2	1782172692	KDEYPWHWQTYNRY-QLVMHMETSA-N	434.924	1.944	50	20	IDGD	
O=C([C@@H]1Cc2[nH]nc(C(F)(F)F)c2C1)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Cl)CCO2	1782847015	KJPPSPUAJOOUTF-UOWOHEGISA-N	438.809	1.508	50	20	IDGD	
O=C1CC(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](Br)Cc4ccccc4)C3)C2)C1	1783021719	GJQFDIYWAPZMHE-GHTZIAJQSA-N	449.345	1.802	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3[nH]nc4ccncc34)CCO2)C1	1783347275	DXTTYQKTELISRA-UGSOOPFHSA-N	436.310	1.575	50	20	IDGD	
COC(=O)c1ccc(OCC(=O)N2CCO[C@]3(CCN(C(=O)C(Cl)Cl)C3)C2)cc1	1783951452	BIIGCJZRJCXVKN-LJQANCHMSA-N	445.299	1.486	50	20	IDGD	
CC[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CO[Si](C)(C)C)C[C@@H]21)N(CC)CC	1784626397	DJMUDNLHBZLOKN-VJANTYMQSA-N	427.662	1.938	50	20	IDGD	
C[C@@H](NC(=O)c1ccccc1)C(=O)N1CC[C@@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1785557466	LLWQYMSTBBTUBE-VGOFRKELSA-N	447.608	1.486	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCBr)[C@H]2C1)N1C[C@H]2C[C@@H]2C1	1786406537	XBBBVDZAOYRSJY-NEMWNAMBSA-N	428.371	1.091	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCBr)[C@H]2C1	1786408845	GPLATUWPBPARJC-ASHKBJFXSA-N	430.170	1.987	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(OCCCO)cc3)C[C@@H]21)[C@@H](F)Cl	1787447709	DNVYYCHEOKOZHS-LEUOFYLZSA-N	428.888	1.576	50	20	IDGD	
C[C@@H](Sc1cccs1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21	1788483444	ZISZPXPIYIMUMH-QTVXIADOSA-N	432.995	1.808	50	20	IDGD	
C=C[C@H](O)C(C)(C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)CBr)C[C@@H]21	1788570272	PRJXMRDJZRVWLW-YXMSTPNBSA-N	431.371	1.570	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1ccc(C2(NC(=O)CCC(N)=O)CCC2)cc1	1788648912	MMXCNHGQSVUJIN-MZJWZYIUSA-N	438.488	1.520	50	20	IDGD	
CCCC(=O)N[C@H](C)C(=O)Nc1ccc(C2(NC(=O)CCC(=O)NN(C)C)CCC2)cc1	1789632409	GGPOCTYUSUUUOZ-MRXNPFEDSA-N	445.564	1.798	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc(OCF)cn3)C[C@@H]21)[C@H](F)Br	1789922210	IEXZYXOLTOCMNE-WRZDFSGXSA-N	449.252	1.066	50	20	IDGD	
Cc1n[nH]c(C)c1CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]21	1789976938	SDOYLZLNHPJXKD-QBWPOKONSA-N	431.364	1.785	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)[C@@H]1Cc2ccccc2N1	1790683805	VUYRZAUKLYBGFZ-XPYWIHLFSA-N	440.313	1.693	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCC(=O)N3CCCC3)C[C@@H]21	1791055160	MALIUTYATQQJQZ-VGWMRTNUSA-N	444.370	1.152	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnn4ccncc34)C[C@@H]21	1791055996	LNMDEXKEXCDZRX-DSPQJCBJSA-N	436.310	1.106	50	20	IDGD	
C[C@H](Oc1cccnc1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21	1791655293	MTEIMRXABZTXFF-OSZUESSQSA-N	444.301	1.519	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C#CC1(O)CCCCC1)C2	1792871450	ZFANFKYQTLXAOA-CUSZFKRNSA-N	441.366	1.306	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1CCCCC1	1795867315	VINSNEPFTMOPAI-DPEPCVEMSA-N	428.537	1.245	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1nccc2occc12	1795973626	FWQNNVCAJOUMBY-FJHTZYQYSA-N	426.242	1.722	50	20	IDGD	
Cc1ccc(OCCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)cc1	1796185795	QCJWUXMNLRBDMM-WKCHPHFGSA-N	436.317	1.396	50	20	IDGD	
Cc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Br)C3)ncc1[N+](=O)[O-]	1796602146	URLHSCKZHAWNLG-RDBQEKCUSA-N	445.245	1.192	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C(C)(C)NCCC#N)C2	1796892132	KEGYDYKRKPSHID-CKFWPPNZSA-N	441.536	1.040	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1nc2c(=O)[nH]c3ccccc3n2n1)[C@H](F)Cl	1797659592	VKCVRCTWWVLXFY-MIJXAVMKSA-N	432.843	1.357	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc3snnc3c1)C2	1797957636	SCERZNKDEOHKBP-YWVIFJGQSA-N	435.582	1.141	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)S)C2	1798523169	VAYOGOZJCGAPGH-AKENFEQQSA-N	437.474	1.042	50	20	IDGD	
CN(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H]1CCCO1)C2)NC(=O)NCc1ccccc1	1799869075	AQBPBZKFDAJEBC-YRPNKDGESA-N	443.548	1.150	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C/N=C/c1ccco1)C2	1800641701	HZTAUAQLVGNLKL-BYWNUXONSA-N	426.311	1.462	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3n(n1)CCCC3)C2	1800641748	IQSGUAWZYHOKND-IARIHHJXSA-N	439.354	1.596	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cn1cccc([N+](=O)[O-])c1=O	1801356362	YJYRBVOHRISLBN-QDMKHBRRSA-N	436.541	1.246	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](CCO)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C(Cl)Cl	1802342778	OQFOHJPVNGTDIS-YVECIDJPSA-N	438.352	1.704	50	20	IDGD	
CC1(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)CCCC1	1802620644	RPFSFYRZCCXGML-TZIWHRDSSA-N	435.333	1.661	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2nnsc2C2CC2)[C@H]1c1cccnc1)[C@H](O)CCl	1803139480	PZIIXTHFSAGGSW-LZWOXQAQSA-N	435.937	1.730	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccn(C(F)F)n2)[C@H]1c1cccnc1)[C@@H](O)CCl	1803141153	LJPRWQRRHHEZQZ-QEJZJMRPSA-N	427.839	1.593	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@H](CNC(=O)CN2CCOC2=O)[C@H]1c1cccnc1	1803337996	FPWDAWVDVDRRDT-QFBILLFUSA-N	434.569	1.391	50	20	IDGD	
CC(=O)N(C)CCC(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)Br)[C@H]1c1cccnc1	1804071615	GIWCVPHVCPFTCV-SKDZVZGDSA-N	439.354	1.739	50	20	IDGD	
C#CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](O)CCl)C2	1804371181	YWSXHHZGOBLPSM-YIDVYQOGSA-N	427.929	1.141	50	20	IDGD	
COc1nccnc1C(=O)NC[C@@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1	1804971698	PJOAJMJKFLWOQX-WMLDXEAASA-N	448.321	1.985	50	20	IDGD	
Cc1ccc(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)nc1	1805867758	HTYIAPDTKVMOBE-SIKLNZKXSA-N	444.300	1.098	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)Cc2cccs2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807362193	FNSOCICLWSJFOA-GCJKJVERSA-N	449.341	1.385	50	20	IDGD	
COc1nccc(C(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)c1F	1807711230	KDTSLPRHAJGQQV-YSVLISHTSA-N	436.871	1.544	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)C(Cl)Cl)[C@@H]1c1cccnc1)c1cccn2c(O)nnc12	1808193841	GKAQVYQFPOVLFG-GXTWGEPZSA-N	449.298	1.953	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2ncn(C(C)C)n2)[C@@H]1c1cccnc1	1808721521	NICJESKREYEIRJ-ULQDDVLXSA-N	434.928	1.827	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC2(CCCN(C(=O)c3cnoc3C3CC3)C2)CC1	1808884290	XIWGUYZHMMCTSF-UHFFFAOYSA-N	437.305	1.390	50	20	IDGD	
O=C(CCN1CCOC1=O)NC[C@@H]1CCN(C(=O)C(Cl)Cl)[C@H]1c1cccnc1	1809532092	JTLQCEXXDOLSAY-ZFWWWQNUSA-N	429.304	1.733	50	20	IDGD	
C[C@H](Cc1ccco1)C(=O)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1	1809972446	IXMJKWQCQAFBDZ-GOSISDBHSA-N	438.333	1.683	50	20	IDGD	
CC[S@](=O)CCC(=O)NC[C@@H]1CCN(C(=O)[C@@H](Cl)COC)[C@H]1c1cccnc1	1810119976	BXRBGPDLPCUFCA-KUSCHIDGSA-N	429.970	1.500	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)n2)[C@H]1c1cccnc1	1810542446	RMUZZXDEODYGKH-KSSFIOAISA-N	445.552	1.454	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)n3)C2)CC1	1810881858	AULRMVWNYQLTGD-LBPRGKRZSA-N	441.326	1.764	50	20	IDGD	
Cn1ccc(=O)cc1C(=O)NC[C@@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1	1811361102	UBGAVWUOKKBASF-KXBFYZLASA-N	447.333	1.885	50	20	IDGD	
COc1cc(C(=O)NC[C@H]2CCN(C(=O)C(Cl)Cl)[C@H]2c2cccnc2)nn1C	1811633339	BYABGCMPGFSXJZ-DOMZBBRYSA-N	426.304	1.947	50	20	IDGD	
Cc1cc(C(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@H]2c2cccnc2)nc2nccn12	1812167962	NHSUYODZNFBXRX-JQHSSLGASA-N	442.907	1.352	50	20	IDGD	
C[C@H](NC(=O)c1ccccn1)C(=O)NC[C@@H]1CCN(C(=O)[C@H](F)Cl)[C@@H]1c1cccnc1	1812347687	PFWXHCWBWZYYGG-PLYYQAHHSA-N	447.898	1.835	50	20	IDGD	
Cc1ncoc1C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1813070419	IVFBSJNMTIKVCL-VQIMIIECSA-N	428.493	1.071	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1CCc2nc(NC(=O)CN3CCOCC3)sc2C1	1814557315	BFDQRZSTOMTFDP-VXGBXAGGSA-N	445.383	1.418	50	20	IDGD	
COc1cnc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)[C@H](O)CCl)n[nH]2)c(F)c1	1814869750	ZHXIKOBDDNFNFE-ZIAGYGMSSA-N	425.848	1.858	50	20	IDGD	
C#CCCCCC(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1	1815348362	LFQJLHIXVRULHN-INIZCTEOSA-N	425.319	1.242	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnc(O)nc3O)sc2C1	1817090091	SXGCFJORPCJOBW-RNFRBKRXSA-N	442.295	1.354	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)C(F)(F)C(F)F)[nH]n1)c1ccc(B(O)O)cc1	1817470144	KELIHPYXPOIRJS-CYBMUJFWSA-N	442.178	1.296	50	20	IDGD	
CC[C@H](O)C(=O)N1CCCC[C@H]1c1cc(NC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)n[nH]1	1818110363	CHVLKEUZXKXDTR-CCODGHKUSA-N	429.481	1.307	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](O)CCl)CC2)c1cccc2c1OCCO2	1818311726	UUEGNPLQRNEIEM-GXFFZTMASA-N	437.905	1.740	50	20	IDGD	
Cn1cc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)[C@H](O)CCl)[nH]n2)c(C(F)F)n1	1818368384	KLEGCROTTKVZJQ-NWDGAFQWSA-N	430.843	1.986	50	20	IDGD	
C[C@@]1(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cnccc3C(=O)NN)n[nH]2)CC1(F)F	1819404319	GVJMPUMGHHNMAN-KUHUBIRLSA-N	447.446	1.759	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1)c1cnc2c(c1)CCNCC2	1821698769	OIFCVEAUCSLHII-QZTJIDSGSA-N	446.939	1.399	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnc(N(C)C)o2)[nH]n1	1822412731	HKHBVUGMYHORFO-AWEZNQCLSA-N	446.512	1.143	50	20	IDGD	
C[C@H](C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1)c1ccccn1	1822897207	DWKPDIDBPWSVHC-MAUKXSAKSA-N	441.536	1.974	50	20	IDGD	
COc1cc(C(=O)N[C@H]2CCc3nc(NC(=O)[C@@H](F)Br)sc3C2)n(C)n1	1823001861	MBXHFTSCCDVJQV-JVXZTZIISA-N	446.302	1.802	50	20	IDGD	
O=C(Cc1ccc2ncnn2c1)N1CCC([C@H]2CCCCN2C(=O)[C@@H](O)CCl)CC1	1824184422	MTPAKRSFDBKUSX-MSOLQXFVSA-N	433.940	1.491	50	20	IDGD	
O=C(Cn1ccncc1=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](F)Br)CC2	1824536688	QGPQVPYJJSTQQO-SDBXPKJASA-N	444.286	1.003	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)C1=NN(C)C(=O)CC1)CC2	1825636651	YGOBDVIZVJZHGW-DTWKUNHWSA-N	442.339	1.447	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)Cn1nc(C)cc1C)CC2	1825994728	YHCSMUCKKVNSGP-QWHCGFSZSA-N	425.942	1.822	50	20	IDGD	
C=C(CC(=O)OCC)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](Cl)COC)sc2C1	1826007011	POEHPLWCMKJUQL-NEPJUHHUSA-N	429.926	1.818	50	20	IDGD	
CCc1cc(C(=O)N[C@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)nn1C	1826088146	SLQKXZFBXMDAFG-LBPRGKRZSA-N	447.565	1.038	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](N)CCC(N)=O)CC1	1826822477	MTCHOSBKVIIJJP-JYJNAYRXSA-N	445.402	1.372	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)C1(O)CCC1)CCO2	1829746827	TZIULRBJDAKCNU-RLFYNMQTSA-N	447.370	1.167	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccccc3)C2)C1	1830538071	VDAZJDTWXIJCCL-JXFKEZNVSA-N	439.350	1.717	50	20	IDGD	
Cc1c[nH]cc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2	1830538285	AUBLUCWTQNMTNU-SCLBCKFNSA-N	428.327	1.424	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](O)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H](F)Cl)CC1	1830667980	QMOUNJWWWGEGFS-QLFBSQMISA-N	435.924	1.984	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3CC[C@H](C(=O)OC)C3)C2)C1	1831638635	FKXLCNTXIQMOHJ-IAGYGMIVSA-N	444.956	1.440	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)C(=O)Nc2cccnc2)CC1	1831831177	PWYUGTHBMRDXKW-MSOLQXFVSA-N	436.940	1.894	50	20	IDGD	
C[C@@H](C(=O)N1CCC(N2CCC(NC(=O)C(C)(C)CCl)CC2)CC1)n1cnnn1	1833216153	WHAUYQDBZFUYLU-AWEZNQCLSA-N	425.965	1.071	50	20	IDGD	
Cc1nc(C(=O)N2CCOC[C@]3(CN(C(=O)CCBr)CCO3)C2)ccc1F	1834819533	VECZVVRAZCQGLE-SFHVURJKSA-N	444.301	1.384	50	20	IDGD	
C[C@H](C(=O)N1CCC(N2CCC(NC(=O)[C@H](F)Br)CC2)CC1)n1cccn1	1836414377	HGVMJYUNDOEILH-CJNGLKHVSA-N	444.349	1.706	50	20	IDGD	
C/C(=C/C(=O)N1CCC(OC2CCN(C(=O)CCBr)CC2)CC1)C(=O)O	1837654703	MLIMQEIRQHFLLT-SEYXRHQNSA-N	431.327	1.801	50	20	IDGD	
C[C@@H](Nc1cnccn1)C(=O)N1CCC(OC2CCN(C(=O)[C@H](F)Cl)CC2)CC1	1838082063	DDFVJLFAINDDCE-DYVFJYSZSA-N	427.908	1.810	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)c3c[nH]c(=O)cn3)CC2)CC1	1838539020	CZCXTKCKAZWTAR-GFCCVEGCSA-N	441.326	1.166	50	20	IDGD	
Cc1cnc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)cn1	1839151151	JMMVWIUJQGCRLC-ZWKOTPCHSA-N	431.320	1.091	50	20	IDGD	
O=C(C1CC(F)(F)C1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839197483	XWXAEUAYQHZVMV-FZMZJTMJSA-N	429.233	1.179	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C1(CC)COC1)CCO2	1839778730	OHAJDVRVTIFFLP-KSSFIOAISA-N	433.343	1.043	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3ccc(C)s3)C2)C1	1840151302	YCUHOJITBCOXLB-XLIONFOSSA-N	444.981	1.699	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(C)nc3C)C2)C1	1840153931	GDMGUZSCEJHRRJ-XLIONFOSSA-N	425.913	1.022	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C(C)=C/c3cccnc3)C2)C1	1840156123	OFTFOGWKWJKWOG-QCXXREMRSA-N	437.924	1.195	50	20	IDGD	
CC(=O)Nc1ccccc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840190658	GTZKGQOGIWBINV-IBGZPJMESA-N	444.315	1.519	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCCn3ccnc3C)CCO2)C1	1840388337	UIKAOAFWEZRHFN-FXAWDEMLSA-N	426.945	1.446	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(CO)c(F)c3)CCO2)C1	1840781658	DIYXNAUJELTWJZ-LAUBAEHRSA-N	442.915	1.796	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@](C)(C(=O)N2CC3(CCCN3C(=O)[C@@H](O)CCl)C2)C1	1841351299	KRQZGXJKBWWBFE-LIRRHRJNSA-N	429.945	1.437	50	20	IDGD	
O=C([C@@H](F)Cl)N1CC2(CCCN2C(=O)CN2C(=O)C3(CCOCC3)c3ccccc32)C1	1845021027	ZHIGQMNYWKVESE-GOSISDBHSA-N	449.910	1.819	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCCC12CN(C(=O)Cn1cccc([N+](=O)[O-])c1=O)C2	1845172328	CAVDSSSKTMJAPM-MRXNPFEDSA-N	431.276	1.196	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(CC(=O)N2CCCC23CN(C(=O)C(Cl)Cl)C3)CC1	1846968017	DPELINYCXOSOCT-UHFFFAOYSA-N	449.379	1.546	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc1[N+](=O)[O-]	3554510	IJGSGFSVJCWQNY-UHFFFAOYSA-N	432.458	1.763	50	20	IDGD	
C[C@@H]1CN(S(=O)(=O)c2cccc(C(=O)NNC(=O)c3ccccc3F)c2)C[C@@H](C)O1	15794805	RBPQHAINENRDNB-ZIAGYGMSSA-N	435.477	1.698	50	20	IDGD	
Cc1ccc(C(=O)O)cc1S(=O)(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12	18995345	SGFXOFFHFUYLFR-UHFFFAOYSA-N	444.469	1.607	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)CCN2C(=O)[C@H]3CCCC[C@H]3C2=O)cc1	195489977	SULPVFAUSADPCR-OLMNPRSZSA-N	431.489	1.565	50	20	IDGD	
COc1cccc([C@@H](CNC(=O)NNC(=O)CNC(=O)c2ccco2)N2CCCC2)c1	726085530	IZERWVJUARPASL-QGZVFWFLSA-N	429.477	1.186	50	20	IDGD	
COc1cc(C(=O)NCC(=O)NNc2nc(-c3ccncc3)no2)cc(OC)c1OC	726377280	UERKWDIVTFKKIU-UHFFFAOYSA-N	428.405	1.031	50	20	IDGD	
CS(=O)(=O)NCCNC(=S)NNC(=O)c1cc(-c2ccccc2)nc2ccccc12	727064947	FENHUGJINIZXBW-UHFFFAOYSA-N	443.554	1.560	50	20	IDGD	
CC(C)CCC(=O)NNC(=O)N1CCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)CC1	727482019	LMSVMMNMALIVFA-UHFFFAOYSA-N	427.483	1.078	50	20	IDGD	
COc1ccc(CCNC(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)c(OC)c1OC	727945103	ISXXBYKREPPAHZ-UHFFFAOYSA-N	444.488	1.841	50	20	IDGD	
O=C(COC(=O)c1ccc(-c2ccccc2)nc1O)NNC(=O)[C@@H]1COc2ccccc2O1	728327427	KSFUUHVFPKZTQV-IBGZPJMESA-N	449.419	1.598	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)c2cnn(-c3ccc(O)nn3)c2C)c1	728529056	RMQIRCWCGMQHJB-UHFFFAOYSA-N	447.249	1.522	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)Cc2ccc(-n3nc(C)cc3C)cc2)n1	728728664	YTRSUFYOWXSZSV-UHFFFAOYSA-N	441.513	1.730	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)N2CCN(C(=O)Cc3ccc(Cl)cc3)CC2)c1	728953885	YMENPQIPZYESTP-UHFFFAOYSA-N	425.876	1.953	50	20	IDGD	
C[C@H](NC(=O)c1n[nH]c2ccccc12)C(=O)NNc1ccc(S(=O)(=O)C(F)F)cc1	728971958	NONVPAXFMNQWMD-JTQLQIEISA-N	437.428	1.821	50	20	IDGD	
CC[C@@H](NC(=O)NNC(=O)COc1cc(C)cc(C)c1)c1cccc(S(N)(=O)=O)c1	729612200	BLOSFUDUVHNAOL-GOSISDBHSA-N	434.518	1.811	50	20	IDGD	
COc1ccc(-n2c(C)cc(C=NNC(=O)CSc3nnc(O)nc3O)c2C)cc1	730557959	BUTTYUAXHIFRJK-UHFFFAOYSA-N	428.474	1.941	50	20	IDGD	
CC(=O)Nc1ccc(NS(C)(=O)=O)c(C(=O)NNC(=O)Cn2ccc3ccccc32)c1	731441566	ZHZATLADYBQWQY-UHFFFAOYSA-N	443.485	1.432	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)c1cccc(CN2CCS(=O)(=O)CC2)c1)c1ccccc1	731995838	BLQCUCBVDSTGGN-HXUWFJFHSA-N	429.542	1.872	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccc(C(=O)NNc2ccccc2S(C)(=O)=O)cc1	732301899	MQCGQFANMVTXFF-UHFFFAOYSA-N	425.532	1.924	50	20	IDGD	
CC[C@@H](C)NS(=O)(=O)c1ccc(C(=O)NNc2nc3ccccc3c(=O)n2C)cc1	733263646	ORUFRHMUOROSIF-CYBMUJFWSA-N	429.502	1.767	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1cc(I)c[nH]1	734436430	XRBIMEMSXBUUQM-UHFFFAOYSA-N	440.245	1.087	50	20	IDGD	
CN1C(=O)C[C@H](C(=O)OCC(=O)NNC(=O)c2cccs2)[C@H]1c1cccc(Cl)c1	734636052	LOTRGXVMVAATSB-SUMWQHHRSA-N	435.889	1.925	50	20	IDGD	
CCOCCCN1CC[C@@H](NC(=O)NNC(=O)c2nnc(O)c3ccccc23)[C@H](C)C1	734682506	BJQGUXOLSUEREG-RHSMWYFYSA-N	430.509	1.416	50	20	IDGD	
CCOCCCN1CC[C@@H](NC(=O)NNC(=O)c2nnc(O)c3ccccc23)[C@@H](C)C1	734682507	BJQGUXOLSUEREG-WMLDXEAASA-N	430.509	1.416	50	20	IDGD	
COc1ccc(S(=O)(=O)Nc2cccc(CNC(=O)NNC(=O)c3ccc[nH]3)c2)cc1	734684275	MURCCLGEAMJUHD-UHFFFAOYSA-N	443.485	1.968	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)c2cc(S(=O)(=O)Nc3ccccc3Cl)ccc2O)cn1	735443557	DLXYISFHPVZEOE-UHFFFAOYSA-N	449.876	1.655	50	20	IDGD	
Cc1nonc1CNC(=O)/C(C#N)=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	736144132	GBWLNDWREOTDSY-ZSOIEALJSA-N	439.863	1.994	50	20	IDGD	
COCCN1CC[C@@H](NC(=O)NNC(=O)[C@H](C)Oc2cccc(Br)c2)C1	736650578	XFEXUFBPNZIUCS-GXTWGEPZSA-N	429.315	1.268	50	20	IDGD	
O=C(COC(=O)[C@@H]1CCCN(C(=O)COc2ccccc2)C1)NNC(=O)c1cccs1	741370391	CZQFBQDLZJELRQ-OAHLLOKOSA-N	445.497	1.370	50	20	IDGD	
NC(=O)CS(=O)(=O)c1ccc(C(=O)NNC(=O)C2=S=C3CCCCCCC3=C2)cc1	742480114	HMOYHFUQRUUMLV-UHFFFAOYSA-N	449.554	1.079	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NN=Cc2ccc(-n3cncn3)c(C)c2)cc1	743426798	VVSWJKIFJDZGOE-UHFFFAOYSA-N	426.502	1.655	50	20	IDGD	
COc1ccc(CNC(=O)CNC(=O)NNC(=O)c2cccc(Br)c2)cc1	743687990	UCMOBZOWQAJYAI-UHFFFAOYSA-N	435.278	1.718	50	20	IDGD	
Cc1cc(=O)c(C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)nn1-c1ccccc1	744524417	FOWAJLQFSATNEV-UHFFFAOYSA-N	431.408	1.031	50	20	IDGD	
CCN(C)[C@@H](C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1)c1ccccc1	745102656	YLENJXCGQIGTIW-AZUAARDMSA-N	427.457	1.210	50	20	IDGD	
O=C(NCc1noc(-c2cccs2)n1)NNC(=O)c1csc(N2CCOCC2)n1	745183033	MTKXNESWHLUVNG-UHFFFAOYSA-N	435.491	1.235	50	20	IDGD	
C[C@H](CC(=O)c1cccc(F)c1)C(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	745399155	RUGPKZPJNDSAQM-GFCCVEGCSA-N	431.376	1.947	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)CCc1c(C)nc2c(c(O)nn2C)c1C	746094121	APYXNMAPGBAVLI-UHFFFAOYSA-N	427.461	1.458	50	20	IDGD	
CC(C)CCn1nc(C(=O)NNS(=O)(=O)C[C@@H]2CCCCO2)c2ccccc2c1=O	748790315	CIJYKQSXQLHJGD-HNNXBMFYSA-N	436.534	1.576	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cccc(Cl)c2[N+](=O)[O-])cc1	749865351	JRCBHRFWZBDTKB-UHFFFAOYSA-N	440.865	1.638	50	20	IDGD	
C[C@@H](C(=O)OCC(=O)NNC(=O)c1cccc(Cl)c1)N1C(=O)[C@@H]2CCCC[C@H]2C1=O	750280521	QAVGQAXFBZZVCM-NILFDRSVSA-N	435.864	1.208	50	20	IDGD	
O=C(NNC(=O)c1ncccc1O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	750665289	WDEXXJJLYBZOSI-UHFFFAOYSA-N	426.454	1.341	50	20	IDGD	
C[C@H](NC(=O)/C(C#N)=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)c1nc[nH]n1	752637705	LINHKLVBFWRALQ-QENILXLESA-N	438.879	1.981	50	20	IDGD	
O=C(NCCN1C(=O)[C@@H]2[C@@H](C1=O)[C@H]1C=C[C@H]2C1)NNC(=O)c1cccc(Br)c1	755175720	HKXLZZGFRCGPCZ-GVARAGBVSA-N	447.289	1.200	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)Nc2cccc(S(=O)(=O)N3CCOCC3)c2)c(O)c1	755353498	JCWWLLMDEHIIOM-UHFFFAOYSA-N	434.474	1.188	50	20	IDGD	
CCOC(=O)COc1cccc(NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c1	755646253	LKMGRZITDQNDDW-UHFFFAOYSA-N	425.405	1.071	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(N2C[C@@H](C(=O)NNc3cc(C)ccn3)CC2=O)cc1	755847275	OXENSENDHDTCFV-INIZCTEOSA-N	445.545	1.917	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc(F)c1F	755952697	CTHNUJKZQHPCPS-UHFFFAOYSA-N	428.369	1.146	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)Nc1cccc(CS(C)(=O)=O)c1	756269214	OCMBTJULFDQNSJ-UHFFFAOYSA-N	428.511	1.689	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)[C@H](C)CS(=O)(=O)c2ccc(F)cc2)cc1	756713452	RJQNTPZDWUWPIQ-CQSZACIVSA-N	436.461	1.548	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)Nc1ccc(S(=O)(=O)NC2CC2)cc1	756775024	GLNHKIRPUNPRNB-UHFFFAOYSA-N	442.295	1.684	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)Nc1cnn(CC(=O)NC2CC2)c1	756794820	DQBYHOJPJFRIGK-CQSZACIVSA-N	436.472	1.935	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)CN1C(=O)NC2(C[C@@H](C)C[C@H](C)C2)C1=O	757736484	ZPKOGOUAKHNHDE-KBPBESRZSA-N	431.493	1.001	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)Nc1cccc2c1CCN2S(C)(=O)=O	758301663	WJRGMTZGCBQGAV-LBPRGKRZSA-N	436.465	1.768	50	20	IDGD	
COc1cc(C(=O)OCC(=O)NNC(=O)Cc2nc(C)cs2)sc1Br	758648001	PPDNNCATDJTPCW-UHFFFAOYSA-N	448.320	1.831	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)N[C@H]1Cc2cccc(O)c2C1	759486014	CPVANRKGIUVGEF-INIZCTEOSA-N	444.513	1.288	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCCC(=O)NNc1cc(Cl)nc(N)n1	761170874	ZKLZPXTWPKVSMO-SNVBAGLBSA-N	427.893	1.061	50	20	IDGD	
CC(C)c1nc(C(=O)NNc2nccc(N3CCOCC3)n2)nn1-c1ccccc1F	762848919	XCHVMEZUWGFUJC-UHFFFAOYSA-N	426.456	1.913	50	20	IDGD	
COc1ccc(Cl)c(S(=O)(=O)N2CCN(S(=O)(=O)CBr)CC2)c1	763206037	MMWJCJBWSMQZNT-UHFFFAOYSA-N	447.760	1.337	50	20	IDGD	
C[C@H](CC(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1)[C@H]1CCCN(C(=O)OC(C)(C)C)C1	763305725	YJEZGDQTWFTGBH-ILXRZTDVSA-N	446.570	1.177	50	20	IDGD	
O=C(NNC(=O)c1c[nH]c2ccccc12)C(=O)Nc1cccc(N2CCCS2(=O)=O)c1	763535523	VFBUVRGAAKUVNL-UHFFFAOYSA-N	441.469	1.108	50	20	IDGD	
Cc1cc(Br)ncc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccccc2)[nH]n1	763614163	SAWGKSWPDNFEIK-UHFFFAOYSA-N	443.261	1.942	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2cccc([C@H](C)N3CCOCC3)c2)c1	763619426	WPXSNRZYURLXBY-KRWDZBQOSA-N	440.500	1.553	50	20	IDGD	
C[C@H](C#N)CSc1ccccc1NC(=O)C(=O)NNC(=O)COc1ccc(C#N)cc1	763678153	DWWLFNCJMJYZCG-CQSZACIVSA-N	437.481	1.975	50	20	IDGD	
O=C(COc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1ccc(Cn2cncn2)cc1	763686827	VKPFJVYAGSTSDU-UHFFFAOYSA-N	428.836	1.145	50	20	IDGD	
O=C1C[C@@H](c2cccc(NC(=O)C(=O)NNC(=O)CSc3ccc(Cl)cc3)c2)CN1	763737394	XUJLJVXGQUPOGI-CYBMUJFWSA-N	446.916	1.822	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2cc(CN(C)C)ccc2OC)c1	763773468	YEASYUKDTGGGEH-UHFFFAOYSA-N	430.461	1.174	50	20	IDGD	
CC(C)(C)OC(=O)Nc1cc(C(=O)NNC(=O)CNC(=O)c2cccnc2)ccc1F	763813630	LAYZMLJMRNMRRW-UHFFFAOYSA-N	431.424	1.759	50	20	IDGD	
Cc1cc(C(=O)NC(C)C)ccc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccccc1F	763850542	NZNQXJLLRVBZEN-CQSZACIVSA-N	444.463	1.826	50	20	IDGD	
Cc1cc(=O)n(C)cc1NC(=O)C(=O)NNC(=O)c1ccc(-c2ccc(F)cc2)s1	763976676	ZEKFJFITHNYXCE-UHFFFAOYSA-N	428.445	1.961	50	20	IDGD	
CCOC(=O)c1cnn2c(C(=O)NNC(=O)c3ccc(CN(CC)CC)o3)ccnc12	763997968	CCPZCWGONWXFOL-UHFFFAOYSA-N	428.449	1.416	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccc(OCc2noc(C)n2)cc1	764136444	QNEGVNPLLYTCLK-UHFFFAOYSA-N	439.428	1.294	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccc(OCC2CCOCC2)cc1	764136793	SXXQVNPGXKCFJN-UHFFFAOYSA-N	441.484	1.829	50	20	IDGD	
CC(C)(C)OC(=O)N1CCc2ccc(NC(=O)C(=O)NNC(=O)c3ccoc3)cc2C1	764164193	RLKWFDINEDTVQI-UHFFFAOYSA-N	428.445	1.973	50	20	IDGD	
O=C(CCC1CCCCC1)NNC(=O)C(=O)Nc1ccccc1CN1C(=O)CCC1=O	764215196	NSHHIPCDCYALTB-UHFFFAOYSA-N	428.489	1.782	50	20	IDGD	
CS(=O)(=O)c1ccccc1NC(=O)C(=O)NNC(=O)c1c(Cl)cccc1Cl	764222055	SYYKHKGQGKMGGX-UHFFFAOYSA-N	430.269	1.797	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3cccc4ncccc34)cc2)CCO1	764257435	GWLCXGNLUONMSL-HNNXBMFYSA-N	433.468	1.860	50	20	IDGD	
O=C(NNC(=O)c1cccc(OC(F)F)c1)C(=O)Nc1ccc(O[C@H]2CCOC2)cc1	764259749	NMIJPRVRJJXOOH-INIZCTEOSA-N	435.383	1.855	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)C(=O)Nc1ccc(OCC2CC2)cc1	764261058	XANKRTRWHOCILJ-UHFFFAOYSA-N	438.488	1.268	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)C(=O)Nc1cccc(NC(=O)c2ccncc2)c1	764280496	ABSPQOQEGSZSFV-UHFFFAOYSA-N	447.451	1.758	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C(=O)Nc1ccc(C)c(NS(C)(=O)=O)c1)c1ccccc1	764327580	BXZOKLOHJHJGPP-INIZCTEOSA-N	432.502	1.646	50	20	IDGD	
O=C(NNC(=O)C(F)(F)Oc1ccccc1)C(=O)Nc1ccc(O[C@@H]2CCOC2)cc1	764379305	BFWJAMUVGGJACN-MRXNPFEDSA-N	435.383	1.612	50	20	IDGD	
CCN(CC)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ncccc2C)cc1Cl	764388158	AMPPPTVZKILFSQ-UHFFFAOYSA-N	431.880	1.925	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1cccc(-n2cccn2)c1	764397421	JGYMPMLEVFPVGS-UHFFFAOYSA-N	425.470	1.759	50	20	IDGD	
Cn1cc(Br)cc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2F)c1=O	764413077	MCDTWEVNNATGCP-UHFFFAOYSA-N	445.632	1.340	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)C(=O)Nc2ccc(OC(C)C)c(Cl)c2)c1	764432592	GUONUYNTUFBBSK-UHFFFAOYSA-N	433.852	1.880	50	20	IDGD	
CC(=NNC(=O)C1CCN(c2ncccn2)CC1)c1ccc(Cl)c(S(N)(=O)=O)c1	764686912	NFSIOPGUEXGVAI-UHFFFAOYSA-N	436.925	1.534	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NN=C1C(=O)Nc2cccc(Cl)c21	764828609	SCDHCHRTGBNFJY-UHFFFAOYSA-N	425.876	1.570	50	20	IDGD	
COCCCNC(=O)NNC(=O)CSc1nnc(-c2ccncc2)n1-c1ccccc1	765122656	YDKGUQBEGXIXQI-UHFFFAOYSA-N	441.517	1.788	50	20	IDGD	
Cc1ccc([C@@H](C)[C@@H](O)C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cc1	765178589	YLWSWBHOIPAHBA-XMSQKQJNSA-N	438.528	1.065	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)c1cc(-c2ccco2)[nH]n1	765751067	IQTOLGAWOHGHMA-UHFFFAOYSA-N	442.907	1.902	50	20	IDGD	
CCN(C)[C@@H](C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1)c1ccccc1	766643649	REPGGJCINYOLEO-JOCHJYFZSA-N	437.544	1.285	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3sccc3CN(C)C)CC2)cc1	766651055	YWLRWGFJWFWNMO-UHFFFAOYSA-N	429.590	1.697	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NN=C(CNS(C)(=O)=O)c2ccccc2)n[nH]1	766713004	OOFZWCZXKNVQPV-UHFFFAOYSA-N	427.486	1.769	50	20	IDGD	
O=C(COc1ccccc1Cc1ccccc1)NNC(=O)NC[C@@H]1CCCS1(=O)=O	767172918	LRMZPWPPDYROEF-SFHVURJKSA-N	431.514	1.564	50	20	IDGD	
CC(C)(C)c1nnc2ccc(C(=O)N3CCN(S(=O)(=O)CBr)CC3)cn12	769619120	FDXRJPYUFKPOGY-UHFFFAOYSA-N	444.355	1.467	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)c2cccc(Br)c2)cn1	769964277	YUBGXGYAWHVBMZ-UHFFFAOYSA-N	427.280	1.169	50	20	IDGD	
Cc1nc(CN2CCC(CNC(=O)NNc3nc(O)c4cnn(C)c4n3)CC2)oc1C	770393975	DJICGKKFRNSSKH-UHFFFAOYSA-N	429.485	1.212	50	20	IDGD	
CCOc1c(Br)cc(C(=O)NNc2nc(O)c3cnn(C)c3n2)cc1OC	770972167	FOGCELGDACNWSR-UHFFFAOYSA-N	437.254	1.996	50	20	IDGD	
CC(C)(C)OC(=O)N1CSC[C@H]1C(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772896939	DIFTZRQRPATGTJ-ZDUSSCGKSA-N	442.925	1.414	50	20	IDGD	
Cc1ccc2c(c1)C(=O)N([C@@H](C)C(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1)C2=O	772899220	ZMUYRBLVEZLBAA-LBPRGKRZSA-N	442.859	1.097	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)CCn1c(=O)nc(O)c2ccccc21	772990249	MMLIJSAXSUWISC-GFCCVEGCSA-N	430.848	1.761	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)ccc1O)C(=O)Nc1ccc(C(F)(F)F)cn1	773545269	DUJWQGODJNBELY-UHFFFAOYSA-N	447.167	1.968	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NNC(=O)CNC(=O)c2cccc([N+](=O)[O-])c2)C1	774269606	FVRMJPRTEBAUJJ-CQSZACIVSA-N	449.464	1.119	50	20	IDGD	
NC(=O)NC(=O)CCNC(=O)C(=O)Nc1ccccc1S[C@@H](Cl)C(F)(F)F	774489739	QNSQWKHSIOZMRV-GFCCVEGCSA-N	426.804	1.546	50	20	IDGD	
CCO[C@@H]1C[C@H](NC(=O)NNC(=O)[C@@H](C)Oc2cccc(Br)c2)[C@H]1OC	776473682	OPQYFTAZSBKOOO-AQNFWKISSA-N	430.299	1.739	50	20	IDGD	
N#C/C(=C/c1ccc(O)cc1)C(=O)N1CCN(S(=O)(=O)c2ccccc2[N+](=O)[O-])CC1	776598547	SBOSCNVTGIPWQY-SSZFMOIBSA-N	442.453	1.740	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NC[C@@H]2COC3(CCOCC3)O2)cc1Br	776914374	WTTJAWSRLWROAW-GFCCVEGCSA-N	444.282	1.324	50	20	IDGD	
O=C(c1cccc(OC[C@@H]2CCCO2)c1)N1CCN(S(=O)(=O)CBr)CC1	777778121	XNHQKUBLIRJHDX-INIZCTEOSA-N	447.351	1.684	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)CO[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)nc1C	778422507	PTQPQWZNHHRCGG-CQSZACIVSA-N	437.497	1.821	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)c1ccccc1)C(=O)NNc1cc(Cl)nc(N)n1	779374941	JJKKJTUFGZBNKB-LLVKDONJSA-N	430.943	1.256	50	20	IDGD	
COc1ccc(NNC(=O)[C@@H](NS(=O)(=O)c2ccc(C)cc2)[C@H](C)O)c([N+](=O)[O-])c1	779535622	KAKRWUGQMPNILG-SJCJKPOMSA-N	438.462	1.083	50	20	IDGD	
O=S(=O)(CBr)N1CCN(S(=O)(=O)c2cccc(C(F)F)c2)CC1	780838293	CYYCGNQOFXCIBU-UHFFFAOYSA-N	433.296	1.613	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1cn(C)nc1-c1cnn(C)c1	781305201	XMHHAMMRNWJDBC-UHFFFAOYSA-N	446.851	1.101	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)c1cc(S(=O)(=O)CC)ccc1Br	781689153	MIMUKLCCGRMAOA-UHFFFAOYSA-N	448.339	1.309	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(Br)s1)NNc1ncncc1Cl	781829526	KFOQGVQVSSOWCB-UHFFFAOYSA-N	426.705	1.376	50	20	IDGD	
COC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(NC(=O)NN=c3cc[nH]cc3)cc2)C1	782015861	PWQDEGDIBHBHRL-CQSZACIVSA-N	433.490	1.226	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN[C@H](CCO)c2ccccc2Br)n1	782104295	ZUEJDAMCXGHJJT-CQSZACIVSA-N	441.351	1.617	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)c1cccc(NS(=O)(=O)C(F)(F)F)c1	782538479	XOTDSTRCMBPGJY-UHFFFAOYSA-N	431.348	1.752	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)CSc1nnc2ccccn12	782549567	RWCIIBSZXWXBPF-UHFFFAOYSA-N	439.545	1.181	50	20	IDGD	
O=C(NN=c1cc[nH]cc1)C(=O)Nc1ccc(CN2CCN(Cc3ccccc3)CC2)cc1	783379030	QOVVMHVWFYPVCI-UHFFFAOYSA-N	444.539	1.903	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNc2ccc(-n3cccn3)nn2)ccc1Br	783433656	XCXNINCPNREPCQ-UHFFFAOYSA-N	432.238	1.515	50	20	IDGD	
COC(=O)[C@H](Cc1ccc(Cl)cc1)NNC(=O)Cc1csc(N2CCOCC2)n1	783575281	XCQYMXASBCMDOY-INIZCTEOSA-N	438.937	1.581	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)N[C@@H]2COc3cc(F)cc(F)c32)cc1	784575550	VARHSMFXSSYVJJ-CYBMUJFWSA-N	426.401	1.838	50	20	IDGD	
CC(=O)N1CCN(Cc2ccccc2NC(=O)C(=O)NNc2ccc(Cl)nc2)CC1	784869823	NPGUDTXPQTTWRL-UHFFFAOYSA-N	430.896	1.481	50	20	IDGD	
COC(=O)CCNC(=O)c1ccc(NC(=O)C(=O)NNc2cc(F)c(F)cc2F)cc1	784893262	PTHCQOQHIAAICK-UHFFFAOYSA-N	438.362	1.479	50	20	IDGD	
CCCNC(=O)[C@H]1CN(C(=O)C(=O)NNc2cc(F)c(F)c(F)c2)c2ccccc2O1	785083243	JDIJJAQUGRDFJT-MRXNPFEDSA-N	436.390	1.867	50	20	IDGD	
CS(=O)(=O)CCn1ccc(NC(=O)C(=O)NNc2cc(C(F)(F)F)ccc2F)n1	785166787	KXMSTKCCXKJABD-UHFFFAOYSA-N	437.375	1.167	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)cc1O	785614569	ULUIUNUULFBFMK-UHFFFAOYSA-N	427.892	1.496	50	20	IDGD	
Cc1ccc(N2CCNC2=O)cc1NC(=O)C(=O)NNC(=O)CCCc1cccs1	787549307	KMLLNOALATWDOR-UHFFFAOYSA-N	429.502	1.695	50	20	IDGD	
COc1ccc(OC)c([C@H]2C[C@@H]2C(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)c1	788102113	UTAMFZFOXDQUDV-WBVHZDCISA-N	431.876	1.925	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)cn1	788918701	ZIEKTGGLHAMNLW-UHFFFAOYSA-N	443.526	1.278	50	20	IDGD	
CC(=O)Nc1cc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)ccc1Cl	789811877	GJSBJIQAYNMQRX-YJBOKZPZSA-N	444.875	1.957	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cc([C@H]3CCCOC3)nn2C)cc1C	790951202	FAGTXUCHFKZLJG-HNNXBMFYSA-N	429.477	1.096	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)cccc1NC(=O)N(C)C	792352152	CNUZGBQZJJODIS-UHFFFAOYSA-N	447.879	1.907	50	20	IDGD	
CO[C@H]1CCC[C@H](CC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)C1	792773423	RHFRCRXJYHBOIL-RDJZCZTQSA-N	439.534	1.064	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NN=C2CCCc3c2cnn3-c2ncccn2)c1	792899385	HZINAOZPAIVPIM-UHFFFAOYSA-N	439.501	1.383	50	20	IDGD	
Cc1ccc([C@]2(C)NC(=O)N(CC(=O)NNC(=O)CNc3ccc(C)cc3C)C2=O)cc1	793136263	UZDUGPIRUCLSLE-QHCPKHFHSA-N	437.500	1.638	50	20	IDGD	
C=C(CBr)COC(=O)CNS(=O)(=O)c1ccc(N2CCCC2=O)cc1	795365455	CKYDIGHXSXZLTA-UHFFFAOYSA-N	431.308	1.586	50	20	IDGD	
CNC(=O)COc1ccc(NC(=O)NNC(=O)CNC(=O)OCc2ccccc2)c(C)c1	797680169	CSZVEHSUIQNXEZ-UHFFFAOYSA-N	443.460	1.199	50	20	IDGD	
C[C@H](C(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1)n1cnc(C#N)n1	798842370	AQSGUQXTRDIXCA-LLVKDONJSA-N	445.486	1.034	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2cc(-c3ccnn3C)ccc2C)c1	799257356	JRWDKQOJWMQZJE-UHFFFAOYSA-N	437.456	1.812	50	20	IDGD	
CSC[C@H](C)C(=O)N1CCC(C(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)CC1	799407093	LEJJKIZZUHEBCT-HNNXBMFYSA-N	434.562	1.627	50	20	IDGD	
C[C@H](CCNS(=O)(=O)c1ccccc1)NC(=O)NNC(=O)c1c[nH]c2ccccc12	801797595	KNXBSTGYAQCVQJ-CQSZACIVSA-N	429.502	1.869	50	20	IDGD	
COCCn1nc(C(=O)NNC(=O)Nc2cc(Cl)c(OC)cc2OC)ccc1=O	802076418	IYBYYBAAXKSPNN-UHFFFAOYSA-N	425.829	1.027	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)c2cc(S(N)(=O)=O)c(C)o2)c(OC)cc1Cl	802077779	CTLPQUKGBROFDU-UHFFFAOYSA-N	432.842	1.373	50	20	IDGD	
COc1ccc(C2=NO[C@H](CNC(=O)NNC(=O)COc3ccccc3F)C2)cc1F	802346236	CJUSIUXRZGATKT-ZDUSSCGKSA-N	434.399	1.876	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)N2CCC[C@@H]2C[C@@]2(C)NC(=O)NC2=O)c1C	804555475	PNIVZBWIGBWVEM-ZJJRPUNMSA-N	427.505	1.638	50	20	IDGD	
CCCN(NC(=O)c1ccc(S(=O)(=O)CC(=O)N(C)C)cc1)C(=O)OC(C)(C)C	804592566	CKSWPWAZQMYACD-UHFFFAOYSA-N	427.523	1.840	50	20	IDGD	
CC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)ccc1F	806975663	JXQHEJNOOKKLLC-UHFFFAOYSA-N	425.376	1.319	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)c(F)cc1Br	806977358	FRJVNLGBLCQBCV-OAHLLOKOSA-N	436.237	1.986	50	20	IDGD	
Cn1ncc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)c1-c1ccccc1	806980265	NEMQFZCDHZSDNF-UHFFFAOYSA-N	425.470	1.671	50	20	IDGD	
CSSCCNC(=O)N1CCN(S(=O)(=O)c2ccc3c(c2)CC(=O)N3)CC1	807229425	XHHXZQNKECTJSQ-UHFFFAOYSA-N	430.577	1.208	50	20	IDGD	
O=C(NCc1ccncc1OC[C@H]1CCOC1)NNC(=O)c1ccc2c(c1)OCCO2	807616798	XKERBHLRHOINGI-AWEZNQCLSA-N	428.445	1.412	50	20	IDGD	
CNC(=O)c1cc(O[C@H]2CCCN(C(=O)/C(C#N)=C\c3cc(C#N)n(C)c3C)C2)ccn1	808234739	OLARKBMHSIBXDZ-MESSXYGASA-N	432.484	1.937	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccccc2O[C@@H]2CCOC2)cc1	813033833	NKHTVPXXBDIPRD-OAHLLOKOSA-N	448.501	1.186	50	20	IDGD	
O=C(CN1CCCCCC1)Nc1cccc(NC(=O)C(=O)NNc2ncncc2F)c1	815765854	GAPPKWHPPBREDD-UHFFFAOYSA-N	429.456	1.512	50	20	IDGD	
CS(=O)(=O)N1CCCC[C@@H]1C(=O)NNC(=O)c1ccccc1OCc1ccc(F)cc1	887594973	GXGKPSQGRMGEBU-GOSISDBHSA-N	449.504	1.980	50	20	IDGD	
C[C@@H]1CC(C)(C)C[C@]2(C1)NC(=O)N(CC(=O)NNC(=O)COc1ccc(F)cc1)C2=O	910813572	VYWGCFVUGPARIK-ASSNKEHSSA-N	434.468	1.489	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)[C@@H](C)NS(=O)(=O)c2cccc(C(F)(F)F)c2)n1	913025797	UVYGZRWOYOGQFK-GFCCVEGCSA-N	447.439	1.033	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccccc1F)NNC(=O)CSc1ccc(Cl)cc1	913496591	YHRANLOISAHJDA-UHFFFAOYSA-N	431.898	1.697	50	20	IDGD	
COc1ccnc(NNC(=O)[C@@H]2CCCCN2S(=O)(=O)c2ccc(C(C)=O)cc2)n1	914762491	HKGNLHIARDCPHI-INIZCTEOSA-N	433.490	1.374	50	20	IDGD	
O=C(CNS(=O)(=O)c1cccs1)NNC(=O)COc1ccc(Br)cc1	915188550	WOGYKUQLOMSMET-UHFFFAOYSA-N	448.320	1.015	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCCN1S(=O)(=O)c1cccs1)c1ccc2c(c1)OCO2	915685158	YMFDTTRHVLQKOR-CYBMUJFWSA-N	437.499	1.481	50	20	IDGD	
CC(=NNC(=O)COc1cccc(C)c1)c1ccc(S(=O)(=O)N2CCOCC2)cc1	915931850	NNNVEVVLRGLBRO-UHFFFAOYSA-N	431.514	1.935	50	20	IDGD	
CNS(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2cc3c(s2)CC[C@@H](C)C3)s1	916231978	BLZIEHMKSIELST-SNVBAGLBSA-N	442.588	1.987	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)NCc1ccc(C(=O)N2CCOCC2)cc1	916247867	NFFMSPPQEOWJHJ-UHFFFAOYSA-N	440.500	1.631	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)NCC[C@@](O)(c2nccn2C)C(F)(F)F)c1	916378282	LMWWPVWTLYGSJA-GOSISDBHSA-N	443.426	1.586	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)NCCN1CCN(c2ccc(F)cc2)CC1	916513562	CTSATGTUMUKSBA-UHFFFAOYSA-N	445.495	1.366	50	20	IDGD	
O=C(COc1ccc(OCc2ccccc2)cc1)NNC(=O)Cn1ccc([N+](=O)[O-])n1	916719516	DDHHBLGBHCNSPA-UHFFFAOYSA-N	425.401	1.597	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)Cn1cnc2ccc(Br)cc2c1=O	919822897	RFHWEWSDBPKXDK-UHFFFAOYSA-N	445.273	1.558	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)Nc2ccc(CN3C(=O)CNC3=O)cc2)c1	920930608	QKGJSRFJFGIBCN-UHFFFAOYSA-N	425.445	1.587	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNC(=O)COc1ccc(Br)cc1	921301581	DKPVHJTWBNJLEV-UHFFFAOYSA-N	436.262	1.902	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)[C@@H]2CSCN2C(=O)C(C)(C)C)CC1	1116083754	LCOVVSYZNRYXKO-AWEZNQCLSA-N	442.582	1.729	50	20	IDGD	
CCOC(=O)c1ccn(-c2cccc(NC(=O)NNC(=O)Cn3nc(C)cc3C)c2)n1	1116563932	WRWHGBHIOMCQME-UHFFFAOYSA-N	425.449	1.715	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCc2nc([C@@H]3CCS(=O)(=O)C3)no2)N(C)c2ccccc21	1116606975	XTRLNYUCBLVREF-CYBMUJFWSA-N	427.486	1.795	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)NCCCN2C(=O)NC(C)(C)C2=O)c(C)n1-c1ccccc1	1263758064	NSCKEDZVIYIDPB-UHFFFAOYSA-N	440.504	1.759	50	20	IDGD	
Cc1c([C@H](C)NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)cnn1C	1323297872	RGJWSPZTQVXUFU-AWEZNQCLSA-N	448.549	1.608	50	20	IDGD	
O=C(CNc1ccccc1)NNC(=O)c1cccc(NN2C(=O)[C@H]3CC=CC[C@@H]3C2=O)c1	1344716700	CBYPNDHYKCIQNG-OALUTQOASA-N	433.468	1.838	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnn4ccncc34)C2)C1	1777976573	DCPWMOJMLPUYIF-SCLBCKFNSA-N	436.310	1.204	50	20	IDGD	
O=C(NCCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Cl)C1)c1ccccc1	1778027608	MZFVYCUKJPTLCR-PLMTUMEDSA-N	439.915	1.855	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Cl)C1	1778030487	UGTHDMYZFRYUHF-CAFLLTJSSA-N	430.904	1.790	50	20	IDGD	
Cc1nc2sccn2c1C(=O)N1CC[C@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1778719912	COVYUJOFHUJAKT-IBGZPJMESA-N	436.610	1.999	50	20	IDGD	
O=C(c1cc2cn[nH]c2cn1)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1778781208	QNTANJXIZVXFSS-CJNGLKHVSA-N	426.246	1.092	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2n[nH]cc2[N+](=O)[O-])C1	1779605769	DEJRPKHDDWXZGO-KANYHAFZSA-N	444.286	1.229	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(CN(C(=O)c3ccco3)CCO2)C1	1780095739	VOVGTNUBDVCTTP-NRFANRHFSA-N	443.412	1.870	50	20	IDGD	
C[C@@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@](C)(Cl)CCl)C1)n1ccnn1	1780716456	IQNUCPUXUCDWGX-MJSCVDMRSA-N	432.352	1.589	50	20	IDGD	
COCc1oncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Br)C1	1780773266	KZPLEMXWIRIYGK-JKIFEVAISA-N	448.289	1.639	50	20	IDGD	
O=C([C@H](F)Br)N1CC[C@]2(C1)CN(C(=O)C(F)(F)c1ccco1)CCO2	1781334659	QIXXSSRTQZCARP-FZMZJTMJSA-N	425.201	1.892	50	20	IDGD	
C#CCO[C@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](Br)CC)C1	1781897101	AMKFGYRTXPNWSN-YKTARERQSA-N	429.355	1.712	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3c(F)ccc(O)c3F)C2)C1	1781932517	FKZPRMFLQQLNRE-BTDLBPIBSA-N	433.249	1.897	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@]2(C1)CN(C(=O)c1ncccn1)CCO2	1782863457	BLWJWJRFDFHKHN-VROYLXGSSA-N	439.422	1.805	50	20	IDGD	
O=C([C@@H](O)CCl)N1CCO[C@]2(CCN(C(=O)C3(c4ccc(Cl)cc4)CC3)C2)C1	1782964667	MQYDBCIVDLRLPS-QFBILLFUSA-N	427.328	1.801	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H]3C[C@@]34C(=O)Nc3ccccc34)C2)C1	1783496621	XNYYESGUNWTTNM-ZXJYCPGTSA-N	431.920	1.744	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)Cn3nnc4ccccc43)CCO2)C1	1783529749	MHPIKERXRAUKTF-SCLBCKFNSA-N	436.310	1.045	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cc(O)c(O)c(Cl)c3)CCO2)C1	1783536556	KDSHPNXHKDNOFN-BMLIUANNSA-N	447.713	1.978	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3CCN3C(=O)OC(C)(C)C)[C@H]2C1	1784822604	PWPKKARIXSROJS-VIQHNZTISA-N	443.972	1.993	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3CCN3C(=O)OC(C)(C)C)[C@H]2C1	1784822606	PWPKKARIXSROJS-WOYTXXSLSA-N	443.972	1.993	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)c1csc2c1CCCO2	1787255859	VRZALCDANKCORD-MZGVZZPPSA-N	428.938	1.266	50	20	IDGD	
O=C(NCCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]2C1)c1ccccc1	1787451286	GDKHSVQHXNSFDW-NBOOPKSLSA-N	425.888	1.321	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cn4cc(F)ccc4n3)C[C@@H]21	1791253544	DQDUKOXBBKXJPL-FAYQHZLMSA-N	438.887	1.321	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(C(F)(F)F)ccn3)C[C@@H]21	1791255238	HUAWKRLRMICDLN-PCBIJLKTSA-N	449.857	1.948	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nc(O)n4c3CCCC4)C[C@@H]21)C(Cl)Cl	1791298445	XSSNKRYKBCYRAF-GVXVVHGQSA-N	431.320	1.322	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2)[C@H]1CCc2ccccc2[C@@H]1O	1793036561	KHBAFIYRGKOCFI-KUHBDSFDSA-N	427.328	1.676	50	20	IDGD	
Cc1nn2cc(CC(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)C(C)(C)CCl)C4)nc2s1	1793660593	XVVVJJFNUXVTQP-YWVIFJGQSA-N	439.969	1.496	50	20	IDGD	
COc1ccc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Br)C3)cn1	1793894123	YYVSAEFEGRTNQK-DLTLXFJOSA-N	444.301	1.303	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN1CCCC1)C2	1794141671	YVOIZYUFRSOALT-YVSFHVDLSA-N	442.988	1.853	50	20	IDGD	
Cc1c(F)ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)Br)C3)c1N	1795701649	AENMFXGUMQGCHD-OVZMXSCWSA-N	428.302	1.703	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccnc(OC)c1F	1795911353	LNMYKGZEZPKXSL-NDPMZMCLSA-N	444.301	1.606	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H]1CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Cl	1796365487	XRSHWXZDEKUKSO-QZCUMHFISA-N	447.935	1.900	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cn1nc(C)cc1C)C2	1796890990	SUVMEXZBFBGPKQ-DPEPCVEMSA-N	439.520	1.272	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](C)N1C[C@@H]3C[C@H]3C1)C2	1796892053	XMLFBKLOJDHTSF-AZZJIIRNSA-N	440.548	1.099	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)c1cc(Cl)nc2ccccc12	1796940908	OJQZINILSHGKIL-GWLLULGVSA-N	438.311	1.691	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc2nc(CO)[nH]c2c1)[C@H](F)Br	1797389464	OODRSEIFXSPIPJ-BUWBCJGYSA-N	439.285	1.998	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@]1(C)C[C@H]1C)C2	1798524559	GFWGCWCUJUHOGJ-QCRSQXJJSA-N	445.472	1.769	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cn3ccsc3n1)C2	1800641766	KAIMNLLPYFDMJC-OPDFLTKYSA-N	441.351	1.773	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C13CC(C(=O)OC)(C1)C3)C2	1800643962	ABKGHMQXVPXMSJ-MHCPSFEUSA-N	443.338	1.093	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)C1CC(F)(F)C1	1802633189	SFAVXNQQULYVGY-VQIMIIECSA-N	443.259	1.126	50	20	IDGD	
O=C(CCC(F)(F)F)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1806826177	SZHPOGUFSZPLHT-APWZRJJASA-N	449.238	1.424	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)cc1	1807374957	LPLZKUMXMBPXNT-GMAHTHKFSA-N	443.312	1.703	50	20	IDGD	
Cc1ccccc1C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1807376506	VZDHWJLZKAZZEQ-NZQKXSOJSA-N	443.312	1.703	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CN2CCCC2=O)[C@@H]1c1cccnc1)[C@H](F)Br	1808661983	UDEHRBRTCCWYLD-XKQJLSEDSA-N	441.301	1.400	50	20	IDGD	
Cc1cnn(CC(=O)N2CC[C@H](CNC(=O)[C@@H](F)Br)[C@@H]2c2cccnc2)c1	1808662883	SKRWQWQPCVKGPO-HYVNUMGLSA-N	438.301	1.983	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)c1cc2cnccc2[nH]1	1809987764	JCHWWNXFUTVQQZ-ZOCIIQOWSA-N	427.892	1.877	50	20	IDGD	
COC(=O)CCC(=O)N1CC[C@H](CNC(=O)[C@H](C)Br)[C@H]1c1cccnc1	1812864069	KCSGQAHIFLUNJN-DXCKQFNASA-N	426.311	1.824	50	20	IDGD	
CNc1nsnc1C(=O)N1CC[C@H](CNC(=O)[C@H](Cl)COC)[C@@H]1c1cccnc1	1813028866	WFZKEYQOMKKQSQ-NFAWXSAZSA-N	438.941	1.548	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2ccncc2F)[C@@H]1c1cccnc1	1813069833	DCYPFZIZWCUWNP-IIBYNOLFSA-N	442.495	1.308	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)[C@H](O)CCSC)[C@@H]1c1cccnc1	1813094659	BZMMZTBSJOOFGY-TWMKSMIVSA-N	429.970	1.455	50	20	IDGD	
Cc1ccnc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)c1	1815341072	SXDKGDQXGPFFQP-OAHLLOKOSA-N	436.302	1.066	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)Cc2ccccc2)n[nH]1	1816891764	VHAVINZMMCJLFW-IBGZPJMESA-N	447.499	1.957	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](C)Br)[nH]n1	1819355685	WCSDFHNJNUSIBV-LOWVWBTDSA-N	443.346	1.893	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc(C#N)cc2)n[nH]1	1820551152	GDZRMRYRXBPHBB-SFHVURJKSA-N	437.504	1.960	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](C)Br)n[nH]1	1822189032	NAOANJWWIHQRND-DMDPSCGWSA-N	443.346	1.893	50	20	IDGD	
Cc1ncc(CC(=O)Nc2cc([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)s1	1822741711	VBARKNHIJLVGCP-MRXNPFEDSA-N	447.565	1.782	50	20	IDGD	
O=C(c1c(O)cc(O)cc1O)N1CCC([C@H]2CCCCN2C(=O)[C@H](O)CCl)CC1	1824188065	MTRVJICJELGHAX-RHSMWYFYSA-N	426.897	1.636	50	20	IDGD	
Cn1cc(CC(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@H](F)Br)CC3)cn1	1826943318	FWHHSYIPSLJMOL-RNCFNFMXSA-N	430.303	1.722	50	20	IDGD	
N#Cc1ccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)cc1	1829907253	CZHZDJVGHZLTHV-IBGZPJMESA-N	426.300	1.361	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)CSc3ncccn3)C2)C1	1830358504	WSFNNZPZHCXQDP-IBGZPJMESA-N	442.969	1.290	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc(OCF)cn3)C2)C1	1831643997	MPAPEUHTIVJRCT-KUHUBIRLSA-N	444.891	1.260	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3nnc(C)s3)C2)C1	1831645582	DTURCQVPGBUYBC-KSSFIOAISA-N	430.958	1.253	50	20	IDGD	
Cc1cnn(CC(=O)N2CCC([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)c1	1831870745	DLGXBPNBBAFVNN-LJQANCHMSA-N	432.569	1.184	50	20	IDGD	
CC(=O)N[C@H](C)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](C)CBr)CC2)CC1	1833265002	UWNXXUJEGXPEOG-UONOGXRCSA-N	445.402	1.114	50	20	IDGD	
Cn1ncc2cc(C(=O)N3CCC(N4CCC(NC(=O)[C@H](O)CCl)CC4)CC3)ccc21	1833310326	QEMJNLYNFBHZRW-HXUWFJFHSA-N	447.967	1.358	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H]3CCc4ccccc43)CC2)CC1)[C@H](O)CCl	1833313119	WROIXTMTMDYJRK-NHCUHLMSSA-N	433.980	1.888	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)C(C)(C)C)CC2)CC1	1835118388	XAXWLTNLQNEWCC-WGOQTCKBSA-N	444.580	1.738	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3nnc(C)s3)CCO2)C1	1836076636	MJQBTYLQABMUIN-RDTXWAMCSA-N	430.958	1.253	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3ccn(C(C)C)n3)CC2)CC1	1836185507	DAEJYPNQSFBYOW-SFHVURJKSA-N	439.988	1.903	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccnc(OC)c3F)CCO2)C1	1836233948	GUXVPYBPNHTACT-QRWLVFNGSA-N	443.903	1.707	50	20	IDGD	
CCc1ccnc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)c1	1836360460	YKCRRJANEBQGIN-MAUKXSAKSA-N	444.301	1.405	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3n[nH]c4ccccc34)CCO2)C1	1836936692	QBZDNEGREIZWSV-NRFANRHFSA-N	434.924	1.898	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)CSC3CCCC3)C2)C1	1837710053	GCSBVZQJPDXTES-FQEVSTJZSA-N	444.670	1.970	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3Cc4ccccc4O3)C2)C1	1837713341	XZMAYZNJAKMHKG-KNQAVFIVSA-N	448.592	1.298	50	20	IDGD	
CCc1noc(C)c1C(=O)N1CCO[C@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1	1838059610	MIXPUSHTSRGDRC-FQEVSTJZSA-N	439.585	1.467	50	20	IDGD	
COCCn1ccc(C(=O)N2CCC(OC3CCN(C(=O)[C@H](F)Cl)CC3)CC2)n1	1838083210	CNIMZGQAPZXCJD-KRWDZBQOSA-N	430.908	1.676	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(-n4cccn4)nc3)CCO2)C1	1838120247	QJVHDUCPFOMHAH-DYESRHJHSA-N	447.923	1.355	50	20	IDGD	
Cc1nnsc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2	1839152540	CLSVCQISGIZPKV-HZPDHXFCSA-N	437.349	1.153	50	20	IDGD	
Cc1nc(C)c(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)o1	1839200573	MMLVYZPSFXPYMJ-CZUORRHYSA-N	434.262	1.052	50	20	IDGD	
CC(C)=NO[C@@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)CCBr)C2)C1	1839224401	RBHWNEITQLSOLV-YOEHRIQHSA-N	434.331	1.029	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CCC=CO3)C2)C1	1839964984	KGLLOZHONLMQNX-RLFYNMQTSA-N	431.327	1.309	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3CCCSC3)C2)C1	1839967696	VACDJHICUOUTIU-MPGHIAIKSA-N	449.411	1.760	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3cccs3)C2)C1	1840030906	AJOIRGYKEAUNQU-KDOFPFPSSA-N	445.379	1.921	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(C#N)cc3)C2)C1	1840034398	JSOHAEUOJFOEBS-LIRRHRJNSA-N	436.306	1.412	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(C(C)C)no3)C2)C1	1840154113	LWJRJCFQUBDYDM-AUUYWEPGSA-N	429.901	1.122	50	20	IDGD	
COc1c(Cl)cccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1	1840738320	CNXKGBIPCMRLQO-KXBFYZLASA-N	447.315	1.018	50	20	IDGD	
Cc1cc(Cl)ccc1C(=O)N1CCCC12CN(C(=O)c1cnccc1C(=O)NN)C2	1841153324	PFBFHIFDIZNORW-UHFFFAOYSA-N	427.892	1.778	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)COc2ccc(O)cc2)C1	1841221512	RPBNYNPQYMCTKL-BUVRLJJBSA-N	439.472	1.108	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1ccnc(C(F)(F)F)c1)C2	1844263742	OVQRSBBDOKMHKO-UHFFFAOYSA-N	448.405	1.230	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)CS[C@H]2CCCCO2)C1	1844290589	XVMBFEZUONVXFW-FSTGKYBXSA-N	447.561	1.584	50	20	IDGD	
Cn1ccc2c(O)ncc(C(=O)N3CCCC34CN(C(=O)[C@H](F)Br)C4)c21	1844637890	FLTKENOXUGIMLM-ZDUSSCGKSA-N	425.258	1.786	50	20	IDGD	
CCOc1ccc(Cl)cc1C(=O)N1CCCC12CN(C(=O)c1ccc(B(O)O)cc1)C2	1845394372	TXEHXBREXVMZNO-UHFFFAOYSA-N	442.708	1.549	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC[C@H]2[C@@H]1CCN2C(=O)c1c(Cl)cncc1Cl	1847202234	MWFSIAVITKQJIF-HOTGVXAUSA-N	434.088	1.197	50	20	IDGD	
CCC(=O)N[C@@H](C)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1847736588	NDVVHQBFRWHBGR-AJNGGQMLSA-N	444.960	1.235	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@]1(O)CCN(C(=O)OC(C)(C)C)C1	1847867884	LVBPZHZZGMNDNW-VCAMNPENSA-N	443.972	1.968	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)C1(c2ccc(F)cc2)CC1	1848048035	JAVWZKSHOHYUBR-OALUTQOASA-N	437.475	1.371	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)Cc1ncccn1	1848095899	XUIHUCHVNRGLSJ-KKUMJFAQSA-N	437.928	1.353	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H]1CCc2nc(O)nc(O)c2C1	1848212564	BUNOACJPFDQDRP-KCXAZCMYSA-N	434.569	1.046	50	20	IDGD	
O=C(CN1c2cccc3cccc(c23)S1(=O)=O)NNC(=O)[C@@H]1COc2ccccc2O1	15663385	FKXODVKPNLOUQT-KRWDZBQOSA-N	439.449	1.336	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)c2ccc(OC)cc2)cc1S(=O)(=O)N1CCOCC1	23110799	GPNNZKILUKSNGQ-UHFFFAOYSA-N	447.513	1.353	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)C[C@@H]2CCS(=O)(=O)C2)cc(OCC)c1OCC	24127256	SWULIUHWZSCIIY-ZDUSSCGKSA-N	428.507	1.469	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@@H]2CC(=O)N(c3ccc(C)c(F)c3)C2)cc(OC)c1OC	26356026	COEDOSIQQAIIIK-CQSZACIVSA-N	445.447	1.974	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CNc2ccc(C)cc2C)cc(OC)c1OCC(N)=O	105190326	AMIGMGQSJPYBMQ-UHFFFAOYSA-N	430.461	1.058	50	20	IDGD	
CC(C)CC(=O)N[C@H](C(=O)NNC(=O)c1csc(N2CCOCC2)n1)c1ccccc1	110577439	GEVQTVHSHOVBII-SFHVURJKSA-N	445.545	1.644	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1ccc(N2CCCC2)nc1	727211048	SWNKPEGQUQSBIQ-UHFFFAOYSA-N	432.864	1.962	50	20	IDGD	
Cc1c(/C=C(\C#N)C(=O)Nc2ccc(C(=O)NCCN3CCOCC3)cc2)cc(C#N)n1C	727806695	YMECCWMSVFDQFB-DEDYPNTBSA-N	446.511	1.813	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NNC(=O)c2c(Cl)cccc2Cl)c1	727847001	NZZSBOPMWCBPNQ-UHFFFAOYSA-N	445.284	1.686	50	20	IDGD	
O=C(CN1C(=O)CCOc2ccccc21)NNc1ccc(S(=O)(=O)NC2CC2)cc1	728210358	LSBCHJLKRXPTBM-UHFFFAOYSA-N	430.486	1.386	50	20	IDGD	
CCOC(=O)c1cc(S(=O)(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)ccc1F	728504821	PBTPGXRTTLSXFS-UHFFFAOYSA-N	444.462	1.029	50	20	IDGD	
O=C(COC(=O)c1cnc(-c2ccco2)s1)NNC(=O)[C@@H]1COc2ccccc2O1	729025288	VEWWRQSKKNYLJJ-AWEZNQCLSA-N	429.410	1.547	50	20	IDGD	
CC(=O)N1CCC(CNC(=O)NNC(=O)[C@@H](C)Oc2cccc(Br)c2)CC1	729495151	QSNLTQSIRLRBHP-GFCCVEGCSA-N	441.326	1.805	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NC[C@H]2CN3CCC[C@H]3CO2)ccc1OCCC(C)C	729619390	PPMKKGPNZLLPJX-ROUUACIJSA-N	434.537	1.927	50	20	IDGD	
C=CCNS(=O)(=O)c1cc(C(=O)NNC(=O)c2cccc3ncccc23)ccc1F	730228798	XPOVLBSSKJCHSF-UHFFFAOYSA-N	428.445	1.913	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)CS(=O)(=O)c1cccc(Br)c1	730782099	GLQDJJPIPJEITB-UHFFFAOYSA-N	443.275	1.155	50	20	IDGD	
CCN1CCN(Cc2ccc(CNC(=O)NNC(=O)c3ccccc3OC)cc2)CC1	731498314	LXUCUKFPNNZYEA-UHFFFAOYSA-N	425.533	1.977	50	20	IDGD	
COC(=O)c1c(S(=O)(=O)NNC(=O)[C@H](C)Oc2ccc3ccccc3c2)n[nH]c1C	732046079	QZSQSAZNVSJQLA-LBPRGKRZSA-N	432.458	1.435	50	20	IDGD	
O=C(COC(=O)C1(c2ccccc2)CCOCC1)NNC(=O)c1cccc([N+](=O)[O-])c1	732325383	NYHOQZYOYJNQLZ-UHFFFAOYSA-N	427.413	1.647	50	20	IDGD	
CC(C)(C)C(=O)N1CCC[C@H](C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)C1	732333493	XKARTXXIWPYIJY-AWEZNQCLSA-N	434.449	1.184	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)NCCNS(=O)(=O)c1cccc([N+](=O)[O-])c1)c1ccccc1	732455475	MZHRXWHQPOSHNZ-KRWDZBQOSA-N	449.489	1.397	50	20	IDGD	
COC(=O)CCOc1ccc(S(=O)(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1	733123157	VOQJOUDHEJLKFH-UHFFFAOYSA-N	444.469	1.438	50	20	IDGD	
COCCOCC(=O)NNC(=O)c1ccc(CN(C)S(=O)(=O)c2ccc(C)cc2)cc1	733123838	HOGZYYRLKJQJEV-UHFFFAOYSA-N	449.529	1.240	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NCc2ccnc(OC3CCOCC3)c2)cc1	733654414	QPRUGNYUQOGLHP-UHFFFAOYSA-N	430.461	1.557	50	20	IDGD	
O=C(NNc1cnccn1)C1CCN(S(=O)(=O)c2cccc(OC(F)(F)F)c2)CC1	734244280	CCAYRUFYMGQVAE-UHFFFAOYSA-N	445.423	1.919	50	20	IDGD	
COc1ccc(CN2CC[C@@H](NC(=O)NNC(=O)COc3cc(C)cc(C)c3)C2=O)cc1	734685109	QSDPSROVUKPJCT-HXUWFJFHSA-N	440.500	1.822	50	20	IDGD	
COC(=O)CCn1c(S[C@H](C)C(=O)NNC(=O)CC(C)C)nc2ccccc2c1=O	734982847	NUDMZNIBLPITHF-CYBMUJFWSA-N	434.518	1.634	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)C[C@H](NC(N)=O)c2ccccc2)cc1C	736755949	YABBDUJUIAZERU-AWEZNQCLSA-N	432.502	1.723	50	20	IDGD	
CN1CCN(CCCNC(=O)NNC(=O)COCc2ccccc2)[C@H](c2ccccc2)C1	738456102	CVEQKZQLXNLZAZ-QFIPXVFZSA-N	439.560	1.912	50	20	IDGD	
O=C(NNc1ncccc1C(F)(F)F)c1cccc(S(=O)(=O)N2CCOCC2)c1	740093730	VNYPIVGDEGBCRE-UHFFFAOYSA-N	430.408	1.878	50	20	IDGD	
O=C(COC(=O)c1cccc(OCC(F)(F)F)n1)NNC(=O)c1ccc([N+](=O)[O-])cc1	740423661	WFKVKGAZDFHSFN-UHFFFAOYSA-N	442.306	1.549	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N[C@H]2CCC[C@H](S(C)(=O)=O)C2)cc1Br	740915709	QLHXOFNNKLEWGT-RYUDHWBXSA-N	448.339	1.758	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)N[C@@H]2CCC[C@H](S(C)(=O)=O)C2)c1	741094279	YKFJVMFXUJUNLV-PWSUYJOCSA-N	448.339	1.758	50	20	IDGD	
O=C(COC(=O)C[C@@H]1CN(Cc2ccccc2)CCO1)NNC(=O)c1cccc(Cl)c1	741355220	OVEJZZAQKBLQJZ-LJQANCHMSA-N	445.903	1.935	50	20	IDGD	
Cc1ccccc1C=NNC(=O)C[C@H](C(=O)NN=Cc1ccccc1C)N1CCOCC1	741767581	ZPGWQAUOMFZFOT-JOCHJYFZSA-N	435.528	1.995	50	20	IDGD	
C[C@@H](CC(=O)NNC(=O)CCCc1ccccc1)/N=C1/NS(=O)(=O)c2ccccc21	742627879	LHLINEJPNNEQSE-HNNXBMFYSA-N	428.514	1.674	50	20	IDGD	
CCOC(=O)C1CCN(C(=O)CN(C)C(=O)NNC(=O)c2cccc3ccccc23)CC1	743630103	MJSGSZXAPZQZQF-UHFFFAOYSA-N	440.500	1.928	50	20	IDGD	
O=C(CN1CCN(CCCOCC(F)(F)F)CC1)NNC(=O)c1ccccc1Cl	744200205	FUNUEJNHWFVWCV-UHFFFAOYSA-N	436.862	1.688	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CN2CCN(S(=O)(=O)c3ccc(C)c(C)c3)CC2)c1	744384671	OXKUQJSREMEIPL-UHFFFAOYSA-N	444.557	1.379	50	20	IDGD	
O=C(NNC(=O)c1cnnn1-c1ccccc1Cl)c1csc(N2CCOCC2)n1	745484766	FHEUTXSJDWYROH-UHFFFAOYSA-N	433.881	1.289	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)CN[C@@H](c2ccccc2)C(F)(F)F)c2ccccc2c1=O	746097129	VQYCKCSYZPHEJA-KRWDZBQOSA-N	433.390	1.588	50	20	IDGD	
C[C@H]1CC(C)(C)C[C@@]2(C1)NC(=O)N(CC(=O)NNC(=O)Cc1cn3ccccc3n1)C2=O	746554199	YEDPOXODTDILEM-RCDICMHDSA-N	440.504	1.161	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1)N[C@H]1CCCCNC1=O	747864913	BDDYTXACGFUGHU-LEWJYISDSA-N	435.528	1.613	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNC(=O)NCC2CCN(S(C)(=O)=O)CC2)cc1	749016833	DWTSNBPTUUKJKK-UHFFFAOYSA-N	440.566	1.727	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)N[C@@H]2CC(=O)N(C(C)(C)C)C2)c2ccccc2c1=O	750659708	LFUMTHFOHWPDCS-CQSZACIVSA-N	442.520	1.540	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNS(=O)(=O)c2cc(C(=O)OC)oc2C)cc1	754744730	LTUIEWNHLRAWHP-GFCCVEGCSA-N	426.447	1.550	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)Nc1ccc(CC(=O)N2CCOCC2)cc1	755862814	UPDVGDXEUKYLHB-UHFFFAOYSA-N	426.473	1.579	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)Nc2cccc(S(=O)(=O)/N=C3\CCCN3C)c2)c(O)c1	756028566	FRYHIHVYLSWGDV-HKOYGPOVSA-N	445.501	1.980	50	20	IDGD	
O=C(NCC1CCS(=O)(=O)CC1)NNC(=O)c1ccc(Br)cc1Cl	756064851	VKFOAPMRCZYIJG-UHFFFAOYSA-N	438.731	1.871	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Nc2ccc(CS(C)(=O)=O)cc2)cc(OC)c1OC	756269176	NRLRLYAXFPIQMS-UHFFFAOYSA-N	437.474	1.724	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1S(=O)(=O)NC1CC1	756683554	RQQKULCPHOKWOX-UHFFFAOYSA-N	449.445	1.511	50	20	IDGD	
CC[C@@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(CC)CC)c1)[C@@H]1CCCO1	756730522	UJUOTQYTAHCAJW-SJORKVTESA-N	426.539	1.619	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2cc3ccccc3o2)cc1	756786017	WNDCPMDSPCLHIR-UHFFFAOYSA-N	432.458	1.824	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)N[C@@H]1CCN(C(=O)CCc2ccccc2)C1	756931965	RQLVPBDXBJEOCG-MRXNPFEDSA-N	443.529	1.042	50	20	IDGD	
CCn1cc(C(=O)NNC(=O)CCN2C[C@@H](C)O[C@H](C)C2)c(=O)c2cc(Cl)ccc21	757715685	PQUWGIGNBJCGTD-ZIAGYGMSSA-N	434.924	1.935	50	20	IDGD	
O=C(c1cc2c(nc1O)CCCCC2)N1CCN(S(=O)(=O)CBr)CC1	758528882	YWNMZZBANQUTKK-UHFFFAOYSA-N	432.340	1.496	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)N[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1C#N	758751962	LPAUHXUQOXDKQO-YDHLFZDLSA-N	435.456	1.682	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)CNC(=O)c1ccccc1OC(F)F	761618920	KLODQSVCVXAMGH-UHFFFAOYSA-N	439.440	1.966	50	20	IDGD	
O=C(COc1cccc(NC(=O)c2ccco2)c1)NNc1nccc(N2CCOCC2)n1	762857087	RISWJIXHPPBXGV-UHFFFAOYSA-N	438.444	1.681	50	20	IDGD	
O=C(NNc1nccc(N2CCOCC2)n1)C1CCN(C(=O)COc2ccccc2)CC1	762857249	XRTPMRBJASYHPU-UHFFFAOYSA-N	440.504	1.074	50	20	IDGD	
CC(=NNC(=O)CNC(=O)c1cccnc1)c1ccc(OCC(=O)N2CCCCC2)cc1	763193125	NBUOIRQOZKIXMD-UHFFFAOYSA-N	437.500	1.743	50	20	IDGD	
O=C(NNC(=O)c1cnc2[nH]cnc2c1)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	763272417	KAHGXJKYORUWHZ-UHFFFAOYSA-N	439.439	1.735	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1cc([N+](=O)[O-])ccc1SC1CCCC1	763437002	DEMYRJWXJKKZHI-LLVKDONJSA-N	427.504	1.825	50	20	IDGD	
COCCOc1cc(NC(=O)C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)ccc1OC	763441715	IGUWLSUGPHEDRE-UHFFFAOYSA-N	432.389	1.028	50	20	IDGD	
C[C@H](c1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)cc1)N1CCOCC1	763552354	YRKMHDQHSGDEAN-CQSZACIVSA-N	440.456	1.208	50	20	IDGD	
NC(=O)c1cccc(NC(=O)C(=O)NNC(=O)COc2ccccc2-c2ccccc2)c1	763644712	XBPKRWMMSJVIRY-UHFFFAOYSA-N	432.436	1.617	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccc(F)c1C(=O)OC	763682136	ORZJTNWKSNLHFW-UHFFFAOYSA-N	433.392	1.176	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc2cnn(CC)c2c1	763685879	YSTKZXZFRXUVKZ-UHFFFAOYSA-N	425.445	1.620	50	20	IDGD	
O=C(NCc1ccc(N2CCCS2(=O)=O)cc1)NNC(=O)c1c[nH]c2ccccc12	763700439	KYGIGODFUNHZOM-UHFFFAOYSA-N	427.486	1.852	50	20	IDGD	
CCS(=O)(=O)c1cc(F)ccc1NC(=O)C(=O)NNC(=O)c1cccc(Cl)c1	763752013	AKCHDZNWNUSAMY-UHFFFAOYSA-N	427.841	1.672	50	20	IDGD	
CC(C)S(=O)(=O)c1ccccc1NC(=O)C(=O)NNC(=O)c1cccc(N(C)C)c1	763753633	IIBWWIXMJMKAHC-UHFFFAOYSA-N	432.502	1.334	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)C(=O)Nc2ccc(CC(F)(F)F)cc2)c2ccccc2c1=O	763785015	ARSCCPASOFLPJU-UHFFFAOYSA-N	447.373	1.438	50	20	IDGD	
CC[C@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)cc1	763839332	JRULGJHMXFNWGV-ZDUSSCGKSA-N	430.436	1.519	50	20	IDGD	
CC(C)CCn1nc(C(=O)NNC(=O)C(=O)Nc2cccc(C#N)c2)c2ccccc2c1=O	763844267	YINAKYRRIBZBHR-UHFFFAOYSA-N	446.467	1.714	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1cccnc1Br	763848656	FKSIXOHECAJYTC-SECBINFHSA-N	425.214	1.537	50	20	IDGD	
CC(C)n1ncc2cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc3ccccc3F)cnc21	763849329	IOJGKMWHKGJKQD-LBPRGKRZSA-N	428.424	1.705	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1cc(N2CCCC2=O)ccc1F	763851534	UEHKNAXDAXIIHQ-LBPRGKRZSA-N	446.410	1.645	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cccnc2OC(C)C)cc1	763859455	BLUQPXRLNNAKEW-CQSZACIVSA-N	430.461	1.821	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cccc(OCCF)c2)cc1	763873703	XVBQKBPCCVCXJI-AWEZNQCLSA-N	431.420	1.791	50	20	IDGD	
CCCCn1ccnc1-c1cccc(NC(=O)C(=O)NNC(=O)Cn2nc(C)cc2C)c1	763885393	KVTLQDMXGSSPGB-UHFFFAOYSA-N	437.504	1.950	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)C(=O)Nc1cccc(C(=O)N2CCCCC2)c1	763920965	OHHXWMCJQPNQOU-UHFFFAOYSA-N	426.448	1.780	50	20	IDGD	
O=C(Cc1cccc2ccccc12)NNC(=O)C(=O)Nc1ccc2c(c1)S(=O)(=O)CC2	764027330	GBPFHNJBMWNOMV-UHFFFAOYSA-N	437.477	1.498	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccccc2CC(=O)OC(C)(C)C)c(O)c1	764110191	HAHQYCQNVCCXSM-UHFFFAOYSA-N	427.457	1.985	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2cnn(CC(C)C)c2C(F)F)c1O	764132688	PLACTOGWDSIJBC-UHFFFAOYSA-N	425.392	1.591	50	20	IDGD	
CC(C)(C)OC(=O)N1CCc2ncc(NC(=O)C(=O)NNC(=O)c3ccoc3)cc2C1	764160090	NPKICFFMILRYJV-UHFFFAOYSA-N	429.433	1.368	50	20	IDGD	
Cn1cc(Br)cc(NC(=O)C(=O)NNC(=O)CCC2CCCCC2)c1=O	764217317	DIILQTUBYAVSMZ-UHFFFAOYSA-N	427.299	1.594	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)ccc1C(=O)NC(C)C	764242138	BDFCPVXIOCQKKE-UHFFFAOYSA-N	435.484	1.874	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cccc(OC(F)F)c2)c(F)c1	764260145	QHNDOXDLRFGUKX-UHFFFAOYSA-N	425.319	1.613	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)C(=O)Nc1ccccc1OCC(F)F	764260864	SEMWBXWZHLEZTC-UHFFFAOYSA-N	448.430	1.123	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)Cc2cc[nH]n2)sc2c1CCCCC2	764285671	JHXOGIXVBOXCMM-UHFFFAOYSA-N	433.490	1.245	50	20	IDGD	
CC(C)(C)OC(=O)N1CCc2ccc(NC(=O)C(=O)NNC(=O)Cc3cc[nH]n3)cc2C1	764296599	BIWZCBYBSXHVDW-UHFFFAOYSA-N	442.476	1.032	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)C(=O)Nc1cnn(CC(=O)NC2CCCC2)c1)c1ccccc1	764328937	UEZNKLXPRVVBOQ-GOSISDBHSA-N	440.504	1.222	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2cc(CC(C)C)nn2C)n[nH]1	764378219	WEGAUKYBSALODA-UHFFFAOYSA-N	439.476	1.417	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccnn3-c3ccncc3)n[nH]2)cc1	764384579	DWGJVFPHTCLRMN-UHFFFAOYSA-N	444.455	1.620	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc(-n4cncn4)nc3)n[nH]2)cc1C	764388346	QPCWSCIMCORDLI-UHFFFAOYSA-N	445.443	1.069	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)CCC(=O)N1CCN(c2ccccc2)CC1	764564829	XMWNROFFEJUAFB-KRWDZBQOSA-N	442.491	1.869	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)nc2)n[nH]1	765308156	YRORILVHYLKOGD-UHFFFAOYSA-N	430.446	1.350	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)o1	765314367	YMGKHBXXZUCLKD-UHFFFAOYSA-N	444.510	1.130	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2cccc(OCC(F)F)n2)c1	765319816	CXYCZXINRINLFV-UHFFFAOYSA-N	443.432	1.442	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)C[C@H]3C[C@H]4CC[C@H]3C4)CC2)cc1	765728593	MCXMYZUCJRBYEC-GBESFXJTSA-N	448.589	1.275	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc([N+](=O)[O-])c2cccnc12)c1cc(Br)c[nH]1	766354519	PSVSZPHTIDEFDI-UHFFFAOYSA-N	440.235	1.857	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)CN1C(=O)COc2ccc(Cl)cc21	767267169	AIZOTNTYTHFRLV-UHFFFAOYSA-N	445.859	1.307	50	20	IDGD	
Cc1cccc(NC(=S)NNC(=O)[C@@H](C)NS(=O)(=O)c2ccc(C#N)cc2)c1C	767854677	KDRDWVINMVYURA-CQSZACIVSA-N	431.543	1.860	50	20	IDGD	
CN(C)C(=O)COc1ccc(C(F)(F)C(=O)NNC(=O)NCCc2cccs2)cc1	769558305	AXBFJYAALDJDRD-UHFFFAOYSA-N	440.472	1.880	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)c2cc(Br)cc([N+](=O)[O-])c2)c2ccccc2c1=O	770749132	OYIWAHXXPUZOCC-UHFFFAOYSA-N	446.217	1.679	50	20	IDGD	
Cc1cccc(F)c1NNC(=O)c1cc(S(=O)(=O)N(C)C)ccc1N1CCOCC1	771712357	DRPVODMWLRVNLI-UHFFFAOYSA-N	436.509	1.978	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)c1cccc(I)c1N	772041902	FCVCCONTMUAZSN-VIFPVBQESA-N	433.246	1.612	50	20	IDGD	
Cc1ccc(-n2nnc(C(=O)NNC(=O)C(=O)NCc3ccc(Cl)cc3)c2C)cc1	772195312	KDDOCQYGBOYJCC-UHFFFAOYSA-N	426.864	1.615	50	20	IDGD	
COc1ccccc1[C@@](N)(C(=O)NNC(=O)c1nn(-c2ccccc2)cc1O)C(F)(F)F	776107344	WYLBFNPIRSDQKN-LJQANCHMSA-N	449.389	1.764	50	20	IDGD	
COCc1nnc(-c2cccc(C(=O)NNC(=O)c3cc(OC)c(OC)c(OC)c3)c2)o1	776284664	BCWNAZQANNDNJY-UHFFFAOYSA-N	442.428	1.984	50	20	IDGD	
Cc1nc(-c2ccc(F)c(F)c2)sc1C(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1	777975117	GIQNVTKRIUGHRQ-SNVBAGLBSA-N	430.458	1.528	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)/C(=C\c2ccc(F)cc2)n2nnnc2C)nc1C	778421109	GHXCFHKBZZKOSS-CXUHLZMHSA-N	426.412	1.537	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)[C@@H]2CS[C@H](Cc3ccccc3F)C(=O)N2)nc1C	778423065	ZPSWNUQULUUFCV-JKSUJKDBSA-N	447.492	1.387	50	20	IDGD	
O=C(NCCc1ccc(Cl)cc1[N+](=O)[O-])NNC(=O)C1CCN(c2ncccn2)CC1	778649648	KCUCTCWTZBWQGF-UHFFFAOYSA-N	447.883	1.828	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)C(=O)Nc1cc(Cl)ccc1OC[C@@H]1CCCCO1	778713372	JCYWYFSTHDPBKN-ZDUSSCGKSA-N	435.868	1.719	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)c1	778890413	HIXKPSWMDSNLLR-UHFFFAOYSA-N	434.311	1.686	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C[C@H](NC(=O)c2ccc(O)cc2)c2ccccc2)n1	780326276	XIULOYYRZUZHLY-FQEVSTJZSA-N	435.484	1.914	50	20	IDGD	
Cc1c(NC(=O)CSCC(=O)NNc2ccnc(F)c2)c(=O)n(-c2ccccc2)n1C	781361928	AOBRFARTYWGQBL-UHFFFAOYSA-N	444.492	1.834	50	20	IDGD	
Cc1oc(-c2cccc(C(F)(F)F)c2)nc1C(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1	782208255	GGNVZBOVNUFXKL-LLVKDONJSA-N	431.392	1.865	50	20	IDGD	
Cn1cc(-c2ccc(F)c(C(=O)NNC(=O)c3csc(N4CCOCC4)n3)c2)cn1	782541622	HVKLNVJMDXBDOL-UHFFFAOYSA-N	430.465	1.594	50	20	IDGD	
O=C(NCc1ccc(N2CCOC2=O)cc1)NNC(=O)c1nn(-c2ccccc2)cc1O	783014149	MJJNGTODJFZUBV-UHFFFAOYSA-N	436.428	1.679	50	20	IDGD	
CCc1cc(NNC(=O)[C@H]2CC=CC[C@@H]2C(=O)N2CCOCC2)nc(-c2ccccn2)n1	784782622	ZLUHIXDSQUEINF-ROUUACIJSA-N	436.516	1.985	50	20	IDGD	
COc1ccc(Br)c(NC(=O)C(=O)NNc2cccc(S(C)(=O)=O)c2)c1	784844852	QWIHOQIWRSYCMS-UHFFFAOYSA-N	442.291	1.943	50	20	IDGD	
CC(=O)c1cccc(S(=O)(=O)N2CCN(C(=O)COC(=O)/C(C#N)=C\C3CC3)CC2)c1	786668335	FERPQPUFUWXNRY-WQRHYEAKSA-N	445.497	1.125	50	20	IDGD	
Cc1ccc(CNC(=O)NNc2nc(O)c3cnn(C)c3n2)c(-n2cc(Cl)cn2)n1	786835295	OOQHOAWTHFBWJA-UHFFFAOYSA-N	428.844	1.438	50	20	IDGD	
Cc1ccc(N2CCNC2=O)cc1NC(=O)C(=O)NNC(=O)c1ccc(O)c(Cl)c1	787549268	JCIWWHIHMJTRIH-UHFFFAOYSA-N	431.836	1.283	50	20	IDGD	
O=C(NNC(=O)[C@H]1OCC[C@H]1c1ccccc1)C(=O)Nc1ccc(-n2cncn2)c(F)c1	789815705	DLQKAIOYJIRJPR-YJBOKZPZSA-N	438.419	1.065	50	20	IDGD	
COc1c(C(=O)N(C)C)cc(Cl)cc1S(=O)(=O)NNC(=O)c1cccc(C#N)c1	790053653	QOCFGMUOOUOMNZ-UHFFFAOYSA-N	436.877	1.545	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1ccccc1N1C[C@H]2CC[C@H]1C2	790952680	TUMFQEONSXVBPS-HOCLYGCPSA-N	436.468	1.846	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc2c(c1)CCN2C(=O)C(=O)NNc1ncccc1C	792375281	HCLQTTCHNSWBRC-UHFFFAOYSA-N	431.518	1.453	50	20	IDGD	
CN(C)N(C(=O)[C@@H]1C[C@H]1C1CCN(C(=O)OC(C)(C)C)CC1)[C@H]1CCS(=O)(=O)C1	792851431	VFNVNEMACJZYJE-YESZJQIVSA-N	429.583	1.762	50	20	IDGD	
CN(CC(N)=O)C(=O)c1cccc(NC(=O)C(=O)NNc2cccc(C(F)(F)F)c2)c1	793030285	YHNKNWFUGHSCKS-UHFFFAOYSA-N	437.378	1.345	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H](C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)C[C@H]2C[C@H]21	796038480	YHBJHJSGFFGUPS-YUELXQCFSA-N	448.432	1.297	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2ncccc2Br)cc1OC	796096080	WFUNODPJGGENAM-UHFFFAOYSA-N	438.234	1.479	50	20	IDGD	
O=C(CCCS(=O)(=O)c1ccc(Cl)cc1)NNC(=O)Cc1cn2ccccc2n1	796888450	YLSZDCGTPPDNAX-UHFFFAOYSA-N	434.905	1.932	50	20	IDGD	
COc1nccnc1NNC(=O)Nc1ccc(NS(=O)(=O)Cc2ccccc2)cn1	797653527	XGASJKFFCMZMLO-UHFFFAOYSA-N	429.462	1.971	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)[C@@H]1CCCN1C(=O)c1ccc(OC)cc1	798351099	QCACOLKOEJVXDG-SFHVURJKSA-N	441.484	1.925	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)nnn1CCOc1ccc(F)cc1	800319630	ZBLFVBYDDRCUCB-UHFFFAOYSA-N	428.380	1.788	50	20	IDGD	
Cc1c(C(=O)OCC(=O)NNC(=O)c2cccs2)nnn1CCOc1ccc(F)cc1	800327110	SQNZWBGELJVRTN-UHFFFAOYSA-N	447.448	1.484	50	20	IDGD	
CC[C@](O)(C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1)c1cccc(Cl)c1	800380167	KSJKKTKNECRQEH-QGZVFWFLSA-N	446.312	1.700	50	20	IDGD	
COc1cnc2ccccc2c1C(=O)NNC(=O)c1sc(N2CCOCC2)nc1C	801796246	LCNOMHXCKXXGQR-UHFFFAOYSA-N	427.486	1.920	50	20	IDGD	
CC(=O)Nc1ccc(NS(C)(=O)=O)c(C(=O)NNC(=O)Nc2cc(F)cc(F)c2)c1	802008295	YCMNBTLDWGQPFL-UHFFFAOYSA-N	441.416	1.761	50	20	IDGD	
O=C(CCCS(=O)(=O)c1ccc(Br)cc1)NNC(=O)N=c1cc[nH]cc1	802033133	ZDFOIMANXXAZJC-UHFFFAOYSA-N	441.307	1.673	50	20	IDGD	
Cc1ccc(-n2[nH]c(C(=O)NNC(=O)Nc3ccc(S(C)(=O)=O)cc3)cc2=O)cc1	802065501	CLFHGHIEXKCYDM-UHFFFAOYSA-N	429.458	1.344	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)N[C@@H]1CCCN(C(=O)Cc2ccccc2)C1	802475712	GWGZHVBOPWNTHJ-GOSISDBHSA-N	434.500	1.441	50	20	IDGD	
CC(C)N(C)S(=O)(=O)c1ccc(F)c(C(=O)NNc2ccc(-n3ccnc3)nn2)c1	804958800	NYFKFWPWLSIVHS-UHFFFAOYSA-N	433.469	1.587	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(NC(=O)NNC(=O)Cn2ccc3ccccc32)ccc1F	806544199	XQLVUEBSKOEFKF-UHFFFAOYSA-N	433.465	1.884	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2scc(C)c2C(=O)OC)cc1	806975259	RUNWOUBPEHYGDD-GFCCVEGCSA-N	449.485	1.795	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(F)cc2OC2CCOCC2)c1	806978141	OJQIBBBCEMFNKQ-UHFFFAOYSA-N	426.404	1.655	50	20	IDGD	
Cc1cc(C)n(-c2ccc(NC(=O)C(=O)NNc3ccc(-n4ccnc4)nn3)cc2F)n1	807429447	ROCSHRUQVALQJH-UHFFFAOYSA-N	435.423	1.686	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)N[C@@H](c2nncn2C)C(C)C)c2ccccc2c1=O	807431296	CWFCICLAXXLLRN-MRXNPFEDSA-N	440.508	1.666	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNc2nccnc2C2CCC2)cc1C	807462279	SAZDDLYCPLHZFT-UHFFFAOYSA-N	432.506	1.896	50	20	IDGD	
CCCN1CCC[C@H]1CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(CC)CC)c1	807548385	VQTMMPOLRXJPKF-KRWDZBQOSA-N	439.582	1.536	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc[nH]2)c(C(=O)NCC(F)(F)F)cc1F	810384521	LYXTVFSPMGMDHD-UHFFFAOYSA-N	429.330	1.154	50	20	IDGD	
Cc1onc(N)c1S(=O)(=O)NC(=O)/C(C#N)=C\c1cc(C)n(C[C@@H]2CCCO2)c1C	810828357	QBJYLGOYPRUJON-YMDFIQGPSA-N	433.490	1.575	50	20	IDGD	
COC(=O)Cc1cc(Br)ccc1S(=O)(=O)NNC(=O)c1ccccn1	811675346	PFXSPAYKXZQFAF-UHFFFAOYSA-N	428.264	1.183	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)cc1	812940406	VCSWVCGDCGBVBL-UHFFFAOYSA-N	441.535	1.847	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ncc(C(F)(F)F)s2)cc1	813033127	GBBJVTHMHOXOCR-UHFFFAOYSA-N	437.425	1.494	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)Cc2nnc(C)o2)c1	813363123	CQLSFFVZVRMMOR-UHFFFAOYSA-N	445.457	1.191	50	20	IDGD	
Cc1nnnn1[C@H](Cc1ccc(F)cc1)C(=O)NNc1ccccc1S(=O)(=O)N(C)C	817053715	CYKFMJWBZGJDFT-QGZVFWFLSA-N	447.496	1.298	50	20	IDGD	
Cc1ccc(-n2[nH]c(C(=O)NNC(=O)[C@@H]3CCCN(C(=O)OC(C)(C)C)C3)cc2=O)cc1	819658588	NMQXVRHOJSXCRL-OAHLLOKOSA-N	443.504	1.882	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)c1ccc2c(c1)C[C@H](C)N2S(C)(=O)=O	825637072	NMAZUTGHQCJMLJ-ZDUSSCGKSA-N	432.502	1.279	50	20	IDGD	
CC(=O)c1cccc(S(=O)(=O)N2CCC(C(=O)NNc3nc(C)cc(C)n3)CC2)c1	837301281	SLIMBJOYNGMERN-UHFFFAOYSA-N	431.518	1.840	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(\C#N)C(=O)O[C@H](C)C(=O)N2CCN(C(C)=O)CC2)c1C	853647612	BIJUKLDXATVEAV-QGHRKWBVSA-N	444.532	1.842	50	20	IDGD	
C[C@@H]1Cc2ccccc2N1S(=O)(=O)c1ccc(F)c(C(=O)N2CC[C@@H](B(O)O)C2)c1	864231253	LIZAEPOVCVTZGC-UKRRQHHQSA-N	432.282	1.655	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)[C@H]2CS[C@@H](Cc3ccccc3F)C(=O)N2)cc1	892122171	SKIPRCAJRDGXLX-MSOLQXFVSA-N	431.489	1.503	50	20	IDGD	
O=C(Cn1cnc2ccccc21)NNC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccccc2)C1	915188526	VJBRZKVAAUHBFS-MRXNPFEDSA-N	441.513	1.285	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2ccc(N3CCOC3=O)cc2)cc1	915293323	MBKRBNZDYAYJAY-UHFFFAOYSA-N	446.485	1.033	50	20	IDGD	
Cc1nnnn1[C@@H](Cc1cccc(F)c1)C(=O)NNC(=O)c1cc(Br)c[nH]1	915685681	HGZPALXEWPPDFL-AWEZNQCLSA-N	436.245	1.456	50	20	IDGD	
CC(=NNC(=O)COc1ccccc1F)c1ccc(S(=O)(=O)NCCC(=O)O)cc1	916300524	KBEPEXIGSGDCFE-UHFFFAOYSA-N	437.449	1.498	50	20	IDGD	
CC1CCN(c2ccc(CNC(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)cn2)CC1	916389266	SSODNXCUTIKKQP-UHFFFAOYSA-N	449.515	1.709	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)cc1C	916519471	ABNIDWBQYVIMQB-UHFFFAOYSA-N	433.509	1.972	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)NCCCn2nc3n(c2=O)CCCC3)c1C	916650207	SYTQITFXFWZQCQ-MRXNPFEDSA-N	430.509	1.186	50	20	IDGD	
Cc1[nH]nc2ncc(C(=O)NNC(=O)c3cccc(S(=O)(=O)N4CCCCC4)c3)cc12	918186551	CMDJSPBYNQYZTQ-UHFFFAOYSA-N	442.501	1.516	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)NCC(=O)N1CCCc2ccccc21	920045730	VNQNCZCUPKGACO-UHFFFAOYSA-N	426.473	1.774	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)Nc2ccc(CN3C(=O)CNC3=O)cc2)c1C	920933075	HQSKLUHUMNQNRB-OAHLLOKOSA-N	439.472	1.975	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)c1cccc(N2CCCC2=O)c1	920979272	DRVPYQYAQHFVLG-CQSZACIVSA-N	448.483	1.766	50	20	IDGD	
O=C(CCCC[C@@H]1SC[C@H]2NC(=O)N[C@H]21)NNC(=O)c1ccc(Br)s1	921303227	UOAWMUONAKTGFX-VYUIOLGVSA-N	447.380	1.997	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@H](CCSC)N2C(=O)[C@H]3CCCC[C@@H]3C2=O)cc1	1115817505	IPQHTQRMGGTREL-ULQDDVLXSA-N	433.530	1.753	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)c2cn(Cc3ccccn3)nn2)CC1	1116134144	YTVGICBNSKPGDV-UHFFFAOYSA-N	429.481	1.130	50	20	IDGD	
CSCC[C@@H](C(=O)NNc1nncc(N)c1Cl)N1C(=O)[C@H]2CCCC[C@H]2C1=O	1116297423	MXBJDHLKAYFDLT-UMNHJUIQSA-N	426.930	1.452	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)NCc2ccccc2N2CCN(C)CC2)cc1OC	1318332057	KBZUAVFYUBXIEP-UHFFFAOYSA-N	441.532	1.990	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)c2ccc3c(c2)OCCO3)ccc1N1CCN(C)CC1	1320238486	QIXQKRCDRVNTLM-UHFFFAOYSA-N	425.489	1.985	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2ccncc2OC[C@H]2CCOC2)c1	1342651858	IRYGAVZPCWGFQY-AWEZNQCLSA-N	448.501	1.045	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnn4ccncc34)C2)C1	1777985605	AVBKLLWEZAPECG-KBXCAEBGSA-N	436.310	1.346	50	20	IDGD	
O=C(c1cc2cnccc2[nH]1)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1778678172	SBXHJNPOPUHHQM-PBHICJAKSA-N	425.258	1.697	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc3nc[nH]c3c2)C1	1779012869	ZHWAXXLFKBMJRT-RRMPHLOHSA-N	434.924	1.944	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cccc(SC)c3O)C2)C1	1780154636	UCFJHRDVZWPKPA-AUUYWEPGSA-N	428.938	1.811	50	20	IDGD	
C[C@H](Cc1ccccn1)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781335672	ZCRKSMBSZMIDBV-QIIPPGSGSA-N	428.302	1.781	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cccc(F)c3[N+](=O)[O-])C2)C1	1781773020	YAJZZAMRUSYGRB-APPDUMDISA-N	444.257	1.961	50	20	IDGD	
CC(=O)N[C@H](C)C(=O)N1CC[C@]2(CN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)CCO2)C1	1783180581	BKXFQSHTVIZQNK-JDORMIOJSA-N	446.454	1.226	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](C)Nc1cccnc1)CCO2	1783532488	IUVPLJYAYGLQFN-PMUMKWKESA-N	425.327	1.495	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3[nH]cnc3-c3cccnc3)CCO2)C1	1783881369	LAIRCWZGYOIOKK-QRWLVFNGSA-N	433.896	1.169	50	20	IDGD	
O=C(c1ccc(N2CCOCC2)cn1)N1CCO[C@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783943893	PIQZLFXLBPAILV-IBGZPJMESA-N	443.331	1.165	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)n3ccnc3)[C@H]2C1	1784258112	SZJZRDBPOPOTJZ-CWVYHPPDSA-N	427.343	1.597	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CC(=O)Nc3cc(C)on3)C[C@@H]21	1784618981	SQTCZNNWVDGNPN-VGWMRTNUSA-N	440.928	1.699	50	20	IDGD	
COc1cc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)cc(OC)c1C	1785173797	WCZATKCYMCPHND-YWZLYKJASA-N	426.897	1.055	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(NC(C)=O)o3)[C@H]2C1	1788608804	SDNCWHJIOQQAOO-AYDFFVQHSA-N	427.885	1.085	50	20	IDGD	
CC[C@H](C)[C@H](O)C(=O)NC1(c2ccc(NC(=O)c3cnccc3C(=O)NN)cc2)CCC1	1789519927	RIQIQJZLOJJMEL-LIRRHRJNSA-N	439.516	1.840	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]3C2)nc1	1789868017	LGWDFSIZSFTFLS-BCRCDCHUSA-N	430.332	1.920	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3c(O)cc(O)cc3O)[C@H]2C1	1790153979	RXSGLQOBTHTDFR-RBOXIYTFSA-N	426.897	1.662	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(F)ccc3OC)C[C@@H]21	1791256616	RPMIJHRFQYPCLV-RPZXMPESSA-N	428.888	1.681	50	20	IDGD	
C[C@H](Br)C(=O)Nc1ccc(C2(NC(=O)CN(C)C(=O)C(=O)O)CCC2)cc1	1791435924	MGFVWOYAROIVPY-NSHDSACASA-N	440.294	1.447	50	20	IDGD	
CN1CCN(c2ccc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)[C@@H](O)CCl)C4)cc2)CC1	1792529585	HDDOTRYZMVGCEI-RNQOJCNYSA-N	434.968	1.290	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1ccc(Cl)s1	1794170945	VQYKZLLJYMICJB-CLLJXQQHSA-N	447.948	1.895	50	20	IDGD	
COc1ccccc1CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1	1796189960	NZMXGRNTOHOCEH-WKCHPHFGSA-N	436.317	1.260	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1cccs1	1796204761	GKKFVVOEYPWPLU-ISFILERXSA-N	425.514	1.712	50	20	IDGD	
COC(=O)N[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Cl)c1ccccc1	1796361973	ZIEWIHDHMXZMQR-JKJDWNRSSA-N	427.860	1.208	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H]1CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Cl	1796365489	XRSHWXZDEKUKSO-SSRUIJIPSA-N	447.935	1.900	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2)[C@H]1Cc2ccccc2CN1	1796370496	ABVIXQDENZMFFQ-SFNKJDCFSA-N	436.350	1.076	50	20	IDGD	
Cc1ccn2c(=O)c(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)C(Cl)Cl)C4)cnc2c1	1797068359	ROIMSAKBXCBOBI-JJLQDPRZSA-N	439.299	1.010	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc([N+](=O)[O-])c(O)cc1C	1799830303	QIAMKRLFVRMNDB-IFOZYUSPSA-N	441.868	1.066	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1C[C@@H]1F	1800377418	VCEOYJZYUKHCQS-UNSNBMSVSA-N	435.408	1.081	50	20	IDGD	
CCOC(=O)c1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C(Cl)Cl)ccn1	1801016603	OMPCINNHMHSMAT-DABQJJPHSA-N	430.288	1.265	50	20	IDGD	
Cc1cnn([C@@H](C)C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)CBr)C3)c1	1801335573	PTZLIPZMLWKCTM-DGADGQDISA-N	427.343	1.373	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)c(O)c(Cl)c1)C2	1802337868	CLQDAUKPKUTMPJ-BTTYYORXSA-N	438.912	1.376	50	20	IDGD	
CCC(=O)N[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)CO[Si](C)(C)C)[C@H]1c1cccnc1	1803435979	TYNSIYFDGCFSAE-SYNHAJSKSA-N	434.613	1.854	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CCC(=O)NN(C)C)C3)cc1	1803721419	CNNJTRBNXCSWNG-REPLKXPHSA-N	429.521	1.270	50	20	IDGD	
Cc1ccc(C(=O)NC[C@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)o1	1803788779	KXIOESNZFGGRGP-UTKZUKDTSA-N	427.505	1.676	50	20	IDGD	
Cn1cnc(C(=O)NC[C@@H]2CCN(C(=O)[C@](C)(Cl)CCl)[C@@H]2c2cccnc2)n1	1805327634	XUYGNWXLWOIDHN-PMUMKWKESA-N	425.320	1.766	50	20	IDGD	
CN(C)c1cccc(OCC(=O)N2CCC3(CCCN(C(=O)[C@@H](O)CCl)C3)CC2)c1	1805516808	BOEMIKAUFIITGO-IBGZPJMESA-N	437.968	1.962	50	20	IDGD	
Cc1cccnc1CCC(=O)N1CCCC2(CCN(C(=O)c3cccc(B(O)O)c3)CC2)C1	1806917078	OSLDBMOUPBPDPG-UHFFFAOYSA-N	449.360	1.547	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)[C@@H]2C[C@@H]2F)[C@@H]1c1cccnc1	1808408079	GPBFKUXVZXGEPR-RXDWQSTPSA-N	440.479	1.579	50	20	IDGD	
CCC(=O)C(=O)N1CC[C@H](CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@@H]1c1cccnc1	1808416105	DRVCWKPAGMBQCS-RBIZEYAUSA-N	438.488	1.201	50	20	IDGD	
Cc1nc(CC(=O)N2CC[C@H](CNC(=O)[C@H](F)Br)[C@@H]2c2cccnc2)no1	1808650657	BUWVZPITLILNNS-KCXAZCMYSA-N	440.273	1.712	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)C3Cc4ccccc4C3)CC2)C1	1809977589	DNNGASXIOLKIFA-UHFFFAOYSA-N	446.356	1.626	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)c2ccccc2)[C@@H]1c1cccnc1	1810303557	VGIGOTGFQLGPTE-GHTZIAJQSA-N	444.495	1.714	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)c1c(O)cc(O)cc1O	1811412223	HUWCFKIZYLWYQB-ULFGMLNVSA-N	435.864	1.118	50	20	IDGD	
CCOc1ccc(C(=O)NC[C@@H]2CCN(C(=O)[C@H](Cl)COC)[C@H]2c2cccnc2)nn1	1811625637	ACFAFOUNNOFDQI-FCEWJHQRSA-N	447.923	1.844	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2ccc([N+](=O)[O-])[nH]2)[C@@H]1c1cccnc1	1813032717	LJCQXACJNRQONV-JKIFEVAISA-N	435.868	1.891	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)[C@@H]1C[C@@]1(F)Cl	1813153171	OWJKHTQGQVTUMF-JWVYWZTKSA-N	445.687	1.006	50	20	IDGD	
C[C@H](C(=O)NC[C@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1)n1cnnn1	1813467854	JWZMGVYJRHBDNS-XPKDYRNWSA-N	436.314	1.120	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)CCN3CCOCC3)sc2C1	1814648134	BNANDBVUDOHRPY-QWHCGFSZSA-N	430.958	1.031	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(O)n[nH]3)sc2C1	1815217357	DMVHZMIMRCVISM-HTQZYQBOSA-N	428.312	1.971	50	20	IDGD	
CN1N=C(C(=O)Nc2cc([C@H]3CCCCN3C(=O)[C@@H](F)Br)[nH]n2)CCC1=O	1815622617	NKIVDMRIYMLMMH-BXUZGUMPSA-N	443.277	1.701	50	20	IDGD	
COC[C@H](NC(C)=O)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CO[Si](C)(C)C)n[nH]1	1819595709	YLHXGYICAXFXCP-JKSUJKDBSA-N	439.589	1.404	50	20	IDGD	
C[C@@H]1C[C@@]1(C)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1	1819798054	SFYJZUJOPXSHIX-SUTOTMHJSA-N	428.518	1.414	50	20	IDGD	
CC(=O)NC(C)(C)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1	1822998434	CWFNCQQQVHJYOK-LDYMZIIASA-N	435.319	1.660	50	20	IDGD	
O=C(NCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H](O)CCl)CC1)c1cccs1	1825235077	XAEQIBQRDLDSJE-CVEARBPZSA-N	441.981	1.697	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)c2cscn2)CC1	1825986193	PPEBFEWWWWOIAS-LJQANCHMSA-N	427.335	1.370	50	20	IDGD	
O=C(CN1C(=O)C=CC1=O)N1CCC([C@H]2CCCCN2C(=O)CCBr)CC1	1826360567	OSOIUMDKFKBYLT-OAHLLOKOSA-N	440.338	1.316	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CS(C)(=O)=O)CC1	1826629319	VPALXLHVUYDIPQ-WMLDXEAASA-N	427.394	1.887	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CN2CCNC2=N)CC1	1826874393	NPBBDZINPGAUKF-KXBFYZLASA-N	432.396	1.682	50	20	IDGD	
C[C@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1)n1ccnc1	1827048860	APVVCHAMVQIBOR-UTKZUKDTSA-N	438.337	1.057	50	20	IDGD	
CC(C)[C@H](S)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827050005	DGRMZELHKBDHFP-UXHICEINSA-N	432.395	1.554	50	20	IDGD	
N=C1NCCN1CC(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H](F)Br)CC1	1830375709	WLXQQLWWJAQTPY-ZFWWWQNUSA-N	432.338	1.137	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)COC3CCCCC3)CCO2)C1	1830383748	HRPZQZILYFYCNQ-KXBFYZLASA-N	447.370	1.576	50	20	IDGD	
Cn1cccc(C(=O)NC2CCN(C3CCN(C(=O)C(Cl)Cl)CC3)CC2)c1=O	1833586095	FQJPCYOGZPTWQI-UHFFFAOYSA-N	429.348	1.374	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1)c1cnsn1	1833975393	MRHMPEPDKBOJDA-UHFFFAOYSA-N	430.372	1.508	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3cncc(F)c3)CCO2)C1	1834352658	HPUHHXPXWDOFGC-FZKQIMNGSA-N	444.301	1.322	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@]3(CN(C(=O)CCBr)CCO3)C2)nc1C	1834819422	QPQBHLMVJOGANO-IBGZPJMESA-N	440.338	1.553	50	20	IDGD	
Cc1nc(C(=O)N2CCOC[C@]3(CN(C(=O)CCBr)CCO3)C2)sc1C	1834823127	JYVTTZUDDIOAEZ-KRWDZBQOSA-N	446.367	1.615	50	20	IDGD	
Cc1nnc(CC(=O)NC2CCN(C3CCN(C(=O)[C@@H](C)Br)CC3)CC2)o1	1834835498	NDSNVDCXPNOZSR-GFCCVEGCSA-N	442.358	1.276	50	20	IDGD	
O=C(Cc1ccc2c(c1)OCO2)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1835172056	JHWAZKOZSAXUHC-LJQANCHMSA-N	445.299	1.218	50	20	IDGD	
Cc1c(C(=O)NC2CCN(C3CCN(C(=O)[C@H](O)CCl)CC3)CC2)nc2ccccn12	1835309202	BMYWOAAMJYPTPT-GOSISDBHSA-N	447.967	1.428	50	20	IDGD	
O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)CCc1ccc[nH]1)CCO2	1836011947	PUKYUWFDXNSAAM-SFHVURJKSA-N	428.327	1.189	50	20	IDGD	
COc1ccc(C(=O)NC2CCN(C3CCN(C(=O)[C@H](O)CCl)CC3)CC2)c(O)c1	1836243677	PDWOGFQYZWPQHK-LJQANCHMSA-N	439.940	1.186	50	20	IDGD	
Cn1ncc2cc(C(=O)N3CCC(OC4CCN(C(=O)[C@@H](O)CCl)CC4)CC3)ccc21	1836717375	VPCFPDJZSADJLS-FQEVSTJZSA-N	448.951	1.785	50	20	IDGD	
COc1cscc1C(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836718161	TYXDZXAQONGKAM-INIZCTEOSA-N	430.954	1.969	50	20	IDGD	
CC(C)c1cc(C(=O)N2CCC(OC3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)n[nH]1	1836718670	YWGFHVCPZKPOQG-SFHVURJKSA-N	426.945	1.745	50	20	IDGD	
CCc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)n(C)n1	1838044856	HICFQZLLRSWJCB-OALUTQOASA-N	447.363	1.289	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)c3cnc(O)[nH]3)CC2)CC1	1838479498	FXQKFQJTPINHFE-LLVKDONJSA-N	429.315	1.511	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(C)n4ccnc4n3)C2)C1	1839148252	SLFALRPFVCJJLJ-FOIQADDNSA-N	435.912	1.125	50	20	IDGD	
O=C(c1cc(O)ccc1F)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1839295952	AKNSIKROVJIGRT-YOEHRIQHSA-N	449.248	1.292	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1onc3ccccc13)CCO2	1839546333	QMSMUOYQJAZLME-NRFANRHFSA-N	447.564	1.749	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3onc4ccccc34)CCO2)C1	1839547602	HIPZKDZDQPYVCD-MGPUTAFESA-N	437.880	1.152	50	20	IDGD	
C=C(C(=O)N1CCO[C@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1)C(F)(F)F	1839894056	GUDSHVZWNVCMAR-HUUCEWRRSA-N	433.254	1.798	50	20	IDGD	
C[C@@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)CCBr)C2)C1)n1cccc1	1840350681	PKQWEQGPYGMUDV-MAUKXSAKSA-N	428.327	1.291	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)Cc2ccc3ccccc3c2)C1	1842660003	ICAYFRAKGRWVJG-UHFFFAOYSA-N	428.297	1.579	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC2(CCCN2C(=O)/C=C/C(=O)NCc2ccco2)C1	1844344619	OAPXKEHDHNWVOU-QWNKOJSDSA-N	428.316	1.892	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC2(CCCN2C(=O)c2nc(O)n3c2CCCC3)C1	1844395999	HDJKGKZIOLHOEE-GFCCVEGCSA-N	425.327	1.773	50	20	IDGD	
COc1cc(C)cc(C(=O)N2CCCC23CN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C3)c1	1845290316	QYMBSBCEILOXHB-PCLIKHOPSA-N	437.500	1.955	50	20	IDGD	
COc1ccc2oc(C(=O)N3CC4(CCCN4C(=O)CCC(=O)NN(C)C)C3)cc2c1	1846385062	PKLPVHDIVSCPIR-UHFFFAOYSA-N	428.489	1.631	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@H]2C[C@H]3C[C@H]3N2C(=O)OC(C)(C)C)C1	1847083055	ICNZZSSOYAKESA-QXSJWSMHSA-N	441.956	1.842	50	20	IDGD	
C[C@@H]1OCCN(C(=O)OC(C)(C)C)[C@H]1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](F)Cl	1847890709	ACIHZUAVIMPCSL-LXFSFDBISA-N	433.908	1.747	50	20	IDGD	
O=C(Cn1ccc2sccc2c1=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](F)Br	1848184520	ALIUFEYONUXFIE-HUBLWGQQSA-N	442.310	1.955	50	20	IDGD	
O=C(c1ncn(-c2cccc(F)c2)n1)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](F)Br	1848311283	MYLBMLKUMLDIBX-MELADBBJSA-N	440.248	1.912	50	20	IDGD	
Cc1nnc(NNC(=O)CSCc2nc3sc4c(c3c(=O)[nH]2)CCCC4)[nH]c1=O	11547816	ZGIWBUDOGVEMQZ-UHFFFAOYSA-N	433.519	1.027	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)C2CCN(c3nc4ccccc4o3)CC2)c2ccccc2c1=O	14346611	QQGIQQJUGURSET-UHFFFAOYSA-N	446.467	1.752	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)CCC(=O)N2CCC(c3ccccc3)=N2)nc2ccccc21	15926142	GXESCUBTROZTIB-UHFFFAOYSA-N	432.484	1.680	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CC23CC4CC(CC(C4)C2)C3)cc(OC)c1OCC(N)=O	17186129	DJSNLIPAGQSFLI-UHFFFAOYSA-N	445.516	1.935	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)Cn2c(-c3cccs3)n[nH]c2=S)c2ccccc2c1=O	17193282	VASXUJGICSBNCR-UHFFFAOYSA-N	441.498	1.377	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)CCc2ccc(N(C)C)cc2)cc1	21779039	RFOOTFPXRGGKSC-UHFFFAOYSA-N	432.546	1.462	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cccc(OC)c2OC)c1	28195830	BNSULRMWGNFNPD-UHFFFAOYSA-N	435.502	1.809	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2ccc3c(c2)C[C@@H](C)N3S(C)(=O)=O)cc1OC	45573769	ODNLRTZBURKDTA-GFCCVEGCSA-N	433.486	1.489	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc2[nH]c(=O)[nH]c2c1)c1ccc(COc2ccccc2)o1	60943560	KVIVKTHJLCDWNC-UHFFFAOYSA-N	428.426	1.652	50	20	IDGD	
COc1cc(I)c(C(=O)NNc2nnc(C)c(O)n2)cc1OC	725881084	PQLRNOOHDWSAAX-UHFFFAOYSA-N	431.190	1.264	50	20	IDGD	
Cc1ccccc1[C@@H](CC(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1)NC(N)=O	728209492	FVAGKMXDHGTHNZ-GOSISDBHSA-N	431.518	1.679	50	20	IDGD	
C#Cc1ccc(C(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)nc1	728858463	QMAGVYROECQTIF-UHFFFAOYSA-N	426.479	2.000	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)NCCCNC(=O)c1cccc(Br)c1	728957377	DBQXQFWCADJRLT-UHFFFAOYSA-N	434.294	1.537	50	20	IDGD	
CC(=NNC(=O)c1sc(N2CCOCC2)nc1C)c1cccc(NS(C)(=O)=O)c1	729816117	CVBMQXHZKAYKNT-UHFFFAOYSA-N	437.547	1.814	50	20	IDGD	
Cn1cc(S(=O)(=O)N2CCCCC2)cc1C(=O)NNC(=O)CCc1ccccc1O	730034299	ISAQPPPODILMGL-UHFFFAOYSA-N	434.518	1.299	50	20	IDGD	
COC(=O)NCCC(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccc(C)cc2C)c1	730768606	DEZZPPGAVGQTQC-UHFFFAOYSA-N	448.501	1.611	50	20	IDGD	
COCc1nc(OC)c2c(C)c(C(=O)NNC(=O)COc3ccccc3O)sc2n1	730781575	SMMIHHBFJUHBOJ-UHFFFAOYSA-N	432.458	1.700	50	20	IDGD	
O=C(NNC(=O)[C@H](c1ccccc1)N1CCCCC1=O)C1CCN(c2ncccn2)CC1	731228692	LWEYWSXEYUPWFS-FQEVSTJZSA-N	436.516	1.594	50	20	IDGD	
CC(=O)Nc1ccc(NS(C)(=O)=O)c(C(=O)NNC(=O)CCCc2ccccc2)c1	731437440	ZEMMXTYQEJVFDP-UHFFFAOYSA-N	432.502	1.800	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)NCC(=O)N1CCN(c2ccc(Cl)cc2)CC1	731545284	YKMBSNHAVPBQIK-UHFFFAOYSA-N	445.907	1.641	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2ccc(C)c(C(=O)NNC(=O)c3c[nH]nc3C)c2)cc1	731852202	LABVRONNPHPGMY-UHFFFAOYSA-N	443.485	1.911	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)c2ccc(S(=O)(=O)CCCC#N)cc2)C[C@@H](C)O1	732263401	MAZNRGPEQFJPBL-HZPDHXFCSA-N	436.534	1.024	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)N[C@@H]2CCN(c3ccccc3Br)C2)n1	732476804	XBHUOLZHPFXPNQ-CQSZACIVSA-N	435.326	1.872	50	20	IDGD	
O=C(NNC(=O)[C@@H]1C[C@H]1c1ccc(OCc2ccccc2)cc1)[C@@H]1CCS(=O)(=O)C1	732535121	RTBWUHUEXSUVKO-YZGWKJHDSA-N	428.510	1.951	50	20	IDGD	
O=C(CCc1ccccc1)NNC(=O)[C@H]1CCCN1S(=O)(=O)c1cccc([N+](=O)[O-])c1	732935881	JDOLZLBSDSOZDE-GOSISDBHSA-N	446.485	1.528	50	20	IDGD	
Cc1nn(C)cc1C(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	733252199	HJRKODDACOJHQC-UHFFFAOYSA-N	427.486	1.282	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)N[C@H]1CCN(C2CC2)C1	734285304	IRNFXPSSNFNQPY-INIZCTEOSA-N	435.550	1.042	50	20	IDGD	
CN1C(=O)C[C@H](C(=O)NNC(=O)COc2ccc(C#N)cc2)[C@H]1c1cccc(Cl)c1	734417595	SQYOBMRTTJWQLX-FXAWDEMLSA-N	426.860	1.957	50	20	IDGD	
Cc1cc(C)n2nc(C(=O)NNC(=O)NC3CCN(C(=O)OC(C)(C)C)CC3)nc2n1	734824596	FCQXAQOYZWLPIN-UHFFFAOYSA-N	432.485	1.085	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)N[C@H]1CCN(c2ccc(Cl)cc2)C1=O	740484653	QYIDTFAFKGEMAO-INIZCTEOSA-N	427.848	1.726	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCC[S@@](=O)Cc2ccccc2)nc1	741422281	YOIHSABBLZMQAH-MUUNZHRXSA-N	439.563	1.343	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)c1cn(Cc2cccs2)nn1	742469359	XRGFSQRGMJLBKJ-UHFFFAOYSA-N	439.545	1.361	50	20	IDGD	
Cc1nc2[nH]n(C)c(=O)c2c(C)c1CC(=O)NNC(=O)c1cccc(Br)c1	742771948	KQKSBDHDNJNIJT-UHFFFAOYSA-N	432.278	1.645	50	20	IDGD	
NS(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=O)c2cccc(Br)c2)c1	743728762	WNKCNJRAGGJXLS-UHFFFAOYSA-N	432.683	1.825	50	20	IDGD	
C[C@H](C(=O)NNC(=O)CC12CC3CC(CC(C3)C1)C2)N1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O	744352855	QEQCGUBSQYXIKG-FDQSWLPFSA-N	429.517	1.291	50	20	IDGD	
COc1cccc(CCC(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)c1OC	744621385	VRTKDMFHENHABG-UHFFFAOYSA-N	449.529	1.801	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)c2nn(-c3ccccc3F)c3c2CCC3)c1	744744556	GLXWKTMTVIMSIJ-UHFFFAOYSA-N	447.426	1.990	50	20	IDGD	
O=C(NCc1ccc(N2CCOCC2)c(F)c1)NNC(=O)c1cc([N+](=O)[O-])ccc1O	745649116	QEZQEWZAFRVOKL-UHFFFAOYSA-N	433.396	1.420	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)c1ccc(CS(N)(=O)=O)cc1	746343421	DPHOLAHDGNEAJF-AWEZNQCLSA-N	427.482	1.857	50	20	IDGD	
Cc1ccc([C@@H](CNC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)N2CCCC2)cc1	747305917	JCDFJSMYHJJEFV-HXUWFJFHSA-N	434.504	1.752	50	20	IDGD	
CC(C)OCCS(=O)(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	748790918	PNBVGOLDGZRGQQ-UHFFFAOYSA-N	444.513	1.434	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@H]2CCCOc3ccccc32)cc1	750339088	QJGFQFKPTPZYMN-SFHVURJKSA-N	446.529	1.860	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)[C@H]2CCCN(C(=O)c3ccc4n[nH]cc4c3)C2)c1	751296722	LWNOLAGEJUEYRI-KRWDZBQOSA-N	434.500	1.942	50	20	IDGD	
O=C(COC(=O)c1scnc1Br)NNC(=O)c1cccc([N+](=O)[O-])c1	754965462	ROUROKYKMPUXLO-UHFFFAOYSA-N	429.208	1.432	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)CCC(=O)NC2CCCC2)c1	755382528	VJSOVTDWCJZKCI-UHFFFAOYSA-N	438.550	1.317	50	20	IDGD	
COc1cc(C=NNC(=O)[C@H]2COc3ccccc3O2)c([N+](=O)[O-])cc1OCC(=O)O	755488609	WZCUAZXDVJYPHY-QGZVFWFLSA-N	431.357	1.357	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)n([C@H]2CCS(=O)(=O)C2)n1	755538123	ZQYKNLFFSOAZSU-OLZOCXBDSA-N	439.469	1.310	50	20	IDGD	
CN1CC(=O)N(c2cccc(NC(=O)NNC(=O)c3nn(-c4ccccc4)cc3O)c2)C1=O	755993795	VDZDWMBNPHJUDE-UHFFFAOYSA-N	449.427	1.443	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2cccc3c2OCCO3)c1	756150458	ROUSIHIJADIFKB-UHFFFAOYSA-N	448.501	1.955	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)Nc1cccc(N2CCS(=O)(=O)CC2)c1	756204407	ANEVIJUQFPOBQO-UHFFFAOYSA-N	436.465	1.292	50	20	IDGD	
COCCS(=O)(=O)c1ccc(NC(=O)NNC(=O)COc2ccccc2OC)cc1	756550649	JJPFDCAMNUSKCT-UHFFFAOYSA-N	437.474	1.347	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)Nc2cnn(-c3ccccc3S(C)(=O)=O)c2)c(O)c1	756707005	SCSIAYHUXSMNHT-UHFFFAOYSA-N	429.458	1.756	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)Nc1ccc(C2CC2)nn1	757701294	YLQDXLVKHWJOBU-UHFFFAOYSA-N	430.490	1.605	50	20	IDGD	
CN(C)C(=O)CNC(=O)c1ccc(NC(=O)NNC(=O)Cc2ccccc2F)cc1Cl	757725438	PGOXGLGBARSCQA-UHFFFAOYSA-N	449.870	1.693	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)N1CCO[C@@H](c2cccc(OC(F)F)c2)C1	758745474	KNJYHYDGXJLSSI-OAHLLOKOSA-N	438.387	1.425	50	20	IDGD	
O=C(NNC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccccc1)C(=O)Nc1ccccn1	758828690	UOZVJSAIQQMZPB-SFHVURJKSA-N	431.452	1.209	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)N=c1cc[nH]cc1I	760035333	UVGSPFQNKXRBBF-SECBINFHSA-N	444.204	1.867	50	20	IDGD	
C[C@H](CC(=O)NNc1nc(-c2ccccc2)no1)NS(=O)(=O)c1cccnc1Cl	760567421	BZDFXDAUQKMXRE-LLVKDONJSA-N	436.881	1.985	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)c1c[nH]c2ccc(Oc3ccccc3)cc2c1=O	760786795	CXDAERJXWVOEAU-ZDUSSCGKSA-N	441.465	1.516	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@H]2CCN(C(=O)C3CCCC3)C2)c2ccccc2c1=O	762383530	YIPCLIAOFTWRSR-HNNXBMFYSA-N	440.504	1.152	50	20	IDGD	
COc1ccc(C[C@@H](C)CNC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1OC	762529598	SQBQUQWMGAYIHE-CQSZACIVSA-N	439.476	1.502	50	20	IDGD	
CCc1csc(-n2cc(C(=O)NNC(=O)c3sc(N4CCOCC4)nc3C)cn2)n1	762737507	MTQATRZYMQZLNO-UHFFFAOYSA-N	447.546	1.568	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)[C@@H]3CCCCN3C(=O)c3ccc(O)nn3)n[nH]2)cc1	762955355	XKYZFBYFSUOFTA-SFHVURJKSA-N	449.471	1.337	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)CSc2ccccc2O)cc1NC(C)=O	763411607	UWABWZGZSLBKBP-UHFFFAOYSA-N	425.488	1.461	50	20	IDGD	
CC(C)(C(=O)NNC(=O)N1CCN(S(C)(=O)=O)c2ccccc2C1)c1ccccc1	763497490	YFMDQHPQVPFPLI-UHFFFAOYSA-N	430.530	1.987	50	20	IDGD	
Cc1ccc(C#N)cc1NC(=O)C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	763532317	UUVDSPRTPROYJD-UHFFFAOYSA-N	434.500	1.165	50	20	IDGD	
CCOc1cc(NC(=O)C(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)ccc1OC	763540780	ZTFGCBVWCHEVOS-UHFFFAOYSA-N	447.444	1.519	50	20	IDGD	
COC(=O)c1c(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)sc2c1CCCC2	763558111	IETRAPRVUVIIHE-UHFFFAOYSA-N	445.453	1.542	50	20	IDGD	
COC(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1	763575008	OKIXMDJENSZCIQ-OAHLLOKOSA-N	433.804	1.053	50	20	IDGD	
O=C(NNC(=O)c1sc2ccccc2c1Cl)C(=O)Nc1cccc(-n2cnnn2)c1	763578853	QPVDEWGWKMXHNS-UHFFFAOYSA-N	441.860	1.930	50	20	IDGD	
CNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C)c(C)c2)cc1Cl	763668180	ZUMKAMQULXPYQY-UHFFFAOYSA-N	432.864	1.481	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(F)cc2OCC(F)F)cc1	763675407	VNQPQAZYIAZHSE-UHFFFAOYSA-N	436.346	1.506	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)C(=O)Nc1ccc(F)cc1F	763696302	WNMXRZRIEQQIRN-UHFFFAOYSA-N	428.189	1.892	50	20	IDGD	
CC(C)Oc1ccc(NC(=O)C(=O)NNC(=O)c2nnc(O)c3ccccc23)c(F)c1	763791992	ZNMQINHTOFTUCJ-UHFFFAOYSA-N	427.392	1.661	50	20	IDGD	
CCCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)cc1	763864635	DRMSVSBSBRDJNK-ZDUSSCGKSA-N	430.436	1.519	50	20	IDGD	
Cc1nn(-c2ccccc2)cc1NC(=O)C(=O)NNC(=O)c1cc(Br)cn1C	764004640	KDRZNCDIQGWVHJ-UHFFFAOYSA-N	445.277	1.681	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)Nc1cccc(OCCCC#N)c1	764004803	NDZUZADSFDEGIG-UHFFFAOYSA-N	448.277	1.870	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc([S@](=O)C(F)(F)F)cc1	764049446	ZKLMMJVLJAQHNL-LJAQVGFWSA-N	429.376	1.722	50	20	IDGD	
CC[C@H](C)C(=O)NNC(=O)C(=O)Nc1cc(Br)ccc1N1CCOCC1	764087260	ZLLAVULBBWALEW-NSHDSACASA-N	427.299	1.418	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(C)cc3)[nH]n2)ccc1F	764111710	SAYICBNBLXSEQX-UHFFFAOYSA-N	439.403	1.711	50	20	IDGD	
Cc1cc(I)ccc1NC(=O)C(=O)NNC(=O)CC(F)(F)F	764112936	RDAPQUURTAXHCL-UHFFFAOYSA-N	429.136	1.638	50	20	IDGD	
O=C(CC(F)(F)F)NNC(=O)C(=O)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1	764114966	ITMYLWKHCHMGKT-CQSZACIVSA-N	438.410	1.368	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)CCc2ccco2)ccc1-n1nnnc1C(C)C	764169635	QRJUMNCJWATDAS-UHFFFAOYSA-N	425.449	1.406	50	20	IDGD	
CN(C)CC(=O)NNC(=O)C(=O)Nc1ccc(Oc2ccc(Br)cc2)cc1	764203967	NERVOJRMNSSXPS-UHFFFAOYSA-N	435.278	1.889	50	20	IDGD	
Cc1cc(C(=O)NC2CCCCC2)ccc1NC(=O)C(=O)NNC(=O)Cc1cccnc1	764264434	SMSHJWIJXFVAQT-UHFFFAOYSA-N	437.500	1.781	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1F	764350899	MPORKNRKQLUJRG-UHFFFAOYSA-N	441.419	1.436	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C)c(S(=O)(=O)NC(C)(C)C)c2)o1	764368414	VGXNHRROJZZRAI-UHFFFAOYSA-N	436.490	1.373	50	20	IDGD	
C[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1NC(=O)NNC(=O)c1nnc(O)c2ccccc12	764562948	FBPVEEAAXVDTGQ-DOMZBBRYSA-N	444.492	1.925	50	20	IDGD	
CCOc1nccc(C)c1C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765427061	YYWGTFQGNBHGLU-UHFFFAOYSA-N	425.489	1.008	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)CSc1nc2ccccc2nc1N1CCCC1	765639086	RKYBCWUGFHARRS-UHFFFAOYSA-N	444.561	1.774	50	20	IDGD	
COc1cccc(C(=O)NNS(=O)(=O)c2cc(N(C)C)ccc2Br)c1O	766320368	RNUUDVDJKBMSFZ-UHFFFAOYSA-N	444.307	1.853	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)c1ccc2nn[nH]c2c1	766662672	ANEBLTYPWZVYRM-UHFFFAOYSA-N	427.896	1.190	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)[C@H]1CC(=O)N(c2cccc(C)c2C)C1	767270546	AZEVNJKPZIQUFS-IBGZPJMESA-N	437.496	1.898	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)CSCC(=O)N3CCOCC3)n[nH]2)c1	768265017	QMQVJCPVKLYPBA-UHFFFAOYSA-N	431.518	1.047	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)Sc1nnc(-c2cc(-c3ccc(F)cc3)[nH]n2)n1N	768420545	OMHDIPCVYVZXQN-NSHDSACASA-N	446.512	1.862	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc([N+](=O)[O-])ccc1Br)c1cccc([N+](=O)[O-])c1	768498165	XCZUBTWLYRYEOG-UHFFFAOYSA-N	445.207	1.889	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)CN2C(=O)N[C@]3(CCCC(C)(C)C3)C2=O)cc1OC	768570625	GJLLRDKNKGVRJA-QFIPXVFZSA-N	446.504	1.746	50	20	IDGD	
CCCCCCn1cc(S(=O)(=O)NNC(=O)Cn2ccc3ccccc32)c(O)nc1=O	769632643	JJPZRRPSNQARQR-UHFFFAOYSA-N	447.517	1.494	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)c3cc(-c4ccc(Br)cc4)[nH]n3)nc21	770972788	AEVPGCUJLADHCG-UHFFFAOYSA-N	429.238	1.978	50	20	IDGD	
CS(=O)(=O)CCn1cccc(NC(=O)NNc2ccnc(Br)c2)c1=O	771181803	ZZVARNWVLFADAJ-UHFFFAOYSA-N	430.284	1.199	50	20	IDGD	
CN(CCC1CCN(c2ccncc2)CC1)CC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	771453514	WNVNNBLSLCZRKV-UHFFFAOYSA-N	440.504	1.989	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)CCNS(=O)(=O)c1c(C)c(C)c(C)c(C)c1C	771925947	CRQWETQVBLSGBY-INIZCTEOSA-N	441.550	1.386	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNC(=O)[C@H](C(C)C)N2CCCS2(=O)=O)cc1	772630991	NOGHIRWRLZDJDF-SFHVURJKSA-N	425.551	1.933	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)CN1C(=O)N[C@@]2(CCCC[C@H]2C)C1=O	772967061	LXJFKHPDTQPXQO-MTJIALIYSA-N	436.896	1.755	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)[C@H](O)[C@@H](O)c1nc2ccccc2s1	772998971	YVCIHABHGAEGNE-AMKSKSKJSA-N	435.889	1.959	50	20	IDGD	
COC(=O)c1sccc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1cccc(Cl)c1	774010192	VSUIBKRIOBKLNS-VIFPVBQESA-N	425.850	1.742	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NNC(=O)CN2C(=O)c3ccccc3C2=O)C1	774247440	VDVOADICROHWOP-CYBMUJFWSA-N	430.461	1.077	50	20	IDGD	
COC(=O)N1CCC[C@@H]([C@H](C)NC(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)C1	776244462	NIOPTRNHMYYDSL-NWDGAFQWSA-N	434.501	1.780	50	20	IDGD	
Cc1nn([C@@H]2CCS(=O)(=O)C2)c(C)c1NC(=O)NNc1cccc(S(C)(=O)=O)c1	776478866	MKNCVJKJBMIRTD-CQSZACIVSA-N	441.535	1.412	50	20	IDGD	
COCCOc1ccc(-n2nc(C)c(C(=O)NNc3cccc(S(C)(=O)=O)c3)n2)cc1	776534770	VEUFRHWGKKKTLM-UHFFFAOYSA-N	445.501	1.761	50	20	IDGD	
COc1ccc(Cn2cc(C(=O)NNC(=O)CNC(=O)c3cccs3)cn2)cc1OC	777622993	JXARZAQIQAKHOQ-UHFFFAOYSA-N	443.485	1.201	50	20	IDGD	
COc1nn(C)c2nc(C)c(CCC(=O)NNC(=O)CNC(=O)OC(C)(C)C)c(C)c12	778442393	VWBGEDJXZAMMIC-UHFFFAOYSA-N	434.497	1.198	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cc(Cl)ccc2OC[C@H]2CCCCO2)n[nH]1	778714110	RLSHOMYRHJUHGQ-CYBMUJFWSA-N	435.868	1.719	50	20	IDGD	
COc1cc(OC)c(Cn2nccc2NC(=O)NNC(=O)c2cccnc2)c(OC)c1	779483130	NDBTWUHEILAMCL-UHFFFAOYSA-N	426.433	1.819	50	20	IDGD	
CC(=O)Nc1ccc(C)c(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)c1	780950360	FXXMRRDKUPGWND-UHFFFAOYSA-N	445.545	1.646	50	20	IDGD	
C[C@@]1(c2ccc(Br)cc2)NC(=O)N(CC(=O)NNc2ccnc(F)c2)C1=O	781367519	CSIOKMLLICFSCX-KRWDZBQOSA-N	436.241	1.894	50	20	IDGD	
COc1cc(OC)c(NS(=O)(=O)c2cccc(C(=O)NN(C)C(N)=O)c2)cc1Cl	782125693	YYNPIKPVOUWMTH-UHFFFAOYSA-N	442.881	1.813	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)c1cccc(NS(=O)(=O)C(F)(F)F)c1	782780743	HTHMXWCLOBYVNI-UHFFFAOYSA-N	440.400	1.234	50	20	IDGD	
CC(C)C[C@@H](C)n1nccc1NC(=O)C(=O)NNC(=O)c1csc(N2CCOCC2)n1	782898062	YJTFOQMPQFSACO-CYBMUJFWSA-N	449.537	1.183	50	20	IDGD	
N#CCOc1cccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)c1	783408519	LHFYKLLQINZYQI-UHFFFAOYSA-N	442.375	1.964	50	20	IDGD	
NC(=O)COc1ccc(NC(=O)C(=O)NNc2ccc(OCC(F)(F)F)cc2)cc1	784370180	ILZOZTNKFWMREE-UHFFFAOYSA-N	426.351	1.574	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)C(=O)Nc2ccc(OCC3CCOCC3)cc2)c1	784841736	PIYLQYPFKAMPAO-UHFFFAOYSA-N	447.513	1.977	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNc2cc(C)ccc2F)cc(S(C)(=O)=O)c1	784883950	KQGYPPFTTXEMQR-UHFFFAOYSA-N	437.449	1.796	50	20	IDGD	
N#Cc1ccc(NNC(=O)C(=O)Nc2ccc(C[C@@H]3CC(=O)NC3=O)cc2)cc1Cl	785092081	AEELVMSURQPVAY-CYBMUJFWSA-N	425.832	1.499	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2cc(Cc3ccccc3)[nH]n2)ccc1Cl	785690220	CQKBTANCWNKNEC-UHFFFAOYSA-N	433.877	1.376	50	20	IDGD	
O=C(NNC(=O)c1cnc(O)c2ccccc12)c1cccc(S(=O)(=O)N2CCCC2)c1	786689194	SPNWMFCGYGUMGG-UHFFFAOYSA-N	440.481	1.800	50	20	IDGD	
Nc1ccc([N+](=O)[O-])cc1C(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	787124584	CCSDVQUHMMDPCV-UHFFFAOYSA-N	446.895	1.409	50	20	IDGD	
CN1CCN(C(=O)NNC(=O)[C@@H](c2ccc(Cl)cc2Cl)N2CCOCC2)CC1	788166745	QSZDDCDEUFDNEC-MRXNPFEDSA-N	430.336	1.355	50	20	IDGD	
Cn1nc([C@@H]2CCCO2)cc1NC(=O)C(=O)NNC(=O)CC12CC3CC(CC(C3)C1)C2	789733313	ZJCGNQNRNDZLLW-LEJIWSMMSA-N	429.521	1.964	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)C2=C(C)N(C)c3ncnn3[C@H]2C)cc1C	791462885	IYLLUTOAIAHGLN-LBPRGKRZSA-N	432.506	1.500	50	20	IDGD	
CNC(=O)c1cc2cc(NC(=O)NNC(=O)C3CCN(c4ncccn4)CC3)ccc2[nH]1	791918648	PSQATDPHMQIZIN-UHFFFAOYSA-N	436.476	1.387	50	20	IDGD	
CCS(=O)(=O)c1ccc([C@H](C)NCC(=O)NNC(=O)c2ccc(OC)c(OC)c2)cc1	792949472	OAIIVDGIBVWEMG-AWEZNQCLSA-N	449.529	1.609	50	20	IDGD	
COCCCn1c(S)nc2cc(C(=O)NNC(=O)c3cccc(C)n3)ccc2c1=O	794081395	FTLKKJKBSVILQH-UHFFFAOYSA-N	427.486	1.500	50	20	IDGD	
CC(=O)N[C@@](C)(C(=O)NN=c1sc2ccccc2n1C)c1ccc(S(C)(=O)=O)cc1	797404234	INTDDRWEOKPLKJ-HXUWFJFHSA-N	446.554	1.627	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2cn([C@H]3CCS(=O)(=O)C3)nc2C(C)C)cc1	802056430	NREZKISCRTYXSR-AWEZNQCLSA-N	435.506	1.841	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)C2CCN(S(=O)(=O)c3cccnc3)CC2)cc1	802122733	ZOHQQEYTTQKQSJ-UHFFFAOYSA-N	446.533	1.401	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NC[C@H]2CC(c3ccc(OC)cc3)=NO2)cc1	802363162	KDWCTTQCOSPWIO-GOSISDBHSA-N	428.445	1.606	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)N[C@H]1CCCN(C(=O)Cc2ccccc2)C1	802473217	PIZYVWUMEZCPGC-INIZCTEOSA-N	448.483	1.513	50	20	IDGD	
O=C1COC[C@@H](C[C@@H]2CN(C(=O)C(=O)NNc3ccccc3Cl)c3ccccc32)N1	806967408	KSDWQIFEQZPFNF-ZIAGYGMSSA-N	428.876	1.819	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)C(=O)Nc1cccc(C(=O)NCCOC)c1)c1ccccc1	806980351	WAHJQOGBJZDAGB-GOSISDBHSA-N	426.473	1.343	50	20	IDGD	
CCS(=O)(=O)c1ccc([C@H](C)NC(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)cc1	807268334	CUZJTYFJJZUBAD-NSHDSACASA-N	436.446	1.799	50	20	IDGD	
CC[C@@H]1[C@@H](C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)CCN1C(=O)OC(C)(C)C	809932950	KRMDGPOQVNMROV-JKSUJKDBSA-N	443.504	1.730	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)Nc1cccc(N2C(=O)NC(C)(C)C2=O)c1	812974214	UUHPTTXGGZUOSJ-UHFFFAOYSA-N	435.444	1.944	50	20	IDGD	
CC(C)(C)[C@H]1CCc2nc(NC(=O)C(=O)NNC(=O)[C@H]3CCc4nncn4C3)sc2C1	815692494	SBGQSGHKSBIQAF-RYUDHWBXSA-N	445.549	1.234	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1cc2c(cc1F)CCC(=O)N2	815751622	HLPYORJRUUVTDM-UHFFFAOYSA-N	449.464	1.043	50	20	IDGD	
O=C(NNC(=O)[C@H]1CS[C@@H](Cc2ccccc2F)C(=O)N1)c1ccc2c(c1)OCCO2	900255576	LJQQNTJGCFSHTJ-QAPCUYQASA-N	445.472	1.201	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)NCc1ccc(C(=O)N2CCCC2)cc1	914598907	ZODUVHXEALCLDF-UHFFFAOYSA-N	426.473	1.841	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)C1CCN(C(=O)N(C)C)CC1	915441165	LJTPTRFGZZRBCX-UHFFFAOYSA-N	440.884	1.046	50	20	IDGD	
CN(CCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)Cc1ccccc1	916197467	UCFDDVIXDMHELC-UHFFFAOYSA-N	447.561	1.403	50	20	IDGD	
Cc1ccc([C@H](CNC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])N2CCOCC2)o1	916229027	LGONCAJFPCWENP-INIZCTEOSA-N	447.448	1.279	50	20	IDGD	
CCC(CC)[C@@H](CNC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)N1CCCC1	916256772	QNWZJCZNTQJJRW-GOSISDBHSA-N	428.537	1.778	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NN=C(C)c1ccncc1)N(S(C)(=O)=O)CC2	916354546	FHCQKMQKLXJTEG-GOSISDBHSA-N	446.529	1.888	50	20	IDGD	
O=C(NCCCn1cccn1)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	916377092	OFNVIKZCWVDEKY-UHFFFAOYSA-N	445.487	1.619	50	20	IDGD	
CC1CCN(c2ccc(CNC(=O)NNC(=O)[C@@H]3COc4ccccc4O3)cn2)CC1	916388683	DMAMGKAHPJPJPM-IBGZPJMESA-N	425.489	1.988	50	20	IDGD	
CCCCNC(=O)c1ccc(CNC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1	916639218	RESPNOAQHCDXOE-UHFFFAOYSA-N	446.529	1.764	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)c2c[nH]c(C(=O)N3CCCC3)c2)c2ccccc2c1=O	916720056	MDZRXUKETQWHLD-UHFFFAOYSA-N	436.472	1.616	50	20	IDGD	
Cc1cc(C)c(S(=O)(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1C(=O)O	917737055	DUOLNUUXVSPHDE-UHFFFAOYSA-N	426.472	1.028	50	20	IDGD	
CS(=O)(=O)C[C@H]1CCCN(C(=O)NNC(=O)c2ccc(COc3ccccc3)o2)C1	918002366	DTESKUKUTGSOTD-HNNXBMFYSA-N	435.502	1.970	50	20	IDGD	
CC(C)CC(=O)NNC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1	919782434	JXXOQKOBCAHUJQ-UHFFFAOYSA-N	429.500	1.819	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)c1ccc2c(c1)SC1=NS(=O)(=O)CCN12	919820247	QQEDLKJSFCXOKF-UHFFFAOYSA-N	446.510	1.310	50	20	IDGD	
CCCCCCOc1ccc(C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)cc1OC	919885548	LNMNFQYDACZDQE-HNNXBMFYSA-N	427.523	1.785	50	20	IDGD	
CCNC(=O)NNC(=O)c1cc(S(=O)(=O)N2CCCCC2)ccc1N1CCCCC1	920858271	XLYISSFCKJUEAD-UHFFFAOYSA-N	437.566	1.815	50	20	IDGD	
O=C(c1ccc(Cn2cccc2)cc1)N1CCN(S(=O)(=O)CBr)CC1	1116593410	QKEIORPVZSMTIB-UHFFFAOYSA-N	426.336	1.976	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)CN2C(=O)COc3ccccc32)CC1	1318549359	CELGNVVADSJXLC-UHFFFAOYSA-N	432.477	1.207	50	20	IDGD	
Cc1ncncc1C(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	1319026576	YRVCJWAVKUHENT-UHFFFAOYSA-N	425.470	1.338	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)CCn2cc(Br)cn2)CC1	1322958107	RONAOCSOYVBNQN-UHFFFAOYSA-N	444.330	1.830	50	20	IDGD	
COC(=O)[C@@H](NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1)c1ccccc1Cl	1322960742	AGTZGFOUHJNXFJ-SFHVURJKSA-N	439.921	1.804	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)NCC(=O)NNc2ccc(C(C)(C)C)nn2)cc1	1325903491	MAXFFNRVRVCYHJ-UHFFFAOYSA-N	435.506	1.372	50	20	IDGD	
Cn1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](O)CCl)C3)c(C(F)F)n1	1778358925	RHPNHFFWGKNQRB-VEVIJQCQSA-N	434.871	1.085	50	20	IDGD	
O=C(c1n[nH]c2cc(Cl)ccc12)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1778659917	JRSKWWUPFHZSDM-RDTXWAMCSA-N	427.288	1.260	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc3ncccn3n2)C1	1778977257	WPZZQECNKTWJRM-DYESRHJHSA-N	445.596	1.708	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Br)C2)c1ccc(CO)o1	1779712857	PWSJKKPUSBBEGC-JKIFEVAISA-N	433.274	1.590	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc([N+](=O)[O-])[nH]2)C1	1780232295	MYQYJEWMRCHWBC-DNVCBOLYSA-N	438.557	1.902	50	20	IDGD	
COc1cccc(OC)c1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2	1780310866	UEULMOSFCANGFQ-SOIKWTOOSA-N	440.924	1.431	50	20	IDGD	
O=C(Cc1cc2cccnc2cc1F)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1781176933	DHCPPSUPYOXCBQ-NQIIRXRSSA-N	435.883	1.346	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H]1CCN1C(=O)OC(C)(C)C)CCO2	1781215055	HDVCJDVMEWXZOW-MDOVXXIYSA-N	429.945	1.843	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)N1C[C@H]3C[C@@H]3C1)C2	1781998135	UNGAABAUGNMIJY-NRFDFHEYSA-N	442.398	1.624	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnn4c3OCCC4)C2)C1	1782279439	KZFOUDQPHYMTCN-ZWKOTPCHSA-N	431.320	1.345	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@@]2(CN(C(=O)Cn3ccnc3)CCO2)C1	1782863458	BPKISEOKJQPIOS-CQTHNFAISA-N	441.438	1.598	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)Cc3cnc4ccccn34)CCO2)C1	1783528101	JYNPWWMATNEPGZ-IFXJQAMLSA-N	435.322	1.490	50	20	IDGD	
O=C(CSc1ccccc1[N+](=O)[O-])N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1783781446	HOSSINNTGWGNJI-KSSFIOAISA-N	443.909	1.117	50	20	IDGD	
CCOc1cccc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](Cl)COC)C3)C2)c1O	1783882089	VDFDOYWDEPRHFD-QRWLVFNGSA-N	426.897	1.488	50	20	IDGD	
CC[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)N(CC)CC	1784630678	VTBHSNKEBXMZPU-QMHWVQJVSA-N	436.366	1.777	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(S(C)(=O)=O)cn3)[C@H]2C1	1785711035	XQNCOSUZQULVPD-QEWYBTABSA-N	443.953	1.096	50	20	IDGD	
COc1ncc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)Br)C[C@@H]32)cc1C	1786270879	GYQREXZERPMWGV-VRKREXBASA-N	440.338	1.775	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)c1cccn2cncc12	1788422503	RGVQGAUZHSVNTL-MZGVZZPPSA-N	439.285	1.618	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(OC)c(OC)c3)[C@H]2C1	1789544943	JVSAZRWWRLCKJD-FPXQBCRKSA-N	440.924	1.551	50	20	IDGD	
Cc1ccc(F)c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]32)c1	1790077112	ZWRBEIOFKICMLE-IEZWGBDMSA-N	434.512	1.100	50	20	IDGD	
CC(=O)Nc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](O)CCl)C[C@@H]32)ccc1C	1790199536	UNNNVHNLRKLAMG-CAMMJAKZSA-N	437.924	1.146	50	20	IDGD	
CC(C)N1CCC[C@H]1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)Br)[C@H]2C1	1791064949	NPQBIEAEEJWBEK-WOYTXXSLSA-N	430.387	1.622	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)Oc3cccnc3)C[C@@H]21	1791065485	YJZOWYSVPDXCQD-AUOOEQCUSA-N	440.338	1.612	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1ccc(C2(NC(=O)COc3ccc(O)nn3)CCC2)cc1	1791571658	XUKDLBZFQXUBBT-OAHLLOKOSA-N	434.880	1.949	50	20	IDGD	
CC(C)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc3c(c1)CCNCC3)C2	1792784736	QIPXSCWKQGHEAX-IZZQQSIFSA-N	434.968	1.238	50	20	IDGD	
CC(C)n1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)CBr)n1	1792872378	BZYRRSYITLBHSD-HGTKMLMNSA-N	427.343	1.698	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnn(C)c1Cl)C2	1792872665	URISPBFKBRUHLI-HNCHTBHHSA-N	433.734	1.308	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C[C@@H]1COc2ccccc2O1	1793269136	JGSCTOSQOBAUSI-HWEQFAERSA-N	438.908	1.060	50	20	IDGD	
CC[C@@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](Br)CC)C2)N(CC)CC	1793461599	GISIYNOSSZRKPZ-BPKGMFCQSA-N	432.403	1.870	50	20	IDGD	
COc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCBr)cc1F	1795113345	ZJXZERURUIUJBC-FVCICTRLSA-N	429.286	1.823	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnc2c(Cl)cccn12	1796066605	VSHNGTJMGKXBSF-LMWOUKEDSA-N	441.315	1.445	50	20	IDGD	
CSc1cccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)c1O	1796191990	YCWGFJYPOOSSAJ-BJWYYQGGSA-N	440.330	1.360	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@]1(F)CCCCC1(F)F	1797212892	MCJZRMJDJCOBBI-QFRSUPTLSA-N	426.863	1.747	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc2ncccc12	1797320205	BXHCJDRHNZSFGI-MUJYYYPQSA-N	444.495	1.799	50	20	IDGD	
Cn1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)c2cccnc21	1798255386	RKTQDNWZARJCFZ-QDMKHBRRSA-N	447.499	1.137	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1noc3c1CCCC3)C2	1798440403	MRUSZSAELQCQQX-BTTYYORXSA-N	438.488	1.118	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)cc([N+](=O)[O-])c1)C2)[C@H](F)Br	1799348151	ARROQAGVTOREJP-DJBIQUGXSA-N	446.229	1.194	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Br)cc1	1799351800	BDQMNXORUKDPCG-OCVGTWLNSA-N	442.285	1.539	50	20	IDGD	
Cc1c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](O)CCl)C3)nc2ccc(Cl)cn12	1800086915	IBUDDCMNOBDCBU-DMVWFOPNSA-N	441.315	1.099	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1csc3c1CCCO3)C2	1800974875	GCIFQZCUOHUZPQ-VZAMPYOESA-N	428.938	1.530	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(C)c(C(=O)O)c(C)c1)C2	1800979662	UDDVVSMZWWPBFV-DFGXFYAUSA-N	438.908	1.459	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H]1[C@H]3c4ccccc4S[C@H]31)C2	1802337494	MSNRWVQYJZMUEJ-NEKOTWGDSA-N	442.585	1.886	50	20	IDGD	
COc1cc(C(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)ccc1O	1803142367	YZAZRDCFRRYSPZ-HHXXYDBFSA-N	433.892	1.715	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H]2C[C@H]2C2CC2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1	1807366009	RFPGTCXHNVPACL-VXSCBNMQSA-N	433.317	1.127	50	20	IDGD	
O=C(Cc1ccc2ncnn2c1)NC[C@@H]1CCN(C(=O)[C@H](F)Cl)[C@@H]1c1cccnc1	1807406803	AIJPOXZXFHCIBR-IPELMVKDSA-N	430.871	1.907	50	20	IDGD	
Cc1ccc(=O)n(C(C)(C)C(=O)N2CC[C@H](CNC(=O)[C@H](F)Cl)[C@@H]2c2cccnc2)n1	1808313598	IIVAONNAFBEQNF-NJAFHUGGSA-N	449.914	1.922	50	20	IDGD	
Cc1c[nH]cc1C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1808580570	NJXFTBFJJXSYJJ-WIYYLYMNSA-N	432.289	1.031	50	20	IDGD	
N=C(N)SCCC(=O)N1CC[C@H](CNC(=O)[C@@H](F)Br)[C@H]1c1cccnc1	1808661885	SILMAAPSZNCEGX-MRVWCRGKSA-N	446.346	1.795	50	20	IDGD	
Cc1noc(CC(=O)N2CC[C@H](CNC(=O)CO[Si](C)(C)C)[C@H]2c2cccnc2)n1	1810542828	ZZSFMDLSPXXUJK-OXQOHEQNSA-N	431.569	1.873	50	20	IDGD	
CN1CCN(CC(=O)N2CC[C@H](CNC(=O)CO[Si](C)(C)C)[C@@H]2c2cccnc2)CC1	1810546145	PFJNRVSJNFPBBV-KNQAVFIVSA-N	447.656	1.186	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2ccc(C(N)=O)cc2)[C@@H]1c1cccnc1	1813033961	XVPQUDAFJPASFK-GBESFXJTSA-N	444.919	1.754	50	20	IDGD	
O=C(CN1CCOCC1)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](F)Br)CC2	1814569242	XJLMYBFJBHYTEQ-RNCFNFMXSA-N	435.319	1.078	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1)c1cnn(-c2cccnc2)c1	1816206357	STCPAEGXADKLBS-DLBZAZTESA-N	443.895	1.896	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)CC[C@@H]2CCOC2)[nH]n1)c1ccc(B(O)O)cc1	1817475499	PPFARMUZOKPHLO-DNVCBOLYSA-N	440.309	1.212	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](O)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](F)Cl)n[nH]1	1818042293	XMQVCLQOUZQRLM-SCDSUCTJSA-N	433.868	1.779	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)Cn2ccncc2=O)n[nH]1	1821659268	YLWQNYKYFAKBDS-WCQYABFASA-N	437.298	1.442	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccccc2O)[nH]n1	1822413442	WKPUAUKSRNYOQK-INIZCTEOSA-N	428.493	1.794	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)[C@@H]1C[C@@]1(F)Cl	1822501264	KDSQZMIZRIXNME-RFUYNDQBSA-N	434.664	1.320	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCS(C)(=O)=O)n[nH]1	1822971943	CSMTYOWBOUKGEP-CMPLNLGQSA-N	435.344	1.620	50	20	IDGD	
CC(C)[C@@H](S)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1	1824537661	LTYDZJJWXAZEEL-VQTJNVASSA-N	432.395	1.554	50	20	IDGD	
Cc1onc(C(=O)N[C@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)c1C	1826082963	HACKFRYTPMRSMQ-LBPRGKRZSA-N	434.522	1.347	50	20	IDGD	
CN1CCN(CC(=O)N2CCCC[C@@H]2C2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1828442345	JUFGQIPPYVUUQZ-SJLPKXTDSA-N	447.393	1.544	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CN2C(=O)C=CC2=O)CC1	1830321776	ROXILNPLCFAYQB-FOIQADDNSA-N	444.359	1.767	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4ccccn4n3)C2)C1	1830361974	HWEQQIXWENCBDN-OAQYLSRUSA-N	434.924	1.669	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)C(=O)c3ccc(Cl)cc3)CCO2)C1	1830688200	QUMQJPKDENIBGL-OXJNMPFZSA-N	443.327	1.997	50	20	IDGD	
CC(C)=NO[C@@H](C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1	1831874894	XRCFBGXQOYFXGH-HKUYNNGSSA-N	437.585	1.780	50	20	IDGD	
O=C1NCCn2nc(C(=O)N3CCC([C@H]4CCCCN4C(=O)C(Cl)Cl)CC3)cc21	1831877890	FVAKWDXGSVFBIQ-CQSZACIVSA-N	442.347	1.664	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)CSc2nc[nH]n2)CC1	1832151733	FSILZNZKFBNFQV-HUUCEWRRSA-N	429.974	1.770	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)c1cccnc1S	1833080027	NFUMDDWMCBUVLS-INIZCTEOSA-N	426.970	1.155	50	20	IDGD	
CC(=O)NCC(C)(C)C(=O)N1CCC(N2CCC(NC(=O)C(C)(C)CCl)CC2)CC1	1833213431	PQZJNZIWMAIQQL-UHFFFAOYSA-N	443.032	1.985	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3ccc4n[nH]cc4c3)CC2)CC1)[C@@H](O)CCl	1833310970	ZSIKVXBHZYSNAG-IBGZPJMESA-N	433.940	1.348	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](CC)NC(N)=O)CC2)CC1	1833532613	ZGTCBTHLVCLWIA-DLBZAZTESA-N	429.993	1.412	50	20	IDGD	
Cc1nc(CC(=O)NC2CCN(C3CCN(C(=O)[C@@](C)(Cl)CCl)CC3)CC2)no1	1833810313	AQHPLWDJWKSDME-IBGZPJMESA-N	446.379	1.728	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccoc3C)CCO2)C1	1834143014	MFJPFEVXUOQZEB-QAPCUYQASA-N	429.311	1.832	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)Cc3ccccc3F)C2)C1	1834822417	MTTYYELAEHDTOW-IBGZPJMESA-N	443.313	1.610	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CCN3CCCCC3)CCO2)C1	1835135272	JZIORQSMNYAJOT-APWZRJJASA-N	446.386	1.102	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)NCCC#N)CCO2	1835674701	FCRPIMXXLVIOJL-OXQOHEQNSA-N	428.961	1.132	50	20	IDGD	
CC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)c3ccn(CCOC)n3)CC2)CC1	1836394327	SBVIPLGCHDNCSN-SFHVURJKSA-N	439.988	1.732	50	20	IDGD	
O=C(Cc1noc2ccccc12)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836716823	SEHAUDUSDSEEFC-LJQANCHMSA-N	449.935	1.969	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)c3cc(O)ncn3)CC2)CC1	1836941953	OKHBFYXJCRIQEP-GFCCVEGCSA-N	441.326	1.578	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cccs3)C2)C1	1837711884	VJPTYNQPSLLDNC-LJQANCHMSA-N	426.611	1.599	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)CC(F)(F)C(=O)O)CC2)CC1	1838079271	LBGKCSRDLXPSOF-AWEZNQCLSA-N	440.871	1.349	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3c[nH]c4ccccc34)CCO2)C1	1839071850	NTPAXQYJMAAOBK-XMSQKQJNSA-N	449.935	1.421	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)COc3ccc(O)cc3)C2)C1	1839141855	VHGNISAKESLPOM-PXNSSMCTSA-N	426.897	1.245	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3ccnc(OC)c3)C2)C1	1839142307	LQUXVKKPHXOIIC-LAUBAEHRSA-N	439.940	1.497	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C=C/c3ccco3)C2)C1	1839150397	LMXLIGQEQWVQGC-NYQZOWANSA-N	431.316	1.986	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccncc3F)C2)C1	1839152463	ABFAWKHMRBUQCX-QZTJIDSGSA-N	434.295	1.527	50	20	IDGD	
Cc1cc(C)nc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)c1	1839199913	ZLJWZFCYACQCNO-YJBOKZPZSA-N	444.301	1.459	50	20	IDGD	
O=C([C@@H]1[C@@H]2C=CS[C@@H]12)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839202357	CGSABOQOMMNEHW-ZWEPEPIOSA-N	435.315	1.008	50	20	IDGD	
O=C(c1cc(F)c(F)cc1F)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1839288717	JRCMELQSPSMQJR-QGZVFWFLSA-N	441.233	1.978	50	20	IDGD	
C=CCC(CC=C)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)Br)CCO2	1840030492	NYIOGMWKIMZOQG-KXBFYZLASA-N	429.355	1.995	50	20	IDGD	
Cc1cc(F)ccc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2	1840036018	CIMSQONSFGOMHB-KUHUBIRLSA-N	443.313	1.988	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(F)c3C)C2)C1	1840149200	HSHNGKIGSIJKHP-OXJNMPFZSA-N	428.888	1.458	50	20	IDGD	
O=C(c1cccc2c[nH]nc12)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840187592	LPFHASPHZCHZPW-SFHVURJKSA-N	427.288	1.437	50	20	IDGD	
O=C(C(Cl)Cl)N1CCO[C@@]2(COCCN(C(=O)C(F)(F)c3ccco3)C2)C1	1840189765	KXVVIEFLAJIBEG-HNNXBMFYSA-N	427.231	1.632	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)c1cccs1)CCO2	1840378137	IEWZMEMMJVDHKU-YZVOILCLSA-N	430.954	1.562	50	20	IDGD	
Cc1ccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@](C)(Cl)CCl)C3)C2)o1	1840508828	IQWDVTJVZSASIH-MOPGFXCFSA-N	433.332	1.823	50	20	IDGD	
O=C(CCn1c(=O)oc2ccccc21)N1CC2(CCCN2C(=O)CCBr)C1	1842637523	ZJAKIDFGRYOPOK-UHFFFAOYSA-N	436.306	1.973	50	20	IDGD	
O=C([C@H](F)Br)N1CC2(CCCN2C(=O)CCS(=O)(=O)c2ccccc2)C1	1842744730	UCWFYISEQVQDQC-HNNXBMFYSA-N	447.326	1.744	50	20	IDGD	
O=C(c1c(Cl)cncc1Cl)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843012982	WOYYYFQFTOYEDS-UHFFFAOYSA-N	434.088	1.199	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@H](C)NC(=O)c2ccc(F)cc2)C1	1845004551	RKZUSIMKIOARKI-CJNGLKHVSA-N	425.888	1.401	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)cc1	14843634	BOFVDEKIMLROAV-UHFFFAOYSA-N	439.384	1.381	50	20	IDGD	
Cc1ccc(-n2nnnc2SCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1C	15522039	DICOURBEJJIHTE-UHFFFAOYSA-N	427.446	1.741	50	20	IDGD	
C[C@@H]1CC(C)(C)C[C@@]2(C1)NC(=O)N(CC(=O)NNC(=O)c1ccc3c(c1)OCO3)C2=O	22929419	LWSJTQFFTZOCLV-XUSGNXJCSA-N	430.461	1.313	50	20	IDGD	
CC1CCN([C@@H](CNC(=O)NNC(=O)CNC(=O)c2ccco2)c2ccccc2)CC1	726236805	MSASZYIPAPPGJD-SFHVURJKSA-N	427.505	1.813	50	20	IDGD	
COc1cccc2c1OCC[C@H]2NC(=O)NNc1ccc(S(=O)(=O)NC(C)C)cn1	726273424	DKKFXXNFLYQELS-OAHLLOKOSA-N	435.506	1.927	50	20	IDGD	
O=C(NNc1nc(-c2ccncc2)no1)c1ccc2c(c1)C(=O)N(C[C@@H]1CCCO1)C2=O	726377162	MQEDILYCRIHGHZ-AWEZNQCLSA-N	434.412	1.664	50	20	IDGD	
COc1ccc(CN2C[C@H](C(=O)NNC(=O)Cc3nc4ccccc4n3C)CC2=O)cc1	726523811	ZOFROZQBEBBZLR-MRXNPFEDSA-N	435.484	1.321	50	20	IDGD	
COc1ccc(CCN2C[C@H](C(=O)NNC(=S)NCC3CCC3)CC2=O)cc1OC	727866847	CFCXQXVRPRIZRM-MRXNPFEDSA-N	434.562	1.390	50	20	IDGD	
C[C@H](C(=O)NNC(=O)c1cc(F)ccc1Br)N1C(=O)[C@H]2CCCC[C@H]2C1=O	728550877	LXDUPGFRDDJDSE-JLLWLGSASA-N	440.269	1.913	50	20	IDGD	
Cc1nc(CSc2ccc(C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)cc2)cs1	729276024	VQUFZTGQFITJQD-SNVBAGLBSA-N	428.561	1.443	50	20	IDGD	
CNS(=O)(=O)Cc1ccc(CNC(=O)NNC(=O)Cn2ccc3ccccc32)cc1	729494471	SSNSXDKAVFLUBX-UHFFFAOYSA-N	429.502	1.221	50	20	IDGD	
COc1ccc(C(C)(C)CNC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1OC	730021206	AQYQABKBWDHEEB-UHFFFAOYSA-N	439.476	1.601	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)N[C@H](C)C(=O)N2CCS(=O)(=O)CC2)c(C)n1CCC(C)C	731477583	XVBHJGOWWVBZQB-VJOZSWGJSA-N	448.589	1.820	50	20	IDGD	
CCN1CCN(S(=O)(=O)c2ccc(Cl)c(C(=O)NNC(=O)C3CCC3)c2)CC1	732142107	SMRNASWHKUZBBJ-UHFFFAOYSA-N	428.942	1.227	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)[C@@H]1C[C@@H](O)CN1C(=O)OCc1ccccc1	732302402	YJSYAXBDTTUKRQ-WBVHZDCISA-N	433.486	1.305	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)NCCN/C(O)=C2\N=CC=CC2=O)c1	732466571	PJPNEMIAIBCZAW-FMQUCBEESA-N	429.477	1.354	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)C1CCN(C(=O)c2cccc3ccccc23)CC1	732645141	NLYROOQXXSHVPI-QGZVFWFLSA-N	443.525	1.274	50	20	IDGD	
COC(=O)c1cc(OC(=O)CN2C(=O)N[C@](C)(c3ccc(F)cc3)C2=O)ccc1[N+](=O)[O-]	732652930	WUJNZCVWURNFGF-HXUWFJFHSA-N	445.359	1.893	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCC2CCSCC2)c1	733656633	BOLDRSPODPYGBW-UHFFFAOYSA-N	428.580	1.804	50	20	IDGD	
CN(C)CC[C@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)C(C)(C)C	734953198	KUUHDXZWTWXEPI-INIZCTEOSA-N	427.571	1.247	50	20	IDGD	
C[C@@H]1CCC[C@H](OCC(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)C1	735118223	NLFIMCXRQCNUKS-CVEARBPZSA-N	425.555	1.056	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H]2CCN(CC3CC3)C2)c1	739035309	MKIXAOGXBCTBGX-KRWDZBQOSA-N	437.566	1.145	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)c1cc(S(=O)(=O)N(CC)CC)ccc1Cl	740852605	FCZWOIINQRXEFE-UHFFFAOYSA-N	446.957	1.436	50	20	IDGD	
CC(C)CNC(=O)N1CCC[C@@H](CC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)C1	741186535	JCLZHZJXYBEXLX-KRWDZBQOSA-N	445.568	1.308	50	20	IDGD	
CCS(=O)(=O)NCc1ccc(C(=O)NNC(=O)c2cc(Br)c[nH]2)cc1	741661374	DXJLUNBVQNMKBT-UHFFFAOYSA-N	429.296	1.291	50	20	IDGD	
NC(=O)[C@@H]1CC(C(=O)NNC(=O)NCc2cccc(C(F)(F)F)c2)=NN1c1ccccc1	742453132	DXITXNIJBOKGTA-INIZCTEOSA-N	448.405	1.656	50	20	IDGD	
CCS(=O)(=O)N1CCC(NC(=O)NNC(=O)Nc2ccc(OC(F)F)cc2)CC1	743529929	BNAQCDWGGDQVKA-UHFFFAOYSA-N	435.453	1.438	50	20	IDGD	
C[C@@H](Oc1ccc(F)c(F)c1)C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	743737941	LTBGQVVMZWXFSV-LLVKDONJSA-N	427.429	1.444	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)NCCCOC2CCOCC2)c2ccccc2c1=O	745845422	OQCJKTQAXUBVDI-UHFFFAOYSA-N	431.493	1.507	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2ccc(N3CCCS3(=O)=O)cc2)cc(OC)c1OC	746076125	LSBRXJLFLXFSCZ-UHFFFAOYSA-N	449.485	1.327	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)[C@@]1(O)CCN(Cc2ccccc2)C1	746200892	QJOLUFUSPLUFGH-OAQYLSRUSA-N	430.530	1.207	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)C[C@@H]2C(=O)Nc3ccccc32)cc1OC	746615580	NWEWOWBUIFVKGK-AWEZNQCLSA-N	427.413	1.134	50	20	IDGD	
COc1ccc(-c2nnc(S)n2CC(=O)NNC(=O)Cc2cn3ccccc3n2)cc1	746638077	XAIXEPLATYTHTI-UHFFFAOYSA-N	437.485	1.280	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2ccc(C#N)cc2)cc(Br)cc1S(N)(=O)=O	747370279	BPQNTAFPOZMLJM-UHFFFAOYSA-N	437.275	1.351	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)N2CCC([C@]3(C)NC(=O)NC3=O)CC2)c1C	748376042	RKFPLRFOMPXZFD-SJAXDAAESA-N	427.505	1.495	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)N[C@@H]1CCN(c2ccc(C(F)(F)F)cc2)C1=O	748635890	SPIKHEDSPJYINQ-SMDDNHRTSA-N	432.399	1.193	50	20	IDGD	
CCOC(=O)N1CCN(S(=O)(=O)NNC(=O)c2cc3c(s2)CC[C@H](C)C3)CC1	748673983	IVUHDLAQQVJXEV-LBPRGKRZSA-N	430.552	1.126	50	20	IDGD	
CCCCN1CCC(NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)CC1	749212727	PQPOLOCZAAJIML-UHFFFAOYSA-N	430.597	1.794	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)N[C@@H]2CCC[C@@H]([S@@](=O)CC)C2)nc1	750670882	OVMLULCXBADCKQ-TXUMCGTDSA-N	445.611	1.818	50	20	IDGD	
C[C@@H](CC(=O)OCc1ccccc1)NC(=O)NNC(=O)c1csc(N2CCOCC2)n1	753001262	UXLCPBXRHOECII-AWEZNQCLSA-N	447.517	1.446	50	20	IDGD	
Cc1noc(C2CCC(NC(=O)NNc3ccc(S(=O)(=O)NC(C)C)cn3)CC2)n1	753359833	PUHBCODCMHIPGQ-UHFFFAOYSA-N	437.526	1.812	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)NC2CCN(S(=O)(=O)C3CC3)CC2)c2ccccc2n1	753964799	BVLWHFWAIFVAOL-UHFFFAOYSA-N	431.518	1.444	50	20	IDGD	
N#Cc1cc(Br)cc(S(=O)(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c1	754254583	BPIPYOSEUKWPRL-UHFFFAOYSA-N	425.220	1.852	50	20	IDGD	
CCc1nn(C)c(CC)c1CNC(=O)NNC(=O)c1sc(N2CCOCC2)nc1C	754839086	URAVGMUSNUKHQO-UHFFFAOYSA-N	435.554	1.291	50	20	IDGD	
Cc1ccccc1-n1nc(C(C)(C)C)cc1NC(=O)NNC(=O)[C@H](C)NS(C)(=O)=O	755760888	HFPUHDVRVGXQHT-ZDUSSCGKSA-N	436.538	1.569	50	20	IDGD	
C=CCN(C)S(=O)(=O)c1ccc(NC(=O)NNC(=O)COCc2ccccc2)cc1	755931639	HLKBYZQVVGMJJF-UHFFFAOYSA-N	432.502	1.863	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)Nc1ccc(CN2CCOC2=O)cc1	756093338	MDAXAZSIRLCBBW-UHFFFAOYSA-N	429.389	1.779	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)Nc2cccc(C(=O)NCCC(N)=O)c2)c1C	756392137	MBSZMIUATHXRIE-HNNXBMFYSA-N	441.488	1.529	50	20	IDGD	
Cc1nc(CC(C)C)c(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)s1	756548931	YNFPHUOAJOWKJE-INIZCTEOSA-N	433.486	1.794	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1-n1nnnc1C1CC1	757621060	MFKKVCVYTOCFFR-UHFFFAOYSA-N	438.404	1.923	50	20	IDGD	
CN(N=Cc1cn(Cc2cccnc2)nn1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758139174	SCMDHVVJYMXKFK-UHFFFAOYSA-N	428.497	1.660	50	20	IDGD	
CC(C)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCN(S(=O)(=O)CBr)CC1	758527465	LDTDJOPRJDCZED-GFCCVEGCSA-N	442.376	1.362	50	20	IDGD	
C[C@@H]1Cc2ccccc2N1C(=O)[C@H]1CCCC[C@@H]1C(=O)NNC(=O)C(=O)Nc1ccccn1	758835511	WSYHCQUKQOHABP-NJAFHUGGSA-N	449.511	1.952	50	20	IDGD	
O=C(NNC(=O)[C@]12CCC(=O)N1c1cc(Cl)ccc1S2)C(=O)Nc1ccccn1	758840382	NWNWSGBRGXJAQR-GOSISDBHSA-N	431.861	1.450	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(F)(F)[C@@H](C(=O)OCC(=O)NNC(=O)c2ccccc2)C1	759286472	BNPSPQKVZNRIHH-CQSZACIVSA-N	441.431	1.883	50	20	IDGD	
COC(=O)c1coc(C(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)c1	759408170	KJLRALNJJBZDOF-UHFFFAOYSA-N	446.423	1.843	50	20	IDGD	
COc1ccc(C[C@@H](C)C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)cc1	759660787	MNONDVKEVUMIFD-QGZVFWFLSA-N	446.573	1.953	50	20	IDGD	
CC(C)(C)C(=O)NNC(=O)C(=O)Nc1cc(Br)cnc1OCC(F)(F)F	761071407	GCWHJKLCMVPQAQ-UHFFFAOYSA-N	441.204	1.917	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)CCc1c(C)nc2cc(O)nn2c1C	762374486	WGSBZXHTKRLJRM-UHFFFAOYSA-N	429.502	1.933	50	20	IDGD	
O=C(NNC(=O)c1c[nH]c2ccccc12)C(=O)Nc1ccc2nc(N3CCOCC3)oc2c1	763539413	LNUIYDJWKHHETJ-UHFFFAOYSA-N	448.439	1.545	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2C[C@]23CCOC3)c1	763727304	BVCBBDQECSUNMA-KKSFZXQISA-N	445.497	1.684	50	20	IDGD	
CC(C)CCOc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1	763922697	ZRWASBIMIHXEJS-UHFFFAOYSA-N	437.460	1.487	50	20	IDGD	
CN1CCOc2ccc(NC(=O)C(=O)NNC(=O)c3ccc(Br)s3)cc21	763941470	XYMOGCOXKRWBMY-UHFFFAOYSA-N	439.291	1.739	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)Nc1cc(C2CCCC2)nn1C	764002386	LUUMLPZYWKWGSY-UHFFFAOYSA-N	437.298	1.578	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2cc(Br)cn2C)cc1[N+](=O)[O-]	764004672	KZVFGSNCISCHBK-UHFFFAOYSA-N	440.210	1.104	50	20	IDGD	
COc1cc(Br)c(NC(=O)C(=O)NNC(=O)Cc2ccsc2)cc1OC	764034452	PQIDSORAQWOARI-UHFFFAOYSA-N	442.291	1.856	50	20	IDGD	
Cn1cc(Br)cc(NC(=O)C(=O)NNC(=O)c2cccc3ccccc23)c1=O	764048480	MYOKOLIQHZLDBT-UHFFFAOYSA-N	443.257	1.701	50	20	IDGD	
O=C(CC(F)(F)F)NNC(=O)C(=O)Nc1ccccc1-n1cc(Br)cn1	764115590	TWTGYADCEVMHBF-UHFFFAOYSA-N	434.172	1.673	50	20	IDGD	
CN(Cc1ccccc1)S(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)CC2CC2)cc1	764144021	ZUCWWMCEOFHCDN-UHFFFAOYSA-N	444.513	1.393	50	20	IDGD	
COC(=O)c1ccc(N2CCCC2)c(NC(=O)C(=O)NNC(=O)c2ccc(C#N)cc2)c1	764177275	NDVKJQHBHUDUBX-UHFFFAOYSA-N	435.440	1.345	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)C(=O)Nc1ccc(N2CCCC2=O)c(F)c1	764239227	HLEPACYNCQMRFW-UHFFFAOYSA-N	437.431	1.693	50	20	IDGD	
CCOC(=O)c1c(C)csc1NC(=O)C(=O)NNC(=O)Cn1ccc2ccccc21	764245244	OAVURWPUICAAFG-UHFFFAOYSA-N	428.470	1.974	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)COCc3ccccc3)cc2)C[C@@H](C)O1	764363132	KXUSHEPQRTZWJC-CALCHBBNSA-N	440.500	1.603	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccc(OC)cc2)c1)N(C)C	764396968	SBZJPJXUYNAZPG-GOSISDBHSA-N	434.518	1.597	50	20	IDGD	
N#Cc1ccc(Oc2ccc(NC(=O)C(=O)NNC(=O)[C@@H]3COCCO3)cc2Cl)cc1	764423510	AZTOPHLXVNCHEF-KRWDZBQOSA-N	444.831	1.505	50	20	IDGD	
CCc1ccc(S(=O)(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)cc1	765124619	CFKRLSAHZAPOGM-UHFFFAOYSA-N	430.574	1.685	50	20	IDGD	
O=C(CC/N=C1/NS(=O)(=O)c2ccccc21)NNC(=O)c1cc(-c2cccs2)[nH]n1	765571616	LIBDTERWCPDIAY-UHFFFAOYSA-N	444.498	1.028	50	20	IDGD	
CC(C)(Oc1ccc(C#N)cc1)C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	766651007	LJNRUDZJRKPEQA-UHFFFAOYSA-N	449.511	1.321	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)c2cccc(-c3nc[nH]n3)c2)cc1	767189801	PXZSWVIIWJFWBL-UHFFFAOYSA-N	434.485	1.967	50	20	IDGD	
COc1ccc2c(c1)[C@@H](NC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)CCO2	767941962	TXXDOEYHUAFMRI-INIZCTEOSA-N	434.474	1.958	50	20	IDGD	
O=C(Cn1cc(C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)cn1)NC1CCCCC1	768260806	OMINNJDLHKDSST-UHFFFAOYSA-N	441.517	1.858	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)Nc1ccccc1C(=O)N1CCOCC1	769223959	VJALSAHEXXPJTG-UHFFFAOYSA-N	448.501	1.720	50	20	IDGD	
CC(=O)c1cccc(OCc2cc(C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)no2)c1	770597149	AXPXOGXZYJJWIP-UHFFFAOYSA-N	447.411	1.507	50	20	IDGD	
C[C@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)NNc2ccnc(Br)c2)C1=O	771548918	COKQVUPKLISJCU-QGZVFWFLSA-N	436.241	1.894	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N=c2cc[nH]c(C)c2Cl)c1	771767985	YWABZFBTDQKFCI-UHFFFAOYSA-N	439.925	1.962	50	20	IDGD	
C[C@@H]1CN(c2ccc(C(=O)NNC(=O)C(=O)NCc3ccc(Cl)cc3)cn2)C[C@@H](C)O1	772194849	DOMXRZOFFRYHOC-ZIAGYGMSSA-N	445.907	1.426	50	20	IDGD	
CC(C)[C@@H](C(=O)NNC(=O)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1)N1C[C@H](C)O[C@H](C)C1	773417832	IHKDGZMVEGBKSJ-XDNAFOTISA-N	440.585	1.915	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2cccc(F)c2I)n1	773730585	GZSLMVDRKWWJLJ-UHFFFAOYSA-N	431.165	1.311	50	20	IDGD	
N#C/C(=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)NNc1cnccn1	775280663	JZJJLXXQIVUFCP-NTEUORMPSA-N	436.863	1.919	50	20	IDGD	
O=C(c1cccc(N2CCCC2=O)c1)N1CCN(S(=O)(=O)CBr)CC1	777777961	USJIPHSMGYRXST-UHFFFAOYSA-N	430.324	1.253	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)c1cc([N+](=O)[O-])c2nsnc2c1	778226359	QEKAZBVNIUXCIM-UHFFFAOYSA-N	425.430	1.973	50	20	IDGD	
COc1ccc(Cn2cc(C(=O)NNC(=O)c3nnc(O)c4ccccc34)cn2)cc1OC	778296465	XIFZAMQQRACCAC-UHFFFAOYSA-N	448.439	1.672	50	20	IDGD	
COc1ccc2nc(NNC(=O)[C@H]3CC(=O)N([C@@H]4CCS(=O)(=O)C4)C3)c(C)cc2c1	778482364	XQSPWQVERNTCQB-LSDHHAIUSA-N	432.502	1.031	50	20	IDGD	
COc1ccc(Cn2ccc(NC(=O)C(=O)NNC(=O)c3ccc(Cl)cc3O)n2)cc1	778713683	PTFLDDSIYPYNNQ-UHFFFAOYSA-N	443.847	1.699	50	20	IDGD	
CC(C)c1ccc(S(=O)(=O)c2ccc(NNC(=O)Cn3ncn(C)c3=O)cc2)cc1	779337846	JTZHNYUXMBCINQ-UHFFFAOYSA-N	429.502	1.681	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@@H]2CC(c3ccccc3[N+](=O)[O-])=NO2)cc(OC)c1OC	781555492	BYMSVYCTCXDBEG-KRWDZBQOSA-N	444.400	1.575	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cnn(C)c3C(F)(F)F)n[nH]2)cc1	782123712	JFOGMJILWCCZKP-UHFFFAOYSA-N	449.393	1.791	50	20	IDGD	
CN(C)CC1CCN(c2ccc(NC(=O)C(=O)NNc3ncncc3Cl)cc2)CC1	782165043	BGIGRNBFKKSOKR-UHFFFAOYSA-N	431.928	1.990	50	20	IDGD	
CN1CCN(C(=O)c2ccccc2NC(=O)C(=O)NNc2nc3ccccc3s2)CC1	782813688	YRUHGSMMFXSYCP-UHFFFAOYSA-N	438.513	1.766	50	20	IDGD	
Cc1cc(S(N)(=O)=O)cc(NC(=O)C(=O)NNc2ncccc2C(F)(F)F)c1C	783121009	CFWCUTSBXMNOCF-UHFFFAOYSA-N	431.396	1.446	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2ccc(C(=O)Nc3ccccc3)cc2)CCS(=O)(=O)C1	783425726	DBOPSUPBMBMCRC-HXUWFJFHSA-N	430.486	1.075	50	20	IDGD	
C[C@@H](Oc1ccccc1NC(=O)C(=O)NN[C@@]1(C)CCS(=O)(=O)C1)c1ccccc1	783426006	LANKPRXJHMUGLW-VFNWGFHPSA-N	431.514	1.963	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2cc(Cl)ccc2OC[C@@H]2CCCO2)CCS(=O)(=O)C1	783427615	PFRJVSSPAPAZHZ-SCLBCKFNSA-N	445.925	1.034	50	20	IDGD	
CNS(=O)(=O)CCNC(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccc(Cl)cc1	784703820	DBHOJQIZBLMTOA-RVDMUPIBSA-N	446.920	1.690	50	20	IDGD	
N#CCOc1cc(F)ccc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)C(F)F)cc1	784834241	YSKSLUROPBHBQX-UHFFFAOYSA-N	442.375	1.806	50	20	IDGD	
Cc1cc2ccccc2nc1NNC(=O)C(=O)Nc1ccc(CN2C(=O)CNC2=O)cc1	785155030	YQFWIWUXETXBRM-UHFFFAOYSA-N	432.440	1.677	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2ccc3nc4n(c(=O)c3c2)CCC4)n1	785225962	ARWWNKNBOALWAU-UHFFFAOYSA-N	436.476	1.061	50	20	IDGD	
CN(C)CCS(=O)(=O)c1ccccc1C(=O)NNc1nnc(-c2ccccn2)s1	788566840	MUEGTOWSJXWIDF-UHFFFAOYSA-N	432.531	1.692	50	20	IDGD	
Cc1ccc2nc(C=NNC(=O)c3cccc(S(=O)(=O)N4CCOCC4)c3)cn2c1	788938867	FIDSCGVTNDBNBP-UHFFFAOYSA-N	427.486	1.428	50	20	IDGD	
CS(=O)(=O)CC[C@H](C(=O)NNC(=O)c1cnn(-c2ccccc2)c1)c1ccccc1	789951028	XMXIUUBICOBNNN-IBGZPJMESA-N	426.498	1.852	50	20	IDGD	
COc1cc(NNC(=O)[C@H](C)NS(=O)(=O)c2ccc(C(N)=O)cc2)ccc1Cl	790179843	HEFQAAZXCKWANJ-JTQLQIEISA-N	426.882	1.258	50	20	IDGD	
CCCn1nc(C(=O)NNS(=O)(=O)c2ccc(OC)cc2F)c2ccccc2c1=O	790387871	VNUYCJFPGIOHTC-UHFFFAOYSA-N	434.449	1.578	50	20	IDGD	
COc1cc(Cl)c(S(=O)(=O)NNC(=O)NCCc2cccs2)cc1C(=O)O	790391416	JZYLAQDUKKQYTQ-UHFFFAOYSA-N	433.895	1.844	50	20	IDGD	
CSc1nnnn1-c1cccc(NC(=O)C(=O)NNc2ccc3c(=O)[nH]ccc3c2)c1	793066046	QLXCVCPNGDKRCH-UHFFFAOYSA-N	436.457	1.308	50	20	IDGD	
Cc1cnn(C)c1S(=O)(=O)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1	795305935	QWYPRQMDBJSJFA-FQEVSTJZSA-N	439.541	1.665	50	20	IDGD	
C[C@H](C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1)[C@H]1OCCc2sccc21	796495643	RCYCKHVVVTVUOH-XGINMYPSSA-N	446.481	1.529	50	20	IDGD	
CC(C)Oc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccc(Cl)cc2)cc1C(N)=O	796999426	LETZFXOSCCIYDC-UHFFFAOYSA-N	432.864	1.555	50	20	IDGD	
O=C(NNC(=O)c1cnnn1-c1c(Cl)cccc1Cl)c1ccc(-n2cnnn2)cc1	797701818	GJEMNDZZLOLZAG-UHFFFAOYSA-N	444.242	1.625	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CNC(=O)c2cc(-c3ccccc3)on2)cc1C	798308432	ZKWCNGKRQIPLEG-UHFFFAOYSA-N	435.440	1.474	50	20	IDGD	
CCn1ncc2cc(C(=O)NNC(=O)c3ccc(Cl)c(S(N)(=O)=O)c3)c(C)nc21	799408834	ZTWBHDWFYUQMND-UHFFFAOYSA-N	436.881	1.135	50	20	IDGD	
CN(C)c1cccc(CCC(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1	801876940	SKNVXQFKLGWMQD-IBGZPJMESA-N	427.457	1.216	50	20	IDGD	
COc1ccc(S(N)(=O)=O)c(OC)c1C(=O)NNC(=O)Nc1cc(F)cc(F)c1	802001196	YWYNYTVEAOMLET-UHFFFAOYSA-N	430.389	1.096	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@@H]2CC(c3c(F)cccc3F)=NO2)cc1	803397516	WYIFHDLDRHIWJA-HNNXBMFYSA-N	438.412	1.714	50	20	IDGD	
CCN(CC)CC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)Cc2ccc(F)cc2)c1	806975472	AAPCSAHBMTUBPM-UHFFFAOYSA-N	443.479	1.435	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)C(=O)Nc1ccc2nccnc2c1Br	806979128	MZJNAZODNJTQOP-UHFFFAOYSA-N	429.234	1.116	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccoc2CC(=O)OC)c1	809957792	YYNLVYCCVHQAPK-UHFFFAOYSA-N	437.474	1.100	50	20	IDGD	
NC(=O)c1ccc(NC(=O)NNC(=O)COc2ccc(F)cc2)c(OCC(F)F)c1	810301481	BDSZJJRYHXDPHW-UHFFFAOYSA-N	426.351	1.800	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(C(=O)NNC(=S)Nc2ccccc2OC)cc1	811257369	CTILZTRLZAUODI-UHFFFAOYSA-N	438.531	1.251	50	20	IDGD	
Nc1cc(Cl)cc(Cl)c1C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	811322375	ULVLMVKZNZGYEC-CQSZACIVSA-N	440.239	1.720	50	20	IDGD	
CN(C)c1ncc(C=NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)n1C	811631260	RELUSZRLUPMKSJ-UHFFFAOYSA-N	440.529	1.729	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ncn(C3CCCCC3)n2)cc1	813033565	ZMHIJEPJTYEAET-UHFFFAOYSA-N	435.510	1.115	50	20	IDGD	
Cc1cccc(Oc2ccccc2NC(=O)C(=O)NNC(=O)[C@@H]2CCc3nncn3C2)c1	815692486	RVTIROGLNGHUCS-OAHLLOKOSA-N	434.456	1.727	50	20	IDGD	
O=C(COC(=O)c1ccc(=O)n(Cc2ccccc2)n1)NNC(=O)c1ccc(Cl)cc1	847194883	JMECUHKMERUQQK-UHFFFAOYSA-N	440.843	1.563	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)NCCC(=O)NN=c2sc3ccccc3n2C)cc1	855569940	PZZXPLRXWOVPKF-UHFFFAOYSA-N	432.527	1.743	50	20	IDGD	
O=C(COc1ccccc1F)NN=Cc1c(N2CCOCC2)nc2ccccn2c1=O	864236995	GFZWWHRSAKGQKG-UHFFFAOYSA-N	425.420	1.199	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H]2CC(=O)N(Cc3ccccc3Cl)C2)c1	915077447	REESKDCMJCXKDT-HNNXBMFYSA-N	449.916	1.553	50	20	IDGD	
CN(C)N(C(=O)C1CCN(c2oc(-c3ccco3)nc2C#N)CC1)[C@H]1CCS(=O)(=O)C1	915141413	QDIHAZQEVDKVQH-HNNXBMFYSA-N	447.517	1.515	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)CN1C(=O)N[C@]2(CCCC[C@@H]2C)C1=O	915775812	PHMJQUQLOLXUIW-FPTDNZKUSA-N	440.504	1.247	50	20	IDGD	
NS(=O)(=O)c1ccc(CCNC(=O)NNC(=O)Cc2ccc3ccccc3c2)cc1	915884032	PBDSQGUTRMNGIN-UHFFFAOYSA-N	426.498	1.603	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NC[C@H]1CN(Cc2ccccc2)CCO1	915894108	HWMIDMIQGXZITC-JXFKEZNVSA-N	430.480	1.824	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NC[C@@H](c2cccs2)N(C)C)nc1	915897778	KUEYVWNBLMSBDA-AWEZNQCLSA-N	426.568	1.759	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)NCc1ccccc1CN1CCOCC1	915927674	QYKDWBMVQXSOCT-UHFFFAOYSA-N	443.460	1.336	50	20	IDGD	
COc1ccc(COCC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1	916090990	FLFSFTWSNYDYEN-UHFFFAOYSA-N	426.517	1.572	50	20	IDGD	
COc1ccc(C=NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)c(OC)c1OC	916335571	YTUQCHDMQGZWBG-UHFFFAOYSA-N	427.866	1.777	50	20	IDGD	
O=C(CCSc1ccc(F)cc1)NNC(=O)NC[C@]1(N2CCOCC2)CCSC1	916636698	JZXFAOIWVQTXBV-LJQANCHMSA-N	442.582	1.846	50	20	IDGD	
CCNS(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)c2ccc(OC)c(OC)c2)c1	917906293	PWOWMZYJZBGKSI-UHFFFAOYSA-N	425.438	1.216	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCc2cccc(Cn3cccn3)c2)nc1	918132893	IZUZLVXJFAEYRK-UHFFFAOYSA-N	443.533	1.839	50	20	IDGD	
CC(=O)Nc1cc(C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)ccc1F	919689627	AGMLUELBGPNCQT-UHFFFAOYSA-N	436.465	1.174	50	20	IDGD	
CNS(=O)(=O)c1ccc([C@@H](C)NC(=O)NNC(=O)Cc2c[nH]c3ccccc23)cc1	919778486	CVVLMQKBLNCXJR-CYBMUJFWSA-N	429.502	1.710	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCCN2CCc3sccc3C2)nc1	919784079	ATDPGZUVDRWBNZ-UHFFFAOYSA-N	438.579	1.514	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCCC2)cc1	919822037	NSJQUIGHKPUQLM-UHFFFAOYSA-N	431.514	1.874	50	20	IDGD	
O=C(NNC(=O)c1ccc(-c2ccc3c(c2)OCCO3)s1)N[C@@H]1CCS(=O)(=O)C1	919883077	AJXCISLENMZHLP-GFCCVEGCSA-N	437.499	1.317	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)Nc2cc(-n3cnnn3)ccc2C)cc1	919896727	CCOXDRUEPGKUTH-CQSZACIVSA-N	425.449	1.990	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@H]2CCc3cc(C)ccc32)cc1	919920186	MGWIFQGLICRBMX-IBGZPJMESA-N	430.530	1.942	50	20	IDGD	
O=C(COc1ccc(Cl)cc1)NNC(=O)Nc1ccc(CN2C(=O)CNC2=O)cc1	920931143	DAZXHFFELJUMSY-UHFFFAOYSA-N	431.836	1.624	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1)C(=O)N1CCCC[C@H]1C	1339212063	IOIZXLJKOHMOGL-CABCVRRESA-N	439.557	1.753	50	20	IDGD	
CN(CC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Cl)C1)C(=O)OC(C)(C)C	1778023299	WVVVFGWGXLYAND-ZXYWRSMDSA-N	435.924	1.902	50	20	IDGD	
CCC[C@@H](C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2)n1cccc1	1778041337	CRHBZEMJXGERCJ-LXGFNABISA-N	425.957	1.943	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2)c1cc(C(F)(F)F)c[nH]1	1778186050	NHBCTXCNDLALSP-JJRVBVJISA-N	437.846	1.761	50	20	IDGD	
CC(C)Cc1cc(C(=O)N2CCO[C@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)n(C)n1	1779296345	PGSZWGWRYRVLIJ-NRFANRHFSA-N	436.629	1.914	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@]2(C1)CN(C(=O)c1n[nH]c3c(F)cccc13)CCO2	1779297114	RSZPWKAFOFPPFO-FQEVSTJZSA-N	434.544	1.997	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(C)cc3-n3nccn3)C2)C1	1780245553	RILSFOSBEJLCAY-LAUBAEHRSA-N	447.923	1.273	50	20	IDGD	
CC(C)CNC(=O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@](C)(Cl)CCl)C1	1780711386	AQBQRIHFSSNIEH-MDASCCDHSA-N	436.380	1.509	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)C/N=C/c1ccco1)C2)[C@H](F)Br	1780775010	TXUCSFDNHXTJDJ-SDJHHXBBSA-N	444.301	1.903	50	20	IDGD	
CCOc1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@](C)(Cl)CCl)C3)C2)nn1	1781230926	BEMCTCFHOMNWMW-QZTJIDSGSA-N	431.320	1.555	50	20	IDGD	
O=C(c1cc(Cl)cnc1O)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781325235	FMIRKELBAAYPNP-XHDPSFHLSA-N	436.665	1.575	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccnnc1O)C2	1781903590	XSZAVZISEPQPLV-HBUWYVDXSA-N	441.326	1.483	50	20	IDGD	
Cc1noc(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](C)Br)C2)n1	1781998509	ZQFHXVCYLPCVGM-XTQGRXLLSA-N	429.315	1.218	50	20	IDGD	
COc1cc2c(O)cccc2cc1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1782388030	XYRWSLCBYZSQQI-XMSQKQJNSA-N	448.903	1.597	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2)[C@H](O)c1ccccc1Cl	1782388915	NMLJYMIMDGKTRP-WOCWXWTJSA-N	445.343	1.487	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4nn[nH]c4c3)C2)C1	1782583312	FICDCNGHQRVEMT-FZKQIMNGSA-N	436.310	1.575	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H]2C[C@@]2(C(=O)N2CC[C@]3(CN(C(=O)[C@@H](F)Cl)CCO3)C2)C1	1783460295	XOGSMHWYXNIUKR-VPCNSNALSA-N	445.919	1.608	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](C)Nc1nccs1)CCO2	1783534998	UYAUYSIVDSWUIK-MQIPJXDCSA-N	431.356	1.557	50	20	IDGD	
CCOc1ccc(CC(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)cc1OC	1783699063	BCUBDPGUVFBWTB-HRAATJIYSA-N	440.924	1.066	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cc(-c4cccnc4)[nH]n3)CCO2)C1	1783877472	JEVOTKCOMOKNCM-FOIQADDNSA-N	433.896	1.169	50	20	IDGD	
C[C@H](CC(=O)N1CCO[C@@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1)c1ccccc1	1783937555	URUXETCABHESSU-WZONZLPQSA-N	430.549	1.383	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN(C)C(=O)c3ccccc3)[C@H]2C1	1784347409	SMAIKBWCIDMGRA-OKYOBFRVSA-N	435.952	1.756	50	20	IDGD	
CCOC(=O)C(C)(C)C(=O)N1CC[C@@]2(CN(C(=O)[C@@H](Br)CC)CCO2)C1	1785525160	KRHRZAVQFMZPSA-SCLBCKFNSA-N	433.343	1.579	50	20	IDGD	
Cn1c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]32)cccc1=O	1785871124	MYENSHVDQLKMJY-NGOJXBLDSA-N	430.332	1.215	50	20	IDGD	
COc1ncccc1C(=O)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1	1787358898	IEUBNLPRCHRCJB-UHFFFAOYSA-N	445.284	1.832	50	20	IDGD	
NC(=O)[C@@H](N)CCC(=O)Nc1ccc(C2(NC(=O)CCBr)CCC2)cc1	1788052195	DUEQWKJIDVNGTB-AWEZNQCLSA-N	425.327	1.498	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3C[C@H]3c3ccccc3)C[C@@H]21	1791293324	VOIYRUUBHVACHW-SXYSDOLCSA-N	442.560	1.143	50	20	IDGD	
CCOC(=O)C(C)(C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21	1792227372	JSEOPXLCTRYWDR-ZDEQEGDKSA-N	437.306	1.246	50	20	IDGD	
CO[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)CBr)c1ccccc1	1792868508	ZQGREFVPJZKRFP-JFMONLCZSA-N	439.350	1.995	50	20	IDGD	
Cc1nnc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@](C)(Cl)CCl)C3)s1	1794107756	PRUOZDAVNNKWHO-RBNVPPIJSA-N	435.377	1.605	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1c(F)ccnc1Cl	1794531620	SSYLYRYNTNKCKV-CLLJXQQHSA-N	425.892	1.499	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnn2ccncc12	1797061546	LFYDDQGTPMEODK-TYYYEBLRSA-N	426.304	1.169	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cn2cccnc2n1	1797388804	IXFXOKKZXSYPMH-XFMPKHEZSA-N	436.310	1.106	50	20	IDGD	
CCOC(=O)c1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)C(C)(C)CCl)C3)ccn1	1798684386	XSXQHYUQRYRLOL-SCAQPMJSSA-N	437.924	1.727	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1CCN(c3ccccn3)CC1)C2	1799269328	XNKXHSKPZOVHHC-DMUMMCEESA-N	434.968	1.905	50	20	IDGD	
CN(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cocn1)C2)NC(=O)NCc1ccccc1	1799864683	HCMOOGPZFQCGFJ-BCDXTJNWSA-N	440.504	1.273	50	20	IDGD	
CN(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H]1CCCO1)C2)NC(=O)NCc1ccccc1	1799869074	AQBPBZKFDAJEBC-IYWMVGAKSA-N	443.548	1.150	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(OC)n1)C2	1800638898	CEECWSHEZPOJSN-OQMKEHIESA-N	426.311	1.467	50	20	IDGD	
Cc1cnc2c(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@@H](C)Br)cnn2c1	1800759327	LRWJFLGWUSOREW-GUIRCDHDSA-N	436.310	1.024	50	20	IDGD	
C[C@H](NNc1ccccc1)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1	1802508311	AULDKWNGZADJQF-LWCVALJOSA-N	445.951	1.692	50	20	IDGD	
CC(C)(CCl)C(=O)NC[C@H]1CCN(C(=O)Cn2ccncc2=O)[C@H]1c1cccnc1	1802904732	NSMDSMIJXIATIM-APWZRJJASA-N	431.924	1.609	50	20	IDGD	
COCCOCC(=O)N1CC[C@H](CNC(=O)[C@@H](C)CBr)[C@@H]1c1cccnc1	1803007377	CAKBGUXDTWAACZ-LESCRADOSA-N	442.354	1.781	50	20	IDGD	
CC(=O)NC(C)(C)C(=O)NC[C@H]1CCN(C(=O)CO[Si](C)(C)C)[C@@H]1c1cccnc1	1803592875	WGATVPKOBMAWRQ-IEBWSBKVSA-N	434.613	1.854	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC2(CCCN(C(=O)[C@@H]3CCC(F)(F)C3)C2)CC1	1804769503	MSAKZGKROFOYEC-QGZVFWFLSA-N	434.292	1.647	50	20	IDGD	
CN[C@H](CC(=O)N1CCC2(CCCN(C(=O)[C@@H](C)CBr)C2)CC1)C(=O)O	1805384232	YOAIIGYQIKWOLE-UONOGXRCSA-N	432.359	1.311	50	20	IDGD	
O=C1CC[C@H](C(=O)N2CC[C@H](CNC(=O)CCBr)[C@@H]2c2cccnc2)CN1	1806338198	RTFOCEXSLWDBCB-VKJFTORMSA-N	437.338	1.399	50	20	IDGD	
Cn1ccc(CC(=O)N2CC[C@H](CNC(=O)[C@H](F)Br)[C@H]2c2cccnc2)n1	1808661249	HMIKUPPYTUCDKG-XYPHTWIQSA-N	438.301	1.754	50	20	IDGD	
Cc1cscc1C(=O)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1	1809978566	YABXVKHHWJLACO-UHFFFAOYSA-N	426.347	1.895	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)on1	1810300390	YDGHUJCXMYBISS-KXBFYZLASA-N	449.471	1.010	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H](CNC(=O)c2cc[n+]([O-])cc2)[C@@H]1c1cccnc1	1811193968	QIZLFRWYVLKNIV-QUCCMNQESA-N	428.565	1.886	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)CCc2ccoc2)[C@H]1c1cccnc1	1813074046	NYEMYLZUTYVCSW-XXBNENTESA-N	441.532	1.686	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)[C@@H]2C[C@H]3CC[C@@H]2O3)[C@H]1c1cccnc1	1813074401	QPQNRVAHVNLMHB-TZDBLYRBSA-N	443.548	1.028	50	20	IDGD	
C[C@H](C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1)n1cccc1	1813315862	QDCOOFXGOWPAPL-ZWCUEREDSA-N	440.548	1.523	50	20	IDGD	
CC(C)C1(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)CCC1	1813664591	JRRCAXITLGJPTD-RBBKRZOGSA-N	449.360	1.907	50	20	IDGD	
CCOC(=O)c1cc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)[C@H](O)CCl)n[nH]2)ccn1	1814873534	PCVGFAOYJFJSBT-HZPDHXFCSA-N	449.895	1.887	50	20	IDGD	
CC(C)=CCCC(=O)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1	1815359962	GXWAXTNNCBIHOD-INIZCTEOSA-N	427.335	1.795	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@H](F)Br)CC2)c1nc[nH]c1[N+](=O)[O-]	1817203210	RWXDFHBYPLJGEC-ANLVUFKYSA-N	447.246	1.691	50	20	IDGD	
CN[C@H](CC(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](C)Br)[nH]n1)C(=O)O	1817368304	IBFPZGNRYISCBW-YUSALJHKSA-N	430.303	1.248	50	20	IDGD	
C[Si](C)(C)OCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)CSc1nc[nH]n1)CC2	1820169514	XCOFACVOLXFWLV-SNVBAGLBSA-N	440.627	1.817	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3cc4cccnn4n3)sc2C1	1821168473	MYSLMWCMSHGAJT-JQWIXIFHSA-N	434.909	1.665	50	20	IDGD	
CC[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H]1CNC(=O)O1)CC2	1825441529	ZMEGRIYNQGWPCG-XKSSXDPKSA-N	431.312	1.337	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)CNC(=O)OC(C)(C)C)sc2C1	1825509616	NFPQBGKFAMAUGL-MNOVXSKESA-N	446.957	1.834	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)c2ccns2)CC1	1825676454	ONCRNFSQHBGVKW-GOSISDBHSA-N	427.335	1.370	50	20	IDGD	
Cc1cc(C(=O)N[C@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)cn1C	1826085893	FENIQVZBLMXNFT-AWEZNQCLSA-N	432.550	1.389	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCC([C@H]2CCCCN2C(=O)CC[C@@H](N)C(N)=O)CC1	1826935456	QGGIZAIJRZDDQW-CLCXKQKWSA-N	435.396	1.435	50	20	IDGD	
C[C@H](C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCBr)CC2)n1cnnn1	1826971659	ITZSLNUKIDLSMX-RKDXNWHRSA-N	428.316	1.088	50	20	IDGD	
O=C(NCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H](O)CCl)CC1)c1ccco1	1827181847	JQIYXNGQOZVOLG-HZPDHXFCSA-N	425.913	1.229	50	20	IDGD	
O=C([C@@H](O)CCl)N1CCC([C@H]2CCCCN2C(=O)c2cccn3c(O)nnc23)CC1	1827535580	NFVDSSKDZBCOLG-CVEARBPZSA-N	435.912	1.268	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)[C@H]2CCC=CO2)CC1	1828891904	BAWHHVDINJXQAI-LEWJYISDSA-N	426.322	1.292	50	20	IDGD	
O=C([C@H](O)CCl)N1CCC([C@@H]2CCCCN2C(=O)c2c(O)cc(O)cc2O)CC1	1830642456	DGCJQSMYDWFCFE-WMLDXEAASA-N	426.897	1.636	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnnc(Cl)c3)C2)C1	1831644554	ZPAWWPYGPHBQED-KDOFPFPSSA-N	431.320	1.608	50	20	IDGD	
C[C@@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)CC(C)(C)O)CC2)CC1	1833262181	IVORSDMLCUTQTD-AWEZNQCLSA-N	432.403	1.750	50	20	IDGD	
Cc1ccc(F)c(C(=O)N2CCC(N3CCC(NC(=O)[C@H](O)CCl)CC3)CC2)c1	1833313895	RXLLEGMBRMWMMM-LJQANCHMSA-N	425.932	1.919	50	20	IDGD	
CNCCCC(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)CBr)CC2)CC1	1834711146	RXWBJJGUKCLQKR-HNNXBMFYSA-N	431.419	1.589	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H]3CCc4nc[nH]c4C3)CC2)CC1)[C@H](F)Cl	1835083697	QQYWHZBDGDFQDO-ACJLOTCBSA-N	425.936	1.621	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cnc4snnc4c3)CC2)CC1)[C@H](F)Cl	1835084259	TYVGZUNJKOXTGU-HNNXBMFYSA-N	440.932	1.806	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCN3CCCCC3)CCO2)C1	1835128837	ONUFFDTZJGSDEY-GHTZIAJQSA-N	429.989	1.726	50	20	IDGD	
COc1cc(C#N)cc(C(=O)N2CCO[C@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)c1	1838579201	FQMAWRQFEJYYDU-JOCHJYFZSA-N	449.935	1.902	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCCn3ccnc3C)C2)C1	1839149153	VFFSLZBINFDZFC-PXNSSMCTSA-N	426.945	1.446	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(CO)o3)C2)C1	1839153631	MEOWAXQJSDHRMQ-QZTJIDSGSA-N	435.304	1.078	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(O)c(F)c3)C2)C1	1839154748	XCVAVPCHYVDGQE-RBUKOAKNSA-N	449.306	1.838	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCN3CCCC3)C2)C1	1839156134	CJDHHGRXBVUALY-RTBURBONSA-N	436.380	1.165	50	20	IDGD	
Cc1cnc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)s1	1839198069	RPACUJIYJOJXLC-IAQYHMDHSA-N	436.303	1.212	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccccc3O)C2)C1	1839962888	UMMROGMTIUXJIP-KXBFYZLASA-N	441.322	1.636	50	20	IDGD	
COc1ccc(OCC(=O)N2CCOC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)cc1	1840186536	AIEZHRRJJOTTRO-IBGZPJMESA-N	447.315	1.334	50	20	IDGD	
CN(CC(=O)N1CC2(CCCN2C(=O)C2=CCCS2)C1)NC(=O)NCc1ccccc1	1841646268	WSRUPOAGGOFKSK-UHFFFAOYSA-N	443.573	1.557	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)c1c(Cl)ccc(Cl)c1O)C2	1846385715	NHTKWFCHMXLYJQ-UHFFFAOYSA-N	443.331	1.889	50	20	IDGD	
O=C(c1cc(Br)ncc1Cl)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl	1847557133	VYDCSYRTJLKUFF-SRVKXCTJSA-N	437.121	1.913	50	20	IDGD	
Cc1ccc(-c2csc3ncn(CCC(=O)NNC(=O)C(=O)NC4CC4)c(=O)c23)cc1	10215339	WIMKXLLLAFWZPO-UHFFFAOYSA-N	439.497	1.250	50	20	IDGD	
Cc1nn(C)c2sc(C(=O)NNC(=O)c3cccc(S(=O)(=O)N4CCCC4)c3)cc12	11331258	OLHJFKCXEAQPBB-UHFFFAOYSA-N	447.542	1.803	50	20	IDGD	
CCCC[C@@H](NC1=NS(=O)(=O)c2ccccc21)C(=O)NNC(=S)NC(C)(C)C	12747688	BPOSPFGGZNNRJO-CYBMUJFWSA-N	425.580	1.578	50	20	IDGD	
O=C(COC(=O)CCc1ccc2c(c1)OCCO2)NNC(=O)c1cccc([N+](=O)[O-])c1	12947855	AVYDHABGTOHAKC-UHFFFAOYSA-N	429.385	1.303	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)OCC(=O)c2c(N)n(C)c(=O)n(C)c2=O)c(C)n1CC(C)C	34869180	LGCJOADLEWFUQU-PXNMLYILSA-N	441.488	1.074	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)CC2CCN(C(=O)OC(C)(C)C)CC2)c2ccccc2c1=O	60142481	DFLYBOHWSNNKGL-UHFFFAOYSA-N	443.504	1.732	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)cnc1Cl)c1csc(N2CCOCC2)n1	110008537	KKRLSXNLXUTBHU-UHFFFAOYSA-N	446.714	1.865	50	20	IDGD	
Cc1ccc(-c2nn(CCC#N)cc2C(=O)NNC(=O)CNC(=O)c2ccco2)cc1C	725741134	MTQLKJBGCDTQTQ-UHFFFAOYSA-N	434.456	1.865	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)NCC1(c2ccc(Cl)cc2)CCOCC1	725870735	QBBRSKBOIPLOHQ-UHFFFAOYSA-N	434.880	1.742	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(NC(=S)NNC(=O)c2cnn(-c3ccccc3)c2)c1	725909495	OUBUSUVGGLFKOZ-UHFFFAOYSA-N	444.542	1.754	50	20	IDGD	
C[C@@H]1CN(CCNC(=O)NNC(=O)COc2ccccc2Cc2ccccc2)CCO1	726256004	MOBMYYCZQXGDIT-GOSISDBHSA-N	426.517	1.707	50	20	IDGD	
C[C@@]1(NNC(=O)NC2CCN(Cc3coc(-c4ccccc4)n3)CC2)CCS(=O)(=O)C1	726274575	FMXRHYWOMBBSJI-OAQYLSRUSA-N	447.561	1.687	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)NCCCN1CCC[C@@H]1C(=O)N(C)C	726278365	WHEMVAMBZABKLX-OAHLLOKOSA-N	425.917	1.235	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)[C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])c(C)c2)c(O)c1	726622489	ZAUNYKQCYLCTGQ-QGZVFWFLSA-N	426.429	1.983	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@H]2CCCC[C@@H]2C(=O)N2CCCC2)cc(OC)c1OC	726864971	NCGASQXTOKKELA-HOTGVXAUSA-N	433.505	1.902	50	20	IDGD	
O=C(CCc1nc(-c2ncccn2)no1)NNc1ccc(S(=O)(=O)NC2CC2)cc1	728211727	DMDKBPYWDDHTBO-UHFFFAOYSA-N	429.462	1.043	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCCN1CCOCC1(C)C	728401014	RZRYHACUMUUOCP-ZDUSSCGKSA-N	443.342	1.658	50	20	IDGD	
CNS(=O)(=O)Cc1ccc(CNC(=O)NNC(=O)c2cccc(OC(F)F)c2)cc1	728598794	UFMNWDNPOLAHOD-UHFFFAOYSA-N	442.444	1.481	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)n1	728731180	NSJQCRUIIPCSMU-UHFFFAOYSA-N	431.430	1.248	50	20	IDGD	
CC(=O)N[C@@H](CC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)c1ccc(Cl)cc1	728847535	IYNZXMNRVNZIAS-SFHVURJKSA-N	444.923	1.761	50	20	IDGD	
O=C(COC(=O)[C@H]1COc2ccc(Cl)cc2C1)NNC(=O)[C@H]1COc2ccccc2O1	729236717	KQHXNPBTUDFUPF-FZKQIMNGSA-N	446.843	1.422	50	20	IDGD	
COCCOc1cn(-c2ccccc2)nc1C(=O)NNC(=S)Nc1ccc(OC)nc1	729691628	JEOQJJYDFWSIFG-UHFFFAOYSA-N	442.501	1.933	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)c1ccc(S(=O)(=O)NC[C@@H]2CCCO2)cc1	730034222	CSYCXBGPFHFLKF-KRWDZBQOSA-N	447.513	1.243	50	20	IDGD	
CC(C)(C)CC(=O)N1CSC[C@@H]1C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	730077170	MHUIJHUXBCUUBH-MRXNPFEDSA-N	440.591	1.908	50	20	IDGD	
COc1ccc(C[C@@H](C)NC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])cc1OC	730129907	FFNGHBZUEDOAJU-CYBMUJFWSA-N	432.433	1.952	50	20	IDGD	
CC1CCN(S(=O)(=O)C2=S=C(C(=O)NNc3nc(-c4ccncc4)no3)C=C2)CC1	730282441	LGLJEFLVJJREDQ-UHFFFAOYSA-N	448.530	1.242	50	20	IDGD	
CCCC(=O)N1CSC[C@@H]1C(=O)OCC(=O)NNC(=O)c1cc(Cl)ccc1OC	730323864	UWOBJTZGRWKOEY-CYBMUJFWSA-N	443.909	1.354	50	20	IDGD	
Cn1cnnc1Sc1ccc(C(=O)NNC(=O)COc2ccccc2O)cc1[N+](=O)[O-]	730780849	XAGMCABNIGFORA-UHFFFAOYSA-N	444.429	1.420	50	20	IDGD	
Cc1c(C(=O)NNC(=O)COc2ccc(C#N)cc2)nnn1-c1cccc2c1CCN(C)C2	731470241	WCMNRLBJUJHBMV-UHFFFAOYSA-N	445.483	1.275	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2ccc(F)c(C(=O)O)c2)cc1Br	732049181	XTYOUQVDNSPXCP-UHFFFAOYSA-N	447.238	1.918	50	20	IDGD	
Cc1cc(S(C)(=O)=O)c(C)c(S(=O)(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c1	733123197	XJVOKTYLFMFDBI-UHFFFAOYSA-N	448.526	1.516	50	20	IDGD	
CCOCCCn1c(NNC(=O)c2ccc(C(=O)OC)nc2)nc2ccccc2c1=O	733269022	XOBCJNMCDQTCOK-UHFFFAOYSA-N	425.445	1.762	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)Cc2cccnc2)c(F)cc1Br	734416223	OWDDZSHGUCBAEK-UHFFFAOYSA-N	446.254	1.322	50	20	IDGD	
CN1C(=O)CC[C@H](C(=O)NNC(=O)N2CCOCC2)[C@@H]1c1ccc(C(F)(F)F)cc1	734429314	MBPLVMYOJQOUHM-HOCLYGCPSA-N	428.411	1.688	50	20	IDGD	
COc1ccc(S(=O)(=O)C[C@H](C)C(=O)NNC(=O)c2c(C)nc3ccccn23)cc1	735030760	JSANPANXTWHLLF-ZDUSSCGKSA-N	430.486	1.522	50	20	IDGD	
COCCOCCNC(=O)NNc1ccc(S(=O)(=O)NC2CCCCCCC2)cn1	735580660	VRVJDNDDXMNKTA-UHFFFAOYSA-N	443.570	1.762	50	20	IDGD	
C[C@@H](CN1CCN(c2ccccn2)CC1)NC(=O)NNC(=O)[C@@H](C)Oc1ccc(F)cc1	735585555	GBTJYNPFGKNYFQ-DLBZAZTESA-N	444.511	1.529	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N1CC[S@](=O)[C@@H](C)[C@@H]1C	736649435	FFRWSGCSLSAETG-YSTCFSIOSA-N	432.340	1.799	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@H](C)C(=O)N2CCCC[C@H]2C)c2ccccc2c1=O	737054713	SUCXTQWQWCNPSA-ZIAGYGMSSA-N	428.493	1.150	50	20	IDGD	
COC[C@H]1CCN(C(=O)/C(C#N)=C/c2cn(CCC(N)=O)nc2-c2ccc(OC)cc2)C1	739757106	OJNFKZJDWZINKO-GYKGCMEESA-N	437.500	1.836	50	20	IDGD	
O=C(COC(=O)c1cn(-c2cccc(C(F)(F)F)c2)nn1)NNC(=O)c1ccccc1	740377606	VATZMIDQNHCWGU-UHFFFAOYSA-N	433.346	1.904	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2ccc3ncccc3c2)c1	741648351	ZGLMSSAACXHUFW-UHFFFAOYSA-N	434.499	1.108	50	20	IDGD	
CCC(CC)[C@H](C(=O)NNC(=O)c1sc(N2CCOCC2)nc1C)N1CCOCC1	742037529	YENBXRVWMQSOJK-MRXNPFEDSA-N	439.582	1.186	50	20	IDGD	
O=C(CCN1C(=O)[C@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O)NNc1ccc(C(F)(F)F)cc1[N+](=O)[O-]	743297603	TWYTULRWOGMVMU-UXOAXIEHSA-N	442.350	1.609	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)[C@H](c1ccccc1)n1cccn1	744621339	QFTROFLDQUBYMS-FQEVSTJZSA-N	441.513	1.637	50	20	IDGD	
CC1CCC(N2C[C@@H](C(=O)OCC(=O)NNC(=O)c3ccc(C#N)cc3)CC2=O)CC1	744999064	WEIGXMYCATVWMH-GMXGEUMGSA-N	426.473	1.290	50	20	IDGD	
Cc1nn(C)c2sc(C(=O)N[C@@H](C)C(=O)OCC(=O)NNC(=O)c3cccs3)cc12	745269516	BYJFPTMPPKUFAF-JTQLQIEISA-N	449.514	1.127	50	20	IDGD	
C[C@H]1C[C@@H](NC(=O)NNC(=O)c2cc3c(s2)CCCCC3)C(=O)N1c1cnn(C)c1	745916842	GJIOLGXJVRYMOE-SWLSCSKDSA-N	430.534	1.889	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)c2cc(S(=O)(=O)N3CCCC3)ccc2O)cc1C	745990770	IPKPSKHHLWVOKZ-UHFFFAOYSA-N	447.513	1.634	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCCN1C(=O)c1ccc(O)nn1)c1cccc(OC(F)F)c1	746214959	HENAHBHIWRYTOB-AWEZNQCLSA-N	435.387	1.240	50	20	IDGD	
O=C(NCc1ccc(F)cc1F)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	746963197	CCNQNZWHTKLULJ-UHFFFAOYSA-N	438.456	1.894	50	20	IDGD	
O=C(CCOc1ccccc1)NNC(=O)NC[C@@H](c1ccc(F)cc1)N1CCOCC1	747298063	ALNAJLLCIJFULU-FQEVSTJZSA-N	430.480	1.999	50	20	IDGD	
CC(C)CN1C[C@@H](C(=O)NNc2ccc(S(=O)(=O)Nc3nccs3)cc2)CC1=O	747944712	WVSOQZUXULBDQE-ZDUSSCGKSA-N	437.547	1.892	50	20	IDGD	
O=C(CS[C@H]1CCS(=O)(=O)C1)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1	748523147	NEYWACNFTPEHKV-JTQLQIEISA-N	432.467	1.344	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)CNC(=O)NC1CCCCC1	748592990	CIMHLMCOTDKZCR-UHFFFAOYSA-N	425.555	1.838	50	20	IDGD	
CN(C(=O)CNC(=O)NNC(=O)COc1ccc(Br)cc1)C1CCCCC1	748665275	UZKFBBYUSIMLNQ-UHFFFAOYSA-N	441.326	1.949	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCCN1CCCc2ccccc21	749213938	MDUJOVLRNMTYKV-UHFFFAOYSA-N	444.561	1.685	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)[C@@H]1OCCc2ccccc21	750422954	BSMMPYSCDZXGTC-JOCHJYFZSA-N	442.947	1.919	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)c3ccc([C@]4(C)NC(=O)NC4=O)cc3)n[nH]2)cc1	751065761	SNAMILPWQPOWMY-QFIPXVFZSA-N	432.440	1.515	50	20	IDGD	
CCCc1nc(C(=O)NNC(=O)CNC(=O)c2ccco2)nn1-c1ccccc1Cl	751199240	LMCDBYOGJJCMBJ-UHFFFAOYSA-N	430.852	1.657	50	20	IDGD	
O=C(CC[C@@H]1CCOC1)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	751297200	ISSFRUFKDOJGNB-QGZVFWFLSA-N	431.514	1.743	50	20	IDGD	
COc1cc(OC)cc(N2C[C@@H](C(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)CC2=O)c1	752510835	ZOMDDOWWPLUVLQ-ZDUSSCGKSA-N	428.401	1.426	50	20	IDGD	
COc1c(S(=O)(=O)NNC(=O)c2ccoc2)cc(Br)c(C)c1[N+](=O)[O-]	755003242	QOJVDSBCELHKGE-UHFFFAOYSA-N	434.224	1.891	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c(Br)n1	755399761	SPPPJCVTWMLJCZ-UHFFFAOYSA-N	441.307	1.478	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N2CCOCC2)cc1NC(=O)NNC(=O)[C@@H](C)CC	755440445	AEYWHRHPPCRHDZ-ZDUSSCGKSA-N	428.511	1.305	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)c2cccc(OC(F)F)c2)n([C@H]2CCS(=O)(=O)C2)n1	755530064	DQJZAGWGNLGHBT-LBPRGKRZSA-N	443.432	1.619	50	20	IDGD	
COC(=O)CCNC(=O)c1ccc(NC(=O)NNC(=O)c2cccc(N(C)C)c2)cc1	755604920	VRLPHDPGCQZMOK-UHFFFAOYSA-N	427.461	1.512	50	20	IDGD	
O=C(NCCN1C(=O)[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)NNC(=O)c1ccc(Cl)cc1Cl	756092703	DBNLIHFXYVPCRP-FCIDVOKBSA-N	437.283	1.745	50	20	IDGD	
CCCCNC(=O)[C@H]1CC[C@@H](C)N(CC(=O)NNC(=O)c2ccc(OC)c(OC)c2)C1	756499712	CFZQLGKRROFJQV-WBVHZDCISA-N	434.537	1.482	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1NS(C)(=O)=O	756781428	DZEVQZAMCPCBIW-INIZCTEOSA-N	436.446	1.059	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)Nc3cnc(N(C)C)nc3)n[nH]2)cc1OC	757755485	JUMJHZSMLXXPNN-UHFFFAOYSA-N	426.437	1.416	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(F)(F)[C@@H](C(=O)NNC(=O)Cc2cn3ccccc3n2)C1	757985122	HWKOCTOOPKRXIX-CQSZACIVSA-N	437.447	1.917	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)N[C@H]2CCc3c[nH]nc3C2)c2ccccc2c1=O	758906094	PPWUWCLMGCWQIT-HNNXBMFYSA-N	437.504	1.811	50	20	IDGD	
COc1cc(F)cc(NNC(=O)CS(=O)(=O)N2CCN(c3cccc(C)c3)CC2)c1	759310853	MTYWBWUSCDIPGK-UHFFFAOYSA-N	436.509	1.738	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCc2ccccc2-c2cnn(C)c2)nc1	759619010	OMWUVFTYIQFYMR-UHFFFAOYSA-N	443.533	1.995	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)CN2C(=O)c3ccccc3N3C(=O)CC[C@]23C)n1	762902035	MBWNUIISTFXSDH-JOCHJYFZSA-N	437.504	1.765	50	20	IDGD	
COc1ccc(Cn2nccc2NC(=O)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1	763470564	KPHLJPIRJXFWKZ-UHFFFAOYSA-N	438.400	1.248	50	20	IDGD	
COCCOc1ccc(C(F)(F)F)cc1NC(=O)C(=O)NNC(=O)c1cccnc1	763494553	HQFZUIDKGAMNRP-UHFFFAOYSA-N	426.351	1.525	50	20	IDGD	
CC[C@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)cc1	763548503	LZTWUZLMRUEYQO-LBPRGKRZSA-N	426.429	1.343	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cccc(OCC(=O)N(C)C)c2)c2ccccc2n1	763613406	XZCRKZQOASMCRW-UHFFFAOYSA-N	449.467	1.410	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)cc1C(=O)N(C)C	763684284	IXQDXGSDOBMMIB-UHFFFAOYSA-N	432.864	1.515	50	20	IDGD	
O=C(CN1CCCc2ccccc21)NNC(=O)C(=O)N1C[C@@H]2CCCN2c2ccccc21	763745763	JVSZVZWGHAINRY-SFHVURJKSA-N	433.512	1.602	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)c(C)c1	763808523	XOVLDOGCVBMGGC-UHFFFAOYSA-N	426.429	1.057	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)C(=O)Nc1cccc2c1oc(=O)n2C	763850864	BIFOJBXWUWZIIW-CYBMUJFWSA-N	448.435	1.838	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1cccc(C(=O)NC2CC2)c1	763858703	WDWYFXYFPMRUOP-GFCCVEGCSA-N	428.420	1.271	50	20	IDGD	
CCN(CC)C(=O)COc1ccc(NC(=O)C(=O)NNC(=O)CC(C)C)cc1Cl	763882420	OSEFRCZLKZETHA-UHFFFAOYSA-N	426.901	1.719	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc3c2OCCC3=O)cc1OC	763901293	NBRRVYSMQANNQT-UHFFFAOYSA-N	427.413	1.459	50	20	IDGD	
COc1ccc(Cn2nccc2NC(=O)C(=O)NNC(=O)Cc2ccc(F)cc2)cc1	763919136	RHUOFPSYZMJOAY-UHFFFAOYSA-N	425.420	1.408	50	20	IDGD	
Cc1ccc(S(C)(=O)=O)cc1NC(=O)C(=O)NNC(=O)c1cc2c(s1)CC[C@H](C)C2	763941963	LEXCQAUPTFUZBU-NSHDSACASA-N	449.554	1.985	50	20	IDGD	
COCCn1cc(NC(=O)C(=O)NNC(=O)c2ccc(COc3ccccc3)o2)cn1	763955251	KXDZYPRUTDNJFO-UHFFFAOYSA-N	427.417	1.101	50	20	IDGD	
CC(=O)N1CCc2cc(NC(=O)C(=O)NNC(=O)c3cc(Br)cn3C)ccc21	764004314	CMDHRPKIWGYGIW-UHFFFAOYSA-N	448.277	1.096	50	20	IDGD	
COC(=O)c1cccc(C#Cc2cccc(NC(=O)C(=O)NNC(=O)c3cnccn3)c2)c1	764030760	GPFKZFTTZYAPPL-UHFFFAOYSA-N	443.419	1.063	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(C(F)(F)F)c2)cc1-n1cnnn1	764037198	JKXAYPDXVMKAAF-UHFFFAOYSA-N	433.350	1.389	50	20	IDGD	
CON(C)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cccc(Br)c2)cc1	764062780	DINMMSWELADXSM-UHFFFAOYSA-N	449.261	1.482	50	20	IDGD	
COC(=O)COc1cccc(NC(=O)C(=O)NNC(=O)Cc2ccc3ccccc3c2)c1	764084347	JVDHAORNCWFSMM-UHFFFAOYSA-N	435.436	1.720	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc(C(N)=O)c(Cl)c3)n[nH]2)cc1	764109897	CXWPGWCBCOEIHJ-UHFFFAOYSA-N	440.847	1.537	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2O1)C(=O)Nc1ccccc1CN1CCSCC1	764162687	DTWWPJRFHHHPJG-LJQANCHMSA-N	440.525	1.325	50	20	IDGD	
CCCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(C#N)cc2)cc1Cl	764177143	KFQUSYFIRVEAHU-UHFFFAOYSA-N	427.848	1.751	50	20	IDGD	
Cc1nc(N2CCOCC2)ccc1NC(=O)C(=O)NNC(=O)CCCc1ccccc1	764224685	RRLJHOXNTAHXIO-UHFFFAOYSA-N	425.489	1.335	50	20	IDGD	
CC1CCN(C(=O)c2ccc(NC(=O)C(=O)NNC(=O)c3cccc(C#N)c3)cc2)CC1	764231306	GZYXYGQBZLJPFR-UHFFFAOYSA-N	433.468	1.830	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)C(=O)Nc2sc(C)nc2C)c1	764232033	MXNZGDGAWWRCRS-UHFFFAOYSA-N	427.280	1.931	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3cccc(OC(F)F)c3)cc2)CCO1	764251175	PZBDFXWBPRBQRF-ZDUSSCGKSA-N	448.426	1.913	50	20	IDGD	
C[C@@H](CC#N)Sc1ccccc1NC(=O)C(=O)NNC(=O)COc1ccccc1O	764278380	XSXMAWRRLXAGQT-ZDUSSCGKSA-N	428.470	1.951	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@@H]2C)ccc1NC(=O)C(=O)NNC(=O)c1c[nH]nc1C	764297643	GSEBOIUUBQEUPO-ZDUSSCGKSA-N	426.477	1.441	50	20	IDGD	
COC(=O)c1sccc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccccc2OC)[nH]n1	764376502	DYOHADNBGYMCPW-UHFFFAOYSA-N	443.441	1.333	50	20	IDGD	
CC(C)n1ncc2cc(NC(=O)C(=O)NNC(=O)CSc3ccccc3O)cnc21	764394211	PPNQMGUQWQOFDH-UHFFFAOYSA-N	428.474	1.596	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1cccc(-c2ccc3c(c2)CCO3)c1	764400282	PAYMXHQZIGQQOO-CQSZACIVSA-N	427.457	1.426	50	20	IDGD	
Cc1nnnn1/C(=C\c1ccc(F)cc1)C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C	765318497	IKCDIQLTKAQUQH-VBKFSLOCSA-N	447.471	1.571	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)[C@@H]1CCCN(C(=O)Cc2ccccc2)C1	765321430	AMPVJIHBRGXEHZ-GOSISDBHSA-N	446.548	1.920	50	20	IDGD	
O=C(CNC(=O)c1ccccc1)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	765755895	UBIUNLUNKZQGNI-UHFFFAOYSA-N	443.935	1.035	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCCCCC2)cc1NC(=O)C(=O)NNc1cnccn1	766260104	IOKKYUFXDQRKOW-UHFFFAOYSA-N	448.505	1.132	50	20	IDGD	
C[C@H](OC(=O)[C@@H](Br)C(C)(C)C)C(=O)NCCc1ccc(S(N)(=O)=O)cc1	766749729	OLYDYFRMNQQDLY-SMDDNHRTSA-N	449.367	1.734	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN(C)Cc1nc(O)c2sccc2n1	767956267	WFAWZXZBECLVKJ-UHFFFAOYSA-N	435.893	1.952	50	20	IDGD	
COc1cc2c(cc1NC(=O)C(=O)NNC(=O)c1ccc(Cl)cc1F)NC(=O)CC2	768244137	YQWZYJQNOUXIOE-UHFFFAOYSA-N	434.811	1.772	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)c1cc(I)c[nH]1	768614039	ZEDBKWVCDCNNKI-UHFFFAOYSA-N	435.243	1.788	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)c2ccc(C)o2)c(NS(=O)(=O)C(F)F)c1	769634065	PLZDTQCBAYJGEV-UHFFFAOYSA-N	439.418	1.184	50	20	IDGD	
Cc1cccc(N2CCN(CCCNC(=O)NNc3nc(O)c4cnn(C)c4n3)CC2)c1	770342677	VLBYKDWTBGCNKG-UHFFFAOYSA-N	439.524	1.216	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)NC3CCN(CC(F)(F)F)CC3)nc21	770369693	ZKECGBZCEOLMRZ-UHFFFAOYSA-N	430.435	1.940	50	20	IDGD	
COc1ccc([C@@H](OC)[C@@H](C)NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1	771906768	XLBQTHMAPOCNQT-ACJLOTCBSA-N	425.449	1.391	50	20	IDGD	
COc1ccc(CC(=O)NNc2nccnc2C(C)C)cc1S(=O)(=O)N1CCOCC1	772869519	MRIXFWXBAPYAOQ-UHFFFAOYSA-N	449.533	1.315	50	20	IDGD	
CCOC(=O)c1c(S(=O)(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)n[nH]c1C	773252203	ROUWKWMIUMZIKT-SNVBAGLBSA-N	430.870	1.325	50	20	IDGD	
C#CCOc1ccccc1NC(=O)C(=O)NNC(=O)c1cc(F)ccc1Br	773497466	UKFRUZZUCZDSGJ-UHFFFAOYSA-N	434.221	2.000	50	20	IDGD	
Cc1nc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)ccc1Br	773527227	IJQLGARGFUIDPZ-UHFFFAOYSA-N	435.234	1.323	50	20	IDGD	
Cc1nc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)ccc1Br	773546659	OEDXMYZCTVTQAA-UHFFFAOYSA-N	443.204	1.910	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(C(=O)NNc2cccc(F)c2C(=O)OC)cc1	773641862	RMCQYZDWIZYBEX-UHFFFAOYSA-N	425.438	1.294	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)c2ccoc2CC(=O)OC)c2ccccc2c1=O	774326435	HLZJZMSMEPVFGR-UHFFFAOYSA-N	440.456	1.970	50	20	IDGD	
CC(C)C[C@H]1OCCC[C@@H]1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	776258230	CRHBVYCRQMSRFV-DLBZAZTESA-N	426.539	1.475	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCCNC(=O)NNc2cccc(S(C)(=O)=O)c2)cc1	776609291	GKLIKRRCSCCNHM-UHFFFAOYSA-N	426.520	1.003	50	20	IDGD	
COc1ccc(Cn2ccc(NC(=O)C(=O)NNC(=O)COc3ccc(C)cc3)n2)cc1	778707625	OKCLWRIAMUFQCH-UHFFFAOYSA-N	437.456	1.413	50	20	IDGD	
CC(C)(C)OC(=O)NCc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccccn2)cc1	778709304	CRJKZCAXMIIKIK-UHFFFAOYSA-N	427.461	1.435	50	20	IDGD	
COCC(=O)N1CCc2cc(NC(=O)C(=O)NNC(=O)CCCc3ccccc3)ccc21	778711862	WYKXLQIOVKWZLP-UHFFFAOYSA-N	438.484	1.331	50	20	IDGD	
C[C@@](O)(CC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)c1ccccc1	780849788	POJQKLRCQVBBAG-JOCHJYFZSA-N	445.541	1.920	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)NOCc1ccc(F)cc1Br	780909526	LXVAJUHHIDHSCE-UHFFFAOYSA-N	429.202	1.373	50	20	IDGD	
CC(C)N(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)CCNC(=O)OC(C)(C)C)c1	780971606	OXLXMVFFABMDER-UHFFFAOYSA-N	442.538	1.391	50	20	IDGD	
O=C(NNc1ncncc1Cl)[C@H]1CCCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1	781830175	QVOVJQPHKKHJCV-NSHDSACASA-N	440.869	1.582	50	20	IDGD	
COC(=O)CN1CCN(c2ccc(NC(=O)C(=O)NNc3ccc(F)cc3F)cc2)CC1	783339794	DVGXOVJBHRISJM-UHFFFAOYSA-N	447.442	1.342	50	20	IDGD	
Cc1ccc(NNC(=O)C(=O)Nc2ccc(S(=O)(=O)/N=C3/CCCN3C)cc2)cc1	783344584	CFUNQELHXQSRCY-MOHJPFBDSA-N	429.502	1.890	50	20	IDGD	
Cc1ccnc(Oc2cc(NC(=O)C(=O)NN[C@@]3(C)CCS(=O)(=O)C3)ccc2C)c1	783423908	BKZBRSPMKNLERI-FQEVSTJZSA-N	432.502	1.627	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)C(=O)Nc1cccc(OC(F)F)c1	784216122	NSGIEJKLMYBTLX-UHFFFAOYSA-N	440.428	1.811	50	20	IDGD	
Cc1c(NNC(=O)C(=O)Nc2ccc(N3C[C@H](C)O[C@@H](C)C3)nc2)cccc1[N+](=O)[O-]	784354143	IOQKNZMIROXSKG-STQMWFEESA-N	428.449	1.994	50	20	IDGD	
CC(C)(C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)cc1	785061645	ZWTUORXWYUHZJF-UHFFFAOYSA-N	436.472	1.191	50	20	IDGD	
COc1cc(F)cc(NNC(=O)C(=O)Nc2ccc(C(=O)N3CCN(C)CC3)cc2)c1	785241808	QXZWOGUMYQWEQP-UHFFFAOYSA-N	429.452	1.304	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1)C(=O)NCCS(=O)(=O)N1CCN(c2ccccn2)CC1	785249594	IYERNJUKHPIZOL-OBGWFSINSA-N	443.504	1.396	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2O1)C(=O)Nc1cc(F)cc(F)c1Br	785990942	METRDSLQMSUGDG-ZDUSSCGKSA-N	440.200	1.817	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCOCC2)cc1NC(=O)COC(=O)/C(C#N)=C\C1CC1	786676772	UOPWJFJGRGRSAZ-GDNBJRDFSA-N	449.485	1.058	50	20	IDGD	
CCN(C(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cnn(C)c2)ccc1Cl)C(C)C	787549711	PNWOZVMOXQFGPB-UHFFFAOYSA-N	434.884	1.344	50	20	IDGD	
CCNC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)COc2ccc(C)c(C)c2)c1C	789731898	JTXODGMQADVVCG-UHFFFAOYSA-N	441.488	1.918	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)[C@H]3CCCc4c(O)cccc43)cc2)CC1	789819063	WSCVYNOXFHDAAL-FQEVSTJZSA-N	444.557	1.892	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)c(OC2CCCC2)c1	792316600	JRRYLCKNZXTZNP-CYBMUJFWSA-N	427.523	1.496	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc3nc(C)n(C)c3c2)c1	792773399	HQNZBLGDCIECMV-UHFFFAOYSA-N	443.529	1.987	50	20	IDGD	
CN(C)N(C(=O)c1cccc(NS(=O)(=O)c2ccccc2)c1)[C@@H]1CCS(=O)(=O)C1	792853000	BKOKZXWXLJAIEI-QGZVFWFLSA-N	437.543	1.593	50	20	IDGD	
Cc1cc([N+](=O)[O-])cc(S(=O)(=O)NNC(=O)CNC(=O)OCc2ccccc2)c1C	794599295	XNZUVQNEGZNHQX-UHFFFAOYSA-N	436.446	1.448	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)c2ccc(C(=O)NNC(=O)c3cccc(C)n3)cc2)n1	795665770	NKZGHDBXFGJZON-UHFFFAOYSA-N	432.440	1.243	50	20	IDGD	
COC(=O)c1cc(F)cc(NC(=O)C(=O)NNC(=O)COc2ccccc2F)c1F	796992808	XLJONUUABNARPD-UHFFFAOYSA-N	425.319	1.055	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)Cc2ccc3ccccc3c2)cc1OC	797000268	YNYWUORCNRGCTL-UHFFFAOYSA-N	435.436	1.964	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)NCCc3ccccc3)cc2)n1	797370306	YWXBESAABSVHSN-UHFFFAOYSA-N	445.479	1.762	50	20	IDGD	
O=C(NNc1ccc(Cl)nn1)C(=O)Nc1ccc(Cl)c(CN2CCOCC2)c1	797536500	XKZARALZQPJBMW-UHFFFAOYSA-N	425.276	1.697	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2CCN(c3ccc(F)c(F)c3)C2=O)cc1C	798308200	SVUPLZQWLRVDOA-HNNXBMFYSA-N	430.411	1.721	50	20	IDGD	
O=C(NCC(F)(F)F)NNC(=O)c1ccc(NS(=O)(=O)c2cccs2)cc1O	798313436	HHWBQJYSDODNCH-UHFFFAOYSA-N	438.409	1.761	50	20	IDGD	
N#Cc1cc(NC(=O)C(=O)NNC(=O)CCc2ccccc2O)ccc1OC(F)(F)F	799835818	XWWHJNWPFUSVGS-UHFFFAOYSA-N	436.346	1.881	50	20	IDGD	
CCc1cccc(C)c1NNC(=O)C(=O)Nc1cc(C(=O)OC)cc(S(C)(=O)=O)c1	799842635	QWWIBGZEHJPIEI-UHFFFAOYSA-N	433.486	1.829	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc2c(c1)CCN2CC(=O)NNC(=O)c1cccc(Cl)c1	800723321	HKAUWZSVGFXUMB-UHFFFAOYSA-N	436.921	1.414	50	20	IDGD	
COCN1C(=O)CCc2cc(NC(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)ccc21	801783961	KZHMHUKHQDVVQO-UHFFFAOYSA-N	446.485	1.440	50	20	IDGD	
O=C(NNC(=O)[C@H]1CS[C@@H](Cc2ccccc2F)C(=O)N1)Nc1ccc2c(c1)OCO2	802102646	ARKCEFVOJJHCKB-PBHICJAKSA-N	446.460	1.550	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CSc2nnc(-c3ccncc3)n2C)cc1OC	802684147	MZRQBKYBJHBPNF-UHFFFAOYSA-N	428.474	1.448	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@H](C)Oc3ccc(C=O)cc3)CC2)cc1	802762452	HGUNWRPHRHPHSQ-IBGZPJMESA-N	438.528	1.540	50	20	IDGD	
Nc1cc(I)cc(C(=O)OCC(=O)NNC(=O)c2cccs2)c1	803852247	PYUOLEGHVFSKOR-UHFFFAOYSA-N	445.238	1.553	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(F)c(C(C)=O)c2)cc1	806975352	UWYKRBRKZZIIHV-CYBMUJFWSA-N	431.420	1.980	50	20	IDGD	
O=C1COC[C@@H](C[C@@H]2CN(C(=O)C(=O)NNc3cc(Cl)ccn3)c3ccccc32)N1	807013231	LPYXHYQAEQNHGF-TZMCWYRMSA-N	429.864	1.214	50	20	IDGD	
CCOc1cc(Br)c(F)cc1NC(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1	810340102	AJEAMYBXVOSDAZ-QMMMGPOBSA-N	438.275	1.574	50	20	IDGD	
Cc1nnc(CCNC(=O)NNC(=O)[C@H](C)Oc2cccc(Br)c2)s1	811853241	RFYRXZRCPUOPJI-VIFPVBQESA-N	428.312	1.949	50	20	IDGD	
CC(C)(C)n1cnc(C(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)n1	812452963	NFHXDXWPHNKQBX-UHFFFAOYSA-N	448.530	1.970	50	20	IDGD	
C[C@H]1C[C@H](NC(=O)NNC(=O)Cc2cn3ccccc3n2)c2ccsc2S1(=O)=O	812649854	HXXZFIHXIGTDSP-FZMZJTMJSA-N	433.515	1.576	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)[C@H]2CC(=O)N(c3ccc4c(c3)CCC4)C2)cc1	812730388	GZYWJRZNUBWUFZ-KRWDZBQOSA-N	442.541	1.922	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1nn(-c2ccccc2)cc1O	813467756	LVUNYASPUATAAA-UHFFFAOYSA-N	443.485	1.356	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)c2c(I)cnn2C)cc1OC	814103948	YWYWZQRYZPFVNS-UHFFFAOYSA-N	444.229	1.507	50	20	IDGD	
O=C(N=c1cc[nH]cc1)NN=Cc1ccc(OCCn2cc(C(=O)O)nn2)c(Cl)c1	815000225	HGJYDMRKBKHDAB-UHFFFAOYSA-N	429.824	1.681	50	20	IDGD	
COC(=O)C(C)(C)c1csc(NC(=O)C(=O)NNC(=O)COc2ccc(C)c(C)c2)n1	815565209	GNFIXUVODXEYMM-UHFFFAOYSA-N	448.501	1.375	50	20	IDGD	
CN(NC(=O)c1cnn(-c2ccccn2)c1N)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	816087946	SAJYSMWJWSAWTN-UHFFFAOYSA-N	444.496	1.099	50	20	IDGD	
CCS(=O)(=O)N[C@@H](C)C(=O)NNC(=O)c1cn(-c2ccccc2)nc1-c1ccccc1	816815622	ZJCBSDLZIHNKCC-HNNXBMFYSA-N	441.513	1.628	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)CCn2c(S)nnc2-c2cccs2)c1	825801057	JFRDELTYPRUGIO-UHFFFAOYSA-N	432.531	1.954	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)CCNS(=O)(=O)c1ccccc1F	869788112	MQILIOGAZCPRPW-UHFFFAOYSA-N	439.465	1.119	50	20	IDGD	
CC(=O)N1Cc2ccccc2C[C@H]1C(=O)NNC(=O)COc1ccc(Br)cc1	871003128	AGRXYWFNDFOMGV-SFHVURJKSA-N	446.301	1.949	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2ccc(NNC(=O)c3cnccn3)c([N+](=O)[O-])c2)cc1	912762856	XTOLUIZVILNYME-UHFFFAOYSA-N	444.429	1.951	50	20	IDGD	
CN(C)N(C(=O)c1ccc(-n2cc(Br)cn2)cc1)[C@@H]1CCS(=O)(=O)C1	915141501	TZQTUGSIMKMLEB-OAHLLOKOSA-N	427.324	1.741	50	20	IDGD	
O=C(NC[C@H]1CN(Cc2ccccc2)CCO1)NNC(=O)c1cc(Br)c[nH]1	915893901	DOIDLDGFBOMOSU-HNNXBMFYSA-N	436.310	1.622	50	20	IDGD	
CC[C@@H](CNC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)c1ccccc1	915920236	NWJDSKYNQUJIMJ-KRWDZBQOSA-N	446.577	1.838	50	20	IDGD	
Cc1n[nH]cc1CCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	916259902	QFGGDNJHVJEBQH-UHFFFAOYSA-N	434.522	1.079	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)N[C@@H](CN2CCCC2)c2ccccc2)c2ccccc2c1=O	916466158	FKDNQNRLQQCGOZ-IBGZPJMESA-N	434.500	1.715	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)[C@H](C)NS(=O)(=O)c2cccs2)cc1OC	917924790	MHCQKOYSPDGEPD-LBPRGKRZSA-N	441.531	1.674	50	20	IDGD	
CCn1c(NNC(=O)[C@@H](Cc2cccc(F)c2)n2nnnc2C)nc2ccccc2c1=O	918016178	FQXWUZZTMCFUMQ-GOSISDBHSA-N	436.451	1.778	50	20	IDGD	
CCCS(=O)(=O)N1CCCC[C@H]1C(=O)NNC(=O)[C@H](C)Oc1ccc(OCC)cc1	918549402	KBSWFPLQQNKYQC-YJBOKZPZSA-N	441.550	1.594	50	20	IDGD	
CCS(=O)(=O)N1CCC[C@H](C(=O)NNC(=O)c2ccc(OC(C)C)c(OC)c2)C1	918549593	CNDVHHPHZIJIFR-HNNXBMFYSA-N	427.523	1.305	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)c2c[nH]n3c2nc(=O)c2ccccc23)cc1	919690581	POGQHSIXRBDMPG-ZDUSSCGKSA-N	435.440	1.803	50	20	IDGD	
CC(C)Oc1cc(Br)ccc1C(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1	919994982	NQILACUCYZKJES-LLVKDONJSA-N	434.312	1.367	50	20	IDGD	
CCCCn1c(C)cc(/C=C(\C#N)C(=O)N(C)CC(=O)N[C@@H]2CCS(=O)(=O)C2)c1C	920291298	UUNJGWNKOWOAOB-WAGPWIPHSA-N	434.562	1.574	50	20	IDGD	
COc1cccc(/C=C(/C(=O)NNC(=O)c2ccc3ccccc3n2)n2nnnc2C)c1	920395919	POIAOFQYSLGKOW-MOSHPQCFSA-N	429.440	1.998	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)Nc2cccc(CN3CCC[C@@H]3C(N)=O)c2)c1	920930307	FSRSYLUFWZUYSV-HXUWFJFHSA-N	439.516	1.985	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)c1ccc(NC(=O)c2ccc(O)nc2)cc1	1115856790	HKSRLTAAPAMMER-SFHVURJKSA-N	434.408	1.641	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@H]2CC(=O)N(c3ccc(C#N)cc3)C2)cc(OC)c1OC	1115909058	UVWCEGFEWFXWNL-HNNXBMFYSA-N	438.440	1.398	50	20	IDGD	
O=C(NNC(=O)N1CCC(C(=O)c2cccs2)CC1)c1csc(N2CCOCC2)n1	1116223323	PCZJLTHZQIRBCO-UHFFFAOYSA-N	449.558	1.991	50	20	IDGD	
O=C(NCCNS(=O)(=O)c1ccc(F)cc1F)NNC(=O)c1ccccc1Cl	1321355094	LUWFGGKNGUJTPC-UHFFFAOYSA-N	432.836	1.541	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)NNC(=O)[C@@H]1CS[C@H](Cc2ccccc2F)C(=O)N1	1337242081	IJUMSJXHKKQIDN-RBUKOAKNSA-N	440.500	1.840	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H]1CC(=O)N(C3CCCC3)C1)C2)[C@@H](F)Cl	1778021944	FCGCWMVOOZICMV-BHNHYPNCSA-N	443.947	1.826	50	20	IDGD	
Cc1nc2sccn2c1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](C)Br)CCO2	1778721612	KCWVJBPDBIVNKT-APPDUMDISA-N	441.351	1.931	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc3ncnn3c2)C1	1779172164	XFUAZHUCZFFGDQ-JXXFODFXSA-N	435.912	1.111	50	20	IDGD	
CN1CCCC[C@@H]1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Br)C2	1780593404	QWHILTAHSBDXRH-ZXFNITATSA-N	434.350	1.675	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccccc2C(N)=O)C1	1780990967	ORNQFSWBBGFLOT-XMSQKQJNSA-N	447.608	1.765	50	20	IDGD	
Cc1cccc(Cl)c1C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1	1781723532	RHABGTMKKGXDEI-QFIPXVFZSA-N	442.708	1.086	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1ccc(O)cn1)C2	1782001612	HOMFODZFSTXYNJ-VVFCZOMOSA-N	440.338	1.627	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CSc1nc[nH]n1)C2	1782002074	LXURMLIXSFCIHH-XHBSWPGZSA-N	446.371	1.194	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc3n(n1)CCCO3)C2	1782176059	WTHGEXOWKUPMHS-YYFZDKIDSA-N	440.928	1.047	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C=C/c2cnc[nH]2)C1	1782428131	ALWUXYTWDAMOAO-SOCMVBSASA-N	439.354	1.968	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@]2(C1)CN(C(=O)c1csnn1)CCO2	1782861813	KRZTXPOQQBEMOH-FZXOMJPYSA-N	445.451	1.867	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)CSc3ncccn3)CCO2)C1	1783341279	CMXWRFNXUIIKSU-SUMWQHHRSA-N	443.367	1.572	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cccc(=O)n3C)CCO2)C1	1783344984	VIBDHRYZVRIBCF-ACJLOTCBSA-N	426.311	1.002	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)Cc3ccc(O)cn3)CCO2)C1	1783354280	OPYOOCZWHATCGL-YJBOKZPZSA-N	426.311	1.333	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)C34CC(C(=O)OC)(C3)C4)C2)C1	1783446160	JLFUSXYOMRJOEL-GPIZFROPSA-N	443.338	1.333	50	20	IDGD	
COC(=O)N(CC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Cl)CCO2)Cc1ccccc1	1783693074	XQPPSTKCEHDTHV-XLIONFOSSA-N	441.887	1.619	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)CCc3c[nH]c4ncccc34)CCO2)C1	1783883857	MDDZSKHPAZMMIX-DYESRHJHSA-N	434.924	1.579	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cc(OC)c(C)c(OC)c3)CCO2)C1	1783884106	PSSFGYCUZLQCHX-HRAATJIYSA-N	440.924	1.710	50	20	IDGD	
O=C(/C=C/C(=O)N1CCO[C@]2(CCN(C(=O)C(Cl)Cl)C2)C1)NCc1ccco1	1783945944	FZKJXZLVVZPBHK-OAJJDEHYSA-N	430.288	1.086	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]2C1	1783974556	PVRPFNHWGYRPJE-QMVSFRDZSA-N	425.751	1.251	50	20	IDGD	
CCC[C@@H](NC(C)=O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]2C1	1783975405	OCTZEDQTCCLDEO-GWFJUFKTSA-N	446.386	1.302	50	20	IDGD	
Cc1ccc2nc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)[C@@H](O)CCl)C[C@@H]43)sc2c1	1786262002	OHRQMXZYZMSEBB-SDADXPQNSA-N	437.949	1.798	50	20	IDGD	
CCC[C@@H](Cl)C(=O)Nc1ccc(C2(NC(=O)CN(CCO)CCO)CCC2)cc1	1786446746	PJEQAMRQMUXTLH-GOSISDBHSA-N	425.957	1.815	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)Nc3cccnc3)[C@H]2C1	1786866455	WXEYZPFMGFTQRV-BJMQQELFSA-N	439.354	1.645	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](N)Cc3cccnc3)[C@H]2C1	1787474556	AWZNAUCXWWXCFL-DRCYAFTPSA-N	443.375	1.167	50	20	IDGD	
CC(C)(NCCC#N)C(=O)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1	1788029303	GFDCRONVRIFDJH-UHFFFAOYSA-N	448.332	1.396	50	20	IDGD	
CCn1nc(C)cc1C(=O)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1	1788143847	OUEULQBCKVLJMR-UHFFFAOYSA-N	446.316	1.953	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)c1ccnc2c(O)cccc12	1790498322	ALZKNPXXRSNGOE-FRJURHEUSA-N	433.892	1.133	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)COc3ccccc3F)[C@H]2C1	1790968090	MRVRXKWXEUFJRD-FHIRATQRSA-N	443.313	1.968	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(C4CC4)on3)C[C@@H]21	1791054469	IUDVXQQMDFLBPH-LESCFKLSSA-N	426.311	1.929	50	20	IDGD	
CNc1nsnc1C(=O)NC1(c2ccc(NC(=O)CCC(=O)NN(C)C)cc2)CCC1	1791595645	LPEWWRKVYAPZAQ-UHFFFAOYSA-N	445.549	1.701	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3cnccn3)[C@H]2C1	1791659768	DRKMQQFEXWTWKG-QBWPOKONSA-N	429.348	1.625	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCCN1C(=O)c2ccccc2C1=O)[C@@H](O)CCl	1794125721	YGAAHUJHNWLCCF-KRXQYRFLSA-N	447.919	1.301	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1CCN(Cc2ccccn2)CC1)[C@H](O)CCl	1794443962	GTPYKQVNFBNPPT-IYWMVGAKSA-N	434.968	1.532	50	20	IDGD	
Cc1ccc(OCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)Br)C3)cc1	1795308066	AIZQCIVFZMTTPX-AFIMGQEJSA-N	425.323	1.747	50	20	IDGD	
O=C(Cc1cc(F)cc(F)c1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1	1796191237	OFNZSYPZNOTEIQ-ACDBMABISA-N	428.244	1.139	50	20	IDGD	
Cc1cc2nnc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)[C@@H](F)Br)C4)c(C)n2n1	1797439706	GSYSUEFUWGEZAW-NWJSVONSSA-N	439.289	1.683	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nnc(-c3ccccc3)o1)C2	1797957014	XHMAXVCKGPAEEQ-ALXJQNPVSA-N	444.564	1.791	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2)c1ccc(Br)cn1	1798032874	WRXJHRQDJXQWJK-BZBKMWRSSA-N	437.121	1.851	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H]1CCOC1)C2	1799220431	NJGJJDYQYWWGNO-JONQDZQNSA-N	431.445	1.808	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(Cl)c(F)c1)c1cccc(B(O)O)c1	1800335205	MPRAKAFPFAIHMW-BJWYYQGGSA-N	430.672	1.725	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1csc(C)n1)C2	1800640251	NKXPBXVWCLURFR-LMWOUKEDSA-N	430.368	1.757	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)ccc1O)C2	1800643075	KWSGQJAURBPSRL-VAECKANCSA-N	427.295	1.475	50	20	IDGD	
CCC[C@@H](NC(C)=O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](Br)CC	1800645206	VSPNBSIINNMJNI-YIDVYQOGSA-N	432.359	1.054	50	20	IDGD	
C[C@H](NNc1ccccc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)Br	1800754888	YJMYKSUQPVPPAW-LBKYZSNHSA-N	439.354	1.365	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCOCCOCCOC	1800836720	DGBVBDMJIYUFSL-SFNKJDCFSA-N	434.961	1.053	50	20	IDGD	
C[C@@H](Cc1ccccn1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)CBr)C2	1801223456	ZLWFBMUZSHORQM-WXQHOCMDSA-N	438.366	1.881	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1C[C@H](NC(=O)OC(C)(C)C)C1	1802085061	LZZRJYGWRFMZHQ-XJTKPRQNSA-N	443.972	1.897	50	20	IDGD	
Cc1ccc(OCCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CCC(=O)NN(C)C)cc1	1802328855	GRSTYVVAAFXTKS-REPLKXPHSA-N	430.549	1.775	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@H]1CCN(C(=O)CS(C)(=O)=O)[C@@H]1c1cccnc1	1803009271	SGDPYJPDMKHYML-XNRPHZJLSA-N	446.367	1.163	50	20	IDGD	
Cn1cc(C(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)c2cccnc21	1803143266	XYRNSFWEJRGMBF-LZQZEXGQSA-N	441.919	1.888	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CCCN1C(C)C	1803336978	KSLWSVRMEUOUBE-NVQWDPAISA-N	442.564	1.631	50	20	IDGD	
Cc1cc(NC(=O)CC(=O)N2CCC3(CCCN(C(=O)[C@H](O)CCl)C3)CC2)no1	1805523841	WSWGTRFLRWBPKQ-CQSZACIVSA-N	426.901	1.143	50	20	IDGD	
CN1CCN(CCC(=O)NC[C@H]2CCN(C(=O)C(Cl)Cl)[C@H]2c2cccnc2)CC1	1806915735	COPPDYBVOZIUST-AEFFLSMTSA-N	442.391	1.529	50	20	IDGD	
C[C@]1(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)CC1(F)F	1807368225	QOZALESFYCOMTE-YRISNDGFSA-N	443.259	1.126	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)Cc2ccsc2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1	1807370371	CBOGJXCINCGFCB-SIKLNZKXSA-N	449.341	1.385	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@H]1CCN(C(=O)c2n[nH]cc2[N+](=O)[O-])[C@H]1c1cccnc1	1810544949	VLQKHWOQURZUSZ-KDOFPFPSSA-N	446.540	1.884	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)c1cccc2nccn12	1812172550	FECBUPBJBMVHTI-KVSKMBFKSA-N	427.892	1.649	50	20	IDGD	
CC(C)[C@H](S)C(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1813069092	UZCXVONTEVTVMF-VDGAXYAQSA-N	435.594	1.415	50	20	IDGD	
C[C@H](C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)n1cccc1	1813308625	DHBOURODFWJWKF-ZNLUXHQJSA-N	446.316	1.144	50	20	IDGD	
O=C(Cc1ccsc1)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1	1815339359	AQFPOSDOZYANGG-HNNXBMFYSA-N	441.343	1.353	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@](C)(O)C(F)(F)F)n[nH]1	1815533537	NKCRBVHCUYGZDM-CCUNJIBTSA-N	426.823	1.969	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCc2cn[nH]c2)n[nH]1	1815878059	URLBVLXCSNXVGM-MRXNPFEDSA-N	430.513	1.131	50	20	IDGD	
Cc1cc(C)nc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)c1	1817725905	KILBCIZNGCTCGK-HXUWFJFHSA-N	447.304	1.721	50	20	IDGD	
Cc1cnc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cnccc3C(=O)NN)n[nH]2)cn1	1819402096	MRJJJEBNALBQBS-QGZVFWFLSA-N	449.475	1.126	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1cccc(F)n1	1819735119	RQMBUDXXDYGMIJ-KRWDZBQOSA-N	437.240	1.243	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](F)Br)n[nH]1	1820932767	PGYKXCRYLGXAHX-PEXQALLHSA-N	433.282	1.539	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1)c1cnc2c(c1)CCNCC2	1821698768	OIFCVEAUCSLHII-MSOLQXFVSA-N	446.939	1.399	50	20	IDGD	
Cc1nn(C)c(C)c1C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1	1822411028	XDJFOGCOXPZPSZ-INIZCTEOSA-N	444.540	1.439	50	20	IDGD	
Cc1nc(CC(=O)N[C@H]2CCc3nc(NC(=O)[C@H](F)Br)sc3C2)no1	1823001330	CRXOOGAHBSIFLO-MADCSZMMSA-N	432.275	1.680	50	20	IDGD	
CC[S@](=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1	1823006366	AATFINAULWGKHY-VCYSJNDCSA-N	440.360	1.904	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC([C@H]2CCCCN2C(=O)CN2CCOCC2)CC1	1826717721	HWNBOCSFNOQSMO-DOTOQJQBSA-N	430.387	1.722	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3snnc3C3CC3)C2)C1	1830357865	MWVSNPONMVVVFS-LJQANCHMSA-N	442.969	1.751	50	20	IDGD	
CC(C)=NO[C@@H](C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1	1830419259	NRJJUXVORPECFY-HKUYNNGSSA-N	437.585	1.780	50	20	IDGD	
Cc1n[nH]c(C)c1CC(=O)N1CCCC[C@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1	1830437559	QEMHEUYXRQIPRC-FQEVSTJZSA-N	446.596	1.562	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1830732830	BMLSOYGUAIRSHA-HNAYVOBHSA-N	447.315	1.018	50	20	IDGD	
CCNC(=S)NCC(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@H](C)Br)CC1	1831092698	AJHPHHUAEFUBPU-ZFWWWQNUSA-N	447.443	1.874	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CC3CCN(C)CC3)C2)C1	1831638755	GFFALGDHHIHWSX-WIYYLYMNSA-N	429.989	1.582	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC([C@H]2CCCCN2C(=O)CN2C(=O)C=CC2=O)CC1	1831987484	HYDXAEDZFDDFJG-UKRRQHHQSA-N	440.338	1.315	50	20	IDGD	
Cc1ccc2[nH]cc(CC(=O)N3CCO[C@@]4(COCCN(C(=O)[C@H](O)CCl)C4)C3)c2c1	1832741332	QIOCVGBXLDLBJF-KNQAVFIVSA-N	449.935	1.075	50	20	IDGD	
Cc1ccc(C(=O)NCC(=O)N2CCCC[C@H]2C2CCN(C(=O)[C@H](O)CCl)CC2)cc1	1832911293	ZHUHQXCCPHYLOS-VQTJNVASSA-N	449.979	1.944	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3nc(C)sc3C)CCO2)C1	1833149703	DTQZERILJYTQIN-BEFAXECRSA-N	445.969	1.013	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(Cl)nc3F)CCO2)C1	1833267222	LBEDZSVEGDBLNY-UGSOOPFHSA-N	434.295	1.962	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(C(C)=O)[nH]n3)CCO2)C1	1833820983	PMNYKBDCSSINDY-KUHUBIRLSA-N	426.901	1.090	50	20	IDGD	
COC(=O)CCC(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)Br)CC2)CC1	1834436195	KTIRAUDPYPWGJI-CYBMUJFWSA-N	432.359	1.295	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)CC3CCCC3)CC2)CC1)c1cccc(B(O)O)c1	1834800915	AOMBGVXUWJUFCS-UHFFFAOYSA-N	441.381	1.132	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC1CCN(C2CCN(C(=O)[C@H]3CCCCO3)CC2)CC1	1835835168	RKUATZYIHKKDBC-LJQANCHMSA-N	425.646	1.979	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnc(N)s3)CCO2)C1	1835846207	BAJIBYNHNLFOEN-JKSUJKDBSA-N	437.349	1.032	50	20	IDGD	
CCc1noc(C)c1C(=O)NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1835958664	KTOADBZTTPCXJV-KRWDZBQOSA-N	426.945	1.330	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3cc(O)no3)CC2)CC1	1835977319	GSQWIMFGKUHUEK-CQSZACIVSA-N	443.342	1.739	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)C3CCOCC3)CC2)CC1)[C@@H](F)Br	1836412821	XCPMRQRTWNCDRL-MRXNPFEDSA-N	434.350	1.675	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)Cn3cc([N+](=O)[O-])cn3)CC2)CC1	1837135192	YUCHBKCJQACNRJ-QGZVFWFLSA-N	441.916	1.807	50	20	IDGD	
CCc1oncc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2	1839151517	VCJQMDBLRFLETA-QZTJIDSGSA-N	434.320	1.543	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)nc1	1839198056	RLNDSIWHYOXMPJ-PBHICJAKSA-N	430.274	1.151	50	20	IDGD	
C[C@H](C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2)c1ccccc1	1839203669	RMPBJUNCWSBRRO-URLQWDBASA-N	443.313	1.937	50	20	IDGD	
Cc1nc2ccc(F)cn2c1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1839526786	XPDGQGHOGZQOEL-QFBILLFUSA-N	442.850	1.386	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnc4cc(C)ccn34)CCO2)C1	1839602048	IBMFKPCIUIFPPN-IERDGZPVSA-N	434.924	1.730	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cc(C)no3)C2)C1	1839962565	KSJJMGIWQGNHSO-CRAIPNDOSA-N	444.326	1.155	50	20	IDGD	
CCOc1ccsc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](Cl)COC)CCO2	1840149362	MPJSKQNVKJXBIB-LIRRHRJNSA-N	446.953	1.471	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(C)c(OC)c3)C2)C1	1840154553	ZGIWQSITDKGQKF-UTKZUKDTSA-N	440.924	1.327	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)C[C@@H]3C[C@@H]4CC[C@H]3C4)C2)C1	1840155410	BCDBOXWKNKITPD-XNXCGYLDSA-N	428.957	1.523	50	20	IDGD	
Cc1ccc(CCC(=O)N2CCOC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)cn1	1840186640	RUVHALUDDCXNCK-IBGZPJMESA-N	430.332	1.583	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840187771	VZXNLXAAZFFSRA-IBGZPJMESA-N	441.315	1.516	50	20	IDGD	
COc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)cc1OC	1840188760	ALDUNYQBNPHSPB-LJQANCHMSA-N	447.315	1.578	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)c1cccs1)CCO2	1840378135	IEWZMEMMJVDHKU-DOXZYTNZSA-N	430.954	1.562	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(CO)c(F)c3)CCO2)C1	1840781660	DIYXNAUJELTWJZ-UWJYYQICSA-N	442.915	1.796	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC12CN(C(=O)c1cnc3c(c1)CCNCC3)C2	1841289201	PHYJYCAOZYRZMI-CQSZACIVSA-N	435.366	1.618	50	20	IDGD	
Cc1ccc2[nH]c(C(=O)N3CC4(CCCN4C(=O)c4cnccc4C(=O)NN)C3)cc2c1	1844264177	PQXXGTLAAKDZEK-UHFFFAOYSA-N	432.484	1.606	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)c1cc(O)n[nH]1)C2	1844692440	XSMPSWFIRWDOGT-UHFFFAOYSA-N	429.389	1.080	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H]1C(=O)N1CC2(CCCN2C(=O)[C@@H](F)Br)C1	1845216240	DHWWHHBXKWSDMF-VXGBXAGGSA-N	434.306	1.890	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)c1c(C)nn(-c3ccccc3)c1O)C2	1846360934	OBCJVBQZFYDOPE-INIZCTEOSA-N	432.908	1.957	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H](O)C[C@H]1C(=O)N1CC2(CCCN2C(=O)C(Cl)Cl)C1	1846389035	WGRBVFIAOHQPMZ-NEPJUHHUSA-N	436.336	1.364	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2ccc(CO)c(F)c2)C1	1846912883	OHQGQGKDHOWAJK-AFUMVMLFSA-N	441.463	1.269	50	20	IDGD	
O=C(c1cnc2cc(C(F)(F)F)ccn12)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl	1847562292	AUBMLBHGVURZJQ-OBJOEFQTSA-N	430.814	1.768	50	20	IDGD	
CC(C)CSc1ccc(S(=O)(=O)NCC(=O)NNC(=O)CC(C)C)cc1[N+](=O)[O-]	10160162	CRYLFYXOMNBUEZ-UHFFFAOYSA-N	446.551	1.815	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)[C@H]2CC(=O)Nc3cc(F)ccc32)ccc1Cl	10414956	AIDPWYFNBRJLIX-NSHDSACASA-N	440.840	1.014	50	20	IDGD	
Cc1cc(C(=O)NNc2nnc(C)c(=O)[nH]2)cc(S(=O)(=O)N2CCC(C)CC2)c1C	11548286	OJTXRVNKNYIAFB-UHFFFAOYSA-N	434.522	1.268	50	20	IDGD	
O=C(CCc1nc2ccccc2c(=O)[nH]1)NNC(=O)CCN1CCN(c2ccccc2)CC1	15314483	CAEXBMQRPBSBRH-UHFFFAOYSA-N	448.527	1.215	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2C(=O)N[C@](C)(c3ccc(F)cc3)C2=O)cc1OC	25433717	LCBLADXSOBCEKI-OAQYLSRUSA-N	444.419	1.071	50	20	IDGD	
CSc1nc2nc(C)c(CC(=O)NNC(=O)[C@H](C)Oc3ccc(F)cc3)c(C)n2n1	27198207	MXRZKJWUAHRWAH-LBPRGKRZSA-N	432.481	1.760	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)c2cc(S(=O)(=O)NC3CC3)ccc2C)c1	28637658	YOLRWJWCBBOAPJ-UHFFFAOYSA-N	431.514	1.893	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccn(-c3ccccc3F)n2)c1	106117971	MHRQLCDRALUTRI-UHFFFAOYSA-N	431.449	1.337	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)N[C@H](C)C(=O)N1CCCC[C@@H]1C	726610889	MPOZUCGXULXHHJ-GXTWGEPZSA-N	438.554	1.022	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)N2CCC(N3CCC[C@H]3C(N)=O)CC2)c1C	726800142	GZDGJKHHWLUKIC-CURYZJDOSA-N	427.549	1.599	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2ccc(Br)cn2)ccc1Cl	727364749	CWMQEWHTJGRPBH-UHFFFAOYSA-N	433.671	1.220	50	20	IDGD	
CCCCC(=O)N1CSC[C@H]1C(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12	728018909	WSECUXPVYCASOW-INIZCTEOSA-N	445.545	1.830	50	20	IDGD	
O=C(COC(=O)c1ccn(-c2cccc(F)c2)n1)NNC(=O)[C@H]1COc2ccccc2O1	728334419	YMFRXCIKULWDLS-GOSISDBHSA-N	440.387	1.156	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NC[C@H]2CCN(CCc3ccccc3)C2)cc1	728753716	BXDKYAOQJYUZNQ-LJQANCHMSA-N	426.517	1.969	50	20	IDGD	
O=C(NCc1cccnc1OC1CCCC1)NNC(=O)C1CCN(c2ncccn2)CC1	728948133	WWEGLQJRPKMLMB-UHFFFAOYSA-N	439.520	1.940	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C2=NN(c3ccccc3)[C@H](C(=O)OC(C)(C)C)C2)n1	728959929	LHMPCWLHSGFXLE-SFHVURJKSA-N	440.504	1.624	50	20	IDGD	
CCN(CC)[C@@H](CNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)c1ccco1	729051367	RKISYBAXAKEZJC-KRWDZBQOSA-N	429.525	1.700	50	20	IDGD	
CCOC(=O)C1CCN(C(=O)CN(C)C(=O)NNC(=O)Cn2ccc3ccccc32)CC1	729507074	NUUHIQCZDWNKCF-UHFFFAOYSA-N	443.504	1.116	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)[C@H](c1ccccc1)N1CCC(O)CC1	729531636	LQHJOEGAGKXIGI-NRFANRHFSA-N	444.557	1.768	50	20	IDGD	
Cc1nn(C)c(C)c1-c1cc(C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)n[nH]1	730077369	VGVQRJIMNFIEQZ-UHFFFAOYSA-N	429.506	1.625	50	20	IDGD	
CC(=NNC(=O)c1cccc2ncccc12)c1ccc(S(=O)(=O)N2CCNCC2)cc1	730145844	SQPYXLOZVQHJHC-UHFFFAOYSA-N	437.525	1.983	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)Sc1ccc(S(=O)(=O)N2CCCCC2)cn1	731904703	PKGQQUOYYRJWAG-CQSZACIVSA-N	428.580	1.930	50	20	IDGD	
COc1ccc(CN2C[C@@H](C(=O)NNC(=O)c3cnn(-c4ccccc4)c3)CC2=O)cc1	733108109	GKRCVKREEXRFCC-KRWDZBQOSA-N	433.468	1.691	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN1S(=O)(=O)c1cccs1)c1cnn(-c2ccccc2)c1	733108869	PGAXRQAOKLARQY-INIZCTEOSA-N	445.526	1.548	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNS(=O)(=O)c2cc(F)ccc2F)CC1	734807130	HCVUHDHRHIMEQR-UHFFFAOYSA-N	434.465	1.857	50	20	IDGD	
CN(c1cccc(Cl)c1)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cnn(C)c2)c1	735443945	LKERTPFDHPASSU-UHFFFAOYSA-N	447.904	1.973	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=O)COCc2ccccc2)ccc1OC	737635288	YMPBZIBIEWKUDW-UHFFFAOYSA-N	449.529	1.704	50	20	IDGD	
Cc1oncc1C(=O)Nc1ccc(C(=O)OCC(=O)NNC(=O)c2cccs2)c(O)c1	741009758	QIACBEQRMHOXTF-UHFFFAOYSA-N	444.425	1.620	50	20	IDGD	
CN(C)CCNC(=O)Cn1cc(NS(=O)(=O)c2ccc(CCCCl)cc2)cn1	741653069	DOFBJLXTWPDSIX-UHFFFAOYSA-N	427.958	1.533	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)Cn2nnc([C@H]3CN(Cc4ccccc4)CCO3)n2)c1	742453565	GMXZGUXSRRIRKD-LJQANCHMSA-N	435.488	1.016	50	20	IDGD	
NS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cccc(Br)c2)cc1Cl	743835823	IIDGQQCCNQIDBR-UHFFFAOYSA-N	432.683	1.825	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)CNc1ccccc1[N+](=O)[O-]	743842454	ZQAXPXCFKLHBBD-UHFFFAOYSA-N	426.477	1.366	50	20	IDGD	
COc1ccc(C(=O)N2CCN(CC(=O)NNC(=O)c3cccc(C)c3)CC2)c(OC)c1	744390134	SGCQXIVNMYQEEM-UHFFFAOYSA-N	440.500	1.231	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCc2noc(-c3cccs3)n2)c2ccccc2c1=O	745281522	RXCGSJFLFBPCQR-UHFFFAOYSA-N	439.457	1.672	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2cnnn2-c2ccccc2Cl)c2ccccc2c1=O	745475054	SLQVVSGEESYHPJ-UHFFFAOYSA-N	437.847	1.725	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(C)c(C(=O)NNC(=O)Cc2cn3ccccc3n2)c1	746556320	SUWQLONREAMVIY-UHFFFAOYSA-N	443.529	1.677	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NCc3ccc(F)cc3F)nc2)CC1	746966564	QTKWNVIIUJTRAG-UHFFFAOYSA-N	440.476	1.122	50	20	IDGD	
CCCOc1ccc(C(=O)NNS(=O)(=O)c2ccc(-n3cnnn3)cc2)cc1OC	747407566	RARLHGDKHBCJOQ-UHFFFAOYSA-N	432.462	1.083	50	20	IDGD	
Cc1ccsc1[C@@H]1C[C@H]1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	747693927	RVXCLUPLFSXMPO-IAGOWNOFSA-N	449.554	1.642	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)CCOc3cccc(C=O)c3)cc2)CC1	748621105	YEYHUBBFEBNFDO-UHFFFAOYSA-N	446.529	1.347	50	20	IDGD	
O=C(NCCc1nnc(-c2ccccc2)o1)NNC(=O)c1csc(N2CCOCC2)n1	749201545	AUQGCORNHUXWDJ-UHFFFAOYSA-N	443.489	1.216	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)NCc1ccccc1CN1CCC(O)CC1	749587998	BYCLDGATHHCNHS-UHFFFAOYSA-N	430.480	1.692	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)c1ccc2c(c1)C(=O)N(Cc1ccccc1)C2=O	751207523	YNFRRKBCPKZZPP-UHFFFAOYSA-N	446.419	1.267	50	20	IDGD	
COc1ccc(C(=O)CCC(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1F	751297634	KDWDPTUDZBRDJG-UHFFFAOYSA-N	436.465	1.552	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)CNC(=O)c3cccs3)n[nH]2)cc1OC	751368100	XBFVZAGXVJQAKA-UHFFFAOYSA-N	429.458	1.346	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)c2cc(Cn3cc(Br)cn3)on2)cc1	751540908	MAJAHKYCFVGSDL-UHFFFAOYSA-N	445.233	1.394	50	20	IDGD	
O=C(NNC(=O)[C@H](c1cc(Cl)cc(Cl)c1)N1CCOCC1)C(=O)N1CCCC1	753534771	WEKZIOQQMFLWSF-HNNXBMFYSA-N	429.304	1.137	50	20	IDGD	
COC(=O)c1cc2c(cc1NC(=O)C(=O)NNc1ccc(C(F)(F)F)cn1)OCO2	753842740	XEECWXUGXADXHY-UHFFFAOYSA-N	426.307	1.698	50	20	IDGD	
COc1ccc(-c2nn(CCC#N)cc2/C=C(/C#N)C(=O)NCc2nc(O)n[nH]2)cc1OC	754356160	VIZLDQGLIRYGPC-ZSOIEALJSA-N	448.443	1.528	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)Nc2ccccc2C(=O)N2CCN(C)CC2)c1	755622972	MBVFGNMKQHLWEZ-UHFFFAOYSA-N	441.488	1.558	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)[C@@H]1CCC(=O)N1Cc1ccc(Br)cc1	756724183	KOQKHDUMOOWEIG-INIZCTEOSA-N	431.290	1.725	50	20	IDGD	
C[C@@H]1CN(C(=O)Cn2cc(NC(=O)NNC(=O)Cc3ccc(F)cc3)cn2)C[C@@H](C)O1	756840758	ZHJFEUZVYNBVHV-ZIAGYGMSSA-N	432.456	1.053	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCc2n[nH]cc2C1)c1cccc(S(=O)(=O)N2CCCCC2)c1	756844513	HAMLQIHLNBJBKF-HNNXBMFYSA-N	431.518	1.150	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)n(C2CCN(C)CC2)n1	756921815	XJDNIVGIRYDNGA-UHFFFAOYSA-N	434.522	1.328	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)[C@H](C)NS(=O)(=O)c2ccc(C#N)cc2)c(OC)c1	757198273	LXAKHGBAAAOEIB-LBPRGKRZSA-N	432.458	1.164	50	20	IDGD	
CCN(c1ccccc1)S(=O)(=O)c1cccc(C(=O)NNc2ccc(C(N)=O)nn2)c1	757401776	FLQPEJURJJWKAA-UHFFFAOYSA-N	440.485	1.548	50	20	IDGD	
O=C(CSCc1ccc(F)cc1)N1CCN(S(=O)(=O)CBr)CC1	758524937	ZEZCIXVUFAHENR-UHFFFAOYSA-N	425.345	1.885	50	20	IDGD	
O=C(NNc1ncc(F)cn1)c1cccc(NS(=O)(=O)c2ccc3c(c2)OCCO3)c1	760915053	SIVPGGMSEKSFFJ-UHFFFAOYSA-N	445.432	1.945	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)CSc2ccccc2O)ccc1Cl	763412727	XNAUUCMIZBBPJC-UHFFFAOYSA-N	430.891	1.934	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)Nc1cnccc1-c1cccc(F)c1	763571645	NPFSLEDZFZKYQD-IBGZPJMESA-N	436.399	1.814	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccn([C@@H](C)c3ccccc3)n2)cc1	763659021	HGAFCSSPUYFCGG-HNNXBMFYSA-N	437.456	1.666	50	20	IDGD	
CCCN1C(=O)CCc2cc(NC(=O)C(=O)NNC(=O)COc3ccccc3F)ccc21	763681159	LIXPEDCBZMERQW-UHFFFAOYSA-N	442.447	1.680	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)N(C)CC3)c2ccccc2c1=O	763789922	GTVPWBKPLBSFMU-UHFFFAOYSA-N	448.483	1.369	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)c1cnc2c(cnn2Cc2ccccc2)c1	763818287	FLAISKVFCRLDCR-UHFFFAOYSA-N	429.440	1.066	50	20	IDGD	
Cc1nn(-c2ccccc2)cc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccccc1F	763858106	QJWIYMYHUPHOTC-AWEZNQCLSA-N	425.420	1.873	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cc(F)c(OC)c(F)c2)cc1	763860637	JLAMNGZARVRPJH-NSHDSACASA-N	437.399	1.926	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccccc1C(=O)NC(C)(C)C	763864450	JMQFBFMHQLGOFV-ZDUSSCGKSA-N	444.463	1.907	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccc(O[C@@H]2CCOC2)cc1	763864455	JNGPLWCSPOXAIG-CZUORRHYSA-N	431.420	1.547	50	20	IDGD	
Cc1nc(-c2cccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc3ccc(F)cc3)c2)n[nH]1	763867659	YEGDWJDYXOHUCS-LLVKDONJSA-N	426.408	1.473	50	20	IDGD	
CCN(Cc1ccccc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccc(F)cc1)C(C)=O	763873767	VYDVPMZDSSVELX-CQSZACIVSA-N	444.463	1.748	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Br)s2)cc1[N+](=O)[O-]	763939174	LFRRONRVOATTQJ-UHFFFAOYSA-N	443.235	1.827	50	20	IDGD	
COC(=O)c1c(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)sc(C)c1C	764007059	YLRMTXVPWFRELK-UHFFFAOYSA-N	433.442	1.322	50	20	IDGD	
Cn1c(=O)n(C)c2cc(NC(=O)C(=O)NNC(=O)c3cccc(C(F)(F)F)c3)ccc21	764037675	SVFGAEQCZOYGHS-UHFFFAOYSA-N	435.362	1.296	50	20	IDGD	
CCCN1Cc2cccc(NC(=O)C(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)c2C1	764078608	XUKJCDQMZSIZJE-UHFFFAOYSA-N	444.513	1.215	50	20	IDGD	
CCOC(=O)c1cc(Br)ccc1NC(=O)C(=O)NNC(=O)c1cc(C)[nH]n1	764098465	ODLNTWZEEXOVJE-UHFFFAOYSA-N	438.238	1.057	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)C(=O)Nc2cc(F)ccc2OC[C@H]2CCCO2)c1	764235871	SILYPFUZMOCLAR-MRXNPFEDSA-N	426.404	1.655	50	20	IDGD	
Cc1ncsc1C(=O)NNC(=O)C(=O)Nc1ccn(-c2ncccc2C(F)(F)F)n1	764247503	RJJFHTOZGBFTKS-UHFFFAOYSA-N	439.379	1.451	50	20	IDGD	
COCC(=O)NNC(=O)C(=O)Nc1c(Br)cc(F)cc1Br	764302818	JFKFCWWTZBBNPV-UHFFFAOYSA-N	427.024	1.083	50	20	IDGD	
Cc1cc(C(=O)N2CCCC2)ccc1NC(=O)C(=O)NNC(=O)COCc1ccccc1	764368540	YJPPGCNDZZHJIT-UHFFFAOYSA-N	438.484	1.534	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)Nc2nc(CS(C)(=O)=O)no2)cc1OC	765245998	WYVAGFXQWZGRNS-UHFFFAOYSA-N	441.466	1.268	50	20	IDGD	
COc1ccnc(NNC(=O)NCCOc2ccc(S(=O)(=O)C(F)(F)F)cc2)n1	766834112	VGLRHMBMLOFKQL-UHFFFAOYSA-N	435.384	1.484	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3csc(NC(C)=O)n3)n[nH]2)cc1OC	768279788	SQWUAYGZZIIYGA-UHFFFAOYSA-N	430.446	1.584	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)NCCNS(=O)(=O)c1ccccc1	770129577	RCMZLTWDKNMDFZ-ZDUSSCGKSA-N	440.909	1.416	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)[C@@H]2CC(=O)N(c3c(F)cccc3F)C2)c1	771157190	NUEUBQVRBAHOCG-CQSZACIVSA-N	431.395	1.631	50	20	IDGD	
Cc1cn2c(=O)c(C(=O)NNC(=O)[C@H]3CCCN(C(=O)OC(C)(C)C)C3)cnc2s1	773411988	SQQHZXFHZNEIOP-LBPRGKRZSA-N	435.506	1.473	50	20	IDGD	
O=C(COC(=O)c1cnc(Oc2ccccc2)cn1)NNC(=O)c1ccc([N+](=O)[O-])cc1	773671456	DIVKRSWMMNKZDF-UHFFFAOYSA-N	437.368	1.795	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)n(C2CCOCC2)n1	774003628	ZBNSNQRMDALZFH-CYBMUJFWSA-N	449.895	1.750	50	20	IDGD	
CS(=O)(=O)CCCCCNC(=O)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1	776262424	BVJRVCXRWSVVKS-UHFFFAOYSA-N	431.458	1.821	50	20	IDGD	
O=C(NNC(=O)c1cccc(O)c1O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	776322962	JYQWDZYMCBYGFH-UHFFFAOYSA-N	441.465	1.651	50	20	IDGD	
Cc1cc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)nn1C1CCCCC1	776434071	TZDOUGMMDGLPKU-LJQANCHMSA-N	442.472	1.841	50	20	IDGD	
CC(=O)N1CCN(S(=O)(=O)c2ccc(C(=O)NNc3cc(Cl)ccn3)cc2)CC1	778446504	LGRIJPICBKCSIV-UHFFFAOYSA-N	437.909	1.345	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3cc(O)cc([N+](=O)[O-])c3)n[nH]2)cc1OC	780646626	OHGZYNMLCFBDFF-UHFFFAOYSA-N	427.373	1.783	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1)c1cccn2c(O)nnc12	780922188	USCJTZDUYFXEGA-HXUWFJFHSA-N	442.479	1.823	50	20	IDGD	
CC(C)Cn1nc(C(=O)NNC(=O)CCNC(=O)OC(C)(C)C)c2ccccc2c1=O	780971793	SDCZAKSGZZNZSF-UHFFFAOYSA-N	431.493	1.728	50	20	IDGD	
CN(C)c1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c2ccccc2n1	780977518	DCPVKOSBVJMDQO-UHFFFAOYSA-N	441.513	1.626	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)c2nnn(Cc3noc(C)n3)c2C)c1	781854304	DONIGBUPFDXCFW-UHFFFAOYSA-N	427.465	1.598	50	20	IDGD	
O=C(NNc1nc2ccccc2s1)C(=O)Nc1ccc(C(=O)N2CCOCC2)c(F)c1	782813943	SOYNAGKCBVONBY-UHFFFAOYSA-N	443.460	1.990	50	20	IDGD	
CCCc1ccc(NC(=O)C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)cc1	782897378	ODUZVRQYJGJGSD-UHFFFAOYSA-N	431.518	1.640	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2cc(C(=O)N3CCOCC3)ccc2OC)cc1	783040009	YVDHGZUUXDXSDS-UHFFFAOYSA-N	428.445	1.258	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2cccc3c2ccn3C)nc1	783265928	ZYUPIHZLVSRWIE-UHFFFAOYSA-N	430.490	1.342	50	20	IDGD	
O=C(NNc1cncc(Cl)n1)C(=O)Nc1cccc(N2CCN(CC3CC3)CC2)c1	783266654	XHQCIGAPFAIEJL-UHFFFAOYSA-N	429.912	1.744	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2ccc(N3CCCCCCC3)c(F)c2)CCS(=O)(=O)C1	783428462	VLTGFDAWDFCWIE-FQEVSTJZSA-N	440.541	1.733	50	20	IDGD	
Cc1cc(C(=O)NCC(C)C)ccc1NC(=O)C(=O)NNc1cccc(S(C)(=O)=O)c1	784842356	ZAJRTRYTCSLVIJ-UHFFFAOYSA-N	446.529	1.866	50	20	IDGD	
CS(=O)(=O)NCc1ccc(NC(=O)C(=O)NNc2cc(C(F)(F)F)ccc2F)cc1	785170126	AYOHJGUMOWJPMV-UHFFFAOYSA-N	448.398	1.976	50	20	IDGD	
O=C(COc1cccc(I)c1)NNC(=O)COc1ccccc1O	787336125	ZBXKPLQXFXOEFW-UHFFFAOYSA-N	442.209	1.602	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(-c3ccsc3)nn2C)c(OC)c1	787542287	IWXKFEICXDWISC-UHFFFAOYSA-N	429.458	1.566	50	20	IDGD	
CCS(=O)(=O)CCn1cc(C)c(NC(=O)C(=O)NNc2nc3ccccc3cc2C)n1	787575517	JRIKJLAZMSKVRI-UHFFFAOYSA-N	444.517	1.565	50	20	IDGD	
Cc1cc(Br)ncc1NC(=O)C(=O)NNC(=O)[C@H]1OCC[C@H]1c1ccccc1	789813471	UKUHCLROZVIPIQ-BBRMVZONSA-N	447.289	1.811	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cc(Cl)cc(F)c2N)cc1OC	791478896	VPTBSFQRBXQNPA-UHFFFAOYSA-N	425.800	1.697	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NC[C@@H](C)NC(=O)OC(C)(C)C	792253110	FCZKZDLDXPYNBC-LLVKDONJSA-N	442.542	1.145	50	20	IDGD	
CNS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2ccc(OCCC(C)C)cc2)nc1	792394598	RQUUFCGCLJIIJP-UHFFFAOYSA-N	435.506	1.881	50	20	IDGD	
O=C(NNC(=O)c1cccc(C(=O)Nc2ccccc2)c1)c1ccc(-n2cnnn2)cc1	794784425	NOFAJVDPEKAAIQ-UHFFFAOYSA-N	427.424	1.989	50	20	IDGD	
CCOc1cc(Cl)ccc1NC(=O)C(=O)NNC(=O)CNC(=O)OCc1ccccc1	797369243	QXCCYORZKVTDGU-UHFFFAOYSA-N	448.863	1.751	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N1CC[C@@H]2NC(=O)OC[C@H]2C1	798510785	YCOPACDCNOOGPZ-GYSYKLTISA-N	441.282	1.388	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)NCCNS(=O)(=O)c1ccc(Cl)cc1F	799666354	HPFVSONSDCGWON-UHFFFAOYSA-N	446.863	1.470	50	20	IDGD	
CNC(=O)CNC(=O)c1cccc(NC(=O)NNC(=O)c2cc(C)nc3ccccc23)c1	800595210	URZLLXDUPLIDMQ-UHFFFAOYSA-N	434.456	1.486	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2c(F)ccc([N+](=O)[O-])c2C)cc1	800621900	BHARXLQUSPINPR-GFCCVEGCSA-N	446.391	1.798	50	20	IDGD	
CCc1ccccc1-n1cc(O)c(C(=O)OCC(=O)NNC(=O)Cc2nc(C)cs2)n1	801417595	CVEBHCBRVUQNLD-UHFFFAOYSA-N	443.485	1.452	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)Cc2ccc(C(=O)NNC(=O)[C@@](C)(O)C3CC3)cc2)cc1	804148095	VVZWQYFRPQSPAI-QFIPXVFZSA-N	445.541	1.738	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)O[C@H](C)c2nncn2C)cc1	805361293	VJINYRMMWNIXGC-DWKHYPNZSA-N	449.471	1.774	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccc(F)cc1OC1CCOCC1	806976025	ZSSYWHSNTYJHQG-UHFFFAOYSA-N	433.411	1.851	50	20	IDGD	
COc1ccc(CN2CCN(C(=O)NNC(=O)c3c(C)nc4ccccn34)CC2)cc1F	807113662	FWFLOSFHALQDNA-UHFFFAOYSA-N	440.479	1.963	50	20	IDGD	
Cc1cc([N+](=O)[O-])ccc1NNC(=O)C(=O)Nc1ccc(C[C@@H]2CC(=O)NC2=O)cc1	807456408	KSYYYOOOHYFUAQ-CYBMUJFWSA-N	425.401	1.190	50	20	IDGD	
CC(C)Oc1ccc([C@H](CNC(=O)NNC(=O)C(=O)Nc2ccccn2)N(C)C)cc1	807588030	JPTXJFNMCNLJLB-KRWDZBQOSA-N	428.493	1.441	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)[C@H]2C[C@H](c3ccccc3)OC2=O)ccc1Cl	809555608	BNEGWYCQZTUPSE-TZMCWYRMSA-N	437.861	1.053	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCC(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)cc1	810346113	CVSKXVQFEMLFML-UHFFFAOYSA-N	433.458	1.413	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCO1)C(=O)Nc1ccc(Cl)c(C(=O)Nc2ccccc2)c1	815779563	LDUOUTIHXFKRIS-MRXNPFEDSA-N	430.848	1.857	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1ccc(O)c(C(=O)NNC(=O)c2ccc[nH]2)c1	843442986	KJIZCMCYFZSUHT-UHFFFAOYSA-N	430.442	1.605	50	20	IDGD	
O=C(Cc1ccccc1O[C@H]1CCOC1)NNC(=O)C(=O)NCc1ccc(Cl)cc1	857479897	SNGUDZCPBNLOOD-KRWDZBQOSA-N	431.876	1.514	50	20	IDGD	
O=C(COC(=O)CCS(=O)(=O)c1ccc(F)cc1)NNC(=O)c1ccc(Cl)cc1	913219512	QMIZFDTWCCIGOH-UHFFFAOYSA-N	442.852	1.647	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)CNC(=O)c2cccc(Br)c2)cc1	913429677	RYKFACYLCSEWAK-UHFFFAOYSA-N	435.278	1.447	50	20	IDGD	
COc1ccc([C@@H](CNC(=O)NNC(=O)c2c(C)nc3ccccn23)N(C)C)cc1OC	915898081	QJQAUAJZJGLELK-MRXNPFEDSA-N	440.504	1.907	50	20	IDGD	
Cn1ccnc1[C@@H](NC(=O)NNC(=O)c1nnc(O)c2ccccc12)c1cccc(F)c1	916224709	PTBWEIRDQISZEZ-INIZCTEOSA-N	435.419	1.942	50	20	IDGD	
CNS(=O)(=O)Cc1ccc(CNC(=O)NNC(=O)COc2cc(C)cc(C)c2)cc1	916229191	UBOHUFORXJEEMX-UHFFFAOYSA-N	434.518	1.262	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCOCC(F)(F)F)c1	916326764	PAECIMOAMZXFNR-UHFFFAOYSA-N	440.444	1.240	50	20	IDGD	
CC(=NNC(=O)COc1ccc(F)cc1)c1ccc(OCC(=O)N2CCOCC2)cc1	916330999	BKIJZICZYDOPEW-UHFFFAOYSA-N	429.448	1.983	50	20	IDGD	
CC(=NNC(=O)c1sc(N2CCOCC2)nc1C)c1ccc(OCC(=O)N(C)C)cc1	916339879	XTAYUHRHWAGXAX-UHFFFAOYSA-N	445.545	1.909	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NC[C@H](c1ccsc1)N(C)C	916450024	XJSLKUVVBHCJQP-CQSZACIVSA-N	438.579	1.597	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@@H]2CCC[C@H]32)cc1	916585279	WIVWIYMLVWFLRO-RXABAKJHSA-N	434.562	1.771	50	20	IDGD	
Cc1nc2cc(F)cc(C(=O)NNC(=O)c3csc(N4CCOCC4)n3)c2nc1C	916746204	BTTBFNUUKXIVSK-UHFFFAOYSA-N	430.465	1.754	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)nc1)c1ccc(S(=O)(=O)NC[C@H]2CCCO2)cc1	917253343	FMWIDPHQKAEJDP-CQSZACIVSA-N	438.893	1.267	50	20	IDGD	
CCNC(=O)COc1cccc(CNC(=O)NNC(=O)c2ccc3c(c2)OCCO3)c1	918090548	HUDDYPCLOLQADL-UHFFFAOYSA-N	428.445	1.117	50	20	IDGD	
CC[C@H](NC(=O)NNC(=O)COc1ccccc1C#N)c1ccccc1OCC(=O)NC	918221437	JKVBEYVRFRISIM-KRWDZBQOSA-N	439.472	1.544	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)CCC/N=C2/NS(=O)(=O)c3ccccc32)cc1	919836188	BQGKJEDTLXOOJV-UHFFFAOYSA-N	444.513	1.294	50	20	IDGD	
Cc1ccc(OCc2nc(CC(=O)NNC(=O)N[C@H]3CCS(=O)(=O)C3)cs2)cc1	919889442	MCAVODSHJBESOS-ZDUSSCGKSA-N	438.531	1.091	50	20	IDGD	
COc1cc(C=NNC(=O)N[C@@H]2CCS(=O)(=O)C2)ccc1OC(=O)c1ccccc1F	920379696	AFEFTVZZJLJQCP-CQSZACIVSA-N	449.460	1.874	50	20	IDGD	
COc1cccc(/C=C(\C(=O)NNC(=O)c2c(C)nc3ccccn23)n2nnnc2C)c1	920431708	NTFKGUFGNXIKEQ-SFQUDFHCSA-N	432.444	1.406	50	20	IDGD	
O=C(CCCOc1ccc(I)cc1)NNC(=O)CN1CCCC1=O	920433673	XRGGSSJDCFOPSJ-UHFFFAOYSA-N	445.257	1.220	50	20	IDGD	
CCCCNC(=O)NNC(=O)[C@H](CCS(C)(=O)=O)NC(=O)c1ccccc1Cl	920764880	QLONELPWHWHZOS-AWEZNQCLSA-N	432.930	1.004	50	20	IDGD	
COC(=O)c1cc(CNC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)oc1C	1248704224	ZQUBMXDQBSBPJJ-UHFFFAOYSA-N	437.478	1.120	50	20	IDGD	
COc1ccc([C@@]2(C)NC(=O)N(CC(=O)NNc3ccc(C(C)(C)C)nn3)C2=O)cc1	1318944580	KRJUVLADGWJHAG-OAQYLSRUSA-N	426.477	1.693	50	20	IDGD	
COc1cccc(C(=O)NCC(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)c1	1320001899	HHIWCNHHYAAIDE-UHFFFAOYSA-N	434.493	1.220	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)c2ccc(N3CCNC3=O)cc2)CC1	1321909648	JXOWBJOVNUTQTM-UHFFFAOYSA-N	431.493	1.624	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)c1ccccc1)C(=O)NNc1nncc(N)c1Cl	1322679728	RZEUCLBEPBVTPN-GFCCVEGCSA-N	430.943	1.256	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)CCN3Cc4ccccc4C3=O)C2)C1	1778187096	UIPYRKUVDDNFID-AVRDEDQJSA-N	449.935	1.116	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)CCN3Cc4ccccc4C3=O)C2)C1	1778187100	UIPYRKUVDDNFID-GCJKJVERSA-N	449.935	1.116	50	20	IDGD	
O=C1Nc2c(cccc2C(=O)N2CC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)C1=O	1778714348	PZRBRLYZBAEEML-GOSISDBHSA-N	426.256	1.069	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@](C)(Cl)CCl)C1	1780712750	WYMXZPHNEPCQBO-TWKYDXJASA-N	434.364	1.427	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Br)C1)C1(O)CCC1	1780770268	KKGZVVWMVYRQMI-VMUDFCTBSA-N	435.334	1.742	50	20	IDGD	
Cc1noc(C)c1CCC(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781325927	KBMTYDPQXBUJJX-NVXWUHKLSA-N	432.290	1.744	50	20	IDGD	
C[C@H](Oc1ccccc1)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781333716	ISKPXSFQJWMJAW-JCKWVBRZSA-N	429.286	1.974	50	20	IDGD	
O=C(CCCc1cccnc1)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781335567	VWXHAAZQARVFNL-AEFFLSMTSA-N	428.302	1.925	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1n[nH]c(C3CC3)c1F)C2	1782170912	FSJUZVNDMWSSTA-LRDNONRASA-N	442.919	1.808	50	20	IDGD	
O=C1CSc2ncc(C(=O)N3CC[C@@]4(C3)CN(C(=O)[C@@H](F)Cl)CCO4)cc2N1	1782425867	UNCKFJATGUDLOV-CXAGYDPISA-N	428.873	1.104	50	20	IDGD	
CO[C@H](C)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](Br)Cc3ccccc3)C2)C1	1783021737	GMTZVGBWWDAEDQ-SYNHAJSKSA-N	439.350	1.857	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H]3CCCO3)C2)C1	1783479465	CJLGYNBUXHRVEO-BXTJHSDWSA-N	445.944	1.127	50	20	IDGD	
C[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@@]2(CN(C(=O)CCBr)CCO2)C1	1783709387	YYEIAMYVNQOYFU-FZKQIMNGSA-N	448.358	1.515	50	20	IDGD	
COC(=O)CCCCCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1784051574	TWHGUUDMASXKHQ-WBVHZDCISA-N	437.306	1.630	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3cnc4ccccc4c3)C[C@@H]21)[C@H](O)CCl	1784083712	GIECLMLIAIVBEQ-MMKMLUHNSA-N	445.947	1.747	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(-c4cc[nH]n4)cc3)C[C@@H]21)[C@H](O)CCl	1784092615	RABYUWGXSMZUCC-DKKFBQAASA-N	432.908	1.270	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CC3CC3)C[C@@H]21	1785076467	KFRFITXCGWCRFV-QAETUUGQSA-N	443.972	1.898	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3ccc(F)nc3)[C@H]2C1	1785235707	HXVVVARCWREVKF-TUUVXOQKSA-N	442.329	1.916	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3CNc4ccccc43)[C@H]2C1	1786879325	PLZOTZFOCQMAMP-LHAWGNPOSA-N	436.350	1.959	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]2C1)N1CSCSC1	1787446405	IKYQUKMAGBXYAH-IKOXMDCHSA-N	425.979	1.544	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4nccn4c3)[C@H]2C1	1788057942	WGZXRWZPAPDWEC-OEAJRASXSA-N	435.322	1.711	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C/N=C/c3ccco3)[C@H]2C1	1788679894	ZVUZHHSYIADBSV-WNSOGJMVSA-N	430.332	1.915	50	20	IDGD	
CCOC(CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]2C1)OCC	1789927334	VNQUJSFWTCIIQC-QCQGSNGOSA-N	439.322	1.446	50	20	IDGD	
CCOC(=O)O[C@@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)Br)C[C@@H]21	1790610643	SBCLORUJEAVSFK-QMVSFRDZSA-N	435.315	1.311	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](Br)CC)[C@H]2C1	1790964755	YSESTTZSEGTQBK-QTVXIADOSA-N	449.342	1.701	50	20	IDGD	
COC(=O)C12CC(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]43)(C1)C2	1791016323	YRNRLTFRXCPMPD-FRPHYYAGSA-N	447.359	1.546	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cncc(C(F)(F)F)c3)C[C@@H]21	1791255320	LNBDEBIIBNILEH-DDWPSWQVSA-N	449.857	1.948	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3[nH]cnc3-c3cccnc3)C[C@@H]21	1791255615	XEYNTPWKOOTNSA-QAETUUGQSA-N	447.923	1.319	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3cc(C)on3)[C@H]2C1	1791539004	RSUJFUBAVLOAJQ-TUUVXOQKSA-N	428.327	1.679	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C=C/c3cnccn3)[C@H]2C1	1791697254	QOGKINRMFDPWSU-CIISDZTESA-N	437.338	1.501	50	20	IDGD	
Cc1cc(CC(=O)Nc2ccc(C3(NC(=O)c4ccc(B(O)O)cc4)CCC3)cc2)no1	1791806800	YBFKIWKBUNQFBY-UHFFFAOYSA-N	433.273	1.653	50	20	IDGD	
CC(C)C1(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)CCC1	1791846017	RLPQGBUAXNBDJG-SNRMKQJTSA-N	443.548	1.105	50	20	IDGD	
CN(CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C(C)(C)C#N)NC(=O)NCc1ccccc1	1792706436	KVOWNKJULNVIJR-REPLKXPHSA-N	440.548	1.521	50	20	IDGD	
CC(C)n1cnc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)CBr)n1	1792867991	MQPCFUMPBFNQGP-FQUUOJAGSA-N	428.331	1.093	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@@H](O)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C(C)(C)CCl)C2	1793005235	NLIOPOADMORTGV-LXTVHRRPSA-N	431.961	1.775	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCc1ccc(F)nc1	1794021244	JPQKTJKJYCYHSY-KRXQYRFLSA-N	442.329	1.916	50	20	IDGD	
COc1cnc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CO[Si](C)(C)C)C3)c(F)c1	1794451923	COKZWPKXJJKZJZ-FVCICTRLSA-N	425.533	1.284	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1=CCCC1	1795044340	KBMUVWOTOGTEPO-YVSFHVDLSA-N	441.956	1.818	50	20	IDGD	
COc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)CBr)C3)nc1	1796727625	SPEGPIRINXZPAT-NFFDBFGFSA-N	426.311	1.324	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(F)nc1)C2	1796891919	OUNYDYIWGODWFW-TWXBYECESA-N	426.452	1.607	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C[C@H]1CNc3ccccc3O1)C2	1797956723	AWLCAOQNHCNRQM-GEYWLOKFSA-N	447.608	1.691	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2)c1cc(-c2ccccn2)[nH]n1	1798170576	KHRNYMLSPVTRNG-IVWMJMPLSA-N	448.321	1.460	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnc3ccoc3c1)C2	1798440398	MKSYTXAHTFUDKL-QDMKHBRRSA-N	434.456	1.392	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCOc1ccc(F)cc1)C2)[C@@H](F)Br	1799342868	KYRCFNVKLSFWAC-CZAMWMTLSA-N	447.276	1.875	50	20	IDGD	
COc1nccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Br)c1F	1799346232	LSTMKCXXQABXHV-FQPOAREZSA-N	434.237	1.123	50	20	IDGD	
CC(C)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)cc([N+](=O)[O-])c1	1799728326	PYYVYSOSDBPLBW-YWVIFJGQSA-N	425.869	1.769	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc3c1OCCO3)C2	1800757853	RRASQOWJZNVHQC-JFILPPLUSA-N	439.306	1.444	50	20	IDGD	
O=C(Cc1cnc2ccccn12)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1	1803097379	JEVMVERFYSLOOO-YRISNDGFSA-N	441.919	1.578	50	20	IDGD	
COc1cccnc1CCC(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]1c1cccnc1	1803142031	VHZDIQPVMLHODU-BLIXFSHQSA-N	446.935	1.724	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2cc3n(n2)CCNC3=O)[C@@H]1c1cccnc1	1806084764	QTAALIHTOPDQPY-MPGHIAIKSA-N	444.923	1.359	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)C[C@@H](N)c2cccnc2)[C@H]1c1cccnc1	1807267657	TYABDTYQBVJRPG-RCLSDMTESA-N	445.951	1.826	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)CCN2CCN(C)CC2)[C@@H]1c1cccnc1	1808260579	WZSOBWBFOIRKNN-IRFCIJBXSA-N	436.000	1.742	50	20	IDGD	
C[C@@H]1CC[C@H](C(=O)NC[C@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)O1	1809560119	YPUHMKSCPFGQGD-QTQZEZTPSA-N	431.537	1.028	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2cc3n(n2)CCCO3)[C@H]1c1cccnc1	1809868731	XHCHYBLXJYNWJN-JTDSTZFVSA-N	447.923	1.634	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)c3sccc3F)CC2)C1	1809969413	VMOYFYODUITVEF-UHFFFAOYSA-N	430.310	1.726	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@H]1CCN(C(=O)/C=C\C(=O)NC2CC2)[C@H]1c1cccnc1	1810546341	TYSWENNFJWVOPF-XKOLFZHYSA-N	444.608	1.774	50	20	IDGD	
Cc1n[nH]c(C)c1C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1810652079	KPVLOFGRSJQDLC-UWJYYQICSA-N	441.536	1.114	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cccc(=O)n2O)[C@@H]1c1cccnc1)C(Cl)Cl	1813077321	JNSSGKYFZHDKMU-SWLSCSKDSA-N	425.272	1.604	50	20	IDGD	
NC(=O)c1ccc(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)cc1	1813733946	MEVAYKIUGJGBJF-BZSNNMDCSA-N	430.892	1.100	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](C)CS(C)(=O)=O)n[nH]1	1815232010	DCUQULVAKBSYJL-MBNYWOFBSA-N	434.946	1.336	50	20	IDGD	
O=C(COc1ccccc1)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1816859180	RLIZZDYVEGACFJ-FQEVSTJZSA-N	448.288	1.474	50	20	IDGD	
COC[C@@H](C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)n[nH]1	1818110526	JIFRGTHQMRQUPL-AZVIPXTKSA-N	443.508	1.818	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CO[Si](C)(C)C)[nH]n1	1819353163	MDMZARDOQVLJED-UKRRQHHQSA-N	438.605	1.961	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)C3=NNC(=O)C3)sc2C1	1819672986	FOXSNXSFEAYPLA-SFYZADRCSA-N	428.312	1.105	50	20	IDGD	
CN1CCC[C@@H](C(=O)N2CCCC[C@@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)C1	1822415441	HEKWUNCRNVGQRP-NVXWUHKLSA-N	433.557	1.117	50	20	IDGD	
C[C@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1)n1cccc1	1822416977	UONYMPSELNIJEF-NVXWUHKLSA-N	429.525	1.838	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)COc2ccc(O)nn2)[nH]n1)C(Cl)Cl	1822422518	GFPSFGAANAHXED-SNVBAGLBSA-N	429.264	1.780	50	20	IDGD	
Cn1cccc1C(=O)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1	1823013870	KROGPLDZXDOVTE-AMIZOPFISA-N	443.298	1.967	50	20	IDGD	
Cc1noc(C)c1C(=O)N1CCCC[C@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1	1825861404	FHUCNUGHVWMFNU-SFHVURJKSA-N	433.553	1.898	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1nn(C)c3c1CCC3)CC2	1825999765	CLQWBZHPVLBZIB-CMPLNLGQSA-N	437.953	1.845	50	20	IDGD	
O=C(C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1)c1ccco1	1827050323	MOLZPYZBLPTSBM-LJQANCHMSA-N	438.289	1.076	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@H]2CC2(F)F)CC1	1828376977	QQTBNRXBQJPNMP-IAGOWNOFSA-N	435.475	1.574	50	20	IDGD	
CC(=O)C[C@H](C)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1	1828925274	IFUBXIVDHHMTKT-MGPUTAFESA-N	443.548	1.534	50	20	IDGD	
O=C(/C=C\c1c[nH]c2ccccc12)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1830725071	DHXUAECCUQGUEM-LNGTVFGOSA-N	447.919	1.237	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CS(C)(=O)=O)CC1	1831549160	MHNKATUCKMFCAX-CABCVRRESA-N	437.400	1.824	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnc(N)s2)CC1	1831870652	BOFTWJVYQGLTFM-HNNXBMFYSA-N	436.582	1.332	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)Cc2ncccn2)CC1	1831872090	NXACNKXEXFBXHV-GOSISDBHSA-N	430.553	1.012	50	20	IDGD	
O=C([C@@H]1CCCS1(=O)=O)N1CCC([C@@H]2CCCCN2C(=O)C(Cl)Cl)CC1	1831880997	SGKXMAWVFQEQLP-KBPBESRZSA-N	425.378	1.987	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H](C)n2cnnn2)CC1	1832290573	PQLGSOYBXBROFV-YDHLFZDLSA-N	427.347	1.637	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)Cc2ccc(O)cn2)CC1	1832321108	HGOPMSCWOQZQHH-HXUWFJFHSA-N	445.564	1.322	50	20	IDGD	
Cn1cc2cc(C(=O)N3CCC(N4CCC(NC(=O)[C@H](O)CCl)CC4)CC3)ccc2n1	1833311660	BSNGIFQCFUNION-HXUWFJFHSA-N	447.967	1.358	50	20	IDGD	
Cc1cnc(C(=O)N2CCO[C@]3(COCCN(C(=O)CCBr)C3)C2)s1	1833799522	VJEYKLRCXPWDPM-INIZCTEOSA-N	432.340	1.307	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3ccnn3C)CC2)CC1	1834214593	RXFNVQABCNTXDC-ZDUSSCGKSA-N	426.359	1.389	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(F)cn3)CCO2)C1	1834480443	KZMWRPXHAZPXLX-KDOFPFPSSA-N	444.301	1.464	50	20	IDGD	
O=C(Cc1ccc(F)cc1)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836716733	MMPJKMLGPXDUOX-LJQANCHMSA-N	426.916	1.967	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cnnc(Cl)c3)CC2)CC1	1837225468	CYVANHZWDHJGTD-INIZCTEOSA-N	445.347	1.996	50	20	IDGD	
Cn1ccnc1C(=O)N1CCC(OC2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1837536314	MFZOCABHHWDKKN-CQSZACIVSA-N	431.306	1.723	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)c3nccn3C)CC2)CC1	1837537928	KUPLJMSSLRLVPX-CYBMUJFWSA-N	427.343	1.816	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3ccc(CO)o3)CC2)CC1	1838465678	AJKQRHVGQPIMSR-QGZVFWFLSA-N	428.913	1.638	50	20	IDGD	
CC(C)n1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)n1	1838788099	KQJFMHOJFLAUJG-WMLDXEAASA-N	447.305	1.225	50	20	IDGD	
O=C(COc1cccnn1)N1CCC(OC2CCN(C(=O)C(Cl)Cl)CC2)CC1	1838790980	QHZNVVAVXIFSPA-UHFFFAOYSA-N	431.320	1.658	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)cc1	1838984318	QGGDERKFCCCELL-CRAIPNDOSA-N	429.286	1.756	50	20	IDGD	
O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(F)c(F)c1)CCO2	1839008750	ZBWRRMGNZJKYAR-SFHVURJKSA-N	447.276	1.820	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(OC)c3F)C2)C1	1839149941	WXMIGICHNKSJPJ-MGPUTAFESA-N	428.888	1.922	50	20	IDGD	
C[C@H](Cn1cccn1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2	1839150574	QFSMRQHXCZYFPB-LZQZEXGQSA-N	447.363	1.212	50	20	IDGD	
Cc1noc(C)c1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2	1839151420	QWGPICPTOHBXDV-MSOLQXFVSA-N	434.320	1.598	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)/C=C/C3CCCC3)CCO2)C1	1839179482	GRWOEWBNFRNEFJ-PTNUPGPXSA-N	429.355	1.973	50	20	IDGD	
O=C(c1ccc(Cl)o1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839200050	BCMZXHDAIDHZAD-DOMZBBRYSA-N	439.665	1.694	50	20	IDGD	
COc1c(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)ccc(F)c1F	1839381703	IIDSSWQVHBFVIF-CRAIPNDOSA-N	436.814	1.578	50	20	IDGD	
O=C(Cc1ccc(F)cc1F)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1839979926	NLHNUDVRNIKUJA-GOSISDBHSA-N	437.270	1.767	50	20	IDGD	
C[C@H](Cn1ccnc1)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1	1840433609	ZJFKNPPLBNRRQY-LZQZEXGQSA-N	447.363	1.212	50	20	IDGD	
Cc1cccc(C)c1N1C[C@H](C(=O)N2CCCC23CN(C(=O)[C@H](O)CCl)C3)CC1=O	1841915121	VDMZCARRHZLQCZ-IAGOWNOFSA-N	433.936	1.459	50	20	IDGD	
Cn1cc(C(=O)N2CC3(CCCN3C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)cn1	1841924154	BSTMWGKOESBPPX-AWEZNQCLSA-N	425.917	1.369	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)Cc2ccccc2C(F)(F)F)C1	1842704012	CMHPFLHVCOGDFU-UHFFFAOYSA-N	446.234	1.445	50	20	IDGD	
CCSc1cccnc1C(=O)N1CCCC12CN(C(=O)c1cnccc1C(=O)NN)C2	1844846693	KIAKJNOIDGQWIR-UHFFFAOYSA-N	440.529	1.323	50	20	IDGD	
Cc1c(C(=O)N2CC3(CCCN3C(=O)[C@](C)(Cl)CCl)C2)cn2[nH]cnc(=O)c12	1845171838	ZLJKBXRPTKWRGL-QGZVFWFLSA-N	426.304	1.384	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2cccc(-c3cnco3)c2)C1	1845414638	BILVKVNSBXURGE-UHFFFAOYSA-N	446.467	1.471	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCCC12CN(C(=O)c1cnc(O)nc1O)C2	1845871078	LTRASKZHSUBWPP-AWNIVKPZSA-N	441.394	1.590	50	20	IDGD	
COC[C@H](NC(C)=O)C(=O)N1CC2(CCCN2C(=O)/C(C#N)=C/c2ccc(F)cc2F)C1	1845871217	BPRMWDCATDIBBD-NXNKFBBFSA-N	446.454	1.226	50	20	IDGD	
COc1ccc2nc(C(=O)N3CC4(CCCN4C(=O)CCC(=O)NN(C)C)C3)ccc2c1	1846384825	NQRRQFHVHUHLLE-UHFFFAOYSA-N	439.516	1.433	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CCCN1C(=O)c2ccccc2C1=O	1848091166	PQSHXPSOHOKPID-BZSNNMDCSA-N	447.919	1.518	50	20	IDGD	
Cc1cc(CC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)n[nH]1	1848099503	QNHUKXDZOUOBRF-JYJNAYRXSA-N	439.944	1.595	50	20	IDGD	
O=C(Cn1ccc2sccc2c1=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](F)Br	1848184521	ALIUFEYONUXFIE-SLEUVZQESA-N	442.310	1.955	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCC(C(=O)NNc3nc(C)cc(C)n3)CC2)cc1OC	14512532	GHTGMUIAAIGXIS-UHFFFAOYSA-N	449.533	1.655	50	20	IDGD	
C[C@@H]1CC(C)(C)C[C@]2(C1)NC(=O)N(CC(=O)NNC(=O)c1ccc3c(c1)OCO3)C2=O	22929426	LWSJTQFFTZOCLV-GTJPDFRWSA-N	430.461	1.313	50	20	IDGD	
C[C@@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)NNC(=O)c2ccc3ccccc3n2)C1=O	27683512	AJCGXIJHLGEHBA-QFIPXVFZSA-N	435.415	1.602	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)C2=NN(c3ccc(F)cc3)[C@@H](C(N)=O)C2)c(C)c1	110888256	ZGJSYKVSHPXNPR-GOSISDBHSA-N	426.452	1.122	50	20	IDGD	
COC(=O)[C@H](C)Sc1ccccc1C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	728845916	PVPSDEIIMFJBCP-AWEZNQCLSA-N	443.529	1.808	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)NCc2cccc(CN3CCC[C@@H](C(N)=O)C3)c2)cc1	731046478	JMKCXYNWAFJKPX-HXUWFJFHSA-N	434.500	1.400	50	20	IDGD	
CC(C)(C(=O)NNS(=O)(=O)c1ccc(N2CCCS2(=O)=O)cc1)c1ccccc1	731179760	BACNJKGTOAEBJO-UHFFFAOYSA-N	437.543	1.514	50	20	IDGD	
C=CC(=O)NCCNC(=O)/C(C#N)=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	732099545	HVPANDATMHHWEM-RVDMUPIBSA-N	440.891	1.404	50	20	IDGD	
CC(=O)Nc1ccc(NS(C)(=O)=O)c(C(=O)NNc2nc(-c3ccccc3)no2)c1	732111971	NJUJPDLKIRAULA-UHFFFAOYSA-N	430.446	1.823	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)N1CCN(Cc2nc(O)c3c4c(sc3n2)CCCC4)CC1	732197002	JKZCUKGCNQFMHE-CYBMUJFWSA-N	446.577	1.339	50	20	IDGD	
CSc1cccc(N2C[C@@H](C(=O)NNC(=O)CCN3C[C@H](C)O[C@H](C)C3)CC2=O)c1	732262395	SCMGVLZJWVCQIR-XHSDSOJGSA-N	434.562	1.408	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)CCNS(=O)(=O)c1ccc(C(C)=O)cc1)c1ccccc1	732292141	SEJBKLLRKRALQJ-LJQANCHMSA-N	431.514	1.899	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)NCC1CCN(Cc2nc(C)c(C)o2)CC1	732476182	YKGVABPFGKNYIA-UHFFFAOYSA-N	445.520	1.921	50	20	IDGD	
COC(=O)c1cc(OC(=O)CN2C(=O)N[C@@](C)(c3ccccc3)C2=O)ccc1[N+](=O)[O-]	732653014	BDKINMHCNRRQLH-FQEVSTJZSA-N	427.369	1.754	50	20	IDGD	
Cc1nn(CCCl)c(C)c1C(=O)N1CCN(C2=NS(=O)(=O)c3ccccc32)CC1	733922670	OPWODPDGECLNIE-UHFFFAOYSA-N	435.937	1.646	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)CN2CCN(C(=O)OC(C)(C)C)CC2=O)c1C	741207176	JOLHEHSBBGCMPB-MRXNPFEDSA-N	448.520	1.297	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@@H](NC(=O)NNC(=O)c1nnc(O)c2ccccc12)C1CC1	741424430	FSASYDPUNFLHQB-CQSZACIVSA-N	430.465	1.583	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(F)c(Br)c2)c1	742471987	VYAXLMMRYWSVME-UHFFFAOYSA-N	444.282	1.913	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2cccc(Br)c2)ccc1OC	743263308	BUMDVSNFJLTSPQ-UHFFFAOYSA-N	443.275	1.868	50	20	IDGD	
CCOC(=O)c1c(S(=O)(=O)NNC(=O)c2cccc(Br)c2)n[nH]c1C	743264062	OARMCBKWGVCYFX-UHFFFAOYSA-N	431.268	1.281	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NNC(=O)c2ccc3ccccc3c2)cc1	743540913	WTBOLQLEJOFOEZ-UHFFFAOYSA-N	441.469	1.924	50	20	IDGD	
CC[C@H](C)NC(=O)CN1CCN(C(=O)NNC(=O)c2cccc(Br)c2)CC1	743685799	FBTLQTYQSZPYAU-ZDUSSCGKSA-N	440.342	1.336	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)[C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])o2)c1	745029492	OWIDRGJISGAURG-CQSZACIVSA-N	444.400	1.105	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)c2ccc(N3CCCS3(=O)=O)cc2C)c1	745209968	NLIDFARLYXNHKQ-UHFFFAOYSA-N	445.497	1.461	50	20	IDGD	
C[C@@H](CCc1ccccc1F)C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	745575435	GMCGDQBZTBDYDD-LIRRHRJNSA-N	430.432	1.925	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)NCCc1cc(Cl)c2c(c1)OCCO2	746746833	IUJMVOARYTUFPU-UHFFFAOYSA-N	429.864	1.875	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCC[C@H](C)[C@@H]2CNC(=O)OC(C)(C)C)n1	747971092	XVRJKPJILXDAKG-ZFWWWQNUSA-N	439.582	1.767	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)c2ccc([C@]3(C)NC(=O)NC3=O)cc2)cc1OC	748014072	GMLRRUCMJMAXSZ-QFIPXVFZSA-N	440.456	1.613	50	20	IDGD	
C[C@@H](NC(=O)CC1CCCCC1)C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	749838719	UVRDPMGZXDYRAE-LLVKDONJSA-N	444.941	1.224	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)NCCNC(=O)c2cccc(Br)c2)cc1	749932437	UJBUOXGHDJXVKC-UHFFFAOYSA-N	430.262	1.695	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)c1ccc(CNS(C)(=O)=O)o1	753566303	QKLWMKUQXAGRMU-ZDUSSCGKSA-N	431.470	1.711	50	20	IDGD	
CC(C)c1c(NC(=O)C(=O)NNC(=O)COc2ccccc2O)cnn1-c1ccccc1	753841093	OQJBYOCUSWCCBO-UHFFFAOYSA-N	437.456	1.866	50	20	IDGD	
COc1ccccc1NC(=O)c1ccc(NC(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)cc1	755497662	ZWAMUABRNOPQTA-AWEZNQCLSA-N	446.485	1.535	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)Nc2ccc(-n3cnnn3)c(C)c2)cc1	755676955	CQGNONPLXNUWBP-AWEZNQCLSA-N	425.449	1.990	50	20	IDGD	
O=C1CCc2cc(F)c(NC(=O)NNC(=O)C3CCN(c4ncccn4)CC3)cc2N1	755740574	JMFUPTHCIYKTTC-UHFFFAOYSA-N	427.440	1.570	50	20	IDGD	
Cc1cc(C(=O)NCC(C)C)ccc1NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	756279190	PKYBCMZVLLWHAA-UHFFFAOYSA-N	436.476	1.823	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)COc2cc(C)cc(C)c2)cc1NS(C)(=O)=O	756781345	ASCYETICDKYHKU-UHFFFAOYSA-N	436.490	1.915	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)Nc2ccc(C(N)=O)cc2F)c2ccccc2c1=O	756820158	IJZMROVIRHBUNH-UHFFFAOYSA-N	440.435	1.901	50	20	IDGD	
Cc1ccc(OC(F)F)c(CNC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c1	757241836	NAAIUMMCMHFAOY-UHFFFAOYSA-N	431.399	1.988	50	20	IDGD	
CN(C)C(=O)c1cc(NC(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)ccc1F	757613063	YJWRNMDFYQQUPW-UHFFFAOYSA-N	425.461	1.985	50	20	IDGD	
CCOC(=O)Cc1nnc(NC(=O)NNC(=O)c2ccc(Br)s2)s1	757756283	QXDXEROSSFGEMI-UHFFFAOYSA-N	434.297	1.934	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)[C@]1(Cc2ccc(Cl)cc2)C[C@H]2CC[C@H]1C2	758048798	WSJJIERWNRIULZ-CTYUOQFJSA-N	427.954	1.774	50	20	IDGD	
CC(C)(C)OC(=O)NCC1(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)CC1	759381502	VYLXQHHYZWLLOW-UHFFFAOYSA-N	446.913	1.053	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cccc(N(C)C)c2)nc1I	760210579	MHZZXBFBVIHLAM-UHFFFAOYSA-N	440.241	1.836	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2ccc(I)c(O)c2)C[C@@H](C)O1	761040767	KJPYKHOHOWLWSW-PHIMTYICSA-N	447.273	1.257	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)c1ccccc1OCC(N)=O	761414266	GSRKAEFRIDBXRN-NSHDSACASA-N	436.262	1.542	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)CN1C(=O)N[C@]2(CCCC(C)(C)C2)C1=O	761625334	HRPTWZYIRXFTRG-NRFANRHFSA-N	448.545	1.826	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)C1(C(=O)NNC(=O)Cc2ccccc2F)CCC1	762205861	CPXKHVQZMBYQJP-UHFFFAOYSA-N	444.438	1.215	50	20	IDGD	
CC[C@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1	763445045	DUEKMZQAPYUWHV-LBPRGKRZSA-N	427.417	1.523	50	20	IDGD	
O=C(NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12)C(=O)Nc1ccsc1	763754522	UBGOUNLQSFOPJB-UHFFFAOYSA-N	447.476	1.906	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccnn1-c1cccc(Cl)c1	763807093	JYQXFXURJMTWJV-UHFFFAOYSA-N	438.831	1.562	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)C(=O)Nc1ccc(-n2nccn2)cc1	763849293	IAYILUODCARVBA-OAHLLOKOSA-N	444.451	1.974	50	20	IDGD	
COc1cc(OC)c(OC)cc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccc(F)cc1	763873139	RZRFQQSZBBGSIW-LLVKDONJSA-N	435.408	1.405	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)C(=O)Nc2ccc(OCCN(C)C)cc2)cc1	763897317	YFKKLGXQPMPOMT-UHFFFAOYSA-N	430.530	1.814	50	20	IDGD	
N#Cc1cc(Cl)ccc1-n1ccc(NC(=O)C(=O)NNC(=O)Cc2ccc(F)cc2)n1	763920021	YANYJCGGCXWPLE-UHFFFAOYSA-N	440.822	1.865	50	20	IDGD	
CN(C)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1Cl	764005655	FBIRHPKMPJACSM-UHFFFAOYSA-N	446.847	1.213	50	20	IDGD	
CCOC(=O)c1cc(F)c(F)cc1NC(=O)C(=O)NNC(=O)[C@@H]1Cc2ccccc2O1	764168234	ORPUSWKVNBWFFI-INIZCTEOSA-N	433.367	1.231	50	20	IDGD	
CN(C)CC1CCN(c2ccc(NC(=O)C(=O)NNC(=O)CCc3ccco3)cc2)CC1	764171435	KXXZBHVZZQCYRH-UHFFFAOYSA-N	441.532	1.776	50	20	IDGD	
NC(=O)C1CCN(c2ccc(NC(=O)C(=O)NNC(=O)CCC3CCCCC3)cc2)CC1	764215518	WFCXQRXVWZJCJR-UHFFFAOYSA-N	443.548	1.835	50	20	IDGD	
Cn1cnn(-c2ccc(NC(=O)C(=O)NNC(=O)c3c(Cl)cccc3Cl)cc2)c1=O	764221717	WTQVHHHIBPHSRR-UHFFFAOYSA-N	449.254	1.278	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)C(C)(C)c2ccccc2)ccc1N1CCCC1=O	764310095	YTKHFMKETNYQOA-UHFFFAOYSA-N	438.484	1.886	50	20	IDGD	
O=C(NNC(=O)C(F)(F)Oc1ccccc1)C(=O)Nc1ccc(Br)nc1	764370177	OEOSIOOUBWGATC-UHFFFAOYSA-N	429.177	1.602	50	20	IDGD	
Cc1nnc(-c2cccc(NC(=O)C(=O)NNC(=O)c3cc(-c4ccc(F)cc4)[nH]n3)c2)o1	764387599	LIWIHSCSQYAXOF-UHFFFAOYSA-N	449.402	1.974	50	20	IDGD	
Cn1c(=O)c2c(ncn2CC(=O)NN=C2CCC[C@@H]2c2ccc(Cl)cc2)n(C)c1=O	764819883	WVDSZMPBKDDADP-CQSZACIVSA-N	428.880	1.527	50	20	IDGD	
Cc1c(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cnc2ccccc12	765737496	FRUSYDJGQYVCOH-UHFFFAOYSA-N	431.496	1.762	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)[C@@H]1C[C@H]1c1c(F)cccc1F	765739501	WBZOTKGLHKGTGD-IAGOWNOFSA-N	442.466	1.674	50	20	IDGD	
O=C(Cc1c[nH]c2ncccc12)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	765753449	YVCGFXVVQUWYNH-UHFFFAOYSA-N	440.935	1.724	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)CCn3c(C)c(C)sc3=O)CC2)cc1	765756643	YKWWLYYTQRNODC-UHFFFAOYSA-N	445.589	1.190	50	20	IDGD	
Cc1nn(C)c(C)c1CCC(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	765757432	SUHSMEQMYZKQMD-UHFFFAOYSA-N	446.983	1.588	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1cccc(CS(=O)(=O)c2ccccc2)c1	766264892	SDGHSLDSINLMEO-UHFFFAOYSA-N	441.469	1.541	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cc(F)ccc3[N+](=O)[O-])CC2)cc1	766648800	LDOSZFGAYVKJTL-UHFFFAOYSA-N	429.452	1.621	50	20	IDGD	
CC(C)N(CCCNC(=O)COC(=O)[C@H](Br)C(C)(C)C)S(C)(=O)=O	766749804	DRYNIBRLVRUKBI-ZDUSSCGKSA-N	429.377	1.516	50	20	IDGD	
COc1ccc(CNC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)c(C)c1	767135637	KUVVOEZFOSOKJZ-UHFFFAOYSA-N	448.549	1.161	50	20	IDGD	
Cc1ccc(C(=O)CCC(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1	767148255	PRRZVIKMMBIAHC-LJQANCHMSA-N	426.425	1.489	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)[C@@H](C)S(=O)(=O)C3CCOCC3)n[nH]2)c1	768265579	ZQKTXIXAVSNPJB-CQSZACIVSA-N	434.518	1.437	50	20	IDGD	
CCCC(=O)N1CCC[C@H](C(=O)NNC(=O)c2cc(-c3ccc(OC)c(OC)c3)[nH]n2)C1	768277942	UEPUXMYWZDSYLL-HNNXBMFYSA-N	443.504	1.894	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)CCS(=O)(=O)CC(C)C)n[nH]2)cc1OC	768279299	MOLOAUQUADESBS-UHFFFAOYSA-N	438.506	1.316	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)c1cc(S(C)(=O)=O)cc(C)c1C	768637412	AXJNPNCWWCEILT-UHFFFAOYSA-N	426.516	1.876	50	20	IDGD	
Cc1nc(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)nn1-c1ccc(F)cc1	768990495	UPROEBBOFZNJKX-UHFFFAOYSA-N	431.453	1.083	50	20	IDGD	
Cn1cc(C=NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c(C(C)(C)C)n1	769566759	JJANZVCGNQOZSA-UHFFFAOYSA-N	433.534	1.502	50	20	IDGD	
Cc1noc(C)c1CSCC(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	769649041	YQADQRNRGAXHFY-MRXNPFEDSA-N	435.458	1.055	50	20	IDGD	
O=C(NNC(=S)NCCc1cccs1)c1nccn2c(Br)cnc12	769739295	YIXYNVHNGJBSMA-UHFFFAOYSA-N	425.337	1.905	50	20	IDGD	
CSCCNC(=S)NNC(=O)C[C@H](NC(C)=O)c1ccc(Br)cc1	769769389	KFHRWPMEIYZYGM-ZDUSSCGKSA-N	433.397	1.875	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)NCc1cccnc1N1CCOCC1	770145589	LMTDHCNILLSHGC-AWEZNQCLSA-N	433.896	1.870	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccnn1-c1cccc(F)c1	770773884	MGFZGLVSGMCXIK-GFCCVEGCSA-N	429.383	1.704	50	20	IDGD	
CC(C)(C)OC(=O)NCCC=NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	771872951	ZXIIQBDSYGWTHZ-UHFFFAOYSA-N	440.522	1.338	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)C1(NS(=O)(=O)c2cccc(F)c2)CCCCC1	772069890	FQGQEZNVBYVOLP-ZDUSSCGKSA-N	443.497	1.296	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1	772888517	KGHDVZZQOGBANU-UHFFFAOYSA-N	442.819	1.511	50	20	IDGD	
Cn1nc(-c2cc(F)cc(F)c2)cc1NC(=O)C(=O)NNC(=O)Cc1ccccc1F	773550806	SPNPYNGDKZXWLR-UHFFFAOYSA-N	431.374	1.833	50	20	IDGD	
Cn1cc(NC(=O)C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)c(C(F)(F)F)n1	773695220	BFRPJZUUTUPNDX-UHFFFAOYSA-N	446.336	1.691	50	20	IDGD	
O=C(CN1CCC(O)(Cc2ccc(F)cc2)CC1)NNC(=O)c1cccc([N+](=O)[O-])c1	775745356	XZCBXOWBVLDYGD-UHFFFAOYSA-N	430.436	1.565	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)N[C@H](c1ccccc1OC(F)F)C(F)(F)F	776001647	QFOCDTLOKNRZNM-LDYMZIIASA-N	445.366	1.657	50	20	IDGD	
COC(=O)Cc1cccc(C(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)c1	779414542	QMMOBYIGAQCHCH-UHFFFAOYSA-N	434.493	1.651	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)C(=O)Nc2ncc(C)s2)c2ccccc2c1=O	782121453	ZEIITXORURVNBM-UHFFFAOYSA-N	428.474	1.361	50	20	IDGD	
CC(C)C(=O)Nc1nc(CC(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)cs1	782351707	NKFPQNZIOIZMEP-UHFFFAOYSA-N	429.458	1.156	50	20	IDGD	
N#C/C(=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)NN1CCCNC1=O	783599414	DJNVNXZRVLOFRD-UVTDQMKNSA-N	441.879	1.432	50	20	IDGD	
Cc1c([N+](=O)[O-])cn(CC(=O)NNC(=O)c2ccc(Cl)cc2)c(=O)c1Br	783924797	NPQQXSXCAONGLP-UHFFFAOYSA-N	443.641	1.942	50	20	IDGD	
CSc1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)CNC(=O)c1cccs1	784004627	IHNYJJWQPDJWOO-UHFFFAOYSA-N	426.907	1.639	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)C(=O)Nc3cnn(-c4ccccn4)c3)n[nH]2)c1	785125278	BVLOLDWVNJOFEV-UHFFFAOYSA-N	444.455	1.674	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc(F)c(C(N)=O)c3)n[nH]2)c1	785125675	FLDSMOWWJVJARF-UHFFFAOYSA-N	438.419	1.331	50	20	IDGD	
CCc1nc2cc(NC(=O)C(=O)NNc3c(OC)cccc3S(C)(=O)=O)ccc2o1	785331605	WQKRUPKLYSPVJU-UHFFFAOYSA-N	432.458	1.884	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)C(=O)Nc1ccc(Cl)cc1-c1ccccc1	785992073	VRHYRCZEXDETIE-NSHDSACASA-N	438.893	1.031	50	20	IDGD	
CC(=O)N1CCN(C(=O)COC(=O)/C(C#N)=C\c2cc(C)n(C[C@H]3CCCO3)c2C)CC1	786313120	MBPKLVGRAZUQSJ-GUBQRQEFSA-N	442.516	1.425	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccc(C(F)(F)F)n1	786414394	NMAXXBFTDSMKEP-UHFFFAOYSA-N	426.351	1.664	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2c(F)ccc(OC)c2OC)cc1OC	788179038	SNARIOBDHTVHQB-UHFFFAOYSA-N	436.392	1.478	50	20	IDGD	
COc1ccc(OC)c([C@H]2C[C@H]2C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c1	788196369	DSITVJAHMMXKST-NVXWUHKLSA-N	443.412	1.720	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)c(C)cc1C	788333206	LBQUJWWBWJDRGI-UHFFFAOYSA-N	441.469	1.941	50	20	IDGD	
CC(C)c1cc(NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)n(-c2ncccn2)n1	789246925	ARWJEIOZCZDSQA-UHFFFAOYSA-N	443.489	1.656	50	20	IDGD	
Cc1noc(-c2ccc(C(F)(F)F)cc2NC(=O)C(=O)NNC(=O)c2c[nH]nc2C)n1	789734180	FMTAAZHQTBOXSU-UHFFFAOYSA-N	437.338	1.495	50	20	IDGD	
COCCOCc1cccc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)c1	789822277	VUDSVWMYXNHRLP-PMACEKPBSA-N	441.484	1.508	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)[C@@](C)(O)Cn1cc(C(F)(F)F)ccc1=O	792629144	KZYJGIXQLRLSPT-IBGZPJMESA-N	441.406	1.407	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2ccc(C)c(Br)n2)c1	793023153	IXSMPTBGWQMGMK-UHFFFAOYSA-N	435.278	1.934	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2F)c(F)cc1C	793023736	VEVOLUDMFYBHRH-UHFFFAOYSA-N	435.383	1.615	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)c2cc(C3CC3)nc3c2c(O)nn3C)cc1	794722647	ZADMTQNFAFTTBJ-UHFFFAOYSA-N	430.490	1.559	50	20	IDGD	
CNS(=O)(=O)N1CCC(C(=O)NNC(=O)c2ccc(-c3ccc(F)cc3)s2)CC1	794805677	JJNXCWQVSKNVQB-UHFFFAOYSA-N	440.522	1.491	50	20	IDGD	
Cc1ccc([C@@H](NCC(=O)NNC(=O)Cc2nc(C)cs2)[C@H](C)S(C)(=O)=O)cc1	797996937	FXFWSRZMMKVUKO-LIRRHRJNSA-N	438.575	1.214	50	20	IDGD	
C=CCNC(=S)NNC(=O)CN1CCN(Cc2ccc(Br)cc2F)CC1	798305083	IDVVNBCEPRPNCQ-UHFFFAOYSA-N	444.374	1.387	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NN=Cc2cn(CC(=O)O)c3ccccc23)c1	799868068	SLMPGPNITKENOH-UHFFFAOYSA-N	428.470	1.740	50	20	IDGD	
Cc1c(C(=O)NNc2cccc(S(C)(=O)=O)c2)nnn1CCOc1ccc(F)cc1	800530705	NTJJAPUVPVMIQO-UHFFFAOYSA-N	433.465	1.965	50	20	IDGD	
COc1ccc(-n2c(C)cc(/C=C(/C#N)C(=O)OCC(=O)N3CCNC(=O)C3)c2C)cc1	800704457	FRPKJGYRQRUDPO-WQRHYEAKSA-N	436.468	1.511	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)N1CC[C@]2(CCN(Cc3ccccc3)C2)C1	805043911	XKGXCVDLFMFUPJ-QFIPXVFZSA-N	425.489	1.348	50	20	IDGD	
C[C@H](C(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)C1CN(C(=O)OC(C)(C)C)C1	806272431	GKEMFFZRBAGCMR-LBPRGKRZSA-N	429.477	1.198	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)Nc1ccc(S(=O)(=O)[C@@H](C)C#N)cc1	806459356	CPKOVLPVICIAML-LBPRGKRZSA-N	426.458	1.795	50	20	IDGD	
O=C(CCc1ccccc1)NNC(=O)C(=O)Nc1ccc(F)c(N2CCCNC2=O)c1	806978249	SNMCWWWMVABVFV-UHFFFAOYSA-N	427.436	1.464	50	20	IDGD	
Cc1cc([N+](=O)[O-])ccc1NNC(=O)C(=O)Nc1cc(F)c(S(C)(=O)=O)c(F)c1	807455345	KJXVMQFKBCWFOF-UHFFFAOYSA-N	428.373	1.667	50	20	IDGD	
Cc1cc([N+](=O)[O-])ccc1NNC(=O)C(=O)Nc1ccc(C)c(N2CCCS2(=O)=O)c1	807456913	KKCKREKLTCRROA-UHFFFAOYSA-N	447.473	1.833	50	20	IDGD	
CCOC(=O)Nc1scnc1C(=O)OCC(=O)NNC(=O)Cc1nc(C)cs1	808699894	RSMUUXPQAXVDQC-UHFFFAOYSA-N	427.464	1.023	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NN=Cc2ccc(S(N)(=O)=O)cc2)c1	811629547	VYGYLZQSLMNWRA-UHFFFAOYSA-N	438.531	1.128	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)[C@@H]2CN(C(=O)OC(C)(C)C)CCO2)cc1	812728555	PJRYIQKPPMAQQW-HNNXBMFYSA-N	428.511	1.016	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NN=C1CN(C(=O)OC(C)(C)C)CC[C@@H]1c1ccccc1	814835651	XMQMDWUADSYBJR-GDBMZVCRSA-N	438.550	1.821	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)cc1)C1CC1	815566422	SXBVEXKLTOXPPS-CYBMUJFWSA-N	442.447	1.894	50	20	IDGD	
CO[C@H]1CCOc2c(NC(=O)C(=O)NNc3ccccc3S(=O)(=O)N(C)C)cccc21	815751696	KNPRRFWQSSEAOF-INIZCTEOSA-N	448.501	1.489	50	20	IDGD	
Cc1ccc(Cn2nccc2NC(=O)C(=O)NNc2ccccc2S(=O)(=O)N(C)C)o1	815751858	RJCYDLGRMZEASB-UHFFFAOYSA-N	446.489	1.165	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NNC(=O)[C@H]2COCCN2CC(F)(F)F)C1	816510406	VLGZTNGTEMYHOE-CHWSQXEVSA-N	438.447	1.044	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)CCNC(=O)Cc2ccccc2)c2ccccc2c1=O	821892353	BPJQETFHBSVYKK-UHFFFAOYSA-N	435.484	1.317	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)c2cc(-c3ccco3)nc3c(C(N)=O)ncn23)cc1	913081094	AEFFKHDQFQTIMO-UHFFFAOYSA-N	434.412	1.237	50	20	IDGD	
Cc1occc1C(=O)Nc1nc(CC(=O)N([C@@H]2CCS(=O)(=O)C2)N(C)C)cs1	915830091	UWEKXOIZVMTJJX-CYBMUJFWSA-N	426.520	1.332	50	20	IDGD	
COc1cc(CCNC(=O)NNC(=O)COc2ccc(C#N)cc2)c([N+](=O)[O-])cc1OC	916219605	YEOQRLIKJSLJLX-UHFFFAOYSA-N	443.416	1.436	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)N[C@@H]1CCN2CCC[C@H]2C1	916572900	FTCUZWUQYXSHNO-SJORKVTESA-N	435.550	1.042	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)NCc1nncn1-c1ccccc1	916580535	JJTLYRUFJWRDEU-UHFFFAOYSA-N	445.277	1.939	50	20	IDGD	
Cn1nc(C(C)(C)C)cc1C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	916736529	XKSFXYLNQXWWKL-UHFFFAOYSA-N	433.534	1.577	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C3=NN(c4ccc(F)cc4)[C@@H](C(N)=O)C3)n[nH]2)cc1	917178215	FLWLAKRJLGHJGX-LJQANCHMSA-N	449.446	1.405	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCNC(=O)C[C@H]1c1ccccc1	919674240	LLPROQSRYWYCHZ-KRWDZBQOSA-N	430.892	1.673	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)c1nc2ncc(Br)cn2n1	919809531	TYUPQUUOTDGCNM-UHFFFAOYSA-N	425.630	1.624	50	20	IDGD	
COCCNS(=O)(=O)c1cccc(C(=O)NNC(=O)CCc2ccc(OC)cc2)c1	919834268	SJSXVQIWPBXCRX-UHFFFAOYSA-N	435.502	1.014	50	20	IDGD	
COc1ccccc1/C=C(/C(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1)c1ccccc1	919889337	LJPXGJYOYLOFAB-CLEQQJOVSA-N	429.498	1.753	50	20	IDGD	
CC(C)C(=O)NNC(=O)c1ccc(NC(=O)C[C@H]2SC(N3CCCC3)=NC2=O)cc1	920954267	LGYITNHDJKVBFF-OAHLLOKOSA-N	431.518	1.526	50	20	IDGD	
COc1ccc2[nH]c(C)c(C(=O)N3CCN(S(=O)(=O)CBr)CC3)c2c1	1116574017	RVLVKLGDDUPEKJ-UHFFFAOYSA-N	430.324	1.925	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)c3ccccc3CS(=O)(=O)c3ccccc3)nc21	1340732160	KZBNYFJCXVYOKX-UHFFFAOYSA-N	438.469	1.800	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4c(c3)CCN4C)C2)C1	1777921620	JQMAIYHSTKUOTC-VLIAUNLRSA-N	436.350	1.906	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cn4cc(F)ccc4n3)C2)C1	1778542169	KRPUDIKNDPFWNX-SGTLLEGYSA-N	439.285	1.700	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccn4nccc4c3)C2)C1	1778740534	SGDUXCSNZQTLFU-VQIMIIECSA-N	435.322	1.951	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(Cl)ncn3)C2)C1	1779819355	XOGIVGWVFZGSCF-MEDUHNTESA-N	431.718	1.747	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2c(F)cncc2F)C1	1779843241	MSILCWYXCKCARR-IOHHAYIISA-N	431.867	1.741	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)CC34CCCN3CCC4)C2)C1	1781134092	CWUJJOSVLRKJDI-HNAYVOBHSA-N	428.371	1.618	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc4c(c3)NC(=O)[C@H](C)O4)CCO2)C1	1781216716	BCKCVNRUGXYIPJ-YHQOMNDMSA-N	435.908	1.867	50	20	IDGD	
O=C(c1cccc2c1OCC2)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781330211	UELIBQFORHHXHD-QAPCUYQASA-N	427.270	1.756	50	20	IDGD	
O=C(CCc1cccc(O)c1)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781333065	BFPUUAUKQJUPBU-WMZOPIPTSA-N	429.286	1.845	50	20	IDGD	
CC(=O)N/C(C)=C/C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCBr)C2	1781461958	DBMNZPAGTPSCAM-RBXFWNBASA-N	430.343	1.325	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cnc4ccccn34)CCO2)C1	1783348094	UZVMRXNRWBERFY-LIRRHRJNSA-N	435.322	1.951	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](C)n1ccccc1=O)CCO2	1783349636	PRYRTKYLVRGLDT-DOXZYTNZSA-N	440.338	1.413	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)C34CC(C(=O)OC)(C3)C4)C2)C1	1783446166	JLFUSXYOMRJOEL-LUPGOKSRSA-N	443.338	1.333	50	20	IDGD	
COC(=O)[C@@H]1CC[C@H](C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](C)Br)C3)C2)C1	1783527613	DPEYCBYPXPEZFE-FLTUCWPJSA-N	431.327	1.189	50	20	IDGD	
COC(=O)c1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](C)Br)C3)C2)cn1	1783534038	CXCNXPISCBTBTQ-KPZWWZAWSA-N	440.294	1.095	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@H](C(=O)N2CC[C@]3(CN(C(=O)[C@@H](F)Br)CCO3)C2)C1	1783866778	XAKOHGNAKVXQEK-HNSFDTNUSA-N	449.317	1.486	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)Cc3cccc([N+](=O)[O-])c3)CCO2)C1	1783868276	DXKXTZFJVYWWOI-APWZRJJASA-N	425.869	1.221	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(C(=O)OC)cc3C)CCO2)C1	1783885375	ZOZUCEZUFAVQQD-UTKZUKDTSA-N	438.908	1.479	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3CC(O)C3)[C@H]2C1	1784002477	KHROYGQMSMMBCU-CMYREYTMSA-N	445.466	1.622	50	20	IDGD	
Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]2C1	1784091929	FCGFMSBHYCIRQL-APYUEPQZSA-N	443.859	1.235	50	20	IDGD	
Cc1nn(C)c(C)c1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)Br)C[C@@H]21	1784703229	JOYJOXVXCZWZCV-HJPIBITLSA-N	427.343	1.414	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c(Cl)c1	1785039070	DXCDQFOHGBHQTG-OAQYLSRUSA-N	436.940	1.465	50	20	IDGD	
CCc1nn(C)c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](Cl)COC)C[C@@H]32)c1Cl	1785707793	TUNPOIFNDUXMOR-XPCVCDNBSA-N	447.363	1.483	50	20	IDGD	
CN(C)c1ncc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]32)o1	1785888827	YXVQKCGBJWNIHT-RSLFNQERSA-N	433.336	1.570	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccn(CC)n3)[C@H]2C1	1786174580	OVQGIWJMIZHREZ-YXWQFLTLSA-N	427.343	1.670	50	20	IDGD	
Cc1cc(CC(=O)Nc2ccc(C3(NC(=O)CCC(=O)NN(C)C)CCC3)cc2)nn1C	1786222966	TXIKCLKFUYIRCV-UHFFFAOYSA-N	440.548	1.778	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21)[C@@H]1Cc2ccccc2CN1	1787414919	AFRVPMMWVLVKOE-QAETUUGQSA-N	426.344	1.484	50	20	IDGD	
Cc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)CBr)C[C@@H]32)cc(O)n1	1787455973	SBOACPPMSWUTET-XTBFLFJDSA-N	440.338	1.720	50	20	IDGD	
Cc1nnsc1C(=O)Nc1ccc(C2(NC(=O)CCC(=O)NN(C)C)CCC2)cc1	1788762339	RLOGTOATIUAJQS-UHFFFAOYSA-N	430.534	1.967	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(-n4cccn4)nc3)[C@H]2C1	1788984308	TZCPUAWRNBAVSW-XSLAGTTESA-N	431.924	1.878	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc(O)c4ccn(C)c34)[C@H]2C1	1789149842	OMAGAYSJMZJGGC-STECZYCISA-N	434.924	1.890	50	20	IDGD	
CC(C)(O)CC(=O)NC1(c2ccc(NC(=O)c3cnccc3C(=O)NN)cc2)CCC1	1789522879	SKEKSTHJVDIKNX-UHFFFAOYSA-N	425.489	1.594	50	20	IDGD	
Cc1n[nH]c(C)c1C(=O)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1	1789691976	DHAJOBLBNAMCSY-UHFFFAOYSA-N	432.289	1.768	50	20	IDGD	
CC(C)NC(=O)OC(C)(C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21	1789752921	KEULYGRSHPMVAB-AVGNSLFASA-N	438.352	1.683	50	20	IDGD	
COc1nccnc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]2C1	1789868829	MSVIGFOFAWNSQQ-RSLFNQERSA-N	431.320	1.315	50	20	IDGD	
CCc1ncccc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]2C1	1789922591	PRVJFYTXDDGOJL-MZGVZZPPSA-N	428.302	1.928	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(C)(C)NCCC#N)C[C@@H]21	1791057579	GKKLCJGBXULEOA-QPSCCSFWSA-N	429.359	1.031	50	20	IDGD	
CCOC(=O)C(C)(C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21	1792227368	JSEOPXLCTRYWDR-CYDGBPFRSA-N	437.306	1.246	50	20	IDGD	
O=C(CCCCCCCCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(O)O)C[C@@H]21	1792309438	CGCRFNVVLDNLFB-JYJNAYRXSA-N	449.386	1.402	50	20	IDGD	
Cc1c(Cl)cccc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc(B(O)O)c1)C2	1792744011	LNDKVNPSNRKQCZ-BCDXTJNWSA-N	426.709	1.894	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3cccnc3n1)C2	1792870360	FDHOKNMQNOMTQH-JJAZEVLHSA-N	447.333	1.864	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3[nH]ccc3n1)C2	1792870970	NVOKFSGWQDJDCU-JRATXPSKSA-N	435.322	1.797	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)Oc1ccccn1)C2	1792873108	LWJAADFXWXQRGG-LBKYZSNHSA-N	440.338	1.470	50	20	IDGD	
C[C@@H](Sc1ccccc1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(B(O)O)cc1)C2	1793437032	QTCOJVIHXAZOTL-GEALJGNFSA-N	438.358	1.799	50	20	IDGD	
O=C(NCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](F)Br)C2)c1cccnc1	1794226485	QMTXCFLTADUWCN-QVHKTLOISA-N	427.274	1.140	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2n[nH]cc2c1	1796150025	HEEMHYWLGLBYPW-IVSAIRAKSA-N	435.322	1.940	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)c1ccc(Cl)c(F)c1	1796189529	YXWLOTVPHIZFPE-BJWYYQGGSA-N	430.672	1.725	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccncc1C(F)(F)F)c1cccc(B(O)O)c1	1797098877	OWFOVSHNHIYKKT-MUJYYYPQSA-N	447.222	1.346	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1n[nH]c2ccccc12	1797412772	MTDLUTSQLIJCAW-NFFDBFGFSA-N	435.322	1.797	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1c(F)cncc1F	1798241137	COEHFKCDPHXHDJ-JNIYBQFBSA-N	432.265	1.737	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1[C@@H](O)CCN1Cc1ccccc1)C2	1799272172	HIYCMVNRGYFTBV-STHVQZNPSA-N	449.979	1.229	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1CCC3(CC1)OCCO3)C2	1799279360	KTCQRIFJXJNXJX-YYAJDYIMSA-N	449.375	1.746	50	20	IDGD	
Cc1ccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)C(Cl)Cl)C3)cc1[N+](=O)[O-]	1799331704	XOCJSUSBEMVULW-YWVIFJGQSA-N	430.288	1.839	50	20	IDGD	
C[C@@H]1CCc2c(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@@H](F)Br)n[nH]c21	1799347974	ZXVNIDLIXCBLAS-AGKDPIEYSA-N	429.290	1.353	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c[nH]c3nccc-3c1)C2	1800639599	KDJDSIRGSNOOFZ-FZKCQIBNSA-N	435.322	1.891	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c3c(nn1C)CCC3)C2	1800643085	LCFCNGPMCIHRKI-FAXLKDOZSA-N	439.354	1.286	50	20	IDGD	
CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(Cl)Cl	1801021168	KVFPVMGCTKQTSB-RNJOBUHISA-N	438.352	1.683	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cnc(OCF)cn2)[C@H]1c1cccnc1)[C@H](O)CCl	1803142009	VAOMDLJCDKOYDF-LXZKKBNFSA-N	437.859	1.097	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC2(CCN(C(=O)CCc3nc(N)n[nH]3)CC2)C1	1805385412	XHGDIYXWPZAYDI-ZDUSSCGKSA-N	441.374	1.582	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)/C=C/C2CCCC2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807363305	BRWXMRRGUCXIET-MEPGCTBYSA-N	447.344	1.827	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)C2CC(F)(F)C2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1	1807364542	JBBJYWAKURQXOB-QFBILLFUSA-N	443.259	1.126	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)n1cccc1	1807367496	LMPMTIPVYGRKAG-ZNLUXHQJSA-N	446.316	1.144	50	20	IDGD	
O=C(CCc1ccc[nH]1)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1807458836	CFVSGQIFHXJOBE-WMZHIEFXSA-N	446.316	1.042	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)c1cc2ncccn2n1	1809761638	WRDWYZVHEHVSAX-LESCRADOSA-N	428.880	1.044	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2cc3n(n2)CCCO3)[C@@H]1c1cccnc1	1809868730	XHCHYBLXJYNWJN-GJYPPUQNSA-N	447.923	1.634	50	20	IDGD	
Cc1nc(C(=O)N2CCC3(CCCN(C(=O)c4ccc(B(O)O)cc4)C3)CC2)cs1	1809968387	YIYLGANWCCVKIH-UHFFFAOYSA-N	427.335	1.290	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)COCCO)[C@H]1c1cccnc1	1812776273	CQKFYVLNJZTOCE-ZOBUZTSGSA-N	428.327	1.270	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)CN2CCOCC2)[C@@H]1c1cccnc1	1812863960	JCFAYUITXSNBCU-YXJHDRRASA-N	439.354	1.203	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2cccnc2C(N)=O)[C@H]1c1cccnc1	1813027795	DGRAFCMWHCRCNW-HFTRVMKXSA-N	445.907	1.149	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CN2CCSCC2)[C@H]1c1cccnc1)C(Cl)Cl	1813074178	OREJYPOXIKPQLK-HOCLYGCPSA-N	431.389	1.940	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2cccc(F)n2)[C@H]1c1cccnc1	1813074239	RKZVYYWIGBIHMB-KKSFZXQISA-N	442.495	1.308	50	20	IDGD	
CN1CCC(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)CC1	1814493530	BMCUOHHGMJOINX-KRWDZBQOSA-N	433.557	1.117	50	20	IDGD	
CCc1ccnc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)c1	1817768577	GENQNACORGNESA-FQEVSTJZSA-N	447.304	1.667	50	20	IDGD	
CCOC(=O)N[C@H](O)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)C(C)(C)CCl)CC2	1819458906	YSDUDFHBKQYXQC-TVQRCGJNSA-N	432.930	1.385	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H]2CNC(=O)O2)[nH]n1	1822083894	DJRWCTXZXSKMHC-WCQGTBRESA-N	428.287	1.684	50	20	IDGD	
CC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CNC(=O)c1cccnc1)CC2	1822841949	YLQRQHVNRHXNAT-QWHCGFSZSA-N	435.937	1.898	50	20	IDGD	
O=C1C[C@H](C(=O)N[C@@H]2CCc3nc(NC(=O)[C@H](F)Br)sc3C2)CCN1	1823014394	VQSAETSQYFHECR-RWYTXXIDSA-N	433.303	1.272	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1nc3ncccn3n1)CC2	1826000313	RPRQFBFMWIUISU-ZJUUUORDSA-N	435.897	1.060	50	20	IDGD	
C[C@@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1)c1ccccn1	1827055247	SOZADORUJZUSQX-WZONZLPQSA-N	449.360	1.798	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)CCc2cnn(C)c2)CC1	1827092725	GAQLKBCIRCHGPD-FQEVSTJZSA-N	446.596	1.345	50	20	IDGD	
Cc1nocc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1	1828925221	IJAZMFLZIABRNP-IBGZPJMESA-N	440.504	1.529	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CCC(F)(F)C1)CCO2	1829657816	CEEHCUBCQHGUSL-XEZPLFJOSA-N	439.297	1.662	50	20	IDGD	
C[C@H](C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2)n1cccc1C=O	1830357857	MUAHINOLCAPUOR-IERDGZPVSA-N	439.940	1.583	50	20	IDGD	
Cc1occc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)CBr)CCO2	1830537776	OEGCCRGOMFKLMK-FZKQIMNGSA-N	429.311	1.689	50	20	IDGD	
Cc1nn(C)c(C)c1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1	1831815402	JVFUQYXKZXIZSX-RTBURBONSA-N	447.363	1.343	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(=O)cco2)CC1	1831871460	FXLMQNFEFSEOJX-GOSISDBHSA-N	432.521	1.246	50	20	IDGD	
Cc1nc(C(=O)N2CCO[C@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)ccc1F	1833461917	DUFOYUZGRSAXHD-FQEVSTJZSA-N	439.560	1.451	50	20	IDGD	
CC[C@@H](C(=O)NC1CCN(C2CCN(C(=O)[C@@H](Cl)COC)CC2)CC1)N(CC)CC	1833539326	QOMCVERGXITHCO-PMACEKPBSA-N	445.048	1.932	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@@](C)(O)C(F)(F)F)CC2)CC1	1833641800	PCVNQCHRZHGXKO-RHSMWYFYSA-N	443.894	1.125	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cccnc3C(N)=O)CC2)CC1	1833919853	GQHYIMVBQOLQQT-QGZVFWFLSA-N	435.956	1.383	50	20	IDGD	
CCc1cnc(C(=O)N2CCOC[C@]3(CN(C(=O)CCBr)CCO3)C2)s1	1834823437	VCDOGJXXKPGFHT-KRWDZBQOSA-N	446.367	1.561	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)C(Cl)Cl)CC2)CC1)c1nc2ncccn2n1	1835352591	XXNSQKUHIPAIGL-UHFFFAOYSA-N	440.335	1.113	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H]3CC[C@H](O)CC3)CC2)CC1)[C@@H](F)Br	1836414284	BYXOMGHBHNMRBJ-KBRIMQKVSA-N	448.377	1.800	50	20	IDGD	
COC(OC)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](C)CBr)CC2)CC1	1836671127	XSZIIOWVASJZSS-ZDUSSCGKSA-N	435.359	1.635	50	20	IDGD	
O=C(Cn1nnc2ccccc21)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836714420	UWJVTUIWRWZTOY-LJQANCHMSA-N	449.939	1.030	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ncc(F)cc3F)C2)C1	1837710344	WWCXXJJNYHCWFD-LJQANCHMSA-N	443.523	1.281	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)[C@H]3CCC(=O)N3)CC2)CC1	1837783406	BVOLPSUGTMFJSW-JKSUJKDBSA-N	444.370	1.437	50	20	IDGD	
CC[S@](=O)CCC(=O)N1CCC(OC2CCN(C(=O)C(Cl)Cl)CC2)CC1	1838362985	PSNLXSKWZDMCPD-SANMLTNESA-N	427.394	1.947	50	20	IDGD	
COC(=O)NCC(=O)N1CCC(OC2CCN(C(=O)[C@@H](C)Br)CC2)CC1	1838773538	NGMGQSTZLYGKQF-GFCCVEGCSA-N	434.331	1.124	50	20	IDGD	
CC(C)c1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)on1	1838775777	HWAMMTVFWDRLKH-FQEVSTJZSA-N	439.585	1.720	50	20	IDGD	
COc1cc(OC)cc(C(=O)N2CCO[C@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)c1	1838934697	HLLPDXLOGPMHAA-LJQANCHMSA-N	447.315	1.578	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CC=CCC1)CCO2	1839126532	IUILNONXIJMKET-JTDSTZFVSA-N	429.355	1.830	50	20	IDGD	
CC(C)[C@H](S)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2	1839150638	RVKPOBPLKJXIIP-RRQGHBQHSA-N	427.394	1.634	50	20	IDGD	
CC(C)=NO[C@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)Br)C2)C1	1839228021	QLPREDLLQAGEKN-JJRVBVJISA-N	434.331	1.027	50	20	IDGD	
COc1c(C)cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)cc1C	1839392225	BCGCMKISOLJYKL-YLJYHZDGSA-N	428.888	1.916	50	20	IDGD	
O=C(c1cn2c(F)cccc2n1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1839554977	SXDOAWBGCXQFPM-YJBOKZPZSA-N	428.823	1.078	50	20	IDGD	
O=C(Cc1ccc2c(c1)CCO2)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1839998433	VQSKNRZAGRMOFT-UYAOXDASSA-N	426.872	1.155	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(C#N)c3)C2)C1	1840034870	ZMIYGUIZIQRPNK-IFXJQAMLSA-N	436.306	1.412	50	20	IDGD	
O=C(c1ccc2c(c1)CCCO2)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1840659762	KVVQFNWRDJNKTR-PXNSSMCTSA-N	426.872	1.616	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(F)c(C)cc3F)CCO2)C1	1840708344	CNIFAINZMRUARK-QRWLVFNGSA-N	446.878	1.597	50	20	IDGD	
COc1c(Cl)cccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1840739589	OABSBVUAPMWTLL-QAPCUYQASA-N	435.279	1.953	50	20	IDGD	
C[C@H](C(=O)N1CC2(CCCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C1)n1ccnn1	1841925426	UIJCPDAEOSLBGG-KGLIPLIRSA-N	440.932	1.175	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)Cc2ccc(F)c(F)c2)C1	1842741712	IZBVVYZWXGHHLC-VULFUBBASA-N	443.454	1.845	50	20	IDGD	
C[C@@H](CC(=O)N1CC2(CCCN2C(=O)c2cnccc2C(=O)NN)C1)Oc1ccccc1	1844264982	GCFMFQMFKLVEBU-INIZCTEOSA-N	437.500	1.360	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC2(CCCN2C(=O)Cc2cn3c(nc2=O)SCC3)C1	1845022751	PKPAOSHTAJKWMP-QGZVFWFLSA-N	445.372	1.331	50	20	IDGD	
CCN(CC)[C@@H](C(=O)N1CCCC12CN(C(=O)CCC(=O)NN(C)C)C2)c1ccccc1	1845840582	SHVIFFJFIGERQE-JOCHJYFZSA-N	443.592	1.646	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCCC12CN(C(=O)c1ccnnc1O)C2	1845871451	CSPAOQBQMAZAQT-RIYZIHGNSA-N	425.395	1.885	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)N1CC2(CCCN2C(=O)[C@@H](Br)Cc2ccccc2)C1	1845941495	BRECIASYLKOURW-WBVHZDCISA-N	448.361	1.887	50	20	IDGD	
C#CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)[C@@H](Cl)COC)C1	1846365809	WUIIZCLWZDYEOT-LSDHHAIUSA-N	427.929	1.360	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CCCc1ccccc1F	1847547311	REUYZHPPVKLBMU-PMACEKPBSA-N	439.491	1.663	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H](C)NC(=O)c2ccccc2)c1	3612964	UAHRMCVSXGHETL-HNNXBMFYSA-N	446.529	1.297	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)c2ccc(CN3C(=O)CNC3=O)cc2)cc1OC	12693459	NKAOFVAUBFWSEJ-UHFFFAOYSA-N	426.429	1.221	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)CC[C@H]1Cc2ccccc2NC1=O	14324740	HLLBPEILSNVVQD-HNNXBMFYSA-N	443.529	1.640	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cnn(Cc3ccccc3)c2)c1	14841576	RYPVJHXYUXEFFB-UHFFFAOYSA-N	427.486	1.257	50	20	IDGD	
COc1cc(C(=O)NNC(=S)Nc2cccc(C)c2C)cc(OC)c1OCC(N)=O	15665432	DBVOVTIMTMJGMM-UHFFFAOYSA-N	432.502	1.816	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)cc(OC)c1OCC(N)=O	15705295	MOAHYGURWSUMKZ-UHFFFAOYSA-N	431.489	1.545	50	20	IDGD	
CC(C)C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCN(Cc3ccccc3)CC2)cc1	21971237	WUUBCQAOJPDNQO-UHFFFAOYSA-N	444.557	1.610	50	20	IDGD	
COC(=O)c1cn(CC(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)c2ccccc12	26688342	PIFLOOZIBJBJDY-UHFFFAOYSA-N	441.440	1.915	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)c2ccc(F)c(NS(C)(=O)=O)c2)cc1F	727498307	DKKUDDYWBDEQPQ-UHFFFAOYSA-N	430.458	1.976	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)NC1CCN(c2ccc(C#N)cn2)CC1	727605810	XCTWUEWETQJNDK-UHFFFAOYSA-N	438.488	1.730	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)c2cccc(CS(=O)(=O)NC(C)(C)C)c2)c1	728208015	ISCRGHSWIGQBAT-UHFFFAOYSA-N	448.545	1.786	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2ccc(N3C[C@H](C)O[C@@H](C)C3)nc2)n1	728722270	OCFQNVOBRJYYIP-KBPBESRZSA-N	447.517	1.007	50	20	IDGD	
CCCn1c(=O)nc(O)c2c(C(=O)NNC(=O)c3cccc(C#N)c3)cc(C3CC3)nc21	728828413	WJNXDFWVJDHCOE-UHFFFAOYSA-N	432.440	1.731	50	20	IDGD	
CS(=O)(=O)c1ccc(Br)c(C(=O)NNC(=O)COc2ccc(F)cc2)c1	728855252	CGJJTWIDDNUDLZ-UHFFFAOYSA-N	445.266	1.832	50	20	IDGD	
CN(C)S(=O)(=O)c1ccsc1C(=O)OCC(=O)NNC(=O)c1cccc(Cl)c1	732366693	GBWCDFZSUJBQDH-UHFFFAOYSA-N	445.906	1.270	50	20	IDGD	
NC(=O)c1ncn2c(C(=O)NNC(=O)CCCc3cccs3)cc(-c3ccco3)nc12	732555454	FUQQVLRJINTMGS-UHFFFAOYSA-N	438.469	1.934	50	20	IDGD	
Cc1c(NC(=O)CSCC(=O)NNc2cnccn2)c(=O)n(-c2ccccc2)n1C	734244493	KOMBDXWKPUSRTJ-UHFFFAOYSA-N	427.490	1.089	50	20	IDGD	
CCc1cc(NNC(=O)C2CCN(c3ccc4nncn4n3)CC2)nc(-c2ccccn2)n1	734357116	QTRWVJHKWRMCSU-UHFFFAOYSA-N	444.503	1.898	50	20	IDGD	
CCOCCCN1CC[C@@H](NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)[C@@H](C)C1	734544403	RORLUHIPIMBFHS-PKOBYXMFSA-N	447.584	1.160	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)C[C@H]2C(=O)Nc3ccccc32)CC1	734824882	LLLFTXRLSQRFHM-OAHLLOKOSA-N	431.493	1.842	50	20	IDGD	
Cc1ccc(C(=O)CCC(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)cc1	735117031	LUNARFWJRACFSH-UHFFFAOYSA-N	445.545	1.432	50	20	IDGD	
Cn1cc(N2CC[C@H](NC(=O)NNC(=O)c3ccc(COc4ccccc4)o3)C2=O)cn1	735513093	TXHBDNHYKJPIRG-KRWDZBQOSA-N	438.444	1.342	50	20	IDGD	
CCn1c(NNC(=O)CC[S@@](=O)c2ccc3c(c2)OCCO3)nc2ccccc2c1=O	740739981	SFCFIBAWBFBIFX-WJOKGBTCSA-N	442.497	1.829	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccc(S(=O)(=O)C(F)F)cc2)cc1C	740942690	LUPLRLFPWUJEMK-UHFFFAOYSA-N	439.440	1.628	50	20	IDGD	
C[C@@H](CN1CCN(c2ccccc2)CC1)NC(=O)NNC(=O)COc1ccccc1F	743509365	CGGNSHOCOWQFMG-KRWDZBQOSA-N	429.496	1.746	50	20	IDGD	
CS(=O)(=O)Nc1cccc(CNC(=O)NNC(=O)c2cccc(Br)c2)c1	743522155	YPILWBCXKOKXIE-UHFFFAOYSA-N	441.307	1.965	50	20	IDGD	
O=C(CNC(=O)c1cc(F)cc(F)c1)NNC(=O)c1cc(Br)ccc1O	743733997	XRWIIDZQRSTKRI-UHFFFAOYSA-N	428.189	1.624	50	20	IDGD	
CCOc1ccc(/C=C(\C#N)C(=O)O[C@H](C)C(=O)N(CC)[C@H]2CCS(=O)(=O)C2)cc1	744572187	XRGXRWFODJZMAR-QPYDYZPCSA-N	434.514	1.960	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)Cn2cnc3c(oc4ccccc43)c2=O)c1	744583753	JXWICYHUTHXFTM-UHFFFAOYSA-N	434.408	1.456	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@H](C)c2cccc(C#N)c2)cc1	745922852	BPDQHUAGZAKOID-OAHLLOKOSA-N	429.502	1.579	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2ccc(COc3ccccc3)o2)cn1C	745976193	FKWAXOUTRQNWPK-UHFFFAOYSA-N	433.442	1.607	50	20	IDGD	
O=C(COc1ccccc1-c1ccccc1)NNC(=O)CS[C@@H]1CCS(=O)(=O)C1	747470714	ZQKNPTKCGHAHSU-MRXNPFEDSA-N	434.539	1.800	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=S)NCc1ccc(Br)cc1	747647772	APBLIHZXHHDTRJ-UHFFFAOYSA-N	427.349	1.936	50	20	IDGD	
COC(=O)N[C@H](C(=O)NNc1ccc(S(=O)(=O)Nc2nccs2)cc1)C(C)C	747942944	LOTXSAKISJIMFP-ZDUSSCGKSA-N	427.508	1.768	50	20	IDGD	
Cc1cc(C(=O)NNc2ccc(F)cc2Br)nc2c1c(=O)n(C)c(=O)n2C	748076151	AHPNAFYTESDJLQ-UHFFFAOYSA-N	436.241	1.599	50	20	IDGD	
COc1ccc(CC(=O)NNc2ccc(C#N)cc2)cc1S(=O)(=O)N1CCOCC1	748104855	JMUBXNHOOYZZMF-UHFFFAOYSA-N	430.486	1.274	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)N[C@@H](Cc2ccccc2)C(N)=O)N(C)c2ccccc21	748722027	OBGBCTHEUNTENC-SFHVURJKSA-N	431.496	1.870	50	20	IDGD	
COCCOCC(=O)NC1CCC(C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)CC1	748830939	KORNYMFCLSKWPI-UHFFFAOYSA-N	443.504	1.176	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)N[C@@H]2CCN(CCCc3ccccc3)C2=O)cc1	750660550	NRWSYHBFYLGCHZ-HXUWFJFHSA-N	440.500	1.638	50	20	IDGD	
COc1nc(N2CCN(C(=O)NNC(=O)c3ccccc3)CC2)ncc1Br	751148268	PUZJFEZRQNJGCA-UHFFFAOYSA-N	435.282	1.424	50	20	IDGD	
COc1cc(-n2cccc2)c(Cl)cc1C(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1	751360337	CIVIKTMHJLMYNR-NSHDSACASA-N	426.882	1.270	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)c1ccc(CNS(C)(=O)=O)o1	753566302	QKLWMKUQXAGRMU-CYBMUJFWSA-N	431.470	1.711	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN2CCS(=O)(=O)C3(CCCCC3)C2)cc1C	753860196	NEXFTZAGBUIPGS-UHFFFAOYSA-N	427.592	1.813	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2cc(S(C)(=O)=O)ccc2C)c2ccccc2c1=O	755536901	SQTUTNCCXCHUKQ-UHFFFAOYSA-N	443.485	1.595	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)Nc2cccc(N3C(=O)CN(C)C3=O)c2)c1	755993774	UZQYLSTZSKLYDC-UHFFFAOYSA-N	425.445	1.934	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)Nc1cccc(F)c1F	756254726	XDTVZQKQKWNHPC-UHFFFAOYSA-N	440.428	1.452	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)[C@@H](C)Oc2ccc(C(C)=O)cc2)cc1-n1cnnn1	756748009	UUOQQJBAESUKHF-CYBMUJFWSA-N	439.432	1.494	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)c1cncc(N2CCOCC2)c1	757141692	OBXBBQMUDVFBBV-UHFFFAOYSA-N	433.534	1.752	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2ccc(F)c(C(=O)N(C)C)c2)c2ccccc2c1=O	757609700	AAFHAXRLTOCDRM-UHFFFAOYSA-N	440.435	1.724	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)c1cccnc1I	757677106	XTLQFFQXKLZMGY-UHFFFAOYSA-N	435.181	1.410	50	20	IDGD	
CCOC(=O)Cc1nnc(NC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)s1	757755901	LULIMUHSBYCVFY-UHFFFAOYSA-N	431.434	1.002	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)Nc2ccc(Oc3cccnc3)nc2)c2ccccc2c1=O	757782898	QEABVGGVMVQWCY-UHFFFAOYSA-N	431.412	1.982	50	20	IDGD	
CN(NC(=O)[C@H]1Cc2ccccc2C(=O)O1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758781378	AAAULEPAIZNQFE-MRXNPFEDSA-N	432.477	1.404	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2cn(Cc3cccc(F)c3)nn2)c2ccccc2c1=O	759112507	VLPMZPBHGLJBTF-UHFFFAOYSA-N	435.419	1.270	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)c1cc(N2CCCC2=O)ccc1Cl	760386842	WBAVAVKCYOHBAY-UHFFFAOYSA-N	439.900	1.936	50	20	IDGD	
CCOc1ccccc1C(=O)N1CCC[C@H]1C(=O)NNc1nccc(N2CCOCC2)n1	762856844	YBJXKMABSMNHMF-KRWDZBQOSA-N	440.504	1.460	50	20	IDGD	
O=C(NNc1nccc(N2CCOCC2)n1)C1CCN(C(=O)c2ccc(F)cc2F)CC1	762860818	KBUKEOZQEMYLLH-UHFFFAOYSA-N	446.458	1.587	50	20	IDGD	
CN1C(=O)c2ccc(NC(=O)C(=O)NNC(=O)c3ccccc3Br)cc2C1=O	763483387	QVNMGEGIALVNEL-UHFFFAOYSA-N	445.229	1.075	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cccc(-n3cccn3)c2)cc(OC)c1OC	763539210	KCVGLSUDLIGKTH-UHFFFAOYSA-N	439.428	1.298	50	20	IDGD	
COc1ccc(Cn2nccc2NC(=O)C(=O)NNC(=O)c2c[nH]c3ccccc23)cc1	763541492	UQEDDUZDASGKDO-UHFFFAOYSA-N	432.440	1.821	50	20	IDGD	
Cc1cnn(-c2ccc(NC(=O)C(=O)NNC(=O)c3ccc4c(c3)OCO4)cc2F)c1	763550781	GVFIUHGCPRYVIG-UHFFFAOYSA-N	425.376	1.448	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(C(=O)N3CCCC3)cc2C)c1	763630416	KWCCOGPRLDVNPH-UHFFFAOYSA-N	438.484	1.704	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc2c(cnn2C(F)F)c1	763657708	PWWLLNHVTZPUHX-UHFFFAOYSA-N	433.371	1.605	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2c(F)cccc2Br)cc1	763674942	QJTUCSXSJYKSGJ-UHFFFAOYSA-N	435.209	1.625	50	20	IDGD	
CN(C)c1ncncc1NC(=O)C(=O)NNC(=O)COc1ccccc1Cc1ccccc1	763719492	ZHIADWRFTFEJAK-UHFFFAOYSA-N	448.483	1.298	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)C(=O)Nc2ccc(F)c(F)c2F)c2ccccc2c1=O	763790336	IBSHPWBBJRCRPB-UHFFFAOYSA-N	447.373	1.794	50	20	IDGD	
CCCOc1cc(F)ccc1NC(=O)C(=O)NNC(=O)c1nnc(O)c2ccccc12	763791767	YMRVFABOQPYLIZ-UHFFFAOYSA-N	427.392	1.663	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@H](C)C(=O)NNC(=O)C(=O)Nc1cnc(N(C)C)nc1	763882606	KHIPASKPCSPIOJ-GFCCVEGCSA-N	434.884	1.366	50	20	IDGD	
CC(C)CC(=O)NNC(=O)C(=O)Nc1ccnn1Cc1ccc(OC(F)(F)F)cc1	763886426	XQQLSUGZRIJEBZ-UHFFFAOYSA-N	427.383	1.962	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc4c(c3)CCC(=O)N4C)n[nH]2)cc1	764109698	AUQBNOPJWXWBTK-UHFFFAOYSA-N	446.467	1.694	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)NCC(F)(F)F)cc2)c(O)c1	764110142	FSBCAYDFNNWWLS-UHFFFAOYSA-N	438.362	1.392	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccc(C)cc1OCCN(C)C	764138592	FPCQVICPZJDOSZ-UHFFFAOYSA-N	428.489	1.273	50	20	IDGD	
Cc1nnc(-c2cccc(NC(=O)C(=O)NNC(=O)Cn3ccc4ccccc43)c2)n1C	764243291	QXYZEECROACREN-UHFFFAOYSA-N	431.456	1.531	50	20	IDGD	
O=C(Cc1ccccn1)NNC(=O)C(=O)Nc1ccc(-n2cccn2)cc1C(F)(F)F	764266310	AMFCWCILJXLVDF-UHFFFAOYSA-N	432.362	1.615	50	20	IDGD	
CC(C)n1ncc2c(C(=O)NNC(=O)CNC(=O)c3cccnc3)cc(-c3ccco3)nc21	764343341	OXHJNEQPHPXTBY-UHFFFAOYSA-N	447.455	1.858	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)C(=O)Nc1ccccc1O[C@H]1CCOC1	764350372	DIHVWEHAJNTSBX-KRWDZBQOSA-N	435.440	1.440	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)C(=O)Nc1ccc(C(=O)N2CCc3ccccc32)cc1	764354343	QUZOMAXNDZUMTG-UHFFFAOYSA-N	443.463	1.613	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)C(=O)Nc1ccc(NC(=O)C2CC2)cc1C(F)(F)F	764355835	JYVRYCVYZSHLCM-UHFFFAOYSA-N	449.389	1.778	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(N2CCSCC2)c(Cl)c1	764397728	BLITWIMNQJCWFU-LBPRGKRZSA-N	444.941	1.031	50	20	IDGD	
COc1ccccc1Oc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2COCCO2)cc1F	764434694	RHEBBKDAKDXORN-QGZVFWFLSA-N	433.392	1.128	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NN=Cc1ccc(C(=O)NC2CC2)cc1	764827831	JACRBGPCSDKQHG-UHFFFAOYSA-N	433.512	1.487	50	20	IDGD	
CCn1cc(NC(=O)NNC(=O)c2cc(-c3ccc(OC)c(OC)c3)[nH]n2)ccc1=O	765311531	QIKDZYYLDMSQSS-UHFFFAOYSA-N	426.433	1.742	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)Cn1c(S)nc2ccccc2c1=O	765416822	BJTPJZDAFQGQQN-UHFFFAOYSA-N	435.506	1.138	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cc(C(=O)NNC(=O)c2cc(C)[nH]n2)ccc1C	765582643	FLZALHSBEYRMJU-UHFFFAOYSA-N	443.485	1.911	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)c2ccc3c(c2)NC(=O)[C@@H](C)N3C)n[nH]1	765600722	TTZZORIFXKJVDH-GFCCVEGCSA-N	434.456	1.937	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2ccncc2)c(I)c1	765698334	OOTPDWYXJJVMGL-UHFFFAOYSA-N	440.197	1.095	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1cccc(CN(C)C(=O)C(F)(F)F)c1	766264649	NSELKWRMXWRZFG-UHFFFAOYSA-N	426.355	1.088	50	20	IDGD	
O=C(COCC(=O)NNc1ncnc2ccsc12)NNc1ncnc2ccsc12	766674903	CIUFGHDAOTURJU-UHFFFAOYSA-N	430.475	1.299	50	20	IDGD	
CCc1nn(C)c(Cl)c1C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	767191829	JDXAVHDKSHELAI-UHFFFAOYSA-N	439.925	1.495	50	20	IDGD	
Cc1c(/C=C(\C#N)C(=O)OCC(=O)CCN2C(=O)c3ccccc3C2=O)cc(C#N)n1C	767276879	JWXFYXIOYAQJRE-CXUHLZMHSA-N	430.420	1.911	50	20	IDGD	
CCOc1ccnc(N2CCCN(C(=O)NNC(=O)Cn3ccc4ccccc43)CC2)n1	767944554	GNEJDTWHGUUELM-UHFFFAOYSA-N	437.504	1.783	50	20	IDGD	
C[C@@H](C(=O)NNc1nc(-c2ccccn2)nc2c1CCC2)S(=O)(=O)C1CCOCC1	768161885	IZDZFSTVZJNZJW-ZDUSSCGKSA-N	431.518	1.453	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)[C@@H](C)N3C(=O)NC4(CCCC4)C3=O)n[nH]2)c1	768270258	XSWCJSUKBFCELZ-CQSZACIVSA-N	438.488	1.708	50	20	IDGD	
CC(C)c1nccnc1NNC(=O)Nc1cc(C(N)=O)ccc1CN1C(=O)CN(C)C1=O	770568224	LAWNYVGUVYCQDU-UHFFFAOYSA-N	440.464	1.242	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1ccoc1Br	770621655	HWAHEEFFGOZKPI-UHFFFAOYSA-N	435.278	1.261	50	20	IDGD	
CS(=O)(=O)c1cc(S(=O)(=O)NNC(=O)CCc2ccccc2O)c(Cl)s1	770635689	PDQILBOKTARMLF-UHFFFAOYSA-N	438.936	1.453	50	20	IDGD	
Cn1c(O)nc2ncc(-c3cccc(C(=O)NNC(=O)C(=O)Nc4ccccn4)c3)cc21	771825562	KBCVLAAEORGQMH-UHFFFAOYSA-N	431.412	1.136	50	20	IDGD	
COc1ccc(I)c(NC(=O)C(=O)NNc2nc(C)cc(C)n2)c1	773479363	UABPYMLVSYFOAI-UHFFFAOYSA-N	441.229	1.788	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2c(Cl)cccc2Cl)cc1OCC(N)=O	773691020	CTBSJSGEEBFNAH-UHFFFAOYSA-N	427.244	1.948	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1cccc(S(C)(=O)=O)c1	774008064	DYOHUJOLKOXRJP-NSHDSACASA-N	439.877	1.297	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNS(=O)(=O)c1cc(C#N)ccc1Cl	775251924	FZHYBSODBGBOJD-UHFFFAOYSA-N	441.922	1.437	50	20	IDGD	
CN(NC(=O)Cc1cnn(-c2ccccc2)n1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776204077	BBWBEBHKLLZILA-UHFFFAOYSA-N	443.508	1.446	50	20	IDGD	
CN(NC(=O)CCCNC(=O)C(C)(C)C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776205249	LIMZFWBROFYSLX-UHFFFAOYSA-N	427.546	1.565	50	20	IDGD	
Cc1csc2ncc(C(=O)NNC(=O)CCN3CCN(c4ccccc4)CC3)c(=O)n12	776286106	UDTSBNDVZJTFLL-UHFFFAOYSA-N	440.529	1.038	50	20	IDGD	
COc1cccc([C@@H]2[C@H](C(=O)NNC(=O)c3cccc(OC)c3O)CC(=O)N2C2CC2)c1	776467232	KDYPEWMTBSJYTR-YLJYHZDGSA-N	439.468	1.923	50	20	IDGD	
CC[C@@H](C)Oc1cc(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)ccn1	777425622	DZCUSJNHIXVTLG-MRXNPFEDSA-N	447.561	1.952	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCC(CCCN3CCOCC3)CC2)cc1OC	780330711	LTGKXHKEWRIPPU-UHFFFAOYSA-N	448.564	1.289	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)CN2C(=O)c3ccc(Br)cc3C2=O)c1	780789512	DKFNCMPYNZUPRI-UHFFFAOYSA-N	432.230	1.975	50	20	IDGD	
CC(C)[C@@H]1C[C@H](CC(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)CCO1	781708536	DSYLVHASKVTESJ-QUCCMNQESA-N	430.549	1.433	50	20	IDGD	
CS(=O)(=O)CCOc1cccc(NC(=O)C(=O)NNc2nc3ccccc3s2)c1	782814487	QSGWRFZWYAJQQX-UHFFFAOYSA-N	434.499	1.802	50	20	IDGD	
Cc1ccc(C(=O)NCC(F)(F)F)cc1NC(=O)C(=O)NNc1cncc(Cl)n1	783265143	FTSVCFHUVYUJMV-UHFFFAOYSA-N	430.774	1.812	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNc3ccc(-n4cccn4)nn3)cc2)C[C@@H](C)O1	783433328	PIOYAHQUJLYSIW-GASCZTMLSA-N	436.476	1.358	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NC[C@H]1CCCCS1(=O)=O	784176311	NMTVYHMAHQACJA-BXUZGUMPSA-N	448.339	1.514	50	20	IDGD	
Cc1nnnn1-c1cc(NC(=O)C(=O)NNc2ccnc(Br)c2)ccc1F	784828373	HFCHOHSZLKQLNI-UHFFFAOYSA-N	435.217	1.349	50	20	IDGD	
Cc1nc2cc(NC(=O)C(=O)NNc3ccc(S(=O)(=O)C(F)F)cc3)ccc2n1C	784835187	GQVSXJPHBSCGCC-UHFFFAOYSA-N	437.428	1.960	50	20	IDGD	
COC(=O)Cc1cccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)c1	784836287	VVRJZRDXYYMDSE-UHFFFAOYSA-N	441.412	1.480	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2cccc([C@H](C)N3CCOCC3)c2)n1	785227921	ZVTSRCDMLCNFQM-INIZCTEOSA-N	441.536	1.798	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)[C@@H](O)Cc1ccccc1Cl	785726317	DBACXXXIXYZVDY-HNNXBMFYSA-N	441.267	1.910	50	20	IDGD	
Cc1nc(Cn2cc(C(=O)NNC(=O)c3cc(-c4ccco4)nc4ccccc34)nn2)no1	786643542	XNPKHFPURFIQNX-UHFFFAOYSA-N	444.411	1.901	50	20	IDGD	
CN(CC(=O)NNc1ccccc1S(N)(=O)=O)C(=O)c1ccc(Br)s1	788228737	OWLJORUYHWNSLG-UHFFFAOYSA-N	447.336	1.373	50	20	IDGD	
COC(=O)c1ccc(C=NNC(=O)c2ccc(-n3cnnn3)cc2)c(Br)c1	788975536	QRZZTNQGMRFSRM-UHFFFAOYSA-N	429.234	1.975	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@H]12	789336816	XNCGRQXJTTYBLW-UVFQYZLESA-N	444.561	1.472	50	20	IDGD	
CC(C)(C)n1cc(C=NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)nn1	790143964	DGMZFBKXPDUXSX-UHFFFAOYSA-N	448.549	1.137	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1cnc(C(F)(F)F)cc1OC	792269765	XSHITIQRKSBZPO-UHFFFAOYSA-N	426.351	1.446	50	20	IDGD	
CC(C)Cc1ccccc1C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	792337256	XMVPVXNTQLGUIV-UHFFFAOYSA-N	431.562	1.973	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)c1ccc(Br)cn1	792772389	IHERRAODPIHHMB-SNVBAGLBSA-N	431.254	1.525	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@H]2C[C@]2(C=NNC(=O)Cc2csc(N3CCOCC3)n2)C1	792939076	DEMVPMTXCQCYLB-XOBRGWDASA-N	435.550	1.881	50	20	IDGD	
Cn1cc(C(=O)CCC(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)cn1	793683963	XMNIASAMTYXXOO-UHFFFAOYSA-N	446.939	1.002	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)N1CCC[C@H](C=NNC(=O)Cc2cn3ccccc3n2)C1	794514154	QEEHZRDZEMVPRR-MRXNPFEDSA-N	442.520	1.742	50	20	IDGD	
CN(C)c1nccc(NNC(=O)C(=O)Nc2ccc(Cl)c(CN3CCOCC3)c2)n1	797538386	KJRXMGZEUQWMIU-UHFFFAOYSA-N	433.900	1.110	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)c1cnn(-c2ccc(C(F)(F)F)cc2)c1	803204664	XYZPMLQPHYGUKJ-UHFFFAOYSA-N	432.362	1.477	50	20	IDGD	
Cc1noc(C)c1S(=O)(=O)NC1(C(=O)NNc2ccc3c(=O)[nH]ccc3c2)CCCC1	803436221	WYSUABXOPGXMLC-UHFFFAOYSA-N	445.501	1.867	50	20	IDGD	
COc1ccc(C(=O)NNc2ccc3c(=O)[nH]ccc3c2)cc1S(=O)(=O)NC(C)C	803438313	LSYROTKDHQTFMX-UHFFFAOYSA-N	430.486	1.980	50	20	IDGD	
COCc1cnc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)s1	806610993	GHVKSFZLAUNHCI-UHFFFAOYSA-N	439.519	1.541	50	20	IDGD	
COCCOc1ccc(S(C)(=O)=O)cc1NC(=O)C(=O)NNc1cc(C)cc(C)c1	806997574	POGSLNGRCISYFF-UHFFFAOYSA-N	435.502	1.814	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NCCc2nnc(C)s2)c2ccccc2c1=O	812485951	UGNOBMFOKQPGGG-UHFFFAOYSA-N	429.506	1.543	50	20	IDGD	
Cc1ccc(N2C[C@@H](C(=O)NNc3ccc(S(=O)(=O)N(C)C)cc3)CC2=O)cc1F	812731451	LMGSLMQNMQXQEK-AWEZNQCLSA-N	434.493	1.881	50	20	IDGD	
CCC(=NNC(=O)N[C@H]1CCS(=O)(=O)C1)c1ccc(OCCCCC(=O)O)cc1	814814688	VVFRKKHYPKKGLM-HNNXBMFYSA-N	425.507	1.921	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NN=C3CCCc4occc43)CC2)cc1	814877479	PNTZKLCDOSHKGQ-UHFFFAOYSA-N	430.530	1.751	50	20	IDGD	
O=C(COC(=O)[C@H]1CCCCN1C1CCCC1)NNC(=O)[C@H]1COc2ccccc2O1	815444972	PEAHCBZVRXJVSO-VQIMIIECSA-N	431.489	1.314	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)C(=O)Nc1cccc(S(=O)(=O)C2CCCCC2)c1	815569251	LZSPUXBKKSWRMW-UHFFFAOYSA-N	444.513	1.517	50	20	IDGD	
CNS(=O)(=O)c1cccc(C(=O)NNc2cc(C(=O)OC)ccc2Br)c1	816716585	SAUKITPYWMKBCJ-UHFFFAOYSA-N	442.291	1.901	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1C(F)(F)F)c1ccc(-n2cnnn2)cc1	896220170	BVVXDYFIZVLYLJ-UHFFFAOYSA-N	442.361	1.942	50	20	IDGD	
CS(=O)(=O)Nc1cccc(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c1	913391910	OCCYXCWJQZOCIF-UHFFFAOYSA-N	445.545	1.031	50	20	IDGD	
O=C(NCCN1CCN(Cc2ccccc2)CC1)NNC(=O)c1cc(Br)c[nH]1	915901348	HPGBAIVNADYNKE-UHFFFAOYSA-N	449.353	1.539	50	20	IDGD	
COc1ccccc1CCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	915904262	SRCXICSKJLJYBV-UHFFFAOYSA-N	446.529	1.666	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NCC2(NS(C)(=O)=O)CCCCC2)cc1C	916253689	GTYGJTVZCMBNDL-UHFFFAOYSA-N	426.539	1.265	50	20	IDGD	
O=C(NCCCn1cccn1)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	916376798	ISXLIQMAYJVWRA-UHFFFAOYSA-N	445.483	1.676	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCc2cccc(C(=O)N(C)C)c2)c2ccccc2c1=O	916483182	CWRZDRDCSQGPRH-UHFFFAOYSA-N	436.472	1.262	50	20	IDGD	
COc1ccc(C)cc1CNC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1	916601624	HNPZMFFVBKHCRE-UHFFFAOYSA-N	434.518	1.463	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)NCc1ccc(S(=O)(=O)N2CCCC2)cc1	916648051	TYAZSWRIPKTENR-UHFFFAOYSA-N	434.493	1.683	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)CN1C(=O)c2ccccc2N2C(=O)CC[C@@]12C	919822374	PQIMZBOSUUNBMA-QHCPKHFHSA-N	436.468	1.384	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)c2sccc2S(=O)(=O)N2CCCC2)cc1	919834140	OEGRBJNCPSUECQ-UHFFFAOYSA-N	437.543	1.935	50	20	IDGD	
CC(=O)N1CCN(S(=O)(=O)c2ccc(C(=O)Oc3ccc([N+](=O)[O-])c(C)c3)cc2)CC1	920115529	GIXGAVAIXINDGM-UHFFFAOYSA-N	447.469	1.975	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2nc3ncc(Br)cn3n2)c2ccccc2n1	920208766	YYZLRKAUZMJTJN-UHFFFAOYSA-N	426.234	1.818	50	20	IDGD	
COc1ccc(-c2nn(CCC#N)cc2/C=C(/C#N)C(=O)NCCNC(C)=O)cc1OC	920428136	XXYFRJOCOHQSQH-BOPFTXTBSA-N	436.472	1.640	50	20	IDGD	
O=C(NNC(=O)[C@@H](Cc1ccccc1)NC(=O)c1cccnc1)c1cccc([N+](=O)[O-])c1	921296908	VNZNINNLTMQJOH-LJQANCHMSA-N	433.424	1.792	50	20	IDGD	
Cn1nc2ccccc2c1C(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	1116641635	FSWTXQVHIBIKQG-UHFFFAOYSA-N	440.935	1.806	50	20	IDGD	
COc1cccc2cc(CNC(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)oc12	1318282970	FGGXOVDDUYOURD-UHFFFAOYSA-N	446.485	1.836	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)c2nc(C3CC3)n(-c3ccccc3)n2)c1	1318948371	NYSUNIQFVHVGDV-UHFFFAOYSA-N	430.424	1.634	50	20	IDGD	
CC(C)n1ncc2c1[C@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)CCC2	1325552953	KYZOTFBTVRRBJB-QGZVFWFLSA-N	448.549	1.736	50	20	IDGD	
Cc1cc2nnc(C(=O)N3CC[C@H]4OCCC[C@@]4(CNC(=O)[C@H](F)Cl)C3)c(C)n2n1	1778025546	DTELMEFAPVSTAH-ACWOFJMJSA-N	438.891	1.403	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4ncnn4c3)C2)C1	1778744330	XZQYNMAEYMXMCM-KBXCAEBGSA-N	436.310	1.346	50	20	IDGD	
C[C@@H](C(=O)N1CC[C@@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1)N1CSCSC1	1779148300	XSWFJIYJPKWXTN-MAUKXSAKSA-N	447.699	1.711	50	20	IDGD	
CC(=O)O[C@H](C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)Br)C2)C(C)C	1779210772	HHJOQTCCUSRIJQ-NQUFMGSDSA-N	447.370	1.871	50	20	IDGD	
CC(C)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1	1779374739	ZNIIGPJNXUFUSV-XMSQKQJNSA-N	431.537	1.249	50	20	IDGD	
COc1cccc(OC)c1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2	1780541880	KYVSMZDVRSUPLQ-YJYMSZOUSA-N	441.322	1.931	50	20	IDGD	
COCCn1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)n1	1781229580	JAFMUXBXXSJRGH-ZWKOTPCHSA-N	433.336	1.209	50	20	IDGD	
O=C(CSc1ccncc1)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781326789	UMODYRWZLPEOAT-ZBFHGGJFSA-N	432.315	1.694	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(O)nc1)C2	1782003642	PTIKASKXESZBQA-RVZJWNSFSA-N	426.311	1.698	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CSc1ccncc1)C2	1782172687	ZYIDDNNFYKMKME-MBOZVWFJSA-N	441.981	1.941	50	20	IDGD	
COC(=O)CCCCCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2	1782275333	GRNZSIZTTIHDOS-RZQQEMMASA-N	432.945	1.224	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccnc(OC)c3F)CCO2)C1	1783342769	OKRIZGCCAHXQFK-ACJLOTCBSA-N	444.301	1.846	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3c[nH]c4ccc(OC)cc34)CCO2)C1	1783877954	SFOHKTKXDITEFW-DYESRHJHSA-N	435.908	1.874	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(F)cn3)C[C@@H]21	1783967940	NUMYQLSKGISZOW-DUPGQFARSA-N	428.302	1.845	50	20	IDGD	
C=CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)[C@H]2C1	1785079748	YJHPVCQGHZTINS-VGWMRTNUSA-N	429.945	1.674	50	20	IDGD	
CCOC(=O)c1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]3C2)ccn1	1787447887	ILPKBVRBFSGBNC-DARAHFNDSA-N	427.860	1.386	50	20	IDGD	
NC(=O)[C@@H](N)CCC(=O)NC1(c2ccc(NC(=O)CCBr)cc2)CCC1	1787672744	AKOOJRKGUVEKFM-AWEZNQCLSA-N	425.327	1.498	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)[C@@H]1Cc2ccccc2O1	1788182985	PPVRSUSGPJVLCA-LAQRGFTBSA-N	437.334	1.755	50	20	IDGD	
COCc1oncc1C(=O)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1	1788829406	NEPQSYNWBSPOJD-UHFFFAOYSA-N	449.272	1.562	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(F)n3)[C@H]2C1	1788869426	YCNPEDFWGURUFO-ABHRYQDASA-N	428.302	1.988	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc4nc[nH]c34)C[C@@H]21)[C@H](F)Br	1789923127	SSUFSZWYDYQJCA-ZAJUMQRFSA-N	439.285	1.847	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cncnc3C)C[C@@H]21	1790960865	SLAWMCMKGRUGRU-TUUVXOQKSA-N	425.327	1.552	50	20	IDGD	
CCN(CC)C[C@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]2C1	1791063103	ACOHJPVBPSBKLP-QEOTZNIISA-N	432.403	1.727	50	20	IDGD	
COCCOCCOCCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(C)(C)CCl)C[C@@H]21	1791132962	FJXJVMPTQZYFIA-BZSNNMDCSA-N	448.988	1.301	50	20	IDGD	
Cn1ncc(Br)c1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(C)(C)CCl	1792781837	CORHZMYCNWZROP-PTEHBNRSSA-N	447.761	1.651	50	20	IDGD	
CC(C)(CCl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H]1CCc3nc(O)nc(O)c3C1)C2	1792879799	YUXIUSPRTDBAPB-YIYPIFLZSA-N	436.940	1.896	50	20	IDGD	
CC(=O)OC[C@H](OC(C)=O)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](C)CBr	1792986574	AIKOHZPNAVQCNI-URXAQBOPSA-N	447.326	1.150	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2)[C@H]1CC(=O)N(Cc2cccs2)C1	1793974546	SUVKGAZDFVDFDF-PMUIAIRXSA-N	443.928	1.221	50	20	IDGD	
O=C(Cc1cccc2ncccc12)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1	1796187936	MXRNSOGWSLELRJ-WKCHPHFGSA-N	443.312	1.409	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Cl	1796365197	VYKXGDPTNQQSAH-FPYNETTCSA-N	442.315	1.243	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC=C(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Cl)C1	1796365563	YZRBESHAFQWPDJ-FZKCQIBNSA-N	445.919	1.678	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnc3[nH]ncc3c1)C2	1796892575	RSRZAGHIZZFOPZ-GTNWXXIDSA-N	448.487	1.344	50	20	IDGD	
COC(=O)Nc1cccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CO[Si](C)(C)C)c1	1797956150	DVJYBKPQKHPOOY-HGKCTWBKSA-N	449.580	1.920	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CC(=O)N(C3CCCC3)C1)C2	1799263263	ILXTZVSHRZAVME-MBZOWXSBSA-N	425.957	1.385	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc(OCF)cn1)C2	1800639434	WCGGSYPVQKOHQP-OXIQGZBJSA-N	445.289	1.159	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCCC(=O)OC(C)(C)C)C2	1800754069	DKOAVCMRYVWUBM-VWPFQQQWSA-N	447.370	1.871	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H]2C[C@]21C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](O)CCl)C2	1802103382	YTUQJYYTBSJLSC-PYWNROJRSA-N	441.956	1.624	50	20	IDGD	
COC[C@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](O)CCNC(=O)OC(C)(C)C)C2	1802282523	FPKVRUVNSQCAAF-QRJUGERDSA-N	447.960	1.154	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)[C@@H]2CCC(=O)NC2)[C@H]1c1cccnc1	1802613322	QZKUUBHGGDXPJK-DPAVQSFQSA-N	437.338	1.397	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCc1ncc[nH]1	1802710176	GAWLTMXOQHTMKR-MVRRYPJTSA-N	425.493	1.115	50	20	IDGD	
COc1ccc(OCC(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)cc1	1802813009	XHXAXIUREYARIC-LRQRDZAKSA-N	447.919	1.775	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@H]1CCN(C(=O)[C@@H]2CCC(=O)N2)[C@@H]1c1cccnc1	1803010011	ZKDIHNKFAMIWTN-JJAZEVLHSA-N	437.338	1.397	50	20	IDGD	
Cc1cc(C(=O)N2CCCC3(CCN(C(=O)c4ccc(B(O)O)cc4)CC3)C2)cnc1C	1807366188	LWVIIAONCFMQAO-UHFFFAOYSA-N	435.333	1.537	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)[C@H]2CC=CCC2)[C@H]1c1cccnc1	1808137189	ZBZSHTYDUZRINX-YRISNDGFSA-N	448.527	1.756	50	20	IDGD	
O=C(/C=C\C(=O)N1CC[C@H](CNC(=O)C(Cl)Cl)[C@H]1c1cccnc1)NC1CC1	1813076907	BGWYUOBDSNAWTH-UTUKGBSRSA-N	425.316	1.726	50	20	IDGD	
C[C@@H](CBr)C(=O)Nc1cc([C@H]2CCCCN2C(=O)C2=NNC(=O)C2)[nH]n1	1814782497	VOHTZOHPCUPNBU-JOYOIKCWSA-N	425.287	1.309	50	20	IDGD	
Cc1cc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)ccn1	1815360859	PQUPSXSBAULPQI-INIZCTEOSA-N	436.302	1.066	50	20	IDGD	
CCOC(=O)N[C@@H](O)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCBr)n[nH]1	1816781425	ARUGHKFVWUEXNL-RISCZKNCSA-N	446.302	1.251	50	20	IDGD	
COc1ccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)nc1	1817475609	VKZWALYQVRSITL-LJQANCHMSA-N	449.276	1.113	50	20	IDGD	
CC(=O)C[C@@H](C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1	1817479199	JXPJCJOPZPGSCY-FZKQIMNGSA-N	426.282	1.011	50	20	IDGD	
CCS(=O)(=O)CC(=O)N[C@H]1CCc2nc(NC(=O)CO[Si](C)(C)C)sc2C1	1820160607	RSTTXNADEKBOSB-NSHDSACASA-N	433.628	1.341	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)Cn2ccncc2=O)n[nH]1	1821656944	SLXYNXDBMIBHFA-FZKQIMNGSA-N	441.319	1.895	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)CCBr)[nH]n1)[C@H]1CCCS1(=O)=O	1821830760	AVJXRNIISZMNHT-CHWSQXEVSA-N	447.355	1.764	50	20	IDGD	
CCC(=O)N[C@@H]1CCc2nc(NC(=O)CN(C)NC(=O)NCc3ccccc3)sc2C1	1822518760	SPIVDHDGXURIHJ-OAHLLOKOSA-N	444.561	1.811	50	20	IDGD	
Cc1nnc(CCC(=O)N2CCC([C@H]3CCCCN3C(=O)[C@@H](O)CCl)CC2)s1	1824180736	MQDFEDVEOFRYDZ-CVEARBPZSA-N	428.986	1.999	50	20	IDGD	
CN(CC(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@H](O)CCl)CC1)C(=O)c1ccccc1	1824381639	RDDATMFKXPKCQN-VQTJNVASSA-N	449.979	1.978	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(C(=O)O)ncn2)CC1	1825508347	RAAXWMGRYFVPGL-RHSMWYFYSA-N	438.912	1.662	50	20	IDGD	
Cc1cccc(CC(=O)N[C@@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)c1	1826085428	TURWXYUWJKNMED-MRXNPFEDSA-N	443.573	1.979	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC([C@H]2CCCCN2C(=O)CS(C)(=O)=O)CC1	1826630045	XIMGOVSIXSNPFV-LSDHHAIUSA-N	437.400	1.824	50	20	IDGD	
C[C@@]1(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)CC1(F)F	1827055315	UOAIIYGVOFBSIY-NQIIRXRSSA-N	434.292	1.645	50	20	IDGD	
O=C(c1cc(=O)nc2cccnn12)N1CCC([C@@H]2CCCCN2C(=O)[C@H](F)Cl)CC1	1827610920	SDFGDKCANVYTIF-KSSFIOAISA-N	435.887	1.857	50	20	IDGD	
O=C([C@@H](F)Br)N1CCC([C@H]2CCCCN2C(=O)c2c[nH]c(=O)cn2)CC1	1829717009	WBWOSVUIMISFPL-UKRRQHHQSA-N	429.290	1.694	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)[C@H]2[C@H]3SC=C[C@H]32)CC1	1831152360	HHYDVXDKWVGLJB-BURNTYAHSA-N	440.374	1.475	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc(OCC)cn3)C2)C1	1831644137	PQLJBHUGSAHPNG-FOIQADDNSA-N	440.928	1.353	50	20	IDGD	
Cc1onc(C(=O)N2CCC([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)c1C	1831871526	UIEQSSINAVJKNN-GOSISDBHSA-N	433.553	1.898	50	20	IDGD	
CC(C)(CCl)C(=O)NC1CCN(C2CCN(C(=O)c3cccnc3C(N)=O)CC2)CC1	1833212025	GYMVADRJPVRTBX-UHFFFAOYSA-N	449.983	1.631	50	20	IDGD	
COc1cccc(C(=O)N2CCC(N3CCC(NC(=O)[C@@H](O)CCl)CC3)CC2)c1F	1833313379	BRRCBUJUFJYTJE-KRWDZBQOSA-N	441.931	1.619	50	20	IDGD	
CC(=O)N[C@@H](C(=O)NC1CCN(C2CCN(C(=O)[C@@H](F)Cl)CC2)CC1)C(C)(C)C	1833402529	QUYRUTSJKQTMKE-DLBZAZTESA-N	432.968	1.643	50	20	IDGD	
O=C(Cc1ncccn1)NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1	1833875920	NREGCWRAEKQSKJ-UHFFFAOYSA-N	438.370	1.376	50	20	IDGD	
Cc1ncccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)Br)C2)C1	1834042479	AKGNAWGPJRYYAV-FZKQIMNGSA-N	426.311	1.243	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3scnc3C)CC2)CC1	1834227325	ZXIFKXOCZRGXTE-MRXNPFEDSA-N	428.986	1.891	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnoc3C)CCO2)C1	1834319278	QCKRIVVMPAZOCM-WMLDXEAASA-N	430.299	1.227	50	20	IDGD	
COCCOCC(=O)NC1CCN(C2CCN(C(=O)[C@@](C)(Cl)CCl)CC2)CC1	1834566873	AHUWUIFBXQYXKA-IBGZPJMESA-N	438.396	1.457	50	20	IDGD	
C[C@@H](C(=O)N1CCC(N2CCC(NC(=O)[C@H](F)Cl)CC2)CC1)n1cccc1C=O	1835080277	OPMROULGJMXPAI-KSSFIOAISA-N	426.920	1.968	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)CCNC(=S)NC)CC2)CC1	1835740316	QGCZOPPUMPGOFT-QGZVFWFLSA-N	446.061	1.450	50	20	IDGD	
CCOC(=O)/C=C/C(=O)N1CCC(N2CCC(NC(=O)[C@@](C)(Cl)CCl)CC2)CC1	1836398776	UKJFPHJOROPILL-SGSXCFNPSA-N	448.391	1.914	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC(OC2CCN(C(=O)[C@H]3C[C@@H]3C3CC3)CC2)CC1	1836657464	RGLOZPZIURVOLZ-YADHBBJMSA-N	440.349	1.025	50	20	IDGD	
O=C(c1n[nH]c2c(F)cccc12)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1837058079	XIMAOBBNVMBWLU-YJBOKZPZSA-N	428.823	1.306	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)ccn1	1837941827	XBCQVKPCURFVNF-RDTXWAMCSA-N	426.311	1.243	50	20	IDGD	
CC(=O)NCCC(=O)N1CCC(OC2CCN(C(=O)[C@H](C)Br)CC2)CC1	1838754798	FDEFDFCHBORRME-ZDUSSCGKSA-N	432.359	1.295	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccn(C(F)F)c3=O)C2)C1	1839145533	LCCWFVKWPWWROL-LIRRHRJNSA-N	447.866	1.331	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)C2)C1	1839147332	NEXRHOJHTPEMCB-APWZRJJASA-N	443.859	1.821	50	20	IDGD	
CCc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)n(C)n1	1839153088	AJBKZSBJTLTVRO-OALUTQOASA-N	447.363	1.289	50	20	IDGD	
O=C(c1[nH]cc2c1CCC2)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839201003	UWIVMGZGHBRVML-CRAIPNDOSA-N	444.301	1.264	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)cc1O	1839267957	OKFPHDFPOSKRQN-IFXJQAMLSA-N	441.322	1.554	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)COC(C)(C)C)C2)C1	1839962462	FYNFWGPQPBCWMX-KDOFPFPSSA-N	435.359	1.431	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3c[nH]c(C)c3)C2)C1	1839964157	ITJFGCCHHAVXMM-CRAIPNDOSA-N	428.327	1.567	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)cc1O	1840034232	FOXMGEWBCOIXHN-IFXJQAMLSA-N	441.322	1.554	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCCC12CN(C(=O)CN1CCCCC1)C2	1841924350	BGBMKKVQWDKEEH-INIZCTEOSA-N	442.988	1.808	50	20	IDGD	
Cc1ccc(S(=O)(=O)CC(=O)N2CCCC23CN(C(=O)CCBr)C3)cc1	1842758135	AVTZDXYSLBXWEU-UHFFFAOYSA-N	443.363	1.757	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2cc3cc(F)ccc3[nH]2)C1	1844013807	BPZPXOAOCZZYSZ-UHFFFAOYSA-N	436.447	1.436	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)c1c(C)noc1N)C2	1844692297	IWKOUYTVIVBRTM-UHFFFAOYSA-N	443.416	1.530	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCCC12CN(C(=O)c1cccc3c1NC(=O)C3=O)C2	1846070978	OQXGKXXMMQIUFW-CYBMUJFWSA-N	434.290	1.812	50	20	IDGD	
COC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)[C@@H](C)Br)C1	1846176738	AEJMGPSGRCVTEW-OLZOCXBDSA-N	448.358	1.513	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@H]2C[C@H](NC(=O)OC(C)(C)C)C2)C1	1847041241	JBWGKPLGIHHGLX-KKUMJFAQSA-N	429.945	1.747	50	20	IDGD	
Cc1cccc(CCC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c1	12606366	HEYWONQRTYDSLD-UHFFFAOYSA-N	431.514	1.410	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)c1ccc2c(=O)n(-c3ccccc3)c(=O)[nH]c2c1	16205550	JWJHHSIWOAFKRS-UHFFFAOYSA-N	448.410	1.658	50	20	IDGD	
CC(C)N1C(=O)c2ccc(C(=O)NNC(=O)[C@H](C)Oc3ccccc3F)cc2S1(=O)=O	108057945	OXCFAHMFENWJGS-LBPRGKRZSA-N	449.460	1.607	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)CCCOc2ccc(S(C)(=O)=O)cc2)nc2ccccc21	116056220	NOXCPRAZEXQNLY-UHFFFAOYSA-N	444.513	1.526	50	20	IDGD	
CC(=NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C)c1ccc(-c2ccccc2)cc1	254607797	WDWUNNPSNJZSQF-UHFFFAOYSA-N	430.468	1.641	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NCCCN1CCN(c2ccccc2)CC1	725874420	YRUCFSTWUSKGCZ-UHFFFAOYSA-N	444.561	1.021	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)NCCSC)c2)cc1	726279785	YHECBGRCXQESLA-UHFFFAOYSA-N	438.531	1.803	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)NCc2ccc([C@@]3(C)NC(=O)NC3=O)cc2)c1	726283096	WOEVTNBGBIANNG-JOCHJYFZSA-N	439.472	1.267	50	20	IDGD	
CN(C)N(C(=O)COc1ccc(Br)cc1Cl)[C@H]1CCS(=O)(=O)C1	728178205	DYQUUTYZFYRUIP-NSHDSACASA-N	425.732	1.974	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)c2cc(-c3ccco3)nc3c(C(N)=O)ncn23)cc1	728203140	MYAKEHGMBKTFFK-UHFFFAOYSA-N	433.428	1.270	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)c1cccc(C#N)c1)N1C(=O)c2ccc(Br)cc2C1=O	728828658	VKKZJVLZPBODDR-JTQLQIEISA-N	441.241	1.766	50	20	IDGD	
Cn1cc(S(N)(=O)=O)cc1C(=O)NNC(=O)c1ccc(Br)cc1Cl	728976007	OBTLYIBHLCHYGV-UHFFFAOYSA-N	435.687	1.163	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)O[C@H](C)C(=O)N[C@@H]2CCS(=O)(=O)C2)c(C)n1CC(C)C	729254445	BXJHRNJNDYLNOZ-JKYFQPHJSA-N	435.546	1.903	50	20	IDGD	
Cc1ccc([C@]2(C)NC(=O)N(CC(=O)NNC(=O)c3cccc4ncccc34)C2=O)cc1	730226509	KJNLOLIVBAONJN-QHCPKHFHSA-N	431.452	1.771	50	20	IDGD	
O=C(Cn1[nH]cc2c(=O)ncnc1-2)NNC(=O)c1cc(-c2ccccc2)nc2ccccc12	730515381	VSSJSQQWCMAENQ-UHFFFAOYSA-N	439.435	1.748	50	20	IDGD	
O=C(NNS(=O)(=O)c1csc(-c2cccc(Br)c2)n1)c1cnccn1	730765065	AMLTWKKJXPYDTL-UHFFFAOYSA-N	440.304	1.986	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(n2cccc2C(=O)NNC(=O)C(=O)N2CCCC2)CC1	731474094	GIBYREAAQGXMFM-UHFFFAOYSA-N	433.509	1.444	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2CN1S(=O)(=O)c1ccc(F)cc1)C1CCC1	732144624	XMNQRXPZVCVUJS-IBGZPJMESA-N	431.489	1.889	50	20	IDGD	
CCOc1ccc(-c2noc(CCC(=O)NNC(=O)CCN3C[C@H](C)O[C@H](C)C3)n2)cc1	732261040	AFKFJXAVVZGESZ-IYBDPMFKSA-N	445.520	1.715	50	20	IDGD	
O=C(NNC(=O)[C@@H]1C[C@H]1c1ccc(OCc2ccccc2)cc1)N[C@H]1CCS(=O)(=O)C1	732554149	ZGBVTCVQAOHCDB-YSIASYRMSA-N	443.525	1.887	50	20	IDGD	
CCN1CCN([C@H](C)CNC(=O)CCC(=O)C(C#N)=C2N(C)c3ccccc3N2C)CC1	733162916	XHXGKQZARDMACD-GOSISDBHSA-N	438.576	1.799	50	20	IDGD	
CSc1nc(C)c(CCC(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)c(O)n1	734239475	PLZXICQECGWXFZ-UHFFFAOYSA-N	428.515	1.000	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NN=C1C(=O)Nc2ccc(Br)cc21	734304166	SUEIZJAYVVIHGF-UHFFFAOYSA-N	426.271	1.929	50	20	IDGD	
Cc1nc(C(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)nn1-c1ccccc1	734825699	MOJVWISRCRYGDP-UHFFFAOYSA-N	443.508	1.919	50	20	IDGD	
O=C(CCS(=O)(=O)c1ccc2c(c1)OCCCO2)NNC(=O)c1ccc(Cl)nc1	741213929	RYZVOFYMJWFTHE-UHFFFAOYSA-N	439.877	1.521	50	20	IDGD	
C[C@@H](CC(=O)c1cccc(Br)c1)C(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1	741662940	UKXOGHMJKOSXHI-JQWIXIFHSA-N	431.308	1.240	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NN=C(C)[C@@H]1CCOC1)N(S(C)(=O)=O)CC2	741756618	LCBFYFIEMOGYCA-NVXWUHKLSA-N	439.534	1.481	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(Br)c(C(F)(F)F)c1)N1CCOCC1	743255729	ISPCDDHSQMKEDK-UHFFFAOYSA-N	432.218	1.703	50	20	IDGD	
CCN(CC)[C@@H](CNC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)c1ccco1	743341869	STPDKWBTUIPDKX-INIZCTEOSA-N	426.477	1.554	50	20	IDGD	
CCC(=NNC(=O)Cc1cc(O)nc(O)n1)c1ccc(I)cc1	743447398	HYMWCZKMVGERFY-UHFFFAOYSA-N	426.214	1.965	50	20	IDGD	
COc1cc(C(=O)NNC(=O)N[C@H]2C[C@@H](C)N(c3ccccc3)C2=O)cc(OC)c1OC	743506934	SWRNSMARCDUQGA-CJNGLKHVSA-N	442.472	1.850	50	20	IDGD	
CCc1nsc(N2CCCN(C(=O)NNC(=O)c3c(C)nc4ccccn34)CC2)n1	743507316	FICUKRGYOCJMBP-UHFFFAOYSA-N	428.522	1.623	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@@H]2C(=O)NNC(=O)NC2CCCC2)cc1	744053982	KZWMSDYJEODQKP-GOSISDBHSA-N	436.534	1.705	50	20	IDGD	
COc1cc(C(=O)N2CCN(CC(=O)NNC(=O)c3cccc(C#N)c3)CC2)ccc1C	744386448	FEAXLVFVNSURME-UHFFFAOYSA-N	435.484	1.094	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)c2cc(Br)cc(F)c2N)c1	745011480	HZZSOAFOGSOVCE-UHFFFAOYSA-N	435.209	1.660	50	20	IDGD	
CN(C)C(=O)NNC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(Br)s2)C1	746006121	OZPFZTIHCUULLJ-SECBINFHSA-N	439.357	1.214	50	20	IDGD	
CSc1nc(O)nc(C)c1C(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12	747344389	DZIDHRGSJAPDFW-UHFFFAOYSA-N	428.474	1.578	50	20	IDGD	
C[C@@]1(c2ccc(C(=O)NNC(=O)c3ccc(Br)s3)cc2)NC(=O)NC1=O	748517619	ZYNGAKJVSFEEGA-INIZCTEOSA-N	437.275	1.640	50	20	IDGD	
C[C@@]1(c2ccc(C(=O)NNC(=O)c3cccc(Br)c3)cc2)NC(=O)NC1=O	748545912	CEBFIFUZMREYHY-SFHVURJKSA-N	431.246	1.579	50	20	IDGD	
CCN=c1nc(NCC)n2c(SCC(=O)NNc3cccc([N+](=O)[O-])c3C)n[nH]c2n1	748666175	RKRIBQUSWLPGGV-UHFFFAOYSA-N	446.497	1.257	50	20	IDGD	
CC[C@H](Oc1ccccc1C)C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	749332524	BABIQSCVODBJMQ-AWEZNQCLSA-N	425.894	1.914	50	20	IDGD	
O=C(CCc1ccccc1)NNC(=O)NCc1cccc(OCCN2CCOCC2)c1	749932346	IBORLWJJFUQYKG-UHFFFAOYSA-N	426.517	1.861	50	20	IDGD	
CC(C)N1CCN(c2ccc(C(=O)NNC(=O)CNC(=O)c3cccs3)cc2)CC1	751212447	RRTZDNHOWFJEGZ-UHFFFAOYSA-N	429.546	1.470	50	20	IDGD	
CN1C(=O)c2cccc3c(S(=O)(=O)NNC(=O)c4cccc([N+](=O)[O-])c4)ccc1c23	753771075	NJMGBCABGUIVFY-UHFFFAOYSA-N	426.410	1.961	50	20	IDGD	
Cc1cc(Br)ccc1C(=O)N1CCC[C@@H](C(=O)NNC(=O)Cc2cc[nH]n2)C1	755278681	BIVPRPZNJKZICN-CYBMUJFWSA-N	448.321	1.723	50	20	IDGD	
C=CCN(C)S(=O)(=O)c1ccc(NC(=O)NNC(=O)CCc2ccccc2O)cc1	755931589	FBFJLBNMTOOULA-UHFFFAOYSA-N	432.502	1.984	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)Nc1cccc(N2C(=O)CN(C)C2=O)c1	755994299	XYQNKHAANBWOQD-LBPRGKRZSA-N	429.408	1.844	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)N[C@@H]1CCN(c2c(F)cccc2F)C1=O	756210330	CDGCEJCZOAXWTR-CYBMUJFWSA-N	449.370	1.388	50	20	IDGD	
CCOC(=O)C1CCN(C(=O)c2ccc(NC(=O)NNC(=O)Cc3cc[nH]n3)cc2)CC1	756682698	OZGPNBOBPUIPTB-UHFFFAOYSA-N	442.476	1.220	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2cnn(CC(C)C)c2C)cc1	757800752	DEHQVCJLCGQJPB-UHFFFAOYSA-N	436.538	1.629	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)C(=O)Nc1ccccn1)Oc1cccc(Br)c1	758817035	QRVRCYHLRNWFMI-LLVKDONJSA-N	436.266	1.581	50	20	IDGD	
O=C(Cn1c(Cc2ccccc2)nc2ccccc21)NNC(=O)C(=O)Nc1ccccn1	758821277	LYYYSYVCUIECBZ-UHFFFAOYSA-N	428.452	1.808	50	20	IDGD	
O=C(NNC(=O)c1ccc(F)cc1Br)NC1CCN(c2cccnn2)CC1	759642163	DVDPQCVCTALGIP-UHFFFAOYSA-N	437.273	1.991	50	20	IDGD	
C[C@@H](C[C@@H]1CCOC1)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	760194067	MYGOQUIUYNWUIS-HOTGVXAUSA-N	438.550	1.620	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cnc([C@@H]4CCCO4)s3)CC2)cc1	760403311	HXBCHFSNKAQUJG-SFHVURJKSA-N	443.573	1.882	50	20	IDGD	
N#CCCn1cc(/C=C(/C#N)C(=O)OCC(=O)NC(=O)NC2CC2)c(-c2ccccc2)n1	761384562	ICRLZFCNQZZFTE-WJDWOHSUSA-N	432.440	1.902	50	20	IDGD	
C[C@@H]1OC(C)(C)N(C(=O)OC(C)(C)C)[C@H]1CNC(=O)NN[C@]1(C)CCS(=O)(=O)C1	762323906	ARXRIWGVKGYHOO-ZJNRKIDTSA-N	434.559	1.128	50	20	IDGD	
COc1ccc2c(c1)[C@H](C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1)CC2	762872097	XFPVCNAKXWLONS-QGZVFWFLSA-N	445.545	1.199	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)NC1CCN(Cc2ccncc2)CC1	763464741	XOOJLAWCTQUFBJ-UHFFFAOYSA-N	434.541	1.681	50	20	IDGD	
Cc1cc(Cl)ccc1OCCCC(=O)NNC(=O)C(=O)Nc1cnc(N(C)C)nc1	763510956	XYIBHYSWAGUXIC-UHFFFAOYSA-N	434.884	1.450	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)C(=O)Nc1ccc(N2CCSCC2)cc1	763550341	DIBCGYXTRYKPIS-UHFFFAOYSA-N	428.470	1.368	50	20	IDGD	
CCCOC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1	763572907	VSKZHDWJIMVTEW-KRWDZBQOSA-N	427.413	1.179	50	20	IDGD	
Cc1ccc(N2CCOC2=O)cc1NC(=O)C(=O)NNC(=O)c1c(C)nc2ccccn12	763630418	ZMPFPVAEWFYFSS-UHFFFAOYSA-N	436.428	1.307	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(C(=O)N(C)C)c(C)c2)cc1C	763665276	ROTQVKGAAUKLFO-UHFFFAOYSA-N	426.473	1.479	50	20	IDGD	
Cn1c(=O)n(C)c2cc(NC(=O)C(=O)NNC(=O)CC34CC5CC(CC(C5)C3)C4)ccc21	763734231	JPMXVDPMOZOSFF-UHFFFAOYSA-N	439.516	1.569	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2ccc(C)c3ncccc23)c2ccccc2c1=O	763786616	QQGOTZWYBDHYIK-UHFFFAOYSA-N	444.451	1.673	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)C(=O)Nc1nc(-c2cccs2)cs1	763802734	GJRSIWAPOBXLGI-UHFFFAOYSA-N	447.454	1.945	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2nc(-c3ccccc3)n(-c3ccccc3)n2)nn1C	763803264	FZCVHKZUZKMEGT-UHFFFAOYSA-N	444.455	1.376	50	20	IDGD	
CCNC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(OCC)c(OC)c2)c1	763900219	BTFCLLNAFMQKDZ-UHFFFAOYSA-N	443.460	1.635	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(C(N)=O)c2)cc1OC	763912793	UPGOLKKCEWENMV-UHFFFAOYSA-N	428.445	1.373	50	20	IDGD	
COC(=O)Cc1ccccc1NC(=O)C(=O)NNC(=O)c1ccc(OC(C)C)c(OC)c1	763915637	BRCHTGDLTLQEAG-UHFFFAOYSA-N	443.456	1.598	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccc([S@@](=O)C(F)(F)F)cc1	763919752	YPZOABQQPQCUJE-GDLZYMKVSA-N	431.367	1.782	50	20	IDGD	
Cc1cc(Cl)c(NC(=O)C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1Cl	763921639	MXZJJFCXKHOTPR-UHFFFAOYSA-N	434.243	1.677	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)C(=O)N1C[C@@H]2CCCN2c2ccccc21	763951094	YVZYZPJRDJKACD-INIZCTEOSA-N	446.467	1.355	50	20	IDGD	
Cc1cnc(O)n1-c1ccccc1NC(=O)C(=O)NNC(=O)c1cc(Cl)ccc1O	763974417	OIXRVQOAQIEBMR-UHFFFAOYSA-N	429.820	1.645	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc(-c4ncon4)cc3)n[nH]2)cc1	764110238	GYCSTUHQRCQXCZ-UHFFFAOYSA-N	431.412	1.835	50	20	IDGD	
COC(=O)Cc1ccccc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccc(C)cc2)[nH]n1	764112087	VKONPHBYOWZGER-UHFFFAOYSA-N	435.440	1.500	50	20	IDGD	
CCNC(=O)N1CCc2ccc(NC(=O)C(=O)NNC(=O)Cc3ccccc3OC)cc21	764135533	ICDFPOCVPBWBGX-UHFFFAOYSA-N	439.472	1.116	50	20	IDGD	
CN(C)c1nnc(-c2ccc(NC(=O)C(=O)NNC(=O)c3cccc4cccnc34)cc2)o1	764149165	SKFSWTRHHRGMIN-UHFFFAOYSA-N	445.439	1.751	50	20	IDGD	
COC(=O)c1cc(Br)c(F)cc1NC(=O)C(=O)NNC(=O)CC(C)(C)C	764197553	DRAFHNKEVNLJIM-UHFFFAOYSA-N	432.246	1.897	50	20	IDGD	
CN1CCN(c2ccccc2NC(=O)C(=O)NNC(=O)c2cccc(OC(F)F)c2)CC1	764260217	UNDBVYUUFSSUCX-UHFFFAOYSA-N	447.442	1.440	50	20	IDGD	
Cc1ccc(NC(=O)C(C)(C)C)cc1NC(=O)C(=O)NNC(=O)COc1ccccc1O	764276057	XYSFHAXWDOPODK-UHFFFAOYSA-N	442.472	1.850	50	20	IDGD	
Cc1ccc(C(=O)N2C[C@H](C)C[C@@H](C)C2)cc1NC(=O)C(=O)NNC(=O)Cc1cc[nH]n1	764293456	PFNMHXDGPRYLJY-ZIAGYGMSSA-N	440.504	1.165	50	20	IDGD	
COc1ccc(OC(F)F)c(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c1	764351033	OBVINXCFAQGMSV-UHFFFAOYSA-N	445.382	1.882	50	20	IDGD	
CN(C)CCOc1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)cc1	764382353	HQFPENQJXFMZSC-UHFFFAOYSA-N	442.501	1.478	50	20	IDGD	
CC/C=C(\C)C(=O)N1CSC[C@H]1C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C	765320097	LAPHHANXDSFIQG-CZAWJFPGSA-N	428.555	1.697	50	20	IDGD	
COc1ccnc(NNC(=O)N[C@H]2CCN(c3ccc(Br)c(C)c3)C2=O)n1	765914728	DOOAOLGBBYHOOK-ZDUSSCGKSA-N	435.282	1.988	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)c1noc2c1CCCC2	766664917	XQLNKYPUTDIRMC-UHFFFAOYSA-N	431.924	1.786	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)[C@@H]1CN(Cc2ccccc2)CCO1	767343243	FZRPFDGEBGYDLZ-FQEVSTJZSA-N	425.485	1.129	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2cn(-c3ccc(F)cc3C)nn2)n1	767818212	ILVFGQJJOBKWRY-UHFFFAOYSA-N	432.437	1.027	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NC2C[C@H](C)O[C@@H](C)C2)c1	768120137	AHIJLXBKVGBDQO-KBPBESRZSA-N	426.539	1.617	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)COc1ccc(N2CCCC2=O)cc1	768636324	RNOJDXYUYBMTPV-UHFFFAOYSA-N	433.486	1.748	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc3c(c2)C(C)(C)C(=O)N3)c1	768907479	GZBYYZSAAZDKPB-UHFFFAOYSA-N	430.486	1.241	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(/C#N)C(=O)N2CCC(C(=O)NCCCO)CC2)c1C	769332463	AWYIFSMORFHAPQ-WBRURWICSA-N	430.549	1.957	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(N3CCCS3(=O)=O)cc2)cc1C	769695482	YBPNVOQDRMWLNE-UHFFFAOYSA-N	430.486	1.243	50	20	IDGD	
O=C(CCC(=O)c1ccccn1)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	770246548	QZTMQRLYVZPDKY-UHFFFAOYSA-N	443.935	1.663	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)N[C@@H]3CCCC[C@H]3N3CCOCC3)nc21	770410542	ASRLESFYCINAFL-HUUCEWRRSA-N	432.529	1.556	50	20	IDGD	
CCC1(CC)[C@H](NC(=O)NNC(=O)c2csc(N3CCOCC3)n2)[C@@H](C)[C@H]1OC	770753843	OACKSPCOUMNZEW-BPLDGKMQSA-N	425.555	1.763	50	20	IDGD	
C[C@@H]1CN(C(=O)NNC(=O)c2cccc3ccccc23)CCN1c1nccn2cnnc12	771211431	FWWGJMKBIOMFHP-OAHLLOKOSA-N	430.472	1.843	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)c1ccc(F)c(S(=O)(=O)N2CCCC2)c1	771993004	JMXDRQQAULKDFO-ZDUSSCGKSA-N	443.497	1.349	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)c1cccc(S(=O)(=O)NCC2CC2)c1	771996468	VZHRRMCXFLTFCI-CYBMUJFWSA-N	425.507	1.114	50	20	IDGD	
O=C(COC(=O)c1cnn(CC(=O)NC2CCCC2)c1)NNC(=O)c1ccc(Cl)cc1	772351970	KNGGRJIMEGSBQZ-UHFFFAOYSA-N	447.879	1.213	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)NCCN(C)S(=O)(=O)c1cccs1	772626315	QZLZZINMFXGTSY-GFCCVEGCSA-N	444.510	1.306	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)c1n[nH]c(C2CC2)c1Br	772887905	DJQHQKSGFHSCOY-UHFFFAOYSA-N	440.685	1.780	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)Cn1cc(Br)ccc1=O	772963366	JAPTUEHRJXGUNR-SNVBAGLBSA-N	428.670	1.879	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1cc2c(cc1Br)CCC2	773547784	XURRTICWIIETJD-SNVBAGLBSA-N	428.283	1.075	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2cccc3cncc(Br)c23)CCS(=O)(=O)C1	773644402	KGFGKUAZFFBOMI-MRXNPFEDSA-N	441.307	1.134	50	20	IDGD	
CN1CCN(C(=O)c2ccc(NC(=O)C(=O)NNc3ccc4ccccc4n3)cc2)CC1	773662368	UMBJKXYODWQKMU-UHFFFAOYSA-N	432.484	1.704	50	20	IDGD	
CC(C)C(CNC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)C(C)C	775007562	PNPWMONKPGUDCY-UHFFFAOYSA-N	426.587	1.572	50	20	IDGD	
CCOC(=O)c1cnc(C)c(C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c1	775055523	PATJRFSHPFPWIP-UHFFFAOYSA-N	430.373	1.093	50	20	IDGD	
CC[C@H](CSC)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	775462306	NYWDZDRFZMSNSA-OAHLLOKOSA-N	428.580	1.947	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)N1CCCN(c2nc3ccc([N+](=O)[O-])cc3[nH]2)CC1	775673131	MULFOLKKKGSCKL-AWEZNQCLSA-N	431.497	1.565	50	20	IDGD	
CCOCCONC(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	776195603	AENMCPKXIGQTLF-UHFFFAOYSA-N	425.449	1.301	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)c2sc3nc4n(c(=O)c3c2C)CCC4)nc1C	778422044	JXWKXQNOISFZJX-UHFFFAOYSA-N	428.474	1.745	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)c1ccn(-c2cccc(Br)c2)n1	778436703	OMYJPPISQYGHNY-UHFFFAOYSA-N	438.282	1.921	50	20	IDGD	
C[C@@H](NC(=O)CC(C)(C)C)C(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	778858551	DVDNICLCWURDDD-CYBMUJFWSA-N	427.546	1.657	50	20	IDGD	
CCC[C@H]1CN(C(=O)OC(C)(C)C)CCN1C(=O)NNC(=O)CNC(=O)c1ccco1	781801371	UBNLLXGWNKPHOI-AWEZNQCLSA-N	437.497	1.472	50	20	IDGD	
COC(=O)CNC(=O)Cc1ccc(NC(=O)C(=O)NNc2nc3ccccc3s2)cc1	782813035	DRAKIPKQCZPUDZ-UHFFFAOYSA-N	441.469	1.210	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)C(=O)Nc1ccc(C2CC2)cc1	782897477	PNOANFJZGJOUHT-UHFFFAOYSA-N	429.502	1.565	50	20	IDGD	
COc1ccc(Cl)c(NC(=O)C(=O)NNC(=O)c2csc(N3CCOCC3)n2)c1	782897537	QKWHJXKYFJZGHX-UHFFFAOYSA-N	439.881	1.041	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)CNC(=O)c2cccs2)ccc1OC(C)C	784003130	AGDCSMHFLLSFCU-UHFFFAOYSA-N	434.474	1.060	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)C(=O)Nc2cccc(C(=O)N3CCSCC3)c2)c1	784852249	TWBHQUOCOSWMJS-UHFFFAOYSA-N	442.497	1.744	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)C(=O)Nc2ccc(C(=O)OC)c(C(=O)OC)c2)c1	784854103	BDCSLEDTDJQVLR-UHFFFAOYSA-N	429.385	1.128	50	20	IDGD	
O=C(NNc1cccnn1)C(=O)Nc1ccc(CN2CCN(Cc3ccccc3)CC2)cc1	784858394	LPEXTAMLVQFYFA-UHFFFAOYSA-N	445.527	1.876	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ccc(C(F)(F)F)nn2)c(OCCN(C)C)c1	784886760	WMLUMAIWAIZFRP-UHFFFAOYSA-N	426.399	1.826	50	20	IDGD	
CCOc1cc(C=NNC(=O)C(C)(C)O)cc(Br)c1OCC(=O)N(C)C	785457826	IIAIHBQQCBJNJA-UHFFFAOYSA-N	430.299	1.536	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1	785676132	PYYNOOAULUZYRU-UHFFFAOYSA-N	437.412	1.636	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NCc2ccc(C)n(C)c2=O)c2ccccc2c1=O	787347971	YEHVTILYPDPPLN-UHFFFAOYSA-N	438.488	1.348	50	20	IDGD	
Cc1ccc(N2CCNC2=O)cc1NC(=O)C(=O)NNC(=O)c1cc2ccccc2cc1O	787540757	FGKSYBACLSGRQO-UHFFFAOYSA-N	447.451	1.783	50	20	IDGD	
CN1CCN(c2ccc(NC(=O)C(=O)NNC(=O)C(C)(C)C)cc2Br)CC1	787892309	WWLMZDJYJHRKQV-UHFFFAOYSA-N	440.342	1.333	50	20	IDGD	
COc1cc(F)ccc1NNC(=O)CCNS(=O)(=O)c1ccc(OC)c(OC)c1	788185464	YNQVNCHMCMQSEV-UHFFFAOYSA-N	427.454	1.663	50	20	IDGD	
CN1CCCC(C)(C)[C@H]1CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	790897419	WIXXBOGUARRWJF-MRXNPFEDSA-N	425.555	1.001	50	20	IDGD	
O=C(NNc1cccc(F)c1[N+](=O)[O-])C(=O)Nc1ccc(N2C(=O)CCCC2=O)cc1	791000875	SAIQTBIXNNDVBT-UHFFFAOYSA-N	429.364	1.859	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2cnn(Cc3ccccc3Cl)c2)n1	792697037	UCGJERQLBIYAPJ-UHFFFAOYSA-N	447.904	1.897	50	20	IDGD	
C[C@H](O)CN1CCN(C(=O)CCC(=O)C(C#N)=C2N(C)c3ccccc3N2C)[C@@H](C)C1	793873488	GZUKDZDQOMBUOQ-IRXDYDNUSA-N	425.533	1.571	50	20	IDGD	
CC(C)[C@@H](NC(=O)NCc1ccccc1)C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	794720323	MTWNCYIJKMWCQP-LJQANCHMSA-N	447.561	1.904	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1ccc(OC(C)C)c(C(N)=O)c1	796998252	IHGOZDQJGQOAEP-UHFFFAOYSA-N	448.863	1.634	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2cc(I)ccc2C)n1	797370530	OBZSCXKSFLGKJX-UHFFFAOYSA-N	438.225	1.703	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NC(=O)NNC(=O)c2cccc(OC(F)F)c2)nc1	797652669	NTYKNEBNXHITPL-UHFFFAOYSA-N	429.405	1.400	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)N[C@H]2CC[C@@H](C(=O)N3CCCCC3)C2)cc1C	798120263	ZZCVZHVJFONLON-AEFFLSMTSA-N	429.521	1.754	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)c2cc(C)c3c(=O)n(C)c(=O)n(C)c3n2)c(Cl)c1	802049400	JXOCYWXDKOEPGH-UHFFFAOYSA-N	430.852	1.369	50	20	IDGD	
CCOC(=O)c1sc2[nH]c(CSCCC(=O)NN(C)C(=O)OC)nc(=O)c2c1C	804124239	GPWFSSJXLJWUHW-UHFFFAOYSA-N	442.519	1.822	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)[nH]n1)C(=O)Nc1nc2c(s1)CSCC2	806973978	ZOVKMBJRHCHINY-UHFFFAOYSA-N	428.499	1.722	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)C(=O)Nc1cccc(F)c1Cl	806993054	ODQMVSWBMUWPMF-UHFFFAOYSA-N	441.872	1.480	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)N[C@@H]1CCCN(C(=O)N2CCCC2)C1	807458497	BQRKMQUKTJIAOV-MRXNPFEDSA-N	433.509	1.475	50	20	IDGD	
CCCCCn1nc(C(=O)NNS(=O)(=O)N2CCC(C)CC2)c2ccccc2c1=O	808070172	POVSFLVPQGJULW-UHFFFAOYSA-N	435.550	1.798	50	20	IDGD	
COc1nnccc1NC(=O)NNC(=O)c1nn(CCC(C)C)c(=O)c2ccccc12	808903188	ZSLCINXEHDICOV-UHFFFAOYSA-N	425.449	1.708	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)Cc1sc(N2CCOCC2)nc1-c1ccccc1	810348848	WXJQDEFKUMACCM-UHFFFAOYSA-N	437.525	1.974	50	20	IDGD	
COC(=O)c1c(F)ccc(NC(=O)C(=O)NNC(=O)c2c(C)nc3ccccn23)c1C	810385689	YYBSQTRLGHXWAT-UHFFFAOYSA-N	427.392	1.277	50	20	IDGD	
CC(=O)c1cccc(S(=O)(=O)NCC(=O)NNc2ccc(Br)nc2)c1	810395828	OBVSKNYHAQYSLN-UHFFFAOYSA-N	427.280	1.468	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)CNS(=O)(=O)c1ccc(Cl)cc1	811103841	MLVKFKCRZRKGBJ-UHFFFAOYSA-N	447.922	1.174	50	20	IDGD	
CC(=NNC(=O)Nc1ccc(S(N)(=O)=O)cc1)c1c(F)cccc1N1CCOCC1	814964803	AWDPAQQFFAVVBS-UHFFFAOYSA-N	435.481	1.855	50	20	IDGD	
Cc1cccc(Oc2ccc(NC(=O)C(=O)NNC(=O)[C@@H]3CCc4nncn4C3)cc2)c1	815691558	UAUWVXXRPKZOPT-OAHLLOKOSA-N	434.456	1.727	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCc2nncn2C1)C(=O)Nc1ccc(OC2CCCC2)c(F)c1	815692357	PELUSIYWOJYDDZ-LBPRGKRZSA-N	430.440	1.087	50	20	IDGD	
O=C1COC[C@H](C[C@@H]2CN(C(=O)C(=O)NNc3cccc(Cl)n3)c3ccccc32)N1	815729562	ZLVDPDJSJYJHRG-OLZOCXBDSA-N	429.864	1.214	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1cccc(-c2ncco2)c1	815752019	YVBUWYKCBQSKEX-UHFFFAOYSA-N	429.458	1.674	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)N(C)C)ccc1C	815752227	JQQQSISAYUIUAJ-UHFFFAOYSA-N	434.474	1.114	50	20	IDGD	
CC/C=C(/C)C(=O)N1CSC[C@H]1C(=O)NNc1ccccc1S(=O)(=O)N(C)C	817055218	RNARDRLDOUJKRQ-ODDCISTRSA-N	426.564	1.638	50	20	IDGD	
O=C(CC1CC1)NNC(=O)c1ccccc1NS(=O)(=O)c1ccc2c(c1)OCCO2	819114900	VDNZXIKVENPSFY-UHFFFAOYSA-N	431.470	1.820	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)N2CCC(O)(c3nn[nH]n3)CC2)c(C)n1C[C@H]1CCCO1	819615093	WLIVLYUKOOAFBJ-ZKTNYTPDSA-N	425.493	1.214	50	20	IDGD	
O=C(COc1ccccc1-c1ccccc1)NNC(=O)CN1C(=O)[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O	863995929	HNAWLDNCNJQAQF-BSWISCRUSA-N	445.475	1.687	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)CCCOc2ccc(F)cc2)ccc1Cl	875337103	ZVKKZWZQFFYHQY-UHFFFAOYSA-N	429.857	1.747	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNS(=O)(=O)c1cccc(S(=O)(=O)N(C)C)c1	884656126	WFRDURPNBLQCRM-UHFFFAOYSA-N	447.922	1.222	50	20	IDGD	
O=C(Cc1ccc([N+](=O)[O-])cc1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	912642907	ICHGEFCHNPDPMK-UHFFFAOYSA-N	432.458	1.383	50	20	IDGD	
Cc1ccc(C)c(NC(=S)NNC(=O)CNS(=O)(=O)c2c(F)cccc2F)c1	913423079	HSLBVVRHWKLJOA-UHFFFAOYSA-N	428.486	1.878	50	20	IDGD	
CCN(Cc1ccc(OC)c(OC)c1)C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	913627945	IIFUDCHOYTUJOA-UHFFFAOYSA-N	425.449	1.556	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)N2CCC[C@H](CNS(C)(=O)=O)C2)c(C)n1C[C@H]1CCCO1	915747460	UCGZYIYKJSONLB-GUJZACONSA-N	448.589	1.979	50	20	IDGD	
Cc1nn([C@@H]2CCS(=O)(=O)C2)c(Cl)c1C=NNC(=O)c1cccc([N+](=O)[O-])c1	916245590	KQYZHSQZPOPPMC-CYBMUJFWSA-N	425.854	1.877	50	20	IDGD	
COc1ccc(C(C)=NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c(O)c1	916258959	QMICBIRJTIVWSF-UHFFFAOYSA-N	433.486	1.576	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)NCC[C@](O)(c1nccn1C)C(F)(F)F	916377579	DDRLYIRVSTUOPN-GTNSWQLSSA-N	447.389	1.497	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)NCCS(=O)(=O)NCc2ccccc2)c1C	916645324	QXEFMOFMPRCCQK-QGZVFWFLSA-N	448.545	1.521	50	20	IDGD	
COc1ccc(CNC(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)c(OC)c1OC	918227758	XNFJQLANJATNEN-UHFFFAOYSA-N	430.461	1.798	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)NCCCn2nc3n(c2=O)CCCC3)c1C	918608639	MEASFQHDPSWDFJ-RGEXLXHISA-N	426.521	1.559	50	20	IDGD	
C[C@@H]1CN(Cc2cccc(CNC(=O)NNC(=O)[C@@H]3COc4ccccc4O3)c2)CCO1	920236721	GBSZIBWEIQJQKW-IERDGZPVSA-N	440.500	1.578	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)CC1(CC(=O)N2CCOCC2)CCCC1	1116664407	JQEPNGBMAJEOPV-INIZCTEOSA-N	425.526	1.311	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)CNS(=O)(=O)c1ccccc1	1317736785	YSEUALPVYVKBNT-HNNXBMFYSA-N	427.482	1.733	50	20	IDGD	
Nc1cnnc(NNC(=O)C2CCN(S(=O)(=O)c3ccccc3F)CC2)c1Cl	1319237017	PIDSVZVVMQEKTQ-UHFFFAOYSA-N	428.877	1.395	50	20	IDGD	
O=C(NNC(=O)N[C@H]1CCO[C@]2(CCS(=O)(=O)C2)C1)Nc1ccc(OC(F)F)cc1	1319952183	YXBVCMIVWPQZLG-YVEFUNNKSA-N	448.448	1.360	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)c2cc(N3CCNC3=O)ccc2F)CC1	1339345022	FLXSOLOBVKYONE-UHFFFAOYSA-N	449.483	1.763	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H]1CC(c3ccccc3)=NN1)CCO2	1779299319	RIFNHLWADUDKFV-KNQAVFIVSA-N	444.608	1.434	50	20	IDGD	
CCCC(=O)N[C@@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CO[Si](C)(C)C)C2	1779518185	WLAGFXRDOIRXGF-CSODHUTKSA-N	441.645	1.657	50	20	IDGD	
O=C(c1cccc(C(F)(F)F)c1F)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1781624023	HUCWGAOJYBXDPE-SUMWQHHRSA-N	438.805	1.888	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cncc(O)c1)C2	1782002905	ZORDOEUQKJVGGG-CDHAZOANSA-N	426.311	1.698	50	20	IDGD	
Cn1cccc1C(=O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCBr)C2	1782609951	WWDPSZMMKZOXLM-DNVCBOLYSA-N	440.338	1.507	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc4nn[nH]c4c3)CCO2)C1	1783355481	UARISGOWKSYNIB-ACJLOTCBSA-N	436.310	1.575	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)Cc3ccc4c(c3)CCO4)CCO2)C1	1783540137	SFPZQDCSGGDDCJ-VBKZILBWSA-N	437.334	1.777	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3CCN(C)CC3)[C@H]2C1	1783595532	XKCOLZKVTGWPHE-IWCQGFGOSA-N	430.387	1.339	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](C)N1CSCSC1)CCO2	1783877555	KMXSLOPIPPIHNO-GRDNDAEWSA-N	438.015	1.113	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C#Cc3ccc(Cl)cc3)[C@H]2C1	1783921859	MPTLQRLKJNTNNI-WNHJNPCNSA-N	439.339	1.925	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cc3ccoc3s1)CCO2	1783933714	FFWKNKZLPWVBEU-FQEVSTJZSA-N	434.518	1.311	50	20	IDGD	
Cn1ncc(C(=O)N2CCO[C@@]3(CCN(C(=O)C(Cl)Cl)C3)C2)c1C(F)(F)F	1783942938	CXADGRKSYOYSNM-CQSZACIVSA-N	429.226	1.686	50	20	IDGD	
O=C([C@H](F)Br)N1CCO[C@@]2(CCN(C(=O)[C@H](O)c3ccccc3Cl)C2)C1	1784253974	VQERYDMRBIQVCE-JKIFEVAISA-N	449.704	1.894	50	20	IDGD	
COc1cccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]32)n1	1785811343	CLSIFRQWGZMSBN-VODUFIJXSA-N	430.332	1.920	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC1(c2ccc(NC(=O)[C@@H](O)CCl)cc2)CCC1	1786134444	ILNBZFKHKBZALH-INIZCTEOSA-N	431.880	1.033	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)[C@@H]3[C@@H]4C=CS[C@@H]34)CCC2)cc1)c1ccc(B(O)O)cc1	1788143390	AGYUUORKQMDYJN-XUVXKRRUSA-N	434.326	1.989	50	20	IDGD	
O=C(NC1(c2ccc(NC(=O)c3ccncc3F)cc2)CCC1)c1cccc(B(O)O)c1	1788856122	OJXZSLMLTRDQOT-UHFFFAOYSA-N	433.248	1.962	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(C(N)=O)cc3)C[C@@H]21	1789872508	HKZAZOPAAZWKPQ-ZKNHNOBHSA-N	442.343	1.615	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]3C2)cc1	1789924610	OYJQMFWMWGUMBM-QCEMKRCNSA-N	429.286	1.979	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)c1cccc2ccnn12	1790344560	YWUSXPXCDNZLFW-DLKVLKDVSA-N	439.285	1.618	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3[C@H]4C=CS[C@H]43)[C@H]2C1	1790622531	NQPYTRYVRZYLKP-RMCMBSFLSA-N	429.380	1.872	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN3CCC(C)CC3)C[C@@H]21	1790957868	APFVJBUTLSMKMU-FJIDUMEYSA-N	444.414	1.872	50	20	IDGD	
Cc1ccc(OCCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CCC(=O)NN(C)C)C3)cc1	1792786923	NAISBVNKAXXZRS-REPLKXPHSA-N	430.549	1.775	50	20	IDGD	
CN(C)[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](O)CCl)c1ccc(Cl)cc1	1792983171	BRFVHFITCUDEBU-QJESEZNXSA-N	444.359	1.132	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cc([N+](=O)[O-])ccc1F	1793810165	XWDZTVBKWHFZKY-ZFHGCVPZSA-N	427.860	1.883	50	20	IDGD	
COc1cncc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CO[Si](C)(C)C)C3)c1	1794055502	MJBDHTJVKMHEHF-UPHUGPLXSA-N	435.597	1.464	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)c1ccc(Cl)c(F)c1	1796191671	MVJXUZJRORCUNZ-BJWYYQGGSA-N	430.672	1.725	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C=C/c1cc(C)on1)C2	1796891658	DBMFZCLJGOHUGS-KFHGRSSCSA-N	438.488	1.768	50	20	IDGD	
CC(C)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(-n2cccn2)nc1	1798210031	SKPOSIVKUFUFRR-ALXJQNPVSA-N	431.924	1.736	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc([N+](=O)[O-])c(O)cc1C	1799831427	RGZPUXDAQVVXPS-IFOZYUSPSA-N	425.869	1.829	50	20	IDGD	
COc1cccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)Br)c1	1800756218	HWIZYYXMLBQUIY-LJGDNWOOSA-N	425.323	1.611	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)Oc1ccccn1	1801369158	MGOQLSQMXZIDNZ-QKDZRIPBSA-N	426.311	1.222	50	20	IDGD	
CN(C)c1ccc(CCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)cc1	1802679309	CSNNCVKVPQQGEN-UADZTWIMSA-N	449.360	1.317	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)[C@@H]1CC=CCC1	1803026605	QLIVTIMXWSBZGO-ZNLUXHQJSA-N	433.317	1.437	50	20	IDGD	
CC(C)N1CCC(C(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)CC1	1803136037	MBCDSWTUIMAACV-AQNXPRMDSA-N	436.984	1.808	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)Cc2cnccn2)[C@@H]1c1cccnc1	1803300834	MWQDEBFYEXWFPF-YEWWUXTCSA-N	432.322	1.904	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(S(C)(=O)=O)c(F)c1	1803894948	WDHLMWAUBJMAFN-LXTVHRRPSA-N	446.928	1.735	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)C1CCCCC1	1806225262	KVWZKZPNTHHVIV-IRLDBZIGSA-N	435.333	1.661	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H]1C(=O)N1CCCC2(CCN(C(=O)[C@H](O)CCl)CC2)C1	1806405457	NPHRLXWGYRBMNV-HZPDHXFCSA-N	443.972	1.827	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H]2C[C@H]2C2CC2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807361290	WNPBXWHZADEXJZ-VXSCBNMQSA-N	433.317	1.127	50	20	IDGD	
Cc1cccc(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)n1	1807361634	GTKWAHSWCKYSKV-KNQAVFIVSA-N	444.300	1.098	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1807372602	GZTXGLDCIPNYPE-WDSOQIARSA-N	429.713	1.098	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)Cc2nnc(C)s2)[C@@H]1c1cccnc1	1807538481	GLVDPBROMTYCHK-VKJFTORMSA-N	437.953	1.744	50	20	IDGD	
CC(=O)N(C)CCC(=O)N1CC[C@H](CNC(=O)[C@@H](F)Br)[C@@H]1c1cccnc1	1808652584	YRQPMXWBLJGCBO-HYVNUMGLSA-N	443.317	1.646	50	20	IDGD	
CN1C(=O)CC[C@H]1C(=O)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@H]1c1cccnc1	1808774549	SCYHHZFNPNSGFN-SDADXPQNSA-N	441.301	1.399	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)CCn2cncn2)[C@H]1c1cccnc1	1812867349	ICOJYTULYHWQOK-LXZKKBNFSA-N	435.326	1.553	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCSC)[C@@H]1c1cccnc1	1813032430	BISUDBISSDEXOS-LUKYLMHMSA-N	429.970	1.455	50	20	IDGD	
O=C(CNC(=O)C(F)(F)F)NC[C@@H]1CCN(C(=O)C(Cl)Cl)[C@H]1c1cccnc1	1813100922	KAFSQYWXMPTXAQ-JQWIXIFHSA-N	441.237	1.570	50	20	IDGD	
O=C(CN1CCCC1=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](F)Br)CC2	1814597296	AFZIEUBTCSDGJX-ISVAXAHUSA-N	433.303	1.368	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3sc(N)nc3C)sc2C1	1815148579	LMLJYSQUYPIDNO-RKDXNWHRSA-N	429.955	1.970	50	20	IDGD	
Cc1cccnc1C(=O)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1	1815350600	ZNUVBMRIFQRZKK-OAHLLOKOSA-N	436.302	1.066	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cncc(F)c2)n[nH]1	1816533213	DECKRZWQWCTNIF-INIZCTEOSA-N	431.472	1.623	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](F)Br)CC2)c1cc(O)nc(O)c1	1816727033	CFSPNBXYPMLHHU-JVXZTZIISA-N	445.270	1.866	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)N[C@H]1CCc2nc(NC(=O)[C@H](F)Cl)sc2C1	1817118221	UXMWWEVHUSQYAH-HZMBPMFUSA-N	425.873	1.415	50	20	IDGD	
Cc1cc(NC(=O)CC(=O)Nc2cc([C@H]3CCCCN3C(=O)[C@H](O)CCl)[nH]n2)no1	1818092391	ZNLQUTGTGKCMLC-CHWSQXEVSA-N	438.872	1.327	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3cnn4ccncc34)sc2C1	1818507728	WSOXUCWYBVVOIS-CMPLNLGQSA-N	434.909	1.665	50	20	IDGD	
O=C1COc2ccc(C(=O)Nc3cc([C@H]4CCCCN4C(=O)[C@@H](O)CCl)[nH]n3)cc2N1	1819100799	FLPCABXEHQOPAV-CABCVRRESA-N	447.879	1.646	50	20	IDGD	
CC(C)(C)[C@@H](O)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819401546	GZZBYAHGASHDLJ-WBVHZDCISA-N	443.508	1.121	50	20	IDGD	
COc1ccccc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1820438777	VLPGKLFZCTYPNW-LJQANCHMSA-N	448.288	1.718	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCc2ccc(O)nn2)[nH]n1	1822377551	XTGATSRRUAIDQT-ZFWWWQNUSA-N	436.900	1.784	50	20	IDGD	
C[C@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](F)Br)[nH]n1)n1cncn1	1822768423	GCURNWCTMKVLOX-CDMKHQONSA-N	428.266	1.945	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)CCl)CC2)c1cccc(-n2cncn2)c1	1823717803	FXPQYWIDOCQWJW-DOMZBBRYSA-N	446.920	1.549	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)C[C@H]2CCCCO2)CC1	1824912394	BJBRFUXLYKCFNL-UXHICEINSA-N	436.597	1.938	50	20	IDGD	
O=C(CNC(=O)c1ccco1)N[C@H]1CCc2nc(NC(=O)C(Cl)Cl)sc2C1	1826098997	NRLJPYYZPAORFW-QMMMGPOBSA-N	431.301	1.882	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)CSc3nc[nH]n3)sc2C1	1826676037	XJCJLBSTSSGKOP-BDAKNGLRSA-N	430.943	1.219	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(=O)n3[nH]cnc3n2)CC1	1827047022	NQNBDBZYLUXZBE-MRXNPFEDSA-N	448.955	1.916	50	20	IDGD	
C[C@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](F)Cl)CC1)[C@@H]1SC(=N)NC1=O	1827614274	YXXDYRGSOAANKR-DOERSZECSA-N	432.949	1.943	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4ccnn4c3)C2)C1	1830365068	AMKRVNHWDBMDIS-NRFANRHFSA-N	434.924	1.669	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CC[C@@H](C(=O)OC)C1)CCO2	1830714241	NQRXQANBGOBSLH-KSVNGYGVSA-N	430.929	1.050	50	20	IDGD	
O=C(Cc1ccc(Cl)c(F)c1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1830719935	PDOBWTZRSASTPY-VQIMIIECSA-N	449.306	1.078	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3nn(C)c4c3CCC4)C2)C1	1831646615	LVCWMMKHNAUJEY-HRAATJIYSA-N	438.956	1.386	50	20	IDGD	
Cc1cc(CC(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)no1	1832130386	QUOBWCACWCAYLR-NRFANRHFSA-N	439.321	1.139	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3cccc(C)c3)CCO2)C1	1832244044	YWBXWVORQKVZRL-DENIHFKCSA-N	438.952	1.638	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)[C@@H]3CCCCN3C)CC2)CC1	1833323567	RLLVBDIIIQFMOZ-QAPCUYQASA-N	443.430	1.826	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccccn3)CCO2)C1	1833980591	OCNVRUFDKOGSCR-RDTXWAMCSA-N	426.311	1.183	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(C)on3)CCO2)C1	1834350483	AKXSBLLBNXIDPE-CXAGYDPISA-N	430.299	1.227	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3csc(C)c3C)CCO2)C1	1834541393	KVJMFPGLKUPKGG-APWZRJJASA-N	430.954	1.689	50	20	IDGD	
COCCOCC(=O)NC1CCN(C2CCN(C(=O)CO[Si](C)(C)C)CC2)CC1	1834565624	FXYHPDIKGLXGMI-UHFFFAOYSA-N	429.634	1.073	50	20	IDGD	
CC(C)NCCC(=O)NC1CCN(C2CCN(C(=O)[C@H](C)CBr)CC2)CC1	1834780065	MVZRVDFRYKBWOG-MRXNPFEDSA-N	445.446	1.977	50	20	IDGD	
C[C@H](C(=O)N1CCC(N2CCC(NC(=O)[C@@H](F)Cl)CC2)CC1)n1ccccc1=O	1835083980	DIWYQLLGFVQPKB-RDTXWAMCSA-N	426.920	1.515	50	20	IDGD	
Cc1ccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)cc1	1835084396	CSVZRMDVAISYDO-IEBWSBKVSA-N	443.313	1.684	50	20	IDGD	
O=C(Cc1noc2ccccc12)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1835980393	NQLIQPUVNITYNG-HKUYNNGSSA-N	425.844	1.361	50	20	IDGD	
O=C(c1ccnc2c1OCO2)N1CCC(OC2CCN(C(=O)[C@@H](F)Cl)CC2)CC1	1838082234	DZQLDZFYKRHZPZ-MRXNPFEDSA-N	427.860	1.957	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(C#N)c3)CCO2)C1	1838908582	ILRBIPQVKMXRBF-KUHUBIRLSA-N	436.306	1.412	50	20	IDGD	
O=C(c1ccc(F)cc1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1838956731	UPKRDFWOQWXDHD-PBHICJAKSA-N	433.249	1.586	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(F)cc1F)CCO2	1839005253	HHTOHMFIRRCFBX-FQEVSTJZSA-N	442.535	1.886	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnnc4ccccc34)C2)C1	1839145198	YPWFXAVYTINBRO-DYESRHJHSA-N	432.908	1.717	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)C(F)(F)C(F)F)C2)C1	1839150102	BTDRZESTXXCTNJ-UONOGXRCSA-N	439.233	1.580	50	20	IDGD	
Cc1ncccc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839197648	DQQSREAGSITSKC-PBHICJAKSA-N	430.274	1.151	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3n[nH]c4c(C)cccc34)CCO2)C1	1839596336	SDHDTYRVVTVWSY-KKSFZXQISA-N	434.924	1.959	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(Cl)nc3)C2)C1	1840149624	VWJFTHPOYYSFEQ-KDOFPFPSSA-N	432.304	1.059	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)Oc3ccccc3)C2)C1	1840154772	FVFMTFWVLURMQY-HGHGUNKESA-N	440.924	1.164	50	20	IDGD	
C[C@H](Cc1ccccn1)C(=O)N1CCO[C@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1	1840334371	SRQCMTYBLPMOGD-GCJKJVERSA-N	449.624	1.568	50	20	IDGD	
C[C@H](Oc1cccnc1)C(=O)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1840454361	CWGMCOSFRHIEMW-SCLBCKFNSA-N	432.304	1.109	50	20	IDGD	
Cc1ccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@](C)(Cl)CCl)C3)C2)o1	1840508833	IQWDVTJVZSASIH-RTBURBONSA-N	433.332	1.823	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)CC[C@H]3CCOC3)CCO2)C1	1840585153	AITHNGOHRPBKDT-GJYPPUQNSA-N	447.370	1.291	50	20	IDGD	
Cc1ccc(CCC(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)cc1F	1841578105	IBGHFCWMXGMUHD-UHFFFAOYSA-N	439.491	1.582	50	20	IDGD	
COc1cc(CC(=O)N2CCCC23CN(C(=O)[C@@H](O)CCl)C3)cc(OC)c1OC	1841784167	XPLSSGBYTASMFJ-AWEZNQCLSA-N	426.897	1.058	50	20	IDGD	
O=C(c1cccnc1-c1ccccc1)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843011349	ULWWPQRNCPBHSP-UHFFFAOYSA-N	441.296	1.559	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)CSC1CCCC1)C2	1843415254	DQUGECXSKPCEKR-HZHRSRAPSA-N	431.562	2.000	50	20	IDGD	
O=C(/C=C/C(=O)N1CCCC12CN(C(=O)[C@H](F)Br)C2)NCc1ccco1	1844344669	VYSMFZSNVZFPKM-RGDDUWESSA-N	428.258	1.346	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)c2cc(-c3ccccc3)no2)C1	1844478161	GBPNZBUVOMOQDL-UHFFFAOYSA-N	431.257	1.152	50	20	IDGD	
O=C(NNC(=O)c1ccc(NS(=O)(=O)c2ccc(Cl)s2)cc1)C(=O)NC1CC1	9890036	DKHODTIFKVFHSR-UHFFFAOYSA-N	442.906	1.242	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)cc1	17113219	BZSVCMQWTRDUGE-UHFFFAOYSA-N	428.401	1.818	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)c1ccc2c(c1)C(=O)N(C[C@@H]1CCCO1)C2=O	17580872	QEAPWFWXXKWBFR-HNNXBMFYSA-N	447.451	1.493	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)CCCNS(=O)(=O)c2ccc3c(c2)OCCCO3)n1	21127130	ILIMPVASGUKBAB-UHFFFAOYSA-N	435.506	1.457	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)CN2C(=O)[C@H](C)Oc3ccccc32)cc1	115402107	QDXSDONXXLVKLU-CABCVRRESA-N	427.457	1.814	50	20	IDGD	
CC(C)(C)OC(=O)NCCc1ccc(CNC(=O)NN[C@]2(C)CCS(=O)(=O)C2)cc1	726275191	XWQNGLYKJOXBMP-HXUWFJFHSA-N	440.566	1.635	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)NCCC(=O)NC(C)(C)C)c2ccccc2c1=O	728135131	XISONKUREJKQDO-UHFFFAOYSA-N	444.536	1.836	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)c1ccc2c(c1)CC(=O)N2C	728402175	ZTNIZNUUOBAWIA-LBPRGKRZSA-N	434.456	1.158	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)CCNC(=O)OCC(F)(F)F)c1	728526350	RZQRCUKMEQYTJP-UHFFFAOYSA-N	442.188	1.897	50	20	IDGD	
COc1ccc2c(c1)CCCN(C(=O)NNC(=O)c1csc(N3CCOCC3)n1)C2	728594210	IEIAFOIFGNPDAC-UHFFFAOYSA-N	431.518	1.791	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)[C@@H]2CS[C@H](Cc3ccccc3F)C(=O)N2)cn1	729691989	GULIDHUIXGRTPJ-LSDHHAIUSA-N	449.533	1.390	50	20	IDGD	
Cc1c(C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)cnn1-c1cccc(Br)c1	729946103	TXDMTODDARKZBW-LLVKDONJSA-N	441.307	1.139	50	20	IDGD	
O=C(O)CNC(=O)c1ccc(S(=O)(=O)NNC(=O)c2cccc(C(F)(F)F)c2)cc1	729962578	AWOVRJBOLQNBLQ-UHFFFAOYSA-N	445.375	1.143	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CSc2nnnn2CC(F)(F)F)ccc1OC(C)C	729966925	ZCBPLLCFWJQKLA-UHFFFAOYSA-N	448.427	1.585	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)CC[C@@H]1NC(=O)N(c2ccc(Cl)cc2)C1=O	730748069	HPRQENSCTPISRL-INIZCTEOSA-N	444.875	1.944	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)NC2CCN(CCC(=O)N(C)C)CC2)c1C	731543647	OKFKNJDIVWCNSY-QGZVFWFLSA-N	433.553	1.344	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2cc(C(=O)NNC(=O)C3CCC3)ccc2Cl)C[C@H](C)O1	732141410	KSLBKXKZFVIVSO-RYUDHWBXSA-N	429.926	1.699	50	20	IDGD	
Cc1c(C(=O)NNC(=O)CCN2C[C@H](C)O[C@H](C)C2)nnn1-c1ccc2ncccc2c1	732258927	IQYJFTZLTOCVCZ-GASCZTMLSA-N	437.504	1.384	50	20	IDGD	
Cc1c(C(=O)NNC(=O)CCN2C[C@H](C)O[C@H](C)C2)nnn1-c1ccc(OC(C)C)cc1	732259265	BNUZBBTXGZEQBC-IYBDPMFKSA-N	444.536	1.623	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)N[C@H](Cc1ccccc1)CN1CCOCC1	732476310	DFTOSNFHQHAHSP-FXAWDEMLSA-N	444.507	1.867	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCc2cc3c(nc2O)CCC3)nc1	733651061	FAJZBRNQHPRPKI-UHFFFAOYSA-N	434.522	1.528	50	20	IDGD	
CCS(=O)(=O)CC(C)=NNC(=O)c1ccc(NN=C(C)CS(=O)(=O)CC)cc1	733745984	WJUCLUUFIGUPPN-UHFFFAOYSA-N	430.552	1.450	50	20	IDGD	
C[C@H](c1cccnc1)N1CCN(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)CC1	734162329	CPBROPUMOIQSBS-OAHLLOKOSA-N	445.549	1.108	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)CS(=O)(=O)c1ccc(C(C)=O)c(F)c1	734809673	NHLPIGBPAITEGM-UHFFFAOYSA-N	438.433	1.037	50	20	IDGD	
C[S@@](=O)Cc1cccc(C(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)c1	734826072	VZNLBPZZLZDXGS-SSEXGKCCSA-N	438.550	1.909	50	20	IDGD	
CC(C)Cc1nc(C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)cs1	735117880	IGXOPBMZTFHSQT-UHFFFAOYSA-N	438.579	1.430	50	20	IDGD	
CCc1ccccc1CNC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	741091599	RWUCTUNRJQDAPN-UHFFFAOYSA-N	432.550	1.406	50	20	IDGD	
CCn1nc(C)c(S(=O)(=O)NNC(=O)c2ccc(OC)c(Br)c2)c1C	741657118	OMIUUNIRZUBKNL-UHFFFAOYSA-N	431.312	1.914	50	20	IDGD	
C[C@H]1Oc2ccccc2N(CCC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)C1=O	743830570	HGQXKCPEKGXTQI-CYBMUJFWSA-N	446.485	1.447	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)CNC(=O)c2cc3ccccc3[nH]2)cc1	743831488	XVUZKEZZOVNHRF-UHFFFAOYSA-N	429.458	1.154	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12)[C@H]1CCOC1	745862316	UZSIZDXMAPFXFZ-RDJZCZTQSA-N	435.484	1.814	50	20	IDGD	
CCOC(=O)C1(C(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)CC1	746110972	PLNJNKOVFSHGGM-UHFFFAOYSA-N	434.456	1.493	50	20	IDGD	
Cc1nc2c(c(O)nn2C)c(C)c1CCC(=O)NNC(=O)NCCNC(=O)OC(C)(C)C	746270394	WKPAAMMPXNGBJU-UHFFFAOYSA-N	449.512	1.078	50	20	IDGD	
CCN1CCN(Cc2ccccc2CNC(=O)NNC(=O)Cc2cn3ccccc3n2)CC1	746744755	NVAMMJQSLBFMOY-UHFFFAOYSA-N	449.559	1.545	50	20	IDGD	
CC(=NNC(=O)c1ccc(Cl)cc1F)c1ccc(S(=O)(=O)NCC(=O)O)cc1	747644055	WTMOFKBGZPZTNX-UHFFFAOYSA-N	427.841	1.996	50	20	IDGD	
O=C(CNC(=O)NCc1ccc(F)cc1)NNc1ccc(S(=O)(=O)C(F)F)cc1	748609941	FNIAVQUBSPXENK-UHFFFAOYSA-N	430.408	1.765	50	20	IDGD	
Nc1c(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cccc1[N+](=O)[O-]	749323261	CDDBPDXCFZZTCM-UHFFFAOYSA-N	433.446	1.036	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)CC23C[C@H]4C[C@@H](CC(O)(C4)C2)C3)cc1OC	750512146	DMSPBUFSFUZGGI-KKQCZIFWSA-N	446.500	1.729	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)N[C@H]2CCN(c3cccc(Cl)c3)C2=O)cc1	750671984	WPJHQSBQWCZGFR-KRWDZBQOSA-N	432.864	1.863	50	20	IDGD	
Cc1nn(-c2ccc(Cl)cc2)c(C)c1CC(=O)NNC(=O)CNC(=O)c1ccco1	751203352	MVFWALAUSWIBLO-UHFFFAOYSA-N	429.864	1.855	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)nc(O)n2C1CCCC1)c1ccc(-n2cnnn2)cc1	751294601	GMYRROCGPUCGNX-UHFFFAOYSA-N	432.444	1.908	50	20	IDGD	
COc1cc(OC)cc(-n2nnnc2CN(C)C(=O)NNC(=O)c2ccccc2OC)c1	752009328	CQYDMTHPFMRYIA-UHFFFAOYSA-N	441.448	1.175	50	20	IDGD	
COC(=O)COc1c(C)cc(C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1C	752502361	FEJXMOBCGXRRGM-UHFFFAOYSA-N	438.440	1.177	50	20	IDGD	
CC(CN1C(=O)CCC1=O)=NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	754911953	PMCVCIQJSLNWRI-UHFFFAOYSA-N	431.452	1.700	50	20	IDGD	
C[C@H]1C[C@H](C)CN(S(=O)(=O)c2ccc(NC(=O)NNC(=O)Cc3cc[nH]n3)cc2)C1	755421046	QQDMMQHJSYFBBG-KBPBESRZSA-N	434.522	1.472	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2cnn(C)c2)c1	755492861	LBPQBZAESWCTQS-UHFFFAOYSA-N	444.473	1.696	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)Nc1ccccc1Cn1cncn1	756152700	QUOLKCWEJSYTOZ-UHFFFAOYSA-N	448.531	1.691	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1ncc(Cc2ccccc2)s1	756155193	MNLCFEUWUHUJET-UHFFFAOYSA-N	438.465	1.905	50	20	IDGD	
CCN(CC)C(=O)c1ccccc1NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	756204763	ZFYWEROCSBUKLF-UHFFFAOYSA-N	436.472	1.882	50	20	IDGD	
CC(=O)N(C)c1ccc(NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1	756262250	PVFCMSOHENTGSD-UHFFFAOYSA-N	447.517	1.451	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2ccc(Cl)cc2O)cc1	756784670	PZCSNRIQFSBMGG-UHFFFAOYSA-N	442.881	1.437	50	20	IDGD	
CSc1nsc(NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)n1	757587962	MUVIOLGOVNIFJT-UHFFFAOYSA-N	442.548	1.511	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)Nc1cnn(-c2cnc3ccccc3n2)c1	757783223	UXQVOROTWLXFFY-UHFFFAOYSA-N	448.399	1.955	50	20	IDGD	
COCCOc1ccc(C#N)cc1NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	758013481	DZPFADMFJXKLAY-UHFFFAOYSA-N	436.428	1.297	50	20	IDGD	
CC(C)n1nnnc1-c1ccccc1NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	758014929	VFJSGNZUCVXUNY-UHFFFAOYSA-N	433.436	1.363	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N2CCCN(C)CC2)cc1	758050369	RDXYVVCRVPCMDN-JXAWBTAJSA-N	436.516	1.505	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N2CCCN(C)CC2)cc1	758050372	RDXYVVCRVPCMDN-NBVRZTHBSA-N	436.516	1.505	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NC[C@@H](C)c2nccs2)cc1	758721670	BUWPFZMOJGYCSP-CYBMUJFWSA-N	425.536	1.206	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)CCn2cnc3ccc(Br)cc3c2=O)nc1	759730541	JUYWVCDBQDWPTH-UHFFFAOYSA-N	446.261	1.874	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C[C@H](C)NS(=O)(=O)c2cccnc2Cl)cc1	760286424	YYXRVAMWOKITCP-ZDUSSCGKSA-N	440.909	1.327	50	20	IDGD	
COc1cc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc2c1O[C@H](C)C2	761073359	ZCTNUSAXGJYDRM-XIKOKIGWSA-N	442.424	1.163	50	20	IDGD	
O=C1CCc2cc(C(=O)NNC(=O)c3ccc(S(=O)(=O)N4CCCC4)cc3)ccc2N1	761657324	NYHGKJRACFYRLE-UHFFFAOYSA-N	442.497	1.431	50	20	IDGD	
Cc1n[nH]c(C)c1[C@H](C)CC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	763378937	NCVCHSFNBWMAKN-CYBMUJFWSA-N	449.533	1.002	50	20	IDGD	
CCC(=O)NNC(=O)C(=O)Nc1cccc(CS(=O)(=O)c2ccc(F)cc2F)c1	763442319	TYSMDFOISUZOER-UHFFFAOYSA-N	425.413	1.435	50	20	IDGD	
CC(=O)NNC(=O)C(=O)Nc1ccc(C(=O)OC2CCN(C(=O)OC(C)(C)C)CC2)cc1	763516440	IBYBSPPJQDOMAE-UHFFFAOYSA-N	448.476	1.349	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)n(Cc2ccccc2)n1	763573456	SEFIOCMWPYRGIU-SFHVURJKSA-N	435.440	1.166	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(NC(=O)[C@@H]3CCCO3)cc2)c1	763619465	XADMPUGRPJXAKH-SFHVURJKSA-N	440.456	1.277	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2cnn(-c3cnc4ccccc4n3)c2)c1	763630441	LHSIQOUSBLGZEZ-UHFFFAOYSA-N	445.439	1.289	50	20	IDGD	
O=C(COc1cccc(C(F)(F)F)c1)NNC(=O)C(=O)Nc1ccc(-n2nccn2)cc1	763640663	PZLMTMLIDVGMOG-UHFFFAOYSA-N	448.361	1.451	50	20	IDGD	
COC(=O)c1cc(OC)ccc1NC(=O)C(=O)NNC(=O)COc1cc(C)cc(C)c1	763647890	SAINOTDOTNZGGC-UHFFFAOYSA-N	429.429	1.264	50	20	IDGD	
COC(=O)c1cc(F)c(F)cc1NC(=O)C(=O)NNC(=O)COc1cc(C)ccc1C	763665412	IDIJMJFPBCKJMU-UHFFFAOYSA-N	435.383	1.533	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)C(=O)Nc1cc(F)ccc1Br	763681040	FMDZUZWYJLRIOV-UHFFFAOYSA-N	428.189	1.892	50	20	IDGD	
Cc1ccccc1-c1cc(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)n(C)n1	763681954	XXHIJLRQRRWULQ-UHFFFAOYSA-N	432.440	1.432	50	20	IDGD	
COc1cc(C)ccc1NC(=O)C(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12	763789854	DEBATFWWQFYSJX-UHFFFAOYSA-N	437.456	1.694	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)C(=O)Nc1ccc2c(c1)OC(F)(F)O2	763790296	HNQYMSUKKIGXCQ-UHFFFAOYSA-N	431.311	1.057	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)OCC(=O)N2	763850911	BQEKTKXKWDKWHF-CYBMUJFWSA-N	448.435	1.724	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccccc2-n2nccc2C)cc1OC	763900456	JLCUCVSIDOGVHJ-UHFFFAOYSA-N	437.456	1.988	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)C(=O)Nc1cccc(NC(=O)[C@H](C)n2cccn2)c1	763950007	HQPSQRPAWQPGNN-HNNXBMFYSA-N	434.456	1.791	50	20	IDGD	
CC[C@H](C)Sc1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)c(C)c1	764001906	GPHOQDVGFRRWGE-QWHCGFSZSA-N	427.548	1.406	50	20	IDGD	
CC[C@H](C)Oc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1	764077716	MJHYUOGLGUJHDR-ZDUSSCGKSA-N	433.486	1.667	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2ccccc2CN2CCOCC2)cc1	764124089	BLYDGCIMUYLRLL-UHFFFAOYSA-N	440.500	1.246	50	20	IDGD	
CCOc1ccc(Br)cc1NC(=O)C(=O)NNC(=O)[C@@H]1Cc2ccccc2O1	764169641	XFZOIWJJHGSLMA-INIZCTEOSA-N	448.273	1.937	50	20	IDGD	
O=C(CCc1ccccc1)NNC(=O)C(=O)Nc1ccc(CN2C(=O)CCCC2=O)cc1	764192841	PKLJEHZGPSHDRT-UHFFFAOYSA-N	436.468	1.444	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)C(=O)Nc1ccn(CCc2ccncc2)n1	764239231	HXKAPXNBCMDMAG-UHFFFAOYSA-N	431.456	1.262	50	20	IDGD	
O=C(Cc1ccccn1)NNC(=O)C(=O)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1	764270741	SQLRADTYRAHVFW-LJQANCHMSA-N	447.499	1.054	50	20	IDGD	
COc1cc(C)ccc1Oc1ccc(NC(=O)C(=O)NNC(=O)Cc2cc[nH]n2)cc1F	764286665	ZQCZRFUSWFWANA-UHFFFAOYSA-N	441.419	1.987	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)CC(=O)N3)cc1Br	764327034	TZYKEBQSRVTSHJ-UHFFFAOYSA-N	447.245	1.352	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C(=O)Nc1cccc(Cn2cccnc2=O)c1)c1ccccc1	764328322	OVSNXSDNGNVEIM-IBGZPJMESA-N	433.468	1.571	50	20	IDGD	
COc1ccc(Br)c2[nH]c(C(=O)NNC(=O)CNC(=O)c3cccnc3)cc12	764344465	DGFMRNCBLGOBBC-UHFFFAOYSA-N	446.261	1.525	50	20	IDGD	
CSc1cnn(-c2ccccc2)c1NC(=O)C(=O)NNC(=O)COCc1ccccc1	764366940	FSSIDUXVOCDTEV-UHFFFAOYSA-N	439.497	1.897	50	20	IDGD	
CN1CCOc2ccc(NC(=O)C(=O)NNC(=O)c3cc(-c4ccc(F)cc4)[nH]n3)cc21	764388033	OINOSNWPXGASMU-UHFFFAOYSA-N	438.419	1.444	50	20	IDGD	
COCCOc1cc(C)ccc1NC(=O)C(=O)NNC(=O)CSc1ccccc1O	764404799	OBRVWZJCQSORPK-UHFFFAOYSA-N	433.486	1.604	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)C(=O)Nc2cccc(Oc3ccncc3)c2)c1	764431458	XUGLZBOLJLSXLO-UHFFFAOYSA-N	434.412	1.627	50	20	IDGD	
Cc1ccc(S(=O)(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)s1	765119044	LLRMETCTEOWAQH-UHFFFAOYSA-N	442.994	1.837	50	20	IDGD	
COC[C@@H](C)n1c(SCC(=O)NNC(=O)c2cc(C)[nH]n2)nnc1-c1ccccc1	765587224	RBOFYIIVHUJQLW-CYBMUJFWSA-N	429.506	1.737	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cc(C)[nH]n2)cc1S(=O)(=O)N[C@H]1CCCC[C@H]1C	765588382	ZEVMOALNFRKSKT-DOMZBBRYSA-N	449.533	1.659	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)c2cnn(-c3ccc(O)nn3)c2C)n[nH]1	765592477	NLWWYNYWWMKTTM-UHFFFAOYSA-N	434.416	1.150	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCN(c3nccc(C(C)C)n3)CC2)cc1OC	767889753	JYEXBQPEFPJWHQ-UHFFFAOYSA-N	442.520	1.200	50	20	IDGD	
CN(C)C(=O)c1cc(F)ccc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccccc2)[nH]n1	768231929	INTDWUXKSHKJIZ-UHFFFAOYSA-N	438.419	1.317	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(Cc3nnc4n3CCCCC4)cc2)o1	768242058	MSXJBQFHCDOBGX-UHFFFAOYSA-N	436.472	1.896	50	20	IDGD	
CC(C)(O)C(=O)NNC(=O)c1cc(I)ccc1Br	768255429	JROGECHSPHABRH-UHFFFAOYSA-N	427.036	1.586	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)Sc1nnc(-c2cnccn2)n1-c1ccc(OC)cc1	768412488	XSRLKYGUYTZZGU-LBPRGKRZSA-N	427.490	1.771	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)c1ccc2c(=O)n(C)c(S)nc2c1	768635695	IZUOWRDMWDYOKX-UHFFFAOYSA-N	434.499	1.391	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)NC3CCN(C(=O)c4ccccc4F)CC3)nc21	770342872	VRUKJUZTLQZYDB-UHFFFAOYSA-N	428.428	1.139	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2ccc(Br)c(F)c2)n(-c2ncccn2)n1	770815937	OZXXEJGYMONFEQ-UHFFFAOYSA-N	434.229	1.954	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)[C@H]1CCCN1C(=O)c1ccccc1OC(F)F	772017783	XMJGMGMVBRLGNE-DGCLKSJQSA-N	427.404	1.382	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCOCC2)cc1C(=O)NNc1nccnc1C(C)C	772853229	CUPKHIQHZBWJSR-UHFFFAOYSA-N	435.506	1.386	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)C(=O)Nc1cc2c(cc1Br)CCC2	773661932	REFULKFWLFODPL-UHFFFAOYSA-N	449.261	1.047	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2ccc3nc(N4CCOCC4)sc3c2)n1	773730603	HNURSYZCIZSUBG-UHFFFAOYSA-N	429.462	1.013	50	20	IDGD	
O=C(NNc1cccc(C(F)(F)F)c1)C(=O)Nc1cnn(CCN2CCOCC2)c1	773739942	HWLIQAFXZXDIPC-UHFFFAOYSA-N	426.399	1.316	50	20	IDGD	
O=C(NNC(=O)c1cc(OC(F)F)cc(OC(F)F)c1)N[C@@H]1CCS(=O)(=O)C1	775671801	BLALGEWFZOZTED-MRVPVSSYSA-N	429.348	1.021	50	20	IDGD	
COc1cccc(/C=C(/C(=O)NNc2cccc(S(C)(=O)=O)c2)n2nnnc2C)c1	776714448	DLQSNIMXAVHWBI-WQRHYEAKSA-N	428.474	1.535	50	20	IDGD	
N#CCc1ccccc1CC(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	776982271	FKAMMCQAWGESDI-UHFFFAOYSA-N	439.947	1.914	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)COC1CCN(C(=O)OC(C)(C)C)CC1	777096528	CKWKQWVHICNZAR-UHFFFAOYSA-N	436.509	1.671	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NN=Cc3cc(F)ccc3C)CC2)cc1	777889444	VXMQRYUFYBUMJZ-UHFFFAOYSA-N	432.521	1.899	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)CN2C(=O)N[C@]3(C[C@@H](C)C[C@@H](C)C3)C2=O)nc1C	778425242	ONBUJFKVQPUNMJ-OYHTYJOISA-N	432.481	1.152	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)c2ccc3c(c2)C[C@@H](C)N3S(C)(=O)=O)nc1C	778429747	SYXSSWDRFUYWBL-LLVKDONJSA-N	433.490	1.429	50	20	IDGD	
C[C@H]1CCN(C(=O)OC(C)(C)C)[C@H](C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)C1	778458250	ILLZDGXCVOAPDP-BBRMVZONSA-N	439.534	1.887	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(NC(=O)C(=O)NNc2ccccc2OC(F)(F)F)c1	778799306	LYTCISXMXQMLKP-UHFFFAOYSA-N	446.407	1.917	50	20	IDGD	
CCNC(=O)N(C)NC(=O)c1ccc(OC)c(S(=O)(=O)N[C@@H]2CCCC[C@H]2C)c1	780711479	LWLKNHJOMSVYHJ-UKRRQHHQSA-N	426.539	1.858	50	20	IDGD	
COC(=O)c1ccccc1NNC(=O)CCNS(=O)(=O)c1ccc(NC(C)=O)cc1	780739260	YJLIYJLSOZZDKG-UHFFFAOYSA-N	434.474	1.243	50	20	IDGD	
CC(C)(C#N)CNC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	781954482	HLNQUCWGRWGSOW-UHFFFAOYSA-N	429.502	1.659	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NCc2cccc(S(=O)(=O)N(C)C)c2)cc1C	782767116	IQXXSNCQMCXUKR-UHFFFAOYSA-N	434.518	1.463	50	20	IDGD	
CCCN(C(=O)c1ccccc1NC(=O)C(=O)NN[C@@]1(C)CCS(=O)(=O)C1)C(C)C	783423917	BNPRADZSQIBOLD-FQEVSTJZSA-N	438.550	1.084	50	20	IDGD	
CN(NC(=O)C(=O)Nc1cc(Cl)ccc1OCCS(C)(=O)=O)c1ccccc1	783430080	XXZWFEFUCLILNE-UHFFFAOYSA-N	425.894	1.870	50	20	IDGD	
O=C(NNc1nccc2sccc12)C(=O)Nc1ccc(CC(=O)N2CCOCC2)cc1	783444353	CPTJHDJZFXOBHU-UHFFFAOYSA-N	439.497	1.779	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CNC(=O)c2cccs2)cc1OC(F)F	784003283	DARNUFPKTWKIHE-UHFFFAOYSA-N	426.401	1.174	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)[C@H]2CC=CC[C@@H]2C(=O)N2CCOCC2)cc1	784294873	TYIBPFYUKWZTOX-UXPWSPDFSA-N	445.516	1.441	50	20	IDGD	
COc1ccc(C(=O)N2CCN(C)CC2)cc1NC(=O)C(=O)NNc1cccnc1Cl	784843177	CDQFUMIJBJSOKC-UHFFFAOYSA-N	446.895	1.213	50	20	IDGD	
O=C(NNc1cccc(C(F)(F)F)n1)C(=O)Nc1cccc(N2CCCS2(=O)=O)c1	784951353	KSLBUYNRVBFTEJ-UHFFFAOYSA-N	443.407	1.722	50	20	IDGD	
CCOC(=O)c1cc(C)sc1NC(=O)C(=O)NNC(=O)Cc1cn2ccccc2n1	785059973	FGITYWDISUALHU-UHFFFAOYSA-N	429.458	1.210	50	20	IDGD	
CCCCOC(=O)c1ccc(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)cc1	785060632	ITKMLXQAWNXYSI-UHFFFAOYSA-N	437.456	1.620	50	20	IDGD	
CCNC(=O)COc1cccc(NC(=O)C(=O)NNc2nc(C(F)(F)F)cs2)c1	785145850	MEHQWKZNUAXMPV-UHFFFAOYSA-N	431.396	1.759	50	20	IDGD	
O=C1CN(C(=O)c2ccc(CNC(=O)NNC(=O)c3ccc4ccccc4c3)cc2)CCN1	787800933	QHLCSUHEMUDMIC-UHFFFAOYSA-N	445.479	1.556	50	20	IDGD	
CCOC(=O)[C@@H](C)NC(=O)[C@H](C)NC(=O)NNC(=O)Nc1ccc(OC(F)F)cc1	787880195	FJMFZBMMMODITE-VHSXEESVSA-N	431.396	1.080	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)CC1CCC2(CC1)OCCO2	788084022	WCYBRDSHGTVTKK-UHFFFAOYSA-N	430.549	1.670	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2cc(Br)ccc2O1)C1CCN(c2ncccn2)CC1	791573943	KUSNLKCYPGZQOM-MRXNPFEDSA-N	446.305	1.607	50	20	IDGD	
C[C@H](NS(=O)(=O)c1ccc(C(N)=O)cc1)C(=O)NNc1cc(Cl)cc(Cl)c1	791732261	YNKVBCZETMONNW-VIFPVBQESA-N	431.301	1.902	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N2C[C@H](C)O[C@@]3(CCOC3)C2)cc1Br	792932113	LWDACGFSGMOADH-GTNSWQLSSA-N	428.283	1.692	50	20	IDGD	
O=C(NNc1ccc2c(=O)[nH]ccc2c1)C(=O)Nc1ccc2c(c1)C(=O)N(CC1CC1)C2=O	793069744	QBAFRKSTGKFSBK-UHFFFAOYSA-N	445.435	1.616	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)N1CCC[C@H](C=NNC(=O)c2cc([N+](=O)[O-])ccc2O)C1	794517000	YSTDSGXTZBCNFU-CYBMUJFWSA-N	449.464	1.779	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1ccc(OC(F)F)c(C(F)(F)F)c1	797663599	UCOHHFSTGUSWDA-ZCFIWIBFSA-N	434.343	1.397	50	20	IDGD	
C[S@@](=O)c1ccc(CC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc1	797791744	FTAUBHCQDFBYKJ-GDLZYMKVSA-N	449.554	1.212	50	20	IDGD	
CCNS(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)c1	798307766	GLEXLMSLULSVGQ-UHFFFAOYSA-N	436.465	1.140	50	20	IDGD	
C[S@](=O)C1(CNC(=O)NNC(=O)[C@H]2Cc3ccccc3CN2Cc2ccccc2)CC1	799368676	YKYJCCFRDQBMOU-QJWGWKRISA-N	440.569	1.855	50	20	IDGD	
C[C@H](CCNS(=O)(=O)c1ccccc1)NC(=O)NNC(=O)Cc1ccc(Cl)cc1	801797509	IRERFJTXZXKLEK-CQSZACIVSA-N	438.937	1.970	50	20	IDGD	
C[C@@H]1CN(S(=O)(=O)c2cccc(C(=O)NNC(=O)Nc3ccccc3)c2)C[C@@H](C)O1	801991891	ZQWGQLXQGOALAI-HUUCEWRRSA-N	432.502	1.951	50	20	IDGD	
O=C1COC[C@H](C[C@@H]2CN(C(=O)C(=O)NNc3ccccc3[N+](=O)[O-])c3ccccc32)N1	806984382	JYTATZRFNSCGPP-KGLIPLIRSA-N	439.428	1.073	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2cccc(F)c2Cn2cccc(C)c2=O)nc1	806989310	DQPFAXMMMRTNMI-UHFFFAOYSA-N	425.420	1.830	50	20	IDGD	
COCc1nc(Cl)cc(NNC(=O)c2cc(-c3ccco3)nc3c(C(N)=O)ncn23)n1	807238083	SAIVNGPJLGNWAT-UHFFFAOYSA-N	442.823	1.435	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(Cl)c(Cl)c1)NNC(=O)Cc1ccccc1F	810373538	WDNQKSZGLFJMDM-UHFFFAOYSA-N	434.276	1.801	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)CNS(=O)(=O)c1cc(C)ccc1C	810792787	SLDKNEUAUNENEV-UHFFFAOYSA-N	437.543	1.530	50	20	IDGD	
CCn1c(S)nc2cc(C(=O)NNc3ccc(S(=O)(=O)N(C)C)cc3)ccc2c1=O	812730410	HXBFHEVJHGVSFJ-UHFFFAOYSA-N	447.542	1.712	50	20	IDGD	
CCCc1nnc(SCC(=O)NNC(=O)c2cc(-c3ccc(C)c(C)c3)[nH]n2)n1N	813501617	GEAWNYOCJDBMCL-UHFFFAOYSA-N	428.522	1.505	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)cc1)[C@H]1C[C@@H]1C	815566525	XFVANUXHGVGUOR-LIRRHRJNSA-N	449.467	1.484	50	20	IDGD	
CC(C)(C)Oc1c(F)cc(NC(=O)C(=O)NNC(=O)[C@H]2CCc3nncn3C2)cc1F	815691352	NGUMOAXWUNQYLD-JTQLQIEISA-N	436.419	1.082	50	20	IDGD	
C=C1c2ccccc2C(=O)N1[C@H](C)C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	821708463	POXUSWVEIKNAGQ-LJQANCHMSA-N	447.539	1.861	50	20	IDGD	
CN(CC(=O)NNC(=O)CCCNC(=O)C(C)(C)C)S(=O)(=O)c1ccc(Cl)cc1	822780828	WITLWGIAFCKXEB-UHFFFAOYSA-N	446.957	1.050	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2CCCCN2S(=O)(=O)c2ccccc2)cc1	837302171	VJFMZTTVXOLWPZ-GOSISDBHSA-N	444.513	1.324	50	20	IDGD	
Cc1ccc(-n2cnnc2SCC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1	894390318	BNCDAASCVSQCIW-UHFFFAOYSA-N	435.473	1.105	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)CN1C(=O)[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O	912601343	ZIIDAQLYYMHCQD-GVCQBIPESA-N	433.464	1.562	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)CCNS(=O)(=O)c1ccccc1Cl	913459323	SPDJQLIEGIDRPF-UHFFFAOYSA-N	439.921	1.797	50	20	IDGD	
O=C(NNc1ncccn1)c1cccc(NS(=O)(=O)c2ccc3nnn(O)c3c2)c1	913498396	VLQIUXQLQSLNIN-UHFFFAOYSA-N	426.418	1.016	50	20	IDGD	
CC(C)CNS(=O)(=O)c1ccc(C(=O)NNC(=O)COc2ccc(C#N)cc2)cc1	914748971	QURWBVJJQVVBRU-UHFFFAOYSA-N	430.486	1.333	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)[C@H]1CS[C@H](Cc2ccccc2F)C(=O)N1	914879958	CQFKEHWCCNTUEU-CRAIPNDOSA-N	447.488	1.203	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1ccc(Cl)cc1)C(=O)NNC(=O)COc1ccc(F)cc1	915787056	SYAJLASOZGQJHQ-LLVKDONJSA-N	429.857	1.372	50	20	IDGD	
NC(=O)c1cccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)c1	915906624	ZPPZJOQJBGELJM-UHFFFAOYSA-N	445.501	1.427	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)N[C@@H](C)c2cccc(S(N)(=O)=O)c2)c1C	916196648	BUZCJHNPNQGPAV-LSDHHAIUSA-N	434.518	1.810	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)NCc1ccccc1Cn1cncn1	916394370	QEKVILCJTFYQME-UHFFFAOYSA-N	425.405	1.144	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2ccc(OC)c(C(=O)O)c2)ccc1OC(C)C	917727941	UEPPDIQPQLQQCI-UHFFFAOYSA-N	438.458	1.813	50	20	IDGD	
Cc1nc(-c2ncccn2)sc1C(=O)NNC(=O)c1sc(N2CCOCC2)nc1C	917918499	SBPBVYHQXLQTFT-UHFFFAOYSA-N	445.530	1.585	50	20	IDGD	
CC(=NNC(=O)CN1c2cccc3cccc(c23)S1(=O)=O)c1ccc(-n2cnnn2)cc1	918711535	PSRBIROCDUEIAK-UHFFFAOYSA-N	447.480	1.865	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)NCc2ccc3c(c2)C(=O)NCC3)CC1	1320435846	BVOYRMPSXCPRPJ-UHFFFAOYSA-N	445.520	1.450	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2ccc(C)nc2Cl)cc1	1350158929	WIJQQJBOCXPUBK-UHFFFAOYSA-N	425.898	1.825	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnc4[nH]ncc4c3)C2)C1	1778416943	UAAZZUGKCWHDNT-MSOLQXFVSA-N	426.304	1.638	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C2(F)CCCCC2)C1	1778815174	SVMJBKVPCJKILN-DENIHFKCSA-N	446.328	1.166	50	20	IDGD	
CN(C)C(=O)c1cccc(C(=O)N2CCO[C@@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)c1	1779299589	AEVLOKAABNDEJN-JOCHJYFZSA-N	447.608	1.683	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(C)n(CC)n3)C2)C1	1779718878	LNBLLXSUSDCSBY-RDTXWAMCSA-N	427.343	1.828	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(C#N)cc(OC)c2)C1	1780091415	NNIRNMVNUYVVAI-NNMXDRDESA-N	449.935	1.948	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCCn1ccnc1)C2)[C@H](F)Br	1780777501	TYTUJUQWOVZSOH-UWWQBHOKSA-N	445.333	1.868	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCn1ccnn1)C2	1781904303	NPUYVYAGPJRGOT-IIDMSEBBSA-N	442.358	1.356	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)Oc2ccccn2)C1	1782540708	QRIDNZWCYURQSU-BIZBXSGISA-N	439.940	1.617	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccn4c(C)cc(C)nc34)C2)C1	1782578209	KDJVRPGZCUFHLU-DYESRHJHSA-N	434.924	1.648	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)C(C)(C)CNC(C)=O)CCO2	1783343480	NJAOJALYGIGPNR-KDOFPFPSSA-N	432.359	1.152	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](C)Br)C3)C2)nc2nccn12	1783537458	SJLBHQIHZOIPAK-FZKQIMNGSA-N	436.310	1.265	50	20	IDGD	
O=C(/C=C/C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21)NCc1ccccc1	1784054803	FUMZUDWFJYNWIH-KTHDREROSA-N	437.899	1.373	50	20	IDGD	
C[C@H](Cc1ccc(F)cc1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]2C1	1784094802	SHYAMDMJHLKGJK-CRWDZZMISA-N	426.916	1.584	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H]1C[C@H](C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]3C2)C1	1787451230	BMCAFJULACRPMD-QNILMXGZSA-N	447.935	1.804	50	20	IDGD	
Cc1c(C(=O)Nc2ccc(C3(NC(=O)c4ccc(B(O)O)cc4)CCC3)cc2)cnn1C	1787509383	IWOUKZMCCDMRQD-UHFFFAOYSA-N	432.289	1.470	50	20	IDGD	
COc1nccnc1C(=O)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1	1788140113	HJMVGQGRQANTDZ-UHFFFAOYSA-N	446.272	1.227	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cn(C)c4ncccc34)[C@H]2C1	1788465128	XDUXPWACZZSLFS-HPZZRFSDSA-N	449.349	1.950	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccn(C(F)F)n3)[C@H]2C1	1788938217	NLHWAAXQJNPPHD-MNXVOIDGSA-N	449.296	1.903	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(C)(C)OC(=O)NC(C)C)[C@H]2C1	1789753611	MGGLJHQBJLIXRZ-VGWMRTNUSA-N	431.961	1.897	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc(C(C)(C)C)cn3)C[C@@H]21	1791254311	NTVHGXMLTKWFNI-MPTYRVRUSA-N	438.956	1.621	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1ccc(C2(NC(=O)[C@H](O)c3ccco3)CCC2)cc1	1791596209	YRMDXBKSRZGANN-HXUWFJFHSA-N	428.489	1.820	50	20	IDGD	
CC(C)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(-n3ccnc3)ccn1)C2	1792784060	LZZYVCFTJJUPQD-JLVBRIDZSA-N	431.924	1.736	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COC1CCCCC1)C2	1792867023	RXYHJODEVPNMPG-AFIMGQEJSA-N	431.371	1.956	50	20	IDGD	
COc1cc(F)cc(/C=C/C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](O)CCl)c1	1792982406	CRAIYTKKJHVQJJ-LCXKQCPHSA-N	426.872	1.037	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1c[nH]c2cc(OC)ccc12	1793030690	XGZYIWYUDMUPMV-QKSJRXBFSA-N	449.935	1.562	50	20	IDGD	
CCC[C@H](NC(=O)c1ccccc1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCl	1793106948	LOBKUFGTBBAOGW-PJVZLEMVSA-N	435.952	1.823	50	20	IDGD	
COC(=O)[C@H]1CC[C@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)C(C)(C)CCl)C3)CC1	1793603360	LAKJPVBWGFWDAD-RDSHKEJNSA-N	428.957	1.820	50	20	IDGD	
CS(=O)(=O)c1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](F)Br)C3)nc1	1794749478	MJCMXSDLENHCFO-MIJXAVMKSA-N	448.314	1.427	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2c(n1)NC(=O)CC2	1796104888	YYEFEQBTTRPLEX-KRXQYRFLSA-N	434.924	1.577	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)c1cccc(Br)c1)C2)[C@H](F)Cl	1796367711	QUGKSUKYTQDGLA-HZZBMVKVSA-N	449.704	1.607	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1CC(C)(C)C1)C2	1796445758	IYXMXSVIESSVBD-KXJDEQQPSA-N	429.521	1.146	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2cccnn2n1	1798422212	DMBXXPYRLTVPIG-FAXLKDOZSA-N	436.310	1.106	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc3c(c1)COC3)C2	1798440369	KTQHAROBDARHGF-BCDXTJNWSA-N	435.484	1.281	50	20	IDGD	
Cc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)Br)C3)n(C(F)F)n1	1798681951	JXHUSFDGZVPLGA-KQXIARHKSA-N	435.269	1.573	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c(c1)NC(=O)[C@H](C)O3)C2	1799268653	BHMWAVBFDWIDBW-VGXVWSLXSA-N	435.908	1.627	50	20	IDGD	
O=C([C@@H](O)CCl)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1(c2ccc(Cl)cc2)CCC1	1800418245	PXSCEVNYENHVHW-DACLVMHWSA-N	441.355	1.951	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(C3CC3)on1)C2	1800637775	ICKDHQCLFMVCLQ-ZWUHOBOKSA-N	426.311	1.929	50	20	IDGD	
COc1ccc(C)c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)Br)c1	1800759658	BRVHDBOZPWYQST-ZJOBFFGXSA-N	425.323	1.990	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc([N+](=O)[O-])c(OC)c1	1801838200	OXXXTRVWWICMLP-UMPJEAMMSA-N	425.869	1.824	50	20	IDGD	
C=CC[C@@H](CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2)NC(=O)OC(C)(C)C	1801927947	ATPMUNFPZFRNNK-AUOOEQCUSA-N	447.935	1.970	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc3nn(C)cc3c1)C2	1802338476	MLTFRPKZDQUOQI-BCDXTJNWSA-N	426.521	1.198	50	20	IDGD	
COC(=O)c1ccc(C(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)cn1	1803139760	VSGBOJKNVHUXIL-OLMNPRSZSA-N	446.891	1.183	50	20	IDGD	
C[C@H](Nc1ccccn1)C(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]1c1cccnc1	1803142625	FWFLCVHXIIOHEJ-KNIMUDFMSA-N	431.924	1.583	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cn3cccnc3n2)[C@H]1c1cccnc1)[C@H](O)CCl	1803143113	UJVVUXGEWAURHI-UAGQMJEPSA-N	428.880	1.044	50	20	IDGD	
O=C(/C=C/c1ccoc1)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1804314691	YLLWLEAJJHJYCB-YMONZSNFSA-N	445.284	1.387	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1ccccc1O	1805196373	IZQNTZYYOUGDBY-AVRDEDQJSA-N	445.284	1.100	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2ccn(C)c2)[C@H]1c1cccnc1	1805294856	HRNSKQXYEZDITL-DYESRHJHSA-N	426.521	1.113	50	20	IDGD	
Cc1cncc(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)c1	1805768199	ZQGVCIIDTXHFQB-KNQAVFIVSA-N	444.300	1.098	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)C(C)(C)F)[C@H]1c1cccnc1	1806980581	JLCNNVFJMOCFFG-PMRLGZHMSA-N	442.495	1.970	50	20	IDGD	
N[C@@H](Cc1cscn1)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Cl)[C@@H]1c1cccnc1	1808204453	CZCIMBSCLCUZDQ-ARLBYUKCSA-N	425.917	1.648	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1CCN(C(=O)[C@@H]2CCC(=O)NC2)[C@@H]1c1cccnc1	1810538084	SALNVXXPNKHTEF-SQGPQFPESA-N	432.597	1.465	50	20	IDGD	
COc1ccnc(C(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)c1OC	1811647169	GIXSXPJLEHZYPG-HDMKZQKVSA-N	448.907	1.413	50	20	IDGD	
COC(=O)C12CC(C(=O)NC[C@@H]3CCN(C(=O)[C@H](O)CCl)[C@@H]3c3cccnc3)(C1)C2	1812834026	MBZIQFIBMXUDMD-XJKVJRSZSA-N	435.908	1.030	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)C2(C#N)CCC2)[C@@H]1c1cccnc1	1813074801	VWOLAANRHWDBFN-YLJYHZDGSA-N	426.521	1.154	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H](CNC(=O)C(Cl)Cl)[C@H]1c1cccnc1)N1CCN(C)CC1	1813078791	KWRHHSJGFVUHKI-DJIMGWMZSA-N	442.391	1.527	50	20	IDGD	
CCNC(=S)NCC(=O)N1CC[C@H](CNC(=O)C(Cl)Cl)[C@H]1c1cccnc1	1813081138	JDQHIRXXMRYFAH-TZMCWYRMSA-N	432.377	1.375	50	20	IDGD	
O=C(O)CSCC(=O)NC[C@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1	1813084542	ZUJLPAIGPFCLEZ-CXAGYDPISA-N	444.351	1.690	50	20	IDGD	
Cn1cc(CC(=O)NC[C@@H]2CCN(C(=O)CO[Si](C)(C)C)[C@H]2c2cccnc2)cn1	1813457137	JXDOSMIWWUPDPK-RXVVDRJESA-N	429.597	1.915	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)[C@H](C)n2cnnn2)[C@@H]1c1cccnc1	1813473610	WVYRRIDPKZCLGO-VIRABCJISA-N	436.314	1.119	50	20	IDGD	
Cc1cc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)n(C)n1	1816448149	USROSFGKUFBEMU-OAHLLOKOSA-N	430.513	1.131	50	20	IDGD	
O=C(CS(=O)(=O)N1CCCC1)N[C@H]1CCc2nc(NC(=O)[C@@H](F)Cl)sc2C1	1817121259	DHBXELKMEZLSGG-TVQRCGJNSA-N	438.934	1.015	50	20	IDGD	
CCOC(=O)N[C@H](O)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CO[Si](C)(C)C)n[nH]1	1819595090	AMAQRAQOUWZANI-XJKSGUPXSA-N	441.561	1.318	50	20	IDGD	
CC(C)(C)CC(=O)N[C@@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1	1819794677	BCZCCMIUAQQQEP-LLVKDONJSA-N	430.534	1.804	50	20	IDGD	
O=C(/C=N/O[C@@H]1CCCCO1)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](O)CCl)CC2	1819901429	VJHMSIQFFARGQT-XJBAITSVSA-N	430.914	1.184	50	20	IDGD	
CN1CCCn2nc(C(=O)Nc3cc([C@@H]4CCCCN4C(=O)[C@@H](O)CCl)[nH]n3)cc2C1	1821591803	OVRKUIZPQOWSHM-IRXDYDNUSA-N	449.943	1.347	50	20	IDGD	
C#CC(=O)Nc1cc([C@H]2CCCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)[nH]n1	1821874784	BUFJWWCFLNDCAC-GOSISDBHSA-N	437.504	1.381	50	20	IDGD	
CCc1oncc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1	1822412932	KJMYNUUSMANFRW-HNNXBMFYSA-N	431.497	1.639	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H]2CNC(=O)C2)CC1	1824096082	JOAQUDIIYIPYDY-FVQBIDKESA-N	428.371	1.773	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)CN(C)C(=O)C(=O)O)sc2C1	1824668713	ZUGPKOWRFQLZHH-VHSXEESVSA-N	430.914	1.006	50	20	IDGD	
C[C@](O)(CC(=O)O)CC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCBr)CC2	1826069677	VGUCHJTWHIEAKG-XXFAHNHDSA-N	448.339	1.456	50	20	IDGD	
O=C(C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1)c1ccco1	1827050322	MOLZPYZBLPTSBM-IBGZPJMESA-N	438.289	1.076	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)C2(F)CCC2)CC1	1828925612	MVCFZYQDBIYYIH-SFHVURJKSA-N	431.512	1.811	50	20	IDGD	
Cc1c(F)cccc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1830161273	VAFSOYGRYVANGQ-CRAIPNDOSA-N	447.276	1.895	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1830363687	JCZKGRPMMZPRPO-ABAIWWIYSA-N	429.714	1.398	50	20	IDGD	
CC(C)c1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)n[nH]1	1830365290	WJBJZNUFNPYOHV-HXUWFJFHSA-N	426.945	1.868	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cn(C)nc3C)CC2)CC1	1833583657	CDWBCPXSYVQCIG-SFHVURJKSA-N	425.961	1.168	50	20	IDGD	
Cc1ccsc1C(=O)N1CCO[C@]2(COCCN(C(=O)CCBr)C2)C1	1833944115	UUDZVOMMTAIFKE-KRWDZBQOSA-N	431.352	1.912	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1)c1cnsn1	1833979093	PKUKWEQKFBMHKL-CYBMUJFWSA-N	434.335	1.414	50	20	IDGD	
Cc1nc(C(=O)N2CCO[C@]3(COCCN(C(=O)CCBr)C3)C2)cs1	1834454314	WILXAVBKAAARNL-INIZCTEOSA-N	432.340	1.307	50	20	IDGD	
CC[C@@H](C)[C@@H](N)C(=O)NC1CCN(C2CCN(C(=O)CO[Si](C)(C)C)CC2)CC1	1834688221	KTHYCBFVJDUEQG-OXQOHEQNSA-N	426.678	1.783	50	20	IDGD	
COc1ccsc1C(=O)N1CCOC[C@]2(CN(C(=O)CCBr)CCO2)C1	1834823357	PSYIMYGTGBOFMD-KRWDZBQOSA-N	447.351	1.612	50	20	IDGD	
Cc1cnn(CC(=O)NC2CCN(C3CCN(C(=O)CCBr)CC3)CC2)c1	1834892644	QXEODGCUBCZYSZ-UHFFFAOYSA-N	440.386	1.548	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)c1cn2ccsc2n1	1835592891	KVJJVJNSLRHMPA-INIZCTEOSA-N	439.969	1.181	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)CO[Si](C)(C)C)CC2)CC1	1835837732	OBFWFEHEBUFLFX-KRWDZBQOSA-N	434.053	1.663	50	20	IDGD	
CC(=O)N(C)[C@@H](C)C(=O)N1CCC(N2CCC(NC(=O)[C@](C)(Cl)CCl)CC2)CC1	1836398102	FCLOGMGLGPXMSS-VBKZILBWSA-N	449.423	1.661	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)C3CCOCC3)CC2)CC1)[C@H](F)Br	1836412820	XCPMRQRTWNCDRL-INIZCTEOSA-N	434.350	1.675	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCC(OC2CCN(C(=O)C[C@](C)(O)CC(=O)O)CC2)CC1	1836624535	MWSJGIXXPJZVHS-NRFANRHFSA-N	446.972	1.866	50	20	IDGD	
C[C@@H](Cc1ccncc1)C(=O)N1CCOC[C@@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1837715639	BOEOVCDVZHMFCQ-PGRDOPGGSA-N	449.624	1.568	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC(OC2CCN(C(=O)[C@H]3CCC(=O)N3)CC2)CC1	1837781628	LLTXWJFUDUKYMK-QGZVFWFLSA-N	425.602	1.115	50	20	IDGD	
C/C=C/C=C\C(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1	1837921742	WJXCVNAKEKOMNF-HOJFPOIOSA-N	426.322	1.111	50	20	IDGD	
O=C(CCc1ccco1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839197763	HWRYJCBQVYBWIZ-WBVHZDCISA-N	433.274	1.359	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(-n4cncn4)c3)CCO2)C1	1839437013	ALWHNXFRROBBHT-NQIIRXRSSA-N	447.923	1.355	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)/C=C/c3cccs3)C2)C1	1840151998	TXMRFOJBTQXFTI-QDYBUIJZSA-N	428.938	1.472	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(C)c3Cl)C2)C1	1840156152	JKHYPHOVJWXITO-JXFKEZNVSA-N	445.343	1.972	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCCc3cccnc3)CCO2)C1	1840513501	CLLBBGWVWVSDNA-RXVVDRJESA-N	439.940	1.115	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1CCCOC1)CCO2	1840878453	HRACCOGVWWGWQV-VKJFTORMSA-N	433.343	1.043	50	20	IDGD	
Cc1ccc(=O)n(C(C)(C)C(=O)N2CC3(CCCN3C(=O)[C@H](C)CBr)C2)n1	1841287674	AMCCQDBYANYARC-CYBMUJFWSA-N	439.354	1.521	50	20	IDGD	
CC(C)(C)OC(=O)N1CCCC[C@@H]1C(=O)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1	1841353672	JTMIJNBRJKOJCV-CABCVRRESA-N	429.945	1.579	50	20	IDGD	
CNC(=O)CC(=O)N1CCCC12CN(C(=O)/C(C#N)=C/c1ccc(Br)cc1)C2	1841562328	MSTXSYABDNDBEP-OQLLNIDSSA-N	445.317	1.696	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)/C=C/c1cccc(C)n1)C2	1843415211	YODZKRPNCJZXHK-NYXNPACISA-N	434.500	1.741	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)CCSC(=N)N)C2	1844692277	FRENWYQNYOFGHX-UHFFFAOYSA-N	449.489	1.354	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)CC[C@@H]1CNc3ccccc3C1)C2	1846384642	PXZQDNMLQHMQAK-SFHVURJKSA-N	441.576	1.627	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@](C)(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](O)CCl)C1	1847559489	NHGZAUORKYOVHU-UJKGCTCZSA-N	429.945	1.435	50	20	IDGD	
O=C(COC(=O)[C@H]1CCCN(C(=O)c2ccc(F)cc2)C1)NNC(=O)c1ccccc1	11060269	FORUVNFHLNIZAQ-KRWDZBQOSA-N	427.432	1.682	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1	15925886	SCQWBWIFWDUVTE-UHFFFAOYSA-N	433.486	1.563	50	20	IDGD	
C#CCNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2ccc(OCCC)c(OC)c2)cc1	28080577	HZEYGZJQGJDSMF-UHFFFAOYSA-N	445.497	1.470	50	20	IDGD	
COc1ccc([C@@H](CNC(=O)NNC(=O)CNC(=O)c2cccs2)N2CCCC2)cc1	725872951	TVQRCMCFEUXCIV-QGZVFWFLSA-N	445.545	1.654	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(Cl)cc1)NNC(=O)c1cc(Br)c[nH]1	726292891	LTZMTNNXFKFXHH-UHFFFAOYSA-N	435.687	1.170	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)N[C@H](CN2CCN(C)CC2)c2ccccc2)cc1	727945535	LNWCGMPUHSOZGM-OAQYLSRUSA-N	425.533	1.693	50	20	IDGD	
N#Cc1cccc(C(=O)NNS(=O)(=O)c2cc(Br)ccc2[N+](=O)[O-])c1	728853638	XGNWVGVKBOPGAH-UHFFFAOYSA-N	425.220	1.852	50	20	IDGD	
COc1cccc(N2CC[C@@H](NC(=O)NNC(=O)C3CCN(c4ncccn4)CC3)C2)c1	728954417	YKJRNSINWDVXGC-QGZVFWFLSA-N	439.520	1.311	50	20	IDGD	
Cc1cccc(COc2cccc(CC(=O)NNC(=O)N[C@H]3CCS(=O)(=O)C3)c2)c1	729969203	WFYKXIPWLYIHPV-SFHVURJKSA-N	431.514	1.634	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)[C@@H]2CCN(c3ccc4c(c3)OCCO4)C2=O)c(C)c1	730586044	ZPLRCOYOPSSFNZ-KRWDZBQOSA-N	438.484	1.687	50	20	IDGD	
O=C(NCc1cocn1)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	730911626	LWDNVCXPVDBTJG-UHFFFAOYSA-N	429.458	1.297	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNS(=O)(=O)c1cc(C(=O)O)cc(Cl)c1Cl	731340845	UIISSXCIFZIQLN-UHFFFAOYSA-N	436.229	1.024	50	20	IDGD	
Cc1c(C(=O)NNC(=O)[C@H]2COc3ccccc3O2)nnn1-c1cccc2cccnc12	731453572	MMWITDMFAWJTNV-GOSISDBHSA-N	430.424	1.725	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)CN1C(=O)CCc2ccccc21	732053404	AQTHBMNJFQYTHF-UHFFFAOYSA-N	429.502	1.029	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)c1cc(S(N)(=O)=O)ccc1N1CCOCC1)c1ccccc1	732133032	NXHNENOGCUTREU-KRWDZBQOSA-N	446.529	1.125	50	20	IDGD	
O=C(C[C@@H]1SC(N2CCCC2)=NC1=O)Nc1ccc(C(=O)NNC(=O)C2CCC2)cc1	732141183	PERILNHLXMWEHZ-INIZCTEOSA-N	443.529	1.670	50	20	IDGD	
O=C(COC(=O)[C@@H]1CCCN(CC(F)(F)F)C1)NNC(=O)c1cccc([N+](=O)[O-])c1	732331530	DKOJUMCWRQSXIU-GFCCVEGCSA-N	432.355	1.173	50	20	IDGD	
CN1CCN(c2ccc(CNC(=O)NNC(=O)c3cnn(-c4ccccc4)c3)cn2)CC1	733337721	RZLGJSWRWOOUAB-UHFFFAOYSA-N	434.504	1.163	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1	734242178	WLTVIAZJERZBFR-UHFFFAOYSA-N	436.469	1.664	50	20	IDGD	
O=C(NNc1ncnc2[nH]cnc12)c1cc(S(=O)(=O)N2CCCCC2)ccc1Cl	740746824	PPBFMROURZUHHH-UHFFFAOYSA-N	435.897	1.938	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)[C@H]1CCCN(C(=O)COc2ccccc2)C1	741213134	ASBBAFJFZMSOEV-INIZCTEOSA-N	427.457	1.236	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H](Cn2cccn2)c2ccccc2)c1	741425363	JRPFNOQFGHJKAG-SFHVURJKSA-N	427.486	1.672	50	20	IDGD	
Cc1noc(-c2ccccc2C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)n1	742033338	LTRBATYZXRHVBI-UHFFFAOYSA-N	429.458	1.370	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)C(=O)NCc2ccc(F)cc2)c2ccccc2c1=O	742033810	CDCXUSVBOGWWSE-UHFFFAOYSA-N	425.420	1.194	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CSc2nnc(COc3ccc(F)cc3)n2N)c1	742452371	OEXMKKXPDHKYKS-UHFFFAOYSA-N	430.465	1.572	50	20	IDGD	
CN(C[C@H]1CCN(Cc2ccccc2)C1)C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	743510587	YXWJVTXRLMGEKZ-GOSISDBHSA-N	434.504	1.471	50	20	IDGD	
CCNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cc(Br)ccc2O)cc1	743730474	ZJMKYTSLBPHZKY-UHFFFAOYSA-N	442.291	1.528	50	20	IDGD	
Cc1ccc2c(c1)C(=O)N(CC(=O)NNC(=O)c1cc(Br)ccc1O)C2=O	743733054	AEXIXRCVOGUBSS-UHFFFAOYSA-N	432.230	1.520	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CN2CCCN(C(=O)c3ccc(Cl)cc3)CC2)c1	744390960	MFEFXDCOYRYBIR-UHFFFAOYSA-N	439.903	1.821	50	20	IDGD	
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCC(=O)NNC(=O)c1cccc(C)c1	744472172	LWQSKGKWQPBFHL-FQEVSTJZSA-N	436.468	1.528	50	20	IDGD	
COc1cc(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)cc2c1OCCO2	744620162	GFIMEYUCSVCGRK-UHFFFAOYSA-N	449.485	1.244	50	20	IDGD	
C[C@@H]1Oc2ccccc2O[C@@H]1C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	744620378	CITMHDRZUDNWQO-LIRRHRJNSA-N	433.486	1.379	50	20	IDGD	
O=C(C[C@@H]1OC(=O)c2ccccc21)NNc1ccccc1S(=O)(=O)N1CCOCC1	744621727	OSNWMTHRGROUGQ-KRWDZBQOSA-N	431.470	1.452	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)cc1	744742529	NVLQRVZVJPAGSV-UHFFFAOYSA-N	434.368	1.270	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)c2cc(Br)cnc2Cl)c1	744910852	SYVJWZDVWVWKDU-UHFFFAOYSA-N	437.637	1.987	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)[C@@H](O)c2ccc(Br)cc2)c1	745043613	FFDCUAMHKGPWOJ-INIZCTEOSA-N	432.230	1.359	50	20	IDGD	
O=C(CNC(=O)[C@H]1c2ccccc2C(=O)N1Cc1ccccc1)NNC(=O)NC1CCCC1	745866519	CUSOVYHUONWIMQ-OAQYLSRUSA-N	449.511	1.773	50	20	IDGD	
CCCCN1C(=O)CC[C@@H](C(=O)NNC(=O)N2CCOCC2)[C@H]1c1ccc(OC)cc1	745988317	XMWRSMOMEVOXEF-UYAOXDASSA-N	432.521	1.848	50	20	IDGD	
CC(C)c1nc(C#N)c(NNC(=O)[C@H]2CCCN2C(=O)/C=C\c2ccc(C(N)=O)cc2)o1	746526321	ZSBOLNZUKMKLPL-CGQZWFTASA-N	436.472	1.916	50	20	IDGD	
COc1cc(C)nc(NNC(=O)c2cc(C3CC3)nc3c2c(O)nc(=O)n3CC(C)C)n1	746631264	VZOMSORHVONOGK-UHFFFAOYSA-N	439.476	1.894	50	20	IDGD	
Cc1ccc(S(=O)(=O)n2ccc(C(=O)NNC(=O)Cc3cn4ccccc4n3)c2)cc1	746642198	WKLVMZJJKWGGTH-UHFFFAOYSA-N	437.481	1.685	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)[C@@H](C)Oc1cccc(C=O)c1	746758115	WZZFJQYKGVCEGY-GFCCVEGCSA-N	434.832	1.933	50	20	IDGD	
CC[C@@](C)(CNC(=O)OC(C)(C)C)C(=O)NNC(=O)c1csc(N2CCOCC2)n1	747727716	OLTWYBASQVDEIX-IBGZPJMESA-N	441.554	1.682	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc2c(c1)COC2)NNc1cccc(Br)c1	748018302	OMKPLJCFEAEVSB-UHFFFAOYSA-N	426.292	1.901	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)c1cc(S(=O)(=O)N2CCC2)ccc1Cl	748689693	SNQLASNAWODSLT-UHFFFAOYSA-N	441.868	1.714	50	20	IDGD	
O=C(NNS(=O)(=O)c1cnn(C2CCOCC2)c1)c1cccc(Br)c1	749770359	AGTRRZPCWZCRLB-UHFFFAOYSA-N	429.296	1.620	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2cccc(C(=O)NNC(=O)CCc3ccccc3)c2)C[C@@H](C)O1	749803637	GSBQJVXJRWDHQG-CALCHBBNSA-N	445.541	1.878	50	20	IDGD	
COc1ccc(C(=O)CNC(=O)CCC(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1	751303348	AZRFRRQHWCPRRC-UHFFFAOYSA-N	441.440	1.007	50	20	IDGD	
CCn1c(NNC(=O)c2cc([N+](=O)[O-])ccc2N2CCOCC2)nc2ccccc2c1=O	751883558	HBWZEHSVVCDGDT-UHFFFAOYSA-N	438.444	1.918	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)[C@@H]2CC(=O)N(c3cc(OC)cc(OC)c3)C2)c1	752266661	PJJIAGVHDNIWQM-CQSZACIVSA-N	443.456	1.535	50	20	IDGD	
CCCCCCOc1ccc(C(=O)NNC(=O)NC[C@@H]2CCN(S(C)(=O)=O)C2)cc1	753671777	UIDSDWKXAWFWAT-INIZCTEOSA-N	440.566	1.871	50	20	IDGD	
COc1cc(OC)c2cc(CCCNC(=O)NNC(=O)Cn3nc(C)cc3C)[nH]c2c1	753947432	QZYBBRYRATYVLL-UHFFFAOYSA-N	428.493	1.962	50	20	IDGD	
O=C(NCCS(=O)(=O)NC[C@H]1CCCCO1)NNc1cc(C(F)(F)F)ccc1F	754644091	HZTVUBZWUSYXKY-GFCCVEGCSA-N	442.435	1.959	50	20	IDGD	
CCc1nnc(O)c(CNC(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)c1CC	754655361	QLPKMNWFZLYINM-UHFFFAOYSA-N	433.465	1.477	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)Nc1ccc(-n2nccc2C(F)(F)F)cc1	756184385	CRUSRPIYIKJSAS-SNVBAGLBSA-N	431.396	1.479	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)Nc1cc(S(=O)(=O)C(F)(F)F)ccc1OC	756298505	ZCBDHDIWDGMGOS-VIFPVBQESA-N	443.400	1.193	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1C	756517143	WBEGSHPROUDVII-QGZVFWFLSA-N	434.474	1.749	50	20	IDGD	
Cc1c(NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cccc1N1CCOC1=O	756818107	MPTAYQCJYRDWTI-UHFFFAOYSA-N	436.428	1.665	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)Nc2cc(C(N)=O)ccc2CN(C)C)o1	756826240	DQHWNAKWAXEXIH-UHFFFAOYSA-N	430.509	1.748	50	20	IDGD	
Cc1c(C(=O)N2CCN(S(=O)(=O)CBr)CC2)nnn1-c1ccccc1	758536339	UFCLCBLGEKIXDT-UHFFFAOYSA-N	428.312	1.016	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccnn2Cc2ccc(F)cc2)cc1	760280592	VGQZEOXLLVAOKH-UHFFFAOYSA-N	436.403	1.107	50	20	IDGD	
CC1(Cn2cc(C(=O)NNc3ccc(S(=O)(=O)Nc4nccs4)cc3)nn2)COC1	760352281	JYQKDQLKQKNJSW-UHFFFAOYSA-N	449.518	1.329	50	20	IDGD	
CC(C)(C)NC(=O)c1ccccc1NC(=O)C(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	763445427	HKUVCGSHILTUCW-UHFFFAOYSA-N	427.417	1.523	50	20	IDGD	
CC(C)(C)c1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(-n3cccn3)nc2)cc1	763596339	WUVQPPQHBDLXGF-UHFFFAOYSA-N	436.472	1.730	50	20	IDGD	
CC[C@@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2F)cc1	763680759	VYJBABGJARFJBM-CYBMUJFWSA-N	430.436	1.519	50	20	IDGD	
CC(C)S(=O)(=O)c1ccccc1NC(=O)C(=O)NNC(=O)COc1ccccc1F	763681543	VJQHPZHWZIHEBF-UHFFFAOYSA-N	437.449	1.173	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(F)cc2Br)cc1	763681559	LKBTWZHDMAOCBV-UHFFFAOYSA-N	435.209	1.625	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(C(=O)NC(C)C)cc1	763712522	IZYIFLKEYIUHQI-UHFFFAOYSA-N	426.473	1.552	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(OCC(F)(F)F)nc2)c1	763754032	KMRXDAKJXKNPBZ-UHFFFAOYSA-N	425.367	1.488	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)c1nc(-c2cccs2)n(-c2ccccc2)n1	763818963	SBIZUQBWJPTDMF-UHFFFAOYSA-N	447.480	1.582	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccccc2S(=O)(=O)C(F)F)cc1	763821498	RDPDBDYGCIWBKS-UHFFFAOYSA-N	441.412	1.156	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)C[C@H](OC)C3)cc1	763859793	FWQUFAMEQQSDGF-VBKZILBWSA-N	441.484	1.752	50	20	IDGD	
CC[C@@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)cc1	763864249	HKCMXGWNOKZINP-KGLIPLIRSA-N	444.463	1.907	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@@H](C)C(=O)NNC(=O)C(=O)Nc1c2c(nn1C)CCC2	763883409	MXEQXSPXJIGXIR-LBPRGKRZSA-N	433.896	1.732	50	20	IDGD	
Cc1cc(C(=O)NC2CCCCC2)ccc1NC(=O)C(=O)NNC(=O)c1cccn1C	763993461	QQCVGRMLZMTSOX-UHFFFAOYSA-N	425.489	1.796	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)C(=O)Nc1cccnc1N1CCCCC1	763994772	GEOYVNDSJKTALZ-UHFFFAOYSA-N	435.282	1.562	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)C(=O)Nc1ccc(F)cc1-c1ccc(F)cc1	763999436	WSMOKSJLDTWTNY-LBPRGKRZSA-N	437.424	1.152	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)on1)C(=O)Nc1ccnn1Cc1ccccc1	764017456	YERYKVHOKGDASA-UHFFFAOYSA-N	430.424	1.986	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc2c(c1)CCN2C(=O)C(=O)NNC(=O)CCC(C)C	764203419	RWXQMFOROFVUES-UHFFFAOYSA-N	438.550	1.190	50	20	IDGD	
C[C@@H]1COCCN1c1ccc(NC(=O)C(=O)NNC(=O)c2cccc(OC(F)F)c2)cc1	764260382	WYVTVOPUVDPNEP-CYBMUJFWSA-N	448.426	1.913	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@H]2C)ccc1NC(=O)C(=O)NNC(=O)Cc1ccncc1	764352706	BSMAWZDAXAXLIG-MRXNPFEDSA-N	437.500	1.733	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2cccs2)[nH]n1)C(=O)Nc1ccc(NC(=O)C2CC2)nc1	764381959	DOHFGUZYWBOGKU-UHFFFAOYSA-N	439.457	1.281	50	20	IDGD	
COc1nccnc1NNC(=O)[C@H](Cc1c[nH]c2ccc(Br)cc12)NC(C)=O	764469654	GCTHIEKDKMENDP-HNNXBMFYSA-N	447.293	1.920	50	20	IDGD	
CS(=O)(=O)Cc1nc2ccccc2n1CC(=O)NNC(=O)CSc1ccccc1O	765248811	VDHREQNBGLHRLD-UHFFFAOYSA-N	448.526	1.226	50	20	IDGD	
O=C(CCc1cncc2ccccc12)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765337237	PIUUGCWYDRXCDR-UHFFFAOYSA-N	445.523	1.773	50	20	IDGD	
COC(=O)[C@H]1CCCCN1C(=O)c1cccc(NC(=O)C(=O)NNC(=O)OC(C)(C)C)c1	765399268	RYAJYUXNWKGZLB-OAHLLOKOSA-N	448.476	1.349	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)N1CCN(c2ccc(NS(C)(=O)=O)cc2)CC1	767216694	MFQBSTBLBIPZIO-UHFFFAOYSA-N	447.517	1.243	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)C(=O)Nc2cnc(Cl)c(Br)c2)c1	768231763	PUHIPJLJAPBQRK-UHFFFAOYSA-N	447.698	1.983	50	20	IDGD	
C[C@@]1(c2cccc(C(=O)NNC(=O)c3cccc(Br)c3)c2)NC(=O)NC1=O	769147921	UBTHGZSUDOQAEF-SFHVURJKSA-N	431.246	1.579	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)Nc1ccccc1CN1C(=O)CCC1=O	769233008	JHFSGDMJIWCJAE-UHFFFAOYSA-N	446.485	1.896	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)Nc2cc(S(=O)(=O)N(C)C)ccc2N2CCOCC2)n1	770077495	MNROYTUXSOEFNR-UHFFFAOYSA-N	449.537	1.329	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2cccc3c2OCCCO3)c1	770435432	SXOQAYFDKGEDDR-UHFFFAOYSA-N	448.501	1.242	50	20	IDGD	
CCNS(=O)(=O)[C@H]1CCN(C(=O)NNC(=O)c2ccc(COc3ccccc3)o2)C1	770753126	CWPGSGULJBDZQY-INIZCTEOSA-N	436.490	1.227	50	20	IDGD	
COC(=O)c1nc(Cl)ccc1S(=O)(=O)NNC(=O)[C@@H](C)Oc1cccc(Cl)c1	773253387	ZVXMOVGQXTXYRU-SECBINFHSA-N	448.284	1.952	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NNC(=O)c2ccccc2SCC(N)=O)C1	773413135	GOCDWQACEWEDAV-CYBMUJFWSA-N	436.534	1.672	50	20	IDGD	
COCCn1nc(C)c(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)c1C	774006182	BVVBESKLGWTYEQ-ZDUSSCGKSA-N	437.884	1.353	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1cccc(-c2nnco2)c1	774008941	MUMCVCFBDOPOFS-LLVKDONJSA-N	429.820	1.943	50	20	IDGD	
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	775687616	CKVUFZTVSPFXGO-OXQOHEQNSA-N	425.489	1.856	50	20	IDGD	
O=C(CCc1nc(-c2cccs2)no1)N1CCN(S(=O)(=O)CBr)CC1	777780104	VCYBUHPQTSHKGS-UHFFFAOYSA-N	449.352	1.557	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1cc(C(=O)NNC(=O)CNC(=O)OC(C)(C)C)ccc1F	778440807	FKSLIRCVWMOBGX-UHFFFAOYSA-N	446.501	1.188	50	20	IDGD	
CC(C)(C)C(=O)NNC(=O)c1cc(I)ccc1N1CCOCC1	778501789	SJSGHJUONYUMNN-UHFFFAOYSA-N	431.274	1.935	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)[C@H]2CC(=O)N(c3ccc(F)c(C)c3)C2)c1	780183765	VVPPSXBFDIUYFE-INIZCTEOSA-N	427.432	1.800	50	20	IDGD	
O=C(NN=C1CCC(N2C(=O)c3ccccc3C2=O)CC1)c1ccc(-n2cnnn2)cc1	780197396	VDMUOQYYBDJBHM-UHFFFAOYSA-N	429.440	1.987	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(S(=O)(=O)C(F)(F)F)cc1)NC1CCCCC1	780364655	FUVCNHYHNMHKHB-UHFFFAOYSA-N	429.442	1.805	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)C2CCN(C3=NS(=O)(=O)c4ccccc43)CC2)c1	780796143	LPLQCFWFWAQGGB-UHFFFAOYSA-N	442.497	1.777	50	20	IDGD	
Cn1c(=O)nc(O)c2c(C(=O)NN=c3cc[nH]cc3)cc(-c3ccc4c(c3)OCO4)nc21	781021155	LQTXYMUUDBUNJG-UHFFFAOYSA-N	432.396	1.004	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNc2ccccc2F)ccc1S(=O)(=O)N1CCCC1	782702359	DORHDYDALHDPQA-UHFFFAOYSA-N	436.465	1.701	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1nc(-c2ccccc2F)cs1	784003950	APQBPCVHOYODKX-UHFFFAOYSA-N	447.473	1.527	50	20	IDGD	
O=C(NNc1ccc(Br)cn1)C(=O)Nc1ccccc1S(=O)(=O)C(F)F	784341980	VMKQAVJQQLTPJU-UHFFFAOYSA-N	449.233	1.922	50	20	IDGD	
COc1ccc(NC(=O)c2cccc(NC(=O)C(=O)NNc3ncc(F)cn3)c2)cn1	784949107	FYYPXHRVPGDXNL-UHFFFAOYSA-N	425.380	1.353	50	20	IDGD	
C[C@H](NC(=O)c1ccc(Br)s1)C(=O)NNc1ccccc1S(N)(=O)=O	788230508	OLBKZCLXBIJHRI-QMMMGPOBSA-N	447.336	1.420	50	20	IDGD	
Cn1nc(-c2ccc(F)cc2F)cc1NC(=O)C(=O)NNC(=O)COc1ccccc1O	789734504	JJSXLNNQATWAGM-UHFFFAOYSA-N	445.382	1.236	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2cccc(N3CCC3=O)c2)c1	790578220	BHAYRWPARQIMOL-UHFFFAOYSA-N	431.474	1.140	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NC[C@H]2CCN(Cc3ccccc3)C2)cc1	792228937	GMBIZFWOSIIORW-QGZVFWFLSA-N	445.545	1.948	50	20	IDGD	
CN1CCN(CC(=O)N(C)c2ccc(NC(=O)NNc3nc4ccccn4n3)cc2)CC1	792294588	ISTUIXZCUONABZ-UHFFFAOYSA-N	437.508	1.088	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)CNC(=O)c1cccs1)c1ccc(Br)cn1	792882421	LVLZKEFGWKMAQF-SECBINFHSA-N	426.296	1.727	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)C(=O)Nc2cccc(F)n2)c2ccccc2c1=O	793021839	LTAHNWSSJHFMPM-UHFFFAOYSA-N	426.408	1.130	50	20	IDGD	
CCOC(=O)c1ccn(-c2ccccc2NC(=O)C(=O)NNC(=O)c2cccc(C)n2)n1	797370585	GXQOSZRZOAUKQL-UHFFFAOYSA-N	436.428	1.152	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(OCC(F)(F)C(F)F)nc2)n1	797371108	YMLMUCOUJOZQAT-UHFFFAOYSA-N	429.330	1.464	50	20	IDGD	
C[S@](=O)C1(CNC(=O)NNC(=O)COc2ccc(OCc3ccccc3)cc2)CC1	799715276	CJLLTHLPXDOQNQ-PMERELPUSA-N	431.514	1.886	50	20	IDGD	
C[C@@]1(CCCC(=O)OCC(=O)NN=C(c2ccccc2)c2ccccc2)NC(=O)NC1=O	801434193	YULDZVCKGYGWSU-QHCPKHFHSA-N	436.468	1.867	50	20	IDGD	
C[C@H](CCNS(=O)(=O)c1ccccc1)NC(=O)NNC(=O)c1cccc(N(C)C)c1	801797945	QIRMWFRZKJYWQF-OAHLLOKOSA-N	433.534	1.454	50	20	IDGD	
O=C(Cn1cnc2scc(-c3cccs3)c2c1=O)NNC(=O)N=c1cc[nH]cc1	802033380	VVESCKNSBLSXQJ-UHFFFAOYSA-N	426.483	1.856	50	20	IDGD	
C[C@@H](CCNS(=O)(=O)c1ccccc1)NC(=O)NNc1cccc(S(C)(=O)=O)c1	802527706	KJVMNVYIQLKVSE-AWEZNQCLSA-N	440.547	1.473	50	20	IDGD	
COC(=O)c1c(F)cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)cc1F	802566143	BHJCXVMYPFCEDB-GFCCVEGCSA-N	449.410	1.922	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3cc(C#N)ccc3Cl)cc2)CC1	802827486	BGTBDRUKBSYWKS-UHFFFAOYSA-N	433.921	1.905	50	20	IDGD	
Cc1cc([N+](=O)[O-])ccc1NNC(=O)c1ccc(F)c(S(=O)(=O)N2CCOCC2)c1	805376906	MTCNWOPQBFHOIL-UHFFFAOYSA-N	438.437	1.820	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)N2CC[C@@H](N3CCN(C(=O)OC(C)(C)C)CC3)C2)n1	805405016	BRWNWTKDQBIQBY-MRXNPFEDSA-N	432.525	1.371	50	20	IDGD	
CC(C)Oc1ncccc1C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	807092792	WPWZQOGYOOBQKV-UHFFFAOYSA-N	425.489	1.088	50	20	IDGD	
COc1cccc2c(C(=O)NNc3ccccc3S(=O)(=O)N3CCOCC3)n[nH]c12	809704284	YFJVESBJOJWSTE-UHFFFAOYSA-N	431.474	1.349	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)c2ccc(S(=O)(=O)NC(C)(C)C)o2)cc1	812729398	OEYFLGROGDWNDJ-UHFFFAOYSA-N	444.535	1.364	50	20	IDGD	
Cn1cc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)NC(C)(C)C)c(C2CC2)n1	812978379	NLEWWYWDDRXFPT-UHFFFAOYSA-N	434.522	1.456	50	20	IDGD	
C[C@H](NC(=O)NNc1nc(O)c2cnn(C)c2n1)c1ccc(N2CCCNC2=O)cc1	813241600	IINJAYTUOGAGOH-NSHDSACASA-N	425.453	1.376	50	20	IDGD	
CCCS(=O)(=O)Nc1cccc(NC(=O)NNC(=O)[C@H]2CCc3nncn3C2)c1C	814633148	AXFOKCSEUFDCIP-ZDUSSCGKSA-N	435.510	1.154	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(N(C(C)=O)[C@@H]3C[C@@H]3C)cc2)c1O	815568635	OYFLCUWRQQRATM-YVEFUNNKSA-N	440.456	1.562	50	20	IDGD	
Cc1ccc(-n2cc(C(=O)NNC(=O)[C@H]3CCCN(C(=O)OC(C)(C)C)C3)nn2)cc1	816510978	LDFDOZGAIALLDB-HNNXBMFYSA-N	428.493	1.984	50	20	IDGD	
CCN1CCN(CC(=O)NNc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C(=O)C1=O	817015191	QARCEIPGJHOUNZ-UHFFFAOYSA-N	426.317	1.858	50	20	IDGD	
CCCCn1c(CCC(=O)NNC(=O)CC2CC2)nc2cc(S(=O)(=O)N(C)C)ccc21	819122462	BUSRSPNPZOQZOD-UHFFFAOYSA-N	449.577	1.967	50	20	IDGD	
CCOc1ccc(C(=O)NN=Cc2c(Cl)nc(N)nc2N2CCOCC2)cc1OC	874084371	CHQAAEWFVHOQGF-UHFFFAOYSA-N	434.884	1.720	50	20	IDGD	
COc1cc(S(=O)(=O)N2CCOCC2)cc(C(=O)NNc2ccc(C)cc2)c1OC	912596218	DIOIFPFTPFWDRL-UHFFFAOYSA-N	435.502	1.790	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2cccc(I)c2)C[C@H](C)O1	912920813	DPRMBHURCLIMCP-RYUDHWBXSA-N	431.274	1.552	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)[C@@H](C)NS(=O)(=O)c2ccc(Cl)cc2)cc1C	913450283	RTBLOASJQHMXLI-CQSZACIVSA-N	439.921	1.850	50	20	IDGD	
CNS(=O)(=O)c1cccc(C(=O)NNC(=O)COc2ccc(Br)cc2)c1	913457519	JCOFZILYMUTDSX-UHFFFAOYSA-N	442.291	1.197	50	20	IDGD	
COc1ccccc1C(=O)NCC(=O)NNC(=O)COc1ccc(Br)cc1	913457811	NUGKZSOMPSLMAK-UHFFFAOYSA-N	436.262	1.414	50	20	IDGD	
C=CCNS(=O)(=O)c1cc(C(=O)NNC(=O)c2ccc3c(c2)OCCO3)ccc1F	914468999	VPNHOBIOPHHNSI-UHFFFAOYSA-N	435.433	1.136	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)o2)cc1C	914881332	BXWKVJMWVQOHMV-UHFFFAOYSA-N	434.474	1.081	50	20	IDGD	
CS(=O)(=O)N1CCC[C@@H]1C(=O)NNC(=O)c1cc(-c2ccco2)nc2ccccc12	915188429	MWAUETYLQRQJSR-QGZVFWFLSA-N	428.470	1.680	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)[C@H]1CCCN(C(=O)N2CCCC2)C1	916132678	HWXVOAQMHGWGKC-INIZCTEOSA-N	426.521	1.674	50	20	IDGD	
CC(=NNC(=O)[C@@H](C)CN1CCOCC1)c1ccc(S(=O)(=O)NCc2ccco2)cc1	916363778	YNSCXMVRLLZOGR-INIZCTEOSA-N	448.545	1.567	50	20	IDGD	
COc1cc(C=NNC(=O)[C@H](C)CN2CCOCC2)ccc1OC(=O)c1cccnc1	916364566	PJVAGJJKVKHHAD-MRXNPFEDSA-N	426.473	1.728	50	20	IDGD	
CCCNC(=O)c1cccc(CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)c1	916478858	XLWAZALDDKPJEG-UHFFFAOYSA-N	446.533	1.264	50	20	IDGD	
CC(=O)NCCCNC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	916521482	DRJNCSBYHOWFMP-UHFFFAOYSA-N	439.519	1.019	50	20	IDGD	
O=C(NCCCS(=O)(=O)Cc1ccccc1)NNC(=O)[C@H]1COc2ccccc2O1	916576960	HFFBHGXSOYQDGU-GOSISDBHSA-N	433.486	1.162	50	20	IDGD	
COc1cc(CNC(=O)NNC(=O)COc2cc(C)ccc2C)ccc1OCC(N)=O	916640465	FESUNFHSJQJENN-UHFFFAOYSA-N	430.461	1.086	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)[C@H]2CC(=O)N(c3ccc(Cl)cc3)C2)nc2ccccc21	916736320	IPNZMUNKPTVIJD-ZDUSSCGKSA-N	425.876	1.970	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(N2C[C@H](C(=O)NNC(=O)C(C)(C)C)CC2=O)cc1	917180330	RYJOMORXJJLAFS-CQSZACIVSA-N	438.550	1.264	50	20	IDGD	
Cn1cc(S(=O)(=O)N2CCCCC2)cc1C(=O)NNC(=O)c1ccc(Cl)nc1	917252649	SXEAZCZPMQELDB-UHFFFAOYSA-N	425.898	1.323	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@H](C)C(=O)NNC(=O)CN(C)c1ncnc2[nH]cnc12	917920708	BHFYAKQWRHZMBO-GFCCVEGCSA-N	431.884	1.674	50	20	IDGD	
Cc1nccc(CNC(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)n1	918106821	PKDJPMLZMADBAT-UHFFFAOYSA-N	443.467	1.687	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)[C@@H](Cc2cccc(F)c2)n2nnnc2C)cc1	920012546	UIACZLQYVJEUOL-LJQANCHMSA-N	426.452	1.693	50	20	IDGD	
O=C(CCn1ccnc1)Nc1cccc(C(=O)NNC(=O)c2nnc(O)c3ccccc23)c1	920092693	FVOUTNAPNHOEPG-UHFFFAOYSA-N	445.439	1.636	50	20	IDGD	
O=C(CCNS(=O)(=O)c1cccc([N+](=O)[O-])c1)NNC(=O)Cc1ccc(Cl)cc1	920340929	YNFSWHUBIHLWFN-UHFFFAOYSA-N	440.865	1.307	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)Nc2ccc(CN3C(=O)CNC3=O)cc2)cc1C	920930191	BBIZJDIQJBJRKN-UHFFFAOYSA-N	425.445	1.587	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NC[C@H](c2cccc(F)c2)N2CCOCC2)cc1OC	921199366	IQVRDQIBPCFLEA-GOSISDBHSA-N	446.479	1.860	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)N2CCN([C@@H]3CCS(=O)(=O)C3)CC2)c(C)n1CC(C)C	921246064	YIQKTPCHKCJXJH-FVIRYLMMSA-N	432.590	1.999	50	20	IDGD	
O=C(NC[C@@H](c1cccc(F)c1)N1CCOCC1)NNc1ccc(-n2cccn2)nn1	921248008	PHRFMJFGCZBGNL-KRWDZBQOSA-N	426.456	1.501	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@@H]2CC(=O)N(c3cc(OC)c(OC)c(OC)c3)C2)cc1	1115834384	YRPKJQDJPNHZME-CQSZACIVSA-N	443.456	1.535	50	20	IDGD	
O=C(NNC(=O)c1n[nH]c2c1CCCC2)c1cccc(NN2C(=O)[C@@H]3CC=CC[C@H]3C2=O)c1	1116877264	LJBNNOZJNIGPHH-HZPDHXFCSA-N	448.483	1.641	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2cccc3ncccc23)cc1	1323935048	WDVPIWSSMYUKTC-UHFFFAOYSA-N	428.470	1.373	50	20	IDGD	
O=C(c1cc(Cl)nc2ccccc12)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1777803899	CEDZMNVIYQBXAP-OXJNMPFZSA-N	438.311	1.931	50	20	IDGD	
COCCOCCOCCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Cl)C1	1778028483	LFHHUEQTBSCMAR-HHXXYDBFSA-N	438.924	1.104	50	20	IDGD	
C=C(Oc1ccccc1O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2	1778083053	CMJQXBPWQUUKKF-YRISNDGFSA-N	438.908	1.398	50	20	IDGD	
CC(=O)N(C)[C@@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)CBr)C2	1778099827	PKNYEYVGALCJLC-QRCPMIHRSA-N	446.386	1.398	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@]2(CN(C(=O)/C=C3\C(=O)Nc4ccccc43)CCO2)C1	1779296837	HMAUPPLYABOVGC-TWMGVTGTSA-N	443.576	1.704	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)Cn2cncn2)C1	1779494977	HFOVNVDTNQJJIC-MIALQEHNSA-N	425.961	1.836	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(C(C)(C)C)n[nH]3)C2)C1	1779574446	FLTQTBYADXFTGU-KPZWWZAWSA-N	427.343	1.934	50	20	IDGD	
O=C(c1ccc([N+](=O)[O-])c2c1OCO2)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Cl)CCO2	1780235074	NFLRPMPXMLIWAL-RHSMWYFYSA-N	429.788	1.301	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3nccc(Cl)c3OC)C2)C1	1780328444	NNAQFLZCPVEKLV-UGSOOPFHSA-N	432.304	1.441	50	20	IDGD	
C=CC(=O)N[C@@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@](C)(Cl)CCl)C1	1780712743	WYMXZPHNEPCQBO-QABNGEJJSA-N	434.364	1.427	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)CC(F)(F)C(=O)O)C2)[C@H](F)Br	1780773726	UJCAUDYHGHKXLL-OLUVUFQESA-N	445.232	1.301	50	20	IDGD	
O=C(CCCc1ccncc1)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781327130	XIHHSSMLYZRUMM-AEFFLSMTSA-N	428.302	1.925	50	20	IDGD	
O=C(c1cccc(N2CCOCC2)c1)N1CC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1781737360	OEWAYZBQQWJPAX-HXUWFJFHSA-N	442.343	1.770	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cncc(O)c2)C1	1782038873	JNXRZYJEPMEDKB-URKNILKWSA-N	440.338	1.946	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCC(=O)N1CCCC1)C2)C(Cl)Cl	1782214273	AIQMOCMEZVUVJH-AUUYWEPGSA-N	434.364	1.707	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(CCN(C(=O)c3nc4ccc(F)cn4n3)C2)C1	1782567977	STPVPAAQAKRNBG-IBGZPJMESA-N	435.532	1.163	50	20	IDGD	
N#C/C(=C\c1ccc(Br)cc1)C(=O)N1CC[C@@]2(CN(C(=O)CN)CCO2)C1	1782870106	MHNLAUURMBRQDS-RNYZQXAPSA-N	433.306	1.145	50	20	IDGD	
Cc1cc(F)ccc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)C2	1783071074	DCWNJPMGMQWFKO-AUSIDOKSSA-N	448.539	1.635	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cccc(OC)n3)CCO2)C1	1783344814	UIEZVCFLPWIDJL-UGSOOPFHSA-N	426.311	1.707	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(N(C)C)nc3)CCO2)C1	1783352068	MSNGHILHAMXJBO-HNAYVOBHSA-N	439.354	1.765	50	20	IDGD	
CCc1[nH]nc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](C)Br)C3)C2)c1Cl	1783532668	MICWNGGOCZJYBE-HWPZZCPQSA-N	433.734	1.852	50	20	IDGD	
COc1cc(F)ccc1CC(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](C)Br)C2)C1	1783536739	GZBQPPPQZKEQJP-YJYMSZOUSA-N	443.313	1.990	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)Cc3ccc4c(c3)CCO4)CCO2)C1	1783540140	SFPZQDCSGGDDCJ-XOBRGWDASA-N	437.334	1.777	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccncc3C(F)(F)F)CCO2)C1	1783874541	IOICBYIRCDUNAM-RHSMWYFYSA-N	435.830	1.798	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cn(C)cc3C(F)(F)F)CCO2)C1	1783874999	NHACKHQVWUVNOJ-YOEHRIQHSA-N	437.846	1.741	50	20	IDGD	
O=C(c1ccc(N2CCOCC2)cc1)N1CCO[C@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783945941	UEUWRHODNXAYJG-FQEVSTJZSA-N	442.343	1.770	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)C3(O)CCC3)C[C@@H]21	1783963877	BMOOTZZINSTYKX-QXKUPLGCSA-N	431.371	1.548	50	20	IDGD	
Cc1nccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]3C2)n1	1783965833	VIWFUAUWPGOOPE-PCBIJLKTSA-N	425.327	1.409	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(Cl)cc(Cl)n3)C[C@@H]21)[C@@H](O)CCl	1784090961	FUZPAALJNIFJIW-RETIQXCHSA-N	436.723	1.581	50	20	IDGD	
O=C(CCCc1cccnc1)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1784674547	RMMBMGSPWBGEDX-AEFFLSMTSA-N	428.302	1.925	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)c3cc(F)cc(Cl)c3)C2)C1	1785071943	GIYGVLRTIVWEEV-HXUWFJFHSA-N	440.903	1.296	50	20	IDGD	
COCCn1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)C(C)(C)CCl)C[C@@H]32)n1	1787635837	XTBFFHYXLRRYJP-ZOBUZTSGSA-N	426.945	1.388	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc4ncccn4n3)[C@H]2C1	1788304755	ONIGWARUUHHYTP-ABHRYQDASA-N	436.310	1.106	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccnc(Cl)n3)[C@H]2C1	1788876104	NGEUYJWUGUUWDJ-NDBFUVGKSA-N	435.739	1.960	50	20	IDGD	
Cn1nc(C(F)(F)F)cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Cl)C[C@@H]21	1788961107	KLQLZGZJJHXCIC-LKAMGYQZSA-N	426.798	1.567	50	20	IDGD	
C[C@H](C(=O)NC1(c2ccc(NC(=O)c3cnccc3C(=O)NN)cc2)CCC1)n1ccnc1	1789519756	IVKQRQFACPGINR-OAHLLOKOSA-N	447.499	1.891	50	20	IDGD	
CC(=O)OC[C@H](OC(C)=O)C(=O)Nc1ccc(C2(NC(=O)[C@H](O)CCl)CCC2)cc1	1789542232	GZZZIQJNRUPEHJ-SJORKVTESA-N	440.880	1.215	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccn(C(F)F)c3=O)C[C@@H]21	1789863261	HVQBXVMWTUZIGV-MHEUCROKSA-N	431.867	1.854	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nnc(-c4ccccc4)o3)C[C@@H]21	1791255399	QNCXIRLBHKOJTR-QAETUUGQSA-N	448.907	1.584	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CS[C@@H]3CCCCO3)C[C@@H]21	1791255404	QNZCVEGTTFBVRZ-IQWQSGHPSA-N	434.986	1.480	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(Cl)c3)C[C@@H]21	1791290901	RRLJDSLCVHLEQF-SZMVWBNQSA-N	436.940	1.306	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCNC(=O)c3ccccc3)[C@H]2C1	1792119758	YYUAVJNUABEGGB-OKYOBFRVSA-N	435.952	1.804	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H]1CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2	1793649715	IRKQKCHMVHKEMH-SSRUIJIPSA-N	447.935	1.900	50	20	IDGD	
COc1ccc(OC)c(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Cl)c1	1796362477	CABULCNFBJPPCP-FTUNRGFVSA-N	428.888	1.760	50	20	IDGD	
CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Cl	1796367099	XWXHSNOCQIHFEG-OJXGSEEGSA-N	428.848	1.398	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCc1ccoc1)C2	1796893181	NVUSTCNJWXUVID-XMYAHUOOSA-N	425.489	1.984	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1c(F)cccc1F	1798984187	VQJOKKWMGADCHH-VTEUUUEMSA-N	426.536	1.948	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccnc1C(=O)OC(C)C)C2	1799264858	ZIEOFBHNJCTAMN-FSDCSDTHSA-N	437.924	1.867	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(C(N)=O)cc1)C2	1799278527	MBMOFSDHTVJMGJ-NXEZDXNNSA-N	428.316	1.225	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c(c1)COC3)C2)[C@H](F)Br	1799346972	HBZILOVXACFMOJ-FZKCQIBNSA-N	427.270	1.611	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1cnc3[nH]ccc3c1)C2	1800763101	OCQPDXXDMQVXIB-PTOXDTDZSA-N	449.349	1.869	50	20	IDGD	
CCOC(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](Br)CC)C2)OCC	1801148621	FNQGYSJHFBWTLW-LOUJCGABSA-N	435.359	1.539	50	20	IDGD	
COc1ccc([C@H](O)C(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)cc1	1802800269	WMBSCPXCOPFICQ-FFGOWVMKSA-N	447.919	1.429	50	20	IDGD	
CC(C)(CCl)C(=O)NC[C@@H]1CCN(C(=O)c2cnc(O)nc2O)[C@H]1c1cccnc1	1802899517	QLKKWPSUXCIYDZ-ZFWWWQNUSA-N	433.896	1.867	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1ccccc1O	1805196379	IZQNTZYYOUGDBY-PGRDOPGGSA-N	445.284	1.100	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCC2(CCCN(C(=O)CN3CC(=O)NC3=O)C2)CC1	1806695760	DCFQJNWSKLUBCQ-KRWDZBQOSA-N	433.336	1.006	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)CSC(=N)N)[C@H]1c1cccnc1	1807008314	JGKNSBZCODFXFZ-KCQAQPDRSA-N	442.383	1.888	50	20	IDGD	
O=C1CC[C@@H](C(=O)N2CC[C@H](CNC(=O)[C@H](F)Br)[C@@H]2c2cccnc2)N1	1808662282	XHPZADGMAVQGGP-DHMWGJHJSA-N	427.274	1.057	50	20	IDGD	
CCNC(=S)NCC(=O)N1CCC2(CCCN(C(=O)CCBr)C2)CC1	1809070697	UGYYSUFBNVUNAL-UHFFFAOYSA-N	433.416	1.487	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)c1ccn2ccnc2c1	1809871946	RVLLPJVDKBRCDE-SCTDSRPQSA-N	427.892	1.649	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)o1	1810292114	WRTXABYLKQUJEK-RLFYNMQTSA-N	434.880	1.552	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@H]1CCN(C(=O)c2cc(CO)on2)[C@@H]1c1cccnc1	1810543500	CVDGTULWSHKNEA-DNVCBOLYSA-N	432.553	1.733	50	20	IDGD	
O=C([C@H](F)Cl)N1CCCC2(CCN(C(=O)[C@@H]3CCc4nc(O)nc(O)c4C3)CC2)C1	1810899821	VWJHNVLMJUWTJY-DOMZBBRYSA-N	440.903	1.758	50	20	IDGD	
Cc1cc(C(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@H]2c2cccnc2)n(C(F)F)n1	1811520983	NZEJHGRWSJETEL-IMJJTQAJSA-N	441.866	1.901	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2cccc(F)c2)[C@@H]1c1cccnc1	1813072844	KYLAYHKZRVAMMY-XMSQKQJNSA-N	441.507	1.913	50	20	IDGD	
C[C@H](CS(C)(=O)=O)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CO[Si](C)(C)C)n[nH]1	1819592000	SRDQRWAANSHQPF-HIFRSBDPSA-N	444.630	1.934	50	20	IDGD	
CN1CCC[C@@H](C(=O)Nc2cc([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)C1	1820727928	GSTSILRXSRULQT-NVXWUHKLSA-N	433.557	1.117	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(OC)nn3)sc2C1	1821073508	YARRSDZQPQQBBC-NXEZZACHSA-N	425.898	1.421	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccnc2C(N)=O)[nH]n1	1822367334	LQKIGPMBGUXIGD-GXTWGEPZSA-N	434.884	1.463	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(F)cn2)[nH]n1	1822413225	OYSPGTWVBKFKER-INIZCTEOSA-N	431.472	1.623	50	20	IDGD	
O=C(NCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H](O)CCl)CC1)c1cccs1	1825235079	XAEQIBQRDLDSJE-HZPDHXFCSA-N	441.981	1.697	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)C[C@](C)(O)CC(=O)O)CC2	1825647074	IMPPKNHKFJQMMI-BEPCFFQHSA-N	448.339	1.454	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(OC)nn1C)CC2	1825994063	PUPDDWJONFTQFW-NXEZZACHSA-N	427.914	1.365	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)C[C@@](C)(O)CC(=O)O)sc2C1	1826078528	UULAGXJLRYGYRW-AGRCIMAESA-N	448.339	1.454	50	20	IDGD	
CS(=O)(=O)CC(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H](F)Br)CC1	1826628901	KGJIKQXEFVNYIE-GXTWGEPZSA-N	427.336	1.341	50	20	IDGD	
Cn1cc(F)cc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827052996	RULKBBYCHOKRDO-FQEVSTJZSA-N	441.312	1.391	50	20	IDGD	
O=C(Cn1cccc([N+](=O)[O-])c1=O)N1CCC([C@H]2CCCCN2C(=O)[C@H](F)Cl)CC1	1827615185	XHCIMAVRPJGLCN-PBHICJAKSA-N	442.875	1.911	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnoc2)CC1	1827751220	KNMYSIBHPVEGGG-GOSISDBHSA-N	426.477	1.220	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)cn1C	1827865346	LVJIHOWHUVOJKT-QFIPXVFZSA-N	437.349	1.560	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H](C)N2CCN(C)CC2)CC1	1830242893	UHZDNFWJALHNQB-YZGWKJHDSA-N	443.032	1.496	50	20	IDGD	
O=C(Cc1c(F)cccc1Cl)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1	1830283929	WXAZZTQSLYQWNJ-LPHOPBHVSA-N	449.306	1.078	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccn(C(F)F)n3)C2)C1	1830365572	ZSRDDLIXAAGAFT-SFHVURJKSA-N	434.871	1.613	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC[C@H]1C1CCN(C(=O)C[C@H](NC)C(=O)O)CC1	1831548301	AMJMLDSNCCNPHF-JYJNAYRXSA-N	446.386	1.842	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(OCC)nn3)C2)C1	1831654964	PEKPCASWGUFMKN-MGPUTAFESA-N	440.928	1.353	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)CC(F)(F)C(=O)O)CC1	1831870640	BJWXNDZWIMSMMA-OAHLLOKOSA-N	446.495	1.089	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)CC[C@H]2CCOC2)CC1	1832450884	ATHJOAPLEUIPIX-PGRDOPGGSA-N	442.365	1.416	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)/C=C/c3ccco3)CCO2)C1	1833078567	JDUSIXQQOPMSLH-NYQZOWANSA-N	431.316	1.986	50	20	IDGD	
CN(C)c1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)nc1	1833644309	NMIOWCOHSHZILT-OAQYLSRUSA-N	438.956	1.483	50	20	IDGD	
Cc1ncccc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1834039999	XBDUVAWQDRMOBY-WMLDXEAASA-N	430.274	1.151	50	20	IDGD	
CCCNC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)[C@H](Cl)CC)CC2)CC1	1836394617	BCVRKXGDXATYFU-GOSISDBHSA-N	429.005	1.882	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)CCNC(=S)NC)CC2)CC1	1836397188	UBZXYWHNMZPRNI-MRXNPFEDSA-N	432.034	1.059	50	20	IDGD	
Cc1onc(C(=O)N2CCC(OC3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)c1C	1836988957	BDTSTWWGTKJOND-UHFFFAOYSA-N	449.552	1.277	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(Cl)cn3)CCO2)C1	1837899827	VOCPRGUBDHQTBC-YVEFUNNKSA-N	446.729	1.588	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(CC)n(C)n3)CCO2)C1	1838271663	RQMATTZPHNWLOY-OXQOHEQNSA-N	426.945	1.460	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc4ccccc4n3)C2)C1	1839144738	JUCKJRFSTMKKTH-VFNWGFHPSA-N	432.908	1.717	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3nnsc3C3CC3)C2)C1	1839144903	ODATUERNLNIULT-UGSOOPFHSA-N	428.942	1.503	50	20	IDGD	
Cn1cc(CCC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)cn1	1839152265	TWJJMXVRBSXQJZ-OALUTQOASA-N	447.363	1.045	50	20	IDGD	
COc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)s1	1840031499	RUPAOQYMYKUCDZ-SJKOYZFVSA-N	447.351	1.610	50	20	IDGD	
O=C(c1ccc(C(F)(F)F)[nH]1)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840189094	WDPTXRYYEXZOBM-OAHLLOKOSA-N	444.237	1.907	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)Cc1ccco1)CCO2	1840472332	BXFWXOMTXFIUAK-YZVOILCLSA-N	443.338	1.698	50	20	IDGD	
O=C([C@@H](O)c1cccc(Br)c1)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1	1841352510	SVGVBQYPLJNFRV-KBPBESRZSA-N	431.714	1.286	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H]2CC[C@@H]1[C@@H](C(=O)N1CC3(CCCN3C(=O)[C@H](O)CCl)C1)C2	1841354659	NDYZHUSLLIQMLK-CAOSSQGBSA-N	441.956	1.578	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@H]2C[C@@H]3C[C@@H]3N2C(=O)OC(C)(C)C)C1	1841360744	ICNZZSSOYAKESA-FZKCQIBNSA-N	441.956	1.842	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCCC12CN(C(=O)[C@@H]1CCCCO1)C2	1841923975	KKINCGMTALABDC-GJZGRUSLSA-N	429.945	1.891	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@H]2COCCN2C(=O)OC(C)(C)C)C1	1843347553	JUSGAJRDDHSAOA-GJZGRUSLSA-N	445.944	1.080	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](O)[C@](C)(C(=O)N2CC3(CCCN3C(=O)[C@@H](F)Cl)C2)C1	1843361701	IMAVYWZANMRNEF-IQUTYRLHSA-N	447.935	1.732	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1n[nH]c3c1CC[C@H]3C)C2	1843415930	FAQJTLHGWCEXAL-CBOPYVSYSA-N	437.504	1.410	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)c2cc(Cl)cc(Cl)n2)C1	1844567678	KLFHGSHGZHIIOH-UHFFFAOYSA-N	434.088	1.199	50	20	IDGD	
COCCOCC(=O)N1CC2(CCCN2C(=O)c2cc([N+](=O)[O-])ccc2OC(C)=O)C1	1844692455	YLOQDQKXKPJSCJ-UHFFFAOYSA-N	435.433	1.000	50	20	IDGD	
CC1(C)C=C(C(=O)N2CCCC23CN(C(=O)[C@@H](O)CCl)C3)CN1C(=O)c1ccccc1	1846263193	WGNLPSLQLRZJOS-SFHVURJKSA-N	445.947	1.651	50	20	IDGD	
COc1cc(CC(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)cc(OC)c1OC	3621296	PSUKDIYCZUMGOO-UHFFFAOYSA-N	434.445	1.742	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)CCc2c(C)nc(N3CCOCC3)[nH]c2=O)cc1	14377097	PJQMJTVLAXNFDK-UHFFFAOYSA-N	445.545	1.096	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)c1ccccc1F)C(=O)NNC(=S)NC(C)(C)C	14894999	NRGPTVGKEFJCGT-LBPRGKRZSA-N	436.600	1.520	50	20	IDGD	
Cc1c(C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)sc2nc3n(c(=O)c12)CCC3	15663377	LAUHJQIMXDLWHN-ZDUSSCGKSA-N	426.454	1.314	50	20	IDGD	
CON(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)c2cc(-c3ccccc3)n[nH]2)cc1	17519448	AHPDDFSHYWARGK-UHFFFAOYSA-N	429.458	1.333	50	20	IDGD	
O=C(CN1CCN(c2ncnc3sccc23)CC1)NNC(=O)c1ccccc1Cl	97110567	CDACYLKKRYQOFY-UHFFFAOYSA-N	430.921	1.928	50	20	IDGD	
O=C(NCCNS(=O)(=O)c1cccc([N+](=O)[O-])c1)NNc1ccc(OC(F)F)cc1	726709848	RVJSXLVZKDTXNT-UHFFFAOYSA-N	445.404	1.801	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2ccc(Br)cn2)cc1	727364173	NGMVCUZGRQEIMO-UHFFFAOYSA-N	441.307	1.234	50	20	IDGD	
O=C(CCn1cnc2ccccc2c1=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	728210077	QFTGTXMDDUQGHT-UHFFFAOYSA-N	427.486	1.371	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NN=Cc1cn(Cc2ccccc2)nc1-c1ccccc1	728435479	BWZWISAKUKUDPT-INIZCTEOSA-N	425.514	1.986	50	20	IDGD	
Cc1nc2n(n1)C[C@H](NC(=O)NNC(=O)c1ccc(Br)cc1Cl)CC2	729052751	VWYPHQZFHJHSGU-SNVBAGLBSA-N	427.690	1.961	50	20	IDGD	
C=CCN1C(=O)C(=O)N(CC(=O)NNC(=O)c2cc(-c3ccco3)nc3ccccc23)C1=O	729298706	SOPUETLLLGOZKT-UHFFFAOYSA-N	447.407	1.233	50	20	IDGD	
COC1CCN(C2(CNC(=O)NNC(=O)c3ccc4c(c3)OCCO4)CCCC2)CC1	730913710	IQJBEOBJHOKCCH-UHFFFAOYSA-N	432.521	1.825	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N[C@H](C)c1nnc2n1CCC2	730937451	QHDMMQPWIIGEQO-MNOVXSKESA-N	437.298	1.846	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)c2cc(Br)c3c(c2)OCCO3)C[C@@H](C)O1	732260204	PTVYRHKMUZPAOK-VXGBXAGGSA-N	442.310	1.481	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNC(=O)NCCN/C(O)=C2\N=CC=CC2=O)cc1	732466134	LWSRQDHPECXLFS-CZIZESTLSA-N	429.477	1.582	50	20	IDGD	
C[C@@H]1Cc2ccccc2N1C(=O)[C@@H]1CCCC[C@@H]1C(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1	732751881	ZGANWYXRBQRIPW-LAVFITLUSA-N	447.557	1.353	50	20	IDGD	
CCN(CC(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12)C(=O)OC(C)(C)C	734416734	BTSDABHHRJGKQH-UHFFFAOYSA-N	431.493	1.995	50	20	IDGD	
COc1ccc(/C=C(/C#N)C(=O)Nc2ccc(S(N)(=O)=O)cc2)c(OCC(=O)O)c1	734483746	SBVVZWXRMGUBFR-JYRVWZFOSA-N	431.426	1.352	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)CNC(=O)C2CCCCC2)CC1	734881489	NIOQVXFHOFUITE-UHFFFAOYSA-N	425.530	1.413	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)Sc1nc(C2CC2)nc2c1c(O)nc(=O)n2C1CC1	734980798	AWAIJHXUZRFIDL-JTQLQIEISA-N	446.533	1.779	50	20	IDGD	
COCCOc1ccc(-n2nc(C)c(C(=O)NNC(=O)c3ccc4c(c3)OCO4)n2)cc1	735027932	FGIDMJLUVQEQEG-UHFFFAOYSA-N	439.428	1.404	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)N[C@@H](C)CN1CCN(c2ccccn2)CC1	735519976	WVCPWPBBDODPSZ-INIZCTEOSA-N	436.520	1.192	50	20	IDGD	
CN(C)c1nccc(NNC(=O)CCn2cnc3ccc(Br)cc3c2=O)n1	740107691	KLKXXBKLMDJRRI-UHFFFAOYSA-N	432.282	1.548	50	20	IDGD	
CCS(=O)(=O)N1CCC(C(=O)NNC(=O)NCc2cccc(C(F)(F)F)c2)CC1	742459629	PUEVLTMZMUCTJM-UHFFFAOYSA-N	436.456	1.598	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@H]2C[C@H]2c2cccc(F)c2)cc1	743356449	MSHDFTNQJDBDSV-ROUUACIJSA-N	434.493	1.641	50	20	IDGD	
O=C(NC[C@@H]1CCCN(Cc2ccccc2)C1)NNC(=O)c1ccc(-n2cnnn2)cc1	743359125	RUPIIJHKAWLYPR-SFHVURJKSA-N	434.504	1.519	50	20	IDGD	
O=C(NCCN1C(=O)CCC1=O)NNC(=O)Nc1ccc(Br)cc1Cl	743611098	LTCRRZDMSASBRC-UHFFFAOYSA-N	432.662	1.587	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CN2CCN(S(=O)(=O)c3cc(C)ccc3C)CC2)c1	744384210	JTWOUGGHKIHGFH-UHFFFAOYSA-N	444.557	1.379	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CN2CCN(Cc3nc(-c4ccccc4)no3)CC2)c1	744387320	PHSBBCBMKIBTIN-UHFFFAOYSA-N	445.483	1.187	50	20	IDGD	
Cn1ccc(N2CCC[C@@H](NC(=O)NNC(=O)CCSc3ccc(F)cc3)C2=O)n1	745882858	KCXIBPULGKDFRX-OAHLLOKOSA-N	434.497	1.567	50	20	IDGD	
Cc1nn(-c2ccccc2)c2sc(C(=O)NNC(=O)NCc3nnnn3C3CC3)cc12	745910097	JQLIWBQRNRKXQK-UHFFFAOYSA-N	437.489	1.861	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)c1nccnc1C(=O)Nc1ccc(Cl)cc1	746233742	CQWTYBZCCSQUCZ-UHFFFAOYSA-N	441.831	1.928	50	20	IDGD	
CS(=O)(=O)CC[C@@H](NS(=O)(=O)c1ccccc1)C(=O)NNc1ccc(Cl)cc1	749274167	IVHOWFCYTXUAPX-MRXNPFEDSA-N	445.950	1.565	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)[C@@H]2CCN(C)c3ccccc32)CC1	750796439	WFVAEQYFAYDHTF-QGZVFWFLSA-N	444.561	1.085	50	20	IDGD	
O=C(NCc1cccc(C(F)(F)F)c1)NNS(=O)(=O)c1cnn([C@H]2CCOC2)c1	751540687	JZFYSXNLSXIDDL-ZDUSSCGKSA-N	433.412	1.556	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)N[C@@H](C)CNC(=O)OC(C)(C)C)c2ccccc2c1=O	756004237	RJBWVHSFGLFOTB-ZDUSSCGKSA-N	446.508	1.835	50	20	IDGD	
O=C(NCC1CCS(=O)(=O)CC1)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1	756755285	XHEGHQMTCFQPTL-UHFFFAOYSA-N	429.442	1.431	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)N[C@H]1CCN(C(=O)CCc2ccccc2)C1	756983383	LENZRJKITWQVPS-SFHVURJKSA-N	438.484	1.636	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)c1ccc(CSc2nncn2C)cc1)n1nnnc1C(C)(C)C	757747854	MXZAYDDSRKTLLG-LBPRGKRZSA-N	443.537	1.414	50	20	IDGD	
COC(=O)C[C@@H](C)C(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccc(OC)cc2)c1	758355423	TZUXUZYVGSSFNA-CYBMUJFWSA-N	449.485	1.456	50	20	IDGD	
O=C(NC[C@H]1CC(=O)N(Cc2ccccc2)C1)NNC(=O)c1cc(Br)c[nH]1	758649688	DXNVNLBSXMWLGN-CYBMUJFWSA-N	434.294	1.770	50	20	IDGD	
O=C(NNC(=O)c1cc(Cl)ccc1I)C(=O)Nc1ccccn1	758829726	HYJWWKLQDHNTKF-UHFFFAOYSA-N	444.616	1.739	50	20	IDGD	
CC(C)CNS(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2cccc(C#N)c2)cc1	759660896	DAJDQNOUJZJWDI-UHFFFAOYSA-N	429.502	1.637	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)NC[C@@H]1CC(=O)N(Cc2ccccc2)C1	759683038	LKRBFYQZCPFCFD-WBVHZDCISA-N	428.464	1.972	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)Cc2ccc(S(=O)(=O)CC(F)(F)F)cc2)nc1	759724728	FFGRMJRDWBYWIE-UHFFFAOYSA-N	431.392	1.890	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=S)NCc1ccc(S(N)(=O)=O)cc1	761187642	FFMKQCSTQWDFNY-UHFFFAOYSA-N	440.572	1.130	50	20	IDGD	
N#CCCCS(=O)(=O)c1ccc(C(=O)NNc2nccc(N3CCOCC3)n2)cc1	762861471	QEFBAZIOTAZYMS-UHFFFAOYSA-N	430.490	1.148	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)CCN2CCN(c3ccccn3)CC2)n[nH]1	763152474	GZAKPXXWGHPMBE-UHFFFAOYSA-N	449.515	1.454	50	20	IDGD	
Cc1oc2ncn(C)c(=O)c2c1C(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	763281508	JQKUFWYWLPLWNB-UHFFFAOYSA-N	448.480	1.084	50	20	IDGD	
O=C(NNC(=O)c1ccc2ccccc2n1)C(=O)Nc1ccc(CN2CCOC2=O)cc1	763466248	JIRZJSIWGADMRS-UHFFFAOYSA-N	433.424	1.587	50	20	IDGD	
CCn1ncc2ccc(NC(=O)C(=O)NNC(=O)c3cc(OC)c(OC)c(OC)c3)cc21	763540652	XVMMUBMKLOTRSD-UHFFFAOYSA-N	441.444	1.482	50	20	IDGD	
COCCOCc1cccc(NC(=O)C(=O)NNC(=O)c2c(C)nc3ccccn23)c1	763623674	FMSRZIZBUZCZDM-UHFFFAOYSA-N	425.445	1.205	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2cc3c(cc2Cl)OCCO3)c1	763665644	LTLFREWHXGRQFI-UHFFFAOYSA-N	433.848	1.893	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cnn(-c2ccccc2)c1C	763680930	IHLGBLDZVJXPTD-UHFFFAOYSA-N	437.456	1.744	50	20	IDGD	
COC(=O)c1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)CN1CCCc2ccccc21	763745265	BLFRTEGHLFOZTH-UHFFFAOYSA-N	444.875	1.665	50	20	IDGD	
O=C(CN1CCCc2ccccc21)NNC(=O)C(=O)Nc1ccn(CCc2ccncc2)n1	763745756	JVDOHOOSLSXKMI-UHFFFAOYSA-N	447.499	1.060	50	20	IDGD	
C[C@@H](CC(=O)NNC(=O)CNC(=O)c1cccnc1)[C@H]1CCCN(C(=O)OC(C)(C)C)C1	763824392	OMRYLRBKRPDCTE-RDJZCZTQSA-N	447.536	1.632	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cccnc2OC(C)C)cc1	763878420	QIJDVGQTPXMOQM-AWEZNQCLSA-N	428.445	1.625	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cnn(Cc3ccccc3)c2)cc1OC	763902922	ZEZRLRLBYSUDHH-UHFFFAOYSA-N	437.456	1.738	50	20	IDGD	
O=C(NNC(=O)c1ccc[nH]1)C(=O)Nc1ccnn1Cc1ccccc1Br	763978833	AYCIFXDONFMIBI-UHFFFAOYSA-N	431.250	1.422	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)C(=O)Nc1ccc(OC2CCCC2)nc1	763995276	PGAYCSIZWRLPMV-UHFFFAOYSA-N	436.266	1.893	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)C(=O)Nc1ccc(OC2CCCC2)c(Cl)c1	763998550	PVQKJAUCZHGUJJ-NSHDSACASA-N	443.909	1.182	50	20	IDGD	
CN1CCN(c2ccccc2NC(=O)C(=O)NNC(=O)Cc2cccc3ccccc23)CC1	764020476	ZDRMMRNKEKVNKE-UHFFFAOYSA-N	445.523	1.920	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc(-n2nccn2)cc1C(F)(F)F	764040119	DKEFCRCXSYKKRV-UHFFFAOYSA-N	448.361	1.694	50	20	IDGD	
CS(=O)(=O)Cc1ccccc1NC(=O)C(=O)NNC(=O)c1cccc2ccccc12	764049839	ZNSLGBPKOOUHGQ-UHFFFAOYSA-N	425.466	1.784	50	20	IDGD	
CN(C1CCCCC1)S(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccoc2)cc1	764164091	PRDGVVXBQCIXOC-UHFFFAOYSA-N	448.501	1.633	50	20	IDGD	
O=C(CCCc1ccccc1)NNC(=O)C(=O)Nc1ccc(S(=O)(=O)C(F)F)cc1	764225053	WYTAXYDVJYDJLM-UHFFFAOYSA-N	439.440	1.792	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)Cc2cccnc2)cc(OC)c1Br	764268417	RTBABPWDABQILM-UHFFFAOYSA-N	437.250	1.190	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(F)ccc2Br)cc1	764271197	XQPOSUALRHMSFF-UHFFFAOYSA-N	438.209	1.775	50	20	IDGD	
COCC(=O)NNC(=O)C(=O)Nc1ccc(OC)c(OCc2ccc3ccccc3n2)c1	764303051	RKAQFPATSZDPKG-UHFFFAOYSA-N	438.440	1.555	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3nn(C(C)(C)C)cc3C#N)n[nH]2)cc1C	764387993	NMNXXYMNMUZFMO-UHFFFAOYSA-N	448.487	1.916	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)c(Cl)n1	764389050	XLFAOVFRSCVDOJ-UHFFFAOYSA-N	432.799	1.673	50	20	IDGD	
C[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1NC(=O)NNC(=O)c1cc([N+](=O)[O-])ccc1O	764541714	VXPQLQUCUPOCKV-RISCZKNCSA-N	437.453	1.890	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)[C@@H]1C[C@@H](O)CN1C(=O)OCc1ccccc1	765250447	SPBUDNWTALAOOK-CVEARBPZSA-N	445.497	1.404	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)N[C@H]1C[C@H](OC(C)C)C1(C)C	766086231	VWPJOJBZBNCWCL-KBPBESRZSA-N	425.555	1.824	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)CCCc1nc(O)c2ccccc2n1	767275305	IBTGRXTVAYYZKX-UHFFFAOYSA-N	436.468	1.900	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)CN2CCN(c3ccccn3)CC2)n[nH]1	768274009	MREXAXQKUSGCSF-UHFFFAOYSA-N	435.488	1.064	50	20	IDGD	
COc1ccc(NNC(=O)CCCN(C)C2=NS(=O)(=O)c3ccccc32)c([N+](=O)[O-])c1	768338890	PKAMIMLOEJTRFX-UHFFFAOYSA-N	447.473	1.908	50	20	IDGD	
C[C@@]1(CNC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)CCO[C@H]1C1CC1	768529562	ZSISROILKFWPQZ-GMAHTHKFSA-N	429.565	1.734	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)c2ccnc(CNC(=O)OC(C)(C)C)c2)cc1	768691238	OYVUZJSPOXLRKZ-UHFFFAOYSA-N	429.477	1.988	50	20	IDGD	
C[C@@H]1C[C@H](NC(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)CCO1	770356475	WPVSTGGTVVYWBJ-DNVCBOLYSA-N	435.488	1.900	50	20	IDGD	
CC[C@H](C)NC(=O)CN1CCN(C(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)CC1	770650442	VIWIYWONHZABBN-LSDHHAIUSA-N	439.944	1.380	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)N1CCN(c2cc(C#N)ccn2)CC1	770659774	VKZUDMLFWRKDEZ-CQSZACIVSA-N	428.880	1.937	50	20	IDGD	
O=C(CCCC(=O)c1ccc(Br)cc1)NNC(=O)[C@@H]1CCS(=O)(=O)C1	770822273	ANSKQBFIECKROZ-GFCCVEGCSA-N	431.308	1.384	50	20	IDGD	
Cn1nc(-c2cc(F)cc(F)c2)cc1NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	772670908	CESRRAMCTDGNTJ-UHFFFAOYSA-N	439.386	1.808	50	20	IDGD	
CC1(OCC(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)CCC1	773251860	OADNBTOLIVOOOP-UHFFFAOYSA-N	431.514	1.885	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cn(C)nc2C(F)(F)F)ccc1OC(C)C	773529851	HSJQASCTDXOFCR-UHFFFAOYSA-N	443.382	1.634	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@H](C)CN(C)Cc2ccccc2)c2ccccc2c1=O	776079605	CCTKOMDQNLNWAA-MRXNPFEDSA-N	436.516	1.881	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)c1ccc(N(C)C)cc1	776242668	ARZGSNHZRVLSIK-CQSZACIVSA-N	433.534	1.708	50	20	IDGD	
Cc1ncc(C(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)c(C)n1	777277010	YYRDJGRQLWLSFI-UHFFFAOYSA-N	439.497	1.647	50	20	IDGD	
CCS(=O)(=O)c1ccc(CNC(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)cc1	777748874	ITYXZFNVLZFSIN-UHFFFAOYSA-N	447.521	1.907	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)[C@@H](O)Cc2cccc(C(F)(F)F)c2)c2ccccc2c1=O	778292737	DCNAKNIJTWYDGO-HNNXBMFYSA-N	434.374	1.317	50	20	IDGD	
C[C@@H](NC(=O)OC(C)(C)C)[C@H]1CCN(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)C1	778589695	SVNATMCKNFXUFA-HIFRSBDPSA-N	444.496	1.252	50	20	IDGD	
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)NNC(=O)c1csc(N2CCOCC2)n1	779387699	QJKVLMHRFUHYTP-LBPRGKRZSA-N	442.542	1.227	50	20	IDGD	
N#CCCn1cc(/C=C(/C#N)C(=O)NS(=O)(=O)C[C@H]2CCCO2)c(-c2ccccc2)n1	781512989	WYUUEMFGPUMWJI-LYPXWFNGSA-N	439.497	1.996	50	20	IDGD	
CSCc1ccccc1NC(=O)C(=O)NNC(=O)c1sc(N2CCOCC2)nc1C	782897764	TZSXXYGGKHJDAI-UHFFFAOYSA-N	449.558	1.551	50	20	IDGD	
COc1cc(C)ccc1Oc1ccc(F)cc1NC(=O)C(=O)NNC(=O)C(=O)NC1CC1	782966719	QBYGIXLYJLEQCL-UHFFFAOYSA-N	444.419	1.300	50	20	IDGD	
O=C(NNc1nc(-c2ccc(Cl)cc2)no1)C(=O)Nc1cc(-n2cnnn2)ccc1F	784795694	TVCHRQFGHGEMEN-UHFFFAOYSA-N	443.786	1.587	50	20	IDGD	
O=C(NNc1ccc(Br)nc1)C(=O)Nc1ccc(CN2C(=O)CCC2=O)cc1	784811603	KZCOACFXMLVYJF-UHFFFAOYSA-N	446.261	1.575	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNc2ncccc2Cl)cc1S(=O)(=O)N(C)C	784818859	CZUBNNMRYIVOHN-UHFFFAOYSA-N	441.897	1.466	50	20	IDGD	
NC(=O)CCSc1ccccc1NC(=O)C(=O)NNc1ccnc(Br)c1	784838251	UAQHNRZXAFKYQN-UHFFFAOYSA-N	438.307	1.893	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNc2cc(F)c(F)cc2F)c(OC)c(OC)c1	784893573	WTDVMAHWXMNKRH-UHFFFAOYSA-N	427.335	1.990	50	20	IDGD	
O=C(NNC(=O)c1nccnc1Sc1ccccc1)c1csc(N2CCOCC2)n1	785021393	KVXOAAFEZFUJLO-UHFFFAOYSA-N	442.526	1.996	50	20	IDGD	
Cc1coc(-c2ccc(C)c(NC(=O)C(=O)NNC(=O)Cc3cn4ccccc4n3)c2)n1	785067767	MNXNTUKUANGXBJ-UHFFFAOYSA-N	432.440	1.935	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)Nc1ccccc1S(=O)(=O)N1CCCCC1	787999613	BNXANJFBLDFPSB-UHFFFAOYSA-N	442.538	1.803	50	20	IDGD	
CN(NS(=O)(=O)c1c[nH]c2ncccc12)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	788915394	CZKGEUAFJGKLKZ-UHFFFAOYSA-N	438.510	1.361	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)n(C2CCOCC2)n1	789812715	MTNKTMCQOYNUNP-HKUYNNGSSA-N	441.488	1.202	50	20	IDGD	
Cc1c(C(=O)NNC(=O)CNC(=O)c2cccs2)nnn1Cc1ccc(F)cc1F	790562240	UYNMASLLURXLQZ-UHFFFAOYSA-N	434.428	1.166	50	20	IDGD	
CC(C)Cc1ncc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cn1	791949509	RPMUFKYVYFLJNW-UHFFFAOYSA-N	446.533	1.926	50	20	IDGD	
COc1cccc(C2=NO[C@@H](C(=O)NNC(=O)c3nn(C(C)C)c(=O)c4ccccc34)C2)c1	792016032	JSQPUTDUDBDGPI-LJQANCHMSA-N	449.467	1.940	50	20	IDGD	
COc1cc(C(F)(F)F)ncc1NC(=O)C(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	792264023	ITUYNSNGRVVGSL-UHFFFAOYSA-N	427.295	1.417	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)C(=O)Nc1cccc(Cl)c1Br	792280608	RKBJKPCDHGHYKT-UHFFFAOYSA-N	443.641	1.211	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)c1cc(F)ccc1-n1cccn1	792776893	KGODTALUHIUYRL-UHFFFAOYSA-N	436.491	1.985	50	20	IDGD	
COc1c(C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)cccc1[N+](=O)[O-]	792805972	OPFIOVDEEAODJI-UHFFFAOYSA-N	425.401	1.969	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNC(=O)NCc1noc(-c2cccs2)n1	792866636	AJYAQGJXKQYYSW-UHFFFAOYSA-N	430.446	1.555	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)N1CCN(C(=O)OC(C)(C)C)C[C@H]1c1nccn1C	792903965	FSACZXDWFUFPSK-CVEARBPZSA-N	436.557	1.596	50	20	IDGD	
COC(=O)[C@H]1CCCCN1C(=O)c1cccc(NC(=O)C(=O)NCCSSC)c1	793078683	HTMFMLJCVQXNDF-OAHLLOKOSA-N	439.559	1.920	50	20	IDGD	
O=C(NN=Cc1ccc(OCCn2cc(C(=O)O)nn2)c(Cl)c1)c1ccc(O)c(O)c1	794557576	FBDSICHXYTUUPN-UHFFFAOYSA-N	445.819	1.884	50	20	IDGD	
C=C(CBr)COC(=O)[C@@H](C)NC(=O)c1ccc(S(=O)(=O)N(C)C)cc1	795416455	PDFHLFGVGSCRHV-GFCCVEGCSA-N	433.324	1.550	50	20	IDGD	
CCOc1ccc(C(=O)NNS(=O)(=O)c2cc(Cl)cc(C(N)=O)c2)cc1OC	799120551	PFPIYRNCKIGAJV-UHFFFAOYSA-N	427.866	1.470	50	20	IDGD	
CSC[C@H](C)C(=O)N1CCC(C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)CC1	799832056	XIPCROKWCVGXOZ-AWEZNQCLSA-N	445.545	1.577	50	20	IDGD	
COc1ccnc(NNC(=O)Nc2cc3c(cc2N2CCCCC2)n(C)c(=O)n3C)n1	800593080	UDMCJIHWORVPLF-UHFFFAOYSA-N	426.481	1.815	50	20	IDGD	
CSC[C@@H](C(=O)NNC(=O)Nc1ccc2c(c1)OCO2)N1C(=O)[C@H]2CCCC[C@H]2C1=O	802104821	LACQKMOSPACJFG-MJBXVCDLSA-N	448.501	1.475	50	20	IDGD	
C[C@H](Oc1ccc(C=O)cc1)C(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	803101745	IVZSCUXXDBRCLW-HNNXBMFYSA-N	434.493	1.902	50	20	IDGD	
COc1cccc(CCC(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1F	803727429	OZPOKRRBJVQUMO-QGZVFWFLSA-N	432.404	1.298	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cnc(C3CCCC3)nc2N)c1	806284658	LIVWJAAQELKXET-UHFFFAOYSA-N	432.506	1.042	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)Nc1cc(F)c(N2CCOCC2)cc1F	806741758	PKGNAXBMBGVCHY-UHFFFAOYSA-N	431.399	1.905	50	20	IDGD	
CNS(=O)(=O)c1cc(NC(=O)/C(C#N)=C/c2cc(C)n(CCOC)c2C)ccc1O	807386028	XQUNDJXWVJKVMO-MHWRWJLKSA-N	432.502	1.911	50	20	IDGD	
Cc1nc(NC(=O)C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)ccc1-c1ccccc1	810386169	OVAJZVUCPJEEMT-UHFFFAOYSA-N	442.439	1.432	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)N1CCC[C@H](CNC(=O)C(F)(F)F)C1	811876101	JAPFXTPLBUDLIS-CYBMUJFWSA-N	425.411	1.773	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(=NNC(=O)N[C@@H]2CCS(=O)(=O)C2)[C@H]([C@@H]2CCOC2)C1	812227164	SVOBWYFUGIUVJT-KFWWJZLASA-N	444.554	1.122	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1)[C@H]1C[C@@H]1C	815563764	NJCQHVKCHMFSOJ-SGTLLEGYSA-N	439.428	1.756	50	20	IDGD	
C[C@H](C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1)c1ccc2c(c1)OCO2	815734660	SYCGZEZPFQTHKY-AWEZNQCLSA-N	433.486	1.683	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)COC1CN(C(=O)OC(C)(C)C)C1	817053591	YCKOPSDAHVGZET-UHFFFAOYSA-N	428.511	1.016	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NNC(=O)COc2ccccc2F)s1	887982441	GBKXXYCXRQSYMM-AWEZNQCLSA-N	441.506	1.575	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2ccc(C)c(NS(C)(=O)=O)c2)cc(OC)c1OC	906473404	NCBVPUQKYXZQNW-UHFFFAOYSA-N	437.474	1.467	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc2ccccc2c1)NNC(=O)[C@H]1COc2ccccc2O1	913416814	VEMHLKXEHSEBJZ-LJQANCHMSA-N	441.465	1.106	50	20	IDGD	
O=C1CC[C@H](C(=O)NNC(=O)c2cccc(S(=O)(=O)Nc3cccc(Cl)c3)c2)N1	913430523	PEHGQHYFTNQDHO-OAHLLOKOSA-N	436.877	1.180	50	20	IDGD	
CCCc1ccc(N2C[C@H](C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)CC2=O)cc1	914406043	JTBFRJIOPPEBKJ-QGZVFWFLSA-N	433.472	1.429	50	20	IDGD	
O=C(CCCCCNS(=O)(=O)c1ccc2c(c1)OCCO2)NNC(=O)C1CCCC1	914848887	JOWWKVIWOUMVND-UHFFFAOYSA-N	439.534	1.634	50	20	IDGD	
COc1ccc(C=NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)cc1	915915116	ONWDZYRDGVVHLD-UHFFFAOYSA-N	431.514	1.799	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)N[C@H](CN2CCOCC2)c2ccccc2)cc1	916216689	QKPJMAXMMPTDEE-HXUWFJFHSA-N	428.489	1.478	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCCCCc2ccccc2)cc1	916230140	IXQDAHQWBGOZFZ-UHFFFAOYSA-N	432.546	1.969	50	20	IDGD	
COc1ccc(C(=O)Oc2ccc(C=NNC(=O)CN3CCCC3=O)cc2OC)cc1	916358961	AVZYTDGNFSHFRY-UHFFFAOYSA-N	425.441	1.996	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)N[C@H](CN2CCCC2=O)c2ccccc2)c2ccccc2c1=O	916459973	SNHBLQXFXULXPO-GOSISDBHSA-N	448.483	1.241	50	20	IDGD	
C[C@H](C(=O)N(C)CC(=O)NNC(=O)c1ccc(COc2ccccc2)o1)n1cccn1	917496700	JMKJBQUBKDUZEQ-OAHLLOKOSA-N	425.445	1.536	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NCc1cccc(OCC(=O)N(C)C)c1	918223436	HGWINJMTQSSSQF-AWEZNQCLSA-N	432.452	1.591	50	20	IDGD	
CC[C@@H](NC(=O)NNC(=O)Cn1nc(C)cc1C)c1ccccc1OCC(=O)N(C)C	918224889	TZSXWNDBAMJDFB-QGZVFWFLSA-N	430.509	1.449	50	20	IDGD	
CCn1c(NNC(=O)c2ccc(OCC(=O)NC)c(OC)c2)nc2ccccc2c1=O	919703182	LMSATQORNKDIBJ-UHFFFAOYSA-N	425.445	1.307	50	20	IDGD	
C[C@H]1CCCN(C[C@@H](C)NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)C1	919914735	LFFBIROXJPGBHL-VQTJNVASSA-N	430.597	1.650	50	20	IDGD	
COc1cccc(N2CCC(NC(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)CC2)c1	1115910994	IVXKMHDOUMMJOV-UHFFFAOYSA-N	436.476	1.284	50	20	IDGD	
O=C(NC[C@@H](N1CCOCC1)C(F)(F)F)NNC(=O)c1cncn1-c1ccccc1	1261099093	IPPMUVJYTULLET-OAHLLOKOSA-N	426.399	1.079	50	20	IDGD	
COC(=O)Cc1cc(=O)n(-c2ccc(C(=O)NNC(=O)c3ccccc3Cl)cc2)[nH]1	1317835698	BOABHFAXVJNLCQ-UHFFFAOYSA-N	428.832	1.609	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc3cn[nH]c3cn2)C1	1779193620	OZDHMBBABLZPSA-WIYYLYMNSA-N	445.596	1.937	50	20	IDGD	
CC(=O)Nc1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)ccn1	1779295697	WFXDCEKHWLXHHA-HXUWFJFHSA-N	434.569	1.335	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccn(C(F)F)n3)C2)C1	1779613641	JGNBLMFPWFSISU-ZBEGNZNMSA-N	435.269	1.753	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1CCCO1)CCO2	1780098739	TXPOLGCUEMOQEJ-RXVVDRJESA-N	447.444	1.143	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(F)cc3)C2)C1	1780705435	XXHASXRWVIQKAY-BHSKHCGUSA-N	441.463	1.403	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCS(C)(=O)=O)C2	1780714411	CHSKHZPDBPEUGS-XOKHGSTOSA-N	443.393	1.171	50	20	IDGD	
Cc1cccc(CCC(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)n1	1781326698	QZHLVYNMIIBRSP-SJLPKXTDSA-N	428.302	1.843	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(-c4cc[nH]n4)cc3)C2)C1	1781882474	FBEQSYAJZMEZSQ-LAUBAEHRSA-N	432.908	1.774	50	20	IDGD	
O=C(CN1CCCCC1=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Br)C2	1782105954	LDDMEADPXZVYCG-RPVQJOFSSA-N	448.333	1.203	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C2CCC(O)CC2)C1	1782332643	NCQCTGHIUUERLY-AGHOITTASA-N	431.371	1.835	50	20	IDGD	
O=C(c1cccn2nccc12)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1782333401	RPUYGYCUXCWJPO-WMLDXEAASA-N	425.258	1.468	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H]2CCc3nc[nH]c3C2)C1	1782456157	FWALHOMFOIDSCN-ZWDAVXSWSA-N	448.640	1.880	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](C)n1cc(C)cn1)CCO2	1783354522	SKYAIPYZUXDTPP-RLFYNMQTSA-N	427.343	1.756	50	20	IDGD	
CCOc1cnc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](C)Br)C3)C2)cn1	1783532559	PQKRQOGUICKJOV-SJCJKPOMSA-N	427.299	1.102	50	20	IDGD	
C[C@H](CC(=O)N1CCO[C@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1)Oc1ccccc1	1783937800	XUXKIAXXMDMFNV-JPYJTQIMSA-N	446.548	1.047	50	20	IDGD	
O=C(C(Cl)Cl)N1CC[C@]2(C1)CN(C(=O)[C@H]1CC(=O)N(C3CCCC3)C1)CCO2	1783942957	QKXFUSUGNNBEOU-DJJJIMSYSA-N	432.348	1.411	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(C(N)=O)cc3)C2)C1	1784931823	UYQXOQNMVXRTCH-RTBURBONSA-N	428.316	1.465	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)C1CCC(CO)CC1	1785055046	BEXUIJNURPCXEK-OYVHKFOJSA-N	435.334	1.455	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3[nH]nc4ncccc34)[C@H]2C1	1787344388	XFNVLWQAAFPCDJ-BPUTZDHNSA-N	431.569	1.403	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3ON=C(c4ccccc4)O3)C[C@@H]21)[C@@H](F)Cl	1787446487	MRKIANKMXWAPPZ-LADRPBIPSA-N	425.844	1.235	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccncc3C(F)(F)F)[C@H]2C1	1787662686	ITLMOLKXRBNUFK-YUDUHTQSSA-N	449.857	1.948	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4c(c3)n(C)c(=O)n4C)[C@H]2C1	1787962545	WPTYJCZWJFYMBM-GGXPGOJBSA-N	448.951	1.488	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21)[C@H]1ON=C(c2ccccc2)O1	1788519815	AGIPOJCPIHFNDP-OSBUWBMXSA-N	425.844	1.235	50	20	IDGD	
COc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)CBr)C[C@@H]32)nn1C	1789398989	AGRRAKYXMURWSR-ABHRYQDASA-N	443.342	1.053	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCOCCOCCOC)C[C@@H]21	1789865179	PQOFJQXMTXVZGQ-FJIDUMEYSA-N	434.961	1.053	50	20	IDGD	
C[C@@H](Cn1cccn1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]2C1	1789922549	OQJQJZXQOKTHTH-YTFOTSKYSA-N	431.306	1.189	50	20	IDGD	
O=C(CN1C(=O)C=CC1=O)NC1(c2ccc(NC(=O)[C@H](F)Br)cc2)CCC1	1790537249	LRDYXJGHQNKREV-INIZCTEOSA-N	438.253	1.736	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ncc(Cl)cn3)C[C@@H]21	1790961587	QNCSKIUXGQGQJZ-DEQVHRJGSA-N	445.745	1.897	50	20	IDGD	
CC[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]2C1)N(CC)CC	1791054982	COZRHKZHHNUBJO-XAJHFOFHSA-N	432.403	1.870	50	20	IDGD	
CCOC(=O)C(C)(C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](Br)CC)C[C@@H]21	1792228689	SUHGTZKSJZTZKD-AJNGGQMLSA-N	447.370	1.729	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CC(=O)N(Cc2ccccc2)C1	1793208769	LIQVSZWTLOAOTI-GQUPQBGVSA-N	447.963	1.642	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CC[C@@H]3CCC(=O)N3C1)C2	1793452343	ZOLNTRBMTFARTE-WEVKLEIESA-N	425.957	1.385	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCc1cccc([N+](=O)[O-])c1	1793701659	KOHZSIHZBOCQKB-HIRMHNASSA-N	439.896	1.371	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1(F)CCC1)C2	1793882312	GOURDXYMICMCDN-XGUBFFRZSA-N	447.935	1.600	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(C)nn1C	1795105348	UTDAFSZPSYDUEU-YDOXXCSQSA-N	425.493	1.114	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CSc1ccncc1)C2	1795111576	XUSOEWBSYLHLGA-FVCICTRLSA-N	428.352	1.548	50	20	IDGD	
C[C@@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Br)C2)n1cccc1C=O	1795752174	FMQBVKHMMZGMTO-YMSVYLFOSA-N	426.311	1.235	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1[nH]nc3c(Cl)cccc13)C2)[C@@H](F)Cl	1796367242	BXPZZRJHRMLULB-CWWXITJESA-N	429.279	1.883	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](COC)NC(=O)OC(C)(C)C	1796841072	ZDTUBTWDVXHCGI-YIDVYQOGSA-N	447.960	1.418	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccn2ccnc2c1	1797446213	BBGMCKHGVLVNDC-MVWRLGRASA-N	425.316	1.774	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1n[nH]c2c(F)cccc12	1798152008	ZHAAVQZCKZRHDA-BTTYYORXSA-N	430.484	1.327	50	20	IDGD	
COc1ccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Br)cc1C	1799344936	YJCPFTMJASQXKJ-LTCOOKNTSA-N	443.313	1.826	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](C)N1CCN(C)CC1	1799968772	VPQWAFFLLSCPHQ-KSWRQPAISA-N	429.403	1.434	50	20	IDGD	
CC[C@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1O)C2	1800073586	SYZKQXMNYUXXLK-NEMWNAMBSA-N	443.972	1.870	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1CCC2(CC1)OCCO2	1800381915	JNWFZRSBXYYNKS-HNKHHVNMSA-N	445.354	1.293	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1C[C@@H]1c1ccc(OC)cc1)C2	1800971305	VERGOGCAKNLSJK-YSWVRCCISA-N	436.936	1.642	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnc2c(c1)CCNCC2)[C@@H](F)Br	1801310067	MIMXHARWMWTJQN-JYYAWHABSA-N	439.329	1.712	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(OC)cc1Cl	1801796581	ZGNORTRGFYMRPQ-LZDSYCOUSA-N	431.316	1.806	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cc1ccc3c(c1)CCO3)C2	1802338642	VEQKJOZHEMOMKZ-REPLKXPHSA-N	428.533	1.175	50	20	IDGD	
CN(C)C(=O)NCC(=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@H]1c1cccnc1	1802680385	JKLXFNCFSWUXGR-AEGPPILISA-N	444.305	1.049	50	20	IDGD	
COc1cnc(C(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)c(F)c1	1803141244	MEDYYYXUGVWIIP-RPVQJOFSSA-N	436.871	1.544	50	20	IDGD	
Cc1ccn2c(C(=O)N3CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]3c3cccnc3)cnc2c1	1803146562	BQCUSYHFKUUDPE-KPFFTGBYSA-N	441.919	1.957	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)CN2C(=O)CNC2=O)[C@H]1c1cccnc1	1804086771	ATEVGGKLWJYCRC-RLFYNMQTSA-N	435.912	1.047	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)c2cccc(=O)n2O)[C@@H]1c1cccnc1	1804952395	QZANHNQMTYOHFJ-JDFRZJQESA-N	449.305	1.584	50	20	IDGD	
O=C(CCBr)NC[C@H]1CCN(C(=O)c2c[nH]c(=O)cn2)[C@H]1c1cccnc1	1806344218	YIEDRQNUPCAMML-DYVFJYSZSA-N	434.294	1.270	50	20	IDGD	
C[C@H](NC(=O)c1cnccn1)C(=O)N1CC[C@H](CNC(=O)[C@H](F)Cl)[C@@H]1c1cccnc1	1808313222	BRVROWUTEOCUFE-YVVXQTMVSA-N	448.886	1.230	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)C(F)F)[C@H]1c1cccnc1	1808414891	OLROITSBEBGKGH-LTNORGLKSA-N	432.431	1.487	50	20	IDGD	
N#Cc1cc(CC(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)ccc1F	1808550351	VGNYPTOREPHFOB-LDQXTDLNSA-N	444.894	1.941	50	20	IDGD	
Cc1cscc1C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1808620997	QXDWYTONEJSKTH-WIYYLYMNSA-N	449.341	1.765	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)c2ccnnc2O)[C@H]1c1cccnc1	1811233712	QSEGIXVKFVNNNC-NJZAAPMLSA-N	434.294	1.680	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)COc2ccc(O)nn2)[C@H]1c1cccnc1	1812353324	VFBBEUNWGRQLTH-YZVOILCLSA-N	433.896	1.679	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)C(F)(F)Cl)[C@H]1c1cccnc1	1813215641	ZQRADKNXLVVXTK-CZUORRHYSA-N	431.871	1.292	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)CCS(C)(=O)=O)[C@H]1c1cccnc1	1813576008	AUCCBJQOOYULIX-JGGQBBKZSA-N	446.367	1.306	50	20	IDGD	
O=C(COc1ccc(F)cc1)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](O)CCl)CC2	1813717718	ZLQCAAUYGMAKMI-SMDDNHRTSA-N	427.885	1.873	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@H]1CC=CCC1)CC2)c1cccc(B(O)O)c1	1815359739	BTKQZBCXEOGEJM-XJKSGUPXSA-N	425.319	1.405	50	20	IDGD	
CC(C)CNC(=O)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](C)Br)CC2	1817331007	WUEPYZNJDLLLQX-NXEZZACHSA-N	431.356	1.611	50	20	IDGD	
C[C@@H]1CCC[C@@H]1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnccc1C(=O)NN)CC2	1818880841	WUZMXCNKTQKALK-UPJWGTAASA-N	442.545	1.804	50	20	IDGD	
Cc1ccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)c(O)n1	1820267667	YIVDJSJORTZUPF-MRXNPFEDSA-N	443.508	1.498	50	20	IDGD	
COCCn1ccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)[C@@H](Cl)COC)n[nH]2)n1	1822370229	SOHBOTYNWUQDJO-BBRMVZONSA-N	438.916	1.812	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)CCc2cccnc2)[nH]n1	1822414713	YWRZDSKTFAQOIC-GOSISDBHSA-N	441.536	1.803	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CN1CCOC1=O)CC2	1822861411	ZJNJVRXMFLURLO-XXFAHNHDSA-N	435.333	1.744	50	20	IDGD	
O=C(N[C@@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1)c1cc(O)nc(O)c1	1823003382	ILTMEPXELZKPPK-KRTXAFLBSA-N	445.270	1.866	50	20	IDGD	
CN1CCC(C(=O)N2CCCC[C@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1	1823809431	ZDEQDSZJNXYWQG-FQEVSTJZSA-N	435.613	1.321	50	20	IDGD	
CNC(=S)NCCC(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](C)Br)sc2C1	1825640611	DEBOPWNLXAPUQB-RKDXNWHRSA-N	448.412	1.323	50	20	IDGD	
O=C([C@@H](F)Br)N1CCC([C@@H]2CCCCN2C(=O)CN2CCOCC2)CC1	1826718650	INXJRTGPRBEWKA-DOTOQJQBSA-N	434.350	1.629	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(F)ccc3C)CCO2)C1	1830079484	LXCVBLALSUQLON-FXAWDEMLSA-N	428.888	1.458	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](C)N2CCN(C)CC2)CC1	1830245474	UHZDNFWJALHNQB-RLLQIKCJSA-N	443.032	1.496	50	20	IDGD	
CC[C@@H](NC(C)=O)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1833096918	LJHUXCAYQFZJSH-HZPDHXFCSA-N	449.365	1.163	50	20	IDGD	
N#Cc1ccc(CC(=O)NC2CCN(C3CCN(C(=O)[C@H](O)CCl)CC3)CC2)cc1	1833107560	BCMSLYSVSXBVMT-HXUWFJFHSA-N	432.952	1.272	50	20	IDGD	
Cc1ccc(F)cc1C(=O)NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1833151592	SWPIDPWKTIGWMT-LJQANCHMSA-N	425.932	1.919	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3coc(C(C)C)n3)CCO2)C1	1833350592	CZTQTXFFKLYBJE-KUHUBIRLSA-N	429.901	1.122	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3cncn3C)CC2)CC1	1834246329	RDHPPBCBHAMUDA-ZDUSSCGKSA-N	426.359	1.389	50	20	IDGD	
O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)CCc1ccccc1)CCO2	1834836202	IPKMKUKUWKWXLJ-HXUWFJFHSA-N	439.350	1.861	50	20	IDGD	
O=C(Cc1cscn1)NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1834841857	WOVLYDQMXNLFPX-MRXNPFEDSA-N	447.374	1.948	50	20	IDGD	
COc1ccc(CCC(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)cc1	1834846342	PEMYHPMKZPAEMD-UYAOXDASSA-N	428.888	1.619	50	20	IDGD	
Cc1noc(CC(=O)NC2CCN(C3CCN(C(=O)[C@@H](F)Br)CC3)CC2)n1	1834851651	MHHOSZXJYAHPQA-MRXNPFEDSA-N	446.321	1.183	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cc4ncccn4n3)CC2)CC1	1835542696	AIAIJTWVTVXOSE-QGZVFWFLSA-N	432.956	1.932	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)Nc3cnccn3)CC2)CC1	1836397207	UIRCOUDLSVKADU-CRAIPNDOSA-N	436.988	1.866	50	20	IDGD	
CN(C)c1ccc(C(=O)N2CCC(OC3CCN(C(=O)[C@H](O)CCl)CC3)CC2)nc1	1836714886	AIHNIBXYCXDVHN-LJQANCHMSA-N	438.956	1.360	50	20	IDGD	
CC#CC[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1)c1ccccc1	1837611234	FOHUOEPBBNIWIP-MIZPHKNDSA-N	448.947	1.240	50	20	IDGD	
Cn1ccc(CC(=O)N2CCC(OC3CCN(C(=O)CCBr)CC3)CC2)n1	1837653478	FFKOWTVIOSHLRX-UHFFFAOYSA-N	441.370	1.746	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cnnc(Cl)c3)C2)C1	1837710211	NZNJMMYPPPRMAD-GOSISDBHSA-N	442.976	1.052	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC(OC2CCN(C(=O)[C@H]3CC=CCC3)CC2)CC1	1837921402	HQPSEGSPYSQCKC-SFHVURJKSA-N	440.349	1.335	50	20	IDGD	
Cn1ccc(CC(=O)N2CCC(OC3CCN(C(=O)[C@@H](F)Br)CC3)CC2)n1	1837948521	GLWYTGXUNFZDNH-QGZVFWFLSA-N	445.333	1.652	50	20	IDGD	
Cc1nc(F)ccc1C(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1838261649	IBUXAVNFACMPFX-HXUWFJFHSA-N	427.904	1.864	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)Cc3c(C)n[nH]c3C)CC2)CC1	1838657042	JJSGIXOLUFCTMN-IBGZPJMESA-N	440.972	1.821	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)[C@@H]3[C@H]4COC[C@H]43)CC2)CC1	1838773421	FXRLQHONPLCBRF-KKBVYLPWSA-N	429.355	1.661	50	20	IDGD	
O=C(c1ccccc1F)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1838856226	VQYAJATXWRHLSR-RHSMWYFYSA-N	433.249	1.586	50	20	IDGD	
CC(C)n1nccc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2	1839153581	KULFPXSYBZUQJP-RTBURBONSA-N	447.363	1.770	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnn4cccc(F)c34)CCO2)C1	1839619740	DFKSIKOSOZNKPS-QRWLVFNGSA-N	438.887	1.561	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)CC(C)=O)C2)C1	1839966953	VBKOHNBTXZDPDU-DHSIGJKJSA-N	433.343	1.232	50	20	IDGD	
O=C(Cc1c(F)cccc1F)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840189207	CQUQRLCWHOVBQL-GOSISDBHSA-N	437.270	1.767	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC2(CCCN2C(=O)CNC(=O)c2cc(C)on2)C1	1844309869	HRCCSBNQKCARFO-GFCCVEGCSA-N	427.299	1.090	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC12CN(C(=O)c1ccccc1C(=O)OCCO)C2	1846177839	OPTRQTSATFMYKQ-CYBMUJFWSA-N	439.306	1.436	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@](O)(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)C(C)(C)CCl)C1	1847437827	VLAUVFUYMWXMIG-VFCRVFHLSA-N	443.972	1.825	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@H](C)NC(=O)OCc1ccccc1	12800227	KLPQMLLSNYLUDU-AWEZNQCLSA-N	447.517	1.364	50	20	IDGD	
C[C@H]1CC(C)(C)C[C@@]2(C1)NC(=O)N(CC(=O)OCC(=O)NNC(=O)c1ccccc1)C2=O	22208577	NHMASVQBISNZDC-RCDICMHDSA-N	444.488	1.128	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)c2cc(S(=O)(=O)NC3CC3)ccc2C)c(C)c1	105450769	RYWZFSGEUOTWSW-UHFFFAOYSA-N	430.530	1.926	50	20	IDGD	
N#Cc1ccc(NCC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc1	108712814	AFHDRANRSZKGKE-UHFFFAOYSA-N	427.486	1.216	50	20	IDGD	
O=C(NNC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)c1cccc(Cl)c1)C(=O)N1CCCC1	726161933	YNRJPOVTQNUIMB-WBAXXEDZSA-N	446.935	1.883	50	20	IDGD	
CC(C)[C@H](NC(=O)NNC(=O)COc1ccccc1[N+](=O)[O-])c1nnc2ccccn12	726283182	XTPCSVKWRFJWPX-KRWDZBQOSA-N	427.421	1.744	50	20	IDGD	
Cc1ccc(S(=O)(=O)NC(C)(C)C)cc1C(=O)N([C@H]1CCS(=O)(=O)C1)N(C)C	728178408	APHMAKVQKLAXLM-AWEZNQCLSA-N	431.580	1.178	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)[C@@H]2CCCN2S(=O)(=O)c2cccs2)c1	728208332	RCUJMHAOHOBJMR-HNNXBMFYSA-N	438.531	1.169	50	20	IDGD	
Cc1[nH]c(-c2ccncc2)nc(=O)c1CC(=O)NNC(=O)c1cccc(OC(F)F)c1	728544463	DFGZSQNOKMXOGQ-UHFFFAOYSA-N	429.383	1.745	50	20	IDGD	
O=C(Cc1cccc(F)c1)NCC(=O)NNC(=O)c1cc(F)ccc1Br	728546806	IEHHFPIWSHWQPB-UHFFFAOYSA-N	426.217	1.847	50	20	IDGD	
CNS(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2cccc(OC(F)F)c2)s1	728598394	APESPOZLIKLTEA-UHFFFAOYSA-N	434.446	1.402	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)N1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1	728951291	FZEXPIQYZKSGAV-DTORHVGOSA-N	430.305	1.813	50	20	IDGD	
O=C(NNC(=O)C1(C(=O)NC2CC2)CC1)c1nn(Cc2ccccc2)c(=O)c2ccccc12	729298689	SLGKSXNOCKCNJC-UHFFFAOYSA-N	445.479	1.265	50	20	IDGD	
CCC[C@@H](NC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1)c1ccccn1	729612616	GENRCGAYPOOTLB-GOSISDBHSA-N	433.534	1.882	50	20	IDGD	
COc1ccccc1C[C@H](C)CC(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	730656843	ZKEQWFWEVNDMSP-MGPUTAFESA-N	442.468	1.795	50	20	IDGD	
COC(=O)c1ccc(C(F)(F)F)cc1S(=O)(=O)NNC(=O)COc1ccccc1O	730812250	MMVRVUAILIOLQU-UHFFFAOYSA-N	448.375	1.586	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@H]2C(=O)NNC(=O)Cc2ccccc2F)c(OC)c1	731330490	XRZSBJBQTFMSTF-SFHVURJKSA-N	429.448	1.838	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)NC3CCN(CCC(=O)N(C)C)CC3)n[nH]2)cc1	731543914	QIZPXNGWBLBDMM-UHFFFAOYSA-N	441.536	1.272	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)c1nn(-c2ccc(F)cc2)ccc1=O	731627692	YQIUTGRJBZDUHO-UHFFFAOYSA-N	443.460	1.569	50	20	IDGD	
O=C(NNC(=O)c1nnc2ccccc2c1O)c1ccc(S(=O)(=O)N2CCCC2)cc1	731865654	QCPMQLKDMFXHFB-UHFFFAOYSA-N	441.469	1.195	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCc2nnc3n2CCCCC3)cc1Br	732238096	IPOMATPZQMQOTC-UHFFFAOYSA-N	437.298	1.920	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)[C@H]1CCCN(C(=O)c2cccc3ccccc23)C1	732644991	CIEJRELYJFTITF-IRXDYDNUSA-N	443.525	1.274	50	20	IDGD	
Cc1noc(C)c1[C@H](C)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	733851409	XWKLILXMTSFSJM-LBPRGKRZSA-N	435.506	1.781	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)[C@@H]1CC[C@H](C(F)(F)F)NC1=O	734250892	OAJUYBVUCQKDJJ-ZWNOBZJWSA-N	436.456	1.664	50	20	IDGD	
N#Cc1ccc(OCc2cccc(C(=O)NNC(=O)N[C@H]3CCS(=O)(=O)C3)c2)cc1	734428583	UZVVTLQBSQZVNE-KRWDZBQOSA-N	428.470	1.268	50	20	IDGD	
O=C(CCSc1ccc(F)cc1)NNC(=O)N[C@@H]1CCN(CCN2CCOCC2)C1	734685455	DPSJPVLFWSIMIL-QGZVFWFLSA-N	439.557	1.045	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)CCCNC(=O)c2ccccc2)CC1	734821062	FJXATJXUFKVTMW-UHFFFAOYSA-N	447.536	1.927	50	20	IDGD	
CCOC(=O)[C@H](NNC(=O)CNC(=O)c1ccco1)c1ccc(Br)cc1F	739993424	BPLSTRUZVDSSNO-OAHLLOKOSA-N	442.241	1.836	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)N1CCn2c(Cc3ccccc3)nnc2C1	743508619	RFLLBWHQEHDPPM-UHFFFAOYSA-N	430.472	1.695	50	20	IDGD	
COc1cccc2c1OCC[C@H]2NC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	743578008	GTOHGSRXNWTWPG-OAHLLOKOSA-N	434.474	1.958	50	20	IDGD	
C#Cc1cccc(NC(=S)NNC(=O)c2cc(NS(C)(=O)=O)c(OC)c(OC)c2)c1	743819841	CDOJMUDECCAUGR-UHFFFAOYSA-N	448.526	1.688	50	20	IDGD	
COC(=O)c1ccc(N2CCN(CC(=O)NNC(=O)c3ccc(C#N)cc3)[C@@H](C)C2)cc1	744393955	VXLRUAXHACJVSQ-INIZCTEOSA-N	435.484	1.317	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(CCNC(=O)NNC(=O)c2cccc(Cl)c2)CC1	744896253	VKSNBUSLGBBHIX-UHFFFAOYSA-N	425.917	1.837	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)[C@@H]2CCCN2c2ncnc3sccc23)c1	744959881	VTASFGJIBKDGBR-INIZCTEOSA-N	439.497	1.973	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)N[C@H]2CCCN(CC(F)(F)F)C2=O)c1C	746339234	LVCRCSJVTLSVKF-KBPBESRZSA-N	430.427	1.954	50	20	IDGD	
CCO/C=C(\C#N)C(=O)N1CCN(S(=O)(=O)c2ccc(Br)s2)CC1	746510608	ARFXMLWJRDXXPI-ZHACJKMWSA-N	434.337	1.787	50	20	IDGD	
CCOc1c(OC)cc(CNC(=O)NNC(=O)Cc2cn3ccccc3n2)cc1OC	746753978	IHNPNHOHIAQVFA-UHFFFAOYSA-N	427.461	1.823	50	20	IDGD	
Cn1c(=O)n(C)c2cc(S(=O)(=O)NNC(=O)c3ccc(Cl)cc3Cl)ccc21	747691288	AUUFIFMWIKLVNG-UHFFFAOYSA-N	429.285	1.807	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNS(=O)(=O)c2ccc(C(=O)OC)cc2C)cc1	747693201	REMSEFFZUVTTIT-AWEZNQCLSA-N	436.486	1.957	50	20	IDGD	
CN(CC(=O)NNc1nc(-c2ccccn2)nc2c1CCC2)S(=O)(=O)c1ccccc1	747982631	GGOOBTHFNSZXTO-UHFFFAOYSA-N	438.513	1.791	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)NCC1CCN(Cc2ccccc2Cl)CC1	748627633	KCPCZARJUSIWLR-HNNXBMFYSA-N	426.945	1.934	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CC[C@H](NC(=O)OC(C)(C)C)C[C@@H]2C)n1	749476233	WTLQICBCBNLOIO-KBPBESRZSA-N	425.555	1.519	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)NCCNS(=O)(=O)Cc2ccon2)c(C)n1CC(C)C	750077986	WKASDTYPVNNYFV-ZDLGFXPLSA-N	433.534	1.892	50	20	IDGD	
Cc1nnc2n1C[C@H](C(=O)NNc1nc3ccccc3c(=O)n1CCCOC(C)C)CC2	750773635	GCVDTPKENLPBIA-MRXNPFEDSA-N	439.520	1.817	50	20	IDGD	
O=C(O)CCC(=O)c1ccc(S(=O)(=O)NNC(=O)c2cc(Br)c[nH]2)cc1	751209198	XKGVUQMOQMIRAE-UHFFFAOYSA-N	444.263	1.448	50	20	IDGD	
O=C(NNC(=O)c1cccc2nc(O)oc12)c1cccc(S(=O)(=O)N2CCCC2)c1	751538737	MZUSVUICNNGZHI-UHFFFAOYSA-N	430.442	1.393	50	20	IDGD	
N#Cc1ccc(CN2CC[C@@H](NC(=O)NNC(=O)Cn3ccc4ccccc43)C2=O)cc1	753123601	BICBMTCYOUQWMX-LJQANCHMSA-N	430.468	1.644	50	20	IDGD	
CCOC(=O)c1ccc(N2CC(NC(=O)NNC(=O)Cc3c[nH]c4ccccc34)C2)nc1	753280033	QBYAVBIOLKRTQQ-UHFFFAOYSA-N	436.472	1.501	50	20	IDGD	
Cc1c(NC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])c(=O)n(-c2ccccc2)n1C	755319198	FJYVVRYPQFZMTK-UHFFFAOYSA-N	440.416	1.624	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)Nc1cccc(S(=O)(=O)N(C)C)c1	755368499	XWIXHDGGEREBSH-UHFFFAOYSA-N	438.531	1.891	50	20	IDGD	
COc1cc(CN2CC[C@H](NC(=O)NNC(=O)COc3ccc(F)cc3)C2)cc(OC)c1	756093318	FRYUAPUYESIRKT-KRWDZBQOSA-N	446.479	1.827	50	20	IDGD	
CS(=O)(=O)CCOc1cccc(NC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1	756298542	YWSYEASNZIBCBT-QGZVFWFLSA-N	435.458	1.103	50	20	IDGD	
NS(=O)(=O)c1cc(F)cc(NC(=O)NNC(=O)c2ccc(Br)s2)c1	756514613	ILOXFTVJDBLVEU-UHFFFAOYSA-N	437.272	1.764	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2cccc(S(=O)(=O)NC3CC3)c2C)cc1OC	756707724	NQKGGQYBTAAZQU-UHFFFAOYSA-N	448.501	1.919	50	20	IDGD	
COC(=O)c1ccc(NC(=O)NNC(=O)c2nnc(O)c3ccccc23)cc1C(=O)OC	756816383	DUTLIEOUCKMTLI-UHFFFAOYSA-N	439.384	1.375	50	20	IDGD	
CCn1cc([N+](=O)[O-])c(C(=O)NNC(=O)c2cc(-c3ccc(OC)c(OC)c3)[nH]n2)n1	756877830	BQEXNUUNMJDSST-UHFFFAOYSA-N	429.393	1.293	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)c2ccc(S(=O)(=O)NCCC#N)cc2)c(OC)c1	757182958	ZMOGKKHXJSNCGY-UHFFFAOYSA-N	432.458	1.431	50	20	IDGD	
O=C(NCCCOc1ncc(C(F)(F)F)cc1Cl)NNC(=O)C(=O)N1CCCC1	757710832	RPLISWURPGENTP-UHFFFAOYSA-N	437.806	1.476	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)cc2cccnc12)N[C@H]1CCS(=O)(=O)C1	758676775	RDWHVBAGNILIRS-NSHDSACASA-N	427.280	1.128	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)C(=O)N(C1CCCCC1)C2=O)C(=O)Nc1ccccn1	758833945	LPKOWPLJKAVIFB-UHFFFAOYSA-N	435.440	1.410	50	20	IDGD	
C[C@@H](O)C[C@@H](CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)c1ccccc1	759608863	FHZDEZGZPYIVSQ-QAPCUYQASA-N	448.545	1.436	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)NC[C@H]1CC(=O)N(Cc2ccccc2)C1	759683032	LKRBFYQZCPFCFD-DOTOQJQBSA-N	428.464	1.972	50	20	IDGD	
COc1cc(Br)cc(S(=O)(=O)NNC(=O)CNC(=O)OC(C)(C)C)c1	760515839	PBFARSAOPHMQPX-UHFFFAOYSA-N	438.300	1.292	50	20	IDGD	
O=C(NC1CC1)N[C@H]1CCN(C(=O)NNC(=O)c2ccc(Br)cc2Cl)C1	760669901	PYNWULUGEOFROC-NSHDSACASA-N	444.717	1.993	50	20	IDGD	
CC(C)(C)OC(=O)N1CCc2ccc(NC(=O)C(=O)NNC(=O)c3ccccn3)cc2C1	763466042	GEMHYQGYFCSCLA-UHFFFAOYSA-N	439.472	1.775	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2cscc2C)c1	763508514	NMACDKJAMKYMHF-UHFFFAOYSA-N	438.531	1.487	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(C#N)ccc2OC(F)F)cc1OC	763549871	AVYPZYVKHJZKHN-UHFFFAOYSA-N	434.355	1.577	50	20	IDGD	
CCCNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)c1	763600520	KDCDKCTUVMDTPU-UHFFFAOYSA-N	434.456	1.616	50	20	IDGD	
CCNS(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1	763653997	MVPXGOJFMLKHLF-UHFFFAOYSA-N	442.501	1.315	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)N2CC3(CCC3)c3c(F)cccc32)cc1	763660915	ILTFQWVHPMNZOS-UHFFFAOYSA-N	427.432	1.829	50	20	IDGD	
C=CCNC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2F)cc1	763678341	DKNNRAHYRFSKPS-UHFFFAOYSA-N	429.408	1.298	50	20	IDGD	
CC(C)OC(=O)NCc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)cc1	763838790	APENIPWHRZOKTQ-UHFFFAOYSA-N	446.435	1.625	50	20	IDGD	
CCOC(=O)c1cc(C)sc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccccc1F	763852985	ZOWTWELZKFEVGZ-NSHDSACASA-N	437.449	1.926	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)C(=O)Nc1cnc2c(c1)COCC2	763854629	SDXHMHNANRVKCT-CQSZACIVSA-N	434.452	1.861	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)Cc2c[nH]c3ccccc23)cc1NS(C)(=O)=O	763861990	YMOCJZBRHMPBMC-UHFFFAOYSA-N	443.485	1.176	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)C(=O)Nc1cccc(Oc2ccccc2)c1	763916190	BTZCXEIJUUHEQM-UHFFFAOYSA-N	443.423	1.854	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)Cc2ccc(F)cc2)c(OC(F)F)c1	763918859	JQMZWSMRECKYRR-UHFFFAOYSA-N	439.346	1.542	50	20	IDGD	
Cc1cc(Br)ncc1NC(=O)C(=O)NNC(=O)c1cc(Cl)ccc1O	763976955	JGQWXVYULKYMMU-UHFFFAOYSA-N	427.642	1.911	50	20	IDGD	
CC(C)OC(=O)c1c(NC(=O)C(=O)NNC(=O)c2cccn2C)sc2c1CCCC2	763994920	APMVGWDZPOCSEN-UHFFFAOYSA-N	432.502	1.930	50	20	IDGD	
CNS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)Cc2cccc3ccccc23)cc1	764026377	BCECPTCCGPVZRB-UHFFFAOYSA-N	440.481	1.077	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc(N2CCN(C)CC2)c(Cl)c1	764048301	OAYXSYMTZKBPBQ-UHFFFAOYSA-N	445.907	1.500	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2O1)C(=O)Nc1c2c(nn1-c1ccccc1)CCC2	764164619	RJUFNOJBLOPETN-LJQANCHMSA-N	431.452	1.451	50	20	IDGD	
CC(C)(C)c1cc(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)n(-c2ccccn2)n1	764166276	ANKCGOGMKNYBJV-INIZCTEOSA-N	448.483	1.654	50	20	IDGD	
CN(C)CCOc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(C#N)cc2)cc1Cl	764183456	YIXCOSKVBPZIRM-UHFFFAOYSA-N	429.864	1.552	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F	764239614	QEACVAIQQBRYFQ-UHFFFAOYSA-N	447.354	1.937	50	20	IDGD	
C[S@@](=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1F	764351071	OKCCBCKJJICMGI-SSEXGKCCSA-N	429.433	1.149	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2cnn(C)c2)cc1NC(=O)OC(C)(C)C	764360401	WFGSIWDCSOXOFF-UHFFFAOYSA-N	432.437	1.175	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)C(=O)Nc1ccccc1C(=O)N1C[C@@H](C)C[C@H](C)C1	764389629	UHNIZDXSPUFGEN-GJZGRUSLSA-N	437.500	1.908	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)NCc1ccc(N2CCCS2(=O)=O)cc1	764772712	LRFAVQHEDFXSCS-UHFFFAOYSA-N	436.465	1.275	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNS(=O)(=O)c3ccc4c(c3)COC4)CC2)cc1	765127783	QUOZIULOMWXVFS-UHFFFAOYSA-N	444.557	1.153	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)c3ccc(C)c(S(N)(=O)=O)c3)n[nH]2)cc1	765570632	DPSLBERCEITOSH-UHFFFAOYSA-N	427.486	1.670	50	20	IDGD	
N#C/C(=C\c1cn(CCC(N)=O)nc1-c1ccc(Br)cc1)C(=O)N1CC(O)C1	765853475	ASPDIJSQFLHCOI-NTUHNPAUSA-N	444.289	1.298	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C2=NN(CC(C)C)C(=O)CC2)cc1Br	766490536	BXPRKVQGASHGDY-UHFFFAOYSA-N	425.283	1.853	50	20	IDGD	
CCOc1ccc(-n2c(C)cc(/C=C(\C#N)C(=O)NS(=O)(=O)CC(N)=O)c2C)cc1	766928124	QQZJGHGLNUWRBU-MHWRWJLKSA-N	430.486	1.331	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cc(NC(C)=O)ccc2Cl)cc1OC	768107236	CFAYMSRNEHTBTA-UHFFFAOYSA-N	449.847	1.934	50	20	IDGD	
COc1cc2c(cc1NC(=O)C(=O)NNC(=O)CSc1ccccc1O)NC(=O)CC2	768242541	SASMXBXKONKCLZ-UHFFFAOYSA-N	444.469	1.164	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3ccccc3OCC(N)=O)n[nH]2)cc1OC	768275745	FHYUJOQDODFAJY-UHFFFAOYSA-N	439.428	1.033	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)N2CCN(c3nccn4cnnc34)[C@@H](C)C2)c1C	771495133	SDFOUKVRFRHGLS-BRLDDBHUSA-N	448.531	1.833	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)NNC(=O)Nc1cnn(Cc2nnc3n2CCCC3)c1	772642935	YVMUBBVDZJHUDW-UHFFFAOYSA-N	433.476	1.736	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NN=C1CCO[C@@H](C)C1)N(S(C)(=O)=O)CC2	773189540	HWIJPVGSXBGVSJ-SUMWQHHRSA-N	439.534	1.624	50	20	IDGD	
COC(=O)CNC(=O)c1ccc(NC(=O)C(=O)NNc2ccc(C(F)(F)F)cn2)cc1	773667202	KZXWGBSXAVYJSI-UHFFFAOYSA-N	439.350	1.085	50	20	IDGD	
O=C(NNc1c(F)cccc1F)C(=O)Nc1ccc(F)c(N2CCCS2(=O)=O)c1	773706895	AQNJKVHLVSMFHR-UHFFFAOYSA-N	428.392	1.726	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccccc1S(=O)(=O)N1CCCC1)NC1CCCCC1	775255672	WPZUNQLVFZRWSX-UHFFFAOYSA-N	430.552	1.296	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)CCS(=O)(=O)c2ccc3c(c2)CCC3)nc1C	778421491	CDAQOBPHPALBBA-UHFFFAOYSA-N	432.502	1.758	50	20	IDGD	
COCCn1ccc(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2Br)n1	778759359	CNRUTEVLVSPYPV-UHFFFAOYSA-N	427.215	1.282	50	20	IDGD	
COc1ccc(Cn2nccc2NC(=O)NNC(=O)Cc2cccnc2)c(OC)c1OC	779458643	GAZHIHUAKDRIOD-UHFFFAOYSA-N	440.460	1.748	50	20	IDGD	
COC(=O)CNC(=O)NN=C(C)c1ccc(S(=O)(=O)NCc2ccc(F)cc2)cc1	779817850	WFWZFRZFCFTULS-UHFFFAOYSA-N	436.465	1.500	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)NCc1cccc(S(=O)(=O)N(C)C)c1	782538658	XGPPTWDMCRGKMS-UHFFFAOYSA-N	440.909	1.743	50	20	IDGD	
CC[C@@H](C)NS(=O)(=O)Cc1cccc(NC(=O)C(=O)NNc2ccc(OC)cc2)c1	783037208	NMLLUUQQNOGAOK-CQSZACIVSA-N	434.518	1.995	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)CCS(=O)(=O)C1	783428001	VPZXLZWCUKLQEC-HXUWFJFHSA-N	428.470	1.487	50	20	IDGD	
CON(C)S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2cccc([N+](=O)[O-])c2C)cc1	784352309	LVEIFRUMYCCMNU-UHFFFAOYSA-N	437.434	1.167	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)C(=O)NNc1ncccc1Cl	784818940	FGSRBQJYLDXOOJ-UHFFFAOYSA-N	441.897	1.466	50	20	IDGD	
CCOC(=O)c1cnn(-c2cccc(NC(=O)C(=O)NNc3cccc(OC)n3)c2)c1C	784846312	PYEJZORFGZMHDQ-UHFFFAOYSA-N	438.444	1.843	50	20	IDGD	
C[C@H]1CN(Cc2ccccc2NC(=O)C(=O)NNc2ccnc(N(C)C)n2)C[C@H](C)O1	784969876	RSGRSAKYQDAJMS-GJZGRUSLSA-N	427.509	1.234	50	20	IDGD	
CN(C)c1nccc(NNC(=O)C(=O)Nc2ccc(-n3cccn3)cc2C(F)(F)F)n1	784970436	HGWYNSMBGIVPTF-UHFFFAOYSA-N	434.382	1.829	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)C(=O)Nc1cc(F)c(N2CCCC2)c(F)c1	785060044	GHPJWIGQPMBMKN-UHFFFAOYSA-N	442.426	1.541	50	20	IDGD	
Cc1ccnc(-c2ccc(NC(=O)C(=O)NNC(=O)Cc3cn4ccccc4n3)cc2)n1	785066483	BZVCKLGSQIPASV-UHFFFAOYSA-N	429.440	1.428	50	20	IDGD	
CNS(=O)(=O)c1ccc2c(c1)N(C(=O)C(=O)NNc1ccc(Cl)c(F)c1)CC2	785179741	OLBDCMSMGFBPDV-UHFFFAOYSA-N	426.857	1.420	50	20	IDGD	
Cn1c(=NNC(=O)[C@H](CC(N)=O)NC(=O)c2ccccc2Cl)sc2ccccc21	786015337	VDBBKZGNHCWEJO-ZDUSSCGKSA-N	431.905	1.499	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)[C@H]2CN(C)C(=O)c3ccccc32)c2ccccc2c1=O	786654865	SKKFJXOLPJGAIH-SFHVURJKSA-N	433.468	1.608	50	20	IDGD	
COc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NNC(=O)NCc2ccc(Cl)cc2)cc1	787424778	OGTAJCNPWHYKKV-LBPRGKRZSA-N	440.909	1.546	50	20	IDGD	
Cc1cc(C)cc(C(=O)N2CCC[C@@H](C(=O)NNc3ccccc3S(N)(=O)=O)C2)c1	788229180	UZBMGXHNWRTXNB-MRXNPFEDSA-N	430.530	1.946	50	20	IDGD	
COc1ccc(-c2noc(CCCC(=O)NNc3ccccc3S(N)(=O)=O)n2)cc1	788232226	RIRBJGZYSOAKBS-UHFFFAOYSA-N	431.474	1.859	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)cc1NC(C)=O	789813473	URFWKBDSWDLFQP-LPHOPBHVSA-N	440.456	1.312	50	20	IDGD	
O=C(NNC(=O)[C@H]1OCC[C@H]1c1ccccc1)C(=O)Nc1ccc(Oc2cccnc2)nc1	789815164	AQEIDFIAIVBGAJ-ICSRJNTNSA-N	447.451	1.928	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCC(C)(C)CN2CCCC2)cc1	790703102	YJKKVDAZDBHOJX-UHFFFAOYSA-N	439.582	1.068	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)c2csc(O)n2)c1	792011993	KRPPTOYDJYQEIC-UHFFFAOYSA-N	448.482	1.733	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)[C@H]2CCCN2c2ncnc3ccccc23)cc1	794732086	UUGMXYIKIQUMOX-LJQANCHMSA-N	440.529	1.992	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)N2CCN(c3ccc(F)cc3)CC2)cc1C	798310338	QQECJKGIZVHQEC-QGZVFWFLSA-N	441.507	1.739	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)Nc2ccc3c(c2)OCC(=O)N3C)n[nH]1	799244845	OOFGMKBWQKSGQT-UHFFFAOYSA-N	436.428	1.907	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@@H]2C(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)cc1	799289619	FPCOWDQZEIILJS-LJQANCHMSA-N	438.484	1.703	50	20	IDGD	
O=C(NNC(=O)c1sccc1S(=O)(=O)N1CCCC1)Nc1ccc2c(c1)OCO2	802098072	HVOSKHWKKWCYQU-UHFFFAOYSA-N	438.487	1.728	50	20	IDGD	
O=C(NC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1)NNC(=O)c1ccc([N+](=O)[O-])cc1	802331485	NPHIGUPXEIDAES-MRXNPFEDSA-N	425.401	1.667	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)[C@@H]2CCN(c3ccc(C#N)cc3F)C2)c2ccccc2c1=O	804161991	XXTMOPMNQSJSOC-CQSZACIVSA-N	434.431	1.232	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@@H]2CCOC[C@@H]2C)c1	807505412	KOPZJJPEBRXAGA-HOCLYGCPSA-N	426.539	1.334	50	20	IDGD	
COc1ccc(C=NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c(C)c1OC	807944296	WFTRZOSERZWJNO-UHFFFAOYSA-N	447.513	1.797	50	20	IDGD	
CCCn1nc(C(=O)NN=Cc2ccc(F)c(S(N)(=O)=O)c2)c2ccccc2c1=O	807953073	QLMOJHJORPHXFQ-UHFFFAOYSA-N	431.449	1.357	50	20	IDGD	
CCCNS(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)c2ccc(Cl)cc2O)cc1	808079370	BWJKGYNFQXLLNO-UHFFFAOYSA-N	447.922	1.357	50	20	IDGD	
COCC1(S(=O)(=O)NC(=O)/C(C#N)=C/c2cn(CCC#N)nc2-c2ccccc2)CC1	811157615	VLXYBHDSJRQMBF-SFQUDFHCSA-N	439.497	1.996	50	20	IDGD	
CCCc1nnc(SCC(=O)NNC(=O)c2ccc(Br)cc2Cl)n1N	813441161	ZKVGWFBPRVSNRM-UHFFFAOYSA-N	447.746	1.914	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)[C@@H](C)Cc2cnc3ccccc3n2)n1	815465954	PSNWABICUCGPLH-LBPRGKRZSA-N	427.486	1.507	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(Br)c(C#N)c2)c1	815564459	JORNNWPMRSDGCZ-UHFFFAOYSA-N	431.246	1.794	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C)cc2)cc1)[C@@H]1C[C@H]1C	815565922	FDNCCHQMZYMQAM-FOIQADDNSA-N	438.484	1.921	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)cc1)[C@@H]1C[C@H]1C	815565937	FINJGSSHDWENKK-BFUOFWGJSA-N	442.447	1.752	50	20	IDGD	
Cc1ccc(-n2c(NNC(=O)COCc3nncn3C)nc3ccccc3c2=O)c(C)c1	815603718	PAIMZXDKSBHXGF-UHFFFAOYSA-N	433.472	1.791	50	20	IDGD	
O=C(NNc1cccc(Cl)n1)C(=O)N1C[C@H](C(=O)N2CCCCC2)Oc2ccccc21	815728102	SFNQNOWSVBNCSG-MRXNPFEDSA-N	443.891	1.985	50	20	IDGD	
CN(C)c1c(Cl)cccc1NC(=O)C(=O)NNc1ccccc1S(=O)(=O)N(C)C	815750949	NUDQIGRFUJVIMY-UHFFFAOYSA-N	439.925	1.738	50	20	IDGD	
CC(=O)Nc1cc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)N(C)C)ccc1F	815752520	VTIBPTMUYVBPOW-UHFFFAOYSA-N	437.453	1.116	50	20	IDGD	
O=C(COc1ccc(Cl)c(F)c1)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	815827414	YJVAASXVWADNHY-UHFFFAOYSA-N	448.882	1.463	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(=O)n(CC(=O)NNc2ccc(F)cc2OC)c1	816338236	ATHHDFPQILSXLI-UHFFFAOYSA-N	426.470	1.170	50	20	IDGD	
CC(C)C[C@H](C(=O)NNC(=O)COc1ccc(C#N)cc1)N1C(=O)[C@@H]2CC=CC[C@H]2C1=O	864018079	QOAXGVSECGCQSN-GUDVDZBRSA-N	438.484	1.450	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)COc2ccc(F)c(Cl)c2)ccc1Cl	906279428	VBQRGTLGJLZULW-UHFFFAOYSA-N	436.248	1.620	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NN=C2CCN(S(=O)(=O)c3c(C)n[nH]c3C)CC2)cc1C	914555107	KJXRARNNURZLEQ-UHFFFAOYSA-N	446.533	1.539	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)N[C@@H](CN1CCOCC1)c1ccccc1	916215058	WECGCRZSUQVTEB-SFHVURJKSA-N	426.473	1.475	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)NCc2ccnc(N3CCOCC3)c2)cc1	916388987	MNCHJFJPRMJDQU-INIZCTEOSA-N	443.504	1.615	50	20	IDGD	
C[C@H]1CCCN([C@H](C)CNC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)C1	916450122	CMTUHGPQBWQBFU-VQTJNVASSA-N	430.597	1.650	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)c2ccccc2c1=O	916519800	KYXIITNCOJYXML-UHFFFAOYSA-N	444.492	1.277	50	20	IDGD	
Cc1cc(Br)oc1C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	917289602	KLDQXADOKHJQGA-GFCCVEGCSA-N	439.218	1.495	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NCc2cccc(C(=O)NC[C@@H]3CCCO3)c2)cc1	920349166	VFIWQVGMIZZYEJ-FQEVSTJZSA-N	440.500	1.813	50	20	IDGD	
O=C(NCCc1cccs1)NNC(=O)c1ccc(F)c(S(=O)(=O)NC2CC2)c1	920889150	NOFHHWRNBLVMEV-UHFFFAOYSA-N	426.495	1.515	50	20	IDGD	
CN1CCN(c2ccc(/C=C(\C#N)C(=O)Nc3ccc(S(N)(=O)=O)cc3)cc2F)CC1	1337561682	BZLSDRKTVWGHQL-FOWTUZBSSA-N	443.504	1.771	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1nc3ccc(F)cn3n1)C2)[C@@H](F)Cl	1778029511	NMWKUBYTQRWPJF-RVZJWNSFSA-N	427.839	1.530	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)Br)C2	1778107212	DAAWYTPFUYYOQK-YRWGSWDYSA-N	432.359	1.151	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4c(c3)NC(=O)CO4)C2)C1	1778570595	CVDCGDFBYJCLJT-YCRPNKLZSA-N	435.908	1.869	50	20	IDGD	
CCCC(=O)N[C@@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CO[Si](C)(C)C)C1	1779545463	OBAIGMTZYMXFER-CSODHUTKSA-N	441.645	1.657	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H]1CCC(=O)NC1)C2	1780706014	DMTPOTIEXIIIDI-TWKYDXJASA-N	434.364	1.263	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CSC(=N)N)C2	1780713327	QVIOVHGZDWPMGN-XFBWCDHKSA-N	425.382	1.363	50	20	IDGD	
Cc1nc(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](F)Br)C2)no1	1780770786	BKBFIXCFYXXMST-DJSGYFEHSA-N	433.278	1.125	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C=C/c1cnc[nH]1)C2)[C@H](F)Br	1780777665	XIGMFDNNLXHAMX-FALOVXMHSA-N	429.290	1.627	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)[C@@H](O)CCNC(=O)OC(C)(C)C)CCO2)C1	1781216897	QDCYUJVKEYTYIO-AUSJPIAWSA-N	447.960	1.109	50	20	IDGD	
O=C(c1ccc(CO)c(F)c1)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781333068	BLUNDPVBTCYERQ-WMLDXEAASA-N	433.249	1.452	50	20	IDGD	
Cn1cc(CC(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](F)Br)C3)cn1	1782591368	UFMCQTJOKDRUTA-FRFSOERESA-N	431.306	1.167	50	20	IDGD	
O=C(c1nc[nH]n1)N1CCO[C@]2(CCN(C(=O)[C@H](Br)Cc3ccccc3)C2)C1	1783021773	BAZSQKMSLCDOPE-BEFAXECRSA-N	448.321	1.254	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)C[C@@H](N)c3cccnc3)CCO2)C1	1783344087	YQOIKRTVWJGDGH-FRQCXROJSA-N	439.354	1.475	50	20	IDGD	
O=C(C(Cl)Cl)N1CC[C@@]2(C1)CN(C(=O)[C@H]1CC(c3ccccc3)=NN1)CCO2	1783949275	IMCBFUIKPZDLHD-DNVCBOLYSA-N	425.316	1.386	50	20	IDGD	
Cc1nn(C)c(C)c1CC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2	1784512602	LGZDZKMHEBNIJS-OALUTQOASA-N	431.364	1.646	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CNC(=O)c3cccnc3)C[C@@H]21	1784616337	PKBJTCLWQRYORS-XSLAGTTESA-N	436.940	1.199	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3cc(F)ccn3)[C@H]2C1	1785240913	IDJOGAPNDXLHMK-OQUILHJVSA-N	442.329	1.916	50	20	IDGD	
CCOc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCBr)[C@H]3C2)nn1	1786409099	ZVDHORPANZMLRU-YDHLFZDLSA-N	441.326	1.254	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc4c[nH]nc34)[C@H]2C1	1787325037	GKYPEGOCKBLUNO-MZGVZZPPSA-N	435.322	1.940	50	20	IDGD	
Cc1nc2cc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)[C@@H](O)CCl)C[C@@H]43)ccc2s1	1788006175	MYKZWIBLLYUMQY-OTRWWLKZSA-N	437.949	1.798	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cn4cc(F)ccc4n3)[C@H]2C1	1788346091	LTKSUGFDLFAILV-QEWYBTABSA-N	438.887	1.321	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc4c(c3)CCO4)C[C@@H]21	1788764329	RCLHRVMXPHDWJL-ZJOUEHCJSA-N	446.620	1.995	50	20	IDGD	
C[C@H](Nc1ccccn1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21	1788781969	QGQUEOGVGBJIDL-YGJAXBLXSA-N	443.317	1.552	50	20	IDGD	
Cc1n[nH]c(C)c1CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]2C1	1789923569	VEDZKVFMCDURKO-PCBIJLKTSA-N	431.306	1.239	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(F)cn3C)C[C@@H]21	1790962144	VMBZRJLJNGXCJC-ZIEJDFEHSA-N	430.318	1.931	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=N/O[C@@H]3CCCCO3)C[C@@H]21	1791055694	DZZMDROXROMNRB-HUGHUKRNSA-N	446.342	1.279	50	20	IDGD	
COc1ncc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](C)Br)[C@H]3C2)cc1F	1791057234	QIYCVOVROCPOID-UHXUCMFUSA-N	444.301	1.606	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nccc(Cl)c3OC)C[C@@H]21	1791253371	ANDPGMKYLXBHQP-VIRABCJISA-N	446.331	1.591	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1ccc(C2(NC(=O)CCN3C(=O)C=CC3=O)CCC2)cc1	1791564959	GFLUGUFCVRRJHW-MRXNPFEDSA-N	433.892	1.689	50	20	IDGD	
CC[C@@H](NC(=O)OC(C)(C)C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21	1792128532	CYDJOXKUPSYKPF-RMEBNNNOSA-N	435.924	1.804	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1c(F)cccc1Cl	1792753043	CTCFVERTTOBMRX-TYYYEBLRSA-N	433.307	1.865	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)c1ccccc1)C2	1792867727	KERLBMAFPDCIIT-CMZRPVNOSA-N	425.323	1.341	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1C[C@H]1c1ccc(F)cc1)c1cccc(B(O)O)c1	1792910356	XDPFQTWHGHMVIJ-LILSUDLASA-N	436.292	1.561	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(OC(F)F)cc1F)C2)[C@H](O)CCl	1792981308	UEBIYFIRAQGAQV-ANGCBRKESA-N	436.814	1.230	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2	1793455326	HYRZFBRFEYLVID-BDBLBAKTSA-N	438.908	1.814	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnnc(Cl)c1	1794209423	PNLPAKFJICNSFN-SGESHTKJSA-N	431.718	1.364	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cccnc1Cl)C2	1795111556	XAPAENUHBSKXHW-YWVIFJGQSA-N	430.730	1.652	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)c1cc2cc(F)ccc2[nH]1	1796188927	BSCOAYSXDVKQFM-REPLKXPHSA-N	435.264	1.552	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(N3CCCOC3=O)cc1)C2)[C@@H](F)Cl	1796366976	QQQDFTLNWXSMFM-YALNPMBYSA-N	439.871	1.771	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnnc2ccccc12	1796888999	CFSMHBWFEMJWKA-JRATXPSKSA-N	433.306	1.616	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CCCN1C(=O)OC(C)(C)C)C2	1799270214	LAQCHFHOEPWEJA-ZHCJQAHYSA-N	443.972	1.993	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc3ccc(F)cn13)C2)[C@H](F)Br	1799347609	SPQVPTSBVHFGJL-OWLDWWDNSA-N	443.248	1.367	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1CCN(CC)CC1)C2	1800644916	KOGTWMWLCRNASY-YVSFHVDLSA-N	430.387	1.481	50	20	IDGD	
C[C@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cncc(S(C)(=O)=O)c1)C2	1801959650	NBMDMAXELZFPQF-DEQVHRJGSA-N	444.351	1.520	50	20	IDGD	
CC(C)(CCl)C(=O)NC[C@@H]1CCN(C(=O)COc2ccc(O)nn2)[C@H]1c1cccnc1	1802904687	NFGKRERWMIYGJA-KXBFYZLASA-N	447.923	1.927	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)/C=N/O[C@@H]2CCCCO2)[C@H]1c1cccnc1)[C@@H](O)CCl	1803142754	IDTILXNXECIRQL-TUPMQDAGSA-N	438.912	1.216	50	20	IDGD	
CN[C@@H](CC(=O)N1CCC2(CCCN(C(=O)[C@H](C)CBr)C2)CC1)C(=O)O	1805384090	YOAIIGYQIKWOLE-KGLIPLIRSA-N	432.359	1.311	50	20	IDGD	
Cc1oncc1C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1	1805799564	SMUBMOHVVFHPIT-HNAYVOBHSA-N	449.471	1.010	50	20	IDGD	
COCCOCC(=O)NC[C@@H]1CCN(C(=O)[C@H](C)CBr)[C@H]1c1cccnc1	1806753523	OKKMFTUATIHFJQ-HFTRVMKXSA-N	442.354	1.781	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2nc3ccccn3n2)[C@H]1c1cccnc1	1807934009	JOFDTCCJMCQQFK-XYJFISCASA-N	442.907	1.698	50	20	IDGD	
C#CCCC(=O)N1CC[C@@H](CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@H]1c1cccnc1	1808420876	ATPIYQFDQXWARO-ULUZWJCLSA-N	434.500	1.635	50	20	IDGD	
Cc1cscc1C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1808619884	ILZAJOKKAQFCKE-WIYYLYMNSA-N	449.341	1.765	50	20	IDGD	
Cc1ccc(O)c(C(=O)N2CCC3(CCCN(C(=O)c4cccc(B(O)O)c4)C3)CC2)c1	1809978144	ZBBQCBFINZYPPD-UHFFFAOYSA-N	436.317	1.539	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC2(CCCN(C(=O)c3cccn4c(O)nnc34)C2)CC1	1810772363	ROIMPXRBSUAZED-OAHLLOKOSA-N	435.912	1.534	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2ncccc2F)[C@H]1c1cccnc1	1811118759	XKGDKDNSTKZPOB-HRAATJIYSA-N	442.495	1.308	50	20	IDGD	
Cn1cc(CC(=O)NC[C@@H]2CCN(C(=O)CCBr)[C@@H]2c2cccnc2)cn1	1813455573	GBPPWMIZBPKWAJ-QFBILLFUSA-N	434.338	1.849	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](C)CS(C)(=O)=O)n[nH]1	1815232081	FYEGHEPSJGTUPH-GMXVVIOVSA-N	449.371	1.866	50	20	IDGD	
Cc1noc(C)c1C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1	1816404762	YNHAJUBDBZXPLA-OAHLLOKOSA-N	431.497	1.693	50	20	IDGD	
O=C(CS(=O)(=O)N1CCCC1)N[C@@H]1CCc2nc(NC(=O)[C@H](F)Cl)sc2C1	1817121258	DHBXELKMEZLSGG-RNCFNFMXSA-N	438.934	1.015	50	20	IDGD	
CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](F)Cl)sc2C1	1817133949	PLFJRJAVHUENEN-MRCXROJRSA-N	442.904	1.060	50	20	IDGD	
Cc1ncsc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1	1817473130	HQASIIZOEKEUJD-INIZCTEOSA-N	439.306	1.474	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@H]2CCC(F)(F)C2)[nH]n1)c1cccc(B(O)O)c1	1817474866	GTKLHDMQZWLGHB-WMLDXEAASA-N	446.263	1.831	50	20	IDGD	
Cn1ccc2c(O)ncc(C(=O)Nc3cc([C@H]4CCCCN4C(=O)[C@@H](O)CCl)[nH]n3)c21	1820090844	IHMQHSVKHOPHCC-CABCVRRESA-N	446.895	1.908	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CN2CCNC2=N)[nH]n1	1820863453	DNTFIDAZYCZKFI-PXAZEXFGSA-N	430.340	1.478	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)c3[nH]cc4c3CCC4)sc2C1	1821202216	MIHQMOZKFLLRSA-CYBMUJFWSA-N	444.561	1.559	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1	1822416812	QGIDUIYYLKYYBW-WCQYABFASA-N	443.346	1.558	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCn1cncn1)CC2	1822869337	JTFKSDVCARCRIY-QLJPJBMISA-N	431.349	1.973	50	20	IDGD	
CN1C(=O)CC[C@H]1C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1	1823007552	PQYOQUMIFJRMBJ-FDOIEUKUSA-N	433.303	1.366	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC[C@H]1C1CCN(C(=O)C2=NNC(=O)C2)CC1	1824092010	LWSDMYOYRMKZIY-WFASDCNBSA-N	427.343	1.513	50	20	IDGD	
COC(=O)[C@@H]1CC[C@H](C(=O)N2CCCC[C@@H]2C2CCN(C(=O)[C@H](O)CCl)CC2)C1	1824172578	QQRCYUQSZQGLQV-BSDSXHPESA-N	428.957	1.795	50	20	IDGD	
CC[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CN1CCOCC1)CC2	1825445405	WAOQNYZEJHBAIO-VXGBXAGGSA-N	445.383	1.561	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc3nn[nH]c3c1)CC2	1826004949	WGOVQMAIQFWTCL-MNOVXSKESA-N	434.909	1.894	50	20	IDGD	
CC(C)c1cc(C(=O)N[C@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)no1	1826080443	KYZXHMXUKMTGLO-LBPRGKRZSA-N	448.549	1.853	50	20	IDGD	
C=C[C@H](O)C(C)(C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827057608	KZYRPQQTRIWEKN-SFTDATJTSA-N	442.365	1.173	50	20	IDGD	
CNCCCC(=O)N1CCC([C@H]2CCCCN2C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)CC1	1827681483	XMKPIBUZNYMUHX-ZFOBRQHDSA-N	444.580	1.740	50	20	IDGD	
CC(C)(C)OCC(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1	1828923436	KHAZNHXEBNYUFM-LJQANCHMSA-N	445.564	1.734	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)C(Cl)Cl)CC1	1828925285	ILZHYMGMVNCGAO-HNNXBMFYSA-N	442.347	1.722	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)c2ncccc2F)CC1	1829458499	AHQLGNJBEHZQQO-FQEVSTJZSA-N	439.296	1.448	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(Cl)nc3)CCO2)C1	1829513001	SUMJILJMUDWDHR-KDOFPFPSSA-N	432.304	1.059	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H]2C[C@H](O)CN2)CC1	1830204463	XHUQUYINLDPNPV-VVLHAWIVSA-N	430.387	1.502	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830366229	LJTMNSWRLCKYQH-AUUYWEPGSA-N	434.917	1.269	50	20	IDGD	
Cn1nc2c(c1C(=O)N1CCOC[C@@]3(C1)CN(C(=O)C(C)(C)CCl)CCO3)CCC2	1830366268	NGKPQXYROHBCBZ-OAQYLSRUSA-N	438.956	1.244	50	20	IDGD	
CC(C)(C)c1ncccc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1830722478	CELDUYJNDJNNPO-IERDGZPVSA-N	439.940	1.049	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3csc(C)n3)C2)C1	1831640974	UFLGOHUBFNFDCW-QFBILLFUSA-N	429.970	1.858	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCCn3ccnc3)C2)C1	1831656401	FCCIMGVQEPFRIZ-XLIONFOSSA-N	426.945	1.527	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccc(C)c(C)c3)CCO2)C1	1832405782	UZDKHNFCIOFHDY-SIKLNZKXSA-N	438.952	1.556	50	20	IDGD	
CN(C)c1cccc(OCC(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)c1	1832526925	GVQBQONRMVXVAI-AZUAARDMSA-N	443.903	1.122	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)C(C)(C)CNC(C)=O)CC2)CC1	1833545056	WXTWCUDTPLPTKZ-SFHVURJKSA-N	429.005	1.738	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(O)nc(Cl)c3)CCO2)C1	1833574693	KWVCILGHVOOSLU-LIRRHRJNSA-N	446.331	1.918	50	20	IDGD	
O=C(CCN1CCCCC1)NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1834528432	ZMNQBKCRLVLYKF-LJQANCHMSA-N	429.005	1.034	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3nc[nH]n3)CC2)CC1	1834953354	CEIPKFDRZVCDMI-CQSZACIVSA-N	427.347	1.163	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)COc3ccc(O)cc3)CC2)CC1)[C@@H](F)Cl	1835077664	BSWSRSOAXKBBHS-LJQANCHMSA-N	427.904	1.877	50	20	IDGD	
COCCn1ccc(C(=O)NC2CCN(C3CCN(C(=O)[C@H](F)Cl)CC3)CC2)n1	1835185126	KIYFIKDXDUKSKV-KRWDZBQOSA-N	429.924	1.249	50	20	IDGD	
Cc1cnc2c(C(=O)NC3CCN(C4CCN(C(=O)[C@@H](F)Cl)CC4)CC3)cnn2c1	1835563027	YORPGLOBDXIAIO-QGZVFWFLSA-N	436.919	1.757	50	20	IDGD	
CCOC(=O)/C=C/C(=O)N1CCC(N2CCC(NC(=O)CO[Si](C)(C)C)CC2)CC1	1835833388	CHLXJECNEICRLA-VOTSOKGWSA-N	439.629	1.529	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)c3ccnnc3)CC2)CC1	1837430259	ISZUITQJUBNNLV-CYBMUJFWSA-N	425.327	1.872	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)c3cc(O)n[nH]3)CC2)CC1	1837904118	WBYMJGYXNCPBAT-LLVKDONJSA-N	429.315	1.511	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3[nH]cnc3-c3cccnc3)CCO2)C1	1838498406	MKOQDADVMCSQRM-IERDGZPVSA-N	447.923	1.559	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)C3(C#N)CCC3)CC2)CC1	1838789236	MKSXFIFPJZBXBG-UHFFFAOYSA-N	433.553	1.052	50	20	IDGD	
CCOc1ccccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1838886098	FEMYLJGATMISAN-IBGZPJMESA-N	431.316	1.959	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4nccnc4c3)C2)C1	1839144715	JEEGSEGMNSWXLH-KKSFZXQISA-N	432.908	1.717	50	20	IDGD	
O=C(C[C@@H]1C[C@@H]2CC[C@H]1C2)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839202974	VHMOIBQXLYGDFT-YEAFQPLXSA-N	447.345	1.960	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(CC#N)cc1)CCO2	1839363061	GMYPASYJTBWRCV-QFIPXVFZSA-N	445.592	1.674	50	20	IDGD	
C[C@H](Cc1ccncc1)C(=O)N1CCO[C@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1	1839659610	QNGLOUSQUFRLLR-GCJKJVERSA-N	449.624	1.568	50	20	IDGD	
Cc1ccccc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2	1840034272	GQPKAOCLWBUEHJ-DNVCBOLYSA-N	425.323	1.848	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4c(C)cccc4[nH]3)C2)C1	1840153357	LWALBFFTHNMBPT-HTAPYJJXSA-N	449.935	1.800	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)Oc3ccccc3)C2)C1	1840154773	FVFMTFWVLURMQY-MMOPVJDHSA-N	440.924	1.164	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(CO)c(F)c3)CCO2)C1	1840783725	YKNDMOQNIFUFSX-OXQOHEQNSA-N	428.888	1.405	50	20	IDGD	
C[C@@H](Sc1ccccc1)C(=O)N1CCCC12CN(C(=O)c1cnccc1C(=O)NN)C2	1841526272	MRSWMNYFGSBYBS-OAHLLOKOSA-N	439.541	1.683	50	20	IDGD	
C=CCCc1ccc(C(=O)N2CCCC23CN(C(=O)CCC(=O)NN(C)C)C3)c(O)n1	1842297958	LFIMKUQCUFLEDH-UHFFFAOYSA-N	429.521	1.096	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2cc[nH]c3nccc2-3)C1	1843272640	NPJPGDFUFXFNHG-VULFUBBASA-N	433.472	1.466	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)[C@](C)(Cl)CCl)C2	1843416661	KOLLTSCOHQFCFN-ORWNMUSCSA-N	428.320	1.560	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)C(C)(C)c1ccccn1)C2	1843417010	NJAALIUSPNVELM-WGOQTCKBSA-N	436.516	1.697	50	20	IDGD	
C[C@@H]1CC[C@H](C(=O)N2CCCC23CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C3)O1	1843880004	LCHNJEATEJGVRB-QLFBSQMISA-N	429.945	1.889	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)c1cccn1C)C2	1844692240	YTIWBLGWUYLVIU-UHFFFAOYSA-N	426.429	1.989	50	20	IDGD	
O=C([C@H]1CC(=O)N(C2CCCC2)C1)N1CC2(CCCN2C(=O)[C@H](F)Br)C1	1845216512	UEBHZPRLQSPVMN-WFASDCNBSA-N	430.318	1.671	50	20	IDGD	
COc1cc(OC)c2cc(C(=O)NNC(=O)CNC(=O)c3cccs3)[nH]c2c1OC	725739690	MBTBZMYMCWFWJF-UHFFFAOYSA-N	432.458	1.446	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)N1CCCN(C(=O)c2ccc(Cl)cc2)CC1	725870929	VIKXRCIHVKVFPU-UHFFFAOYSA-N	447.879	1.252	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)Cc2cc3c(cc2Br)OCCO3)cc1	726276222	NCVIJXYRTHLRJD-UHFFFAOYSA-N	448.273	1.857	50	20	IDGD	
CC(C)Oc1ccc(NC(=S)NNC(=O)c2ccc(S(=O)(=O)N(C)C)o2)cc1	727500664	YWABYEWNHDXFNN-UHFFFAOYSA-N	426.520	1.949	50	20	IDGD	
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC[C@H](C(=O)NNC(=O)c2cccc(Cl)c2)C1	728203702	LLGWHSGCJRFHQN-AWEZNQCLSA-N	439.925	1.542	50	20	IDGD	
O=C(COC(=O)c1[nH]c2ccccc2c1Cl)NNC(=O)[C@@H]1COc2ccccc2O1	728325376	MAUVNPZHTOLSKV-HNNXBMFYSA-N	429.816	1.966	50	20	IDGD	
C[C@@]1(c2ccccc2)NC(=O)N(CC(=O)NNC(=O)c2cccc(OC(F)F)c2)C1=O	728489145	ZDWKWDITQLQELL-FQEVSTJZSA-N	432.383	1.516	50	20	IDGD	
Cc1ccc(S(=O)(=O)NNC(=O)c2cc(F)ccc2Br)cc1C(N)=O	728514303	HABCAOHUVRJTQC-UHFFFAOYSA-N	430.255	1.619	50	20	IDGD	
CNS(=O)(=O)c1ccc([C@H](C)NC(=O)NNC(=O)Cn2ccc3ccccc32)cc1	729497184	PSPWOHCFOASLJI-AWEZNQCLSA-N	429.502	1.641	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)C[C@@H](C)S(=O)(=O)c2ccc(F)cc2)cn1	729691625	JDUCQZYHNLPFRM-LLVKDONJSA-N	426.495	1.799	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Cc2coc(-c3cccs3)n2)c1	729966741	ZBIFGBRFTADNFJ-UHFFFAOYSA-N	434.499	1.657	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)[C@H]2CCN(c3ccc4c(c3)OCCO4)C2=O)c1	730516919	PCTIOYIKRIUIHB-QGZVFWFLSA-N	441.440	1.289	50	20	IDGD	
O=C(CNC(=O)c1c(Cl)cccc1[N+](=O)[O-])NNC(=O)Cc1c[nH]c2ccccc12	731050455	KYFSNRGLOAZFRB-UHFFFAOYSA-N	429.820	1.849	50	20	IDGD	
COc1ccc([C@@H](CNC(=O)NNC(=O)Cc2ccccc2F)N2CCOCC2)cc1	731401908	OEPJREILRQBFGX-HXUWFJFHSA-N	430.480	1.781	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)c1ccc(Sc2nncn2C)c([N+](=O)[O-])c1	731491655	YICPFFGJINVVAD-UHFFFAOYSA-N	428.430	1.958	50	20	IDGD	
COC(=O)c1ccc(CCC(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1	731596913	LHBKFXVAPNNKGD-UHFFFAOYSA-N	439.877	1.168	50	20	IDGD	
CC(C)(CNC(=O)NNC(=O)c1ccc(Br)cc1Cl)NS(C)(=O)=O	731683974	LONUQKWGIWADQT-UHFFFAOYSA-N	441.735	1.374	50	20	IDGD	
Cc1c(C(=O)NNC(=O)CCN2C[C@@H](C)O[C@H](C)C2)nnn1-c1ccc2ncccc2c1	732258932	IQYJFTZLTOCVCZ-HUUCEWRRSA-N	437.504	1.384	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCC1(N(C)C)CCOCC1	733851252	RXMMDEZBEJKSSA-ZDUSSCGKSA-N	443.342	1.658	50	20	IDGD	
CC(C)OCc1ccc(C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)cc1	735117035	LXLQVZLZESWMMF-UHFFFAOYSA-N	447.561	1.700	50	20	IDGD	
COc1cc(I)c(Cl)cc1C(=O)NNC(=O)c1cnn(C)c1	735444767	VXUBCECSBKKOQL-UHFFFAOYSA-N	434.621	1.762	50	20	IDGD	
O=C(CCSCc1nc(O)c2ccccc2n1)NNC(=O)CNC(=O)c1ccco1	739709795	ODJWFNRBTQNGRH-UHFFFAOYSA-N	429.458	1.129	50	20	IDGD	
CS[C@@H](C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1)c1ccccc1	740085833	NVAWVBCXXXBCTQ-QGZVFWFLSA-N	435.575	1.565	50	20	IDGD	
CC(C)[C@H](C(=O)OCC(=O)NNC(=O)c1ccc(Cl)cc1)N1C[C@H](C)O[C@H](C)C1	741027198	QTKANIYBBZWORE-QWQRMKEZSA-N	425.913	1.778	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)N2CCN(CC[S@](C)=O)CC2)N(C)c2ccccc21	742184721	ZMQXHRBDFPNHQD-HKBQPEDESA-N	443.573	1.180	50	20	IDGD	
NC(=O)CS(=O)(=O)c1ccc(C(=O)NNC(=O)CC23CC4CC(CC(C4)C2)C3)cc1	742472873	VXMIHEHYJMZCAF-UHFFFAOYSA-N	433.530	1.313	50	20	IDGD	
CCO[C@@H](C)c1ncc(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)s1	742478494	PWGRVSZPFITSPR-QMMMGPOBSA-N	432.911	1.616	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)c1cn(Cc2ccccn2)nn1	743416084	LAIGSXUKRNOIDQ-UHFFFAOYSA-N	429.506	1.555	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cc(Br)ccc2O)cc1N1CCNC1=O	743729692	DFGFMUVHGXFTQL-UHFFFAOYSA-N	449.261	1.768	50	20	IDGD	
CC(=NNC(=O)c1cc(Cl)ccc1O)c1ccc(S(=O)(=O)NCC(=O)O)cc1	744775639	DGQNCTJRKTVZHJ-UHFFFAOYSA-N	425.850	1.563	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)c1cc(S(=O)(=O)N2CCCC2)ccc1O	745990875	ZWXWMPLCGUGTRZ-UHFFFAOYSA-N	433.486	1.189	50	20	IDGD	
O=C(NNC(=O)[C@H](c1ccccc1)N1CCSCC1)c1csc(N2CCOCC2)n1	746818070	NDUZOUIOBNWWGO-KRWDZBQOSA-N	447.586	1.531	50	20	IDGD	
O=C(CN1C(=O)[C@@H]2CCCC[C@H]2C1=O)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1	748521614	WWPWHSMGZQDXCP-CHWSQXEVSA-N	433.408	1.598	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)OCC(=O)Nc2cc(S(C)(=O)=O)ccc2F)cc(C#N)n1C	750009115	FDDDAGHTRDWZCM-NSIKDUERSA-N	444.444	1.837	50	20	IDGD	
CC[C@@H](CS(=O)(=O)c1ccccc1)NC(=O)NNC(=O)C(=O)Nc1ccc(C)c(C)c1	752703310	HOXVXYVQWPQYCO-INIZCTEOSA-N	446.529	1.825	50	20	IDGD	
CCS(=O)(=O)c1ccc(N2CCC(NC(=O)NNC(=O)c3ccc(C)o3)CC2)cc1	752900738	BYIRZFVBJIXNJK-UHFFFAOYSA-N	434.518	1.995	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCO[C@@H]1c1cnn(-c2ccccc2F)c1)C(=O)Nc1ccccn1	753177592	LOVUVMWDDDIRES-KBXCAEBGSA-N	438.419	1.270	50	20	IDGD	
CC1(C)Cc2cc(S(=O)(=O)NNC(=O)C3CCN(c4ncccn4)CC3)ccc2O1	753363276	KYBLIOUTSKCXPW-UHFFFAOYSA-N	431.518	1.416	50	20	IDGD	
CNS(=O)(=O)c1cc(NC(=O)NNC(=O)COc2ccc(Cl)cc2)ccc1C	755515139	KEDYYBQIVICNAJ-UHFFFAOYSA-N	426.882	1.788	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)N[C@H]1CCN(c2c(F)cccc2F)C1=O	756211149	KVJYFCLHCCEBGO-HNNXBMFYSA-N	428.399	1.291	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccc3c(c2)CCCC(=O)N3)c1	756382798	UOFLMRHRCLWVMF-UHFFFAOYSA-N	445.501	1.678	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)Nc2ccc(CC)c(S(N)(=O)=O)c2)cc1OC	756527274	XSFFRHDGLOTCHL-UHFFFAOYSA-N	436.490	1.770	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)Nc1cc(Br)c(=O)n(C)c1	757678312	NCJMATSDSBSYGV-VIFPVBQESA-N	427.230	1.907	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)c2cccc(S(=O)(=O)N3C[C@H](C)O[C@H](C)C3)c2)nc1	759737481	CBNTXSWRQWCPHV-OKILXGFUSA-N	448.501	1.423	50	20	IDGD	
Cc1nn(C)c(C)c1C(=O)C(=O)NNC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1	761439306	RTKUYOZEJMZMNS-UHFFFAOYSA-N	443.467	1.929	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)COc1ccccc1[N+](=O)[O-])c1cn(-c2ccccc2)nn1	761785361	HOUYJMKEYVLJQR-ZDUSSCGKSA-N	425.405	1.646	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)N[C@@H]1CCCN(c2ccccc2F)C1=O	761814591	ASRWSLHAULQSQR-CYBMUJFWSA-N	433.465	1.143	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)NC[C@H]2[C@@H](C)OC(C)(C)N2C(=O)OC(C)(C)C)n1	762330783	QGWZBBNXQHAAEZ-CABCVRRESA-N	438.529	1.591	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)CN(C)C1=NS(=O)(=O)c2ccccc21	762410490	XFTZDYNLXMIELV-UHFFFAOYSA-N	448.526	1.016	50	20	IDGD	
Cc1ccc2ncc(C(=O)NN(C)C(=O)N3CCN(C(=O)OC(C)(C)C)CC3)c(=O)n2c1	763281246	IPWUZRVDDLWENF-UHFFFAOYSA-N	444.492	1.252	50	20	IDGD	
C[C@H](c1cccc(NC(=O)C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c1)N1CCOCC1	763445724	JVGAKACVWQNUDL-CQSZACIVSA-N	441.444	1.388	50	20	IDGD	
Cn1c(C(C)(C)C)nc2cc(NC(=O)C(=O)NNC(=O)c3ccc4c(c3)OCO4)ccc21	763548123	JPLBQOODTGLURK-UHFFFAOYSA-N	437.456	1.999	50	20	IDGD	
CC[C@@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1	763573007	PMTLCICWNZIWLF-ACJLOTCBSA-N	440.456	1.141	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(Cl)c2S(C)(=O)=O)c1	763623686	FPFFVJPOMNGIRI-UHFFFAOYSA-N	439.877	1.217	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(OCC(F)(F)F)nc2)cc1	763658827	DMEUIVCSNLQTMZ-UHFFFAOYSA-N	442.350	1.196	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2ccccc2O[C@@H]2CCOC2)c1	763666028	UWQSMNFUCPKLFH-MRXNPFEDSA-N	427.457	1.636	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2ccc(CN3CCOC3=O)cc2)c1	763775928	ZBQGUMPADIQQHS-UHFFFAOYSA-N	442.428	1.056	50	20	IDGD	
CC(C)(C)OC(=O)c1ccccc1NC(=O)C(=O)NNC(=O)COc1ccccc1C#N	763808065	UNIIDRDPWITSHY-UHFFFAOYSA-N	438.440	1.678	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccc(C#Cc2ccccn2)c1	763809591	XEBYXUHXWPBKHU-UHFFFAOYSA-N	439.431	1.518	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccccc2SCCC(N)=O)cc1	763810875	DDJVRWNMBFBEHF-UHFFFAOYSA-N	430.486	1.127	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)N2CCc3cc(F)c(F)cc32)cc1	763861250	NFQALVWPWUGLJZ-LBPRGKRZSA-N	433.411	1.868	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cnn(Cc3ccccc3)c2)cc1	763872139	KORDMPNLOBPZLW-MRXNPFEDSA-N	449.467	1.687	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(F)(F)F)nc2)cc1OC	763902072	MUHIDAIPOISEJW-UHFFFAOYSA-N	426.351	1.907	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)N(C)OC)cc2)cc1OC	763903867	VXCDJUNDAMOLCN-UHFFFAOYSA-N	444.444	1.127	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc(Cl)c(-n2nnnc2C2CC2)c1	763959920	LPHBDQBBNUXWGL-UHFFFAOYSA-N	439.863	1.901	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1cnn(Cc2ccncc2)c1	764012002	LIUOCMVYCHZASQ-UHFFFAOYSA-N	428.836	1.388	50	20	IDGD	
Cc1c(C(=O)NNC(=O)CSc2ccccc2O)cnn1CCO[C@@H]1CCCCO1	764045259	HIZQZKTYEFZMBV-LJQANCHMSA-N	434.518	1.994	50	20	IDGD	
COCCn1ncc2ccc(NC(=O)C(=O)NNC(=O)CCc3ccc(OC)cc3)cc21	764126975	NCNILPHBOIQWMH-UHFFFAOYSA-N	439.472	1.410	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(-n3cncn3)c(F)c2)o1	764138939	MKTQRCHSKGWYIP-UHFFFAOYSA-N	443.439	1.241	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccc(S(=O)(=O)C(F)F)cc1	764139218	OGQUXARSZMEKIY-UHFFFAOYSA-N	441.412	1.020	50	20	IDGD	
CC(C)OCCCn1c(NNC(=O)c2coc(S(N)(=O)=O)c2)nc2ccccc2c1=O	764162408	QRKLHORFXNLNIV-UHFFFAOYSA-N	449.489	1.209	50	20	IDGD	
CN1CC(=O)N(c2cccc(NC(=O)C(=O)NNC(=O)CCC3CCCCC3)c2)C1=O	764209432	AKUGIWKEXAWRIH-UHFFFAOYSA-N	429.477	1.531	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)cc1	764333523	VTHIAVJZVOZBPY-UHFFFAOYSA-N	438.456	1.864	50	20	IDGD	
CN(C)C(=O)c1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)c1ccc(O)c(Cl)c1	764349398	MSFCWJFYROPASU-UHFFFAOYSA-N	439.255	1.801	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCc2nc(C(C)C)cs2)cc1	764376026	KKNCUIMDIOFZPN-UHFFFAOYSA-N	439.563	1.726	50	20	IDGD	
Cc1nc(-c2ccccc2NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)no1	764389048	XJUNJJVYPFNQLH-UHFFFAOYSA-N	449.402	1.974	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)C(=O)Nc1ccc(S(=O)(=O)C2CCCC2)cc1	764389279	QWEPUDGLKKRHRC-UHFFFAOYSA-N	430.486	1.506	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)C(=O)Nc2c(C)cccc2C)cc1	764532543	CAVMJAWOLWBPFM-UHFFFAOYSA-N	432.502	1.018	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)NCc1cccc(N2CCCS2(=O)=O)c1	765271329	PYQXDKOAIDTZQZ-UHFFFAOYSA-N	432.502	1.274	50	20	IDGD	
O=C(NN=Cc1ncccc1C(F)(F)F)c1cccc(S(=O)(=O)N2CCOCC2)c1	765544673	UZBPIOIKNKUUDF-UHFFFAOYSA-N	442.419	1.885	50	20	IDGD	
Cc1cc(NC(=O)[C@@H](C)SCC(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)no1	765570248	XULKFVVYHPCMTP-SNVBAGLBSA-N	434.503	1.956	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)c1nccn2c(Br)cnc12	769618007	UWPJWQQFUIAXLY-UHFFFAOYSA-N	442.277	1.865	50	20	IDGD	
CSCCNC(=S)NNC(=O)c1ccc(Sc2nncn2C)c([N+](=O)[O-])c1	769767398	KDHFCULGPRGWLF-UHFFFAOYSA-N	427.537	1.346	50	20	IDGD	
O=C(COC(=O)CCc1nc(C2CCCC2)no1)NNC(=O)c1cccc([N+](=O)[O-])c1	770053936	UEZVKGQRBBJNAA-UHFFFAOYSA-N	431.405	1.572	50	20	IDGD	
CC(C)(C)NC(=S)NNC(=O)CN1C(=O)N[C@@](C)(c2ccc(F)c(Cl)c2)C1=O	770213525	KMOMIMBKZRCLSF-KRWDZBQOSA-N	429.905	1.540	50	20	IDGD	
COCCS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2c(F)cccc2Cl)cc1	770810898	HDYYWXRLRYFKSL-UHFFFAOYSA-N	429.857	1.981	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)c3ccc(S(=O)(=O)N4CCCC4)o3)nc21	770965412	JYHSHLRRQWQLGQ-UHFFFAOYSA-N	449.493	1.421	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)CN1C(=O)N[C@](C)(c2ccccc2OC)C1=O)c1ccccc1	771265683	FVRFSEXABFBEIC-QMHKHESXSA-N	438.484	1.803	50	20	IDGD	
C[C@H](CCN1CCN(C)CC1)NC(=O)CCC(=O)C(C#N)=C1N(C)c2ccccc2N1C	771656667	FSDHZLQAIQWJLO-GOSISDBHSA-N	438.576	1.799	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)[C@@H]1CCCN1C(=O)c1ccccc1OC(F)F	772017790	XMJGMGMVBRLGNE-YPMHNXCESA-N	427.404	1.382	50	20	IDGD	
CC[C@H](C)[C@H](NC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1)C(F)(F)F	772530658	IGFGPWLDIAPHGX-WFASDCNBSA-N	438.472	1.923	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)C(=O)Nc2cccc(NC(=O)CN3CCCCCC3)c2)n1	773479200	RYACTJWWCMRQKM-UHFFFAOYSA-N	439.520	1.990	50	20	IDGD	
Cn1cc(NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)c(C(F)(F)F)n1	773546402	MYNJRKKEBASUGO-UHFFFAOYSA-N	427.368	1.290	50	20	IDGD	
O=C(NNc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cccc(C(=O)N2CCSCC2)c1	773643298	NJZXVRSKWHIHIN-UHFFFAOYSA-N	429.458	1.866	50	20	IDGD	
COC(=O)CCc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)cc1	774008682	LICFJCREUHBJNB-ZDUSSCGKSA-N	447.875	1.999	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNS(=O)(=O)c3c(C)cccc3F)CC2)cc1	775284733	WPAUVYICEDYBMD-UHFFFAOYSA-N	434.537	1.570	50	20	IDGD	
CN1CCN(C(=O)c2ccccc2NC(=O)NNc2cccc(S(C)(=O)=O)c2)CC1	776465962	JQQIPVARQZSSCG-UHFFFAOYSA-N	431.518	1.626	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)NCc2cccc(OCCN3CCOCC3)c2)c1	776619142	QOJRLCXJVYEQNS-UHFFFAOYSA-N	448.545	1.627	50	20	IDGD	
CC(C)C[C@@H]1C[C@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)CCO1	777752204	YOWYYPKZBOJOGL-HZPDHXFCSA-N	426.539	1.475	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)[C@@H]1CCN(Cc2ccccc2)C1	778588882	MHKVCPJMMATUMN-QFBILLFUSA-N	434.504	1.517	50	20	IDGD	
COc1ccc(C[C@H](C)C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1OC	781157268	CKFGMYZKDYHAJP-HNNXBMFYSA-N	427.505	1.736	50	20	IDGD	
CCOc1ccc(-n2c(C)cc(/C=C(/C#N)C(=O)NCCN3CCNC(=O)C3)c2C)cc1	781412362	NTUSQEQDZUCNOF-ZHZULCJRSA-N	435.528	1.948	50	20	IDGD	
O=C(NNC(=O)c1ccccc1)C(=O)Nc1ccc2c(c1)CCC(=O)N2CC(F)(F)F	782116419	GVSRTHUHFTXZHU-UHFFFAOYSA-N	434.374	1.928	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)NCCCc1nc(-c2ccc(F)cc2)no1	784451277	FHWRICZZFMRPSE-UHFFFAOYSA-N	429.408	1.923	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)NCCCc1nc(-c2ccc(F)cc2)no1	784454791	PIGPPLPTLVBNTD-UHFFFAOYSA-N	436.444	1.663	50	20	IDGD	
CCCNC(=O)[C@H]1CN(C(=O)C(=O)NNc2ccc(F)c(F)c2F)c2ccccc2O1	784806584	JJKAKOLGJLLPOK-OAHLLOKOSA-N	436.390	1.867	50	20	IDGD	
CN(C)C(=O)COc1cccc(NC(=O)C(=O)NNc2ccnc(Br)c2)c1	784830255	JVIAQPMNLQCFNY-UHFFFAOYSA-N	436.266	1.393	50	20	IDGD	
CSc1nnnn1-c1cccc(NC(=O)C(=O)NNc2ccc(C#N)c(Cl)c2)c1	785091399	AJLNCJJRYUCYBT-UHFFFAOYSA-N	428.865	1.991	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2cc(N3CCOC3=O)ccc2C)n1	785238059	XQNUXOBCYNVOEA-UHFFFAOYSA-N	427.465	1.670	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2ccccc2O)cc1S(=O)(=O)N1CCCC1	786125208	MGJXOIFVTYVGTO-UHFFFAOYSA-N	434.474	1.652	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1cc(-c2ccsc2)nn1C	787543177	GVUSKEIDUVPKHH-NSHDSACASA-N	431.449	1.841	50	20	IDGD	
COCCOc1cc(OC)ccc1C(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	788525297	FINWOKQFJBZKMR-UHFFFAOYSA-N	435.864	1.451	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2c[nH]nc2-c2ccoc2)c1	789867820	YWYHPIKMOSNZFO-UHFFFAOYSA-N	431.474	1.775	50	20	IDGD	
CC[C@H](C)n1ncc(NC(=O)C(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)c1C	792264581	TVPSJTCEKQBGBX-NSHDSACASA-N	433.465	1.588	50	20	IDGD	
CCCCn1c(CCC(=O)NNC(=O)OC)nc2cc(S(=O)(=O)N(C)C)ccc21	792603875	JAUBWLHIJMGCMB-UHFFFAOYSA-N	425.511	1.407	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)c2cnn3c2C[C@H](CNC(C)=O)CC3)cc1OC	792736960	TUNKGYSGGQEEHQ-CQSZACIVSA-N	429.477	1.064	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(Br)cc2)n1	794089455	FTQAICPAUYOGIG-UHFFFAOYSA-N	441.307	1.234	50	20	IDGD	
CCCS(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)c2cccc(C)n2)c(OC)c1	794598591	ICGGLGUGBUDOQH-UHFFFAOYSA-N	442.519	1.174	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2cccc(C)n2)ccc1Br	794599491	GPQDWFZZMIKHPE-UHFFFAOYSA-N	428.264	1.562	50	20	IDGD	
Cn1c(N)c(C(=O)/C(C#N)=C/c2cnn(-c3ccc(C(F)(F)F)cc3)c2)c(=O)n(C)c1=O	794688066	WBKARVLQWRLWNX-KPKJPENVSA-N	444.373	1.661	50	20	IDGD	
CCOC(=O)Cc1cccc(S(=O)(=O)NNC(=O)c2ccc(OCC)c(OC)c2)c1	795285134	WPPDMUVFIHIPAD-UHFFFAOYSA-N	436.486	1.823	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1C	797535298	LLEJBKJYKYECAH-UHFFFAOYSA-N	425.199	1.097	50	20	IDGD	
COC(=O)c1ccccc1NNC(=O)[C@@](C)(NC(C)=O)c1ccc(S(C)(=O)=O)cc1	797749910	CYKHMTCBSOYHDP-FQEVSTJZSA-N	433.486	1.371	50	20	IDGD	
CCOc1ccccc1CN1CCN(CC(=O)NNC(=O)Cc2nc(C)cs2)[C@@H](C)C1	799345239	WFGVPGCNDUPYTG-KRWDZBQOSA-N	445.589	1.746	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNS(=O)(=O)c2cccc([N+](=O)[O-])c2)CC1	799533198	XYCNLUPQFUYPHA-UHFFFAOYSA-N	443.482	1.487	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NN=Cc2cc(C(=O)OC)c(C)n2C)c1	800805580	TZRPFTMFAYPZIV-UHFFFAOYSA-N	434.518	1.915	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2CCCN(S(=O)(=O)c3ccccc3)C2)cc1	801108864	OVOQCPNTFAYQKS-MRXNPFEDSA-N	444.513	1.182	50	20	IDGD	
Cc1nc(C#N)c(N2CCC(C(=O)NNC(=O)c3nn(-c4ccccc4)cc3O)CC2)o1	802427921	JSPNFNXOTJQZJQ-UHFFFAOYSA-N	435.444	1.424	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NC(=O)NNc2ccc(-n3ccnc3)nn2)cc1	806100713	ALULGOUBENDRHG-UHFFFAOYSA-N	430.494	1.841	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)[C@H](c2cnn(C)c2)N(C)C(=O)OC(C)(C)C)c1	806365336	SHACBHSQUBJCPX-SFHVURJKSA-N	446.508	1.596	50	20	IDGD	
O=C1COc2c(cc(Cl)cc2NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)N1	806757982	AUGNQQWGZMSBQQ-UHFFFAOYSA-N	445.867	1.530	50	20	IDGD	
O=C(NCC1CCN(S(=O)(=O)C(F)F)CC1)NNc1ccc2c(=O)[nH]ccc2c1	806797008	OQCHNYPNYUWFTA-UHFFFAOYSA-N	429.449	1.419	50	20	IDGD	
Cc1c(C(F)(F)F)nn(C)c1NC(=O)C(=O)NNC(=O)C1=S=C2CCCCCC2=C1	806975762	NRKZDZXVHQIWDN-UHFFFAOYSA-N	443.451	1.815	50	20	IDGD	
COC(=O)c1c(C)csc1NC(=O)C(=O)NNC(=O)CSc1ccccc1OC	806980255	NACGMHGZNLVCRB-UHFFFAOYSA-N	437.499	1.730	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccc(F)c(N2C(=O)CCC2=O)c1	806980482	QHINNNRRIDIFBH-UHFFFAOYSA-N	426.404	1.116	50	20	IDGD	
O=C(c1ccccc1)c1nc[nH]c1C(=O)N1CCN(S(=O)(=O)CBr)CC1	807195481	DHYLJCZIONXHJL-UHFFFAOYSA-N	441.307	1.081	50	20	IDGD	
CN1CCN(C(=O)NNC(=O)CSc2nc3ccccc3nc2N2CCCC2)CC1	807379376	XZJRWXMLVZLAAX-UHFFFAOYSA-N	429.550	1.310	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCC2(S(C)(=O)=O)CCCC2)nc1	807535867	MHTYLBBXOSVKHK-UHFFFAOYSA-N	447.583	1.096	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)NCC(=O)NN=c2cc[nH]c3ccccc23)cc1	810361753	SFTIWMJLUHHGJI-UHFFFAOYSA-N	428.470	1.255	50	20	IDGD	
O=C1COc2c(cccc2NC(=O)C(=O)NNC(=O)c2ccccc2Br)N1	810385109	MABUXWOJFVYDAE-UHFFFAOYSA-N	433.218	1.180	50	20	IDGD	
CC(C)n1ncc2cc(C(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)cnc21	810455155	SZUMXYMGYCJMHP-UHFFFAOYSA-N	430.490	1.337	50	20	IDGD	
COC[C@@]1(C(=O)NNC(=O)Cc2cn3ccccc3n2)CCN(C(=O)OC(C)(C)C)C1	810465086	KFINLHFXVFVZIJ-OAQYLSRUSA-N	431.493	1.298	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NN=C(C)c3ccc4[nH]c(=O)c(=O)[nH]c4c3)n[nH]2)cc1OC	811645355	IZYNAFOICSVIAD-UHFFFAOYSA-N	448.439	1.778	50	20	IDGD	
C[C@H](C#N)Oc1ccccc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	813033406	RMWOSTGMKDLMAP-CYBMUJFWSA-N	431.474	1.310	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1C(F)(F)F)c1csc(N2CCOCC2)n1	814736788	SFZMTOJAJNLERK-UHFFFAOYSA-N	445.379	1.982	50	20	IDGD	
CC(=NNC(=O)c1cnn(-c2ccccc2)c1)c1ccc(S(=O)(=O)CC(N)=O)cc1	814848761	ROSMPTSXNFKUHD-UHFFFAOYSA-N	425.470	1.285	50	20	IDGD	
CCOC(=O)c1cc(COC)cc(NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)c1	815568666	PQGVQZXGXHWTLU-GOSISDBHSA-N	441.440	1.099	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCO1)C(=O)Nc1cccc(CS(=O)(=O)Cc2ccccc2)c1	815779007	NTJWJAXLZAYDHU-GOSISDBHSA-N	445.497	1.067	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@H]2CSC(c3ccccc3O)=N2)cc(OC)c1OC	816813963	DCMBDBZBHPQABF-CYBMUJFWSA-N	431.470	1.741	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)N2CC[C@H](CS(C)(=O)=O)C2)N(C)c2ccccc21	816997228	BABYNTLAUQDJTI-HNNXBMFYSA-N	430.530	1.550	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNS(=O)(=O)c1cccc(S(N)(=O)=O)c1	817974833	GBODHCSZZWFKQI-CYBMUJFWSA-N	449.510	1.264	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)CNC(=O)c2ccc(C#N)cc2)c1	818744551	AOQDPRAGZXNVHS-UHFFFAOYSA-N	431.246	1.980	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)N2CCC(O)(c3nn[nH]n3)CC2)c(C)n1C[C@H]1CCCO1	819615092	WLIVLYUKOOAFBJ-UWKDKTGGSA-N	425.493	1.214	50	20	IDGD	
NC(=O)N[C@H](CC(=O)NNC(=O)COc1ccc(Br)cc1)c1ccccc1	821903765	AZLQKULSMXXASJ-OAHLLOKOSA-N	435.278	1.775	50	20	IDGD	
COc1ccc(-c2nnc(S)n2CC(=O)NNC(=O)CNc2cccc(OC)c2)cc1	825801499	OILQMJGWVZEWCO-UHFFFAOYSA-N	442.501	1.511	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1)N1CC[C@@H](B(O)O)C1	864233217	GOMZCYPPPIBSLD-SECBINFHSA-N	428.625	1.103	50	20	IDGD	
COc1ccccc1N(C)S(=O)(=O)c1ccc(C)c(C(=O)N2CC[C@H](B(O)O)C2)c1	864234661	ZEQKKSNCJGBJKT-HNNXBMFYSA-N	432.307	1.518	50	20	IDGD	
O=C(NNC(=O)c1cc(I)ccc1-n1cnnn1)c1ccccc1	911621197	KTKRKSYTWZUMSW-UHFFFAOYSA-N	434.197	1.342	50	20	IDGD	
C[C@@H](NC(=O)C1CCCC1)C(=O)NNC(=O)c1ccc(CSc2nncn2C)cc1	916102386	JWVYGWZPWUMPIA-CYBMUJFWSA-N	430.534	1.563	50	20	IDGD	
CCOc1ccc(O)c(C=NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c1	916258689	IZOGZOUWSUYBMN-UHFFFAOYSA-N	433.486	1.576	50	20	IDGD	
CC(C)NC(=O)C(=O)NNC(=O)c1ccc(NC(=O)c2ccc(Br)cc2)cc1	916374377	XJKCNCQSHQFNIY-UHFFFAOYSA-N	447.289	1.987	50	20	IDGD	
COc1cccc(CCNC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)c1	916382041	JIYQCQUZQJTFCQ-UHFFFAOYSA-N	434.518	1.197	50	20	IDGD	
O=C(NNC(=O)c1sccc1S(=O)(=O)N1CCCC1)c1ccc(Cl)cc1O	918359380	YSOVCBALOWXPOW-UHFFFAOYSA-N	429.907	1.966	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)CN2C(=O)N[C@@](C)(c3ccc(F)cc3)C2=O)cc1	919836438	PQFCJYUNYJBYFP-QFIPXVFZSA-N	442.447	1.382	50	20	IDGD	
O=C(CN1CCCC1=O)NNC(=O)[C@H]1CCCN1C(=O)c1ccc(Cl)c(Cl)c1	920435594	KKZLQQUXENQHHC-CQSZACIVSA-N	427.288	1.368	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N[C@H](C)Cn2cncn2)cc1	920851664	MSCDOGSYNPWODE-GESOSKEOSA-N	448.487	1.137	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)Nc1nc(CN2C[C@@H](C)O[C@H](C)C2)cs1	920930484	KEUJNNFAPHQPCI-ZIAGYGMSSA-N	449.533	1.993	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)NNC(=O)c2ccc3c(c2)OCO3)cc1OC	920932574	QCBZBPTZDCMQAT-UHFFFAOYSA-N	436.446	1.652	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)c1ccc(N2CCOC2=O)cc1	920989601	JXHUNDDUZPAHCD-CYBMUJFWSA-N	436.432	1.324	50	20	IDGD	
CO[C@@H](CNC(=O)NNC(=O)c1sc(N2CCOCC2)nc1C)c1ccc(F)cc1	1319008199	WOISASJWLXJPAD-HNNXBMFYSA-N	437.497	1.759	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)N[C@@H]1CCO[C@]2(CCSC2)C1	1319345116	TUSSNDDZPXLYDV-FZKQIMNGSA-N	441.579	1.287	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)Cn2ccc3ccccc3c2=O)CC1	1321160076	WWAIAWDCTDCHQK-UHFFFAOYSA-N	428.489	1.796	50	20	IDGD	
CNC(=O)c1cccc(NC(=O)NNC(=O)c2n[nH]c3c2CCCC3)c1Br	1323592448	FYVAKMGREORDPO-UHFFFAOYSA-N	435.282	1.877	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)c1cc(Br)c(C=O)n1C	1324304595	JMBSYODHJSKFIB-UHFFFAOYSA-N	429.296	1.607	50	20	IDGD	
COc1ccc(S(=O)(=O)NCCC(=O)NNc2ccc(C(C)(C)C)nn2)cc1OC	1328715608	WGSCIJUPTXJGDG-UHFFFAOYSA-N	437.522	1.603	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@@H](C(=O)NNc2cncc(Br)c2)[C@@H](C)O)cc1	1341980606	SFJXEERWIWUNDR-IAQYHMDHSA-N	443.323	1.324	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cn3ccccc3n2)C1	1778478581	NWTIVDAVVHUUDN-LUQKVYGDSA-N	434.924	1.716	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(CCN(C(=O)COc3cc(Cl)ccn3)C2)C1	1779229838	LJQKIALGKCPJSZ-IBGZPJMESA-N	441.988	1.795	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)Cc2ccc3ncnn3c2)C1	1780550887	WEWSDEKQXUUAOV-CBGDNZLLSA-N	433.940	1.803	50	20	IDGD	
Cc1ccn2c(C(=O)N3CCO[C@]4(CCN(C(=O)[C@@H](F)Br)C4)C3)cnc2c1	1781331951	BNZVUCHWDBIPLV-QAPCUYQASA-N	439.285	1.777	50	20	IDGD	
CC[C@H](CC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2)NC(=O)OC(C)(C)C	1781358878	ATCZFGMDQFBGAC-QEEYODRMSA-N	447.960	1.109	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CSc1nc[nH]n1)C2	1782002071	LXURMLIXSFCIHH-HWWQOWPSSA-N	446.371	1.194	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(C)ccc3-n3ccnn3)C2)C1	1782169606	VFVMUJQTNYIWMJ-UWJYYQICSA-N	447.923	1.273	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc3n[nH]cc3c1)C2	1782172730	MAKPVSIXCHRSMJ-HGHGUNKESA-N	434.924	1.944	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(C(N)=O)cc1)C2	1782177766	CAYGMKVBYMRJEV-CBGDNZLLSA-N	437.924	1.167	50	20	IDGD	
COc1cccc2c1C[C@H](C(=O)N1CC[C@]3(CN(C(=O)[C@@H](O)CCl)CCO3)C1)CC2	1782986383	ZDGDKCBISZAOFT-TVTNDZMWSA-N	436.936	1.230	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cccn4ccnc34)CCO2)C1	1783349221	KCADEYGJYJXISA-DNVCBOLYSA-N	435.322	1.951	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)C[C@H]3CNc4ccccc4O3)CCO2)C1	1783877836	RCURDGKUVVDOKC-QYWGDWMGSA-N	437.924	1.333	50	20	IDGD	
CN(C)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C[C@@H]21	1786720880	LSKQXBRIHHSZEM-VWZYDEGLSA-N	446.498	1.803	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3nc4ccccn4n3)[C@H]2C1	1787262618	KHZBLHSFIGVEQM-JYJNAYRXSA-N	431.569	1.174	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc(-c4ccccn4)nc3)C[C@@H]21)[C@@H](F)Cl	1787443727	BJAZPLJTFCSOGU-ZFZWDLNGSA-N	433.871	1.666	50	20	IDGD	
Cc1oc2cc(O)ccc2c1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21	1787970218	YXYCSUQFRXLUDN-PTOXDTDZSA-N	436.892	1.640	50	20	IDGD	
COC[C@H](Cl)C(=O)NC1(c2ccc(NC(=O)[C@H](O)N3CCOCC3)cc2)CCC1	1789557122	PWTHQTTXBSPYQY-LPHOPBHVSA-N	425.913	1.025	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4cnccc4n3)C[C@@H]21	1791254301	NPQNYLMAHTZQAC-GGXPGOJBSA-N	432.908	1.477	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc(F)cc3F)C[C@@H]21	1791257359	BPTIUOIPKZCDMV-SCNOPHJPSA-N	430.879	1.741	50	20	IDGD	
Cc1cnn([C@@H](C)C(=O)Nc2ccc(C3(NC(=O)c4ccc(B(O)O)cc4)CCC3)cc2)c1	1791844316	VMXZQWWQIIBCMI-KRWDZBQOSA-N	446.316	1.880	50	20	IDGD	
CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(C)(C)CCl)C(=O)c1ccccc1	1792783280	SCAIBYKWWDCFQH-IZZQQSIFSA-N	435.952	1.613	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCl)C1CC1	1793110692	UATCEDRRIAYYNE-QRJUGERDSA-N	429.945	1.528	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)C(C)C	1793231182	BUVBZPMNILJBKX-NXEZDXNNSA-N	433.461	1.789	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C\c1c[nH]c2ccccc12)c1ccc(B(O)O)cc1	1794229962	LCJCJNBVPLQZDH-BMIDJGPBSA-N	443.312	1.813	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnnc3ccccc13)C2	1795114534	SJTFDIJNTDSDBJ-IVWMJMPLSA-N	433.306	1.618	50	20	IDGD	
O=C(Cc1cc(F)cc(F)c1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2	1795841391	ADBTYTFZTDRMOS-IVWMJMPLSA-N	431.277	1.882	50	20	IDGD	
Cc1cc2cccc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3ccc(B(O)O)cc3)c2[nH]1	1796189082	UHLDNZDPHSMDEE-ACDBMABISA-N	431.301	1.722	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(Cl)cn1)C2	1798439760	CLMBBHFJAQBOEC-BTTYYORXSA-N	428.880	1.299	50	20	IDGD	
C[C@@H](Cc1ccccn1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnccc1C(=O)NN	1798443707	YJUZENLRQVAKLG-OWLYRPNTSA-N	436.516	1.211	50	20	IDGD	
Cc1cc(C(=O)NCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](F)Br)C3)no1	1798509398	GUYXQCQTNJADQQ-FBKDDSFISA-N	431.262	1.042	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cc(F)ccc1F)C2)[C@H](F)Br	1799350564	XJBMGHCWSFIDLH-OJXGSEEGSA-N	435.240	1.787	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(-n2cncn2)c1	1799774917	FPOFYEUZCPEOTQ-XEMDLRDOSA-N	443.580	1.322	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnn2c1CCC2	1799965747	SRSNFZPEAXWHGT-FAXLKDOZSA-N	425.327	1.206	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COc1ccc(F)cc1)C2	1800639492	ZWYKIPONOSSRHG-ZDFLXESQSA-N	443.313	1.968	50	20	IDGD	
CO[C@H](C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](Br)Cc1ccccc1)C2	1801043438	RIBNUOVUUHLBRF-SOVHRIKKSA-N	439.350	1.617	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](N)CCC(N)=O)C2	1801436980	BLMWJDXSBRSNIO-ZPLALWFASA-N	445.470	1.103	50	20	IDGD	
CC[C@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)COc1ccc(O)nn1)C2	1801805524	AAKVGDNZEDOGIB-RNJOBUHISA-N	427.299	1.373	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1CCc2ccccc2C1)c1cccc(B(O)O)c1	1801840625	PQFCCBVUFSULSC-SNJCGAMXSA-N	432.329	1.423	50	20	IDGD	
Cc1cccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)c1Cl	1803619642	SGVITPATNHAEFF-BCDXTJNWSA-N	426.709	1.894	50	20	IDGD	
C[C@]1(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)CC=CCC1	1807368690	XCANPKAYKUFCMY-XTJBDQBJSA-N	447.344	1.827	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)[C@@H](C)N2CCN(C)CC2)[C@H]1c1cccnc1	1807873848	BSBCQNVUVLHRGH-RSPOEFSDSA-N	436.000	1.741	50	20	IDGD	
CN[C@H](CC(=O)N1CCCC2(CCN(C(=O)[C@@H](C)CBr)CC2)C1)C(=O)O	1809829312	MJQXPWGWZRMLGW-UONOGXRCSA-N	432.359	1.311	50	20	IDGD	
CC[S@](=O)CCC(=O)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@@H]1c1cccnc1	1810122848	HLSBSTYLEXXMIS-ANXQPQAYSA-N	448.358	1.937	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)N1CC[C@H](CNC(=O)CO[Si](C)(C)C)[C@@H]1c1cccnc1	1810545644	BWNNURIGJVHBBO-MDYRTPRTSA-N	432.597	1.630	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)[C@H](C)CC(N)=O)[C@@H]1c1cccnc1	1812865423	OTPFNFLYQVENKV-TWJWRFFLSA-N	425.327	1.382	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCSC)[C@H]1c1cccnc1	1813032442	BISUDBISSDEXOS-NXOAAHMSSA-N	429.970	1.455	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)C[C@](C)(O)CC(=O)O)[C@H]1c1cccnc1	1813067415	GWZRNWXCBOXFIP-SLGAXEFGSA-N	425.913	1.721	50	20	IDGD	
O=C1Cc2cc(C(=O)N3CCCC[C@H]3c3cc(NC(=O)[C@@H](O)CCl)n[nH]3)ccc2N1	1814873679	SZVPHUDHXZUGQP-HOTGVXAUSA-N	431.880	1.810	50	20	IDGD	
CCC[C@@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(=O)n3[nH]nnc3n2)[nH]n1	1815318944	QGQKWQZEEJAAGX-MFKMUULPSA-N	447.887	1.249	50	20	IDGD	
Cc1cccnc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1815396468	HIRJJTRHNKCZPX-GOSISDBHSA-N	433.277	1.413	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)ccc1O	1817477128	MSJLVFSWPWGMTL-IBGZPJMESA-N	448.288	1.723	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@@H](F)Cl)[nH]n1)c1n[nH]c2c1CS(=O)(=O)C2	1817684037	WUNPLHZXIUWNFR-BXUZGUMPSA-N	444.876	1.402	50	20	IDGD	
CNC(=S)NCCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](Cl)COC)[nH]n1	1819408541	AHUSFEAOCKPPDC-AAEUAGOBSA-N	430.962	1.140	50	20	IDGD	
CN(CC(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@](C)(Cl)CCl)[nH]n1)C(=O)C(=O)O	1821716073	XECNVSPSEQWXLW-DIFFPNOSSA-N	448.307	1.181	50	20	IDGD	
COCCn1ccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)[C@H](Cl)COC)n[nH]2)n1	1822370237	SOHBOTYNWUQDJO-CZUORRHYSA-N	438.916	1.812	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2CCCCO2)CC1	1823818738	NIEUYLKXECYRSX-PMACEKPBSA-N	443.548	1.488	50	20	IDGD	
O=C(Cn1cc([N+](=O)[O-])cn1)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)CC1	1824179418	RLITUYLCGMBACD-HOTGVXAUSA-N	427.889	1.011	50	20	IDGD	
O=C([C@H](O)CCl)N1CCC([C@H]2CCCCN2C(=O)[C@H]2ON=C(c3ccccc3)O2)CC1	1828816291	FYOMKLULDNTKAA-JBYIUTFZSA-N	449.935	1.941	50	20	IDGD	
Cc1ocnc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1	1828924431	SOVHRAUQWDMEED-GOSISDBHSA-N	440.504	1.529	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CSc3ncccn3)C2)C1	1831646552	MMULEGYTPIKEMR-KXBFYZLASA-N	442.969	1.433	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2C[C@H]3CC[C@@H]2O3)CC1	1831681064	UAZOTNJRVCJRPM-CZYKHXBRSA-N	440.349	1.167	50	20	IDGD	
O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)C[C@@H]1CCCCO1)CCO2	1832340990	PJBSMHMKNIAYFY-MAUKXSAKSA-N	433.343	1.187	50	20	IDGD	
Cc1cccc(/C=C/C(=O)NC2CCN(C3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)n1	1833063890	WCBQDFAWIUMVFB-XJDXJNMNSA-N	434.968	1.575	50	20	IDGD	
C=CCCC(C)(C)C(=O)NC1CCN(C2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1	1833079063	JXIYFMAGPRYQGF-UHFFFAOYSA-N	449.640	1.923	50	20	IDGD	
C[C@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)[C@H]3C[C@@H](O)C3)CC2)CC1	1833262974	DDSYYWZCJVTREZ-CPUCHLNUSA-N	430.387	1.360	50	20	IDGD	
Cc1cncc(CCC(=O)N2CCC(N3CCC(NC(=O)[C@@H](O)CCl)CC3)CC2)c1	1833308302	QOCHXPOJZNRXAY-FQEVSTJZSA-N	436.984	1.494	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3cncn3C)CC2)CC1	1834246467	WUNQLSVQKWJNTN-MRXNPFEDSA-N	440.386	1.779	50	20	IDGD	
CCc1nc(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](Cl)COC)CC3)CC2)co1	1835987272	PHCMCDDYVKXHKZ-INIZCTEOSA-N	426.945	1.676	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC(OC2CCN(C(=O)c3ncn(C)n3)CC2)CC1	1836670272	NAYSLGJHHYCEEH-CYBMUJFWSA-N	442.358	1.458	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)/C=C/c3ccccc3N)C2)C1	1837711745	OTSSPYJOPDGTPR-HYGBKTPJSA-N	447.608	1.590	50	20	IDGD	
N#Cc1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)c1	1838907938	XDJONTJMCNHMHQ-YJBOKZPZSA-N	440.269	1.319	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3coc([Si](C)(C)C)c3)C2)C1	1839145618	NNECOKQGLBRAQJ-OXQOHEQNSA-N	443.016	1.912	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(Cl)c(O)cc3O)C2)C1	1839147272	LYKAHJYFIODARK-BFUOFWGJSA-N	447.315	1.839	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C=C/c3ccoc3)C2)C1	1839150266	HHUNZXKDIUPCPX-WTJLDUFHSA-N	431.316	1.986	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)C#Cc3ccccc3)C2)C1	1839151406	QNFDCTKDHJRGCQ-RTWAWAEBSA-N	439.339	1.731	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(F)c3Cl)CCO2)C1	1839324603	PVKNJDXLISFPSO-AUUYWEPGSA-N	449.306	1.803	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H]3[C@@H]4C=CS[C@@H]34)CCO2)C1	1839699814	VSHVVGBHCLSEIB-AJRPESIASA-N	435.373	1.554	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(C)c(F)c3F)C2)C1	1840156869	WWZXISPRVDYFRH-YWZLYKJASA-N	446.878	1.597	50	20	IDGD	
O=C(c1ccc2c(c1)OCCO2)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840187670	PKSSYJSJZRKARK-LJQANCHMSA-N	445.299	1.332	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3cnc(C)s3)CCO2)C1	1840398145	PSPZPVMEXNESGE-LPHOPBHVSA-N	429.970	1.858	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H]2CC[C@@H](C2)[C@H]1C(=O)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1	1841353598	GQFLKWSQWHZSOZ-VGWMRTNUSA-N	441.956	1.578	50	20	IDGD	
Cc1ccc2cc(C(=O)N3CC4(CCCN4C(=O)c4cccc(B(O)O)c4)C3)ccc2n1	1843014060	SXUZXSQNTMEPPP-UHFFFAOYSA-N	429.285	1.354	50	20	IDGD	
C[C@H](Cc1ccc(F)cc1)C(=O)N1CC2(CCCN2C(=O)c2cnccc2C(=O)NN)C1	1844264940	AGOXTCWYNVWWTM-OAHLLOKOSA-N	439.491	1.520	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@H]1COCCN1C(=O)OC(C)(C)C)C2	1845164508	IOMVLVJHUUACAK-CABCVRRESA-N	429.945	1.843	50	20	IDGD	
Cc1cc(C(N)=O)cc(C)c1C(=O)N1CC2(CCCN2C(=O)[C@@H](F)Br)C1	1845217984	GQPSLSYFRZKQJY-CQSZACIVSA-N	426.286	1.910	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCCC12CN(C(=O)c1cc(CO)on1)C2	1845871553	OOPHMDJXRKNUEO-MKMNVTDBSA-N	428.395	1.869	50	20	IDGD	
C[C@H]1[C@@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](O)CCl)CCN1C(=O)OC(C)(C)C	1847568696	ISZDZFIUMHVTAR-UVPYHEFZSA-N	429.945	1.433	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](O)CCl)C[C@H]2C[C@H]21	1847568711	JESFOQQMYHZWSY-IAODNVIUSA-N	427.929	1.186	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)CCc2ccc(C#N)cc2)c1	10753805	DXCJTTIKGXPPPL-UHFFFAOYSA-N	428.514	1.983	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1cnc2c(c1)c(C)nn2C	24149097	CJCQCLSEMICQRQ-UHFFFAOYSA-N	431.836	1.557	50	20	IDGD	
Cc1nc2c(cnn2C(C)C)cc1C(=O)NNC(=O)c1sc(N2CCOCC2)nc1C	28643492	CEZGXTLNJARXFF-UHFFFAOYSA-N	443.533	1.997	50	20	IDGD	
Cc1ccc(N2C(=O)/C(=C\NNC(=O)[C@H]3CCS(=O)(=O)C3)c3ccccc3C2=O)cc1	28807384	ZYGKZMXAAZNOCD-CCRNYGKSSA-N	439.493	1.578	50	20	IDGD	
O=C(NNC(=O)c1ccc(F)c(S(=O)(=O)N2CCCC2)c1)c1ccc2c(c1)OCCO2	105931501	NAGHLKUBSFETRD-UHFFFAOYSA-N	449.460	1.456	50	20	IDGD	
COc1ccc(S(=O)(=O)NCCC(=O)Oc2ccc([N+](=O)[O-])cc2OC)cc1OC	725736336	MTCZGHPKBIDVFI-UHFFFAOYSA-N	440.430	1.895	50	20	IDGD	
CC(C)[C@@H](NC(=O)NCc1ccccc1)C(=O)NNC(=O)CNC(=O)c1cccs1	725741861	UUGODMBRCJJKEW-QGZVFWFLSA-N	431.518	1.149	50	20	IDGD	
O=C(CNC(=O)NNC(=O)c1cc(Br)c[nH]1)Nc1cccc2cccnc12	725859418	CJMPNLZFXONESZ-UHFFFAOYSA-N	431.250	1.908	50	20	IDGD	
CC1CCN(c2ccc(CNC(=O)NNC(=O)CNC(=O)c3cccs3)cn2)CC1	725873845	SMZZVYKSBUGOJH-UHFFFAOYSA-N	430.534	1.640	50	20	IDGD	
CN(C)C(=O)COc1ccccc1C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	728210059	PUQFTIRMCBSNSP-UHFFFAOYSA-N	432.502	1.351	50	20	IDGD	
O=C(COC(=O)c1ccn(-c2ccc(F)cc2)n1)NNC(=O)[C@@H]1COc2ccccc2O1	728326514	ZGUMKEBNFYIXLU-SFHVURJKSA-N	440.387	1.156	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNS(=O)(=O)c2cnc3onc(C)c3c2)c1	728508303	MNTAGDMIBGFQFF-UHFFFAOYSA-N	441.263	1.926	50	20	IDGD	
Cc1cc([N+](=O)[O-])c(S(=O)(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1C	728854136	MYRWXZNUEARYSL-UHFFFAOYSA-N	434.478	1.228	50	20	IDGD	
CC[C@@H](C)NC(=O)CN1CCN(C(=O)NNC(=O)c2cc3c(s2)CC[C@@H](C)C3)CC1	728944631	IADXJPAQQGXGEW-HUUCEWRRSA-N	435.594	1.760	50	20	IDGD	
O=C(NNC(=O)[C@H]1CSCN1C(=O)c1ccc(Cl)cc1)[C@@H]1COc2ccccc2O1	729166934	AXRKAXPSQFOTQI-PBHICJAKSA-N	447.900	1.843	50	20	IDGD	
COc1cccc(/C=C(\C#N)C(=O)O[C@H](C)C(=O)Nc2cccc(S(N)(=O)=O)c2)c1	729272097	RHYNJQGQAROXTM-GULXKOIASA-N	429.454	1.820	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)Cn1ccc2ccccc21)c1ccc(S(=O)(=O)N(C)C)cc1	729597105	SBIQUUUEEYCMIR-HNNXBMFYSA-N	443.529	1.983	50	20	IDGD	
CC(=O)Nc1ccc(NS(C)(=O)=O)c(C(=O)NNC(=O)c2cccc3cccnc23)c1	731435817	LQDMSYKRQDGKMD-UHFFFAOYSA-N	441.469	1.640	50	20	IDGD	
Cc1nc(CN2CCC(CNC(=O)NNC(=O)CNC(=O)c3cccs3)CC2)oc1C	732475891	OCXAVQBLTRUMIX-UHFFFAOYSA-N	448.549	1.325	50	20	IDGD	
O=C(NNC(=O)c1ccc(Oc2ccc(F)c(F)c2)cc1)N[C@H]1CCS(=O)(=O)C1	732755252	REUYIRXHSUXSJC-LBPRGKRZSA-N	425.413	1.888	50	20	IDGD	
O=C(CNC(=O)c1ccccc1OC(F)F)NNC(=O)c1cnn(-c2ccccc2)c1	733364665	PROUBXUSDRIMNH-UHFFFAOYSA-N	429.383	1.665	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)NCc1ccnc(OC2CCOCC2)c1	733653150	INSPHFZEKQKBJU-UHFFFAOYSA-N	425.445	1.420	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)N[C@@H]2CCC[C@H](C(=O)N(C)C)C2)nc1	734223125	YFENSWVWNGHIJE-UONOGXRCSA-N	426.543	1.041	50	20	IDGD	
CC(C)n1ccc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)n1	739052544	TYCXWONSTPUJFX-UHFFFAOYSA-N	434.522	1.393	50	20	IDGD	
C[C@@H]1C[C@@H](C)CN(S(=O)(=O)c2cccc(C(=O)NNc3ccnc(N(C)C)n3)c2)C1	740112368	FVRPQHSKKGWHLN-HUUCEWRRSA-N	432.550	1.966	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)CCS(=O)(=O)c1ccc(OC)c(OC)c1	740781600	GEBPYXZVTOZHKB-UHFFFAOYSA-N	436.486	1.266	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NCc2nc(C(F)(F)F)cs2)c2ccccc2c1=O	741089785	JDBFRQPYBPLVOL-UHFFFAOYSA-N	426.380	1.553	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)c1n[nH]c2ccc(I)cc12	742697826	JYMHVYPWAPMVPP-UHFFFAOYSA-N	443.245	1.233	50	20	IDGD	
C#CCNS(=O)(=O)c1cccc(C(=O)NNC(=O)c2cccc(Br)c2)c1	742771851	FIHCYIPZQTXCPO-UHFFFAOYSA-N	436.287	1.435	50	20	IDGD	
CC(C)c1ccc(-n2cc(O)c(C(=O)NNC(=O)CCN3C[C@@H](C)O[C@H](C)C3)n2)cc1	743292062	WHOOFWLCHSYDGE-HZPDHXFCSA-N	429.521	1.962	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)N[C@@H]1CC(=O)N([C@@H]2C[C@@H]2c2ccccc2)C1	743508314	NKWMFCFMYKAYKW-KZNAEPCWSA-N	432.484	1.744	50	20	IDGD	
COc1ccc(OC)c(CCNC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)c1	743612695	LBMSQONMHFDIRT-UHFFFAOYSA-N	436.490	1.686	50	20	IDGD	
O=C(NCC(F)(F)F)NNC(=O)[C@H]1CCCN(C(=O)N2CCc3sccc3C2)C1	743822299	BNEGTZXSOPHEME-LBPRGKRZSA-N	433.456	1.831	50	20	IDGD	
Cc1nc2ccc(C(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)cc2nc1C	743836750	BEXOLBIJLGYYSP-UHFFFAOYSA-N	427.486	1.572	50	20	IDGD	
COc1ccc2c(c1)OCC[C@@H]2NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	745861028	HOIAGSIQYGTHAA-KRWDZBQOSA-N	448.501	1.413	50	20	IDGD	
CC(C)CN1CCC[C@H](CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)C1	746328677	QBXHTRGMXLHTIV-MRXNPFEDSA-N	439.582	1.249	50	20	IDGD	
COc1cc2c(cc1CNC(=O)NNC(=O)c1nn(C)c(=O)c3ccccc13)O[C@H](C)C2	746348393	XNCKONBTASMOFR-GFCCVEGCSA-N	437.456	1.410	50	20	IDGD	
CC(=NNC(=O)C(=O)NN=C(C)c1ccc([S@@](C)=O)cc1)c1ccc([S@@](C)=O)cc1	746365698	AWBBRAJYYTXZQN-LOYHVIPDSA-N	446.554	1.542	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNS(=O)(=O)c2ccc(-n3cnnn3)cc2)cc1	747410062	OHAMHYJMHZBZPX-UHFFFAOYSA-N	430.490	1.711	50	20	IDGD	
COC(=O)c1ccc(S(=O)(=O)NNC(=O)c2ccc(Cl)cc2F)c([N+](=O)[O-])c1	747617682	IUBZHIOXXHKKQQ-UHFFFAOYSA-N	431.785	1.797	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCC(=O)NNc2ccc([N+](=O)[O-])cc2)cc1OCC	747981210	FYUWITIWFQEEAC-UHFFFAOYSA-N	438.462	1.814	50	20	IDGD	
NC(=O)[C@H]1CN(C(=O)C(=O)Nc2ccccc2S[C@@H](Cl)C(F)(F)F)CCO1	748001594	MOQUFHHSZUWTSX-YMTOWFKASA-N	425.816	1.557	50	20	IDGD	
CS(=O)(=O)CC[C@@H](NC(=O)c1ccccc1Cl)C(=O)NNc1cccc(C#N)c1	748029610	KJIIWJOWJRFXCN-QGZVFWFLSA-N	434.905	1.888	50	20	IDGD	
Cc1ccc(N2C(=O)C[C@H](C(=O)NNC(=O)C(=O)N3CCCC3)[C@@H]2c2cccs2)cc1	748246592	CXQKLMVSNMDPPH-QFBILLFUSA-N	440.525	1.921	50	20	IDGD	
CC(C)[C@@H](C(=O)NNC(=O)c1ccc(CSc2nncn2C)cc1)N1CCCC1=O	748555436	FRRLZIMSNJNYBX-KRWDZBQOSA-N	430.534	1.515	50	20	IDGD	
O=C(O)c1ccc(O)c(S(=O)(=O)NNC(=O)c2ccc(COc3ccccc3)o2)c1	748674418	SXWWXMVFWLLNOK-UHFFFAOYSA-N	432.410	1.886	50	20	IDGD	
CS(=O)(=O)c1cc(C(=O)NNC(=O)c2ccc(Cl)nc2)ccc1Br	749170210	AHDUEGYWUNHMNF-UHFFFAOYSA-N	432.683	1.976	50	20	IDGD	
O=C(NNC(=O)c1cc2ccccc2o1)c1ccc2c(c1)S(=O)(=O)N(C1CC1)C2=O	749476980	GFVYPPICEUHDAB-UHFFFAOYSA-N	425.422	1.815	50	20	IDGD	
CO[C@@H](C)c1noc(CN2CCCN(CC(=O)NNC(=O)c3ccc(C)cc3)CC2)n1	750059239	FBWHEGICZNLPSN-INIZCTEOSA-N	430.509	1.054	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)N[C@@H]2CCC[C@H]([S@](=O)CC)C2)nc1	750670880	OVMLULCXBADCKQ-COEMCCDRSA-N	445.611	1.818	50	20	IDGD	
Cn1nncc1C=NNC(=O)CN(Cc1ccccc1)S(=O)(=O)c1ccc(Cl)cc1	751130538	ZINRURDVTAZJAJ-UHFFFAOYSA-N	446.920	1.810	50	20	IDGD	
O=C(NCc1c(F)cccc1OC(F)F)NNC(=O)c1csc(N2CCOCC2)n1	751998750	AHQPTTVJNPTVRM-UHFFFAOYSA-N	445.423	1.864	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCc2ccc(F)c(F)c2F)c1	753280967	DUTRYBPWSQXJMZ-UHFFFAOYSA-N	444.435	1.541	50	20	IDGD	
N#Cc1ccc(CN2CC[C@H](NC(=O)NNC(=O)c3ccc4ccccc4n3)C2=O)cc1	753290416	QMVKCCBWDDMQGM-FQEVSTJZSA-N	428.452	1.852	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NNc2cc(Cl)nc(N)n2)ccc1OC	753458181	WSBCRVSHSUKYRR-UHFFFAOYSA-N	428.902	1.508	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)N[C@H]2CCN(Cc3ccc(C#N)cc3)C2=O)cc1C	753722239	IPWSRYILMGTEQM-IBGZPJMESA-N	448.483	1.245	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)Nc2ccc(S(=O)(=O)N3CCCCCC3)cc2)n1	755434195	KLLSXXNZBYVTBW-UHFFFAOYSA-N	448.549	1.918	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)c2ccc3ccccc3n2)n([C@@H]2CCS(=O)(=O)C2)n1	755535663	QYNCXXBXPGGLPW-CQSZACIVSA-N	428.474	1.566	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1	755953015	XUGFSTOAUSKNFV-CQSZACIVSA-N	445.501	1.422	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Nc2ccccc2OCCC(N)=O)cc(OC)c1OC	756065818	KGBORWRCVIBSQI-UHFFFAOYSA-N	432.433	1.433	50	20	IDGD	
COC(=O)c1cccc(NC(=O)C(=O)NNc2nccnc2Cl)c1Br	756189551	LVHRKMRFAHYBJT-UHFFFAOYSA-N	428.630	1.761	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)Nc1c(C(=O)N2CCOCC2)oc2ccccc12	756287738	VZLDNGZRYCTVOC-ZDUSSCGKSA-N	434.449	1.109	50	20	IDGD	
COC(=O)c1ccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c(F)c1	756403623	QGYLKQRWFSGPSY-UHFFFAOYSA-N	438.437	1.329	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)N[C@@H]1CCN(C(=O)CCc2ccccc2)C1	756917082	NJYGDSHBSSZAAD-GOSISDBHSA-N	434.500	1.820	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(Cl)c(C(=O)NNc2ccc(C(N)=O)nn2)c1	757406420	ABFKMYIZDRQKRZ-UHFFFAOYSA-N	426.886	1.016	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)ccc1Cl	757473207	NIRLABNXFUYUPZ-UHFFFAOYSA-N	439.877	1.692	50	20	IDGD	
Cn1ccnc(NC(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)c1=O	757907207	MOHPHYSZXRCYKC-UHFFFAOYSA-N	445.439	1.005	50	20	IDGD	
CCc1nnc(O)c(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1CC	758149985	BIYSRXANNWHCBX-UHFFFAOYSA-N	447.517	1.166	50	20	IDGD	
CN(NC(=O)c1ccc2c(c1)OCC(=O)N2)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758787737	VJIKENVFLPRMIC-UHFFFAOYSA-N	433.465	1.267	50	20	IDGD	
COc1cc(N2C[C@@H](C(=O)NNc3ncccc3[N+](=O)[O-])CC2=O)cc(OC)c1OC	759298171	URDBNISGSMPNHP-NSHDSACASA-N	431.405	1.512	50	20	IDGD	
CCNS(=O)(=O)c1ccc(CC(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)cc1	759352774	VDPWEDKXKYPHNV-INIZCTEOSA-N	433.530	1.759	50	20	IDGD	
Cc1cc(C)nc(-n2nccc2NC(=O)C(=O)NNC(=O)c2cccc3ncccc23)n1	760278186	UUQQFPXGBQOHEM-UHFFFAOYSA-N	430.428	1.227	50	20	IDGD	
O=C(NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)C1=Cc2cc(F)ccc2OC1	761199234	JGSSKSIPEYAURQ-UHFFFAOYSA-N	445.472	1.847	50	20	IDGD	
COc1cccc(/C=C(\C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)n2nnnc2C)c1	762936662	FCVBBUBGTQGSQR-UDWIEESQSA-N	444.455	1.840	50	20	IDGD	
Cn1ccc([C@H](NC(=O)NNc2nc(O)c3cnn(C)c3n2)c2ccc(Cl)cc2)n1	763165182	QTUMZJNOMVPUDL-CQSZACIVSA-N	427.856	1.872	50	20	IDGD	
O=C(NNC(=O)c1ccccc1Br)C(=O)Nc1ccccc1Cn1cncn1	763483485	UVRQBRXNGOAFOV-UHFFFAOYSA-N	443.261	1.489	50	20	IDGD	
COCCOc1c(Cl)cc(NC(=O)C(=O)NNC(=O)c2cccnc2)cc1Cl	763491202	GNLZGNZXLRTBRA-UHFFFAOYSA-N	427.244	1.813	50	20	IDGD	
O=C(NNC(=O)c1cc2ccccc2cc1O)C(=O)Nc1cccc(N2CCOC2=O)c1	763523642	XJNLSNPJBWQCBQ-UHFFFAOYSA-N	434.408	1.902	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)Nc1ccc(OC[C@@H]2CCCO2)cc1	763569828	CHPJNQFIRUBICG-LPHOPBHVSA-N	441.440	1.170	50	20	IDGD	
COC(=O)c1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)[C@@H]1COc2ccccc2O1	763571296	LWMDXSBEPAQEKL-HNNXBMFYSA-N	433.804	1.053	50	20	IDGD	
CC(C)N(C)S(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2F)cc1	763575037	PIESLDXHZCNEQJ-UHFFFAOYSA-N	436.465	1.254	50	20	IDGD	
CCn1nnnc1-c1cccc(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)c1	763686397	LRCZRVLTSDGTMO-UHFFFAOYSA-N	443.851	1.178	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccccc1CN1CCOCC1	763713882	QJRXUTGPAAEIFA-UHFFFAOYSA-N	440.500	1.246	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H]2C[C@@]23CCOC3)c1	763727302	BVCBBDQECSUNMA-IIBYNOLFSA-N	445.497	1.684	50	20	IDGD	
NC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccco3)nc3ccccc23)n1	763763847	MGLHMKDRXICVBN-UHFFFAOYSA-N	444.407	1.388	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(N3CCO[C@@H](C)C3)cc2)cc1	763812688	VGHUJAJRAYZVGC-INIZCTEOSA-N	426.473	1.385	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)OCCO3)cc1	763859866	GMMJZFSEMJQODJ-CYBMUJFWSA-N	429.429	1.410	50	20	IDGD	
CNC(=O)c1cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)ccc1Cl	763863678	AUDDIDPGSJUCEE-JTQLQIEISA-N	436.827	1.392	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccccc1Cn1cncn1	763864858	LHNZFKDCVRHGMI-ZDUSSCGKSA-N	426.408	1.019	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(OC)c([N+](=O)[O-])c2)ccc1OC(C)C	763921786	OQBRYXBAHRNPSO-UHFFFAOYSA-N	446.416	1.799	50	20	IDGD	
NC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ccc(Br)s2)ccc1Cl	763940429	QUNJXMPFCGQKLW-UHFFFAOYSA-N	445.682	1.663	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1ccc(S(C)(=O)=O)cc1C	764012312	PLNHYEXQTUXPJU-UHFFFAOYSA-N	439.877	1.460	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc(C)cc1OC[C@H]1CCCO1	764047593	IOUCGQSINXCBLK-OAHLLOKOSA-N	427.457	1.961	50	20	IDGD	
CCOC(=O)[C@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)CC(C)(C)C)cc1F	764197503	AZBWBEOZHZNICX-NSHDSACASA-N	438.456	1.029	50	20	IDGD	
CO[C@H](C)C(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)CCCc2ccccc2)c1	764224377	PKURVYUUBHTILS-OAHLLOKOSA-N	426.473	1.769	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)C(=O)Nc1cccc(Br)c1	764259861	KQQBGQGEVAHTGK-UHFFFAOYSA-N	447.293	1.242	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)C(=O)Nc1ccc(N2CCOCC2)c(F)c1	764287860	BHLFXXLKKJLSSZ-UHFFFAOYSA-N	430.436	1.087	50	20	IDGD	
CCOCC(=O)NNC(=O)C(=O)Nc1ccc(N2C[C@H](C)O[C@H](C)C2)c(C(F)(F)F)c1	764325307	IRSFFMJPEQGECC-TXEJJXNPSA-N	446.426	1.441	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccnn2CC2CC2)cc1Br	764326770	NTSNBSVMCHJSQO-UHFFFAOYSA-N	436.266	1.464	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)ccc1C(=O)N(C)C	764342686	IKJSHBNRQRZYPT-UHFFFAOYSA-N	434.456	1.282	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)c(Cl)c1)C(=O)Nc1ccc(CN2C(=O)CCC2=O)cc1	764349379	LWPOFTJJCGDXDD-UHFFFAOYSA-N	444.831	1.094	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(Br)cc1C(C)C	764399900	NIGVXFGLMLYMMQ-NSHDSACASA-N	430.299	1.710	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)C[C@@H]1CN(C(=O)OC(C)(C)C)CCO1	764547317	KZAYRGMMKPIKCH-OAHLLOKOSA-N	445.520	1.772	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ccccn2)cc(Br)c1F	764662926	MTSNPMLVVUSOBB-UHFFFAOYSA-N	439.197	1.170	50	20	IDGD	
Cc1nc(-c2ccc(S(=O)(=O)NNC(=O)CNC(=O)c3ccco3)s2)cs1	765073973	AVGNJCLQUOTZKY-UHFFFAOYSA-N	426.501	1.513	50	20	IDGD	
Cc1onc(-c2ccncc2)c1C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	765730805	XOABKIIALIOQLS-UHFFFAOYSA-N	443.485	1.823	50	20	IDGD	
C[C@H](Cc1ccccc1F)C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765739578	YQQGCINEOMZNPK-QGZVFWFLSA-N	426.492	1.610	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)NCc2cnc(N3CCOCC3)c(F)c2)cc1C	765890478	GUSQQWMZZDYGHR-UHFFFAOYSA-N	444.467	1.143	50	20	IDGD	
O=C(NNC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1)C(=O)Nc1cncnc1	768237793	NZIUWGHEVCYIGH-UHFFFAOYSA-N	428.412	1.124	50	20	IDGD	
Cc1ccc2c(c1)C(=O)N([C@H](C)C(=O)NNc1nc(O)c3cnn(C(C)(C)C)c3n1)C2=O	770966429	LHVHKPKLOYAYCD-LLVKDONJSA-N	437.460	1.723	50	20	IDGD	
O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772188306	KJSAKBLGYCWEKN-UHFFFAOYSA-N	429.820	1.667	50	20	IDGD	
O=C(CNC(=O)c1cc2ccccc2[nH]1)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772188884	ZLMXHKNJBOSJMO-UHFFFAOYSA-N	427.848	1.015	50	20	IDGD	
CC(C)=CC(=O)NCc1ccc(C(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)cc1	772195436	MHKHKCHJRAKIAO-UHFFFAOYSA-N	442.903	2.000	50	20	IDGD	
CSc1cc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)ccn1	772602251	LPPSDQAWNCSOAU-UHFFFAOYSA-N	449.558	1.732	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)NCCNS(=O)(=O)c2ccc(C)s2)cc1	772630312	JBMPMWIJWNBPEW-UHFFFAOYSA-N	442.588	1.766	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)CCNS(=O)(=O)c1ccccc1	772953731	NWJQEGAWDABHIO-CYBMUJFWSA-N	425.894	1.623	50	20	IDGD	
Cc1ccc(-n2nccc2NC(=O)C(=O)NNC(=O)c2cccc(C(F)(F)F)c2)nn1	773499915	OSAXGJQHHUWLRZ-UHFFFAOYSA-N	433.350	1.389	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2cc(C)nn2-c2ccc(C(F)(F)F)cn2)n1	773723933	HZQQUJMMMIPOSL-UHFFFAOYSA-N	436.354	1.475	50	20	IDGD	
COc1ccc(Cn2ccc(NC(=O)C(=O)NNC(=O)COc3ccc(F)cc3)n2)cc1	778707417	MKQKDBOWDIXTON-UHFFFAOYSA-N	441.419	1.244	50	20	IDGD	
C[C@@H](O)[C@H](NC(=O)C1CC1)C(=O)NNC(=O)c1ccc(COc2ccc(Cl)cc2)cc1	779490595	CBZPTPPJJXEBDF-YJYMSZOUSA-N	445.903	1.956	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)N[C@H]1CCC[C@H]1CCO	779710383	FPJCSLSANBDCFX-YJBOKZPZSA-N	438.550	1.356	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)[C@@H]1CCCN(C2CCC2)C1	781404182	PNRYSWHTRRSQAR-SJLPKXTDSA-N	429.569	1.676	50	20	IDGD	
CCS(=O)(=O)c1ccc(Br)c(C(=O)NNc2ncnc3[nH]cnc23)c1	782117365	JZVDVNIYKCJJNA-UHFFFAOYSA-N	425.268	1.666	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)COc2ccc(Br)cc2)ccc1F	782121460	ZOXIGUDDSLEPRA-UHFFFAOYSA-N	440.225	1.762	50	20	IDGD	
Cc1cc(N2CCOCC2)ccc1NC(=O)C(=O)NN=c1sc2ccccc2n1C	783351361	CZLYZXTXBDVQAM-UHFFFAOYSA-N	425.514	1.955	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2ccc3nc(Cc4ccccc4)oc3c2)CCS(=O)(=O)C1	783426284	HARNLCLYGCKWFE-OAQYLSRUSA-N	442.497	1.555	50	20	IDGD	
Cc1ccnc(NNC(=O)C(=O)Nc2ccc(S(=O)(=O)N3C[C@H](C)O[C@@H](C)C3)cc2)c1	783934129	MVIDVPKAOCGOTG-GJZGRUSLSA-N	447.517	1.270	50	20	IDGD	
C[C@H](C1CC1)n1cc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)cn1	784218502	VNVKSBJYXNKKOY-GFCCVEGCSA-N	432.506	1.377	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@](C)(CNC(=O)NNC(=O)CNC(=O)c2ccco2)C1	784263895	SLAGGYHTHLQWQD-FQEVSTJZSA-N	437.497	1.377	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)F)cc1)C(=O)Nc1cccc(-n2cccn2)c1	784835581	CSQQQMLVQMFXAW-UHFFFAOYSA-N	435.412	1.950	50	20	IDGD	
CCOC(=O)/C=C/c1ccc(NC(=O)C(=O)NNc2cccc(S(C)(=O)=O)c2)cc1	784839303	JFWMIJYXNPEERC-FMIVXFBMSA-N	431.470	1.748	50	20	IDGD	
COC(=O)c1cc(N2CCOCC2)ccc1NC(=O)C(=O)NNc1cccnc1Cl	784849028	RLYXFDWWTMTRHI-UHFFFAOYSA-N	433.852	1.440	50	20	IDGD	
O=C(NNc1cc(Cl)ccn1)C(=O)Nc1ccc(F)c(N2CCCS2(=O)=O)c1	784861544	MLLORIPLGIAVGH-UHFFFAOYSA-N	427.845	1.496	50	20	IDGD	
CCNC(=O)N(C)NC(=O)C(=O)Nc1ccc(OCC(=O)N(CC)CC)c(Cl)c1	784915809	OTLPFYQPFXDTQR-UHFFFAOYSA-N	427.889	1.218	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)C(=O)Nc1cccc(Oc2ccccn2)c1	785060450	IASXSLXTNRSHID-UHFFFAOYSA-N	430.424	1.850	50	20	IDGD	
COc1ccc(COc2cccc(F)c2)cc1NC(=O)C(=O)NNc1nccn(C)c1=O	785086546	RRUBESGHAWLNCQ-UHFFFAOYSA-N	441.419	1.589	50	20	IDGD	
Cc1nnnn1[C@@H](Cc1ccc(F)cc1)C(=O)NNc1nnc(-c2ccccn2)s1	788554878	CQCIQYQNDUQJKH-HNNXBMFYSA-N	425.453	1.961	50	20	IDGD	
CCOC1CC(CCNC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)C1	788859812	ROONOBSJHZYXBR-UHFFFAOYSA-N	438.550	1.620	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)[C@@H](C)Oc1cccc(Br)c1)c1nnnn1C1CC1	790711727	BJGNPEJSVSTNLX-VHSXEESVSA-N	438.286	1.629	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)[C@@H]1Cc2cc(Br)ccc2O1	792173160	BYZOUWLLOPPMGR-ZDUSSCGKSA-N	443.298	1.608	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)cc(-n2cccn2)c1	792355085	OTJNBHURPGSOCT-ZDUSSCGKSA-N	441.419	1.573	50	20	IDGD	
CC(C)c1ccccc1NC(=S)NNC(=O)[C@H](C)N1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O	792492060	PMNRIVLOGDATKR-PAZMTAOXSA-N	430.530	1.679	50	20	IDGD	
CN(C)N(C(=O)c1csc(CCNC(=O)OC(C)(C)C)n1)[C@@H]1CCS(=O)(=O)C1	792855914	VFNSDXHZRNUMRF-GFCCVEGCSA-N	432.568	1.316	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc3ccn(C)c(=O)c3c2)c1C	793022602	YPHORGNQOUIVQR-HNNXBMFYSA-N	436.468	1.709	50	20	IDGD	
COCCCNC(=S)N(C)NC(=O)[C@@H]1CS[C@]2(c3ccc(F)cc3)CCC(=O)N12	793274196	VAIADSPUJKWSOS-KXBFYZLASA-N	440.566	1.590	50	20	IDGD	
Cn1ccc(CCC(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)n1	794181782	AXINHLHLMCGSQD-UHFFFAOYSA-N	430.468	1.572	50	20	IDGD	
CC(=NNC(=O)CN1CCN(Cc2ccc(C)cc2)CC1)c1ccc2c(c1)OCC(=O)N2	794920569	ONEKGKQHCIOJDM-UHFFFAOYSA-N	435.528	1.984	50	20	IDGD	
CCOC(=O)c1cc(S(=O)(=O)NNC(=O)[C@H]2COc3ccccc3O2)c(F)cc1C	795280793	MUGWKAJOZRBDDY-MRXNPFEDSA-N	438.433	1.460	50	20	IDGD	
CC(C)O[C@@H](C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1)c1ccccc1	796416315	JHRSZKDSCIYGBN-AZUAARDMSA-N	428.441	1.683	50	20	IDGD	
O=C(NCC(F)(F)F)NNC(=O)c1ccc2c(=O)n(Cc3ccco3)c(S)nc2c1	798314720	XYBFAMJFVJHKFU-UHFFFAOYSA-N	441.391	1.833	50	20	IDGD	
CCO[C@H]1C[C@@](NC(=O)OC(C)(C)C)(C(=O)NNC(=O)NCC(F)(F)F)C1(C)C	798315595	LHVZZSIFQHVWED-MGPLVRAMSA-N	426.436	1.978	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)C(=O)Nc2ccc(O[C@H]3CCN(C)C3=O)cc2C)c1	799257852	MCDQMDQQFIKFHS-SFHVURJKSA-N	440.456	1.473	50	20	IDGD	
Cc1c(I)cc([N+](=O)[O-])cc1C(=O)NNC(=O)Cc1cccnc1	800883042	KVOUIQNCBVTHOS-UHFFFAOYSA-N	440.197	1.907	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)[C@]23CCC(=O)N2c2ccccc2C(=O)N3C2CC2)cc1	802054428	OMFFTZDKZUTPJQ-QHCPKHFHSA-N	449.467	1.989	50	20	IDGD	
COC(=O)c1c(F)cc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)cc1F	802567105	IMTCZVDEUJCVDR-UHFFFAOYSA-N	443.309	1.509	50	20	IDGD	
CCc1nnc(NC(=O)[C@H](C)[C@H](C)NC(=O)NNC(=O)COc2cccc(C)c2)s1	804867053	FGWPSQMEEIMUFG-OLZOCXBDSA-N	434.522	1.781	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)N[C@H](C)c1c(F)cncc1F	804867977	QQXGWOUUUYVFEQ-SECBINFHSA-N	426.449	1.667	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)N1CCC[C@H](CN(C)S(C)(=O)=O)C1	805369223	PTBNHMRGVARFGU-ZIAGYGMSSA-N	446.957	1.452	50	20	IDGD	
CCc1nnc(NC(=O)[C@H](C)[C@@H](C)NC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)s1	805880947	SNVZBNXDLJLOPG-GYSYKLTISA-N	448.505	1.234	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1nc2c(s1)CSCC2	806973923	NWUNVZJZTKTQBI-UHFFFAOYSA-N	436.515	1.496	50	20	IDGD	
O=C(Cc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1ccc(F)c(N2CCCNC2=O)c1	806975710	LUQOYBCZUOICSM-UHFFFAOYSA-N	447.854	1.727	50	20	IDGD	
O=C1COC[C@@H](C[C@@H]2CN(C(=O)C(=O)NNc3ccc4ccccc4n3)c3ccccc32)N1	806984703	QGTRJHVQTWNDRP-IAGOWNOFSA-N	445.479	1.713	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C[C@H]2CN(Cc3ccccc3)CCO2)cc1	812729629	SDKMVJJPCCKBRM-IBGZPJMESA-N	432.546	1.671	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)[C@@H]2CC(=O)N(c3ccc4c(c3)CCC4)C2)cc1	812730389	GZYWJRZNUBWUFZ-QGZVFWFLSA-N	442.541	1.922	50	20	IDGD	
Cc1cnc(Br)c(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)c1	812980205	OIRYKLIHKNHSFU-UHFFFAOYSA-N	441.669	1.971	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2cc(C3CCCCC3)nn2C)cc1	813033817	MWHIDTIPCRYILT-UHFFFAOYSA-N	448.549	1.800	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)C2(S(=O)(=O)c3ccccc3)CCOCC2)cc1	813575802	DNQXQTDLVNTWKZ-UHFFFAOYSA-N	433.486	1.871	50	20	IDGD	
Cn1ccnc(NNC(=O)C(=O)Nc2cc(Cl)ccc2I)c1=O	815607759	HXHRYGTZESTLRI-UHFFFAOYSA-N	447.620	1.120	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)[C@H](CS(C)(=O)=O)c2ccccc2)cc1	816817431	BQXOALJOYNFPGQ-DNVCBOLYSA-N	434.514	1.828	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)[C@H](O)[C@@H](O)c1nc2ccccc2s1	825477589	RPVCNMDNWJWHDG-QZTJIDSGSA-N	431.470	1.316	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)c2cnn(C)c2C(F)(F)F)cc1	916102346	CTGUYUSLVVDJLO-UHFFFAOYSA-N	439.423	1.935	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@@H]2COc3ccccc3C2)c1	916199869	LIFLQKCYOSTLLN-CQSZACIVSA-N	432.502	1.132	50	20	IDGD	
Cc1nn([C@@H]2CCS(=O)(=O)C2)c(Cl)c1C=NNC(=O)COc1ccccc1C#N	916322158	ORSITXRQTXPWFM-CQSZACIVSA-N	435.893	1.605	50	20	IDGD	
CN1CCN(Cc2ccc(CNC(=O)NNC(=O)COc3ccc(C#N)cc3)cc2)CC1	916387510	DQRPPHROIAILAC-UHFFFAOYSA-N	436.516	1.215	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCC(=O)N1CCCCC1	916473165	CITTXBWQSHEBKX-LBPRGKRZSA-N	427.299	1.559	50	20	IDGD	
CCOc1ccccc1N1C[C@H](C(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)CC1=O	916562703	SYFNVPQFASHKEZ-MRXNPFEDSA-N	438.484	1.841	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCC(=O)N(Cc2ccccc2)[C@@H]1c1ccccc1)C(=O)NC1CC1	917622175	LORGOBAFDGNCAJ-TZIWHRDSSA-N	434.496	1.593	50	20	IDGD	
NC(=O)COc1ccc(NC(=O)NNC(=O)c2ccc(F)cc2Br)cc1	918204252	XIFCPGWNCSEXQZ-UHFFFAOYSA-N	425.214	1.919	50	20	IDGD	
COc1ccc(CC(=O)O)cc1S(=O)(=O)NNC(=O)c1ccc(Br)s1	919955224	DLPWAFRHTQQEKY-UHFFFAOYSA-N	449.304	1.770	50	20	IDGD	
NC(=O)c1ccc(/C=C\C(=O)N2CCC[C@@H]2C(=O)NNC(=O)c2cccc(Cl)c2)cc1	920021935	RGLULYJYBJLHME-IBWPDUFMSA-N	440.887	1.904	50	20	IDGD	
CN1CCN(c2ccccc2NC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)CC1	920928607	VERXBTHPCQVHME-UHFFFAOYSA-N	435.488	1.796	50	20	IDGD	
CC(C)c1nn([C@@H]2CCS(=O)(=O)C2)cc1C(=O)NNC(=O)c1n[nH]c2c1CCCC2	1252172617	MIKFIQAQEXIHNM-GFCCVEGCSA-N	434.522	1.043	50	20	IDGD	
Cc1nn(C)cc1CCC(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	1253103350	HWNBIYLMRGUQQQ-UHFFFAOYSA-N	432.956	1.280	50	20	IDGD	
O=C(NNC(=O)c1ccc(Br)cc1)Nc1cccc(N2C(=O)CNC2=O)c1	1254722010	XNVZCKSYWPCGBE-UHFFFAOYSA-N	432.234	1.972	50	20	IDGD	
Cc1ccn(-c2cccc(C(=O)OCC(=O)NNC(=O)[C@H]3COc4ccccc4O3)c2)n1	1318263805	LWNDHRZCDFFKPY-LJQANCHMSA-N	436.424	1.325	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@H](C(=O)NNC(=O)c3n[nH]c4c3CCCC4)C2)cc1	1321932001	VMSZHFAXHPKZAV-HNNXBMFYSA-N	445.545	1.459	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)c1ccc2c(c1)SC1=NS(=O)(=O)CCN12	1323359631	NWYJWWIYBYJKOY-UHFFFAOYSA-N	442.486	1.031	50	20	IDGD	
COc1ncnc(N(C)C)c1NC(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1	1325359508	FYQHJVZJAWGKCX-UHFFFAOYSA-N	437.501	1.351	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@@H](C)C(=O)NNC(=O)[C@H]1CCCCN1S(C)(=O)=O	1337223233	RRFBRPIUGFTECQ-DZGCQCFKSA-N	431.942	1.686	50	20	IDGD	
COc1ccc(C[C@H](C)N(C)C(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1	1338142021	PBICBKRLIUFBGF-AWEZNQCLSA-N	433.534	1.906	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2c[nH]c3nccc-3c2)C1	1777899066	LEWDJSZBAQRANL-CSODHUTKSA-N	434.924	1.896	50	20	IDGD	
Cn1nc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)c2c1CCC2	1777963646	TZVSNJSSKRWRMA-RHSMWYFYSA-N	429.290	1.043	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)/C=C3\C(=O)Nc4ccccc43)C2)C1	1778910081	ZUKQCIDMWDXDEF-VWELDODOSA-N	433.892	1.106	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@H](C(=O)N2CCO[C@@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)C1	1779301791	VPQZLTKWTHMZHR-CSODHUTKSA-N	440.613	1.647	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)c(O)c1	1780552941	KGQQHRKVSHYUEF-PBHICJAKSA-N	431.258	1.535	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CCO[C@]2(CCN(C(=O)[C@](C)(Cl)CCl)C2)C1	1781231903	GQFJDYYPAUOBEJ-KQEPKPNTSA-N	447.359	1.808	50	20	IDGD	
O=C(c1ccc2[nH]ccc2n1)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781332137	UJUPAXAGBTXZGT-WMLDXEAASA-N	425.258	1.697	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)COc1ccccc1C#N)C2	1782178967	RBLXWODZJLIMAR-SFGWALBWSA-N	449.935	1.705	50	20	IDGD	
C[C@@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCC(=O)NN(C)C)C1)c1ccccc1	1782213878	BAQJQAQYHRKWDE-DRMXPCRNSA-N	444.576	1.677	50	20	IDGD	
O=C(NCCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C(Cl)Cl)C1)c1ccc[nH]1	1782214358	CWGLWAFWGXRLBR-AUUYWEPGSA-N	445.347	1.452	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3c4c(nn3C)CCC4)C2)C1	1782442037	UXRWNULNGNMCNA-LIRRHRJNSA-N	439.354	1.526	50	20	IDGD	
C[C@H](Cc1ccncc1)C(=O)N1CC[C@@]2(CN(C(=O)[C@@H](F)Br)CCO2)C1	1782661096	OUZUGIHINGLJAU-SIIHOXLZSA-N	428.302	1.781	50	20	IDGD	
COc1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](O)CCl)C3)ccc1F	1782916362	PITNZRFVERECAE-WRWLIDTKSA-N	428.888	1.562	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)C[C@@H](N)c3cccnc3)CCO2)C1	1783344084	YQOIKRTVWJGDGH-FCEWJHQRSA-N	439.354	1.475	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)CCc3nnc(C)s3)CCO2)C1	1783344129	NGLQFDBXNGWMIW-SUMWQHHRSA-N	445.383	1.783	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H]1Cc3ccccc3CN1)CCO2	1783534011	CPZPZSOZVLSWHJ-ZTQAJYAQSA-N	436.350	1.314	50	20	IDGD	
Cc1cccn2ncc(C(=O)N3CCO[C@@]4(CCN(C(=O)[C@H](C)Br)C4)C3)c12	1783536215	IBAJDLDDJZZODS-IFXJQAMLSA-N	435.322	1.870	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(=O)c4ccccc4o3)[C@H]2C1	1783825819	JKRPMIKLBGXRNK-PEMDQYIBSA-N	448.903	1.640	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1ccc(Cl)c(F)c1)CCO2	1783934429	GYXFOFIOOWGPNH-FQEVSTJZSA-N	440.903	1.296	50	20	IDGD	
O=C(c1cc(Cl)cc2nn[nH]c12)N1CCO[C@@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783948455	NBPRNIZWSGSPDP-MRXNPFEDSA-N	432.695	1.859	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CC[C@H](O)CC3)C[C@@H]21	1783974245	JIXDRLVPVDCRGY-UYLCUJDWSA-N	431.371	1.548	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3csc(C(F)(F)F)n3)C[C@@H]21)[C@H](O)CCl	1784091434	UGVCBTYGMGACIZ-XPXLGCRWSA-N	441.859	1.355	50	20	IDGD	
Cc1cc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)Br)C[C@@H]32)nn1C	1784243201	ZDEXJAFUMPVXLW-VRKREXBASA-N	427.343	1.034	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21)[C@@H]1COc2ccccc2O1	1785044196	ZIICKCYATGHIQL-APYUEPQZSA-N	429.300	1.610	50	20	IDGD	
O=C(Cc1cccnc1)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1	1788267400	XOKDKVGAZHCTGG-UHFFFAOYSA-N	429.285	1.752	50	20	IDGD	
C[C@H](NNc1ccccc1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]2C1	1788761827	DVIXQZRHEAPQPV-ZULIPRJHSA-N	448.640	1.823	50	20	IDGD	
Cn1ncc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]32)c1Cl	1789083837	BIFJUNQAFIAZLP-HTWFXAOOSA-N	437.755	1.903	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ncc(F)cc3F)C[C@@H]21)[C@@H](F)Br	1789921478	LKNQQBQDJKCEML-VWBVRBGYSA-N	436.228	1.644	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)[C@H]1CCc2cccc(Cl)c21	1790688354	DAWAQQFTGQDHPW-YDRHNJASSA-N	441.355	1.949	50	20	IDGD	
CCOC(CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](Br)CC)[C@H]2C1)OCC	1790963996	QTRINMODNOMGAH-VGWMRTNUSA-N	449.386	1.929	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3nnc(C)s3)C[C@@H]21	1791252209	DOYLZHWLYXYYQU-AJNGGQMLSA-N	430.958	1.013	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3(F)CCCCC3)C[C@@H]21	1791291368	STIMLILKENRQDR-ULQDDVLXSA-N	426.533	1.012	50	20	IDGD	
Cc1cc(C)n(CCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CO[Si](C)(C)C)C[C@@H]32)n1	1791509241	TZSQMPCMOMGFPY-FHWLQOOXSA-N	436.629	1.721	50	20	IDGD	
Cc1cnn([C@H](C)C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]32)c1	1791596921	MSXNOYFENYMOKL-XZLOLGPPSA-N	431.364	1.969	50	20	IDGD	
CN1CCC[C@H](C(=O)NC2(c3ccc(NC(=O)CCC(=O)NN(C)C)cc3)CCC2)C1	1791600770	BENDHSNTJUZCJH-KRWDZBQOSA-N	429.565	1.835	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(Cl)cc1F)c1ccc(B(O)O)cc1	1792719844	LEJMDYGODIWONI-BJWYYQGGSA-N	430.672	1.725	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COc1ccc(F)cc1)C2	1792868025	QNZSMRDLZAQTAP-ZUMXRPEOSA-N	443.313	1.825	50	20	IDGD	
Cc1cnn([C@@H](C)C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)CBr)c1	1792873339	UGSLEJKEVQUDRX-GVRJEKJASA-N	427.343	1.373	50	20	IDGD	
Cc1ccccc1-c1ncccc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](O)CCl	1792976280	BNKGXEUHUQVCRT-WOUAJJJCSA-N	443.931	1.860	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CC(=O)OC(C)(C)C	1793592910	NQIAKGKSPAKKKH-ZWUHOBOKSA-N	433.343	1.481	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccc2c(c1)OCO2	1795312015	QXQSKAJQISNYPA-ZZXMYQEDSA-N	443.327	1.784	50	20	IDGD	
COc1cc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Cl)cc(OC)c1OC	1796364048	COZGCLMOVVPADC-OESLAJAZSA-N	444.887	1.379	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1cnc2ccccc2n1	1796777166	MAELOWBBNVTRQU-OJXGSEEGSA-N	437.269	1.524	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2cc(OC)ccc2o1	1797351177	YLKIVNYDTYGTJE-MVWRLGRASA-N	436.892	1.898	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccn2cncc2c1	1798167743	VIKIPMKAJODYEV-MVUGMWCJSA-N	447.499	1.720	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1n[nH]c2cc(Cl)ccc12	1798174784	QWKLDKPTXVEBPJ-QDMKHBRRSA-N	446.939	1.841	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](CN)c1ccccc1)C2	1799274779	HVKPBUKXOMFEKF-YPLULLRNSA-N	428.360	1.555	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@](C)(Cl)CCl	1799278602	PQZOFWAMSXLCRH-GEGIDHMNSA-N	447.359	1.568	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(O)c([N+](=O)[O-])c1	1799483833	ONWQKYZETHGZIM-TYYYEBLRSA-N	446.287	1.740	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2ccnn2c1	1800028067	HMXQOWACRQONNF-FSDCSDTHSA-N	435.322	1.711	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CCOC1)C2	1800334112	JMLMOQVKTXSUNU-KVUUAWEYSA-N	431.439	1.498	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccnc(C(F)(F)F)c1)C2	1800973513	BWEKOPCKYKQPGR-XFMPKHEZSA-N	435.830	1.557	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1=NNC(=O)C1)C2	1801439239	DWTSKFDIRRSKMB-WMTCKVMYSA-N	427.411	1.386	50	20	IDGD	
C[C@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C(C#N)=C/c1ccc(F)cc1F)C2)n1cnnn1	1803095265	ARWDSXUTEIDGGE-TYVRSOFJSA-N	441.442	1.758	50	20	IDGD	
Cc1cc(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)c(C)o1	1805562249	SWAJCSDHMSPLEN-UGKGYDQZSA-N	447.300	1.605	50	20	IDGD	
Cn1ccc(CC(=O)N2CC[C@H](CNC(=O)CCBr)[C@H]2c2cccnc2)n1	1806340325	BYWCWOCPTIJADZ-DNVCBOLYSA-N	434.338	1.849	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)/C=C/C2CCCC2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807363300	BRWXMRRGUCXIET-LSTWCFQCSA-N	447.344	1.827	50	20	IDGD	
Cc1noc(N)c1C(=O)N1CC[C@H](CNC(=O)[C@@H](F)Br)[C@H]1c1cccnc1	1808660782	CZMVFLFRHLEJJK-MRVWCRGKSA-N	440.273	1.970	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCC2(CCCN(C(=O)C(C)=O)C2)CC1	1808991984	DLCZOXVSSLSCPT-UHFFFAOYSA-N	431.445	1.954	50	20	IDGD	
Cc1ncc(CC(=O)N2CCC3(CCCN(C(=O)c4ccc(B(O)O)cc4)C3)CC2)s1	1809972147	CJXXTWSYFJMFJZ-UHFFFAOYSA-N	441.362	1.219	50	20	IDGD	
COC(=O)C1(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](F)Br)[C@H]2c2cccnc2)CC1	1812691161	DVSGRNQDJZFJBW-MELADBBJSA-N	442.285	1.731	50	20	IDGD	
O=C(CCC(F)(F)F)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2	1814432088	IMMSBCJIKQWTNK-GFCCVEGCSA-N	441.240	1.391	50	20	IDGD	
COC(=O)[C@@H]1CC[C@H](C(=O)N2CCCC[C@H]2c2cc(NC(=O)[C@H](O)CCl)n[nH]2)C1	1814863981	DZZNMRODXHUJEF-MYZSUADSSA-N	426.901	1.591	50	20	IDGD	
Cc1cc2nnc(C(=O)N3CCCC[C@H]3c3cc(NC(=O)[C@@H](O)CCl)n[nH]3)c(C)n2n1	1814870739	BMCZMFVFJDCUEN-KBPBESRZSA-N	446.899	1.370	50	20	IDGD	
N=C(N)SCCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](F)Br)CC2	1814950612	FBNFUBULHZWNRH-LHLIQPBNSA-N	438.348	1.762	50	20	IDGD	
Cc1csc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)c1	1815350267	NGQVRDWNDHFXLV-AWEZNQCLSA-N	441.343	1.732	50	20	IDGD	
O=C(CCc1ccccc1)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1	1815355154	PJZDEEYQSZMEFJ-GOSISDBHSA-N	449.341	1.682	50	20	IDGD	
Cc1cc(CC(=O)Nc2cc([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)on1	1815716055	NNWXMTGAIUSDGM-INIZCTEOSA-N	431.497	1.314	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccnc2)n[nH]1	1816376819	MDPKGMQAHQIAMT-KRWDZBQOSA-N	434.460	1.423	50	20	IDGD	
COc1cc(C#N)cc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@@H](O)CCl)CC3)c1	1821383949	LEJORLANRVDAMV-WFASDCNBSA-N	434.905	1.849	50	20	IDGD	
Cc1cc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)[C@H](O)CCl)[nH]n2)nc2nccn12	1821478072	QQCUDVFNVUYULC-LSDHHAIUSA-N	431.884	1.666	50	20	IDGD	
CCCNC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](Cl)COC)n[nH]1	1822371869	URCFRHACICRCJO-DZGCQCFKSA-N	427.933	1.962	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(=O)n3[nH]cnc3n2)[nH]n1)C(Cl)Cl	1822417565	ARPIEKGOLKUUMI-JTQLQIEISA-N	439.263	1.250	50	20	IDGD	
O=C(Cc1ncccn1)N[C@@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1	1823001687	JDEVLVMBRHOZKO-OQPBUACISA-N	428.287	1.778	50	20	IDGD	
Cc1ncccc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1	1825842834	QEVBFWSJKUZSOC-JOCHJYFZSA-N	435.333	1.617	50	20	IDGD	
O=C1C[C@H](C(=O)N2CCC([C@H]3CCCCN3C(=O)[C@H](F)Br)CC2)CCN1	1830381742	MUWRPDJBCMARLZ-FMKPAKJESA-N	432.334	1.823	50	20	IDGD	
CN1C(=O)CC[C@H]1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H](F)Br)CC1	1830400548	GJUCKXKQLJKZGX-YCPHGPKFSA-N	432.334	1.917	50	20	IDGD	
C[C@H](Sc1ccccc1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1830725236	IFGBNUCLNYCIBK-KNBMTAEXSA-N	442.965	1.223	50	20	IDGD	
CC(F)(F)C(C)(C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1831683071	PRYAWTSSBLSYPQ-ZBEGNZNMSA-N	445.276	1.815	50	20	IDGD	
Cc1cc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)nn1C	1831871356	AXXQUQONIODJKA-IBGZPJMESA-N	432.569	1.335	50	20	IDGD	
Cc1cnn([C@H](C)C(=O)N2CCCC[C@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)c1	1832186566	CENGYLNVEGCAQB-QUCCMNQESA-N	446.596	1.745	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3ncccc3C)CCO2)C1	1832781165	GILYKVBKFXOYAR-LAUBAEHRSA-N	439.940	1.033	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H]3CCc4ccoc4C3)CC2)CC1)[C@@H](O)CCl	1833305852	AFZSUAMKVFOOLL-LPHOPBHVSA-N	437.968	1.556	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(O)nc(Cl)c3)CCO2)C1	1833581388	RQHZKTOLPXXEHW-SCLBCKFNSA-N	432.304	1.528	50	20	IDGD	
CC(=O)N(C)CCC(=O)NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1	1833669774	BUTRXPIVWHCSDD-KRWDZBQOSA-N	449.365	1.117	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(C)cnc3Cl)CCO2)C1	1834559336	HMDKVXCKGJCMTP-DNVCBOLYSA-N	446.331	1.367	50	20	IDGD	
CC(C)C(=O)N1CCO[C@]2(COCCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1	1834738583	NWKLEMHLKZXZBR-CQTHNFAISA-N	433.455	1.984	50	20	IDGD	
O=C(CCc1ccccn1)N1CCOC[C@]2(C1)CN(C(=O)CCBr)CCO2	1834818964	GQYHFFOISQSSAE-IBGZPJMESA-N	440.338	1.256	50	20	IDGD	
O=C(CCCn1cccc1)N1CCOC[C@@]2(C1)CN(C(=O)CCBr)CCO2	1834826626	SFQBHMRBWAIBLP-LJQANCHMSA-N	442.354	1.510	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)Cc3ccsc3)CC2)CC1	1834861589	POLMDVQUJYIVKF-UHFFFAOYSA-N	449.621	1.235	50	20	IDGD	
Cc1ccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)cc1	1835084395	CSVZRMDVAISYDO-HKUYNNGSSA-N	443.313	1.684	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1)[C@H]1CCC=CO1	1835723166	XXOYVHSFXRRKBX-HZPDHXFCSA-N	432.334	1.941	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)C(Cl)Cl)CC2)CC1)c1cc2cccnn2n1	1836079613	PJCXNFOHVJLRRC-UHFFFAOYSA-N	439.347	1.718	50	20	IDGD	
CN1CCC[C@H]1C(=O)N1CCC(OC2CCN(C(=O)CCBr)CC2)CC1	1837000768	FVKOAFYFMNTMJZ-KRWDZBQOSA-N	430.387	1.864	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccn4nccc4c3)CCO2)C1	1837155599	KPVZMCQQOGDCNY-WIYYLYMNSA-N	434.924	1.812	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)Cn3cncn3)CC2)CC1	1837964922	CVHMDYLCXCEFTF-ZDUSSCGKSA-N	428.331	1.060	50	20	IDGD	
N#Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCBr)C3)C2)cc1	1838950203	NVAZOOQZMMUCLC-LJQANCHMSA-N	436.306	1.413	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3=NO[C@H](c4ccccc4)C3)C2)C1	1839144596	FWAYTMXDZQMAIQ-JLMWRMLUSA-N	449.935	1.978	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3=NO[C@@H](c4ccccc4)C3)C2)C1	1839144597	FWAYTMXDZQMAIQ-KPLVRAHFSA-N	449.935	1.978	50	20	IDGD	
C[C@H](C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2)n1ccnc1	1839150849	ZFWRHTSGPZGWNT-JLSDUUJJSA-N	433.336	1.137	50	20	IDGD	
Cc1[nH]nc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)c1F	1839151277	MLUARMTVFVEQKT-IAGOWNOFSA-N	437.299	1.164	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)n3ccnc3)C2)C1	1839961854	KVHSVFHHSMEHBM-VKJFTORMSA-N	443.342	1.074	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCCC(F)(F)F)C2)C1	1840030195	CXZJFMCHBIDOQX-SWLSCSKDSA-N	445.276	1.959	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](OC)c3ccccc3)C2)C1	1840151714	MCTFFALBTVNDFJ-WFXMLNOXSA-N	440.924	1.084	50	20	IDGD	
O=C(c1cc(F)cc(F)c1F)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840190867	QVKQLEAIASFSGF-KRWDZBQOSA-N	441.233	1.978	50	20	IDGD	
Cc1ccc(CCC(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)c(C)n1	1840337578	CFEKJJHTUCNCKL-UYAOXDASSA-N	427.904	1.622	50	20	IDGD	
C[C@@H](C(=O)N1CCCC12CN(C(=O)c1ccc(B(O)O)cc1)C2)c1ccc(Cl)cc1	1841197304	APZGVXALUQGQPH-OAHLLOKOSA-N	426.709	1.641	50	20	IDGD	
O=C(c1cn2ccc(Br)cc2n1)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1	1841351409	PDPDEERHGFMENS-CYBMUJFWSA-N	441.713	1.514	50	20	IDGD	
CCOC(=O)N[C@@H](O)C(=O)N1CCCC12CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)C2	1844159598	MRIOVEXNJRCXDZ-AAKUMTKESA-N	448.426	1.140	50	20	IDGD	
C[C@H](C(=O)N1CC2(CCCN2C(=O)/C(C#N)=C/c2ccc(F)cc2F)C1)n1ccnn1	1845871765	LVNVVXBWGZYAHW-BRYYZUPOSA-N	426.427	1.928	50	20	IDGD	
C[C@H](CC(N)=O)C(=O)N1CC2(CCCN2C(=O)[C@H](Br)Cc2ccccc2)C1	1845940582	YJIPSOUVIGYFGU-GDBMZVCRSA-N	436.350	1.708	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCCC12CN(C(=O)C1(N3CCN(C)CC3)CC1)C2	1846071709	INEJXCOZEJIQCZ-OAHLLOKOSA-N	427.387	1.143	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c([N+](=O)[O-])cc1OC(F)F	11776665	FHQKXDMCSIGUKY-HNNXBMFYSA-N	439.327	1.806	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	15895067	PTPRCZBDRHNCED-UHFFFAOYSA-N	431.514	1.874	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)[C@@H]1CS[C@@]2(C)CCC(=O)N12	21957781	OQCNQOWNBLABKX-SGTLLEGYSA-N	441.893	1.107	50	20	IDGD	
Cn1c(SCC(=O)NNC(=O)c2ccccc2)nnc1[C@H]1COc2ccccc2O1	22165453	BHQQFQWQZVAYOV-MRXNPFEDSA-N	425.470	1.881	50	20	IDGD	
CCCNC(=O)CSc1nnc(SCC(=O)NNC(=O)c2cccs2)s1	26164381	VJMHTLRIKJXBJJ-UHFFFAOYSA-N	431.590	1.771	50	20	IDGD	
CC[C@H](C)C(=O)N1Cc2ccccc2C[C@H]1C(=O)NNC(=O)CNC(=O)c1ccco1	725742050	ZBKNWYIWDJVQAA-YOEHRIQHSA-N	426.473	1.156	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)CCc2c(C)[nH]c(-c3ccncc3)nc2=O)cc1	725890111	KAFGLYAVTUPVBK-UHFFFAOYSA-N	435.484	1.862	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)[C@@H]2CS[C@@]3(C)CCC(=O)N23)c1	728529875	RNWTYVLLPCFGGQ-LRDDRELGSA-N	428.308	1.673	50	20	IDGD	
CC(C)OCCCNC(=O)C1CCN(CC(=O)NNC(=O)c2cccc(Cl)c2)CC1	728570336	JNPMVXCWHRFVAO-UHFFFAOYSA-N	438.956	1.744	50	20	IDGD	
COCCN1CCC[C@@H](NC(=O)CCC(=O)C(C#N)=C2N(C)c3ccccc3N2C)C1	729982739	GRHNMLOWHBADFK-QGZVFWFLSA-N	425.533	1.884	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cccc3ncccc23)cc1S(=O)(=O)N(C)C	730225337	BFPBDHCVNAZFAO-UHFFFAOYSA-N	428.470	1.569	50	20	IDGD	
O=C(NNC(=O)C1(c2ccccc2Cl)CCOCC1)c1ccc(-n2cnnn2)cc1	730514643	BTMIWJUTJYTZCC-UHFFFAOYSA-N	426.864	1.825	50	20	IDGD	
O=C(CCCCOc1ccc(Br)cc1)NNC(=O)N[C@H]1CCS(=O)(=O)C1	731186888	XMOMGYWEQSGEFY-ZDUSSCGKSA-N	448.339	1.516	50	20	IDGD	
C[C@H]1CN(Cc2ccc(C(=O)NNC(=O)CCN3C[C@H](C)O[C@H](C)C3)cc2)C[C@H](C)O1	732262633	VBAAAIOQYTYJQG-RDGPPVDQSA-N	432.565	1.556	50	20	IDGD	
Cc1ccc(S(=O)(=O)n2ccc(C(=O)NNC(=O)CCN3C[C@@H](C)O[C@H](C)C3)c2)cc1	732263924	PTYAFCBXSIHFFG-IAGOWNOFSA-N	448.545	1.294	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)NCCN/C(O)=C2/N=CC=CC2=O)c(C)n1-c1ccccc1	732466563	PHSXGQGSNJLHDU-VZCXRCSSSA-N	436.472	1.565	50	20	IDGD	
CS(=O)(=O)CC[C@H](NS(=O)(=O)c1ccccc1)C(=O)NNc1ccc(F)cc1F	733363073	LHPYCHNJMQEAEK-INIZCTEOSA-N	447.485	1.190	50	20	IDGD	
N#CCCn1cc(/C=C(/C#N)C(=O)NS(=O)(=O)[C@@H]2CCOC2)c(-c2ccccc2)n1	733722232	UVPFGLMZGGGPMD-MUMAZLPKSA-N	425.470	1.606	50	20	IDGD	
CN1C(=O)C[C@@H](C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)[C@H]1c1cccc(Cl)c1	734393611	SXOMQBCGRPWREW-SJLPKXTDSA-N	449.916	1.724	50	20	IDGD	
CCN(C)[C@@H](C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1)c1ccccc1	735118400	UGRZXQLXYYAJGA-LJQANCHMSA-N	446.577	1.154	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)c2cc(S(=O)(=O)Nc3ccc(Cl)cc3)ccc2O)cn1	735449011	CUPUVQMITQHYDW-UHFFFAOYSA-N	449.876	1.655	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N1CCS(=O)(=O)[C@@H](C)[C@H]1C	736372214	DTAXGZSASRPYCW-WOPDTQHZSA-N	448.339	1.465	50	20	IDGD	
COC[C@@H](C)CNC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	737064626	IYDPHIMIMBFYAZ-LBPRGKRZSA-N	426.520	1.775	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)c2cn(-c3cccc(C(F)(F)F)c3)nn2)C[C@@H](C)O1	740076017	QKDGNPOEHDNIDK-CHWSQXEVSA-N	440.426	1.546	50	20	IDGD	
Cc1cc(C#N)ccc1S(=O)(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	740810799	ZODQZZNXQNUJMO-UHFFFAOYSA-N	448.526	1.275	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C(C)C	740851438	FGNUREGBUDJUQR-SFHVURJKSA-N	429.521	1.303	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN(C(=O)COc2ccccc2)C1)c1cc(Br)c[nH]1	741208161	SJDPJTVTOYZNNY-CYBMUJFWSA-N	449.305	1.856	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc(NS(C)(=O)=O)c1OC	742462994	JPRWPTBFDUJTJW-UHFFFAOYSA-N	438.418	1.058	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)Cc2csc(NC(=O)C(C)(C)C)n2)nc2ccccc21	742474493	QNBRHKPPJWROTH-UHFFFAOYSA-N	428.518	1.947	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)/C(=C/c2ccc(F)cc2)n2nnnc2C)c1	744539307	SMWDUYGWQZKCEW-WQRHYEAKSA-N	438.419	1.432	50	20	IDGD	
CCCN(C(=O)[C@H](C)OC(=O)/C(C#N)=C\c1cccc(OC)c1)[C@@H]1CCS(=O)(=O)C1	744568932	XZNPCENFVIUGIQ-QNQLJGHGSA-N	434.514	1.960	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1cc2c(nc1O)CCCCC2	744620515	GSZFZFHFAKOERW-UHFFFAOYSA-N	446.529	1.834	50	20	IDGD	
C[C@H](CN1CCN(c2ccccc2)CC1)NC(=O)NNC(=O)COc1ccc(C#N)cc1	745836593	BVTHRDFIMIAMKI-GOSISDBHSA-N	436.516	1.478	50	20	IDGD	
O=C(NCCCN1C(=O)COc2ccccc21)NNC(=O)c1cc([N+](=O)[O-])ccc1O	745856716	JVDIKKKANMUGLP-UHFFFAOYSA-N	429.389	1.060	50	20	IDGD	
CCN1CCN(C[C@@H](C)CNC(=O)NNC(=O)c2cc(-c3ccc(C)cc3)[nH]n2)CC1	745861604	NERMYAWPTSCEFT-KRWDZBQOSA-N	427.553	1.603	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(-c3ccccn3)no2)c1	746093528	QDRGSXJXLGKGCQ-UHFFFAOYSA-N	443.485	1.842	50	20	IDGD	
COc1cccc(C(=O)NNS(=O)(=O)c2ccc([N+](=O)[O-])cc2Br)c1O	746591414	LJBHTDUQIGQLSG-UHFFFAOYSA-N	446.235	1.695	50	20	IDGD	
CC(C)Oc1ccc(NS(=O)(=O)CC(=O)NNC(=O)Cc2cn3ccccc3n2)cc1	746636783	GGHFCZXYBJOPSO-UHFFFAOYSA-N	445.501	1.253	50	20	IDGD	
O=C(CCOc1ccccc1)NNS(=O)(=O)c1cc(C(=O)O)ccc1Br	747076460	OMJUABJUHRIFKJ-UHFFFAOYSA-N	443.275	1.926	50	20	IDGD	
O=C1CN(S(=O)(=O)c2cccc(C(=O)NNc3ccc(C(F)(F)F)cc3)c2)CCN1	747588091	CNGHBIHEKQTZEM-UHFFFAOYSA-N	442.419	1.583	50	20	IDGD	
Cc1ccc(C)c(NC(=S)NNC(=O)c2cnc3c(c2C)c(=O)n(C)c(=O)n3C)c1	748049114	SWXUOVBPNHNXAL-UHFFFAOYSA-N	426.502	1.189	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN1C(=O)c1ccc(Cl)c(Cl)c1)C(=O)N1CCCC1	748241258	QUCUGPPEGWOWSQ-CQSZACIVSA-N	427.288	1.368	50	20	IDGD	
Cc1ccc(C)c(S(=O)(=O)Nc2cccc(C(=O)NNC(=O)C(=O)N3CCCC3)c2)c1	748247188	MHOIHUPBNPNISY-UHFFFAOYSA-N	444.513	1.488	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1)c1cnn(C)c1	749884417	WPFYKMPTDVZXGV-OAHLLOKOSA-N	430.472	1.687	50	20	IDGD	
CC(C)(C)OC(=O)NCCOCC(=O)NNc1nc(Br)cn2ccnc12	750250067	LNLKNZWVNZRAFM-UHFFFAOYSA-N	429.275	1.476	50	20	IDGD	
Cc1nn(-c2cncc3nnnn23)c(C)c1CC(=O)NNc1cccc(Br)c1	750424455	QBXUJZMXPXTHAW-UHFFFAOYSA-N	442.281	1.770	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NC2CN(C(=O)OC(C)(C)C)C2)nc1	751796059	UICMDAFJFNEJKE-UHFFFAOYSA-N	442.542	1.358	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2c(F)cccc2OC(F)F)c1	752021578	RRRACDUQSQIIAN-UHFFFAOYSA-N	431.392	1.975	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)N[C@H]1CCCN(c2cccnc2)C1=O	753355206	DAAAIJAIOKIDRG-INIZCTEOSA-N	435.444	1.113	50	20	IDGD	
Nc1nc(Cl)cc(NNC(=O)c2ccc(S(=O)(=O)Nc3nccs3)cc2)n1	753457293	KASNZLANQQZWBH-UHFFFAOYSA-N	425.883	1.726	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)c2cccc(S(N)(=O)=O)c2C)n[nH]1	754475620	QPIWJKHUYBUPLE-UHFFFAOYSA-N	429.458	1.116	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)Cc3ccc4c(c3)COC4)cc2)CC1	755575747	ZYVUQHSZZNOOOB-UHFFFAOYSA-N	430.530	1.339	50	20	IDGD	
COC(=O)Cn1ccc(NC(=O)NNC(=O)c2cc(OC)ccc2Br)n1	756644700	GDEWZRJTCYCHPB-UHFFFAOYSA-N	426.227	1.294	50	20	IDGD	
C[C@@H]1CN(C(=O)Cn2cc(NC(=O)NNC(=O)C(C)(C)c3ccccc3)cn2)C[C@@H](C)O1	756840550	WQGRDMNKPYDVFC-HZPDHXFCSA-N	442.520	1.649	50	20	IDGD	
Cn1cc(-c2nc3ccccn3c2NC(=O)NNC(=O)c2nnc(O)c3ccccc23)cn1	757667252	XEZWIKVANBLYRK-UHFFFAOYSA-N	443.427	1.850	50	20	IDGD	
O=C(NCc1ccc(N2CCc3ccccc3C2)nc1)NNC(=O)C(=O)Nc1ccccn1	758688014	WCUZJGBMCYJRMP-UHFFFAOYSA-N	445.483	1.508	50	20	IDGD	
O=C(NCC1(c2ccc(Cl)cc2)CCOCC1)NNC(=O)C(=O)Nc1ccccn1	758709143	HERCBKDZMKZIIN-UHFFFAOYSA-N	431.880	1.752	50	20	IDGD	
C[C@H]1CC[C@H](CC(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)C1	759111575	BPPYVHBYOJKUPM-WMZOPIPTSA-N	437.562	1.614	50	20	IDGD	
C[C@H]1CN(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)C[C@@H](c2ccsc2)O1	759718211	KCPHMCQAKMERLL-WFASDCNBSA-N	437.547	1.858	50	20	IDGD	
Cc1noc(C[C@@H](NC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])c2ccccc2)n1	759864778	AGKNFJVACDPXTI-OAHLLOKOSA-N	440.416	1.979	50	20	IDGD	
O=C(CSc1nnc(O)nc1O)NN=Cc1c(F)ccc(C2OCCO2)c1Cl	761785474	HXKBUBFAGVZGHT-UHFFFAOYSA-N	429.817	1.363	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)CCc1nc(C2CCCC2)no1	761806003	ZXVOQNAWOSYXOE-UHFFFAOYSA-N	434.522	1.723	50	20	IDGD	
CCCS(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)c2ccc(C)cc2O)cc1F	762467059	MOBGFOAZJCJJRK-UHFFFAOYSA-N	445.494	1.615	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@H](C)C(=O)NNC(=O)c1ccc(S(N)(=O)=O)nc1	762738831	UBYGFNIIEPKVIK-LLVKDONJSA-N	426.882	1.228	50	20	IDGD	
Cc1sc2nc(CCC(=O)NNc3nccc(N4CCOCC4)n3)nc(O)c2c1C	762851784	FZIHNLRVVOCTPA-UHFFFAOYSA-N	429.506	1.716	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)c1ccc(F)c(I)c1	763365106	MIKNFKXUTYMUEO-UHFFFAOYSA-N	430.173	1.976	50	20	IDGD	
Cc1cc(C)c(S(=O)(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)cc1C(=O)O	763439906	XYWYZJYQRALCQX-UHFFFAOYSA-N	429.495	1.616	50	20	IDGD	
O=C(NNC(=O)c1ccncc1)C(=O)Nc1cc(Br)ccc1N1CCCC1	763463031	UQXALBYQOAJXHJ-UHFFFAOYSA-N	432.278	1.844	50	20	IDGD	
O=C(NNC(=O)c1ccncc1)C(=O)Nc1cccc(C(=O)Nc2ccc(Cl)cn2)c1	763463252	YQCXYMAVKZDCQL-UHFFFAOYSA-N	438.831	1.782	50	20	IDGD	
COC(=O)N(C)Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(OC)c(OC)c2)cc1	763550683	JRWPGAAKGKKUFE-UHFFFAOYSA-N	444.444	1.302	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)Nc1cccc(Oc2ccncc2)c1	763569815	CDEUAVBTZLEKKV-LJQANCHMSA-N	434.408	1.800	50	20	IDGD	
COC(=O)N(C)Cc1ccc(NC(=O)C(=O)NNC(=O)COc2cccc(C)c2)cc1	763628814	BEZXRYFONFLGGO-UHFFFAOYSA-N	428.445	1.358	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2ccc(-n3cncn3)c(F)c2)c1	763646795	JXGFZTHDXJNSJK-UHFFFAOYSA-N	426.408	1.188	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(C(=O)NC(C)(C)C)cc1	763656816	DXEWQANZCRRJEF-UHFFFAOYSA-N	442.472	1.388	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)C(=O)Nc1cccc(C#Cc2ccccn2)c1	763678570	GKBWQFAWIWWSEK-UHFFFAOYSA-N	432.411	1.785	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl	763683887	CBITXBUOVCDXKF-UHFFFAOYSA-N	436.808	1.812	50	20	IDGD	
CC(C)n1ncc2cc(NC(=O)C(=O)NNC(=O)COc3ccc(Cl)cc3)cnc21	763684108	FGTINGVSLFTCMD-UHFFFAOYSA-N	430.852	1.831	50	20	IDGD	
Cc1cc(Cl)ccc1NC(=O)C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	763719499	ZRMYZPXPCVWAMP-UHFFFAOYSA-N	438.893	1.298	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)C(=O)Nc2cncc3ccccc23)c2ccccc2c1=O	763791981	ZKQZTVMKHXRWTR-UHFFFAOYSA-N	444.451	1.925	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccc(OCc2cccnc2)c1	763808833	RJZQWNYDNLLHHM-UHFFFAOYSA-N	445.435	1.697	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccc(CN2CCOC2=O)cc1	763870730	BUJUEAIKHSAEDS-CYBMUJFWSA-N	444.419	1.331	50	20	IDGD	
CCc1cc(NC(=O)C(=O)NNC(=O)c2ccc(OCCC(C)C)c(OC)c2)n(C)n1	763914457	LTZGSOMJQRBLRU-UHFFFAOYSA-N	431.493	1.816	50	20	IDGD	
COC(=O)c1csc(NC(=O)C(=O)NNC(=O)c2ccc(OC(C)C)c(OC)c2)c1	763916699	SFSPDPJKRTYPQY-UHFFFAOYSA-N	435.458	1.730	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccc(Cl)cc2)cc1NS(C)(=O)=O	763932153	OATRJLQLOVKSJL-UHFFFAOYSA-N	438.893	1.349	50	20	IDGD	
O=C(NNC(=O)c1cc(Cl)ccc1O)C(=O)Nc1ccccc1CN1C(=O)CCC1=O	763977235	KKVRYGWEHAYBDU-UHFFFAOYSA-N	444.831	1.094	50	20	IDGD	
CCn1cnnc1-c1cccc(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)c1	763994535	DVDDOVJFEGCDRM-UHFFFAOYSA-N	446.265	1.455	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)c2cc(Br)cn2C)cc1	764002759	RQKRWCPVNNYMEE-UHFFFAOYSA-N	439.266	1.213	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cc(Br)cn2C)nn1-c1ccccc1	764004377	FQRNHYWZJQYHBW-UHFFFAOYSA-N	445.277	1.681	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)nn1-c1cccc(F)c1	764005972	HCNGFWFTRAEGBH-UHFFFAOYSA-N	439.403	1.491	50	20	IDGD	
CS(=O)(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)c2cccc3ccccc23)cc1	764052147	SFFDIUGPNVYENY-UHFFFAOYSA-N	425.466	1.784	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(OC3CCC3)c(F)c2)c1	764077210	JGMMBTFNOWKZRT-UHFFFAOYSA-N	449.460	1.560	50	20	IDGD	
Cc1nc(-c2ccc(NC(=O)C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)cc2)n[nH]1	764203929	GGZNNNZRIKWERT-UHFFFAOYSA-N	445.480	1.171	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)CCc2ccccc2O)ccc1OC1CCOCC1	764280926	ICDWNJFJZMZMIF-UHFFFAOYSA-N	441.484	1.977	50	20	IDGD	
CCOC(=O)c1ccsc1NC(=O)C(=O)NNC(=O)c1cnn(-c2ccccc2)c1	764343572	SNVNSWWOGXLEDV-UHFFFAOYSA-N	427.442	1.510	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)c1nn(-c2ccccc2C(F)(F)F)cc1O	764345823	XJBGHNHSGORKOW-UHFFFAOYSA-N	448.361	1.183	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)C(=O)Nc1ccnn1Cc1cccc(Cl)c1Cl	764355086	ZBRMHKUZQIAFQE-UHFFFAOYSA-N	447.282	1.962	50	20	IDGD	
Cc1ccc2c(c1)[C@@H](NC(=O)NNc1ccc(S(=O)(=O)N3CCN(C)CC3)cn1)CO2	764377820	ZMWFQVLGLBYIFP-KRWDZBQOSA-N	446.533	1.086	50	20	IDGD	
COC(=O)c1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)C(F)(F)Oc1ccccc1	764380142	PRMGUXSNMMZCJH-UHFFFAOYSA-N	441.774	1.884	50	20	IDGD	
COCCc1cc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(C)c(C)c3)[nH]n2)n(C)n1	764389186	ZDDITKUUSUDAIK-UHFFFAOYSA-N	439.476	1.016	50	20	IDGD	
CCn1cnnc1-c1cccc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)c1	764401984	VIAUXQXVDYUZHI-UHFFFAOYSA-N	440.485	1.549	50	20	IDGD	
Cc1ccc(S(C)(=O)=O)cc1NC(=O)C(=O)NNC(=O)c1ccc(Cl)cc1F	764410563	RWVJFUFSPPVMJV-UHFFFAOYSA-N	427.841	1.591	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)CCC(=O)N2CCN(c3ccccc3)CC2)nc2ccccc21	764547527	MNNCFSABECVQTA-UHFFFAOYSA-N	448.527	1.392	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1c(-c2ccccn2)noc1C	764558527	KGBPKVKDSRRZFD-UHFFFAOYSA-N	428.474	1.721	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)[C@H](C)S(=O)(=O)C2CCOCC2)cc1OC	764574326	SNDHDCQOXIFGMC-AWEZNQCLSA-N	442.534	1.617	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1)N[C@H]1CCS(=O)(=O)C1	764873806	IENAFJUTJWLTLO-AWEZNQCLSA-N	447.473	1.338	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)[C@H]1CCCN(C(=O)c2ccncc2)C1	765320136	LSEJINUJNKRCKR-INIZCTEOSA-N	433.509	1.386	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)c1cc(C(N)=O)n(-c2ccccc2)n1	765322721	LNNGHAHIZKBRST-UHFFFAOYSA-N	430.465	1.037	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)CNC(=O)c3cccc([N+](=O)[O-])c3)n[nH]2)cc1	765572525	ZVPGDZDJIBEFBX-UHFFFAOYSA-N	436.428	1.738	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)[C@H]1C[C@@H]1c1c(F)cccc1F	765739502	WBZOTKGLHKGTGD-IRXDYDNUSA-N	442.466	1.674	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)CCC(=O)c2ccc3c(c2)CCC(=O)N3)cc1	767610161	OBQQVJPHHIAHFV-UHFFFAOYSA-N	448.435	1.410	50	20	IDGD	
CC(C)c1cc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)n(-c2ncccn2)n1	768240130	SHQAFWJVOYBOIJ-UHFFFAOYSA-N	443.851	1.544	50	20	IDGD	
CCOc1ccc(CN2C(=O)c3ccccc3C2=O)cc1C(=O)NNC(=O)c1cc(C)[nH]n1	768276125	JHLQTYYACFTXDF-UHFFFAOYSA-N	447.451	1.988	50	20	IDGD	
COc1ccc(NNC(=O)CN2C(=O)N[C@](C)(c3ccc(F)cc3)C2=O)c([N+](=O)[O-])c1	768332749	SXJJAMQMZQZFKJ-LJQANCHMSA-N	431.380	1.653	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)c2nccc3c(S(N)(=O)=O)cccc23)cc1	768484407	OLESTCJVQLWLEA-UHFFFAOYSA-N	428.474	1.415	50	20	IDGD	
CC(C)n1ncc2cc(S(=O)(=O)NNC(=O)C3CCN(c4ncccn4)CC3)ccc21	768498683	CFJGVWZIKRRITI-UHFFFAOYSA-N	443.533	1.633	50	20	IDGD	
CCOc1cc(/C=C/C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)ccc1O	768622624	GPCZEAZZWIMOKO-ONNFQVAWSA-N	429.385	1.717	50	20	IDGD	
Cc1noc(C)c1S(=O)(=O)N1CCC(C(=O)NNc2cc(C#N)cc(Cl)n2)CC1	768711164	FOQFHHNIVQJHNL-UHFFFAOYSA-N	438.897	1.756	50	20	IDGD	
CC(=O)N1CCc2c(NC(=O)C(=O)NNC(=O)c3cccc(Br)c3)cccc21	769266591	NMKOHIVAGJINQI-UHFFFAOYSA-N	445.273	1.758	50	20	IDGD	
Cn1nc(Br)c2c(=O)n(CC(=O)NNc3c(F)cccc3Cl)cnc21	770203273	JFPINFRSJWGHTR-UHFFFAOYSA-N	429.637	1.828	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)N1CCN(C(=O)CN2CCCC2)CC1	770659623	TZCAUUHKBIKMNW-OAHLLOKOSA-N	437.928	1.088	50	20	IDGD	
Cc1ccncc1[C@H](C)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	771442715	VHVVZPNHGDDJKC-HNNXBMFYSA-N	447.517	1.116	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)C1(NS(=O)(=O)c2cccc(F)c2)CCCCC1	772069889	FQGQEZNVBYVOLP-CYBMUJFWSA-N	443.497	1.296	50	20	IDGD	
COc1cc(Br)c(S(=O)(=O)NNC(=O)c2ccccc2)cc1C(=O)O	772862320	XLNXLHRBKLJSOG-UHFFFAOYSA-N	429.248	1.779	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NNC(=O)CCc2nc(-c3ccccn3)no2)C1	773421089	QVOIRUAPPJFVOD-CQSZACIVSA-N	444.492	1.859	50	20	IDGD	
CC(C)COc1ccc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1	773645404	KGLLRNBIJFRMTG-LJQANCHMSA-N	428.441	1.866	50	20	IDGD	
C[C@H](C(=O)Nc1ccc(NC(=O)C(=O)NNc2c(F)cccc2F)cc1)n1cncn1	773719080	VEJZONNCTFBPCZ-LLVKDONJSA-N	429.387	1.838	50	20	IDGD	
CC(C)c1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc(O)n1	775521620	VOYGNCQLKVNCIA-UHFFFAOYSA-N	448.501	1.006	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)NCCc2cnccn2)cc1	775588875	KZOFYNFKPOHZCQ-ATVHPVEESA-N	445.483	1.490	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)CCc2ccc3[nH]ccc3c2)CC1	776231504	IFXBMMMFFJVLAN-UHFFFAOYSA-N	442.545	1.575	50	20	IDGD	
CCOC(=O)N1CCC[C@@H]([C@@H](C)NC(=O)NNC(=O)c2nnc(O)c3ccccc23)C1	777266522	AABGBADUVGKJRA-CHWSQXEVSA-N	430.465	1.536	50	20	IDGD	
COC(=O)Nc1ccc(S(=O)(=O)NNC(=O)c2cc3c(s2)CCC3)cc1[N+](=O)[O-]	777596866	DHJCZRAJYGYBCR-UHFFFAOYSA-N	440.459	1.947	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)n1	778165417	HWSCWNCVHUGBAR-UHFFFAOYSA-N	428.373	1.385	50	20	IDGD	
COc1cccc2[nH]cc(CC(=O)NNc3ccccc3S(=O)(=O)N3CCOCC3)c12	778829189	SVLAGSNSUQPOFO-UHFFFAOYSA-N	444.513	1.883	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C(=O)Nc2ccc(OC(F)F)c(F)c2)nc2ccccc21	782883762	BTPFKRJENHJWDP-UHFFFAOYSA-N	435.362	1.642	50	20	IDGD	
CO[C@H]1Cc2ccc(NC(=O)C(=O)NNc3ccc(S(=O)(=O)NC4CC4)cc3)cc2C1	784214437	XDZYZNKJFVRIFC-SFHVURJKSA-N	444.513	1.323	50	20	IDGD	
COc1ccc(C(=O)CCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c(OC)c1OC	784583994	BFRREPJJUPGBSG-GOSISDBHSA-N	444.440	1.663	50	20	IDGD	
O=C(NNc1ccccc1)C(=O)N1CCc2cc(S(=O)(=O)N3CCCCC3)ccc21	784763082	APYCWAZSDPRRNI-UHFFFAOYSA-N	428.514	1.894	50	20	IDGD	
O=C(NNc1ccc(Br)nc1)C(=O)Nc1ccc(CN2CCOC2=O)cc1	784808955	JFFBYDCFCCHWCJ-UHFFFAOYSA-N	434.250	1.878	50	20	IDGD	
CCNC(=O)N(C)NC(=O)C(=O)Nc1ccnn1Cc1ccc(OC(F)(F)F)cc1	784915605	FFRFRDYPKGEAFG-UHFFFAOYSA-N	428.371	1.461	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)[C@@H]1CCC(=O)c2ccccc21	786391191	KOODAVIRCSGXBL-HXUWFJFHSA-N	434.496	1.352	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)CCC(=O)N3CCCC#N)c(O)c1	787889707	QOTMUTAEURTXPA-UHFFFAOYSA-N	449.467	1.683	50	20	IDGD	
C[C@H](CN1CCOCC1)C(=O)NN=C1C(=O)Nc2ccc(Br)c(Cl)c21	788016771	XXVYZXFYOJFEOF-SECBINFHSA-N	429.702	1.843	50	20	IDGD	
CC(C)Oc1cc(NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)ccc1C(N)=O	788772213	QCLCXWOEFBFHDP-UHFFFAOYSA-N	434.474	1.443	50	20	IDGD	
CC(C)Oc1cc(NC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)ccc1C(N)=O	788773673	YTUWUCXFMQVOQL-UHFFFAOYSA-N	438.444	1.931	50	20	IDGD	
CSSCCNC(=O)N1CCN(c2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])CC1	790879384	DGDWCYDNCTYAMN-UHFFFAOYSA-N	434.565	1.841	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)[C@@H]1CCN(CC(F)(F)F)C1	791446825	CBMJSMSUTWLMDZ-MRXNPFEDSA-N	427.471	1.230	50	20	IDGD	
C[C@@](O)(Cn1cc(C(F)(F)F)ccc1=O)C(=O)NNC(=O)Cc1ccc(Cl)cc1	792028836	FZBKJSZYYZOHFX-QGZVFWFLSA-N	431.798	1.662	50	20	IDGD	
COc1ccc(NNC(=O)[C@@](C)(O)Cn2cc(C(F)(F)F)ccc2=O)c([N+](=O)[O-])c1	792240415	SSVWBTGDLVRBDD-INIZCTEOSA-N	430.339	1.678	50	20	IDGD	
CN(C)N(C(=O)CSc1nc2ccccc2nc1N1CCCC1)[C@@H]1CCS(=O)(=O)C1	792853596	FQEPDRVYONPCLE-OAHLLOKOSA-N	449.602	1.814	50	20	IDGD	
O=C(CN[C@@H](CO)c1ccc(Br)cc1)NNC(=O)c1ccc([N+](=O)[O-])cc1	794825971	AIFMRRFHJRZSIU-HNNXBMFYSA-N	437.250	1.442	50	20	IDGD	
CCOC(=O)c1ccc(OC)c(S(=O)(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)c1	795286874	RHNMFINKNHKANN-UHFFFAOYSA-N	449.485	1.437	50	20	IDGD	
Cc1nc2c3cccnc3nn2c(C)c1CCC(=O)NNC(=O)Cc1cn2ccccc2n1	796885523	JAFMEFIAIJGNPE-UHFFFAOYSA-N	442.483	1.865	50	20	IDGD	
CNC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)Cc2cccc3ccccc23)c(C)c1	797000230	XOFNCHSXBUEEHA-UHFFFAOYSA-N	448.479	1.602	50	20	IDGD	
COC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(OC)cc2OC)c1C	798041867	GHYWGHDZHYHVAJ-UHFFFAOYSA-N	430.417	1.590	50	20	IDGD	
O=C(NNS(=O)(=O)c1cccc(Br)c1F)[C@H]1COc2ccccc2O1	799120507	OQVOJUFKVKPCLN-GFCCVEGCSA-N	431.239	1.738	50	20	IDGD	
Cc1ccc(Cc2sc(NC(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)nc2C)cc1	799431136	DWXJZUILAILOFT-GFCCVEGCSA-N	425.536	1.441	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)c1cc(F)cc2nn[nH]c12	800517145	LMJDMHLUYLQEGO-UHFFFAOYSA-N	445.886	1.329	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)N[C@H](Cn1ccccc1=O)c1ccccc1	800762092	AMHSETDXXMJKTJ-LJQANCHMSA-N	431.452	1.871	50	20	IDGD	
COc1nccc(NC(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)n1	801725168	HGMLMPXZSYWOLU-UHFFFAOYSA-N	445.439	1.710	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)[C@@H](CSC)N2C(=O)[C@H]3CCCC[C@H]3C2=O)cc1	802063260	XHLRRLAVMNSFSF-OWCLPIDISA-N	434.518	1.755	50	20	IDGD	
C[C@@H]1Cc2cc(C(=O)NNC(=O)Nc3ccc4c(c3)OCO4)ccc2N1S(C)(=O)=O	802095685	ASNBVOVSRRZGNC-LLVKDONJSA-N	432.458	1.592	50	20	IDGD	
COc1ccc(N2C[C@H](C(=O)NNC(=O)Nc3ccc4c(c3)OCO4)CC2=O)c(OC)c1	802101485	NTHMKTSRNJVIHS-GFCCVEGCSA-N	442.428	1.638	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)CC(=O)NNC(=O)Nc2ccc(N(C)C)cc2)cc1F	802120051	IQDXLOZWMAYAIY-UHFFFAOYSA-N	436.465	1.721	50	20	IDGD	
O=C(NCc1ccccc1OCCN1CCOCC1)NNc1ccc(-n2ccnc2)nn1	805014766	KFTUBJYIKRZRDT-UHFFFAOYSA-N	438.492	1.200	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C#N)c(Br)c2)c(OC)c1	806978721	JEKKPUKRYYEUQH-UHFFFAOYSA-N	447.245	1.738	50	20	IDGD	
CCCNS(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)c2ccc(C)cc2O)cc1	808079000	KTMUTADYKIGNRS-UHFFFAOYSA-N	427.504	1.012	50	20	IDGD	
COC[C@@]1(C(=O)NNC(=O)CNc2ccccc2OC)CCN(C(=O)OC(C)(C)C)C1	810007566	LHIHZVPMLPIGHQ-OAQYLSRUSA-N	436.509	1.528	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)c2ccc(C(=O)OC)[nH]2)c2ccccc2c1=O	814219655	PUGXYUWOYNCQPK-UHFFFAOYSA-N	425.445	1.776	50	20	IDGD	
CC(=NNC(=O)Cc1csc(N2CCOCC2)n1)c1cccc(O[C@@H](C)C(=O)O)c1	814770910	QJDUQOGVJCGRNI-AWEZNQCLSA-N	432.502	1.915	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(OC)c(C)c(OC)c1	815565585	UGALLMGDQGEJIP-UHFFFAOYSA-N	431.445	1.576	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cccc(S(=O)(=O)C3CCCCC3)c2)n[nH]1	815568056	UEELJNGWIGFPMK-UHFFFAOYSA-N	433.490	1.224	50	20	IDGD	
N#Cc1cc(NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)ccc1Br	815568586	NOGSKCBOASQEGF-OAHLLOKOSA-N	429.230	1.410	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1cc(C2CCCCC2)nn1C	815752428	RMYMOLIRZCBXPU-UHFFFAOYSA-N	448.549	1.800	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)/C=C/c1ccccc1)C(=O)NNc1ncncc1F	817071053	NHUZJDYEAMZBNC-HQPKTYMTSA-N	425.511	1.771	50	20	IDGD	
O=C(CN(Cc1ccccc1)S(=O)(=O)c1ccc(Cl)cc1)N1CC[C@@H](B(O)O)C1	864234923	ZIFQHWUWQQZUKF-MRXNPFEDSA-N	436.726	1.606	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NN=Cc2c(N3CCOCC3)nc3ccccn3c2=O)c1	864237217	PLAJNDCUZORZMK-UHFFFAOYSA-N	435.484	1.677	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NN=Cc2c(Cl)nc(N)nc2N2CCOCC2)cc1	874080063	HGBIHGSAEGZCRY-CYBMUJFWSA-N	448.911	1.865	50	20	IDGD	
C[C@H](Oc1ccc(Cl)cc1Br)C(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1	893188150	OUYSHLVKISLCFZ-DTWKUNHWSA-N	439.715	1.452	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)CN(C)C(=O)c1cccs1	914957905	BIIVWPCHTJNNCE-UHFFFAOYSA-N	439.877	1.487	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(S(C)(=O)=O)ccc2Cl)c1	915164956	UQKFYTZRUFUNOI-UHFFFAOYSA-N	430.891	1.222	50	20	IDGD	
Cc1ccc(OCCNC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)cc1	915891663	QXXGKMXFNQJKJX-UHFFFAOYSA-N	448.549	1.031	50	20	IDGD	
CC(=NNC(=O)c1cccnc1)c1ccc(S(=O)(=O)N2CCCC[C@@H]2C(=O)O)cc1	916251340	GHEFVFZZBUVYNP-GOSISDBHSA-N	430.486	1.863	50	20	IDGD	
CC(C)n1nc(C(=O)NNS(=O)(=O)c2ccc3nc(O)[nH]c3c2)c2ccccc2c1=O	916646469	POXMHHNTYMSQSJ-UHFFFAOYSA-N	442.457	1.183	50	20	IDGD	
CON(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)c2cc(-c3ccc(C)cc3)[nH]n2)cc1	917178614	ZIAZWFMTEWACET-UHFFFAOYSA-N	443.485	1.642	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)N2CCN(CC(=O)N(C)C)CC2)c(C)n1C[C@@H]1CCCO1	917367050	JDQVYZYEHFIQAG-OABJIQBASA-N	427.549	1.423	50	20	IDGD	
Cc1ccc(S(=O)(=O)Oc2ccc(S(=O)(=O)NNC(=O)c3ccccn3)cc2)cc1	917713530	KHQGYSRQCZXUGL-UHFFFAOYSA-N	447.494	1.781	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@@H](C)C(=O)NNC(=O)CN(C)C(=O)[C@H](C)n1cccn1	918688774	DRPIRJGYMUVLBT-GJZGRUSLSA-N	435.912	1.788	50	20	IDGD	
Cc1c(/C=C(\C#N)C(=O)OCC(=O)N2CCC(C(=O)N3CCCC3)CC2)cc(C#N)n1C	919044306	MFCQWZVARMIHQQ-YBFXNURJSA-N	437.500	1.516	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)c1ccc(F)c(S(=O)(=O)NC(C)(C)C)c1	920008749	ZUQVHGZDBGDAIQ-UHFFFAOYSA-N	437.493	1.915	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)NCc1cccnc1N1CCN(C)CC1	921247249	CIPLJXCJRWSUPV-UHFFFAOYSA-N	442.520	1.142	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)Cn2nc(-c3ccccc3)oc2=O)CC1	1116085512	NQRCZIMKHNBIKY-UHFFFAOYSA-N	445.476	1.298	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)[C@@H]2CC(=O)N(Cc3ccccn3)C2)CC1	1116088706	QVRIYBONJDGQPP-MRXNPFEDSA-N	445.520	1.225	50	20	IDGD	
C[C@H]1CN(Cc2csc(NC(=O)NNC(=O)COc3ccccc3O)n2)C[C@@H](C)O1	1318325997	GAVIHKAXKQFTRU-BETUJISGSA-N	435.506	1.690	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)c1ccc2nnc(C(F)F)n2c1	1319622265	FHTDTRCNBMFCQF-UHFFFAOYSA-N	443.458	1.640	50	20	IDGD	
CCN1CCN(C(=O)Cc2ccc(NC(=O)NNC(=O)c3ccc(OC)cc3)cc2)CC1	1320423803	BXEMNWUXFVHVOX-UHFFFAOYSA-N	439.516	1.868	50	20	IDGD	
CCS(=O)(=O)Nc1cc(OC)ccc1S(=O)(=O)NNC(=O)c1ccc(OC)cc1	1336104707	FLPHAAQTWRARJG-UHFFFAOYSA-N	443.503	1.089	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2ccnc(OC3CCC3)c2)cc1	1336290132	UEZMMWUZDPKBRH-UHFFFAOYSA-N	432.502	1.403	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnc4sc(C)cn4c3=O)C2)C1	1777988963	FLIXNWOYXXGKGS-AUUYWEPGSA-N	438.937	1.525	50	20	IDGD	
CC(C)NC(=O)OC(C)(C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Cl)C1	1778025359	QLQRJRKSKOXPJE-BIENJYKASA-N	435.924	1.948	50	20	IDGD	
O=C(c1ccn2ccnc2c1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1778566668	BLGGWFGSWRZHAK-RHSMWYFYSA-N	425.258	1.468	50	20	IDGD	
O=C(c1c[nH]c2cnccc12)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1778753525	POHKYBACVSOYAX-WMLDXEAASA-N	425.258	1.697	50	20	IDGD	
O=C1COc2ccc(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)[C@@H](F)Cl)C4)cc2N1	1779049294	LFDMKROMMPYMOQ-WRWLIDTKSA-N	439.871	1.679	50	20	IDGD	
COc1cc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](F)Cl)CCO3)c([N+](=O)[O-])cc1O	1780193911	AQMXALABBCGFFT-RHSMWYFYSA-N	431.804	1.287	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCc1cncnc1)C2)[C@@H](F)Br	1780771515	JRLHYPXKQLBCMN-QGPMSJSTSA-N	443.317	1.614	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1C[C@@]13C(=O)Nc1ccccc13)CCO2	1781221362	CPVGQUXIEFBXCQ-KFVVBQDRSA-N	431.920	1.744	50	20	IDGD	
CO[C@H](C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1)c1ccccc1	1781328590	TVXHLHHTTUHZTN-MPGHIAIKSA-N	429.286	1.895	50	20	IDGD	
COc1cc(C#N)cc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](F)Br)C3)C2)c1	1781334435	NWKYDDQAWUXKDL-MAUKXSAKSA-N	440.269	1.701	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(NC(C)=O)c(O)c3)C2)C1	1782135912	OJGXAZJDDHPJOG-YWZLYKJASA-N	439.896	1.048	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cn1nnc3ccccc31)C2	1782172461	VKOZHIWSSZEUHZ-RRMPHLOHSA-N	449.939	1.199	50	20	IDGD	
CN1CCC[C@H]1C(=O)N1CCO[C@]2(CCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1	1782864114	QXPAGRCIUMKGGO-BIQJICTHSA-N	444.482	1.796	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)CC34CCCN3CCC4)CCO2)C1	1783538382	VEFNZXQKWYOLSJ-BEFAXECRSA-N	428.371	1.618	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(CCN(C(=O)Cn3cnc4ccccc43)C2)C1	1783747165	HJHRYIHMOQMEPY-IBGZPJMESA-N	435.322	1.651	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)Cc3cc4ccccc4n3C)CCO2)C1	1783867847	BWILDVKOJATSCU-XMSQKQJNSA-N	433.936	1.805	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H]3CCC[C@@H](C(=O)OC)C3)C2)C1	1783869885	XDHUXPBJDMBLHO-QOIOWGMHSA-N	430.929	1.050	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cn4c(Cl)cccc4n3)CCO2)C1	1783876240	XIGJGKPIAMIFQE-ORAYPTAESA-N	441.315	1.685	50	20	IDGD	
C#CCCCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)CCO2	1783907760	KXZUIAAZFHWVQX-JOCHJYFZSA-N	443.456	1.767	50	20	IDGD	
COC(=O)c1ccc(CC(=O)N2CCO[C@@]3(CCN(C(=O)C(Cl)Cl)C3)C2)cc1	1783949931	HRYJKPRKZTWHPH-IBGZPJMESA-N	429.300	1.649	50	20	IDGD	
CC(=O)N[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)Br)C[C@@H]21)C(C)(C)C	1784310531	FGLJKMPXHBPEQE-VLVIQNCWSA-N	446.386	1.300	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc4ncnn4c3)C[C@@H]21	1784620806	NDGVRIGDVOOASB-XSLAGTTESA-N	433.940	1.659	50	20	IDGD	
Cn1cc(CCC(=O)NC2(c3ccc(NC(=O)c4ccc(B(O)O)cc4)cc3)CCC2)cn1	1788140707	LWIVSBHLPZDOHT-UHFFFAOYSA-N	446.316	1.480	50	20	IDGD	
C[C@@H]1Oc2ccc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)[C@H](F)Cl)C[C@@H]43)cc2NC1=O	1789261856	DQPBFWKMCFERRA-CFXSOUKZSA-N	439.871	1.534	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccnc1S	1792577850	XSGACGXRKPSAJG-JWBKOJIWSA-N	440.529	1.756	50	20	IDGD	
CC(C)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1[nH]cnc1-c1cccnc1)C2	1792784090	OPBMQCGRFZFUQW-MUJYYYPQSA-N	431.924	1.940	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)c1	1794065375	NODXSTMUGCJEOH-WKCHPHFGSA-N	436.317	1.314	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)nc(Cl)c1	1794415639	GPDZABUILRUXLM-OXIQGZBJSA-N	446.729	1.817	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(OC(F)F)cn1	1794456853	HPCPZHDQPLFELJ-FVCICTRLSA-N	443.523	1.738	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cncn1-c1ccncc1	1794464652	PTLFUTNBRUACMD-CWPLJXCYSA-N	443.580	1.322	50	20	IDGD	
CCc1[nH]nc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCBr)c1Cl	1795112363	BBBQCPUUUORMPY-WDAIWFPHSA-N	433.734	1.614	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C1\C(=O)Nc3ccccc31)C2	1795115733	JXWMTBAREJWUDM-LCKYFGFMSA-N	448.317	1.397	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2)c1cc2sccn2c1	1796111888	CTTOTRLKJVTWPA-YWVIFJGQSA-N	426.336	1.989	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](O)[C@H](C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](F)Cl)C1	1796809439	MPMGDRAORRTJOL-UKRFAEJPSA-N	447.935	1.777	50	20	IDGD	
Cc1c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CCC(=O)NN(C)C)C3)nc2ccccn12	1797366775	WPDZXSFZPRGXPF-BJWYYQGGSA-N	426.521	1.268	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CO[Si](C)(C)C)cc1O	1797957241	HNFAOOPKWXEIEV-CWPLJXCYSA-N	449.580	1.405	50	20	IDGD	
CSc1ncccc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Br)C2	1798329890	MPKKGFZFLKQLHS-NRWUCQMLSA-N	428.352	1.790	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1c(F)cccc1F)c1cccc(B(O)O)c1	1799731861	AFWRRCZWIHGZDZ-BJWYYQGGSA-N	428.244	1.139	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc2c1NC(=O)C2	1800031386	QYJHYXBVSYZGPA-KNLUSZGBSA-N	440.327	1.621	50	20	IDGD	
CC(C)(C)CCCCCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2	1800668862	OANUHVFSTAIESD-HATOLVCRSA-N	444.381	1.566	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/c1ccc([N+](=O)[O-])o1)C2	1800970689	HFWKNEYWUQGUBO-BLFFOYFLSA-N	427.841	1.044	50	20	IDGD	
C[C@H](S)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](Br)Cc1ccccc1)C2	1800987440	QNBZZBJCCHHPGM-RKOFLFEYSA-N	441.391	1.901	50	20	IDGD	
COc1ccc(F)cc1CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)Br)C2	1801101700	RJTWTVRTMDNQGB-NASWQRNTSA-N	443.313	1.750	50	20	IDGD	
COC[C@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1=NN(c3ccccc3)C(=O)C1)C2	1802277229	RNVALLWOLYIDHW-ORQFMDKSSA-N	432.908	1.671	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CSc2ncccn2)[C@H]1c1cccnc1)[C@@H](O)CCl	1803137931	FDFRLMYRIUKZEF-ZOBUZTSGSA-N	435.937	1.269	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cnc3ccccn23)[C@@H]1c1cccnc1)[C@H](O)CCl	1803138538	CFYPARKMCXVEFL-KVSKMBFKSA-N	427.892	1.649	50	20	IDGD	
Cc1nc2ncccn2c1C(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]1c1cccnc1	1803142473	DOEBJDXFNYFYSL-SOLBZPMBSA-N	442.907	1.352	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@@H](CNC(=O)c2cc(O)ncn2)[C@@H]1c1cccnc1	1803736759	JZFTVPBTKWGRBT-IFIJOSMWSA-N	448.321	1.928	50	20	IDGD	
O=C(Cc1cccnc1Cl)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1	1804357968	ACJPVRMKNUEFCG-JZXOWHBKSA-N	437.327	1.978	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H](CNC(=O)c2ccc(O)nn2)[C@H]1c1cccnc1	1805263886	ALWDTHPPCUCNBP-SUYBPPKGSA-N	448.321	1.928	50	20	IDGD	
O=C(/C=C/C(=O)N1CCC2(CCCN(C(=O)[C@@H](O)CCl)C2)CC1)NCc1ccco1	1805522825	MEUTVHFKRWTCID-BDUNBXCCSA-N	437.924	1.283	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CCC(F)(F)F)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1	1807370553	GSAZJZOQLDVHMZ-QFBILLFUSA-N	449.238	1.424	50	20	IDGD	
Cc1ccnc(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)c1	1807374204	FGIFOXJHBRHESK-KNQAVFIVSA-N	444.300	1.098	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H]2[C@H]3COC[C@H]32)[C@H]1c1cccnc1)[C@H](F)Br	1808680031	GOLMOTZNVVARPR-DERJNBNXSA-N	426.286	1.670	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)c3cn4ccccc4n3)CC2)C1	1809978156	NYBUFCMTVJRTMX-UHFFFAOYSA-N	446.316	1.173	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccon2)n[nH]1	1816591467	NAUOEJVAWHPYGM-PDYUXYPTSA-N	438.448	1.838	50	20	IDGD	
Cc1cc(/C=C/C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)no1	1817472031	DCDMQYNMTLKUSU-YXBWYFRISA-N	449.276	1.405	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](O)CCl)CC2)c1cc2ncsc2[nH]1	1820217171	QVYNQUNGKSOKMF-WRWORJQWSA-N	425.923	1.906	50	20	IDGD	
C[C@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)c3n[nH]cc3[N+](=O)[O-])sc2C1	1820302557	HHDSMCQUZDVHEA-BQBZGAKWSA-N	443.283	1.784	50	20	IDGD	
CC[C@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1820857096	YNUFCSRKGAMIGN-ZFWWWQNUSA-N	433.900	1.732	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@H]1c1cc(NC(=O)C[C@](C)(O)CC(=O)O)n[nH]1	1822413558	IXZYYRONFXXLNJ-ZMNCSTGQSA-N	445.314	1.801	50	20	IDGD	
O=C([C@@H]1ON=C(c2ccccc2)O1)N1CCC([C@H]2CCCCN2C(=O)[C@H](O)CCl)CC1	1824185494	FFGSTLNYQLKFBZ-HMFYCAOWSA-N	449.935	1.941	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H]1CCC(=O)N1)CC2	1825445248	QORJBGJQLPWDAA-ATZCPNFKSA-N	429.340	1.507	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CNC(=O)N(C)C)CC2	1825632115	PKINLGAOEKBSBX-BDAKNGLRSA-N	432.344	1.110	50	20	IDGD	
O=C(CCc1ccccn1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827050743	XFAPYSZCAJRPHJ-QHCPKHFHSA-N	449.360	1.628	50	20	IDGD	
O=C(c1n[nH]c2c1CS(=O)(=O)C2)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](F)Cl)CC1	1827607580	IEDRUUBMXCKZSF-GOEBONIOSA-N	446.932	1.606	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3=COCCC3)C2)C1	1830544462	YWWUJVFGQGODQB-KDOFPFPSSA-N	431.327	1.168	50	20	IDGD	
Cc1cccc(Cl)c1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1830733012	CTSCJPPYZRWPQK-KXBFYZLASA-N	431.316	1.318	50	20	IDGD	
CCCOc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)cc1	1830733846	VSSQJNDHPOYQFJ-GHTZIAJQSA-N	440.924	1.145	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3n[nH]c4c3CC[C@H]4C)C2)C1	1831646857	NKRFXFSNCGOTFC-IVZHQMGZSA-N	438.956	1.937	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(F)(F)C(F)F)CCO2	1832183866	XZGOCXIQXZOWRF-YGRLFVJLSA-N	449.239	1.374	50	20	IDGD	
O=C(Cc1ccc2c(c1)CCC2)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1832508347	IZEJBUPWKJPGIL-OAQYLSRUSA-N	441.355	1.978	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)CCN2CCCC2)CC1	1832970128	LTXACWOZDLMLKX-FQEVSTJZSA-N	435.613	1.465	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)/C=C/c3ccco3)CCO2)C1	1833078566	JDUSIXQQOPMSLH-HKVCONOFSA-N	431.316	1.986	50	20	IDGD	
CCc1ncccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)Br)C2)C1	1833517811	HQSXSSSXADDLIH-AUUYWEPGSA-N	440.338	1.497	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(C(C)(C)C)n[nH]3)CCO2)C1	1837993923	MDJYTNMNFIDKOZ-VLIAUNLRSA-N	442.944	1.031	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CN(C)C(=O)OC(C)(C)C)C2)C1	1839143978	NFOKSEKXFUWWJH-QRWLVFNGSA-N	447.960	1.327	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCn3nc(C)cc3C)C2)C1	1839149078	SSXZAFVUKHJMHE-FXAWDEMLSA-N	426.945	1.364	50	20	IDGD	
Cc1nc(C)c(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)o1	1839153874	UOBUZYSEURYTEW-MSOLQXFVSA-N	434.320	1.598	50	20	IDGD	
CC(C)c1nc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)co1	1839197607	BUQRVJMTJLOJOM-SUMWQHHRSA-N	448.289	1.559	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(O)ccc3F)CCO2)C1	1839293519	MWIWMVCKFNAJJC-FQEVSTJZSA-N	428.888	1.866	50	20	IDGD	
O=C(CCc1cccc(O)c1)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840190897	UBWGXFXQEQAVPC-IBGZPJMESA-N	431.316	1.585	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@]1(O)CCN(C(=O)OC(C)(C)C)C1)C2	1841670637	JIUFNWHTKRJELI-VFNWGFHPSA-N	443.972	1.969	50	20	IDGD	
O=C(Cc1c(F)cccc1Cl)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843010325	DIYVJJZQIHGAAF-UHFFFAOYSA-N	430.672	1.219	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@@H](C)C(=O)N2CC3(CCCN3C(=O)[C@H](F)Cl)C2)cc1	1843361448	HRXIKYGLGQOBPD-ZFWWWQNUSA-N	431.917	1.400	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCCC12CN(C(=O)CCN1CCOCC1)C2	1845870791	CNRDFJYNQDDHEG-LDADJPATSA-N	444.482	1.797	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H]2OC[C@H](C(=O)N3CCCC34CN(C(=O)[C@@H](F)Cl)C4)[C@H]2C1	1846141741	IMUACXWGEPQVHN-LXTVHRRPSA-N	445.919	1.606	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@H](Cc2cccc(F)c2)NC(C)=O)C1	1847014406	LFMJNVRCBWKLTK-ROUUACIJSA-N	439.915	1.330	50	20	IDGD	
O=C([C@@H](F)Br)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1	1847038184	FMSUOHCLIGEMNW-SJDLMVEWSA-N	429.242	1.711	50	20	IDGD	
CN(CC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)C12CC(F)(C1)C2)NC(=O)NCc1ccccc1	1847852683	AQTWBQGJDOXQGQ-FFACFXHASA-N	443.523	1.427	50	20	IDGD	
C[C@H]1Oc2ccccc2O[C@@H]1C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	14330732	GEDHXECJKZFIDM-KUHUBIRLSA-N	445.497	1.461	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)Cn2c(=O)ccn(Cc3ccccc3)c2=O)cc1	14938778	RTAWYMUTKLFOIS-UHFFFAOYSA-N	438.509	1.306	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2)cc(OC)c1OC	15562743	FXZXLLAFEAWYJJ-UHFFFAOYSA-N	425.419	1.552	50	20	IDGD	
C[C@H](NC(=O)OCc1ccccc1)C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	16594300	SWGBYWGNOZLQQA-AWEZNQCLSA-N	448.501	1.013	50	20	IDGD	
C[C@@H](NC(=O)c1ccccc1)C(=O)NNC(=O)c1ccc(CSc2nncn2C)cc1	26751029	GVQDOUYYQIXORE-CQSZACIVSA-N	438.513	1.687	50	20	IDGD	
O=C(N/N=C1/C(O)=Nc2ccc(F)cc21)c1cccc(S(=O)(=O)N2CCOCC2)c1	38203396	PORHYAAWFFTOBM-UHFFFAOYSA-N	432.433	1.582	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NCCc1ccc(F)c(Br)c1	725872842	HLLLTLUMGBERPO-UHFFFAOYSA-N	443.298	1.953	50	20	IDGD	
CS(=O)(=O)Nc1cc(C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)ccc1F	725880108	XBXJUNJPBNWYSV-UHFFFAOYSA-N	433.421	1.163	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)c1cc(I)ccc1O	725902845	VIGQDTXWHMDKME-UHFFFAOYSA-N	445.238	1.249	50	20	IDGD	
Cc1ccc(OCCCNC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1	726262758	OUEKUZRYIUKYGU-UHFFFAOYSA-N	448.545	1.723	50	20	IDGD	
CO[C@H](C)CCNC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	726714379	QKFAUNFDZZNVOS-GFCCVEGCSA-N	426.520	1.918	50	20	IDGD	
CN(Cc1ccccc1)CC1CCN(C(=O)NNC(=O)CNC(=O)c2ccco2)CC1	727480359	YYBWKEOKPROHNQ-UHFFFAOYSA-N	427.505	1.594	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)COc1ccc(C#N)cc1)c1cccc(S(=O)(=O)N(C)C)c1	727610432	QQVQCBCHKKWQGN-CQSZACIVSA-N	445.501	1.279	50	20	IDGD	
O=C(CS(=O)(=O)Cc1cccc(Br)c1)NNC(=S)NCC1CCC1	727865050	GCGBERZENLZYKT-UHFFFAOYSA-N	434.381	1.659	50	20	IDGD	
O=C(COC(=O)c1cc(F)c(Cl)nc1Cl)NNC(=O)[C@@H]1COc2ccccc2O1	728343828	QRVJYDOGFRQTRQ-LBPRGKRZSA-N	444.202	1.672	50	20	IDGD	
CN(C)CCCOc1ccc(CNC(=O)NNC(=O)Cc2nc3ccccc3n2C)cc1	728751527	GBTOXCDCGAXTND-UHFFFAOYSA-N	438.532	1.977	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CS(=O)(=O)Cc2ccc(Br)cc2)c1	728826474	JRDSILCGANRAFP-UHFFFAOYSA-N	436.287	1.697	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNS(=O)(=O)c2cc(C(=O)O)sc2C)cc1	729663221	YDDXFLZPQFQDME-JTQLQIEISA-N	428.488	1.930	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNS(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2	729666990	AOPSQZFRMGRFPE-UHFFFAOYSA-N	432.414	1.330	50	20	IDGD	
COC(=O)c1ccccc1-c1ccc(C=NNC(=O)CSc2nnc(O)nc2O)o1	730559193	YPHAFEXCXPYTTH-UHFFFAOYSA-N	429.414	1.572	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)CN1C(=O)N[C@@](C)(c2ccc(F)cc2)C1=O)c1ccccc1	731998181	ZEFQDDFDFLXJBR-JTSKRJEESA-N	426.448	1.934	50	20	IDGD	
C=CCOc1ccccc1CNC(=O)NNC(=O)c1sc(N2CCOCC2)nc1C	732235459	CNQPBBBNKPSUEG-UHFFFAOYSA-N	431.518	1.997	50	20	IDGD	
C[C@H]1Cc2cc(C(=O)NNC(=O)c3cnn(-c4ccccc4)c3)ccc2N1S(C)(=O)=O	733110012	NEWLROVGFNGBCD-AWEZNQCLSA-N	439.497	1.658	50	20	IDGD	
CC(C)OCCCn1c(NNC(=O)[C@@H]2CC(=O)N(C3CC3)C2)nc2ccccc2c1=O	733265579	GUWFNMPLBIRSQY-OAHLLOKOSA-N	427.505	1.666	50	20	IDGD	
CCOc1ccc(/C=C(\C#N)C(=O)N2CCN(CC(=O)Nc3nncs3)CC2)cc1	733959522	ZVZALJDGTAIYGU-LFIBNONCSA-N	426.502	1.627	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)Nc2cccn(C)c2=O)cc1	733959870	NQAFUARGKFPBJF-FOWTUZBSSA-N	446.467	1.678	50	20	IDGD	
O=C(COC(=O)[C@H]1CCCN(Cc2ccccc2)C1)NNC(=O)c1cccc([N+](=O)[O-])c1	741323293	YTYJTCQDVFAWNL-SFHVURJKSA-N	440.456	1.811	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)/C=C\c1ccccc1)C(=O)NNc1ncnc2[nH]cnc12	743471270	XRBCDYISMOBDBQ-QQBNSCQMSA-N	447.546	1.508	50	20	IDGD	
COc1cc(OCC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)ccc1[N+](=O)[O-]	743830128	OETJWYATFAUESJ-UHFFFAOYSA-N	438.418	1.239	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)CNC(=O)NCc2ccc(Cl)cc2)c1	744941406	KHUWXSUPIWDSJK-UHFFFAOYSA-N	432.864	1.452	50	20	IDGD	
C[C@H](CCc1ccccc1F)C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	745575434	GMCGDQBZTBDYDD-KUHUBIRLSA-N	430.432	1.925	50	20	IDGD	
Cc1ccc(NC(=O)[C@@H]2CCCN(CC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)C2)nc1	746456948	GEQLOAYHTMKJHQ-MRXNPFEDSA-N	440.460	1.410	50	20	IDGD	
O=C(NNC(=O)c1cc(F)c(F)cc1F)c1cccc(S(=O)(=O)N2CCCC2)c1	746765902	ASGZAFBXYPNSLY-UHFFFAOYSA-N	427.404	1.963	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2cnc(C(C)C)[nH]2)c1	747596024	VFUXUMYFEIJGOF-UHFFFAOYSA-N	443.551	1.187	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)c2cc(N3CCNC3=O)ccc2Cl)c1	747718393	YVVBYOQRTYRSQA-UHFFFAOYSA-N	430.848	1.796	50	20	IDGD	
Cc1c(C(=O)NNC(=O)Cc2cccc3ccccc23)cnc2c1c(=O)n(C)c(=O)n2C	747754154	QDWQYMIDTKLQES-UHFFFAOYSA-N	431.452	1.098	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2nn(-c3ccc(F)cc3)cc2O)cc(OC)c1OC	748014839	SXIHVAIBWBIRHO-UHFFFAOYSA-N	430.392	1.818	50	20	IDGD	
Cc1cc(C(=O)NNc2ccc(Br)cc2F)nc2c1c(=O)n(C)c(=O)n2C	748189011	ZJZATIGLNOYVQZ-UHFFFAOYSA-N	436.241	1.599	50	20	IDGD	
O=C(CSCC(=O)N1CCOCC1)NNc1nc(-c2ccccn2)nc2c1CCC2	748337601	JJEUDBYJLFJYKM-UHFFFAOYSA-N	428.518	1.062	50	20	IDGD	
COc1cc(OC)cc(N2CC[C@@H](NC(=O)NNC(=O)[C@H]3COc4ccccc4O3)C2)c1	748662995	YGSXUINYAYFNAI-JLTOFOAXSA-N	442.472	1.453	50	20	IDGD	
CCOC(=O)C1CCN(S(=O)(=O)NNC(=O)c2cc3c(s2)CC[C@@H](C)C3)CC1	748673597	CPIJZIHIOLORCH-GFCCVEGCSA-N	429.564	1.627	50	20	IDGD	
COC(=O)c1cc(C(=O)OC)cc(S(=O)(=O)NNC(=O)c2cc3ccccc3o2)c1	749867419	WOCQLCDIUQJVHF-UHFFFAOYSA-N	432.410	1.629	50	20	IDGD	
COC[C@@H](C)n1c(C)cc(/C=C(\C#N)C(=O)NCCNS(=O)(=O)Cc2ccon2)c1C	750075213	AXTZLXROWKZYIR-BFERYNQYSA-N	449.533	1.443	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)NCCNS(=O)(=O)Cc2ccon2)c(C)n1CC(C)C	750077985	WKASDTYPVNNYFV-VCHYOVAHSA-N	433.534	1.892	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1)N[C@@H]1CC(=O)N(C2CC2)C1	750656273	WWGCHZIKNOGTMY-IRLDBZIGSA-N	447.539	1.707	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)c1cn(-c2ccccc2C(F)(F)F)nn1	751209581	SCMCTBKBIWWNNE-UHFFFAOYSA-N	438.391	1.539	50	20	IDGD	
Cc1oc(S(=O)(=O)N(C)C)cc1C(=O)NNC(=O)c1cc(F)ccc1Br	753302269	GIKSLXOMVVDFNF-UHFFFAOYSA-N	448.270	1.815	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)Nc1ccc(C(=O)NC2CCOCC2)cc1	753893248	KJFZERNYGPUFIR-UHFFFAOYSA-N	428.445	1.533	50	20	IDGD	
CCCN(CCNC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)C(=O)OC(C)(C)C	754120341	DSSBFMJZYSFULR-UHFFFAOYSA-N	442.538	1.681	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCOCC2)cc1NC(=O)NNC(=O)CC1CCCC1	755409688	WCSIFSSNVLPSPK-UHFFFAOYSA-N	440.522	1.449	50	20	IDGD	
O=C(NNC(=O)c1cnccn1)Nc1cccc(S(=O)(=O)NC2=NCCCCC2)c1	755497110	YNNZSFLFAZYPFE-UHFFFAOYSA-N	431.478	1.194	50	20	IDGD	
COc1ccc(S(=O)(=O)NC2CC2)cc1NC(=O)NNC(=O)c1ccc(Cl)nc1	755616112	WHSZRNPYIJBKPF-UHFFFAOYSA-N	439.881	1.651	50	20	IDGD	
Cc1ccc(-n2cnnn2)cc1NC(=O)NNC(=O)c1cc(Br)ccc1O	755825301	UAWFXJKDZGQALR-UHFFFAOYSA-N	432.238	1.905	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)[C@H](C)Oc2ccc(C(C)=O)cc2)cc1-n1cnnn1	756748011	UUOQQJBAESUKHF-ZDUSSCGKSA-N	439.432	1.494	50	20	IDGD	
C[C@H]1CN(c2nccnc2C#N)CCN1C(=O)NNC(=O)c1cc(Br)c[nH]1	756913326	FKGZJWKOFMNTTL-JTQLQIEISA-N	433.270	1.004	50	20	IDGD	
COc1ccccc1N1CC[C@@H](NC(=O)NNC(=O)[C@H](C)Oc2ccccc2F)C1=O	757284057	BYKPCUKQZXYTSC-DZGCQCFKSA-N	430.436	1.738	50	20	IDGD	
C=CCn1c(=O)c2ccccc2n2c(SCC(=O)NN=c3cc[nH]cc3Cl)nnc12	757419033	RKVIFIYOGMWWHK-UHFFFAOYSA-N	441.904	1.936	50	20	IDGD	
O=C(NN=Cc1cc(O)c(O)c(Br)c1)c1csc(N2CCOCC2)n1	757564669	XEEIXDZGXOUUMC-UHFFFAOYSA-N	427.280	1.917	50	20	IDGD	
COCc1nc(C)c(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)s1	758076076	LMXAPAKRUUJMNZ-UHFFFAOYSA-N	438.531	1.457	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)N1CCN(c2nc(F)c(F)cc2F)CC1	758856929	YXTSOIMUMIVVIU-UHFFFAOYSA-N	433.394	1.632	50	20	IDGD	
O=C(NNC(=O)N1CCN(c2nc(F)c(F)cc2F)CC1)c1cnn(-c2ccccc2)c1	759028929	BICZZIXLBPLPPY-UHFFFAOYSA-N	445.405	1.861	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)N=c2cc[nH]cc2I)cc1	760023947	BIPPSRJVBVAWEZ-UHFFFAOYSA-N	426.214	1.648	50	20	IDGD	
CN1C(=C(C#N)C(=O)COC(=O)c2ccc(=O)n(-c3cnn(C)c3)c2)N(C)c2ccccc21	760846800	MXPYJJZMIQBHKH-UHFFFAOYSA-N	444.451	1.618	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc(C)c1F	763378142	AOADMAVOQLQFHS-UHFFFAOYSA-N	435.477	1.538	50	20	IDGD	
O=C(NNC(=O)c1ccccn1)C(=O)Nc1ccc(C(=O)N2CCCCC2)c(Cl)c1	763462706	AQFMEZKHVAEXRH-UHFFFAOYSA-N	429.864	1.761	50	20	IDGD	
O=C(NNC(=O)c1cccnc1)C(=O)Nc1ccc(=O)n(Cc2ccccc2Cl)c1	763490721	CGUHMLPOBCGVBP-UHFFFAOYSA-N	425.832	1.345	50	20	IDGD	
O=C(NNC(=O)c1cccnc1)C(=O)Nc1ccc(C(=O)N2CCCCC2)c(Cl)c1	763492103	UDSRNOSMRDANMT-UHFFFAOYSA-N	429.864	1.761	50	20	IDGD	
CN1CCC(N2CCC(NC(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)CC2)CC1	763498017	LKZBJHOOFYWDCB-UHFFFAOYSA-N	440.589	1.180	50	20	IDGD	
O=C(NNC(=O)c1c[nH]c2ccccc12)C(=O)Nc1ccc(C(=O)NCC(F)(F)F)cc1	763540882	LTKFUWKRFGGRGO-UHFFFAOYSA-N	447.373	1.860	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)Nc1cccc(Oc2cnccn2)c1	763578950	RVWXLXSXWPHDGO-KRWDZBQOSA-N	435.396	1.195	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)cc1C(=O)N(C)C	763599908	ARAIDIQDJALMAG-UHFFFAOYSA-N	434.456	1.487	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(CCN3CCOCC3)cc2)c1	763631598	ZXHGDPVLHADJQF-UHFFFAOYSA-N	440.500	1.035	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)COc1cc(Cl)c(Cl)cc1Cl	763824442	PVYVLIYPZPZRST-UHFFFAOYSA-N	431.663	1.998	50	20	IDGD	
Cn1c(C2CC2)nc2cc(NC(=O)C(=O)NNC(=O)COc3ccc(F)cc3)ccc21	763843174	POLBLKWBZHORHW-UHFFFAOYSA-N	425.420	1.755	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccn(Cc2ccccn2)n1	763867949	ZDCLRSQIMADODI-ZDUSSCGKSA-N	426.408	1.019	50	20	IDGD	
COc1cc(Br)cc(C)c1NC(=O)C(=O)NNC(=O)Cn1nc(C)cc1C	763884204	DBAYXKFUJYAWQD-UHFFFAOYSA-N	438.282	1.366	50	20	IDGD	
CNC(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)CCSc2ccc(F)cc2)cc1	763894952	IAWLOMYQEOOPEC-UHFFFAOYSA-N	432.477	1.383	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)C(=O)Nc2cccc([C@@H]3CNC(=O)C3)c2)cc1	763897816	GOJPCAYZNIYPDP-HNNXBMFYSA-N	426.498	1.477	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)C(=O)Nc1cnn(-c2ccccc2F)c1	763949064	MXSIGGBDGSJFKG-UHFFFAOYSA-N	449.402	1.302	50	20	IDGD	
O=C(NNC(=O)c1ccc(COc2ccccc2)o1)C(=O)Nc1ccc(-n2nccn2)cc1	763955028	GXRVFSACJBPGPZ-UHFFFAOYSA-N	446.423	1.839	50	20	IDGD	
Cc1ccc(C(=O)NCC(F)(F)F)cc1NC(=O)C(=O)NNC(=O)c1ccccc1C	763956631	SPTUPTCRXFLOBC-UHFFFAOYSA-N	436.390	1.995	50	20	IDGD	
COCCn1cc(NC(=O)C(=O)NNC(=O)c2ccc(Br)cc2Cl)cn1	764059439	VLOWCDGNFQBZQH-UHFFFAOYSA-N	444.673	1.345	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2cccc(NC(=O)c3ccncc3)c2)c1O	764132116	JXUCNMNYHULXDE-UHFFFAOYSA-N	449.423	1.448	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)C(=O)Nc1ccc(N2CCCC2=O)cc1	764205042	XNLPSESEWMGMBB-UHFFFAOYSA-N	447.492	1.204	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)C(=O)Nc2ccccc2N(C)C)c1	764232592	RGCPZBSKIJWNBD-UHFFFAOYSA-N	435.278	1.923	50	20	IDGD	
CCNC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)c2cccc3ncccc23)cc1	764259914	LGWFJDAXMFZDGH-UHFFFAOYSA-N	435.440	1.149	50	20	IDGD	
C[C@H]1CN(Cc2ccccc2NC(=O)C(=O)NNC(=O)Cc2ccccn2)C[C@H](C)O1	764267312	SNFQRRPRNUGPHL-HOTGVXAUSA-N	425.489	1.019	50	20	IDGD	
C[S@@](=O)Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2O)ccc1Cl	764276030	WROSWJRRKOCTLA-GDLZYMKVSA-N	439.877	1.089	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)CCc2ccccc2O)n([C@H]2C[C@H]3CC[C@H]2C3)n1	764281182	LAVPYFAQXJQUCZ-XIRDDKMYSA-N	425.489	1.977	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)C(=O)Nc1cc(F)cc(N2CCOCC2)c1)c1ccccc1	764328024	IWTWLQJVQTZXKZ-LJQANCHMSA-N	428.464	1.942	50	20	IDGD	
COc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NNC(=O)c1ccc(O)c(Cl)c1	764349250	HCPOWIARRRLRHU-UHFFFAOYSA-N	434.836	1.156	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c(C)c1	764351978	VCFOBWRLLLAMIK-UHFFFAOYSA-N	437.456	1.606	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(S(=O)(=O)N3CCCCC3)ccc2C)o1	764371630	PTEFXEGYLNJJGQ-UHFFFAOYSA-N	448.501	1.471	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1ccccc1-n1cccn1	764392581	GSUAENCLIYBDJL-UHFFFAOYSA-N	425.470	1.759	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1ccc(-n2cncn2)c(F)c1	764393871	SHNATKTXCKVZHG-UHFFFAOYSA-N	444.448	1.293	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)cc1C(=O)NC(C)C	764403865	DYRYYKYJPDQAEH-UHFFFAOYSA-N	444.513	1.717	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)Nc3ccc(S(N)(=O)=O)cc3)n[nH]2)cc1	765306316	AOXSNRNBJGBODQ-UHFFFAOYSA-N	428.474	1.753	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)C1=NN(Cc2ccc(F)cc2)C(=O)CC1	765311647	ZLNZEMHRNOXCCC-UHFFFAOYSA-N	449.483	1.756	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)[C@@H](CC(F)F)NC(=O)OC(C)(C)C)c2ccccc2c1=O	765531715	XVLDBAMNXUFZSR-GFCCVEGCSA-N	439.419	1.243	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1ccc2c(c1)CN(C(=O)OC(C)(C)C)CC2	766262402	ZWRDCRTYKWJVEL-UHFFFAOYSA-N	442.476	1.860	50	20	IDGD	
CC(CC(=O)NNC(=O)Cc1ccccc1F)CC(=O)NNC(=O)Cc1ccccc1F	766634024	KGEMWIMIMIIKCS-UHFFFAOYSA-N	446.454	1.461	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)CN1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1	766879316	XYEZHJQCVAFVPQ-IBGZPJMESA-N	427.480	1.720	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)[C@]12CCC(=O)N1c1ccccc1S2	767275767	AJEBOKCGFOPLGD-JOCHJYFZSA-N	439.493	1.857	50	20	IDGD	
Cc1cccc(NC(=S)NNC(=O)[C@H](C)NS(=O)(=O)c2cccc(C#N)c2)c1C	767854616	IUVCKKDTNLGUKF-AWEZNQCLSA-N	431.543	1.860	50	20	IDGD	
C[C@H](CCC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)NC(=O)OC(C)(C)C	768224856	OHDMXAKKFSZCQM-GFCCVEGCSA-N	428.511	1.936	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)[C@H]3CCCCN3C(=O)C(C)C)n[nH]2)cc1OC	768275892	HYBPGNNFJDTOAF-QGZVFWFLSA-N	443.504	1.892	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cc4c(cc3O)OCO4)CC2)cc1	768292216	XCGPTVUZUHZGPW-UHFFFAOYSA-N	426.473	1.008	50	20	IDGD	
COc1ccc(C)cc1N1C[C@H](C(=O)NNc2c(OC)cccc2S(C)(=O)=O)CC1=O	768634446	KAXUWRCWGUVVHT-CQSZACIVSA-N	447.513	1.912	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)NNC(=O)c1cc(Br)c[nH]1	770480966	MMZZITKEYGOOEL-MRVPVSSYSA-N	444.673	1.873	50	20	IDGD	
Cn1nc(O)c2c(C(=O)NNc3nc(O)c4cnn(C(C)(C)C)c4n3)cc(C3CC3)nc21	770956419	SYGKWRFINOAFTC-UHFFFAOYSA-N	437.464	1.909	50	20	IDGD	
CNS(=O)(=O)c1ccc(C(=O)NNc2nc(-c3ccccn3)nc3c2CCC3)cn1	771737393	PAKNGQWTFNJNDV-UHFFFAOYSA-N	425.474	1.087	50	20	IDGD	
COC(=O)c1cc(OC)c(OC)c(OC)c1NC(=O)C(=O)NNc1ccccc1[N+](=O)[O-]	773648070	KGMKSAGEEPADJV-UHFFFAOYSA-N	448.388	1.489	50	20	IDGD	
O=C(NNc1ccc(C(F)(F)F)cn1)c1cccc(S(=O)(=O)N2CCOCC2)c1	775251914	FSOOHHPLEOFDLM-UHFFFAOYSA-N	430.408	1.878	50	20	IDGD	
Cc1c(-c2ccccc2)sc(NC(=O)NNC(=O)CN(C)C)c1C(=O)N1CCOCC1	775681227	CRGJARZTBNJNLV-UHFFFAOYSA-N	445.545	1.910	50	20	IDGD	
CCNS(=O)(=O)c1ccc(F)c(C(=O)NNc2ncc(C(=O)OCC)c(C)n2)c1	778428285	AMRTWJDQZPCKIZ-UHFFFAOYSA-N	425.442	1.156	50	20	IDGD	
Cn1cc([C@@H](CO)NC(=O)NNC(=O)[C@@H]2Cc3ccccc3CN2Cc2ccccc2)cn1	778643078	YFGMKOPDNZFNNY-YADHBBJMSA-N	448.527	1.411	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@H](C(=O)NNC(=O)C(C)(C)c2ccccc2)[C@@H](C)O)cc1	779514890	OXUJRUNQWYAXGH-QAPCUYQASA-N	433.530	1.148	50	20	IDGD	
O=C(CC1(CNC(=O)OCc2ccccc2)CCCCC1)NNC(=O)C(=O)NC1CC1	780226400	BEIAQRJOYVGHKN-UHFFFAOYSA-N	430.505	1.679	50	20	IDGD	
N#Cc1ccc(N2CCC[C@H](NC(=O)NNC(=O)COc3ccccc3C#N)C2=O)cc1	780893508	AKNSCBLCCQIRIR-SFHVURJKSA-N	432.440	1.335	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)c1ccccc1F)C(=O)NNc1ncncc1Cl	781804411	IAPGONZAKAWSAV-LBPRGKRZSA-N	433.918	1.812	50	20	IDGD	
CC(C)(C)OC(=O)N1CCc2ncc(NC(=O)C(=O)NNc3ncncc3Cl)cc2C1	782165035	AXTSBYMRRFDGKC-UHFFFAOYSA-N	447.883	1.900	50	20	IDGD	
COC(=O)COc1ccc(C=NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc1	782223339	QYZHQRUUZZICOS-UHFFFAOYSA-N	445.497	1.787	50	20	IDGD	
CC(C)Oc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)C(=O)NNc1cccc(F)c1	783039403	BEGYXRWPDBFFOZ-UHFFFAOYSA-N	438.481	1.945	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccc(-c3ncco3)cc2)nc1	783264414	PABPSUKYOFSGDR-UHFFFAOYSA-N	444.473	1.505	50	20	IDGD	
C[C@@H]1CCCN(Cc2ccc(NC(=O)C(=O)NNc3ccc(-n4cccn4)nn3)cc2)C1	783433219	OTYQWAKKNDMHKR-MRXNPFEDSA-N	434.504	1.976	50	20	IDGD	
O=C(NNc1ccc(-n2cccn2)nn1)C(=O)N1CCc2ccc(Br)cc21	783436781	QFTHKSJBXIWHFD-UHFFFAOYSA-N	428.250	1.457	50	20	IDGD	
Cc1ncc(-c2ccc(NC(=O)C(=O)NNC(=O)CNC(=O)c3cccs3)cc2)o1	784003502	HLRGKPZRAFVZLF-UHFFFAOYSA-N	427.442	1.227	50	20	IDGD	
O=C(NNc1ccc(Br)cn1)C(=O)Nc1cccc(-c2nnnn2C2CC2)c1	784340912	GPXGBHQUHQDOKH-UHFFFAOYSA-N	443.265	1.914	50	20	IDGD	
Cc1nc(Cn2cc(C(=O)NNC(=O)c3ccc(-c4ccc(F)cc4)s3)nn2)no1	784753745	ZMAKMWANMYFPMQ-UHFFFAOYSA-N	427.421	1.960	50	20	IDGD	
COCCOc1ccc(F)cc1NC(=O)C(=O)NNc1cccc(S(C)(=O)=O)c1	784844524	LJJVMAFHOXQPTL-UHFFFAOYSA-N	425.438	1.336	50	20	IDGD	
CCNS(=O)(=O)c1ccc2c(c1)N(C(=O)C(=O)NNc1cc(F)cc(OC)c1)CC2	785235391	ZXTZDXNVZAEAMR-UHFFFAOYSA-N	436.465	1.165	50	20	IDGD	
CN(C)CCc1ccc(CNC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)cc1	786254001	LQZSQOYADZFTRM-UHFFFAOYSA-N	433.534	1.730	50	20	IDGD	
Nc1c(Cl)ccc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1Cl	786636512	IBYJTBYFLSMKEO-ZDUSSCGKSA-N	440.239	1.720	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)N[C@@H]2CCN(c3cccc(Br)c3)C2)n1	787372175	YRSGRLVAMPHYKX-OAHLLOKOSA-N	435.326	1.872	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)CCC(C)C)cc1S(=O)(=O)N1CCCC1	787541888	FNLZVCCYIJVQCK-UHFFFAOYSA-N	440.522	1.002	50	20	IDGD	
CCCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)cc1	789810950	ASGLVZJRBOQVSA-OALUTQOASA-N	438.484	1.485	50	20	IDGD	
O=C(NNC(=O)[C@H]1OCC[C@H]1c1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl	789813384	SCUNBEVEPVBPHV-BBRMVZONSA-N	432.820	1.907	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)Cn3ccc4ccccc4c3=O)n[nH]2)cc1OC	790556209	CNDOQMKCQGPACG-UHFFFAOYSA-N	447.451	1.870	50	20	IDGD	
O=C(NNc1cccc(F)c1[N+](=O)[O-])c1ccc(F)c(S(=O)(=O)N2CCOCC2)c1	790594688	MOVKRCOEDMMNAU-UHFFFAOYSA-N	442.400	1.651	50	20	IDGD	
O=C(Cc1cc2c(cc1Br)OCCO2)NNC(=O)c1ccc2c(c1)OCCO2	791012266	OADNTMJFOVOSCV-UHFFFAOYSA-N	449.257	1.995	50	20	IDGD	
Cc1c(C(=O)NNC(=O)CCN2C[C@H](C)O[C@H](C)C2)nnn1Cc1ccc(F)cc1F	792207642	DSVMJTPORZFYLI-BETUJISGSA-N	436.463	1.173	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2cc3c[nH]nc3cc2C)c2ccccc2c1=O	792266946	BOJMGRNAYWGLRM-UHFFFAOYSA-N	433.428	1.001	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2cccc(NC(=O)N(C)C)c2C)n1	792373069	WBIMHRMUUPHZGU-UHFFFAOYSA-N	428.497	1.807	50	20	IDGD	
CC(=O)NC[C@@H]1CCn2ncc(C(=O)NNC(=O)[C@@H](C)Oc3cccc(C)c3C)c2C1	792736672	OLGNGJOLRCJOHJ-NVXWUHKLSA-N	427.505	1.427	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)c(OC)c(C)c1OC	797006008	WLFWKMIUCSGUQD-UHFFFAOYSA-N	440.456	1.762	50	20	IDGD	
CN(C)[C@@H](C(=O)NNC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1)c1cncn1C	798153776	FIDNQBXRCYAKGL-LJQANCHMSA-N	444.499	1.732	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)/C=C/c2cc3cnn(C(C)C)c3[nH]c2=O)cc1C	798307666	BKUHZLXSDRGPCP-SOFGYWHQSA-N	436.472	1.722	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@@H]2C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)cc1	798986987	DRLISEOXJILTPT-QGZVFWFLSA-N	448.520	1.752	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)[C@H](C)Oc2ccc(Br)cc2)C[C@@H](C)O1	799101131	LEEGCRVIVOLZMH-MJBXVCDLSA-N	428.327	1.863	50	20	IDGD	
Cc1ccc(-c2n[nH]c(SCC(=O)NNC(=O)[C@H]3COc4ccccc4O3)n2)cc1	799324617	IRALYLODOMSKEW-MRXNPFEDSA-N	425.470	1.860	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNS(=O)(=O)c1ccc(C(=O)N(C)C)cc1	799543279	KHASADLXYZCOQK-LBPRGKRZSA-N	425.894	1.819	50	20	IDGD	
Cc1c(C(=O)NNC(=O)Nc2ccc3c(c2)OCO3)nnn1CCOc1ccc(F)cc1	802095419	CSAPKVXFKGEPQI-UHFFFAOYSA-N	442.407	2.000	50	20	IDGD	
Cc1nnnn1[C@H](Cc1ccc(F)cc1)C(=O)NNC(=O)Nc1ccc2c(c1)OCO2	802100852	AJHZBLPQYQWOIT-OAHLLOKOSA-N	427.396	1.486	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)N[C@H]1CCN(C(=O)Nc2ccccc2)C1	802495532	JFRVYWOCRUOLJD-AWEZNQCLSA-N	435.444	1.586	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)C(=O)Nc1ccc(OC(F)F)nc1	802570935	BQPSCGYHCLCRTB-UHFFFAOYSA-N	441.416	1.206	50	20	IDGD	
CCCCn1c(CCC(=O)NN(C)C(=O)OC)nc2cc(S(=O)(=O)N(C)C)ccc21	804125559	GVVLMEATXVQWKO-UHFFFAOYSA-N	439.538	1.749	50	20	IDGD	
CN(C)S(=O)(=O)C[C@H](NC(=O)NNC(=O)c1cc2c(s1)CCC2)C(F)(F)F	805767281	HNDZZCNEHGLQFJ-NSHDSACASA-N	428.458	1.003	50	20	IDGD	
Cc1ccccc1[C@@H]([C@@H](C)NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)N(C)C	807406507	RWFAGJYZDOAUGX-FOIQADDNSA-N	436.516	1.877	50	20	IDGD	
Cc1cc([N+](=O)[O-])ccc1NNC(=O)C(=O)Nc1ccc(CN2C(=O)CNC2=O)cc1	807455321	CISWXBBHWYGCLE-UHFFFAOYSA-N	426.389	1.037	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(Br)cc1)NNC(=O)c1ccc(Cl)nc1	810154941	IDTBKFHZHFWMDQ-UHFFFAOYSA-N	447.698	1.237	50	20	IDGD	
COC[C@]1(C(=O)NNC(=O)Cc2cn3ccccc3n2)CCN(C(=O)OC(C)(C)C)C1	810465085	KFINLHFXVFVZIJ-NRFANRHFSA-N	431.493	1.298	50	20	IDGD	
NC(=O)Cc1ccc(CNC(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)cc1	812481821	QWFOMOXBINBNFF-UHFFFAOYSA-N	430.408	1.834	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@H]2CCCN(c3ccccc3)C2=O)cc(OC)c1OC	814362115	PXESXSNXUYTBJQ-MRXNPFEDSA-N	427.457	1.917	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)N2CC[C@@H](CS(C)(=O)=O)C2)N(C)c2ccccc21	816997229	BABYNTLAUQDJTI-OAHLLOKOSA-N	430.530	1.550	50	20	IDGD	
CS(=O)(=O)Nc1ccc(/C=C\C(=O)NNC(=O)c2nnc(O)c3ccccc23)cc1	818323979	NVBVHVBQDIFQTQ-FLIBITNWSA-N	427.442	1.181	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)c1ccc(SCc2cn3ccccc3n2)cc1	818853359	JILJSNYUUNHBOE-HNNXBMFYSA-N	444.538	1.822	50	20	IDGD	
O=C(COC(=O)COc1ccc2c(c1)CCC(=O)N2)NNC(=O)c1cccc(Cl)c1	825357462	UHZLUVMVSBNWAH-UHFFFAOYSA-N	431.832	1.608	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)CCC(=O)N2CCC(c3ccccc3)=N2)C[C@@H](C)O1	912919126	KIYNCACAOWXAFJ-CALCHBBNSA-N	429.521	1.050	50	20	IDGD	
CCc1c(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cnn1-c1ccccc1	914333612	JZYVVNVOXSYVRS-UHFFFAOYSA-N	447.904	1.810	50	20	IDGD	
Cc1cc(C)n([C@@H](C)CC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)n1	915685709	JIJKNWYNHRGDAM-INIZCTEOSA-N	433.534	1.697	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2cc(-c3c(C)nn(C)c3C)[nH]n2)c2ccccc2c1=O	915696112	JFPAQKHEQSAXLW-UHFFFAOYSA-N	448.487	1.622	50	20	IDGD	
COC(=O)c1cc(CNC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])ccc1OC	915890750	DZJKFFNLGBFHGN-UHFFFAOYSA-N	432.389	1.299	50	20	IDGD	
COc1cc(C=NNC(=O)c2ccc3c(c2)OCO3)ccc1OCC(=O)N1CCOCC1	916289224	IBUXXWSIPMHVGR-UHFFFAOYSA-N	441.440	1.425	50	20	IDGD	
NS(=O)(=O)c1cccc(CNC(=O)NNC(=O)c2ccc(COc3ccccc3)o2)c1	916625798	QGADKEUGJDBLTH-UHFFFAOYSA-N	444.469	1.650	50	20	IDGD	
CC(=O)NCCc1ccc(S(=O)(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)s1	918724821	DHCWMCHUOJIBOT-UHFFFAOYSA-N	425.576	1.953	50	20	IDGD	
CNC(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccc(Br)cc2)c1	919880115	ZWIBBIXYZPUJHP-UHFFFAOYSA-N	427.280	1.824	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)NC[C@H](c1ccc(F)cc1)N1CCOCC1	919897954	SXZOXDHWIDQUHF-LJQANCHMSA-N	430.480	1.781	50	20	IDGD	
CCCc1noc2nc(-c3ccco3)cc(C(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)c12	920217223	XNBULJOOFVPPPB-LLVKDONJSA-N	432.458	1.631	50	20	IDGD	
Cc1sc2nc(CCC(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)nc(O)c2c1C	920344799	RDOKUBMBVRRPJW-UHFFFAOYSA-N	448.526	1.811	50	20	IDGD	
C#CCCOc1ccc(C=NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1	920358610	WYGPWWJGJJAJKS-UHFFFAOYSA-N	441.509	1.874	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)Nc1ccccc1CN1C(=O)CNC1=O	920932936	GBQGHLJJZYBVJA-GFCCVEGCSA-N	429.408	1.498	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)Nc2ccccc2CN2C(=O)CNC2=O)c1C	920933462	PLISYABPBBUHQE-OAHLLOKOSA-N	439.472	1.975	50	20	IDGD	
COc1ccc([C@@H](CC(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)NC(C)=O)cc1	921183533	AXGHUUVVQFPBNQ-LJQANCHMSA-N	426.473	1.665	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)c2ccc(=O)n(-c3ccccc3)n2)CC1	1116086174	ZRMUUVKOMBPSDN-UHFFFAOYSA-N	441.488	1.641	50	20	IDGD	
COCc1nocc1C(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	1117665143	VKTCEFUULGIATP-UHFFFAOYSA-N	436.471	1.758	50	20	IDGD	
O=C(CCO)NNC(=O)Nc1cc(Br)ccc1I	1254981179	NZHZJNFGWXAHNR-UHFFFAOYSA-N	428.024	1.589	50	20	IDGD	
Nc1cnnc(NNC(=O)CS(=O)(=O)Cc2ccc(Br)cc2)c1Cl	1319220220	PANWWDGWTHEEAM-UHFFFAOYSA-N	434.703	1.533	50	20	IDGD	
O=C(COCc1ccncc1)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	1323466862	UHUPERINWBJSTA-UHFFFAOYSA-N	446.510	1.922	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3nn(C)c4c3CCC4)C2)C1	1777963937	ALMIGGUQNJHFRT-KUHUBIRLSA-N	439.354	1.526	50	20	IDGD	
COc1ccnc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)c1OC	1780452702	KNVIQEZKAIHJEI-RTBURBONSA-N	446.331	1.779	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(C#N)cc3)C2)C1	1780695384	FFEKMKZKNJRGFJ-VUEBRRCKSA-N	448.483	1.136	50	20	IDGD	
N[C@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Br)C1)c1ccccn1	1780771523	JUGAEEAKRQUIJY-LDDOYCOJSA-N	443.317	1.286	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](CCO)NC(=O)OC(C)(C)C)CCO2	1781211507	VYXGHQJOIXLFKZ-AVYPCKFXSA-N	447.960	1.109	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cccnc3CS(C)(=O)=O)CCO2)C1	1781212903	AESYBMBWQXFFSE-HNAYVOBHSA-N	443.953	1.087	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H]1CCN1C(=O)OC(C)(C)C)CCO2	1781215053	HDVCJDVMEWXZOW-BXTJHSDWSA-N	429.945	1.843	50	20	IDGD	
CC(C)(C)c1cnc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](F)Br)C3)C2)cn1	1781329632	ICFDZFFIASNEEK-KSSFIOAISA-N	443.317	1.908	50	20	IDGD	
O=C(C#CC1(O)CCCCC1)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781331584	NHQGCXUQLAHWAA-QAPCUYQASA-N	431.302	1.205	50	20	IDGD	
N#Cc1cc(CC(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)ccc1F	1781333269	NHPVTBSVAZFQTM-SJLPKXTDSA-N	442.260	1.760	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)C3(Br)CC3)C2)C1	1781340632	MVJZJYBOPFAAJQ-FZMZJTMJSA-N	438.160	1.775	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(CCN(C(=O)c3c(F)ccc(O)c3F)C2)C1	1781929809	KQKSVBVUXDPKAL-QGZVFWFLSA-N	433.249	1.899	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc3ncnn3c1)C2	1782175183	FVYBIOHBCMKSRA-JXXFODFXSA-N	435.912	1.111	50	20	IDGD	
N[C@@H](CC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C(Cl)Cl)C1)c1cccnc1	1782215014	GDNRNLWFQZCNOI-QMTMVMCOSA-N	429.348	1.789	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)Cn3cnc4ccccc43)CCO2)C1	1783539949	PSEXZBVUBFQOQV-AUUYWEPGSA-N	435.322	1.650	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccnc(OCC(C)C)c3)CCO2)C1	1783876981	ZCMAEBBBLMKMRB-UTKZUKDTSA-N	439.940	1.814	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(O)n3)C[C@@H]21	1783967052	AAACXDPMLZFFSJ-ABHRYQDASA-N	426.311	1.412	50	20	IDGD	
COc1ccc(Cl)c(CC(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)c1F	1784052843	HHVIJHZFZRQFBD-IFXJQAMLSA-N	449.306	1.460	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(C)nn3CC)[C@H]2C1	1787290649	VQCMENFJGOPVBR-MPTYRVRUSA-N	441.370	1.978	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)[C@H](F)Br)CCC2)cc1)c1ccc(B(O)O)cc1	1788144624	WDQGTPDGDVIDRN-INIZCTEOSA-N	449.085	1.805	50	20	IDGD	
Cc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)C(Cl)Cl)C[C@@H]32)nn1C(F)F	1789330160	VUBLQYKFCILMKK-NHCYSSNCSA-N	425.263	1.984	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)Cn3ccnc3)C[C@@H]21	1790964549	ZVKQQWOHAWEOPH-WOYTXXSLSA-N	441.370	1.672	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3c[nH]c4ncccc34)C[C@@H]21	1791058061	XSIPGVCRFNTZRA-APYUEPQZSA-N	435.322	1.940	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CC34CCCN3CCC4)C[C@@H]21	1791254112	NIBWRUDWNIRUMR-FJIDUMEYSA-N	427.973	1.238	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C[C@@H]21	1791256593	CUKTXJWEMPBBOU-JPYFCXBMSA-N	447.315	1.598	50	20	IDGD	
C[C@H](Oc1cccnc1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CO[Si](C)(C)C)C[C@@H]21	1791655735	UVQCFKXHBNCEJI-CAMMJAKZSA-N	435.597	1.680	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(F)ccc3OC)[C@H]2C1	1791954858	MFFWTLRVWVSTLK-PTOXDTDZSA-N	428.888	1.681	50	20	IDGD	
COc1cc(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](O)CCl)C3)cc(OC)c1OC	1793899235	YAXGGWCISHMOGY-FZKCQIBNSA-N	440.924	1.493	50	20	IDGD	
COc1cccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@](C)(Cl)CCl)C3)n1	1793989499	QSMPZTCAWGLUNC-JBYDNAENSA-N	430.332	1.459	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(OCC(F)(F)F)n1)[C@@H](O)CCl	1794643063	YOWDKIJSFOHAGX-OPDFLTKYSA-N	435.830	1.874	50	20	IDGD	
Cc1nc2sccn2c1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCBr	1795115741	KOCQODDDGRXVRQ-DABQJJPHSA-N	441.351	1.692	50	20	IDGD	
CC[C@H](NC)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1796174951	UIQKVYUTRBKEGE-QRJUGERDSA-N	430.977	1.755	50	20	IDGD	
CN(CCCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Cl)C(=O)OC(C)(C)C	1796370630	JSMMEIHPYDTICI-XRGAULLZSA-N	435.924	1.758	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H]1CCC[C@@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Cl	1796371314	VADGSIWJHCSETC-KARBZBNUSA-N	447.935	1.804	50	20	IDGD	
CC(C)n1cnc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)CBr)C3)n1	1796629897	PNLPIXRQCZPBPI-YIYPIFLZSA-N	428.331	1.093	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1cc2cnccc2[nH]1	1797520090	TVKMANXWLOSDCR-JLUCKKNBSA-N	425.258	1.457	50	20	IDGD	
CCOC(=O)c1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CO[Si](C)(C)C)ccn1	1797957305	FVFATJUHHZBIKR-HGKCTWBKSA-N	449.580	1.313	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H]1CCc3nc(O)nc(O)c3C1)C2	1798625400	DIYFYOUDDSHACE-APIJFGDWSA-N	448.596	1.482	50	20	IDGD	
COc1cncc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Br)c1	1799344430	MJJQRGNRMFWOBR-DLTLXFJOSA-N	444.301	1.303	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1c2c(nn1C)CCC2	1800045138	ZDNIOBKFMRETHO-JFILPPLUSA-N	439.354	1.143	50	20	IDGD	
CC[C@@H](CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](O)CCl)C2)NC(=O)OC(C)(C)C	1800184312	VHZIFSAJJXBXQX-QMHWVQJVSA-N	431.961	1.918	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1C[C@@]12C(=O)Nc1ccccc12	1800733884	YMIAFFTXKMTSMV-ABJWLNFASA-N	445.947	1.894	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Cl)C3)C1	1800768141	MPZQVCIIMGVUNR-LJIZCISZSA-N	447.935	1.758	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COCc1ccc(C)c(C)c1)C2	1800975416	NPUCRZIRBNELOS-JTJHWIPRSA-N	438.952	1.663	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnccc1C(F)(F)F)C2	1800975613	NWUQJDPISOZKBB-BAESOJJISA-N	435.830	1.557	50	20	IDGD	
O=C(/C=C/C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(Cl)Cl)NCc1ccccc1	1801015299	CWDOKJKNYZIPMC-AQCVZSBXSA-N	440.327	1.252	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)COc1ccc(O)nn1	1801264799	WUIFYYORIFLKFA-RVMXOQNASA-N	427.299	1.230	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cc1ccc(Cl)s1)C2	1802332953	HTPYWLFUKYYNIR-BTTYYORXSA-N	426.970	1.955	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cnc3ncccn23)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803143188	WKLPHUJJNRBOTG-BHYGNILZSA-N	428.880	1.044	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)c2cc[nH]n2)[C@H]1c1cccnc1	1803760842	JVHIHFPIESLBPT-CPJWQURSSA-N	448.487	1.258	50	20	IDGD	
Cc1cccnc1C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1803799671	KKBLIICTWFOXQL-SIKLNZKXSA-N	444.300	1.098	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)CCN2C(=O)C=CC2=O)[C@H]1c1cccnc1	1803912807	KGZICDCFXCNUBL-XGHQBKJUSA-N	446.935	1.810	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)C2=CCCS2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1	1807365472	OZZRVWHZICLADU-FXAWDEMLSA-N	437.330	1.102	50	20	IDGD	
Cc1nc(C(=O)N2CCCC3(CCN(C(=O)c4cccc(B(O)O)c4)CC3)C2)cs1	1808689960	DQIZUGHOOGKWSK-UHFFFAOYSA-N	427.335	1.290	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1CCN(C(=O)CN2CCCC2=O)[C@@H]1c1cccnc1	1810542021	VILSCWYMVFIBKX-LAUBAEHRSA-N	432.597	1.561	50	20	IDGD	
Cc1ccn(C)c1C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1811606633	LYNVDDVPOQNGLM-KNQAVFIVSA-N	446.316	1.042	50	20	IDGD	
COc1ccccc1CC(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1	1812762895	JKFYBSHMSCOICQ-UEXGIBASSA-N	431.920	1.938	50	20	IDGD	
CSCC[C@H](O)C(=O)N1CC[C@H](CNC(=O)[C@@H](C)Br)[C@H]1c1cccnc1	1812868010	RAUKRSFWMZVQQN-DMRZNYOFSA-N	444.395	1.985	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2cnccc2F)[C@H]1c1cccnc1	1813070871	LRKUNOHLCFEUDD-KKSFZXQISA-N	442.495	1.308	50	20	IDGD	
Cc1ccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)nc1C	1817470886	KXFFSNBIHYDJIK-FQEVSTJZSA-N	447.304	1.721	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccns2)[nH]n1)c1ccc(B(O)O)cc1	1817471198	STHOEWOYGGQNDS-HNNXBMFYSA-N	425.279	1.166	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc(F)s2)[nH]n1)c1cccc(B(O)O)c1	1817473893	FPNCGOOQEIORTM-OAHLLOKOSA-N	442.281	1.910	50	20	IDGD	
Cc1cc(C(=O)NCC(=O)Nc2cc([C@@H]3CCCCN3C(=O)[C@H](F)Cl)[nH]n2)no1	1819466901	IAZSLTWSSSEVBR-WFASDCNBSA-N	426.836	1.663	50	20	IDGD	
Cc1ccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)nc1	1822412695	FEFZLOOPIFRXKL-KRWDZBQOSA-N	427.509	1.792	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccccc3C(N)=O)sc2C1	1823451160	QJWKFJNXVORTRQ-MFKMUULPSA-N	436.921	1.722	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CN2C(=O)CNC2=O)CC1	1824609660	OAIOQVMRWIMDIR-CVEARBPZSA-N	426.945	1.565	50	20	IDGD	
C[C@@H](Cc1ccco1)C(=O)N[C@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1	1826091770	BTOBWVZCJOGSSQ-KBPBESRZSA-N	447.561	1.900	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1CCc2nc(NC(=O)C3=COCCC3)sc2C1	1826174694	APFZLDGPNNSDLD-GFCCVEGCSA-N	442.501	1.062	50	20	IDGD	
CS(=O)(=O)CC(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@H](F)Br)CC1	1826628908	KGJIKQXEFVNYIE-JSGCOSHPSA-N	427.336	1.341	50	20	IDGD	
COCC1(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)CC1	1827048866	AUEILYFBVIVKNA-FQEVSTJZSA-N	428.338	1.026	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC[C@H]1C1CCN(C(=O)C(F)(F)C(F)F)CC1	1827050244	KFYZZBSEYUWFTR-INIZCTEOSA-N	444.234	1.500	50	20	IDGD	
O=C([C@@H]1CCC=CO1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827051894	ILFQRMAHIFZVOG-SFTDATJTSA-N	426.322	1.292	50	20	IDGD	
CC(C)[C@H](S)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827055560	CZJFYFNXPGAJDO-PMACEKPBSA-N	432.395	1.554	50	20	IDGD	
N[C@@H](Cc1cscn1)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H](O)CCl)CC1	1827546020	WSCPCGHGSXKTJD-BBWFWOEESA-N	428.986	1.232	50	20	IDGD	
CCc1cc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)no1	1829378456	OKNBONBYOCMCRR-OAQYLSRUSA-N	439.321	1.464	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C13CC(F)(C1)C3)CCO2	1831592804	JSVAACAHTREFBA-CRZVIPCUSA-N	433.318	1.509	50	20	IDGD	
O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)C[C@H]1CCCCO1)CCO2	1832340991	PJBSMHMKNIAYFY-QAPCUYQASA-N	433.343	1.187	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3ccc(OC)nc3)CCO2)C1	1832581323	DDWJZGFOAWTCOE-DYESRHJHSA-N	439.940	1.497	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)COc3cccnc3)CCO2)C1	1832668738	VBECUFLVEHSXNG-FQEVSTJZSA-N	425.913	1.182	50	20	IDGD	
CN(C)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1833665737	GCQRLWMIJNWROT-SFHVURJKSA-N	431.320	1.021	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3conc3C)CCO2)C1	1834340169	JJMNEADSEVDZOL-WMLDXEAASA-N	430.299	1.227	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3nc[nH]c3[N+](=O)[O-])CC2)CC1	1835098364	PISIKVXIGMATGP-HNNXBMFYSA-N	440.932	1.911	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3ccc4cncn4c3)CC2)CC1	1835618457	XIUJYDNUJMQHKS-FQEVSTJZSA-N	447.967	1.773	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](NC(C)C)C(C)C)CCO2	1835893133	ROHIPLYAHLXGJJ-UEXGIBASSA-N	432.005	1.873	50	20	IDGD	
CCCC(=O)N[C@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](Cl)CCC)C2)C1	1837671020	ZDKRBJGNILOYIS-QINHECLXSA-N	431.961	1.155	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)CN3CCCC3=O)CC2)CC1	1837810098	VCOLQWORJRIJOT-AWEZNQCLSA-N	444.370	1.391	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(F)nc3)CCO2)C1	1837840083	DUPGDUCFDLSCGZ-SCLBCKFNSA-N	444.301	1.322	50	20	IDGD	
CC1(C)CC(C(=O)N2CCC(OC3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)C1	1837921392	GSWZUKUDZHCDRY-UHFFFAOYSA-N	442.365	1.415	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)ccn1	1837941824	XBCQVKPCURFVNF-KBXCAEBGSA-N	426.311	1.243	50	20	IDGD	
C[C@H](C(=O)N1CCC(OC2CCN(C(=O)[C@H](F)Cl)CC2)CC1)n1ccccc1=O	1838082936	UWERUZFLZFMCOR-KDOFPFPSSA-N	427.904	1.942	50	20	IDGD	
O=C(c1cc(O)no1)N1CCC(OC2CCN(C(=O)[C@H](F)Br)CC2)CC1	1838481838	LEXQHBQDFDGVCR-AWEZNQCLSA-N	434.262	1.683	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3nc(C)sc3C)C2)C1	1839142257	LAVVLGZLOPIZFD-KXBFYZLASA-N	429.970	1.776	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4ncncc4c3)C2)C1	1839145407	GTTMBGFSVCWXJW-LAUBAEHRSA-N	432.908	1.717	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)cc1	1839201901	NAPKYINEEANYFD-YJBOKZPZSA-N	429.286	1.756	50	20	IDGD	
N#Cc1ccc(F)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)c1	1839422445	UXUOIXCOSQMEJD-SFHVURJKSA-N	430.263	1.571	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3csc(C)n3)C2)C1	1839963429	JWYRSPMMKUTCCG-GUYCJALGSA-N	446.367	1.695	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3c(C)ccn3C)C2)C1	1839965760	JTTCGWAVEDBUGQ-KXBFYZLASA-N	442.354	1.577	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)C3=COCCC3)C2)C1	1839966495	HFHPOLKINCUPCP-QAPCUYQASA-N	431.327	1.311	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3c(C)cccc3Cl)C2)C1	1840154999	MLCNYLRJZMUULA-JXFKEZNVSA-N	445.343	1.972	50	20	IDGD	
C[C@@H](Oc1ccccc1)C(=O)N1CCOC[C@@]2(CN(C(=O)C(Cl)Cl)CCO2)C1	1840189386	OLHMEGZTXOJVPM-KUHUBIRLSA-N	431.316	1.714	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CCCn3cccc3)CCO2)C1	1840463260	YXJQWJUOIUYADC-APWZRJJASA-N	442.354	1.508	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)C3CCSCC3)CCO2)C1	1840922370	IEYMVHGFZHKREB-KSSFIOAISA-N	449.411	1.617	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC12CN(C(=O)c1ccc3c(c1)NC(=O)CO3)C2	1841287422	LUGHNIPEVPLZRE-GFCCVEGCSA-N	436.306	1.866	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)/C=C/c2ccc(F)cc2F)C1	1841796353	FCVJKBTXCJTORI-HWKANZROSA-N	441.438	1.494	50	20	IDGD	
C#CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)[C@H](C)Br)C1	1846180188	RZHLVMWXDGPNFE-UONOGXRCSA-N	442.354	1.890	50	20	IDGD	
CCOc1c(C(=O)N2CC3(CCCN3C(=O)[C@H](Cl)COC)C2)cnc2c1cnn2C	1846361805	PZLJCDQKVHUBLH-OAHLLOKOSA-N	435.912	1.438	50	20	IDGD	
O=C(c1cc(-c2cc[nH]n2)n2ccccc12)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl	1847564069	SOGDTMKAIOPDTB-LNLFQRSKSA-N	427.892	1.745	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H]1CCc2nc(O)nc(O)c2C1	1848217421	LBGJDBXDTFMMPM-IJNCGLNKSA-N	443.331	1.431	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cc(Cl)ccc2O)cc1S(=O)(=O)N(C)C	10600917	MDMJAOKSDPHICT-UHFFFAOYSA-N	427.866	1.379	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)[C@H]2CC(=O)Nc3cc(F)ccc32)cc1OC	12936191	NAGXHPQFHBTJPN-AWEZNQCLSA-N	445.403	1.273	50	20	IDGD	
O=C(CCc1ccccc1)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	28604863	JTNAQTWFOBPTBJ-UHFFFAOYSA-N	445.541	1.420	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)cc1	32797765	YKGQYONHDZOWEK-UHFFFAOYSA-N	430.486	1.999	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)C[C@](O)(c2nc(C)cs2)C(F)(F)F)cc1	725928838	CWFLYBGKIRVJFD-KRWDZBQOSA-N	445.419	1.904	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)NCc2ccc([C@]3(C)NC(=O)NC3=O)cc2)cc1	726278275	DNYLPNGIEAOTIR-QFIPXVFZSA-N	439.472	1.213	50	20	IDGD	
COC(=O)CCn1nc(C)c(C=NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)c1C	727059510	QERQZJQVSIDETB-UHFFFAOYSA-N	441.897	1.128	50	20	IDGD	
CC(=O)Nc1cccc(OCCNC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)c1	729232036	CLVOIDVTSYTXAI-UHFFFAOYSA-N	438.444	1.559	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)c1cccc(S(=O)(=O)NCC2CC2)c1	729451182	MFSBBCWIJKDZJW-UHFFFAOYSA-N	426.498	1.791	50	20	IDGD	
CN(CC(=O)NNC(=O)c1ccc(F)cc1)CC(=O)Nc1ccc(Br)cn1	729472936	BVPUVYXKPDGAJT-UHFFFAOYSA-N	438.257	1.315	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@H](C(=O)NNC(=O)CNc3ccccc3)C2)cc1	729513354	LNZBNDJSXHKVMT-KRWDZBQOSA-N	430.530	1.655	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2scnc2C)c1	729615691	AIYOERJFPPUIJI-UHFFFAOYSA-N	425.536	1.626	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)NCc3cocn3)c2)cc1	730913486	XFCVKNOHGBVTJX-UHFFFAOYSA-N	445.457	1.628	50	20	IDGD	
O=C(COCC(=O)NNC(=O)c1ccc(F)cc1Br)NCc1cccnc1	731182646	HPYHGRBWDHYLMF-UHFFFAOYSA-N	439.241	1.077	50	20	IDGD	
Cc1ccc(C)n1-c1ccc(C(=O)NNC(=O)NCCS(=O)(=O)NCC2CCC2)cc1	731760922	ICSYZOXJEMHJKX-UHFFFAOYSA-N	447.561	1.758	50	20	IDGD	
CN1CCCC[C@@H]1C(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	731865691	RKFMJVKXBDRZMF-LJQANCHMSA-N	430.530	1.410	50	20	IDGD	
O=C(NN=Cc1nc(-c2cccc(Br)c2)c[nH]1)N[C@@H]1CCS(=O)(=O)C1	731925572	KUYUDDIYLWWGBS-GFCCVEGCSA-N	426.296	1.659	50	20	IDGD	
CC(=O)Nc1ccc(NS(C)(=O)=O)c(C(=O)NNc2nc(-c3cccnc3)no2)c1	732110492	BRTRMTPUNZHOMN-UHFFFAOYSA-N	431.434	1.218	50	20	IDGD	
CNC(=O)c1ccc(CNC(=O)NNC(=O)c2ccc(OC)c(Br)c2)cc1	732238438	OJQCCYBCNNUDRN-UHFFFAOYSA-N	435.278	1.962	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)N[C@@H]1CCN(c2ccccc2Cl)C1=O	732469497	GUUACPBXRTXTPX-CYBMUJFWSA-N	447.835	1.763	50	20	IDGD	
CN1C(=O)C[C@@H](C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)[C@@H]1c1cccc(Cl)c1	734419370	PMJAWJSOIWRMLH-AEFFLSMTSA-N	439.863	1.296	50	20	IDGD	
CN1C(=O)CC[C@@H](C(=O)NNC(=O)C(=O)N2CCCC2)[C@@H]1c1ccc(C(F)(F)F)cc1	734432873	XDLNBVGLSVGSLR-ZBFHGGJFSA-N	440.422	1.385	50	20	IDGD	
NS(=O)(=O)c1ccc(F)c(CNC(=O)NNC(=O)Cc2cccc3ccccc23)c1	734673492	LAVKXSCEZGFZGR-UHFFFAOYSA-N	430.461	1.699	50	20	IDGD	
CN(C)[C@@H](CNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)c1c(F)cccc1F	734675425	ISIBAUPXKQKWMC-KRWDZBQOSA-N	447.490	1.605	50	20	IDGD	
C[C@H](NC(=O)c1cccs1)C(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	734822444	WJOJJEIXOOWJGO-LBPRGKRZSA-N	439.538	1.596	50	20	IDGD	
CC(=O)NCC(=O)N1CCc2cc(C(=O)NNC(=O)[C@H](C)Oc3ccccc3F)ccc21	735631232	RYYSVTWSOBBQSM-ZDUSSCGKSA-N	442.447	1.079	50	20	IDGD	
CS(=O)(=O)c1ccc(Br)c(C(=O)NNC(=O)COCc2ccccc2)c1	737628736	GDRAJNRESLIBLB-UHFFFAOYSA-N	441.303	1.830	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)NCc1n[nH]cc1Br	738477306	JLMWUERIINBTJU-UHFFFAOYSA-N	447.087	1.844	50	20	IDGD	
CCCOc1ccc(C(=O)NNS(=O)(=O)c2ccc(C#N)cc2[N+](=O)[O-])cc1OC	741203789	HEWZKLITYHGDFO-UHFFFAOYSA-N	434.430	1.887	50	20	IDGD	
O=C(Cn1cnc2ccccc21)NNC(=O)[C@@H]1CCCN(C(=O)COc2ccccc2)C1	741207880	UPYAYVFQQAYSFU-QGZVFWFLSA-N	435.484	1.501	50	20	IDGD	
COC(C)(C)C[C@@H](C)NC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	745865059	HJEWQNIBEKOYJK-CQSZACIVSA-N	426.539	1.619	50	20	IDGD	
Cc1cc(N2CC[C@@H](NC(=O)NNC(=O)c3ccc(Cl)cc3Cl)C2=O)n(C)n1	745905394	IUDZMEFQUSJIBC-CYBMUJFWSA-N	425.276	1.785	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)Nc3nccs3)cc2)c1O	746292820	DOZOHFCEYNNCCH-UHFFFAOYSA-N	448.482	1.733	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2ccc(Br)nc2)cc1	746579722	MTWCJAYSJMSKOJ-UHFFFAOYSA-N	441.307	1.234	50	20	IDGD	
O=C(CCOc1ccccc1)NNC(=O)NC[C@H](c1cccc(F)c1)N1CCOCC1	747307196	WDBUJLABWGIDAM-HXUWFJFHSA-N	430.480	1.999	50	20	IDGD	
CNS(=O)(=O)c1csc(C(=O)NNC(=O)c2ccc(F)cc2Br)c1	748704765	MUCOJKKHVBYSAE-UHFFFAOYSA-N	436.284	1.633	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c(O)nc2ccccc12	749330226	MHSGOPDTHGZSCR-UHFFFAOYSA-N	428.470	1.574	50	20	IDGD	
O=C(CCNC(=O)c1ccc([N+](=O)[O-])cc1)NNc1nc(Br)cn2ccnc12	750246033	IKUSLKLPWJJCKT-UHFFFAOYSA-N	448.237	1.663	50	20	IDGD	
CN(C(=O)OC(C)(C)C)[C@H]1CCN(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)C1	750276369	NUMBWQHZVJQFCR-INIZCTEOSA-N	447.540	1.375	50	20	IDGD	
Cc1nnc2n1C[C@H](C(=O)NNC(=O)[C@@H]1Cc3ccccc3CN1Cc1ccccc1)CC2	750728698	YEITWSHQIMNZOE-YADHBBJMSA-N	444.539	1.923	50	20	IDGD	
Cc1cc(C)nc(SCc2ccc(C(=O)NNC(=O)CCN3CCOCC3)cc2)n1	750866158	SZQKEOXODSFANY-UHFFFAOYSA-N	429.546	1.869	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)CN1CCN(C(=O)OCc2ccccc2)CC1	751068049	HEOSINXKORDOLI-UHFFFAOYSA-N	446.529	1.488	50	20	IDGD	
Cc1cccc(NC(=O)N2CCC[C@@H](C(=O)NNC(=O)CNC(=O)c3cccs3)C2)c1	751206086	BREPUFRBQLLPMP-OAHLLOKOSA-N	443.529	1.878	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)NNC(=O)CNC(=O)c2cccs2)c1C	751208512	FQEYMILJTNWNRV-YBEGLDIGSA-N	429.502	1.297	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cnn(-c3ccc(Cl)cc3)n2)c1	751549366	VFULUBIRDMDRPY-UHFFFAOYSA-N	448.892	1.246	50	20	IDGD	
COC(=O)c1cc(NC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c(C)c([N+](=O)[O-])c1	753127412	WJKOFHMTBHAWRR-INIZCTEOSA-N	430.373	1.683	50	20	IDGD	
NC(=O)c1ccc(CNC(=O)NNC(=O)COc2ccc(OCc3ccccc3)cc2)cn1	753953310	JGIWLZPJGDNYFI-UHFFFAOYSA-N	449.467	1.669	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN(C(=O)NC2CCCC2)C1)c1nn(-c2ccccc2)cc1O	754418632	WOVKHRYWAITHLX-HNNXBMFYSA-N	440.504	1.703	50	20	IDGD	
O=C(COC(=O)c1cc(Br)ccc1O)NNC(=O)c1cccc([N+](=O)[O-])c1	754543714	DOEOXIJMOOQJDZ-UHFFFAOYSA-N	438.190	1.681	50	20	IDGD	
COc1ccc(Oc2ccc(CCNC(=O)NNC(=O)C(=O)N3CCCC3)cc2)cc1	755084246	PSFNYXMWRLSUAI-UHFFFAOYSA-N	426.473	1.983	50	20	IDGD	
COc1cc(CN2CC[C@@H](NC(=O)NNC(=O)COCc3ccccc3)C2)cc(OC)c1	755174500	MSADMWNGSLSRFC-LJQANCHMSA-N	442.516	1.825	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)cc1	755794926	LPBWIRJNUYBKOY-UHFFFAOYSA-N	433.417	1.731	50	20	IDGD	
CN(C(=O)c1ccc(C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)cc1)c1ccccc1	756949855	NJMBHODKCNUBSB-INIZCTEOSA-N	430.486	1.094	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)Nc1cnn(-c2ccccc2)n1	757824954	DTTPHUCDXLZGKU-UHFFFAOYSA-N	434.504	1.632	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)Nc1ccn(-c2cccc(C(F)(F)F)c2)n1	757998370	WOESGCQRVSOGRO-SNVBAGLBSA-N	431.396	1.479	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2ccc3c(c2)NC(=O)[C@H](C)S3)n1	759847815	GJQHHOXYEBEJDV-JTQLQIEISA-N	434.499	1.431	50	20	IDGD	
CCCOc1cccnc1C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	760065456	FTGDODTXTZDLMA-UHFFFAOYSA-N	432.502	1.730	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)NCc1cn2cc(Br)cc(C)c2n1	760145828	ZRJRYCCYFGXGIV-NSHDSACASA-N	428.287	1.287	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C[C@@](O)(c1nccn1C)C(F)(F)F	762360505	DNVUGLPZLRJEQO-MRXNPFEDSA-N	432.424	1.508	50	20	IDGD	
C[C@H](CN1CCOCC1)C(=O)NN=C1CCOC[C@H]1[C@H]1CCCN1C(=O)OC(C)(C)C	762416984	DRUBRXWZVLSKJS-ZHALLVOQSA-N	438.569	1.863	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)N[C@@H]2CC[C@@H]3SCCS[C@@H]32)nc1	763059364	BFIFTMNBTIFUJO-VNHYZAJKSA-N	431.609	1.774	50	20	IDGD	
CNC(=O)c1cc(Oc2ccccc2NC(=O)C(=O)NNC(=O)c2ccccc2)ccn1	763430552	JLOSFLVYSDFYQU-UHFFFAOYSA-N	433.424	1.633	50	20	IDGD	
COC(=O)[C@@H](C)Cc1ccc(NC(=O)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1	763468901	XLZKKZRXDUVXLN-LBPRGKRZSA-N	428.401	1.346	50	20	IDGD	
COCCn1nc(C)c(NC(=O)C(=O)NNC(=O)c2cc3ccccc3cc2O)c1C	763525691	ATDMYOBLMWILAS-UHFFFAOYSA-N	425.445	1.405	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2ccccc2F)cccc1C(=O)N1CCSCC1	763567684	AGSJBRFXEUQGIO-UHFFFAOYSA-N	444.488	1.723	50	20	IDGD	
Cc1coc(-c2ccc(C)c(NC(=O)C(=O)NNC(=O)[C@H]3COc4ccccc4O3)c2)n1	763572058	LOTJFJUMXSWNRO-GOSISDBHSA-N	436.424	1.884	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)NC(=O)[C@@H](C)O3)c2ccccc2n1	763615931	JKVDPZHYADWNMB-GFCCVEGCSA-N	433.424	1.662	50	20	IDGD	
CN(C)c1c(Cl)cccc1NC(=O)C(=O)NNC(=O)CN1CCCc2ccccc21	763728443	QKSFGHIZGCFMGA-UHFFFAOYSA-N	429.908	1.945	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)C(=O)Nc2cccc(C#Cc3ccccn3)c2)c1	763754015	KCXCOUOXRZMNMO-UHFFFAOYSA-N	427.464	1.947	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)C(=O)Nc2cccc(CN3CCCCC3=O)c2)c1	763758305	QZDOWCIAXCZMDH-UHFFFAOYSA-N	437.500	1.665	50	20	IDGD	
CS(=O)(=O)c1ccc(F)c(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCC3)c1	763775833	VOPVVESYAHPWJF-UHFFFAOYSA-N	425.463	1.179	50	20	IDGD	
CCCOC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2nnc(O)c3ccccc23)cc1	763791543	VGZJQCIFLLFWMW-UHFFFAOYSA-N	437.412	1.302	50	20	IDGD	
CC[C@@H](C)Oc1cccc(NC(=O)C(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])c1	763804671	PDWIOXAMOJCHDO-CYBMUJFWSA-N	430.417	1.937	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)C(=O)Nc1ccc(C(F)(F)F)nc1	763804934	XWILDTXHSZXPAK-UHFFFAOYSA-N	427.295	1.174	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)n([C@@H]2C[C@H]3CC[C@H]2C3)n1	763839774	LSOIPSMFTDCXKR-GRDNDAEWSA-N	429.452	1.857	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cccc(N3CCCC3=O)c2)c1C	763850776	PWAPLOXRRLJUSM-INIZCTEOSA-N	438.484	1.984	50	20	IDGD	
COC(=O)[C@H](C)Cc1ccc(NC(=O)C(=O)NNC(=O)Cc2c[nH]c3ccccc23)cc1	763865487	QSTYASYWFBYKSE-CQSZACIVSA-N	436.468	1.848	50	20	IDGD	
CNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)cc1Cl	763974129	LJJOUDSOQPBAII-UHFFFAOYSA-N	425.228	1.458	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)C(=O)Nc1ccnn1CCc1ccccc1	763995941	SIIHGTMRLYEWJU-UHFFFAOYSA-N	445.277	1.616	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)c1sccc1S(=O)(=O)N1CCCC1	764048686	UVVRIZHDQAPFOH-UHFFFAOYSA-N	441.556	1.792	50	20	IDGD	
Cc1ccc(S(C)(=O)=O)cc1NC(=O)C(=O)NNC(=O)Cc1ccc2ccccc2c1	764084351	JVZUBSDLLUXDTG-UHFFFAOYSA-N	439.493	1.880	50	20	IDGD	
CCCS(=O)(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)Cc2ccccc2OC)c1	764135425	GEQITGCMDMVOQE-UHFFFAOYSA-N	448.501	1.176	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)C[C@H](OC)C3)o1	764139552	VADUITQLGVBXBP-GOSISDBHSA-N	428.489	1.635	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCCCC2)cc1NC(=O)C(=O)NNC(=O)CC(C)(C)C	764199752	UDBGHWIUEHSJDV-UHFFFAOYSA-N	438.550	1.692	50	20	IDGD	
CN1CCN(Cc2cccc(NC(=O)C(=O)NNC(=O)c3cccc4ncccc34)c2)CC1	764258864	BSIDBRMOQIQQFD-UHFFFAOYSA-N	446.511	1.382	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2cccs2)[nH]n1)C(=O)Nc1cnn(-c2ccccc2F)c1	764378256	XCWAGFZAXOMFPY-UHFFFAOYSA-N	439.432	1.863	50	20	IDGD	
COC(=O)c1c(F)cccc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	764387710	MGEFBNVGBYTZSA-UHFFFAOYSA-N	443.366	1.541	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)C(=O)Nc1cnn(Cc2ccccc2)c1	764394071	NAHWCIKZEAEHQE-UHFFFAOYSA-N	425.470	1.515	50	20	IDGD	
Cc1nc(-c2ccccc2NC(=O)C(=O)NNC(=O)CSc2ccccc2O)no1	764400746	GWSIHJWACWJMHG-UHFFFAOYSA-N	427.442	1.629	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(N(C)C2CCCCC2)c(F)c1	764400971	RSYZIEDHAWKEKE-CQSZACIVSA-N	438.500	1.732	50	20	IDGD	
COC(=O)c1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)CSc1ccccc1O	764402015	WIDHTYIDOZYOCU-UHFFFAOYSA-N	437.861	1.710	50	20	IDGD	
CC(=NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1)c1cnn(-c2ccccn2)c1C	764826758	AJYMEONVNRUMEZ-UHFFFAOYSA-N	445.527	1.874	50	20	IDGD	
COc1cc2c(cc1C=NNC(=O)CN1CCN(C(=O)c3ccccc3)CC1)O[C@@H](C)C2	764829365	WAYZKJCSAZNRLV-KRWDZBQOSA-N	436.512	1.927	50	20	IDGD	
Cc1ccc([C@@H](C)[C@H](O)C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)cc1	765198235	KZNFHTLSJLQZLA-UTKZUKDTSA-N	446.573	1.539	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1F	765632668	DETPOUSPSXNPMO-UHFFFAOYSA-N	446.438	1.119	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)[C@@H]2C[C@@H]2c2cc(F)c(F)c(F)c2)ccc1Cl	766634546	ZHYOATVGTUWBJI-NXEZZACHSA-N	447.822	1.969	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3nn(-c4ccccc4)cc3O)CC2)cc1	766647728	VRHNRZPQUKOBDB-UHFFFAOYSA-N	448.527	1.465	50	20	IDGD	
CCS(=O)(=O)C1CCN(C(=O)NNC(=O)c2ccc(OC)c(Br)c2)CC1	767809494	LAOYIXCSWZDFLQ-UHFFFAOYSA-N	448.339	1.711	50	20	IDGD	
Cn1cc(C=NNC(=O)c2ccc(-n3cnnn3)cc2)c(-c2ccc3c(c2)OCCCO3)n1	767823630	JWJYYYMCLOATTK-UHFFFAOYSA-N	444.455	1.988	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)C(=O)Nc1cnc(Cl)c(Br)c1	768240794	ASJLYICJOHJKNN-UHFFFAOYSA-N	441.669	1.922	50	20	IDGD	
CCOC(=O)c1[nH]c(C)c(S(=O)(=O)NNC(=O)COc2ccccc2OCC)c1C	768496775	OHQSEOVVADDVDX-UHFFFAOYSA-N	439.490	1.595	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)CCC(=O)c2ccc3c(c2)CCC(=O)N3)C[C@@H](C)O1	768686684	ILCTUQNEZNGYOV-GASCZTMLSA-N	430.505	1.181	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cccc([C@@]3(C)NC(=O)NC3=O)c2)ccc1OC(C)C	768930254	OVCXOTYZJZDOPN-JOCHJYFZSA-N	440.456	1.612	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)c2ccc(S(N)(=O)=O)cc2F)cc1	769739182	VUABUXABBBGIEO-LLVKDONJSA-N	425.438	1.100	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)c1	770649199	NBUWKQSVXRTLKT-LLVKDONJSA-N	436.852	1.800	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)Cc2nc(-c3ccccc3)cs2)cn1	771124933	USSGHFDSVHMSJO-UHFFFAOYSA-N	445.526	1.459	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)N[C@@H]1CCO[C@@]2(CCOC2)C1	771442536	MRLKUIAZMCGXTE-DYVFJYSZSA-N	428.283	1.496	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)c1ccc(S(=O)(=O)C(F)F)cc1	772195608	AHENMCBOHLZXIM-UHFFFAOYSA-N	445.831	1.414	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCCNC(=O)NNC(=O)Cc2c[nH]c3ccccc23)s1	772632053	VLEBOKVXRGOWKQ-UHFFFAOYSA-N	435.531	1.389	50	20	IDGD	
CCCCS(=O)(=O)N1CCC[C@@H]1C(=O)NNC(=O)[C@H](C)Oc1cccc(Cl)c1	772969741	OQQHKOUYIWHUBG-XJKSGUPXSA-N	431.942	1.849	50	20	IDGD	
Cc1cc(C[C@@H](C)NC(=O)NNC(=O)CNC(=O)c2cccs2)n(-c2ccccc2)n1	773004911	JKLYPHFEJVELLP-CQSZACIVSA-N	440.529	1.934	50	20	IDGD	
CCS(=O)(=O)NCCc1ccc(S(=O)(=O)NNC(=O)c2ccccc2C)s1	773234448	PXJVPKUIRRMVHP-UHFFFAOYSA-N	431.561	1.162	50	20	IDGD	
COc1cc(C#N)ccc1OCC(=O)NNC(=O)[C@H]1CCCN(C(=O)OC(C)(C)C)C1	773415220	MVEAYXRDEYMHOL-HNNXBMFYSA-N	432.477	1.740	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)C(=O)NNc1ccc(C#N)cc1	773692950	OCCCTFDEEOAVCK-UHFFFAOYSA-N	431.474	1.289	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(N3C(=O)CCCC3=O)cc2)cc1F	773886001	UWOOTHDZWDAVGK-UHFFFAOYSA-N	426.404	1.577	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)COC2CCN(C(=O)OC(C)(C)C)CC2)cc1	777127401	MQROIMGBTIFYIZ-UHFFFAOYSA-N	449.504	1.715	50	20	IDGD	
O=C(COC(=O)c1cnn(-c2cccc(Cl)c2)n1)NNC(=O)c1ccc([N+](=O)[O-])cc1	777209993	XEYONRIWXLIWRV-UHFFFAOYSA-N	444.791	1.447	50	20	IDGD	
O=C(c1cc([N+](=O)[O-])ccc1Cl)N1CCN(S(=O)(=O)CBr)CC1	777779469	LWDLKXJPJGZAFP-UHFFFAOYSA-N	426.676	1.688	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N[C@H](C)c2ncon2)cc1	778408980	HOQKVFOQPAPHAB-MLJKTZRHSA-N	435.444	1.601	50	20	IDGD	
CNC(=O)CCCC(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccc(OC)cc2)c1	780155092	SBOBFMGITIJNQY-UHFFFAOYSA-N	448.501	1.173	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)[C@@H]2CC(=O)N(c3ccc(F)c(C)c3)C2)cc1	780180185	GJDLIXCRLRIBFW-MRXNPFEDSA-N	427.432	1.800	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)NCc2cccc(S(=O)(=O)N(C)C)c2)c2ccccc2n1	782759401	IUXAJXREODQGIK-UHFFFAOYSA-N	441.513	1.938	50	20	IDGD	
O=C(NNc1ncc(C(F)(F)F)cc1Cl)C(=O)Nc1cccc(-n2cnnn2)c1	782849407	OLGHXSQFAIBYKM-UHFFFAOYSA-N	426.746	1.811	50	20	IDGD	
Cn1cnn(-c2ccc(NC(=O)C(=O)NNc3ccc(Br)cc3)cc2)c1=O	783009081	DMIPKXLWDRRUQQ-UHFFFAOYSA-N	431.250	1.415	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(NC(=O)C(=O)NN=c2sc3ccccc3n2C)c1	783350099	VSTNFXIYUOSKKP-UHFFFAOYSA-N	433.515	1.061	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNc2c(C)cc(C)cc2C)ccc1S(=O)(=O)N(C)C	783367162	VFPMZULJHRGCBZ-UHFFFAOYSA-N	434.518	1.953	50	20	IDGD	
Cc1cc(C)c(NNC(=O)C(=O)Nc2ccc(S(=O)(=O)N3CCOCC3)cc2)c(C)c1	783368974	XCEMEYXENAAERR-UHFFFAOYSA-N	446.529	1.715	50	20	IDGD	
Cc1cc(Br)cc(Cl)c1NC(=O)C(=O)NN[C@@]1(C)CCS(=O)(=O)C1	783424445	DTYCYRGGHNVQRE-AWEZNQCLSA-N	438.731	1.547	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNc2ccc(-n3cccn3)nn2)cccc1OCC(F)(F)F	783433162	LVMAPPPJERQSCT-UHFFFAOYSA-N	435.366	1.994	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2ccc(N3CCNC(=O)C3)cc2)ccc1Br	783924076	RJRVZWJOYATIII-UHFFFAOYSA-N	446.305	1.776	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNc2cc(C)ncn2)cc1S(=O)(=O)N1CCCC1	783948836	UESZLOYMXOXFON-UHFFFAOYSA-N	448.505	1.050	50	20	IDGD	
CON(C)S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccc(OC(F)F)cc2)cc1	784307750	HZYNQCFZBLVHDI-UHFFFAOYSA-N	444.416	1.552	50	20	IDGD	
CON(C)S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccc(F)c(F)c2F)cc1	784812588	KJNXRXOLZRIWBQ-UHFFFAOYSA-N	432.380	1.368	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccnn3-c3ccncc3)n[nH]2)c1	785126634	AUACKOKNRPHKFW-UHFFFAOYSA-N	444.455	1.674	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2cccc(Cl)c2-n2cncn2)n1	785237975	WSEWIDQJNKUVSH-UHFFFAOYSA-N	429.872	1.639	50	20	IDGD	
COCC[C@H](NC(=O)C(=O)Nc1ccccc1S[C@H](Cl)C(F)(F)F)C(N)=O	785285895	NMKIBRIDIWANEY-XPTSAGLGSA-N	427.832	1.851	50	20	IDGD	
COC(=O)c1csc(NC(=O)C(=O)NNc2c(OC)cccc2S(C)(=O)=O)c1	785331620	XEZKXKIGVWAEJF-UHFFFAOYSA-N	427.460	1.029	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)[C@@H](NC(=O)C(F)(F)F)C(C)C)cc1C	786770817	QYONPYINAIIBDK-ZDUSSCGKSA-N	437.440	1.626	50	20	IDGD	
COc1ccc(Cl)cc1N1C[C@H](C(=O)NNc2ccccc2S(N)(=O)=O)CC1=O	788230830	ZMVUWKXIOCSEIW-LLVKDONJSA-N	438.893	1.492	50	20	IDGD	
CC(C)n1nc(-c2ccco2)cc1NC(=O)C(=O)NNC(=O)[C@@H]1COc2ccccc2O1	789732755	UXOPTZQRZIHBCQ-KRWDZBQOSA-N	439.428	1.650	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)C(=O)Nc2nc([C@@H]3C[C@H]4CC[C@H]3C4)cs2)c1	789738658	GUZKLSMGODIXCR-SLEUVZQESA-N	442.501	1.800	50	20	IDGD	
CC[C@H]1CCc2nc(NC(=O)C(=O)NNC(=O)CNC(=O)c3cccs3)sc2C1	789758313	SCOMPMDEWDQNNS-JTQLQIEISA-N	435.531	1.235	50	20	IDGD	
O=C(NCCc1ccc(S(=O)(=O)N2CCCCC2)s1)NNc1nc2ccccn2n1	790397940	IQWMYJNOYLQSKL-UHFFFAOYSA-N	449.562	1.834	50	20	IDGD	
CN1C(=O)C[C@@H](C(=O)NNC(=O)C(=O)N2CCCC2)[C@@H]1c1ccc(Cl)c(Cl)c1	790551211	XPTWFFXHGZGNMN-ABAIWWIYSA-N	427.288	1.283	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1cccc2c1OCC[C@@H]2OC	790963154	BAMHBTHXGNYMES-AWEZNQCLSA-N	449.485	1.651	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)[C@@](C)(O)Cn2cc(C(F)(F)F)ccc2=O)c1	792031239	TTXUPZIRIICFBG-SFHVURJKSA-N	426.395	1.145	50	20	IDGD	
CN(C)N(C(=O)CSc1nc2ccccc2nc1N1CCCC1)[C@H]1CCS(=O)(=O)C1	792853595	FQEPDRVYONPCLE-HNNXBMFYSA-N	449.602	1.814	50	20	IDGD	
Cc1cncc(CCC(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)c1	794392956	LIFBMPASWXKKGU-UHFFFAOYSA-N	429.952	1.941	50	20	IDGD	
CC(=NNC(=O)CNC(=O)c1ccco1)c1cc(S(N)(=O)=O)c(Cl)cc1Cl	794501454	HLGKGTWXGXBPIY-UHFFFAOYSA-N	433.273	1.504	50	20	IDGD	
COC(=O)c1ccc(S(=O)(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)c(F)c1	794579516	YDNZEKVMZRXBPM-UHFFFAOYSA-N	442.421	1.261	50	20	IDGD	
Cc1nc(-c2cccnc2)nc(O)c1CC(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	794722301	VMXVKWHUCHBZKS-UHFFFAOYSA-N	442.501	1.489	50	20	IDGD	
CCNC(=O)N(C)c1cccc(NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)c1	796998706	GDQDBJKGNGKTFN-UHFFFAOYSA-N	433.852	1.611	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2cc(C(F)(F)F)ccc2-n2cccn2)n1	797371182	QHKVNXLMYYNHSI-UHFFFAOYSA-N	432.362	1.994	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)Nc2cc(S(=O)(=O)N3CCCC3)ccn2)cc1	797673582	GXRUEAZTEIIKFG-UHFFFAOYSA-N	447.517	1.660	50	20	IDGD	
CC(=O)N[C@](C)(C(=O)NNc1nc(-c2ccccc2)no1)c1ccc(S(C)(=O)=O)cc1	797725870	UKDZCMQDYBRXCU-FQEVSTJZSA-N	443.485	1.635	50	20	IDGD	
O=C(NCc1ccncc1OCC(F)(F)F)NNC(=O)[C@@H]1COc2ccccc2O1	798525284	PPMXFCVIKGORAE-HNNXBMFYSA-N	426.351	1.693	50	20	IDGD	
O=C(NNC(=O)c1sc(N2CCOCC2)nc1-c1ccccc1)C(=O)N1CCCC1	799594549	CISTWLKRWFRCAZ-UHFFFAOYSA-N	429.502	1.030	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccc(OC(F)(F)F)c(C#N)c1	799835594	UWOLSIMXMYVORN-UHFFFAOYSA-N	436.346	1.794	50	20	IDGD	
CC(=NNC(=O)[C@@H](C)NS(C)(=O)=O)c1c[nH]c2ccc(Br)cc2c1=O	799878622	BWBMLFORCCOXRA-SECBINFHSA-N	429.296	1.069	50	20	IDGD	
C[C@H](C(=O)NNc1cc([N+](=O)[O-])ccc1Br)S(=O)(=O)C1CCOCC1	800618237	LTJFILPOXMTQBO-SECBINFHSA-N	436.284	1.783	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)c2ccc(S(N)(=O)=O)s2)cc1Cl	802075455	AUDQPQMBEXUJLB-UHFFFAOYSA-N	434.883	1.533	50	20	IDGD	
CN(C(=O)OC(C)(C)C)[C@H](C(=O)NNc1cccc(S(C)(=O)=O)c1)c1cnn(C)c1	803038428	SFMUDKIMOXGBOP-INIZCTEOSA-N	437.522	1.875	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)C[C@@H]2COCCN2C(=O)OC(C)(C)C)cn1	803183685	YAGGQIRYQVYUBO-CYBMUJFWSA-N	425.511	1.434	50	20	IDGD	
COC(=O)c1cn(CCNC(=O)/C(C#N)=C/c2cc(C)n(C[C@@H]3CCCO3)c2C)nn1	803644190	VDIBDXKYHSOTQF-LTXFRBGYSA-N	426.477	1.385	50	20	IDGD	
COCCNC(=O)c1cccc(NC(=O)NNC(=O)[C@H](C)Oc2ccc(C(C)=O)cc2)c1	806627280	PQPUGZJPIJERLG-HNNXBMFYSA-N	442.472	1.886	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccc(F)c(N3CCCNC3=O)c2)c1	806805497	ULAOPBBUOBSLIT-UHFFFAOYSA-N	449.464	1.615	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1nc(C2CCOCC2)cs1	806974755	GMHHTMCAQRHQPJ-NSHDSACASA-N	436.465	1.730	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ccc(-n3ccnc3)nn2)cc1Br	807429412	QZFHTEQZNDINBJ-UHFFFAOYSA-N	432.238	1.515	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NN=Cc2ccc(F)c(S(N)(=O)=O)c2)CC1	807973221	NZALHBVVHSYSEY-UHFFFAOYSA-N	443.501	1.506	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(F)c(C(=O)OC)c1F	810385473	UHTWGDHTAHEJQA-UHFFFAOYSA-N	435.383	1.479	50	20	IDGD	
Cc1ccc(S(=O)(=O)NC2CC2)cc1C(=O)NNC(=O)[C@H](C)Oc1ccc(F)cc1	811884885	DNKAQKATHVNDBL-ZDUSSCGKSA-N	435.477	1.803	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ncccc2C)cc1S(=O)(=O)C1CCCC1	815570589	HIIGWDQXLZBLMS-UHFFFAOYSA-N	444.513	1.814	50	20	IDGD	
CC(C)n1ncc2ccc(NC(=O)C(=O)NNc3ccccc3S(=O)(=O)N(C)C)cc21	815750977	OLXZBKUERGLPBS-UHFFFAOYSA-N	444.517	1.949	50	20	IDGD	
CCOc1ccc(NNC(=O)C(=O)Nc2ccc(CN3CCN(C(C)=O)CC3)cc2)cc1	815816185	LRGRNUVHCWPNLY-UHFFFAOYSA-N	439.516	1.831	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNS(=O)(=O)c2ccc3oc(=O)ccc3c2)cc1	903939483	RKAOAVYQOVWELD-ZDUSSCGKSA-N	432.454	1.969	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)c3cccnc3)CC2)cc1	912628678	HTMIIFSGWIDHGV-UHFFFAOYSA-N	432.502	1.342	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCCCN(C)C1CCCCC1	913463133	NXWBGSYNADAUPK-UHFFFAOYSA-N	438.598	1.887	50	20	IDGD	
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC(=NNC(=O)[C@H](C)Oc2ccc(F)cc2)CC1	914559401	MGDIULKGUPINQF-AWEZNQCLSA-N	437.497	1.890	50	20	IDGD	
CN(CC(=O)NNC(=O)c1ccc2c(c1)OCO2)C(=O)c1ccc(Br)s1	916743951	LDAHTDWKPRRLPU-UHFFFAOYSA-N	440.275	1.773	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1ccccc1SCc1cn2ccccc2n1	918208631	DLQSTOVVCGIGEM-CQSZACIVSA-N	444.538	1.822	50	20	IDGD	
CCS(=O)(=O)N1CCC[C@@H](C(=O)NNC(=O)Cc2nc(-c3ccccc3)cs2)C1	918556606	YGKLYOQVTHMXDT-OAHLLOKOSA-N	436.559	1.562	50	20	IDGD	
Cn1cc(C(=O)NNS(=O)(=O)c2ccc(F)c(S(C)(=O)=O)c2)c2ccccc21	918754170	DJBHYDNPKNAKSH-UHFFFAOYSA-N	425.463	1.344	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCCC(=O)NNC(=O)Cc2ccccc2OC)cc1	919820488	GVNBXOJIHVWHGJ-UHFFFAOYSA-N	435.502	1.152	50	20	IDGD	
O=C(NN=Cc1cc(Br)c2c(c1)OCCCO2)N[C@H]1CCS(=O)(=O)C1	921260298	WOIJIBKKZYBEGE-NSHDSACASA-N	432.296	1.431	50	20	IDGD	
O=C(NNC(=O)c1cncn1-c1ccccc1)c1cncc(I)c1	1319732802	KBXAROWWBZVBRE-UHFFFAOYSA-N	433.209	1.947	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)NCc1cccc(OCC(F)(F)F)n1	1320952059	JIEDRVYKWXLYFU-UHFFFAOYSA-N	428.367	1.941	50	20	IDGD	
COC(=O)N1CCC[C@H](NC(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)C1	1321909255	RWXXZURBQAYZGT-AWEZNQCLSA-N	427.502	1.195	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)CC1(CC(=O)N2CCOCC2)CCCC1	1322110986	SARPRARIKNBJND-INIZCTEOSA-N	435.496	1.940	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)NC[C@@H]3CCOC3)c2)cc1	1323296454	HASYVAOXLHDCDJ-AWEZNQCLSA-N	448.501	1.477	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)[C@]3(F)CCOC3)c2)c(C)c1	1326644779	SKVFBFIICFPVEV-FQEVSTJZSA-N	435.477	1.994	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCc1cc2c(nc1O)CCC2	1352304940	JQIPZRZNBRPCGY-UHFFFAOYSA-N	432.506	1.022	50	20	IDGD	
COc1ccc2c(/C=C/C(=O)N3CC[C@]4(C3)CN(C(=O)[C@H](O)CCl)CCO4)c[nH]c2c1	1778118863	YOUUYMWSEVFIGV-NNVWVVBJSA-N	447.919	1.619	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1cccc(F)c1)C2	1782210854	SEQWQKAUGDGIII-AUSIDOKSSA-N	448.539	1.255	50	20	IDGD	
CSCC[C@H](O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CO[Si](C)(C)C)C2	1782231363	NAAVMPVRJHLCDM-FRQCXROJSA-N	432.659	1.466	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)Cc2ccc(O)cn2)C1	1782635363	BTPYVPQTSGBFFX-URKNILKWSA-N	440.338	1.627	50	20	IDGD	
CCCNC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](Br)CC)C2)C1	1783344277	SERAFESSQABEQP-KBXCAEBGSA-N	432.359	1.296	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3ccc(OC)c(O)c3)[C@H]2C1	1783786152	RIAIXRIXXRQKFT-GGXPGOJBSA-N	440.924	1.177	50	20	IDGD	
CCOC(CC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](Br)CC)CCO2)OCC	1784166497	HIJGUSSMGYKUBN-KDOFPFPSSA-N	435.359	1.779	50	20	IDGD	
Cc1cc(C)n(CCC(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)n1	1784319258	NDULHPYYPDQMAU-AUUYWEPGSA-N	441.370	1.751	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)[C@H](O)c1ccccc1	1786672224	WREPDYZSBSYXOT-RFBLXINOSA-N	429.286	1.390	50	20	IDGD	
O=C(Cc1cnccn1)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1	1788140566	YJEPEVQLCMVQKQ-UHFFFAOYSA-N	430.273	1.147	50	20	IDGD	
Cn1cccc1C(=O)C(=O)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1	1788145509	XASUHSBBFNAKBN-UHFFFAOYSA-N	445.284	1.336	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nnsc3C3CC3)C[C@@H]21)[C@H](F)Br	1789922608	JDWWXWITTROQIC-RMIALFOJSA-N	447.330	1.699	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC1(c2ccc(NC(=O)c3cc[n+]([O-])cc3)cc2)CCC1	1789952314	GTMDHHFPOVDAGS-UHFFFAOYSA-N	446.467	1.380	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CSc3ccncc3)C[C@@H]21	1791252310	GBGILPCFBPAPSR-HJWJTTGWSA-N	427.954	1.407	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/c3cccc(OC)c3)C[C@@H]21	1791257808	ULMQALSNNVUWFI-ZTXCGUALSA-N	436.936	1.942	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)NC(=O)OC(C)(C)C)C2	1793444818	DMDCPDAGKAVOTM-RBZJEDDUSA-N	431.961	1.897	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cc(F)cc(F)c1	1795844075	WILAIEOSFGFJNU-YVWYUNDQSA-N	426.536	1.948	50	20	IDGD	
COc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Cl)cc1NC(C)=O	1796366050	IPVXFLZXOXNRSP-RMHZUWNSSA-N	427.860	1.391	50	20	IDGD	
C=CC[C@H](CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Cl)NC(=O)OC(C)(C)C	1796369756	CSFUFNOCKSBFLK-AEKWLRTRSA-N	447.935	1.970	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cn(C)c2ncccc12	1797577574	MDAXVPFSEWTQFD-RMHZUWNSSA-N	449.349	1.950	50	20	IDGD	
CC#CC[C@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc(B(O)O)c1)C2)c1ccccc1	1798553501	NFWXYYJKERLCTC-KIHHCIJBSA-N	444.340	1.815	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(Cl)ncn1	1798997898	UGVIBVFQAHHVEN-SIENDBQGSA-N	443.895	1.516	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C=C/C1CCCCC1	1799315247	QZUFZEWWAVULJG-NECVAMPVSA-N	441.532	1.025	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCCc1ccncc1)C2)[C@@H](F)Br	1799344235	CRWMPEWLFLJXHH-YALNPMBYSA-N	428.302	1.684	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)NC(=O)OC(C)(C)C	1800597826	SUGAJCZNLSHKOR-WHRXGGIHSA-N	448.358	1.641	50	20	IDGD	
COc1ccnc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)Br)c1OC	1800760255	LDUSWTXHMYWVCT-FMSGJZPZSA-N	442.310	1.085	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)Br	1800763205	STGOABNDRPUEGO-OWDFPOFWSA-N	443.338	1.115	50	20	IDGD	
COc1ccc(CC(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)cc1	1803138275	INFYUGGZJPGVJC-SLYNCCJLSA-N	431.920	1.938	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc3nncn3c2)[C@H]1c1cccnc1)[C@H](O)CCl	1803142848	KWDLOQYUUWYPRL-LESCRADOSA-N	428.880	1.044	50	20	IDGD	
CCC(=O)N[C@H](C)C(=O)NC[C@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1	1803429940	GCVFCGGNBOYHQB-SIIHOXLZSA-N	439.354	1.787	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)C23CC(F)(C2)C3)[C@@H]1c1cccnc1	1803661480	RMRSASKBGVQABP-GCKXXRJTSA-N	431.512	1.353	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H](CNC(=O)[C@@H](C)CC(N)=O)[C@H]1c1cccnc1	1803671843	NNIVUEYMJVNNBQ-PWXKEOIMSA-N	439.354	1.772	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)CCN2C(=O)C=CC2=O)[C@@H]1c1cccnc1	1803920177	UOQYACXLSWIXIM-FTRWYGJKSA-N	432.908	1.420	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)cc1	1807374958	LPLZKUMXMBPXNT-JTHBVZDNSA-N	443.312	1.703	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@H](CNC(=O)Cn2cnnn2)[C@H]1c1cccnc1	1807614628	RVZFVMTZBPYPRR-LXZKKBNFSA-N	426.308	1.010	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)c1ccn2ccnc2c1	1809871947	RVLLPJVDKBRCDE-YQVWRLOYSA-N	427.892	1.649	50	20	IDGD	
O=C(CCc1ccsc1)N1CCCC2(CCN(C(=O)c3ccc(B(O)O)cc3)CC2)C1	1810042106	IXPVZJFTEFMVHV-UHFFFAOYSA-N	440.374	1.906	50	20	IDGD	
Nc1n[nH]c(CCC(=O)NC[C@H]2CCN(C(=O)C(Cl)Cl)[C@H]2c2cccnc2)n1	1810156876	LCKQGYIEELYZLT-RISCZKNCSA-N	426.308	1.224	50	20	IDGD	
O=C(/C=N/O[C@@H]1CCCCO1)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1	1810358345	RUBZDWYXCKQLCX-XMIRXOPOSA-N	438.912	1.216	50	20	IDGD	
COc1ccccc1CC(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1	1812762908	JKFYBSHMSCOICQ-WFXMLNOXSA-N	431.920	1.938	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)CNC(C)=O)[C@H]1c1cccnc1	1812779301	SCCXURWGJNJBAU-VYDXJSESSA-N	425.327	1.397	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)n2cnnn2)[C@H]1c1cccnc1	1812867939	PGEXJCWWNZREOY-NEBZKDRISA-N	436.314	1.119	50	20	IDGD	
COC(=O)CSCC(=O)N1CC[C@H](CNC(=O)C(Cl)Cl)[C@H]1c1cccnc1	1813075770	JEYQOUBYFDRVHB-IUODEOHRSA-N	434.345	1.797	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(Cl)o1)CC2)c1ccc(B(O)O)cc1	1815340978	RLVIBISARMMRBY-LBPRGKRZSA-N	445.693	1.609	50	20	IDGD	
O=C1Cc2cc(C(=O)Nc3cc([C@H]4CCCCN4C(=O)[C@@H](O)CCl)[nH]n3)ccc2N1	1818979323	BQRVAXPFIPYFOY-CVEARBPZSA-N	431.880	1.810	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H]1CC=CCC1)CC2	1819793708	RPAXKNGHADCQJF-CHWSQXEVSA-N	440.529	1.724	50	20	IDGD	
N#Cc1cccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)c1	1820483617	AVDVYQYCKLKTNT-FQEVSTJZSA-N	443.272	1.581	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnncc3C(=O)O)sc2C1	1820502148	FBQRNHICBXVCOT-LDYMZIIASA-N	439.881	1.111	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](C)n2cnnn2)[nH]n1	1822092714	UEUQXGFSYJPQBY-NTZNESFSSA-N	439.318	1.823	50	20	IDGD	
Cc1cccnc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1	1822410911	RZBQSKWKYSSEMN-INIZCTEOSA-N	427.509	1.792	50	20	IDGD	
NC(=O)c1nccnc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)C(Cl)Cl)n[nH]1	1822423793	LOCGHWOEWQQGJK-VIFPVBQESA-N	426.264	1.408	50	20	IDGD	
C[C@H](C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@](C)(Cl)CCl)sc2C1)n1cnnn1	1822869931	PAJLWAIZJTZCPR-XWRVAKJBSA-N	432.337	1.539	50	20	IDGD	
COc1nn(C)cc1C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1	1823001173	BDOVWMZVRKGGLA-WRWORJQWSA-N	446.302	1.802	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2CCCCO2)CC1	1823818119	KXDHOIIGJDWXIA-SFTDATJTSA-N	428.338	1.169	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](O)CCl)CC2	1825501576	GKTNBZHRAQKCPS-GXSJLCMTSA-N	432.930	1.180	50	20	IDGD	
Cc1noc(CC(=O)N[C@@H]2CCc3nc(NC(=O)[C@H](C)Br)sc3C2)n1	1825642875	WHROSTCUDXEZRQ-IONNQARKSA-N	428.312	1.773	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)Cn1cc([N+](=O)[O-])cn1)CC2	1825993017	DACLOTWSAQVOND-MWLCHTKSSA-N	442.885	1.114	50	20	IDGD	
CCc1ncccc1C(=O)N[C@@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1	1826080370	GGGFMXUWFIMPIT-CYBMUJFWSA-N	444.561	1.699	50	20	IDGD	
O=C(c1cccc(F)n1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827052449	ZUODCPLPLOCCPA-FQEVSTJZSA-N	439.296	1.448	50	20	IDGD	
Cc1ccc(C)c(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cccc(B(O)O)c2)CC3)c1	1827551111	GYBVNMBYACNGMM-KRWDZBQOSA-N	449.341	1.979	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)c2[nH]cc3c2CCC3)CC1	1829584366	GDCHGJCWLPCPKL-QFIPXVFZSA-N	449.360	1.730	50	20	IDGD	
CN(C)C(=O)NCC(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H](F)Br)CC1	1830378168	CJZONRLKBJHQHO-UKRRQHHQSA-N	435.338	1.568	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CNC(=O)N(C)C)CC1	1831651102	WVDLLTXJMYLLCY-ZFWWWQNUSA-N	431.375	1.661	50	20	IDGD	
C=CCOCCCC(=O)N1CCC([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1	1831870876	IFFATLKYIINCKG-HXUWFJFHSA-N	436.597	1.962	50	20	IDGD	
Cc1ccccc1OCC(=O)N1CCC(N2CCC(NC(=O)[C@H](O)CCl)CC2)CC1	1833308935	DWVIHFOFIVMRQM-LJQANCHMSA-N	437.968	1.545	50	20	IDGD	
CCN(CC)C[C@@H](C)C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)CCl)CC2)CC1	1833311652	BOKWUCBNUYBAPZ-VQIMIIECSA-N	431.021	1.136	50	20	IDGD	
Cc1noc(N)c1C(=O)NC1CCN(C2CCN(C(=O)[C@H](C)Br)CC2)CC1	1834702358	BISVYIIYBMYQOP-NSHDSACASA-N	442.358	1.534	50	20	IDGD	
O=C(CCc1cccnc1)N1CCOC[C@@]2(C1)CN(C(=O)CCBr)CCO2	1834822478	PLOVMWFCLWSCPL-LJQANCHMSA-N	440.338	1.256	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CCBr)CCO2)C1	1834824630	CRGUCBKMGGEMPJ-SMDDNHRTSA-N	442.148	1.011	50	20	IDGD	
Cc1cnn(CC(=O)NC2CCN(C3CCN(C(=O)[C@@](C)(Cl)CCl)CC3)CC2)c1	1834894536	BTTOJQIQBDMTGA-FQEVSTJZSA-N	444.407	1.999	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccccc3F)CCO2)C1	1835007994	KFNMGNNQTVNDOE-JXFKEZNVSA-N	428.888	1.078	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1)c1ccc(CO)o1	1835927447	MGGGMUZHRPANBK-UHFFFAOYSA-N	442.354	1.742	50	20	IDGD	
O=C(c1cnc2ccccc2n1)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836717894	NBWZGNQUUXUMBQ-FQEVSTJZSA-N	446.935	1.842	50	20	IDGD	
O=C(c1ccc2scnc2c1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1837063318	OFDXYGXQSWKUPP-YJBOKZPZSA-N	427.885	1.901	50	20	IDGD	
COc1ccnc(C(=O)N2CCO[C@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)c1	1837955274	ZGUSLBQSMMTRGY-FQEVSTJZSA-N	437.569	1.012	50	20	IDGD	
CC(C)n1nccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)Br)C2)C1	1838024778	OOVMMMIFCKCYET-KBXCAEBGSA-N	443.342	1.317	50	20	IDGD	
C[C@H](C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2)n1cccc1	1839154874	APMSLULRIBPVNC-ATZDWAIDSA-N	432.348	1.742	50	20	IDGD	
Cc1cccc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)n1	1839198580	JJRZXNHRHQIQOM-AEFFLSMTSA-N	444.301	1.079	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CC[C@@H](C)O3)C2)C1	1839965376	WXJHPTIQRLTVOR-FSZRXZPDSA-N	433.343	1.184	50	20	IDGD	
N#Cc1ccc(CCC(=O)N2CCOC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)cc1	1840187078	JTKFXVMONICZJO-FQEVSTJZSA-N	440.327	1.751	50	20	IDGD	
O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1C[C@@]1(F)Cl)CCO2	1840244139	WBEZYFZXBCXLPV-CQDKDKBSSA-N	427.698	1.152	50	20	IDGD	
Cc1ccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](C)CBr)C3)C2)o1	1840506850	SBSZHGPVORAXDY-IFXJQAMLSA-N	443.338	1.618	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)c(Cl)c1	1840734551	VFGOBSNZNPFPFH-CRAIPNDOSA-N	435.279	1.953	50	20	IDGD	
N=C(N)SCC(=O)N1CC2(CCCN2C(=O)[C@H](Br)Cc2ccccc2)C1	1845940925	RCHRGGHQODIKOE-CQSZACIVSA-N	439.379	1.823	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)c1ccc(-c3ccc(O)nn3)cc1)C2	1846363788	DTXBGGWPXUUURH-MRXNPFEDSA-N	430.892	1.920	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H]1C[C@H]1c1ccc(F)c(F)c1	1847606291	LWHGXFRSGWMQCL-USNOLKROSA-N	440.255	1.264	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)/C=C/c1cnccn1	1848098700	RIUPLOKZEIFXEM-PLFMJXSHSA-N	449.939	1.824	50	20	IDGD	
O=C(Cc1csc(N2CCCC2=O)n1)NNC(=O)c1nn(-c2ccccc2)cc1O	10159690	XHVDJOXBIVXIGU-UHFFFAOYSA-N	426.458	1.165	50	20	IDGD	
C=CCNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc1	10160007	FDQXFUCILLEHKY-UHFFFAOYSA-N	441.469	1.117	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)CNC(=O)NCc2ccc(C)cc2)cc1	11238249	AMLICGFLGKCBMO-INIZCTEOSA-N	428.489	1.808	50	20	IDGD	
Cc1cccn2cc(COc3ccc(C(=O)NNC(=O)[C@@H]4CCS(=O)(=O)C4)cc3)nc12	11715525	TVXNNMQDTQDLMR-MRXNPFEDSA-N	442.497	1.417	50	20	IDGD	
Cn1cc(/C=C/C(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)cn1	15427870	SSZQKMRHTGTYBW-CMDGGOBGSA-N	431.499	1.757	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(C)c(C(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)c1	17159204	LIKKOADVGNUAFE-UHFFFAOYSA-N	449.573	1.897	50	20	IDGD	
CCCc1nnc(S)n1CC(=O)NNC(=O)[C@@H](C)Oc1cccc(Br)c1	24312596	LNOXQHWFLSCKRJ-SNVBAGLBSA-N	442.339	1.897	50	20	IDGD	
C[C@H](NC(=O)c1cccs1)C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	24632729	DGSSBDHMAZRQCQ-INIZCTEOSA-N	429.546	1.226	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@H](C)N2C(=O)NC3(CCCC3)C2=O)ccc1OC(C)C	110367536	SWGDAKSOCVEBEW-ZDUSSCGKSA-N	432.477	1.497	50	20	IDGD	
C[C@@H]1CC(C)(C)C[C@@]2(C1)NC(=O)N(CC(=O)NNc1nc(-c3ccncc3)no1)C2=O	726377425	YZDCHMIQYDPNAZ-MPBGBICISA-N	427.465	1.712	50	20	IDGD	
CCOc1ccc(C(=O)NCC(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)cc1	726867376	HRVJQWQKCBEUIK-UHFFFAOYSA-N	432.502	1.399	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@H]2C(=O)NNc2nc(-c3ccncc3)no2)c(OC)c1	728073290	CARGYBHVYFNQHQ-INIZCTEOSA-N	438.444	1.897	50	20	IDGD	
COCCS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cccc(OC(F)F)c2)cc1	728486009	LRRJFTPODLGVJQ-UHFFFAOYSA-N	428.413	1.783	50	20	IDGD	
CS(=O)(=O)c1cc(C(=O)NNC(=O)c2cccc(OC(F)F)c2)cc([N+](=O)[O-])c1	728487153	OCJNJIDZOWIGJA-UHFFFAOYSA-N	429.357	1.675	50	20	IDGD	
COc1ccc(C(=O)OCC(=O)NNC(=O)Cc2nc(C)cs2)c(Br)c1	728730787	VUUULMMMNAFELH-UHFFFAOYSA-N	442.291	1.770	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)[C@H]1CCN(c2ccccc2Br)C1=O	730782287	LYEXOIRCDGPXBN-GFCCVEGCSA-N	448.273	1.734	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)c1cc(I)ccc1O	730837396	YEKNPMUWFCTTSU-UHFFFAOYSA-N	428.182	1.542	50	20	IDGD	
Cc1c(C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)nnn1-c1ccc(-c2ccccc2)cc1	731163325	DWXUYNRNXOQTAR-QGZVFWFLSA-N	439.497	1.438	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN(C(=O)Nc2ccccc2)C1)c1ccc(-n2cnnn2)cc1	731853883	LGEYGHLEFKQFTI-MRXNPFEDSA-N	434.460	1.367	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])o1	731874864	SHBCJZWOTRIRKZ-DGCLKSJQSA-N	434.380	1.546	50	20	IDGD	
O=C(N[C@@H]1CCS(=O)(=O)C1)[C@H]1CCCC[C@H]1C(=O)NNc1nc(-c2ccccc2)no1	732111537	AOTZMTGZDHFNQA-OWCLPIDISA-N	447.517	1.289	50	20	IDGD	
Cn1c(=O)nc(O)c2nc(CCC(=O)NNc3nc(-c4ccc(Cl)cc4)no3)[nH]c21	732976811	YWNVISMITOWZHM-UHFFFAOYSA-N	430.812	1.142	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CN2CCN([C@@H]3CCN(c4ccccc4)C3=O)CC2)cc1	732985248	MRUXUHVGRABHRP-OAQYLSRUSA-N	435.528	1.179	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)c3cn(C)nc3C)c2)cc1	733252249	KCCXAORIDPCIKJ-UHFFFAOYSA-N	443.485	1.613	50	20	IDGD	
Cc1ccc(-n2c(NNC(=O)c3cn(C)c(=O)nc3O)nc3ccccc3c2=O)c(C)c1	733265194	LBOJLMGCRGANJU-UHFFFAOYSA-N	432.440	1.559	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc2c(c1)OCCCO2)NNc1nccc2sccc12	734249019	GTXYKVYVGVVFIM-UHFFFAOYSA-N	434.499	1.879	50	20	IDGD	
COc1ccc(CN2CC[C@H](NC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)C2=O)cc1	734683177	GIVZYEXAJALWRH-KRWDZBQOSA-N	427.417	1.349	50	20	IDGD	
COc1ccc(S(=O)(=O)C[C@@H](C)C(=O)NNC(=O)c2ccc(OC)c(OC)c2)cc1	734990180	BGPSXSWJMSCUHG-CYBMUJFWSA-N	436.486	1.583	50	20	IDGD	
C[S@](=O)CCNC(=O)/C(C#N)=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	735045866	KQTRPYZTOHRCAA-LXMSFFOBSA-N	433.921	1.481	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)c2nonc2C)c1	736668638	ZRBAMIYEHQYLGS-UHFFFAOYSA-N	431.430	1.262	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)c2cc(N3CCNC3=O)ccc2F)cc1	737765266	CWICDNZOZGABCW-ZDUSSCGKSA-N	430.436	1.983	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)c2ccc(C[C@H]3CC(=O)NC3=O)cc2)cc1	741144011	FNMNKEHBZRZDDP-PBHICJAKSA-N	439.468	1.519	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)COc2ccc(Br)cc2)c1	744467098	KMVMRSOTHCWFNG-UHFFFAOYSA-N	432.230	1.704	50	20	IDGD	
N#CCOc1ccc(C=NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1	744563443	PRRCGYLVKZDNFJ-UHFFFAOYSA-N	428.470	1.374	50	20	IDGD	
Cn1ccc(N2CCC[C@@H](NC(=O)NNC(=O)Nc3ccc(OC(F)F)cc3)C2=O)n1	745883297	NUTOJCLXUYRWHQ-CYBMUJFWSA-N	437.407	1.553	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN(C(=O)NC2CCCC2)C1)c1nnc(O)c2ccccc12	746096180	BVNKYGDJCNRYNB-CYBMUJFWSA-N	426.477	1.461	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)NCC(=O)NCCO)c(C)n1-c1ccc(Br)cc1	746225194	BPRWXMXRPFHAII-MHWRWJLKSA-N	445.317	1.988	50	20	IDGD	
COc1cc(C)nc(NNC(=O)CCCCC/N=C2/NS(=O)(=O)c3ccccc32)n1	746624167	ZYRHPYIHZFXZJP-UHFFFAOYSA-N	432.506	1.536	50	20	IDGD	
CCOc1ccc(C(=O)NCC(=O)NNC(=O)Cc2cn3ccccc3n2)cc1OCC	746700994	DZWQYHYSZJBAPH-UHFFFAOYSA-N	439.472	1.252	50	20	IDGD	
NS(=O)(=O)c1cccc(N2C[C@H](C(=O)NNc3ccc(C(F)(F)F)cc3)CC2=O)c1	748508414	XBNLVAYYZIHGDS-LLVKDONJSA-N	442.419	1.849	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)NCc1cccc(Cn2cnc3ccccc32)c1	748629121	ZPGNSCHCVYNKOA-MRXNPFEDSA-N	425.489	1.967	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)NNC(=O)c2cc(OC)ccc2Br)o1	748642886	OTYDIKJTUXHTRT-UHFFFAOYSA-N	447.263	1.851	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)[C@@H]1CCCN1C(=O)c1ccc2c(c1)OCO2	749715587	MWCPMBMPUKRETH-KRWDZBQOSA-N	439.468	1.809	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)c1cc(O)nc2c(Br)cccc12	749948605	KUKDROHPJIIGEV-UHFFFAOYSA-N	449.286	1.955	50	20	IDGD	
CCOCCCn1c(NNC(=O)c2ccnc(C(=O)OC)c2)nc2ccccc2c1=O	751381470	BICRXOJBEKTYGE-UHFFFAOYSA-N	425.445	1.762	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)N1CC[C@@H](OCCCc2ccccc2)C1	752008901	AVNXIGZODQRGGM-QGZVFWFLSA-N	430.530	1.942	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@](C)(CNC(=O)NNC(=O)C(=O)Nc2ccccn2)C1	753372896	OZCWFQQPSDGOBA-FQEVSTJZSA-N	434.497	1.388	50	20	IDGD	
Nc1nc(Cl)cc(NNC(=O)C2CCN(S(=O)(=O)c3ccccc3F)CC2)n1	753465069	YCJRHALTEDCVSA-UHFFFAOYSA-N	428.877	1.395	50	20	IDGD	
O=C(CNc1ccccc1)NNC(=O)c1cccn2c(I)cnc12	754415783	GBCLSBMFVIBUPE-UHFFFAOYSA-N	435.225	1.812	50	20	IDGD	
O=C(NCCN1C(=O)[C@@H]2[C@@H](C1=O)[C@H]1C=C[C@H]2C1)NNC(=O)c1cc2c(s1)CCCCC2	755248674	WPKWGOBISUFKEN-USJZOSNVSA-N	442.541	1.768	50	20	IDGD	
CCN1CCN(c2ccc(NC(=O)NNC(=O)COc3ccccc3[N+](=O)[O-])cc2)CC1	755473865	PEWCIRPFTHXOPV-UHFFFAOYSA-N	442.476	1.968	50	20	IDGD	
Cc1ccc(C(=O)N(C)C)cc1NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1	755882951	UVEABLGJTPYDSO-UHFFFAOYSA-N	425.493	1.556	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)Nc1ccccc1CN1C(=O)CCC1=O	756221048	NDUXBWMRJSIOQI-UHFFFAOYSA-N	447.492	1.793	50	20	IDGD	
CCn1ncc2ccc(NC(=O)NNC(=O)CN(C)S(=O)(=O)c3ccc(C)cc3)cc21	756269066	KRYSUHKNDOFRLP-UHFFFAOYSA-N	444.517	1.838	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)Nc2ccn(CCN3CCOCC3)n2)cc1	756647805	URDXPNMUPWHBAZ-INIZCTEOSA-N	446.508	1.234	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)COc2ccccc2C#N)cc1N1CCOC1=O	756818875	QCQJCESEUWLRRI-UHFFFAOYSA-N	425.401	1.755	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)CN2C(=O)NC3(C[C@H](C)C[C@@H](C)C3)C2=O)cc1C	756866108	WSZGRXFLEHAORR-ZIAGYGMSSA-N	430.505	1.576	50	20	IDGD	
COc1ccccc1N1CC[C@@H](NC(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)C1=O	757288325	XGIHQYVNQRRJQN-MRXNPFEDSA-N	439.472	1.386	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)N[C@H]2CCN(c3ccccc3OC)C2=O)cc1	757288391	YWXMNPZLFTXXGX-KRWDZBQOSA-N	426.473	1.772	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1cccc2c1CCN2C(=O)OC(C)(C)C	757620502	JQVXZPJYOPWWBQ-NSHDSACASA-N	441.510	1.075	50	20	IDGD	
COC(=O)c1cc(NC(=O)NNC(=O)c2cc(-c3ccc(OC)c(OC)c3)[nH]n2)cn1C	757675956	PTKHOUMCICCCGB-UHFFFAOYSA-N	442.432	1.686	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c(Cl)n1	757691124	VAACRMRHJFLMTN-UHFFFAOYSA-N	427.870	1.460	50	20	IDGD	
Cc1ncsc1C(=O)NNC(=O)Nc1cccc(S(=O)(=O)NCc2ccco2)c1	757866985	NIJDCDPLLCLXPJ-UHFFFAOYSA-N	435.487	1.990	50	20	IDGD	
Cc1c(C(=O)OCC(=O)NNC(=O)c2ccccc2)cnn1CCO[C@@H]1CCCCO1	758618631	JTSUTDPGAKXPPE-LJQANCHMSA-N	430.461	1.353	50	20	IDGD	
C[C@@H]1CN(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)C[C@H](c2ccsc2)O1	759718209	KCPHMCQAKMERLL-IUODEOHRSA-N	437.547	1.858	50	20	IDGD	
NC(=O)[C@@H]1CC[C@H](CNC(=O)C(=O)Nc2ccccc2S[C@@H](Cl)C(F)(F)F)O1	760120695	JTLKQZXIYWRGOX-UYNUJQBQSA-N	439.843	1.994	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)c1ccc(F)c(NS(C)(=O)=O)c1	761625701	SFIADSDOBHPERT-UHFFFAOYSA-N	427.479	1.759	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)N[C@@H]2CCCN(c3ccccc3F)C2=O)cc1C	761821536	OZAYPTSKLUPMQH-QGZVFWFLSA-N	441.463	1.907	50	20	IDGD	
O=C(NNc1nccc(N2CCOCC2)n1)c1cnc2c(cnn2Cc2ccccc2)c1	762855405	NNAPFAYFHPENLH-UHFFFAOYSA-N	430.472	1.863	50	20	IDGD	
CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)NNC(=O)CCCNC(=O)OC(C)(C)C	763439815	VABMWESZJUYNAD-UHFFFAOYSA-N	430.483	1.772	50	20	IDGD	
CC(=O)c1ccc(NC(=O)C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1	763530758	HQSIJQGLSKKSOO-UHFFFAOYSA-N	437.500	1.187	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(OC3CCCC3)nc2)cc1	763659163	KBFGVBKHELZFKP-UHFFFAOYSA-N	428.445	1.577	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)C(=O)Nc1cccc(OC(F)(F)F)c1	763804450	SWAIGQZYZCCAMQ-UHFFFAOYSA-N	442.306	1.658	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(-n3cccn3)c(Cl)c2)cc1	763819872	AGTPGCHTGKXOMX-UHFFFAOYSA-N	427.848	1.999	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccnn1CCc1ccccc1	763837469	GNTHNBVNDGGYMW-UHFFFAOYSA-N	425.420	1.430	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)cc(OC)c1OC	763852445	WDCYIFMRXWYRRL-AWEZNQCLSA-N	445.472	1.883	50	20	IDGD	
Cc1nc(C)n(-c2ccccc2NC(=O)C(=O)NNC(=O)Cc2c[nH]c3ccccc23)n1	763860976	MSQANIBTVHVQMU-UHFFFAOYSA-N	431.456	1.694	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccc(NC(=O)c2ccccc2)nc1	763919824	WFKYMHBEWLFZCJ-UHFFFAOYSA-N	435.415	1.802	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)C(=O)Nc1cccc(C(=O)N2CCc3ccccc32)c1	763999088	NCJVNSGIVLCSHK-UHFFFAOYSA-N	431.452	1.628	50	20	IDGD	
Cc1ccc(Cn2cccc(NC(=O)C(=O)NNC(=O)c3ccc(C)cc3O)c2=O)cc1	764105607	WAQUODDUUWIHRZ-UHFFFAOYSA-N	434.452	1.619	50	20	IDGD	
COCCc1noc(-c2cc(Cl)ccc2NC(=O)C(=O)NNC(=O)CC(F)(F)F)n1	764115019	KYCIAVZEHUELHW-UHFFFAOYSA-N	449.773	1.617	50	20	IDGD	
O=C(CC(F)(F)F)NNC(=O)C(=O)Nc1ccc(N2CCc3sccc3C2)nc1	764115537	RNMYMJYMWWTCII-UHFFFAOYSA-N	427.408	1.744	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccccc2Cn2cncn2)o1	764138280	GBURBIKQSANTJU-UHFFFAOYSA-N	439.476	1.161	50	20	IDGD	
Cc1ccn(-c2ccccc2NC(=O)C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)n1	764205061	XZVOYTSUNJWXPU-UHFFFAOYSA-N	444.492	1.572	50	20	IDGD	
COc1ncnc(N(C)C)c1NC(=O)C(=O)NNC(=O)c1c(Cl)cccc1Cl	764221483	LEFREFVSAPMRNE-UHFFFAOYSA-N	427.248	1.258	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)C(=O)Nc2cnn(CC(F)F)c2)c1	764231908	JTDCXKONNRFJAR-UHFFFAOYSA-N	446.208	1.319	50	20	IDGD	
O=C(NNC(=O)c1cccc2ncccc12)C(=O)Nc1cc(N2CCCC2=O)ccc1F	764252780	LOEKCWRVPQEPHT-UHFFFAOYSA-N	435.415	1.900	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1cccc(-c2noc(C3CC3)n2)c1	764275495	MODQRDNMFLCQOK-UHFFFAOYSA-N	437.412	1.485	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)C(=O)Nc1cccc2c1CCN(C(=O)OC(C)(C)C)C2	764296006	RLUQQFKQBIGOFJ-UHFFFAOYSA-N	442.476	1.411	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)C(=O)Nc1cccn(Cc2ccc(F)cc2)c1=O	764320329	XYNKQKCOEFJSDT-UHFFFAOYSA-N	440.406	1.503	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C(=O)Nc1cccc(CN2CCN(C)CC2)c1)c1ccccc1	764329655	XSDSEDYVNKDNPG-NRFANRHFSA-N	437.544	1.714	50	20	IDGD	
COC(=O)CCCOc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)cc1	764345912	LTRORUTUJHVSBF-UHFFFAOYSA-N	449.847	1.777	50	20	IDGD	
COC(=O)c1cc(Cl)ccc1NC(=O)C(=O)NNC(=O)c1cnn(-c2ccccc2)c1	764346157	UNSWPHYMSPRLKW-UHFFFAOYSA-N	441.831	1.712	50	20	IDGD	
COC(=O)c1cc(Cl)cc(NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)c1	764349064	DVXVJOWGRAHRMY-UHFFFAOYSA-N	426.212	1.885	50	20	IDGD	
C[C@@H](NC(=S)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1)c1ccccc1	764514214	LDFKRYJOSDHKQP-QGZVFWFLSA-N	425.558	1.701	50	20	IDGD	
CC(=NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C)c1cc2c(ccc3ccccc32)o1	764813058	UOUJSYULBKATAS-UHFFFAOYSA-N	444.451	1.874	50	20	IDGD	
Cc1ccc(Br)c(S(=O)(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1	765641796	JZOMCJVAFYAJKF-CQSZACIVSA-N	427.276	1.907	50	20	IDGD	
CNC(=O)c1cccc(C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)c1	765752236	PLTDVLYQYCLBGD-UHFFFAOYSA-N	443.935	1.278	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H]2CCO[C@H](C3CC3)C2)c1	765921276	ZRHGUFIIJBNWLQ-WMZOPIPTSA-N	438.550	1.619	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)N1CCNC(=O)[C@@H]1c1ccccc1Br	767731927	KOCNMCUQRFNTNB-WBMJQRKESA-N	425.327	1.504	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2nccc3c(S(N)(=O)=O)cccc23)c2ccccc2n1	768469640	AJCCULCWNKHPKT-UHFFFAOYSA-N	435.465	1.814	50	20	IDGD	
CCNS(=O)(=O)c1cccc(C(=O)NNc2c(OC)cccc2S(C)(=O)=O)c1	768644459	AVXBWHOYTHRHBP-UHFFFAOYSA-N	427.504	1.154	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)CN2C(=O)N[C@@]3(CCCC(C)(C)C3)C2=O)cc1	768927359	GFFLMKOBPKDVDF-OAQYLSRUSA-N	431.493	1.145	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)NC2CCN([C@H]3CCCC[C@@H]3O)CC2)cc1OC	769164268	ABUGMHZAELSFPK-ROUUACIJSA-N	434.537	1.806	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)NCCc2n[nH]c(C)n2)cc1	769775359	GXAYHAAKOAFFKB-LFIBNONCSA-N	448.487	1.127	50	20	IDGD	
CC(=NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1)c1sccc1O	769794896	XNRBGJJNFMEQRP-UHFFFAOYSA-N	436.559	1.609	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1ccc(-n2ncc3ccccc32)cc1Cl	769927938	QDMQJSUQBKIZHA-NSHDSACASA-N	435.893	1.378	50	20	IDGD	
CSc1cccc(C)c1NC(=O)C(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	770773133	DRABUGCNLJMLLS-UHFFFAOYSA-N	425.470	1.364	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3ncccc3C(F)(F)F)CC2)cc1	770788790	WTKOWGRMWSGZKG-UHFFFAOYSA-N	435.450	1.988	50	20	IDGD	
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)NNc1nc(O)c2cnn(C)c2n1	770975319	URCMHESKNFIFCK-MRXNPFEDSA-N	436.476	1.377	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)c1cc(COc2ccc(Cl)cc2Cl)on1	772036469	NSJHGZMGRDKYKG-VIFPVBQESA-N	448.284	1.756	50	20	IDGD	
CC(=O)N(CCC(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1)Cc1ccccc1	772195643	CAGMXCIRPAQVFY-UHFFFAOYSA-N	430.892	1.542	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)NCCNS(=O)(=O)c2ccc(C)s2)c1	772631050	PGOWOUOJFUJZCB-UHFFFAOYSA-N	440.547	1.361	50	20	IDGD	
Cc1nc(NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)ccc1Br	773526612	ABGWWOAFTLVZJK-UHFFFAOYSA-N	427.642	1.911	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)[C@H](C)N2CCN(c3ccc(F)cc3)CC2)nc1C	778430306	RMQGOXCCQQTEHY-HNNXBMFYSA-N	430.484	1.755	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)/C(=C\c1ccco1)NC(=O)c1ccccc1	778432829	ASHYWHFLURNMSJ-FOWTUZBSSA-N	428.445	1.723	50	20	IDGD	
CC(C)(COc1ncccc1Br)NCC(=O)NNC(=O)c1cccc(C#N)c1	779603116	HMMNGBJCQNXZKD-UHFFFAOYSA-N	446.305	1.924	50	20	IDGD	
O=C(NCC1CCN(CC(F)(F)F)CC1)NNC(=O)c1nn(-c2ccccc2)cc1O	780629927	AOLUZXSZTMWSMY-UHFFFAOYSA-N	440.426	1.796	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)c2cc(S(N)(=O)=O)ccc2Br)c1	780790220	SDYKUBKWGZPXDJ-UHFFFAOYSA-N	428.264	1.640	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)NCc1ccccc1CN1CC[C@@H](O)C1	781954857	OJNZQVIWQMIQJY-GOSISDBHSA-N	444.557	1.885	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)N2CCCC2)ccc1OS(=O)(=O)CBr	782418988	WMNVCVKJTAEMSN-UHFFFAOYSA-N	442.309	1.319	50	20	IDGD	
COC(=O)CN1CCN(c2ccc(NC(=O)C(=O)NNc3ccccc3F)cc2)CC1	782706403	XWFKVXSHRVRJIN-UHFFFAOYSA-N	429.452	1.203	50	20	IDGD	
COc1ccc(-c2nn(CCC#N)cc2/C=C(/C#N)C(=O)NCc2cn(C)nn2)cc1OC	783619386	WIVHIFQWELHWAK-SXGWCWSVSA-N	446.471	1.833	50	20	IDGD	
Cc1ccc(NNC(=O)C(=O)Nc2ccc(S(=O)(=O)N3C[C@@H](C)C[C@@H](C)C3)cc2)nn1	783951465	HFOBNYCXCJASCI-OKILXGFUSA-N	446.533	1.533	50	20	IDGD	
COC[C@@H](C)NS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2cccnc2Cl)cc1	784843261	GWOQABPDOMTYRD-LLVKDONJSA-N	441.897	1.130	50	20	IDGD	
CCOc1cc(N2CCN(C)CC2)ccc1NC(=O)C(=O)NNc1cccnc1Cl	784848997	RAIYTLRSESWQNM-UHFFFAOYSA-N	432.912	1.967	50	20	IDGD	
Cc1ccc(C(=O)N2C[C@@H](C)C[C@@H](C)C2)cc1NC(=O)C(=O)NNc1nccn(C)c1=O	785090143	ODDFIXHSCZACTM-OKILXGFUSA-N	440.504	1.289	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CC(c2c(F)cccc2F)=NO1)c1csc(N2CCOCC2)n1	785699907	HRQCQCATDAMMSY-AWEZNQCLSA-N	437.428	1.212	50	20	IDGD	
CC(C)(C)C(=O)NC1CCC(C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)CC1	789212839	LEYWJMQFBHTZSV-UHFFFAOYSA-N	448.476	1.620	50	20	IDGD	
Cc1cccnc1NNC(=O)CCC(=O)N1CCN(S(=O)(=O)c2ccc(F)cc2)CC1	791214228	WRKOSAXKOZSAQJ-UHFFFAOYSA-N	449.508	1.286	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCCCN(C)C)cc1C(=O)NNc1nc2ccccn2n1	791261354	DLLCRLCQQMWZRL-UHFFFAOYSA-N	431.522	1.025	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)[C@@H](C#N)Cc2ccc(C#N)cc2)CC1	792187817	QNJROIQGTDIZMN-QGZVFWFLSA-N	440.504	1.970	50	20	IDGD	
C[C@@H]1CN(C(=O)c2ccc(NC(=O)C(=O)NNc3nc4ccccn4n3)cc2)C[C@@H](C)O1	792393474	HMSUAJGAKQAWGO-ZIAGYGMSSA-N	437.460	1.061	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@H]2[C@H]3[C@@H]4C[C@@H]5[C@@H]6C[C@@H]([C@@H]3[C@@H]64)[C@@H]52)cc1	792804877	YDAZGNSULVEHSD-DLYUNYOKSA-N	429.542	1.157	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)Cc1ccc(S(=O)(=O)N(C)C)cc1	793968286	AJMBTLRXFWHOSW-CYBMUJFWSA-N	439.921	1.748	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NN=C[C@H]2CCCN(C(=O)CNC(=O)OC(C)(C)C)C2)c1	794522888	GSJUAWNERRUDGJ-OAHLLOKOSA-N	446.508	1.519	50	20	IDGD	
Cc1cccc(C(=O)NNS(=O)(=O)c2ccc(S(=O)(=O)N3CCCCC3)cc2)n1	794600989	MGQWRRGCEKWFDA-UHFFFAOYSA-N	438.531	1.188	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C[C@H]1COCCN1C(=O)OC(C)(C)C	794787447	ILTAFUSWEASIFX-ZFWWWQNUSA-N	425.457	1.766	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)[C@H](C#N)Cc2ccc(C#N)cc2)cc1OC	795825093	NCHZKLPAYWRFBW-KRWDZBQOSA-N	436.424	1.262	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)cc1OC	796989583	HZWGEMDDXIHPRM-LLVKDONJSA-N	433.392	1.174	50	20	IDGD	
O=C(NNc1ccc(F)cc1F)C(=O)Nc1cc(S(=O)(=O)N2CCCC2)ccn1	797044605	GSIBAKLQHQJURR-UHFFFAOYSA-N	425.417	1.226	50	20	IDGD	
C[C@H](C(=O)NNC(=O)NCC(F)(F)F)N1C(=O)c2ccc(Br)cc2C1=O	798315688	ZOPXLUPAFNHAQH-ZCFIWIBFSA-N	437.172	1.326	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCCN2CCN(C)C(C)(C)C2)cc1Br	799371769	HANBVJGNBSEWHJ-UHFFFAOYSA-N	442.358	1.428	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)NCCS(=O)(=O)CCc1ccccc1	799856647	IXRXMIPBIQVPNC-UHFFFAOYSA-N	429.502	1.244	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CN(C)C(=O)c2ccc(Br)o2)cc1	801109465	OREFTPYCCAXHAF-UHFFFAOYSA-N	437.250	1.209	50	20	IDGD	
COc1cccc(-c2noc(SCC(=O)NNC(=O)C(=O)Nc3ccc(C)cc3)n2)c1	801110210	SATOUIXOYQTTNP-UHFFFAOYSA-N	441.469	1.932	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)Nc1cc(F)c(N2CCOCC2)cc1F	806739301	DQZGUCFBXDMPMQ-SFHVURJKSA-N	434.399	1.794	50	20	IDGD	
CC1(C)CC(=O)c2cc(NC(=O)C(=O)NNC(=O)c3ccc4c(c3)OCO4)ccc2O1	806973100	ZMHCVNXQJWRANR-UHFFFAOYSA-N	425.397	1.559	50	20	IDGD	
COCc1cnc(NC(=O)C(=O)NNC(=O)c2ccc(OC)c(Br)c2)s1	806979634	CYTKURAVRNFDKY-UHFFFAOYSA-N	443.279	1.460	50	20	IDGD	
COc1cc(C(=O)NNC(=O)N[C@@H]2CCC[C@@H]3CN(C(C)=O)C[C@@H]32)cc(OC)c1OC	808185630	BMIGYRQMIBIMBT-VNQPRFMTSA-N	434.493	1.303	50	20	IDGD	
C#CC[C@@]1(C(=O)OCC(=O)NNC(=O)c2cccs2)CCCN1C(=O)OC(C)(C)C	808597131	HQYCFHFRRHXKNI-FQEVSTJZSA-N	435.502	1.845	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)C(=O)Nc2ccc3c(c2)C(=O)OC3)c1	808934347	AXPBWRMZPLAYBO-UHFFFAOYSA-N	425.441	1.954	50	20	IDGD	
CC(C)(C(=O)NNC(=O)C(=O)Nc1ccc(C(N)=O)cc1OCC(F)F)c1ccccc1	810387025	BZTQCSWOKALNOT-UHFFFAOYSA-N	448.426	1.493	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)c(C2CC2)n1	811880198	JUDRGBQNSSYXHF-UHFFFAOYSA-N	431.518	1.547	50	20	IDGD	
CN(C)S(=O)(=O)CCNC(=O)NNc1ccc(Br)cc1C(F)(F)F	812693576	DACLPOYCQJGNDC-UHFFFAOYSA-N	433.250	1.985	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)C2(S(C)(=O)=O)CCOCC2)cc1OC	814102015	ALBMKEYCDVFDPG-UHFFFAOYSA-N	428.507	1.229	50	20	IDGD	
CC(C)C(=O)Nc1cc(C(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)ccn1	816088005	UBWFPHSJPCWTSG-UHFFFAOYSA-N	448.524	1.925	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(Br)c(C(=O)NNc2cnnn2C)c1	816769377	FREXSRNEKCFARV-UHFFFAOYSA-N	431.316	1.365	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)c2nc(S(C)(=O)=O)ncc2C)cc1OC	816827948	LRPLODBVRWGDMH-UHFFFAOYSA-N	436.490	1.451	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)[C@@H](CCS(C)(=O)=O)NC(=O)c2ccccc2Cl)n1	837302473	SHCSABUFFBVFBS-OAHLLOKOSA-N	439.925	1.423	50	20	IDGD	
Cc1ccc2nc(COc3cccc(C(=O)NNC(=O)[C@@H]4CCS(=O)(=O)C4)c3)cn2c1	841342218	JDVQIPGJYHCHAF-MRXNPFEDSA-N	442.497	1.417	50	20	IDGD	
O=C(CCSc1ccc(F)cc1)NNC(=O)CNS(=O)(=O)c1cccc(F)c1	913035305	UGDXMRWSHYEAKW-UHFFFAOYSA-N	429.470	1.573	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)c1ccc(S(=O)(=O)NCC(C)C)cc1	914832401	ZMSFNPGYCWDZFU-UHFFFAOYSA-N	434.518	1.503	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)NCC(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)cc1	915788121	UUQCQVSKMQZNLN-MRXNPFEDSA-N	447.513	1.399	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)NCc2nnc3n2CCC3)cc(OCC)c1OCC	916235130	BSLOKQBUICEUSP-UHFFFAOYSA-N	432.481	1.565	50	20	IDGD	
CC(=NNC(=O)Cc1nc2ccccc2n1C)c1ccc(S(=O)(=O)NCC(=O)O)cc1	916313543	SCBXILULNXQCCY-UHFFFAOYSA-N	443.485	1.019	50	20	IDGD	
CC(=NNC(=O)[C@H](C)CN1CCCCCC1)c1ccc(S(=O)(=O)NCC(=O)O)cc1	916366657	KJQOUJPXHWRGDA-OAHLLOKOSA-N	438.550	1.402	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)NCc2cccc(NC(=O)COC)c2)cc1OC	916383225	OPERPOXREKDQGR-UHFFFAOYSA-N	430.461	1.823	50	20	IDGD	
CNC(=O)c1ccc(CNC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1	916392233	RKWUNSFQDAJVMI-UHFFFAOYSA-N	438.532	1.089	50	20	IDGD	
O=C(COC(=O)c1cc(-c2cccs2)[nH]n1)NNC(=O)[C@H]1COc2ccccc2O1	917257889	VFLJTTOCEPTBHZ-OAHLLOKOSA-N	428.426	1.282	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NCCC(=O)N[C@H](C)CC)c2ccccc2c1=O	918085301	QVULWBIQFIWIRQ-CQSZACIVSA-N	430.509	1.445	50	20	IDGD	
CCS(=O)(=O)N1CCC[C@@H](C(=O)NNC(=O)[C@@H](C)Oc2c(C)cc(Cl)cc2C)C1	918551146	NYTOPMIDROYYOW-HUUCEWRRSA-N	445.969	1.933	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)[C@@H]1CCCCN1C(=O)C(C)C	919601823	WQHLUMMFTYUMMT-HNNXBMFYSA-N	439.896	1.690	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)N(C)CC(=O)N[C@@H]2CCS(=O)(=O)C2)c(C)n1CC(C)C	919747025	XJIORFAEZVYEGU-PMEBHBLGSA-N	434.562	1.430	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)N2CCC[C@H](CS(C)(=O)=O)C2)N(C)c2ccccc21	919843893	OMEBQYVVZXFWCD-INIZCTEOSA-N	444.557	1.940	50	20	IDGD	
CCCCCCOc1ccc(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)cc1OC	919885549	LNMNFQYDACZDQE-OAHLLOKOSA-N	427.523	1.785	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCc1ccccc1-n1ccnc1	919920813	VNJTZXKDWGOSQR-UHFFFAOYSA-N	441.517	1.618	50	20	IDGD	
Cc1cccc2c1OCCC2=NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	920357037	ADWMTHSPZBBPJM-UHFFFAOYSA-N	429.498	1.933	50	20	IDGD	
C[C@@H](OC[C@H]1CCCO1)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	921018703	ANYZIMKJHFUDEM-NVXWUHKLSA-N	439.534	1.206	50	20	IDGD	
C[C@H](C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1)c1ccc(F)c(F)c1	1319200237	DQPYLXXPFLVFOB-HNNXBMFYSA-N	430.455	1.674	50	20	IDGD	
O=C1Cc2cc(S(=O)(=O)NNC(=O)c3cncn3-c3ccccc3)c(Cl)cc2N1	1322413486	IIPKJNMRRBXBRP-UHFFFAOYSA-N	431.861	1.644	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NNc2cncc(Br)c2)n(C)c1	1335934823	PEBFNEAUNPBLAX-UHFFFAOYSA-N	430.328	1.970	50	20	IDGD	
Cc1nnsc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Br)C2	1778238971	PNVYQGLTRQOWPN-IFUGULHKSA-N	435.319	1.665	50	20	IDGD	
O=C(c1ccc2ncncc2c1)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1778603755	FXMVXTDMZWDEBV-MAUKXSAKSA-N	437.269	1.764	50	20	IDGD	
C=CC[C@H](C(=C)C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2	1779270281	ATOOFVPNUDUHGY-PQNGQFLHSA-N	440.349	1.262	50	20	IDGD	
CC(C)n1nccc1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](C)CBr)CCO2	1779599797	IGVKREZEHAIRSP-RDTXWAMCSA-N	427.343	1.939	50	20	IDGD	
CN1CCCC[C@H]1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Br)C2	1780593402	QWHILTAHSBDXRH-JTOWHCCKSA-N	434.350	1.675	50	20	IDGD	
COc1cc(OC)cc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)c1	1780662328	VWEGRDLWNMLOQK-YJYMSZOUSA-N	441.322	1.931	50	20	IDGD	
COc1cc(OC)cc(C(=O)N2CC[C@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)c1	1780662582	YJNYEYPLPKYGNE-NRFANRHFSA-N	436.581	1.999	50	20	IDGD	
CC(C)c1nc(CC(=O)N2CCO[C@@]3(CCN(C(=O)[C@](C)(Cl)CCl)C3)C2)no1	1781225043	SNZZTQHDAGTBHH-MSOLQXFVSA-N	433.336	1.802	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc4c(c3)CC(=O)N4)CCO2)C1	1781230544	VBRQEVMOVSYDRQ-WOJBJXKFSA-N	440.327	1.861	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)[C@H]3CC[C@H]4CCC(=O)N4C3)CCO2)C1	1781231066	GBUXOOMTVBSODF-SLUIBLPYSA-N	446.375	1.454	50	20	IDGD	
O=C(c1ccn2nccc2c1)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781331505	LSQNWWNHIVBBHA-YOEHRIQHSA-N	425.258	1.468	50	20	IDGD	
O=C(CNc1ccc(F)cc1)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781331818	XWIFIWUBLREBDU-NVXWUHKLSA-N	432.265	1.758	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)CC3CCC(C)(C)CC3)C2)C1	1781408579	NZHPJPSHHFSLDD-HSZRJFAPSA-N	436.597	1.796	50	20	IDGD	
O=C(COc1ccccc1F)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2	1781905214	LXZAJETUMSLLTP-WRWLIDTKSA-N	428.888	1.318	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H]1CCc3nc[nH]c3C1)C2	1782179258	WDMTZWFLCDMKIR-QKSJRXBFSA-N	438.956	1.282	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cccc4ccnn34)CCO2)C1	1783352981	LOXJLDFNXPCRNV-KXBFYZLASA-N	435.322	1.951	50	20	IDGD	
COc1cncc(CCC(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](C)Br)C3)C2)c1	1783529973	PZNCSHUZMOQJOV-KUHUBIRLSA-N	440.338	1.636	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)COc3ccccc3F)CCO2)C1	1783538203	AIYKRBYINMEPFA-FZKQIMNGSA-N	429.286	1.818	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3nccc(Cl)c3OC)CCO2)C1	1783881248	JYUJEDLKIMUEJN-ACJLOTCBSA-N	432.304	1.441	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cccc3c1CCCC3)CCO2	1783937367	HEQHOSVXQOKWAY-DEOSSOPVSA-N	442.560	1.382	50	20	IDGD	
COC(=O)[C@@H]1CC[C@@H](C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CO[Si](C)(C)C)C[C@@H]32)C1	1784081635	WUIJEFZQCMDENW-ZBRFXRBCSA-N	440.613	1.407	50	20	IDGD	
CN1Cc2ccccc2C[C@@H]1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21	1785024406	KIYQMSIQYXOMOU-FJIDUMEYSA-N	440.371	1.827	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ncc(Cl)cn3)[C@H]2C1	1785821932	XUFCUUPUGZGYDT-DEQVHRJGSA-N	445.745	1.897	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc(O)cn3)C[C@@H]21	1786407645	DSIFHQHOTYXCPF-RCBQFDQVSA-N	426.311	1.094	50	20	IDGD	
COc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCBr)C[C@@H]32)nc1	1787759156	QITULYIZLIKEDQ-NOLJZWGESA-N	426.311	1.469	50	20	IDGD	
CCCC(=O)N[C@@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)Br)C[C@@H]21	1788743586	DNMGDDSBUYKOPI-QTVXIADOSA-N	432.359	1.054	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)c1ccnc(Cl)n1	1788874090	NYNQTAFBRNEAHB-GVXVVHGQSA-N	431.718	1.508	50	20	IDGD	
Cc1n[nH]c(C)c1CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21	1789976868	OIPIYRIIDMNGIU-ATVPRXPUSA-N	431.306	1.239	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(O)ccc3F)[C@H]2C1	1790054355	CMPOXFSZZCPITL-AZLWOZFGSA-N	429.286	1.908	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc4ccc(F)cn34)[C@H]2C1	1790474389	HJKDMILJPVGOSJ-FAYQHZLMSA-N	438.887	1.321	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)Nc1ccc(C2(NC(=O)CN3C(=O)CNC3=O)CCC2)cc1	1790489478	TZOBVSXAJSNEFL-GOSISDBHSA-N	441.315	1.909	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3cnn(C)c3)C[C@@H]21	1790961961	SJPZCWWLOVJRSS-NXOAAHMSSA-N	441.370	1.506	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)C3(O)CCC3)C[C@@H]21	1790962217	QUOJRSATYMLJCM-QXKUPLGCSA-N	431.371	1.691	50	20	IDGD	
CC(=O)N/C(C)=C/C(=O)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1	1791024094	VEINAIMFDTTYGX-CCEZHUSRSA-N	435.289	1.154	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)Nc3ccccn3)C[C@@H]21	1791056144	OYYPLKJTKFCLOB-QXKUPLGCSA-N	439.354	1.645	50	20	IDGD	
COC(=O)[C@H]1CC=CC[C@@H]1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(C)(C)CCl)C[C@@H]21	1791230598	ZRIZGNXNUNNMNL-ATIWLJMLSA-N	440.968	1.987	50	20	IDGD	
CCn1nc(C(C)C)cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](Cl)COC)[C@H]2C1	1791254175	PENMUXBKHKCFKF-FPXQBCRKSA-N	440.972	1.874	50	20	IDGD	
COc1ccc2[nH]cc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]4C3)c2n1	1791296473	MFTLMNQPMXGHIZ-JKOKRWQUSA-N	441.315	1.969	50	20	IDGD	
Cc1noc(CC(=O)NC2(c3ccc(NC(=O)CCC(=O)NN(C)C)cc3)CCC2)n1	1791600045	PELXUEWGPWTRPZ-UHFFFAOYSA-N	428.493	1.428	50	20	IDGD	
C[C@H](CBr)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCN1CCN(C)CC1)C2	1792989530	MBWHSWGKVBHPFX-WCXIOVBPSA-N	429.403	1.293	50	20	IDGD	
CC[C@@H](CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCl)NC(=O)OC(C)(C)C	1793115270	GSJGHTGRPGPBCF-ARKGTOAJSA-N	431.961	1.918	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1sccc1F)C2	1796439631	TVHMRLYIHFPUAE-NNGSTNBRSA-N	447.492	1.224	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1Cc3ccccc3O1)C2)[C@@H](F)Br	1799348821	BOGMTESWINDEAT-PTNZTPPNSA-N	427.270	1.270	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CC[C@H]2CCC(=O)N2C1	1799933293	QBIYQPXXDRJAGB-OHQCYIMMSA-N	426.355	1.809	50	20	IDGD	
COC[C@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc3c(c1)n(C)c(=O)n3C)C2	1802274370	WQSZMSQSGFOLKD-FZKCQIBNSA-N	434.924	1.383	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]2c2cccnc2)n1	1803140937	JMLVZSQOLNIZTM-SZVBFZGTSA-N	445.907	1.354	50	20	IDGD	
Cn1cc(C(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)c2cccnc21	1803143267	XYRNSFWEJRGMBF-MNEFBYGVSA-N	441.919	1.888	50	20	IDGD	
CCOc1cnc(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)cn1	1804912510	NZNUUMOQGQNDFB-ZVZYQTTQSA-N	433.896	1.190	50	20	IDGD	
Cc1ccsc1C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1805395755	DXUNNQYFFGRCGB-AZUAARDMSA-N	449.341	1.765	50	20	IDGD	
COCCOCC(=O)NC[C@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1	1806757872	VYXWCLWYDNAODL-QAPCUYQASA-N	428.327	1.535	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC2(CCCN(C(=O)c3ccnn3C)C2)CC1	1808420434	AEJOENRTXVWXIU-PCLIKHOPSA-N	439.520	1.399	50	20	IDGD	
Cn1ccc(CC(=O)N2CC[C@H](CNC(=O)[C@@H](F)Br)[C@@H]2c2cccnc2)n1	1808661248	HMIKUPPYTUCDKG-XOKHGSTOSA-N	438.301	1.754	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2nc3ncccn3n2)[C@H]1c1cccnc1	1809236478	JKKHAYWPCWGLCQ-OWCLPIDISA-N	443.895	1.093	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)c1cnc2[nH]ncc2c1	1809707864	RVDHLDGFODCTRR-JQFCIGGWSA-N	428.880	1.272	50	20	IDGD	
CNCCCC(=O)N1CCCC2(CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CC2)C1	1809767479	NRDAABNAQSRBQP-KOEQRZSOSA-N	430.553	1.351	50	20	IDGD	
O=C(CCCc1cccnc1)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1	1809972569	KMSWAPBJYFASLF-UHFFFAOYSA-N	449.360	1.629	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)c1ccc2nn[nH]c2c1	1812296633	DGIZWKJCIACFIM-JCGIZDLHSA-N	428.880	1.272	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)CCS(C)(=O)=O)[C@H]1c1cccnc1	1812868193	UFYGDWGALLAJEP-BJJXKVORSA-N	446.367	1.306	50	20	IDGD	
Cc1cnc(C(=O)N2CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)s1	1813070583	JYRXBRVQQRASIF-APWZRJJASA-N	444.561	1.539	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@H]1CCc2nc(NC(=O)CS(C)(=O)=O)sc2C1	1814325495	QQEUBICSJKTMRY-RMLUDKJBSA-N	428.363	1.336	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)CC3CCOCC3)sc2C1	1814617015	ZKLYSJBFRIQQQR-CQSZACIVSA-N	437.566	1.245	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)/C=C/c2cccnc2)[nH]n1)c1ccc(B(O)O)cc1	1817470422	AZUOFCNLSVRJTB-OJWOGGGRSA-N	445.288	1.504	50	20	IDGD	
Cc1n[nH]c(C)c1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1	1817476596	LRHMRANJYGFOOA-QGZVFWFLSA-N	436.281	1.049	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CO)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](F)Cl)[nH]n1	1817974886	RAWRNPJAEMABAT-OUCADQQQSA-N	447.895	1.822	50	20	IDGD	
CC(=O)C[C@@H](C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819404217	DTKUNNWPVUTIOG-SJKOYZFVSA-N	441.492	1.329	50	20	IDGD	
Cc1ccn(C)c1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(B(O)O)cc1)CC2	1821727780	PITCCUWOPGQAOP-HNNXBMFYSA-N	438.318	1.009	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](C)N2CCN(C)CC2)[nH]n1	1822374636	YLGZGVCMSNDDGA-UXLLHSPISA-N	440.976	1.292	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CNC(=O)C(F)(F)F)[nH]n1	1822375046	RTYYGCGRYSRGNM-ONGXEEELSA-N	439.822	1.334	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)C3(N4CCN(C)CC4)CC3)sc2C1	1822719925	ZNEUVRXPOBKXFJ-UONOGXRCSA-N	440.013	1.853	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCS(C)(=O)=O)CC2	1822870085	RUFIDSARVSXKAH-PSLIRLAXSA-N	442.390	1.726	50	20	IDGD	
Cc1nnc(CC(=O)N[C@H]2CCc3nc(NC(=O)[C@@H](F)Br)sc3C2)o1	1823002178	AOLBKWHUBFIFNU-JVXZTZIISA-N	432.275	1.680	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@H]1CCc2nc(NC(=O)Cn3nccn3)sc2C1	1823109660	MNUIPCAPCYFLPW-ZJUUUORDSA-N	427.328	1.378	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccno2)CC1	1825917326	VCOQBTSVZLGJCD-QGZVFWFLSA-N	426.477	1.220	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)C13CC(C(=O)OC)(C1)C3)CC2	1826005053	ZHPCEJIBUFHWHM-NCBVISDVSA-N	441.937	1.652	50	20	IDGD	
O=C(Cc1cccs1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827052832	IUGXHGHRFPOOIR-NRFANRHFSA-N	440.374	1.904	50	20	IDGD	
CCC1(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)COC1	1827053399	MLTGQGHDDPNTBL-HXUWFJFHSA-N	428.338	1.026	50	20	IDGD	
O=C([C@@H]1CCCSC1)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827059390	AAVJETXDNIPUAD-TZIWHRDSSA-N	444.406	1.743	50	20	IDGD	
N#CCC(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)[C@H](F)Cl)C2)C1	1828807460	BHIUPXOZIICKKU-PXNSSMCTSA-N	436.871	1.887	50	20	IDGD	
COc1ncc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)cc1F	1830358729	RFGUWCSTXDJPKC-HXUWFJFHSA-N	443.903	1.564	50	20	IDGD	
Cc1nscc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2	1830534961	FYXGMKVOXZQEII-SJCJKPOMSA-N	446.367	1.553	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CSc2nc[nH]n2)CC1	1831838060	YOMPYYSCBVNOLB-CABCVRRESA-N	429.974	1.770	50	20	IDGD	
COc1cnc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)cn1	1831871389	CJUJLOBDCDJIBS-SFHVURJKSA-N	446.552	1.092	50	20	IDGD	
CCc1nc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)co1	1831873764	WPIBCYJXRNODFQ-SFHVURJKSA-N	433.553	1.843	50	20	IDGD	
O=C(Cc1cc(F)ccc1Cl)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1	1832264592	IPGKJRWDBKKEQD-LPHOPBHVSA-N	449.306	1.078	50	20	IDGD	
Cc1ccc(CCC(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)s1	1832882291	LNKFWBVAZLJABF-VQIMIIECSA-N	430.954	1.045	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H]3CNc4ccccc43)CC2)CC1)[C@@H](O)CCl	1833308858	AZXYLOQTRPOMDH-ICSRJNTNSA-N	434.968	1.367	50	20	IDGD	
Nc1ccccc1/C=C/C(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)CCl)CC2)CC1	1833309415	UCMULZMVCZNQAB-XJDXJNMNSA-N	434.968	1.453	50	20	IDGD	
CC(C)c1cc(C(=O)N2CCC(N3CCC(NC(=O)[C@H](O)CCl)CC3)CC2)n[nH]1	1833312704	XYBDLQSRZUYCIO-GOSISDBHSA-N	425.961	1.318	50	20	IDGD	
Cc1ncc(C(=O)NC2CCN(C3CCN(C(=O)[C@H](F)Br)CC3)CC2)[nH]1	1833580173	TWWQAZOMSBRZQK-HNNXBMFYSA-N	430.322	1.594	50	20	IDGD	
Cc1nscc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1833747025	IEJWJDCTKSLNKL-SWLSCSKDSA-N	436.303	1.212	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(F)cn3)CCO2)C1	1834480908	VCZPBNUFMCAPAM-PXAZEXFGSA-N	430.274	1.074	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCC(N2CCC(NC(=O)[C@@H]3CCC(=O)N3)CC2)CC1	1834526797	GDYYGEJFWWFFGV-HNAYVOBHSA-N	433.380	1.073	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1)C1CCOCC1	1834546140	BTBFGIMVOVMJJV-MRXNPFEDSA-N	434.350	1.675	50	20	IDGD	
O=C(CC[C@@H]1CCOC1)N1CCOC[C@@]2(C1)CN(C(=O)CCBr)CCO2	1834826860	ZFONXPCOEYWZLS-CRAIPNDOSA-N	433.343	1.045	50	20	IDGD	
Cc1nccnc1C(=O)NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1836013381	HBNRWRKLZJKUNG-MRXNPFEDSA-N	442.333	1.661	50	20	IDGD	
COCCOCC(=O)N1CCC(N2CCC(NC(=O)[C@](C)(Cl)CCl)CC2)CC1	1836398574	NITXBBGOGCJEIK-LJQANCHMSA-N	438.396	1.457	50	20	IDGD	
Cc1ccccc1OCC(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836716849	UUKKGPHWFKWNQL-LJQANCHMSA-N	438.952	1.972	50	20	IDGD	
CC(C)c1cc(C(=O)N2CCC(OC3CCN(C(=O)[C@H](O)CCl)CC3)CC2)n[nH]1	1836718669	YWGFHVCPZKPOQG-GOSISDBHSA-N	426.945	1.745	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccnn3C(C)C)CCO2)C1	1838019042	VRCRCBGZZQDBAK-OXQOHEQNSA-N	426.945	1.942	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccn(C(F)F)n1)CCO2	1838037004	MWNHCYLMAPYZJI-SFHVURJKSA-N	446.527	1.200	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3c(F)cncc3F)CCO2)C1	1838161263	GVTBVUQERDUURY-YJYMSZOUSA-N	431.867	1.837	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](C)Cn3cncn3)CC2)CC1	1838421348	OACOXGNHTNBTOL-MAUKXSAKSA-N	441.960	1.167	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC(OC2CCN(C(=O)[C@@H]3CCNC(=O)C3)CC2)CC1	1838432114	VDDYUKHTJSAQST-MRXNPFEDSA-N	439.629	1.363	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cc4cccnn4n3)CC2)CC1	1838520461	WXMFCNKKJZWTJF-SFHVURJKSA-N	449.939	1.595	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cn(C(C)(C)C)nn3)CCO2)C1	1838756222	ZHKNWCVZTGMQRD-FOIQADDNSA-N	441.960	1.511	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(F)cc(F)c1)CCO2	1839002121	TTXGMOACCWVIOZ-HXUWFJFHSA-N	442.535	1.886	50	20	IDGD	
CSCC(C)(C)C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](F)Br)CCO2)C1	1839198549	HWAOUORUDKDGDH-LRDDRELGSA-N	441.363	1.523	50	20	IDGD	
COc1c(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)ccc(F)c1F	1839381708	IIDSSWQVHBFVIF-YJBOKZPZSA-N	436.814	1.578	50	20	IDGD	
O=C(c1cnc2ccc(F)cn12)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1839592671	UKJCXNVKZXHNNO-SFHVURJKSA-N	445.278	1.347	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(CC#N)cc3)C2)C1	1840154876	IMVUIPXRAMIVHE-NQIIRXRSSA-N	435.908	1.076	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(F)c(OC)c3)C2)C1	1840155770	DFRCOQLIPIQETP-FOIQADDNSA-N	444.887	1.158	50	20	IDGD	
O=C(C(Cl)Cl)N1CCO[C@]2(COCCN(C(=O)C3(c4ccccc4)CC3)C2)C1	1840187410	YMSNOLSOOZQQNA-LJQANCHMSA-N	427.328	1.978	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)n1cccc1)CCO2	1840354036	AYFHTJPAPWNABE-BXWFABGCSA-N	442.354	1.679	50	20	IDGD	
O=C(CCc1nc(-c2ccc(F)cc2)no1)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1	1841350051	FISYTSHNAZFLJK-HNNXBMFYSA-N	436.871	1.611	50	20	IDGD	
CCC(=O)N[C@@H](C)C(=O)N1CCCC12CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2	1841534366	MLYAAYNVPSQTMS-ZDUSSCGKSA-N	446.460	1.252	50	20	IDGD	
Cc1ccn2c(=O)c(C(=O)N3CC4(CCCN4C(=O)CCBr)C3)cnc2c1	1842638409	YNPVJWGREPDRLB-UHFFFAOYSA-N	433.306	1.605	50	20	IDGD	
O=C(c1ccc2occ(Cl)c2c1)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843011691	GYXOULAXXUTZSH-UHFFFAOYSA-N	438.676	1.897	50	20	IDGD	
O=C([C@H]1CCc2cccc(Cl)c21)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843014972	VRXOJPKDBWVJBU-SFHVURJKSA-N	438.720	1.567	50	20	IDGD	
Cn1ccc(CC(=O)N2CCCC23CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C3)n1	1843055413	RMZBBBDQFLATCB-HNNXBMFYSA-N	439.944	1.298	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)c1nccnc1C)C2	1844692801	LXDJIZVESYIAKZ-UHFFFAOYSA-N	439.428	1.749	50	20	IDGD	
COc1ccc(C(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)cc1Cl	1846844713	CBXBPKWJXWLFNW-UHFFFAOYSA-N	443.891	1.478	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC2(CCCN2C(=O)c2ccc(S(C)(=O)=O)c(F)c2)C1	1846893079	AQVDCASPOQFVOR-UHFFFAOYSA-N	442.585	1.898	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1ccc(Cl)nc1	1847175631	YZOROHNJJZIYDM-GAVIZYNASA-N	428.880	1.684	50	20	IDGD	
O=C(COC(=O)CCc1ccc2c(c1)OCCO2)NNC(=O)c1ccc([N+](=O)[O-])cc1	12947882	UUFXFTQHQXBPKU-UHFFFAOYSA-N	429.385	1.303	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)CCn2c(=O)oc3cc(Cl)ccc32)c2ccccc2c1=O	14888121	GCABTIOZGFCASM-UHFFFAOYSA-N	441.831	1.346	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C2CCN(S(=O)(=O)CC)CC2)cc1	18071638	QWHQZSPXXGGDAK-CQSZACIVSA-N	427.523	1.062	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)c1sccc1NC(=O)c1ccncc1	725739240	ASMRKBCDQGBULG-UHFFFAOYSA-N	429.483	1.648	50	20	IDGD	
Cc1noc([C@@H](C)NC(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)n1	726279054	MQEQOVLKYCCYPC-CYBMUJFWSA-N	447.459	1.785	50	20	IDGD	
Cc1noc(C)c1S(=O)(=O)N1CCC[C@H](C(=O)NNc2nc(-c3cccnc3)no2)C1	728076010	TTXJLYFMXNNALI-AWEZNQCLSA-N	447.477	1.280	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)[C@H](C)NC(=O)c2n[nH]c3ccccc23)o1	728209278	JRYWOFOBHCTFBW-ZDUSSCGKSA-N	426.477	1.577	50	20	IDGD	
CCC[C@H](NC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1)c1ccccn1	729612617	GENRCGAYPOOTLB-SFHVURJKSA-N	433.534	1.882	50	20	IDGD	
Cc1cc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)CCc3ccccc3O)c2)no1	730034165	XOVUSLGCGXTPRA-UHFFFAOYSA-N	444.469	1.883	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)N[C@H]1CCN(c2ccc(F)cc2F)C1	730136347	HELQEEZXMZNYJW-LBPRGKRZSA-N	428.399	1.837	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)[C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)c1	731958281	QPLWHBOPTXWPIC-CQSZACIVSA-N	448.457	1.739	50	20	IDGD	
CN(CC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1)C(=O)C1CC1	733124655	NGTKQRGKHSWIJF-UHFFFAOYSA-N	436.515	1.178	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1	734239567	FQFKIWVAEUPQDR-UHFFFAOYSA-N	429.518	1.489	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)N[C@H](C)CN1CCN(c2ccccn2)CC1	735517332	CEGWUSXSJINCDT-OAHLLOKOSA-N	446.939	1.898	50	20	IDGD	
O=C(NNC(=O)c1ccc(N2CCCS2(=O)=O)cc1Cl)c1ccc2c(c1)OCO2	736064969	ZSLXMZNWJREUQV-UHFFFAOYSA-N	437.861	1.683	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)[C@@H]2CC(=O)N(c3ccccc3)C2)cc1C	736777515	NVMILQJZCXSPGL-CQSZACIVSA-N	429.498	1.976	50	20	IDGD	
COc1cccc(C(=O)N2CCN(C(=O)NNC(=O)COCc3ccccc3)CC2)c1	738496665	SZZBXMBAIPCCNJ-UHFFFAOYSA-N	426.473	1.411	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)N2CCN(CCn3cncn3)CC2)N(C)c2ccccc21	740739208	ZQMWOAADVNRQSA-UHFFFAOYSA-N	448.531	1.093	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN(C(=O)COc2ccccc2)C1)c1cccc([N+](=O)[O-])c1	741169463	RIWOBKDYTFNCRJ-INIZCTEOSA-N	426.429	1.673	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(CC(=O)NNC(=O)c2ccc3ccccc3n2)C(=O)C1	741207101	QGCRHXNVMZTUHO-UHFFFAOYSA-N	427.461	1.075	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C[C@H](C)/N=C2/NS(=O)(=O)c3ccccc32)c1	742472010	MEQOMHNLXZUYEJ-HNNXBMFYSA-N	444.513	1.347	50	20	IDGD	
CCCCS(=O)(=O)N1CCC[C@H]1C(=O)NNC(=O)c1cccc(Br)c1	742771825	DAYVREJHNCBUQM-AWEZNQCLSA-N	432.340	1.804	50	20	IDGD	
COc1cc(OCC(=O)NNC(=O)c2cc(Br)ccc2O)ccc1[N+](=O)[O-]	743731388	QNPBUHDLHNEIOW-UHFFFAOYSA-N	440.206	1.912	50	20	IDGD	
O=C(NCC1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1cc([N+](=O)[O-])ccc1O	745834217	JUZXUFWTTQJCIW-UHFFFAOYSA-N	441.444	1.797	50	20	IDGD	
C[C@](O)(Cc1ccccc1)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	746093320	PIWTWHUKHHRVAE-NRFANRHFSA-N	431.514	1.226	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CN(Cc2nc(O)c3ccccc3n2)CCO1)c1ccc(Cl)nc1	746128544	IIERGBBVLUPSML-HNNXBMFYSA-N	442.863	1.046	50	20	IDGD	
C[C@H]1C[C@H](C)CN(C(=O)CN2CCN(C(=O)NNC(=O)CCOc3ccccc3)CC2)C1	747107913	DPWQXYLGNUECCH-OALUTQOASA-N	445.564	1.318	50	20	IDGD	
O=C(CCc1nc(-c2nc[nH]n2)no1)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1	748522773	GCZWCMYNVLOHQH-UHFFFAOYSA-N	431.356	1.224	50	20	IDGD	
Cn1nc(C(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)c2ccccc2c1=O	748523332	QDNZEYYQCSUQKE-UHFFFAOYSA-N	426.376	1.984	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)NCCc1ccc(I)s1	748626671	DXUYERYFEGMBOX-SECBINFHSA-N	441.291	1.277	50	20	IDGD	
COc1cc(OC)cc(N2CC[C@@H](NC(=O)NNC(=O)c3c(C)nc4ccccn34)C2)c1	748660928	HEERSHSFOSHDHR-OAHLLOKOSA-N	438.488	1.883	50	20	IDGD	
NS(=O)(=O)c1ccc(OCC(=O)NNC(=O)c2ccc(F)cc2Br)cc1	749732630	HCLCQMQNGWBXPF-UHFFFAOYSA-N	446.254	1.076	50	20	IDGD	
COc1ccc(C(=O)NNc2nc(Br)cn3ccnc23)cc1N1CCNC1=O	750244156	XCSSAEVHRWZCLO-UHFFFAOYSA-N	446.265	1.787	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CN(C)CCC2CCN(C3CCN(C)CC3)CC2)c1	750833019	BUXFXEFRZYHROZ-UHFFFAOYSA-N	429.609	1.884	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](n2cc(C(=O)NNc3ccc(C(N)=O)nn3)cn2)C1	753424827	MEBXJVHKIOKDMT-CYBMUJFWSA-N	430.469	1.101	50	20	IDGD	
O=C(NNc1ccc(C(F)(F)F)nn1)[C@@H]1C[C@@H](O)CN1C(=O)OCc1ccccc1	755193150	AKJVYKURCMMGCH-OLZOCXBDSA-N	425.367	1.711	50	20	IDGD	
C#CCOCCC(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccc(C)cc2C)c1	755381654	PCTZKZNQIYBKFL-UHFFFAOYSA-N	429.498	1.905	50	20	IDGD	
COc1ccc(OC)c(NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1	755389746	PVSXYTTXKPOINE-UHFFFAOYSA-N	448.501	1.955	50	20	IDGD	
COc1ccc(-c2nn(CCC#N)cc2/C=C(\C#N)C(=O)N[C@@H]2CNC(=O)C2)cc1OC	755931509	FFPBGQAARHUVOC-BXUGYJKXSA-N	434.456	1.393	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c(Cl)cc1F	755952163	HSRAKDHHYSBIPG-UHFFFAOYSA-N	431.785	1.797	50	20	IDGD	
CC[C@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(CC)CC)c1)[C@H]1CCCO1	756730511	UJUOTQYTAHCAJW-DLBZAZTESA-N	426.539	1.619	50	20	IDGD	
CCOc1cc(C)ccc1CNC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1	757259179	MOTPZNFSASFMNE-UHFFFAOYSA-N	448.545	1.853	50	20	IDGD	
NS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2cc(F)ccc2Br)cc1	757673575	IBISCZIREDLSPG-UHFFFAOYSA-N	431.243	1.702	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)Nc1cnn(-c2ccccc2Br)c1	757774780	AKQPTGOZGVVTRL-SNVBAGLBSA-N	442.295	1.222	50	20	IDGD	
CCCc1cc(NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)n(C)n1	757891714	NSUWEKOCBQOCFF-UHFFFAOYSA-N	434.522	1.624	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NN=Cc1ccc(OCCN2CCOCC2)c(Cl)c1	759196368	KPYKXJVPKNCKOC-UHFFFAOYSA-N	434.880	1.524	50	20	IDGD	
CC(C)CNS(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2ccc(C#N)cc2)cc1	759666950	ZBGQXFZJCQAPGO-UHFFFAOYSA-N	429.502	1.637	50	20	IDGD	
CCOc1ccc(C(=O)NNS(=O)(=O)c2ccc(S(C)(=O)=O)c(F)c2)cc1OC	760334053	GBGLHQZCTSCGGV-UHFFFAOYSA-N	446.478	1.260	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCCC(=O)NNc1cc(Cl)nc(N)n1	761170873	ZKLZPXTWPKVSMO-JTQLQIEISA-N	427.893	1.061	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@H](C)c2cccc([N+](=O)[O-])c2)cc1	761398085	AFEDRCYJVYGNPZ-CQSZACIVSA-N	434.474	1.475	50	20	IDGD	
O=C(O)c1cc(Br)cc(S(=O)(=O)NNC(=O)c2ccc3c(c2)OCO3)c1	762463872	YOVQJWLVJOGIEX-UHFFFAOYSA-N	443.231	1.499	50	20	IDGD	
Cc1cc(-c2noc(CCC(=O)NNc3nccc(N4CCOCC4)n3)n2)ccc1F	762851106	ASVODIUGRVOTQD-UHFFFAOYSA-N	427.440	1.887	50	20	IDGD	
CN1CC[C@H](CNC(=O)NNC(=O)C(=O)Nc2ccccn2)[C@H]1c1ccc(Cl)c(F)c1	763093307	VIYRHBVIQNSAGT-CXAGYDPISA-N	448.886	1.836	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)c3cc(C)c4c(O)nc(O)nc4n3)n[nH]2)cc1C	763176298	FJWIQOCJWHKIJP-UHFFFAOYSA-N	433.428	1.826	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)N[C@@H]1CC(=O)N([C@@H]2C[C@@H]2c2ccccc2)C1	763527156	ZSMLQAGZENZJCG-BRWVUGGUSA-N	440.525	1.972	50	20	IDGD	
CC[C@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(OC)c(OC)c2)cc1	763549883	AZGHTOMYLGTIOX-ZDUSSCGKSA-N	442.472	1.632	50	20	IDGD	
COCCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(C)oc2C)cc1Cl	763583290	KJGAHFJKLSDBQB-UHFFFAOYSA-N	436.852	1.326	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(Cc3ccncc3)cc2)cc1	763674042	KFYHCEHWOIPZBE-UHFFFAOYSA-N	429.436	1.709	50	20	IDGD	
COC(=O)CCc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)cc1	763694970	MRRVWUARSXDKPM-UHFFFAOYSA-N	433.848	1.611	50	20	IDGD	
CC(=O)Nc1ccc(Cl)c(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)c1	763848651	FHQHFZTWXFLOBK-SNVBAGLBSA-N	436.827	1.991	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)N(C)CCO3)cc1	763862528	XWHZHIQZZXYDJP-CQSZACIVSA-N	442.472	1.467	50	20	IDGD	
CCn1nnnc1-c1cccc(NC(=O)C(=O)NNC(=O)CSc2ccc(C)cc2)c1	763898423	UPSLRRMHUKASEZ-UHFFFAOYSA-N	439.501	1.547	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccn(CC(F)(F)F)n2)cc1OC	763910354	FUMJHPKQIDYLJU-UHFFFAOYSA-N	443.382	1.643	50	20	IDGD	
Cc1noc(COc2ccc(NC(=O)C(=O)NNC(=O)Cc3ccc(Cl)cc3)cc2)n1	763931967	MQZRNIVNZFNDRE-UHFFFAOYSA-N	443.847	1.939	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)C(=O)Nc1cccc(C(=O)N2CCSCC2)c1C	763957465	DQPQENLXWIPXSV-UHFFFAOYSA-N	440.525	1.892	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)C2=S=C3CCCCCC3=C2)ccc1C(=O)N(C)C	763961527	GZMZQMDTDMGEGH-UHFFFAOYSA-N	442.541	1.765	50	20	IDGD	
O=C(Cc1ccsc1)NNC(=O)C(=O)Nc1cccc(I)c1	764034809	KNVRJCLMPJRTAA-UHFFFAOYSA-N	429.239	1.681	50	20	IDGD	
O=C(NNC(=O)c1cccc(Br)c1)C(=O)Nc1c[nH]nc1-c1ccccn1	764063047	JRDZDWZQGCFTET-UHFFFAOYSA-N	429.234	1.634	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cccc(Cn4cncn4)c3)n[nH]2)cc1	764109942	DUBDWVUSHZJZAG-UHFFFAOYSA-N	444.455	1.425	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2O1)C(=O)Nc1ccc(OCc2ccncc2)cc1	764163526	KMWKYTNUZPRSQH-FQEVSTJZSA-N	432.436	1.750	50	20	IDGD	
COc1ccc(Cn2nccc2NC(=O)C(=O)NNC(=O)c2ccc(C#N)cc2)c(OC)c1	764177044	HOTOHOLCJHEKMY-UHFFFAOYSA-N	448.439	1.220	50	20	IDGD	
CN(Cc1cccc(NC(=O)C(=O)NNC(=O)CC2CCCC2)c1)C(=O)C(F)(F)F	764184391	QCEJDIKBNCHFHC-UHFFFAOYSA-N	428.411	1.874	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)C(=O)Nc1ccccc1Br	764266997	PQJUMDYLHOAQFG-UHFFFAOYSA-N	447.293	1.242	50	20	IDGD	
O=C(Cc1cc[nH]n1)NNC(=O)C(=O)Nc1ccnn1Cc1c(Cl)cccc1Cl	764292955	JDOOVVRPXRKGQN-UHFFFAOYSA-N	436.259	1.290	50	20	IDGD	
O=C(CO)NNC(=O)C(=O)Nc1ccc(NC(=O)c2ccccc2F)cc1C(F)(F)F	764421163	GKCGJZJTETZSRZ-UHFFFAOYSA-N	442.325	1.175	50	20	IDGD	
COc1nccnc1NNC(=O)c1cc(S(=O)(=O)NC2CC2)c(Cl)cc1Cl	764485179	UFVCENRYKMHFBP-UHFFFAOYSA-N	432.289	1.990	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)NNC(=O)NCc1ccc(N2CCCS2(=O)=O)cc1	764764528	AMHOCHWPADJEDF-UHFFFAOYSA-N	441.513	1.781	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)[C@H](C)NC(=O)c3ccoc3)n[nH]2)cc1OC	765595722	DCUOKOZGPGABMB-NSHDSACASA-N	427.417	1.266	50	20	IDGD	
CN1CCO[C@H]([C@@H](NC(=O)NNC(=O)COc2ccccc2O)c2ccc(Cl)cc2)C1	766320402	NUHGCXFEZWZJEV-ICSRJNTNSA-N	448.907	1.827	50	20	IDGD	
C[C@@H](Sc1ccccn1)C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	766656297	YVIQFPSPIJVXET-MRXNPFEDSA-N	427.530	1.168	50	20	IDGD	
O=Cc1ccc(OCC(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)cc1	766663197	JSXBFSLYRFINIH-UHFFFAOYSA-N	444.919	1.497	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)NC[C@@H]2CCCS2(=O)=O)c2ccccc2c1=O	767174249	HJYNPTHLNWBVST-AWEZNQCLSA-N	449.533	1.108	50	20	IDGD	
COCCN(CCNC(=O)NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)OC(C)(C)C	767303795	UWTKIKYFKUAMFU-INIZCTEOSA-N	438.481	1.040	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)c1ccc(F)c(NS(C)(=O)=O)c1	767323312	ZBNHBGCDDRPBOC-UHFFFAOYSA-N	437.449	1.053	50	20	IDGD	
CC(C)(C)CC(=O)NNC(=O)C(=O)Nc1ccccc1OCC(=O)Nc1cccnc1	768240123	SFUWCHOWBBBHCS-UHFFFAOYSA-N	427.461	1.621	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)c2c[nH]n3c2nc(=O)c2ccccc23)n[nH]1	768274456	TZDCNYFGLBQQKW-UHFFFAOYSA-N	443.423	1.649	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc2c(c1)nc(CCC(=O)NNc1nc3ccccc3[nH]1)n2C	768512391	JXZVXZQSAAZDGB-UHFFFAOYSA-N	441.517	1.776	50	20	IDGD	
COc1ccc2c(c1)[C@@H](NC(=O)NNc1ccc(S(=O)(=O)NC(C)C)cn1)CCO2	768529871	UWZVEBGOXIOLRA-INIZCTEOSA-N	435.506	1.927	50	20	IDGD	
CC(C)n1nc(C(=O)NNS(=O)(=O)c2cc(Cl)cnc2N)c2ccccc2c1=O	768846923	DIOXGUDTNDIRBD-UHFFFAOYSA-N	436.881	1.231	50	20	IDGD	
CSCCNC(=S)NNC(=O)c1ccc(Cl)c(S(=O)(=O)N2CCCC2)c1	769780728	XBRIQAJTKFDPMA-UHFFFAOYSA-N	437.012	1.596	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@@H]2C(=O)O[C@@H](C)C(=O)NNC(=O)CC(C)C)c(OC)c1	771989680	VJRUSJLZMBDLRV-WMLDXEAASA-N	449.504	1.434	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)[C@@H]1CCN(c2cccc(Cl)c2)C1=O	772897722	LJKQHCNFMOOLJX-INIZCTEOSA-N	449.294	1.810	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H]1CCCC1=NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	773207804	LSTZXESBYSTYCK-SFHVURJKSA-N	443.548	1.994	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)Nc1ccc(Br)cn1	773530349	VNSVOZMMSULPIP-UHFFFAOYSA-N	445.071	1.345	50	20	IDGD	
Cn1ccnc1[C@](O)(CCNC(=O)NNc1cccc(S(C)(=O)=O)c1)C(F)(F)F	776610119	RSWXJHHXUBTBQQ-OAHLLOKOSA-N	435.428	1.290	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NC[C@@H]2COC3(CCC(C)CC3)O2)c2ccccc2c1=O	777759664	HABOLPMMBWKGMS-HEOKHYPTSA-N	443.504	1.682	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)c2cc(O)cc([N+](=O)[O-])c2)cc1	780333832	LAYVMMLAYCREDX-UHFFFAOYSA-N	428.430	1.796	50	20	IDGD	
CCNC(=O)N(C)NC(=O)CS[C@H](C)C(=O)Nc1c(C)n(C)n(-c2ccccc2)c1=O	780710108	WIFCWKWPXVWZIK-CQSZACIVSA-N	448.549	1.237	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)c2cccc(NC(=O)c3cccnc3)c2)c1	782760504	CIUHYPFUSWBOPN-UHFFFAOYSA-N	443.419	1.824	50	20	IDGD	
COc1ccc(-c2nn(CCC#N)cc2/C=C(/C#N)C(=O)NCCn2ccnn2)cc1OC	782828825	YTANNUWUUBGPRE-ATVHPVEESA-N	446.471	1.796	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)C(=O)Nc1ccccc1OC(C)C	782897538	QLDZPOIJXVMPIM-UHFFFAOYSA-N	447.517	1.475	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2cnn([C@@H](C)C3CC3)c2)nc1	783258597	KWRMYMYYJNPXFT-LBPRGKRZSA-N	435.510	1.018	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNc2cncc(Cl)n2)c2ccccc12	783266638	WNVIVCPIIKSRDB-UHFFFAOYSA-N	429.820	1.917	50	20	IDGD	
CN(C)c1ccc(S(=O)(=O)N(C)C)cc1NC(=O)C(=O)NNc1ccc(F)cc1F	783347070	FURBEBVQSVTMIB-UHFFFAOYSA-N	441.460	1.363	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNc2nccc3sccc23)ccc1S(=O)(=O)N(C)C	783435303	BJNGEOFSOUAKER-UHFFFAOYSA-N	449.514	1.637	50	20	IDGD	
CC(C)NC(=O)c1ccc(Cl)c(NC(=O)C(=O)NNc2ccc(-n3cccn3)nn2)c1	783435995	GPBUHGFUTVSTHJ-UHFFFAOYSA-N	442.867	1.536	50	20	IDGD	
CC(=NNC(=O)[C@H](C)CN1CCOCC1)[C@@H]1CN(C(=O)OCc2ccccc2)CCO1	783809192	ZVHRKTBSFAFZRY-XLIONFOSSA-N	432.521	1.484	50	20	IDGD	
CC(C)(C)OC(=O)N[C@]1(C(=O)NNc2ncnc3[nH]cnc23)[C@H]2CCCO[C@@H]2C1(C)C	783899525	IYEDSWOLQBLBAS-LOOLNKMNSA-N	431.497	1.895	50	20	IDGD	
Cc1c(Cl)cc(F)c(NC(=O)C(=O)NNC(=O)CNC(=O)c2cccs2)c1F	784004320	WHFGUDHDKBSIKB-UHFFFAOYSA-N	430.820	1.504	50	20	IDGD	
O=C(NCC(=O)OCc1ccc(Cl)cc1)NNC(=O)C1CCN(c2ncccn2)CC1	784291561	VTXZYPAMAJGLDA-UHFFFAOYSA-N	446.895	1.420	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)C(=O)Nc1ccc(Oc2cccc(F)c2F)nc1	787550276	RDQXICBTMRQDCC-UHFFFAOYSA-N	427.367	1.876	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)c(C)cc1C	788337777	LPYRXLJPOBCAEM-UHFFFAOYSA-N	437.456	1.305	50	20	IDGD	
Cn1ccc2cccc(NC(=O)C(=O)NNc3ccc(S(=O)(=O)NC4CC4)cc3)c21	788338540	WTNZCHSDUWUGIQ-UHFFFAOYSA-N	427.486	1.701	50	20	IDGD	
O=C(NNc1cccc(F)c1[N+](=O)[O-])C(=O)Nc1ccc(NC(=O)[C@@H]2CCCO2)cc1	790993297	DRQZWJGVFPGDTN-HNNXBMFYSA-N	431.380	1.933	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1ccnn1-c1ccccc1	792210420	YBWLLVLBTUEKKM-UHFFFAOYSA-N	427.486	1.650	50	20	IDGD	
COc1c(NC(=O)C(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)cc(Cl)cc1C(N)=O	793022707	BICRTFVTNJBMMG-UHFFFAOYSA-N	448.907	1.750	50	20	IDGD	
COc1cc(OC)c(S(=O)(=O)NNC(=O)c2cccc(C)n2)cc1Br	794599794	NTZRZGOXFRNZSK-UHFFFAOYSA-N	430.280	1.793	50	20	IDGD	
Cn1cc2c(n1)CCC[C@@H]2C(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	798980696	XVTKVKDLZIOPDZ-KRWDZBQOSA-N	444.967	1.459	50	20	IDGD	
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)NNC(=O)Nc1cc(F)cc(F)c1	802003186	IXBCYLNKSJICDH-INIZCTEOSA-N	449.414	1.678	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)CS[C@H]2CCS(=O)(=O)C2)c(OC)cc1Cl	802081748	AJJRGNAYRILTLZ-VIFPVBQESA-N	437.927	1.430	50	20	IDGD	
CCOC(=O)CON=C(C(=O)NNC(=O)Nc1ccc(Cl)cc1Cl)c1cc[nH]n1	802087253	KDOPGIDSMJDKDF-UHFFFAOYSA-N	443.247	1.853	50	20	IDGD	
COC(=O)c1c(F)cc(NC(=O)C(=O)NNC(=O)COc2ccccc2F)cc1F	802566162	BZQYZBZXPQVUNK-UHFFFAOYSA-N	425.319	1.055	50	20	IDGD	
COC(=O)c1c(F)cc(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)cc1F	802566545	UXJBWNMDKJSQHF-UHFFFAOYSA-N	441.774	1.570	50	20	IDGD	
CCn1cnnc1NC(=O)/C(C#N)=C\c1cn(CCC(N)=O)nc1-c1ccc(OC)cc1	803526054	LRUSZPRKPDFBMV-GDNBJRDFSA-N	434.460	1.591	50	20	IDGD	
C[C@H]1[C@@H](NC(=O)OC(C)(C)C)CCN1C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	804868214	ZXJHVHFCQVMVCB-WFASDCNBSA-N	430.469	1.004	50	20	IDGD	
CN(C[C@H]1CCCN(C(=O)NNC(=O)c2cccc(OC(F)F)c2)C1)S(C)(=O)=O	805065046	IWXXTBHIUUWHJU-GFCCVEGCSA-N	434.465	1.246	50	20	IDGD	
Cc1ccc(Br)c(S(=O)(=O)NCCNC(=O)NNC(=O)C2CCCC2)c1	805352242	WYTWJOOLFAPTKW-UHFFFAOYSA-N	447.355	1.556	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)Nc1ccc(S(=O)(=O)C[C@H]2CCCO2)cc1	806264164	ADJZXNIBPCBADH-OAHLLOKOSA-N	443.489	1.764	50	20	IDGD	
CNS(=O)(=O)c1cc(NC(=O)NNC(=O)[C@H](C)Oc2ccccc2F)ccc1F	806546341	LVDNAYBLPDJGQQ-JTQLQIEISA-N	428.417	1.493	50	20	IDGD	
COCCNC(=O)c1cccc(NC(=O)C(=O)NNc2ncccc2C(F)(F)F)c1	806994291	BSUBPKPHBFBRTK-UHFFFAOYSA-N	425.367	1.558	50	20	IDGD	
O=C(NCc1ccncc1OC[C@@H]1CCOC1)NNC(=O)c1cc(Br)c[nH]1	807616203	PPJCZVSIDHEPCN-LLVKDONJSA-N	438.282	1.732	50	20	IDGD	
O=C(NNC(=O)C1(S(=O)(=O)c2ccccc2)CCOCC1)c1cccc([N+](=O)[O-])c1	807914188	DARSYEQBNZKLJT-UHFFFAOYSA-N	433.442	1.379	50	20	IDGD	
CC[C@@H]1[C@@H](C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)CCN1C(=O)OC(C)(C)C	810107067	VLFPHHMFDLIOFN-JKSUJKDBSA-N	439.534	1.887	50	20	IDGD	
COC(=O)c1c(F)ccc(NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)c1C	810386680	MMLKGVWWRPQNHI-UHFFFAOYSA-N	426.404	1.662	50	20	IDGD	
CCOC(=O)c1ccc(NNC(=O)c2ccc(S(=O)(=O)NCCOC)cc2)cc1C	812721691	AXGWHLVYULXLFT-UHFFFAOYSA-N	435.502	1.853	50	20	IDGD	
O=C(CN1CCC[C@@](CO)(Cc2ccccc2)C1)NNC(=O)c1cccc([N+](=O)[O-])c1	812872995	YCWAWKZKXSMGBD-JOCHJYFZSA-N	426.473	1.673	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)NC[C@H](CO)Cc2cnn(C)c2)c(C)n1C[C@@H]1CCCO1	819666447	RLFYCQVMEFFQRS-QMXFXUOTSA-N	425.533	1.892	50	20	IDGD	
Cn1ccnc1[C@H](NC(=O)NNC(=O)c1csc(N2CCOCC2)n1)c1ccccc1	840461914	MJSBJCAPCFMFGF-MRXNPFEDSA-N	441.517	1.447	50	20	IDGD	
CCNS(=O)(=O)c1ccc(C)c(C(=O)NNC(=S)NCCc2cccs2)c1	849366506	FSSGQRQNNAZDQU-UHFFFAOYSA-N	426.589	1.706	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)[C@H]1CC(=O)N(c2ccc3c(c2)OCCO3)C1	871626766	UMNURLIMGGJLPI-INIZCTEOSA-N	439.468	1.600	50	20	IDGD	
CC(=O)NNC(=O)CCCCCNC(=O)c1cc(S(=O)(=O)N(C)C)ccc1Cl	884739108	HYWXVUZRBMREAG-UHFFFAOYSA-N	432.930	1.048	50	20	IDGD	
COc1cccc(/C=C(/C#N)C(=O)OCC(=O)N2CCN(CC(=O)NC(C)(C)C)CC2)c1	912612190	NDFHWZHMMQFPBU-PDGQHHTCSA-N	442.516	1.204	50	20	IDGD	
O=C(COC(=O)C1(c2cccc(Cl)c2)CC1)NNC(=O)[C@H]1COc2ccccc2O1	913392902	YXBNCMPBGWSHOF-QGZVFWFLSA-N	430.844	1.902	50	20	IDGD	
N#C/C(=C\c1cn(CCC(N)=O)nc1-c1cccc(Br)c1)C(=O)NCCO	914532841	QKPNAXKDOCYRHF-MDWZMJQESA-N	432.278	1.203	50	20	IDGD	
COC(=O)C[C@@H]1c2cc(OC)c(OC)cc2CCN1CC(=O)NNC(=O)c1ccccc1	916148172	ZCUPIBWLDKFEII-GOSISDBHSA-N	441.484	1.627	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)N[C@@H](CN2CCOCC2)c2ccccc2)cc1C	916216865	UKAZKCMXPZNRPC-FQEVSTJZSA-N	439.516	1.646	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NCc2cccc(S(=O)(=O)NC(C)C)c2)cc1C	916486324	LQZOTZRGTDSAGI-UHFFFAOYSA-N	448.545	1.900	50	20	IDGD	
CCn1c(O)nc2cc(C(=O)NNC(=O)c3nn(-c4ccccc4)cc3O)ccc2c1=O	916752499	IOJXLVZATBAQMR-UHFFFAOYSA-N	434.412	1.088	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)[C@@H](C)NS(=O)(=O)c2cccs2)cc1	917917999	ISXYZZASWQJYMO-OLZOCXBDSA-N	441.531	1.429	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)[C@@H](C)NS(=O)(=O)c2cccs2)c1C	917918953	IOMRJEBOSRLCGA-ZIAGYGMSSA-N	425.532	1.647	50	20	IDGD	
CC[C@H](C)[C@@H](C)NC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	920048631	JGFIQVCEQYAGDZ-JKSUJKDBSA-N	440.566	1.405	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)NCc1cccc(C(=O)N2CCOCC2)c1	920811874	NABGWOSFMIGZQO-UHFFFAOYSA-N	440.500	1.631	50	20	IDGD	
Cc1ccc(S(=O)(=O)Nc2cccc(C(=O)NNC(=O)CN3CCCC3=O)c2)cc1F	920827533	UCOJWFZCPFJNBE-UHFFFAOYSA-N	448.476	1.318	50	20	IDGD	
O=C(NC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1)NNC(=O)c1cncn1-c1ccccc1	1256705469	JIBPLAYUMDIKOC-SFHVURJKSA-N	446.467	1.944	50	20	IDGD	
Cc1nc2[nH]n(C)c(=O)c2c(C)c1CCC(=O)NNC(=O)c1cncn1-c1ccccc1	1318547992	GREOCIOBDWSRHF-UHFFFAOYSA-N	433.472	1.458	50	20	IDGD	
O=C(Cn1cc(C2CC2)nn1)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	1319119238	QUFFFPYDLUIBKE-UHFFFAOYSA-N	443.471	1.319	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)CCc3ccc4c(c3)CCO4)CC2)cc1	1333465915	MUEBLEUUTLJPBC-UHFFFAOYSA-N	436.556	1.828	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](N)Cc2cscn2)C1	1777965845	KWIVGPYDAFVOJX-MIALQEHNSA-N	443.013	1.934	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@](C)(C(=O)N2CC[C@@]3(CN(C(=O)[C@H](F)Cl)CCO3)C2)C1	1778179559	QWOSUHHYLRLCHL-PNHOKKKMSA-N	447.935	1.998	50	20	IDGD	
CC(=O)O[C@H](C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCBr)C2)C(C)C	1779205870	NIVIEURLPBZPLV-HHXXYDBFSA-N	447.370	1.873	50	20	IDGD	
Cc1cnc2c(C(=O)N3CCO[C@@]4(CCN(C(=O)CO[Si](C)(C)C)C4)C3)cnn2c1	1779296793	FRXOBUWVYNUOBC-HXUWFJFHSA-N	431.569	1.333	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc3cccnn3n2)C1	1779994103	OSSZXVDRVUDIDO-XAUMDUMWSA-N	435.912	1.111	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(C1)CN(C(=O)C13CC(C1)C3)CCO2	1780098667	GQNMMWORWORWSP-IVKVDSSUSA-N	443.456	1.764	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cn3[nH]cnc(=O)c3c1C)C2	1780706530	WXHRFINRZXHGTB-GCKMJXCFSA-N	449.939	1.476	50	20	IDGD	
O=C(c1n[nH]c2c1CCCC2)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781330929	IWQOKGAKTAPGRV-RHSMWYFYSA-N	429.290	1.423	50	20	IDGD	
CCOC(=O)C1(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)CCBr)C3)CC1	1781620674	DENNJMOUXLEXPD-RDTXWAMCSA-N	445.354	1.629	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cccnc3OC)CCO2)C1	1783344410	QBFPILKABDKWGJ-KDOFPFPSSA-N	426.311	1.707	50	20	IDGD	
Cc1noc(C)c1CCC(=O)N1CCO[C@]2(CCN(C(=O)[C@H](C)Br)C2)C1	1783532565	PRNFZJDMCSJCFF-KPZWWZAWSA-N	428.327	1.837	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cc(-c4ccncc4)[nH]n3)CCO2)C1	1783539180	YOWQKEYJIHDJKF-BFUOFWGJSA-N	448.321	1.699	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cc(C)nc4ccc(O)cc34)CCO2)C1	1783875343	PVPSVHWBGAFXIK-PGRDOPGGSA-N	447.919	1.946	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cncnc3)C[C@@H]21	1783969307	KVAXPEIMVULACL-OEAJRASXSA-N	425.327	1.030	50	20	IDGD	
COc1cc(C(=O)Nc2ccc(C3(NC(=O)CCC(=O)NN(C)C)CCC3)cc2)n(C)n1	1787069182	OUAAELUUYXGHEA-UHFFFAOYSA-N	442.520	1.549	50	20	IDGD	
Cc1ccc(-n2ccnn2)c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]3C2)c1	1787449575	HZAYUOUMMDWPDX-QXRTWZOPSA-N	435.887	1.703	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccncc3F)[C@H]2C1	1787752197	BTMTWQBUFNDSHY-DSPQJCBJSA-N	428.302	1.845	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccnn3-c3ccccc3)[C@H]2C1	1787771284	KAMYOYSDIIEAAU-CAIZAGQASA-N	446.935	1.719	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC1(c2ccc(NC(=O)CC(F)(F)C(=O)O)cc2)CCC1	1788571177	RWXGFCCBUICHBF-UHFFFAOYSA-N	440.447	1.604	50	20	IDGD	
CSc1cccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](O)CCl)C[C@@H]32)c1O	1789245859	SRZZNCBZKSLOBD-MHEUCROKSA-N	428.938	1.307	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)c1cccc(C(F)(F)F)c1	1789549899	ZTKLTNFHWWNDIA-TUUVXOQKSA-N	434.842	1.898	50	20	IDGD	
N[C@H](CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]2C1)c1cccnc1	1789922741	PDFLZMIWZPPNJI-KSXIZUIISA-N	443.317	1.142	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4ncccc4[nH]3)C[C@@H]21)[C@@H](F)Br	1789923299	DRPKRFSEBMYKJX-KUDNYVPYSA-N	439.285	1.847	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21	1791060998	NXSOYCIZHSURPZ-NMUGVGKYSA-N	430.112	1.440	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3cccs3)C[C@@H]21	1791288869	YZGXNGMQGYEJEZ-SZMVWBNQSA-N	436.578	1.033	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21)c1ccc(N2C(=O)C=CC2=O)cc1	1792071124	VLKPDYUVRXITKH-FJXLLPKBSA-N	449.866	1.244	50	20	IDGD	
Cc1cc(/C=C/C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)CBr)no1	1792871051	PPJUHMQICNQCPZ-OTDOOETQSA-N	426.311	1.617	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CCc3nc[nH]c3C1)C2	1792871952	FSUBJIYHEXBVSG-CGEFAEBTSA-N	439.354	1.135	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cnc2ccccn12	1792934890	WGNPLESCZZFGJL-ZZXMYQEDSA-N	439.343	1.703	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CCCN(Cc3ccccc3)C1)C2)[C@H](O)CCl	1792975413	QVHWPDCFVXOWQG-AFDCHOCNSA-N	449.979	1.088	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1CC(c2ccccc2)=NO1	1793499388	QGPIGEGVSBEDGW-AJYBTWMASA-N	441.532	1.191	50	20	IDGD	
Cc1ncc(/C=C/C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCBr)s1	1795116869	BWRAEYDEFVAFTR-BNNGIJEPSA-N	428.352	1.839	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1sc2nccnc2c1N	1795704486	IVGFRHQIODKCMH-GFQSEFKGSA-N	437.953	1.884	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Cl)C[C@H]2C[C@H]21	1796361192	KZFMWZDHUWULNS-GIAZKGQJSA-N	445.919	1.508	50	20	IDGD	
CC(C)(C)OC(=O)N1CC2(C[C@H]2C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Cl)C1	1796370089	HFPPOAQAYIXRRA-AIEDFZFUSA-N	445.919	1.367	50	20	IDGD	
C[C@@H](Nc1nccs1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CO[Si](C)(C)C)C2	1796412669	CJKBDQVKDBAQLH-HGTKMLMNSA-N	426.615	1.385	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1c[nH]c2ccc(OC)cc12	1797408792	YNFNTKBGICPRLR-JBYDNAENSA-N	435.908	1.634	50	20	IDGD	
CCn1nc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)CBr)C3)cc1C	1798230768	SCYAIXIUJGVUDV-ZIEJDFEHSA-N	427.343	1.446	50	20	IDGD	
Cc1ccccc1OCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnccc1C(=O)NN	1798439315	VVUMTBFYHFMASB-BJWYYQGGSA-N	437.500	1.324	50	20	IDGD	
COc1cc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@](C)(Cl)CCl)ccn1	1799273608	DKYNXPLDHRUXND-BAAGSCJXSA-N	444.359	1.849	50	20	IDGD	
Cc1ccn2ncc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@@H](F)Br)c2c1	1799346743	ZVUAOXNUGSOLEQ-NOXHYTERSA-N	439.285	1.536	50	20	IDGD	
CN(C)c1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Br)cc1	1799348890	RHZKIVYKNHQPNX-XRGAULLZSA-N	428.302	1.646	50	20	IDGD	
Cc1c(Br)c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](O)CCl)C3)nn1C	1799442855	AXPWQOAJPFCHOX-USZNOCQGSA-N	433.734	1.343	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](O)Cc1ccccc1	1800635854	KGMDYEMXQUSSJL-JZBZHOAESA-N	429.344	1.416	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CNc1ccc(F)cc1)C2	1800756703	REFWNPLKYCILRX-JRATXPSKSA-N	428.302	1.611	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1(NC(=O)OC(C)(C)C)CC1	1802224519	BMKCQPIYPQYWMJ-XGUBFFRZSA-N	429.945	1.651	50	20	IDGD	
C=CCNC(=O)/C=C\C(=O)NC[C@@H]1CCN(C(=O)C(Cl)Cl)[C@@H]1c1cccnc1	1802497444	HNMTWEOMLIFMFN-XGRZMECZSA-N	425.316	1.750	50	20	IDGD	
CC(C)(C)OC(=O)CC(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1	1803136707	TZFQQHSWEQUDLE-VKJFTORMSA-N	425.913	1.419	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC2(CCCN(C(=O)c3cccnc3Cl)C2)CC1	1804656908	NDTVYKDMQNILPL-UHFFFAOYSA-N	441.724	1.573	50	20	IDGD	
C[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCC2(CCCN(C(=O)[C@@H](O)CCl)C2)CC1	1805515521	ROGFKQRVJNWDJR-GJZGRUSLSA-N	431.961	1.731	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@@H](CNC(=O)CNCP(=O)(O)O)[C@@H]1c1cccnc1	1807018788	QKCVTIYWBHKFQC-HOCLYGCPSA-N	446.872	1.077	50	20	IDGD	
C[C@H](C(=O)NC[C@@H]1CCN(C(=O)[C@H](F)Cl)[C@H]1c1cccnc1)N1CCN(C)CC1	1807862113	AYBKPPJCOXHKEH-UBDQQSCGSA-N	425.936	1.258	50	20	IDGD	
Cc1c(C(=O)N2CC[C@H](CNC(=O)[C@H](F)Cl)[C@@H]2c2cccnc2)cn2[nH]cnc(=O)c12	1808315444	NNJDWOLIWMALSE-COXVUDFISA-N	446.870	1.580	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)[C@@H]2CC=CCC2)[C@@H]1c1cccnc1	1810294424	KNUMLXOKZKGGIZ-HGHGUNKESA-N	448.527	1.756	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)CCNC(=S)NC)[C@@H]1c1cccnc1	1810314726	JNRZBTVTIKCNBV-ZOBUZTSGSA-N	425.986	1.589	50	20	IDGD	
CCNC(=S)NCC(=O)NC[C@H]1CCN(C(=O)C(Cl)Cl)[C@@H]1c1cccnc1	1812333416	OGOXXMDDWPAADD-TZMCWYRMSA-N	432.377	1.375	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2cncc(F)c2)[C@@H]1c1cccnc1	1813070953	MNQFHEAYIFJACQ-IIBYNOLFSA-N	442.495	1.308	50	20	IDGD	
CN(CC(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](O)CCl)CC2)C(=O)OC(C)(C)C	1814231319	DLUPFGGKJSWKAR-ZYHUDNBSSA-N	446.957	1.522	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CNC(=O)N(C)C)n[nH]1	1814566099	CGODFXISXOVBKH-CMPLNLGQSA-N	429.319	1.456	50	20	IDGD	
C[C@@H]1CCC[C@@H]1C(=O)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1	1815356688	LJDSZPSNAXOQHD-KCXAZCMYSA-N	427.335	1.485	50	20	IDGD	
N#Cc1cccc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)c1	1815360356	GPCPTTSTWUEOHX-KRWDZBQOSA-N	446.297	1.234	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(O)cc1)CC2)c1cccc(B(O)O)c1	1815360748	MYLLMXNLUANDHP-OAHLLOKOSA-N	437.286	1.068	50	20	IDGD	
Cc1noc(CC(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@H](F)Br)CC3)n1	1815565911	RODONVRLVPSWCC-MADCSZMMSA-N	432.275	1.680	50	20	IDGD	
CCc1ccnc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)CCC(=O)NN(C)C)CC3)c1	1816055696	CWBBGWUXCFASSW-AWEZNQCLSA-N	444.561	1.699	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](F)Br)CC2	1817021432	GEIPNQYCAVDTTF-MHYGZLNHSA-N	436.307	1.193	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CS(C)(=O)=O)n[nH]1	1817054043	WPXVDUSMTQQRAP-JQWIXIFHSA-N	435.344	1.477	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](O)CCl)CC2)c1ncn(-c2ccccc2)n1	1817487775	ZXIBREVQEUUWQA-FZMZJTMJSA-N	446.920	1.549	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H]2CCOC2)[nH]n1	1818114419	ZITAVTDXDYKTDB-GUROPIRUSA-N	441.492	1.572	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@H](O)CCl)CC2)c1ccc2nc(CO)[nH]c2c1	1818150029	FAGJUSAJLMYTIQ-QMTHXVAHSA-N	449.920	1.337	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(F)cn2C)n[nH]1	1818388392	UNJSGZGRNBJDMT-HNNXBMFYSA-N	433.488	1.566	50	20	IDGD	
Cc1cnoc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819403272	BOCCEXYRRJQQFF-HNNXBMFYSA-N	438.448	1.324	50	20	IDGD	
C[C@@]1(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)CC1(F)F	1823394193	QANXNJOFTDLGFD-BEFAXECRSA-N	432.236	1.441	50	20	IDGD	
C[C@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1)C1(O)CCC1	1823732611	JZJFVWCWOHVJOT-DYESRHJHSA-N	442.365	1.151	50	20	IDGD	
O=C(Cc1ccc2ncnn2c1)N1CCC([C@@H]2CCCCN2C(=O)[C@H](O)CCl)CC1	1824184427	MTPAKRSFDBKUSX-ZWKOTPCHSA-N	433.940	1.491	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@H]2CCCO2)CC1	1827243795	LAIKEDZYPHZXGP-LZVXGSKFSA-N	443.548	1.919	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2nc[nH]n2)CC1	1827346662	GDZOBKOKURARAR-YSGZUTGPSA-N	440.508	1.172	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@H](F)Br)CC1	1827566448	GGQFYZIJNJCHSJ-IHRRRGAJSA-N	435.338	1.744	50	20	IDGD	
O=C(c1ccc(Cl)cc1F)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1	1830080398	XHDSPVYTVMGSQJ-MAUKXSAKSA-N	435.279	1.149	50	20	IDGD	
O=C(c1c[nH]c(=O)cn1)N1CCC([C@H]2CCCCN2C(=O)[C@@H](F)Br)CC1	1830380521	PPYWKUANAKPMPV-UKRRQHHQSA-N	429.290	1.694	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H]2CNC(=O)O2)CC1	1831546068	CJWZXODFGJWKGC-KKUMJFAQSA-N	430.343	1.888	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CC(=O)OC(C)(C)C)C2)C1	1831639587	CPAGKLUIWOGMPT-QRWLVFNGSA-N	432.945	1.582	50	20	IDGD	
COCc1oncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1	1831873320	PIPZESDCDPSUKZ-SFHVURJKSA-N	449.552	1.427	50	20	IDGD	
CC(C)c1nc(CC(=O)N2CCO[C@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)no1	1832783111	HSYZHROZXAVCOH-HXUWFJFHSA-N	442.944	1.457	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(C)on3)CCO2)C1	1834350487	AKXSBLLBNXIDPE-GUYCJALGSA-N	430.299	1.227	50	20	IDGD	
CCc1oncc1C(=O)N1CCO[C@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1	1834519373	KWFMOQMDYXWHCX-IBGZPJMESA-N	425.558	1.159	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)C(Cl)Cl)CC2)CC1)c1[nH]nc2ccncc12	1835018811	FPAXHZJQDDVFRT-UHFFFAOYSA-N	439.347	1.947	50	20	IDGD	
N[C@@H](CC(=O)N1CCC(N2CCC(NC(=O)[C@@H](F)Cl)CC2)CC1)c1cccnc1	1835080347	QDGMKXSVLVBYNF-PKOBYXMFSA-N	425.936	1.578	50	20	IDGD	
C[C@H](Nc1cnccn1)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](F)Cl)CC2)CC1	1835749562	VIAJLLMWPJBZOE-SUMWQHHRSA-N	426.924	1.383	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC(OC2CCN(C(=O)c3nc[nH]n3)CC2)CC1	1836670886	KZPAWLXTCMZLQR-GFCCVEGCSA-N	428.331	1.448	50	20	IDGD	
Cc1ncc(CC(=O)N2CCC(OC3CCN(C(=O)[C@H](O)CCl)CC3)CC2)s1	1836720230	LSNJOAULLFIJAJ-QGZVFWFLSA-N	429.970	1.592	50	20	IDGD	
O=C(c1nn[nH]c1C(F)(F)F)N1CCC(OC2CCN(C(=O)[C@H](F)Cl)CC2)CC1	1838082700	MZBZVGZFUVGWBJ-ZDUSSCGKSA-N	441.813	1.970	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(F)cc3)CCO2)C1	1838953696	KVGNVLWCHBDFKH-KUHUBIRLSA-N	443.313	1.927	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cn4c(F)cccc4n3)C2)C1	1839148089	LXXXXSNKVZQBJB-VBKZILBWSA-N	438.887	1.561	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCCCCC(=O)OC)C2)C1	1839149023	QICUPYAVKYXYDF-UZLBHIALSA-N	432.945	1.584	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C=C/c3cccnc3)C2)C1	1840030998	BYXUEVUHZWWXEC-IHMJFIQFSA-N	438.322	1.335	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)ccn1	1840033464	GBZPTRLKLQJHLT-KDOFPFPSSA-N	426.311	1.243	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3cccc(C)n3)C2)C1	1840150087	FHZADVUUNZSZEP-WIYYLYMNSA-N	439.940	1.033	50	20	IDGD	
O=C(c1ccn2ccnc2c1)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840188473	LWTUCMMZMQKWDU-GOSISDBHSA-N	427.288	1.208	50	20	IDGD	
Cc1nn(C)c(C)c1CC(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1840435293	RPHJIAVVOWIAOY-OAQYLSRUSA-N	440.972	1.301	50	20	IDGD	
C[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1)c1ccccn1	1840503526	CSJKTRCUKREIQC-YEWWUXTCSA-N	444.301	1.332	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)C3Cc4ccccc4C3)CCO2)C1	1840944385	DOCACZVSMAFKIY-UGKGYDQZSA-N	436.936	1.112	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)C2CCN(C(C)C)CC2)C1	1841871943	HBCXRKTYLYQVSC-KOEQRZSOSA-N	442.564	1.444	50	20	IDGD	
Cc1cc2nnc(C(=O)N3CC4(CCCN4C(=O)[C@H](F)Br)C3)c(C)n2n1	1845217672	ONRVULOCAWVDLV-ZDUSSCGKSA-N	425.262	1.249	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC2(CCCN2C(=O)c2cc3n(n2)CCCN(C)C3)C1	1845725940	IRUROWLUFXIAPC-AWEZNQCLSA-N	438.370	1.567	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC2(CCCN2C(=O)c2cc3n(n2)CCCN(C)C3)C1	1845727619	VZYITWZPVXJEIN-OAHLLOKOSA-N	438.370	1.709	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)c1ccc(OCC3CC3)cc1F)C2	1846385402	BEHICLZDAKBBRK-UHFFFAOYSA-N	446.523	1.805	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)C(C)(C)C	1847528390	VWQWFIBVRWWMFT-BQFCYCMXSA-N	433.461	1.743	50	20	IDGD	
O=C(CCn1c(=O)oc2ccccc21)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](F)Br	1848153870	XHBMQLVILKUQGN-MKBNYLNASA-N	440.269	1.877	50	20	IDGD	
Cc1nn(-c2cccc(C(F)(F)F)c2)c(C)c1C(=O)C(=O)NNc1nnc(C)c(=O)[nH]1	11548432	HQIMBPSABUCJKA-UHFFFAOYSA-N	435.366	1.621	50	20	IDGD	
CCOc1ccccc1OCCCC(=O)NNC(=O)c1csc(N2CCOCC2)n1	12803250	FICWFCOZQXCUKM-UHFFFAOYSA-N	434.518	1.999	50	20	IDGD	
O=C(NNC(=O)c1cccnc1)c1ccc(S(=O)(=O)NCCc2cccs2)cc1	24562427	QEHRZBHVIUQOAM-UHFFFAOYSA-N	430.511	1.739	50	20	IDGD	
CNS(=O)(=O)c1ccc(C)c(C(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)c1	26688548	YFNIZONNTJVFGQ-UHFFFAOYSA-N	437.474	1.004	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNS(=O)(=O)c2ccc(N3CCCC3=O)cc2)cc1	28808363	UQHVTGIMFDGJKK-OAHLLOKOSA-N	447.513	1.989	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)NCCC(=O)N2CCN(c3ccccc3)CC2)cc(C#N)n1C	216345572	DGUMDWSLNHKZAX-ZHZULCJRSA-N	430.512	1.967	50	20	IDGD	
Cc1ccc(-c2nnc(S)n2CC(=O)NNC(=O)CNC(=O)c2cccs2)cc1	725741546	PVXYJVUBDIGSNV-UHFFFAOYSA-N	430.515	1.181	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)CCNC(=O)C1CCCCC1	726045736	LHDJRDYYDSIUHK-UHFFFAOYSA-N	439.896	1.739	50	20	IDGD	
COCCCNC(=S)N(C)NC(=O)c1ccc(S(=O)(=O)N2CCC(C)CC2)cc1	726077246	SCEFSVJRAHHBFW-UHFFFAOYSA-N	442.607	1.595	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)[C@@H]1Nc2ccccc2S(=O)(=O)N1	727753018	QXKQOFSBHRHLLS-MRXNPFEDSA-N	443.510	1.610	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)[C@H]1CC(=O)N(Cc2ccccn2)C1	728209608	ISYIYRGSFDLUPD-AWEZNQCLSA-N	429.502	1.014	50	20	IDGD	
O=C(COC(=O)c1cc(Br)cs1)NNC(=O)[C@H]1COc2ccccc2O1	728332157	HMKIWDFWQZWUKA-GFCCVEGCSA-N	441.259	1.655	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1ccn(-c2ccccc2Cl)n1	728846942	XHWMNRUTVSNRRY-UHFFFAOYSA-N	425.880	1.993	50	20	IDGD	
O=C(NCc1nc(Cc2ccccc2)no1)NNC(=O)C1CCN(c2ncccn2)CC1	729048583	IRZMDZXQBPPEAC-UHFFFAOYSA-N	436.476	1.197	50	20	IDGD	
CC(C)NS(=O)(=O)c1cc(C(=O)NNC(=O)Cn2ccc3ccccc32)ccc1F	729450570	CORKNBXAOUROAZ-UHFFFAOYSA-N	432.477	1.928	50	20	IDGD	
CC(C)N1C(=O)c2ccc(C(=O)NNC(=O)Cn3ccc4ccccc43)cc2S1(=O)=O	729453877	CBYPKSCOBFUFMP-UHFFFAOYSA-N	440.481	1.655	50	20	IDGD	
Cn1c(=O)nc(O)c2c(C(=O)NNC(=O)c3cccc4ncccc34)cc(C3CC3)nc21	730227606	HLHJGKIFVXAHQH-UHFFFAOYSA-N	430.424	1.535	50	20	IDGD	
CC[C@@H](C)C(=O)N1Cc2ccccc2C[C@@H]1C(=O)NNC(=O)COc1ccccc1O	730781226	IHSQJEVZVDBXSI-CRAIPNDOSA-N	425.485	1.918	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)NC1CCN(CC(=O)Nc2ccccc2)CC1	730820350	GCWVOWOVFYMCIJ-UHFFFAOYSA-N	441.488	1.205	50	20	IDGD	
CC(=O)N1CCN(C(=O)CCNC(=O)NNC(=O)CC23CC4CC(CC(C4)C2)C3)CC1	730825394	BRDPHHWIVODKLX-UHFFFAOYSA-N	433.553	1.004	50	20	IDGD	
N#CCCn1cc(/C=C(\C#N)C(=O)NCCCN2C(=O)CNC2=O)c(-c2ccccc2)n1	731008596	JZAIGSJBEBXVCT-SFQUDFHCSA-N	431.456	1.429	50	20	IDGD	
CC(C)(C(=O)NNC(=O)CCS(=O)(=O)c1ccc2c(c1)OCCO2)c1ccccc1	731176071	FSAKKAMOEVMCSC-UHFFFAOYSA-N	432.498	1.747	50	20	IDGD	
Cc1[nH]c2ccnn2c(=O)c1CC(=O)OCC(=O)NN=C(c1ccccc1)c1ccccc1	733546197	BTFSUDCFGNAEON-UHFFFAOYSA-N	443.463	1.986	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)[C@@H]1CCCN(C(=O)Cc2ccccc2)C1	734242183	WODVQMLFXMQZQC-QGZVFWFLSA-N	447.536	1.323	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)[C@@H]1CC[C@@H](C(F)(F)F)NC1=O	734250891	OAJUYBVUCQKDJJ-MFKMUULPSA-N	436.456	1.664	50	20	IDGD	
CN(CC(=O)NNc1cc(C(F)(F)F)nc(-c2ccccn2)n1)[C@H]1CCS(=O)(=O)C1	734258618	MITMOQVETFVVCJ-NSHDSACASA-N	444.439	1.119	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)[C@@H]2CCCN(C(=O)C3CC3)C2)CC1	734825904	QMIBIGDKSBHLNR-OAHLLOKOSA-N	437.541	1.365	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)N[C@H]2CCCN(c3cccc(F)c3)C2)c2ccccc2c1=O	734949632	DAVOZLHBMPDDRG-HNNXBMFYSA-N	438.463	1.686	50	20	IDGD	
COc1ccc(S(=O)(=O)C[C@H](C)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)cc1	734990858	BXMJDGZGTCIXCS-UONOGXRCSA-N	438.477	1.859	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCc4ccccc43)c2)cn1	735446420	WMIADNOVBQXQRM-UHFFFAOYSA-N	439.497	1.636	50	20	IDGD	
O=C(NCCCc1ccc(O)cc1)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	735761839	ZZENSNZQAPJZBN-UHFFFAOYSA-N	446.529	1.754	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)N[C@H](C)[C@@H]2CN(Cc3ccccc3)CCO2)cc1	741437273	XVLCNAVKCUVRQZ-NQIIRXRSSA-N	426.517	1.994	50	20	IDGD	
CCS(=O)(=O)NCc1ccc(C(=O)NNC(=O)Cc2nc3ccccc3n2C)cc1	741661608	WOSJXSOGVYZCMQ-UHFFFAOYSA-N	429.502	1.016	50	20	IDGD	
COc1ccc(C)cc1CN1CCN(CC(=O)NNC(=O)Cc2nc(C)cs2)CC1	741673882	DFFURKAHIZKUTF-UHFFFAOYSA-N	431.562	1.276	50	20	IDGD	
CC(=NNC(=O)Cc1cc(O)nc(O)n1)c1ccc(S(=O)(=O)NCc2ccco2)cc1	743446190	QOXBVXGSNPIPQN-UHFFFAOYSA-N	445.457	1.042	50	20	IDGD	
O=C(NC[C@H]1CCS(=O)(=O)C1)NNC(=O)Nc1ccc(Br)cc1Cl	743530645	OLJHQDWFZZGEGF-MRVPVSSYSA-N	439.719	1.873	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(C(=O)NNC(=O)NC2CCCC2)ccc1Br	744052684	OPAOWUJSAHYZSE-UHFFFAOYSA-N	433.328	1.586	50	20	IDGD	
O=C(CC1CCCCC1)NCC(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	744621641	WNBUUYLUVVFKRU-UHFFFAOYSA-N	438.550	1.237	50	20	IDGD	
C[C@@H](C(=O)OCC(=O)NNC(=O)c1cccc(Cl)c1)n1nnc(-c2ccccc2)n1	745685140	TZAOZMTWHAIZMT-LBPRGKRZSA-N	428.836	1.559	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)NCc2cc(S(N)(=O)=O)ccc2F)c(Cl)c1	745825365	HTJORSUITIXDHT-UHFFFAOYSA-N	429.861	1.971	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2ccc(-c3nnc(C)o3)cc2)cc1	746093511	IRWPBJPXCIWWEE-UHFFFAOYSA-N	443.485	1.435	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNc3oc(C(C)C)nc3C#N)CC2)cc1	746526324	ZZSDHRCROQWKPZ-UHFFFAOYSA-N	446.533	1.428	50	20	IDGD	
CN1C(=O)C[C@@H](C(=O)NNC(=O)Cc2cn3ccccc3n2)[C@H]1c1cccc(Cl)c1	746556255	OYQGLVHPVFLSLN-OXQOHEQNSA-N	425.876	1.897	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)NC[C@H](c1cccs1)N1CCOCC1	746742681	NEUATNADYLHTLU-MRXNPFEDSA-N	428.518	1.342	50	20	IDGD	
O=C(NNC(=O)[C@]12CCC(=O)N1c1ccccc1C(=O)N2Cc1ccccc1)c1ccc[nH]1	747663984	VSBDUUJRGIZZJA-DEOSSOPVSA-N	443.463	1.955	50	20	IDGD	
CC(C)OCCS(=O)(=O)NCC(=O)NNC(=O)[C@H](C)Oc1ccc2ccccc2c1	747905721	JWLJNPRUXQCXGJ-HNNXBMFYSA-N	437.518	1.099	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)N2CCN(CCS(N)(=O)=O)CC2)c(C)n1CCC(C)C	748372748	SNGSSFLPRYOZMY-ZHZULCJRSA-N	435.594	1.491	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)NCCCN1CCN(c2ccncc2)CC1	748466072	UUMCFYINGBRXFO-QGZVFWFLSA-N	444.511	1.531	50	20	IDGD	
NS(=O)(=O)Cc1cccc(C(=O)NNC(=O)c2ccc(F)cc2Br)c1	749733095	OQSJHMKEWSCYAZ-UHFFFAOYSA-N	430.255	1.452	50	20	IDGD	
CN(C)c1cccc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)n1	755098891	PJJRWCWYGFTTLS-UHFFFAOYSA-N	446.533	1.076	50	20	IDGD	
Cc1ccccc1NS(=O)(=O)c1ccc(C)c(C(=O)NNC(=O)Cc2cc[nH]n2)c1	755281428	GVZRXRASQJVNDD-UHFFFAOYSA-N	427.486	1.831	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)Nc1cccc(S(=O)(=O)NC2CC2)c1	755586043	QSEROOQFYITAIR-KRWDZBQOSA-N	432.458	1.120	50	20	IDGD	
CN(C)C(=O)NN=Cc1c(Sc2nnnn2-c2ccccc2)nc2ccccn2c1=O	755673651	QTHMDIJAMMESLE-UHFFFAOYSA-N	435.473	1.427	50	20	IDGD	
O=C(CN(Cc1ccccc1O)C[C@@H]1CCCO1)NNC(=O)c1ccc([N+](=O)[O-])cc1	756326062	CHWGRXVRKYBPIL-SFHVURJKSA-N	428.445	1.743	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)Nc2ccc3nc(N4CCOCC4)oc3c2)c1	757777881	VABDURYMTHERST-UHFFFAOYSA-N	439.432	1.484	50	20	IDGD	
Cc1c[nH]ccc1=NC(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	757806827	BXLHYYQOFJFONW-UHFFFAOYSA-N	428.456	1.980	50	20	IDGD	
CCc1ccc(S(C)(=O)=O)cc1C(=O)OCC(=O)NNC(=O)c1cccc(C#N)c1	758926785	PGMNKXCVTXFEIN-UHFFFAOYSA-N	429.454	1.142	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@H](C(=O)NNc3ncccc3[N+](=O)[O-])C2)s1	759289416	FGDUHDZZYGODTD-LBPRGKRZSA-N	425.492	1.904	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)Nc1cccc(S(=O)(=O)Nc2ccccc2)c1	760947418	JBTOBKSLTFJUSG-CQSZACIVSA-N	436.490	1.692	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)C1=Cc2cc(F)ccc2OC1	761487198	GNNHNWVSMKZQEP-UHFFFAOYSA-N	438.459	1.207	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1cc(Br)ccc1F	763467272	ALFXRJFKEVZWDZ-UHFFFAOYSA-N	425.170	1.896	50	20	IDGD	
O=C(NNC(=O)c1cccnc1)C(=O)Nc1cccc(-c2cn(Cc3ccccc3)nn2)c1	763492521	YLTMLWXDZKCTAK-UHFFFAOYSA-N	441.451	1.788	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)C(=O)Nc1cc(F)ccc1OC[C@@H]1CCCO1	763551921	USRKGNWCZOHLQC-AWEZNQCLSA-N	445.403	1.512	50	20	IDGD	
CN(Cc1cccc(NC(=O)C(=O)NNC(=O)c2ccccc2F)c1)C(=O)C(F)(F)F	763562316	TYKNHENMDTVRAS-UHFFFAOYSA-N	440.353	1.746	50	20	IDGD	
CCN(Cc1ccccc1NC(=O)C(=O)NNC(=O)c1c(C)nc2ccccn12)C(C)=O	763629713	RLIBBTJDNJLIFH-UHFFFAOYSA-N	436.472	1.411	50	20	IDGD	
COCCOc1c(Cl)cccc1NC(=O)C(=O)NNC(=O)COc1ccccc1F	763681148	LAGNXSKIJZFJDS-UHFFFAOYSA-N	439.827	1.669	50	20	IDGD	
Cc1nnnn1-c1cc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCC3)ccc1F	763784562	ZGKBWJLDFAGJQZ-UHFFFAOYSA-N	429.437	1.060	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1c2c(nn1-c1ccccc1)CCC2	763812848	IVXZFLUUMJFMPS-UHFFFAOYSA-N	444.451	1.398	50	20	IDGD	
CCOC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)cc1	763868051	ZXHIDOBHLRAVII-GFCCVEGCSA-N	432.408	1.948	50	20	IDGD	
Cc1ccc(C(=O)NC2CC2)cc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccc(F)cc1	763871328	FUQJGMUYHXTNDP-ZDUSSCGKSA-N	442.447	1.580	50	20	IDGD	
COc1cc(C)c(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(C(C)=O)cc2)cc1OC	763872297	NKURCPDRFDVKAK-CQSZACIVSA-N	443.456	1.768	50	20	IDGD	
COCCOc1ncccc1NC(=O)C(=O)NNC(=O)c1cc2c(s1)CC[C@H](C)C2	763943107	RAXBYACCBLBOMJ-LBPRGKRZSA-N	432.502	1.693	50	20	IDGD	
N#CCCCOc1cccc(NC(=O)C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)c1	763944522	MOVFFZMIFSIRCS-UHFFFAOYSA-N	448.439	1.660	50	20	IDGD	
COc1cc(F)c(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)on2)cc1OC	764017370	XEJNSFYQGAVAPL-UHFFFAOYSA-N	428.376	1.898	50	20	IDGD	
CNC(=O)c1ccc(OC)c(NC(=O)C(=O)NNC(=O)c2cccc(Br)c2)c1	764063697	WJXSZQOVIDOSHG-UHFFFAOYSA-N	449.261	1.217	50	20	IDGD	
O=C(CC1CC1)NNC(=O)C(=O)Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1	764143386	PZILQUFMKYHKEW-UHFFFAOYSA-N	449.555	1.937	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)C(=O)Nc1ccc(-c2nnc3n2CCCC3)cc1	764314056	RAKVCPDOYDVSRE-UHFFFAOYSA-N	436.447	1.749	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)C(=O)Nc1cccc(NC(=O)c2ccncc2)c1	764318127	AVEGEIGOYHBDOI-UHFFFAOYSA-N	435.415	1.802	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(NC(C)=O)c2)cc1Br	764326389	GQTYXLMLDNIIRU-UHFFFAOYSA-N	449.261	1.816	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)C(=O)Nc1cccc(OCCS(C)(=O)=O)c1)c1ccccc1	764329689	YHJVKDJSQKRCGY-GOSISDBHSA-N	447.513	1.390	50	20	IDGD	
C[C@H]1CCCC[C@@]12NC(=O)N(CC(=O)NNc1c(F)cc(C(=O)NC3CC3)cc1F)C2=O	764332070	BVDHGVIETJLUKW-WIUDPPPLSA-N	449.458	1.801	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)C(=O)Nc1cc(C(=O)N2CCCCC2)ccc1Cl	764354540	WJPAEEPJYNIREC-UHFFFAOYSA-N	443.891	1.690	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COCc2ccccc2)n(-c2ccc(F)cc2)n1	764368491	XDUKIRYJFQNPNP-UHFFFAOYSA-N	425.420	1.623	50	20	IDGD	
CCOC(=O)c1ccccc1NC(=O)C(=O)NNC(=O)c1cc(-c2cccs2)[nH]n1	764384743	KRCSNTOFRZKQPU-UHFFFAOYSA-N	427.442	1.715	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cc(C)nn3CCC#N)n[nH]2)cc1	764385303	WHXHRJLPJYXQIG-UHFFFAOYSA-N	434.460	1.457	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1cc(C(C)(C)C)nn1-c1ccccc1C	764399122	ZNPLRYWPILRXII-OAHLLOKOSA-N	445.520	1.616	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)[C@@H](C)S(=O)(=O)C1CCOCC1	764553095	QHHDRFYUHDRQSY-HUUCEWRRSA-N	434.514	1.737	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1ccn(-c2ccc(F)cc2F)n1	766466627	PNVWVPNWHZKCGV-UHFFFAOYSA-N	427.415	1.618	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)[C@@H](C(C)C)N2C(=O)c3ccccc3C2=O)cc1	766793031	OKQMIBZVXXZQBG-LJQANCHMSA-N	437.452	1.620	50	20	IDGD	
O=C(Cc1ccc(Cl)cc1)NNC(=O)c1ccc(N2C(=O)CCC2=O)c([N+](=O)[O-])c1	767439734	MJRSMJVBEDANSO-UHFFFAOYSA-N	430.804	1.905	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)NCCc3nnc4n3CCCCC4)nc21	770339860	FHKNDFWWZAAPJP-UHFFFAOYSA-N	428.501	1.474	50	20	IDGD	
COc1ccc(-n2nc(C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)cc2C)cc1	770718616	FNUFHCAPFKCZFY-UHFFFAOYSA-N	435.488	1.657	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3ccc(-c4nc[nH]n4)cc3)cc2)CC1	771432427	SSDHTGCNTGXFKH-UHFFFAOYSA-N	441.517	1.165	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(Cl)s1)NNc1ccnc(Br)c1	771535378	PRTDQHQTRVFQSL-UHFFFAOYSA-N	425.717	1.981	50	20	IDGD	
O=C(NNc1ccc(Br)c(F)c1)[C@@H]1CC(=O)N(CCN2CCOCC2)C1	771681261	IIDMHRANFVSWMN-GFCCVEGCSA-N	429.290	1.212	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)[C@H]1CCCCN1C(=O)c1ccc(O)nn1	772962379	ADYZJLFBQSGATB-MLGOLLRUSA-N	447.879	1.445	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccc(OCCN(C)C)cc1	774007582	CDICHKDGGJPOEE-CQSZACIVSA-N	448.907	1.834	50	20	IDGD	
O=C(Cc1cc[nH]n1)NNC(=O)Nc1ccc(OCCN2C(=O)c3ccccc3C2=O)cc1	775871130	FPJQPRWCNZGRKP-UHFFFAOYSA-N	448.439	1.480	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)Nc1ccc(Cl)cn1	775927145	GJIXFDGVEDBVDA-UHFFFAOYSA-N	439.881	1.222	50	20	IDGD	
COC(=O)Cn1cccc1C=NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	776187394	GNOHPZZKKYIOPR-UHFFFAOYSA-N	431.924	1.582	50	20	IDGD	
CCO[C@@H]1C[C@H](NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)[C@H]1Oc1ccccc1	776530982	JPUYAUSCPAJVFN-IPMKNSEASA-N	447.513	1.659	50	20	IDGD	
CC(=O)c1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c(C)nc1C	776724363	RVTJQKJAEOWFAK-UHFFFAOYSA-N	444.513	1.760	50	20	IDGD	
CC(=O)NCc1ccc(S(=O)(=O)NCC(=O)NNc2nc3ccccc3cc2C)s1	777478289	AIKKKJLLTAIKCQ-UHFFFAOYSA-N	447.542	1.662	50	20	IDGD	
COC(=O)c1ccccc1NNC(=O)c1cccc(S(=O)(=O)NC[C@@H]2CCCO2)c1	777774519	NDNPZIYJTQTNRB-HNNXBMFYSA-N	433.486	1.687	50	20	IDGD	
O=C([C@@H]1CCCCN1C(=O)c1ccco1)N1CCN(S(=O)(=O)CBr)CC1	777832590	NZZIIKNNRKJPIE-ZDUSSCGKSA-N	448.339	1.101	50	20	IDGD	
COC[C@@H](C)n1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)n1	778715462	XUBCWQDTPSBSOT-LLVKDONJSA-N	429.412	1.019	50	20	IDGD	
COc1ccc(Cn2nccc2NC(=O)NNC(=O)c2cc(C)[nH]n2)c(OC)c1OC	779462890	ZPARAZXMCBMCQJ-UHFFFAOYSA-N	429.437	1.455	50	20	IDGD	
O=[N+]([O-])c1ccccc1S(=O)(=O)N1CCN(S(=O)(=O)CCCCCl)CC1	780666462	IRKVJYDGVSUYOR-UHFFFAOYSA-N	425.916	1.250	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NNc2ccc(OC)cn2)o1	781537464	PLLVHZMACCHKIU-ZDUSSCGKSA-N	438.462	1.156	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)NCc1ccccc1CN1CC[C@@H](O)C1	781954200	LOJUUIQKQWQYKZ-CRAIPNDOSA-N	430.480	1.690	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CN2CCNC(=O)[C@H]2c2ccccc2C(F)(F)F)cc1	782102397	URJLQJYRPDHEOW-GOSISDBHSA-N	434.418	1.948	50	20	IDGD	
CC(=O)N1CCN(Cc2cccc(NC(=O)C(=O)NNc3ncccc3Cl)c2)CC1	782119098	ZSFMXHBKAGOYEM-UHFFFAOYSA-N	430.896	1.481	50	20	IDGD	
Cc1ccccc1NC(=O)NNC(=O)C(=O)Nc1cc(N2CCNC2=O)ccc1Cl	783417291	PHTRRZMVRVKARA-UHFFFAOYSA-N	430.852	1.969	50	20	IDGD	
CC(C)CC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)CNC(=O)c2cccs2)cc1	784004305	FIQHYTMIVKFMME-UHFFFAOYSA-N	445.501	1.249	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1ccccc1CCC(F)(F)F	784005398	YXFAWFDJKUYLFO-UHFFFAOYSA-N	442.419	1.759	50	20	IDGD	
C[C@H]1CN(C(=O)Cn2cc(NC(=O)C(=O)NNc3ccccc3Cl)cn2)C[C@H](C)O1	784780124	YZWDHPBBVFJLFN-STQMWFEESA-N	434.884	1.254	50	20	IDGD	
O=C(NNc1nc(-c2ccc(Cl)cc2)no1)C(=O)Nc1cnn(C[C@H]2CCCO2)c1	784799822	OROOTURTWWYNFF-CQSZACIVSA-N	431.840	1.847	50	20	IDGD	
CN(c1ccccc1NC(=O)C(=O)NNc1ccc(Br)nc1)S(C)(=O)=O	784809309	PKIRPAYKUZSCRJ-UHFFFAOYSA-N	442.295	1.322	50	20	IDGD	
CN1CCN(CCOc2ccc(NC(=O)C(=O)NNc3ncccc3Cl)cc2)CC1	784821406	QIIKMIOYESYCHV-UHFFFAOYSA-N	432.912	1.443	50	20	IDGD	
COC(=O)c1cccc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)NC(C)(C)C)c1	784833971	WCZXWQMFLOTAPR-UHFFFAOYSA-N	448.501	1.632	50	20	IDGD	
CCCCNS(=O)(=O)c1cccc(NC(=O)C(=O)NNc2ccc(Cl)nc2)c1	784871662	SWOHUQYOUKCFJI-UHFFFAOYSA-N	425.898	1.895	50	20	IDGD	
CCNC(=O)N(C)NC(=O)C(=O)Nc1ccc(C(=O)NCc2ccccn2)c(Cl)c1	784915252	HVMAKFAIVTVAQT-UHFFFAOYSA-N	432.868	1.296	50	20	IDGD	
CCNC(=O)N(C)NC(=O)C(=O)Nc1cc(NC(=O)CN2CCCC[C@@H]2C)ccc1F	784915831	PRBLVWJAIOZXJR-ZDUSSCGKSA-N	436.488	1.270	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)C(=O)Nc1ccc(F)cc1OCC1CC1	785060760	LTPOBFUBSBACAH-UHFFFAOYSA-N	425.420	1.591	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)C(=O)Nc1ccc(N2CCCC2)c(Cl)c1	785068226	WMFANQRHOWZMBO-UHFFFAOYSA-N	440.891	1.917	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1cnc(-c2ccccc2)nc1	785338429	LZEBEXUAXRUSPX-UHFFFAOYSA-N	441.469	1.638	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)Nc1cnc(N2CCN(C(=O)OC(C)(C)C)CC2)nc1	786181321	HDKIQBYZIGMIRV-UHFFFAOYSA-N	445.484	1.032	50	20	IDGD	
N#CCCn1cc(C=NNC(=O)c2csc(N3CCOCC3)n2)c(-c2ccncc2)n1	788420138	RNXXYJKZOKSCGQ-UHFFFAOYSA-N	436.501	1.916	50	20	IDGD	
O=C(NN=Cc1ccc(Cl)c(I)c1O)[C@H]1CCS(=O)(=O)C1	788708638	KPCFNYGGGWORAY-QMMMGPOBSA-N	442.662	1.535	50	20	IDGD	
CS(=O)(=O)Cc1nc2ccccc2n1CC(=O)NNC(=O)Cc1c[nH]c2ccccc12	789378091	NQFJQNNVJGCEOR-UHFFFAOYSA-N	439.497	1.452	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)cc1OC	789809666	DELDGRZFSYPJOF-LPHOPBHVSA-N	427.457	1.753	50	20	IDGD	
C[S@](=O)Cc1ccccc1NC(=O)C(=O)NNC(=O)[C@H]1OCC[C@H]1c1ccccc1	789812702	MNRBMYGBXZUOPN-WWYQSKBDSA-N	429.498	1.224	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)ccc1C(F)(F)F	790959295	GRVQCFLEOZXQEV-UHFFFAOYSA-N	435.362	1.690	50	20	IDGD	
Cc1cc(C(=O)N([C@@H]2CCS(=O)(=O)C2)N(C)C)ccc1NS(=O)(=O)C(F)(F)F	792847892	BNFJCBMJIFJMEB-GFCCVEGCSA-N	443.469	1.362	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNC(=O)[C@H]1CC(c2ccccc2[N+](=O)[O-])=NO1	794070611	BMTKPNREQZJSEU-QGZVFWFLSA-N	441.400	1.162	50	20	IDGD	
O=C(CNC(=O)c1ccc(Br)cc1)NNC(=O)c1ccc2c(c1)OCCO2	794416957	VUMKLLWNAXSVGE-UHFFFAOYSA-N	434.246	1.411	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C[C@H]1COCCN1C(=O)OC(C)(C)C	794787445	ILTAFUSWEASIFX-HIFRSBDPSA-N	425.457	1.766	50	20	IDGD	
Cc1c(Cl)cc(S(=O)(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1C(=O)O	794862698	CIKMTVFKMCBQDF-UHFFFAOYSA-N	446.890	1.373	50	20	IDGD	
CN(CCN1CCN(Cc2ccccc2)CC1)CC(=O)NNC(=O)c1ccc(C#N)cc1	796276751	RHRHPOZQEFSGRE-UHFFFAOYSA-N	434.544	1.069	50	20	IDGD	
Cc1c(NNC(=O)C(=O)Nc2cc(S(=O)(=O)N3CCCC3)ccn2)cccc1[N+](=O)[O-]	797068316	WBKSZIXRSRZWIB-UHFFFAOYSA-N	448.461	1.165	50	20	IDGD	
Cc1ccc(N2CCOCC2)cc1NC(=O)C(=O)NNC(=O)c1cccc(OC(F)F)c1	797535981	VDGCKAHPNRKWOS-UHFFFAOYSA-N	448.426	1.833	50	20	IDGD	
CNS(=O)(=O)c1ccccc1S(=O)(=O)NNC(=O)c1ccc(Cl)cc1Cl	799520402	YANWGINGSRDZSJ-UHFFFAOYSA-N	438.314	1.525	50	20	IDGD	
O=C(N=c1cc[nH]cc1)NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2F)c1	802027186	WBXXMDZOGZCLQZ-UHFFFAOYSA-N	429.433	1.910	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)[C@@H](C(C)C)N2CCCS2(=O)=O)c(OC)cc1Cl	802086319	VSNIPQOHHZACGG-OAHLLOKOSA-N	448.929	1.570	50	20	IDGD	
COc1ccc(Cl)c(NC(=O)NNC(=O)c2cc(S(N)(=O)=O)ccc2OC)c1	802115460	RTHPYZULBORASX-UHFFFAOYSA-N	428.854	1.471	50	20	IDGD	
COC(=O)c1ccccc1S(=O)(=O)N1CCC(C(=O)NNc2cccc(F)n2)CC1	804771122	HRNQYDGEVYBYRC-UHFFFAOYSA-N	436.465	1.551	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)c1nn(-c2ccccc2)cc1O)C1CN(C(=O)OC(C)(C)C)C1	806345840	BPRYCYBKELQIBP-CYBMUJFWSA-N	429.477	1.842	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)Nc2ccc(F)c(N3C(=O)CCC3=O)c2)c1	806744106	QCIONZYDUQKHII-UHFFFAOYSA-N	430.392	1.963	50	20	IDGD	
O=C1COC[C@@H](C[C@H]2CN(C(=O)C(=O)NNc3cccc(Cl)c3)c3ccccc32)N1	806984020	KPQZLNFWUIRYNP-XJKSGUPXSA-N	428.876	1.819	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNc2ncccc2F)cc(OC)c(OC)c1OC	807302198	YZLNQXVWJNGHHH-UHFFFAOYSA-N	436.396	1.505	50	20	IDGD	
Cc1cc([N+](=O)[O-])ccc1NNC(=O)C(=O)Nc1ccc2nc(N3CCOCC3)oc2c1	807456060	VFKCPJQKJHXIKQ-UHFFFAOYSA-N	440.416	1.963	50	20	IDGD	
CCO[C@@H]1CC(=NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)[C@@H]1SC	807944293	WDQZLCCGFZNHJD-SJORKVTESA-N	427.548	1.334	50	20	IDGD	
CCOC(=O)Nc1scnc1C(=O)OCC(=O)NNC(=O)c1ccc(Cl)cc1	808698454	DTKWIBXZOYKPOL-UHFFFAOYSA-N	426.838	1.983	50	20	IDGD	
Cn1nnc2c1C[C@@H](C(=O)NNC(=O)COc1ccc(-c3ccc(C#N)cc3)cc1)CC2	809940984	ULSRLJSCEVFKGN-SFHVURJKSA-N	430.468	1.685	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)OCc2cnn(C)n2)cc1	811048808	CONMYBGRARTBIP-DHDCSXOGSA-N	435.444	1.213	50	20	IDGD	
CC(=O)N1C[C@@H]2CCC[C@@H](NC(=O)NNc3nc(O)c4cnn(C(C)(C)C)c4n3)[C@H]2C1	812434767	UCVZCSWMBBZDKL-AEGPPILISA-N	430.513	1.560	50	20	IDGD	
CCn1ncc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)c1C(F)(F)F	813033133	GDUCHECKHUASPG-UHFFFAOYSA-N	448.427	1.254	50	20	IDGD	
CC(C)(C)OC(=O)N1CC([C@@H](F)C(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)C1	813508325	GAYFWHSLFMVUNG-CQSZACIVSA-N	442.875	1.309	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCc2nncn2C1)C(=O)Nc1ccc(CCCc2ccccc2)cc1	815692354	PCKIKXMNOVOCFR-IBGZPJMESA-N	446.511	1.802	50	20	IDGD	
CCS(=O)(=O)N[C@@H](CCSC)C(=O)NNC(=O)c1cc(-c2ccccc2)on1	819102824	ATYOWDZHLXXOGQ-ZDUSSCGKSA-N	426.520	1.164	50	20	IDGD	
CCOc1ccc(/C=C(/C#N)C(=O)OCC(=O)Nc2cccc(S(N)(=O)=O)c2)cc1	849205305	ZKLBMMPLBCTKSH-GDNBJRDFSA-N	429.454	1.822	50	20	IDGD	
O=C(COC(=O)[C@@H](NC(=O)c1ccco1)c1ccccc1)NNC(=O)c1cccs1	905575358	AKAIORFASLKVMT-KRWDZBQOSA-N	427.438	1.817	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(/C#N)C(=O)N2CCN(S(=O)(=O)N(C)C)CC2)c1C	914504180	QTAWIFHCUHPVIV-JJBLJPBOSA-N	437.566	1.170	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(OC)c(C(=O)NNC(=O)c2cccc(N(C)C)c2)c1	915059825	XNNLJUWHGNZCTN-UHFFFAOYSA-N	448.545	1.867	50	20	IDGD	
C[C@H]1CN(CCCNC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)C[C@H](C)O1	916249887	QJLQKNNAKYTTLW-PMACEKPBSA-N	446.596	1.028	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NN=C2C(=O)Nc3ccc(OC)cc32)c1	916260728	BCGQHEXONNNBNM-UHFFFAOYSA-N	430.486	1.812	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)NC2CCN(C(=O)c3ccccc3F)CC2)cc1	916379774	OMTOXJZPIZBWHN-UHFFFAOYSA-N	439.447	1.711	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCCC(=O)NNC(=O)c2ccc(Cl)nc2)cc1	917248827	GBWMFOSIZSETRX-UHFFFAOYSA-N	426.882	1.263	50	20	IDGD	
N#Cc1ccc(S(=O)(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c(C(F)(F)F)c1	917716829	DVYRYXCRLZFWSK-AWEZNQCLSA-N	427.360	1.727	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CCc2nc(O)c3cnn(-c4ccccc4)c3n2)c(O)c1	918341409	URWXYQGHVNJOFU-UHFFFAOYSA-N	432.440	1.929	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)c1ccc(C)cc1)C(=O)NNC(=O)CC(F)(F)F	918363754	CHNKKQOOKCMXAN-LBPRGKRZSA-N	427.470	1.495	50	20	IDGD	
Cc1c(/C=C(\C#N)C(=O)NCc2ccc(C(=O)N3CCN(C)CC3)cc2)cc(C#N)n1C	918580306	NNSREWYKOBEDGX-CIAFOILYSA-N	430.512	1.816	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)NCc1ccn(-c2ccccc2)n1	919658826	MUJMHSBNRWGMAV-UHFFFAOYSA-N	447.543	1.915	50	20	IDGD	
CC(=O)Nc1cc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)ccc1F	919691819	BCJCRIZEZDYVBH-UHFFFAOYSA-N	448.476	1.643	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)Nc2cnn(CC(=O)NC3CC3)c2)N(C)c2ccccc21	919849937	PGARXAAEJFJZSM-UHFFFAOYSA-N	447.499	1.771	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccc(=O)n(CC)c2)c1	920929352	NKXQORVEQVUWEC-UHFFFAOYSA-N	435.506	1.365	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CS[C@H](Cc2ccccc2F)C(=O)N1)c1cccc([N+](=O)[O-])c1	935812234	ICUFFJRRLOKURZ-JKSUJKDBSA-N	432.433	1.338	50	20	IDGD	
Nc1cnnc(NNC(=O)c2cc(S(=O)(=O)N3CCCC3)ccc2Cl)c1Cl	1319406002	JSUVQWBASRPVPZ-UHFFFAOYSA-N	431.305	1.907	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)N[C@H]1CCO[C@@]2(CCS(=O)(=O)C2)C1	1324924266	NMTCVEYGCDOXNO-SJCJKPOMSA-N	431.898	1.029	50	20	IDGD	
CN(C)[C@@H]1CCCC[C@@H]1NC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	1327831557	IJAKCAAAXTXNDZ-ZWKOTPCHSA-N	437.566	1.288	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@H]2CCOC3(CCOCC3)C2)c2ccccc2c1=O	1349004262	IWALWNRSMGHLAD-AWEZNQCLSA-N	429.477	1.089	50	20	IDGD	
CO[C@@H]1C[C@H](CO[Si](c2ccccc2)(c2ccccc2)C(C)(C)C)[C@@H](O)[C@H](O)[C@H]1O	1772820655	BZXXFGFXPPQZBP-OPHUTGBKSA-N	430.617	1.681	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CO[Si](C)(C)C)C1)C1(O)CCC1	1779538743	GRTIOIRJSGFXKF-MBOZVWFJSA-N	426.630	1.903	50	20	IDGD	
O=C(c1csc(C(F)(F)F)n1)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1779754351	JFSUZZCJHWANHH-HZMBPMFUSA-N	427.832	1.205	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Cl)CCO2	1780097710	FSWZUOXWHMBSBI-QAPCUYQASA-N	443.815	1.498	50	20	IDGD	
C/C=C(/C)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1	1780098072	AXKCHKYTMQXDNV-FMOCQCRYSA-N	431.445	1.930	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](O)CCNC(=O)OC(C)(C)C)C2)C1	1781340920	UBBUHRDPTLELDJ-AVYPCKFXSA-N	447.960	1.109	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2)[C@H]1CCc2ccccc2O1	1782146550	HBGQBKNPEMWTJI-OSGXGRJZSA-N	436.936	1.494	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](O)Cc3ccccc3)C2)C1	1783342046	ZVBWCBGYQVYZBA-FFZOFVMBSA-N	429.344	1.656	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)CCc3cnccn3)CCO2)C1	1783354307	PGCKWGNJBMGURX-MAUKXSAKSA-N	425.327	1.413	50	20	IDGD	
COc1cc(OC)cc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](C)Br)C3)C2)c1	1783538810	XPPHEYSQNFFKBU-DJJJIMSYSA-N	441.322	1.931	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](C)Br)C2)C1	1783539899	OUQITABOCFUYRD-SUNKGSAMSA-N	426.149	1.773	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccn(-c4ccccc4)n3)CCO2)C1	1783880621	FAOKEIJBWVXNMO-DYESRHJHSA-N	432.908	1.570	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)C3CCC4(CC3)OCCO4)CCO2)C1	1783881397	LCDJLMQSXBJBIA-VQIMIIECSA-N	430.929	1.003	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN3CCCCC3)C[C@@H]21	1783967648	HTUHVRYWOWRLRM-QZWWFDLISA-N	430.387	1.483	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/c3cnc[nH]3)C[C@@H]21	1783974825	VMRPUKYUPWUBHW-JKMKLXDYSA-N	425.327	1.434	50	20	IDGD	
CC(C)Oc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]3C2)cc1C#N	1784095339	BHNFALIZYHDFSR-CAIZAGQASA-N	449.935	1.538	50	20	IDGD	
CC[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)N(CC)CC	1784630683	VTBHSNKEBXMZPU-UVPYHEFZSA-N	436.366	1.777	50	20	IDGD	
CN(CCCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Cl)CCO2)C(=O)OC(C)(C)C	1785585360	BMVXCSLTXOQWCB-BEFAXECRSA-N	435.924	1.998	50	20	IDGD	
C[C@@H](C(=O)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1)n1ccnc1	1786231196	FAPBWLYIHFCMBK-INIZCTEOSA-N	432.289	1.572	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(=O)cco3)[C@H]2C1	1786281937	XGTVUEUKPQLHLL-DSPQJCBJSA-N	427.295	1.264	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/C3CCCCC3)C[C@@H]21)c1ccc(B(O)O)cc1	1786981933	QPRNQYBQUIHCDV-KDEIEAFCSA-N	440.349	1.096	50	20	IDGD	
Cc1cc(NC(=O)CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)C(C)(C)CCl)C[C@@H]32)no1	1787489369	GMECJQLJPLXRQY-KKUMJFAQSA-N	440.928	1.556	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CC[S@@](=O)CC)[C@H]2C1	1788490375	BPSFLEPAIQSSBH-ZHKNHGQWSA-N	437.400	1.298	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(COC)c[nH]3)[C@H]2C1	1789212828	FCAVQTWDBMQOBD-JKQORVJESA-N	442.354	1.928	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21	1790607991	URWVRJHVMRPXBR-RFGFWPKPSA-N	435.315	1.313	50	20	IDGD	
CCC(=O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C[C@@H]21	1790817105	MHIIJTHENKWCJZ-AXHNFQJDSA-N	447.444	1.093	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc4nccn34)C[C@@H]21	1791063883	VSSDSYYLCMZQGJ-YXWQFLTLSA-N	435.322	1.711	50	20	IDGD	
CSCC[C@@H](O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]21	1791308225	WUJIPAACCANXMK-JEJJNBGPSA-N	427.394	1.316	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)Cn3ccnc3)[C@H]2C1	1791625409	SSDNRSZRWJIZQC-NRKLIOEPSA-N	441.370	1.530	50	20	IDGD	
Cc1nccn1[C@@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21	1791704988	QNUNHYHYCSVIHA-MFGQWXODSA-N	431.306	1.423	50	20	IDGD	
Cc1nc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)CBr)sc1C	1792872353	AVRUQXIDBNAHSX-WBMYTEFPSA-N	430.368	1.994	50	20	IDGD	
O=C(/C=C/c1ccc([N+](=O)[O-])o1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2	1793108505	AGFUGLGGFOYRDF-OBCQIGCLSA-N	446.229	1.481	50	20	IDGD	
O=C(Cn1ccc2ccc([N+](=O)[O-])cc21)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2	1793212070	RREDWYQHRVNRDG-GGNLRSJOSA-N	438.843	1.674	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnc(N(C)C)o1	1794603145	WZDOKMZUYDBUEJ-OPDFLTKYSA-N	429.315	1.117	50	20	IDGD	
CC(C)(C)n1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCBr)n1	1795111446	OLCUVYYKSWMYPJ-YWVIFJGQSA-N	427.343	1.626	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1COc3ccccc3O1)C2	1795111456	PCJGPQCQKJDIAU-ZDFLXESQSA-N	439.306	1.201	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)COc1ccccc1	1795584280	USMLXCWRCJHCTM-ADDUXVCJSA-N	437.500	1.838	50	20	IDGD	
CC(C)(C)OC(=O)NCC1(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Cl)CC1	1796361802	UPOXUCYCEIUSSX-XJFOESAGSA-N	433.908	1.415	50	20	IDGD	
COc1ccc(C(=O)CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Cl)cc1	1796362885	NBBTXFPRADOYNI-FTUNRGFVSA-N	426.872	1.782	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](Br)Cc1ccccc1)C2)c1cn[nH]c1	1796573966	KWSQRLRADYNDKZ-MHORFTMASA-N	447.333	1.619	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2)c1ccc2c(c1)OCO2	1796784612	VKXCJFBLZLKCKK-FVCICTRLSA-N	425.279	1.404	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CS[C@H]1CCCCO1	1797791717	QGNYPAWZXXEMGV-QZLJAVCYSA-N	449.411	1.867	50	20	IDGD	
CCn1nc(C(C)C)cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2	1798740047	LOKVWYRTEKOEGS-VZAMPYOESA-N	445.333	1.920	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccc(C(=O)OC)s1	1799047500	KVNUHCFCCDVFSX-IFOZYUSPSA-N	428.938	1.684	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc3c(c1)CCC3)C2)[C@@H](F)Br	1799344712	SJJTZFDTNORSDE-UKBAYJJMSA-N	439.325	1.998	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cccc(Cl)n1)C2)[C@H](F)Br	1799344817	WBYONCXDDUDLEZ-OWLDWWDNSA-N	434.693	1.558	50	20	IDGD	
CSc1ncccc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Br	1799348914	SAIDMWSSPHHMJK-LFSVMHDDSA-N	432.315	1.697	50	20	IDGD	
Cc1nc2sccn2c1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Br	1799350379	XXOSOVSBGBQUSW-NOHGZBONSA-N	445.314	1.598	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1ccc(C(=O)OC)s1	1799808496	KNHYISGPJCPXJI-XFMPKHEZSA-N	428.938	1.969	50	20	IDGD	
CN(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccon1)C2)NC(=O)NCc1ccccc1	1799864985	VYZJVJOLENQRSI-BCDXTJNWSA-N	440.504	1.273	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1n[nH]c3c1CS(=O)(=O)C3)C2	1800078660	GLHMFWVLDOOEHL-WMEBDMIVSA-N	449.360	1.326	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ncccn1)C2	1800332391	GRGRAMBMBARATK-SQABCVSLSA-N	439.422	1.565	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc3[nH]ncc13)C2	1800639991	RJDHZKURWGJMCY-RBNVPPIJSA-N	435.322	1.940	50	20	IDGD	
CCOC(=O)C(C)(C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](Br)CC	1800645080	SEVHUTREYGIAMZ-CRWXNKLISA-N	433.343	1.339	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COc1cc(Cl)ccn1)C2	1800759021	DPFSMZXALLRQRV-LSSIXWDNSA-N	446.729	1.487	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCc1cccc(O)c1	1801121570	LUEZCPOGAHSUGL-AMVTXUCVSA-N	439.350	1.945	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCc1cnc2[nH]ccc2c1)c1cccc(B(O)O)c1	1802095315	YIXLAKYYWZSXNY-WKCHPHFGSA-N	446.316	1.127	50	20	IDGD	
COC[C@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H]1CN(Cc3ccccc3)CCO1)C2	1802274384	WUNUPIOHXYJECV-SSTJLMRISA-N	449.979	1.779	50	20	IDGD	
O=C(/C=C/c1ccoc1)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1804314690	YLLWLEAJJHJYCB-UTKZXYPPSA-N	445.284	1.387	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)CN2CCCC2=O)[C@H]1c1cccnc1	1806926348	QOJCQXGGOIIWMN-JCKWVBRZSA-N	437.338	1.493	50	20	IDGD	
O=C([C@H](F)Cl)N1CCC2(CCCN(C(=O)[C@@H]3CCc4nc(O)nc(O)c4C3)C2)CC1	1807088324	HFVWTMQOWSATAQ-DOMZBBRYSA-N	440.903	1.758	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)COC(=O)C(F)(F)F)[C@H]1c1cccnc1)[C@H](F)Cl	1808313613	INDYPEPFHIVTTP-DRZSPHRISA-N	425.766	1.727	50	20	IDGD	
CC(=O)N/C(C)=C/C(=O)N1CC[C@H](CNC(=O)[C@@H](F)Br)[C@H]1c1cccnc1	1808678017	FBRCYWXLKJIRLY-RWKZSZBOSA-N	441.301	1.818	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)c1cn2ccccc2n1	1809048450	PRRHGCDSMCMRPL-IEZWGBDMSA-N	427.892	1.649	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2nc3ncccn3n2)[C@@H]1c1cccnc1	1809230131	IPZRGFWPEYDTJW-PMPSAXMXSA-N	427.896	1.856	50	20	IDGD	
CC1=CC[C@H](C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)CC1	1809479242	WHDWOXQZQQQRND-AVCGJXAMSA-N	447.344	1.827	50	20	IDGD	
Cc1cc(C(=O)N2CCC3(CCCN(C(=O)c4ccc(B(O)O)cc4)C3)CC2)c(C)n1C	1809970892	CYHCUTXOGKUVKZ-UHFFFAOYSA-N	437.349	1.480	50	20	IDGD	
C[C@H](Cc1ccncc1)C(=O)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1	1809974343	UOOINPMVTWSDFC-LJQANCHMSA-N	449.360	1.485	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)c2ccncc2)[C@@H]1c1cccnc1	1810299174	NXFKWJNDXRGWRY-FXAWDEMLSA-N	445.483	1.109	50	20	IDGD	
C[C@@H]1C[C@]1(C)C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1	1810305328	KBSHRZREMXGMRM-XVRCHWGISA-N	436.516	1.446	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC2(CCCN(C(=O)c3cccc4[nH]ncc34)C2)CC1	1810589305	NHKQXANAUMNRHP-UHFFFAOYSA-N	440.548	1.781	50	20	IDGD	
Cc1nc(C(=O)N2CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)co1	1813071804	XRSCNFVUIOBHAM-UZLBHIALSA-N	428.493	1.071	50	20	IDGD	
C[C@H](C(=O)NC[C@@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1)n1cncn1	1813400085	KVWBHSRXQXYKQT-KMFMINBZSA-N	435.326	1.725	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)C1=CCCS1	1815268674	GWEYUFJWTZBHHE-MRXNPFEDSA-N	426.307	1.416	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@H]1C[C@@H]1C1CC1)CC2)c1ccc(B(O)O)cc1	1815335824	SVULANUYSJUHKY-OAGGEKHMSA-N	425.319	1.095	50	20	IDGD	
COc1ncccc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1	1817473040	APFNCRPZIAWHMR-GOSISDBHSA-N	449.276	1.113	50	20	IDGD	
Cc1ccncc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1	1818340132	WTQZJMFOCYJGTP-KRWDZBQOSA-N	427.509	1.792	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](Cl)COC)CC2	1819694964	MYPYAJUXROFJDL-GMTAPVOTSA-N	431.946	1.017	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2nc3ncccn3n2)[nH]n1	1822187459	VIPQLGFTSKIPFC-PWSUYJOCSA-N	447.297	1.937	50	20	IDGD	
CCc1ccc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2ccc(B(O)O)cc2)CC3)cc1	1822287392	ITGPMVBADFKYLK-GOSISDBHSA-N	449.341	1.925	50	20	IDGD	
COCCn1ccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)[C@H](Cl)COC)n[nH]2)n1	1822370233	SOHBOTYNWUQDJO-CJNGLKHVSA-N	438.916	1.812	50	20	IDGD	
Cc1cncc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)c1	1822412697	FGJUAGMOHXACNQ-KRWDZBQOSA-N	427.509	1.792	50	20	IDGD	
C[C@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](F)Br)[nH]n1)n1cnnn1	1822858835	AFDQWJAJXJEPRA-QRTLGDNMSA-N	429.254	1.340	50	20	IDGD	
CN[C@H](CC(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](C)CBr)CC1)C(=O)O	1824092718	GYXVNMGURQFIJN-IMJJTQAJSA-N	446.386	1.700	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCN1CCOCC1)CC2	1825641003	GHOPKHWCEWVXHL-VXGBXAGGSA-N	445.383	1.561	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)CCCn3ccnc3)sc2C1	1826690464	KXXFUHYMOKYQRH-OLZOCXBDSA-N	425.942	1.986	50	20	IDGD	
CNc1ccc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)cc1	1827055292	XBYPNDJJTPRAPH-QHCPKHFHSA-N	449.360	1.955	50	20	IDGD	
Cn1c(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)cc2ccccc21	1830433281	MGAIGLORHXDGCG-TZIWHRDSSA-N	437.899	1.712	50	20	IDGD	
CC(C)(C)c1ncccc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1830722476	CELDUYJNDJNNPO-HRAATJIYSA-N	439.940	1.049	50	20	IDGD	
CC(C)[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1)c1ccccc1	1830838396	QFIOTHSDNHWSKD-CNNODRBYSA-N	438.952	1.482	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccnc2S)CC1	1831869161	BACLAZMRMUFHIN-GOSISDBHSA-N	447.605	1.977	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(F)(F)C(F)F)CCO2	1832194012	WCPUPLQOPHSVTE-IINYFYTJSA-N	449.239	1.517	50	20	IDGD	
CCn1nccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1	1834418090	CNPTXSIMFUNQDR-ROUUACIJSA-N	433.336	1.209	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1)c1cc(O)n[nH]1	1834769698	GLNRWGGANWGXPE-UHFFFAOYSA-N	428.331	1.086	50	20	IDGD	
O=C(CCOc1ccccc1)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1834833762	RRSJJADYHVKNJA-IBGZPJMESA-N	431.316	1.716	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)Cc3nc(C)no3)CC2)CC1	1834848805	BPVOBVUVTNMFMA-KRWDZBQOSA-N	425.961	1.900	50	20	IDGD	
Cn1ccc(=O)cc1C(=O)NC1CCN(C2CCN(C(=O)C(C)(C)CCl)CC2)CC1	1836107682	WMZDJVWASPVEQT-UHFFFAOYSA-N	436.984	1.836	50	20	IDGD	
CCn1nc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)c2ccccc21	1836342704	FNGAZJLUMXIVHG-PXNSSMCTSA-N	438.887	1.661	50	20	IDGD	
O=C(c1c(O)cc(O)cc1O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836717722	IAPZEOKRGZVXOG-KRWDZBQOSA-N	442.896	1.015	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)C#CC3(O)CCCCC3)CCO2)C1	1837486348	BYOSRVMIDNEKNJ-PGRDOPGGSA-N	440.968	1.549	50	20	IDGD	
CC(C)O[C@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1	1837601911	HGVJPNKMOMZGMI-OLMNPRSZSA-N	425.353	1.493	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc([N+](=O)[O-])o3)C2)C1	1837709071	UUSWSPWWWLKYDF-GOSISDBHSA-N	441.513	1.109	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)C[C@H]3CCCCO3)C2)C1	1837709934	BBRSAMGPPIULQA-XLIONFOSSA-N	428.602	1.254	50	20	IDGD	
O=C(c1cc[n+]([O-])cc1)N1CCC(OC2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1838508909	UNKPHBAYBBJRSX-MRXNPFEDSA-N	444.301	1.623	50	20	IDGD	
CCc1ncccc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2	1839150890	AWOUHZKJCAIVGP-VQTJNVASSA-N	444.359	1.950	50	20	IDGD	
Cc1nc(F)ccc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839200074	DBJWYNBJDPQVAR-RHSMWYFYSA-N	448.264	1.290	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)cc1O	1839267956	OKFPHDFPOSKRQN-AUUYWEPGSA-N	441.322	1.554	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(C)ccc3F)CCO2)C1	1839314084	QBIBBQQVXBRUQS-OXQOHEQNSA-N	428.888	1.458	50	20	IDGD	
Cc1cc(C#N)cc(C(=O)N2CCO[C@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)c1	1839454159	XHJLBOXZGGIFIZ-LJQANCHMSA-N	426.300	1.740	50	20	IDGD	
COc1ccccc1CC(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1839952812	WMAFHHCZZWVVGP-QFIPXVFZSA-N	438.952	1.959	50	20	IDGD	
O=C(Cc1cccc(F)c1F)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1839983227	WPEGSNAYDPSZRW-SFHVURJKSA-N	437.270	1.767	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)COc2ccccc2C)C1	1842746246	LSCYJFJDRWECKQ-KOEQRZSOSA-N	437.500	1.711	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)CNc2ccccc2C)C1	1842986381	RGKVYJZAMUJSHL-YZSQISJMSA-N	436.516	1.744	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)[C@@]2(F)CCCCC2(F)F)C1	1843893001	UAQQXOXGGIIOGO-IBGZPJMESA-N	439.438	1.420	50	20	IDGD	
CN(CC(=O)N1CCCC12CN(C(=O)c1ccn(C)c1)C2)NC(=O)NCc1ccccc1	1845038443	CJNXMZMAPOCJHB-UHFFFAOYSA-N	438.532	1.188	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2	1845166262	LAPBEPBTTQKVDB-QGZVFWFLSA-N	435.956	1.553	50	20	IDGD	
CN1C(=O)CC[C@H]1C(=O)N1CCCC12CN(C(=O)[C@@H](Br)Cc1ccccc1)C2	1845239005	PFCGBIJDJRIAPG-IRXDYDNUSA-N	448.361	1.817	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC12CN(C(=O)c1ccc(N3C(=O)C=CC3=O)cc1)C2	1846179934	FEKNGDHYDFRDCN-CYBMUJFWSA-N	446.301	1.716	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1ccc(Cl)cc1F	1847353882	KPBZNMRIUZHERS-IRXDYDNUSA-N	431.855	1.607	50	20	IDGD	
Cc1ccc(-c2n[nH]c(=S)n2CC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1	17193306	UHJBDRGCDIXSNK-UHFFFAOYSA-N	449.496	1.624	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc2c1O[C@@H](C)C2	26535077	ICZWFMREXZINCM-VIFPVBQESA-N	439.877	1.394	50	20	IDGD	
CCOC(=O)C1=NN(c2ccccc2)[C@@H](C(=O)NNC(=O)[C@H]2COc3ccccc3O2)C1	110673699	FVJBHVGDODNWLT-VQIMIIECSA-N	438.440	1.172	50	20	IDGD	
O=C(CN1C(=O)N[C@]2(CCc3ccccc32)C1=O)NNC(=O)C12CC3CC(CC(C3)C1)C2	196398654	WGYZZRTZFJXEHW-FACINGSZSA-N	436.512	1.744	50	20	IDGD	
CC(C)[C@@H](NC(=O)NNC(=O)CNC(=O)c1cccs1)c1ccc2c(c1)OCCO2	725871752	KXKQHWCOCLVZIR-GOSISDBHSA-N	432.502	1.977	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)NC[C@@H](O)COc2ccc3c(c2)OCO3)c1C	725890577	RXZKUULHANYDEV-PMEBHBLGSA-N	441.484	1.943	50	20	IDGD	
C[C@@]1(C2CC2)NC(=O)N(CC(=O)NNC(=O)c2ccc(Br)cc2Cl)C1=O	728832572	NRKGWFCKXCWPCI-INIZCTEOSA-N	443.685	1.584	50	20	IDGD	
C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	728846197	MZPYLSUJWUOWIR-LBPRGKRZSA-N	448.867	1.870	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)COc1ccc(Br)cc1)[C@@H](C)N1CCOCC1	729624504	XIWHDWIANWLHMP-QWHCGFSZSA-N	429.315	1.268	50	20	IDGD	
CC(CCN1C(=O)c2ccccc2C1=O)=NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	730946318	PSPYOYFILFLTFH-UHFFFAOYSA-N	442.497	1.729	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)NCc1ccc(C(=O)N2CCN(C)CC2)cc1	731499437	WBTIHABOMDZKDC-UHFFFAOYSA-N	425.489	1.227	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])o1	732050091	LQRVYFJVTHQLQJ-LBPRGKRZSA-N	432.389	1.027	50	20	IDGD	
CNS(=O)(=O)c1cccc([C@H](C)NC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c1	733647547	GFLAKQRQSSAECR-AWEZNQCLSA-N	442.501	1.486	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2ccccc2OCC2CC2)CC1	735118445	VOEKUOCYPABQIE-UHFFFAOYSA-N	445.545	1.563	50	20	IDGD	
O=C(COC1CCOCC1)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	735270906	YUMJBTRUPDOKPD-UHFFFAOYSA-N	436.472	1.345	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)c2cccc(NS(C)(=O)=O)c2)cc1C	736736018	SJZJYASWLTXVNE-UHFFFAOYSA-N	439.515	1.608	50	20	IDGD	
O=C(Cc1ccc(S(=O)(=O)C(F)F)cc1)NNC(=O)[C@H]1COc2ccccc2O1	740633349	BEIMHBCJCYLSOE-OAHLLOKOSA-N	426.397	1.213	50	20	IDGD	
Cc1c(C(=O)NNC(=O)C(F)(F)Oc2ccccc2)nnn1-c1cccc([N+](=O)[O-])c1	741596884	DZBNTNQWSGRIEF-UHFFFAOYSA-N	432.343	1.917	50	20	IDGD	
CC(C)c1ccc(N2CC[C@@H](C(=O)NNC(=O)CNC(=O)c3cccs3)C2=O)cc1	741684609	IXSFWZIAYCAMIL-INIZCTEOSA-N	428.514	1.802	50	20	IDGD	
COCCS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cccc(Br)c2)cc1	742772215	SPEBYWFCTTVCQZ-UHFFFAOYSA-N	441.303	1.944	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@H]2CCCN(Cc3ccccc3)C2)c1	742774299	IMTKIQWBQBJIIE-GOSISDBHSA-N	444.557	1.946	50	20	IDGD	
Cc1nn(C)c2sc(C(=O)NNc3ccc(S(=O)(=O)N4CCN(C)CC4)cc3)cc12	743334963	PHRORXXJOVJKIX-UHFFFAOYSA-N	448.574	1.636	50	20	IDGD	
C[C@H]1CN(Cc2cccc(CNC(=O)NNC(=O)c3cc([N+](=O)[O-])ccc3O)c2)CCO1	745775317	DIZZBNYUUUUQKV-AWEZNQCLSA-N	443.460	1.665	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)[C@@H]1CCCN1Cc1ccccn1	746092575	XNEASDAVLXOPAN-QFIPXVFZSA-N	436.560	1.406	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)NCC(=O)Oc2ccc([N+](=O)[O-])cc2OC)cc1	746192801	AVEDCUAODOQFAO-UHFFFAOYSA-N	438.414	1.664	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)CSc2nc(-c3ccc(C)cc3)n[nH]2)c1	746301324	LKNUPDNFESIDDY-UHFFFAOYSA-N	425.474	1.687	50	20	IDGD	
COc1cc(C)nc(NNC(=O)c2sccc2S(=O)(=O)N2CCSCC2)n1	746627866	PSEXJGHTYAUFKK-UHFFFAOYSA-N	429.549	1.350	50	20	IDGD	
C[C@@H]1CCCCN1C(=O)CN1CCN(C(=O)NNC(=O)CCOc2ccccc2)CC1	747108256	QYGKIAUYWFRGES-GOSISDBHSA-N	431.537	1.215	50	20	IDGD	
CCOc1cc(C#N)cc(Br)c1OCC(=O)NNC(=O)Cc1ccncc1	747322612	FIZCJQOKTFQDFC-UHFFFAOYSA-N	433.262	1.883	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)c1cccc(CS(N)(=O)=O)c1	749400365	GAKIDJDYDKALNJ-AWEZNQCLSA-N	427.482	1.857	50	20	IDGD	
C[C@H](Sc1ccnc2cc(Cl)ccc12)C(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1	749874244	MODAEBPTNCUQIP-QWRGUYRKSA-N	427.935	1.951	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)N[C@H]2CC(=O)N(C(C)(C)C)C2)c2ccccc2c1=O	750659706	LFUMTHFOHWPDCS-AWEZNQCLSA-N	442.520	1.540	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1c[nH]nc1-c1ccc2c(c1)OCO2	752002580	JJOZHQMEUPEBKU-UHFFFAOYSA-N	435.444	1.273	50	20	IDGD	
COc1ccc([C@H]2[C@H](C(=O)NNC(=O)CO)CCC(=O)N2c2ccc(OC)cc2)cc1	753442959	QRASEBHCPMXTIX-NQIIRXRSSA-N	427.457	1.328	50	20	IDGD	
CSCC[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)NNc1cc(Cl)nc(N)n1	753458235	XVBDIUNLDASTMS-NSHDSACASA-N	439.885	1.615	50	20	IDGD	
CS(=O)(=O)c1cc(Br)cc(C(=O)NNc2cc(Cl)nc(N)n2)c1F	753464119	LFMPSQPTBJDBIU-UHFFFAOYSA-N	438.666	1.774	50	20	IDGD	
CN(C)C(=O)c1ccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1	755446535	VPGOORINNQJOIB-UHFFFAOYSA-N	433.490	1.105	50	20	IDGD	
CN1CCN(C(=O)c2ccccc2NC(=O)NNC(=O)c2ccc(Cl)cc2O)CC1	755622778	KFEZLANWEVSHDJ-UHFFFAOYSA-N	431.880	1.900	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2cc(Br)ccc2O)cn1	755906633	WELCBZJHDBCGOT-UHFFFAOYSA-N	429.252	1.420	50	20	IDGD	
C[S@@](=O)c1cccc(NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c1	756527466	SKRQGCQUARUQLW-SSEXGKCCSA-N	429.546	1.789	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCC[C@H]2C(=O)OCc2ccccc2)cc1OC	756533978	XHGRJJNJKHBVBK-SFHVURJKSA-N	441.484	1.673	50	20	IDGD	
CC(=O)N(Cc1ccc(NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1)C1CC1	756660714	OQLXNDXRXVMENR-UHFFFAOYSA-N	448.483	1.911	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(F)(F)[C@@H](C(=O)NNC(=O)[C@H]2COc3ccccc3O2)C1	757758312	AKBSUPQVGZIBDJ-IUODEOHRSA-N	441.431	1.866	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)Nc2ccc(-n3ncn(C)c3=O)cc2)cc1OC	757863684	TYRTUKAHUGMEBZ-UHFFFAOYSA-N	440.460	1.835	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)c2ccc(Br)cc2-n2cncn2)c1	760124020	YUSWGMOFIONPLP-UHFFFAOYSA-N	445.277	1.912	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccnn2[C@H](C)C2CC2)cc1	760277445	LHDNGKWJCSMEJB-TZMCWYRMSA-N	427.461	1.610	50	20	IDGD	
Cn1cnnc1-c1cccc(NC(=O)C(=O)NNC(=O)c2cc3ccccc3cc2O)c1	763523549	TZYLQGZSXKUIAV-UHFFFAOYSA-N	430.424	1.741	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)C(=O)Nc1ccc2c(c1)OC1(CCCC1)O2	763548541	MPESANABRVWAIE-UHFFFAOYSA-N	425.397	1.857	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(OCCN(C)C)cc2)cc1OC	763552168	WKJCJTKYAFQYAQ-UHFFFAOYSA-N	430.461	1.044	50	20	IDGD	
CC(C)(C)NC(=O)c1cccc(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1	763571261	KXZKMFQPDVBPFW-QGZVFWFLSA-N	440.456	1.141	50	20	IDGD	
COC(=O)N(C)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2OC)cc1	763656589	DELVPTJKERJZNH-UHFFFAOYSA-N	430.417	1.063	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc2c(cc1F)CCC(=O)N2	763682216	PMMHHDNUFYSGQH-UHFFFAOYSA-N	444.419	1.274	50	20	IDGD	
Cc1cc(C)n(-c2ccc(NC(=O)C(=O)NNC(=O)COc3ccc(Cl)cc3)cn2)n1	763686051	JXQVJKUJHRVMKD-UHFFFAOYSA-N	442.863	1.702	50	20	IDGD	
CCc1cc(O)nc(-c2cccc(NC(=O)C(=O)NNC(=O)c3cccc(N(C)C)c3)c2)n1	763757104	CBIOLGAKPRHDKG-UHFFFAOYSA-N	448.483	1.877	50	20	IDGD	
CC[C@H](C)n1nc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(C(C)=O)cc2)cc1C	763879559	YHQFXRULMNGKJQ-SWLSCSKDSA-N	429.477	1.919	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(CNC(C)=O)cc2)cc1OC	763902626	NPGGRIZKHUOHLW-UHFFFAOYSA-N	428.445	1.130	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3cccc([C@H]4CNC(=O)C4)c3)cc2C1	763944221	XXPSEQICTMSBHZ-IUODEOHRSA-N	440.525	1.876	50	20	IDGD	
COC(=O)c1ccc(N2CCCC2)c(NC(=O)C(=O)NNC(=O)c2ccc(Cl)nc2)c1	764101418	QQONUIRERWKXEB-UHFFFAOYSA-N	445.863	1.522	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2ccc(C)c(NS(C)(=O)=O)c2)cc1	764127349	SFILSZKNWLJMQL-UHFFFAOYSA-N	448.501	1.094	50	20	IDGD	
O=C(NNC(=O)c1ccoc1)C(=O)Nc1ccc(Cl)cc1I	764159588	YSSIZXDUMFLSHY-UHFFFAOYSA-N	433.589	1.937	50	20	IDGD	
COc1cccc(-c2nsc(NC(=O)C(=O)NNC(=O)[C@@H]3Cc4ccccc4O3)n2)c1	764167033	HRCQEEJIHAQPAI-HNNXBMFYSA-N	439.453	1.303	50	20	IDGD	
CN(C)C(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(OC(F)F)c2)cc1	764251756	YCXJZUHLRQWCAT-UHFFFAOYSA-N	434.399	1.318	50	20	IDGD	
CCOCC(=O)NNC(=O)C(=O)Nc1ccc(Oc2cccc(S(C)(=O)=O)c2)cc1	764316647	CIUKDIILGPMDDY-UHFFFAOYSA-N	435.458	1.005	50	20	IDGD	
CC(C)Oc1cc(Br)ccc1C(=O)NNC(=O)CNC(=O)c1cccnc1	764345828	XRTALOWJJAIYPI-UHFFFAOYSA-N	435.278	1.822	50	20	IDGD	
COC(=O)c1sccc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccc(C)c(C)c2)[nH]n1	764386404	AUNJBTLKPWTFLC-UHFFFAOYSA-N	441.469	1.941	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc4c(c3)oc(=O)n4C)n[nH]2)cc1C	764387237	HZRSYZYEBQCTDV-UHFFFAOYSA-N	448.439	1.538	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)C(=O)Nc1ccc2c(c1)CCCC(=O)N2	764401209	OQWFNVUECQYJDH-UHFFFAOYSA-N	428.470	1.545	50	20	IDGD	
O=C(CO)NNC(=O)C(=O)Nc1ccc(Oc2ccnc3cc(Cl)ccc23)c(F)c1	764422425	ZACVSYMSARBZCI-UHFFFAOYSA-N	432.795	1.898	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)c2c(C)c(C)nn(C)c2=O)c2ccccc2c1=O	764607048	XLRIJNISDJUFIX-UHFFFAOYSA-N	438.488	1.372	50	20	IDGD	
CC(C)n1nc(C(=O)NNS(=O)(=O)c2cccc3nonc23)c2ccccc2c1=O	765027164	FWTXJYWXCWVDNB-UHFFFAOYSA-N	428.430	1.137	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NN=C(C)c1ccnn1C)N(S(C)(=O)=O)CC2	766003420	XDMZUDCGWRAXHE-KRWDZBQOSA-N	449.533	1.227	50	20	IDGD	
COC(=O)c1nccc2c(S(=O)(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)cccc12	766307556	KCOOCGGGJBPOTQ-UHFFFAOYSA-N	430.398	1.553	50	20	IDGD	
Cc1c(C(=O)NNC(=S)Nc2ccccn2)cc(Br)cc1S(N)(=O)=O	768581282	NUNYWVWYRGPLMM-UHFFFAOYSA-N	444.336	1.431	50	20	IDGD	
CCOC(=O)[C@@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNc2c(C)cccc2F)cc1	770816524	XHTCKEUJMHSYTP-CYBMUJFWSA-N	430.436	1.897	50	20	IDGD	
COc1ccc([C@@H]2[C@H](C(=O)NNc3nc(O)c4cnn(C)c4n3)CCC(=O)N2C)cc1	770972011	OHIOQBPWVJJEOD-CZUORRHYSA-N	425.449	1.130	50	20	IDGD	
CC(C)C(=O)c1ccc(S(=O)(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)cc1	771606589	ICUKLTIDESDZGX-UHFFFAOYSA-N	437.905	1.805	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)[C@@H]1CCCN1S(=O)(=O)c1cccs1	772064694	NGSMPQWFJPIYID-OLZOCXBDSA-N	431.536	1.026	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)N1CCO[C@H](CNC(=O)OC(C)(C)C)C1	773130043	AMVMFMMJSIXQDW-CQSZACIVSA-N	432.481	1.223	50	20	IDGD	
CCOC(=O)N1CCC[C@@H](C(=O)NNC(=O)[C@H]2CCCN(C(=O)OC(C)(C)C)C2)C1	773413074	ZTDADIACLFSAAR-CABCVRRESA-N	426.514	1.649	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)C2=NN(c3ccc(F)cc3)C(=O)CC2=O)c1C	773713276	PAMGISJEIFKSER-CQSZACIVSA-N	440.431	1.719	50	20	IDGD	
COc1ccccc1C(=O)NCC(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776201296	IGBUIHOJMRHUBN-UHFFFAOYSA-N	449.508	1.061	50	20	IDGD	
C[C@H](C(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1)n1nnnc1C(C)(C)C	776202683	VUAYJUVNGVNFMG-CYBMUJFWSA-N	438.533	1.167	50	20	IDGD	
C[C@@]1(C2CC2)NC(=O)N(CC(=O)NNc2ccc([N+](=O)[O-])cc2Br)C1=O	779140299	GOFWYMGIFVTIER-HNNXBMFYSA-N	426.227	1.521	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)N[C@@H]1CCC[C@H]1CCO	779710381	FPJCSLSANBDCFX-MAUKXSAKSA-N	438.550	1.356	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)CNS(=O)(=O)c2ccc3c(c2)OCCCO3)c1	780793072	WKCIIUPVQFBAJO-UHFFFAOYSA-N	435.458	1.056	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCc3c(ncn3-c3ccc(F)cc3)C2)n1	781350009	CNURUHBMKVZVIO-UHFFFAOYSA-N	428.493	1.525	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)[C@H]1CC(c2ccccc2[N+](=O)[O-])=NO1	781932799	HYUJLOZJKPKKDB-GOSISDBHSA-N	436.428	1.848	50	20	IDGD	
CCOc1ccc(Oc2ccc(NC(=O)C(=O)NNC(=O)C(=O)N3CCCC3)cc2)cc1	783999859	LRNRAWWZFYWRJA-UHFFFAOYSA-N	440.456	1.586	50	20	IDGD	
COc1cccc(NNC(=O)C(=O)Nc2cnc3c(c2)CN(C(=O)OC(C)(C)C)CC3)n1	784843756	PQLXDFKDHUPDCP-UHFFFAOYSA-N	442.476	1.860	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2cc(Cl)ccn2)cc1OCC(=O)NC1CC1	784856298	KXTANBWYFCOOBZ-UHFFFAOYSA-N	433.852	1.483	50	20	IDGD	
Cc1nc(Cn2nnc(C(=O)NNC(=O)NCc3cccc(C(F)(F)F)c3)c2C)no1	784935775	AFVZYMIDQQGYSW-UHFFFAOYSA-N	438.370	1.489	50	20	IDGD	
N#C/C(=C\c1cn(CCC(N)=O)nc1-c1cccc(Br)c1)C(=O)NOCCO	787292912	UJEJVIDXLKMYTE-MDWZMJQESA-N	448.277	1.135	50	20	IDGD	
O=C(NNC(=O)c1cncc(Cl)n1)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	788625883	UVPWKZQFJVKYMV-UHFFFAOYSA-N	434.847	1.907	50	20	IDGD	
CC(C)(C)C(=O)NC1CCC(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)CC1	788746634	UABPBIYYBDWTEZ-UHFFFAOYSA-N	430.553	1.562	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)C(=O)Nc1nc2c(s1)CCCCC2	789734585	DUUZBMYQYPODAQ-UHFFFAOYSA-N	439.538	1.803	50	20	IDGD	
CC(C)(C)Cc1csc(NC(=O)C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)n1	789740737	HNYKCJMZXNEIDF-UHFFFAOYSA-N	428.478	1.107	50	20	IDGD	
COc1ccc(OC(F)F)c(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)c1	789817719	IVWUOLRRYAISKC-YOEHRIQHSA-N	449.410	1.955	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)CN1C(=O)COc2cc(Br)ccc21	790065317	LTDPFXIRQBDBHI-UHFFFAOYSA-N	444.282	1.111	50	20	IDGD	
CN1C(=O)C[C@H](C(=O)NNC(=O)C(=O)N2CCCC2)[C@@H]1c1ccc(Cl)c(Cl)c1	790551232	XPTWFFXHGZGNMN-NHYWBVRUSA-N	427.288	1.283	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cc([C@H]3CCCOC3)nn2C)c1C	790951861	MIXOURWUEBELLH-HOTGVXAUSA-N	443.504	1.484	50	20	IDGD	
Cc1cccc(=O)n1C[C@@](C)(O)C(=O)NNC(=O)c1ccc(COc2ccccc2)o1	792024537	NPFGIRACQCQPTB-JOCHJYFZSA-N	425.441	1.541	50	20	IDGD	
O=C(NCCCCn1cc(Br)cn1)NNC(=O)c1cc([N+](=O)[O-])ccc1O	792226453	SYJBVAWOZKBZPI-UHFFFAOYSA-N	441.242	1.684	50	20	IDGD	
Cc1cccnc1NNC(=O)C(=O)Nc1cccc(S(=O)(=O)NC2=NCCCCC2)c1	792376091	PCADSRYSKUQEBX-UHFFFAOYSA-N	444.517	1.723	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)c1ccc2c(c1)OCO2	794179782	DJUGBLHYPOMIDM-CQSZACIVSA-N	445.497	1.765	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)NCCN(C)S(=O)(=O)c2ccc(F)cc2)cc(C#N)n1C	798044971	DOQIUIIOVJRNJY-YBEGLDIGSA-N	429.477	1.688	50	20	IDGD	
NS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cc(-c3ccco3)nc3ccccc23)cn1	798316341	GFQZVPIWDQWDTD-UHFFFAOYSA-N	437.437	1.612	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)CCC(=O)Nc2ccc3nc(O)[nH]c3n2)c2ccccc2n1	799007142	ROYJZKLHONZYMT-UHFFFAOYSA-N	433.428	1.700	50	20	IDGD	
N#Cc1cc(NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)ccc1OC(F)(F)F	799459666	LGGPNUSSOURDMQ-UHFFFAOYSA-N	432.322	1.899	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2ccncc2C(F)(F)F)CC1	800691083	CSNOXZWNQWRDIN-UHFFFAOYSA-N	444.439	1.188	50	20	IDGD	
O=C1CCc2cc(Cl)c(S(=O)(=O)NNC(=O)C3CCN(c4ncccn4)CC3)cc21	800836522	YQYQNNNJUYMNLN-UHFFFAOYSA-N	449.920	1.485	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)CCN2CCN(C(=O)[C@@H]3CCCO3)CC2)c(Cl)c1	802047570	CUHRXEPZTOBRFO-KRWDZBQOSA-N	437.928	1.514	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2ccccc2S(=O)(=O)N2CCOCC2)cc1	802051884	GKFCSXNHEGLEAX-UHFFFAOYSA-N	434.474	1.183	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)[C@H]2CCCN2S(=O)(=O)c2cccs2)cc1	802118907	PTNKMYMPZYRVKY-OAHLLOKOSA-N	437.547	1.820	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)C(=O)Nc1nc(-c2ccc(F)cc2)cs1	807004528	PDBNWDBKPVGWJP-UHFFFAOYSA-N	431.405	1.058	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)C1CCN(S(=O)(=O)c2ccccc2F)CC1	807368273	APOGYCXWNLNOMF-UHFFFAOYSA-N	445.513	1.163	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)N[C@H]2CCCN(C(=O)N3CCCC3)C2)cc1C	807459259	WQIKOOLQUYWBJR-KRWDZBQOSA-N	430.509	1.253	50	20	IDGD	
CCN(C)C(=O)c1cccc(S(=O)(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c1	808092386	RMRJSWPPBHRHOA-UHFFFAOYSA-N	427.486	1.588	50	20	IDGD	
C[C@]1(CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)OCCc2sccc21	811851882	WUBPFEHBBOBJOB-GOSISDBHSA-N	437.547	1.473	50	20	IDGD	
NS(=O)(=O)c1ccc(NC(=O)NN=C2C(=O)Nc3cccc(Br)c32)cc1	814964108	MFSMYUBTBKFPEV-UHFFFAOYSA-N	438.263	1.574	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1cccc(COCC2CC2)c1	815752370	PHJICBXGVOBORO-UHFFFAOYSA-N	446.529	1.945	50	20	IDGD	
NS(=O)(=O)c1ccc(Cl)c(C(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)c1	819850039	XPXMPTZMWIQDAF-UHFFFAOYSA-N	446.268	1.259	50	20	IDGD	
Cc1cc(S(=O)(=O)Nc2ccccc2C(=O)NNC(=O)C(=O)NC(C)C)ccc1F	895019232	CZGJMBKJOBPYAT-UHFFFAOYSA-N	436.465	1.221	50	20	IDGD	
O=C(NCCSCc1ccccc1F)NNC(=O)c1csc(N2CCOCC2)n1	914534376	GPFXMLPCEJTGES-UHFFFAOYSA-N	439.538	1.996	50	20	IDGD	
Cc1ccc(C(=O)N2CCC[C@H](C(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)C2)cc1	914781557	KUEQLCJLHKKYNU-KRWDZBQOSA-N	447.495	1.555	50	20	IDGD	
C[C@]12CCC(=O)N1c1ccccc1C(=O)N2CC(=O)NNC(=O)c1cc2c(s1)CCC2	914830651	NHLGXRYMFLPIPQ-JOCHJYFZSA-N	438.509	1.997	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)CCCn2cnc3ccccc32)cc1	916112262	GQKQMEMCLNLUPE-UHFFFAOYSA-N	443.529	1.593	50	20	IDGD	
NS(=O)(=O)c1cccc(CNC(=O)NNC(=O)c2ccc(Br)s2)c1	916625476	KHUMBMDUNMNHHH-UHFFFAOYSA-N	433.309	1.302	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)NC[C@@]3(N4CCOCC4)CCSC3)n[nH]2)cc1	916636929	PVSBPTPYBLEZPD-NRFANRHFSA-N	444.561	1.537	50	20	IDGD	
NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NNC(=O)Cc3ccc(F)cc3)cc2)C1	918117490	FYVXHQNOCZGVEJ-QGZVFWFLSA-N	427.480	1.601	50	20	IDGD	
CC[C@@H](NC(=O)NNC(=O)c1cc(OC)cc(OC)c1)c1ccccc1OCC(=O)NC	918221772	NTQWCKAJUZPFHF-GOSISDBHSA-N	444.488	1.924	50	20	IDGD	
Cc1cnn(CCC(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)c1	918299048	GVCRQGUTUDEETC-UHFFFAOYSA-N	430.472	1.745	50	20	IDGD	
O=C(CCn1ccnc1)Nc1cccc(C(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1	919977132	UVNYEKXCMUXOLG-LJQANCHMSA-N	435.440	1.513	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)c1ccc(Sc2nncn2C)c([N+](=O)[O-])c1	920006373	JCOGYNFANYOTKZ-UHFFFAOYSA-N	442.457	1.887	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@@H](C(C)C)N2C[C@H](C)O[C@H](C)C2)c2ccccc2c1=O	920275597	FMUQDZWPQHMCTH-ZRGWGRIASA-N	429.521	1.311	50	20	IDGD	
CCNC(=O)CN1CCCN(C(=O)/C(C#N)=C\c2cc(C)n(C[C@@H]3CCCO3)c2C)CC1	920456144	YCPDPVSSAZZVIX-BHJKQYKASA-N	441.576	1.861	50	20	IDGD	
Nc1c(I)cccc1C(=O)OCC(=O)NNC(=O)c1ccccc1	920706106	QFNQECVNUGFAEB-UHFFFAOYSA-N	439.209	1.491	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)[C@@H](Cc2ccccc2)NC(=O)c2cccnc2)cc1	921299459	UYBKKYZNRPDZLC-OAQYLSRUSA-N	443.463	1.521	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)CNC(=O)OCc1ccccc1	921299735	MZCJINLCKNCNDP-UHFFFAOYSA-N	439.516	1.273	50	20	IDGD	
O=C(Cc1ccc(S(=O)(=O)CCO)cc1)NNC(=O)NCc1ccc(Cl)cc1	1116724749	BOXLWZFVAKCECK-UHFFFAOYSA-N	425.894	1.179	50	20	IDGD	
CNS(=O)(=O)c1cccc([C@@H](C)NC(=O)NNC(=O)c2cncn2-c2ccccc2)c1	1321475310	VKBQMYKVVPPUHA-CQSZACIVSA-N	442.501	1.486	50	20	IDGD	
O=C(c1c[nH]c2ncccc12)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1777710908	NNQFLOJCRHBKGK-GUYCJALGSA-N	425.258	1.697	50	20	IDGD	
CN1CCc2cc(C(=O)N3CC[C@@]4(CN(C(=O)CCBr)CCO4)C3)ccc21	1777919596	VZDLNFPDPBDRAK-HXUWFJFHSA-N	436.350	1.907	50	20	IDGD	
C=CC(=O)N[C@@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](Br)CC)C2	1779536174	KTKDNOHLWMQNEE-NRTGNBEESA-N	444.370	1.365	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C1CCC(O)CC1)C2	1779545626	CSUPBDZJMKSVDM-YMPMHWPESA-N	426.630	1.903	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Br)C2)c1ccc([N+](=O)[O-])[nH]1	1780234386	KNNUSCLSRDUFEB-AXAPSJFSSA-N	447.261	1.741	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)COc1cccnc1)C2)[C@@H](F)Br	1780770959	MUXTXOLVDWBSQU-QGPMSJSTSA-N	444.301	1.665	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc4ncnn4c3)CCO2)C1	1781229312	BTMXVUYARLNQBB-QZTJIDSGSA-N	426.304	1.409	50	20	IDGD	
C[C@H](C(=O)N1CCO[C@@]2(CCN(C(=O)[C@](C)(Cl)CCl)C2)C1)n1ccccc1=O	1781229688	HZRAFRMTMMNZMQ-ZMYBRWDISA-N	430.332	1.476	50	20	IDGD	
Cc1nccn1CC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)Br)C2	1781559774	YGWCPXQUMRMUGZ-JCKWVBRZSA-N	427.343	1.489	50	20	IDGD	
Cc1cc(Br)ccc1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1781564961	KWXALVLXACEZHS-CRAIPNDOSA-N	445.741	1.801	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1cc(C)n(C)n1)C2	1782172672	ZDIAVTTYEHIMBW-SQGPQFPESA-N	426.945	1.039	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)Cc3ccccc3O)C2)C1	1783239492	FUFOQEQWJDAMOM-DNVCBOLYSA-N	425.323	1.938	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3nccc4nc[nH]c34)CCO2)C1	1783347499	JWFXKLNCZGLKGS-KZULUSFZSA-N	436.310	1.575	50	20	IDGD	
COc1ccc(CC(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)cc1F	1784706131	PWBNVNFGWSZJMY-FUHWJXTLSA-N	447.276	1.897	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H]1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]2C1	1787443622	OYSLOMOPGHOECR-SBJFKYEJSA-N	433.908	1.510	50	20	IDGD	
CC(C)(NCCC#N)C(=O)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1	1788140644	FFGMJLUKOZXTQI-UHFFFAOYSA-N	448.332	1.396	50	20	IDGD	
C[C@@H](Nc1ccccn1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]2C1	1788764277	JMJNCJHZKZIETC-OWSLCNJRSA-N	434.613	1.713	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)CBr)C[C@@H]21	1790605651	SVKUYGYDVWMYSX-MRLBHPIUSA-N	449.342	1.559	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3c(C)nc4sccn34)C[C@@H]21	1791255335	MOZPVBDYUVGLGU-XQLPTFJDSA-N	440.953	1.551	50	20	IDGD	
CC(C)N1CCC[C@H]1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)CBr)C[C@@H]21	1791807096	XWOYZNFJFBEBHH-FPSMNIFISA-N	444.414	1.870	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC1(c2ccc(NC(=O)[C@@H]3CCCOC3)cc2)CCC1	1792295590	CEYRJSOGSXUZBS-OAHLLOKOSA-N	437.500	1.859	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)COC(C)C	1792616507	WRDZPPHSVZOCQI-YVWYUNDQSA-N	449.460	1.148	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3[nH]ccc3n1)C2	1792870973	NVOKFSGWQDJDCU-KOFHJDLBSA-N	435.322	1.797	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c[nH]c3cccc(Cl)c13)C2)[C@@H](O)CCl	1792981394	KTMOGEIJGFTGJB-RERORNDZSA-N	426.300	1.624	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](CCO)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C(Cl)Cl)C2	1793249651	KIQXQCOPBLXZMN-YVECIDJPSA-N	438.352	1.704	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCCC(F)(F)F	1793980377	SPBZQUGYDBADJO-CLLJXQQHSA-N	427.427	1.670	50	20	IDGD	
Cc1nc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)CBr)C3)c(C)s1	1794178782	UCTQGJXXVWFWRF-JAMKOXHTSA-N	444.395	1.923	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccon1	1794924353	OSTNGPFTTAJOCQ-NEBZKDRISA-N	442.900	1.010	50	20	IDGD	
Cc1ccc(OCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Br)C3)cc1	1795309126	ZOMGDKDMGRFCMW-DLTLXFJOSA-N	429.286	1.654	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1nc(OC)ccc1[N+](=O)[O-]	1796718425	DOICCOOBEBYAHK-ZWUHOBOKSA-N	440.884	1.609	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnc(C(C)(C)C)cn1	1797268135	QPVWWUQNXNLLPK-MUJYYYPQSA-N	430.553	1.399	50	20	IDGD	
Cc1oc2cc(O)ccc2c1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc(B(O)O)c1)C2	1797516250	UFLAGEOMXYLZPM-BCDXTJNWSA-N	448.284	1.692	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccn2nccc2c1	1797552701	GIUXDAAXPOVRKC-JJAZEVLHSA-N	435.322	1.569	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(F)nc1C	1798315077	ZAUVHFIGIHWIAH-LMWOUKEDSA-N	428.302	1.906	50	20	IDGD	
CC(=O)N[C@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2)c1ccc(F)cc1	1799052990	FIRYESBFQQJWPS-QMPXSYISSA-N	429.851	1.127	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(OC)c(NC(C)=O)c1)C2	1799268703	FOODSKMEJLVVNC-YYAJDYIMSA-N	437.924	1.874	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1Cc3ccccc3O1)C2)[C@H](F)Br	1799348830	BOGMTESWINDEAT-URLPEUOOSA-N	427.270	1.270	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](O)Cc1ccccc1	1800637876	VEFWHKPJYKNCHH-MDMSPXHWSA-N	439.350	1.353	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c[nH]nc3c1)C2	1800639566	IZNDBXRJLATOLC-JYYAWHABSA-N	435.322	1.940	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc3c(c1)CCO3)C2	1800761845	HETGBXFYPNMOBU-ZSKVKKPNSA-N	437.334	1.537	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c[nH]c3ccc(OC)cc13)C2	1800976831	KKRFYJCJLPVHQU-JBYDNAENSA-N	435.908	1.634	50	20	IDGD	
Cc1cc(Cl)cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCC(=O)NN(C)C)C3)c1	1801739534	PSTDKLUSPIGFPY-CWPLJXCYSA-N	436.940	1.225	50	20	IDGD	
CC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](Cl)COC)C2	1801964051	HVZRVNMHAWZDMQ-DGADGQDISA-N	447.960	1.133	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(C(F)(F)F)nn1C)C2	1802337552	OOGAOQLLJNMWEZ-CLLJXQQHSA-N	444.458	1.064	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cccc3c2OCC3)[C@@H]1c1cccnc1)[C@H](O)CCl	1803139066	KBEBKOJMCVTCQD-QXAKKESOSA-N	429.904	1.936	50	20	IDGD	
Cc1nn2cc(CC(=O)N3CCCC4(CCN(C(=O)[C@H](O)CCl)CC4)C3)nc2s1	1806445818	XEJOQCIJSVMUFS-OAHLLOKOSA-N	439.969	1.473	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)cn1C	1807363421	ORHCMRPGPVDDOX-DENIHFKCSA-N	446.316	1.042	50	20	IDGD	
O=C(CCc1ccc[nH]1)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1807458835	CFVSGQIFHXJOBE-CVDCTZTESA-N	446.316	1.042	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)c[nH]1	1810303015	OKAVKSLAJISBJY-JXFKEZNVSA-N	447.499	1.350	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)N1CC[C@H](CNC(=O)[C@H](C)Br)[C@@H]1c1cccnc1	1812866125	BDFIFAPWPSHFIU-SHFYGJNESA-N	437.338	1.562	50	20	IDGD	
O=C(CCc1ccccn1)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1816007209	AMMWFSGYJALYQE-FQEVSTJZSA-N	447.304	1.423	50	20	IDGD	
CN(CC(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1)C(=O)OC(C)(C)C	1817026961	KBUSMSLSWYNCTA-KBPBESRZSA-N	443.932	1.868	50	20	IDGD	
CNCCCC(=O)N[C@@H]1CCc2nc(NC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)sc2C1	1817279797	FZJUMZCMDUOENY-SUZBBLJPSA-N	445.549	1.189	50	20	IDGD	
Cc1cc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)[C@H](O)CCl)[nH]n2)ncc1[N+](=O)[O-]	1818262468	UDCGJUJZWXIXBM-UKRRQHHQSA-N	436.856	1.927	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](O)N2CCOCC2)[nH]n1	1820865827	CFAGVTPEHDTYCB-JOQOYGCGSA-N	448.351	1.289	50	20	IDGD	
COc1ccc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@@H](F)Br)CC3)nn1	1821069388	PJZBGQZGPCRSOK-JVXZTZIISA-N	444.286	1.858	50	20	IDGD	
Cc1ncc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)s1	1822416256	YAKUPTAZBLWEAA-CQSZACIVSA-N	433.538	1.854	50	20	IDGD	
CC(C)/C=C/C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1823086139	BXELNHOHAUIZOX-LXXRFIIISA-N	425.493	1.926	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)c3cc(O)ccc3F)sc2C1	1823289272	FGWYJNGPYVATSW-NSHDSACASA-N	449.508	1.587	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](O)CCl)CC2)c1cnn2cccc(F)c12	1824366787	YSRGICWIUBNESL-TVQRCGJNSA-N	437.884	1.755	50	20	IDGD	
CC(C)[C@H](S)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1	1824540157	HANKGCVPLPVHSH-MOPGFXCFSA-N	447.605	1.873	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)C23CC(F)(C2)C3)CC1	1824580355	KLQQPYDSGHWXGN-NWLLBJEDSA-N	443.523	1.811	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](C)Cn1cccn1)CC2	1825994035	OLZMQQSOTJCGLA-XQQFMLRXSA-N	425.942	1.842	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)C(=O)Nc2cccnc2)CC1	1829045311	UOSVZXLETSXVNU-ZWKOTPCHSA-N	436.940	1.894	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](S)C(C)C)CCO2	1831499268	TUBNVVKBHZKFAC-JJRVBVJISA-N	437.400	1.571	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CC[C@@H](C(=O)OC)C3)C2)C1	1831638638	FKXLCNTXIQMOHJ-VWXURSGXSA-N	444.956	1.440	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4nn[nH]c4c3)C2)C1	1831654790	XTWVKNBMKABZED-YWZLYKJASA-N	435.912	1.435	50	20	IDGD	
CC(F)(F)C(C)(C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1831683068	PRYAWTSSBLSYPQ-MEDUHNTESA-N	445.276	1.815	50	20	IDGD	
Cc1nn(C)cc1C(=O)N1CCC([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1	1831871282	QWNLWGLKJKNAGM-LJQANCHMSA-N	432.569	1.335	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H](F)Br)CC1	1831874789	WDNVAQUEXHNJPF-PBHICJAKSA-N	449.365	1.670	50	20	IDGD	
O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)CCc1ccccn1)CCO2	1833185219	VHCYOGDJNGGDRP-IBGZPJMESA-N	440.338	1.256	50	20	IDGD	
C[C@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)CSC(=N)N)CC2)CC1	1833262291	MRLJEMNLRHTVME-GFCCVEGCSA-N	448.431	1.216	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)/C=C/c3ccsc3)CC2)CC1)[C@@H](O)CCl	1833307921	DLCARKPVICUWPK-KROLTMCQSA-N	425.982	1.933	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NC1CCN(C2CCN(C(=O)[C@H](F)Cl)CC2)CC1	1833836081	DTCYTVRLPWBVFZ-KRWDZBQOSA-N	444.960	1.584	50	20	IDGD	
O=C(CCOc1ccccc1)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1834833764	RRSJJADYHVKNJA-LJQANCHMSA-N	431.316	1.716	50	20	IDGD	
Cc1nnsc1C(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)Br)CC2)CC1	1835183519	KNCNOBHOLZXPAD-LLVKDONJSA-N	444.399	1.815	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)c1ccc2ncncc2c1	1835586077	ZEIGWAXHKZPUPT-FQEVSTJZSA-N	445.951	1.415	50	20	IDGD	
Cc1n[nH]cc1C(=O)NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1	1836155463	WUGITYGQGTWPGY-HNNXBMFYSA-N	430.322	1.594	50	20	IDGD	
O=C([C@H](O)CCl)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CCC[C@H]3CCCC[C@@H]31)CCO2	1836697301	KSGNXZQFCSETDC-ZPXGPAEQSA-N	442.984	1.649	50	20	IDGD	
O=C(Cn1nnc2ccccc21)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836714419	UWJVTUIWRWZTOY-IBGZPJMESA-N	449.939	1.030	50	20	IDGD	
O=C(c1cn2cc(F)ccc2n1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1836960476	QACQAIUVFTVGAS-CRAIPNDOSA-N	428.823	1.078	50	20	IDGD	
CC(=O)N(C)CCC(=O)N1CCC(OC2CCN(C(=O)[C@H](C)Br)CC2)CC1	1837040847	BRXGMYUBLZRWFY-AWEZNQCLSA-N	446.386	1.637	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc4c(c3)CNC4=O)CCO2)C1	1837152504	QBUDFHGKDIILES-UTKZUKDTSA-N	435.908	1.017	50	20	IDGD	
Cc1onc(C(=O)N2CCOC[C@@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)c1C	1837710226	PHUYTOBPABMKGQ-LJQANCHMSA-N	425.558	1.213	50	20	IDGD	
CCc1nc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](Br)CC)C3)C2)co1	1838138361	UKJIUWBFULNCTA-ACJLOTCBSA-N	444.326	1.481	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1[nH]cc3c1CCC3)CCO2	1838453607	KMWNZJAMOKIYLP-NRFANRHFSA-N	435.597	1.425	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CC=CCC1)CCO2	1839130190	NSQDBYFSFAXYFF-TXPKVOOTSA-N	429.355	1.973	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3ccc(OC)nc3)C2)C1	1839142349	NCLVAJBAKJVJRS-UWJYYQICSA-N	439.940	1.497	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)[C@H](C)CC)C2)C1	1839962550	JXRPWEOJPXINBE-LDDOYCOJSA-N	435.359	1.023	50	20	IDGD	
O=C(Cn1cnc2ccccc21)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1840103033	IYFQFISZCXWYMZ-LJQANCHMSA-N	441.315	1.296	50	20	IDGD	
O=C(c1c(F)ccnc1Cl)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840186348	KCWXOGHBMOIENU-MRXNPFEDSA-N	440.686	1.748	50	20	IDGD	
O=C(c1cnn2ccccc12)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840187521	GSAAUJOUWSFUFQ-GOSISDBHSA-N	427.288	1.208	50	20	IDGD	
O=C([C@@H](O)CCl)N1CC2(CCCN2C(=O)c2nc3ccc(C(F)(F)F)cn3n2)C1	1843154665	RFXZHHWCXKNYPK-NSHDSACASA-N	431.802	1.165	50	20	IDGD	
CCCOc1ccc(C(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)cc1	1844264781	HIYHAANBQNGMHN-UHFFFAOYSA-N	437.500	1.605	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1c(F)ccc(Cl)c1F)C2	1844265604	UYMVPLQTSNPALQ-UHFFFAOYSA-N	449.845	1.748	50	20	IDGD	
CN1CCCn2nc(C(=O)N3CCCC34CN(C(=O)[C@H](F)Br)C4)cc2C1	1845727315	LQLKUYPWHOZSRW-AWEZNQCLSA-N	428.306	1.226	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](O)CCl)C1	1847563574	KQCMWFXLFCPTRO-FXUDXRNXSA-N	429.945	1.435	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(C(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)cc1	26810021	ICWDYKCBECLSOW-UHFFFAOYSA-N	435.546	1.589	50	20	IDGD	
CN(CC(=O)NNC(=O)c1ccc(COc2ccccc2)o1)S(=O)(=O)c1ccccc1	46642561	HOPQKSMKMRMUPP-UHFFFAOYSA-N	443.481	1.940	50	20	IDGD	
COc1ccc([C@@H](CNC(=O)NNC(=O)CNC(=O)c2ccco2)N2CCCC2)cc1	725871830	HHQFFCHQIZYHFU-QGZVFWFLSA-N	429.477	1.186	50	20	IDGD	
N#Cc1ccc(N2CCC[C@@H]2C(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1	728170864	TWJDKBDBIOWXBN-QGZVFWFLSA-N	426.502	1.281	50	20	IDGD	
O=C(COc1cccc(N2CCCC2=O)c1)NNc1ccc(S(=O)(=O)NC2CC2)cc1	728210585	PUELGMPGIAJAFS-UHFFFAOYSA-N	444.513	1.776	50	20	IDGD	
CSC[C@@H](C(=O)NNC(=O)Cn1ccc2ccccc21)N1C(=O)[C@H]2CCCC[C@H]2C1=O	729448429	QUEIDHVHFMOYOK-JZXOWHBKSA-N	442.541	1.696	50	20	IDGD	
COC1CCN(C(C)(C)CNC(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)CC1	730907641	HRLWAXXDZGHEKD-UHFFFAOYSA-N	442.586	1.284	50	20	IDGD	
CCNS(=O)(=O)CCNC(=O)NNC(=O)c1cc(-c2ccccc2)nc2ccccc12	731760422	IBZCGCPWFALGSM-UHFFFAOYSA-N	441.513	1.785	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1	732264345	QPSGIWABHFCQMO-ZDUSSCGKSA-N	447.473	1.529	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)COc2cccc(NC(=O)c3ccco3)c2)C[C@@H](C)O1	732264558	VILLUQMJTSCDCD-IYBDPMFKSA-N	444.488	1.557	50	20	IDGD	
O=C(NCCCC(=O)N1CCc2ccccc21)NNC(=O)c1nn(-c2ccccc2)cc1O	732475459	GGHQBWSWVBYORS-UHFFFAOYSA-N	448.483	1.891	50	20	IDGD	
NS(=O)(=O)c1ccc(CNC(=S)NNC(=O)NCc2ccc(Cl)cc2)cc1	732929284	SAXXKMIQBJYERM-UHFFFAOYSA-N	427.939	1.366	50	20	IDGD	
CCOCCCn1c(NNC(=O)C(=O)c2c(C)nn(C)c2C)nc2ccccc2c1=O	733268918	UZVOKLVXZGVMFH-UHFFFAOYSA-N	426.477	1.499	50	20	IDGD	
N#CCCn1cc(/C=C(/C#N)C(=O)NS(=O)(=O)[C@H]2CCOC2)c(-c2ccccc2)n1	733722234	UVPFGLMZGGGPMD-QMJOVRGKSA-N	425.470	1.606	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)c(C)c1C	735266032	WPQRISNXXCUZOO-UHFFFAOYSA-N	440.547	1.537	50	20	IDGD	
O=C(CC[S@@](=O)c1ccc2c(c1)OCCO2)NNC(=O)c1ccc2c(c1)OCCO2	740740514	SUHHGECLDQVPRK-SSEXGKCCSA-N	432.454	1.188	50	20	IDGD	
CC(C)C(=O)N(C)Cc1ccc(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1	741662274	MQSDKBDFKJSNGN-UHFFFAOYSA-N	445.545	1.669	50	20	IDGD	
O=C(C[C@H](C(=O)NN=Cc1ccc(F)cc1)N1CCOCC1)NN=Cc1ccc(F)cc1	741767247	SVJWGBIQKBDDHL-HXUWFJFHSA-N	443.454	1.656	50	20	IDGD	
CCn1c(NNC(=O)CCCC[C@@H]2SC[C@H]3NC(=O)N[C@H]32)nc2ccccc2c1=O	742275986	SYLVOAXHRQWFLC-HLLBOEOZSA-N	430.534	1.585	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN2CCCN(CC(=O)N3CCCC3)CC2)cc1C	744386821	SFNUNWYSNNNZBI-UHFFFAOYSA-N	435.594	1.010	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)NCCCN2C(=O)COc3ccccc32)cc1C	745857070	PDRIHXVQCGYXMH-UHFFFAOYSA-N	439.472	1.388	50	20	IDGD	
CC[C@@H](Nc1c([N+](=O)[O-])c(C)nn1C)C(=O)NNC(=O)C(F)(F)Oc1ccccc1	746297104	UCYBHYHYOLKWFV-GFCCVEGCSA-N	426.380	1.646	50	20	IDGD	
N#Cc1ccc(NNC(=O)C2=NN([C@H]3CCS(=O)(=O)C3)C(=O)CC2)cc1C(F)(F)F	746897503	ZXLNCSGIXVNAPG-LBPRGKRZSA-N	443.407	1.186	50	20	IDGD	
COc1cc(C)nc(NNC(=O)CCCNS(=O)(=O)c2ccc3c(c2)CCCC3)n1	747419340	ATZMNXDJZQQRFW-UHFFFAOYSA-N	433.534	1.874	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)NCCC(=O)N1CCN(c2ccccc2)CC1	748464405	COBSNFACAOIKGG-UHFFFAOYSA-N	443.479	1.274	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)[C@H]1CCN(C2CCCCC2)C1	748855646	AJXAILMHUHMBKX-KRWDZBQOSA-N	436.578	1.805	50	20	IDGD	
CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)NNC(=O)COc1ccc(F)cc1	749333701	RXFWFJWYOBMDDL-LJQANCHMSA-N	430.411	1.720	50	20	IDGD	
Cc1nc2ccccc2c(=O)n1-c1ccc(C(=O)NNC(=O)CNC(=O)c2ccco2)cc1	751203981	BBISVQBQKJCWTR-UHFFFAOYSA-N	445.435	1.478	50	20	IDGD	
Cn1cnc2cc(C(=O)NNC(=O)c3ccc(S(=O)(=O)N4CCCC4)cc3)ccc21	753394149	UPVKOSHUCKJGTD-UHFFFAOYSA-N	427.486	1.433	50	20	IDGD	
O=C(COC(=O)Cc1ccc(I)cc1)NNC(=O)c1ccccc1	753458400	URQNFOSPQDZTAS-UHFFFAOYSA-N	438.221	1.838	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)[C@H](C)c2ccc([N+](=O)[O-])cc2F)cc1OC	755064483	KIDGHFDOKOWEBK-LLVKDONJSA-N	449.391	1.859	50	20	IDGD	
CN(C)c1cccc(CNC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)n1	755097793	KPYDRHVVJYVCEB-UHFFFAOYSA-N	425.537	1.190	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NC(=O)NNC(=O)COc2ccccc2C#N)cc1	755517842	QWYHTIZPSZZKGP-UHFFFAOYSA-N	431.474	1.477	50	20	IDGD	
C[C@@H]1C[C@@H](C)CN(C(=O)c2ccccc2NC(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)C1	755669434	ZVTKZSSBCBNGIZ-KFWWJZLASA-N	436.534	1.392	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)Nc1cccc(N2CCCS2(=O)=O)c1	755886755	XIEYJLJREASDSK-UHFFFAOYSA-N	449.445	1.366	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccc(-c3csnn3)cc2)c1	756205343	GYCBBTZVSQAGEL-UHFFFAOYSA-N	446.514	1.922	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)[C@@H]1CCC(=O)N1Cc1ccc(Br)cc1	756691753	KDVORRLRAPNGLV-INIZCTEOSA-N	431.290	1.725	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)COc2ccc(C#N)cc2)cc1N1CCCS1(=O)=O	756703311	GRTMVPOSKVXQFL-UHFFFAOYSA-N	443.485	1.638	50	20	IDGD	
CCOC(=O)[C@@H](C)NC(=O)c1ccc(NC(=O)NNC(=O)Cc2ccccc2F)cc1	756792222	ZXYRBWCAHJNEDI-CYBMUJFWSA-N	430.436	1.903	50	20	IDGD	
NC(=O)c1ccc(NNC(=O)c2ccc(NS(=O)(=O)/C=C\c3ccccc3)cc2)nn1	757402266	LYJDNGWLBNDSIC-SEYXRHQNSA-N	438.469	1.745	50	20	IDGD	
Cc1ccc(CNC(=O)NNC(=O)CNC(=O)c2cccs2)c(OC[C@H]2CCCO2)c1	757730715	AOICKXGFZVBTKH-MRXNPFEDSA-N	446.529	1.875	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)N[C@@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1C#N	758760778	POLDQKDKLSRWCW-HEHGZKQESA-N	435.456	1.682	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)NC[C@@H]1CN(Cc2ccccc2)CCCO1	759213591	BADFUKIATCPJST-GOSISDBHSA-N	428.489	1.393	50	20	IDGD	
CCCn1nc(C(=O)NNS(=O)(=O)c2cnc(Cl)c(F)c2)c2ccccc2c1=O	761937069	IWCDUOMJXMGQRJ-UHFFFAOYSA-N	439.856	1.617	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)c1ccc(N2NC(=O)CCC2=O)cc1	762370643	NWWNSFPNAFVZFU-UHFFFAOYSA-N	428.470	1.407	50	20	IDGD	
O=C(NNc1nccc(N2CCOCC2)n1)[C@@H]1CC(=O)N(Cc2ccccc2Cl)C1	762851755	FMYBTYOBPCDCAC-OAHLLOKOSA-N	430.896	1.458	50	20	IDGD	
COC(=O)CCCOc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)cc1	763547466	BYUKVVYVZROJHL-UHFFFAOYSA-N	443.412	1.147	50	20	IDGD	
CCCC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1C	763572182	MARBHIVRCFCDFC-SFHVURJKSA-N	440.456	1.660	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cccc(N3CCCNC3=O)c2)c2ccccc2n1	763615184	BQHDDPBBYXCIRM-UHFFFAOYSA-N	446.467	1.863	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)C(=O)Nc1ccc(N2CCSCC2)cc1	763681018	SJTAIWQTVSFATQ-UHFFFAOYSA-N	432.477	1.544	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(F)c(NC(=O)OC)c1	763712343	OXGIRCNXIWPGTP-UHFFFAOYSA-N	432.408	1.731	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cnc(Br)cc1C	763716751	LTLQSUIZZVNKFR-UHFFFAOYSA-N	435.278	1.880	50	20	IDGD	
O=C(NNC(=O)c1cccc(Cl)c1)C(=O)Nc1ccc(NC(=O)[C@H]2CCCO2)cc1	763753421	VUYNJZKKDJJGQN-MRXNPFEDSA-N	430.848	1.857	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)C(=O)Nc2ccc(C(C)=O)cc2)c2ccccc2c1=O	763801047	BNNLSTIIOQSWCW-UHFFFAOYSA-N	449.467	1.799	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cc(CN(C)C)ccc2C)cc1	763872570	OLWUUTINWNALQM-MRXNPFEDSA-N	440.500	1.813	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)C(=O)Nc2ccc(CC(=O)N(C)C)cc2)cc1	763895504	FZVRVZSUWPRWIR-UHFFFAOYSA-N	428.514	1.504	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3ccc4c(c3)N(C)C(=O)CO4)cc2C1	763940516	SMOCIBZVTAVNGY-LLVKDONJSA-N	442.497	1.628	50	20	IDGD	
CC(=O)N(Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)cc1)C1CC1	763974431	PODQBHQIKXGXHX-UHFFFAOYSA-N	444.875	1.956	50	20	IDGD	
COC(=O)[C@@H](C)Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1	764005645	DPSPOEIPOBTBBL-ZDUSSCGKSA-N	441.440	1.209	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)CC(F)(F)F)c(Br)cc1F	764112491	LSVPJLRZQIMFFB-UHFFFAOYSA-N	444.135	1.413	50	20	IDGD	
CCOc1cc(C(=O)N(C)C)ccc1NC(=O)C(=O)NNC(=O)Cc1ccccc1OC	764131539	IMLJDNLZHSEZKC-UHFFFAOYSA-N	442.472	1.124	50	20	IDGD	
O=C(CCOc1ccccc1)NNC(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F	764161321	RHJLWBXCFFGORO-UHFFFAOYSA-N	438.343	1.751	50	20	IDGD	
CCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(Br)ccc2O)cc1	764281051	WJLHEVCVUVHICI-UHFFFAOYSA-N	449.261	1.304	50	20	IDGD	
CNS(=O)(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2cc3ccccc3o2)c1C	764331118	MYZFBSATBGNNTB-UHFFFAOYSA-N	430.442	1.049	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)Cc2ccncc2)sc2c1CC[C@H](C)C2	764356232	QZWASNSUGZQXRC-LBPRGKRZSA-N	444.513	1.773	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc(C)nc3C)n[nH]2)cc1OC	764379227	SKZUUDDHSRSDAB-UHFFFAOYSA-N	438.444	1.505	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)c(C)c1	764380178	QOSPWTLCHZMXNN-UHFFFAOYSA-N	437.399	1.778	50	20	IDGD	
CS(=O)(=O)CCc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2F)cc1	764422444	ZISOHDLLINWPHB-UHFFFAOYSA-N	441.868	1.466	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)Nc3ccc4c(c3)OCCO4)CC2)cc1	765312657	JBRQDEKKAZTAOF-UHFFFAOYSA-N	439.516	1.737	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)ccc1OC	765606871	HRATUUWPAXTYRH-UHFFFAOYSA-N	447.448	1.207	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1cccc(C[S@](=O)c2ccccc2)c1	766261235	QCANHOKKWMPPQG-PMERELPUSA-N	425.470	1.875	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Cc2cc(F)c(F)cc2F)cc1	767826589	ZEWSKXUAQMNARS-UHFFFAOYSA-N	429.420	1.423	50	20	IDGD	
CC(C)(O)C(=O)NNC(=O)c1ccc(Cl)c(S(=O)(=O)N2CCc3ccccc32)c1	768245181	SEFGZGAWQPEPIE-UHFFFAOYSA-N	437.905	1.623	50	20	IDGD	
COC(=O)c1cc(F)c(Br)c(S(=O)(=O)NNC(=O)c2cccn2C)c1	769860811	XLLJWXXRQJIZHO-UHFFFAOYSA-N	434.243	1.337	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNc2c(C)cccc2F)cc(S(C)(=O)=O)c1	770819766	XSKGQCMAAJPHFD-UHFFFAOYSA-N	437.449	1.796	50	20	IDGD	
CCc1cc(NNC(=O)[C@H](C)NS(=O)(=O)c2cccs2)nc(-c2ccccn2)n1	771007786	FSQDXSGUAAABHG-LBPRGKRZSA-N	432.531	1.973	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)N[C@@H](c1ccc(F)c(Cl)c1)C(F)(F)F	772628227	LACZFEOTJIMOAY-KWQFWETISA-N	431.795	1.848	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)CCNS(=O)(=O)c2ccc(C(C)C)cc2)c1	773070205	NYWBMIBNUSHFKQ-UHFFFAOYSA-N	447.517	1.293	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ccc(C(F)(F)F)cn2)cc1NS(C)(=O)=O	773665311	ACLGPCCLZNSFGC-UHFFFAOYSA-N	447.395	1.562	50	20	IDGD	
Cc1cc(C(=O)N2CCOCC2)ccc1NC(=O)C(=O)NNc1cnc2ccccc2n1	773717668	BEUKGBZDZGDADZ-UHFFFAOYSA-N	434.456	1.492	50	20	IDGD	
Cn1c(=NNC(=O)NCCOc2ccc(NS(C)(=O)=O)cc2)sc2ccccc21	773778633	JAPDLLDJBUPDRO-UHFFFAOYSA-N	435.531	1.805	50	20	IDGD	
CS(=O)(=O)Nc1ccc(OCCNC(=O)NNC(=O)c2cc3c(s2)CCC3)cc1	773778667	JGCKPMHMGWTDET-UHFFFAOYSA-N	438.531	1.631	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)c2ccc3c(c2)C(=O)N(C[C@H]2CCCO2)C3=O)c1	776533236	AOYJCEXXZIKGCC-OAHLLOKOSA-N	443.481	1.622	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1N1CCOCC1)c1cc(-c2ccccc2)[nH]n1	776702615	JHGYJEBHHFSNIR-UHFFFAOYSA-N	436.428	1.896	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CN(C)[C@@H](C(N)=O)c2cccc(Br)c2)c1	777725196	RCIQNOVBRJQZOL-QGZVFWFLSA-N	433.306	1.677	50	20	IDGD	
CC1CCC2(CC1)OC[C@H](CNC(=O)NNC(=O)c1nn(C)c(=O)c3ccccc13)O2	777761372	MOOLSUVHMXIGGS-GJGORFQUSA-N	429.477	1.199	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)CCNC(=O)N2CCc3ccccc3C2)nc1C	778421103	FZCLLJBJGUKGPZ-UHFFFAOYSA-N	426.477	1.563	50	20	IDGD	
O=C(N1CCN(S(=O)(=O)CBr)CC1)C(F)(F)c1ccc([N+](=O)[O-])cc1	778422723	FRQJOSYLSGRZSD-UHFFFAOYSA-N	442.238	1.513	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)c2cccc(S(=O)(=O)N(CC)CC)c2)nc1C	778425367	RWIMGVQGSPZCOD-UHFFFAOYSA-N	435.506	1.749	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)c2ccc(CS(=O)(=O)C(F)F)cc2)nc1C	778428232	KENLZIREYQIWOR-UHFFFAOYSA-N	428.417	1.856	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)c2ccccc2NS(=O)(=O)C(F)(F)F)nc1C	778428613	FOSHSHGSGDBJBF-UHFFFAOYSA-N	447.395	1.980	50	20	IDGD	
O=C(NNC(=O)c1coc(-c2ccc(Br)cc2F)n1)C(=O)N1CCCC1	778674225	FNTOGPTWZZWCIS-UHFFFAOYSA-N	425.214	1.627	50	20	IDGD	
COC(=O)c1ccccc1NNC(=O)c1cc(S(=O)(=O)N2CCOCC2)ccc1F	780738988	VRXJDOMJWZKMCU-UHFFFAOYSA-N	437.449	1.390	50	20	IDGD	
COc1cc(C)ccc1NC(=O)C(=O)NNC(=O)c1sc(N2CCOCC2)nc1C	782896450	IMNSYDPCQIBWTP-UHFFFAOYSA-N	433.490	1.005	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNc3ncnc4ccsc34)cn2)C[C@H](C)O1	783254641	IJJQVPRYTONFJK-RYUDHWBXSA-N	427.490	1.782	50	20	IDGD	
Cc1ccc(Oc2ccc(NC(=O)C(=O)NNC(=O)C(=O)N3CCCC3)cn2)cc1C	783999223	CEQPGQMECWTBEB-UHFFFAOYSA-N	425.445	1.199	50	20	IDGD	
C[C@@H](c1ccccc1)n1ccc(NC(=O)C(=O)NNC(=O)CNC(=O)c2cccs2)n1	784003775	OOIHLKBRQRZEKU-ZDUSSCGKSA-N	440.485	1.070	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)C(=O)Nc1ccc(OCC2CC2)cc1	784210213	IMBIGAKEDYCZAD-UHFFFAOYSA-N	444.513	1.998	50	20	IDGD	
COC(=O)c1ccsc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)C(F)F)cc1	784835001	GBQIOCXOVCORSE-UHFFFAOYSA-N	433.414	1.613	50	20	IDGD	
CS(=O)(=O)c1ccccc1-n1cc(NC(=O)C(=O)NNc2cccnc2Cl)cn1	784843924	WUIMZXNRUJHXHW-UHFFFAOYSA-N	434.865	1.406	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)cnc1Br	785023444	ISPQMFLPKBOGRJ-UHFFFAOYSA-N	438.194	1.166	50	20	IDGD	
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC(=O)C(=O)NNc2nccn(C)c2=O)cc1	785090584	TXAGUWNARDAEDA-LBPRGKRZSA-N	430.465	1.448	50	20	IDGD	
CC[C@]1(C)Oc2ccc(NC(=O)C(=O)NNC(=O)COc3ccccc3[N+](=O)[O-])cc2O1	785990347	FABKSCOINBWXSO-HXUWFJFHSA-N	444.400	1.657	50	20	IDGD	
NC(=O)c1ncccc1C(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	786734048	DMVXEAUZECQPNW-UHFFFAOYSA-N	445.482	1.118	50	20	IDGD	
N#C/C(=C/c1ccc(O)cc1)C(=O)Nc1ccc(NC(=O)CCN2C(=O)CNC2=O)cc1	787010976	SQULMWNXLZBKCP-PTNGSMBKSA-N	433.424	1.818	50	20	IDGD	
O=C(COC(=O)c1c[nH]cc1-c1ccccc1F)NNC(=O)[C@H]1COc2ccccc2O1	787199877	PKJRYEXYYWQBOW-LJQANCHMSA-N	439.399	1.965	50	20	IDGD	
CCS(=O)(=O)CCn1cc(C)c(NC(=O)C(=O)NNc2cccc(Cl)c2C)n1	787557023	BJFYZFOOXVEVKW-UHFFFAOYSA-N	427.914	1.670	50	20	IDGD	
Cc1ccc([C@]2(C)NC(=O)N(CC(=O)Nc3cccc(NC(=O)NN(C)C)c3)C2=O)cc1	788253882	LHUCGJNOXCUTLU-QFIPXVFZSA-N	438.488	1.999	50	20	IDGD	
CSCC[C@@H](O)C(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	788626169	VUHSZZRHWSWKGB-QGZVFWFLSA-N	437.543	1.040	50	20	IDGD	
Cn1nc([C@H]2CCCO2)cc1NC(=O)C(=O)NNC(=O)c1ccccc1Br	789730730	ZMHLSVNHTLAMBH-CYBMUJFWSA-N	436.266	1.434	50	20	IDGD	
CN(C)[C@@H]1CCOc2c(NC(=O)C(=O)NNC(=O)COc3ccc(C#N)cc3)cccc21	789732632	RCWDFCPSJREITG-GOSISDBHSA-N	437.456	1.108	50	20	IDGD	
CCn1cnnc1-c1cccc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)c1	789813144	QIDLGWJLKLJIKA-OALUTQOASA-N	448.483	1.624	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)NCCc2ccc(S(N)(=O)=O)cc2)c1C	789960558	BJWVBBYUSLVPEQ-CPNJWEJPSA-N	430.530	1.665	50	20	IDGD	
CO[C@H]1CCOc2c(NC(=O)C(=O)NNC(=O)c3cnn(-c4ccccc4)c3)cccc21	790951634	FWRXPNSVDGORGA-SFHVURJKSA-N	435.440	1.742	50	20	IDGD	
O=C(C[C@@H]1CCCOC1)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	792791151	YSORUJMXXRYUQH-KRWDZBQOSA-N	431.514	1.743	50	20	IDGD	
O=C(NN=CCc1ccc([N+](=O)[O-])cc1)c1cccc(S(=O)(=O)N2CCOCC2)c1	792872192	MXBRSDXZRGQCSG-UHFFFAOYSA-N	432.458	1.574	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cccc(Br)n2)cc1	793021262	AUZKLPIJWFBBOP-LLVKDONJSA-N	449.261	1.600	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNc2ccc3c(=O)[nH]ccc3c2)cc1C	793068717	CBHXQPHFYYVEKF-UHFFFAOYSA-N	443.485	1.680	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Cc2c(C)nn(C(C)C)c2C)cc1	794183087	QGROVFFLAKKVNQ-UHFFFAOYSA-N	435.550	1.400	50	20	IDGD	
CC(=NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)c1ccc2c(c1)OCC(=O)N2	794855425	SVIRHVDKMQTKAW-UHFFFAOYSA-N	442.497	1.956	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)[C@@]1(F)CCN(C(=O)OC(C)(C)C)C1	795168045	FWQFYOYBORLVOA-GOSISDBHSA-N	430.502	1.729	50	20	IDGD	
O=C(COC(=O)[C@@H]1CCCCN1Cc1ccccn1)NNC(=O)c1ccc([N+](=O)[O-])cc1	795606122	KANDAUACRKAKEI-SFHVURJKSA-N	441.444	1.349	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)[C@@H](C)NS(=O)(=O)c2cccc(C(F)(F)F)c2)n1	795670121	LMHJEGRZCIKLLU-LLVKDONJSA-N	430.408	1.537	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)C(=O)Nc1ccc(OC(C)C)c(C(N)=O)c1)c1ccccc1	797009588	VJMUTZZRKWIWMF-MRXNPFEDSA-N	426.473	1.852	50	20	IDGD	
O=C(NNC(=O)c1cc(Cl)ccc1O)Nc1cc(S(=O)(=O)N2CCCC2)ccn1	797673847	MPEBFAFJVRJUMX-UHFFFAOYSA-N	439.881	1.692	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@@H](C)NC(=O)CCc2ccccc2)c2ccccc2c1=O	799408372	NQCDDGCERXCXGN-OAHLLOKOSA-N	435.484	1.315	50	20	IDGD	
O=C(CN1C(=O)[C@@H]2CCCC[C@H]2C1=O)NNc1cc([N+](=O)[O-])ccc1Br	800618563	BGUUXGWPUKABEL-GHMZBOCLSA-N	425.239	1.976	50	20	IDGD	
COC(=O)c1c(F)cc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2OC)cc1F	802566195	DLPIOKJKIJLBBG-UHFFFAOYSA-N	441.774	1.813	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)c1c(C)nn(Cc2ccccc2)c1N	803112949	LDZQDQMSBCBOBX-UHFFFAOYSA-N	429.502	1.991	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)Nc2nncn2C2CC2)cc1	803514445	AVUQFPKFZMNSCZ-GDNBJRDFSA-N	446.471	1.906	50	20	IDGD	
COC(=O)CC[C@@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)c1ccc2c(c1)OCCO2	806347119	GSJOIIBOBRGYAR-CYBMUJFWSA-N	437.449	1.065	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(C#N)c(Br)c2)c1	806974180	XXJQYDSDHJWXPM-UHFFFAOYSA-N	430.262	1.786	50	20	IDGD	
Cc1nc2c3ccccc3nn2c(C)c1CCC(=O)N([C@@H]1CCS(=O)(=O)C1)N(C)C	809800303	OEUMSRSZOQOVQM-MRXNPFEDSA-N	429.546	1.924	50	20	IDGD	
COc1cc(C(=O)NNC(=O)N[C@@H](C)c2noc(COC(C)C)n2)cc(OC)c1OC	811851461	ZMOPOKYKRHARRR-NSHDSACASA-N	437.453	1.726	50	20	IDGD	
CCCN(CC)C[C@@H](C)NC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1	812674706	HTAWLCOSRSHEOK-MRXNPFEDSA-N	427.571	1.066	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccccc2O[C@H]2CCOC2)cc1	813033832	NKHTVPXXBDIPRD-HNNXBMFYSA-N	448.501	1.186	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)NC[C@@H]2C[C@H](F)CN2C(=O)OC(C)(C)C)c1	813811976	LKCILWOTYWYDAV-KBPBESRZSA-N	440.472	1.995	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)NCC(=O)NCCN1CCCCCC1	814325244	MVTDADDOVQTYHE-HNNXBMFYSA-N	439.944	1.430	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCc2nncn2C1)Nc1ccc(Cl)c(-n2nnnc2C2CC2)c1	814655275	UFWJFTBOXXLOGY-NSHDSACASA-N	442.871	1.200	50	20	IDGD	
CN(C)C(=O)NNC(=O)c1cn(C)nc1[C@@H]1CCCN(C(=O)OCc2ccccc2)C1	814669235	MYRGDAZBIPWHSA-MRXNPFEDSA-N	428.493	1.852	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)Cc2ccc(F)cc2)cc1)[C@@H]1C[C@@H]1C	815567345	VEYZBLZOACWADB-ORAYPTAESA-N	426.448	1.916	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)[C@]23CCC(=O)N2CCS3)c2ccccc2c1=O	849202141	UAMBILXTJOBCFS-OAQYLSRUSA-N	443.529	1.413	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc2ccccc2c1)NNC(=O)c1cccc([N+](=O)[O-])c1	912770495	NITTZAZNIAEWIU-UHFFFAOYSA-N	428.426	1.488	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)CNS(=O)(=O)c1ccc2ccccc2c1	912861135	YMWZWHTWHGNOHW-AWEZNQCLSA-N	445.472	1.872	50	20	IDGD	
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC(=NNC(=O)[C@H]2COc3ccccc3O2)CC1	914554629	OCHYVHUSOSXJCH-QGZVFWFLSA-N	433.490	1.123	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN1C(=O)c1ccc(Cl)c(Cl)c1)[C@@H]1CCS(=O)(=O)C1	914719812	RUWNUORWFTVRAB-RISCZKNCSA-N	448.328	1.180	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)NC[C@H](c2cccs2)N2CCN(C)CC2)c1	915902519	WGGWSDLEPKERBD-GOSISDBHSA-N	431.562	1.754	50	20	IDGD	
O=C(CSc1ccc(Cl)cc1)NNC(=O)NC[C@@]1(N2CCOCC2)CCSC1	916636587	GMXKIKXWWSTQEH-SFHVURJKSA-N	445.010	1.970	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(OCC(=O)NNC(=O)C(C)(C)C)c([N+](=O)[O-])c1	917180051	AGPSMNRKUWBQQG-UHFFFAOYSA-N	430.483	1.198	50	20	IDGD	
CC(=NNC(=O)C1=S=C2CCCC2=C1)c1ccc(S(=O)(=O)NCCCN(C)C)cc1	917536119	JIGVGUXKUKAWRA-UHFFFAOYSA-N	448.614	1.959	50	20	IDGD	
NS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cc(-c3ccco3)nc3ccccc23)o1	917910820	RWDPXDWJWJDXIB-UHFFFAOYSA-N	426.410	1.810	50	20	IDGD	
C[C@H](NC(=O)NN[C@]1(C)CCS(=O)(=O)C1)c1cc2c(cc1Br)OCCO2	918097489	QXIUXXVMQAFUDB-MGPLVRAMSA-N	448.339	1.662	50	20	IDGD	
NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)cc2)C1	918117819	JYXADYRDGWPYED-INIZCTEOSA-N	440.460	1.441	50	20	IDGD	
C[C@]1(C2CC2)NC(=O)N(CC(=O)NNC(=O)c2ccc(F)cc2Br)C1=O	918340398	NXWBYTPXZGZZKR-MRXNPFEDSA-N	427.230	1.070	50	20	IDGD	
O=C(NNC(=O)c1ccccc1F)c1ccc2c(c1)S(=O)(=O)N(C[C@@H]1CCCO1)C2=O	918549715	MWXGWHIONAIEPL-ZDUSSCGKSA-N	447.444	1.224	50	20	IDGD	
CCCCn1c(C)cc(/C=C(\C#N)C(=O)NCCC(=O)N[C@H]2CCS(=O)(=O)C2)c1C	918569840	LFKZVGQKXOOQNI-GQEMFKIVSA-N	434.562	1.622	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)NNC(=O)c2cc(Br)c[nH]2)cc1OC	918778376	COLXZIZGESMQOS-UHFFFAOYSA-N	440.254	1.474	50	20	IDGD	
O=C(NCCS(=O)(=O)NCc1ccccc1)NNC(=O)c1ccc2ccccc2c1	918780092	PKYGAFMSFIVEJP-UHFFFAOYSA-N	426.498	1.903	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)OCC(=O)N2CCC[C@@H](NC(C)=O)C2)c1C	918808406	BLKYFUPEDUMAAQ-PYIVIEQSSA-N	430.505	1.329	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)CCc2cc(F)ccc2F)cc1	919684123	HVLZMNNTKMSMOM-UHFFFAOYSA-N	425.457	1.674	50	20	IDGD	
O=C(NNC(=O)C1(c2ccc(Br)cc2)CCC1)N[C@H]1CCS(=O)(=O)C1	919889972	XQLJPIMEJKXCOR-ZDUSSCGKSA-N	430.324	1.388	50	20	IDGD	
CCNC(=O)NNC(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccc(OC)c(OC)c1	920858377	FJAJMEGJXJCEER-XNTDXEJSSA-N	437.460	1.738	50	20	IDGD	
O=C(NCCc1cccs1)NNC(=O)c1ccc2c(c1)C(=O)N(C[C@H]1CCCO1)C2=O	920861849	WSQRHSMWZIYWRJ-CQSZACIVSA-N	442.497	1.710	50	20	IDGD	
CC(C)(C)OC(=O)NC(C)(C)C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	921299688	JNAFQZIGAPJZGZ-UHFFFAOYSA-N	433.553	1.649	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)N[C@H]2CCN(c3ccccn3)C2)CC1	1320119860	GMGVGNOZZYLCIZ-INIZCTEOSA-N	432.525	1.638	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1nn(-c2ccccc2F)cc1Br	1321331523	VDQHPOUMBFMWIS-SECBINFHSA-N	427.230	1.877	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)[C@@H]2CC(=O)N(C)c3ccccc32)c2ccccc2c1=O	1321527229	RZWKPHCWHYAJHR-QGZVFWFLSA-N	433.468	1.889	50	20	IDGD	
Cc1nn(C)c2sc(C(=O)N[C@H](C)C(=O)NNC(=O)c3n[nH]c4c3CCCC4)cc12	1322124713	XEZMETXYTGNZMW-SNVBAGLBSA-N	429.506	1.125	50	20	IDGD	
CCOc1ccc(NC(=S)NNC(=O)[C@@H](CC)N=c2nn[nH]n2-c2ccccc2)cc1	1331402298	HVAPSSPDKIWODD-QGZVFWFLSA-N	440.533	1.691	50	20	IDGD	
Cn1nc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)c2c1CCC2	1777963350	QKRIRCPCIUKMCZ-RTBURBONSA-N	429.348	1.589	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ncn(-c3ccccc3)n1)C2)[C@@H](F)Cl	1778026395	SZCAQDXBZSISKH-JXXFODFXSA-N	435.887	1.929	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C1(F)CCC1)C2	1778095356	XATOMZKBFYSDTK-AMODZNIKSA-N	447.511	1.527	50	20	IDGD	
O=C(c1ccc2nc[nH]c2c1)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1778511759	UDRVZIHFGFCBJA-YOEHRIQHSA-N	425.258	1.697	50	20	IDGD	
Cc1nc[nH]c1CSCC(=O)N1CC[C@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1778912820	ZOGCXXIAOMERCG-LJQANCHMSA-N	440.642	1.633	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)Cn2cncn2)C1	1779501616	CZTZWKYIHKEMBM-BASYENTBSA-N	442.358	1.212	50	20	IDGD	
O=C(c1csc(C(F)(F)F)n1)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1779754357	JFSUZZCJHWANHH-QMTHXVAHSA-N	427.832	1.205	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2c[nH]c(=O)cn2)C1	1780123876	FLIDPCOVSFFRCU-JEBQAFNWSA-N	431.320	1.134	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(C)nc3O)C2)C1	1780276493	XOUSTKFDQOFOBT-KBXCAEBGSA-N	426.311	1.713	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc(O)c(OC)c2)C1	1780444978	AIGSAZKGOYSPBN-FQELHTAISA-N	440.924	1.782	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)C1CCC(O)CC1)C2)[C@@H](F)Br	1780777703	ZKMQSSAWDFTPHD-PTALEHFISA-N	435.334	1.742	50	20	IDGD	
CCOc1c(C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](Cl)CC)C3)C2)cnc2c1cnn2C	1781217444	IPBGAYNGXJYOIH-IERDGZPVSA-N	449.939	1.828	50	20	IDGD	
CC(C)(C)n1cc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)nn1	1781232445	UOTNWZRLMBFPEB-ZWKOTPCHSA-N	432.352	1.713	50	20	IDGD	
Cc1ccc(-n2ccnn2)c(C(=O)N2CC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)c1	1782169530	QSRFYXVMSPCKTR-IBGZPJMESA-N	438.315	1.823	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H]3CCCO3)C2)C1	1783479463	CJLGYNBUXHRVEO-AUSJPIAWSA-N	445.944	1.127	50	20	IDGD	
Cc1cnc2c(C(=O)N3CCO[C@@]4(CCN(C(=O)[C@H](C)Br)C4)C3)cnn2c1	1783534197	RCUWOBPICREJKB-SCLBCKFNSA-N	436.310	1.265	50	20	IDGD	
C/C(=C\c1cccs1)C(=O)N1CCO[C@@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1	1783933300	UKZLGZOIJKXYER-RDOKFVIMSA-N	434.562	1.354	50	20	IDGD	
COC(=O)CCCCCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](C)CBr)CCO2	1784044675	XPVXCJDYJNFZAS-DNVCBOLYSA-N	447.370	1.971	50	20	IDGD	
COC(=O)[C@@H]1CC[C@H](C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)Br)C[C@@H]32)C1	1784081715	BOLNZZWPABTNCT-IATJYDTKSA-N	445.354	1.339	50	20	IDGD	
Cc1cc(C)n2ccc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]4C3)c2n1	1784093010	ZKNGKDFFXSTMIJ-DKIMLUQUSA-N	434.924	1.144	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cn3cc([N+](=O)[O-])cn3)C[C@@H]21	1784615953	DNQPLZJITKFREA-HNKHHVNMSA-N	427.889	1.179	50	20	IDGD	
Cc1cc(C)n(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCBr)C[C@@H]32)n1	1785339531	QMKREZZGDPHNIZ-JYJNAYRXSA-N	427.343	1.265	50	20	IDGD	
C[C@@H](CBr)C(=O)Nc1ccc(C2(NC(=O)[C@@H](N)CCC(N)=O)CCC2)cc1	1786068935	GFUUJJKKUUJVAV-WFASDCNBSA-N	439.354	1.744	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnoc3COC)[C@H]2C1	1787723127	DBYZGZGTNQFKIU-MXAVVETBSA-N	444.326	1.588	50	20	IDGD	
Cn1c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](O)CCl)C[C@@H]32)ccc1C(F)(F)F	1787740807	JJNNFZZAENBBOP-VTPLQMEGSA-N	437.846	1.237	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)c1ccc2nc[nH]c2c1	1788330117	MRZRJMXQUDWEFH-GVAFMPQTSA-N	439.285	1.847	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(=O)nc4sccn34)C[C@@H]21	1789861691	IZUDPJOPVTXURV-XPCVCDNBSA-N	438.937	1.367	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nc[nH]c3[N+](=O)[O-])C[C@@H]21	1790962079	UFLBJKVJVGJWMV-YFKTTZPYSA-N	444.286	1.085	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4cncn4c3)C[C@@H]21	1791056370	VYBZTBNJFRADQO-CSFVBSKPSA-N	435.322	1.711	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)CBr)C[C@@H]21	1791249117	FIPQKUXTHBCVTK-PEDHHIEDSA-N	425.751	1.251	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CSC3CCCC3)C[C@@H]21	1791287970	IVMHRZCYKLGYGE-SZMVWBNQSA-N	440.610	1.015	50	20	IDGD	
CCOC(CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)CBr)C[C@@H]21)OCC	1791417421	DIIMWHCRVITDFU-UGUYLWEFSA-N	449.386	1.786	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cn1ccc2c(F)cccc21)c1ccc(B(O)O)cc1	1793056281	DCYNTRJJDYFQSZ-REPLKXPHSA-N	449.291	1.412	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCl)C1CN(C(=O)OCc2ccccc2)C1	1793112348	FDUBFGIKJVPISD-RDGPPVDQSA-N	449.935	1.493	50	20	IDGD	
CC(C)(C)OC(=O)N1C(=O)CC[C@H]1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCl	1793116111	GLLHKBAAKHZOSM-AIEDFZFUSA-N	443.928	1.150	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H]2C[C@@]2(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](O)CCl)C1	1793116174	HUBRGFOQCDKAOF-ATCDCCBLSA-N	441.956	1.481	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](CC)N(CC)CC	1793461604	GISIYNOSSZRKPZ-ZHCJQAHYSA-N	432.403	1.870	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CC(=O)OC(C)(C)C	1793588711	UYRPOIUMQNEPFL-NFFDBFGFSA-N	433.343	1.339	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C(F)(F)C(F)(F)C(=O)O)[C@@H](F)Br	1793977329	NOJKMEBEXSKJHQ-ULAWRXDQSA-N	437.159	1.670	50	20	IDGD	
Cc1cccc2c(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)CCBr)n[nH]c12	1795116573	ULRWCJAZNPMYFS-FVCICTRLSA-N	435.322	1.860	50	20	IDGD	
CO[C@@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1ccccc1	1795168759	FALNUKURDVIKPS-JKJDWNRSSA-N	429.286	1.654	50	20	IDGD	
O=C(/C=C\c1c[nH]c2ccccc12)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1	1796190008	RAEGJWVUDQJOTQ-MXEOVQSZSA-N	443.312	1.813	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cn(C)nc1C(F)F	1796705165	HUJQAQSHFHGIKT-GUDRVLHUSA-N	435.269	1.344	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CN(Cc2ccccc2)CCO1	1797248133	JFEGVRHOLBUUED-SSTJLMRISA-N	449.979	1.494	50	20	IDGD	
COc1cncc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CO[Si](C)(C)C)c1	1797952751	JVNRGICNACDPQK-UPHUGPLXSA-N	435.597	1.464	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ncccc1Br	1798187929	MXWKVKLBEHPICQ-ZMJPVWNMSA-N	446.729	1.301	50	20	IDGD	
Cc1nc2sccn2c1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Br	1799350378	XXOSOVSBGBQUSW-LSCVPOLPSA-N	445.314	1.598	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(-c2ccccc2)[nH]n1	1799386733	ZYWKDLLHKQTASQ-BCDXTJNWSA-N	438.532	1.702	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C[C@@H](O)CNC(=O)OC(C)(C)C)C2	1800074527	DRCMZCIKYVMVLC-YIDVYQOGSA-N	431.961	1.918	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(=O)C1CC1)C2	1800332172	DGCIRDXROQCXOE-AONCJLBWSA-N	429.423	1.440	50	20	IDGD	
Cc1cccn2ncc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@@H](C)Br)c12	1800762620	VWZNQFNHMCGTSU-HGTKMLMNSA-N	435.322	1.629	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CC(C)(C)C(=O)OC(C)(C)C)C2	1800979080	SEKIDBRVUFGIHL-IVSAIRAKSA-N	446.972	1.588	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(Cl)Cl	1801021019	FEGVGRYVTVTEES-DABQJJPHSA-N	438.352	1.685	50	20	IDGD	
C[C@H](Oc1cccnc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Br)C2	1801405305	MQFJEILWEYQJHH-YMSVYLFOSA-N	426.311	1.222	50	20	IDGD	
C/C=C(\C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN(C)NC(=O)NCc1ccccc1)C2	1801611499	DNAVGBKUGRBIJY-LDDVZMJFSA-N	427.549	1.937	50	20	IDGD	
COc1ccc(COCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CCC(=O)NN(C)C)C3)cc1	1802521212	XJBJHBYTIYXEDQ-REPLKXPHSA-N	446.548	1.223	50	20	IDGD	
Cn1nc(C(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)c2c1CCC2	1803143221	XEYQDJJGEFRVAY-DKSSEZFCSA-N	431.924	1.223	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)[C@H](C)CS(C)(=O)=O)[C@H]1c1cccnc1	1803586827	FHKDOPDUYVSEAL-MXASKKJJSA-N	429.970	1.786	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)[C@H](COC)NC(C)=O)[C@H]1c1cccnc1	1803692713	XBOPGZYQUGIRNA-VJANTYMQSA-N	438.956	1.646	50	20	IDGD	
Cc1ccc(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)o1	1803779105	IQUPDIYUYFMRED-NQIIRXRSSA-N	433.273	1.296	50	20	IDGD	
Cc1cc[nH]c1C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1805012660	QJRJKKPUXYAICU-LAUBAEHRSA-N	426.521	1.411	50	20	IDGD	
Cc1cncc(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)c1	1805767468	QZSKKJBTNZYDSI-SIKLNZKXSA-N	444.300	1.098	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)/C=C/c2ccoc2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807360515	BZRRWQMOXGNXQM-YMONZSNFSA-N	445.284	1.387	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H](CNC(=O)Cn2cncn2)[C@@H]1c1cccnc1	1807597439	VXTOHPCGWDOMTP-UNEWFSDZSA-N	435.326	1.410	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@H](CNC(=O)c2cnc(O)nc2O)[C@H]1c1cccnc1	1808280230	JULOTVLCUXLZNW-WMLDXEAASA-N	445.552	1.454	50	20	IDGD	
Cc1cc(NC(=O)CC(=O)NC[C@@H]2CCN(C(=O)[C@H](F)Cl)[C@H]2c2cccnc2)no1	1808394895	RVCIJXVAOZZEKS-KKXDTOCCSA-N	437.859	1.947	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)[C@H]3Cc4ccccc4O3)CC2)C1	1809972632	VVRJUJXTTWVVIB-JOCHJYFZSA-N	448.328	1.215	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2cnn3c2OCCC3)[C@@H]1c1cccnc1	1813034175	CWMYTHMVRTXQTB-RYQLBKOJSA-N	447.923	1.634	50	20	IDGD	
O=C(Cc1cccs1)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1	1815354841	URNCUPJGKYJXQA-AWEZNQCLSA-N	441.343	1.353	50	20	IDGD	
Cc1ccc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)cc1C	1815360903	QNHAPMUUGOVRNX-SFHVURJKSA-N	449.341	1.979	50	20	IDGD	
CCOCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[nH]n1	1816881851	MSMPXAKFNUUGNS-OHHQFBAHSA-N	429.481	1.572	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)Cc2ccccn2)[nH]n1)c1cccc(B(O)O)c1	1817475130	KVRRYJFADQLMLN-IBGZPJMESA-N	433.277	1.033	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)C/N=C/c2ccco2)[nH]n1)c1cccc(B(O)O)c1	1817476147	HLWFPXLSIVUHSK-BBMHEYIBSA-N	449.276	1.108	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@H](O)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](F)Cl)n[nH]1	1818035557	NUZLVZNERVIFJO-SGMGOOAPSA-N	447.895	1.822	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccns1)CC2	1819795587	PETWPQJGNALDQA-SECBINFHSA-N	443.514	1.138	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cncs1)CC2	1819795956	WHNVMGMTHUSFNS-SECBINFHSA-N	443.514	1.138	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)c3cnc(O)[nH]3)sc2C1	1820669811	GOYRZXBHOJLOBY-JGVFFNPUSA-N	428.312	1.971	50	20	IDGD	
CNC(=S)NCCC(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](Cl)COC)n[nH]1	1822369150	DAWSUCRXPATQAT-YPMHNXCESA-N	430.962	1.140	50	20	IDGD	
CC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](C)N1CCN(C)CC1)CC2	1822849045	FPSYFAQXXJMBAC-RDBSUJKOSA-N	428.002	1.708	50	20	IDGD	
C[C@H](C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCBr)[nH]n1)n1cnnn1	1822857112	WBXPXERAUIPRMX-ZYHUDNBSSA-N	425.291	1.435	50	20	IDGD	
CC(=O)C(C)(C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1	1824375018	GJDUBDPBKQLQDW-IBGZPJMESA-N	443.548	1.534	50	20	IDGD	
CCS(=O)(=O)N[C@H](C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H](F)Cl)CC1	1824459971	JTDHGSPIDVYHTK-BPLDGKMQSA-N	425.954	1.468	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)CCN2CCOCC2)CC1	1826749092	FWHPXEFRTDNUBA-RBUKOAKNSA-N	429.989	1.582	50	20	IDGD	
CC[C@H](NC)C(=O)N1CCCC[C@H]1C1CCN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)CC1	1827037148	OZTGUCDTHJUIDQ-PTBWTGOTSA-N	444.580	1.738	50	20	IDGD	
Cc1nc2ncccn2c1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H](O)CCl)CC1	1828229150	RNTDYANSJRWYGK-SJORKVTESA-N	433.940	1.871	50	20	IDGD	
O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)C1CC(F)(F)C1)CCO2	1829984783	MPZWKRXBOBSDSZ-OAHLLOKOSA-N	425.270	1.273	50	20	IDGD	
Cc1ccnc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)c1	1830538538	IQLPGYYPLXVROH-KXBFYZLASA-N	440.338	1.491	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)nc2ccccc12	1830728566	UZDSRDLLKAWLGO-DENIHFKCSA-N	447.919	1.213	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CC3CCN(C)CC3)C2)C1	1831638753	GFFALGDHHIHWSX-RXVVDRJESA-N	429.989	1.582	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)CCc3cccc(O)c3)CC2)CC1)[C@@H](O)CCl	1833312744	AVLUSORADRBELU-FQEVSTJZSA-N	437.968	1.496	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)c3ccccc3)CC2)CC1	1834583490	SWWPFVYEHVOEMI-UXHICEINSA-N	437.968	1.545	50	20	IDGD	
Cc1ncc(CC(=O)N2CCOC[C@@]3(CN(C(=O)CCBr)CCO3)C2)s1	1834826812	XAGGCZVIBJNKGS-QGZVFWFLSA-N	446.367	1.235	50	20	IDGD	
CCc1cc(C(=O)NC2CCN(C3CCN(C(=O)[C@H](C)Br)CC3)CC2)n[nH]1	1834923561	DZYKCAVMOQSASC-ZDUSSCGKSA-N	440.386	1.941	50	20	IDGD	
Cc1nnsc1C(=O)NC1CCN(C2CCN(C(=O)[C@H](C)Br)CC2)CC1	1835183520	KNCNOBHOLZXPAD-NSHDSACASA-N	444.399	1.815	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CCC(F)(F)F)CCO2)C1	1835328927	FLOJPSSMURRCCP-DOMZBBRYSA-N	445.276	1.959	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)C(Cl)Cl)CC2)CC1)c1ccc([N+](=O)[O-])[nH]1	1836197684	GHBFBCSFXMJRSC-UHFFFAOYSA-N	432.308	1.912	50	20	IDGD	
COc1ccc(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)c(C)c1	1836328783	RUPYCHKDCUEFIT-FQEVSTJZSA-N	437.968	1.789	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)c3nc[nH]c3[N+](=O)[O-])CC2)CC1	1836393958	DJDLOIFAAUNKOE-CQSZACIVSA-N	426.905	1.521	50	20	IDGD	
O=C(c1noc2c1CCCC2)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1836429473	CDRNGZAXIOQRAX-GOSISDBHSA-N	432.304	1.427	50	20	IDGD	
O=C(c1cc2cccnn2c1)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836718871	FYBOMNFHJHASHR-LJQANCHMSA-N	434.924	1.546	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cnc(Cl)s1)CCO2	1838158443	HCEJIFZOTHWQPE-QGZVFWFLSA-N	448.017	1.718	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(OC)c3)CCO2)C1	1838929573	VVHYLRSLFWREKJ-FXAWDEMLSA-N	426.897	1.019	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(OC(F)F)cn3)C2)C1	1839142995	IDTSGVIXTLAUJJ-IFXJQAMLSA-N	447.866	1.770	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)cc(O)n1	1839152228	RKGCCNHINKAQGS-MOPGFXCFSA-N	446.331	1.402	50	20	IDGD	
O=C(c1cnoc1C1CC1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839197736	GYUHFRMYELUUAZ-PBHICJAKSA-N	446.273	1.313	50	20	IDGD	
O=C(c1sccc1F)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839198885	OMQHVRYBADZPAZ-SWLSCSKDSA-N	439.278	1.648	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(-n4cncn4)c3)CCO2)C1	1839437015	ALWHNXFRROBBHT-WIYYLYMNSA-N	447.923	1.355	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccccc3O)CCO2)C1	1839909212	ZMEJEYJQAJSQJX-PMACEKPBSA-N	445.343	1.627	50	20	IDGD	
Cc1ncc(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)s1	1840400718	FKAOSOULYPDNDO-YVEFUNNKSA-N	446.367	1.234	50	20	IDGD	
O=C(c1csc(-c2ccccc2)n1)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843011272	NFKKJYYNTCYAII-UHFFFAOYSA-N	447.325	1.621	50	20	IDGD	
COc1ccc(/C=C(\C)C(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)cc1	1844265045	OWVAATHTTCPMBS-FOWTUZBSSA-N	449.511	1.614	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)C#CC2(O)CCCCC2)C1	1844282624	KYKKKPWDVWAYAD-KOEQRZSOSA-N	439.516	1.022	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CCOCCOCCOCCOC	1847870182	NMOUQDCQTVKSQC-FHWLQOOXSA-N	448.988	1.682	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H]1C[C@H]2CC[C@@H]1O2	1848098699	RIJCVYIPELXPSB-XDKXFUCDSA-N	441.956	1.888	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)C1CCN(Cc2ccccn2)CC1	1848246104	TWSTYEJGXQXDDK-AABGKKOBSA-N	434.968	1.749	50	20	IDGD	
Cc1ccc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)C(=O)NC3CC3)cc2)cc1C	9890035	WSSYWBKFNXIDEP-UHFFFAOYSA-N	430.486	1.144	50	20	IDGD	
Cc1[nH]c(=O)[nH]c(=O)c1CCC(=O)NNC(=O)COc1ccccc1Cc1ccccc1	14323504	REKDQNOJQRPNLA-UHFFFAOYSA-N	436.468	1.121	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)c2cccc(S(=O)(=O)NC3CC3)c2)nc2ccccc21	17411208	GICBMNOPKPNGOE-UHFFFAOYSA-N	427.486	1.018	50	20	IDGD	
Cc1ccc(S(=O)(=O)NC(C)(C)C)cc1C(=O)NNC(=O)[C@@H]1COc2ccccc2O1	26974341	TZFYFODVDBJNKZ-SFHVURJKSA-N	447.513	1.673	50	20	IDGD	
CCOc1ccc(NC(=S)NNC(=O)c2cccc(S(=O)(=O)N(C)OC)c2)cc1	28633657	TUSSWBDVJILWLC-UHFFFAOYSA-N	438.531	1.899	50	20	IDGD	
Cc1c(NNC(=O)NCC(=O)N2CCN(C(=O)OC(C)(C)C)CC2)cccc1[N+](=O)[O-]	728130104	UWZHMLSLUIZMRV-UHFFFAOYSA-N	436.469	1.609	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1Cl	728455134	BKZQPZPZTQHLMU-UHFFFAOYSA-N	437.905	1.744	50	20	IDGD	
COc1ccccc1[C@H](C)CC(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	728511857	DQJJFHDVXOPSGP-LLVKDONJSA-N	425.894	1.951	50	20	IDGD	
CN(C)C(=O)C[C@H](NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)c1ccccc1	729051341	PWACZDBYEXBLLV-SFHVURJKSA-N	439.520	1.243	50	20	IDGD	
Cc1cc(Cl)ccc1OCCCC(=O)NNC(=O)Cc1c(C)[nH]c2ccnn2c1=O	729296062	SQNZYFWHFLEKIZ-UHFFFAOYSA-N	431.880	1.842	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)Cn2ccc3ccccc32)cc(S(=O)(=O)N(C)C)c1C	729450504	YMLGPGTZODICEI-UHFFFAOYSA-N	428.514	1.970	50	20	IDGD	
COc1ccccc1N(C)S(=O)(=O)c1ccc(C)c(C(=O)NNC(=O)c2cnn[nH]2)c1	729456060	OZISWCXEIZEQQV-UHFFFAOYSA-N	444.473	1.022	50	20	IDGD	
Cc1nn(-c2cccc(C(F)(F)F)c2)c(C)c1C(=O)C(=O)NNC(=O)Cc1cc[nH]n1	730102439	CQURKYVUUFGDLV-UHFFFAOYSA-N	434.378	1.804	50	20	IDGD	
CCOc1ccc(OCc2ccc(C(=O)NNC(=O)CN3CCC(=O)NC3=O)cc2)cc1	731957391	YZTTXMCRGBIPDG-UHFFFAOYSA-N	440.456	1.367	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCC(C)(C)N2CCOCC2)cc1Br	732236827	XXQLQAGOCPYOSE-UHFFFAOYSA-N	429.315	1.513	50	20	IDGD	
CN1CCN(CC(=O)NNC(=O)c2ccc(CSc3nc4ccccc4[nH]3)cc2)CC1	732267406	YOLRYNAENUFMJF-UHFFFAOYSA-N	438.557	1.864	50	20	IDGD	
COC1(C(=O)NNc2nc3ccccc3c(=O)n2C)CCN(C(=O)OC(C)(C)C)CC1	733261603	URZMEGMCRTTWLF-UHFFFAOYSA-N	431.493	1.793	50	20	IDGD	
CCCN(C)c1ccc(C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)cc1	735117213	CYCOZZYVWAUARX-UHFFFAOYSA-N	446.577	1.621	50	20	IDGD	
O=C(COC(=O)c1cc(O)nc2ccc(F)cc12)NNC(=O)c1cccc([N+](=O)[O-])c1	738808991	KEYYURIWPHYHCJ-UHFFFAOYSA-N	428.332	1.606	50	20	IDGD	
CCOC(=O)[C@@H](NNC(=O)CNC(=O)c1ccco1)c1ccc(Br)cc1F	739993423	BPLSTRUZVDSSNO-HNNXBMFYSA-N	442.241	1.836	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H](CCCO)c2ccccc2)c1	741095137	YZQFBNWJPHEXOL-GOSISDBHSA-N	434.518	1.395	50	20	IDGD	
CC(=NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)c1ccc(S(C)(=O)=O)c(F)c1	741756709	HVVKKFGCRDAHTH-UHFFFAOYSA-N	441.506	1.634	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NC[C@H](C)Oc1ccccc1F	743510118	QDFNPMRPWWZDFJ-LBPRGKRZSA-N	437.497	1.839	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N[C@@H](C)CN2CCN(c3ccccc3)CC2)cc1OC	743520162	DRVBEYQGDRQXKS-KRWDZBQOSA-N	441.532	1.859	50	20	IDGD	
COc1ccc(CCNC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)c(OC)c1	743571113	VNEHHKPHRBXFMN-UHFFFAOYSA-N	436.490	1.686	50	20	IDGD	
CC(=O)N1C=Cc2ccccc2[C@H]1CC(=O)OCC(=O)NNC(=O)c1ccc(C#N)cc1	744522603	JRKOQSXLGVKDJA-HXUWFJFHSA-N	432.436	1.827	50	20	IDGD	
CS(=O)(=O)NC1(CNC(=O)NNC(=O)c2cccc(Br)c2)CCCCC1	745430236	XEJJBZYMLCFHKH-UHFFFAOYSA-N	447.355	1.645	50	20	IDGD	
CC(C)(C)C(=O)Cn1cc(C(=O)NNC(=O)c2ccc(F)cc2Br)nn1	746136237	IZDJCMMHYFNWJD-UHFFFAOYSA-N	426.246	1.870	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2ccccc2F)cc(Br)cc1S(N)(=O)=O	747199289	GTAQAQBRBBGNEB-UHFFFAOYSA-N	430.255	1.619	50	20	IDGD	
COCCN(CCOC)S(=O)(=O)c1ccc(C(=O)NNc2ccc(C#N)cc2)cc1	748104838	HEYICYJVSUTKSG-UHFFFAOYSA-N	432.502	1.599	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CCc2ccco2)cc1S(=O)(=O)Cc1cc(C)no1	748262103	QLALQENQUVRMPH-UHFFFAOYSA-N	447.469	1.952	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)N2CCN(CCS(N)(=O)=O)CC2)c(C)n1C1CCCCC1	748369177	DWEKSMWOIJJYBY-HMMYKYKNSA-N	447.605	1.950	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)[C@@H](c2ccccc2)n2cccn2)ccc1Cl	748697805	VZXGABWQYVPKIH-MRXNPFEDSA-N	433.877	1.235	50	20	IDGD	
COC[C@@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1)C1CC1	750447465	SMTCWUXFVKMEKN-LJQANCHMSA-N	446.529	1.534	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)c1cc(S(=O)(=O)NC(C)(C)C)ccc1Cl	751391054	GBEFEWZSGVATFH-UHFFFAOYSA-N	446.957	1.483	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CCN2C[C@H](C)O[C@@H](C)C2)cc(OC)c1Br	751425094	DXZWEGWKISRESN-RYUDHWBXSA-N	444.326	1.727	50	20	IDGD	
C[C@@H](NC(=S)NNC(=O)CCn1cnc2ccc(Br)cc2c1=O)C1CC1	751617666	KBHXITJHVZRXHU-SNVBAGLBSA-N	438.351	1.843	50	20	IDGD	
COC(=O)[C@H]1c2ccccc2CCN1CC(=O)NNC(=O)c1cc(Cl)ccc1OC	752302337	OALPPHMNTZUFTD-LJQANCHMSA-N	431.876	1.882	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)c1ccnc(O[C@@H]2CCOC2)c1	754009876	NBODYRTUTOWPHO-OAHLLOKOSA-N	436.262	1.852	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)co1	756015055	XINBRVDXSNPYMP-UHFFFAOYSA-N	428.417	1.457	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)Nc1ccc(S(=O)(=O)/N=C2\CCCN2C)cc1	756074347	YBHSGNAPHAKFDW-HKOYGPOVSA-N	445.501	1.975	50	20	IDGD	
NC(=O)CCNC(=O)c1cccc(NC(=O)NNC(=O)c2cc(-c3ccccc3)on2)c1	756391147	KOMDSIJRZRHMRO-UHFFFAOYSA-N	436.428	1.413	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)c2ccccc2O)ccc1S(=O)(=O)N1CCCC1	756583628	CROSVQOEXWCEOG-UHFFFAOYSA-N	434.474	1.652	50	20	IDGD	
CN(C)C(=O)Cn1cnc(NC(=O)NNC(=O)c2ccc(-c3ccc(F)cc3)s2)n1	756769329	DWEVTTZVDDZKCL-UHFFFAOYSA-N	431.453	1.700	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCCCO[C@H]1CCOC1	756915769	CKMVOJFCKJAMHW-DOMZBBRYSA-N	430.299	1.742	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)Nc1ccc(C)c(S(=O)(=O)NC2CC2)c1	757865471	MIUQHLVKSJECGM-UHFFFAOYSA-N	448.501	1.676	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)CCc1cc(Cl)ccc1Br	758045490	OSLALXWKCFSSMT-QMMMGPOBSA-N	426.720	1.120	50	20	IDGD	
CCc1nc(C(=O)N2CCN(S(=O)(=O)CBr)CC2)nn1-c1ccccc1	758519287	XYMOSCOYMOZYHW-UHFFFAOYSA-N	442.339	1.270	50	20	IDGD	
Cc1ccc(-n2cnnc2SCC(=O)NNC(=O)C(=O)Nc2ccccn2)cc1C	758841281	VZSKZBBKMKXEMN-UHFFFAOYSA-N	425.474	1.157	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccnn2[C@H](C)C2CC2)cc1	760276814	DDOGBXGPAPCOBH-KGLIPLIRSA-N	429.477	1.806	50	20	IDGD	
Cc1cc(C)nc(-n2nccc2NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)n1	760280693	XCBBBFKRGZVGHK-UHFFFAOYSA-N	443.851	1.097	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)c1cn(-c2ccccc2C(F)(F)F)nn1	760439314	JQNNKNJPTPOEDQ-UHFFFAOYSA-N	442.398	1.962	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	761794289	HOLBDCFRORMUPZ-MRXNPFEDSA-N	441.444	1.495	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NN[C@@H](C(N)=O)c2cccc(Br)c2)c1	763377549	RHFMKMDMBMDVAH-CQSZACIVSA-N	426.292	1.314	50	20	IDGD	
COc1cccc(Cn2nccc2NC(=O)C(=O)NNC(=O)c2ccccc2O)c1OC	763530429	VIHSZOLXQNBTFN-UHFFFAOYSA-N	439.428	1.054	50	20	IDGD	
O=C(C[C@@H]1NC(=O)NC1=O)NNC(=O)c1ccc(CSc2nc3ccccc3[nH]2)cc1	763546403	OZBLCEXEDJYMCF-HNNXBMFYSA-N	438.469	1.214	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1C(=O)NC(C)C	763578871	RBRWPVGTKNNCNA-SFHVURJKSA-N	440.456	1.059	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)COc2cccc(C)c2)c(C)c1	763623808	HTHVFFVCWKRJFX-UHFFFAOYSA-N	429.429	1.020	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N1CCC[C@@H](S(C)(=O)=O)C1	763642348	QKBZNVNEBVTFMT-BXUZGUMPSA-N	448.339	1.466	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)COc2cc(C)ccc2C)cc1NC(C)=O	763665020	BVGADWKOTQIUPE-UHFFFAOYSA-N	428.445	1.435	50	20	IDGD	
CN(C)CC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)cc1	763735778	RZHLLJBLUHPZLR-UHFFFAOYSA-N	441.532	1.489	50	20	IDGD	
CCn1cnnc1-c1cccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)c1	763866374	VSZSZOSTZLUGDS-CYBMUJFWSA-N	440.435	1.658	50	20	IDGD	
Cc1nc(-c2ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc3ccc(F)cc3)cc2)n[nH]1	763871903	IOPFANCCJDWFEM-NSHDSACASA-N	426.408	1.473	50	20	IDGD	
CC(=O)Nc1ccc(C)c(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(C(C)=O)cc2)c1	763872122	KLJRXQCSJHJZLE-CQSZACIVSA-N	440.456	1.709	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1csc(-c2ccccn2)n1	763872691	OHYAVOPLKQMUQN-LLVKDONJSA-N	429.433	1.898	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)C(=O)Nc2ccc(-n3cncn3)c(F)c2)cc1	763897653	AFJLUBDACQYZQR-UHFFFAOYSA-N	428.449	1.593	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)NCC)cc2)cc1OC	763910296	CJDJRXLEPBEPSD-UHFFFAOYSA-N	442.472	1.633	50	20	IDGD	
COC(=O)CCOc1ccc(NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)cc1	763979440	VRDOCEMDHRDHPH-UHFFFAOYSA-N	435.820	1.387	50	20	IDGD	
CCS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2OC)cc1	764012431	QEAPOJJOEXYBED-UHFFFAOYSA-N	439.877	1.542	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1cccc(OCC(=O)N(C)C)c1	764012638	UCOFPXGXQSNZJB-UHFFFAOYSA-N	448.863	1.215	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)CCCN3C(=O)OC(C)(C)C)n[nH]1	764106751	QSTQBCPGOBJCCM-UHFFFAOYSA-N	442.476	1.806	50	20	IDGD	
CN1CCC/C1=N\S(=O)(=O)c1cccc(NC(=O)C(=O)NNC(=O)CC2CCCC2)c1	764183183	DIRGAEZBGRYSCW-JJIBRWJFSA-N	449.533	1.166	50	20	IDGD	
COc1ccc(C(=O)N2CCCC2)cc1NC(=O)C(=O)NNC(=O)c1cccc(C#N)c1	764236942	HNEPJWJQDAWADZ-UHFFFAOYSA-N	435.440	1.203	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1cc(F)c(N2CCCCC2)c(F)c1	764275602	OTJIDPXSSYSPCM-UHFFFAOYSA-N	448.426	1.826	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cccc(C)c3F)n[nH]2)cc1OC	764379176	RNINYERKOCPTEW-UHFFFAOYSA-N	441.419	1.941	50	20	IDGD	
COC(=O)c1[nH]c(C)cc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	764387664	MBOKJQVDEIKBSW-UHFFFAOYSA-N	428.380	1.039	50	20	IDGD	
CN1CCN(Cc2ccc(C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)cc2)CC1	765312926	HIMHZDOTWRSGGP-UHFFFAOYSA-N	433.553	1.500	50	20	IDGD	
COCCNS(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)c1	765568293	PFSZACXJZQMYEW-UHFFFAOYSA-N	449.514	1.138	50	20	IDGD	
CCn1c(=O)c(=O)[nH]c2cc(C(=O)NNC(=O)c3cc(-c4cc(C)ccc4C)[nH]n3)ccc21	765576056	MQEUCSOGAXKUIH-UHFFFAOYSA-N	446.467	1.791	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N[C@H](C)c3ccccc3)c2)n[nH]1	765587438	WINPALNTWYJKBN-CQSZACIVSA-N	427.486	1.832	50	20	IDGD	
CC1=C(C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)C(=O)OC1(C)C	766663772	NNPZIJHCHKCWLQ-UHFFFAOYSA-N	434.924	1.257	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NCC(=O)NNc1c(F)cc(F)cc1Br	767027907	QDZTVQRGHPAYMQ-UHFFFAOYSA-N	437.241	1.811	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)[C@@H]2CCCN(C(=O)N3CCCC3)C2)n[nH]1	768273949	LBMOQCVKAZXDGF-OAHLLOKOSA-N	440.504	1.774	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)[C@H](C)NS(=O)(=O)c1ccc(C)cc1	768641279	QPQYLGBREPMCPR-ZDUSSCGKSA-N	441.531	1.217	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)c2ccc(S(N)(=O)=O)cc2F)cc1	769739183	VUABUXABBBGIEO-NSHDSACASA-N	425.438	1.100	50	20	IDGD	
CN1CCN(CC(=O)N(C)c2ccc(NC(=O)NNc3ccc(Cl)nn3)cc2)CC1	770024097	TZRYDEXZZJCCMB-UHFFFAOYSA-N	432.916	1.489	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)N[C@@H](C)[C@H]2CN(C)CCO2)cc(OCC)c1OCC	770124825	SSAVTSPQJICCMI-KBXCAEBGSA-N	438.525	1.546	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)N[C@@H]1C[C@H](C)N(c2cnn(C)c2)C1=O	770654753	CWFNELLJFYFOCT-MQIPJXDCSA-N	434.884	1.365	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NCc1nc(COc2ccccc2)n[nH]1	771374694	BBITUOSIKHIVPY-ZDUSSCGKSA-N	428.424	1.821	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2cc(-c3ccc4c(c3)CCO4)no2)n1	771426004	AVXAXNZTFBPCGN-UHFFFAOYSA-N	442.453	1.588	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)C1CCN(C(=O)c2ccc(F)cc2F)CC1	771900267	HRFIGXDWJXCSNN-ZDUSSCGKSA-N	439.459	1.942	50	20	IDGD	
CON(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)c1	772965136	BXMBXWWOTMHSDE-GFCCVEGCSA-N	441.893	1.750	50	20	IDGD	
COc1cccc(C(=O)NNS(=O)(=O)c2cc(Cl)ccc2CS(C)(=O)=O)c1O	774614540	FVWRTWZQPNYFPZ-UHFFFAOYSA-N	448.906	1.222	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NC[C@H]2CC[C@H](C(=O)N(C)C)O2)cc1Br	774715420	FQKRDRLJZBNVEM-BXUZGUMPSA-N	443.298	1.038	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)COC2CCN(C(=O)OC(C)(C)C)CC2)nc1C	777178379	UXFCCXGUGUXYIM-UHFFFAOYSA-N	437.497	1.821	50	20	IDGD	
COc1cccc([C@@H]2[C@H](C(=O)NNC(=O)CNC(=O)OC(C)(C)C)CC(=O)N2C2CC2)c1	778442792	FAQRTDRLWRRMLD-VQIMIIECSA-N	446.504	1.419	50	20	IDGD	
Cn1ncc2c(O)nc(CCC(=O)NNc3ccc([N+](=O)[O-])cc3Br)nc21	779145478	VDGKMDAEIKKYBU-UHFFFAOYSA-N	436.226	1.816	50	20	IDGD	
C[C@@]1(NNC(=O)N[C@@H]2CCN(c3ccc(Cl)c(Cl)c3)C2=O)CCS(=O)(=O)C1	779380414	RPBFHKZBIAJSEP-CZUORRHYSA-N	435.333	1.480	50	20	IDGD	
COc1cc(Br)ccc1CCC(=O)NNC(=O)CNC(=O)c1cccnc1	782555182	JJGCBWPRZRGVGM-UHFFFAOYSA-N	435.278	1.363	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)c(C)c1	783263934	MTFCTLBKHXSPOD-UHFFFAOYSA-N	435.506	1.557	50	20	IDGD	
O=C(NNc1ccc(F)cc1F)C(=O)Nc1cc(N2CCCS2(=O)=O)ccc1F	783339531	AZMXDHPKODRYTE-UHFFFAOYSA-N	428.392	1.726	50	20	IDGD	
CC1CCN(CCc2cccc(NC(=O)C(=O)NN[C@@]3(C)CCS(=O)(=O)C3)c2)CC1	783427245	NPUSIGKAYWODCC-NRFANRHFSA-N	436.578	1.098	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)N[C@@H]1COc2cc(F)cc(F)c21	784574322	CTXDHGJDQOISKL-GFCCVEGCSA-N	439.444	1.644	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)C(=O)Nc2ccc(OCc3nc(C)no3)cc2)c1	784852137	RCOKHDHZSGBMJZ-UHFFFAOYSA-N	425.401	1.825	50	20	IDGD	
CCNC(=O)COc1ccc(NC(=O)C(=O)NNc2cccc(C(F)(F)F)n2)cc1	784957846	ICHWLDIGROCIMW-UHFFFAOYSA-N	425.367	1.697	50	20	IDGD	
COC(=O)CCNC(=O)c1ccc(NC(=O)C(=O)NNc2cc(F)c(F)c(F)c2)cc1	785086590	AIAULGDQNAJOKC-UHFFFAOYSA-N	438.362	1.479	50	20	IDGD	
COC[C@@H](C)n1c(C)cc(/C=C(\C#N)C(=O)N2CCN(c3cnc(O)nc3N)CC2)c1C	788156004	WWZXFGNZDWZYFK-BFERYNQYSA-N	439.520	1.646	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2cccc3c2OCC[C@@H]3N(C)C)c1	789733245	ZTZVNCMZTZZATJ-SFHVURJKSA-N	426.473	1.545	50	20	IDGD	
COc1cc(NNC(=O)C(=O)Nc2cccc(CN3C(=O)CNC3=O)c2)ccc1Cl	789804707	LUJSATRBGUFECV-UHFFFAOYSA-N	431.836	1.482	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)CC2OCCO2)c1	792771938	CLXASXBSUHNSBX-UHFFFAOYSA-N	435.458	1.020	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)CS(=O)(=O)c2ccc(C(C)=O)c(F)c2)cc1	792801633	BWOSXXAALMSVSE-UHFFFAOYSA-N	436.461	1.591	50	20	IDGD	
CCS(=O)(=O)c1ccc(F)c(C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)c1	794722608	YLRSSOBTLSDFHU-UHFFFAOYSA-N	429.495	1.627	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)CN[C@@H](CO)c2ccc(Br)c(F)c2)cc1	795350368	RJYOHNIXCKBTEB-INIZCTEOSA-N	435.253	1.544	50	20	IDGD	
COC(=O)c1cc(F)cc(NC(=O)C(=O)NNC(=O)c2cccc(OC(F)F)c2)c1F	797003692	FFLXBLLNUOIHCI-UHFFFAOYSA-N	443.309	1.753	50	20	IDGD	
CN(CCNC(=O)NNC(=O)C(C)(C)c1ccccc1)S(=O)(=O)c1ccc(F)cc1	798063665	XGQQUIXLQILANR-UHFFFAOYSA-N	436.509	1.754	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)[C@H]2CCc3cnn(C)c3C2)c2ccccc2c1=O	798829295	FGVISCUNGYDFGH-HNNXBMFYSA-N	436.516	1.886	50	20	IDGD	
O=C(NNS(=O)(=O)c1cccc(Br)c1F)c1cc([N+](=O)[O-])ccc1O	799123194	OCUFJFDZJHICAN-UHFFFAOYSA-N	434.199	1.825	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2ccc(Br)cc2)cc1-n1cnnn1	801994370	OUCQERGIZIXBDG-UHFFFAOYSA-N	432.238	1.900	50	20	IDGD	
COc1ccc(NC(=O)NNc2ccc(-n3ccnc3)nn2)cc1S(=O)(=O)NC1CC1	806293497	SNTGHBVFTMMFCZ-UHFFFAOYSA-N	444.477	1.260	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)C2CCN(CC(F)F)CC2)c1	806306209	JHYUOMSQNOGIAY-UHFFFAOYSA-N	446.520	1.455	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cnn(CC(C)C)c1C1CC1	806973554	RFFBVKRBBFKZCU-UHFFFAOYSA-N	429.477	1.590	50	20	IDGD	
CN(CCNC(=O)NNc1ccc2c(=O)[nH]ccc2c1)S(=O)(=O)c1ccc(F)cc1	807204535	FWLDLTGOLPLDIV-UHFFFAOYSA-N	433.465	1.614	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)Nc1ccc2c(c1)C(=O)N(CC1CC1)C2=O	808832468	NXVQWBBBRFTIDQ-UHFFFAOYSA-N	433.424	1.796	50	20	IDGD	
COC(=O)C[C@@H](C)CC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	809558442	ZXSDHUJXPWMQFV-LBPRGKRZSA-N	439.515	1.899	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)Cn1nc(C(F)(F)F)cc1C	809980951	XQWSPSCDGNDYTR-UHFFFAOYSA-N	432.428	1.273	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCC(=O)NNc2nc(-c3ccccn3)nc3c2CCC3)cc1	810442480	UYFDJHKOLALDSM-UHFFFAOYSA-N	438.513	1.757	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)N1CCC[C@H](CNC(=O)C(F)(F)F)C1	811850592	AHUPLBDRALUXKT-GFCCVEGCSA-N	426.399	1.388	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)CN2C(=O)[C@H](C)Oc3ccccc32)c2ccccc2c1=O	811904561	HBUQGTDCBDYXJN-AWEZNQCLSA-N	449.467	1.382	50	20	IDGD	
CC(=O)N1c2ccc(S(=O)(=O)NNC(=O)[C@@H]3COc4ccccc4O3)cc2C[C@H]1C	812536321	XVAKLMCZLYRJCG-BLVKFPJESA-N	431.470	1.134	50	20	IDGD	
CCc1c(NC(=O)C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)cnn1CC(C)C	813033097	FDSGPKMXSVTCIR-UHFFFAOYSA-N	436.538	1.434	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccccc2OC(F)F)cc1	813033388	QTRHXRQPGIHWQW-UHFFFAOYSA-N	428.417	1.620	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCc2nncn2C1)C(=O)Nc1cccc(CSC2CCCC2)c1	815692050	IHTDKHOYXLCDMK-OAHLLOKOSA-N	442.545	1.802	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1ccccc1NC(=O)C1CC1	815734572	NPANQQOWSYGIJZ-UHFFFAOYSA-N	444.513	1.813	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1cccnc1OCC(F)F	815751657	IPGRSPWGKZSQHV-UHFFFAOYSA-N	443.432	1.058	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)C(=O)Nc2cnn(C)c2C2CC2)c1	815866769	NZLHBGZDYAWTRA-UHFFFAOYSA-N	436.266	1.928	50	20	IDGD	
CCn1c(S)nc2cc(C(=O)NNc3ccccc3S(=O)(=O)N(C)C)ccc2c1=O	817052614	JCRVGJDFZQTOGY-UHFFFAOYSA-N	447.542	1.712	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)C[C@H]1C[C@H]2CC[C@H]1C2	863950168	ZWLSKKMSKPXCBO-GBESFXJTSA-N	449.573	1.614	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)[C@@H]2CCCN(C(=O)Cc3ccccc3)C2)cc1	914942469	LHOSTLIXUGBSGN-HXUWFJFHSA-N	437.496	1.781	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2oc3c(c2C)C(=O)CCC3)cc1	915109848	NWWBMNNYKGYHIT-UHFFFAOYSA-N	433.486	1.497	50	20	IDGD	
Cc1cc(C=NNC(=O)Cn2nnc(-c3ccccc3)n2)c(C)n1CCN1CCOCC1	915938123	QPUHMRRCQRXRIQ-UHFFFAOYSA-N	436.520	1.241	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCc2ccc(N3CCCC3=O)cc2)c2ccccc2c1=O	916218299	GOUITJNZDVOYFF-UHFFFAOYSA-N	448.483	1.687	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCCCN2C[C@H](C)O[C@@H](C)C2)nc1	916249781	KCYSGNFGUMSQSY-HOTGVXAUSA-N	442.586	1.238	50	20	IDGD	
CCS(=O)(=O)N1CCC(NC(=O)NNC(=O)c2ccc(OCCC(C)C)cc2)CC1	916260068	PHNHUUOCPGAZSJ-UHFFFAOYSA-N	440.566	1.870	50	20	IDGD	
COc1cc(C=NNC(=O)c2sc(N3CCOCC3)nc2C)cc(OC)c1OC(C)=O	916338748	ZVYBVNJPQLODCG-UHFFFAOYSA-N	448.501	1.995	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)c2ccc3c(c2)S(=O)(=O)N(C2CC2)C3=O)c1	916744841	ZSTBNRZIMFIQIZ-UHFFFAOYSA-N	445.453	1.086	50	20	IDGD	
CSC[C@H](C(=O)NNC(=O)c1c(C)nc2ccccn12)N1C(=O)[C@@H]2CCCC[C@H]2C1=O	917360467	ZHROOIAYHXADMY-RBSFLKMASA-N	443.529	1.311	50	20	IDGD	
COc1ccc(CNC(C)=O)cc1S(=O)(=O)NNC(=O)C12CC3CC(CC(C3)C1)C2	917720144	CUIQOOGHDVUKTJ-UHFFFAOYSA-N	435.546	1.857	50	20	IDGD	
O=C(CCN1CCCS1(=O)=O)NNC(=O)COc1ccc(OCc2ccccc2)cc1	918199772	DEHRFFBAGBFLHY-UHFFFAOYSA-N	447.513	1.217	50	20	IDGD	
Cc1ccccc1-n1ncc(C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)c1C(F)(F)F	919886707	UCTIPPCOKLGOGO-NSHDSACASA-N	445.423	1.331	50	20	IDGD	
COC(=O)Cc1csc(NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)n1	920929637	VAJYIPHEPVVZJF-UHFFFAOYSA-N	446.533	1.224	50	20	IDGD	
CCOc1ccc(CN(C)C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1OC	1251628572	FCYGZJAIBDUNIH-UHFFFAOYSA-N	442.520	1.973	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H]2CCCCN2Cc2ccncc2)c1	1318462315	FEIGOBOONZIJNU-LJQANCHMSA-N	445.545	1.148	50	20	IDGD	
O=C(NC[C@H](c1ccccc1)N1CCOCC1)NNC(=O)c1cncn1-c1ccccc1	1321717706	BETCHXSODISGOG-HXUWFJFHSA-N	434.500	1.890	50	20	IDGD	
CN(C)N(C(=O)c1cn(-c2ccc(Br)cc2)nn1)[C@@H]1CCS(=O)(=O)C1	1322696651	CHCJIWKCFFWGGV-CYBMUJFWSA-N	428.312	1.136	50	20	IDGD	
CCOC(=O)[C@@H](C)NC(=O)c1ccc(NC(=O)NNC(=O)c2ccc(OC)cc2)cc1F	1325357763	XBFCDZCCVSFYOB-GFCCVEGCSA-N	446.435	1.982	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2nc(C)ncc2Br)c2ccccc2c1=O	1325927300	QRVXLSMNDWBOHE-UHFFFAOYSA-N	445.277	1.742	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)c(C)n1CC1CC1	1333588932	WQQJSZIUHRHKKS-UHFFFAOYSA-N	437.544	1.734	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1cc(=NCc2ccccc2)cc[nH]1	1519123038	AFDBGSAVNPGKMN-UHFFFAOYSA-N	431.500	1.583	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4nccn4c3)C2)C1	1778016930	XVUIOGAURNCPTG-DNVCBOLYSA-N	435.322	1.951	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(Cl)c4nncn4c3)C2)C1	1778947008	SHPIDRHANMEAGD-SCLBCKFNSA-N	426.304	1.844	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cccc3c2NC(=O)C3=O)C1	1779151742	RXJRWNLCTAIBHN-WJONJSRFSA-N	447.919	1.966	50	20	IDGD	
C[C@H](C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2)n1ccccc1=O	1779266542	AEMVAYFKMGWVTA-NIKGAXFTSA-N	430.332	1.476	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1nc3ccc(F)cn3n1)CCO2	1779299040	MUSQZIRNYCOELI-LJQANCHMSA-N	435.532	1.163	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)Nc2cnccn2)C1	1779393932	FMRMWZRPDZSWKX-ZFCANOHDSA-N	439.944	1.045	50	20	IDGD	
CCCNC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CO[Si](C)(C)C)C1	1779539967	XIVGKTZCJCGJPW-DYESRHJHSA-N	441.645	1.658	50	20	IDGD	
COc1cc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](F)Cl)CCO3)c([N+](=O)[O-])cc1O	1780193908	AQMXALABBCGFFT-PBHICJAKSA-N	431.804	1.287	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)c(O)n1	1780269696	RKNFSQYMHILJOM-SGTLLEGYSA-N	426.311	1.570	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H]1CCNC(=O)C1)C2	1780714384	BUISMEDNDIFEQE-QABNGEJJSA-N	434.364	1.263	50	20	IDGD	
Cc1cnn(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](F)Br)C2)c1	1780773802	XAVSCQKAFNYYBB-UKPHBRMFSA-N	431.306	1.396	50	20	IDGD	
CCOc1c(F)cc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)cc1Cl	1781848425	JUTRYPMLACXISB-DNVCBOLYSA-N	449.306	1.921	50	20	IDGD	
C=CCNC(=O)/C=C\C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)Br)C1	1781995554	PNXRQILMMUNWER-FPMDKBBYSA-N	442.354	1.142	50	20	IDGD	
CC[S@@](=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)Br)C1	1781997577	CPMDNALNLNTGRE-KFBOSPLFSA-N	437.400	1.442	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)CN3CCSCC3)CCO2)C1	1783339543	SLNDANBGGFGQQS-YOEHRIQHSA-N	434.400	1.039	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)Cc3noc(C(C)C)n3)CCO2)C1	1783345068	YNGAAPDRLKUWKI-UGSOOPFHSA-N	443.342	1.739	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](C)Br)C3)C2)nn1C(F)F	1783539228	ZIYRELXQRPCQLA-ZBEGNZNMSA-N	435.269	1.814	50	20	IDGD	
C/C(=C\c1cccs1)C(=O)N1CCO[C@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1	1783933302	UKZLGZOIJKXYER-WMJZSHNHSA-N	434.562	1.354	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(-c4ccccc4)no3)C[C@@H]21)[C@@H](O)CCl	1784091360	PPECAAPHWCXBLD-MRHSLFKSSA-N	433.892	1.535	50	20	IDGD	
CCOC(CC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2)OCC	1784167279	SJNQWQNCFNSGDB-ROUUACIJSA-N	425.353	1.842	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)[C@]3(C)CC=CCC3)C2)C1	1784752352	IBZRURPPSFNAEF-WOMORPIMSA-N	441.532	1.697	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(CCN(C(=O)C3(F)CCC3)C2)C1	1784880901	VMFOSIILSXRHNP-HXUWFJFHSA-N	449.435	1.856	50	20	IDGD	
CCc1[nH]nc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]32)c1F	1785794573	WBWVBHLSQZMGCC-FNCVKVGOSA-N	435.327	1.941	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCN3Cc4ccccc4C3=O)C[C@@H]21)[C@@H](F)Cl	1787447497	ZAIHIUIXSTUVBG-PCODUJHASA-N	437.899	1.547	50	20	IDGD	
CC(C)n1cnc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]32)n1	1787671076	HTVXLTFGLOGEOZ-WZTLGTBRSA-N	432.352	1.689	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)COc3cc(Cl)ccn3)[C@H]2C1	1788730051	KLEAIIGJGZZBPQ-HNKHHVNMSA-N	446.331	1.347	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4ncccn4n3)C[C@@H]21)[C@H](F)Br	1789926025	LDRWUHIEOZDNTD-UHXUCMFUSA-N	440.273	1.013	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3c(O)cc(O)cc3O)[C@H]2C1	1790158315	MORGIVVQCCNNCE-YOLKCXPHSA-N	443.294	1.180	50	20	IDGD	
Cc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CO[Si](C)(C)C)C[C@@H]32)nc2nccn12	1790407642	CXRHORCECRJELW-BQFCYCMXSA-N	445.596	1.483	50	20	IDGD	
C[C@H](CN)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C(C#N)=C/c3ccc(F)cc3F)[C@H]2C1	1790694016	BIQVPKNMTJIRJX-CAVRUCQQSA-N	432.471	1.446	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)Cn3cccn3)C[C@@H]21	1790960794	GGGYHMQMFPUWKP-WOYTXXSLSA-N	441.370	1.672	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3snnc3C3CC3)C[C@@H]21	1791057087	AZWCNZYVEUWRDO-IXOXFDKPSA-N	443.367	1.792	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(NC(C)=O)c(O)c1)C2	1793453696	QYINBOAJUISIQR-YYAJDYIMSA-N	437.924	1.961	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCBr	1795116379	DOXGJDYPUQDLGL-LSCVPOLPSA-N	426.149	1.535	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)c1cccc(C(F)(F)F)c1	1796191771	VQWVMVMPUBPPAN-REPLKXPHSA-N	446.234	1.951	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C[C@@H]1CNc2ccccc2O1	1797676917	QNGNLKDTEMZYRR-MPWIWIEXSA-N	447.608	1.691	50	20	IDGD	
Cc1c(F)ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)c1N	1798439229	QMEHHSPDYIOMJH-BTTYYORXSA-N	440.479	1.280	50	20	IDGD	
Cc1ccc(=O)n(C(C)(C)C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CO[Si](C)(C)C)n1	1798627423	IOWGFVPDQHKACM-BJWYYQGGSA-N	434.613	1.777	50	20	IDGD	
C#CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](Cl)CC	1799273845	ROCXHTGOECIKHU-NNXHMXCWSA-N	441.956	1.510	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cccc([N+](=O)[O-])c1)C2)[C@H](F)Br	1799343080	MNCQYYQUUXLGTO-VZAMPYOESA-N	444.257	1.417	50	20	IDGD	
Cc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCBr)C3)cc2c[nH]nc12	1799917862	WBVRKSRRMGWZSH-JLVBRIDZSA-N	435.322	1.860	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2ncccc2[nH]1	1800885723	UEDHGSLTVIJUOW-BTTYYORXSA-N	433.472	1.127	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cn1ccc3c(F)cccc31)C2	1800971241	RMIKKTFYLVFRIX-FKEXNYPISA-N	437.899	1.624	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CNC(=O)c1ccc(C)cc1	1802114762	DBPNJLIIKSEDEM-DMUMMCEESA-N	435.952	1.722	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)/C=C/c2ccc([N+](=O)[O-])o2)[C@H]1c1cccnc1)[C@@H](O)CCl	1803136085	NCNQCMKCVUACNM-JAETUBNISA-N	448.863	1.902	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc3c(n2)OCCO3)[C@H]1c1cccnc1)[C@H](O)CCl	1803138681	DNJPYVOIEFLVCO-LESCRADOSA-N	446.891	1.167	50	20	IDGD	
CC(C)(C)n1cc(C(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)cn1	1803142199	WPQHLCYNDDKJLV-NXHRZFHOSA-N	433.940	1.952	50	20	IDGD	
CC(=O)Nc1ccccc1C(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1	1803145558	FCRZISDYNKARFZ-UXPWSPDFSA-N	444.919	1.959	50	20	IDGD	
O=C(Cc1cncnc1)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@@H]1c1cccnc1	1804651208	QIPAOWSDQWVVRS-UAGQMJEPSA-N	436.285	1.811	50	20	IDGD	
O=C(CCBr)N1CCC2(CCCN(C(=O)Cn3cc([N+](=O)[O-])cn3)C2)CC1	1806930597	HADLMHQKPCRBKS-UHFFFAOYSA-N	442.314	1.808	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1808260796	XKNWHWCJYFEJMT-NZSAHSFTSA-N	429.713	1.098	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)c2cnc[nH]2)[C@@H]1c1cccnc1	1808414313	HEMIOWUCUOMDQM-XJYZCQQUSA-N	448.487	1.258	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC2(CCCN(C(=O)Cn3cc(Cl)cn3)C2)CC1	1810011237	CIZOJBYNGMTZNH-UHFFFAOYSA-N	438.960	1.141	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@H](CNC(=O)c2ccnnc2O)[C@H]1c1cccnc1	1811228297	CPHJYFSNMTVRJT-MAUKXSAKSA-N	429.553	1.748	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)[C@H](Cl)COC)[C@@H]1c1cccnc1	1812368210	YHOKHOUAXNCOAA-XLNGHYISSA-N	441.912	1.903	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@H](CNC(=O)COc2cccnn2)[C@H]1c1cccnc1	1813387056	JDMUSNRWBKQCKJ-LAUBAEHRSA-N	443.580	1.808	50	20	IDGD	
Cc1ccc(CC(=O)NC[C@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)o1	1813515038	PZZCTINZKZYZPP-WZONZLPQSA-N	441.532	1.605	50	20	IDGD	
CCc1[nH]nc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@@H](O)CCl)CC3)c1Cl	1815804659	JJKKVHUAZFJPQO-XCBNKYQSSA-N	432.333	1.908	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccns2)[nH]n1)c1cccc(B(O)O)c1	1817473484	WBOWLAKXVXZDEI-HNNXBMFYSA-N	425.279	1.166	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccoc2Cl)[nH]n1)c1cccc(B(O)O)c1	1817477101	YQOKHZXAZUFCGI-MRXNPFEDSA-N	442.668	1.956	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H]1C[C@@H]1C1CC1)CC2	1819789934	AIPIRXHPYSBSDA-BNOWGMLFSA-N	440.529	1.414	50	20	IDGD	
CC(C)/C=C/C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1	1819801865	URCWAZRJGHAUGD-MJRJWQSSSA-N	428.518	1.580	50	20	IDGD	
C[Si](C)(C)OCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCS(C)(=O)=O)CC2	1820169000	OJVUHBVIDSBXPB-LLVKDONJSA-N	433.628	1.341	50	20	IDGD	
COc1ccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)cc1	1820570243	POTOBDDMZRZIAJ-HXUWFJFHSA-N	448.288	1.718	50	20	IDGD	
O=C(Cn1nnc2ccccc21)N1CCC([C@H]2CCCCN2C(=O)[C@@H](O)CCl)CC1	1824177842	ADEJCRPUTYAPEB-MJGOQNOKSA-N	433.940	1.651	50	20	IDGD	
C#CCCCCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnccc1C(=O)NN)CC2	1826426827	IFELDWJPBJZSHW-ZDUSSCGKSA-N	440.529	1.561	50	20	IDGD	
C=C[C@@H](O)C(C)(C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1	1828881411	CXQJPIFAXDQSLK-LEWJYISDSA-N	442.365	1.173	50	20	IDGD	
Cc1ncncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1	1829358040	QQUJRYNVULXHGR-NRFANRHFSA-N	436.321	1.012	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4cccnc4n3)C2)C1	1830361774	CFOUGEDJOBCASR-JOCHJYFZSA-N	446.935	1.965	50	20	IDGD	
Cc1cccc(/C=C/C(=O)N2CCC(N3CCC(NC(=O)[C@H](O)CCl)CC3)CC2)n1	1833306137	KNWXVDIQTSOGIU-RRFGBZISSA-N	434.968	1.575	50	20	IDGD	
Cc1cnc(Cl)c(C(=O)N2CCC(N3CCC(NC(=O)[C@H](O)CCl)CC3)CC2)c1	1833308854	AWKPFVFSDVXIOT-QGZVFWFLSA-N	443.375	1.828	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)Cc3cnc4ccccn34)CC2)CC1)[C@H](F)Cl	1835079194	NOHDCJHKZPGCRS-FQEVSTJZSA-N	435.931	1.983	50	20	IDGD	
COc1ccccc1C(=O)N1CCOC[C@@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1837715156	ZUIAQOFPORUOQZ-OAQYLSRUSA-N	436.581	1.617	50	20	IDGD	
CC(=O)NCCC(=O)N1CCC(OC2CCN(C(=O)CO[Si](C)(C)C)CC2)CC1	1838432132	XAKCIIRLBFGMLF-UHFFFAOYSA-N	427.618	1.363	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3nccc(OC)c3OC)CCO2)C1	1838841199	KGDXMIOXAGUFKO-JLTOFOAXSA-N	441.912	1.186	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(OC)c(F)c3)C2)C1	1839141456	JCGKXTOXWNFXTO-QRWLVFNGSA-N	428.888	1.922	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cc(F)cc(F)c3)C2)C1	1839144316	VEVHLJLSCCMRPD-XLIONFOSSA-N	430.879	1.981	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4c(c3)CCN4C)C2)C1	1839144956	PDJLHSCRGJXXGH-AVRDEDQJSA-N	435.952	1.766	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ncc(C)s3)C2)C1	1839963784	VRTDSABSEGWMHC-SUMWQHHRSA-N	446.367	1.695	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccsc3)C2)C1	1840031900	GJPGKDOZJRVLSZ-SUMWQHHRSA-N	431.352	1.530	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(O)cc3)C2)C1	1840034691	UJCCUFKDTKGSKX-ACJLOTCBSA-N	427.295	1.246	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCOc3ccccc3)C2)C1	1840151067	VQDIWQNJNGIOGE-WIYYLYMNSA-N	440.924	1.166	50	20	IDGD	
O=C1Cc2cc(C(=O)N3CCOC[C@]4(C3)CN(C(=O)C(Cl)Cl)CCO4)ccc2N1	1840188321	CQDYKRACKXKQBD-IBGZPJMESA-N	442.299	1.055	50	20	IDGD	
CSc1ncccc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840189128	YRMHXEYWCCNIBP-QGZVFWFLSA-N	434.345	1.677	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)[C@H](O)c2ccco2)C1	1841071192	PXPARRYHOGKUGM-GOSISDBHSA-N	443.412	1.664	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC2(CCCN2C(=O)C2CCOCC2)C1	1842759644	LKLQWTSOLRORCW-HNNXBMFYSA-N	429.945	1.749	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC2(CCCN2C(=O)c2ccc(CS(C)(=O)=O)nc2)C1	1843216235	KCDKKKIESWZMPR-UHFFFAOYSA-N	439.610	1.295	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1ccnn1C(C)C)C2	1843416293	TVPOSFIWUKXHHE-BUVRLJJBSA-N	425.493	1.415	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)[C@@H](C)N(C)C(C)=O)C1	1843427269	ZYXZZMHUXHWPBB-CYBMUJFWSA-N	446.460	1.204	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC2(CCCN2C(=O)c2ccc([N+](=O)[O-])c3c2OCO3)C1	1844758220	KNTKPXUPHJRICU-UHFFFAOYSA-N	435.509	1.992	50	20	IDGD	
CC(C)C[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)[C@H](O)CCl)C2	1846267122	YOZYVDQEKCLUAO-HUUCEWRRSA-N	431.961	1.729	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)(C)O)C2	1846365558	CASSOAICKYAXLL-ZIAGYGMSSA-N	447.960	1.108	50	20	IDGD	
COc1cc(C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc(OC)c1OC	10718016	MPXUVNXWHHHIHS-UHFFFAOYSA-N	433.373	1.239	50	20	IDGD	
Cc1cc(NC(=O)CSCC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)no1	13082433	FIZIQVMQXJEEHO-UHFFFAOYSA-N	430.446	1.007	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)[C@H]1CC(=O)Nc2cc(F)ccc21	14280230	CNEXJVBCJYVULT-IBGZPJMESA-N	439.491	1.611	50	20	IDGD	
O=C(NNC(=O)c1cc2c(s1)CCCCCC2)C1=CN2CCS(=O)(=O)N=C2C=C1	15759887	RTUZQKZDXHEVPL-UHFFFAOYSA-N	434.543	1.666	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(C(=O)NNC(=O)[C@H]2COc3ccccc3O2)ccc1Cl	15795108	OCSJFTQLLIDOAP-OAHLLOKOSA-N	439.877	1.191	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)c1cc(Cl)c(-n2cnnn2)cc1OC	107909887	GLJGNWRJLGNICZ-UHFFFAOYSA-N	430.852	1.727	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)c1ccc(NS(=O)(=O)c2ccccc2)cc1	725739696	MDVFKWFRXOMTOR-UHFFFAOYSA-N	442.453	1.271	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)N1CCC(NC(=O)c2ccccc2)CC1	725871206	DOFCFHKGZFGLAK-UHFFFAOYSA-N	429.502	1.113	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1	728210604	QRFNCHYIQKOVTH-UHFFFAOYSA-N	442.457	1.978	50	20	IDGD	
C#CCN1CCC(C(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)CC1	729298453	HHSKGUVSYMCWGP-UHFFFAOYSA-N	443.507	1.551	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)NC2CCCC2)cc1Br	729348845	ZJFWVOJADUCEQL-UHFFFAOYSA-N	433.328	1.586	50	20	IDGD	
Cc1cc(C(=O)N2CCC[C@H]2C(=O)NNC(=O)CNc2ccccc2)ccc1[N+](=O)[O-]	729513873	VVWIYDVHTLTHLJ-SFHVURJKSA-N	425.445	1.767	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNS(=O)(=O)c1ccc(C(=O)N2CCOCC2)cc1	729667050	DYWNDMABXFMZAI-UHFFFAOYSA-N	442.497	1.123	50	20	IDGD	
CO[C@@](C)(C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)c1ccccc1	730159927	YAOPNZCNTQJNDE-OAQYLSRUSA-N	431.514	1.794	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)NCc1cccc(C(=O)NC[C@H]2CCCO2)c1	731543711	OSUOMAYITZAVDF-QGZVFWFLSA-N	426.473	1.748	50	20	IDGD	
C[C@H](C(=O)NNC(=O)c1ccc2c(c1)OCCO2)N1CCN(c2ccc(F)cc2)CC1	731866222	RUJKQSGQLNLJRQ-OAHLLOKOSA-N	428.464	1.569	50	20	IDGD	
C[C@@H](NC(=O)CCC(=O)NNC(=O)c1ccncc1)C(=O)c1ccc(Br)cc1	732048649	CRGGERXMEBWAON-GFCCVEGCSA-N	447.289	1.773	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)CC[C@@H]1NC(=O)N(c2ccc(Cl)c(Cl)c2)C1=O	732084308	YBGUWNPOHFPUAC-ZDUSSCGKSA-N	439.259	1.691	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)Nc1ccccc1CN1C(=O)CNC1=O	733333445	NARWBKOTFUWQQF-UHFFFAOYSA-N	433.428	1.391	50	20	IDGD	
CCN1CCC[C@@H]1CN1C[C@H](C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)CC1=O	733362610	TYGCLUUOYDGONA-UKRRQHHQSA-N	444.504	1.459	50	20	IDGD	
COc1ccc(CN2CC[C@@H](NC(=O)NNC(=O)c3cc(OC)cc(OC)c3)C2=O)cc1	734541742	JJXGZIPDWKFAJU-LJQANCHMSA-N	442.472	1.458	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)c2cn(-c3ccccc3)nn2)CC1	734824992	PSJRXPTYHJWLAY-UHFFFAOYSA-N	429.481	1.611	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)N[C@@H](C)CN1CCN(c2ccccn2)CC1	735517895	GSWBAYSAJZMMRM-KRWDZBQOSA-N	426.521	1.174	50	20	IDGD	
O=C(NNS(=O)(=O)C[C@H]1CCCO1)[C@H]1Cc2ccccc2CN1Cc1ccccc1	735646322	PEDNZNXXYRYENJ-NHCUHLMSSA-N	429.542	1.743	50	20	IDGD	
CCc1ccccc1O[C@H](C)C(=O)N1CCN(CC(=O)NNC(=O)c2cccs2)CC1	736623055	HOWDLVHSJRSQEQ-MRXNPFEDSA-N	444.557	1.683	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)[C@H]2CCCN(C(=O)COc3ccccc3)C2)c1	741283660	JRNVYSYZOXMCBR-KRWDZBQOSA-N	440.500	1.572	50	20	IDGD	
COC(=O)c1ccc(S(=O)(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)cc1C	741648860	PKKKHVHQSRRDLU-UHFFFAOYSA-N	438.458	1.431	50	20	IDGD	
Cc1cc(C(=O)O)c(O)c(S(=O)(=O)NNC(=O)c2cccc(Br)c2)c1	743263334	CQOUNMBZPWWFDK-UHFFFAOYSA-N	429.248	1.785	50	20	IDGD	
Cn1c(=O)n(C)c2cc(S(=O)(=O)NNC(=O)c3cccc(Br)c3)ccc21	743264457	UJPWMXBKRKNIDS-UHFFFAOYSA-N	439.291	1.263	50	20	IDGD	
Cc1cc(N2CC[C@@H](NC(=O)NNC(=O)c3ccc(Br)s3)C2=O)n(C)n1	743518524	MYPCLLCKUIBCLI-SECBINFHSA-N	441.311	1.302	50	20	IDGD	
Cc1nc([N+](=O)[O-])cn1CC(=O)NNC(=O)COc1ccc(OCc2ccccc2)cc1	743607565	LDVIJWANGUEPRM-UHFFFAOYSA-N	439.428	1.905	50	20	IDGD	
C[C@H]1C[C@H](NC(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)CCN1C	745855278	USZNYKTWHZFDBO-FUHWJXTLSA-N	448.527	1.872	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(Nc2ccccc2)(C(=O)NNC(=O)N2CCOCC2)CC1	745986416	SSJRGJDMFTULQX-UHFFFAOYSA-N	447.536	1.941	50	20	IDGD	
O=C(NNC(=O)N1CCOCC1)c1ccc(Cl)c(S(=O)(=O)N2CCCCCC2)c1	745992582	FCGRYFFIPFFLJW-UHFFFAOYSA-N	444.941	1.591	50	20	IDGD	
NC(=O)CC[C@H](C(=O)NNC(=O)c1cccc2ccccc12)N1C(=O)c2ccccc2C1=O	746296703	UOXADPRMOKZYIS-LJQANCHMSA-N	444.447	1.531	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N(C)OC)cc2)o1	746392549	OHCAZJKDPAIABP-UHFFFAOYSA-N	438.506	1.378	50	20	IDGD	
Cc1cccc(-c2nnc(S)n2CCC(=O)NNC(=O)Cc2cn3ccccc3n2)c1	746701797	LXFUENNPRBTQRR-UHFFFAOYSA-N	435.513	1.970	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(OCC(F)(F)F)cc1)[C@H]1COc2ccccc2O1	747408905	DMITZDDTXLQKQO-OAHLLOKOSA-N	432.376	1.777	50	20	IDGD	
Cn1ccnc(NNC(=O)CCc2nc(-c3cc(Br)cs3)no2)c1=O	747939390	ZPOAAMJLGMUWTM-UHFFFAOYSA-N	425.268	1.730	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)[C@@H]2CCCN(C(=O)C3CC3)C2)cc1	749562220	NYLUWWZRODSIDP-QGZVFWFLSA-N	442.545	1.517	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CNC(=O)c2ccco2)ccc1OCc1cscn1	751201752	KZYOFQMOQSAXPL-UHFFFAOYSA-N	430.442	1.515	50	20	IDGD	
C[C@@H](NC(=S)NNC(=O)c1cn(C2CCN(C(=O)OC(C)(C)C)CC2)nn1)C1CC1	751617166	HLUVEFRKJGLRIW-GFCCVEGCSA-N	437.570	1.758	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)[C@H](c1ccccc1)N1CCC(O)CC1	752737531	ZTHFYGARQFKLLO-IBGZPJMESA-N	444.919	1.302	50	20	IDGD	
C[C@H]1C[C@@H](NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)CN1C1CC1	753942634	ATALFGZLIPCSGG-GOEBONIOSA-N	435.550	1.040	50	20	IDGD	
O=C(CCC(=O)NC1CCCC1)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	756003751	VKDIJBDSTGEZCR-UHFFFAOYSA-N	449.983	1.444	50	20	IDGD	
CCN1CCN(C(=O)c2ccc(NC(=O)NNC(=O)Cn3nc(C)cc3C)cc2)CC1	756252215	AIYAPDPVXXOALW-UHFFFAOYSA-N	427.509	1.131	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)NNC(=O)c2nnc(O)c3ccccc23)cc1	756561314	AOQQFLCTRQWOAO-UHFFFAOYSA-N	430.446	1.564	50	20	IDGD	
CCCS(=O)(=O)Nc1cccc(NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c1	756683602	GGKUBIJYRHWTOB-UHFFFAOYSA-N	444.477	1.281	50	20	IDGD	
Cc1cc(Br)ncc1NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	757628930	ITDLZTDKGRZMRZ-UHFFFAOYSA-N	431.250	1.866	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)N[C@@H]2CN(C(=O)OC(C)(C)C)C[C@@H]2C#N)cc1	758770391	LDXNTPJZYAZOCT-DOTOQJQBSA-N	431.493	1.717	50	20	IDGD	
CCOC(=O)N1[C@H](c2ccc(C)o2)CC[C@@H]1C(=O)NNC(=O)C(=O)Nc1ccccn1	758832712	IHHFGFBUOCKOMM-UONOGXRCSA-N	429.433	1.431	50	20	IDGD	
CC[C@@H]1CN(C(=O)NNC(=O)CNC(=O)c2cccs2)CCN1Cc1ccccc1	759256856	GQCHPTJTXZTPKT-QGZVFWFLSA-N	429.546	1.815	50	20	IDGD	
O=C(NC1CC1)N[C@@H]1CCN(C(=O)NNC(=O)c2ccc(Br)cc2Cl)C1	760669900	PYNWULUGEOFROC-LLVKDONJSA-N	444.717	1.993	50	20	IDGD	
C=CCn1c(S)nc2cc(C(=O)NNc3nccc(N4CCOCC4)n3)ccc2c1=O	762867347	VTANCOXWQIPUAW-UHFFFAOYSA-N	439.501	1.255	50	20	IDGD	
COc1cc(OC)c2cc(C(=O)NNc3nccc(N4CCOCC4)n3)[nH]c2c1OC	762868267	NHNFOWURUCOQRN-UHFFFAOYSA-N	428.449	1.577	50	20	IDGD	
C[C@H](c1ccc(NC(=O)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1)N1CCOCC1	763467869	HXMQTGRDSPIWOS-CQSZACIVSA-N	441.444	1.388	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2Br)cc1NC(C)=O	763483533	QGESDLKCNQWXRX-UHFFFAOYSA-N	449.261	1.816	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(OC(C)C)c(C#N)c2)cc1OC	763551265	UWKCZJWRVYWAPY-UHFFFAOYSA-N	426.429	1.762	50	20	IDGD	
O=C(NNC(=O)C1CC1)C(=O)Nc1ccc(Cl)c(S(=O)(=O)N2CCCCC2)c1	763557327	AKVLMJHEGOZEPI-UHFFFAOYSA-N	428.898	1.011	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)[nH]n1)C(=O)Nc1ccnn1Cc1ccccc1	763604200	HJORWASJTOHQKS-UHFFFAOYSA-N	429.440	1.721	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(N3CCOC3=O)cc2)c2ccccc2n1	763610631	JMCHAYOBBDBZQN-UHFFFAOYSA-N	433.424	1.900	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)COc2cc(C)cc(C)c2)ccc1NC(C)=O	763645572	VPVVBSZCBHKPKV-UHFFFAOYSA-N	428.445	1.435	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2ccc(N3CCCC3=O)c(F)c2)c1	763772691	ORQDYAQWMKLQDM-UHFFFAOYSA-N	444.419	1.369	50	20	IDGD	
CC[C@@H](C)n1nc(NC(=O)C(=O)NNC(=O)c2nn(CC)c(=O)c3ccccc23)cc1C	763785510	GXIFGISLRSMORI-GFCCVEGCSA-N	439.476	1.292	50	20	IDGD	
CNC(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)c1	763849848	LALSUJQVKUATBD-JTQLQIEISA-N	436.827	1.392	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(C(=O)NC)ccc2C)cc1OC	763902777	XNEHBXJOWVDRTQ-UHFFFAOYSA-N	428.445	1.162	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)C(=O)Nc1cccnc1Oc1ccccc1	763922204	UBXVUNGNQDJOBL-UHFFFAOYSA-N	444.411	1.249	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3ccc4c(c3)NC(=O)CO4)cc2C1	763939281	CUSODUJJKUPLKY-SNVBAGLBSA-N	428.470	1.604	50	20	IDGD	
CCn1nnnc1-c1cccc(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3c2)c1	764066264	DKDHPGAJNMZZGU-UHFFFAOYSA-N	429.440	1.913	50	20	IDGD	
CNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(F)cc2Br)cc1	764083923	CNRURGPSTMMLSI-UHFFFAOYSA-N	437.225	1.348	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3nc(N4CCOCC4)oc3c2)c(O)c1	764109785	BSFAUIBIXNIECF-UHFFFAOYSA-N	439.428	1.078	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2ccnn2CCc2ccccc2)cc1	764131245	JAMTWRNXWACVDX-UHFFFAOYSA-N	435.484	1.853	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)c2cccc(OC)c2O)sc(C)c1C	764132379	NSGWHBZOWYNESZ-UHFFFAOYSA-N	435.458	1.656	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(Oc3ccc(C#N)cc3)nc2)c1O	764132975	ZGGNSRFWXGSOIL-UHFFFAOYSA-N	447.407	1.859	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccnc(OCC(F)(F)F)c1	764135453	GUFQLAJSHJISHO-UHFFFAOYSA-N	426.351	1.360	50	20	IDGD	
O=C(CC1CCCC1)NNC(=O)C(=O)Nc1ccc(Cl)c(-n2nnnc2C2CC2)c1	764179298	QEGMDEGKLSXINO-UHFFFAOYSA-N	431.884	1.859	50	20	IDGD	
COc1ccc(Cn2nccc2NC(=O)C(=O)NNC(=O)CC2CCCC2)c(OC)c1	764179587	VAUOUZRFLAYGIC-UHFFFAOYSA-N	429.477	1.615	50	20	IDGD	
Cc1ncsc1C(=O)NNC(=O)C(=O)Nc1ccc(F)cc1I	764245524	GWMOHHCTEAZWJZ-UHFFFAOYSA-N	448.217	1.595	50	20	IDGD	
C[C@H](c1cccc(NC(=O)C(=O)NNC(=O)CCc2ccccc2O)c1)N1CCOCC1	764277306	BIIVLXTTWRGBOH-MRXNPFEDSA-N	440.500	1.504	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)C(=O)Nc1cccc(COCC(F)(F)C(F)F)c1	764294741	AFMQOMCNRIFLMQ-UHFFFAOYSA-N	431.346	1.535	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)c2ccc(C)o2)cc(OC)c(OC)c1OC	764370782	CXSCCZPWNWZIMT-UHFFFAOYSA-N	449.416	1.190	50	20	IDGD	
COC(=O)[C@@H](C)Cc1ccc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)cc1	764404179	GIYNTDHRHVSREE-ZDUSSCGKSA-N	445.497	1.622	50	20	IDGD	
COc1cccc(COc2cccc(NC(=O)C(=O)NNC(=O)[C@H]3COCCO3)c2C)c1	764430668	YOOJXLBBDQJOSQ-LJQANCHMSA-N	443.456	1.084	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	765754608	LRGAUELHDJQXDE-UHFFFAOYSA-N	441.919	1.556	50	20	IDGD	
COc1cc(C#N)ccc1NC(=O)C(=O)NNC(=O)COc1cccc(C(F)(F)F)c1	766258090	ANWOXYQDZKPYMM-UHFFFAOYSA-N	436.346	1.751	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNS(=O)(=O)c2ccc([N+](=O)[O-])c3cccnc23)cc1C	766353763	MNIWMZHLTGMNKT-UHFFFAOYSA-N	443.441	1.708	50	20	IDGD	
COC(=O)[C@@H](NNC(=O)C1CCN(c2ncccn2)CC1)c1cccc(Br)c1	766735085	QCVBTMRFHDFPKM-INIZCTEOSA-N	448.321	1.991	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)Cn1cnc2c(oc3ccccc32)c1=O	767273372	UPLSQGFCTLGQBV-UHFFFAOYSA-N	448.435	1.384	50	20	IDGD	
CC(C)(C)OC(=O)N1CCO[C@@H](CC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)C1	767828032	QOYIOYKFFLBXHI-HNNXBMFYSA-N	445.476	1.365	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](OCC(=O)NNC(=O)Cc2cn3ccccc3n2)C1	768194229	ZPZLDOCTGRASSQ-MRXNPFEDSA-N	431.493	1.440	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)CN2C(=O)N[C@@]3(CCCC(C)(C)C3)C2=O)cc1OC	768570624	GJLLRDKNKGVRJA-JOCHJYFZSA-N	446.504	1.746	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)NC1CCN([C@@H]2CCCC[C@H]2O)CC1	769159641	DYNUFGDBBVBZCK-QZTJIDSGSA-N	442.520	1.290	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc3c2CCN3C(C)=O)cc1OC	769266107	LYSVSHYVHOHWMT-UHFFFAOYSA-N	440.456	1.403	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)NC3CCN([C@H]4CCC[C@@H]4O)CC3)nc21	770413665	USTIMTUBKMKNTP-GJZGRUSLSA-N	432.529	1.291	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)N[C@@H](C)CCN2CCN(C)CC2)cc1Cl	770584591	FBFXKEFUNOWUKD-ZDUSSCGKSA-N	442.948	1.719	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)c1cccnc1Oc1ccccc1C(N)=O	772183490	MYFBNKKDRSBROA-ZDUSSCGKSA-N	428.445	1.712	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1)c1ccc(S(C)(=O)=O)cc1	772196220	HTBFDGXRMIRTMA-GFCCVEGCSA-N	437.905	1.311	50	20	IDGD	
O=C(CCCn1c(=O)oc2ccccc21)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772197845	ZMAYRSAZHBOMFM-UHFFFAOYSA-N	430.848	1.492	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NCCN(C)S(=O)(=O)c2cccs2)cc1C	772625402	ORAQOPKSPGXLBS-UHFFFAOYSA-N	440.547	1.395	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)Nc1cnn(Cc2nnc3n2CCCC3)c1	772635579	CFMWTSBKLDDGPP-UHFFFAOYSA-N	438.448	1.097	50	20	IDGD	
COc1ccc(/C=C/C(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)cc1O	773390618	AAPHFOBIEJQGCZ-CSKARUKUSA-N	438.528	1.688	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)C(=O)Nc1ccc(OC(F)F)c2cccnc12	773492751	SICXXLNMKIEFTO-UHFFFAOYSA-N	444.350	1.965	50	20	IDGD	
O=C(CN1CCN(c2nnc(C(F)(F)F)s2)CC1)NNC(=O)c1cccc(Cl)c1	776864568	LJTYQFFOYMYBPJ-UHFFFAOYSA-N	448.858	1.794	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)C1CCN(c2ccc(C(F)(F)F)cn2)CC1	778438468	YLHMUUFFWKPBMF-UHFFFAOYSA-N	445.442	1.989	50	20	IDGD	
CC(=O)Nc1ccc(C)c(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1	780154985	LWMDFJXZNSXINA-UHFFFAOYSA-N	444.513	1.813	50	20	IDGD	
C[C@H]1C(=O)CC[C@H](C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)C1(C)C	780171136	IBPYOWAXRDJKHI-WMLDXEAASA-N	435.546	1.874	50	20	IDGD	
CCO[C@@H]1C[C@](NC(=O)OC(C)(C)C)(C(=O)NNc2nc(O)c3cnn(C)c3n2)C1(C)C	780701237	UMKJVIQCGSBARQ-ODXCJYRJSA-N	449.512	1.611	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)N[C@@H]1CCCN(c2ccc(C#N)cc2)C1=O	780901850	JOPMGFSSCDWEEL-AUUYWEPGSA-N	439.447	1.991	50	20	IDGD	
COc1cc2c(cc1OC)CN(C(=O)CCCNS(=O)(=O)CBr)CC2	782436090	YJXUWFVTWTYDLX-UHFFFAOYSA-N	435.340	1.641	50	20	IDGD	
CNS(=O)(=O)c1ccc2c(c1)N(C(=O)C(=O)NNc1nc3ccccc3s1)CC2	782813481	KHCJWVPGFWVQNM-UHFFFAOYSA-N	431.499	1.237	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2c(C(=O)N3CCOCC3)oc3ccccc23)cc1	783035026	NPYKUULFESHSJA-UHFFFAOYSA-N	438.440	1.996	50	20	IDGD	
CS(=O)(=O)N1CCc2c(NC(=O)C(=O)NNc3ncccc3C(F)(F)F)cccc21	783124835	IFHQCZNXTDMERD-UHFFFAOYSA-N	443.407	1.504	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)n(C(C)(C)C)n1	783265124	VWIJUXDGLUZGQW-UHFFFAOYSA-N	437.526	1.110	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2cccc(CCCc3ccccc3)c2)CCS(=O)(=O)C1	783427183	MKXPOFIMBKRJKI-JOCHJYFZSA-N	429.542	1.998	50	20	IDGD	
CN1CC(=O)N(c2cccc(NC(=O)C(=O)NNc3ccc(OC(F)F)cc3)c2)C1=O	784309528	QASICZZYXHUYLN-UHFFFAOYSA-N	433.371	1.768	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)F)cc1)C(=O)Nc1ccnn1-c1ccccc1	784835400	NRZBPZQDRQGMHE-UHFFFAOYSA-N	435.412	1.950	50	20	IDGD	
COC(=O)c1c(F)cccc1NC(=O)C(=O)NNc1c(OC)cccc1S(C)(=O)=O	785331277	RUQLFZTUVWJHEY-UHFFFAOYSA-N	439.421	1.106	50	20	IDGD	
C[C@H]1Cc2cc(S(N)(=O)=O)ccc2N1C(=O)COC(=O)/C(C#N)=C\c1ccccc1	785352742	ZSEIBSJRDGYIKI-XGHPXPSOSA-N	425.466	1.762	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@@H]2C(=O)NNc2ccc(-n3ccnc3)nn2)s1	788180649	CVJHMSIJUNCNCB-CYBMUJFWSA-N	433.519	1.329	50	20	IDGD	
COc1ccc(S(=O)(=O)NC2CC2)cc1NC(=O)NNc1cc(Cl)nc(N)n1	789016304	FXMUDDJQQDLHEL-UHFFFAOYSA-N	427.874	1.310	50	20	IDGD	
CC(C)Oc1cc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCC3)ccc1C(N)=O	789732152	MTVGTFHVMQVMBL-UHFFFAOYSA-N	430.486	1.523	50	20	IDGD	
COc1ccc(OC)c(C2=NO[C@H](C(=O)NNC(=O)[C@H](C)Oc3ccccc3F)C2)c1	791461382	ZMHFQJKUMRAVDA-BUXKBTBVSA-N	431.420	1.951	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNc2ncccc2C)c(C(=O)N2CCCC2)cc1OC	792380164	RVSXKMQPMSMCNA-UHFFFAOYSA-N	427.461	1.725	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)C(C)C)cc1NC(=O)C(=O)NNc1nc2ccccn2n1	792395910	VGXMZOYHBKGHLM-UHFFFAOYSA-N	445.505	1.148	50	20	IDGD	
C[C@@]1(C(=O)NNC(=O)C(=O)Nc2ccccn2)CCN(C(=O)OCc2ccccc2)C1	793650030	OETUAOBJLYSTBA-OAQYLSRUSA-N	425.445	1.216	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)c1ccc2c(c1)OCO2	794196932	WYCWTDCVPGBQMD-CQSZACIVSA-N	445.497	1.765	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNS(=O)(=O)c2cc(Cl)c(C)c(C(=O)O)c2)c1	794867268	VQQQLKJPJKERLA-UHFFFAOYSA-N	428.850	1.987	50	20	IDGD	
COC(=O)c1cc(F)cc(NC(=O)C(=O)NNC(=O)CSc2ccc(C)cc2)c1F	797001061	XFELEMXBRYCZPB-UHFFFAOYSA-N	437.424	1.938	50	20	IDGD	
COc1ccc(NC(=O)c2cccc(NC(=O)C(=O)NNC(=O)c3cccc(C)n3)c2)cn1	797370346	ZRIIDTRLLQDALE-UHFFFAOYSA-N	448.439	1.446	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NC(=O)NNC(=O)c2ccc(Br)s2)nc1	797653034	FTWVLUXMACETRF-UHFFFAOYSA-N	448.324	1.622	50	20	IDGD	
CN(CCNC(=O)NNC(=O)Cc1c[nH]c2ccccc12)S(=O)(=O)c1ccc(F)cc1	798118428	XCTMXGHPUQLNGT-UHFFFAOYSA-N	447.492	1.501	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)c2n[nH]cc2C)c1	799407344	RNRGDLOQGMNONC-UHFFFAOYSA-N	429.458	1.602	50	20	IDGD	
CCCCNS(=O)(=O)c1ccc(C)c(NC(=O)C(=O)NNc2nccnc2Cl)c1	799835380	HHVMSKAHMIIKNY-UHFFFAOYSA-N	440.913	1.599	50	20	IDGD	
CC(C)OCCCn1c(NNC(=O)c2ccnc3c2nnn3C)nc2ccccc2c1=O	801156477	TXXCKNXAZPACLT-UHFFFAOYSA-N	436.476	1.645	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2ccc(C(=O)NNC(=O)N=c3cc[nH]cc3)cc2)cc1	802025857	ONUZYWQIDPMOFM-UHFFFAOYSA-N	441.469	1.779	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)[C@@H]2CC(=O)N(c3cc(OC)cc(OC)c3)C2)cc1	802059037	UECYUBMARGPVGQ-CYBMUJFWSA-N	428.445	1.918	50	20	IDGD	
Cc1nc(COc2ccccc2C(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)no1	802065646	HBQYYPGIJFXYLF-UHFFFAOYSA-N	445.457	1.827	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@]23CCC(=O)N2c2ccccc2S3)cc1	802067486	FNTZJORKQGITAL-LJQANCHMSA-N	446.510	1.872	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)[C@@H]1CCCN(S(=O)(=O)c2ccc(F)cc2)C1	804956740	WULVOUOWEHOQFY-CQSZACIVSA-N	445.480	1.345	50	20	IDGD	
O=C(NNc1cccc(F)n1)C(=O)Nc1ccc2c(ccn2CCN2CCOCC2)c1	807392461	PGECQCFEAHPKFE-UHFFFAOYSA-N	426.452	1.589	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)NC[C@H](N1CCOCC1)C(F)(F)F	807541350	LBHMPIONEGESOX-HNNXBMFYSA-N	434.415	1.058	50	20	IDGD	
N#Cc1ccc(S(=O)(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)o1	808068789	HUGGIBCUDYFUOT-UHFFFAOYSA-N	449.448	1.533	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)C1(S(=O)(=O)c2ccccc2)CCOCC1	808433815	BHLWXPXQDDBGIX-UHFFFAOYSA-N	432.498	1.374	50	20	IDGD	
CCOc1ccc(NC(=S)NNC(=O)CNS(=O)(=O)c2c[nH]c3ncccc23)cc1	810022302	HQRNQPHVRSKBFH-UHFFFAOYSA-N	448.530	1.258	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNS(=O)(=O)c1cnc2onc(-c3ccccc3)c2c1	811683345	CWGTYTODGYFUCY-UHFFFAOYSA-N	441.425	1.222	50	20	IDGD	
COC[C@]1(CNC(=O)NNC(=O)c2nnc(O)c3ccccc23)OCCc2ccccc21	812477000	FROGIQKWPHMLDF-QFIPXVFZSA-N	437.456	1.394	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(C)cnc1Br	812980233	PWUGBAMEBHYRLF-UHFFFAOYSA-N	437.250	1.326	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2cccc(F)c2Br)n1	814505930	BXDKUXQCTPVGBS-UHFFFAOYSA-N	430.255	1.900	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCCNC(=O)[C@@H]1Cc1ccccc1	815142455	TTYNMYLSAPJPNC-SFHVURJKSA-N	444.919	1.543	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)c1ccc(=O)n(-c2ccccc2F)n1	817054269	BPCFHBHETDINDX-UHFFFAOYSA-N	431.449	1.379	50	20	IDGD	
COc1ccc(-n2cnnc2SCC(=O)NNC(=O)COc2ccc(C#N)cc2)cc1	818816701	VIQPBBBQCDJGDK-UHFFFAOYSA-N	438.469	1.466	50	20	IDGD	
COc1ccc(-n2cnnc2SCC(=O)NNC(=O)COc2ccc(F)cc2)cc1	818858483	RZIKBUOZGBMQOZ-UHFFFAOYSA-N	431.449	1.734	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)[C@H]2CC(=O)N(C3CC3)C2)c2ccccc2c1=O	828973249	AYSRJHXEXLULGU-AWEZNQCLSA-N	425.489	1.359	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)[C@@]23CCC(=O)N2CCS3)c2ccccc2c1=O	849202140	UAMBILXTJOBCFS-NRFANRHFSA-N	443.529	1.413	50	20	IDGD	
Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)Oc1ccc(C(=O)N2CC[C@H](B(O)O)C2)cc1	864233164	FZVVQAJPLGSGEV-AWEZNQCLSA-N	434.235	1.360	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)[C@@H]2CCCN2S(=O)(=O)c2ccc(C)s2)c1	887572972	ILHPDDMHZXJKLD-INIZCTEOSA-N	437.543	1.744	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2ccc(CS(=O)(=O)c3ccccc3)o2)C[C@@H](C)O1	912918860	FNCLLVBFFDXYHN-IYBDPMFKSA-N	449.529	1.514	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)[C@H]2CC(=O)N(Cc3ccccc3Cl)C2)C[C@@H](C)O1	912920216	YQWZZFWCEGMAEV-INMHGKMJSA-N	436.940	1.335	50	20	IDGD	
COc1ccc(CSCC(=O)NNC(=O)COc2ccc(C#N)cc2)cc1[N+](=O)[O-]	914748770	FSFVEENXLYRKGG-UHFFFAOYSA-N	430.442	1.935	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)c1cc(S(=O)(=O)N(C)C)c[nH]1	915062048	VVIBFEZCRUNXBB-CYBMUJFWSA-N	430.486	1.647	50	20	IDGD	
CC(=O)Nc1ccc(NC(=S)NNC(=O)Cc2csc(N3CCOCC3)n2)cc1	915117662	TYZAUWNPLJYLJO-UHFFFAOYSA-N	434.547	1.498	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)c1	915858315	XIOZSUSWWJJUAW-UHFFFAOYSA-N	429.414	1.259	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NC[C@H](c2cccc(F)c2)N(C)C)nc1	915901094	NJHWJJMDKKUTJZ-QGZVFWFLSA-N	438.529	1.836	50	20	IDGD	
Cc1cc(C=NNC(=O)c2cccc(S(C)(=O)=O)c2)c(C)n1CCN1CCOCC1	915959202	IXVZEDQSCLYYDE-UHFFFAOYSA-N	432.546	1.605	50	20	IDGD	
Cn1ccnc1[C@H](NC(=O)NNC(=O)c1nnc(O)c2ccccc12)c1ccccc1F	916224724	QSXWRTRKNNNIID-MRXNPFEDSA-N	435.419	1.942	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)NCCc2nnc3n2CCCCC3)cc1	916235264	ICVFSWIQLFYKLT-HNNXBMFYSA-N	430.509	1.744	50	20	IDGD	
CO[C@H](CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)c1ccccc1	916271392	OANHUAOAGKFULV-LJQANCHMSA-N	446.529	1.803	50	20	IDGD	
CC(=NNC(=O)c1cc(N)cc([N+](=O)[O-])c1)c1ccc(S(=O)(=O)N2CCOCC2)cc1	916346593	JWCQIKHCSHBVHK-UHFFFAOYSA-N	447.473	1.352	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCC(=O)N1CCCCC1	916473164	CITTXBWQSHEBKX-GFCCVEGCSA-N	427.299	1.559	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)NCCN1CCN(c2ccccc2)CC1	916514825	OTXMKLSAKJJVDW-QGZVFWFLSA-N	429.496	1.746	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2c[nH]c3ccccc23)cc1	916649402	NAJRKPVTDHNNRJ-UHFFFAOYSA-N	445.501	1.237	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)[C@@H]2CC(=O)N(c3ccc(OC)cc3OC)C2)cc1	919833798	CESYKWPYOBTWHC-MRXNPFEDSA-N	441.484	1.846	50	20	IDGD	
C[C@H]1CN(Cc2cccc(CNC(=O)NNC(=O)c3ccc4c(c3)OCCO4)c2)CCO1	920237798	MZPZETHNIIZPPA-INIZCTEOSA-N	440.500	1.823	50	20	IDGD	
COc1ccc(CCCNC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1OC	920919874	DCIYNQRPFCJLOL-UHFFFAOYSA-N	425.449	1.256	50	20	IDGD	
COC(=O)/C=C/c1cc(OC)c(OC)c(S(=O)(=O)NNC(=O)NC2CCCCC2)c1	921017787	SJPIJOBZIKSOHE-MDZDMXLPSA-N	441.506	1.715	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cccn2Cc2ccccc2)c1	935110024	PMCOXGMGNXWUJQ-UHFFFAOYSA-N	426.498	1.862	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2ccc(OC)c(I)n2)cc1	1116401888	SSAFYMKFCGCXGE-UHFFFAOYSA-N	427.198	1.778	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)c1ccc(C)cc1)C(=O)NNc1nncc(N)c1Cl	1319220658	UKFIRNOUCDGCPZ-CYBMUJFWSA-N	444.970	1.564	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2cnn(-c3ccccc3)c2OC)c2ccccc2c1=O	1320337207	OZKIIGYBEZTNOE-UHFFFAOYSA-N	432.440	1.686	50	20	IDGD	
Nc1cnnc(NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)c1Cl	1333509560	RXGDRVRBIMHPJJ-UHFFFAOYSA-N	432.893	1.948	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(CCN(C(=O)c3ccc4nccnc4c3)C2)C1	1777973877	HHJAOCXQGYEZHO-IBGZPJMESA-N	433.306	1.858	50	20	IDGD	
O=C(c1ccn2cncc2c1)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1778658525	QIJAMMKYDSEJID-PBHICJAKSA-N	425.258	1.468	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)/C=N/N3CCCCC3)C2)C1	1779020281	MBHDRFPRYVNSNS-VZCCDBLZSA-N	429.359	1.462	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CC(F)(F)C(=O)O)C2	1779543873	RXPRMLNFOFZCDP-CXAGYDPISA-N	436.528	1.462	50	20	IDGD	
COc1nc(C)ccc1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1779741145	PILXZXVEPKQNMU-GUYCJALGSA-N	430.274	1.533	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(OC)cc3OC)C2)C1	1780536859	PTORVUADVJQCGD-OXQOHEQNSA-N	426.897	1.401	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cn1cc([N+](=O)[O-])cn1)C2	1780700637	VNVAKTLRTBVIIC-IIDMSEBBSA-N	427.889	1.323	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](F)Br)C2)nn1C	1780771077	RWMVFXBGDGOBFJ-JKIFEVAISA-N	431.306	1.547	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C=C/C1CCCC1)C2	1782213484	VMMRCSBSTYAEHY-XYRGPISMSA-N	434.581	1.620	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)Cc1ccccc1)C2)C(Cl)Cl	1782221494	WTBBNCBWJNYFKH-JXXFODFXSA-N	429.344	1.908	50	20	IDGD	
CCN1CCC(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](Cl)COC)C3)CC1	1783300435	CZVXOEGMIJZPOI-DBXWQHBBSA-N	429.989	1.486	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cncn3-c3ccncc3)CCO2)C1	1783533215	XKIFWNTWFBROHC-AUUYWEPGSA-N	448.321	1.494	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cn4c(F)cccc4n3)CCO2)C1	1783538525	XYTJRBGLJMOYLW-KPZWWZAWSA-N	439.285	1.700	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3c(-c4ccncn4)noc3C)CCO2)C1	1783883852	ZUKPZJVNQDLTLE-VLIAUNLRSA-N	449.895	1.137	50	20	IDGD	
CC(C)c1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc1	1783935392	PKEGHLRYMBYYMF-QHCPKHFHSA-N	430.549	1.627	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)C3(O)CCC3)C[C@@H]21	1783963873	BMOOTZZINSTYKX-OWYFMNJBSA-N	431.371	1.548	50	20	IDGD	
COC(=O)[C@@H]1CC[C@H](C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]32)C1	1784088114	VOBAYOUBUBKFEB-RMMITJNHSA-N	449.375	1.792	50	20	IDGD	
COC(=O)[C@@H]1CC[C@H](C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Br)C[C@@H]32)C1	1784088527	WTPYFPMVICNPBG-IWTMDLJTSA-N	449.317	1.246	50	20	IDGD	
Cc1cc(F)c(C(=O)N2CC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)cc1F	1785067603	ZJPWWKNGYQKYMQ-NRFANRHFSA-N	438.475	1.090	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CC[C@@]3(CN(C(=O)CCBr)CCO3)C2)cc1	1785103299	TUZXWJKTFAAVDP-LJQANCHMSA-N	438.322	1.874	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)cc1	1785107896	RYHLBHBUCCRJHY-YJYMSZOUSA-N	438.322	1.872	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC1(c2ccc(NC(=O)CN3CCSCC3)cc2)CCC1	1785823952	YIJFVUNJILEYMF-UHFFFAOYSA-N	447.605	1.542	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](N)Cc3cscn3)[C@H]2C1	1787398349	VYOPZUIIVUXQRC-VZUYIZPNSA-N	449.404	1.229	50	20	IDGD	
CCn1ccc(C(=O)Nc2ccc(C3(NC(=O)c4cnccc4C(=O)NN)CCC3)cc2)n1	1787499602	UPXWAQKCIGLQQZ-UHFFFAOYSA-N	447.499	1.963	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC1(c2ccc(NC(=O)[C@@H](N)CCC(N)=O)cc2)CCC1	1787979967	QZDBWYCKGNDLOU-KSSFIOAISA-N	429.348	1.950	50	20	IDGD	
CN(C)c1ncc(C(=O)NC2(c3ccc(NC(=O)c4ccc(B(O)O)cc4)cc3)CCC2)o1	1788140248	OKYHMEMMCCRYOF-UHFFFAOYSA-N	448.288	1.482	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc4n(n3)CCC4)[C@H]2C1	1788415516	FARBYRZNCFNCNS-FAYQHZLMSA-N	439.354	1.596	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]3C2)cnc1C	1789922555	OWGTVWJITFMZOC-QCEMKRCNSA-N	428.302	1.982	50	20	IDGD	
Cc1cccc(CCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]3C2)c1	1791287929	DRKBEAIFSOIYJN-ACRUOGEOSA-N	444.576	1.280	50	20	IDGD	
COc1cccc(/C=C/C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)c1	1796192116	KFZKKFBQXIATKB-IKNLRRFCSA-N	434.301	1.340	50	20	IDGD	
CCCc1onc(C)c1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2	1796615706	GJPSDZCMRCRMOT-JLUCKKNBSA-N	432.290	1.829	50	20	IDGD	
Cc1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](F)Cl)n(-c2cccc(=O)n2C)n1	1796806101	RPJJXIUFPNLMKE-AHXJXLJNSA-N	435.887	1.666	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C[C@@H]1CCCCO1)C2	1796890900	OJORACVVOBCHDJ-OSVXTHCDSA-N	429.521	1.718	50	20	IDGD	
C[C@H]1CCc2c(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@@H](F)Br)C4)n[nH]c21	1796972542	ZMYCACHWJOHSLJ-RMEBFJKESA-N	429.290	1.353	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(-c2cccs2)on1	1798128729	NBAHOLAPGFRKGK-LKQDWFRTSA-N	439.921	1.860	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc2cnccc12)c1ccc(B(O)O)cc1	1798129492	DOPDYXHGKYQNAG-ACDBMABISA-N	429.285	1.480	50	20	IDGD	
Cc1ccccc1OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Br	1799346662	VGKDSDQRWOWUGE-RMHZUWNSSA-N	429.286	1.654	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc([N+](=O)[O-])cc1F	1799492992	IPFUAQVWKJENMS-YYHMBLRTSA-N	444.257	1.721	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccn2nccc12	1799973822	PMGXRZBTQCPBGI-UESRRSCYSA-N	425.316	1.774	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ncn(C(C)C)n1)C2	1800641357	ZMEIEBCIXUWNOX-CRWXNKLISA-N	428.331	1.236	50	20	IDGD	
CCOc1ncccc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)Br	1800754479	OQFVHGCGUIPGHI-XPCVCDNBSA-N	426.311	1.467	50	20	IDGD	
Cc1nccn1CCCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)Br)C2	1801310510	CRDQWLSPMWDOLF-FAYQHZLMSA-N	427.343	1.345	50	20	IDGD	
N#Cc1ccccc1OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2	1801991736	LDZASPWTKMXVCD-DLTLXFJOSA-N	440.269	1.217	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@H]1c1cccnc1)c1csnn1	1803753073	IFQFKDLLDKIMAP-WCFLWFBJSA-N	428.287	1.943	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC2(CCCN(C(=O)Cn3cc([N+](=O)[O-])cn3)C2)CC1	1806934892	KGSVGTKNTOZZDJ-ZDUSSCGKSA-N	442.314	1.806	50	20	IDGD	
COCCOCC(=O)N1CC[C@H](CNC(=O)[C@@H](F)Br)[C@H]1c1cccnc1	1808661316	IERVULYEIYEVEO-FVQBIDKESA-N	432.290	1.441	50	20	IDGD	
Cn1ccc(C(=O)N2CC[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)c1	1810299951	VSNYHDVRNCESBV-JXFKEZNVSA-N	447.499	1.052	50	20	IDGD	
CCC(=O)C(=O)NC[C@H]1CCN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@@H]1c1cccnc1	1812565710	MRPJYROIOPCDAX-JMBUVSEHSA-N	438.488	1.201	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)CSCC(=O)O)[C@@H]1c1cccnc1	1812867126	FGRRPXAEFGSUNI-DETPVDSQSA-N	444.351	1.689	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H]3CCC(=O)N3)sc2C1	1814040087	BINAQLJPWUNRPC-YWVKMMECSA-N	429.340	1.365	50	20	IDGD	
COc1ccc([C@H](O)C(=O)N2CCCC[C@H]2c2cc(NC(=O)[C@H](O)CCl)n[nH]2)cc1	1814863959	DJOMKSSSJGPRRI-JZXOWHBKSA-N	436.896	1.744	50	20	IDGD	
O=C(Cc1ccccc1)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1	1815339905	TXRKLRDVXUSKAL-KRWDZBQOSA-N	435.314	1.291	50	20	IDGD	
CC(C)C1(C(=O)N[C@@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)CCC1	1815347879	VHNAFBHFAHGFJW-MRXNPFEDSA-N	441.362	1.875	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](F)Br)CC2)c1nc[nH]c1[N+](=O)[O-]	1817203212	RWXDFHBYPLJGEC-MLUIRONXSA-N	447.246	1.691	50	20	IDGD	
CC(C)CNC(=O)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](C)CBr)CC2	1817319927	CNOHJWAXSYAGHO-GHMZBOCLSA-N	445.383	1.858	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3cn4ncccc4n3)sc2C1	1818466505	QVTUIZOGXRJQJW-QWRGUYRKSA-N	434.909	1.665	50	20	IDGD	
CCNC(=S)NCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](C)Br)n[nH]1	1822188878	PFWHKMUMGCYPRS-CMPLNLGQSA-N	445.387	1.669	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)N[C@H]1CCc2nc(NC(=O)[C@@](C)(Cl)CCl)sc2C1	1822863938	UXRBOOGKZFOOHH-BEPCFFQHSA-N	436.365	1.738	50	20	IDGD	
CCOC(=O)N[C@@H](O)C(=O)N1CCC([C@@H]2CCCCN2C(=O)C(C)(C)CCl)CC1	1824013821	RYAZECRARZNSAT-HOTGVXAUSA-N	431.961	1.936	50	20	IDGD	
O=C([C@H]1Cc2ccccc2CN1)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)CC1	1824182993	NCVTXUUXGDUJRP-HKBOAZHASA-N	433.980	1.920	50	20	IDGD	
Cc1nc2ncccn2c1C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H](O)CCl)CC1	1824186243	LOOVDLACZGLDBY-SJORKVTESA-N	433.940	1.871	50	20	IDGD	
CN1CCCC[C@@H]1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1	1824199021	HLNZYFCHIXTHPP-FCHUYYIVSA-N	441.381	1.084	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)c2cccs2)CC1	1825776737	JIENPTDVRHAYNJ-LJQANCHMSA-N	426.347	1.975	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1nc3ccccn3n1)CC2	1825998859	NJOKJPSINKGZMC-WDEREUQCSA-N	434.909	1.665	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1nn(C)c3c1CCC3)CC2	1825999767	CLQWBZHPVLBZIB-JQWIXIFHSA-N	437.953	1.845	50	20	IDGD	
CC(C)(CCl)C(=O)N[C@H]1CCc2nc(NC(=O)C[C@](C)(O)CC(=O)O)sc2C1	1826067843	KUEKVBFCUAZGCI-YPMLDQLKSA-N	431.942	1.936	50	20	IDGD	
O=C(c1ccc(O)cc1)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827052685	XFICAFAKOWHTFC-JOCHJYFZSA-N	436.317	1.619	50	20	IDGD	
O=C(c1cncc(O)c1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827053151	FPOPRPAPLCHNGV-NRFANRHFSA-N	437.305	1.014	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)C(F)(F)C(F)F)C2)C1	1830535134	JUYZETITTOUJTC-IINYFYTJSA-N	449.239	1.374	50	20	IDGD	
Cc1ncoc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2	1830537605	LFKSLKIMHSOMRO-SJCJKPOMSA-N	430.299	1.084	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccncc3)C2)C1	1830537801	OYAYVMXCKORBQD-KSSFIOAISA-N	426.311	1.183	50	20	IDGD	
O=C(CCc1ccccc1Cl)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1830724716	YOYOLNXBPBHFSQ-PXNSSMCTSA-N	445.343	1.329	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCN3CCCCC3)C2)C1	1831647103	PWUXSBXVFBYUSK-RXVVDRJESA-N	429.989	1.726	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2CCCOC2)CC1	1832868687	VJWTWMGMVIWSOE-CTNGQTDRSA-N	428.338	1.026	50	20	IDGD	
CCOc1ccsc1C(=O)NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1833020552	VCJNHCOITGEYRA-MRXNPFEDSA-N	443.997	1.932	50	20	IDGD	
C[C@@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)Cn3cccn3)CC2)CC1	1833263603	NORSWEKFZZUENS-HNNXBMFYSA-N	440.386	1.486	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)Cc3cccc(F)c3)CC2)CC1)[C@H](O)CCl	1833308997	HZTYJBHCCQBXOD-LJQANCHMSA-N	425.932	1.540	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3ccc4cccnc4n3)CC2)CC1)[C@H](O)CCl	1833309838	AWSWCTNXCWPSNI-LJQANCHMSA-N	445.951	1.415	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)c3cccn(C)c3=O)CC2)CC1	1833530460	YIFAVAURUNVADQ-IBGZPJMESA-N	436.984	1.978	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCBr)CCO3)C2)nc1C	1834819424	QPQBHLMVJOGANO-LJQANCHMSA-N	440.338	1.553	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CCN3CCCCC3)CCO2)C1	1835135433	JZIORQSMNYAJOT-VQIMIIECSA-N	446.386	1.102	50	20	IDGD	
O=C(CCc1ccc2c(c1)OCO2)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1835180502	JDKFEXIRIYNQGB-ICSRJNTNSA-N	442.871	1.339	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CC3CCOCC3)CCO2)C1	1835423768	JPLGTQIICPQBFI-VQIMIIECSA-N	447.370	1.433	50	20	IDGD	
C[C@H](C(=O)NC1CCN(C2CCN(C(=O)C(Cl)Cl)CC2)CC1)N1C[C@@H]2C[C@H]2C1	1835676655	IYJXOEVIOUELIC-ILXRZTDVSA-N	431.408	1.702	50	20	IDGD	
O=C(CS[C@H]1CCCCO1)NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1835757075	NMLONGMTOBAICM-HKUYNNGSSA-N	448.029	1.418	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CNc3ccccc3C)CCO2)C1	1835866911	MVDPKSCXCQTOKU-DYESRHJHSA-N	439.940	1.117	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC(OC2CCN(C(=O)c3cccs3)CC2)CC1	1837397087	KMHVVAAHJBTLMD-UHFFFAOYSA-N	442.346	1.354	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cnc(OC)cn3)CC2)CC1	1837572167	IGSKXZHRECRZQP-INIZCTEOSA-N	440.928	1.351	50	20	IDGD	
CC(C)(C)CC(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1	1837642589	MYZWWXVGPRMPMY-UHFFFAOYSA-N	430.354	1.415	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3ccnc(Cl)n3)CC2)CC1	1838460092	CSBVROJREKTZET-OAHLLOKOSA-N	445.347	1.996	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4c(cnn4C)c3)C2)C1	1839145205	YRBLXBFROBJDCZ-UWJYYQICSA-N	434.924	1.661	50	20	IDGD	
CCOCC(=O)N1CCOC[C@]2(C1)CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)CCO2	1839743189	ANGBUUJTPUJFKQ-IXNCKXOBSA-N	449.454	1.365	50	20	IDGD	
CCc1ncsc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2	1840034875	ZTJGDWHNHHOAKZ-SJKOYZFVSA-N	446.367	1.559	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)C(=O)c3cccn3C)CCO2)C1	1840481136	FGUFHCUPRWHNJT-FOIQADDNSA-N	425.913	1.072	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(F)cc3C)CCO2)C1	1840778466	BRVYBRVMXJOGPU-PXNSSMCTSA-N	428.888	1.458	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC2(CCCN2C(=O)Cc2cncnc2)C1	1842095372	CIIWPMHHTCLBAN-HNNXBMFYSA-N	437.928	1.355	50	20	IDGD	
O=C1CC[C@H](C(=O)N2CCCC23CN(C(=O)[C@@H](Br)Cc2ccccc2)C3)N1	1842798324	JZRQPOLDTUEYOS-JKSUJKDBSA-N	434.334	1.475	50	20	IDGD	
CC[C@@H](C)[C@@H](N)C(=O)N1CCCC12CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2	1842894242	LGCXIHPBKVXXFS-FZKQIMNGSA-N	432.477	1.711	50	20	IDGD	
C[C@@H]1OCCN(C(=O)OC(C)(C)C)[C@H]1C(=O)N1CC2(CCCN2C(=O)[C@@H](F)Cl)C1	1843362214	HNSHRLSGQYAJAP-BFHYXJOUSA-N	433.908	1.749	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)c1	1844263475	IVUPSJZQMWETES-UHFFFAOYSA-N	437.500	1.198	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)CN(C)C(C)C)C2	1844693572	UTHCPNBQYANPEW-UHFFFAOYSA-N	432.477	1.677	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@H]2CN(C(=O)OC(C)(C)C)C[C@@H]2O)C1	1845107819	NHINRYXFIPAQHH-ILXRZTDVSA-N	429.945	1.435	50	20	IDGD	
C[C@@](O)(CC(=O)O)CC(=O)N1CC2(CCCN2C(=O)/C(C#N)=C/c2ccc(F)cc2F)C1	1845871906	COIXCKOBZCPILQ-LFEYGZQNSA-N	447.438	1.691	50	20	IDGD	
CCCN1CCN(c2ccc(C(=O)N3CC[C@H]4[C@@H]3CCN4C(=O)[C@H](O)CCl)cc2)CC1	1847561723	DEXAQGUOYCNSDL-PCCBWWKXSA-N	448.995	1.634	50	20	IDGD	
CC(C)[C@H](CNC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl	1847563828	MFJYTEHCVRLEAE-VGWMRTNUSA-N	431.961	1.585	50	20	IDGD	
CSCC[C@H](NC(=O)c1ccc(Cl)cc1Cl)C(=O)NNC(=O)C(=O)NC1CC1	9889197	VXCGXGAUHKLOKQ-ZDUSSCGKSA-N	447.344	1.271	50	20	IDGD	
CCOc1ccc(N2C[C@@H](C(=O)NNC(=O)c3ccc(OC)c(OC)c3)CC2=O)cc1	10143096	KDCGJVPXMBALOB-HNNXBMFYSA-N	427.457	1.917	50	20	IDGD	
CS(=O)(=O)CC[C@H](NC(=O)c1ccccc1Cl)C(=O)NNC(=O)c1ccccc1	17171116	ANKMTTCIYJJKEA-INIZCTEOSA-N	437.905	1.334	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)CNC(=O)c2ccc(C)s2)c2ccccc2c1=O	104746635	CVPOZSARURROJK-UHFFFAOYSA-N	427.486	1.367	50	20	IDGD	
CCOc1ccc(NC(=S)NNC(=O)CN(C)C2=NS(=O)(=O)c3ccccc32)cc1	725909187	GBAYXFURPQVFPA-UHFFFAOYSA-N	447.542	1.484	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)c1cc(Cl)c2c(c1)OCCCO2	726088033	AMRFBPMWTRBWQF-UHFFFAOYSA-N	438.893	1.869	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)c2cccn2C)ccc1OCC(=O)N1CCCCC1	726540712	KVDYPIHHAIMXLR-UHFFFAOYSA-N	428.489	1.890	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)c3ccn(C)n3)c2)c(C)c1	727364939	XOZHQIPGFXOEAP-UHFFFAOYSA-N	427.486	1.913	50	20	IDGD	
CN(C)CC(=O)NNC(=O)c1cc(S(=O)(=O)Nc2ccc(F)cc2)ccc1Cl	727761511	KVDLVHYLSZMXOH-UHFFFAOYSA-N	428.873	1.603	50	20	IDGD	
CC(C)N1C(=O)c2ccc(C(=O)NNc3nc(-c4cccnc4)no3)cc2S1(=O)=O	728079216	PZMXMTMRDSUAGD-UHFFFAOYSA-N	428.430	1.441	50	20	IDGD	
Cc1cccc([C@@H](CC(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)NC(N)=O)c1	728209779	LXELCLKLDBBXJR-GOSISDBHSA-N	431.518	1.679	50	20	IDGD	
CC(C)Oc1ccc(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)cn1	728214563	AHKPEELDANNMJW-UHFFFAOYSA-N	433.534	1.562	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NC[C@H]1CCN(CCc2ccccc2)C1	728714965	FLUIJRCWPMDWEK-QGZVFWFLSA-N	429.546	1.373	50	20	IDGD	
CC[C@@H](C)NC(=O)CN1CCN(C(=O)NNC(=O)c2c(Cl)cccc2Cl)CC1	728954074	KOQWQTBVZQESQZ-GFCCVEGCSA-N	430.336	1.880	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)c3ccccc3n2)cc1	729275088	KOQNXNHXLUWSEJ-CYBMUJFWSA-N	442.497	1.609	50	20	IDGD	
N#C/C(=C/c1ccc(OC(F)(F)C(=O)O)cc1)C(=O)Nc1ccc(S(N)(=O)=O)cc1	730732271	HSDZOMRAESXGLY-XFXZXTDPSA-N	437.380	1.936	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)c1cc(S(=O)(=O)Nc2ccccc2F)c[nH]1	730778095	IUXMSICCAKXFGA-UHFFFAOYSA-N	448.432	1.500	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)N1CCCN(C(=O)CC2CCCC2)CC1	730828369	WRNGDDCWMMJDHI-UHFFFAOYSA-N	435.550	1.333	50	20	IDGD	
CCN(CC)C(=O)COc1cccc(NC(=O)NNC(=O)COc2ccccc2O)c1	730897571	NIUMDQLOFDOOGJ-UHFFFAOYSA-N	430.461	1.871	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)CCNS(=O)(=O)c1cccc([N+](=O)[O-])c1)c1ccccc1	732133186	SARRKLXAYFFHQT-KRWDZBQOSA-N	434.474	1.604	50	20	IDGD	
O=C(COC(=O)c1cnnn1-c1ccccc1Cl)NNC(=O)c1cccc([N+](=O)[O-])c1	732332673	WRNSDCXEJYAGQL-UHFFFAOYSA-N	444.791	1.447	50	20	IDGD	
O=C(COc1ccccc1-c1ccccc1)NNC(=O)NCCN/C(O)=C1/N=CC=CC1=O	732467036	UJLUPTSKHZHWCI-DQRAZIAOSA-N	449.467	1.589	50	20	IDGD	
C[C@@H]1CCC[C@@H](OCC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)C1	732931759	GENIMJLURUOSBK-NVXWUHKLSA-N	439.534	1.064	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)[C@H](C)Oc2ccc(F)cc2Cl)n1	733563311	MIOWGZRWXZIUQF-JTQLQIEISA-N	429.857	1.945	50	20	IDGD	
Cn1c(=O)nc(O)c2c(C(=O)NNC(=O)C(C)(C)C)cc(-c3ccc4c(c3)OCO4)nc21	733952258	YYKAYRDDRYKRFN-UHFFFAOYSA-N	439.428	1.237	50	20	IDGD	
CC(C)n1ncc2cc(/C=C\C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)c(=O)[nH]c21	734239819	FGIVWJNJIANBAP-SREVYHEPSA-N	447.496	1.174	50	20	IDGD	
Cc1nn(C)c2nc(C3CC3)cc(C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)c12	734240791	UDHVCIBBOVVRSJ-UHFFFAOYSA-N	431.497	1.623	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNS(=O)(=O)c1ccc2c(c1)N(C(C)=O)CC2	734417615	BMUPMQZOZUPOTC-UHFFFAOYSA-N	433.486	1.383	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cccc(-n3cccn3)c2)cc1	735027773	DEHOVFYJJSEYMY-UHFFFAOYSA-N	427.486	1.262	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)Cc2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2)cn1	735470643	GEZIDHQCSLTNOB-UHFFFAOYSA-N	431.449	1.364	50	20	IDGD	
C[C@@H](CN1CCN(c2ccccn2)CC1)NC(=O)NNC(=O)Cc1c[nH]c2ccccc12	735585258	CSIWNZLCWLHHOQ-KRWDZBQOSA-N	435.532	1.647	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)CCn2c(=O)n(C)c3ccccc32)cc1C	736755904	WZFBTEZEGOBIEY-UHFFFAOYSA-N	444.513	1.667	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)c1cccc(S(=O)(=O)NC[C@H]2CCCO2)c1	738545673	KONQBEJYWYFLFN-GOSISDBHSA-N	447.513	1.122	50	20	IDGD	
CN(C)c1nccc(NNC(=O)c2ccc(S(=O)(=O)NCCc3cccs3)cc2)n1	740102864	GXVSFTKJTOTVES-UHFFFAOYSA-N	446.558	1.882	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)Cn1cnc2scc(-c3cccs3)c2c1=O	740850822	ASPWJTXVZUTIEE-UHFFFAOYSA-N	447.542	1.639	50	20	IDGD	
CNC(=O)c1cccc(CCNC(=O)NNC(=O)COc2ccc(Br)cc2)c1	740920693	RCYMBSQFFNSZOH-UHFFFAOYSA-N	449.305	1.761	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)NCCCN2CCN(c3ccncc3)CC2)cc1	743576392	XMQRWCDNQWXZKW-UHFFFAOYSA-N	440.552	1.696	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)N2CCN(CC(=O)NC3CC3)CC2)c(C)n1C[C@H]1CCCO1	744313336	DYPZWRPTHYTZFC-WVWKGNOCSA-N	439.560	1.614	50	20	IDGD	
O=C(COC(=O)CCNC(=O)N1CCc2ccccc2C1)NNC(=O)c1cccs1	745059265	YWZRLJNVFXPFLO-UHFFFAOYSA-N	430.486	1.210	50	20	IDGD	
C[C@@H]1CCC[C@@](CNC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)(N(C)C)C1	745719862	KKTYTJGAOJYQSV-AUUYWEPGSA-N	425.555	1.936	50	20	IDGD	
O=C(NCCc1nc(C(F)(F)F)cs1)NNC(=O)c1nnc(O)c2ccccc12	745920625	OZYUTRCGWCYEEU-UHFFFAOYSA-N	426.380	1.997	50	20	IDGD	
Cc1ccc(-n2[nH]c(C(=O)NNC(=O)c3sc(N4CCOCC4)nc3C)cc2=O)cc1	746098636	WMQGJKDTVVILPE-UHFFFAOYSA-N	442.501	1.150	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(C(=O)NNC(=O)c2cccn2C)ccc1Br	747598658	GTDZVBNVLAKVMF-UHFFFAOYSA-N	429.296	1.113	50	20	IDGD	
CCCC[C@H](NC(N)=O)C(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1	747780950	GANKIQWMKIVOTR-LEWJYISDSA-N	437.544	1.988	50	20	IDGD	
CCc1cccc(NC(=O)CNC(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)c1	748460399	DOBMAMKJKQJSOJ-UHFFFAOYSA-N	434.522	1.596	50	20	IDGD	
C=CCN1C(=O)C(=O)N(CC(=O)NNC(=O)c2cc3c(s2)CC[C@@H](C(C)(C)C)C3)C1=O	748555519	ROYHNQASMPMZRL-CYBMUJFWSA-N	446.529	1.637	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1c(C)oc2ncn(C)c(=O)c12	750522705	VJIXOKTVQPIAJF-UHFFFAOYSA-N	448.819	1.115	50	20	IDGD	
Cc1nn(Cc2ccc(C(=O)NNC(=O)CNC(=O)c3ccco3)cc2)c(C)c1[N+](=O)[O-]	751205225	ZTIBXDTWTJGQGX-UHFFFAOYSA-N	440.416	1.240	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCc1cnc(N(C)C)n1C	751807098	MYOPVRIZTYPZPX-LLVKDONJSA-N	439.314	1.547	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)c1noc(Cc2ccccc2)n1	753048510	CDIOCTMGEYWYQG-CYBMUJFWSA-N	447.455	1.613	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)c3cc(S(=O)(=O)N(C)C)oc3C)n[nH]2)cc1	753328879	PUYTZFWFGFDMRB-UHFFFAOYSA-N	431.474	1.612	50	20	IDGD	
CCCc1c(C(=O)NNc2ccc(C(N)=O)nn2)cnn1-c1cc(F)c(OC)cc1F	753425468	WZTWSABYJBEWDM-UHFFFAOYSA-N	431.403	1.757	50	20	IDGD	
CCCCCn1nc(C(=O)NNS(=O)(=O)c2cn(C(C)C)cn2)c2ccccc2c1=O	753949887	SJNSUWNPSRMFOP-UHFFFAOYSA-N	446.533	1.987	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)Nc1cccc(C(=O)NCCC(N)=O)c1	756389158	AUYQTUNCBWKKKZ-GFCCVEGCSA-N	431.424	1.051	50	20	IDGD	
CNC(=O)COc1ccc(NC(=O)NNC(=O)c2cc(Br)ccc2O)cc1	756442774	QJFOYKHEWVZLAF-UHFFFAOYSA-N	437.250	1.746	50	20	IDGD	
O=C(CCSc1ccc(F)cc1)NNC(=O)Nc1ccn(CCN2CCOCC2)n1	756645448	FYQKNACRGQAARM-UHFFFAOYSA-N	436.513	1.690	50	20	IDGD	
O=C(CC12CC3CC(CC(C3)C1)C2)NNC(=O)Nc1ccn(CCN2CCOCC2)n1	756645629	HDPBOWRYKOUICW-UHFFFAOYSA-N	430.553	1.975	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)NCc1cc2c(cc1OC(F)F)OCO2	756961358	MPTJIOQDJDNGER-UHFFFAOYSA-N	425.344	1.632	50	20	IDGD	
O=C(NC[C@H]1CCCS1)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	757254465	KWPXRYAJMLERGH-OAHLLOKOSA-N	426.564	1.701	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)Nc1ccc(CS(C)(=O)=O)c(F)c1	757675920	PKBQQIQOWAEEBU-UHFFFAOYSA-N	446.501	1.828	50	20	IDGD	
CN(C)c1nnc(-c2ccc(NC(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)cc2)o1	757719010	BYNKTXDVOPWIPE-UHFFFAOYSA-N	444.473	1.673	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)Nc1cccc(-n2ccnn2)c1	757733526	AWJHQHKDVMNMEI-UHFFFAOYSA-N	434.504	1.632	50	20	IDGD	
CN1CCc2ccc(NC(=O)NNC(=O)c3ccc(S(=O)(=O)N4CCCC4)cc3)cc21	757917619	LIZLMDYSYNAWMD-UHFFFAOYSA-N	443.529	1.930	50	20	IDGD	
CCS(=O)(=O)N1CCC(CNC(=O)NNC(=O)COc2ccc(C)c(C)c2)CC1	758741892	HLBCHPAMOKEFME-UHFFFAOYSA-N	426.539	1.074	50	20	IDGD	
C[C@H](CC(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1)NC(=O)C1CCCC1	758781411	BVDZSJWTZWZKLW-OAHLLOKOSA-N	439.557	1.707	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)CC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)C[C@@H](C)O1	760119361	HIVSIAGTCRCEBQ-BRWVUGGUSA-N	426.558	1.670	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)c2ccccc2F)c(OC)c1	761268294	ZJUHLMHWITYQTL-UHFFFAOYSA-N	431.467	1.219	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)c1	761803433	UQYNJILFFVPYHL-GOSISDBHSA-N	444.513	1.225	50	20	IDGD	
O=C(NNC(=O)c1ccncc1)C(=O)Nc1ccc(-c2n[nH]c(-c3ccccc3)n2)cc1	763466281	KRMOYFUAJHVOHM-UHFFFAOYSA-N	427.424	1.933	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)cc1	763601041	NHEXHVGQGMZLLO-UHFFFAOYSA-N	437.412	1.028	50	20	IDGD	
COC(=O)c1c(NC(=O)C(=O)NNC(=O)c2c(C)nc3ccccn23)sc(C)c1C	763627838	DVAMZEMJYIRSOT-UHFFFAOYSA-N	429.458	1.507	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2cccc(CS(C)(=O)=O)c2C)c1	763644585	LAABSIWVYMFRCV-UHFFFAOYSA-N	447.513	1.321	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(C)c(NC(C)=O)c1C	763647111	NLUSDGJBTBNVJJ-UHFFFAOYSA-N	428.445	1.435	50	20	IDGD	
CCN(Cc1ccccc1NC(=O)C(=O)NNC(=O)COc1ccc(OC)cc1)C(C)=O	763661809	PGMLPGODOKWBPX-UHFFFAOYSA-N	442.472	1.229	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc([S@](C)=O)c(F)c1	763680515	GIUOZZPZDIQNTM-PMERELPUSA-N	437.449	1.127	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)C(=O)Nc1ccc(C(=O)NC2CCCC2)cc1	763681426	GAHORXSIYLNPHD-UHFFFAOYSA-N	442.447	1.663	50	20	IDGD	
COC(=O)Nc1cc(NC(=O)C(=O)NNC(=O)Cc2c[nH]c3ccccc23)ccc1F	763860284	CTGHMDTWZLRIBW-UHFFFAOYSA-N	427.392	1.814	50	20	IDGD	
CCCn1cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(Br)c2)cn1	763884250	TXWIZFPFUAIHKD-NSHDSACASA-N	438.282	1.609	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)OC)c(C)c2)cc1OC	763901080	FJQIYTOFJLKUJW-UHFFFAOYSA-N	429.429	1.589	50	20	IDGD	
Cc1nn(-c2ccccc2)cc1NC(=O)C(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	763945391	XJVVTEYVXWPLBU-UHFFFAOYSA-N	445.439	1.472	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)C(=O)Nc1ccc(F)cc1OC(F)F	763999311	VHGOAAFCYCVGRY-UHFFFAOYSA-N	435.156	1.917	50	20	IDGD	
COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NNC(=O)c1cc(Br)cn1C	764004833	OISJWGDIRPOEBU-UHFFFAOYSA-N	440.210	1.104	50	20	IDGD	
CCn1nnnc1-c1cccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)on2)c1	764017325	WRQQXSOSAWCMER-UHFFFAOYSA-N	446.427	1.415	50	20	IDGD	
O=C(Cc1cccc2ccccc12)NNC(=O)C(=O)Nc1ccn(Cc2ccccn2)n1	764019487	NHZGTNVGVHWYGP-UHFFFAOYSA-N	428.452	1.808	50	20	IDGD	
CCN(CC)C(=O)c1ccccc1NC(=O)C(=O)NNC(=O)c1ccc(Cl)cc1O	764116854	IWCCMPBVKVOBRQ-UHFFFAOYSA-N	432.864	1.927	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(-c3nncn3C)c2)o1	764138098	AZFJIONDDFRVTP-UHFFFAOYSA-N	439.476	1.317	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cccnc2Br)o1	764138634	GDNHXSWPUBVRNZ-UHFFFAOYSA-N	438.282	1.679	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)ccc1-n1nnnc1C(C)C	764152886	HLIMOSCDGDFOEM-GOSISDBHSA-N	449.471	1.184	50	20	IDGD	
Cc1c(CS(C)(=O)=O)cccc1NC(=O)C(=O)NNC(=O)CCCc1cccs1	764340130	UCKCTISIPGYRBL-UHFFFAOYSA-N	437.543	1.710	50	20	IDGD	
O=C(NNC(=O)C(F)(F)Oc1ccccc1)C(=O)Nc1ncn(Cc2ccccc2)n1	764380314	VJCRYBQWJDRWPQ-UHFFFAOYSA-N	430.371	1.084	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc(CC(=O)NC)cc3)n[nH]2)cc1	764385353	YSYKGBKNGVLJEZ-UHFFFAOYSA-N	448.483	1.327	50	20	IDGD	
CC(C)CNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)cc1	764400032	FLAFMAUBNCVRHX-UHFFFAOYSA-N	444.513	1.656	50	20	IDGD	
Cn1ccnc1-c1cccc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)c1	764401690	QJKQUSGEQFYMPA-UHFFFAOYSA-N	425.470	1.671	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)cnc1Br	764405710	XKJCFJHZAHKCOB-UHFFFAOYSA-N	439.291	1.736	50	20	IDGD	
O=C(NNC(=O)c1ccccc1F)c1ccc(C(=O)NNC(=O)c2ccccc2F)o1	764516305	RWSIJXRFMDWSTO-UHFFFAOYSA-N	428.351	1.707	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)OC(C)(C)C)cc1S(=O)(=O)N1CCCCC1	765399431	XGYLNGJVTNCALI-UHFFFAOYSA-N	440.522	1.664	50	20	IDGD	
CSc1ccc(C)c(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)c1	765737349	DQCGCKGDYBVJBL-UHFFFAOYSA-N	426.542	1.936	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3ccc(C(F)(F)F)nc3)CC2)cc1	765756360	VBLGJWDQYNFNMU-UHFFFAOYSA-N	435.450	1.988	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cn(C)nc3C(F)(F)F)CC2)cc1	766643958	NAWGREJILPCDAU-UHFFFAOYSA-N	438.454	1.326	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3c[nH]c4ccccc4c3=O)CC2)cc1	766649501	QCUGTCKOCNUCHT-UHFFFAOYSA-N	433.512	1.415	50	20	IDGD	
CC(C[C@@H]1COCCN1C(=O)OC(C)(C)C)=NNC(=O)c1ccc(-n2cnnn2)cc1	767368785	VKMFVEWELHMWHC-QGZVFWFLSA-N	429.481	1.794	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)[nH]n1)c1ccc(N2C(=O)CCC2=O)c([N+](=O)[O-])c1	767415949	UJRMOJINOIXQNI-UHFFFAOYSA-N	448.395	1.713	50	20	IDGD	
Cn1c(NNC(=O)c2ccc(N3C(=O)CCC3=O)c([N+](=O)[O-])c2)nc2ccccc2c1=O	767920460	BVLGAQLZFBYLIY-UHFFFAOYSA-N	436.384	1.252	50	20	IDGD	
O=C1CCc2cc(C(=O)NNc3ccccc3S(=O)(=O)N3CCOCC3)c(F)cc2N1	768175386	ULHUOOYDVQZQDZ-UHFFFAOYSA-N	448.476	1.488	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc2c(c1)nc(CCC(=O)NNc1ccc([N+](=O)[O-])cc1)n2C	768247788	VEAAOYNEQSVXFM-UHFFFAOYSA-N	446.489	1.808	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1ccnn1-c1cccc(F)c1	770771512	KIQNDVMAMJAPPH-UHFFFAOYSA-N	425.376	1.182	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)[C@@H]3CCCN(C(=O)Nc4ccccc4F)C3)nc21	770972073	POPNUYGEBGEWHX-LLVKDONJSA-N	428.428	1.595	50	20	IDGD	
Cc1cc2c(N3CCC[C@@H]3C(=O)NNc3nccc(N4CCOCC4)n3)ncnc2s1	771048741	UYZUSOBAUDOMHR-OAHLLOKOSA-N	440.533	1.738	50	20	IDGD	
CCCn1c(=O)nc(O)c2c(C(=O)O[C@H](C)C(=O)NNC(=O)CC)cc(C(C)C)nc21	771992986	IJYPXSVPHRMJPP-LLVKDONJSA-N	433.465	1.133	50	20	IDGD	
C=CCNS(=O)(=O)c1cc(C(=O)O[C@@H](C)C(=O)NNC(=O)CC(C)C)ccc1F	771995397	RKQLOXIPAARQDA-LBPRGKRZSA-N	429.470	1.029	50	20	IDGD	
CC(C)[C@@H]1C[C@@H](NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)CCO1	772619769	NOYCYVVJVDTWEZ-WMZOPIPTSA-N	438.550	1.619	50	20	IDGD	
COC(=O)Cn1cc(C(C)=NNC(=O)COc2ccc(-c3ccc(C#N)cc3)cc2)nn1	772833680	RBTQKWJADBBADQ-UHFFFAOYSA-N	432.440	1.909	50	20	IDGD	
CC(=O)N1CCN(S(=O)(=O)c2cccc(C(=O)NNc3nccnc3C(C)C)c2)CC1	772855025	ZQYOLINEMQJDOG-UHFFFAOYSA-N	446.533	1.210	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)[C@H]1CC=CC[C@H]1C(=O)N1CCOCC1	772971223	YFTAMPVHRFHPQC-JCGIZDLHSA-N	435.908	1.696	50	20	IDGD	
C=CCN(C)S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccccc2[N+](=O)[O-])cc1	773648838	UGWYUALXQLWZHU-UHFFFAOYSA-N	433.446	1.483	50	20	IDGD	
CN(Cc1ccccc1)[C@H](CNC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)C1CC1	773716241	JKDIWZMREMNFDY-HXUWFJFHSA-N	444.557	1.945	50	20	IDGD	
CCN(CC)C(=O)Cn1ccc2cc(NC(=O)C(=O)NNc3nccc(OC)n3)ccc21	773726013	FQTHCEHNRUPSCO-UHFFFAOYSA-N	439.476	1.390	50	20	IDGD	
COC(=O)CN1CCN(c2ccc(NC(=O)C(=O)NNc3cccc(Cl)c3)cc2)CC1	773729089	JMRWQGBGHQEVRT-UHFFFAOYSA-N	445.907	1.717	50	20	IDGD	
CC(C)c1nccnc1NNC(=O)C(=O)Nc1ccc(CC(=O)N2CCSCC2)cc1	773991702	COQJPLATKDJDDK-UHFFFAOYSA-N	442.545	1.800	50	20	IDGD	
COC(=O)COc1cccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)c1	774003238	VYUCMVAYROTMFR-LBPRGKRZSA-N	449.847	1.445	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccnn1-c1ccncc1	774009169	NYQDHDMPWFEMTA-LBPRGKRZSA-N	428.836	1.474	50	20	IDGD	
CS(=O)(=O)Cc1ccc(Cl)cc1S(=O)(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	774608594	QFLIPCUANXAYSZ-UHFFFAOYSA-N	447.878	1.416	50	20	IDGD	
C[C@@H]1CN(CCOc2ccc(CCNC(=O)NNC(=O)c3cnn(C)c3)cc2)C[C@@H]1C	774772899	OPMMLLAVNYRWPF-CALCHBBNSA-N	428.537	1.573	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)CN[C@H](C)c1cccc(S(=O)(=O)N(C)C)c1	775341273	XWWKDZXQTWZUDS-MRXNPFEDSA-N	432.546	1.286	50	20	IDGD	
COC(=O)N1CCC[C@H]([C@H](C)NC(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)C1	776241212	QGPPETGFNDQNSR-KBPBESRZSA-N	442.542	1.261	50	20	IDGD	
C[C@@H](c1cccc(N2CCCS2(=O)=O)c1)N(C)C(=O)NNC(=O)Cc1cccnc1	777507207	FKYQEFIHNUAMKE-HNNXBMFYSA-N	431.518	1.598	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)NCC(=O)NNc2cccc(C(=O)OC)c2)cc1	781038991	KTMBJGJDFCDAFF-UHFFFAOYSA-N	435.458	1.072	50	20	IDGD	
COC[C@@H](CNC(=O)NNc1ccc(S(=O)(=O)NC2CCCCCCC2)cn1)OC	781386827	ASACDQNRSAAYDJ-MRXNPFEDSA-N	443.570	1.760	50	20	IDGD	
CC(=O)N1CCN(Cc2ccccc2NC(=O)NNc2cccc(S(C)(=O)=O)c2)CC1	782077508	MRRSREHWONZHBW-UHFFFAOYSA-N	445.545	1.903	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccccc2CCN(C)C)cc1	782701770	KCYWUGCPMFTMSA-INIZCTEOSA-N	440.500	1.547	50	20	IDGD	
O=C1CN(c2ccc(NC(=O)C(=O)NNc3ccccc3Br)cc2)CCN1	782987340	JQFPXKSTVFWJFI-UHFFFAOYSA-N	432.278	1.467	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)C(=O)Nc1cccc(-c2nnco2)c1	784216107	NDZVGGPVEDKJKP-UHFFFAOYSA-N	442.457	1.259	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNc2nccnc2Cl)c(Br)cc1F	784780895	SAJPOPKLGFSWHY-UHFFFAOYSA-N	446.620	1.900	50	20	IDGD	
COc1cc(F)cc(NNC(=O)C(=O)Nc2ccc(C(=O)NC3CCOCC3)cc2)c1	785236388	FMSNRBQRUVFUPI-UHFFFAOYSA-N	430.436	1.825	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2c(OC)cccc2S(C)(=O)=O)cc1Cl	785331439	VECQJEGXHWVIRH-UHFFFAOYSA-N	427.866	1.843	50	20	IDGD	
NC(=O)CC[C@@H](NS(=O)(=O)c1ccccc1C(F)(F)F)C(=O)NNc1ccccc1	785840077	KFRQZNFVIBZGST-CQSZACIVSA-N	444.435	1.761	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)N[C@@H]1CCCN(C2CCCCC2)C1=O	785924962	QSHAFGSWOXJXCY-MRXNPFEDSA-N	426.477	1.603	50	20	IDGD	
N#C/C(=C\c1ccc(O)cc1)C(=O)NCc1ccccc1CS(=O)(=O)N1CCOCC1	786785683	DBBVNWYVKWXWMT-DEDYPNTBSA-N	441.509	1.778	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(S(=O)(=O)CBr)CC2)c(Cl)n1	788664931	ODWAXNNSBSPKIL-UHFFFAOYSA-N	432.749	1.032	50	20	IDGD	
Nc1nc(Cl)cc(NNC(=O)Nc2ccc3c(ccn3CC(=O)N3CCOCC3)c2)n1	789080871	WRHFWQMPXSFFNZ-UHFFFAOYSA-N	444.883	1.674	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3nc(C)c(C)s3)n[nH]2)cc1OC	789738315	DGSQYRUDIMHUDM-UHFFFAOYSA-N	444.473	1.567	50	20	IDGD	
CC1(C)Oc2ccc(NC(=O)C(=O)NNC(=O)[C@H]3OCC[C@H]3c3ccccc3)cc2O1	789809744	FRLUPBNCVDGMSB-YJBOKZPZSA-N	425.441	1.853	50	20	IDGD	
O=C(NNC(=O)N1CCC[C@@H](N2CCCS2(=O)=O)C1)c1c(Cl)cccc1Cl	789839737	MGZRUQAHXSZPSH-LLVKDONJSA-N	435.333	1.848	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(C(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)cc1	789852241	MFRREMOGQXBYHP-UHFFFAOYSA-N	439.877	1.208	50	20	IDGD	
CO[C@@H]1CCOc2c(NC(=O)C(=O)NNC(=O)COc3ccc(Cl)cc3)cccc21	790952170	PFKXVDBPVMSAIB-MRXNPFEDSA-N	433.848	1.975	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)cccc1NC(=O)N(C)C	792355093	PDYWCFRLVSYYSP-UHFFFAOYSA-N	433.852	1.847	50	20	IDGD	
COc1cccc(-c2noc(SCC(=O)N([C@@H]3CCS(=O)(=O)C3)N(C)C)n2)c1	792849919	MEUQMWFFQKBLKT-CYBMUJFWSA-N	426.520	1.330	50	20	IDGD	
CN(C)N(C(=O)[C@@H]1CCN(c2ccc(Cl)c(Cl)c2)C1=O)[C@@H]1CCS(=O)(=O)C1	792853962	HVUSJVFXJDFYPE-CHWSQXEVSA-N	434.345	1.839	50	20	IDGD	
CSc1cccc(N2C[C@H](C(=O)NNC(=O)C(=O)Nc3ccc(C)cc3)CC2=O)c1	793213667	XPMMWUJCZXBNFO-CQSZACIVSA-N	426.498	1.856	50	20	IDGD	
C[C@@]1(C(=O)NNC(=O)CNC(=O)c2cccs2)CCN(C(=O)OCc2ccccc2)C1	793335263	DAMJGHOLCDJKQA-OAQYLSRUSA-N	444.513	1.674	50	20	IDGD	
Cc1cc([N+](=O)[O-])c(C)c(S(=O)(=O)NNC(=O)CNC(=O)OCc2ccccc2)c1	794599170	WAUHFGGPHDKKPB-UHFFFAOYSA-N	436.446	1.448	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1c(-c2cccnc2)noc1C	794779993	IPVKAGXQIXMDJY-UHFFFAOYSA-N	428.474	1.721	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(F)cc2-c2cnn(C)c2)cc1OC	796991480	FCRRMVNKLYWNKD-UHFFFAOYSA-N	441.419	1.643	50	20	IDGD	
CN1CCN([C@@H](C(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)c2ccccc2)CC1	802063545	JXZLIGNSCPCSQH-LJQANCHMSA-N	445.545	1.232	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)C(=O)Nc1ccc(OC(F)F)cc1F	802566610	XRTCFJHPYVCHPG-UHFFFAOYSA-N	449.345	1.718	50	20	IDGD	
C#Cc1cc(F)c(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)c(F)c1	802569452	NMPFESPNURBDCT-UHFFFAOYSA-N	437.428	1.110	50	20	IDGD	
COCCN(CCOC)C1CCN(C(=O)NNC(=O)Cn2ccc3ccccc32)CC1	805079498	JGFHLIBMHMYZTI-UHFFFAOYSA-N	431.537	1.441	50	20	IDGD	
CCc1nnc(NC(=O)[C@H](C)[C@@H](C)NC(=O)NNC(=O)COCc2ccccc2)s1	805141395	DKIVLWODVUJDCM-CHWSQXEVSA-N	434.522	1.611	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)NCCCN1C(=O)c2ccccc2C1=O	805819523	SZVLQEBQBBTMPI-UHFFFAOYSA-N	430.848	1.979	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(NC(=O)NNC(=O)COc2ccccc2C#N)ccc1F	806541909	JLDDUSTZODZFNY-UHFFFAOYSA-N	435.437	1.179	50	20	IDGD	
COC(=O)c1c(C)csc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccc(C(C)=O)cc1	806975234	REJAUFOGCKZBEB-GFCCVEGCSA-N	447.469	1.599	50	20	IDGD	
C[Si](C)(C)c1ccc(CC(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)cc1	810462832	ZBWBNMIJXOPJFM-UHFFFAOYSA-N	447.633	1.939	50	20	IDGD	
O=C(COC(=O)[C@H](O)c1ccc(Cl)cc1F)NNC(=O)[C@H]1COc2ccccc2O1	811369520	JAKIKEMUCXHYHV-NVXWUHKLSA-N	438.795	1.043	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)NNC(=O)c1ccc(Br)s1	813542547	CHOLRJZPCNLXHN-UHFFFAOYSA-N	437.279	1.756	50	20	IDGD	
CSCC[C@H](NC(=O)CCC(=O)C(C#N)=C1N(C)c2ccccc2N1C)C(=O)N(C)C	813836891	VQQHLOZJZMGAJO-INIZCTEOSA-N	443.573	1.983	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)c3cc(C=O)c[nH]3)c2)cc1	814698284	XWSBHQGCVWQHEO-UHFFFAOYSA-N	442.453	1.711	50	20	IDGD	
CCOc1ccc(NNC(=O)C(=O)Nc2ccc(C)c(C(=O)N3CCOCC3)c2)cc1	815815561	HETKWJPFLBINSL-UHFFFAOYSA-N	426.473	1.948	50	20	IDGD	
O=C(CSc1nnc(N2CCOCC2)n1C1CC1)NNC(=O)c1cccc(Cl)c1	827900106	NDKDHEXVPJRBBW-UHFFFAOYSA-N	436.925	1.656	50	20	IDGD	
C[C@H]1CC(C)(C)C[C@@]2(C1)NC(=O)N(CC(=O)NNC(=O)COc1ccc(F)cc1)C2=O	910813574	VYWGCFVUGPARIK-YEJXKQKISA-N	434.468	1.489	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)CNC(=O)CC23CC4CC(CC(C4)C2)C3)C[C@@H](C)O1	912920139	VWUCACFVJFRCDP-JVRWENHQSA-N	434.581	1.356	50	20	IDGD	
CC(=O)Nc1cccc(NC(=S)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)c1	913143700	ORPBMJPSTZFSMS-UHFFFAOYSA-N	441.922	1.577	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(\C#N)C(=O)O[C@@H](C)C(=O)N2CCC(C(N)=O)CC2)c1C	913150536	WWTBYVVQDDUZID-NHLVTWMQSA-N	444.532	1.875	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CNC(=O)c2ccc([N+](=O)[O-])c(C)c2)ccc1OC(C)C	913154101	AQWNYYJGLQDWAX-UHFFFAOYSA-N	444.444	1.890	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)cc(C#N)n1C	913287151	UZRCQXFTKBFFII-CHHVJCJISA-N	425.832	1.770	50	20	IDGD	
O=C(CCOCC(F)(F)F)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	914456977	JOXAYEZBEDDERU-UHFFFAOYSA-N	437.440	1.591	50	20	IDGD	
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC(=NNC(=O)c2cc(Br)c[nH]2)CC1	914555285	OAEFYOPXEADSDJ-UHFFFAOYSA-N	443.327	1.688	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)c2ccc(F)c(S(=O)(=O)N3CCCC3)c2)cc1	914602712	MIMYVWOKUOUYOU-UHFFFAOYSA-N	435.477	1.759	50	20	IDGD	
CCCOc1ccc(C(=O)NNS(=O)(=O)c2ccc(OCC(=O)O)cc2)cc1OC	915185234	YIPQKFYXFYDWLJ-UHFFFAOYSA-N	438.458	1.571	50	20	IDGD	
CN(C)N(C(=O)[C@H]1CCN(c2ccccc2Br)C1=O)[C@H]1CCS(=O)(=O)C1	916109926	OYGYMHIPWJTJDK-STQMWFEESA-N	444.351	1.294	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1cccnc1N1CCCCC1	916134119	CDADJBVWHWGOND-UHFFFAOYSA-N	430.534	1.748	50	20	IDGD	
COc1cc(C=NNC(=O)c2cccc([N+](=O)[O-])c2)ccc1OCC(=O)N1CCOCC1	916247519	ZPRQDZOOCLSBIA-UHFFFAOYSA-N	442.428	1.605	50	20	IDGD	
Cc1cc(C)n(-c2ccc(CNC(=O)NNC(=O)Cc3nc4ccccc4n3C)cn2)n1	916419831	UPHBCZJGPPWLKJ-UHFFFAOYSA-N	432.488	1.844	50	20	IDGD	
CSCC[C@H](NC(=O)c1cccc(C)c1)C(=O)NNC(=O)C(=O)Nc1ccc(C)cc1	916830475	BATBTRPUDIFYBI-SFHVURJKSA-N	442.541	1.941	50	20	IDGD	
O=C(NNC(=O)C1CCN(C(=O)CCOc2ccccc2)CC1)c1ccc2c(c1)OCO2	917388407	CGYBTGADCNNRQD-UHFFFAOYSA-N	439.468	1.884	50	20	IDGD	
CC(C)N1C(=O)c2ccc(C(=O)NNC(=O)COc3ccc(F)cc3)cc2S1(=O)=O	919689608	YUAJJTMPXPHDIA-UHFFFAOYSA-N	435.433	1.219	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@@H](C)Cn2cccn2)c1	919778470	CITMXRHOSFDRBF-OAHLLOKOSA-N	436.538	1.194	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@H]2CCN(c3ccc(F)cc3)C2)c1	920046511	LVTOSLANVGZDTK-CQSZACIVSA-N	434.493	1.700	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)c2nc(S(C)(=O)=O)n3ccccc23)c1C	920274587	SWGLDVXDTMVGNX-AWEZNQCLSA-N	430.486	1.583	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)[C@H]1CCCN1C(=O)Cc1ccccc1	920288820	ZBAGMNHFCHPXGI-HXUWFJFHSA-N	433.512	1.980	50	20	IDGD	
COC(=O)/C=C\c1cc(OC)c(OC)c(S(=O)(=O)NNC(=O)c2ccccc2O)c1	921018100	XPGJOMXTCMWORV-HJWRWDBZSA-N	436.442	1.219	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)[C@H]2CC(=O)N(c3ccccc3)C2)CC1	1116084017	NESKMIBEDGNGNY-INIZCTEOSA-N	430.505	1.834	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNS(=O)(=O)c2cccc3c2COC3=O)CC1	1318667462	FZZNLXNTBDPWMA-UHFFFAOYSA-N	439.490	1.314	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)Cn2cc(C(F)(F)F)ccc2=O)cc1C	1318982693	IENNTNPANNQWSD-UHFFFAOYSA-N	445.419	1.804	50	20	IDGD	
O=C(NNC(=O)[C@H]1CN(Cc2nc(O)c3ccccc3n2)CCO1)c1ccccc1Cl	1322076208	ISGMHWGBBUXAPT-QGZVFWFLSA-N	441.875	1.651	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)Cn2nc3n(c2=O)CCCCC3)c1	1324616134	JFZCYRUJPXOVOD-UHFFFAOYSA-N	438.282	1.464	50	20	IDGD	
O=C(CSc1ccc(Cl)cc1)NNC(=O)[C@@H]1Nc2ccccc2S(=O)(=O)N1	1339965007	MSOLIRVMIMQQMT-OAHLLOKOSA-N	426.907	1.310	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4c(c3)CCCC4=O)C2)C1	1777927323	GHAKLYASFXXVCG-GCJKJVERSA-N	434.920	1.903	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)[C@@H]2SC(=N)NC2=O)C1	1778085140	RHGNYYYDRWTAJM-ROOHJGOOSA-N	444.985	1.320	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(C(=O)N2CC[C@@]3(CN(C(=O)C(Cl)Cl)CCO3)C2)C1	1778127425	ZHUQDBHFLCZGFO-SFHVURJKSA-N	436.336	1.487	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)c3csc4c3CCCC4)C2)C1	1778486931	VOWIUPPWJXPCJN-JOCHJYFZSA-N	448.589	1.443	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(Cl)nn3)C2)C1	1779432793	PMQNWKZYBUZINQ-ZBEGNZNMSA-N	431.718	1.747	50	20	IDGD	
CC(C)(C)n1cc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)nn1	1780354216	FELHCDWECHCRIO-QZTJIDSGSA-N	432.352	1.713	50	20	IDGD	
CC(C)=CCCC(=O)N1CC[C@@]2(C1)CN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)CCO2	1781121216	VVGAAEZFRVELPO-PCCDRTMGSA-N	429.521	1.697	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)c3cn4cccnc4n3)CCO2)C1	1781230701	YBHTZMVTWVSMPT-MSOLQXFVSA-N	426.304	1.409	50	20	IDGD	
O=C(c1ccn2ccnc2c1)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781332513	ZYZIWXGLBMDVRJ-RHSMWYFYSA-N	425.258	1.468	50	20	IDGD	
O=C1CCc2ccc(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)[C@@H](O)CCl)C4)cc2N1	1781408781	FCUFBVUQVOOZSY-NJNPRVFISA-N	449.935	1.299	50	20	IDGD	
Cc1noc(N)c1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)Br)C1	1781998410	SWAMVADGSNDXGB-GSDQYQHOSA-N	429.315	1.476	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1[nH]nc3ccncc13)C2)C(Cl)Cl	1782215246	MVBQVANYEBJTSI-FZKQIMNGSA-N	426.304	1.889	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4c(c3)NC(=O)CC4)C2)C1	1782515073	QOOJALLAOUEURY-IIBYNOLFSA-N	435.908	1.269	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@@]2(C1)CN(C(=O)c1ncc[nH]1)CCO2	1782863540	FZSJUZQZZPYHTH-ZVYZCIRASA-N	427.411	1.739	50	20	IDGD	
CC(C)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3c(O)cc(O)cc3O)C[C@@H]21	1783853729	YAYCHPMNCBRVTL-RBOXIYTFSA-N	426.897	1.662	50	20	IDGD	
CCc1nn(C)c(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](Cl)COC)C3)C2)c1Cl	1783873661	RYNYTVUGDHWHCH-KPZWWZAWSA-N	433.336	1.333	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)/C=C/c3ccc(OC)cc3F)CCO2)C1	1783879353	QOHRSOCJPPVCNP-VYHZTRRPSA-N	440.899	1.931	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(NC(C)=O)c(O)c3)CCO2)C1	1783881844	NDODQQQAXMDYGF-YWZLYKJASA-N	439.896	1.048	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CC[C@@H]3CNc4ccccc4C3)C[C@@H]21)[C@H](O)CCl	1784090236	VFAZPHIOPHESIP-PAMRQWRISA-N	449.979	1.630	50	20	IDGD	
Cn1ncc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)C(Cl)Cl)C[C@@H]32)c1C(F)(F)F	1785527711	YFKJJFZSXRTEBG-LSJOCFKGSA-N	443.253	1.836	50	20	IDGD	
CCCCC[C@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2C1	1786984940	BWKVNDYFDLHVHU-GIUOSPMZSA-N	430.354	1.176	50	20	IDGD	
COC[C@H](Cl)C(=O)NC1(c2ccc(NC(=O)c3cc(=O)n4[nH]cnc4n3)cc2)CCC1	1788139536	PZLRPMWCVCEJKU-AWEZNQCLSA-N	444.879	1.419	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)c3ccc(F)cn3)CCC2)cc1)c1ccc(B(O)O)cc1	1788140336	SSTOSDBYXVCZSA-UHFFFAOYSA-N	433.248	1.962	50	20	IDGD	
O=C(COc1cc(Cl)ccn1)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21	1788730180	WKXWJSOMBWCDTK-DRZSPHRISA-N	436.723	1.897	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3c(O)cc(O)cc3O)[C@H]2C1	1790155531	XBQUPUWTTFUMKB-MJFSBKNWSA-N	426.897	1.804	50	20	IDGD	
CC(=O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](Br)Cc3ccccc3)[C@H]2C1	1790780800	SWZKXWWABKLREL-FJIDUMEYSA-N	437.334	1.561	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ncc(Cl)cn3)C[C@@H]21	1791057914	ZNZZDQOQWBANLP-URBCHYCLSA-N	431.718	1.507	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/C(=O)c3cccs3)C[C@@H]21	1791254980	YUEMRYJZMGCHQE-LDFDMIBHSA-N	440.949	1.721	50	20	IDGD	
CCCNC(=O)CCC(=O)NC1(c2ccc(NC(=O)CCC(=O)NN(C)C)cc2)CCC1	1791599896	ORTWPNJSXOJLBX-UHFFFAOYSA-N	445.564	1.800	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(C3CC3)on1)C2	1792867164	ZHDPXDPBJMGWQR-YGSHXTJESA-N	426.311	1.786	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nccc(OC)c1OC)C2	1793448696	IIQSIOLYQHBMIR-HLPPOEQASA-N	425.913	1.710	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cocn1)C2	1793881198	UVRFLRXXEFANTK-XFMPKHEZSA-N	442.900	1.010	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)[C@H]1[C@@H]2CCC[C@H]1c1ccccc1N2	1795498832	IGWMXUWYMAKDTF-OAXNIYSNSA-N	447.963	1.554	50	20	IDGD	
CN[C@H](CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C(C#N)=C/c1ccc(F)cc1F)C2)C(=O)O	1796095454	PKOXAKIOYKKDDM-RWOGOPBDSA-N	446.454	1.573	50	20	IDGD	
CCOc1c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](Cl)COC)C3)cnc2c1cnn2C	1796538634	RCNWLEQCWGBRNE-LOUJCGABSA-N	449.939	1.873	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(Br)ncc1F)[C@@H](O)CCl	1797092633	KGAYCBFXOGSAPO-WJZNIJOASA-N	434.693	1.835	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1ccc(F)nc1)C2)[C@H](F)Br	1799344137	AKIQYSNHXTYLKN-VZAMPYOESA-N	432.265	1.433	50	20	IDGD	
Cn1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Br)c(C(F)F)n1	1799347195	IHHGWKZUOVVMOC-NUODRBITSA-N	439.232	1.251	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(S(C)(=O)=O)cn1)C2	1800077715	HKHSFVUXODEOCD-SJBDTSRBSA-N	448.372	1.973	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3ccccn3n1)C2	1800640585	ABDZUKMHYGBWOU-YXPYIKCWSA-N	435.322	1.711	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CCc2ccccc2O1	1800950009	YWIAVYPKAVTGAC-SHJAMOMRSA-N	432.593	1.821	50	20	IDGD	
COc1ccc(/C=C(\C)C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)cc1	1801377589	OLSLOZOPPAVZLQ-RFYQUTDWSA-N	448.328	1.730	50	20	IDGD	
O=C(Cn1cncn1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](Br)Cc1ccccc1	1801568174	UAZZLZRGTONPNL-XMTFNYHQSA-N	446.349	1.923	50	20	IDGD	
CC(=O)N(C)CCC(=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@@H]1c1cccnc1	1804073522	QJPQVBXMNVZRJX-USXIJHARSA-N	443.317	1.646	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC2(CCCN(C(=O)[C@H]3CCC(=O)NC3)C2)CC1	1804981865	KHLDRVZDLKMSNE-LSDHHAIUSA-N	428.371	1.917	50	20	IDGD	
O=C(c1[nH]cnc1-c1cccnc1)N1CCC2(CCCN(C(=O)[C@@H](O)CCl)C2)CC1	1805523279	RWIKQPBIRDWLEL-INIZCTEOSA-N	431.924	1.916	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC2(CCCN(C(=O)CN3CCOC3=O)C2)CC1	1805768572	UFYKDUMOQUXBBN-CQSZACIVSA-N	430.343	1.843	50	20	IDGD	
N=C(N)SCCC(=O)NC[C@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1	1807122238	OBOYSYCLZUWXJM-CJNGLKHVSA-N	442.383	1.889	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H]2C[C@@]2(F)Cl)[C@H]1c1cccnc1)c1cccc(B(O)O)c1	1807373299	AWCIFHTWZYCOAB-DBSRCYSRSA-N	445.687	1.006	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CN2CCCC2=O)[C@H]1c1cccnc1)[C@H](F)Br	1808661979	UDEHRBRTCCWYLD-JQFCIGGWSA-N	441.301	1.400	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)c1ccc2c(c1)OCCO2	1808989437	NXKKIVSKNAETEN-QKLQHJQFSA-N	445.903	1.772	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)CN2CCN(C(C)=O)CC2)[C@H]1c1cccnc1	1809670475	KRMUPHBMQYXPSB-SVFBPWRDSA-N	449.983	1.269	50	20	IDGD	
CCc1ccc(C(=O)N2CCC3(CCCN(C(=O)c4ccc(B(O)O)cc4)C3)CC2)cn1	1809968376	WVGNQRHECNRFTQ-UHFFFAOYSA-N	435.333	1.482	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1)c1cc(CO)on1	1811589580	JYXFCRPXAVLSLC-SUMWQHHRSA-N	437.294	1.667	50	20	IDGD	
CCOc1ccc(C(=O)NC[C@@H]2CCN(C(=O)[C@H](Cl)COC)[C@@H]2c2cccnc2)nn1	1811625638	ACFAFOUNNOFDQI-FRQCXROJSA-N	447.923	1.844	50	20	IDGD	
C#CCCCC(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1	1813049283	RWXOAYQORJHEMM-UWJYYQICSA-N	434.500	1.203	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)C(=O)c2cccn2C)[C@@H]1c1cccnc1	1813478289	GXSDSMQPLMHUHX-BQFCYCMXSA-N	432.908	1.563	50	20	IDGD	
CCC[C@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](COC)NC(C)=O)[nH]n1	1815321271	RPNJKHSKUWDUQE-NUEKZKHPSA-N	427.933	1.960	50	20	IDGD	
C=CC[C@@H](C(=C)C)C(=O)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1	1815356534	IWXIZZJPCIOZPG-IRXDYDNUSA-N	439.346	1.817	50	20	IDGD	
Cc1ncccc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1816392122	VDBXHTLGWMDMKA-LJQANCHMSA-N	433.277	1.413	50	20	IDGD	
CC(C)CNC(=O)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](C)Br)[nH]n1	1818135844	NXMUKLWPLRSOOJ-AAEUAGOBSA-N	428.331	1.957	50	20	IDGD	
CC(C)CNC(=O)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](C)Br)[nH]n1	1818135846	NXMUKLWPLRSOOJ-DGCLKSJQSA-N	428.331	1.957	50	20	IDGD	
CNC(=S)NCCC(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](Cl)COC)[nH]n1	1819408543	AHUSFEAOCKPPDC-WCQYABFASA-N	430.962	1.140	50	20	IDGD	
O=C(COC(=O)C(F)(F)F)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)CC1	1824186583	OYSVDHLSMROMDA-STQMWFEESA-N	428.835	1.311	50	20	IDGD	
COc1cccc(C(=O)N[C@@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)n1	1826080586	SXWCPDRONOEKNL-GFCCVEGCSA-N	446.533	1.146	50	20	IDGD	
Cc1nc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)cs1	1827050776	GBOXEVMLZBGEJI-FQEVSTJZSA-N	441.362	1.678	50	20	IDGD	
C=CCO[C@@H](C)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827056077	RVHHASIFDVOLFZ-LAUBAEHRSA-N	428.338	1.191	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CN(C)C)CC1	1827681219	PZMHSWQYEUNWQZ-JWGRYVKWSA-N	430.553	1.302	50	20	IDGD	
O=C(CCBr)N1CCC([C@@H]2CCCCN2C(=O)[C@H](O)N2CCOCC2)CC1	1828967091	UEAAAELXOZVNFM-WMZOPIPTSA-N	446.386	1.042	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc([N+](=O)[O-])o3)CCO2)C1	1829479045	CHMYDLKNXKUBHV-SFHVURJKSA-N	429.857	1.523	50	20	IDGD	
C[C@H]1CCc2c(C(=O)N3CCOC[C@]4(C3)CN(C(=O)C(C)(C)CCl)CCO4)n[nH]c21	1830362125	MBHADIIBAPYSBG-QKKBWIMNSA-N	438.956	1.794	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C=N/O[C@@H]3CCCCO3)C2)C1	1830365386	XFRHZFSNXVDICY-HNNRIZOBSA-N	445.944	1.237	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)COC3CCCCC3)CCO2)C1	1830383781	JLROMGWUHLICNW-FXAWDEMLSA-N	432.945	1.046	50	20	IDGD	
C=CCSCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2	1830535891	VXXOJRKBYVYGKN-WMLDXEAASA-N	435.384	1.393	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccsc3)C2)C1	1830538903	UTIYYIJECGNVRQ-KBXCAEBGSA-N	445.379	1.778	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4ncnn4c3)C2)C1	1831650361	GVTMSVSPGVBZQD-JXFKEZNVSA-N	435.912	1.207	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3Cc4ccccc4N3)C2)C1	1831657913	RODZYNDLMINNAC-JLMWRMLUSA-N	435.952	1.887	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1	1831871435	QHLSZFRJPKWAQT-KRWDZBQOSA-N	447.536	1.099	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(CO)o2)CC1	1831873400	IUVPBTSEDYCXLI-SFHVURJKSA-N	434.537	1.378	50	20	IDGD	
Cc1ccc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)c(O)n1	1831873715	UNQPZNDBAGNNJI-IBGZPJMESA-N	445.564	1.702	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3c(C)noc3C)CC2)CC1	1834156883	QQVJFBAXTRSZKJ-KRWDZBQOSA-N	426.945	1.730	50	20	IDGD	
Cc1noc(C)c1C(=O)N1CCOC[C@]2(CN(C(=O)CCBr)CCO2)C1	1834819439	RBTIFCPSTNRBTO-KRWDZBQOSA-N	430.299	1.146	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(F)c(C)c3N)CCO2)C1	1835873168	NQKFCESQGBCRJZ-YWZLYKJASA-N	427.904	1.804	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3n[nH]cc3[N+](=O)[O-])CC2)CC1	1838442941	HWFNWZUVQZCWIT-CQSZACIVSA-N	427.889	1.948	50	20	IDGD	
O=C(c1ccccc1F)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1838856225	VQYAJATXWRHLSR-PBHICJAKSA-N	433.249	1.586	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc(N)s3)C2)C1	1839152137	OWDDZCKPXPLFEM-HOTGVXAUSA-N	437.349	1.032	50	20	IDGD	
N#Cc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)cc1	1839202200	XOQOSPBJMVAUJQ-QAPCUYQASA-N	440.269	1.319	50	20	IDGD	
C[C@H](Cc1ccc(F)cc1)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1839764621	HSDCUKZONLXFBH-WIBUTAKZSA-N	430.879	1.995	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)C3CCC(O)CC3)CCO2)C1	1840275386	BDXBIRGPOUWOMT-IADFQQGMSA-N	447.370	1.167	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CCCS1)CCO2	1840574067	FKYGHFSWFOXTEJ-KEYYUXOJSA-N	435.384	1.369	50	20	IDGD	
C=CCO[C@H](C)C(=O)N1CCCC12CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2	1841610593	QSNUURHUNOGRGU-GOSISDBHSA-N	443.548	1.127	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H]1C(=O)N1CCCC12CN(C(=O)CCBr)C2	1841763710	RVVBZRMLKOGYDR-ZDUSSCGKSA-N	430.343	1.984	50	20	IDGD	
O=C(CCc1c[nH]c2ccc(F)cc12)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843012474	RPGOIOQECTZETJ-UHFFFAOYSA-N	449.291	1.437	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)CS[C@@H]1CCCCO1)C2	1843416166	HSBWXEACZDKEFV-MMTNMYCKSA-N	447.561	1.584	50	20	IDGD	
CCNC(=O)N[C@@H](C)C(=O)N1CCCC12CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)C2	1844231539	XGDZRNGKBQSIJC-FSEGOYHTSA-N	445.470	1.783	50	20	IDGD	
C[Si](C)(C)C#CCCCC(=O)N1CCCC12CN(C(=O)c1ccc(B(O)O)cc1)C2	1844252510	AVVORNYHKSKGIX-UHFFFAOYSA-N	426.398	1.235	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1cccc3ncsc13)C2	1844264492	YJOFLDLABHSITC-UHFFFAOYSA-N	436.497	1.426	50	20	IDGD	
Cc1ccc(=O)n(C(C)(C)C(=O)N2CCCC23CN(C(=O)[C@@H](C)CBr)C3)n1	1844353163	PFCLEJQMWZZQHD-ZDUSSCGKSA-N	439.354	1.521	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)CN1CCCCC1)C2	1844692260	BQLJAXGRBKUBDK-UHFFFAOYSA-N	444.488	1.823	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)c1ccncc1O)C2	1844692738	FSPQEZGDILLMGP-UHFFFAOYSA-N	440.412	1.752	50	20	IDGD	
O=C([C@@H](O)CCl)N1CC2(CCCN2C(=O)[C@@H](O)c2cccc(Br)c2)C1	1845039759	NOSBVDGDGIQNGG-KBPBESRZSA-N	431.714	1.286	50	20	IDGD	
Cc1nccnc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1848099168	DOXIUZUBCSHFIJ-KKUMJFAQSA-N	437.928	1.733	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc(CO)on1	1848099452	LFRBIBYQZFIKCI-KKUMJFAQSA-N	442.900	1.114	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCc1nc2ccccc2n1C	9755768	YTTPZWLUJCDIOZ-UHFFFAOYSA-N	429.506	1.319	50	20	IDGD	
C#CCNS(=O)(=O)c1cccc(C(=O)NNC(=O)CCSc2ccc(F)cc2)c1	12683856	RKOGDXRBVDLDDL-UHFFFAOYSA-N	435.502	1.681	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)CN1C(=O)N[C@@](C)(c2ccc(F)cc2)C1=O	23754158	GAQRYCCBHPRTRF-FQEVSTJZSA-N	448.838	1.716	50	20	IDGD	
O=C(CCn1cncn1)NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2Cl)c1	25527387	GGUIQKMBUCQJSI-UHFFFAOYSA-N	448.892	1.584	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)CNS(=O)(=O)c1ccc(Cl)s1	116461604	ZWMCXOVATMDHHD-VIFPVBQESA-N	435.886	1.434	50	20	IDGD	
CCCn1c(C)cc(/C=C(\C#N)C(=O)N2CCN(C(=O)CN3CCOCC3)CC2)c1C	214340938	GGADKBJMCIQSPC-RCCKNPSSSA-N	427.549	1.425	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NCc1ccccc1CN1CCCC1=O	725873815	QUUQUVICTBGKRK-UHFFFAOYSA-N	429.502	1.131	50	20	IDGD	
NS(=O)(=O)c1ccc(CNC(=S)NNC(=O)COc2ccc3ccccc3c2)cc1	726450412	PGOOFVAGPPKYAT-UHFFFAOYSA-N	444.538	1.562	50	20	IDGD	
CCn1c(O)nc2cc(C(=O)NNc3ccc(S(=O)(=O)C(F)F)cc3)ccc2c1=O	728972195	GOXFOIUSNWBQDJ-UHFFFAOYSA-N	438.412	1.875	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)NCCN1CCN(Cc2ccccc2)CC1	729496952	GXEQNHCDUMMFSR-UHFFFAOYSA-N	434.544	1.790	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)[C@H](CCSC)NC(=O)c2ccccc2)cn1	729692542	KHEPRDXERKMBNU-HNNXBMFYSA-N	433.559	1.960	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2ccc(NNC(=O)[C@H]3CCC(=O)N3)c([N+](=O)[O-])c2)cc1	729836108	MZVUKKGXCZXVRB-OAHLLOKOSA-N	449.445	1.126	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNS(=O)(=O)c2ccc(F)c(C)c2)cc1	729837484	SUNPSLAFFDIDGA-UHFFFAOYSA-N	429.495	1.073	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2nnc(O)c3ccccc23)nnn1-c1cccc2cccnc12	731453932	VWJVEGWOZHNMMK-UHFFFAOYSA-N	440.423	1.848	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NCCCC(=O)N1CCc2ccccc21	732244899	MENIZZIMAVTAQK-UHFFFAOYSA-N	429.502	1.178	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)COc2ccccc2OCC(F)(F)F)C[C@@H](C)O1	732262571	UOBMRTBJOPCFDQ-ZIAGYGMSSA-N	433.427	1.653	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)NC[C@]2(C)CCOC2)cc1	733181118	QWRUJUZLCIRDIB-HZUJZGFBSA-N	437.500	1.884	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)NNC(=O)c1ccc(Br)s1	733338571	DIGHAMLJNWMYNY-UHFFFAOYSA-N	449.290	1.985	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)[C@@]2(O)CCN(Cc3ccccc3)C2)cc1OC	735836903	NPULAXSPBQUQEY-HSZRJFAPSA-N	427.501	1.882	50	20	IDGD	
CCc1ccccc1O[C@@H](C)C(=O)N1CCN(CC(=O)NNC(=O)c2cccs2)CC1	736623054	HOWDLVHSJRSQEQ-INIZCTEOSA-N	444.557	1.683	50	20	IDGD	
Cc1ccc(Nc2cccc(C(=O)OCC(=O)NNC(=O)Cc3nc(C)cs3)c2)nn1	736877212	QMTFZGWCVBXNGR-UHFFFAOYSA-N	440.485	1.840	50	20	IDGD	
CN(C)CCOc1ccccc1N1CCN(C(=O)NNC(=O)Cc2cccnc2)CC1	738474254	ATNJDEHOZGEOCB-UHFFFAOYSA-N	426.521	1.128	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)CCNC(=O)c1ccc(Br)cc1	740851441	FHJCJRYWJMUXPK-UHFFFAOYSA-N	427.299	1.021	50	20	IDGD	
CC(C)CNC(=O)N1CCC[C@@H](CC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)C1	741178776	OORSQOZZAPYCTG-HNNXBMFYSA-N	438.550	1.319	50	20	IDGD	
O=C1C[C@H](Cc2ccc(C(=O)NNC(=O)c3cc(F)ccc3Br)cc2)C(=O)N1	743336414	GLTHDATZMLVUSM-LBPRGKRZSA-N	448.248	1.868	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)N[C@@H]1CC(=O)N(CCOc2ccccc2)C1	743509570	HACGBVZJFCFNBY-OAHLLOKOSA-N	430.436	1.215	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)NCCCN2C(=O)CCC2=O)cc1Cl	743596810	AKPMZZAUJZKMJC-UHFFFAOYSA-N	427.845	1.232	50	20	IDGD	
Cc1nc([N+](=O)[O-])cn1CC(=O)NNC(=O)[C@@H](C)Oc1cccc(Br)c1	743742133	NRLLAKXCXYUXTK-SECBINFHSA-N	426.227	1.477	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2c[nH]c3ccccc23)sc1Br	744463114	BLODHARZONDBGY-UHFFFAOYSA-N	443.304	1.714	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2cccc(Cl)c2)sc1Br	744463605	MCGFKJSXVVACJE-UHFFFAOYSA-N	438.712	1.886	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)[C@@]23CCC(=O)N2c2ccccc2S3)c1	744618742	VMZLIQHDVKJHBV-NRFANRHFSA-N	425.466	1.928	50	20	IDGD	
O=C(COC(=O)c1ccc(OC2CCC2)cc1)NNC(=O)[C@@H]1COc2ccccc2O1	745672831	RKFSZDHEQPPZCP-IBGZPJMESA-N	426.425	1.762	50	20	IDGD	
NC(=O)[C@@H]1CCCN(CCCNC(=O)NNC(=O)c2cc3c(s2)CCCCCC3)C1	745833628	ZDNICFJSSMDPDA-MRXNPFEDSA-N	435.594	1.939	50	20	IDGD	
CCOC(=O)C1(C(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)CC1	746093583	SSXWPPNYYONCPM-UHFFFAOYSA-N	445.497	1.269	50	20	IDGD	
NC(=O)CC[C@H](C(=O)NNC(=O)c1ccc2ccccc2c1)N1C(=O)c2ccccc2C1=O	746132007	IBTRCOIJRJDWSS-LJQANCHMSA-N	444.447	1.531	50	20	IDGD	
O=C(CNC(=O)c1ccc(Br)s1)NNC(=O)Cc1cn2ccccc2n1	746702262	SCCWLGIUEDQMLV-UHFFFAOYSA-N	436.291	1.278	50	20	IDGD	
O=C(CN1C(=O)Cn2c(cc3ccccc32)C1=O)NNC(=O)c1cccc2cccnc12	747423994	BQHDJKMLGTWCHA-UHFFFAOYSA-N	427.420	1.633	50	20	IDGD	
O=C(CN1C(=O)N[C@@]2(CCc3ccccc32)C1=O)NNC(=O)c1cccc2cccnc12	747426704	ULNXXTRVCSHKDW-HSZRJFAPSA-N	429.436	1.389	50	20	IDGD	
COc1ccc(Cl)cc1NC(=O)CCNC(=O)NNC(=O)COc1ccccc1C#N	747592050	VSWGGOGJIJYGBZ-UHFFFAOYSA-N	445.863	1.958	50	20	IDGD	
COc1ccccc1[C@@H](CNC(=O)NNC(=O)C(=O)N1CCCC1)NC(=O)OC(C)(C)C	748462012	SGCUFWAAVJQQOD-OAHLLOKOSA-N	449.508	1.214	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CCc2ccccc2)cc1S(=O)(=O)N1CCOCC1	749802673	ORTHOUQSIAMBJX-UHFFFAOYSA-N	447.513	1.110	50	20	IDGD	
COCCCOc1ccc(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)cc1	750072258	DOHJZGPRBGPHNI-UHFFFAOYSA-N	449.529	1.880	50	20	IDGD	
CC1CCC2(CC1)NC(=O)N(NC(=O)COC(=O)/C(C#N)=C\c1ccc(O)cc1)C2=O	750660115	AGGVHTDNSZJLQM-GDNBJRDFSA-N	426.429	1.374	50	20	IDGD	
CS(=O)(=O)N1CCc2cc(C(=O)NNC(=O)c3cc4ccccc4cc3O)ccc21	751025821	RIPVNQNPUKAHHY-UHFFFAOYSA-N	425.466	1.942	50	20	IDGD	
CCC(=O)NCc1cc(S(=O)(=O)NNC(=O)c2cccc(Cl)c2)ccc1OC	751539406	XPMASLMTEGTNLS-UHFFFAOYSA-N	425.894	1.998	50	20	IDGD	
Cc1oc(C(=O)NNC(=O)c2cc(Br)ccc2O)cc1S(=O)(=O)N(C)C	754016277	HIENOFSSVPTVPL-UHFFFAOYSA-N	446.279	1.381	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Cc2cc[nH]n2)cc1S(=O)(=O)N[C@H]1CCCC[C@H]1C	755268794	IAWPTSLNXUMLEY-CJNGLKHVSA-N	449.533	1.279	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)Nc1ccc(S(=O)(=O)NC2=NCCCCC2)cc1	755500781	PTYIGFWHVBPARJ-UHFFFAOYSA-N	444.517	1.728	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2cccc(C(=O)NC3CC3)c2)c1	755557931	KWQQLABWURLYLS-UHFFFAOYSA-N	445.501	1.296	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1ncc(Cc2ccccc2)s1	756155070	LQHMBYFBPJRMMS-UHFFFAOYSA-N	426.454	1.604	50	20	IDGD	
Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O	756212853	RTWPKWDDAQREQE-CYBMUJFWSA-N	431.474	1.749	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)Nc1cc(Br)ccc1-n1cccn1	756489648	QLSCSKIRSHSBSM-SNVBAGLBSA-N	442.295	1.222	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CN2CCCC[C@@H]2CNC(=O)Nc2ccccc2)c1	756580192	NVCBVWRONYQEJX-HXUWFJFHSA-N	434.500	1.995	50	20	IDGD	
CS(=O)(=O)CCOc1ccc(Cl)cc1NC(=O)NNC(=O)c1ccccc1O	756813543	PRPWXRIEDHFDOY-UHFFFAOYSA-N	427.866	1.936	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)Nc2ccccc2OCC(=O)N2CCOCC2)c1O	756873128	HRLOZEWCDHFSOF-UHFFFAOYSA-N	444.444	1.105	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)N[C@@H]1CCN(C(=O)CCc2ccccc2)C1	756981827	BTIPNNHMPKDBJJ-YLJYHZDGSA-N	438.484	1.391	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1ccnc(OCC(F)F)c1	759228615	FWPKZCZVDCBANC-UHFFFAOYSA-N	442.444	1.503	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCC3(CC2)OCc2ccccc23)cc1OC	759786944	MEUNYFLWNMDJAV-UHFFFAOYSA-N	425.485	1.986	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)c1cncc(I)c1	760443152	QCIFRNVKHFKVFK-UHFFFAOYSA-N	434.234	1.362	50	20	IDGD	
CCC(=O)NNC(=O)C(=O)Nc1cc(S(=O)(=O)N(CC)CC)ccc1OC(C)C	763438944	XZKNIUUMIPHJRK-UHFFFAOYSA-N	428.511	1.000	50	20	IDGD	
O=C(NNC(=O)c1ccccn1)C(=O)Nc1ccc(NC(=O)C2CC2)cc1C(F)(F)F	763465105	SAMGQDJVQNIHNL-UHFFFAOYSA-N	435.362	1.849	50	20	IDGD	
COCCn1ncc2ccc(NC(=O)C(=O)NNC(=O)c3ccc(OC)c(OC)c3)cc21	763550395	LROCIYAKMGCINT-UHFFFAOYSA-N	441.444	1.100	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)Nc1ccc(OC[C@@H]2CCCO2)cc1	763569829	CHPJNQFIRUBICG-QFBILLFUSA-N	441.440	1.170	50	20	IDGD	
Cc1cc(C(=O)NC(C)C)ccc1NC(=O)C(=O)NNC(=O)c1c(C)nc2ccccn12	763623797	HPVFWJPUHRAHNI-UHFFFAOYSA-N	436.472	1.489	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C)c(C)c2)cc1F	763667201	SBTVNDMURGYGFR-UHFFFAOYSA-N	433.436	1.633	50	20	IDGD	
CCn1cnnc1-c1cccc(NC(=O)C(=O)NNC(=O)COc2ccccc2F)c1	763680513	JLSXVHCLMWSYPM-UHFFFAOYSA-N	426.408	1.269	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccccc1S(=O)(=O)C(C)C	763713674	NXHUBIMAFZFEKZ-UHFFFAOYSA-N	447.513	1.596	50	20	IDGD	
CCCc1cc(NC(=O)C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)n(C)n1	763789778	BSEMGGZDBJRXJW-UHFFFAOYSA-N	439.476	1.063	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)C(=O)Nc1ccc(F)cc1OC(F)F	763803229	JWUDGIFWBJGDHW-UHFFFAOYSA-N	442.306	1.500	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3ccc4c(c3)C(=O)N(C)C4=O)cc2C1	763940753	IJEIZYVBFNGBNQ-SNVBAGLBSA-N	440.481	1.498	50	20	IDGD	
CC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(F)cc2Br)c1	764084810	IEDFLZANTKOATR-UHFFFAOYSA-N	437.225	1.946	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(CN3C(=O)CCCC3=O)cc2)c(O)c1	764109228	IPLYIYKYSYPDEO-UHFFFAOYSA-N	438.440	1.139	50	20	IDGD	
CCOc1cc(C(=O)N(C)C)ccc1NC(=O)C(=O)NNC(=O)c1ccc(Cl)cc1O	764118041	YBKLCDYGVBMIJQ-UHFFFAOYSA-N	448.863	1.546	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1cc(F)ccc1OC[C@H]1CCCO1	764135204	CBSZTYFWWMMKRJ-MRXNPFEDSA-N	445.447	1.721	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1cc2sc(C)nc2cc1OC	764136051	MQYPPNQPSHXABI-UHFFFAOYSA-N	428.470	1.951	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(C)n([C@H](C)C3CC3)n2)o1	764139538	XJUDNLBWUCMBML-CQSZACIVSA-N	430.509	1.997	50	20	IDGD	
C[S@](=O)Cc1cc(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)ccc1Cl	764163479	JKSNRDIGLCOJSX-OFJJUDJNSA-N	435.889	1.308	50	20	IDGD	
CC(C)n1nnnc1-c1ccc(NC(=O)C(=O)NNC(=O)CCc2ccco2)cc1F	764170858	ZBKHHQSZWMRXOB-UHFFFAOYSA-N	429.412	1.372	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)C(=O)Nc1cccc(-n2ccnc2)c1	764204503	PCVAXMJYOGXRPT-UHFFFAOYSA-N	430.465	1.263	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)C(=O)Nc2ccc(C#N)cc2F)c1	764230609	CISJFUNKBQZGHH-UHFFFAOYSA-N	435.209	1.868	50	20	IDGD	
CN1CCC(N(C)c2ccc(NC(=O)C(=O)NNC(=O)c3cccc(C#N)c3)cc2)CC1	764241565	ANFIIWOXELLXPO-UHFFFAOYSA-N	434.500	1.488	50	20	IDGD	
COC(=O)c1cc2cc(NC(=O)C(=O)NNC(=O)CCc3ccccc3O)ccc2o1	764278417	PDKZRHLTTQIXEP-UHFFFAOYSA-N	425.397	1.644	50	20	IDGD	
NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)cc1Cl	764387834	MMLSXUZXRNZYBO-UHFFFAOYSA-N	444.810	1.368	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)C(=O)Nc1ccc(N2CCSCC2)c(Cl)c1	764389281	QYWNQGVJQFZIKP-UHFFFAOYSA-N	433.921	1.996	50	20	IDGD	
Cc1cc(OCc2cccc(Cl)c2)ccc1NC(=O)C(=O)NNC(=O)[C@@H]1COCCO1	764425424	POAKDKXYCJOKAE-SFHVURJKSA-N	447.875	1.729	50	20	IDGD	
COc1ccc(NC(=O)c2cccc(NC(=O)C(=O)NNC(=O)OC(C)(C)C)c2)cn1	765398304	FYTSTEXMZZASPT-UHFFFAOYSA-N	429.433	1.837	50	20	IDGD	
O=C(NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)o1)c1cc(-c2cccs2)[nH]n1	765570059	QRIGYZBGRIGQLF-UHFFFAOYSA-N	435.487	1.591	50	20	IDGD	
CC[C@@H](Oc1ccccc1F)C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765737544	GIDDXBNILJHFBD-LJQANCHMSA-N	442.491	1.589	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)CN2CCO[C@H](c3ccc(OC(F)F)cc3)C2)cc1	766266365	AIAKGDKNOAUZOY-SFHVURJKSA-N	430.411	1.994	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNc2nccnc2OC)cc(OC)c1Br	766270502	INRRCJVKCULQMZ-UHFFFAOYSA-N	426.227	1.347	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cc(C)n(C(C)(C)C)n3)CC2)cc1	766642510	RWNJHSIZHLAZPS-UHFFFAOYSA-N	426.565	1.834	50	20	IDGD	
C[C@@H]1C[C@H]1c1ccc(CCC(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)o1	766642904	OOYUMKUIOQJKRW-YLJYHZDGSA-N	438.528	1.941	50	20	IDGD	
CC(C)[C@@H](C(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1)N1CCCC1=O	766662681	AZQCOJXQBQQNPF-NRFANRHFSA-N	449.983	1.252	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(F)c(C(=O)NNc2ccccc2S(C)(=O)=O)c1	766663672	UBZHNWRIEQTURR-UHFFFAOYSA-N	429.495	1.673	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)[C@@H](NC(=O)c1cccs1)C(C)C	767275215	FQTVZCQXCZCEFM-IBGZPJMESA-N	431.514	1.744	50	20	IDGD	
O=C(Nc1ccccc1S[C@@H](Cl)C(F)(F)F)C(=O)N1CCN(C(=O)CO)CC1	768111182	CQZAWKGIYGYGTK-OAHLLOKOSA-N	439.843	1.508	50	20	IDGD	
CCCCn1c(C)cc(/C=C(\C#N)C(=O)N2CCN(S(=O)(=O)c3nc[nH]n3)CC2)c1C	768724509	ATFDKJXKYZELAE-LDADJPATSA-N	445.549	1.463	50	20	IDGD	
CNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2ccc(-c3ccc(F)cc3)s2)cn1	770214898	VUXIZAOYPLWTEF-UHFFFAOYSA-N	434.474	1.932	50	20	IDGD	
COC(=O)c1cnc(C(=O)NNC(=O)c2nc(-c3ccccc3)n(-c3ccccc3)n2)cn1	770465392	AIQIMKIGOALJDL-UHFFFAOYSA-N	443.423	1.586	50	20	IDGD	
COc1ccc(Cl)cc1N1C[C@@H](C(=O)NNc2nc(O)c3cnn(C)c3n2)CC1=O	770989967	KBLUDIZKCDDCCQ-VIFPVBQESA-N	431.840	1.227	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNS(=O)(=O)CCc1ccccc1[N+](=O)[O-]	771608236	SOWMBNPNUYUIRO-UHFFFAOYSA-N	440.865	1.058	50	20	IDGD	
CC[C@H](C)NS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cncc(NC(C)=O)c2)cc1	773069580	FZLPZLXZCBRJPV-LBPRGKRZSA-N	433.490	1.192	50	20	IDGD	
Cc1nc(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)ccc1Br	773522189	WOOWXVQOMLHVNT-ZDUSSCGKSA-N	435.234	1.078	50	20	IDGD	
COC(=O)c1cc(N2CCOCC2)ccc1NC(=O)C(=O)NNc1nccnc1C(C)C	773999230	VVQUXWYCAJQIGL-UHFFFAOYSA-N	442.476	1.305	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1cnn(C[C@@H]2CCCO2)c1	774002281	PIMZVMSQUPVKNU-WBMJQRKESA-N	435.868	1.269	50	20	IDGD	
CO[C@@H](c1ccc(Br)cc1)[C@@H](C)NC(=O)NNC(=O)C(=O)N1CCCC1	774341370	PHASAMANLMPISE-BXUZGUMPSA-N	427.299	1.478	50	20	IDGD	
CCOC(=O)N1CCC[C@H]([C@H](C)NCC(=O)NNC(=O)c2ccc(OC)c(OC)c2)C1	776823228	MMMIJKRCOARJRZ-HOCLYGCPSA-N	436.509	1.311	50	20	IDGD	
Cc1ccc2cccnc2c1S(=O)(=O)NNC(=O)c1csc(N2CCOCC2)n1	777911841	PPYPWIJIQLPPDH-UHFFFAOYSA-N	433.515	1.460	50	20	IDGD	
COC(=O)[C@@H](O)CNC(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccc(Cl)cc1	778946302	DZFKZHGMZOEDDD-ZGUWOUCSSA-N	427.848	1.674	50	20	IDGD	
COC(=O)c1scc(C)c1NC(=O)C(=O)NNC(=O)c1cc(Br)cn1C	782119974	CPUZQADASLODLV-UHFFFAOYSA-N	443.279	1.344	50	20	IDGD	
Cc1ccccc1NC(=O)NNC(=O)C(=O)Nc1cccc2c1CCN2S(C)(=O)=O	783416004	NXJNNGPIDQKVST-UHFFFAOYSA-N	431.474	1.109	50	20	IDGD	
Cc1ccc(-c2ncccc2NC(=O)C(=O)NNC(=O)CNC(=O)c2ccco2)s1	784002601	SLJYVSOKWBDDDK-UHFFFAOYSA-N	427.442	1.227	50	20	IDGD	
CN1CCN(C(=O)Cc2ccc(NC(=O)C(=O)NNc3ccccc3Cl)cc2)CC1	784774160	LZJJUQXOQSBGIF-UHFFFAOYSA-N	429.908	1.738	50	20	IDGD	
O=C(NNc1ncccc1Cl)C(=O)Nc1cccc(Cn2nc3ccccn3c2=O)c1	784813441	BFGBFPJMWCJPFJ-UHFFFAOYSA-N	437.847	1.675	50	20	IDGD	
COc1cccc(NNC(=O)C(=O)Nc2ccc(NC(=O)NC[C@@H]3CCCO3)cc2)n1	784842990	DYGPPCKGDYZARH-HNNXBMFYSA-N	428.449	1.473	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2ccc(CN(C)C(=O)OC)cc2)n1	785226955	XZPLHRAFXZBZFG-UHFFFAOYSA-N	429.481	1.603	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1cccc(S(=O)(=O)Nc2ccccc2F)c1	785417058	LGEMTLQZERGXRP-LBPRGKRZSA-N	437.449	1.729	50	20	IDGD	
COc1cccc(C[C@@H](O)C(=O)OCC(=O)NNC(=O)c2cc(Cl)ccc2OC)c1	785707167	OMTRFLSSTLHMKV-MRXNPFEDSA-N	436.848	1.265	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)[C@H]2CCN(C(=O)OC(C)(C)C)[C@H]2C)n1	786374750	ATNJCILRRJMOKN-STQMWFEESA-N	440.522	1.330	50	20	IDGD	
C[C@H](NS(=O)(=O)c1cccc(C#N)c1)C(=O)NNC(=O)NCc1ccc(Cl)cc1	787436356	YAKBJAMJMYSRTN-LBPRGKRZSA-N	435.893	1.409	50	20	IDGD	
O=C(Cc1cc(O)nc(O)n1)NN=C1C(=O)Nc2ccc(Br)c(Cl)c21	788020621	OVYUTTUYKRCMDK-UHFFFAOYSA-N	426.614	1.319	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2cccn(CC)c2=O)c1	789297743	DNBREFKZRMZTCC-UHFFFAOYSA-N	449.533	1.043	50	20	IDGD	
Cc1cc(F)c(Br)cc1NC(=O)C(=O)NNC(=O)COc1ccccc1O	789584078	CJDWHGVEVUTFDI-UHFFFAOYSA-N	440.225	1.767	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)cc1	789811171	WJVCCDDEDMBDRA-OALUTQOASA-N	427.457	1.370	50	20	IDGD	
CCOc1c(Cl)cccc1CC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	790113226	LITKNRQQLAPAHP-UHFFFAOYSA-N	439.921	1.993	50	20	IDGD	
CN1CCN(C(=O)NN=C2C(=O)N(Cc3ncon3)c3ccc(Br)cc32)CC1	790173365	IBKRWBYYURYELS-UHFFFAOYSA-N	448.281	1.040	50	20	IDGD	
CC(C)(C)OC(=O)Nc1ccccc1CCC(=O)NNC(=O)CNC(=O)c1cccnc1	790558503	JUMOGVKYRKBONL-UHFFFAOYSA-N	441.488	1.939	50	20	IDGD	
CO[C@@H]1CCOc2c(NC(=O)C(=O)NNC(=O)CSc3ccccc3O)cccc21	790952521	NNCHGHNNYIOSDH-OAHLLOKOSA-N	431.470	1.740	50	20	IDGD	
CO[C@@H]1CCOc2c(NC(=O)C(=O)NNC(=O)[C@H]3COc4ccccc4O3)cccc21	790957559	UKHCWQZNWXXNOY-RHSMWYFYSA-N	427.413	1.083	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(Cc3nnc4n3CCC4)cc2)c1	792267035	DILKRQOUAGGNBZ-UHFFFAOYSA-N	448.483	1.288	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@H](C)CCC(=O)OC(C)C)cc1	792304204	MULNOJQPUVAZIV-OAHLLOKOSA-N	442.538	1.066	50	20	IDGD	
CCC(=NNC(=O)[C@H](C)CN1C[C@@H](C)O[C@H](C)C1)c1ccc(Cl)c(S(N)(=O)=O)c1	794477612	DCPXGKWRXDDKDR-MGPQQGTHSA-N	444.985	1.963	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN(CC(=O)N2CCCCCC2)C(C)C)cc1OC	796603107	VXNPQKPIWKDJPR-UHFFFAOYSA-N	434.537	1.578	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNC(=O)CNC(=O)OCc2ccccc2)cc1F	797368995	LIWZQYDLFOMRTE-UHFFFAOYSA-N	432.408	1.237	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNC(=O)C(=O)Nc1ccccc1Br	797369390	ULGNNJRFTVFJQD-UHFFFAOYSA-N	449.261	1.461	50	20	IDGD	
CNC(=O)C[C@H](NC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)c1ccccc1	797545584	HDHCVCOXENBXEB-INIZCTEOSA-N	433.490	1.303	50	20	IDGD	
CN(CCO)S(=O)(=O)c1ccc(C(=O)NNc2cccc(Br)c2)cc1	798334886	VNONSVCOGBRXLG-UHFFFAOYSA-N	428.308	1.819	50	20	IDGD	
CSC[C@H](C)C(=O)N1CCC(C(=O)NNC(=O)CSc2ccccc2O)CC1	799716622	UUKLSPOODAICNL-ZDUSSCGKSA-N	425.576	1.869	50	20	IDGD	
COC(=O)Nc1cccc(CNC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)c1	804867493	CQJIDZGYKSDHSL-UHFFFAOYSA-N	448.505	1.611	50	20	IDGD	
COc1ccc(CS(C)(=O)=O)cc1NC(=O)C(=O)NNc1ccc(C#N)c(Cl)c1	807021239	ZDUFWMNDVCQFTF-UHFFFAOYSA-N	436.877	1.847	50	20	IDGD	
CN1CCN(C(=O)NNC(=O)CSc2nnc(-c3ccco3)n2Cc2ccco2)CC1	807383512	YGDQTVAJQLNBEA-UHFFFAOYSA-N	445.505	1.260	50	20	IDGD	
O=C(NNc1cccc(F)n1)C(=O)Nc1cc(Br)ccc1N1CCOCC1	807390983	CVBIAHBNGFGSOD-UHFFFAOYSA-N	438.257	1.902	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCc2ccc3[nH]c(C)cc3c2)cc1	807561819	XXRCZEWDYFCQMK-UHFFFAOYSA-N	443.529	1.936	50	20	IDGD	
CCCS(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)NCCc2cccs2)cc1	808081298	PWAGYXHEVNFKDO-UHFFFAOYSA-N	431.561	1.667	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)C(=O)Nc2cc(C(C)C)nn2-c2ccccc2)c1	810389806	MVWGJHJDQZCNMP-UHFFFAOYSA-N	449.471	1.749	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N1C[C@@H](C)S(=O)(=O)[C@H](C)C1	811853256	RRKKYLWNVFTWRH-UTUOFQBUSA-N	448.339	1.465	50	20	IDGD	
Cc1nc(O)c(Br)cc1C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	812731334	FYRHETHPLLZCSI-UHFFFAOYSA-N	429.296	1.865	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2c(F)cc(Cl)cc2F)cc1	813033977	UAYNZZMAHPINJE-UHFFFAOYSA-N	432.836	1.950	50	20	IDGD	
CC(=NNC(=O)Nc1ccc(S(N)(=O)=O)cc1)c1ccc(S(=O)(=O)N(C)C)cc1	814970265	WGDDZLHZYOPKGR-UHFFFAOYSA-N	439.519	1.130	50	20	IDGD	
C[C@H](COC1CCCC1)CS(=O)(=O)N1CCN(S(=O)(=O)CBr)CC1	815032310	FIUKZWAOXVVHDI-CYBMUJFWSA-N	447.417	1.211	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)C(=O)Nc2cccc(C3CC3)n2)c2ccccc2c1=O	815566097	IWWHPHMWPSNILE-UHFFFAOYSA-N	448.483	1.869	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)C(=O)Nc1cccc(S(=O)(=O)C2CCCCC2)c1	815567003	LXHOCWJCVBUBBI-UHFFFAOYSA-N	432.502	1.531	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(C)c(S(=O)(=O)C3CCCC3)c2)n1	815630281	CENOFETYZMHVRK-UHFFFAOYSA-N	444.513	1.814	50	20	IDGD	
CCn1cc(-c2nn(C)cc2C(=O)NNC(=O)[C@H]2CCCN(C(=O)OC(C)(C)C)C2)cn1	816509189	GZZKBBDAQKZHSQ-AWEZNQCLSA-N	445.524	1.712	50	20	IDGD	
C[C@@H]1Cc2ccccc2N1C(=O)[C@@H]1CCCC[C@H]1C(=O)NNC(=O)N1CCN(C)CC1	819721447	TXINQOMXOSXXOX-BHIYHBOVSA-N	427.549	1.759	50	20	IDGD	
O=C(C1CCN(S(=O)(=O)c2cccc(C(F)(F)F)c2)CC1)N1CC[C@@H](B(O)O)C1	864233999	LXPHIJOQKQRPBJ-CQSZACIVSA-N	434.245	1.181	50	20	IDGD	
CNC(=S)NNC(=O)Cc1csc(=NCc2ccco2)n1-c1cccc(OC)c1	916122609	GBOJGTIQFUSMDL-UHFFFAOYSA-N	431.543	1.909	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NC[C@@H](c2ccc(C)o2)N2CCOCC2)cc1	916229796	YZOWNSSZONDDKO-SFHVURJKSA-N	432.477	1.379	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)NCc2ccc(N3CCN(C)CC3)nc2)c1C	916245545	HRCDRVBFXMGLEL-SFHVURJKSA-N	440.548	1.748	50	20	IDGD	
COC[C@@H](C)n1c(C)cc(/C=C(\C#N)C(=O)N2CCN(C(=O)C(=O)NC3CC3)CC2)c1C	916409707	GCVUKYIBMNWPRO-PUMYGXPMSA-N	441.532	1.169	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)NCCC(=O)N1CCCCC1	916438318	ZQSRTXXTOOWIMG-UHFFFAOYSA-N	427.299	1.561	50	20	IDGD	
CN(C)[C@H](CNC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)c1ccsc1	916450035	YCZUZEKGJIAHAU-HXUWFJFHSA-N	444.605	1.894	50	20	IDGD	
O=C(NCc1ccc(S(=O)(=O)NC[C@@H]2CCCO2)cc1)NNC(=O)c1ccccc1	916649725	QYGBHDMJAZKAAH-KRWDZBQOSA-N	432.502	1.288	50	20	IDGD	
CC(C)CN1C(=O)/C(=C\NNC(=O)c2ccc(F)cc2Br)C(=O)NC1=S	917603751	OZCOLFQVPHTELL-WDZFZDKYSA-N	443.298	1.606	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)[C@@H](C)n3cccn3)c2)cc1	918186824	LTCQIEGFZCKBEZ-CQSZACIVSA-N	443.485	1.715	50	20	IDGD	
C[C@H]1CC(C)(C)C[C@]2(C1)NC(=O)N(CC(=O)NNC(=O)c1ccc(Cl)cc1O)C2=O	918358032	UDBKCFSNVUAUKY-YBTHPKLGSA-N	436.896	1.943	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NN=C(C)c2ccc(-n3cnnn3)cc2)c1	918708031	UAXBKQRNIYXGMA-UHFFFAOYSA-N	441.517	1.847	50	20	IDGD	
CC(C)[C@H](C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)n1nnc(-c2ccccc2)n1	919714537	QCIQVPDWLWUXSS-QGZVFWFLSA-N	442.501	1.402	50	20	IDGD	
O=C(NNC(=O)c1cn(-c2ccccc2)nc1-c1cccs1)N[C@H]1CCS(=O)(=O)C1	919883433	CUKQHQDEKHMHEV-ZDUSSCGKSA-N	445.526	1.732	50	20	IDGD	
Cc1noc2nc(-c3ccccc3)cc(C(=O)NNC(=O)N[C@@H]3CCS(=O)(=O)C3)c12	919889989	XWZOPENCNQAWDV-CYBMUJFWSA-N	429.458	1.329	50	20	IDGD	
O=C(NCc1cccc(NC(=O)[C@H]2CCCO2)c1)NNC(=O)[C@H]1COc2ccccc2O1	920236308	AJDMGGLVIHXXEU-RTBURBONSA-N	440.456	1.475	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCC2CC2)cc1S(=O)(=O)N[C@H]1CCCC[C@H]1C	920859275	UQTVRJWGQIXOKT-CJNGLKHVSA-N	438.550	1.906	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCCCC(=O)NNC(=O)NCCc2cccs2)cc1C	920861248	LGKAEAIXQIEFAP-UHFFFAOYSA-N	438.575	1.997	50	20	IDGD	
O=C(CCCC[C@@H]1SC[C@H]2NC(=O)N[C@@H]21)NNC(=O)c1cc(Br)c[nH]1	921304597	XXCRIHKBEBVFMZ-MDZLAQPJSA-N	430.328	1.264	50	20	IDGD	
CN(C)C(=O)N1CCC(C(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)CC1	1318667504	HVLGBQJKJMIKSQ-UHFFFAOYSA-N	425.530	1.175	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cc(Br)c(C=O)n2C)cc(OC)c1OC	1318958539	HBTGAMHFHBGJGS-UHFFFAOYSA-N	440.250	1.701	50	20	IDGD	
COc1ccc(O)c(S(=O)(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)c1	1320060952	WOMMMNHOUSKZMX-UHFFFAOYSA-N	429.495	1.357	50	20	IDGD	
C[C@@H](Sc1ncccc1C(=O)NNC(=O)c1n[nH]c2c1CCCC2)C(=O)N1CCCC1	1322304355	RERLUHJOWFLRHX-CYBMUJFWSA-N	442.545	1.861	50	20	IDGD	
C[C@](O)(C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CO[Si](C)(C)C)C1)C(F)(F)F	1779539654	IZWXKZHTDNWVFJ-XOKHGSTOSA-N	440.535	1.665	50	20	IDGD	
COc1ccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)CCBr)C3)nn1	1779951250	FCIAHRNRIJCAJW-RDTXWAMCSA-N	441.326	1.398	50	20	IDGD	
O=C(c1ccc(N2CCCC2)c(F)c1)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1780143710	UAZBOWYCUXYJKL-NQIIRXRSSA-N	439.915	1.469	50	20	IDGD	
Cc1ccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C3)cc1F	1780361993	FJQDNYXTVWEXBO-AUSIDOKSSA-N	448.539	1.635	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H]3CC[C@@H]4CCC(=O)N4C3)C2)C1	1781050306	HUZPPFRARWWHGI-MRUHUIDDSA-N	425.957	1.482	50	20	IDGD	
COc1ccnc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)c1OC	1781232473	UYIKHOWCQCIVKS-OALUTQOASA-N	446.331	1.779	50	20	IDGD	
O=C(c1cccc(Br)c1F)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1781559539	NVZMHIFNXICDRY-CXAGYDPISA-N	449.704	1.631	50	20	IDGD	
O=C(c1ccc(N2CCCCC2)cc1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1781711932	WFDZJBRCTDHSGA-SIKLNZKXSA-N	435.952	1.720	50	20	IDGD	
Cc1[nH]nc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](C)Br)C2)c1F	1781996859	WFIRLIJJIULRQG-GSDQYQHOSA-N	431.306	1.768	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1	1782009002	NOAIKXZCZUJKAY-FZKQIMNGSA-N	433.288	1.449	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(S(C)(=O)=O)ccc3F)C2)C1	1782151671	SXPPNOKQIPRZAZ-DNVCBOLYSA-N	446.928	1.690	50	20	IDGD	
C#CCO[C@@H](C)C(=O)N1CCO[C@]2(CCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1	1782861969	NNYAUKJLLNAIQM-CXLLCFNZSA-N	443.450	1.740	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)Cn3cnc4ccccc43)C2)C1	1783752935	UQCPNHRSDYYPJG-KUHUBIRLSA-N	435.322	1.650	50	20	IDGD	
Cc1onc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)CBr)C[C@@H]32)c1C	1784772225	ZQRBEFYBAROSJW-HJPIBITLSA-N	428.327	1.916	50	20	IDGD	
COc1cc(CCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CO[Si](C)(C)C)C[C@@H]32)ccn1	1785105959	VDTWVGUNURQOCL-FHWLQOOXSA-N	449.624	1.854	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)c1cccnc1OCC1CC1	1785733716	NPJZYHMNAYTEKP-OWLYRPNTSA-N	437.924	1.063	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccnn3CC)[C@H]2C1	1786181390	UEGMMHGXVFIVGI-AYDFFVQHSA-N	427.343	1.670	50	20	IDGD	
O=C(Cc1ccc2ccccc2c1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21	1786447521	ORLHJPJHVUFWKI-TUFLPTIASA-N	430.932	1.962	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1)c1ccnc(F)c1	1786517097	YSGPUXLWLNDJOB-UHFFFAOYSA-N	433.248	1.962	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3[nH]nc4ccncc34)[C@H]2C1	1787341160	LXMZGVNGVVGFDE-MPXAEWJHSA-N	436.310	1.335	50	20	IDGD	
COc1cc(C(=O)NC2(c3ccc(NC(=O)c4ccc(B(O)O)cc4)cc3)CCC2)n(C)n1	1788140362	UXQRVCCJQOVJQX-UHFFFAOYSA-N	448.288	1.170	50	20	IDGD	
O=C(CC(F)(F)C(=O)O)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1	1788141111	LSYGAULKCFDLMQ-UHFFFAOYSA-N	446.215	1.224	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)c1cnn2c1CCC2	1790388066	FNOSVGRHCRBKMY-NOLJZWGESA-N	425.327	1.208	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4ncnn4c3)C[C@@H]21	1791056373	VYDOSNSTFPGKGE-UNQGMJICSA-N	436.310	1.106	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnn4ncccc34)C[C@@H]21	1791057182	GRCLRZKZBSXWFZ-DUPGQFARSA-N	436.310	1.106	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Cl)C[C@@H]21)[C@@H]1C[C@@]12C(=O)Nc1ccccc12	1791065029	QAEYQHMFJFXHBJ-LDBZLIDKSA-N	435.883	1.411	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC1(c2ccc(NC(=O)CCc3ncc[nH]3)cc2)CCC1	1791759737	BKZTWQAGZVEQOZ-UHFFFAOYSA-N	426.521	1.849	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCc1ccc(F)c(F)c1)c1cccc(B(O)O)c1	1792824295	VFVJJMJUUFEERH-REPLKXPHSA-N	442.271	1.529	50	20	IDGD	
C#CCO[C@@H](C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2	1793571503	XKDSXSGPMQPBLS-LLLHUVSDSA-N	443.456	1.810	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnccc1C(F)(F)F	1794719817	IXXHSJYZBJNORJ-JLUCKKNBSA-N	435.830	1.557	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)c1ccc(-c2cc[nH]n2)cc1	1796189378	FLVUQEAXMMJZKS-WKCHPHFGSA-N	444.300	1.322	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1csc2c1CCCO2)c1cccc(B(O)O)c1	1796555149	QJGSXABGSPDJGT-BJWYYQGGSA-N	440.330	1.319	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(-n3cccn3)nc1)C2	1797957244	BYQYYQRKRLIOQO-XEMDLRDOSA-N	443.580	1.322	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc3cccnc13)C2	1798440185	GNYVCRLHSBMULU-BJWYYQGGSA-N	444.495	1.799	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2c(c1)NC(=O)[C@@H](C)O2	1798582526	GKTWJCYKZYAOLY-BWOYXGKQSA-N	435.908	1.627	50	20	IDGD	
Cc1cncc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Br)c1	1799344679	QOAFXGLCZYGRJU-FSDCSDTHSA-N	428.302	1.603	50	20	IDGD	
Cc1cccc2c(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@@H](F)Br)n[nH]c12	1799347276	OHCWCDRORPFUPR-YHYOWMERSA-N	439.285	1.765	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(Cl)c(O)cc1O	1799445067	BROZHCJIPHZOEL-KFRQHLNQSA-N	447.713	1.738	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc([N+](=O)[O-])cc1F	1799492944	FCZWOIFASKHOGI-VAECKANCSA-N	429.832	1.191	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)n1cccc1C=O)C2	1800756503	NJLBYBAFHYEAKB-QKDZRIPBSA-N	426.311	1.235	50	20	IDGD	
COC[C@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H]1C[C@@]13C(=O)Nc1ccccc13)C2	1802284956	STBHIMIYBYLGBA-XEURPQGBSA-N	431.920	1.788	50	20	IDGD	
COc1ccnc(C(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]2c2cccnc2)c1OC	1803140860	IOWMZMDBDUTZDD-IIDMSEBBSA-N	448.907	1.413	50	20	IDGD	
Cc1nnc(CCC(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)s1	1803142415	WRFUFXDGMSNGMO-VKJFTORMSA-N	437.953	1.480	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)c1cn2ccsc2n1	1809938541	OJTRPGXXOFEXSQ-BPUTZDHNSA-N	433.921	1.710	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)[C@@H]3CCCSC3)CC2)C1	1809972417	IVMLYSAVERTIIR-GOSISDBHSA-N	430.379	1.354	50	20	IDGD	
Cc1cnoc1C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1	1810302887	NWICXSIUUBBXPS-QAPCUYQASA-N	449.471	1.010	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)c[nH]1	1810303017	OKAVKSLAJISBJY-OXJNMPFZSA-N	447.499	1.350	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)C2(F)CCC2)[C@H]1c1cccnc1	1810308765	NSRDXBNQMFUDCC-QAPCUYQASA-N	440.479	1.292	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@H]1CCN(C(=O)CCn2cncn2)[C@@H]1c1cccnc1	1810547389	FQHXXLTXRLSXED-YLJYHZDGSA-N	430.585	1.621	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2ccnc3c2OCO3)[C@@H]1c1cccnc1	1811316061	QJCMLZGRMWQRQM-XIRDDKMYSA-N	446.891	1.779	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)c1cnn2cccc(F)c12	1812280600	NQXJFCOMTXQZDT-JCGIZDLHSA-N	445.882	1.788	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)[C@H](C)Cn2ccnc2)[C@@H]1c1cccnc1	1813033297	LIMHXXQQKKRWOK-XGXHKWSGSA-N	433.940	1.874	50	20	IDGD	
O=C(Cc1ccc2c(c1)OCO2)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](O)CCl)CC2	1814133474	QAGOOXNFTOYJOV-DGCLKSJQSA-N	437.905	1.626	50	20	IDGD	
CC(C)CNC(=O)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCBr)n[nH]1	1816781314	WXZLCWFFTUGWNC-CYBMUJFWSA-N	428.331	1.959	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cscn2)[nH]n1)c1cccc(B(O)O)c1	1817473399	RNSALJFPXOYXKS-MRXNPFEDSA-N	425.279	1.166	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)CCl)CC2)c1ccc2ncncc2c1	1819183527	ASXLPPZXXJELSE-DOMZBBRYSA-N	431.905	1.912	50	20	IDGD	
C=CC[C@H](C)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1	1819799414	BUIDYLLLFSWMFU-NWDGAFQWSA-N	428.518	1.580	50	20	IDGD	
CC(C)=NO[C@@H](C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1820970353	ZPANVQKNMDMQMG-KSSFIOAISA-N	441.297	1.196	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1	1823006379	ACADTCOYSDNXGP-RWYTXXIDSA-N	433.303	1.436	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](CC)NC(N)=O)CC2	1825446889	KCLHNSSEIYJOQI-UTLUCORTSA-N	446.371	1.676	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)CN3CCCCC3=O)sc2C1	1825867734	JEUVLGFJVCCRSP-NEPJUHHUSA-N	428.942	1.321	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(O)nc(O)c1)CC2	1825998865	NOKKCZKBDBUOEU-UWVGGRQHSA-N	426.882	1.429	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)N[C@H]1CCc2nc(NC(=O)[C@H](Cl)COC)sc2C1	1826004379	HZNVPEGRBPWDTH-OUAUKWLOSA-N	433.914	1.871	50	20	IDGD	
COc1ccc(C(=O)N[C@@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)cc1	1826088677	JBAKUJVKNJDTOO-CQSZACIVSA-N	445.545	1.751	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)CN3C(=O)CSC3=S)sc2C1	1828247171	NKRRDURLXKQYSC-IUCAKERBSA-N	447.007	1.933	50	20	IDGD	
COc1ncc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)cc1C	1830358578	DQMSNNIUAKHQBI-OAQYLSRUSA-N	439.940	1.734	50	20	IDGD	
O=C(C(Cl)Cl)N1CCC([C@@H]2CCCCN2C(=O)[C@H]2CCCS2(=O)=O)CC1	1831286487	XPWCLCVYYDZLCB-UONOGXRCSA-N	425.378	1.987	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4n(n3)CCCO4)C2)C1	1831651071	NKFBPSHWMLAWPE-YWZLYKJASA-N	440.928	1.143	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4c(c3)CC(=O)N4)C2)C1	1831652122	WLOLOSQDFMZLIM-JTSKRJEESA-N	449.935	1.659	50	20	IDGD	
Cc1cc(CC(=O)N2CCC([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)no1	1831876499	GPSHZWNEHAETIE-LJQANCHMSA-N	433.553	1.518	50	20	IDGD	
C[C@@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)c3ncccn3)CC2)CC1	1833261909	BWSBREWMFIZNRR-AWEZNQCLSA-N	438.370	1.693	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3n[nH]c(CC)c3F)CCO2)C1	1833734560	VVXMZEHEWATURO-YJYMSZOUSA-N	430.908	1.589	50	20	IDGD	
Cc1cc(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](C)Br)CC3)CC2)no1	1834253434	XFKYCCXPSYJMLQ-CYBMUJFWSA-N	427.343	1.952	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3ccc(F)cn3)CC2)CC1	1834299868	VUEUYCGKDKSTBZ-QGZVFWFLSA-N	426.920	1.660	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)C3CCCC3)CC2)CC1	1834360745	VMZQJAIPERWKNU-UHFFFAOYSA-N	442.564	1.061	50	20	IDGD	
Cc1nc(C(=O)N2CCO[C@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)cs1	1834456321	KXIJZYLUKFKOQD-SFHVURJKSA-N	427.599	1.373	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(F)cn1)CCO2	1834477120	FXKVVEMBXMCTEW-LJQANCHMSA-N	425.533	1.142	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)C(=O)c3ccccc3)CCO2)C1	1834706807	UPQJRSJNLAWMGP-VQTJNVASSA-N	443.327	1.562	50	20	IDGD	
CC(=O)C[C@H](C)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](F)Br)CC2)CC1	1836414322	DUTLYYJWCMGPOA-BLLLJJGKSA-N	434.350	1.864	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836717279	AAPPWIMLFJFQTM-YOEHRIQHSA-N	429.772	1.821	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)/C=N/O[C@H]3CCCCO3)CCO2)C1	1837526123	SNOPFUFBQYFOCS-HQNYPKAYSA-N	445.944	1.379	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](Cl)COC)CC2)CC1	1838726960	NKDVSCPJNRSFFU-PBHICJAKSA-N	448.944	1.800	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)CCc3cnccn3)CC2)CC1	1838784951	AFAZSVOQOZFSOH-IBGZPJMESA-N	438.956	1.662	50	20	IDGD	
O=C(c1c(F)cccc1Cl)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1	1838868010	FEFHBIWTIIIIDV-KBXCAEBGSA-N	435.279	1.149	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(F)cc(F)c3)CCO2)C1	1839003389	FJNMPLMGCQGWHI-VQIMIIECSA-N	432.851	1.289	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3n[nH]c4ccc(F)cc34)C2)C1	1839145957	RWIDMAOMIFOTFD-YWZLYKJASA-N	438.887	1.789	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(F)ccc3F)C2)C1	1840034165	BVXRJRKSODFMNO-SGTLLEGYSA-N	447.276	1.818	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)CC(C)=O)CCO2	1840133017	RWWKPZRILQZVAT-QIIPPGSGSA-N	433.343	1.232	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(C)c(F)c3)C2)C1	1840154220	PMIDIXUWBIRSGM-UZLBHIALSA-N	428.888	1.458	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4ccoc4c3)C2)C1	1840155324	XVTYENHGHIUSQL-LAUBAEHRSA-N	436.892	1.757	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)C2(CNC(=O)OC(C)(C)C)CC2)C1	1841095291	WGCNTFKKNOVIAZ-AWEZNQCLSA-N	429.945	1.749	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2cc3c(s2)CCC3)C1	1842556792	HQPREAVICVVSPB-UHFFFAOYSA-N	425.514	1.366	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1cnn3ccc(C)cc13)C2	1843415942	GIGMDMNDNRBDCX-WGOQTCKBSA-N	447.499	1.594	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)Cc2ccc3c(c2)CCCO3)C1	1843920167	SIHCEHRGEBWWQP-UHFFFAOYSA-N	428.533	1.131	50	20	IDGD	
O=C([C@@H]1CN(Cc2ccccc2)CCO1)N1CC2(CCCN2C(=O)C(Cl)Cl)C1	1846387801	NXPLTXSTLLZCPL-INIZCTEOSA-N	426.344	1.895	50	20	IDGD	
CC[C@H](C)NS(=O)(=O)c1ccc(C(=O)NNC(=O)c2c(C)nc3ccccn23)cc1	17583141	DDRRKSYQLYJJJU-ZDUSSCGKSA-N	429.502	1.794	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)cn1	17633789	ORHBMDOBUARYEU-UHFFFAOYSA-N	429.440	1.867	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)[nH]c2c1C(=O)CCC2	21783570	SSSOTCFLZWKMKW-UHFFFAOYSA-N	444.513	1.701	50	20	IDGD	
O=C(NNC(=O)c1ccc(C(F)(F)F)nc1)c1ccc(S(=O)(=O)N2CCCC2)cc1	26561440	BRCSGAKNJFWEPW-UHFFFAOYSA-N	442.419	1.960	50	20	IDGD	
O=C(CNC(=O)Nc1ccccc1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	27229223	ACLBVHLTNXVXMI-UHFFFAOYSA-N	445.501	1.054	50	20	IDGD	
CC(=NNC(=O)C(=O)NC1CC1)c1ccc(NC(=O)C[C@H]2Nc3ccccc3NC2=O)cc1	725853776	VZCRYCGWSHCPHU-LJQANCHMSA-N	448.483	1.567	50	20	IDGD	
CC(C)NC(=O)C(=O)NNC(=O)[C@@H]1C[C@H]2CCCC[C@H]2N1C(=O)c1cccc(Cl)c1	726157343	SVOPTKVTGXNKHS-XYPHTWIQSA-N	434.924	1.785	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)NCc1cccc(NC(=O)c2ccncc2)c1	726234411	GEAKHYRZLGYXJL-UHFFFAOYSA-N	436.428	1.187	50	20	IDGD	
CNS(=O)(=O)c1cccc([C@@H](C)NC(=O)NNC(=O)[C@H](C)Oc2ccccc2F)c1	727609322	JLWFXRBCJRBFQT-OLZOCXBDSA-N	438.481	1.593	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)O[C@H](C)C(=O)N[C@H]2CCS(=O)(=O)C2)c(C)n1CC(C)C	729254446	BXJHRNJNDYLNOZ-QOMRNPFZSA-N	435.546	1.903	50	20	IDGD	
Cc1nc(-c2ncccn2)nc(O)c1CC(=O)NNC(=O)c1cc(Br)c[nH]1	729282502	ZPQYYEGACTZLCS-UHFFFAOYSA-N	432.238	1.042	50	20	IDGD	
CCN1CCC[C@H]1CN1C[C@H](C(=O)NNC(=O)c2ccc(OC(C)C)c(OC)c2)CC1=O	729627165	PNQZPEBSBVQAOB-MSOLQXFVSA-N	446.548	1.576	50	20	IDGD	
CCOc1cc2c(cc1[C@@H]1C[C@@H]1C(=O)NNC(=O)CNC(=O)c1ccco1)O[C@@H](C)C2	730490084	WWDUXJAYYZWGRZ-NOLJZWGESA-N	427.457	1.683	50	20	IDGD	
O=C(COc1ccc(I)cc1)NNC(=O)COc1ccccc1O	730781738	ANILNEGJFVITRM-UHFFFAOYSA-N	442.209	1.602	50	20	IDGD	
O=C(COC(=O)c1nn(-c2ccc(F)cc2)ccc1=O)NNC(=O)c1ccc(Cl)cc1	731746653	SPCARIOFVXEMBA-UHFFFAOYSA-N	444.806	1.643	50	20	IDGD	
C[C@H](C(=O)NNC(=O)[C@H]1COc2ccccc2O1)N1CCN(c2ccc(F)cc2)CC1	731865406	DNJXLTNRTZWQRF-FOIQADDNSA-N	428.464	1.324	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc([C@@H](C)N[C@H](C)C(=O)NNC(=O)CC(C)C)cc1	732197201	XDAJSAVIEUCVSS-HZPDHXFCSA-N	426.583	1.950	50	20	IDGD	
C[C@H]1C[C@H]1C(=O)Nc1ccc(C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1	732328500	ZTHGMJBJIWCGID-YVEFUNNKSA-N	440.412	1.807	50	20	IDGD	
Cc1nc(N2CCOCC2)nc(O)c1CCC(=O)NNc1ccc(Br)nc1	732838045	GUWGBMYHZNLOPC-UHFFFAOYSA-N	437.298	1.561	50	20	IDGD	
C[C@H]1CCC[C@H](OCC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)C1	732931760	GENIMJLURUOSBK-RDJZCZTQSA-N	439.534	1.064	50	20	IDGD	
COCCS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1	733107013	SSOXRBCTPBMCRV-UHFFFAOYSA-N	428.470	1.367	50	20	IDGD	
CCOCCCn1c(NNC(=O)[C@H]2CC(=O)N(CC(C)C)C2)nc2ccccc2c1=O	733265948	NQSFAYGVPJCSMV-INIZCTEOSA-N	429.521	1.771	50	20	IDGD	
COc1ccc2[nH]cc(CCNC(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)c2c1	733650520	QLUJVZJQZPMMPT-UHFFFAOYSA-N	430.486	1.767	50	20	IDGD	
O=C(C[C@H]1CCc2ccccc21)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	734387585	QNHZGGLAIJCIAB-QGZVFWFLSA-N	443.525	1.589	50	20	IDGD	
COCCN1CC[C@H](NC(=O)NNC(=O)[C@@H](C)Oc2cccc(Br)c2)C1	736650580	XFEXUFBPNZIUCS-OCCSQVGLSA-N	429.315	1.268	50	20	IDGD	
Cc1nn(C)c2sc(C(=O)N[C@H](C)C(=O)NNC(=O)[C@H]3COc4ccccc4O3)cc12	742033983	WVDQDBOGCHPIGF-IAQYHMDHSA-N	443.485	1.049	50	20	IDGD	
COc1ccc(C(=O)NCCNC(=O)NNC(=O)c2cccc(Br)c2)cc1	743686431	LYAWMQNLUGHKME-UHFFFAOYSA-N	435.278	1.832	50	20	IDGD	
COc1cc(OC)cc(C(=O)NCC(=O)NNC(=O)c2cccc(Br)c2)c1	743728397	PMBPGKXCNHEANI-UHFFFAOYSA-N	436.262	1.657	50	20	IDGD	
Cc1ccc(S(C)(=O)=O)cc1C(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	743831139	QIZSEEIRGPRWFD-UHFFFAOYSA-N	425.488	1.269	50	20	IDGD	
C[C@H](C(=O)OCC(=O)NNC(=O)c1cccc(Cl)c1)n1nnc(-c2ccccc2)n1	745685139	TZAOZMTWHAIZMT-GFCCVEGCSA-N	428.836	1.559	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)c1ccc(Cl)c(Cl)c1)C(=O)NNC(=O)N(C)C	746013112	UXFMDBIHIVAPDM-LBPRGKRZSA-N	443.378	1.696	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)[C@H]2CCCN(C(=O)c3ccc4n[nH]cc4c3)C2)c1	746300436	UICVKPJRTAUMIE-HNNXBMFYSA-N	449.471	1.230	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2scnc2C(C)(C)C)CC1	746892915	ZDAGJBPUHDHJEW-UHFFFAOYSA-N	438.579	1.529	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCCN1Cc1ccc(F)cc1)c1csc(N2CCOCC2)n1	747199778	DDNJHFGKYJKJTH-GOSISDBHSA-N	447.536	1.935	50	20	IDGD	
C[C@@H](c1ccccc1)[C@](C)(O)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	747348545	MWCPKFVWZUXSHT-AOMKIAJQSA-N	445.541	1.787	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(NC(=S)NNC(=O)c2cc(Cl)ccc2O)c1	747731100	BAKRBNSVCAHZBU-UHFFFAOYSA-N	428.923	1.927	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)NCCC(=O)Nc1ccc(Br)cc1C	748627117	GTTFFMCRUUFRQT-LBPRGKRZSA-N	445.314	1.468	50	20	IDGD	
CNC(=O)CCNC(=O)/C(C#N)=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	748724304	ZJJMKACKSSZLKF-GXDHUFHOSA-N	428.880	1.238	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN(C)[C@H]2CS(=O)(=O)c3ccc(Cl)cc32)n1	750176540	AFSABIIKKBNCGK-ZDUSSCGKSA-N	442.950	1.255	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C1CCN(c2nc3ccccc3o2)CC1	751208643	HQPUZEOTXOYPOJ-UHFFFAOYSA-N	427.486	1.683	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N2CCOCC2)cc1NC(=O)NNC(=O)CC(C)C	755440507	CDSPSGAZJMYDSS-UHFFFAOYSA-N	428.511	1.305	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)c2ccc(O)c(Cl)c2)n([C@H]2CCS(=O)(=O)C2)n1	755531849	JLKMSWJETIJURK-NSHDSACASA-N	427.870	1.377	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)N1CCN(CC(=O)Nc2ccccc2F)CC1	756069669	FHNXEQAUHDNYJT-UHFFFAOYSA-N	443.479	1.339	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2ccc(OC)c(-n3nnnc3C)c2)cc1OC	756320774	QGGCVDOJFSCXLZ-UHFFFAOYSA-N	427.421	1.463	50	20	IDGD	
CN1CCN(CC(=O)N(C)c2ccc(NC(=O)NNC(=O)c3cccc(C#N)c3)cc2)CC1	756357556	DJWHKFNICKVMOX-UHFFFAOYSA-N	449.515	1.235	50	20	IDGD	
COC(=O)c1cc(NC(=O)NNC(=O)c2ccc3c(c2)OCCO3)c(OC)c(OC)c1	756742449	MSLBKPIUHBZQDF-UHFFFAOYSA-N	431.401	1.728	50	20	IDGD	
C[C@](O)(CN1Cc2ccccc2C1=O)C(=O)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	756882779	ZMZFBNWTSWANHM-QFIPXVFZSA-N	437.431	1.384	50	20	IDGD	
C[C@@H]1C[C@@H](C)CC2(C1)NC(=O)N(CC(=O)NNC(=O)Cn1ccc3ccccc31)C2=O	756974039	IPJJFCAGCMYAAO-HUUCEWRRSA-N	425.489	1.535	50	20	IDGD	
Cc1cc(=NC(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)cc[nH]1	757807664	NUVASWCVMWXVPI-UHFFFAOYSA-N	428.456	1.980	50	20	IDGD	
O=C(NNC(=O)C(=O)Nc1ccccn1)N[C@@H]1CCN(c2ccc(Br)cc2)C1	758742551	GMYULFOPGDKFQZ-CYBMUJFWSA-N	447.293	1.392	50	20	IDGD	
CN(NC(=O)c1ccc(C(=O)NC2CC2)cc1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758786067	IVRQLSLIOPXVCK-UHFFFAOYSA-N	445.520	1.828	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCc1nnc(C(C)(C)C)s1	758832885	AJHYBOWZOAAUTH-UHFFFAOYSA-N	439.567	1.581	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(-c3nnc(C)o3)cc2)cc1OC	758969694	FDRSFURDCSSLTF-UHFFFAOYSA-N	440.412	1.680	50	20	IDGD	
COCCOc1cc(C(=O)NNC(=O)CCN2C[C@@H](C)O[C@H](C)C2)nc2ccccc12	760119185	ATKUXMOHOUTKDX-HZPDHXFCSA-N	430.505	1.520	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)c1nc(-c2ccccc2)no1	760288230	WNWBMMXZAQOOQN-ZDUSSCGKSA-N	433.432	1.460	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3cnn(C)c3Br)n[nH]2)cc1OC	760376109	DNXBVFJBIMVGKB-UHFFFAOYSA-N	449.265	1.665	50	20	IDGD	
COC(=O)c1ccc(S(=O)(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)cc1C	763439762	RCGWWUMTTNRKAW-UHFFFAOYSA-N	429.495	1.396	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3ccc4ccccc4n3)cc2)CCO1	763448973	AGAJIVCKFNIYFH-HNNXBMFYSA-N	433.468	1.860	50	20	IDGD	
CCCN1CCN(c2ccc(NC(=O)C(=O)NNC(=O)c3ccncc3)cc2Cl)CC1	763463085	VSEHRUTURZTJCT-UHFFFAOYSA-N	444.923	1.667	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cccnc2)nn1CCCOc1ccc(F)cc1	763491526	LYWRMOFJTTUDQD-UHFFFAOYSA-N	440.435	1.594	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccccc2CSC)cc(OC)c1OC	763540737	YVTJXGIRQZRRHN-UHFFFAOYSA-N	433.486	1.975	50	20	IDGD	
CCN(c1ccccc1)S(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)C2CC2)cc1	763562475	RUGMQUCKILJRSY-UHFFFAOYSA-N	430.486	1.398	50	20	IDGD	
CS(=O)(=O)c1cccc(NC(=O)C(=O)NNC(=O)CSc2ccc(Cl)cc2)c1	763736803	VFKNPEKTYZVCDC-UHFFFAOYSA-N	441.918	1.622	50	20	IDGD	
C=CCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(OC)cc(OC)c2)cc1	763773382	WYUHLKLKYDVCDQ-UHFFFAOYSA-N	426.429	1.019	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2cc(C#N)ccc2Cl)c2ccccc2c1=O	763786957	SRCPVJDHKDOAIC-UHFFFAOYSA-N	438.831	1.341	50	20	IDGD	
CC(C)Cn1cc(NC(=O)C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)cn1	763791460	SCWKDSVWUFOPOE-UHFFFAOYSA-N	439.476	1.230	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)cc1NC(C)=O	763864377	CCFSSSICTFZYMR-NSHDSACASA-N	432.408	1.346	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc(C)cc1OC[C@@H]1CCCO1	764047591	IOUCGQSINXCBLK-HNNXBMFYSA-N	427.457	1.961	50	20	IDGD	
Cc1noc(COc2ccc(NC(=O)C(=O)NNC(=O)c3ccc(Cl)cc3O)cc2)n1	764125919	AVHZBAIDFLWDQI-UHFFFAOYSA-N	445.819	1.716	50	20	IDGD	
O=C(CCC1CCCCC1)NNC(=O)C(=O)Nc1cccc(C(=O)N2CCOCC2)c1	764214712	BTWSNUOIXDIDHG-UHFFFAOYSA-N	430.505	1.605	50	20	IDGD	
CC(C)(C)OC(=O)Nc1ccc(F)c(NC(=O)C(=O)NNC(=O)Cc2ccccn2)c1	764266664	IFNWQYQJGXPGHR-UHFFFAOYSA-N	431.424	1.896	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1ccc2nc(-c3ccccn3)oc2c1	764277421	DPFPAUOTFIWASK-UHFFFAOYSA-N	447.407	1.760	50	20	IDGD	
CN1CCC(N(C)c2ccc(NC(=O)C(=O)NNC(=O)Cc3ccccc3F)cc2)CC1	764318587	BSLNRGRKZCNZLW-UHFFFAOYSA-N	441.507	1.685	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cnn(C)c2)nn1-c1ccc(Cl)c(Cl)c1	764360387	VTEBEUZJIPKFCD-UHFFFAOYSA-N	436.259	1.621	50	20	IDGD	
O=C(NNC(=O)[C@@H](O)CCc1ccccc1)c1cccc(S(=O)(=O)N2CCCCC2)c1	764586723	ZWYRGGFSEGDDBV-FQEVSTJZSA-N	445.541	1.616	50	20	IDGD	
CNS(=O)(=O)c1csc(C(=O)NNC(=O)c2cc(-c3cc(C)ccc3C)[nH]n2)c1	765581000	IKESESLKFJYLNE-UHFFFAOYSA-N	433.515	1.738	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCc4ccccc43)c2)n[nH]1	765585607	BHYXJIIOFRUJHY-UHFFFAOYSA-N	425.470	1.544	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N2CC(O)(C(C)C)C2)cc1	765589277	LIEKSRVENGJENQ-YVLHZVERSA-N	437.500	1.570	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1ccc(OCC2CC2)cc1	765735385	LYMFPFZUZIHMOP-UHFFFAOYSA-N	436.512	1.694	50	20	IDGD	
O=C(Cc1ccc(C(F)(F)F)cc1)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765737387	YTGPGVXVEVCCIC-UHFFFAOYSA-N	448.445	1.853	50	20	IDGD	
COc1cc(C#N)ccc1NC(=O)C(=O)NNC(=O)c1cc(F)ccc1Br	766260675	URIAUEFAXYMARZ-UHFFFAOYSA-N	435.209	1.868	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)[C@H](c1ccccc1)N1CCCCC1=O	767338215	BCLULGNVOOZWKK-QHCPKHFHSA-N	437.496	1.982	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)[C@H](C(C)C)N2C[C@H](C)O[C@H](C)C2)n[nH]1	768282075	WBDNNMFCCBSQOQ-MDOVXXIYSA-N	429.521	1.980	50	20	IDGD	
COC(=O)c1[nH]c(C)c(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1C	769049975	YXVQRIPAWMMGMI-UHFFFAOYSA-N	448.501	1.277	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Cc2ccnc(O)c2Br)cc(OC)c1OC	770813908	NAPACIYGRDWSDL-UHFFFAOYSA-N	440.250	1.579	50	20	IDGD	
CCNc1ncc(C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)s1	771046555	UHVJGSBPLHYZBZ-UHFFFAOYSA-N	436.969	1.807	50	20	IDGD	
C[C@@]1(c2ccc(Br)cc2)NC(=O)N(CC(=O)NNC(=O)C2CCCC2)C1=O	771249032	DZWMBIZZUPSAFN-SFHVURJKSA-N	437.294	1.554	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1ccccc1OCC(=O)Nc1ccccc1F	771856372	STSWAEXYBLWULR-ZDUSSCGKSA-N	431.420	1.946	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NC[C@H]2COC3(CCCCC3)O2)nc1	776064362	JVWGQWQGXKWZKH-HNNXBMFYSA-N	441.554	1.814	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)Nc2ccc(N3CCNC(=O)C3)c(Cl)c2)c1	776466976	DICZINGSECXYSG-UHFFFAOYSA-N	437.909	1.828	50	20	IDGD	
O=C(Cn1cnc2ccccc21)NNC(=O)[C@]1(F)CCN(C(=O)OCc2ccccc2)C1	776966942	YVAGLHZPQAGUJK-QFIPXVFZSA-N	439.447	1.935	50	20	IDGD	
CC(=O)c1cc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c(C)nc1C	777111732	GGLDESIMSNUYET-GOSISDBHSA-N	427.413	1.045	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNS(=O)(=O)c1ccc(OC(F)F)c(Cl)c1	777939383	MFEMEQOGMOBTEJ-UHFFFAOYSA-N	429.829	1.776	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)/C=C\c1ccc(I)o1	778438355	PHZYFZHFLGTAEV-ALCCZGGFSA-N	435.218	1.570	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N[C@@H](CO)CC(F)(F)F	778587571	DHHVFZCXELOXNR-WCBMZHEXSA-N	428.205	1.860	50	20	IDGD	
C[C@@H](NC(=O)OC(C)(C)C)[C@@H]1CCN(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)C1	778589697	SVNATMCKNFXUFA-UKRRQHHQSA-N	444.496	1.252	50	20	IDGD	
COc1ccc(Cn2ccc(NC(=O)C(=O)NNC(=O)c3cccc(N(C)C)c3)n2)cc1	778707217	NWPBBMSTDRMFKZ-UHFFFAOYSA-N	436.472	1.406	50	20	IDGD	
CCOCCCn1c(NNC(=O)c2cc3c(O)ncnc3cn2)nc2ccccc2c1=O	778838473	YGGZUDDLXCFKNE-UHFFFAOYSA-N	435.444	1.624	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)[C@H]2CN(Cc3nc(O)c4ccccc4n3)CCO2)c1	780792630	MSBOYCOFLHYDET-GOSISDBHSA-N	437.456	1.466	50	20	IDGD	
Cn1ncc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)c1C(F)(F)F	782116404	GLWBBTHKSDRFKB-UHFFFAOYSA-N	441.338	1.517	50	20	IDGD	
Cc1cc2cc(NC(=O)C(=O)NNC(=O)c3sc(N4CCOCC4)nc3C)ccc2[nH]1	782896528	JTJCFGYKIBQTJW-UHFFFAOYSA-N	442.501	1.478	50	20	IDGD	
CCOc1ncccc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1	783407502	CKWPWHMIJXGJOD-UHFFFAOYSA-N	432.380	1.856	50	20	IDGD	
O=C(NNc1ccc(OC(F)F)cc1)C(=O)Nc1cccc(CN2C(=O)CNC2=O)c1	784314034	ZWZHOLPNCPYNSH-UHFFFAOYSA-N	433.371	1.422	50	20	IDGD	
CCNC(=O)COc1cccc(NC(=O)C(=O)NNc2ccc(Br)cn2)c1	784342069	YVXZAFATGLUGGV-UHFFFAOYSA-N	436.266	1.441	50	20	IDGD	
O=C(NNc1ccc(OCC(F)(F)F)cc1)C(=O)Nc1cc(-n2cnnn2)ccc1F	784368262	HBBGRFRMTYOXKW-UHFFFAOYSA-N	439.329	1.824	50	20	IDGD	
COc1cc(OC)c(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)cc1F	784835203	HRGIPMBANIADNN-UHFFFAOYSA-N	447.391	1.921	50	20	IDGD	
Cn1c(C2CC2)nc2cc(NC(=O)C(=O)NNc3cccc(S(C)(=O)=O)c3)ccc21	784841828	SWMRCTSJBADFHY-UHFFFAOYSA-N	427.486	1.936	50	20	IDGD	
CN(C)c1nccc(NNC(=O)C(=O)Nc2ccc(F)cc2I)n1	784971155	TYSBQTMTHRXRAG-UHFFFAOYSA-N	444.208	1.368	50	20	IDGD	
CCNC(=O)N(C)NC(=O)Nc1cc(S(=O)(=O)N2CCCCC2)ccc1N(C)C	785834984	JEVNWJKZADQMCY-UHFFFAOYSA-N	426.543	1.625	50	20	IDGD	
Cc1ccc(NC(=O)COC(=O)/C(C#N)=C/C2CC2)cc1S(=O)(=O)N1CCOCC1	786680814	NRWUYOZJJQNZKH-MHWRWJLKSA-N	433.486	1.358	50	20	IDGD	
COc1cc(C(=O)NNc2ccccc2S(N)(=O)=O)ccc1OCC(=O)NC(C)C	788228862	QGRJIMKXCDLIQB-UHFFFAOYSA-N	436.490	1.003	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNc2c(OC)cccc2S(C)(=O)=O)c(C)cc1C	788338311	OHVAQACENPJCLR-UHFFFAOYSA-N	449.485	1.584	50	20	IDGD	
O=C(CC1CCC2(CC1)OCCO2)N1CCN(S(=O)(=O)CBr)CC1	788526546	VNUCHCYRAMTEDX-UHFFFAOYSA-N	425.345	1.136	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)[C@@H](c2cnn(C)c2)N(C)C(=O)OC(C)(C)C)cc1	788632979	WULBPYYSOQUGOA-GOSISDBHSA-N	446.508	1.596	50	20	IDGD	
COC(=O)CCNC(=O)c1ccc(NC(=O)C(=O)NNc2cccc(F)c2[N+](=O)[O-])cc1	790999074	WBTJEZCFBFLHKI-UHFFFAOYSA-N	447.379	1.109	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)[C@@H]2COCCN2C2CCCC2)cc1	792788111	WJZHNRMDGDFYSC-SFHVURJKSA-N	444.561	1.512	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)ccc1O)C(=O)Nc1cnc(CC2CC2)nc1	793024507	FLCJHJZADXGHPN-UHFFFAOYSA-N	434.250	1.297	50	20	IDGD	
O=C(Cc1ccccn1)NNC(=O)C(=O)Nc1ccc2c(c1)N(CC(F)F)CCS2	793027128	VLIQCJFEVKTXNR-UHFFFAOYSA-N	435.456	1.587	50	20	IDGD	
CC(C)(C)c1ccc(NC(=O)C(=O)NNC(=O)CNC(=O)c2cccs2)cc1[N+](=O)[O-]	793038700	HESUMFFBGNJVBB-UHFFFAOYSA-N	447.473	1.470	50	20	IDGD	
O=C(NNC(=O)c1cccc2ncccc12)Nc1cc(S(=O)(=O)N2CCCC2)ccn1	797674062	PDCKYESTZJVYOC-UHFFFAOYSA-N	440.485	1.881	50	20	IDGD	
Cc1cc(O[C@H]2CCN(C)C2=O)ccc1NC(=O)C(=O)NNC(=O)c1cccc(Cl)c1	799256943	BTPAZCSEOYBXHF-KRWDZBQOSA-N	444.875	1.658	50	20	IDGD	
CCc1cccc(C)c1NNC(=O)C(=O)Nc1cc(S(=O)(=O)N(C)C)ccc1OC	799843072	LVNOSACBNANAMH-UHFFFAOYSA-N	434.518	1.898	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)N[C@H](Cn2ccccc2=O)c2ccccc2)cc1	800764093	YJEIRDKRMDNHMX-HXUWFJFHSA-N	431.452	1.871	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@@H](C)CNC(=O)OC(C)(C)C)CC2)cc1	802762379	DNWWBRIJYIJEJZ-SFHVURJKSA-N	447.580	1.421	50	20	IDGD	
CCCN(NC(=O)CCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1)C(=O)OC(C)(C)C	804591949	PUWVLQBBEKBXNM-UHFFFAOYSA-N	430.483	1.942	50	20	IDGD	
CN(C)S(=O)(=O)C[C@H](NC(=O)NNC(=O)NCc1ccc(Cl)cc1)C(F)(F)F	805766672	BCHADWHCUJYCIF-NSHDSACASA-N	445.851	1.176	50	20	IDGD	
Cn1cc(C=NNC(=O)c2cn(-c3ccccc3)nc2-c2ccccc2)c(=O)n(C)c1=O	807184770	WXGCXFCQNJSIGC-UHFFFAOYSA-N	428.452	1.701	50	20	IDGD	
Cn1c(=O)n(C)c2cc(N3CCCCC3)c(NC(=O)C(=O)NNc3ncccc3F)cc21	807301018	QOKMYASOHPIKSR-UHFFFAOYSA-N	441.467	1.483	50	20	IDGD	
CCC(CC)NC(=O)[C@H]1CN(C(=O)C(=O)NNc2ncccc2F)c2ccccc2O1	807301649	FIVFUPVNDWFMQK-QGZVFWFLSA-N	429.452	1.763	50	20	IDGD	
COc1ccc(Br)c(NC(=O)C(=O)NNc2ccc(-n3ccnc3)nn2)c1	807429630	SVIRPEXEEULKJP-UHFFFAOYSA-N	432.238	1.515	50	20	IDGD	
CC(=O)N1CCN(c2cccc(NC(=O)C(=O)NNc3nccnc3C3CCC3)c2)CC1	807462145	LXKKJHVGMPPOBO-UHFFFAOYSA-N	437.504	1.494	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)Nc2ccc3c(c2)C(=O)N(CC2CC2)C3=O)cc1	808831414	BSPCLWWFVIEOQA-UHFFFAOYSA-N	438.440	1.933	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)[C@@H]2C[C@@H](c3ccccc3)OC2=O)c2ccccc2c1=O	809545729	IETYNPNUZIOCSY-ROUUACIJSA-N	434.452	1.872	50	20	IDGD	
C[C@@H]1Oc2ccccc2[C@@H]1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	812432155	VHERNMNYQRXFIU-IFXJQAMLSA-N	444.513	1.937	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2cncc(Br)c2)cc1	813033016	AKESWGWGEXYGIP-UHFFFAOYSA-N	442.295	1.176	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2cccc(OCCCC#N)c2)cc1	813033659	FEGZBYFEKZOYHA-UHFFFAOYSA-N	445.501	1.701	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NN=C(C)c2ccc(S(=O)(=O)CC(N)=O)cc2)o1	814821887	CGFWQBKLLOFIBM-UHFFFAOYSA-N	434.518	1.534	50	20	IDGD	
O=C(NNc1ncncc1F)C(=O)Nc1ccc(Cl)c(S(=O)(=O)N2CCCC2)c1	815765055	DQSGFGBPMAZKPN-UHFFFAOYSA-N	442.860	1.135	50	20	IDGD	
COc1ccc(C(=O)NNc2nc3ccccc3n2C)cc1S(=O)(=O)N1CCOCC1	816577766	ZIFLLOGPBPOENH-UHFFFAOYSA-N	445.501	1.360	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNS(=O)(=O)c2ccc3c(c2)C(=O)N(C)C3=O)cc1	861556824	RBYKSUXPLWBJCY-UHFFFAOYSA-N	445.497	1.961	50	20	IDGD	
COc1cccc([C@@]2(C)NC(=O)N(NC(=O)/C(C#N)=C/c3cc(C#N)n(C)c3C)C2=O)c1	863708989	VXEUXTZKYSNQOR-URWPNFCTSA-N	432.440	1.619	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)c2ccc(C)c(NS(C)(=O)=O)c2)cc1	906471300	RUVXHXUFTLLMEA-CQSZACIVSA-N	435.502	1.994	50	20	IDGD	
C[C@@H](NC(=O)c1ccc(Cl)cc1)C(=O)NNC(=O)c1csc(N2CCOCC2)n1	912852210	QZMPZEYRIOAOJU-LLVKDONJSA-N	437.909	1.213	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)CCc2ccc(S(=O)(=O)NC3CC3)cc2)c1	913464866	BKMKFWHRXQHUAD-UHFFFAOYSA-N	431.514	1.595	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(F)c(C(=O)OCC(=O)NNC(=O)c2ccccc2)c1	914939276	DEOAPFMGNSJGGZ-UHFFFAOYSA-N	437.449	1.130	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2ccc(C(=O)N3CCCC3)cc2)c1	916252573	DOXLJYRSOCTLPT-UHFFFAOYSA-N	444.513	1.470	50	20	IDGD	
Cn1ccnc1[C@@](O)(CCNC(=O)NNC(=O)c1ccc2ccccc2n1)C(F)(F)F	916381796	UEJGRVGKNQHLTO-SFHVURJKSA-N	436.394	1.753	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NC[C@H](C)N2CCC[C@H](C)C2)nc1	916450227	HNYBOPLFWQPCMY-HOTGVXAUSA-N	426.587	1.859	50	20	IDGD	
COC[C@@H](C)n1c(C)cc(/C=C(/C#N)C(=O)NS(=O)(=O)c2cc(C(N)=O)n(C)c2)c1C	916789275	RKOQHNFHRALDGY-YSTIZTGUSA-N	447.517	1.162	50	20	IDGD	
Cc1nn([C@H]2CCS(=O)(=O)C2)c(C)c1C=NNC(=O)c1nn(-c2ccccc2)cc1O	917028475	WVMHYLNMFIWUSL-INIZCTEOSA-N	442.501	1.515	50	20	IDGD	
CCc1ccccc1OCC(=O)NNS(=O)(=O)c1cc(S(C)(=O)=O)ccc1C	917719317	DRUSCYRLQQCAJA-UHFFFAOYSA-N	426.516	1.349	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NN=Cc2ccc(S(C)(=O)=O)cc2)c1	918150677	FBMHMCLTQBMBLD-UHFFFAOYSA-N	437.543	1.885	50	20	IDGD	
C[C@@]1(NNC(=O)NCc2ccc(OCCOc3ccccc3)nc2)CCS(=O)(=O)C1	918222515	WNEOSDGJFWAUCH-HXUWFJFHSA-N	434.518	1.420	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C2CCN(S(=O)(=O)c3ccc(C#N)cc3)CC2)c(O)c1	918337371	JYIXOZCSMMXQQS-UHFFFAOYSA-N	442.497	1.434	50	20	IDGD	
Cn1cccc1C(=O)N1CCN(C(=O)NNC(=O)c2ccc(Br)s2)CC1	918778651	LEPYRKUAGFATJA-UHFFFAOYSA-N	440.323	1.662	50	20	IDGD	
O=C(CSCc1ccc(Br)cc1)NNC(=O)N[C@H]1CCS(=O)(=O)C1	919886873	XCHGHKIYRIPOIC-LBPRGKRZSA-N	436.353	1.200	50	20	IDGD	
CC(C)(C)c1cc(NC(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)n(-c2ccc(F)cc2)n1	920933310	SUKJYJIJEQGNHI-GFCCVEGCSA-N	437.497	1.896	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCC[C@H](C(=O)NNC(=O)c2ccccc2F)C1)c1ccccc1F	921273273	GTVJCSRRRAKOCV-KBPBESRZSA-N	444.438	1.993	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@H](Cc2ccccc2)NC(=O)c2cccnc2)cc1OC	921299128	IDEHCLDTPLMZMB-IBGZPJMESA-N	448.479	1.901	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)CNC(C)(C)C)c2)cc1	1338411041	FFDCFTRZNBHLNW-UHFFFAOYSA-N	434.518	1.645	50	20	IDGD	
Cn1cnnc1SCC(=O)Nc1cccc(C(=O)NNC(=S)Nc2ccccn2)c1	1348983959	BQRORYWQSBWUNG-UHFFFAOYSA-N	442.530	1.572	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2n[nH]c3c2CC[C@@H]3C)C1	1778603769	AAMJBROVVKZFJT-WRUKREGBSA-N	438.956	1.841	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)C(=O)Nc3cccnc3)C2)C1	1779204132	AXTHMAIVDNAKQB-QZTJIDSGSA-N	429.304	1.086	50	20	IDGD	
COC(=O)CSCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CO[Si](C)(C)C)C1	1779539845	MXAJULDOXQDLAA-DNVCBOLYSA-N	446.642	1.258	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1nnc3cc(C)nn3c1C)C2	1780702758	RJMVZLPJXVWLPA-WHSLLNHNSA-N	448.955	1.886	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cc(Cl)c4nncn4c3)CCO2)C1	1781222151	WYNHBYFPCVOQCW-FZKQIMNGSA-N	426.304	1.844	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@](C)(Cl)CCl)C3)C2)o1	1781229534	FTNWRBSEGBRVRQ-MSOLQXFVSA-N	432.304	1.918	50	20	IDGD	
Cc1cc(CCC(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](F)Br)C3)C2)ccn1	1781325628	GJIIWPBNKOTTMO-WMZOPIPTSA-N	428.302	1.843	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](F)Br)C3)C2)nc2nccn12	1781334127	VKENBGWXCUSBBO-GUYCJALGSA-N	440.273	1.172	50	20	IDGD	
COc1cccc(CC(=O)N2CCO[C@]3(CCN(C(=O)[C@H](C)Br)C3)C2)n1	1783530383	XDFWWEFZQTVBEU-SCLBCKFNSA-N	426.311	1.246	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H]3CCc4nc[nH]c4C3)C2)C1	1784353701	ZHIKGMDBRVYURB-JCGVRSQUSA-N	425.327	1.128	50	20	IDGD	
CC1CCN(CC(=O)Nc2ccc(C3(NC(=O)c4cccc(B(O)O)c4)CCC3)cc2)CC1	1786270337	IMXFBFQHMMVLJH-UHFFFAOYSA-N	449.360	1.846	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1ccc2occc2c1	1788012072	XOKOPGCIGMAJIG-VCOUNFBDSA-N	448.284	1.020	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cncnc3C)[C@H]2C1	1788972023	XIZPVTXRCSZQBG-HNKHHVNMSA-N	425.327	1.552	50	20	IDGD	
COCc1c[nH]c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)CBr)C[C@@H]32)c1	1789208360	YXELXKQCDRMGQJ-QEWYBTABSA-N	442.354	1.785	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]3C2)c(O)c1	1789927045	OKDZYOCNQRERSL-MZGVZZPPSA-N	429.286	1.984	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)NC(=O)OC(C)(C)C)C[C@@H]21	1791250007	VSHXUGXMTVFPRI-GVRJEKJASA-N	447.960	1.133	50	20	IDGD	
Cn1cc2cc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]4C3)ccc2n1	1791296778	JRDGFAQPWKRTLI-NOLJZWGESA-N	425.316	1.970	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC1(c2ccc(NC(=O)CSCC(=O)O)cc2)CCC1	1791614031	HSQDBLAYJKPISN-UHFFFAOYSA-N	436.534	1.311	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)NC(=O)c3ccccc3)[C@H]2C1	1792249737	CBPGHWRFJFDLKP-GBBGEASQSA-N	435.952	1.802	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1CCC(CO)CC1	1793852556	NOLREYILIAODPZ-QUPNRYDCSA-N	431.371	1.406	50	20	IDGD	
Cc1c(Cl)cccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1	1796185701	IKHCHXOPJQIUDL-BCDXTJNWSA-N	426.709	1.894	50	20	IDGD	
COCCn1nccc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](C)CBr)C2	1797054631	ZPPRJIVWNCTZLL-APIJFGDWSA-N	427.343	1.812	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cn(C)c2ncccc12	1797574239	QVZMCSOSJUCDNC-VWPFQQQWSA-N	449.349	1.808	50	20	IDGD	
COC(=O)NCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O	1799221855	UFLJUQOPPCFRLN-BTTYYORXSA-N	448.432	1.128	50	20	IDGD	
Cc1ccc(C(=O)C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Br)cc1	1799346488	AJCYZSWFEPPMLB-FQLMCAECSA-N	427.270	1.458	50	20	IDGD	
CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2	1799798121	OXJXIPNNIHVZAH-QHBPRCKVSA-N	445.303	1.668	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1c(C)noc1C)C2	1800640036	HBPDQLBAOWYFIR-KPEUIFRASA-N	442.354	1.987	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(C)c(NC(C)=O)c1)C2	1800976888	CMCKBZUQQAWAFS-ZMMAXQRCSA-N	437.924	1.410	50	20	IDGD	
O=C(CN1CCSCC1)NC[C@H]1CCN(C(=O)C(Cl)Cl)[C@@H]1c1cccnc1	1802448986	MUIAZQQQPDNMSQ-GDBMZVCRSA-N	431.389	1.940	50	20	IDGD	
C=C(Oc1ccccc1O)C(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1	1803139678	SWGMZNZZUTXBCG-KPFFTGBYSA-N	445.903	1.985	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc(CO)c(F)c2)[C@@H]1c1cccnc1)[C@H](O)CCl	1803146782	CZAWOSYBJATMAH-KFKAGJAMSA-N	435.883	1.632	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)CCS(C)(=O)=O)[C@H]1c1cccnc1	1803693862	AFHUFMLTYWIPNL-RYRKJORJSA-N	429.970	1.930	50	20	IDGD	
COc1c(Cl)cccc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCC(=O)NN(C)C)C2	1803762717	OVMCCMFUNFAOJH-QDMKHBRRSA-N	436.940	1.973	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC2(CCCN(C(=O)Cc3ccc(C#N)cc3)C2)CC1	1804946470	CFDKPUVPUGDNIZ-UHFFFAOYSA-N	439.560	1.705	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)CNCP(=O)(O)O)[C@H]1c1cccnc1	1807024189	MHUWLHUWJCMLMP-HLLBOEOZSA-N	446.872	1.220	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cccn3c(O)nnc23)[C@@H]1c1cccnc1)[C@@H](F)Cl	1808308178	BOFZFTYNYRSMDY-NWANDNLSSA-N	432.843	1.684	50	20	IDGD	
O=C1C[C@H](C(=O)N2CC[C@H](CNC(=O)[C@H](F)Br)[C@H]2c2cccnc2)CCN1	1808678633	MDSUKHKSTQZCSS-CUBALJKWSA-N	441.301	1.304	50	20	IDGD	
COC(=O)NCC(=O)N1CC[C@H](CNC(=O)[C@@H](F)Br)[C@H]1c1cccnc1	1808680111	HVKFMUDECPPKCL-MRVWCRGKSA-N	431.262	1.134	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)CN2CCN(C)CC2)[C@H]1c1cccnc1	1809598328	JNPYOIYNCZUUCJ-SVFBPWRDSA-N	436.000	1.742	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@H]1CCN(C(=O)CCN2CCOC2=O)[C@@H]1c1cccnc1	1810546039	LIJRYBDBAXCUOM-YLJYHZDGSA-N	448.596	1.781	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)CNC(=S)NCC)[C@@H]1c1cccnc1	1812328679	JFPQISDQGHTEMV-RYRKJORJSA-N	440.013	1.979	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2cc(C(C)=O)[nH]n2)[C@@H]1c1cccnc1	1813029273	HDMJCZWOUXZPFB-RVKKMQEKSA-N	433.896	1.581	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H]1C[C@@H]1C1CC1)CC2)c1ccc(B(O)O)cc1	1815335823	SVULANUYSJUHKY-BZUAXINKSA-N	425.319	1.095	50	20	IDGD	
CCc1cc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)n[nH]1	1817705911	FQCDRTVVCCQIOF-MRXNPFEDSA-N	430.513	1.374	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)C2=NNC(=O)C2)n[nH]1	1819338572	RMZAKSHHMVKCQZ-JOYOIKCWSA-N	425.287	1.309	50	20	IDGD	
CC(C)O[C@@H](C)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1	1819798120	WNZOEVFQVHFMDA-NWDGAFQWSA-N	446.533	1.181	50	20	IDGD	
COc1cc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@H](F)Br)CC3)nn1C	1821771850	DWKCNUASEYMGES-KRTXAFLBSA-N	446.302	1.802	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](Cl)COC)n[nH]1	1822371068	RDANAKZWAZNXKD-BZPMIXESSA-N	428.921	1.363	50	20	IDGD	
Cc1nc(C)c(C(=O)N2CCCC[C@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)o1	1822414400	DSLAEBSCJUZIKW-HNNXBMFYSA-N	431.497	1.693	50	20	IDGD	
COc1cnc(C(=O)N[C@H]2CCc3nc(NC(=O)[C@H](F)Br)sc3C2)cn1	1823003131	IUBXFDXVZRTDCI-MADCSZMMSA-N	444.286	1.858	50	20	IDGD	
CC[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H]1CCC(=O)N1)CC2	1825445251	QORJBGJQLPWDAA-KKZNHRDASA-N	429.340	1.507	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(O)nn1)CC2	1825637396	ZDYDGJIJDCWCQK-HTQZYQBOSA-N	426.296	1.648	50	20	IDGD	
CCn1nc(C(=O)N[C@@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)cc1C	1826088236	VJOHUIRCTJIJRO-CYBMUJFWSA-N	447.565	1.267	50	20	IDGD	
COc1cnc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)c(F)c1	1830357696	DRYDZBTWQHGEBC-HXUWFJFHSA-N	443.903	1.564	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)CC[C@H]3CCOC3)C2)C1	1830544999	DLAWPARHIRXPSS-GJYPPUQNSA-N	447.370	1.291	50	20	IDGD	
Cc1cccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)n1	1830921204	LQOPGJSEWJEBKF-VQTJNVASSA-N	444.359	1.625	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CN2CCN(C)CC2)CC1	1831655322	NRIPBBOGCCONFO-SJLPKXTDSA-N	443.430	1.637	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CN2CCSCC2)CC1	1831827426	XOUVIIGIPPJQJK-ROUUACIJSA-N	432.030	1.909	50	20	IDGD	
COc1cc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)nn1C	1831874384	OAXMTYIAGGEFFN-SFHVURJKSA-N	448.568	1.035	50	20	IDGD	
Cc1nnc(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)s1	1833022831	BFDRTJSDESXYLF-INIZCTEOSA-N	437.349	1.039	50	20	IDGD	
CC[C@H](NC(C)=O)C(=O)N1CCC(N2CCC(NC(=O)C(C)(C)CCl)CC2)CC1	1833214001	OZIKFTQXHDPBEF-SFHVURJKSA-N	429.005	1.738	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H]3CCc4ccccc4O3)CC2)CC1)[C@@H](O)CCl	1833312960	NMQZQOIRPKIHBP-PZJWPPBQSA-N	449.979	1.552	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnn(C(C)(C)C)c3)CCO2)C1	1833450195	ABOXNDQYRQDNHI-NRFANRHFSA-N	440.972	1.973	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccn3C)CCO2)C1	1833911727	HUNIJAGLAUPUFK-KSSFIOAISA-N	428.327	1.269	50	20	IDGD	
Cc1cc(CC(=O)N2CCC(N3CCC(NC(=O)CCBr)CC3)CC2)no1	1834423333	GXJVZZIKWNHXHJ-UHFFFAOYSA-N	441.370	1.882	50	20	IDGD	
CCOCC(=O)N1CCO[C@]2(COCCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1	1834989627	ZPUJORWDDYZXHX-CQTHNFAISA-N	449.454	1.365	50	20	IDGD	
O=C(COC(=O)C(F)(F)F)NC1CCN(C2CCN(C(=O)[C@@H](F)Cl)CC2)CC1	1835687295	MFNHHJGKALKJMC-CYBMUJFWSA-N	431.814	1.198	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)NC1CCN(C2CCN(C(=O)[C@H](Cl)CC)CC2)CC1	1835709006	NOQTWKHOJFVITG-RHSMWYFYSA-N	429.993	1.283	50	20	IDGD	
C[C@@H](C(=O)N1CCC(OC2CCN(C(=O)C(C)(C)CCl)CC2)CC1)n1cnnn1	1836625050	HLGWDFUSKMMFQS-AWEZNQCLSA-N	426.949	1.498	50	20	IDGD	
COc1ccnc(C(=O)N2CCC(OC3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)c1	1836718520	QPWMTNRJQKWGDS-SFHVURJKSA-N	425.913	1.302	50	20	IDGD	
C[C@@H](Cc1ccccn1)C(=O)N1CCOC[C@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1837717802	ONJKGZAGYWFMCS-AVRDEDQJSA-N	449.624	1.568	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)CCc3nc(N)n[nH]3)CC2)CC1	1838367189	TWYRHFIQPFBSLQ-HNNXBMFYSA-N	426.949	1.336	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3c(F)cccc3F)CCO2)C1	1838996601	VUDHESUZYPCTEE-FOIQADDNSA-N	446.878	1.218	50	20	IDGD	
CCc1noc(C)c1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2	1839153812	SMRFBHSOWCHENN-RBUKOAKNSA-N	448.347	1.852	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)cn1	1839197973	OEPYNZWVZFKRHV-RHSMWYFYSA-N	430.274	1.151	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)ccc1O	1839307951	BWJQUAWRBFEOIY-NRFANRHFSA-N	436.581	1.622	50	20	IDGD	
COC(=O)C12CC(C(=O)N3CCO[C@]4(COCCN(C(=O)C(C)(C)CCl)C4)C3)(C1)C2	1840004940	XDLXPKMPHNQZQR-CBNMVNINSA-N	442.940	1.051	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(C=O)s3)C2)C1	1840032471	ZFJIRHNWWZMILD-PXAZEXFGSA-N	445.335	1.414	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3(C(F)(F)F)CC3)C2)C1	1840033893	UKZUQSJEFVPMDL-RISCZKNCSA-N	443.260	1.569	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)C3Cc4ccccc4C3)C2)C1	1840155860	DZDSSMMILUKRHI-KNQAVFIVSA-N	436.936	1.112	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(CN(C(=O)CCCc3cccnc3)CCO2)C1	1840511768	LDKQNTQUBWHAEM-QFIPXVFZSA-N	449.624	1.712	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H](C(=O)N2CC3(CCCN3C(=O)[C@@H](O)CCl)C2)[C@@H](F)C1	1841348693	YVLPVPMXELYYJB-ILXRZTDVSA-N	447.935	1.385	50	20	IDGD	
COc1ccc(CCC(=O)N2CCCC23CN(C(=O)CCC(=O)NN(C)C)C3)cc1OC	1841783928	ZRKZQKXFRMFUFI-UHFFFAOYSA-N	446.548	1.213	50	20	IDGD	
CC(C)n1nc(C(=O)N2CCCC23CN(C(=O)CCBr)C3)cc1C(=O)O	1842260104	HHEYJDMGYPNSMK-UHFFFAOYSA-N	427.299	1.764	50	20	IDGD	
CC(C)n1nc(C(=O)N2CCCC23CN(C(=O)[C@H](F)Br)C3)cc1C(=O)O	1842261058	PGFTWLXZYAYLOV-LBPRGKRZSA-N	431.262	1.670	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)C(Cl)(Cl)Cl)C2	1843416798	BLKRNSOABRPBEV-UFFVCSGVSA-N	434.711	1.694	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)[C@@H]1CCc3ccccc3O1)C2	1843416840	HEOITFWGWIIOEE-NTRYICDMSA-N	449.511	1.718	50	20	IDGD	
Cc1ccc(C(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)c(Cl)c1	1844265485	IGPNLINEBVNBDJ-UHFFFAOYSA-N	427.892	1.778	50	20	IDGD	
Cc1ccc(=O)n(C(C)(C)C(=O)N2CCCC23CN(C(=O)[C@](C)(Cl)CCl)C3)n1	1844354512	RGMAUMZRFOEKFE-GOSISDBHSA-N	429.348	1.727	50	20	IDGD	
C[C@@H](Cc1ccc(F)cc1)C(=O)N1CCCC12CN(C(=O)c1cnccc1C(=O)NN)C2	1845900081	BYBGIMHPVRJTDD-HNNXBMFYSA-N	439.491	1.520	50	20	IDGD	
CC(=O)NCCC(=O)N1CC2(CCCN2C(=O)[C@H](Br)Cc2ccccc2)C1	1845942607	QKYXNAKQFURAFH-QGZVFWFLSA-N	436.350	1.722	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@H]1C[C@H](NC(=O)OC(C)(C)C)C1)C2	1846365810	WYQGWRKHBBEYLR-KKUMJFAQSA-N	429.945	1.747	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)c1ccc(N3CCCCC3)cc1)C2	1846385737	PNYXTYBFOKSDJJ-UHFFFAOYSA-N	441.576	1.867	50	20	IDGD	
COc1ccc([C@H]2C[C@H]2C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)CCC(=O)NN(C)C)cc1	1847775264	KMZYGCMHZWGLQN-ZRNYENFQSA-N	428.533	1.374	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](CC(N)=O)NC(=O)OC(C)(C)C	1847871818	LUCOBWVTTJJHMD-QPSCCSFWSA-N	444.960	1.364	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	3613942	WDYDIQIRJJXUGO-UHFFFAOYSA-N	435.477	1.840	50	20	IDGD	
CCn1c(NNC(=O)CCNS(=O)(=O)c2cccc(Cl)c2)nc2ccccc2c1=O	11163704	JOAHJZSIYXTQTR-UHFFFAOYSA-N	449.920	1.882	50	20	IDGD	
Cc1nc(C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)nn1-c1ccc(F)cc1	16398101	SRHUVXPYYZEISS-UHFFFAOYSA-N	442.363	1.241	50	20	IDGD	
O=C(NC[C@@H](O)c1ccc(Cl)cc1)NNC(=O)c1csc(N2CCOCC2)n1	29334811	XQYNDJOJCWTCIL-CQSZACIVSA-N	425.898	1.311	50	20	IDGD	
CN1C(=C(C#N)C(=O)COC(=O)Cn2nc(-c3ccccc3)oc2=O)N(C)c2ccccc21	115599721	LHEJZRRQYBCLEJ-UHFFFAOYSA-N	445.435	1.937	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)[C@@H]1CCCN(C(=O)Nc2ccccc2F)C1	725741955	XFMZGFAZVOXDFF-CYBMUJFWSA-N	431.424	1.240	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NCc1ccccc1OCC(F)(F)F	725873687	PARVHANNRNMGRL-UHFFFAOYSA-N	430.408	1.950	50	20	IDGD	
COc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NNC(=O)c2cccc(OC(F)F)c2)cc1	728544409	AQUULAMNUTWSKZ-NSHDSACASA-N	443.428	1.425	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)c2cc(F)ccc2Br)cc1S(N)(=O)=O	728612614	WQYZMGQFNPWUAL-UHFFFAOYSA-N	430.255	1.619	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)NCc2ccc(S(=O)(=O)N3CCCCC3)cc2)c1	728942270	NTRPNAQHVHGCES-UHFFFAOYSA-N	441.513	1.877	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)NCCNC(=O)c2ccc(Br)cc2)c1	728953003	KIHTVXZADLFFLM-UHFFFAOYSA-N	430.262	1.695	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNS(=O)(=O)c2cc(F)c(F)cc2F)ccc1Cl	729837500	UFXZCSMNGIZHAW-UHFFFAOYSA-N	443.812	1.028	50	20	IDGD	
CCCn1nc(C(=O)NNS(=O)(=O)c2ccc3c(c2)C[C@@H](C)O3)c2ccccc2c1=O	729964644	KAOJHXARMOLQSX-CYBMUJFWSA-N	442.497	1.753	50	20	IDGD	
Cc1ccc(Cn2nc(C)c(CCC(=O)NNC(=O)CNC(=O)c3ccco3)c2C)cc1	730178336	FPGNVVDSSNRZEM-UHFFFAOYSA-N	437.500	1.960	50	20	IDGD	
O=C(CC[C@H]1NC(=O)N(c2ccc(Cl)c(Cl)c2)C1=O)NNC(=O)NCC1CC1	730531808	BAUBTLJIZRVUOH-CYBMUJFWSA-N	428.276	1.939	50	20	IDGD	
CCOc1cc(C=NNC(=O)CSc2nnc(O)nc2O)cc(Br)c1O	730559265	BSLSHHSDXFMDLO-UHFFFAOYSA-N	444.267	1.392	50	20	IDGD	
O=C(CNc1ccccc1)NNC(=O)[C@@H]1CCCN(S(=O)(=O)Cc2ccccc2)C1	730585751	MMWQOYVJQVHNOE-GOSISDBHSA-N	430.530	1.488	50	20	IDGD	
CC(C)COc1cn(-c2ccccc2)nc1C(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1	730774476	UEJYPIQIIDKFBE-CQSZACIVSA-N	435.506	1.038	50	20	IDGD	
CC[C@@H](C)C(=O)N1Cc2ccccc2C[C@H]1C(=O)NNC(=O)COc1ccccc1O	730781228	IHSQJEVZVDBXSI-QAPCUYQASA-N	425.485	1.918	50	20	IDGD	
CC(CCN1C(=O)c2ccccc2C1=O)=NNC(=O)Cc1csc(N2CCOCC2)n1	730947121	DGWIQRBDFROHPS-UHFFFAOYSA-N	441.513	1.701	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@H]2CC(=O)N(C3CCC(C)CC3)C2)cc(OC)c1OC	731327477	YATHJHQGTQCAGZ-SIWZUTFBSA-N	433.505	1.901	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)CN1C(=O)COc2cc(Br)ccc21	731491476	MLFNXALNPHKRHI-UHFFFAOYSA-N	434.246	1.644	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)CC[C@H]1NC(=O)N(c2ccc(Cl)c(Cl)c2)C1=O	732084307	YBGUWNPOHFPUAC-CYBMUJFWSA-N	439.259	1.691	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2ccc(NS(C)(=O)=O)cc2)cc1Br	732175620	MMYIIXGPSWASFV-UHFFFAOYSA-N	442.291	1.904	50	20	IDGD	
Cc1nn(-c2ccccc2)c2sc(C(=O)NNC(=O)NC[C@H]3CN(C)CCN3C)cc12	732475249	ZAIBKPKMAPKMPH-INIZCTEOSA-N	441.561	1.585	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)[C@@H]1CCCCN1S(C)(=O)=O	734250898	OORNYKZAPPDFKB-AWEZNQCLSA-N	432.568	1.021	50	20	IDGD	
C[C@@H](CN1C[C@@H](C)O[C@H](C)C1)C(=O)NN=Cc1ccccc1OCC(=O)NCC1CC1	734746583	ZUIUPJVPCMDNOK-RCCFBDPRSA-N	430.549	1.787	50	20	IDGD	
Cc1cc(C)n2nc(C)c(C(=O)NNC(=O)NC3CCN(C(=O)OC(C)(C)C)CC3)c2n1	734821146	HEKZVEFUWVWZTM-UHFFFAOYSA-N	445.524	1.998	50	20	IDGD	
CC(C)C(=O)N1CCC(C(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)CC1	734825655	LHHVHYPDUPLOCZ-UHFFFAOYSA-N	439.557	1.611	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)CN2C(=O)[C@H](C)Oc3ccccc32)cc1C	736771654	SRIZDPDBEYXUFY-ZDUSSCGKSA-N	445.497	1.737	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1	737629769	XVBOZPHZXWHFMZ-CQSZACIVSA-N	432.458	1.625	50	20	IDGD	
O=C(C[C@H](C(=O)NN=C/C=C/c1ccco1)N1CCOCC1)NN=C/C=C/c1ccco1	741767188	RPYGMPFOANMKKB-UAPIVMBPSA-N	439.472	1.894	50	20	IDGD	
O=C(CCN1C(=O)[C@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O)NNC(=O)CSc1ccc(Cl)cc1	742470951	CMYTTYKIZHCPFW-OMNBBPDLSA-N	437.905	1.132	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H]1CC(=O)NNC(=O)C1CCN(c2ncccn2)CC1	742635733	XFXNXJOUSNNEBW-MRXNPFEDSA-N	432.525	1.630	50	20	IDGD	
COc1ccc(N2CCN(CCNC(=O)NNC(=O)COc3ccc(F)cc3)CC2)cc1	743363967	YVKPZSAOADWCLC-UHFFFAOYSA-N	445.495	1.366	50	20	IDGD	
CN(C)c1ccc(N2CCC(NC(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)CC2)cc1	743512042	RFPNYUCOCPVPHN-UHFFFAOYSA-N	449.519	1.341	50	20	IDGD	
CCc1nncn1CCNC(=O)NNC(=O)[C@@H](C)Oc1cccc(Br)c1	743521272	QHZPQXMAEUHCKX-LLVKDONJSA-N	425.287	1.401	50	20	IDGD	
COc1ccc(N2C[C@H](C(=O)NNC(=O)c3cc(Br)ccc3O)CC2=O)cc1	743729997	LAAINLDUEKOKLM-LLVKDONJSA-N	448.273	1.977	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1cnc(-c2ccccc2)[nH]1	744620430	DTIRQAGVSZFKPN-UHFFFAOYSA-N	427.486	1.855	50	20	IDGD	
CC(C)c1c(C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)cnn1-c1ccccn1	744700198	CRYDSIZHDHGCCM-UHFFFAOYSA-N	432.440	1.880	50	20	IDGD	
O=C(CSCc1nc(O)c2c3c(sc2n1)CCCC3)NNC(=O)N1CCOCC1	745995786	BCURWDVAUHMGOD-UHFFFAOYSA-N	437.547	1.582	50	20	IDGD	
Cc1ccc2cc(C(=O)NNC(=O)CN3CCN(C(=O)c4ccccc4)CC3)ccc2n1	746239259	BZFPIDQBWDAAAI-UHFFFAOYSA-N	431.496	1.762	50	20	IDGD	
Cc1ccc(S(=O)(=O)NC(C)(C)C)cc1C(=O)NNC(=O)Cc1cn2ccccc2n1	746549734	WVPGLHAFIAECES-UHFFFAOYSA-N	443.529	1.723	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2cccc3cccnc23)cc1	747471900	CBPNAGNSPZHWGO-UHFFFAOYSA-N	426.454	1.177	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)ccc1F	748518322	JMOCYGDGXSTPBE-UHFFFAOYSA-N	441.384	1.524	50	20	IDGD	
COc1ccc(CCC(=O)OCC(=O)NNC(=O)c2cc(Cl)ccc2OC)cc1O	748876386	XUWLCVVEASYFJW-UHFFFAOYSA-N	436.848	2.000	50	20	IDGD	
O=C(NNC(=O)c1cccc(-n2nccc2C(F)(F)F)c1)N[C@H]1CCS(=O)(=O)C1	749173081	GSNJCOOJCRCTFF-NSHDSACASA-N	431.396	1.022	50	20	IDGD	
CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)NNC(=O)c1ccc2c(c1)OCCO2	749338852	TVFOPIHKIKSXSN-SFHVURJKSA-N	440.431	1.587	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2cc(Cl)ccc2[N+](=O)[O-])cc(OC)c1OC	751267791	YWJSBWHDTUPIAU-UHFFFAOYSA-N	445.837	1.897	50	20	IDGD	
CCNS(=O)(=O)c1cccc(C(=O)NNc2nc(Br)cn3ccnc23)c1	751400929	ZYQQDURVPZFYAN-UHFFFAOYSA-N	439.295	1.547	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)NCC2(CN3CCOCC3)CCCCC2)cc1C	751809561	HRIOZONMRPVMCO-UHFFFAOYSA-N	445.564	1.855	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)c2cc(S(=O)(=O)N(C)C)ccc2N2CCCCC2)o1	752781506	TUUUHJUQURJLNS-UHFFFAOYSA-N	434.518	1.903	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)Nc2ccc(CN3CCCC3=O)cc2)c2ccccc2c1=O	755939983	OTLRLZKRVIOUGR-UHFFFAOYSA-N	434.456	1.522	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1ccc(Br)cc1C(F)(F)F	756124535	SBRCFBWUHUBCHY-LURJTMIESA-N	447.233	1.558	50	20	IDGD	
Cc1c(NC(=O)NNC(=O)c2ccc3c(c2)OCCO3)cccc1C(=O)N1CCOCC1	756184680	JTJMSFQQSFCZHD-UHFFFAOYSA-N	440.456	1.705	50	20	IDGD	
CCc1ccc(NC(=O)NNC(=O)c2cc(Br)c[nH]2)cc1S(N)(=O)=O	756523131	ALGYANNMJDCDMI-UHFFFAOYSA-N	430.284	1.454	50	20	IDGD	
COCCS(=O)(=O)c1ccc(NC(=O)NNC(=O)COc2ccccc2C#N)cc1	756555139	RZIUUYYLWZIOLE-UHFFFAOYSA-N	432.458	1.210	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@H](C)C(=O)NNC(=O)Nc1ncn(CC(=O)N(C)C)n1	756769998	HMFHIBHCQHCDDL-GFCCVEGCSA-N	437.888	1.257	50	20	IDGD	
CN(C(=O)c1ccc(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)cc1)c1ccccc1	756949856	NJMBHODKCNUBSB-MRXNPFEDSA-N	430.486	1.094	50	20	IDGD	
CN1C(=O)CC[C@@H](C(=O)NNc2ccc(C(N)=O)nn2)[C@H]1c1ccc(C(F)(F)F)cc1	757404273	OARYPLAWKHQACM-MLGOLLRUSA-N	436.394	1.647	50	20	IDGD	
COCCn1cc(C(=O)N2CCN(S(=O)(=O)CBr)CC2)c2ccccc21	758534126	CIGQVBBWQFKIAV-UHFFFAOYSA-N	444.351	1.728	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H](CCC(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)C1	758714469	ATESZCTYPLXURV-OAHLLOKOSA-N	444.488	1.900	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C(=O)Nc1ccccn1)n1nnc(-c2ccc(Cl)cc2)n1	758833835	JDHUNXSSODRSOL-CYBMUJFWSA-N	428.840	1.126	50	20	IDGD	
COCc1nc(C)c(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)s1	759230025	WAFSNVLZNJDWCP-UHFFFAOYSA-N	426.520	1.376	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)N[C@@H]2CCOC[C@H]2OCC)c2ccccc2c1=O	760127394	PHIRYZFCSHYHMA-IAGOWNOFSA-N	431.493	1.335	50	20	IDGD	
CC1(C)C(=O)N(C[C@](C)(O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c2ccccc21	760329795	QFLRUUJTCHURSM-DEOSSOPVSA-N	447.495	1.709	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)c1ccc2c(=O)n(C)c(S)nc2c1	762349402	HXYJVTUPVIQRNB-UHFFFAOYSA-N	430.511	1.784	50	20	IDGD	
CCS(=O)(=O)c1cccc(C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c1	762908239	KUGSEVWDUKJWMT-UHFFFAOYSA-N	435.414	1.006	50	20	IDGD	
COc1cc(C(C)=NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)c(OC)cc1O	763138032	HXFMEYZWENXJJV-UHFFFAOYSA-N	427.866	1.864	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NN=C(C)[C@H](C)OC)N(S(C)(=O)=O)CC2	763143053	YZUGYHSJEZEZRQ-BBRMVZONSA-N	427.523	1.480	50	20	IDGD	
CCOc1cc(C=NNC(=O)CNC(=O)c2cccnc2)ccc1O[C@H](C)C(=O)N(C)C	763192565	HOHZQYLCGHJODC-OAHLLOKOSA-N	441.488	1.216	50	20	IDGD	
Cc1nn(-c2ccc(Br)cc2)cc1C=NNC(=O)[C@@H]1CCS(=O)(=O)C1	763359553	PSIXJQMZDAGEGU-GFCCVEGCSA-N	425.308	1.828	50	20	IDGD	
CC(C)NC(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)c1	763560009	YOIAIMJGIOAYRR-UHFFFAOYSA-N	446.847	1.607	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2cc(C(=O)NC(C)C)ccc2Cl)c1	763623829	IICGGYJRKDEQJH-UHFFFAOYSA-N	446.891	1.952	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1cccc(OC[C@@H]2CCCO2)c1	763628451	KPUHBVXVMTWMQW-KRWDZBQOSA-N	437.456	1.600	50	20	IDGD	
Cc1nc(COc2ccc(NC(=O)C(=O)NNC(=O)c3c(C)nc4ccccn34)cc2)no1	763628775	MGJFDYQYMQHCJS-UHFFFAOYSA-N	449.427	1.313	50	20	IDGD	
COc1ccc(OC)c(NC(=O)C(=O)NNC(=O)COc2cccc(C(F)(F)F)c2)c1	763640229	UJXNVPQBUGZNQO-UHFFFAOYSA-N	441.362	1.888	50	20	IDGD	
COC(=O)c1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)COc1ccc(C)c(C)c1	763667049	OLUDHIYFPBNMSC-UHFFFAOYSA-N	433.848	1.908	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccc(Cl)c1N(C)C	763682965	XJFVUMBRGMXNCE-UHFFFAOYSA-N	434.880	1.970	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)C(=O)Nc1ccc(Cl)c2ncccc12	763805004	QKFBSDWVRCYDAY-UHFFFAOYSA-N	443.803	1.961	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cccnc2Br)cc1	763871704	HMILFWXRARBNRX-LLVKDONJSA-N	449.261	1.600	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cc3c(cc2Cl)OCO3)cc1	763872595	OVVNXVYFQFXJCQ-NSHDSACASA-N	447.831	1.825	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccnn2-c2ccncc2)cc1	763873826	ZFROHSVOHWLPSC-CQSZACIVSA-N	436.428	1.023	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(C)cn(C)c2=O)cc1OC	763911076	CMUXVNIEYQDNBX-UHFFFAOYSA-N	430.461	1.281	50	20	IDGD	
Cn1cnnc1-c1cccc(NC(=O)C(=O)NNC(=O)c2ccc(Br)s2)c1	763942208	XMEKRKOTDTZPGO-UHFFFAOYSA-N	449.290	1.706	50	20	IDGD	
CCn1c(=O)n(CC)c2nc(NC(=O)CCC(=O)NNC(=O)CC(F)(F)F)ccc21	763960401	ZDDUYKUZAQCAMZ-UHFFFAOYSA-N	430.387	1.056	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)Nc1cccnc1Br	764002701	QTQLQHYCVAEQQY-UHFFFAOYSA-N	445.071	1.345	50	20	IDGD	
COC(=O)[C@@H]1CN(C(=O)C(=O)NNC(=O)c2ccc(Cl)cc2OC)c2ccccc2O1	764011296	GCSMYWKTJMLUQR-INIZCTEOSA-N	447.831	1.077	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2cccc(COCC3CC3)c2)c1	764077248	KDWQPCHXUZJYMJ-UHFFFAOYSA-N	445.497	1.416	50	20	IDGD	
CCCS(=O)(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(C)cc2O)c1C	764111071	NADOLBHMJNFRRK-UHFFFAOYSA-N	448.501	1.560	50	20	IDGD	
CN(Cc1cccc(NC(=O)C(=O)NNC(=O)CC(F)(F)F)c1)Cc1cscn1	764114509	CRVWOOZPERRVLQ-UHFFFAOYSA-N	429.424	1.813	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2cc(C(=O)N(C)C)ccc2OC)cc1	764126113	FLHOCCMKLUQQRA-UHFFFAOYSA-N	442.472	1.124	50	20	IDGD	
Cc1cccc(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)c1C(=O)N1CCCC1	764153569	LVWDWEMYFDXIMF-SFHVURJKSA-N	436.468	1.321	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccnc(OCC(F)(F)C(F)F)c2)c1	764236111	VUIQKDFETWSLKH-UHFFFAOYSA-N	439.325	1.632	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)C(=O)Nc1cccc(N2CCCC2)c1	764260273	ODOBEENYGRVMHP-UHFFFAOYSA-N	437.504	1.079	50	20	IDGD	
CN(C)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)cc1Cl	764349134	JQXGSWORPDUWPB-UHFFFAOYSA-N	439.255	1.801	50	20	IDGD	
C[C@H]1CN(c2ccccc2NC(=O)C(=O)NNC(=O)COCc2ccccc2)C[C@@H](C)O1	764366146	KHJCXHGCPFAFNT-CALCHBBNSA-N	440.500	1.603	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(CC(=O)N3CCSCC3)cc2)o1	764369554	HOGGMIHILLWEBO-UHFFFAOYSA-N	430.486	1.106	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(-c2cn3cccc(C)c3n2)cc1	764398318	FBYMWZNJKBAXSR-HNNXBMFYSA-N	439.472	1.447	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1cnn(-c2ccc(C(F)(F)F)cc2)c1	764400430	PVYXIISSGBMRMQ-LLVKDONJSA-N	443.382	1.029	50	20	IDGD	
O=C(Cc1ccccc1C(F)(F)F)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765731970	DKTJWEJATQQKLH-UHFFFAOYSA-N	448.445	1.853	50	20	IDGD	
CC(=O)c1cc(C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)n(C)c1	766664978	ZSPLXBLFLVHFSA-UHFFFAOYSA-N	431.924	1.460	50	20	IDGD	
COCCN(CCNC(=O)NNC(=O)c1c(C)nc2ccccn12)C(=O)OC(C)(C)C	767186774	DBKYLTPMIVDXDH-UHFFFAOYSA-N	434.497	1.470	50	20	IDGD	
O=C(NNC(=O)c1cccc2ncccc12)c1ccc(N2C(=O)CCC2=O)c([N+](=O)[O-])c1	767883932	BQTBRLXDPBUWJQ-UHFFFAOYSA-N	433.380	1.871	50	20	IDGD	
CC1(C)C(=O)Nc2ccc(C(=O)NNc3ccccc3S(=O)(=O)N3CCOCC3)cc21	769149538	BWRWNEBINWDXEX-UHFFFAOYSA-N	444.513	1.694	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2sc3nc4n(c(=O)c3c2C)CCC4)cc1C	769695612	ZHDSSKWWDCEHDK-UHFFFAOYSA-N	439.497	1.729	50	20	IDGD	
CSCCNC(=S)NNC(=O)CN1C(=O)N[C@@](C)(c2ccc(F)c(Cl)c2)C1=O	770255135	VWTKWHYFNRXSMC-INIZCTEOSA-N	447.945	1.104	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)NCCNC(=O)Cc3cccc(F)c3)nc21	770368726	MUUFSGJKSLNGSK-UHFFFAOYSA-N	444.471	1.411	50	20	IDGD	
CCc1c(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cnn1-c1ccc(OC)cc1	771094331	NUKGJHRBOZQQGH-UHFFFAOYSA-N	432.444	1.494	50	20	IDGD	
C[C@@]1(c2ccc(F)c(Cl)c2)NC(=O)N(CC(=O)NNc2nccnc2Cl)C1=O	771735831	SSITYKCCYZGIFZ-INIZCTEOSA-N	427.223	1.833	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1ccc(OCC(=O)N2[C@@H](C)CCC[C@@H]2C)cc1	771853390	SSVFQOFCOLPEIQ-JYJNAYRXSA-N	433.505	1.958	50	20	IDGD	
CCCCn1ncc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c1C	772004080	LZCDLBDILRUCRR-UHFFFAOYSA-N	449.533	1.087	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)[C@H](NC(=O)c1cc(Cl)ccc1F)[C@H](C)O	772041365	KHYIRDWGKQVKEO-XMZIXOGTSA-N	445.875	1.084	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ccc3ccccc3n2)cc1S(=O)(=O)N(C)C	773654594	HWMZQTBAEJBSJW-UHFFFAOYSA-N	427.486	1.875	50	20	IDGD	
CCOC(=O)N1CCC([C@@H](C)NC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)CC1	777678107	IENYYCYTCCCYFR-CQSZACIVSA-N	444.492	1.779	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNS(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F	777939400	NBZLJTALSCHOMO-UHFFFAOYSA-N	442.372	1.448	50	20	IDGD	
C[C@H]1CCN(C(=O)OC(C)(C)C)[C@@H](C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)C1	778413180	POGNAEOLQVLOGB-WMLDXEAASA-N	444.488	1.898	50	20	IDGD	
CCC(CC)NC(=O)[C@@H]1CN(C(=O)C(=O)NNc2ncncc2Cl)c2ccccc2O1	782159416	RACYGHWGXMLIRE-INIZCTEOSA-N	446.895	1.672	50	20	IDGD	
O=C(NNc1ncc(C(F)(F)F)cc1Cl)C(=O)Nc1cc(-n2cnnn2)ccc1F	782854012	LQBFRWLCIPNZQY-UHFFFAOYSA-N	444.736	1.950	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)C(=O)Nc1ccc(F)cc1Cl	782896200	CJHGEWLZMQHOOG-UHFFFAOYSA-N	427.845	1.172	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)(F)F)cc1)C(=O)Nc1cccc([N+](=O)[O-])c1	783407974	IFEJGADNWTWJBN-UHFFFAOYSA-N	432.336	1.970	50	20	IDGD	
Cc1ccc(-n2nc(NC(=O)C(=O)NNC(=O)CNC(=O)c3cccs3)cc2C)cc1	784004978	MQIRKMGVPADWQQ-UHFFFAOYSA-N	440.485	1.067	50	20	IDGD	
NC(=O)[C@@H](Cc1ccc(F)cc1)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	784060390	HIMDFGOTDZHMQU-LJQANCHMSA-N	448.520	1.331	50	20	IDGD	
CC[C@H](C)n1nc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)cc1C	784215003	APNDUUAUAOOMDI-LBPRGKRZSA-N	434.522	1.685	50	20	IDGD	
COc1ccc(S(=O)(=O)NC2CC2)cc1NC(=O)C(=O)NNc1cccc([N+](=O)[O-])c1	784834099	VQZTXRMLLDNUDE-UHFFFAOYSA-N	449.445	1.126	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)C(=O)Nc2cccc(OC[C@H]3CCCO3)c2)c1	784839186	GGJCECDQBYSECV-QGZVFWFLSA-N	433.486	1.730	50	20	IDGD	
COCCCS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2cccnc2Cl)cc1	784842185	MVZPTLDFVXQCTL-UHFFFAOYSA-N	426.882	1.627	50	20	IDGD	
COc1cccc(NNC(=O)C(=O)Nc2c(C)cnn2Cc2ccc(OC)c(OC)c2)n1	784846161	LTYZVILEDKLPRC-UHFFFAOYSA-N	440.460	1.742	50	20	IDGD	
Cn1ccnc(NNC(=O)C(=O)Nc2ccc(Br)c(C(F)(F)F)c2)c1=O	785090683	WRKSJQONOFADLH-UHFFFAOYSA-N	434.172	1.643	50	20	IDGD	
O=C(CCC(=O)N1CCN(c2ccccn2)CC1)NNC(=O)NCc1ccc(Cl)cc1	787436332	XLAIMMHJTCXGKC-UHFFFAOYSA-N	444.923	1.694	50	20	IDGD	
CC(=NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1cc(C(=O)O)ccc1C	788407717	DSZYHKFEKOZKGI-UHFFFAOYSA-N	445.497	1.868	50	20	IDGD	
Cc1ccn(C[C@@](C)(O)C(=O)NNc2ccccc2S(=O)(=O)NC(C)(C)C)c(=O)c1	790717402	ANDZBHQYUYYRBT-HXUWFJFHSA-N	436.534	1.128	50	20	IDGD	
Cc1c(C(=O)NNc2nc3ccccn3n2)nnn1C1CCN(C(=O)OC(C)(C)C)CC1	791257777	KFGMDAXRHOCOKD-UHFFFAOYSA-N	441.496	1.958	50	20	IDGD	
COc1cc(C(F)(F)F)ncc1NC(=O)C(=O)NNC(=O)CCc1ccccc1O	792265507	CLQDPLAULLKGAO-UHFFFAOYSA-N	426.351	1.533	50	20	IDGD	
CC(C)Oc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(F)cc2Br)nn1	793026921	VFMLTIZMHLYRFY-UHFFFAOYSA-N	440.229	1.565	50	20	IDGD	
COc1ccc(C(=O)N2CCC(NC(=O)NNC(=O)c3cccc(C)n3)CC2)cc1OC	793031558	LEOFBXBXTYIWHP-UHFFFAOYSA-N	441.488	1.656	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)N2CCN([C@@H](C)C(=O)Nc3cccc(F)c3)CC2)n1	793220784	PQCDOJMQKJZXTF-HNNXBMFYSA-N	428.468	1.528	50	20	IDGD	
O=C(NNC(=O)c1cccc2cccc(Br)c12)N[C@H]1CCS(=O)(=O)C1	795527697	QRULFGXOCXZCKQ-NSHDSACASA-N	426.292	1.733	50	20	IDGD	
CC(=O)N1CCC(N(CC(=O)NNC(=O)c2cccc(C)c2)Cc2cncs2)CC1	795573418	BUDGPOIMUIFJSF-UHFFFAOYSA-N	429.546	1.726	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)Nc3ccc(S(=O)(=O)N(C)C)cn3)cc2C1	797652789	PDNSBEWFKSCSIQ-LLVKDONJSA-N	437.547	1.985	50	20	IDGD	
COCCOC(=O)c1c(C)[nH]c(C(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)c1C	798310018	MYUXFFBSQINWSD-UHFFFAOYSA-N	430.461	1.451	50	20	IDGD	
CCN=c1nc(NCC)n2c(SCC(=O)NNc3c(C)cccc3CC)n[nH]c2n1	799758352	ICXDTSBBHQYDMX-UHFFFAOYSA-N	429.554	1.911	50	20	IDGD	
O=C(CSc1nnc2c(=O)[nH]c3ccccc3n12)NNC(=O)c1cccc([N+](=O)[O-])c1	799826990	YGBVPOQFAVRHGM-UHFFFAOYSA-N	439.413	1.032	50	20	IDGD	
O=C(N=c1cc[nH]cc1)NNC(=O)C1CCN(c2ccc3nnc(C(F)(F)F)n3n2)CC1	802022733	GJUSWAIFSPKYTG-UHFFFAOYSA-N	449.397	1.029	50	20	IDGD	
CSCC[C@@H](NC(=O)c1ccc2ccccc2n1)C(=O)NNC(=O)N=c1cc[nH]cc1	802028174	MOZJMPIUVKPXSP-GOSISDBHSA-N	438.513	1.756	50	20	IDGD	
COc1ccc(Cl)c(NC(=O)NNC(=O)CN(C)S(=O)(=O)c2cccnc2)c1	802107972	MMUTUJIFWKPARX-UHFFFAOYSA-N	427.870	1.217	50	20	IDGD	
O=C(NNc1ccc2c(=O)[nH]ccc2c1)c1cc(S(=O)(=O)N2CCOCC2)ccc1F	803438132	DOLKRLHNRWDBSV-UHFFFAOYSA-N	446.460	1.445	50	20	IDGD	
COCCOc1ccc(S(C)(=O)=O)cc1NC(=O)C(=O)NNc1ccc(OC)cc1	806996244	PRMUCOWRWXNZRK-UHFFFAOYSA-N	437.474	1.206	50	20	IDGD	
COCCN(C)NC(=O)c1ccc(NC(=O)C[C@H]2SC(N3CCCC3)=NC2=O)cc1	808073989	WIUDUKUFIISHCL-MRXNPFEDSA-N	433.534	1.332	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)C(=O)OC3)cc1Br	808935350	SYDTYTMNPADMSJ-UHFFFAOYSA-N	448.229	1.528	50	20	IDGD	
C#CC[C@]1(C(=O)NNC(=O)CNC(=O)c2cccs2)CCCN1C(=O)OC(C)(C)C	809646630	DSZRUUZINJPJTB-HXUWFJFHSA-N	434.518	1.418	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1CC	810385435	SBYUQCIEYYLWMN-UHFFFAOYSA-N	430.417	1.721	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)c1cc(CN2CCCC2)on1	812446045	KWAXJCDAXFFXOZ-UHFFFAOYSA-N	426.521	1.244	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2c[nH]nc2-c2ccccc2)cc1	813033262	LMADAGPHPBMWDC-UHFFFAOYSA-N	428.474	1.409	50	20	IDGD	
Cc1nccc(CCC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)n1	814360869	OQPQBYNECGQYHL-UHFFFAOYSA-N	431.518	1.353	50	20	IDGD	
C[C@](O)(C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)c1ccc(Cl)cc1	814708476	LQOYBGWQZAUZNL-JOCHJYFZSA-N	430.936	1.907	50	20	IDGD	
CCCN1C(=O)c2ccccc2N2C(=O)CC[C@]12C(=O)NNC(=O)c1cccc(C#N)c1	815399460	YDAQQFNIVRXEJI-QHCPKHFHSA-N	431.452	1.708	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2c[nH]c3ccccc23)nnn1Cc1ccccc1F	815563436	BWJNAIPSJNAZOX-UHFFFAOYSA-N	435.419	1.655	50	20	IDGD	
Cn1cnc(NC(=O)C(=O)NNC(=O)c2ccc(COc3ccc4ccccc4c3)cc2)n1	815564926	XNEXURDIFYQJHG-UHFFFAOYSA-N	444.451	1.947	50	20	IDGD	
CCOC(=O)c1cc(COC)cc(NC(=O)C(=O)NNC(=O)c2ccc(C)c(F)c2)c1	815575060	IUUBNFQRJIKXGU-UHFFFAOYSA-N	431.420	1.857	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NNC(=O)Cn2ccc3ccccc3c2=O)C1	816510422	VYDPDVMVXSUUBI-MRXNPFEDSA-N	428.489	1.796	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)c2cc(S(N)(=O)=O)cnc2C)cc1OC	816828091	QOXLJLMJXZVCDO-UHFFFAOYSA-N	436.490	1.300	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)CN2C(=O)N[C@](C)(c3ccc(F)cc3)C2=O)c(C)c1	818580976	ROGFMBAGAUONPY-JOCHJYFZSA-N	441.463	1.469	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)[C@H](CSC)N1C(=O)[C@H]2CCCC[C@H]2C1=O	864001344	YEOILBVSDCGZNZ-ZNMIVQPWSA-N	449.529	1.128	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)CCNS(=O)(=O)c1cc(C)ccc1C	871624638	BHLOOBLZTZOFBJ-UHFFFAOYSA-N	433.530	1.761	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1)c1ccc(CO)cc1	877197983	ONUWPYLQCWTBRN-UHFFFAOYSA-N	428.452	1.956	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)O[C@H](C)C(=O)N2CCC(C(N)=O)CC2)c1C	913026857	ARULAEZITAAACC-BKAYVGFPSA-N	430.505	1.314	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(Cl)cc2)cc1	913429567	ISMWNEXVOZSSIP-UHFFFAOYSA-N	440.909	1.229	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)o1	914748794	GRYYFDJUDYQPFW-UHFFFAOYSA-N	437.474	1.303	50	20	IDGD	
COc1ccccc1NC(=S)NNC(=O)[C@H]1CS[C@@H](Cc2ccccc2F)C(=O)N1	915599084	QKWDRPUPTJUXBX-WBVHZDCISA-N	448.545	1.995	50	20	IDGD	
Cc1nnnn1[C@H](Cc1cccc(F)c1)C(=O)NNC(=O)c1cc(Br)c[nH]1	915685689	HGZPALXEWPPDFL-CQSZACIVSA-N	436.245	1.456	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)NCc1nnc2n1CCCCC2	915915837	QLZYNGXLVQPELP-UHFFFAOYSA-N	440.552	1.047	50	20	IDGD	
COc1cc(C=NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc(OC)c1OC	916335462	XTSFPSUYTRVHKV-UHFFFAOYSA-N	427.866	1.777	50	20	IDGD	
O=C(Cc1ccc2ccccc2c1)NNC(=O)NC[C@@]1(N2CCOCC2)CCSC1	916636647	HUBCUWKMSLMBJP-QFIPXVFZSA-N	428.558	1.921	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)/C=C\c2ccc(I)o2)cc1	916830168	BCRUCTGVZLOSJP-CLFYSBASSA-N	439.209	1.992	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)c1ccc(S(=O)(=O)N(C)C)cc1	918106661	ZASHBJXDGVYLEM-GFCCVEGCSA-N	435.462	1.550	50	20	IDGD	
CCOc1ccc(C2(CNC(=O)NN[C@@]3(C)CCS(=O)(=O)C3)CCOCC2)cc1	919923518	UDXRGLIMQLCDJQ-IBGZPJMESA-N	425.551	1.515	50	20	IDGD	
NC(=O)[C@@H]1CCCN1Cc1cccc(NC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1	920932455	LLUXVHYRWQCYMT-QFBILLFUSA-N	439.472	1.129	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)CCCN(C)C(=O)OC(C)(C)C	921301795	GHIJGXNSHJXYRQ-UHFFFAOYSA-N	441.554	1.696	50	20	IDGD	
CC(=NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1c(C)nc2sccn12	1317731878	MISVZJOEOZDROM-UHFFFAOYSA-N	447.542	1.879	50	20	IDGD	
N#Cc1ccc(N2C[C@@H](C(=O)OCC(=O)NNC(=O)c3ccc(Cl)cc3)CC2=O)cc1	1318050723	RFZGHYWBAFOSFZ-HNNXBMFYSA-N	440.843	1.569	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)N[C@H]1CCO[C@]2(CCSC2)C1	1319345117	TUSSNDDZPXLYDV-SCLBCKFNSA-N	441.579	1.287	50	20	IDGD	
Cc1n[nH]c(C)c1C[C@@H](C)C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	1322858097	XQHSNSNISNSLDB-CQSZACIVSA-N	434.566	1.285	50	20	IDGD	
N#CCCn1cc(/C=C(/C#N)C(=O)N2CCC(OCC(N)=O)CC2)c(-c2ccccc2)n1	1323314089	IHSNBZRODOVADA-AQTBWJFISA-N	432.484	1.864	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(O)nc(O)n2)C1	1778014827	CXPHIBZCCULQEZ-BFUOFWGJSA-N	426.901	1.280	50	20	IDGD	
CCCC(=O)N[C@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](Cl)COC)C2	1779519708	HSIPSXBVDLYUHH-UIVXKWKOSA-N	431.961	1.059	50	20	IDGD	
C[C@@H](Cn1cccn1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CO[Si](C)(C)C)C1	1779539580	DMODKTPXXLQTTM-WAOWUJCRSA-N	436.629	1.885	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3csc(C(F)(F)F)n3)C2)C1	1779758652	MRUFPHHRPGRLBG-BMIGLBTASA-N	441.859	1.859	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)c3sccc3Cl)C2)C1	1779787178	YTBGUZNVYLKOOX-IBGZPJMESA-N	449.920	1.157	50	20	IDGD	
O=C(c1cncc2cnccc12)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1780014433	ITJHKFXCEFWOQQ-YJBOKZPZSA-N	437.269	1.764	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](F)Cl)CCO3)cc1NC(C)=O	1780211849	UTBJOXZDKWSOFB-APWZRJJASA-N	427.860	1.632	50	20	IDGD	
CC(C)n1ccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)n1	1780376888	IJRLMOZZXUUBCI-RDTXWAMCSA-N	427.343	1.939	50	20	IDGD	
C[C@H](C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1)n1cccc1C=O	1781332125	ZXDGBHDJEKBCTG-SUYBPPKGSA-N	430.274	1.382	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](NC(C)C)C(C)C)C2	1782170619	SOPIRMPNXUYNKU-NEYJZJCJSA-N	432.005	1.777	50	20	IDGD	
N#Cc1ccc2[nH]nc(C(=O)N3CC[C@@]4(CN(C(=O)CCBr)CCO4)C3)c2c1	1782194144	CLXIZSIMZFWYKJ-LJQANCHMSA-N	446.305	1.663	50	20	IDGD	
CNc1ccc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CCC(=O)NN(C)C)C2)cc1	1782210769	JBSNTOMVUZRIDK-AUSIDOKSSA-N	445.564	1.229	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCn2nc(C)cc2C)C1	1782438732	SCRHUGYCUMXHTQ-DBXWQHBBSA-N	440.972	1.658	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)CN3CCC(C)CC3)CCO2)C1	1783344916	WRASGIOTVDYNRB-LPHOPBHVSA-N	430.387	1.722	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)[C@@H](N)Cc3cscn3)CCO2)C1	1783348124	VPVAIBQXSPCKCI-KEYYUXOJSA-N	445.383	1.016	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H]1CCN1C(=O)OC(C)(C)C)CCO2	1783871952	XAMSFKFQBAAPHL-BXTJHSDWSA-N	445.944	1.080	50	20	IDGD	
C#CCCCCC(=O)N1CC[C@]2(C1)CN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)CCO2	1784199668	OWYIVOMGTDAOPO-ZRZWOPFXSA-N	427.505	1.144	50	20	IDGD	
O=C(CCc1cnc[nH]1)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1	1786806471	AANSUDHDAJQPBP-UHFFFAOYSA-N	432.289	1.470	50	20	IDGD	
CCc1oncc1C(=O)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1	1787554925	XLLILGVMHFLJJN-UHFFFAOYSA-N	433.273	1.978	50	20	IDGD	
C[C@H](Br)C(=O)NC1(c2ccc(NC(=O)CC[C@H](N)C(N)=O)cc2)CCC1	1788058823	HPLHDFDYGYQUSR-FZMZJTMJSA-N	425.327	1.497	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4nccn4c3)C[C@@H]21)[C@H](F)Br	1789925721	IBHCMXKAPZRMTM-YXWQFLTLSA-N	439.285	1.618	50	20	IDGD	
C[C@H](Oc1cccnc1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]2C1	1789926919	LEXPWLPOJMZJIX-YERCRUGSSA-N	444.301	1.519	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)NC(=O)OC(C)(C)C)[C@H]2C1	1790173596	DSWATPQEWDNCCW-WNZSCWOMSA-N	447.960	1.217	50	20	IDGD	
O=C(Cc1cccc(C(F)(F)F)c1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21	1790759481	ZWATZVBOWPATKO-HJWJTTGWSA-N	448.869	1.827	50	20	IDGD	
C[C@H](Cn1ccnc1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]21	1791628391	NNQOXDQCFOCZJZ-CUGJGTHOSA-N	431.364	1.735	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)ccc1O)C2	1792874442	PKNRYEDGHHHQGN-LSSIXWDNSA-N	427.295	1.332	50	20	IDGD	
COc1cc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Cl)C3)cc(OC)c1OC	1793659983	GGDJYNYANSFYGW-OESLAJAZSA-N	444.887	1.379	50	20	IDGD	
CC(C)N1CCC(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCBr)C3)CC1	1793798130	YECQRQDQDCJYIN-ALXJQNPVSA-N	430.387	1.481	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)COc1cccc(N(C)C)c1	1794117368	OPRLYGRZJUHJOY-GGPHIMKMSA-N	445.564	1.143	50	20	IDGD	
CC(C)c1csc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)n1	1794547605	WNGDDJMCUNROJA-BJWYYQGGSA-N	427.335	1.512	50	20	IDGD	
COc1cc(Cl)cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)c1	1796190508	GWXDLWLIKUJXFB-REPLKXPHSA-N	442.708	1.594	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(C)c1)C2	1796441763	ZOAHFAQZUIVOSD-WCARGJHZSA-N	437.500	1.332	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccn2c(O)nnc12	1796725527	DSOAFDYRDVJSJU-QPSSLKIMSA-N	426.304	1.923	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1c[nH]c3ncccc13)C2	1797958965	DHRPDWFPJIVJLI-UPHUGPLXSA-N	444.608	1.937	50	20	IDGD	
CC(C)(C)OC(=O)NCC[C@@H](O)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C(Cl)Cl)C2	1800169123	MILZMJYUZGMLOI-YVECIDJPSA-N	438.352	1.704	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(Cl)ncn1)C2	1800641976	PBRMYEGVXWYOJF-FBKDDSFISA-N	431.718	1.507	50	20	IDGD	
C[C@H](CC(N)=O)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@@H]1c1cccnc1	1803672643	ZEBZGHOZGALKIX-DZGBDDFRSA-N	429.290	1.289	50	20	IDGD	
Cc1cc[nH]c1C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1805004973	PVLMHFDUYGIERV-WIYYLYMNSA-N	432.289	1.031	50	20	IDGD	
C[C@@H](C(=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Cl)[C@@H]1c1cccnc1)N1CCN(C)CC1	1807897512	AYBKPPJCOXHKEH-DZJNRPSUSA-N	425.936	1.258	50	20	IDGD	
C[C@@](O)(CC(=O)O)CC(=O)N1CCC2(CCCN(C(=O)CCBr)C2)CC1	1809070556	UTVJJKAIEFVTBQ-KRWDZBQOSA-N	433.343	1.618	50	20	IDGD	
C[C@@H]1CC[C@H](C(=O)NC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)O1	1809560117	YPUHMKSCPFGQGD-HVSHLEFESA-N	431.537	1.028	50	20	IDGD	
O=C(Cn1ccccc1=O)N1CCCC2(CCN(C(=O)[C@H](F)Br)CC2)C1	1810034734	MFGRQPLYWVNXRE-INIZCTEOSA-N	428.302	1.770	50	20	IDGD	
C[C@@H]1CC[C@H](C(=O)N2CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)O1	1813070393	IXUWBNQQRRRGBU-FLTJSSMESA-N	431.537	1.028	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2nc[nH]c2[N+](=O)[O-])[C@@H]1c1cccnc1)C(Cl)Cl	1813080071	MJQPWNBBGDEGHJ-CMPLNLGQSA-N	427.248	1.836	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)[C@@H]1C[C@@]1(F)Cl	1813151408	CIFMHQSFKRVSPK-JWVYWZTKSA-N	445.687	1.006	50	20	IDGD	
N#Cc1cccc(C(=O)N[C@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)c1	1815343924	XSHWDBWPMVTKOR-KRWDZBQOSA-N	446.297	1.234	50	20	IDGD	
C[C@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCBr)n[nH]1)n1cnnn1	1816784585	JBMFSOFHQGDDBS-ZYHUDNBSSA-N	425.291	1.435	50	20	IDGD	
Cc1cc(NC(=O)CC(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@H](F)Cl)CC3)no1	1817240320	IGBIHELQUZDAMJ-RTHLEPHNSA-N	429.861	1.915	50	20	IDGD	
COc1ccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)cn1	1817474745	YQPXLMCWKFZHDN-SFHVURJKSA-N	449.276	1.113	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@H]2CCCS2)[nH]n1)c1cccc(B(O)O)c1	1817479871	VZFSZTKJCIOGLO-IAGOWNOFSA-N	428.323	1.291	50	20	IDGD	
Cc1cc2nnc(C(=O)Nc3cc([C@H]4CCCCN4C(=O)[C@@H](O)CCl)[nH]n3)c(C)n2n1	1818587934	LWKDOGXHXZVGST-KGLIPLIRSA-N	446.899	1.370	50	20	IDGD	
CC[S@](=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](C)Br)CC2	1819519665	KRLYTSCLIQWFEZ-BYGADWOMSA-N	436.397	1.997	50	20	IDGD	
COC[C@H](NC(C)=O)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](F)Br)[nH]n1	1819611825	NUNSKBNIIWTARU-OBJOEFQTSA-N	448.293	1.243	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)/C=C/C1CC1)CC2	1819792774	AJPCXBSNQIOARY-MJRJWQSSSA-N	426.502	1.334	50	20	IDGD	
CC[C@@H](Br)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2c[nH]c(=O)cn2)[nH]n1	1822089592	DLSDWYJHAFPMTN-ZWNOBZJWSA-N	437.298	1.972	50	20	IDGD	
COCCn1nccc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](Cl)COC)n[nH]1	1822367714	ACINNXGPWTYQQO-ZFWWWQNUSA-N	438.916	1.812	50	20	IDGD	
Nc1n[nH]c(CCC(=O)N[C@H]2CCc3nc(NC(=O)[C@H](F)Br)sc3C2)n1	1823007114	JEMSCRZJRGVMLR-KGFZYKRKSA-N	446.306	1.079	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](O)CCl)CC2)c1nc2ccc(F)cn2n1	1824387731	GUXIFKSKKKJFLP-ONGXEEELSA-N	438.872	1.150	50	20	IDGD	
COc1cnc(C(=O)N[C@@H]2CCc3nc(NC(=O)[C@@H](C)Br)sc3C2)cn1	1825636995	PFAVINJFDVZHJB-RKDXNWHRSA-N	440.323	1.951	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@H]1CCc2nc(NC(=O)[C@H]3CCOC3)sc2C1	1827168673	DTNZWRUOYBFDIU-UFOJXWSGSA-N	444.517	1.226	50	20	IDGD	
Cc1nc2ncccn2c1C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@H](O)CCl)CC1	1828229147	RNTDYANSJRWYGK-DLBZAZTESA-N	433.940	1.871	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(F)nc2)CC1	1829191528	FTBRPNDXTYJDRB-FQEVSTJZSA-N	439.296	1.448	50	20	IDGD	
CCc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)no1	1830540066	MKFMVAAXIFQEGE-UGSOOPFHSA-N	444.326	1.338	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CCCSC3)C2)C1	1830547034	ZNQQIFQVDVJJCP-VKJFTORMSA-N	449.411	1.617	50	20	IDGD	
Cc1cccc(CC(=O)N2CCC([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)n1	1831871967	YCPOIOSMNRCOIZ-OAQYLSRUSA-N	443.592	1.925	50	20	IDGD	
Cc1ccc(F)cc1C(=O)NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1833151591	SWPIDPWKTIGWMT-IBGZPJMESA-N	425.932	1.919	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3scnc3C)CCO2)C1	1834269415	YKCVVYGCFPYFGE-SUMWQHHRSA-N	446.367	1.695	50	20	IDGD	
O=C(CCBr)NC1CCN(C2CCN(C(=O)Cc3cnc[nH]3)CC2)CC1	1834421787	MAGPEDUIMOUIIK-UHFFFAOYSA-N	426.359	1.309	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)c1nccc2[nH]ccc12	1835015689	GMDGSYLJELEZTL-SFHVURJKSA-N	433.940	1.348	50	20	IDGD	
C=CCC(=O)N1CCC(N2CCC(NC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CC2)CC1	1835118245	WEZHFEOHUBQLSY-PCLIKHOPSA-N	428.537	1.268	50	20	IDGD	
C[C@H](Nc1nccs1)C(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836717856	LXAWOLZEAYEDNZ-XJKSGUPXSA-N	444.985	1.542	50	20	IDGD	
Cn1ccnc1C(=O)N1CCC(OC2CCN(C(=O)CCBr)CC2)CC1	1837535308	SYRKTYPMLXXTNQ-UHFFFAOYSA-N	427.343	1.817	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(F)n3)CCO2)C1	1837902399	WXAIKBTWFJYSNF-ACJLOTCBSA-N	444.301	1.322	50	20	IDGD	
COC(=O)C12CC(C(=O)N3CCC(OC4CCN(C(=O)[C@@H](F)Cl)CC4)CC3)(C1)C2	1838085960	LICLVYIGEOIJGO-APMMTJHUSA-N	430.904	1.863	50	20	IDGD	
Cc1nccn1CC(=O)N1CCC(OC2CCN(C(=O)[C@H](F)Br)CC2)CC1	1838647972	COSKJISKVBMRCJ-KRWDZBQOSA-N	445.333	1.881	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)CN3CCCCC3=O)CC2)CC1	1838781274	WTZUGLQCYJQZHC-GOSISDBHSA-N	443.972	1.251	50	20	IDGD	
COc1cccc(C(=O)N2CCO[C@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)c1	1838929111	YOCSDOHPYIBORG-NRFANRHFSA-N	436.581	1.617	50	20	IDGD	
CC(C)=NO[C@H](C)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2	1839154191	GBYHMWYFTXCWBC-JLSDUUJJSA-N	438.352	1.480	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(-n4cccn4)cc3)CCO2)C1	1839337273	ABMACCPMMLCLGA-KNQAVFIVSA-N	446.935	1.960	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1839961716	GHQCQBMIOVHGFB-DYVFJYSZSA-N	439.778	1.881	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@]3(C)CC3(F)F)C2)C1	1839967185	CUAKVVHOKVREFN-RCBQFDQVSA-N	439.297	1.662	50	20	IDGD	
O=C(CCc1cnc2[nH]ccc2c1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1840080728	AJJCNSUSLMIOFO-XLIONFOSSA-N	438.887	1.486	50	20	IDGD	
C[C@@H](C(=O)N1CCCC12CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)n1ccnc1	1841464338	DVVCQXPZKSCCHC-GJZGRUSLSA-N	439.944	1.780	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H](C(=O)N2CCCC23CN(C(=O)[C@@H](O)CCl)C3)[C@@H](F)C1	1841516251	UZGZDFRGENBRHR-ILXRZTDVSA-N	447.935	1.385	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2ccc(N(C)C)cn2)C1	1842277572	WKXKSZQXKIJUNW-MFKUBSTISA-N	437.504	1.099	50	20	IDGD	
CN(CC(=O)N1CC2(CCCN2C(=O)c2ccsc2)C1)NC(=O)NCc1ccccc1	1842380750	KDIBHFICZKWIGW-UHFFFAOYSA-N	441.557	1.911	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC2(CCCN2C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C1	1843416872	JRXGTIQWDINXLA-XMOVILSBSA-N	438.326	1.497	50	20	IDGD	
Cc1oc2cc(O)ccc2c1C(=O)N1CCCC12CN(C(=O)c1cccc(B(O)O)c1)C2	1843741002	LHSFTEBWDHHLEN-UHFFFAOYSA-N	434.257	1.257	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC2(CCCN2C(=O)c2cc3n(n2)CCCNC3=O)C1	1843999553	YIJIAFJQRMUGEI-GFCCVEGCSA-N	438.326	1.007	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2cncc3cnccc23)C1	1844652397	YDPUWMCEBJJKFK-JFLMPSFJSA-N	445.483	1.581	50	20	IDGD	
Cc1c(C(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)cccc1C(F)(F)F	1846875122	IAUJWQCGYOPAEB-UHFFFAOYSA-N	446.234	1.824	50	20	IDGD	
CCCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl	1847556965	UQEKNIZKBIQLDO-YHUYYLMFSA-N	431.961	1.871	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)c2ccc3c(c2)CCCN3S(C)(=O)=O)nc2ccccc21	17411310	SWLHLUBLYZKCJH-UHFFFAOYSA-N	441.513	1.289	50	20	IDGD	
CC(C)Cn1nc(C(=O)NNC(=O)CCN2C[C@@H](C)O[C@H](C)C2)c2ccccc2c1=O	38686880	FHAACJAHFKZZBW-HZPDHXFCSA-N	429.521	1.313	50	20	IDGD	
O=C(CNC(=O)c1ccc(C(F)(F)F)cc1)NNC(=O)CNC(=O)c1cccs1	725909225	GSIJWPBBUPFFOJ-UHFFFAOYSA-N	428.392	1.074	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)N[C@H]1C[C@@H]1c1cccc(Br)c1	726609765	CVXBGAHFMUPVBA-CVEARBPZSA-N	442.277	1.925	50	20	IDGD	
CCS(=O)(=O)NCCCNC(=O)CCC(=O)C(C#N)=C1N(C)c2ccccc2N1C	726771466	SPUZDOLTYBRFIP-UHFFFAOYSA-N	433.534	1.103	50	20	IDGD	
CNS(=O)(=O)c1cccc([C@@H](C)NC(=O)NNC(=O)COc2ccc(OC)cc2)c1	727608889	ZRZMJFGXUJDYDL-CYBMUJFWSA-N	436.490	1.074	50	20	IDGD	
O=C(NNC(=S)NCC1CCC1)C1CCN(S(=O)(=O)/C=C\c2ccccc2)CC1	727866039	LMXPJKFLOGJBRH-KAMYIIQDSA-N	436.603	1.995	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@H]2C(=O)NNc2nc(-c3cccnc3)no2)c(OC)c1	728079432	UZCTYRUFFWVDPZ-INIZCTEOSA-N	438.444	1.897	50	20	IDGD	
O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)NNC(=O)c1ccc(-n2cnnn2)cc1	728715363	YNMAECFRSFLVFP-SFHVURJKSA-N	434.504	1.171	50	20	IDGD	
Cn1c(S)nc2cc(C(=O)NNc3ccc(S(=O)(=O)C(F)F)cc3)ccc2c1=O	728974267	KGXCLYJBEFIXJO-UHFFFAOYSA-N	440.453	1.975	50	20	IDGD	
Cc1nc2[nH]n(C)c(=O)c2c(C)c1CCC(=O)NNC(=O)[C@H](C)Oc1ccccc1F	729282824	JYQNCFQMIMIWLR-ZDUSSCGKSA-N	429.452	1.565	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)CNc2ccccc2)cc1S(=O)(=O)N1CCOCC1	729514276	VWNXNAWBBWTCPW-UHFFFAOYSA-N	446.529	1.143	50	20	IDGD	
O=C(Cc1cc[nH]n1)NNC(=O)c1ccc(Cl)c(S(=O)(=O)N2CCCCC2)c1	730101734	CBQDIIOBBTYFHK-UHFFFAOYSA-N	425.898	1.241	50	20	IDGD	
CSCC[C@H](C(=O)NNC(=O)Cc1ccccc1F)N1C(=O)c2ccccc2C1=O	731330138	QOHKKLAEPCGUOS-QGZVFWFLSA-N	429.473	1.934	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)CS(=O)(=O)Nc1ccc(N2CCCCC2)cc1	731494360	OCVUWPYYCICWOO-UHFFFAOYSA-N	446.529	1.888	50	20	IDGD	
CCOc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)c3c[nH]nc3C)c2)cc1	731851911	ZTVRDDGNWXZKPK-UHFFFAOYSA-N	443.485	1.992	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@@H]2CC(=O)N(Cc3ccccn3)C2)cc1Br	732033565	ROYPMYPGRVOXNR-CYBMUJFWSA-N	447.289	1.662	50	20	IDGD	
COc1ccc(CCC(=O)N2CCCN([C@@H](C)C(=O)NNC(=O)CC(C)C)CC2)cc1	732200323	XMBVJVPJVYAPNR-SFHVURJKSA-N	432.565	1.744	50	20	IDGD	
O=C(COC(=O)C1(C(=O)Nc2ccc(F)cc2)CC1)NNC(=O)c1cccc([N+](=O)[O-])c1	732331706	OPBZYGXNHKFVPR-UHFFFAOYSA-N	444.375	1.457	50	20	IDGD	
O=C(NNc1ccc(Br)nc1)c1cccc(CN2CCS(=O)(=O)CC2)c1	732837235	BVNIWPCWOXKVQM-UHFFFAOYSA-N	439.335	1.831	50	20	IDGD	
CCn1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)cn1	733947662	CQSOTIQOSPBCNW-UHFFFAOYSA-N	427.486	1.456	50	20	IDGD	
CC(C)[C@H](C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)n1nnc(-c2ccccc2)n1	734239589	SUULPVMRJORPQR-OAHLLOKOSA-N	446.512	1.392	50	20	IDGD	
O=C(NCCn1cccn1)NNc1ccc(S(=O)(=O)NC2CCCCCCC2)cn1	735581258	OYCAOFHNHHLCGS-UHFFFAOYSA-N	435.554	1.996	50	20	IDGD	
NS(=O)(=O)c1ccc(Br)c(C(=O)NNC(=O)COCc2ccccc2)c1	737923078	JXDNDOSVLIKCDU-UHFFFAOYSA-N	442.291	1.074	50	20	IDGD	
NS(=O)(=O)c1ccccc1S(=O)(=O)NNC(=O)CC12CC3CC(CC(C3)C1)C2	740706399	YTDAIUUFWLCSSS-UHFFFAOYSA-N	427.548	1.250	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2cnn(-c3ccccc3F)c2)c1	742028751	FMIAHOAJIPZKBV-UHFFFAOYSA-N	438.462	1.038	50	20	IDGD	
CCCN(CCC)S(=O)(=O)NNC(=O)c1ccc(CSc2nncn2C)cc1	742231361	BPAKWGMXAHJPQU-UHFFFAOYSA-N	426.568	1.709	50	20	IDGD	
COc1cc(C(=O)NNC(=O)N[C@H]2C[C@H](C)N(c3ccccc3)C2=O)cc(OC)c1OC	743506933	SWRNSMARCDUQGA-BBRMVZONSA-N	442.472	1.850	50	20	IDGD	
CC(=O)N1CCc2ccccc2[C@H]1CC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	743830620	ZTUZWQLYPPFAGL-LJQANCHMSA-N	444.513	1.779	50	20	IDGD	
C[C@H](C(=O)NNC(=O)c1c(Cl)cccc1Cl)N1C(=O)[C@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O	744362207	XNQFERFUVCDDEZ-RPBUXLIISA-N	426.256	1.305	50	20	IDGD	
CC(C)(C)OC(=O)NC1(C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)CCCC1	744964648	UVYZDYVXWQRWTN-UHFFFAOYSA-N	430.461	1.700	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1)c1cnn(C)c1	745839174	OGZVJQWVMUSUNS-OAHLLOKOSA-N	445.487	1.827	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)c2nc(NCc3ccco3)ncc2Cl)c1	746309606	FNHJCNWUOHTXEK-UHFFFAOYSA-N	429.824	1.763	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)N[C@H]3CCCN(CC(F)(F)F)C3=O)nc21	746339791	QYCYFWPYXQDUOB-JTQLQIEISA-N	444.418	1.466	50	20	IDGD	
CCO/C=C(/C#N)C(=O)N1CCN(S(=O)(=O)c2ccc(Br)cc2)CC1	746511039	XDGUOAUWJQRXBP-SEYXRHQNSA-N	428.308	1.726	50	20	IDGD	
Cn1ncnc1COc1ccc(S(=O)(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)cc1	746591682	OXYOQCDOQXESBA-UHFFFAOYSA-N	445.545	1.920	50	20	IDGD	
COc1cc(C)nc(NNC(=O)CCNS(=O)(=O)c2cccc(Br)c2)n1	746626827	BHWCOCUNGKGHHH-UHFFFAOYSA-N	444.311	1.368	50	20	IDGD	
O=C(Cn1c(S)nc2ccccc2c1=O)NNC(=O)c1cccc(Br)c1	746691421	IHAKQRKIJONIPR-UHFFFAOYSA-N	433.287	1.909	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NC2CCC(C(N)=O)CC2)c2ccccc2c1=O	747582785	FLWHKIRJEJNPKM-UHFFFAOYSA-N	428.493	1.185	50	20	IDGD	
CC(C)CS(=O)(=O)CC(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1	747778047	AKPVVNHZJRVTAR-OAQYLSRUSA-N	443.569	1.832	50	20	IDGD	
Cc1cccc(NS(=O)(=O)c2cc(C(=O)NNC(=O)C(=O)N3CCCC3)ccc2C)c1	748245971	AYAFOVJNFWEMGB-UHFFFAOYSA-N	444.513	1.488	50	20	IDGD	
Cc1cc(Br)ccc1NNC(=O)CCN1CCN(C(=O)[C@H]2CCCO2)CC1	748740477	GDFMQPPXTTZOGO-QGZVFWFLSA-N	439.354	1.914	50	20	IDGD	
O=C(NCc1cccc(F)n1)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	749239226	HQQVKYYRXYZXQR-UHFFFAOYSA-N	435.481	1.540	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)N[C@H]1CCN(CCCc2ccccc2)C1=O	750291915	MYFLUGLDZIZVGR-SFHVURJKSA-N	438.484	1.636	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)c2ccc(Br)c(S(=O)(=O)N(C)C)c2)o1	752525505	NDAHIULOTYUNMZ-UHFFFAOYSA-N	430.280	1.676	50	20	IDGD	
CC[C@@H](NC(=O)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1)C(=O)N1CCOCC1	753055788	FDVOLDDSLQLBMZ-CYBMUJFWSA-N	438.428	1.244	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)Nc2ccc(CC(=O)N3CCOCC3)cc2)c1	755861976	KSIVAGZDENGDKJ-UHFFFAOYSA-N	440.500	1.936	50	20	IDGD	
CCCN(CCC)C(=O)c1ccc(NC(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)cc1	755969211	KJVGOUHNPHBATI-CYBMUJFWSA-N	427.527	1.039	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)Nc3cnn(CC(=O)NC4CC4)c3)n[nH]2)cc1C	756796505	QTPWAFCMPHBNPF-UHFFFAOYSA-N	436.476	1.635	50	20	IDGD	
COc1ccccc1N1CC[C@H](NC(=O)NNC(=O)Nc2ccc(N(C)C)cc2)C1=O	757286120	LHKAGRYOGKLNEQ-INIZCTEOSA-N	426.477	1.902	50	20	IDGD	
O=C(NCc1ccc2c(c1)CCS2(=O)=O)NNC(=O)c1cccc(OC(F)F)c1	757738292	NIYCBMFRHGGLLS-UHFFFAOYSA-N	425.413	1.762	50	20	IDGD	
CN(C)N(C(=O)c1ccc2c(=O)n(-c3ccccc3)c(O)nc2c1)[C@H]1CCS(=O)(=O)C1	757866956	PCMQYNCORAXJBP-INIZCTEOSA-N	442.497	1.197	50	20	IDGD	
Cc1ccc(N2CCC(C(=O)N3CCN(S(=O)(=O)CBr)CC3)CC2)nc1	758511600	BQHQMEFOJQUQRI-UHFFFAOYSA-N	445.383	1.433	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCC[C@@H]([C@@H](C)NC(=O)OC(C)(C)C)C2)n1	758780772	UITVVFWLVMIBAW-HUUCEWRRSA-N	439.582	1.767	50	20	IDGD	
CC(C)(C)[C@@H](CN1CCc2ccccc2C1)NC(=O)NNC(=O)C(=O)Nc1ccccn1	758792127	VDUNXTIDDMHPBX-GOSISDBHSA-N	438.532	1.824	50	20	IDGD	
C[C@H](NC(=O)OC(C)(C)C)[C@H]1CN(C(=O)NNC(=O)Cn2ccc3ccccc32)CCO1	760758266	XJNNMHVFHZCLNK-MAUKXSAKSA-N	445.520	1.996	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H]1[C@@H]1COCCC1=NNC(=O)C(=O)Nc1ccccn1	762434538	QANXSKOOQVKALS-ZBFHGGJFSA-N	431.493	1.928	50	20	IDGD	
COCCOc1ccc(C#N)cc1NC(=O)C(=O)NNC(=O)c1ccc2ccccc2n1	763450766	QBASJDOTWZHRHU-UHFFFAOYSA-N	433.424	1.531	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(C)n(-c3cccc(F)c3)n2)cc1OC	763550432	MSNCGQGWNKZFEP-UHFFFAOYSA-N	441.419	1.737	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(C(=O)N2CCCC2)cc1	763657457	MXMDICMFQURPLO-UHFFFAOYSA-N	440.456	1.096	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(Oc3cnccn3)c2)cc1	763662191	VQUHPJSHLGOMRZ-UHFFFAOYSA-N	437.412	1.442	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2F)cc1N1CCOC1=O	763681585	GZIPJYQETRGNOI-UHFFFAOYSA-N	430.392	1.256	50	20	IDGD	
CNC(=O)c1ccc(OC)c(NC(=O)C(=O)NNC(=O)CC23CC4CC(CC(C4)C2)C3)c1	763734144	IXLGTZFEMOAZAN-UHFFFAOYSA-N	442.516	1.747	50	20	IDGD	
CCS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)cc1	763745971	MAIHCDPRMBCPAJ-UHFFFAOYSA-N	444.513	1.019	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)C(=O)Nc2cc(Cl)cc(Cl)c2)c2ccccc2c1=O	763790418	IJQHNXOBNHNWFO-UHFFFAOYSA-N	434.239	1.640	50	20	IDGD	
Cc1cc(C)nc(-n2nc(C(=O)OCC(=O)NNC(=O)c3ccc(C#N)cc3)cc2C)n1	763792724	BYMGYCRCXLOVLE-UHFFFAOYSA-N	433.428	1.077	50	20	IDGD	
Cc1ncc(-c2ccc(NC(=O)C(=O)NNC(=O)COc3ccccc3[N+](=O)[O-])cc2)o1	763804650	OEIZNVWYPHTWGK-UHFFFAOYSA-N	439.384	1.723	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)C[C@H]1Sc2ccc(Cl)cc2NC1=O	763821789	XOTSTCJBBLXYCH-CQSZACIVSA-N	433.877	1.115	50	20	IDGD	
C=CCNC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)cc1	763866613	QFFLFOIUTGYQCH-CYBMUJFWSA-N	443.435	1.687	50	20	IDGD	
C#CCOc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(OCCC)c(OC)c2)c1	763911903	QQORBSLIHYATDU-UHFFFAOYSA-N	425.441	1.896	50	20	IDGD	
Cc1c(Cl)cc(F)c(NC(=O)C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c1F	763916952	LITZLKNFLUEVNP-UHFFFAOYSA-N	435.778	1.302	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc(F)c(-n2nnnc2C2CC2)c1	764040038	BTMXBWVOMSRXDU-UHFFFAOYSA-N	439.407	1.087	50	20	IDGD	
COCCOC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2ccccc2OC)c1	764043850	XLFXXHGNNDQFHZ-UHFFFAOYSA-N	430.417	1.290	50	20	IDGD	
CCc1ccc(NC(=O)C(=O)NNC(=O)c2cccc3ccccc23)cc1S(N)(=O)=O	764047682	GHUMGLSDPUKKOJ-UHFFFAOYSA-N	440.481	1.449	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)N3CCCCC3)c(Cl)c2)n[nH]1	764106293	HOAZZLBGPDPSNO-UHFFFAOYSA-N	432.868	1.397	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)C(=O)N(CC2CC2)C3=O)c(O)c1	764109835	LLJAFVVNYHNHQF-UHFFFAOYSA-N	436.424	1.106	50	20	IDGD	
CCOC(=O)c1cc(CC)sc1NC(=O)C(=O)NNC(=O)[C@@H]1Cc2ccccc2O1	764154457	QSGXPWHBKPIVGE-HNNXBMFYSA-N	431.470	1.577	50	20	IDGD	
C[C@@H](C(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(C#N)cc2)c1)n1cccn1	764178143	YYQWTXDRIKXJLD-AWEZNQCLSA-N	445.439	1.354	50	20	IDGD	
CC(C)(C)CC(=O)NNC(=O)C(=O)Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1	764200068	XMWVQNORGCGGIH-UHFFFAOYSA-N	438.550	1.773	50	20	IDGD	
COc1ccc(S(=O)(=O)NC(C)(C)C)cc1NC(=O)C(=O)NNC(=O)CC(C)(C)C	764202544	VHDYAHIBNHFAPB-UHFFFAOYSA-N	442.538	1.294	50	20	IDGD	
COC(=O)c1c(F)cccc1NC(=O)C(=O)NNC(=O)c1cc(-c2cccs2)[nH]n1	764383227	YSCYRHUCELCZRP-UHFFFAOYSA-N	431.405	1.464	50	20	IDGD	
CCNS(=O)(=O)c1cccc(C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)c1	765316695	BRQAEFXGJHCVHW-UHFFFAOYSA-N	428.511	1.051	50	20	IDGD	
O=C(O)c1ccc2c(C=NNC(=O)c3cccc(S(=O)(=O)N4CCCC4)c3)n[nH]c2c1	765548944	QUCSTERYNDTCEO-UHFFFAOYSA-N	441.469	1.810	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2ccc(Cl)c(S(=O)(=O)NCc3ccccc3)c2)n[nH]1	765587282	UDCOSDSSVQEMHE-UHFFFAOYSA-N	447.904	1.925	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)[C@H]1SCCc2sccc21	766643766	SHBUFUGQJUBISM-IBGZPJMESA-N	444.582	1.684	50	20	IDGD	
O=C(CCCCN1CCCC1)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	766659584	COUYBQKRNWQRPM-UHFFFAOYSA-N	436.000	1.871	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)CCc1nc2ccccc2c(=O)n1C	767265233	QRNBHJLZCOLZLM-UHFFFAOYSA-N	436.468	1.108	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc3c(cc2F)NC(=O)CC3)c1	767734919	QBMHYXHLKWVWBN-UHFFFAOYSA-N	434.449	1.036	50	20	IDGD	
COCCOc1ccc(-n2nc(C)c(C(=O)NNC(=S)Nc3ccccn3)n2)cc1	768579549	QWSKYAFCWUSHDO-UHFFFAOYSA-N	427.490	1.627	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)NCCNC(=O)c3ccc(Cl)cc3)nc21	770342381	RPHSUTCLAZIULY-UHFFFAOYSA-N	446.899	1.996	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)Cc2cccc(OCc3cccnc3)c2)c2ccccc2c1=O	770577118	CJLBYUWLKBEXQH-UHFFFAOYSA-N	443.463	1.911	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@@H]2C(=O)O[C@H](C)C(=O)NNC(=O)CC(C)C)c(OC)c1	771989679	VJRUSJLZMBDLRV-RHSMWYFYSA-N	449.504	1.434	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NNC(=O)CCc2nc(-c3ncccn3)no2)C1	773422030	TZYXUNJPUAZTRW-CYBMUJFWSA-N	445.480	1.254	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNc2nc(C)cc(C)n2)c(Br)cc1F	773479371	UBZRULHSZVQLGW-UHFFFAOYSA-N	440.229	1.863	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2cc(C)cc(C)n2)c1	773512230	QYKFDYUFLCDZRX-UHFFFAOYSA-N	447.517	1.129	50	20	IDGD	
Cn1cc(NC(=O)C(=O)NNc2ccc(C(F)(F)F)cn2)cc(Br)c1=O	773668970	CSJXZMNAOIGHIZ-UHFFFAOYSA-N	434.172	1.643	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCCC(=O)NNc1cnc2ccccc2n1	774794937	OHFPSSKFNBJGBS-MRXNPFEDSA-N	428.493	1.979	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@H](C(=O)NNc2ccc(C(F)(F)F)cn2)[C@H](C)O)cc1	775249275	JZZYXBHIRUMZTG-NHYWBVRUSA-N	432.424	1.580	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)N[C@@H](C)CS(=O)(=O)c1ccc(C)cc1	776195765	QVHVOKXPWABWOL-INIZCTEOSA-N	449.529	1.965	50	20	IDGD	
COc1cccc([C@H]2[C@H](C(=O)NNC(=O)c3ccc4c(c3)OCO4)CC(=O)N2C2CC2)c1	776447826	OWRXKVLDIWTLBB-UTKZUKDTSA-N	437.452	1.937	50	20	IDGD	
O=C(NCCOCc1ccc(Cl)cc1Cl)NNC(=O)C(=O)Nc1ccccn1	776631323	HXAGJHJYPXEHAF-UHFFFAOYSA-N	426.260	1.874	50	20	IDGD	
COc1cccc(C[C@@H](C(=O)NNc2cccc(S(C)(=O)=O)c2)n2nnnc2C)c1	776720567	DCYPHRMPDLQBPW-SFHVURJKSA-N	430.490	1.321	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)c2cn(C)nc2-c2cnn(CC)c2)cc1	777422833	ZEMAVFJZUQOKAT-AWEZNQCLSA-N	426.477	1.931	50	20	IDGD	
CS(=O)(=O)N1CC(CNC(=O)/C(C#N)=C\c2cn(CCC#N)nc2-c2ccccc2)C1	779332158	OXKYKVIMRSRLQG-ZDLGFXPLSA-N	438.513	1.378	50	20	IDGD	
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	779387615	OKTAUIKAFDWTFH-CYBMUJFWSA-N	432.481	1.825	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)OC)cc2OC)cc1OC	782120455	JAVPGLTUZKMKHH-UHFFFAOYSA-N	445.428	1.289	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNc2ccc(Cl)cc2)cc(S(C)(=O)=O)c1	783340139	OHFGSNSCZICPPQ-UHFFFAOYSA-N	425.850	1.612	50	20	IDGD	
Cc1c(NNC(=O)C(=O)Nc2cccc(CN3CCN(C)CC3)c2)cccc1[N+](=O)[O-]	784351008	AAGXXTKCXHBELZ-UHFFFAOYSA-N	426.477	1.732	50	20	IDGD	
O=C(NNc1ccccc1Cl)C(=O)Nc1cccc(S(=O)(=O)NC2=NCCC2)c1	784770476	KJKMIKIIAIOZIQ-UHFFFAOYSA-N	435.893	1.892	50	20	IDGD	
CN(C)c1nccc(NNC(=O)C(=O)Nc2cccc(NC(=O)c3cccs3)c2)n1	784969348	LAMDEYYPIFSBPL-UHFFFAOYSA-N	425.474	1.938	50	20	IDGD	
CCNC(=O)Nc1ccc(C)c(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c1	787550598	WGFKWBSMAUNPQL-UHFFFAOYSA-N	449.471	1.722	50	20	IDGD	
O=C(CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@H]12)NNC(=O)c1ccc(Br)s1	789253712	UOAWMUONAKTGFX-RVBZMBCESA-N	447.380	1.997	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2nc3c(s2)CCCC3)cc(OC)c1OC	789730624	UWRKZGWZJCQBAA-UHFFFAOYSA-N	434.474	1.447	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)N3CCC[C@H](N4CCCS4(=O)=O)C3)cc2C1	789829459	OYOGLOIEADNWLV-HIFRSBDPSA-N	440.591	1.727	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)[C@@H]1CC(c2cccnc2)=NO1	790120289	CZEVHCUQRIWRIP-ZBEGNZNMSA-N	433.262	1.952	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@H]2CCC3(CCCCC3)O2)c1	790631349	DFWQWQQKSVVXFF-MRXNPFEDSA-N	438.550	1.763	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)NCCCNC(=O)c2ccc(Br)cc2)n1	792962642	IRSDCVCODJXFQW-UHFFFAOYSA-N	434.294	1.917	50	20	IDGD	
COc1c(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCC3)cc(Cl)cc1C(N)=O	793021778	JFCFEXZVAKETAA-UHFFFAOYSA-N	436.877	1.397	50	20	IDGD	
CC(C)Oc1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)nn1	793039776	CCKBZSRZGZAHCD-UHFFFAOYSA-N	447.395	1.639	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCCCc2ccccc2F)cc1	793465124	SQXJQIIWHUQHDM-UHFFFAOYSA-N	436.509	1.718	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2cc(OC)c(OC)c(C)c2OC)c1O	797003125	WUVHGNNUACUQTA-UHFFFAOYSA-N	433.417	1.135	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2ccc(OC(C)C)c(C(N)=O)c2)n1	797102419	BDDPHTIBFWJNMJ-UHFFFAOYSA-N	429.481	1.291	50	20	IDGD	
CC1(C)CN(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)C[C@]2(C[C@@H]3CC[C@H]2C3)O1	799353615	RJGSMGVHNCDYQD-ZJTDPSCFSA-N	425.493	1.686	50	20	IDGD	
Cc1ccc(NNC(=O)NC[C@H](N2CCN(C(=O)OC(C)(C)C)CC2)C(F)(F)F)nn1	802466034	WZCHWTPKDOOLOF-ZDUSSCGKSA-N	447.462	1.895	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2cc(N)c(C)cc2Br)n1	803854294	NKKYDVLSTWTJRL-UHFFFAOYSA-N	441.307	1.652	50	20	IDGD	
CCc1nnc(NC(=O)[C@H](C)[C@H](C)NC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)s1	805880949	SNVZBNXDLJLOPG-SUNKGSAMSA-N	448.505	1.234	50	20	IDGD	
CNC(=O)c1cccc(NC(=O)C(=O)NNc2ncccc2Cl)c1Br	806967552	IWQRKEXIYCXIIS-UHFFFAOYSA-N	426.658	1.939	50	20	IDGD	
CN(NC(=O)c1cnc(C2OCCO2)s1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	807243342	PZCNDDDWDFUQQW-UHFFFAOYSA-N	441.510	1.438	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)Nc1cc(C(N)=O)ccc1OCC(F)F	810343338	UQBBOIPVCBSYBN-UHFFFAOYSA-N	432.387	1.852	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(Br)c([N+](=O)[O-])c2)cc1	810386568	HDUFLPNKCGSSQI-UHFFFAOYSA-N	432.190	1.629	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)CCCC[C@@H]2SC[C@@H]3NC(=O)N[C@@H]23)cc1	812730438	JFLOPJDSSUNYMA-YQQAZPJKSA-N	441.579	1.106	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)c2cnc(NC(=O)OC(C)(C)C)cn2)cc1	812733362	PGSGCIDMMGJINW-UHFFFAOYSA-N	436.494	1.831	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)CNC(=O)OC(C)(C)C)c1ccc(N2CCCNC2=O)cc1	812943996	JBAHFJJUCULMPR-ZDUSSCGKSA-N	434.497	1.522	50	20	IDGD	
Cc1cc(Cl)cnc1NC(=O)C(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12	812979186	KRMOTUSAXUOPCD-UHFFFAOYSA-N	442.863	1.734	50	20	IDGD	
Cc1cnc(Br)c(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)c1	812980644	YMELQLPXPDQDRG-UHFFFAOYSA-N	432.234	1.189	50	20	IDGD	
CO[C@@H]1Cc2ccc(NC(=O)C(=O)NNc3ccc(S(=O)(=O)N(C)C)cc3)cc2C1	813033175	IDCSQJBKFHJBIT-QGZVFWFLSA-N	432.502	1.132	50	20	IDGD	
O=C(NNC(=O)[C@@H](O)c1ccc(Cl)cc1)c1cccc(S(=O)(=O)N2CCCC2)c1	813363173	DMLORJOMTNWULT-KRWDZBQOSA-N	437.905	1.619	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@@H](O)c3ccc(Cl)cc3F)CC2)cc1	813487618	JHDXYGAGHMHYQH-NRFANRHFSA-N	448.926	1.786	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@H]2NC(=O)NNC(=O)CNC(=O)c1ccco1	813805923	XDLMKJWODVEDMA-CQSZACIVSA-N	435.481	1.129	50	20	IDGD	
CN(CCOc1ccc(S(N)(=O)=O)cc1)C(=O)NNC(=O)CCCc1ccccc1	814297536	PZKWJKCCJLUXQQ-UHFFFAOYSA-N	434.518	1.408	50	20	IDGD	
COC(=O)C12CCC(C(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)(CC1)CC2	814363632	OOFGGXFIOWZJIL-UHFFFAOYSA-N	437.518	1.212	50	20	IDGD	
CCn1nc(C)c(C(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)n1	814723630	AAUGADIFJOCWTA-UHFFFAOYSA-N	431.456	1.439	50	20	IDGD	
COc1ccc(C(=O)NNc2cnnn2C)cc1S(=O)(=O)N(C)Cc1ccccc1	816771289	GUOOKGQCVYOOCG-UHFFFAOYSA-N	430.490	1.401	50	20	IDGD	
COc1cccc(/C=C(/C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)n2nnnc2C)c1	818029918	RAQBBODCIUYGKP-CYUIRQCWSA-N	440.435	1.742	50	20	IDGD	
NC(=O)CC[C@@H](NS(=O)(=O)c1cccc(C(F)(F)F)c1)C(=O)NNc1ccccc1	825130948	LYASEKCPMLQAMO-OAHLLOKOSA-N	444.435	1.761	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2CC(=O)N(c3ccc(C)c(F)c3)C2)cc1C	844257527	CQSJRYMUJDGGPN-OAHLLOKOSA-N	426.448	1.890	50	20	IDGD	
O=C(COC(=O)CSc1ccc2c(c1)OCCO2)NNC(=O)c1cccc([N+](=O)[O-])c1	849132658	YSWXDWWOFYAOJK-UHFFFAOYSA-N	447.425	1.463	50	20	IDGD	
CCOc1ccc(NS(=O)(=O)c2cc(C(=O)N3CC[C@H](B(O)O)C3)ccc2C)cc1	864233644	JJIWRVKHKVNXNX-INIZCTEOSA-N	432.307	1.883	50	20	IDGD	
O=C([C@H]1CCCCN1C(=O)c1ccc(Br)c(F)c1)N1CC[C@@H](B(O)O)C1	864234691	TZBMQOILXTULTQ-IUODEOHRSA-N	427.079	1.658	50	20	IDGD	
C=CCNC(=S)NNC(=O)c1ccc(Cl)c(S(=O)(=O)NC[C@@H]2CCCO2)c1	913435794	UIYGLCBQPRHKPH-LBPRGKRZSA-N	432.955	1.092	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2CC(=O)N(Cc3ccccc3Cl)C2)c1	915077449	REESKDCMJCXKDT-OAHLLOKOSA-N	449.916	1.553	50	20	IDGD	
C[C@@H]1C[C@@H]1C(=O)Nc1cccc(C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c1	915408133	KRJKBFRHZFBUCO-PXAZEXFGSA-N	440.412	1.807	50	20	IDGD	
COc1ccc2[nH]cc(CC(=O)OCC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)c2c1	915520538	WSKYDWQTGYMJGA-UHFFFAOYSA-N	426.385	1.632	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)CS(=O)(=O)c2cccc(Br)c2)cc1	915594247	YFPIGLCQNKUMRJ-UHFFFAOYSA-N	441.303	1.758	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1	915924994	MJKAHNJMAMLALD-UHFFFAOYSA-N	449.489	1.770	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)NCc1ccc(C(=O)N2CCOCC2)cc1	916248666	LPRHLWICKRRLGA-HNNXBMFYSA-N	444.463	1.596	50	20	IDGD	
COc1ccc2c(c1)C(=NNC(=O)c1cccc(S(=O)(=O)N3CCCCC3)c1)C(=O)N2	916262801	ZRYWKYYOURSWAM-UHFFFAOYSA-N	442.497	1.956	50	20	IDGD	
COCCOc1ccc(CNC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)cc1	916514240	GQLUXPJEFRFZMU-UHFFFAOYSA-N	449.533	1.458	50	20	IDGD	
CN(C)Cc1cccc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1	916569035	YUSAYRMUDXAAMM-UHFFFAOYSA-N	433.534	1.143	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)CN(C)C(=O)c2ccc(Br)o2)c1	917387811	NBIJQAKXAPCUFG-UHFFFAOYSA-N	438.278	1.957	50	20	IDGD	
CC[C@H](NC(=O)NNC(=O)Cn1nc(C)cc1C)c1ccccc1OCC(=O)N(C)C	918224887	TZSXWNDBAMJDFB-KRWDZBQOSA-N	430.509	1.449	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)Cn2c(C)nc3ccccc32)cc1OC	919229341	KBKAIQMIZBEEDW-UHFFFAOYSA-N	426.429	1.366	50	20	IDGD	
CN(C)[C@H](C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)c1ccccc1	920275545	ZMKGHHMCSFBKAX-IBGZPJMESA-N	430.530	1.535	50	20	IDGD	
Cc1nnc(CNC(=O)/C(C#N)=C/c2cn(CCC(N)=O)nc2-c2ccc(Cl)cc2)o1	920851422	LKPZKWAFWLULFR-RIYZIHGNSA-N	439.863	1.994	50	20	IDGD	
CNS(=O)(=O)c1ccc(CC(=O)NNc2nc(-c3ccccn3)nc(C)c2C)cc1	1116578912	HVSCPTCZYDPGKL-UHFFFAOYSA-N	426.502	1.749	50	20	IDGD	
CC(C)n1ncc2c1[C@H](NC(=O)NNC(=O)c1csc(N3CCOCC3)n1)CCC2	1321172796	URQCGLJDHTUCAC-CQSZACIVSA-N	433.538	1.779	50	20	IDGD	
COC(=O)c1cc(C)c(C)c(S(=O)(=O)NNC(=O)c2cncn2-c2ccccc2)c1	1322287431	ZHDBYGDUAWWKGE-UHFFFAOYSA-N	428.470	1.899	50	20	IDGD	
COC(=O)C(=O)NNC(=O)N[C@H]1CCCN(c2c(C)cc(Br)cc2C)C1	1323090679	ZZGIWWYEZVSKJJ-ZDUSSCGKSA-N	427.299	1.538	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)C1(O)Cc2ccccc2C1	1333508586	NJDVMCCUAWEDHT-UHFFFAOYSA-N	442.947	1.135	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)C#CC3(O)CCCCC3)C2)C1	1779062333	LTKKWRGNNLSLPQ-JXFKEZNVSA-N	441.366	1.546	50	20	IDGD	
CC[C@@H](NC(N)=O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@](C)(Cl)CCl)C1	1780711614	KAKTWHXQLZNZLP-COCCGSRQSA-N	437.368	1.184	50	20	IDGD	
COc1cc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)ccc1O	1780745473	CBIRZZYRNAYXDB-YJYMSZOUSA-N	441.322	1.875	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)[C@H]3COc4ccccc4O3)CCO2)C1	1781225569	ZZMXPRGBULPZDV-LSTHTHJFSA-N	443.327	1.893	50	20	IDGD	
O=C(c1cc(O)cc([N+](=O)[O-])c1)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781333439	OJGLHFLICHLIMC-CJNGLKHVSA-N	446.229	1.434	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CC(=O)OC(C)(C)C)C2	1782172050	MFOINLJRBPLMHN-STXHMFSFSA-N	432.945	1.486	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccc4nonc4c3)CCO2)C1	1783347154	AKIQRGWZKSNFEY-SCLBCKFNSA-N	437.294	1.840	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc([N+](=O)[O-])o3)[C@H]2C1	1783357639	CMQOIFZLAFNCOH-MNXVOIDGSA-N	444.282	1.812	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(OC)c(OC)c3)CCO2)C1	1783882786	RWIPXOULLFCOGD-FOIQADDNSA-N	426.897	1.401	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cccc(C#N)c3Cl)CCO2)C1	1783882913	UOBUACAUBNJNRN-KXBFYZLASA-N	426.300	1.909	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H]1C[C@H]1c1ccc(F)cc1)CCO2	1783932723	BGRHZQNKDADLCO-YDHSSHFGSA-N	446.523	1.132	50	20	IDGD	
Cc1c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]3C2)cnn1C	1783967074	AKQIPKBBGRLSJO-XTBFLFJDSA-N	427.343	1.353	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/c3ccc(O)cc3Cl)C[C@@H]21)[C@H](O)CCl	1784094912	VATDLPDZMINGEF-WVSAELBTSA-N	443.327	1.638	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](C)Oc3ccccn3)C2)C1	1784480596	LJHIQIYNKOPEDS-ZRGWGRIASA-N	440.338	1.710	50	20	IDGD	
C[C@H](C(=O)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1)n1ccnc1	1786231988	SHBFCOIWQSBPCZ-MRXNPFEDSA-N	432.289	1.572	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC1(c2ccc(NC(=O)c3cccn(C)c3=O)cc2)CCC1	1786515925	ZCMWURWLCOBPCI-UHFFFAOYSA-N	439.516	1.506	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3(C(F)(F)F)CCC3)[C@H]2C1	1786757826	PLXUOTZLFPWRJS-KKUMJFAQSA-N	448.486	1.072	50	20	IDGD	
Cc1cc(C)n(CC(=O)Nc2ccc(C3(NC(=O)c4cccc(B(O)O)c4)CCC3)cc2)n1	1786893183	FGRMRXIXTWDKBM-UHFFFAOYSA-N	446.316	1.628	50	20	IDGD	
COc1nccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCBr)C[C@@H]32)c1F	1787136279	KQNVWFNRPLGBHE-UBHSHLNASA-N	444.301	1.608	50	20	IDGD	
Cc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)Br)C[C@@H]32)n(C(F)F)n1	1789336716	QCCYYNSLJXQRRK-MNXVOIDGSA-N	449.296	1.963	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3CC[C@H]4CCC(=O)N4C3)[C@H]2C1	1789770225	LRCZXBSRPMBFHL-PXOUGSPUSA-N	425.957	1.385	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cccnc3Cl)C[C@@H]21)[C@H](F)Br	1789922496	NUMLKTXTFOBKAR-ABHRYQDASA-N	448.720	1.948	50	20	IDGD	
Cc1ccc(CCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]3C2)nc1	1789922802	UJLTUPFKCXVGHH-MBGYTDRXSA-N	442.329	1.993	50	20	IDGD	
CCOC(=O)c1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Cl)C[C@@H]32)cc1	1790260717	IQFBZCYFJNOAFC-LUKYLMHMSA-N	426.872	1.991	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/c3cnccn3)C[C@@H]21	1790963347	FQHOQTPTWUBJTF-KOJYPYIBSA-N	437.338	1.643	50	20	IDGD	
CC[C@H]1CC[C@H](C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)CC1	1791103705	SHJIXSBQBBPQCK-XWCXQPFMSA-N	442.365	1.176	50	20	IDGD	
CC1(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)CCCCC1	1791214447	BKBBUDZZNQOBPY-SNRMKQJTSA-N	443.548	1.249	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)Sc3ccccn3)C[C@@H]21	1791256677	UKSHKXIXZAFFEX-VIQHNZTISA-N	441.981	1.796	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)COc3cccnn3)[C@H]2C1	1791604062	MXTYUFGSMSTPIE-AJNGGQMLSA-N	441.326	1.009	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3nc[nH]c3c1)C2	1792870662	HSKIZDXTEGFRSO-MBMVNNNZSA-N	435.322	1.797	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1c(C)noc1C	1794146966	ATILXDOBSQHZFR-XTUBRDOVSA-N	440.504	1.606	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)nc(Cl)c1	1794415599	CCELGDZYWBVTDX-CBRVECNMSA-N	432.702	1.427	50	20	IDGD	
CCOC(=O)C(C)(C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C(C)=N/NC(=O)c1ccc[nH]1	1796893206	RKAWIKUEFDJFBN-BDHJUDLHSA-N	445.520	1.348	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc2c1NC(=O)C2=O	1798209566	UICBTDHZTSAQDX-YFKTTZPYSA-N	434.290	1.857	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2)c1cnc2snnc2c1	1798503789	GTLKLJNOVZNINH-GNXNZQSNSA-N	440.323	1.075	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1cc(C)on1	1798514660	UIUJGLWDRGRVAB-KFHGRSSCSA-N	438.488	1.768	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)c1n[nH]c2c(Cl)cccc12	1799897807	XOXIQKUEHLZFBE-DJBIQUGXSA-N	427.288	1.019	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2)C1CCC2(CC1)OCCO2	1800380183	ITFYHRXGTARDMW-SCAQPMJSSA-N	445.354	1.294	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/c1cc(C)on1)C2	1800642124	YDQBOOPSSQHUAM-UEVDSIMOSA-N	426.311	1.759	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(C)nc1O)C2	1800642353	FLMQBKZLPQCNHH-NEBZKDRISA-N	426.311	1.472	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnn(-c3cccnc3)c1)C2	1800757354	DLQRXVUCQHNXEK-FAYQHZLMSA-N	448.321	1.254	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(C)(C)Oc1ccc(C)cn1)C2	1800977679	VESWNFYMCPLHNK-KYHPRHEASA-N	439.940	1.391	50	20	IDGD	
CC(C)N1CCC[C@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)CBr)C2	1801570527	JVTPAEJAQJHPDK-KSWRQPAISA-N	430.387	1.480	50	20	IDGD	
CC(C)(C)OC(=O)NC12CC(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)[C@@H](O)CCl)C4)(C1)C2	1801866929	CIVUKCUYLFVISC-BJEBVQOXSA-N	441.956	1.672	50	20	IDGD	
CC[C@H](NC(C)=O)C(=O)NC[C@@H]1CCN(C(=O)[C@H](C)Br)[C@@H]1c1cccnc1	1802548843	UNELEOQSWABRPI-OSMBCOQSSA-N	439.354	1.786	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@H](CNC(=O)[C@@H]2CCC(=O)N2)[C@H]1c1cccnc1	1806639874	FQRVGPKBTWEIPF-BFIPOCKSSA-N	427.332	1.602	50	20	IDGD	
Cc1ccc(CC(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)o1	1807373954	GVHMWWOZVKJANY-AUSIDOKSSA-N	447.300	1.225	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)CC(F)(F)C(=O)O)[C@H]1c1cccnc1	1808295131	RODQEOLEWPQEJK-VHRBIJSZSA-N	448.264	1.981	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H](CNC(=O)[C@H](C)NC=O)[C@@H]1c1cccnc1	1808345700	NRMZYWKASKQUHI-CLWVCHIJSA-N	425.327	1.253	50	20	IDGD	
CC/C=C(\C)C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1	1810307054	CMUKITZURNTKMT-UNCLRNMLSA-N	436.516	1.756	50	20	IDGD	
Cn1cc(CC(=O)N2CC[C@@H](CNC(=O)CO[Si](C)(C)C)[C@@H]2c2cccnc2)cn1	1810547993	LAMVGRQMTMZTMT-RXVVDRJESA-N	429.597	1.915	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@@H]1c1cccnc1)c1ccnnc1O	1811231126	XRGOMPJTZOELJQ-YUTCNCBUSA-N	438.257	1.587	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](O)C(C)C)n[nH]1	1814944917	VEKPHDDMHVMAPP-XAIYEHPZSA-N	443.508	1.553	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(C(=O)O)ncn2)n[nH]1	1816156371	WQFHZKFBHBLHCA-IINYFYTJSA-N	436.856	1.458	50	20	IDGD	
CS(=O)(=O)c1cncc(C(=O)N[C@@H]2CCc3nc(NC(=O)[C@H](F)Cl)sc3C2)c1	1817116861	GPXZPEFIFVCPIS-RNCFNFMXSA-N	446.913	1.702	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccncc2F)[nH]n1)c1cccc(B(O)O)c1	1817474830	IDWRNYMMCRPYCU-SFHVURJKSA-N	437.240	1.243	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](C)Br)[nH]n1	1817996421	PVTAMFKVFCFTIB-NHCYSSNCSA-N	429.319	1.632	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CN2CCN(C)CC2)n[nH]1	1818915218	PDBHYFFQALPHJV-UKRRQHHQSA-N	441.374	1.433	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCc2nc(N)n[nH]2)n[nH]1	1819286233	PALGJGYUVMUTCP-APPDUMDISA-N	443.339	1.971	50	20	IDGD	
COc1ccc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@@H](C)Br)CC3)nn1	1821073135	NDKYXZXYWCRLBI-RKDXNWHRSA-N	440.323	1.951	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](F)Br)CC2)c1c[nH]c(=O)cn1	1821472497	NUVWZYNHPDHPDZ-KGFZYKRKSA-N	430.259	1.143	50	20	IDGD	
Cn1cccc1C(=O)C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1	1823013871	KROGPLDZXDOVTE-ISVAXAHUSA-N	443.298	1.967	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@H]1CCc2nc(NC(=O)C3(F)CC3)sc2C1	1824843681	BFNURSHAOZUZCH-DLDHGHKKSA-N	432.481	1.691	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)CNC(=O)C(F)(F)F)sc2C1	1826144959	ZILIMYAPJZFWKX-YUMQZZPRSA-N	426.848	1.751	50	20	IDGD	
C[C@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1)n1ccnc1	1827055847	LYRYZQMAZONAOH-UTKZUKDTSA-N	438.337	1.057	50	20	IDGD	
O=C(CCc1ccoc1)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2	1827106550	MJBUTVJJNPACNQ-MRXNPFEDSA-N	439.302	1.275	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cnncc2C(=O)O)CC1	1829254672	JLGHYHVOOJUNFI-SJORKVTESA-N	438.912	1.662	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc([N+](=O)[O-])o3)CCO2)C1	1829479043	CHMYDLKNXKUBHV-GOSISDBHSA-N	429.857	1.523	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)n3cc(C)cn3)C2)C1	1831657122	LXEQYDWGCKMAIZ-ZWOKBUDYSA-N	426.945	1.616	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)C(C)(F)F)CCO2	1831686477	GVAIPAHUAPTBOM-ACJLOTCBSA-N	426.888	1.378	50	20	IDGD	
O=C(Cc1cc([N+](=O)[O-])ccc1F)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1832430250	ZRHNIORVBRLXHJ-AEFFLSMTSA-N	447.822	1.267	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)c3cc(O)n(C)n3)CC2)CC1	1833531538	SIFLFOWWVRDTJN-INIZCTEOSA-N	425.961	1.718	50	20	IDGD	
CC(=O)NCC(C)(C)C(=O)NC1CCN(C2CCN(C(=O)C(Cl)Cl)CC2)CC1	1833546113	GCWKLIYARKIEOW-UHFFFAOYSA-N	435.396	1.524	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccccc3O)CCO2)C1	1833759055	WFNYBVGSFMVNLT-FZKQIMNGSA-N	427.295	1.246	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)Cc3cccs3)C2)C1	1834822512	RSSRUNXHKJHISM-QGZVFWFLSA-N	431.352	1.532	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(CN(C(=O)C#Cc3ccccc3)CCO2)C1	1835100441	SQFHLCBNCCYYRY-JOCHJYFZSA-N	430.577	1.346	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cn4ncccc4n3)CC2)CC1	1835395482	YFMJNGQLYOKUET-QGZVFWFLSA-N	432.956	1.932	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3cc(CO)on3)CC2)CC1	1836189430	ROGXUIMQXFXBHQ-GFCCVEGCSA-N	443.342	1.136	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)c1cc(F)ccc1F	1836220973	KYUHVXRWFBYHTJ-GOSISDBHSA-N	429.895	1.750	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cn4ccsc4n3)CCO2)C1	1837049119	PSZMBTZWOAYKKT-SCLBCKFNSA-N	426.926	1.483	50	20	IDGD	
Cc1cc[nH]c1C(=O)N1CCC(OC2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1	1837302479	RUSCHFFIZBNNGI-UHFFFAOYSA-N	433.553	1.308	50	20	IDGD	
COc1nn(C)cc1C(=O)N1CCC(OC2CCN(C(=O)C(Cl)Cl)CC2)CC1	1837378367	YQJYRXZAMGHCPY-UHFFFAOYSA-N	433.336	1.845	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)N1CCC(OC2CCN(C(=O)[C@H](C)Br)CC2)CC1	1838069571	WMOARLAUSOZRKJ-WFASDCNBSA-N	447.374	1.215	50	20	IDGD	
C=CCC(F)(F)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2	1839155245	PJQZROQNHWJALI-CVEARBPZSA-N	429.291	1.891	50	20	IDGD	
O=C(c1cccc(F)c1[N+](=O)[O-])N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1839356793	KRVZVBARZVGBPX-WMLDXEAASA-N	433.795	1.338	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc4c3NC(=O)C4)CCO2)C1	1839571898	RZGJYPLKSFHMQO-QFIPXVFZSA-N	449.935	1.516	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](Br)CC)CCO2	1839965513	APYGVCNSNCASEL-DVOMOZLQSA-N	425.751	1.634	50	20	IDGD	
CC(C)n1nccc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)Br)CCO2	1840033383	BYPJJNRUKHXIDR-KBXCAEBGSA-N	443.342	1.317	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)Br)CCO2	1840036415	JSGBXJPVJTYMLW-COPLHBTASA-N	442.148	1.010	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CC=CC[C@H]1C(=O)OC)CCO2	1840143564	YAQGACDLIHOUKI-PZTGFMGMSA-N	442.940	1.216	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc4ncccc34)C2)C1	1840152623	NRLKXYQTSNXGAR-PGRDOPGGSA-N	447.919	1.559	50	20	IDGD	
O=C(c1ccc2nccn2c1)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840188515	NWEKCTIKMYWUDS-GOSISDBHSA-N	427.288	1.208	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)CCc2nnc(C)s2)C1	1842054530	SIDGBFGLTKIEIU-LPYMAVHISA-N	443.533	1.117	50	20	IDGD	
O=C(c1n[nH]c2cc(Cl)ccc12)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843013917	CPXCQGVBOHIWJJ-UHFFFAOYSA-N	438.680	1.027	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC2(CCCN2C(=O)Cn2cccn2)C1	1843088692	BNQAMEPVNLNNTR-AWEZNQCLSA-N	425.917	1.219	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)C1(c3ccccc3)CCC1)C2	1844265204	FVVAHKJZYONYJA-UHFFFAOYSA-N	433.512	1.624	50	20	IDGD	
C[C@H](NC(=O)c1ccc(F)cc1)C(=O)N1CCCC12CN(C(=O)CO[Si](C)(C)C)C2	1845003804	YQSJDIWSNBYTDI-HNNXBMFYSA-N	435.572	1.999	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)CN1CCN(C(=O)OC(C)(C)C)CC1)C2	1845168740	WUGXZDICUHOBSO-MRXNPFEDSA-N	442.988	1.760	50	20	IDGD	
COc1ccc(OC)c(C(=O)CCC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](O)CCl)c1	1847564836	ZPHLDOWZQFSKHL-XYJFISCASA-N	438.908	1.468	50	20	IDGD	
Cn1cc(CC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)cn1	1848098786	YVJMERPGPGPFEV-JYJNAYRXSA-N	439.944	1.297	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)/C=C/c1ccccc1)C(=O)NNC(=S)NC(C)(C)C	14894997	GPLFGYZTCPVEMQ-FQNOHDAGSA-N	444.648	1.992	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCCCCC2)cc1C(=O)NNc1nnc(C)c(O)n1	29066919	SESJDVWEKHEQDN-UHFFFAOYSA-N	436.494	1.216	50	20	IDGD	
CC(C)N1C(=O)c2ccc(C(=O)NNC(=O)c3cc(Cl)ccc3O)cc2S1(=O)=O	108062655	FGMNYKQWZXTOMM-UHFFFAOYSA-N	437.861	1.673	50	20	IDGD	
Cc1ccc(S(=O)(=O)NC[C@@H]2CCCN(CC(=O)NNC(=O)c3ccccc3)C2)cc1	725811905	JNJXRVDFUCYNJX-SFHVURJKSA-N	444.557	1.447	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)c1cn(-c2ccccc2)nc1-c1ccccc1)N1CCN(C)CC1	725877682	FOHOFUOPUGYXFG-SFHVURJKSA-N	432.528	1.936	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)c2oc3ccccc3c2CS(C)(=O)=O)cc1	726659440	HJTFEZQYGVPWNY-UHFFFAOYSA-N	444.465	1.904	50	20	IDGD	
Cc1noc(CNC(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)n1	727230798	UPJQHBWDTJCQAI-UHFFFAOYSA-N	436.475	1.385	50	20	IDGD	
C[C@H](CC(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1)NC(=O)C1CCCCC1	727365757	YJCSUUXNDJUZPA-LLVKDONJSA-N	444.941	1.224	50	20	IDGD	
C#Cc1cccc(NC(=S)NNC(=O)c2ccc(F)c(S(=O)(=O)NC3CC3)c2)c1	727500793	GTBCYYRHXOBKNR-UHFFFAOYSA-N	432.502	1.879	50	20	IDGD	
C[C@H]1CCCCN1C(=O)CN1CCN(C(=O)NNC(=O)CCCc2ccccc2)CC1	727845962	CLUSOUGBBOLRFR-IBGZPJMESA-N	429.565	1.769	50	20	IDGD	
Cc1nc2c(C(N)=O)cnn2c(C)c1CCC(=O)NNC(=O)c1cccc(OC(F)F)c1	728485391	XWDHZVLSCWVWPS-UHFFFAOYSA-N	446.414	1.440	50	20	IDGD	
Cc1ccccc1CN1CCN(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)CC1	728958160	USZDJSZTCJCUSE-UHFFFAOYSA-N	437.548	1.560	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1ccc(CSc2nc[nH]n2)cc1	728984029	YUJVLVWGXAUGAI-UHFFFAOYSA-N	438.517	1.565	50	20	IDGD	
C[C@@H](CC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)S(=O)(=O)c1ccc(F)cc1	729176976	PHCNXMGJGMCAPB-LBPRGKRZSA-N	442.490	1.243	50	20	IDGD	
Cc1cccc(N2C(=O)N[C@@H](CCC(=O)NNC(=O)c3ccc4c(c3)OCCO4)C2=O)c1	730742722	VEUAKQAVCYCWTD-INIZCTEOSA-N	438.440	1.432	50	20	IDGD	
Cc1nc(C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)nn1-c1ccccc1	731594746	LKTBGLUALIMAID-UHFFFAOYSA-N	431.456	1.941	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)c1ccc(Cl)c(S(=O)(=O)N2CCC[C@@H](C)C2)c1	731851860	UOZFNJRDEKRRPF-LLVKDONJSA-N	439.925	1.867	50	20	IDGD	
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC(C(=O)NNc2nc(-c3cccnc3)no2)CC1	732111026	XJHQGGOFNGRFNZ-UHFFFAOYSA-N	446.493	1.016	50	20	IDGD	
N#Cc1ccc(N2C(=O)N[C@H](CCC(=O)NNC(=O)c3ccc(Cl)cc3O)C2=O)cc1	733806363	ZVSHIGQJZKBPMZ-OAHLLOKOSA-N	441.831	1.583	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N(C)Cc2cn[nH]c2)cc1	733984684	ZSVLUNIWKKNJEF-MFOYZWKCSA-N	433.472	1.723	50	20	IDGD	
CN(CC(=O)NNc1cc(C(F)(F)F)nc(-c2cccnc2)n1)[C@@H]1CCS(=O)(=O)C1	734259109	QEBAIZGNSVFCHD-GFCCVEGCSA-N	444.439	1.119	50	20	IDGD	
CC(=O)NCC(=O)N1CCc2cc(C(=O)NNC(=O)COc3cc(C)ccc3C)ccc21	735646686	HBICDRSKFTWGPY-UHFFFAOYSA-N	438.484	1.169	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCCNc2nccc(C(F)(F)F)n2)cc1OC	738450485	ZHDYNKNXBLAAPG-UHFFFAOYSA-N	428.371	1.569	50	20	IDGD	
CCc1cc(NNC(=O)[C@H](CC)N=c2nn[nH]n2-c2ccccc2)nc(-c2ccccn2)n1	738538177	FXFMFVGNZCBMKT-KRWDZBQOSA-N	444.503	1.832	50	20	IDGD	
C[C@H](Cc1ccccc1F)C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	738543529	QURYXKXXPDVFQV-OAHLLOKOSA-N	435.525	1.479	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1)NNC(=O)c1cccc(Cl)c1	740887222	QWNULNMMAKPOAX-UHFFFAOYSA-N	445.863	1.467	50	20	IDGD	
Cc1cccc(C=NNC(=O)C[C@@H](C(=O)NN=Cc2cccc(C)c2)N2CCOCC2)c1	741767441	VRLUWOBFIQHMHQ-QFIPXVFZSA-N	435.528	1.995	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)c1cn(Cc2cccs2)nn1	742472104	XRUAFMZJNKUTOP-UHFFFAOYSA-N	436.291	1.990	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)CN2CCN(C(=O)c3cccc4ccccc34)CC2)cc1	744386278	JLAIGRPPJOYREE-UHFFFAOYSA-N	441.491	1.930	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CN2CCN(C(=O)Cc3c[nH]c4ccccc34)CC2)c1	744386868	MRGNAWBPMMBSDE-UHFFFAOYSA-N	444.495	1.187	50	20	IDGD	
Cc1cc(=O)c(C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)nn1-c1ccccc1F	744595189	OADOHVPZXSZDPG-UHFFFAOYSA-N	449.398	1.170	50	20	IDGD	
CC(=NNC(=O)[C@H]1COCCO1)c1ccc(S(=O)(=O)Nc2ccc(C(=O)O)cc2)cc1	745210526	DSTNNONXKBYUKJ-GOSISDBHSA-N	447.469	1.441	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)NCCc2cccc(C(=O)N(C)C)c2)cc1C	745847416	QATFWSWRVAEAQY-UHFFFAOYSA-N	425.489	1.517	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2ccc(NNC(=O)Cc3cc[nH]n3)c([N+](=O)[O-])c2)cc1	746090780	RCDIPSOCPFBNCL-UHFFFAOYSA-N	446.445	1.813	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)CCSc2n[nH]c(C)n2)c2ccccc2c1=O	746096374	SVWJBMOSHHGVLX-UHFFFAOYSA-N	443.533	1.957	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)c2cccc(CN3CCN(C)CC3)c2)cc1OC	746098955	ROOXZLVLBDWPMV-UHFFFAOYSA-N	426.517	1.916	50	20	IDGD	
CCCCNC(=O)NNC(=O)CN1CCN(Cc2ccc(Br)cc2F)CC1	746165182	NCLVWNSYPUDFKC-UHFFFAOYSA-N	444.349	1.836	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)Cc1ccc(S(=O)(=O)N2CCCC2)s1	746545700	SNWAITQEWAUBRA-UHFFFAOYSA-N	447.542	1.113	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)[C@@H]1CS[C@H](Cc2ccccc2F)C(=O)N1	746636757	FOTFTBPDISIYNV-DLBZAZTESA-N	441.488	1.006	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NCC(=O)NNc2cccc([N+](=O)[O-])c2)c1	748005826	BJLAFJPQHHPHNL-UHFFFAOYSA-N	449.489	1.498	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@@H]2CCCN2C(=O)CC(C)(C)C)c2ccccc2c1=O	748213630	CHVNPVNVWIQMBK-INIZCTEOSA-N	427.505	1.605	50	20	IDGD	
NC(=O)c1ccc(C(=O)NNC(=O)[C@H]2Cc3ccccc3CN2Cc2ccccc2)nc1	748841087	JDNVAVMOJZYDJA-OAQYLSRUSA-N	429.480	1.569	50	20	IDGD	
CC(C)NS(=O)(=O)Cc1ccc(CNC(=O)NNC(=O)CCc2ccccc2)cc1	749934229	VFRFJCYVWRYMST-UHFFFAOYSA-N	432.546	1.978	50	20	IDGD	
CC[S@](=O)[C@@H]1CCC[C@@H](NC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)C1	750267723	OKJMEEOENGYRAN-SIJNZQJQSA-N	443.595	1.312	50	20	IDGD	
CNC(=O)Cc1noc(COC(=O)/C(C#N)=C\c2cc(C)n(C[C@H]3CCCO3)c2C)n1	750318003	JEWJFPIJNWNGSL-QOTSWMAJSA-N	427.461	1.606	50	20	IDGD	
CC[C@@H](C)c1ccccc1N1C[C@H](C(=O)NNC(=O)CNC(=O)c2ccco2)CC1=O	751206800	NONXJXNKMZSDNQ-HUUCEWRRSA-N	426.473	1.723	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)c1cccc(N2C(=O)c3ccccc3C2=O)c1	751207098	RODCPWVGGJPACK-UHFFFAOYSA-N	432.392	1.271	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)CCNC(=O)C2CCCCC2)c2ccccc2c1=O	751293204	GNKOBSVPICBMDL-UHFFFAOYSA-N	427.505	1.825	50	20	IDGD	
COc1ccc(C(=O)NNC(=S)N[C@@H](C)C2CC2)cc1S(=O)(=O)NC(C)(C)C	751621131	QSNBMQVMJWEQIS-NSHDSACASA-N	428.580	1.679	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccc(Cl)cc2C(F)(F)F)cc1O)C(=O)NC1CC1	752790171	VUWFCAVXPHBXDG-UHFFFAOYSA-N	431.758	1.290	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNS(=O)(=O)Cc1cccc(Cl)c1	753015342	CXVDJIPEFHEODR-UHFFFAOYSA-N	430.939	1.706	50	20	IDGD	
Cc1c(Br)cc(C(=O)NNC(=O)CNC(=O)c2cccs2)cc1[N+](=O)[O-]	753126039	DCFDTLNATGFEHK-UHFFFAOYSA-N	441.263	1.918	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)N(C)CC(=O)NNc2ccc(C#N)c(Cl)c2)cc1	753303248	UNXBYJRTPOEETO-UHFFFAOYSA-N	435.893	1.934	50	20	IDGD	
O=C(Cc1cc[nH]n1)NNC(=O)c1sccc1S(=O)(=O)NC1CCCCCC1	755288077	DQFHUAJQZBJOBB-UHFFFAOYSA-N	425.536	1.476	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)Nc1cccc(S(=O)(=O)N2CCCCC2)c1	755359362	KKEADFVLNQRIOO-CQSZACIVSA-N	428.511	1.065	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)Nc2ccc(NC(=O)CN3CCOCC3)cc2)c1O	755598228	FAWKGYUSLFVFPW-UHFFFAOYSA-N	443.460	1.138	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)Nc2ccc(C)c(-n3cnnn3)c2)cc1	755687921	ZMEPVFFISSSORE-CQSZACIVSA-N	425.449	1.990	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(Br)c(C(=O)NNc2cc(C)ccn2)c1	755838491	MZMRLEVLQSVVDD-UHFFFAOYSA-N	443.323	1.834	50	20	IDGD	
O=C(NNC(=O)c1cc2c(s1)CCC2)Nc1cccc(N2CCS(=O)(=O)CC2)c1	756204493	BQIWCGITDDDHIS-UHFFFAOYSA-N	434.543	1.938	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)Nc2ccn(CCN(C)C)n2)c2ccccc2c1=O	756766793	ZFLXDWNHDURDQD-UHFFFAOYSA-N	426.481	1.202	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)Nc2ccc(S(=O)(=O)NCC3CC3)cc2)cc1	756784435	NGBWSQBDIAIDMV-UHFFFAOYSA-N	432.502	1.915	50	20	IDGD	
COC(=O)c1cncc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1	757720967	IYGWPBXSLKWCFF-UHFFFAOYSA-N	447.473	1.119	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)ccc1Cl	758067152	GZCGPJNWNKOXRC-UHFFFAOYSA-N	425.894	1.739	50	20	IDGD	
O=C(NC[C@H](c1ccccc1Cl)N1CCCC1)NNC(=O)C(=O)Nc1ccccn1	758671593	BUZZGSXPNCQBEH-MRXNPFEDSA-N	430.896	1.841	50	20	IDGD	
CO[C@@](C)(C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)c1ccccc1F	760065918	KHKSTKGROHRTBU-OAQYLSRUSA-N	449.504	1.933	50	20	IDGD	
CCc1ccccc1OCC(=O)NNS(=O)(=O)c1cccc(S(=O)(=O)CC)c1	760335559	SAUJFCPXFSDRPD-UHFFFAOYSA-N	426.516	1.431	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)c1ccc(CCNS(C)(=O)=O)s1	761450935	OBIAWDWSZSYKKF-UHFFFAOYSA-N	449.558	1.213	50	20	IDGD	
CSc1ccc(S(=O)(=O)N2CCN(S(=O)(=O)CBr)CC2)cc1	763206946	YRSGANNDVAUHRV-UHFFFAOYSA-N	429.383	1.397	50	20	IDGD	
CC(C)(C)OC(=O)NCCOc1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2)cc1	763424572	BXCKQCXAELDVOK-UHFFFAOYSA-N	442.472	1.990	50	20	IDGD	
CCNC(=O)c1ccc(C)c(NC(=O)C(=O)NNC(=O)c2ccccc2Br)c1	763483171	OFGBTINHBNIKDR-UHFFFAOYSA-N	447.289	1.907	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(CC(=O)N3CCSCC3)cc2)c(C)o1	763586168	LAUYUIOWIMQTTM-UHFFFAOYSA-N	444.513	1.414	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(N2CCOCC2)cc1C	763656334	APHZZPVGYHIALS-UHFFFAOYSA-N	442.472	1.005	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccccc1C(=O)NC(C)(C)C	763656833	FOWYIPHBXIXMSV-UHFFFAOYSA-N	442.472	1.388	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2cccc(CS(C)(=O)=O)c2C)c1	763666067	WGNDFIVSZNGBFX-UHFFFAOYSA-N	447.513	1.321	50	20	IDGD	
CC[C@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2cc(C)ccc2C)cc1	763669624	XQZWNCKQEZSQEQ-INIZCTEOSA-N	440.500	1.997	50	20	IDGD	
O=C(COc1ccc(Cl)cc1)NNC(=O)C(=O)N1C[C@H]2CCCN2c2ccccc21	763685958	GLTBWMBLMDAEOE-OAHLLOKOSA-N	428.876	1.882	50	20	IDGD	
COC(=O)c1cc(OC)ccc1NC(=O)C(=O)NNC(=O)COc1ccc(Cl)cc1	763695423	UIXHOPNWBMSUQP-UHFFFAOYSA-N	435.820	1.300	50	20	IDGD	
CCCN(CCC)C(=O)c1cccc(C(=O)NNC(=O)CNC(=O)c2cccnc2)c1	763825733	VWEJFPLAUVHDTI-UHFFFAOYSA-N	425.489	1.535	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccn(CC(F)(F)F)n2)cc1	763860692	KKEVESDGUPDRFT-NSHDSACASA-N	443.382	1.398	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2scc(C(=O)OC)c2C)cc1	763860744	LHSMGFOIMXOBCP-GFCCVEGCSA-N	449.485	1.795	50	20	IDGD	
Cc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccc(F)cc1	763873832	ZGDFWJBZJUBVGP-CYBMUJFWSA-N	430.436	1.389	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(C(=O)OC)n(C)c2)cc1OC	763912297	VHXOJBFJFURSRA-UHFFFAOYSA-N	432.433	1.009	50	20	IDGD	
CNC(=O)c1ccc(OC)c(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CC[C@H](C)C3)c1	763951201	ZWEXXFUSUYOXBL-NSHDSACASA-N	444.513	1.641	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)cc1OC(C)C	763996086	UVHXKEJVCMQMPN-UHFFFAOYSA-N	439.266	1.973	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1cc(C)nn1C1CCOCC1	764019290	KHUSGYBQUBKRNH-UHFFFAOYSA-N	435.868	1.605	50	20	IDGD	
O=C(NNC(=O)c1ccc(F)cc1Br)C(=O)Nc1ccc(-n2nccn2)cc1	764086926	XDJFNLJMLURWMZ-UHFFFAOYSA-N	447.224	1.569	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2cc(F)c(Br)cc2F)c1O	764130054	ABAJDEJPLSZLHL-UHFFFAOYSA-N	444.188	1.841	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)C(=O)Nc1ccc(C(=O)NC2CCOCC2)cc1	764320412	FYNVVSKKFQLQFG-UHFFFAOYSA-N	442.447	1.063	50	20	IDGD	
C[C@@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3cnn(-c4ccccc4)c3)cc2)CCO1	764352036	XQAXRYJNFCFSLK-MRXNPFEDSA-N	448.483	1.497	50	20	IDGD	
COCCOc1ccc(C(F)(F)F)cc1NC(=O)C(=O)NNC(=O)c1ncccc1C	764385867	NVARMTJFOGSSCE-UHFFFAOYSA-N	440.378	1.834	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)n(Cc2ccccc2)n1	764399938	BJCSABHLKFLDLQ-UHFFFAOYSA-N	439.497	1.824	50	20	IDGD	
COc1nccnc1NNC(=O)C1CCN(S(=O)(=O)c2ccc3c(c2)CCC3)CC1	764471314	UACKOYLNTWEXMI-UHFFFAOYSA-N	431.518	1.518	50	20	IDGD	
Cc1c(S(=O)(=O)NNC(=O)c2cccc(Br)c2)cnn1-c1ccccn1	765099725	XSEHGYVDKHDDRB-UHFFFAOYSA-N	436.291	1.962	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3cn(Cc4ccccc4)nn3)n[nH]2)cc1OC	765595680	BUOSTSRYJUNWEK-UHFFFAOYSA-N	447.455	1.809	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](OCC(=O)OCC(=O)NNC(=O)c2cccs2)C1	768067646	ZUGMQJAXXDIIHV-ZDUSSCGKSA-N	441.506	1.468	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccc(F)cc1C(=O)N(C)C	768238772	USDBDJMECCMQSZ-LLVKDONJSA-N	434.399	1.220	50	20	IDGD	
Nn1c(SCC(=O)NNC(=O)c2ccccc2Cl)nnc1-c1n[nH]c2c1CCC2	768429551	VVTYFEKVIXLRBE-UHFFFAOYSA-N	432.897	1.077	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)CN1C(=O)N[C@](C)(c2ccccc2)C1=O	768613738	XXVJREZKERFDMP-HXUWFJFHSA-N	446.485	1.009	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)CN1C(=O)N[C@]2(CCCC[C@@H]2C)C1=O	768635277	XCWAORVZDSHXQL-BUXKBTBVSA-N	438.506	1.043	50	20	IDGD	
CC(=O)N1CCN(S(=O)(=O)c2ccc(C(=O)OC[C@@H](C)CBr)cc2)CC1	770320956	GPCAHTATRKUOSN-ZDUSSCGKSA-N	447.351	1.727	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)N2CCN(c3nccn4cnnc34)[C@@H](C)C2)c1C	771495135	SDFOUKVRFRHGLS-RONKMWSCSA-N	448.531	1.833	50	20	IDGD	
O=C(NNc1ccc(F)c([N+](=O)[O-])c1)c1ccc(S(=O)(=O)NC[C@@H]2CCCO2)cc1	771590719	OUKNBVGNEUZPJZ-AWEZNQCLSA-N	438.437	1.948	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)N2CCC(C(=O)NCCO)CC2)c(C)n1C[C@H]1CCCO1	771768297	HCWDVWICYLCLHQ-DMMSUNFISA-N	428.533	1.538	50	20	IDGD	
CC[C@H](C)C(=O)N1CSC[C@@H]1C(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772898559	SACHQJKNRNDDBJ-SMDDNHRTSA-N	426.926	1.051	50	20	IDGD	
Cc1cc(S(=O)(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)sc1C	773229342	BGRHTVVSEHNARN-UHFFFAOYSA-N	436.559	1.132	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@@H]1CN(C(=O)NNC(=O)Cn2ccc3ccccc32)CCO1	773270943	AJHFSMNCSKFVGY-MRXNPFEDSA-N	431.493	1.608	50	20	IDGD	
O=C(COC(=O)[C@H]1CCN(C(=O)OCc2ccccc2)C1)NNC(=O)c1cccs1	773578144	QPAIUHXEIIPYED-HNNXBMFYSA-N	431.470	1.711	50	20	IDGD	
CN1CCN(C(=O)NNC(=O)c2cc(Br)c(O)c(Br)c2)CC1	773672755	IXEMCHWRALWELS-UHFFFAOYSA-N	436.104	1.519	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1cnn(C2CCCC2)c1C	773733008	VMHBERIWFRQBDJ-UHFFFAOYSA-N	435.506	1.801	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccccc1CCN(C)C	774010019	UJIQYWMCFMOCNG-CQSZACIVSA-N	432.908	1.998	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)on1)Nc1ccnn1[C@@H]1CCS(=O)(=O)C1	776055152	HGBHAHFCXUSNMQ-CYBMUJFWSA-N	430.446	1.364	50	20	IDGD	
CSC[C@@H](C(=O)NNc1cccc(S(C)(=O)=O)c1)N1C(=O)[C@H]2CCCC[C@H]2C1=O	776537362	CAGDQAFPRCWZHB-XHSDSOJGSA-N	439.559	1.440	50	20	IDGD	
COC(=O)N1CCC([C@@H](C)NCC(=O)NNC(=O)c2cc(Cl)ccc2OC)CC1	776809129	MSGOKGHAXDSFBG-GFCCVEGCSA-N	426.901	1.566	50	20	IDGD	
CC(C)Cc1cc(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc(O)n1	777273763	DWQKWFUHHMRGAV-UHFFFAOYSA-N	426.882	1.361	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NC[C@H]2COC3(CCCCCC3)O2)nc1	777763574	GFSCDSCASGCGTR-HNNXBMFYSA-N	441.554	1.860	50	20	IDGD	
CCOc1cnc(C(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)cn1	777770342	ZUZQHBFKQHCGBI-UHFFFAOYSA-N	447.498	1.812	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)c2cc(S(=O)(=O)N(C)C)cn2C)c1	778524975	SLBBVNZIUZQJHD-UHFFFAOYSA-N	436.534	1.547	50	20	IDGD	
O=C(NNc1cccnn1)c1cc(I)ccc1N1CCOCC1	779086804	CISLBSQWJLCIRP-UHFFFAOYSA-N	425.230	1.675	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)c2cnn(Cc3ccc(OC)c(OC)c3)c2)cc1	779368117	HYBKJQJFZRFNNB-UHFFFAOYSA-N	439.472	1.830	50	20	IDGD	
O=C(NNC(=O)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(F)cc1)c1cccc(Cl)c1	780170957	FMDXDYQHWFLZJZ-ZBFHGGJFSA-N	441.868	1.064	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)N[C@@H](C)c2ncn(C)n2)c2ccccc2c1=O	780704592	PTNZEGGVCSLWFM-ZDUSSCGKSA-N	426.481	1.420	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(CNC(=O)NNC(=O)c2cccc(OC(F)F)c2)c1	782538119	SBNCGCGGHHANIA-UHFFFAOYSA-N	442.444	1.683	50	20	IDGD	
CC(C)Oc1ccc(NC(=O)C(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1	782897381	OFKMJENVTDITBM-UHFFFAOYSA-N	433.490	1.167	50	20	IDGD	
CCNC(=O)N1CCc2ccc(NC(=O)C(=O)NNc3ncnc4ccsc34)cc21	783255346	SHJGLRACUDCDAX-UHFFFAOYSA-N	425.474	1.865	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2cc(F)c(N3CCCCC3)c(F)c2)CCS(=O)(=O)C1	783425703	CWTBWDNOPNAJRW-GOSISDBHSA-N	430.477	1.092	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2cccc([N+](=O)[O-])c2C)ccc1N1C(=O)CCC1=O	784358676	XNKBZQWMMTXTLN-UHFFFAOYSA-N	425.401	1.947	50	20	IDGD	
O=C(NNc1nccnc1Cl)C(=O)Nc1cccc(N2CCN(CC3CC3)CC2)c1	784776373	HVZIMXYAOZPTLD-UHFFFAOYSA-N	429.912	1.744	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNc2ccccn2)cc1S(=O)(=O)N(CC)CC	784796582	QVMARSIWNYBGJV-UHFFFAOYSA-N	435.506	1.593	50	20	IDGD	
C[C@@H](c1ccc(NC(=O)C(=O)NNc2cccc(S(C)(=O)=O)c2)cc1)N1CCOCC1	784844775	NSWONQURLQBIRU-HNNXBMFYSA-N	446.529	1.565	50	20	IDGD	
CN(C)C(=O)c1cc(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)ccc1Cl	785068074	SPXWQIBJWBYANQ-UHFFFAOYSA-N	442.863	1.018	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNc2nccn(C)c2=O)sc2c1CC[C@H](CC)C2	785090726	XSFYVVBTSROLET-NSHDSACASA-N	447.517	1.615	50	20	IDGD	
Cc1nc(Cn2cc(C(=O)OCC(=O)NN=C(c3ccccc3)c3ccccc3)nn2)no1	787159678	LFHOWNRNVIQQSF-UHFFFAOYSA-N	445.439	1.743	50	20	IDGD	
Cc1ccc(Br)nc1C(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	787218300	XCJQBENMDAKRSS-UHFFFAOYSA-N	425.670	1.883	50	20	IDGD	
O=C(NCc1ccccc1)NNC(=O)[C@H]1CCCN1S(=O)(=O)c1cccc([N+](=O)[O-])c1	787591847	ZHDXDQPTLVCZQA-QGZVFWFLSA-N	447.473	1.279	50	20	IDGD	
Cc1cnc(Cl)c(NC(=O)C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c1	787894157	LWAQKYBXUURICE-UHFFFAOYSA-N	444.923	1.342	50	20	IDGD	
Cn1nc(-c2ccc(F)cc2F)cc1NC(=O)C(=O)NNC(=O)COc1ccccc1F	789732764	VIEOEVSOGUMBKP-UHFFFAOYSA-N	447.373	1.669	50	20	IDGD	
CN(C)C(=O)c1cc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)ccc1F	789812953	OUAKFAYWHGDLFP-YJBOKZPZSA-N	442.447	1.186	50	20	IDGD	
COc1cc(NNC(=O)CCNc2ccc(S(N)(=O)=O)cc2[N+](=O)[O-])ccc1Cl	790179415	QRXHVASDJLAWTK-UHFFFAOYSA-N	443.869	1.850	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNc2cccc(F)c2[N+](=O)[O-])cccc1C(=O)N1CCOCC1	790999094	WQXGKXUZSKTXQY-UHFFFAOYSA-N	445.407	1.597	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(N3C(=O)CCCC3=O)c2)cc1F	792354657	AWWQWQAIXZXEQN-UHFFFAOYSA-N	426.404	1.577	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2cccc(NC(=O)N(C)C)c2C)c1	792355807	WBIAHGPVDIFQAP-UHFFFAOYSA-N	441.488	1.870	50	20	IDGD	
Cc1c(CC(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)cnn1C	794182158	HWEJMKYFWVAPQA-UHFFFAOYSA-N	430.468	1.490	50	20	IDGD	
CCn1nc(C)c(CC(=O)NNC(=O)c2ccc(CSc3nncn3C)cc2)c1C	794183051	PVFWOOHVYWTNKB-UHFFFAOYSA-N	427.534	1.944	50	20	IDGD	
O=C(NN=C1CCOc2cc(F)ccc21)c1cccc(S(=O)(=O)N2CCOCC2)c1	794854036	ANOCDJOXJHJMLG-UHFFFAOYSA-N	433.461	1.763	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NC[C@H]3CCC(F)(F)C3)nc2)CC1	797558629	CVPJUDXEPIYSQT-ZDUSSCGKSA-N	432.497	1.079	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)N2CCN(c3ccc(F)cc3)CC2)cc1C	798310337	QQECJKGIZVHQEC-KRWDZBQOSA-N	441.507	1.739	50	20	IDGD	
C[C@@H]1[C@H](NC(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)CC(=O)N1Cc1ccccc1	798532285	PDNQYMFTIJTBPM-MLGOLLRUSA-N	427.417	1.434	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)NCCNS(=O)(=O)c2ccc(F)cc2F)cc1	799673227	VEICZYZXHQLRQH-UHFFFAOYSA-N	426.445	1.450	50	20	IDGD	
CCc1cccc(C)c1NNC(=O)C(=O)Nc1cccc(N2CCS(=O)(=O)CC2)c1	799842724	VUWDFNBMSXJPRZ-UHFFFAOYSA-N	430.530	1.874	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1ccncc1C(F)(F)F	800692108	LTYWDVNUJSLSIE-UHFFFAOYSA-N	430.408	1.878	50	20	IDGD	
CC(C)N1C(=O)c2ccc(C(=O)NNC(=O)Nc3cc(F)cc(F)c3)cc2S1(=O)=O	802003347	OAXJSTBTGNGWLM-UHFFFAOYSA-N	438.412	1.984	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@H](O)c2cccc(C(F)(F)F)c2)cc1	803397430	UXOMYDCXMBWGHM-CQSZACIVSA-N	431.392	1.995	50	20	IDGD	
CC[C@H](NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)c1ccc(OC)c(OC)c1	804868163	YJSNLZDJVWSOCS-INIZCTEOSA-N	425.449	1.775	50	20	IDGD	
O=C(NCCN1CCN(c2ccc(F)cc2)CC1)NNc1ccc(-n2ccnc2)nn1	804957410	JSYUBMIWHSSFAZ-UHFFFAOYSA-N	425.472	1.250	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)[C@H](c1cnn(C)c1)N(C)C(=O)OC(C)(C)C	806558555	GERGZMQWQUBUSR-SFHVURJKSA-N	431.493	1.727	50	20	IDGD	
O=C1COc2c(cc(Cl)cc2NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)N1	806980580	ZXGZKZKPUQQTJA-UHFFFAOYSA-N	439.211	1.430	50	20	IDGD	
O=C1COc2c(cc(Cl)cc2NC(=O)C(=O)NNc2ccc(Br)nc2)N1	807012729	SJGWDTYUVMKROP-UHFFFAOYSA-N	440.641	1.910	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNc2ncccc2F)ccc1S(=O)(=O)N1CCCC1	807301690	OTLWHOOJMOYMTN-UHFFFAOYSA-N	437.453	1.096	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)NC[C@@H](N1CCOCC1)C(F)(F)F	807541351	LBHMPIONEGESOX-OAHLLOKOSA-N	434.415	1.058	50	20	IDGD	
O=C(C[C@H]1CCCC(=O)N1)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	809558405	ZNZBATIQLNIREI-GFCCVEGCSA-N	436.515	1.369	50	20	IDGD	
COC(=O)c1c(F)ccc(NC(=O)C(=O)NNC(=O)c2cccc3cccnc23)c1F	810386482	CCNQBHDUPMUARG-UHFFFAOYSA-N	428.351	1.699	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc4nc(C)nn4c3)n[nH]2)cc1	810387152	IHCUKADIKNEUAL-UHFFFAOYSA-N	432.444	1.390	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)Cc2sc(N3CCOCC3)nc2-c2ccccc2)cn1	810417995	SKQQEOIHHABRJW-UHFFFAOYSA-N	426.502	1.384	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)CNS(=O)(=O)c2cccc(C(F)(F)F)c2)n1	810560504	CFCLORWZBJMOKP-UHFFFAOYSA-N	446.455	1.763	50	20	IDGD	
CC(=NNC(=O)c1cc(Br)c[nH]1)c1ccc(S(=O)(=O)CC(N)=O)cc1	814780046	FGZKKMGSZOYLGP-UHFFFAOYSA-N	427.280	1.190	50	20	IDGD	
CCOC(=O)COc1cccc(C(C)=NNC(=O)Nc2ccc(S(N)(=O)=O)cc2)c1	814964907	DTJBPUFEMJHERP-UHFFFAOYSA-N	434.474	1.822	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1	815751945	VNYYBMVRGBELGB-UHFFFAOYSA-N	441.853	1.580	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)[C@H]2CS[C@H](Cc3ccccc3F)C(=O)N2)cc1	892122175	SKIPRCAJRDGXLX-QZTJIDSGSA-N	431.489	1.503	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNS(=O)(=O)c3cccc(S(C)(=O)=O)c3)cc2C1	903961180	OPIBRFUZNOKUKK-LLVKDONJSA-N	428.557	1.900	50	20	IDGD	
CS(=O)(=O)Nc1ccccc1C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	913391840	HSJRGBJVTJWBPC-UHFFFAOYSA-N	445.545	1.031	50	20	IDGD	
Cc1nc2ccccc2c(=O)n1CC(=O)NNC(=O)COc1ccc(Br)cc1	913396651	WMKQVOFTCCGYTG-UHFFFAOYSA-N	445.273	1.694	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)/C(C#N)=C\c1cc(C#N)n(C)c1C	914504922	IPSPXBQRLJKSFM-NVNXTCNLSA-N	439.501	1.175	50	20	IDGD	
Cc1nc(-c2c(C)c(C)nn(C)c2=O)sc1C(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	915190713	MWSHUPLXRYTKMT-UHFFFAOYSA-N	442.457	1.812	50	20	IDGD	
COc1ccc(-n2nnc(C(=O)OCC(=O)NNC(=O)c3cccc(Cl)c3)c2C)cc1	915399584	RVHBDMOKKBQSHA-UHFFFAOYSA-N	443.847	1.856	50	20	IDGD	
COc1ccc([C@@H](CNC(=O)NNC(=O)COc2ccccc2C#N)N(C)C)cc1OC	915897600	HRHKJURDJGOAPC-QGZVFWFLSA-N	441.488	1.588	50	20	IDGD	
CC(C)CS(=O)(=O)CC(=O)NNC(=O)COc1ccc(-c2ccc(C#N)cc2)cc1	916109163	PYCATYNNCBRWON-UHFFFAOYSA-N	429.498	1.822	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)NCc2ccc(N3CCO[C@@H](C)C3)nc2)c1	916392780	LFPJPTJTKXDPBX-AWEZNQCLSA-N	429.477	1.468	50	20	IDGD	
C[C@H](NS(=O)(=O)c1cccs1)C(=O)NNC(=O)c1ccc(Br)s1	917925531	FQZJGSSBEBWQPR-ZETCQYMHSA-N	438.350	1.700	50	20	IDGD	
O=C(CCN1CCCS1(=O)=O)NNC(=O)c1cc(-c2ccco2)nc2ccccc12	918201118	MPFPVXVGZPZZGZ-UHFFFAOYSA-N	428.470	1.681	50	20	IDGD	
CSCC[C@H](NC(=O)c1ccc([N+](=O)[O-])o1)C(=O)NNC(=O)c1ccc(C)cc1O	919818240	BABIEPOSCPAPLD-LBPRGKRZSA-N	436.446	1.515	50	20	IDGD	
CS(=O)(=O)Nc1ccccc1CC(=O)NNc1ccc(S(=O)(=O)C(F)F)cc1	1116037660	UNCXVJPFHCXOAZ-UHFFFAOYSA-N	433.458	1.740	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)CN2C(=O)c3ccccc3C2=O)CC1	1251915633	ZLMMDRCYJVOVMW-UHFFFAOYSA-N	430.461	1.077	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)CC2(CC(=O)N3CCOCC3)CCCC2)c1	1317710418	IBKPQRIOJBNRNE-UHFFFAOYSA-N	433.505	1.664	50	20	IDGD	
COC(=O)C(=O)NNC(=O)N[C@H](c1cccc(S(C)(=O)=O)c1)c1ccc(C)cc1C	1319300521	XNUFLSXSHQOEGU-QGZVFWFLSA-N	433.486	1.300	50	20	IDGD	
Nc1cnnc(NNC(=O)CCNS(=O)(=O)c2cccc(Br)c2)c1Cl	1324009227	MSSRFKYUOPRSTH-UHFFFAOYSA-N	449.718	1.286	50	20	IDGD	
COC(=O)c1cc(C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)n(-c2ccccc2)n1	1326010217	JZMAYGPLGUYVMN-UHFFFAOYSA-N	443.485	1.666	50	20	IDGD	
C[C@@H](O)CNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cccc3ccccc23)cc1	1353587434	RPIRUHWVVKPZPO-CQSZACIVSA-N	427.482	1.574	50	20	IDGD	
O=C(NCCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Cl)C1)c1ccc[nH]1	1778024199	RYYJAONZGKYOIC-SIXWZSSISA-N	428.892	1.183	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)o1	1779031208	QZIXHTZDDOTPQQ-DIFFPNOSSA-N	428.283	1.465	50	20	IDGD	
COc1ncc(C(=O)N2CCO[C@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)cc1F	1779296208	JUSQRTSIQUXJAE-IBGZPJMESA-N	425.533	1.524	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H]1CCNC(=O)C1)C2	1780714389	BUISMEDNDIFEQE-WTVLQJKYSA-N	434.364	1.263	50	20	IDGD	
CCOc1cnc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@](C)(Cl)CCl)C3)C2)cn1	1781227894	FVHKRLFVRUDWTR-QZTJIDSGSA-N	431.320	1.555	50	20	IDGD	
CC(C)N1CCC(C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](F)Br)C3)C2)CC1	1781325499	DPUXQDHUUDDFBD-YJBOKZPZSA-N	434.350	1.627	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCc1cc(F)ccn1)C2	1782172282	SDNLRVIZTMOAFS-DBXWQHBBSA-N	441.931	1.921	50	20	IDGD	
Cc1cc(CC(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](C)Br)C3)no1	1782464595	FZXOUUJQWUKRTM-JCKWVBRZSA-N	428.327	1.823	50	20	IDGD	
COc1ccc(F)cc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2	1782926340	HUHJZFHXBFJQLM-WRWLIDTKSA-N	428.888	1.562	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cc(C)nn3CC)CCO2)C1	1783343356	UPIRFAQJWZSQHM-RDTXWAMCSA-N	427.343	1.828	50	20	IDGD	
CC(=O)c1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]3C2)n[nH]1	1783969523	NLFSRCHOCZCJHT-SDPXSBNPSA-N	441.326	1.237	50	20	IDGD	
O=C(Cc1cccc2ncccc12)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21	1784454120	JATCLMGCUYQSCF-UHMOLFJZSA-N	431.920	1.357	50	20	IDGD	
O=C(CCc1cc(F)ccn1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21	1785242601	LFNIRFQMXXHUCC-JIRONKKISA-N	446.292	1.824	50	20	IDGD	
CCCNC(=O)CCC(=O)Nc1ccc(C2(NC(=O)CCC(=O)NN(C)C)CCC2)cc1	1786302639	SRVIMMNASFDQSM-UHFFFAOYSA-N	445.564	1.800	50	20	IDGD	
CC(=O)c1cc(C(=O)Nc2ccc(C3(NC(=O)c4cccc(B(O)O)c4)CCC3)cc2)n[nH]1	1787222167	SLQDTOAZSDBNEF-UHFFFAOYSA-N	446.272	1.354	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4c[nH]nc4c3)[C@H]2C1	1787319202	CPDVKQQQLWHLMW-ZUFFMMDNSA-N	435.322	1.940	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3[nH]nc4ncccc34)[C@H]2C1	1787345826	IZABFMKJNNRRLS-IMIFBBOLSA-N	436.310	1.335	50	20	IDGD	
Cc1[nH]nc(C(=O)NC2(c3ccc(NC(=O)c4ccc(B(O)O)cc4)cc3)CCC2)c1F	1788140441	XXJROFPKYIPCNZ-UHFFFAOYSA-N	436.252	1.599	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)c3ccc(CO)o3)CCC2)cc1)c1ccc(B(O)O)cc1	1788142127	CHQSUZFGXDURHN-UHFFFAOYSA-N	434.257	1.513	50	20	IDGD	
O=C(COc1cccnc1)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1	1788144939	GERSUXMOYLMRKL-UHFFFAOYSA-N	445.284	1.588	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc4cn[nH]c4cn3)[C@H]2C1	1788468808	CSQTZUPGDRTMSV-IZBNFRDHSA-N	436.310	1.335	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3n[nH]cc3[N+](=O)[O-])[C@H]2C1	1788813123	GQRUJUBWKOOLQQ-KQXIARHKSA-N	444.286	1.085	50	20	IDGD	
Cc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Br)C[C@@H]32)ccc1O	1790070465	RKSMIOVCDNXWDN-SDADXPQNSA-N	429.286	1.984	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3CCN(C(C)C)CC3)C[C@@H]21	1791252438	LZHMPYVNUACGDD-VJANTYMQSA-N	429.989	1.340	50	20	IDGD	
Cc1nn(C)c(C)c1CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21	1791634708	LMPHVBXJKOQHEX-XIRDDKMYSA-N	441.370	1.344	50	20	IDGD	
C[C@H](Oc1cccnc1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)Br)C[C@@H]21	1791654365	PYUQSOUEIKOTPD-HZRXROBNSA-N	440.338	1.612	50	20	IDGD	
O=C(NC1(c2ccc(NC(=O)[C@H]3CC[C@H](O)CC3)cc2)CCC1)c1ccc(B(O)O)cc1	1791700711	MSJCCLITGYJQDX-OQIWPSSASA-N	436.317	1.665	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H](C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](O)CCl)C[C@@H]2C[C@@H]21	1793107832	XDXDPANEWCGADG-ZUKRZWFUSA-N	441.956	1.622	50	20	IDGD	
COc1ccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCBr)C3)cc1	1795259264	WHTKNDUCRNKMRV-CCWDJLKJSA-N	425.323	1.612	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)Nc1cccnc1	1795603014	UPMJIAPPRSBKQQ-WVCIDPQESA-N	439.354	1.503	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2c(n1)OCCO2	1796284880	XMNBXHYPIRFMQD-CVGJEZRXSA-N	444.315	1.292	50	20	IDGD	
COC(=O)C12CCC(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)[C@H](O)CCl)C4)(CC1)CC2	1797880525	IRFJRTCEBIDDPV-YFQBQFEZSA-N	426.941	1.738	50	20	IDGD	
COC(=O)[C@H]1CCC[C@@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CO[Si](C)(C)C)C1	1797956795	ZMASIIWLSVKXMX-OYNZLANYSA-N	440.613	1.407	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2n(n1)CCCNC2=O	1797967379	UQSGALZHSGBRAI-QDMKHBRRSA-N	433.585	1.120	50	20	IDGD	
Cc1cccc2[nH]c(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)c3ccc(B(O)O)cc3)C4)cc12	1798057443	BNIWZFMIEQJYAQ-REPLKXPHSA-N	431.301	1.722	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1[C@H]2c3ccccc3S[C@H]21)c1ccc(B(O)O)cc1	1798451728	BNATVMCNEOAWIU-AZNOEYCNSA-N	448.353	1.506	50	20	IDGD	
COc1cccc(OC)c1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2	1798826264	VLOXQPQOUQFMCM-IVWMJMPLSA-N	441.322	1.692	50	20	IDGD	
COc1ccc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Br)cn1	1799344657	PSCSOHMDZRIVNL-DLTLXFJOSA-N	444.301	1.303	50	20	IDGD	
C[C@H](Oc1cccnc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Br	1799351866	DAGSPITZHHLAJW-ZZVJUGKHSA-N	430.274	1.129	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1onc2ccccc12	1799984025	FERAIUJWNXBHNM-FJHTZYQYSA-N	426.242	1.722	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CC(c2ccccc2)=NN1	1800153801	UTONEIOAMMFQHT-VYMYIBDJSA-N	432.952	1.750	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(C)ccc1-n1ccnn1)C2	1800979572	PQIGBEZJWRXKGK-HIRMHNASSA-N	447.923	1.033	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)COc1ccccc1C#N	1801994653	ZBPYBOGWOWDLJS-LJGDNWOOSA-N	436.306	1.310	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)n2cncn2)[C@H]1c1cccnc1	1803017202	CBOSYVXBXDUKLP-JHNDHUHGSA-N	449.353	1.971	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@H](CNC(=O)[C@@H]2CNC(=O)O2)[C@@H]1c1cccnc1	1803647960	JDKBDAMBEVEONT-NUXNZHGMSA-N	429.304	1.432	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(-c2ncc[nH]2)cc1)c1cccc(B(O)O)c1	1803782648	RPNOWHGRDZAFKD-WKCHPHFGSA-N	444.300	1.322	50	20	IDGD	
C=CCSCC(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1804176781	SLQHJSAQNNMZLY-UWJYYQICSA-N	433.578	1.380	50	20	IDGD	
COc1nn(C)cc1C(=O)NC[C@H]1CCN(C(=O)C(Cl)Cl)[C@H]1c1cccnc1	1805308505	QUTGJNFUUCZTTA-OCCSQVGLSA-N	426.304	1.947	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)C1CCCCC1	1806225268	KVWZKZPNTHHVIV-UNMCSNQZSA-N	435.333	1.661	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)CCc2cnn(C)c2)[C@H]1c1cccnc1	1807430930	DQQRUIUEYKDHBO-WSTZPKSXSA-N	433.940	1.708	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)Cn2ccccc2=O)[C@@H]1c1cccnc1	1807442329	NYILGSUQKKSZBZ-ZWOKBUDYSA-N	432.908	1.203	50	20	IDGD	
Cc1ccc(C(=O)N2CCCC3(CCN(C(=O)c4ccc(B(O)O)cc4)CC3)C2)nc1C	1807790962	AREDSUCZKATXLW-UHFFFAOYSA-N	435.333	1.537	50	20	IDGD	
Cc1occc1C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1	1810299506	RDTQOBWLBCFTLK-JXFKEZNVSA-N	448.483	1.615	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2ccns2)[C@@H]1c1cccnc1	1813071832	YHIGMUWXGMDXCY-DNVCBOLYSA-N	430.534	1.231	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H](CNC(=O)[C@@H](C)n2cncn2)[C@H]1c1cccnc1	1813397998	ZMEUULJIQXBFPJ-MUIFIZLQSA-N	449.353	1.971	50	20	IDGD	
Cc1ccc(C(=O)N[C@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)c(C)c1	1815343660	IDENGBTWQHUKTN-KRWDZBQOSA-N	449.341	1.979	50	20	IDGD	
O=C(/C=C/C1CCCC1)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1	1815360689	XKNMRQNPRUXENK-YRYLYKBFSA-N	439.346	1.795	50	20	IDGD	
O=C(C/N=C/c1ccco1)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1819477709	RJYBIQFBNPAWFJ-BBMHEYIBSA-N	449.276	1.108	50	20	IDGD	
CNC(=S)NCCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](C)Br)CC2	1819810449	DWWXEMXRSHRHHD-DTWKUNHWSA-N	448.412	1.323	50	20	IDGD	
C[C@H](CS(C)(=O)=O)C(=O)N[C@H]1CCc2nc(NC(=O)CO[Si](C)(C)C)sc2C1	1820160141	FYQBQMUBJWDDHT-NEPJUHHUSA-N	447.655	1.587	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CC[C@@H](N)C(N)=O)[nH]n1	1820864510	BUTQAEGWWGMLFE-MOCULFSLSA-N	433.340	1.231	50	20	IDGD	
CC[C@@H](Br)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CN2CCNC2=N)[nH]n1	1822088154	QHEKWNXBLJBYOM-DGCLKSJQSA-N	440.346	1.415	50	20	IDGD	
O=C(N[C@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1)c1cc(O)nc(O)n1	1823004654	RYNLQRBNROBHJY-RRAGMBSWSA-N	446.258	1.261	50	20	IDGD	
O=C([C@@H]1CC(c2ccccc2)=NN1)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)CC1	1824187915	LJTJPDAOYTZQOL-ACRUOGEOSA-N	446.979	1.972	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CN2CCOC2=O)CC1	1824336291	KYCBPMKELTWBNW-ZFWWWQNUSA-N	430.343	1.842	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@H](O)CCl)CC2)C1CCC2(CC1)OCCO2	1824896545	MHOVSDXVHWRRKD-TZMCWYRMSA-N	443.953	1.588	50	20	IDGD	
O=C(NCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H](O)CCl)CC1)c1cccnc1	1825087853	KOFMBHJAFNCSLT-MSOLQXFVSA-N	436.940	1.031	50	20	IDGD	
CCc1cc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)n[nH]1	1827054884	NYKHRZRCQUKPIS-OAQYLSRUSA-N	438.337	1.199	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)CC[C@H]3CCOC3)sc2C1	1827329400	ORYPPIAOSXYITB-KBPBESRZSA-N	437.566	1.245	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(C)=O)C2)C1	1829339804	CCDAHIJNKXFLAS-WIYYLYMNSA-N	437.924	1.712	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc([N+](=O)[O-])o3)CCO2)C1	1829490440	VMQWYWCVVUTPES-BZNIZROVSA-N	446.254	1.041	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccns3)C2)C1	1830535340	MXXKNLJNMQEIOU-BLLLJJGKSA-N	432.340	1.244	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccnc3)C2)C1	1830537703	MKOKEZJHDBFKKN-KBXCAEBGSA-N	426.311	1.183	50	20	IDGD	
O=C(c1cccc2c1CCCC2)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1830738275	NHDDNBFAJIHOQZ-DENIHFKCSA-N	436.936	1.235	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H](N)CN)CC1	1831225141	HTEZUAOYXDPLNO-VPZDZECISA-N	445.514	1.777	50	20	IDGD	
C[C@@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1)c1ccccn1	1832328129	KXIOGUDENWHSMV-JPYJTQIMSA-N	449.360	1.798	50	20	IDGD	
O=C(C(Cl)Cl)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1COc3ccccc3O1)CCO2	1832499720	WSMCAXAAXIVQKU-DNVCBOLYSA-N	445.299	1.087	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)c3ccco3)CC2)CC1	1833089764	JPZFGTQLUBDFGL-FUHWJXTLSA-N	427.929	1.138	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)C3(C)COC3)CC2)CC1	1833138124	GCKUZYNHALWLJN-AWEZNQCLSA-N	430.387	1.626	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3nc(C)sc3C)CCO2)C1	1833149704	DTQZERILJYTQIN-DNVCBOLYSA-N	445.969	1.013	50	20	IDGD	
C[C@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)Cn3cccn3)CC2)CC1	1833263604	NORSWEKFZZUENS-OAHLLOKOSA-N	440.386	1.486	50	20	IDGD	
Cc1ccc(C(=O)N2CCC(N3CCC(NC(=O)[C@@H](O)CCl)CC3)CC2)c(F)c1	1833313226	AJTRBJBUCUVXKW-IBGZPJMESA-N	425.932	1.919	50	20	IDGD	
Cc1nnc(CC(=O)N2CCC(N3CCC(NC(=O)CCBr)CC3)CC2)o1	1834421713	GHTWBSKNBUWNFA-UHFFFAOYSA-N	442.358	1.277	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)CCBr)CC2)CC1	1834423473	KQJRRTRFTYLCQM-HNNXBMFYSA-N	438.794	1.597	50	20	IDGD	
O=C(CSc1ncccn1)NC1CCN(C2CCN(C(=O)[C@H](F)Cl)CC2)CC1	1834864107	XGMXBBHVCNXLRW-INIZCTEOSA-N	429.949	1.675	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCC(N2CCC(NC(=O)c3cnc(O)[nH]3)CC2)CC1	1835964230	HITKFKTWYZAGAS-SFHVURJKSA-N	432.352	1.537	50	20	IDGD	
CC(C)(C)n1cc(C(=O)N2CCC(OC3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)nn1	1836717659	AKOLYYAZYPYJCW-KRWDZBQOSA-N	441.960	1.245	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3CNc4ccccc43)C2)C1	1837711468	JDPLYBXGXWQEMZ-PGRDOPGGSA-N	447.608	1.504	50	20	IDGD	
Cc1cc(/C=C/C(=O)N2CCOC[C@]3(C2)CN(C(=O)CO[Si](C)(C)C)CCO3)no1	1837715260	FVNUHGBVGFOYMI-XJDXJNMNSA-N	437.569	1.304	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1837715978	USAPWMZTUWIKJU-XJKSGUPXSA-N	437.407	1.078	50	20	IDGD	
COc1ccnc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)c1	1837956288	RSSUXIGDQOYYMB-OALUTQOASA-N	446.331	1.397	50	20	IDGD	
O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)c1c(F)cncc1F)CCO2	1838164787	QMXGWYICJFCZTR-KRWDZBQOSA-N	448.264	1.215	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)[C@@H]3CCC=CO3)CC2)CC1	1838389448	PCAAJKHQCPJUKX-IBGZPJMESA-N	436.553	1.051	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccccc3F)CCO2)C1	1838853555	VNIIYSGBKFQQCZ-IFXJQAMLSA-N	443.313	1.927	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)COc3cc(Cl)ccn3)C2)C1	1839145445	HXOWBRXANOZHNG-KXBFYZLASA-N	446.331	1.588	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1840030433	MKEZLKYPZGYSRA-BLLLJJGKSA-N	425.751	1.491	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3F)C2)C1	1840032007	KUMIAUAYOQZAIU-SJKOYZFVSA-N	430.274	1.074	50	20	IDGD	
COC(=O)c1ccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)cc1	1840278390	GVMVYKYPUDXLTO-FXAWDEMLSA-N	442.871	1.007	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1CCCS1)CCO2	1840574066	FKYGHFSWFOXTEJ-JKIFEVAISA-N	435.384	1.369	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@]1(C)CC1(F)F)CCO2	1840829373	BTFFRXSEDRUEML-MAZHCROVSA-N	439.297	1.662	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2ccc3cc(O)ccc3n2)C1	1843666189	RIDHUVUWAAYYMG-UHFFFAOYSA-N	446.467	1.070	50	20	IDGD	
CC(=O)N[C@@H](C(=O)N1CCCC12CN(C(=O)[C@H](F)Br)C2)c1ccc(F)cc1	1845009818	AEEDPCQIYZHIML-CABCVRRESA-N	444.276	1.897	50	20	IDGD	
Cn1ncc(Br)c1C(=O)N1CC2(CCCN2C(=O)[C@H](F)Br)C1	1845217737	RXUVLFHRSMBHON-JTQLQIEISA-N	438.095	1.690	50	20	IDGD	
O=C([C@@H]1ON=C(c2ccccc2)O1)N1CC2(CCCN2C(=O)[C@@H](F)Br)C1	1845218120	NFGVOJJVHNBYTR-WBMJQRKESA-N	426.242	1.615	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC12CN(C(=O)C1(F)CN(C(=O)OC(C)(C)C)C1)C2	1846180164	QKJQEGPQYLHECJ-GFCCVEGCSA-N	448.333	1.932	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@]23C[C@@H]2CCN3C(=O)OC(C)(C)C)C1	1846259023	PEEHJEJUNUUJNW-PDSXEYIOSA-N	441.956	1.843	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@H]1CCCN1C(=O)OC(C)(C)C)C2	1846364982	UECXUPGSQYHASX-HUUCEWRRSA-N	429.945	1.843	50	20	IDGD	
COc1ccc(CCC(=O)N2CC3(CCCN3C(=O)CCC(=O)NN(C)C)C2)c(F)c1	1846384953	CVQDBYKOMRKOAO-UHFFFAOYSA-N	434.512	1.343	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)c1ccccc1C(F)(F)F)C2	1846385464	JODBWEZKJMCGDB-UHFFFAOYSA-N	426.439	1.895	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)CCN2CCCC2)C1	1847126424	NJXVCEMVRSIPOI-UHFFFAOYSA-N	444.488	1.823	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H]1CC(c2ccccc2)=NN1	1847501477	BWIPDGOBKXAWGF-MGHWNKPDSA-N	433.350	1.985	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H]1CC(c2ccccc2)=NN1	1847501488	BWIPDGOBKXAWGF-QCSYZSNVSA-N	433.350	1.985	50	20	IDGD	
CCn1c(NNC(=O)c2cc(Cl)c(OCC(N)=O)c(OC)c2)nc2ccccc2c1=O	11166131	PKFWTSJHBBOLBU-UHFFFAOYSA-N	445.863	1.699	50	20	IDGD	
O=C(NNC(=O)C1CC1)c1cccc(S(=O)(=O)N2CCN(Cc3ccccc3)CC2)c1	15794389	LQZZRPPUEIPQRN-UHFFFAOYSA-N	442.541	1.364	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)COc3cccc(C)c3)CC2)cc1	17198506	GWIRXDDXCZWMIW-UHFFFAOYSA-N	445.541	1.931	50	20	IDGD	
CNS(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=O)c2ccc(Cl)cc2OC)c1	21026243	UIYHLPKKEUTHIH-UHFFFAOYSA-N	432.285	1.985	50	20	IDGD	
O=C(NNC(=O)C1CCN(S(=O)(=O)c2cccnc2Cl)CC1)c1ccccc1O	23449630	HHDFYRKHLNWABX-UHFFFAOYSA-N	438.893	1.303	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2ccc(N3C[C@H](C)O[C@H](C)C3)nc2)cc(OC)c1OC	30018303	JHFYGMCUPSMCTD-OKILXGFUSA-N	444.488	1.796	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCN(c3ccc(C#N)cc3F)CC2)cc1OC	725803801	QWXGWGQZKLURKB-UHFFFAOYSA-N	441.463	1.298	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=S)NCCc2ccccn2)cc1	726121253	BXUVCNLXDYFYCT-UHFFFAOYSA-N	427.559	1.854	50	20	IDGD	
O=C(CCCNC(=O)c1ccc(F)cc1)NNc1ccc(S(=O)(=O)NC2CC2)cc1	728211041	DZLGOGRLIGAZIK-UHFFFAOYSA-N	434.493	1.920	50	20	IDGD	
CNC(=O)c1ccc(C(=O)NNC(=O)[C@@H]2Cc3ccccc3CN2Cc2ccccc2)cn1	728519574	LOGWFORVXCRZLX-QFIPXVFZSA-N	443.507	1.829	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)c3cccc(C#N)c3)CC2)cc1	728827379	NQKDCYIQKXODHF-UHFFFAOYSA-N	442.497	1.429	50	20	IDGD	
C[C@@H]1CN(S(=O)(=O)c2cccc(C(=O)NNC(=O)c3cccc(C#N)c3)c2)C[C@@H](C)O1	728828557	ZKDPNQGTYOIRHH-HUUCEWRRSA-N	442.497	1.431	50	20	IDGD	
Cn1nnc2cc(C(=O)NNC(=O)c3cccc(S(=O)(=O)N4CCCCC4)c3)ccc21	729295815	MEKGNOYXSLKGKX-UHFFFAOYSA-N	442.501	1.218	50	20	IDGD	
COc1ccc(N2C[C@@H](C(=O)NNC(=O)Cn3ccc4ccccc43)CC2=O)c(OC)c1	729449956	LXGFTQGVBAYBCK-INIZCTEOSA-N	436.468	1.859	50	20	IDGD	
CC(C)[C@H](NC(=O)NC(C)(C)C)C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	729509295	GLOUZQZZHCRJFF-FQEVSTJZSA-N	446.596	1.468	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)c1ccc(S(=O)(=O)NCc2ccco2)cc1	730034215	BWLKTGORJOVTKX-UHFFFAOYSA-N	443.481	1.858	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)N[C@H]1CCN(c2ccc(F)cc2F)C1	730137631	YEPKATHRWLCGDB-AWEZNQCLSA-N	428.403	1.163	50	20	IDGD	
COc1cc(C=NNC(=O)CSc2nc(C)cc(C)n2)cc(OC)c1OCC(N)=O	730542995	DKDLJDPUGMWCEN-UHFFFAOYSA-N	433.490	1.217	50	20	IDGD	
Cn1nc(SCC(=O)NN=C/C(Br)=C\c2ccccc2)c(=O)n(C)c1=O	730568821	DAOYZEHCJNQNRP-PCDLVJHBSA-N	438.307	1.109	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@H]2C(=O)NNC(=O)COc2ccccc2O)c(OC)c1	730777816	DRSXHPKHZLYFJS-INIZCTEOSA-N	443.456	1.240	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NCCCN(C(=O)C2CCC2)C2CC2)c2ccccc2c1=O	731404256	FMKZZBKZNMATLH-UHFFFAOYSA-N	440.504	1.059	50	20	IDGD	
Cc1n[nH]cc1S(=O)(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	732045634	LTCQKAWBNSHHNH-UHFFFAOYSA-N	438.469	1.100	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)CCC(=O)N(CCC#N)c2ccccc2)C[C@H](C)O1	732261510	NBDPIDLPAJAJDK-ROUUACIJSA-N	429.521	1.360	50	20	IDGD	
COc1ccc(Cl)cc1NCC(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	733502099	LMNYMOIGVKVWSH-KRWDZBQOSA-N	449.847	1.291	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)c2n[nH]c(C)c2C)c1	734417374	BKTPEJHHVQDYRA-UHFFFAOYSA-N	443.485	1.911	50	20	IDGD	
NS(=O)(=O)c1ccc(F)c(CNC(=O)NNC(=O)NCc2ccc(Cl)cc2)c1	734676524	QUBVANHWLLBCSJ-UHFFFAOYSA-N	429.861	1.340	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)NCC2(c3cccc(Br)c3)CCOCC2)cn1	735512328	KMDPPBOXIOTOLW-UHFFFAOYSA-N	436.310	1.875	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)[C@H]1CN(Cc2ccccc2)CCO1	741172064	IGZKOTINMSBRDR-GOSISDBHSA-N	448.317	1.876	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)N[C@H](Cn1cccn1)c1ccccc1	741266026	HPDZSFJHVGLLQC-MRXNPFEDSA-N	441.517	1.562	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)CCCN(C)C2=NS(=O)(=O)c3ccccc32)c1	742033261	LSUCLZLFWJRLFD-UHFFFAOYSA-N	444.513	1.382	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)CN(C[C@H]2CCCO2)C(=O)OC(C)(C)C)nc2ccccc21	742034649	SGVNGHBFPWQPJJ-OAHLLOKOSA-N	445.520	1.679	50	20	IDGD	
COc1ccccc1-n1cc(S(=O)(=O)NNC(=O)c2c(C)nc3ccccn23)cn1	743250077	VBHUCCJISUGYLA-UHFFFAOYSA-N	426.458	1.460	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc2oc(=O)[nH]c2cc1Cl)c1cnn(-c2ccccc2)c1	743258439	DPIVSNUQRDROCA-UHFFFAOYSA-N	433.833	1.584	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)c1ccccn1	744885690	DUUPVNFQDZGARA-HNNXBMFYSA-N	431.518	1.961	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(N3CCOCC3)c(F)c2)cc1	744974370	HCBCCLFTYLOVIK-UHFFFAOYSA-N	426.404	1.152	50	20	IDGD	
COC(=O)Nc1ccc(C(=O)OCC(=O)NNC(=O)c2ccc(OC)c(OC)c2)cc1O	745652626	LNUPBLCNMHXVKA-UHFFFAOYSA-N	447.400	1.206	50	20	IDGD	
O=C(Cn1cc(C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)cn1)NC1CCCCC1	746679024	ZZSZGKPHWNEHMP-UHFFFAOYSA-N	435.488	1.797	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)CC1(CS(C)(=O)=O)CC1	746821331	IPSKNWTXTPURGF-NSHDSACASA-N	433.324	1.579	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)C[C@@](O)(c2nc(C)cs2)C(F)(F)F)cc1	746863985	JPHDHBASXYTNRM-MRXNPFEDSA-N	432.424	1.860	50	20	IDGD	
C[C@@H]1CN(S(=O)(=O)c2cccc(C(=O)NNC(=O)c3ccc(C#N)cc3)c2)C[C@@H](C)O1	747176792	QYIOBQDMZDRLKU-HUUCEWRRSA-N	442.497	1.431	50	20	IDGD	
O=C(CNC(=O)[C@H]1c2ccccc2C(=O)N1Cc1ccccc1)NNC(=O)CC(F)(F)F	747473546	HEQZSGFTFNMTIK-GOSISDBHSA-N	448.401	1.600	50	20	IDGD	
O=C1CN(S(=O)(=O)c2ccc(C(=O)NNc3cccc4c3CCCC4)cc2)CCN1	748574024	SRXAIDANNOKDEK-UHFFFAOYSA-N	428.514	1.443	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNS(=O)(=O)c2cc(Cl)ccc2[N+](=O)[O-])cc1C	751267418	HKTLVUJVIBJSME-UHFFFAOYSA-N	426.838	1.813	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCc1ccc(C(N)=O)o1	752002498	NDIGMTQRLVUBJO-SECBINFHSA-N	425.239	1.439	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)NCc2ccc(C(=O)NNc3cccnn3)cc2)cc1	753098063	COMNCSZGQBXIAU-UHFFFAOYSA-N	440.485	1.670	50	20	IDGD	
C[C@@]1(CCC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)CCC(=O)N1	753378803	KORVKVUSOXPMJX-FQEVSTJZSA-N	436.534	1.071	50	20	IDGD	
CN(CCN1C(=O)c2ccccc2C1=O)C(=O)NNC(=O)c1cccc(OC(F)F)c1	754111936	XXUBBFWACOAKJK-UHFFFAOYSA-N	432.383	1.870	50	20	IDGD	
COc1c(S(=O)(=O)NNC(=O)c2ccccn2)cc(Br)c(C)c1[N+](=O)[O-]	755006471	STZGPYYBAWQOIC-UHFFFAOYSA-N	445.251	1.693	50	20	IDGD	
COc1ccc(C2(C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)CCC2)cc1OC	755341313	JOQNOHIIUUDSPW-UHFFFAOYSA-N	436.509	1.981	50	20	IDGD	
CCc1c(NC(=O)C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cnn1CCC(C)C	756155963	XYDLHEOHPGCDHR-UHFFFAOYSA-N	449.533	1.295	50	20	IDGD	
CS(=O)(=O)NCc1ccc(NC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc1	756630292	UDAMWDAOUUDXDL-UHFFFAOYSA-N	444.473	1.094	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)Cc2c[nH]c3ccccc23)ccc1S(=O)(=O)N(C)C	757776559	RRRNGEMZXYDYTB-UHFFFAOYSA-N	445.501	1.822	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2ccc3c(c2)CCC(=O)N3C)c2ccccc2c1=O	758075404	HLCMFPHLNFQBRK-UHFFFAOYSA-N	433.468	1.790	50	20	IDGD	
COCc1nc(C)c(C(=O)OCC(=O)NNC(=O)c2cc(Cl)ccc2OC)s1	758819732	IAZOEFCRRPGLCS-UHFFFAOYSA-N	427.866	1.878	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)c2cc(S(=O)(=O)NCCOC)ccc2C)n1	762909143	YCRIYUHKMWKMHD-UHFFFAOYSA-N	436.538	1.313	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)cc1S(=O)(=O)NCC#N	763167287	WXIOWRCIMKNGSD-UHFFFAOYSA-N	444.498	1.323	50	20	IDGD	
O=C(NNC(=O)C1(S(=O)(=O)c2ccccc2)CC1)c1cc(-c2ccc(F)cc2)[nH]n1	763173150	KSPZJHKXBUEJBJ-UHFFFAOYSA-N	428.445	1.983	50	20	IDGD	
C[C@H]1CN(Cc2cccc(NC(=O)C(=O)NNC(=O)c3ccccc3O)c2)C[C@@H](C)O1	763527157	NJQUHTTTXSNVDR-GASCZTMLSA-N	426.473	1.401	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)Nc1ccc(Br)cc1F	763569718	ANMPHSSZYUQHBO-AWEZNQCLSA-N	438.209	1.514	50	20	IDGD	
COc1cc(F)c(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)cc1OC	763605734	TVBOCPRHPRXVKD-UHFFFAOYSA-N	427.392	1.633	50	20	IDGD	
CCc1nnc(-c2ccc(NC(=O)C(=O)NNC(=O)COc3ccccc3F)cc2)o1	763681744	IEKYWDCLMGOKCO-UHFFFAOYSA-N	427.392	1.603	50	20	IDGD	
COC(=O)Nc1cc(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)ccc1F	763685346	AVJLRBNAMXQLTF-UHFFFAOYSA-N	438.799	1.822	50	20	IDGD	
CNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)CSc2ccc(Cl)cc2)c1C	763737192	ZFCOVSVFPZMYHY-UHFFFAOYSA-N	434.905	1.886	50	20	IDGD	
COC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2cc(OC)cc(OC)c2)cc1F	763775118	LJJHUNUNXZNKFI-UHFFFAOYSA-N	434.380	1.421	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2cccc(-n3cccc3)c2)c2ccccc2c1=O	763787296	WQYPAOQNJGQNAY-UHFFFAOYSA-N	444.451	1.607	50	20	IDGD	
COCCOc1cccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)c1	763847702	FJCBAUZVGJCSMS-MRXNPFEDSA-N	429.473	1.882	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)cnc1Br	763858029	QFICYEQABQOTCG-SNVBAGLBSA-N	439.241	1.845	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)c(C)c1	763873734	YGCSBNYRKRXQQI-ZDUSSCGKSA-N	447.419	1.239	50	20	IDGD	
CN1CCN(c2ccccc2NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)on2)CC1	764003848	PBAZWPVALWQFNB-UHFFFAOYSA-N	448.483	1.493	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1cc(S(C)(=O)=O)ccc1F	764011040	FNCXYDJTIYUNNF-UHFFFAOYSA-N	443.840	1.291	50	20	IDGD	
O=C(Cc1ccc2ccccc2c1)NNC(=O)C(=O)Nc1cccnc1N1CCOCC1	764085062	OHUQEROZRFQBKX-UHFFFAOYSA-N	433.468	1.400	50	20	IDGD	
COC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(C)cc3)[nH]n2)c1	764109817	BVKDRYVYFZSQLB-UHFFFAOYSA-N	436.428	1.963	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)nc2n3CCCCC2)c1O	764130462	IGTGVENWARTUIT-UHFFFAOYSA-N	437.456	1.877	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)NC(C)C)cc2)o1	764139166	ODLGQJKNMGOZDH-UHFFFAOYSA-N	443.504	1.659	50	20	IDGD	
CCOCC(=O)NNC(=O)C(=O)Nc1sc2c(c1C(=O)OCC)CC[C@@H](CC)C2	764317220	JIYLCPWETRQHDQ-LLVKDONJSA-N	425.507	1.562	50	20	IDGD	
Cc1oc(S(=O)(=O)N(C)C)cc1C(=O)NNc1c(F)cc(C(=O)NC2CC2)cc1F	764332077	BYVUSAZJDSCXBH-UHFFFAOYSA-N	442.444	1.766	50	20	IDGD	
CC(C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1	764343625	UCHSCRJUUPDLGA-UHFFFAOYSA-N	434.456	1.410	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)Cc3ccncc3)cc2F)C[C@H](C)O1	764352724	CLPHJVHWEZNEHF-KBPBESRZSA-N	429.452	1.163	50	20	IDGD	
COc1c(Br)cc(Cl)cc1NC(=O)C(=O)NNC(=O)c1cnn(C)c1	764363902	WEVXXGRUTJIXFU-UHFFFAOYSA-N	430.646	1.244	50	20	IDGD	
O=C(NNC(=O)[C@H]1COCCO1)C(=O)Nc1ccc(-c2nc3ccccc3s2)cc1	764427417	ZJRSPIYECBLUDJ-OAHLLOKOSA-N	426.454	1.465	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)[C@H](C)NS(=O)(=O)c2ccc(C#N)cc2)c1C	764553992	UOMFJCAXJGRQOU-HOTGVXAUSA-N	444.513	1.457	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)Cn3c(C)c(C)sc3=O)n[nH]2)cc1OC	765598651	MEKIKGYLAIXOOC-UHFFFAOYSA-N	431.474	1.395	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)CNC(=O)c2cccc([N+](=O)[O-])c2)n[nH]1	765599328	FJWPZYMHVFZDBO-UHFFFAOYSA-N	438.400	1.185	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)[C@H]2CCCN(C(=O)c3ccncc3)C2)n[nH]1	765600552	SAGQTGCFCTZNKL-INIZCTEOSA-N	448.483	1.794	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNc2nccnc2OC)sc2c1CCCS2	766269808	FHHMCDSPIABJJW-UHFFFAOYSA-N	437.503	1.844	50	20	IDGD	
NC(=O)c1csc(C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)c1	766662713	CNAUPEGWQJJVEK-UHFFFAOYSA-N	435.937	1.079	50	20	IDGD	
CC(=NNC(=O)Cc1nn2c(C3CCCCC3)nnc2s1)c1cc(C(N)=O)n(C)c1	767110318	RSKJFECVEPYLPQ-UHFFFAOYSA-N	428.522	1.754	50	20	IDGD	
Cc1nn([C@H]2CCS(=O)(=O)C2)c(Cl)c1C=NNC(=O)c1ccc2c(c1)OCCO2	767484953	DNQWODWYDZANRE-ZDUSSCGKSA-N	438.893	1.740	50	20	IDGD	
CC(=NNC(=O)C[C@H](C(=O)NN=C(C)c1occc1C)N1CCOCC1)c1occc1C	767786646	XKNTUGSGPAYAAI-GOSISDBHSA-N	443.504	1.961	50	20	IDGD	
CC(C)c1cc(NC(=O)C(=O)NNC(=O)Cc2ccc(F)cc2)n(-c2ncccn2)n1	768239202	VTZDHBSTPCUQKI-UHFFFAOYSA-N	425.424	1.253	50	20	IDGD	
Cc1cc(C)c(C)c(S(=O)(=O)N2CCC(C(=O)NNC(=O)C(C)(C)O)CC2)c1C	768247738	MTYNRGLSZBQPQD-UHFFFAOYSA-N	425.551	1.239	50	20	IDGD	
CC(C)(O)C(=O)NNC(=O)c1nnn(-c2cccc(Br)c2)c1C(F)(F)F	768260153	SZPHFOVNPMYEHH-UHFFFAOYSA-N	436.188	1.581	50	20	IDGD	
CCc1c(C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)cnn1-c1ccccc1OC	769585537	MBEAEKGBTNSWCY-UHFFFAOYSA-N	446.508	1.912	50	20	IDGD	
CCn1nc(C=NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c2ccccc21	769763961	SQQOCKCGJKDNCQ-UHFFFAOYSA-N	441.513	1.841	50	20	IDGD	
CSCCNC(=S)NNC(=O)c1cn(CCC#N)nc1-c1ccc([N+](=O)[O-])cc1	770239143	HHCMEYONIPOYAN-UHFFFAOYSA-N	433.519	1.844	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccccc1)c1ccc2c(c1)OCCO2	770406271	MHLRPOBRXJVHTM-QGZVFWFLSA-N	445.497	1.462	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)Nc1ccn(CCN2CCOCC2)n1	770484478	LETIPGKVSOIJRX-CQSZACIVSA-N	436.900	1.489	50	20	IDGD	
CCc1nc(-c2ccc(C(=O)NNC(=O)c3csc(N4CCOCC4)n3)cc2)n[nH]1	770749953	QXIXXSSAEDMZFG-UHFFFAOYSA-N	427.490	1.402	50	20	IDGD	
CCN1CCN(c2cccc(NC(=O)C(=O)NNC(=O)COc3cccc(C)c3)c2)CC1	770774813	VZCCLUFTMJLXLQ-UHFFFAOYSA-N	439.516	1.302	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccccc1	771847328	VIBXXAMYPDLWOJ-YHZJOHHESA-N	434.456	1.860	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)OCc2nncn2C)cc1	771873558	NMRUJTGFRRTPID-OQLLNIDSSA-N	435.444	1.213	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)[C@@H]2CCN(C(=O)OCc3ccccc3)C2)cc1	773576542	IMLTVNDDJVNPDN-LJQANCHMSA-N	439.468	1.958	50	20	IDGD	
O=C(NNc1cnc2ccccc2n1)C(=O)Nc1ccc(F)c(-n2nnnc2C2CC2)c1	773718678	LQRDENNREHSNHD-UHFFFAOYSA-N	433.407	1.704	50	20	IDGD	
Cc1c(Cl)cccc1NNC(=O)C(=O)Nc1cnn(CC(=O)N2C[C@H](C)O[C@@H](C)C2)c1	773768144	KUXIVDRMAIVBLC-STQMWFEESA-N	448.911	1.563	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(CN3C(=O)CCC3=O)cc2)cc1F	773889210	KYAGTKAEXTYZFD-UHFFFAOYSA-N	426.404	1.183	50	20	IDGD	
CC[C@@H](NCC(=O)NNC(=O)c1cccc(C#N)c1)c1ccccc1OCC(=O)N(C)C	775053198	INXJWDQKXGXHNR-LJQANCHMSA-N	437.500	1.527	50	20	IDGD	
CC(C)(C)OC(=O)c1cccc(CNC(=O)NNC(=O)CNC(=O)c2cccs2)c1	775735497	QBARCWBGBNHNNS-UHFFFAOYSA-N	432.502	1.964	50	20	IDGD	
O=C(COC(=O)c1ccc(C(F)(F)F)cc1O)NNC(=O)[C@H]1COc2ccccc2O1	776400554	WTKXRZADDAWUAM-OAHLLOKOSA-N	440.330	1.555	50	20	IDGD	
O=C(Cc1ccc(OC(F)F)cc1)N1CCN(S(=O)(=O)CBr)CC1	777777502	KBVJSRPKYCGUMC-UHFFFAOYSA-N	427.267	1.657	50	20	IDGD	
COc1ccc(N2CCN(C(=O)/C=C/C(=O)NNC(=O)NCc3ccco3)CC2)cc1	778248069	ZUIPIRLLTFMTGO-CMDGGOBGSA-N	427.461	1.024	50	20	IDGD	
COc1ccc(C(=O)c2ccccc2C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1	781238706	NXNWYOSSEJAVMX-UHFFFAOYSA-N	442.435	1.977	50	20	IDGD	
CCOc1ccc(-n2c(C)cc(/C=C(\C#N)C(=O)NCCN3CCNC(=O)C3)c2C)cc1	781412361	NTUSQEQDZUCNOF-XSFVSMFZSA-N	435.528	1.948	50	20	IDGD	
O=C(NNC(=O)N1CCC[C@@H](n2ccc(C(F)(F)F)n2)C1)c1ccc(-n2cnnn2)cc1	782493597	QMBNQURJLKKAMB-CQSZACIVSA-N	449.397	1.569	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2cn(C)nc2C(F)(F)F)c1	782816165	PKGGWFJBFIYCIY-UHFFFAOYSA-N	434.400	1.156	50	20	IDGD	
CC(C)Oc1ccc(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)c(F)c1	782893594	JSRWYPARALJDJS-UHFFFAOYSA-N	427.436	1.828	50	20	IDGD	
CNC(=O)c1cccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)c1	783409811	WQMJBUIBUAXAGU-UHFFFAOYSA-N	444.391	1.422	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)C(=O)Nc1cccc(C#Cc2cccs2)c1	784004522	PTHUEGQSGQPPJD-UHFFFAOYSA-N	436.449	1.257	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1	784832937	HUDJYTULEHZCSJ-UHFFFAOYSA-N	435.462	1.753	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)F)cc1)C(=O)Nc1ccc2c(c1)OCCCO2	784835591	DFBYEPDWKWOMBY-UHFFFAOYSA-N	441.412	1.926	50	20	IDGD	
Cc1cccc(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)c1C(=O)N1CCCC1	785060784	LXEOOWXOWBVMEL-UHFFFAOYSA-N	448.483	1.207	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)c1cccn2c(I)cnc12	788178579	RUIVCOCIBINEAT-UHFFFAOYSA-N	446.212	1.672	50	20	IDGD	
NS(=O)(=O)c1cccc2c(C(=O)NNC(=O)[C@H]3OCC[C@H]3c3ccccc3)nccc12	788874083	KDBGIMURXXVJRM-LIRRHRJNSA-N	440.481	1.216	50	20	IDGD	
CCNC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2cc(OC)cc(OC)c2)c1C	789733257	WITYLQXWGYWBKN-UHFFFAOYSA-N	443.460	1.553	50	20	IDGD	
CC(C)(C)n1cc(C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)nn1	790783393	AYHYJGJXXHHHAO-UHFFFAOYSA-N	433.944	1.265	50	20	IDGD	
COc1ccc(S(=O)(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)c(F)c1	790883511	OEBQZYYARCBKKU-UHFFFAOYSA-N	446.501	1.632	50	20	IDGD	
COc1ccc(OC)c(C2=NO[C@H](C(=O)NNC(=O)[C@@H](C)Oc3ccccc3F)C2)c1	791461379	ZMHFQJKUMRAVDA-BLVKFPJESA-N	431.420	1.951	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)CC2OCCCO2)c1	792773499	UHXGSRDKWSKJRG-UHFFFAOYSA-N	449.485	1.410	50	20	IDGD	
COc1ccc(F)c2[nH]c(C(=O)NNC(=O)c3sc(N4CCOCC4)nc3C)cc12	792811241	WBANCGBKMXDTTC-UHFFFAOYSA-N	433.465	1.992	50	20	IDGD	
Cc1nc(C#N)c(N2CCC(C(=O)NNC(=O)c3cc(-c4cccs4)[nH]n3)CC2)o1	793750111	QEUVAZUSTBXGKE-UHFFFAOYSA-N	425.474	1.984	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)Nc2ccc(-n3nnnc3O)cc2)N(C)c2ccccc21	793951873	UYXUPHZPZYKFGS-UHFFFAOYSA-N	444.455	1.977	50	20	IDGD	
CNC(=O)c1cc(Cl)cc(S(=O)(=O)NNC(=O)C(C)(C)c2ccccc2)c1OC	795316264	LAXXKGNXCJREJR-UHFFFAOYSA-N	439.921	1.996	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)[C@H]1CN(Cc2ccccc2)CCC1(F)F	795956863	HRDAGXAABGYASB-OAHLLOKOSA-N	436.484	1.783	50	20	IDGD	
COC(=O)c1cc(F)cc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)c1F	797013628	ZUVFDALUJMXBKF-UHFFFAOYSA-N	439.396	1.335	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)Nc2ccc(S(=O)(=O)/N=C3\CCCN3C)cc2)n1	797617009	GOECYWCXFMYUFE-JJIBRWJFSA-N	430.490	1.669	50	20	IDGD	
Cc1csc([C@@](O)(CC(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)C(F)(F)F)n1	798308421	ZFFHVODPIFJYNR-KRWDZBQOSA-N	444.435	1.994	50	20	IDGD	
NC(=O)c1cc(Br)cc(S(=O)(=O)NNC(=O)c2cccc3ncccc23)c1	799529993	WOXAWJPYLQBRFB-UHFFFAOYSA-N	449.286	1.720	50	20	IDGD	
CNC(=O)CNC(=O)c1cccc(NC(=O)NNC(=O)c2cc3c(s2)CC[C@@H](C)C3)c1	800594611	DJLMITXDBLFOGN-GFCCVEGCSA-N	443.529	1.815	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCCC(=O)OC1CCCCC1	800983398	IIHGFQBAXOYSRV-UHFFFAOYSA-N	439.538	1.498	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CCC(=O)N2CCN(c3ccccc3)CC2)cc1	801107458	YIJZEEFCBFLBDO-UHFFFAOYSA-N	437.500	1.210	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)C(C)C)cc1	801109352	KNQOJSXKTJBMPG-HXUWFJFHSA-N	449.511	1.946	50	20	IDGD	
CN(CC(=O)NNc1ccc(-c2cccc(C(F)(F)F)c2)nn1)[C@@H]1CCS(=O)(=O)C1	804211121	FWDMMAFAQWTPMA-CQSZACIVSA-N	443.451	1.724	50	20	IDGD	
O=C(NNC(=O)c1c[nH]c2ccccc12)C(=O)Nc1cc(F)c(N2CCOCC2)cc1F	806973053	XKAKQXVAPGVJFI-UHFFFAOYSA-N	443.410	1.682	50	20	IDGD	
Cc1cc(I)cc(NC(=O)C(=O)NNC(=O)Cc2ccncc2)c1	806979041	LGUPKHSDBKVEKC-UHFFFAOYSA-N	438.225	1.323	50	20	IDGD	
O=C1COC[C@H](C[C@@H]2CN(C(=O)C(=O)NNc3cccc(F)c3F)c3ccccc32)N1	807017886	QOFXUVPLDORNTB-OLZOCXBDSA-N	430.411	1.443	50	20	IDGD	
CNS(=O)(=O)c1cc(NC(=O)C(=O)NNc2ccc(OC)c(Cl)c2)ccc1F	807020709	BVGAUWQAVDPLPW-UHFFFAOYSA-N	430.845	1.478	50	20	IDGD	
CCN(c1ccccc1)S(=O)(=O)c1cccc(C(=O)NNC(=O)N2CCN(C)CC2)c1	807383505	XWHLSGUMKPXNOJ-UHFFFAOYSA-N	445.545	1.504	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2ccc3c(c2)SCC(=O)N3)c2ccccc2c1=O	809953938	NXHWKDIWUSWUAV-UHFFFAOYSA-N	437.481	1.926	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCc2cc3ccccc3n(C)c2=O)cc(OC)c1OC	813838454	KNANOFNPJVPYQK-UHFFFAOYSA-N	440.456	1.709	50	20	IDGD	
CCOC1CC(=NNC(=O)C[C@H]2c3cc(OC)c(OC)cc3CCN2S(C)(=O)=O)C1	814758918	LTRSQJGAYVMJDZ-LWKPJOBUSA-N	439.534	1.624	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)C(=O)Nc1cc(Cl)ccc1OC(F)(F)F	815593053	AFOGLASXQIPFJC-UHFFFAOYSA-N	448.741	1.348	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1ccn(Cc2ccccc2)n1	815751003	OXEMEWWNRUNFMH-UHFFFAOYSA-N	442.501	1.264	50	20	IDGD	
CN(C(=O)c1ccc(Cl)cc1)c1ccc(NC(=O)C(=O)NNC(=O)[C@H]2CCCO2)cc1	815779635	OQJAQFIOHJZNEF-QGZVFWFLSA-N	444.875	1.882	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)CCNS(=O)(=O)/C=C/c2ccccc2)c1	825805379	CNYZQADBRBZXEC-ACCUITESSA-N	432.502	1.235	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)c2ccc(Cn3cncn3)cc2)cc1	832750838	DWYNMHZTWIPRBW-UHFFFAOYSA-N	448.512	1.822	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNS(=O)(=O)c2ccc(S(C)(=O)=O)cc2)cc1	874067885	QYWYJMXPTBDSTP-CYBMUJFWSA-N	442.515	1.266	50	20	IDGD	
O=C(NN=Cc1c(N2CCOCC2)nc2ccccn2c1=O)c1cc(Br)c[nH]1	874102577	XNNNTCGIEXOXJD-UHFFFAOYSA-N	445.277	1.386	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CS[C@H](Cc2ccccc2F)C(=O)N1)c1ccc2c(c1)OCCO2	900255575	LJQQNTJGCFSHTJ-MAUKXSAKSA-N	445.472	1.201	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)[C@H](CC(C)C)N2C(=O)[C@@H]3CC=CC[C@H]3C2=O)cc1	901473413	XRIFBKZLNGROIR-QRVBRYPASA-N	427.501	1.887	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)[C@H]2CC(=O)N(Cc3ccccc3Cl)C2)C[C@@H](C)O1	912920217	YQWZZFWCEGMAEV-UXLLHSPISA-N	436.940	1.335	50	20	IDGD	
CCOc1ccc(N2C[C@H](C(=O)NNC(=O)CCN3C[C@H](C)O[C@H](C)C3)CC2=O)cc1	912924613	BTNCGCORRSEEOB-IXDOHACOSA-N	432.521	1.085	50	20	IDGD	
CCCCn1c(CCC(=O)NNc2ncccn2)nc2cc(S(=O)(=O)N(C)C)ccc21	913044139	XZIAQNBEHQQJFB-UHFFFAOYSA-N	445.549	1.953	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)CNS(=O)(=O)c2cccc(C#N)c2)cc1OC	913069899	YHFFPJWKRGFETC-UHFFFAOYSA-N	446.485	1.095	50	20	IDGD	
C=CCNC(=S)NNC(=O)[C@@H](CCSC)NS(=O)(=O)/C=C/c1ccccc1	913435509	OFPQLNVWSUHOSK-NRMKIYEFSA-N	428.605	1.380	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)CCNS(=O)(=O)c2ccc(F)c(F)c2)c1	913445702	RACMXNSXYLBOTH-UHFFFAOYSA-N	427.429	1.168	50	20	IDGD	
COc1ccc(CSCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1[N+](=O)[O-]	914709735	WHYOERWSAKXIEK-KRWDZBQOSA-N	433.442	1.824	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)NC[C@@H](c1ccc(C)o1)N1CCOCC1	916228373	AIRWWIQTZMABTL-KRWDZBQOSA-N	446.504	1.769	50	20	IDGD	
O=C(CN1CCN(C(=O)COc2ccc(F)cc2)CC1)NNC(=O)c1ccccc1Cl	917109510	SJWULNMTOWTNAT-UHFFFAOYSA-N	448.882	1.463	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(F)cc3nc(S)[nH]c23)c1	917494727	TVMSNABNYQMISS-UHFFFAOYSA-N	437.478	1.316	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(C)n(C)n2)c1	917521128	RGOCQLDAEJHVGI-UHFFFAOYSA-N	443.485	1.613	50	20	IDGD	
Cc1nn(-c2ccc(Cl)cc2)c(C)c1C=NNC(=O)CSc1nnc(O)nc1O	917545153	QGMAZVDEUDPHBO-UHFFFAOYSA-N	433.881	1.981	50	20	IDGD	
Cc1c(/C=C(\C#N)C(=O)N2CCN(CC(=O)N3CCc4ccccc43)CC2)cc(C#N)n1C	918597916	QOJNCNOJUMQWDW-FYJGNVAPSA-N	442.523	1.846	50	20	IDGD	
N#C/C(=C\c1cn(CCC(N)=O)nc1-c1ccc(Br)cc1)C(=O)NCCCO	920852934	BIZASXRQGNGQBW-GXDHUFHOSA-N	446.305	1.594	50	20	IDGD	
Cc1cc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)c3cccs3)CC2)c(C)s1	921061987	QGMLFZWRYXRUCS-UHFFFAOYSA-N	442.588	1.194	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@H]2CC(=O)N(c3ccccc3)C2)c2ccccc2c1=O	921125831	WMGJGYABVJWRTB-AWEZNQCLSA-N	434.456	1.166	50	20	IDGD	
C[C@H](OC[C@@H]1CCCCO1)C(=O)NNC(=O)c1ccc(CSc2nncn2C)cc1	921165806	YELOQUSHRFJTAT-YOEHRIQHSA-N	433.534	1.843	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)c1cn(-c2ccc(Br)cc2)nn1	1115991086	DORIMPBPZIILCR-UHFFFAOYSA-N	446.261	1.878	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2cc3c(nc2O)CCC(C)(C)C3)n1	1319450403	AJPGCJVPWFOXGX-UHFFFAOYSA-N	432.502	1.614	50	20	IDGD	
CN(CC(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1)c1ccccc1[N+](=O)[O-]	1323203316	BIQPMIVZRVDLBK-UHFFFAOYSA-N	435.481	1.826	50	20	IDGD	
O=C(NNC(=O)c1cncn1-c1ccccc1)N[C@H]1CCCN(C(=O)N2CCCC2)C1	1323825475	VHHAXERFVPAPFA-INIZCTEOSA-N	425.493	1.497	50	20	IDGD	
CC(C)(C)OC(=O)N1CCc2ccc(C(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)cc2C1	1343178128	IGQDUBWXGYJVPG-HNNXBMFYSA-N	437.518	1.176	50	20	IDGD	
O=C([C@H](O)CCl)N1CCO[C@]2(CCN(C(=O)C3(c4cccc(Cl)c4)CC3)C2)C1	1778066770	DAHGVUMBHXNLIV-VQIMIIECSA-N	427.328	1.801	50	20	IDGD	
O=C(c1cc2cn[nH]c2cn1)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1778781211	QNTANJXIZVXFSS-XJKSGUPXSA-N	426.246	1.092	50	20	IDGD	
Cc1cc(/C=C/C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)no1	1779125785	OVCUBXXMWSIAOW-AUEBCZNDSA-N	426.311	1.857	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2)c1cc2sccc2[nH]1	1779143464	VHDOKSWTYLGWCQ-ZSZQSSIHSA-N	425.938	1.957	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cnn(-c3cccnc3)c1)CCO2	1779296396	PHSQDECJRTWMSQ-NRFANRHFSA-N	443.580	1.562	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(CCN(C(=O)c3cc4ncsc4[nH]3)C2)C1	1779330808	JLNSVOWOYQSGTF-MRXNPFEDSA-N	427.324	1.853	50	20	IDGD	
O=C(c1nc(O)n2c1CCCC2)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1779348676	ZPQMMXYASDHOIW-GUYCJALGSA-N	445.289	1.059	50	20	IDGD	
Cc1nccnc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCBr)C2	1779871260	OKISBCYKQJEAMJ-RDTXWAMCSA-N	425.327	1.698	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)Cc3ccc(OC)cc3[N+](=O)[O-])C2)C1	1781412084	TWWQXRIAUJPYMD-UZLBHIALSA-N	439.896	1.993	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCN1CCCCC1)C2	1782170215	BGLXJOMIZPQVAI-DBXWQHBBSA-N	429.989	1.630	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)n1cc(C)cn1)C2	1782178517	NUHWHQIVEMFHLX-AXVVYFOYSA-N	426.945	1.520	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccccc1F)C2	1782212032	CUTUBNPQBYIHHR-XMSQKQJNSA-N	434.512	1.326	50	20	IDGD	
Cc1cc(NC(=O)CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)C(Cl)Cl)C2)no1	1782217689	ZGVPNPBKXSOYHU-KZULUSFZSA-N	447.319	1.629	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(CCN(C(=O)COc3ccccc3F)C2)C1	1783354706	CXBKDVRJKLSRHO-SFHVURJKSA-N	429.286	1.819	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@H]1C(=O)N1CC[C@@]2(CN(C(=O)CCBr)CCO2)C1	1783849267	AMGXXJJUMMOSGQ-SPYBWZPUSA-N	443.338	1.357	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cc3cccnc3s1)CCO2	1783934196	BXCQNIUEWZTSAR-NRFANRHFSA-N	445.545	1.113	50	20	IDGD	
CCOC(=O)[C@@H]1CCC[C@H](C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Cl)C[C@@H]32)C1	1784070347	VNRYLOGIXMPIFQ-FHULIHMCSA-N	432.920	1.870	50	20	IDGD	
COC(=O)[C@@H]1CC[C@H](C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CO[Si](C)(C)C)C[C@@H]32)C1	1784081629	WUIJEFZQCMDENW-ADHGMGHFSA-N	440.613	1.407	50	20	IDGD	
Cc1nn(C)c(C)c1CC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1784512597	KYBTZNOJWQDGFY-DOTOQJQBSA-N	431.306	1.100	50	20	IDGD	
CN1CC(C(=O)N2CC[C@@]3(CN(C(=O)/C(C#N)=C/c4ccc(F)cc4F)CCO3)C2)C1	1784786825	FFLQQYDAAUGNIA-AGBQBWRISA-N	430.455	1.263	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3nnc(C)s3)[C@H]2C1	1787058530	ZCDVVGMXGFGMMD-FQUUOJAGSA-N	445.383	1.542	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)c1cc(C(F)F)no1	1787141398	UOLYTZFNASMWLV-RJVLYZLMSA-N	440.216	1.896	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21)c1ccc2c(n1)OCCO2	1787383002	YVVKPLNVVUQEIN-MJVIPROJSA-N	430.288	1.250	50	20	IDGD	
Cn1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)C(Cl)Cl)C[C@@H]32)c2cccnc21	1788464988	RXONEFXNEDZSHS-WHOFXGATSA-N	425.316	1.970	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3snnc3C)C[C@@H]21	1790961556	LSKAKJLZMXXDCJ-CYDGBPFRSA-N	431.356	1.613	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(=O)c4ccccc4o3)C[C@@H]21	1791249709	OZYMUBZBRFYSPL-PEMDQYIBSA-N	448.903	1.640	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CC(c4ccccc4)=NO3)C[C@@H]21	1791249812	QJROEWDLJSDWEE-OIGVQNGMSA-N	449.935	1.413	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3c(F)cccc3F)C[C@@H]21	1791254535	WERUFDOVWPDINK-OWCBBSPXSA-N	430.879	1.741	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)c1ccccc1OC(F)F	1792029192	YDKCXBVZCPOYMC-PCBIJLKTSA-N	432.851	1.481	50	20	IDGD	
COc1nccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCBr)c1F	1795112509	IIJMQDLKEPTOAM-QHBPRCKVSA-N	430.274	1.218	50	20	IDGD	
O=C(Cc1c(F)ccc(F)c1F)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1	1796187948	ORBITNUQCUFFQX-MUJYYYPQSA-N	446.234	1.278	50	20	IDGD	
COc1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)ccc1F	1796190475	BCLDOQMLCNETAV-BCDXTJNWSA-N	426.253	1.080	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnc2cc(C)ccn2c1=O	1797068060	SPNKGSPFZXBCEI-KPEUIFRASA-N	432.908	1.224	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nc3ccc(F)cn3n1)C2	1799279343	JQNCIZGCUWKNKC-MSNRECKUSA-N	444.294	1.308	50	20	IDGD	
C[C@H](NNc1ccccc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Br	1799341944	AQSPDBMTGOVOOZ-PLPKTUSISA-N	443.317	1.272	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2)c1ccc(O)c([N+](=O)[O-])c1	1799479648	RUALGOWNENACHN-DRXBFXEBSA-N	442.266	1.289	50	20	IDGD	
COc1ccc(OCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)Br)cc1	1800754249	KZQUMCYDQNCSIA-FLTUCWPJSA-N	441.322	1.447	50	20	IDGD	
C[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)Br)c1ccc(O)cc1	1800759946	SSDUAKFAJABAHQ-FJSLXNCJSA-N	425.323	1.869	50	20	IDGD	
COc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)Br)ccc1O	1800760619	WBRCFUQHUJIYSB-YGSHXTJESA-N	427.295	1.387	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COc1ccccc1C#N)C2	1800763502	CCEHUQGKFKQQBH-FRQROOTJSA-N	436.306	1.310	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(-c3ncc[nH]3)cc1)C2	1800982345	DPKPYWMMGRJRHW-MHORFTMASA-N	432.908	1.534	50	20	IDGD	
CC(C)(C)OC(=O)N1C(=O)CC[C@H]1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](O)CCl)C2	1802617094	JLMKIEKTYPVIMZ-AIEDFZFUSA-N	443.928	1.150	50	20	IDGD	
CC(=O)NCC(=O)N1CC[C@H](CNC(=O)[C@@H](C)CBr)[C@@H]1c1cccnc1	1803014539	FXAUYSWBXGSMNV-MJEQTWJJSA-N	425.327	1.255	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CSc2ncccn2)[C@H]1c1cccnc1)[C@H](O)CCl	1803137928	FDFRLMYRIUKZEF-UXLLHSPISA-N	435.937	1.269	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc(CO)c(F)c2)[C@H]1c1cccnc1)[C@H](O)CCl	1803146778	CZAWOSYBJATMAH-IPELMVKDSA-N	435.883	1.632	50	20	IDGD	
COC1(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C3)CCC1	1803415223	SYNQBMWBDCSRIA-GSWMANSFSA-N	429.521	1.718	50	20	IDGD	
CN(CCCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](O)CCl)C2)C(=O)OC(C)(C)C	1804390273	OXIIURAQQUVDTH-QKPAOTATSA-N	431.961	1.871	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC2(CCCN(C(=O)c3ccc(F)nc3F)C2)CC1	1804679002	YFLGOZMPVRQMEI-UHFFFAOYSA-N	443.259	1.198	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2cc(C(C)=O)[nH]n2)[C@@H]1c1cccnc1	1805261063	DFHNWNQPPZPNLS-VKJFTORMSA-N	433.896	1.581	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)C(Cl)Cl)[C@H]1c1cccnc1)c1nc2ncccn2n1	1809237095	LILGXDHNDWLYQZ-STQMWFEESA-N	434.287	1.643	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)c1c[nH]c2cnccc12	1810061265	JINHXUGHHYTIGO-KYNGSXCRSA-N	427.892	1.877	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)N1CC[C@H](CNC(=O)CO[Si](C)(C)C)[C@H]1c1cccnc1	1810545647	BWNNURIGJVHBBO-WRWLIDTKSA-N	432.597	1.630	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC2(CCCN(C(=O)c3nccc4[nH]ccc34)C2)CC1	1810649230	WPGIYFPKYNKLAQ-UHFFFAOYSA-N	446.316	1.401	50	20	IDGD	
Cc1cccc(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)c1	1811863457	VWBWAAZERSRVIA-FYYLOGMGSA-N	443.312	1.703	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2ccc(C(N)=O)cc2)[C@@H]1c1cccnc1	1813033959	XVPQUDAFJPASFK-CEXWTWQISA-N	444.919	1.754	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)CN2CCCCC2=O)[C@@H]1c1cccnc1)C(Cl)Cl	1813081767	ZZXHTNYUKCNGOX-RHSMWYFYSA-N	427.332	1.904	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H](CNC(=O)COc2cccnn2)[C@@H]1c1cccnc1	1813387057	JDMUSNRWBKQCKJ-UTKZUKDTSA-N	443.580	1.808	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)CCN3CCN(C)CC3)sc2C1	1814583739	VTLJFUPPIHCWBO-ZIAGYGMSSA-N	428.002	1.710	50	20	IDGD	
O=C(Cc1ccccc1)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1	1815354729	BYNSJZYBTXXIHR-QGZVFWFLSA-N	435.314	1.291	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](O)c2ccccc2)n[nH]1	1817083790	CXRGUKAZWGDIHK-DYESRHJHSA-N	442.520	1.508	50	20	IDGD	
COc1ccccc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1	1817476829	RUTUSFDUMAKLAZ-IBGZPJMESA-N	448.288	1.718	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](O)CCl)CC2)c1ccc2c(c1)OCCO2	1817977861	MJDWCFDIVCYOEV-WCQYABFASA-N	437.905	1.740	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)C2(C#N)CC2)[nH]n1	1818111865	MESWCWGXKQABBS-IXBOPPFXSA-N	436.476	1.840	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)CN3CCN(C)CC3)sc2C1	1818804756	BMCYBJNPEWRQBC-VXGBXAGGSA-N	444.399	1.086	50	20	IDGD	
C[Si](C)(C)OCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)COc1cccnn1)CC2	1820168674	JKAIJOONECNMOP-LBPRGKRZSA-N	435.582	1.776	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN2CCN(C)CC2)[nH]n1	1822186779	JEQGJFGTXOGDBZ-HIFRSBDPSA-N	441.374	1.433	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@](C)(Cl)CCl)sc2C1	1822868131	SDRZHMHJKYJROW-YHTYYEMMSA-N	433.361	1.982	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@H](O)CCl)CC2)c1ccc(O)c([N+](=O)[O-])c1	1823222561	KGJSDKPPAJOGJX-NOZJJQNGSA-N	440.865	1.582	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H]2CCCCN2C)CC1	1824207112	MOYPZEVYVHSWBW-UXHICEINSA-N	435.613	1.463	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCn1cncn1)CC2	1825453286	VEKPVWDALIFAOQ-MNOVXSKESA-N	441.355	1.910	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](C)Cn1cncn1)CC2	1825640574	CYMNJGVFXBVNEG-DCAQKATOSA-N	441.355	1.766	50	20	IDGD	
COCCn1nccc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@H](O)CCl)CC1	1827809779	HUHVUMYUMJXFNH-FUHWJXTLSA-N	426.945	1.363	50	20	IDGD	
CO/C=C(\C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1	1828924112	JAZMDVILFIGMQM-IQGVVSCOSA-N	429.521	1.469	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CC3CCN(C)CC3)CCO2)C1	1829996051	GRAQNUKKEBZRKU-GHTZIAJQSA-N	429.989	1.582	50	20	IDGD	
COc1ccccc1OCC(=O)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1830232162	WAQOYHIVJIKEHN-LJQANCHMSA-N	447.315	1.334	50	20	IDGD	
CC(=O)O[C@H](C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2)C(C)C	1830361728	BBDWOGXUOATKLS-JXFKEZNVSA-N	432.945	1.296	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4cnccc4n3)C2)C1	1830362578	ZJZKMOLUIAJXON-JOCHJYFZSA-N	446.935	1.965	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnn4ncccc34)C2)C1	1831645385	AMELPKINLJDOHY-UZLBHIALSA-N	435.912	1.207	50	20	IDGD	
O=C([C@@H](F)Br)N1CCC([C@H]2CCCCN2C(=O)CN2C(=O)C=CC2=O)CC1	1831986639	SVWYGSPWDYLVLO-CXAGYDPISA-N	444.301	1.222	50	20	IDGD	
CN1N=C(C(=O)N2CCC(N3CCC(NC(=O)C(C)(C)CCl)CC3)CC2)CCC1=O	1833213692	XRTYLOVKIVHLEU-UHFFFAOYSA-N	439.988	1.431	50	20	IDGD	
COCCOCC(=O)N1CCC(N2CCC(NC(=O)[C@H](C)CBr)CC2)CC1	1833262072	HUHCPZMSQJWAAU-OAHLLOKOSA-N	448.402	1.252	50	20	IDGD	
CC[C@H](C)[C@@H](O)C(=O)N1CCC(N2CCC(NC(=O)[C@H](C)CBr)CC2)CC1	1833264724	JDEGDBRHMWIUGQ-HDMKZQKVSA-N	446.430	1.996	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnc(C)c(C)c3)CCO2)C1	1833300648	IBKICPUVXIVRFP-FXAWDEMLSA-N	425.913	1.022	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)[C@H]3CCC(=O)NC3)CC2)CC1	1833529652	CUGSSBLUOJAYCZ-YJBOKZPZSA-N	426.989	1.492	50	20	IDGD	
Cc1oncc1C(=O)NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1834240963	YSKSDENHLUPBJU-OAHLLOKOSA-N	431.306	1.859	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cncs3)CCO2)C1	1834461257	VJYNEGZGJPHVNB-LRDDRELGSA-N	432.340	1.244	50	20	IDGD	
CC(C)c1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)no1	1834499832	GAFMRTVWKHYMSG-SCLBCKFNSA-N	444.326	1.651	50	20	IDGD	
O=C(CC12CCCN1CCC2)NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836381280	ROHXOVLYKUVROZ-IBGZPJMESA-N	441.016	1.176	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C1(F)CCCCC1)CCO2	1836620376	OLVAZGUDZOJPJI-WMLDXEAASA-N	435.334	1.899	50	20	IDGD	
Cn1cc(C(=O)N2CCC(OC3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)c(C(F)F)n1	1836718328	VMKYDARZSCBVQI-HNNXBMFYSA-N	448.898	1.570	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc4nncn4c3)CCO2)C1	1837011643	SJARDWXVNNFOAR-JXFKEZNVSA-N	435.912	1.207	50	20	IDGD	
O=C(c1cc2cnccc2[nH]1)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1837105895	GAQXJNODHYSYPI-GOSISDBHSA-N	427.288	1.437	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(-c4cccnc4)[nH]n3)CCO2)C1	1838031045	IADGNPGFDLMQJF-KKSFZXQISA-N	447.923	1.559	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3n[nH]cc3[N+](=O)[O-])CC2)CC1	1838443840	LMLUUHNKRZBSPS-AWEZNQCLSA-N	443.888	1.184	50	20	IDGD	
O=C(CC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1)Nc1ccc(F)cc1	1839029541	RXVCELZROAPRRZ-IEBWSBKVSA-N	445.850	1.145	50	20	IDGD	
C=C(C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1)C(F)(F)F	1839893995	CJUNHQBPRMFLGV-ZWNOBZJWSA-N	433.196	1.252	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(F)cn3)C2)C1	1840031516	SFZZJLRMXKTMNI-YVEFUNNKSA-N	430.274	1.074	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4cnccc4c3)C2)C1	1840152458	IZPKHLGDUMZQLS-UGKGYDQZSA-N	447.919	1.559	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(F)cc3F)C2)C1	1840153909	FPDLLKZLYSVIFR-BEFAXECRSA-N	432.851	1.289	50	20	IDGD	
CO[C@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1	1840211560	GTFWSWWFFFCVKW-SEVXFQSKSA-N	449.454	1.363	50	20	IDGD	
C[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1)n1cccn1	1840442958	SZIXCZJNKFGFSH-FHLIZLRMSA-N	433.336	1.137	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)c(Cl)c1	1840693727	PJPKQWNDMQIZQC-VQIMIIECSA-N	431.316	1.318	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)Cc2ccc3c(c2)CCC3)C1	1841901212	XIKRESKVLRZRQA-UHFFFAOYSA-N	433.512	1.234	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCCC12CN(C(=O)CCc1cn[nH]c1)C2	1841924318	XLYNYTOVKALXGN-HNNXBMFYSA-N	439.944	1.678	50	20	IDGD	
O=C(c1ccc2nnc(Br)n2c1)N1CC2(CCCN2C(=O)[C@@H](F)Cl)C1	1843363548	LLPWDRFMCJHPBJ-LLVKDONJSA-N	430.665	1.843	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)N1CC2(CCCN2C(=O)/C(C#N)=C/c2ccc(F)cc2F)C1	1845871141	SWGGKOSSMBPLLB-IREQLNLFSA-N	430.455	1.942	50	20	IDGD	
CCCn1nc(C(=O)NNS(=O)(=O)c2ccc(F)c(C(=O)O)c2)c2ccccc2c1=O	13261892	BMZPPIDPOKLVFP-UHFFFAOYSA-N	448.432	1.267	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)[nH]n2)cc1	14326359	XUMUUGAEIQKJIG-UHFFFAOYSA-N	427.486	1.710	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2c(C)nc3ccccn23)cc1S(=O)(=O)NC(C)C	14842288	JXOMMWDYVPBTPD-UHFFFAOYSA-N	445.501	1.413	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)Cc2ccc(C(=O)NNC(=O)[C@@H]3CCCO3)cc2)cc1	15797734	OIJFKNJAJOSPCP-IBGZPJMESA-N	431.514	1.756	50	20	IDGD	
CSCC[C@@H](NC(=O)c1cccc(C)c1)C(=O)NNC(=O)COc1ccc(C#N)cc1	15888590	VKAJZZBHAASRED-LJQANCHMSA-N	440.525	1.945	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)cc1[N+](=O)[O-]	15945905	QZSCOYYOJBNOTP-UHFFFAOYSA-N	425.401	1.969	50	20	IDGD	
CCCn1c(=O)n(CCC(=O)NNC(=O)COc2ccccc2OC)c2ccccc21	16232917	PNMZNVAJKQXUFD-UHFFFAOYSA-N	426.473	1.838	50	20	IDGD	
Nn1c(SCC(=O)NNC(=O)c2ccccc2)nnc1-c1ccccc1Br	22209178	URLGEVFXSRBHTK-UHFFFAOYSA-N	447.318	1.975	50	20	IDGD	
CNS(=O)(=O)c1ccc(CCC(=O)NNC(=O)c2cc(-c3ccccc3)on2)cc1	27261699	IGYUGYSMHHDELF-UHFFFAOYSA-N	428.470	1.644	50	20	IDGD	
CC(C)(C)SCCNC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	727605151	TYJMSUNWTUSDTF-UHFFFAOYSA-N	428.580	1.947	50	20	IDGD	
O=C(NNC(=O)c1cc(I)cc(C(F)(F)F)c1)C(=O)NC1CC1	728019281	WASWQKSVFRHZRL-UHFFFAOYSA-N	441.147	1.350	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@@H](C)C(=O)NNC(=O)CCc1nc(-c2nc[nH]n2)no1	728203385	IWNWFQQDFFAQJF-NSHDSACASA-N	433.856	1.672	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)c2ccc(S(=O)(=O)N(C)C)c(Br)c2)n1	729311350	OZWDWBBZPMFXCI-UHFFFAOYSA-N	428.312	1.863	50	20	IDGD	
CC(C)(C)CCCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	729612801	IMAPWZVBPBBUNN-UHFFFAOYSA-N	440.566	1.868	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H](CCNC(=O)NNC(=O)c2nnc(O)c3ccccc23)C1	730142014	VNQGZIWFJOYQSR-CYBMUJFWSA-N	444.492	1.927	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NN=c3cc[nH]c4ccccc34)CC2)cc1	730290443	LOWPKBHMFVZJIW-UHFFFAOYSA-N	439.541	1.415	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	730820874	KCKSSSQQBDTZSH-OAHLLOKOSA-N	430.469	1.006	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@H](C(=O)NNC(=O)Cc3ccccc3F)C2)s1	731328786	YHINIZWFIXRWTN-HNNXBMFYSA-N	439.534	1.986	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)ccc1S(N)(=O)=O	731891363	LWOVMOVNIVBUAB-UHFFFAOYSA-N	443.485	1.008	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Cn2ncc3ccccc3c2=O)cc1Br	732032527	CBLSHSIAOAKGNR-UHFFFAOYSA-N	431.246	1.629	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)CCN3CCN(C(=O)[C@H]4CCCO4)CC3)cc2C1	732053147	XYHLDBQGXNGRTM-DOTOQJQBSA-N	448.589	1.347	50	20	IDGD	
COc1ccc(-c2nn(CCC#N)cc2/C=C(/C#N)C(=O)NCc2nc[nH]n2)cc1OC	732116581	WGTAVNXKLFGOOT-NVNXTCNLSA-N	432.444	1.822	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@@H](C)N2CCc3ccccc3C2)cc1	732260786	YYYBOTYATHVCSE-QGZVFWFLSA-N	444.557	1.210	50	20	IDGD	
Cc1cc(C=NNC(=O)CSc2nn(C)c(=O)n(C)c2=O)ccc1Oc1cccnc1	732712725	OIFRCPAVAGASCE-UHFFFAOYSA-N	440.485	1.217	50	20	IDGD	
Cc1nc(-c2ccccn2)nc(NNC(=O)c2cc(NS(C)(=O)=O)ccc2O)c1C	734257301	PIRRHNKFRDCAEO-UHFFFAOYSA-N	428.474	1.989	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)Cc2ccc3c(c2)CCC3)CC1	735117646	ZYLPHBJRCJVEBG-UHFFFAOYSA-N	429.546	1.192	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2ccc(-c3ccccc3)[nH]2)CC1	735117913	IXGUYAZYTPDPDO-UHFFFAOYSA-N	440.529	1.770	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)CCCOc2ccc(I)cc2)cn1	735445075	FAUSOWWXDXRYKH-UHFFFAOYSA-N	428.230	1.645	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)CCCc2nc(C3CC3)no2)c1	739676554	VTKOYBIUJDGGDA-UHFFFAOYSA-N	449.533	1.761	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)C[C@H]2CCCN(C(=O)NCC(C)C)C2)cc1	741377738	YFFOYBSQFWXEJE-QGZVFWFLSA-N	432.521	1.767	50	20	IDGD	
CS(=O)(=O)NCCc1ccc(C(=O)NNC(=O)c2cccc(Br)c2)cc1	742773135	NXHXLIHJSWWARU-UHFFFAOYSA-N	440.319	1.616	50	20	IDGD	
O=C(CSc1nnc(O)nc1O)NN=Cc1cc(Cl)ccc1OC[C@H]1CCCO1	743433870	NJZDVEZAYCIXBJ-GFCCVEGCSA-N	439.881	1.736	50	20	IDGD	
CN(C)c1cc(CNC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c2ccccc2n1	743712519	RLYKBVHFYVLWTM-UHFFFAOYSA-N	441.513	1.849	50	20	IDGD	
O=C(Cn1ncn2nccc2c1=O)NNC(=O)Nc1ccc(Br)cc1Cl	743831730	VESQASYCLIJLAH-UHFFFAOYSA-N	440.645	1.160	50	20	IDGD	
Cc1nn(-c2ccccc2)c(C)c1C(=O)C(=O)OCC(=O)NNC(=O)c1ccc(C#N)cc1	744522245	PBKUSZUPSSULMP-UHFFFAOYSA-N	445.435	1.548	50	20	IDGD	
CC(C)(C)C(=O)N1CCC[C@H]1C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	744619466	PPVOOKWTAQOXHB-INIZCTEOSA-N	438.550	1.188	50	20	IDGD	
C[C@H]1C[C@@H](NC(=O)NNC(=O)CCSc2ccc(F)cc2)C(=O)N1c1cnn(C)c1	745919955	XSPOPASFLMQYKP-BLLLJJGKSA-N	434.497	1.566	50	20	IDGD	
CSCC[C@@H](NC(=O)NNC(=O)Cc1cn2ccccc2n1)c1nnc2ccccn12	746739336	AQZPHQSCJBPTFE-OAHLLOKOSA-N	438.517	1.744	50	20	IDGD	
CN1C(=C(C#N)C(=O)COC(=O)c2cc(S(N)(=O)=O)ccc2O)N(C)c2ccccc21	747344067	SKOZTHOKEFSHHX-UHFFFAOYSA-N	442.453	1.087	50	20	IDGD	
CC(=NNC(=O)Cc1cn2ccccc2n1)c1ccc(S(=O)(=O)NCCC(=O)O)cc1	747638281	OUAMZGWIFHQZAV-UHFFFAOYSA-N	443.485	1.170	50	20	IDGD	
CCc1cccc(NC(=O)CNC(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)c1	748327172	BHSRZTUFKLEKRQ-UHFFFAOYSA-N	430.461	1.858	50	20	IDGD	
COCCS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)cc1	749720289	YPDWYZHHAPJKDS-UHFFFAOYSA-N	428.470	1.572	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@@H]2CSCN2C(=O)OC(C)(C)C)cc(OC)c1OC	750844510	DCUKMJYGIHXDNV-LBPRGKRZSA-N	441.506	1.783	50	20	IDGD	
C[C@H](NC(=S)NNC(=O)CN1C(=O)COc2cc(Br)ccc21)C1CC1	751621483	WPNRFNUBWLGGRI-VIFPVBQESA-N	427.324	1.468	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)c2cc(S(N)(=O)=O)cc(Cl)c2F)c1	752265315	QEJHJUGFALBKOW-UHFFFAOYSA-N	429.857	1.583	50	20	IDGD	
NC(=O)c1cc(CNC(=O)NNC(=O)COc2ccc(OCc3ccccc3)cc2)on1	752684264	GXHISBQBFZDJHO-UHFFFAOYSA-N	439.428	1.262	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Cc2ccc(F)cc2F)c1	755037299	QJSJLWCCSLHOLD-UHFFFAOYSA-N	425.457	1.999	50	20	IDGD	
C[C@@H]1Cc2ccccc2N1S(=O)(=O)c1cccc(C(=O)NNC(=O)Cc2cc[nH]n2)c1	755268181	DNDPRSXIFMCKTJ-CQSZACIVSA-N	439.497	1.553	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)Nc1cc(C)nn1[C@H]1CCS(=O)(=O)C1	755535517	QDPHCAVPNGMICX-HNNXBMFYSA-N	435.506	1.345	50	20	IDGD	
Cn1c(=O)c2cc(NC(=O)NNC(=O)CC34CC5CC(CC(C5)C3)C4)cnc2n(C)c1=O	755847594	IITCEDKWVUMPKH-UHFFFAOYSA-N	440.504	1.391	50	20	IDGD	
O=C1CN(c2ccc(NC(=O)NNC(=O)COc3ccccc3F)cc2Cl)CCN1	755938558	SZIYJCZIWKJYED-UHFFFAOYSA-N	435.843	1.647	50	20	IDGD	
Cc1nnnn1-c1cc(NC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])ccc1F	756335184	DOJZNOCINNLMMO-UHFFFAOYSA-N	430.356	1.250	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)Nc2ccc(N(C)C(=O)CN3CCN(C)CC3)cc2)o1	756358039	HMJASCAPEJOVIY-UHFFFAOYSA-N	428.493	1.265	50	20	IDGD	
CC(C)S(=O)(=O)c1ccccc1NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	756528482	MWPIFMFSPNLNLD-UHFFFAOYSA-N	429.462	1.311	50	20	IDGD	
C[C@@H]1CN(C(=O)Cn2cc(NC(=O)NNC(=O)CCc3ccccc3)cn2)C[C@@H](C)O1	756838997	OVCAJMNVFCCAGG-HZPDHXFCSA-N	428.493	1.304	50	20	IDGD	
CCn1c(SCC(=O)NNC(=O)c2cccc(C#N)c2)nc2ccc(F)cc2c1=O	756925690	GZNRBBZVEFHSAK-UHFFFAOYSA-N	425.445	1.980	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NCc2cc3c(cc2OC(F)F)OCO3)cc1	757250138	FYNOAWYTMMWDDD-UHFFFAOYSA-N	439.371	1.935	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)Nc1ccnc(Cl)c1	757807631	MUWKPFFTNCONRB-UHFFFAOYSA-N	439.881	1.222	50	20	IDGD	
Cc1cnc([C@H](C)CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)s1	758742950	AIGSHJJEFVAADX-LLVKDONJSA-N	425.536	1.450	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CC(=O)N(Cc2cccc(C(F)(F)F)c2)C1)C(=O)Nc1ccccn1	758834176	PWTYXGLEOSZLLU-CYBMUJFWSA-N	449.389	1.235	50	20	IDGD	
O=C(NC[C@@H]1CN(Cc2ccccc2)CCCO1)NNC(=O)c1cc([N+](=O)[O-])ccc1O	759351883	PYQILTOPYLTQQM-QGZVFWFLSA-N	443.460	1.536	50	20	IDGD	
CCNS(=O)(=O)c1ccc(CC(=O)NNC(=O)c2ccc(Br)s2)cc1	759356952	MIDNJCJCRVNCBN-UHFFFAOYSA-N	446.348	1.813	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(OC)c(C(=O)NNc2ccc(C(=O)OC)cn2)c1	759725566	RTEPYOSXUZYDIF-UHFFFAOYSA-N	436.490	1.664	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)[C@H]2CCCN2C(=O)/C=C\c2ccc(C(N)=O)cc2)nc1	759729462	VJVWNQKVYCWEDN-ACAQERRYSA-N	437.456	1.115	50	20	IDGD	
Cc1ccc(CN2C[C@@H](C(=O)OCC(=O)NNC(=O)Cc3nc(C)cs3)CC2=O)cc1	760166270	DEUNJAHCBYQOAR-INIZCTEOSA-N	444.513	1.042	50	20	IDGD	
O=C(CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@@H]12)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	763175085	BBAWZGDOVDJMLA-XYJFISCASA-N	446.508	1.703	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCCCC2)cc1NC(=O)C(=O)NNC(=O)c1ccccc1	763423359	NWTMKRKDOOESIK-UHFFFAOYSA-N	444.513	1.569	50	20	IDGD	
CCN1CCN(c2ccc(Cl)cc2NC(=O)C(=O)NNC(=O)c2ccccc2)CC1	763426400	WRLXGIKOLZKHHU-UHFFFAOYSA-N	429.908	1.882	50	20	IDGD	
CCC(=O)NNC(=O)C(=O)Nc1ccc(OC)c(NC(=O)Nc2ccccc2OC)c1	763438673	VYTBLKMQGACANK-UHFFFAOYSA-N	429.433	1.844	50	20	IDGD	
CN(C)C(=O)c1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)c1ccc2ccccc2n1	763448967	ABBMPLLKXZNTME-UHFFFAOYSA-N	439.859	1.990	50	20	IDGD	
COc1ccc2c(c1)[C@H](C(=O)OCC(=O)NNC(=O)[C@H]1COc3ccccc3O1)CC2	763450849	KUCQOCFWGNBRRL-DNVCBOLYSA-N	426.425	1.256	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1cccc(CCN2CCCC2)c1	763471720	XHBNBJJOASBAFQ-UHFFFAOYSA-N	425.445	1.633	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccccc2F)ccc1-n1nnnc1C(C)C	763562554	XAEWVMGNLJBEEM-UHFFFAOYSA-N	425.424	1.633	50	20	IDGD	
COC(=O)c1[nH]c(C)cc1NC(=O)C(=O)NNC(=O)COc1ccc(C(C)(C)C)cc1	763595480	QQRQXSZNIMTMFA-UHFFFAOYSA-N	430.461	1.572	50	20	IDGD	
CCOc1cc(N2CCN(C)CC2)ccc1NC(=O)C(=O)NNC(=O)c1cc(C)oc1C	763600854	DOCCIJCHRYCZEZ-UHFFFAOYSA-N	443.504	1.447	50	20	IDGD	
Cc1cc(Oc2ncccn2)ccc1NC(=O)C(=O)NNC(=O)COc1ccc(C#N)cc1	763681770	NNAWTGYFIXRLAR-UHFFFAOYSA-N	446.423	1.614	50	20	IDGD	
O=C(COc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1ccccc1Cn1cncn1	763686706	QDSSSMVPLLLMLV-UHFFFAOYSA-N	428.836	1.145	50	20	IDGD	
C[S@](=O)Cc1ccccc1NC(=O)C(=O)NNC(=O)CN1CCCc2ccccc21	763734917	NVIXPJAWIGKTQG-PMERELPUSA-N	428.514	1.104	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccnn2-c2ccc(Cl)cc2)c1	763754488	SMCQRQMEFDNPOG-UHFFFAOYSA-N	426.864	1.991	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccc(OCc2ccccc2)nc1	763837460	GHZSXHGJPZHXCQ-UHFFFAOYSA-N	438.415	1.965	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccccc2-n2cncn2)cc1	763872576	OPYMKUILOOEPIJ-CQSZACIVSA-N	436.428	1.023	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccc(NC(=O)C2CC2)nc1	763874078	ZLAYDBUXJQOXFM-NSHDSACASA-N	429.408	1.123	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)C(=O)Nc1cccnc1Br	763947947	GOTRNKJHVWTHLP-UHFFFAOYSA-N	445.233	1.135	50	20	IDGD	
COC(=O)N(C)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)cc1	763994289	CAHGQESUDDTXLT-UHFFFAOYSA-N	438.238	1.380	50	20	IDGD	
Cc1cccc(COc2cccc(NC(=O)C(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)c2)c1	764002438	MIASVSBNUJZOJL-MRXNPFEDSA-N	445.497	1.095	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1ccccc1OCCC(N)=O	764020467	ZAVUYAAPYKAMGF-UHFFFAOYSA-N	434.836	1.003	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)N(C)C3CCCCC3)cc2)n[nH]1	764106756	RDWLEFRGXGSXNW-UHFFFAOYSA-N	426.477	1.523	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2cccc(-c3n[nH]c(C4CC4)n3)c2)c1O	764131059	FWBSBMONBCZETC-UHFFFAOYSA-N	436.428	1.463	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(C(F)(F)C(F)(F)F)cc1	764397432	JQWZIXHFLOHOJU-SECBINFHSA-N	427.326	1.478	50	20	IDGD	
CCN(Cc1ccccc1)C(=O)c1cc(NC(=O)C(=O)NNC(=O)CO)ccc1Cl	764421614	PIBINXHSQDAYEF-UHFFFAOYSA-N	432.864	1.081	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COCCO1)C(=O)Nc1cc(C2CCCC2)nn1-c1ccccc1	764433949	PBSOWUUSEOPWCB-KRWDZBQOSA-N	427.461	1.031	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NN=C3[C@H]4CCCO[C@H]4C3(C)C)CC2)cc1	764816890	DOKXYZKEXDQGQT-WIYYLYMNSA-N	448.589	1.609	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)[C@H]2CN(C(=O)OC(C)(C)C)CCO2)n[nH]1	765592557	OOXKDKRGVHTPGG-QGZVFWFLSA-N	445.476	1.482	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cc([N+](=O)[O-])c1	765732979	KXCWHPDVCWXNCB-UHFFFAOYSA-N	425.445	1.122	50	20	IDGD	
CC(C)(O)C(=O)NNC(=O)C1CCN(S(=O)(=O)c2c(Cl)cccc2Cl)CC1	768256763	YKLAIUGETCDNBP-UHFFFAOYSA-N	438.333	1.312	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2ccc(C(=O)NNC(=S)Nc3ccccn3)cc2)C[C@H](C)O1	768578218	DJWXEYZGXMPJMS-KBPBESRZSA-N	449.558	1.511	50	20	IDGD	
CCNC(=O)COc1cccc(NC(=O)NNc2c(OC)cccc2S(C)(=O)=O)c1	769224602	YPEOJEWGTKPUEG-UHFFFAOYSA-N	436.490	1.762	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)C/N=C3/NS(=O)(=O)c4ccccc43)cc2C1	769375096	ISQZQHMEIGZJOU-LLVKDONJSA-N	432.527	1.373	50	20	IDGD	
Cc1cccc(F)c1NNC(=O)C(=O)Nc1cnn(CC(=O)N2C[C@@H](C)O[C@H](C)C2)c1	770822112	UKWBAIJRTJXRQR-ZIAGYGMSSA-N	432.456	1.048	50	20	IDGD	
COc1ccc2c(c1)nc(CNC(=O)NNC(=O)COc1ccccc1[N+](=O)[O-])n2C	771393212	ULIOKYBKKGVRLD-UHFFFAOYSA-N	428.405	1.400	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1ccc(C)c(S(=O)(=O)N2CCCCC2)c1	771870139	FEAAXENTDMEIIT-AWEZNQCLSA-N	425.507	1.272	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)Cn1cnc2sc(-c3ccccc3)cc2c1=O	771945665	DHIWGZSCQQEZQX-GFCCVEGCSA-N	428.470	1.614	50	20	IDGD	
Cc1nc2ccnn2c(C)c1CCC(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772191134	BURLDBIPOXMKPI-UHFFFAOYSA-N	428.880	1.396	50	20	IDGD	
CCC1(O)CCC(NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)CC1	772596666	ZAGNBGVSULACDB-UHFFFAOYSA-N	426.539	1.030	50	20	IDGD	
CC(C)(C)C(=O)N1CSC[C@H]1C(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772888786	MOLDAESICCELNV-ZDUSSCGKSA-N	426.926	1.051	50	20	IDGD	
Cc1oc(C(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)cc1S(=O)(=O)N(C)C	772972316	UCZUVHDNLZPJAR-LLVKDONJSA-N	429.882	1.720	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(C(F)(F)F)cn1	773524116	FEJDOMZCRXHQRS-UHFFFAOYSA-N	426.351	1.664	50	20	IDGD	
O=C(NNc1ccc2ccccc2n1)C(=O)Nc1ncn(CC(=O)N2CCCCCC2)n1	773654692	KZWLDTUMXFNLDB-UHFFFAOYSA-N	436.476	1.311	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1ccc(C(F)(F)F)cn1	773731206	OOBDXCRAUIGVTO-UHFFFAOYSA-N	432.380	1.594	50	20	IDGD	
O=C(CCc1ccc2[nH]ccc2c1)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	775780359	JQVYPRXZHKQUFH-UHFFFAOYSA-N	433.512	1.706	50	20	IDGD	
COCc1nc(C)c(C(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)s1	776206356	SQWDAIOJZGTKFD-UHFFFAOYSA-N	427.527	1.847	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)CS(=O)(=O)c2cccc(Br)c2)c1	776714427	CISSILWQTVIUSY-UHFFFAOYSA-N	447.332	1.770	50	20	IDGD	
O=C(Cc1ccccc1Br)N1CCN(S(=O)(=O)CBr)CC1	777777119	FKPKZHZBSJVGDZ-UHFFFAOYSA-N	440.157	1.818	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(\C#N)C(=O)NS(=O)(=O)c2c(C)nn(C)c2OC)c1C	778852633	OLUHRSBVMFQZLE-YRUBURHZSA-N	449.533	1.775	50	20	IDGD	
CC(=O)N1CCN(Cc2ccccc2NC(=O)C(=O)NNc2ccc(F)c(F)c2F)CC1	782118973	XRECHIBXHGBNKT-UHFFFAOYSA-N	449.433	1.850	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C(=O)Nc2ccc(SC(F)F)nc2)nc2ccccc21	782889248	XYBGHDYUHBZZKJ-UHFFFAOYSA-N	434.428	1.612	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)C(=O)Nc1cc(F)c(F)c(F)c1	782895845	ADZIPCXIDVJDHB-UHFFFAOYSA-N	443.407	1.105	50	20	IDGD	
COc1ccc(Br)c(NC(=O)C(=O)NNc2ccc(-n3cccn3)nn2)c1	783437158	UQFBUOJPUVYBSS-UHFFFAOYSA-N	432.238	1.515	50	20	IDGD	
Cc1ccc(NNC(=O)C(=O)Nc2cccc(S(=O)(=O)N(C)c3ccccc3)c2)nn1	783953963	SJKZSUCQLRZVST-UHFFFAOYSA-N	440.485	1.692	50	20	IDGD	
O=C(NNC(=O)C(=O)N1CCCC1)C(=O)Nc1ccccc1Oc1ccccc1Cl	783999210	LBPXOHMPCPKEPF-UHFFFAOYSA-N	430.848	1.841	50	20	IDGD	
N#Cc1cccnc1-n1cc(NC(=O)C(=O)NNc2nc(-c3ccc(Cl)cc3)no2)cn1	784794415	FQPZQSCEXRENTH-UHFFFAOYSA-N	449.818	1.924	50	20	IDGD	
CNC(=O)CCOc1ccc(NC(=O)C(=O)NNc2ccc(Br)nc2)cc1	784808785	FFOOZHCHMSUYCK-UHFFFAOYSA-N	436.266	1.441	50	20	IDGD	
Cc1ccc(F)c(NNC(=O)C(=O)Nc2ccc(C(=O)NCC(=O)N(C)C)c(Cl)c2)c1	784884920	KWZHOIHNRMKGQE-UHFFFAOYSA-N	449.870	1.687	50	20	IDGD	
O=C(NNc1ccc(C(F)(F)F)nn1)C(=O)Nc1ncn(Cc2ccc(Cl)cc2)n1	784888296	SFHGQCYYRJWSJN-UHFFFAOYSA-N	440.773	1.870	50	20	IDGD	
CN(C)c1nccc(NNC(=O)C(=O)Nc2cc(Br)ccc2N2CCCC2)n1	784969824	AIVZQUMXHVKZBS-UHFFFAOYSA-N	448.325	1.987	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1ccc2c(c1)C[C@H](OC)C2	785330761	LJTJWHNVMXXKGW-OAHLLOKOSA-N	433.486	1.294	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)[C@H](O)Cc1cccc(C(F)(F)F)c1	785742766	ZKRXVRYAQJYKQX-QGZVFWFLSA-N	438.402	1.851	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNc2ccnc(Br)c2)cccc1N1CCNC1=O	787562926	VJKRYTSEBUNDJG-UHFFFAOYSA-N	433.266	1.764	50	20	IDGD	
CS(=O)(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2F)ccc1Cl	788333896	QHTCFVQQFCHOOJ-UHFFFAOYSA-N	448.259	1.936	50	20	IDGD	
O=C(CN1c2cccc3cccc(c23)S1(=O)=O)NN=Cc1ccc2c(c1)NC(=O)CO2	788700995	AHOZJRAJRPGUCD-UHFFFAOYSA-N	436.449	1.830	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1ccc(C(N)=O)c(OC(C)C)c1	789731119	CWTJNXAWEOZWOT-UHFFFAOYSA-N	448.863	1.634	50	20	IDGD	
CNS(=O)(=O)c1ccc2c(c1)N(C(=O)C(=O)NNc1ccc(Cl)c(OC)c1)CC2	789797226	RAZDBUYUJGJXIV-UHFFFAOYSA-N	438.893	1.289	50	20	IDGD	
C[C@@H]1CN(C(=O)Cn2cc(NC(=O)NNc3cccc(F)c3[N+](=O)[O-])cn2)C[C@@H](C)O1	790512215	MYPPIDRZOXWKNT-VXGBXAGGSA-N	435.416	1.715	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCC(C(=O)NNc3ncccc3C)CC2)cc1OC	791224740	GSZQTZLHWMPJDL-UHFFFAOYSA-N	434.518	1.951	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3ncsc3C(F)(F)F)cc2)CC1	792268204	SYHFINDRSKDFAW-UHFFFAOYSA-N	449.480	1.855	50	20	IDGD	
O=C(NNC(=O)c1cc2sc(N3CCCC3)nc2s1)N[C@H]1CCS(=O)(=O)C1	793176965	ORSSANFONUPYKT-VIFPVBQESA-N	429.549	1.089	50	20	IDGD	
CC(=NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)c1cc(S(N)(=O)=O)c(C)cc1C	794516548	TXOCYGJGXMXIKM-UHFFFAOYSA-N	438.531	1.900	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCC1([S@](C)=O)CCC1	798048828	SSLOQEVXXGFZBP-NDHGSNPTSA-N	432.340	1.848	50	20	IDGD	
Cc1cc(O[C@H]2CCN(C)C2=O)ccc1NC(=O)NNC(=O)COCc1ccccc1	799239579	ZYDUWZJJACWNLR-IBGZPJMESA-N	426.473	1.974	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)Nc1ccc2c(c1)OCO2)N1CCN(c2ccc(F)cc2)CC1	802106324	AVUQETGORYORKU-AWEZNQCLSA-N	429.452	1.918	50	20	IDGD	
COc1cc(CCNC(=O)NNC(=O)c2c(C)nc3ccccn23)c([N+](=O)[O-])cc1OC	806970192	IWYQMUJRAGUUBL-UHFFFAOYSA-N	442.432	1.755	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccc(C#N)c(Br)c1	806977650	SNYKLABGDUJCIH-UHFFFAOYSA-N	431.246	1.658	50	20	IDGD	
COC(=O)c1c(F)cccc1NNC(=O)CCNS(=O)(=O)c1cccc(C(C)=O)c1	808029195	IQGBHMWERYKFKK-UHFFFAOYSA-N	437.449	1.627	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cnnc(-c3ccccc3)c2)cc1	809984031	RWFKAXCWTSEIPC-UHFFFAOYSA-N	439.497	1.534	50	20	IDGD	
CNC(=O)c1cc(Oc2ccc(NC(=O)C(=O)NNc3ncc(F)cn3)cc2F)ccn1	810396081	UKGCJBLUIDELTH-UHFFFAOYSA-N	443.370	1.384	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)c2ccc(N3CCNC3=O)cc2)c2ccccc2c1=O	812574105	CWEKLJWWYCCMKD-UHFFFAOYSA-N	434.456	1.582	50	20	IDGD	
C[C@H](C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1)c1ccc(S(C)(=O)=O)cc1	812733436	RYEIANBQOOFWLH-ZDUSSCGKSA-N	425.532	1.587	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)N2CC3(CCC3)c3c(F)cccc32)cc1	813034012	VITCOOFOPJNNPT-UHFFFAOYSA-N	446.504	1.988	50	20	IDGD	
O=C(COC(=O)[C@H]1CCCN(c2ccccc2)C1=O)NNC(=O)c1cccc([N+](=O)[O-])c1	814606558	FKVFDSNRSAAEIT-KRWDZBQOSA-N	440.412	1.342	50	20	IDGD	
COCc1cc(NC(=O)C(=O)NNC(=O)COc2cccc(C)c2)cc(C(=O)OC)c1	815564742	RALXNHWMTZBBCZ-UHFFFAOYSA-N	429.429	1.093	50	20	IDGD	
COC(=O)c1cnn(C)c1NC(=O)C(=O)NNC(=O)c1sc2ccccc2c1Cl	815564829	ULPPWYFIEOTMPX-UHFFFAOYSA-N	435.849	1.475	50	20	IDGD	
CCOCCCn1c(NNC(=O)c2cnn(-c3ccccn3)c2N)nc2ccccc2c1=O	815604503	QUYKRIQVYIJUAU-UHFFFAOYSA-N	448.487	1.743	50	20	IDGD	
COc1ccc(NNC(=O)[C@H](C)NS(=O)(=O)c2c(C)nn(C)c2C)c(C(F)(F)F)c1	816703242	VWXZHVKTZKLLHH-JTQLQIEISA-N	449.455	1.874	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)CCCCCS(N)(=O)=O	816828683	MEPULQIZFRZJDX-LLVKDONJSA-N	436.328	1.213	50	20	IDGD	
Cc1ccccc1[C@H](CC(=O)NNC(=O)[C@H]1CCCN(C(=O)OC(C)(C)C)C1)NC(N)=O	819658103	ISOWOYFGJSUZEF-RDJZCZTQSA-N	447.536	1.889	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2cccnc2OCC(F)F)cc(OC)c1OC	821123505	BHJRFHDYHYHRDW-UHFFFAOYSA-N	447.416	1.375	50	20	IDGD	
CCOC(=O)c1cnc(SCC(=O)NNC(=O)c2cc(Cl)ccc2OC)nc1N	844257309	BESNTIAKIDFVQV-UHFFFAOYSA-N	439.881	1.451	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)c1ccc2ccccc2c1)C(=O)N1CC[C@H](B(O)O)C1	864232340	ZZYDKACUWOBFHN-WMZOPIPTSA-N	436.364	1.315	50	20	IDGD	
CC(=NNC(=O)c1sc(N)nc1C)c1ccc(S(=O)(=O)NCCCC(=O)O)cc1	874111796	WXNSCCZSKVESCC-UHFFFAOYSA-N	439.519	1.331	50	20	IDGD	
Cn1ccnc1SCc1ccc(C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)o1	912947122	PHTHRPUOLHRAHY-UHFFFAOYSA-N	438.469	1.627	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNS(=O)(=O)c2cc(C(=O)O)c(O)cc2C)cc1	914688980	SQBHAEXNMULLLQ-LBPRGKRZSA-N	438.458	1.575	50	20	IDGD	
COc1cccc(CO[C@H](C)C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c1	915275217	QSPQNPSOCMIJLD-LJQANCHMSA-N	440.544	1.960	50	20	IDGD	
O=C(CN(Cc1ccccc1)S(=O)(=O)c1ccc(Cl)cc1)NNC(=O)c1cc[nH]n1	916144657	NRGCXGPWBJVAKU-UHFFFAOYSA-N	447.904	1.715	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)N[C@@H](C)c2nnc3ccccn23)c2ccccc2c1=O	916222181	UZSGZHYRCZBUDX-ZDUSSCGKSA-N	434.460	1.725	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCc2ccc(Cn3cccn3)cc2)nc1	916222399	BYJKRXBPULUGGX-UHFFFAOYSA-N	443.533	1.839	50	20	IDGD	
CC(=NNC(=O)c1ccc(N)cc1)c1ccc(S(=O)(=O)N(C)CCCC(=O)O)cc1	916540447	XPLYKMQLCFKPJD-UHFFFAOYSA-N	432.502	1.908	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)Cc1nc2ccccc2n1C)N1CCc2sccc2C1	916619983	JLTPVZPSZXDMEW-AWEZNQCLSA-N	426.546	1.955	50	20	IDGD	
O=C(Cc1ccc2ccccc2c1)NNC(=O)Cn1cc(Br)c(O)nc1=O	917195374	KHDDCAHCLRRZDA-UHFFFAOYSA-N	431.246	1.255	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)CN(C)C(=O)c2ccc(Br)o2)c1	917388433	FTLZHALAPVTHML-UHFFFAOYSA-N	440.250	1.593	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNS(=O)(=O)c2cccc(C(=O)NC3CC3)c2)cc1	917725939	XJPUCGFLMWFUCB-AWEZNQCLSA-N	447.513	1.755	50	20	IDGD	
Cc1cccc(NC(=O)N2CCC[C@@H](C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)C2)c1	917925411	LSIHMWYRUSLNSR-QGZVFWFLSA-N	448.487	1.676	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)c1c(F)cccc1F	918100918	DUHFMQSIPUDELH-LLVKDONJSA-N	426.445	1.920	50	20	IDGD	
COc1cccc([C@H](C)NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)c1	918109564	QDHGQYZMZSCKEB-HNNXBMFYSA-N	434.518	1.716	50	20	IDGD	
COc1cc(OC)c(CNC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])c(OC)c1	918231287	YLIMZJYDTLGLHM-UHFFFAOYSA-N	434.405	1.530	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3n[nH]c(O)n3)c3ccccc3n2)cc1OC	918289046	KOFNNLWWYVWGGR-UHFFFAOYSA-N	434.412	1.818	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCCCC2)cc1)NNC(=O)NCC(F)(F)F	918707069	NDIUDXPGNJEBKA-UHFFFAOYSA-N	436.456	1.687	50	20	IDGD	
C[C@H]1CN(Cc2ccc(C(=O)OCC(=O)NNC(=O)c3cccs3)cc2)C[C@H](C)O1	919269371	XVCKJQXPOGXIMS-GJZGRUSLSA-N	431.514	1.975	50	20	IDGD	
Cc1sc2ncnc(SCCC(=O)NNC(=O)N[C@@H]3CCS(=O)(=O)C3)c2c1C	919883970	CYZHSSNMUFYGFH-LLVKDONJSA-N	443.576	1.308	50	20	IDGD	
CC(=O)N1CCN(S(=O)(=O)c2ccc(C(=O)NNc3ccc(Cl)cc3)cc2)CC1	920087787	CYIHYKSGKSEBIP-UHFFFAOYSA-N	436.921	1.950	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)NCc1cccc(C(=O)N2CCOCC2)c1	920812158	VHKXJPFDBDGLPH-HNNXBMFYSA-N	444.463	1.596	50	20	IDGD	
COc1ccc(CC(=O)O)cc1S(=O)(=O)NNC(=O)c1cncn1-c1ccccc1	1251237299	JLBWSEORVHUJCK-UHFFFAOYSA-N	430.442	1.131	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NCc1cccc(OCC(F)(F)F)n1	1256154699	DDWYJOTXTQVZCV-UHFFFAOYSA-N	431.396	1.345	50	20	IDGD	
Cc1noc(C)c1S(=O)(=O)N1CCC(C(=O)NNc2ccc(C(C)(C)C)nn2)CC1	1318639618	QFARATAEMFLVGG-UHFFFAOYSA-N	436.538	1.923	50	20	IDGD	
C[C@H]1CN(CCCNC(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)CCCO1	1320785703	LNKUOMIDKDMSNN-INIZCTEOSA-N	441.573	1.465	50	20	IDGD	
COC[C@@]1(CNC(=O)NNC(=O)c2cncn2-c2ccccc2)OCCc2ccccc21	1324690716	OUZHRSQTXRTNQH-HSZRJFAPSA-N	435.484	1.931	50	20	IDGD	
CCc1ccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C3)cc1	1780470111	RPZWKAZOYKOWKV-HYBUGGRVSA-N	444.576	1.750	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(O)ccc2F)C1	1780909682	JRQJFEPXSSIOEG-WRWLIDTKSA-N	428.888	1.913	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(O)ccc2O)C1	1781144906	MDECZURGPOIFHP-XAUMDUMWSA-N	426.897	1.479	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H]1Cc3[nH]nc(C(F)(F)F)c3C1)CCO2	1781220396	ZPUAWUBFZMFFCA-RRUGBERISA-N	448.873	1.991	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)c3cc4cn[nH]c4cn3)CCO2)C1	1781229240	AYPDJBXYPZPRLY-MSOLQXFVSA-N	426.304	1.638	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2)c1ccnc2ncccc12	1781295975	IICMHJDDLPPGSJ-CSODHUTKSA-N	432.908	1.357	50	20	IDGD	
O=C(CCCc1ccncc1)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781327133	XIHHSSMLYZRUMM-SJLPKXTDSA-N	428.302	1.925	50	20	IDGD	
Cn1nc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)c2c1CCC2	1781329147	AGRPZVFRQQTFHN-PBHICJAKSA-N	429.290	1.043	50	20	IDGD	
O=C(c1n[nH]c2c1CCCC2)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781330927	IWQOKGAKTAPGRV-PBHICJAKSA-N	429.290	1.423	50	20	IDGD	
O=C(c1n[nH]c2ccc(F)cc12)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781332428	YKGKJSFDRFJPAF-RHSMWYFYSA-N	443.248	1.836	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1cnc(C)s1)C2	1782179047	RTTPMEFOWPQAKU-GPMSIDNRSA-N	429.970	1.762	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1c(O)cc(O)cc1O)C2)C(Cl)Cl	1782219165	KMMCHLKRPUPWBO-FZKQIMNGSA-N	433.288	1.735	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)Oc2ccccn2)C1	1782540711	QRIDNZWCYURQSU-BZLDKRAPSA-N	439.940	1.617	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H]3Cc4ccccc4N3)C2)C1	1782838043	WVMNNCDTUNDRPE-GZRFBZBPSA-N	436.350	1.884	50	20	IDGD	
O=C(c1ncc[nH]1)N1CCO[C@@]2(CCN(C(=O)[C@H](Br)Cc3ccccc3)C2)C1	1783018610	NRXMWSFNFRCNBM-OXQOHEQNSA-N	447.333	1.859	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccnn3CCOC)CCO2)C1	1783347288	FNYFQNSJXJGLBG-KBXCAEBGSA-N	443.342	1.147	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(C(N)=O)cc3)CCO2)C1	1783354168	NRQQRENDVIMERU-DNVCBOLYSA-N	438.322	1.403	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(C1)CN(C(=O)C1(NC(=O)OC(C)(C)C)CC1)CCO2	1783883934	NIWLHXOSZXUPFZ-AUUYWEPGSA-N	445.944	1.127	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)C(Cl)Cl)C3)C2)cc1O	1783949964	QHPUQAARBXWANU-GOSISDBHSA-N	430.288	1.598	50	20	IDGD	
CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCO[C@@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783952906	WQSOVZLWHHADEA-KZULUSFZSA-N	438.352	1.923	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ncc(F)cc3F)C[C@@H]21	1783970448	ZVECLGSHYDRZHZ-UHXUCMFUSA-N	446.292	1.984	50	20	IDGD	
C=C(CC(=O)OCC)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]2C1	1783972661	MDZQWMKDBXEHOY-VGWMRTNUSA-N	445.354	1.507	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](C)n3ccnc3C)C2)C1	1784638955	IIRUSJMTVZZYKY-QIIPPGSGSA-N	427.343	1.756	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(=O)oc3)[C@H]2C1	1786280309	IHAXEKMGVNEWLJ-MHEUCROKSA-N	427.295	1.407	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C=N/O[C@@H]3CCCCO3)[C@H]2C1	1788660900	RFRNXNMYFLKKCB-HOQDUREWSA-N	446.342	1.279	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)COc3cc(Cl)ccn3)[C@H]2C1	1788730052	KLEAIIGJGZZBPQ-TUUVXOQKSA-N	446.331	1.347	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnn4ccncc34)C[C@@H]21	1788762751	SOGSPPIIRIIWIS-ZVZYQTTQSA-N	431.569	1.174	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3c(C)n[nH]c3C)[C@H]2C1	1788820022	TVAXZHQCLWYQGB-AJNGGQMLSA-N	427.343	1.793	50	20	IDGD	
Cc1ccn(CC(=O)NC2(c3ccc(NC(=O)c4cnccc4C(=O)NN)cc3)CCC2)n1	1789521108	HCDFOICYNUQEQM-UHFFFAOYSA-N	447.499	1.638	50	20	IDGD	
CN1CCN(C2(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)C(C)(C)CCl)C[C@@H]43)CC2)CC1	1789804591	CXFSIKFLMPGLJG-BZSNNMDCSA-N	441.016	1.011	50	20	IDGD	
CCOC(=O)C1(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CO[Si](C)(C)C)C[C@@H]32)CC1	1790719718	QLAQPOVGJPEILZ-JYJNAYRXSA-N	426.586	1.161	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccc(C#N)cc1	1792556346	HOLAUQRUUABNJC-UEILYKACSA-N	434.334	1.721	50	20	IDGD	
CC[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)CBr)N(CC)CC	1792868901	VMLUNVRTRKUPNZ-NQNKBUKLSA-N	432.403	1.727	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(N(C)C)cc1)C2	1792872445	IIWKVNKEMDNAFQ-NYCLONFESA-N	438.366	1.987	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(=O)c1ccc(Cl)cc1	1792948455	CSVCHXCESBKRSE-DNVSUFBTSA-N	443.725	1.896	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C[C@@H]1COc2ccccc2O1	1793268155	KHNRLJZXJFTIHJ-MPWIWIEXSA-N	448.592	1.658	50	20	IDGD	
CC(C)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN1CCc2sccc2C1	1793895532	FZOUSBQBNPMFSM-HGKCTWBKSA-N	440.009	1.961	50	20	IDGD	
C[C@@H]1CCc2c(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)CCBr)n[nH]c21	1795114546	VAQRISZNPOJDDP-LSSIXWDNSA-N	425.327	1.448	50	20	IDGD	
O=C(CCOc1ccc(F)cc1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1	1796185903	YNPYVARQKUAVGU-ACDBMABISA-N	440.280	1.226	50	20	IDGD	
COC(=O)C12CCC(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@H](F)Cl)(CC1)CC2	1796365609	UVSLZDHLNJIJIH-UQPGURTASA-N	430.904	1.624	50	20	IDGD	
CC(=O)Nc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@](C)(Cl)CCl)C3)ccn1	1796747275	BZWVJOQMZYXOKZ-MVWRLGRASA-N	443.331	1.480	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(-c2ccccc2)no1	1798138810	CYNLZWPTHWANIA-YYAJDYIMSA-N	433.892	1.799	50	20	IDGD	
COc1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](O)CCl)C3)cc(C(F)(F)F)n1	1799207504	ZIAOLTZYETXVDQ-RNJOBUHISA-N	435.830	1.961	50	20	IDGD	
COc1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](O)CCl)C3)cc(C(F)(F)F)n1	1799207506	ZIAOLTZYETXVDQ-YVECIDJPSA-N	435.830	1.961	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)COCCNC(=O)OC(C)(C)C	1799260267	BCNOAYGVIWEYQR-JYYAWHABSA-N	447.960	1.135	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(OC)c(OC)c1O	1799664044	FEGBIAVBUUVQEH-FAXLKDOZSA-N	426.897	1.630	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1=NO[C@@H](c3ccccc3)C1)C2	1800978026	JUQKLBQDMKMHLQ-CTRAYCPCSA-N	435.908	1.347	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](Br)Cc1ccccc1)C2)C1=COCC1	1801548880	QZYBJNHKQWYJPV-FCGDIQPGSA-N	449.345	1.886	50	20	IDGD	
C[C@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(=O)nc3sccn13)C2	1801963979	VHLDROTZKQPRTG-YFKTTZPYSA-N	439.335	1.791	50	20	IDGD	
O=C(Cc1cccc([N+](=O)[O-])c1)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1	1802378161	NRPUKUQWJJLPTF-HQRMLTQVSA-N	446.891	1.838	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc3ncnn3c2)[C@H]1c1cccnc1)[C@@H](O)CCl	1803142787	JDXLCVRAEGAYNU-ZVZYQTTQSA-N	428.880	1.044	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H](CNC(=O)c2ccc(O)nn2)[C@@H]1c1cccnc1	1805268320	KADNDJFQPDZELM-BEFAXECRSA-N	429.553	1.748	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2ccsc2)[C@H]1c1cccnc1	1805424836	KVPWMBUGFCXJBT-OXQOHEQNSA-N	429.546	1.836	50	20	IDGD	
Cc1ncoc1C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1	1805857859	LEKXACIGEQSLFS-QAPCUYQASA-N	449.471	1.010	50	20	IDGD	
CC(C)(F)C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1	1806982138	MCMRRUHNODIROC-WMLDXEAASA-N	428.468	1.148	50	20	IDGD	
CCC(=O)N[C@H](C)C(=O)N1CC[C@H](CNC(=O)[C@@H](F)Br)[C@H]1c1cccnc1	1808649194	LFOGALZYQKSXHE-UIBBOPPKSA-N	443.317	1.693	50	20	IDGD	
Cc1cc(C(=O)NC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)c[nH]1	1808779403	XRCCMMGTBZQBIB-JXFKEZNVSA-N	447.499	1.350	50	20	IDGD	
CCOC(=O)N[C@H](O)C(=O)NC[C@@H]1CCN(C(=O)C(C)(C)CCl)[C@@H]1c1cccnc1	1810086751	IKPSSHAPOXGTMN-ZMSDIMECSA-N	440.928	1.417	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2cc3cccnn3n2)[C@H]1c1cccnc1	1813030517	CXGOPFFERWQHAU-AYBZRNKSSA-N	442.907	1.698	50	20	IDGD	
COCc1oncc1C(=O)N1CC[C@H](CNC(=O)[C@H](Cl)COC)[C@@H]1c1cccnc1	1813031838	XODXUXSDNLKWIX-KYJSFNMBSA-N	436.896	1.789	50	20	IDGD	
CC(=O)N(C)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](F)Br)[nH]n1	1815582899	JRNHVUVWAQCNCN-WFASDCNBSA-N	432.294	1.961	50	20	IDGD	
Cc1ncsc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1816491853	GFVRHGXRVHAJEI-MRXNPFEDSA-N	439.306	1.474	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](C)Br)CC2	1817023487	DZFBNTYILSLQIE-CIUDSAMLSA-N	432.344	1.285	50	20	IDGD	
O=C(CCN1CCOCC1)Nc1cc([C@H]2CCCCN2C(=O)CCBr)[nH]n1	1817178521	OSDBEUMVSTVLCS-OAHLLOKOSA-N	442.358	1.909	50	20	IDGD	
CC[S@](=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCBr)CC2	1819508032	LYSQJCKPSMJFJT-ZZDSUILFSA-N	436.397	1.999	50	20	IDGD	
O=C(/C=C/C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1)NCc1ccco1	1819532266	KFNSFGCFWVPHPB-YCZSJOHXSA-N	449.895	1.467	50	20	IDGD	
C[C@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](F)Br)n[nH]1)n1ccnn1	1820936401	BQWFWSWKCIEROY-XWIASGKRSA-N	428.266	1.945	50	20	IDGD	
Cc1ccc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2ccc(B(O)O)cc2)CC3)c(C)c1	1822018196	IHGAHALFECFSNR-KRWDZBQOSA-N	449.341	1.979	50	20	IDGD	
CC[C@@H](Br)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2CCC(=O)N2)[nH]n1	1822088620	WVQILIYRYDNZCB-MDZLAQPJSA-N	426.315	1.854	50	20	IDGD	
C[C@H](Br)C(=O)Nc1cc([C@H]2CCCCN2C(=O)C[C@](C)(O)CC(=O)O)[nH]n1	1822191956	OVESZRZLEAQOMC-BFCNOCSMSA-N	445.314	1.801	50	20	IDGD	
C[C@H](C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](F)Br)[nH]n1)n1cnnn1	1822858834	AFDQWJAJXJEPRA-HLUHBDAQSA-N	429.254	1.340	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(=O)n3[nH]nnc3n2)CC1	1824614242	JUFFPOSIUZDSSN-GDBMZVCRSA-N	449.943	1.453	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnn3ncccc13)CC2	1825997861	DELZFWCZFLXKJB-CMPLNLGQSA-N	434.909	1.665	50	20	IDGD	
O=C(c1ccccc1O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827050689	UAFYKYTZENQLBW-OAQYLSRUSA-N	436.317	1.619	50	20	IDGD	
Cn1cc(F)cc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827052997	RULKBBYCHOKRDO-HXUWFJFHSA-N	441.312	1.391	50	20	IDGD	
C[C@H](C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2)c1ccccc1	1828230753	SBCZCFMFSDZWHX-KBXCAEBGSA-N	449.341	1.852	50	20	IDGD	
C[C@H](Cn1ccnc1)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1	1832227643	SAMBZRRIICJHOS-UYAOXDASSA-N	446.596	1.512	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)CC[C@@H]2CCOC2)CC1	1832456271	LYXBWDBDURVYPB-UYAOXDASSA-N	436.597	1.796	50	20	IDGD	
CN(C)C(=O)NCC(=O)N1CCC(N2CCC(NC(=O)C(C)(C)CCl)CC2)CC1	1833214061	WNZVNVBMSFLZEO-UHFFFAOYSA-N	429.993	1.094	50	20	IDGD	
C[C@@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)c3ccnnc3)CC2)CC1	1833262624	ZKEJLEKXJVDRIQ-AWEZNQCLSA-N	438.370	1.693	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)CCc3cnc[nH]3)CC2)CC1	1833789400	FMMUCDYYSKEKRK-SFHVURJKSA-N	425.961	1.168	50	20	IDGD	
O=C(CCc1ccccc1Cl)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1	1835173075	OSVFOCGMJCKEMP-PXNSSMCTSA-N	445.343	1.329	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C1(C(F)(F)F)CCC1)CCO2	1835473863	BDUPRBODUHGAIK-CJNGLKHVSA-N	442.862	1.429	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cn4cccnc4n3)CC2)CC1	1835548208	JSTYQYCZWXGYBW-QGZVFWFLSA-N	432.956	1.932	50	20	IDGD	
C=CC(=O)N[C@@H](C)C(=O)NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1	1835829411	JEZIYTIOEKQLEC-AWEZNQCLSA-N	443.386	1.034	50	20	IDGD	
CCc1ccnc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)c1	1836360037	DPHFWSUPXFWWLU-IFXJQAMLSA-N	440.338	1.497	50	20	IDGD	
C[C@H](Oc1cccnc1)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836719631	ATCUCDWCMLHQCG-KXBFYZLASA-N	439.940	1.447	50	20	IDGD	
Cc1cc(CC(=O)N2CCC(OC3CCN(C(=O)[C@@H](F)Br)CC3)CC2)n[nH]1	1838412874	UDKYOMPWNFHZQX-QGZVFWFLSA-N	445.333	1.950	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cc(CO)on3)CC2)CC1	1838558277	XDDUMBZXBDERGX-MRXNPFEDSA-N	429.901	1.033	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCNC(=O)OC(C)(C)C)C2)C1	1839149518	JMSNJLLEJGDHAA-MGPUTAFESA-N	447.960	1.375	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CCCCN3C)C2)C1	1839961868	LQOWFKDNTUNWQT-FCEWJHQRSA-N	446.386	1.101	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cccc(F)c3)C2)C1	1840032376	WVEGVWDCCOMVTH-LIRRHRJNSA-N	443.313	1.608	50	20	IDGD	
C[C@@H](Cc1ccccn1)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1840335832	XVCJOLCDGDMOSU-LIRRHRJNSA-N	430.332	1.520	50	20	IDGD	
O=C(c1ccc2[nH]nc(Br)c2c1)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1	1841351681	XWOAOIXVOLEBMO-CYBMUJFWSA-N	441.713	1.742	50	20	IDGD	
Cc1cc(C(=O)N2CC3(CCCN3C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)on1	1841924250	OQCHMPSYAZTOLU-ZDUSSCGKSA-N	426.901	1.932	50	20	IDGD	
Cc1nn[nH]c1C(=O)N1CC2(CCCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C1	1841924400	HXWHPJGRUUFFEU-LBPRGKRZSA-N	426.905	1.062	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1cc(-c3ccco3)no1)C2	1844264085	CBUGIDPGZSLWCO-UHFFFAOYSA-N	436.428	1.064	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)C2=C3c4ccccc4C(=O)N3CC2)C1	1844651144	KCGFHPRCEHPMKV-QGZVFWFLSA-N	429.904	1.714	50	20	IDGD	
CN(CC(=O)N1CCCC12CN(C(=O)[C@@]1(C)CC1(F)F)C2)NC(=O)NCc1ccccc1	1845039919	VWDOJPJANLOIKN-HXUWFJFHSA-N	449.502	1.581	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H]1CCC[C@@H]1C(=O)N1CCCC12CN(C(=O)[C@H](O)CCl)C2	1847085248	XUELNKKHSIGQJB-SOUVJXGZSA-N	429.945	1.483	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)C[C@H](NC(N)=O)c2cccs2)c2ccccc2c1=O	11148170	HOZMKOXDMNMJQI-AWEZNQCLSA-N	442.501	1.429	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)[C@@H]1CC(=O)N(Cc2ccccc2)C1	15314971	MTDLYNZIGLSTHM-OAQYLSRUSA-N	449.555	1.395	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)CN2C(=O)N[C@@]3(C[C@H](C)CC(C)(C)C3)C2=O)c1	23154004	TYYANNWSMQGJLH-WAIKUNEKSA-N	444.532	1.966	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)CN1C(=O)N[C@@](C)(c2ccc(F)cc2)C1=O	23750565	QSHLPAREZDUBII-QKVFXAPYSA-N	446.410	1.347	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)OCC(=O)NNC(=O)c2ccccc2)cc1	39657778	VWJMVYGJWMVOGV-SFHVURJKSA-N	445.497	1.153	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)CCc2ccc(S(=O)(=O)NC3CC3)cc2)cc1	105880471	BWAJREWSWLBORX-UHFFFAOYSA-N	446.529	1.328	50	20	IDGD	
CC[C@@H](C)C(=O)N1CCC[C@@H](C(=O)OCC(=O)NNC(=O)c2ccc(OC)c(OC)c2)C1	726040881	ZSBBSFQMOPPHGZ-GDBMZVCRSA-N	449.504	1.293	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@@H](C)C(=O)NNC(=O)CS[C@@H]1CCS(=O)(=O)C1	726198699	PNOUPPNRZNDASJ-GXTWGEPZSA-N	434.967	1.792	50	20	IDGD	
O=C(CN1C(=O)c2ccccc2S1(=O)=O)NNC(=O)c1c(Cl)cccc1Cl	727804460	CCMKXGWTSSREBD-UHFFFAOYSA-N	428.253	1.599	50	20	IDGD	
CCOC(=O)c1c(S(=O)(=O)NNC(=O)[C@H](C)Oc2ccc3ccccc3c2)n[nH]c1C	728170496	YEZSBRLRLKGJNI-ZDUSSCGKSA-N	446.485	1.825	50	20	IDGD	
COc1cccc(C(=O)NNS(=O)(=O)c2ccc(Br)cc2[N+](=O)[O-])c1O	728505686	NKVJYZFQIGRIQN-UHFFFAOYSA-N	446.235	1.695	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc2c(c(C(=O)O)c1)OCCO2)c1cccc(OC(F)F)c1	728509887	AXHJKIHNZWLKGI-UHFFFAOYSA-N	444.368	1.381	50	20	IDGD	
CCN(CC(=O)Nc1ccc(N2CCOCC2)cc1)C(=O)NNC(=O)Cc1cccnc1	728957631	ZGQFMQRSKFVACA-UHFFFAOYSA-N	440.504	1.162	50	20	IDGD	
CCC(CC)N1C[C@H](C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)CC1=O	729297049	RMPWMOHDFPKPEB-GOSISDBHSA-N	429.565	1.383	50	20	IDGD	
O=C(CN1CCC[C@@H](NS(=O)(=O)c2cccc(F)c2)C1)NNC(=O)c1ccccc1	729482304	NFNIHJAYIFSQPI-QGZVFWFLSA-N	434.493	1.030	50	20	IDGD	
NC(=O)[C@H]1CCCN1Cc1cccc(NC(=O)NNC(=O)CCc2ccccc2O)c1	730020528	MAKPEOFLXWXKAO-GOSISDBHSA-N	425.489	1.627	50	20	IDGD	
CC(C)N1C(=O)c2ccc(C(=O)NNC(=O)c3cccc4ncccc34)cc2S1(=O)=O	730227516	CAEIEXXDDOVTSO-UHFFFAOYSA-N	438.465	1.863	50	20	IDGD	
NC(=O)c1ccc(/C=C\C(=O)N2CCC[C@@H]2C(=O)NN=c2cc[nH]c3ccccc23)cc1	730288698	WXKSDXIVUBYXJT-ZDKIGPTLSA-N	429.480	1.903	50	20	IDGD	
COC(=O)Cc1cc(=O)n(-c2ccc(C(=O)NNC(=O)C(C)(C)c3ccccc3)cc2)[nH]1	731201244	KSKPGMWHDVCPHW-UHFFFAOYSA-N	436.468	1.620	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)CN1C(=O)N[C@](C)(c2ccc(OC)cc2)C1=O)c1ccccc1	731995905	CRZMJHFGBVSBLW-WZONZLPQSA-N	438.484	1.803	50	20	IDGD	
C[C@@H]1C[C@@H]1c1ccc(CCC(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)o1	735117006	KSAFWSJCOLUROZ-WBVHZDCISA-N	447.561	1.810	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N1CCS(=O)(=O)C[C@@H]1C	740026488	YJCRDSFVFTXDFO-QWRGUYRKSA-N	434.312	1.076	50	20	IDGD	
O=C(Cn1cc(NS(=O)(=O)c2ccc(CCCCl)cc2)cn1)N1CCOCC1	741650857	BGUVISCFACCKAZ-UHFFFAOYSA-N	426.926	1.714	50	20	IDGD	
Cc1nn(C)c2sc(C(=O)N[C@@H](C)C(=O)NNC(=O)c3ccc(Cl)cc3O)cc12	743317640	NBYXEDSYPLYYQA-VIFPVBQESA-N	435.893	1.882	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)c1nc(-c2cccc(F)c2)no1	743511931	QAJBVGBZNYIZDO-LLVKDONJSA-N	437.395	1.557	50	20	IDGD	
O=C(NCC(=O)N1CCc2ccccc2C1)NNC(=O)c1cccc(Br)c1	743580406	DLJFLCUYEVLYBF-UHFFFAOYSA-N	431.290	1.978	50	20	IDGD	
COC[C@](C)(O)CNC(=O)/C(C#N)=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	743771295	FOYNXRPNMWQASC-ZVYZCIRASA-N	445.907	1.499	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)CCCNC(=O)OCc2ccccc2)cc1	743830084	MIQOTHUGHKWJMK-UHFFFAOYSA-N	448.501	1.949	50	20	IDGD	
Cc1cc2ncc(C(=O)NNc3ccccc3S(=O)(=O)N3CCOCC3)c(C)n2n1	744618745	ADBZHQRIUBLFQI-UHFFFAOYSA-N	430.490	1.124	50	20	IDGD	
Cc1ccc(C(=O)N2CCC[C@@H](C(=O)OCC(=O)NNC(=O)c3ccc(C#N)cc3)C2)cc1	744706037	XFKOCDPLRMMYGA-HXUWFJFHSA-N	448.479	1.723	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1cc([N+](=O)[O-])ccc1O)c1ccc(N2CCOCC2)cc1	745778920	JNAQLWZJYLOSIO-ZDUSSCGKSA-N	429.433	1.842	50	20	IDGD	
C[C@H]1C[C@@H](NC(=O)NNC(=O)CC23CC4CC(CC(C4)C2)C3)C(=O)N1c1cnn(C)c1	745918333	NRTWPEMRZDINKS-ISFGOQRRSA-N	428.537	1.851	50	20	IDGD	
Cn1c(SCC(=O)NNC(=O)Cc2cn3ccccc3n2)nnc1-c1cccs1	746555719	GYLSUISQLCOTSU-UHFFFAOYSA-N	427.515	1.674	50	20	IDGD	
C[C@H]1CN(Cc2cccc(CNC(=O)NNC(=O)Cc3cn4ccccc4n3)c2)CCO1	746754257	APMZFIYWTGZLQA-KRWDZBQOSA-N	436.516	1.628	50	20	IDGD	
Cc1c(C(=O)NNC(=S)NCC2CCC2)cc(Br)cc1S(N)(=O)=O	747523817	RDMIQNQGQLKSTI-UHFFFAOYSA-N	435.369	1.314	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)Cn1cc([N+](=O)[O-])ccc1=O	748697397	GPEXGSPVZKJQRJ-JTQLQIEISA-N	439.222	1.134	50	20	IDGD	
COCCOc1ccc(Cl)cc1C(=O)OCC(=O)NNC(=O)c1cccc(C#N)c1	748935506	YNRDSQOXWOZMTD-UHFFFAOYSA-N	431.832	1.855	50	20	IDGD	
C[C@@H](Cn1cncn1)NC(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	749211194	LJVNRZWVIWQYOR-HNNXBMFYSA-N	446.475	1.013	50	20	IDGD	
O=C(NCC(=O)N1CCN(c2ccccc2)CC1)NNC(=O)c1ccc2ccccc2n1	749219513	AWVIVMKTVHUVCB-UHFFFAOYSA-N	432.484	1.528	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)C2(S(C)(=O)=O)CCCC2)c2ccccc2c1=O	749837716	JWJNKUGVEONZBN-UHFFFAOYSA-N	448.545	1.705	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)CCc3nc[nH]n3)c2)cc1	750014760	GWWDIRZPDPANRH-UHFFFAOYSA-N	444.473	1.008	50	20	IDGD	
O=C(CN1CCC(Oc2ccccc2I)CC1)NNC(=O)C1CC1	750056399	KGPIWGGDHLPPNC-UHFFFAOYSA-N	443.285	1.692	50	20	IDGD	
C[C@H](NC(=O)CC1CCCCC1)C(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	750233995	LNKBXSBVPMZUEA-ZDUSSCGKSA-N	434.449	1.374	50	20	IDGD	
O=C(NNC(=O)C1(c2ccc(Br)cc2)CCOCC1)[C@@H]1CCS(=O)(=O)C1	751064879	ZVDUEWDCAWHFOF-GFCCVEGCSA-N	445.335	1.079	50	20	IDGD	
N#Cc1ccc(S(=O)(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)cc1C(F)(F)F	751516029	DQEXGSJSIRFABL-UHFFFAOYSA-N	430.320	1.814	50	20	IDGD	
CN(CC(=O)NNC(=O)c1cc2c(s1)CC[C@H](C(C)(C)C)C2)[C@H]1CCS(=O)(=O)C1	753564147	OPCRQHOKMVTUIP-GJZGRUSLSA-N	441.619	1.779	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)N[C@@H]1CCO[C@H](c2ccc(F)cc2)C1	754135991	SVPUVQKWOSKMQJ-WBVHZDCISA-N	449.508	1.983	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1cccc(C(=O)NNC(=O)Cc2cc[nH]n2)c1)c1ccccc1	755278850	FQEGYWMQVAHZMP-CQSZACIVSA-N	427.486	1.453	50	20	IDGD	
COC(=O)CCNC(=O)c1ccc(NC(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)cc1	755605048	XZEPNLXRZCTZSN-CYBMUJFWSA-N	446.435	1.739	50	20	IDGD	
CC(C)C[C@@H](C)OCCC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	755775797	JEPKHZQHADKQBL-QGZVFWFLSA-N	426.583	1.907	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)Nc3ccc(C(N)=O)cc3C)n[nH]2)cc1OC	755806042	SDERYQGHQRNCDI-UHFFFAOYSA-N	438.444	1.968	50	20	IDGD	
CC(C)(C)S(=O)(=O)N1CCC(NC(=O)NNC(=O)Cc2ccc(Cl)cc2)CC1	755899610	NOQBOCBHIIHUMW-UHFFFAOYSA-N	430.958	1.806	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)Nc2cccc(N3C(=O)CNC3=O)c2)cc1	755995002	OGOVGXXCNCFIIU-CYBMUJFWSA-N	439.428	1.566	50	20	IDGD	
COc1cc(CN2CC[C@@H](NC(=O)NNC(=O)Cn3nc(C)cc3C)C2)cc(OC)c1	756093934	HDTMEVZVAKPKTI-QGZVFWFLSA-N	430.509	1.122	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)Nc2cc(N3CCCC3=O)ccc2F)c2ccccc2c1=O	756126462	YAYYPGBJKWERGX-UHFFFAOYSA-N	438.419	1.666	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c(Br)c1	756319498	IBMAZXBGBQUBEC-UHFFFAOYSA-N	432.238	1.900	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)Nc2cc(F)cc(S(N)(=O)=O)c2)cc1OC	756514492	HSAWZHLUAGAJAW-UHFFFAOYSA-N	426.426	1.347	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)Nc2ccn(CCN3CCOCC3)n2)cc1	756647957	XORRVSAWUWFNDC-MRXNPFEDSA-N	444.492	1.038	50	20	IDGD	
CS(=O)(=O)c1ccccc1-n1cc(NC(=O)NNC(=O)c2ccc3c(c2)OCO3)cn1	756703587	AJEMIFHOUNMSDQ-UHFFFAOYSA-N	443.441	1.471	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)Nc1ccc(F)cc1I	756872129	POFCVEODVQMHLQ-ZETCQYMHSA-N	441.222	1.018	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)sc1Br	758402003	MQEVAXCPRYRZFK-UHFFFAOYSA-N	433.305	1.998	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)NCCOc1cccc(C(F)(F)F)n1	758653598	VAJIKXUPMBZTJK-UHFFFAOYSA-N	428.367	1.897	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NC[C@@H](C)CC2(C)OCCO2)c2ccccc2c1=O	758851152	CWSYLKHABKFGHN-HNNXBMFYSA-N	445.520	1.930	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)NC[C@@H]1CN(Cc2ccccc2)CCCO1	758856841	XKXPBRYREBZFFQ-GOSISDBHSA-N	430.480	1.826	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)c1ncc(Br)cc1Br	759378273	FGWBKJCCLNAEBO-UHFFFAOYSA-N	436.104	1.672	50	20	IDGD	
COC[C@@H](NC(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccc(Cl)cc1)C(N)=O	760043171	NBXBQHCNSZIGIG-CRPZLVSXSA-N	426.864	1.641	50	20	IDGD	
C[C@H](NC(=O)OC(C)(C)C)[C@@H]1CN(CC(=O)NNC(=O)c2ccccc2Cl)CCO1	760977769	RKJUXBVMACGIEP-BBRMVZONSA-N	440.928	1.715	50	20	IDGD	
N#Cc1cccc([C@H]2CN(C(=O)NNC(=O)c3csc(N4CCOCC4)n3)CCO2)c1	762413659	AWBHTCBJFOEZAR-QGZVFWFLSA-N	442.501	1.279	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NN=C(C)[C@@H](C)OC)N(S(C)(=O)=O)CC2	763143056	YZUGYHSJEZEZRQ-CJNGLKHVSA-N	427.523	1.480	50	20	IDGD	
CCC(CC)NC(=O)[C@H]1CN(C(=O)C(=O)NNC(=O)c2ccccc2)c2ccccc2O1	763423822	VZNCXUJVJQWSIN-LJQANCHMSA-N	438.484	1.547	50	20	IDGD	
CC(C)(C)OC(=O)Cc1ccccc1NC(=O)C(=O)NNC(=O)c1ccc2c(c1)OCO2	763558557	LFYMDXCJGNGNFQ-UHFFFAOYSA-N	441.440	1.699	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2ccc(F)c(C(=O)N(C)C)c2)c1	763643903	ARXGQEDZNYFXCL-UHFFFAOYSA-N	430.436	1.309	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cnc2c(cnn2C(C)C)c1	763679766	DBAFBRAGJZABGV-UHFFFAOYSA-N	440.460	1.576	50	20	IDGD	
O=C(COc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1ccc(O[C@H]2CCOC2)cc1	763686707	QDVIPWCTSKEUTG-KRWDZBQOSA-N	433.848	1.673	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)CCC3)c2ccccc2c1=O	763790691	MTUUPJBPAWFMSF-UHFFFAOYSA-N	433.468	1.866	50	20	IDGD	
C[C@@H](C#N)CSc1ccccc1NC(=O)C(=O)NNC(=O)COc1ccccc1C#N	763814963	XYANMXNSAHIIPL-AWEZNQCLSA-N	437.481	1.975	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(C(=O)N3CCCC3)cc2C)cc1	763819895	ARTDEPPTZKBOLK-UHFFFAOYSA-N	438.484	1.704	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)C(=O)N(C)CC2	763870713	BTDMCXLNFXBFSA-LBPRGKRZSA-N	428.420	1.007	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)C(=O)Nc2ccc(N3CCOC3=O)cc2)cc1	763891998	TYWARJYRZRNMFG-UHFFFAOYSA-N	428.470	1.830	50	20	IDGD	
COC(=O)c1csc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2OC)c1C	764010996	FIHFYGNJBDVNJE-UHFFFAOYSA-N	425.850	1.905	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1cccc(CN2CCOC2=O)c1	764011006	FHOUOHUTAALECF-UHFFFAOYSA-N	446.847	1.701	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(NC(=O)c3ccccc3)nc2)c1O	764133574	XBYCYURCBKDMDQ-UHFFFAOYSA-N	449.423	1.448	50	20	IDGD	
COc1ccc(Br)c(NC(=O)C(=O)NNC(=O)Cc2ccccc2OC)c1	764133688	YYWJFQDWSXNYBM-UHFFFAOYSA-N	436.262	1.795	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)CCC(C)C)c(Br)cc1F	764199092	MQMSTAGYGRMBAI-UHFFFAOYSA-N	432.246	1.897	50	20	IDGD	
COC(=O)c1cc(OC)c(OC)c(OC)c1NC(=O)C(=O)NNC(=O)CC(C)(C)C	764199499	UAKYIAWARWVKMC-UHFFFAOYSA-N	425.438	1.021	50	20	IDGD	
CCOC(=O)C(C)(C)n1cc(NC(=O)C(=O)NNC(=O)C(C)(C)c2ccccc2)cn1	764310107	YVZFJKIZMZLYNQ-UHFFFAOYSA-N	429.477	1.245	50	20	IDGD	
O=C(NNC(=O)C1CCC1)C(=O)Nc1ccc(C(=O)NCc2ccccn2)c(Cl)c1	764339373	RUJJWNLNSDCCFI-UHFFFAOYSA-N	429.864	1.551	50	20	IDGD	
Cc1cccc(-n2ncc(C(=O)NNC(=O)CNC(=O)c3cccnc3)c2C(F)(F)F)c1	764344390	BXUMZIGZEWJKMT-UHFFFAOYSA-N	446.389	1.786	50	20	IDGD	
Cc1n[nH]c(C)c1[C@@H](C)CC(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	764752157	HSPGMQYCXGYVGU-HNNXBMFYSA-N	426.521	1.126	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)[C@]1(F)CCN(C(=O)OC(C)(C)C)C1	765312901	GUPQKQHQFAEOST-IBGZPJMESA-N	432.493	1.788	50	20	IDGD	
Cc1nc(-c2cccnc2)nc(O)c1CC(=O)NNC(=O)CCCNC(=O)OC(C)(C)C	765323469	QRMUZNACJVFRGJ-UHFFFAOYSA-N	444.492	1.547	50	20	IDGD	
CCC1(CC)[C@@H](NC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)C[C@H]1OC	765635267	QJMYUDMSJIVIBG-UONOGXRCSA-N	425.555	1.826	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1c(C)ccc([N+](=O)[O-])c1C	766258854	NBXOVRNRGPJEQZ-UHFFFAOYSA-N	430.417	1.775	50	20	IDGD	
O=C(Cc1cccc(OCCCOc2ccccc2)c1)NNC(=O)C(=O)N1CCCC1	766555112	KANBBUKODWVOHQ-UHFFFAOYSA-N	425.485	1.847	50	20	IDGD	
CN(C)C(=O)COc1ccccc1C(=O)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	768275760	CMYGNMISYCARNF-UHFFFAOYSA-N	425.420	1.758	50	20	IDGD	
CCOc1ccc(NC(=S)NNC(=O)c2cccc([C@]3(C)NC(=O)NC3=O)c2)cc1	768928669	GDDQXRWCKRMOIW-FQEVSTJZSA-N	427.486	1.771	50	20	IDGD	
O=C(Oc1ccc([N+](=O)[O-])c2ncccc12)c1ccc(S(=O)(=O)N2CCOCC2)o1	770126669	DOIZZWLQSMMQEE-UHFFFAOYSA-N	433.398	1.976	50	20	IDGD	
C[C@H](CBr)COC(=O)CNS(=O)(=O)c1ccc(N2CCCC2=O)cc1	770316576	GJSCNBCQAXKNSM-GFCCVEGCSA-N	433.324	1.666	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)[C@@H]3CCCN3C(=O)c3ccccc3O)nc21	771008891	MYCHJHXAJGCLRK-AWEZNQCLSA-N	439.476	1.740	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1	772187687	ATTRELDQUYCDRO-UHFFFAOYSA-N	442.819	1.511	50	20	IDGD	
COc1cccc([C@@H]2[C@@H](C(=O)O[C@@H](C)C(=O)NNC(=O)CC(C)C)CC(=O)N2C2CC2)c1	772234811	FKMXGFOPESCRRO-DHUIEDIVSA-N	445.516	1.872	50	20	IDGD	
CC(C)(C)NC(=O)N1CCN(C(=O)NNC(=O)c2ccc(Br)s2)CC1	773129700	NYCFBQWXYAOAHJ-UHFFFAOYSA-N	432.344	1.991	50	20	IDGD	
CCOC(=O)[C@@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNc2c(F)cccc2F)cc1	773708421	BAXSBSKMUWGCGK-LLVKDONJSA-N	434.399	1.728	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)cn1	774008616	JGULBDNTXMLSOB-LBPRGKRZSA-N	436.852	1.314	50	20	IDGD	
CCc1cnccc1[C@@H](C)NC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	774336576	ZCUCOJDZCMKNHF-OAHLLOKOSA-N	447.565	1.362	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)NCC(F)(F)CNC(=O)OC(C)(C)C	777407413	FYKJQKQBAAPUJC-UHFFFAOYSA-N	426.424	1.747	50	20	IDGD	
COc1c(F)cc(S(=O)(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1[N+](=O)[O-]	777601668	XUTHOQBRPYMFDG-UHFFFAOYSA-N	427.366	1.137	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)C1CCN(C(=O)/C=C\c2ccccc2)CC1	778434295	YMUNQIPVXKQUNK-KTKRTIGZSA-N	430.505	1.611	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)c1cc(I)ccc1O	778517765	NNTCKLKBAUGXDF-UHFFFAOYSA-N	435.218	1.283	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)NC[C@@H](c1cccc(F)c1)N1CCOCC1	778632386	VSJYNZVMVXUAPW-INIZCTEOSA-N	439.488	1.054	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@H](C(=O)NNC(=O)c2ccc3ccccc3c2)[C@@H](C)O)cc1	779500092	LEIULDDZNIBAJP-QRWLVFNGSA-N	441.509	1.637	50	20	IDGD	
N#CCCn1cc(/C=C(\C#N)C(=O)N2CC(n3cc(C(N)=O)nn3)C2)c(-c2ccccc2)n1	779548334	CSDSGJHXDPZVMC-CXUHLZMHSA-N	441.455	1.145	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNc2nc3ccccc3s2)ccc1S(=O)(=O)N(C)C	782812785	SOLAVBSKJAHWIS-UHFFFAOYSA-N	449.514	1.637	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ccc(Br)cc2)cc1-n1nnnc1C	783009963	UWLGMVLUZLWPNN-UHFFFAOYSA-N	446.265	1.824	50	20	IDGD	
CN(C)C(=O)COc1ccc(NC(=O)C(=O)NNc2ncccc2C(F)(F)F)cc1	783112869	SMUHQDUVNMOVGH-UHFFFAOYSA-N	425.367	1.649	50	20	IDGD	
CCOc1ccc(C#N)cc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)NC(C)C)cn1	783263097	HKBZOUUXJDHTJU-UHFFFAOYSA-N	446.489	1.120	50	20	IDGD	
O=C(NNc1nccc2sccc12)C(=O)Nc1ccc(C(=O)N2CCOCC2)cc1	783440372	XFKVGWZFLHECGN-UHFFFAOYSA-N	425.470	1.851	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2ccc(S(=O)(=O)N3CCCCCC3)cc2)ncn1	783948049	GPZLVQAMDRRXNZ-UHFFFAOYSA-N	432.506	1.432	50	20	IDGD	
C[C@@H]1CN(C(=O)Cn2cc(NC(=O)C(=O)NNc3ccccc3Cl)cn2)C[C@@H](C)O1	784780123	YZWDHPBBVFJLFN-CHWSQXEVSA-N	434.884	1.254	50	20	IDGD	
CC(=O)Nc1ccc(NC(=O)C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)cc1	785100942	BWMBLPPIYVXQIX-UHFFFAOYSA-N	431.399	1.897	50	20	IDGD	
CCOC(=O)c1cc(F)c(F)cc1NC(=O)C(=O)NNc1nccc(N(CC)CC)n1	785226109	PCXNUWVAHOHGAC-UHFFFAOYSA-N	436.419	1.860	50	20	IDGD	
COc1cccc(-n2c(CC(=O)NNC(=O)[C@H](C)O)csc2=NCc2ccco2)c1	786686963	IKQBYUDIMNBSHV-ZDUSSCGKSA-N	430.486	1.312	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(C)c(C(=O)NNc2nnc(-c3ccccn3)s2)c1	788562289	BEUZRJUNJWBQFF-UHFFFAOYSA-N	448.530	1.590	50	20	IDGD	
CN(NS(=O)(=O)c1cncc(Cl)c1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	788914790	GAFKWOJMMRCTLZ-UHFFFAOYSA-N	433.918	1.533	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2cccc3c2OCC[C@H]3N(C)C)c1	789731975	LYQQNHVLRTWZTG-LJQANCHMSA-N	440.500	1.854	50	20	IDGD	
CS(=O)(=O)CC[C@@H](C(=O)NNC(=O)c1nnc(O)c2ccccc12)c1ccccc1	789869297	SELDPZUOQLXFFZ-CQSZACIVSA-N	428.470	1.315	50	20	IDGD	
CCC[C@@H](CCCS(C)(=O)=O)C(=O)NNC(=O)c1sc(N2CCOCC2)nc1C	789871285	PBUBVZIRPWLOEL-AWEZNQCLSA-N	446.595	1.290	50	20	IDGD	
CC(=O)N1CCc2ccc(S(=O)(=O)NNC(=O)c3cccc4ncccc34)cc2CC1	790052142	DFSOQUZPLIFWPF-UHFFFAOYSA-N	438.509	1.805	50	20	IDGD	
O=C(NNS(=O)(=O)c1cnn(CC(F)F)c1)c1cc(F)ccc1Br	790052704	ICDMYBIOQWTYEC-UHFFFAOYSA-N	427.202	1.673	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCc2cccc(C)n2)c1	792236844	DEBUIRSEZBNLFA-UHFFFAOYSA-N	433.534	1.607	50	20	IDGD	
CN(CCC(=O)NNC(=O)c1csc(N2CCOCC2)n1)C(=O)OCc1ccccc1	792809177	LSRSSWPACBZKCF-UHFFFAOYSA-N	447.517	1.399	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(-n3ccc(C)n3)cc2)cc1OC	793022251	SDABTDMNPCTHIL-UHFFFAOYSA-N	437.456	1.988	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNS(=O)(=O)c2cccc([N+](=O)[O-])c2OC)cc1	794863687	CSWWFCQVMVZDNV-GFCCVEGCSA-N	439.446	1.779	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccc(F)c(N2CCOC2=O)c1	796990762	XDJXSIYMIVASBZ-UHFFFAOYSA-N	434.355	1.086	50	20	IDGD	
CN(C(=O)[C@@H]1CCN(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)C1)c1ccccc1	797606469	BVODXNGGFGGGKX-MRXNPFEDSA-N	434.460	1.002	50	20	IDGD	
CC1=C(C(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)SCCO1	798153749	CXWASYQTWAOBHZ-UHFFFAOYSA-N	447.538	1.921	50	20	IDGD	
CCOc1ccc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)c3cnnn3C)cc2)cc1	798824221	BYSRDMJUWCPYJI-UHFFFAOYSA-N	444.473	1.089	50	20	IDGD	
Cn1cc(Oc2ccccc2C(=O)N2CCN(S(=O)(=O)CBr)CC2)cn1	801183833	ZDPJUGHIORDKIT-UHFFFAOYSA-N	443.323	1.652	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)[C@H]2CC[C@@H](C(F)(F)F)NC2=O)cc1Cl	802074593	RYOUSZDZEWBIQZ-MADCSZMMSA-N	438.790	1.967	50	20	IDGD	
COc1ccc(C2=NO[C@H](CNC(=O)NNC(=O)COc3ccccc3[N+](=O)[O-])C2)cc1	802366986	GJMFKONIVGKBPM-HNNXBMFYSA-N	443.416	1.506	50	20	IDGD	
C[C@H](Cn1ccc2ccccc21)C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	803794218	AOAOYRTZIPSKSX-FOIQADDNSA-N	437.452	1.808	50	20	IDGD	
O=C(CN1CCC(NC(=O)NNc2ccc(-n3ccnc3)nn2)CC1)Nc1ccccc1	804899896	LCEABQOATBGWGN-UHFFFAOYSA-N	435.492	1.392	50	20	IDGD	
CC(=O)c1cc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)ccc1F	806997496	HUENNBBMGXVYPZ-UHFFFAOYSA-N	437.453	1.192	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(NC(=O)C(=O)NNc2ncnc3ccsc23)ccc1F	806997992	OAKBBODCPLLUDI-UHFFFAOYSA-N	438.466	1.163	50	20	IDGD	
O=C(NNC(=O)N1CCC[C@H](CNS(=O)(=O)C2CC2)C1)c1cnn(-c2ccccc2)c1	808271577	WJHZCHGMYMEAPP-OAHLLOKOSA-N	446.533	1.021	50	20	IDGD	
CCOC(=O)c1cccc(NC(=O)c2cccc(NC(=O)C(=O)NNC(=O)CC)c2)c1	810385536	SUJLBIPNJDFPOF-UHFFFAOYSA-N	426.429	1.612	50	20	IDGD	
Cc1ncc2n1CC[C@H](C(=O)NNC(=O)CN1CCN(Cc3ccc(Cl)cc3)CC1)C2	810594298	ZYZCOFJLBMDKPY-SFHVURJKSA-N	444.967	1.373	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)NCC(=O)NCCN1CCCCCC1	814325245	MVTDADDOVQTYHE-OAHLLOKOSA-N	439.944	1.430	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NN=C(C)c1c[nH]nc1C)N(S(C)(=O)=O)CC2	814758810	ILLYHYOYMATRCC-QGZVFWFLSA-N	449.533	1.525	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)C2(N3C(=O)c4ccccc4C3=O)CCCC2)c1	815439677	AWHSEVBHCWBBPY-UHFFFAOYSA-N	449.463	1.908	50	20	IDGD	
O=C(NNC(=O)c1cccnc1)C(=O)Nc1ccn(-c2ccc(Br)cc2)n1	815563827	PGPSIWJNSOQTMC-UHFFFAOYSA-N	429.234	1.430	50	20	IDGD	
CCNS(=O)(=O)c1ccc2c(c1)N(C(=O)C(=O)NNc1ccc(OCC)cc1)CC2	815815236	QODXUZOFCQEJFI-UHFFFAOYSA-N	432.502	1.416	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)NCc2ccc(C(=O)NNc3cnnn3C)cc2)cc1	816769516	LXCTZZPVXKFHBT-UHFFFAOYSA-N	428.474	1.253	50	20	IDGD	
O=C(COC(=O)CSc1ccccc1[N+](=O)[O-])NNC(=O)[C@@H]1COc2ccccc2O1	819006623	FKSUSKOAKXDYJB-HNNXBMFYSA-N	447.425	1.218	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)[C@@H]2CC(=O)N(C3CC3)C2)c2ccccc2c1=O	828973250	AYSRJHXEXLULGU-CQSZACIVSA-N	425.489	1.359	50	20	IDGD	
CC(=O)N1Cc2ccccc2C[C@@H]1C(=O)NNC(=O)COc1ccc(Br)cc1	871003127	AGRXYWFNDFOMGV-GOSISDBHSA-N	446.301	1.949	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc1C	916562284	OHFJSUYHUKUPKL-UHFFFAOYSA-N	444.513	1.488	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(N2C[C@@H](C(=O)NNC(=O)C(C)(C)C)CC2=O)cc1	917180329	RYJOMORXJJLAFS-AWEZNQCLSA-N	438.550	1.264	50	20	IDGD	
Cn1cc(CCC(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)cn1	917559397	ILISFJNYWBCKKU-UHFFFAOYSA-N	430.468	1.572	50	20	IDGD	
CC(=O)Nc1cccc2c1CCN(C(=O)NNC(=O)c1csc(N3CCOCC3)n1)C2	918002173	TYFUOYKATDZQBH-UHFFFAOYSA-N	444.517	1.351	50	20	IDGD	
COc1cc(C=NNC(=O)N[C@@H]2CCS(=O)(=O)C2)ccc1OC(=O)c1ccc(F)cc1	920381141	ORUCOFYFELTGCZ-MRXNPFEDSA-N	449.460	1.874	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(Br)cs2)c1	921301839	LNFSIAOEKWRHNP-UHFFFAOYSA-N	432.321	1.836	50	20	IDGD	
CC(=O)N1C[C@@H]2[C@@H](CCC[C@H]2NC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)C1	1117497565	UQTSMIKDQWALFV-IAOVAPTHSA-N	437.522	1.073	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)NCc2ccccc2NS(C)(=O)=O)c1C	1319048294	XJTAJOOSXCVQRS-OAHLLOKOSA-N	434.518	1.973	50	20	IDGD	
COC(=O)c1cc(C(=O)NNC(=O)c2cncn2-c2ccccc2)n(-c2ccccc2)n1	1321538850	HMXIJCFWYYDCGA-UHFFFAOYSA-N	430.424	1.919	50	20	IDGD	
CC(=O)Nc1c[nH]nc1[C@H]1CCCN(C(=O)NNC(=O)c2cc(Br)c[nH]2)C1	1337451586	KMVQPUJHTSEECF-JTQLQIEISA-N	438.286	1.693	50	20	IDGD	
Cc1c(C(=O)N2CCN(S(=O)(=O)CBr)CC2)cnn1-c1ccncc1	1337814305	MOZHQFFVIOTBHJ-UHFFFAOYSA-N	428.312	1.016	50	20	IDGD	
CCCS(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)c2n[nH]c3c2CCCC3)cc1	1342867213	ZVAJHOCHGQQQBU-UHFFFAOYSA-N	426.520	1.096	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(C(F)F)no2)C1	1777705259	YFZLEDTXPVHKHM-YRILPIOLSA-N	435.855	1.994	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnc4cc(C)ccn4c3=O)C2)C1	1777993838	CGLNWGADHWQVOT-HTAPYJJXSA-N	446.935	1.854	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)[C@@]3(F)CCCCC3(F)F)C2)C1	1778222689	JOXJQNFYWJGYKE-MOPGFXCFSA-N	448.486	1.107	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(C)(C(=O)N2CC[C@]3(CN(C(=O)[C@H](F)Cl)CCO3)C2)C1	1778315152	WBVCWGCBXQZYHH-DJJJIMSYSA-N	433.908	1.608	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4ncnn4c3)C2)C1	1778742038	NDVXDPWYQJPFRN-ZWKOTPCHSA-N	426.304	1.409	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1CC(c3ccccc3)=NN1)CCO2	1779299326	RIFNHLWADUDKFV-UGKGYDQZSA-N	444.608	1.434	50	20	IDGD	
CSc1ncccc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2	1779911028	LFWVUBZWBSXDBF-SPYBWZPUSA-N	427.954	1.531	50	20	IDGD	
C#CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](Cl)CC)C2)C1	1781223286	KSUIHAVLAIXWHF-VWKPWSFCSA-N	441.956	1.750	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)c3c(O)cc(O)cc3O)CCO2)C1	1781235452	ZNSSIVXUPRKDRL-MSOLQXFVSA-N	433.288	1.483	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccnn1)C2	1781901532	PLUYDGWFWNGBCF-DDUZABMNSA-N	425.327	1.778	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccnn1)C2	1781901534	PLUYDGWFWNGBCF-JCKWVBRZSA-N	425.327	1.778	50	20	IDGD	
C[C@H](O)C(=O)N1CCO[C@@]2(CCN(C(=O)/C(C#N)=C/c3ccc(Br)cc3)C2)C1	1782870549	SZWZYUKYUHRYIJ-CRSFEPEASA-N	448.317	1.567	50	20	IDGD	
O=C(CCN1CCCC1)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCBr)C2	1783317868	HURLOOXFFNYZDP-VQIMIIECSA-N	430.387	1.771	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](C)Nc1cnccn1)CCO2	1783349663	QOYYEZVSKUHDHC-SUNYJGFJSA-N	440.342	1.280	50	20	IDGD	
C=CCNC(=O)/C=C\C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]21	1783531145	DHOPURSMNLVQBZ-XXUDPWSFSA-N	432.348	1.061	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cccc3ncsc13)CCO2	1783935102	NUQYNCYUTQKHPW-OAQYLSRUSA-N	445.545	1.113	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc4ccnn34)C[C@@H]21	1783972295	KDRGBZIBIKVXKQ-OAOQPFQOSA-N	449.349	1.959	50	20	IDGD	
Cc1cnn([C@H](C)C(=O)N2CC[C@]3(CN(C(=O)[C@H](C)CBr)CCO3)C2)c1	1784442200	LWPVFNHNMCYATQ-IIDMSEBBSA-N	427.343	1.613	50	20	IDGD	
Cc1nn(C)c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)CBr)C[C@@H]32)c1F	1785776123	JBGITXDKHRFPTE-PYJNHQTQSA-N	445.333	1.492	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](N)c3ccccn3)[C@H]2C1	1786869655	CEKHEZOXHPDQHJ-CPJSGKAGSA-N	429.348	1.297	50	20	IDGD	
Cc1ccc(C(=O)C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]3C2)cc1	1789925572	RLEWZKGOIPRAAL-JKQORVJESA-N	441.297	1.848	50	20	IDGD	
Cc1n[nH]c(C)c1CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)CBr)C[C@@H]21	1789973073	ULZGUQZIUPKMFP-GQGQLFGLSA-N	441.370	1.580	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3c(C)noc3C)C[C@@H]21	1791252051	AALFAVFIROOSAZ-DKIMLUQUSA-N	427.929	1.458	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4cc(O)ccc4n3)C[C@@H]21	1791254878	WBNXAUHQRVBJPQ-VERUCKTNSA-N	447.919	1.788	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/c3ccsc3)C[C@@H]21	1791288844	XRQGKPSZQQYEMW-FLZDPOQHSA-N	434.562	1.114	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(Cl)cc3)C[C@@H]21	1791290642	GODFKOHEEAULLH-SZMVWBNQSA-N	436.940	1.306	50	20	IDGD	
COc1cccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)CBr)n1	1792868830	QZRIQEYFUKADQC-FLTUCWPJSA-N	440.338	1.253	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2)[C@H]1CCc2ccccc2[C@H]1O	1793036563	KHBAFIYRGKOCFI-QMPXSYISSA-N	427.328	1.676	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCl)c1ccc(Br)nc1F	1793110607	MIEDIOQCQKZCKB-WYFGTUCQSA-N	434.693	1.835	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1c(F)cccc1F)C2	1795114966	RSOWIUOHDYBBBS-KSPBDQMDSA-N	431.277	1.882	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](N)c1cccc(Cl)c1	1795630504	YMPBRQNZQJSSGT-KUHBDSFDSA-N	430.332	1.183	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)c1cc(=O)c2ccccc2o1	1796189766	XYGGYQWKMYTAPS-BCDXTJNWSA-N	446.268	1.038	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1c[nH]c2nccc-2c1	1796649415	HJIJGGIQOSEDJG-MZHJKJSWSA-N	447.499	1.900	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nccc3nc[nH]c13)C2	1799275523	VHJQMAIQTHPZEJ-ZSMOCIRGSA-N	426.304	1.397	50	20	IDGD	
COc1cc2c(O)cccc2cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2	1800012535	FTCGAUNVYGEEDD-ZZXMYQEDSA-N	448.903	1.357	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(C(F)F)no1)C2	1800639683	MCHGCFBUDAYESJ-BSTOTGJRSA-N	436.253	1.989	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1cc(F)ccn1)C2	1800757529	PRZVYDACSGFIRM-JRATXPSKSA-N	428.302	1.526	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1n[nH]c3ccc(F)cc13)C2	1800758966	AMMDQFIJHBQEHF-ZVXAKGHKSA-N	439.285	1.689	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1onc2ccccc12	1801003428	DNYPHSMEWOWQAW-BTTYYORXSA-N	434.456	1.392	50	20	IDGD	
Cc1ccc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCC(=O)NN(C)C)cc1F	1801010626	NCZZBNSHVRVADO-FEJSZKPUSA-N	448.539	1.029	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCc1ccc(O)nn1	1801236467	BRUQCZBUCPGQTP-LXTVHRRPSA-N	425.327	1.927	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)nc3ccccc13)C2	1802336140	HNBLWKHHIGBNLQ-MUJYYYPQSA-N	439.516	1.565	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@H]1CCN(C(=O)c2cc(O)n[nH]2)[C@H]1c1cccnc1	1803010082	ZLPKFVRQBHUORV-KFNAQCHYSA-N	436.310	1.861	50	20	IDGD	
Cn1nc2c(c1C(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]1c1cccnc1)CCC2	1803146644	CBGZCBOVUAITDH-ZTFGCOKTSA-N	431.924	1.223	50	20	IDGD	
O=C(C[C@@H]1CCCCO1)N1CCCC2(CCN(C(=O)c3cccc(B(O)O)c3)CC2)C1	1806591796	GYBOVOFGDKEHAD-FQEVSTJZSA-N	428.338	1.170	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC2(CCCN(C(=O)c3ncc(Cl)cn3)C2)CC1	1807899867	NEOUOQAMCVJEBT-UHFFFAOYSA-N	436.944	1.348	50	20	IDGD	
C[C@H](C(=O)NC[C@@H]1CCN(C(=O)[C@H](F)Cl)[C@@H]1c1cccnc1)[C@H]1SC(=N)NC1=O	1808403496	WTYUBBAPJUEKLR-RORMEEMCSA-N	441.916	1.424	50	20	IDGD	
Cc1ncsc1C(=O)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1	1809967665	BZUMRXGPTRZPHP-UHFFFAOYSA-N	427.335	1.290	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H](CNC(=O)c2nccnc2C(N)=O)[C@H]1c1cccnc1	1811183607	UYVKBJWZNNSXTP-RHSMWYFYSA-N	444.923	1.555	50	20	IDGD	
CC(=O)N[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)CBr)[C@@H]1c1cccnc1	1812645911	NOYGEKNUKJIZOD-UWWPHRKUSA-N	439.354	1.643	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)Cc2c(C)nn(C)c2C)[C@@H]1c1cccnc1	1813033125	IQFXJKBNVFDRKF-HFSMHLIXSA-N	447.967	1.934	50	20	IDGD	
O=C(O)CSCC(=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@H]1c1cccnc1	1813086215	LFFHCVMXCUXBPE-TUKIKUTGSA-N	448.314	1.596	50	20	IDGD	
O=C1CC[C@H](C(=O)Nc2cc([C@H]3CCCCN3C(=O)[C@@H](F)Br)[nH]n2)CN1	1814524131	BSSJRMIVRFSIAU-DRCTWCGVSA-N	430.278	1.619	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccnc2C(N)=O)n[nH]1	1816077002	APTSUHNRXZKJMT-JSGCOSHPSA-N	434.884	1.463	50	20	IDGD	
CC(=O)OC[C@H](OC(C)=O)C(=O)N[C@H]1CCc2nc(NC(=O)[C@H](F)Cl)sc2C1	1817125366	MSAGNNDXGDJZPG-GAFUQQFSSA-N	435.861	1.084	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](C)CBr)CC2	1817292625	LXHUUAKATMEBPQ-CKYFFXLPSA-N	445.383	1.953	50	20	IDGD	
CC(C)N[C@@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1)C(C)C	1817456589	UUTAHGVGDNAJIO-LAUBAEHRSA-N	449.600	1.797	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)C(F)(F)Cl)[nH]n1)c1cccc(B(O)O)c1	1817479806	RTUJXYOKHRGICO-ZDUSSCGKSA-N	426.616	1.227	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](O)CCl)CC2)c1n[nH]c2c(F)cccc12	1819228053	OIHGMZOINGMRLL-QPUJVOFHSA-N	437.884	1.984	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)CCN2CCOCC2)[nH]n1)[C@H](F)Br	1820932050	CGYYOQRYUUTIGV-CJNGLKHVSA-N	446.321	1.815	50	20	IDGD	
O=C1NCCn2nc(C(=O)N3CCCC[C@H]3c3cc(NC(=O)C(Cl)Cl)n[nH]3)cc21	1822418320	NFFMYPULVRIXEZ-NSHDSACASA-N	440.291	1.459	50	20	IDGD	
O=C(CNC(=O)C(F)(F)F)Nc1cc([C@@H]2CCCCN2C(=O)C(Cl)Cl)[nH]n1	1822444257	OKEYHAYLBCGECR-QMMMGPOBSA-N	430.214	1.884	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(O)c(F)c3)sc2C1	1823317896	VOHZKRWFGCHGAP-GFCCVEGCSA-N	449.508	1.587	50	20	IDGD	
Cc1cn(CC(=O)Nc2cc([C@H]3CCCCN3C(=O)C(Cl)Cl)[nH]n2)c(=O)nc1O	1823369648	CICLOWZPIYNXFS-LLVKDONJSA-N	443.291	1.476	50	20	IDGD	
CC(=O)N/C(C)=C/C(=O)N[C@H]1CCc2nc(NC(=O)[C@H](C)Br)sc2C1	1825647899	XUAQBUSZLUXBMQ-RDGXFMKGSA-N	429.340	1.878	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc3n(n1)CCCO3)CC2	1826000394	SMKBXQUODFWKFV-MNOVXSKESA-N	439.925	1.602	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)Cc1cscn1)CC2	1826085485	WLXGLHUVLMFGAT-LLVKDONJSA-N	436.563	1.127	50	20	IDGD	
COc1ccccc1C(=O)N[C@@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1	1826088601	GZNGCQSWOBNFEB-CYBMUJFWSA-N	445.545	1.751	50	20	IDGD	
C[C@H](Cc1ccco1)C(=O)N[C@@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1	1826091773	BTOBWVZCJOGSSQ-ZIAGYGMSSA-N	447.561	1.900	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)Cc2ccncc2)CC1	1830175938	OEVHOMRGJLRNEZ-FQEVSTJZSA-N	429.565	1.617	50	20	IDGD	
Cc1cc(C)n(CCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)n1	1830369897	DPQQULZYDASXMV-OAQYLSRUSA-N	440.972	1.611	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccnc(OC)c3)C2)C1	1831652073	WAEJAFAIHLZFSV-OXJNMPFZSA-N	425.913	1.568	50	20	IDGD	
C#CCO[C@H](C)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](Br)CC)CC2)CC1	1833469326	QOVUJZHRVNBGCW-QAPCUYQASA-N	442.398	1.770	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3ccn(C)n3)CC2)CC1	1834218622	BLFWMHCFNGNTDD-INIZCTEOSA-N	440.386	1.779	50	20	IDGD	
O=C(CCBr)NC1CCN(C2CCN(C(=O)Cc3ccncc3)CC2)CC1	1834423366	QOZSASRNZYXBEI-UHFFFAOYSA-N	437.382	1.981	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)[C@H]3C[C@@H]3F)CC2)CC1	1835117818	NBZLWHZHNJWFNM-SWERZJPOSA-N	446.527	1.050	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)CC3CC3)CC2)CC1	1835118378	VRVXHQAFRDTEMZ-WGOQTCKBSA-N	442.564	1.492	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccc(F)c(F)c3)CCO2)C1	1835144387	USPRBOLRFGWSPH-MGPUTAFESA-N	446.878	1.218	50	20	IDGD	
O=C(CCC(F)(F)F)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1835325026	BLRQXTXFLGQNCM-DGCLKSJQSA-N	435.212	1.476	50	20	IDGD	
CCn1ccc(C(=O)N2CCC(N3CCC(NC(=O)CO[Si](C)(C)C)CC3)CC2)n1	1835833505	KWVZGTLBCQFCBO-UHFFFAOYSA-N	435.645	1.940	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(F)c(C)c3N)CCO2)C1	1835875526	YZDJMNKOQBUCLB-YWZLYKJASA-N	443.903	1.040	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4nonc4c3)C2)C1	1837712966	BNFBFRUCFMTXQS-HXUWFJFHSA-N	448.552	1.144	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(Cl)ccn3)C2)C1	1840033965	VTFCBDMURNTCFE-SJKOYZFVSA-N	446.729	1.588	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(O)ccc3F)C2)C1	1840034806	XSTCCSRBMZQQTD-KZULUSFZSA-N	445.285	1.385	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3c(C)c[nH]c3C)C2)C1	1840150756	RDPVJVZCDAOKLA-NQIIRXRSSA-N	441.956	1.274	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3ccc(C)s3)C2)C1	1840151303	YCUHOJITBCOXLB-YLJYHZDGSA-N	444.981	1.699	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(Cl)cc3)C2)C1	1840153778	ASKBRPHBZJOYDP-LPHOPBHVSA-N	431.316	1.664	50	20	IDGD	
O=C(c1ccc(O)c([N+](=O)[O-])c1)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840189356	MWEYURXYAUZNHE-QGZVFWFLSA-N	448.259	1.174	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)cc1	1840190046	AMYUYDGOHCPVKY-LJQANCHMSA-N	444.315	1.519	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H]3CCCN3C(C)C)CCO2)C1	1840581496	DFIONFCQQGEHID-LVCYWYKZSA-N	429.989	1.723	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(OC)ccc3F)CCO2)C1	1840686680	ZOJJNBQUXLRTNP-OXJNMPFZSA-N	428.888	1.922	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2ccc(F)nc2F)C1	1840976811	QREQLDFHXSGYHX-BRJLIKDPSA-N	430.415	1.311	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC12CN(C(=O)/C=C/C(=O)NCc1ccco1)C2	1841287982	REEZONCYPVFRJU-GJBLVYBDSA-N	438.322	1.686	50	20	IDGD	
O=C(c1cc(=O)c(OCc2ccccc2)c[nH]1)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1	1841349987	AYNDXTZXCDCKNG-GOSISDBHSA-N	445.903	1.371	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(C(=O)N2CC3(CCCN3C(=O)CO[Si](C)(C)C)C2)C1	1844378133	JMSOXDWCTNLMEG-UHFFFAOYSA-N	425.602	1.908	50	20	IDGD	
CN(CC(=O)N1CCCC12CN(C(=O)c1ccncc1)C2)NC(=O)NCc1ccccc1	1845038615	ZMSASLZJVWEKQK-UHFFFAOYSA-N	436.516	1.245	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl)C(C)(C)C	1847559745	KMVFVAFQVSXAKQ-ZQDZILKHSA-N	431.961	1.727	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)N1CCN(S(=O)(=O)c2ccc3c(c2)CCC3)CC1	9797042	APDAVDYOTPIGMF-UHFFFAOYSA-N	442.541	1.845	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2nc(C)n(-c3ccc(F)cc3)n2)c2ccccc2c1=O	17190679	NRRWJFHRRIZFLD-UHFFFAOYSA-N	435.419	1.519	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)Cn2c(=O)cnc3ccccc32)c2ccccc2c1=O	17196546	IYEILTOXAGGGLE-UHFFFAOYSA-N	432.440	1.149	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1	21023923	MEYCLWJXIMBOHS-UHFFFAOYSA-N	425.894	1.739	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CN2C(=O)NC3(CCCC3)C2=O)ccc1OCCC(C)C	24299453	FYXYALFAWKDWHU-UHFFFAOYSA-N	446.504	1.746	50	20	IDGD	
CC(=O)Nc1ccc(NS(C)(=O)=O)c(C(=O)NNC(=O)COc2cc(C)ccc2C)c1	110942188	BEBSSZQQGINOFQ-UHFFFAOYSA-N	448.501	1.473	50	20	IDGD	
COCCC(=O)NNC(=O)Cc1csc(=NCc2ccco2)n1-c1cccc(OC)c1	727098544	CNJSFRCREQQRKT-UHFFFAOYSA-N	444.513	1.968	50	20	IDGD	
O=C(NNC(=O)N1CCO[C@@H](c2ccc(F)c(F)c2)C1)c1ccc(-n2cnnn2)cc1	727473699	PZVWTIDXCIYPOA-QGZVFWFLSA-N	429.387	1.368	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NCCCc2nc(C)no2)c2ccccc2c1=O	727604101	OMVPOAHULGPCLV-UHFFFAOYSA-N	427.465	1.465	50	20	IDGD	
O=C(NNc1nc(-c2cccnc2)no1)c1ccc(S(=O)(=O)NCc2ccco2)cc1	728078564	KRRFHOJLWGWTSQ-UHFFFAOYSA-N	440.441	1.960	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cccc(OC(F)F)c2)cc(Cl)c1OCC(N)=O	728487140	UMIHPPUSJFOABA-UHFFFAOYSA-N	443.790	1.889	50	20	IDGD	
C[C@@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(C(=O)NNC(=O)Cc3cccnc3)cc2)C1	728852158	PLMHBWQNUZGJHI-HZPDHXFCSA-N	430.530	1.752	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)CCc1c(C)nc2[nH]n(C)c(=O)c2c1C	729516376	OVTFQMGEAHWJGS-UHFFFAOYSA-N	426.477	1.079	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ncccc2Cl)c1C(F)(F)F)C(=O)N1CCCC1	730541322	VBIJRAULYAPYJZ-UHFFFAOYSA-N	430.774	1.323	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H](c2ccccc2)N2CCCCC2=O)c1	731223574	HCVDDLPTMZGUHL-LJQANCHMSA-N	429.498	1.605	50	20	IDGD	
Cc1c(C(=O)OCC(=O)NNC(=O)c2cccs2)nnn1-c1cccc2ncccc12	731382184	SQSOZOVPOXXFDT-UHFFFAOYSA-N	436.453	1.803	50	20	IDGD	
CC1CCC(NS(=O)(=O)CC(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)CC1	731732581	JETFMRJUZAAIFN-UHFFFAOYSA-N	445.925	1.142	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)N1CCN([C@@H](C)c2nc(-c3ccccc3)no2)CC1	731848303	HTQXZNHDPUUAOD-SJORKVTESA-N	428.537	1.997	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)N[C@H]1CCN(c2ccccc2Cl)C1=O	732469498	GUUACPBXRTXTPX-ZDUSSCGKSA-N	447.835	1.763	50	20	IDGD	
COCCOCC(=O)NC1CCC(C(=O)NNc2ccc(Br)nc2)CC1	732837121	VREXYBJDVXHDLZ-UHFFFAOYSA-N	429.315	1.625	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)N[C@H]2CCN(c3ccccc3F)C2=O)cc1C	732892953	KEHZLGCPBSBPPJ-INIZCTEOSA-N	427.436	1.517	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)[C@H]1CCCN1S(=O)(=O)c1cccc([N+](=O)[O-])c1	732937714	PJILCDMQTAPBIV-MRXNPFEDSA-N	448.457	1.218	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)NCCS(=O)(=O)C(C)(C)C)N(C)c2ccccc21	733181955	VWSWLGYQFUSWPF-UHFFFAOYSA-N	432.546	1.987	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)[C@@H](C)C(C)C)N(S(C)(=O)=O)CC2	733358163	PIQPGMXUTGUOQO-XJKSGUPXSA-N	441.550	1.392	50	20	IDGD	
O=C(NNC(=O)[C@@H]1C[C@@H](O)CN1C(=O)OCc1ccccc1)c1cnn(-c2ccccc2)c1	733364008	DTKLIMWPBHGTAC-UXHICEINSA-N	449.467	1.405	50	20	IDGD	
N#Cc1ccc(N2C(=O)N[C@H](CCC(=O)NNc3nc(-c4ccccc4)no3)C2=O)cc1	733775749	QELZYCMWOIPLDB-MRXNPFEDSA-N	431.412	1.957	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)[C@H]2CCCN(C(=O)C3CC3)C2)CC1	734825903	QMIBIGDKSBHLNR-HNNXBMFYSA-N	437.541	1.365	50	20	IDGD	
O=P(CCN[C@H]1CS(=O)(=O)C[C@H]1N1CCOCC1)(c1ccccc1)c1ccccc1	734837396	IAYRBGNQVWXUFM-FCHUYYIVSA-N	448.525	1.088	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NNc2cc(C)nc(C)n2)o1	736716187	GXRWFUPOKHDXOE-ZDUSSCGKSA-N	437.478	1.160	50	20	IDGD	
COc1ccc(CN2CCN(C(=O)NNC(=O)COCc3ccccc3)CC2)cc1F	738496844	AGYKTGYNAUMEEG-UHFFFAOYSA-N	430.480	1.910	50	20	IDGD	
O=C(Cc1ccn(-c2ccc(F)cc2)n1)NNC(=O)c1csc(N2CCOCC2)n1	742036948	RIUVWANPPUWAHD-UHFFFAOYSA-N	430.465	1.308	50	20	IDGD	
N#Cc1ccc(CS(=O)(=O)CC(=O)NNC(=O)c2cccc(Br)c2)cc1	742770495	VIBGQMDVFXGWDS-UHFFFAOYSA-N	436.287	1.697	50	20	IDGD	
CC(C)[C@H](NS(=O)(=O)c1ccc2ccccc2c1)C(=O)NNc1ncnc2[nH]cnc12	743473012	IRMQXIHTHNHREM-INIZCTEOSA-N	439.501	1.952	50	20	IDGD	
O=C(NN=Cc1cnc2ccccc2n1)c1cccc(S(=O)(=O)N2CCOCC2)c1	744563019	HMBCWDNOHZVKGU-UHFFFAOYSA-N	425.470	1.415	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)[C@H]2CCCN(C(=O)Cc3ccccc3)C2)cc1	744701003	MZAGFOUZJXEQAQ-FQEVSTJZSA-N	448.479	1.344	50	20	IDGD	
O=C(COC(=O)c1nnn(C2CC2)c1C(F)(F)F)NNC(=O)c1ccc([N+](=O)[O-])cc1	745776182	OEYVEQIROBLNMR-UHFFFAOYSA-N	442.310	1.158	50	20	IDGD	
C[C@H](CC(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)C(=O)c1cccc(F)c1	746088168	QVYKLRQOOPSWSF-GFCCVEGCSA-N	431.376	1.947	50	20	IDGD	
Cc1cccc(N2CCN(CCC(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)CC2)c1	746096447	FRDLBNBGGLZJAF-UHFFFAOYSA-N	448.527	1.215	50	20	IDGD	
Cc1nc2nc(C(F)(F)F)nn2c(C)c1CCC(=O)N([C@H]1CCS(=O)(=O)C1)N(C)C	746202694	LVFVERUCPWQODL-LBPRGKRZSA-N	448.471	1.185	50	20	IDGD	
Cn1c(NNC(=O)CC[S@@](=O)c2ccc3c(c2)OCCO3)nc2ccccc2c1=O	746257551	AJZNKPBGVGRJFT-SSEXGKCCSA-N	428.470	1.346	50	20	IDGD	
CC(C)Oc1cc(Br)cc(C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)c1	746594266	MGNOKRCHWPNVPN-LBPRGKRZSA-N	434.312	1.367	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)c2ccc([C@@]3(C)NC(=O)NC3=O)cc2)cc1OC	748015217	QKPPDRAOJRTCKE-OAQYLSRUSA-N	426.429	1.223	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)c1ccc(S(=O)(=O)CCCC#N)cc1	748343481	HMOKPPUBKVDTNG-UHFFFAOYSA-N	430.486	1.646	50	20	IDGD	
CC(=O)c1cccc(NC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)c1	748822526	QYZFWLNGWSYFPY-UHFFFAOYSA-N	432.506	1.369	50	20	IDGD	
CC[S@](=O)[C@H]1CCC[C@H](NC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)C1	750267725	OKJMEEOENGYRAN-WXWKEVLISA-N	443.595	1.312	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2csc(Cc3ccc(N)cc3)n2)n1	751945504	QLZOLKSTNLXAMV-UHFFFAOYSA-N	445.526	1.628	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2C[C@H](CNC(=O)OC(C)(C)C)C[C@@H]2C)n1	752069510	PHTBOACFSQSSGJ-KBPBESRZSA-N	425.555	1.377	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)NC[C@H]1CCCN1S(C)(=O)=O	753005748	YFQREEHBOAKBCU-CQSZACIVSA-N	437.547	1.487	50	20	IDGD	
O=C1N[C@H](C(=O)NNc2ccc(C(F)(F)F)nn2)CS[C@H]1Cc1ccccc1F	755183555	YJRBGKNXVDMFEL-RYUDHWBXSA-N	429.399	1.921	50	20	IDGD	
O=C(CSc1nnc(O)nc1O)NN=Cc1cn(-c2ccc(Cl)cc2Cl)nn1	755618377	LCJWDGAOAQJWHM-UHFFFAOYSA-N	441.260	1.413	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)Nc1ccccc1C(=O)N1CCOCC1	755623536	PZLDVLAZMYYIOH-UHFFFAOYSA-N	426.473	1.953	50	20	IDGD	
O=C1CN(S(=O)(=O)c2ccc(C(=O)NNc3nc(C(F)(F)F)cs3)cc2)CCN1	755859866	NUCGACLEHLSARS-UHFFFAOYSA-N	449.436	1.039	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)Nc2ccc(N3CCNC(=O)C3)c(Cl)c2)c1O	755938672	WZWHMCSJPHRAQQ-UHFFFAOYSA-N	433.852	1.457	50	20	IDGD	
COc1cc(CN2CC[C@H](NC(=O)NNC(=O)Cc3ccccc3F)C2)cc(OC)c1	756095167	MYMLHKPERSLOHD-KRWDZBQOSA-N	430.480	1.990	50	20	IDGD	
COc1ccc(C(=O)N2CCCC2)cc1NC(=O)NNC(=O)c1cncc(NC(C)=O)c1	756258315	RCMISUWNOLYOPZ-UHFFFAOYSA-N	440.460	1.751	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)Nc3cccc(C(=O)NCCC(N)=O)c3)cc2C1	756393946	ULUSTSUTAMNPMB-LBPRGKRZSA-N	443.529	1.945	50	20	IDGD	
COCCS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2c(C)nc3ccccn23)cc1	756552096	LQTOFGXGDFXZPR-UHFFFAOYSA-N	431.474	1.529	50	20	IDGD	
COC(=O)c1ccc(NC(=O)NNC(=O)c2cncc(NC(C)=O)c2)cc1C(=O)OC	756816855	BQKGEVXCTIRQSQ-UHFFFAOYSA-N	429.389	1.080	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)C2(CNC(=O)OC(C)(C)C)CCCC2)c2ccccc2c1=O	756900028	SNLVALGKBFCBPZ-UHFFFAOYSA-N	443.504	1.780	50	20	IDGD	
Cc1cnn(-c2ccc(S(=O)(=O)NNC(=O)CNC(=O)c3cccs3)cc2F)c1	757655371	SDUMWSHPPHDYHP-UHFFFAOYSA-N	437.478	1.121	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2cn(C)nc2-c2ccccc2)c1	757890931	DHQGMNNYXKSKQT-UHFFFAOYSA-N	442.501	1.804	50	20	IDGD	
CC[C@H](CN1CCCC1)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(CC)CC)c1	758844423	HYVOZSVRLFROAP-QGZVFWFLSA-N	439.582	1.536	50	20	IDGD	
Cc1cc(-c2noc([C@H](C)NC(=O)NNC(=O)CNC(=O)c3ccco3)n2)ccc1F	760748284	CGISABPFLRMMJR-NSHDSACASA-N	430.396	1.599	50	20	IDGD	
Cc1c(Cl)cc(C(=O)O)cc1S(=O)(=O)NNC(=O)CCCNC(=O)OC(C)(C)C	763439091	ILALYKLPEORMSQ-UHFFFAOYSA-N	449.913	1.961	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)sc2c1CCC2	763471089	RRFLOBAZURETAD-UHFFFAOYSA-N	446.441	1.721	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)C(=O)Nc1cccc2cccnc12	763532365	XJYYOVDPKDWDSU-UHFFFAOYSA-N	446.511	1.533	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)sc2c1CCC2	763557853	FZPZBQUMBDXTTG-UHFFFAOYSA-N	445.453	1.542	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2cccn(CC(F)(F)F)c2=O)c1	763649096	XHZQISWZGZVWRN-UHFFFAOYSA-N	440.378	1.192	50	20	IDGD	
Cc1ccc(-n2nc(NC(=O)C(=O)NNC(=O)COc3ccccc3F)cc2C)cc1	763683347	YUJTWIBLBZVMTG-UHFFFAOYSA-N	425.420	1.793	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccc(NC(=O)[C@H](C)OC)c1	763710868	CUJUSKUBJUWSNS-AWEZNQCLSA-N	442.472	1.387	50	20	IDGD	
COCCOc1cc(C)ccc1NC(=O)C(=O)NNC(=O)c1cc(OC)cc(OC)c1	763775837	VSARLIRWFSCUIB-UHFFFAOYSA-N	431.445	1.437	50	20	IDGD	
Cc1cnn(-c2ccc(NC(=O)C(=O)NNC(=O)COc3ccccc3C#N)cc2F)c1	763815001	ZEVSTFARKPMTHW-UHFFFAOYSA-N	436.403	1.356	50	20	IDGD	
Cc1cnc(O)n1-c1ccccc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccc(F)cc1	763873046	PXNREPPTJXRQGE-CYBMUJFWSA-N	441.419	1.579	50	20	IDGD	
COC(=O)c1cc(Cl)ccc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccc(F)cc1	763873209	SIKJJJNQYIQHHK-SNVBAGLBSA-N	437.811	1.819	50	20	IDGD	
O=C(CCSc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccn(CC(F)(F)F)n1	763895134	LCBYEEVHEQPISI-UHFFFAOYSA-N	433.387	1.853	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)ccc1Br	763916162	AAJULBYOZZVECC-UHFFFAOYSA-N	444.249	1.133	50	20	IDGD	
COC(=O)CSCc1cccc(NC(=O)C(=O)NNC(=O)Cc2ccc(F)cc2)c1	763921749	VVGDXIOOKGNDCM-UHFFFAOYSA-N	433.461	1.561	50	20	IDGD	
CNS(=O)(=O)c1ccc(C)c(NC(=O)C(=O)NNC(=O)c2cccc3ccccc23)c1	764047802	HMAMLWVVVKMTAT-UHFFFAOYSA-N	440.481	1.456	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)CC)cc1S(=O)(=O)N1CCCC1	764084668	VPMJLSLWNCLVDS-ZDUSSCGKSA-N	440.522	1.002	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)c2cc(C)[nH]n2)sc2c1CCCCC2	764098336	LUKAFVVEKXFRJX-UHFFFAOYSA-N	433.490	1.625	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccoc2)c(OCC(F)(F)F)c1	764159559	YLECJYJHNOHJIF-UHFFFAOYSA-N	429.307	1.407	50	20	IDGD	
CS(=O)(=O)CCc1ccc(NC(=O)C(=O)NNC(=O)CCCc2ccccc2)cc1	764227652	PKTMOLCAJYGXKY-UHFFFAOYSA-N	431.514	1.383	50	20	IDGD	
COCc1c(Br)cccc1NC(=O)C(=O)NNC(=O)c1scnc1C	764245758	UPZIPJZQXOVFCM-UHFFFAOYSA-N	427.280	1.760	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)c1nc(-c2ccccc2)n2c1CCCCC2	764345167	OODXNVZAMJAYKO-UHFFFAOYSA-N	432.484	1.863	50	20	IDGD	
Cc1cn(-c2ccccc2)nc1NC(=O)C(=O)NNC(=O)C(F)(F)Oc1ccccc1	764379185	RYUJXBCMXKNEBL-UHFFFAOYSA-N	429.383	1.938	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1	764398565	UFJPYMOVGSRKFQ-AWEZNQCLSA-N	426.429	1.488	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)[C@@H](C)NS(=O)(=O)c1cccc(C#N)c1	764636427	STPPQVBGIASVIA-LLVKDONJSA-N	436.877	1.348	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc2c3c(c1)CC(=O)N3CCC2)c1nnc(-c2ccccc2)o1	764933923	BYDGVNHMVNOXAL-UHFFFAOYSA-N	439.453	1.195	50	20	IDGD	
C[C@@H](CC(=O)NNC(=O)CNC(=O)c1ccco1)C1CCN(C(=O)OC(C)(C)C)CC1	765384531	YZBRPPGERSPFRE-AWEZNQCLSA-N	436.509	1.830	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)cc(OC)c1OC	766258672	INFVGQZIEHAGFS-UHFFFAOYSA-N	446.416	1.637	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@@H]3CCCN3C(=O)C(C)(C)C)CC2)cc1	766648890	LPJITTLPBJXEFY-FQEVSTJZSA-N	443.592	1.297	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)c1ccc(C)c(NS(C)(=O)=O)c1	767267294	DEXWZYXSQMPERY-UHFFFAOYSA-N	433.486	1.222	50	20	IDGD	
CCn1c(=O)oc2cc(S(=O)(=O)NNC(=O)c3cnn(-c4ccccc4)c3)ccc21	767458187	BCWYNUOHACRCSC-UHFFFAOYSA-N	427.442	1.423	50	20	IDGD	
CCc1ccc(S(=O)(=O)N2CCN(S(=O)(=O)CBr)CC2)cc1CC	767852392	YPLLZULYEAZLTK-UHFFFAOYSA-N	439.397	1.800	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)/C(=C\c1ccccc1)n1nnnc1C	768631093	ZKQNPQSBMNKLDB-NTCAYCPXSA-N	428.474	1.535	50	20	IDGD	
Cn1cc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c(-c2cccs2)n1	768675680	RXYYMSFYXIPALK-HNNXBMFYSA-N	442.453	1.293	50	20	IDGD	
CNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2ccc(Br)cc2Cl)cn1	770233503	OIBLBZYDKNPLFD-UHFFFAOYSA-N	447.698	1.480	50	20	IDGD	
C[C@H](CCN1CCN(C)CC1)NC(=O)NNC(=O)c1ccc(COc2ccccc2)o1	770306523	BIEGZQSLRCRERW-QGZVFWFLSA-N	429.521	1.829	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)[C@@H]1CC(=O)N(c2c(F)cccc2F)C1	770904536	VARRLEZJQNJJPL-GFCCVEGCSA-N	440.447	1.770	50	20	IDGD	
CCCN(CCC)S(=O)(=O)c1ccc(C(=O)NNc2nc(O)c3cnn(C)c3n2)cc1	770971103	HBHDWJQBJMWFHV-UHFFFAOYSA-N	447.521	1.637	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)c3cnn(-c4ccc(F)cc4)c3-n3cccc3)nc21	770974004	QYCCYPZYXICRGR-UHFFFAOYSA-N	433.407	1.941	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)NCC(C)(C)CO)cc1	771788917	KKFTVTMNQJCSPP-YBEGLDIGSA-N	425.489	1.476	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)NCCN(C)S(=O)(=O)c2cccs2)cc1	772015402	ITYUUBXWFAYXFI-UHFFFAOYSA-N	440.547	1.340	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)C[C@H](O)c2ccc(Cl)cc2)c1	772557174	DIJWXZQAXMYAIZ-INIZCTEOSA-N	425.894	1.475	50	20	IDGD	
CNS(=O)(=O)c1ccc(C)c(C(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)c1	772966897	LKGCXFDFQARXIV-LBPRGKRZSA-N	425.894	1.785	50	20	IDGD	
CCOC(=O)N1CCC[C@H](C(=O)NNC(=O)[C@H]2CCCN(C(=O)OC(C)(C)C)C2)C1	773413076	ZTDADIACLFSAAR-GJZGRUSLSA-N	426.514	1.649	50	20	IDGD	
CCOC(=O)NNC(=O)C(=O)Nc1ccc(OCCN2C(=O)c3ccccc3C2=O)cc1	773497091	PWTRRCFKZBWYIK-UHFFFAOYSA-N	440.412	1.077	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2ccccc2C(=O)N2C[C@@H](C)C[C@@H](C)C2)n1	773726861	SIFUMDDYBDLNLX-OKILXGFUSA-N	426.477	1.685	50	20	IDGD	
O=C1C[C@H](Cc2ccc(NC(=O)C(=O)NNc3cccc(C(F)(F)F)c3)cc2)C(=O)N1	773763368	UPYCWJJOEGKJCS-LBPRGKRZSA-N	434.374	1.992	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)NCc2cn(C)nc2C)cc1	773888916	XMJMNWHQRPSAAI-LICLKQGHSA-N	447.499	1.699	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(C(C)C)nn2-c2ncccn2)cc1F	773889953	OZFPZDCVAGKDSE-UHFFFAOYSA-N	425.424	1.633	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)N[C@@H]2CCO[C@]3(CCS(=O)(=O)C3)C2)c1C	776075520	BEHRVZVRPYOXLS-JXXFODFXSA-N	439.534	1.137	50	20	IDGD	
CN(NC(=O)c1cnn(C)c1Br)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776202006	ORHLQTMSPUBRJC-UHFFFAOYSA-N	445.318	1.432	50	20	IDGD	
CN(C(=O)OC(C)(C)C)[C@H](C(=O)NNC(=O)[C@H]1COc2ccccc2O1)c1cnn(C)c1	776318254	RXBZFTOAHZGHID-SJORKVTESA-N	445.476	1.316	50	20	IDGD	
COCCO[C@H]1COCC[C@H]1NC(=O)NNC(=O)COc1ccccc1-c1ccccc1	777277772	DCFCDBQMPVFGSV-CTNGQTDRSA-N	443.500	1.883	50	20	IDGD	
O=C(NNc1ncnc2ccsc12)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(F)cc1	780927119	QZDQPUIBSFVEPB-RISCZKNCSA-N	437.478	1.098	50	20	IDGD	
O=C(CSc1nnc(O)nc1O)NN=C1CCC[C@@H]2CN(Cc3ccccc3)C[C@@H]12	781123789	JMZCQSRPRPLMQH-HUUCEWRRSA-N	428.518	1.779	50	20	IDGD	
COc1ccc(CN(CC(=O)NNC(=O)c2ccc(C)cc2)[C@@H]2CCS(=O)(=O)C2)cc1	781348345	HEFSOCIVRWPYRJ-LJQANCHMSA-N	445.541	1.454	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)Nc2ccccc2CN2CCN(C(C)=O)CC2)c1O	782077744	FDGUYRXPQQJLOD-UHFFFAOYSA-N	441.488	1.531	50	20	IDGD	
COc1nc(N2CCN(S(=O)(=O)CBr)CC2)ncc1Br	782466861	CEISWNKBXVSCQT-UHFFFAOYSA-N	430.122	1.052	50	20	IDGD	
COC(=O)[C@H](Cc1ccc(F)cc1)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	783571034	IZKHWAAIRAYOLP-IBGZPJMESA-N	449.504	1.629	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNc2ccc(OC(F)F)cc2)cc1C(=O)OC	784310185	YEVVLKVIVKWPDI-UHFFFAOYSA-N	437.355	1.943	50	20	IDGD	
O=C(NNc1ccc(Br)cn1)C(=O)Nc1cc(C2CC2)nn1-c1ncccn1	784340313	OXXJDTMNINFISE-UHFFFAOYSA-N	443.265	1.779	50	20	IDGD	
COc1cccc(NNC(=O)C(=O)Nc2ccc(F)cc2I)n1	784842986	DFYAKRXCPVKUQN-UHFFFAOYSA-N	430.177	1.916	50	20	IDGD	
CCS(=O)(=O)CCn1cc(C)c(NC(=O)C(=O)NNC(=O)CCC2CCCCC2)n1	787542202	GXJCFRGZHLLQAG-UHFFFAOYSA-N	441.554	1.073	50	20	IDGD	
COc1ccc(OC)c([C@H]2C[C@@H]2C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c1	788196375	DSITVJAHMMXKST-WBVHZDCISA-N	443.412	1.720	50	20	IDGD	
O=C(O)c1cc(S(=O)(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)ccc1[N+](=O)[O-]	788500950	RCLISAJMSWEIQF-BBRMVZONSA-N	435.414	1.175	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)C(=O)Nc2cccc3c2OCC[C@@H]3N(C)C)c1	789731335	CIMPPDPXWIRZQE-SFHVURJKSA-N	425.489	1.538	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2cc(C(F)(F)F)ccc2-c2nc(C)no2)n1	789746321	WDTFKDSMUIVUAS-UHFFFAOYSA-N	437.338	1.944	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)N1CCC(C(=O)c2ccc(F)cc2)CC1	789839278	ADQHAJZFVCOTOZ-UHFFFAOYSA-N	432.477	1.953	50	20	IDGD	
CCN(C(=O)OC(C)(C)C)[C@H](C)CNC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	792315654	CSZPXMJKUSIXDF-CYBMUJFWSA-N	442.538	1.680	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C[C@H]2COCCN2C(=O)OC(C)(C)C)cc1OC	794783053	BWKVBEULVMPAHM-HNNXBMFYSA-N	437.493	1.881	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H]2CN(CC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)CC[C@@H]21	795098639	DXUWYJKSHNYLBC-WBVHZDCISA-N	447.492	1.687	50	20	IDGD	
COC(=O)c1cc(Cl)c(Cl)cc1NC(=O)C(=O)NNC(=O)Cc1cccnc1	797534623	BZVYGKMTYPLTSQ-UHFFFAOYSA-N	425.228	1.504	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)Nc2cc(S(=O)(=O)N3CCCC3)ccn2)c1	797673556	GAUMXCRYKQHBND-UHFFFAOYSA-N	447.517	1.715	50	20	IDGD	
C=CCNC(=S)NNC(=O)c1cn(CCC#N)nc1-c1ccc(OC)c([N+](=O)[O-])c1	798304688	HONYOGZNVYFSEQ-UHFFFAOYSA-N	429.462	1.675	50	20	IDGD	
CSC[C@@H](C)C(=O)N1CCC(C(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)CC1	799407094	LEJJKIZZUHEBCT-OAHLLOKOSA-N	434.562	1.627	50	20	IDGD	
COCN1C(=O)CCc2cc(NC(=O)NNC(=O)[C@H]3COc4ccccc4O3)ccc21	801782155	IQSBXBFIXXFXFS-GOSISDBHSA-N	426.429	1.562	50	20	IDGD	
O=C(CS(=O)(=O)Cc1ccc(Br)cc1)NNC(=O)N=c1cc[nH]cc1	802032469	SRWLOQHYPBOYFY-UHFFFAOYSA-N	427.280	1.034	50	20	IDGD	
O=C(CN1CCS(=O)(=O)CC1)NNC(=O)Nc1c(Cl)cc(Cl)cc1Cl	802069212	PNJYYAJOBPYIIZ-UHFFFAOYSA-N	429.713	1.530	50	20	IDGD	
CCS(=O)(=O)N1CCC(C(=O)NNC(=O)Nc2cc(OC)c(Cl)cc2OC)CC1	802080799	PISNTQSLIWUHHA-UHFFFAOYSA-N	448.929	1.572	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(F)c(C(C)=O)c2)cc1	806975080	MYHZXQUDTBUERF-ZDUSSCGKSA-N	429.404	1.784	50	20	IDGD	
COC(=O)c1cc(C)c(NC(=O)C(=O)NNC(=O)Cc2ccccc2OC)c(Cl)c1	806977486	LOUAIBFDQHEYSS-UHFFFAOYSA-N	433.848	1.772	50	20	IDGD	
O=C(NNC(=O)c1cccc(OC(F)F)c1)C(=O)Nc1nc2c(s1)CSCC2	806978516	FCRLFMABXIHELG-UHFFFAOYSA-N	428.442	1.934	50	20	IDGD	
C[C@@H](Oc1ccccc1NC(=O)C(=O)NNC(=O)COc1ccccc1O)C(F)(F)F	806978956	OFQTWFSIIOWWKO-LLVKDONJSA-N	441.362	1.887	50	20	IDGD	
O=C1COC[C@H](C[C@@H]2CN(C(=O)C(=O)NNc3ccc4ccccc4n3)c3ccccc32)N1	806984705	QGTRJHVQTWNDRP-SJORKVTESA-N	445.479	1.713	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2nccnc2C2CCC2)c(OCC(=O)N(C)C)c1	807460882	XEFGVROPZFZHBY-UHFFFAOYSA-N	426.477	1.601	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(Cl)c(Cl)c1)NNC(=O)c1ccc(Cl)nc1	810154776	FUBQMOGDHGPBBG-UHFFFAOYSA-N	437.692	1.781	50	20	IDGD	
CNC(=O)c1cc(Oc2ccc(NC(=O)C(=O)NNc3ccnc(F)c3)cc2F)ccn1	810397514	QIZOAQKACZHGRR-UHFFFAOYSA-N	442.382	1.989	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCC(=O)NNc2cc(Cl)nc(C)n2)cc1OCC	810437834	JDJXTXZUFXIQOH-UHFFFAOYSA-N	443.913	1.657	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)CCCC[C@@H]2SC[C@H]3NC(=O)N[C@H]32)cc1	812730436	JFLOPJDSSUNYMA-HLLBOEOZSA-N	441.579	1.106	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)nn1[C@@H](C)C1CC1	813033470	VEMFYTQJTLPOCM-ZDUSSCGKSA-N	434.522	1.495	50	20	IDGD	
CC(=NNC(=O)Nc1ccc(S(N)(=O)=O)cc1)c1ccc(S(=O)(=O)C(F)F)cc1	814964508	WSLBXKDCAFBUJW-UHFFFAOYSA-N	446.457	1.876	50	20	IDGD	
COc1ccc(NC(=O)c2cccc(NC(=O)C(=O)NNc3ncncc3F)c2)cn1	815766361	XEXAUHNXIMOZOC-UHFFFAOYSA-N	425.380	1.353	50	20	IDGD	
CN(C/C=C/C(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1)CC(F)(F)F	816087905	PYZGTDOKLKTSJK-VOTSOKGWSA-N	437.463	1.672	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCc2nn[nH]c21)c1nc(-c2ccccc2)n(-c2ccccc2)n1	816828458	GKWBREOBQZPUNH-INIZCTEOSA-N	428.456	1.934	50	20	IDGD	
CCn1nc(C(=O)NN=Cc2c(OC)nc(N)nc2N2CCCC2)c2ccccc2c1=O	863965631	NLRORINSZNBIQF-UHFFFAOYSA-N	436.476	1.161	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)CN2C(=O)N[C@@]3(CCc4ccccc43)C2=O)c1	864001498	IVKTWIOYMJFLOJ-HSZRJFAPSA-N	436.468	1.223	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)c2ccc(F)c(S(=O)(=O)NC(C)C)c2)cc1C	914748891	MBRMWNQHMNRXSS-UHFFFAOYSA-N	437.493	1.969	50	20	IDGD	
Cc1nc(-c2c(C)c(C)nn(C)c2=O)sc1C(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	915190682	LDODOQNNTQWWGA-UHFFFAOYSA-N	442.457	1.812	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H]2CCN(Cc3ccccc3)C2)c1	915902886	OTRGKEVCQDGBBU-SFHVURJKSA-N	445.545	1.155	50	20	IDGD	
O=C(NCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNc1cccc([N+](=O)[O-])c1	915917474	AQGNQUYNRQASTA-UHFFFAOYSA-N	435.462	1.442	50	20	IDGD	
Cc1oc(C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)cc1S(=O)(=O)N1CCCC1	916138280	DKBHNLWUFPMZGF-CYBMUJFWSA-N	439.465	1.740	50	20	IDGD	
COc1cc(C=NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc2c1OCO2	916258792	LQKMDBXQALIUTO-UHFFFAOYSA-N	447.469	1.209	50	20	IDGD	
Cn1ccnc1[C@](O)(CCNC(=O)NNC(=O)Cc1ccc(Cl)cc1)C(F)(F)F	916377703	FCSCUDOLYZPDOY-MRXNPFEDSA-N	433.818	1.787	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)CCCc2nnc(-c3ccccc3)o2)c2ccccc2c1=O	917387050	ICNQJRHWJBKNDP-UHFFFAOYSA-N	432.440	1.767	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)NCc2cccc(OCC(=O)N(C)C)c2)c1	918223812	NFYNGTKVCLUAAY-UHFFFAOYSA-N	428.489	1.680	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)NCCNC(=O)c2cccnc2)N(C)c2ccccc21	919715984	HOAZYIWGDQTISM-UHFFFAOYSA-N	432.484	1.598	50	20	IDGD	
Cc1cc(C)c2c(-n3cccc3)c(C(=O)NNC(=O)N[C@H]3CCS(=O)(=O)C3)sc2n1	919883039	ADHTTXHINSBZET-ZDUSSCGKSA-N	447.542	1.835	50	20	IDGD	
COc1cccc(C(=O)NNS(=O)(=O)c2ccc([N+](=O)[O-])c(Br)c2)c1O	919958435	KWSRQJLMHAPXQO-UHFFFAOYSA-N	446.235	1.695	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)Nc1nc(CN2CCOCC2)cs1	920933199	RYXLOPHVBHYNPB-UHFFFAOYSA-N	429.300	1.532	50	20	IDGD	
Cc1nn([C@H]2CCS(=O)(=O)C2)c2nc(C3CC3)cc(C(=O)NNC(=O)NCC3CC3)c12	1317993911	GQYGHIZRGCHFTD-AWEZNQCLSA-N	446.533	1.331	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cnn4c(C)cc(C)nc34)CC2)cc1	1319240877	RCWOYGSUMGAAQZ-UHFFFAOYSA-N	435.532	1.233	50	20	IDGD	
O=C(c1ccc2ncoc2c1)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1778010309	IUNFDLAQFQXDOS-PBHICJAKSA-N	426.242	1.962	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)Nc2nccs2)C1	1778074167	ULUOFRHHKZNKPH-DEXNDLTESA-N	444.985	1.711	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)c3cccc(Cl)c3)CCO2)C1	1779032184	FPXXMFDQRKXPIG-OAQYLSRUSA-N	443.891	1.096	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(-c4ccncc4)[nH]n3)C2)C1	1779593808	WFUQPAYLWHXWPD-MGPUTAFESA-N	433.896	1.169	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H]1CCCO1)CCO2	1780098738	TXPOLGCUEMOQEJ-GHTZIAJQSA-N	447.444	1.143	50	20	IDGD	
O=C(COc1ccc(O)cc1)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781326247	VOESQDOMLLTMOI-NVXWUHKLSA-N	431.258	1.291	50	20	IDGD	
O=C(c1n[nH]c(C2CC2)c1F)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781328004	GJBNSRLKGHSAEG-CJNGLKHVSA-N	433.253	1.560	50	20	IDGD	
C[C@H](C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1)n1cccc1C=O	1781332119	ZXDGBHDJEKBCTG-HACGYAERSA-N	430.274	1.382	50	20	IDGD	
O=C(c1cccc2nccn12)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1782361752	PMDDILVTAGZEQS-PBHICJAKSA-N	425.258	1.468	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H]3CC(c4ccccc4)=NN3)C2)C1	1782601677	BLPMJVKSGAFVDC-LQBOVUBWSA-N	432.952	1.990	50	20	IDGD	
Cc1onc(-c2ccncn2)c1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]2C1	1787447659	APJPDTDDJKRJRE-MYLCLEHYSA-N	437.859	1.568	50	20	IDGD	
COCCn1nccc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]21	1787626849	LUQYLVVKTVZKJW-PWDMQXDWSA-N	447.363	1.359	50	20	IDGD	
CCCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)[C@H]2C1	1789222321	SDUVJOLZHHNVLM-FNHZYXHNSA-N	433.461	1.914	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1ccc(C2(NC(=O)c3ccc(O)cn3)CCC2)cc1	1789522918	XKQWCWZMCAFNDP-UHFFFAOYSA-N	446.467	1.847	50	20	IDGD	
CC(C)N1CCC[C@H]1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]2C1	1789927222	PVFYLKWKMKLBMA-UVPYHEFZSA-N	434.350	1.529	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CO[Si](C)(C)C)C[C@@H]21	1790608716	SGALYCPZPVMYIR-UGUYLWEFSA-N	430.574	1.379	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(Cl)ncn3)C[C@@H]21	1790960400	FRJROYMRTYRPNS-FMSGJZPZSA-N	445.745	1.897	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nccc4[nH]ccc34)C[C@@H]21	1791058035	WQJOPHACMHLHRM-DUPGQFARSA-N	435.322	1.940	50	20	IDGD	
C[C@H](Oc1cccnc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)CBr	1792873002	IOHNQXJBXQYIHB-JGFGOLAASA-N	440.338	1.470	50	20	IDGD	
C[C@H](CBr)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CNC(=O)c1cccnc1)C2	1792987323	NMQPJJMHFFERON-DMRZNYOFSA-N	437.338	1.481	50	20	IDGD	
COc1cccnc1CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCC(=O)NN(C)C)C2	1794303814	ALSDFVXYTGRKTQ-BJWYYQGGSA-N	431.537	1.034	50	20	IDGD	
COc1ncc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)Br)C3)cc1F	1794364596	AUZOHCXDBPBECG-ZKCLLBTKSA-N	430.274	1.216	50	20	IDGD	
Cc1cccn2ncc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)CCBr)c12	1795116393	FRRBUVFBQIVMKM-XOIINTDNSA-N	435.322	1.631	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1CCC3(CC1)OCCO3)C2	1795116550	RRFQQOHCNDBAME-SCAQPMJSSA-N	445.354	1.294	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc3c[nH]nc13)C2	1796892143	KYDFEOWGPXFSAZ-AUHJYUKYSA-N	447.499	1.949	50	20	IDGD	
COc1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)ccc1C	1798441962	QKPLBNUUVGXBQK-BJWYYQGGSA-N	437.500	1.568	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc3ccnn13)C2)[C@H](F)Br	1799348513	JZHSGNFTUBXTMT-JLUCKKNBSA-N	425.258	1.228	50	20	IDGD	
O=C1Cc2cc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@@H](F)Br)ccc2N1	1799348733	AAWZJOWQKNJZHB-NOXHYTERSA-N	440.269	1.075	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1nn(C)c(C)c1Br	1799445370	JSETXOCKFDTOCG-RNJOBUHISA-N	447.761	1.997	50	20	IDGD	
CN(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1=COCC1)C2)NC(=O)NCc1ccccc1	1799869681	WLXVFCXKVZREQY-ACDBMABISA-N	441.532	1.275	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2cccnc2nc1O	1799922221	AUPFFVUMLQSOHT-IKVITTDRSA-N	449.305	1.322	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccnc2ncccc12	1799977474	CJJCQOJPWXOZIT-JFILPPLUSA-N	433.306	1.616	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc2nccn12	1799994788	CXDOAXVQKWYZAD-AODNKKSCSA-N	425.316	1.774	50	20	IDGD	
COc1cc(F)c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CCC(=O)NN(C)C)C3)c(F)c1	1800478729	LVSSQEDOLLYPPR-BTTYYORXSA-N	438.475	1.598	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CSc1ccncc1)C2	1800757594	QOEFNDZWLUGQRB-NFFDBFGFSA-N	428.352	1.547	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccn(-c3ccccc3)n1)C2	1800979311	ZGLHDCMTXQCOTE-LORHWOILSA-N	432.908	1.329	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CC(=O)N(C3CCCC3)C1)C2)C(Cl)Cl	1801015297	CUOCEPSWFZFQET-JFILPPLUSA-N	432.348	1.171	50	20	IDGD	
CCOC(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)OCC	1801149709	WRIHKSURPVRCHB-JLUCKKNBSA-N	425.295	1.056	50	20	IDGD	
C[C@H](S)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN(C)NC(=O)NCc1ccccc1)C2	1802295644	VFNACNNIRFTDQT-OWLYRPNTSA-N	433.578	1.289	50	20	IDGD	
CCOC(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2)OCC	1802595532	CNKLWCCXLIIZIK-GSWMANSFSA-N	447.536	1.548	50	20	IDGD	
COc1cccnc1CCC(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1	1803142036	VHZDIQPVMLHODU-MMOPVJDHSA-N	446.935	1.724	50	20	IDGD	
COc1cc(CCC(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)ccn1	1804273834	VDHRHGUSRJWFJF-WFXMLNOXSA-N	446.935	1.724	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)c2ccon2)[C@@H]1c1cccnc1	1805996643	WEUHQEWMCOYMNZ-TYNUBOESSA-N	449.471	1.523	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccccc2O)[C@H]1c1cccnc1)c1cccc(B(O)O)c1	1807369546	NPNKFGJFBSTKRX-AVRDEDQJSA-N	445.284	1.100	50	20	IDGD	
C#CC(=O)N1CC[C@H](CNC(=O)CN(C)NC(=O)NCc2ccccc2)[C@@H]1c1cccnc1	1807451837	FRIOJGNKHSNQCB-OFNKIYASSA-N	448.527	1.067	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)CCNC(=S)NC)[C@@H]1c1cccnc1	1810306542	VPPCILNAISXWOQ-BQFCYCMXSA-N	440.013	1.979	50	20	IDGD	
CC(=O)N[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)[C@H](C)Br)[C@@H]1c1cccnc1	1812652132	LABJQBNWPAYPLQ-SHUKQUCYSA-N	425.327	1.395	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1)C1(O)CCC1	1813067713	BONORVANHBKKIC-BLIXFSHQSA-N	445.564	1.012	50	20	IDGD	
CSCC(C)(C)C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1	1815337595	UKZIRGYRZPTVDT-CQSZACIVSA-N	447.391	1.438	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(F)c1)CC2)c1ccc(B(O)O)cc1	1815343816	QLONOMNVKVSGNS-INIZCTEOSA-N	439.277	1.502	50	20	IDGD	
N#Cc1ccc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)cc1	1815360352	GMDPERPQHRKNGQ-KRWDZBQOSA-N	446.297	1.234	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1coc(Cl)n1	1816174708	WKJPCRGWQIKEEV-HNNXBMFYSA-N	443.656	1.351	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1ccccc1O	1816263296	HWEVLCGBFUCDJM-SFHVURJKSA-N	434.261	1.415	50	20	IDGD	
CN1CCCn2nc(C(=O)N[C@@H]3CCc4nc(NC(=O)[C@@H](F)Cl)sc4C3)cc2C1	1817133017	CNWXCVNZSQUFML-MEBBXXQBSA-N	440.932	1.935	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2[C@H]3C=CS[C@@H]32)[nH]n1)c1ccc(B(O)O)cc1	1817474778	FQQUAHXOGIXJEN-HYEGPXJVSA-N	438.318	1.271	50	20	IDGD	
COc1ccc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)CCC(=O)NN(C)C)CC3)nc1	1817884362	SJHFRPPYERJRLZ-LBPRGKRZSA-N	446.533	1.146	50	20	IDGD	
Cc1cc(/C=C/C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)no1	1819471490	DSRFUFXHFUDNDT-CSHXORCISA-N	449.276	1.405	50	20	IDGD	
C[C@H](NC(=O)c1ccccn1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1	1821662984	XGVIHYUJAWHQGM-APHBMKBZSA-N	448.911	1.215	50	20	IDGD	
C=CCC(F)(F)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1	1821988166	OKRRABNKYMXBCH-CQSZACIVSA-N	426.468	1.986	50	20	IDGD	
CC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)COc1ccc(O)nn1)CC2	1822855735	PBYCFNUQKYQXTP-UWVGGRQHSA-N	425.898	1.647	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)CCc3ccc(O)nn3)sc2C1	1824491770	OJWUKFPTDRNUHK-VXGBXAGGSA-N	439.925	1.437	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CC(F)(F)C(=O)O)CC2	1825999141	QZWWROZNDCRTDQ-YUMQZZPRSA-N	425.841	1.419	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCc1ccc(O)nn1)CC2	1826004855	SMNWQDYXESBWJL-VXGBXAGGSA-N	439.925	1.437	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(F)cn1C)CC2	1826086311	RJUHALIAIWOSKS-GFCCVEGCSA-N	436.513	1.220	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)[C@H]3C[C@@]3(F)Cl)sc2C1	1826274273	QARBMPSSMUQQLW-YHTYYEMMSA-N	431.921	1.353	50	20	IDGD	
C=CCOCCCC(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827056043	RAGDFIJVYNLWGP-JOCHJYFZSA-N	442.365	1.583	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cnc(O)nc2O)CC1	1827591833	XWVIJVLXUUCEEN-INIZCTEOSA-N	436.585	1.973	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H]2CCC=CO2)CC1	1828924019	GOKAZGGSHFKZGM-WOJBJXKFSA-N	441.532	1.611	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3nc4ccccn4n3)C2)C1	1830357502	CXBCKHDNROEPNU-HXUWFJFHSA-N	435.912	1.064	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)on1	1830537796	OVNVHJFBWXSEAH-SJCJKPOMSA-N	430.299	1.084	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)Nc3cnccn3)C2)C1	1831651059	NFRVHCNQUNEOJX-GQIGUUNPSA-N	439.944	1.141	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3cccs3)CCO2)C1	1833160761	ZHDHHXBSRKMSST-RDTXWAMCSA-N	445.379	1.921	50	20	IDGD	
CCS(=O)(=O)CC(=O)N1CCC(N2CCC(NC(=O)C(C)(C)CCl)CC2)CC1	1833213552	TXPQUHIGEWNBTM-UHFFFAOYSA-N	436.018	1.258	50	20	IDGD	
C[C@@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)c3cn(C)cn3)CC2)CC1	1833261905	BTQQROOWFIXENK-AWEZNQCLSA-N	440.386	1.636	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(Cl)nc3F)CCO2)C1	1833267220	LBEDZSVEGDBLNY-SCLBCKFNSA-N	434.295	1.962	50	20	IDGD	
COc1cccc(CC(=O)N2CCC(N3CCC(NC(=O)[C@H](O)CCl)CC3)CC2)c1	1833309503	ZXGMMVNAKAVVGI-HXUWFJFHSA-N	437.968	1.409	50	20	IDGD	
CCCNC(=O)CCC(=O)NC1CCN(C2CCN(C(=O)C(Cl)Cl)CC2)CC1	1833426134	SPNQLHVMLDYIOY-UHFFFAOYSA-N	435.396	1.668	50	20	IDGD	
Cn1ccc(CC(=O)NC2CCN(C3CCN(C(=O)CO[Si](C)(C)C)CC3)CC2)n1	1834848226	PJBZRYHOCAODPG-UHFFFAOYSA-N	435.645	1.386	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)Cn3cccn3)CC2)CC1	1834881263	ANHKYVFIDGWPLV-HNNXBMFYSA-N	440.386	1.486	50	20	IDGD	
Cc1ccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)cc1	1835085609	MBDZLBDKZBVDSJ-JXFKEZNVSA-N	439.350	1.777	50	20	IDGD	
CC(=O)NC(C)(C)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](F)Br)CC2)CC1	1836413343	CMAKTDADMCDSKQ-OAHLLOKOSA-N	449.365	1.163	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)c3ccc[n+]([O-])c3)CC2)CC1	1837242904	ZFGFLNLIIMSUMQ-CQSZACIVSA-N	440.338	1.716	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CCC=CO1)CCO2	1837406183	HFXPIAUSCNEAIX-IIDMSEBBSA-N	431.327	1.167	50	20	IDGD	
COC1(CC(=O)N2CCOC[C@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)CCC1	1837717838	PDKKKIXKUAGYFG-HXUWFJFHSA-N	428.602	1.254	50	20	IDGD	
C=CC(=O)N[C@@H](C)C(=O)N1CCC(OC2CCN(C(=O)[C@H](F)Br)CC2)CC1	1838427723	FACWPFCSYORFTI-LRDDRELGSA-N	448.333	1.366	50	20	IDGD	
COC(=O)NCC(=O)N1CCC(OC2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1838648040	HJFZXNIPPCGOKR-CQSZACIVSA-N	438.294	1.032	50	20	IDGD	
C[C@@H](C(=O)N1CCC(OC2CCN(C(=O)[C@H](F)Br)CC2)CC1)n1ccnn1	1838648152	JYFPQWQWVGXYJO-WFASDCNBSA-N	446.321	1.528	50	20	IDGD	
CC(C)n1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)n1	1838788340	UKMAWACHEUAKQV-RBUKOAKNSA-N	447.363	1.770	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccccc3OC)CCO2)C1	1838877768	XYVURPPEGIEHLO-OXJNMPFZSA-N	426.897	1.019	50	20	IDGD	
CN(C)c1cccc(C(=O)N2CCO[C@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)c1	1838925472	VSBVEIQUQGLDSU-LJQANCHMSA-N	430.332	1.626	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccncc3)CCO2)C1	1839057473	FDXUCAADJCPWQH-DNVCBOLYSA-N	440.338	1.112	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4cccnc4n3)C2)C1	1839145556	LZKLLNPZFSNOPP-IIBYNOLFSA-N	432.908	1.717	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1[C@H]3SC=C[C@H]31)CCO2	1839700278	KSCOLGAXRAQONM-GLRLOKQVSA-N	445.379	1.491	50	20	IDGD	
C=CCC(F)(F)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H](C)Br)CCO2)C1	1840035376	PFWAMNXTUQELTG-IUODEOHRSA-N	425.270	1.438	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(C)cc3OC)CCO2)C1	1840680222	PUBVMIPSAZOMNM-DYESRHJHSA-N	440.924	1.327	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC12CN(C(=O)[C@@H]1CC(c3ccccc3)=NN1)C2	1841289382	XWIKDNAWKPEMQZ-PBHICJAKSA-N	433.350	1.987	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCCC12CN(C(=O)c1cccc(O)n1)C2	1841924173	DGQKUPQSQIBZGM-AWEZNQCLSA-N	438.912	1.736	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCCC12CN(C(=O)Cc1cncnc1)C2	1841924182	DXRUHZJPQHUENG-HNNXBMFYSA-N	437.928	1.355	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)CCc2cnccc2C)C1	1842051861	YITWHJNSQPEOBT-YZSQISJMSA-N	436.516	1.660	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)Cc2ccc3ccccc3c2)C1	1842660007	JCGJOJZRKAEQBX-UHFFFAOYSA-N	428.297	1.579	50	20	IDGD	
O=C(Cc1cccc(C(F)(F)F)c1)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843012247	SLEGBFYWOIOCLX-UHFFFAOYSA-N	446.234	1.445	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)[C@@H](F)Br)C2	1843416639	IVXQXFTVYSYVGI-HMASQMOLSA-N	428.262	1.014	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCCC12CN(C(=O)c1cc(S(C)(=O)=O)ccc1F)C2	1844379007	HCVNHNXVIVLZGP-UHFFFAOYSA-N	442.585	1.898	50	20	IDGD	
COc1ccc(Cl)cc1CC(=O)N1CCCC12CN(C(=O)c1ccc(B(O)O)cc1)C2	1845920768	GODRPAJYONXLEV-UHFFFAOYSA-N	442.708	1.088	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)c1cccc(-c3ccccc3)n1)C2	1846384722	ARFSMHWWRUFZEP-UHFFFAOYSA-N	435.528	1.939	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)C1=NO[C@H](c3ccccc3)C1)C2	1846384972	GGZRDLZVEWILST-SFHVURJKSA-N	427.505	1.080	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@H](O)CC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)C(C)(C)CCl	1847438416	PJPKAKLABCYOCA-ILXRZTDVSA-N	431.961	1.729	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H]1C[C@@H]2C[C@@H]2N1C(=O)OC(C)(C)C	1847573670	SOMLPQKCCAMGMA-FQMQPWHVSA-N	441.956	1.840	50	20	IDGD	
CC(C)(C)c1cc(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2cnccc2C(=O)NN)ccn1	1848315274	KGLZHULCMPYGQL-ROUUACIJSA-N	436.516	1.507	50	20	IDGD	
C=C1c2ccccc2C(=O)N1[C@H](C)C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	14057363	VYHCTPPZNOGMFG-CQSZACIVSA-N	442.497	1.213	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)c1ccccc1)C(=O)NNC(=O)c1ccccc1F	15794536	ONROWALDPFDANI-MRXNPFEDSA-N	425.507	1.687	50	20	IDGD	
Cc1nnnn1/C(=C\c1ccc(F)cc1)C(=O)OCC(=O)NNC(=O)c1cccs1	23573416	UFQBLRKLILGMGM-ZROIWOOFSA-N	430.421	1.185	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)CNC(=O)CC2CCCCC2)c2ccccc2c1=O	109763358	CDRPQBMPNWGKMK-UHFFFAOYSA-N	427.505	1.825	50	20	IDGD	
COCCCNC(=S)N(C)NC(=O)Cc1cc2c(cc1Br)OCCO2	726078198	GBXGVSUVSPNNJH-UHFFFAOYSA-N	432.340	1.637	50	20	IDGD	
Cn1ccc(C(=O)NNC(=O)CCN2CCN(C(c3ccccc3)c3ccccc3)CC2)n1	727294679	HAHNGGCBMCDDEN-UHFFFAOYSA-N	446.555	1.978	50	20	IDGD	
COc1ccccc1C(=O)N[C@@H](CCS(C)(=O)=O)C(=O)NNc1ccc(F)cc1F	727865769	VOCLEKSJFVKOLV-INIZCTEOSA-N	441.456	1.650	50	20	IDGD	
C[C@H](Oc1ccc(F)c(F)c1)C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	728336306	JTXMZCDWCCZNCM-APPDUMDISA-N	436.367	1.263	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1n[nH]c(C2CC2)c1Br	728890533	UZDCHOOMWWNVIF-UHFFFAOYSA-N	434.298	1.517	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCCOc2cccc(NC(C)=O)c2)cc(OC)c1OC	729221699	XVVGIZKTNNHMSO-UHFFFAOYSA-N	446.460	1.694	50	20	IDGD	
CC(=O)N1CCN(c2ccccc2CNC(=O)NNC(=O)Cn2ccc3ccccc32)CC1	729608186	HYHUICXSXVPSCY-UHFFFAOYSA-N	448.527	1.840	50	20	IDGD	
COc1ccc(CNC(C)=O)cc1S(=O)(=O)NNC(=O)Cn1ccc2ccccc21	729667015	BXKMYSJHPXUQKH-UHFFFAOYSA-N	430.486	1.296	50	20	IDGD	
CN(C)c1ccc(NC(=S)NNC(=O)c2ccc(S(=O)(=O)NCCC#N)cc2)cc1	729690909	PCMGZYJVNWMXFF-UHFFFAOYSA-N	446.558	1.576	50	20	IDGD	
CC(C)(C(=O)NNC(=O)c1cccc(CN2CCS(=O)(=O)CC2)c1)c1ccccc1	731175607	YECSUDLZMRRRIM-UHFFFAOYSA-N	429.542	1.656	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)NCCC(=O)N1CCN(c2ccccc2)CC1	731545222	XLOWUFFVLJHFQL-UHFFFAOYSA-N	425.489	1.378	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)CCNS(=O)(=O)c1ccc(F)c(F)c1)c1ccccc1	732132955	LPHQDEKFQZTOMZ-OAHLLOKOSA-N	425.457	1.974	50	20	IDGD	
Cc1cc(C)nc(-n2nc(C)c(CC(=O)NNC(=O)CCN3C[C@@H](C)O[C@H](C)C3)c2C)n1	732262867	WTKRGEYAOQPZTR-HZPDHXFCSA-N	443.552	1.085	50	20	IDGD	
Cc1ccc(C)n1-c1ccc(C(=O)NNC(=O)NCCN/C(O)=C2\N=CC=CC2=O)cc1	732466656	QHRKOZYLTBUVAG-XUTLUUPISA-N	436.472	1.565	50	20	IDGD	
CC1CCC(Oc2cc(CNC(=O)NNC(=O)CNC(=O)c3ccco3)ccn2)CC1	733850714	YDYPQPJFCLRGNX-UHFFFAOYSA-N	429.477	1.893	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)N[C@H]2CCN(C(C)C)C2=O)c2ccccc2c1=O	734218300	IRABDDOSLGLSQN-INIZCTEOSA-N	428.493	1.150	50	20	IDGD	
CN1CCC(N2CC[C@H](NC(=O)NNC(=O)c3ccc(Br)s3)C2)CC1	734281773	PMIZWSOZNAFLPL-NSHDSACASA-N	430.372	1.623	50	20	IDGD	
CCCCS(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)CCc2ccco2)cc1	737755967	BREXOQKZKCORNK-UHFFFAOYSA-N	429.520	1.764	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2coc(-c3ccccc3)n2)cc1	737766669	LGFJSQMHULLGSM-UHFFFAOYSA-N	428.470	1.732	50	20	IDGD	
CN(C)c1nccc(NNC(=O)CCCCC/N=C2/NS(=O)(=O)c3ccccc32)n1	740105094	XGSFLXRDJOLBNK-UHFFFAOYSA-N	431.522	1.285	50	20	IDGD	
O=C(COC(=O)c1cc(O)nc2cc(F)ccc12)NNC(=O)c1ccc([N+](=O)[O-])cc1	740256419	HKSIRIMKSSKEKE-UHFFFAOYSA-N	428.332	1.606	50	20	IDGD	
Cc1nc2ccccc2c(=O)n1CC(=O)NNC(=O)c1cc(Br)ccc1O	743730412	WSUAAYYSQKBFPF-UHFFFAOYSA-N	431.246	1.634	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1cccn1Cc1ccncc1	744619230	KSBXCJNZEYTZTA-UHFFFAOYSA-N	441.513	1.709	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)c1ccc(COc2ccccc2)o1)CN1CCN(C)CC1	745863223	TWOIOIKYUWQPFY-KRWDZBQOSA-N	429.521	1.686	50	20	IDGD	
CN(C)c1ccc(N2CCC(NC(=O)NNC(=O)c3cc([N+](=O)[O-])ccc3O)CC2)cc1	745869762	KZEFWKGSAQEUPK-UHFFFAOYSA-N	442.476	1.979	50	20	IDGD	
CO[C@H](CNC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)c1cccc(Cl)c1	745911900	MLOHYDYIOLBZGM-MRXNPFEDSA-N	429.864	1.919	50	20	IDGD	
CCSCC[C@H](C)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	745924086	ZOHKQPPNDSNWSY-AWEZNQCLSA-N	428.580	1.947	50	20	IDGD	
Cn1ccnc(NNC(=O)c2ccc(Cl)c(S(=O)(=O)N3CCCCC3)c2)c1=O	747938176	QZCBTGSYLDNTIZ-UHFFFAOYSA-N	425.898	1.365	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)[C@@H]2CC(=O)N(c3cn[nH]c3)C2)cc(OCC)c1OCC	748524840	ZZCRMSBYGSXHLB-CQSZACIVSA-N	445.476	1.420	50	20	IDGD	
CCO[C@@H]1C[C@H](NC(=O)NNC(=O)c2csc(N3CCOCC3)n2)C1(CC)CC	749619582	WTPPAMOVTJQPFW-LSDHHAIUSA-N	425.555	1.908	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)c3ccc(C=O)[nH]3)c2)cc1	749863309	UCYGDOQVCKXRKN-UHFFFAOYSA-N	442.453	1.711	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)ccc1[N+](=O)[O-]	751043677	MYMOXTOVNMKLDM-UHFFFAOYSA-N	448.457	1.463	50	20	IDGD	
Cc1nn(C)c2nc(-c3cccs3)cc(C(=O)NNC(=O)CNC(=O)c3ccco3)c12	751204980	UIKSLGOXAOYXLH-UHFFFAOYSA-N	438.469	1.789	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N[C@H](C)c2nc(C)no2)cc1	751395831	FPHNZZUWFUFVIZ-BVTUPMQUSA-N	449.471	1.910	50	20	IDGD	
CCC(=O)NCc1cc(S(=O)(=O)NNC(=O)c2ccc3c(c2)OCO3)ccc1OC	751538417	JEXWGOJHGIJVPS-UHFFFAOYSA-N	435.458	1.073	50	20	IDGD	
C[C@H]1CCCN(S(=O)(=O)c2cc(C(=O)NNC(=S)N[C@H](C)C3CC3)n(C)c2)C1	751617833	LEQXYMAMQQYNTQ-QWHCGFSZSA-N	427.596	1.353	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2ccc(=O)n(-c3cccc(F)c3)c2)n1	751775176	AJRVCTFRBPVLGU-UHFFFAOYSA-N	444.444	1.288	50	20	IDGD	
Cc1oc(-c2cnn(C)c2)nc1C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	752651272	UTDVYCALEINVNV-UHFFFAOYSA-N	446.489	1.161	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CC(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1)C1CC1	752737480	YPBNUQONSBOGOF-HNNXBMFYSA-N	438.912	1.797	50	20	IDGD	
O=C(CCCCc1cnn[nH]1)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	753986400	ZSKZTSODSSWHJF-UHFFFAOYSA-N	445.487	1.681	50	20	IDGD	
CCc1nn(C)c(CC)c1S(=O)(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12	754334348	MPRPGTRXOKTKGC-UHFFFAOYSA-N	446.533	1.459	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCOCC2)cc1C(=O)NNc1cccnc1Cl	754470090	ARASKIJIJDGOPO-UHFFFAOYSA-N	426.882	1.521	50	20	IDGD	
Cc1cc(Br)ccc1C(=O)N1CCC[C@H](C(=O)NNC(=O)Cc2cc[nH]n2)C1	755278686	BIVPRPZNJKZICN-ZDUSSCGKSA-N	448.321	1.723	50	20	IDGD	
Cc1cccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c1C	755330802	VFHKTOIDTQMNIB-UHFFFAOYSA-N	432.502	1.791	50	20	IDGD	
Cc1ccc(S(C)(=O)=O)cc1NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1	755536962	SWQKHPFTCRSSAH-UHFFFAOYSA-N	432.506	1.258	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)Nc1cccc(N2CCCS2(=O)=O)c1	755884199	HBDFYHPGOXKJQZ-UHFFFAOYSA-N	442.457	1.342	50	20	IDGD	
CCOC(=O)N1CCN(S(=O)(=O)NNC(=O)c2ccc(OCCC(C)C)cc2)CC1	755960334	XZBUZLXTIKDJDN-UHFFFAOYSA-N	442.538	1.365	50	20	IDGD	
COCCOc1cc(C)ccc1CNC(=O)NNC(=O)Cc1nc2ccccc2n1C	756108366	WYBNRQJROBGXHH-UHFFFAOYSA-N	425.489	1.980	50	20	IDGD	
Cc1c(CS(C)(=O)=O)cccc1NC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	756609246	FTMAPYKZWQGRCE-UHFFFAOYSA-N	439.515	1.410	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)cc1NS(C)(=O)=O	756782314	PGWBBPYKCUBZMQ-LLVKDONJSA-N	440.453	1.826	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2ccc(C(=O)NC3CC3)cc2)c2ccccc2c1=O	756863072	FNZGIVQHWBIJCL-UHFFFAOYSA-N	433.468	1.774	50	20	IDGD	
CCOC(=O)Cc1nnc(NC(=O)NNC(=O)c2cccc(Br)c2)s1	757754806	DFCIFXNHLCRRNZ-UHFFFAOYSA-N	428.268	1.873	50	20	IDGD	
COc1ccc(C(C)(C)C(=O)OCC(=O)NNC(=O)Cc2nc(C)cs2)cc1OC	758134531	LYDKGKKZIXZGIG-UHFFFAOYSA-N	435.502	1.680	50	20	IDGD	
CCOCCCn1c(NNC(=O)COc2c(C)nn(C)c2C)nc2ccccc2c1=O	758484339	FKLGMFUANBIKOR-UHFFFAOYSA-N	428.493	1.696	50	20	IDGD	
Cc1nc2ccnn2c(C)c1CCC(=O)N1CCN(S(=O)(=O)CBr)CC1	758527123	HXWIBTMNIUOZGW-UHFFFAOYSA-N	444.355	1.105	50	20	IDGD	
COc1ccccc1[C@@H](CNC(=O)NNC(=O)C(=O)Nc1ccccn1)N1CCCC1	758673008	YHNAAMIEADYIGS-MRXNPFEDSA-N	426.477	1.196	50	20	IDGD	
C[C@H](NC(=O)c1cccs1)C(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758786847	PAOBTCPMQBGRAK-ZDUSSCGKSA-N	439.538	1.502	50	20	IDGD	
Cc1cc(C)nc(-n2nccc2NC(=O)C(=O)NNc2ccc(Br)nc2)n1	760305293	WOLABAFULUFPMB-UHFFFAOYSA-N	431.254	1.518	50	20	IDGD	
CCn1c(=O)n(CC)c2nc(NC(=O)CCC(=O)NNc3nc(C)cc(OC)n3)ccc21	761168536	YPLLBVJPPWBMNR-UHFFFAOYSA-N	442.480	1.207	50	20	IDGD	
O=C(COC(=O)c1cccc([C@@H]2CCOC2)c1)NNC(=O)[C@@H]1COc2ccccc2O1	761546907	IKLWKXLMNCCLRM-APWZRJJASA-N	426.425	1.335	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)N[C@@H]1CCCN(c2ccccc2F)C1	762574317	BIWLRFVCYVGACA-QGZVFWFLSA-N	441.511	1.832	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)c2ccnc3c(C(=O)OCC)cnn23)cc1OC	763270818	VMYMZBAVXITYHU-UHFFFAOYSA-N	441.444	1.778	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)c1ccc2c(c1)CC(=O)N2C	763497253	DFTPDLWXBQGVDD-CYBMUJFWSA-N	433.509	1.902	50	20	IDGD	
CCc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1	763508491	MTDDLIZRPYIAHV-UHFFFAOYSA-N	444.513	1.433	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)c1	763549141	PLECMSWILMOBNE-UHFFFAOYSA-N	429.414	1.259	50	20	IDGD	
Cc1cc(C)n(-c2ccc(NC(=O)C(=O)NNC(=O)c3ccc4c(c3)OCO4)cc2F)n1	763557773	DPVUFYHCTQPNCJ-UHFFFAOYSA-N	439.403	1.757	50	20	IDGD	
O=C(NCc1cccnc1OCC(F)F)NNC(=O)c1nn(-c2ccccc2)cc1O	763571793	FIBNHEPNSGKXAE-UHFFFAOYSA-N	432.387	1.761	50	20	IDGD	
Cc1ccc(-n2nc(NC(=O)C(=O)NNC(=O)[C@H]3COc4ccccc4O3)cc2C)cc1	763576449	AQACYCASFLFPAC-GOSISDBHSA-N	435.440	1.415	50	20	IDGD	
NC(=O)COc1cccc(NC(=O)C(=O)NNC(=O)c2sc3ccccc3c2Cl)c1	763578422	NRRKQSVSPPFSRM-UHFFFAOYSA-N	446.872	1.819	50	20	IDGD	
NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2cccc(C(F)(F)F)c2)c(F)c1	763638627	DCBFKBZIBHRHOR-UHFFFAOYSA-N	442.325	1.108	50	20	IDGD	
CSc1cc2c(cc1NC(=O)C(=O)NNC(=O)COc1ccc(C#N)cc1)OCCO2	763674077	KRLSBXQXDSOAQZ-UHFFFAOYSA-N	442.453	1.216	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)ccc1C(=O)N(C)C	763684465	LUQJVPDCSWTWIP-UHFFFAOYSA-N	432.864	1.515	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1cc(C#N)ccc1OC(F)F	763864896	LWTVDAIODHRSDI-SNVBAGLBSA-N	436.346	1.852	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1cccc(CN2CCCC2=O)c1	763864999	MZBOVPANQWFJJB-AWEZNQCLSA-N	442.447	1.502	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)c2cccnc12	763866674	XMUIOIAIORYQBJ-LBPRGKRZSA-N	426.404	1.936	50	20	IDGD	
Cc1nn(-c2ccccc2)cc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccc(F)cc1	763873304	VFZAJSFVDLVILN-AWEZNQCLSA-N	425.420	1.873	50	20	IDGD	
CC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Br)s2)cc1	763940425	QSRQSBORUCOHCU-UHFFFAOYSA-N	425.264	1.869	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3cnn(-c4ncccn4)c3)cc2C1	763943119	RFYWKDYWAVLUPD-NSHDSACASA-N	425.474	1.248	50	20	IDGD	
CN(C)C(=O)C[C@@H]1CN(C(=O)C(=O)NNC(=O)c2cccn2C)c2ccc(Cl)cc21	763992474	FKQNYWXRJOVWEZ-GFCCVEGCSA-N	431.880	1.048	50	20	IDGD	
Cc1cc(C)n(-c2cccc(NC(=O)C(=O)NNC(=O)c3cc(Br)c[nH]3)c2)n1	763994747	FXQZYJZQUXLZLS-UHFFFAOYSA-N	445.277	1.979	50	20	IDGD	
CCNC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3c2)cc1	764064975	STYNKRUGVJWNNG-UHFFFAOYSA-N	434.452	1.754	50	20	IDGD	
O=C(CN1CCCCCC1)Nc1ccc(NC(=O)C(=O)NNC(=O)c2ccoc2)cc1	764163661	LRMQINFCEICZTD-UHFFFAOYSA-N	427.461	1.494	50	20	IDGD	
CCOC(=O)c1cc(Br)ccc1NC(=O)C(=O)NNC(=O)Cc1ccccn1	764264732	RSGKKJAZERCPAV-UHFFFAOYSA-N	449.261	1.349	50	20	IDGD	
CCNC(=O)N1CCc2ccc(NC(=O)C(=O)NNC(=O)CCCc3cccs3)cc21	764340465	CUECVNYBPNQDGC-UHFFFAOYSA-N	443.529	1.949	50	20	IDGD	
COc1cc(C)ccc1Oc1ccc(F)cc1NC(=O)C(=O)NNC(=O)[C@H]1COCCO1	764424025	GBPJHWKUBFUYIC-GOSISDBHSA-N	447.419	1.436	50	20	IDGD	
Cc1ccc([C@@H](C)[C@@H](O)C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1	764586445	VGONRCXBGQXCKN-OXQOHEQNSA-N	445.541	1.705	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NN=Cc3cnn(C(C)(C)C)c3)CC2)cc1	764817249	OONFHHLQLIESMM-UHFFFAOYSA-N	446.577	1.403	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)Cc3ccc(S(N)(=O)=O)s3)n[nH]2)cc1	765571646	MORYJUDTWVGNEI-UHFFFAOYSA-N	433.515	1.352	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3ccc([S@@](C)=O)cc3)CC2)cc1	765749368	MEUDHXQUGSKYGM-SSEXGKCCSA-N	428.558	1.311	50	20	IDGD	
C[C@H]1CN(C(=O)NNC(=O)CNC(=O)c2cccs2)[C@H](C)CN1Cc1ccccc1	766528474	JDUUGBJYAWGWNN-JKSUJKDBSA-N	429.546	1.814	50	20	IDGD	
Nc1ccc(C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)cc1[N+](=O)[O-]	766664394	QEHUCRZVFLBLSR-UHFFFAOYSA-N	446.895	1.409	50	20	IDGD	
COCCN(CCNC(=O)NNC(=O)[C@H]1COc2ccccc2O1)C(=O)OC(C)(C)C	767303797	UWTKIKYFKUAMFU-MRXNPFEDSA-N	438.481	1.040	50	20	IDGD	
CCOc1ccnc(N2CCCN(C(=O)NNC(=O)c3c(C)nc4ccccn34)CC2)n1	767927490	MEKSWBITWDLXBC-UHFFFAOYSA-N	438.492	1.398	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)NC2CCN(C(=O)CCOC)CC2)cc1OC	767961190	NDNDBMZFHVVXHK-UHFFFAOYSA-N	436.509	1.456	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)[C@H]2CCN(C(=O)OCc3ccccc3)C2)c1	770133067	CHNXWUCRRZQCPO-KRWDZBQOSA-N	426.473	1.913	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)Nc1ccc(C[C@@H]2NC(=O)NC2=O)cc1	770633219	XFFKCKIFSQMDJM-BZNIZROVSA-N	445.863	1.711	50	20	IDGD	
CN(CCC1CCN(c2ccncc2)CC1)C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	770753095	CBMLXEJWXCETRK-UHFFFAOYSA-N	449.519	1.650	50	20	IDGD	
COc1ccc(N2C[C@H](C(=O)NNc3nc(O)c4cnn(C(C)(C)C)c4n3)CC2=O)cc1	770959511	WUWIIOPIMQYRFO-GFCCVEGCSA-N	439.476	1.792	50	20	IDGD	
CN1CCN(c2ccc(/C=C(/C#N)C(=O)Nc3ccc(S(N)(=O)=O)cc3)cc2)CC1	771518981	BNEZNCFOZRVXAL-VKAVYKQESA-N	425.514	1.631	50	20	IDGD	
CC(C)(C)OC(=O)N1CCSC[C@H]1CC(=O)NNC(=O)COc1ccc(C#N)cc1	772048585	WPVCIRFKCKRIJD-OAHLLOKOSA-N	434.518	1.827	50	20	IDGD	
CCCCC(=O)N1CSC[C@@H]1C(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772898802	SJCSFNTWZPGRKA-CQSZACIVSA-N	426.926	1.195	50	20	IDGD	
O=C(NN=Cc1ncc(C2OCCO2)s1)c1cccc(S(=O)(=O)N2CCCC2)c1	772991500	ULFQXZVTWWTEDC-UHFFFAOYSA-N	436.515	1.737	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cncc(NC(C)=O)c2)ccc1OCC(=O)NC(C)C	773082678	ZNEWFFCBXDFWQK-UHFFFAOYSA-N	443.460	1.027	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNS(=O)(=O)c1cnn(C2CCOCC2)c1	773251779	NVSOZJYYSSCIQY-LBPRGKRZSA-N	428.898	1.665	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(F)c(NC(=O)C(=O)NNc2cnc3ccccc3n2)c1	773718263	LUWQLGHMIWFBCS-UHFFFAOYSA-N	432.437	1.101	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNc2cnc3ccccc3n2)cc1C	773719200	YKYNXVHBZUVFKG-UHFFFAOYSA-N	428.474	1.782	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccc(NC(=O)C2CC2)nc1	774010766	ZITPSJIZCNGRRC-LLVKDONJSA-N	445.863	1.637	50	20	IDGD	
CCn1c(=O)c(C(=O)/C(C#N)=C\c2cc(C(=O)OC)co2)c(N)n(Cc2ccccc2)c1=O	774113577	DPDXJQWCWHQHHD-DHDCSXOGSA-N	448.435	1.830	50	20	IDGD	
CCCn1nc(C(=O)NNS(=O)(=O)c2cc(OC)ccc2O)c2ccccc2c1=O	775670171	UYVGTUHTLIXIRU-UHFFFAOYSA-N	432.458	1.144	50	20	IDGD	
CN(NC(=O)c1cn(-c2ccccc2)nn1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776213502	PPCVBKHQPZKZEA-UHFFFAOYSA-N	429.481	1.517	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNS(=O)(=O)c1cc(Cl)ccc1OC[C@@H]1CCOC1	777632834	MHEBTZBVDDJZCZ-GFCCVEGCSA-N	447.941	1.370	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)[C@H]2CCCN(C(=O)COc3ccccc3)C2)nc1C	778421444	ATVZXWWQWCSYJD-INIZCTEOSA-N	441.488	1.722	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)c2cn(C)nc2-c2cnn(CC)c2)cc1C	778577123	WPEFNQGRCADYLC-UHFFFAOYSA-N	444.517	1.854	50	20	IDGD	
NC(=O)Cc1ccc(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2Br)cc1	778754496	ZLGMOMNWWAPUDW-UHFFFAOYSA-N	436.222	1.467	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)C3(C)CCCCC3)CC2)cc1	780926569	MFAOGWKGKCIENE-UHFFFAOYSA-N	436.578	1.419	50	20	IDGD	
O=C(NNc1cnc2ccccc2n1)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(F)cc1	781025065	IQSRLJLEBNGZMR-DYVFJYSZSA-N	431.449	1.036	50	20	IDGD	
CC(C)c1cc(Br)ccc1NC(=O)C(=O)NN[C@]1(C)CCS(=O)(=O)C1	783426008	FMJWHDATTXKEMU-MRXNPFEDSA-N	432.340	1.709	50	20	IDGD	
COc1c(C)ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)c1C	784213119	LLQCBCRKEJMRKD-UHFFFAOYSA-N	432.502	1.835	50	20	IDGD	
Cc1nnnn1-c1cccc(NC(=O)C(=O)NNc2nc(-c3ccc(Cl)cc3)no2)c1	784799556	JOXVNLUYIKMVED-UHFFFAOYSA-N	439.823	1.756	50	20	IDGD	
CN(C)CCn1ccc(NC(=O)C(=O)NNc2ccc(Br)cc2Cl)n1	784840748	OWCDYPMVVLANPG-UHFFFAOYSA-N	429.706	1.942	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNc2cc(F)c(F)cc2F)cccc1C(=O)N1CCOCC1	784893259	PQOMPYYPJUKSEB-UHFFFAOYSA-N	436.390	1.967	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)Cc2ccccc2S(C)(=O)=O)n[nH]1	786483031	UXOIVMXPHWHUMJ-UHFFFAOYSA-N	428.470	1.493	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2coc(C3CCOCC3)n2)cc1OC	786729447	DPXNJFCRXMSEIE-UHFFFAOYSA-N	433.417	1.204	50	20	IDGD	
Cn1nc(-c2ccsc2)cc1NC(=O)C(=O)NNC(=O)CSc1ccccc1O	787550587	VQOOGWUJNVJBGA-UHFFFAOYSA-N	431.499	1.732	50	20	IDGD	
Cc1nn(C)c(N2CCN(C(=O)NNC(=O)c3cc4c(s3)CC[C@H](C)C4)CC2)c1C#N	788092531	JNSMSRJUUASDEN-ZDUSSCGKSA-N	441.561	1.963	50	20	IDGD	
NS(=O)(=O)c1ccccc1NNC(=O)C[C@@H]1Sc2ccc(Cl)cc2NC1=O	788230833	ZNRDTOSDGCSEQI-ZDUSSCGKSA-N	426.907	1.934	50	20	IDGD	
Cc1noc(-c2ccc(C(F)(F)F)cc2NC(=O)C(=O)NNC(=O)c2cc(C)[nH]n2)n1	789733028	GDNZWNSIBBMIFV-UHFFFAOYSA-N	437.338	1.495	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)NNC(=O)COc2ccccc2OC)c1C	790007414	SAQRHQRWZXJPNJ-LDADJPATSA-N	426.473	1.893	50	20	IDGD	
CCS(=O)(=O)c1ccc([C@H](C)NC(=O)NNC(=O)COc2ccccc2OC)cc1	790656680	PEGYUJAEWLQZMM-AWEZNQCLSA-N	435.502	1.959	50	20	IDGD	
C[C@H]1C[C@H](C(=O)NNc2nc3ccccn3n2)[C@H](C(=O)NNc2nc3ccccn3n2)C1	791259521	UUHNTELZDKMTOA-ZSOGYDGISA-N	434.464	1.021	50	20	IDGD	
CC(C)c1ccccc1NC(=S)NNC(=O)CCN1CCN(C(=O)[C@H]2CCCO2)CC1	792491024	PPUPZROZSACZNW-LJQANCHMSA-N	447.605	1.841	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)CC[S@](=O)c2ccc3c(c2)OCCO3)cc1	792803015	MQKBIVFPEHFZAR-PMERELPUSA-N	432.498	1.744	50	20	IDGD	
O=C(NNS(=O)(=O)c1cccc(OC(F)(F)F)c1F)[C@@H]1COc2ccccc2O1	793350857	RDMITSNKXJZHJW-LBPRGKRZSA-N	436.339	1.874	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)c1cccc(NN2C(=O)[C@@H]3CC=CC[C@H]3C2=O)c1	793539277	LTOFFUNWTFTEAB-WOJBJXKFSA-N	448.479	1.943	50	20	IDGD	
COC(=O)Cn1ncc(NC(=O)C(=O)NNc2ccc(F)cc2Br)c1C	796989046	MDCGZOMTYASWKC-UHFFFAOYSA-N	428.218	1.348	50	20	IDGD	
CC(C)(C)OC(=O)NCC[C@H]1CCCN(CC(=O)NNC(=O)c2ccc(C#N)cc2)C1	799357896	BVDSNMBXKUEPGG-QGZVFWFLSA-N	429.521	1.946	50	20	IDGD	
O=C(/C=C\c1ccccc1)NCCCNC(=O)NNC(=O)c1cc(Br)c[nH]1	799857487	PZNFOLZJAWCWFH-FPLPWBNLSA-N	434.294	1.941	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCCS(=O)(=O)CCc2ccccc2)cc1OC	799861385	QVJFZHIAIRZXAU-UHFFFAOYSA-N	435.502	1.305	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@@]1(C)CCN(C(=O)NNC(=O)CNC(=O)c2cccs2)C1	801005288	AJRFOPOLQJTFRO-LJQANCHMSA-N	439.538	1.455	50	20	IDGD	
COc1cnc2ccccc2c1C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	801900267	JWXMKPRJPGBWLB-GOSISDBHSA-N	437.408	1.388	50	20	IDGD	
O=C(CNC(=O)c1ccccc1I)NNC(=O)Nc1ccccc1	801988571	HTAFHINGIZAGPB-UHFFFAOYSA-N	438.225	1.874	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)NNC(=O)Nc2cc(OC)c(Cl)cc2OC)c(C)o1	802084513	YNKOLFOGFBTDNH-UHFFFAOYSA-N	446.869	1.633	50	20	IDGD	
O=C(NCCCN1C(=O)CNC1=O)NNc1ccc(-c2cccc(C(F)(F)F)c2)nn1	805091601	LVBOFNAQVGOLDV-UHFFFAOYSA-N	437.382	1.730	50	20	IDGD	
O=C(NCc1cccc(N2CCCS2(=O)=O)c1)NNc1ccc(-n2ccnc2)nn1	805289365	OFSDFHYBURFHCA-UHFFFAOYSA-N	428.478	1.029	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@@H](C)C(=O)NNC(=O)C(=O)Nc1cccc2c1CNC2=O	806974962	JBWTYSDWACZZNZ-LBPRGKRZSA-N	444.875	1.754	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2C)cc1N1CCOC1=O	807456242	COEFLIHAZQSAEK-UHFFFAOYSA-N	429.389	1.950	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)c1snnc1C1CC1	810594149	VJCQEEWLORGOCN-UHFFFAOYSA-N	434.953	1.648	50	20	IDGD	
CNS(=O)(=O)c1ccc(C)c(C(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)c1	811824885	ZDZGLPGONUMKLC-UHFFFAOYSA-N	439.877	1.175	50	20	IDGD	
Cc1ccc(S(=O)(=O)NC2CC2)cc1C(=O)OCC(=O)NNC(=O)c1cccs1	811841066	MXNUDQXJMCKYSD-UHFFFAOYSA-N	437.499	1.115	50	20	IDGD	
CCc1nc(C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)nn1-c1ccccc1F	812729447	PDPYSWDWMRDUCI-UHFFFAOYSA-N	432.481	1.976	50	20	IDGD	
CN(C)C(=O)COc1cccc(NC(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)c1	812924278	IYIMSJWNISRELB-UHFFFAOYSA-N	435.506	1.553	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)Nc1cc(Br)cn(C)c1=O	814660232	SKDBEASVUXOOMG-UHFFFAOYSA-N	444.311	1.547	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)Nc1nc(CC(F)(F)F)cs1	815564255	CXHJGZAMDSHGFF-NSHDSACASA-N	430.364	1.174	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCc2nncn2C1)C(=O)Nc1cc(F)ccc1SCC(F)F	815692137	JYHIDBYLQMWROZ-SECBINFHSA-N	442.423	1.123	50	20	IDGD	
O=C(CC1CC1)NNC(=O)c1cc(S(=O)(=O)N2CCCC2)ccc1Br	819126820	VHAWCZRTGUHOIF-UHFFFAOYSA-N	430.324	1.795	50	20	IDGD	
CCCCC(=O)N1CSC[C@@H]1C(=O)NNC(=O)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	819658889	QDLYMIXBAXEHBU-HUUCEWRRSA-N	442.582	1.873	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)CCC(C)C)N(S(C)(=O)=O)CC2	913161835	YGGOALVDVBFILH-INIZCTEOSA-N	441.550	1.536	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)N[C@H](CN2CCOCC2)c2ccc(C)cc2)cc1	916215455	GRDQQQSHACGOGK-OAQYLSRUSA-N	442.516	1.786	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)NCCCN2C[C@H](C)O[C@H](C)C2)c2ccccc2c1=O	916250036	UDYLXQDQMSEMMM-IYBDPMFKSA-N	444.536	1.421	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCCNC(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)cc1	916276558	BLLKMSQBABVMRG-CQSZACIVSA-N	438.481	1.210	50	20	IDGD	
Cc1cc(C)n(-c2ccc(CNC(=O)NNC(=O)C(=O)Nc3ccc(C)c(C)c3)cn2)n1	916419247	FEZQWAVTTZOSRV-UHFFFAOYSA-N	435.488	1.970	50	20	IDGD	
C[C@@H](Cc1cccs1)NC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	916509590	JJMGIGXPWMHWHM-AWEZNQCLSA-N	438.579	1.337	50	20	IDGD	
CC(C)(C)NS(=O)(=O)CCNC(=O)NNC(=O)c1ccc(Br)s1	916622389	NQIVLIBJFTWVGC-UHFFFAOYSA-N	427.346	1.173	50	20	IDGD	
O=C(CNC(=O)c1c[nH]c2ccccc2c1=O)NNC(=O)Cc1ccc2ccccc2c1	917197826	NVZNRBFBSWWBMV-UHFFFAOYSA-N	428.448	1.801	50	20	IDGD	
O=C(CNS(=O)(=O)c1c(F)cccc1F)NNC(=O)c1cc2ccccc2cc1O	917358390	USJYGDOITMLGKT-UHFFFAOYSA-N	435.408	1.563	50	20	IDGD	
O=C(CC12C[C@H]3C[C@@H](CC(Br)(C3)C1)C2)NNC(=O)N[C@H]1CCS(=O)(=O)C1	919886443	SXLQVMVWFKRCOU-LZULQBLISA-N	448.383	1.628	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)NCc2ccccc2CN2CCOCC2)cc1	919898802	MWYYKRCCPTZMHF-UHFFFAOYSA-N	426.517	1.991	50	20	IDGD	
COCCCNC(=O)NNC(=O)[C@H]1CCCN(C(=O)c2ccccc2OC(F)F)C1	920862293	WVYWUAJZUWXQPU-ZDUSSCGKSA-N	428.436	1.507	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2c(C)cnn2CC2CC2)cc1	1116565107	HWHRRALGAQIIIP-UHFFFAOYSA-N	434.522	1.383	50	20	IDGD	
COCCn1cc(NC(=O)NNC(=O)c2cc(Br)ccc2O)ccc1=O	1116585514	DDADHPIDRHVJJA-UHFFFAOYSA-N	425.239	1.429	50	20	IDGD	
CC(=O)N1CCN(C(=O)CCNC(=O)NNc2nc(Cl)c(Cl)cc2Cl)CC1	1318667388	LGFLBYPXGJVISR-UHFFFAOYSA-N	437.715	1.749	50	20	IDGD	
C[C@@H](COc1ccccc1F)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	1321958449	SNAGGVZIPHZNKV-ZDUSSCGKSA-N	438.481	1.488	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2cc(S(=O)(=O)N(C)C)ccc2N(C)C)cc1	1337765992	KFLJXIDVXWNHEQ-UHFFFAOYSA-N	435.506	1.478	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCCC(=O)N2CCN(c3ccccc3)CC2)cc1	1338090558	YMXQWZNIYXZJPU-UHFFFAOYSA-N	425.489	1.378	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2)c1noc2c1CCCC2	1777864306	XLMRBIVYWTVKOX-YYFZDKIDSA-N	425.913	1.281	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnc4ncccn34)C2)C1	1777930175	NCRVIICSPKVKQD-UGSOOPFHSA-N	436.310	1.204	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@]2(C1)CN(C(=O)c1ncn(-c3ccccc3)n1)CCO2	1779295276	DQIBZHCPMRUIIL-NRFANRHFSA-N	443.580	1.562	50	20	IDGD	
CC(C)=CCCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1	1779374109	ADJRUGOYKRXEDV-AUSIDOKSSA-N	443.548	1.559	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(OC)ccn3)C2)C1	1779539621	BHNVDZDOPHRUHF-KBXCAEBGSA-N	426.311	1.707	50	20	IDGD	
O=C(c1cccc(F)c1[N+](=O)[O-])N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1781772493	XYYMUAKEEUQVIF-BBRMVZONSA-N	448.220	1.868	50	20	IDGD	
O=C(c1cccc(F)c1[N+](=O)[O-])N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1781772498	XYYMUAKEEUQVIF-XJKSGUPXSA-N	448.220	1.868	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(Cl)Cl)C2)[C@@H](O)Cc1ccccc1	1781895742	GRAHMSOIJJOOPY-RZQQEMMASA-N	429.344	1.908	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)n1ccnc1)C2	1781997144	GGIFTCSFWVNNRH-LUXYFRNMSA-N	427.343	1.741	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(Cl)cnc1O)C2	1782168762	UKZSQXDZQRLEEO-SPYBWZPUSA-N	446.331	1.822	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(C(C)C)[nH]n1)C2	1782173451	BOHCKGOFSPNTDY-JNAXZKDPSA-N	426.945	1.914	50	20	IDGD	
CCOC(=O)C(C)(C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](Cl)COC)C1	1782178256	JQSRCPSGMCMNEF-STXHMFSFSA-N	432.945	1.343	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C13CC(C(=O)OC)(C1)C3)C2	1782179208	IOELDMHDBFMQOA-GJWIZFIESA-N	442.940	1.097	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H]3CC(c4ccccc4)=NN3)C2)C1	1782606667	OASHWOPSYYBMNR-VHFSOBRXSA-N	449.349	1.366	50	20	IDGD	
Cc1nn2cc(CC(=O)N3CCO[C@@]4(CCN(C(=O)C(Cl)Cl)C4)C3)nc2s1	1783943174	VNIWNNVOCUPTGY-INIZCTEOSA-N	432.333	1.275	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]2C1	1783974559	QAZBRSYOZSFPFJ-MOLYVOAJSA-N	440.176	1.781	50	20	IDGD	
Cn1c(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]3C2)cc2ccccc21	1784084528	WRJGGGJBJXZVLG-UHMOLFJZSA-N	433.936	1.300	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(C(N)=O)cc3)C2)C1	1784925708	WAEVMXJTVGUHBM-DJJJIMSYSA-N	438.322	1.260	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)COc3cc(C)ccc3C)[C@H]2C1	1785007205	JAQHNNZAXFHGKG-GNBUJSLZSA-N	438.952	1.916	50	20	IDGD	
CN(C)c1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CO[Si](C)(C)C)C[C@@H]32)nc1	1785749876	DZRXMWZNFPVCJC-IEZWGBDMSA-N	434.613	1.592	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3c(C)nc4ccccn34)[C@H]2C1	1787849268	UQOIVKRQDHKSBO-NXOAAHMSSA-N	434.924	1.490	50	20	IDGD	
Nc1nc(C(=O)NC2(c3ccc(NC(=O)c4cccc(B(O)O)c4)cc3)CCC2)cs1	1788143947	YTSKUHBFOCNZFS-UHFFFAOYSA-N	436.302	1.467	50	20	IDGD	
O=C1Nc2c(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)C(Cl)Cl)C[C@@H]43)cccc2C1=O	1788436837	OQNABEZUFHDXRT-XDTLVQLUSA-N	440.283	1.218	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C#CC3(O)CCCCC3)[C@H]2C1	1788637755	WUKHWCKRZBMCMT-OGNFBWPZSA-N	445.387	1.901	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc([N+](=O)[O-])[nH]3)[C@H]2C1	1789390467	GJVLHSLGJZZZHO-BTIUKSQHSA-N	433.292	1.753	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3ON=C(c4ccccc4)O3)C[C@@H]21	1789863358	OQYNVNCGCSSMKX-QYRAFCHESA-N	435.908	1.718	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CC(F)(F)C(=O)O)C[C@@H]21	1789865975	KBGPGWZTLSNVEH-USXUVBGUSA-N	431.263	1.312	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]2C1	1789924803	DUEFALKESPZIQB-NMUGVGKYSA-N	430.112	1.440	50	20	IDGD	
C[C@@H](Oc1ccccn1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]2C1	1789926925	LIGQGCJJDOOBQL-XSEXMBABSA-N	444.301	1.519	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CCCN(C)C3)C[C@@H]21	1790962796	BCHJPLBWIWWQMY-WOYTXXSLSA-N	430.387	1.481	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(=O)c4ccccc4o3)C[C@@H]21	1791249708	OZYMUBZBRFYSPL-NTNQKNOYSA-N	448.903	1.640	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC1(c2ccc(NC(=O)CN(CCO)CCO)cc2)CCC1	1791328388	JGZKKMDSQNVVJS-IBGZPJMESA-N	446.375	1.643	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCN1CCCCC1)C2	1792868061	RZBJUHXQDHQGDR-CUSZFKRNSA-N	430.387	1.483	50	20	IDGD	
CC(=O)OC[C@H](OC(C)=O)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](C)CBr	1792986572	AIKOHZPNAVQCNI-IRHMCKRBSA-N	447.326	1.150	50	20	IDGD	
CN1Cc2ccccc2C[C@@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CO[Si](C)(C)C)C2	1793829415	QQHKZYSYTRFJMR-XAPVIXHLSA-N	445.636	1.484	50	20	IDGD	
C[C@@H]1C[C@@]1(C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1793879053	CWUASWKSYAVJMF-PQKAOMOJSA-N	443.972	1.754	50	20	IDGD	
Cc1nn[nH]c1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1794142798	RUXWTFGBUXUSMT-CRWXNKLISA-N	440.932	1.497	50	20	IDGD	
C=CCCc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)C(Cl)Cl)C3)c(O)n1	1794490924	NZOPGOJJOSVHQH-JJLQDPRZSA-N	428.316	1.913	50	20	IDGD	
COc1ncc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Br)C3)cc1C	1794985610	NGHYGILJUFQWDT-CRWXNKLISA-N	430.274	1.292	50	20	IDGD	
O=C1CSc2cc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@@H](F)Cl)C4)ccc2N1	1796291667	BYPPQCABYNAWCI-OXUXUCFPSA-N	427.885	1.468	50	20	IDGD	
Cc1cc(NC(=O)CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](C)Br)C3)no1	1796870770	RIFPUGKMJOINLP-FVCCEPFGSA-N	427.299	1.733	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CCN(C(=O)OC(C)(C)C)C1	1797221956	MCVDGKMMHOVKLX-SIRPWMCASA-N	443.972	1.850	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C=N/O[C@@H]1CCCCO1	1797815260	LXDPIBNXXGHCJR-BNDVCMTDSA-N	436.336	1.341	50	20	IDGD	
Cc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCBr)C3)nn1C(F)F	1798674709	GFEPDIGAIKMVSE-GNXNZQSNSA-N	435.269	1.575	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(OC)cc(OC)c1	1798899303	SNUYVHVUMIGVEU-DACLVMHWSA-N	426.897	1.161	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc([N+](=O)[O-])ccc1N(C)C)C2	1799272266	KKFGTNLTODVVHS-ZDFLXESQSA-N	438.912	1.881	50	20	IDGD	
C[C@H](NC(=O)c1cnccn1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@](C)(Cl)CCl	1800080904	SVJYPZYTTCYWBN-NEXRYAKISA-N	442.347	1.469	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CC(c2ccccc2)=NN1	1800154636	DEEWPYYGKSHNKW-SHJAMOMRSA-N	444.608	1.194	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1Cc2ccccc2N1	1800318594	JPRZGUGALAJWKT-ACSCVQKFSA-N	426.344	1.849	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(C(C)(C)C)n[nH]1)C2	1800760217	JBWTXQAJOMCDLA-MCYUEQNJSA-N	427.343	1.694	50	20	IDGD	
O=C(/C=C/c1ccc(O)cc1Cl)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2	1800900945	VFTLQCCJLKYAJH-SUYSFODASA-N	429.300	1.248	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CCc3ccccc3[C@@H]1O)C2	1800970381	DCHGQZFIOVFKQD-YSDUZXLGSA-N	436.936	1.126	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1c[nH]c3cc(OC)ccc13)C2	1800971451	ZFUSAKHPXBSVDY-QKSJRXBFSA-N	449.935	1.562	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C[C@H]1COc3ccccc3O1)C2)C(Cl)Cl	1801015350	JPOWKPNBIXXOAP-LKQDWFRTSA-N	429.300	1.610	50	20	IDGD	
COC(=O)c1ccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C(Cl)Cl)cc1	1801018083	KFDRZCBEKKJWBR-MIFYACCESA-N	429.300	1.409	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)C1=CCCS1	1803631960	BOYLYKNZVUBGTK-YLJYHZDGSA-N	437.330	1.102	50	20	IDGD	
COc1c(Cl)cccc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc(B(O)O)c1)C2	1803757335	VNFUNNMIZXDWLK-BJWYYQGGSA-N	442.708	1.594	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)CS(C)(=O)=O)[C@@H]1c1cccnc1	1808243383	DZRBMFCZHGHVJW-QSPRXWTASA-N	429.970	1.786	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)c3ccoc3Cl)CC2)C1	1809969603	KQAZYGCVTWULSS-UHFFFAOYSA-N	430.697	1.771	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)[C@H]3[C@H]4SC=C[C@H]43)CC2)C1	1809980630	YMDAWMHKOJBOKW-OTWHNJEPSA-N	426.347	1.086	50	20	IDGD	
CS(=O)(=O)c1ccc(C(=O)N2CCC3(CCCN(C(=O)[C@H](F)Cl)C3)CC2)nc1	1810900170	YEPRYPHCQMLOFZ-HNNXBMFYSA-N	431.917	1.864	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2ccccc2C(N)=O)[C@H]1c1cccnc1	1811289063	FRMKQTANOLQCCB-ZYSHUDEJSA-N	444.919	1.754	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1)c1c[nH]c(=O)cn1	1811452186	NJHMGJSGIBILLS-DYVFJYSZSA-N	434.294	1.270	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2cnc(OC)cn2)[C@H]1c1cccnc1	1813029123	CBVVARPNRFGJKA-MPGHIAIKSA-N	433.896	1.454	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)ccn1	1813073253	KJCZDLLBUHPVRR-DENIHFKCSA-N	438.532	1.478	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)Cn2cc(C)c(O)nc2=O)[C@H]1c1cccnc1	1814040489	MTTIETCADCLLOK-XYJFISCASA-N	447.923	1.376	50	20	IDGD	
N[C@H](C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](F)Br)CC2)c1ccccn1	1815018454	DTKXYEMKICTJQI-AQUOVQTQSA-N	442.314	1.841	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@H]1C[C@@H]1C1CC1)CC2)c1cccc(B(O)O)c1	1815350428	VQCBRSWKIDFBRI-OAGGEKHMSA-N	425.319	1.095	50	20	IDGD	
O=C(CCc1ccc[nH]1)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2	1815468796	KNWZIUFAHAFBPM-MRXNPFEDSA-N	438.318	1.010	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](F)Br)CC2)c1nc[nH]c1[N+](=O)[O-]	1817203213	RWXDFHBYPLJGEC-SSDLBLMSSA-N	447.246	1.691	50	20	IDGD	
CC(C)CNC(=O)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](C)CBr)CC2	1817319931	CNOHJWAXSYAGHO-QWRGUYRKSA-N	445.383	1.858	50	20	IDGD	
O=C(CCc1ccc[nH]1)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1817529643	FWBAKRLVMASRLH-IBGZPJMESA-N	435.293	1.356	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3c(C)nc4ncccn34)sc2C1	1818395839	MGBDMGKMYYZTDL-RYUDHWBXSA-N	448.936	1.974	50	20	IDGD	
Cc1cc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)ccn1	1819752107	HXRAZIFYRZIHRY-IBGZPJMESA-N	433.277	1.413	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCN2CCN(C)CC2)[nH]n1	1822368326	HHVSJLZFASYTNY-RDJZCZTQSA-N	440.976	1.293	50	20	IDGD	
Cn1cccc(C(=O)N[C@H]2CCc3nc(NC(=O)[C@H](F)Br)sc3C2)c1=O	1822999485	SERZLPUSXPSNKD-UFBFGSQYSA-N	443.298	1.758	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CN2C(=O)CNC2=O)CC1	1824904974	VUBJTPSKJVNBBA-LIRRHRJNSA-N	447.363	1.394	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](N)c1ccccn1)CC2	1825640617	BSUFLFOUVPMGCN-RBZYPMLTSA-N	438.351	1.934	50	20	IDGD	
CC(C)c1nc(C(=O)N[C@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)co1	1826080347	DHVAJWDPBOYLEP-LBPRGKRZSA-N	448.549	1.853	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1[nH]cc3c1CCC3)CC2	1826088375	XBPBLTOVBJXUOF-CYBMUJFWSA-N	444.561	1.559	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@]1(C)CC1(F)F)CC2	1826092052	KAZUKVDXNGQAIT-DYZYQPBXSA-N	429.493	1.473	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCC([C@H]2CCCCN2C(=O)CC[C@H](N)C(N)=O)CC1	1826935462	QGGIZAIJRZDDQW-KHYOSLBOSA-N	435.396	1.435	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC([C@H]2CCCCN2C(=O)Cn2cnnn2)CC1	1827193216	QWOFMFAENDWQKB-DZGCQCFKSA-N	427.347	1.324	50	20	IDGD	
Cc1cc(C)nc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)c1	1827317178	LGKRCDLLUAFNTP-HSZRJFAPSA-N	449.360	1.925	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1C1CCN(C(=O)C2(C)COC2)CC1	1827677677	YAQZXLMBGDFWRB-PTFSYIGCSA-N	443.548	1.777	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](O)CCl)CC2	1827968979	DXUPOBSJMUADAX-JQWIXIFHSA-N	446.957	1.570	50	20	IDGD	
CC(=O)C(C)(C)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1	1828923384	HNIKBHAHCGROIH-LJQANCHMSA-N	443.548	1.534	50	20	IDGD	
CC(C)(O)CC(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1	1828925436	LTAQHWXFOBJIFY-GOSISDBHSA-N	431.537	1.079	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccnn2)CC1	1829210066	CFNGVHKWLVEPDA-IBGZPJMESA-N	437.504	1.022	50	20	IDGD	
CC(C)[C@H]1CC[C@H](C(=O)N2CCOC[C@]3(CN(C(=O)[C@H](O)CCl)CCO3)C2)CC1	1830736747	WOPYDCPBUWVSMW-NEYJZJCJSA-N	430.973	1.505	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3c(C)c[nH]c3C)CCO2)C1	1830903693	KKAGKNIGBRIQKM-WIYYLYMNSA-N	441.956	1.274	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4nonc4c3)C2)C1	1831645621	CTGCDBONIWQUTL-FOIQADDNSA-N	436.896	1.700	50	20	IDGD	
CC(=O)C[C@H](C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1	1831798433	BVNRTTBNYLTYJG-KKSFZXQISA-N	428.338	1.215	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)Cn2cc(C)c(O)nc2=O)CC1	1832776688	XENWYKGOZLHDHS-DLBZAZTESA-N	438.956	1.894	50	20	IDGD	
CC(C)(C)n1ccc(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)n1	1833996105	YXWFYJLOCALYGL-SFHVURJKSA-N	439.988	1.423	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3cc(O)no3)CC2)CC1	1835977318	GSQWIMFGKUHUEK-AWEZNQCLSA-N	443.342	1.739	50	20	IDGD	
Cc1ccc2oc(C(=O)N3CCO[C@@]4(COCCN(C(=O)[C@@H](F)Cl)C4)C3)cc2n1	1836264913	MTEVOTPZPDGKTN-APWZRJJASA-N	425.844	1.741	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC1CCN(C2CCN(C(=O)c3cc(CO)on3)CC2)CC1	1836399810	NCGPMYPINHPYBI-LJQANCHMSA-N	447.363	1.588	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC1CCN(C2CCN(C(=O)c3ccnnc3O)CC2)CC1	1836399934	QWMZMNIWIPIWKE-LJQANCHMSA-N	444.363	1.604	50	20	IDGD	
Cc1ccc(OCC(=O)N2CCC(OC3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)cc1	1836716860	VSZDDNFBLOVCAF-FQEVSTJZSA-N	438.952	1.972	50	20	IDGD	
Cc1ccn2c(C(=O)N3CCC(OC4CCN(C(=O)[C@H](O)CCl)CC4)CC3)cnc2c1	1836719365	QHGPBVLLKUAGES-LJQANCHMSA-N	448.951	1.855	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](C)Br)CC2)CC1	1838069568	WMOARLAUSOZRKJ-DOMZBBRYSA-N	447.374	1.215	50	20	IDGD	
O=C(Cc1ccc2ncnn2c1)N1CCC(OC2CCN(C(=O)[C@H](F)Cl)CC2)CC1	1838084249	RZKKEPYVOCDHSS-IBGZPJMESA-N	437.903	1.805	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)c(O)c1	1838890028	CXKLLYFPKKAGQS-GOSISDBHSA-N	433.288	1.275	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccn(-c4ccccc4)n3)C2)C1	1839145662	BUJWIGJIPOGPPA-XMSQKQJNSA-N	446.935	1.960	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc4cccnn4c3)CCO2)C1	1839559074	MPRALRCXYWJJDX-NRFANRHFSA-N	434.924	1.669	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)OC(=O)OCC)CCO2	1839681622	UXXYLCLPZJIVBP-YZVOILCLSA-N	434.917	1.412	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)CC(C)=O)C2)C1	1839966954	VBKOHNBTXZDPDU-QIIPPGSGSA-N	433.343	1.232	50	20	IDGD	
Cc1ncsc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)Br)CCO2	1840030996	BXSYUUOWFVWKHJ-ZBEGNZNMSA-N	432.340	1.305	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3ccc[nH]3)C2)C1	1840031769	BVHRHTWYRZMYAS-KBXCAEBGSA-N	428.327	1.187	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(F)c(C)c3)C2)C1	1840155057	OHWSJJDWGRVBKG-OXQOHEQNSA-N	428.888	1.458	50	20	IDGD	
COc1cc(F)ccc1CC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1840934093	CZARCIBZXYGPRR-IEBWSBKVSA-N	432.851	1.368	50	20	IDGD	
Cc1cccc(C)c1SCC(=O)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843011466	GSEZDIKNVCJIMN-UHFFFAOYSA-N	438.358	1.593	50	20	IDGD	
Cc1ccc(NCCC(=O)N2CCCC23CN(C(=O)c2ccc(B(O)O)cc2)C3)c(C)c1	1844306665	ZWAGWMMNBJRWTB-UHFFFAOYSA-N	435.333	1.302	50	20	IDGD	
C#CCCCCC(=O)N1CC2(CCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)C1	1845039469	RTTLZMJPNPTWMN-UHFFFAOYSA-N	439.560	1.730	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@H]1CN(C(=O)OC(C)(C)C)CCO1)C2	1845168629	QEQREPJFAJWVTE-LSDHHAIUSA-N	429.945	1.843	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2ccc3ccnn3c2)C1	1845662230	HNULGIARWSGZAN-MFKUBSTISA-N	433.472	1.285	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CCCC12CN(C(=O)[C@@H](C)CBr)C2	1846337996	LRYLYOLEJYDQAN-SOUVJXGZSA-N	427.339	1.976	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CC(N)=O)C(=O)N1CCCC12CN(C(=O)C(C)(C)CCl)C2	1847090648	YUMFAVASSSJHRE-ZDUSSCGKSA-N	444.960	1.224	50	20	IDGD	
CC(C)NCCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1848099645	QYXKUWFPZMZPMH-JYJNAYRXSA-N	430.977	1.708	50	20	IDGD	
COc1cc(CCC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc(OC)c1OC	10159125	WOCLHJLMOBGMOC-UHFFFAOYSA-N	440.456	1.998	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNS(=O)(=O)c2cccc(C(=O)O)c2)cc1	13346217	GQJMCHFSWKDZSQ-UHFFFAOYSA-N	447.498	1.429	50	20	IDGD	
CC(C)n1nc(C(=O)NNS(=O)(=O)c2ccc([N+](=O)[O-])cc2)c2ccccc2c1=O	16095345	UQHCCGFHGXNEHK-UHFFFAOYSA-N	431.430	1.509	50	20	IDGD	
CS(=O)(=O)N1CCc2cc(C(=O)NNC(=O)c3cc(-c4ccccc4)on3)ccc21	27262137	SZXZIVUGOVXELY-UHFFFAOYSA-N	426.454	1.739	50	20	IDGD	
CCn1c(=O)[nH]c2cc(C(=O)NNC(=O)c3ccc(Br)cc3)ccc2c1=O	97464983	ICSRCVMERLMUAW-UHFFFAOYSA-N	431.246	1.547	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)c2ccccc2c1=O	115077161	UYIUHHOKPZJMTO-UHFFFAOYSA-N	433.384	1.102	50	20	IDGD	
CC(C)COC[C@H](NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)c1ccco1	726259664	IUVPRRGRBBHONC-INIZCTEOSA-N	427.461	1.884	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)c1nccnc1C(=O)NCc1ccc(F)cc1	726524138	QUUCQTRBTTYLIX-UHFFFAOYSA-N	447.430	1.577	50	20	IDGD	
CC(=O)c1cccc(OCCCC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1	728844896	AFJWIUMCRQUQPR-UHFFFAOYSA-N	425.489	1.902	50	20	IDGD	
COCCCNC(=O)[C@H](C)N1CCN(S(=O)(=O)c2ccc(CCCl)cc2)CC1	728935988	JKRRWWUPLQWGPB-INIZCTEOSA-N	431.986	1.315	50	20	IDGD	
CN(CCCNC(=O)NNC(=O)c1ccc(Br)cc1Cl)S(C)(=O)=O	728950082	ZDCZLURGTFNLNG-UHFFFAOYSA-N	441.735	1.328	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)Cc2c(C)nc3cc(O)nn3c2C)cc1OC	729281953	HXJDTVBICFDUCJ-UHFFFAOYSA-N	427.461	1.853	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CN(C)CC(=O)Nc2ccc(Br)cn2)cc1	729473325	XCVDKMUKRLDXPT-UHFFFAOYSA-N	434.294	1.484	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)CSc2nnnn2CC(F)(F)F)c1C	729966669	VXYLRGVNMWRPKE-LLVKDONJSA-N	432.428	1.559	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Cc2cc[nH]n2)cc1S(=O)(=O)N1C[C@@H](C)C[C@H](C)C1	730103002	UPNUIHLUDIXJSK-KBPBESRZSA-N	449.533	1.089	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H]2CCN(c3ccc(F)cc3F)C2)c1	730136320	GGLFTLDUFHHNRZ-CQSZACIVSA-N	438.456	1.591	50	20	IDGD	
CN(C)C(=O)CN1CCC(NC(=O)NNC(=O)c2cc3c(s2)CCCCCC3)CC1	731762312	OOHQUNYWNSZERI-UHFFFAOYSA-N	435.594	1.904	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)N1CCC[C@@H](C(=O)Nc2ccc(Br)cn2)C1	731849085	RIVFVQPETPRUBT-NWDGAFQWSA-N	426.315	1.441	50	20	IDGD	
CSCC[C@H](C(=O)NNc1nc(-c2ccncc2)no1)N1C(=O)[C@H]2CCCC[C@H]2C1=O	732065417	FNCYIEPXNLDYCM-QLFBSQMISA-N	444.517	1.872	50	20	IDGD	
COc1ccc(N2C[C@@H](C(=O)NNC(=O)c3cnn(-c4ccccc4)c3)CC2=O)c(OC)c1	733106965	RJWBRJHPQXOBFW-HNNXBMFYSA-N	449.467	1.704	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)c1cnc2c(c1)c(O)nc(=O)n2C1CC1	733169841	BWJPFUHJXSHXGT-UHFFFAOYSA-N	431.412	1.093	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)CNC(=O)c1ccc2c(c1)OCO2	734252691	BMABWUKLFNMMGG-UHFFFAOYSA-N	448.501	1.365	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)N[C@@H](C)CN1CCN(c2ccccn2)CC1	735586416	LSIURQIRBUQDSJ-KRWDZBQOSA-N	442.520	1.010	50	20	IDGD	
O=C(NC[C@@H](O)c1cc(Cl)cc(Cl)c1)NNC(=O)c1ccc(-n2cnnn2)cc1	735678315	MDCGIPITRNZTLH-OAHLLOKOSA-N	436.259	1.647	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)Cn2c(=O)n(CC)c3ccccc32)cc1C	736769473	UJLYQPRGTPLDMA-UHFFFAOYSA-N	444.513	1.760	50	20	IDGD	
CSC[C@@H](C)NC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	737060988	DTLUQKGVXAEDSS-CQSZACIVSA-N	436.559	1.861	50	20	IDGD	
CC(C)[C@H](NC1CCOCC1)C(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12	740748858	BEYJLYXXYGHSPJ-SFHVURJKSA-N	429.521	1.532	50	20	IDGD	
CC(C)C(=O)N(C)Cc1ccc(C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1	741535822	RSCNVCYYAQJTTN-UHFFFAOYSA-N	431.514	1.779	50	20	IDGD	
Cc1c(/C=C(\C#N)C(=O)Nc2cnn(CC(=O)N3C[C@H](C)O[C@H](C)C3)c2)cc(C#N)n1C	741726074	JUMNFPNFWMZWEJ-QWEQOLLXSA-N	435.488	1.583	50	20	IDGD	
CC(C)(C)OC(=O)N(CC(=O)NNC(=O)c1cc(Br)c[nH]1)C[C@@H]1CCCO1	742036502	LOSSIIYZJKNPQM-LBPRGKRZSA-N	445.314	1.954	50	20	IDGD	
CN(C)[C@@H](CNC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)c1cccs1	742710925	QGWSPVULHRNWKH-AWEZNQCLSA-N	425.536	1.790	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc2oc(=O)[nH]c2cc1Cl)c1cccc(OC(F)F)c1	743257315	JIOMGYSEYGPLLL-UHFFFAOYSA-N	433.776	1.999	50	20	IDGD	
O=C(COc1ccc(F)cc1F)NNc1ccccc1S(=O)(=O)N1CCOCC1	744621147	SCQLIZGYTCTILN-UHFFFAOYSA-N	427.429	1.508	50	20	IDGD	
COc1ccc(Br)c(C(=O)OCC(=O)NNC(=O)c2ccc(C)cc2)c1N	745289811	VKOMXGMWTATALX-UHFFFAOYSA-N	436.262	1.966	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NCCCNC(=O)c2ccccc2)cc1	745794234	ZXYLUTZCSIGLCF-UHFFFAOYSA-N	433.490	1.246	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)[C@H](C)Oc1ccc2ccccc2c1)CN1CCN(C)CC1	745861188	AAWNIKIIEICMOX-ROUUACIJSA-N	427.549	1.821	50	20	IDGD	
CCc1cnc(CNC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)s1	745904861	RXMMSLNYDQFRLR-UHFFFAOYSA-N	425.536	1.165	50	20	IDGD	
CCN(CC)CCSCC(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	746333658	XHAGVXYUWMXDKC-UHFFFAOYSA-N	430.596	1.226	50	20	IDGD	
N#C/C(=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)OCC(=O)N1CCC1	746899128	HYAFMKAWKMXVSN-XNTDXEJSSA-N	441.875	1.761	50	20	IDGD	
COCCS(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=O)Cc2ccncc2)c1Cl	747324933	SIILPTIKJGCOSV-UHFFFAOYSA-N	446.312	1.812	50	20	IDGD	
O=C(NCc1ccon1)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	747597989	ZIDRJCZQRKUVIP-UHFFFAOYSA-N	429.458	1.297	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)CS[C@@H]1CCS(=O)(=O)C1	748594694	WPRBJRPGTJXNBT-GFCCVEGCSA-N	435.593	1.127	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)CCOc2ccc(C(N)=O)cc2)CC1	748713648	HBECLIQQEBACQE-UHFFFAOYSA-N	449.508	1.284	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)[C@@H]2CCCN2S(=O)(=O)c2cccs2)cc1	749262670	YERPSWDSRPKTPW-HNNXBMFYSA-N	438.531	1.169	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)[C@@]1(C)CCCN(C(=O)OC(C)(C)C)C1	751970660	DZHUBPSRNVWPBF-FQEVSTJZSA-N	443.545	1.879	50	20	IDGD	
O=C(NCCn1cccc1)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	753050798	VNTRODCXMQQEFD-UHFFFAOYSA-N	433.515	1.995	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)C[C@@](C)(O)C2CC2)c1	755382453	QJOWEQUDZCXVSN-OAQYLSRUSA-N	447.513	1.808	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)N[C@H]2CCN(c3c(F)cccc3F)C2=O)nc2ccccc21	756213331	UBNKOCDPGJPZLQ-HNNXBMFYSA-N	442.426	1.530	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)ccc1C(N)=O	756400347	JZRKRIDHWHOXIZ-UHFFFAOYSA-N	445.501	1.345	50	20	IDGD	
Cc1ccc(Cc2nnc(NC(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)s2)cc1	756483426	NPDFLPYXOAUPEZ-UHFFFAOYSA-N	435.473	1.880	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2ccc(C(=O)NNc3ccc(C(N)=O)nn3)cc2)cc1	757402951	QYTZGPBOPYZFES-UHFFFAOYSA-N	426.458	1.442	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)CN1C(=O)NC2(C[C@H](C)C[C@@H](C)C2)C1=O	757629183	QBBRIHWVEQTSTB-HUUCEWRRSA-N	430.505	1.522	50	20	IDGD	
CC(C)Oc1ccc(Br)cc1NC(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1	757739639	OUGOCSGKPDAGTJ-JTQLQIEISA-N	434.312	1.824	50	20	IDGD	
CC(=O)[C@@H]1C[C@H](CC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)C1(C)C	759378589	IPMISZHGKDOPFE-AEFFLSMTSA-N	435.546	1.874	50	20	IDGD	
CNc1nnc(CC(=O)NNC(=O)[C@@H]2Cc3ccccc3CN2Cc2ccccc2)s1	759681906	FWDQFHHKJSZXEN-SFHVURJKSA-N	436.541	1.897	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)NCc2cnn(C)c2C)cc1	759763327	GSQBCYMEWWOPRT-YVLHZVERSA-N	447.499	1.699	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)N=c2cc[nH]cc2I)c1	760029992	QLKFDCMPMQSTDN-UHFFFAOYSA-N	440.241	1.957	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N(CC)CC)cc1NC(=O)C(=O)NNC(=O)C(C)(C)C	761063864	MTMGKWVRWLZADZ-UHFFFAOYSA-N	442.538	1.248	50	20	IDGD	
O=C(NNC(=O)c1ccccc1Br)C(=O)Nc1ccn(Cc2ccccn2)n1	763483209	PDKGCQAAAFYJCZ-UHFFFAOYSA-N	443.261	1.489	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1OC(C)C	763573604	UBERAJKCQYNFEU-GOSISDBHSA-N	429.429	1.408	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccc(-c2noc(C)n2)c1	763663255	PLRSIAGUIAINQO-UHFFFAOYSA-N	425.401	1.219	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)C(=O)Nc1ccc(-n2cccn2)c(Cl)c1	763683209	XGCMKIBBRSXSRG-UHFFFAOYSA-N	431.811	1.830	50	20	IDGD	
C[C@@H]1Oc2ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc3ccccc3F)cc2NC1=O	763863876	DUOGSQPTSKASRB-WDEREUQCSA-N	430.392	1.099	50	20	IDGD	
CCNC(=O)N1CCc2ccc(NC(=O)C(=O)NNC(=O)Cc3c[nH]c4ccccc34)cc21	763865989	YVTUZDOMXLZIGE-UHFFFAOYSA-N	448.483	1.589	50	20	IDGD	
Cc1cnc(O)n1-c1ccccc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccc(F)cc1	763873047	PXNREPPTJXRQGE-ZDUSSCGKSA-N	441.419	1.579	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(N3CCOC3=O)c2)cc1OC	763900268	CEYMGWMKMCPVGS-UHFFFAOYSA-N	442.428	1.450	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccccc2-n2cncn2)cc1OC	763912365	XTNBDQPMLTUAOD-UHFFFAOYSA-N	438.444	1.464	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccc(S(=O)(=O)C2CCCC2)cc1	763919714	STGIIVFFNFQDDB-UHFFFAOYSA-N	447.488	1.871	50	20	IDGD	
COc1ccc(C(=O)N2CCCCCC2)cc1NC(=O)C(=O)NNC(=O)c1cccn1C	763992879	KDYSSRQSEQREMT-UHFFFAOYSA-N	441.488	1.450	50	20	IDGD	
Cc1nnnn1-c1cccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)on2)c1	764004506	YAIZAKNEERSJOM-UHFFFAOYSA-N	432.400	1.025	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(C3CCCC3)nn2C)o1	764138308	BBQQSGKGPHOCGT-UHFFFAOYSA-N	430.509	1.912	50	20	IDGD	
CN(c1ccccc1)S(=O)(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2ccoc2)c1	764159742	FPVKRGJREMMPPK-UHFFFAOYSA-N	442.453	1.504	50	20	IDGD	
O=C(NNC(=O)c1c(Cl)cccc1Cl)C(=O)Nc1cnn(C[C@@H]2CCCO2)c1	764222083	VTAFYDGSQRVNAC-NSHDSACASA-N	426.260	1.769	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)C(=O)Nc1ccc(NC(=O)[C@H]2CCCO2)cc1	764277832	IKAIKGSYTBVAIF-GOSISDBHSA-N	440.456	1.228	50	20	IDGD	
COC(=O)c1cc2cc(NC(=O)C(=O)NNC(=O)COc3ccccc3O)ccc2o1	764278109	RFIUIPCQPGWBGD-UHFFFAOYSA-N	427.369	1.090	50	20	IDGD	
COCC(=O)NNC(=O)C(=O)Nc1ccc(NC(=O)c2ccccc2)cc1C(F)(F)F	764300006	REVDDQQMXMDAMZ-UHFFFAOYSA-N	438.362	1.690	50	20	IDGD	
CCOCC(=O)NNC(=O)C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(Cl)c1	764317787	NTYXWYIMPGEUAZ-UHFFFAOYSA-N	430.848	1.913	50	20	IDGD	
CC(C)(C)NC(=O)c1ccccc1NC(=O)C(=O)NNC(=O)c1cnn(-c2ccccc2)c1	764350250	BYQQJALGVSOTQE-UHFFFAOYSA-N	448.483	1.800	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)C(=O)Nc1cccc(Cl)c1-n1cccn1	764366691	OZPUVXQASFMFFY-UHFFFAOYSA-N	427.848	1.828	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)C(=O)Nc1ccc(F)cc1I	764385564	BOFALRKSSYJQPE-UHFFFAOYSA-N	442.188	1.533	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)C(=O)Nc1ccc(OCC(F)(F)F)nc1	764394890	WJQLLIDVLKGCTB-UHFFFAOYSA-N	444.391	1.607	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1cc(C(C)(C)C)nn1-c1ccc(C)cc1	764398571	UHCAWFRLITVJDR-OAHLLOKOSA-N	445.520	1.616	50	20	IDGD	
Cc1nnc(-c2cccc(NC(=O)C(=O)NNC(=O)CSc3ccccc3O)c2)n1C	764402094	XRUVQHWCNNNRLG-UHFFFAOYSA-N	440.485	1.374	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)cc1	765126134	ISZJSISJLRSFSG-UHFFFAOYSA-N	444.557	1.325	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)c1ccc(F)cc1[N+](=O)[O-]	765756139	XIOIKNYVXMMVCZ-UHFFFAOYSA-N	449.870	1.966	50	20	IDGD	
COc1cc(C#N)ccc1NC(=O)C(=O)NNC(=O)c1ccc(F)cc1Br	766260914	XGHPVIYEDQXPDH-UHFFFAOYSA-N	435.209	1.868	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2nccnc2OC)cc1NC(=O)OC(C)(C)C	766261444	ZPDGBXULBBFICA-UHFFFAOYSA-N	432.437	1.923	50	20	IDGD	
N#Cc1cc(F)c(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)c(F)c1	766636743	UDVQOBKYSODZKH-UHFFFAOYSA-N	427.411	1.055	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)/C=C/c3ccc(I)o3)nc21	770970781	DNBMGQMENBDAEE-HWKANZROSA-N	426.174	1.423	50	20	IDGD	
O=C(Nc1cccc(C(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)c1)NC1CC1	772897658	KEADAJMOBRICCY-UHFFFAOYSA-N	429.864	1.701	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)CN1C(=O)COc2ccc([N+](=O)[O-])cc21	772998241	WZNOLOGXJNTEGF-NSHDSACASA-N	448.819	1.589	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)CCn2cnc3sccc3c2=O)C1	773422755	YDWXINKQVLDVCS-ZDUSSCGKSA-N	449.533	1.643	50	20	IDGD	
CCCNC(=O)[C@@H]1CN(C(=O)C(=O)NNc2nccnc2C(C)C)c2ccccc2O1	773990601	BAQHAJBNHXREEE-INIZCTEOSA-N	426.477	1.364	50	20	IDGD	
NS(=O)(=O)c1cccc(N2C[C@H](C(=O)NNc3ccc(C(F)(F)F)cn3)CC2=O)c1	775254876	HGNAKXNOYAAQHV-SNVBAGLBSA-N	443.407	1.244	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)Nc1ccc(C[C@H]2NC(=O)NC2=O)cc1	775708105	NFFHCFUDSMWUQU-QGZVFWFLSA-N	433.428	1.089	50	20	IDGD	
O=C(NCc1nc(C(F)(F)F)n[nH]1)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1	776257423	WHSWYHLJEMTWAF-UHFFFAOYSA-N	432.306	1.943	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)NCCCN2C(=O)NC3(CCCCC3)C2=O)c1	776609191	BWFGZZWFDVMOEA-UHFFFAOYSA-N	437.522	1.361	50	20	IDGD	
C[C@H](CC(=O)NNc1cccc(S(C)(=O)=O)c1)NS(=O)(=O)c1cccnc1Cl	776721141	MYLCLFXZXNSENW-LLVKDONJSA-N	446.938	1.339	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)/C=C/C(=O)N2CCN(c3ccc(OC)cc3)CC2)cc1	778225768	OJJCHFWACHGNGC-OUKQBFOZSA-N	436.512	1.924	50	20	IDGD	
CC(=NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)c1cnn(C)c1C	778532895	FANOLNJDAAWEFN-UHFFFAOYSA-N	433.534	1.222	50	20	IDGD	
COc1ccc(Cn2ccc(NC(=O)C(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)n2)cc1	778706455	QYSIVEATGXWUKD-UHFFFAOYSA-N	438.400	1.248	50	20	IDGD	
Cc1cc(C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)nn1-c1cccc(C#N)c1	780199416	ARSROUZKWWHFTK-UHFFFAOYSA-N	448.395	1.579	50	20	IDGD	
COC(=O)c1ccccc1NNC(=O)[C@H]1CCCN(S(=O)(=O)c2c(C)n[nH]c2C)C1	780737626	OSDKTIHBJSFTCJ-AWEZNQCLSA-N	435.506	1.357	50	20	IDGD	
CN(C)c1nccc(NNC(=O)C(=O)Nc2ccc(-n3nccn3)cc2C(F)(F)F)n1	784971052	RGNPJXRBTSRJMX-UHFFFAOYSA-N	435.370	1.224	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)C(=O)Nc3cccc4c3OCCO4)n[nH]2)c1	785126155	JXVBCJUKBLHLPW-UHFFFAOYSA-N	435.440	1.864	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2cccc3ccn(C)c23)c2ccccc2c1=O	788331659	TYICNKIPRRTNPG-UHFFFAOYSA-N	432.440	1.308	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)[C@@H]1CCCc2c(O)cccc21	789812970	DPBKFJPWYRGEKV-HXUWFJFHSA-N	436.512	1.418	50	20	IDGD	
COc1cc(NNC(=O)Cn2cnc3c(c(Br)nn3C)c2=O)ccc1Cl	790180309	PGWVPADGCYQQJW-UHFFFAOYSA-N	441.673	1.698	50	20	IDGD	
O=C(NNc1cccc(F)c1[N+](=O)[O-])C(=O)Nc1cccc(OCC(=O)N2CCCC2)c1	791001003	UPNNTCPCOSXDJL-UHFFFAOYSA-N	445.407	1.817	50	20	IDGD	
COc1cc(C(F)(F)F)ncc1NC(=O)C(=O)NNC(=O)COc1ccc(C)cc1	792269362	XZCJBRHPXIMWBR-UHFFFAOYSA-N	426.351	1.582	50	20	IDGD	
CN(NC(=O)[C@@H](C#N)Cc1ccc(C#N)cc1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	792319682	XYCMOPIEXVPIPU-GOSISDBHSA-N	440.504	1.876	50	20	IDGD	
CCC(CC)NC(=O)[C@H]1CN(C(=O)C(=O)NNc2ncccc2C)c2ccccc2O1	792379257	CCDXNGUVCMRBKC-GOSISDBHSA-N	425.489	1.932	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)CCn2cnc3ccccc3c2=O)c2ccccc2c1=O	793031553	KYWZLOYCMTYNCS-UHFFFAOYSA-N	446.467	1.539	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)CNC(=O)OCc2ccccc2)C1	794062089	SYGMVRDEKXDAFS-INIZCTEOSA-N	434.493	1.707	50	20	IDGD	
CCOC(=O)c1cc(S(=O)(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)ccc1C	795286887	SAMXNRBAAOUUOZ-UHFFFAOYSA-N	433.486	1.737	50	20	IDGD	
CCn1cc(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c(C(F)(F)F)n1	797787819	DAZWIVQJAPGFEN-UHFFFAOYSA-N	438.454	1.895	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)Cc2ccc([S@](C)=O)cc2)c2ccccc2c1=O	797793580	YVPHWIOUQLQDPC-PMERELPUSA-N	426.498	1.548	50	20	IDGD	
CO[C@H](C(=O)NNc1nc2ccccc2c(=O)n1CCCOC(C)C)c1cnn(C)c1	798967173	QIUZQKBHUXLOSM-SFHVURJKSA-N	428.493	1.776	50	20	IDGD	
NC(=O)c1cc(Br)cc(S(=O)(=O)NNC(=O)c2ccc(Cl)cc2O)c1	799523279	GIONIEYEEIOWHU-UHFFFAOYSA-N	448.682	1.530	50	20	IDGD	
O=C(CO)NNC(=O)C(=O)Nc1ccc(Oc2ccc(F)cc2)c(Br)c1	799835552	RVNNNCCEWKNHKY-UHFFFAOYSA-N	426.198	1.459	50	20	IDGD	
O=C(NNC(=O)[C@H]1CC(=O)N(c2ccc3c(c2)OCCO3)C1)Nc1cc(F)cc(F)c1	802004447	FKRXYJBBVXOCDD-NSHDSACASA-N	432.383	1.942	50	20	IDGD	
CC(=O)NCCNC(=O)CCC(=O)NNC(=O)Nc1c(Cl)cc(Cl)cc1Cl	802068827	JBKBUYVBLMVEMR-UHFFFAOYSA-N	438.699	1.832	50	20	IDGD	
C[C@@]1(c2ccccc2)NC(=O)N(CC(=O)NNC(=O)Nc2ccc3c(c2)OCO3)C1=O	802093413	UDLYPIVHBHROLE-FQEVSTJZSA-N	425.401	1.035	50	20	IDGD	
COC(=O)c1c(F)cc(NC(=O)C(=O)NNC(=O)COc2cc(C)ccc2C)cc1F	802566098	ZJHVUVFJGLUSBH-UHFFFAOYSA-N	435.383	1.533	50	20	IDGD	
COc1ccc(S(C)(=O)=O)cc1S(=O)(=O)NNC(=O)Cn1ccc2ccccc21	802721871	KBARZRIOIUTMHD-UHFFFAOYSA-N	437.499	1.063	50	20	IDGD	
O=C(NNc1ccc2c(=O)[nH]ccc2c1)c1ccccc1S(=O)(=O)N1CCOCC1	803435416	YKNBKKDGOUCRHB-UHFFFAOYSA-N	428.470	1.306	50	20	IDGD	
Cc1nc(CN2CCC(CNC(=O)NNc3ccc(-n4ccnc4)nn3)CC2)oc1C	805105425	VXBKPCGRKSJLMW-UHFFFAOYSA-N	425.497	1.805	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)NNC(=O)C(=O)Nc1nc(C2CCOCC2)cs1	806974543	CZIUWTOESZGMJF-UHFFFAOYSA-N	427.486	1.847	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)C(=O)Nc1cccc(F)c1Cn1cccc(C)c1=O	806979385	SHAIFGPNCXEWDF-UHFFFAOYSA-N	437.431	1.447	50	20	IDGD	
COC(=O)c1c(F)ccc(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)c1C	810384625	HLSHNUFBVLGAFU-UHFFFAOYSA-N	442.447	1.459	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)Nc2ccc(CN3C(=O)CNC3=O)cc2)cc1	812314068	XCIRILAUMSAXDE-UHFFFAOYSA-N	446.489	1.137	50	20	IDGD	
COC(=O)c1cc(Br)cc(C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1	812447724	OWAVSKGEEHJHID-HNNXBMFYSA-N	435.230	1.837	50	20	IDGD	
CNC(=O)c1cc2cc(NC(=O)NNc3ccc(S(=O)(=O)N(C)C)cc3)ccc2[nH]1	812975774	ISQITJYRIQVOSC-UHFFFAOYSA-N	430.490	1.926	50	20	IDGD	
Cc1ccc2cccc(NC(=O)C(=O)NNc3ccc(S(=O)(=O)N(C)C)cc3)c2n1	813034063	WXEWMNLLAGOHKC-UHFFFAOYSA-N	427.486	1.875	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)C2(S(=O)(=O)c3ccccc3)CCOCC2)c1	813510441	YQBUTTZINUJOAW-UHFFFAOYSA-N	438.527	1.556	50	20	IDGD	
CC(=O)N1CCN(S(=O)(=O)NC(=O)/C(C#N)=C\c2cc(C)n(CCC(C)C)c2C)CC1	813948787	KYDKJYAWAOORML-MOSHPQCFSA-N	449.577	1.583	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)C(=O)Nc1sccc1C#N	815566171	KYKRSDJRAADERV-SECBINFHSA-N	437.275	1.936	50	20	IDGD	
Cc1nnc(NNC(=O)c2cccc(S(=O)(=O)N[C@H](C)c3ccccc3)c2)nc1O	817283974	GGTQQUIYYYMNNZ-GFCCVEGCSA-N	428.474	1.682	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)Cn3cncn3)c2)c(C)c1	849199656	OCYCILATMIDLIR-UHFFFAOYSA-N	428.474	1.157	50	20	IDGD	
O=S(=O)(c1c(Br)cc2nc(O)oc2c1Cl)N1CC[C@H](B(O)O)C1	864232036	VNASCCODAPRPAS-YFKPBYRVSA-N	425.453	1.187	50	20	IDGD	
COc1ccccc1NCC(=O)NN=Cc1c(N2CCOCC2)nc2ccccn2c1=O	864237802	MKRSBTOJVDSOKX-UHFFFAOYSA-N	436.472	1.102	50	20	IDGD	
CNC(=O)c1ccc(C=NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)cc1	912777858	VDQLESNTIJZMCC-UHFFFAOYSA-N	428.514	1.985	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@H](C)C(=O)NNC(=O)Cc1ccc(S(N)(=O)=O)s1	915188855	YUJSAJDWKSIJCN-LLVKDONJSA-N	445.950	1.823	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)cnn1Cc1ccccc1	915636260	CJZGPKUHCMQPJV-UHFFFAOYSA-N	426.502	1.608	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NCCCN2C(=O)NC3(CCCC3)C2=O)cc1C	915906080	HGVQRHWOIDWHHC-UHFFFAOYSA-N	431.493	1.267	50	20	IDGD	
CN1CCN(C(=O)c2ccc(CNC(=O)NNC(=O)COc3ccc(F)cc3)cc2)CC1	916390348	LDPRBHVZVNWNCB-UHFFFAOYSA-N	443.479	1.123	50	20	IDGD	
COc1cc([C@H](C)NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc(OC)c1OC	916482092	GTCSEDAXSDVAKD-LBPRGKRZSA-N	441.448	1.393	50	20	IDGD	
CC(C)NS(=O)(=O)c1cccc(CNC(=O)NNC(=O)COc2ccccc2C#N)c1	916486157	ADZDORLVNFEMOX-UHFFFAOYSA-N	445.501	1.154	50	20	IDGD	
C=CCN(CC=C)[C@@H](CNC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)C(C)C	916522042	WYSBPQSLWHHNAS-SFHVURJKSA-N	426.521	1.576	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)NCCS(=O)(=O)NCc1ccccc1	916645085	ANKPZERBXFLNRG-UHFFFAOYSA-N	440.909	1.412	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)OCC(=O)N2CCC[C@@H](NC(C)=O)C2)c1C	918808393	BLKYFUPEDUMAAQ-DEWISIQVSA-N	430.505	1.329	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)[C@H](CC(C)C)N2C(=O)[C@@H]3CC=CC[C@H]3C2=O)c1O	919756821	NGVWYDAIOQOYDU-FMKPAKJESA-N	429.473	1.528	50	20	IDGD	
O=C(NNC(=O)c1cc2c(F)cc(Br)cc2[nH]1)N[C@H]1CCS(=O)(=O)C1	919885067	JQPDDAXSNDFPAF-QMMMGPOBSA-N	433.259	1.201	50	20	IDGD	
Cc1noc(CCC(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)n1	920406552	SCXQIZIANBLIJO-UHFFFAOYSA-N	443.485	1.250	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)[C@@H](c2ccccc2)n2cccn2)cc1OC	920910316	VYQGYRMAPDYLFU-HXUWFJFHSA-N	438.440	1.494	50	20	IDGD	
C=C[C@@H](COC)NC(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccc(OC)cc2)c1	1116619532	PNFRLVLUPQHXFB-HNNXBMFYSA-N	448.501	1.641	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)c2cnn(-c3ccc(F)cc3)n2)CC1	1252011847	ZGYKESXSIGTPOQ-UHFFFAOYSA-N	432.456	1.815	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)NCCN2CCOC(C)(C)C2)CC1	1318626426	QSLUFMRUMZAJAV-UHFFFAOYSA-N	427.546	1.075	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)NCCCCCS(C)(=O)=O)c2ccccc2c1=O	1320731924	VUCOTHWUMKYVCI-UHFFFAOYSA-N	437.522	1.136	50	20	IDGD	
CNS(=O)(=O)c1ccc(CC(=O)NNC(=O)c2ccc(OC(C)C)c(OC)c2)cc1	1321049431	VGUPWSOWLAQCAN-UHFFFAOYSA-N	435.502	1.394	50	20	IDGD	
Cc1cnc2c(S(=O)(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)cccc2c1	1321526974	HUQRKVKUVPVFQC-UHFFFAOYSA-N	448.526	1.417	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2n[nH]c3c2CCCC3)C1	1777879394	BFDDUAOQQFMKRT-LUQKVYGDSA-N	438.956	1.670	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc4cccn4cn3)C2)C1	1778042868	KJXORRLQNQYYSN-AUUYWEPGSA-N	435.322	1.809	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(CCN(C(=O)CS[C@H]3CCCCO3)C2)C1	1779078209	NTYXEVJYTHTANE-DLBZAZTESA-N	435.384	1.861	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)COc3cc(Cl)ccn3)C2)C1	1779231891	BVXPSDMYARLTEV-SJKOYZFVSA-N	446.729	1.727	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)c(-n2nccn2)c1	1780245775	VFSGQRZXHPAHPD-IBGZPJMESA-N	438.315	1.823	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(CCN(C(=O)c3nn[nH]c3C(F)(F)F)C2)C1	1780359793	HWUKQKLSYJKOPY-CYBMUJFWSA-N	440.220	1.052	50	20	IDGD	
CSCC[C@H](O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@](C)(Cl)CCl)C1	1780714904	KJOMKJBVNPGLLO-MJSCVDMRSA-N	441.421	1.851	50	20	IDGD	
CN1CCCC[C@@H]1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Br)C1	1780770419	NCRYGZDCGHCRES-ATNYBXOESA-N	434.350	1.675	50	20	IDGD	
CC(=O)N[C@@H](C(=O)N1CC[C@@]2(CN(C(=O)C(Cl)Cl)CCO2)C1)c1ccc(F)cc1	1780915759	YNFWSXJXKWYOQU-BEFAXECRSA-N	446.306	1.637	50	20	IDGD	
COc1nc(C)ccc1C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781332165	UYDZSJZYBDBENO-DYVFJYSZSA-N	430.274	1.533	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cnn4ccccc34)CCO2)C1	1783347563	LBUSNFQMGUXOTI-DNVCBOLYSA-N	435.322	1.951	50	20	IDGD	
CC1CCN(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]3C2)CC1	1783964272	OPMCVNVHVNVHAR-OWSLCNJRSA-N	444.414	1.729	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CC(=O)Nc3cc(C)on3)C[C@@H]21	1784618977	SQTCZNNWVDGNPN-JONQDZQNSA-N	440.928	1.699	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H]3CCOC3)C2)C1	1784721448	TWHDXACTSPJVES-RQXWEQLASA-N	431.439	1.738	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)CCNC(=O)OC(C)(C)C)C2)C1	1785339096	YWTJVOUXPDDYHA-FZKQIMNGSA-N	448.358	1.515	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)CNC(=O)c3ccc(C)cc3)C2)C1	1785560965	MVRKFOPJJRMAGJ-XMSQKQJNSA-N	435.952	1.962	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3[nH]ccc3C)[C@H]2C1	1785666660	NWYIZOLUGOITIO-GZERKGCBSA-N	440.504	1.050	50	20	IDGD	
COC(=O)c1ccc(OCC(=O)N2CC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)cc1	1785721852	CKVXUCDCHYGWNY-IBGZPJMESA-N	445.299	1.486	50	20	IDGD	
CC[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCBr)[C@H]2C1)N(CC)CC	1786404792	QHQFVOZOPRNHND-QAETUUGQSA-N	432.403	1.872	50	20	IDGD	
COc1cccc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Br)C[C@@H]32)c1	1786527177	BMRWSEQEQRTSOW-OWIUFQIYSA-N	443.313	1.908	50	20	IDGD	
Cn1cnc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]3C2)c1C(F)(F)F	1787447186	QCZWHMLNTAUPSA-YVNDNENWSA-N	426.798	1.567	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3Cc4ccccc4O3)[C@H]2C1	1788186036	BIKMBZBYQHZFRK-ADBDHWBDSA-N	437.334	1.753	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1ccc(C2(NC(=O)C(=O)N(C)C)CCC2)cc1	1788648094	IXEGMORZHUJSQC-VULFUBBASA-N	438.488	1.343	50	20	IDGD	
COc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]32)ccn1	1788906249	BLCMJRVYPKRTNO-XMDUPGNXSA-N	430.332	1.920	50	20	IDGD	
C[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]2C1)n1ccccc1=O	1789870739	SVYDGFGSYMPGBX-UHMUHUCWSA-N	444.359	1.625	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnncc3C(=O)O)C[C@@H]21	1789870852	ZUCOEMWETJCHOT-PCPUYYKTSA-N	445.303	1.004	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C[C@@H]3C[C@@H]4CC[C@H]3C4)[C@H]2C1	1790907372	ZMRLYNBGHJWKHC-HLXURNFRSA-N	434.581	1.165	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cn3ccccc3=O)C[C@@H]21	1790961039	FSBUUBHSFLUTNJ-JONQDZQNSA-N	440.338	1.002	50	20	IDGD	
CCCC(=O)N[C@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](Br)CC)[C@H]2C1	1790961115	WZRNCNNFAXXFLK-CWVYHPPDSA-N	446.386	1.444	50	20	IDGD	
CCN1CCC(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)Br)C[C@@H]32)CC1	1792297438	UXTSFVQCBQQGLG-IWCQGFGOSA-N	430.387	1.481	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C#Cc1ccc(Cl)cc1	1792945777	ORUWSKHLMADIQO-REPLKXPHSA-N	430.936	1.703	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@H]2[C@H](C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)[C@@H](O)CCl)[C@@H]2C1	1793116891	YGHYJQUNXRHETR-DPNXGZFNSA-N	441.956	1.337	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCO)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C(Cl)Cl)C2	1793249646	KIQXQCOPBLXZMN-RNJOBUHISA-N	438.352	1.704	50	20	IDGD	
COc1ccc2[nH]cc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3ccc(B(O)O)cc3)c2c1	1796189044	PZMSOWVQAQQVBF-BCDXTJNWSA-N	447.300	1.422	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)c1ccc(-c2ncc[nH]2)cc1	1796192615	MWSWIGVTOZPMAQ-WKCHPHFGSA-N	444.300	1.322	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1ccc2nc[nH]c2c1	1797412164	IMZITHZFQIAFNM-JLUCKKNBSA-N	425.258	1.457	50	20	IDGD	
Cc1ccc(C(=O)C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Br)cc1	1799346489	AJCYZSWFEPPMLB-HLPPOEQASA-N	427.270	1.458	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)c1c[nH]c2c(Cl)cccc12	1800055191	XZAKJCJYFDSPAA-OXUXUCFPSA-N	426.300	1.624	50	20	IDGD	
C[C@H]1CCc2c(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@@H](C)Br)n[nH]c21	1800757053	HJMIEXGYQOBUNY-NQUGEPOWSA-N	425.327	1.446	50	20	IDGD	
CC(=O)Nc1ccccc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)Br	1800763953	PMZMAIHQOYWOSL-MBMVNNNZSA-N	438.322	1.632	50	20	IDGD	
CC(=O)Nc1ccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C(Cl)Cl)cc1	1801014771	FMEFORVLFDVEMH-XOIINTDNSA-N	428.316	1.581	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@H](O)CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C(Cl)Cl	1802346619	QOQSHKIPZXFCJH-YVECIDJPSA-N	438.352	1.704	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@@H](CNC(=O)C(O)O)[C@@H]1c1cccnc1	1802927914	OYVYUJMTVFTXRM-TWBVCCKASA-N	442.422	1.283	50	20	IDGD	
CN(C)c1ccc(C(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]2c2cccnc2)cn1	1803139997	AVVZKAIHXQMYCP-SZVBFZGTSA-N	431.924	1.462	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc3ncncc3c2)[C@@H]1c1cccnc1)[C@H](O)CCl	1803143286	YWRSXUHXMKXBHI-PWIZWCRZSA-N	439.903	1.944	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)CS(=O)(=O)CC)[C@@H]1c1cccnc1	1803685829	CVKPPBBAOQFYKM-SOLBZPMBSA-N	429.970	1.930	50	20	IDGD	
COC(=O)CSCC(=O)N1CCCC2(CCN(C(=O)[C@H](C)Br)CC2)C1	1806038235	SPWKIWRPWQGUDF-ZDUSSCGKSA-N	435.384	1.907	50	20	IDGD	
COCCC(=O)NC[C@H]1CCN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@@H]1c1cccnc1	1806743052	WQTWICFVPBLKHY-MFWRVWTKSA-N	440.504	1.258	50	20	IDGD	
O=C(c1cccc(=O)n1O)N1CCCC2(CCN(C(=O)[C@@H](F)Br)CC2)C1	1807556133	MJFTWLURZLILIT-CQSZACIVSA-N	430.274	1.621	50	20	IDGD	
Cc1nn[nH]c1C(=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@H]1c1cccnc1	1807804650	KEMAGDNJFTVREG-FPMFFAJLSA-N	425.262	1.518	50	20	IDGD	
Cc1nccn1CC(=O)N1CC[C@H](CNC(=O)[C@@H](F)Br)[C@@H]1c1cccnc1	1808679384	XCVQZAOFHKZFGP-HYVNUMGLSA-N	438.301	1.983	50	20	IDGD	
O=C(CCN1C(=O)C=CC1=O)N1CCC2(CCCN(C(=O)CCBr)C2)CC1	1809066634	RFBZADFRZCSKIN-UHFFFAOYSA-N	440.338	1.318	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC2(CCCN(C(=O)CCN3CCOCC3)C2)CC1	1809586313	CDYNDSBAIXZHEF-INIZCTEOSA-N	430.387	1.723	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)c3c[nH]c4cnccc34)CC2)C1	1809978793	RHKNJVKBZNJNGJ-UHFFFAOYSA-N	446.316	1.401	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@H]1CCN(C(=O)c2cc[n+]([O-])cc2)[C@H]1c1cccnc1	1810543951	IBEGVGNEMDTHBG-QUCCMNQESA-N	428.565	1.886	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)C(C)(C)CNC(C)=O)[C@@H]1c1cccnc1	1813027953	HEHWIMAHKJYFKP-FGTMMUONSA-N	438.956	1.504	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)c[nH]1	1813070866	NFLXACROGIOBFX-UTKZUKDTSA-N	426.521	1.411	50	20	IDGD	
O=C(NCC(=O)N1CC[C@@H](CNC(=O)C(Cl)Cl)[C@@H]1c1cccnc1)c1ccco1	1813075393	AKEIUYHQEIQJDS-BBRMVZONSA-N	439.299	1.914	50	20	IDGD	
O=C(Cc1cnc2ccccn12)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1	1814833779	LLAGEFQFJSYCFG-JKSUJKDBSA-N	430.896	1.892	50	20	IDGD	
O=C1Cc2cc(C(=O)N3CCCC[C@H]3c3cc(NC(=O)[C@H](O)CCl)n[nH]3)ccc2N1	1814873683	SZVPHUDHXZUGQP-JKSUJKDBSA-N	431.880	1.810	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC[C@H]1c1cc(NC(=O)C23CC(F)(C2)C3)n[nH]1	1815285884	YOKNWQIQCIGDKS-ATIQYGATSA-N	426.257	1.288	50	20	IDGD	
Cc1ccc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)s1	1815355009	LEHYYBCUGONRBQ-CQSZACIVSA-N	441.343	1.732	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)CCBr)[nH]n1)c1ccc(B(O)O)cc1	1817471276	KKZQWOVUEINGCV-HNNXBMFYSA-N	449.114	1.180	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(F)cc2)[nH]n1)c1cccc(B(O)O)c1	1817476581	KXOQRMDZZNCPMM-IBGZPJMESA-N	436.252	1.848	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](N)Cc2cccnc2)[nH]n1	1822368915	JPCAKUXRKQNYQE-HLLBOEOZSA-N	434.928	1.621	50	20	IDGD	
CCN(CC)C[C@@H](C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1	1822416531	GVYXVKUDFDUZGK-AEFFLSMTSA-N	449.600	1.753	50	20	IDGD	
CC(=O)N[C@@H]1CCc2nc(NC(=O)CN(C)NC(=O)NCc3ccccc3)sc2C1	1822518355	NDYITEUWKDONID-OAHLLOKOSA-N	430.534	1.421	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](C)N3CCN(C)CC3)sc2C1	1822709724	PFGPQKANRKAVEF-HZSPNIEDSA-N	428.002	1.708	50	20	IDGD	
O=C(CCNC(=O)c1ccccc1)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1	1823352837	MSPPZRVVCMNGHG-IRXDYDNUSA-N	447.923	1.822	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)c2ccccc2O)CC1	1825662327	GOKNPAOOIXWEGN-NRFANRHFSA-N	436.317	1.619	50	20	IDGD	
CC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1	1826386892	BVQRCKLYJGNJHG-IBGZPJMESA-N	429.521	1.288	50	20	IDGD	
COC(=O)NCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](C)CBr)CC2	1826495324	MYNMJMJLZUTSKY-DTWKUNHWSA-N	433.328	1.442	50	20	IDGD	
N=C1NCCN1CC(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@H](F)Br)CC1	1826874371	NAEHVFUIEDZYHD-ZFWWWQNUSA-N	432.338	1.137	50	20	IDGD	
CC/C=C(\C)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnccc1C(=O)NN)CC2	1827452715	KDMJOUSTADQJQC-KBVBDRTLSA-N	428.518	1.724	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)c2cccc(F)n2)CC1	1829225033	LANLYUWBRKPVEQ-HXUWFJFHSA-N	439.296	1.448	50	20	IDGD	
Cc1nccnc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1	1829441959	MSMSSRYITUZJOA-SFHVURJKSA-N	430.553	1.391	50	20	IDGD	
C[C@@H](Cn1ccnc1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830370797	YPAYXTQSJFAVKR-JXFKEZNVSA-N	426.945	1.241	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CC[C@H](C(=O)OC)C1)CCO2	1830706549	ILHJGJALYUBQBY-MXTNKPTQSA-N	444.956	1.440	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CNC(=O)OC(C)(C)C)C2)C1	1831657991	RVIWUNWHWINIIQ-QRWLVFNGSA-N	447.960	1.375	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)n3ccnc3C)C2)C1	1831658824	IORKLGASWXUDOZ-OXFYSEKESA-N	426.945	1.616	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)N2CCO[C@@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)c1	1832442721	DKFSOYDTFFWWKV-FQEVSTJZSA-N	445.343	1.942	50	20	IDGD	
Cc1cc(C(=O)N2CCC(N3CCC(NC(=O)[C@@H](O)CCl)CC3)CC2)n(C(F)F)n1	1833311931	GDYVGUUEHRLAPM-INIZCTEOSA-N	447.914	1.372	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3n[nH]c(C4CC4)c3F)CCO2)C1	1833685219	WKZKHSQLHZFYCP-DJJJIMSYSA-N	428.892	1.514	50	20	IDGD	
Cc1cc(CC(=O)NC2CCN(C3CCN(C(=O)CO[Si](C)(C)C)CC3)CC2)on1	1833733254	DIVMUWQSPSKKPO-UHFFFAOYSA-N	436.629	1.949	50	20	IDGD	
Cc1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)CBr)C3)C2)n1	1834047073	VZZCBHWZXGRHEO-AUUYWEPGSA-N	440.338	1.491	50	20	IDGD	
CN(C)c1cncc(C(=O)N2CCC(N3CCC(NC(=O)[C@@H](F)Cl)CC3)CC2)c1	1835078832	YHCGUHUUMMQEAH-GOSISDBHSA-N	425.936	1.867	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3ccnc4c3OCO4)CC2)CC1)[C@H](F)Cl	1835084341	ZBAIFGRXGHPACU-INIZCTEOSA-N	426.876	1.530	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC1CCN(C2CCN(C(=O)c3cc(O)ncn3)CC2)CC1	1835835029	MDYFEFZEVADWNG-UHFFFAOYSA-N	435.601	1.219	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3[nH]cc4c3CCC4)CC2)CC1	1836087042	QSLUGGGDLSGGHQ-IBGZPJMESA-N	436.984	1.942	50	20	IDGD	
CC(C)Cc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)n(C)n1	1836337300	WVJCGXFYGWWFHU-QFBILLFUSA-N	430.908	1.223	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC1CCN(C2CCN(C(=O)c3cnc(O)[nH]3)CC2)CC1	1836400211	ZKOJXBALTDPFBU-SFHVURJKSA-N	432.352	1.537	50	20	IDGD	
O=C(CCBr)N1CCC(OC2CCN(C(=O)CN3CCCC3=O)CC2)CC1	1837651803	LHKZFKLZWBTYOM-UHFFFAOYSA-N	444.370	1.392	50	20	IDGD	
CCN(CC)C[C@@H](C)C(=O)N1CCOC[C@@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1837716038	YJSMGXDEJVNNBG-WIYYLYMNSA-N	443.661	1.272	50	20	IDGD	
CC(=O)N[C@@H](C)C(=O)N1CCC(OC2CCN(C(=O)[C@H](C)Br)CC2)CC1	1838753847	DPPYLGPKYRHTCO-STQMWFEESA-N	432.359	1.293	50	20	IDGD	
Cc1ccc(O)c(C(=O)N2CCO[C@]3(COCCN(C(=O)CCBr)C3)C2)c1	1838892106	LHQQQXPYTWEFJA-IBGZPJMESA-N	441.322	1.556	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)C2)C1	1839147026	FGHQDXQDJITSFK-QFBILLFUSA-N	441.868	1.388	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3c(C)nn(C)c3C)C2)C1	1839148778	JOKQMVIGYMRFGD-PXNSSMCTSA-N	426.945	1.053	50	20	IDGD	
Cc1n[nH]c(C)c1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2	1839153278	DUUPGPVQPLLPDK-QZTJIDSGSA-N	433.336	1.333	50	20	IDGD	
Cc1nccnc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2	1839153688	OLCSVPWRYPQKOH-ROUUACIJSA-N	431.320	1.091	50	20	IDGD	
Cn1cc2cc(C(=O)N3CCO[C@]4(COCCN(C(=O)C(Cl)Cl)C4)C3)ccc2n1	1839506119	ANMCYZJWBDMHGK-LJQANCHMSA-N	441.315	1.447	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3n[nH]c4c(C)cccc34)CCO2)C1	1839596334	SDHDTYRVVTVWSY-IERDGZPVSA-N	434.924	1.959	50	20	IDGD	
C[Si](C)(C)c1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)co1	1840188598	SDQWEGXCCQSMTR-SFHVURJKSA-N	449.407	1.699	50	20	IDGD	
O=C([C@@H]1C[C@@]1(F)Cl)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1840247417	YRZYXOMUWCWOQF-ZNIXKSQXSA-N	431.661	1.058	50	20	IDGD	
CCc1c(Br)c(C(=O)N2CC3(CCCN3C(=O)[C@@H](O)CCl)C2)nn1C	1841350516	IGNGNULLGSWGEZ-NSHDSACASA-N	433.734	1.162	50	20	IDGD	
O=C(Cc1ccc(Br)c(F)c1)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1	1841353741	MOZPMXMEUBJEGG-CQSZACIVSA-N	433.705	1.934	50	20	IDGD	
CC#CC[C@@H](C(=O)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1)c1ccccc1	1843011579	SBOFLWVJDMNGJM-JOCHJYFZSA-N	430.313	1.381	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)c2nc3c(=O)[nH]c4ccccc4n3n2)C1	1843808481	FPWFBPCVLJLZGY-CYBMUJFWSA-N	442.907	1.795	50	20	IDGD	
CN(CC(=O)N1CCCC12CN(C(=O)[C@H]1CCC=CO1)C2)NC(=O)NCc1ccccc1	1845038885	CYRXUDJESYQXKA-LJQANCHMSA-N	441.532	1.229	50	20	IDGD	
CCOC(=O)c1ncn2c1CC[C@@H](C(=O)N1CCCC13CN(C(=O)C(Cl)Cl)C3)C2	1845863877	WGRHBLHHDPDINC-GFCCVEGCSA-N	443.331	1.629	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)C1(c3ccc(F)c(F)c3)CC1)C2	1846385408	BZHSPEBCZDYCSJ-UHFFFAOYSA-N	434.487	1.573	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cc3c(s2)CCCCC3)cc(OC)c1OCC(N)=O	16174946	FSPUSHNTFRRMGU-UHFFFAOYSA-N	447.513	1.973	50	20	IDGD	
C[C@@H]1Cc2cc(C(=O)OCC(=O)NNC(=O)c3cccs3)ccc2N1S(C)(=O)=O	17161532	IHGMCKWWJFDGGO-LLVKDONJSA-N	437.499	1.077	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@H](C(=O)NNC(=O)COc2cccc(C)c2)C(C)C)cc1	17198780	ZYWHWGRHWLCOGE-FQEVSTJZSA-N	433.530	1.833	50	20	IDGD	
CS(=O)(=O)Cc1nc2ccccc2n1CC(=O)NNC(=O)C12CC3CC(CC(C3)C1)C2	27071906	SCSBSRGXYWOOQA-UHFFFAOYSA-N	444.557	1.945	50	20	IDGD	
Cc1oc(-c2ccccc2)nc1CC(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	29227705	PXPCTGQKSJVOFD-UHFFFAOYSA-N	448.888	1.955	50	20	IDGD	
O=C(NNc1nc(-c2ccccc2)no1)c1cccc(S(=O)(=O)NC[C@@H]2CCCO2)c1	728081119	ADOMJOOZZKJULO-INIZCTEOSA-N	443.485	1.951	50	20	IDGD	
C[C@@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(S(=O)(=O)NNC(=O)NCC3CC3)cc2)C1	728262278	BULXYGCUTBBNRI-ZIAGYGMSSA-N	444.579	1.256	50	20	IDGD	
C[C@H]1CN(c2ccc(C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)cn2)C[C@H](C)O1	728848221	ZYBKIXRNUKTJTJ-HOTGVXAUSA-N	439.520	1.163	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)CCc2c(C)nc3[nH]n(C)c(=O)c3c2C)o1	729528520	YBKBHIMBTINADZ-UHFFFAOYSA-N	442.520	1.707	50	20	IDGD	
NC(=O)[C@@H](NNC(=O)C1CCN(c2ncccn2)CC1)c1ccc(Br)cc1	729676078	AWVYPPKXISQQGR-HNNXBMFYSA-N	433.310	1.303	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)CNC(=O)c2ccc(C(F)(F)F)cc2)cn1	729692826	UBFGQFBHJIQNQZ-UHFFFAOYSA-N	427.408	1.857	50	20	IDGD	
CCn1c(NNC(=O)[C@@H]2CCN(c3ccc4c(c3)OCCO4)C2=O)nc2ccccc2c1=O	730522230	OPVBGLPHQBXETF-INIZCTEOSA-N	449.467	1.684	50	20	IDGD	
CCC(=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O)c1ccc(Cl)cc1Cl	730569255	SEKSNXQUKQQDHI-UHFFFAOYSA-N	430.317	1.808	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)[C@H]2CCN(c3ccc4c(c3)OCCO4)C2=O)cc1	730585846	QKASFXRMHMZLRW-QGZVFWFLSA-N	440.456	1.079	50	20	IDGD	
COC(=O)NCCCC(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	730770421	KDMICOGQPQPTLA-UHFFFAOYSA-N	437.460	1.286	50	20	IDGD	
CCC[C@@H](NC(=O)NNC(=O)COc1ccccc1O)C(=O)N1CCc2sccc2C1	730911894	RGXQZGFVPWMZNC-OAHLLOKOSA-N	446.529	1.917	50	20	IDGD	
CCOc1ccc(NS(=O)(=O)c2ccc(C(=O)NNC(=O)c3c[nH]nc3C)cc2)cc1	731851627	IEQSVQLIMRGAIW-UHFFFAOYSA-N	443.485	1.992	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2ccc(OCC(F)(F)C(F)F)nc2)C[C@@H](C)O1	732260754	HQFYOSDLTYQVMV-TXEJJXNPSA-N	436.406	1.621	50	20	IDGD	
O=C(COC(=O)C1(c2ccc(F)cc2)CCOCC1)NNC(=O)c1cccc([N+](=O)[O-])c1	732332337	NSJFPQGJFHJUDS-UHFFFAOYSA-N	445.403	1.787	50	20	IDGD	
C[C@@H](c1nc(-c2cccs2)no1)N1CCN(C(=O)NNC(=O)Cc2cccnc2)CC1	732995670	QIARKBHBGLAJCC-AWEZNQCLSA-N	441.517	1.855	50	20	IDGD	
CC(=O)N[C@H](C)c1ccc(S(=O)(=O)NNC(=O)c2cnn(-c3ccccc3)c2)s1	733122806	ARKBYKRKAQLELX-GFCCVEGCSA-N	433.515	1.754	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)[C@@H]1CC(=O)N(C[C@H]2CCCN2CC)C1	733125431	HMGFDAFEGAJXSM-IAGOWNOFSA-N	440.548	1.079	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)Nc2cccn(C)c2=O)cc1	733959871	NQAFUARGKFPBJF-VBKFSLOCSA-N	446.467	1.678	50	20	IDGD	
Cc1nn(C(C)C)c(C)c1S(=O)(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12	734418436	HSUQMCDJAOVSDZ-UHFFFAOYSA-N	446.533	1.995	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNS(=O)(=O)c1ccc(CS(C)(=O)=O)cc1	734806857	MGBRMSTZPSWBQE-UHFFFAOYSA-N	432.907	1.517	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2ccc(C)c(C(=O)NNC(=O)c3cnn(C)c3)c2)cc1	735473214	OPMXVBWZAOERIY-UHFFFAOYSA-N	427.486	1.913	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccc3c(c2)OCO3)c1	735516515	STKYIVFFHJGHND-UHFFFAOYSA-N	443.441	1.322	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCn2c(nnc2C(F)(F)F)C1	739935610	AUXLGBOOAHXGRN-UHFFFAOYSA-N	432.790	1.236	50	20	IDGD	
O=C(CCCN1C(=O)c2ccc(Br)cc2C1=O)NNc1ncnc2[nH]cnc12	740746790	NNOSLVXHDCBXTC-UHFFFAOYSA-N	444.249	1.635	50	20	IDGD	
CC(C)[C@@H](C(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)N1C[C@H](C)O[C@H](C)C1	741024994	BNYDSUWBCREBQP-IYOUNJFTSA-N	436.465	1.033	50	20	IDGD	
CSc1nnc(CCCNC(=O)NNc2ccc(-n3cccn3)nn2)n1CC(C)C	741091254	FALZLUVIUOTWKF-UHFFFAOYSA-N	430.542	1.891	50	20	IDGD	
Cc1cc(N2CCCS2(=O)=O)ccc1C(=O)NNC(=O)Cn1cnc2ccccc21	741660120	IVOOKPQZWHGWRT-UHFFFAOYSA-N	427.486	1.346	50	20	IDGD	
O=C(CNC(=O)c1cc2ccccc2[nH]1)NNC(=O)COc1ccc(Br)cc1	742470185	BBMVCPBKQACKIT-UHFFFAOYSA-N	445.273	1.887	50	20	IDGD	
COc1cccc(-c2noc([C@H](C)NC(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)n2)c1	743510833	DWWQSKBGMNRQDS-LBPRGKRZSA-N	449.431	1.426	50	20	IDGD	
CC(C)c1ncc(Cl)c(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)n1	743741343	AQVZXFCJXCTNGU-UHFFFAOYSA-N	432.289	1.629	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)NCCS(=O)(=O)NCc2ccccc2)cc1	745629545	GOBQJNFLNZGCJU-UHFFFAOYSA-N	434.522	1.208	50	20	IDGD	
Cn1ccc(N2CCC[C@H](NC(=O)NNC(=O)CSc3ccc(Cl)cc3)C2=O)n1	745883917	QTWISRVSEHDNMY-AWEZNQCLSA-N	436.925	1.692	50	20	IDGD	
CSc1ccc(F)cc1CNC(=O)NNC(=O)c1csc(N2CCOCC2)n1	745928200	ALQAGXUTUATDDL-UHFFFAOYSA-N	425.511	1.985	50	20	IDGD	
COc1ccc(C(=O)N2CCC(C(=O)NNC(=O)N3CCOCC3)CC2)c2ccccc12	745992175	VVUHIBRFICBRHU-UHFFFAOYSA-N	440.500	1.774	50	20	IDGD	
O=C(NCCNS(=O)(=O)c1cccnc1)NNc1ccc(F)cc1Br	746325443	CTDNOXAYUZAPSX-UHFFFAOYSA-N	432.275	1.588	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2ccc(Cl)nc2)cc(Br)cc1S(N)(=O)=O	747356842	AVDFDCKDVKXGNC-UHFFFAOYSA-N	447.698	1.528	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@](F)(C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)C1	748297509	SRRBGDVXTUEQOC-GOSISDBHSA-N	429.470	1.200	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)[C@@H]2CCCN2S(=O)(=O)c2cccs2)c1	749115434	XQOUKOHLPHBCKS-HNNXBMFYSA-N	439.515	1.380	50	20	IDGD	
CC[C@@H](C(=O)N1CCC(NC(=O)NNC(=O)C(=O)N2CCCC2)CC1)c1ccccc1	749191993	VNSXFLXCAWEGRK-GOSISDBHSA-N	429.521	1.124	50	20	IDGD	
Cc1cc(Br)ccc1NNC(=O)C(=O)Nc1ccc(S(N)(=O)=O)cc1	749289935	XARGBMIWIPWXDY-UHFFFAOYSA-N	427.280	1.487	50	20	IDGD	
Cn1nc(Br)c2c(=O)n(CC(=O)NNC(=O)c3cc4ccccc4o3)cnc21	749474235	QIJKTPFWIDEVKG-UHFFFAOYSA-N	445.233	1.100	50	20	IDGD	
O=C(COc1ccc(OCc2ccccc2)cc1)NNC(=O)N[C@@H]1CC(=O)N(C2CC2)C1	750656249	WECXAAWXNALEKC-QGZVFWFLSA-N	438.484	1.738	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c2c(C)n[nH]c2n1	750664024	WDKSDTMRNFBFHY-UHFFFAOYSA-N	442.501	1.434	50	20	IDGD	
N#C/C(=C/c1ccc(O)cc1)C(=O)OCC(=O)N(C1CCCC1)[C@H]1CCS(=O)(=O)C1	750664863	YUMICCDLCQPXPH-QMJOVRGKSA-N	432.498	1.801	50	20	IDGD	
CC(=NNC(=O)CNC(=O)c1ccco1)c1ccc(S(=O)(=O)N2CCCCC2)cc1	750938570	IAMIVFFPGSLUFF-UHFFFAOYSA-N	432.502	1.724	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)CNC(=O)c1ccco1)c1noc(-c2ccc(Cl)cc2)n1	753038508	LTTMWDAASISCPC-SNVBAGLBSA-N	432.824	1.804	50	20	IDGD	
CCCN(CCC)S(=O)(=O)N1CCN(C(=O)NNC(=O)c2ccccc2OC)CC1	753127212	OWQXQICVMFPUAE-UHFFFAOYSA-N	441.554	1.034	50	20	IDGD	
C[C@@H]1C[C@@H](CCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)CCO1	753333679	DKKDMPVCINEQCM-CVEARBPZSA-N	438.550	1.620	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@@H]2COc3cc(F)cc(F)c32)c2ccccc2c1=O	753420525	UMACJUTUGYACAZ-CQSZACIVSA-N	429.383	1.772	50	20	IDGD	
CC(C)c1c(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)cnn1-c1ccccc1	753838792	BLUAEKHKVKMBOQ-LJQANCHMSA-N	449.467	1.922	50	20	IDGD	
O=C(COC(=O)Cc1cc(F)cc2c1OCOC2)NNC(=O)c1ccc([N+](=O)[O-])cc1	753876523	WCEVRPUNIDFJEB-UHFFFAOYSA-N	433.348	1.147	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(NC(=O)NNC(=O)c2cnn(C)c2)ccc1Cl	755432419	YXFFOOHCNWQIOQ-UHFFFAOYSA-N	428.902	1.571	50	20	IDGD	
COc1cc(C=NNC(=O)[C@H](C)CN2CCC(C)CC2)c([N+](=O)[O-])cc1OCC(=O)O	755585500	UYZHORVLNWZOAB-CQSZACIVSA-N	436.465	1.885	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)Nc1ccc(N2CCOCC2)cc1C(F)(F)F	755915702	CLQYSNLIFDGRHO-LBPRGKRZSA-N	434.415	1.746	50	20	IDGD	
COc1ccc(C(=O)N2CCN(C)CC2)cc1NC(=O)NNC(=O)c1ccc(C)cc1O	756247722	IKQQRDDLRBFAER-UHFFFAOYSA-N	441.488	1.563	50	20	IDGD	
O=C(COC(=O)c1c[nH]nc1-c1ccccc1F)NNC(=O)c1ccc([N+](=O)[O-])cc1	756605191	CIMXVAMXBUSPGD-UHFFFAOYSA-N	427.348	1.742	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2cncc(N3CCOCC3)c2)c2ccccc2c1=O	756864921	ZKRMMXRSHAZJGV-UHFFFAOYSA-N	436.472	1.113	50	20	IDGD	
CCOC(=O)c1cc(Br)cc(S(=O)(=O)NNC(=O)NCc2ccco2)c1	756935524	DZXPLQHIVNXWTD-UHFFFAOYSA-N	446.279	1.912	50	20	IDGD	
CN(C)c1nccc(NNC(=O)[C@@H]2CCC(=O)N2Cc2ccc(Br)cc2)n1	757662454	RNWHGJAPOHCVHE-AWEZNQCLSA-N	433.310	1.939	50	20	IDGD	
COCCOc1ccc(C#N)cc1NC(=O)NNC(=O)COc1ccccc1[N+](=O)[O-]	758013904	JZIPSIXHXIDZBK-UHFFFAOYSA-N	429.389	1.723	50	20	IDGD	
O=C(NNC(=O)c1nnn(-c2ccc(F)cc2)c1C(F)(F)F)C(=O)Nc1ccccn1	758835185	SWPHALDNPSWOCE-UHFFFAOYSA-N	437.313	1.220	50	20	IDGD	
COc1cc(Br)c(N)c(C(=O)OCC(=O)NNC(=O)c2cccc(C)c2)c1	759312688	DVMLHNUUTJREJM-UHFFFAOYSA-N	436.262	1.966	50	20	IDGD	
CS(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1Cl	759404565	RIJPKMCNDXIHJC-UHFFFAOYSA-N	426.838	1.796	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)c2cc(S(=O)(=O)N3CCC[C@H](C)C3)cn2C)nc1	759739932	ZKMWFCOVFQTHNX-ZDUSSCGKSA-N	435.506	1.384	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2ccnn2-c2nc(C)cc(C)n2)c1	760279635	OPGBDZSMJUJIAR-UHFFFAOYSA-N	437.460	1.061	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)N[C@@H]1CC[C@H]2SCCS[C@@H]12	762526381	DVQMTPUMXANXAR-BZPMIXESSA-N	443.620	1.612	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)c3cc(S(=O)(=O)N(C)C)ccc3F)n[nH]2)cc1	762956325	RIPAHRTUFRCDJD-UHFFFAOYSA-N	445.476	1.849	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)c2ccccc2c1=O	763126034	NJPMOJCHRBLDMU-SFHVURJKSA-N	449.467	1.496	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCc2nc(CN3C(=O)NC(C)(C)C3=O)no2)N(C)c2ccccc21	763307400	BZUOJUXCNAAKCJ-UHFFFAOYSA-N	449.471	1.723	50	20	IDGD	
CC(C)NC(=O)NNS(=O)(=O)c1c(Br)cc2nc(O)oc2c1Cl	763421159	LRIVWJSBRINBRS-UHFFFAOYSA-N	427.664	1.850	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(F)cc1OCC(F)F	763446351	RMWKSYCTESKMES-UHFFFAOYSA-N	426.307	1.778	50	20	IDGD	
CC(C)OC(=O)c1c(NC(=O)C(=O)NNC(=O)c2ccccn2)sc2c1CCCC2	763463401	HXOBYZOQPVNTHR-UHFFFAOYSA-N	430.486	1.987	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(CCN2CCCC2)cc1	763468441	ZBZRDSUCAKKGDV-UHFFFAOYSA-N	425.445	1.633	50	20	IDGD	
COC(=O)c1ccc(OCc2ccccc2)c(NC(=O)C(=O)NNC(=O)c2cccnc2)c1	763492259	RAKOEYTWSRUMTR-UHFFFAOYSA-N	448.435	1.847	50	20	IDGD	
CC(C)CNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)cc1	763550497	AVKFUEIMHXDICV-UHFFFAOYSA-N	426.429	1.201	50	20	IDGD	
COCCCOc1cccc(NC(=O)C(=O)NNC(=O)c2c(C)nc3ccccn23)c1	763630187	VXQXBPCDSLGVPE-UHFFFAOYSA-N	425.445	1.458	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(OC2CCCC2)nc1	763647862	RMIQWUBPLLQIGU-UHFFFAOYSA-N	428.445	1.577	50	20	IDGD	
CC(C)(C)NC(=O)c1cccc(NC(=O)C(=O)NNC(=O)COc2ccccc2F)c1	763681246	NXETYSGBRTXLSN-UHFFFAOYSA-N	430.436	1.519	50	20	IDGD	
O=C(COc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1cc(C(F)(F)F)cnc1O	763686540	NKCFEKXABHPRBD-UHFFFAOYSA-N	432.742	1.624	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(CN3CCCCC3=O)c2)cc1	763811737	LMRYWIMXBBUGSO-UHFFFAOYSA-N	438.484	1.672	50	20	IDGD	
COc1cc2nc(C)sc2cc1NC(=O)C(=O)NNC(=O)COc1ccc(F)cc1	763838876	BEALLBHHJUNJQU-UHFFFAOYSA-N	432.433	1.917	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccc(OC[C@H]2CCCO2)cc1	763848531	CRGSZHPOEWCSLS-RHSMWYFYSA-N	445.447	1.937	50	20	IDGD	
Cc1nccn1-c1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)cn1	763851042	TUGWFOHWMWQYGA-LBPRGKRZSA-N	426.408	1.268	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccc(Oc2cccnc2)nc1	763866863	YHHJEAGRGBNFNW-ZDUSSCGKSA-N	439.403	1.961	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccccc1O[C@H]1CCOC1	763867336	UUQSRHULVMVLOR-CJNGLKHVSA-N	431.420	1.547	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccc(C)c(NC(=O)C(C)(C)C)c2)n1	763884154	BCKFIOJXGHMXTC-UHFFFAOYSA-N	428.493	1.579	50	20	IDGD	
Cn1c(=O)oc2cc(NC(=O)C(=O)NNC(=O)CCSc3ccc(F)cc3)ccc21	763895795	GRAJRCOYHQCVMI-UHFFFAOYSA-N	432.433	1.539	50	20	IDGD	
O=C(Cc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1cccc(N2CCCNC2=O)c1	763936635	MQVYGDNNSAEQQD-UHFFFAOYSA-N	429.864	1.588	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cnn1-c1ccccc1	763950109	SVWZFOAQDJVMGK-UHFFFAOYSA-N	445.439	1.472	50	20	IDGD	
O=C(Cc1ccsc1)NNC(=O)C(=O)Nc1ccc(-n2nccn2)cc1C(F)(F)F	764033219	IGODYRLOBVHXTA-UHFFFAOYSA-N	438.391	1.676	50	20	IDGD	
COC(=O)N(C)c1ccc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1	764351376	QXAPTYHJSMWQLD-UHFFFAOYSA-N	436.428	1.475	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(F)c(I)c(F)c2)o1	764370346	QGPSFUBYTFMVGS-UHFFFAOYSA-N	449.151	1.871	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)CN(C)C3)n[nH]1	764377844	RCUBOUWLURATEF-UHFFFAOYSA-N	434.456	1.430	50	20	IDGD	
O=C(NNC(=O)C(F)(F)Oc1ccccc1)C(=O)N1C[C@H]2CCCN2c2ccccc21	764379642	GLDLWONKDLICAB-CQSZACIVSA-N	430.411	1.821	50	20	IDGD	
Cn1nc(CC(C)(C)C)cc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	764388403	RRKGFWSISOTELV-UHFFFAOYSA-N	441.467	1.938	50	20	IDGD	
Cc1cc(N2CCOCC2)ccc1NC(=O)C(=O)NNC(=O)CSc1ccccc1O	764400839	IQRWWEWINYLPDT-UHFFFAOYSA-N	444.513	1.415	50	20	IDGD	
CS(=O)(=O)c1c(F)cc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2F)cc1F	764410190	JNTIFXWPZICSPD-UHFFFAOYSA-N	449.794	1.561	50	20	IDGD	
CCOC(=O)c1cnn2c(C(=O)NNC(=O)c3cc(-c4cc(C)ccc4C)[nH]n3)ccnc12	764751164	LKBTUAMOSFOXRA-UHFFFAOYSA-N	447.455	1.988	50	20	IDGD	
O=C(CSCc1cc(=O)n2ccsc2n1)NNC(=O)CSc1ccccc1O	765249741	OWVXBFNZCBSSMO-UHFFFAOYSA-N	436.540	1.635	50	20	IDGD	
CCN1C(=O)c2ccc(C(=O)NNC(=O)CSc3ccccc3O)cc2S1(=O)=O	765251067	WYCZSPRVGFRZGN-UHFFFAOYSA-N	435.483	1.110	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)NCCCN1CCN(c2ccncc2)CC1	765732294	PDYTUUGFMNFDKR-UHFFFAOYSA-N	432.550	1.324	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1ccccc1OCC1CC1	766636705	RUDCHAMDFSREFY-UHFFFAOYSA-N	436.512	1.694	50	20	IDGD	
COC(=O)c1ccccc1-c1ccccc1C(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1	767685461	WAIGIVYWLXVVHE-CYBMUJFWSA-N	431.470	1.271	50	20	IDGD	
Cc1nn(CC(=O)N2CCN(S(=O)(=O)CBr)CC2)cc1-c1ccccc1	768179865	KDGVINCWJLDWMC-UHFFFAOYSA-N	441.351	1.685	50	20	IDGD	
CSCCNC(=S)NNC(=O)c1cc(S(C)(=O)=O)ccc1Br	769764197	ACQREEFKWOEFON-UHFFFAOYSA-N	426.383	1.325	50	20	IDGD	
CSCCNC(=S)NNC(=O)c1cccc(S(=O)(=O)N(C)c2ccccc2)c1	769769260	RJSNHVQLGGZKGQ-UHFFFAOYSA-N	438.600	1.984	50	20	IDGD	
CCOc1cc(C(=O)NNS(=O)(=O)c2ccnn2CC)cc(OCC)c1OCC	769862468	KAYSHVWDVWRSAQ-UHFFFAOYSA-N	426.495	1.722	50	20	IDGD	
C[S@](=O)c1cccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1	770210644	ZXYFYTTYXYWNEB-NDEPHWFRSA-N	435.527	1.283	50	20	IDGD	
C[C@H](NS(=O)(=O)c1ccc(C(N)=O)cc1)C(=O)NNc1cccc(C(F)(F)F)n1	771021372	GBLACHJXSPNCEZ-VIFPVBQESA-N	431.396	1.009	50	20	IDGD	
COc1ccnc(NNC(=O)CN2C(=O)N[C@](C)(c3ccc(Br)cc3)C2=O)n1	771262038	ASKCGCJOIASFCX-QGZVFWFLSA-N	449.265	1.158	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)C[C@H](NC(=O)c1ccc(O)cc1)c1ccccc1	772001124	AVKYCLVYCVOVBZ-KDOFPFPSSA-N	427.457	1.743	50	20	IDGD	
Cc1c(C(=O)O[C@@H](C)C(=O)NNC(=O)CC(C)C)nnn1-c1ccc(OC(F)F)cc1	772107094	ULWQFBGQGIVISR-LBPRGKRZSA-N	439.419	1.916	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)CCN1CCN(c2ccccn2)CC1	772971162	XVENBIKTODYKLW-INIZCTEOSA-N	431.924	1.862	50	20	IDGD	
COC(=O)N1CCC[C@H]([C@@H](C)NC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)C1	773567213	MALPBVWOGWKNCO-OLZOCXBDSA-N	441.510	1.293	50	20	IDGD	
CC1C[C@H](C(=O)NNC(=O)CCc2ccco2)[C@@H](C(=O)NNC(=O)CCc2ccco2)C1	775823932	KYOQKXVGNDDMMV-ROUUACIJSA-N	444.488	1.395	50	20	IDGD	
O=C(Cc1cccc2ccccc12)NNC(=O)N[C@H]1CCO[C@]2(CCS(=O)(=O)C2)C1	776076092	IEIUHICSFGRRLV-LAUBAEHRSA-N	431.514	1.449	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)[C@@H]2CCCN(C(=O)c3ccc4n[nH]cc4c3)C2)c1	776540834	AKSYJLVVRUCOBN-OAHLLOKOSA-N	441.513	1.962	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)[C@H]2CCCN(C(=O)COc3ccccc3)C2)c1	776541093	GTURULOSILLRGX-INIZCTEOSA-N	431.514	1.851	50	20	IDGD	
CC(=O)c1cccc(O[C@H](C)C(=O)N2CCN(S(=O)(=O)CBr)CC2)c1	777778987	CEUMWFOXJLGEIY-CYBMUJFWSA-N	433.324	1.483	50	20	IDGD	
COc1ccc(Cn2ccc(NC(=O)C(=O)NNC(=O)COc3ccccc3F)n2)cc1	778707120	MSEIVWVHHCNMMB-UHFFFAOYSA-N	441.419	1.244	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(I)c(C(=O)NN=c2cc[nH]cc2)c1	780759693	MTSREXYOCCQYFW-UHFFFAOYSA-N	446.270	1.115	50	20	IDGD	
COc1ccc(NNC(=O)CCNS(=O)(=O)c2ccc(Br)cc2)nc1	781520056	ZYPOPBANUXKYSY-UHFFFAOYSA-N	429.296	1.664	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)N2CCC[C@@H]2C(=O)NNc2ncncc2Cl)o1	781835647	FRPMLVUNBNOKEQ-LLVKDONJSA-N	443.869	1.196	50	20	IDGD	
O=C(NNc1ccc(F)cc1F)C(=O)Nc1cccc(S(=O)(=O)N2CCOCC2)c1	783340471	QCJDUMUQSSQYLI-UHFFFAOYSA-N	440.428	1.068	50	20	IDGD	
CN(C)C(=O)CNC(=O)c1ccc(NC(=O)C(=O)NN(C)c2ccccc2)cc1Cl	783434785	ULDIOMDVWLQFST-UHFFFAOYSA-N	431.880	1.264	50	20	IDGD	
Cn1cc(CNC(=O)/C(C#N)=C\c2cn(CCC(N)=O)nc2-c2ccc(Cl)cc2)nn1	783619647	ZDJJDMAOLIGRLF-ZSOIEALJSA-N	438.879	1.431	50	20	IDGD	
CCC(CC)NC(=O)[C@H]1CN(C(=O)C(=O)NNc2ccc(C)nn2)c2ccccc2O1	783947522	CCMQCRGUMXBGBU-QGZVFWFLSA-N	426.477	1.327	50	20	IDGD	
O=C(NNc1ccc(Br)nc1)C(=O)Nc1cccc(Cn2cccnc2=O)c1	784809525	RFOMMXFTXPCTJH-UHFFFAOYSA-N	443.261	1.531	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)F)cc1)C(=O)Nc1cccc(-n2ccnn2)c1	784832933	HRBJCBDVYQVKCH-UHFFFAOYSA-N	436.400	1.345	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2ccc(F)c(S(C)(=O)=O)c2)cc(OC)c1OC	785682354	OYXBMFMSFVYXMX-UHFFFAOYSA-N	426.422	1.330	50	20	IDGD	
Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)NNC(=O)CNC(=O)c1ccco1	786053924	HRPWCLYENJEZPC-UHFFFAOYSA-N	425.195	1.450	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)CN2CCC(CNC(=O)OCc3ccccc3)CC2)cc1	786109460	WPVUBLLNZYSZJW-UHFFFAOYSA-N	449.511	1.958	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@@H]2C[C@H]2c2cc(OC)ccc2OC)c2ccccc2c1=O	788084134	YTKHYYOTAZUABK-FUHWJXTLSA-N	436.468	1.998	50	20	IDGD	
COc1ccc(OC)c([C@@H]2C[C@H]2C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1	788085911	FKMHYHKHYRMARK-FUHWJXTLSA-N	447.513	1.519	50	20	IDGD	
CN(NC(=O)Nc1ccc2c(c1)CC(=O)N2C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	788709720	GGRUTGIZWQTBDO-UHFFFAOYSA-N	446.508	1.847	50	20	IDGD	
COc1nn(C)cc1NC(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	789321676	ZBUIBTJQYSOMMY-UHFFFAOYSA-N	447.459	1.597	50	20	IDGD	
CCc1nc(NC(=O)C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)sc1C	789732019	KNPQGBYDJBQMED-UHFFFAOYSA-N	442.501	1.704	50	20	IDGD	
COc1c(C(=O)N(C)C)cc(Cl)cc1S(=O)(=O)NNC(=O)c1ccc(C#N)cc1	790052665	GPXISHIBRSBDJL-UHFFFAOYSA-N	436.877	1.545	50	20	IDGD	
CC(=O)N1CCCN(c2ccc(F)cc2NC(=O)C(=O)NNC(=O)c2ccccc2)CC1	790945297	OMNROBWRPHWMIR-UHFFFAOYSA-N	441.463	1.284	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)Cc2ccc(S(=O)(=O)N(C)C)cc2)cc1OC	792823382	DAAIQAFCLAHECX-UHFFFAOYSA-N	435.502	1.348	50	20	IDGD	
CN(C)C(=O)Nc1ccc(CNC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1	793497923	KDUBHKKFYQDLCR-UHFFFAOYSA-N	437.460	1.171	50	20	IDGD	
C=C(CBr)COC(=O)c1cccc(S(=O)(=O)N2CCN(C(C)=O)CC2)c1	795358994	UQPFRYFITBHWIF-UHFFFAOYSA-N	445.335	1.647	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)Nc1cc2c(cc1N1CCCCC1)n(C)c(=O)n2C	800593091	UKKRQZQWGZTEAJ-CQSZACIVSA-N	448.524	1.072	50	20	IDGD	
O=C(N=c1cc[nH]cc1)NNC(=O)[C@@H]1CCCN1C(=O)c1ccc(Br)cc1	802024848	WWUZCEJVTMMFIR-HNNXBMFYSA-N	432.278	1.724	50	20	IDGD	
CS(=O)(=O)c1nc(C(=O)NNC(=O)Nc2ccc(OC(F)F)cc2)c2ccccn12	802046352	LSLUKXZZAJEREO-UHFFFAOYSA-N	439.400	1.806	50	20	IDGD	
CN(CC(=O)NNc1cc(Cl)nc(N)n1)c1cc(Br)ccc1[N+](=O)[O-]	803097130	ZYERBMCVXVBSIT-UHFFFAOYSA-N	430.650	1.962	50	20	IDGD	
O=C(CN1CCN(C(=O)OCc2ccccc2)CC1)NNc1ccc2c(=O)[nH]ccc2c1	803436075	GIQPDDSDNIWROH-UHFFFAOYSA-N	435.484	1.926	50	20	IDGD	
CS(=O)(=O)c1cc(CNC(=O)NNc2nc3ccccn3n2)cc(C(F)(F)F)c1	807221689	FQTNDTKSVRMRCD-UHFFFAOYSA-N	428.396	1.978	50	20	IDGD	
O=C(NCCCn1cc(Br)cn1)NNC(=O)c1cnn(-c2ccccc2)c1	807613951	VRKRLRDBKVPPHB-UHFFFAOYSA-N	432.282	1.866	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)CN1C(=O)NC2(CCC(C(C)(C)C)CC2)C1=O	808045510	MNWKQQONWIJZBT-UHFFFAOYSA-N	440.541	1.450	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CN2CCN([C@@H]3CCN(C(=O)OC(C)(C)C)C3)CC2)cc1	808774378	URUUFYURYICZCO-LJQANCHMSA-N	445.564	1.383	50	20	IDGD	
CN1CCN([C@H](C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)c2ccccc2)CC1	812727739	UZSNIXCQQQTOKA-FQEVSTJZSA-N	431.562	1.369	50	20	IDGD	
CN(C)C(=O)COc1ccc(NC(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)cc1	812918942	NCJVFRAQZUTGMV-UHFFFAOYSA-N	435.506	1.553	50	20	IDGD	
CC(C)(C)OC(=O)N1CCOc2ccc(NC(=O)C(=O)NNC(=O)c3ccoc3)cc2C1	812980307	OWRLGAYLCIRNHJ-UHFFFAOYSA-N	444.444	1.809	50	20	IDGD	
CC(=O)Nc1cc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)ccc1C	813033534	YAZWNNDABQWPKL-UHFFFAOYSA-N	433.490	1.286	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CNC2(Cc3cccc(F)c3)CCOCC2)cc1OC	815152003	MIGTWOGGBAPGTE-UHFFFAOYSA-N	445.491	1.985	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2CCN(Cc3ccccc3)C2)c1	816810395	KRDBGDGYECYZTM-GOSISDBHSA-N	430.530	1.220	50	20	IDGD	
CCC[C@H](C(=O)OCC)S(=O)(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12	821127273	FUKOXENLPZZJLV-OAHLLOKOSA-N	438.506	1.273	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@H]2Cc3ccccc3CN2C(C)=O)cc(OC)c1OC	859242003	VLQIDRPNUORZEN-QGZVFWFLSA-N	427.457	1.447	50	20	IDGD	
COc1ccc2[nH]cc(CC(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)c2c1	915286196	DWYGDYBSRPVHPE-UHFFFAOYSA-N	430.486	1.431	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NC2CC(C)(C)NC(C)(C)C2)cc1	915881319	QYEVLGRIVUDBFC-UHFFFAOYSA-N	439.582	1.255	50	20	IDGD	
CS(=O)(=O)NCCNC(=O)NNC(=O)c1cn(-c2ccccc2)nc1-c1ccccc1	916294871	VDIKRYRGKUADNL-UHFFFAOYSA-N	442.501	1.033	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1ccc2c(c1)OCCO2)c1ccc(S(=O)(=O)N(C)C)cc1	918106103	YPMXEQUGVJYUDD-ZDUSSCGKSA-N	448.501	1.413	50	20	IDGD	
CC[C@H](NC(=O)NNC(=O)c1c(C)nc2ccccn12)c1ccccc1OCC(=O)NC	918220850	BTGXFXWTPOLGPZ-INIZCTEOSA-N	438.488	1.863	50	20	IDGD	
COc1ccc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c(OC)c1	918235614	QXLINNUFOAJGNR-UHFFFAOYSA-N	436.490	1.098	50	20	IDGD	
Cn1cc(S(=O)(=O)N2CCCCC2)cc1C(=O)NNC(=O)c1ccc(Cl)cc1O	918358828	AEPASGHKIORIEN-UHFFFAOYSA-N	440.909	1.634	50	20	IDGD	
CCc1noc2ncc(C(=O)NNC(=O)CN(C)S(=O)(=O)c3ccc(C)cc3)cc12	918397887	SMVTWLHOUCHEQQ-UHFFFAOYSA-N	431.474	1.175	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)CN3C(=O)N[C@](C)(c4ccccc4)C3=O)n[nH]2)cc1	918695206	PVMUQCDDNMMGKN-HSZRJFAPSA-N	446.467	1.613	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(NC(C)=O)ccc2O)c1	919807519	UBTWAIJBDCUSKU-UHFFFAOYSA-N	448.501	1.456	50	20	IDGD	
C[C@@H]1CN(c2ccc(NC(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)cc2F)C[C@@H](C)O1	920933182	RMMRPWFEHCXDGS-UPJWGTAASA-N	428.486	1.027	50	20	IDGD	
O=C(CCN1CCN(C(c2ccccc2)c2ccccc2)CC1)NNC(=O)[C@H]1CCOC1	921146179	MTZSVBHNTCKSOH-QFIPXVFZSA-N	436.556	1.968	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)[C@@H]2CC(=O)N(C3CCCCC3)C2)CC1	1116083993	MTGFXRXAFQJSBF-MRXNPFEDSA-N	436.553	1.962	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1ccnc(OC2CCC2)c1	1116408055	ABKKULXLMQEZTB-UHFFFAOYSA-N	437.500	1.232	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)NCC(=O)NNC(=O)Cc2cccc3ccccc23)cc1	1118208774	XDSSCEQEQMIUNB-UHFFFAOYSA-N	439.493	1.711	50	20	IDGD	
N#C/C(=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)N1CC(O)(C2CC2)C1	1320784065	YIEQEBQSQSFYPD-DHDCSXOGSA-N	439.903	1.969	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)NCCN2C(=O)COc3ccccc32)cc1OC	1324170670	NXKNYQYHXLQZAL-UHFFFAOYSA-N	428.445	1.464	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2nc3ncccn3n2)C1	1778586295	AKCDBOVWVHZWOZ-BXTJHSDWSA-N	434.928	1.659	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3c(C)nc4sccn34)C2)C1	1778721977	NAULKMQVPFLSLI-FZKQIMNGSA-N	426.926	1.402	50	20	IDGD	
C=CC(=O)N[C@@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@](C)(Cl)CCl)C2	1779534881	ILDNHBVROMUCHX-WTVLQJKYSA-N	434.364	1.427	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)cc1C	1780683237	ZRTCAVYKQUYGFE-HSZRJFAPSA-N	437.500	1.059	50	20	IDGD	
CC(C)CNC(=O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@](C)(Cl)CCl)C1	1780711387	AQBQRIHFSSNIEH-NIKGAXFTSA-N	436.380	1.509	50	20	IDGD	
O=C(COCc1ccccc1)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781327973	FUYNXEUBIVGLFK-SJLPKXTDSA-N	429.286	1.724	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1ccccc1F)C2	1782210774	JYFBDABBDMNHEH-AUSIDOKSSA-N	448.539	1.255	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3c(C)nn(C)c3C)CCO2)C1	1783344531	UNKCAYKGEABJHH-KBXCAEBGSA-N	427.343	1.654	50	20	IDGD	
C[C@H](O)C(=O)N1CC[C@]2(CN(C(=O)/C(C#N)=C/c3ccc(Br)cc3)CCO2)C1	1783527308	YCYDSPRYYUBRIP-CRSFEPEASA-N	448.317	1.567	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)CN(C)C(=O)OC(C)(C)C)CCO2)C1	1783532128	DLUXDNRFBUOXPI-UGSOOPFHSA-N	448.358	1.467	50	20	IDGD	
COC(=O)c1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](C)Br)C3)C2)cn1	1783534043	CXCNXPISCBTBTQ-XIKOKIGWSA-N	440.294	1.095	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cc(-c4ccccn4)[nH]n3)CCO2)C1	1783538065	SKGNYTQVBAZYSO-ORAYPTAESA-N	448.321	1.699	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H]3CCCN3Cc3ccccc3)C2)C1	1784241177	AAWOQKVRXDNINQ-JTAQYXEDSA-N	449.979	1.735	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)CCNC(=O)OC(C)(C)C)C2)C1	1785339093	YWTJVOUXPDDYHA-ACJLOTCBSA-N	448.358	1.515	50	20	IDGD	
CN(CCCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2)C(=O)OC(C)(C)C	1785582558	SGMJBPXCPUWKNO-MGPUTAFESA-N	447.960	1.063	50	20	IDGD	
Cn1ncc2cc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)CCBr)[C@H]4C3)ccc21	1786406788	DYDUHHLCGDQJIG-ZVZYQTTQSA-N	449.349	1.952	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC1(c2ccc(NC(=O)c3cccc(O)n3)cc2)CCC1	1787388500	QCTMBIPDWPFFQO-UHFFFAOYSA-N	425.489	1.908	50	20	IDGD	
Cc1nn2cc(CC(=O)N3CC[C@H]4CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]4C3)nc2s1	1787443739	RYKSXXMCXBXNCC-GZCFXPHUSA-N	429.905	1.156	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)c1cc2n(n1)CCC2	1788412990	PUFYNLZKVYNQPK-NOLJZWGESA-N	425.327	1.208	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)c1cc2cnccc2[nH]1	1788417452	NKOQYEOELUIBSA-JDFRZJQESA-N	435.322	1.941	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC1(c2ccc(NC(=O)c3cc(O)nc(O)c3)cc2)CCC1	1788429263	AVXYRDDZPJXYAU-UHFFFAOYSA-N	441.488	1.614	50	20	IDGD	
CCc1cc(C(=O)Nc2ccc(C3(NC(=O)c4ccc(B(O)O)cc4)CCC3)cc2)nn1C	1789921723	FRHDHRFOEXKTQC-UHFFFAOYSA-N	446.316	1.724	50	20	IDGD	
CCN(CC)C[C@@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]2C1	1789924884	FVAZEXFCMFPGBC-OLMNGRFOSA-N	436.366	1.635	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnn4c3OCCC4)[C@H]2C1	1790372267	JLUGWKIHRWSRNM-XPVILTJLSA-N	445.347	1.495	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)Nc3cnccn3)C[C@@H]21	1791056289	RAGQFGMOWSTTNS-MRLBHPIUSA-N	440.342	1.040	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc[nH]c4nccc3-4)C[C@@H]21	1791057158	FLXBONOUEYOIDU-APYUEPQZSA-N	435.322	1.891	50	20	IDGD	
C[C@@H](Br)C(=O)NC1(c2ccc(NC(=O)CN(C)C(=O)C(=O)O)cc2)CCC1	1791097424	AXXZGXMYFGQFIS-LLVKDONJSA-N	440.294	1.447	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3CCC[C@@H](C(=O)OC)C3)[C@H]2C1	1791245344	IOZQZSPNZMCHCF-COZGXFGHSA-N	428.957	1.963	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc4ccc(F)cn34)C[C@@H]21)C(Cl)Cl	1791296527	WENGRSJNUSSSFQ-JKOKRWQUSA-N	429.279	1.870	50	20	IDGD	
CCC[C@@H](NC(C)=O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)Br)C[C@@H]21	1792189462	VMTSSUJWUBHLNI-WGIXJMRHSA-N	432.359	1.054	50	20	IDGD	
COc1ccc([C@H]2C[C@@H]2C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)cc1	1796189948	NRQFBBWTROKSBN-PMNYKWLYSA-N	448.328	1.431	50	20	IDGD	
C=CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Cl	1796365382	WIORLJIJJMBKGG-XLWJZTARSA-N	433.908	1.580	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NO[C@H](c2ccccc2)C1	1797755852	KXSXBJRMVAWFGE-DMUMMCEESA-N	441.532	1.515	50	20	IDGD	
Cc1nc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)sc1C	1798440046	WDTKZUPIFLVLDT-BTTYYORXSA-N	428.518	1.324	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C13CCC(CC1)CC3)C2	1798443608	NGOQXHIQPVYUDI-SURIZHFBSA-N	425.533	1.907	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(C(C)C)[nH]n1	1798670839	SCWKTRBLUAJTON-OQMKEHIESA-N	427.343	1.910	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(C(F)(F)F)ccn1)c1ccc(B(O)O)cc1	1798877642	XNGVNBKSNJLHCX-BJWYYQGGSA-N	447.222	1.346	50	20	IDGD	
N#Cc1cc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Br)C3)ccc1F	1799326018	FPBSSWGGQNECBD-DLTLXFJOSA-N	442.260	1.520	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1n[nH]c3ccccc13)C2)[C@@H](F)Br	1799349493	HKOCFALSLSIJSB-YJKIEOBBSA-N	425.258	1.457	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](C)N1CCN(C)CC1	1799968773	VPQWAFFLLSCPHQ-NQNKBUKLSA-N	429.403	1.434	50	20	IDGD	
CC1(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)/C(C#N)=C/c2ccc(F)cc2F)COC1	1800330145	KQFUGZXSZMBTMO-ULMACSCCSA-N	431.439	1.498	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)NC(=O)OC(C)(C)C	1800597824	SUGAJCZNLSHKOR-OKWIKPQFSA-N	448.358	1.641	50	20	IDGD	
COc1cccc2[nH]cc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)c3cccc(B(O)O)c3)C4)c12	1801032496	ZYOGCRRNDGCMIP-BCDXTJNWSA-N	447.300	1.422	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccnc2c(O)cccc12)c1cccc(B(O)O)c1	1801143042	FQQSQONXPQDUMK-BCDXTJNWSA-N	445.284	1.186	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)Sc1ccccn1	1801323109	RKJOMNDWZWQTHO-XGYYKPKNSA-N	427.954	1.406	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)C1CC(F)(F)C1	1802632656	OOSAHMKUHPKSGR-QFBILLFUSA-N	443.259	1.126	50	20	IDGD	
CC(C)(CCl)C(=O)NC[C@H]1CCN(C(=O)CCN2C(=O)C=CC2=O)[C@@H]1c1cccnc1	1802898558	XTZZKEGZSIUBMB-OXQOHEQNSA-N	446.935	1.668	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cc(O)nc(Cl)c2)[C@H]1c1cccnc1)[C@H](O)CCl	1803142505	XOHVGBIQQCYPFT-QEORTHHSSA-N	439.299	1.755	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)NC(=O)OCC)[C@H]1c1cccnc1	1803691864	MIIOVGSQYANDII-NBOOPKSLSA-N	440.928	1.559	50	20	IDGD	
COc1ncc(C(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@H]2c2cccnc2)cc1C	1806097087	NXFVMQDGYNBIEM-JQHSSLGASA-N	432.908	1.713	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1807366951	WEIFCVKCJSMYDZ-YSIASYRMSA-N	443.740	1.489	50	20	IDGD	
Cn1ccc(CC(=O)NC[C@@H]2CCN(C(=O)[C@H](F)Br)[C@@H]2c2cccnc2)n1	1807518331	SXTPPGOUDKCWER-XKQJLSEDSA-N	438.301	1.754	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)c1ccc(O)c([N+](=O)[O-])c1	1810690316	DZIKJDATVGKTCX-WBAXXEDZSA-N	448.863	1.615	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC2(CCCN(C(=O)[C@H](CC)NC(N)=O)C2)CC1	1810822691	AGRNGXSURGANGC-KBPBESRZSA-N	431.375	1.838	50	20	IDGD	
Cc1cccc(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)c1	1811863459	VWBWAAZERSRVIA-GMAHTHKFSA-N	443.312	1.703	50	20	IDGD	
C=CC[C@H](C)C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1	1812588171	CCSFIYFQZLUDQJ-XAUMDUMWSA-N	436.516	1.612	50	20	IDGD	
CC(=O)C(C)(C)C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1813069549	ZRMZLIGZUAAOCC-XLIONFOSSA-N	431.537	1.076	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)CNC(=O)c3ccco3)sc2C1	1815655979	IZUQHDWVURJYIX-WDEREUQCSA-N	440.909	1.332	50	20	IDGD	
CN[C@H](CC(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](C)Br)[nH]n1)C(=O)O	1817368303	IBFPZGNRYISCBW-WCQGTBRESA-N	430.303	1.248	50	20	IDGD	
C[C@@H]1CCC[C@@H]1C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1	1819796979	KMIJOTFQFLKULC-UPJWGTAASA-N	442.545	1.804	50	20	IDGD	
C[Si](C)(C)OCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1nccnc1C(N)=O)CC2	1820167186	XWFBHDASNBFDBC-SNVBAGLBSA-N	448.581	1.109	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@H](O)CCl)CC2)c1nc(O)n2c1CCCC2	1820232797	KARVATUHRDDALA-BXKDBHETSA-N	439.925	1.207	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1CCc2nc(NC(=O)c3nccnc3C(N)=O)sc2C1	1821036822	NOEYNAXHGCWOPZ-SNVBAGLBSA-N	448.581	1.109	50	20	IDGD	
C=CCNC(=O)/C=C\C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1	1822998449	DICRASAPZYDOJE-VBMBPTLOSA-N	445.314	1.604	50	20	IDGD	
NC(=O)c1nccnc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)C(Cl)Cl)CC1	1829511751	TYDWSDKHWHCEEV-GFCCVEGCSA-N	428.320	1.613	50	20	IDGD	
C[C@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H](F)Br)CC1)n1cnnn1	1830381041	DZEIOTBDJODGGQ-MRVWCRGKSA-N	431.310	1.544	50	20	IDGD	
Cc1ccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)cn1	1831871417	DXNPEIPPKYTDFO-HXUWFJFHSA-N	429.565	1.996	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)C/N=C/c2ccco2)CC1	1831873522	NDDXAJIAOLDBFI-HSJQUHBMSA-N	445.564	1.691	50	20	IDGD	
CSCC[C@H](O)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1	1831898147	KGNAZNCCQQGQMA-MSOLQXFVSA-N	442.626	1.093	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)C[C@H]3CCCCO3)CCO2)C1	1832351496	PDCBUTGLTFVNON-GJYPPUQNSA-N	447.370	1.576	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3ccco3)CCO2)C1	1833052118	ISOOIEWBQFHDAX-KDOFPFPSSA-N	429.311	1.452	50	20	IDGD	
N#Cc1cccc(CCC(=O)NC2CCN(C3CCN(C(=O)[C@H](O)CCl)CC3)CC2)c1	1833238119	ZPXLDVMZBYAPMH-OAQYLSRUSA-N	446.979	1.662	50	20	IDGD	
CN1CCc2cc(C(=O)N3CCC(N4CCC(NC(=O)[C@H](O)CCl)CC4)CC3)ccc21	1833309917	DOUYVZHGECNLRB-OAQYLSRUSA-N	448.995	1.464	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3nccs3)CCO2)C1	1834431305	KVUIWQUICCMHLT-BLLLJJGKSA-N	432.340	1.244	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](F)Cl)CC2)CC1)c1cccn2c(O)nnc12	1835043507	RTJBUDYJXWULCA-OAHLLOKOSA-N	438.891	1.155	50	20	IDGD	
Cc1nnsc1C(=O)N1CCC(N2CCC(NC(=O)[C@@H](F)Br)CC2)CC1	1836412652	OXUZMPJHYDUJDA-CQSZACIVSA-N	448.362	1.722	50	20	IDGD	
Cc1cc(C(=O)N2CCC(OC3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)nn1C(F)F	1836718619	WWFVTVVOCPYCMQ-INIZCTEOSA-N	448.898	1.799	50	20	IDGD	
CC(C)(C)c1cc(C(=O)N2CCC(OC3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)[nH]n1	1836718657	YEJSCYCQZLQHCJ-KRWDZBQOSA-N	440.972	1.919	50	20	IDGD	
O=C(COc1cc(Cl)ccn1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1837652971	NLLGYABLPCNFIP-DOTOQJQBSA-N	436.267	1.105	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccnc(Cl)n3)CCO2)C1	1837919883	SKUVBCJKGCEGMH-ACJLOTCBSA-N	431.320	1.608	50	20	IDGD	
O=C(c1[nH]cc2c1CCC2)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1838454823	UPLSFZQSKVMHOG-YJBOKZPZSA-N	444.301	1.264	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ncc(OC)cc3F)C2)C1	1839143065	KLPQCKVBQWKXPX-LIRRHRJNSA-N	429.876	1.317	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(F)n3)C2)C1	1839153515	IXCGIHYQVNJIIQ-QZTJIDSGSA-N	434.295	1.527	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CCCOC3)C2)C1	1839967110	ANTWLEIBMZFBOF-VKJFTORMSA-N	433.343	1.043	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cccs3)C2)C1	1840032115	OAPQASVKQRCLAD-GUYCJALGSA-N	431.352	1.530	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3c[nH]c4ccccc34)C2)C1	1840154126	LZQZYLOHZAOHKP-GCJKJVERSA-N	449.935	1.421	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(C)cc3Cl)C2)C1	1840155965	GNQMEULQEOGSCP-XLIONFOSSA-N	445.343	1.972	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(F)c(C)cc3F)CCO2)C1	1840708342	CNIFAINZMRUARK-FOIQADDNSA-N	446.878	1.597	50	20	IDGD	
C[C@@H]1[C@@H](C(=O)N2CC3(CCCN3C(=O)[C@@H](O)CCl)C2)CCN1C(=O)OC(C)(C)C	1841354498	FBJHAIQTBUGLIJ-ILXRZTDVSA-N	429.945	1.435	50	20	IDGD	
COc1ccc(CC(=O)N2CC3(CCCN3C(=O)c3ccc(B(O)O)cc3)C2)c(Cl)c1	1843010554	BSMPOYDPQSYTFS-UHFFFAOYSA-N	442.708	1.088	50	20	IDGD	
CC(C)(C)c1ncccc1C(=O)N1CCCC12CN(C(=O)c1cnccc1C(=O)NN)C2	1843150396	MDIUOBKPMUTNTI-UHFFFAOYSA-N	436.516	1.508	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCCC12CN(C(=O)[C@H]1CCc3nc(O)nc(O)c3C1)C2	1845169382	FXZPIMBKXLMPFI-BBATYDOGSA-N	443.331	1.432	50	20	IDGD	
N#C/C(=C\c1ccc(Br)cc1)C(=O)N1CCCC12CN(C(=O)CNC(N)=O)C2	1845873284	VOXBPISOPNWYOZ-RIYZIHGNSA-N	446.305	1.228	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)CCCn1c(O)nc3ccccc31)C2	1846363502	MVQNFNQSYDOALO-OAHLLOKOSA-N	434.924	1.979	50	20	IDGD	
O=C(c1cc(Br)cc2[nH]ncc12)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl	1847562613	BQRRKIMOZQIXOV-SOUVJXGZSA-N	441.713	1.741	50	20	IDGD	
COc1ccc(Br)cc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl	1847565805	YURDTTRDZOXAGC-IHRRRGAJSA-N	431.714	1.873	50	20	IDGD	
Cc1cc(C)c(OCC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2cccc(B(O)O)c2)c(C)c1	1847733771	MXXSGMXVFUPAKF-SFTDATJTSA-N	436.317	1.186	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)C[C@H]1OCCc2ccccc21	1847758352	MLOXUGJQHXUCPZ-PCCBWWKXSA-N	449.511	1.205	50	20	IDGD	
COc1cc(C(=O)OCC(=O)NNC(=O)c2ccccc2)c([N+](=O)[O-])cc1OC(F)F	10209269	SAPMJPRRMQIIGN-UHFFFAOYSA-N	439.327	1.823	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)C[C@H](NC(N)=O)c2ccccc2)c2ccccc2c1=O	14044652	VWIHWRDVYURDNJ-KRWDZBQOSA-N	436.472	1.538	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2ccc3c(c2)NC(=O)[C@@H](C)S3)c2ccccc2c1=O	15939776	NYIFMNRIIJFTBB-LLVKDONJSA-N	437.481	1.924	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)CCc2nc(-c3ccsc3)no2)c2ccccc2c1=O	17190599	HNYJBKZAHMHXPU-UHFFFAOYSA-N	438.469	1.922	50	20	IDGD	
CN(C)c1ccc(CCC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc1	21783715	PUVLQKFIHUZKCR-UHFFFAOYSA-N	444.557	1.931	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)CCc1nc(-c2ccccc2)no1	21967360	JIKRNNJFOPZDNU-UHFFFAOYSA-N	442.501	1.732	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)CN2C(=O)c3ccccc3N3C(=O)CC[C@@]23C)c1	106058452	IUPNZKXMWGPTFY-QHCPKHFHSA-N	436.468	1.520	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)CCc1c(C)nc2c(C(N)=O)cnn2c1C	108111429	WZOCVGIAMMGSNC-UHFFFAOYSA-N	438.488	1.166	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cccn2C)cc1	115236591	GUAPBPVPAKAEDZ-UHFFFAOYSA-N	428.470	1.909	50	20	IDGD	
C[C@H](NC(=O)NN[C@@]1(C)CCS(=O)(=O)C1)c1cc(F)ccc1N1CCN(C)CC1	726280900	ZETXOSSJALRBMM-LIRRHRJNSA-N	427.546	1.020	50	20	IDGD	
COc1ccc(CN2C[C@H](C(=O)NNC(=O)c3ccc(OC)c(OC)c3)CC2=O)cc1	726496616	BXIJBWZMROEEAB-MRXNPFEDSA-N	427.457	1.522	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NCc2cccc(C(=O)NCCN(C)C)c2)cc1	727603878	IPSBDVZRYWXKPY-UHFFFAOYSA-N	427.505	1.196	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)CN2C(=O)c3ccccc3N3C(=O)CC[C@]23C)c(C)c1	728205658	WWGHKAJAJFZXHL-XMMPIXPASA-N	449.511	1.862	50	20	IDGD	
C[C@H](OC[C@H]1CCCCO1)C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	728214566	AJLSAQNGKXBTQY-FUHWJXTLSA-N	440.566	1.040	50	20	IDGD	
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC[C@@H](C(=O)NNc2nc(-c3cccnc3)no2)C1	728218394	ZQFKSFRLFBZMIB-CQSZACIVSA-N	446.493	1.016	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)c1ccc2c(c1)CC(=O)N2C	728402174	ZTNIZNUUOBAWIA-GFCCVEGCSA-N	434.456	1.158	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)c2ccc(-n3cnnn3)c(C)c2)c1	728527387	HMTBJFZNIZVYTK-UHFFFAOYSA-N	431.250	1.817	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NCC(=O)NNc2ccc(F)c(F)c2F)c1	728717390	TWQAETIGCRYBPG-UHFFFAOYSA-N	430.408	1.227	50	20	IDGD	
O=C1Nc2ccc(Br)cc2C1=NNC(=O)C1CCN(c2ncccn2)CC1	728783217	DUUQTWDTWBBOLH-UHFFFAOYSA-N	429.278	1.928	50	20	IDGD	
CCCS(=O)(=O)N1CCCC[C@@H]1C(=O)NNc1ccc(S(=O)(=O)C(F)F)cc1	728972210	HBNBQSQPAKFGPM-CQSZACIVSA-N	439.506	1.720	50	20	IDGD	
O=C(CCCNS(=O)(=O)c1ccc2c(c1)CCCC2)NNC(=O)Cc1cccnc1	728986205	JEXHHQNOAAOIPV-UHFFFAOYSA-N	430.530	1.409	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)c2cc(C)c(C)c(S(=O)(=O)N(C)C)c2)cn1	729693389	WQSXSVJDAZWHAT-UHFFFAOYSA-N	437.547	1.589	50	20	IDGD	
Cc1ccc2c(c1)C(=O)N(CC(=O)NNc1ccc(S(=O)(=O)NC3CC3)cc1)C2=O	730076019	WZBILQSCQZUUKO-UHFFFAOYSA-N	428.470	1.175	50	20	IDGD	
Cc1cc(S(C)(=O)=O)c(C)c(S(=O)(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c1	730203025	GBRVWDKZYWHGNN-UHFFFAOYSA-N	427.460	1.238	50	20	IDGD	
O=C(NCCOCC1CC1)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	731119158	OIUDGZBHADMHRW-UHFFFAOYSA-N	435.488	1.759	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)N1CCN(S(=O)(=O)c2cc(Cl)ccc2Cl)CC1	731848837	NTWHEEABZXLVBS-LLVKDONJSA-N	437.349	1.246	50	20	IDGD	
C[C@H]1CN(C[C@H](C)C(=O)NN=C2CCS(=O)(=O)c3cc(F)c(F)cc32)C[C@@H](C)O1	731924923	MVOGYYHUWPUVMM-RWMBFGLXSA-N	429.489	1.708	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)N1CCC[C@@H](NS(=O)(=O)c2cccc(F)c2)C1	732201397	ZELYVLZTVQMABG-GDBMZVCRSA-N	428.530	1.150	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)c3cc(C(N)=O)n(-c4ccccc4)n3)n[nH]2)cc1	732272106	HOWAPJTWKIHVTM-UHFFFAOYSA-N	429.440	1.745	50	20	IDGD	
CC(C)c1ccc(-n2c(NNC(=O)CC[C@@H]3NC(=O)NC3=O)nc3ccccc3c2=O)cc1	733263908	FXVFZRBXFCYSEP-SFHVURJKSA-N	448.483	1.940	50	20	IDGD	
CCOCCCn1c(NNC(=O)[C@H](C)Sc2nncn2C)nc2ccccc2c1=O	733268897	UFXWPAKZCPNEAL-ZDUSSCGKSA-N	431.522	1.576	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)CC[C@H]2NC(=O)N(c3ccc(C#N)cc3)C2=O)c1	733755228	VIOJTMXUVOTMRI-GOSISDBHSA-N	434.456	1.290	50	20	IDGD	
COc1cc(F)c([C@H](C)NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1OC	734013823	SVUCEZNMSWWNBT-NSHDSACASA-N	439.465	1.952	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)N[C@H]2CCN(C3CCN(C)CC3)C2)cc1OC	734284501	XCXYNZYGQDNOPF-SFHVURJKSA-N	447.580	1.987	50	20	IDGD	
Cc1ccc(S(=O)(=O)n2ccc(C(=O)NNC(=O)COc3ccc(C#N)cc3)c2)cc1	735460395	TZPPDOBLPMMPEG-UHFFFAOYSA-N	438.465	1.745	50	20	IDGD	
O=C(COCc1ccccc1)NNS(=O)(=O)c1cc(C(=O)O)ccc1Br	737755527	FSEBEZMCZCQNMX-UHFFFAOYSA-N	443.275	1.674	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@H](C(=O)NNC(=O)COCc2ccccc2)C(C)C)cc1	737923110	KUXKBBKZKUJFAW-FQEVSTJZSA-N	433.530	1.662	50	20	IDGD	
C#CCSCCNC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	740487997	UTDRSKBFUAODBL-UHFFFAOYSA-N	438.556	1.859	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)[C@H](O)c2ccc(Br)cc2)n1	740969781	FRYSFMOOPGXPNR-OAHLLOKOSA-N	442.291	1.181	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN(C(=O)COc2ccccc2)C1)c1ccc2c(c1)OCO2	741207429	XPUWSJBPXJTWFI-MRXNPFEDSA-N	425.441	1.494	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@@H](NC(=O)NNC(=O)CNC(=O)c1cccs1)C1CC1	741275326	MNDKOOJFJVIFEK-GFCCVEGCSA-N	425.511	1.112	50	20	IDGD	
CC(C)n1ccc(CC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)n1	742467550	DZMIYBFRJXMQSW-UHFFFAOYSA-N	433.534	1.642	50	20	IDGD	
CO[C@@H](CNC(=O)NNC(=O)c1csc(N2CCOCC2)n1)c1cccc(Cl)c1	743509351	CCBNCFFTQGEMPT-HNNXBMFYSA-N	439.925	1.965	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)N[C@H]3C[C@@H](C)N(c4cnn(C)c4)C3=O)cc2C1	743510744	CZZHBBWFJXUABV-JMSVASOKSA-N	430.534	1.744	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CN2CCN(C(=O)Cc3ccc(Cl)cc3)CC2)c1	744386320	BJJAQCWYQASPEW-UHFFFAOYSA-N	439.903	1.360	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1cn(-c2ccccc2)nn1	744621575	UFCXQWASGJNJOH-UHFFFAOYSA-N	428.474	1.045	50	20	IDGD	
COc1cc(C=NNC(=O)COc2ccccc2[N+](=O)[O-])cc(Cl)c1OCC(N)=O	745987478	ZPGSCKNWBOZOLC-UHFFFAOYSA-N	436.808	1.650	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2ccccc2Br)c1	746223020	QWDOGBRWUKUICH-UHFFFAOYSA-N	426.292	1.997	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)[C@@H]1CN(Cc2nc(O)c3ccccc3n2)CCO1	746239779	ICYYPMCXGIXPCU-SFHVURJKSA-N	437.456	1.006	50	20	IDGD	
CC(C)(C)OC(=O)[C@@H]1CN(C(=O)NNC(=O)c2cccc(Br)c2)CCO1	747508221	BHPJECXUNXRFBZ-ZDUSSCGKSA-N	428.283	1.846	50	20	IDGD	
Cc1c(C(=O)NNc2ccc(Br)cc2F)cnc2c1c(=O)n(C)c(=O)n2C	748185312	SBVMUDLPAJSWNA-UHFFFAOYSA-N	436.241	1.599	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(=O)n(CC(=O)NNc2cccc3cnccc23)c1	748762886	FMPNNQPTCGSYPT-UHFFFAOYSA-N	429.502	1.570	50	20	IDGD	
C[C@H]1NC(C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)=NN(c2ccccc2)C1=O	748835493	ZHOADBRWAPCHSF-LLVKDONJSA-N	442.426	1.639	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN(Cc2cccnc2)C1)c1csc(N2CCOCC2)n1	749161669	OFELHTIICSKLPK-MRXNPFEDSA-N	430.534	1.048	50	20	IDGD	
C[C@H](C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)C1CCCC1	749334515	HWPKLAWQYZIGTD-INIZCTEOSA-N	437.562	1.614	50	20	IDGD	
Cc1nn(-c2cncc3nnnn23)c(C)c1CC(=O)NNC(=O)c1cccc2ccccc12	749850437	WBNJZHBPWCHCMV-UHFFFAOYSA-N	441.455	1.479	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)[C@H]1CC(=O)N(c2cccc3ccccc23)C1	751209760	SEQVSEYZVWROHV-HNNXBMFYSA-N	436.493	1.832	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)c1ccc(CS(=O)(=O)C(F)F)cc1	751532512	DBBRPRUSPVIMMS-UHFFFAOYSA-N	436.234	1.989	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)[C@H]1CC(=O)N(CCOc2ccccc2Cl)C1	751927807	QDCWTZDOXILGER-AWEZNQCLSA-N	447.875	1.499	50	20	IDGD	
COc1cc(OC)cc(N2C[C@H](C(=O)NNC(=O)Cc3cn4ccccc4n3)CC2=O)c1	752354642	OXQIVCKDYCFBJE-CQSZACIVSA-N	437.456	1.095	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N2CCOC[C@@H](C)C2)cc1	754230859	WUCOMTUOPPENMI-GYKGCMEESA-N	437.500	1.836	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)NCC(=O)NNc2ccc(-c3ccccc3)nn2)cc1	754473387	JHGRGOSMIMXFEB-UHFFFAOYSA-N	425.470	1.768	50	20	IDGD	
CC(C)CNC(=O)c1ccc(NC(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)cc1Cl	756110522	NLMQULQSGSZEIP-NSHDSACASA-N	430.914	1.313	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)nc1)Nc1cc(N2CCCS2(=O)=O)ccc1F	756155010	LLGGZQCHTAVNQA-UHFFFAOYSA-N	427.845	1.881	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)cc1C	756208540	YRSOJLCOFGKVNA-UHFFFAOYSA-N	446.529	1.770	50	20	IDGD	
CN(CC(=O)NNC(=O)c1cccc(C#N)c1)[C@H]1CS(=O)(=O)c2ccc(Cl)cc21	756620159	UKKNKVKTRLMXCL-INIZCTEOSA-N	432.889	1.433	50	20	IDGD	
CCCS(=O)(=O)Nc1cccc(NC(=O)NNC(=O)c2nnc(O)c3ccccc23)c1	756683451	FCEUAHWEGSYLKN-UHFFFAOYSA-N	444.473	1.954	50	20	IDGD	
COC(=O)c1cc(NC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c(OC)c(OC)c1	756743423	UJUQVGZHOHBIJM-MRXNPFEDSA-N	431.401	1.483	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)c1cncc(I)c1	756854437	DNZUTHVTUIUVHW-ZDUSSCGKSA-N	425.182	1.287	50	20	IDGD	
COc1cc(OC)c(OC)cc1NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	757715139	JXCHMCLUQOYNNH-UHFFFAOYSA-N	427.417	1.426	50	20	IDGD	
O=C(Cc1cccc(OC(F)(F)F)c1)N1CCN(S(=O)(=O)CBr)CC1	758514083	YRMWDOHSSIFMNE-UHFFFAOYSA-N	445.257	1.954	50	20	IDGD	
CN(NC(=O)CN1C(=O)COc2ccccc21)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758786057	IVDFVGYSYJEJRX-UHFFFAOYSA-N	447.492	1.048	50	20	IDGD	
Cc1cc(C)nc(-n2nccc2NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)on2)n1	760278360	WQKDCQXQMXEHTK-UHFFFAOYSA-N	446.427	1.334	50	20	IDGD	
O=C(NNC(=O)c1c[nH]c2c(Cl)cc(Br)cc2c1=O)C(=O)N1CCCC1	760810560	JITVVGVOJVZGLJ-UHFFFAOYSA-N	441.669	1.327	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H]2CCCN(c3ccccc3F)C2=O)c1	761817210	LQLGMLWFTVLEGY-MRXNPFEDSA-N	448.476	1.369	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2cc(I)ccc2F)C[C@@H](C)O1	762442628	HTDDIEXIAPHPAT-PHIMTYICSA-N	449.264	1.691	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1cccc(Cl)c1-n1cncn1	763470049	FJTQJBOZHSSIMH-UHFFFAOYSA-N	429.780	1.229	50	20	IDGD	
COC(=O)c1c(F)cccc1NC(=O)C(=O)NNC(=O)c1cc2ccccc2cc1O	763525972	GAVLGXUWGYCEJL-UHFFFAOYSA-N	425.372	1.871	50	20	IDGD	
Cc1cc(Cl)ncc1NC(=O)C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	763530943	LGRYTLTXJFWXRS-UHFFFAOYSA-N	444.923	1.342	50	20	IDGD	
CN(C)C(=O)c1ccccc1NC(=O)C(=O)NNC(=O)COc1ccc(C(C)(C)C)cc1	763596273	UBYGUYANKQODBM-UHFFFAOYSA-N	440.500	1.851	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cccc(OCC(N)=O)c2)c(C)n1-c1ccccc1	763602432	RKURUVSWJGYMMB-UHFFFAOYSA-N	449.467	1.358	50	20	IDGD	
CCOC(=O)c1cc(CC)sc1NC(=O)C(=O)NNC(=O)c1c(C)nc2ccccn12	763627455	AAUOSSTUMOFEAG-UHFFFAOYSA-N	443.485	1.843	50	20	IDGD	
Cn1cnc2cc(NC(=O)C(=O)NNC(=O)COc3cccc(C(F)(F)F)c3)ccc21	763640249	UQVICNNWLYKDFE-UHFFFAOYSA-N	435.362	1.757	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(Br)c(C)c1	763663276	QIJHCCCJFQOAJM-UHFFFAOYSA-N	436.262	1.931	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccccc1O[C@@H]1CCOC1	763682995	YSLNJSNIZWRWDB-OAHLLOKOSA-N	443.456	1.418	50	20	IDGD	
CN(C)c1ncc(NC(=O)C(=O)NNC(=O)COc2ccccc2Cc2ccccc2)cn1	763718880	QBVCPGHRXYARSY-UHFFFAOYSA-N	448.483	1.298	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(Br)cc1F	763806911	IHTUOTMCWYSFPJ-UHFFFAOYSA-N	435.209	1.625	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)cc1Cl	763807091	JYLMDJZGVQCMFB-UHFFFAOYSA-N	446.847	1.402	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cc(C(F)(F)F)cnc2O)c1C	763851085	QHULLWKSHGOXFH-NSHDSACASA-N	440.378	1.976	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccccc1N1CCOC1=O	763865397	KHSYWZXNEFMHQF-GFCCVEGCSA-N	430.392	1.336	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2cccc(C[S@@](=O)C(C)(C)C)c2)n1	763892922	NETOVSRGIPESNU-SSEXGKCCSA-N	433.534	1.333	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3ccc(OCC(N)=O)cc3)cc2C1	763947422	BHODZHPCFYPFHK-NSHDSACASA-N	430.486	1.137	50	20	IDGD	
O=C(NNC(=O)c1cnccn1)C(=O)Nc1ccnn1Cc1cccc(Cl)c1Cl	764023969	HAGOAJWMGIGWQC-UHFFFAOYSA-N	434.243	1.428	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2ccnn2Cc2ccc(C)o2)cc1	764126190	GTVIHQSQFPPORT-UHFFFAOYSA-N	425.445	1.560	50	20	IDGD	
CCN(Cc1ccccc1NC(=O)C(=O)NNC(=O)Cc1ccccc1OC)C(C)=O	764136473	QZERJNONHXXWHK-UHFFFAOYSA-N	426.473	1.392	50	20	IDGD	
O=C(NNC(=O)c1cc(F)ccc1Br)C(=O)Nc1ccc(-n2ccnn2)cc1	764270019	BHAHNRUSJPPRAT-UHFFFAOYSA-N	447.224	1.569	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccccn2)cc1OCC(F)(F)F	764270724	RTCPPZVITIJKPT-UHFFFAOYSA-N	426.351	1.360	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)C(=O)Nc1ccccc1OCC(F)(F)F	764365804	CCUVSEGXGDBDSX-UHFFFAOYSA-N	425.363	1.930	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccccc2CS(=O)(=O)c2ccccc2)o1	764370128	NGOULAVSXSQRQI-UHFFFAOYSA-N	441.465	1.962	50	20	IDGD	
O=C1CSc2ccc(NC(=O)C(=O)NNC(=O)c3cc(-c4cccs4)[nH]n3)cc2N1	764382368	IDNLJHLURNOLNS-UHFFFAOYSA-N	442.482	1.582	50	20	IDGD	
COCCOc1cccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)c1	764386790	CRFJOMKINXMFPF-UHFFFAOYSA-N	441.419	1.641	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)CCC(=O)N2CCN(c3ccccc3)CC2)c1	764549134	YUUFFGSSGGGUQM-UHFFFAOYSA-N	440.500	1.594	50	20	IDGD	
Cn1c(=O)c2c(ncn2CC(=O)NN=Cc2sc3ccccc3c2Cl)n(C)c1=O	764812305	IQPBRFTWYMOFNK-UHFFFAOYSA-N	430.877	1.452	50	20	IDGD	
COc1ccc(O)c(C=NNC(=O)CN2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)c1	764815263	CKHIOUJPXYNWRK-UHFFFAOYSA-N	446.529	1.166	50	20	IDGD	
C[C@H](CC(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1)c1cccc(F)c1	765738539	LLHGYPGBIHOFSS-QGZVFWFLSA-N	426.492	1.925	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@@H](C)NC(=O)C3CCCCC3)CC2)cc1	765755778	SBMXVMREMQPFCS-LJQANCHMSA-N	443.592	1.345	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)c1nc(N2CCCC2)ncc1Cl	767288731	SUGZLDZUMPRKJD-UHFFFAOYSA-N	431.880	1.586	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)c1[N+](=O)[O-]	767430776	IQBNLZXILCUFKR-UHFFFAOYSA-N	425.401	1.969	50	20	IDGD	
CCc1ccc(S(C)(=O)=O)cc1C(=O)NNc1c(OC)cccc1S(C)(=O)=O	768636549	SYUSSYOIMFABIM-UHFFFAOYSA-N	426.516	1.822	50	20	IDGD	
CCCCOc1ccc(C(=O)NNS(=O)(=O)c2ccc(C(=O)OC)nc2)cc1OC	769626039	NQQIWYFKZJWBOH-UHFFFAOYSA-N	437.474	1.679	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNS(=O)(=O)c1cc(S(C)(=O)=O)sc1Cl	770631693	ANOYFLSWNMXWAD-UHFFFAOYSA-N	448.935	1.384	50	20	IDGD	
COc1ccc([C@H]2[C@H](C(=O)NNc3nc(O)c4cnn(C)c4n3)CCC(=O)N2C)cc1	770972010	OHIOQBPWVJJEOD-CJNGLKHVSA-N	425.449	1.130	50	20	IDGD	
Cc1ccc(-n2cnnc2SCC(=O)NNc2nc(O)c3cnn(C)c3n2)cc1C	770990631	NZASMFQDGSJTPC-UHFFFAOYSA-N	425.478	1.502	50	20	IDGD	
COc1ccccc1[C@@]1(C)NC(=O)N(CC(=O)NNc2ccccc2S(C)(=O)=O)C1=O	771571856	QWCUNOSZHUUBDY-HXUWFJFHSA-N	446.485	1.009	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)CCc1nc(O)c2c3c(sc2n1)C[C@@H](C)CC3	771950572	ZJFXPLLBEBAJBD-QWRGUYRKSA-N	434.518	1.943	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)CCC(=O)N1CCN(c2ccccc2)CC1	772194018	YGOWARHDCFTOSN-KRWDZBQOSA-N	432.521	1.241	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NCCN(C)S(=O)(=O)c2cccs2)cc1	772627735	WZIHIECBIPAPNC-UHFFFAOYSA-N	426.520	1.086	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@H](C)C(=O)NNC(=O)[C@@H](C(C)C)N1CCCS1(=O)=O	772629272	DCROVMCYBKHQMK-GDBMZVCRSA-N	445.969	1.932	50	20	IDGD	
COC(=O)[C@@H](C)n1cccc1C=NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	774574690	IITZXUAXMHACCK-OAHLLOKOSA-N	448.501	1.007	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)N[C@@H](C)CS(=O)(=O)c2ccc(C)cc2)c1	776191885	FGWGRAXLUBRABO-AWEZNQCLSA-N	435.502	1.819	50	20	IDGD	
COC(=O)Nc1ccc(S(=O)(=O)NNC(=O)[C@H]2Cc3ccccc3O2)cc1[N+](=O)[O-]	777619616	LZNDFBJRCMLDPU-OAHLLOKOSA-N	436.402	1.086	50	20	IDGD	
Cc1cc(C)n(-c2ccc(C(=O)N3CCN(S(=O)(=O)CBr)CC3)cc2)n1	777777056	DCXBIKAVEVPJIF-UHFFFAOYSA-N	441.351	1.929	50	20	IDGD	
Cc1nn(CC(F)(F)F)c(C)c1[C@@H](C)C(=O)NNC(=O)CNC(=O)c1cccnc1	778509459	SWIKTTHNTUFRPC-SNVBAGLBSA-N	426.399	1.138	50	20	IDGD	
O=C(NNc1ccccc1OC(F)(F)F)c1ccc(S(=O)(=O)N2CCOCC2)o1	779216198	BWGHYLKYDHRGTO-UHFFFAOYSA-N	435.380	1.956	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)Nc1ccnn1Cc1ccc(Br)cc1	779458241	CLXKKNAFPRTEPY-LBPRGKRZSA-N	440.298	1.898	50	20	IDGD	
COc1ccc(Cn2nccc2NC(=O)NNC(=O)c2cccnc2)c(OC)c1OC	779459869	NLLRYWDFYXMALC-UHFFFAOYSA-N	426.433	1.819	50	20	IDGD	
N#Cc1ccc(S(=O)(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)c(Cl)c1	779829396	IXMCQLWSRCUKHL-UHFFFAOYSA-N	449.297	1.136	50	20	IDGD	
CN1CCCCC/C1=N/S(=O)(=O)c1cccc(NC(=O)C(=O)NN=c2cc[nH]cc2)c1	783370159	MCLXPGCQSBPMBO-BWAHOGKJSA-N	444.517	1.178	50	20	IDGD	
NC(=O)c1ccc(F)c(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)c1	783409889	YZKKZIHNUKDIAR-UHFFFAOYSA-N	448.354	1.300	50	20	IDGD	
Cc1c([N+](=O)[O-])cn(CC(=O)NNC(=O)c2cccc(Cl)c2)c(=O)c1Br	783923610	ACVMUMFGAJXQBU-UHFFFAOYSA-N	443.641	1.942	50	20	IDGD	
CSc1nnnn1-c1cccc(NC(=O)C(=O)NNc2ccc(Br)cn2)c1	784338661	FDEMCMGVQOPCOF-UHFFFAOYSA-N	449.294	1.624	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)[C@H]1CC=CC[C@@H]1C(=O)N1CCOCC1	784395084	XIZOZBXTCGSXCP-OALUTQOASA-N	448.545	1.012	50	20	IDGD	
O=C(NC[C@H]1CCCO1)Nc1ccc(NC(=O)C(=O)NNc2cccc([N+](=O)[O-])c2)cc1	784828220	NSEQMUQFDAYDNG-QGZVFWFLSA-N	442.432	1.977	50	20	IDGD	
O=C(NNc1ccnc(F)c1)C(=O)Nc1cc(Br)ccc1N1CCOCC1	784852466	ZROZYVSOHZFJSX-UHFFFAOYSA-N	438.257	1.902	50	20	IDGD	
O=C(NNc1ccc(C(F)(F)F)nn1)C(=O)Nc1ccc2c(c1)C(=O)N(CC1CC1)C2=O	784886766	WSXWORIRNVWKGB-UHFFFAOYSA-N	448.361	1.583	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1)C(=O)Nc1cccc(S(=O)(=O)N2CCNC(=O)C2)c1	785238792	JGTNGCQRTUFLNX-XNTDXEJSSA-N	428.445	1.492	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCc2ccc(CCN(C)C)cc2)nc1	786252011	QFFPNHCHHFVYHT-UHFFFAOYSA-N	434.566	1.699	50	20	IDGD	
Cn1cc(-c2ncccc2NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cn1	786416112	BJXGSESMGCUOKN-UHFFFAOYSA-N	430.428	1.068	50	20	IDGD	
COCCc1ccccc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	786416164	DGZVOYCBFSMCBW-UHFFFAOYSA-N	425.420	1.804	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(N(C)C)c2)cc1C(=O)N(C)C(C)C	787541121	MGPIKYHJOZCCMX-UHFFFAOYSA-N	439.516	1.941	50	20	IDGD	
O=C(c1ccc(O[C@H]2CCOC2)cc1)N1CCN(S(=O)(=O)CBr)CC1	790013787	KAZHUXYZUMBGGZ-HNNXBMFYSA-N	433.324	1.294	50	20	IDGD	
CC(C)(C)n1cc(C(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)nn1	790197786	AEIRDUKRHSYLHE-UHFFFAOYSA-N	448.530	1.970	50	20	IDGD	
COc1cc(Cl)c(S(=O)(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1C(=O)O	790385726	IIXJZDAYZYTVCW-AWEZNQCLSA-N	442.833	1.196	50	20	IDGD	
COC(=O)c1ccc(NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c(N(C)C)c1	792416621	YIXZDQDQDNMRHV-UHFFFAOYSA-N	441.492	1.399	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNC(=O)NNC(=O)c1cccc2cccnc12	792873067	QDLLIAVJXGBDQF-UHFFFAOYSA-N	436.428	1.136	50	20	IDGD	
Cc1ccc(C)c(S(=O)(=O)N2CCN(C(=O)NNC(=O)c3cccc(C)n3)CC2)c1	793228475	MPLJJSCWZVQRDJ-UHFFFAOYSA-N	431.518	1.368	50	20	IDGD	
COCC1(C(=O)NNC(=O)COc2ccccc2O)CCN(C(=O)OC(C)(C)C)CC1	793460757	DUZOLLCENNJMRF-UHFFFAOYSA-N	437.493	1.582	50	20	IDGD	
CC(=NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1)c1cccc(N2CCC2=O)c1	794920914	XQDDUHFJUWDWKT-UHFFFAOYSA-N	433.512	1.722	50	20	IDGD	
O=C(COC(=O)CCSCc1ccccc1)NNC(=O)[C@@H]1COc2ccccc2O1	795847194	ADGBCRCYVLQOIO-SFHVURJKSA-N	430.482	1.841	50	20	IDGD	
C[C@@H]1CCN(C(=O)OC(C)(C)C)[C@H](C)[C@@H]1NCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	796644375	KNDHIZCOSWEBKS-HBUWYVDXSA-N	449.508	1.979	50	20	IDGD	
COc1cc2c(cc1S(=O)(=O)NNC(=O)c1ccc(Cl)cc1F)OCC(=O)N2	797431275	JQCXKYPYGXJMTC-UHFFFAOYSA-N	429.813	1.442	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CCc2c(C)nc3c(C#N)cnn3c2C)cc1C	798308380	XKDPYVTXVHBPMT-UHFFFAOYSA-N	433.472	1.553	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3ccc(C(N)=S)cc3)cc2)CC1	798335477	ODHQEBLUKQPEOP-UHFFFAOYSA-N	433.559	1.014	50	20	IDGD	
NC(=O)c1cc(Br)cc(S(=O)(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c1	799518716	QGULNRXFLQKMCL-UHFFFAOYSA-N	443.235	1.080	50	20	IDGD	
CCOC(=O)COc1ccc(NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1	800560400	SKXRRMKJJJWDIH-UHFFFAOYSA-N	439.428	1.342	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CC[S@](=O)c2ccc3c(c2)OCCO3)cc1	801110742	FPBDAHDTPDQAQF-PMERELPUSA-N	431.470	1.050	50	20	IDGD	
COc1ccc(Cl)c(NC(=O)NNC(=O)C2=NN(c3ccccc3)C(=O)[C@@H](C)N2)c1	802111695	PEZBTNRORJFXRS-LLVKDONJSA-N	430.852	1.840	50	20	IDGD	
COc1ccc(C2=NO[C@H](CNC(=O)NNC(=O)c3ccc4c(c3)OCCO4)C2)cc1C	802360202	ZMKDKNDXPJCQBE-INIZCTEOSA-N	440.456	1.912	50	20	IDGD	
CC(C)C(Cn1cccn1)=NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	802704411	LWSAYJGYJWEMAE-UHFFFAOYSA-N	447.561	1.665	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)no1	804031240	XPHFFOJSOTWXFH-UHFFFAOYSA-N	429.458	1.928	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc3oc(O)nc3c2)c1	805153507	CTIZBIVLQRLZHY-UHFFFAOYSA-N	432.458	1.639	50	20	IDGD	
Cc1c(C(F)(F)F)nn(C)c1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccccc1F	806975140	OWALDZBSZLHMQG-VIFPVBQESA-N	431.346	1.440	50	20	IDGD	
CC(C)Cn1ncc(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)c1C1CC1	806992249	CRUBRBFKZKLPGU-UHFFFAOYSA-N	437.504	1.632	50	20	IDGD	
Cc1ccccc1[C@@H]([C@H](C)NC(=O)NNC(=O)c1csc(N2CCOCC2)n1)N(C)C	807406713	AZRFYVFUPAKOIS-MAUKXSAKSA-N	446.577	1.924	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(C(N)=O)ccc2OCC(F)F)cc1F	810388133	RQISPWOXOJYLQY-UHFFFAOYSA-N	438.362	1.277	50	20	IDGD	
N#Cc1ncn(-c2ccccc2NC(=O)C(=O)NNc2ccc(Cl)cc2[N+](=O)[O-])n1	810392495	WLUIRZLCZXJVBU-UHFFFAOYSA-N	426.780	1.782	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)[C@@H]2CCN(c3ccccc3F)C2)cc1OC	811375259	CJYYQQFVOVOMQD-OAHLLOKOSA-N	445.447	1.674	50	20	IDGD	
CCCOc1ccc(C(=O)NNS(=O)(=O)c2cccc(CC(=O)OC)c2)cc1OC	811677698	HFOYBELAILAWEG-UHFFFAOYSA-N	436.486	1.823	50	20	IDGD	
C[C@H](NC(=O)c1n[nH]c2ccccc12)C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	812732804	BFMXVUNJGASHIT-LBPRGKRZSA-N	430.490	1.075	50	20	IDGD	
Cn1nncc1CNC(=O)/C(C#N)=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	813793683	XLXQMFFZQVKMMD-ZSOIEALJSA-N	438.879	1.431	50	20	IDGD	
CNC(=O)Oc1cccc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CC[C@@H](C)C3)c1	815567059	NMTYVAJLOXHTEA-LLVKDONJSA-N	430.486	1.991	50	20	IDGD	
O=C(NNc1ncncc1F)c1ccc(NS(=O)(=O)c2ccc3nc(O)[nH]c3c2)cc1	817083928	YEFQJPVPSHYORR-UHFFFAOYSA-N	443.420	1.755	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)[C@@H]2CCCN2S(=O)(=O)c2ccc(C)s2)cc1	893642795	MBSSINZZPLNZAS-INIZCTEOSA-N	437.543	1.744	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Cn2nc3ccccn3c2=O)ccc1OCCC(C)C	894368333	ZGXMJAJDZPGGNM-UHFFFAOYSA-N	427.461	1.391	50	20	IDGD	
O=C(NNC(=O)c1cn2ccccc2n1)c1cccc(S(=O)(=O)N2CCCCC2)c1	912643206	IKWOYCZSPNWDMV-UHFFFAOYSA-N	427.486	1.584	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)[C@H]2CCCCN2S(=O)(=O)c2ccc([N+](=O)[O-])cc2)n1	913001521	YKZLWUSDBJFJAI-MRXNPFEDSA-N	434.478	1.688	50	20	IDGD	
O=C(COC(=O)C1CCN(C(=O)CCc2ccccc2)CC1)NNC(=O)c1ccccc1	915024376	RSRWBTXBDFXTCV-UHFFFAOYSA-N	437.496	1.862	50	20	IDGD	
COc1ccc([C@H](CNC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)N(C)C)cc1OC	915897276	BOIJCBWCCIZTTL-INIZCTEOSA-N	431.449	1.859	50	20	IDGD	
O=C(CN1CCCS1(=O)=O)NNC(=O)c1ccc(COc2ccc(Cl)cc2)cc1	916034192	VJRCEMXKBQWBAK-UHFFFAOYSA-N	437.905	1.716	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)NCC[C@](O)(c1nccn1C)C(F)(F)F	916377577	DDRLYIRVSTUOPN-DIFFPNOSSA-N	447.389	1.497	50	20	IDGD	
C[C@H]1CCCN(CCCCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)C1	916503999	PQZZUAMTXOMJBH-INIZCTEOSA-N	439.582	1.393	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2ccc(-n3cccn3)cc2)c1	916519214	HQRNBVPLTUCFEX-UHFFFAOYSA-N	442.501	1.267	50	20	IDGD	
COc1cccc(/C=C(/C#N)C(=O)OCC(=O)c2c(N)n(CC(C)C)c(=O)n(C)c2=O)c1	916613228	UKOXGQAXLIGZRY-NVNXTCNLSA-N	440.456	1.127	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCC[C@H](C(=O)Nc2ccccn2)C1	917400615	XHEFKFUFTRFMOZ-AWEZNQCLSA-N	445.907	1.855	50	20	IDGD	
O=C(NN=Cc1cc(Br)c2c(c1)OCCO2)c1ccc(-n2cnnn2)cc1	917540510	TYVBKLQABNNDOA-UHFFFAOYSA-N	429.234	1.960	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)CN1CCCC1	918220701	KOYVYSHFZLFRLC-INIZCTEOSA-N	437.566	1.147	50	20	IDGD	
O=C(CCCCc1ccc(Br)cc1)NNC(=O)N[C@@H]1CCS(=O)(=O)C1	919886765	UPZWNVPGIZZNKX-CQSZACIVSA-N	432.340	1.679	50	20	IDGD	
O=C(CCNS(=O)(=O)c1cccc([N+](=O)[O-])c1)NNC(=O)c1c[nH]c2ccccc12	920339698	BFNUPWNDGFILQM-UHFFFAOYSA-N	431.430	1.206	50	20	IDGD	
CNC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1ccc(Br)cc1	920745313	LTPFWBCJNSDKEQ-UHFFFAOYSA-N	427.280	1.824	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)NCCCN2CCN(c3ccccc3Cl)CC2)n1	920813244	DMIDEDMNQLUMJR-UHFFFAOYSA-N	447.971	1.696	50	20	IDGD	
COC(=O)Cc1csc(NC(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)n1	920930629	SGOZURJAUDWRAH-UHFFFAOYSA-N	444.473	1.616	50	20	IDGD	
NC(=O)[C@H]1CC(C(=O)NNC(=O)Cc2nc(-c3ccccc3)cs2)=NN1c1ccccc1	935338330	LRMHCJKQJJQYJR-GOSISDBHSA-N	448.508	1.620	50	20	IDGD	
N#Cc1ccc(N2C[C@@H](C(=O)NNC(=O)c3cc(Br)ccc3O)CC2=O)cc1	1116151034	YOIKJEDUIPYRDB-LBPRGKRZSA-N	443.257	1.840	50	20	IDGD	
COc1cc(Br)c(OC)c(C(=O)NNC(=O)CNC(=O)c2cccnc2)c1	1116290476	UZTAZZCAOFXQCB-UHFFFAOYSA-N	437.250	1.052	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(C(=O)CNC(=O)NNc2ccc(C(C)(C)C)nn2)CC1	1318939601	ZVEMLAWHRCEXQQ-UHFFFAOYSA-N	435.529	1.480	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2ccc(S(=O)(=O)/N=C3/CCCN3C)cc2)cc1	1320118171	GMNOLWQOVUNMDP-MOHJPFBDSA-N	445.501	1.975	50	20	IDGD	
CN1CCN(C(C)(C)CNC(=O)CCC(=O)C(C#N)=C2N(C)c3ccccc3N2C)CC1	1322846597	QBKYSYFGQDTNNT-UHFFFAOYSA-N	438.576	1.799	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)[C@@H]2CC23CCS(=O)(=O)CC3)cc1	1323048580	MAGCRRDTVCAEPB-HNNXBMFYSA-N	449.558	1.083	50	20	IDGD	
COc1c(C(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)cnn1-c1ccccc1	1344718134	NISPGGDXKUCGJA-UHFFFAOYSA-N	429.458	1.751	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cn4ncccc4n3)C2)C1	1777953660	QQDIFNIHCOHEMU-ROUUACIJSA-N	426.304	1.409	50	20	IDGD	
Cc1nn2cc(CC(=O)N3CC[C@H]4OCCC[C@@]4(CNC(=O)[C@H](F)Cl)C3)nc2s1	1778023173	XWCLKLYXSTVPLZ-QIIPPGSGSA-N	443.932	1.690	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4c(c3)CNC4=O)C2)C1	1778725697	FLEZCJIZCPRWCP-WOJBJXKFSA-N	440.327	1.610	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(C)n(C(F)F)n2)C1	1780162701	MCOBVKJHPONZPY-ZBQZNYHESA-N	448.898	1.968	50	20	IDGD	
CN1CCC[C@H](C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)CO[Si](C)(C)C)C3)C1	1780574014	NSBBFLYFEAAKIR-WAOWUJCRSA-N	425.646	1.694	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)c3cccn4c(O)nnc34)CCO2)C1	1781227574	MUYOQIYCBSIQMF-ZWKOTPCHSA-N	442.303	1.115	50	20	IDGD	
CC1(C)CCC(CC(=O)N2CC[C@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)CC1	1781404530	YRJUXOHSISHAGW-DEOSSOPVSA-N	442.365	1.416	50	20	IDGD	
C/C=C(\C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2	1781708623	PRDJDTGBDPUISY-JAZDDDIHSA-N	429.521	1.601	50	20	IDGD	
CCn1nc(C)cc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](Cl)COC)C1	1782172961	RYCSEAAPVBYUKN-XAUMDUMWSA-N	426.945	1.593	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnn4cccc(F)c34)C2)C1	1782552336	WOKLAIRIDOFNNQ-XIKOKIGWSA-N	439.285	1.700	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnc4c(c3)CCNCC4)C2)C1	1782728602	ZRPSKAUIRTZDRZ-XMSQKQJNSA-N	434.968	1.621	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)C3(O)CCC3)[C@H]2C1	1783509652	VRQQJSCICAEHDR-QXKUPLGCSA-N	431.371	1.548	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)CCO2)C1	1783880142	GHZLRTHZHUKSCF-QAPCUYQASA-N	429.832	1.431	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cc3ccsc3[nH]1)CCO2	1783937295	RITZBQXTZULZQB-FQEVSTJZSA-N	433.534	1.046	50	20	IDGD	
CC(C)(C)OC(=O)NC1(C(=O)N2CCO[C@@]3(CCN(C(=O)C(Cl)Cl)C3)C2)CC1	1783951604	CRSIIGJWJGJGQL-QGZVFWFLSA-N	436.336	1.677	50	20	IDGD	
Cc1nc2cccc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]4C3)c2s1	1784090720	LONMGVXDWFXXBV-CSFVBSKPSA-N	437.949	1.798	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3=CCCS3)[C@H]2C1	1784571458	VVXWPCFDICYCRJ-GLYSVQQSSA-N	445.545	1.121	50	20	IDGD	
Cc1nnc(CCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]32)s1	1785325576	QOCUTKJFEYZOCP-WZTLGTBRSA-N	449.404	1.995	50	20	IDGD	
CCC[C@H](Cl)C(=O)Nc1ccc(C2(NC(=O)CN(CCO)CCO)CCC2)cc1	1786446749	PJEQAMRQMUXTLH-SFHVURJKSA-N	425.957	1.815	50	20	IDGD	
COc1nccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)Br)C[C@@H]32)c1F	1787139750	WQKYEQUSRYRVER-IMIFBBOLSA-N	444.301	1.606	50	20	IDGD	
C[C@@H]1Oc2ccc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]4C3)cc2NC1=O	1787447884	IJDZSJNVWRUJKY-KMNSEVKQSA-N	439.871	1.534	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3(C)CCC3)C[C@@H]21	1787507507	YRVMJQFQPDHKIJ-SMKMMKTPSA-N	429.521	1.290	50	20	IDGD	
CC(C)n1cnc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)Br)C[C@@H]32)n1	1787671855	PQBVFFZDBGQNRQ-XUXIUFHCSA-N	428.331	1.236	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cnc4ccccn34)C[C@@H]21	1788762194	OVMPNYSUWJIMTK-WDSOQIARSA-N	444.608	1.708	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3CCCN(C)C3)[C@H]2C1	1789740770	KKPNBLRBLWZIRF-QEOTZNIISA-N	430.387	1.339	50	20	IDGD	
CC(C)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(N3CCOCC3)cc1)C2	1792782174	WKVOQKLYCAXHQO-OPVJXMOQSA-N	449.979	1.991	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)[C@H]1C[C@@H]1c1ccc(F)c(F)c1	1793044301	FHYLUAZGDAXXMZ-DXAJAJGGSA-N	428.863	1.258	50	20	IDGD	
O=C(Cn1ccc2sccc2c1=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2	1794044018	HHVLTQIVWJFZBC-QHBPRCKVSA-N	444.340	1.456	50	20	IDGD	
CCc1c(Br)c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](O)CCl)C3)nn1C	1796408093	UWUKWOWAKXDXPZ-NOHGZBONSA-N	447.761	1.597	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Cl)C3)C1	1797220237	ZJMWLVFNNVWZHH-QMIVOQANSA-N	433.908	1.367	50	20	IDGD	
COc1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](O)CCl)C3)c([N+](=O)[O-])cc1O	1799307189	HITHVSAQQHZSGZ-DDIVZENXSA-N	427.841	1.161	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3cccnn3c1)C2)[C@@H](F)Br	1799347180	MNLGXINKEBTUML-AYRXBEOTSA-N	425.258	1.228	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccn2nccc12	1800995196	WOQBVADGDBBURK-CKFWPPNZSA-N	447.499	1.720	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)Cc2ccccc2)[C@@H]1c1cccnc1)[C@H](O)CCl	1803146502	BHVLIHFTDNEWJB-MTQWCTHYSA-N	431.920	1.291	50	20	IDGD	
CN1N=C(C(=O)NC[C@H]2CCN(C(=O)C(C)(C)CCl)[C@H]2c2cccnc2)CCC1=O	1804116169	YPUSBZRSXYWUGQ-QAPCUYQASA-N	433.940	1.961	50	20	IDGD	
C[C@H](NC(=O)c1ccccn1)C(=O)N1CC[C@H](CNC(=O)[C@H](F)Cl)[C@H]1c1cccnc1	1808322764	XHNFEELEPTXDFO-NZPGVSJUSA-N	447.898	1.835	50	20	IDGD	
Cc1nc2ncccn2c1C(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1	1809294500	KIYXGKGSXAXYNQ-JZXOWHBKSA-N	442.907	1.352	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC2(CCCN(C(=O)CNC(=O)c3ccco3)C2)CC1	1810138853	CADPYCRTUYLCMY-HNNXBMFYSA-N	425.913	1.494	50	20	IDGD	
Cc1ccn(C)c1C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1811606632	LYNVDDVPOQNGLM-DENIHFKCSA-N	446.316	1.042	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1	1812362764	DXJZQBRNOYLGRC-SLBVQIDZSA-N	427.885	1.249	50	20	IDGD	
CC[C@@H](NC(C)=O)C(=O)N1CC[C@H](CNC(=O)[C@H](C)Br)[C@H]1c1cccnc1	1812864552	WBLWXELPJCVNQA-WBQNTZJQSA-N	439.354	1.786	50	20	IDGD	
Cc1cnoc1C(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1813073862	PKGWVSAYDIAXTB-QFBILLFUSA-N	428.493	1.071	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)Cc3ccn(C)n3)sc2C1	1815553526	QPRCZQXARAOWOX-VHSXEESVSA-N	426.340	1.815	50	20	IDGD	
Cc1nocc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1816523085	QFOICORECKRYGH-MRXNPFEDSA-N	438.448	1.324	50	20	IDGD	
CS(=O)(=O)c1ccc(C(=O)N[C@@H]2CCc3nc(NC(=O)[C@@H](F)Cl)sc3C2)nc1	1817117943	QIOQCVKJVFYMDL-AMIZOPFISA-N	446.913	1.702	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)CC2CCOCC2)[nH]n1)c1cccc(B(O)O)c1	1817475328	OAHNZNAUIJDGDR-IBGZPJMESA-N	440.309	1.212	50	20	IDGD	
CC(C)=NO[C@@H](C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1	1817477155	NPFNOHWCYPSAQD-KBXCAEBGSA-N	441.297	1.196	50	20	IDGD	
Cc1cc(C)nc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)c1	1817726049	MLIGUKSOOBGMDA-HXUWFJFHSA-N	447.304	1.721	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@H](O)CCl)CC2)c1cnc2ccccc2n1	1817952268	AKFDXTTYLGFLAQ-MEBBXXQBSA-N	431.905	1.912	50	20	IDGD	
CC(C)O[C@@H](C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1819504052	MKZULOJIVYVXBH-KSSFIOAISA-N	428.298	1.209	50	20	IDGD	
CC(C)O[C@@H](C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1819504104	ODJXHSSFUHJNSY-KSSFIOAISA-N	428.298	1.209	50	20	IDGD	
Cc1cnoc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1820068196	MQQZOOHFJUZNGA-OAHLLOKOSA-N	438.448	1.324	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H]2CNC(=O)C2)[nH]n1	1822090676	NDXVWIRFROLMEN-GMXVVIOVSA-N	426.315	1.711	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnn3c2CCC3)[nH]n1	1822415689	PCVZWCNHYDXSQG-QGZVFWFLSA-N	442.524	1.231	50	20	IDGD	
Cc1nccn1[C@H](C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1	1822883141	DICSSEXUEIFWMM-RHSMWYFYSA-N	444.540	1.541	50	20	IDGD	
O=C(N[C@@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1)c1ccnnc1O	1823006843	IWYFXHOQPZMDFU-LHLIQPBNSA-N	430.259	1.555	50	20	IDGD	
CC[C@H](C)[C@H](O)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1	1824547939	DGTWTQBADMMERC-BEVDRBHNSA-N	445.564	1.325	50	20	IDGD	
O=C([C@@H]1CCCCO1)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827049365	RZRHSSMVUJRTSC-RTWAWAEBSA-N	428.338	1.169	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC[C@H]1C1CCN(C(=O)C(F)(F)C(F)F)CC1	1827055528	BGDJUMQUINQYEF-INIZCTEOSA-N	444.234	1.500	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2nc[nH]c2[N+](=O)[O-])CC1	1827651426	XBYQNMNUXZITCH-KBPBESRZSA-N	427.889	1.805	50	20	IDGD	
Cc1n[nH]c(C)c1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1	1829165871	HPMFPMZLLUTBJT-HXUWFJFHSA-N	438.337	1.253	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)o1	1830535849	UQHTYPSLRSHBRC-ACJLOTCBSA-N	429.311	1.689	50	20	IDGD	
CCc1oncc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2	1830538005	TVNCFWTZLGEQSC-UGSOOPFHSA-N	444.326	1.338	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3cnc4ccccn34)CCO2)C1	1830654667	BBOWCOINTJFFSO-GCJKJVERSA-N	448.951	1.741	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H]2CCCS2(=O)=O)CC1	1831657243	UWIABWKUGKJAOH-NUEKZKHPSA-N	449.411	1.967	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3cc(F)ccn3)CCO2)C1	1832855995	VWECHNFIKPLUJC-YLJYHZDGSA-N	427.904	1.627	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1)[C@H]1CCCCO1	1833109226	GWGCZEMKKMCEED-QGZVFWFLSA-N	430.387	1.912	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1)C1CCOCC1	1834544208	HTKSYIDSQJHBCB-UHFFFAOYSA-N	430.387	1.770	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)c3cnccc3Cl)C2)C1	1834823264	LVYNCUIDMJAFBK-QGZVFWFLSA-N	446.729	1.590	50	20	IDGD	
Cn1nc(C(=O)N2CCC(OC3CCN(C(=O)[C@H](O)CCl)CC3)CC2)c2c1CCC2	1836717078	GXQHDGSVOUMVDK-GOSISDBHSA-N	438.956	1.121	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc4nncn4c3)CCO2)C1	1837012446	ORJREZBMDAPJBH-HXUWFJFHSA-N	435.912	1.064	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(F)c3F)C2)C1	1837714829	PPUPIYBDQXEPIV-HXUWFJFHSA-N	442.535	1.886	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCC(OC2CCN(C(=O)CS(C)(=O)=O)CC2)CC1	1837770528	XUJMHKVTRAYKNT-KRWDZBQOSA-N	443.393	1.266	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(-n4cccn4)nc3)CCO2)C1	1838120248	QJVHDUCPFOMHAH-LAUBAEHRSA-N	447.923	1.355	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@H]3CC[C@H](O)CC3)CC2)CC1	1838785449	GGYREHNVTANDPK-BXWFABGCSA-N	430.973	1.790	50	20	IDGD	
C[C@H](C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2)c1ccccn1	1839156160	DEAXBADPFDRACP-CWFSZBLJSA-N	444.359	1.878	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3c[nH]c(C)c3)C2)C1	1839964159	ITJFGCCHHAVXMM-QAPCUYQASA-N	428.327	1.567	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3C[C@]3(F)Cl)C2)C1	1839966541	IKKWXRFWMNQUFZ-GVAFMPQTSA-N	441.725	1.541	50	20	IDGD	
Cc1nc(C)c(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)o1	1840033873	SZOXIZODCALJEQ-GTNSWQLSSA-N	430.299	1.145	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)c(C)n1C	1840034539	OLGAGQQNKBOZCJ-AUUYWEPGSA-N	442.354	1.495	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(OC)ccc3F)C2)C1	1840156142	JFBPHYCSCKXHGQ-JXFKEZNVSA-N	444.887	1.158	50	20	IDGD	
Cc1nccn1[C@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1	1840494061	OQRSERKZLVXOCF-NIKGAXFTSA-N	447.363	1.445	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3ccccc3F)CCO2)C1	1840547814	WWZMGJRYIQCZPG-DYESRHJHSA-N	442.915	1.469	50	20	IDGD	
O=C(Nc1ccc(C(=O)N2CC3(CCCN3C(=O)[C@@H](O)CCl)C2)cc1)c1ccco1	1841353310	PRPYOYYGTRBRAG-INIZCTEOSA-N	431.876	1.949	50	20	IDGD	
C[C@H](Br)C(=O)N1CC2(CCCN2C(=O)[C@@H]2CCN2C(=O)OC(C)(C)C)C1	1841766474	QFYQOAAZIPNRHM-STQMWFEESA-N	430.343	1.983	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)C2CCN(Cc3ccccn3)CC2)C1	1842094905	GTQKQNHNAGOSDK-IBGZPJMESA-N	434.968	1.751	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)c2c(Cl)ccc(Cl)c2O)C1	1845476366	LRANXZPDIMJHOD-UHFFFAOYSA-N	449.099	1.510	50	20	IDGD	
Cc1cc(C(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)cc2c[nH]nc12	1845605258	NTTXPQMUDAQRCR-UHFFFAOYSA-N	433.472	1.001	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)c1cc(OC)c(OC)c([N+](=O)[O-])c1)C2	1846363866	INCKUMPQCRNMNB-ZDUSSCGKSA-N	441.868	1.683	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2cnccc2C(=O)NN)cc1Cl	1847362796	YTRZBGZTRSCKCY-ROUUACIJSA-N	427.892	1.776	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC[C@H]2[C@@H]1CCN2C(=O)C1CCC(C(F)(F)F)CC1	1847985824	GQQLWTGCZFNPHE-MZQWUDBDSA-N	438.255	1.551	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cccc(OC(F)F)c2)cc1	15902100	GBKMQGIRRCWNHD-UHFFFAOYSA-N	427.429	1.678	50	20	IDGD	
CCOC(=O)/C(C#N)=C/NNC(=O)c1cccc(S(=O)(=O)Nc2ccc(OC)cc2)c1	18988592	HHDSSHSHMQKYBN-FYWRMAATSA-N	444.469	1.701	50	20	IDGD	
CCn1c(CCC(=O)NNc2nc(C)cc(C)n2)nc2cc(S(=O)(=O)N(C)C)ccc21	22233656	KWOMOPRISYSQGS-UHFFFAOYSA-N	445.549	1.789	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCc2ccco2)cc1C(=O)NNC(=O)c1ccccc1O	22259404	WXUIPKUPRRDLGW-UHFFFAOYSA-N	429.454	1.847	50	20	IDGD	
COc1cc(C)c(S(=O)(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)cc1OC	23143919	JTXXXOMNLYBPSZ-UHFFFAOYSA-N	440.474	1.661	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNS(=O)(=O)c2ccc3c(c2)C[C@H](C)N3C(C)=O)c1	28679308	ARUNYFPMVAXLRL-LBPRGKRZSA-N	433.486	1.625	50	20	IDGD	
C[C@@H](NC(=S)NNC(=O)N[C@H]1CCS(=O)(=O)C1)c1ccc(Cl)cc1Cl	726476202	GXIBCPVXQULOPU-SCZZXKLOSA-N	425.363	1.920	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)C[C@@H]2CCS(=O)(=O)C2)c2ccccc2c1=O	728214184	ADVLOPUKWFCHQG-AWEZNQCLSA-N	434.518	1.173	50	20	IDGD	
O=C(CCn1nc(O)c2ccccc2c1=O)NNC(=O)c1cc(F)ccc1Br	728550190	YDUSPQPWCZVUJN-UHFFFAOYSA-N	449.236	1.855	50	20	IDGD	
COc1cc(CNC(=O)NNC(=O)c2cccc(OC(F)F)c2)ccc1OCC(N)=O	728746216	RIAZGMVDPVWNOS-UHFFFAOYSA-N	438.387	1.305	50	20	IDGD	
COc1ccc(N2CCN(CCCNC(=O)NNC(=O)c3cccc(C#N)c3)CC2)cc1	728953057	LRKKKIIHPZJWMB-UHFFFAOYSA-N	436.516	1.723	50	20	IDGD	
CC(C)OCCCn1c(NNC(=O)C[C@H]2CCS(=O)(=O)C2)nc2ccccc2c1=O	729279854	RMEBZMZWHACFQX-OAHLLOKOSA-N	436.534	1.480	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)CCS(=O)(=O)c2ccc3c(c2)CCC3)cn1	729691920	FTGZWSRSBSGQIV-UHFFFAOYSA-N	434.543	1.761	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2ccc(C)c(C(=O)NNC(=O)Cc3cc[nH]n3)c2)cc1	730102903	RWTXFBSGLUSILX-UHFFFAOYSA-N	443.485	1.531	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)NCC1CCN(S(=O)(=O)c2ccccc2)CC1	731361743	VRPDDTQYCAKQDT-UHFFFAOYSA-N	448.520	1.800	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)NCC(C)(C)NS(C)(=O)=O)N(C)c2ccccc21	731651473	OZUFMVNVUAOZAO-UHFFFAOYSA-N	433.534	1.101	50	20	IDGD	
COC(=O)C[C@@H]1c2cc(OC)c(OC)cc2CCN1[C@@H](C)C(=O)NNC(=O)CC(C)C	732197013	JPYDWQPJRYAAQY-WMLDXEAASA-N	435.521	1.748	50	20	IDGD	
COC(=O)N1CCC(NC(=O)NNC(=O)c2ccc(OC)c(Br)c2)CC1	732244308	CSNXBFULXLAOJZ-UHFFFAOYSA-N	429.271	1.633	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)CCNC(=O)N2CCc3ccccc3C2)cc1	732263637	IJNHYALKHGJBLQ-UHFFFAOYSA-N	425.489	1.413	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2ccc(C(=O)NNC(=O)c3cnn(C)c3)cc2)cc1C	735473028	JZNWYWJWBAIWKD-UHFFFAOYSA-N	427.486	1.913	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)[C@H](C)N2C(=O)[C@H]3CCCC[C@H]3C2=O)cc1C	736758022	RWOZWZCIVWFMCJ-MELADBBJSA-N	449.529	1.487	50	20	IDGD	
CCCCS(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)c2ccccc2OC)cc1	737756547	GIKKDFVVTUJHII-UHFFFAOYSA-N	441.531	1.860	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)[C@H](C)NC(=O)c2cc3c(C)nn(C)c3s2)c1	743295668	QOWZEGPRAZWVRH-LBPRGKRZSA-N	444.517	1.330	50	20	IDGD	
Cc1ccc(OC[C@H](C)NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1	743350906	HFLWASPBGQUHGW-KRWDZBQOSA-N	448.545	1.722	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NC2CCCC2)cc1S(=O)(=O)Cc1cc(C)no1	744052806	TUCAPOCJRDELOF-UHFFFAOYSA-N	436.490	1.852	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)CNC(=O)NCc2ccc(Cl)cc2)c1	744941827	OMLVSSXBJBGSKG-UHFFFAOYSA-N	443.847	1.015	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)c2sccc2S(=O)(=O)N2CCC(CO)CC2)n1	745491033	DTZGUFGRZZLZRF-UHFFFAOYSA-N	425.536	1.305	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)N[C@@H]1C[C@@H](C)N(c2ccccc2)C1=O	745881403	IVQOMPHAHGMRKJ-NVXWUHKLSA-N	426.473	1.989	50	20	IDGD	
C[C@H](C(=O)NNc1nc(-c2ccc(Cl)cc2)no1)N1C(=O)[C@H]2[C@H](C1=O)[C@H]1CC[C@H]2O1	746256376	PFBBBTWTGCYIJI-LXOGICJWSA-N	431.836	1.384	50	20	IDGD	
O=C(CCCNS(=O)(=O)c1ccc2c(c1)CCCC2)NNC(=O)Cc1ccncc1	747429279	KSPHOVQRTQXRRX-UHFFFAOYSA-N	430.530	1.409	50	20	IDGD	
O=C(CSc1ccccc1C(=O)NNC(=O)C(=O)N1CCCC1)NCC1CCCCC1	748245967	ASJZHSQNFDUSDI-UHFFFAOYSA-N	446.573	1.859	50	20	IDGD	
O=C(NCc1ccc(OC2CCCCC2)nc1)NNC(=O)c1ccc(-n2cnnn2)cc1	750327628	SXBZCEBIQSEVOD-UHFFFAOYSA-N	436.476	1.913	50	20	IDGD	
O=C(COC(=O)c1ccn(-c2c(F)cccc2F)n1)NNC(=O)c1cccc([N+](=O)[O-])c1	750383646	YJHBFHBGFAMTEQ-UHFFFAOYSA-N	445.338	1.677	50	20	IDGD	
Cc1cnc([C@H](C)NC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)s1	750659877	DMFJFRNZCXNWNF-ZDUSSCGKSA-N	439.567	1.170	50	20	IDGD	
N#Cc1ccc(S(=O)(=O)NNC(=O)[C@@H]2Cc3ccccc3CN2Cc2ccccc2)cn1	751276583	UFUONEQWENSFFF-QFIPXVFZSA-N	447.520	1.890	50	20	IDGD	
CCc1cc(Br)ccc1NNC(=O)[C@@H](C)NS(=O)(=O)c1cnn(C)c1	753185613	UMACWYUIVQZZCJ-SNVBAGLBSA-N	430.328	1.555	50	20	IDGD	
O=C(NCCCc1nc(-c2ccc(F)cc2)no1)NNC(=O)C(=O)Nc1ccccn1	753265394	XYOJHVUWCCQURN-UHFFFAOYSA-N	427.396	1.172	50	20	IDGD	
CCCC[C@H](NC(=O)[C@@H](C)NC(=O)C(C)(C)C)C(=O)NNC(=O)c1ccc2c(c1)OCO2	755038027	IPWILCRBWUMJGQ-HIFRSBDPSA-N	448.520	1.402	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2cc(C)nn2[C@H]2CCS(=O)(=O)C2)c(OC)c1	755534027	NQRJAXYZRDBXBJ-LBPRGKRZSA-N	437.478	1.035	50	20	IDGD	
COCCOc1cc(NC(=O)NNC(=O)c2nnc(O)c3ccccc23)ccc1OC	755694832	GNEAPJQDGXZKIQ-UHFFFAOYSA-N	427.417	1.836	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1ccc2c(c1)CCN2C(=O)OC(C)(C)C	756309049	FIVWVOSRHFJWDN-NSHDSACASA-N	441.510	1.075	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)Nc1ccc(Cl)cc1OCC(F)(F)F	756573369	AOPXUERSIXQSQN-QMMMGPOBSA-N	429.804	1.869	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)Nc1cccc(CSC2CCOCC2)c1	756594244	QEAAVEHLXAMZKZ-CQSZACIVSA-N	427.548	1.686	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2cnn(Cc3ccccn3)c2)c2ccccc2c1=O	756739065	LJFHFQBLBOKGEI-UHFFFAOYSA-N	432.444	1.523	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)ccc1-n1nnnc1C(C)C	758016055	QZHIPIGBIFUDMF-UHFFFAOYSA-N	447.463	1.536	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1ccc2c(c1)CCC(=O)N2C	758589949	MJCWOMBZLMCDDP-UHFFFAOYSA-N	445.859	1.876	50	20	IDGD	
COc1cc(OC)cc(N2CCCN(CC(=O)NNC(=O)c3ccc(F)cc3)CC2)c1	758744925	TWRSRYWORBSFRP-UHFFFAOYSA-N	430.480	1.816	50	20	IDGD	
CN(NC(=O)CCNC(=O)Cc1ccccc1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758782704	XGYDFZQGQQIIBM-UHFFFAOYSA-N	447.536	1.371	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)NC[C@H]2CN(Cc3ccccc3)CCCO2)c1	759234375	YBNPZTWAQUBQHU-NRFANRHFSA-N	442.516	1.939	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H]1[C@H]1COCCC1=NNC(=O)N[C@@H]1CCS(=O)(=O)C1	762418673	RNWOSPZFFWTNBW-IJEWVQPXSA-N	444.554	1.265	50	20	IDGD	
Cc1ccccc1-c1cc(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)n(C)n1	763576924	DSDPPXGUIYTFJU-SFHVURJKSA-N	435.440	1.321	50	20	IDGD	
O=C(CSc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1cnn(-c2ccccc2)n1	763731657	BLAGWSUPDSGOTK-UHFFFAOYSA-N	430.877	1.799	50	20	IDGD	
O=C(CC12CC3CC(CC(C3)C1)C2)NNC(=O)C(=O)Nc1cnn(C[C@H]2CCCO2)c1	763736954	NJBSHTYHONFVQQ-XCLLZBPDSA-N	429.521	1.755	50	20	IDGD	
Cc1nn(-c2ccc(C#N)cc2)c(NC(=O)C(=O)NNC(=O)C2=S=C3CCCC3=C2)c1C	763785822	SYISDJNVSXVQOH-UHFFFAOYSA-N	448.508	1.649	50	20	IDGD	
CC(C)(C)c1ccc(C(=O)NNC(=O)C(=O)Nc2cc(F)cc(S(N)(=O)=O)c2)cc1	763799184	PAFBONUTRNCRAM-UHFFFAOYSA-N	436.465	1.170	50	20	IDGD	
CC(C)(C)c1nc2cc(NC(=O)C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)ccc2o1	763922353	VZTYVNWECQTUJH-UHFFFAOYSA-N	448.443	1.501	50	20	IDGD	
Cc1cc(N2CCOCC2)ccc1NC(=O)C(=O)NNC(=O)Cc1ccc(Cl)cc1	763931961	MPAZQUPFYVYCBB-UHFFFAOYSA-N	430.892	1.814	50	20	IDGD	
O=C(NNC(=O)c1ccc(Br)s1)C(=O)Nc1ccc(-n2cccn2)nc1	763940634	LSZXQCCGODMCJL-UHFFFAOYSA-N	435.263	1.491	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cccc3ccccc23)cc1NS(C)(=O)=O	764052756	WSYDMGPTDZDJDP-UHFFFAOYSA-N	440.481	1.919	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cccc(Br)c2)cc1C	764062772	CWOJKOSNSIVIBA-UHFFFAOYSA-N	434.246	1.944	50	20	IDGD	
COc1cccc(-c2cc(NC(=O)C(=O)NNC(=O)[C@@H]3Cc4ccccc4O3)n(C)n2)c1	764153058	HVVYGBGAFODXFA-SFHVURJKSA-N	435.440	1.185	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)C(=O)Nc1ccc(C(=O)N2CCc3ccccc32)cc1	764263811	LXIFCILYOZKSRA-UHFFFAOYSA-N	443.463	1.613	50	20	IDGD	
C[C@H]1CN(c2ccccc2NC(=O)C(=O)NNC(=O)COc2ccccc2O)C[C@H](C)O1	764278120	RNAPBVJILLJPJH-GJZGRUSLSA-N	442.472	1.171	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)CCc2ccccc2O)ccc1N1CCOCC1	764288014	CHZBEBYIBYXRPP-UHFFFAOYSA-N	426.473	1.256	50	20	IDGD	
COCC[S@@](=O)Cc1cccc(NC(=O)C(=O)NNC(=O)c2cc3ccccc3o2)c1	764330996	KPUWMHCOQNIVPG-WJOKGBTCSA-N	443.481	1.728	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)CCCc2cccs2)ccc1N1CCCC1=O	764342064	TXMHHQWYVWMGGA-UHFFFAOYSA-N	444.513	1.992	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc(C)cc3F)n[nH]2)cc1OC	764378011	GCPMYALEBFIVQE-UHFFFAOYSA-N	441.419	1.941	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1cccc(Cl)c1SC(F)F	764401809	XMEJYBOBDRTSES-QMMMGPOBSA-N	425.841	1.792	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCC2(N3CCOCC3)CC2)cc1Br	764780761	SHWZHHGAFIRWSD-UHFFFAOYSA-N	427.299	1.267	50	20	IDGD	
Cc1cccc(S(=O)(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)c1	765119422	QCLOABICTWTMJI-UHFFFAOYSA-N	436.965	1.776	50	20	IDGD	
CC(C)(C)OC(=O)NNC(=O)C(=O)Nc1ccc(Br)cc1S(C)(=O)=O	765398312	GHZZFKMORLEZAM-UHFFFAOYSA-N	436.284	1.347	50	20	IDGD	
C[C@H](CCOc1ccccc1)C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765737004	CZYOCGARHHOJFL-LJQANCHMSA-N	438.528	1.697	50	20	IDGD	
O=C(NNC(=O)c1ccc(=O)n(-c2ccccc2F)n1)c1cc(-c2ccc(F)cc2)[nH]n1	765882262	STTGXVDIXNPHFX-UHFFFAOYSA-N	436.378	1.976	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1ccc(C(=O)N2CCC[C@@H](C)C2)cc1C	766271698	OWQXIYYXWBPFAJ-CYBMUJFWSA-N	426.477	1.748	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)C3=NO[C@@H](c4ccccc4)C3)CC2)cc1	766639837	AQHFDNZKDKICHP-JOCHJYFZSA-N	435.528	1.778	50	20	IDGD	
CC(C)(C)C(=O)NCCC(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	766664987	ZZQDZWXUNKHGOH-UHFFFAOYSA-N	437.972	1.157	50	20	IDGD	
CCCn1nc(C(=O)NN=C(CNS(C)(=O)=O)c2ccccc2)c2ccccc2c1=O	766686967	HVKCLQHQRHIFBE-UHFFFAOYSA-N	441.513	1.490	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)N[C@H]1CC(=O)N(c2ccc(Cl)c(F)c2)C1	766864451	RGQLGEKODONMRA-ZDUSSCGKSA-N	445.838	1.865	50	20	IDGD	
O=C(COC(=O)c1ccc2c(c1)nc(O)n2CC(F)(F)F)NNC(=O)c1cccs1	767476544	LTJDDTRIYKHVKN-UHFFFAOYSA-N	442.375	1.984	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)C1	767778923	FPMNVXHSAWDPLI-WMLDXEAASA-N	435.477	1.390	50	20	IDGD	
CC(C)(O)C(=O)NNC(=O)Cc1csc(NC(=O)c2ccc(Br)o2)n1	768260349	VONNIIAGITYCSD-UHFFFAOYSA-N	431.268	1.212	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)C3=NN(c4ccccc4)[C@@H](C(N)=O)C3)n[nH]2)c1	768265135	UBEYBILTIIWSIA-HXUWFJFHSA-N	445.483	1.575	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)N[C@H](C)[C@@H]2CN(C)CCO2)c2ccccc2c1=O	770435550	OELVKZUVMGVJFC-QAPCUYQASA-N	444.536	1.250	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)Nc1ccn(CCN2CCOCC2)n1	770484476	LETIPGKVSOIJRX-AWEZNQCLSA-N	436.900	1.489	50	20	IDGD	
CCS(=O)(=O)NC1CCN(C(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)CC1	770646002	BQADMWMIUZNYGQ-LBPRGKRZSA-N	432.930	1.252	50	20	IDGD	
CC(C)(C)C(=O)N1CSC[C@@H]1C(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772888785	MOLDAESICCELNV-CYBMUJFWSA-N	426.926	1.051	50	20	IDGD	
CCC(CC)[C@@H](C(=O)NNC(=O)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1)N1CCOCC1	773413735	IVBWACMENGACER-MSOLQXFVSA-N	440.585	1.918	50	20	IDGD	
CC[C@H](C)NS(=O)(=O)c1cccc(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2)c1	773643535	AXLGGYIEFHXDBC-LBPRGKRZSA-N	435.462	1.753	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)/C=C/c2cnc(OC)nc2)c2ccccc2c1=O	773742398	VFWBFBAZEVTSPQ-ZHACJKMWSA-N	436.472	1.860	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)NC(=O)CS2	774010281	SFLQKUDRUIPOKF-SNVBAGLBSA-N	448.888	1.938	50	20	IDGD	
C[C@@H](NC(=O)NNc1cccc(S(C)(=O)=O)c1)c1cccc(S(=O)(=O)N(C)C)c1	776619789	STTIXSHWALOKEN-CYBMUJFWSA-N	440.547	1.728	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)N[C@H]2CCN(c3ccc(F)c(Cl)c3)C2=O)cc1	777753299	VYQUFLXNFZQUHB-KRWDZBQOSA-N	445.838	1.865	50	20	IDGD	
O=C(NC[C@@H]1COC2(CCOCC2)O1)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1	777755180	OGOGRQPZXSELNG-GFCCVEGCSA-N	439.412	1.528	50	20	IDGD	
CCn1c(CCC(=O)NNc2cccc(OC)n2)nc2cc(S(=O)(=O)N(C)C)ccc21	780772634	UZYXFMPPKXGPDK-UHFFFAOYSA-N	446.533	1.786	50	20	IDGD	
COC(=O)c1cc(Cl)cc(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)c1	782888220	USJUKXDJFZVEBW-UHFFFAOYSA-N	443.847	1.342	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)cnn1CC(C)C	783263006	GXZHAKFIODVMLP-UHFFFAOYSA-N	437.526	1.011	50	20	IDGD	
Cc1ccc(Br)cc1NC(=O)C(=O)NNC(=O)CNC(=O)c1cccs1	784004912	LVUOCFRXVWKNQU-UHFFFAOYSA-N	439.291	1.335	50	20	IDGD	
CC(C)C[C@H](C(=O)OCC(=O)NNC(=O)c1cccs1)N1C(=O)[C@H]2CC=CC[C@@H]2C1=O	784474086	FGCJYQTZHKVNLK-SOUVJXGZSA-N	447.513	1.418	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)NC(C)(C)C)c(C)n1	784833638	QGXOZVYZWWSTIS-UHFFFAOYSA-N	435.506	1.557	50	20	IDGD	
CS(=O)(=O)c1ccc(-c2csc(CC(=O)NNC(=O)Cc3cccnc3)n2)cc1	784937097	YGLNJMRDGVWQLY-UHFFFAOYSA-N	430.511	1.541	50	20	IDGD	
COC(=O)c1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)Cc1cn2ccccc2n1	785066481	BUFQEPQZPMGIKT-UHFFFAOYSA-N	429.820	1.103	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2cccc(OCCS(C)(=O)=O)c2)cc1Cl	785118903	XQFDDMDKSKMGTF-UHFFFAOYSA-N	441.893	1.854	50	20	IDGD	
Cc1ccc(C(=O)NCC2CC2)cc1NC(=O)C(=O)NNC(=O)COc1ccccc1F	785990381	FQKSIEHLUHINTI-UHFFFAOYSA-N	442.447	1.439	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H]2CCc3cc(C#N)ccc32)c1	787422667	BERHCGXBWZLGIF-GOSISDBHSA-N	427.486	1.440	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)NCc2ccc(Cl)cc2)cc1S(=O)(=O)NCC#N	787433739	KQXLRKXGRVXBNV-UHFFFAOYSA-N	435.893	1.595	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2CCC(=O)c3cccn32)c1	788723623	CBFGBEAUPGUZHB-KRWDZBQOSA-N	432.502	1.497	50	20	IDGD	
Cc1cc(F)cc(S(=O)(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)c1	788917887	XIEPKPKDLSZADZ-UHFFFAOYSA-N	430.502	1.932	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)CCOCC(F)(F)C(F)(F)F)c2ccccc2c1=O	790116886	STICPFGWRPDRIT-UHFFFAOYSA-N	436.337	1.782	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2cc(Br)ccc2O1)c1ccc(-n2cnnn2)cc1	792030501	NORUJVDFGWVZEZ-OAHLLOKOSA-N	429.234	1.190	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@@H](C(=O)NNC(=O)c2ccc3ccccc3n2)[C@@H](C)O)cc1	792544165	YEZNNEFPRZCKCY-AUUYWEPGSA-N	442.497	1.032	50	20	IDGD	
Cc1ccc2c(c1)CC[C@@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)N3CCCC3)c1)O2	792774797	WOCLLPZGCOYWIX-FQEVSTJZSA-N	443.525	1.934	50	20	IDGD	
Cc1nc2ccc(Br)cn2c1C(=O)NNc1nccc(N2CCOCC2)n1	795173004	CPYMROWTKAXSLI-UHFFFAOYSA-N	432.282	1.789	50	20	IDGD	
CCOC(=O)c1cc(S(=O)(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c(F)cc1C	795278337	WSDRNWVNZVTYSY-UHFFFAOYSA-N	425.394	1.842	50	20	IDGD	
CNC(=O)[C@@]1(C)CCN(C(=O)NNC(=O)[C@@H](C)Oc2cccc(Br)c2)C1	797606925	TUCMAHMOYHZAKR-DIFFPNOSSA-N	427.299	1.415	50	20	IDGD	
CN(CCNC(=O)NNC(=O)Cc1ccccc1F)S(=O)(=O)c1ccc(F)cc1	798098125	OTWZFXBGLVNKTB-UHFFFAOYSA-N	426.445	1.158	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3ccncc3C(F)(F)F)cc2)CC1	800690826	OROCBSLQKBIFCK-UHFFFAOYSA-N	443.451	1.793	50	20	IDGD	
Nc1cc2c(cc1C(=O)OCC(=O)NNC(=O)[C@H]1COc3ccccc3O1)CCCC2	801452420	JKOFFHVRHIQIEE-LJQANCHMSA-N	425.441	1.292	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)c1cncc(-n2ccnn2)c1	801795862	FZGJHRPMWIGJGQ-NSHDSACASA-N	431.250	1.653	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)N1CCC(c2nnc3n2CCN(C(=O)OC(C)(C)C)C3)CC1	802023644	RFOLZAGVCFJTBD-CQSZACIVSA-N	449.556	1.154	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1cc(C(=O)NNC(=O)N=c2cc[nH]cc2)ccc1Cl	802027369	DKEKQUGVDRAXBW-UHFFFAOYSA-N	425.898	1.700	50	20	IDGD	
Cc1cc(C)cc(N2CC[C@H](C(=O)NNC(=O)Nc3ccc(S(C)(=O)=O)cc3)C2=O)c1	802068047	XWVHPTSDHIUSQS-GOSISDBHSA-N	444.513	1.913	50	20	IDGD	
COC(=O)N(C)NC(=O)c1cccc(NC(=O)C[C@@H]2SC(N3CCCCC3)=NC2=O)c1	804124137	AHCNLIFBBHCMHV-HNNXBMFYSA-N	447.517	1.842	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)C(=O)c1ccc(O)cc1	807094575	ZVWKIFZFHAKJLS-UHFFFAOYSA-N	430.892	1.194	50	20	IDGD	
CN1CCN(C(=O)NNC(=O)c2cc(S(=O)(=O)NC(C)(C)C)ccc2Cl)CC1	807381250	KXGAROHFAONALT-UHFFFAOYSA-N	431.946	1.019	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)Nc1cc(C2CC2)ccn1	810326653	OYDJUNBPMJOFNK-UHFFFAOYSA-N	445.501	1.446	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)[C@@]2(F)CCN(C(=O)OC(C)(C)C)C2)cc1	812729614	QEQQHQQCCFOBLC-GOSISDBHSA-N	430.502	1.729	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1cn(Cc2ccccc2)nn1	815566533	XIJQBIQGMNAIPR-ZDUSSCGKSA-N	426.408	1.019	50	20	IDGD	
CCCN1CCN(c2ccc(NC(=O)C(=O)NNc3ncncc3F)cc2Cl)CC1	815763876	FWWAXGFMDXFILJ-UHFFFAOYSA-N	435.891	1.883	50	20	IDGD	
Cn1nncc1NNC(=O)C1CCN(S(=O)(=O)c2ccccc2C(F)(F)F)CC1	816769985	FXAYTHOZDHZUBX-UHFFFAOYSA-N	432.428	1.378	50	20	IDGD	
O=C(NNc1ccccc1)c1cc(O)nc2ccc(S(=O)(=O)N3CCOCC3)cc12	868149436	HAYBLVLUWCAZJQ-UHFFFAOYSA-N	428.470	1.718	50	20	IDGD	
CC(=O)CCC(=O)NNC(=O)c1ccc(CN(C)S(=O)(=O)c2ccc(C)cc2)cc1	913419280	SPMDWIUVXVJVMG-UHFFFAOYSA-N	431.514	1.946	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)[C@H](CC(C)C)N2C(=O)[C@H]3CC=CC[C@H]3C2=O)cc1	913429578	JPGKMFFGFIGOPB-OTWHNJEPSA-N	442.516	1.620	50	20	IDGD	
Cc1nc(-c2c(C)c(C)nn(C)c2=O)sc1C(=O)NNC(=O)COc1ccc(F)cc1	915189202	DBPCHMVZEQHCGS-UHFFFAOYSA-N	445.476	1.808	50	20	IDGD	
Cc1ccn2c(=O)c(C(=O)NNC(=O)c3nn(C(C)C)c(=O)c4ccccc34)cnc2c1	915635949	HGABGIDGUOPXRG-UHFFFAOYSA-N	432.440	1.369	50	20	IDGD	
Cc1cc(C)n(-c2ccc(CC(=O)NNC(=O)c3csc(N4CCOCC4)n3)cc2)n1	915636727	QQPYVWHJYQLONG-UHFFFAOYSA-N	440.529	1.786	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NN=Cc2ccc(OCCC(=O)O)cc2)cc1	915944057	HCXUUTACHSBOLJ-UHFFFAOYSA-N	433.486	1.619	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)CS(=O)(=O)C2CCCC2)cc1	916102372	HZYHLCKCMBYPTM-UHFFFAOYSA-N	437.547	1.226	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCCOc2ccc(OC)cc2)nc1	916214058	MBZZERQRDSLWBG-UHFFFAOYSA-N	437.522	1.826	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NCC[C@@](O)(c1nccn1C)C(F)(F)F	916378800	UHNNRVLXALWXLY-APPDUMDISA-N	447.389	1.497	50	20	IDGD	
CCOC(=O)N1CCC(NC(=O)CCCNC(=O)NNC(=O)c2ccccc2C)CC1	916639920	UBDSLFMMISFLCR-UHFFFAOYSA-N	433.509	1.456	50	20	IDGD	
O=C(NNC(=O)[C@H]1CC(=O)N(c2ccc(Cl)cc2)C1)c1csc(N2CCOCC2)n1	916734421	FZEPYZHSXISPDA-LBPRGKRZSA-N	449.920	1.447	50	20	IDGD	
Cc1nc2c(C(N)=O)cnn2c(C)c1CCC(=O)NNC(=O)[C@@H](C)Oc1ccc(F)cc1	916734719	NLQAHSKEBXMNTN-CYBMUJFWSA-N	442.451	1.132	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)c1cc(F)cc2nc(S)[nH]c12	919685927	FRPLFWARZYAPLZ-UHFFFAOYSA-N	442.520	1.964	50	20	IDGD	
Cc1nc2cc(C(=O)NNC(=O)N[C@@H]3CCS(=O)(=O)C3)ccc2n1-c1ccccc1	919884937	LSCDIZYCLYSUJB-OAHLLOKOSA-N	427.486	1.465	50	20	IDGD	
O=[N+]([O-])c1ccc(S(=O)(=O)NCCNS(=O)(=O)c2ccc(CCCl)cc2)cc1	920046890	JEMIFUUEMGRYSE-UHFFFAOYSA-N	447.922	1.633	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)N[C@H]1CCCN(S(C)(=O)=O)C1	920239911	IGKVMGCNDANUKN-PBHICJAKSA-N	434.518	1.362	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)CNC(=O)Cc2cccc(F)c2)CC1	1116084787	JFVSNPDNYHTMJR-UHFFFAOYSA-N	436.484	1.279	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=S)NC[C@H]2CCCCO2)c1	1116388388	KBLSNVUDKFPBIM-OAHLLOKOSA-N	428.580	1.395	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2ccc(NC(=O)C3CC3)cc2)c1	1317889877	UWMAJYIKQYBGHM-UHFFFAOYSA-N	430.486	1.583	50	20	IDGD	
Cc1nnnn1/C(=C/c1ccc(F)cc1)C(=O)NNC(=O)c1cncn1-c1ccccc1	1317995293	HDLIAXWCHVNSKS-WOJGMQOQSA-N	432.419	1.766	50	20	IDGD	
CS(=O)(=O)Nc1ccccc1CC(=O)OCC(=O)NNC(=O)c1ccc(Cl)cc1	1318453000	FYKRTGLLMQHQRF-UHFFFAOYSA-N	439.877	1.258	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2ccc3nnc(C(F)F)n3c2)c2ccccc2c1=O	1319616928	ZZYGUBWLNHHDNT-UHFFFAOYSA-N	441.398	1.862	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(O)nc(O)c2)C1	1777846925	ZHFVYOFOPGFEGT-JLTOFOAXSA-N	425.913	1.885	50	20	IDGD	
Cn1cc(F)cc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Br)C2	1778376079	XFBFVHXTXUNZJJ-CKEIUWERSA-N	434.281	1.982	50	20	IDGD	
O=C(c1cc2cc(F)c(F)cc2[nH]1)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1778400480	XNZJZAYDSSQDMM-APWZRJJASA-N	427.835	1.489	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnc4[nH]ncc4c3)C2)C1	1778416947	UAAZZUGKCWHDNT-QZTJIDSGSA-N	426.304	1.638	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(=O)nc4sccn34)C2)C1	1779947952	URLYGSCPLWSHPS-LJQANCHMSA-N	438.937	1.465	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H]1CCC(=O)NC1)C2	1781897366	ISLALNODVZPVAQ-XTDOFWJNSA-N	444.370	1.200	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H]2CCNC(=O)C2)C1	1782267568	HGYYIGDLEBTBSL-NXEZDXNNSA-N	444.370	1.058	50	20	IDGD	
O=C(c1cnc2ccc(F)cn12)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1782462544	NQWZOTQPYDWNKB-PBHICJAKSA-N	443.248	1.607	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](O)CCl)C3)cc1	1782989264	KGUMSRGWHXSEAS-WAOWUJCRSA-N	437.924	1.372	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)Cc3csc(C)n3)CCO2)C1	1783343882	KGBDXDLKENZCRZ-YOEHRIQHSA-N	430.368	1.997	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(NC(C)=O)o3)CCO2)C1	1783349665	QSMRKHDTLXOASU-FZKQIMNGSA-N	442.310	1.855	50	20	IDGD	
CC(C)[C@H]1CC[C@H](C(=O)N2CC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)CC1	1783370425	CJBNBZBFNRVQBV-JXQFQVJHSA-N	442.365	1.272	50	20	IDGD	
Cc1cccn2ncc(C(=O)N3CCO[C@]4(CCN(C(=O)[C@@H](C)Br)C4)C3)c12	1783536219	IBAJDLDDJZZODS-KUHUBIRLSA-N	435.322	1.870	50	20	IDGD	
CC(C)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nc4ccc(F)cn4n3)C[C@@H]21	1783852818	OJACNUOWHRZPPS-QEJZJMRPSA-N	437.903	1.727	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4n(n3)CCC4)C[C@@H]21	1783966969	NNHKLTWJXJAOON-HPZZRFSDSA-N	439.354	1.454	50	20	IDGD	
CCOC(=O)/C=C/C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]2C1	1783967975	OJCHJZYISKJISW-SLIXGAEDSA-N	431.327	1.116	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(CCN(C(=O)C3=COCC3)C2)C1	1784764300	ZMRJPWOSQINTSZ-NRFANRHFSA-N	445.428	1.268	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnn4ccccc34)C[C@@H]21	1786406826	IWSAXUIKORKPHL-QRTARXTBSA-N	435.322	1.713	50	20	IDGD	
C[C@@H](Nc1nccs1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21	1787485533	JAEGSQUKDFXNRQ-RFGFWPKPSA-N	445.383	1.708	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CCC[C@H]3C)C[C@@H]21	1787508379	HJFBPIZKGFCFNN-LSTDIUBPSA-N	443.548	1.536	50	20	IDGD	
Cn1cnc(C(=O)Nc2ccc(C3(NC(=O)c4cnccc4C(=O)NN)CCC3)cc2)c1	1787522704	IBKAWYFWUJVLOT-UHFFFAOYSA-N	433.472	1.480	50	20	IDGD	
CCc1cc(C(=O)NC2(c3ccc(NC(=O)c4cccc(B(O)O)c4)cc3)CCC2)nn1C	1788148028	XHVLMULELPZNCO-UHFFFAOYSA-N	446.316	1.724	50	20	IDGD	
Cc1cnc2c(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)CO[Si](C)(C)C)C[C@@H]43)cnn2c1	1788337082	HMFHCHKOSNWKOW-SZMVWBNQSA-N	445.596	1.483	50	20	IDGD	
CCCC(=O)N[C@@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]21	1788742392	GPGXUKSLPGJNIX-OXMIBSBGSA-N	436.380	1.507	50	20	IDGD	
CSCC[C@@H](O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]2C1	1789872285	FVWIXYZUIFPWQF-LHLGERLTSA-N	427.394	1.316	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)c1ccc(-c2cc[nH]n2)cc1	1790186039	CRLCEHLJJVBFSJ-DKKFBQAASA-N	432.908	1.270	50	20	IDGD	
N#CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](Br)Cc3ccccc3)[C@H]2C1	1790779405	CVZWXIDGJZSEQV-FJIDUMEYSA-N	434.334	1.886	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)Nc3cccnc3)C[C@@H]21	1791058046	NROJYHXFVAANOC-AUOOEQCUSA-N	439.354	1.645	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3c4c(nn3C)CCC4)C[C@@H]21	1791063170	CGYFJUUQHYIFLK-DSPQJCBJSA-N	439.354	1.286	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3ncccc3OC)C[C@@H]21	1791252373	IHQNYABRYYBYQA-FPXQBCRKSA-N	439.940	1.256	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)C[C@@H]21	1791256579	CLGJJZZMOYRUHX-UQCMEYCASA-N	441.868	1.148	50	20	IDGD	
O=C1CCc2ccc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]4C3)nc2N1	1791295517	KYCIQNIJQWOZEL-OBJOEFQTSA-N	441.315	1.363	50	20	IDGD	
Cc1cnn([C@H](C)C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCBr)C[C@@H]32)c1	1791593732	YOAVTENMPRTREO-UGUYLWEFSA-N	427.343	1.517	50	20	IDGD	
C[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)c1ccccn1	1791715617	CITSUKAKZZQOKT-YOPIWALVSA-N	428.302	1.855	50	20	IDGD	
C[C@H](NNc1ccccc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@](C)(Cl)CCl)C2	1792507895	BZLBMEPXYZZYDF-GUEUDTIMSA-N	443.375	1.818	50	20	IDGD	
COc1ccc([N+](=O)[O-])c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C(C)(C)CCl)n1	1792782048	NTOZXDFRCOLUQV-JJLQDPRZSA-N	440.884	1.467	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1cnc3[nH]ccc3c1)C2	1795116537	QAQRTABIZAWSBW-HGKCTWBKSA-N	449.349	1.870	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnc2[nH]ncc2c1	1797343752	GWSMMPYQYZXMLK-HPEDKQMDSA-N	436.310	1.192	50	20	IDGD	
COc1cccc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CO[Si](C)(C)C)n1	1797953061	ZXAOXMCAJRQTTC-VPTLXERWSA-N	435.597	1.464	50	20	IDGD	
COc1ccc([C@@H](O)C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@](C)(Cl)CCl)cc1	1799273891	SOIJDOPZEGPWCX-QUYZETPZSA-N	445.343	1.555	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3nonc3c1)C2	1799275444	SFAFRFQITFLHTD-TYYYEBLRSA-N	427.288	1.662	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccn3nccc13)C2	1800642930	CMHDCWMMFIRTEG-YXPYIKCWSA-N	435.322	1.711	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCc1cnc2[nH]ccc2c1	1800846593	PBQUFSZOEKCHHZ-GMLZMKKNSA-N	449.349	1.869	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCc1cnccn1	1801404804	ZKUCRZOHZXFMOW-VWPFQQQWSA-N	425.327	1.030	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cc1cccc3ncccc13)C2	1802334078	IBFFWHRFCUKDBA-REPLKXPHSA-N	437.544	1.789	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)Cc2cnccn2)[C@@H]1c1cccnc1	1803300833	MWQDEBFYEXWFPF-JOQOYGCGSA-N	432.322	1.904	50	20	IDGD	
O=C(Cc1cccc(Cl)n1)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1	1804698254	DTIFMKLLTXZFIB-URLQWDBASA-N	437.327	1.978	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)c2cc(O)n(C)n2)[C@@H]1c1cccnc1	1804898310	GMUCKLJGNJHJKA-GHJWDPDVSA-N	436.310	1.624	50	20	IDGD	
C[C@@H](CNC(=O)OC(C)(C)C)C(=O)N1CCC2(CCCN(C(=O)[C@@H](O)CCl)C2)CC1	1805514920	GTIBCQXWANCZEN-HOTGVXAUSA-N	445.988	1.978	50	20	IDGD	
Cc1cscc1C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1808620996	QXDWYTONEJSKTH-RXVVDRJESA-N	449.341	1.765	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)c3cc(C4CC4)on3)CC2)C1	1809977449	HDPRZMJVDZHWPD-UHFFFAOYSA-N	437.305	1.390	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)c2cccnc2)[C@@H]1c1cccnc1	1810298566	IVCTVOFLGOMOPE-OXJNMPFZSA-N	445.483	1.109	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@H]1CCN(C(=O)c2cc(O)ncn2)[C@H]1c1cccnc1	1810540737	PWIMXPZPIKEPSJ-BEFAXECRSA-N	429.553	1.748	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](O)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Cl)[C@@H]1c1cccnc1	1811507554	RGIGZBAKHUWZQN-DSJMHWKBSA-N	444.891	1.465	50	20	IDGD	
CC(=O)NCCC(=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@H]1c1cccnc1	1812662613	ZXTFOMCWEMQFQF-CWRNSKLLSA-N	429.290	1.304	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)CCn2cncn2)[C@H]1c1cccnc1	1813320999	HXBBMKCLONRQNN-JLJPHGGASA-N	435.326	1.553	50	20	IDGD	
Cc1cccc(CC(=O)Nc2nc3c(s2)C[C@@H](NC(=O)CCC(=O)NN(C)C)CC3)c1	1813914153	PQXMBILNBVXZSS-INIZCTEOSA-N	443.573	1.979	50	20	IDGD	
Cc1cc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)nn1C	1816428344	FCSRCMFZRKYDRF-INIZCTEOSA-N	430.513	1.131	50	20	IDGD	
O=C(CCBr)Nc1cc([C@H]2CCCCN2C(=O)CN2CCOCC2)[nH]n1	1816782841	YWAVCOYYGADJCC-CQSZACIVSA-N	428.331	1.519	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnc(O)nc3O)sc2C1	1817078902	LHPQLIJRQFPTAO-SCZZXKLOSA-N	425.898	1.978	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)CCc2ccoc2)[nH]n1)c1cccc(B(O)O)c1	1817479781	QMMNOUPLDMQTLM-LJQANCHMSA-N	436.277	1.621	50	20	IDGD	
O=C1Nc2c(C(=O)Nc3cc([C@@H]4CCCCN4C(=O)[C@H](O)CCl)[nH]n3)cccc2C1=O	1819193834	UAGMXGOTGLDBLG-UONOGXRCSA-N	445.863	1.450	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CO[Si](C)(C)C)CC2	1819691248	XYPRPIVXPLPKOX-NEPJUHHUSA-N	441.630	1.614	50	20	IDGD	
CC1(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cnccc4C(=O)NN)sc3C2)CCC1	1819790062	DTXPWRBTIMDUJK-LLVKDONJSA-N	428.518	1.558	50	20	IDGD	
Cc1nccn1[C@H](C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1	1822416584	IWJRVOJADQOZJD-PBHICJAKSA-N	444.540	1.541	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCS(C)(=O)=O)CC2	1822870083	RUFIDSARVSXKAH-BJOHPYRUSA-N	442.390	1.726	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cn[nH]c2)CC1	1827680807	WWAANAGHMIKJKC-UAHQCSBISA-N	439.520	1.777	50	20	IDGD	
Cc1cn(CC(=O)Nc2nc3c(s2)C[C@H](NC(=O)C(Cl)Cl)CC3)c(=O)nc1O	1827994122	HSSKGTBDDWRWSM-MRVPVSSYSA-N	446.316	1.130	50	20	IDGD	
Nc1n[nH]c(CCC(=O)N2CCCC[C@H]2C2CCN(C(=O)[C@H](F)Br)CC2)n1	1828805282	SKAKSAMPPYNZGL-WFASDCNBSA-N	445.337	1.630	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCS(C)(=O)=O)CC1	1829103696	LLSQZORUKDPDNC-QGZVFWFLSA-N	432.659	1.892	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cnc4ccccn34)C2)C1	1830354299	WINMWDWESHJWCZ-QFIPXVFZSA-N	448.951	1.598	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CNC(=O)N(C)C)CC1	1831651101	WVDLLTXJMYLLCY-UKRRQHHQSA-N	431.375	1.661	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H]2CCCS2)CC1	1832438695	NNOPETOHDDHDMW-MOPGFXCFSA-N	445.589	1.814	50	20	IDGD	
CCNC(=S)NCC(=O)N1CCC(N2CCC(NC(=O)C(C)(C)CCl)CC2)CC1	1833215617	RUUOZJLKNVNRBB-UHFFFAOYSA-N	446.061	1.307	50	20	IDGD	
Cc1ccccc1OCC(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)CCl)CC2)CC1	1833308933	DWVIHFOFIVMRQM-IBGZPJMESA-N	437.968	1.545	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3csnc3C)CCO2)C1	1833749785	VWOFTSIHXNCCNN-RHSMWYFYSA-N	446.367	1.695	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCBr)CCO2)C1	1834819492	PKZHJOCGZBADCW-XJKSGUPXSA-N	425.751	1.635	50	20	IDGD	
C[C@@H](Nc1cccnc1)C(=O)N1CCC(N2CCC(NC(=O)[C@H](F)Cl)CC2)CC1	1835080299	OUMRGVXXAFZWEJ-KDOFPFPSSA-N	425.936	1.988	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccsc3)CCO2)C1	1836101732	DEEVNJZVRPOAMH-ZWKOTPCHSA-N	435.373	1.983	50	20	IDGD	
C/C(=C/C(=O)N1CCC(N2CCC(NC(=O)[C@@](C)(Cl)CCl)CC2)CC1)C(=O)O	1836400225	AARCJDNXVCAVDW-QXFGJRORSA-N	434.364	1.825	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1Cc3ccccc3CN1)CCO2	1836498938	OOSQDTKHUAOPEP-VIZSFHNOSA-N	449.979	1.565	50	20	IDGD	
O=C(Cc1ccccc1F)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836716656	HNXXCUDVNNBQBO-IBGZPJMESA-N	426.916	1.967	50	20	IDGD	
CC(C)(C(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1)c1ccccn1	1836719991	FZDPYMCEQFGSSN-GOSISDBHSA-N	437.968	1.958	50	20	IDGD	
Cn1nc(C(=O)N2CCC(OC3CCN(C(=O)[C@](C)(Cl)CCl)CC3)CC2)cc1O	1837270274	JPEMHHVKAWKQAU-LJQANCHMSA-N	447.363	1.974	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(OC2CCN(C(=O)C3CCC3)CC2)CC1	1837601376	CEFQCMZTJUFACD-PCLIKHOPSA-N	443.548	1.919	50	20	IDGD	
COCc1c[nH]c(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)c1	1838519410	MKOLBILCTQSDKK-ACJLOTCBSA-N	444.326	1.015	50	20	IDGD	
CCn1nc(C(C)C)cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1838812671	PORQEKXUQHLJEQ-LPHOPBHVSA-N	430.908	1.631	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3cnc[nH]3)C2)C1	1839150063	AYZDCIYCVDMNER-ROUUACIJSA-N	433.336	1.035	50	20	IDGD	
Cc1nnsc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2	1839152539	CLSVCQISGIZPKV-HOTGVXAUSA-N	437.349	1.153	50	20	IDGD	
Cc1ccc(O)c(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)c1	1839201679	FUVPXCJTCVWBHX-MAUKXSAKSA-N	445.285	1.461	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(CC#N)cc3)CCO2)C1	1839364315	YGYCKQDDBDGXQD-GHTZIAJQSA-N	435.908	1.076	50	20	IDGD	
CC(C)c1nc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)co1	1840030948	AXRVHRMGTBVKCC-UGSOOPFHSA-N	444.326	1.651	50	20	IDGD	
C=CC[C@H](CC(=O)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1)NC(=O)OC(C)(C)C	1841354824	YYWVXEXLNMLBLZ-HUUCEWRRSA-N	429.945	1.649	50	20	IDGD	
CS(=O)(=O)Cc1ccc(C(=O)N2CCCC23CN(C(=O)[C@H](F)Br)C3)cn1	1843216433	HDHNGOYKCVHYJY-ZDUSSCGKSA-N	448.314	1.134	50	20	IDGD	
CCOc1ncccc1C(=O)N1CC2(CCCN2C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C1	1843415161	RGCJJZQZOMTBAZ-MFKUBSTISA-N	438.488	1.431	50	20	IDGD	
COc1ccc(C(=O)N2CC3(CCCN3C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)c(O)c1	1843416479	PJSDHFOMRIBPHB-ZVHZXABRSA-N	439.472	1.352	50	20	IDGD	
CC(C)(C)OC(=O)N1CC2(C[C@@H]2C(=O)N2CCCC23CN(C(=O)[C@@H](O)CCl)C3)C1	1846115875	NSXOOXWLZDOJCW-KGLIPLIRSA-N	427.929	1.047	50	20	IDGD	
CC[C@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)[C@@H](O)CCl)C2	1847085566	IGQAZCQGYDZJTA-KKUMJFAQSA-N	431.961	1.729	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1ccc(O)cn1	1848095654	JMSUBIVYEDVUQE-JYJNAYRXSA-N	438.912	1.735	50	20	IDGD	
CC(C)CCSc1ccc(C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)cc1[N+](=O)[O-]	9930723	CBHFWQXWLVZCAX-ZDUSSCGKSA-N	429.520	1.929	50	20	IDGD	
CS(=O)(=O)CC[C@@H](NC(=O)c1ccccc1Cl)C(=O)NNC(=O)c1ccccc1	17171115	ANKMTTCIYJJKEA-MRXNPFEDSA-N	437.905	1.334	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)Cc2ccc(C(=O)NNC(=O)c3cnc[nH]3)cc2)cc1	725880117	XXDCAAYKKDLUAC-UHFFFAOYSA-N	427.486	1.614	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])c(C)c1	726504421	WBYORXNGCSFUIU-SFHVURJKSA-N	440.456	1.907	50	20	IDGD	
CC(=O)NCC(=O)N1CCC[C@@H]1C(=O)NNC(=O)COc1ccccc1-c1ccccc1	728456634	UFLUXQYPSPKAAG-LJQANCHMSA-N	438.484	1.007	50	20	IDGD	
CCN1CCN(CCCCNC(=O)NNC(=O)c2cc(F)ccc2Br)CC1	728744037	LOGNRLGKRPNVTQ-UHFFFAOYSA-N	444.349	1.950	50	20	IDGD	
Cc1nc2[nH]n(C)c(=O)c2c(C)c1CCC(=O)NNC(=O)[C@@H](C)Oc1ccc(F)cc1	729281655	AVDXZAPJZRXNDP-CYBMUJFWSA-N	429.452	1.565	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCCc2cc(OC)c(OC)cc2[N+](=O)[O-])c(OC)c1	730027895	AZFNTFBHPXSHMU-UHFFFAOYSA-N	448.432	1.816	50	20	IDGD	
C[C@@H]1CCC[C@H](NC(=O)CN2CCN(CC(=O)NNC(=O)c3cccc(Cl)c3)CC2)C1	731214308	CLNWYFDEGAWYEE-APWZRJJASA-N	449.983	1.414	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)N2CCC[C@@H](CS(N)(=O)=O)C2)N(C)c2ccccc21	731881059	BFBOSEZUXAYQRZ-OAHLLOKOSA-N	445.545	1.184	50	20	IDGD	
O=C(CCN1CCN(C(=O)[C@@H]2CCCO2)CC1)NNC(=O)CC12CC3CC(CC(C3)C1)C2	731959414	LXTDINTXEUQRDB-WNZYQOIOSA-N	446.592	1.454	50	20	IDGD	
O=C(COC(=O)c1cn(-c2ccccc2Cl)nn1)NNC(=O)c1cccc([N+](=O)[O-])c1	732333781	VAQVLFHYUKKNGC-UHFFFAOYSA-N	444.791	1.447	50	20	IDGD	
Cc1ccc(C2(C(=O)OCC(=O)NNC(=O)Cc3nc(C)cs3)CCOCC2)cc1	732382788	MPUWJCDCEDVYGT-UHFFFAOYSA-N	431.514	1.741	50	20	IDGD	
CCOCCCn1c(NNC(=O)c2c([N+](=O)[O-])c(C)nn2C)nc2ccccc2c1=O	733268979	WQMWRIDYANZQRN-UHFFFAOYSA-N	429.437	1.530	50	20	IDGD	
CCOCCCn1c(NNC(=O)c2ccccc2S(C)(=O)=O)nc2ccccc2c1=O	733269170	ZWXDUENQBZAFHF-UHFFFAOYSA-N	444.513	1.984	50	20	IDGD	
O=C(NNc1cnnc2ccccc12)c1ccc(S(=O)(=O)NC[C@@H]2CCCO2)cc1	733810340	FFAUVIGOWYWQON-HNNXBMFYSA-N	427.486	1.844	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2cc(-c3cccs3)[nH]n2)CC1	735118302	QYPMVPKGHRCVOW-UHFFFAOYSA-N	447.546	1.226	50	20	IDGD	
COc1cc(NC(=O)Cc2cccs2)c(C(=O)NNC(=O)c2cnn(C)c2)cc1OC	735471164	RYSDGEYVZRMXIW-UHFFFAOYSA-N	443.485	1.755	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)[C@H]1CC(=O)N(c2ccc3c(c2)OCCO3)C1	737636059	AVLSAIGOWOQDTO-INIZCTEOSA-N	425.441	1.175	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	740851209	USXFFQFDJFBTQU-UHFFFAOYSA-N	446.529	1.231	50	20	IDGD	
CN(CCCC(=O)NNC(=O)c1cccc(C#N)c1)C1=NS(=O)(=O)c2ccccc21	741920879	NJMICYZDQDFJFJ-UHFFFAOYSA-N	425.470	1.180	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)[C@H](c2cccc(F)c2)N2CCOCC2)nc2ccccc21	742034516	PAASHVQMSXQNDW-NRFANRHFSA-N	425.464	1.476	50	20	IDGD	
CN1C(=O)c2ccc(S(=O)(=O)NNC(=O)c3cccc(Br)c3)cc2C1=O	743263372	DRUDVLYGBNCEEE-UHFFFAOYSA-N	438.259	1.298	50	20	IDGD	
Cc1nn(C)c2sc(C(=O)N[C@@H](C)C(=O)NNC(=O)CCc3ccccc3O)cc12	743338182	LBXFKBYPJVOSTO-LBPRGKRZSA-N	429.502	1.547	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)NCC2(N(C)C)CCOCC2)cc1Cl	743624961	CJFQGRCCCSAWJC-UHFFFAOYSA-N	429.905	1.804	50	20	IDGD	
CN(Cc1ccccc1)C(=O)N1CCN(CC(=O)NNC(=O)c2cccc(C#N)c2)CC1	744386790	KWKNCNZGLFOCLP-UHFFFAOYSA-N	434.500	1.189	50	20	IDGD	
CC(C)NC(=O)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2c3ccccc3C[C@H]2C)c1	744447346	BGKZFSJXYMLHBN-CQSZACIVSA-N	444.513	1.112	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)Oc1ccccc1Cl	745886575	HEQAQBIQIBULEJ-GFCCVEGCSA-N	429.864	1.998	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)N[C@@H]1CC(=O)N([C@H]2C[C@@H]2c2ccccc2)C1	745913778	CPHBVWTWGZYVFY-UNEWFSDZSA-N	439.428	1.401	50	20	IDGD	
C[C@@H]1OC(C)(C)N(C(=O)OC(C)(C)C)[C@H]1C(=O)NNC(=O)CNC(=O)c1cccs1	746198910	XNFZWMPATRUGOP-SMDDNHRTSA-N	440.522	1.386	50	20	IDGD	
C[C@@H]1CC(C)(C)C[C@@]2(C1)NC(=O)N(CC(=O)NNC(=O)Cc1cn3ccccc3n1)C2=O	746554190	YEDPOXODTDILEM-JLCFBVMHSA-N	440.504	1.161	50	20	IDGD	
C=CCn1c(S)nc2cc(C(=O)NNC(=O)Cc3cn4ccccc4n3)ccc2c1=O	746640717	IIZBLLIDNOIIGB-UHFFFAOYSA-N	434.481	1.523	50	20	IDGD	
CN(C)[C@@H](CNC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)c1ccc(Cl)cc1	746778506	VYMUYLLSJZZBCU-KRWDZBQOSA-N	428.884	1.563	50	20	IDGD	
C[C@@H]1CCCCN1C(=O)CN1CCN(C(=O)NNC(=O)c2cccc3cccnc23)CC1	747461916	ICPNIPXGHHTXMW-QGZVFWFLSA-N	438.532	1.608	50	20	IDGD	
CCOc1ccc(C(=O)NNS(=O)(=O)c2ccc(F)c(C(=O)OC)c2)cc1OC	747596956	TTYBEUCWLACVTC-UHFFFAOYSA-N	426.422	1.643	50	20	IDGD	
O=C(CCN1CCN(C(=O)[C@H]2CCCO2)CC1)NNc1ccc(F)cc1Br	748073823	BTAUMXGVGWHGPL-MRXNPFEDSA-N	443.317	1.745	50	20	IDGD	
O=C(NNc1nc(-c2ccccn2)nc2c1CCC2)[C@@H]1CC(=O)N(Cc2ccccn2)C1	748341044	MCRUNZODMHNLGM-OAHLLOKOSA-N	429.484	1.914	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN(C)C2CCC(NC(=O)OC(C)(C)C)CC2)n1	749847395	NLFCOCHXJYTJHX-UHFFFAOYSA-N	439.582	1.909	50	20	IDGD	
Cc1ccc(C(=O)N([C@@H]2CCS(=O)(=O)C2)N(C)C)cc1S(=O)(=O)NC1CCCC1	752282835	XCHXVCWFAXBEOX-QGZVFWFLSA-N	443.591	1.322	50	20	IDGD	
O=C(NNC(=S)NCCc1cccs1)[C@@H]1CCCN1S(=O)(=O)c1cccs1	753079922	WKMQXJRZKIDONR-ZDUSSCGKSA-N	444.629	1.701	50	20	IDGD	
C[C@@H](C[S@@](C)=O)NC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	753356148	BPCXDQLVLCFSRQ-YBOJIHHZSA-N	444.560	1.260	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCOCC2)cc1NC(=O)NNC(=O)CC(C)(C)C	755409879	BNKFYQHQOWMVHL-UHFFFAOYSA-N	428.511	1.305	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)ccc1-n1cnnn1	755679583	OBCSXEDLQFVCBE-UHFFFAOYSA-N	447.459	1.728	50	20	IDGD	
Cc1cc(N2CCOCC2)ccc1NC(=O)NNC(=O)COc1ccccc1[N+](=O)[O-]	755739356	HIVCKQCCGNCPIH-UHFFFAOYSA-N	429.433	1.972	50	20	IDGD	
COc1ccc(-c2nn(CCC#N)cc2/C=C(/C#N)C(=O)N[C@H]2CNC(=O)C2)cc1OC	755931515	FFPBGQAARHUVOC-XYMPBJBSSA-N	434.456	1.393	50	20	IDGD	
COC(=O)c1nc(Cl)ccc1S(=O)(=O)NNC(=O)c1cccc(OC(F)F)c1	755976402	XZXLQJNSRBZLCZ-UHFFFAOYSA-N	435.792	1.746	50	20	IDGD	
Cc1cc(=O)n(C)cc1NC(=O)NNC(=O)c1nn(CCC(C)C)c(=O)c2ccccc12	756892427	QGXNRPSTKZXEFW-UHFFFAOYSA-N	438.488	1.916	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)CC[C@@H](NC(=O)OC(C)(C)C)c1ccccc1	758046506	SWYCEDDKQZKPGL-UKRRQHHQSA-N	442.538	1.118	50	20	IDGD	
COc1ccc(CN2C[C@H](C(=O)NNC(=O)CSc3ccccc3OC)CC2=O)cc1	761636566	LRLZMOZCKJLKCU-MRXNPFEDSA-N	443.525	1.992	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)NC2CCN(Cc3ccc(Br)cc3)CC2)cn1	762104589	ZCEXAZHFMJKUJG-UHFFFAOYSA-N	435.326	1.791	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)CCc1c(C)c2c(C)nn(C)c2[nH]c1=O	762362147	USSNGPMOUSNAQZ-UHFFFAOYSA-N	443.529	1.759	50	20	IDGD	
O=C(NNc1nccc(N2CCOCC2)n1)c1ccc(S(=O)(=O)N2CCCCC2)cc1	762851444	PGUXGUGYZXAEGF-UHFFFAOYSA-N	446.533	1.245	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)n([C@H]2C[C@H]3CC[C@H]2C3)n1	763446291	QBCIXORQCCKWNT-NOLJZWGESA-N	426.433	1.861	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)N[C@@H]1CCN(Cc2ccccc2)C1=O	763486425	LIAKSKAUSSYXQW-MRXNPFEDSA-N	433.509	1.423	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1F	763511542	GPTBYRCVZQKZGU-UHFFFAOYSA-N	448.476	1.318	50	20	IDGD	
COC(=O)c1ccc(F)c(NC(=O)C(=O)NNC(=O)c2cc3ccccc3cc2O)c1	763526775	KTPSJDYHLJOKGF-UHFFFAOYSA-N	425.372	1.871	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cccc(Cl)c2OC)cc(OC)c1OC	763538610	DXIJFVJWHOESMF-UHFFFAOYSA-N	437.836	1.774	50	20	IDGD	
CCNC(=O)N1CCc2ccc(NC(=O)C(=O)NNC(=O)c3c[nH]c4ccccc34)cc21	763539902	CKMAMUCROSJXIH-UHFFFAOYSA-N	434.456	1.660	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(C3CCCCC3)nn2C)cc1OC	763550380	DWZJNHAKILVUQS-UHFFFAOYSA-N	429.477	1.885	50	20	IDGD	
N#Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1C(F)(F)F	763574563	DTIMZVCXBUQPBJ-HNNXBMFYSA-N	434.330	1.503	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](CNC(=O)NNC(=O)c1nn(-c2ccccc2)cc1O)C1CC1	763586261	SUPYJJUFRTZQGM-OAHLLOKOSA-N	444.492	1.825	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cnn(-c3ccccc3Cl)c2)cc1	763660570	BTNQHAOETXKKDK-UHFFFAOYSA-N	443.847	1.699	50	20	IDGD	
CNC(=O)c1cc(NC(=O)C(=O)NNC(=O)COc2ccc(C)c(C)c2)ccc1Cl	763667982	XELFNAYFBXSYDD-UHFFFAOYSA-N	432.864	1.481	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(N(C)C)c2)cc1N1CCOC1=O	763758196	JXRYXMUYDQQTLM-UHFFFAOYSA-N	425.445	1.417	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(-c3nnc4n3CCCC4)cc2)c1	763761003	YAHDMJAMTSMGCP-UHFFFAOYSA-N	447.499	1.747	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)c2cc(OC)cc(OC)c2)cc1F	763772945	QYLVPLFQMXZDCV-UHFFFAOYSA-N	435.408	1.268	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(NC(=O)C(=O)NNC(=O)CC(C)C)ccc1Cl	763887818	BPDLISIAEVSISX-UHFFFAOYSA-N	432.930	1.503	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)C(=O)Nc2ccc(N3CCOCC3)nc2C)cc1	763896611	PBUXPHPPKVIQEP-UHFFFAOYSA-N	443.529	1.413	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc([S@@](C)=O)c2)cc1OC	763911028	AVWHGZGHOQCOCI-SSEXGKCCSA-N	433.486	1.621	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)C(=O)Nc1cccc(C(=O)N2CCSCC2)c1	763918786	HUWPPZCKJAZIOP-UHFFFAOYSA-N	444.488	1.343	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)C(=O)Nc1ccc(Cc2ccncc2)cc1	763921007	GFRWTKNWXRQLPC-UHFFFAOYSA-N	442.439	1.048	50	20	IDGD	
O=C(Cc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1ccc(N2CCOCC2)c(F)c1	763939019	BLLVNOXQVGEDRJ-UHFFFAOYSA-N	434.855	1.644	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3cccc(C(=O)N(C)C)c3)cc2C1	763944121	WJSSTNKBXQLIQF-GFCCVEGCSA-N	428.514	1.974	50	20	IDGD	
Cc1nc(-c2ccc(NC(=O)C(=O)NNC(=O)c3nn(-c4ccccc4)cc3O)cc2)n[nH]1	763945046	SNRSRJXEAYAQOR-UHFFFAOYSA-N	446.427	1.071	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(OCCN3CCCCC3)cc2)c(O)c1	764104759	GGSFSTUFEWUNSG-UHFFFAOYSA-N	440.500	1.965	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1ccccc1OCc1cscn1	764277766	NPCLLJZOXJESGT-UHFFFAOYSA-N	442.453	1.593	50	20	IDGD	
CC(=O)N(Cc1ccc(NC(=O)C(=O)NNC(=O)CCc2ccccc2O)cc1)C1CC1	764288741	LPEITUJQXSYJCG-UHFFFAOYSA-N	438.484	1.622	50	20	IDGD	
Cc1cc(C)n(-c2ccc(C(F)(F)F)cc2NC(=O)C(=O)NNC(=O)c2c[nH]nc2C)n1	764296320	XQLYDDUNBCVPAD-UHFFFAOYSA-N	449.393	1.939	50	20	IDGD	
Cc1cnc(O)n1-c1ccccc1NC(=O)C(=O)NNC(=O)c1cnn(-c2ccccc2)c1	764352012	WSEMZMCBHOWTQS-UHFFFAOYSA-N	445.439	1.472	50	20	IDGD	
Cc1ccc(-n2nc(C(C)(C)C)cc2NC(=O)C(=O)NNC(=O)c2cnn(C)c2)c(C)c1	764359227	NMPMJZDCVVPRMD-UHFFFAOYSA-N	437.504	1.920	50	20	IDGD	
CCC(CC)NC(=O)[C@@H]1CN(C(=O)C(=O)NNC(=O)c2ccc(C)o2)c2ccccc2O1	764372179	PQTLRXXNNDXNHZ-SFHVURJKSA-N	442.472	1.448	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)C(=O)Nc1ccccc1N1CCOC1=O	764394540	QSHIOKZKLATWHD-UHFFFAOYSA-N	430.442	1.227	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1ccc(F)cc1OCC#N	764394551	QYWMXAWGNQXQOU-UHFFFAOYSA-N	432.433	1.615	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)C(=O)Nc1c(F)c(F)c(F)c(F)c1F	764405707	XJUKTGXTRVUOOB-UHFFFAOYSA-N	435.330	1.966	50	20	IDGD	
CCn1c(C)cc(C=NNC(=O)CN2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)c1C	764817689	GZSNOLJASQELAX-UHFFFAOYSA-N	445.589	1.890	50	20	IDGD	
Cn1c(C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)ccc1[N+](=O)[O-]	765755039	BUYFKIPRBHBHFC-UHFFFAOYSA-N	434.884	1.166	50	20	IDGD	
O=C(Cc1cc2ccccc2nc1O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	766636581	QTRMKJBAYNGOHS-UHFFFAOYSA-N	447.495	1.088	50	20	IDGD	
CCc1ccc(NS(=O)(=O)c2cc(C(=O)NNC(=O)C(C)(C)O)ccc2OC)cc1	768247989	RUMUTXJZPBPMQA-UHFFFAOYSA-N	435.502	1.590	50	20	IDGD	
COc1ccc(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)nc1Cl	768311458	OJIXWYPBTKEYNB-UHFFFAOYSA-N	439.925	1.437	50	20	IDGD	
C[C@]1(c2cccc(C(=O)NNC(=O)c3ccc(F)cc3Br)c2)NC(=O)NC1=O	768957304	FIUXYBQJLBKVLY-GOSISDBHSA-N	449.236	1.718	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)c2ccc(S(C)(=O)=O)c(Br)c2)nc1	770127588	FTBPJCBWOUPHIM-UHFFFAOYSA-N	428.264	1.791	50	20	IDGD	
CC(=O)[C@H]1CC(C(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)=NN1c1ccccc1	770958099	IDSAATPCBUDDAL-MRXNPFEDSA-N	436.476	1.954	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)[C@H]3CCCN3C(=O)c3ccc4ccccc4c3O)nc21	771020644	KWOJCDFGIFZWAH-MRXNPFEDSA-N	447.455	1.676	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1ccc(S(=O)(=O)N2C[C@@H](C)C[C@@H](C)C2)cc1	771843919	AUDPXCJGIGGGFY-ZNMIVQPWSA-N	439.534	1.456	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)[C@@H]1CCN(c2ccccc2Br)C1=O	772022425	GNMWWOSBKNUEHG-GHMZBOCLSA-N	426.267	1.291	50	20	IDGD	
Cc1ccc(S(N)(=O)=O)c(C(=O)NNC(=O)[C@H]2CCCN(C(=O)OC(C)(C)C)C2)c1	773412214	UDOWLEZPNGCQKP-ZDUSSCGKSA-N	440.522	1.051	50	20	IDGD	
CC(C)c1nccnc1NNC(=O)C(=O)Nc1cccc(S(=O)(=O)N2CCCCC2)c1	773993406	UMOIOUBWQLJYOW-UHFFFAOYSA-N	446.533	1.856	50	20	IDGD	
COc1ccnc(NNC(=O)Nc2ccc(S(=O)(=O)N3C[C@H](C)O[C@@H](C)C3)cc2)n1	775447532	YSNULBHSTNGXGB-STQMWFEESA-N	436.494	1.432	50	20	IDGD	
CO[C@@H]1[C@@H](C)[C@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)C1(C)C	776069699	NNCONXDKEMDFJL-RRQGHBQHSA-N	438.550	1.475	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)c1cccc([N+](=O)[O-])c1N1CCOCC1	776558946	RIQGWYOYNAFJFS-ZDUSSCGKSA-N	432.408	1.799	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)NC1CCN(S(=O)(=O)CC(C)C)CC1	777765417	PIIDHKLQBSCABZ-UHFFFAOYSA-N	446.957	1.743	50	20	IDGD	
O=C(NCCCC(=O)N1CCN(S(=O)(=O)CBr)CC1)c1ccsc1	777777406	IHYJPNNXAVHZGR-UHFFFAOYSA-N	438.369	1.085	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNS(=O)(=O)c1cc(Br)ccc1F	777938928	IDGGGKCUOZMZQJ-UHFFFAOYSA-N	426.264	1.422	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN[C@H](c1nc(-c2nc[nH]n2)no1)C(C)C	778139087	AJTIYWHEJSUVSK-AWEZNQCLSA-N	448.871	1.265	50	20	IDGD	
C[C@H](NC(=O)c1cccc(Cl)c1Cl)C(=O)NNC(=O)CNC(=O)OC(C)(C)C	778443710	WIIUFJPXLVKETD-VIFPVBQESA-N	433.292	1.784	50	20	IDGD	
CN(C)C(=O)COc1ccccc1C(F)(F)C(=O)NNC(=O)c1ccc2c(c1)OCO2	778524828	QLXLWNMHPVFVNW-UHFFFAOYSA-N	435.383	1.435	50	20	IDGD	
COC[C@@H](C)n1ccc(NC(=O)C(=O)NNC(=O)c2sc(-c3ccccc3)nc2C)n1	778710259	RADNNRXACSKNCJ-GFCCVEGCSA-N	442.501	1.922	50	20	IDGD	
O=C(NNc1ccccc1OC(F)(F)F)C(=O)Nc1cc(-n2cnnn2)ccc1F	778799682	AZLGSOQYMMCINC-UHFFFAOYSA-N	425.302	1.782	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)C[C@](C)(O)c2ccccc2)c1	780849715	NQJIBRHIRYQVMQ-NRFANRHFSA-N	433.530	1.776	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2cccs2)[nH]n1)C(=O)Nc1ccc(OC2COC2)cc1	782124775	UEBWJHDQOWDCGS-UHFFFAOYSA-N	427.442	1.316	50	20	IDGD	
O=S(=O)(CBr)NC[C@@H]1CCC[C@H](NS(=O)(=O)CBr)C1	782437525	NFINHOUFEHCWDE-BDAKNGLRSA-N	442.195	1.089	50	20	IDGD	
COc1ccc(Sc2ccc(NC(=O)C(=O)NN[C@]3(C)CCS(=O)(=O)C3)cc2)cc1	783425037	HIBMWEWBGNPOEI-HXUWFJFHSA-N	449.554	1.983	50	20	IDGD	
Cc1c(NC(=O)C(=O)NN[C@@]2(C)CCS(=O)(=O)C2)cccc1C(=O)Nc1ccccc1	783425530	ILUGIARZRAQZJL-NRFANRHFSA-N	444.513	1.384	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2cc(Cl)ccc2OC2CCCC2)CCS(=O)(=O)C1	783426679	JOAQVVNKHATQJN-GOSISDBHSA-N	429.926	1.798	50	20	IDGD	
CCCC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)CNC(=O)c2cccs2)c1C	784005329	VPMLKMMPXCVUCZ-UHFFFAOYSA-N	445.501	1.311	50	20	IDGD	
COCCn1ccc(C(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)n1	784310455	NHMJTEKETJGJKG-UHFFFAOYSA-N	449.514	1.467	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2nc(-c3ccc(Cl)cc3)no2)n(-c2ncccn2)n1	784794422	GAINZPPPAUUKAH-UHFFFAOYSA-N	439.823	1.756	50	20	IDGD	
CN(C)CCC(=O)Nc1ccc(NC(=O)C(=O)NNc2ccnc(Br)c2)cc1	784830023	IVSJMECRYKWYEK-UHFFFAOYSA-N	449.309	1.816	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1cnn(CC2CC2)c1	784833314	NCOGVQWPJUACEE-UHFFFAOYSA-N	434.522	1.452	50	20	IDGD	
CC[C@@H](C)NS(=O)(=O)c1cccc(NC(=O)C(=O)NNc2ccc(Cl)nc2)c1	784870471	UBGQHWCNULUAHF-LLVKDONJSA-N	425.898	1.894	50	20	IDGD	
CCNC(=O)N(C)NC(=O)C(=O)Nc1ccc(OC(F)(F)F)cc1Br	784915330	LSONWABWTLMZMI-UHFFFAOYSA-N	427.177	1.979	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2cc(F)c(F)c(F)c2)cc1S(=O)(=O)N(C)C	785088185	HFHAYLFRUIZUPD-UHFFFAOYSA-N	430.408	1.744	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)C(=O)Nc3cccc(-n4cnnn4)c3)n[nH]2)c1	785126961	WCYIZGUEYNUGOM-UHFFFAOYSA-N	445.443	1.069	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCc2ncnn2-c2ccccc2)nc1	787351517	WXUAEQQCQGFCPP-UHFFFAOYSA-N	430.494	1.175	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)C1CCN(C2CC2)CC1	787439818	LYVPBHBBYOTAMU-UHFFFAOYSA-N	433.984	1.479	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2cc(C)cnc2Cl)c2ccccc2c1=O	787888684	DZIDYWJKAYUSTH-UHFFFAOYSA-N	428.836	1.173	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cccnc2C(F)(F)F)cc1OC	788132248	XNEBLLZTIAHFDW-UHFFFAOYSA-N	427.335	1.736	50	20	IDGD	
CC(C)(C)OC(=O)N1CC2(C[C@H]2C(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)C1	789286277	NKGZCMCUOXHCHC-AWEZNQCLSA-N	437.880	1.901	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)Nc1nc2c(s1)CCCC2	789732801	YGVDVXYFTJGBSP-UHFFFAOYSA-N	426.296	1.523	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)NNC(=O)c2cc3ccccc3cc2O)ccc1OC	792520467	BOWDYSRTWZHQPM-UHFFFAOYSA-N	429.454	1.537	50	20	IDGD	
CC(=O)N[C@H](CC(=O)N([C@H]1CCS(=O)(=O)C1)N(C)C)c1ccc(Br)cc1	792855835	URDXSHICDUMNFP-JKSUJKDBSA-N	446.367	1.509	50	20	IDGD	
Cc1nc(C)c(CCC(=O)NNC(=O)c2ccc(CSc3nncn3C)cc2)c(O)n1	792930763	AEOROPCPZUECAY-UHFFFAOYSA-N	441.517	1.614	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c(Br)c1	794578758	MHILUFMBEVOSGF-AWEZNQCLSA-N	443.275	1.607	50	20	IDGD	
CCOC(=O)C1=NN(c2ccccc2)[C@@H](C(=O)NNC(=O)C(=O)Nc2ccc(C)cc2)C1	801108066	BEHPOQUQLQLKER-GOSISDBHSA-N	437.456	1.279	50	20	IDGD	
Cc1nnnn1[C@H](Cc1ccccc1)C(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	802067250	AGKXACQEVDAILA-QGZVFWFLSA-N	443.489	1.022	50	20	IDGD	
Cc1ccc(Cc2ccccn2)cc1NC(=O)C(=O)NNC(=O)COc1ccccc1O	802566890	HUSUKHYQEHTQJX-UHFFFAOYSA-N	434.452	1.851	50	20	IDGD	
Cc1ccc(-c2cncc(F)c2)cc1NC(=O)C(=O)NNC(=O)CNC(=O)c1ccco1	802570899	AIOJCDHECJNVQA-UHFFFAOYSA-N	439.403	1.305	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)[C@@](C)(O)CSc1cccc(F)c1	803799200	YIBGSTKWNKLUBE-NRFANRHFSA-N	434.489	1.911	50	20	IDGD	
COC(=O)Nc1cccc(CNC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)c1	805817024	VTEGAJJXUYKBMK-UHFFFAOYSA-N	435.462	1.804	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(Cl)cc2c1OCC(=O)N2	806974080	SVIIWHQBBVUKFN-UHFFFAOYSA-N	446.847	1.398	50	20	IDGD	
Cc1cc(-c2csc(NC(=O)C(=O)NNC(=O)CNC(=O)c3cccs3)n2)c(C)o1	807004702	RLLRYNFKAMIZAM-UHFFFAOYSA-N	447.498	1.597	50	20	IDGD	
Cc1ccc(C)c(-n2ncc(NC(=O)C(=O)NNc3ccc(-n4ccnc4)nn3)c2C)c1	807429796	WJCQKEHOMHBEAH-UHFFFAOYSA-N	431.460	1.855	50	20	IDGD	
N#Cc1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2cccc(Br)c2)cc1	810449222	KFXBEBAJUQDXQE-UHFFFAOYSA-N	437.275	1.060	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)CNS(=O)(=O)c1c(F)cccc1F	811462705	WJFVMRUOFGGZLJ-SNVBAGLBSA-N	447.847	1.511	50	20	IDGD	
COc1ccc(S(=O)(=O)NCC(=O)NNc2cccc(F)c2[N+](=O)[O-])cc1OC	811476112	OSTSEKHUAGZUNP-UHFFFAOYSA-N	428.398	1.173	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)N[C@H]1CC(=O)N(c2ccccc2F)C1	813236354	JEJFPKUVXHRIDP-AWEZNQCLSA-N	430.436	1.739	50	20	IDGD	
CC(=NNC(=O)Nc1ccc(S(N)(=O)=O)cc1)c1ccc(S(C)(=O)=O)c(F)c1	814967340	HBSCQXMLPUMYHI-UHFFFAOYSA-N	428.467	1.422	50	20	IDGD	
CCOC(=O)c1cc(COC)cc(NC(=O)C(=O)NNC(=O)c2ccc(C)cc2O)c1	815568483	JVVLLKUJVRKELX-UHFFFAOYSA-N	429.429	1.423	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCc2nncn2C1)C(=O)Nc1cccc(Sc2ccccc2)c1	815691943	GFEWSRKSZHDDSP-AWEZNQCLSA-N	436.497	1.778	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)C(=O)Nc2ccc3c(c2)CC(=O)N3)c1	815866233	UMPAXBCVKWMHBD-UHFFFAOYSA-N	447.245	1.812	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)c2ccc(F)c(S(N)(=O)=O)c2)c1	818756724	JQQKTEPDUYFXTC-UHFFFAOYSA-N	446.254	1.779	50	20	IDGD	
CSC[C@H](C(=O)NNC(=O)COc1cc(C)cc(C)c1)N1C(=O)[C@H]2CCCC[C@H]2C1=O	863998488	YWNTVHYNOKMRHD-FGTMMUONSA-N	447.557	1.736	50	20	IDGD	
CC(=O)Nc1cccc(NC(=S)NNC(=O)Cc2csc(N3CCOCC3)n2)c1	913140670	JYIKQAFXYYBYIV-UHFFFAOYSA-N	434.547	1.498	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)OC(C)(C)C)cc1S(=O)(=O)NCc1ccccn1	913176204	IAYSAWPXZSOKSW-UHFFFAOYSA-N	436.490	1.738	50	20	IDGD	
Cc1ccc(NC(=S)NNC(=O)c2ccc(S(=O)(=O)N3CCOCC3)o2)c(C)c1	914881611	IFHMDBGAIFAXFO-UHFFFAOYSA-N	438.531	1.549	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Nc2ccccc2SCC(N)=O)cc(OC)c1OC	915932227	ZBTPCGYMZDDQHA-UHFFFAOYSA-N	434.474	1.756	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)NCc1ccc(N2CCN(C)CC2)nc1	916247290	NUFNBXJTXZYWDJ-UHFFFAOYSA-N	442.520	1.142	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NCC2(N3CCSCC3)CCCC2)c2ccccc2c1=O	916616217	FXKCMULUZDOYAX-UHFFFAOYSA-N	444.561	1.239	50	20	IDGD	
C[C@H](C(=O)Nc1cccc(F)c1)N1CCN(CC(=O)NNC(=O)c2ccc(F)cc2)CC1	917124117	GMMQQQFWAFPOGV-OAHLLOKOSA-N	445.470	1.371	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CC(c2ccc(Cl)cc2Cl)=NO1)c1ccc(-n2cnnn2)cc1	917924870	BBUFYJUCQIRSDD-INIZCTEOSA-N	446.254	1.923	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2cc3c(=O)n(C)c(=O)n(C)c3n2C)c(C)n1-c1ccccc1	919690437	OQAKKTJZAPRBSW-UHFFFAOYSA-N	448.483	1.058	50	20	IDGD	
CNS(=O)(=O)c1ccc([C@H](C)NC(=O)NNC(=O)c2cn(C)c3ccccc23)cc1	919779314	QDFADSAWNUHDSP-ZDUSSCGKSA-N	429.502	1.792	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)n[nH]2)cc1	920212653	SPIQXNYFKNCPRZ-UHFFFAOYSA-N	443.485	1.410	50	20	IDGD	
O=C(NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)C(=O)c1ccc2c(c1)CCC2	920418270	FYOJYWXBVKSZAS-UHFFFAOYSA-N	441.509	1.604	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)[C@@H]1COc2ccccc2O1)c1cccc(N2CCOC2=O)c1	920966279	JMRFHLNVCHJDFR-ACJLOTCBSA-N	426.429	1.875	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNS(=O)(=O)c1cc(S(C)(=O)=O)ccc1F	921294903	DFYPNOCIIMTTQQ-UHFFFAOYSA-N	446.478	1.016	50	20	IDGD	
C[C@@H](CCNC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)N(C)C(=O)OC(C)(C)C	1318488852	JOXLZMWWCLIKAO-ZDUSSCGKSA-N	442.538	1.680	50	20	IDGD	
Cn1cc(N2CC[C@H](NC(=O)NNC(=O)c3ccc(F)cc3Br)C2)cn1	1318575633	OLPAOYWBTOCATN-NSHDSACASA-N	425.262	1.545	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)[C@@H](c1cnn(C)c1)N(C)C(=O)OC(C)(C)C	1322408601	SSZNDXNCQJVSBV-QGZVFWFLSA-N	441.492	1.745	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1nc(O)n3c1CCCC3)C2)[C@@H](F)Cl	1778030913	NVJPPOGASJIGDG-ZXYWRSMDSA-N	428.892	1.587	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)N2C[C@H]3C[C@H]3C2)C1	1779262887	JOVYVBJCRISDHU-MVKVRZLJSA-N	442.398	1.624	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cn3cc(F)ccc3n1)CCO2	1779296904	LKCBIBIOCQIYGO-HXUWFJFHSA-N	434.544	1.768	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccc(-n3cccn3)nc1)CCO2	1779297835	ATKDUWHKOKOCKV-OAQYLSRUSA-N	443.580	1.562	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(C1)CN(C(=O)C(C)(C)C#N)CCO2	1780095299	PEEUOTUGLIFGKP-NRFANRHFSA-N	444.444	1.513	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(C1)CN(C(=O)C(F)F)CCO2	1780096858	JDIRWDNLLCLUOB-SFHVURJKSA-N	427.360	1.229	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(C1)CN(C(=O)C1(C)CC1)CCO2	1780097321	XFYIPNQXKRUJHT-NRFANRHFSA-N	431.445	1.764	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)n(C(F)F)n1	1780312737	FQUKPJADMFWDPI-ABAIWWIYSA-N	439.232	1.721	50	20	IDGD	
Cc1cncc(CCC(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](F)Br)C3)C2)c1	1781325679	GYBMTPZMHVSIAF-WMZOPIPTSA-N	428.302	1.843	50	20	IDGD	
O=C(COc1ccc(F)cc1)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781328652	VJBZZEAYWAEZEP-NVXWUHKLSA-N	433.249	1.725	50	20	IDGD	
C[C@@H]1CCc2c(C(=O)N3CCO[C@@]4(CCN(C(=O)[C@@H](F)Br)C4)C3)n[nH]c21	1781330362	WXYSSFGPAQMPEY-LGFNAOKASA-N	429.290	1.593	50	20	IDGD	
O=C([C@@H](F)Br)N1CC[C@]2(C1)CN(C(=O)[C@@H]1Cc3ccccc3N1)CCO2	1781332632	CFYPLHPMSJTXEN-DAYGRLMNSA-N	426.286	1.544	50	20	IDGD	
Cc1noc(N)c1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)Br)C1	1781998411	SWAMVADGSNDXGB-ILMHXZGMSA-N	429.315	1.476	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](CN)c1ccccc1)C2	1782170778	XJPRIZHAGDMUDA-VQQMMKBISA-N	437.968	1.497	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4c(c3)NC(=O)CC4)C2)C1	1782515067	QOOJALLAOUEURY-HRAATJIYSA-N	435.908	1.269	50	20	IDGD	
O=C(Cc1cccc(C(F)(F)F)c1)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1782979457	MEXNXHPHNXOLSB-CRAIPNDOSA-N	434.842	1.678	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cccc(=O)n3C)CCO2)C1	1783344992	VIBDHRYZVRIBCF-UGSOOPFHSA-N	426.311	1.002	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)CCc3ccc(OC)nc3)CCO2)C1	1783872601	COOKWEUEPYMPLO-UZLBHIALSA-N	425.913	1.107	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(OCCCO)cc3)CCO2)C1	1783883150	VILHJBBRKDAAAO-GHTZIAJQSA-N	440.924	1.145	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccn4nccc4c3)C[C@@H]21	1783966637	IQOOJOYMPJMPRN-IKICRFKJSA-N	449.349	1.959	50	20	IDGD	
Cc1nn(C)c(C)c1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)CBr)C[C@@H]21	1784699624	RFZKRTQKYDFWFM-MEYUZBJRSA-N	441.370	1.661	50	20	IDGD	
COc1cccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]32)n1	1785811341	CLSIFRQWGZMSBN-NGOJXBLDSA-N	430.332	1.920	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](N)c3ccccn3)[C@H]2C1	1786872574	RUEIGBHOUNFRAF-GFISCPRKSA-N	439.354	1.235	50	20	IDGD	
O=C(CSc1ncccn1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21	1787075223	WYVQHPZQWKYVGT-ZJQBRPOHSA-N	447.330	1.239	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)c1cc(C(F)F)no1	1787141397	UOLYTZFNASMWLV-OSTYVCCYSA-N	440.216	1.896	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(Cl)nn3)C[C@@H]21)[C@H](F)Br	1789924431	CZSWXHVUMXOCRQ-PZEZNAACSA-N	435.681	1.414	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc([N+](=O)[O-])[nH]3)C[C@@H]21)[C@@H](F)Br	1789924880	ZVTDIJDNGSHBCV-LKAMGYQZSA-N	433.234	1.207	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3ccc(O)nn3)[C@H]2C1	1790566204	CVECCJYOSZYDDS-VFSPDHHESA-N	445.347	1.331	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccnc(Cl)n3)C[C@@H]21	1791058633	ACDADNBPSFOHSO-ZPFDUUQYSA-N	431.718	1.507	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3ccnc(OC)c3)C[C@@H]21	1791252564	MUGGSHCSLONNEV-XSLAGTTESA-N	439.940	1.256	50	20	IDGD	
O=C([C@H](O)CCl)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3CC[C@H](C(F)(F)F)CC3)[C@H]2C1	1792149746	XUVKAKJHSJMXCK-SBOZNWLOSA-N	440.890	1.935	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCCn1cccc1)C2	1792873317	SGMYUJDROAWQBZ-CUSZFKRNSA-N	426.355	1.889	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2)C(=O)c1ccc(Cl)cc1	1792945955	FVKJQIUPKHBFHA-YWVIFJGQSA-N	443.725	1.897	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1C[C@@H]1c1ccc(F)c(F)c1)C2)[C@@H](O)CCl	1792975441	RZJBVWANJIOWPF-HWAOXGGSSA-N	428.863	1.258	50	20	IDGD	
CN(CCCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCl)C(=O)OC(C)(C)C	1793117474	NYDBGGBYXRNJQZ-QKPAOTATSA-N	431.961	1.871	50	20	IDGD	
CC[C@@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)CBr)C2)N(CC)CC	1793454571	NGMLGMOJSHEDBY-KSWRQPAISA-N	432.403	1.727	50	20	IDGD	
COc1cccnc1CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@](C)(Cl)CCl)C2	1794031360	DOWSXDMPANYNJY-VLBMKZOESA-N	444.359	1.849	50	20	IDGD	
Cc1cccnc1CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnccc1C(=O)NN)C2	1794264624	SDGQLSWAHMFBBN-BJWYYQGGSA-N	436.516	1.273	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](CN)c1ccccc1	1795670479	CPFHWQAEORYDKJ-SOVHRIKKSA-N	438.366	1.350	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCc1cncnc1	1795807545	RATXTPIZCYMXMB-JYYAWHABSA-N	425.327	1.172	50	20	IDGD	
C=C(Oc1ccccc1O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2	1796432344	RJJVMSQICZODTI-NOXHYTERSA-N	443.269	1.565	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccnn1-c1ccccc1	1796741081	RYLLLGZEPMZWTO-UPHUGPLXSA-N	442.592	1.927	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)N1C[C@H]2C[C@@H]2C1	1797638905	YBBDTBREBOUBND-YDLMYCGBSA-N	428.371	1.090	50	20	IDGD	
Cc1cccc(C)c1SCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2	1797948571	SOLSFLAOKCAMSJ-KYHPRHEASA-N	426.966	1.585	50	20	IDGD	
Cn1ncc2cc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@@H](F)Br)ccc21	1799346755	ABWCVHKOKVORGO-OCVGTWLNSA-N	439.285	1.467	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c[nH]c3ncccc13)C2)[C@H](F)Br	1799346883	DQDRXNZZZGYROT-DJBIQUGXSA-N	425.258	1.457	50	20	IDGD	
CCOC(=O)C1(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](Br)CC)C3)CC1	1800367408	KGIHVLOFZHBRGF-XJFOESAGSA-N	431.327	1.093	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1cnc3[nH]ccc3c1)C2)C(Cl)Cl	1801017929	ATQHILYKIKVDST-MIFYACCESA-N	425.316	1.889	50	20	IDGD	
C[C@@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1nc(O)n3c1CCCC3)C2	1801962925	DEBONGSJZADUIM-FVCCEPFGSA-N	425.327	1.960	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)/C=C/c2ccc([N+](=O)[O-])o2)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803136084	NCNQCMKCVUACNM-CTAJETNHSA-N	448.863	1.902	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCCC2(CCN(C(=O)c3cc(=O)n4[nH]cnc4n3)CC2)C1	1805260057	SDIJVVQLPWDXDU-UHFFFAOYSA-N	434.928	1.527	50	20	IDGD	
CCNC(=S)NCC(=O)N1CCC2(CCCN(C(=O)[C@@H](C)CBr)C2)CC1	1805389967	YXGCRXRVDBNGOU-AWEZNQCLSA-N	447.443	1.733	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1	1810527307	PFMKHPVVZGDVCX-QIIPPGSGSA-N	437.338	1.563	50	20	IDGD	
CCc1cc(C(=O)NC[C@@H]2CCN(C(=O)[C@H](Cl)COC)[C@H]2c2cccnc2)n(C)n1	1810922409	SGQJTVWANPJHFD-WDYCEAGBSA-N	433.940	1.951	50	20	IDGD	
Cn1cc2cc(C(=O)NC[C@@H]3CCN(C(=O)[C@H](O)CCl)[C@H]3c3cccnc3)ccc2n1	1812095426	SICVIJARSMWEHU-DBVUQKKJSA-N	441.919	1.888	50	20	IDGD	
COc1nccnc1C(=O)N1CC[C@H](CNC(=O)[C@@H](C)Br)[C@H]1c1cccnc1	1812864743	KJJPAVKVHHQBLF-XNRPHZJLSA-N	448.321	1.983	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)CCN2CCOCC2)[C@@H]1c1cccnc1	1813030238	FNKPXUFRAUMEIR-WSTZPKSXSA-N	438.956	1.064	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)CCSC(=N)N)[C@H]1c1cccnc1	1813030784	LCJGFFJLTJFOFX-YCPHGPKFSA-N	427.958	1.358	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](N)c2ccccn2)[C@@H]1c1cccnc1	1813032226	VCXWYMNWFKWQEG-PBWTXFEYSA-N	431.924	1.436	50	20	IDGD	
Cc1cccnc1C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1813069000	RIGLYUYLOWYCSN-XMSQKQJNSA-N	438.532	1.478	50	20	IDGD	
C[C@]1(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)CC1(F)F	1814073310	AZEMHVZLWCLIOW-PLMTUMEDSA-N	443.259	1.126	50	20	IDGD	
Cc1ccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)nc1	1816540456	XPKVFPHFGZCWIH-LJQANCHMSA-N	433.277	1.413	50	20	IDGD	
CN(C)C(=O)NCC(=O)N1CCCC[C@H]1c1cc(NC(=O)CCBr)n[nH]1	1816780511	WSAQKJBWTCMJAO-LBPRGKRZSA-N	429.319	1.458	50	20	IDGD	
CS(=O)(=O)c1ccc(C(=O)N[C@H]2CCc3nc(NC(=O)[C@@H](F)Cl)sc3C2)nc1	1817117944	QIOQCVKJVFYMDL-ISVAXAHUSA-N	446.913	1.702	50	20	IDGD	
CCc1ccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)cn1	1817473362	ONIAGENGSVHJHI-FQEVSTJZSA-N	447.304	1.667	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H]2C[C@H]2C2CC2)[nH]n1	1819401676	NOBBSRINFJUCCU-MPGHIAIKSA-N	437.504	1.760	50	20	IDGD	
Nc1n[nH]c(CCC(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@H](F)Br)CC3)n1	1819559598	AXBRPKIVTXWEJS-KGFZYKRKSA-N	446.306	1.079	50	20	IDGD	
CC[C@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(=O)n3[nH]cnc3n2)[nH]n1	1820853081	GPBMEDDIFTZKFR-GXFFZTMASA-N	432.872	1.464	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)CN2CCCC2=O)[nH]n1)[C@@H](F)Br	1820932333	GEUQRAYYCLKFSR-XHDPSFHLSA-N	430.278	1.715	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])o2)CC1	1823618585	ZAPQSUDQJRRZPU-MRXNPFEDSA-N	449.508	1.794	50	20	IDGD	
O=C(c1cnc2snnc2c1)N1CCC([C@H]2CCCCN2C(=O)[C@H](O)CCl)CC1	1824185586	KDVJOQDTRIBEFG-HZPDHXFCSA-N	437.953	1.919	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CN1CCN(C)CC1)CC2	1825642561	XCGXAQZZTZSEPV-VXGBXAGGSA-N	444.399	1.086	50	20	IDGD	
O=C(C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1)c1ccco1	1827055922	KEJBEBCXOHXVKJ-IBGZPJMESA-N	438.289	1.076	50	20	IDGD	
O=C(C(Cl)Cl)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827060503	MERRDKSGIJMELN-INIZCTEOSA-N	427.137	1.403	50	20	IDGD	
CC[C@@H](O)C(=O)N1CCC([C@H]2CCCCN2C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)CC1	1827677071	FDMBUVJVYGKWHL-YBOOGWSUSA-N	431.537	1.511	50	20	IDGD	
COCCn1nccc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H](O)CCl)CC1	1827809780	HUHVUMYUMJXFNH-SJLPKXTDSA-N	426.945	1.363	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H](O)N2CCOCC2)CC1	1828969647	WYEZGRADQILAIY-UYAOXDASSA-N	441.645	1.108	50	20	IDGD	
Cc1cccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)c1F	1830103852	MHMOJFWVEHOFDR-KUHUBIRLSA-N	443.313	1.988	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4ncccn4n3)C2)C1	1830362006	IFJMFOANYRGYQY-HXUWFJFHSA-N	435.912	1.064	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(F)s3)C2)C1	1830535820	UAAZFYQHZRHTJZ-YVEFUNNKSA-N	449.342	1.988	50	20	IDGD	
Cc1ccncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1	1831873336	PZLCICMJMARYTB-HXUWFJFHSA-N	429.565	1.996	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)cn1	1831951247	JLOCJDORDXKZHI-FQEVSTJZSA-N	437.569	1.012	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)cn1	1831952983	PQKABZRLASENCY-RBUKOAKNSA-N	446.331	1.397	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3ccccn3)CCO2)C1	1833188102	GOKCVQLVAFKYDG-WOJBJXKFSA-N	444.359	1.707	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccccc3O)CCO2)C1	1833759271	WHLCWHACLJXTMA-KXBFYZLASA-N	441.322	1.636	50	20	IDGD	
O=C(/C=C/C1CCCC1)N1CCOC[C@@]2(C1)CN(C(=O)CCBr)CCO2	1834824053	RTZQHBITOYPWPL-ZMBJWTFHSA-N	429.355	1.974	50	20	IDGD	
C[C@H](Nc1ccccn1)C(=O)NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1835846080	MYKAVIOGAYPJLQ-MAUKXSAKSA-N	437.972	1.053	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3cccnn3)CC2)CC1	1835895388	PWDCAFKUNOWNCR-INIZCTEOSA-N	438.370	1.835	50	20	IDGD	
CC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)CCN3CCN(C)CC3)CC2)CC1	1836395893	QDWUZXKPEPHXHV-FQEVSTJZSA-N	442.048	1.213	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1	1836921984	GDLVCPZTGIFNKC-SFHVURJKSA-N	445.004	1.766	50	20	IDGD	
O=C(C[C@@H]1CNc2ccccc2O1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1837352214	ZDBKAIHYVVYVOS-WNYOCNMUSA-N	441.887	1.240	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(F)nc3)CCO2)C1	1837851460	KMTLEOOUCMJWGS-KDOFPFPSSA-N	444.301	1.464	50	20	IDGD	
Cc1ccoc1C(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1	1837920325	MQXQTEOZUFSBLZ-UHFFFAOYSA-N	440.305	1.194	50	20	IDGD	
CC(C)n1nccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1838025015	ANOVRIPIVMLXSW-YOEHRIQHSA-N	447.305	1.225	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(CC)n(C)n3)CCO2)C1	1838271664	RQMATTZPHNWLOY-UZLBHIALSA-N	426.945	1.460	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)Cn3nccn3)CC2)CC1	1838655567	LKVKKUFPWKDLAE-INIZCTEOSA-N	442.358	1.450	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)Cc3cc[nH]n3)CC2)CC1	1838732552	FZACAFSEWHEHBH-CYBMUJFWSA-N	427.343	1.734	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(F)cc3F)CCO2)C1	1839006860	WIXGPQSZCJZBMZ-HNAYVOBHSA-N	432.851	1.289	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3F)C2)C1	1839152150	PEHJQOZNSVHTSQ-ROUUACIJSA-N	434.295	1.527	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)/C=C/C3CCCCC3)CCO2)C1	1839184353	IWAOTCDUMCWSMW-MVRCGGMCSA-N	428.957	1.833	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3nc4ccccc4o3)CCO2)C1	1839503831	ZGDXEEBRICBIKT-XOBRGWDASA-N	437.880	1.152	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1[C@H]3SC=C[C@H]31)CCO2	1839696550	ABHGEMINUHDDLK-RUENVJTFSA-N	426.611	1.169	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(C)nc3)C2)C1	1839963597	PQALPYDHFZGBIU-QFBILLFUSA-N	440.338	1.634	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](OC)c3ccccc3)C2)C1	1840151713	MCTFFALBTVNDFJ-WAOWUJCRSA-N	440.924	1.084	50	20	IDGD	
Cc1cc(C)cc(CCC(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)c1	1840304668	KSOBRTNFAPOAHE-SIKLNZKXSA-N	438.952	1.292	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(OC)c3F)CCO2)C1	1840794751	UEZGSJGOHQTQGV-FOIQADDNSA-N	444.887	1.158	50	20	IDGD	
COc1ccc(C2(C(=O)N3CC4(CCCN4C(=O)c4ccc(B(O)O)cc4)C3)CCC2)cc1	1843011903	IRAAAGJWBACIDD-UHFFFAOYSA-N	448.328	1.314	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)Cc1cccc(F)c1)C2	1843415859	VUPNYOSCOSXBJD-MFKUBSTISA-N	425.464	1.706	50	20	IDGD	
C[C@@H](C(=O)N1CC2(CCCN2C(=O)[C@@H](F)Br)C1)N1CSCSC1	1845217916	CBYSKCJDTASHJL-WDEREUQCSA-N	426.377	1.923	50	20	IDGD	
Cc1cccc(C)c1N1C[C@@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](O)CCl)CC1=O	1847556250	FVLHEYRICTYPEM-XLAORIBOSA-N	433.936	1.458	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@]2(C(=O)N3CC[C@H]4[C@@H]3CCN4C(=O)[C@H](O)CCl)C[C@H]2C1	1847563081	MINRKPCMHGXPEW-UFJVTBDRSA-N	441.956	1.435	50	20	IDGD	
C=CCNS(=O)(=O)c1cccc(C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)c1	10159984	QBJGRVNOMTZKFR-UHFFFAOYSA-N	441.469	1.117	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)c3ccccc3F)CC2)cc1	23650466	UMALNFGXPDFYMN-UHFFFAOYSA-N	435.477	1.696	50	20	IDGD	
CCOc1ccc(NC(=S)NNC(=O)Cn2c(=O)n(CC)c(=O)c3ccccc32)cc1	28633696	XZOWGNOWEWNDAW-UHFFFAOYSA-N	441.513	1.600	50	20	IDGD	
C[C@H]1CC(C)(C)C[C@@]2(C1)NC(=O)N(CC(=O)NNC(=O)c1ccc3c(c1)OCCO3)C2=O	105279431	AHCZKRUTKLSMJK-WHEQGISXSA-N	444.488	1.356	50	20	IDGD	
CC1CCN([C@H](CNC(=O)NNC(=O)CNC(=O)c2ccco2)c2cccs2)CC1	726085133	XZMCGRKGGCZYGC-OAHLLOKOSA-N	433.534	1.875	50	20	IDGD	
CCOc1ccc(/C=C(/C#N)C(=O)NCCC(=O)N2CCN(c3ncccn3)CC2)cc1	726544855	YRCMQHMHPXUQIJ-MNDPQUGUSA-N	434.500	1.637	50	20	IDGD	
O=C(NNC(=O)N1CCC[C@H]1c1cccc2c1OCCO2)c1ccc(-n2cnnn2)cc1	727473660	OIFKVKCUXCPAKD-KRWDZBQOSA-N	435.444	1.625	50	20	IDGD	
CC(C)(C)OC(=O)N(CCNC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)C1CC1	727606179	QIUSWUFNJDUJJU-UHFFFAOYSA-N	440.522	1.434	50	20	IDGD	
N#Cc1ccccc1N1CCCN(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)CC1	728959837	QRMZQXUTXKTCEG-UHFFFAOYSA-N	448.531	1.518	50	20	IDGD	
COc1cc(OC)cc(C(=O)NCC(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)c1	728974733	ZRLHSHCHEDPIBW-UHFFFAOYSA-N	443.428	1.573	50	20	IDGD	
CCN1CCN(c2ccc(F)cc2[C@@H](C)NC(=O)NNC(=O)Cc2cccnc2)CC1	729053481	ITNZKCCGCZLICQ-MRXNPFEDSA-N	428.512	1.997	50	20	IDGD	
O=C(CC1(CC(=O)NNC(=O)c2ccccn2)CCCCC1)NNC(=O)c1ccccn1	729833407	HKHNGWPZAILNGI-UHFFFAOYSA-N	438.488	1.430	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)c1cc(S(N)(=O)=O)c(Br)s1	731501621	ZFPVGIVWSMUSFJ-UHFFFAOYSA-N	434.293	1.241	50	20	IDGD	
Cc1ccc([C@]2(C)NC(=O)N(CC(=O)NNc3ccccc3S(C)(=O)=O)C2=O)cc1	732303048	VDZAUXJONCBAEI-FQEVSTJZSA-N	430.486	1.309	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)CNC(=O)c1ccc(F)cc1F	734250874	NCARBOGTYCZEGW-UHFFFAOYSA-N	440.472	1.915	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)c1	735117640	ZXIBPDARBJECTL-INIZCTEOSA-N	433.534	1.237	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N1CCS(=O)(=O)[C@H](C)[C@H]1C	736372208	DTAXGZSASRPYCW-GRYCIOLGSA-N	448.339	1.465	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)NNC(=O)c1ccc(Br)s1	738450634	OWTAAMSJBXWUIQ-UHFFFAOYSA-N	427.280	1.703	50	20	IDGD	
COc1cc(I)c(C(=O)NNc2ccnc(N(C)C)n2)cc1OC	740113000	WLKKYQJOHBSLHX-UHFFFAOYSA-N	443.245	1.921	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)[C@@H]2CCCN(C(=O)COc3ccccc3)C2)nc2ccccc21	741206976	HTUXFXKRSWNTHM-QGZVFWFLSA-N	449.511	1.581	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(Br)c(C(F)(F)F)c1)c1cnccn1	743250892	ITLDYDOESIPYOK-UHFFFAOYSA-N	425.186	1.881	50	20	IDGD	
O=C(CN1C(=O)[C@H]2[C@H](C1=O)[C@H]1CC[C@H]2O1)NNc1ccc(Br)cc1Cl	743334982	KLLXEQPKAVJKER-HBJVGIJOSA-N	428.670	1.708	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NC[C@H](O)c1cnn(C)c1	743521629	RCYXDBJYDLPXBN-YGRLFVJLSA-N	426.271	1.014	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(C)c(NC(=S)NNC(=O)N2CCOCC2)c1	745729616	IWOUOJZHVATJRQ-UHFFFAOYSA-N	429.568	1.269	50	20	IDGD	
NC(=O)[C@H]1CCCN(CCCNC(=O)NNC(=O)c2ccc(F)cc2Br)C1	745829876	HUPOGDIXUMMJGK-NSHDSACASA-N	444.305	1.120	50	20	IDGD	
C[C@H](CN1CCN(c2ccccc2)CC1)NC(=O)NNC(=O)c1nnc(O)c2ccccc12	745840782	YIXPWVNZLRNRBN-MRXNPFEDSA-N	449.515	1.490	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@@H]2[C@@H]3CCCO[C@@H]3C2(C)C)cc1	745860368	QNURABMWXQQNAK-JQHSSLGASA-N	438.550	1.150	50	20	IDGD	
C[C@@H]1C[C@H](NC(=O)NNC(=O)CCSc2ccc(F)cc2)C(=O)N1c1cnn(C)c1	745919958	XSPOPASFLMQYKP-WBMJQRKESA-N	434.497	1.566	50	20	IDGD	
Cc1noc(C(F)(F)F)c1C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	746098726	YNYXWPSEUIUICF-UHFFFAOYSA-N	426.760	1.377	50	20	IDGD	
CCn1nc(C(=O)NN=C(C)c2ccc(NS(C)(=O)=O)cc2)c2ccccc2c1=O	747045830	MMVAYMKEUOVSRB-UHFFFAOYSA-N	427.486	1.942	50	20	IDGD	
O=C(NCCCN1C(=O)NC2(CCCCC2)C1=O)NNC(=O)c1cccc2cccnc12	747460140	CXMWHTADAUPBIJ-UHFFFAOYSA-N	438.488	1.824	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)NCc1cccc(NC(=O)NCc2ccncc2)c1	747587256	XGBGUCNUAQIIJZ-UHFFFAOYSA-N	433.472	1.871	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)[C@H](Cc1c[nH]c2cc(F)ccc12)NC(C)=O	749529104	BEQUZLWKFXBVFU-IBGZPJMESA-N	426.448	1.753	50	20	IDGD	
Cc1nn(-c2cncc3nnnn23)c(C)c1CC(=O)NN=c1sc2ccccc2n1C	749587261	GHIVKNRJLSKNRT-UHFFFAOYSA-N	434.489	1.050	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)NCc2ccccc2CN2CCC(O)CC2)c1	749588700	DXRLYYSHFLQYOH-UHFFFAOYSA-N	425.533	1.854	50	20	IDGD	
COC(=O)c1ccc(S(=O)(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)cc1Cl	749772240	UOTZAOIGJHKHTR-UHFFFAOYSA-N	429.794	1.364	50	20	IDGD	
COc1ccccc1N1CC[C@H](CNC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)C1	750331782	YYIWJHZLASXUAC-OAHLLOKOSA-N	436.476	1.141	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)NNC(=O)c2ccc(F)cc2Br)ccc1F	752512389	ADZOUSJXERBPEM-UHFFFAOYSA-N	448.245	1.710	50	20	IDGD	
COc1cc(OC)cc(OCCCNC(=O)NNC(=O)c2ccc3c(c2)OCCO3)c1	753925658	OFKPTYDTWFJVMC-UHFFFAOYSA-N	431.445	1.888	50	20	IDGD	
CN1CC[C@@H](NC(=O)NNC(=O)C(=O)Nc2ccccn2)[C@@H]1c1ccc(Cl)c(F)c1	755100898	VOQLPVIFSOCCCL-ZBFHGGJFSA-N	434.859	1.588	50	20	IDGD	
CCCC[C@H](NC(=O)[C@H](C)NC(=O)C(C)(C)C)C(=O)NNC(=O)c1ccc(Cl)nc1	755185832	NPKCBXWNHLKAIG-JSGCOSHPSA-N	439.944	1.722	50	20	IDGD	
CN(C)c1ccc(S(=O)(=O)N2CCCCC2)cc1NC(=O)NNC(=O)c1ccccn1	755434095	FJMNBCNHDFZTRQ-UHFFFAOYSA-N	446.533	1.789	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)C(=O)Nc1ncc(Cc2ccccc2)s1	756198596	MUTOIXNEVNTMJK-UHFFFAOYSA-N	434.481	1.710	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)Nc2ccn(CCOC)n2)c2ccccc2c1=O	756311424	PITAJJNMXHCOFT-UHFFFAOYSA-N	427.465	1.506	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1ccc([C@@H](C)NC(=O)OC(C)(C)C)cc1	756813745	CIXKEKDOXONCCX-NEPJUHHUSA-N	443.526	1.363	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)Nc1ccccc1OCC(=O)N1CCOCC1	756873069	GKAIKKBGBVOLKV-UHFFFAOYSA-N	443.416	1.299	50	20	IDGD	
COc1ccc(C(C)(C)C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1OC	758152286	RBTMYEJWNOLHML-UHFFFAOYSA-N	449.529	1.693	50	20	IDGD	
Cc1cccc2c(=O)n(CC(=O)OCC(=O)NNC(=O)c3cccc(Cl)c3)cnc12	760848641	HWYKPIFUERXETD-UHFFFAOYSA-N	428.832	1.363	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)Cc2cccc(I)c2)C[C@@H](C)O1	760988087	OGOSYLJRCNPESH-BETUJISGSA-N	445.301	1.480	50	20	IDGD	
O=C(CCc1ccco1)NNC(=O)[C@@H]1CCCC[C@H]1C(=O)NNC(=O)CCc1ccco1	761154035	FNUDRQUHJFEQEP-QZTJIDSGSA-N	444.488	1.539	50	20	IDGD	
CC(=O)c1cccc(NC(=O)C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c1	763530155	DVJLHTBFDCPVSO-UHFFFAOYSA-N	437.500	1.187	50	20	IDGD	
COc1ccc(C(=O)N2CCCC2)cc1NC(=O)C(=O)NNC(=O)c1c[nH]c2ccccc12	763536504	RVVWVONQDCCHPL-UHFFFAOYSA-N	449.467	1.812	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)ccc1F	763543238	NALWAIJSJMRFTQ-UHFFFAOYSA-N	449.391	1.038	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)Nc1ccc(Oc2ccncc2)cc1	763577023	GCHBYCJKTVVUST-LJQANCHMSA-N	434.408	1.800	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)Nc1ccc(-c2n[nH]c(C3CC3)n2)cc1	763577720	KFMTXFSYJLXNBY-KRWDZBQOSA-N	448.439	1.275	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccnc1N1CCCCC1	763657681	OXITYVQCXAHWGC-UHFFFAOYSA-N	427.461	1.245	50	20	IDGD	
COCCOc1ccc(F)cc1NC(=O)C(=O)NNC(=O)COc1ccc(Cl)cc1	763684881	PWPUWPNQSSSVDX-UHFFFAOYSA-N	439.827	1.669	50	20	IDGD	
CCn1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2Cc2ccccc2)ccc1=O	763717848	BBXLNLKOOSSHHM-UHFFFAOYSA-N	448.479	1.624	50	20	IDGD	
O=C(NNC(=O)c1cc2c(s1)CCC2)C(=O)Nc1cccn(Cc2ccccc2)c1=O	763784426	WUOSHYCDSHYFIV-UHFFFAOYSA-N	436.493	1.847	50	20	IDGD	
Cc1cc(S(C)(=O)=O)ccc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccccc1F	763865852	RRGNDGNSDHDYSA-LBPRGKRZSA-N	437.449	1.091	50	20	IDGD	
CC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(C(C)=O)cc2)c1C	763872027	JFZGVSZIYUIVOK-CQSZACIVSA-N	440.456	1.709	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)Cn2nc(C)cc2C)c(OCC(F)(F)F)c1	763893636	XMBMWTISRPYFTL-UHFFFAOYSA-N	427.383	1.536	50	20	IDGD	
Cc1ccc(NC(=O)C2CC2)cc1NC(=O)C(=O)NNC(=O)c1cc(Br)c[nH]1	763996012	TVDLIPVZCQVYSB-UHFFFAOYSA-N	448.277	1.834	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)on2)cc1-n1cnnn1	764016017	CIVVKQMUIHDENA-UHFFFAOYSA-N	432.400	1.025	50	20	IDGD	
Cn1cc(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3c2)cc(Br)c1=O	764067215	QZEHGETXIZTQSR-UHFFFAOYSA-N	443.257	1.701	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)c2cccc3ncccc23)cc1F	764257954	RKQFKHWBQYOSEV-UHFFFAOYSA-N	426.404	1.799	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CCc2ccccc2O)c(OCCN(C)C)c1	764287819	AHAKHDDBVKBDHO-UHFFFAOYSA-N	428.489	1.360	50	20	IDGD	
COc1ccc(COc2cccc(F)c2)cc1NC(=O)C(=O)NNC(=O)c1c[nH]nc1C	764298167	PUTWCQZMYNYIAE-UHFFFAOYSA-N	441.419	1.845	50	20	IDGD	
C[C@@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)Cc3ccccc3F)cn2)C[C@@H](C)O1	764312948	DYEGCZBFESWIHV-ZIAGYGMSSA-N	429.452	1.163	50	20	IDGD	
CCCN1Cc2cccc(NC(=O)C(=O)NNC(=O)c3cnn(-c4ccccc4)c3)c2C1	764351082	ONHZKTHNNPSPIV-UHFFFAOYSA-N	432.484	1.998	50	20	IDGD	
Cc1cc(N2CCOCC2)ccc1NC(=O)C(=O)NNC(=O)COCc1ccccc1	764366893	QIDZZMYDYPFHEF-UHFFFAOYSA-N	426.473	1.134	50	20	IDGD	
CCOC(=O)c1cc(Br)ccc1NC(=O)C(=O)NNC(=O)c1ccc(C)o1	764367894	MPSUBHWEASQUII-UHFFFAOYSA-N	438.234	1.927	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(Br)cc2S(C)(=O)=O)o1	764372352	XUSPSOVLEKOBEV-UHFFFAOYSA-N	444.263	1.154	50	20	IDGD	
CNC(=O)c1ccc(C)c(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)c1	764388536	UBFCIKBGRXUVCU-UHFFFAOYSA-N	438.419	1.284	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)C(=O)Nc1c(C)cnn1Cc1cc(F)ccc1F	764389254	PHIFHVYTFJBLTK-UHFFFAOYSA-N	428.399	1.621	50	20	IDGD	
CC(C)Oc1ccc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)cc1C#N	764400005	DGFRKVQPIGGMNR-UHFFFAOYSA-N	428.470	1.929	50	20	IDGD	
COc1ccc(C(C)(C)C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1	764551055	BQPQOGMSHNNVAF-UHFFFAOYSA-N	425.894	1.735	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccccc2)n[nH]1	765592744	QLHFARKYSOVOFR-UHFFFAOYSA-N	443.485	1.167	50	20	IDGD	
CN1CCO[C@H]([C@H](NC(=O)NNC(=O)C(=O)Nc2ccccn2)c2ccc(Cl)cc2)C1	766319549	MZCLISPKCFEKBY-DOTOQJQBSA-N	446.895	1.076	50	20	IDGD	
COc1nc(N(C)C)sc1C=NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	767037545	SVDXDUZSTTZECR-UHFFFAOYSA-N	437.547	1.766	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)CN2C(=O)N[C@@]3(CCCC(C)(C)C3)C2=O)c1	768566614	UKJOKYZTLLWDPX-OAQYLSRUSA-N	432.477	1.356	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)c1cc(Cl)cc(Br)c1F	770040010	GKDZATJQPVBGOT-UHFFFAOYSA-N	429.633	1.828	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)NCc3ccccc3Cn3cncn3)nc21	770343430	YFGGJMMKXTWNHJ-UHFFFAOYSA-N	436.480	1.753	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)CCNC(=O)c3n[nH]c4ccccc34)nc21	770957028	ZUIOLBLOBTWEDQ-UHFFFAOYSA-N	437.464	1.426	50	20	IDGD	
CCCOc1cccc(CCNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)c1	771199745	JRAMXPCNRIHHGU-UHFFFAOYSA-N	433.534	1.955	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(OC(F)F)cn2)c1	771843890	DBCIEYRJBWVEOJ-UHFFFAOYSA-N	442.444	1.788	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H]1C(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772888877	NIQONUYYEHCROE-LSDHHAIUSA-N	438.912	1.797	50	20	IDGD	
O=C(NNC(=O)N1CC[C@@H]2[C@H](CCCN2C2CC2)C1)c1csc(N2CCOCC2)n1	772973574	RLNYSFKELALDFM-RHSMWYFYSA-N	434.566	1.283	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)[C@@H]2CC[C@H](C(F)(F)F)NC2=O)C1	773410876	FSZMAKNYRXPTNS-QJPTWQEYSA-N	436.431	1.238	50	20	IDGD	
O=C(NNc1c(Cl)cccc1Cl)C(=O)Nc1ccnn1[C@@H]1CCS(=O)(=O)C1	773696533	CRUHGGJEAFYWEH-SECBINFHSA-N	432.289	1.631	50	20	IDGD	
COC(=O)CCc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)cc1	774008681	LICFJCREUHBJNB-CYBMUJFWSA-N	447.875	1.999	50	20	IDGD	
O=C(NNC(=O)c1cc2ccccc2o1)Nc1ccc(S(=O)(=O)N2CCOCC2)cn1	776062119	QLAYRZVVLDZKRK-UHFFFAOYSA-N	445.457	1.315	50	20	IDGD	
O=C(OCc1ccccc1)N1CC[C@@](F)(C(=O)NNc2nccc(N3CCOCC3)n2)C1	777522684	BKWBZZWMCLSWKT-NRFANRHFSA-N	444.467	1.507	50	20	IDGD	
CC(C)CS(=O)(=O)N1CCC(NC(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)CC1	777765435	QQYKKACPJCXDFE-CQSZACIVSA-N	444.529	1.374	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2c(C)csc2C(=O)OC)cc1	782120214	HOCGQVDVJNEQRW-GFCCVEGCSA-N	449.485	1.795	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCC[C@@H](n3ccc(C(F)(F)F)n3)C2)n1	782533210	RYOYSHVCSWXABS-GFCCVEGCSA-N	430.456	1.694	50	20	IDGD	
Cc1cnn(-c2ccc(NC(=O)C(=O)NNC(=O)Cc3nc4ccccc4n3C)cc2F)c1	782888574	UZTZWYBTKHOFSM-UHFFFAOYSA-N	449.446	1.535	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2ccc(S(=O)(=O)N3CCC[C@H](C)C3)cc2)nc(C)n1	783326384	DDFHZNXMSUMYNU-ZDUSSCGKSA-N	446.533	1.596	50	20	IDGD	
COc1cc(Br)cc(C)c1NC(=O)C(=O)NNc1ccc(-n2cccn2)nn1	783436672	MHALSIWMYRMSIL-UHFFFAOYSA-N	446.265	1.824	50	20	IDGD	
CC(C)n1ncc2ccc(NC(=O)C(=O)NNC(=O)CNC(=O)c3cccs3)cc21	784003443	FXJYAKHSDVRZBI-UHFFFAOYSA-N	428.474	1.195	50	20	IDGD	
CN1CCC/C1=N/S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccnc(F)c2)cc1	784848978	PUZJVZQWSDEONH-JLPGSUDCSA-N	434.453	1.115	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2cc3c(cc2[N+](=O)[O-])OCCCO3)n1	785225951	ABCNDGXWCRKAEB-UHFFFAOYSA-N	445.436	1.474	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)Cc2cccnc2)c(OCc2ccccc2)c1	785989944	ATPSMJMNIWZMQP-UHFFFAOYSA-N	434.452	1.998	50	20	IDGD	
Cc1ccc(C)c(-n2cnc3cc(C(=O)NNC(=O)N[C@@H]4CCS(=O)(=O)C4)ccc32)c1	788500707	AFSLHTIKEFKNQL-MRXNPFEDSA-N	441.513	1.773	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cc([C@H]4CCCO4)nn3C)n[nH]2)cc1	789733558	NOEKMEDSZRMUBE-QGZVFWFLSA-N	437.460	1.370	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)CCc1ccccc1NC(=O)OC(C)(C)C	790641675	HRAIENCVPHMBBY-LBPRGKRZSA-N	428.511	1.051	50	20	IDGD	
O=C(NNC(=O)C(F)(F)Oc1ccccc1)C(=O)Nc1cccc(Br)n1	793026746	UNMOLWYFGXNHOC-UHFFFAOYSA-N	429.177	1.602	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)CCC(=O)N1CCC(c2ccccc2)=N1	795177297	LAOIGXOLMMWOSX-UHFFFAOYSA-N	443.529	1.797	50	20	IDGD	
CC[C@](NCC(=O)NNC(=O)Cc1nc(C)cs1)(C(=O)OC)c1ccc(Cl)cc1	796446733	BKICREGIJRFXOJ-LJQANCHMSA-N	438.937	1.863	50	20	IDGD	
COC(=O)c1cc(Cl)c(Cl)cc1NC(=O)C(=O)NNC(=O)c1ccccc1O	797536198	UNIIWFFWFPYBIL-UHFFFAOYSA-N	426.212	1.885	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)C2(c3cncc(Br)c3)CC2)C[C@@H](C)O1	799102300	XUUPPSKAXBRVCJ-BETUJISGSA-N	425.327	1.522	50	20	IDGD	
Cc1cc(O[C@H]2CCN(C)C2=O)ccc1NC(=O)NNC(=O)COc1ccc(C#N)cc1	799238698	FFVLXNQLWOLALN-IBGZPJMESA-N	437.456	1.708	50	20	IDGD	
NS(=O)(=O)c1ccc(C(=O)NNc2ccc3c(=O)[nH]ccc3c2)cc1Br	803428879	IDPVSMBPSOGDPX-UHFFFAOYSA-N	437.275	1.695	50	20	IDGD	
CCOC(=O)C1(S(C)(=O)=O)CCN(C(=O)/C(C#N)=C/c2ccc(OCC)cc2)CC1	804715303	DXKYJSQPVFRFCU-SAPNQHFASA-N	434.514	1.961	50	20	IDGD	
CON(C)S(=O)(=O)c1cc(C(=O)NNc2ccc(-n3ccnc3)nn2)ccc1Cl	804954148	HJKAIXYRZSNKCP-UHFFFAOYSA-N	437.869	1.255	50	20	IDGD	
CCc1nnc(NC(=O)[C@H](C)[C@@H](C)NC(=O)NNC(=O)c2ccc3c(c2)OCCO3)s1	805878757	SBLZAMKSABBTKP-GHMZBOCLSA-N	448.505	1.479	50	20	IDGD	
CNS(=O)(=O)c1cc(NC(=O)NNc2c(OC)cccc2S(C)(=O)=O)ccc1F	806546544	SPIHCSRNPCSYMU-UHFFFAOYSA-N	446.482	1.295	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1cc(F)c(N2CCOCC2)cc1F	806972404	VCOZZKRAXHPMKS-UHFFFAOYSA-N	449.370	1.109	50	20	IDGD	
Cc1cc(C)c(C)c(S(=O)(=O)NCC(=O)NNC(=O)COc2ccccc2O)c1C	810364726	GJEWECUFDVKRAT-UHFFFAOYSA-N	435.502	1.131	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)CN(CC(=O)NNc2nc(C)cc(C)n2)c2ccccc2)n1	812455476	HWVOACUVEXZQFR-UHFFFAOYSA-N	449.519	1.593	50	20	IDGD	
Cc1cccc2c1OC[C@H](NC(=O)NNC(=O)CCN1CCN(c3ccccc3)CC1)C2	812637420	ZSEKNQKUCLGPPW-HXUWFJFHSA-N	437.544	1.841	50	20	IDGD	
CC(=NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1cc(C(=O)O)cs1	814688721	JZONYGBYWWSNND-UHFFFAOYSA-N	437.499	1.621	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NN=CC1(C)COC1)N(S(C)(=O)=O)CC2	814758833	JFYKRYSMLVVEJE-HNNXBMFYSA-N	425.507	1.091	50	20	IDGD	
O=C(COC(=O)c1ccc(OC(F)F)c(F)c1)NNC(=O)c1cccc([N+](=O)[O-])c1	815485806	LZXZYGNNFDQUPU-UHFFFAOYSA-N	427.291	1.953	50	20	IDGD	
CCOC(=O)c1cc(COC)cc(NC(=O)C(=O)NNC(=O)c2ccccc2OC)c1	815568019	SNEGSQYYJXZHSQ-UHFFFAOYSA-N	429.429	1.418	50	20	IDGD	
CCOc1ccc(NNC(=O)C(=O)Nc2ccc(C(=O)N3CCN(CC)CC3)cc2)cc1	815814904	BGXNPCKQUYHQCZ-UHFFFAOYSA-N	439.516	1.945	50	20	IDGD	
Cn1nncc1NNC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(Br)s2)C1	816771691	WSGPASLMZWLENN-VIFPVBQESA-N	449.356	1.183	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@@H](C(=O)NNC(=O)CNc3ccccc3)C2)s1	849212024	OJFRYLNPSRHTRR-OAHLLOKOSA-N	436.559	1.717	50	20	IDGD	
C[C@H]1Cc2ccccc2N1S(=O)(=O)c1ccc(F)c(C(=O)N2CC[C@@H](B(O)O)C2)c1	864231251	LIZAEPOVCVTZGC-DZGCQCFKSA-N	432.282	1.655	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCC[C@H](c3nnc4n3CCCCC4)C2)n1	911584049	RTDJXIMKRBNFMF-HNNXBMFYSA-N	431.566	1.339	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)NCC(=O)NNC(=O)CNc2ccc(C)cc2C)cc1	913164910	ZMMQZJCZYUBETA-UHFFFAOYSA-N	432.502	1.044	50	20	IDGD	
CN(CCCNC(=O)NNC(=O)c1csc(N2CCOCC2)n1)Cc1ccccc1	913636203	SHTAQJFDDJWKLD-UHFFFAOYSA-N	432.550	1.446	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NN=Cc1cccc([N+](=O)[O-])c1	915913753	FQWPXJGIPFFBAM-UHFFFAOYSA-N	446.485	1.699	50	20	IDGD	
Cn1ccnc1[C@@H](NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)c1ccccc1	916220431	GUQRTTOYUBKDDZ-KRWDZBQOSA-N	431.456	1.401	50	20	IDGD	
CC(C)NS(=O)(=O)Cc1ccccc1CNC(=O)NNC(=O)c1cccc(N(C)C)c1	916228563	GLWCUYDKFICQMA-UHFFFAOYSA-N	447.561	1.725	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NCCCN1C(=O)NC2(CCCCC2)C1=O	916268748	MGYOKYFPAONYCJ-CQSZACIVSA-N	449.483	1.568	50	20	IDGD	
CC(=NNC(=O)COc1ccccc1C#N)c1ccc(OCC(=O)N2CCOCC2)cc1	916322163	OZKYTFOJPFSFGH-UHFFFAOYSA-N	436.468	1.715	50	20	IDGD	
CC(=NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1)c1cccc(OCC(=O)O)c1	916334613	NPFVXZLSCHZYOO-UHFFFAOYSA-N	425.850	1.605	50	20	IDGD	
CC(C)NS(=O)(=O)c1cccc(CNC(=O)NNc2ccc(-n3cccn3)nn2)c1	916486153	AAZZVFXGDXJGCL-UHFFFAOYSA-N	430.494	1.175	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)NCCCN(C)S(C)(=O)=O	916580441	ZLKXPZLWEFWOEE-UHFFFAOYSA-N	425.536	1.344	50	20	IDGD	
COc1cc(CNC(=O)NNC(=O)c2cccc(N(C)C)c2)ccc1OCC(=O)N(C)C	916641552	RLKVWCSGICVSSO-UHFFFAOYSA-N	443.504	1.372	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)Cc2ccc(F)c(Br)c2)c2ccccc2c1=O	917387732	JOJDKXRYLCXXKR-UHFFFAOYSA-N	433.237	1.839	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCC[C@H](C(=O)Nc3ccccn3)C2)cc1OC	917400621	XHXGIMGDTPCTSQ-INIZCTEOSA-N	441.488	1.211	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)[C@H]2CCCN(S(=O)(=O)c3ccccc3)C2)c1O	919756165	ZVQQBMNGZCYWPU-AWEZNQCLSA-N	433.486	1.263	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C2=NN(c3ccc(F)cc3)[C@H](C(N)=O)C2)cc1	919833861	HKVJTOBKMRBDKF-SFHVURJKSA-N	427.436	1.035	50	20	IDGD	
Cc1c(C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)cnn1-c1cccc(C(F)(F)F)c1	919889466	MQPZLTFGZWBANE-LBPRGKRZSA-N	445.423	1.331	50	20	IDGD	
CC(C)NC(=O)C(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cc(F)ccc1F	920431840	SAXDDUDCFRJSAX-UHFFFAOYSA-N	440.428	1.051	50	20	IDGD	
CCCNC(=O)NNC(=O)CCNS(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1	921091326	GRIFSYMGVXOLFW-UHFFFAOYSA-N	430.836	1.768	50	20	IDGD	
COC(=O)c1cccc(C=NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c1	1116268694	JPVKVAQSBGZGLZ-UHFFFAOYSA-N	431.470	1.258	50	20	IDGD	
O=C(NNC(=O)[C@H]1CC(=O)N(c2c(F)cccc2F)C1)c1cncn1-c1ccccc1	1116451101	ODUXRSOJHUHMQQ-ZDUSSCGKSA-N	425.395	1.965	50	20	IDGD	
COc1cccc2cc(CNC(=O)NNC(=O)c3csc(N4CCOCC4)n3)oc12	1318434192	LVRZTFBQUSIRJG-UHFFFAOYSA-N	431.474	1.879	50	20	IDGD	
COC(=O)COc1ccc(C(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1	1318558113	NFVKFKWAHVRNQJ-UHFFFAOYSA-N	435.477	1.647	50	20	IDGD	
COc1ncccc1CCC(=O)N1CCO[C@]2(CCN(C(=O)CO[Si](C)(C)C)C2)C1	1779294386	PUFQAAHLLMAVDT-NRFANRHFSA-N	435.597	1.704	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc(F)nc2C)C1	1779904166	IPPQOYTUHHJGJQ-JXXFODFXSA-N	427.904	1.910	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(=O)nc4sccn34)C2)C1	1779949376	WNIJYAFCVSGZEN-BFUOFWGJSA-N	438.937	1.607	50	20	IDGD	
Cc1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C3)c(C)n1C	1779972754	OBFDEDUUPYSZER-AUSIDOKSSA-N	447.580	1.142	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](F)Br)C2)cn1	1780770133	CWCOCQHGWSCWFC-DDUZABMNSA-N	444.301	1.908	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H]3CC[C@@H]4CCC(=O)N4C3)C2)C1	1781054832	XOWOXPSCYDTFQG-VWXURSGXSA-N	425.957	1.625	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)[C@@H]3[C@@H](O)CCN3Cc3ccccc3)CCO2)C1	1781219395	MSGBYKDULMMIHV-QTDGGUCWSA-N	449.979	1.469	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnn3c2CCC3)C1	1781283159	VWQVETSGUHHSBU-WIYYLYMNSA-N	434.613	1.808	50	20	IDGD	
COc1cc(C#N)cc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)c1	1781334432	NWKYDDQAWUXKDL-CRAIPNDOSA-N	440.269	1.701	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc4ncnn4c3)CCO2)C1	1783349059	GURABKQLZOIDQO-KDOFPFPSSA-N	436.310	1.346	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cccc3ccoc13)CCO2	1783937895	YIRJKANNHDGEIZ-JOCHJYFZSA-N	428.489	1.249	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)C(Cl)Cl)C3)C2)cc1NC(C)=O	1783948143	CMWWDDBTTHMTOD-IBGZPJMESA-N	444.315	1.901	50	20	IDGD	
CCCC(=O)N[C@@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]2C1	1783966961	NBCUOANYQOWGEJ-QXKUPLGCSA-N	446.386	1.302	50	20	IDGD	
Cc1nccn1[C@H](C)C(=O)N1CC[C@@]2(CN(C(=O)[C@@H](C)CBr)CCO2)C1	1784628626	LHTLKPXXYWEWDF-IYOUNJFTSA-N	427.343	1.613	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cncc(S(C)(=O)=O)c3)[C@H]2C1	1785587906	WEHJQHBCKCLKST-SJWGOKEGSA-N	443.953	1.096	50	20	IDGD	
CC[C@@H](C)[C@@H](O)C(=O)Nc1ccc(C2(NC(=O)c3cnccc3C(=O)NN)CCC2)cc1	1786401904	ZWJVADLMMUAFRA-AUUYWEPGSA-N	439.516	1.840	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCSC(=N)N)[C@H]2C1	1786847411	AXTKCVJSBHRHTN-VOAKCMCISA-N	435.388	1.014	50	20	IDGD	
C[C@@H](Cn1cccn1)C(=O)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1	1786968404	QOJAEZMTMMDVDN-KRWDZBQOSA-N	446.316	1.647	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3[nH]nc4ncccc34)[C@H]2C1	1787344742	PUQHLWMFKNLPFO-LDBIXWDDSA-N	440.331	1.788	50	20	IDGD	
COc1nc(C)ccc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)Br)C[C@@H]21	1789015636	BKGJITWFMGLHDY-VRKREXBASA-N	440.338	1.775	50	20	IDGD	
CCc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)CBr)C[C@@H]32)nn1C	1789065004	JQBWWUIAJPGXJA-HPZZRFSDSA-N	441.370	1.607	50	20	IDGD	
CCOC(=O)N[C@H](O)C(=O)Nc1ccc(C2(NC(=O)[C@H](Cl)COC)CCC2)cc1	1789408501	HYEXHLINERQWFC-RHSMWYFYSA-N	427.885	1.439	50	20	IDGD	
CC[C@@H](C)[C@@H](O)C(=O)NC1(c2ccc(NC(=O)c3cnccc3C(=O)NN)cc2)CCC1	1789519924	RIQIQJZLOJJMEL-AUUYWEPGSA-N	439.516	1.840	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc4nccn34)C[C@@H]21)[C@@H](F)Br	1789924819	DVOSDIFKMGPUSQ-LMRQPLJMSA-N	439.285	1.618	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccnc3OC)C[C@@H]21	1790960732	CIUOKRAKNYQJLW-HNKHHVNMSA-N	440.338	1.857	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc(OC)c(C)c3)C[C@@H]21	1791251230	ASKGICSVUBPHDL-HJWJTTGWSA-N	425.913	1.246	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(C)cnc3Cl)C[C@@H]21	1791251568	NGPQOHOKAJYEPY-TUUVXOQKSA-N	430.332	1.891	50	20	IDGD	
Cc1ccc(C(=O)NCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)C(Cl)Cl)C[C@@H]32)cc1	1792253327	OHZVQGYJEBFWKR-JYJNAYRXSA-N	442.343	1.508	50	20	IDGD	
CC(C)(C)OC(=O)NC1(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Cl)C[C@@H]32)CC1	1792336992	ADIOUZMEDIRKNY-XUXIUFHCSA-N	433.908	1.558	50	20	IDGD	
CC#C[C@H](CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](O)CCl)c1ccc(O)cc1	1792982650	LIZXPDUBLPCZPG-GOBLKYCHSA-N	434.920	1.079	50	20	IDGD	
CCS(=O)(=O)c1ccc(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](O)CCl)cc1	1793113006	YJTMMNFBOKVUOF-KYHPRHEASA-N	442.965	1.261	50	20	IDGD	
Cc1nc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CO[Si](C)(C)C)C3)c(C)s1	1794180403	VDWKJSJTGJCXRR-CCWDJLKJSA-N	425.627	1.744	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nnc(-c3ccccc3)o1)C2	1795115852	OGJPCFCKBQTXQQ-MIFYACCESA-N	449.305	1.725	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cncnc1	1795192861	GPKGZQMMHNXNOM-FZKCQIBNSA-N	437.928	1.861	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1sc(N)nc1C	1795670214	ZOXSNNOYZLJNIP-WRWGMCAJSA-N	431.356	1.410	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1n[nH]c2c1CS(=O)(=O)C2	1796386142	YYGBMSRSSXLEGD-OPDFLTKYSA-N	428.942	1.497	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1c(Br)cnn1C	1796748859	OWUIBSSHCBBNJZ-LFSVMHDDSA-N	433.734	1.403	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1csc(C)n1)C2	1796890086	YZLARGSVFHDMIV-LSOZKBPJSA-N	428.518	1.837	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1nn(C)c2c1CCC2	1797044122	LZZKGBBQAGKZCM-JFILPPLUSA-N	439.354	1.143	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2cncn2c1	1797526068	KPECPQVLUDJLIZ-FAYQHZLMSA-N	435.322	1.569	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](OC(C)=O)C(C)C	1797596965	WGMUPKMTVMDINE-YIDVYQOGSA-N	433.343	1.337	50	20	IDGD	
COc1ccc(OCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CO[Si](C)(C)C)cc1	1797953798	IDQSVAASQXZRBY-VPTLXERWSA-N	436.581	1.515	50	20	IDGD	
COCCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](Br)Cc1ccccc1	1800437095	WBUAZTPBAKTXFK-ZMMAXQRCSA-N	439.350	1.619	50	20	IDGD	
Cc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)Br)nc2nccn12	1800761975	LELAVGYGNASLHN-GUIRCDHDSA-N	436.310	1.024	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)Oc1ccccc1)C2	1800762119	OHSONAPGPNFUBY-JGFGOLAASA-N	425.323	1.827	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc2ccncc12)c1ccc(B(O)O)cc1	1800909886	ISYNVFULUWLOCF-ACDBMABISA-N	429.285	1.480	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1C[C@H]1c1ccc(OC)cc1)C2	1800971303	VERGOGCAKNLSJK-BVTPCJTOSA-N	436.936	1.642	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccnc1OCC1CC1)C2)C(Cl)Cl	1801015867	NVQSXGXIRXLYLI-AGGWBTHJSA-N	428.316	1.877	50	20	IDGD	
CC[C@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](O)NC(=O)OC(C)(C)C)C2	1801803811	NULOMFOGYGSKRV-WHRXGGIHSA-N	448.358	1.641	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)[C@@H]2C[C@H]2C2CC2)[C@@H]1c1cccnc1	1802989162	OGGHDAJSBYMRQL-LYSIVYOWSA-N	448.527	1.446	50	20	IDGD	
Cc1noc(C)c1CCC(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]1c1cccnc1	1803141334	MUDAZWFEEQNPBI-POAQFYNOSA-N	434.924	1.925	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)Cc2ccccc2)[C@H]1c1cccnc1)[C@@H](O)CCl	1803146508	BHVLIHFTDNEWJB-YRPNKDGESA-N	431.920	1.291	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)CN2C(=O)C=CC2=O)[C@H]1c1cccnc1	1803694722	LVFGZBNPBZAQGM-FTRWYGJKSA-N	432.908	1.420	50	20	IDGD	
NC(=O)NCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](Br)Cc1ccccc1)C2	1804479850	PDKSMGWNFQSHKE-FZKCQIBNSA-N	437.338	1.299	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1ccsc1	1805419006	BDPDBYITYPTUPJ-PXNSSMCTSA-N	435.314	1.456	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)c2cccs2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807364966	VJSMKQGXXSACHU-XLIONFOSSA-N	435.314	1.456	50	20	IDGD	
Cc1noc(CC(=O)NC[C@@H]2CCN(C(=O)CCBr)[C@@H]2c2cccnc2)n1	1807523138	VNUJPWXYMYQJAA-KBXCAEBGSA-N	436.310	1.807	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)c3cccc4c3OCC4)CC2)C1	1809972002	GWLXTMZPMKQADW-UHFFFAOYSA-N	448.328	1.460	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2ccccc2C(N)=O)[C@@H]1c1cccnc1	1811289062	FRMKQTANOLQCCB-SNRMKQJTSA-N	444.919	1.754	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)c2c[nH]c(=O)cn2)[C@H]1c1cccnc1	1811458210	LQICQWTXFCKOCW-NORZTCDRSA-N	434.294	1.268	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)[C@H](C)N2C[C@H]3C[C@H]3C2)[C@H]1c1cccnc1	1813030983	IITYWEZOYIGCNG-CYQMMEFHSA-N	434.968	1.681	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)CCS(C)(=O)=O)[C@H]1c1cccnc1	1813573195	DHTZYWCMELAOGG-XYJFISCASA-N	429.970	1.930	50	20	IDGD	
O=C(Cc1ccc2c(c1)OCO2)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](O)CCl)CC2	1814133472	QAGOOXNFTOYJOV-AAEUAGOBSA-N	437.905	1.626	50	20	IDGD	
O=C(Cc1cnc2ccccn12)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1	1814833776	LLAGEFQFJSYCFG-HOTGVXAUSA-N	430.896	1.892	50	20	IDGD	
C=C(C(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1)C(F)(F)F	1815348029	BOSNJPKNMSHNGG-LBPRGKRZSA-N	439.224	1.167	50	20	IDGD	
Cc1nc2sccn2c1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](O)CCl)CC2	1819352172	XBLUYBJCOWEROZ-GXSJLCMTSA-N	439.950	1.986	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)COc2cccnc2)[nH]n1	1822410941	SUOGKEWUDBVINA-KRWDZBQOSA-N	443.508	1.249	50	20	IDGD	
COc1ccc(CC(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@@H](O)CCl)CC3)c(C#N)c1	1822805572	YXJCQWUUAQNVLU-BBRMVZONSA-N	448.932	1.778	50	20	IDGD	
Cc1ccc(CC(=O)Nc2cc([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)o1	1822903515	IYUGZOVOAHZJON-LJQANCHMSA-N	436.277	1.540	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC([C@H]2CCCCN2C(=O)CN2CCNC2=N)CC1	1826868938	ATQMHRRFMCGDIP-GDBMZVCRSA-N	442.402	1.477	50	20	IDGD	
O=C([C@H](F)Cl)N1CCC([C@@H]2CCCCN2C(=O)c2n[nH]c3c2CS(=O)(=O)C3)CC1	1827270648	UITYZNOJWPWRHY-HOCLYGCPSA-N	446.932	1.606	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)[C@H]3CCCS3)sc2C1	1827297827	NCTQFYFYCXEXIL-DGCLKSJQSA-N	425.580	1.324	50	20	IDGD	
O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)CCc1ccccn1)CCO2	1833185220	VHCYOGDJNGGDRP-LJQANCHMSA-N	440.338	1.256	50	20	IDGD	
CC(C)(CCl)C(=O)NC1CCN(C2CCN(C(=O)c3cccc(=O)n3O)CC2)CC1	1833212293	WSYKCAQOADHUMB-UHFFFAOYSA-N	438.956	1.536	50	20	IDGD	
CNCCCC(=O)N1CCC(N2CCC(NC(=O)[C@H](C)CBr)CC2)CC1	1833263791	SLTZDIRXMUDEMI-OAHLLOKOSA-N	431.419	1.589	50	20	IDGD	
CSc1ncccc1C(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)CCl)CC2)CC1	1833312348	MDZLAVHGUYVGPZ-KRWDZBQOSA-N	440.997	1.588	50	20	IDGD	
O=C(c1ccccc1O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1833758436	SJQWDBTXLFPQPU-PBHICJAKSA-N	431.258	1.153	50	20	IDGD	
Cc1ncsc1C(=O)N1CCO[C@@]2(COCCN(C(=O)CCBr)C2)C1	1834265393	UWSWFGHQCKTSLO-MRXNPFEDSA-N	432.340	1.307	50	20	IDGD	
C[C@H]1CCc2c(C(=O)NC3CCN(C4CCN(C(=O)[C@H](O)CCl)CC4)CC3)n[nH]c21	1835358965	FRPKEFGMCAOUOW-SUMWQHHRSA-N	437.972	1.244	50	20	IDGD	
Cc1nnc(CC(=O)N2CCO[C@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)s1	1836075502	RQKJXLLCANZFJL-GOSISDBHSA-N	430.958	1.110	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3cc(F)cc(F)c3)CCO2)C1	1836121650	HDVLGUPPBGGCNY-XLIONFOSSA-N	430.879	1.981	50	20	IDGD	
O=C(c1csc2c1CCCO2)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1836391089	PREVIFCFWJPIBS-GOSISDBHSA-N	449.356	1.947	50	20	IDGD	
O=C(c1ccc2nccn2c1)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836717324	TYDTWCFJGKRLCE-SFHVURJKSA-N	434.924	1.546	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc4n(n3)CCCO4)CCO2)C1	1836966825	KXBHDWPPZIZBPO-FQEVSTJZSA-N	440.928	1.001	50	20	IDGD	
CCCC(=O)N[C@@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1837668933	BPOHLMJVBQNQPX-YWZLYKJASA-N	431.961	1.013	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3noc(C(C)C)n3)C2)C1	1839142676	VRWSQRBSHDLRFN-KUHUBIRLSA-N	428.917	1.209	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1	1839147570	VWYRDEPOEUOUPA-BFUOFWGJSA-N	447.315	1.839	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(F)(F)C(F)F)C2)C1	1839150101	BTDRZESTXXCTNJ-KGLIPLIRSA-N	439.233	1.580	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3C[C@H]4CC[C@@H]3O4)C2)C1	1839155160	LSNXOBAWPJKKIZ-YXBKOPBNSA-N	435.348	1.247	50	20	IDGD	
COc1cccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)c1	1840034516	OBBJJNWTWJVFIS-IFXJQAMLSA-N	441.322	1.549	50	20	IDGD	
O=C([C@H](O)CCl)N1CCOC[C@]2(C1)CN(C(=O)C1(c3ccccc3)CCC1)CCO2	1840113029	BSDGFMGKDWXSCO-NQIIRXRSSA-N	436.936	1.164	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CCc4ccccc43)C2)C1	1840155597	FMFCVWKTRLINJE-DXIQSLLYSA-N	436.936	1.427	50	20	IDGD	
Nc1ccccc1/C=C/C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840187997	JKILADNHKFGHRV-UEKDZROGSA-N	428.316	1.542	50	20	IDGD	
Cc1ccc(CCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)c(C)n1	1840190559	ALGDZDTWBHMKLU-HXUWFJFHSA-N	444.359	1.891	50	20	IDGD	
Cc1nccn1[C@@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1840489106	JXHVGRHFRRGSJF-MGPUTAFESA-N	426.945	1.474	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(OC)ccc3F)CCO2)C1	1840687090	VWQZEYODORXZCE-UZLBHIALSA-N	444.887	1.158	50	20	IDGD	
COc1cccc(C(=O)N2CC3(CCCN3C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)c1C	1843417255	NZFJITDJIRRKCG-PCLIKHOPSA-N	437.500	1.955	50	20	IDGD	
Cc1cc(C(=O)N2CCCC23CN(C(=O)CN(C)NC(=O)NCc2ccccc2)C3)c[nH]1	1843553624	OAENUTSGCHEMKV-UHFFFAOYSA-N	438.532	1.486	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2cc(C(C)C)no2)C1	1844812297	KCKAOCYRCHPBGD-OEAKJJBVSA-N	426.477	1.749	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2cc(F)cc(F)c2)C1	1844967632	UCVQYKCCNCIXSB-DHRITJCHSA-N	429.427	1.916	50	20	IDGD	
C[C@H](NC(=O)c1ccccn1)C(=O)N1CCCC12CN(C(=O)[C@@](C)(Cl)CCl)C2	1845770439	WKTOHNVEWOHCLB-UGSOOPFHSA-N	427.332	1.640	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@H](O)C[C@H]1C(=O)N1CC2(CCCN2C(=O)C(Cl)Cl)C1	1846387430	WGRBVFIAOHQPMZ-RYUDHWBXSA-N	436.336	1.364	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)[C@H]2CC[C@H](C(F)(F)F)CC2)C1	1846982835	NORDBUFOLCOSMH-SHTZXODSSA-N	432.487	1.932	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@H]2C[C@H](F)CN2C(=O)OC(C)(C)C)C1	1847136614	MELLLJVYTIRBMX-KKUMJFAQSA-N	447.935	1.791	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](CCO)NC(=O)OC(C)(C)C	1847639139	NQQHTDMVJOPNRV-UGUYLWEFSA-N	431.961	1.871	50	20	IDGD	
Cc1cccc(NC(=S)NNC(=O)CCc2c(C)nc(N3CCOCC3)[nH]c2=O)c1C	14308330	KFHRUVYDPTXXLD-UHFFFAOYSA-N	444.561	1.482	50	20	IDGD	
O=C(Cn1c(=O)ccn(Cc2ccccc2)c1=O)NNC(=S)Nc1cccc(Cl)c1	14893073	JXMSFESXWGQGNM-UHFFFAOYSA-N	443.916	1.730	50	20	IDGD	
O=C(CSc1n[nH]c(=O)n1CCc1ccccc1)NNC(=O)c1cccc([N+](=O)[O-])c1	22615748	FPDKWUOIGZZQKX-UHFFFAOYSA-N	442.457	1.276	50	20	IDGD	
Cc1ccc(C)c(S(=O)(=O)NCCC(=O)NNC(=O)COc2ccc(C#N)cc2)c1	25259881	YHZYLWWYQOAFLE-UHFFFAOYSA-N	430.486	1.070	50	20	IDGD	
Cc1ccc(S(=O)(=O)NC2CC2)cc1C(=O)NNC(=O)COc1ccc(C#N)cc1	26694943	KRUIAHLYCRVEII-UHFFFAOYSA-N	428.470	1.147	50	20	IDGD	
O=C(Cc1ccc2c(c1)OCCO2)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	27229562	AQVXZOHCSOUWEZ-UHFFFAOYSA-N	445.497	1.246	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)CCNS(=O)(=O)c2ccc(F)c(F)c2)c1	28637126	KMNOSLIZBOJUBQ-UHFFFAOYSA-N	441.456	1.476	50	20	IDGD	
CCCn1c(CCC(=O)NNC(=O)c2ccccc2C)nc2cc(S(N)(=O)=O)ccc21	115306720	HJNJTBYSYQFVEI-UHFFFAOYSA-N	443.529	1.796	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccc(Br)cc2)CC1)NNC(=O)c1ccccc1	725813703	VCGMRWGJEKYHKM-UHFFFAOYSA-N	445.317	1.668	50	20	IDGD	
Cc1c(Cl)cccc1NC(=O)CCNC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	725860899	ZYOHVQZIVGUJMH-UHFFFAOYSA-N	442.867	1.597	50	20	IDGD	
COc1ccc([C@@H](C)NC(=O)NNC(=O)CNC(=O)c2ccco2)cc1Br	725871081	FZMHYPAZRACGBJ-SNVBAGLBSA-N	439.266	1.872	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)NCCc1ccc(F)c(Br)c1	725872555	OWTALILZTKKCCY-UHFFFAOYSA-N	427.230	1.484	50	20	IDGD	
Cc1nnc(NNC(=O)c2sccc2S(=O)(=O)NC2CCCCCC2)nc1O	725881502	XFNTZPZIWANKOX-UHFFFAOYSA-N	426.524	1.705	50	20	IDGD	
Cc1cccc(CC(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1	726752453	MYEGTDNACWBVIN-UHFFFAOYSA-N	445.541	1.339	50	20	IDGD	
CCOC(=O)C1CCN(C(=O)CN(C)C(=O)NNC(=O)CCCc2ccccc2)CC1	728954401	POLQMSHQGALCRB-UHFFFAOYSA-N	432.521	1.484	50	20	IDGD	
CCNC(=O)CCCC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	729284541	ZDVWRYZFRGDOED-UHFFFAOYSA-N	446.529	1.233	50	20	IDGD	
C[C@@H]1CCC[C@H]1NC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	729624722	XWSXNMGHAXOKFS-CRAIPNDOSA-N	438.550	1.159	50	20	IDGD	
COC(=O)c1c(CC(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)[nH]c(C(C)=O)c1C	730035976	RNMNRKUOCUDZDS-UHFFFAOYSA-N	449.847	1.513	50	20	IDGD	
Cn1ccnc1[C@](O)(CCNC(=O)NNC(=O)c1cccc2ncccc12)C(F)(F)F	730114220	FBAFARYOJRLMTD-GOSISDBHSA-N	436.394	1.753	50	20	IDGD	
CCC(=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O)c1ccc(Cl)c(Cl)c1	730568974	IDBZJSITMDCBHC-UHFFFAOYSA-N	430.317	1.808	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@H]2CC(=O)N(C3CCC(C)CC3)C2)c2ccccc2c1=O	731341673	OLTFCWOIDPTNKA-PCKAHOCUSA-N	439.516	1.605	50	20	IDGD	
COC(=O)Cc1cc(=O)n(-c2ccc(C(=O)NNC(=O)Cc3ccccc3F)cc2)[nH]1	731344272	DMBDIZUPQMTPBB-UHFFFAOYSA-N	426.404	1.024	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)N2CCN(CC(=O)N3CCCc4ccccc43)CC2)c1	731363455	YVCVNMOSCKHZRL-UHFFFAOYSA-N	446.511	1.510	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)[C@H]2CCCN2c2ncnc3sccc23)C[C@@H](C)O1	732261539	DGNRVNFJLOUTCC-IJEWVQPXSA-N	432.550	1.307	50	20	IDGD	
Cc1cc(C)nc(-n2nc(C)c(CC(=O)NNc3ccccc3S(C)(=O)=O)c2C)n1	732301593	FCAVBBDFADDIRW-UHFFFAOYSA-N	428.518	1.985	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)[C@@H]1CCCN(C(=O)c2cccc3ccccc23)C1	732644992	CIEJRELYJFTITF-SJORKVTESA-N	443.525	1.274	50	20	IDGD	
O=C(NCc1ccnc(OC2CCOCC2)c1)NNC(=O)c1ccc2c(c1)OCCO2	733352795	GZIZDADFLVMGIR-UHFFFAOYSA-N	428.445	1.555	50	20	IDGD	
CN(C)C(=O)[C@H]1CCC[C@H](NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)C1	734220752	JKTGDJHZRMCNSG-OALUTQOASA-N	444.580	1.176	50	20	IDGD	
COc1ccc(S(=O)(=O)C[C@@H](C)C(=O)NNC(=S)Nc2ccc(OC)nc2)cc1	735122868	FFHIXEYLBXEUFK-GFCCVEGCSA-N	438.531	1.526	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)Cn2c(=O)n(C)c3ccccc32)cc1C	736753027	IPCHGTIZQQFTQQ-UHFFFAOYSA-N	430.486	1.277	50	20	IDGD	
CCCCN(C)S(=O)(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	739666933	GNYXFIBTWLGPPT-UHFFFAOYSA-N	432.568	1.072	50	20	IDGD	
COc1cc(N2C[C@@H](C(=O)NNc3ccnc(N(C)C)n3)CC2=O)cc(OC)c1OC	740102996	SYUZBDPSQQKUEQ-LBPRGKRZSA-N	430.465	1.065	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)c1ccc(C)cc1)C(=O)NNc1ccnc(N(C)C)n1	740107725	MCVSNQJTLQYLKH-OAHLLOKOSA-N	438.579	1.394	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)COc2ccccc2O)cc1N1CCCS1(=O)=O	741075289	UHSACAMBDVIELK-UHFFFAOYSA-N	434.474	1.472	50	20	IDGD	
CCC(=NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)c1cnn(C)c1	741804568	CMEGGUQNLHIJGF-UHFFFAOYSA-N	433.534	1.304	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1cnc(O)c(Br)c1	742037055	STTFSUHPUWXNRN-UHFFFAOYSA-N	442.295	1.226	50	20	IDGD	
COc1ccc(-c2nnc(SCC(=O)NNC(=O)c3cccc(C)c3)n2N)cc1OC	742449724	WOHZIUHIJYFLLY-UHFFFAOYSA-N	442.501	1.538	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNS(=O)(=O)c1c(Cl)cc(Cl)cc1[N+](=O)[O-]	743255648	MBOITFOQXAYSRA-UHFFFAOYSA-N	437.217	1.234	50	20	IDGD	
Cc1ccccc1[C@H]1CN(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)CCO1	743510412	WGCQBJVPKAFCNE-QGZVFWFLSA-N	431.518	1.716	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)ccc1O)C(=O)c1cnn(-c2ccccc2)c1	743730116	NJMDYARBUXTVSE-UHFFFAOYSA-N	429.230	1.984	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)CN(C)c2ccccc2[N+](=O)[O-])cc1C	745614274	HJZVGBWBEGNAOL-UHFFFAOYSA-N	434.474	1.968	50	20	IDGD	
O=C(NCC(C1CC1)C1CC1)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	745908045	VMAKRRLEHSHMJH-UHFFFAOYSA-N	436.534	1.088	50	20	IDGD	
C[C@@H]1C[C@@H](NC(=O)NNC(=O)c2cc3c(s2)CCCCC3)C(=O)N1c1cnn(C)c1	745916840	GJIOLGXJVRYMOE-IUODEOHRSA-N	430.534	1.889	50	20	IDGD	
C[C@H]1CC[C@@H](C)N1CC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	746093060	JLZGBMQPPLUPAA-CALCHBBNSA-N	444.557	1.799	50	20	IDGD	
NC(=O)CC[C@@H](C(=O)NNC(=O)c1ccc2ccccc2c1)N1C(=O)c2ccccc2C1=O	746132006	IBTRCOIJRJDWSS-IBGZPJMESA-N	444.447	1.531	50	20	IDGD	
COC[C@@H](NC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)c1ccco1	746770332	MGUKPMJKPYKTGC-MRXNPFEDSA-N	436.490	1.396	50	20	IDGD	
CSCC[C@H](C(=O)NNC(=O)CCOc1ccccc1)N1C(=O)[C@H]2CCCC[C@H]2C1=O	747179398	SBIWTONOHQJMHU-FGTMMUONSA-N	447.557	1.900	50	20	IDGD	
O=C(CN1C(=O)[C@H]2CCCC[C@@H]2C1=O)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1	748521615	WWPWHSMGZQDXCP-STQMWFEESA-N	433.408	1.598	50	20	IDGD	
CCC[C@@H](NC(=O)NNC(=O)[C@@H](C)OCCOC)C(=O)N1CCc2sccc2C1	748633477	ZBGNLLOLCFNCRY-UKRRQHHQSA-N	426.539	1.183	50	20	IDGD	
COc1ccc(C(C)=NNC(=O)CSc2nnc(O)nc2O)cc1Cn1cccn1	749858846	KUHGOJYSYLIGRU-UHFFFAOYSA-N	429.462	1.169	50	20	IDGD	
COc1ccccc1NC(=O)CN1CCN(CC(=O)NNC(=O)c2cccc(C)c2)CC1	750227511	BUQGBVDYCZCIPF-UHFFFAOYSA-N	439.516	1.021	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)c1cc2occc2[nH]1	750828024	JKAFYZXMBVSCEI-UHFFFAOYSA-N	446.485	1.176	50	20	IDGD	
Cc1nc(N)sc1C(=O)NN=C1C(=O)Nc2c(I)cccc21	750938086	XHXUMPYZXQBHSN-UHFFFAOYSA-N	427.227	1.725	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)NCCc2nc(C)no2)cc1	751387551	BJZOMKFSTBWLTL-WJDWOHSUSA-N	449.471	1.391	50	20	IDGD	
O=C(NCc1nccn1CCc1ccccc1)NNC(=O)c1nnc(O)c2ccccc12	751810228	OUQCFLBRTARPTP-UHFFFAOYSA-N	431.456	1.919	50	20	IDGD	
CNC(=O)[C@@H](C)NC(=O)/C(C#N)=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	752748416	YZLMRXNQJYUFGQ-OJLMPMFISA-N	428.880	1.237	50	20	IDGD	
CCCCOc1ccc(C(=O)NNS(=O)(=O)c2cc(C(=O)OC)co2)cc1OC	753949873	RTPZWGAWCFIJLW-UHFFFAOYSA-N	426.447	1.877	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)C2CCCC2)cc1S(=O)(=O)N1CCOCC1	755412651	FOTVZDVBEZRPAB-UHFFFAOYSA-N	426.495	1.059	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)Nc2ccccc2C(=O)N2CCOCC2)c1	755624533	VHNQVOFGJJXYEL-UHFFFAOYSA-N	428.445	1.643	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2cc(F)cc(N3CCOCC3)c2)c1	756279496	GIEYLPRCDCYRAI-UHFFFAOYSA-N	436.465	1.532	50	20	IDGD	
CN(C1CC1)S(=O)(=O)c1ccc(NC(=O)NNC(=O)COc2ccc(F)cc2)cc1	756404277	UCXJCYLEKKRRJP-UHFFFAOYSA-N	436.465	1.840	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)c2nnc(O)c3ccccc23)cc1NS(C)(=O)=O	756517797	VCIUXOQWISQFDN-UHFFFAOYSA-N	430.446	1.482	50	20	IDGD	
COCC[S@@](=O)Cc1cccc(NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c1	756613774	QUOOSOOKFSMFHF-WJOKGBTCSA-N	443.489	1.024	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)[C@H]1CCc2n[nH]cc2C1	757095615	IBNXZSOJJYUBDL-INIZCTEOSA-N	430.940	1.133	50	20	IDGD	
CCOC(=O)c1sc([C@@H](C)NC(=O)NNC(=O)c2nnc(O)c3ccccc23)nc1C	757269664	AQIXCTVMZAXTMQ-SNVBAGLBSA-N	444.473	1.982	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)c2ccc(O)c(Cl)c2)ccc1S(=O)(=O)N(C)C	757775161	FIZJXYKTZUTVKZ-UHFFFAOYSA-N	442.881	1.771	50	20	IDGD	
Cc1nn(-c2ccccc2)c2sc(C(=O)NNC(=O)NC[C@@H]3CC[C@H](C(N)=O)O3)cc12	760204309	QHZSJVASYFQLDM-DZGCQCFKSA-N	442.501	1.372	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)C(C)(C)NC(=O)C(F)(F)F)CC1	760343007	ARDVMLLAHGWDFG-UHFFFAOYSA-N	439.435	1.173	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)Cn1cnc(-c2ccccc2)n1	761206781	SDMAKZLLUORCDY-UHFFFAOYSA-N	427.490	1.008	50	20	IDGD	
CNC(=O)COc1cccc(CNC(=O)NNC(=O)CSc2ccccc2OC)c1	761669678	NDGWHVKPYZRGEY-UHFFFAOYSA-N	432.502	1.443	50	20	IDGD	
C[C@@H]1CCCN(S(=O)(=O)c2ccc(NC(=O)C(=O)NNC(=O)c3ccccc3)cc2)C1	763431802	RBRVRUXNDWBJMB-OAHLLOKOSA-N	444.513	1.507	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(OCC2CCOCC2)cc1	763446923	YJOYTGQWYXOZLW-UHFFFAOYSA-N	442.428	1.800	50	20	IDGD	
Cc1cc(Cl)ccc1NC(=O)C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	763528774	AFYRJJJEIDGIHW-UHFFFAOYSA-N	443.935	1.947	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2ccccc2-n2nc(C)nc2C)c1	763665821	OXXVZRARHBTGLB-UHFFFAOYSA-N	436.472	1.666	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(OC(C)C)c(C#N)c1	763681592	LYEXCFYGOLSHMD-UHFFFAOYSA-N	440.456	1.909	50	20	IDGD	
CN(C)C(=O)c1cc(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)ccc1F	763727389	DPCLAPDNPDSKDS-UHFFFAOYSA-N	441.463	1.066	50	20	IDGD	
CC1CCN(c2ccc(NC(=O)C(=O)NNC(=O)COc3ccccc3C#N)cc2)CC1	763807619	OYOJUMMCMBNUNQ-UHFFFAOYSA-N	435.484	1.959	50	20	IDGD	
COC(=O)c1cc(C(C)C)ccc1NC(=O)C(=O)NNC(=O)COc1ccccc1C#N	763808135	VMANSVOEVVMATC-UHFFFAOYSA-N	438.440	1.633	50	20	IDGD	
CCCCNS(=O)(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2ccc(CC)cc2)c1	763831699	RJIFYXWSCHYVOM-UHFFFAOYSA-N	446.529	1.727	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)C(=O)Nc1cccc(OC[C@H]2CCCO2)c1	763840677	WIMRSMLNFNBZKY-GOSISDBHSA-N	431.420	1.548	50	20	IDGD	
Cc1ccc(S(C)(=O)=O)cc1NC(=O)C(=O)NNC(=O)c1cc(Cl)ccc1O	763974186	NAJVEPKWWBEWRK-UHFFFAOYSA-N	425.850	1.157	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)S(=O)(=O)CC2	764020151	VPTRATZVCNEBOW-UHFFFAOYSA-N	437.861	1.078	50	20	IDGD	
O=C(NNC(=O)c1cccc2ccccc12)C(=O)Nc1ccc(C(=O)N2CCOCC2)cc1	764050258	DXIQHPUUMXYOER-UHFFFAOYSA-N	446.463	1.712	50	20	IDGD	
CCc1cc(NC(=O)C(=O)NNC(=O)c2ccc(Br)cc2Cl)n(C)n1	764057690	HJQZKVNVIUHKIB-UHFFFAOYSA-N	428.674	1.798	50	20	IDGD	
Cc1cc(C(=O)N2CCC(C)CC2)ccc1NC(=O)C(=O)NNC(=O)CC(F)(F)F	764114635	DZPMNFXAFHDVQG-UHFFFAOYSA-N	428.411	1.905	50	20	IDGD	
Cc1nc2ccc(NC(=O)C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)cc2s1	764204702	ZVHMIDNDPZQDJB-UHFFFAOYSA-N	435.506	1.996	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1ccccc1OCC(F)(F)F	764277631	LJQCKDNLKMUMQW-UHFFFAOYSA-N	427.335	1.498	50	20	IDGD	
CC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)cc1C	764382344	HLTIZFBWXCCHPJ-UHFFFAOYSA-N	426.458	1.805	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COCCO1)C(=O)Nc1ccc(-c2nc3ccccc3s2)cc1	764427414	ZJRSPIYECBLUDJ-HNNXBMFYSA-N	426.454	1.465	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1F	764739084	GIMWFEZIRGEIOO-UHFFFAOYSA-N	448.476	1.643	50	20	IDGD	
NC(=O)COc1ccc(C=NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)cc1	764830709	KSBTUGVOHBVZIB-UHFFFAOYSA-N	443.935	1.472	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)CCN2C(=O)[C@H]3CCCC[C@@H]3C2=O)n[nH]1	765596204	SMFWDPXKZKKEGT-KBPBESRZSA-N	439.472	1.412	50	20	IDGD	
CC[C@@H]1CCCC[C@@H]1OCC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1	766339056	NADILMITTFPLBO-AEFFLSMTSA-N	425.551	1.748	50	20	IDGD	
CN(C)CCS(=O)(=O)c1ccccc1C(=O)NNC(=O)c1cnn(-c2ccccc2)c1	767473028	SFHOIQPPMBRERR-UHFFFAOYSA-N	441.513	1.282	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)[C@H]2CCCN(C(=O)N3CCCC3)C2)n[nH]1	768273948	LBMOQCVKAZXDGF-HNNXBMFYSA-N	440.504	1.774	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(O)c(C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)c1	768310337	ARTQLNZKRBYROK-UHFFFAOYSA-N	449.457	1.396	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)[C@H](C)N1C(=O)c2ccc(C)cc2C1=O	768641640	UNYNUBLFSMDOFG-LBPRGKRZSA-N	431.470	1.535	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc3nc(C(F)(F)F)cn3c2)c1	769852185	ZOLXIXMOGXGIPG-UHFFFAOYSA-N	426.376	1.831	50	20	IDGD	
COC[C@@H](C)NC(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccc(OC)cc2)c1	770326978	KRNCJDFRJZJAIP-CYBMUJFWSA-N	436.490	1.475	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)NC1CCN(S(=O)(=O)C2CC2)CC1	770649977	SFIXUWLAZOTZBH-GFCCVEGCSA-N	444.941	1.394	50	20	IDGD	
CCn1c(=O)c(=O)[nH]c2cc(C(=O)NNc3nc(O)c4cnn(C(C)(C)C)c4n3)ccc21	770956601	VJWKBBMQGSILGD-UHFFFAOYSA-N	438.448	1.067	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1cccc(C(F)(F)F)c1)C(=O)NNC(=O)c1cccc(C#N)c1	771010690	BOIJTECXXTZSNU-LLVKDONJSA-N	440.403	1.705	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)cn1	771432059	OVVYGRYOEOLIQW-UHFFFAOYSA-N	434.446	1.085	50	20	IDGD	
COCc1nc(OC)c2c(C)c(C(=O)O[C@@H](C)C(=O)NNC(=O)CC(C)C)sc2n1	771912169	COHPAHGVSKOFNI-NSHDSACASA-N	438.506	1.894	50	20	IDGD	
Cc1c(C(=O)O[C@H](C)C(=O)NNC(=O)CC(C)C)nnn1-c1ccc2c(c1)OCCO2	772106627	CLNUGTBCGGIKMP-CYBMUJFWSA-N	431.449	1.086	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccc(OCCC(N)=O)cc1	774008802	LXNRPESFBPUNGL-GFCCVEGCSA-N	448.863	1.148	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)c1ccc(N(C)C)cc1	776242666	ARZGSNHZRVLSIK-AWEZNQCLSA-N	433.534	1.708	50	20	IDGD	
CCOC(=O)N1CCC[C@H]([C@H](C)NC(=O)NNC(=O)c2nnc(O)c3ccccc23)C1	777266525	AABGBADUVGKJRA-STQMWFEESA-N	430.465	1.536	50	20	IDGD	
COC(=O)c1cc(Br)c(S(=O)(=O)NNC(=O)NCc2ccco2)s1	777617012	NGKCILFSAMBTII-UHFFFAOYSA-N	438.281	1.583	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)[C@@H](NC(=O)NCc2ccccc2)C(C)C)nc1C	778423745	GPEQXLGDDXUNEZ-KRWDZBQOSA-N	428.493	1.929	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cc3c(cc2F)NC(=O)CC3)o1	778712867	LICJCZKRUVZCSR-UHFFFAOYSA-N	445.451	1.545	50	20	IDGD	
NS(=O)(=O)c1ccc2c(c1)oc(=O)n2CC(=O)NNc1ccccc1OC(F)(F)F	779209338	KWPQWLFVIZUTRY-UHFFFAOYSA-N	446.363	1.284	50	20	IDGD	
COc1cccc(NNC(=O)C2CCN(S(=O)(=O)c3ccc4c(c3)OCCO4)CC2)n1	780772451	NTNLBSFJVLQJMB-UHFFFAOYSA-N	448.501	1.405	50	20	IDGD	
COC(=O)COc1ccc(C=NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1	782223870	ZUBONINCOSRBJL-UHFFFAOYSA-N	433.486	1.318	50	20	IDGD	
CCOC(=O)[C@@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNc2cccc(F)c2)cc1F	783043373	TVOLKSOPPNYFCK-LLVKDONJSA-N	434.399	1.728	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)cc1OC	784216779	PNHCMPLRJCEKLR-UHFFFAOYSA-N	448.501	1.616	50	20	IDGD	
Cn1cc(Br)cc(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2Cl)c1=O	784383008	XIAYFFNVEZBOQC-UHFFFAOYSA-N	444.629	1.791	50	20	IDGD	
NC(=O)C1CCN(c2ccc(NC(=O)C(=O)NNc3ccc(F)c(F)c3F)cc2)CC1	784806616	JWPZDAPTVFEEQP-UHFFFAOYSA-N	435.406	1.887	50	20	IDGD	
Cc1ccc(S(C)(=O)=O)cc1NC(=O)C(=O)NNc1ccc(Br)nc1	784809568	SJYXRIUZCIRNPJ-UHFFFAOYSA-N	427.280	1.638	50	20	IDGD	
CCN1CCN(c2ccc(NC(=O)C(=O)NNc3ccnc(N(C)C)n3)c(C)c2)CC1	784969771	PDFLAKVWSUZFCX-UHFFFAOYSA-N	426.525	1.075	50	20	IDGD	
CCN(CC)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)cc1	785068626	XYQRQJIOCBDNAG-UHFFFAOYSA-N	436.472	1.145	50	20	IDGD	
O=C1C[C@@H](Cc2ccc(NC(=O)C(=O)NNc3nc(C(F)(F)F)cs3)cc2)C(=O)N1	785145083	CTYTWTIAPWCQGT-SECBINFHSA-N	441.391	1.449	50	20	IDGD	
CNS(=O)(=O)c1ccc(C)c(NC(=O)C(=O)NNc2nc3ccccc3cc2C)c1	785157359	DCHYBVCIOWCPSA-UHFFFAOYSA-N	427.486	1.842	50	20	IDGD	
CCOC(=O)[C@@](C)(CNC(=O)NNC(=O)[C@@H]1COc2ccccc2O1)c1ccccc1	787311729	YSXDXQDXNPGWNA-AVRDEDQJSA-N	427.457	1.678	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccc(Cl)cc1-n1cccn1	788330764	LCJXEUMMYUURRH-UHFFFAOYSA-N	431.811	1.830	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)NOC[C@H]2CCOC2)cc1	788573686	HKDZKKOPCVKGAM-ADFUCPMPSA-N	439.472	1.425	50	20	IDGD	
Cn1nc([C@@H]2CCCO2)cc1NC(=O)C(=O)NNC(=O)c1cccc(Br)c1	789733548	NFMJHHHZRZXUSB-ZDUSSCGKSA-N	436.266	1.434	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N2CC(=O)N(C3CC3)C2)cc1	791184347	LCIWCGRGPZZIPX-MHWRWJLKSA-N	448.483	1.132	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)Cc2ccc(S(=O)(=O)N(C)C)cc2)cc1	792809741	OTBKKWMJRMHXCR-OAHLLOKOSA-N	449.529	1.493	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)NCCN2CC=CCC2)cc1	794116375	WCAABEVBYKLMMC-XDJHFCHBSA-N	448.527	1.719	50	20	IDGD	
CC(C)Oc1ccc(NC(=O)C(=O)NNc2ccc(Br)cn2)cc1C(N)=O	797068389	XMCIJHZTCVSOPP-UHFFFAOYSA-N	436.266	1.812	50	20	IDGD	
CC(=O)c1ccc(NC(=O)C(=O)NNC(=O)CNC(=O)OCc2ccccc2)cc1Cl	797369004	LOOVXIAJRHNABQ-UHFFFAOYSA-N	446.847	1.555	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CN2C(=O)Cn3c(cc4ccccc43)C2=O)cc1C	798307774	GMLXBFGLTOAWTQ-UHFFFAOYSA-N	447.451	1.027	50	20	IDGD	
CC(Cc1cccc(C(F)(F)F)c1)=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O	799106432	HDKXYVIUBNSUDE-UHFFFAOYSA-N	429.424	1.325	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Nc2ccc3c(c2)OCC(=O)N3C)cc(OC)c1OC	799246138	PIGFTSQDDBUQKB-UHFFFAOYSA-N	430.417	1.534	50	20	IDGD	
Cc1cc(O[C@@H]2CCN(C)C2=O)ccc1NC(=O)C(=O)NNc1ncnc2ccsc12	799260841	AVGHOKHXRPOFCC-OAHLLOKOSA-N	440.485	1.691	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N(C)[C@@H](C)c2cccc(S(N)(=O)=O)c2)c(OC)c1	799920108	BLXTWILVKIBAGK-LBPRGKRZSA-N	436.490	1.399	50	20	IDGD	
COc1ccc(S(=O)(=O)CCC(=O)NNC(=O)Nc2cc(F)cc(F)c2)cc1OC	802003370	NPVXRVUGKDOJIQ-UHFFFAOYSA-N	443.428	1.999	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)/C=C\c1ccccc1)C(=O)NNC(=O)N=c1cc[nH]cc1	802030874	VLZQRILILXXBQW-OOXMNIKJSA-N	449.558	1.368	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)C2CCC3(CC2)NC(=O)NC3=O)cc1Cl	802074791	YYTOMHRZKNZDJD-UHFFFAOYSA-N	439.856	1.278	50	20	IDGD	
COCCOc1cc([N+](=O)[O-])c(C(=O)NNC(=O)Nc2ccc3c(c2)OCO3)cc1OC	802100911	DASSXXYGFVLIOD-UHFFFAOYSA-N	448.388	1.824	50	20	IDGD	
COc1cc(S(=O)(=O)N2CCOCC2)cc(C(=O)NNc2cccc(F)n2)c1OC	804766096	JBHGISJHBHIIRC-UHFFFAOYSA-N	440.453	1.016	50	20	IDGD	
O=C(NCCCN1C(=O)c2ccccc2C1=O)NNC(=O)c1cccc(OC(F)F)c1	805066292	XWMSBOOYLIWLKC-UHFFFAOYSA-N	432.383	1.918	50	20	IDGD	
CCN1CCN(C(=O)c2ccc(NC(=O)NNc3ccc(-n4ccnc4)nn3)cc2)CC1	806240340	PTFKAZQQSMJXNY-UHFFFAOYSA-N	435.492	1.589	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cc3ccccc3o2)ccc1F	806979610	BUGZGWZDOMCSPG-UHFFFAOYSA-N	448.432	1.222	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)NC[C@H](c1ccc(F)cc1)N1CCOCC1	807000395	RWUBZVMNHWBMBN-GOSISDBHSA-N	440.479	1.799	50	20	IDGD	
Cc1cccn(Cc2c(F)cccc2NC(=O)C(=O)NNc2nc3ccccn3n2)c1=O	807033441	QCSJKLQGZVMBLT-UHFFFAOYSA-N	435.419	1.469	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)NC[C@H](N2CCOCC2)C(F)(F)F)cc1	807541396	MWNWLXUZAXKTCX-BBRMVZONSA-N	448.442	1.446	50	20	IDGD	
Cc1c(/C=C(\C#N)C(=O)OCC(=O)Nc2ccc3c(c2)C(=O)N(C)C3=O)cc(C#N)n1C	809303830	UEPCXAOHFCFVEF-MKMNVTDBSA-N	431.408	1.520	50	20	IDGD	
Cc1cccc(-c2nnc(S)n2CC(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)c1	812732171	VLCKKLNZYQOQCS-UHFFFAOYSA-N	446.558	1.936	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H](C(=O)NNC(=O)c2csc(N3CCOCC3)n2)C[C@H]2C[C@H]21	814226012	ZKXWCNWRDQFHON-BNOWGMLFSA-N	437.522	1.139	50	20	IDGD	
CN(CCOc1ccc(S(N)(=O)=O)cc1)C(=O)NNC(=O)c1cc2ccccc2o1	814309731	KEYIBCGVPKQVAL-UHFFFAOYSA-N	432.458	1.445	50	20	IDGD	
COc1ccc(C(=O)N(C)C)cc1NC(=O)NNc1ccccc1S(=O)(=O)N(C)C	814617119	INWOXTUNLPXFMN-UHFFFAOYSA-N	435.506	1.796	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)cn2ccnc12	815608992	SXCSWAQSRMNICX-UHFFFAOYSA-N	428.399	1.895	50	20	IDGD	
CC(C)Nc1ccc(S(=O)(=O)NCC(=O)NNc2ccc(F)cc2)cc1[N+](=O)[O-]	825313725	AULKIBCOUBWAQJ-UHFFFAOYSA-N	425.442	1.976	50	20	IDGD	
CC(C)NC(=O)CSc1ccccc1C(=O)NNC(=O)[C@H]1COc2ccccc2O1	859414815	KWMDGHIGMMAJBY-QGZVFWFLSA-N	429.498	1.904	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2ccc3ccccc3n2)cc1	912766672	KJHBUERKQGHGIT-UHFFFAOYSA-N	426.454	1.177	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@@H](C)C(=O)NNC(=O)CSCC(=O)N1CCOCC1	912865036	YGJOIMNIYRMPES-AWEZNQCLSA-N	443.953	1.464	50	20	IDGD	
O=C(COC(=O)c1csc(Br)c1)NNC(=O)[C@H]1COc2ccccc2O1	913396053	GGTFWUAHEFFIEI-GFCCVEGCSA-N	441.259	1.655	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1	914709129	MMVZQUIMBHKODD-QGZVFWFLSA-N	437.449	1.113	50	20	IDGD	
COc1ccc(Cn2ncc3cc(C(=O)NNC(=O)c4ccccn4)cnc32)c(OC)c1	914846013	MAAOJNSOOQFJFI-UHFFFAOYSA-N	432.440	1.967	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2ccccc2OC(F)F)c1	916242348	JPBQWUGSJRKGGU-UHFFFAOYSA-N	442.444	1.683	50	20	IDGD	
COc1cc(CNC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)ccn1	916255455	CPPFMCCZYDUWAE-UHFFFAOYSA-N	433.490	1.019	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)NC[C@H](C(C)C)N2CCN(C)CC2)cc1	916258260	PVPYMBZZMWHTIJ-YLJYHZDGSA-N	435.569	1.455	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)NC[C@H](c2ccccc2)N2CCOCC2)nc2ccccc21	916508810	FAKQGSXOAZQTOT-HXUWFJFHSA-N	436.516	1.520	50	20	IDGD	
O=C(CC12CC3CC(CC(C3)C1)C2)NNC(=O)NCCCn1nc2n(c1=O)CCCC2	916649910	OCAVCRCPXAKFPV-UHFFFAOYSA-N	430.553	1.708	50	20	IDGD	
CC(C)(C)C(=O)NNC(=O)c1ccc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1O	917180712	OWYSWSYIUDLRLX-UHFFFAOYSA-N	436.446	1.908	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)OCC(=O)N2CCC[C@H](NC(C)=O)C2)c1C	918808398	BLKYFUPEDUMAAQ-FHTAPLDASA-N	430.505	1.329	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c2c(c1)OCO2)c1ccc(-n2cnnn2)cc1	919838876	QKBWDNOEGLOSNU-UHFFFAOYSA-N	431.206	1.228	50	20	IDGD	
CC(C)Oc1ccc(S(=O)(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)c2ccccc12	919960716	CSGAZCVEPKGLDV-ZDUSSCGKSA-N	441.531	1.307	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)NCc1cccc(CN2CCO[C@@H](C)C2)c1	920236602	DJCZGIOHISSRRS-KRWDZBQOSA-N	442.516	1.825	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)NCc2cccc(C(=O)NC[C@H]3CCCO3)c2)c1	920346737	AQWHKMCXXFEHJK-HXUWFJFHSA-N	440.500	1.813	50	20	IDGD	
CCN(CC)C[C@H](C)NC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	921121726	PDXGVGWQOJMJJS-HNNXBMFYSA-N	425.555	1.145	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)N[C@H]2CCO[C@@]3(CCSC3)C2)cc1	1116307627	XZXPCDRWNKIFIA-GUYCJALGSA-N	428.536	1.481	50	20	IDGD	
CS(=O)(=O)N1CCC(CNC(=O)NNC(=O)c2ccc(Br)cc2)CC1	1116377988	VHOQCIDIPWMGJI-UHFFFAOYSA-N	433.328	1.065	50	20	IDGD	
O=C(NNC(=O)c1c(F)ccc(S(=O)(=O)NC2CC2)c1F)c1n[nH]c2c1CCCC2	1322535270	HOVPNAVOUINMGI-UHFFFAOYSA-N	439.444	1.082	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)c3cc4ccccc4o3)C2)C1	1777844417	FNUVSLZVFPKFBH-QFIPXVFZSA-N	428.489	1.249	50	20	IDGD	
O=C(c1n[nH]c2ccc(F)cc12)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1778624286	JPEMLYBDYLGQJT-RHSMWYFYSA-N	443.248	1.836	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cccn3cncc23)C1	1779134405	QLBMCOAWQGMAMJ-YRISNDGFSA-N	434.924	1.716	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(CCN(C(=O)c3cc(-c4ccccn4)[nH]n3)C2)C1	1779628651	IWEXEHMJXCNHHL-OAQYLSRUSA-N	443.580	1.767	50	20	IDGD	
O=C(c1ccncc1-c1ccccc1)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1779852953	KYUIOOLVWLFSAD-UGKGYDQZSA-N	429.904	1.792	50	20	IDGD	
Cc1nccnc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)CBr)C2	1779871413	HDAWPVRZYUOVLH-ZBQZNYHESA-N	439.354	1.944	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)Cc3ccc(OC)cc3[N+](=O)[O-])CCO2)C1	1781216566	LRCIBEAFESQRQN-JXFKEZNVSA-N	439.896	1.993	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)c3cccn4c(O)nnc34)CCO2)C1	1781227566	MUYOQIYCBSIQMF-MSOLQXFVSA-N	442.303	1.115	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)c3nn[nH]c3C(F)(F)F)CCO2)C1	1781232052	SMKKJKIEKOFSDA-ZIAGYGMSSA-N	444.241	1.503	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781334263	NSFSXHYEWJWNJB-UEKVPHQBSA-N	425.251	1.068	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCn2ccnn2)C1	1782557410	DJUTYPBTNFIDGW-HDMKZQKVSA-N	442.358	1.213	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](C)Br)C3)C2)n(C(F)F)n1	1783535595	ALTIZIMXECJCLB-ZBEGNZNMSA-N	435.269	1.814	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)C3=Cc4ccccc4NC(=O)C3)CCO2)C1	1783881124	JFUVKTIVFZTGLN-VGOFRKELSA-N	447.919	1.496	50	20	IDGD	
C[C@H](C(=O)N1CCO[C@]2(CCN(C(=O)C(Cl)Cl)C2)C1)[S@](=O)c1ccccc1	1783949485	KRLPDUDDDCHFEQ-HEVVRDHBSA-N	433.357	1.816	50	20	IDGD	
COc1ncccc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21	1786007590	SERRVDSBLVSJFJ-QEJZJMRPSA-N	426.311	1.469	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc4nccn34)C[C@@H]21	1786407359	TZONYTDMHSXEKW-DZKIICNBSA-N	435.322	1.713	50	20	IDGD	
Cn1cc(CC(=O)NC2(c3ccc(NC(=O)c4cccc(B(O)O)c4)cc3)CCC2)cn1	1788149209	DMSGNKXXNBXTCI-UHFFFAOYSA-N	432.289	1.090	50	20	IDGD	
O=C(Cc1ccc2c(c1)CCCO2)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21	1788194681	HABCMOFSHPMPQL-JPLJXNOCSA-N	436.936	1.134	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(OC)n(C)n3)[C@H]2C1	1789401508	KGRQENVYOFKBRS-ABHRYQDASA-N	443.342	1.196	50	20	IDGD	
CCOC(=O)N[C@H](O)C(=O)NC1(c2ccc(NC(=O)[C@@H](F)Br)cc2)CCC1	1790536340	PIAVKGRWHUTPAI-TZMCWYRMSA-N	446.273	1.876	50	20	IDGD	
CC(=O)N[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)Br)[C@H]2C1)C(C)(C)C	1791055068	HXHDQBGEPDAJIT-YDMUCJKGSA-N	446.386	1.300	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4ncncc4c3)C[C@@H]21	1791253800	GTWORWSZVWYVIK-XPYUAMARSA-N	432.908	1.477	50	20	IDGD	
C[C@H](Br)C(=O)Nc1ccc(C2(NC(=O)CC[C@H](N)C(N)=O)CCC2)cc1	1791434796	ZTEBXXDVKNQJPR-FZMZJTMJSA-N	425.327	1.497	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)COc3cccnn3)[C@H]2C1	1791602333	ALXUHEDFCJLKCX-WZTLGTBRSA-N	431.320	1.071	50	20	IDGD	
CSCC[C@@H](O)C(=O)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1	1791616303	LKJSUJSXLMAGGP-LJQANCHMSA-N	442.346	1.228	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccn(C(F)F)n1)C2	1792871171	QHRHAMMUKRTJMK-KQXIARHKSA-N	435.269	1.512	50	20	IDGD	
O=C(CCc1cnc2[nH]ccc2c1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1	1796192056	FIKDNOCNZJYJFN-WKCHPHFGSA-N	446.316	1.127	50	20	IDGD	
Cc1nc(Br)sc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Cl	1796365169	QZEHJKWQQORDFW-DKIAZLNASA-N	440.722	1.952	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1occc1Br	1796546009	MTLYNGQCVJMNLA-LFSVMHDDSA-N	435.702	1.499	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/C(=O)c1cccs1)c1cccc(B(O)O)c1	1796894564	HXKQIFHFWKZMGZ-VOHBNYOCSA-N	438.314	1.119	50	20	IDGD	
CC(C)(C)c1cnc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)cn1	1797263636	HARPXFIJVXETNN-BCDXTJNWSA-N	436.321	1.020	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2n(n1)CCCC2	1797442972	AEHKBQCPZMEMAX-NFFDBFGFSA-N	425.327	1.206	50	20	IDGD	
Cc1cccc2cc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)c3ccc(B(O)O)cc3)C4)[nH]c12	1798024522	DBSHCXKTSBFIPQ-ACDBMABISA-N	431.301	1.722	50	20	IDGD	
Cc1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)cc1F	1799613268	QNFWOIZFVZENDF-MUJYYYPQSA-N	425.464	1.698	50	20	IDGD	
Cc1cc2[nH]c(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)CCC(=O)NN(C)C)C4)cc2s1	1799949731	ZGXQNSQKNIQEJK-VTEUUUEMSA-N	447.561	1.114	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](O)CCNC(=O)OC(C)(C)C)C2	1800074899	IQEZZMCPFBLYHU-JKJDWNRSSA-N	431.961	1.918	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2)c1ccnc2c(O)cccc12	1800096552	PBRAHFNNZVPJMR-IVWMJMPLSA-N	448.317	1.929	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(O)cc1F	1800442892	DURPKYFBFRYXMC-SSJPOKSSSA-N	441.463	1.917	50	20	IDGD	
COc1ccc(F)cc1CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)Br	1800762964	LTRNGIKPAQPAIG-NASWQRNTSA-N	443.313	1.750	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc2ccncc12)c1cccc(B(O)O)c1	1800909893	JGQUZQWWPXWVLN-ACDBMABISA-N	429.285	1.480	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(OC)cc(OC)c1)C2	1800979027	OJLPIHCJKFXWHY-LTCOOKNTSA-N	426.897	1.161	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccnc2ncccc12	1800998501	UZIHSACGFFBFLV-QDMKHBRRSA-N	445.483	1.194	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCNC(=O)OC(C)(C)C	1801954752	VJSZFDPMHPTNLH-JYYAWHABSA-N	431.961	1.898	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCOCCOCCOC	1802086685	JLKUPSUDNBPRCY-YYIAUSFCSA-N	449.386	1.868	50	20	IDGD	
CC(C)(CCl)C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1802899494	CZFWXKADXKLDPK-HKUYNNGSSA-N	443.740	1.346	50	20	IDGD	
CN(C)c1ccncc1C(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1	1803140541	FDXAXAYRQYOHFS-MNEFBYGVSA-N	431.924	1.462	50	20	IDGD	
COC(OC)C(=O)NC[C@@H]1CCN(C(=O)[C@H](C)CBr)[C@@H]1c1cccnc1	1803344804	WRPIAPBPVPTACC-VHDGCEQUSA-N	428.327	1.737	50	20	IDGD	
CCS(=O)(=O)CC(=O)NC[C@H]1CCN(C(=O)C(C)(C)CCl)[C@@H]1c1cccnc1	1803509255	JISQGRKNKFKOMZ-NVXWUHKLSA-N	429.970	1.787	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)CSCC(=O)OC)[C@H]1c1cccnc1	1803579535	HHJFNUHIOOKKMQ-RLFYNMQTSA-N	443.953	1.247	50	20	IDGD	
Cn1nc(C(F)(F)F)cc1C(=O)N1CCC2(CCCN(C(=O)[C@@H](O)CCl)C2)CC1	1805522024	CWGSTLHZAPTXBQ-ZDUSSCGKSA-N	436.862	1.883	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)s1	1807363708	PPWPKVMVMBRKLD-WIYYLYMNSA-N	449.341	1.765	50	20	IDGD	
CC(C)C1(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)CCC1	1807364225	CXEBEELAXDULAN-IRLDBZIGSA-N	449.360	1.907	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)c(C)o1	1807369421	JFMWAIUZGUETGZ-UGKGYDQZSA-N	447.300	1.605	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)Cc2cccnc2)[C@H]1c1cccnc1	1807626769	JKAZURHXUNIBDA-WMZHIEFXSA-N	438.532	1.098	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)C(Cl)Cl)[C@H]1c1cccnc1)c1cnc(O)nc1O	1808283026	ZAQPCMSUMGJCNU-JQWIXIFHSA-N	426.260	1.406	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2cnc3ncccn23)[C@H]1c1cccnc1	1809333155	HJYCQOKRWAOGSE-XYJFISCASA-N	442.907	1.698	50	20	IDGD	
C=C1CC(C(=O)N2CC[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)C1	1810295681	VFCYOHMMECWCBP-OXJNMPFZSA-N	434.500	1.366	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)[C@@H]1Cc2ccccc2N1	1812430709	CCIZBOPSYDTFCF-FFGOWVMKSA-N	428.920	1.724	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)c2ccc[n+]([O-])c2)[C@@H]1c1cccnc1	1812864565	ISFKUPLNUWUVRK-JLJPHGGASA-N	433.306	1.818	50	20	IDGD	
CCCNC(=O)CCC(=O)N1CC[C@H](CNC(=O)[C@H](Cl)COC)[C@@H]1c1cccnc1	1813028700	UGSNOOPZGPGJTD-HLIPFELVSA-N	438.956	1.648	50	20	IDGD	
O=C(O)c1cc(C(=O)N2CC[C@@H](CNC(=O)C(Cl)Cl)[C@H]2c2cccnc2)ncn1	1813078224	RGRRCMKBJOUZDI-SMDDNHRTSA-N	438.271	1.693	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)CCc2ccoc2)[C@@H]1c1cccnc1	1813528518	NGGXYBUDJMJCKS-XXBNENTESA-N	441.532	1.686	50	20	IDGD	
C[C@]1(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)CC1(F)F	1814073302	AZEMHVZLWCLIOW-DJPFJPOOSA-N	443.259	1.126	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)[C@H]1CCC(F)(F)C1	1814387680	PEQBLGZIPXPDNT-YOEHRIQHSA-N	446.263	1.831	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@H]1CCc2nc(NC(=O)[C@H](F)Cl)sc2C1	1817122271	XBEKBVMUIAPOQC-SASYSFIBSA-N	440.888	1.724	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)c(C)o1	1817473369	OZYLGCPACFGSKT-LJQANCHMSA-N	436.277	1.919	50	20	IDGD	
CC(C)[C@H](S)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1	1817473847	CFADNUJQPYCWDM-WMZOPIPTSA-N	430.339	1.350	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1ccncc1F	1818394057	QWUVWWNGWVLCMR-GOSISDBHSA-N	437.240	1.243	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3ccc4nncn4c3)sc2C1	1819180984	PQKQMWZFXAWUNB-NWDGAFQWSA-N	434.909	1.665	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](Br)CC)CC2	1820148463	LTANEVCVEOMLDQ-VWYCJHECSA-N	443.367	1.919	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@H]1CCc2nc(NC(=O)c3ccnnc3O)sc2C1	1821093311	YYESRNYCRNFKPE-IUCAKERBSA-N	440.323	1.896	50	20	IDGD	
Cc1nscc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1	1822413542	ZCHJQUCUYOOXMF-OAHLLOKOSA-N	433.538	1.854	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H]2CCOC2)n[nH]1	1822952866	XLRNTTOZMRSKHQ-GUROPIRUSA-N	441.492	1.572	50	20	IDGD	
O=C(Nc1cccnc1)C(=O)N[C@H]1CCc2nc(NC(=O)C(Cl)Cl)sc2C1	1826099986	XZGWGNVOXINNFO-QMMMGPOBSA-N	428.301	1.893	50	20	IDGD	
CC1(C)CC(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2ccc(B(O)O)cc2)CC3)C1	1826201292	RQWLRTWECRGQFT-OAHLLOKOSA-N	427.335	1.485	50	20	IDGD	
C=CCOCCCC(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827049015	FUKZKZURJIYUSR-JOCHJYFZSA-N	442.365	1.583	50	20	IDGD	
O=C(/C=C/c1ccoc1)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827050367	PGDIVYNOEFTZKI-LQPWBEKMSA-N	436.317	1.906	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@H](C)CN)CC1	1827681212	PTVSNGWWTITMRH-GBYGFOPDSA-N	430.553	1.335	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccnc3S)CCO2)C1	1829798915	RCIIJLVJVRTWID-ZWKOTPCHSA-N	448.372	1.677	50	20	IDGD	
CN(C)c1cncc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)c1	1830357907	HLZBJZCBWUCSPJ-NRFANRHFSA-N	438.956	1.483	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H](F)Br)CC1	1830381013	DJKMZLWRMUNFEC-YOEHRIQHSA-N	449.365	1.670	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccnc(OC)c3F)C2)C1	1831645624	DWAQCJDBKWOZDQ-FOIQADDNSA-N	443.903	1.707	50	20	IDGD	
C[C@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)c3cocn3)CC2)CC1	1833261967	FWGYQATVIOEDKA-CYBMUJFWSA-N	427.343	1.891	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)Cc3cccc(C)n3)CC2)CC1	1833361453	HJLXYZWSCPCQFL-HXUWFJFHSA-N	436.984	1.758	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)/C=C/c3cccnc3)CC2)CC1	1833858871	VIKSATRIGVAWBE-DPZZJQGRSA-N	434.968	1.920	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)c3ccnn3C)CC2)CC1	1834210717	NEYGWXLBTPQJOV-CQSZACIVSA-N	440.386	1.636	50	20	IDGD	
Cn1nccc1C(=O)NC1CCN(C2CCN(C(=O)[C@@](C)(Cl)CCl)CC2)CC1	1834212754	JXCHKEZMYBPJRH-IBGZPJMESA-N	430.380	1.842	50	20	IDGD	
O=C(CCBr)NC1CCN(C2CCN(C(=O)[C@@H]3C[C@H]4CC[C@@H]3O4)CC2)CC1	1834423404	KAFJHTJJQLSAIV-KURKYZTESA-N	442.398	1.911	50	20	IDGD	
O=C(CCC(F)(F)F)N1CCOC[C@]2(C1)CN(C(=O)CCBr)CCO2	1834822517	SHYQCXRHIAMOEY-AWEZNQCLSA-N	431.249	1.570	50	20	IDGD	
O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)Cc1cccc(F)c1)CCO2	1835021382	XTDQMXVDPLWNTO-LJQANCHMSA-N	443.313	1.610	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cnoc3C3CC3)C2)C1	1837712425	QAUCFECUBWGBEQ-HXUWFJFHSA-N	437.569	1.474	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(OC)c(F)c3)C2)C1	1839141457	JCGKXTOXWNFXTO-YWZLYKJASA-N	428.888	1.922	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3nc(Cl)ccc3F)C2)C1	1839142413	NSBYPXRUHGIULR-XIKOKIGWSA-N	434.295	1.962	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3n[nH]c4ccc(F)cc34)C2)C1	1839145956	RWIDMAOMIFOTFD-QRWLVFNGSA-N	438.887	1.789	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)cc1F	1839202225	XXAIKURJGGXPPV-YJBOKZPZSA-N	447.276	1.895	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnn4cccc(C)c34)CCO2)C1	1839612128	BBFFPOCYKFBHNM-UTKZUKDTSA-N	434.924	1.730	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)C34CC(F)(C3)C4)C2)C1	1839962482	HFZDZEWFSXCAQV-CRZVIPCUSA-N	433.318	1.509	50	20	IDGD	
Cc1cc(F)cc(CC(=O)N2CCO[C@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)c1	1840241538	KCZGEFRWFOTDNJ-LJQANCHMSA-N	433.307	1.937	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2ccc(Cl)nc2)C1	1840971361	UZQHFHLLDAWVMX-ZMOGYAJESA-N	428.880	1.686	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)COC2CCCCC2)C1	1841229007	HGDVXLHPGJAFCM-LFVJCYFKSA-N	429.521	1.673	50	20	IDGD	
Cc1ccn2c(=O)c(C(=O)N3CC4(CCCN4C(=O)[C@H](C)CBr)C3)cnc2c1	1841287601	XLBYLYGBVGTYIE-CQSZACIVSA-N	447.333	1.851	50	20	IDGD	
COC(=O)CCC(=O)N1CC2(CCCN2C(=O)c2cc([N+](=O)[O-])ccc2OC(C)=O)C1	1844692258	BCBLLQQVBFNCMU-UHFFFAOYSA-N	433.417	1.290	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@]1(O)CCN(C(=O)OC(C)(C)C)C1)C2	1845167808	VSVGIOWUCQDSNK-XOBRGWDASA-N	429.945	1.579	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2cccc(F)c2Cl)C1	1845369720	APEVYNFHDPTWQY-UHFFFAOYSA-N	431.855	1.608	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@H]1C[C@H]3C[C@H]3N1C(=O)OC(C)(C)C)C2	1846360496	PGULBBMVQVAKKQ-QKPAOTATSA-N	441.956	1.842	50	20	IDGD	
COc1ccc(OC)c(CCC(=O)N2CC3(CCCN3C(=O)CCC(=O)NN(C)C)C2)c1	1846384567	IHDJPAUKROORIG-UHFFFAOYSA-N	446.548	1.213	50	20	IDGD	
CC[C@H](C)[C@H](O)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1847838650	WUWSBNHOGDFCFB-QXKUPLGCSA-N	431.961	1.727	50	20	IDGD	
O=C(NNC(=O)c1ccccn1)c1csc(S(=O)(=O)N2CCc3ccccc3C2)c1	11763468	IHBBCGUUHBGJMF-UHFFFAOYSA-N	442.522	1.965	50	20	IDGD	
Cn1c(SCC(=O)NNC(=O)c2ccccc2)nnc1[C@@H]1COc2ccccc2O1	22165449	BHQQFQWQZVAYOV-INIZCTEOSA-N	425.470	1.881	50	20	IDGD	
COCc1c(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)oc2ccccc12	26745533	IQQGZZWDSIWAGL-UHFFFAOYSA-N	431.470	1.904	50	20	IDGD	
Cc1ccnn1-c1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1	26745812	GLUSYCZGBRJOJY-UHFFFAOYSA-N	427.486	1.506	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=O)c2ccccc2O)c1	29069821	VKLQUWHZADSRDY-UHFFFAOYSA-N	427.866	1.045	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)CCCN2C(=O)c3ccccc3C2=O)o1	109421051	AANPIYWAHSOFKX-UHFFFAOYSA-N	426.473	1.959	50	20	IDGD	
COCCCNC(=S)N(C)NC(=O)CCNC(=O)c1ccc(Br)cc1	726075276	CCHGTLNSOBDOSB-UHFFFAOYSA-N	431.356	1.443	50	20	IDGD	
CSCC[C@H](NC(=O)NNC(=O)CNC(=O)c1cccs1)c1nnc2ccccn12	726086569	LHQUSVSUBYSLKK-LBPRGKRZSA-N	447.546	1.345	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNS(=O)(=O)c2cc(F)ccc2C(=O)OC)cc1	727351538	MPENZOJLAZMXAZ-GFCCVEGCSA-N	440.449	1.788	50	20	IDGD	
CC(C)Oc1ccc(NC(=S)NNC(=O)c2cc(S(=O)(=O)N(C)C)c[nH]2)cc1	727495730	VMOAPJSDWATYAX-UHFFFAOYSA-N	425.536	1.684	50	20	IDGD	
Cc1ccn(-c2ccc(C(=O)OCC(=O)NNC(=O)[C@H]3COc4ccccc4O3)cc2)n1	728327964	CVTMLQDZUYDOCG-LJQANCHMSA-N	436.424	1.325	50	20	IDGD	
CCCNC(=O)Nc1ccc(CC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1	728889908	HWWIBPMDAVJIRI-UHFFFAOYSA-N	439.520	1.615	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)Cc2c(C)nc3c(c(O)nn3C)c2C)cc1OC	729282223	NBGSMPBDINRTMM-UHFFFAOYSA-N	427.461	1.702	50	20	IDGD	
C[C@H](NC(=O)c1ccc(Br)s1)C(=O)NNC(=O)CNc1ccccc1	729513653	FPPIITGUQOHWCE-JTQLQIEISA-N	425.308	1.888	50	20	IDGD	
C[C@@H]1COCCN1CCNC(=O)NNC(=O)COc1ccccc1Cc1ccccc1	729614864	SRLASAROHHIUDA-GOSISDBHSA-N	426.517	1.707	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1ccc2c(c1)NC(=O)CCN2	729719287	TXWAPUVYKVYUQB-UHFFFAOYSA-N	446.847	1.721	50	20	IDGD	
NS(=O)(=O)c1cnn(CC(=O)NNc2ccc(Br)cc2C(F)(F)F)c1	731834722	USOJAGVTWDUQCG-UHFFFAOYSA-N	442.217	1.455	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)C1CCN(S(=O)(=O)c2ccc(C(C)(C)C)cc2)CC1	732084217	RQGVXAYBVUQYMD-UHFFFAOYSA-N	447.561	1.878	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)Cc3ccc(OCC#N)cc3)cc2)CC1	732286122	UWKHDDMYOQSXSD-UHFFFAOYSA-N	443.529	1.211	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)CNC(=O)c1cccc([N+](=O)[O-])c1	734252357	PLLJUETWJYEWEG-UHFFFAOYSA-N	449.489	1.545	50	20	IDGD	
Cc1nc(-c2ccccn2)nc(NNC(=O)C2=NN(c3ccc(F)cc3)[C@@H](C(N)=O)C2)c1C	734257051	ALXTVAWTWJDSPA-GOSISDBHSA-N	448.462	1.858	50	20	IDGD	
CCc1cc(NNC(=O)CNC(=O)c2ccc(OC)c(OC)c2)nc(-c2ccccn2)n1	734357161	UUPAYCOKJUVOEH-UHFFFAOYSA-N	436.472	1.991	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)CCOCc2ccccc2)CC1	735117583	YIEOWSGOWLLWNV-UHFFFAOYSA-N	433.534	1.068	50	20	IDGD	
O=C(NNc1ccc(Cl)nn1)c1ccc2c(c1)S(=O)(=O)N(C[C@@H]1CCCO1)C2=O	735686810	IASWHENCQSUAKU-NSHDSACASA-N	437.865	1.210	50	20	IDGD	
CC[C@H](Nc1c([N+](=O)[O-])c(C)nn1C)C(=O)NNC(=O)c1cc(-c2ccccc2)[nH]n1	735840834	OMBCHBLMEXODSX-ZDUSSCGKSA-N	426.437	1.679	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCCCCC2)cc1C(=O)NNc1ccnc(N(C)C)n1	740114123	PSTWROQOTUWDMU-UHFFFAOYSA-N	448.549	1.873	50	20	IDGD	
COc1ccc(C(=O)NNc2ncnc3[nH]cnc23)cc1S(=O)(=O)NC1CCCC1	740746141	LRBARDALKJQEJZ-UHFFFAOYSA-N	431.478	1.339	50	20	IDGD	
CC(C)(C)OC(=O)Nc1ccc(C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)c(Cl)c1	740776961	QETDLQXUKGFYTG-SNVBAGLBSA-N	431.898	1.883	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)COc1ccc(I)cc1	740851047	NAWYESRVQFQACH-UHFFFAOYSA-N	433.246	1.122	50	20	IDGD	
Cc1nn(C)c2sc(C(=O)N[C@H](C)C(=O)NNc3nc(-c4cccnc4)no3)cc12	742073120	SJKJCQABCONRHW-SNVBAGLBSA-N	426.462	1.650	50	20	IDGD	
CC(C)c1nn([C@H]2CCS(=O)(=O)C2)cc1C(=O)NNC(=O)COCc1ccccc1	742693230	XKXVZWCZFLNONO-INIZCTEOSA-N	434.518	1.344	50	20	IDGD	
O=C(NNc1ncnc2[nH]cnc12)[C@@H]1CCCN(C(=O)N2CCc3sccc3C2)C1	743470544	TVFVANXXJPBKEY-CYBMUJFWSA-N	426.506	1.748	50	20	IDGD	
C[C@@H]1Sc2ccc(C(=O)NNC(=O)Nc3ccc(S(C)(=O)=O)cc3)cc2NC1=O	743830490	WEFBMVBKTLXJIS-JTQLQIEISA-N	434.499	1.989	50	20	IDGD	
Cc1cccc(C)c1NC(=O)CN1CCN(CC(=O)NNC(=O)c2cccc(C#N)c2)CC1	744384859	JCZRYDPFCLOTMH-UHFFFAOYSA-N	448.527	1.192	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)c2cc(S(=O)(=O)N(C)C)ccc2F)c1	744556852	UFQUQZRBMNMSOU-UHFFFAOYSA-N	437.449	1.002	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)[C@H]2CCCN(C(=O)Cc3ccccc3)C2)c1	744700257	HEPRFBCTFODGNO-FQEVSTJZSA-N	437.496	1.781	50	20	IDGD	
CC(=O)CCc1ccc(OCC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)cc1	745108095	VTASJXMPFXZIRM-UHFFFAOYSA-N	446.529	1.650	50	20	IDGD	
COc1cc(C(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)cc(NC(C)=O)c1OC	745440186	XRNSOFBAIRAECT-UHFFFAOYSA-N	449.847	1.934	50	20	IDGD	
C[C@H](CCc1cccn1C)NC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	745875034	JBZXYWQEIMGSOT-MRXNPFEDSA-N	449.581	1.004	50	20	IDGD	
O=C(NNC(=O)N1CCOCC1)[C@H]1CCCN(C(=O)c2ccccc2OC(F)F)C1	745986070	JEUMMQHWLKSBAL-ZDUSSCGKSA-N	426.420	1.213	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2sccc2OC(F)F)CC1	745994570	IUICCPVRSXIYQA-UHFFFAOYSA-N	447.489	1.438	50	20	IDGD	
COc1ccc(-c2nn(CCC#N)cc2C(=O)NNC(=O)N2CCOCC2)cc1[N+](=O)[O-]	745995776	AYIBVRDBBGYUGR-UHFFFAOYSA-N	443.420	1.067	50	20	IDGD	
Cc1cc(=O)n(CC(=O)NC(C)C)c(C)c1C(=O)NNC(=O)c1cccc2ncccc12	746229172	KUXAHBZGNFONBV-UHFFFAOYSA-N	435.484	1.613	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1ccccc1N1CCOCC1	747280029	IWGCRGLAZBKCDI-UHFFFAOYSA-N	447.875	1.803	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCCOc2ncccc2F)nc1	747450069	JWFCRSFMUYYIHI-UHFFFAOYSA-N	426.474	1.351	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)NCc1cccc(S(=O)(=O)N2CCCCC2)c1	747502292	LDSNJOSBHQWMJJ-UHFFFAOYSA-N	431.518	1.329	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NC2CCN(CCOC(C)C)CC2)c2ccccc2c1=O	747590235	AUFBYVJBNXHOFE-UHFFFAOYSA-N	444.536	1.250	50	20	IDGD	
COc1ccccc1N(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)c2ccc[nH]2)cc1	747663056	IXEDXMKTIRTXMG-UHFFFAOYSA-N	428.470	1.923	50	20	IDGD	
Cc1c(Br)cc(S(=O)(=O)NNC(=O)c2ccccc2O)cc1C(=O)O	748640118	RUBIQOUOHKWRQL-UHFFFAOYSA-N	429.248	1.785	50	20	IDGD	
Cc1cc(C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)nc2nc(O)nc(O)c12	748829195	OTSJAPWFWRZAHF-UHFFFAOYSA-N	430.371	1.672	50	20	IDGD	
COc1cc(S(=O)(=O)NNC(=O)COCc2ccccc2)c(Cl)cc1C(=O)O	749145646	LIXRTGHLLWMUNV-UHFFFAOYSA-N	428.850	1.573	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCc2ccc(OCC3CC3)nc2)nc1	749187688	ZNVKIVRUQWBUHU-UHFFFAOYSA-N	434.522	1.778	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)c3cc(S(N)(=O)=O)cc(C)c3C)n[nH]2)cc1	752617203	JNJCXZVJBNEMMK-UHFFFAOYSA-N	427.486	1.724	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)[C@H]2CC(=O)N(c3cc(OC)cc(OC)c3)C2)cc1	752792739	QBCAWBHALDKWFP-AWEZNQCLSA-N	442.472	1.325	50	20	IDGD	
CC(C)[C@@H]1OCCC[C@@H]1CNC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	753033671	FNFSTMLWDZPYNQ-KNQAVFIVSA-N	431.581	1.980	50	20	IDGD	
Cc1nn(-c2ccccc2)c(C)c1[C@H]1OCC[C@@H]1C(=O)NNC(=O)C(=O)Nc1ccccn1	753176335	GKIPPIYOXRFWBB-PXNSSMCTSA-N	448.483	1.748	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@@H]2CCc3cc(OC)ccc3C2)c2ccccc2c1=O	753289821	YRDKIJFJNWNLLX-MRXNPFEDSA-N	435.484	1.927	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)c2ccc(CNS(C)(=O)=O)o2)cc1OC	753566574	RWCMGZMKMXXVJD-UHFFFAOYSA-N	425.463	1.201	50	20	IDGD	
O=C(CC(F)(F)F)NNC(=O)Nc1ccc(Cl)c(S(=O)(=O)N2CCOCC2)c1	755360923	IHQFUGZOBXSYRF-UHFFFAOYSA-N	444.819	1.466	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)c1ccc(-n2ccnn2)cc1	756105467	HEAPKPDZYMWEGU-ZDUSSCGKSA-N	443.489	1.768	50	20	IDGD	
O=C(COC(=O)c1csc([C@@H]2CCCO2)n1)NNC(=O)[C@H]1COc2ccccc2O1	756459941	NPAIAGJSKYYOEA-LSDHHAIUSA-N	433.442	1.139	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2ccc(C(=O)N(C)C)c(C)c2)c2ccccc2c1=O	756705850	WOXOFXWWPCGPGV-UHFFFAOYSA-N	436.472	1.893	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)Nc1ccc(S(=O)(=O)NCC2CC2)cc1	756784356	MQODZFAEVYMFGV-UHFFFAOYSA-N	436.465	1.746	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)nn1C	757753198	KWZGLIQOYXPXSP-UHFFFAOYSA-N	431.460	1.897	50	20	IDGD	
COCCn1nc(C)c(NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c1C	757871919	RAXHXHFKRHWLIT-UHFFFAOYSA-N	443.552	1.511	50	20	IDGD	
CCNS(=O)(=O)c1ccc(CC(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)cc1	759393289	SOZFEBWAKVKBPQ-UHFFFAOYSA-N	445.476	1.518	50	20	IDGD	
CCO[C@@H]1C[C@@H](NC(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)[C@]12CCCO2	760140947	DXBRYUABVDDGKC-IIDMSEBBSA-N	427.527	1.121	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)CCNS(=O)(=O)c2ccc(C(C)=O)cc2)n1	762908624	MWCMJEZJAUYAMA-UHFFFAOYSA-N	434.522	1.337	50	20	IDGD	
Cn1nc(SCC(=O)NN=C2CCCc3c2sc2ccccc32)c(=O)n(C)c1=O	763150723	GLYJSXCHNYKGKD-UHFFFAOYSA-N	429.527	1.643	50	20	IDGD	
CCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2Br)cc1	763484365	XSCHFGUAHHQWBF-UHFFFAOYSA-N	433.262	1.599	50	20	IDGD	
O=C(NNC(=O)c1cc2ccccc2cc1O)C(=O)Nc1ccc(C(=O)NC2CC2)cc1	763517372	IXRLNOYJCGCQSD-UHFFFAOYSA-N	432.436	1.837	50	20	IDGD	
COCC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2cc(C)nc3ccccc23)cc1	763616418	UCYJDWDFNOGYEY-UHFFFAOYSA-N	435.440	1.528	50	20	IDGD	
O=C(COc1cccc(C(F)(F)F)c1)NNC(=O)C(=O)Nc1ccnn1-c1ccncc1	763638550	AKPRDIROUWPPOE-UHFFFAOYSA-N	448.361	1.451	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cc(C)ccc2Br)cc1	763662061	SNBJAFVSKJETGK-UHFFFAOYSA-N	436.262	1.931	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cc(F)ccc2N2CCCCC2)cc1	763681025	IEZZFCLPMKJYBX-UHFFFAOYSA-N	439.447	1.853	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2F)ccc1N1CCCC1=O	763681805	QSKBAPGRPIQAEA-UHFFFAOYSA-N	444.419	1.126	50	20	IDGD	
COc1cc(Br)cc(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)c1	763681938	PPGUTOKDRBKRJN-UHFFFAOYSA-N	447.245	1.494	50	20	IDGD	
Cc1nn(C)c2ncc(NC(=O)C(=O)NNC(=O)CSc3ccc(Cl)cc3)cc12	763735208	PRXXDIOACPGLFK-UHFFFAOYSA-N	432.893	1.808	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2ccc(N3CCOC3=O)cc2)c1	763772245	PFLOIEGSABPKSR-UHFFFAOYSA-N	428.401	1.060	50	20	IDGD	
CCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(C(C)=O)cc2)cc1	763878562	RHYKCCFCHUSJEU-CQSZACIVSA-N	440.456	1.192	50	20	IDGD	
CCOC(=O)c1ccccc1NC(=O)C(=O)NNC(=O)c1ccc(OCC)c(OC)c1	763912760	SITMCFYMMYVFDR-UHFFFAOYSA-N	429.429	1.670	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)C(=O)Nc1ccc(C(=O)N2CCc3ccccc32)cc1	763994065	WFNLTAMLBCDKLH-UHFFFAOYSA-N	431.452	1.628	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2O1)C(=O)Nc1ccnn1-c1ccc(Cl)cc1	764152066	CBOYCRVKHYJCQQ-MRXNPFEDSA-N	425.832	1.615	50	20	IDGD	
COC(=O)c1[nH]c(C)cc1NC(=O)C(=O)NNC(=O)c1cc(F)ccc1Br	764270565	OWZNSRBHNRGSEV-UHFFFAOYSA-N	441.213	1.411	50	20	IDGD	
CCOCC(=O)NNC(=O)C(=O)Nc1ccnc(Oc2ccccc2Br)c1	764317479	IVNZCFDTAHNXND-UHFFFAOYSA-N	437.250	1.759	50	20	IDGD	
O=C(CN1C(=O)[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)NNc1c(F)cc(C(=O)NC2CC2)cc1F	764329213	FHXSYPAZZXXHAW-CVSRONHPSA-N	430.411	1.107	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1cc(C(C)C)nn1-c1ccc(C)cc1	764398156	DOMUVYOCJVNQMM-OAHLLOKOSA-N	431.493	1.442	50	20	IDGD	
CC(C)NS(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)c1	765615300	FQRCPJIZDPYWHW-UHFFFAOYSA-N	445.476	1.977	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1cc(Br)ccc1N1CCCC1	766260482	GHSJRXGSZOZSCE-UHFFFAOYSA-N	435.282	1.930	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1)N1CCCC1=O	766662710	CETCKRVIEZYIEH-SFHVURJKSA-N	435.956	1.006	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)NC1CCN([C@@H]2CCCC[C@@H]2O)CC1	767936655	AMNREUKCMRIXGK-CABCVRRESA-N	428.331	1.489	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3cc(NC(C)=O)ccc3O)n[nH]2)cc1OC	768277924	UBDPVWDPZQJTMU-UHFFFAOYSA-N	439.428	1.833	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)NCCC(=O)NNc2ncnc3ccsc23)cc1	768292567	ZHEJKMYYDNCYRO-UHFFFAOYSA-N	434.503	1.461	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2ccc(C(=O)O)c(F)c2)cc1Br	768499319	KYLOWCDIECUFDU-UHFFFAOYSA-N	447.238	1.918	50	20	IDGD	
CN(C)c1ccc(N2CCC(NC(=O)NNc3nc(O)c4cnn(C)c4n3)CC2)cc1	770399950	JGNHRNHLKPTMIZ-UHFFFAOYSA-N	425.497	1.430	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)c1ccc(S(=O)(=O)N2CCCCC2)cc1	771893405	JDGBCFGXKSQDAF-OAHLLOKOSA-N	439.534	1.600	50	20	IDGD	
COC(=O)c1ccc(S(=O)(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)c(OC)c1	773251871	QBMZTBADVGHMOW-NSHDSACASA-N	442.877	1.912	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)C(=O)Nc2ccc(C(=O)N(C)[C@H]3CCCN(C)C3)cc2)n1	773478207	LBFJWJLAQKXBIJ-SFHVURJKSA-N	439.520	1.341	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1cccc2c1oc(=O)n2C	774006157	BJMIVAMVINEHBF-JTQLQIEISA-N	432.820	1.338	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)NC[C@@H]2CC[C@H](C(=O)N(C)C)O2)c(C)n1-c1ccccc1	775460372	IXFQYIRRECDADL-PKOBYXMFSA-N	427.505	1.674	50	20	IDGD	
CN(NC(=O)c1ccc2c(c1)NC(=O)CO2)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776206165	QGQNDEVQUDLTKL-UHFFFAOYSA-N	433.465	1.267	50	20	IDGD	
Cc1nn(CC(F)(F)F)c(C)c1[C@@H](C)C(=O)NNC(=O)CNC(=O)c1cccs1	777976127	MZXNTYCZUMSCQI-SECBINFHSA-N	431.440	1.805	50	20	IDGD	
CN(C)C(=O)COc1ccccc1C(F)(F)C(=O)NNC(=O)c1ccc(Cl)nc1	778604308	MYRBCQTZAZVFKH-UHFFFAOYSA-N	426.807	1.755	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)[C@H](O)[C@@H](O)c2nc3ccccc3s2)o1	779500858	SIRAMJFWLYJCMI-IAGOWNOFSA-N	432.502	1.587	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)CSc2n[nH]c(-c3ccc4c(c3)OCCO4)n2)cc1	779822734	HAAJZWYENVCSJR-UHFFFAOYSA-N	436.453	1.668	50	20	IDGD	
CN(C)[C@@H](C(=O)OCC(=O)NNC(=O)c1cccc(C#N)c1)c1c(F)cccc1Cl	780114533	HIYPHHKFXBRBCA-GOSISDBHSA-N	432.839	1.958	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)c2cc(S(N)(=O)=O)c(Br)s2)c1	780792757	ZZXGOUQDTJNPBS-UHFFFAOYSA-N	434.293	1.702	50	20	IDGD	
Cc1cnc(-c2cccc(NC(=O)C(=O)NNC(=O)Cc3nc4ccccc4n3C)c2)o1	782886403	JMKVSEQCEBAENN-UHFFFAOYSA-N	432.440	1.865	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNS(=O)(=O)c1ccc(S(F)(F)(F)(F)F)cc1	782910923	OROSEGKPTFHXFN-ZETCQYMHSA-N	447.429	1.591	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ccc(F)cc2F)cc1OCC(=O)NC1CC1	783340489	QVOKUZKNEGJKAG-UHFFFAOYSA-N	434.399	1.713	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NN=c2sc3ccccc3n2C)cc1NS(C)(=O)=O	783349238	FSNUXFLPBKUNAF-UHFFFAOYSA-N	449.514	1.191	50	20	IDGD	
N#Cc1cc(Cl)ccc1-n1ccc(NC(=O)C(=O)NNc2ccc(-n3cccn3)nn2)n1	783433165	MCROOJUOFVXALK-UHFFFAOYSA-N	448.834	1.455	50	20	IDGD	
Cc1ccc(-n2nccc2NC(=O)C(=O)NNc2ccc(OCC(F)(F)F)cc2)nn1	784369112	UBAOZHWWHXVJCZ-UHFFFAOYSA-N	435.366	1.994	50	20	IDGD	
CC(C)CNC(=O)c1ccc(NC(=O)C(=O)NNc2cccc(S(C)(=O)=O)c2)cc1	784841791	RKLMHVSGZZXCBR-UHFFFAOYSA-N	432.502	1.558	50	20	IDGD	
CSc1nnnn1-c1cccc(NC(=O)C(=O)NNc2cccc(C(F)(F)F)n2)c1	784952749	PNIIOFTVAPPJMR-UHFFFAOYSA-N	438.395	1.880	50	20	IDGD	
Cc1ccc(NC(=O)C2CC2)cc1NC(=O)C(=O)NNC(=O)Cc1cn2ccccc2n1	785061619	YWUJRZAHGJSGBE-UHFFFAOYSA-N	434.456	1.320	50	20	IDGD	
COc1cc(F)cc(NNC(=O)C(=O)Nc2ccc(S(=O)(=O)N(C)C(C)C)cc2)c1	785233861	CAVMBASEEWJMPG-UHFFFAOYSA-N	438.481	1.945	50	20	IDGD	
COCCCS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2cc(F)cc(OC)c2)cc1	785237813	WKNLUTKJAONPPQ-UHFFFAOYSA-N	439.465	1.726	50	20	IDGD	
NC(=O)[C@@H]1CCC[C@@H](C(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)C1	786723430	OXJURGROJMDDHI-RTBURBONSA-N	447.499	1.441	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2cccc(N3CCNC3=O)c2C)n1	787576343	PADPFNMMKUHAJP-UHFFFAOYSA-N	426.481	1.243	50	20	IDGD	
COCc1nc(OC)c2c(C)c(C(=O)NNc3ccc(-n4ccnc4)nn3)sc2n1	788178551	SPFPSMQUPXKHBF-UHFFFAOYSA-N	426.462	1.887	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H]2CCC(=O)c3cccn32)c1	788723625	CBFGBEAUPGUZHB-QGZVFWFLSA-N	432.502	1.497	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)N[C@H]1CCN(c2ccc(Cl)cc2Cl)C1	788906244	NFFKBERGMLYZDC-LBPRGKRZSA-N	440.287	1.926	50	20	IDGD	
O=C(NNC(=O)c1ccoc1)C(=O)Nc1cc(Br)cc(C(=O)N2CCCC2)c1	790952551	OBPQDHRSAHFQAG-UHFFFAOYSA-N	449.261	1.678	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)[C@H]2CC(c3cc(OC)ccc3OC)=NO2)c1	791457550	DQDIOEYYDTUBRI-LJQANCHMSA-N	429.429	1.675	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)[C@](C)(O)Cn2cc(C(F)(F)F)ccc2=O)c1	792031237	TTXUPZIRIICFBG-GOSISDBHSA-N	426.395	1.145	50	20	IDGD	
CCS(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2cc(Br)c[nH]2)s1	792217195	GHTCHIAKRJHDGU-UHFFFAOYSA-N	435.325	1.777	50	20	IDGD	
COc1ccc(NNC(=O)[C@](C)(O)Cn2cc(C(F)(F)F)ccc2=O)c([N+](=O)[O-])c1	792240416	SSVWBTGDLVRBDD-MRXNPFEDSA-N	430.339	1.678	50	20	IDGD	
COc1cc(C(F)(F)F)ncc1NC(=O)C(=O)NNC(=O)COc1cc(C)ccc1C	792267511	HKFYQQMNFYUBCV-UHFFFAOYSA-N	440.378	1.891	50	20	IDGD	
Cc1ccn(-c2ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc3ccccc3F)cc2)n1	793021815	KTESQKAZGSDMSM-AWEZNQCLSA-N	425.420	1.873	50	20	IDGD	
Cc1nc(O)c(Br)cc1C(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	794774988	KZLNRIKLRZKNFS-UHFFFAOYSA-N	432.234	1.180	50	20	IDGD	
CNC(=O)[C@@]1(C)CCN(C(=O)NNC(=O)[C@H]2Cc3ccccc3CN2Cc2ccccc2)C1	797607087	AJFQECUVHJKFSR-BWKNWUBXSA-N	449.555	1.812	50	20	IDGD	
Cc1ccc([C@@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)cc1	797703446	WPCIEKUMBMEEHR-LSDHHAIUSA-N	425.507	1.143	50	20	IDGD	
CC[C@H](Nc1c([N+](=O)[O-])c(C)nn1C)C(=O)NNC(=O)C(=O)Nc1ccc(C)c(C)c1	798309601	IYZPTMAZAQPRMJ-AWEZNQCLSA-N	431.453	1.230	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)C(=O)Nc2ccc(O[C@@H]3CCN(C)C3=O)cc2C)c1	799257851	MCDQMDQQFIKFHS-GOSISDBHSA-N	440.456	1.473	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)Nc2cccc(C(=O)NCC(=O)NC)c2)cc1OC	800597481	XNUFTNCWTLNRQA-UHFFFAOYSA-N	443.460	1.036	50	20	IDGD	
CC(=O)NCCN(Cc1ccc(C)s1)C(=O)NNC(=O)CNC(=O)c1cccs1	801005949	OPOLBDCJXYQQRM-UHFFFAOYSA-N	437.547	1.227	50	20	IDGD	
CC(C)(C)OC(=O)N1CCn2c(nnc2C2CCN(C(=O)NNC(=O)C(C)(C)C)CC2)C1	801750348	QSCQJUDNQUHROP-UHFFFAOYSA-N	449.556	1.995	50	20	IDGD	
O=C(N=c1cc[nH]cc1)NNC(=O)C1(NS(=O)(=O)c2cccc(F)c2)CCCCC1	802028387	VCQUWHAJGXAXCB-UHFFFAOYSA-N	435.481	1.477	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)CNC(=O)OCC(F)(F)F)c(OC)cc1Cl	802082104	AGRXRZLAVISIHB-UHFFFAOYSA-N	428.751	1.798	50	20	IDGD	
Cn1c(=O)c2ccc(C(=O)NNC(=O)Nc3ccc(Cl)cc3Cl)nc2n(C)c1=O	802094416	UMIWQJQRSJUXSZ-UHFFFAOYSA-N	437.243	1.406	50	20	IDGD	
COc1ccc(Cl)c(NC(=O)NNC(=O)CCNS(=O)(=O)c2ccccc2)c1	802111554	KJSROZBDIQEHLM-UHFFFAOYSA-N	426.882	1.870	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)CC[C@@H]2NC(=O)N(c3ccc(C#N)cc3)C2=O)cc1	802117634	WVYIKQBVISXJMT-SFHVURJKSA-N	449.471	1.682	50	20	IDGD	
NS(=O)(=O)c1cnn(CC(=O)NNc2ccc(-c3cccc(C(F)(F)F)c3)nn2)c1	804210469	MWJNOIBJWZVJTP-UHFFFAOYSA-N	441.395	1.150	50	20	IDGD	
CN(C[C@@H]1CCCN(C(=O)NNC(=O)c2cccc(OC(F)F)c2)C1)S(C)(=O)=O	805065136	IWXXTBHIUUWHJU-LBPRGKRZSA-N	434.465	1.246	50	20	IDGD	
Cc1cc([N+](=O)[O-])ccc1NNC(=O)Nc1ccc(S(=O)(=O)N2CCOCC2)cn1	806435723	OEZHQGYGZLINTI-UHFFFAOYSA-N	436.450	1.468	50	20	IDGD	
COCCNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3c2)c1	806976463	QAYBBJWIFQOEKL-UHFFFAOYSA-N	434.452	1.616	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)c1cc(Cl)cc(F)c1Br	807082892	YDBPMNMFVDPCHJ-UHFFFAOYSA-N	429.633	1.828	50	20	IDGD	
CN1CCC/C1=N/S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ncccc2F)cc1	807302906	SWTKZXDUKLSOGA-IWIPYMOSSA-N	434.453	1.115	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)N[C@@H](c2nncn2C)C(C)C)c1	807431311	DCDAMFYDIBOXEV-CYBMUJFWSA-N	425.287	1.928	50	20	IDGD	
CC(=O)N1C[C@H]2[C@@H](NC(=O)NNC(=O)c3nn(-c4ccccc4)cc3O)CCC[C@H]2C1	808357713	NDUIYYQZQPBYHS-UAGQMJEPSA-N	426.477	1.169	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2cnnc(-c3ccccc3)c2)ccc1Cl	809982858	RDPWJUHKPACYDE-UHFFFAOYSA-N	431.861	1.519	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(-n3ccc(C(F)(F)F)n3)cc2)n1	810408497	INUAKXZDQQFYHB-UHFFFAOYSA-N	432.362	1.994	50	20	IDGD	
COC(=O)c1cn(-c2cccc(NC(=O)C(=O)NNC(=O)Nc3ccccc3C)c2)nn1	812984369	ZAQPEYGGNWUPQS-UHFFFAOYSA-N	437.416	1.154	50	20	IDGD	
CCOC(=O)Cc1csc(NC(=O)NNc2ccccc2S(=O)(=O)N(C)C)n1	813837310	IEJQVNWJIYIIGM-UHFFFAOYSA-N	427.508	1.648	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCc2cccc(N3CCOCC3)c2)cc(OC)c1OC	814359025	XCPQCHNHGWNBGY-UHFFFAOYSA-N	444.488	1.693	50	20	IDGD	
NS(=O)(=O)c1ccc(NC(=O)NN=Cc2cnc3ccc(Br)cn23)cc1	814970338	YUHWGWZPXPCAGJ-UHFFFAOYSA-N	437.279	1.900	50	20	IDGD	
Cc1ccc(Oc2ccccc2NC(=O)C(=O)NNC(=O)[C@H]2CCc3nncn3C2)cc1	815692175	LHPHEGLNQYIZEW-HNNXBMFYSA-N	434.456	1.727	50	20	IDGD	
Cc1cc(N2CCCCCC2)ccc1NC(=O)C(=O)NNC(=O)[C@@H]1CCc2nncn2C1	815692562	UXBCMODTSHRVLI-MRXNPFEDSA-N	439.520	1.315	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1cc2c(cc1F)NC(=O)CC2	815751881	SFBVQBRTYQSZKK-UHFFFAOYSA-N	449.464	1.043	50	20	IDGD	
COc1cc(Cl)c(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)N(C)C)cc1C	815752203	IMKXPUCQUPTITB-UHFFFAOYSA-N	440.909	1.989	50	20	IDGD	
C=C1c2ccccc2C(=O)N1[C@@H](C)C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	821708458	POXUSWVEIKNAGQ-IBGZPJMESA-N	447.539	1.861	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2cc(-c3cccs3)on2)ccc1Cl	822203609	CJMNUUZLSBANRJ-UHFFFAOYSA-N	426.863	1.779	50	20	IDGD	
O=C(CNc1ccccc1)NNC(=O)c1ccc(S(=O)(=O)NC[C@H]2CCCO2)cc1	823328328	GYCLCFYJFQWJIU-QGZVFWFLSA-N	432.502	1.017	50	20	IDGD	
COCCNC(=O)C1CCN(C(=O)NNC(=O)c2ccc(COc3ccccc3)o2)CC1	889344109	QBNQPPNUZSOXOI-UHFFFAOYSA-N	444.488	1.688	50	20	IDGD	
Cc1ccccc1C(=O)N[C@H](CC(C)C)C(=O)NNC(=O)CCN1C[C@H](C)O[C@@H](C)C1	912921637	QETHACLLXYPIQM-CMKODMSKSA-N	432.565	1.786	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)c2ccc(S(=O)(=O)NCc3ccco3)cc2)cc1	913431296	CKVYWHHSQXJYRY-UHFFFAOYSA-N	442.497	1.940	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)NCCCN1C(=O)NC2(CCCC2)C1=O	913635775	FULXWCHOITZFGK-UHFFFAOYSA-N	437.884	1.547	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(N2C[C@H](C(=O)O)CC2=O)cc1)c1cccc(Cl)c1	914746597	OEKULTPHRAQPJY-GFCCVEGCSA-N	437.861	1.401	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NC[C@@H](c2cccs2)N2CCN(C)CC2)cc1OC	915901308	HCDCYZSYXDXASC-INIZCTEOSA-N	447.561	1.698	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2ccccc2N(C)C(=O)C2CC2)c2ccccc2c1=O	916123138	KQWIKWPIDWRKSS-UHFFFAOYSA-N	433.468	1.864	50	20	IDGD	
COc1cccc(NCC(=O)NN=C(C)c2ccc(OCC(=O)N3CCOCC3)cc2)c1	916359465	CKXWZIOSJBTGCK-UHFFFAOYSA-N	440.500	1.885	50	20	IDGD	
CCOc1cccc(CNC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)c1	916392422	VYMLJWYKAJZMMN-UHFFFAOYSA-N	448.549	1.243	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)c1nn(-c2ccccc2)cc1O)S(=O)(=O)c1ccc(F)cc1	918300413	KVMJOIMPXAVZIQ-LBPRGKRZSA-N	432.433	1.340	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N=c3cc[nH]cc3)cc2)c(O)c1	918339516	POMBYJCKIKGBNE-UHFFFAOYSA-N	426.454	1.393	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2nnc(C3CC3)s2)c1	918542064	RWOKNGUTQDOXJY-UHFFFAOYSA-N	438.535	1.913	50	20	IDGD	
CCNC(=O)COc1ccc(CNC(=O)/C(C#N)=C\c2cc(C#N)n(C)c2C)cc1OC	918586825	LFDKFOPBVBCEDH-NVMNQCDNSA-N	435.484	1.952	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)CNS(=O)(=O)c3c[nH]c4ncccc34)cc2C1	918758801	AUATUJRMCPPFIU-NSHDSACASA-N	447.542	1.489	50	20	IDGD	
Cc1cc(Br)oc1C(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	919380083	WPGTZHPDPFZSPC-UHFFFAOYSA-N	426.179	1.877	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)[C@H](C)NS(=O)(=O)c1ccc(Cl)cc1	919820357	XFDNHWLTQXLVSW-LBPRGKRZSA-N	425.894	1.406	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)C2CCN(Cc3ccccc3)CC2)c1	919962781	UDVUXTXFOMSCNX-UHFFFAOYSA-N	444.557	1.610	50	20	IDGD	
O=C(NCCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1)NNC(=O)c1cccc(Cl)c1	920050831	IECPWPOJYDAKFZ-UHFFFAOYSA-N	441.853	1.171	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)c1cc([N+](=O)[O-])cc(S(C)(=O)=O)c1	920287767	KGKZQEYXVILVSI-SNVBAGLBSA-N	425.394	1.366	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN2CCC[C@H](c3n[nH]cc3NC(C)=O)C2)cc1C	1116512096	UMPYGCPVVHSKPX-AWEZNQCLSA-N	432.550	1.941	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2cccc3ccccc23)cc1	1117635477	BIAYPOXSELAUJI-UHFFFAOYSA-N	427.482	1.978	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@@H]2CCCCN2Cc2cccnc2)cc1	1256692500	QLYUTMALZCGTQS-SFHVURJKSA-N	431.518	1.693	50	20	IDGD	
CC(C)NC(=S)NNC(=O)CNC(=O)[C@@H]1c2ccccc2C(=O)N1Cc1ccccc1	1318160149	GYMQINYMSCGQGW-IBGZPJMESA-N	439.541	1.404	50	20	IDGD	
CC(C)n1nc(C(=O)NNS(=O)(=O)c2c[nH]c(C(F)(F)F)c2)c2ccccc2c1=O	1321102817	AEZMZBUHMHLXQF-UHFFFAOYSA-N	443.407	1.948	50	20	IDGD	
COc1ccc(CCC(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)c(F)c1	1778289312	YAHKFACUXYVQSS-PXNSSMCTSA-N	428.888	1.197	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3n[nH]c4cc(Cl)ccc34)C2)C1	1778666973	MNPQPFJLGVYACN-LIRRHRJNSA-N	441.315	1.914	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@]2(CN(C(=O)/C=C/C(=O)NCc3ccco3)CCO2)C1	1779298019	FAWXLPKDRSNTGV-BXKJMJEDSA-N	449.580	1.133	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)c(OC)c1	1780535945	WYKWMMSAAAOKHI-CRAIPNDOSA-N	445.285	1.838	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(O)c([N+](=O)[O-])c3)CCO2)C1	1781235347	YBWVBDNUOMEADF-ZWKOTPCHSA-N	446.287	1.980	50	20	IDGD	
CN1CCc2cc(C(=O)N3CCO[C@@]4(CCN(C(=O)[C@@H](F)Br)C4)C3)ccc21	1781330157	ROEDQMJZAIHOLD-VQIMIIECSA-N	440.313	1.813	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cccc(F)c3[N+](=O)[O-])C2)C1	1781773022	YAJZZAMRUSYGRB-GTNSWQLSSA-N	444.257	1.961	50	20	IDGD	
CCC[C@H](NC(C)=O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)Br)C1	1782001239	CBCTVFCIVFJMMH-HWLIBYHHSA-N	446.386	1.589	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)nc2nccn12	1782354341	JEHSRCJIFDSMGA-MOPGFXCFSA-N	440.331	1.718	50	20	IDGD	
C[C@@H](C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)CBr)C2)n1cccn1	1782555035	SCEBZQUQLYJFDM-YIOZNXECSA-N	441.370	1.989	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H]1CCCO1)CCO2	1782864359	LINKCCBSSGJOOD-BYCJELGNSA-N	431.439	1.881	50	20	IDGD	
C[C@H]1Oc2ccc(C(=O)N3CCO[C@@]4(CCN(C(=O)C(Cl)Cl)C4)C3)cc2NC1=O	1783948280	HRBSCPKPFNURDG-NSPYISDASA-N	442.299	1.653	50	20	IDGD	
CCn1nc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]3C2)cc1C	1783970563	WMDKQCJNFBNSJP-QEWYBTABSA-N	441.370	1.836	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)Cc3ccc(C)o3)C2)C1	1784660994	QPXZXZXEWYBSLO-OLCUMFGGSA-N	441.488	1.094	50	20	IDGD	
CN1Cc2ccccc2C[C@H]1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21	1785024407	KIYQMSIQYXOMOU-XSLAGTTESA-N	440.371	1.827	50	20	IDGD	
Cc1cccc(C(=O)N2CC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c1Cl	1785034467	SFYQPAHZRCIQQA-OAQYLSRUSA-N	436.940	1.465	50	20	IDGD	
Cn1cc(CCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]32)cn1	1787012365	UMIBQEXPUBJBMV-IUVQAAGXSA-N	431.364	1.569	50	20	IDGD	
CC[C@@H](NC(C)=O)C(=O)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1	1788140036	BPAYVNLPYFMSIE-HXUWFJFHSA-N	437.305	1.029	50	20	IDGD	
Cc1cnc(C(=O)NC2(c3ccc(NC(=O)c4ccc(B(O)O)cc4)cc3)CCC2)cn1	1788140268	QSMZQYXEFNLNSO-UHFFFAOYSA-N	430.273	1.526	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)N3C[C@@H]4C[C@H]4C3)[C@H]2C1	1788507415	VVFJTUMCKVZANU-YBPYCPRNSA-N	442.398	1.337	50	20	IDGD	
O=C(C[C@H]1CNc2ccccc2O1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Cl)C[C@@H]21	1788552037	OEPCXWHGXYZBRU-DPSXKDBOSA-N	425.888	1.764	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(O)c([N+](=O)[O-])c3)[C@H]2C1	1790023088	IIMNQWRXKFBCGE-WSMBLCCSSA-N	425.869	1.911	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)c1c(O)cc(O)cc1O	1790156759	YOYHPGCRZPSXCT-BOCCBSBMSA-N	447.257	1.087	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)C(Cl)Cl)C[C@@H]32)cc1O	1790304853	MWHBJAUIKYSUHV-XEZPLFJOSA-N	444.315	1.748	50	20	IDGD	
C[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21)[S@@](=O)c1ccccc1	1790595336	HSUBNWKHXVGRNW-PPHQJTDHSA-N	430.929	1.697	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CNC(=O)OC(C)(C)C)C[C@@H]21	1791063392	HFIXZMABJJWIBR-RFGFWPKPSA-N	448.358	1.274	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)NNc3ccccc3)C[C@@H]21	1791250273	CLKOKRQXGHHTDE-FQQAFBJJSA-N	438.956	1.225	50	20	IDGD	
C[C@H](NC(=O)c1ccccc1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21	1792251002	SYZLDFHNVVTVCP-TUUVXOQKSA-N	442.343	1.588	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(-c3cccs3)on1)C2)[C@H](O)CCl	1792980773	MYLHQQBGPCOCSI-DDFXLWFNSA-N	425.894	1.206	50	20	IDGD	
Cc1cncc(CCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)c1	1794346286	PPUPDIOWZCGXJS-BCDXTJNWSA-N	436.516	1.273	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(C(=O)O)n(C(C)C)n1	1794434660	ATVOAZJUWFGJGE-OQMKEHIESA-N	426.901	1.383	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](F)Br)C3)n1	1794577798	YGRGYDAEHZEMLA-OXIQGZBJSA-N	427.274	1.982	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cn1cc(Cl)cn1	1796209546	XGYCWXVOKZAEIQ-XMOXNHLCSA-N	445.911	1.309	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(Cl)nc2n[nH]cc12	1796521190	ZLINPJWQGDEISF-CLLJXQQHSA-N	447.927	1.236	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc([N+](=O)[O-])o1)C2	1796889904	ZQIUWWXHEOZWMU-ONMDDFKGSA-N	442.432	1.574	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccnc(F)c1)C2	1796890617	AVRMGYVFEVYUHT-TWXBYECESA-N	426.452	1.607	50	20	IDGD	
C[C@@H]1CCc2c(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@H](F)Br)C4)n[nH]c21	1796972541	ZMYCACHWJOHSLJ-PVUIZZSESA-N	429.290	1.353	50	20	IDGD	
COc1nc(C)ccc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@](C)(Cl)CCl)C2	1798249780	TUVUTXVOFCMNKG-QPWUGHHJSA-N	430.332	1.838	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCCc1cccnc1)C2	1798443504	DAHWQMQFNDROOS-BCDXTJNWSA-N	436.516	1.355	50	20	IDGD	
Cc1c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](C)Br)C3)cn2[nH]cnc(=O)c12	1799153620	GJTHGTPAPVWUKC-RVMXOQNASA-N	436.310	1.366	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)CNC(=O)OC(C)(C)C)C2	1799265099	ZNVMKBBDJWNCMV-IBEHDNSVSA-N	431.961	1.754	50	20	IDGD	
CCOc1ccc(Cl)cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2	1799615272	BIXJLMCFVALZFG-RBNVPPIJSA-N	431.316	1.542	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)c(O)c(Cl)c1	1799769490	QRTFRUKIBJQDOS-FVCICTRLSA-N	442.972	1.806	50	20	IDGD	
Cc1cccn2ncc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)CO[Si](C)(C)C)C4)c12	1800107544	SVWSWKXDNWMWRP-HGKCTWBKSA-N	430.581	1.697	50	20	IDGD	
COc1cc(Cl)ccc1CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2	1800353026	JZCCOCOEXWMMOW-ZFHGCVPZSA-N	431.316	1.080	50	20	IDGD	
COc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)Br)c(O)c1	1800760581	USVVCXDZQNZPHB-OVZMXSCWSA-N	427.295	1.387	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(CO)c(F)c1)C2	1800764270	ZLAVYKAOHZGCMM-BWPSIRRCSA-N	429.286	1.305	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1scnc1C(F)(F)F)C2	1800975684	RFEJUGBOIZUHBH-LMLFDSFASA-N	441.859	1.619	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C=C/c1ccccc1[N+](=O)[O-]	1802109543	KCYODFDZEJJFQS-VZKXDKJQSA-N	437.880	1.451	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)c2cc(O)ncn2)[C@H]1c1cccnc1	1803741506	ICVXXFCRSLWNEP-NORZTCDRSA-N	434.294	1.680	50	20	IDGD	
O=C(CCBr)NC[C@H]1CCN(C(=O)c2cccc(=O)n2O)[C@H]1c1cccnc1	1806340016	XNBMNVPDGGSHLY-KDOFPFPSSA-N	449.305	1.585	50	20	IDGD	
CC(=O)N/C(C)=C/C(=O)N1CC[C@@H](CNC(=O)CCBr)[C@H]1c1cccnc1	1806346519	JXKBAXZVQMIHPC-XJJOCEFXSA-N	437.338	1.912	50	20	IDGD	
Cc1cscc1C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1807373857	CSQAYVJYEMFZCI-WIYYLYMNSA-N	449.341	1.765	50	20	IDGD	
Cc1nc(C)c(C(=O)N2CCCC3(CCN(C(=O)CCC(=O)NN(C)C)CC3)C2)s1	1808240169	OHWULWDGQHAIRD-UHFFFAOYSA-N	435.594	1.978	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)c1ccc2nonc2c1	1809126443	DMUBUCICFYGHGT-WBAXXEDZSA-N	429.864	1.537	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@@H](CNC(=O)CCc2nc(N)n[nH]2)[C@@H]1c1cccnc1	1810145897	DUJDLJUUFNONDW-YOEHRIQHSA-N	433.944	1.686	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)c2cc(=O)ccn2C)[C@H]1c1cccnc1	1811368075	YDDFGIWSOGCJOD-DHSIGJKJSA-N	447.333	1.883	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1cccc(F)c1	1811800834	PZWVTZRSIPJGPC-DENIHFKCSA-N	447.275	1.534	50	20	IDGD	
C=CCOCCCC(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1813069541	ZRDPRNLDIMOVLB-WMZHIEFXSA-N	445.564	1.443	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)[C@H]2CC=CCC2)[C@@H]1c1cccnc1	1813073109	MJXGRSSFJUYNMK-LQBOVUBWSA-N	427.549	1.817	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)Cc2cnn(C)c2)[C@@H]1c1cccnc1	1813459987	OUYNIDHHDGUYOR-XCRHUMRWSA-N	434.338	1.847	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)CN3CCOCC3)sc2C1	1814572314	KMDYSRZRYRUIRI-NWDGAFQWSA-N	445.383	1.561	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(C3CC3)on2)n[nH]1	1814628628	LLYZNTOVXVFCBA-MRXNPFEDSA-N	443.508	1.954	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccnc2C(N)=O)n[nH]1	1816077163	JSYSZIJLWCITFA-ZWNOBZJWSA-N	449.309	1.993	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](C)Br)CC2	1817023495	DZFBNTYILSLQIE-YIZRAAEISA-N	432.344	1.285	50	20	IDGD	
CO/C=C(\C)C(=O)N[C@@H]1CCc2nc(NC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)sc2C1	1817281965	UMULKEDZEJWNMH-QHGBOQLOSA-N	444.517	1.739	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)/C=C/c2cccnc2)[nH]n1)c1ccc(B(O)O)cc1	1817470415	AZUOFCNLSVRJTB-HSSRVXSRSA-N	445.288	1.504	50	20	IDGD	
Cc1ncccc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1	1817471382	XLNLRRLOMFDEEU-IBGZPJMESA-N	433.277	1.413	50	20	IDGD	
CC(C)(C)OCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1	1817474119	MOWCKDHKKPJTRQ-QGZVFWFLSA-N	428.298	1.211	50	20	IDGD	
CNC(=S)NCCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCBr)[nH]n1	1819406020	DRQUZTPLRZIXTH-LBPRGKRZSA-N	445.387	1.671	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2c[nH]c(=O)cn2)n[nH]1	1820242053	IPHBJOXDXWVQIT-MFKMUULPSA-N	437.298	1.830	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H]2CNC(=O)C2)[nH]n1	1822090680	NDXVWIRFROLMEN-MDZLAQPJSA-N	426.315	1.711	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H]2CCCCN2C)CC1	1824201082	MOYPZEVYVHSWBW-VQTJNVASSA-N	435.613	1.463	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(F)cc1)CC2	1826088326	DJSIAQMOZYLPLR-AWEZNQCLSA-N	433.509	1.881	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CNCP(=O)(O)O)CC1	1826801183	ZOZRWEIGDODLSS-HNNXBMFYSA-N	437.905	1.596	50	20	IDGD	
Cn1cccc1C(=O)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](F)Br)CC2	1827001704	UTQKWXPDLDIEQR-ISVAXAHUSA-N	443.298	1.967	50	20	IDGD	
O=C(CCOc1ccc(F)cc1)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1830255712	KLTSRPCHMMRBRH-IBGZPJMESA-N	449.306	1.855	50	20	IDGD	
Nc1n[nH]c(CCC(=O)N2CCC([C@H]3CCCCN3C(=O)[C@@H](F)Br)CC2)n1	1830383016	VCJMZIRIEQWESW-IUODEOHRSA-N	445.337	1.630	50	20	IDGD	
Cc1[nH]ccc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2	1830538362	DAUMJWANWNJZOL-UGSOOPFHSA-N	428.327	1.424	50	20	IDGD	
Cc1cccc(Cl)c1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1830733005	CTSCJPPYZRWPQK-BEFAXECRSA-N	431.316	1.318	50	20	IDGD	
Cc1cc(C)c(OCC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)c(C)c1	1831168888	QDJWNLABDLPPKR-CTNGQTDRSA-N	442.915	1.981	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(O)c(OC)c3)C2)C1	1831654041	HWNHUSIFKPTRRH-IIBYNOLFSA-N	440.924	1.878	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)Cc2cnccn2)CC1	1831871878	WKBLUOYAUGDVTA-IBGZPJMESA-N	430.553	1.012	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3ccn4nccc4c3)CC2)CC1)[C@H](O)CCl	1833310134	KHGMALVYBZAIDR-LJQANCHMSA-N	433.940	1.119	50	20	IDGD	
CCN(CC)C[C@@H](C)C(=O)N1CCOC[C@@]2(CN(C(=O)CCBr)CCO2)C1	1834825349	XTDXEMCDYUBMPO-VQIMIIECSA-N	448.402	1.206	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)CC3CCOCC3)CCO2)C1	1835422709	ACRKSHZXKNGPRF-RTBURBONSA-N	437.364	1.496	50	20	IDGD	
Cc1cc(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](C)CBr)CC3)CC2)n[nH]1	1836145990	XCEUELZNHRDXIH-ZDUSSCGKSA-N	440.386	1.934	50	20	IDGD	
O=C(/C=N/O[C@@H]1CCCCO1)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836716965	BAGSSQJWPWTHRO-FWVVFLIFSA-N	445.944	1.114	50	20	IDGD	
Cn1nc2c(c1C(=O)N1CCC(OC3CCN(C(=O)[C@H](O)CCl)CC3)CC1)CCC2	1836719535	WANRHHASQSVDIR-GOSISDBHSA-N	438.956	1.121	50	20	IDGD	
O=C(CCBr)N1CCC(OC2CCN(C(=O)c3ccc[n+]([O-])c3)CC2)CC1	1837240213	RARFRFPNEVJCGT-UHFFFAOYSA-N	440.338	1.717	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCC(OC2CCN(C(=O)c3c[nH]c(=O)cn3)CC2)CC1	1838538890	QCNMVSYRIVCUIA-LJQANCHMSA-N	445.347	1.618	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(OC)cc(OC)c3)CCO2)C1	1838934599	ZPVPOOCUDYIHIK-NQIIRXRSSA-N	440.924	1.791	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3ccc[nH]3)C2)C1	1839152368	XFVOFJNSPSDQNT-RBUKOAKNSA-N	432.348	1.640	50	20	IDGD	
CCc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)n[nH]1	1839152427	YYDPQYXQHBNKEY-QZTJIDSGSA-N	433.336	1.278	50	20	IDGD	
O=C([C@@H](F)Br)N1CCO[C@@]2(COCCN(C(=O)C3(C(F)(F)F)CC3)C2)C1	1839200595	KUKLNSJVKCJIFK-MFKMUULPSA-N	447.223	1.476	50	20	IDGD	
Cc1cccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)c1	1839202033	RNIKEVSPOUNZJK-YJBOKZPZSA-N	429.286	1.756	50	20	IDGD	
Cc1ccncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)Br)CCO2	1840032791	KFXQYYUSZUTCHO-KBXCAEBGSA-N	426.311	1.243	50	20	IDGD	
CCc1cnc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)s1	1840033487	HHNBAQSALRZORB-PXAZEXFGSA-N	446.367	1.559	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(O)c(F)c3)C2)C1	1840035398	PXMVHJXYDZGFMD-XIKOKIGWSA-N	445.285	1.385	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccc(F)c(F)c3)C2)C1	1840151457	BZFRZYFOQZTIKZ-FOIQADDNSA-N	446.878	1.218	50	20	IDGD	
COC(=O)c1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)c(C)c1	1840787171	SGKNPSIRRVAKEX-UZLBHIALSA-N	442.871	1.386	50	20	IDGD	
O=C(c1cnn2c(-c3ccsc3)ccnc12)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1	1841350671	QWJIOZIIZRUYQJ-INIZCTEOSA-N	445.932	1.875	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC2(CCCN2C(=O)C(C)(C)n2nc(C)ccc2=O)C1	1844354610	BXPDPBHOJBQCIY-CQSZACIVSA-N	439.354	1.664	50	20	IDGD	
O=C(c1cccc(N2CCOCC2)n1)N1CC2(CCCN2C(=O)[C@H](F)Br)C1	1845217769	ULIWKEPRNKBGOC-HNNXBMFYSA-N	441.301	1.426	50	20	IDGD	
COc1ccc(OC)c(S(=O)(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)c1	16148436	YMYZUNCEFRHAMY-UHFFFAOYSA-N	426.447	1.353	50	20	IDGD	
Cc1c(C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)nnn1-c1cccc([N+](=O)[O-])c1	24359228	CWHSRVKYLJSQKH-GFCCVEGCSA-N	428.380	1.852	50	20	IDGD	
CC(C)[C@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	727113499	JCAQEXUFXADGBA-HNNXBMFYSA-N	442.538	1.247	50	20	IDGD	
C#Cc1cccc(NC(=S)NNC(=O)CN2C(=O)N[C@]3(CCc4ccccc43)C2=O)c1	727497762	LZKJROBTWHJKRH-QFIPXVFZSA-N	433.493	1.379	50	20	IDGD	
CN(C)N(C(=O)CCNC(=O)NC12CC3CC(CC(C3)C1)C2)[C@@H]1CCS(=O)(=O)C1	728179566	MDICXJDAHPVKJO-VQBCORBOSA-N	426.583	1.137	50	20	IDGD	
C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)cc2[N+](=O)[O-])C1	728369895	WBPFIUUBACUVRE-UMVBOHGHSA-N	438.506	1.273	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)CN(C)c2ncnc3[nH]cnc23)c1	728527529	MSTHXYZJVPFARH-UHFFFAOYSA-N	434.254	1.021	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2cnn(-c3ccccc3C)c2C)n1	728723406	PYZINXMTNOHHHT-UHFFFAOYSA-N	427.486	1.801	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(F)cc2)C1	730033999	KKPPGAJPCUZYQK-INIZCTEOSA-N	449.504	1.712	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)c1cc(S(=O)(=O)N2CCC[C@@H](C)C2)cn1C	731491873	ZJZRJCUUCRBONY-CQSZACIVSA-N	434.518	1.529	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)CCNC(=O)N1CCc2ccccc2C1	731865244	LUUQELLZZNRCAD-OAHLLOKOSA-N	428.464	1.898	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)c1ccccc1C(=O)c1ccc(N(C)C)c([N+](=O)[O-])c1	731878540	DJLVLWKEYUAJHK-UHFFFAOYSA-N	436.428	1.998	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN1S(=O)(=O)c1cccc([N+](=O)[O-])c1)NC1CCCC1	732957962	CQESDWCUHFMDCZ-HNNXBMFYSA-N	425.467	1.021	50	20	IDGD	
Cc1cc(NNC(=O)c2ccccc2NS(=O)(=O)c2ccc3nc(O)[nH]c3c2)ncn1	734256774	XYQULACIVWKWDU-UHFFFAOYSA-N	439.457	1.925	50	20	IDGD	
COc1ccc(CN2CC[C@@H](NC(=O)NNC(=O)COc3ccccc3C#N)C2=O)cc1	734682452	AHZGLAXZLPVRBP-GOSISDBHSA-N	437.456	1.077	50	20	IDGD	
COc1ccc(S(=O)(=O)C[C@H](C)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)cc1	735124181	SBOBZJSIMBMLBG-AWEZNQCLSA-N	442.497	1.956	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)[C@@H](C)N2CCc3ccccc3C2)cc1OC	735958713	KHPBVKYSWHEEEK-OAHLLOKOSA-N	441.484	1.455	50	20	IDGD	
COC(=O)c1cc(Br)cc(S(=O)(=O)NNC(=O)Cc2cccnc2)c1	736063802	WFUMYGHXIFUQEP-UHFFFAOYSA-N	428.264	1.183	50	20	IDGD	
COc1ccc(SCCC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1OC	740813388	GIZAZGMUZCWOIH-UHFFFAOYSA-N	442.497	1.894	50	20	IDGD	
C#Cc1cccc(NC(=S)NNC(=O)CCS(=O)(=O)c2ccc(OC)c(OC)c2)c1	740942799	APPLPKQLMXOQQW-UHFFFAOYSA-N	447.538	1.867	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)[C@H]1CCCN(C(=O)COc2ccccc2)C1	741182189	CTHOEZFOZJLSKC-SFHVURJKSA-N	425.485	1.703	50	20	IDGD	
Cc1cccc([C@H](C)CNC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)c1	741427195	XPSMKCIAHMEVAU-QGZVFWFLSA-N	446.577	1.756	50	20	IDGD	
O=C(CCSc1ccc(F)cc1)NNC(=O)c1ccc(C[C@H]2CC(=O)NC2=O)cc1	743290625	ILRFLMGNSYUUKD-HNNXBMFYSA-N	429.473	1.974	50	20	IDGD	
NC(=O)[C@H](NNC(=O)COc1ccccc1[N+](=O)[O-])c1ccc(Br)cc1F	743461292	GRWLTXVGDIHVTO-OAHLLOKOSA-N	441.213	1.723	50	20	IDGD	
COC[C@@H]1CN(C(=O)NNC(=O)[C@H]2Cc3ccccc3CN2Cc2ccccc2)CCO1	743573804	IUCWWBUBPKIDQA-FCHUYYIVSA-N	438.528	1.702	50	20	IDGD	
Cc1cccc(-n2cc(C(=O)NNc3ccccc3S(=O)(=O)N3CCOCC3)nn2)c1	744621499	ZCVBYJZXLPNFII-UHFFFAOYSA-N	442.501	1.354	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1csc(N2CCOCC2)n1)c1cccc(-n2cccn2)c1	745933071	PZCICDBACNANLH-CQSZACIVSA-N	441.517	1.871	50	20	IDGD	
C[C@@H](CS(C)(=O)=O)C(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1	746840996	BVLOXGCCXGQTDC-OXJNMPFZSA-N	429.542	1.442	50	20	IDGD	
C[C@@H]1CC(C)(C)C[C@@]2(C1)NC(=O)N(CC(=O)NNC(=O)CCOc1ccccc1)C2=O	747181009	CKVGFZVSFIJADM-IVZQSRNASA-N	430.505	1.740	50	20	IDGD	
N#CCCCS(=O)(=O)c1ccc(C(=O)OCC(=O)NNC(=O)c2cccs2)cc1	748408112	IRWDODRXFDZOMR-UHFFFAOYSA-N	435.483	1.444	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)NCCCN2CCN(c3ccncc3)CC2)c1	748465654	PYHSQUJQBZGQIX-UHFFFAOYSA-N	440.548	1.620	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)NCc1ccc(Cn2cnc3ccccc32)cc1	748625453	RRNSWZMXNLEHJD-INIZCTEOSA-N	425.489	1.967	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)NCc1cccc(Cn2cnc3ccccc32)c1	748629120	ZPGNSCHCVYNKOA-INIZCTEOSA-N	425.489	1.967	50	20	IDGD	
CC[S@](=O)[C@H]1CCC[C@@H](NC(=O)NNC(=O)c2csc(N3CCOCC3)n2)C1	750265231	AHLUFHGODXLSAU-ZBYRNGAHSA-N	429.568	1.004	50	20	IDGD	
C[C@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)N1CCSCC1	750828266	RULGTBJWTGJRSM-OAHLLOKOSA-N	440.591	1.060	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)n[nH]2)cc1OC	751300213	URYCZFFOGQIGIN-UHFFFAOYSA-N	434.416	1.144	50	20	IDGD	
COc1cc2ncn(CCCC(=O)NNC(=S)N[C@H](C)C3CC3)c(=O)c2cc1OC	751620953	MNYVOGLRNFUPRU-GFCCVEGCSA-N	433.534	1.488	50	20	IDGD	
CC[C@H](CS(=O)(=O)c1ccccc1)NC(=O)NNC(=O)c1c(C)nc2ccccn12	752127246	NFKQQCUMKAZTLL-OAHLLOKOSA-N	429.502	1.839	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)CC[C@@H](C)CC(=O)NNC(=O)c1ncccc1C	752236894	LUVBSPYQPNPJEC-CYBMUJFWSA-N	426.477	1.122	50	20	IDGD	
O=C(NNC(=O)C(=O)N1CCCC1)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	753259245	ALOYZQUQOHNUKT-UHFFFAOYSA-N	442.347	1.911	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc2ccccc2o1)c1ccc(S(=O)(=O)N2CCCC2)cc1	753981729	PXMJBIZYNOJNBN-UHFFFAOYSA-N	449.510	1.841	50	20	IDGD	
N#C/C(=C\c1ccc(O)cc1)C(=O)OCC(=O)N(C[C@@H]1CCCO1)[C@H]1CCS(=O)(=O)C1	754536549	KLYWZULWJBZRGX-NROPBOCCSA-N	448.497	1.037	50	20	IDGD	
C[C@@H](c1ccc(NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1)N1CCOCC1	756507132	BXOXBYYRADKCIB-HNNXBMFYSA-N	436.476	1.522	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2cccc(N3CCCNC3=O)c2)c2ccccc2c1=O	756792884	OMNZNHYIEMIBTR-UHFFFAOYSA-N	449.471	1.803	50	20	IDGD	
CNS(=O)(=O)c1cccc(NC(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)c1C	757726017	GRXCKGGXUQWWAL-UHFFFAOYSA-N	446.464	1.899	50	20	IDGD	
COCc1nc2n(n1)C[C@H](NC(=O)NNC(=O)c1cc(F)ccc1Br)CC2	757787680	VHIHBCIQUBAZBP-SNVBAGLBSA-N	441.261	1.285	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2cnc(OCc3ccccc3)cn2)cc1	757965272	CQTONBLLKHWNQK-UHFFFAOYSA-N	441.469	1.926	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cnn(CCO[C@H]3CCCCO3)c2C)cc1OC	758052300	BJMPNYJMNUSORG-IBGZPJMESA-N	432.477	1.827	50	20	IDGD	
CCn1cc(C(=O)C(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)cn1	758188957	AKIRDBDMZVWGJL-UHFFFAOYSA-N	444.455	1.249	50	20	IDGD	
O=C(c1cc(Cl)c2c(c1)OCCO2)N1CCN(S(=O)(=O)CBr)CC1	758522157	FHCUIMNLOMKQKR-UHFFFAOYSA-N	439.715	1.551	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1cccc([C@H]2CCOC2)c1	761486571	BWYUMXIRMFLRIY-NRFANRHFSA-N	436.512	1.410	50	20	IDGD	
CC(=NNC(=O)[C@H](C)CN1C[C@H](C)O[C@@H](C)C1)c1c(C)nn(CCS(C)(=O)=O)c1C	763155209	IWJCDFAADNOWGF-ILXRZTDVSA-N	441.598	1.130	50	20	IDGD	
N#C/C(=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)OCC1(CO)COC1	763606994	NBQJYMYYRPLUII-VIZOYTHASA-N	444.875	1.538	50	20	IDGD	
C#CCOc1ccc(NC(=O)C(=O)NNC(=O)COc2cccc(C(F)(F)F)c2)cc1	763639364	MKBUPDGLFHVPDW-UHFFFAOYSA-N	435.358	1.882	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(N3CCCC3=O)c(F)c2)cc1	763660426	CVEWJZITBAZWMB-UHFFFAOYSA-N	444.419	1.126	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(C(=O)NCC(C)C)cc2)cc1C	763667029	OFUHFRSZQUEPTQ-UHFFFAOYSA-N	440.500	1.854	50	20	IDGD	
CCOC(=O)/C=C/c1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)cc1	763680744	GIQZZKMVEPPIIG-KPKJPENVSA-N	436.424	1.299	50	20	IDGD	
CCSc1cccc(NC(=O)C(=O)NNC(=O)c2nn(CC)c(=O)c3ccccc23)c1	763785124	FXHCPRVXVFTHLD-UHFFFAOYSA-N	439.497	1.928	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)C(=O)Nc1cnn(-c2ccccc2)c1	763944762	PITVUFMTUXUDAL-UHFFFAOYSA-N	431.412	1.163	50	20	IDGD	
O=C(NNC(=O)c1ccc[nH]1)C(=O)Nc1ccc(-c2csc(N3CCOCC3)n2)cc1	763978747	BXIVXKQLVYLNRY-UHFFFAOYSA-N	440.485	1.375	50	20	IDGD	
CC(C)(C)n1cc(C#N)c(NC(=O)C(=O)NNC(=O)c2cccc(Br)c2)n1	764062952	HKPZPJDRGQSFNP-UHFFFAOYSA-N	433.266	1.672	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(NC(=O)OC)c2)o1	764138862	KWAJWJIMGKXKIZ-UHFFFAOYSA-N	431.449	1.699	50	20	IDGD	
Cc1cc(-c2nc3cc(F)ccc3n2C)ccc1NC(=O)C(=O)NNC(=O)CN(C)C	764204268	PVVBSIYUGAREKZ-UHFFFAOYSA-N	426.452	1.335	50	20	IDGD	
Cn1ccnc1C(=O)c1ccc(NC(=O)C(=O)NNC(=O)C(C)(C)c2ccccc2)cc1	764302172	KPQDOSROVNEERB-UHFFFAOYSA-N	433.468	1.715	50	20	IDGD	
CC(C)(C(=O)NNC(=O)C(=O)Nc1cnn(-c2cnc3ccccc3n2)c1)c1ccccc1	764309993	YAIXEBDYDQWQFM-UHFFFAOYSA-N	443.467	1.879	50	20	IDGD	
CNC(=O)Cn1ccc2ccc(NC(=O)C(=O)NNC(=O)CCCc3cccs3)cc21	764342109	VAEWQPRZAGKCJV-UHFFFAOYSA-N	441.513	1.558	50	20	IDGD	
CNC(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c1	764342736	IZIGQLCYEUKOLN-UHFFFAOYSA-N	440.847	1.285	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)nn1-c1ccccc1	764352059	YOQVEWXQOBZGGN-UHFFFAOYSA-N	429.440	1.766	50	20	IDGD	
CCN(Cc1cccc(NC(=O)C(=O)NNC(=O)c2cnn(C)c2)c1)C(=O)OC(C)(C)C	764362611	FVSFPTHXODTJRH-UHFFFAOYSA-N	444.492	1.577	50	20	IDGD	
C[S@@](=O)c1ccc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)cc1F	764401132	LHKGHIRSXMKOEP-MUUNZHRXSA-N	425.463	1.147	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1F)C(=O)Nc1ccc(S(=O)(=O)C(F)F)cc1	764411105	QTXIKZYGTNPSPR-UHFFFAOYSA-N	449.794	1.875	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C[C@@H]1CN(C(=O)OC(C)(C)C)CCO1	764554776	WYLLRAQPEQBSGK-UONOGXRCSA-N	425.457	1.766	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NN=Cc1ccc(C)nc1)N(S(C)(=O)=O)CC2	764895975	IYURKDNEYUTELM-GOSISDBHSA-N	446.529	1.806	50	20	IDGD	
Cc1c(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)c(O)nc2ccccc12	765733103	NJIXSHSEUYEUKA-UHFFFAOYSA-N	447.495	1.468	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)c1csc([N+](=O)[O-])c1	765758397	LPFBUJCRMOAPFK-UHFFFAOYSA-N	437.909	1.889	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN(C)[C@@H](CO)c2cccc(Br)c2)n1	767045788	QYTHKIYMVXHQIP-AWEZNQCLSA-N	441.351	1.569	50	20	IDGD	
CN(C)CCS(=O)(=O)c1ccccc1C(=O)NNC(=O)c1cc(Br)c[nH]1	767205237	QOHKXHFWGONLGB-UHFFFAOYSA-N	443.323	1.187	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)[C@@H]1CC(=O)N(C2CCC(C)CC2)C1	767340846	YXOYQEOLXPZQKT-ZCDLSOSASA-N	429.517	1.655	50	20	IDGD	
C[C@H](NS(=O)(=O)c1ccc(C#N)cc1)C(=O)NNC(=O)c1cc2ccccc2cc1O	767828396	RVBSFBMURNJIPO-ZDUSSCGKSA-N	438.465	1.545	50	20	IDGD	
CC1(C)CCC[C@@]2(C1)NC(=O)N(CC(=O)NNC(=O)c1ccc3c(c1)OCCO3)C2=O	768565804	KXTIZZCTHBQENN-NRFANRHFSA-N	430.461	1.110	50	20	IDGD	
COc1ccccc1[C@@H](NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)c1ccco1	769201530	FJFMYCWHTNKHDL-LJQANCHMSA-N	433.428	1.998	50	20	IDGD	
CC(=O)N1CCc2c(NC(=O)C(=O)NNC(=O)c3cc(-c4ccc(C)cc4)[nH]n3)cccc21	769268162	WXFAJNIREKBJSA-UHFFFAOYSA-N	446.467	1.694	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)c3cc(I)ccc3F)nc21	770972825	JRDLBHSNSCOIGB-UHFFFAOYSA-N	428.165	1.570	50	20	IDGD	
O=C(NNc1ccc(Br)c(F)c1)[C@@H]1CC(=O)N([C@@H]2CCS(=O)(=O)C2)C1	771682144	HXLZGILTQKJGIK-MWLCHTKSSA-N	434.287	1.067	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1ccc(S(=O)(=O)N(C)c2ccccc2)cc1	771870833	QOHOPTMVNSQVMZ-AWEZNQCLSA-N	433.486	1.614	50	20	IDGD	
COc1ccc([C@@H](OC)[C@H](C)NC(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1	771904478	KNTXDHPKXZAWGW-GUYCJALGSA-N	449.533	1.709	50	20	IDGD	
Cc1cc(S(=O)(=O)NCCNC(=O)NNC(=O)COCc2ccccc2)c(C)s1	771983994	AGPRGHBKYMPUBV-UHFFFAOYSA-N	440.547	1.190	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)[C@H](NC(=O)c1ccc(OC)cc1)c1ccccc1	772074840	HGJJMZYTAOKOCU-IFXJQAMLSA-N	427.457	1.655	50	20	IDGD	
C[C@H]1C[C@H](NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)CCN1C(=O)OC(C)(C)C	772339906	QJJRSYXEHFUMFH-DZGCQCFKSA-N	444.496	1.394	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)c1c[nH]c2ccc(I)cc2c1=O	772643016	ARHLWBFHGBUNDT-UHFFFAOYSA-N	448.220	1.531	50	20	IDGD	
COc1ccc(-c2n[nH]cc2C(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)cc1	772885035	SSIBROBJOHWFEY-UHFFFAOYSA-N	427.848	1.816	50	20	IDGD	
Cc1ccc(-n2nc(C)cc2NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)nn1	773496532	KPXQSDNXHMYXMC-UHFFFAOYSA-N	445.386	1.037	50	20	IDGD	
O=C1C[C@H](Cc2ccc(NC(=O)C(=O)NNc3ccc(C(F)(F)F)cc3)cc2)C(=O)N1	773768631	WHDKNZVROCCDSQ-LBPRGKRZSA-N	434.374	1.992	50	20	IDGD	
Nc1ccccc1S(=O)(=O)NCC(=O)NNC(=O)CSc1ccc(Cl)cc1	774322783	OSKQAUCNDBLSOC-UHFFFAOYSA-N	428.923	1.140	50	20	IDGD	
CN(C)C(=O)[C@@H]1CC[C@@H](CNC(=O)NNC(=O)c2ccc(Br)cc2Cl)O1	774699681	HSENOCMPWIYQKS-GWCFXTLKSA-N	447.717	1.682	50	20	IDGD	
CC1C[C@@H](C(=O)NNC(=O)CCc2ccco2)[C@H](C(=O)NNC(=O)CCc2ccco2)C1	775823929	KYOQKXVGNDDMMV-QZTJIDSGSA-N	444.488	1.395	50	20	IDGD	
O=C(NNc1ccc2ccccc2n1)Nc1ccc(S(=O)(=O)N2CCOCC2)cn1	776062487	WAFBZFCYUPGDCF-UHFFFAOYSA-N	428.474	1.799	50	20	IDGD	
COCCO[C@H]1COCC[C@H]1NC(=O)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1	777279992	WQGHEBIANLVRAT-KGLIPLIRSA-N	441.428	1.427	50	20	IDGD	
O=C(NNC(=O)N1CC[C@@H](C(=O)NCC(F)(F)F)C1)c1ccc(Br)s1	777411268	JLXFTCMEDPQWGI-SSDOTTSWSA-N	443.245	1.865	50	20	IDGD	
CC(=O)c1ccc(C(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)c(F)c1	777418698	BKOLFUZSDBIKAD-UHFFFAOYSA-N	426.492	1.916	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)[C@H](Cc2ccc(F)cc2)n2nnnc2C)nc1C	778424076	LTCWOTMTRCDJCC-INIZCTEOSA-N	428.428	1.323	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)c1ccc2c(c1)C(=O)N(C1CCCCC1)C2=O	778435898	ABZKBCWLYDAWOK-UHFFFAOYSA-N	444.488	1.901	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1ccc(-c2ncn(C)n2)cc1	779868980	HAAIDGFIHKKILH-UHFFFAOYSA-N	427.490	1.158	50	20	IDGD	
CN(NC(=O)[C@H]1CCN1C(=O)OC(C)(C)C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	781985281	LQWZOFJNGZOSKM-CQSZACIVSA-N	441.529	1.632	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)N1CCC[C@@H](n2ccc(C(F)(F)F)n2)C1	782501664	AYTSGPNWWHJOOX-LLVKDONJSA-N	444.439	1.771	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc2c(c1)CCN2C(=O)C(=O)NNc1ccccc1F	782705810	MTEVXNOHEXPEIX-UHFFFAOYSA-N	434.493	1.889	50	20	IDGD	
O=C(NNC(=O)C(=O)NC1CC1)C(=O)Nc1ccc(OCc2ccccc2Cl)cc1	782968269	ZPJLZYMSIYRGLA-UHFFFAOYSA-N	430.848	1.284	50	20	IDGD	
Cc1ccccc1NC(=O)NNC(=O)C(=O)Nc1ccc(N2C[C@H](C)O[C@H](C)C2)nc1	783416818	BGVZOSHMQLSBGQ-GASCZTMLSA-N	426.477	1.795	50	20	IDGD	
O=C(NNc1ccc(-n2cccn2)nn1)C(=O)Nc1cccc(-c2noc(C3CC3)n2)c1	783433670	XSDDKZOBFAAZFJ-UHFFFAOYSA-N	431.416	1.672	50	20	IDGD	
O=C(NNC(=O)[C@H]1CC=CC[C@H]1C(=O)N1CCOCC1)c1cc(-c2ccc(F)cc2)[nH]n1	784456869	PFMSQFOQUYVWKW-DLBZAZTESA-N	441.463	1.418	50	20	IDGD	
Cc1nc(Cn2cc(C(=O)NNC(=O)CCCOc3ccc(Cl)cc3C)nn2)no1	784811352	MIWURKCINLDZCS-UHFFFAOYSA-N	433.856	1.600	50	20	IDGD	
CCCS(=O)(=O)Nc1cccc(NC(=O)C(=O)NNc2cccc(C(=O)OC)c2)c1	784853447	ITUWTPKEBADSJV-UHFFFAOYSA-N	434.474	1.707	50	20	IDGD	
COCCNC(=O)Cn1cc(NC(=O)C(=O)NNc2c(Cl)cc(F)cc2Cl)cn1	784878911	WIQDNDBHPQTZJQ-UHFFFAOYSA-N	447.254	1.173	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)Nc1ccnn1-c1cccc(Cl)c1	785024341	XMZIIAKVYYYHKP-UHFFFAOYSA-N	444.791	1.539	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2ncn(Cc3ccc(C#N)cc3)n2)cc1Cl	785116164	DPKZINWRXGSONZ-UHFFFAOYSA-N	425.836	1.942	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)CCC(=O)Nc1ccc2nc(O)[nH]c2n1	787905230	KYLPIXGVFWWNPZ-UHFFFAOYSA-N	444.473	1.331	50	20	IDGD	
NS(=O)(=O)c1ccccc1NNC(=O)COc1cccc(NC(=O)c2ccco2)c1	788232236	ROYZXNZHKUIRPN-UHFFFAOYSA-N	430.442	1.701	50	20	IDGD	
N#Cc1ccc(S(=O)(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1Br	788477248	JIRWUVZXBNTLTA-UHFFFAOYSA-N	425.220	1.852	50	20	IDGD	
CN(C)[C@H]1CCOc2c(NC(=O)C(=O)NNC(=O)COc3ccccc3C#N)cccc21	789732428	PTINJINCNVQFLV-KRWDZBQOSA-N	437.456	1.108	50	20	IDGD	
COc1cc(NNC(=O)C(=O)Nc2cc(S(N)(=O)=O)cc(C)c2C)ccc1Cl	789795897	DRKDXLBATBTTLT-UHFFFAOYSA-N	426.882	1.695	50	20	IDGD	
CC(=O)Nc1c(C)ccc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)c1C	789809974	JKNRLRSYHJLHET-PXNSSMCTSA-N	438.484	1.920	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)[C@H]1Cc2cc(Br)ccc2O1	792173158	BYZOUWLLOPPMGR-CYBMUJFWSA-N	443.298	1.608	50	20	IDGD	
C[C@@H]1CN(c2ccc(NC(=O)C(=O)NNc3ccc4c(=O)[nH]ccc4c3)cn2)C[C@@H](C)O1	793064448	AONPXYRNDHHNJY-ZIAGYGMSSA-N	436.472	1.619	50	20	IDGD	
COC(=O)c1cc(F)c(Br)cc1NC(=O)C(=O)NNc1nccnc1OC	797007658	RRWGQNPNUNOMAQ-UHFFFAOYSA-N	442.201	1.255	50	20	IDGD	
O=C(NNc1ccc(-n2cccn2)nn1)C(=O)Nc1ccnc(OCc2ccccc2)c1	800627141	DXDCJCDUVYAQLM-UHFFFAOYSA-N	430.428	1.718	50	20	IDGD	
Cc1c(C(=O)NNC(=O)Nc2ccc(Br)cc2)cnn1-c1ccc(O)nn1	801997359	OQPYGYRIJPYGMK-UHFFFAOYSA-N	432.238	1.905	50	20	IDGD	
COc1ccc(Cl)c(NC(=O)NNC(=O)c2cnc3c(c2C)c(=O)n(C)c(=O)n3C)c1	802107874	DWMPSJVOJJOUGY-UHFFFAOYSA-N	446.851	1.069	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)N1CC[C@@]2(CCN(Cc3ccccc3)C2)C1	805044160	IBSJFTWAOLWHIZ-JOCHJYFZSA-N	441.557	1.817	50	20	IDGD	
O=C(NNc1cnc2ccccc2n1)C(=O)Nc1cc(F)c(N2CCOCC2)cc1F	806983757	FNVODBOEPOVQAJ-UHFFFAOYSA-N	428.399	1.826	50	20	IDGD	
C[C@H]1C[C@H](C)CN(S(=O)(=O)c2ccc(NC(=O)C(=O)NNc3cccc(F)n3)cc2)C1	807392476	QAHBZPIICMEIPT-KBPBESRZSA-N	449.508	1.969	50	20	IDGD	
Cc1cc([N+](=O)[O-])ccc1NNC(=O)C(=O)Nc1ccc(CCN2CCOCC2)cc1	807457093	PRVUIZYSSJGPJM-UHFFFAOYSA-N	427.461	1.860	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)NCCn1cc(Br)cn1	807531103	MMTAMTQXHUHNLD-UHFFFAOYSA-N	426.271	1.454	50	20	IDGD	
CC(=O)Nc1ncc(S(=O)(=O)NNC(=O)NCc2cccc(C(F)(F)F)c2)s1	808083950	HAFYUSZZZSFTGS-UHFFFAOYSA-N	437.425	1.813	50	20	IDGD	
O=C(COC(=O)c1cncc(C(F)(F)F)c1)NNC(=O)[C@H]1COc2ccccc2O1	808620336	YOTCJFYQGPIUOQ-CQSZACIVSA-N	425.319	1.245	50	20	IDGD	
COc1cc(NNC(=O)CNS(=O)(=O)c2ccc(OC)c(OC)c2)ccc1Cl	811472595	HFXOURCZXBRJIQ-UHFFFAOYSA-N	429.882	1.787	50	20	IDGD	
Cc1nn(CC(F)(F)F)c(C)c1CC(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	812730396	HJQGPDMRMKXMFW-UHFFFAOYSA-N	433.456	1.998	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)N[C@@H]2CC(=O)N(c3ccccc3F)C2)cc1OC	812931697	IUJXYWDEGZDJIX-CQSZACIVSA-N	430.436	1.983	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC2(CCN(C(=O)NNC(=O)CNC(=O)c3ccco3)CC2)C1	814295553	XUIVIICOGHJJCU-UHFFFAOYSA-N	449.508	1.473	50	20	IDGD	
N#Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)ccc1Br	815563804	OLLAEXVXCREFLM-UHFFFAOYSA-N	432.190	1.629	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@@H]2CCc3nncn3C2)ccc1Oc1ccncc1	815693130	MSTWARXHPUUCGZ-CQSZACIVSA-N	435.444	1.122	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)N2CCN(S(=O)(=O)c3cc[nH]n3)CC2)c(C)n1CC(C)C	816326971	QWJJJEYWHISRQT-XDHOZWIPSA-N	444.561	1.924	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)[C@H]2CCN(c3ccc(F)cc3)C2=O)C1	816510238	PWDCRLMABHRLDF-WMLDXEAASA-N	448.495	1.973	50	20	IDGD	
CC(C)n1nc(C(=O)NNS(=O)(=O)c2c[nH]nc2C(F)(F)F)c2ccccc2c1=O	821127049	FBKQVMSVTFILPT-UHFFFAOYSA-N	444.395	1.343	50	20	IDGD	
O=C(Cn1nnc(-c2ccccc2)n1)NN=Cc1c[nH]nc1-c1ccc2c(c1)OCCO2	839386265	NOWLWHZCKIQZFW-UHFFFAOYSA-N	430.428	1.652	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)CCNS(=O)(=O)c2ccc(C)c(C)c2)c(C)c1	913164445	QYOWQDPDKGRHCE-UHFFFAOYSA-N	432.546	1.848	50	20	IDGD	
NS(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)COc2ccc(Br)cc2)c1	913457464	HRZLVUDMHKXFKU-UHFFFAOYSA-N	446.254	1.076	50	20	IDGD	
Cc1cc(Br)cc2c1NC(=O)C2=NNC(=O)Cn1nnc(-c2ccccc2)n1	915049114	QPTBKOYDCZCJOS-UHFFFAOYSA-N	440.261	1.884	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C2CCN(C(=O)N3CCCC3)CC2)c2ccccc2c1=O	915636667	YWMAHCUQYGSHNV-UHFFFAOYSA-N	440.504	1.105	50	20	IDGD	
COc1ccc([C@@H](CNC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)N2CCOCC2)cc1	915896976	NNMQUUSGMXVBJC-LJQANCHMSA-N	443.460	1.621	50	20	IDGD	
CN1CCN([C@H](CNC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c2cccs2)CC1	915901224	FVUFEJHKJOIXRI-MRXNPFEDSA-N	432.506	1.589	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)c2cccc(NS(=O)(=O)c3cccs3)c2)n1	916139894	AIBBGSJUYHVIPZ-UHFFFAOYSA-N	433.515	1.823	50	20	IDGD	
COC(=O)c1cc(Br)ccc1S(=O)(=O)NNC(=O)c1ccc(Cl)nc1	917747846	YMMRKMAJBIVQHX-UHFFFAOYSA-N	448.682	1.907	50	20	IDGD	
CC(C)Oc1ccccc1CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	918127809	LICIJYLGEOOIBG-UHFFFAOYSA-N	434.518	1.868	50	20	IDGD	
O=C(NCc1ccc(N2CCOCC2)c(F)c1)NNC(=O)c1nnc(O)c2ccccc12	918217670	JICGCYYXIOLULF-UHFFFAOYSA-N	440.435	1.455	50	20	IDGD	
COc1ccc(OC)c(CCNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)c1	919790088	LRMZJSPBYBTLLB-UHFFFAOYSA-N	435.506	1.184	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(Cl)cc1C(F)(F)F)N[C@@H]1CCS(=O)(=O)C1	919961259	YVIXXHUIGONCHO-MRVPVSSYSA-N	435.833	1.038	50	20	IDGD	
C[C@H]1CN(Cc2csc(NC(=O)NNC(=O)COc3ccccc3C#N)n2)C[C@@H](C)O1	920930688	TYAVKOQMUVJXCU-OKILXGFUSA-N	444.517	1.856	50	20	IDGD	
CCOC(=O)c1ncc(C(=O)NNC(=O)c2ccc(CSc3nncn3C)cc2)s1	1117383256	OEMZVGCYCRSGAV-UHFFFAOYSA-N	446.514	1.815	50	20	IDGD	
O=C(O)COc1ccc(S(=O)(=O)NNC(=O)c2cncn2-c2ccccc2)cc1F	1318278546	LABLEXXYXXJHPH-UHFFFAOYSA-N	434.405	1.098	50	20	IDGD	
CCC(=O)N[C@@H](CCSC)C(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1	1318623028	UGJJFXVKWZQWFP-AWEZNQCLSA-N	430.571	1.429	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1)CC1(C)OCCO1	1340294045	UYOXEWLXTRFZGK-AWEZNQCLSA-N	428.530	1.753	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnn4ccncc34)C2)C1	1777985615	AVBKLLWEZAPECG-RDTXWAMCSA-N	436.310	1.346	50	20	IDGD	
Cc1cccc(C)c1SCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1779285040	DYIKFOVSLPTVFX-OXQOHEQNSA-N	426.966	1.825	50	20	IDGD	
C=CC(=O)N[C@@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@](C)(Cl)CCl)C2	1779534878	ILDNHBVROMUCHX-QABNGEJJSA-N	434.364	1.427	50	20	IDGD	
CCOC(=O)O[C@@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CO[Si](C)(C)C)C1	1779546328	LVPKETXEIBXEMK-RZQQEMMASA-N	444.601	1.913	50	20	IDGD	
CC(C)n1nccc1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](C)CBr)CCO2	1779599792	IGVKREZEHAIRSP-KDOFPFPSSA-N	427.343	1.939	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(OC)c(N(C)C)c3)C2)C1	1781129044	ZSASMHQTLGIPJY-IIBYNOLFSA-N	439.940	1.459	50	20	IDGD	
COc1cccc(CC(=O)N2CCO[C@]3(CCN(C(=O)[C@](C)(Cl)CCl)C3)C2)n1	1781224102	HLSCDEGWCORTTR-RTBURBONSA-N	430.332	1.699	50	20	IDGD	
Cc1cccc(C)c1NC(=O)C(=O)N1CC[C@@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1781238673	GQICAKPQIXUXRK-JOCHJYFZSA-N	447.608	1.923	50	20	IDGD	
Cc1nn(C)c(C)c1CC(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781333545	FTQXJKZGHWCXCQ-NVXWUHKLSA-N	431.306	1.100	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C23CC(C(=O)OC)(C2)C3)C1	1781962317	JEWQTZGHQJVISW-ROIMBAQASA-N	442.940	1.097	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1noc(C(C)C)n1)C2	1782172070	MUOCYRKAWRRSQL-STXHMFSFSA-N	442.944	1.503	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccn4ccnc4c3)CCO2)C1	1783349205	JPULTJFIQAHXGE-DNVCBOLYSA-N	435.322	1.951	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3c(O)cc(O)cc3O)CCO2)C1	1783353467	OUDOIQLXNWGGES-KPZWWZAWSA-N	443.294	1.420	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc([N+](=O)[O-])o3)[C@H]2C1	1783362553	WMBXZSFOEJFOAY-YDHLFZDLSA-N	425.514	1.633	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H]2C[C@@]21C(=O)N1CC[C@@]2(CN(C(=O)[C@H](F)Cl)CCO2)C1	1783553830	FPQQELRLWBKRHZ-ITHTXLDVSA-N	445.919	1.750	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(Cl)nc(OC)c3)CCO2)C1	1783877115	GCHJSZVNPGQAKC-ACJLOTCBSA-N	432.304	1.441	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3c[nH]c4cccc(OC)c34)CCO2)C1	1783880601	FYPAGDLGEFCCAB-QVKFZJNVSA-N	435.908	1.874	50	20	IDGD	
COc1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)C(Cl)Cl)C3)C2)ccc1[N+](=O)[O-]	1783951851	KZTBWRXJXKLQFZ-QGZVFWFLSA-N	432.260	1.851	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3cc(F)ccn3)[C@H]2C1	1785241445	QDNDDNPUWKHTBE-MGHWNKPDSA-N	427.904	1.387	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)/C=C/c3ccccc3[N+](=O)[O-])C2)C1	1785551357	UULKVMMGUVKDPU-AIRUHKMPSA-N	437.880	1.692	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC1(c2ccc(NC(=O)C[C@@H]3NC(=O)NC3=O)cc2)CCC1	1786761596	AQTKVAGZOSPUNO-HNNXBMFYSA-N	432.553	1.570	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CSc3ncccn3)C[C@@H]21	1789866099	MATDASIYYJHEQF-NUXNZHGMSA-N	447.388	1.785	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3cccnc3)C[C@@H]21)[C@@H](F)Br	1789922679	NWQLNTIMWJIRBZ-QBYUYEEZSA-N	428.302	1.684	50	20	IDGD	
Cc1ccc(O)c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]3C2)c1	1789924573	MRBKISBKLCWWDQ-MZGVZZPPSA-N	429.286	1.984	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCC(C)C)[C@H]2C1	1790835465	QMQODUFJVWSDLF-MPKALDKKSA-N	431.537	1.536	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN3CCCCC3)C[C@@H]21	1790961830	RYYUXGXHOJXWGC-QAETUUGQSA-N	430.387	1.626	50	20	IDGD	
Cc1cnn([C@@H](C)C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](C)Br)[C@H]3C2)c1	1791064961	NRCLQSDCPLJJPK-QXKUPLGCSA-N	427.343	1.516	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(Cl)cnc1O	1792390842	URUMMWVNRHMNHT-XHSYRHOGSA-N	432.702	1.427	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2)[C@@H]1CCc2ccoc2C1	1793122230	BTCKXPAVWFZGAT-ZXFNITATSA-N	425.323	1.759	50	20	IDGD	
COc1ncccc1CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@](C)(Cl)CCl)C2	1794094402	GXYHXLWQIGHVSN-DOHHPOSVSA-N	444.359	1.849	50	20	IDGD	
COc1cc(F)ccc1CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCBr	1795117297	LKMDVYJXXCBXDC-HBCWATKFSA-N	443.313	1.751	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnc(C(F)(F)F)cn1	1796068968	GREXOHCWSXQBAG-DRXBFXEBSA-N	446.502	1.550	50	20	IDGD	
CC(C)(C)OC(=O)N1CC=C(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Cl)CC1	1796370789	MDGNUEFDAJSQEA-FZKCQIBNSA-N	445.919	1.678	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](C)Cn1ccnc1)C2	1796893202	QWOJCKDZXIPCFK-HEZDOATESA-N	439.520	1.291	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CO[Si](C)(C)C)c1	1797958902	AHUQWPKFLCBVRN-XEMDLRDOSA-N	433.581	1.700	50	20	IDGD	
Cc1nc2ccncc2cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(B(O)O)cc1)C2	1798014891	RRLBSFATTRIBHS-ACDBMABISA-N	444.300	1.184	50	20	IDGD	
Cc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCBr)C3)n(C(F)F)n1	1798680150	QUCBFILCZKGXOE-GNXNZQSNSA-N	435.269	1.575	50	20	IDGD	
Cc1cc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Br)ccn1	1799344883	WUBFVCPRXPQDMP-FSDCSDTHSA-N	428.302	1.603	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccn3ccnc13)C2)[C@@H](F)Br	1799349872	MOXJMNMKZJSBIH-ZMJPVWNMSA-N	425.258	1.228	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccnc2ncccc12	1799977475	CJJCQOJPWXOZIT-NFFDBFGFSA-N	433.306	1.616	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3n[nH]cc3c1)C2	1800639618	KREKFKGOCGEFKR-IVSAIRAKSA-N	435.322	1.940	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1C[C@H]1c1ccc(F)c(F)c1)C2	1800970674	GYZLWUCZDZPEIO-GNRYUNBRSA-N	442.890	1.912	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(F)ccc1Cl)C2	1801012629	SLKGVVHIAGXABR-DBWKPXFBSA-N	440.903	1.055	50	20	IDGD	
CCS(=O)(=O)c1ccc(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](O)CCl)C3)cc1	1801562548	SZRKFMJNBUCXGY-KYHPRHEASA-N	442.965	1.261	50	20	IDGD	
C[C@@H](Cc1ccccc1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnccc1C(=O)NN)C2	1802644314	HBUFMTQKYBOJTD-KANFNMMFSA-N	435.528	1.816	50	20	IDGD	
C=CCO[C@H](C)C(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1803571093	MOYZEDXQAJSAIM-HGHGUNKESA-N	431.537	1.052	50	20	IDGD	
COC(=O)CSCC(=O)NC[C@@H]1CCN(C(=O)C(Cl)Cl)[C@@H]1c1cccnc1	1803580332	LRWMYMLBHNJANI-SWLSCSKDSA-N	434.345	1.797	50	20	IDGD	
COc1cc(Cl)cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)c1	1803764013	NYOZKXUAFUXXAG-REPLKXPHSA-N	442.708	1.594	50	20	IDGD	
O=C(CN1CCc2sccc2C1)N1CCCC2(CCN(C(=O)[C@H](O)CCl)CC2)C1	1806781946	DDYMAUAOKALOFY-QGZVFWFLSA-N	440.009	1.937	50	20	IDGD	
N=C(N)SCC(=O)NC[C@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1	1807003739	DJGPDASZEMMDGG-IUODEOHRSA-N	428.356	1.499	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)o1	1807360246	POEOIWGABAAXSQ-WIYYLYMNSA-N	433.273	1.296	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)ccn1	1807361459	QAHCTMXKCLHEIN-UNMCSNQZSA-N	444.300	1.098	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1	1808263936	RHHGJSFMGNGJOD-JCGIZDLHSA-N	444.923	1.417	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)c1cnc2ccccc2n1	1808966088	YUANNMYVHXFZPN-BEVDRBHNSA-N	439.903	1.944	50	20	IDGD	
CC(C)(F)C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1	1810302441	KFJWUXILOBCJOQ-PBHICJAKSA-N	428.468	1.148	50	20	IDGD	
C=CCC(F)(F)C(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1812671443	GDYCKRDRKKVCCO-APWZRJJASA-N	437.491	1.672	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)Cc2ccc(O)cn2)[C@@H]1c1cccnc1	1813033453	NTOBQGLLTITMBL-MOXGXCLJSA-N	432.908	1.685	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1ccccc1F)CC2)c1cccc(B(O)O)c1	1815360868	PTPZKXKSPVRWLJ-CQSZACIVSA-N	439.277	1.502	50	20	IDGD	
COc1cccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)n1	1817471035	PSSCLUCBPRSAKH-SFHVURJKSA-N	449.276	1.113	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)c(C)n1C	1817472355	ROFUMLZGXCLBTL-HXUWFJFHSA-N	449.320	1.665	50	20	IDGD	
CC(C)n1cnc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)n1	1818296038	MIEXVHGADOXZFC-OAHLLOKOSA-N	445.528	1.261	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)CCl)CC2)c1ccc2nccnc2c1	1818488428	RUHAJQUBUMZYFP-ABAIWWIYSA-N	431.905	1.912	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](COC(C)=O)OC(C)=O)n[nH]1	1819432167	ARPDKYIVACWFAQ-CWRNSKLLSA-N	442.900	1.914	50	20	IDGD	
COCCOCCOCCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1	1822253613	KBUWSFDLOWAHNW-HOTGVXAUSA-N	446.932	1.071	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)COC(=O)C(F)(F)F)[nH]n1	1822369757	HXGCOBDSAYPILV-KOLCDFICSA-N	440.806	1.761	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H]2CC[C@H](O)CC2)n[nH]1	1822545960	QKRRVOIZWXBBIN-BFYDXBDKSA-N	434.541	1.326	50	20	IDGD	
C[C@@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1)c1ccccn1	1822897208	DWKPDIDBPWSVHC-QAPCUYQASA-N	441.536	1.974	50	20	IDGD	
CC[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnnn1C)CC2	1825440799	FJDDAJHFLKUYQF-RKDXNWHRSA-N	427.328	1.671	50	20	IDGD	
CC(=O)N/C(C)=C/C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](C)Br)sc2C1	1825647897	XUAQBUSZLUXBMQ-HBUNZAKRSA-N	429.340	1.878	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cscn2)CC1	1825987708	VJQDWDZXEOXPLR-SFHVURJKSA-N	442.545	1.689	50	20	IDGD	
C[C@]1(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)CC1(F)F	1827060031	MSKVPURHPQYQCY-GHTZIAJQSA-N	434.292	1.645	50	20	IDGD	
O=C(CCBr)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)n2)CC1	1827598791	FVZCAKFBMQYKHA-CQSZACIVSA-N	441.326	1.906	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CN2CCS(=O)(=O)CC2)CC1	1830303538	OEDPLNFAMPRVQA-MSOLQXFVSA-N	448.029	1.354	50	20	IDGD	
O=C(c1cc(=O)c2ccccc2o1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1830310085	QMIBBNMEOXIYIU-FXAWDEMLSA-N	438.839	1.397	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3CCN(C(C)C)CC3)C2)C1	1831639934	HEIIZCQZNNTURB-DENIHFKCSA-N	444.016	1.971	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CSCC(=O)OC)CC1	1831828964	WGICANJPAHVKKU-HOTGVXAUSA-N	434.986	1.766	50	20	IDGD	
COc1cncc(CCC(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)c1	1832914900	GXGJZTVNIMZGNS-PKOBYXMFSA-N	429.876	1.014	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)CC3CCN(C)CC3)CC2)CC1	1833135173	NXBNIDJMIILWTE-FQEVSTJZSA-N	443.032	1.544	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cccc4nc[nH]c34)CC2)CC1)[C@H](O)CCl	1833310793	SRZLQBPPBQQXND-GOSISDBHSA-N	433.940	1.348	50	20	IDGD	
O=C(CCBr)NC1CCN(C2CCN(C(=O)Cc3cc[nH]n3)CC2)CC1	1834424396	ZGHJMXHLPRVLDI-UHFFFAOYSA-N	426.359	1.309	50	20	IDGD	
Cc1ccc2oc(C(=O)NC3CCN(C4CCN(C(=O)[C@@H](O)CCl)CC4)CC3)cc2n1	1834914102	IWGDFDJXLIDGKF-SFHVURJKSA-N	448.951	1.921	50	20	IDGD	
COc1cccc(CC(=O)N2CCC(N3CCC(NC(=O)[C@H](F)Cl)CC3)CC2)n1	1835078630	QAJALYCOESFTCW-IBGZPJMESA-N	426.920	1.739	50	20	IDGD	
O=C(CC12CCCN1CCC2)NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836381281	ROHXOVLYKUVROZ-LJQANCHMSA-N	441.016	1.176	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C1(F)CCCCC1)CCO2	1836620371	OLVAZGUDZOJPJI-PBHICJAKSA-N	435.334	1.899	50	20	IDGD	
Cc1cccc2cc(C(=O)N3CCO[C@]4(COCCN(C(=O)[C@@H](O)CCl)C4)C3)[nH]c12	1836851485	MVGPEAPSNRQHBX-LAUBAEHRSA-N	435.908	1.146	50	20	IDGD	
COc1ccc2[nH]cc(C(=O)N3CCO[C@@]4(COCCN(C(=O)[C@@H](F)Cl)C4)C3)c2c1	1836923811	VKWPNRYGKNOQOZ-XLIONFOSSA-N	439.871	1.781	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc(Cl)nc3)C2)C1	1837708786	PAQOTYMWEUNZMD-SFHVURJKSA-N	442.976	1.052	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(C#N)cc3)C2)C1	1837714474	HYACDCNKRSIYJJ-OAQYLSRUSA-N	431.565	1.480	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3ncccc3F)CCO2)C1	1838243070	HCXQQTFWIFWAKR-FZKQIMNGSA-N	444.301	1.322	50	20	IDGD	
CC(=O)N[C@@H](C)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1838647995	DSCMSYNAYAHMLE-XHDPSFHLSA-N	436.322	1.200	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)[C@H]3CNC(=O)C3)CC2)CC1	1838754003	FJOGCGDCHLZQJP-CJNGLKHVSA-N	444.370	1.295	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccccc3OC)CCO2)C1	1838877769	XYVURPPEGIEHLO-OXQOHEQNSA-N	426.897	1.019	50	20	IDGD	
Cc1[nH]nc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)c1F	1839151278	MLUARMTVFVEQKT-IRXDYDNUSA-N	437.299	1.164	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)C(C)(C)C)C2)C1	1839962173	WPAJXZOWJABBEC-DEYYWGMASA-N	435.359	1.023	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4ccsc4[nH]3)C2)C1	1840154659	BWGYJIHTMCHAPZ-AUUYWEPGSA-N	441.937	1.553	50	20	IDGD	
O=C(c1cc2cccnc2[nH]1)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840188467	LJMNQPYASIBHES-GOSISDBHSA-N	427.288	1.437	50	20	IDGD	
O=C(CCCCn1cccc1)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840188572	QBHMNZTUAQALTD-LJQANCHMSA-N	432.348	1.919	50	20	IDGD	
O=C(c1cnn2c(-c3ccsc3)ccnc12)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1	1841350672	QWJIOZIIZRUYQJ-MRXNPFEDSA-N	445.932	1.875	50	20	IDGD	
O=C(c1ccoc1I)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1	1841350775	XBAMVXQMNZAXHA-JTQLQIEISA-N	438.649	1.301	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@H]1CN(C(=O)OC(C)(C)C)C[C@H]1O)C2	1841668919	COGBJKRDBRKFEG-HRCADAONSA-N	443.972	1.825	50	20	IDGD	
Cc1nn2cc(CC(=O)N3CCCC34CN(C(=O)[C@H](F)Br)C4)nc2s1	1841787572	TWPCWZCLRGFVLV-LBPRGKRZSA-N	430.303	1.536	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)/C=C/c2ccccc2N)C1	1842958802	OCDBEZQJJKFTAK-VRESTWFCSA-N	434.500	1.619	50	20	IDGD	
Cc1cc(C(=O)N2CC3(CCCN3C(=O)c3ccc(B(O)O)cc3)C2)nc2ccccc12	1843011244	IKTWITHSMQUSQY-UHFFFAOYSA-N	429.285	1.354	50	20	IDGD	
Cc1nc2cccc(C(=O)N3CC4(CCCN4C(=O)c4cccc(B(O)O)c4)C3)c2s1	1843014008	MZPUYGALOQUNKV-UHFFFAOYSA-N	435.314	1.415	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)CCOCCNC(=O)OC(C)(C)C)C2	1846360656	XTAAMDLLMPHRQM-HNNXBMFYSA-N	447.960	1.375	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)c1ccc(OC)c(Br)n1)C2	1846363109	PXXAWTQRLAQUDM-LLVKDONJSA-N	446.729	1.924	50	20	IDGD	
CCOC(=O)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)[C@@H](Cl)CC)C2	1847044945	YYFXLSSAUXGALW-KBPBESRZSA-N	445.944	1.664	50	20	IDGD	
O=C(c1cn2c(C(F)(F)F)cccc2n1)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl	1847562432	SPXLWPZUKZFHLN-AVGNSLFASA-N	430.814	1.768	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CCC[C@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](O)CCl)C1	1847562861	CPGBZFRFPANBAM-BQJWPVKWSA-N	443.972	1.871	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H]2C[C@@]2(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](O)CCl)C1	1847563927	RZCXKEXCBGYBKD-HOJQFNHUSA-N	427.929	1.045	50	20	IDGD	
CCC(=O)N[C@H](C)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O	1847741532	UVYLYRXCLSUIOM-DQYPLSBCSA-N	446.460	1.250	50	20	IDGD	
CCNS(=O)(=O)c1ccc(C)c(C(=O)NNc2nc3ccccc3c(=O)n2CC)c1	11164261	DLJHJZVCHUYCDX-UHFFFAOYSA-N	429.502	1.780	50	20	IDGD	
CN(C)C(=O)COC(=O)/C(C#N)=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	11373071	MWFJKPVJLJOHQI-NTEUORMPSA-N	429.864	1.617	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)CSc1nnnn1C1CC1	15050967	JVKQGPKGQFMDGG-UHFFFAOYSA-N	427.284	1.089	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)CCCn1c(=O)oc2ccccc21	15379178	BAYIVZJIWCVTFN-UHFFFAOYSA-N	445.501	1.437	50	20	IDGD	
COC(=O)c1ccc(C(=O)NNC(=O)c2ccc(CSc3nncn3C)cc2)cc1	25444615	PSPHZTURLVYOLU-UHFFFAOYSA-N	425.470	1.969	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(OCC(F)(F)F)cc2)c1	106012481	TUEODPBMOSCQFC-UHFFFAOYSA-N	445.419	1.953	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)C1CCC2(CC1)NC(=O)NC2=O	110678645	DBPNXVDMCNRSEK-UHFFFAOYSA-N	427.486	1.648	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](CNC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)C1	725860492	QLSSYYRPRMIDHX-AWEZNQCLSA-N	444.496	1.253	50	20	IDGD	
CC(C)(C)NC(=S)NNC(=O)[C@H](CCS(C)(=O)=O)NC(=O)c1ccccc1Cl	726141887	PHSAKQZVIWXVJH-ZDUSSCGKSA-N	448.998	1.167	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NNc2nc(-c3ccncc3)no2)s1	728072592	UACVWGVOOORCHF-ZDUSSCGKSA-N	434.503	1.798	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2ccc(OCC(F)(F)F)cc2)n1	728722981	KMONXZLZNJCGAA-UHFFFAOYSA-N	431.392	1.940	50	20	IDGD	
CC(C)CC(=O)N[C@H](C(=O)NNC(=O)C1CCN(c2ncccn2)CC1)c1ccccc1	728890359	NKJIBDFRCKBPST-FQEVSTJZSA-N	438.532	1.744	50	20	IDGD	
CSCC[C@H](C(=O)NNC(=O)COc1ccccc1O)N1C(=O)[C@H]2CCCC[C@@H]2C1=O	730780197	KATISDOBYWZSRS-SOUVJXGZSA-N	449.529	1.215	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2ccc(I)c(F)c2)C[C@@H](C)O1	732262070	IKHZYADNXGAIAT-PHIMTYICSA-N	449.264	1.691	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(Cl)s1)NNc1ccc(Br)nc1	732836862	PDXIJMNNEYSODD-UHFFFAOYSA-N	425.717	1.981	50	20	IDGD	
CC(C)OCCCn1c(NNC(=O)C2CCS(=O)(=O)CC2)nc2ccccc2c1=O	733265561	GKSCWYURXCJSCK-UHFFFAOYSA-N	436.534	1.480	50	20	IDGD	
C[C@@H](CS(C)(=O)=O)NC(=O)NNC(=O)COc1ccc(OCc2ccccc2)cc1	733663173	VFAMFDMHVROLMU-HNNXBMFYSA-N	435.502	1.408	50	20	IDGD	
N#Cc1ccc(N2C(=O)N[C@@H](CCC(=O)NNC(=O)c3cccc(Cl)c3)C2=O)cc1	733754772	NGNKGGZKNMVXKA-INIZCTEOSA-N	425.832	1.878	50	20	IDGD	
Cc1nc(-c2ccccn2)nc(NNC(=O)C2=NN(c3ccc(F)cc3)[C@H](C(N)=O)C2)c1C	734257052	ALXTVAWTWJDSPA-SFHVURJKSA-N	448.462	1.858	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)CCn2c(C)c(C)sc2=O)c2ccccc2c1=O	734313145	XLRPHRHLHCCYLX-UHFFFAOYSA-N	429.502	1.498	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)c1	735117600	YYLOTPFNBGHPDL-UHFFFAOYSA-N	433.534	1.157	50	20	IDGD	
CCSc1ccc(C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)cn1	735118254	OQDGFNRFAITTNT-UHFFFAOYSA-N	436.563	1.282	50	20	IDGD	
CC(=NNC(=O)COCc1ccccc1)c1ccc(S(=O)(=O)NCCC(=O)O)cc1	737434599	SZMSCGLBEZZACR-UHFFFAOYSA-N	433.486	1.497	50	20	IDGD	
CS(=O)(=O)Nc1cccc(CC(=O)NNC(=O)c2cccc(Br)c2)c1	742768988	HUBKDRKVGAZVPO-UHFFFAOYSA-N	426.292	1.824	50	20	IDGD	
O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)NNC(=O)c1csc(N2CCOCC2)n1	743741845	LILUNQUHRHJYHT-UHFFFAOYSA-N	430.446	1.304	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)Nc1ccc2c(c1)OCCO2	744449896	HLOZKJLLVLBMOD-UHFFFAOYSA-N	434.474	1.627	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(S(=O)(=O)C(F)F)cc2)cc1	744458918	NCETUVVBXLWYMF-UHFFFAOYSA-N	437.380	1.173	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NCCCN2C(=O)COc3ccccc32)cc1C	745857935	UAUJOKKWGXGHRZ-UHFFFAOYSA-N	426.473	1.828	50	20	IDGD	
O=C(NNC(=O)N1CCOCC1)c1ccc(S(=O)(=O)Nc2ccc(Cl)cc2)cc1	745995756	AEVWMQGRMIUVDZ-UHFFFAOYSA-N	438.893	1.827	50	20	IDGD	
O=C(NCCCn1cncn1)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1	747981704	SLYGRHALGXGCQS-NRFANRHFSA-N	433.516	1.626	50	20	IDGD	
NS(=O)(=O)c1ccc2c(c1)oc(=O)n2CC(=O)NNc1ccc(Cl)cc1Cl	748007890	HXIXLXQUBJLVPN-UHFFFAOYSA-N	431.257	1.692	50	20	IDGD	
COCCOc1cc([N+](=O)[O-])c(C(=O)NNc2ccc(S(C)(=O)=O)cc2)cc1OC	748142147	DQXPXOAVBZLPAI-UHFFFAOYSA-N	439.446	1.789	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCN(C(=O)CCCc3ccccc3)CC2)n1	748810366	ODEHMXJYGAHGRO-UHFFFAOYSA-N	443.573	1.309	50	20	IDGD	
Cc1nccn1C[C@@H](C)CNC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	749195473	BMMUAMUUNCLJJS-HNNXBMFYSA-N	448.549	1.256	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(\C#N)C(=O)NCCNS(=O)(=O)Cc2ccon2)c1C	750075221	AXTZLXROWKZYIR-ZNBBLSJYSA-N	449.533	1.443	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)C1(C)CCC1)N(S(C)(=O)=O)CC2	750234025	YFTIPBZMIUWMJC-HNNXBMFYSA-N	439.534	1.290	50	20	IDGD	
Cc1nc2ccccc2c(=O)n1CC(=O)NNc1nc(Br)cn2ccnc12	750248686	SELYCAWIQGEJLF-UHFFFAOYSA-N	428.250	1.653	50	20	IDGD	
Cc1ccc2c(c1)C(=O)N(CC(=O)NNc1nc(Br)cn3ccnc13)C2=O	750249670	HLWWSYADKHZYBV-UHFFFAOYSA-N	429.234	1.540	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N[C@@H]2CCN(CCCc3ccccc3)C2=O)cc1OC	750271340	BMSVLDWFPPMXGR-GOSISDBHSA-N	440.500	1.882	50	20	IDGD	
CCN1CCN(C(=O)CNC(=O)/C(C#N)=C/c2cc(C)n(C[C@H]3CCCO3)c2C)CC1	750734117	ONHXDKAGGICFAM-NNVROAHOSA-N	427.549	1.471	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)Cc2ccc(C(=O)NN=Cc3cnnn3C)cc2)cc1	751132050	ZDQMPBIGFNSXEU-UHFFFAOYSA-N	426.502	1.708	50	20	IDGD	
C[C@@H](NC(=S)NNC(=O)c1cc(S(N)(=O)=O)c(Br)s1)C1CC1	751619556	OSUFKKPUSBWUPR-RXMQYKEDSA-N	427.371	1.065	50	20	IDGD	
C[C@H](NC(=S)NNC(=O)CCS(=O)(=O)c1ccc2c(c1)OCCCO2)C1CC1	751619887	YHGASSNBFSDWAU-LBPRGKRZSA-N	427.548	1.306	50	20	IDGD	
COc1c(F)ccc(F)c1C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	755777051	QIHXTCQGEKROJL-UHFFFAOYSA-N	440.472	1.666	50	20	IDGD	
Cn1c(=O)c2cc(NC(=O)NNC(=O)Cc3cccc4ccccc34)cnc2n(C)c1=O	755846549	LUFMTBPLCAUHEE-UHFFFAOYSA-N	432.440	1.181	50	20	IDGD	
COc1ccc(C(=O)N2CCN(C)CC2)cc1NC(=O)NNC(=O)c1ccccc1F	756246517	CDLBTYYMUODPPY-UHFFFAOYSA-N	429.452	1.688	50	20	IDGD	
C[C@@H]1CCC[C@H](OCc2cccc(NC(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)c2)C1	756255683	AJEHAVIFNSOYPV-CPUCHLNUSA-N	426.539	1.872	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)NCc2cc(C)ncn2)cc1	757207817	IXZSWAXWGZOEGV-LICLKQGHSA-N	445.483	1.756	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)C2(Cc3ccccc3)CCC2)CC1	758296479	OABIRFVQNQWSMK-UHFFFAOYSA-N	443.573	1.874	50	20	IDGD	
Cc1ccccc1-n1cc(C(=O)N2CCN(S(=O)(=O)CBr)CC2)cn1	758528653	WWLWHTBRUCAQGR-UHFFFAOYSA-N	427.324	1.621	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCN(Cc3cccc(Cl)c3)C(=O)C2)n1	758757704	ZEJAPVGHZLKXGS-UHFFFAOYSA-N	435.937	1.139	50	20	IDGD	
CCC(=O)N1CCCC[C@@H]1C(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758785730	FAPJDMRSJIEFOY-OAHLLOKOSA-N	425.530	1.413	50	20	IDGD	
COc1cc(F)cc(NNC(=O)c2ccc(OC)c(S(=O)(=O)N3CCOCC3)c2)c1	759321731	MOJCNRQMIHZGNR-UHFFFAOYSA-N	439.465	1.621	50	20	IDGD	
COC(=O)[C@@H](C)Cc1ccc(NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1	760088053	RSXDGMVFXNBGIH-HNNXBMFYSA-N	440.504	1.898	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H](C)C[C@@H]2CCOC2)c1	760193327	KCLFNVVHUWYCSY-GJZGRUSLSA-N	426.539	1.476	50	20	IDGD	
C[C@@H](CC(=O)NNc1nc(-c2ccncc2)no1)NS(=O)(=O)c1cccnc1Cl	760494124	JGRUZQZZHKDDEE-JTQLQIEISA-N	437.869	1.380	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)NCCNS(=O)(=O)NC(C)C)c(C)n1C[C@H]1CCCO1	760641242	NTRVYTCNEQWQPH-ZYNFKGNASA-N	437.566	1.140	50	20	IDGD	
O=C(NCCOc1ccc(C(F)(F)F)cn1)NNC(=O)[C@H]1COc2ccccc2O1	760835719	IHPIDOHXAQQEEZ-CQSZACIVSA-N	426.351	1.650	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)NCc1ccc(N2CCO[C@@H](C)C2)nc1	761659515	NHNWDPPKBMVQIY-HNNXBMFYSA-N	445.545	1.938	50	20	IDGD	
CSc1ccc(NC(=O)C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cn1	763530233	FULOKKVAOJBIEI-UHFFFAOYSA-N	442.545	1.102	50	20	IDGD	
C=CCNC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2cc(OC)cc(OC)c2)cc1	763773001	RLTQDKUJESJAHU-UHFFFAOYSA-N	441.444	1.411	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)COC3)c2ccccc2c1=O	763789912	GGCLJWHOYOCQBD-UHFFFAOYSA-N	435.440	1.407	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)C(=O)Nc1cccc(OCc2cccnc2)c1	763838923	BPWCRSLCEZMTJS-UHFFFAOYSA-N	438.415	1.965	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccccc1CN1CCOCC1	763852407	XBOGOGULFKAKPK-OAHLLOKOSA-N	444.463	1.211	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)NC(=O)CC3)cc1	763871087	DMWSOOKWCFXIBP-ZDUSSCGKSA-N	438.440	1.327	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(OC)cc(OC)c2)cc1OC	763912095	NPMOROIFCUOPIG-UHFFFAOYSA-N	431.445	1.901	50	20	IDGD	
COc1c(Br)cc(Cl)cc1NC(=O)C(=O)NNC(=O)c1cccn1C	763997252	ZXZHGJOJIVTBSM-UHFFFAOYSA-N	429.658	1.849	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1ccc(F)c(-n2nnnc2C)c1	764012075	LWFWSUMREJPNIE-UHFFFAOYSA-N	447.814	1.172	50	20	IDGD	
COC(=O)c1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)CCc1ccc(OC)cc1	764125855	CNNXNKBLNYNAOI-UHFFFAOYSA-N	433.848	1.854	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccccc2C(=O)NC(C)(C)C)c1O	764130891	BAIREVHXYSFFEL-UHFFFAOYSA-N	428.445	1.329	50	20	IDGD	
COc1ccc(S(=O)(=O)C(F)(F)F)cc1NC(=O)C(=O)NNC(=O)CCC(C)C	764199820	RYVBSDVYURZHQB-UHFFFAOYSA-N	439.412	1.511	50	20	IDGD	
CNC(=O)Cn1ccc2ccc(NC(=O)C(=O)NNC(=O)CCC3CCCCC3)cc21	764215509	VOQYFMKQJGLULG-UHFFFAOYSA-N	427.505	1.834	50	20	IDGD	
O=C(NNC(=O)c1cc(F)ccc1Br)C(=O)Nc1cccc2c1OCCO2	764276487	DYCRUDDSMCPQDX-UHFFFAOYSA-N	438.209	1.759	50	20	IDGD	
O=C(CCCc1cccs1)NNC(=O)C(=O)Nc1ccc(NC(=O)[C@H]2CCCO2)cc1	764334308	CLMPZWJUTDZYAG-QGZVFWFLSA-N	444.513	1.974	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)N[C@@H]2CCCC[C@@H]2N2CCOCC2)nc1	764377854	ZQJFYWDFRFXSJG-SJORKVTESA-N	440.570	1.038	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)C(=O)Nc2cnccc2-c2cccc(F)c2)c1	764432672	JBDQJSWXCOBTPR-UHFFFAOYSA-N	436.403	1.641	50	20	IDGD	
Cc1cc(C(=O)NN=C2C(=O)N(CC(=O)N(C)C)c3ccc(Br)cc32)n[nH]1	764795785	YWOGBQJGKDOWJT-UHFFFAOYSA-N	433.266	1.050	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNS(=O)(=O)c3ccc(C)cc3C)CC2)cc1	765124459	AOCVJODEVWSOCW-UHFFFAOYSA-N	430.574	1.739	50	20	IDGD	
CNC(=O)[C@@H]1CCC[C@H]1NC(=O)NNC(=O)COc1ccc(OCc2ccccc2)cc1	766277093	CTEGAIVIZMKPLK-WOJBJXKFSA-N	440.500	1.890	50	20	IDGD	
Cc1cc(Br)cc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1	766798972	QYOBUCSEQMTBPT-INIZCTEOSA-N	449.257	1.902	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)c2nn(C)cc2[N+](=O)[O-])c2ccccc2c1=O	767163095	CUUVYLIFAONPOE-UHFFFAOYSA-N	427.421	1.303	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)n(-c2ncccn2)n1	768239411	ZDMQOHOOTIXCJP-OAHLLOKOSA-N	437.460	1.141	50	20	IDGD	
CCC(=O)N1CCC[C@@H](C(=O)NNC(=O)c2cc(-c3ccc(OC)c(OC)c3)[nH]n2)C1	768275277	ABBMLPJQOWDUAE-CQSZACIVSA-N	429.477	1.504	50	20	IDGD	
COc1ccc(NNC(=O)c2cc(S(=O)(=O)N3CCCCC3)cn2C)c([N+](=O)[O-])c1	768328384	GWMGENWUUYQUOV-UHFFFAOYSA-N	437.478	1.873	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)c1ccc(Br)c(Cl)c1F	770043232	PIRULBAYDBUIAO-UHFFFAOYSA-N	429.633	1.828	50	20	IDGD	
CC(C)(C)[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)COc1ccccc1-c1ccccc1	770447021	JBTZQVHCQKWAAR-IBGZPJMESA-N	433.530	1.844	50	20	IDGD	
C[C@@H]1NC(C(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)=NN(c2ccccc2)C1=O	770970122	YMDYLYFKFPZKPV-NSHDSACASA-N	437.464	1.068	50	20	IDGD	
COc1ccc(C(=O)N[C@@H](C(=O)NNc2nc(O)c3cnn(C)c3n2)c2ccccc2)cc1	770971619	MFMLHWWVHDTBJT-QGZVFWFLSA-N	447.455	1.692	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)[C@@H]2CC(=O)N(c3c(F)cccc3F)C2)cc1	771154233	SDIQAOSWUNJEQY-CQSZACIVSA-N	431.395	1.631	50	20	IDGD	
CN(CCNC(=O)NNC(=O)c1cccc2ncccc12)S(=O)(=O)c1cccs1	772017807	XVBVHLKLDSCKTQ-UHFFFAOYSA-N	433.515	1.561	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccc(I)cn1	773530394	JIDCZGMJMKBYGD-UHFFFAOYSA-N	442.188	1.154	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)Cc2csc(N3CCOCC3)n2)cc1	773714017	SRFORPWQNFYRFC-CQSZACIVSA-N	434.518	1.536	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc2cc(Br)ccc2c1)[C@H]1CCS(=O)(=O)C1	775257562	MKCMYEIGNNZRRN-LBPRGKRZSA-N	447.332	1.347	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1)c1ccc(OC)cc1	775639674	YRTPXZZGEYLJFZ-IBGZPJMESA-N	433.530	1.965	50	20	IDGD	
COC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(NC(=O)NNc3ccccn3)cc2)C1	779012366	UANKAZVIGXKBFU-CQSZACIVSA-N	433.490	1.804	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N2CC[C@H](O)[C@@H](C)C2)cc1	779270027	RWJDKDNFIHTCEC-HOEHRCRFSA-N	437.500	1.570	50	20	IDGD	
CCOC(=O)N1CCC([C@H](C)NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)CC1	779672932	GQUULJUTYMKZEE-ZDUSSCGKSA-N	444.492	1.135	50	20	IDGD	
N#Cc1ccc(N2CCC[C@H](NC(=O)NNC(=O)COc3ccccc3F)C2=O)cc1	779967685	YMCJAIJTULFRBA-KRWDZBQOSA-N	425.420	1.602	50	20	IDGD	
CCNC(=O)N(C)NC(=O)[C@H](CCS(C)(=O)=O)Cc1cccc(Br)c1	780709610	QWMBOJJCKLAIKV-CYBMUJFWSA-N	434.356	1.735	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)[C@@H]2C[C@]23CCN(C(=O)OC(C)(C)C)C3)c1	781288685	XFDOULZPDHRJJL-AOMKIAJQSA-N	431.489	1.946	50	20	IDGD	
CS(=O)(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2Cl)cc1	782928341	ZBFYAWQKZOYNFC-UHFFFAOYSA-N	444.296	1.938	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNc2ncnc3ccsc23)cccc1S(=O)(=O)NC1CC1	783262248	OKDISNWTNCVOBO-UHFFFAOYSA-N	446.514	1.522	50	20	IDGD	
CC(C)Sc1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)CNC(=O)c1ccco1	784002020	IXNRJIDDJFHXAV-UHFFFAOYSA-N	438.893	1.949	50	20	IDGD	
CCNS(=O)(=O)c1ccc2c(c1)N(C(=O)C(=O)NNc1cccc([N+](=O)[O-])c1C)CC2	784351220	CSKVRGMSUNGSBL-UHFFFAOYSA-N	447.473	1.234	50	20	IDGD	
O=C(NNc1ccc(OCC(F)(F)F)cc1)C(=O)Nc1cccnc1N1CCOCC1	784370630	ZFCUBKJECNEIAY-UHFFFAOYSA-N	439.394	1.941	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1C	785438753	IJOZTWVCSTYCHX-UHFFFAOYSA-N	444.513	1.813	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)C(=O)Nc1nc2c(s1)CCCCCC2	789770698	QNVXRJZEKSEIIS-UHFFFAOYSA-N	426.502	1.778	50	20	IDGD	
COC(=O)c1cc(C=NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)cn1C	790166518	JNMSDOKXNONBKW-UHFFFAOYSA-N	431.924	1.733	50	20	IDGD	
O=C(NNc1nc2ccccn2n1)C(=O)Nc1cc(N2CCCS2(=O)=O)ccc1Cl	792393312	CWKMVBXAIAPYND-UHFFFAOYSA-N	449.880	1.004	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc(OC(C)C)nn3)n[nH]2)cc1C	793024997	IVGIIQRJARXGHK-UHFFFAOYSA-N	437.460	1.670	50	20	IDGD	
COc1cc(OC)cc(C(=O)N2CCN(C(=O)NNC(=O)c3cccc(C)n3)CC2)c1	793220815	QRRCAEUXNPLBLH-UHFFFAOYSA-N	427.461	1.220	50	20	IDGD	
CC(=NNC(=O)[C@@H](C)CN1CCOCC1)c1cc(S(N)(=O)=O)c(Cl)cc1Cl	794478872	SRHUDYFAWRALHH-JTQLQIEISA-N	437.349	1.449	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)NC2CCCC2)(S(C)(=O)=O)CC1	795787383	SPLVTTCPKNCYIH-UHFFFAOYSA-N	432.543	1.074	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)Nc2cc(S(=O)(=O)N3CCCC3)ccn2)cc1C	797675145	AEEGRXSEOVLSTQ-UHFFFAOYSA-N	447.517	1.715	50	20	IDGD	
CC(C)(C)Nc1ccccc1NC(=O)C(=O)NNC(=O)c1csc(N2CCOCC2)n1	799260633	RQFMRZLJHFPKID-UHFFFAOYSA-N	446.533	1.590	50	20	IDGD	
NS(=O)(=O)CC1CCN(C(=O)NNC(=O)c2ccc(COc3ccccc3)o2)CC1	799857378	ORDMEPAMRJDGQK-UHFFFAOYSA-N	436.490	1.214	50	20	IDGD	
O=C(NNC(=O)[C@@H]1C[C@@H](O)CN1C(=O)OCc1ccccc1)Nc1cc(F)cc(F)c1	802006012	AFHZRWDGVQCKHT-SJORKVTESA-N	434.399	1.890	50	20	IDGD	
O=C(NCc1c(F)cccc1N1CCCC1)NNC(=O)C1CCN(c2ncccn2)CC1	805067753	CCQSMQOZDYJLDU-UHFFFAOYSA-N	441.511	1.963	50	20	IDGD	
CNC(=O)c1cccc(NC(=O)NNC(=O)COc2ccc(C#N)cc2)c1Br	806734865	GRYARRWCFKARMF-UHFFFAOYSA-N	446.261	1.912	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)N[C@H]1CCN(Cc2ccccc2)C1	807007341	DADPXMNJSJSZNM-KRWDZBQOSA-N	444.561	1.507	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C2(S(=O)(=O)c3ccccc3)CCOCC2)c1	807958876	IKSGNCIDGIHAEE-UHFFFAOYSA-N	448.497	1.488	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)Nc2cccc3c2OCC(=O)N3)c2ccccc2c1=O	810258311	UZVSMRDOCIQQRW-UHFFFAOYSA-N	436.428	1.775	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)c2cccc(C[S@@](C)=O)c2)c2ccccc2c1=O	810465719	KLUZWQYCQBFPHM-SSEXGKCCSA-N	426.498	1.931	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1)[C@H]1CCc2nncn2C1	815157088	IFKRAQDMTZKRDK-LEWJYISDSA-N	430.512	1.615	50	20	IDGD	
COc1ccc(I)c(NC(=O)C(=O)NNc2ncncc2F)c1	815764518	KKGMWMMILJQRKD-UHFFFAOYSA-N	431.165	1.311	50	20	IDGD	
Cc1nnnn1/C(=C\c1ccccc1)C(=O)NNc1ccccc1S(=O)(=O)N(C)C	817054919	DQDULSRVNGMOPP-LGMDPLHJSA-N	427.490	1.373	50	20	IDGD	
Cc1ccccc1[C@H](CC(=O)NNC(=O)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1)NC(N)=O	819658104	ISOWOYFGJSUZEF-WBVHZDCISA-N	447.536	1.889	50	20	IDGD	
O=C(/C=C\c1ccc(I)o1)NNC(=O)[C@@H]1COc2ccccc2O1	859443724	QHWGFNQFLWPLPO-WOLRVDTOSA-N	440.193	1.885	50	20	IDGD	
CCOC(=O)N1CCC[C@@H](C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)C1	912893541	LVUIMVGXHCFZFI-GOSISDBHSA-N	431.537	1.215	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)NC3CCCCC3)CC2)cc1	913450957	FKBMLEZPVVAEFH-UHFFFAOYSA-N	438.550	1.759	50	20	IDGD	
CS(=O)(=O)NCCCNC(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccccc1	914756478	GAIRPSTYJLDQFC-LGMDPLHJSA-N	426.502	1.426	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)[C@H](Cc2cccc(F)c2)n2nnnc2C)c1	915691392	ZXSNVNJMFGCKMD-SFHVURJKSA-N	428.424	1.383	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2ccc3c(c2)OCO3)ccc1OCC(=O)NC(C)C	916034335	CRIBMGPGJSVYAP-UHFFFAOYSA-N	429.429	1.402	50	20	IDGD	
CC(=NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1)c1cccc(-n2cnnn2)c1	916276646	KWPBIWSDNYZOQL-UHFFFAOYSA-N	427.490	1.132	50	20	IDGD	
O=C(NCCCn1cncn1)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	916376364	LOGUVFILKRWNDS-UHFFFAOYSA-N	449.518	1.175	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)NCc1ccnc(N2CCN(C)CC2)c1	916390854	ZZOSDHOAONMFIS-UHFFFAOYSA-N	426.521	1.305	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NC[C@@H]2CCN(c3ccccc3)C2)nc1	916579883	QQQNSTYHLMZEKL-INIZCTEOSA-N	432.550	1.921	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)N[C@@H]1CCN2CCCC[C@@H]12	916639257	SFLHWMIWJHIYOO-MSOLQXFVSA-N	435.550	1.042	50	20	IDGD	
CN(C)N(C(=O)[C@H]1CCN(c2cccc(Br)c2)C1=O)[C@H]1CCS(=O)(=O)C1	917621315	AIWHQBNSBFGCEP-GJZGRUSLSA-N	444.351	1.294	50	20	IDGD	
CCOC(=O)c1c(S(=O)(=O)NNC(=O)c2cc3c(s2)CC[C@H](C)C3)n[nH]c1C	917728400	SRCZUXSBAARILG-VIFPVBQESA-N	426.520	1.704	50	20	IDGD	
CN(CC(=O)NNC(=O)COc1ccc(C#N)cc1)C(=O)c1ccc(Br)o1	917908905	ZJJSKGSRUIECKN-UHFFFAOYSA-N	435.234	1.212	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1cccs1)C(=O)NNC(=O)c1ccc(Br)s1	917925530	FQZJGSSBEBWQPR-SSDOTTSWSA-N	438.350	1.700	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)/C=C\c1ccccc1)C(=O)NNC(=O)CC(F)(F)F	918363652	BJNVSDOFGIQECV-CHOZFAJLSA-N	439.481	1.798	50	20	IDGD	
O=C(NNC(=O)c1ccccc1F)c1ccc2c(c1)S(=O)(=O)N(C[C@H]1CCCO1)C2=O	918549711	MWXGWHIONAIEPL-CYBMUJFWSA-N	447.444	1.224	50	20	IDGD	
COC(=O)CNS(=O)(=O)c1cccc(NC(=O)/C(C#N)=C\c2cc(C#N)n(C)c2C)c1	918581114	GNPVTDHNGHDWEM-CHHVJCJISA-N	441.469	1.202	50	20	IDGD	
C[C@@H](Cc1ccc(O)cc1)NC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	919911025	FWGLYUGOKOJPHJ-HNNXBMFYSA-N	446.529	1.752	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)CN2C(=O)Cn3c(cc4ccccc43)C2=O)c1C	920274769	XNSQQURJKFDKTE-MRXNPFEDSA-N	448.479	1.855	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)C2=CC=CN3CCS(=O)(=O)N=C23)c1	921233063	IJFIMIXRDVFAMX-UHFFFAOYSA-N	432.502	1.142	50	20	IDGD	
NC(=O)[C@@H]1CC(C(=O)NNC(=O)Cc2nc(-c3ccccc3)cs2)=NN1c1ccccc1	935338331	LRMHCJKQJJQYJR-SFHVURJKSA-N	448.508	1.620	50	20	IDGD	
CCOCCOc1ccc(S(=O)(=O)NNC(=O)c2cncn2-c2ccccc2)cc1	1318010917	CRASXUCICIRZHA-UHFFFAOYSA-N	430.486	1.911	50	20	IDGD	
CC(=O)Nc1c[nH]nc1[C@H]1CCCN(C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)C1	1325063007	BHWGSKNMTOAFOX-HNNXBMFYSA-N	436.476	1.788	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)/C=C3\C(=O)Nc4ccccc43)C2)C1	1778910025	YIPWUBCVKCUCDY-GWXHHLPMSA-N	448.317	1.635	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(CCN(C(=O)C[C@H]3CNc4ccccc4O3)C2)C1	1778931719	QDHUFILAPCNVTL-JTSKRJEESA-N	447.608	1.931	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)C/N=C/c3ccco3)C2)C1	1779137738	DOPSQCMAVCIFCM-FRCMGPSKSA-N	426.311	1.702	50	20	IDGD	
COc1nccc(C(=O)N2CCO[C@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)c1F	1779296087	JLJCNGQKWOQPKC-IBGZPJMESA-N	425.533	1.524	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3c(-c4ccncn4)noc3C)C2)C1	1780049622	RRISOBHVRDIGLP-XOBRGWDASA-N	433.896	1.901	50	20	IDGD	
C=C(CC(=O)OCC)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Br)C1	1780774011	RVMPEKSHIDSNDD-DDUZABMNSA-N	449.317	1.700	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(CCN(C(=O)Cc3ccc(F)c(C#N)c3)C2)C1	1781301206	RKFWANCKKFTGKO-OAQYLSRUSA-N	433.556	1.921	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)n2ccnn2)C1	1781551719	CUFNCLBQUUZGGI-ATNYBXOESA-N	442.358	1.527	50	20	IDGD	
O=C(c1ccc(Br)c(O)c1)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1781694956	IKHOHIMKRNMNLS-PBHICJAKSA-N	447.713	1.198	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cccc(N4CCOCC4)c3)C2)C1	1781738427	ZTQCSCKNTJUOEL-UGKGYDQZSA-N	435.952	1.984	50	20	IDGD	
O=C(c1cc(O)cc([N+](=O)[O-])c1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1781938597	HWYXOJUREIPESV-CZUORRHYSA-N	446.229	1.434	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCc1cnn(C)c1)C2	1781998021	MSKDCNLSCJKHML-ZSZQSSIHSA-N	441.370	1.650	50	20	IDGD	
Cc1cnn([C@H](C)C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](F)Br)C3)c1	1782514128	JSTVGTBBERNUQG-ATNYBXOESA-N	445.333	1.957	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H]3C[C@@H]3F)C2)C1	1782930155	RIAPJMYPLIXCCT-WFTHSTBKSA-N	433.908	1.306	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccnc(Cl)n3)CCO2)C1	1783349353	KSTHOKXEJUPMJN-BZNIZROVSA-N	431.718	1.747	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)COC(=O)C(F)(F)F)CCO2)C1	1783349654	QMRCWCFLDSYEPZ-QMTHXVAHSA-N	445.232	1.095	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)C(=O)c3cccn3C)CCO2)C1	1783354536	STVKDSYZPDFZLR-UGSOOPFHSA-N	426.311	1.211	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(OC)c(OC)cc3C)CCO2)C1	1783879781	AUXYVYDSGKCRHM-IERDGZPVSA-N	440.924	1.710	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H](C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Cl)C[C@@H]32)C1	1788179949	JUQRQOQRTJQTQQ-YXMSTPNBSA-N	447.935	1.758	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)c1cc(-c2cccs2)on1	1788908144	PDHCVKNDQPJKGC-GMZLATJGSA-N	439.921	1.596	50	20	IDGD	
CCc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)CBr)C[C@@H]32)nn1C	1789065006	JQBWWUIAJPGXJA-RMRKRWHISA-N	441.370	1.607	50	20	IDGD	
CCSc1cccnc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21	1789420670	HFAODDFOXPVBOS-XQLPTFJDSA-N	427.954	1.387	50	20	IDGD	
COc1nccnc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]2C1	1789868828	MSVIGFOFAWNSQQ-PAKFGRKTSA-N	431.320	1.315	50	20	IDGD	
O=C(NC1(c2ccc(NC(=O)[C@@H]3[C@H]4C=CS[C@H]43)cc2)CCC1)c1cccc(B(O)O)c1	1791086579	BXOYUXQOQCBVIL-VAMGGRTRSA-N	434.326	1.989	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(OC)c(F)c3)C[C@@H]21	1791250905	QSXHWEMVLKRJGN-AFIMGQEJSA-N	428.888	1.681	50	20	IDGD	
O=C(CCc1cccc(O)c1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21	1791399891	VFDJGMNTWAMWPJ-MBGYTDRXSA-N	443.313	1.995	50	20	IDGD	
CCOc1ncccc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)CBr)C2	1792378225	LKLNTMDWAQRRRJ-AYDFFVQHSA-N	440.338	1.715	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1[nH]nc3ncccc13)C2	1792868080	OODYHWUXRYIQND-FMSGJZPZSA-N	436.310	1.192	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3ncsc3[nH]1)C2	1792870299	BNJLLHNPAPWSSX-NJBDSQKTSA-N	441.351	1.859	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(C(=O)O)n(C(C)C)n1)C2	1793445452	JANMPARVJYMKDR-LOUJCGABSA-N	440.928	1.773	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ncc(F)cc1F	1793811412	LLJTWTUTZWCCAK-JGJQQFHASA-N	444.442	1.746	50	20	IDGD	
Cc1cccc(-c2ncccc2C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](O)CCl)C3)c1	1796009757	DSHVUFUWRIKNQD-PIKOESSRSA-N	443.931	1.860	50	20	IDGD	
CCOc1cccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)c1O	1796189462	PNIIYSFCGDNCIM-BCDXTJNWSA-N	438.289	1.036	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)Br)C2	1796838775	XAWODRIRASRBEL-ZIEJDFEHSA-N	435.322	1.629	50	20	IDGD	
CC(C)c1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)CBr)C3)n[nH]1	1798665787	RPGPINXQSIFDPQ-JFILPPLUSA-N	427.343	1.767	50	20	IDGD	
Cc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)CBr)C3)nn1C(F)F	1798674761	YUCKBXLNBBWHAN-SGESHTKJSA-N	449.296	1.821	50	20	IDGD	
Cc1cc(NC(=O)CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@](C)(Cl)CCl)no1	1799275493	SORUNJGJSXQAEK-XBCDXLOZSA-N	447.319	1.138	50	20	IDGD	
COc1ncc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@](C)(Cl)CCl)cc1F	1799277370	QGYHPHMIEPXDFM-AZGFTEDZSA-N	434.295	1.669	50	20	IDGD	
COc1cccc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Br)n1	1799344937	YMAYYSKWWZWYCU-CZAMWMTLSA-N	444.301	1.303	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1cc(F)cc([N+](=O)[O-])c1	1799631084	NXRKYHHKGDHHCA-DJBIQUGXSA-N	448.220	1.628	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1nnc(C)s1)C2	1800639841	OWIIBDUPLYOXHY-OXIQGZBJSA-N	431.356	1.152	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCOc1ccc(F)cc1)C2	1800754665	TYOKZCNHJNERLN-ZUMXRPEOSA-N	443.313	1.968	50	20	IDGD	
Cc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)Br)n(C(F)F)n1	1800760279	MJSILGSZVOXVJE-HNCHTBHHSA-N	435.269	1.573	50	20	IDGD	
CCc1nn(C)c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](Cl)COC)c1Cl	1800973484	AOQRNMDLQYKVRO-NWJSVONSSA-N	433.336	1.093	50	20	IDGD	
Cc1cc2cc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)c3ccc(B(O)O)cc3)C4)ccc2[nH]1	1801164587	HAIHZWOGNCSTBH-WKCHPHFGSA-N	431.301	1.722	50	20	IDGD	
CCN(CC)C[C@@H](C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2	1801283162	XRSVEDJLRZOXLH-YMUBQMKBSA-N	444.580	1.737	50	20	IDGD	
O=C(CCN1C(=O)C=CC1=O)NC[C@H]1CCN(C(=O)C(Cl)Cl)[C@@H]1c1cccnc1	1803916687	JHHNHHWSTRLTIH-CXAGYDPISA-N	439.299	1.206	50	20	IDGD	
COc1nn(C)cc1C(=O)NC[C@@H]1CCN(C(=O)C(Cl)Cl)[C@@H]1c1cccnc1	1805308503	QUTGJNFUUCZTTA-GXTWGEPZSA-N	426.304	1.947	50	20	IDGD	
Cc1ccc(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)cn1	1805455578	UTVIGRXQXPQRLZ-UGKGYDQZSA-N	444.300	1.098	50	20	IDGD	
C[C@H]1CC[C@H](C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)CC1	1807376402	YSGXPWWICKGNJD-ZVEOBBNSSA-N	449.360	1.907	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)C(Cl)Cl)[C@@H]1c1cccnc1)c1cnc(O)nc1O	1808282989	ZAQPCMSUMGJCNU-CMPLNLGQSA-N	426.260	1.406	50	20	IDGD	
O=C1CC[C@H](C(=O)N2CC[C@H](CNC(=O)[C@H](F)Br)[C@@H]2c2cccnc2)N1	1808662293	XHPZADGMAVQGGP-UXOAXIEHSA-N	427.274	1.057	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC2(CCCN(C(=O)Cc3cccnc3)C2)CC1	1810166068	XIHLISFPJYAIOW-UHFFFAOYSA-N	436.516	1.168	50	20	IDGD	
Cc1cc(C(=O)NCC(=O)NC[C@@H]2CCN(C(=O)[C@H](F)Cl)[C@H]2c2cccnc2)no1	1810375536	IZFYCEREUVMKBO-JQFCIGGWSA-N	437.859	1.348	50	20	IDGD	
CC(=O)N[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1	1812649025	WWQUNTYPRSDINQ-PVUWLOKVSA-N	425.327	1.397	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CN2CCOC2=O)n[nH]1	1815023882	VSIDNZSZVYFABG-DGCLKSJQSA-N	442.314	1.885	50	20	IDGD	
C[C@@]1(C(=O)N[C@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)CC=CCC1	1815361744	QHVSWVGVLIZHEZ-KSFYIVLOSA-N	439.346	1.795	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](F)Br)[nH]n1)c1cccc(=O)n1O	1816148879	NHPNVIFFNIBSJN-IINYFYTJSA-N	442.245	1.805	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H]1CCCO1)CC2	1817279769	CYXNLCLHQVSLGM-BLKQIODTSA-N	444.517	1.368	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H]1C[C@@H]1F)CC2	1817283085	ULTRZHXYZMOCGU-DYDUWRGWSA-N	432.481	1.547	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2csc(N)n2)n[nH]1	1817389184	RRAGNIAYBNCSOL-ZDUSSCGKSA-N	434.526	1.127	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1	1817473831	BTMQLEWEPDXNEE-NVXWUHKLSA-N	432.717	1.803	50	20	IDGD	
Cc1cscc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2	1817568216	JGXIUCWUUGCONG-CQSZACIVSA-N	441.343	1.732	50	20	IDGD	
CC(C)CNC(=O)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCBr)[nH]n1	1818132319	PYNPTLAIQLEIJL-CYBMUJFWSA-N	428.331	1.959	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1822182924	GJRXNGTUULOLLC-ABAIWWIYSA-N	449.114	1.179	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)ccc2O)[nH]n1	1822415657	MTWXOLREXPWRQY-MRXNPFEDSA-N	444.492	1.500	50	20	IDGD	
C[C@@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1)C1(O)CCC1	1823733454	WNUPRKXZKBZYFB-LAUBAEHRSA-N	442.365	1.151	50	20	IDGD	
Cc1ccc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)nc1	1827051367	VQDMWWXOSNLMSB-QFIPXVFZSA-N	435.333	1.617	50	20	IDGD	
O=C(c1ccc(O)nc1)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827056659	PVYUAOVQEXLJPH-HXUWFJFHSA-N	437.305	1.014	50	20	IDGD	
C[C@]1(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2cccc(B(O)O)c2)CC3)CC1(F)F	1828048084	VDCRWJSHKKCWDI-KZULUSFZSA-N	435.261	1.094	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2nc3ncccn3n2)CC1	1828179565	BZZBFFBCIRSWNT-HOTGVXAUSA-N	434.928	1.611	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)c2ccc(O)nc2)CC1	1829722787	AQKDFENLQBUGTI-HXUWFJFHSA-N	437.305	1.014	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)/C=C/c3cccc(C)n3)CCO2)C1	1829728360	LPITVUBMSBKVIV-ZETQTWJXSA-N	437.924	1.113	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CC[C@H](N)C(N)=O)CC1	1830315780	DTKMGEUIDMRAJD-DOXZYTNZSA-N	435.396	1.435	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccn4cncc34)C2)C1	1830362393	UXLVMDAXVSYWNX-OAQYLSRUSA-N	434.924	1.669	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCCn3ccnc3)C2)C1	1830370194	LLXVRFGOYLWGKN-FQEVSTJZSA-N	426.945	1.385	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cccc(OC)n3)C2)C1	1831640517	NCLKGWWQPLWGPQ-LAUBAEHRSA-N	439.940	1.497	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)C3CCC(CO)CC3)C2)C1	1831641185	WPUNEJAWJHSXMS-PKZBPHAMSA-N	430.973	1.649	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCC(=O)N3CCCC3)CCO2)C1	1832418901	QUOPFKKMSMDLSA-LAUBAEHRSA-N	443.972	1.253	50	20	IDGD	
COC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)[C@@H](C)CBr)CC2)CC1	1833262235	KWYRMPNIQRZNOZ-AWEZNQCLSA-N	446.386	1.542	50	20	IDGD	
COc1ccc(C)c(C(=O)N2CCC(N3CCC(NC(=O)[C@H](O)CCl)CC3)CC2)c1	1833313897	SEBZMBOUEXPVLO-HXUWFJFHSA-N	437.968	1.789	50	20	IDGD	
C[C@@H](CC(N)=O)C(=O)NC1CCN(C2CCN(C(=O)[C@](C)(Cl)CCl)CC2)CC1	1833521977	DNDVKSIBTXCBCS-ORAYPTAESA-N	435.396	1.306	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3cn(C)cn3)CC2)CC1	1834288040	XZKRKBGAMWBABC-ZDUSSCGKSA-N	426.359	1.389	50	20	IDGD	
O=C(Cc1cnc[nH]1)NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1	1835063745	PBOFCTKUBUNKRD-INIZCTEOSA-N	430.322	1.214	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)c1cccc2c1OCC2	1835284739	UGFSSFAJBJVFOC-IBGZPJMESA-N	435.952	1.406	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)c1ccn2cncc2c1	1835604248	IXJOHOMWCCXPLF-LJQANCHMSA-N	433.940	1.119	50	20	IDGD	
O=C(CCc1cccnc1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1836182713	RQCDHBZOHOCGOC-AEFFLSMTSA-N	444.301	1.161	50	20	IDGD	
CC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](N)Cc3cscn3)CC2)CC1	1836394231	OHESJQKTAKIRQP-ROUUACIJSA-N	442.029	1.602	50	20	IDGD	
CCC(=O)N[C@H](C)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](F)Br)CC2)CC1	1836413562	JGEQDFGJLVAOQN-MLGOLLRUSA-N	449.365	1.163	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)c(C)n1C	1837715334	KTJURDKAHVAYCU-OAQYLSRUSA-N	437.613	1.563	50	20	IDGD	
COCCOCC(=O)N1CCC(OC2CCN(C(=O)CO[Si](C)(C)C)CC2)CC1	1837767450	IOWNOPYRPPRAKF-UHFFFAOYSA-N	430.618	1.500	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cnc(O)nc3O)CC2)CC1	1838077007	UECRNFIYKKSCLE-HNNXBMFYSA-N	426.901	1.517	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)C3CN(C)C3)CC2)CC1	1838766151	XYLUNPTXLICTRM-QGZVFWFLSA-N	430.387	1.720	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccc4c(c3)CCO4)C2)C1	1839147711	AGNUYGIQISYZJR-GCJKJVERSA-N	436.936	1.638	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc4cc(C)ccn34)C2)C1	1839148386	XITIWDBTOKYLHR-HRAATJIYSA-N	434.924	1.730	50	20	IDGD	
COc1c(C)cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)cc1C	1839392215	BCGCMKISOLJYKL-FXAWDEMLSA-N	428.888	1.916	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(O)ccc3O)CCO2)C1	1839446182	HGLSYTWKRSVKNG-OXJNMPFZSA-N	426.897	1.575	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc4c3NC(=O)C4)CCO2)C1	1839573844	DBGFOFYPVGQMJV-IERDGZPVSA-N	435.908	1.269	50	20	IDGD	
CC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](Br)Cc1ccccc1)CCO2	1839801792	CYGTUPFFYSNVGC-HKUYNNGSSA-N	425.323	1.469	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](S)C(C)C)C2)C1	1839963107	ZZESKWVOAHAPAN-VBQJREDUSA-N	437.400	1.571	50	20	IDGD	
O=C(Cn1cnc2ccccc21)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840190889	SQJGPONJEHPESQ-IBGZPJMESA-N	441.315	1.296	50	20	IDGD	
CCOC(CC(=O)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1)OCC	1840282260	JGUYTHPLAJYASW-KRWDZBQOSA-N	427.325	1.036	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(F)cc3OC)CCO2)C1	1840641114	OOZOVMRPGYQNOE-UZLBHIALSA-N	428.888	1.922	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)cc1	1840726588	BOQHWDNNOFPYBZ-QFBILLFUSA-N	427.860	1.249	50	20	IDGD	
CCSc1ncccc1C(=O)N1CCCC12CN(C(=O)c1cnccc1C(=O)NN)C2	1840990053	ISDSIBDFKISHFX-UHFFFAOYSA-N	440.529	1.323	50	20	IDGD	
C=CCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1	1841352983	XOGVEUMZCUUFAY-LSDHHAIUSA-N	429.945	1.649	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@H]2CC(=O)CN2C(=O)OC(C)(C)C)C1	1841433424	ARTVZTDYLFRNTH-CABCVRRESA-N	427.929	1.786	50	20	IDGD	
C[C@@H](CC(N)=O)C(=O)N1CCCC12CN(C(=O)[C@H](Br)Cc1ccccc1)C2	1841658975	RPUILFSUNOIZPY-GOEBONIOSA-N	436.350	1.708	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1cc3ncsc3[nH]1)C2	1843416344	ZEHPHBDNNCWEDD-WYMPLXKRSA-N	439.501	1.575	50	20	IDGD	
O=C([C@H](O)CCl)N1CC2(CCCN2C(=O)c2c[nH]c3ncc(C(F)(F)F)cc23)C1	1844068337	UDVYMFIMKGXYLM-CYBMUJFWSA-N	430.814	1.998	50	20	IDGD	
Cn1c(=O)c(C(=O)N2CC3(CCCN3C(=O)[C@](C)(Cl)CCl)C2)nc2ccccc21	1845170626	FFCFTGWSAXGGSW-LJQANCHMSA-N	437.327	1.987	50	20	IDGD	
C[C@H](NC(=O)c1ccccn1)C(=O)N1CCCC12CN(C(=O)[C@@H](F)Br)C2	1845770416	UEDXGOYMTFXXIO-WCQYABFASA-N	427.274	1.094	50	20	IDGD	
CCOC(=O)c1ncn2c1CC[C@H](C(=O)N1CCCC13CN(C(=O)C(Cl)Cl)C3)C2	1845863878	WGRHBLHHDPDINC-LBPRGKRZSA-N	443.331	1.629	50	20	IDGD	
Cc1nc(C(=O)N2CC3(CCCN3C(=O)CCC(=O)NN(C)C)C2)c(C(F)(F)F)o1	1846384894	WIIKEBRNBHFODT-UHFFFAOYSA-N	431.415	1.192	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1ccc2c(c1)n(C)c(=O)n2C	1847501081	LUDBSOMHHRFVPN-RCBQFDQVSA-N	449.349	1.723	50	20	IDGD	
C=CC[C@H](CC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl)NC(=O)OC(C)(C)C	1847568006	JSNLWEPYPXQDPD-UGUYLWEFSA-N	429.945	1.647	50	20	IDGD	
O=C(COC(=O)c1ccc2c(=O)n3c(nc2c1)CCCCC3)NNC(=O)c1ccccc1	3531409	JZDJIMKKNJJFTI-UHFFFAOYSA-N	434.452	1.741	50	20	IDGD	
C=CCOc1ccc(C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)cc1OC	12702911	DYYYPTOUFZLEAC-UHFFFAOYSA-N	432.502	1.936	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1ccc(N2CCOCC2)nc1	21590690	MMZUKMGZTAFACU-UHFFFAOYSA-N	448.863	1.198	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@H](C(=O)NNC(=O)COc2ccccc2F)C(C)C)cc1	26696583	UDMFKBDVDMHLDV-IBGZPJMESA-N	437.493	1.663	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NCc1ccc(CN2CCCC2=O)cc1	725872201	BLQBPWWJOLMLGB-UHFFFAOYSA-N	429.502	1.131	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cnn(C)c2C(F)F)c1	727364380	MIQYWIYVXOLOGV-UHFFFAOYSA-N	429.449	1.463	50	20	IDGD	
CNS(=O)(=O)c1cccc([C@H](C)NC(=O)NNC(=O)c2cc(OC)cc(OC)c2)c1	727607300	ATJNOKDYKQTMMJ-LBPRGKRZSA-N	436.490	1.317	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)N[C@H](C)c1cccc(S(=O)(=O)N(C)C)c1	727609398	KIZOMVMSPVJVPK-OAHLLOKOSA-N	448.545	1.970	50	20	IDGD	
COc1ccc(CC(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)cc1[N+](=O)[O-]	727672086	ZQZHVNDPRIXMFH-UHFFFAOYSA-N	439.428	1.898	50	20	IDGD	
O=C(CCCc1ccccc1)NNC(=O)c1cccc(S(=O)(=O)NC[C@H]2CCCO2)c1	727860291	BJLRYAOKHCAYFH-LJQANCHMSA-N	445.541	1.928	50	20	IDGD	
CCN(C)C(=O)c1cccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1	729297656	CNKQYHMTDKPDHP-UHFFFAOYSA-N	432.502	1.104	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)N[C@@H]1CCN(c2ccc(F)cc2F)C1	730137632	YEPKATHRWLCGDB-CQSZACIVSA-N	428.403	1.163	50	20	IDGD	
Cc1nonc1C(=O)NNC(=O)CCN1CCN(C(c2ccccc2)c2ccccc2)CC1	733910787	JNSJVYYTYSNOOR-UHFFFAOYSA-N	448.527	1.936	50	20	IDGD	
CC(C)C(=O)Nc1nc(CC(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)cs1	734241505	HKWDLUOJBAYXLY-UHFFFAOYSA-N	428.515	1.135	50	20	IDGD	
CNS(=O)(=O)c1ccc(C(=O)NNc2ccccc2S(=O)(=O)NC(C)(C)C)cc1	734252213	ITTVQYPDZMRBMS-UHFFFAOYSA-N	440.547	1.428	50	20	IDGD	
CC(C)Oc1cccc(CC(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)c1	735117679	FTYRRXOYSAMXHV-UHFFFAOYSA-N	447.561	1.491	50	20	IDGD	
CC[C@H](OC1CCCC1)C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	735117710	GUWDHFYSNVZYOW-INIZCTEOSA-N	425.555	1.199	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)NCCNc2nccc(C(F)(F)F)n2)cc1	739045845	NUMYYJIAWDXKRQ-UHFFFAOYSA-N	426.399	1.879	50	20	IDGD	
CCCOc1ccc(C(=O)NNS(=O)(=O)c2cccc(-c3nnnn3C)c2)cc1OC	742025725	HLRRJWDVHKOGNG-UHFFFAOYSA-N	446.489	1.298	50	20	IDGD	
O=C(NN=C1CCCc2c(O)cccc21)c1cccc(S(=O)(=O)N2CCOCC2)c1	743418427	YUNFAQSZSYUSOV-UHFFFAOYSA-N	429.498	1.884	50	20	IDGD	
CC/C=C(\C)C(=O)N1CSC[C@H]1C(=O)OCC(=O)NNC(=O)c1cccc(C#N)c1	744973903	QIVUADPVPUFOAJ-RBBXRFMQSA-N	430.486	1.120	50	20	IDGD	
C[C@@H]1C[C@@H](NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)C(=O)N1c1ccccc1	745881748	LWUJVSFAEJCYEE-CXAGYDPISA-N	434.456	1.072	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)N[C@@H](C)c1nc(C(C)(C)C)no1	745917782	PLGZFRNBLNZRAF-NSHDSACASA-N	437.526	1.674	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)C2CC(OCc3ccccc3)C2)ccc1Cl	746821275	GZABBGANYOPGPY-UHFFFAOYSA-N	437.905	1.744	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCCCC2)cc1)NNC(=O)Cc1ccncc1	747322886	RTLUXDDOEJWQBS-UHFFFAOYSA-N	430.530	1.579	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1)NNc1cccc([N+](=O)[O-])c1	747995832	OZACTTWDJQLCIS-UHFFFAOYSA-N	434.352	1.915	50	20	IDGD	
CC[C@H](Oc1ccccc1F)C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	748287355	LPISNKVGIGPXOE-ZDUSSCGKSA-N	429.857	1.745	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN1C(=O)c1ccc2c(c1)OCO2)c1ccc([N+](=O)[O-])cc1	749562973	USOQVRPWKYSDTG-HNNXBMFYSA-N	426.385	1.389	50	20	IDGD	
N#C/C(=C\c1ccc(O)cc1)C(=O)OCC(=O)N(C1CCCC1)[C@@H]1CCS(=O)(=O)C1	750664861	YUMICCDLCQPXPH-QIPHDZALSA-N	432.498	1.801	50	20	IDGD	
O=C(C[C@H]1CSCCS1)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	751549174	RCPKOCWXARXKDV-AWEZNQCLSA-N	429.589	1.471	50	20	IDGD	
CC(C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)=C1CCCC1	753572549	KGFDQYBAPRBLCH-UHFFFAOYSA-N	435.546	1.678	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCc2ccc3c(c2)C(=O)NCC3)cc1Br	754199814	FNWJOVHHAOGBRM-UHFFFAOYSA-N	447.289	1.888	50	20	IDGD	
N#C/C(=C/c1ccc(O)cc1)C(=O)OCC(=O)NCc1ccccc1CN1CCOCC1	754539069	WIVNKGDDVJBKAT-BKUYFWCQSA-N	435.480	1.991	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2ccc(NC(=O)COC)cc2)c2ccccc2c1=O	755637116	CDHXBYSOLJYYRQ-UHFFFAOYSA-N	438.444	1.468	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)Nc2cccc(-n3nnnc3C)c2)n[nH]1	755757864	GZRADRBPWDXQPQ-UHFFFAOYSA-N	433.432	1.836	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)Nc2cc(N3CCCS3(=O)=O)ccc2F)cc1	756155612	SMJCSJJBTUXNDI-UHFFFAOYSA-N	447.448	1.469	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2ccc(-c3ncon3)cc2)cc1	756317464	YJORYXOEDIYKQN-UHFFFAOYSA-N	444.473	1.518	50	20	IDGD	
NC(=O)CCNC(=O)c1cccc(NC(=O)NNC(=O)c2cccc(C(F)(F)F)c2)c1	756394352	VYIULICPFIGFLA-UHFFFAOYSA-N	437.378	1.777	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1cccc(CN(C)C(=O)OC(C)(C)C)c1	756665958	XJWUVABLIVJBKG-GFCCVEGCSA-N	443.526	1.144	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)C(F)(F)c1nccs1	756862472	QQKDZLCQRMTABE-UHFFFAOYSA-N	443.907	1.854	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)CN2C(=O)N[C@]3(C[C@@H](C)C[C@@H](C)C3)C2=O)c1	756865252	OXCBDVXJYWTQHQ-MFKICJERSA-N	430.505	1.576	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)N[C@@H]2CCN(c3ccccc3OC)C2=O)cc1	757286707	OBTOBTAANBBWGI-MRXNPFEDSA-N	428.445	1.219	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)[C@H]2COc3ccccc3O2)ccc1Cl	757472967	LXCJARSCADNGFH-OAHLLOKOSA-N	426.834	1.276	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)[C@H]1COc2ccc(Br)cc21	760437056	AOUPXNAXFUOJJO-LBPRGKRZSA-N	428.283	1.987	50	20	IDGD	
Cc1cc(S(C)(=O)=O)c(C)c(S(=O)(=O)NNC(=O)CSc2ccccc2O)c1	763399075	RNACDHFICOZMOB-UHFFFAOYSA-N	444.556	1.514	50	20	IDGD	
O=C(NNC(=O)c1c[nH]c2ccccc12)C(=O)Nc1cccn(Cc2ccc(F)cc2)c1=O	763536090	LFFQSMVFBPHERK-UHFFFAOYSA-N	447.426	1.917	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)c(OC[C@@H]2CCCO2)c1	763550575	FQRHALYEJIDGTM-HNNXBMFYSA-N	441.440	1.681	50	20	IDGD	
CCOC(=O)N(C)c1ccc(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1	763569732	ATJNKRWXVPSVJL-QGZVFWFLSA-N	442.428	1.205	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)Nc1cccc(COCC2CC2)c1	763573379	ZZHJXDTZVRLSDN-IBGZPJMESA-N	425.441	1.539	50	20	IDGD	
O=C(NNC(=O)c1sc2ccccc2c1Cl)C(=O)Nc1ccc(-n2cncn2)nc1	763577728	KLPKALUVAKZHLU-UHFFFAOYSA-N	441.860	1.930	50	20	IDGD	
CCc1nnc(-c2ccc(NC(=O)C(=O)NNC(=O)COc3ccccc3OC)cc2)o1	763663712	MZEZRRIFPWJOAA-UHFFFAOYSA-N	439.428	1.473	50	20	IDGD	
CS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(Cl)c2)cc1Cl	763748011	SBCTXNWVALLGBB-UHFFFAOYSA-N	445.284	1.765	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc3c2oc(=O)n3C)cc1	763766668	BRFFHGQAIHGRQD-UHFFFAOYSA-N	440.456	1.956	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)C(=O)Nc1ccn(CCN(C)C)n1	763851735	VMIFIJREDLVAKV-HNNXBMFYSA-N	438.488	1.151	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1cnn(-c2ccccc2F)c1	763866669	QTRCTFSMDDPGAB-LBPRGKRZSA-N	429.383	1.704	50	20	IDGD	
COCCOc1ccc(C#N)cc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccc(F)cc1	763870619	ARJLXLHYASROMW-ZDUSSCGKSA-N	444.419	1.276	50	20	IDGD	
COC(=O)N(C)c1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)cc1	763871525	HIDLWIYHLWYIJI-GFCCVEGCSA-N	432.408	1.582	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(-n3ccnn3)cc2)cc1	763878336	OXIAEXCFCUIPRB-CQSZACIVSA-N	436.428	1.023	50	20	IDGD	
CCc1ncc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(Br)c2)cn1	763882851	MDGRCJBPRFPNDW-JTQLQIEISA-N	436.266	1.355	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccc(Sc3ncccn3)cc2C)n1	763885054	JAMUDUCNIPOTAP-UHFFFAOYSA-N	439.501	1.536	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccnc(Sc3ccccn3)c2)n1	763893212	PNSAWIXSXVRUHL-UHFFFAOYSA-N	425.474	1.227	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)Cc2ccc(F)cc2)ccc1N1CCCC1=O	763918631	HWYWGPFVNRHDRK-UHFFFAOYSA-N	428.420	1.290	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3ccc4c(c3)n(C)c(=O)n4C)cc2C1	763940296	DUKZDENNIYHRLJ-LLVKDONJSA-N	441.513	1.463	50	20	IDGD	
CCOC(=O)c1ccccc1NC(=O)C(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	763945047	SQDMKIOAHPXLSD-UHFFFAOYSA-N	437.412	1.154	50	20	IDGD	
CCN1CCN(Cc2ccc(NC(=O)C(=O)NNC(=O)Cc3ccsc3)cc2)CC1	764036050	WUERIDKIWIDZNL-UHFFFAOYSA-N	429.546	1.214	50	20	IDGD	
O=C(NNC(=O)c1ccc2ccccc2c1)C(=O)Nc1ccccc1CN1CCNC1=O	764064697	OIMRYMMNNFHPCR-UHFFFAOYSA-N	431.452	1.765	50	20	IDGD	
CN(c1ccccc1)S(=O)(=O)c1cccc(NC(=O)C(=O)NNC(=O)C2CCCC2)c1	764078055	XGDAGLYKGNGZBB-UHFFFAOYSA-N	444.513	1.788	50	20	IDGD	
COc1ccc(C(=O)N2CCCC2)cc1NC(=O)C(=O)NNC(=O)c1ccc(C)cc1O	764109855	LWOMXUNXYSKHKH-UHFFFAOYSA-N	440.456	1.345	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc([S@](=O)C(F)(F)F)cc2)c1O	764131078	MOROZJHFEQNNGH-PMERELPUSA-N	445.375	1.428	50	20	IDGD	
C[C@@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(NC(=O)C(=O)NNC(=O)CC3CC3)cc2)C1	764141564	BSZRQCXLEYBZKT-ZIAGYGMSSA-N	436.534	1.239	50	20	IDGD	
Cn1ccnc1Sc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)cc1	764153641	MZIVAOURJBWXKT-QGZVFWFLSA-N	437.481	1.661	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(C#N)cc2)c(OC(F)F)c1	764177830	WCFXFWHQCWCGQK-UHFFFAOYSA-N	432.339	1.346	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1ccc2c(c1)ncn2-c1ccccc1	764277643	GDRPOGUIJVHWGB-UHFFFAOYSA-N	445.435	1.896	50	20	IDGD	
N#Cc1c(F)cccc1-n1ccc(NC(=O)C(=O)NNC(=O)CCc2ccccc2O)n1	764278210	MVRNNDUGWHIQQI-UHFFFAOYSA-N	436.403	1.307	50	20	IDGD	
Cn1cc(Br)cc(NC(=O)C(=O)NNC(=O)C(C)(C)c2ccccc2)c1=O	764302555	NLFACGRYZIRKTN-UHFFFAOYSA-N	435.278	1.212	50	20	IDGD	
C#CCNS(=O)(=O)c1cccc(C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)c1	764334901	LHLHEAOHQKDUQM-UHFFFAOYSA-N	448.451	1.525	50	20	IDGD	
O=C(CCCc1cccs1)NNC(=O)C(=O)Nc1ccc(N2C(=O)CCCC2=O)cc1	764340230	WGJSCQOOAZYSNF-UHFFFAOYSA-N	442.497	1.900	50	20	IDGD	
COC(=O)c1cc(OC)ccc1NC(=O)C(=O)NNC(=O)c1cc(-c2cccs2)[nH]n1	764385123	RZWWZKXHBUYDQH-UHFFFAOYSA-N	443.441	1.333	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1ccc2c(c1)nc(C)n2C	764393156	CULWULRHJAINBG-UHFFFAOYSA-N	427.486	1.769	50	20	IDGD	
COc1ccc(C(=O)NNc2nccnc2OC)cc1S(=O)(=O)Cc1cc(C)no1	764465534	YNHYECAZKZGGGX-UHFFFAOYSA-N	433.446	1.521	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=S)NC1CCOCC1	764519604	RTKCUAMBGFIAFI-UHFFFAOYSA-N	425.986	1.132	50	20	IDGD	
COc1cccc(-c2cc(C(=O)NNC(=O)c3ccc(Cl)c(S(N)(=O)=O)c3)n[nH]2)c1	764554848	YEGBQFMXGHRYTD-UHFFFAOYSA-N	449.876	1.461	50	20	IDGD	
C[C@@H](NC(=O)c1ccoc1)C(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	765757804	GKJCFKMAPHMSES-OAHLLOKOSA-N	447.923	1.017	50	20	IDGD	
O=C(NCc1ccc(O)c(Br)c1)NNC(=O)c1cc([N+](=O)[O-])ccc1O	767230875	FPCRYAKSYLTORF-UHFFFAOYSA-N	425.195	1.913	50	20	IDGD	
COc1ccccc1N1C[C@@H](C(=O)OCC(=O)NNC(=O)Cc2ccccc2C)CC1=O	767263948	YAFQRDHDYBPFSA-KRWDZBQOSA-N	439.468	1.290	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)CCC(=O)N1CCN(c2ccccc2)CC1	767734781	NNGMFGCIQNYPJJ-UHFFFAOYSA-N	438.528	1.904	50	20	IDGD	
Cc1ccc(C)c(N2CCN(C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)CC2)c1	767944178	WJRKIKOVZMCFBD-UHFFFAOYSA-N	437.548	1.873	50	20	IDGD	
CC(C)(C)[C@@H](Br)C(=O)N1CCC(C(=O)NCCCN2CCOCC2)CC1	768178825	DSTPZAGOBAXHEN-INIZCTEOSA-N	432.403	1.873	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)CSc3nncn3C(C)C)n[nH]2)cc1OC	768279477	PLXQAAKJXODIRM-UHFFFAOYSA-N	445.505	1.820	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1cc2ccccc2cc1O	768290671	LTIDXBHTUVTVGO-UHFFFAOYSA-N	432.480	1.764	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)c1nccn2c(Br)cnc12	770151219	QLIZFPIODXVODL-UHFFFAOYSA-N	441.286	1.558	50	20	IDGD	
CSCCNC(=S)NNC(=O)c1cccnc1S[C@H](C)C(=O)N1CCCC1	770244808	AAPMYZAWBDSPDB-GFCCVEGCSA-N	427.621	1.657	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)Nc1ccnn1[C@H]1CCS(=O)(=O)C1	770759252	NPDCZDOXTIEQRR-YPMHNXCESA-N	441.897	1.516	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)c3ccc(-n4cc(Br)cn4)cc3)nc21	770972552	JBSSAWJNXXAJDQ-UHFFFAOYSA-N	429.238	1.774	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)[C@H]3CCCN(C(=O)c4ccc(Cl)cc4)C3)nc21	770990265	MXYDVBVATCXDER-LBPRGKRZSA-N	429.868	1.718	50	20	IDGD	
C[C@@H](CC(=O)NNc1ccnc(Br)c1)/N=C1/NS(=O)(=O)c2ccccc21	771530423	CFALOKQUBRGHOU-JTQLQIEISA-N	438.307	1.805	50	20	IDGD	
Cc1nc(-c2cnn(C)c2)sc1C(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772195668	CPIJEUOUVYQQLH-UHFFFAOYSA-N	432.893	1.583	50	20	IDGD	
Cc1cc(S(=O)(=O)NCCNC(=O)NNC(=O)COc2ccc(F)cc2)c(C)s1	772625404	OUFCNOAEVUTOIM-UHFFFAOYSA-N	444.510	1.192	50	20	IDGD	
C[C@H](NS(=O)(=O)c1cccs1)C(=O)NNC(=O)[C@H](C)Oc1cccc(Cl)c1	772965354	XIIUPETWPZBDOV-QWRGUYRKSA-N	431.923	1.683	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)c2cncc(NC(C)=O)c2)ccc1OCC(=O)OC	773082545	ZAHWMSMRWVJHSR-UHFFFAOYSA-N	430.417	1.065	50	20	IDGD	
Cn1cnc(-c2ccc(C(=O)NNC(=O)[C@H]3CCCN(C(=O)OC(C)(C)C)C3)cc2)n1	773410584	DPDJFXLJBYVUAX-INIZCTEOSA-N	428.493	1.890	50	20	IDGD	
COC(=O)c1c(F)cccc1NNC(=O)CN1C(=O)N[C@](C)(c2ccc(C)cc2)C1=O	773640293	BRFMYPVDKDVMFM-OAQYLSRUSA-N	428.420	1.831	50	20	IDGD	
CCOC(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)c1	774007341	GDALJJAWQGTQJX-ZDUSSCGKSA-N	447.875	1.999	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@H]2CCCO[C@@H]2CC(C)C)cc1	776259904	SYWUZKSLEXZPFP-ZWKOTPCHSA-N	440.566	1.540	50	20	IDGD	
Cc1cc(S(=O)(=O)NCCNC(=O)NNc2cccc(S(C)(=O)=O)c2)c(C)s1	776626651	XYZPALAXAQAKOR-UHFFFAOYSA-N	446.576	1.373	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(=O)n(CC(=O)NNc2ccc3ccccc3n2)c1	777464891	LNLMZMAVEWQTCU-UHFFFAOYSA-N	429.502	1.570	50	20	IDGD	
C[C@@H](NC(=O)OC(C)(C)C)[C@@H]1CCN(C(=O)NNC(=O)CNC(=O)c2cccs2)C1	778639797	GWKXNLGBVMNNBA-CHWSQXEVSA-N	439.538	1.454	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NCc1ccccc1CN1CC[C@@H](O)C1	781954846	OGGSDEQQYYZSKY-HNAYVOBHSA-N	430.480	1.690	50	20	IDGD	
CC(=O)N1CCN(Cc2cccc(NC(=O)C(=O)NNc3c(C)cccc3F)c2)CC1	782123628	HJKWTFGVONUVFU-UHFFFAOYSA-N	427.480	1.880	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(CNC(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)c1	782538127	SIFQYIGCNREYOD-UHFFFAOYSA-N	434.562	1.984	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNc2cccc3c2CCCC3)cc(S(C)(=O)=O)c1	783453053	NALSUMBRCFCIBS-UHFFFAOYSA-N	445.497	1.837	50	20	IDGD	
O=C1C[C@H](Cc2ccc(NC(=O)C(=O)NNc3ccccc3C(F)(F)F)cc2)C(=O)N1	784831835	VUUMWUAZNPKGJN-LBPRGKRZSA-N	434.374	1.992	50	20	IDGD	
C#CCOc1cc(F)ccc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)C(F)F)cc1	784835191	GXSLUVCGGFPKLT-UHFFFAOYSA-N	441.387	1.916	50	20	IDGD	
CN1CCCN(c2ccc(NC(=O)C(=O)NNc3ccc(C(F)(F)F)nn3)cc2)CC1	784891229	JUZIXRIHQIPGAR-UHFFFAOYSA-N	437.426	1.719	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)[C@@H]3CN(C)C(=O)c4ccccc43)n[nH]2)cc1OC	785183491	XYNZNDUJPAKFQR-MRXNPFEDSA-N	449.467	1.724	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2cccn(Cc3ccccc3)c2=O)n1	785226135	QFYSAJMSHBDYFK-UHFFFAOYSA-N	435.488	1.615	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1ccnn1[C@@H](C)CC(C)C	785330099	DXRXGRVHYKGFDK-ZDUSSCGKSA-N	437.522	1.984	50	20	IDGD	
CCc1ccccc1CC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	785437933	DIUOQAGYMKJORD-UHFFFAOYSA-N	431.514	1.274	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNS(=O)(=O)c1cnccc1C(F)(F)F	785486131	GYIGIIHNRQXCKS-UHFFFAOYSA-N	436.799	1.380	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Nc2cccnc2-c2cnn(C)c2)cc(OC)c1OC	786209366	XMDLPPMMYDITGS-UHFFFAOYSA-N	426.433	1.974	50	20	IDGD	
N#C/C(=C/c1cn(CCC(N)=O)nc1-c1cccc(Br)c1)C(=O)NOCCO	787292910	UJEJVIDXLKMYTE-JYRVWZFOSA-N	448.277	1.135	50	20	IDGD	
Cc1cc(-n2cccn2)ccc1NC(=O)C(=O)NNC(=O)[C@H]1OCC[C@H]1c1ccccc1	789809951	IACAQPDJJBZJDG-ICSRJNTNSA-N	433.468	1.839	50	20	IDGD	
COc1c(C(=O)N(C)C)cc(Cl)cc1S(=O)(=O)NNC(=O)c1ccccc1C	790044969	ILHTZJSFWXVEIT-UHFFFAOYSA-N	425.894	1.982	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)[C@H]1COCCN1C1CCCC1	790065328	LXBYPXCDFWBFTB-MRXNPFEDSA-N	426.311	1.619	50	20	IDGD	
Cc1ccc(C)c(S(=O)(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)c1[N+](=O)[O-]	790404711	OKKDLYCNKVNJBD-UHFFFAOYSA-N	440.865	1.491	50	20	IDGD	
CS(=O)(=O)c1ccc(Cl)c(NC(=O)C(=O)NNc2cccc(F)c2[N+](=O)[O-])c1	790997718	SORPYQPZQKHKBT-UHFFFAOYSA-N	430.801	1.873	50	20	IDGD	
O=C(NNc1nc2ccccn2n1)[C@H]1CCCCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1	791243518	RLLBVGWUCOGOGB-OAHLLOKOSA-N	445.461	1.324	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)N[C@@H](C)CCC(=O)OC(C)C	792303557	NKADLHPFRVDYKO-LBPRGKRZSA-N	427.527	1.352	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cnc(CC4CC4)nc3)n[nH]2)cc1	793026650	SOQQFHRZRVCZOD-UHFFFAOYSA-N	433.472	1.781	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)N(CC(F)F)CCS2	793026739	ULWBUASKVMZRCM-UHFFFAOYSA-N	435.456	1.967	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H](O)c2cccc(C(F)(F)F)c2)c1	794764020	QLCMHAXQOIXBBA-HNNXBMFYSA-N	445.419	1.450	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)NNC(=O)Nc1cc(S(=O)(=O)N2CCCC2)ccn1	797675263	JGWVNHRPPNGXND-UHFFFAOYSA-N	442.501	1.743	50	20	IDGD	
Cc1c(NNC(=O)NCCN(C)S(=O)(=O)c2ccc(F)cc2)cccc1[N+](=O)[O-]	798118224	JZDACCKAESDOGI-UHFFFAOYSA-N	425.442	1.989	50	20	IDGD	
O=C(CN1C(=O)[C@H]2CCCC[C@H]2C1=O)NNc1cc([N+](=O)[O-])ccc1Br	800618564	BGUUXGWPUKABEL-PHIMTYICSA-N	425.239	1.976	50	20	IDGD	
Cc1cn(-c2ccc(F)cc2)nc1C(=O)N1CCN(S(=O)(=O)CBr)CC1	801183617	UBBBZXLEJRWDAJ-UHFFFAOYSA-N	445.314	1.760	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)c2ccc(S(N)(=O)=O)cc2)c(OC)cc1Cl	803397312	SOLMIAHXUHJBHD-UHFFFAOYSA-N	428.854	1.471	50	20	IDGD	
COC(=O)c1c(C)csc1NC(=O)C(=O)NNC(=O)C(F)(F)Oc1ccccc1	806978689	DAIMRWVHNSXEPP-UHFFFAOYSA-N	427.385	1.601	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)C(=O)Nc2ccc(C(N)=O)cc2OCC(F)F)c1	810383288	YYEXCHSOMNLXLG-UHFFFAOYSA-N	436.371	1.298	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)C1(c2ccccc2)CC(=O)C1	811271018	ZPUSEQDAQYMIHE-UHFFFAOYSA-N	430.844	1.954	50	20	IDGD	
CN(C)c1cccnc1CNC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	812537079	YWXVESGGPLCKHF-UHFFFAOYSA-N	446.533	1.076	50	20	IDGD	
COCCOCc1ccc(CNC(=O)NNC(=O)c2nnc(O)c3ccccc23)cc1	813186508	JENWWLDFKQOUQE-UHFFFAOYSA-N	425.445	1.643	50	20	IDGD	
CCC(=NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1)c1cccc(N)c1	814876775	COCZKPLSQSBRLF-UHFFFAOYSA-N	443.573	1.814	50	20	IDGD	
O=C(NN=Cc1c(N2CCOCC2)nc2ccccn2c1=O)Nc1ccc2c(c1)OCO2	814993246	YFZRDODWNKONEK-UHFFFAOYSA-N	436.428	1.415	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)[C@H]2COCCN2CC(F)(F)F)c1	816716631	UYJTUXDTLBQCMP-GFCCVEGCSA-N	440.216	1.942	50	20	IDGD	
Cc1sc2ncn(CCC(=O)NNC(=O)[C@H]3COc4ccccc4O3)c(=O)c2c1C	817999782	XENHQUXWWVYIHX-OAHLLOKOSA-N	428.470	1.452	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NN=Cc1c(N2CCOCC2)nc2ccccn2c1=O	874082429	QFSDYJHQQDIMHP-HNNXBMFYSA-N	439.447	1.588	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNS(=O)(=O)c3cccc(S(C)(=O)=O)c3)cc2C1	903961181	OPIBRFUZNOKUKK-NSHDSACASA-N	428.557	1.900	50	20	IDGD	
CNS(=O)(=O)c1ccc(C(=O)OCC(=O)NN=C(c2ccccc2)c2ccccc2)o1	915418145	ZPSOAGCGGGGOII-UHFFFAOYSA-N	441.465	1.913	50	20	IDGD	
CC(C)COCCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	916208467	GPLRIMPANWZGBD-UHFFFAOYSA-N	426.539	1.478	50	20	IDGD	
Cc1ccc([C@H](CN2CCOCC2)NC(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1	916217301	KDRTXCSJZVHMBS-IBGZPJMESA-N	440.500	1.784	50	20	IDGD	
CC(=NNC(=O)c1ccncc1)c1ccc(S(=O)(=O)N2CCCC[C@@H]2C(=O)O)cc1	916242873	KOJRNCXUXPBLCM-GOSISDBHSA-N	430.486	1.863	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)NCC1(NS(C)(=O)=O)CCCCC1	916252123	FPNJEWFISMGNIV-UHFFFAOYSA-N	432.930	1.545	50	20	IDGD	
Cc1cc(C)n(CC(=O)NN=Cc2cccc(C=NNC(=O)Cn3nc(C)cc3C)c2)n1	916342969	GRZXAXHEFAECEP-UHFFFAOYSA-N	434.504	1.614	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)NCc1ccc(N2CCO[C@@H](C)C2)nc1	916393322	YHLUTKKOYMAIDY-HNNXBMFYSA-N	429.477	1.225	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)NC[C@H](C)N1CCN(c2ccccc2)CC1	916514957	VKUVULPOBMRSBM-SFHVURJKSA-N	441.532	1.615	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)c(O)n1	916760977	UYVDDLWNIZJPOB-UHFFFAOYSA-N	429.440	1.872	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2nnn(-c3ccc(C)cc3)c2C)c2ccccc2c1=O	917530120	SSBBZURSYIYJQG-UHFFFAOYSA-N	431.456	1.689	50	20	IDGD	
O=C(CN1C(=O)N[C@]2(CCc3ccccc32)C1=O)NNC(=O)c1ccc(Cl)cc1O	918357596	KGBNFAHQUZLKCW-FQEVSTJZSA-N	428.832	1.200	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)CCn2cc([N+](=O)[O-])cn2)cc1	919829759	WLYMQZUCBOQFHH-UHFFFAOYSA-N	430.450	1.063	50	20	IDGD	
Cc1nc(SCC(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)c2c(C)c(C)sc2n1	919884758	KZNCTDKRIQURHX-LLVKDONJSA-N	443.576	1.226	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H](C)OC[C@@H]2CCCCO2)c1	921165050	HIQPPKHVBKQPAT-WBVHZDCISA-N	441.550	1.452	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H](C)NC(=O)OC(C)(C)C)c1	921298611	DIDFMWIKWGUKDC-ZDUSSCGKSA-N	442.538	1.391	50	20	IDGD	
CCOc1ccc(C(=O)NNS(=O)(=O)c2ccc(NC(C)=O)c(F)c2)cc1OC	1256238467	NHTTWFSCVXUCHY-UHFFFAOYSA-N	425.438	1.815	50	20	IDGD	
Cc1c(C(=O)NNC(=S)NC(C)C)nnn1C1CCN(C(=O)OC(C)(C)C)CC1	1318200163	NSSQGCPEBZNKJR-UHFFFAOYSA-N	425.559	1.676	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@]2(C1)CN(C(=O)c1ccc3c(n1)NC(=O)CC3)CCO2	1779295744	WTBPBXARVIKCLA-NRFANRHFSA-N	446.580	1.261	50	20	IDGD	
CC(=O)N/C(C)=C/C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CO[Si](C)(C)C)C1	1779546367	QOZFCEMNVGWCME-IFPCECNESA-N	425.602	1.392	50	20	IDGD	
CC1=NN(c2ccc(C(=O)N3CC[C@]4(C3)CN(C(=O)[C@H](F)Cl)CCO4)cc2)C(=O)C1	1780795794	JGQWOOLROLQLPP-PXNSSMCTSA-N	436.871	1.777	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cnc(OCF)cn3)CCO2)C1	1783343897	KVBZPYUGEPAKMD-PXAZEXFGSA-N	445.289	1.399	50	20	IDGD	
CCOc1ncccc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](Cl)COC)C[C@@H]21	1783391031	MYWAMGFFZHREOW-HJWJTTGWSA-N	425.913	1.327	50	20	IDGD	
CO[C@H](C)C(=O)N1CC[C@]2(CN(C(=O)[C@@H](Br)Cc3ccccc3)CCO2)C1	1783993727	FZHNSOHGIWBGJJ-OXFYSEKESA-N	439.350	1.857	50	20	IDGD	
C[C@H](Oc1cccnc1)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2	1784547595	INTSSUOAZILPMP-JVPBZIDWSA-N	430.332	1.915	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](NC(C)=O)C(C)(C)C)C[C@@H]21	1784615113	IBFHEBKAVRVAMD-IECFSIQFSA-N	429.989	1.924	50	20	IDGD	
COc1nccnc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)CBr)C[C@@H]21	1785646318	KKJXCAKJPLYUHE-RFGFWPKPSA-N	441.326	1.110	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cncn3-c3ccncc3)[C@H]2C1	1785754519	KVFGZTUHXNKCDD-XPYUAMARSA-N	447.923	1.114	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC1(c2ccc(NC(=O)Cc3cncnc3)cc2)CCC1	1786933405	GEUPISHXSSYDOM-UHFFFAOYSA-N	445.483	1.466	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3ccc(F)cn3)[C@H]2C1	1787035490	GDVVAMWJICWLDR-APYUEPQZSA-N	428.302	1.526	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc4n(n3)CCC4)[C@H]2C1	1788415518	FARBYRZNCFNCNS-QEWYBTABSA-N	439.354	1.596	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@](C)(O)C(F)(F)F)C[C@@H]21	1789868308	BAFROPZMLUAQHU-UQXKVLDMSA-N	435.270	1.516	50	20	IDGD	
CCc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]3C2)n(C)n1	1789870787	WBGANPBXMCRWRB-BCRCDCHUSA-N	431.364	1.812	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc(OCF)cn3)C[C@@H]21)[C@@H](F)Br	1789922207	IEXZYXOLTOCMNE-JYYRZZBQSA-N	449.252	1.066	50	20	IDGD	
CCN(CC)C[C@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)CBr)C[C@@H]21	1790595691	VJHAAOUMLJXAPD-ATIWLJMLSA-N	446.430	1.975	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc(F)cc3F)C[C@@H]21	1791257358	BPTIUOIPKZCDMV-MBGYTDRXSA-N	430.879	1.741	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3ncc[nH]3)[C@H]2C1	1791484053	VDNUZQJVDWSRMJ-XQLPTFJDSA-N	427.343	1.496	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC1(c2ccc(NC(=O)CN3CCCCC3=O)cc2)CCC1	1791514780	HYNMOBWLWYEPGA-UHFFFAOYSA-N	443.548	1.506	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1ccc(C2(NC(=O)/C=C/c3cnccn3)CCC2)cc1	1791603015	BFYDLODZYAQQPG-CMDGGOBGSA-N	436.516	1.997	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCc1ccc(F)c(F)c1)c1ccc(B(O)O)cc1	1792824296	VJXYQEQCQOWCPL-REPLKXPHSA-N	442.271	1.529	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)c1ccccc1)C2	1792867725	KERLBMAFPDCIIT-BTYMGIQYSA-N	425.323	1.341	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)Cc1ccncc1)C2	1792872097	LXSZGWGXKOKVPU-HUMVNOLHSA-N	438.366	1.881	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CCc3cccc(Cl)c31)C2)[C@H](O)CCl	1792984083	SDJQUNMPUFHXGR-JGTMWYTQSA-N	427.328	1.559	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCc1c[nH]c2ccccc12	1795835184	DVGJIEDXPWIAIK-VWFIUDSGSA-N	433.936	1.944	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnnc2ccccc12	1796890384	RCVGYQGSOZCDLG-YVWYUNDQSA-N	428.565	1.685	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc2c1OCCO2	1796962497	IQGYIXIXVUIRJR-XBMZAUBUSA-N	443.327	1.897	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cn3cc(F)ccc3n1)C2	1799277275	VNYUPSXCZXSJBX-FIXGWNCBSA-N	443.306	1.913	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccno1)C2)[C@H](Br)Cc1ccccc1	1800435678	LILDGSLWNMEUIV-KYHPRHEASA-N	448.317	1.884	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](NC(C)C)C(C)C)C2	1800640157	WWHGUULTOYYYQI-NNXHMXCWSA-N	432.403	1.772	50	20	IDGD	
CC(C)NC(=O)OC(C)(C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)Br	1800760053	YPIBGUJSPPNEBY-FQUUOJAGSA-N	448.358	1.273	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(Cl)ccc1F)C2	1801009114	QCCGHEOALIONKY-DBWKPXFBSA-N	440.903	1.055	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccc(O)cn1	1801463223	GDLFOMLWWWRERY-DJZPMSPPSA-N	426.311	1.093	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccc(OC)c(F)c1	1801503209	UOZFVIMLFBWPPJ-YGTYGHESSA-N	428.888	1.220	50	20	IDGD	
Cc1ccc(C(=O)C(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)cc1	1803146317	NGJNFRYDOXXCBH-QYZOEREBSA-N	429.904	1.878	50	20	IDGD	
CC[C@@H](C)[C@@H](O)C(=O)N1CCCC2(CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CC2)C1	1806074278	OXFAJJLGBNKSSC-JNPBVJNKSA-N	445.564	1.759	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCCC2(CCN(C(=O)CN3CCS(=O)(=O)CC3)CC2)C1	1806152675	GZBOOOJIMQINIL-KRWDZBQOSA-N	448.029	1.356	50	20	IDGD	
CO[C@H](C)C(=O)N1CC[C@@H](CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@H]1c1cccnc1	1808416136	FHLNZNOLLGQKFV-HKPSGPMNSA-N	440.504	1.256	50	20	IDGD	
CCC(=O)N[C@H](C)C(=O)N1CC[C@H](CNC(=O)CO[Si](C)(C)C)[C@H]1c1cccnc1	1810537395	FFOQZWKKDWAUKV-WRWLIDTKSA-N	434.613	1.854	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1)c1c[nH]c(=O)cn1	1811452191	NJHMGJSGIBILLS-SUMWQHHRSA-N	434.294	1.270	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)[C@@H]2C[C@H]2C2CC2)[C@H]1c1cccnc1	1813067846	GGXMRZXCWZIMRH-VWNVYAMZSA-N	427.549	1.507	50	20	IDGD	
C=CCSCC(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1813069718	AWUOXAJIBFNAQO-UWJYYQICSA-N	433.578	1.380	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)Cc3ccccc3)sc2C1	1813816884	MUTRLNSIFDLYBK-OAHLLOKOSA-N	429.546	1.671	50	20	IDGD	
Cc1nc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cnccc3C(=O)NN)n[nH]2)co1	1819401873	DAUBVVKRQUCDGO-INIZCTEOSA-N	438.448	1.324	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)Cc2ccc3ncnn3c2)n[nH]1	1820703270	XMQNBDAMFRHFNO-GOEBONIOSA-N	445.911	1.941	50	20	IDGD	
C[C@H](Br)C(=O)Nc1cc([C@H]2CCCCN2C(=O)C2=NN(C)C(=O)CC2)[nH]n1	1822185578	YXLKLHDFUSRKRL-GXFFZTMASA-N	439.314	1.793	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(F)cn2C)[nH]n1	1822415610	CSHODOGWNFXYRY-HNNXBMFYSA-N	433.488	1.566	50	20	IDGD	
C[C@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)n1cccc1	1822671620	NGZPRSRJQKOXIN-BEFAXECRSA-N	435.293	1.458	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)Cc3c(C)n[nH]c3C)sc2C1	1823131834	CIISPYVKJVBNGZ-AAEUAGOBSA-N	425.942	1.892	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)CN2CCCC2)CC1	1823797935	BFTVWRSKCAVQMV-FQEVSTJZSA-N	442.564	1.014	50	20	IDGD	
O=C(COC(=O)C(F)(F)F)N1CCC([C@H]2CCCCN2C(=O)[C@@H](O)CCl)CC1	1824186580	OYSVDHLSMROMDA-OLZOCXBDSA-N	428.835	1.311	50	20	IDGD	
O=C1OCCN1CC(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@H](F)Br)CC1	1824333233	ANWSKDHSSCARMG-ZFWWWQNUSA-N	434.306	1.749	50	20	IDGD	
CCOC(=O)N[C@@H](O)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CCBr)CC1	1826358325	DRLPZBYQJOEWRL-HOCLYGCPSA-N	448.358	1.456	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC[C@@H]1C1CCN(C(=O)C(F)(F)C(F)F)CC1	1827055529	BGDJUMQUINQYEF-MRXNPFEDSA-N	444.234	1.500	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccn3c(O)nnc23)CC1	1827538490	NYGXCKRMVSGENQ-SJORKVTESA-N	449.939	1.922	50	20	IDGD	
Cc1ccnc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)c1	1827759836	BMZSSVUIWIBKJD-HXUWFJFHSA-N	429.565	1.996	50	20	IDGD	
O=C([C@@H](O)CCl)N1CCC([C@H]2CCCCN2C(=O)COC(=O)C(F)(F)F)CC1	1828833157	JGQGMTOADLATDZ-OLZOCXBDSA-N	428.835	1.311	50	20	IDGD	
O=C(CN1C(=O)C=CC1=O)N1CCC([C@H]2CCCCN2C(=O)[C@H](F)Br)CC1	1830381434	JSIWULLTGXOGNC-DYVFJYSZSA-N	444.301	1.222	50	20	IDGD	
CC(=O)C[C@H](C)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](C)CBr)CCO2)C1	1830543909	HGRYUNIDXHYTNG-IYOUNJFTSA-N	433.343	1.089	50	20	IDGD	
O=C(c1ccc(Cl)cc1F)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1830720055	RVLKSKVXFXRCPP-YJBOKZPZSA-N	435.279	1.149	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)n3cccc3C=O)C2)C1	1831647796	YYKNTRUOSSXMDU-MDKPJZGXSA-N	439.940	1.726	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)Br)C2)C1	1831656372	DRFWMONOPQRQDR-DVOMOZLQSA-N	425.751	1.634	50	20	IDGD	
CC(C)N(C)CC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1	1832418389	LYGDRWIKLCFSHL-HXUWFJFHSA-N	444.580	1.259	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(CN(C(=O)/C=C/c3cccnc3)CCO2)C1	1833102326	NPMNGJSHWYKXMT-IRUYWQDXSA-N	433.581	1.403	50	20	IDGD	
N#Cc1ccc(F)c(C(=O)N2CCC(N3CCC(NC(=O)[C@H](O)CCl)CC3)CC2)c1	1833311624	ACZYNHPVTZTEQX-LJQANCHMSA-N	436.915	1.482	50	20	IDGD	
Cc1nc(C(=O)N2CCC(N3CCC(NC(=O)[C@@H](O)CCl)CC3)CC2)sc1C	1833312536	QUJVMZAQWBPCPK-INIZCTEOSA-N	428.986	1.545	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccnc3OC)CCO2)C1	1834125291	OWMHCLNAZDPNJB-JXFKEZNVSA-N	425.913	1.568	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)CCC(=O)OC)CC2)CC1	1834436461	SYFCYCCHLNHTFN-INIZCTEOSA-N	446.386	1.685	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)c3c(F)cccc3F)C2)C1	1834824142	SRQNSZNTJHSPMR-GOSISDBHSA-N	447.276	1.820	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC1CCN(C2CCN(C(=O)COc3cccnn3)CC2)CC1	1835837929	SUTHOBNYCGYZAK-UHFFFAOYSA-N	449.628	1.279	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccc(F)cn3)CCO2)C1	1836034668	OYFOOJXFJJLJPA-MOPGFXCFSA-N	448.322	1.456	50	20	IDGD	
O=C(c1noc2c1CCCC2)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1836429474	CDRNGZAXIOQRAX-SFHVURJKSA-N	432.304	1.427	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@H](O)NC(=O)OCC)CC2)CC1	1836923439	XKHNZHFUTJYZCA-SJORKVTESA-N	447.960	1.457	50	20	IDGD	
O=C(c1cccc2ncsc12)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1837070665	MWTDZZZSQCNMLB-MAUKXSAKSA-N	427.885	1.901	50	20	IDGD	
C[C@H](Nc1cnccn1)C(=O)N1CCC(OC2CCN(C(=O)[C@H](F)Cl)CC2)CC1	1838082064	DDFVJLFAINDDCE-GUYCJALGSA-N	427.908	1.810	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3CC=CC[C@@H]3C(=O)OC)C2)C1	1839148563	BTWGYNHBYAQWAX-IAGYGMIVSA-N	442.940	1.216	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(O)cn3)C2)C1	1839151126	IVNDYTNGKRNXFE-ROUUACIJSA-N	432.304	1.094	50	20	IDGD	
Cc1cc(/C=C/C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)no1	1839154028	ZEAYFZISGBEDHW-FKDQEEMOSA-N	446.331	1.689	50	20	IDGD	
Cc1cc(F)cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)c1	1839202177	WNSJLSIRTUEKKB-YJBOKZPZSA-N	447.276	1.895	50	20	IDGD	
C[C@H](Cc1ccc(F)cc1)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1	1839762966	LSDIRNAIDBZTCV-FQELHTAISA-N	442.915	1.060	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(C4CC4)on3)C2)C1	1840030350	JINWJOZCLHWKLX-KZULUSFZSA-N	442.310	1.405	50	20	IDGD	
CNc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)cc1	1840032288	UAZBYRIWPARTAD-LIRRHRJNSA-N	440.338	1.582	50	20	IDGD	
Cc1cc(F)ccc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)Br)CCO2	1840036019	CIMSQONSFGOMHB-LIRRHRJNSA-N	443.313	1.988	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)C(=O)c3cccn3C)CCO2)C1	1840481138	FGUFHCUPRWHNJT-QRWLVFNGSA-N	425.913	1.072	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@H](CCO)NC(=O)OC(C)(C)C)C2	1841665907	AISOLFGQKZNWTP-CABCVRRESA-N	431.961	1.873	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC2(CCCN2C(=O)CCNC(=O)c2ccc[nH]2)C1	1842016239	OBKQWEWAKOEKOR-CYBMUJFWSA-N	425.327	1.512	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC2(CCCN2C(=O)Cn2c(=O)n(C)c3ccccc32)C1	1843860201	HXYZYNQLRWHKCZ-CQSZACIVSA-N	449.349	1.717	50	20	IDGD	
Cc1ccc(C(=O)NCC(=O)N2CC3(CCCN3C(=O)[C@H](F)Br)C2)cc1	1845220683	HXHGQYUFTNEAMZ-HNNXBMFYSA-N	426.286	1.619	50	20	IDGD	
CC(C)(C)OC(=O)N1CC2(C[C@H]2C(=O)N2CCCC23CN(C(=O)[C@H](O)CCl)C3)C1	1846115876	NSXOOXWLZDOJCW-UONOGXRCSA-N	427.929	1.047	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](NC(=O)c1ccccc1)[C@@H](C)O	1847434655	CCPOZSKMNSIRRD-IQRFUGTFSA-N	435.952	1.775	50	20	IDGD	
Cn1ccc(CC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)n1	1848099847	YZJLNMYKMAKPMG-JYJNAYRXSA-N	439.944	1.297	50	20	IDGD	
CCc1[nH]c(C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)c(C)c1C(=O)OC	16177462	VENFJXIROCNOOY-UHFFFAOYSA-N	435.506	1.348	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)[C@@H](NS(=O)(=O)c2ccc(C)cc2)C(C)C)c1	17059301	GCQIYMXRYPRELB-IBGZPJMESA-N	449.529	1.776	50	20	IDGD	
O=C(NNC(=O)c1ccc(Br)s1)NC1CCN(C[C@H]2CCOC2)CC1	303658302	AMDACORUTZSGHZ-LLVKDONJSA-N	431.356	1.956	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)Cn1nc(-c2ccccc2)oc1=O	726069694	QSKQDXYFGYDHNI-UHFFFAOYSA-N	447.245	1.492	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)CN2c3cccc4cccc(c34)S2(=O)=O)cn1	726898322	WSBUXRFCNNGLKF-UHFFFAOYSA-N	443.510	1.770	50	20	IDGD	
CN(C)CCNC(=O)c1cccc(CNC(=O)NNC(=O)c2ccc3ccccc3n2)c1	727479164	AVJPTVNLWXZUAE-UHFFFAOYSA-N	434.500	1.670	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)N[C@H](CN1CCN(C)CC1)c1ccccc1	727843493	MJLXSSLNQDAPJN-LJQANCHMSA-N	435.532	1.575	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)C[C@H]3C(=O)Nc4ccccc43)cc2)CC1	728216377	YNNFFEUVYNGKLH-GOSISDBHSA-N	443.529	1.192	50	20	IDGD	
Cc1ccc(-c2nn(-c3ccccc3)cc2C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)o1	728375710	AZNJNGRHYSKKNU-CQSZACIVSA-N	428.470	1.636	50	20	IDGD	
COc1ccc(C(=O)NCC(=O)NNC(=O)Cn2ccc3ccccc32)cc1[N+](=O)[O-]	729540615	IMBWFHNURWCKOD-UHFFFAOYSA-N	425.401	1.136	50	20	IDGD	
O=C(CN1CCCN(C(=O)CC2CCCC2)CC1)NNC(=O)c1ccc([N+](=O)[O-])cc1	730808126	BQHCNOIVMSRKAO-UHFFFAOYSA-N	431.493	1.470	50	20	IDGD	
Cc1nc(C)c(CCNC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)s1	731123795	OEZVYNQOUQDMAU-UHFFFAOYSA-N	430.578	1.845	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)NCCC(=O)NNC(=O)C(C)(C)c2ccccc2)cc1	731231435	PRPRNBISAHANRR-UHFFFAOYSA-N	431.514	1.683	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)NCCNC(=O)c1cccc(Br)c1	731500536	LATJBHJBAHPYRQ-UHFFFAOYSA-N	435.278	1.832	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2ccc(S(=O)(=O)C3CCCC3)cc2)C[C@@H](C)O1	732259890	KTCNENSJUJSMFX-IYBDPMFKSA-N	437.562	1.663	50	20	IDGD	
Cc1ccc(S(=O)(=O)c2ccc(NNC(=O)Cn3ncn4nccc4c3=O)cc2)cc1	732828835	VBZFHASTAPLBHE-UHFFFAOYSA-N	438.469	1.176	50	20	IDGD	
Nc1nc(Cl)c(C=NNC(=O)c2cnn(-c3ccccc3)c2)c(N2CCOCC2)n1	733077467	ZOLLLKBBDRVRAU-UHFFFAOYSA-N	426.868	1.498	50	20	IDGD	
COc1cc(S(=O)(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc(C(=O)O)c1OC	733123059	OZPJDEYALSLWIC-UHFFFAOYSA-N	446.441	1.211	50	20	IDGD	
COc1cc([N+](=O)[O-])c(C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)cc1SC	734239731	AZBOXDWPWFVFDL-UHFFFAOYSA-N	443.482	1.794	50	20	IDGD	
CCCS(=O)(=O)Nc1ccc(C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)cc1	734241732	SSJCOPKHKBWWOM-UHFFFAOYSA-N	443.526	1.307	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1Cl)N[C@H]1CCN(CCN2CCOCC2)C1	734686612	RHHSVDUZLGOGMD-AWEZNQCLSA-N	430.336	1.344	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)N[C@H]2CCN(c3ccc(Cl)cc3)C2=O)nc2ccccc21	740483955	FSLHLZBNEJAKMQ-INIZCTEOSA-N	440.891	1.905	50	20	IDGD	
C[C@]1(C(=O)NNC(=O)CNC(=O)c2cccs2)CCCN(C(=O)c2ccccc2)C1	741918751	IOLLZIRVPRHULS-NRFANRHFSA-N	428.514	1.568	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)CCC(=O)c2ccc3c(c2)OCCO3)c1	744451906	YKLDSNJJOSWWMZ-UHFFFAOYSA-N	426.425	1.734	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)c2cc(Cl)nc(N3CCCC3)c2)cc1	745011329	GCEKXIRNGOMIAJ-UHFFFAOYSA-N	427.848	1.825	50	20	IDGD	
O=C(COC(=O)c1cnc(-c2ccncc2)s1)NNC(=O)c1ccc([N+](=O)[O-])cc1	745170292	YIJGCBWRLGPEJH-UHFFFAOYSA-N	427.398	1.731	50	20	IDGD	
O=C(NCc1ccccc1CS(=O)(=O)N1CCOCC1)NNc1ccc(Cl)nc1	745403168	URIYZKALJVAFNH-UHFFFAOYSA-N	439.925	1.723	50	20	IDGD	
C[C@H]1C[C@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)CCN1C	745859287	ZZCPLWUAMVMZEO-DOTOQJQBSA-N	437.566	1.288	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)N[C@@H]2C[C@@H](C)N(c3cnn(C)c3)C2=O)cc1OC	745919724	WQYMHWQJLPDSDM-CZUORRHYSA-N	444.492	1.356	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)CCc2c(C)nc3c(c(O)nn3C)c2C)c1	746094657	BKNFLQSCBXHFLW-UHFFFAOYSA-N	427.461	1.702	50	20	IDGD	
O=C(COC(=O)Cc1csc(-c2cccnc2)n1)NNC(=O)c1cccc([N+](=O)[O-])c1	746212265	MKURZKBITMDDJC-UHFFFAOYSA-N	441.425	1.660	50	20	IDGD	
CC(C)c1nc(C#N)c(NNC(=O)[C@@H]2CCCN2C(=O)/C=C/c2ccc(C(N)=O)cc2)o1	746526322	ZSBOLNZUKMKLPL-JEJOPICUSA-N	436.472	1.916	50	20	IDGD	
COc1cc(C)nc(NNC(=O)NCC(=O)N2CCN(c3ccc(Cl)cc3)CC2)n1	746761841	MUKJUGAATJKEJN-UHFFFAOYSA-N	433.900	1.422	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)[C@H]2CCCN2C(=O)/C=C\c2ccc(C(N)=O)cc2)cc1	747173231	ZIZBITIFYLJWNO-XCJXAGMVSA-N	431.452	1.123	50	20	IDGD	
Cc1nc(C(C)C)nc(O)c1C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	747413012	DGWCVUJWPNONDI-UHFFFAOYSA-N	435.506	1.392	50	20	IDGD	
CCOC(Cn1cc(C(=O)NNC(=O)c2ccc(F)cc2Br)nn1)OCC	748559636	FRAGPNOOFKHWBV-UHFFFAOYSA-N	444.261	1.654	50	20	IDGD	
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC[C@@H](C(=O)NNc2cccc([N+](=O)[O-])c2C)C1	748670763	ZCMAKRITRMJCAR-CQSZACIVSA-N	436.494	1.787	50	20	IDGD	
CC(C)OCCS(=O)(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1	749010626	GSJHJONWCKGOAY-OAQYLSRUSA-N	431.558	1.989	50	20	IDGD	
CC[C@H](C)Oc1ccc(C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)cc1	750240984	BSCUUAFRGRBXAJ-INIZCTEOSA-N	447.561	1.952	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Cc2noc3ccccc23)c1	750542020	OTZUFTANBZYWNV-UHFFFAOYSA-N	430.486	1.862	50	20	IDGD	
COCCCOc1cccc(CNC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c1	752126149	DBPBYVWKOBPYDX-UHFFFAOYSA-N	425.449	1.222	50	20	IDGD	
Cn1nc(Br)c2c(=O)n(CC(=O)NNc3ccc(C#N)c(Cl)c3)cnc21	753316678	FYGLLAZTPMWNAZ-UHFFFAOYSA-N	436.657	1.561	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCC[C@@H]2CCO[C@@H](C)C2)cc1	753344557	KXWVPWCMINBXMU-JKSUJKDBSA-N	426.539	1.151	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2ccc(CCNS(C)(=O)=O)s2)c2ccccc2n1	754777356	FDTQJWIBSYRYSP-UHFFFAOYSA-N	432.527	1.771	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)nnc1C	756573147	QQMRINPTLHOKCR-UHFFFAOYSA-N	432.506	1.735	50	20	IDGD	
C[C@@H](CS(=O)(=O)c1ccc(F)cc1)C(=O)OCC(=O)NNC(=O)c1ccc(C#N)cc1	756714370	UTGQFJRISILKCO-ZDUSSCGKSA-N	447.444	1.112	50	20	IDGD	
COC(=O)c1cc(NC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])c(OC)c(OC)c1	756741984	IDDYEYCDKCXJAN-UHFFFAOYSA-N	448.388	1.630	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)Nc1cc(C2CC2)nn1[C@H]1CCS(=O)(=O)C1	756857324	URQGRIAHOWQMER-ZDUSSCGKSA-N	447.473	1.315	50	20	IDGD	
CCCn1c(CCC(=O)NN=c2cc[nH]cc2Cl)nc2cc(S(N)(=O)=O)ccc21	757406336	OQANCJWKPJWVOQ-UHFFFAOYSA-N	436.925	1.640	50	20	IDGD	
O=C(NCc1ccc2c(c1)CCS2(=O)=O)NNC(=O)c1cnn(-c2ccccc2)c1	757752160	ZTKNOLVFVZKJBV-UHFFFAOYSA-N	425.470	1.346	50	20	IDGD	
CC1(C)C(=O)N(C[C@@](C)(O)C(=O)OCC(=O)NNC(=O)c2ccccc2)c2ccccc21	758876988	DXRGRFQBIVXAFU-HSZRJFAPSA-N	439.468	1.066	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)c2ccc(OC)c(S(=O)(=O)NC(C)(C)C)c2)nc1	759739989	VLLWPBBXVKEZBU-UHFFFAOYSA-N	436.490	1.711	50	20	IDGD	
NC(=O)[C@H]1CC[C@@H](CNC(=O)NNC(=O)c2ccc(COc3ccc(Cl)cc3)cc2)O1	760204229	PCDZNGUCPAYAEW-ZWKOTPCHSA-N	446.891	1.896	50	20	IDGD	
CCS(=O)(=O)c1cccc(S(=O)(=O)NNC(=O)c2nnc(-c3ccccc3)o2)c1	760343059	AICXZZRVMMYCRE-UHFFFAOYSA-N	436.471	1.154	50	20	IDGD	
C[C@H](CC(=O)NNc1nc(-c2cccnc2)no1)NS(=O)(=O)c1cccnc1Cl	760568996	XMCAPFBWDVHMOI-SNVBAGLBSA-N	437.869	1.380	50	20	IDGD	
C[C@H](CN1CCOCC1)C(=O)NN=C1CCOC[C@H]1[C@@H]1CCCN1C(=O)OC(C)(C)C	762416982	DRUBRXWZVLSKJS-LMMKCTJWSA-N	438.569	1.863	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)CCCC[C@@H]3SC[C@H]4NC(=O)N[C@H]43)n[nH]2)cc1	762952951	OCCVJHJXPRYMCD-ZIFCJYIRSA-N	442.545	1.872	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(N3CCCC3=O)ccc2F)cc1OC	763550173	KCZWFDLDURRTIM-UHFFFAOYSA-N	444.419	1.369	50	20	IDGD	
CSc1nc2ccc(NC(=O)C(=O)NNC(=O)[C@H]3COc4ccccc4O3)cc2s1	763570267	DLWCKPCVWSJCEH-CQSZACIVSA-N	444.494	1.944	50	20	IDGD	
CCc1nnc(-c2ccc(NC(=O)C(=O)NNC(=O)COc3ccc(OC)cc3)cc2)o1	763660567	BSHLFFJPVYJWBW-UHFFFAOYSA-N	439.428	1.473	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cc(F)ccc2Br)cc1	763660736	GAYNOXDARURJEC-UHFFFAOYSA-N	440.225	1.762	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2c(F)cccc2-n2cccn2)cc1	763661351	NIRYKTNDBQJBQL-UHFFFAOYSA-N	427.392	1.185	50	20	IDGD	
CCN(CC)C(=O)c1ccccc1NC(=O)C(=O)NNC(=O)COc1ccccc1F	763679602	ONPOFPQLQWTPED-UHFFFAOYSA-N	430.436	1.473	50	20	IDGD	
O=C(NNC(=O)C12CC3CC(CC(C3)C1)C2)C(=O)Nc1cccn(CC(F)(F)F)c1=O	763727597	JFTJZDTZWWUPOH-UHFFFAOYSA-N	440.422	1.713	50	20	IDGD	
COC(=O)[C@H](C)Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc(OC)cc(OC)c2)cc1	763774889	ISHIWVHKAGHCTO-CYBMUJFWSA-N	443.456	1.455	50	20	IDGD	
COc1ccc(C)cc1NC(=O)C(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12	763791688	VXUBNHFVLGYYBE-UHFFFAOYSA-N	437.456	1.694	50	20	IDGD	
Cc1nn(-c2ccc(Cl)cc2)c(C)c1CC(=O)NNC(=O)CNC(=O)c1cccnc1	763821882	YMKSNJLZXCQEBE-UHFFFAOYSA-N	440.891	1.657	50	20	IDGD	
COC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)cc1F	763858562	VCSRYVIMPXROOE-JTQLQIEISA-N	436.371	1.697	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(NC(C)=O)cc2)cc1	763861104	MIZASMOLVWUEOA-CYBMUJFWSA-N	428.445	1.597	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccnc(OCC(F)(F)F)c1	763871613	HWFSOAYOPMZAKB-JTQLQIEISA-N	444.341	1.715	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)N2CCCc3ccc(F)cc32)cc1	763872959	PYLXTLXFLCENMU-AWEZNQCLSA-N	427.432	1.922	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2cc(C)nn2-c2cccc(Cl)c2)n1	763882848	WTVNNAOPRVFDDU-UHFFFAOYSA-N	429.868	1.434	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cncnc2OC)ccc1OCCC(C)C	763916271	KXWACEDZPVJKAO-UHFFFAOYSA-N	431.449	1.318	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cccn2C)n(-c2ccccc2C(F)(F)F)n1	763992426	DMQMGWKBLUDZAO-UHFFFAOYSA-N	434.378	1.938	50	20	IDGD	
O=C(CC1CCCC1)NNC(=O)C(=O)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1	764189130	WLLOJJXPZWJEAD-LJQANCHMSA-N	438.532	1.996	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)C(=O)Nc1ccc(N=Nc2ccccc2)cc1	764227864	SCVXRIYZNSJUHR-LBPRGKRZSA-N	432.462	1.126	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)C(=O)Nc2cccc3c2CN(c2ccccn2)C3)c1	764242486	SSBYIIDOPUOIQN-UHFFFAOYSA-N	426.436	1.873	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)c(Cl)c1)C(=O)Nc1cccc(N2CCCNC2=O)c1	764349823	RFADFTXHUNLQGF-UHFFFAOYSA-N	431.836	1.365	50	20	IDGD	
O=C1CCc2cc(F)c(NC(=O)C(=O)NNC(=O)c3cnn(-c4ccccc4)c3)cc2N1	764350777	LGXRIWLVUSKQDW-UHFFFAOYSA-N	436.403	1.296	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1)C(=O)N1C[C@H]2CCCN2c2ccccc21	764387338	KALXAATVGHUMJH-MRXNPFEDSA-N	448.458	1.992	50	20	IDGD	
O=C(NNC(=O)[C@H]1COCCO1)C(=O)Nc1ccccc1S[C@H](Cl)C(F)(F)F	764424994	LYBVPSOZUIPQOX-OTYXRUKQSA-N	441.815	1.407	50	20	IDGD	
Cn1c(=O)c2c(ncn2CC(=O)NN=Cc2ccc(-c3ccc(F)cc3)s2)n(C)c1=O	764812711	PIUFLKLBMHJWQR-UHFFFAOYSA-N	440.460	1.452	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)CCn3c(=O)nc(O)c4ccccc43)n[nH]2)cc1C	765567823	RXDLVCKSSJMVDD-UHFFFAOYSA-N	446.467	1.960	50	20	IDGD	
Cc1ccc2cccc(C(=O)NNC(=O)CN3CCN(C(=O)c4ccccc4)CC3)c2n1	765738291	JPXPSMRVRKZXSY-UHFFFAOYSA-N	431.496	1.762	50	20	IDGD	
COc1ccc(NNC(=O)[C@H](CSC)N2C(=O)[C@@H]3CCCC[C@H]3C2=O)c([N+](=O)[O-])c1	768332282	RXTDOZRDJLZZCE-IOASZLSFSA-N	436.490	1.953	50	20	IDGD	
COc1cccc(-c2nnc(SCC(=O)NNC(=O)c3ccccc3Cl)n2N)c1	768434458	CVMGKAYSPCCOGE-UHFFFAOYSA-N	432.893	1.874	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NCCC3=CCCCCC3)nc2)CC1	768455144	UUMBLQSXTYQGSV-UHFFFAOYSA-N	436.582	1.924	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)NC[C@H](c3ccccc3Cl)N3CCOCC3)nc21	770343485	ZBCDCXZPEYHEHF-OAHLLOKOSA-N	446.899	1.422	50	20	IDGD	
COCCOc1ccc(C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)c(Cl)c1	770423438	XVHHWIZVPGZCCT-UHFFFAOYSA-N	431.832	1.855	50	20	IDGD	
CCCCn1c(=O)nc(O)c2c1nc(CCC(=O)NN(C)C(=O)NCC)n2CC(C)C	770549086	KSJGNUJJUAUYLJ-UHFFFAOYSA-N	435.529	1.380	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2cc(F)c(Br)cc2C)n1	770774710	SCEYCRNFCBXOTG-UHFFFAOYSA-N	426.246	1.496	50	20	IDGD	
COc1ccccc1[C@@]1(C)NC(=O)N(CC(=O)NNC(=O)Cn2ccc3ccccc32)C1=O	771260870	NUPISLFIWGCICF-HSZRJFAPSA-N	449.467	1.265	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)c1cc(NS(C)(=O)=O)ccc1O	772992221	ZFWWPRASMOEQRJ-JTQLQIEISA-N	427.866	1.646	50	20	IDGD	
COCC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)cc1	774007535	BKXGSSAMRRHYLD-GFCCVEGCSA-N	448.863	1.478	50	20	IDGD	
COc1ccc(NC(C)=O)cc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1cccc(Cl)c1	774008202	JSXSUKHSYWTHID-LLVKDONJSA-N	448.863	1.860	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)Nc1ccnn1CC1CC1	776022654	YYFWEUQLAHAZIT-UHFFFAOYSA-N	432.506	1.544	50	20	IDGD	
Cc1nccc(NC(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)n1	776493269	JJTCEWVYRLBWSA-UHFFFAOYSA-N	429.444	1.953	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)c1cccc([N+](=O)[O-])c1N1CCOCC1	776703518	XYSPJPJKQUPMFZ-UHFFFAOYSA-N	438.400	1.155	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)c1ccc2nsnc2c1	776710841	LIMDYPVZPHEMKX-UHFFFAOYSA-N	444.948	1.924	50	20	IDGD	
COCCO[C@@H]1COCC[C@@H]1NC(=O)NNC(=O)c1ccc(OC(C)C)c(OC)c1	776935535	CRDKIFBMERGBEX-MAUKXSAKSA-N	425.482	1.247	50	20	IDGD	
O=C(c1ccc(OC[C@@H]2CCCO2)cc1)N1CCN(S(=O)(=O)CBr)CC1	777778176	ZXKKIWXDNXANHB-INIZCTEOSA-N	447.351	1.684	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)CCNS(=O)(=O)c2cccc(Cl)c2)nc1C	778426230	MHVIPNWGMBBFQK-UHFFFAOYSA-N	441.897	1.427	50	20	IDGD	
CC1(C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)CCCCC1	780198948	YMBHOONHTDTOPP-UHFFFAOYSA-N	437.562	1.758	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cc(-c3cc(C)ccc3C)[nH]n2)cc1-n1cnnn1	781710564	OUYFZEBEYVFPKZ-UHFFFAOYSA-N	432.444	1.753	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)Nc1cc(Br)cnc1-n1cccn1	782065917	XNOBCHBYKFDDQP-SNVBAGLBSA-N	427.259	1.234	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)C(=O)Nc1cccc(Cl)c1F	782897360	NFMPMSITEQYFBO-UHFFFAOYSA-N	441.872	1.480	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NN=c2sc3ccccc3n2C)c(OCC(=O)N(C)C)c1	783351736	IWDKGKPRZYTQTG-UHFFFAOYSA-N	441.513	1.586	50	20	IDGD	
COC(=O)[C@H]1CN(C(=O)C(=O)NNc2ccc(C#N)c(C(F)(F)F)c2)c2ccccc2O1	784232335	SKDDCPHHVLKEBS-MRXNPFEDSA-N	448.357	1.987	50	20	IDGD	
CS(=O)(=O)CCc1ccc(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2Cl)cc1	784382583	FJVCHZQGTPPQLO-UHFFFAOYSA-N	440.865	1.917	50	20	IDGD	
CCNC(=O)N(C)NC(=O)C(=O)Nc1ccc(C)c(S(=O)(=O)N2CCCCCC2)c1	784915250	HUWJGBYDBNUCJP-UHFFFAOYSA-N	439.538	1.191	50	20	IDGD	
COc1cc(C#N)ccc1Oc1ccc(NC(=O)C(=O)NNc2nccn(C)c2=O)cc1	785086934	VFFPNRBHUKBAME-UHFFFAOYSA-N	434.412	1.535	50	20	IDGD	
COc1cc(C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)cnc1Br	786739487	VHGAQMMOAPXLCZ-UHFFFAOYSA-N	433.218	1.342	50	20	IDGD	
CSCCNC(=S)NNC(=O)c1cc([C@H]2CCN(C(=O)OC(C)(C)C)C2)[nH]n1	787489775	LXFKKHDZSLIHJQ-NSHDSACASA-N	428.584	1.606	50	20	IDGD	
Cc1ccc(N2CCNC2=O)cc1NC(=O)C(=O)NNC(=O)C12CC3CC(CC(C3)C1)C2	787541359	PWESYZLBNOKQGW-UHFFFAOYSA-N	439.516	1.827	50	20	IDGD	
CCS(=O)(=O)CCn1cc(C)c(NC(=O)C(=O)NNc2ccc(C(F)(F)F)cc2)n1	787560933	XNYQDTKAKHENCH-UHFFFAOYSA-N	447.439	1.727	50	20	IDGD	
CSCC[C@H](O)C(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	788624937	NOSDMGUUTQSGNP-KRWDZBQOSA-N	426.502	1.263	50	20	IDGD	
COc1cc(NNC(=O)NCCC(=O)N2CCN(c3ncccn3)CC2)ccc1Cl	788954093	LEVRWRSSRPHQFN-UHFFFAOYSA-N	433.900	1.504	50	20	IDGD	
CCNC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)c1C	789733840	VNNTZFVIKSGHFE-KRWDZBQOSA-N	425.445	1.226	50	20	IDGD	
COc1cc(NNC(=O)[C@H](CCC(N)=O)N2C(=O)c3ccccc3C2=O)ccc1Cl	790186792	JIQAPAHTTSVKTB-HNNXBMFYSA-N	430.848	1.722	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2cccc(OC)c2O)ccc1C(F)(F)F	790953034	ZISHEMYTTZRRIR-UHFFFAOYSA-N	427.335	1.828	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)Cc2ccc(Cl)cc2)cc(-n2cccn2)c1	792352698	GREVPYBCKPZVRQ-UHFFFAOYSA-N	427.848	1.863	50	20	IDGD	
Cc1cc(C)c(C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)cc1I	792855736	BRIBFNBSERDKEF-JTQLQIEISA-N	436.271	1.104	50	20	IDGD	
N#CCc1cccc(S(=O)(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1	794577610	YVZCDKSHNUGWCW-UHFFFAOYSA-N	448.526	1.160	50	20	IDGD	
CN(C(=O)OC(C)(C)C)[C@@H](C(=O)NNC(=O)COc1ccccc1O)c1cnn(C)c1	796252472	BSKMKYXGUOHBHM-QGZVFWFLSA-N	433.465	1.260	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@@H]2C(=O)NNC(=O)c2cc(OC)cc(OC)c2)cc1	798351890	GKXZOSJPUMVLRL-LJQANCHMSA-N	427.457	1.778	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)c3n[nH]cc3C)c2)cc1	799409924	AQHBSSHBEWMQBW-UHFFFAOYSA-N	429.458	1.602	50	20	IDGD	
Cn1c(=O)c2cc(C(=O)NNC(=O)Nc3ccc(Cl)cc3Cl)n(C)c2n(C)c1=O	802091640	VEGKILWJCBGPIS-UHFFFAOYSA-N	439.259	1.349	50	20	IDGD	
CCN1CCC[C@@H]1CN1C[C@@H](C(=O)NNC(=O)Nc2cc(OC)ccc2Cl)CC1=O	802107988	FFACXBXYWWLDPL-UONOGXRCSA-N	437.928	1.834	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)CNS(=O)(=O)c2ccc(Cl)s2)cc1	802123122	HPGAXXQYISEJBS-UHFFFAOYSA-N	431.927	1.599	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCCC2)cc1)NNc1ccc(-n2ccnc2)nn1	804956226	DVTROQJQMQTPRE-UHFFFAOYSA-N	441.517	1.523	50	20	IDGD	
C[C@H](C#N)S(=O)(=O)c1ccc(NC(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1	806456849	XYWQOFQKBMKLOX-GFCCVEGCSA-N	430.442	1.610	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)Nc1cc(F)c(F)cc1N1CCOCC1	806706125	FSYHSSUNSVCCEB-UHFFFAOYSA-N	431.399	1.905	50	20	IDGD	
CC1(C)CC(=O)c2cc(NC(=O)C(=O)NNC(=O)COc3ccccc3O)ccc2O1	806979339	YNRPCGFXHUYHLV-UHFFFAOYSA-N	427.413	1.301	50	20	IDGD	
CCS(=O)(=O)N1CCC([C@@H](C)N(C)C(=O)NNC(=O)c2ccccc2OC)CC1	808268296	JCXMVVCGMGCECW-CQSZACIVSA-N	426.539	1.432	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)C(=O)Nc2ccc(-c3ccccc3)c(C)n2)c1	810390504	UVWYRTPIPUIBKM-UHFFFAOYSA-N	432.440	1.810	50	20	IDGD	
NS(=O)(=O)c1ccc2c(c1)C(=NNC(=O)c1nn(-c3ccccc3)cc1O)CCC2	811635073	LCNODTLRDUPESE-UHFFFAOYSA-N	425.470	1.696	50	20	IDGD	
CCOC(=O)c1ccc(NNC(=O)CNS(=O)(=O)c2c[nH]c3ncccc23)cc1C	812723811	OHWGLJBEHLXODI-UHFFFAOYSA-N	431.474	1.470	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)[C@@H]2CCCN2C(=O)Nc2ccccc2)c2ccccc2c1=O	813365153	GKVZSZCDCMEGNH-KRWDZBQOSA-N	434.456	1.391	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCc2nncn2C1)c1ccccc1NS(=O)(=O)c1cccs1	814255435	OCITUSIUYULJQB-GFCCVEGCSA-N	446.514	1.164	50	20	IDGD	
O=C(NN=C1CCO[C@@H](C(F)(F)F)C1)c1cccc(S(=O)(=O)N2CCOCC2)c1	814689071	TURYZDOFYHYZAD-OAHLLOKOSA-N	435.424	1.535	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NN=C[C@H]1CCCOC1)N(S(C)(=O)=O)CC2	814759335	YYVWBPOPYLRUIZ-PBHICJAKSA-N	439.534	1.481	50	20	IDGD	
NS(=O)(=O)N1CCC[C@@H](C(=O)OCC(=O)NN=C(c2ccccc2)c2ccccc2)C1	815262951	JDJJEWKNUPAUCC-GOSISDBHSA-N	444.513	1.014	50	20	IDGD	
COCc1cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)cc(C(=O)OC)c1	815566051	HOPODMQOQWMFQK-GFCCVEGCSA-N	447.419	1.312	50	20	IDGD	
CNC(=O)c1cc(Oc2cccc(NC(=O)C(=O)NNC(=O)c3ccc(O)cc3)c2)ccn1	815582702	NIKRQGLZYMXZSF-UHFFFAOYSA-N	449.423	1.339	50	20	IDGD	
CCN(Cc1cccc(NC(=O)C(=O)NNC(=O)[C@H]2CCCO2)c1)C(=O)OC(C)(C)C	815778937	KQASQDZRTIQCBL-MRXNPFEDSA-N	434.493	1.709	50	20	IDGD	
COCCN(C)NC(=O)c1cc(S(=O)(=O)N2CCOCC2)c(Cl)cc1Cl	816561884	PHOGEYPIMMWZCL-UHFFFAOYSA-N	426.322	1.237	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)CN1C(=O)N[C@]2(C[C@@H](C)CC(C)(C)C2)C1=O	863999668	XIFKZNGGOAIHOV-FPTDNZKUSA-N	446.504	1.358	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)CN2C(=O)N[C@]3(CCc4ccccc43)C2=O)c1	864001499	IVKTWIOYMJFLOJ-QHCPKHFHSA-N	436.468	1.223	50	20	IDGD	
O=C(NN=Cc1c(N2CCOCC2)nc2ccccn2c1=O)c1cc(-c2ccccc2)on1	874103746	ONAWYAVHNKWFGP-UHFFFAOYSA-N	444.451	1.950	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1cccc(C(F)(F)F)c1)C(=O)NNC(=O)c1ccccc1F	913416830	WGMHOPIYMDEVDG-SNVBAGLBSA-N	433.383	1.973	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2cccnc2)on1)c1ccc(S(=O)(=O)N2CCCC2)cc1	915357481	OEQXZTVOYZEBBJ-UHFFFAOYSA-N	441.469	1.596	50	20	IDGD	
O=C(NNC(=O)c1ccccc1-n1cccn1)c1ccc(S(=O)(=O)N2CCCC2)cc1	915657894	JBKMMIPCJCQJHB-UHFFFAOYSA-N	439.497	1.732	50	20	IDGD	
CC(C)CCC[C@@H](C)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	915884126	MSMAUOBKJXHCLX-MRXNPFEDSA-N	440.566	1.866	50	20	IDGD	
C[C@H](CCc1ccco1)NC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	915914171	OJMZPTUNTYSGMN-OAHLLOKOSA-N	436.538	1.258	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)NCc1ccccc1CN1CCOCC1	915927437	MTMRTBXKFSXMNM-MRXNPFEDSA-N	430.480	1.956	50	20	IDGD	
CCN(CC(=O)NNC(=O)c1ccccc1)CC(=O)Nc1ccc(N2CCOCC2)cc1	916145194	DPEZZWMTVNYPTM-UHFFFAOYSA-N	439.516	1.245	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCCNC(=O)NNC(=O)Cc2ccc3ccccc3c2)cc1	916273537	JECXXOMZXCLCEO-UHFFFAOYSA-N	440.525	2.000	50	20	IDGD	
O=C(Cn1cnc2ccccc21)NNC(=O)C1CCN(C(=O)CCOc2ccccc2)CC1	917911451	JQKFXVFOQDTWDV-UHFFFAOYSA-N	449.511	1.891	50	20	IDGD	
CN(C)c1ncccc1C(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	918245276	ZKCVVZVYKIUCAF-UHFFFAOYSA-N	442.483	1.924	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CC(=O)N(Cc2ccccn2)C1)c1ccc(F)cc1Br	918342484	YTSMGTXEUPHKNO-LLVKDONJSA-N	435.253	1.793	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)NNc2ncccn2)cc1	920852975	DFFSDXXHBHUSEG-PTNGSMBKSA-N	432.444	1.274	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@@H](C(=O)NNC(=O)c2ccccc2Cl)[C@@H](C)O)cc1	1319920864	WBGQKJDJMRJHTI-MLGOLLRUSA-N	425.894	1.137	50	20	IDGD	
CN(C)[C@@H]1CCCC[C@H]1NC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	1327831553	IJAKCAAAXTXNDZ-QZTJIDSGSA-N	437.566	1.288	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](F)Cl)C2)c1	1778021972	AGBCNIVISGHBJX-JTDSTZFVSA-N	446.928	1.752	50	20	IDGD	
O=C1CCc2ccc(C(=O)N3CC[C@H]4OCCC[C@@]4(CNC(=O)[C@@H](F)Cl)C3)nc2N1	1778025835	HDNHQDZUPSHXKF-AKCHCHLHSA-N	438.887	1.628	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc4ncccn4n3)C2)C1	1778462113	XTBNABHNPMKFBR-SCLBCKFNSA-N	436.310	1.204	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)COC(=O)C(F)(F)F)C2)C1	1778899078	ZKNMLYSRLRXLSZ-KBPBESRZSA-N	435.226	1.158	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](N)c1ccccn1)C2	1780713579	ZAIWCJOAZCJUOQ-YAJHFMINSA-N	443.375	1.832	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)c3cnc(OCF)cn3)CCO2)C1	1781228584	VGOBTKYKXVVAMB-DLBZAZTESA-N	435.283	1.462	50	20	IDGD	
O=C(c1ccn2nccc2c1)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781331503	LSQNWWNHIVBBHA-WMLDXEAASA-N	425.258	1.468	50	20	IDGD	
COc1ccc(F)cc1CC(=O)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781335417	YDRGGBYBJRDFSK-FUHWJXTLSA-N	447.276	1.897	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H]1CNc3ccccc31)C2	1782170719	VDAFXICKHFKJQJ-ODULNIPZSA-N	435.952	1.963	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc3[nH]ccc3n1)C2	1782176182	XKKBUKRSTDAEKM-FIKMYACPSA-N	434.924	1.944	50	20	IDGD	
O=C(NCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C(Cl)Cl)C1)c1ccco1	1782215221	LMUQHRALBRXQSG-FZKQIMNGSA-N	432.304	1.327	50	20	IDGD	
O=C(c1ccnc2ncccc12)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1782343186	BFCBJCBQWFTBOJ-KDOFPFPSSA-N	437.269	1.764	50	20	IDGD	
CCc1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](Br)CC)C3)C2)nn1C	1783353751	ZYEUDKKYMMJDIA-RDTXWAMCSA-N	427.343	1.600	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cnccc3N(C)C)CCO2)C1	1783532926	UCGOFSIPMNBXNE-SCLBCKFNSA-N	425.327	1.375	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3c(OC)cccc3OC)CCO2)C1	1783882625	QYTBQIBZVODCOT-VLIAUNLRSA-N	426.897	1.401	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(N4CCCCC4)cc3)C[C@@H]21)[C@H](O)CCl	1784092753	VPTMKEUOFLRWLY-WJMWBRGCSA-N	449.979	1.870	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H]3CCc4nc[nH]c4C3)C2)C1	1784353050	SJDWSQPWYODPJH-CKFHNAJUSA-N	439.354	1.518	50	20	IDGD	
COC[C@@H](C)C(=O)Nc1ccc(C2(NC(=O)c3cnccc3C(=O)NN)CCC2)cc1	1786436394	BNYHIVRJRYFGTJ-CQSZACIVSA-N	425.489	1.715	50	20	IDGD	
Cn1cccc(C(=O)Nc2ccc(C3(NC(=O)c4ccc(B(O)O)cc4)CCC3)cc2)c1=O	1786512701	DCANUCGWXKQASS-UHFFFAOYSA-N	445.284	1.127	50	20	IDGD	
COc1ccc(C(=O)Nc2ccc(C3(NC(=O)c4cccc(B(O)O)c4)CCC3)cc2)cn1	1786529687	RXRALDMGVLMURY-UHFFFAOYSA-N	445.284	1.832	50	20	IDGD	
CCc1nc(C(=O)NC2(c3ccc(NC(=O)c4ccc(B(O)O)cc4)cc3)CCC2)co1	1788142342	QMZZKEBKWKLFMZ-UHFFFAOYSA-N	433.273	1.978	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc4cnccc4nc3C)[C@H]2C1	1788290004	RPZSFHNMKGYVMT-DEYWJSPQSA-N	446.935	1.785	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)c1ccn2cncc2c1	1788406420	CFGGTUBLQYSLAQ-XIRDDKMYSA-N	435.322	1.713	50	20	IDGD	
C[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]21)N1C[C@H]2C[C@H]2C1	1788513616	ZGEUMQHCUPKMCR-UQSYLFMPSA-N	432.392	1.543	50	20	IDGD	
COc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Br)C[C@@H]32)ccn1	1788906695	XYOMIBIUPWQSTQ-PWNZVWSESA-N	430.274	1.374	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)c3ccccc3)C[C@@H]21)[C@@H](F)Br	1789922988	VTDCGAYYBIWCTO-UVPYHEFZSA-N	429.286	1.390	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21)[C@@H]1C[C@@]12C(=O)Nc1ccccc12	1791065037	QAEYQHMFJFXHBJ-OKMYWALYSA-N	435.883	1.411	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(F)cc3OC)C[C@@H]21	1791256191	HCAMWEWTHJXXFN-PTOXDTDZSA-N	428.888	1.681	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4nc(CO)[nH]c4c3)C[C@@H]21)C(Cl)Cl	1791294838	RFJUFWIRAGRVGH-HUBLWGQQSA-N	441.315	1.452	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1snnc1C1CC1)C2	1792868359	VEMDNEBXDRQKPY-SYEHKZFSSA-N	443.367	1.650	50	20	IDGD	
CC(C)(C)n1ncc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](O)CCl)c1Cl	1792976598	YIDGBYRDIKJQPE-XCCSTKFXSA-N	433.336	1.094	50	20	IDGD	
CC(C)(CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCl)NC(=O)OC(C)(C)C	1793108018	YOBOKDZRUOECII-LXTVHRRPSA-N	431.961	1.918	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C[C@@H]1OCCc2ccccc21)c1cccc(B(O)O)c1	1793488319	UGSIHCOWWKVYGI-KGSLCBSSSA-N	448.328	1.322	50	20	IDGD	
COc1ccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)CBr)C3)cc1	1795257850	GLUWATRARMFDCX-JNNRSPCRSA-N	439.350	1.858	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(CC(C)C)nn1C	1796018014	HYKAUYYRNRRZNP-CXHZTBPHSA-N	426.945	1.076	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Cl)C1	1796368051	BETZKWTZCOLZIP-WDTWZTHCSA-N	447.935	1.758	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc2ccccc12	1796784511	RFYBYZKLSLHBJI-FEJSZKPUSA-N	438.528	1.416	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1c[nH]c3ncccc13)C2	1796892572	RNKVBALNQOXKGR-CWNKPHDYSA-N	447.499	1.949	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccncn1	1796981546	PPIUBNPVWAHLEH-FQLMCAECSA-N	437.928	1.861	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1n[nH]c2c(F)cccc12	1797493388	UAFMUAUKRQPDCP-NJBDSQKTSA-N	439.285	1.689	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)n[nH]1)C2	1799217811	IHMCZPXHXNYEGX-CLLJXQQHSA-N	443.416	1.514	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccn(C(C)C)n1	1799453368	AOBXWGJOOCBBAI-GSWMANSFSA-N	439.520	1.850	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccnc2ncccc12	1799974670	OHUTZRRJLDPPAY-VWPFQQQWSA-N	447.333	1.864	50	20	IDGD	
Cc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)Br)ncc1[N+](=O)[O-]	1800756729	DFBBHQAWUSNWEF-MCYUEQNJSA-N	441.282	1.285	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc3cc(Cl)ccn13)C2	1800975331	MQJYBKFWMOPBOM-DMVWFOPNSA-N	441.315	1.445	50	20	IDGD	
CCOc1cccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](Cl)COC)c1O	1800977478	REBDHYBQQBAWSL-YXPYIKCWSA-N	426.897	1.248	50	20	IDGD	
C[C@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](O)CNC(=O)OC(C)(C)C)C2	1801959421	TVTFBPVYHQVLJD-HPCHECBXSA-N	448.358	1.294	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1(c3ccc(O)cc3)CC1)C2	1802335023	WIGCJLYGNDFCNV-BCDXTJNWSA-N	428.533	1.435	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccoc1C(F)(F)F)C2	1802336688	UERIWUVJOYBJSW-CLLJXQQHSA-N	430.427	1.923	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H](CNC(=O)[C@H]2CCC(=O)NC2)[C@@H]1c1cccnc1	1802607969	FCWBRYBGHFGBCA-UWVAXJGDSA-N	432.597	1.465	50	20	IDGD	
COc1ccc([C@H](O)C(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]2c2cccnc2)cc1	1803137900	VMPQMLQKJFETSL-AFYVEPGGSA-N	447.919	1.429	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(F)cc(F)c1F)c1cccc(B(O)O)c1	1803690016	JLSNPVSUSCVJQZ-MUJYYYPQSA-N	432.207	1.349	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)c2cccc(=O)n2C)[C@@H]1c1cccnc1	1805315060	DDOWWGUTLRBGKQ-YEWWUXTCSA-N	447.333	1.883	50	20	IDGD	
COc1ccnc(C(=O)N2CCC3(CCCN(C(=O)[C@@H](O)CCl)C3)CC2)c1OC	1805525006	BENJZKNXVLHQQF-AWEZNQCLSA-N	425.913	1.543	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)N1CC[C@H](CNC(=O)CCBr)[C@H]1c1cccnc1	1806343221	OAOHVKAWRRSJTO-DDUZABMNSA-N	437.338	1.563	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)CCC(F)(F)F)[C@H]1c1cccnc1	1806832423	PYLKPGWYLUTUCV-HNAYVOBHSA-N	443.470	1.803	50	20	IDGD	
Cc1ccc(CC(=O)N2CCCC3(CCN(C(=O)c4ccc(B(O)O)cc4)CC3)C2)cn1	1807195443	LAESLCMQKBTSIX-UHFFFAOYSA-N	435.333	1.157	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)[C@@H]2CC=CCC2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807359059	DJPRWNIGCOMOBW-SYYKKAFVSA-N	433.317	1.437	50	20	IDGD	
Cc1ncccc1C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1807369949	ZJNSGZAVHKJZAU-SIKLNZKXSA-N	444.300	1.098	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)c[nH]1	1807377184	ZCZSOTNFLBADDU-GHTZIAJQSA-N	432.289	1.031	50	20	IDGD	
C#CCO[C@H](C)C(=O)N1CC[C@H](CNC(=O)[C@H](F)Br)[C@H]1c1cccnc1	1808649816	XYRQWBVEXGQASW-MIGQKNRLSA-N	426.286	1.816	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)c3ncccc3F)CC2)C1	1809971554	ZJDBFGKOCHDEND-UHFFFAOYSA-N	425.269	1.059	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)[C@H]3CCc4ccccc43)CC2)C1	1809972374	ICRNVOSOGLOUNJ-QHCPKHFHSA-N	446.356	1.941	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)[C@@H]3[C@H]4C=CS[C@H]43)CC2)C1	1809973363	IZKIUMIFIBIBPU-GUDVDZBRSA-N	426.347	1.086	50	20	IDGD	
CCOc1ccc(C(=O)N2CC[C@H](CNC(=O)[C@@H](Cl)COC)[C@@H]2c2cccnc2)nn1	1813033304	PYHCLGCMBRRQNT-GJYPPUQNSA-N	447.923	1.844	50	20	IDGD	
C=C[C@H](O)C(C)(C)C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1813072426	DMCDMKDUGHTJSW-LVCYWYKZSA-N	445.564	1.034	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)C2CC(C)(C)C2)[C@H]1c1cccnc1	1813130089	VVANMEHOBQTDGE-LAUBAEHRSA-N	429.565	1.897	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CNC(=O)N(C)C)n[nH]1	1814562331	LURCENQDPLKKEG-DGCLKSJQSA-N	443.346	1.704	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC[C@H]1c1cc(NC(=O)C(F)(F)C(F)F)n[nH]1	1815542694	NTNRQFRAKVNXMJ-ZDUSSCGKSA-N	442.178	1.296	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2[C@H]3C=CS[C@H]32)[nH]n1)c1cccc(B(O)O)c1	1817476845	FDJOGIIDTGGBFN-IWKCEXAMSA-N	438.318	1.271	50	20	IDGD	
COc1ccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)nc1	1818400792	OGQLYOOQGVAEMB-LJQANCHMSA-N	449.276	1.113	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnc4[nH]ncc4c3)sc2C1	1818956722	SSKLCWPGCYEBCG-VXGBXAGGSA-N	434.909	1.894	50	20	IDGD	
Cn1ccc(=O)cc1C(=O)N[C@H]1CCc2nc(NC(=O)CO[Si](C)(C)C)sc2C1	1820166873	PFZDPRLRIRGMRX-LBPRGKRZSA-N	434.594	1.919	50	20	IDGD	
CC[C@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1820857090	YNUFCSRKGAMIGN-DZGCQCFKSA-N	433.900	1.732	50	20	IDGD	
C#CCCCCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1822581909	TXNJFQDWWQIQLA-SFHVURJKSA-N	437.504	1.908	50	20	IDGD	
CC(=O)N/C(C)=C/C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](F)Br)CC2	1824475193	HTXIJGAYGCPQMY-RGQOULRXSA-N	433.303	1.786	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@H]1CCc2nc(NC(=O)Cn3ccncc3=O)sc2C1	1824536719	VOMQJPBZDIKRQF-LBPRGKRZSA-N	435.582	1.164	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H]2CNC(=O)O2)CC1	1824574750	FPDKFAONOUBAOU-KFWWJZLASA-N	430.343	1.888	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(C(N)=O)cc1)CC2	1826008782	HDOJOFRNPVKLED-QWHCGFSZSA-N	436.921	1.722	50	20	IDGD	
CC[C@@H](NC)C(=O)N1CCCC[C@H]1C1CCN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)CC1	1827037153	OZTGUCDTHJUIDQ-VURWOWCXSA-N	444.580	1.738	50	20	IDGD	
O=C(C[C@@H]1CCCCO1)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827050036	FFLLEPAHROJERV-FCHUYYIVSA-N	442.365	1.559	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@H](F)Cl)CC1	1828926964	VFKSEEMDFQSOIY-HOTGVXAUSA-N	425.892	1.453	50	20	IDGD	
CC(C)(C)c1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)cn1	1829569302	AILOCDRCSZQTBG-JXFKEZNVSA-N	427.904	1.984	50	20	IDGD	
Cc1nc(C)c(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)o1	1830540834	TZKANPCUUVUTHZ-KZULUSFZSA-N	444.326	1.392	50	20	IDGD	
Cc1nc(CC(=O)N2CCC(N3CCC(NC(=O)[C@H](O)CCl)CC3)CC2)c(C)s1	1833307866	BQGBHPHYYWGVRP-GOSISDBHSA-N	443.013	1.474	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)CCCc3cccnc3)CC2)CC1)[C@@H](O)CCl	1833313158	YBSMBCKFXVCJPM-FQEVSTJZSA-N	436.984	1.576	50	20	IDGD	
CC(C)(C)c1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)ccn1	1833369135	PFKYVOQOLSOVHT-OXJNMPFZSA-N	427.904	1.984	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)[C@@H]3CCCS3(=O)=O)CC2)CC1	1833534646	JYRJOLYZURFKMR-ROUUACIJSA-N	448.029	1.543	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)c1ncc(F)cc1F	1833601158	MXRWUNIZOSYGIZ-MRXNPFEDSA-N	430.883	1.145	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3nnc(-c4ccccc4)o3)CCO2)C1	1837537612	ZGKLYUBFZCOTCI-KKSFZXQISA-N	448.907	1.824	50	20	IDGD	
CC(C)N[C@H](C(=O)N1CCOC[C@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1)C(C)C	1837711888	VZCZUAMCJAIIFK-FPOVZHCZSA-N	443.661	1.317	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1	1838637514	XCJWRZCBQAYDDT-KRWDZBQOSA-N	430.977	1.375	50	20	IDGD	
C[C@H](C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2)n1cccn1	1839155534	WKADZXCXJNWPOC-ZTFGCOKTSA-N	433.336	1.137	50	20	IDGD	
O=C(CCc1ccco1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839197762	HWRYJCBQVYBWIZ-RDJZCZTQSA-N	433.274	1.359	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cc3ccoc3cn1)CCO2	1839485318	KOLAQIKRTWVWKX-OAQYLSRUSA-N	447.564	1.749	50	20	IDGD	
Cc1nc(C)c(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)s1	1840031520	SHQZYQIRXXKYMN-PIGZYNQJSA-N	446.367	1.613	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)c(O)c1	1840036886	RVEJBKYUQWBWMC-IFXJQAMLSA-N	441.322	1.554	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3c(C)cccc3F)CCO2)C1	1840652253	JKQXDWXFEAYTBS-MGPUTAFESA-N	428.888	1.458	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H](C(=O)N2CC3(CCCN3C(=O)[C@@H](O)CCl)C2)[C@H](F)C1	1841348697	YVLPVPMXELYYJB-KFWWJZLASA-N	447.935	1.385	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H](C(=O)N2CC3(CCCN3C(=O)[C@H](O)CCl)C2)[C@H](F)C1	1841348700	YVLPVPMXELYYJB-RBSFLKMASA-N	447.935	1.385	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H]2C[C@]21C(=O)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1	1841353953	ZIDRASVRBULKRJ-PJSUUKDQSA-N	427.929	1.189	50	20	IDGD	
Cc1snc2sc(C(=O)N3CC4(CCCN4C(=O)c4ccc(B(O)O)cc4)C3)cc12	1843010998	DFKAHBJBUJNUIF-UHFFFAOYSA-N	441.343	1.477	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1cc(Cl)cnc1O)C2	1843415134	OLTPEAPBGJRPKD-WYMPLXKRSA-N	444.879	1.392	50	20	IDGD	
CN(CC(=O)N1CC2(CCCN2C(=O)[C@@H]2CC2(F)F)C1)NC(=O)NCc1ccccc1	1843853655	QMQMCSITQCFMFG-INIZCTEOSA-N	435.475	1.191	50	20	IDGD	
N#Cc1cc(C(=O)N2CCCC23CN(C(=O)[C@H](O)CCl)C3)ccc1Br	1845457804	JSEBSNXDBJKYGT-CQSZACIVSA-N	426.698	1.737	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCCC12CN(C(=O)Cn1ccccc1=O)C2	1845870776	BJUWWCYMMUQGHF-LICLKQGHSA-N	438.434	1.937	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)COCCOCCOCCOC)C1	1846255990	HSGHWLJDZXVYID-KRWDZBQOSA-N	434.961	1.294	50	20	IDGD	
CCn1c(CCC(=O)NNC(=S)NC(C)C)nc2cc(S(=O)(=O)N(C)C)ccc21	10741428	NDRFEWBOCQSYGN-UHFFFAOYSA-N	440.595	1.143	50	20	IDGD	
CN1C(=C(C#N)C(=O)COC(=O)Cc2n[nH]c(=O)c3ccccc23)N(C)c2ccccc21	12399995	QPZITUMLFPBDDY-UHFFFAOYSA-N	429.436	1.899	50	20	IDGD	
O=C(C[C@H](C(=O)O)c1ccccc1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	13254714	NBVFHMMCGPCYFX-SFHVURJKSA-N	445.497	1.491	50	20	IDGD	
Cc1cccc(NC(=S)NNC(=O)CCc2c(C)nc(N3CCOCC3)[nH]c2=O)c1	14319098	ZGGVEEYNORGDQH-UHFFFAOYSA-N	430.534	1.174	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)c2ccc3c(=O)n4c(nc3c2)CCCCC4)cc1	15939067	NBTIJYNOVZFDMU-UHFFFAOYSA-N	431.452	1.835	50	20	IDGD	
CC(C)[C@H](NC(=O)OCc1ccccc1)C(=O)NNC(=O)c1n[nH]c(=O)c2ccccc12	17195075	FZNLNVJSLBQQNS-KRWDZBQOSA-N	437.456	1.635	50	20	IDGD	
COc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)cc1	24299035	IRCAWXCDAMOKEY-STQMWFEESA-N	439.465	1.116	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)CN2C(=O)N[C@@](C)(c3ccc(F)cc3)C2=O)c2ccccc21	26938030	AMKFYZPEDKGJRI-QFIPXVFZSA-N	437.431	1.546	50	20	IDGD	
O=C(C(=O)N1CCN(S(=O)(=O)c2ccc(CCCCl)cc2)CC1)N1CCCC1	726973924	ABIYOECAQKHGSZ-UHFFFAOYSA-N	427.954	1.313	50	20	IDGD	
COC(=O)CCn1nc(C)c(C=NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1C	727058708	DHVYXGVACWGYKP-UHFFFAOYSA-N	435.506	1.077	50	20	IDGD	
COc1cc(-n2cnnn2)c(Cl)cc1C(=O)NNC(=O)CNc1ccc(C)cc1C	728205071	JNWCTOVXBHQJQU-UHFFFAOYSA-N	429.868	1.814	50	20	IDGD	
CC/C=C(\C)C(=O)N1CSC[C@H]1C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	728211928	MGOVJXMMASQGIM-UEIWYUPXSA-N	438.575	1.828	50	20	IDGD	
O=C(COC(=O)c1[nH]c2ccccc2c1Cl)NNC(=O)[C@H]1COc2ccccc2O1	728325377	MAUVNPZHTOLSKV-OAHLLOKOSA-N	429.816	1.966	50	20	IDGD	
CN(CC(=O)NNC(=O)c1cc(F)ccc1Br)S(=O)(=O)c1cccnc1	728549292	IBGSVBXQQRJPTE-UHFFFAOYSA-N	445.270	1.065	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN(S(=O)(=O)Cc2ccccc2)C1)c1ccc(Cl)nc1	730531134	JQCUPHHWMKXNMT-INIZCTEOSA-N	436.921	1.738	50	20	IDGD	
O=C(CN1CCC([C@@H](O)c2ccc(F)cc2)CC1)NNC(=O)c1cccc([N+](=O)[O-])c1	731038670	PBAVFKIKWNAOPI-FQEVSTJZSA-N	430.436	1.941	50	20	IDGD	
CC(=NNC(=O)Cc1ccccc1F)c1cccc(N(S(C)(=O)=O)S(C)(=O)=O)c1	731316749	ILOBFSWRMNEYJF-UHFFFAOYSA-N	441.506	1.634	50	20	IDGD	
Cc1c(C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)nnn1-c1ccc2c(c1)OCCO2	731454020	YRMSQSCGBFJUNJ-ZDUSSCGKSA-N	441.419	1.715	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)c2ccc(OCC(N)=O)cc2)cc1	731485561	PQLPWWVWXUFYBP-UHFFFAOYSA-N	440.485	1.046	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CCN2C[C@H](C)O[C@@H](C)C2)cc1I	732261360	MMPBQMYWGYCOSB-STQMWFEESA-N	445.301	1.860	50	20	IDGD	
CC(=NNC(=O)c1cnn(-c2ccccc2)c1)c1ccc(S(=O)(=O)NCC(=O)O)cc1	733078454	NJQKIXKGZXWTMF-UHFFFAOYSA-N	441.469	1.389	50	20	IDGD	
O=C(NNC(=O)[C@H](Cc1cccnc1)NC(=O)c1ccccc1)c1ccc([N+](=O)[O-])cc1	733252021	BDMBLACXAMIEHZ-IBGZPJMESA-N	433.424	1.792	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)CCNC(=O)c2ccsc2)CC1	734822422	VIBPODVEAFRQQC-UHFFFAOYSA-N	439.538	1.598	50	20	IDGD	
Cc1nc(-c2cccnc2)nc(NNC(=O)CCc2ccc(S(N)(=O)=O)cc2)c1C	736696649	KTTYJLRNJLHZDI-UHFFFAOYSA-N	426.502	1.879	50	20	IDGD	
O=C(C[C@@H]1SC(N2CCCC2)=NC1=O)Nc1ccc(C(=O)NNc2cccnn2)cc1	736701794	HDIJBJMOMUVWNM-HNNXBMFYSA-N	439.501	1.656	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)NC3CCN(C[C@@H]4CCOC4)CC3)n[nH]2)cc1	737056180	JVOOJUCWZIJOLA-INIZCTEOSA-N	426.521	1.830	50	20	IDGD	
CC(=NNC(=O)c1ccc2c(c1)OCO2)c1cccc(S(=O)(=O)N2CCOCC2)c1	739399710	HFZVZWJRAYWVSQ-UHFFFAOYSA-N	431.470	1.590	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)CSc1nncn1-c1ccc(C(C)C)cc1	740851611	OCYLMLSZSKTDIQ-UHFFFAOYSA-N	432.550	1.935	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)[C@@H](C)NC(=O)c2cc3c(C)nn(C)c3s2)cc1	743293785	KBCKZFSDBBNCAT-GFCCVEGCSA-N	444.517	1.330	50	20	IDGD	
C[C@H]1C[C@H](NC(=O)NNC(=O)c2ccc(Br)s2)C(=O)N1c1cnn(C)c1	743518788	UJZFPLOPIBYLDO-WPRPVWTQSA-N	441.311	1.382	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)C[C@@H](c2ccccc2)N2CCOC2=O)cc1	743830441	VEKRKVKVAVRJMU-KRWDZBQOSA-N	446.485	1.826	50	20	IDGD	
C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)OCC(=O)NNC(=O)c1ccc(C#N)cc1	744496843	INWCMKOJRLFJGW-LBPRGKRZSA-N	428.426	1.951	50	20	IDGD	
CC(=O)Nc1c(C)cccc1C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	744620223	HFGBXPHAYLFQRH-UHFFFAOYSA-N	432.502	1.731	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)c1cc([N+](=O)[O-])ccc1O)N1CCN(c2ccccc2)CC1	745519313	QKUOYYSJMYNJLS-OAHLLOKOSA-N	442.476	1.455	50	20	IDGD	
COCCOC[C@H](C)NC(=O)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1	745863256	CRIYPFKSRGMZMG-AVRDEDQJSA-N	440.544	1.995	50	20	IDGD	
O=C(CCCc1ccccc1)NNC(=O)[C@@H]1CN(Cc2nc(O)c3ccccc3n2)CCO1	746209719	AFAYSHXBZMECMA-FQEVSTJZSA-N	449.511	1.707	50	20	IDGD	
Cn1c(=O)nc(O)c2nc(CCC(=O)NNC(=O)c3ccc(Cl)cc3Cl)[nH]c21	746231765	MCFQAMCFEDGROV-UHFFFAOYSA-N	425.232	1.063	50	20	IDGD	
O=C(CCOc1ccccc1)NNC(=O)NCc1ccc(C(=O)N2CCOCC2)cc1	747104646	GIAOKRLIVFOILS-UHFFFAOYSA-N	426.473	1.459	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)/C=C/c1ccccc1)C(=O)NNC(=O)Cc1ccncc1	747428735	UUHXARHXBCIXMG-PMXLPMHFSA-N	448.570	1.484	50	20	IDGD	
COc1ccc(C(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)cc1N1CCNC1=O	747717346	RFLCEAIEKVGLDW-UHFFFAOYSA-N	446.847	1.496	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)CNC(=O)NCc2ccc([N+](=O)[O-])cc2)c1	748214065	JMGZFDWLRKOBGJ-UHFFFAOYSA-N	429.433	1.237	50	20	IDGD	
O=C(NNC(=O)C(=O)N1CCCC1)NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1	748460111	JHVWPADAUTUHCL-UHFFFAOYSA-N	441.454	1.623	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)CCc3ccccc3)CC2)cc1	749798645	DSJRDTRIDVYNRB-UHFFFAOYSA-N	444.557	1.082	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)c1ccc(F)cc1I	751206072	ASNCONXLLWTPTK-UHFFFAOYSA-N	447.229	1.683	50	20	IDGD	
N#CCCn1cc(/C=C(\C#N)C(=O)NCCCn2cc(CO)nn2)c(-c2ccccc2)n1	753012453	VZYGKXIYCBTZQM-LDADJPATSA-N	430.472	1.661	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)N[C@H]2CCN(c3ccccn3)C2)nc1	753729203	SDDUOXVTFZOJAJ-HNNXBMFYSA-N	433.538	1.412	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2c(C)c3ccccc3oc2=O)cc1OC	754614477	LLVZIHLDFKYYPR-UHFFFAOYSA-N	440.408	1.737	50	20	IDGD	
CC(=O)N1CCC[C@@H](C(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)C1	754801904	DKNFWPIMKOBGGQ-HXUWFJFHSA-N	447.499	1.408	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N(CC)CC)cc1NC(=O)NNC(=O)c1cccn1C	755443217	WLWAEHZCEFGTBK-UHFFFAOYSA-N	437.522	1.921	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)[C@H]2COc3ccccc3O2)ccc1N1CCCC1=O	755591512	GNWNNKBWEXOXAW-GOSISDBHSA-N	426.429	1.815	50	20	IDGD	
Cc1c(NC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cccc1C(=O)N1CCOCC1	756184810	NLMDFMIUHXGUTI-IBGZPJMESA-N	440.456	1.460	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)N[C@@H]2CCN(c3c(F)cccc3F)C2=O)cc1C	756212462	QUZRERYYCHWRMF-MRXNPFEDSA-N	445.426	1.656	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)N[C@@H](C)c2ccc([S@](C)=O)cc2)nc1	756721323	GFRKRFCGLWFGGA-OIJAAMDRSA-N	439.563	1.893	50	20	IDGD	
CN(C)Cc1ccc(C(N)=O)cc1NC(=O)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	756827110	OPLAWYHETROZMD-UHFFFAOYSA-N	439.451	1.843	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCc2n[nH]cc2C1)c1cccc(S(=O)(=O)N2CCCCC2)c1	756844522	HAMLQIHLNBJBKF-OAHLLOKOSA-N	431.518	1.150	50	20	IDGD	
CCN(CC)CCNC(=O)c1cc(NC(=O)NNC(=O)c2cnn(C)c2)ccc1Cl	757758382	UGTBPHAEQYLAFQ-UHFFFAOYSA-N	435.916	1.612	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)Nc2cccn(CCS(C)(=O)=O)c2=O)cc1	757781192	PMRSJZKCSPCZKY-UHFFFAOYSA-N	438.531	1.146	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)c1cc(COc2c(Cl)cccc2Cl)on1	758380775	ORSXWOMJJWSAFP-VIFPVBQESA-N	448.284	1.756	50	20	IDGD	
COc1cc2c(cc1C=NNC(=O)c1cccc(S(=O)(=O)N3CCOCC3)c1)OCO2	758868035	AEYMSWWESVAMDQ-UHFFFAOYSA-N	447.469	1.209	50	20	IDGD	
Cc1cc(O)cc(=O)n1CC(=O)NNC(=O)COc1ccc(OCc2ccccc2)cc1	759687911	DAKGYJNVYQBZLI-UHFFFAOYSA-N	437.452	1.668	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)CS(=O)(=O)Cc2cccc(Br)c2)nc1	759740845	YSEYJAYMRMNBKS-UHFFFAOYSA-N	442.291	1.689	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)N[C@H]2CCOC[C@@H]2OCC)c2ccccc2c1=O	760132133	OWNKPWHFFMZISQ-ROUUACIJSA-N	445.520	1.725	50	20	IDGD	
C[C@H](O)c1cn(CC(=O)NNC(=O)c2cn(-c3ccccc3)nc2-c2ccccc2)nn1	762965448	YJKOELHSNUJSHG-HNNXBMFYSA-N	431.456	1.645	50	20	IDGD	
CCN(Cc1ccccc1NC(=O)C(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)C(C)=O	763468638	OUUBCOHOSSHOIO-UHFFFAOYSA-N	427.417	1.363	50	20	IDGD	
Cc1nn(CC(F)(F)F)c(C)c1CC(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	763480208	XXAWNTZQSFJCJN-UHFFFAOYSA-N	436.394	1.957	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ccc(OC)c(OC)c2)ccc1Cl	763551350	ONTHXFTWIQTQRY-UHFFFAOYSA-N	435.820	1.544	50	20	IDGD	
COCC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)cc1	763603494	CFQXGNRNPHCGTB-UHFFFAOYSA-N	436.428	1.061	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)[nH]n1)C(=O)N1C[C@@H]2CCCN2c2ccccc21	763604924	LTQWXMPZPQMGFY-INIZCTEOSA-N	430.468	1.853	50	20	IDGD	
COC(=O)c1[nH]c(C)cc1NC(=O)C(=O)NNC(=O)COc1cccc(C(F)(F)F)c1	763639722	QVPNKSVVQDTBMV-UHFFFAOYSA-N	442.350	1.293	50	20	IDGD	
CC(C)(C)OC(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)COc2ccccc2F)c1	763678659	HDNPJLYUSHIUNJ-UHFFFAOYSA-N	445.447	1.875	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)C(=O)Nc1ccccc1C(=O)N1CCCCC1	763679836	PIIYDDIMGUBBIT-UHFFFAOYSA-N	442.447	1.617	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2cc(C)nn2[C@@H]2C[C@H]3CC[C@H]2C3)c1	763771724	FLKFJNOHQRRKIN-SUNYJGFJSA-N	441.488	1.970	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2cccc(NC(=O)C3CC3)c2)c1	763771906	HCQKXXWPRMMNHQ-UHFFFAOYSA-N	426.429	1.452	50	20	IDGD	
C[C@@H]1COCCN1c1ccc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCC3)cc1	763784660	GAPJSBPLTXHXLA-CYBMUJFWSA-N	428.514	1.862	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(-c3nnc(N(C)C)o3)cc2)cc1	763812205	RLFHGPSLFKALEP-UHFFFAOYSA-N	438.444	1.276	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccn(Cc3ccccc3)c2=O)cc1	763821612	VIBVGDDYEHBSAR-UHFFFAOYSA-N	434.452	1.370	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1cnn(-c2ccccc2F)c1	763848274	BCEOJLUAYNQRIS-GFCCVEGCSA-N	429.383	1.704	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccc(-n2cncn2)c(F)c1	763863705	BEHDUHIBMFNXSV-LLVKDONJSA-N	430.371	1.099	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccc(-n2cncn2)c(F)c1	763863708	BEHDUHIBMFNXSV-NSHDSACASA-N	430.371	1.099	50	20	IDGD	
COCCOc1cc(C)ccc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccc(F)cc1	763873695	XPAWUKOCXXSZGO-AWEZNQCLSA-N	433.436	1.713	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)NCCS(=O)(=O)c1ccc(Cl)cc1	763930205	BOPSACXPORJKCP-UHFFFAOYSA-N	443.934	1.942	50	20	IDGD	
O=C(NNC(=O)c1cc2c(s1)CCCCC2)C(=O)Nc1cc(-n2cnnn2)ccc1F	763962056	KRIKEVAVVQJWCI-UHFFFAOYSA-N	443.464	1.532	50	20	IDGD	
COc1c(Cl)cccc1NC(=O)C(=O)NNC(=O)c1cc(Br)cn1C	764002862	UEMCWIYJBWPMHH-UHFFFAOYSA-N	429.658	1.849	50	20	IDGD	
CCCNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)on2)c1	764003177	BLOAGOYBYWTHTC-UHFFFAOYSA-N	435.440	1.881	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)N2C[C@@H]3CCCN3c3ccccc32)o1	764138900	LWKWACDBXDRENN-INIZCTEOSA-N	439.516	1.898	50	20	IDGD	
O=C(CCCc1ccccc1)NNC(=O)C(=O)Nc1cccc(-c2nnnn2C2CC2)c1	764224742	SFXAWLJRIAPJEF-UHFFFAOYSA-N	433.472	1.784	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)C(=O)Nc1nc(-c2ccccc2OC(F)F)cs1	764296666	FSAJIDARWUKMDO-UHFFFAOYSA-N	436.400	1.843	50	20	IDGD	
CC(C)(C)OC(=O)NCc1cccc(NC(=O)C(=O)NNC(=O)Cc2ccncc2)c1	764355732	HFXZPWNSBFVNGA-UHFFFAOYSA-N	427.461	1.435	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@]2(CCN(CC(=O)NNC(=O)c3cccc(C#N)c3)C2)C1	765035766	VWKGTFJXLGZZCE-JOCHJYFZSA-N	427.505	1.652	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)CCN2C(=O)NC3(CCCC3)C2=O)n[nH]1	765593381	YAFFBYLWQVNTCJ-UHFFFAOYSA-N	440.460	1.101	50	20	IDGD	
O=C(CNC(=O)NCc1ccc(F)cc1)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	765607122	KDHCWERJAVXYRI-UHFFFAOYSA-N	428.399	1.615	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)N1CCO[C@@H](c2ccc(OC(F)F)cc2)C1	765668758	JCWNFOXZOFFDAF-OAHLLOKOSA-N	438.387	1.425	50	20	IDGD	
Cc1ccc(C(=O)N2CCN(CC(=O)NNC(=O)Cc3ccccc3C)CC2)cc1F	766856185	OOQCBOPHOUUDJF-UHFFFAOYSA-N	426.492	1.590	50	20	IDGD	
Cc1ccc(Cl)c(S(=O)(=O)N2CCN(S(=O)(=O)CBr)CC2)c1	767851669	SBYRMGUKZVZSJY-UHFFFAOYSA-N	431.761	1.637	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)[C@](C)(NC(=O)OC(C)(C)C)c3ccccc3)nc21	767924395	AOQUNVDFNRYLQF-HXUWFJFHSA-N	427.465	1.952	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(C)(C)O)cc1S(=O)(=O)N[C@@H]1CCCC[C@H]1C	768245770	FXCBCCVKVBNYJQ-TZMCWYRMSA-N	427.523	1.084	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)C3(C(=O)NC4CC4)CCC3)n[nH]2)cc1OC	768276813	MBAZLOFJLCKVHC-UHFFFAOYSA-N	427.461	1.304	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(NC(C)=O)c(F)c2)cc1OC	769002007	YGRNHDOFAQCNPF-UHFFFAOYSA-N	433.392	1.419	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)Nc1cc(S(N)(=O)=O)cc(C)c1C	769242211	UCIJGBXDERYTLU-UHFFFAOYSA-N	442.519	1.512	50	20	IDGD	
Cc1cc2c(N3CCC[C@H]3C(=O)NNc3nc(O)c4cnn(C)c4n3)ncnc2s1	770983665	OPYDJWJTWARVHT-LBPRGKRZSA-N	425.478	1.494	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NN=Cc2ccc(N3CCN(C)CC3)cc2)cc1	771556282	YMHUUTPKRXHIEJ-UHFFFAOYSA-N	443.573	1.518	50	20	IDGD	
O=C(CCCc1ccc2nc(O)[nH]c2c1)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772887984	FABAXORLGSKNNB-UHFFFAOYSA-N	429.864	1.708	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N[C@H](C)CS(=O)(=O)c2ccc(C)cc2)cc1OC	773136649	WBIXEKUUPNUEKL-CQSZACIVSA-N	435.502	1.819	50	20	IDGD	
Cc1ccc(CCC(=O)NCC(=O)NNC(=O)[C@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1	773413084	ZUQJCAOCYWAHNW-SFHVURJKSA-N	446.548	1.838	50	20	IDGD	
CS(=O)(=O)N1CCc2c(NC(=O)C(=O)NNc3ccc(C(F)(F)F)cn3)cccc21	773662436	VDIOTSCTEXMQJB-UHFFFAOYSA-N	443.407	1.504	50	20	IDGD	
COC(=O)c1ccc(OC)cc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1cccc(Cl)c1	774000969	BFBKASTZEBKJMF-LLVKDONJSA-N	449.847	1.689	50	20	IDGD	
COc1ccc(SC)c(OC)c1C(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	775962773	ZZRCOAXBSFQFEI-UHFFFAOYSA-N	449.441	1.952	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)N[C@@H]2CCO[C@@]3(CCS(=O)(=O)C3)C2)c1C	776004655	UFECBXATSCYZPJ-ITBUCFEJSA-N	435.546	1.511	50	20	IDGD	
COc1cccc([C@H]2[C@@H](C(=O)NNc3nc(O)c4cnn(C)c4n3)CC(=O)N2C2CC2)c1	776475205	DEUPFRBMPBLREL-YOEHRIQHSA-N	437.460	1.273	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(C(=O)NNC(=O)CNC(=O)OC(C)(C)C)cc1	778447631	BMYQJDYNSCCBDC-UHFFFAOYSA-N	428.511	1.003	50	20	IDGD	
COc1cc(N2C[C@@H](C(=O)NNc3cc(Cl)nc(N)n3)CC2=O)cc(OC)c1OC	779374770	DVMPVNLJFDFSCE-VIFPVBQESA-N	436.856	1.234	50	20	IDGD	
COc1cc(Br)c(F)cc1S(=O)(=O)NNC(=O)c1ccc2c(c1)OCO2	779830533	XRGUHQYVUGRVCV-UHFFFAOYSA-N	447.238	1.949	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@]2(C[C@@H]2C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)C1	780347887	PPFQXNSANUJHBW-QRWLVFNGSA-N	437.518	1.498	50	20	IDGD	
O=C(NNc1cccc2c1CCCC2)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(F)cc1	780950531	JDABGMXFTUOVBZ-UZLBHIALSA-N	433.505	1.972	50	20	IDGD	
CN1CCC/C1=N/S(=O)(=O)c1cccc(NC(=O)C(=O)NNc2ccccc2F)c1	782706047	OSUMKTSXXZVQPR-ULJHMMPZSA-N	433.465	1.720	50	20	IDGD	
O=C(NN=c1cc[nH]cc1)C(=O)Nc1cc(Br)cnc1OCC(F)(F)F	783378307	DOKWQASLBPZSIJ-UHFFFAOYSA-N	434.172	1.684	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)cn1C	783408528	LMZZKTBPFVZMEC-UHFFFAOYSA-N	448.379	1.187	50	20	IDGD	
CN1CCC/C1=N\S(=O)(=O)c1cccc(NC(=O)C(=O)NN(C)c2ccccc2)c1	783432474	YNLOSFDZLCJGJE-PTGBLXJZSA-N	429.502	1.606	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2ccc(-n3cccn3)nn2)ccc1OC1CCOCC1	783432832	FRARLMQIIUANAP-UHFFFAOYSA-N	437.460	1.610	50	20	IDGD	
Cn1c(=O)n(C)c2cc(NC(=O)C(=O)NNc3nc(-c4ccc(Cl)cc4)no3)ccc21	784795066	LAULFRFYIQUTCW-UHFFFAOYSA-N	441.835	1.662	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1ccc(OC2CCCC2)nc1	785331085	OCVWNBKZNRYHTJ-UHFFFAOYSA-N	448.501	1.897	50	20	IDGD	
O=C(COC(=O)c1ccnc(OC2CCC2)c1)NNC(=O)[C@@H]1COc2ccccc2O1	786642999	IHGOYDNESPDBFQ-KRWDZBQOSA-N	427.413	1.157	50	20	IDGD	
Cc1ccc(N2CCNC2=O)cc1NC(=O)C(=O)NNC(=O)c1cnn(-c2ccccc2)c1	787550860	YLTKZCZJCVEONY-UHFFFAOYSA-N	447.455	1.110	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2cc(F)c(F)cc2F)cc1C(=O)N1CCOCC1	787563605	QCCKJFKYOBNGBO-UHFFFAOYSA-N	436.390	1.967	50	20	IDGD	
COc1cccc([C@H]2[C@@H](C(=O)NNc3ccccc3S(N)(=O)=O)CC(=O)N2C2CC2)c1	788223944	QHHIQSLZXCEYLY-JXFKEZNVSA-N	444.513	1.538	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)c1ccnc(Oc2ccc(F)cc2F)c1	788760761	JNVDBMRZOKWHOZ-UHFFFAOYSA-N	427.367	1.738	50	20	IDGD	
C[C@H]1C[C@H](C)CN(S(=O)(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)C1	788918730	ZSNOHIHQXAGYOK-GJZGRUSLSA-N	433.575	1.318	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N1CC[C@H](N2CCCC2=O)C1	791010461	VISURTLIPRAYOU-JSGCOSHPSA-N	439.310	1.654	50	20	IDGD	
O=C(NNc1cncc(Cl)n1)C(=O)Nc1ccc2c(c1)N(CC(F)F)C(=O)CS2	793034372	NUBSQUOVRLJVRA-UHFFFAOYSA-N	442.835	1.916	50	20	IDGD	
Cc1cc(NC(=O)[C@H](C)SCC(=O)NNc2ccccc2S(=O)(=O)N(C)C)no1	795177874	SKXWAWQZHHKNIL-LBPRGKRZSA-N	441.535	1.437	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)c(OC)c(C)c1OC	796989289	DSIVKBITFNBKOJ-GFCCVEGCSA-N	449.435	1.713	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2cc(OC)c(OC)c(C)c2OC)cc1	797002345	QIDBQJGCSZOSQS-UHFFFAOYSA-N	445.472	1.748	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NC(=O)NNC(=O)c2cc3ccccc3cc2O)nc1	797653077	BWQJBGSEBPATNN-UHFFFAOYSA-N	429.458	1.657	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(Cl)c(CN(C)C)c1	799256843	AHNOFZKHSAOJDE-UHFFFAOYSA-N	448.907	1.965	50	20	IDGD	
Cc1ccccc1-n1c(C)cc(/C=C(\C#N)C(=O)NCCC(=O)NS(C)(=O)=O)c1C	800552039	YEEOUXNIBOHRLP-LDADJPATSA-N	428.514	1.892	50	20	IDGD	
CC1(C)CN(Cc2ccccc2)CC[C@@H]1NC(=O)NNC(=O)CNC(=O)c1ccco1	801006156	SGKWNESISZSZQB-SFHVURJKSA-N	427.505	1.641	50	20	IDGD	
COc1cc(F)cc(NNC(=O)c2ccc(F)c(S(=O)(=O)N3CCOCC3)c2)c1	801177026	CPDXUCODRAHGQJ-UHFFFAOYSA-N	427.429	1.751	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1	801427584	XMHTXNKFVNINJM-FQEVSTJZSA-N	441.484	1.673	50	20	IDGD	
O=C(CCS(=O)(=O)c1ccc2c(c1)OCCO2)NNC(=O)Nc1cc(F)cc(F)c1	802004719	SVMMNWGBAIGNQQ-UHFFFAOYSA-N	441.412	1.753	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)CN2C(=O)N[C@](C)(c3ccc(F)cc3)C2=O)cc1	802060246	CKXRFPNMYXVJAS-HXUWFJFHSA-N	429.408	1.454	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)c2cc(Br)ncc2Cl)cc1	805626222	AYGPIJLCOKSFFN-UHFFFAOYSA-N	437.637	1.987	50	20	IDGD	
Cc1cccn(Cc2c(F)cccc2NC(=O)C(=O)NNC(=O)c2ccc(C#N)cc2)c1=O	806978250	SOVWMPYJDXHKPQ-UHFFFAOYSA-N	447.426	1.616	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2cc(C)n(-c3ccc(F)cc3F)n2)c1	808934761	UTTWILANFPHUNX-UHFFFAOYSA-N	443.410	1.932	50	20	IDGD	
COC(=O)c1cn(-c2cccc(NC(=O)NNC(=O)COc3cc(C)ccc3C)c2)nn1	812979915	GYGFARJWLQYUAB-UHFFFAOYSA-N	438.444	1.902	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)c1cnn(-c2ccccn2)c1N	814739584	WKGDRBKTUJYYSU-NSHDSACASA-N	445.277	1.841	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)N(C)[C@@H]2CCN(S(C)(=O)=O)C2)N(C)c2ccccc21	816817492	CVRGMWDDPGVDQT-OAHLLOKOSA-N	445.545	1.149	50	20	IDGD	
CCCn1c(C)cc(/C=C(\C#N)C(=O)N2CCN(S(=O)(=O)c3cc[nH]n3)CC2)c1C	819493810	IBDSMNAWPPUKFN-QGOAFFKASA-N	430.534	1.678	50	20	IDGD	
O=C(NCCCN1C(=O)NC2(CCCCC2)C1=O)NNC(=O)c1c[nH]c2ccccc12	913638556	YJUPIGSCHVFVPT-UHFFFAOYSA-N	426.477	1.757	50	20	IDGD	
COc1ccc2c(c1)C[C@@H](C(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)CO2	915014948	PTVCMGPDISOUHD-CQSZACIVSA-N	429.385	1.159	50	20	IDGD	
COc1cccc(C[C@@H](C(=O)NNC(=O)Cc2ccc(Cl)cc2)n2nnnc2C)c1	915686485	CWURQZZPEYMFHR-SFHVURJKSA-N	428.880	1.817	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(C)=O	915775527	GUQKGIGKVFJHMH-HXUWFJFHSA-N	446.511	1.975	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)NCCN2CCN(Cc3ccccc3)CC2)c1	915901396	HWIVZDNLAFTOHM-UHFFFAOYSA-N	441.532	1.466	50	20	IDGD	
CCC(CC)[C@@H](CNC(=O)NNC(=O)c1cc(Br)c[nH]1)N1CCOCC1	916255702	DRKKRJKETNQHOV-OAHLLOKOSA-N	430.347	1.858	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NCCNS(=O)(=O)Cc1ccccc1	916517554	ZIRYZXSOCGAALO-CQSZACIVSA-N	438.481	1.043	50	20	IDGD	
CC(=O)N1CCc2cc(Br)c(S(=O)(=O)NNC(=O)c3ccc[nH]3)cc21	917731736	YHNCJDRLYIZKFW-UHFFFAOYSA-N	427.280	1.310	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCc2ccc(Cl)nc2)cc1	918079855	GUTMCERNKJLQSB-UHFFFAOYSA-N	425.898	1.195	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)[C@H]1CS[C@@H](Cc2ccccc2F)C(=O)N1	920212751	HORTXOVNFZQFSA-AEFFLSMTSA-N	431.489	1.367	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)N2CCC(=NNC(=O)Cc3csc(C)n3)CC2)cc1	920365450	BMEPYFPEWMLIKF-UHFFFAOYSA-N	449.558	1.909	50	20	IDGD	
CCN(C)C(=O)c1cccc(S(=O)(=O)NNC(=O)c2cncn2-c2ccccc2)c1	1261128938	FMAKCQSAURPTAW-UHFFFAOYSA-N	427.486	1.588	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)N[C@H]2CCCN(C(=O)c3ccccc3)C2)nc2ccccc21	1318155637	KTCDPTZIIFCFCT-KRWDZBQOSA-N	434.500	1.751	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)NCc2ccccc2NS(C)(=O)=O)c1C	1319048288	XJTAJOOSXCVQRS-HNNXBMFYSA-N	434.518	1.973	50	20	IDGD	
Cc1c(C(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)cnn1-c1ccncc1	1319788945	KJNPAWUPFYOANG-UHFFFAOYSA-N	428.493	1.984	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C=C\C(=O)NC1CC1)C2	1779545527	VSLFDAYEUSYEHZ-UXTXJKSZSA-N	437.613	1.187	50	20	IDGD	
O=C(C1=C2c3ccccc3C(=O)N2CC1)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Cl)CCO2	1780004329	BUZMWDYZLZQGSK-UTKZUKDTSA-N	433.867	1.622	50	20	IDGD	
COCCC(=O)N1CCO[C@@]2(CCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1	1780097105	QLYQBTAVWZEUMQ-FQEVSTJZSA-N	435.433	1.000	50	20	IDGD	
CC(=O)O[C@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)Br)C1)C(C)C	1781997808	JEWCGUZUZYQCBZ-NQUFMGSDSA-N	447.370	1.871	50	20	IDGD	
C#CCCCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2	1782190258	WQJCDQGFCVRLEM-RCBCJABQSA-N	441.532	1.438	50	20	IDGD	
COc1cccc2c1C[C@H](C(=O)N1CC[C@@]3(CN(C(=O)[C@H](O)CCl)CCO3)C1)CC2	1782986380	ZDGDKCBISZAOFT-CDMIOBSGSA-N	436.936	1.230	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cc(O)ccc3O)CCO2)C1	1783354318	YCWQLFHMSXAMPM-KBXCAEBGSA-N	427.295	1.715	50	20	IDGD	
CCC[C@H]1CC[C@H](C(=O)N2CC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)CC1	1783367926	ZMXLZXCJZTWMKW-DNVFCKCGSA-N	436.597	1.796	50	20	IDGD	
Cc1cnc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]3C2)cn1	1783968494	VMPZMBOHHUKPBB-DSRCVFDASA-N	425.327	1.409	50	20	IDGD	
CCOC(=O)C1(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]3C2)CC1	1783975044	YOONYBVQDMXADL-AJNGGQMLSA-N	445.354	1.340	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](C)n3ccnc3C)C2)C1	1784638953	IIRUSJMTVZZYKY-DHSIGJKJSA-N	427.343	1.756	50	20	IDGD	
CCN1CCC(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)CC1	1785638921	FIQBPLQJBSQXKV-DNVCBOLYSA-N	430.387	1.579	50	20	IDGD	
Cc1ccc2c(/C=C/C(=O)N3CC[C@@]4(C3)CN(C(=O)[C@H](O)CCl)CCO4)c[nH]c2c1	1785664009	PQHQAYHLYRZXPW-DIVZQSFRSA-N	431.920	1.919	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1(c2ccc(NC(=O)[C@H](O)CCl)cc2)CCC1	1786132095	IRRREHGINICAGP-FCLYZYNOSA-N	445.907	1.854	50	20	IDGD	
COc1cccc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCBr)[C@H]3C2)n1	1786401103	OQCINRBNNKEEPW-BPUTZDHNSA-N	440.338	1.397	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3=NN(c4ccccc4)C(=O)C3)[C@H]2C1	1787540240	PVJPJRGKRMYDSH-RMRDIRSESA-N	446.935	1.776	50	20	IDGD	
Cc1nnsc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)CBr)C[C@@H]21	1787630139	WISQSODXZKKPND-BQUFFADESA-N	431.356	1.471	50	20	IDGD	
Cc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)CBr)C[C@@H]32)cn1C	1787672741	YWZRGWPEZFTYMH-CSFVBSKPSA-N	426.355	1.958	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc4ccccn34)[C@H]2C1	1787934288	XRJSKYFGIPFXFL-BQFCYCMXSA-N	430.581	1.779	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3n[nH]c4c3CCCC4)C[C@@H]21)[C@@H](F)Br	1789922634	JXARXEZVLQVAML-YLUJIRGKSA-N	443.317	1.572	50	20	IDGD	
COc1cccc2[nH]cc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)[C@H](O)CCl)C[C@@H]43)c12	1790423515	MTJSCLRBYWCTES-ZKNMIIFVSA-N	435.908	1.370	50	20	IDGD	
CCNC(=S)NCC(=O)Nc1ccc(C2(NC(=O)[C@@H](Cl)COC)CCC2)cc1	1791035145	OPGCIEYCSMBDCK-HNNXBMFYSA-N	426.970	1.858	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)COCc3ccccc3)C[C@@H]21	1791057572	GHFMVZZZLFNHTD-UBDQQSCGSA-N	439.350	1.966	50	20	IDGD	
CCOC(CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)Br)[C@H]2C1)OCC	1791065460	XYGGFMZRLICSAN-AJNGGQMLSA-N	435.359	1.539	50	20	IDGD	
CSCC[C@@H](O)C(=O)NC1(c2ccc(NC(=O)CCC(=O)NN(C)C)cc2)CCC1	1791602565	OFGNSOSPSUDVFJ-QGZVFWFLSA-N	436.578	1.608	50	20	IDGD	
C[C@H](Cn1ccnc1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21	1791628053	IOWYLCQDDVZHOB-CAEXGNQWSA-N	431.306	1.189	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CNC(=O)c1cccnc1	1794226753	HWTJDIVYEBYJND-FZKCQIBNSA-N	437.338	1.623	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnccc1N(C)C	1794472720	PTHHRUKVZOJBBR-IARIHHJXSA-N	439.354	1.524	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CNc2ccccc21	1796067446	MPKKGLGTZGKRFQ-NXEZDXNNSA-N	434.500	1.146	50	20	IDGD	
Cc1ccc2cc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3ccc(B(O)O)cc3)ccc2n1	1796189052	QIWABRUQSVYZIB-KOUNCHBCSA-N	443.312	1.789	50	20	IDGD	
N#Cc1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](O)CCl)C3)c(C(F)(F)F)n1	1796459265	IHYPIQZCOKTXHJ-GFQSEFKGSA-N	430.814	1.824	50	20	IDGD	
Cc1cc(NC(=O)CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](C)CBr)C3)no1	1796866112	HERUDRKPEBEQPX-RUZUBIRVSA-N	441.326	1.981	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCc1cccnc1)C2	1796892042	CKYVVXQUJZOROH-INZAXJFKSA-N	436.516	1.786	50	20	IDGD	
Cn1c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)cc2ccccc21	1797274952	LKWPXWRWPNEBEU-ACDBMABISA-N	431.301	1.424	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1n[nH]c2c1CCc1ncccc1-2)[C@@H](O)CCl	1799164989	HACVLZYWHAAMMQ-LKQDWFRTSA-N	429.908	1.422	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(-n2cccn2)cc1)c1ccc(B(O)O)cc1	1800485004	LYBCSHYRCLCTKF-QQFNCUIESA-N	444.300	1.118	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)Oc1cccnc1	1801405304	MQFJEILWEYQJHH-QKDZRIPBSA-N	426.311	1.222	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cc1cc(F)ccc1[N+](=O)[O-])C2	1802344235	RYJVFCSDUJAGFV-BJWYYQGGSA-N	449.483	1.288	50	20	IDGD	
CCOc1ncccc1C(=O)N1CCCC2(CCN(C(=O)CCC(=O)NN(C)C)CC2)C1	1804689927	GLWRARRPQPNEKO-UHFFFAOYSA-N	445.564	1.698	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2cccnc2C(N)=O)[C@H]1c1cccnc1	1804816636	QCRJIZIMMRUHQO-UWWQBHOKSA-N	445.907	1.149	50	20	IDGD	
Cc1occc1C(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1805619151	NVEQAEIIVZLTIM-DYESRHJHSA-N	427.505	1.676	50	20	IDGD	
Cc1cncc(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)c1	1805768198	ZQGVCIIDTXHFQB-DENIHFKCSA-N	444.300	1.098	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H](CNC(=O)CN2CCCC2=O)[C@H]1c1cccnc1	1806923725	DKFPOTYEKZAAJL-ZTNFWEORSA-N	441.359	1.946	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H](CNC(=O)CSC(=N)N)[C@H]1c1cccnc1	1806996865	DUCHSRKZUXJPPP-UXIGCNINSA-N	442.383	1.745	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)o1	1807364688	JUTRRLVELNZXAT-GHTZIAJQSA-N	433.273	1.296	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc(F)cc2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1	1807373442	BCDSSKIHGKTIST-UGKGYDQZSA-N	447.275	1.534	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC2(CCCN(C(=O)c3cnoc3C3CC3)C2)CC1	1808892317	WHNQXDGSDXHYBC-UHFFFAOYSA-N	431.537	1.770	50	20	IDGD	
Cc1nc(CC(=O)N2CCC3(CCCN(C(=O)c4cccc(B(O)O)c4)C3)CC2)cs1	1809974907	GYHPRULUMKLOHG-UHFFFAOYSA-N	441.362	1.219	50	20	IDGD	
O=C(Cc1cccc(F)c1)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1	1809976541	CAANORMMRBLPFO-UHFFFAOYSA-N	438.308	1.593	50	20	IDGD	
CC(=O)NCC(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)CBr)[C@H]1c1cccnc1	1812614639	OAPAPIIJHOWEFU-NUTKFTJISA-N	425.327	1.255	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)N1CC[C@H](CNC(=O)[C@@H](C)Br)[C@H]1c1cccnc1	1812865201	VGPAUANYTLSSAU-REBRKWNGSA-N	440.342	1.318	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)[C@@H]2C[C@H]3CC[C@@H]2O3)[C@@H]1c1cccnc1	1812894540	ZOKMEQWQGIZKSO-TZDBLYRBSA-N	443.548	1.028	50	20	IDGD	
COC(=O)CCCCCC(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1	1813137742	GGDXGTNFAQFQME-SQGPQFPESA-N	439.940	1.811	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)[C@@H]1CCc2nc[nH]c2C1	1813322586	JJUUUSOIBAVHON-ALQDCCJHSA-N	431.924	1.215	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc[nH]1)CC2	1817281736	OEWDXQBLZWCRKY-ZVYABZQBSA-N	439.501	1.831	50	20	IDGD	
Cc1onc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)c1C	1817469635	BJPZCJAKRHETIS-QGZVFWFLSA-N	437.265	1.314	50	20	IDGD	
CC(=O)C[C@@H](C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1	1817474835	HJPRWACBHXKDBN-FZKQIMNGSA-N	426.282	1.011	50	20	IDGD	
C[C@@H](C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1)n1cccc1	1817480042	ZSWSRWZAIYOXMJ-KXBFYZLASA-N	435.293	1.458	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1cnccc1F	1817732867	LQKVFMWBDWQMBT-GOSISDBHSA-N	437.240	1.243	50	20	IDGD	
CC[S@](=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](F)Br)CC2	1819517784	XCUDULBLUPDUKT-VZPAGZTGSA-N	440.360	1.904	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H]1CCCS1)CC2	1819801058	GEYHGKHYNRSEOP-YGRLFVJLSA-N	446.558	1.263	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](F)Br)n[nH]1	1820932743	OKNHGMBLPWFIPJ-IUPBHXKESA-N	432.294	1.959	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1)c1ccc(O)c([N+](=O)[O-])c1	1821042160	ISCMWBXOLMBWKQ-WFASDCNBSA-N	437.840	1.929	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCc2ccc(O)nn2)n[nH]1	1821640896	ZFCOGALIIWUCIR-UKRRQHHQSA-N	436.900	1.784	50	20	IDGD	
O=C(CCn1cncn1)N[C@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1	1823013537	CZBFDKLNUGSFJX-QPUJVOFHSA-N	431.291	1.427	50	20	IDGD	
Cc1cccc(C)c1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2	1823515285	ZMVADTWGYKAOJJ-QGZVFWFLSA-N	449.341	1.979	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CN2CC(=O)NC2=O)CC1	1824010867	HUGHFSVEQVIIQT-OAHLLOKOSA-N	426.945	1.423	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H]2CNC(=O)O2)CC1	1824089816	QSGYIDSZQNGPOA-CFVMTHIKSA-N	430.343	1.746	50	20	IDGD	
C[C@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1	1826089693	LTPHGWWTAACDMD-UWVGGRQHSA-N	446.371	1.212	50	20	IDGD	
C[C@@H](C(=O)N[C@@H]1CCc2nc(NC(=O)C(Cl)Cl)sc2C1)N1CCN(C)CC1	1826104313	KNZSFTUNDNMBRB-WDEREUQCSA-N	434.393	1.495	50	20	IDGD	
CCc1cc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)n[nH]1	1827053148	WPCBJDSFBMQGMS-OAQYLSRUSA-N	438.337	1.199	50	20	IDGD	
O=C(c1cncs1)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827056007	NLYSPFJVLFHRCW-SFHVURJKSA-N	427.335	1.370	50	20	IDGD	
CCOC(=O)N[C@H](O)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CO[Si](C)(C)C)CC1	1828760545	CPMYDQXQWGRGAW-FUHWJXTLSA-N	443.617	1.522	50	20	IDGD	
Cc1nc(F)ccc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830364176	ATLXXUZQLJUOLW-HXUWFJFHSA-N	427.904	1.864	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CC[C@@H](C)O3)C2)C1	1830540955	XCGNNIHJTDCXRM-ADAWSYLGSA-N	433.343	1.041	50	20	IDGD	
O=C(/C=C\c1c[nH]c2ccccc12)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1830725073	DHXUAECCUQGUEM-RFWKKBFOSA-N	447.919	1.237	50	20	IDGD	
C=CCOCCCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)Br)C2)C1	1831412799	DLCIEJAEQZKMQR-YJBOKZPZSA-N	433.343	1.209	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)C3=CCCS3)CCO2)C1	1831559402	YGRDLVLVEJRZTN-CXAGYDPISA-N	433.368	1.637	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc[nH]c4nccc3-4)C2)C1	1831646372	KTFGXZRFPUSGDN-UWJYYQICSA-N	434.924	1.992	50	20	IDGD	
Cc1cn(CC(=O)N2CCCC[C@H]2C2CCN(C(=O)[C@H](F)Cl)CC2)c(=O)nc1O	1832772931	HBLOVFUEFYMNBY-HOCLYGCPSA-N	428.892	1.411	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)Cc3ccc4c(c3)CCO4)CC2)CC1)[C@@H](O)CCl	1833311877	GFMWWPZSOVCRLV-FQEVSTJZSA-N	449.979	1.335	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)CN3CCCC3=O)CC2)CC1	1833532281	KDFHZMJXMBUQHA-GOSISDBHSA-N	426.989	1.588	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)nc1C	1833694979	FMBCOLWVUFENJY-AUUYWEPGSA-N	440.338	1.552	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CC3CCOCC3)CCO2)C1	1835424574	SAJKHOXNQNIJNE-KDOFPFPSSA-N	433.343	1.043	50	20	IDGD	
COc1ccnc(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](F)Cl)CC3)CC2)c1OC	1836208350	GRDWRIJHKSGZNX-GOSISDBHSA-N	442.919	1.818	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccnc(OC)c3F)CCO2)C1	1836237921	OJYKSFFNFDQBRE-LIRRHRJNSA-N	429.876	1.317	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)c1cccc(F)c1F	1836316271	AHTLLOFHPAEGSY-QGZVFWFLSA-N	429.895	1.750	50	20	IDGD	
O=C([C@@H](O)CCl)N1CCC(OC2CCN(C(=O)[C@H](O)Cc3ccccc3)CC2)CC1	1836719190	PERIFSFSJIAESQ-UXHICEINSA-N	438.952	1.188	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc4c(c3)CC(=O)N4)CCO2)C1	1836784149	HGIJNAZZUXTSPG-JTSKRJEESA-N	449.935	1.659	50	20	IDGD	
C[C@@H](Cc1ccco1)C(=O)N1CCOC[C@@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1837717695	MCSSHXGWHWMSCT-LAUBAEHRSA-N	438.597	1.766	50	20	IDGD	
Cc1n[nH]c(C)c1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1	1837807064	KOEYODVXRQXMBE-MSOLQXFVSA-N	433.336	1.333	50	20	IDGD	
CCc1nc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)co1	1838138776	IRCJUTBHJUMTFR-YVEFUNNKSA-N	430.299	1.090	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3nc(Cl)ccc3F)C2)C1	1839142410	NSBYPXRUHGIULR-KPZWWZAWSA-N	434.295	1.962	50	20	IDGD	
Cc1onc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)c1C	1839150342	JQZUFFXHEJQWCE-ROUUACIJSA-N	434.320	1.598	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(F)c3Cl)CCO2)C1	1839324606	PVKNJDXLISFPSO-LIRRHRJNSA-N	449.306	1.803	50	20	IDGD	
COc1cc(F)c(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)c(F)c1	1839333261	YGINKWBMLZGXHU-CRAIPNDOSA-N	436.814	1.578	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(OC)ccc3C)CCO2)C1	1839360357	CGJHXILXYOSTJV-GHTZIAJQSA-N	440.924	1.327	50	20	IDGD	
COc1c(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)ccc(F)c1F	1839381706	IIDSSWQVHBFVIF-QAPCUYQASA-N	436.814	1.578	50	20	IDGD	
CCOc1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)c1O	1839427834	WXKDSFDBMIYGAJ-IBGZPJMESA-N	447.315	1.665	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3sc(C)nc3C)C2)C1	1840150238	IDQZOGXNJJNHTN-RDTXWAMCSA-N	431.942	1.084	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccnc3SC)C2)C1	1840153949	GKWISSSOUTUDHH-BEFAXECRSA-N	443.953	1.127	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)/C=C/c3ccc(C)s3)CCO2)C1	1840397412	ZPILLCACWQDAMA-HOQHSMRBSA-N	442.965	1.780	50	20	IDGD	
Cc1cc(C)c(OCC(=O)N2CCCC23CN(C(=O)c2ccc(B(O)O)cc2)C3)c(C)c1	1841529684	CWYZMQFSLZTKOD-UHFFFAOYSA-N	436.317	1.188	50	20	IDGD	
C=C[C@@H](O)C(C)(C)C(=O)N1CC2(CCCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C1	1841924719	UVZMZXAUUKSRAC-LSDHHAIUSA-N	443.972	1.895	50	20	IDGD	
O=C(c1cc(=O)nc2sccn12)N1CC2(CCCN2C(=O)CCBr)C1	1842638715	MDXYKMPILCPMDU-UHFFFAOYSA-N	425.308	1.358	50	20	IDGD	
C=C[C@H](O)C(C)(C)C(=O)N1CCCC12CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2	1844237784	MSTSCXZMVHVIPT-SFHVURJKSA-N	445.472	1.910	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@@H](O)C(=O)N1CC2(CCCN2C(=O)[C@@](C)(Cl)CCl)C1	1845168913	HVWBYNWRWPOPER-PXAZEXFGSA-N	438.352	1.312	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CCO2)C1	1847151565	BOVBOSGXQMFKQJ-HUUCEWRRSA-N	429.945	1.843	50	20	IDGD	
C=CC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl	1847565371	MDYWREOPTNQMHK-XWSJACJDSA-N	449.935	1.659	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H]1CCCCN1C	1847578186	XJLCNXHNMHLGHZ-GBESFXJTSA-N	444.488	1.820	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H]1CC(=O)N(C2CCCC2)C1	1848045877	ZISSQANEECTVCQ-XRGAULLZSA-N	426.355	1.763	50	20	IDGD	
CC(C)CN1N=C(C(=O)N2CCc3sc(CNC(=O)CCl)nc3C2)CCC1=O	2088591815	KSACHJGLLSIABW-UHFFFAOYSA-N	425.942	1.517	50	20	IDGD	
CC(C)CC(=O)NNC(=O)c1cc(S(=O)(=O)N2CCOCC2)c(Cl)cc1Cl	10160466	QJTVYANNNMWJIP-UHFFFAOYSA-N	438.333	1.821	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(C(=O)OCC(=O)NNC(=O)c2cccs2)cc1	10602062	REABJLAFCWADST-UHFFFAOYSA-N	425.488	1.053	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1	15991527	LTGYLFVUMVVPQF-GOSISDBHSA-N	433.486	1.318	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(N2CCCC2=O)cc1)c1cncn1-c1ccccc1	21632704	APSKZRCCQAEHKV-UHFFFAOYSA-N	425.470	1.622	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)c1ccc(S(=O)(=O)NC(C)(C)C)cc1	24586067	CZHQDMAASFTGHO-UHFFFAOYSA-N	429.502	1.794	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CNC(=O)c2cccs2)c1NC(=O)c1ccncc1	725739245	ATMCXLJDUVBYRO-UHFFFAOYSA-N	437.481	1.895	50	20	IDGD	
O=C(CCc1nnc(-c2cc3ccccc3o2)o1)NNC(=O)c1ccc(-n2cnnn2)cc1	726157792	UOHYCPMWWFTUGO-UHFFFAOYSA-N	444.411	1.852	50	20	IDGD	
Cc1ccc(F)c(C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1	727063090	HBYWJIZOHYYLNW-UHFFFAOYSA-N	449.504	1.549	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2ccc(N3CCCC3)nc2)cc1	727098814	GQYCWQZYVAPPCT-UHFFFAOYSA-N	431.518	1.072	50	20	IDGD	
CSCC[C@@H](C(=O)NNc1nc(-c2cccnc2)no1)N1C(=O)c2ccccc2C1=O	728078511	IKVJOTZICYCXLV-HNNXBMFYSA-N	438.469	1.993	50	20	IDGD	
CS(=O)(=O)c1ccc(F)c(S(=O)(=O)NNC(=O)c2cccc(OC(F)F)c2)c1	728510404	JDZMXUYKOHQPGZ-UHFFFAOYSA-N	438.405	1.454	50	20	IDGD	
CCN1CCCC[C@@H]1C(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	729284054	QKRFIRXGTIZVHB-HXUWFJFHSA-N	444.557	1.801	50	20	IDGD	
CCCn1c(=O)nc(O)c2c(C(=O)NNC(=O)Cc3ccccc3F)cc(C3CC3)nc21	731329491	SSAGQNXKFSLVIR-UHFFFAOYSA-N	439.447	1.927	50	20	IDGD	
Cc1nc(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)nn1-c1ccccc1	731569431	BJJCUBHCSHHDDB-UHFFFAOYSA-N	433.516	1.549	50	20	IDGD	
O=C(NCCN/C(O)=C1\N=CC=CC1=O)NNC(=O)c1ccc(COc2ccccc2)o1	732466811	RCIUFXGTCZEZRH-CZIZESTLSA-N	439.428	1.329	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(I)c(C(=O)NNc2cnccn2)c1	734245443	CHKXHXNWCSFQDL-UHFFFAOYSA-N	447.258	1.088	50	20	IDGD	
CN(CC(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1)C(=O)c1cccs1	734824969	PCMKMZYFLNJHOU-UHFFFAOYSA-N	439.538	1.550	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)c2cccc(CS(C)(=O)=O)c2)cc1C	736764772	NNZQYGKOTPXUKB-UHFFFAOYSA-N	438.527	1.782	50	20	IDGD	
CCOC(=O)C1(CNC(=O)NNC(=O)COc2ccc(Br)cc2)CCC1	741091429	KOEFINLXLZEYJC-UHFFFAOYSA-N	428.283	1.892	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCc2nc(-c3ccccc3)n[nH]2)nc1	741416095	FMYUCTAKYJJYSW-UHFFFAOYSA-N	430.494	1.380	50	20	IDGD	
Cc1cccc([C@@H](C)CNC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)c1	741427193	XPSMKCIAHMEVAU-KRWDZBQOSA-N	446.577	1.756	50	20	IDGD	
Cc1cc(F)cc2c(=O)c(C(=O)NNC(=O)c3csc(N4CCOCC4)n3)c[nH]c12	741741586	ZPBFNGVKWXBAKP-UHFFFAOYSA-N	431.449	1.344	50	20	IDGD	
COCCn1c(SCC(=O)NNC(=O)c2cccc(C#N)c2)nnc1-c1ccncc1	741848589	RGJCCBFEBCEANH-UHFFFAOYSA-N	437.485	1.411	50	20	IDGD	
C[C@@H]1C[C@H](NC(=O)NNC(=O)c2c(Cl)cccc2Cl)C(=O)N1c1cnn(C)c1	743586053	TWZFCZLNMVMIDZ-RNCFNFMXSA-N	425.276	1.865	50	20	IDGD	
Cc1ccc(N2CC[C@H](NC(=O)NNC(=O)C3CCN(c4ncccn4)CC3)C2=O)cc1	743588556	CCRBSUAUVMZVEZ-SFHVURJKSA-N	437.504	1.137	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3OC(F)F)CC2)c1	744385699	MZSJLAGSBNBNSH-UHFFFAOYSA-N	446.454	1.815	50	20	IDGD	
COc1ccccc1NC(=O)C1CCN(CC(=O)NNC(=O)c2ccc(C#N)cc2)CC1	744387163	MCUHELBGHLYWNE-UHFFFAOYSA-N	435.484	1.679	50	20	IDGD	
CCOC(=O)N1CCN(C(=O)[C@H](C)OC(=O)/C(C#N)=C\c2cc(C#N)n(C)c2C)CC1	744631389	DOLWOFOWPSVXCM-HAKPAVFJSA-N	427.461	1.345	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2ccccc2-c2nc(C)no2)cc1OC	745258771	NOGBXBNKZPGODT-UHFFFAOYSA-N	440.412	1.680	50	20	IDGD	
Cc1ccc([C@H](CN2CCOCC2)NC(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)cc1	745359162	XJLBJLDSRMBQNA-SFHVURJKSA-N	443.460	1.626	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)N[C@H]2CCCN(c3ccn(C)n3)C2=O)cc1	745884497	YJUXGZFCUYHVHU-PBHICJAKSA-N	444.492	1.112	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)CCn2c(S)nc3ccccc3c2=O)o1	746392942	SOPMOHRKWPRSOB-UHFFFAOYSA-N	443.529	1.971	50	20	IDGD	
O=C(NCCNS(=O)(=O)c1cccs1)NNC(=O)C12CC3CC(CC(C3)C1)C2	747438412	UFNPRDYQKZMVLS-UHFFFAOYSA-N	426.564	1.573	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1)N[C@H]1CCCCNC1=O	747864918	BDDYTXACGFUGHU-SFTDATJTSA-N	435.528	1.613	50	20	IDGD	
CC(C)OCCS(=O)(=O)NCC(=O)NNC(=O)c1ccc(-c2ccc(F)cc2)s1	747906006	KLIZMUIQROWXJW-UHFFFAOYSA-N	443.522	1.660	50	20	IDGD	
COc1cc(-c2noc(CCC(=O)NNc3nccn(C)c3=O)n2)cc(Cl)c1OC	747941709	DFTXGIOLCJVUDD-UHFFFAOYSA-N	434.840	1.577	50	20	IDGD	
CCCc1nc(C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)nn1-c1ccccc1Cl	748614554	VDGNEHAPGQZHAY-LLVKDONJSA-N	425.898	1.069	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)NCc1ccccc1CN1CCC(O)CC1	749590045	KJIIYEOWQDWRAU-UHFFFAOYSA-N	436.516	1.364	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNS(=O)(=O)c2cn(CC(C)C)cn2)c1	749865910	XHLXVSGJIYGUMO-UHFFFAOYSA-N	431.312	1.934	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1	751211919	MTPLUCPOMMXSNP-UHFFFAOYSA-N	431.455	1.971	50	20	IDGD	
COC(=O)[C@H](C)NC(=O)/C(C#N)=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	751315391	HCLZEYNOYAYJQZ-CJAAZZPWSA-N	429.864	1.664	50	20	IDGD	
CN1CCN(C(=O)CN2CCC(N(C)C(=O)/C(C#N)=C\c3ccc(F)cc3)CC2)CC1	752057281	LJXKFDKMNWPPNQ-CYVLTUHYSA-N	427.524	1.429	50	20	IDGD	
CCn1cc([C@H]2C[S@](=O)CCN2C(=O)NNC(=O)Cn2ccc3ccccc32)cn1	753125837	OLQLOCMPAWWBNB-VPTFNQTCSA-N	428.518	1.404	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)[C@@](C)(O)c1cccc(C(F)(F)F)c1	754847778	XHLUTDQQNCASPJ-KRWDZBQOSA-N	434.415	1.768	50	20	IDGD	
CCCC[C@H](NC(=O)[C@H](C)NC(=O)C(C)(C)C)C(=O)NNC(=O)NC1CCCCC1	755036548	VKTCSTIQILAYTO-HOCLYGCPSA-N	425.574	1.875	50	20	IDGD	
CN1CC(=O)N(c2cccc(NC(=O)NNC(=O)COc3ccccc3[N+](=O)[O-])c2)C1=O	755990452	FEDKDPSMZYSEQN-UHFFFAOYSA-N	442.388	1.225	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2ccc3c(c2)OC(C)(C)O3)cc1	756222069	LQHUOGJRDUMMIC-UHFFFAOYSA-N	448.501	1.976	50	20	IDGD	
COC(=O)c1n[nH]c2ccc(NC(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)cc12	756574784	QQQWXRPZHKSLHQ-UHFFFAOYSA-N	434.453	1.807	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)Nc1ccc2[nH]nc(C(=O)OC)c2c1	756576281	ZHHKWIGJBPXKOV-UHFFFAOYSA-N	427.417	1.980	50	20	IDGD	
COc1ccccc1N1CC[C@@H](NC(=O)NNC(=O)c2nnc(O)c3ccccc23)C1=O	757289508	BGPABFRYHKPHRS-CQSZACIVSA-N	436.428	1.094	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)Nc1ccc2c(c1)S(=O)(=O)CC2	757710303	XGXBOEUXXRZKOQ-UHFFFAOYSA-N	426.495	1.474	50	20	IDGD	
COCCc1cc(NC(=O)NNC(=O)c2cc(-c3ccc(OC)c(OC)c3)[nH]n2)n(C)n1	757726363	VOMQJSIDPHKAHL-UHFFFAOYSA-N	443.464	1.483	50	20	IDGD	
Cc1ccc(NC(=O)OC(C)(C)C)cc1NC(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1	757770871	QKZKQIAHCFFMNI-GFCCVEGCSA-N	426.495	1.929	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc2c(c1)COC2)NNc1nc(-c2ccc(Cl)cc2)no1	759791615	ZFNVUGQCYXLOPS-UHFFFAOYSA-N	449.876	1.842	50	20	IDGD	
CC(=O)N[C@@H](CC(=O)NNC(=O)CCNC(=O)OC(C)(C)C)c1ccc(F)cc1F	760437200	DDAYMWXSXNHUJO-HNNXBMFYSA-N	428.436	1.594	50	20	IDGD	
CCCS(=O)(=O)N1CCCC[C@H]1C(=O)NNC(=O)CSc1ccccc1OC	762372664	CJDSOOQRDREPIT-AWEZNQCLSA-N	429.564	1.529	50	20	IDGD	
C[C@H](CC(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	763184674	ACKITCJVIAKGGP-KFWWJZLASA-N	431.555	1.242	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2ccccn2)cccc1-c1nnc2n1CCCCC2	763468471	ZKSVDTNKUWMDSG-UHFFFAOYSA-N	433.472	1.775	50	20	IDGD	
O=C1CCc2ccc(NC(=O)C(=O)NNC(=O)c3ccccc3Br)cc2N1	763482114	CRPQMQGEHHGQRL-UHFFFAOYSA-N	431.246	1.734	50	20	IDGD	
Cc1ccnc(Oc2ccc(NC(=O)C(=O)NNC(=O)[C@@H]3COc4ccccc4O3)cc2)n1	763569990	CUDGKHPSKDECOM-SFHVURJKSA-N	449.423	1.503	50	20	IDGD	
CCN(CC)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1	763572685	NSFGBZLTUFKOKB-SFHVURJKSA-N	440.456	1.095	50	20	IDGD	
CC[C@@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2c(C)nc3ccccn23)cc1	763628363	IXCWQQMEIMJOSC-CYBMUJFWSA-N	436.472	1.571	50	20	IDGD	
O=C(COc1cccc(C(F)(F)F)c1)NNC(=O)C(=O)Nc1ccccc1-n1cncn1	763639650	QADDGXYNRGZRRS-UHFFFAOYSA-N	448.361	1.451	50	20	IDGD	
CS(=O)(=O)Cc1ccccc1NC(=O)C(=O)NNC(=O)COc1ccc(Cl)cc1	763686041	JIUUCNPOKOCMCW-UHFFFAOYSA-N	439.877	1.050	50	20	IDGD	
CCS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)cc1	763727600	JLCSSLUZMJVDRL-UHFFFAOYSA-N	433.530	1.783	50	20	IDGD	
Cn1c(=O)oc2cc(NC(=O)C(=O)NNC(=O)CSc3ccc(Cl)cc3)ccc21	763732110	ADLUHVQOYSSEPJ-UHFFFAOYSA-N	434.861	1.663	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(OC(F)F)c(Cl)c1	763809215	SPEOQKRCWCFTEZ-UHFFFAOYSA-N	438.774	1.978	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(F)c(N2CCCC2)c(F)c1	763814151	QMJCFSVCPWILHW-UHFFFAOYSA-N	443.410	1.602	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccnn1-c1cccc(Cl)c1	763839861	NBXDMLIDKDBAEZ-UHFFFAOYSA-N	431.811	1.830	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cccnc2-n2cccn2)cc1	763867193	SQVDFZOZNZVJJP-AWEZNQCLSA-N	438.444	1.219	50	20	IDGD	
CN1CCc2ccc(NC(=O)C(=O)NNC(=O)CCSc3ccc(F)cc3)cc2C1=O	763895222	MRUVCUOYQAFMMJ-UHFFFAOYSA-N	444.488	1.722	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccccc2Cn2cncn2)cc1OC	763900307	CXGMMYCNXWBDIT-UHFFFAOYSA-N	438.444	1.133	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccc(NC(=O)[C@@H]2CCCO2)cc1	763921607	UAEWULVRNMIFMX-KRWDZBQOSA-N	428.420	1.272	50	20	IDGD	
Cc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccccc2)on1	764016652	LBYZGERSEQGODS-UHFFFAOYSA-N	435.440	1.752	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cc(Br)ccc2N2CCCC2)n[nH]1	764097380	CGDSODFZQMWSDW-UHFFFAOYSA-N	435.282	1.481	50	20	IDGD	
CCNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(C)cc3)[nH]n2)c1	764109750	BEYICAUFJOYHHY-UHFFFAOYSA-N	434.456	1.535	50	20	IDGD	
Cc1c(CS(C)(=O)=O)cccc1NC(=O)C(=O)NNC(=O)c1ccc(Cl)cc1O	764116829	HZYULBOUDVELGY-UHFFFAOYSA-N	439.877	1.298	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)ccc1N1CCCC1=O	764126405	JXZVPPDFNTZBFZ-UHFFFAOYSA-N	446.847	1.581	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1O)C(=O)Nc1cc(F)cc(N2CCOCC2)c1	764126622	NKQFZYZWRAYSAI-UHFFFAOYSA-N	436.827	1.421	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2cc(C)nn2-c2cccc(Cl)c2)c1O	764132906	SRDKNIWBTLEYKE-UHFFFAOYSA-N	443.847	1.948	50	20	IDGD	
Cc1cccc(C(=O)N2CCCC2)c1NC(=O)C(=O)NNC(=O)[C@@H]1Cc2ccccc2O1	764154985	VOJMPENDKPBQMV-SFHVURJKSA-N	436.468	1.321	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C)c(C)c(NC(=O)C(=O)NNC(=O)c2ccoc2)c1	764164708	YTPYMOPYRUVPQF-UHFFFAOYSA-N	436.490	1.327	50	20	IDGD	
CC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)CCc2ccco2)c(C(F)(F)F)c1	764171147	FHFLIMUPZDGFJU-UHFFFAOYSA-N	426.351	1.976	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)C(=O)Nc1ccc(-c2nnc3n2CCCCCC3)cc1	764355702	GVXXEEMMJSYDCG-UHFFFAOYSA-N	447.499	1.785	50	20	IDGD	
CCCCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2ncccc2C)cc1	764386216	UDGRAWGMMYWJOK-UHFFFAOYSA-N	433.490	1.332	50	20	IDGD	
COC(=O)c1ccc(C)c(NC(=O)C(=O)NNC(=O)CSc2ccccc2OC)c1	764394560	REIXDYPWMMXWKP-UHFFFAOYSA-N	431.470	1.668	50	20	IDGD	
O=C(NNC(=O)[C@H]1COCCO1)C(=O)Nc1cc(C2CCCC2)nn1-c1ccccc1	764433953	PBSOWUUSEOPWCB-QGZVFWFLSA-N	427.461	1.031	50	20	IDGD	
C[C@H](NC(=S)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1)c1ccccc1	764514213	LDFKRYJOSDHKQP-KRWDZBQOSA-N	425.558	1.701	50	20	IDGD	
Cc1ccc(Cl)c2c1NC(=O)C2=NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	764828729	TWZWICMOTRTAPT-UHFFFAOYSA-N	439.903	1.879	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)c3ccc(F)c(S(N)(=O)=O)c3)n[nH]2)c1	765581464	PDTFVZVTZJUXIG-UHFFFAOYSA-N	431.449	1.555	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)CN3C(=O)CCc4ccccc43)CC2)cc1	765753936	FPKQBDKWIIBUFQ-UHFFFAOYSA-N	449.555	1.239	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)[C@H](c2ccccc2)C2CC2)CC1	766190517	DXMGSJIJLVTAFK-LJQANCHMSA-N	429.546	1.655	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)N[C@@H]1CC(=O)N(c2ccc(Cl)c(F)c2)C1	766864449	RGQLGEKODONMRA-CYBMUJFWSA-N	445.838	1.865	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)CNC(=O)CNC(=O)OC(C)(C)C)n[nH]2)cc1	767120663	VUTBPYFSGULLJD-UHFFFAOYSA-N	444.492	1.041	50	20	IDGD	
CN(C)CCS(=O)(=O)c1ccccc1C(=O)NNC(=O)c1cccc2ncccc12	767430501	NAVJFAICDKMYNJ-UHFFFAOYSA-N	426.498	1.645	50	20	IDGD	
COc1cc(Cl)ccc1S(=O)(=O)N1CCN(S(=O)(=O)CBr)CC1	767848513	AHHHCRVWGXVZEZ-UHFFFAOYSA-N	447.760	1.337	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)CN2C(=O)N[C@]3(CCCC(C)(C)C3)C2=O)cc1	768568404	FPHQEJOMBVHMEV-NRFANRHFSA-N	430.509	1.796	50	20	IDGD	
CCCn1c(C)cc(/C=C(/C#N)C(=O)N2CCN(S(=O)(=O)c3nc[nH]n3)CC2)c1C	768728090	BHRTYLJZVFDMJN-BOPFTXTBSA-N	431.522	1.073	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)C[C@H]2C=CS(=O)(=O)C2)c2ccccc2c1=O	769321942	IOQFPZZYKRRRHE-CQSZACIVSA-N	432.502	1.296	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)NCC3(N4CCOC(C)(C)C4)CCCCC3)nc21	770397251	WKRKJHOWEFKFLL-UHFFFAOYSA-N	432.529	1.509	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)[C@@H]3CC(=O)N(c4cccc(Br)c4)C3)nc21	770968722	LUXMUMMPAXELFR-SECBINFHSA-N	446.265	1.328	50	20	IDGD	
Cc1oc(-n2cccc2)c(C#N)c1C(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772883574	DEHXCWSBUJHYDL-UHFFFAOYSA-N	425.832	1.981	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)[C@H](c1cccc(F)c1)N1CCOCC1	772892031	PYGJDISIXWPACC-SFHVURJKSA-N	448.882	1.316	50	20	IDGD	
Cc1noc(-c2ccccc2)c1NC(=O)C(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	773500985	ZKVXSYIWVURHIC-UHFFFAOYSA-N	446.423	1.941	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)NC(=O)CC2	774009581	RGGUNZBDEVKRJZ-NSHDSACASA-N	430.848	1.778	50	20	IDGD	
COc1cccc([C@H]2[C@@H](C(=O)NNC(=O)Cn3nc(C)cc3C)CC(=O)N2C2CC2)c1	776448349	SBAAUZNVEQKHMF-RXVVDRJESA-N	425.489	1.408	50	20	IDGD	
CN(NC(=O)c1cc(S(=O)(=O)NCCOc2ccccc2)ccc1Cl)C(N)=O	778418850	SRNJTVSPBWNNGL-UHFFFAOYSA-N	426.882	1.353	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)NNC(=O)Cc2cccnc2)cc1Br	780388087	VQQWGXIDVCYVEC-UHFFFAOYSA-N	427.280	1.355	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NNc2cccc(OC)n2)o1	780768751	DKXGSWZCKIELPD-LBPRGKRZSA-N	438.462	1.156	50	20	IDGD	
COc1cc([N+](=O)[O-])ccc1NC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	782073526	DYYLCPQYOVFEEB-UHFFFAOYSA-N	442.476	1.968	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccccc1-c1ccno1)C1CCN(c2ncccn2)CC1	782257898	NZWIVTOALSAGJE-UHFFFAOYSA-N	428.474	1.358	50	20	IDGD	
Cc1cc(Br)ccc1NC(=O)C(=O)NNC(=O)Cc1nc2ccccc2n1C	782884643	HEAFSHZEIVDINL-UHFFFAOYSA-N	444.289	1.973	50	20	IDGD	
COc1c(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2Cl)cccc1C(N)=O	782927245	NGSXXSZHGFLSNC-UHFFFAOYSA-N	425.228	1.501	50	20	IDGD	
O=C(NNC(=O)[C@H](O)C1CCCCC1)c1cccc(S(=O)(=O)NCc2ccccc2)c1	783506231	FNRAZQZWYISEIY-HXUWFJFHSA-N	445.541	1.867	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1cccc(Oc2ccccn2)c1	784004317	WCNTXUSMVOKHEM-UHFFFAOYSA-N	439.453	1.451	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)C(=O)N1CCCc2ccc(F)cc21	784210142	FBCXTWFQSQGVIZ-UHFFFAOYSA-N	432.477	1.689	50	20	IDGD	
Cc1nc(Cn2nnc(C(=O)NNC(=S)Nc3ccc(OC(C)C)cc3)c2C)no1	784990253	RWKQJOBXGWMHRP-UHFFFAOYSA-N	430.494	1.745	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)n(Cc2ccccc2)n1	785022963	DPPRXYLKGNWSPJ-UHFFFAOYSA-N	438.400	1.253	50	20	IDGD	
COc1cccc(Cn2ccc3ccc(NC(=O)C(=O)NNc4nccn(C)c4=O)cc32)c1	785089526	APVZPROJCLYGIR-UHFFFAOYSA-N	446.467	1.874	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)[C@H]1[C@H](C(F)(F)F)[C@H]2CC[C@H]1O2	785597101	GIRWAIJTYADEMW-RRCSTGOVSA-N	449.451	1.507	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(Cl)c(F)c1Cl)c1ccc(-n2cnnn2)cc1	788744609	UZZBOXVLETZODY-UHFFFAOYSA-N	431.236	1.732	50	20	IDGD	
CC1(c2cc(NC(=O)C(=O)NNC(=O)c3nn(-c4ccccc4)cc3O)no2)CCCC1	789731807	LLYVHRZGOKXVEF-UHFFFAOYSA-N	438.444	1.797	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2n[nH]c(CC)c2Br)c2ccccc2c1=O	789869692	WAHAGGWEPJXKCX-UHFFFAOYSA-N	447.293	1.929	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccc2c1OCC[C@H]2OC	790950976	AKUOPFJMQBYTAV-GOSISDBHSA-N	427.457	1.884	50	20	IDGD	
O=C(NNc1ccc(Cl)c(F)c1)C(=O)Nc1cc(S(=O)(=O)N2CCCC2)ccn1	797103585	KSWXXUUSIGCQCQ-UHFFFAOYSA-N	441.872	1.740	50	20	IDGD	
CO[C@H](C(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1)c1cnn(C)c1	798842678	FBSKAOUDXOOCQI-INIZCTEOSA-N	449.514	1.431	50	20	IDGD	
CO[C@@H](C(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1)c1cnn(C)c1	798940450	IIIPFLWNLPUKTB-FGZHOGPDSA-N	433.512	1.882	50	20	IDGD	
COC(=O)c1cccc(NC(=O)C(=O)NNc2ccc(-n3cccn3)nn2)c1OC(C)C	799260902	DQGJFWNWBLHSOL-UHFFFAOYSA-N	439.432	1.318	50	20	IDGD	
COc1cccc(C=NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1F	799867750	NQFRXLXELXDBGB-UHFFFAOYSA-N	449.504	1.938	50	20	IDGD	
O=C(COC(=O)c1cnn(CCO)c1-c1ccccc1)NNC(=O)c1ccc(Cl)cc1	801317902	AWZIOZDZLYUJSF-UHFFFAOYSA-N	442.859	1.814	50	20	IDGD	
O=C(NC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1)NNC(=O)c1nnc(O)c2ccccc12	802332160	VABPJRMPSLPQTG-CQSZACIVSA-N	448.439	1.408	50	20	IDGD	
C[C@@H](CCNS(=O)(=O)c1ccccc1)NC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	802526831	LFKQUQFOJVVDRJ-ZDUSSCGKSA-N	435.462	1.296	50	20	IDGD	
O=C(NCCCN1CCN(Cc2ccccc2)CC1)NNc1ccc(-n2ccnc2)nn1	804952395	OAUUFJCYEINBQU-UHFFFAOYSA-N	435.536	1.496	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)[C@]1(C(F)(F)F)CCN(C(=O)OC(C)(C)C)C1	805649204	NRXBJAXNSXBYBM-QFYYESIMSA-N	425.404	1.665	50	20	IDGD	
CC1(C)CC(=O)c2cc(NC(=O)C(=O)NNc3ccc(S(C)(=O)=O)cc3)ccc2O1	806995426	UHNAYUOOZQPPTM-UHFFFAOYSA-N	431.470	1.916	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2cc(F)c(Br)c(Cl)c2)CCS(=O)(=O)C1	807001433	ZZNQAGYIRUHHHI-CYBMUJFWSA-N	442.694	1.378	50	20	IDGD	
Cc1nc2ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc3c(C)cc(Cl)cc3C)cn2n1	810385964	HBOYVGGMXRWCGG-GFCCVEGCSA-N	444.879	1.861	50	20	IDGD	
CO[C@@H](CNC(=O)OC(C)(C)C)CC(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	812725222	AQVXRBAYZCKOFL-CQSZACIVSA-N	430.527	1.310	50	20	IDGD	
CCCCS(=O)(=O)N1CCC(C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)CC1	812727959	FHVDBIKYANLFIX-UHFFFAOYSA-N	446.595	1.222	50	20	IDGD	
Cc1ccc(C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)cc1NS(C)(=O)=O	812729520	OCDPOJWWDZCTHQ-UHFFFAOYSA-N	426.520	1.374	50	20	IDGD	
COC(=O)c1cn(-c2cccc(NC(=O)C(=O)NNc3cc(F)c(F)c(F)c3)c2)nn1	812988516	ZOFYBZSCBITLNP-UHFFFAOYSA-N	434.334	1.553	50	20	IDGD	
CN(C)c1c(Cl)cccc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	813033544	YORAPUJUZTUHQP-UHFFFAOYSA-N	439.925	1.738	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)[C@H]3CC4CCC3CC4)CC2)cc1	814316861	JIKJYXVBJYUPIG-QLOJAFMTSA-N	448.589	1.275	50	20	IDGD	
CC(=NNC(=O)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1)c1ccc2[nH]c(=O)c(=O)[nH]c2c1	814972246	AAZGERBDSRQKLH-CQSZACIVSA-N	429.477	1.704	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)CN2C(=O)[C@H]3CCCC[C@@H]3C2=O)c1	818767513	LTLOFVZKBKSDQD-RYUDHWBXSA-N	438.278	1.854	50	20	IDGD	
Cc1ccc(/C=C(/C#N)C(=O)OCC(=O)N2CCN(CC(=O)NC(C)(C)C)CC2)cc1	912613462	PJMYPCOUYVOCDT-UYRXBGFRSA-N	426.517	1.504	50	20	IDGD	
Cc1nn(-c2ccccc2)c2sc(C(=O)NNC(=O)Cn3nc4ccccn4c3=O)cc12	914084134	UPYJGMCPRXZBTF-UHFFFAOYSA-N	447.480	1.666	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)c2ccc(OCc3ccncc3)cc2)c2ccccc2c1=O	914280723	ZOTTUGLEMVZCMK-UHFFFAOYSA-N	429.436	1.982	50	20	IDGD	
C[C@H](Oc1cccc(F)c1)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	914457202	SYTBFSBZEIHLLJ-AWEZNQCLSA-N	435.477	1.839	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@H]2C(=O)NNC(=O)COc2ccccc2F)c(OC)c1	915059708	NEMVACMIFIHAIX-KRWDZBQOSA-N	445.447	1.674	50	20	IDGD	
O=C(NNC(=O)[C@H]1CC(=O)N(C2CCCC2)C1)c1cccc(S(=O)(=O)N2CCCC2)c1	916556385	YDGYGEROQMYHBV-INIZCTEOSA-N	448.545	1.023	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)c2ccc3c(c2)S(=O)(=O)N(C2CC2)C3=O)cc1	916743698	NLTGLQUBHRGPAL-UHFFFAOYSA-N	429.454	1.142	50	20	IDGD	
Cc1nnc([C@H]2Cc3ccccc3CN2CC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)o1	917194835	RLTLYXKXPQHOAK-GOSISDBHSA-N	436.428	1.847	50	20	IDGD	
CC(C)c1nn(C)cc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	917902145	PIAXGIHAHHEOCM-UHFFFAOYSA-N	433.534	1.793	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)c2ccc(F)c(S(=O)(=O)N(C)C)c2)cc1OC	918686748	IBMBVCKBIWMZII-UHFFFAOYSA-N	439.465	1.558	50	20	IDGD	
Cc1nn(C(F)F)c(C)c1CC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	920884300	GOIDOARKKWVXQH-UHFFFAOYSA-N	429.449	1.149	50	20	IDGD	
C[C@H]1CN(Cc2csc(NC(=O)NNC(=O)[C@@H]3COc4ccccc4O3)n2)C[C@@H](C)O1	920932981	ZAAFIGKTQCULLN-AHIWAGSCSA-N	447.517	1.745	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)COc1ccc([N+](=O)[O-])c(OC)c1	921021375	GXPZUAVVGXETMU-UHFFFAOYSA-N	427.417	1.742	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)N[C@@H]2CC(=O)N(c3ccccc3)C2)cc1	921125705	VGVHHMFBMGWHBL-JKSUJKDBSA-N	426.473	1.989	50	20	IDGD	
CN(CC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)Cc1ccccc1	1318091523	KTPRMQQNIWMOGY-UHFFFAOYSA-N	444.557	1.754	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)N[C@H]1CCO[C@@]2(CCSC2)C1	1319345118	TUSSNDDZPXLYDV-UGSOOPFHSA-N	441.579	1.287	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CSCC(=O)O)C2	1779545867	LQEREBYJMUPTHY-RDTXWAMCSA-N	432.615	1.170	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc([N+](=O)[O-])c4c3OCO4)C2)C1	1780237501	PJEIHZHFSDQDPM-YJYMSZOUSA-N	439.852	1.784	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C=C\C(=O)NC1CC1)C2	1780712546	RAPNPZADDAYKLV-CTFNTZBASA-N	446.375	1.571	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc4c(c3)n(C)c(=O)n4C)CCO2)C1	1781219798	VCAJBKBKHZPOEW-VFNWGFHPSA-N	434.924	1.338	50	20	IDGD	
COCCn1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)n1	1781229579	JAFMUXBXXSJRGH-ROUUACIJSA-N	433.336	1.209	50	20	IDGD	
Cc1ccc(OCC(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)cc1	1781328785	ZJXNVHNMEKCRTD-SJLPKXTDSA-N	429.286	1.894	50	20	IDGD	
O=C(C1CCC2(CC1)OCCO2)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781332657	CRNDPEHRMSKFMM-WMLDXEAASA-N	449.317	1.440	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)C2)C1	1781938245	FFFVBXOETNVRAO-ROUUACIJSA-N	446.287	1.980	50	20	IDGD	
O=C(c1ncc[nH]1)N1CCO[C@]2(CCN(C(=O)[C@H](Br)Cc3ccccc3)C2)C1	1783018611	NRXMWSFNFRCNBM-UZLBHIALSA-N	447.333	1.859	50	20	IDGD	
CN(C)CC(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](Br)Cc3ccccc3)C2)C1	1783024052	SZDRGFIOBYNVQW-FXAWDEMLSA-N	438.366	1.384	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H]1CCN1C(=O)OC(C)(C)C)CCO2	1783871953	XAMSFKFQBAAPHL-MDOVXXIYSA-N	445.944	1.080	50	20	IDGD	
Cc1nn(C)cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]2C1	1783968653	FBXBCDXJCSMFPY-MZGVZZPPSA-N	427.343	1.353	50	20	IDGD	
CCS(=O)(=O)N[C@@H](C)C(=O)Nc1ccc(C2(NC(=O)[C@@H](O)CCl)CCC2)cc1	1786335360	BFDDJGQLUGVIBG-WFASDCNBSA-N	431.942	1.048	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(C(F)(F)F)ccn3)[C@H]2C1	1788967104	YOJYQWTXBWHKML-ZIEJDFEHSA-N	449.857	1.948	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ncccc3F)[C@H]2C1	1789056924	BLAXEOFIOYNFGK-XPCVCDNBSA-N	428.302	1.988	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]3C2)cc(O)n1	1789866595	UIPGPERLSVSSPG-VFSPDHHESA-N	430.332	1.925	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)ccc3O)C[C@@H]21	1791060503	FZTYQJNMNLXPEW-KHJVZFFJSA-N	427.295	1.475	50	20	IDGD	
CO[C@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C[C@@H]21	1791317324	LFXGVJRDHCBBOV-DTPILHQWSA-N	449.460	1.148	50	20	IDGD	
CC(C)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(OCCCO)cc1)C2	1792784056	LYGXCYRKGZQKOM-IZZQQSIFSA-N	438.952	1.916	50	20	IDGD	
O=C(Cc1n[nH]c2cc(Cl)ccc12)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCl	1793115712	TZKIVXJTKCTUGX-LKQDWFRTSA-N	425.316	1.997	50	20	IDGD	
COc1cccc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)Br)C3)n1	1794015675	FQGRCADOTAEFDK-FLTUCWPJSA-N	440.338	1.396	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2)c1ncn(-c2cccc(F)c2)n1	1794286030	DIYSZMTWDBRULQ-BAESOJJISA-N	425.823	1.144	50	20	IDGD	
CN(C)c1cncc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCBr)c1	1795111430	MRISNSKNPJBQHU-XOIINTDNSA-N	425.327	1.136	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CNc1ccc(F)cc1	1795543510	CBADJFHNRLPSGS-KOFHJDLBSA-N	428.302	1.611	50	20	IDGD	
N[C@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2)c1cccc(Cl)c1	1795624981	IIUCVTBGRIHPTF-RMHZUWNSSA-N	444.757	1.714	50	20	IDGD	
O=C(Cc1noc2ccccc12)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1	1796187088	MFKYPQNTUJODJN-BCDXTJNWSA-N	433.273	1.002	50	20	IDGD	
CC(C)(Cc1ccccc1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1	1796189732	SRAKNCRMFPFTEA-KOUNCHBCSA-N	434.345	1.887	50	20	IDGD	
CC(C)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C=C1\C(=O)Nc2ccccc21	1797658116	YUAOZVZVWRJMGZ-LRKVGGNXSA-N	431.920	1.877	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1coc([Si](C)(C)C)c1	1797727141	CDIUGSSNEOWNDC-ZIEJDFEHSA-N	443.414	1.811	50	20	IDGD	
Cc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Br)C3)nn1C(F)F	1798676757	LSYCLKXQGKOZCZ-RBLKWDMZSA-N	439.232	1.480	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1cn2c(F)cccc2n1	1799999582	MKKHNQWJONJVAZ-OWLDWWDNSA-N	443.248	1.367	50	20	IDGD	
C[C@@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2)[S@](=O)c1ccccc1	1800217477	WCJMOFXZSPPKGI-MNGJIDMDSA-N	433.357	1.576	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)c1ccccc1)C2	1800640189	YEKWMFVYMUHINK-ZHCJQAHYSA-N	425.323	1.483	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(-c3cnccn3)c1)C2	1800979046	QCKJAHSYNARREW-AJYBTWMASA-N	444.919	1.601	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)[S@@](=O)c1ccccc1)C2	1800979516	NUEDGSAGGBZMDM-KLKWWNPASA-N	442.965	1.026	50	20	IDGD	
C=CC[C@H](CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2)NC(=O)OC(C)(C)C	1801931071	ATPMUNFPZFRNNK-AEKWLRTRSA-N	447.935	1.970	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(OC)c(OC)c1O)C2	1802280214	LJIJEOXRPFIUNJ-QVHKTLOISA-N	426.897	1.915	50	20	IDGD	
C[C@H](C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1)C1(O)CCC1	1802469728	VHOTWNUXSFXNEW-PLMTUMEDSA-N	445.564	1.012	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)[C@H]2CCC(=O)NC2)[C@@H]1c1cccnc1	1802613323	QZKUUBHGGDXPJK-GUSZCTEKSA-N	437.338	1.397	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]1c1cccnc1	1803148470	QGZPMCOEJZANSP-DMRZNYOFSA-N	427.885	1.249	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(F)cc(Cl)c1)c1ccc(B(O)O)cc1	1803666427	IUMCUVPUQCGKJW-REPLKXPHSA-N	430.672	1.725	50	20	IDGD	
COc1cccc(CCC(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)n1	1804430128	NFSJCAFTSJOCEP-YRISNDGFSA-N	446.935	1.724	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC2(CCCN(C(=O)C(C)(C)C#N)C2)CC1	1805044494	LYRKPPZQWNMNQK-PCLIKHOPSA-N	426.521	1.901	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)[C@H](N)c2ccccn2)[C@@H]1c1cccnc1	1807166990	HNHQHEOEPQXLIR-NZPGVSJUSA-N	446.349	1.966	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2cc3n(n2)CCC3)[C@@H]1c1cccnc1	1809985047	QTBURTWWKXIGRO-IEZWGBDMSA-N	431.924	1.798	50	20	IDGD	
CNC(=S)NCCC(=O)NC[C@@H]1CCN(C(=O)C(Cl)Cl)[C@@H]1c1cccnc1	1810309652	CDWFKLWPRFTOAY-GXTWGEPZSA-N	432.377	1.375	50	20	IDGD	
CN1C(=O)CC[C@H]1C(=O)N1CC[C@@H](CNC(=O)CO[Si](C)(C)C)[C@@H]1c1cccnc1	1810545255	WSTUZQJPANAIIR-ZWOKBUDYSA-N	432.597	1.560	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)CCn2ccnn2)[C@@H]1c1cccnc1	1812779359	SWQNXWHTSKTSJW-XYJFISCASA-N	449.353	1.943	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)[C@@H]2CCC(=O)N2C)[C@@H]1c1cccnc1	1812869186	SIGIDSORJJXKFB-NZUILWFCSA-N	437.338	1.492	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)[C@@H]2CCc3nc[nH]c3C2)[C@H]1c1cccnc1	1813034045	ZPNZZMWQTKVLAK-FKKBTLCVSA-N	445.951	1.869	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](C)NS(=O)(=O)CC)n[nH]1	1815167447	KKTLDIMLPLTCLR-MBNYWOFBSA-N	433.962	1.747	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](F)Br)CC2)c1cc(O)nc(O)n1	1817103275	DWVAOEIFMVDWDS-GPXNAGAYSA-N	446.258	1.261	50	20	IDGD	
CN1CCN(CC(=O)N2CCCC[C@@H]2c2cc(NC(=O)[C@@](C)(Cl)CCl)n[nH]2)CC1	1820865786	BRWHXRPPFNJUCH-BEFAXECRSA-N	445.395	1.886	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc(CO)on2)[nH]n1)[C@@H](F)Br	1820939021	DBYFDMWLRDINIJ-DGCLKSJQSA-N	430.234	1.886	50	20	IDGD	
CC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CNC(=O)c1cccnc1)CC2	1822841950	YLQRQHVNRHXNAT-STQMWFEESA-N	435.937	1.898	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1CCc2nc(NC(=O)Cn3nccn3)sc2C1	1823109659	MNUIPCAPCYFLPW-VHSXEESVSA-N	427.328	1.378	50	20	IDGD	
O=C(CCC(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H](O)CCl)CC1)N1CCCC1	1824178785	KUYBHTXGZIPXFX-MSOLQXFVSA-N	427.973	1.608	50	20	IDGD	
Cc1ncccc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1	1825842835	QEVBFWSJKUZSOC-QFIPXVFZSA-N	435.333	1.617	50	20	IDGD	
O=C(O)c1cc(C(=O)N[C@@H]2CCc3nc(NC(=O)C(Cl)Cl)sc3C2)ncn1	1826093564	QRANKIFFPCRXNF-ZCFIWIBFSA-N	430.273	1.661	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC([C@H]2CCCCN2C(=O)CS(C)(=O)=O)CC1	1826625426	IQJFCGHDQFGEJQ-DZGCQCFKSA-N	437.400	1.682	50	20	IDGD	
Cn1ccc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)CC2)c1	1828925014	BFFQLDUDJPXXAP-FQEVSTJZSA-N	438.532	1.571	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)c2[nH]cc3c2CCC3)CC1	1829584259	BVXVLDZRUUGHJL-QFIPXVFZSA-N	449.360	1.730	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)C[C@H]2NC(=O)NC2=O)CC1	1830314245	UTLGARPPMCBUMM-LPMFXHHGSA-N	447.363	1.441	50	20	IDGD	
O=C(/C=C/c1ccc([N+](=O)[O-])o1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1830908663	RLEVVBSVKGCJFB-YOYDLMLSSA-N	431.804	1.192	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3n[nH]c(C4CC4)c3F)C2)C1	1831643422	BNQHNGMJYHLKNI-VLIAUNLRSA-N	442.919	1.904	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H]2CCNC(=O)C2)CC1	1831656798	KVLSVNJOANTPSZ-CWRNSKLLSA-N	428.371	1.916	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cnc(N(C)C)o2)CC1	1831871469	FZYPSKFRYYQRAD-QGZVFWFLSA-N	448.568	1.347	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)CC2(O)CCC2)CC1	1832460342	IEYNXSHFJBQOEC-IBGZPJMESA-N	443.548	1.224	50	20	IDGD	
C[C@@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)c3ccnn3C)CC2)CC1	1833262598	XXFXWYCBBJUVQJ-AWEZNQCLSA-N	440.386	1.636	50	20	IDGD	
C[C@H](Nc1nccs1)C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)CCl)CC2)CC1	1833310408	GODRSICODANVSU-XJKSGUPXSA-N	444.001	1.115	50	20	IDGD	
Cc1cc(C)n(CCC(=O)N2CCC(N3CCC(NC(=O)[C@H](O)CCl)CC3)CC2)n1	1833312845	HSLHMRGTUKPQFS-LJQANCHMSA-N	439.988	1.061	50	20	IDGD	
C[C@H](Cc1ccccn1)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)CCl)CC2)CC1	1833313155	XULYTQCDUBMULB-UZLBHIALSA-N	436.984	1.432	50	20	IDGD	
COC(=O)CSCC(=O)NC1CCN(C2CCN(C(=O)C(Cl)Cl)CC2)CC1	1833480364	RCCJBNYWNAITIP-UHFFFAOYSA-N	440.393	1.268	50	20	IDGD	
CC(C)c1cc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCBr)CCO3)C2)on1	1834823655	AZUAODYJAFVSAO-GOSISDBHSA-N	444.326	1.653	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CC3CCOCC3)CCO2)C1	1835424577	SAJKHOXNQNIJNE-RDTXWAMCSA-N	433.343	1.043	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](C)NC(=O)NCC)CC2)CC1	1835704780	ZAZQSPZMDABYNQ-QAPCUYQASA-N	444.020	1.673	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3ccnn3C(C)C)CC2)CC1	1835947880	CRGBIPLDWZILMD-SFHVURJKSA-N	439.988	1.903	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3ccnnc3O)CC2)CC1	1836063534	CNBWUKBLYWOTAG-LBPRGKRZSA-N	440.342	1.151	50	20	IDGD	
CCNC(=S)NCC(=O)N1CCC(N2CCC(NC(=O)[C@H](Cl)CC)CC2)CC1	1836397868	QSDWLIGOVMHXHV-MRXNPFEDSA-N	432.034	1.059	50	20	IDGD	
CCS(=O)(=O)CC(=O)N1CCC(OC2CCN(C(=O)C(Cl)Cl)CC2)CC1	1836848537	KHKMKDBVNSOLOY-UHFFFAOYSA-N	429.366	1.223	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(C#N)c[nH]3)CCO2)C1	1838740188	HCUHCWBXOHXPJF-KSSFIOAISA-N	439.310	1.130	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4c(c3)C(=O)CC4)C2)C1	1839148496	ZKLDPDNRWYEOIH-XMSQKQJNSA-N	434.920	1.903	50	20	IDGD	
Cc1[nH]nc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)c1F	1839151276	MLUARMTVFVEQKT-DLBZAZTESA-N	437.299	1.164	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C=C/c3ccco3)C2)C1	1839962829	RZAWHCKWZUYEHA-FOSBAXRVSA-N	441.322	1.923	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3F)C2)C1	1839964681	YZUOXBPTKSBDEB-KBXCAEBGSA-N	444.301	1.464	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccnc3Cl)C2)C1	1840149263	KETIRYRHCCYNRO-KBXCAEBGSA-N	432.304	1.059	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)C3(c4ccccc4)CC3)C2)C1	1840149411	ONHPVWNTCJQAIF-GHTZIAJQSA-N	436.936	1.428	50	20	IDGD	
COCC1(C(=O)N2CC3(CCCN3C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)CC1	1841924110	WEBOODCMADCEEY-AWEZNQCLSA-N	429.945	1.749	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)N3CC4(CCCN4C(=O)c4cccc(B(O)O)c4)C3)c[nH]2)cc1	1843013388	CUXVWZGEFWYWCJ-UHFFFAOYSA-N	443.312	1.801	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC2(CCCN2C(=O)[C@H](C)[C@H]2SC(=N)NC2=O)C1	1843402825	QIGBZELVJPCKEO-GMTAPVOTSA-N	431.356	1.023	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)c2cc3cccc(F)c3s2)C1	1843701971	XIXRVYZXWKLCNM-UHFFFAOYSA-N	438.289	1.851	50	20	IDGD	
CC#CC[C@@H](C(=O)N1CCCC12CN(C(=O)c1cccc(B(O)O)c1)C2)c1ccccc1	1844334910	AUYKUTGYLFMKDN-JOCHJYFZSA-N	430.313	1.381	50	20	IDGD	
C[C@@H](NC(=O)c1ccc(F)cc1)C(=O)N1CCCC12CN(C(=O)[C@@H](F)Br)C2	1845004050	NHEHQCQKBVYNCL-BXUZGUMPSA-N	444.276	1.838	50	20	IDGD	
CC(=O)N[C@@H](C(=O)N1CCCC12CN(C(=O)[C@H](O)CCl)C2)c1cccc(Cl)c1	1845017739	PUOTWQMTOBHKSB-HZPDHXFCSA-N	428.316	1.320	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@]2(C(=O)N3CCCC34CN(C(=O)[C@@H](O)CCl)C4)C[C@@H]2C1	1846103986	PVYZTAJFCFCBND-WIEQDCTASA-N	441.956	1.437	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@H]2C[C@](C)(O)CN2C(=O)OC(C)(C)C)C1	1846231264	KCVXDMSFJLSJJC-AVYPCKFXSA-N	443.972	1.968	50	20	IDGD	
Cc1nn2cc(CC(=O)N3CC[C@H]4[C@@H]3CCN4C(=O)[C@@H](C)Br)nc2s1	1847978703	QUNGGHSAGJSHKP-ICCXJUOJSA-N	426.340	1.627	50	20	IDGD	
COc1ccc(N2C[C@H](C(=O)NNC(=S)NCCc3cccs3)CC2=O)c(OC)c1	11523701	ZQWDIMMJXLEFEN-CYBMUJFWSA-N	448.570	1.856	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc2oc(SCC(=O)NNC(=O)c3ccccc3)nc2c1	20893394	YFILXASHRMZJCA-UHFFFAOYSA-N	434.499	1.631	50	20	IDGD	
NC(=O)NCCCCC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	22259715	OBLMZDCBBMWMLU-UHFFFAOYSA-N	439.519	1.149	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)c2ccc(N3CCCS3(=O)=O)cc2)cc1	24352042	JCBFNNVLZUIXSV-OAHLLOKOSA-N	447.513	1.854	50	20	IDGD	
CCCNC(=O)CSc1nnc(SCC(=O)NNC(=O)c2ccc(F)cc2)s1	26218953	DZAPTHSOTFUSBF-UHFFFAOYSA-N	443.551	1.849	50	20	IDGD	
COc1ccc(N2C[C@H](C(=O)NNC(=O)[C@H]3COc4ccccc4O3)CC2=O)c(OC)c1	27068343	ZITCOWSZGRNCKN-BFUOFWGJSA-N	441.440	1.044	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)c2ccc(C)c(S(N)(=O)=O)c2)cc1OC	28078550	KUECSBDWJKIQDG-UHFFFAOYSA-N	435.502	1.905	50	20	IDGD	
CC(=NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1)c1ccccc1O	254379306	GSFAQPDFHHMUNG-UHFFFAOYSA-N	430.530	1.547	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)CCOc2ccc(S(N)(=O)=O)cc2)c1C	726382133	NANDFIJAXOMZBJ-OAHLLOKOSA-N	435.502	1.335	50	20	IDGD	
O=C(CCCc1ccccc1)NNC(=O)CCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1	727741172	TVHMCWFMZKDEHK-UHFFFAOYSA-N	434.474	1.434	50	20	IDGD	
O=C(Cc1csc(N2CCCC2=O)n1)NNc1ccc(S(=O)(=O)NC2CC2)cc1	728209977	KHOSLBWCHZBPOV-UHFFFAOYSA-N	435.531	1.396	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)COc3cccc(Cl)c3)cc2)CC1	728213308	WVXIWLTXUXEPLL-UHFFFAOYSA-N	438.937	1.798	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc(C(F)(F)F)ccc1F)c1ccc(-n2cnnn2)cc1	728503262	LKHCFFJBJGFMLB-UHFFFAOYSA-N	430.343	1.444	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)c2ccc(S(=O)(=O)N(C)C)o2)c1	728529597	GIDPLDDKTOZHAC-UHFFFAOYSA-N	446.279	1.376	50	20	IDGD	
CC1(C)CN(CC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)CCN1Cc1ccccc1	729481228	MFUOPVWYXJUUQX-UHFFFAOYSA-N	425.489	1.952	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCCCN1CCCCC1=O	730129508	SDVCPYWFBUDBJW-CYBMUJFWSA-N	441.326	1.949	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)c1csc(I)c1	730740833	MCPUOFHUNKYIFS-NSHDSACASA-N	430.223	1.954	50	20	IDGD	
CC(=O)N1CCN(C(=O)CCNC(=O)NNC(=O)c2c(Cl)cccc2Cl)CC1	730826412	XKMFDCSCTVQNKH-UHFFFAOYSA-N	430.292	1.018	50	20	IDGD	
O=C(NNC(=O)c1cc2c(nc1O)CCCC2)c1ccc(S(=O)(=O)N2CCCC2)cc1	731597876	VLLJXWSLRHYGID-UHFFFAOYSA-N	444.513	1.525	50	20	IDGD	
O=C(Cc1ccc(S(=O)(=O)N2CCOCC2)s1)NNc1nc(-c2ccccc2)no1	732113217	QBQAOMJGGHQXAC-UHFFFAOYSA-N	449.514	1.505	50	20	IDGD	
Cc1cc(CSc2ncccc2C(=O)NNC(=O)CCN2C[C@H](C)O[C@@H](C)C2)no1	732260160	BNYDYTGTPPERHW-GJZGRUSLSA-N	433.534	1.931	50	20	IDGD	
Cc1csc([C@](O)(CC(=O)NNC(=O)CCN2C[C@@H](C)O[C@H](C)C2)C(F)(F)F)n1	732260595	VRMZRSCYRRBXCF-XHBSWPGZSA-N	438.472	1.238	50	20	IDGD	
CS(=O)(=O)N1CCCC[C@H]1C(=O)NNc1cc(C(F)(F)F)nc(-c2ccccn2)n1	734258873	OPNGSPREEXDHJJ-LBPRGKRZSA-N	444.439	1.815	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)c2ccc(NS(=O)(=O)c3ccc(F)c(F)c3)cc2)cn1	735473325	SHAQNHHOJQGELW-UHFFFAOYSA-N	435.412	1.574	50	20	IDGD	
COc1ccc(-c2nn(CCC#N)cc2/C=C(\C#N)C(=O)NCCNC(N)=O)cc1OC	736108325	XSBLQIUHFMKXJH-XNTDXEJSSA-N	437.460	1.172	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)c1ccc(N2CCCS2(=O)=O)cc1Cl	736674423	SVOYODDMZDCDKC-UHFFFAOYSA-N	437.905	1.979	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)[C@H]1CCC[C@H]1NC(=O)OC(C)(C)C	739734855	YNGQUSFMTKXVTR-QWHCGFSZSA-N	429.518	1.535	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cc(=O)n(-c3nc(C)cc(C)n3)[nH]2)ccc1OC(C)C	741741174	NYCCLHHBNXQRIC-UHFFFAOYSA-N	440.460	1.443	50	20	IDGD	
CC(C)c1nn([C@H]2CCS(=O)(=O)C2)cc1C(=O)NNC(=O)c1ccc2ccccc2n1	742463389	LXZWQXDAUDTZCR-HNNXBMFYSA-N	441.513	1.989	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NNC(=O)Cn2ccc3ccccc32)cc1	743592330	ZKBOPXQHLRUJIH-UHFFFAOYSA-N	444.473	1.112	50	20	IDGD	
CN1CCC(N2CC[C@H](NC(=O)NNC(=O)Nc3ccc(OC(F)F)cc3)C2)CC1	743626822	NUAHLSLTPQQSBM-AWEZNQCLSA-N	426.468	1.792	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@H](C)Oc1ccc(F)c(F)c1	743742530	XDOZSFIAJZEPPN-NSHDSACASA-N	426.445	1.795	50	20	IDGD	
Cc1nc(C(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)nn1-c1ccc(F)cc1	743830052	LUMQVYUWQWTWII-UHFFFAOYSA-N	432.437	1.585	50	20	IDGD	
CCc1ccccc1N1C[C@@H](C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)CC1=O	744545580	BXWAQIMNMHCXKU-SFHVURJKSA-N	434.452	1.478	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)c1cnn(CC(=O)NC2CCCCC2)c1	746578540	XBSNEAUYZQALLE-AWEZNQCLSA-N	431.468	1.700	50	20	IDGD	
CC(=NNC(=O)Cc1cn2ccccc2n1)c1ccc(S(=O)(=O)N2CCOCC2)cc1	747638212	NIYJVIKSEHMLHW-UHFFFAOYSA-N	441.513	1.438	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NCCCN2CCN(c3ccncc3)CC2)cc1	748466479	YXKYGJJKJYNDHZ-UHFFFAOYSA-N	426.521	1.312	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)NCc2ccccc2CS(C)(=O)=O)cc1	749585128	FEUSYHRDZXBFGV-HNNXBMFYSA-N	449.529	1.928	50	20	IDGD	
Cc1cc(NC(=O)CSCC(=O)NNc2nc(Br)cn3ccnc23)no1	750243422	IBGCWULAORWOBY-UHFFFAOYSA-N	440.283	1.603	50	20	IDGD	
CNS(=O)(=O)[C@@H]1CCN(C(=O)/C(C#N)=C/c2cn(CCC#N)nc2-c2ccccc2)C1	750515938	KFHYPPDDNNDERO-XYSGSMRZSA-N	438.513	1.521	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)N1CCC[C@@H]1C(=O)NNC(=O)CNC(=O)c1ccco1	751202061	OZHUYWSENUIYTI-CQSZACIVSA-N	448.863	1.124	50	20	IDGD	
O=C(NNC(=O)c1occc1Br)c1ccc(S(=O)(=O)N2CCCC2)cc1	751298486	SKAIQTMKCGTBQF-UHFFFAOYSA-N	442.291	1.901	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ncccc2OCC(F)(F)F)c1	752503418	OWTXJXACWUUYRO-UHFFFAOYSA-N	446.407	1.348	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2ccccc2C)cc1S(=O)(=O)N1CCOCC1	755413566	NZJKEWDVBXRJLD-UHFFFAOYSA-N	448.501	1.491	50	20	IDGD	
Cc1nn(C)c(N2CCOCC2)c1C=NNC(=O)Cc1nc(O)c2c(C)c(C)sc2n1	755540484	LJKHFHQSSFIQMU-UHFFFAOYSA-N	443.533	1.585	50	20	IDGD	
O=C(Cc1csc(N2CCOCC2)n1)NN=Cc1cc(O)cc(Br)c1O	755600058	WONAFHCYICLDQO-UHFFFAOYSA-N	441.307	1.846	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)c2cc(S(N)(=O)=O)c(C)o2)cc1OC	755622015	FNHYUOJVDBDRJX-UHFFFAOYSA-N	425.463	1.498	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)N2CCN(CC(=O)Nc3ccc(Cl)cc3)CC2)c1	756062425	KTRIMYRVHHRZJH-UHFFFAOYSA-N	440.891	1.822	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)Nc1cc(C(F)(F)F)cnc1O	756171884	IBAFWKWODXTYCC-UHFFFAOYSA-N	425.371	1.665	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)Nc1ccc(OC)c(-n2nnnc2C)c1	756322295	WMXCBPNGDMSHJW-UHFFFAOYSA-N	425.449	1.773	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)Nc2cc(C#N)ccc2OC(F)F)c2ccccc2c1=O	756344160	RKZWKRBKRVULCK-UHFFFAOYSA-N	428.355	1.873	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)Nc1cccc(C(=O)NCCC(N)=O)c1	756395413	WWLHSOSGYJKDLI-GFCCVEGCSA-N	431.424	1.051	50	20	IDGD	
CN(C)CCCOc1ccc(NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1	756475981	QWYBXDXISZRKOG-UHFFFAOYSA-N	434.518	1.887	50	20	IDGD	
CCOC(=O)[C@@H](C)NC(=O)c1ccc(NC(=O)NNC(=O)Cc2ccccc2OC)cc1	756789991	KPYCRVPFOSVIBA-CQSZACIVSA-N	442.472	1.772	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)Nc1ccc(C[C@@H]2CC(=O)NC2=O)cc1	756817263	WXXRKHRMQVBMCL-TZMCWYRMSA-N	428.420	1.651	50	20	IDGD	
CCS(=O)(=O)c1ccc(CCC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1	756922906	MYTLNFSWLZOXKW-UHFFFAOYSA-N	438.527	1.278	50	20	IDGD	
COc1cccc(-c2cc(C(=O)N3CCN(S(=O)(=O)CBr)CC3)n[nH]2)c1	758522088	DQSMVPQSRKCGCF-UHFFFAOYSA-N	443.323	1.525	50	20	IDGD	
O=C(NNC(=O)c1ccc(I)cc1Cl)C(=O)Nc1ccccn1	758837433	BNGODDYCYSYLRY-UHFFFAOYSA-N	444.616	1.739	50	20	IDGD	
Cc1ccc(CNC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])c(O[C@H]2CCOC2)c1	758899883	KEIADWFPIKBSHW-INIZCTEOSA-N	444.444	1.980	50	20	IDGD	
COc1nc(N2CCN(CCI)CC2)ncc1Br	759376866	AIFFFGFBOBHOEY-UHFFFAOYSA-N	427.084	1.805	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)CN2C(=O)c3ccc(Br)cc3C2=O)nc1	759728357	DCKCAFVGNBWZTB-UHFFFAOYSA-N	433.218	1.370	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)c2ccc(C)cc2O)c(OC)c1	761272518	KJTLTRBPPMLLHD-UHFFFAOYSA-N	443.503	1.094	50	20	IDGD	
COC(=O)c1cn(CC(=O)OCC(=O)NNC(=O)Cc2nc(C)cs2)c2ccccc12	762373297	LDESNBZNONBYIP-UHFFFAOYSA-N	444.469	1.126	50	20	IDGD	
O=C(NNc1nccc(N2CCOCC2)n1)c1csc(I)c1	762855522	FRMRVVPJZDZHNO-UHFFFAOYSA-N	431.259	1.736	50	20	IDGD	
CCOC(=O)C(C)(C)C(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	762937726	LHNRYCQMDCVHQG-UHFFFAOYSA-N	447.513	1.515	50	20	IDGD	
COc1cccc(C[C@@H](C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)n2nnnc2C)c1	762939557	TYGFFYSXOASNGI-FQEVSTJZSA-N	446.471	1.625	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1Cl	763441759	JLLIFXDVFGMXJS-UHFFFAOYSA-N	436.808	1.673	50	20	IDGD	
O=C(NNC(=O)c1ccccc1Br)C(=O)Nc1ccnn1Cc1ccccn1	763482129	DDJDGYAETMFKPZ-UHFFFAOYSA-N	443.261	1.489	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccc3scnc3c2)cc(OC)c1OC	763539188	JXLCNODENLDKAO-UHFFFAOYSA-N	430.442	1.722	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)[nH]n1)C(=O)Nc1cccnc1OCC(F)F	763599900	AJTBGRDWCOEQTJ-UHFFFAOYSA-N	430.371	1.515	50	20	IDGD	
CCN(CC)C(=O)c1ccccc1NC(=O)C(=O)NNC(=O)COc1ccc(C)c(C)c1	763664694	FDVMSCBEOJIMCC-UHFFFAOYSA-N	440.500	1.950	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2cccc(C(=O)NC(C)(C)C)c2)c1	763668066	HLEIDLCVXNWGMO-UHFFFAOYSA-N	440.500	1.997	50	20	IDGD	
COC(=O)c1c(C2CC2)csc1NC(=O)C(=O)NNC(=O)COc1ccc(C#N)cc1	763673623	IDCQUKUBTVVXGY-UHFFFAOYSA-N	442.453	1.449	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)C(=O)Nc2ccc(F)c(C#N)c2)c2ccccc2c1=O	763789853	DDPSWAWPIHFSSA-UHFFFAOYSA-N	436.403	1.388	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(OCC(=O)N(CC)CC)c2)cc1	763833719	DYMFNCVSUDPLDO-UHFFFAOYSA-N	440.500	1.896	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc3ccccc3c2)n(CCC#N)n1	763855262	VFNBWBRFSMADHL-OAHLLOKOSA-N	434.456	1.812	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)N2CCc3cc(F)c(F)cc32)cc1	763878000	NSSAUUVVJQLJQJ-LBPRGKRZSA-N	431.395	1.671	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)Nc1ccc(CC(=O)N2CCOCC2)cc1	763928718	FGGQITLPAGHLMH-UHFFFAOYSA-N	444.513	1.739	50	20	IDGD	
Cc1nc(C)n(-c2ccccc2NC(=O)C(=O)NNC(=O)Cc2ccc(Cl)cc2)n1	763931447	HIIURHAGIVAFIQ-UHFFFAOYSA-N	426.864	1.866	50	20	IDGD	
COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NNC(=O)c1ccc(Br)s1	763942130	VBLBGXSXOSHSSG-UHFFFAOYSA-N	443.235	1.827	50	20	IDGD	
COc1c(F)cc(NC(=O)C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc1F	763949062	MVHUIEVMYJYOEA-UHFFFAOYSA-N	431.355	1.264	50	20	IDGD	
CNC(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)c1	763979286	SQEHWKMCYHKWBU-UHFFFAOYSA-N	425.228	1.458	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)Nc1ccc(F)cc1OC(F)F	764005280	XASXJCZEGXPAIB-UHFFFAOYSA-N	449.183	1.928	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2nc(-c3ccccc3)cs2)c1	764078611	XXERFPGODWMSQZ-UHFFFAOYSA-N	444.494	1.613	50	20	IDGD	
CC[C@@H](C)C(=O)NNC(=O)C(=O)Nc1cc(NC(=O)CN2CCCC[C@H]2C)ccc1F	764084653	VNDKKYAXANYIDP-ZIAGYGMSSA-N	435.500	1.771	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(N3C[C@H](C)O[C@@H](C)C3)cc2)c(O)c1	764109318	KFQQVKFYMSIFJR-GJZGRUSLSA-N	426.473	1.714	50	20	IDGD	
CS(=O)(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)c1	764125379	WKHMMUBLSHLJFM-UHFFFAOYSA-N	446.268	1.502	50	20	IDGD	
O=C(CCc1ccco1)NNC(=O)C(=O)Nc1ccc2nc(N3CCOCC3)sc2c1	764168597	FEQXCCGKXPMMNF-UHFFFAOYSA-N	443.485	1.445	50	20	IDGD	
Cc1ccc(S(C)(=O)=O)cc1NC(=O)C(=O)NNC(=O)Cn1ccc2ccccc21	764239243	IJQWERSQZICLJX-UHFFFAOYSA-N	428.470	1.139	50	20	IDGD	
O=C(Cc1ccccn1)NNC(=O)C(=O)Nc1ccc(C(=O)NCCc2ccccc2)cc1	764270563	OUEASEUZOBFCFC-UHFFFAOYSA-N	445.479	1.383	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(NC(C)=O)c(F)cc2F)c(OC)c1	764284444	MDOXCFKKLNLTHH-UHFFFAOYSA-N	436.371	1.340	50	20	IDGD	
CCc1onc(C)c1NC(=O)C(=O)NNC(=O)c1ccc(OC)c(Br)c1	764326009	DDYNKAYRENHQKX-UHFFFAOYSA-N	425.239	1.716	50	20	IDGD	
CCN1CCN(c2ccc(NC(=O)C(=O)NNC(=O)c3cc4ccccc4o3)cc2)CC1	764331007	LENUUTSKRLYPPW-UHFFFAOYSA-N	435.484	1.974	50	20	IDGD	
CC(C)Oc1ccc(C#N)cc1NC(=O)C(=O)NNC(=O)c1cnn(-c2ccccc2)c1	764342046	ACXCRWPGQBUNRK-UHFFFAOYSA-N	432.440	1.931	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)COCc2ccccc2)c(Br)c1	764368356	VIKKLINUQGSVLB-UHFFFAOYSA-N	436.262	1.760	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(Cl)ccc2OCCS(C)(=O)=O)o1	764370684	APMPASNGCPMKJV-UHFFFAOYSA-N	443.865	1.065	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(NC(=O)NC[C@@H]3CCCO3)cc2)o1	764371482	OTCJDIFUVKGSIP-HNNXBMFYSA-N	429.433	1.288	50	20	IDGD	
O=C(NNC(=O)C(F)(F)Oc1ccccc1)C(=O)Nc1cnc(-c2ccccc2)nc1	764378588	KCCPFGXCBLCPEB-UHFFFAOYSA-N	427.367	1.901	50	20	IDGD	
N#Cc1ccc(OC(F)F)c(NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)c1	764380300	UPFFIRXYVVQDAL-UHFFFAOYSA-N	440.309	1.917	50	20	IDGD	
CSc1nnnn1-c1cccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2F)c1	764409992	FCPSETVASCTABF-UHFFFAOYSA-N	449.855	1.576	50	20	IDGD	
C[C@@](O)(CNC(=O)NNC(=O)c1csc(N2CCOCC2)n1)c1ccccc1Cl	765191623	ANHADRQXPATPOW-GOSISDBHSA-N	439.925	1.485	50	20	IDGD	
C[C@H](C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)S(=O)(=O)c1ccc(F)cc1	765324446	WJETYCINMCUYSW-GFCCVEGCSA-N	431.486	1.440	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NC[C@H]1CCCS1(=O)=O	765645957	YDYATXYSHDPZSZ-ZWNOBZJWSA-N	434.312	1.124	50	20	IDGD	
O=C(/C=C\c1ccc2c(c1)OCO2)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765739541	XSERHSXTSHKYFK-CLFYSBASSA-N	436.468	1.034	50	20	IDGD	
O=C(NNC(=O)c1cccc2cccnc12)c1ccc(N2C(=O)CCC2=O)c([N+](=O)[O-])c1	767772956	AEAQICYSVDLJLW-UHFFFAOYSA-N	433.380	1.871	50	20	IDGD	
O=C(NNC(=O)c1ccc(Br)s1)NC1CCN([C@@H]2CCC[C@@H]2O)CC1	767937243	IKMVWULGPOZVRN-NEPJUHHUSA-N	431.356	1.832	50	20	IDGD	
N#Cc1ccc(C(=O)NNS(=O)(=O)c2cc3nc(O)[nH]c3cc2Br)cc1	768506509	UAQOEXLBQZRYSI-UHFFFAOYSA-N	436.247	1.526	50	20	IDGD	
N#Cc1cc(Cl)nc(NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1	768709239	ZIIBCTCCWKGKEQ-UHFFFAOYSA-N	449.920	1.703	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)N1CCO[C@H](C(=O)OC(C)(C)C)C1	770659437	SDIDCNZKUYIOGZ-WFASDCNBSA-N	427.885	1.891	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)c1cc(N2C[C@@H](C)O[C@H](C)C2)ccn1	770813028	AHWFLBMNGPHLDT-HZPDHXFCSA-N	428.489	1.934	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)C(=O)NNc1c(C)cccc1F	770815616	KPBANWKRFYRFGD-UHFFFAOYSA-N	438.481	1.865	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(C(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)cc1	770957612	CCDSGTWDSYIFHZ-UHFFFAOYSA-N	433.494	1.294	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)c2cccnc12	771605916	FDFVIGLKSSMENA-UHFFFAOYSA-N	448.888	1.523	50	20	IDGD	
Cc1cccc(F)c1NNC(=O)[C@H](CCS(C)(=O)=O)NS(=O)(=O)c1ccccc1	771706918	JMIGCOJZCDHUQP-INIZCTEOSA-N	443.522	1.359	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCCNC(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)s1	772630982	NEUXJIINTJOZRF-LBPRGKRZSA-N	444.510	1.272	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)[C@H]1CCc2c(Cl)cccc21	775780541	OAWCEWKCZGVXIA-IBGZPJMESA-N	440.931	1.975	50	20	IDGD	
Cc1c(C(=O)NNC(=O)CNC(=O)OC(C)(C)C)cnn1CCO[C@H]1CCCCO1	778432838	AZSDONLVQOGSGF-INIZCTEOSA-N	425.486	1.020	50	20	IDGD	
CC[C@@H](C)n1nc(C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)cc1C	778506745	RALYSDZFFYMWGX-CQSZACIVSA-N	435.554	1.251	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cc(O)cc([N+](=O)[O-])c3)CC2)cc1	780646002	HJUBVUKORJYHJX-UHFFFAOYSA-N	427.461	1.188	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)c2ccc3c(c2)SC2=NS(=O)(=O)CCN23)c1	780796537	DTNWBRWULXWQPO-UHFFFAOYSA-N	432.483	1.842	50	20	IDGD	
COc1ccc(NNC(=O)[C@H](CCSC)NS(=O)(=O)c2ccccc2F)nc1	781516949	ZNMKVVYJJOSGGP-AWEZNQCLSA-N	428.511	1.773	50	20	IDGD	
O=C(NNc1cncc(Cl)n1)C(=O)N1C[C@@H](C(=O)N2CCCCC2)Oc2ccccc21	783260325	ZJHOKZTXQFSREY-HNNXBMFYSA-N	444.879	1.380	50	20	IDGD	
CN1CCN(CC(=O)N(C)c2ccc(NC(=O)C(=O)NN(C)c3ccccc3)cc2)CC1	783429922	QZRGSSAQQMZLOF-UHFFFAOYSA-N	438.532	1.003	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)F)cc1)[C@@H]1CC=CC[C@H]1C(=O)N1CCOCC1	784445752	ATQAMVUFMURJFI-HZPDHXFCSA-N	443.472	1.567	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)NC(C)(C)C)cc1F	784832883	FOQQBMFJRSGSMX-UHFFFAOYSA-N	438.481	1.993	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)NC(C)(C)C)c(N(C)C)n1	784834222	XWIMIRUIJUXBAB-UHFFFAOYSA-N	448.549	1.615	50	20	IDGD	
O=C(NNc1c(F)cc(C(=O)NC2CC2)cc1F)C(=O)Nc1ccc2c(c1)C(=O)NCC2	785099449	GBYCFJGRQWZNMR-UHFFFAOYSA-N	443.410	1.225	50	20	IDGD	
O=C(NNc1nc(C(F)(F)F)cs1)C(=O)Nc1ccccc1C(=O)N1CCOCC1	785146802	XCFZKDUAZVCFBI-UHFFFAOYSA-N	443.407	1.716	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)NCc2ccc(S(C)(=O)=O)s2)cc1OC	786879254	BAIREOODAMCJOC-UHFFFAOYSA-N	427.504	1.703	50	20	IDGD	
Cc1cc2c(cc1C)[C@H](C(=O)OCC(=O)NNC(=O)[C@@H]1COc3ccccc3O1)CO2	786955479	FCYREFRJBGKKDX-BEFAXECRSA-N	426.425	1.310	50	20	IDGD	
CCOC(=O)[C@@](C)(CNC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)c1ccccc1	787309301	KYNYFWDSPLEKKM-NRFANRHFSA-N	447.513	1.555	50	20	IDGD	
CN1CCN(C(=O)NNC(=O)c2cccc(S(=O)(=O)Nc3ccccc3F)c2)CC1	788166163	JBVRNODAMYMNNE-UHFFFAOYSA-N	435.481	1.228	50	20	IDGD	
Cn1cc(-c2ccc(NC(=O)NNC(=O)COc3ccc(Br)cc3)nn2)cn1	788789049	LFGKKSVROMMZCI-UHFFFAOYSA-N	446.265	1.871	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2ccc(Cl)c(OC)c2)c2ccccc2c1=O	789733314	ZJUYEBHKLIYVPG-UHFFFAOYSA-N	443.847	1.478	50	20	IDGD	
Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C(=O)NNC(=O)[C@H]1OCC[C@H]1c1ccccc1	789816263	FUYRWSSIPRKPRT-YJBOKZPZSA-N	426.429	1.870	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3n[nH]c4c3CCCCC4)cc2)CC1	789818455	GXWQQCRATNEUQL-UHFFFAOYSA-N	432.550	1.372	50	20	IDGD	
C[C@@H](CC(=O)NNc1cccc(F)c1[N+](=O)[O-])NS(=O)(=O)c1cccnc1Cl	791150397	MOABGMGPLOCSDP-VIFPVBQESA-N	431.833	1.983	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)[C@](C)(O)Cn1cc(C(F)(F)F)ccc1=O	792016638	RNMNWEJVZZSTKO-BBATYDOGSA-N	445.369	1.372	50	20	IDGD	
Cc1c(C(=O)NNC(=O)CCN2C[C@@H](C)O[C@H](C)C2)nnn1Cc1ccc(F)cc1F	792207644	DSVMJTPORZFYLI-CHWSQXEVSA-N	436.463	1.173	50	20	IDGD	
COc1cc(C(F)(F)F)ncc1NC(=O)C(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	792264169	KRKWPDGFOISKLH-UHFFFAOYSA-N	427.295	1.417	50	20	IDGD	
COc1ccc(Cn2nccc2NC(=O)C(=O)NNc2ncccc2C)c(OC)c1OC	792379639	KKCBNCJZNUPAGH-UHFFFAOYSA-N	440.460	1.742	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)c1ccc(Br)cn1	792907179	GJAISWVJICIHFP-GFCCVEGCSA-N	448.325	1.942	50	20	IDGD	
CS(=O)(=O)C[C@@H](NC(=O)NNC(=O)CNC(=O)OCc1ccccc1)c1ccccc1	793137925	RPPAHUWDXSTTRX-QGZVFWFLSA-N	448.501	1.029	50	20	IDGD	
Cc1nn(-c2ccccc2)c(N)c1C=NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	794920609	PXSUXWWSLQVORN-UHFFFAOYSA-N	445.527	1.671	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccc(F)c(N2CCOC2=O)c1	796990689	VIAURTAPUNLUQX-NSHDSACASA-N	448.382	1.475	50	20	IDGD	
Cc1ccc(N2CCOCC2)cc1NC(=O)C(=O)NNC(=O)c1ccc(O)c(Cl)c1	797534918	GSSYCSGUIVLKRO-UHFFFAOYSA-N	432.864	1.590	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)C[C@@H](C)O1	798105747	DYLHBJLKBXRSNL-ZHALLVOQSA-N	432.521	1.434	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CSCC(=O)N(C)C2CCCCC2)cc1C	798307808	HCDYENOVCNLRDQ-UHFFFAOYSA-N	434.562	1.914	50	20	IDGD	
CC[C@](O)(C(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)c1cccc(Cl)c1	800322438	TWFBQGKFLKETJQ-LJQANCHMSA-N	435.820	1.850	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)Nc1ccnc(OCc2ccccc2)c1	800622812	UFTDSFQEIWQWSA-IBGZPJMESA-N	448.435	1.587	50	20	IDGD	
O=C(NNC(=O)c1cccc(CN2CCS(=O)(=O)CC2)c1)Nc1cc(F)cc(F)c1	802006562	PEZYGLPLOAYCKI-UHFFFAOYSA-N	438.456	1.662	50	20	IDGD	
CSC[C@H](C(=O)NNC(=O)Nc1ccc2c(c1)OCO2)N1C(=O)[C@@H]2CCCC[C@H]2C1=O	802104818	LACQKMOSPACJFG-MGPQQGTHSA-N	448.501	1.475	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)C(=O)Nc1ccc(Br)c2cccnc12	802567232	LFWPTMVBRCXQAU-UHFFFAOYSA-N	428.246	1.721	50	20	IDGD	
O=C1COC[C@H](C[C@@H]2CN(C(=O)C(=O)NNc3ccccc3Cl)c3ccccc32)N1	806967406	KSDWQIFEQZPFNF-KGLIPLIRSA-N	428.876	1.819	50	20	IDGD	
CCN(C)C(=O)c1cccc(NC(=O)C(=O)NNC(=O)COc2cc(C)cc(C)c2)c1	806973214	FCDDYWDOQXMKGX-UHFFFAOYSA-N	426.473	1.560	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)c1cc(S(=O)(=O)Nc2ccccc2F)c[nH]1	807368489	DUARWNGIBGQYGV-UHFFFAOYSA-N	442.469	1.505	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)[C@H]1CC(=O)N(C)[C@H]1c1ccc(Cl)c(F)c1	807372117	YTHRVDTWCZNEQM-LRDDRELGSA-N	429.876	1.935	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc2[nH]ccc12	808934986	DMPWQGMRSQPONT-UHFFFAOYSA-N	446.423	1.540	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)c3cn(C)nn3)c2)c(C)c1	809551273	TYIAWEJWRWMBMH-UHFFFAOYSA-N	428.474	1.308	50	20	IDGD	
CC(=O)c1cccc(S(=O)(=O)NCC(=O)NNC(=O)c2c(Cl)cccc2Cl)c1	810338133	ORFBRXLUDLCEAQ-UHFFFAOYSA-N	444.296	1.936	50	20	IDGD	
CC1(C)CN(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)C[C@@H](C(F)(F)F)O1	814271029	UPNXFBVHRJESEC-NSHDSACASA-N	437.444	1.376	50	20	IDGD	
COC(=O)C(C)(C)c1csc(NC(=O)C(=O)NNC(=O)Cc2ccc(Cl)cc2)n1	815567415	XLWAAVRSHBIIPY-UHFFFAOYSA-N	438.893	1.576	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCc2nncn2C1)C(=O)Nc1ccccc1Oc1cccc(F)c1	815691529	SSPJLEZIXAAKDX-CYBMUJFWSA-N	438.419	1.558	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1ccnn1C1CCCCC1	815752016	YROBLGNICCWJTC-UHFFFAOYSA-N	434.522	1.720	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)c1cc(O)nc2ccc([N+](=O)[O-])cc12	817053514	VBHIKZAKDHYIJE-UHFFFAOYSA-N	431.430	1.856	50	20	IDGD	
CCOC(=O)c1cnc(C(=O)NNc2ccccc2S(=O)(=O)N(C)C)c(Cl)c1	817054659	RUTXOQXEAZMFGD-UHFFFAOYSA-N	426.882	1.919	50	20	IDGD	
CNS(=O)(=O)c1ccc(C(=O)NNc2cc(C(=O)OC)ccc2Br)cn1	818767518	LVCZQIDMVYHZTE-UHFFFAOYSA-N	443.279	1.296	50	20	IDGD	
CC(C)C(=O)N1CCC(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)CC1	885813473	VZPUGTMTFFMSLH-UHFFFAOYSA-N	429.565	1.241	50	20	IDGD	
CC(C)(C)OC(=O)NNC(=O)CCCNS(=O)(=O)c1ccc2c(c1)OCCCO2	913176197	HLPUDNBJUBTWGK-UHFFFAOYSA-N	429.495	1.462	50	20	IDGD	
COc1cc2cc(C(=O)OCC(=O)NNC(=O)c3ccccc3)[nH]c2c(OC)c1OC	915017003	RVKLCRSCQAPJJN-UHFFFAOYSA-N	427.413	1.812	50	20	IDGD	
COc1ccc([C@@H](CNC(=O)NNC(=O)c2cccc(N(C)C)c2)N2CCOCC2)cc1	915897129	WQSBMHBUODPYOT-OAQYLSRUSA-N	441.532	1.779	50	20	IDGD	
Cc1nn([C@H]2CCS(=O)(=O)C2)c(Cl)c1C=NNC(=O)[C@@H](C)CN1CCCCC1	916364550	PDHCSPLWUSIKNW-ZFWWWQNUSA-N	429.974	1.777	50	20	IDGD	
CC[C@@H](C)NC(=O)c1cccc(CNC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1	916477280	WZCFBVCYJNNTLS-AUUYWEPGSA-N	426.473	1.885	50	20	IDGD	
CCCNC(=O)CN1CCC(NC(=O)NNC(=O)CC23CC4CC(CC(C4)C2)C3)CC1	916518939	PTQJTHWTUITMOZ-UHFFFAOYSA-N	433.597	1.914	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2ccc(N3CCSCC3)cc2)c1	916624819	SDFBGFXCUKLRET-UHFFFAOYSA-N	448.570	1.788	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NCc1cccc(CN2CCOCC2)c1	918223240	GCCLIGHGVCDHRY-MRXNPFEDSA-N	430.480	1.956	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)c2ccc(OC)c(S(=O)(=O)NC(C)C)c2)cc1	919835893	TXYUNZFGARLTNN-UHFFFAOYSA-N	449.529	1.784	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)CS(=O)(=O)Cc1cccc(Br)c1	919839010	YIEMIYPKNHNZNL-UHFFFAOYSA-N	443.294	1.893	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)C[C@@H](c1ccccc1)OC2=O)N[C@H]1CCS(=O)(=O)C1	919886349	VSTQHXXTBNQREI-WMZOPIPTSA-N	443.481	1.272	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)[nH]n1)Nc1nc(CN2CCOCC2)cs1	920932607	RUXAXSQLQZRCGA-UHFFFAOYSA-N	427.490	1.832	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H](C)OC[C@H]2CCCO2)c1	921020114	RPEPMEZTVKRUHE-GDBMZVCRSA-N	427.523	1.062	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(S(=O)(=O)NC3CC3)cc2)cc1C	921183554	CURVUNFXQLTIRJ-UHFFFAOYSA-N	430.486	1.144	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H](C)c2cnn(C)c2C)c1	1115853439	CFABMOPUIBLDNC-CYBMUJFWSA-N	436.538	1.464	50	20	IDGD	
O=C(COc1ccccc1Cc1ccccc1)NNC(=O)Cn1nc2n(c1=O)CCCCC2	1248582827	HVORIIPACQZIIF-UHFFFAOYSA-N	449.511	1.588	50	20	IDGD	
Cc1cccc(NC(=S)NNC(=O)c2ccc(S(=O)(=O)NC[C@@H](C)O)cc2)c1C	1262596169	UXTHPZSCFPZRQQ-CYBMUJFWSA-N	436.559	1.594	50	20	IDGD	
Cc1nn(C)cc1CCC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	1318514669	SPIDEMGIJHVXRU-UHFFFAOYSA-N	433.534	1.297	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)c1ccc([S@@](C)=O)cc1	1319501101	ISBKTXURARWGLA-ILHIWHGASA-N	430.534	1.522	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1CC	1323442890	FZRSNCKDGMUOCD-UHFFFAOYSA-N	445.541	1.907	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)N[C@H]2CC(=O)N(C(C)(C)C)C2)CC1	1331208953	OQUHNPIDIMRNAN-AWEZNQCLSA-N	425.530	1.363	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](C)Nc3cnccn3)C2)C1	1779053107	ZEQWEOFRCMSNQH-LBTNJELSSA-N	440.342	1.138	50	20	IDGD	
O=C(COC(=O)C(F)(F)F)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(Cl)Cl)C2	1779281907	XPWVLQJFRLTOOX-YMTOWFKASA-N	435.226	1.410	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Br)C2)c1ccc(Cl)nn1	1779630871	FXPXSFZNMCXKJK-PVXIVEMSSA-N	449.708	1.948	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2)c1cncc(C(F)(F)F)c1	1779852906	NTEAXRSBHSSJJM-HDMKZQKVSA-N	449.857	1.828	50	20	IDGD	
CCOc1ccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)nn1	1780426735	HPXJCAJUXQYUFE-CZUORRHYSA-N	431.262	1.009	50	20	IDGD	
Cn1nc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@](C)(Cl)CCl)C2)cc1O	1780710055	DMTWTFFNYSXXEU-JEBQAFNWSA-N	433.336	1.490	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)CCS(=O)(=O)c3ccccc3)CCO2)C1	1781213067	LAEIBKZEEQFRCA-YLJYHZDGSA-N	442.965	1.698	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@](C)(Cl)CCl)C3)C2)ncc1[N+](=O)[O-]	1781230209	QNCRFRNBUFRMTR-MSOLQXFVSA-N	445.303	1.978	50	20	IDGD	
O=C(c1nc2ccccc2[nH]1)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781329269	CIHHHZRTWYWPII-SUMWQHHRSA-N	425.258	1.697	50	20	IDGD	
O=C(c1ccc2cncn2c1)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781331646	OISFOBIECVNCEN-PBHICJAKSA-N	425.258	1.468	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(CCN(C(=O)c3cc(Cl)c(O)cc3O)C2)C1	1781471807	MIDKJZLKCZSOSZ-KRWDZBQOSA-N	447.713	1.980	50	20	IDGD	
COc1cc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)c(F)c(OC)c1F	1781946262	FZRPRFKMTDFBFJ-BLVKFPJESA-N	448.850	1.025	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)Cc2ccc(O)cn2)C1	1782635364	BTPYVPQTSGBFFX-VVFCZOMOSA-N	440.338	1.627	50	20	IDGD	
CCc1[nH]nc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](Br)CC)C3)C2)c1F	1783345271	YRNJCRAONJFQMR-DIFFPNOSSA-N	431.306	1.728	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Cl)C[C@@H]32)c1	1783747849	FAIWXRSKOGWTFE-QCEMKRCNSA-N	432.901	1.218	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3c(F)ccc(OC)c3OC)CCO2)C1	1783881778	UEWLCYKTJTWVIL-RBZFPXEDSA-N	444.887	1.540	50	20	IDGD	
CC[C@H](C)CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C[C@@H]21	1784295499	XHNWUVURMACDLR-BQRDVNJZSA-N	431.537	1.536	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CNC(=O)c3cccs3)C[C@@H]21	1784616331	PGXSAKKFXWFHSR-VGWMRTNUSA-N	441.981	1.865	50	20	IDGD	
COc1ncc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Br)C[C@@H]32)cc1C	1786272403	MREVXEFZCREHIV-MXAVVETBSA-N	444.301	1.682	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3n[nH]c4c3CCc3ncccc3-4)C[C@@H]21)[C@H](F)Cl	1787447959	NZMWPLWACZSICA-FUELBLBUSA-N	447.898	1.698	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc4[nH]ccc4s3)[C@H]2C1	1788085495	WROYLSGVGCQUSF-DZKIICNBSA-N	447.561	1.196	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)c1cc(-c2ccccc2)no1	1788916094	LNIFYHNWYDFYFT-MRHSLFKSSA-N	433.892	1.535	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnn4c3OCCC4)[C@H]2C1	1790372266	JLUGWKIHRWSRNM-VFSPDHHESA-N	445.347	1.495	50	20	IDGD	
Cc1nn(C)c(C)c1CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)Br)[C@H]2C1	1791064760	JFPUUPQSJGINEY-GQGQLFGLSA-N	441.370	1.343	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(F)cc(F)c3F)C[C@@H]21	1791256246	JVUBVHLKJJQLKK-BWPSIRRCSA-N	434.842	1.951	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1ccc(C2(NC(=O)[C@@H](O)N3CCOCC3)CCC2)cc1	1791568869	LCXBIVJGZBTGNZ-QFBILLFUSA-N	425.913	1.025	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccc(C#N)cc1	1792559207	QNWRWUGSDIKRTI-SFNKJDCFSA-N	434.334	1.864	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc(Cl)nc1)C2	1792867160	ZAOVEVSUUXUDKC-SYEHKZFSSA-N	431.718	1.364	50	20	IDGD	
COC(=O)CCCCCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)CBr	1792871867	BCHUQLOAQGPEKE-ZXFNITATSA-N	447.370	1.731	50	20	IDGD	
COc1ccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Br)C3)cc1C	1793654024	JLBUSEQBFRTDRO-DACLVMHWSA-N	443.313	1.826	50	20	IDGD	
CC(C)CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1793881299	ZTPHSYAERDWLLA-IVSAIRAKSA-N	431.961	1.754	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CCc2nc(O)nc(O)c2C1	1794383943	JMUOWJAHGCGNAT-APIJFGDWSA-N	448.596	1.482	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(N3CCOCC3)cc1)C2)[C@H](F)Cl	1796363694	YGSFUJVRRMHYCD-MVJTYMMSSA-N	425.888	1.261	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccn(C(F)F)n1	1798163237	OUMMHFABZGLLAU-LSCVPOLPSA-N	435.269	1.655	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CNC(=O)c1cccs1)C2	1799274239	SLERLHXPYFJPMH-TYYYEBLRSA-N	448.372	1.304	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccn3nccc3c1)C2	1799275768	BACCJPDNEJIISM-MVWRLGRASA-N	425.316	1.774	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1ccnc2ncccc12	1799978547	ROZMJMGNQWPKTM-BAESOJJISA-N	437.269	1.524	50	20	IDGD	
C=CCNC(=O)/C=C\C(=O)NC[C@@H]1CCN(C(=O)[C@H](Cl)COC)[C@H]1c1cccnc1	1802499257	ROTJBJHJCXUSJW-NNKVFSEQSA-N	434.924	1.200	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1CCN(C(=O)c2cnnn2C)[C@H]1c1cccnc1	1803009010	OFSPNDCSTGRNPE-INWMFGNUSA-N	435.326	1.561	50	20	IDGD	
C[C@H](Nc1nccs1)C(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]1c1cccnc1	1803139077	KDFQOYPSFVAIPH-XZDPQHSOSA-N	437.953	1.644	50	20	IDGD	
CC(C)[C@H](S)C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1803607383	CNSSSTBNFYXRPL-VDGAXYAQSA-N	435.594	1.415	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)c2ccon2)[C@@H]1c1cccnc1	1805996641	WEUHQEWMCOYMNZ-RBIZEYAUSA-N	449.471	1.523	50	20	IDGD	
O=C1CC[C@H](C(=O)NC[C@@H]2CCN(C(=O)[C@@H](F)Br)[C@H]2c2cccnc2)N1	1806815182	OYMTZNFPSNQDBB-MYZSUADSSA-N	427.274	1.057	50	20	IDGD	
CC(C)n1nc(C(=O)N2CCCC3(CCN(C(=O)[C@H](O)CCl)CC3)C2)cc1C(=O)O	1807691578	VQNNDBMNBKGNQS-MRXNPFEDSA-N	440.928	1.607	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2cn3ncccc3n2)[C@@H]1c1cccnc1	1809358299	SSVSCZVVMKPMJN-GJYPPUQNSA-N	442.907	1.698	50	20	IDGD	
CC1=CC[C@H](C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)CC1	1809478520	OCDXFXCRRKHKEQ-HARLFGEKSA-N	447.344	1.827	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)[C@@H]3CCC(F)(F)C3)CC2)C1	1809977907	MADOERHTTKCKHB-QGZVFWFLSA-N	434.292	1.647	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC2(CCCN(C(=O)c3ccc4n[nH]cc4c3)C2)CC1	1810570794	OYUHKQITOAHKHM-UHFFFAOYSA-N	446.316	1.401	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)n3)C2)CC1	1810890609	HOIVWXHKLMHEDO-GFCCVEGCSA-N	441.326	1.906	50	20	IDGD	
COC(=O)CCC(=O)N1CC[C@H](CNC(=O)[C@@H](C)Br)[C@H]1c1cccnc1	1812864079	KCSGQAHIFLUNJN-SUYBPPKGSA-N	426.311	1.824	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)N1CC[C@H](CNC(=O)[C@@H](C)Br)[C@H]1c1cccnc1	1812864459	PLJDGHZIQGBZHE-BQGCOEIASA-N	439.354	1.738	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2cccc(C#N)c2)[C@H]1c1cccnc1	1813073247	ODZMJJDQVKEXGX-REWPJTCUSA-N	448.527	1.646	50	20	IDGD	
O=C1Cc2cccc(C(=O)N3CCCC[C@H]3c3cc(NC(=O)[C@H](O)CCl)n[nH]3)c2N1	1814874804	FJSKCEPERNAEIH-LSDHHAIUSA-N	431.880	1.810	50	20	IDGD	
Cc1cc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)[nH]n2)no1	1816527407	FGZQTCVFGYXKIH-INIZCTEOSA-N	438.448	1.324	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H]2CCC(=O)N2)n[nH]1	1817088971	IMMDGECXUCUOAS-LOWVWBTDSA-N	426.315	1.711	50	20	IDGD	
COCCC(=O)N[C@@H]1CCc2nc(NC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)sc2C1	1817279751	BZMRUXWEYTXLPW-IVWKQIGUSA-N	432.506	1.226	50	20	IDGD	
Cc1nc(N)sc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1	1817394737	RAFYVHBXUWQVPV-ZDUSSCGKSA-N	448.553	1.436	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)COc2ccccc2)[nH]n1)c1ccc(B(O)O)cc1	1817471648	UPUPKJXCZSOMPF-HXUWFJFHSA-N	448.288	1.474	50	20	IDGD	
COC(=O)c1ccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)[C@@H](O)CCl)[nH]n2)cn1	1818222083	NHRRIMRUJYITLD-GJZGRUSLSA-N	435.868	1.497	50	20	IDGD	
CC(C)n1nccc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1	1819816393	BKJCDIBOWXKQOP-MRXNPFEDSA-N	444.540	1.866	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cnc(O)nc2O)[nH]n1)[C@H](F)Br	1820932961	WKZJJDRIVQNQDS-ONGXEEELSA-N	443.233	1.607	50	20	IDGD	
CCc1cc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)CCC(=O)NN(C)C)CC3)nn1C	1820971758	IGQQSTHBUUYVAP-GFCCVEGCSA-N	447.565	1.038	50	20	IDGD	
CCNC(=S)NCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](C)Br)[nH]n1	1821644020	FQWKOHHIPVSCRP-PWSUYJOCSA-N	445.387	1.669	50	20	IDGD	
COc1cc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@H](O)CCl)CC3)ccc1O	1822241466	XXACQGFMKNKHQI-ZWNOBZJWSA-N	425.894	1.683	50	20	IDGD	
Cc1ccncc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1	1822413984	JUVNYQORGSNKRS-QGZVFWFLSA-N	427.509	1.792	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CN2CC(=O)NC2=O)CC1	1824608950	DWTOQJMTVPKCCI-CVEARBPZSA-N	426.945	1.565	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](C)CC(N)=O)CC2	1825441377	UMIPUFHUNHTTKQ-UTLUCORTSA-N	431.356	1.740	50	20	IDGD	
CCS(=O)(=O)N[C@H](C)C(=O)N[C@H]1CCc2nc(NC(=O)C(Cl)Cl)sc2C1	1826092875	NJKFJVJYKZTNNU-SFYZADRCSA-N	443.378	1.187	50	20	IDGD	
Cc1oncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827050630	AZJYXAIUMKTAEP-HXUWFJFHSA-N	425.294	1.210	50	20	IDGD	
O=C(c1ccncc1O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827057892	MHEZOLKEKCFFCJ-FQEVSTJZSA-N	437.305	1.014	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccn3c(O)nnc23)CC1	1827538487	NYGXCKRMVSGENQ-IRXDYDNUSA-N	449.939	1.922	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2nccs2)CC1	1828925979	VUIAZZKFLSYPNX-QGZVFWFLSA-N	442.545	1.689	50	20	IDGD	
O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc([N+](=O)[O-])o1)CCO2	1829480392	NGVBWWUVFAEQNW-MRXNPFEDSA-N	446.254	1.043	50	20	IDGD	
O=C(c1cccc(-c2cnco2)c1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1830733749	SIXPDOXOHPVZPR-UWJYYQICSA-N	449.891	1.011	50	20	IDGD	
CCN(C)[C@H](C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1	1831073436	KPKSDBVFFFKDTK-UZLBHIALSA-N	444.580	1.259	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](CC)N(CC)CC)C2)C1	1831640117	IYVNYYFXLKOEMN-WAOWUJCRSA-N	432.005	1.971	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccnc3OC)C2)C1	1831643797	HAKLBSFKPIJXFL-JXFKEZNVSA-N	425.913	1.568	50	20	IDGD	
Cc1csc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)c1	1831782011	ICCIEEIJSGBNJZ-DYVFJYSZSA-N	431.352	1.910	50	20	IDGD	
Cc1onc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](C)CBr)C3)C2)c1C	1831972140	XQCROEGGBKWOCY-SGTLLEGYSA-N	444.326	1.392	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)CNc3ccc(F)cc3)CC2)CC1)[C@H](O)CCl	1833309057	KYYDATOWHHICPX-LJQANCHMSA-N	440.947	1.409	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cscn3)CCO2)C1	1834252510	GXYYGRHBHMVWQI-WBMJQRKESA-N	432.340	1.244	50	20	IDGD	
O=C(c1cnoc1C1CC1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1834617413	PSQWUTPMDNKYGZ-YOEHRIQHSA-N	446.273	1.313	50	20	IDGD	
C[C@H](C(=O)NC1CCN(C2CCN(C(=O)C(Cl)Cl)CC2)CC1)n1ccccc1=O	1835825098	TUYHQOBOHSIBMQ-CQSZACIVSA-N	443.375	1.785	50	20	IDGD	
CC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](N)Cc3cccnc3)CC2)CC1	1836393921	BTSWKRGDYQIAHD-PMACEKPBSA-N	436.000	1.540	50	20	IDGD	
Cc1nc(C(=O)N2CCOC[C@@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)sc1C	1837715236	DHMFOPAPKOFZOI-LJQANCHMSA-N	441.626	1.681	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccncc3Cl)CCO2)C1	1837890710	GKQWFCRWBVEUFW-CRAIPNDOSA-N	432.304	1.059	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC(OC2CCN(C(=O)c3ccnnc3O)CC2)CC1	1838429732	LGLQCZPOSPRMMP-UHFFFAOYSA-N	436.585	1.646	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)nn1C(F)F	1838703869	LQJFDQMGDJUYGP-LJQANCHMSA-N	448.898	1.922	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc4nccn34)CCO2)C1	1839549900	VIGQZFNRZNAGGI-HRAATJIYSA-N	434.924	1.812	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(OC)cc3F)C2)C1	1840154682	CMWHRYCCQPNRAI-UZLBHIALSA-N	444.887	1.158	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C)cc(OC)c3)C2)C1	1840155135	QTYDFFJZLPDKTM-GHTZIAJQSA-N	440.924	1.327	50	20	IDGD	
CCCCC[C@@H](C)C(=O)N1CCOC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1	1840185438	QEVADOUYIHVDGS-GCJKJVERSA-N	440.585	1.032	50	20	IDGD	
O=C(c1ccc2c[nH]nc2c1)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840187600	MQYLTYKNRWJDFX-SFHVURJKSA-N	427.288	1.437	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)c1ccccn1)CCO2	1840504056	FBAGJCPKBKNSMF-YZVOILCLSA-N	440.338	1.425	50	20	IDGD	
Cc1cc(F)ccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)Br)C2)C1	1840778648	FMZJUPMMJUUIGP-IFXJQAMLSA-N	443.313	1.988	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)C3CCSCC3)CCO2)C1	1840926328	JJZQTBMROVLDIW-DYVFJYSZSA-N	435.384	1.369	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC12CN(C(=O)C1(c3ccc(F)c(F)c3)CC1)C2	1843011900	IFQOURPXSHPLMA-UHFFFAOYSA-N	440.255	1.193	50	20	IDGD	
CC(=O)C[C@H](C)C(=O)N1CC2(CCCN2C(=O)c2cc([N+](=O)[O-])ccc2OC(C)=O)C1	1844693349	VJQUMNRIGMPBKD-ZDUSSCGKSA-N	431.445	1.952	50	20	IDGD	
CCOC(=O)c1c(CCC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](Cl)COC)c[nH]c1C	1847663341	MCBCBEJCCABAKU-ULQDDVLXSA-N	439.940	1.888	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)N1CCN(S(=O)(=O)c2ccc(C#N)cc2)CC1	9797114	ROGZSZPLJZJGMQ-UHFFFAOYSA-N	427.486	1.228	50	20	IDGD	
CS(=O)(=O)N1CCC(C(=O)NNC(=O)COc2ccccc2Cc2ccccc2)CC1	14260479	XRQPUMHRUNVFPK-UHFFFAOYSA-N	445.541	1.475	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)[C@@H]2CCCN(C(=O)Nc3ccccc3)C2)c2ccccc2c1=O	15856977	HTMGMCMPXAJUPV-OAHLLOKOSA-N	448.483	1.639	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)CSc2ccc(C(N)=O)cc2[N+](=O)[O-])cc1C	15886443	OMTNQDYZNAXTSL-UHFFFAOYSA-N	432.458	1.629	50	20	IDGD	
O=C(CCCCCNC1=NS(=O)(=O)c2ccccc21)NNC(=O)c1ccccc1O	17574777	GPDYBLXBURRKIX-UHFFFAOYSA-N	430.486	1.452	50	20	IDGD	
COc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)cc1	18103866	RIVIGPVIHYJQTA-HOTGVXAUSA-N	449.529	1.594	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)CCc2nc(-c3cccs3)no2)c2ccccc2c1=O	26546620	CWWQPFAAARWODJ-UHFFFAOYSA-N	438.469	1.922	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)CN2C(=O)N[C@](C)(c3ccc(F)cc3)C2=O)c1	26900670	OIHQKKAAGWIJRQ-OAQYLSRUSA-N	444.419	1.071	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)[C@@H]2CC(=O)N(Cc3ccco3)C2)c2ccccc2c1=O	28409164	JRGWSHPKHXZUBO-CQSZACIVSA-N	437.456	1.209	50	20	IDGD	
COc1ccc(-c2n[nH]c(=S)n2CC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1	105162693	IJALEYOCGVNJEB-MRXNPFEDSA-N	441.469	1.604	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2cccc(CN3CCOCC3)c2)c2ccccc2c1=O	110744624	YAHJEHVGDMMUOY-UHFFFAOYSA-N	435.484	1.323	50	20	IDGD	
CCCS(=O)(=O)Nc1cccc(C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c1	115604904	GMKYLFXGSDOEBY-UHFFFAOYSA-N	443.485	1.160	50	20	IDGD	
CC(=NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1)c1ccc(F)cc1	254834593	MNNBIIIWBSHMJA-UHFFFAOYSA-N	432.521	1.981	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)c1cnc(-c2ccc3c(c2)OCO3)s1	728474133	VOAKGICTWANVKR-UHFFFAOYSA-N	430.467	1.791	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNS(=O)(=O)c2csc(C(=O)O)c2)c1	728508796	ZXEKTHLOMBMZKM-UHFFFAOYSA-N	435.277	1.841	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2cccc(Br)c2N)n1	728727311	CCWGFLCBVFFNJM-UHFFFAOYSA-N	427.280	1.343	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)c1ccc(S(=O)(=O)NCc2cccs2)cc1	728893619	ZVKDXPYFKRSTTP-UHFFFAOYSA-N	430.511	1.625	50	20	IDGD	
CS(=O)(=O)N(c1cccc(C(=O)/C=C/c2cnn(CCCl)c2)c1)S(C)(=O)=O	729824125	XNAGDYITVGJMGJ-VOTSOKGWSA-N	431.923	1.744	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cccc(Br)c2O)c1	730104754	WMEBRVSRDJOGHE-UHFFFAOYSA-N	442.291	1.480	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)c1ccn(-c2cccc(Br)c2)n1	730179647	YQSUJNRVMCAGOA-UHFFFAOYSA-N	448.302	1.887	50	20	IDGD	
CC(C)(C(=O)NNC(=O)c1ccccc1S(=O)(=O)N1CCOCC1)c1ccccc1	731175517	ZBGWKOOGMVSJAX-UHFFFAOYSA-N	431.514	1.446	50	20	IDGD	
COC(=O)c1ccc(C(=O)OC)c(S(=O)(=O)NNC(=O)C(C)(C)c2ccccc2)c1	731177782	JIUWZERFLVSJCJ-UHFFFAOYSA-N	434.470	1.547	50	20	IDGD	
COc1ccc(N2CCN(CCNC(=O)NNC(=O)Cc3ccccc3F)CC2)cc1	731361709	UUECDMMBURUVKS-UHFFFAOYSA-N	429.496	1.529	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2sccc2S(=O)(=O)N(C)C)ccc1OC(C)C	732052035	JCHHPXNETVSBDC-UHFFFAOYSA-N	441.531	1.869	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)C3=NNC(=O)C3)c3ccccc3n2)cc1OC	732258760	HBWKGLDTTBGFNV-UHFFFAOYSA-N	433.424	1.556	50	20	IDGD	
COc1cc2cc(C(=O)NNC(=O)CCN3C[C@H](C)O[C@H](C)C3)[nH]c2c(OC)c1OC	732260567	GCXHTGFSDCCXFV-BETUJISGSA-N	434.493	1.454	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)NCCCNC(=O)c1ccc(F)cc1	732468446	QYXOVOZUHNJMCB-UHFFFAOYSA-N	433.396	1.263	50	20	IDGD	
CCc1nc([C@H](C)NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cs1	732476256	BUOOUYVXPJVZBX-ZDUSSCGKSA-N	439.563	1.726	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)[C@@H]2CCCN2S(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1	732932837	PVYNVTKFSPPMNR-SFHVURJKSA-N	446.485	1.772	50	20	IDGD	
CC(=O)N1CCCc2cc(S(=O)(=O)NNC(=O)c3cnn(-c4ccccc4)c3)ccc21	733122845	CTIUJUPZALLRRP-UHFFFAOYSA-N	439.497	1.795	50	20	IDGD	
COc1cc(CCNC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)ccc1O	734213399	ADFKVEAQHKNQGV-UHFFFAOYSA-N	441.532	1.486	50	20	IDGD	
CC(C)CN1C[C@H](C(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)CC1=O	734820948	BHIULAHUISYRQU-CQSZACIVSA-N	425.530	1.221	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)Cc2ccc(S(=O)(=O)C(F)F)cc2)c1	740647183	DXFQEGOHBDDFTB-UHFFFAOYSA-N	446.453	1.090	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2cnc(O)c(Br)c2)c2ccccc2c1=O	742034855	RFKOIEZPXVIHJL-UHFFFAOYSA-N	446.261	1.744	50	20	IDGD	
CN(CCCC(=O)NNC(=O)Cc1ccc(F)cc1)C1=NS(=O)(=O)c2ccccc21	742035632	UJYSTEFKRIYLEK-UHFFFAOYSA-N	432.477	1.377	50	20	IDGD	
CCS(=O)(=O)N1CCC[C@@H](C(=O)NNC(=O)NCc2cccc(C(F)(F)F)c2)C1	742448109	FWVMOWSGFQUVKE-CYBMUJFWSA-N	436.456	1.598	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1cn(Cc2cccs2)nn1	742479299	ZTGULAXGEJLMJZ-UHFFFAOYSA-N	433.519	1.064	50	20	IDGD	
O=C(NNC(=O)N1CC[C@@H](COCc2ccccc2)C1)c1csc(N2CCOCC2)n1	743509930	NGEQHIQCJPRBTN-QGZVFWFLSA-N	445.545	1.873	50	20	IDGD	
COc1ccccc1-c1noc([C@H](C)NC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)n1	743705730	UYUQJPWMKRLBBA-SJCJKPOMSA-N	439.428	1.977	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)c2ccc(S(N)(=O)=O)c(C)c2)cc1Cl	743834942	ZWNPTNCUWLCDSS-UHFFFAOYSA-N	442.881	1.780	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)[C@@H]2CC(=O)N(c3ccc(C)c(F)c3)C2)c1	744498944	ZCTNUHWQXKMHLA-MRXNPFEDSA-N	427.432	1.800	50	20	IDGD	
C[C@H]1Oc2c(cccc2C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)NC1=O	744619404	NHUREBHEOJNDMB-CYBMUJFWSA-N	446.485	1.184	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)c2nn(-c3ccccc3)c3c2CCC3)c1	744635783	VEXKVHKOVGYJDX-UHFFFAOYSA-N	429.436	1.851	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)N[C@H]2CCN(c3cc(C)nn3C)C2=O)cc1	745907094	YGOWEDPYQHJXFT-PBHICJAKSA-N	444.492	1.030	50	20	IDGD	
Cc1nnc(-c2ccc(C(=O)NNC(=O)c3ccc(Cl)c(S(N)(=O)=O)c3)cc2)o1	746098497	SKJROFYZNNVHRA-UHFFFAOYSA-N	435.849	1.421	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)[C@@]2(O)CCN(Cc3ccccc3)C2)c1	746214446	CLBFQTUICLJZSQ-HXUWFJFHSA-N	448.317	1.856	50	20	IDGD	
COc1cc2c(cc1CNC(=O)NNC(=O)COc1ccccc1[N+](=O)[O-])O[C@H](C)C2	746344708	IRBPKHUUBCPFGO-GFCCVEGCSA-N	430.417	1.836	50	20	IDGD	
CSCC[C@H](NC(=O)c1cccc(C)c1)C(=O)NNC(=O)Cc1cn2ccccc2n1	746641280	ONGYQCRTINQXKW-SFHVURJKSA-N	439.541	1.884	50	20	IDGD	
O=C(NNC(=O)c1ccccc1NS(=O)(=O)c1ccc(F)cc1)C(=O)N1CCCC1	748247522	QRALPHILMLDFPZ-UHFFFAOYSA-N	434.449	1.010	50	20	IDGD	
COc1cc(OC)cc(N2CC[C@H](NC(=O)NNC(=O)c3ccc4c(c3)OCCO4)C2)c1	748662459	SAIFPZUSYPSUPV-HNNXBMFYSA-N	442.472	1.698	50	20	IDGD	
COc1ccc([C@H](C)CC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1	749864909	CABCROQJRYDZLL-MRXNPFEDSA-N	433.530	1.965	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)N[C@@H]1CC(=O)N(c2cccc(C(F)(F)F)c2)C1	753034101	CSFKBZNLTOCDMJ-DGCLKSJQSA-N	432.399	1.193	50	20	IDGD	
CC[C@@H](NC(=O)NNC(=O)c1sc(-c2ccccc2)nc1C)C(=O)N1CCOCC1	753047279	QRXQTWRFSHJUMH-OAHLLOKOSA-N	431.518	1.700	50	20	IDGD	
COc1cc(OC)cc(C(=O)N2CCC(C(=O)NNc3cc(Cl)nc(N)n3)CC2)c1	753456789	DEIRQJDBNFPBLS-UHFFFAOYSA-N	434.884	1.725	50	20	IDGD	
N#C/C(=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)NC[C@@]1(O)CCOC1	755219240	QAAXHOQDCVUFOD-VYARXKNBSA-N	443.891	1.253	50	20	IDGD	
COC(=O)CNC(=O)Cc1ccc(NC(=O)NNC(=O)c2ccc(OC)cc2OC)cc1	755863609	OXLXYBHMMORDQS-UHFFFAOYSA-N	444.444	1.002	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@@H]2CCN(c3ncccc3F)C2)c2ccccc2c1=O	756151188	KUKXOFSNOLSYCZ-CYBMUJFWSA-N	439.451	1.173	50	20	IDGD	
COC(=O)c1cccc(NC(=O)C(=O)NNC(=O)CC(F)(F)F)c1Br	756154480	FLWQJYKSXTUDME-UHFFFAOYSA-N	426.145	1.274	50	20	IDGD	
NC(=O)CCOc1ccc(NC(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)cc1	756508311	HWCMNPADFHBXAX-UHFFFAOYSA-N	426.408	1.937	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)Nc1ccc(C[C@@H]2CC(=O)NC2=O)cc1	756815879	OSCXGKFXTHOWBZ-CQSZACIVSA-N	426.429	1.132	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N(C)CC[C@H](C)O)cc1	756959837	UWEDYTOSINSMBD-YSKWHIJTSA-N	425.489	1.570	50	20	IDGD	
COCCCS(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1	757823890	UFIKKNNIKQNDNW-GOSISDBHSA-N	449.485	1.490	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)Nc2c(C)nn([C@H]3CCS(=O)(=O)C3)c2C)c1	757871239	FWXFPTZUOLUTLN-INIZCTEOSA-N	449.533	1.708	50	20	IDGD	
Cc1ccc(CNC(=O)NNC(=O)C(=O)Nc2ccccn2)c(OC[C@@H]2CCOC2)c1	758847535	VKWHQMYTBSELPR-OAHLLOKOSA-N	427.461	1.274	50	20	IDGD	
CCc1ccc(S(C)(=O)=O)cc1C(=O)OCC(=O)NNC(=O)c1ccc(C#N)cc1	758938015	HHMXPFXVQBSOMG-UHFFFAOYSA-N	429.454	1.142	50	20	IDGD	
COCCS(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2c[nH]c3ccccc23)cc1	759261118	RUILLZKXGMAUMF-UHFFFAOYSA-N	430.486	1.732	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)C(C)(C)NC(=O)C(F)(F)F	760068053	YPMMRQDASLCSFE-MRVPVSSYSA-N	440.216	1.821	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)C(=O)Nc1ccnn1Cc1ccc(F)cc1	760279361	NDWTVQSLYWLRCX-UHFFFAOYSA-N	425.376	1.199	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccnn1-c1ccc(Cl)cc1	763446427	SONLACSBWUXZDZ-UHFFFAOYSA-N	428.792	1.834	50	20	IDGD	
Cc1nccn1-c1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2Br)cn1	763482754	KYVNHJBJYNUHOQ-UHFFFAOYSA-N	443.261	1.738	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc3ccccc3cc2O)cc1F	763526629	JQPFXHCIQCRSHL-UHFFFAOYSA-N	425.372	1.871	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cccc([N+](=O)[O-])c2C)cc(OC)c1OC	763540626	XIRUXSVFUVXCHV-UHFFFAOYSA-N	432.389	1.329	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(-n3cc(C)cn3)c(F)c2)cc1OC	763551938	VGLLMPCITCEILB-UHFFFAOYSA-N	441.419	1.737	50	20	IDGD	
COc1cccc(Cn2nccc2NC(=O)C(=O)NNC(=O)c2ccccc2F)c1OC	763568905	OWWBGZOVVGQNTR-UHFFFAOYSA-N	441.419	1.487	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)COc2cc(C)cc(C)c2)cc(OC)c1OC	763651275	ZUPRNKWUHLUCOV-UHFFFAOYSA-N	431.445	1.494	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)ccc1C(=O)NC(C)C	763807105	KJWLIYIRQGGLEK-UHFFFAOYSA-N	437.456	1.170	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)c1ccc(-c2noc(C(F)(F)F)n2)cc1	763814452	PSRUFGHUFDDNHY-UHFFFAOYSA-N	434.334	1.341	50	20	IDGD	
Cc1cc(C)n(-c2ccc(Cl)c(C(=O)NNC(=O)CNC(=O)c3cccnc3)n2)n1	763818648	NCIRKZGCLXDUTG-UHFFFAOYSA-N	427.852	1.124	50	20	IDGD	
C[C@H](c1ccccc1)n1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)n1	763844163	VQBBIIDJHBUQLJ-CQSZACIVSA-N	425.420	1.796	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)C(=O)Nc2ccccc2CN2CCNC2=O)cc1	763896339	LLCFRMLVSVSCKE-UHFFFAOYSA-N	441.513	1.398	50	20	IDGD	
O=C(Cc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1ccc(=O)n(Cc2ccccc2)c1	763932826	SLXXGTITKVJOAF-UHFFFAOYSA-N	438.871	1.879	50	20	IDGD	
O=C(NNC(=O)c1cc(Cl)ccc1O)C(=O)Nc1ccc(N2CCCC2=O)c(F)c1	763974644	UOZIPEUIAWUQGL-UHFFFAOYSA-N	434.811	1.711	50	20	IDGD	
CCOC(=O)c1cc(Br)ccc1NC(=O)C(=O)NNC(=O)c1cccn1C	763999108	NTRVJEGSNYHNSS-UHFFFAOYSA-N	437.250	1.364	50	20	IDGD	
Cc1ccnn1-c1ccccc1NC(=O)C(=O)NNC(=O)c1cc(Br)cn1C	764002176	JQIITSFLBDESSF-UHFFFAOYSA-N	445.277	1.681	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc(-n4cnnn4)c(C)c3)n[nH]2)cc1	764111753	PYHRLSTYGVYPLP-UHFFFAOYSA-N	445.443	1.069	50	20	IDGD	
COC(=O)N(C)Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)cc1	764125085	RCBRGMVLVXUIPC-UHFFFAOYSA-N	434.836	1.644	50	20	IDGD	
CCOC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)cc1C#N	764166557	CFGQKFHQHGYQBC-KRWDZBQOSA-N	437.412	1.216	50	20	IDGD	
CCc1cc(O)nc(-c2cccc(NC(=O)C(=O)NNC(=O)[C@H]3Cc4ccccc4O3)c2)n1	764166593	DLKGTAQFGIMZMV-GOSISDBHSA-N	447.451	1.501	50	20	IDGD	
O=C(Cc1ccccn1)NNC(=O)C(=O)Nc1cc(Br)ccc1N1CCCC1	764264275	OTGMSPSQAQUTSY-UHFFFAOYSA-N	446.305	1.773	50	20	IDGD	
NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(F)ccc2Br)c(F)c1	764270061	CYCWBFRMJSOSTN-UHFFFAOYSA-N	441.188	1.226	50	20	IDGD	
CC(C)Cn1ncc(NC(=O)C(=O)NNC(=O)COc2ccccc2O)c1C(F)F	764278147	SZBPLUQJACODRD-UHFFFAOYSA-N	425.392	1.347	50	20	IDGD	
Cc1cc(Br)c(NC(=O)C(=O)NNC(=O)c2c[nH]nc2C)cc1[N+](=O)[O-]	764295453	MKYVNOVMYCVFJP-UHFFFAOYSA-N	425.199	1.097	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)C(=O)Nc1ccc(C)c(NS(C)(=O)=O)c1)c1ccccc1	764327581	BXZOKLOHJHJGPP-MRXNPFEDSA-N	432.502	1.646	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)C(=O)Nc1cccc(S(=O)(=O)NC2CC2)c1)c1ccccc1	764327832	GDLUCTRTKJYZRV-GOSISDBHSA-N	444.513	1.407	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)c2cnn(C)c2)sc(C)c1C[C@@H](C)CC	764358421	CXQNEMBCQSBDSF-NSHDSACASA-N	449.533	1.955	50	20	IDGD	
C[C@@H]1Oc2ccc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc3ccccc3)cc2NC1=O	764380138	POIDNGJBQZVUOG-JTQLQIEISA-N	434.355	1.164	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1ccc(-c2nnc(C)o2)cc1	764393600	JEQTXWUAPIVOMK-UHFFFAOYSA-N	441.469	1.932	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1F)C(=O)Nc1cccc(-c2nnnn2C2CC2)c1	764410417	FWGSKLHVEYCFPC-UHFFFAOYSA-N	443.826	1.867	50	20	IDGD	
C[C@H](NS(=O)(=O)c1ccc(C#N)cc1)C(=O)NNC(=O)c1c(Cl)cccc1Cl	765412833	UUBXUAHUSITMFB-JTQLQIEISA-N	441.296	1.993	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)CNC(=O)c3cccc(F)c3)n[nH]2)cc1OC	765597657	WFJFSYVOJVQQFS-UHFFFAOYSA-N	441.419	1.424	50	20	IDGD	
CC(C)Cc1nc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cs1	765734462	ZGALKKAJVZTOGQ-UHFFFAOYSA-N	429.546	1.561	50	20	IDGD	
C[C@@H](Oc1ccc(F)c(F)c1)C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765738664	MECMRAAKMDYIJY-OAHLLOKOSA-N	446.454	1.338	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CCc2ccco2)cc1NC(=O)CCN(C)C	768240100	RTWZHQKYVGQOCM-UHFFFAOYSA-N	429.477	1.197	50	20	IDGD	
COc1ccc(NNC(=O)CC[C@H]2NC(=O)N(c3ccc(C#N)cc3)C2=O)c([N+](=O)[O-])c1	768339229	UQWWKXZJDSWYRY-MRXNPFEDSA-N	438.400	1.823	50	20	IDGD	
CC[C@H](C(=O)NN(C)C(=S)NCCCOC)n1nnc(-c2ccc(Cl)cc2)n1	768735421	LDIZJEXNOQCTMV-CQSZACIVSA-N	425.946	1.819	50	20	IDGD	
CC(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)c1	770240134	GEKNUFDBXUDHGZ-UHFFFAOYSA-N	439.515	1.739	50	20	IDGD	
COc1ccc(Cl)cc1N1CC[C@H](NC(=O)NNc2nc(O)c3cnn(C)c3n2)C1	770372152	QLGGWJDVOMCBCB-NSHDSACASA-N	432.872	1.636	50	20	IDGD	
COC(=O)N1CC(NC(=O)NNC(=O)[C@H]2Cc3ccccc3CN2Cc2ccccc2)C1	770427178	HBSOGTFZRRFAOP-HXUWFJFHSA-N	437.500	1.395	50	20	IDGD	
CCNC(=O)N(C)NC(=O)c1cc(S(=O)(=O)N2CCOCC2)c(Cl)cc1Cl	770542576	IZONXOYAJBZEQL-UHFFFAOYSA-N	439.321	1.320	50	20	IDGD	
COc1cccc(NC(=O)C(=O)NNC(=O)c2cc(Br)ccc2O)c1F	770770775	BZSXEJTXNSZHSU-UHFFFAOYSA-N	426.198	1.702	50	20	IDGD	
CCN1CCN(c2cccc(NC(=O)C(=O)NNC(=O)c3ccc(O)c(Cl)c3)c2)CC1	770772327	WSFDUINJTZBSAB-UHFFFAOYSA-N	445.907	1.587	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)c3n[nH]c(-c4ccccc4)c3Br)nc21	770972547	RRBCSBNIKOYSKM-UHFFFAOYSA-N	429.238	1.978	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)NCc1nc(COc2ccccc2)n[nH]1	771375101	DJPQAKWPYCHCTB-UHFFFAOYSA-N	426.433	1.302	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)N[C@@H]2CCO[C@]3(CCOC3)C2)c2ccccc2c1=O	771432500	ASHZXGWNWQBCRO-IVZQSRNASA-N	443.504	1.479	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)CS(=O)(=O)Cc1ccc(C#N)cc1	772994708	LFRSLWWZXLOJKG-CYBMUJFWSA-N	435.889	1.741	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NC[C@H]1COC2(CCCCC2)O1	775715214	UNGZRUPRVDMCLU-AWEZNQCLSA-N	439.538	1.308	50	20	IDGD	
O=C(Cc1ccc2ccccc2c1)NNC(=O)Nc1ccnn1[C@@H]1CCS(=O)(=O)C1	776055397	JBYHFWUVKANMLA-QGZVFWFLSA-N	427.486	1.791	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)N[C@@H](Cc2ccccc2)CN2CCOCC2)c1	776625714	YBSJLPPDIXLXSW-IBGZPJMESA-N	432.546	1.660	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)N[C@H]1CCN(c2ccc(F)c(Cl)c2)C1=O	777752692	PHKJWTXWLKYQPV-AWEZNQCLSA-N	436.827	1.699	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccc(CNC(=O)OC(C)(C)C)cc2)n1	778707772	QEDXEXJZNLWFRG-UHFFFAOYSA-N	444.492	1.311	50	20	IDGD	
Cc1ccc2nc(-c3ccc(NC(=O)C(=O)NNC(=O)C(=O)NC4CC4)cc3)sc2c1	782966323	MFDFWSRELGQATN-UHFFFAOYSA-N	437.481	1.636	50	20	IDGD	
CC(=O)Nc1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)cc1C	783262009	AHJIKMAKTMCNRK-UHFFFAOYSA-N	448.505	1.117	50	20	IDGD	
CC(=O)c1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)cc1C	783265753	WYJGLYMZMQWUPU-UHFFFAOYSA-N	433.490	1.361	50	20	IDGD	
Cc1cc(Oc2ccccc2)ccc1NC(=O)C(=O)NNC(=O)CNC(=O)c1ccco1	784002930	XOMJPFAASGJLID-UHFFFAOYSA-N	436.424	1.896	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNc2cccc(S(C)(=O)=O)c2)cc1F	784841818	SLQNZIRVDQLEAL-UHFFFAOYSA-N	425.438	1.336	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)cn1	785099282	CMFFFFAJQYGHDG-UHFFFAOYSA-N	449.414	1.359	50	20	IDGD	
CC(C)OCCCn1c(NNC(=O)[C@@H]2CCC[C@@H](C(N)=O)C2)nc2ccccc2c1=O	786979245	KNAFUCVKSGZTEP-HZPDHXFCSA-N	429.521	1.946	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cccnc3C(F)(F)F)CC2)cc1	788591344	QXEFCSCZFPJVBE-UHFFFAOYSA-N	435.450	1.988	50	20	IDGD	
Cc1cc(-n2cccn2)ccc1NC(=O)C(=O)NNC(=O)c1cc(Br)cn1C	789584969	UDSYGNQMWVCCOT-UHFFFAOYSA-N	445.277	1.681	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)[C@@H]2COCCN2C2CCCC2)c2ccccc2c1=O	789939927	RQITZIVXDCUGCF-SFHVURJKSA-N	427.505	1.211	50	20	IDGD	
O=C1CN(S(=O)(=O)c2cccc(C(=O)NNc3cc(Cl)cc(Cl)c3)c2)CCN1	791719340	WDGHVFFWUKOSBJ-UHFFFAOYSA-N	443.312	1.871	50	20	IDGD	
CNC(=O)c1cc2cc(NC(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)ccc2[nH]1	791917932	DPKHBBXDDHALEB-UHFFFAOYSA-N	433.428	1.241	50	20	IDGD	
COc1c(NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)cc(Cl)cc1C(N)=O	793022135	PJOKEJNRQDNJIL-UHFFFAOYSA-N	441.227	1.206	50	20	IDGD	
CC(C)(C(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12)N1CCOCC1	801103622	KGFZEAPOJROAIW-UHFFFAOYSA-N	449.511	1.317	50	20	IDGD	
CNS(=O)(=O)c1ccc(C(=O)NNC(=O)Nc2cc(OC)c(Cl)cc2OC)cc1	802081627	XBARYYOCFQVGKJ-UHFFFAOYSA-N	442.881	1.732	50	20	IDGD	
NC(=O)CS(=O)(=O)c1ccc(C(=O)NNC(=O)Nc2ccc(Cl)cc2Cl)cc1	802090364	GCAVPOKJKHXZOW-UHFFFAOYSA-N	445.284	1.719	50	20	IDGD	
COc1cccc(NNC(=O)C2(S(C)(=O)=O)CCN(C(=O)OC(C)(C)C)CC2)n1	803081714	ZRGBECLFIHLBGV-UHFFFAOYSA-N	428.511	1.348	50	20	IDGD	
CC1(C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)CCN(c2ccc(Cl)cc2C#N)CC1	804185148	VVDRQLCGRMHBOJ-CYBMUJFWSA-N	438.937	1.400	50	20	IDGD	
O=C(Cn1ncn2nccc2c1=O)NNc1ccc(-c2cccc(C(F)(F)F)c2)nn1	804209201	PVHJLAIGWRWIHK-UHFFFAOYSA-N	430.350	1.510	50	20	IDGD	
O=C(NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1)c1cnn(CCF)c1	806344763	LSGWEQPPGURDIK-UHFFFAOYSA-N	437.478	1.790	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)c1ccc(C(F)(F)F)cc1N1CCCC1	807082390	PHGQYSQCAWQJSR-UHFFFAOYSA-N	435.406	1.892	50	20	IDGD	
C[C@@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(NC(=O)C(=O)NNc3cccc(F)n3)cc2)C1	807392478	QAHBZPIICMEIPT-ZIAGYGMSSA-N	449.508	1.969	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)N2CCC[C@H](CNS(=O)(=O)C3CC3)C2)c1C	807900229	UTFYKIDKNRGZDP-BDBXIWDTSA-N	448.589	1.979	50	20	IDGD	
O=C(NNC(=O)N1CC[C@@]2(CCc3ccccc3O2)C1)C1CCN(c2ncccn2)CC1	811874213	JTCSQHOZLBZGLB-QHCPKHFHSA-N	436.516	1.904	50	20	IDGD	
O=C(COC(=O)c1nn(-c2ccccc2)c2c1CCC2)NNC(=O)c1ccc([N+](=O)[O-])cc1	812845568	JAGRLNFDDYGIJI-UHFFFAOYSA-N	449.423	1.887	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc3c(C)nn(C)c3c2)cc1	812979159	KGRJCOWCGNABJO-AWEZNQCLSA-N	437.456	1.638	50	20	IDGD	
COC(=O)c1cn(-c2cccc(NC(=O)NNC(=O)[C@H](C)Oc3ccccc3F)c2)nn1	812979351	PNEOVZQPEAPGES-LBPRGKRZSA-N	442.407	1.813	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccc3c(C)nn(C)c3c2)cc(OC)c1OC	812980417	UDTUCGVMEGPHGY-UHFFFAOYSA-N	441.444	1.307	50	20	IDGD	
Cc1cn(-c2ccccc2)nc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	813033899	QLLDYKGWXFAKIX-UHFFFAOYSA-N	442.501	1.513	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2nnn(CCOc3ccc(F)cc3)c2C)nc1	815579294	JQSRXTIXOWEQHX-UHFFFAOYSA-N	429.412	1.290	50	20	IDGD	
CC(=O)N[C@H](CC(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)c1cccs1	829359573	LWLCWGNOHGZEGW-CQSZACIVSA-N	434.430	1.228	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(F)c(C(=O)NNC(=S)NCCc2cccs2)c1	838833740	PZYUCHBQAXAWAR-UHFFFAOYSA-N	430.552	1.489	50	20	IDGD	
Cc1ccc([C@@]2(C)NC(=O)N(CC(=O)NNC(=O)COc3ccccc3F)C2=O)cc1	864020227	LCHUSELBYAWRPK-OAQYLSRUSA-N	428.420	1.128	50	20	IDGD	
CSC[C@H](C(=O)NNC(=O)c1cccc(N(C)C)c1)N1C(=O)[C@H]2CCCC[C@@H]2C1=O	904225087	SUTHOSAMEMXFDJ-YESZJQIVSA-N	432.546	1.420	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)C2CCN(C(=O)/C=C\c3ccccc3)CC2)C[C@@H](C)O1	912921733	UQXLQCOJCDDLCD-HCRJECLASA-N	442.560	1.585	50	20	IDGD	
CCc1ccccc1OCC(=O)NNS(=O)(=O)c1cc(S(C)(=O)=O)ccc1Cl	914564462	HQNLZJMBBCZWGK-UHFFFAOYSA-N	446.934	1.694	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2ccc(F)c(S(=O)(=O)NC(C)C)c2)cc1OC	914709865	YKZZNMRDGNEWSA-UHFFFAOYSA-N	439.465	1.604	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCCCN(C)Cc2ccccc2)nc1	916196643	BREZORIDQNSLSU-UHFFFAOYSA-N	434.566	1.917	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)NCc2ccc(C(=O)N3CCOCC3)cc2)c1	916247922	VHPZOLMORZNTMD-UHFFFAOYSA-N	425.489	1.369	50	20	IDGD	
CCn1nc(C(=O)NN=C(C)c2ccc(S(=O)(=O)N(C)C)cc2)c2ccccc2c1=O	916316256	PNANGKJFZSPSOM-UHFFFAOYSA-N	441.513	1.821	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2ncc(-c3ccccc3)o2)c1	916625181	BUAOZOFZJUDQEH-UHFFFAOYSA-N	443.485	1.736	50	20	IDGD	
O=C(NCc1cc(-c2ccccc2)no1)NNC(=O)c1csc(N2CCOCC2)n1	916636266	YMKKFUXTSAHRMQ-UHFFFAOYSA-N	428.474	1.779	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)N[C@@H]1CCN2CCCC[C@@H]12	916638465	GWADOXWYEHNLNJ-MOPGFXCFSA-N	449.577	1.432	50	20	IDGD	
COC1(C(=O)NNC(=O)c2ccc3c(c2)OCCO3)CCN(C(=O)OC(C)(C)C)CC1	917975231	MTPRCINUAVCRRH-UHFFFAOYSA-N	435.477	1.635	50	20	IDGD	
CCS(=O)(=O)N1CCC[C@H](C(=O)NNC(=O)c2sc(-c3ccccc3)nc2C)C1	918552000	SFJMBPFLXWZUAR-HNNXBMFYSA-N	436.559	1.941	50	20	IDGD	
O=C(CSCc1ccc(Cl)cc1Cl)NNC(=O)N[C@@H]1CCS(=O)(=O)C1	919889365	YIDRXWLZNDQVGR-LLVKDONJSA-N	426.347	1.744	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)Nc2cccc(CN3CCC[C@H]3C(N)=O)c2)c1	920932948	WYYJRKRBFWVFCY-IBGZPJMESA-N	425.489	1.676	50	20	IDGD	
O=C(CCC/N=C1/NS(=O)(=O)c2ccccc21)NNc1cncc(Br)c1	1116389555	GJWSXWPQCLAQLU-UHFFFAOYSA-N	438.307	1.806	50	20	IDGD	
CNC(=O)c1cc(Cl)cc(S(=O)(=O)NNC(=O)c2ccc(OC)cc2)c1OC	1117106065	NILXNZUBWAOEJL-UHFFFAOYSA-N	427.866	1.340	50	20	IDGD	
CNS(=O)(=O)c1ccc(CC(=O)NNc2nc(Br)cn3ccnc23)cc1	1321069874	GJYCSFGXLNRXRF-UHFFFAOYSA-N	439.295	1.086	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)[C@H]2CC(=O)N(C)c3ccccc32)cc1OC	1328227277	ZOJAMFDLQXRAGO-HNNXBMFYSA-N	441.440	1.158	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)Cc2ccc(S(=O)(=O)CCO)cc2)c2ccccc2n1	1339846526	MRWOWYFFFYIICW-UHFFFAOYSA-N	427.482	1.313	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCCNS(=O)(=O)c2ccc(Cl)cc2F)cc1	1339874623	LCQZSIGTXBTLHN-UHFFFAOYSA-N	444.872	1.410	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(Cl)Cl)C2)c1nc2ccccn2n1	1777816407	NTYAMDHCEZIXPZ-KZULUSFZSA-N	426.304	1.661	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)Cc2cnc[nH]2)C1	1777995999	NIUVHRZGMCWNBH-HDMKZQKVSA-N	427.343	1.640	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccn3c(O)nnc13)C2)[C@@H](F)Cl	1778025902	HZMRWIZTWDTVMY-SNUQEOBHSA-N	425.848	1.097	50	20	IDGD	
O=C(c1cc2cc(F)c(F)cc2[nH]1)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1778400484	XNZJZAYDSSQDMM-VQIMIIECSA-N	427.835	1.489	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc4ncccn4n3)C2)C1	1778462115	XTBNABHNPMKFBR-UGSOOPFHSA-N	436.310	1.204	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4ncncc4c3)C2)C1	1778602395	UCAPDBZPHFQARC-NRFANRHFSA-N	428.565	1.925	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)/C=C/C(=O)NCc3ccco3)C2)C1	1779207086	UJPZUUVIWXMGNH-YAQIIAKESA-N	437.924	1.547	50	20	IDGD	
CC(=O)Nc1ccccc1C(=O)N1CCO[C@@]2(CCN(C(=O)CO[Si](C)(C)C)C2)C1	1779300178	PPENQUPOAIXEKQ-OAQYLSRUSA-N	433.581	1.940	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)c3cccc4ccoc34)C2)C1	1782451225	GPGSHCOWQIDLIA-QFIPXVFZSA-N	428.489	1.249	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)/C=C/c3cc(C)on3)CCO2)C1	1783349934	WKMXIBDWDFAABP-PUBSZHEZSA-N	426.311	2.000	50	20	IDGD	
CCc1[nH]nc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](C)Br)C3)C2)c1Cl	1783532670	MICWNGGOCZJYBE-MGPLVRAMSA-N	433.734	1.852	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)Cc3ccc(NC(C)=O)cc3)CCO2)C1	1783875820	UEQZFQDPNDRNSA-RXVVDRJESA-N	437.924	1.271	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)c1ccccc1Cl)CCO2	1783878196	BSBSAMNDNVCNNJ-GPMSIDNRSA-N	431.316	1.457	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cccc(C(=O)N(C)C)c3)CCO2)C1	1783883914	MWGLLHBBGJWKAT-LAUBAEHRSA-N	437.924	1.086	50	20	IDGD	
C[C@H](Oc1ccccn1)C(=O)N1CC[C@]2(CN(C(=O)CCBr)CCO2)C1	1784486659	PONLEUSWYLJODM-KSSFIOAISA-N	426.311	1.464	50	20	IDGD	
CC(C)N1CCC(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Br)C[C@@H]32)CC1	1784997402	YWVNOUKMXZTVRL-LUKYLMHMSA-N	448.377	1.777	50	20	IDGD	
CC(C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)[C@H]2C1	1785075336	HHMNUEWVPUXXSJ-VGWMRTNUSA-N	431.961	1.754	50	20	IDGD	
COc1cc(C(=O)Nc2ccc(C3(NC(=O)c4ccc(B(O)O)cc4)CCC3)cc2)n(C)n1	1787066244	OZEIFNLHDHTRPA-UHFFFAOYSA-N	448.288	1.170	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CSc3ncccn3)[C@H]2C1	1787077142	NUDRXJCMPICXJS-RFGFWPKPSA-N	443.367	1.332	50	20	IDGD	
COc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]3C2)c([N+](=O)[O-])cc1O	1787448156	VPBYKJZKESWGCN-PVYXACFKSA-N	445.831	1.437	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)[C@@H]3SC(=N)NC3=O)[C@H]2C1	1787492486	FQZGPTGPPLAXEA-XZBVAUNFSA-N	444.985	1.176	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21)c1cccc2c1OCCO2	1787946095	ZKJNNSJSZONZLO-WHOFXGATSA-N	429.300	1.855	50	20	IDGD	
COC[C@H](Cl)C(=O)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1	1788149463	VKJIVNBCQMSMTO-SFHVURJKSA-N	430.697	1.368	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(NC(C)=O)o3)[C@H]2C1	1788608805	SDNCWHJIOQQAOO-YXWQFLTLSA-N	427.885	1.085	50	20	IDGD	
CN1CCC[C@H]1C(=O)NC1(c2ccc(NC(=O)c3cnccc3C(=O)NN)cc2)CCC1	1789520008	ZYESDPJBKGIHEQ-IBGZPJMESA-N	436.516	1.527	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CNC(=O)c3cccs3)C[C@@H]21	1789858670	IOVVEEOAVKBLES-XQLPTFJDSA-N	427.954	1.475	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3ccc(O)nn3)C[C@@H]21	1789872665	YBXWCENFVBKHHZ-VFSPDHHESA-N	445.347	1.331	50	20	IDGD	
CC1CCN(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]3C2)CC1	1789921413	HELIKAOBPJCVAS-JKQORVJESA-N	434.350	1.389	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)c1ccc(NC(=O)C2CC2)cc1	1789989338	NTECVJUMYRXHNS-KANFNMMFSA-N	449.935	1.228	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)CBr)C[C@@H]21	1791055246	QANRDALNQFPLGS-MOLYVOAJSA-N	440.176	1.781	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cc4ccccc4n3C)C[C@@H]21	1791249283	HGNJHMSIZHTRRQ-WBKMXMRLSA-N	447.963	1.954	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)nc(Cl)c3)C[C@@H]21	1791252217	DRGALXUDSCVUAD-DEQVHRJGSA-N	432.304	1.288	50	20	IDGD	
Cn1cnc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]3C2)c1C(F)(F)F	1791295423	FYQLIUQYRWNRMY-GUBZILKMSA-N	443.253	1.836	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3CCc4nc[nH]c4C3)[C@H]2C1	1791530484	UOJZHRQGUFPVKI-DEEHTKSCSA-N	439.354	1.278	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc(F)cn1)C2	1792867483	CHLNFYKGQWHWFA-KOFHJDLBSA-N	428.302	1.384	50	20	IDGD	
CSCC(C)(C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2	1793406996	AJIBUTBDRLRLNO-AMFOTSNXSA-N	449.577	1.099	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccnc(C(F)(F)F)c1	1794545938	HZHNRLNTTOYDQW-QVHKTLOISA-N	435.830	1.557	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN(C)C(=O)OC(C)(C)C	1795339791	LVBJMYKSNORFCF-XPCVCDNBSA-N	448.358	1.226	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1noc2ccccc12)c1ccc(B(O)O)cc1	1796214527	WRSBSORPMFFBQP-BCDXTJNWSA-N	433.273	1.002	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)Nc1ccccn1	1797976389	MLPACWIUUKFCON-XGYYKPKNSA-N	439.354	1.645	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(O)c(F)c1)C2	1798441648	BPNFTDKWMHISSY-BTTYYORXSA-N	427.436	1.095	50	20	IDGD	
Cc1onc(-c2ccncn2)c1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2	1798490874	URQOKFOZZIVKJA-GNXNZQSNSA-N	440.287	1.447	50	20	IDGD	
CN(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C#CC1CC1)C2)NC(=O)NCc1ccccc1	1799865899	PKSUHROZDZSLOW-WKCHPHFGSA-N	437.544	1.384	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(CS(C)(=O)=O)nc1)C2	1800070623	OVWQJFOIHICDFB-YYIAUSFCSA-N	427.954	1.895	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cc(C)n(C)n1)C2	1800637963	KYPDGSFCSWKWHQ-YXPYIKCWSA-N	427.343	1.034	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCCC(=O)OC(C)(C)C)C2	1800971274	SXEWBBDXARFVCS-KRXQYRFLSA-N	432.945	1.342	50	20	IDGD	
CC(=O)NCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](Br)Cc1ccccc1)C2	1801661575	ZKVLBNWQCRTNTH-XMTFNYHQSA-N	436.350	1.767	50	20	IDGD	
CC[C@@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](O)NC(=O)OC(C)(C)C)C2	1801803813	NULOMFOGYGSKRV-WPLOAARJSA-N	448.358	1.641	50	20	IDGD	
COC(=O)[C@@H]1CC[C@H](C(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)C1	1803130485	QSDPXOIFJUCDAP-YFUQURRKSA-N	437.924	1.276	50	20	IDGD	
O=C(/C=C/c1ccc([N+](=O)[O-])o1)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1	1803260187	NUNRIUGYCHRBML-JAETUBNISA-N	448.863	1.902	50	20	IDGD	
CC(C)(C)OC(=O)CC(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1	1803896764	RVSZJUATMQJJSZ-RLFYNMQTSA-N	425.913	1.419	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)CN2C(=O)CNC2=O)[C@H]1c1cccnc1	1804086773	ATEVGGKLWJYCRC-RVKKMQEKSA-N	435.912	1.047	50	20	IDGD	
CC(C)(C)OC(=O)NCC(C)(C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](O)CCl)C2	1804619760	MWQIXXNDCHIJSM-LXTVHRRPSA-N	431.961	1.775	50	20	IDGD	
CC(=O)NC(C)(C)C(=O)N1CC[C@@H](CNC(=O)CCBr)[C@H]1c1cccnc1	1806341705	FGLUAQOZZIHGIM-DOTOQJQBSA-N	439.354	1.787	50	20	IDGD	
COC(=O)NCC(=O)N1CC[C@@H](CNC(=O)CCBr)[C@@H]1c1cccnc1	1806347076	SGFGRODXBWCSDV-BBRMVZONSA-N	427.299	1.228	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)Cc2cscn2)[C@H]1c1cccnc1	1807496880	AZCXRGRBFFRANN-IIBYNOLFSA-N	444.561	1.160	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)[C@@H](N)Cc2cccnc2)[C@@H]1c1cccnc1	1808362595	GXIYUBOCCODDLO-MUGJNUQGSA-N	445.951	1.306	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)c2cnco2)[C@H]1c1cccnc1	1808408730	JPEBMINTWPOWBF-YRJCQSRDSA-N	449.471	1.523	50	20	IDGD	
C[C@H](C(=O)NC[C@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1)n1ccnn1	1812397027	YDBYCEJUSRBDRQ-UNEWFSDZSA-N	435.326	1.725	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)c2ncn(C)n2)[C@H]1c1cccnc1	1812774825	IGNXOUZNIXILTK-KKUMJFAQSA-N	435.326	1.703	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2cc(=O)ccn2C)[C@@H]1c1cccnc1	1813032246	VZKZONJZPSOUIG-HHXXYDBFSA-N	432.908	1.354	50	20	IDGD	
CCc1ncccc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1816162070	BUAWRTPZNVBEHE-FQEVSTJZSA-N	447.304	1.667	50	20	IDGD	
C#CCCC(=O)N[C@@H]1CCc2nc(NC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)sc2C1	1817284427	JUIRFEGRVYVDDD-CJCQAYSXSA-N	426.502	1.603	50	20	IDGD	
C=CCOCCCC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1	1817474455	ROYOBROXTFUADC-IBGZPJMESA-N	440.309	1.378	50	20	IDGD	
Cc1ncc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2ccc(B(O)O)cc2)CC3)s1	1817889802	RUDMUXOTLMARSI-CYBMUJFWSA-N	442.331	1.127	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)C2=CCCS2)[nH]n1	1819401447	BMWJKMFSGATVHI-HNNXBMFYSA-N	441.517	1.735	50	20	IDGD	
CCc1cc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@H](Cl)COC)CC3)n(C)n1	1820636485	LEBZJVUWXXMVSV-NWDGAFQWSA-N	425.942	1.919	50	20	IDGD	
Cc1nscc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1	1822413540	ZCHJQUCUYOOXMF-HNNXBMFYSA-N	433.538	1.854	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H]3CC=CCC3)sc2C1	1822790661	FLFHRNSOQZFKBK-QWHCGFSZSA-N	440.529	1.724	50	20	IDGD	
CC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)Cn1cc(C)c(O)nc1=O)CC2	1822858095	WHDPHIUWMVPDQS-MNOVXSKESA-N	439.925	1.343	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCN1CCOCC1)CC2	1825999983	ZIWDIRFSVDBABI-CHWSQXEVSA-N	430.958	1.031	50	20	IDGD	
O=C1C[C@H](C(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@H](F)Br)CC3)CCN1	1826222517	ZYKNZBCHMVLTNW-RWYTXXIDSA-N	433.303	1.272	50	20	IDGD	
O=C([C@H]1CCCS1(=O)=O)N1CCC([C@@H]2CCCCN2C(=O)CCBr)CC1	1826359787	OMVHEDWBZIFEHQ-JKSUJKDBSA-N	449.411	1.968	50	20	IDGD	
Cc1nccnc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827058308	XWROXIGRQTUTKU-HXUWFJFHSA-N	436.321	1.012	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1	1827428954	MNNRZBFUPIZSMU-CVEARBPZSA-N	425.913	1.980	50	20	IDGD	
Cc1ccncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1	1827898793	COLHYYWILKAZCD-QFIPXVFZSA-N	435.333	1.617	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H](O)c3ccco3)CCO2)C1	1829828268	BSAWWUSBCOKSMI-JCGIZDLHSA-N	435.304	1.006	50	20	IDGD	
N#Cc1ccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)cc1	1830013077	QGBXFMNCPINJLE-HSZRJFAPSA-N	445.328	1.785	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CN2CC(=O)NC2=O)CC1	1830313847	ORHYWXNIUUYIFZ-LIRRHRJNSA-N	447.363	1.394	50	20	IDGD	
CC(C)=NO[C@H](C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1	1830416118	QNOPIEKAJHAAQW-UTKZUKDTSA-N	443.353	1.401	50	20	IDGD	
O=C(CCCc1ccccc1F)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1	1830692399	XWBIMFYOHIELJX-WIYYLYMNSA-N	442.915	1.205	50	20	IDGD	
O=C([C@@H](F)Cl)N1CCC([C@@H]2CCCCN2C(=O)Cn2cccc([N+](=O)[O-])c2=O)CC1	1831186719	BXNRQCUSGYPXRV-WMLDXEAASA-N	442.875	1.911	50	20	IDGD	
O=C([C@H](F)Cl)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CC(c3ccccc3)=NO1)CCO2	1831254131	FWDCHXHCYCDFFJ-FUHIMQAGSA-N	439.871	1.170	50	20	IDGD	
O=C([C@@H](F)Cl)N1CCOC[C@]2(C1)CN(C(=O)C13CC(C(F)(F)F)(C1)C3)CCO2	1831701242	CTUAUYQPLPQMKA-MGXDSONQSA-N	428.810	1.710	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3ccco3)CCO2)C1	1833052754	WRXAHPXAMIZSQX-LPHOPBHVSA-N	443.338	1.842	50	20	IDGD	
C[C@H](CC(N)=O)C(=O)NC1CCN(C2CCN(C(=O)[C@@](C)(Cl)CCl)CC2)CC1	1833521978	DNDVKSIBTXCBCS-YJYMSZOUSA-N	435.396	1.306	50	20	IDGD	
COC[C@H](C)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)CBr)CC2)CC1	1833522979	IKLPRZBQXSUTDZ-GJZGRUSLSA-N	432.403	1.872	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)cn1	1833999427	MXBRCNDHELZCTQ-WMLDXEAASA-N	430.274	1.151	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@H]1C(=O)N1CCC(N2CCC(NC(=O)[C@@H](F)Cl)CC2)CC1	1835083929	ZUTGQDLZADUQBR-KZNAEPCWSA-N	443.947	1.848	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](CN)c3ccccc3)CCO2)C1	1835813477	QLPPIEUAMLIUOS-GCJKJVERSA-N	437.968	1.450	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3nccc4occc34)CCO2)C1	1836295360	JANLLKVWNYUHAX-FOIQADDNSA-N	437.880	1.152	50	20	IDGD	
Cc1nc(CC(=O)N2CCC(OC3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)cs1	1836715131	JXPRHPRTYNCSBC-KRWDZBQOSA-N	429.970	1.592	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnc4[nH]ncc4c3)CCO2)C1	1836807730	CKTOFWBFBFLFSA-UZLBHIALSA-N	435.912	1.435	50	20	IDGD	
O=C(NCC(=O)N1CCC(OC2CCN(C(=O)[C@@H](F)Cl)CC2)CC1)c1cccnc1	1837122509	ATDWMSBDLPKUJL-GOSISDBHSA-N	440.903	1.344	50	20	IDGD	
Cn1cnc(C(=O)N2CCC(OC3CCN(C(=O)[C@H](F)Br)CC3)CC2)c1	1837549827	WWOWMMKAAHDRHX-HNNXBMFYSA-N	431.306	1.723	50	20	IDGD	
O=C(c1cc(O)n[nH]1)N1CCC(OC2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1837902973	TUZMXVMCDCFODO-CQSZACIVSA-N	433.278	1.418	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(OC2CCN(C(=O)C3CC3)CC2)CC1	1838102726	LFDDZCSWEFTVCK-BUVRLJJBSA-N	429.521	1.529	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)CNC(C)=O)CC2)CC1	1838752662	TTXNNFMOETWKJW-MRXNPFEDSA-N	432.359	1.295	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)Cc3cnn(C)c3)CC2)CC1	1838773495	JVUJPMZDIFUPEH-AWEZNQCLSA-N	441.370	1.745	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(C)c(OC)c3)CCO2)C1	1838988888	UITBCHLLOQSXTJ-DYESRHJHSA-N	440.924	1.327	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(OC)cc(OC)c3)C2)C1	1839146072	JLYYJHBNUOFJJL-RXVVDRJESA-N	440.924	1.791	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(C)cc3F)CCO2)C1	1839260927	LKKKGQPMLGFTET-JXFKEZNVSA-N	428.888	1.458	50	20	IDGD	
C#CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](Br)Cc1ccccc1)CCO2	1839802257	PUGOZDKUONVEQE-YLJYHZDGSA-N	435.318	1.082	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)(Cl)Cl)CCO2	1839923267	VRUOCORZSOFZKO-GXFFZTMASA-N	438.135	1.067	50	20	IDGD	
COc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)s1	1840031498	RUPAOQYMYKUCDZ-SJCJKPOMSA-N	447.351	1.610	50	20	IDGD	
CCOc1ccccc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](Cl)COC)CCO2	1840154199	PCHPVUIAZFXMAU-UTKZUKDTSA-N	440.924	1.409	50	20	IDGD	
CN(C)c1cncc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)c1	1840186867	WQRAMUOMJWSSDB-SFHVURJKSA-N	431.320	1.021	50	20	IDGD	
Cc1cccc(F)c1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)Br)C2)C1	1840651984	FADMSTALXSSXSX-KUHUBIRLSA-N	443.313	1.988	50	20	IDGD	
COc1ccc([C@@H](O)C(=O)N2CCCC23CN(C(=O)[C@H](C)CBr)C3)cc1	1841181828	NHPOUYHNCLKLNK-CZUORRHYSA-N	425.323	1.963	50	20	IDGD	
COc1ccc(Cl)cc1CC(=O)OCC(=O)NNC(=O)c1ccc(OC)c(OC)c1	24220328	WXGZOODCTZAYGM-UHFFFAOYSA-N	436.848	1.913	50	20	IDGD	
Cc1nnc(SCC(=O)NNC(=O)c2ccc3c(c2)OCCO3)n1Cc1ccccc1	105365883	QNKVFFLSSHTVPC-UHFFFAOYSA-N	439.497	1.959	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCCC[C@H]2CNC(=O)Nc2ccccc2)n1	105948092	FPGZIIAXISAKDR-KRWDZBQOSA-N	444.561	1.818	50	20	IDGD	
C[C@H](C(=O)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1)N1CCN(C)CC1	725895206	VPPWTYGXHUAANG-XXBNENTESA-N	435.572	1.397	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2c[nH]c3ccccc23)c(C(=O)OC)s1	726520126	YYBKRZXWTYBILQ-UHFFFAOYSA-N	437.455	1.426	50	20	IDGD	
CCn1cc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)ccc1=O	726871397	OZKGOKIHLNFHFE-UHFFFAOYSA-N	447.517	1.509	50	20	IDGD	
COc1ccc(-c2nnc(SCC(=O)N([C@@H]3CCS(=O)(=O)C3)N(C)C)o2)cc1	728179679	NSSJNMASVRLQTH-CYBMUJFWSA-N	426.520	1.330	50	20	IDGD	
O=C(COC(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12)NNC(=O)[C@@H]1COc2ccccc2O1	728340681	MEABJTQJQHAICN-KRWDZBQOSA-N	440.368	1.220	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1	728527383	HLEYTBBALIUMJZ-UHFFFAOYSA-N	434.294	1.925	50	20	IDGD	
CC(C)CN1CCO[C@@H](CNC(=O)NNC(=O)c2cc(F)ccc2Br)C1	728741627	RXQIOXWRBYODKY-ZDUSSCGKSA-N	431.306	1.889	50	20	IDGD	
CC(=NNC(=O)Cc1cccnc1)c1ccc(S(=O)(=O)N2CCCC[C@H]2C(=O)O)cc1	728784247	CWODFOBPKXQWSK-IBGZPJMESA-N	444.513	1.792	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2cccc(C#N)c2)cc1	728942418	RIOKPYHOZVTTRV-UHFFFAOYSA-N	429.502	1.733	50	20	IDGD	
Cc1nn(C(C)(C)C)c2nc(C3CC3)cc(C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)c12	729273977	DUUZAMJHPDNKPE-LLVKDONJSA-N	436.538	1.071	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCOCC2)cc1C(=O)NN=c1cc[nH]c2ccccc12	730288518	PWQKYSSWHYJKMD-UHFFFAOYSA-N	442.497	1.443	50	20	IDGD	
CC(=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O)c1ccc(N2CCCCC2)c(F)c1	730571857	VFVHWEVZUJXSQF-UHFFFAOYSA-N	448.524	1.241	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)N(C)CCCOc1cccc(S(C)(=O)=O)c1	731500048	YSSAGLXTQPIPKD-UHFFFAOYSA-N	435.502	1.854	50	20	IDGD	
O=C(CNC(=O)c1c(Cl)cccc1[N+](=O)[O-])NNC(=O)c1cnn(-c2ccccc2)c1	733365199	VPFUODKJFQJUMW-UHFFFAOYSA-N	442.819	1.625	50	20	IDGD	
CCN=c1nc(NCC)n2c(SCC(=O)NNc3cc(F)c(F)cc3F)n[nH]c2n1	734551534	CVDWQBANJFVIGD-UHFFFAOYSA-N	441.443	1.458	50	20	IDGD	
CC(C)Oc1cccc([C@H](O)CNC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c1	735088690	JFRCLZMGAQSITL-GOSISDBHSA-N	425.449	1.127	50	20	IDGD	
COC(=O)c1cc(Br)cc(S(=O)(=O)NNC(=O)c2cccc(C#N)c2)c1	736063485	QRHINIQPXQNPOT-UHFFFAOYSA-N	438.259	1.731	50	20	IDGD	
Cc1nc(-c2cccnc2)nc(NNC(=O)CCNS(=O)(=O)c2cn(C)c(C)n2)c1C	736693823	RYINSJWRLBJCHM-UHFFFAOYSA-N	444.521	1.009	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)NCCS(=O)(=O)c1ccc(Cl)cc1	738496015	KAEWOBBPLOTNAU-UHFFFAOYSA-N	425.894	1.661	50	20	IDGD	
COc1ccc(CN2C(=O)c3ccccc3C2=O)cc1C(=O)NNc1ncnc2[nH]cnc12	740746613	VFEMTVOOLFPYDB-UHFFFAOYSA-N	443.423	1.915	50	20	IDGD	
CC(=NNC(=O)C1CCN(c2ncccn2)CC1)c1cccc(N2CCCS2(=O)=O)c1	741164510	ODGRITGOYDAOKO-UHFFFAOYSA-N	442.545	1.773	50	20	IDGD	
Cc1cc(N2CCCS2(=O)=O)ccc1C(=O)NNC(=O)COc1ccc(C#N)cc1	741660442	PIZJKVDVJSTHHM-UHFFFAOYSA-N	428.470	1.247	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)[C@H]2CCCN(C(=O)c3ccncc3)C2)cc1	741886716	ARIYBFBKHJXOOA-AEFFLSMTSA-N	440.500	1.947	50	20	IDGD	
O=C(NNC(=O)c1cccc(Br)c1)Nc1ccccc1CN1C(=O)CNC1=O	743812768	DCFIVHQOJNHQFX-UHFFFAOYSA-N	446.261	1.967	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CN(C)CCN2CCN(C(=O)OC(C)(C)C)CC2)c1	744403909	AAVUOIBVPGRXER-UHFFFAOYSA-N	433.553	1.241	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)[C@H]2CCCN(C(=O)Nc3ccccc3)C2)c1	744594615	SRGZUPDOCNJSNB-SFHVURJKSA-N	449.467	1.807	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)C2(c3cccc(F)c3)CCOCC2)cc1	744858095	JKPYZVXCKAOFML-UHFFFAOYSA-N	425.416	1.750	50	20	IDGD	
CCS(=O)(=O)c1ccc(F)c(C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)c1	745006447	TVPDSYSGQMMPCF-UHFFFAOYSA-N	433.417	1.109	50	20	IDGD	
C[C@@H](CN1CCN(c2ccccc2)CC1)NC(=O)NNC(=O)COc1ccc(F)cc1	745840414	WHARNCONXRPPBU-KRWDZBQOSA-N	429.496	1.746	50	20	IDGD	
CC(=O)Nc1ccccc1CNC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1	745857884	NEAVYXYLTMFHEK-UHFFFAOYSA-N	447.517	1.105	50	20	IDGD	
CC1(C)[C@H]2OCCC[C@H]2[C@H]1NC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	745859864	FTWPJGFXNFLJNS-TYPHKJRUSA-N	429.565	1.733	50	20	IDGD	
COc1cc(C(=O)NNC(=O)N[C@H]2CCCN(c3ccn(C)n3)C2=O)ccc1OC(C)C	745883920	QUMUSXUMUMGIGG-HNNXBMFYSA-N	444.492	1.356	50	20	IDGD	
O=C(NNC(=O)[C@@H](O)c1ccccc1)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	746110765	JYEVPZGQHWTVNT-FQEVSTJZSA-N	428.452	1.883	50	20	IDGD	
O=C(NCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNc1cc(F)c(F)c(F)c1	746744883	WWNMFGYPHHVPDV-UHFFFAOYSA-N	444.435	1.951	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNS(=O)(=O)c2ccc3c(c2)n(C)c(=O)n3C)cc1	747692463	NSRPEVFVCJZSGR-ZDUSSCGKSA-N	448.501	1.053	50	20	IDGD	
CCCn1nc(C(=O)NNS(=O)(=O)c2cc(C(=O)O)cs2)c2ccccc2c1=O	747893337	MVDVPHYIFZYIMV-UHFFFAOYSA-N	436.471	1.190	50	20	IDGD	
Cc1nc(Cl)cc(NNC(=O)c2cccc(S(=O)(=O)NC[C@@H]3CCCO3)c2)n1	747982953	HAYCQPPACSAXNU-ZDUSSCGKSA-N	425.898	1.653	50	20	IDGD	
CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)NNC(=O)c1ccc2c(c1)OCCO2	749338849	TVFOPIHKIKSXSN-GOSISDBHSA-N	440.431	1.587	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc([N+](=O)[O-])cnc2C)c1	750542085	VGPXQIXBJWOACJ-UHFFFAOYSA-N	435.462	1.404	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2c(Cl)cc(Cl)cc2Cl)cc1O)C(=O)N1CCCC1	752795034	OHOGWPWJTGFYCL-UHFFFAOYSA-N	446.678	1.922	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)NC[C@H]2CCCN2S(C)(=O)=O)c(C)n1C[C@H]1CCCO1	753144551	RTHZQRCABHCJAA-XFVDGSDISA-N	434.562	1.731	50	20	IDGD	
CCCN(CCNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)C(=O)OC(C)(C)C	754111725	UYWQHSNYWKVCIK-UHFFFAOYSA-N	449.556	1.671	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)N[C@@H]1[C@H]2CCO[C@H]2C12CCC2	754672449	CBQLZTLSYZSFAM-HMXCVIKNSA-N	427.549	1.487	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)Nc1cccc(S(=O)(=O)N2CCCCC2)c1	755359361	KKEADFVLNQRIOO-AWEZNQCLSA-N	428.511	1.065	50	20	IDGD	
COc1cc(C=NNC(=O)Cn2cnc3ccccc32)c([N+](=O)[O-])cc1OCC(=O)O	755523657	CAINMWRKTYGQCT-UHFFFAOYSA-N	427.373	1.567	50	20	IDGD	
O=C(NNC(=O)c1ccc[nH]1)Nc1ccc(CC(=O)N2CCN(c3ncccn3)CC2)cc1	755690552	FVFVJGAZKBRAFA-UHFFFAOYSA-N	448.487	1.163	50	20	IDGD	
Cc1ccc(SCC(F)(F)F)c(NC(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)c1	756664831	QQKZGFMVOVSSRW-SECBINFHSA-N	428.458	1.740	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)Nc1ccc(S(=O)(=O)NCC2CC2)cc1	756785078	RWIOBLJQYOPFLU-SFHVURJKSA-N	446.485	1.368	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N[C@H](C)[C@H](C)CO)cc1	757090311	WSWHPAIWCHWPGT-SBSYXSKNSA-N	425.489	1.474	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)N[C@H]1CCN(C(=O)CCc2ccccc2)C1	757285340	HVDMWOQRUWTGFK-SFHVURJKSA-N	428.464	1.769	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)c2c[nH]c3ccccc23)ccc1S(=O)(=O)N(C)C	757775335	IDYQARIRJZUZOV-UHFFFAOYSA-N	431.474	1.893	50	20	IDGD	
Cn1ccnc(NC(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)c1=O	757907677	SZWMEWJUBUAALB-UHFFFAOYSA-N	448.486	1.109	50	20	IDGD	
COC(=O)[C@H](C)Oc1ccc(C=NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1	758366575	HTNXVNNXHKGTTH-INIZCTEOSA-N	447.513	1.706	50	20	IDGD	
Cn1c(N)c(C(=O)/C(C#N)=C/c2cn(-c3ccccc3)nc2C(C)(C)C)c(=O)n(C)c1=O	758419012	TYLPRVYVOHSOGR-SDNWHVSQSA-N	432.484	1.939	50	20	IDGD	
CN(NC(=O)c1ccc(N2CCOCC2)cc1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758782612	TVKDSOAUODMHGD-UHFFFAOYSA-N	447.536	1.773	50	20	IDGD	
O=C(NNC(=O)C(=O)Nc1ccccn1)N[C@H]1CCCN(c2ccccc2Cl)C1=O	758804697	QBHITVONOSHNAV-ZDUSSCGKSA-N	430.852	1.200	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)NCCN2CCC(N(C)C)CC2)c1	759617590	XULFWFQKRQSWGB-UHFFFAOYSA-N	442.358	1.428	50	20	IDGD	
COC[C@@H](NC(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccc(Cl)cc1)C(N)=O	760043173	NBXBQHCNSZIGIG-RKCSUWQLSA-N	426.864	1.641	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1ccnn1Cc1ccc(F)cc1	760280650	WEYZKWOZUUXPLS-UHFFFAOYSA-N	426.364	1.378	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)C(C)(C)C)n([C@H]2CCN(Cc3ccccc3)C2)n1	761063166	CDSPWIGCHJUDQV-KRWDZBQOSA-N	426.521	1.771	50	20	IDGD	
O=C(NNC(=O)c1ccc2ccccc2n1)C(=O)Nc1ccc(N2CCOCC2)c(F)c1	763465922	HMNHLXOCEQCWGJ-UHFFFAOYSA-N	437.431	1.610	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(C)nn2Cc2ccccc2)cc1OC	763549875	AWUHXLRXALMXAQ-UHFFFAOYSA-N	437.456	1.657	50	20	IDGD	
COc1ccc(OC(F)F)c(NC(=O)C(=O)NNC(=O)c2ccc(OC)c(OC)c2)c1	763550469	NYSQOMZNPXGJFQ-UHFFFAOYSA-N	439.371	1.714	50	20	IDGD	
COc1ccc(C(=O)N2CCCC2)cc1NC(=O)C(=O)NNC(=O)c1ccccc1F	763555313	CNRJEGCVUKIFBK-UHFFFAOYSA-N	428.420	1.470	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)Nc1ccccc1OCC(F)(F)F	763570799	IAIQGNDFQLRNOR-HNNXBMFYSA-N	439.346	1.554	50	20	IDGD	
O=C(COc1cccc(C(F)(F)F)c1)NNC(=O)C(=O)Nc1ccn(-c2ccncc2)n1	763639301	DGWUUPGDTUGUKG-UHFFFAOYSA-N	448.361	1.451	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2ccccc2CN2CCOCC2)c1	763644521	KHQJLNXRVZXJRK-UHFFFAOYSA-N	440.500	1.301	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(N(C)C)c2)cc1Cl	763754247	NWMIXBDEDBAEML-UHFFFAOYSA-N	448.863	1.358	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2cccc(C(F)(F)F)c2)c2ccccc2c1=O	763787004	UOEMYVQERBLVQO-UHFFFAOYSA-N	447.373	1.835	50	20	IDGD	
Cc1nn(CC(F)(F)F)c(C)c1CC(=O)OCC(=O)NNC(=O)c1cccc(C#N)c1	763828617	RDTVCYCTHGXVFE-UHFFFAOYSA-N	437.378	1.481	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCCCC3)cc1-n1cnnn1	763967731	FMVJNBTUNQYPCA-UHFFFAOYSA-N	439.501	1.701	50	20	IDGD	
CC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2cc(Br)cn2C)cc1C	764004353	DVMRXPLTEDTJGX-UHFFFAOYSA-N	436.266	1.454	50	20	IDGD	
C[C@@H]1COCCN1c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)cc1	764116822	HYQNPHDENXEHCA-GFCCVEGCSA-N	432.864	1.670	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2c(C)cccc2C(=O)N2CCCC2)c1O	764132323	NASTYVWBOJRWFT-UHFFFAOYSA-N	440.456	1.345	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2cnn(-c3ccccc3F)c2C)c1O	764132831	RILIAWNTQOJEBR-UHFFFAOYSA-N	427.392	1.434	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1cnn(Cc2ccc(Cl)cc2)c1	764278288	UTGKWIRNYAMVSO-UHFFFAOYSA-N	443.847	1.455	50	20	IDGD	
COCCOc1ccc(C(F)(F)F)cc1NC(=O)C(=O)NNC(=O)c1c[nH]nc1C	764295977	RIJHKFUKUHQPDD-UHFFFAOYSA-N	429.355	1.162	50	20	IDGD	
CN(c1ccccc1NC(=O)C(=O)NNC(=O)CCCc1cccs1)S(C)(=O)=O	764338748	DEEWQHXOIXDUBL-UHFFFAOYSA-N	438.531	1.253	50	20	IDGD	
COc1cc2c(cc1OC)CN(C(=O)CCC(=O)NNC(=O)c1ccccc1F)CC2	764512411	CGJDYZODDVAJPR-UHFFFAOYSA-N	429.448	1.969	50	20	IDGD	
C/C(=C\C(=O)NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1)C(C)(C)C	766637140	YJOGTCLYFHNVSB-SAPNQHFASA-N	436.578	1.441	50	20	IDGD	
COc1nc(N(C)C)sc1C=NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	767159433	QYKQZPJVGSWZMC-UHFFFAOYSA-N	437.547	1.766	50	20	IDGD	
CCOc1ccc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)C(C)(C)C(N)=O)cc2)cc1	767404187	XVONIWLFJMUTEP-UHFFFAOYSA-N	448.501	1.159	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)c1cc(C)c(C)c(S(N)(=O)=O)c1	768630403	XKPXGEXTUACORQ-UHFFFAOYSA-N	427.504	1.120	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)c2ccnc(CNC(=O)OC(C)(C)C)c2)c1	768688793	CRJKNLIZEPILCH-UHFFFAOYSA-N	429.477	1.988	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cc(F)cc(Cl)c2O)cc1	768929199	FXKXZFUSXUSAAL-UHFFFAOYSA-N	429.857	1.575	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)NC2CCN([C@H]3CCCC[C@H]3O)CC2)cc1OC	769164270	ABUGMHZAELSFPK-ZWKOTPCHSA-N	434.537	1.806	50	20	IDGD	
CCS(=O)(=O)NCc1ccc(C(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)cc1	770965506	KYUDMWAMHMKWMP-UHFFFAOYSA-N	447.521	1.483	50	20	IDGD	
Cc1c(C(=O)O[C@@H](C)C(=O)NNC(=O)CC(C)C)nnn1-c1ccc2c(c1)OCCO2	772106628	CLNUGTBCGGIKMP-ZDUSSCGKSA-N	431.449	1.086	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1cc(F)c(F)cc1I	772188660	TUNUWUNWTRQADN-ZCFIWIBFSA-N	426.157	1.672	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)c2ccccc2Cn2cncn2)C1	773418562	KFZWPIQWJRRNQL-INIZCTEOSA-N	428.493	1.735	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)C(=O)Nc2ccc(C(=O)N3CCOCC3)c(Cl)c2)n1	773481492	SFKXFDOKAUJLIE-UHFFFAOYSA-N	432.868	1.301	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(S(=O)(=O)N3CCCC3)cc2)cc1F	773886458	XAQFEXSMGJAKDS-UHFFFAOYSA-N	448.476	1.318	50	20	IDGD	
O=C(Cc1cccc2ccccc12)NNC(=O)N[C@@H]1CCO[C@]2(CCS(=O)(=O)C2)C1	776076091	IEIUHICSFGRRLV-DYESRHJHSA-N	431.514	1.449	50	20	IDGD	
CNc1c(C(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)cccc1[N+](=O)[O-]	776205214	KWPZSUQJJBOYSB-UHFFFAOYSA-N	436.469	1.886	50	20	IDGD	
O=C(NC[C@H]1COC2(CCCCCC2)O1)NNC(=O)c1csc(N2CCOCC2)n1	776885900	XCBYFIFUJPRZCH-AWEZNQCLSA-N	439.538	1.390	50	20	IDGD	
COc1ccc(/C=C\C(=O)N2CCN(S(=O)(=O)CBr)CC2)cc1OC	777835629	BOGISWVULYFZDA-XQRVVYSFSA-N	433.324	1.543	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)c1cccc(N2C(=O)c3ccccc3C2=O)c1	778434294	YKVHHSBENGRCSM-UHFFFAOYSA-N	438.440	1.773	50	20	IDGD	
COCC(=O)N1CCc2cc(NC(=O)C(=O)NNc3cccc(C(=O)OC)c3)ccc21	778697129	KAGVMGREKOGUGX-UHFFFAOYSA-N	426.429	1.091	50	20	IDGD	
CCOc1cc(N2CCOC(C)(C)C2)ccc1NC(=O)C(=O)NNC(=O)c1c[nH]nc1C	782118019	VWFADBOXTSOKSZ-UHFFFAOYSA-N	444.492	1.132	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H]1CCC[C@@H](NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)C1	782547501	XWSPVGNQMVHZRZ-CABCVRRESA-N	444.496	1.442	50	20	IDGD	
COc1cc(OC)c(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)cc1F	782884536	BOECETCIHOMWMB-UHFFFAOYSA-N	429.408	1.058	50	20	IDGD	
CSCc1ccc(NC(=O)C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)cc1	782898035	XIJKFTPEGZGXGD-UHFFFAOYSA-N	449.558	1.551	50	20	IDGD	
O=C(NNC(=O)c1ccnc(C2CC2)c1)c1cccc(S(=O)(=O)N2CCOCC2)c1	783029197	WNAXWCIXUUFOAQ-UHFFFAOYSA-N	430.486	1.055	50	20	IDGD	
O=C(NNc1ncccc1C(F)(F)F)C(=O)Nc1ccc(CN2C(=O)CNC2=O)cc1	783117371	CNSJOJFNDCKBHC-UHFFFAOYSA-N	436.350	1.234	50	20	IDGD	
CC(C)Oc1ccccc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	784210612	YCNXMDXOLVMRNO-UHFFFAOYSA-N	432.502	1.996	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNc2ccc(F)c(F)c2F)cc(S(C)(=O)=O)c1	784807482	ZOFUTYIMISDLFI-UHFFFAOYSA-N	445.375	1.376	50	20	IDGD	
CC(=O)Nc1cccc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)NC(C)(C)C)c1	784833913	SIGAIQIFMXZDFA-UHFFFAOYSA-N	447.517	1.804	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)Nc1ccc(N2CCSCC2)cc1	785023201	LTGDQBAKAUDLCM-UHFFFAOYSA-N	445.457	1.253	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)ccc1Br	785023883	OUXFQFSXSJYLHT-UHFFFAOYSA-N	437.206	1.771	50	20	IDGD	
Cc1ccccc1-c1cc(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)n(C)n1	785060359	HXTXBIJTRKVDDS-UHFFFAOYSA-N	431.456	1.372	50	20	IDGD	
COC(=O)CCc1cccc(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)c1	786414302	KVUVWWOFRSMEAI-UHFFFAOYSA-N	437.250	1.283	50	20	IDGD	
Cc1nn(C)c(N2CCN(C(=O)NNC(=O)c3cc4c(s3)CC[C@@H](C)C4)CC2)c1C#N	788092529	JNSMSRJUUASDEN-CYBMUJFWSA-N	441.561	1.963	50	20	IDGD	
CS(=O)(=O)c1cc(NC(=O)C(=O)NNc2ccnc(Br)c2)ccc1Cl	788339439	YKGWFTWEWVAQMO-UHFFFAOYSA-N	447.698	1.983	50	20	IDGD	
COC(=O)c1cn(CC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)c2ccccc12	789852579	BHAACSOZBQBMGY-UHFFFAOYSA-N	433.424	1.780	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2cccc(F)c2[N+](=O)[O-])cc1NS(C)(=O)=O	790997465	OEZAUFNJEMSXKR-UHFFFAOYSA-N	425.398	1.496	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2ccnn2-c2ccccc2)cc1	792016776	AJWDOGNHZMULFV-UHFFFAOYSA-N	427.486	1.262	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1c(C)c(C)nn1-c1ccc(Cl)cc1	792265504	CJHULRUZOXCGGL-CYBMUJFWSA-N	437.884	1.280	50	20	IDGD	
CC[C@H](C)n1ncc(NC(=O)C(=O)NNC(=O)c2nn(CC)c(=O)c3ccccc23)c1C	792269250	VQDDNVWKSBAPMY-LBPRGKRZSA-N	439.476	1.292	50	20	IDGD	
C[C@@H]1C(=O)CC[C@@H]1CC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	792789615	LWNOWWJOZWNVKB-DOTOQJQBSA-N	443.525	1.931	50	20	IDGD	
C[C@@H](NC(=O)c1ccc(Br)s1)C(=O)N([C@H]1CCS(=O)(=O)C1)N(C)C	792854068	INMNNKWNSTVLSO-ZJUUUORDSA-N	438.369	1.121	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2cc(C(C)(C)C)nn2-c2ccc(C#N)cc2)n1	793029866	SWBCMODBVYNZFE-UHFFFAOYSA-N	434.460	1.922	50	20	IDGD	
CCOC(=O)c1ccc(NNC(=O)CCN2CCN(C(=O)[C@@H]3CCCO3)CC2)cc1C	794645642	FRASETPPIYBMIH-IBGZPJMESA-N	432.521	1.328	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)C[C@H]2COCCN2C(=O)OC(C)(C)C)cc1C	794807920	XMBUIPKVDHLKPC-INIZCTEOSA-N	434.493	1.415	50	20	IDGD	
COCc1ccc(OC)c(S(=O)(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)c1	795343600	MKXFPUVRHZRIPS-UHFFFAOYSA-N	441.893	1.121	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)Cc2c(C)nc(-c3cccnc3)nc2O)cc1C	798309528	HEMQACQYJNUSPV-UHFFFAOYSA-N	434.456	1.498	50	20	IDGD	
CN(C)C(=O)Cn1cc(NS(=O)(=O)c2ccc(OCCBr)cc2)cn1	799530003	WWUNWGFALAXRMX-UHFFFAOYSA-N	431.312	1.546	50	20	IDGD	
O=C(NCCNS(=O)(=O)c1ccc(F)cc1F)NNC(=O)c1cccc2ncccc12	799673846	QOJSCVXTIBQXHP-UHFFFAOYSA-N	449.439	1.436	50	20	IDGD	
Cc1nc2cccc(C(=O)NNc3ccc(S(=O)(=O)N4CCN(C)CC4)cc3)c2[nH]1	801929078	DPFGYNXZMVWDBN-UHFFFAOYSA-N	428.518	1.564	50	20	IDGD	
O=C(CCCNS(=O)(=O)c1ccc2c(c1)OCCCO2)NNC(=O)Nc1ccccc1	801988805	QURUWZPUMRULIW-UHFFFAOYSA-N	448.501	1.759	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(OCC(=O)NNC(=O)Nc2ccc3c(c2)OCO3)CC1	802099523	KEISQORPZIXKHA-UHFFFAOYSA-N	436.465	1.984	50	20	IDGD	
COc1ccc(C2=NO[C@H](CNC(=O)NNC(=O)c3c(C)nc4ccccn34)C2)cc1F	802347999	MLORWTOTPUKISU-AWEZNQCLSA-N	440.435	1.928	50	20	IDGD	
O=C1COC[C@@H](C[C@H]2CN(C(=O)C(=O)NNc3ccccc3Cl)c3ccccc32)N1	806967407	KSDWQIFEQZPFNF-UONOGXRCSA-N	428.876	1.819	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)CNS(=O)(=O)c1ccc(Br)cc1	810566066	YSOOBUJBMFWIMR-UHFFFAOYSA-N	440.319	1.426	50	20	IDGD	
Cn1cncc1CNC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	812489109	NFVVUXAIVGDUPJ-UHFFFAOYSA-N	434.503	1.427	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2cnc(-c3ccccc3)nc2)cc1	813033654	DWGGWNHPNTUOGW-UHFFFAOYSA-N	440.485	1.476	50	20	IDGD	
Cc1csc(-c2ccc(NC(=O)C(=O)NNC(=O)[C@H]3CCc4nncn4C3)cc2)n1	815692442	RDHPTUQYENCREV-ZDUSSCGKSA-N	425.474	1.059	50	20	IDGD	
CCn1c2ccccc2c2cc(NC(=O)C(=O)NNC(=O)[C@@H]3CCc4nncn4C3)ccc21	815693248	QLUXCHZTALLNRJ-CQSZACIVSA-N	445.483	1.754	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)N(C)[C@@H]2CCN(S(C)(=O)=O)C2)c(C)n1C[C@@H]1CCCO1	816816669	DQJSQOOEHBTDHP-BXWLARMLSA-N	434.562	1.683	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)c2ccc3c(c2)C[C@H](C)N3S(C)(=O)=O)c1	825796708	LKIAISSLCODHOJ-ZDUSSCGKSA-N	432.502	1.279	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2cccc(NC(=O)[C@@H]3CCCO3)c2)n1	907781620	HPBPLCJCZKNZDW-HNNXBMFYSA-N	446.485	1.116	50	20	IDGD	
Cc1c(/C=C(\C#N)C(=O)OCC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)cc(C#N)n1C	913287302	ZZSOEZMIRVHVMT-QLKAYGNNSA-N	437.368	1.931	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)CCCN2C(=O)CCC2=O)c2ccccc2c1=O	915618529	SUFOLDAZDOFZJM-UHFFFAOYSA-N	441.488	1.277	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@@H](c2cccs2)N2CCCC2)c1	915902235	VGORAIHJWZOBJK-INIZCTEOSA-N	436.559	1.933	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)N[C@H](CN1CCOCC1)c1ccccc1	916215057	WECGCRZSUQVTEB-GOSISDBHSA-N	426.473	1.475	50	20	IDGD	
CC(C)NS(=O)(=O)c1cccc(CNC(=O)NNC(=O)COc2ccc(F)cc2)c1	916486178	BBGSLKZMACDMCK-UHFFFAOYSA-N	438.481	1.422	50	20	IDGD	
COCCOc1ccc(CNC(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)cn1	916512344	IZBCGBNBHOPTLZ-UHFFFAOYSA-N	438.510	1.015	50	20	IDGD	
O=C(NCCCn1nc2n(c1=O)CCCC2)NNc1ccc(F)cc1Br	916650282	ZQJLCCCMPGROQL-UHFFFAOYSA-N	427.278	1.999	50	20	IDGD	
CC(=O)Nc1ccc(S[C@H](C)C(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1	916734414	FUEGCNDXKXJKTQ-GFCCVEGCSA-N	449.558	1.880	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)CCc1c(C)nc2ccnn2c1C	916734933	TZEUBAVJYMZUKV-UHFFFAOYSA-N	443.533	1.341	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2ccc(OC)c3ncccc23)cc(OC)c1OC	917717325	COPKWCRXLUFUAY-UHFFFAOYSA-N	447.469	1.893	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)c2cc(C(N)=O)cs2)c2ccccc2c1=O	919689461	QPMKFISBHFPVDG-UHFFFAOYSA-N	427.486	1.822	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)N[C@H](CC(=O)N(C)C)c2ccccc2)nc1	920046401	JFIBYUQLJKYVSL-QGZVFWFLSA-N	448.549	1.614	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)NCCc2cnn(C)c2)cc1	920851419	LHILPVUCARTSJX-WOJGMQOQSA-N	447.499	1.433	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)CCCC[C@@H]1SC[C@H]2NC(=O)N[C@H]21	921302516	XNCGRQXJTTYBLW-PTSWNOGYSA-N	444.561	1.472	50	20	IDGD	
O=C(COC(=O)CC1(CC(=O)N2CCOCC2)CCCC1)NNC(=O)c1cccs1	1317765133	WEHKYJCPLNSJSD-UHFFFAOYSA-N	437.518	1.252	50	20	IDGD	
O=C(NNC(=S)NC[C@@H]1CCOC1)c1cccc(NC(=S)NC[C@H]2CCOC2)c1	1319380810	MJPNCDFTLTXLSZ-KGLIPLIRSA-N	437.591	1.155	50	20	IDGD	
Cc1nn([C@@H]2CCS(=O)(=O)C2)c2nc(C3CC3)cc(C(=O)NNc3ncncc3F)c12	1324581673	AAHLTVGNSDKYAQ-GFCCVEGCSA-N	445.480	1.663	50	20	IDGD	
CSCC[C@H](C(=O)NNC(=O)c1n[nH]c2c1CCCC2)N1C(=O)[C@@H]2CCCC[C@H]2C1=O	1337223322	UIBIIMYKOKISSG-XJKCOSOUSA-N	447.561	1.346	50	20	IDGD	
Cc1cccc2[nH]c(C(=O)N3CC[C@@]4(CN(C(=O)CCC(=O)NN(C)C)CCO4)C3)cc12	1778502107	WSTRCJILUBUARY-HSZRJFAPSA-N	441.532	1.293	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc3nonc3c2)C1	1778526056	SXPGTJIKAJINQH-WIBUTAKZSA-N	436.896	1.604	50	20	IDGD	
O=C(/C=C1\C(=O)Nc2ccccc21)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2	1779283257	TVXIJXZXDSIRRQ-BHXRDOOWSA-N	447.919	1.136	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccncc2O)C1	1779619051	BQKWSJSCGHWPEC-WBHUJUFNSA-N	426.311	1.698	50	20	IDGD	
Cn1ccc2c(O)ncc(C(=O)N3CC[C@@]4(CN(C(=O)CO[Si](C)(C)C)CCO4)C3)c21	1779975429	BFUBFFIVKIPHLG-OAQYLSRUSA-N	446.580	1.574	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(CO)on2)C1	1780219667	VAZGWDZKBROCFG-JDSLSITLSA-N	430.299	1.078	50	20	IDGD	
N#Cc1cc(CC(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](O)CCl)C3)ccc1F	1780754217	JJOVAWLAZXZZDJ-WAOWUJCRSA-N	437.899	1.353	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cccc(N4CCOCC4)n3)CCO2)C1	1781219233	SSGVFHOETPXCKM-HRAATJIYSA-N	436.940	1.379	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)Cn3nnc4ccccc43)CCO2)C1	1781224699	NFLHHUGFHIGDMG-OALUTQOASA-N	440.331	1.498	50	20	IDGD	
O=C(c1cccn2ccnc12)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781331811	QGUZQZZDMLZVOV-SUMWQHHRSA-N	425.258	1.468	50	20	IDGD	
O=C(c1cc(F)cc([N+](=O)[O-])c1)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781332821	JTNVWAZPHQTLTN-CJNGLKHVSA-N	448.220	1.868	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](N)c1ccccn1)C2	1781997765	GBXLEKMKLRVPLX-JNNRSPCRSA-N	439.354	1.379	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnn4c3CCC4)C2)C1	1782322913	UYBJEYQZWNCXMZ-KSSFIOAISA-N	425.327	1.446	50	20	IDGD	
O=C1Cc2cccc(C(=O)N3CC[C@]4(C3)CN(C(=O)[C@H](F)Br)CCO4)c2N1	1782411383	DXSOYALUALMJMG-YJBOKZPZSA-N	440.269	1.315	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)Cc3ccc([N+](=O)[O-])cc3F)C2)C1	1782973858	LCTKQTNBIADWNM-KXBFYZLASA-N	443.859	1.360	50	20	IDGD	
COc1nc(C)ccc1C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](C)Br)C2)C1	1783535562	AAZHRBHJKDGAMP-FZKQIMNGSA-N	426.311	1.626	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(C)c(NC(C)=O)c3)CCO2)C1	1783879758	ANXOSUCIIKROEO-UWJYYQICSA-N	437.924	1.651	50	20	IDGD	
COc1ccc2[nH]cc(C(=O)N3CCO[C@]4(CCN(C(=O)C(Cl)Cl)C4)C3)c2n1	1783948276	HLLGSSHOOBRWCL-SFHVURJKSA-N	427.288	1.819	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(O)cn3)C[C@@H]21	1783967380	GKOPUDHDWKLORK-DUPGQFARSA-N	426.311	1.412	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@](C)(O)C(F)(F)F)C[C@@H]21	1783969916	QUHVCTPRXWPNCR-VSBZFQJLSA-N	445.276	1.310	50	20	IDGD	
Cc1cc(C)n(CCC(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)n1	1784321174	KPCXRDWNIXJPQO-YJBOKZPZSA-N	427.343	1.503	50	20	IDGD	
Cc1cc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)CBr)C[C@@H]32)on1	1785085993	CJIDKBQOHCBLFP-XTBFLFJDSA-N	428.327	1.536	50	20	IDGD	
O=C(c1cc(F)ccc1C(F)(F)F)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1785211668	QXXAEWZOVHAUQZ-YOEHRIQHSA-N	438.805	1.888	50	20	IDGD	
C[C@@H](Cn1cccn1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)Br)C[C@@H]21	1785445213	WUEIVLJFFIRYLE-QRJUGERDSA-N	427.343	1.282	50	20	IDGD	
C[C@H](NC(=O)c1ccc(F)cc1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]2C1	1787449181	NNNZSDKPOYPMBC-MUMJOVGASA-N	443.878	1.458	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4cc(O)ccc4n3)[C@H]2C1	1787868730	UATZHHWRRXOELQ-REGYPHIPSA-N	447.919	1.788	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)c1cnn(Cc2ccccc2)c1	1788926058	SDWGCZHCFRGNJJ-FFGOWVMKSA-N	446.935	1.124	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc([N+](=O)[O-])[nH]3)[C@H]2C1	1789392981	YQJAGXDVUSRERU-BLFANLJRSA-N	429.271	1.300	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C3CCC(CO)CC3)C[C@@H]21)[C@H](F)Br	1789922011	BAWRFSUMIVMVSZ-YHHCBVJFSA-N	435.334	1.455	50	20	IDGD	
Cc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]32)c(F)c1	1790006336	PXQQOHHZIBTKLZ-IEZWGBDMSA-N	434.512	1.100	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3[nH]nc4ncccc34)C[C@@H]21	1791058031	WMLCMVXBXJEDLC-XWUBHJNHSA-N	436.310	1.335	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(Cl)cnc1O	1792390569	GNPXIRRWOMGMNS-RDBQEKCUSA-N	446.729	1.817	50	20	IDGD	
O=C(COc1ccc(O)cc1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2	1792775370	WLSLMKBURZCLLW-IVWMJMPLSA-N	427.295	1.146	50	20	IDGD	
CC1CCN(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)CBr)CC1	1792868721	NDDMZMLHALGIPG-XLMAVXFVSA-N	430.387	1.339	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1CCC(CO)CC1)C2	1792868835	RDNAUNDFPRNNCE-XKXGBVFJSA-N	431.371	1.406	50	20	IDGD	
COc1ccc(-c2cc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@@H](O)CCl)no2)cc1	1792978247	MQBLPNKEYUZWCH-CSHUHZATSA-N	449.891	1.153	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H](C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](O)CCl)C3)C[C@@H]2C[C@@H]21	1793126775	KCPJBXKFWXFARO-ZUKRZWFUSA-N	441.956	1.622	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnn3cccc(F)c13)C2	1795116560	SNELWAGVQGFZRT-DRXBFXEBSA-N	439.285	1.462	50	20	IDGD	
CCn1nc(C)cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)CBr)C2	1796130665	CRPDZQIFNFYPCP-OEYIWLLWSA-N	427.343	1.446	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1=C3c4ccccc4C(=O)N3CC1)C2)[C@H](F)Cl	1796366053	IQJGOHJOBSZESN-GWLLULGVSA-N	433.867	1.381	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@](O)(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](F)Cl)C1	1796810106	PIDOWZJFCKPEPB-ZRKYPZEGSA-N	433.908	1.531	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc3ncccc3[nH]1)C2	1798443236	ZZTRQNZCJBZRBX-BTTYYORXSA-N	433.472	1.127	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc(Br)nc1)C2	1799269098	SROJPLLPVNLTAT-UMPJEAMMSA-N	444.757	1.994	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@](C)(Cl)CCl)o1	1799277262	UVQRUQYRJNUDFL-TYYYEBLRSA-N	432.304	1.678	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3ccnn3c1)C2)[C@H](F)Br	1799346568	CVFCNKIDRAMJBW-NEBZKDRISA-N	425.258	1.228	50	20	IDGD	
COc1cccc(/C=C/C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Br)c1	1799346913	IXOSZFDBKQOXHQ-KLHHMNKOSA-N	441.297	1.989	50	20	IDGD	
C[C@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@](C)(Cl)CCl)[C@H]1SC(=N)NC1=O	1800078720	JSZYYLZRPXROQY-XBEPSMQDSA-N	435.377	1.663	50	20	IDGD	
C[C@@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnccc1C(=O)NN)C2)c1ccc(O)cc1	1800103657	XXEOWTAHSZMZHJ-MXASKKJJSA-N	437.500	1.446	50	20	IDGD	
CCCCC[C@@H](C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnccc1C(=O)NN)C2	1800562381	QCRBJBLOTYBREQ-OAFZBRQQSA-N	431.537	1.105	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1[nH]nc3ccncc13)C2	1800640231	ZYAABSHIWWNIHZ-WJNVRWDZSA-N	436.310	1.335	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3cccnn3n1)C2	1800642149	YPOMIIGILWXKEV-FAXLKDOZSA-N	436.310	1.106	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc3c(Cl)cccn13)C2	1800975142	KASISKBOVMANBP-LMWOUKEDSA-N	441.315	1.445	50	20	IDGD	
CC(=O)Nc1ccc(Cl)c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](O)CCl)C3)c1	1801906318	PYRHNZLKIXLXTH-LZDSYCOUSA-N	444.315	1.101	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(S(C)(=O)=O)ccc1F)C2	1802280459	QOVCNSCAMGKOPB-OQMKEHIESA-N	446.928	1.735	50	20	IDGD	
CCOC(=O)N1CCC(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](Cl)COC)CC1	1802283364	SIYCICZQTCFXEU-YVSFHVDLSA-N	429.945	1.747	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CNC(=O)C(F)(F)F	1802383835	ZXEAHOFAMPGGDF-LMLFDSFASA-N	428.249	1.477	50	20	IDGD	
CC[C@H](NC(C)=O)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)Br)[C@H]1c1cccnc1	1802548846	UNELEOQSWABRPI-ZCPGHIKRSA-N	439.354	1.786	50	20	IDGD	
N=C(N)SCC(=O)N1CC[C@@H](CNC(=O)CCBr)[C@@H]1c1cccnc1	1806341182	ZRNQWUUTVNWFCD-WFASDCNBSA-N	428.356	1.499	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC2(CCCN(C(=O)[C@H](F)c3ccccc3)C2)CC1	1806515903	ZFEDPRAWDOOKQB-OAQYLSRUSA-N	438.308	1.922	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@H](CNC(=O)CSC(=N)N)[C@H]1c1cccnc1	1807005993	NIEKYHXHPSLRRN-QEORTHHSSA-N	432.377	1.950	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H]2C[C@@]2(F)Cl)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807367051	JLTAJVOFFPJZMG-JWVYWZTKSA-N	445.687	1.006	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)/C=C/c2ccco2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1	1807369445	JXMDWMZLFKUNPE-QNDZLASUSA-N	445.284	1.387	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)[C@H](C)S)[C@@H]1c1cccnc1	1808416876	SFSSNBWMGZMURH-KAPJVXPESA-N	442.545	1.540	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC2(CCCN(C(=O)c3cnoc3C3CC3)C2)CC1	1808884223	RHLQNYNKHRWDDF-UHFFFAOYSA-N	437.305	1.390	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)c3cnoc3C3CC3)CC2)C1	1809968232	NUDKGBHOXWEXJG-UHFFFAOYSA-N	437.305	1.390	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)CC2CCC2)[C@@H]1c1cccnc1	1810307675	FXKPFBKKRYTPMY-LAUBAEHRSA-N	436.516	1.590	50	20	IDGD	
C[C@H](C(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1)n1cccc1	1813315861	QDCOOFXGOWPAPL-SFGWALBWSA-N	440.548	1.523	50	20	IDGD	
CCCNC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](Cl)COC)[nH]n1	1815114101	PIQCUJIZTLMIKX-ZFWWWQNUSA-N	427.933	1.962	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H]1CCCO1)CC2	1817279770	CYXNLCLHQVSLGM-CBZIDRGTSA-N	444.517	1.368	50	20	IDGD	
CCc1oncc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1	1817470959	NWTGHOVCQOABDR-KRWDZBQOSA-N	437.265	1.260	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](Cl)COC)[nH]n1	1819355857	XYHHTKDYVJKNKG-DYEKYZERSA-N	428.921	1.363	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](F)Br)CC2	1820148871	XBKKUOGGSLIFHT-RWYTXXIDSA-N	433.303	1.436	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)CCN2CCOCC2)[nH]n1)[C@@H](F)Br	1820932052	CGYYOQRYUUTIGV-CZUORRHYSA-N	446.321	1.815	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](F)Br)n[nH]1	1820937352	QHXKFTIPOOFINH-ABAIWWIYSA-N	447.309	1.465	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc(O)cc2F)n[nH]1	1821112813	LVNSYXCQICHLRZ-QGZVFWFLSA-N	446.483	1.933	50	20	IDGD	
CC[S@](=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1	1823006361	AATFINAULWGKHY-MYUSKNPXSA-N	440.360	1.904	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CNC(=O)N(C)C)CC1	1823877662	OPDNZELGYXCNKL-ZBFHGGJFSA-N	445.402	1.908	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H]3CNC(=O)C3)sc2C1	1825203210	HRWFKEGQURBDPP-GUBZILKMSA-N	429.340	1.365	50	20	IDGD	
O=C([C@@H](O)CCl)N1CCC([C@@H]2CCCCN2C(=O)c2cccn3c(O)nnc23)CC1	1827535582	NFVDSSKDZBCOLG-HOTGVXAUSA-N	435.912	1.268	50	20	IDGD	
COC[C@H](C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1	1828923721	VUUIPNPIXVZMIY-KXBFYZLASA-N	431.537	1.201	50	20	IDGD	
CCN(C)[C@H](C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1	1828924423	QRADGWWAFKUIGC-UZLBHIALSA-N	444.580	1.259	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc([N+](=O)[O-])o3)C2)C1	1830352910	UNEXMVGAVHJUJQ-SFHVURJKSA-N	429.857	1.523	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3cnn(C)c3)C2)C1	1831646290	KLJZOFPTINHIHD-YLJYHZDGSA-N	426.945	1.217	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(NC(C)=O)o3)C2)C1	1831651984	VKYHJWKOGJIWEN-MGPUTAFESA-N	441.912	1.716	50	20	IDGD	
CS(=O)(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H](F)Br)CC1	1832402165	VBPFUFSIVUQPCE-UKRRQHHQSA-N	441.363	1.731	50	20	IDGD	
COc1ccc(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)cn1	1832581061	RPUZYJYBBRHCDR-MJGOQNOKSA-N	429.876	1.014	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)C(=O)c3ccco3)CCO2)C1	1832667442	FFKDZRKUDLWTRF-UGSOOPFHSA-N	443.294	1.092	50	20	IDGD	
O=C(c1cccnc1OCC1CC1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1833625335	PVPALVNGVGSVKR-OXJNMPFZSA-N	441.887	1.475	50	20	IDGD	
Cc1noc(C)c1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1	1834069046	REKILENUKOCBDE-MSOLQXFVSA-N	434.320	1.598	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccnc(Cl)c3)CCO2)C1	1834185606	KEZXCAUYKAKRKM-PXAZEXFGSA-N	446.729	1.588	50	20	IDGD	
COc1cscc1C(=O)NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1835233114	XAVOEOHGKNVANR-MRXNPFEDSA-N	429.970	1.542	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)Cn3cc(Cl)cn3)CCO2)C1	1835969553	PLMBFFWUMOSMAG-SFHVURJKSA-N	433.336	1.258	50	20	IDGD	
CC[C@@H](NC(C)=O)C(=O)N1CCC(OC2CCN(C(=O)[C@H](C)Br)CC2)CC1	1836618954	LJXFQPGIRFRSON-SUMWQHHRSA-N	446.386	1.683	50	20	IDGD	
Cc1ccc(C(=O)C(=O)N2CCC(OC3CCN(C(=O)[C@H](O)CCl)CC3)CC2)cc1	1836718706	AJGSGALWZPLFLZ-LJQANCHMSA-N	436.936	1.776	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cn4ccsc4n3)CCO2)C1	1837045504	YUVAYYZYYNOELR-IFXJQAMLSA-N	440.953	1.873	50	20	IDGD	
CCc1noc(C)c1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)Br)C2)C1	1838060316	IKSPRABFGVQDKG-KPZWWZAWSA-N	444.326	1.399	50	20	IDGD	
COCc1oncc1C(=O)N1CCC(OC2CCN(C(=O)[C@@H](Cl)COC)CC2)CC1	1838166371	DPRVBGBGWHKWQR-KRWDZBQOSA-N	443.928	1.687	50	20	IDGD	
COCc1c[nH]c(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)c1	1838519102	ZTGJJSOZMKNQEW-OALUTQOASA-N	448.347	1.467	50	20	IDGD	
Cc1ccc(O)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)c1	1838894447	TYGQIGPFZFFZLX-AUUYWEPGSA-N	441.322	1.554	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(F)c3F)CCO2)C1	1839000273	XCIARHHFSRMMIM-KZULUSFZSA-N	447.276	1.818	50	20	IDGD	
CCCOc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)cc1	1839011072	JMGCQYYSQFVSEC-NQIIRXRSSA-N	440.924	1.145	50	20	IDGD	
Cc1cccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)c1	1839202031	RNIKEVSPOUNZJK-MAUKXSAKSA-N	429.286	1.756	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(C)c(O)c3)CCO2)C1	1839269175	GMKCRNTYWNHWOA-UZLBHIALSA-N	426.897	1.024	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3CCC(F)(F)CC3)C2)C1	1840150284	IALLRVFPFUJGCC-MAUKXSAKSA-N	438.899	1.522	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4ncccc4c3)C2)C1	1840152704	PXUZLWIFMRHUFI-XMSQKQJNSA-N	447.919	1.559	50	20	IDGD	
Cn1cc2cc(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)C(Cl)Cl)CCO4)ccc2n1	1840189994	WNZGRWKVZJRNBS-LJQANCHMSA-N	441.315	1.447	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)CCCn3ccnc3)CCO2)C1	1840383714	AFGSDLGFAGCPHQ-MOPGFXCFSA-N	447.363	1.356	50	20	IDGD	
COc1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)c1C	1840645152	GPAVAGKPYJTVCB-IBGZPJMESA-N	431.316	1.877	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC12CN(C(=O)c1cccc3c1NC(=O)C3=O)C2	1841287399	KXXFPPUREQQNDW-NSHDSACASA-N	434.290	1.669	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)c1ccn(C)c1)C2	1844692101	HXHDZUZSDGONBA-UHFFFAOYSA-N	426.429	1.989	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC12CN(C(=O)/C=C/C(=O)NCc1ccccc1)C2	1846175457	ZMLKXMOPGWPSEW-HVHJFMEUSA-N	434.334	1.846	50	20	IDGD	
CC[C@H](NC(C)=O)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)/C(C#N)=C/c1ccc(F)cc1F	1847297993	CNPQESTXMSAACB-ORCPSTMUSA-N	430.455	1.988	50	20	IDGD	
O=C(CNC(=O)NNC(=O)c1nn(-c2ccccc2)cc1O)Nc1ccc(F)c(F)c1	11761983	SRIAZYXGLKBMNQ-UHFFFAOYSA-N	430.371	1.439	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)Cn2cc(C(F)(F)F)ccc2=O)c2ccccc2c1=O	22629472	ZFYNFRADTZGVLN-UHFFFAOYSA-N	449.389	1.448	50	20	IDGD	
Cc1nc2c(c(C)nn2C)c(C)c1CCC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	23690337	QAXVMSCKEYOAPK-UHFFFAOYSA-N	433.476	1.263	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)NCCC(=O)NNC(=O)COc2cccc(C)c2)cc1	28581106	SEJYIMBWUZNNOS-UHFFFAOYSA-N	433.486	1.092	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cc(OC)c(C)c(OC)c2)cc1OC	28864215	LWWLVEQBEMNASW-UHFFFAOYSA-N	432.429	1.647	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCCC[C@H]2[C@H](C)NC(=O)OC(C)(C)C)n1	726598209	BPGZHFGLNFEXRL-GJZGRUSLSA-N	439.582	1.909	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCC[C@H](CN(C)C(=O)OC(C)(C)C)C2)n1	727137620	FARKHKDRNRLUDY-OAHLLOKOSA-N	439.582	1.720	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3cnn(C)c3C(F)F)cc2)CC1	728213871	DTXUMMDRJQSPQP-UHFFFAOYSA-N	428.465	1.051	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)[C@@H]2CCCN(S(=O)(=O)c3ccc(F)cc3)C2)c1	728828141	HOIUNQGUBKMICX-MRXNPFEDSA-N	430.461	1.559	50	20	IDGD	
Cc1cc(=O)c(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)nn1-c1ccccc1	728847433	FFAXLJNEZBUKBA-UHFFFAOYSA-N	433.472	1.009	50	20	IDGD	
O=C(NN=c1cc[nH]c2ccccc12)c1cccc(S(=O)(=O)NC[C@@H]2CCCO2)c1	730288440	JCMWUGVTJVEVPZ-INIZCTEOSA-N	426.498	1.871	50	20	IDGD	
CSCC[C@H](C(=O)NNC(=O)COc1ccccc1O)N1C(=O)c2ccccc2C1=O	730780478	WTPNUFGUJHAGDX-OAHLLOKOSA-N	443.481	1.336	50	20	IDGD	
Cc1csc([C@@](O)(CC(=O)NNC(=O)CCN2C[C@H](C)O[C@H](C)C2)C(F)(F)F)n1	732260594	VRMZRSCYRRBXCF-OZVIIMIRSA-N	438.472	1.238	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CN2CCN([C@@H](CO)c3ccc(Cl)cc3)CC2)cc1	732667305	OFWLGUNYXUJLID-FQEVSTJZSA-N	430.936	1.761	50	20	IDGD	
CN(C)c1ncc(Br)cc1C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	733218143	RVJFMXZDOVXAAM-UHFFFAOYSA-N	441.307	1.388	50	20	IDGD	
Cc1cccc(-n2c(NNC(=O)CN3CCCS3(=O)=O)nc3ccccc3c2=O)c1C	733264639	PLXWOHBVJKKHIE-UHFFFAOYSA-N	441.513	1.481	50	20	IDGD	
CC(=NNC(=O)NCCNC(=O)OC(C)(C)C)c1ccc(S(=O)(=O)N(C)C)cc1	734304057	QDIZGXJUQUMJPL-UHFFFAOYSA-N	427.527	1.485	50	20	IDGD	
C[C@H]1CN(C[C@H](C)C(=O)NN=Cc2ccccc2OCC(=O)NCC2CC2)C[C@@H](C)O1	734746580	ZUIUPJVPCMDNOK-OKZBNKHCSA-N	430.549	1.787	50	20	IDGD	
Cc1cc(NNC(=O)[C@H](NS(=O)(=O)c2ccc3c(c2)OCCCO3)C(C)C)nc(C)n1	736717227	VKHNCJMYXGMSIY-LJQANCHMSA-N	449.533	1.701	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)C[C@H]2Oc3ccccc3NC2=O)cc1C	736764200	JQMDXSYYRUUMEX-CQSZACIVSA-N	431.470	1.713	50	20	IDGD	
CCc1cc(NNC(=O)Cn2c(=O)n(CC)c(=O)c3ccccc32)nc(-c2ccccn2)n1	738538187	GJKKARFTOGUSAW-UHFFFAOYSA-N	445.483	1.741	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCc2c[nH]nc2C1)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	742511159	NXOFAIYNVDKZLB-GOSISDBHSA-N	442.483	1.678	50	20	IDGD	
O=C(Cc1cc(O)nc(O)n1)NN=Cc1cc(Br)c(O)c(Br)c1	743447952	SYLFVYPFKLPHNR-UHFFFAOYSA-N	446.055	1.811	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CSc1nnc([C@H]2CCCCO2)n1N	743455095	IHRSYXJVCLCDDV-CYBMUJFWSA-N	440.913	1.449	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)N[C@H]1CC(=O)N(CCOc2ccccc2)C1	743509907	MVXLFYLLFPLUIM-INIZCTEOSA-N	436.472	1.267	50	20	IDGD	
Cc1cc(C)c(S(=O)(=O)N2CCC(C(=O)NNC(=O)N3CCOCC3)CC2)c(C)c1	745996403	WGCQJDWUXVVOIF-UHFFFAOYSA-N	438.550	1.086	50	20	IDGD	
O=C(COC(=O)CC[C@@H]1Cc2ccccc2NC1=O)NNC(=O)c1cccc([N+](=O)[O-])c1	746922607	KDRKCCJIAQESCS-OAHLLOKOSA-N	440.412	1.490	50	20	IDGD	
CSCC[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)NNC(=O)c1ccc(C#N)cc1	747175990	VQICGMIFLIZTMD-QGZVFWFLSA-N	441.469	1.779	50	20	IDGD	
O=C(COc1ccccc1-c1ccccc1)NNC(=O)CS[C@H]1CCS(=O)(=O)C1	747470712	ZQKNPTKCGHAHSU-INIZCTEOSA-N	434.539	1.800	50	20	IDGD	
NC(=O)NCc1ccc(C(=O)NNc2ccc(S(=O)(=O)Nc3nccs3)cc2)cc1	747943053	CBWIVRFOANGINV-UHFFFAOYSA-N	446.514	1.869	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)N2CCC[C@@H]2C(=O)NNc2ccc(C#N)cc2)o1	748100824	AGHCHRZFEJJIEK-OAHLLOKOSA-N	432.458	1.624	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2cnn(C3CCOCC3)c2)ccc1OC(C)C	749753922	BYAMFQSDPKMURB-UHFFFAOYSA-N	438.506	1.654	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)Cn3cc(Br)c(O)nc3=O)cc2C1	751442527	KLHCGKRZHJMKDI-QMMMGPOBSA-N	441.307	1.359	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(/C#N)C(=O)N2CCC(O)(CN3CCOCC3)CC2)c1C	752740558	OLUBVDPCUHCALV-MAGMUUGSSA-N	444.576	1.905	50	20	IDGD	
COc1cccc([C@H](C)CC(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)c1	753276004	CABPQVKRQSFPEP-LLVKDONJSA-N	425.894	1.951	50	20	IDGD	
COCCCOc1cc(C)ccc1CNC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	755240792	LIICDEFUVPTWTR-UHFFFAOYSA-N	449.529	1.958	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)Nc2cccc(C(=O)NCCC(N)=O)c2)c1C	756392147	MBSZMIUATHXRIE-OAHLLOKOSA-N	441.488	1.529	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)Nc2ccc(OCC(=O)NC)cc2)cc1	756441344	KQSISDZCRFTTIS-CQSZACIVSA-N	430.461	1.830	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)Nc1ccc(C[C@H]2CC(=O)NC2=O)cc1	756815875	OSCXGKFXTHOWBZ-AWEZNQCLSA-N	426.429	1.132	50	20	IDGD	
CS(=O)(=O)Cc1cc(F)ccc1NC(=O)NNC(=O)c1nnc(O)c2ccccc12	757676450	AEYXZZHSTYRTRI-UHFFFAOYSA-N	433.421	1.486	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)Nc1cc(Br)c(=O)n(C)c1	757678309	NCJMATSDSBSYGV-SECBINFHSA-N	427.230	1.907	50	20	IDGD	
CC[C@@H](C)NS(=O)(=O)c1cccc(NC(=O)NNC(=O)COc2ccccc2C#N)c1	757709184	LREIDPFXXVEDLH-CQSZACIVSA-N	445.501	1.867	50	20	IDGD	
C[C@H]1CCCN(S(=O)(=O)c2cc(C(=O)NNc3nc(O)c4ccccc4n3)n(C)c2)C1	758298922	OJJVPCMJQJOXNK-ZDUSSCGKSA-N	444.517	1.851	50	20	IDGD	
CN(NC(=O)c1cccc(-n2cccn2)n1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758785764	FQOTXHVYGPTGEX-UHFFFAOYSA-N	429.481	1.517	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)N1CCC[C@@H]1C(=O)NNC(=O)C(=O)Nc1ccccn1	758831919	FGCKBHLZGFRVJP-CQSZACIVSA-N	445.863	1.134	50	20	IDGD	
CC(C)CNS(=O)(=O)c1ccc(CNC(=O)NNC(=O)COCc2ccccc2)cc1	759661285	FLOGFTXTWKLXBI-UHFFFAOYSA-N	448.545	1.668	50	20	IDGD	
CC1(C)C(=O)N(C[C@](C)(O)C(=O)NNC(=O)Cn2ccc3ccccc32)c2ccccc21	760275189	CBKBRSVAGCUJQP-DEOSSOPVSA-N	434.496	1.864	50	20	IDGD	
CCCCn1ncc(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)c1CC	760462831	KKMNTZDEEICYIY-UHFFFAOYSA-N	448.593	1.939	50	20	IDGD	
CN(C1CCCCC1)S(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)C(C)(C)C)cc1	761064037	RNGMEWJMEKBGDK-UHFFFAOYSA-N	438.550	1.772	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCc2cccnc2OCC(F)F)cc(OC)c1OC	763453661	NABGCXZHVVYPCO-UHFFFAOYSA-N	440.403	1.896	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2Br)cn1	763483428	SCHFIUDDQQIXCX-UHFFFAOYSA-N	437.250	1.269	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc3ccccc3cc2O)cc1	763522788	QRPFYHFKUZLBKA-UHFFFAOYSA-N	427.438	1.349	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)C(=O)Nc1ccc(-c2nnc3n2CCCC3)cc1	763559981	XUSGMDXILMFFMB-UHFFFAOYSA-N	448.439	1.410	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(CC(F)(F)F)c2)cc1	763660213	ZQYFGJXAAJOGQE-UHFFFAOYSA-N	425.363	1.965	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(F)cc1OC(F)F	763662885	BZBYGNKWZWYBRV-UHFFFAOYSA-N	427.335	1.601	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(CS(C)(=O)=O)c2)cc1C	763665291	SKDZYQIRJUMKOM-UHFFFAOYSA-N	433.486	1.013	50	20	IDGD	
CC(=O)Nc1cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)ccc1Cl	763864938	MFAFKSXYURHFMJ-SNVBAGLBSA-N	436.827	1.991	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(C(C)=O)cc2)c(OC)c1	763872615	OZIJUEMSIQZZMA-ZDUSSCGKSA-N	429.429	1.460	50	20	IDGD	
C[C@@H]1Oc2ccc(NC(=O)C(=O)NNC(=O)c3cccc(Br)c3)cc2NC1=O	764062983	IGKRXDXHALTEFP-VIFPVBQESA-N	447.245	1.568	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(S(=O)(=O)c3ccc(F)cc3)cc2)n[nH]1	764097128	AEIHVFUIXOMHSI-UHFFFAOYSA-N	445.432	1.090	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)C(C)C)cc1NC(=O)C(=O)NNC(=O)CC(C)(C)C	764197910	IPTQZPZFSLMFIJ-UHFFFAOYSA-N	426.539	1.546	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)nn1-c1ccccc1	764204156	JUOSXQHUWKHIRH-UHFFFAOYSA-N	444.492	1.572	50	20	IDGD	
CON(C)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cccc(OC(F)F)c2)cc1	764251830	ZIXKSLMCKDFLBH-UHFFFAOYSA-N	436.371	1.321	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)c1cc(-c2cccnc2)nc2ccccc12	764343809	SITXZEVRJOAQEQ-UHFFFAOYSA-N	426.436	1.883	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)C(=O)Nc1cccc(CN2C[C@@H](C)O[C@H](C)C2)c1	764389741	WPMPMSKKYDLLMO-HZPDHXFCSA-N	425.489	1.399	50	20	IDGD	
O=C(Cc1cnn(-c2ccccc2)c1)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765737096	VYCJXANLILHOAC-UHFFFAOYSA-N	446.511	1.020	50	20	IDGD	
COC(=O)NNC(=O)c1cc(I)ccc1I	765842821	QFHRVUZHRQFSJO-UHFFFAOYSA-N	445.982	1.897	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@]1(C)CCCC[C@@H]1C(=O)NNC(=O)CNC(=O)c1cccnc1	766229964	ZCFMQKKVRJZNIY-VFNWGFHPSA-N	433.509	1.432	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3c(C)nn(CCCl)c3C)CC2)cc1	766643474	WYMYHLMPTSAUKO-UHFFFAOYSA-N	446.983	1.626	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NC[C@@H]2CCCS2(=O)=O)ccc1OCCC(C)C	767172772	BQGGGHKYSZVTMM-HNNXBMFYSA-N	427.523	1.641	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)C1	767778924	FPMNVXHSAWDPLI-YOEHRIQHSA-N	435.477	1.390	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](OCC(=O)NNC(=O)c2cc(Br)c[nH]2)C1	767816334	ZZZNVOPAJYUEAG-LBPRGKRZSA-N	445.314	1.954	50	20	IDGD	
COc1ccc2c(c1)OC[C@H](NC(=O)NNC(=O)c1cc(OC)c(OC)c(OC)c1)C2	768105479	MEDAYGSYQKJMIS-CQSZACIVSA-N	431.445	1.669	50	20	IDGD	
COc1ccc2c(c1)OC[C@H](NC(=O)NNC(=O)C1CCN(c3ncccn3)CC1)C2	768111538	HKDMUEFGFDBTEB-MRXNPFEDSA-N	426.477	1.036	50	20	IDGD	
CC(C)[C@H](NC(=O)OC(C)(C)C)C(=O)NCC(=O)NNC(=O)c1c[nH]c2ccccc12	768284074	BAIAHGPDVJOCDW-KRWDZBQOSA-N	431.493	1.594	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)CN1C(=O)N[C@@]2(CCCC(C)(C)C2)C1=O	768566459	RZKKDYHZEKUWIO-YEJXKQKISA-N	434.468	1.631	50	20	IDGD	
Cc1[nH]nc(C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c1Br	768620998	GYLJIBIHWJLCLR-UHFFFAOYSA-N	426.183	1.007	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)c3cccc([C@@]4(C)NC(=O)NC4=O)c3)n[nH]2)cc1	769282965	QRRWVUHETBDBAA-HSZRJFAPSA-N	446.467	1.769	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)NC[C@H](NC(=O)OC(C)(C)C)c3ccccc3)nc21	770402770	VYJFRSRSSWODJO-AWEZNQCLSA-N	442.480	1.961	50	20	IDGD	
COCCCS(=O)(=O)NCC(=O)NNc1ccc(Br)cc1C(F)(F)F	770955839	QKOUWLVFMVGZJN-UHFFFAOYSA-N	448.261	1.867	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)[C@H]1CC(=O)N(c2ccc(Cl)c(F)c2)C1	772235763	NRWZBEAIQRNFRK-NEPJUHHUSA-N	427.860	1.957	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)NCCNS(=O)(=O)c1ccc(C)s1	772629706	FXXKNKNTNANHFC-UHFFFAOYSA-N	446.938	1.641	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)CCn1c(=O)nc(O)c2ccccc21	772990250	MMLIJSAXSUWISC-LBPRGKRZSA-N	430.848	1.761	50	20	IDGD	
COc1cc(Cl)ccc1NC(=O)C(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	773499896	OBPKKNXHOMYAHD-UHFFFAOYSA-N	429.820	1.640	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)c2cc(Cl)sc2S(N)(=O)=O)cc1	773713174	NOGAHSITEKBVLT-SECBINFHSA-N	447.922	1.676	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1cc(-n2cnnn2)ccc1F	774008122	FUOQPSHXRRILPV-SNVBAGLBSA-N	447.814	1.008	50	20	IDGD	
COC(=O)c1cncc(C(=O)NNC(=O)c2cc(-c3ccc(OC)c(OC)c3)[nH]n2)c1	774332555	KMOHCMBKVQQWAO-UHFFFAOYSA-N	425.401	1.350	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)c2cc(Br)c[nH]2)cc1CC(=O)O	774605295	PSWUBTSGYGSHGZ-UHFFFAOYSA-N	432.252	1.036	50	20	IDGD	
COC(=O)c1cccc(CC(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)c1	776206637	XNWFYUUWGBSANS-UHFFFAOYSA-N	434.493	1.651	50	20	IDGD	
COc1cccc([C@H]2[C@H](C(=O)NNC(=O)c3cccc(OC)c3O)CC(=O)N2C2CC2)c1	776467231	KDYPEWMTBSJYTR-XLIONFOSSA-N	439.468	1.923	50	20	IDGD	
CCOC(=O)N1CCC[C@@H]([C@H](C)NC(=O)NNC(=O)Cc2nc3ccccc3n2C)C1	777266720	QHDWVBWJZQJYJS-LSDHHAIUSA-N	430.509	1.703	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNS(=O)(=O)c1cccc2c(C)ccnc12	777598049	ZRQGVYUFQFCNEF-UHFFFAOYSA-N	447.542	1.768	50	20	IDGD	
COC(=O)c1cc(Br)c(S(=O)(=O)NNC(=O)c2ccccc2OC)s1	777633497	ZDZPOPACXFUHSQ-UHFFFAOYSA-N	449.304	1.929	50	20	IDGD	
O=C(CN1CCC(CCCN2CCOCC2)CC1)NNC(=O)c1ccc([N+](=O)[O-])cc1	780330076	SUKDANZYRONWHT-UHFFFAOYSA-N	433.509	1.180	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)C(=O)Nc1ccc(Cl)cc1F	782896352	GMAGZCZZOQXVOV-UHFFFAOYSA-N	441.872	1.480	50	20	IDGD	
Cc1ccc(C(F)(F)F)cc1NC(=O)C(=O)NNC(=O)CNC(=O)c1cccs1	784003947	AOQVMYAOWSDMFG-UHFFFAOYSA-N	428.392	1.591	50	20	IDGD	
Cc1nc(N2CCOCC2)ccc1NC(=O)C(=O)NNc1nc(C(F)(F)F)cs1	785144127	GSWWPYYJBOJCGD-UHFFFAOYSA-N	430.412	1.784	50	20	IDGD	
Cc1nn([C@@H]2CCS(=O)(=O)C2)c(C)c1NC(=O)C(=O)NNc1ccc(Cl)c(F)c1	785179850	UONDBSYBKFVEOP-GFCCVEGCSA-N	443.888	1.734	50	20	IDGD	
O=C(COC(=O)[C@@H]1[C@H](C(F)(F)F)[C@H]2CC[C@H]1O2)NNC(=O)c1cccc([N+](=O)[O-])c1	785809308	YQFLQIVNGCDAPY-MHDGFBEUSA-N	431.323	1.255	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)CC2CCC3(CC2)OCCO3)cc1OC	788171894	VGEPZKHPCIAJEN-UHFFFAOYSA-N	436.461	1.331	50	20	IDGD	
O=C(NNC(=O)[C@H]1OCC[C@H]1c1ccccc1)C(=O)Nc1ccc(O[C@@H]2CCOC2)cc1	789809992	JVWMXGLEPUZASH-AABGKKOBSA-N	439.468	1.513	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@@H](C)n2ccc3ccccc3c2=O)c2ccccc2c1=O	791195717	TUWYSWCNSLHNDS-CQSZACIVSA-N	431.452	1.754	50	20	IDGD	
O=C(NNc1nc2ccccn2n1)[C@@H]1CCCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1	791243860	SFSSUUPTBDQERQ-CYBMUJFWSA-N	445.461	1.182	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)[C@@H]2CCN(CC(F)(F)F)C2)CC1	792186693	LKYJQTKXSUCYCY-GFCCVEGCSA-N	437.463	1.601	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1cc2ccccc2c(=O)n1C	794779094	DDOOIOMEFUTIIV-UHFFFAOYSA-N	427.486	1.215	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)[C@H]1CC(=O)N(c2c(F)cccc2F)C1	795181010	FTEFOIJDRCLJQC-LBPRGKRZSA-N	438.456	1.711	50	20	IDGD	
Cc1ccc(S(=O)(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)cn1	795280024	BKQSEPHTNGQCIL-UHFFFAOYSA-N	449.496	1.715	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNC(=O)C(=O)Nc1nc(C2CCC2)cs1	797368897	PPHMXJRWTYLTBM-UHFFFAOYSA-N	431.474	1.423	50	20	IDGD	
COCCCNC(=O)NNS(=O)(=O)c1cc(C(F)(F)F)ccc1Br	799122283	AGCZOMULWPCXNL-UHFFFAOYSA-N	434.234	1.997	50	20	IDGD	
CN1C(=O)COc2cc(NC(=O)C(=O)NNC(=O)Cc3cccc4ccccc34)ccc21	799258614	IADKMJKTCYSHMV-UHFFFAOYSA-N	432.436	1.524	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)N[C@H]1CCN(C(=O)Nc2ccccc2)C1	800983855	WRMHUHCHBCXLSO-INIZCTEOSA-N	427.461	1.711	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cn(-c3cccc(C(F)(F)F)c3)nn2)cc1	801106565	COZZLBCTJHXDEF-UHFFFAOYSA-N	432.362	1.994	50	20	IDGD	
COc1ccc(-n2cc(O)c(C(=O)OCC(=O)NNC(=O)c3cccc(C#N)c3)n2)cc1	801361519	GVNAMYLSSMSXHN-UHFFFAOYSA-N	435.396	1.076	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)c1ccccc1S[C@H](C)C(N)=O	801490351	LINXLTPQRSFRAV-CQSZACIVSA-N	429.498	1.508	50	20	IDGD	
Cc1nn(-c2cncc3nnnn23)c(C)c1CC(=O)NNC(=O)Nc1ccc(Cl)cc1	802017366	JGVKPDYGSYXJTP-UHFFFAOYSA-N	440.855	1.371	50	20	IDGD	
O=C(NCc1cccc(OCCN2CCOCC2)c1)NNc1ccc(-n2ccnc2)nn1	804990070	UUAISXMHLHVWIJ-UHFFFAOYSA-N	438.492	1.200	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1nc2c(Br)cccc2s1	806741190	RSNAWXKVVVNDDF-LURJTMIESA-N	436.313	1.149	50	20	IDGD	
N#Cc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)cc1Br	806974807	HBSOPWKMDHTBFF-UHFFFAOYSA-N	435.209	1.625	50	20	IDGD	
Cc1cc(I)cc(NC(=O)C(=O)NNC(=O)c2ncccc2C)c1	806978994	KNDOANOQHSQHCH-UHFFFAOYSA-N	438.225	1.703	50	20	IDGD	
CNS(=O)(=O)c1cc(NC(=O)C(=O)NNc2ncc(Cl)cc2Cl)ccc1F	806984817	WKEJDKWGNLTEIG-UHFFFAOYSA-N	436.252	1.517	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2csc(N3CCOCC3)n2)c(Cl)cc1F	806992654	JCDMGCKHJGJKQH-UHFFFAOYSA-N	441.872	1.480	50	20	IDGD	
CN(C)[C@H](CNC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)c1ccccc1Cl	807010284	YDQZFMOALFGBFN-QGZVFWFLSA-N	428.884	1.563	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCc2ccncc2OC[C@@H]2CCOC2)cc1OC	807615510	HYTNVYJXCLYAPI-CQSZACIVSA-N	430.461	1.658	50	20	IDGD	
CC(C)(C)C[C@@H](CC(=O)NNC(=O)c1ccccn1)C(=O)NNC(=O)c1ccccn1	809538901	VRIRBRMTQAUTIS-CQSZACIVSA-N	426.477	1.141	50	20	IDGD	
CCOC(=O)c1cccc(NC(=O)c2cccc(NC(=O)C(=O)NNc3cnccn3)c2)c1	810383301	ZDWQYXIGCKXLMP-UHFFFAOYSA-N	448.439	1.987	50	20	IDGD	
CC(C)CC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)NNC(=O)c1cc(-c2cccs2)[nH]n1	810584257	BIHCFGLJRFFWTK-AWEZNQCLSA-N	429.506	1.396	50	20	IDGD	
C[C@H]1Oc2ccccc2[C@H]1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	812432156	VHERNMNYQRXFIU-KUHUBIRLSA-N	444.513	1.937	50	20	IDGD	
O=C(NNC(=O)c1ccnc(-c2ncc[nH]2)c1)c1cccc(S(=O)(=O)N2CCCC2)c1	814194668	MGGYDVRSVINFSM-UHFFFAOYSA-N	440.485	1.331	50	20	IDGD	
CS(=O)(=O)C1(C(=O)NNC(=O)c2cc(-c3ccco3)nc3ccccc23)CCOCC1	814211549	JDNHUZQADAHILV-UHFFFAOYSA-N	443.481	1.850	50	20	IDGD	
CCOc1ccc(NC(=O)NNc2ncncc2F)cc1S(=O)(=O)N1CCOCC1	814524836	SDVPSGCCWWOVKC-UHFFFAOYSA-N	440.457	1.184	50	20	IDGD	
CN(Cc1ccccc1)c1ccccc1NC(=O)C(=O)NNC(=O)[C@@H]1CCc2nncn2C1	815692619	WCXDYHLZZWRANP-QGZVFWFLSA-N	447.499	1.263	50	20	IDGD	
Cc1coc(-c2cccc(NC(=O)C(=O)NNc3ccccc3S(=O)(=O)N(C)C)c2)n1	815751942	VNIFKGRMDNERNI-UHFFFAOYSA-N	443.485	1.982	50	20	IDGD	
Cc1nc2c(c(O)nn2C)c(C)c1CCC(=O)NNc1ccccc1S(=O)(=O)N(C)C	817053688	CAASAHDDVBKDTB-UHFFFAOYSA-N	446.533	1.617	50	20	IDGD	
Cc1nnnn1[C@@H](Cc1cccc(F)c1)C(=O)NNc1ccccc1S(=O)(=O)N(C)C	817054847	AXYMGJMZNDGSCD-KRWDZBQOSA-N	447.496	1.298	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)[C@H]1CC(c2ccccc2[N+](=O)[O-])=NO1	817055187	PZLSVFZMPGDFTD-MRXNPFEDSA-N	433.446	1.481	50	20	IDGD	
O=C(CNc1ccccc1)NNC(=O)CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1	823328001	UQPKDWYSDQLASO-UHFFFAOYSA-N	446.407	1.123	50	20	IDGD	
CN(C)N(C(=O)[C@@H]1CC(=O)N(c2cccc(Br)c2)C1)[C@@H]1CCS(=O)(=O)C1	914437342	HSJKPMJABXPWEP-IUODEOHRSA-N	444.351	1.294	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)CCCc2nnc(-c3ccccc3)o2)c1	915294861	ZANZNINYDFEFED-UHFFFAOYSA-N	428.470	1.924	50	20	IDGD	
CCC(CC)N1C[C@H](C(=O)OCC(=O)NNC(=O)c2cc(Cl)ccc2OC)CC1=O	915580578	QGHQINJAULXIJK-GFCCVEGCSA-N	439.896	1.690	50	20	IDGD	
C[C@@]1(NNC(=O)NC[C@H](c2c(F)cccc2Cl)N2CCCC2)CCS(=O)(=O)C1	916433856	XDRUHLUFMITQMN-CRAIPNDOSA-N	432.949	1.997	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2ccc(N3CCCC3)cc2)c1	916588391	TZUFCYLEERABHI-UHFFFAOYSA-N	445.545	1.681	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)NC[C@]2(N3CCOCC3)CCSC2)c1C	916636688	JQDQCFOVVJVUNT-LAUBAEHRSA-N	436.578	1.609	50	20	IDGD	
Cn1cc(/C=C\C(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)cn1	917108685	PKRDIEAEWUOTOZ-QXMHVHEDSA-N	428.452	1.653	50	20	IDGD	
CC(C)(C)C(=O)NNC(=O)c1ccc(NS(=O)(=O)c2ccc3nc(O)[nH]c3c2)cc1	917180448	VBPAZWVVUIGLTN-UHFFFAOYSA-N	431.474	1.876	50	20	IDGD	
N#Cc1ccc(S(=O)(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1Cl	917725577	OYTNMDQGGQZSOJ-UHFFFAOYSA-N	449.297	1.136	50	20	IDGD	
CC(C)(C)n1cc(C(=O)C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cn1	917904811	ZMANRGIGFKRDGR-UHFFFAOYSA-N	426.521	1.181	50	20	IDGD	
CCNC(=O)NNC(=O)/C(C#N)=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	920857492	OWXNSAYAIYPEOE-LCYFTJDESA-N	429.868	1.336	50	20	IDGD	
COc1cc(OC)cc(N2C[C@H](C(=O)NNC(=O)c3n[nH]c4c3CCCC4)CC2=O)c1	1116228589	NULQYLKSZXWZRR-GFCCVEGCSA-N	427.461	1.120	50	20	IDGD	
COc1ccc(S(=O)(=O)CCC(=O)NNC(=O)c2cncn2-c2ccccc2)cc1	1321490993	JDNXAADMGRARSX-UHFFFAOYSA-N	428.470	1.506	50	20	IDGD	
C[C@H]1CCCCN1C(=O)[C@@H](C)NC(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1	1339212074	IOIZXLJKOHMOGL-LSDHHAIUSA-N	439.557	1.753	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Br)C2)c1nc[nH]c1[N+](=O)[O-]	1778062774	RRKKJRQCEVBCIO-BPYAMOTFSA-N	448.249	1.136	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(CCN(C(=O)c3cc(-c4ccncc4)[nH]n3)C2)C1	1779594128	KULCWRJVAXPBAZ-OAQYLSRUSA-N	443.580	1.767	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H]3CC[C@H]4CCC(=O)N4C3)C2)C1	1781057375	OIESUHIQHDSWLU-QBTDHISASA-N	446.375	1.454	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)c3cnn4c3OCCC4)CCO2)C1	1781233773	DPLAOTTYJFWTQS-MSOLQXFVSA-N	431.320	1.345	50	20	IDGD	
Cc1nnc(CCC(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](F)Br)C3)C2)s1	1781325703	HRUCICHDFSCXSV-ZFWWWQNUSA-N	435.319	1.300	50	20	IDGD	
CC(C)(C)n1cc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)cn1	1781326745	SFHYAQZULZDYQV-DYVFJYSZSA-N	431.306	1.772	50	20	IDGD	
COC(=O)c1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](F)Br)C3)C2)cn1	1781329346	DWWJKMVUIBMASS-SUMWQHHRSA-N	444.257	1.002	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](F)Br)C3)C2)ncc1[N+](=O)[O-]	1781329898	NFYKCPPUXBURRT-BBRMVZONSA-N	445.245	1.432	50	20	IDGD	
Cc1ncc(/C=C/C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)s1	1781334275	JUXYOICTZHWKRR-PWFUPBTHSA-N	432.315	1.985	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H]1CCCCN1C)C2	1781997446	WRFIAPZSIGBZHH-YKTARERQSA-N	430.387	1.768	50	20	IDGD	
COc1ccc(CC(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](C)Br)C3)C2)cc1	1783533561	ZZLMUEFYQGYFIG-LIRRHRJNSA-N	425.323	1.851	50	20	IDGD	
Cc1cccc(C)c1NC(=O)C(=O)N1CCO[C@@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783947735	YMTKQZFMPVDHBF-LJQANCHMSA-N	428.316	1.876	50	20	IDGD	
O=C(Cc1ccc([N+](=O)[O-])cc1F)N1CCO[C@@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783949195	FWNGQQKZNXGJDP-KRWDZBQOSA-N	434.251	1.910	50	20	IDGD	
COC(=O)[C@@H]1CC[C@H](C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)Br)C[C@@H]32)C1	1784081718	BOLNZZWPABTNCT-IBPCWRJOSA-N	445.354	1.339	50	20	IDGD	
Nc1nc2cc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]4C3)ccc2s1	1784090315	YKIKYXQQSMFVJG-VIRABCJISA-N	438.937	1.072	50	20	IDGD	
CC1CCN(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCBr)C[C@@H]32)CC1	1784316494	TZXRGJRFRZTWRA-ULQDDVLXSA-N	430.387	1.483	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)c3ccccc3)[C@H]2C1	1786664848	ZAZPGWKNXFJVRU-HILJTLORSA-N	439.350	1.731	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(-c4ccc(O)nn4)cc3)C[C@@H]21)[C@H](F)Cl	1787449560	HHUNAJOHONRIMU-MRHSLFKSSA-N	448.882	1.977	50	20	IDGD	
O=C(CN1CCCCC1=O)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1	1788149397	NOBUNPSJRNCSMZ-UHFFFAOYSA-N	449.316	1.127	50	20	IDGD	
COC(=O)[C@H]1CC[C@@H](C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]3C2)C1	1788761927	HDXNITNYLPFGDL-FPSMNIFISA-N	440.613	1.407	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](N)c3ccccn3)C[C@@H]21	1789866727	XBCJFJRCAQDNNF-FBVCHZJASA-N	429.348	1.297	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)Cn3ccnc3)C[C@@H]21	1790964546	ZVKQQWOHAWEOPH-VIQHNZTISA-N	441.370	1.672	50	20	IDGD	
Cc1nccn1CCCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)Br)C[C@@H]21	1791571807	CDEJFMAXHOCHTG-IWCQGFGOSA-N	441.370	1.735	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1ccc(C2(NC(=O)[C@H]3CCCCN3C)CCC2)cc1	1791596077	NYNZDCDWQQFESS-LJQANCHMSA-N	429.565	1.978	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1ccc(C2(NC(=O)c3ccncc3O)CCC2)cc1	1791601034	GIXZUMDEHXOLNM-UHFFFAOYSA-N	425.489	1.908	50	20	IDGD	
COc1cnc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)CBr)C3)c(F)c1	1794449687	ISICUXJAYUCJPN-MCYUEQNJSA-N	444.301	1.464	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)c1cccc2ncccc12	1796189048	QGAFPSWLZSEFEV-REPLKXPHSA-N	429.285	1.480	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](F)Cl)C(C)(C)O	1796810776	AXAAOFAHDGGHNW-ITGHMWBKSA-N	435.924	1.823	50	20	IDGD	
COc1nc(C)ccc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Br)C2	1798248595	MWWKJMJJAPUQSO-GUIRCDHDSA-N	426.311	1.385	50	20	IDGD	
CCc1noc(C)c1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnccc1C(=O)NN	1798439910	NFUPFHAIJOWIRQ-BTTYYORXSA-N	426.477	1.110	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccnn1C(C)C	1798832987	MYWKEJKEDIGHDK-OSSGZSMMSA-N	439.520	1.850	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccnnc1)C2	1799220008	DXYXALRBAKRPHL-MUJYYYPQSA-N	439.428	1.876	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c(c1)CCCO3)C2)[C@H](F)Br	1799352463	XUHNYODPNIGHSP-FSDCSDTHSA-N	441.297	1.905	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1n[nH]c3c1CC[C@@H]3C)C2	1800641229	SIVCNDNJUHSUAT-YLLRLKMBSA-N	439.354	1.836	50	20	IDGD	
COc1cc(C)ccc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)Br	1800762472	BVFVCFIZRBZULD-ZJOBFFGXSA-N	425.323	1.990	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c(Cl)cncc1Cl)C2	1800973937	NKXZENXUTDZSHY-YJKIEOBBSA-N	436.723	1.845	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3ccc(OC)cc3[nH]1)C2	1800978008	JHNAQXDFIZTVTG-MVWRLGRASA-N	435.908	1.634	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc2ccoc12	1801101738	YJWKTDFOXXTCQW-MUJYYYPQSA-N	433.468	1.997	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(C(F)(F)F)nc1)C2	1802332618	BXBOWDNNBBYISW-QDMKHBRRSA-N	441.454	1.725	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1803689953	HNJMATASMWDLID-YZGWKJHDSA-N	443.740	1.489	50	20	IDGD	
COc1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)c(Cl)c1	1803738855	GRMZLKKTDAXEJH-BJWYYQGGSA-N	442.708	1.594	50	20	IDGD	
CCOC(=O)N1CCC(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](Cl)COC)C3)CC1	1804125708	BSNLHXNYRUBUQT-YYIAUSFCSA-N	429.945	1.747	50	20	IDGD	
C[C@@H](NC(=O)c1ccccc1)C(=O)N1CCC2(CCCN(C(=O)[C@@H](O)CCl)C2)CC1	1805529063	IJKVBKVCBWMBIS-AEFFLSMTSA-N	435.952	1.636	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)CS(C)(=O)=O)[C@H]1c1cccnc1	1808243374	DZRBMFCZHGHVJW-HJWJTTGWSA-N	429.970	1.786	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1CCN(C(=O)CS(C)(=O)=O)[C@@H]1c1cccnc1	1808297317	YTQUDZYDDBOAQB-LXZKKBNFSA-N	436.361	1.368	50	20	IDGD	
Cc1cc(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)cn1C	1808724678	WGJYHEXFTOAPBZ-SIKLNZKXSA-N	446.316	1.042	50	20	IDGD	
Cc1c(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](F)Cl)[C@H]2c2cccnc2)cn2[nH]cnc(=O)c12	1811303745	UPKHOSVSEQLONT-RRQGHBQHSA-N	446.870	1.580	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@H]1c1cccnc1)c1c[nH]c(=O)cn1	1811457799	ZQZCVQYUOLSPPA-TUKIKUTGSA-N	438.257	1.175	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)c2cc(O)n(C)n2)[C@H]1c1cccnc1	1812864448	HYBFXZQEQANGKO-RBOXIYTFSA-N	436.310	1.624	50	20	IDGD	
CCc1cc(C(=O)N2CC[C@H](CNC(=O)[C@@H](Cl)COC)[C@@H]2c2cccnc2)n(C)n1	1813033014	YWYDPQKYJJNBDC-AYBZRNKSSA-N	433.940	1.951	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)COc2cccnn2)[C@H]1c1cccnc1	1813390451	BZEJYZILGWLIGT-JTDSTZFVSA-N	433.896	1.210	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1CCc2nc(NC(=O)CSC(=N)N)sc2C1	1814717840	ZJIZCLUMXNBSBF-JGVFFNPUSA-N	434.385	1.713	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@](C)(O)C(F)(F)F)n[nH]1	1815533963	UKTKXUOEFBOALA-YVEFUNNKSA-N	448.446	1.088	50	20	IDGD	
Cc1noc(CC(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@@H](C)Br)CC3)n1	1815567677	VLJARBJDOHVDII-VXNVDRBHSA-N	428.312	1.773	50	20	IDGD	
C[C@@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCBr)n[nH]1)n1cnnn1	1816784582	JBMFSOFHQGDDBS-CMPLNLGQSA-N	425.291	1.435	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)C[C@@H]2CCCCO2)[nH]n1)c1ccc(B(O)O)cc1	1817470503	SUHCZVNQHJOUSL-HKUYNNGSSA-N	440.309	1.355	50	20	IDGD	
O=C1CCc2ccc(C(=O)Nc3cc([C@@H]4CCCCN4C(=O)[C@@H](O)CCl)[nH]n3)nc2N1	1817809129	KRPSRUXJHUDBOU-GJZGRUSLSA-N	446.895	1.595	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)C(=O)c2ccco2)[nH]n1	1822410376	IJIGYKAENKGIEV-AWEZNQCLSA-N	430.465	1.251	50	20	IDGD	
C[C@H](C(=O)N[C@@H]1CCc2nc(NC(=O)[C@](C)(Cl)CCl)sc2C1)n1cnnn1	1822869929	PAJLWAIZJTZCPR-KEMUVXCRSA-N	432.337	1.539	50	20	IDGD	
C=C(CC(=O)OCC)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](Cl)COC)CC2	1822930335	LBUFKXXOZXEVCT-RYUDHWBXSA-N	429.926	1.818	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@H](O)CCl)CC2)c1n[nH]c2cccc(F)c12	1824293083	MCSCHTZVQMZVKN-PRHODGIISA-N	437.884	1.984	50	20	IDGD	
CC[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCNC(C)=O)CC2	1825452144	XWSMOQSGWPAVAP-GHMZBOCLSA-N	431.356	1.755	50	20	IDGD	
CC[C@H](NC(C)=O)C(=O)N[C@H]1CCc2nc(NC(=O)[C@H](C)Br)sc2C1	1825631927	NEJDBWJGVPGGRA-LSJOCFKGSA-N	431.356	1.753	50	20	IDGD	
O=C(/C=C/c1ccco1)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827049952	AFSSYTJCBKFLQA-NELJVSICSA-N	436.317	1.906	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1	1828923851	CPJOFMAJAJKZBW-QZTJIDSGSA-N	435.956	1.936	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3c(F)cncc3F)C2)C1	1831652001	VOPPWKZHYDTMAV-ORAYPTAESA-N	431.867	1.837	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(C(=O)O)ncn2)CC1	1831828999	WYXSSCGXLFTUIX-PBHICJAKSA-N	438.912	1.662	50	20	IDGD	
CN1CCC[C@@H](C(=O)N2CCC([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)C1	1831873882	DIPXVKRSWRBUJV-WOJBJXKFSA-N	435.613	1.321	50	20	IDGD	
Cc1ncccc1CCC(=O)N1CCO[C@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1	1832636709	KAXOFHWIDHPCED-JOCHJYFZSA-N	449.624	1.631	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H]3CNc4ccccc43)CC2)CC1)[C@H](O)CCl	1833308860	AZXYLOQTRPOMDH-UYAOXDASSA-N	434.968	1.367	50	20	IDGD	
C#CCO[C@H](C)C(=O)NC1CCN(C2CCN(C(=O)[C@](C)(Cl)CCl)CC2)CC1	1833466818	SDNRCOZHFBJVPM-FOIQADDNSA-N	432.392	1.833	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3nccn3C)CC2)CC1	1834270832	DCEHFXRRKSBDMY-INIZCTEOSA-N	440.386	1.779	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(N2CCC(NC(=O)CC(C)C)CC2)CC1	1834412637	PSCNVJDVWNKZCE-YZSQISJMSA-N	444.580	1.738	50	20	IDGD	
CC[C@H](C)[C@H](N)C(=O)NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1	1834686345	CQLQJNXBGOGPRR-RCBQFDQVSA-N	435.382	1.622	50	20	IDGD	
Cc1noc(N)c1C(=O)NC1CCN(C2CCN(C(=O)[C@@](C)(Cl)CCl)CC2)CC1	1834701663	PVRCFNVYBHUZMC-IBGZPJMESA-N	446.379	1.987	50	20	IDGD	
O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)Cc1ccc(F)cc1)CCO2	1835048858	RBEQTFFVTLKHCB-IBGZPJMESA-N	443.313	1.610	50	20	IDGD	
CN(C)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836715104	JAIMMUCTMJQHOE-IBGZPJMESA-N	438.956	1.360	50	20	IDGD	
O=C(c1cc2cccnc2[nH]1)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836717145	KFNAFZFTZSGIBZ-SFHVURJKSA-N	434.924	1.775	50	20	IDGD	
O=C(COc1cc(Cl)ccn1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1837652973	NLLGYABLPCNFIP-RDJZCZTQSA-N	436.267	1.105	50	20	IDGD	
Cc1nc(C)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)o1	1838005969	HRWDEGBJLPCVNG-BBRMVZONSA-N	434.262	1.052	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cncnc3C)CCO2)C1	1838098557	SFEJHZYOPOQGDF-CRAIPNDOSA-N	441.326	1.029	50	20	IDGD	
Cc1cccc(Cl)c1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1	1839338868	ROONTSDFPFBHDU-BEFAXECRSA-N	431.316	1.318	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc4cccnn4c3)CCO2)C1	1839559515	LZVQIDDATASGHF-WIYYLYMNSA-N	434.924	1.812	50	20	IDGD	
CCc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)cc(C)n1	1840187667	PJOAQTOSDNAIQG-IBGZPJMESA-N	430.332	1.826	50	20	IDGD	
Cc1ccn2ncc(C(=O)N3CCOC[C@]4(C3)CN(C(=O)C(Cl)Cl)CCO4)c2c1	1840187755	UVITVPPVXGVODP-IBGZPJMESA-N	441.315	1.516	50	20	IDGD	
O=C(C(Cl)Cl)N1CCO[C@]2(COCCN(C(=O)C(Cl)(Cl)Cl)C2)C1	1840189845	ONITWMZSDSLGAP-LLVKDONJSA-N	428.527	1.617	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3c(C)cccc3F)CCO2)C1	1840652252	JKQXDWXFEAYTBS-FOIQADDNSA-N	428.888	1.458	50	20	IDGD	
COc1ccc(Cl)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)c1	1840653553	GHNLUYBWHJSHIS-QAPCUYQASA-N	435.279	1.953	50	20	IDGD	
COc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)ccc1F	1840683901	ZRXYFZIPCVILSP-GOSISDBHSA-N	435.279	1.708	50	20	IDGD	
N#Cc1ccc(CCC(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)cc1	1841006292	LTVOGVJCQSSFRQ-UHFFFAOYSA-N	432.484	1.007	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1ccc([N+](=O)[O-])o1)C2	1843415105	LGCORGOIRGNVJM-CIAFOILYSA-N	428.405	1.139	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H](O)[C@H](C(=O)N2CCCC23CN(C(=O)C(Cl)Cl)C3)C1	1845108864	VOLYMNSQYRBTFM-NEPJUHHUSA-N	436.336	1.221	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)[C@H](C)Oc2cccnc2)C1	1846626616	WODHGSLCHKUDNJ-JZCUADNKSA-N	438.488	1.186	50	20	IDGD	
CC(C)N(C)CC(=O)N1CCCC12CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1846711406	WPLQEHUBLCMSTQ-HNNXBMFYSA-N	430.977	1.662	50	20	IDGD	
CCN1CCN(c2ccc(C(=O)N3CCCC34CN(C(=O)[C@H](Cl)COC)C4)cc2)CC1	1846897968	NOZSUBJOMVEEBW-HXUWFJFHSA-N	448.995	1.899	50	20	IDGD	
CCOC(=O)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)[C@H](F)Cl)C2	1847043727	NNRRENOYSBXDNX-NEPJUHHUSA-N	435.880	1.181	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)c2cccc(N3CCCS3(=O)=O)c2)cc1	11238246	UUBFXUZUTJJARG-HNNXBMFYSA-N	447.513	1.854	50	20	IDGD	
CNc1ccc(C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1[N+](=O)[O-]	15901967	POOIXBASCXJGQD-UHFFFAOYSA-N	435.462	1.027	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)Cn1c(=O)cnc2ccccc21	23785724	HWVNLMWENBVMGQ-LBPRGKRZSA-N	445.273	1.774	50	20	IDGD	
C[C@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)NNC(=O)c2ccc3ccccc3n2)C1=O	27683518	AJCGXIJHLGEHBA-JOCHJYFZSA-N	435.415	1.602	50	20	IDGD	
Cc1noc(Cl)c1CCC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	109354775	APYUSXCCABUKPB-UHFFFAOYSA-N	440.909	1.815	50	20	IDGD	
CC(C)(C)NC(=S)NNC(=O)CNS(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1	726139917	RHBLKSRSSPZOCY-UHFFFAOYSA-N	446.904	1.931	50	20	IDGD	
CCc1ccc([C@H](C)C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1	727704473	MUJYMCPCOMJTLK-INIZCTEOSA-N	445.541	1.835	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)[C@@H]2CSCN2C(=O)CC(C)(C)C)c2ccccc2c1=O	728150859	MLZRZNAEDGGVMU-AWEZNQCLSA-N	431.518	1.032	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NN=C1C(=O)N(Cc2ccccc2Cl)c2ccccc21	728435547	DXZVDRJWTNLESG-LBPRGKRZSA-N	434.905	1.645	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN1c1ncnc2sccc12)[C@@H]1COc2ccccc2O1	728455432	PSWONTVRZIZBFR-BBRMVZONSA-N	425.470	1.648	50	20	IDGD	
O=C(NNC(=O)c1cccc(OC(F)F)c1)Nc1cccc(CN2C(=O)CNC2=O)c1	728593483	XDMHDIXVMPMHFD-UHFFFAOYSA-N	433.371	1.806	50	20	IDGD	
O=C(CCN1C(=O)[C@H]2CCCC[C@@H]2C1=O)NNc1ccc(S(=O)(=O)C(F)F)cc1	728976543	VANRZSYVZDSTAO-KBPBESRZSA-N	429.445	1.691	50	20	IDGD	
C[C@@H]1Oc2c(cccc2C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)NC1=O	729296740	CLTPDRMPGJOWTO-INIZCTEOSA-N	437.500	1.379	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@@H](C)N(C)C2CC2)c1	729617671	SESUWCVOVIEZDP-CQSZACIVSA-N	425.555	1.144	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)C[C@H](C)S(=O)(=O)c2ccc(F)cc2)cn1	729691626	JDUCQZYHNLPFRM-NSHDSACASA-N	426.495	1.799	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)[C@H]1CC(=O)N(c2ccc(F)cc2)C1	730218582	MFTJMGBMAOBITO-ZDUSSCGKSA-N	432.477	1.763	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)[C@H]1CCN(c2ccc3c(c2)OCCO3)C1=O	730512642	OODKGQFOYYBCFE-OAHLLOKOSA-N	441.440	1.046	50	20	IDGD	
N#CCNC(=O)COC(=O)/C(C#N)=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	731233114	DWLQTPBIJLSDAB-NTEUORMPSA-N	440.847	1.169	50	20	IDGD	
O=C(COC(=O)CCCc1ccc2c(c1)CC(=O)N2)NNC(=O)c1cccc([N+](=O)[O-])c1	732340232	CTBFRIUKTUASJU-UHFFFAOYSA-N	440.412	1.417	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NCc2ccc(N(C)S(C)(=O)=O)cc2)cc1	732475645	KRPMAUXFFHFUSE-UHFFFAOYSA-N	436.490	1.000	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)[C@H]1CCN(c2cc(Cl)ccc2Cl)C1=O	740849592	GKBPEDJGZJHJFZ-GFCCVEGCSA-N	429.304	1.799	50	20	IDGD	
O=C(NCc1ccc(N2CC=CC2)cc1)NNC(=O)c1csc(N2CCOCC2)n1	740903006	IPLANHNQYYSBBY-UHFFFAOYSA-N	428.518	1.500	50	20	IDGD	
CC(C)CNC(=O)N1CCC[C@@H](C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)C1	741283375	FYLKNKBPDKROCX-OAHLLOKOSA-N	428.493	1.417	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)[C@@H]2CCN(c3cccc(Cl)c3)C2=O)nc2ccccc21	742034601	QOAHWIKFTCWSER-HNNXBMFYSA-N	425.876	1.970	50	20	IDGD	
O=C(CCNc1ncc(C(F)(F)F)cc1Cl)NNC(=O)N[C@@H]1CCS(=O)(=O)C1	742056305	ZRNFAHDSTZPEEJ-SECBINFHSA-N	443.835	1.073	50	20	IDGD	
CS(=O)(=O)c1ccccc1-n1cc(NC(=O)NNC(=O)COc2ccccc2O)cn1	743184653	VIWBIYFHMGWBSJ-UHFFFAOYSA-N	445.457	1.213	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)NNC(=O)Nc1ccc(OC(F)F)cc1	743509156	YNVKTEMOQIJIFZ-UHFFFAOYSA-N	433.375	1.925	50	20	IDGD	
COc1ccc(CCC(=O)N2CCN(CC(=O)NNC(=O)c3cccc(C#N)c3)CC2)cc1	744390363	FFFACMLWQINCLR-UHFFFAOYSA-N	449.511	1.105	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)N[C@@H]1CC(=O)N(CCOc2ccccc2)C1	745846320	GISGKCNVSJNNPN-OAHLLOKOSA-N	427.417	1.219	50	20	IDGD	
Cc1cc(N2CC[C@H](NC(=O)NNC(=O)CCSc3ccc(F)cc3)C2=O)n(C)n1	745904934	FQACDVPQRIRUMF-HNNXBMFYSA-N	434.497	1.486	50	20	IDGD	
O=C(NNC(=O)N1CCOCC1)c1ccc2c(=O)n(-c3ccccc3F)c(S)nc2c1	745987780	GIDOSVWSMUXGPF-UHFFFAOYSA-N	443.460	1.500	50	20	IDGD	
CSCC[C@@H](C(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)N1C(=O)[C@H]2CCCC[C@H]2C1=O	746022145	ABTBECRFWLSMRV-XHSDSOJGSA-N	448.501	1.653	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@](C)(O)Cc2ccccc2)c1	746093671	SDRYUKAHODZXHP-OAQYLSRUSA-N	433.530	1.472	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)c1cccc(CN2CCN(C)CC2)c1	746094130	AXHNCLZOUYOYIR-UHFFFAOYSA-N	426.517	1.673	50	20	IDGD	
CCS(=O)(=O)CCOc1ccc(S(=O)(=O)NNC(=O)NC2CCCCC2)cc1	746352881	YCHSHYAFMUDBPM-UHFFFAOYSA-N	433.552	1.325	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)N[C@@H]1CCN(c2cccc(OC(F)(F)F)c2)C1	748636850	XYOINJZLGPIAOJ-QWHCGFSZSA-N	434.415	1.546	50	20	IDGD	
Cc1oc(-c2ccco2)nc1CC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	749562639	ZJLNZHBHGGTJHV-UHFFFAOYSA-N	432.458	1.497	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(C(=O)CNC(=O)NNC(=O)c2cc3ccccc3o2)CC1	749563700	LLEMBMSVTLXRFU-UHFFFAOYSA-N	445.476	1.456	50	20	IDGD	
CCOC(=O)c1sc(CNC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)nc1C	750673299	SQRISXJPGWGLIL-UHFFFAOYSA-N	444.473	1.664	50	20	IDGD	
COc1cc(C(C)=NNC(=O)CNC(=O)c2ccco2)ccc1S(=O)(=O)C(F)F	750937489	UAUWFWSCGRHSKM-UHFFFAOYSA-N	429.401	1.555	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1cnn(-c2ccc(Cl)cc2)n1	751547684	ZISXKUJRYGOPLE-UHFFFAOYSA-N	447.908	1.597	50	20	IDGD	
COc1cc(OC)cc(N2C[C@H](C(=O)NNC(=O)[C@@H](C)Oc3ccccc3F)CC2=O)c1	752270991	NFLYUAXWPIDADQ-ZIAGYGMSSA-N	445.447	1.811	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)N[C@@H]2CCCN(Cc3ccccn3)C2=O)c1C	753297050	FZYRFCLAQWMZCB-IEBWSBKVSA-N	439.516	1.987	50	20	IDGD	
CC(CN1Cc2ccccc2C1=O)=NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1	754911818	LMIVCVDEWJGVIT-UHFFFAOYSA-N	428.514	1.764	50	20	IDGD	
O=C(Cc1cc[nH]n1)NNC(=O)c1ccc2c(=O)n(CCc3ccccc3)c(S)nc2c1	755268553	LFSSRKMLTMTPPF-UHFFFAOYSA-N	448.508	1.655	50	20	IDGD	
C[C@@H](CS(=O)(=O)c1ccc(F)cc1)C(=O)NNC(=O)c1cnn(-c2ccccc2)c1	755310716	SHXOWQNYUWOXNO-AWEZNQCLSA-N	430.461	1.882	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)c2cccc(-n3ccnn3)c2)cc1	755395945	WIKUVHVIHSDHQO-UHFFFAOYSA-N	434.485	1.763	50	20	IDGD	
CCOCC(=O)NNC(=O)Nc1cc(S(=O)(=O)N2CCCCC2)ccc1OCC	755434572	MEXHABDBKCAIGK-UHFFFAOYSA-N	428.511	1.449	50	20	IDGD	
NS(=O)(=O)c1cc(F)cc(NC(=O)NNC(=O)CCSc2ccc(F)cc2)c1	756514405	GXBUJPRSLGEJNR-UHFFFAOYSA-N	430.458	1.947	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)Nc2cnn(-c3ccccc3S(C)(=O)=O)c2)c1	756704563	HWUITEAAHVNDRH-UHFFFAOYSA-N	443.485	1.816	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)Nc1cnn(Cc2ccccn2)c1	756739602	PPYHEHBLFHWEAR-UHFFFAOYSA-N	448.531	1.691	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2ccc(Cl)nc2)cc1	756785047	RTLRNYHHQFRYQO-UHFFFAOYSA-N	427.870	1.126	50	20	IDGD	
O=C1C[C@@H](Cc2ccc(NC(=O)NNC(=O)c3cc(-c4cccs4)[nH]n3)cc2)C(=O)N1	756814849	IEEOFCOYXLPVOA-GFCCVEGCSA-N	438.469	1.810	50	20	IDGD	
CCOC(=O)[C@H](C)NC(=O)c1ccc(NC(=O)NNC(=O)c2ccccc2O)cc1F	756818239	MSTSJMMMMDNFBI-NSHDSACASA-N	432.408	1.679	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N(C)CC[C@@H](C)O)cc1	756959835	UWEDYTOSINSMBD-UHVIJJLKSA-N	425.489	1.570	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)Nc1ccc(F)c(S(=O)(=O)NC2CC2)c1	757872203	WHDHWVLUJWERNR-UHFFFAOYSA-N	436.421	1.462	50	20	IDGD	
O=C(CSCC(=O)Nc1cccc(Br)c1)NNC(=O)Cc1cc[nH]n1	758073451	KRUMTZYGIUICMQ-UHFFFAOYSA-N	426.296	1.234	50	20	IDGD	
Cc1nc(-c2ccc(C(=O)N3CCN(S(=O)(=O)CBr)CC3)cc2)n[nH]1	758512035	GRTCAIAASJVKRZ-UHFFFAOYSA-N	428.312	1.220	50	20	IDGD	
O=C(c1cnn(-c2ccccc2Cl)c1)N1CCN(S(=O)(=O)CBr)CC1	758522466	ITEMQOXERGWHNJ-UHFFFAOYSA-N	447.742	1.966	50	20	IDGD	
O=C(NNC(=O)C(=O)Nc1ccccn1)NC1CCN(Cc2ccc(Cl)cc2)CC1	758686014	VXMMCXDGLXLYPG-UHFFFAOYSA-N	430.896	1.669	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)N1CCN(Cc2cccc(Cl)c2)C(=O)C1	758888161	UZEZDHWSEPTUIE-UHFFFAOYSA-N	430.892	1.942	50	20	IDGD	
CCNS(=O)(=O)c1ccc(CC(=O)NNC(=O)Cn2c(CC)nc3ccccc32)cc1	759357407	MGZVBWIPSYXAKQ-UHFFFAOYSA-N	443.529	1.287	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cccc(C3OCCO3)c2)cc1OC	759831041	YTYQEHKGFBBAHD-UHFFFAOYSA-N	430.413	1.367	50	20	IDGD	
Cc1cc(C(=O)NNS(=O)(=O)c2ccc([N+](=O)[O-])c(C(=O)O)c2)c2ccccc2n1	760334476	HIODNYCHVKNWHN-UHFFFAOYSA-N	430.398	1.773	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NCc2ccn3ccnc3c2)c2ccccc2c1=O	762396964	GZIFBIXPTUFPRY-UHFFFAOYSA-N	433.472	1.989	50	20	IDGD	
C[C@@H](O)c1cn(CC(=O)NNC(=O)c2cn(-c3ccccc3)nc2-c2ccccc2)nn1	762965450	YJKOELHSNUJSHG-OAHLLOKOSA-N	431.456	1.645	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)N[C@H]1CCO[C@H](C(C)(C)C)C1	763461010	QAZNAQLMMVBAOP-KBPBESRZSA-N	425.555	1.826	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)C(=O)Nc1ccc(Cl)cc1F	763530253	GQPJXHRCUOUUHC-UHFFFAOYSA-N	447.898	1.777	50	20	IDGD	
COCCn1ncc2ccc(NC(=O)C(=O)NNC(=O)c3cc(C)nc4ccccc34)cc21	763614802	JFDBQHMTKFAGSK-UHFFFAOYSA-N	446.467	1.939	50	20	IDGD	
Cc1ccc(Cn2cccc(NC(=O)C(=O)NNC(=O)COc3cccc(C)c3)c2=O)cc1	763629790	ICABNLCTJXSVCA-UHFFFAOYSA-N	448.479	1.678	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccc(-c2nnnn2CC)c1	763712100	KXUQVFICOAWMGK-UHFFFAOYSA-N	437.460	1.087	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)NC(=O)CS2	763871591	HSBKEZUACYRFLZ-JTQLQIEISA-N	432.433	1.423	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3ccc4c(c3)N(C)C(=O)CO4)cc2C1	763940520	SMOCIBZVTAVNGY-NSHDSACASA-N	442.497	1.628	50	20	IDGD	
CC(=O)NCc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Br)s2)cc1	763941169	OTHYYDOEQMZVHM-UHFFFAOYSA-N	439.291	1.546	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)C(=O)Nc1ccc(-c2ncco2)cc1	763949061	MUXTYNIXEFJEDW-UHFFFAOYSA-N	432.396	1.633	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc(F)c(N2CCCS2(=O)=O)c1	763957642	HYGNMFWDTLUKAT-UHFFFAOYSA-N	434.449	1.074	50	20	IDGD	
CCOc1ccc(C(=O)N2CCCCC2)cc1NC(=O)C(=O)NNC(=O)c1ccc[nH]1	763980703	ZNQLFLBDBVIVKI-UHFFFAOYSA-N	427.461	1.439	50	20	IDGD	
CCN(CC)C(=O)COc1cccc(NC(=O)C(=O)NNC(=O)c2ccccc2OC)c1	764048327	OWFONYMPVZAZOL-UHFFFAOYSA-N	442.472	1.342	50	20	IDGD	
CS(=O)(=O)Cc1ccccc1NC(=O)C(=O)NNC(=O)Cc1ccc2ccccc2c1	764084219	IUGCRMXNOSPRCI-UHFFFAOYSA-N	439.493	1.713	50	20	IDGD	
CCn1cc(NC(=O)C(=O)NNC(=O)c2ccc(F)cc2Br)ccc1=O	764085752	NWMGRTCKQIUFNG-UHFFFAOYSA-N	425.214	1.170	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(-c3nnc(C)o3)c2)o1	764138135	CQMBAURJCRLMCA-UHFFFAOYSA-N	440.460	1.880	50	20	IDGD	
CC(C)n1nnnc1-c1ccccc1NC(=O)C(=O)NNC(=O)[C@H]1Cc2ccccc2O1	764163076	HKMUKBGXFWAGKC-QGZVFWFLSA-N	435.444	1.011	50	20	IDGD	
C[C@@H](C(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)CC2CCCC2)cc1)n1cncn1	764179411	STJKDRHOWLQSGF-ZDUSSCGKSA-N	427.465	1.144	50	20	IDGD	
CN(C)CCOc1ccc(NC(=O)C(=O)NNC(=O)CCc2ccccc2)cc1Cl	764184637	AKXZRGYJKHWZTD-UHFFFAOYSA-N	432.908	1.999	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)C(=O)Nc1ccnn1Cc1ccccc1F	764280596	DJYHDXJZKOEZFA-UHFFFAOYSA-N	425.420	1.495	50	20	IDGD	
CC(C)(C(=O)NNC(=O)C(=O)Nc1ccccc1CN1C(=O)CCC1=O)c1ccccc1	764308543	DIBQVADMDQUZQR-UHFFFAOYSA-N	436.468	1.399	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1cccc(C2OCCO2)c1	764463961	IKAFHEMQZYVDFB-UHFFFAOYSA-N	433.486	1.510	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cc1	764514191	KRRZTGIVCWLAPM-UHFFFAOYSA-N	427.530	1.471	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)CCC(=O)N1CCN(c2ccccc2)CC1	764523485	HQVICBJHTCZHBP-UHFFFAOYSA-N	440.500	1.350	50	20	IDGD	
CC(=NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1)c1cccc(N2CCOCC2)c1	764828876	USGFRAOCVMJCHH-UHFFFAOYSA-N	449.555	1.821	50	20	IDGD	
COCCC(=NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)C1CCOCC1	764885481	JYTDLSDMYQHWME-UHFFFAOYSA-N	439.534	1.256	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNS(=O)(=O)c2cnn(-c3ccccn3)c2C)cc1	765031004	UJHHHKRJVUXIRT-OAHLLOKOSA-N	445.501	1.751	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cc1F	765426018	SFQDRHXQLJWATJ-UHFFFAOYSA-N	441.463	1.003	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2C[C@H]2c2cc(F)c(F)c(F)c2)c1	766631485	MJLYEPQYRRVXIV-UONOGXRCSA-N	441.431	1.919	50	20	IDGD	
CN(C)CC(=O)NNC(=O)CCC(=O)N1CCN(C2c3ccccc3-c3ccccc32)CC1	767946918	HXJVQHOCCLFUPQ-UHFFFAOYSA-N	449.555	1.390	50	20	IDGD	
COC(=O)NNS(=O)(=O)c1ccc(F)c2ncc(I)cc12	768264070	ZIRUPNVHDVMWTQ-UHFFFAOYSA-N	425.179	1.528	50	20	IDGD	
O=C(NNC(=O)c1ccc(F)cc1Br)NC1CCN([C@H]2CCC[C@@H]2O)CC1	769155936	PSXWNFNKZCDJOF-HOTGVXAUSA-N	443.317	1.910	50	20	IDGD	
Cc1cc(N2CC[C@H](NC(=O)NNC(=O)[C@H](C)Oc3cccc(Cl)c3)C2=O)n(C)n1	770648370	GDKMTQDPCWSKJQ-WFASDCNBSA-N	434.884	1.285	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)N2CCN(c3nccn4cnnc34)[C@H](C)C2)c1C	771495137	SDFOUKVRFRHGLS-SYERDGIWSA-N	448.531	1.833	50	20	IDGD	
CCn1c(=O)nc(O)c2c(C(=O)O[C@@H](C)C(=O)NNC(=O)CC(C)C)cc(C3CC3)nc21	771997012	XKVHNPRFGMNAEE-NSHDSACASA-N	445.476	1.133	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)c1ccc2c(=O)n3c(nc2c1)CCC3	772194733	CWCREDMVPGVDSU-UHFFFAOYSA-N	439.859	1.074	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)C1(OCc2ccccc2)CCOCC1	772697974	RQRXSAFDFONENJ-UHFFFAOYSA-N	436.509	1.608	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)[C@@H]1CCCN1C(=O)Cc1ccccc1	772896734	BOAXEZSCXBTJEK-SFHVURJKSA-N	442.903	1.337	50	20	IDGD	
Cn1cc(S(=O)(=O)N2CCOCC2)cc1C(=O)NNc1ncc(Cl)cc1Cl	775264208	KQPCZJMZXLPBCQ-UHFFFAOYSA-N	434.305	1.505	50	20	IDGD	
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	775686102	CPIGAVYBJHOYAQ-OXQOHEQNSA-N	425.489	1.856	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)nn1-c1ccc(Cl)cc1Cl	776292821	FHHQLLHRSOPRCE-JTQLQIEISA-N	431.301	1.683	50	20	IDGD	
CCNS(=O)(=O)c1ccc(CNC(=O)NNc2cccc(S(C)(=O)=O)c2)cc1	776626484	UNPXNKLJLOIUSE-UHFFFAOYSA-N	426.520	1.215	50	20	IDGD	
O=C(CCCOc1ccc(Cl)cc1Cl)NNC(=O)NCC(=O)N1CCOCC1	776639015	DSXXUBQZAATYKM-UHFFFAOYSA-N	433.292	1.342	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)nn1[C@@H](C)C1CC1	777418659	AQIUJKNLRIVXNT-KRWDZBQOSA-N	438.532	1.382	50	20	IDGD	
O=C(NNc1ccccn1)c1cc(S(=O)(=O)N2CCOCC2)ccc1N1CCCCC1	777473763	ZORGIHCUAJWAHC-UHFFFAOYSA-N	445.545	1.850	50	20	IDGD	
CN(C)C(=O)COc1ccccc1C(F)(F)C(=O)NNC(=O)c1ccc2c(c1)OCCO2	778555639	AUAUWGMCWAFIPR-UHFFFAOYSA-N	449.410	1.478	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)Nc2cnn(CC(=O)N3C[C@H](C)O[C@H](C)C3)c2)c1	780584251	LBZVHSFJPHGVJG-OKILXGFUSA-N	430.465	1.454	50	20	IDGD	
COc1ccc([N+](=O)[O-])cc1NS(=O)(=O)c1ccc(C(=O)NN=c2cc[nH]cc2)cc1	780759763	OUBSKJNGBLPQGT-UHFFFAOYSA-N	443.441	1.978	50	20	IDGD	
CC(=O)N1CCN(Cc2ccccc2NC(=O)NNC(=O)COc2ccccc2O)CC1	782077906	HHZPIFPDJHLIOS-UHFFFAOYSA-N	441.488	1.288	50	20	IDGD	
COc1ccc(C(=O)N2CCOCC2)cc1NC(=O)C(=O)NNc1ccc(F)cc1F	783346942	CIXJRPQJGZUCAU-UHFFFAOYSA-N	434.399	1.528	50	20	IDGD	
CSc1nnnn1-c1cccc(NC(=O)C(=O)NNC(=O)Nc2ccccc2C)c1	783416918	HTHVMMYSMYHHAQ-UHFFFAOYSA-N	426.462	1.484	50	20	IDGD	
CSc1cc2c(cc1NC(=O)C(=O)NNc1ccc(-n3cccn3)nn1)OCCO2	783437375	ZOXRNTXDUYESHU-UHFFFAOYSA-N	427.446	1.237	50	20	IDGD	
Cc1cccc(-n2nc(C(C)(C)C)cc2NC(=O)C(=O)NNC(=O)C(=O)N2CCCC2)c1	784000186	PXMSLGKTPMTHHI-UHFFFAOYSA-N	440.504	1.187	50	20	IDGD	
CC(C)(C)c1nc2cc(NC(=O)C(=O)NNC(=O)CNC(=O)c3ccco3)ccc2o1	784001734	CMFFXQXHDPMUTM-UHFFFAOYSA-N	427.417	1.234	50	20	IDGD	
CN1CCOc2ccc(NC(=O)C(=O)NNc3ccc(S(=O)(=O)NC4CC4)cc3)cc21	784216906	QUSRPMGYBUEVSV-UHFFFAOYSA-N	445.501	1.038	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)ccc1F	784231175	XNUJNOLPTFPNEA-UHFFFAOYSA-N	449.508	1.152	50	20	IDGD	
COc1ccc(C(=O)N2CCOCC2)cc1NC(=O)C(=O)NNc1ccccc1Cl	784774225	MLNZWWQXHCDOAX-UHFFFAOYSA-N	432.864	1.903	50	20	IDGD	
CNS(=O)(=O)c1ccc(C)c(NC(=O)C(=O)NNc2ccc(Br)nc2)c1	784809555	SAXWDAMBHLJNNR-UHFFFAOYSA-N	442.295	1.142	50	20	IDGD	
CSc1ccc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)NC(C)(C)C)cn1	784833640	QJNBNPJAQQHGQY-UHFFFAOYSA-N	437.547	1.962	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)ccc1C	784836121	QWYTUSFUDYXTMK-UHFFFAOYSA-N	441.412	1.860	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)C(=O)Nc2cccc([C@H](C)N3CCOCC3)c2)c1	784853932	RLNBWMLFAOJHOR-HNNXBMFYSA-N	426.473	1.948	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2cnn(-c3ccc(C)cc3C)c2)c1	786414386	NEFUGCLLURTOGY-UHFFFAOYSA-N	437.456	1.906	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)CCCc2cccs2)cccc1N1CCNC1=O	787549604	NXWIALXQQUYRLU-UHFFFAOYSA-N	429.502	1.695	50	20	IDGD	
O=C(CCC(=O)Nc1ccc2nc(O)[nH]c2n1)NNC(=O)c1ccccc1Br	787863467	QURNUERMRVXAJG-UHFFFAOYSA-N	447.249	1.606	50	20	IDGD	
CC(C)N1C(=O)C[C@H](C(=O)NNC(=O)N2CCN(C)CC2)[C@H]1c1ccc(Cl)c(F)c1	788168766	BVWCNVJEXXKMCK-KBXCAEBGSA-N	439.919	1.765	50	20	IDGD	
CC[C@@H](C)NS(=O)(=O)c1ccc(C(=O)NNc2ccccc2S(N)(=O)=O)cc1	788224246	RTSGFTLHQLHBNS-GFCCVEGCSA-N	426.520	1.168	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)C(=O)Nc2cc(C3(C)CCCC3)on2)c2ccccc2c1=O	789732565	RRWVJEBUTZPJJZ-UHFFFAOYSA-N	438.444	1.153	50	20	IDGD	
COc1ccc(CC(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)nc1	789991571	SFLWHYRZLSYEDZ-UHFFFAOYSA-N	431.924	1.251	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2nc(Br)ccc2F)c2ccccc2c1=O	792016011	IQFFDZKOCSZEPJ-UHFFFAOYSA-N	434.225	1.788	50	20	IDGD	
CNC(=O)c1cc2cc(NC(=O)C(=O)NNC(=O)c3cnn(-c4ccccc4)c3)ccc2[nH]1	792356795	ULFTUBTWARTTRV-UHFFFAOYSA-N	445.439	1.113	50	20	IDGD	
CC(C)c1c(NC(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)cnn1-c1ccc(Cl)cc1	792494705	FVVOUFFHHHLBEU-NSHDSACASA-N	442.929	1.740	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)c2cc(S(=O)(=O)N(C)C)ccc2F)cc1	794716953	ISEZHPBYNGTRES-UHFFFAOYSA-N	444.510	1.083	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)CCC(=O)c1ccc2c(c1)OCCO2	795169344	NQOKUJXGEKSMPO-UHFFFAOYSA-N	433.486	1.814	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(CN(C)C)c(Br)c2)n1	797370865	LOSAEYOUJAZPFM-UHFFFAOYSA-N	434.294	1.614	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)Nc2cnc(N3CCOCC3)c(Br)c2)n1	799249232	RXYJTHGPVUDNKP-UHFFFAOYSA-N	435.282	1.851	50	20	IDGD	
Cc1ccc(-c2ccnn2C)cc1NC(=O)C(=O)NNC(=O)Cc1cn2ccccc2n1	799261431	CTWQAOPNJIIBSE-UHFFFAOYSA-N	431.456	1.372	50	20	IDGD	
COc1cc(N2CCN(C(=O)NNC(=O)c3c(C)nc4ccccn34)CC2)ccc1F	801737845	KIHMMQPADYWWIX-UHFFFAOYSA-N	426.452	1.967	50	20	IDGD	
O=Cc1ccc(OCCn2cc(C(=O)NNC(=O)N=c3cc[nH]cc3)nn2)c(Cl)c1	802030398	COYNVCNBGNFGKW-UHFFFAOYSA-N	429.824	1.106	50	20	IDGD	
Cc1ccc2c(c1)C(=O)N([C@H](C)C(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)C2=O	802067082	KUIZEJWFCYINFR-GFCCVEGCSA-N	444.469	1.236	50	20	IDGD	
O=C(CNC(=O)c1ccc(Br)s1)NNC(=O)Nc1ccc2c(c1)OCO2	802102244	JAEPMUBDFPDCEK-UHFFFAOYSA-N	441.263	1.822	50	20	IDGD	
CCn1c(CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)nc2ccccc21	807070045	ORWULKUSDOFQHP-UHFFFAOYSA-N	429.506	1.494	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)Cc1ccc(S(=O)(=O)N2CCCC2)s1	808045343	ILIWINJMLWNNCF-UHFFFAOYSA-N	433.552	1.012	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2cccc([N+](=O)[O-])c2Cl)c1	809914255	DHAODYCVCSNFQO-UHFFFAOYSA-N	441.853	1.965	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(Br)s1)NNc1cccnc1Cl	810494014	LSYUBTPTLVQPCH-UHFFFAOYSA-N	425.717	1.981	50	20	IDGD	
C[C@]1(CNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)OCCc2sccc21	811873993	FBEWIDOZQGXBOW-HXUWFJFHSA-N	430.534	1.573	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)N2CCN(c3ccccc3)CC2)cc1OC	812450828	RZEXTQPJAOTQKJ-UHFFFAOYSA-N	440.500	1.594	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NC[C@@]2(C)OCCc3sccc32)c2ccccc2c1=O	812550404	BMZLTVCSJXELCV-HXUWFJFHSA-N	427.486	1.427	50	20	IDGD	
CCc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	813033688	GUZHYKPFIDAVPO-UHFFFAOYSA-N	435.462	1.489	50	20	IDGD	
Cc1nc(-c2cccc(NC(=O)C(=O)NNc3ccc(S(=O)(=O)N(C)C)cc3)c2)n[nH]1	813034068	XJJCCKJIHWPIFD-UHFFFAOYSA-N	443.489	1.112	50	20	IDGD	
COC(=O)c1cc(Br)cc(C(=O)NNC(=O)C(=O)Nc2ccc(C)cc2)c1	813373995	ORIRMVYAEKPGGJ-UHFFFAOYSA-N	434.246	1.944	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@H](C)Cc2cnc3ccccc3n2)c2ccccc2c1=O	814729422	PHALQLYQRLRHHE-CQSZACIVSA-N	430.468	1.999	50	20	IDGD	
CC(=NNC(=O)[C@H](C)NS(C)(=O)=O)c1nnn(-c2cccc(Br)c2)c1C	814835337	NVWXBWJJXWRSIZ-JTQLQIEISA-N	443.327	1.116	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)C(=O)Nc1ccc(Br)c(C2CC2)n1	815564943	XXXHVJPOGVMPQB-UHFFFAOYSA-N	447.245	1.850	50	20	IDGD	
Cc1c(C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)cnn1-c1cccc(C(F)(F)F)c1	818950288	RFZPCINBBMRZHW-NSHDSACASA-N	430.408	1.395	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)[C@@H]2CC(=O)N(c3cc(C)ccc3OC)C2)cc1	825529272	FNMHEOXRUOGMNT-OAHLLOKOSA-N	426.473	1.625	50	20	IDGD	
COc1ccc(-c2noc(CCC(=O)NNC(=O)CNc3ccccc3OC)n2)cc1	825649314	KYZDMUMKPUATGS-UHFFFAOYSA-N	425.445	1.946	50	20	IDGD	
Cc1cc(C(=O)NNS(=O)(=O)c2cc(C(=O)O)cc(C(=O)O)c2)c2ccccc2n1	831920311	FHNDKGDYGCADLY-UHFFFAOYSA-N	429.410	1.563	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)CNS(=O)(=O)c2ccc(C)cc2)cc1	912839827	BEHFLNGKTCPGTC-HNNXBMFYSA-N	435.502	1.287	50	20	IDGD	
O=C(COC(=O)[C@H]1CC(=O)N(c2ccc3c(c2)CCC3)C1)NNC(=O)c1cccs1	914634052	BIBFNLKKBPOXOQ-HNNXBMFYSA-N	427.482	1.594	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)NCc2ccc(N3CCN(C)CC3)nc2)cc1OC	916245469	BAQXLEREOHPXBY-UHFFFAOYSA-N	442.520	1.385	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)N[C@H]2CCc3nc(C)ncc3C2)c2ccccc2c1=O	916319429	RNWATEZFAIZOKF-INIZCTEOSA-N	449.515	1.797	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)N[C@H]1CCCN(Cc2ccccc2)C1	916607781	QKGCWVNWFIMUMR-KRWDZBQOSA-N	427.461	1.969	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)CNC(=O)c2ccoc2C)c2ccccc2c1=O	916735957	QTCYVOAZFQKREU-UHFFFAOYSA-N	439.472	1.679	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2cc(C)c(C(=O)O)s2)cc(OC)c1OC	917718070	UMVUSIOGFUXRQO-UHFFFAOYSA-N	430.460	1.404	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNS(=O)(=O)c1ccc(CCNC(C)=O)cc1	917721406	YFTIJUPQXKDVRZ-UHFFFAOYSA-N	435.502	1.152	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NCCCCn2ccnc2)c2ccccc2c1=O	918139774	YCFNULQVLZZXHV-UHFFFAOYSA-N	425.493	1.818	50	20	IDGD	
CCOCCO[C@H](C)C(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	918142176	DVHBNAMBHJIUHS-MRXNPFEDSA-N	438.484	1.647	50	20	IDGD	
CC(C)CN1CCO[C@H](CNC(=O)NNC(=O)c2ccc(F)cc2Br)C1	918188524	LIUUXMPATBUIAT-CYBMUJFWSA-N	431.306	1.889	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(C(=O)NNC(=O)c2cc(Br)c[nH]2)ccc1F	918690361	PLGFPOQCJDOGSJ-UHFFFAOYSA-N	433.259	1.241	50	20	IDGD	
CCN(Cc1ccccc1)C(=O)CNC(=O)NNC(=O)C(=O)Nc1ccc(C)c(C)c1	920051001	IKGKIANZRNTIEP-UHFFFAOYSA-N	425.489	1.621	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2nc(S(C)(=O)=O)n3ccccc23)ccc1OC(C)C	920275283	SWQRIXPGCQWTDF-UHFFFAOYSA-N	446.485	1.608	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)Nc1ccc(CN2C(=O)CNC2=O)cc1	920933505	SKOMACAQGWVSHO-LBPRGKRZSA-N	429.408	1.498	50	20	IDGD	
CC1(C)CC(=O)C(=CNNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)C(=O)C1	920976145	QWKURIZXRXPMSP-UHFFFAOYSA-N	433.530	1.938	50	20	IDGD	
Cc1cc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c2ccc(F)cc2n1	1115982644	QVWXZSGJZCNLJM-LJQANCHMSA-N	439.399	1.827	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CNS(=O)(=O)c2cccc(C(F)(F)F)c2)cc1	1248407199	GCRJRCBESLCIIY-UHFFFAOYSA-N	431.392	1.454	50	20	IDGD	
Cc1c(NC(=O)[C@@H](C)SCC(=O)NNc2cccnn2)c(=O)n(-c2ccccc2)n1C	1320054232	RCDAGAFSKBTMEV-CQSZACIVSA-N	441.517	1.478	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCN(c2ccccc2Br)C1=O)c1n[nH]c2c1CCCC2	1321707260	YBKLLNUMPUNNER-GFCCVEGCSA-N	446.305	1.865	50	20	IDGD	
N#CCOc1cccc(CNC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c1	1321814381	LXGAVEWAZGOSRU-UHFFFAOYSA-N	436.516	1.632	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4cc(OC)ccc4n3)C2)C1	1777900356	RRAPQCQSIDJDPK-VGSWGCGISA-N	447.919	1.941	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2)c1ccc2c(c1)OCCO2	1778442193	ZINYLURQHPQETE-RRMPHLOHSA-N	438.908	1.185	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2)c1ccc2cnccc2n1	1778530206	AFKQKFAMQVGSEI-DBXWQHBBSA-N	432.908	1.357	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccn4cncc4c3)C2)C1	1778653138	JHZUKZRRIPCATM-AUUYWEPGSA-N	435.322	1.809	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccc(OC(F)F)cn1)CCO2	1779296264	MFAREUPZMKYICA-LJQANCHMSA-N	443.523	1.978	50	20	IDGD	
CC[C@H](NC(C)=O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@](C)(Cl)CCl)C1	1780706232	UEELFENGFWUFMF-QGWWYQLQSA-N	436.380	1.651	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](F)Br)C2)nn1	1780773323	AAUUUUMMOOKKCK-HACGYAERSA-N	445.289	1.303	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H]3CC=CCC3)C2)C1	1781153259	DXYLYYYRDANWEX-KTUMRIBQSA-N	427.505	1.307	50	20	IDGD	
O=C(CS[C@@H]1CCCCO1)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781331477	LJHQRYTUPZXQAX-FMKPAKJESA-N	439.347	1.767	50	20	IDGD	
CCOc1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)nn1	1781333248	FIBXVDAUDQMQIS-CZUORRHYSA-N	431.262	1.009	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H]2[C@H]3COC[C@H]32)C1	1782800854	RJHNMVUYQVBAAV-ROMBUNGYSA-N	429.355	1.566	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)Cn3cc(Cl)cn3)CCO2)C1	1783342200	JKMWXLVPQQVVPH-CZUORRHYSA-N	433.734	1.540	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccnn3-c3ccccc3)CCO2)C1	1783874493	HXPWMUVVNBYVKN-UTKZUKDTSA-N	432.908	1.570	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc(Cl)nc3)C[C@@H]21	1783964461	UJHTXRWICSBUDV-IMIFBBOLSA-N	445.745	1.754	50	20	IDGD	
CC(=O)Nc1ccccc1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1785100931	AMGGIZDZKDBUQG-QAPCUYQASA-N	442.285	1.779	50	20	IDGD	
Cc1cc(C)n(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)Br)C[C@@H]32)n1	1785342423	KLSMYJHRBNIIAF-VGWMRTNUSA-N	427.343	1.263	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(O)nc4ccccc34)[C@H]2C1	1787903565	HNWLSXNNHARKHI-UHEFJODHSA-N	447.919	1.788	50	20	IDGD	
CNc1nsnc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]2C1	1788761870	FYWXOGNHXKKSGN-AVGNSLFASA-N	427.603	1.025	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(C)n(C(F)F)n3)[C@H]2C1	1789329882	BIFWMQMXDHEMIS-XPCVCDNBSA-N	434.871	1.434	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(-n4ccnc4)ccn3)[C@H]2C1	1789376064	LZFSWGMATVFMIO-RMRDIRSESA-N	447.923	1.114	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4nn[nH]c4c3)C[C@@H]21)[C@@H](F)Br	1789924711	BQQCSPRYPQAKQS-LWWSYDQCSA-N	440.273	1.242	50	20	IDGD	
Cc1cc(C)n(CCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]3C2)n1	1789926558	BWWKMIPTXCTHQG-JKQORVJESA-N	445.333	1.560	50	20	IDGD	
COc1cnc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]3C2)c(F)c1	1791057314	SLFQVBKDWVLHRJ-MPXAEWJHSA-N	444.301	1.606	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)Cn3ccnc3)C[C@@H]21	1791064704	FCUJWWWSCUSCSF-OWYFMNJBSA-N	427.343	1.282	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4ncsc4[nH]3)C[C@@H]21	1791255289	JQWGCQMNHWFPBF-OHTBPHCPSA-N	426.926	1.472	50	20	IDGD	
Cc1c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](O)CCl)cccc1C(F)(F)F	1792983613	RMSRBINYARAPCG-NOXHYTERSA-N	434.842	1.817	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCn1c(=O)oc2ccccc21	1794257172	XTQBIPJPJVXXJX-QKPAOTATSA-N	435.908	1.877	50	20	IDGD	
O=C(CNC(=O)c1cccs1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCBr	1795491143	RHFYBFXAYSVKGX-CLLJXQQHSA-N	428.352	1.901	50	20	IDGD	
C[C@H](Sc1ccccc1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1	1796187874	IOPPBOJVGKRNFN-QLIIJSOBSA-N	438.358	1.799	50	20	IDGD	
COc1ccc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Cl)c(OC)c1	1796370950	RWYYUHYIFIEDAQ-GTYSZEQSSA-N	428.888	1.760	50	20	IDGD	
CCN(CC)C[C@H](C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C(C)=N/NC(=O)c1ccc[nH]1	1796893726	OOBIENJDMZJKSG-LGXVYYPLSA-N	444.580	1.737	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cn2ncccc2n1	1797042657	GFDAMQAWIFDTSB-ZWUHOBOKSA-N	436.310	1.106	50	20	IDGD	
C[C@H](Nc1nccs1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CO[Si](C)(C)C	1797956016	VQFYKYPFGFKTLK-AYDFFVQHSA-N	426.615	1.385	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2ncccn2n1	1798034854	ZYVABHDQOQXIGQ-MVRRYPJTSA-N	448.487	1.115	50	20	IDGD	
CO[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Br)c1ccccc1	1799346106	CEILKHPMWGLFQQ-JKJDWNRSSA-N	429.286	1.654	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cn1cccc([N+](=O)[O-])c1=O)C2	1800082985	HGGJUBGLXFNVKY-YFQWEKLQSA-N	445.303	1.631	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccc(F)cc1F	1800659838	HSPBEFNULVNAOK-AKENFEQQSA-N	431.277	1.880	50	20	IDGD	
CCC[C@H]1CC[C@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCC(=O)NN(C)C)CC1	1801012992	PHWGIBGKLWBAIE-UGEWPGMYSA-N	436.597	1.556	50	20	IDGD	
Cc1ccc(C(=O)NCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C(Cl)Cl)cc1	1801021111	ILQQKPDYUMWLND-MIFYACCESA-N	428.316	1.118	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1cc(C)on1	1802829967	IJLQYXKUBCIIGD-KADWPKLNSA-N	426.477	1.298	50	20	IDGD	
O=C(/C=C/c1ccoc1)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1804313870	LXCOVXWLVSLOAS-RMHGUEDNSA-N	445.284	1.387	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC2(CCCN(C(=O)c3ccc([N+](=O)[O-])o3)C2)CC1	1804650334	XESWIVVEKXJNCE-UHFFFAOYSA-N	441.249	1.026	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2cc3n(n2)CCNC3=O)[C@@H]1c1cccnc1	1808249334	DYXOJHXYULHKFU-RLFYNMQTSA-N	444.923	1.359	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)c1nc2ccccc2[nH]1	1809035648	HJECMFFFXXHQLW-JCGIZDLHSA-N	427.892	1.877	50	20	IDGD	
O=C(c1ccc2nccn2c1)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1	1809971953	DSTKYHTVTWPNGI-UHFFFAOYSA-N	446.316	1.173	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)c2cc(=O)ccn2C)[C@H]1c1cccnc1	1812867246	NXIATUCGYBBLMU-YEWWUXTCSA-N	447.333	1.883	50	20	IDGD	
C[C@@H]1CCC[C@@H]1C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1813070648	LDTDWOSSEDTNAT-GZHDQSLTSA-N	429.565	1.897	50	20	IDGD	
CC(C)C1(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)CCC1	1813665737	XXPRWXRMPMZDIV-IRLDBZIGSA-N	449.360	1.907	50	20	IDGD	
CCCNC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](Cl)COC)[nH]n1	1815114099	PIQCUJIZTLMIKX-HIFRSBDPSA-N	427.933	1.962	50	20	IDGD	
COCC1(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)[nH]n2)CC1	1815191900	RRXJWPLNJAMPIE-INIZCTEOSA-N	441.492	1.141	50	20	IDGD	
O=C(N[C@@H]1CCc2nc(NC(=O)[C@@H]3Cc4ccccc4CN3)sc2C1)[C@H](O)CCl	1817030345	IJGAYUNCBOMFBI-VNQPRFMTSA-N	434.949	1.369	50	20	IDGD	
Cc1nc(N)sc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1	1817394736	RAFYVHBXUWQVPV-CYBMUJFWSA-N	448.553	1.436	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2CCCOC2)[nH]n1	1819404222	DVRHYSLZDLKGEK-DYVFJYSZSA-N	441.492	1.141	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)[C@H](OC(C)=O)C(C)C)sc2C1	1819490279	WRMCAAWXNVSMEE-SLEUVZQESA-N	431.942	1.897	50	20	IDGD	
CC(C)O[C@H](C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1819504105	ODJXHSSFUHJNSY-RDTXWAMCSA-N	428.298	1.209	50	20	IDGD	
Cc1[nH]ccc1C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1	1819797277	SEGBSGZXPDAADA-LLVKDONJSA-N	439.501	1.318	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1cccc(F)c1	1820489543	SNQYMPHZGMRBOM-IBGZPJMESA-N	436.252	1.848	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@H]1CCc2nc(NC(=O)c3nccnc3C(N)=O)sc2C1	1821036820	NOEYNAXHGCWOPZ-JTQLQIEISA-N	448.581	1.109	50	20	IDGD	
CCNC(=S)NCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](F)Br)[nH]n1	1821644519	OMZRUSWGZPCDDP-GXFFZTMASA-N	449.350	1.576	50	20	IDGD	
CC(C)=CCCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2	1822730897	PVVVBSWHNWUQRU-MRXNPFEDSA-N	427.335	1.795	50	20	IDGD	
O=C(CSc1nc[nH]n1)N[C@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1	1823014081	NXFUUVIRSLACKV-QUBYGPBYSA-N	449.331	1.656	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)CCl)CC2)c1ccccc1-n1nccn1	1823546200	FLTWBBIYAAMHRR-ABAIWWIYSA-N	446.920	1.549	50	20	IDGD	
O=C(c1cnc2c(c1)CCNCC2)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)CC1	1824188956	WUFSNWMOQLUGFI-SFTDATJTSA-N	448.995	1.603	50	20	IDGD	
C[C@H](Cc1ccco1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCC(=O)NN(C)C)CC2	1826966591	USCIGFIRLVZWAU-KGLIPLIRSA-N	447.561	1.900	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(=O)n3[nH]nnc3n2)CC1	1830306475	LNPOQWDVHPQSBW-ZFWWWQNUSA-N	435.916	1.063	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3CCc4nc[nH]c4C3)C2)C1	1830370085	HVAAHSWHYCBLOS-BTYIYWSLSA-N	438.956	1.236	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cn3nc(C)cc3C)C2)C1	1831640599	NZGCTGVTCBUVTP-PXNSSMCTSA-N	426.945	1.364	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc4ccccn34)C2)C1	1831647161	RHCCQPVKFVQGTR-KKSFZXQISA-N	434.924	1.812	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3ncccc3OC)CCO2)C1	1832865392	IECOLSDRILPUFL-KKSFZXQISA-N	439.940	1.497	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(CN(C(=O)CCCc3ccncc3)CCO2)C1	1833058257	ZNYUXKFLAMSWAQ-QFIPXVFZSA-N	449.624	1.712	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)c3cc(O)nc(O)n3)CC2)CC1	1833532317	KUOYRDIJGPXRNL-HNNXBMFYSA-N	439.944	1.481	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(N(C)C)cn3)CCO2)C1	1833643380	QHYDUZISTMXELJ-UWJYYQICSA-N	438.956	1.625	50	20	IDGD	
COc1cc(C(=O)NC2CCN(C3CCN(C(=O)C(C)(C)CCl)CC3)CC2)n(C)n1	1833955485	HHDLALITUVVEIG-UHFFFAOYSA-N	439.988	1.879	50	20	IDGD	
Cc1nnc(CC(=O)NC2CCN(C3CCN(C(=O)[C@H](C)Br)CC3)CC2)o1	1834835499	NDSNVDCXPNOZSR-LBPRGKRZSA-N	442.358	1.276	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CCC(F)(F)F)CCO2)C1	1835329015	KIXOYUWSWCQNBW-BXUZGUMPSA-N	431.249	1.569	50	20	IDGD	
C[C@H](CS(C)(=O)=O)C(=O)N1CCC(OC2CCN(C(=O)C(Cl)Cl)CC2)CC1	1836876440	RWQBGBYZFMKKJS-GFCCVEGCSA-N	443.393	1.469	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)c(C)n1C	1838389703	MLFABAXUXHXKCE-IFXJQAMLSA-N	442.354	1.495	50	20	IDGD	
O=C(c1[nH]cc2c1CCC2)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1838454820	UPLSFZQSKVMHOG-CRAIPNDOSA-N	444.301	1.264	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(F)c3)CCO2)C1	1838912807	VOMVPBHJZUPROO-FZKQIMNGSA-N	429.286	1.679	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(OC)cc(OC)c3)CCO2)C1	1838934600	ZPVPOOCUDYIHIK-RXVVDRJESA-N	440.924	1.791	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3nc(O)n4c3CCCC4)C2)C1	1839145416	HBJLAHJIAIKYRW-VLIAUNLRSA-N	440.928	1.012	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)c(C)o1	1839197570	BFQRLAVQRNJVOD-WMLDXEAASA-N	433.274	1.657	50	20	IDGD	
CCOC(=O)C1(C(=O)N2CCO[C@@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)CC1	1839759221	HOIIGIGBAFXSNT-LJQANCHMSA-N	430.929	1.051	50	20	IDGD	
CC(C)(C)c1ccc(C(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)cn1	1840987555	KEGFWGPEFZMYGX-UHFFFAOYSA-N	436.516	1.508	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@]2(C[C@@H]2C(=O)N2CC3(CCCN3C(=O)[C@@H](O)CCl)C2)C1	1841353546	DDGWEVRLFKZENE-SIFCLUCFSA-N	441.956	1.437	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCCC12CN(C(=O)Cc1cnccn1)C2	1841924084	TUYYNHHJGHYFON-HNNXBMFYSA-N	437.928	1.355	50	20	IDGD	
Cc1nc(C(=O)N2CC3(CCCN3C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)co1	1841924279	RGOOTULKNFTEBK-ZDUSSCGKSA-N	426.901	1.932	50	20	IDGD	
Cc1ccc2[nH]cc(CC(=O)N3CCCC34CN(C(=O)c3cccc(B(O)O)c3)C4)c2c1	1841974277	VNFNEVWKTAGTPS-UHFFFAOYSA-N	431.301	1.216	50	20	IDGD	
COc1ccc([N+](=O)[O-])c(C(=O)N2CCCC23CN(C(=O)CCBr)C3)n1	1843585473	NHMBNQXCNXFVEL-UHFFFAOYSA-N	427.255	1.600	50	20	IDGD	
Cc1ccc2cc(C(=O)N3CCCC34CN(C(=O)c3ccc(B(O)O)cc3)C4)ccc2n1	1843751592	XMPQRBBIPCEMRT-UHFFFAOYSA-N	429.285	1.354	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)c2ccc(N3N=C(C)CC3=O)cc2)C1	1844961299	YGYWLVQXZAZGSN-QGZVFWFLSA-N	432.908	1.870	50	20	IDGD	
C=C[C@@H]1C[C@]1(NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)[C@H](O)CCl)C2	1847081135	LPQOLJPHUPXXOE-ARGWCVDVSA-N	427.929	1.259	50	20	IDGD	
C=C[C@H](O)C(C)(C)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1848099251	GUKSOSNTJUVSFD-VGWMRTNUSA-N	443.972	1.893	50	20	IDGD	
CCn1c(NNC(=O)[C@H]2CC(=O)N(c3ccc4c(c3)OCCO4)C2)nc2ccccc2c1=O	9856973	WYUHZTCKSKLRJU-AWEZNQCLSA-N	449.467	1.684	50	20	IDGD	
C[C@@H]1CN(S(=O)(=O)c2cccc(C(=O)NNC(=S)NC(C)(C)C)c2)C[C@@H](C)O1	14895274	DIMLPUOOEAHVFY-CHWSQXEVSA-N	428.580	1.392	50	20	IDGD	
Cc1ccc([C@]2(C)NC(=O)N(CC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)C2=O)cc1	17329715	SERDIFJMCXCHEU-FQEVSTJZSA-N	425.401	1.131	50	20	IDGD	
C#CCNC(=O)COC(=O)/C(C#N)=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	19133113	QZJOWUMWXVBPNB-XNTDXEJSSA-N	439.859	1.278	50	20	IDGD	
O=C(NNC(=O)c1ccccc1I)c1ccc(-n2cnnn2)cc1	23156138	RFBBFUOEBQJKRN-UHFFFAOYSA-N	434.197	1.342	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cc(C(=O)NNc2nnc(C)c(O)n2)ccc1C	23311108	YBZRCSCBMFNZJI-UHFFFAOYSA-N	444.473	1.760	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)c1cnc2c(c1)c(=O)n(C)c(=O)n2C	29329589	BOGYBPWJDODZQG-CYBMUJFWSA-N	447.451	1.014	50	20	IDGD	
CCCCS(=O)(=O)N1CCC(C(=O)NNC(=O)COc2ccccc2CC)CC1	108107061	RJQSIWMJQRSJEG-UHFFFAOYSA-N	425.551	1.617	50	20	IDGD	
CCc1cccc(OCC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1	115084888	AXMYHWHJMGGEOG-UHFFFAOYSA-N	431.514	1.874	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)NCCC(=O)NNc2nc(-c3cccnc3)no2)cc1	728075775	NBYNOGYIDAIRSI-UHFFFAOYSA-N	430.446	1.146	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)CNC(=O)c2ccc(Br)s2)c1	728206538	UIBDXCGPJFFGHU-UHFFFAOYSA-N	441.307	1.509	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(Cl)c(S(=O)(=O)NNC(=O)C(C)(C)C)c1	728260418	OGATWNODVSFYEZ-UHFFFAOYSA-N	425.960	1.726	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2)c1ccc2ccccc2n1	728261577	UJVDFBBHCQXYNO-UHFFFAOYSA-N	430.398	1.538	50	20	IDGD	
COC[C@@H](C)n1c(C)cc(/C=C(\C#N)C(=O)N2CCN(C(=O)CN3CCCC3)CC2)c1C	728551769	MZGPHJMYMPYQMT-VZMFNRANSA-N	441.576	1.986	50	20	IDGD	
CCN=c1nc(NCC)n2c(SCC(=O)NNc3ccc(F)c(F)c3F)n[nH]c2n1	728715672	UVNONTLUEWYJJX-UHFFFAOYSA-N	441.443	1.458	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)N2CCN(S(=O)(=O)c3c(F)cccc3F)CC2)c1	728954666	LQISMNXGSMSDTN-UHFFFAOYSA-N	449.439	1.197	50	20	IDGD	
CC(C)(C)CC(=O)N1CSC[C@@H]1C(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	730081520	SKPPKUXJLLQDQW-CQSZACIVSA-N	431.518	1.677	50	20	IDGD	
O=C(NCc1ccc(C(=O)N2CCOCC2)cc1)NNC(=O)c1cccc2ncccc12	730114102	FRUDIJSRCZKGSJ-UHFFFAOYSA-N	433.468	1.851	50	20	IDGD	
C[C@@H]1CCCN(S(=O)(=O)c2cc(C(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)n(C)c2)C1	730159215	SMUYYYPUOPEQHC-CYBMUJFWSA-N	449.489	1.429	50	20	IDGD	
C[C@@H](NC(=O)OC(C)(C)C)C1CCN(CC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)CC1	730266644	ZHJLKFCXKPOXGM-CQSZACIVSA-N	449.508	1.981	50	20	IDGD	
CCOc1cc(C=NNC(=O)CSc2nn(C)c(=O)n(C)c2=O)ccc1OCC(C)C	730568998	IQSGEFWFMFFOPC-UHFFFAOYSA-N	449.533	1.155	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)[C@H]1CC(=O)N(c2ccccc2Br)C1	730778506	PIZQYUMGVXKSJG-LBPRGKRZSA-N	448.273	1.734	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)NCc1cccc(OCCN2CCOCC2)c1	730825057	PNAHRMKJMGUQRO-UHFFFAOYSA-N	444.488	1.013	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2csc(-c3ccoc3)n2)ccc1Cl	730998169	MUDGMLWIFSMMDC-UHFFFAOYSA-N	426.863	1.779	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2nnn(-c3ccc4c(c3)OCCO4)c2C)cc1OC	731453390	JIRSXHZSLRIBKX-UHFFFAOYSA-N	439.428	1.439	50	20	IDGD	
N#CC1(C(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)CCOCC1	731487695	WWAMOZSKWTWNIO-UHFFFAOYSA-N	431.452	1.526	50	20	IDGD	
C[C@H]1C[C@H]1C(=O)Nc1cccc(C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c1	732327835	MEVCAFHREOQYAS-YVEFUNNKSA-N	440.412	1.807	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)N[C@@H]2CCN(CC(F)(F)F)C2=O)N(C)c2ccccc21	732560994	UVSSMEZSCKUFCG-CQSZACIVSA-N	449.433	1.936	50	20	IDGD	
COc1ccc(C(=O)NNc2cnnc3ccccc23)cc1S(=O)(=O)N1CCOCC1	733808977	QBGFCTTXWKQZHF-UHFFFAOYSA-N	443.485	1.416	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NC2CCN(C[C@H]3CCCO3)CC2)cc(OC)c1OC	734283711	SDHNBQARCLVJCB-MRXNPFEDSA-N	436.509	1.300	50	20	IDGD	
COc1ccc(C=NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)c(OCC(=O)O)c1	734363498	KRDNQKVPQACBIM-UHFFFAOYSA-N	449.485	1.238	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2csc3ccccc23)CC1	735117346	RSKUNBJTWZQVTR-UHFFFAOYSA-N	431.543	1.989	50	20	IDGD	
O=C(NNS(=O)(=O)C[C@H]1CCCO1)[C@@H]1Cc2ccccc2CN1Cc1ccccc1	735646323	PEDNZNXXYRYENJ-RTWAWAEBSA-N	429.542	1.743	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)Sc1nnc(-c2cncc(Br)c2)n1N	736441654	PWXULXOGKCVTPU-SECBINFHSA-N	442.343	1.491	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NNc2ccnc(N(C)C)n2)ccc1Cl	740105058	VPSCQLFCJJBBBR-UHFFFAOYSA-N	426.930	1.983	50	20	IDGD	
CCCCN(C)C(=O)c1ccccc1S(=O)(=O)NNC(=O)C(=O)NC(CC)CC	740812642	SKNQFWLNGYBHFP-UHFFFAOYSA-N	426.539	1.173	50	20	IDGD	
CS(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)c2cccc3ccccc23)c(F)c1	741656480	XEODVMBFKXOAFQ-UHFFFAOYSA-N	437.474	1.974	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)CN2CCC(C(=O)Nc3ccc4c(c3)OCO4)CC2)cc1	744385547	QJNYLTXIRBXHLA-UHFFFAOYSA-N	449.467	1.399	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CN2CCN(CC(=O)N(C)C3CCCCC3)CC2)c1	744395418	XBJJLJBYXUPHFS-UHFFFAOYSA-N	429.565	1.165	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)c2ccc(N3C[C@@H](C)O[C@H](C)C3)nc2)c1	744715916	VZXLLOBVBGGWMT-HZPDHXFCSA-N	426.473	1.622	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)NCCN2CCN(C(=O)OC(C)(C)C)CC2)c1	744896304	YSTFGXRLRJKZFK-UHFFFAOYSA-N	434.541	1.249	50	20	IDGD	
Cc1ccc([C@@H](CNC(=O)NNC(=O)Cc2cn3ccccc3n2)N2CCOCC2)cc1	746757889	RVLBGVAWAYEPGF-HXUWFJFHSA-N	436.516	1.589	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc(OC(F)(F)F)cc1)NNC(=O)Cc1ccncc1	747428886	YXDLFGXOAVPTRP-UHFFFAOYSA-N	446.407	1.039	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NNC(=O)c2cccc3cccnc23)cc(OC)c1OC	747461882	DMQVTTCOSQJMRI-UHFFFAOYSA-N	439.428	1.550	50	20	IDGD	
CS(=O)(=O)Cc1cccc(CNC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)c1	749192589	RGRSEZGDCFQWPN-UHFFFAOYSA-N	443.485	1.267	50	20	IDGD	
CC[S@](=O)[C@H]1CCC[C@H](NC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)C1	750297293	QSYBKCCJTCKHFI-IVAFGUPBSA-N	430.552	1.506	50	20	IDGD	
Cc1noc(C(F)(F)F)c1C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	750487883	NXDHFGQUSNGMIU-LLVKDONJSA-N	429.307	1.146	50	20	IDGD	
Cn1c(O)nc2ccc(C(=O)NNC(=O)c3ccc(S(=O)(=O)N4CCCC4)cc3)cc21	751549639	WQEVENYERBOGIE-UHFFFAOYSA-N	443.485	1.138	50	20	IDGD	
CCN1C(=O)[C@@H]2CN(C(=O)/C(C#N)=C\c3cc(C)n(C[C@H]4CCCO4)c3C)CCN2C1=O	752507430	IUFMYEOJYZDZFP-BXWLARMLSA-N	439.516	1.686	50	20	IDGD	
CS(=O)(=O)N1CC[C@H](CNC(=O)NNC(=O)COc2ccccc2-c2ccccc2)C1	753671361	PRCRHNHFJYQNFJ-MRXNPFEDSA-N	446.529	1.344	50	20	IDGD	
O=C(NNc1ccc(C(F)(F)F)nn1)c1cc(S(=O)(=O)N2CCOCC2)ccc1F	755198228	NIKUZCHIRFEFLM-UHFFFAOYSA-N	449.386	1.412	50	20	IDGD	
COC(=O)CCNC(=O)c1ccc(NC(=O)NNC(=O)CCc2ccccc2O)cc1	755603114	IBSRCUZEXXCJDY-UHFFFAOYSA-N	428.445	1.471	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])cc1NS(C)(=O)=O	756514858	ASZFAPVYODRACZ-UHFFFAOYSA-N	437.434	1.506	50	20	IDGD	
C[C@@H]1C[C@@H](C)CC2(C1)NC(=O)N(CC(=O)NNc1nc3ccccc3c(=O)n1C)C2=O	756996318	PYZDSSLICYUPNF-CHWSQXEVSA-N	426.477	1.123	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)N[C@H](CC(N)=O)C2CCOCC2)c(C)n1C[C@H]1CCCO1	757694881	ZUBUGRHJJFQDQG-AMGYQSQTSA-N	428.533	1.978	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)c1cccnc1I	757736590	KFWIQNFYYBAPNU-UHFFFAOYSA-N	426.214	1.568	50	20	IDGD	
Cc1cc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)ccc1Br	757780169	KAPBDRDYSGDZQQ-INIZCTEOSA-N	449.257	1.902	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)CN2C(=O)NC3(C[C@H](C)C[C@@H](C)C3)C2=O)cc1	757841796	PTJOOJTWGIMBQO-HUUCEWRRSA-N	444.488	1.046	50	20	IDGD	
Cc1cc(CC(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)c(C)n1-c1ccc(Cl)cc1	758036399	RLTZXEUJJMPOOT-LBPRGKRZSA-N	426.926	1.375	50	20	IDGD	
O=C(COC(=O)[C@H]1COc2ccc(Br)cc21)NNC(=O)c1cccs1	758649207	CQRYSBCVXXTILP-NSHDSACASA-N	425.260	1.991	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)N[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1C#N	758753540	PRUBFJKEEQAQGX-ZIAGYGMSSA-N	449.533	1.877	50	20	IDGD	
CC[C@@H]1Oc2cc([C@H](C)NC(=O)NNC(=O)C(=O)Nc3ccccn3)ccc2NC1=O	758821392	MTZKATHAPUFXQQ-FZMZJTMJSA-N	426.433	1.221	50	20	IDGD	
Cc1nc(COc2ccc(F)cc2)sc1C(=O)NNC(=O)C(=O)Nc1ccccn1	758840101	TVTWVKAGQNXROH-UHFFFAOYSA-N	429.433	1.964	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)COc1ccc([N+](=O)[O-])c2cccnc12	760443312	WNICTUQYBHXXNU-UHFFFAOYSA-N	433.421	1.584	50	20	IDGD	
CS(=O)(=O)c1c(Cl)cccc1NC(=O)C(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	763470909	PWBGQSLWLVNPLR-UHFFFAOYSA-N	440.821	1.051	50	20	IDGD	
COC(=O)[C@@H]1CN(C(=O)C(=O)NNC(=O)c2cc3ccccc3cc2O)c2ccccc2O1	763523021	RUXFWQYWOGGERU-IBGZPJMESA-N	449.419	1.274	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cc(F)c(F)c(F)c2)cc(OC)c1OC	763539408	LHUFIYCKHUFEBX-UHFFFAOYSA-N	427.335	1.529	50	20	IDGD	
CN(C)C(=O)Cn1ccc(NC(=O)C(=O)NNC(=O)c2sc3ccccc3c2Cl)n1	763577095	GSOCDWDINOHIEA-UHFFFAOYSA-N	448.892	1.239	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cc(C(N)=O)ccc2F)c(C)n1-c1ccccc1	763603128	WBZUVCHPEZWYHL-UHFFFAOYSA-N	437.431	1.732	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(C(=O)NC(C)C)c(C)c2)cc1C	763668068	YDYDVSBKWKDIDV-UHFFFAOYSA-N	440.500	1.915	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2cc(C(=O)NC3CC3)ccc2C)c1	763668364	LJPXVHCBZBQFRD-UHFFFAOYSA-N	438.484	1.669	50	20	IDGD	
COC(=O)c1cc(OC)ccc1NC(=O)C(=O)NNC(=O)CN1CCCc2ccccc21	763735657	QAKMNCJYVDDUMD-UHFFFAOYSA-N	440.456	1.021	50	20	IDGD	
CCS(=O)(=O)c1cccc(CC(=O)NNC(=O)c2cc(-c3ccccc3OC)[nH]n2)c1	763762551	CTMDSDOHZNQCHQ-UHFFFAOYSA-N	442.497	1.883	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cccc([N+](=O)[O-])c2C)cc1	763862406	XBAKBGATQFIDQN-CYBMUJFWSA-N	430.417	1.855	50	20	IDGD	
COC(=O)c1cc(F)c(F)cc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccccc1F	763864868	LLWGPXROPCGSPG-SECBINFHSA-N	439.346	1.444	50	20	IDGD	
CC(=O)Nc1cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)c(F)cc1F	763866419	PDOQSARKILKEHI-SECBINFHSA-N	438.362	1.616	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(C(C)=O)c(C)c2)cc1	763877977	NGNNZEQALMEOJR-HNNXBMFYSA-N	425.441	1.954	50	20	IDGD	
CN(C)C(=O)COc1cccc(NC(=O)C(=O)NNC(=O)Cc2ccc(Cl)cc2)c1	763932392	NKJUCCYJQZPUDY-UHFFFAOYSA-N	432.864	1.136	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3ccccc3OCCC(N)=O)cc2C1	763949262	OEPYDQVOAIUQBG-LBPRGKRZSA-N	444.513	1.527	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)C(=O)Nc1cccc(S(=O)(=O)NC(C)(C)C)c1	763951318	VRBDMMDNJVSUBQ-UHFFFAOYSA-N	432.502	1.472	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)cc1OCC	763994928	JPRSZWANFATTJP-UHFFFAOYSA-N	439.266	1.974	50	20	IDGD	
CC(C)C(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)c1	764005591	CDUOHPLSUYPIJC-UHFFFAOYSA-N	426.429	1.452	50	20	IDGD	
CNC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)Cc2cccc3ccccc23)cc1	764034508	BTJLJCMRAXNJIF-UHFFFAOYSA-N	434.452	1.293	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1	764040424	HPMFHNWMWQDULT-ZIAGYGMSSA-N	444.463	1.848	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cccc(Br)c2)ccc1C(=O)N(C)C	764059313	RREUFMBKXMEDIF-UHFFFAOYSA-N	447.289	1.859	50	20	IDGD	
COc1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	764077939	OZTFPNMMLQWGHU-UHFFFAOYSA-N	425.850	1.152	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccc3ccccc3c2)cc1-n1cnnn1	764090777	FTVNZGMIFZFNBM-UHFFFAOYSA-N	429.440	1.453	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(OCCN(C)C)c(Cl)c2)c(O)c1	764105716	XLDQTFPHXTZGRY-UHFFFAOYSA-N	434.880	1.694	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3nn(C(C)(C)C)cc3C#N)n[nH]2)cc1	764112185	XFBCVIKHYWWGIF-UHFFFAOYSA-N	434.460	1.608	50	20	IDGD	
O=C(CC1CC1)NNC(=O)C(=O)Nc1ccc(C(=O)NCc2ccccn2)c(Cl)c1	764142917	MOONAHNXHOLLBJ-UHFFFAOYSA-N	429.864	1.551	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2O1)C(=O)Nc1ccc(N2CCCC2=O)c(F)c1	764168262	PBRVVSZGXUOWGK-QGZVFWFLSA-N	426.404	1.042	50	20	IDGD	
CCCCNS(=O)(=O)c1cccc(NC(=O)C(=O)NNC(=O)CCc2ccccc2)c1	764191659	DZQUXAYXCIBOEM-UHFFFAOYSA-N	446.529	1.484	50	20	IDGD	
CC1CCN(c2ccc(NC(=O)C(=O)NNC(=O)COc3ccccc3O)cc2)CC1	764274911	GJAFBSYADVWYLW-UHFFFAOYSA-N	426.473	1.793	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1c(F)cc(Br)cc1F	764274913	GJBGVZQRFLYLSY-UHFFFAOYSA-N	444.188	1.598	50	20	IDGD	
COC(=O)c1cc(F)c(F)cc1NC(=O)C(=O)NNC(=O)c1cc(-c2cccs2)[nH]n1	764382348	HOGRNMXNOADTNO-UHFFFAOYSA-N	449.395	1.603	50	20	IDGD	
CCCCOc1ccc(OC)cc1NC(=O)C(=O)NNC(=O)c1cncc(NC(C)=O)c1	764433209	LUOAJVIVZDQKPO-UHFFFAOYSA-N	443.460	1.627	50	20	IDGD	
O=C(NNC(=O)[C@H](O)c1cccnc1)c1nn(Cc2ccccc2)c(=O)c2ccccc12	764596384	JQDKBGVIFJZMIW-HXUWFJFHSA-N	429.436	1.334	50	20	IDGD	
Cc1cc(C)nc(-n2nc(C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)cc2C)n1	765310478	HFEVHKYXDINHHB-UHFFFAOYSA-N	431.497	1.653	50	20	IDGD	
C[C@H](NC(=O)C(C)(C)C)C(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	765751053	HYYFBZVWDRTHJA-HNNXBMFYSA-N	437.972	1.156	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(CCNC(=O)NNc2ccccc2S(C)(=O)=O)CC1	765826425	UQTYXEKNNCUHAY-UHFFFAOYSA-N	441.554	1.269	50	20	IDGD	
CC(C[C@H]1COCCN1C(=O)OC(C)(C)C)=NNC(=O)Cc1cc(O)nc(S)n1	767358663	DIYJHODUJSSCTQ-ZDUSSCGKSA-N	425.511	1.532	50	20	IDGD	
CC(C)(C)OC(=O)N1CCO[C@@H](C(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)C1	767449095	UCNSEQLGEHZZSD-CQSZACIVSA-N	441.868	1.280	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3c(C)oc4ncnc(O)c34)n[nH]2)cc1OC	768277006	ORFMXEOCJGBBDW-UHFFFAOYSA-N	438.400	1.719	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)[C@@H]3CC(=O)N(C(C)(C)C)C3)n[nH]2)cc1OC	768279852	ULYWFMNPFZDUEG-CYBMUJFWSA-N	429.477	1.502	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)OCc2nnnn2CC2CCOCC2)c1C	768356744	NUBCQKFTOXMJSO-ODLFYWEKSA-N	428.493	1.815	50	20	IDGD	
C[C@]1(CNC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)CCO[C@H]1C1CC1	768529563	ZSISROILKFWPQZ-JTHBVZDNSA-N	429.565	1.734	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NC[C@@H]2[C@H]3Cc4ccccc4[C@H]32)cc1	769151918	QYPBYWCFIZHORP-SFHLNBCPSA-N	442.541	1.532	50	20	IDGD	
CSCCNC(=S)NNC(=O)CCNS(=O)(=O)c1ccc2ccccc2c1	769767239	DRMQTXJWDOJRQV-UHFFFAOYSA-N	426.589	1.367	50	20	IDGD	
COc1ccc(CNC(=O)CNC(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)cc1	770327733	ORYBNGUSZHVDTG-ZDUSSCGKSA-N	434.880	1.763	50	20	IDGD	
C[C@@H](C(=O)NC1CC1)N1CCN(C(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)CC1	770646230	DTMPYHMAFREKBV-UONOGXRCSA-N	437.928	1.133	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)C1CCN(S(=O)(=O)/C=C\c2ccccc2)CC1	771930776	BUNVOQUZRTUIHC-SZGZABIGSA-N	437.518	1.188	50	20	IDGD	
O=C(NNC(=O)c1ccn(-c2ccc(Cl)cc2Cl)n1)N[C@H]1CCS(=O)(=O)C1	772159026	UKDKDYBHBXHZGN-JTQLQIEISA-N	432.289	1.310	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)c1ccc(CN2C(=O)CNC2=O)cc1	772995279	OHBIRHFXNTWNPL-LBPRGKRZSA-N	430.848	1.620	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)NCc2ccc(N3CCCS3(=O)=O)c(F)c2)c1	773581015	NFJYMHCDNAYQSC-UHFFFAOYSA-N	449.508	1.576	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)NCC(F)(F)F)cc2)cc1F	773903393	YWNUEEWHSPYKHC-UHFFFAOYSA-N	440.353	1.826	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)n(C2CCOCC2)n1	774003630	ZBNSNQRMDALZFH-ZDUSSCGKSA-N	449.895	1.750	50	20	IDGD	
CCOC(=O)c1c(NC(=O)NNC(=O)CN(C)C)sc2c1CCN(C(=O)OCC)C2	775723341	SEBXGJJXPWXLCY-UHFFFAOYSA-N	441.510	1.154	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)N[C@@H]2C[C@@H](OCC)[C@H]2OC)c2ccccc2c1=O	776528253	XAQSOCFKWRRDPD-LMMKCTJWSA-N	445.520	1.723	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)N[C@@H]2CCN(c3ccc(F)c(Cl)c3)C2=O)cc1	777753300	VYQUFLXNFZQUHB-QGZVFWFLSA-N	445.838	1.865	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@@H](C(=O)NNC(=O)C(C)(C)c2ccccc2)[C@H](C)O)cc1	779514889	OXUJRUNQWYAXGH-MAUKXSAKSA-N	433.530	1.148	50	20	IDGD	
Cc1cc(N2C[C@@H](C(=O)NNC(=O)c3nn(-c4ccccc4)cc3O)CC2=O)ccc1F	780328192	OLYXYNAUQQQQNO-AWEZNQCLSA-N	437.431	1.840	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)N[C@H]1CCc2nnc(-c3ccc(F)cc3)n2C1	780909222	MHVYOFXFXYMVKB-HNNXBMFYSA-N	439.407	1.951	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)c1ccccc1I	780973876	IUTXSEGLNINEKH-UHFFFAOYSA-N	433.246	1.967	50	20	IDGD	
COc1ccc(Cn2ncc(C)c2NC(=O)C(=O)NNc2ncncc2Cl)cc1OC	782159907	LTGIRYVUFFLIEG-UHFFFAOYSA-N	445.867	1.782	50	20	IDGD	
CC[C@H](C)Sc1ccc(NC(=O)C(=O)NNC(=O)C(=O)NC2CC2)c(C(F)(F)F)c1	782966056	KOIWOOFRPRTQTN-VIFPVBQESA-N	446.451	1.961	50	20	IDGD	
CCOC(=O)[C@@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNc2ccc(OC)cc2)cc1F	783039122	GSYUHSBARDEDEN-GFCCVEGCSA-N	446.435	1.598	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(NC(=O)C(=O)NNc2ccc(F)cc2F)ccc1Cl	783342991	QUPCZXPPYRUDBZ-UHFFFAOYSA-N	432.836	1.950	50	20	IDGD	
Cc1cc(C)c(NNC(=O)C(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)c(C)c1	783366813	MRVACDSSNHZPBK-UHFFFAOYSA-N	430.530	1.928	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2ccc(C(F)(F)C(F)(F)F)cc2)CCS(=O)(=O)C1	783427257	NTFNISWPNSMHKJ-ZDUSSCGKSA-N	429.367	1.477	50	20	IDGD	
N#Cc1cc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)ccc1Cl	784212689	DXMYBQJRLAZKAM-UHFFFAOYSA-N	433.877	1.734	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)[C@@H](O)Cc2cccc(C(F)(F)F)c2)n1	785747566	ZAVXULAEOKAUBD-ZDUSSCGKSA-N	445.419	1.307	50	20	IDGD	
CC(=O)c1cccc(S(=O)(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)c1	788915310	JMLBBLROSFQFJF-UHFFFAOYSA-N	440.522	1.687	50	20	IDGD	
Cn1c(=O)ccc2ccc(NC(=O)C(=O)NNC(=O)[C@H]3OCC[C@H]3c3ccccc3)cc21	789809916	GNJIASTVHWHPLV-PXNSSMCTSA-N	434.452	1.197	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)c2cccc(C)n2)cc1NC(=O)c1ccccn1	794599720	LFNAYBKYLBQCIR-UHFFFAOYSA-N	441.469	1.669	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3[nH]nnc3-c3ccccc3)cc2)CC1	797746379	YBBVASFUQLYSKF-UHFFFAOYSA-N	441.517	1.165	50	20	IDGD	
CNC(=O)CNC(=O)c1cccc(NC(=O)NNC(=O)c2cccc(Br)c2)c1	800596997	RIVLDCXVHTWDGM-UHFFFAOYSA-N	448.277	1.391	50	20	IDGD	
COc1ccc2c(c1)OCCN(C(=O)NNC(=O)c1csc(N3CCOCC3)n1)C2	801738550	RGSOUTJXGRWACF-UHFFFAOYSA-N	433.490	1.237	50	20	IDGD	
C[C@H]1NC(C(=O)NNC(=O)Nc2ccc(Br)cc2)=NN(c2ccccc2)C1=O	801997252	VUEXRRXVHDASOL-LLVKDONJSA-N	445.277	1.940	50	20	IDGD	
CCOC(=O)C1(C(=O)NNC(=O)c2cc(-c3ccc(OC)c(OC)c3)[nH]n2)CCOCC1	802937330	STTWIQAYHFFYBL-UHFFFAOYSA-N	446.460	1.215	50	20	IDGD	
N#Cc1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)cc1Br	806974574	NKWFVHWZTMQZTJ-UHFFFAOYSA-N	442.229	1.357	50	20	IDGD	
CCN(C)C(=O)c1cccc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)c1	806978710	FDAOOKGDSOQZIT-UHFFFAOYSA-N	434.399	1.536	50	20	IDGD	
O=C1COC[C@H](C[C@@H]2CN(C(=O)C(=O)NNc3c(F)cccc3F)c3ccccc32)N1	806984289	POCOWCAIMVNHMK-OLZOCXBDSA-N	430.411	1.443	50	20	IDGD	
COCC1(CNC(=O)NNC(=O)c2ccccc2O)CCN(C(=O)OC(C)(C)C)CC1	807270730	XKHDZRBVALIZOO-UHFFFAOYSA-N	436.509	2.000	50	20	IDGD	
COC[C@]1(C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)CCN(C(=O)OC(C)(C)C)C1	809950821	ZIDSPHXRFMVIAI-KKSFZXQISA-N	435.477	1.247	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)NC[C@H]1CCN(c2ccccc2F)C1	813206020	ZMOBIIXDZJPWGZ-CQSZACIVSA-N	431.424	1.970	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)N[C@H]2CCN(c3ccccc3F)C2)cc1	813853340	DZJGOFCRXAVYGH-AWEZNQCLSA-N	435.481	1.844	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H]2[C@@H](C1)[C@@H]2C(=O)NNc1nc(O)c2cnn(C(C)(C)C)c2n1	815554652	FGKBVQQZVIAOKJ-ITGUQSILSA-N	431.497	1.843	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)cc1)C1CC1	815566923	JWNPPRIWQPEUQD-UHFFFAOYSA-N	430.848	1.961	50	20	IDGD	
CCOC(=O)c1cc(COC)cc(NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)c1	815567053	NJZZJRCXVRFUIE-UHFFFAOYSA-N	449.847	1.768	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)[C@@H](O)[C@@H](O)c2nc3ccccc3s2)c1C	831083218	RZUPDGHKDDQFLO-JEBQAFNWSA-N	429.498	1.922	50	20	IDGD	
Cn1nnnc1Sc1ccc([N+](=O)[O-])cc1C(=O)NNC(=O)COc1ccc(F)cc1	910788065	OMRMSNYUSUPZGV-UHFFFAOYSA-N	447.408	1.249	50	20	IDGD	
C[C@H](CN1CCOCC1)C(=O)NN/C=C1\C(=O)N(c2ccccn2)C(=O)c2ccccc21	912745192	CEVWWHLIFKVSTL-BAACNHRGSA-N	435.484	1.199	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)CNS(=O)(=O)c2ccc(C)c(C)c2)cc1	912842404	BWLQGZPHVUPPOP-INIZCTEOSA-N	449.529	1.595	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCCN(C(=O)c3ccccc3F)CC2)n1	913148574	XECDFVXWQITDOR-UHFFFAOYSA-N	433.509	1.129	50	20	IDGD	
C=CCNC(=S)NNC(=O)[C@H](CCSC)NC(=O)c1ccccc1Br	913435524	ROAOKFVXMQQDFI-ZDUSSCGKSA-N	445.408	1.982	50	20	IDGD	
CN(C)[C@@H](CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)c1cccs1	915898160	TXKPGVBKEBUHPV-HNNXBMFYSA-N	439.563	1.245	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)NC[C@@H](c2cccs2)N2CCN(C)CC2)c1	915901051	DDCPTOAUUHDCKW-SFHVURJKSA-N	447.561	1.698	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2ccccc2CN2CCCC2)c1	916221278	CMNWDDUPLPBYAF-UHFFFAOYSA-N	430.530	1.830	50	20	IDGD	
O=C(NCCNS(=O)(=O)c1ccccc1)NNC(=O)c1cc2c(s1)CCCCC2	916294706	FYHHOECDDZIBCM-UHFFFAOYSA-N	436.559	1.940	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)NCCCN1CCN(Cc2ccccc2)CC1	916487957	FDGUUHRBLCOJOR-UHFFFAOYSA-N	427.524	1.907	50	20	IDGD	
CCOc1c(Cl)cc(CNC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1OC	918234921	MBGZPONCMHNDQT-UHFFFAOYSA-N	445.867	1.867	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)N[C@H](C)CN1C[C@@H](C)C[C@H](C)C1	919924742	VJHZJXQAAZEYBE-SOUVJXGZSA-N	438.598	1.599	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)Cc1ccc(S(=O)(=O)N2CCCC2)s1	920006807	VHRUSQUMKZHSCA-UHFFFAOYSA-N	437.543	1.474	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1CNC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	920919565	TYSDMACDEGXYDC-UHFFFAOYSA-N	449.489	1.816	50	20	IDGD	
C[C@H]1CN(Cc2csc(NC(=O)NNC(=O)COc3ccc(C#N)cc3)n2)C[C@H](C)O1	920930541	OHCBGYDXPBWRDK-KBPBESRZSA-N	444.517	1.856	50	20	IDGD	
COC(=O)c1cc(NC(=O)NNC(=O)COc2ccccc2C#N)cc(C(=O)OC)c1	920930614	RWDHVAOEUIAXQD-UHFFFAOYSA-N	426.385	1.363	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)CNC(=O)c1cccs1)CN(C)C(=O)OC(C)(C)C	1321741851	BISVXZDRINBFMK-GFCCVEGCSA-N	427.527	1.311	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cn(C)nc2C(F)F)C1	1778361569	ZIOGLSLUZLCUCO-PJIJBLCYSA-N	448.898	1.739	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H]3ON=C(c4ccccc4)O3)C2)C1	1778871617	MZPQBLADALUZTL-RXVVDRJESA-N	435.908	1.816	50	20	IDGD	
O=C(/C=C\C(=O)NC1CC1)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Br)C2	1779230740	QMYGEVODIOMFJC-JEWVKGLTSA-N	446.317	1.026	50	20	IDGD	
Cc1nnc(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](F)Br)C2)s1	1780772073	ZUYSXRZLGZRYKP-DJSGYFEHSA-N	449.346	1.593	50	20	IDGD	
O=C(c1cc2cccn2cn1)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781329472	GLKYTSKGQAPGJU-PBHICJAKSA-N	425.258	1.468	50	20	IDGD	
O=C(Cc1ccc2c(c1)CCO2)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1783423404	ZSRRNZYEVRNSKX-PKOBYXMFSA-N	441.297	1.684	50	20	IDGD	
CCOc1ncccc1C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](C)Br)C2)C1	1783528522	OSKUQJOFUHIUDD-ACJLOTCBSA-N	426.311	1.707	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3n[nH]c4c3CCCC4)CCO2)C1	1783534573	LUUHWBBRJHGVNY-KPZWWZAWSA-N	425.327	1.515	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccnc4ncccc34)CCO2)C1	1783535482	DNSMMHWTZQMMCU-ORAYPTAESA-N	433.306	1.857	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(-n4cccn4)nc3)CCO2)C1	1783538035	SAKOXLHGUGNKOM-AUUYWEPGSA-N	448.321	1.494	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)COc3ccc(O)cc3)[C@H]2C1	1783842723	MUXRWFZLJJAZMG-VZYKRBATSA-N	445.343	1.987	50	20	IDGD	
CC(C)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCNC(=O)c3ccc[nH]3)C[C@@H]21	1783845928	IBPRPOIWDRYTBT-ZOBUZTSGSA-N	438.956	1.379	50	20	IDGD	
CC(C)=NO[C@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]2C1	1783971666	DNVCIPPNNYPCHZ-OWYFMNJBSA-N	432.359	1.798	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccncc3-c3ccccc3)C[C@@H]21)[C@H](O)CCl	1784090874	DTINSVBSDSEATF-DVWBAYGPSA-N	443.931	1.942	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3c[nH]c4ncccc34)C[C@@H]21)[C@H](O)CCl	1784097237	WSNLAAPVIBEEQZ-OWLYRPNTSA-N	434.924	1.075	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnnc(Cl)c3)[C@H]2C1	1785450166	KKZGCQXJWMTJIQ-QEJZJMRPSA-N	426.977	1.575	50	20	IDGD	
Cc1ccc(C(=O)C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCBr)[C@H]3C2)cc1	1786407603	ABUSJZDNKBTHTR-ULQDDVLXSA-N	437.334	1.942	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CCC[C@@H]3C)C[C@@H]21	1787508383	HJFBPIZKGFCFNN-QAVYHNJPSA-N	443.548	1.536	50	20	IDGD	
COC[C@H](Cl)C(=O)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1	1788143493	JGDPWAIAVUVKFS-SFHVURJKSA-N	430.697	1.368	50	20	IDGD	
COc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)Br)C[C@@H]32)ccc1O	1789603689	TYCWMVHRGRTCFE-MJFSBKNWSA-N	441.322	1.778	50	20	IDGD	
COc1ncccc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]2C1	1789922603	PVTIVDWGTNSQIM-DOERSZECSA-N	430.274	1.374	50	20	IDGD	
CC(C)(C)n1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]3C2)cn1	1789922609	PXVDKDBOJYZALE-CYUUQNCZSA-N	445.333	1.922	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)COc3ccccc3F)[C@H]2C1	1790968143	QQIMGPTVLUDGTI-XSWJXKHESA-N	428.888	1.438	50	20	IDGD	
COC(=O)CCCCCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21	1791350870	FFPSTCKILUZMBW-JYJNAYRXSA-N	447.370	1.875	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1ccc(C2(NC(=O)Cn3cc(C)c(O)nc3=O)CCC2)cc1	1791572187	UFEOMIIEGJBAHW-MRXNPFEDSA-N	448.907	1.645	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc([N+](=O)[O-])o1	1792398139	LFVVOICWMKIPIC-ONMDDFKGSA-N	442.432	1.574	50	20	IDGD	
Cc1onc(-c2ccncn2)c1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(C)(C)CCl	1792783957	IINXKXZUELMHET-XOIINTDNSA-N	447.923	1.908	50	20	IDGD	
C[C@H](Oc1ccccc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCBr	1795116343	AYPHKROZICWTIK-AFIMGQEJSA-N	425.323	1.829	50	20	IDGD	
C[C@H](Sc1cccs1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1	1796191345	AZWGXZZPMWCBDI-RUGDWHBFSA-N	444.387	1.861	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1nc3ccccc3[nH]1)C2	1796892485	HCMCXHLKCBFRED-CWNKPHDYSA-N	447.499	1.949	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](C)Br)C2	1796893503	CFMDBZHNASHQMR-ZWVOWAKLSA-N	438.326	1.542	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2cncn2c1	1797532118	JGORTCKMCDLZDU-YALNPMBYSA-N	435.322	1.711	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ncccc1C(F)(F)F	1798228668	CDJYRSXUXUIFCV-ZMJPVWNMSA-N	435.830	1.557	50	20	IDGD	
C[C@H](Cc1ccco1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnccc1C(=O)NN	1798443553	HNXGOCKDUHMSIA-LVQVYYBASA-N	425.489	1.409	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)c1ccccc1N1CCCCC1	1799783075	HVBVCZYLVYGAJI-JSJNYSNDSA-N	435.952	1.480	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CCCO1)C2	1800333238	XEFOHVWDNFUXRT-UHVSXOQYSA-N	431.439	1.640	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)ccc1F	1800395016	OFRDOVMVTFGXSP-CLLJXQQHSA-N	427.436	1.095	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(NC(=O)C3CC3)cc1)C2	1800977830	YYSILGWSWHOVJN-NBMJBFSESA-N	449.935	1.492	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cc3cn[nH]c3cn2)[C@@H]1c1cccnc1)[C@H](O)CCl	1803142918	MVMWFJFASAIUSA-MORSLUCNSA-N	428.880	1.272	50	20	IDGD	
O=C(/C=C/c1ccc([N+](=O)[O-])o1)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1	1803260192	NUNRIUGYCHRBML-NYGUZRMVSA-N	448.863	1.902	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)C#CC2CC2)[C@H]1c1cccnc1	1803451039	PQNVPCXJBGAQPU-RBCAPNDLSA-N	446.511	1.635	50	20	IDGD	
COc1ccc(Cl)c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)c1	1803506838	GKZXWODHQWPSQC-BJWYYQGGSA-N	442.708	1.594	50	20	IDGD	
O=C([C@@H](O)CCl)N1CCCC2(CCN(C(=O)C(F)(F)C(F)(F)C(=O)O)CC2)C1	1805518144	PDRMZOYZEWMXGI-JTQLQIEISA-N	432.798	1.173	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H]2[C@H]3COC[C@H]32)[C@H]1c1cccnc1)[C@@H](F)Br	1808680037	GOLMOTZNVVARPR-UGYDUONOSA-N	426.286	1.670	50	20	IDGD	
Cc1ccccc1NCC(=O)N1CCCC2(CCN(C(=O)c3ccc(B(O)O)cc3)CC2)C1	1809914231	WDTXKULNZYTOJB-UHFFFAOYSA-N	449.360	1.632	50	20	IDGD	
CCc1cc(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](Cl)COC)[C@H]2c2cccnc2)n(C)n1	1810922403	SGQJTVWANPJHFD-IEZWGBDMSA-N	433.940	1.951	50	20	IDGD	
Cc1ccn2c(C(=O)NC[C@@H]3CCN(C(=O)[C@H](O)CCl)[C@@H]3c3cccnc3)cnc2c1	1812252652	OPAGWPHBWAYWOE-ILZDJORESA-N	441.919	1.957	50	20	IDGD	
Cc1nnc(CC(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@@H](F)Br)CC3)o1	1815491162	HNIQEPKVLVFMPV-JMCQJSRRSA-N	432.275	1.680	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@H](O)CCl)CC2)c1ncn(-c2ccccc2)n1	1817487773	ZXIBREVQEUUWQA-BXUZGUMPSA-N	446.920	1.549	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccsc1)CC2	1819795181	JAYJPBXYYWFKAX-NSHDSACASA-N	442.526	1.743	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)CCCn2ccnc2)n[nH]1	1822718689	NLIXTZNOQUBJDL-KRWDZBQOSA-N	444.540	1.452	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H]2CNC(=O)O2)CC1	1824089818	QSGYIDSZQNGPOA-SNPRPXQTSA-N	430.343	1.746	50	20	IDGD	
Cc1[nH]nc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)c1F	1825610552	XRHBIGGIENABDX-INIZCTEOSA-N	436.532	1.464	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1coc(Cl)n1)CC2	1826080758	WWGSYIQSAJAPEN-SECBINFHSA-N	440.913	1.383	50	20	IDGD	
O=C(COC(=O)C(F)(F)F)N[C@H]1CCc2nc(NC(=O)C(Cl)Cl)sc2C1	1826099998	ZCCCDDUZGIXBBU-YFKPBYRVSA-N	434.223	1.964	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1CCc2nc(NC(=O)CCn3ccnn3)sc2C1	1826868942	MZNUARKUGBNZMD-GHMZBOCLSA-N	441.355	1.768	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H]2CCOC2)CC1	1827679828	WNJDJHHVGVWVSS-SPWWYGFFSA-N	443.548	1.777	50	20	IDGD	
C[C@H](NC(=O)c1cnccn1)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H](F)Cl)CC1	1829026162	KPTXNWIPXWYBTQ-RRQGHBQHSA-N	439.919	1.749	50	20	IDGD	
O=C([C@H](O)CCl)N1CCC([C@@H]2CCCCN2C(=O)c2nn[nH]c2C(F)(F)F)CC1	1829790918	YAPSWJLDUYRGDS-NWDGAFQWSA-N	437.850	1.657	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)C3(C#N)CCC3)C2)C1	1830546996	YXWWBFPVWXBZRT-RDTXWAMCSA-N	428.327	1.168	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC([C@@H]2CCCCN2C(=O)Cn2ccncc2=O)CC1	1831106138	FTUBOXPDHSPDLE-SFHVURJKSA-N	434.613	1.715	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CN2CCCCC2=O)CC1	1831832326	CFYVQXKWXLZFFR-MSOLQXFVSA-N	427.973	1.872	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3nnc(C)s3)CCO2)C1	1833014979	APTBLHJHLIFHSR-DNVCBOLYSA-N	444.985	1.643	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3ccccn3)CCO2)C1	1833188101	GOKCVQLVAFKYDG-VQTJNVASSA-N	444.359	1.707	50	20	IDGD	
CC(C)(CCl)C(=O)NC1CCN(C2CCN(C(=O)/C=C\C(=O)NC3CC3)CC2)CC1	1833214905	YGHWADPQMZPHAA-WAYWQWQTSA-N	439.000	1.658	50	20	IDGD	
O=C(Cc1cnccn1)NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1	1833369480	GJSAPSWEJKIWRW-UHFFFAOYSA-N	438.370	1.376	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)Cn3ccncc3=O)CC2)CC1	1833534611	IIWMMYBPYWKTCF-SFHVURJKSA-N	437.972	1.222	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@H](C)Cn3cccn3)CC2)CC1	1833890503	ZIRZGGBOKXRMLX-VQIMIIECSA-N	439.988	1.345	50	20	IDGD	
Cc1cc(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](F)Br)CC3)CC2)nn1C	1834174617	KSNKYNLUFYPDLU-MRXNPFEDSA-N	444.349	1.604	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CNc3ccccc31)CCO2	1835718443	WZCKDZHGNZJNMI-PGRDOPGGSA-N	447.608	1.504	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3cccs3)CCO2)C1	1836091561	PMNAWAUDQMSAEK-ZWKOTPCHSA-N	435.373	1.983	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)Cn3cc([N+](=O)[O-])cn3)CC2)CC1	1836394936	KCWNMDJRVKQZCZ-QGZVFWFLSA-N	440.932	1.380	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccn3cncc3c1)CCO2	1837078475	DUFIQDMABUVSDQ-OAQYLSRUSA-N	446.580	1.256	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc4c(c3)CNC4=O)CCO2)C1	1837152505	QBUDFHGKDIILES-UWJYYQICSA-N	435.908	1.017	50	20	IDGD	
O=C(CCBr)N1CCC(OC2CCN(C(=O)Cc3ncccn3)CC2)CC1	1837209934	UBRDXTPVYIITIZ-UHFFFAOYSA-N	439.354	1.803	50	20	IDGD	
CC(C)N1CCC[C@H]1C(=O)N1CCOC[C@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1837718176	ZBDZULFEWJLSIA-RXVVDRJESA-N	441.645	1.167	50	20	IDGD	
O=C(CCN1CCOCC1)N1CCC(OC2CCN(C(=O)C(Cl)Cl)CC2)CC1	1837816790	TZAZUOPEOUQCRV-UHFFFAOYSA-N	436.380	1.511	50	20	IDGD	
COc1ccsc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)Br)C2)C1	1838299195	GAIZLHGKVQHLRK-SJCJKPOMSA-N	447.351	1.610	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3c(F)cccc3F)CCO2)C1	1838864286	XHKWGAVSNQWQKY-SGTLLEGYSA-N	447.276	1.818	50	20	IDGD	
N#CCc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)cc1	1839364151	PDNICTOMNFJRPN-IBGZPJMESA-N	426.300	1.626	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3C[C@H]3C3CC3)C2)C1	1839962120	VBVJMWSVMVXAMT-RCJHGTSTSA-N	429.355	1.662	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)ON=C(C)C)C2)C1	1839965676	HKTOIQDDOOGNAF-VKJFTORMSA-N	448.358	1.417	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3cnc4[nH]ccc4c3)CCO2)C1	1840081503	RJZDTKMRZOGOLS-GCJKJVERSA-N	448.951	1.969	50	20	IDGD	
Cc1c(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)nc2ccccn12	1840187610	NFGZBVDCHITVTR-LJQANCHMSA-N	441.315	1.516	50	20	IDGD	
COc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)c(O)c1	1840189081	VNLCXZYGZBNTCS-GOSISDBHSA-N	433.288	1.275	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CC[C@H]3CCOC3)CCO2)C1	1840590151	FVPWXUPJKNHZKC-BXWFABGCSA-N	447.370	1.433	50	20	IDGD	
O=C(c1ccccc1OC(F)F)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1840744743	VDTBGDHVLNJLCZ-KSSFIOAISA-N	436.814	1.892	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)N2CCCC23CN(C(=O)[C@@H](F)Br)C3)c1	1841172293	MIDVNSKPKAAZCE-CYBMUJFWSA-N	433.299	1.598	50	20	IDGD	
C[C@H](Br)C(=O)N1CC2(CCCN2C(=O)c2ccc(S(C)(=O)=O)cn2)C1	1842255822	HUHLBVRGSSASBC-NSHDSACASA-N	430.324	1.086	50	20	IDGD	
CC(C)COc1cc(C(=O)N2CCCC23CN(C(=O)CCC(=O)NN(C)C)C3)ccn1	1843431336	BKVZPZPSZUITFR-UHFFFAOYSA-N	431.537	1.306	50	20	IDGD	
Cc1cn2c(=O)c(C(=O)N3CCCC34CN(C(=O)[C@@H](F)Br)C4)cnc2s1	1843785482	GVTNOLNDUUFPQU-LLVKDONJSA-N	443.298	1.572	50	20	IDGD	
CC(=O)N[C@H](C(=O)N1CCCC12CN(C(=O)[C@@H](F)Br)C2)c1ccc(F)cc1	1845006529	AEEDPCQIYZHIML-LSDHHAIUSA-N	444.276	1.897	50	20	IDGD	
O=C([C@H](O)CCl)N1CC2(CCCN2C(=O)c2cccc(I)c2)C1	1845303844	XHUXARMIKXJOIH-CYBMUJFWSA-N	448.688	1.708	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC2(CCCN2C(=O)[C@H]2C[C@@]23C(=O)Nc2ccccc23)C1	1846153998	RLRPVMXRGPTDCB-ZGLRSVDFSA-N	432.318	1.883	50	20	IDGD	
C[C@@H](C(=O)N1CCCC12CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)C2)n1cnnn1	1846647831	VCYOXNZKOTVPSJ-FEZXJWFHSA-N	427.415	1.323	50	20	IDGD	
Cc1cc(NC(=O)CC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](C)CBr)no1	1847499273	ZYXRANUHQXRNJC-WXHSDQCUSA-N	427.299	1.544	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](O)CCl)CC1	1847569001	SHRRVGGCLWUKRI-JYJNAYRXSA-N	429.945	1.435	50	20	IDGD	
O=C(CSc1nnc(NC[C@@H]2CCCO2)s1)NNC(=O)c1cccc([N+](=O)[O-])c1	16330848	JFFOGZOZGNFGRW-LBPRGKRZSA-N	438.491	1.591	50	20	IDGD	
O=C(COc1ccccc1Cc1ccccc1)NNC(=O)Cn1nnc2ccccc2c1=O	16593088	JURZDJKKRAMZMF-UHFFFAOYSA-N	443.463	1.609	50	20	IDGD	
O=C(CCNC(=O)c1ccc(Br)cc1)NNC(=O)COc1ccc(F)cc1	18101183	RRWCTCZJGVEBQO-UHFFFAOYSA-N	438.253	1.935	50	20	IDGD	
Cc1ccc(-n2cnnc2SCC(=O)NNC(=O)c2n[nH]c(=O)c3ccccc23)cc1	25351585	RXYJGYJFJCHAMR-UHFFFAOYSA-N	435.469	1.366	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)c1cccc(S(=O)(=O)N2CCCC2)c1	26975079	AARARXOOCYQCDM-GOSISDBHSA-N	431.470	1.072	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(Br)cnc2Cl)c1	725884642	SCQBOVFIUFJJFK-UHFFFAOYSA-N	432.683	1.976	50	20	IDGD	
C#Cc1cccc(NC(=S)NNC(=O)CCNS(=O)(=O)/C=C\c2ccccc2)c1	727501108	HRBNTYGVAKKECZ-OWBHPGMISA-N	428.539	1.966	50	20	IDGD	
CCCOC(=O)c1ccc(S(=O)(=O)NNC(=O)c2nnc(-c3ccccc3)o2)cc1	727796994	HZXFEVQJNVYFFE-UHFFFAOYSA-N	430.442	1.927	50	20	IDGD	
Cn1ccnc1[C@](O)(CCNC(=O)NNC(=O)CCCc1ccccc1)C(F)(F)F	727843119	SJEAPPOJELJQBF-GOSISDBHSA-N	427.427	1.913	50	20	IDGD	
CN(C)N(C(=O)[C@@H]1CCCN(C(=O)c2ccc(Cl)cc2)C1)[C@H]1CCS(=O)(=O)C1	728176903	OYATVDDKVBKSEA-WBVHZDCISA-N	427.954	1.685	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)Cc3ccc4c(c3)OCO4)cc2)CC1	728215787	IUWFBMCYFSWQNF-UHFFFAOYSA-N	432.502	1.037	50	20	IDGD	
CC(C)c1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)Cc3cccnc3)CC2)cc1	728856466	PWPQDAONDVUUJC-UHFFFAOYSA-N	444.557	1.996	50	20	IDGD	
COCCOc1cn(-c2ccccc2)nc1C(=O)NNC(=O)COc1ccc(F)cc1	729300258	PVAHEPZPZYKIHU-UHFFFAOYSA-N	428.420	1.877	50	20	IDGD	
C[C@@H]1CCCC[C@]12NC(=O)N(CC(=O)NNC(=S)Nc1ccc(N(C)C)cc1)C2=O	729689923	WPGKWFGINYYCIB-XCLFUZPHSA-N	432.550	1.571	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)c2cccc(S(=O)(=O)N(C)C(C)C)c2)cn1	729693383	WKZSWDSZDBXFTG-UHFFFAOYSA-N	437.547	1.751	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@@H]2C(=O)NNC(=O)Cc2ccccc2F)s1	731329962	IPQHGZCVMQFYDK-OAHLLOKOSA-N	425.507	1.739	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)c2nnn(-c3ccc4c(c3)OCCO4)c2C)c1	731469901	CSFGGCFFFRIFKK-UHFFFAOYSA-N	437.456	1.804	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@@H]2CC(=O)N(CC(F)(F)F)C2)cc1Br	732035452	DTSKRJNKYWEMIX-SECBINFHSA-N	438.200	1.630	50	20	IDGD	
CC(C)Cn1ncc2cc(C(=O)OCC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)cnc21	732333828	WIHYCYCEPLCAQY-UHFFFAOYSA-N	440.416	1.614	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)c1cccc(S(=O)(=O)NC2CC2)c1	733109736	CCQLSKWKPMSWBI-UHFFFAOYSA-N	425.470	1.388	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCCC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1C	733171303	MRHUCLXTUVIDHG-UHFFFAOYSA-N	441.513	1.619	50	20	IDGD	
C[C@H]1CN(CC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)C[C@@H](C)N1C(=O)OC(C)(C)C	733200304	LIZUFRACMSHKBZ-OKILXGFUSA-N	435.481	1.686	50	20	IDGD	
CC(C)n1ncc2cc(/C=C/C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)c(=O)[nH]c21	734239821	FGIVWJNJIANBAP-VOTSOKGWSA-N	447.496	1.174	50	20	IDGD	
O=C(NCc1nc(-c2cccc(Cl)c2)no1)NNC(=O)c1ccc(-n2cnnn2)cc1	734517021	NGFIBXOBDNSFIZ-UHFFFAOYSA-N	439.823	1.510	50	20	IDGD	
CCCC(=O)N1CCCC[C@H]1C(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	734824584	DVYXZMRORUORSO-INIZCTEOSA-N	439.557	1.898	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@@H]2CC(c3c(F)cccc3F)=NO2)cc(OC)c1OC	735989757	MZSIGUXRTPGYTF-INIZCTEOSA-N	435.383	1.945	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN2CCC(N(C)S(=O)(=O)CC)CC2)cc1C	736310268	ONVGRUCBUMLHME-UHFFFAOYSA-N	430.596	1.126	50	20	IDGD	
CCOC(=O)N1[C@H](c2ccc(C)o2)CC[C@@H]1C(=O)NNC(=O)CNC(=O)c1ccco1	736483293	ZBHMVQZKJZSGSC-UONOGXRCSA-N	432.433	1.420	50	20	IDGD	
O=C(COCc1ccccc1)NNS(=O)(=O)c1cc(C(=O)O)sc1Br	737756533	QRTYYNYJAVPAPH-UHFFFAOYSA-N	449.304	1.735	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NC[C@H]2CCN(c3ccccc3)C2)cc1	743552502	UKRORFWVRPIZNR-OAHLLOKOSA-N	431.518	1.952	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)CN2C(=O)Cn3c(cc4ccccc43)C2=O)cc1	743845407	OBIFUHZBYAALAC-UHFFFAOYSA-N	436.493	1.872	50	20	IDGD	
Cc1ccccc1O[C@H](C)C(=O)N1CCN(CC(=O)NNC(=O)c2ccc(C#N)cc2)CC1	744406316	BRUZPNPMCRESJO-GOSISDBHSA-N	449.511	1.239	50	20	IDGD	
COc1cccc(CO[C@H](C)C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)c1	744619108	HXUVBKPPUQHKMH-MRXNPFEDSA-N	449.529	1.765	50	20	IDGD	
Cc1nc2c(cc1C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1)c(C)nn2C	744621441	XBKLHHARDJHPKQ-UHFFFAOYSA-N	444.517	1.363	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)O[C@@H](C)C(=O)Nc2cccc(S(N)(=O)=O)c2)cc(C#N)n1C	744633652	YMQLLHFEIBVBJQ-XKBFBRDOSA-N	441.469	1.330	50	20	IDGD	
C[C@@](O)(C(=O)OCC(=O)NNC(=O)c1cccc(C#N)c1)c1cccc(C(F)(F)F)c1	745104609	NZOGXQSUUBATTG-IBGZPJMESA-N	435.358	1.789	50	20	IDGD	
C[C@@H](CCc1cccn1C)NC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	745874847	FXYVISAXCKNUCC-INIZCTEOSA-N	447.561	1.775	50	20	IDGD	
CC(C)CN1CCC[C@@H](CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)C1	746328676	QBXHTRGMXLHTIV-INIZCTEOSA-N	439.582	1.249	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN(C)[C@@H]1CCCC[C@@H]1S(C)(=O)=O	746469926	FDCRXWNNPHDGKP-ZBFHGGJFSA-N	431.942	1.397	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)N2CCN(S(=O)(=O)CCOC(C)C)CC2)cc(C#N)n1C	746873117	YVAUVGKBLPPIQR-WQRHYEAKSA-N	433.534	1.011	50	20	IDGD	
CC(C)NS(=O)(=O)CCNC(=O)NNC(=O)COc1ccccc1Cc1ccccc1	746974087	ZNIUXQIOEZCZLW-UHFFFAOYSA-N	448.545	1.314	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2c(C)nc(O)nc2SC)c2ccccc2c1=O	747199790	WQDUWFOLUIDFFP-UHFFFAOYSA-N	428.474	1.407	50	20	IDGD	
NC(=O)N1CCC[C@H](C(=O)NNC(=O)[C@H]2Cc3ccccc3CN2Cc2ccccc2)C1	747787455	QMDZORYZEDGMQU-LEWJYISDSA-N	435.528	1.552	50	20	IDGD	
NC(=O)CC[C@@H](C(=O)NNc1ccc(OC(F)F)cc1)N1C(=O)c2ccccc2C1=O	748637212	IQDOFNQOQMBYEN-HNNXBMFYSA-N	432.383	1.661	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)NCC(=O)N1CCN(c2ccccc2)CC1	749222499	YOZQPCRZXHTGII-INIZCTEOSA-N	443.479	1.272	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Cc2nc(-c3ccco3)oc2C)cc1	749560825	KYLSXEWJWKGKEQ-UHFFFAOYSA-N	446.485	1.562	50	20	IDGD	
Cn1c(=NNC(=O)CCNS(=O)(=O)c2ccc([N+](=O)[O-])cc2)sc2ccccc21	749567756	ZWBVSMJGSYKZRM-UHFFFAOYSA-N	435.487	1.449	50	20	IDGD	
CC(=O)N1C[C@@H](C(=O)NNc2nc(Br)cn3ccnc23)Oc2ccccc21	750246885	INXZURKCVZVNOU-ZDUSSCGKSA-N	431.250	1.749	50	20	IDGD	
CN1C(=O)N[C@]2(CCC[C@H]2CNC(=O)NNC(=O)c2ccc(Br)s2)C1=O	752003220	RXIOZYAMCGSXJF-AYVTZFPOSA-N	444.311	1.175	50	20	IDGD	
NC(=O)c1cc(CNC(=O)NNC(=O)Nc2ccc(Br)cc2Cl)on1	752195303	ZNSAXTFVNWMXPH-UHFFFAOYSA-N	431.634	1.725	50	20	IDGD	
COc1ccnc(NNC(=O)c2cc(S(N)(=O)=O)cc(Br)c2Cl)n1	753798506	QCQVPADFCONGLL-UHFFFAOYSA-N	436.675	1.305	50	20	IDGD	
O=C(CN1CCn2c(CCc3ccccc3)nnc2C1)NNC(=O)c1ccc([N+](=O)[O-])cc1	754663138	HRDSFWCCUHQDQF-UHFFFAOYSA-N	449.471	1.248	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)CNC(=O)c2ccccc2C(F)(F)F)c1	755160191	QUFDURDIUXDFQN-UHFFFAOYSA-N	443.403	1.300	50	20	IDGD	
O=C(NNc1ccc(C(F)(F)F)nn1)c1ccc(S(=O)(=O)N=c2cc[nH]cc2)cc1	755187247	JPOOLJBPDQLWFB-UHFFFAOYSA-N	438.391	1.870	50	20	IDGD	
O=C(NNc1ccc(C(F)(F)F)nn1)[C@H]1CN(Cc2nc(O)c3ccccc3n2)CCO1	755198208	MXKPKVFYYYUFGQ-CYBMUJFWSA-N	449.393	1.488	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2ccccc2S(C)(=O)=O)c2ccccc2c1=O	755583073	KIDAYTIPCPWVMP-UHFFFAOYSA-N	429.458	1.286	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)CN2C(=O)NC3(C[C@H](C)C[C@@H](C)C3)C2=O)c1	756865248	OXCBDVXJYWTQHQ-HZPDHXFCSA-N	430.505	1.576	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2ccc(C(F)(F)F)nc2)cc1	757794346	OGJQWSKMDXACRP-UHFFFAOYSA-N	445.423	1.882	50	20	IDGD	
Cc1c(C(=O)NNc2nc3ccccc3c(=O)n2C)cnn1CCO[C@H]1CCCCO1	759104283	UQAJAQDWWWMROV-SFHVURJKSA-N	426.477	1.739	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)NC[C@H]1CN(Cc2ccccc2)CCCO1	759233494	UTJMWEZIIAADAR-KRWDZBQOSA-N	435.525	1.133	50	20	IDGD	
C[C@H](c1ccccc1)[C@](C)(O)C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	759555598	HGKGCRMVFVVESO-KEQGGVEFSA-N	428.441	1.072	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)NC[C@]1(Cc2ccc(F)cc2)CCC[C@H]1O	759672010	NFGPVCBOFPPZJY-DYESRHJHSA-N	432.452	1.253	50	20	IDGD	
O=C(NNC(=O)c1ccncc1)C(=O)Nc1ccc(-c2nnc3n2CCCCCC3)cc1	763467550	UCGQULHDQGIBGO-UHFFFAOYSA-N	433.472	1.856	50	20	IDGD	
C[S@](=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2Br)cc1F	763483194	OZNRGDHQRCFZHD-SANMLTNESA-N	442.266	1.725	50	20	IDGD	
O=C(NNC(=O)c1c[nH]c2ccccc12)C(=O)Nc1ccc(S(=O)(=O)NC2CC2)cc1	763540293	FREMMIAZEJQZCX-UHFFFAOYSA-N	441.469	1.008	50	20	IDGD	
COC(=O)c1c(C2CC2)csc1NC(=O)C(=O)NNC(=O)COc1ccccc1F	763680766	QOTHJDUZIYGQGR-UHFFFAOYSA-N	435.433	1.716	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(C)nn1C1CCOCC1	763716249	FLCPTZUOYQFNOV-UHFFFAOYSA-N	429.477	1.270	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)ccc1C(F)(F)F	763790811	PDZWPUCQTOYXBZ-UHFFFAOYSA-N	447.373	1.660	50	20	IDGD	
Cn1nc(C2CCCC2)cc1NC(=O)C(=O)NNC(=O)COc1ccccc1[N+](=O)[O-]	763805991	XTBGHJDGKZVQFH-UHFFFAOYSA-N	430.421	1.151	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)cc1	763838647	ARKHMPLDFZGCAH-OAHLLOKOSA-N	443.456	1.409	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccc(O[C@H]2CCOC2)cc1	763864453	JNGPLWCSPOXAIG-CJNGLKHVSA-N	431.420	1.547	50	20	IDGD	
Cc1cc(C(=O)NC(C)C)ccc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccc(F)cc1	763866242	NWKCABFVSPNGGN-CQSZACIVSA-N	444.463	1.826	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1cccnc1Br	763866939	RTCPRHAKGPQDLD-SECBINFHSA-N	425.214	1.537	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cccc([S@](C)=O)c2)cc1	763872604	OWNPMOUHZVYKRY-OSXTUODASA-N	431.470	1.180	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)C(=O)Nc1ccc(CC(N)=O)cc1	763902420	KPYVWOFQQQCQPL-UHFFFAOYSA-N	437.481	1.546	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)C(=O)Nc1ccc(CCN2CCCC2)cc1	763996298	OOHBBVCSSSWQOC-UHFFFAOYSA-N	448.321	1.815	50	20	IDGD	
CN(C)c1ncncc1NC(=O)C(=O)NNC(=O)c1ccc(Br)cc1Cl	764059375	SXKJEZNDQBFWRI-UHFFFAOYSA-N	441.673	1.358	50	20	IDGD	
CC(=O)N(Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(C)cc2O)cc1)C(C)C	764112218	UEDGCACQELVRFX-UHFFFAOYSA-N	426.473	1.857	50	20	IDGD	
CCC(CC)NC(=O)[C@@H]1CN(C(=O)C(=O)NNC(=O)CC(F)(F)F)c2ccccc2O1	764114423	ARWRRCVCKFWZGX-AWEZNQCLSA-N	444.410	1.185	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(C)cc2OCCN(C)C)c1O	764130916	LFCHJSXFMTYJPP-UHFFFAOYSA-N	430.461	1.049	50	20	IDGD	
Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)C(=O)NNC(=O)c1ccoc1	764159118	SBQWCXMDMADXIU-SFHVURJKSA-N	436.472	1.631	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)CCC(C)C)cccc1S(=O)(=O)NC(C)(C)C	764198634	MFXCBSNNEJBPFL-UHFFFAOYSA-N	426.539	1.594	50	20	IDGD	
O=C(Cc1ccccn1)NNC(=O)C(=O)Nc1cc(Cl)ccc1OC[C@H]1CCCO1	764264772	UAFOBEDENLIKCZ-OAHLLOKOSA-N	432.864	1.621	50	20	IDGD	
Cc1ccc(-n2ccnc2SCC(=O)NNC(=O)CNC(=O)c2cccnc2)cc1C	764341822	KYRHVWBVKLPNBM-UHFFFAOYSA-N	438.513	1.554	50	20	IDGD	
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC(=O)C(=O)NNC(=O)Cc2ccncc2)cc1	764353922	MVGVWCARVPYFON-AWEZNQCLSA-N	441.488	1.996	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@@H]2CCCC[C@@H]2N2CCOCC2)c2ccccc2c1=O	764374500	KXLPTTGGNVTSCO-MSOLQXFVSA-N	442.520	1.004	50	20	IDGD	
COC(=O)c1[nH]c(C)cc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccc(C)c(C)c2)[nH]n1	764387226	HUUSPJSQMMEAFB-UHFFFAOYSA-N	438.444	1.516	50	20	IDGD	
CC(=O)N(C)c1ccccc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	764389013	WDORWOYGUFUBBF-UHFFFAOYSA-N	438.419	1.598	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COCCO1)C(=O)Nc1cccc(Oc2ccnc3ccccc23)c1	764423998	FSNPZDQUFHOWJR-IBGZPJMESA-N	436.424	1.528	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNC(=O)c2cncc(NC(C)=O)c2)cc1OCC	764433197	LLPXJAHWNHSCGU-UHFFFAOYSA-N	429.433	1.237	50	20	IDGD	
Cn1nc2c(c1C(=O)NNC(=O)c1cccc(S(=O)(=O)N3CCCCC3)c1)CCCC2	764463260	JEJLROSLENWZLR-UHFFFAOYSA-N	445.545	1.548	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)[C@@H]1CN(C(=O)OC(C)(C)C)CCO1	764547272	IQCDFUYUADLZEG-INIZCTEOSA-N	431.493	1.382	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)CCN3C(=O)[C@H]4CCCC[C@H]4C3=O)n[nH]2)cc1	765576959	WEVFYVJUAVLPFB-CALCHBBNSA-N	437.500	1.965	50	20	IDGD	
O=C(NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)N[C@@H]1CCO[C@@H](C2CC2)C1	765921073	WSVDNKYVUJRIES-SJLPKXTDSA-N	436.534	1.373	50	20	IDGD	
O=C(C[C@@H](C(=O)NN=C1CC(C(F)F)C1)N1CCOCC1)NN=C1CC(C(F)F)C1	766024457	FAAXHNHCUOIALF-MGULZYLOSA-N	435.422	1.372	50	20	IDGD	
Cc1nc(C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)c2ccccn12	766659494	BRCYFGIUSSLBDG-UHFFFAOYSA-N	440.935	1.875	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](OCC(=O)NNC(=O)c2ccc3c(c2)OCCO3)C1	767830647	KOFKGBAAXIZXEX-HNNXBMFYSA-N	435.477	1.635	50	20	IDGD	
COc1cc2c(cc1OC)CN(C(=O)CCC(=O)NNc1ncccc1[N+](=O)[O-])CC2	768233147	VMDSONWXPMHLKZ-UHFFFAOYSA-N	429.433	1.815	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)c1cccc(S(=O)(=O)N(C)OC)c1	768645223	NYMAIISRVVVQBA-UHFFFAOYSA-N	443.503	1.038	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)c1c[nH]c2c(OC(F)(F)F)cccc2c1=O	770040341	ISORBMWKRGKPTF-UHFFFAOYSA-N	449.345	1.013	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)N[C@@H](C)c1cccc(S(N)(=O)=O)c1	770102900	MJBRWKRUUZTWIZ-RYUDHWBXSA-N	440.909	1.846	50	20	IDGD	
C[C@@H](CBr)COC(=O)[C@@H](C)NC(=O)c1ccc(S(=O)(=O)N(C)C)cc1	770337600	SPAZZUKNKLOOQB-NWDGAFQWSA-N	435.340	1.629	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)NCc3ccccc3CS(C)(=O)=O)nc21	770401130	JSFOEWBNAAWGPT-UHFFFAOYSA-N	447.521	1.658	50	20	IDGD	
CCOC(=O)Cc1nnc(NC(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)s1	770619858	VXCJVDJCCZGOOD-SECBINFHSA-N	427.870	1.917	50	20	IDGD	
Cc1nc2c3ccccc3nn2c(C)c1CCC(=O)NNc1nc(O)c2cnn(C)c2n1	770973582	NGDXBMBKDXDHIV-UHFFFAOYSA-N	431.460	1.958	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)Cc2cccc(OCCOC)c2)c2ccccc2c1=O	772015175	PBLRCDRFYPUSGB-UHFFFAOYSA-N	438.484	1.835	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)ccc1O)C(=O)Nc1cc(C(F)(F)F)ccn1	773545411	FLKKBBQGQPDVND-UHFFFAOYSA-N	447.167	1.968	50	20	IDGD	
O=C(NNc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cccc(Cn2nc3ccccn3c2=O)c1	773640102	WTKIGTLJWNINMW-UHFFFAOYSA-N	447.411	1.534	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN[C@@H](C)c2ccc(S(=O)(=O)NC)cc2)cc1C	775238866	SJONQSYUACDPMI-ZDUSSCGKSA-N	438.575	1.639	50	20	IDGD	
CN(NC(=O)c1cccc2c1oc(=O)n2C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776205629	NIMOUFZGMLXDND-UHFFFAOYSA-N	433.465	1.381	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)NCc2nc(C(F)(F)F)n[nH]2)c2ccccc2c1=O	776255917	IGBDSYJMZRMRDL-UHFFFAOYSA-N	438.370	1.259	50	20	IDGD	
C[C@@H]1OC(C)(C)N(C(=O)OC(C)(C)C)[C@H]1C(=O)OCC(=O)NNC(=O)c1cccs1	776481125	VKKFPPQQYJQJFC-SMDDNHRTSA-N	441.506	1.813	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)Cc3ccccc3CC#N)cc2)CC1	777425601	CTJZEZXIBDVYAE-UHFFFAOYSA-N	427.530	1.375	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)CSC1CCN(C(=O)OC(C)(C)C)CC1	777803950	NEXIWUNYJJPABW-UHFFFAOYSA-N	430.571	1.571	50	20	IDGD	
CC[C@@H](C)C(=O)N1CCC[C@H](C(=O)N2CCN(S(=O)(=O)CBr)CC2)C1	777836302	IKBIONTZSWWJIM-KGLIPLIRSA-N	438.388	1.098	50	20	IDGD	
O=C(CSc1ccccc1O)NNS(=O)(=O)c1ccc(OCC(F)(F)F)nc1	778031965	HLQVTJXKRDYKJZ-UHFFFAOYSA-N	437.421	1.830	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@@H](C(=O)NNC(=O)c2cc3ccccc3o2)[C@@H](C)O)cc1	779529868	QFGHSYGEWIVFNT-FZKQIMNGSA-N	431.470	1.230	50	20	IDGD	
CC(C)(C(=O)NNC(=O)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(F)cc1)c1ccccc1	780638591	JYASNOWUGRMPNG-AEFFLSMTSA-N	449.504	1.075	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)[C@H]1C[C@@]12CCN(C(=O)OC(C)(C)C)C2	781281971	MDHIZFRSPYQNIA-UZUQRXQVSA-N	445.516	1.875	50	20	IDGD	
CCS(=O)(=O)c1ccc(Br)c(C(=O)NNC(=O)NCC(F)(F)F)c1	781680172	NWQBOXPWSNYSIK-UHFFFAOYSA-N	432.218	1.749	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2ccc(C(=O)N(C)[C@@H]3CCCN(C)C3)cc2)nc1	782148157	CWRNBJTWISDPIJ-QGZVFWFLSA-N	440.504	1.338	50	20	IDGD	
CCN1CCN(C(=O)c2ccc(NC(=O)C(=O)NNc3ccc(OC)cc3)cc2)CC1	783036459	CIDQOFMCUNCEHQ-UHFFFAOYSA-N	425.489	1.555	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNc2nccnc2Cl)c2ccccc12	784776167	FAZPCNDKLSFMKW-UHFFFAOYSA-N	429.820	1.917	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2cccc(S(C)(=O)=O)c2)nn1-c1cccc(F)c1	784844874	SIJLFBJTBXHNRT-UHFFFAOYSA-N	431.449	1.805	50	20	IDGD	
O=C1COc2ccc(NC(=O)C(=O)NNc3c(F)cc(C(=O)NC4CC4)cc3F)cc2N1	785099198	AFNKMCPERJCGPQ-UHFFFAOYSA-N	445.382	1.270	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1ccc(CCN(C)C)cc1	785330355	FXBQFJISNFORGC-UHFFFAOYSA-N	434.518	1.285	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1ccc(S(=O)(=O)Nc2ccccc2C)cc1	785510635	UQAUOAGZVGXRRH-AWEZNQCLSA-N	433.486	1.899	50	20	IDGD	
Cn1cc(-c2ncccc2NC(=O)C(=O)NNC(=O)c2cccc(OC(F)F)c2)cn1	786416600	GSBXVLUPTZARFQ-UHFFFAOYSA-N	430.371	1.483	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCOc3ccc(Br)cc32)n1	786428842	XHXDTJKZYRQAMQ-UHFFFAOYSA-N	425.308	1.803	50	20	IDGD	
CS(=O)(=O)c1ccc(NCCNC(=O)/C(C#N)=C\c2ccc(O)cc2)c([N+](=O)[O-])c1	786762384	DSFMXPHBZNNIFV-UVTDQMKNSA-N	430.442	1.839	50	20	IDGD	
COC[C@H](C)Oc1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)Cn1nc(C)cc1C	787888547	BQQJGCILINSTEI-ZDUSSCGKSA-N	437.884	1.353	50	20	IDGD	
CC(C)[C@@H](CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)c1ccnn1C	788318730	JLZZIAPSWPTTBD-MRXNPFEDSA-N	436.538	1.054	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCC(O)(CC)CC)c1	788323592	FXIMSCCOZKGBOP-UHFFFAOYSA-N	428.555	1.602	50	20	IDGD	
O=C1CCc2cc(F)c(NC(=O)C(=O)NNC(=O)[C@H]3OCC[C@H]3c3ccccc3)cc2N1	789810487	OLZFVHPQTURNMO-LIRRHRJNSA-N	440.431	1.369	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2cnnn2-c2cccc(F)c2)c2ccccc2c1=O	789869699	WIELLDRBAHLAJC-UHFFFAOYSA-N	435.419	1.601	50	20	IDGD	
O=C(NNc1cccc(F)c1[N+](=O)[O-])C(=O)Nc1cccc(N2CCCS2(=O)=O)c1	790998439	MXGJGNUFBVHLHJ-UHFFFAOYSA-N	437.409	1.356	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1cc2nccnc2cc1F	792208558	ACWZKZILXQMMLW-UHFFFAOYSA-N	431.449	1.547	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1cc(C)cc(N2CCN(C(C)C)CC2)c1	792270003	YVUVPWAFXLTNOG-UHFFFAOYSA-N	427.509	1.406	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)cccc1NC(=O)N(C)C	792356148	MROLCMVGGVTTAO-UHFFFAOYSA-N	449.414	1.846	50	20	IDGD	
Cc1nc(N)c2c(C)c(C(=O)NNC(=O)CNC(=O)OCc3ccccc3)sc2n1	794060150	BLYZMAGHNADESI-UHFFFAOYSA-N	428.474	1.578	50	20	IDGD	
CCn1nc(C)c(CC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1C	794195122	FLXYIJSBNFEMDE-UHFFFAOYSA-N	433.534	1.308	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccccc1S(=O)(=O)C(F)F)c1ccc([N+](=O)[O-])cc1	794576148	FKVPUUHAEGARSM-UHFFFAOYSA-N	435.386	1.214	50	20	IDGD	
CC(C)[C@@H](NC(=O)NCc1ccccc1)C(=O)NNc1ccccc1S(=O)(=O)N(C)C	795182202	RHFHXWHYIFWRCL-LJQANCHMSA-N	447.561	1.904	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)CN1C(=O)C(F)(F)Oc2ccccc21	796067263	XOYGRFGPXLPXDF-UHFFFAOYSA-N	447.394	1.247	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C(=O)Nc1ccc(OC(C)C)c(C(N)=O)c1)c1ccccc1	797009587	VJMUTZZRKWIWMF-INIZCTEOSA-N	426.473	1.852	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)c1cc([N+](=O)[O-])cnc1O	798353696	MTUFZROKCBTFNX-QMMMGPOBSA-N	425.195	1.686	50	20	IDGD	
CN1C(=O)COc2cc(NC(=O)C(=O)NNC(=O)C34CC5CC(CC(C5)C3)C4)ccc21	799257636	OCFIDIHTSBPQPF-UHFFFAOYSA-N	426.473	1.344	50	20	IDGD	
NC(=O)[C@@H]1CC(C(=O)NNC(=O)Nc2ccc(Br)cc2)=NN1c1ccccc1	801996373	IGYJCTLHFXISOD-HNNXBMFYSA-N	445.277	1.722	50	20	IDGD	
C[C@@]1(c2ccc(Br)cc2)NC(=O)N(CC(=O)NNc2ncccc2F)C1=O	804219542	LJPFLDABPOPMLG-KRWDZBQOSA-N	436.241	1.894	50	20	IDGD	
CCOC(=O)C(C)(C)c1csc(NC(=O)C(=O)NNC(=O)COc2cccc(C)c2)n1	806973984	ZYYMUGBGFMCTCX-UHFFFAOYSA-N	448.501	1.457	50	20	IDGD	
CCOC(=O)C(C)(C)c1csc(NC(=O)C(=O)NNC(=O)c2ccccc2OC)n1	806976641	JKVJRLYPZDUSBT-UHFFFAOYSA-N	434.474	1.392	50	20	IDGD	
CNS(=O)(=O)c1cc(NC(=O)C(=O)NNc2ncccc2C(F)(F)F)ccc1F	806994322	CSUDDHVDRBWCHO-UHFFFAOYSA-N	435.359	1.229	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)NNC(=O)[C@H]3COc4ccccc4O3)cc2C1	807026178	KSMFTXHABYONPS-XHDPSFHLSA-N	430.486	1.688	50	20	IDGD	
COc1ccc(I)c(NC(=O)C(=O)NNc2cccc(F)n2)c1	807391322	MWGILSRAZKLERB-UHFFFAOYSA-N	430.177	1.916	50	20	IDGD	
Cc1cc([N+](=O)[O-])ccc1NNC(=O)C(=O)Nc1ccc(C(=O)N2CCOCC2)cc1C	807456329	HLADGCKYBHIJAX-UHFFFAOYSA-N	441.444	1.766	50	20	IDGD	
Cc1ccc(C)c(S(=O)(=O)NCC(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)c1	811461485	CYSRXPDCGAXTST-CQSZACIVSA-N	439.921	1.850	50	20	IDGD	
Cc1ccc(N2C[C@H](C(=O)NNc3ccc(S(=O)(=O)N(C)C)cc3)CC2=O)cc1F	812731453	LMGSLMQNMQXQEK-CQSZACIVSA-N	434.493	1.881	50	20	IDGD	
CC(C)Oc1cc(NC(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)ccc1C(N)=O	812971870	WBDJHCXFGGTUAB-UHFFFAOYSA-N	435.506	1.972	50	20	IDGD	
O=C(NNC(=O)C1(Cc2ccc(F)cc2)CCOCC1)c1csc(N2CCOCC2)n1	814224664	JTVJEEFZUGLXKU-UHFFFAOYSA-N	448.520	1.919	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)c2cnn(C)c2I)c1C	814736562	RWVSBNFNKVUOLI-NSHDSACASA-N	442.257	1.870	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NN=C(C)c1c[nH]nc1C)N(S(C)(=O)=O)CC2	814758809	ILLYHYOYMATRCC-KRWDZBQOSA-N	449.533	1.525	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)C[C@H]3CCCS(=O)(=O)C3)n[nH]2)cc1OC	815886781	JAIIOOZOYVNJAQ-GFCCVEGCSA-N	436.490	1.070	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)CN2C(=O)[C@@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2=O)cc1OC	913070599	SFTWFCGRKZFRCS-MBZVMHRFSA-N	427.457	1.052	50	20	IDGD	
O=C(CCNS(=O)(=O)/C=C\c1ccccc1)NNC(=O)c1cc(-c2ccccc2)[nH]n1	913423023	PQAQTKKRUYJQQH-OWBHPGMISA-N	439.497	1.818	50	20	IDGD	
O=C(CNS(=O)(=O)c1c(F)cccc1F)NNC(=S)Nc1cccc(Cl)c1	913522143	KPROTMKRSMGCAC-UHFFFAOYSA-N	434.877	1.914	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)c2cnc3nc(O)nc(O)c3c2)cc1OC	915671305	PQQAPXZTKBWWFU-UHFFFAOYSA-N	427.417	1.698	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCCc2ccc(Cl)cc2)cc1	915885674	OJTQSCSMDFYAKO-UHFFFAOYSA-N	438.937	1.842	50	20	IDGD	
COc1cccc(C=NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1	915915311	YLCSZTIJWOVLFS-UHFFFAOYSA-N	431.514	1.799	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)NCCNC(=O)c2ccc(Cl)cc2)cc1C	916262403	DVGGEAAOXGNSST-UHFFFAOYSA-N	431.880	1.656	50	20	IDGD	
Cc1ccc(CNC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)c(C)c1	918228316	SUKQEAYLIVYIDW-UHFFFAOYSA-N	432.550	1.461	50	20	IDGD	
O=C(NNC(=O)N1CCN(C(=O)c2ccccn2)CC1)c1ccc(Br)s1	918778585	KWICDFJMLDUSFZ-UHFFFAOYSA-N	438.307	1.718	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)CCc1c(C)nc2c(c(OC)nn2C)c1C	919822380	QALXKXXVWDLUPB-UHFFFAOYSA-N	425.489	1.925	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)N2CCC(C(=O)N3CCN(C)CC3)CC2)c1C	920464969	SKTUOGLZMCFWEX-CJLVFECKSA-N	441.576	1.671	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCC2CC2)cc1S(=O)(=O)N[C@H]1CCCC[C@@H]1C	920859274	UQTVRJWGQIXOKT-BBRMVZONSA-N	438.550	1.906	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)n(-c2ccccn2)n1	920929184	BHYLIKGSKYUULU-UHFFFAOYSA-N	448.531	1.941	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)[C@@H]2CC(=O)N(c3ccccc3)C2)CC1	1116084018	NESKMIBEDGNGNY-MRXNPFEDSA-N	430.505	1.834	50	20	IDGD	
CN(C(=O)OC(C)(C)C)[C@@H](C(=O)NNC(=O)COc1ccc(C#N)cc1)c1cnn(C)c1	1117103003	SLNGEBBVINOTKG-GOSISDBHSA-N	442.476	1.426	50	20	IDGD	
Nc1cnnc(NNC(=O)c2ccc3ncc(I)n3c2)c1Cl	1319303323	PMYCQFQQWSOGAH-UHFFFAOYSA-N	429.609	1.721	50	20	IDGD	
O=C(NNC(=S)NC[C@H]1CCOC1)c1cccc(NC(=S)NC[C@H]2CCOC2)c1	1319380812	MJPNCDFTLTXLSZ-ZIAGYGMSSA-N	437.591	1.155	50	20	IDGD	
CCC(CC)C(=O)N1CCC(NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)CC1	1321846404	YCKQBTFGOUGRDB-UHFFFAOYSA-N	442.520	1.305	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc4n(n3)CCC4)C2)C1	1778671686	NQYLIWCUEFIWSK-KDOFPFPSSA-N	425.327	1.446	50	20	IDGD	
Cn1cc(C(=O)N2CC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)c(C(F)(F)F)n1	1779544666	VAQPOVDDPOLNKO-AWEZNQCLSA-N	429.226	1.686	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccnc(OC)c3)C2)C1	1779562379	LQHNDIHUZOHZTC-KBXCAEBGSA-N	426.311	1.707	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)COCCNC(=O)OC(C)(C)C)C2)C1	1781202265	ZDYGSAJKMSABBG-QRWLVFNGSA-N	447.960	1.375	50	20	IDGD	
C#CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](Cl)CC)C2)C1	1781223287	KSUIHAVLAIXWHF-XFQAVAEZSA-N	441.956	1.750	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(CO)c(F)c3)CCO2)C1	1781234786	ZCLIGTUKUAQDGG-MOPGFXCFSA-N	433.307	1.998	50	20	IDGD	
COC(=O)C1(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)CCBr)C3)CC1	1781808792	PEKVVMUAZPPSIC-CXAGYDPISA-N	431.327	1.239	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Cl)C2)[C@@H]1C[C@@]12C(=O)Nc1ccccc12	1782005316	XKXNRKDUPSYWBQ-BSFXZMFCSA-N	449.910	1.945	50	20	IDGD	
O=C1CCc2ccc(C(=O)N3CC[C@]4(C3)CN(C(=O)[C@H](F)Br)CCO4)cc21	1782313335	VBLVKRHIJZKPRE-LPHOPBHVSA-N	439.281	1.950	50	20	IDGD	
C[C@H](Cc1ccncc1)C(=O)N1CC[C@]2(CN(C(=O)[C@@H](F)Br)CCO2)C1	1782661091	OUZUGIHINGLJAU-DDUZABMNSA-N	428.302	1.781	50	20	IDGD	
CC[C@H](O)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](Br)Cc3ccccc3)C2)C1	1783018809	QHFMOIDDIQRCJH-ABSDTBQOSA-N	439.350	1.593	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc4c(cnn4C)c3)CCO2)C1	1783534691	YBUQKVQWNQSZCP-DJJJIMSYSA-N	435.322	1.800	50	20	IDGD	
CC(=O)Nc1ccc(Cl)c(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)c1	1785270629	PFQBIXRTHXJQTK-QFBILLFUSA-N	444.315	1.342	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)C[C@@H]21)[C@@H](F)Cl	1787447130	NHHATWYJUYNFFB-WIRVQXDCSA-N	436.871	1.293	50	20	IDGD	
C[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(C)(C)CCl)C[C@@H]21)[C@H]1SC(=N)NC1=O	1787493368	UFJYGGKOWCHCJI-IKOXMDCHSA-N	444.985	1.034	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)c1c(Cl)ccc2c1OCO2	1787921540	ZNHPTUYSGBALHE-UHXUCMFUSA-N	445.299	1.262	50	20	IDGD	
Cc1nc[nH]c1C(=O)Nc1ccc(C2(NC(=O)c3cnccc3C(=O)NN)CCC2)cc1	1788773360	ZMVFDNVUXMRYGJ-UHFFFAOYSA-N	433.472	1.778	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cn4[nH]cnc(=O)c4c3C)[C@H]2C1	1789172737	LXHDADDGEWXKFB-HJWJTTGWSA-N	449.939	1.332	50	20	IDGD	
Cn1nc2c(c1C(=O)N1CC[C@H]3CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]3C1)CCC2	1789872325	SBYDYQGDGKYZPD-VOOFSGFHSA-N	443.375	1.738	50	20	IDGD	
N=C1NCCN1CC(=O)NC1(c2ccc(NC(=O)[C@@H](F)Br)cc2)CCC1	1790534829	RXTKPROOJVVSLY-CQSZACIVSA-N	426.290	1.651	50	20	IDGD	
C[C@H](Nc1nccs1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)CBr	1792867560	CSNRZTUXUMVMPE-YHQUGGNUSA-N	445.383	1.564	50	20	IDGD	
CC(C)N(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Cl)C(=O)OC(C)(C)C	1796361848	WAXQOGCMEAQKIC-XRGAULLZSA-N	435.924	1.756	50	20	IDGD	
CCOC(=O)c1ncn2cc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)[C@H](O)CCl)C4)ccc12	1796374583	WGEOGKMAHKBRIE-JYYAWHABSA-N	448.907	1.363	50	20	IDGD	
CC(C)=NO[C@@H](C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C(C)=N/NC(=O)c1ccc[nH]1	1796892652	BQKMEEQBFZIFQV-AECQCBAMSA-N	430.509	1.560	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)N1C[C@H]2C[C@H]2C1	1797638911	YBBDTBREBOUBND-ZXPKRNLXSA-N	428.371	1.090	50	20	IDGD	
CC(C)(C)n1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Br)n1	1799346763	AAOKLGIHGGEUCC-XCCSTKFXSA-N	431.306	1.532	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1cc2ncccc2[nH]1	1799895989	LMRAZZALRNTJLE-ANGCBRKESA-N	425.258	1.457	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](F)Br)c1nc2ccc(F)cn2n1	1800161236	AATAYMJOQDJAJX-NOHGZBONSA-N	428.237	1.811	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(F)c(C)n1)C2	1800639111	IGSXEAOIVQHVQE-ZWUHOBOKSA-N	428.302	1.906	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1cc(F)cc(F)c1F	1801769451	XRLIOTIXMXVZHI-QYOFDKIESA-N	439.203	1.998	50	20	IDGD	
O=C([C@H](O)CCl)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CC[C@H](C(F)(F)F)CC1	1801993127	KQGINKDFVKYPQM-QAUDVVSPSA-N	426.863	1.544	50	20	IDGD	
COc1cccnc1CCC(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1	1804453366	ICXIFBREYAXUQR-CDXJDZJCSA-N	446.935	1.724	50	20	IDGD	
Cc1nc(CC(=O)NC[C@@H]2CCN(C(=O)[C@@H](F)Br)[C@@H]2c2cccnc2)no1	1804493221	OJARGBRJSCGQCX-APHBMKBZSA-N	440.273	1.712	50	20	IDGD	
Cn1nncc1C(=O)NC[C@@H]1CCN(C(=O)[C@@](C)(Cl)CCl)[C@H]1c1cccnc1	1804750645	XSJUWDSYQRHJLT-YEWWUXTCSA-N	425.320	1.766	50	20	IDGD	
COc1cnc(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)c(F)c1	1805078775	VMLUNSCVQWPAAW-OWQGQXMQSA-N	436.871	1.544	50	20	IDGD	
COc1ccc([N+](=O)[O-])c(C(=O)N2CCC3(CCCN(C(=O)[C@@H](O)CCl)C3)CC2)n1	1805523550	QAILLGOOCIXHMD-AWEZNQCLSA-N	440.884	1.443	50	20	IDGD	
COC(=O)CSCC(=O)N1CCCC2(CCN(C(=O)CO[Si](C)(C)C)CC2)C1	1806034104	GHIFGEAFYWHESY-UHFFFAOYSA-N	430.643	1.975	50	20	IDGD	
Cc1ccc(C(=O)N2CCCC3(CCN(C(=O)c4ccc(B(O)O)cc4)CC3)C2)s1	1808085340	OXPVXXLUQOBMQU-UHFFFAOYSA-N	426.347	1.895	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)c3cc(O)ccc3F)CC2)C1	1809980843	XSOYPUBOZPVPRG-UHFFFAOYSA-N	440.280	1.370	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC2(CCCN(C(=O)c3nccc4occc34)C2)CC1	1810311413	SYSJGZVAICBUAL-UHFFFAOYSA-N	447.300	1.666	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H](CNC(=O)CO[Si](C)(C)C)[C@@H]1c1cccnc1)n1cncn1	1810548577	RATYSWYIPQMUBI-SUMDDJOVSA-N	430.585	1.792	50	20	IDGD	
CC(=O)NCCC(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)Br)[C@H]1c1cccnc1	1812663377	JZIPOVINJFDEFA-PVUWLOKVSA-N	425.327	1.397	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](OC(C)=O)C(C)C)[C@H]1c1cccnc1	1813030872	GUVRACFYCSVNHS-VJANTYMQSA-N	439.940	1.929	50	20	IDGD	
O=C(O)CSCC(=O)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@@H]1c1cccnc1	1813086211	LFFHCVMXCUXBPE-GLQYFDAESA-N	448.314	1.596	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)Cc2ccc(O)cn2)[C@@H]1c1cccnc1	1813500370	ZRSKGGPKSYKXLW-QSFXBCCZSA-N	432.908	1.685	50	20	IDGD	
Cc1cc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)c(C)o1	1816414911	NMPMLSONJKOVDO-IBGZPJMESA-N	436.277	1.919	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](C)CN)n[nH]1	1817223738	OJQOCVVSKWNMBG-NGLVEMMDSA-N	428.497	1.131	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)CCc2cccnc2)[nH]n1)c1ccc(B(O)O)cc1	1817471694	WXBRHAQZOZNKJR-FQEVSTJZSA-N	447.304	1.423	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)cnc1C	1817474140	NLVWWEJEWNKQMF-FQEVSTJZSA-N	447.304	1.721	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)/C=N/N3CCCCC3)sc2C1	1819780829	INWDJCWYFURTMB-CAVOBDPNSA-N	427.958	1.781	50	20	IDGD	
C[C@@H]1CCC[C@H]1C(=O)N[C@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1	1819796977	KMIJOTFQFLKULC-FRRDWIJNSA-N	442.545	1.804	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(C(=O)O)ncn2)[nH]n1	1822367834	SUDPLWOHACJHTC-IINYFYTJSA-N	436.856	1.458	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1	1822416811	QGIDUIYYLKYYBW-DGCLKSJQSA-N	443.346	1.558	50	20	IDGD	
CC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CN1C(=O)CSC1=S)CC2	1822857485	IMNNLBSOPYXBGJ-DTWKUNHWSA-N	447.007	1.933	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)c2nccs2)CC1	1826110773	MSFXMJAYMMPQNT-GOSISDBHSA-N	427.335	1.370	50	20	IDGD	
C[C@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)CCn3cncn3)sc2C1	1826611220	QMUMHNQRFJPHJX-UWVGGRQHSA-N	427.328	1.520	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)NNc1ccccc1)CCO2	1829809459	WCANCMSNEXFJEN-MDKPJZGXSA-N	438.956	1.465	50	20	IDGD	
COC(=O)C12CC(C(=O)N3CCOC[C@]4(CN(C(=O)C(C)(C)CCl)CCO4)C3)(C1)C2	1830365896	JJYHYJJEKFRGBC-CBNMVNINSA-N	442.940	1.051	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccccn3)C2)C1	1830537513	JPSYDVXIMVZSMU-KSSFIOAISA-N	426.311	1.183	50	20	IDGD	
O=C([C@H](O)CCl)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CCC[C@H]4CCCC[C@H]43)C2)C1	1830732071	UFGQTDMCIIKGCT-UGVAJALESA-N	442.984	1.649	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H](O)c2ccco2)CC1	1831869689	LWWDWUCEAZNXNK-UWJYYQICSA-N	434.537	1.306	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccc(C)c(C)c3)CCO2)C1	1832405779	UZDKHNFCIOFHDY-KNQAVFIVSA-N	438.952	1.556	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)c3ccco3)CC2)CC1	1833089763	JPZFGTQLUBDFGL-AEFFLSMTSA-N	427.929	1.138	50	20	IDGD	
C[C@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)C3(C)COC3)CC2)CC1	1833261343	QRXCGPWWWGOYAS-CQSZACIVSA-N	430.387	1.626	50	20	IDGD	
CCc1ncsc1C(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)CCl)CC2)CC1	1833313791	QZZLSTVDXKCPRG-INIZCTEOSA-N	428.986	1.490	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)Cc3c(C)noc3C)CC2)CC1	1833730364	RTWGLPIXEIDBBN-IBGZPJMESA-N	440.972	1.659	50	20	IDGD	
Cc1ccn(CC(=O)NC2CCN(C3CCN(C(=O)CCBr)CC3)CC2)n1	1833856778	ATHWYNVJQAVDIP-UHFFFAOYSA-N	440.386	1.548	50	20	IDGD	
CC[C@H](C)[C@@H](N)C(=O)NC1CCN(C2CCN(C(=O)[C@H](C)CBr)CC2)CC1	1834681738	GKPKHBYIWLHDIR-HDMKZQKVSA-N	445.446	1.962	50	20	IDGD	
C=C(C)CC(C)(C)C(=O)NC1CCN(C2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1	1835816589	SJUCZKGYWBNNLC-UHFFFAOYSA-N	449.640	1.923	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3ccnc(OC)c3)CC2)CC1	1835933445	UXDXURUBLDNCHC-GOSISDBHSA-N	438.956	1.529	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnccc3F)CCO2)C1	1836319787	ZHDSLAPAJZFCJZ-YVEFUNNKSA-N	430.274	1.074	50	20	IDGD	
O=C(c1ccc(O)cc1F)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836718099	QUULYFZCFATQRO-GOSISDBHSA-N	428.888	1.743	50	20	IDGD	
O=C(c1c(F)cncc1F)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836718663	YPGCMUJMHFDPCZ-INIZCTEOSA-N	431.867	1.572	50	20	IDGD	
O=C(c1ccc2ccnn2c1)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836718744	CDGMBRYTTOWULZ-LJQANCHMSA-N	434.924	1.546	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cc(C)n(C)n3)CC2)CC1	1837455003	TVDRRZAYZDNRGE-QGZVFWFLSA-N	426.945	1.595	50	20	IDGD	
CC(C)(C)OC(=O)CC(=O)N1CCOC[C@@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1837710291	SVQIMUCYXUGTFT-FQEVSTJZSA-N	444.601	1.026	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(F)cc(F)c3)C2)C1	1837714787	NOXHNHVKSCTMJS-FQEVSTJZSA-N	442.535	1.886	50	20	IDGD	
CCc1noc(C)c1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1838058600	NGGBCNRWHRKJPA-PBHICJAKSA-N	448.289	1.306	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3ccc(OC)nn3)CC2)CC1	1838512466	FAVQMARFQGVVNC-INIZCTEOSA-N	440.928	1.351	50	20	IDGD	
CCSc1cccnc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1838847257	TXXRYGRKVYJBKK-CRAIPNDOSA-N	431.917	1.798	50	20	IDGD	
Cc1nnsc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2	1839152541	CLSVCQISGIZPKV-JKSUJKDBSA-N	437.349	1.153	50	20	IDGD	
Cc1cc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)no1	1839155116	JNZQOTOJHMDOSJ-ROUUACIJSA-N	434.320	1.218	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3CCCSC3)C2)C1	1839156378	NUEHOAJOXBFYOE-WBAXXEDZSA-N	439.405	1.822	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(C)c4n[nH]cc4c3)CCO2)C1	1839511307	QYQCRVBSGOTPQV-UWJYYQICSA-N	434.924	1.959	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3ccc(F)cc3)C2)C1	1840155502	DMYVKUIPBXHLNX-WIYYLYMNSA-N	442.915	1.469	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cccc(F)c3F)C2)C1	1840156162	OOMJFWAAZYJJEU-YWZLYKJASA-N	446.878	1.218	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)C3=COCCC3)CCO2)C1	1840213944	CJHHOZXCGPKTNZ-KBXCAEBGSA-N	431.327	1.168	50	20	IDGD	
O=C(C1CC2(CCC2)C1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1840604396	DPBWIJINAVEIQY-RDTXWAMCSA-N	433.318	1.714	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)N2CC3(CCCN3C(=O)[C@H](O)CCl)C2)CC1	1841354615	KSNIWHLYXPCHHO-OAHLLOKOSA-N	429.945	1.437	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](CC(=O)N2CCCC23CN(C(=O)[C@H](O)CCl)C3)C1	1841412825	MRPZEXBMAMHEEF-JKSUJKDBSA-N	443.972	1.827	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C1	1841925432	UREWPXSQKABALN-STQMWFEESA-N	438.352	1.576	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)/C=C\c2c[nH]c3ccccc23)C1	1841972514	ZOHPVICINPNKBG-SREVYHEPSA-N	444.495	1.697	50	20	IDGD	
O=C(c1ccc2occ(Cl)c2c1)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843014482	OXRKEDOMPGETJP-UHFFFAOYSA-N	438.676	1.897	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)c2ccc(CCN3CCCC3)nc2)C1	1843458393	XNJJOWSZEZTEDS-IBGZPJMESA-N	434.968	1.791	50	20	IDGD	
O=C([C@@H](O)CCl)N1CC2(CCCN2C(=O)c2cn3cc(C(F)(F)F)ccc3n2)C1	1844060774	MBRYPLCPYJSMPA-ZDUSSCGKSA-N	430.814	1.770	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)Cc1c(F)cccc1Cl)C2	1844263256	KPCNFTZQQBCDFT-UHFFFAOYSA-N	445.882	1.537	50	20	IDGD	
C[C@@H](C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cnccc1C(=O)NN)c1ccc(Cl)cc1	1847408749	ZIWFFLXQPURWIT-VMDGZTHMSA-N	441.919	1.958	50	20	IDGD	
COc1ccnc(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](C)CBr)c1OC	1847500054	ANSHIXMTLNFZMU-AGIUHOORSA-N	426.311	1.945	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](C)NS(=O)(=O)c1ccc(C)cc1	1847583504	ZWTAHISMIJNICW-DKIMLUQUSA-N	441.981	1.881	50	20	IDGD	
O=C(NNC(=O)c1n[nH]c(=O)c2ccccc12)c1ccc(Cl)c(N2CCCC2=O)c1	14854920	OWYNBGRPFQQLSF-UHFFFAOYSA-N	425.832	1.778	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)COc2ccccc2Cl)cc1	15902189	JQBXUTDZQXNEJF-UHFFFAOYSA-N	425.894	1.495	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cccc(OC[C@@H]3CCCO3)c2)c1	26228279	JOLNWIIJETTYFW-SFHVURJKSA-N	447.513	1.570	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@@H](C)C(=O)NNC(=O)c1cc(S(N)(=O)=O)cn1C	27202915	SDNOMFKIYOYMGV-NSHDSACASA-N	428.898	1.171	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1F	726437464	HEDBQGOHKCEIPT-UHFFFAOYSA-N	426.495	1.716	50	20	IDGD	
C#Cc1cccc(NC(=S)NNC(=O)CCc2c(C)nc(N3CCOCC3)nc2O)c1	727501683	ZHCBTLZZOPRYBT-UHFFFAOYSA-N	440.529	1.259	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)NCc2cccc(C(=O)NCCN(C)C)c2)c1	727604126	PPVCJASAVXJHOZ-UHFFFAOYSA-N	441.532	1.504	50	20	IDGD	
CCOC(=O)c1cc(S(=O)(=O)NNC(=O)c2nnc(-c3ccccc3)o2)ccc1F	728505884	SUHNODIXFDDAOL-UHFFFAOYSA-N	434.405	1.676	50	20	IDGD	
CC(C)COC(=O)N1CCC(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)CC1	728844662	AACXIXWSMADZPO-UHFFFAOYSA-N	432.525	1.345	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)N2CCC[C@H](CN3CCN(c4ccccn4)CC3)C2)c1	728954533	ZZSLFTCHLWIYOO-HXUWFJFHSA-N	447.543	1.842	50	20	IDGD	
COc1cc(CCC(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc(OC)c1	729994153	IIZVUOBRXUPTMC-IBGZPJMESA-N	444.440	1.167	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@H]2C(=O)NNC(=O)CCc2ccccc2O)c(OC)c1	730034102	RZHOMYKUEIHPMX-SFHVURJKSA-N	441.484	1.794	50	20	IDGD	
O=C(Cc1cc[nH]n1)NNC(=O)c1ccc(Cl)c(S(=O)(=O)N2CCCCCC2)c1	730092604	MEIZEOIYTNIAHI-UHFFFAOYSA-N	439.925	1.632	50	20	IDGD	
CCCCN1C(=O)CC[C@@H](C(=O)NNC(=O)Cc2cc[nH]n2)[C@@H]1c1ccc(OC)cc1	730102457	DYBZSJRVLKQDOF-NQIIRXRSSA-N	427.505	1.888	50	20	IDGD	
C[C@]1(NNC(=O)NCC2CCN(Cc3ccccc3Cl)CC2)CCS(=O)(=O)C1	730134334	YKPPGAJFRCIEKU-IBGZPJMESA-N	428.986	1.933	50	20	IDGD	
CCCCN(C)CCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	732892208	VVXHOSWUEUCTNW-UHFFFAOYSA-N	439.582	1.537	50	20	IDGD	
COc1cccc(/C=C(/C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)n2nnnc2C)c1	733110459	MMDSUTHZWKAZCZ-NDENLUEZSA-N	444.455	1.635	50	20	IDGD	
C[C@H](NS(=O)(=O)c1ccc(Cl)cc1)C(=O)NNc1nc2ccccc2c(=O)n1C	733261588	GRTAUGZFUKTSGM-NSHDSACASA-N	435.893	1.397	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)NCCC(=O)NNc2ccc(F)c(F)c2F)cc1	733360534	LKUUQODLHBQBIQ-UHFFFAOYSA-N	430.408	1.874	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1C(=O)N(C)C	734415760	HTDVQIXTKFRIJL-UHFFFAOYSA-N	443.485	1.206	50	20	IDGD	
COc1ccc(S(=O)(=O)C[C@@H](C)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1	734990407	IXSGVYAECKMNDV-ACJLOTCBSA-N	434.470	1.092	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)c2cccc3c2O[C@@H](C)C(=O)N3)cc1C	736816794	DCPMWCWPWWOMAE-NSHDSACASA-N	431.470	1.956	50	20	IDGD	
COCCS(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=O)Cc2cccnc2)c1Cl	740784976	YUZVJIIBPZRDAC-UHFFFAOYSA-N	446.312	1.812	50	20	IDGD	
CCc1cccc(C)c1NC(=S)NNC(=O)CN1CCN(C(=O)OC(C)(C)C)CC1=O	741298472	DORJPYWUOINQOW-UHFFFAOYSA-N	449.577	1.954	50	20	IDGD	
CCN1CCC[C@@H]1CN1C[C@H](C(=O)NNC(=O)c2cccc(Br)c2)CC1=O	742773252	RTFHMOXYGCUWFM-GDBMZVCRSA-N	437.338	1.543	50	20	IDGD	
Cc1ccc(S(=O)(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)cc1Br	743268621	BBCYRILWNMIESZ-UHFFFAOYSA-N	430.236	1.995	50	20	IDGD	
CN(C)[C@H](CNC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)C1CCCCC1	743613640	HXJNTPGQDXBZOX-QGZVFWFLSA-N	425.555	1.936	50	20	IDGD	
CC1CCC(NS(=O)(=O)CC(=O)NNC(=O)c2cc(Br)ccc2O)CC1	743729779	HVDATPNDNLPMTH-UHFFFAOYSA-N	448.339	1.414	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)N[C@H]1C[C@H](C)N(c2ccccc2)C1=O	745881404	IVQOMPHAHGMRKJ-RDJZCZTQSA-N	426.473	1.989	50	20	IDGD	
CC(C)(C)OC(=O)NC1(C(=O)NNC(=O)COc2ccccc2O)Cc2ccccc2C1	746235376	VQBHNSIRVVVCQK-UHFFFAOYSA-N	441.484	1.981	50	20	IDGD	
CC[C@@](C)(CNC(=O)OC(C)(C)C)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	747868431	ZIIJRAYTEXEGEI-NRFANRHFSA-N	434.541	1.781	50	20	IDGD	
N#CCCCS(=O)(=O)c1ccc(C(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1	748163085	ZLMOFDLGEZZGII-GOSISDBHSA-N	429.454	1.365	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)CNC(=O)NCc2ccc([N+](=O)[O-])cc2)cc1	748360859	VCSRVXYYDOPWJT-UHFFFAOYSA-N	429.433	1.183	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)[C@@H]2CCCN2C(=O)c2ccc3c(c2)OCO3)nc2ccccc21	749559674	CNZBPKGKLKYSFZ-KRWDZBQOSA-N	449.467	1.297	50	20	IDGD	
O=C(CCOc1ccccc1)NNC(=O)NCCNC(=O)c1cccc(Br)c1	749931062	IZFPQDFWUOORRY-UHFFFAOYSA-N	449.305	1.978	50	20	IDGD	
CN(CC(=O)NNc1nc(Br)cn2ccnc12)S(=O)(=O)c1ccccc1	750243983	SERYAIPNLXCJPM-UHFFFAOYSA-N	439.295	1.256	50	20	IDGD	
O=C(NCc1c(F)cccc1OC(F)F)NNC(=O)C1CCN(c2ncccn2)CC1	752006591	KWXQEBXMVCFQAA-UHFFFAOYSA-N	438.410	1.964	50	20	IDGD	
COC(=O)c1c(Br)ccc(NC(=O)C(=O)NNC(=O)c2ccncc2)c1C	753838912	DIWAEWIOUZDBMV-UHFFFAOYSA-N	435.234	1.339	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN(C(=O)NC2CCCC2)C1)c1nn(-c2ccccc2)cc1O	754418634	WOVKHRYWAITHLX-OAHLLOKOSA-N	440.504	1.703	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCCCC2)cc1NC(=O)NNC(=O)c1c[nH]nc1C	755413632	XOEWZEIMXWTFGU-UHFFFAOYSA-N	436.494	1.368	50	20	IDGD	
CCCc1nnc(NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)s1	755474106	XIHQQZQHFSJELC-UHFFFAOYSA-N	426.524	1.272	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)Nc2ccc(S(=O)(=O)NC3=NCCCCC3)cc2)cn1	755501468	UQRHSHKKIQRVNG-UHFFFAOYSA-N	433.494	1.137	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)NC1CCN(S(=O)(=O)C(C)(C)C)CC1	755926094	PTQLFKXBVABVJD-UHFFFAOYSA-N	440.566	1.551	50	20	IDGD	
COCCOC(=O)Nc1cccc(NC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1	756221859	SOGPFBLUGJIMMY-QGZVFWFLSA-N	430.417	1.874	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)[C@H](C)Oc2ccccc2F)cc1-n1nnnc1C	756321308	SLLRBFLXTGOHPV-NSHDSACASA-N	429.412	1.739	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)Nc1cnn(CC(=O)NC2CCCC2)c1	756794271	BLVZGIRYUZITMP-UHFFFAOYSA-N	445.436	1.082	50	20	IDGD	
NC(=O)c1ccc(NNC(=O)[C@@H](Cc2ccccc2)NC(=O)OCc2ccccc2)nn1	757393524	ZOBDUJJOKWFRRA-GOSISDBHSA-N	434.456	1.556	50	20	IDGD	
O=C(NN=c1cc[nH]cc1Cl)C1CCN(S(=O)(=O)c2cccnc2Cl)CC1	757405173	HNCSQBAEUCQUHQ-UHFFFAOYSA-N	430.317	1.749	50	20	IDGD	
CN(c1ccccc1NC(=O)NNC(=O)c1nnc(O)c2ccccc12)S(C)(=O)=O	757661866	ULPLPSUWIVJHSX-UHFFFAOYSA-N	430.446	1.198	50	20	IDGD	
O=C(NCc1ccco1)NNS(=O)(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	760342786	PFKTWPNGWCAODA-UHFFFAOYSA-N	442.519	1.147	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)c1cc(I)ccc1F	762169829	YLHWCEVGIQCOGG-UHFFFAOYSA-N	447.229	1.683	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)c1sccc1S(=O)(=O)N(C)C	762409743	RNJYYPCRRBKSMQ-UHFFFAOYSA-N	429.545	1.560	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)Nc1ccc(CN2C(=O)CNC2=O)cc1	763479272	QPZFTYLUXIBCPP-UHFFFAOYSA-N	429.458	1.389	50	20	IDGD	
CO[C@@H]1Cc2ccc(NC(=O)C(=O)NNC(=O)c3ccccc3Br)cc2C1	763483578	ROPBFVAUGQBKNA-CQSZACIVSA-N	432.274	1.962	50	20	IDGD	
CSc1nnnn1-c1cccc(NC(=O)C(=O)NNC(=O)c2c[nH]c3ccccc23)c1	763535534	HGDHABDARDWVDI-UHFFFAOYSA-N	436.457	1.265	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)C(=O)Nc2cc(C)nn2C)cc(OCC)c1OCC	763544586	ZQUBZMJUSJFBIS-UHFFFAOYSA-N	433.465	1.324	50	20	IDGD	
Cc1ccn(-c2ccccc2NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)n1	763605614	VVLSYSKVVPEILU-UHFFFAOYSA-N	429.440	1.971	50	20	IDGD	
COC(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)c1	763674775	PQYZJUQJOMOEKP-UHFFFAOYSA-N	430.804	1.163	50	20	IDGD	
Cn1c(=O)n(C)c2cc(NC(=O)C(=O)NNC(=O)C34CC5CC(CC(C5)C3)C4)ccc21	763733805	GWURLZKIWKZIFY-UHFFFAOYSA-N	425.489	1.179	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2ccnn2CCC(C)C)c2ccccc2c1=O	763785697	LEYHXNDBKMFYLD-UHFFFAOYSA-N	439.476	1.059	50	20	IDGD	
O=C(NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)C(=O)Nc1ccccc1F	763796433	DNCKOGQFYQOCEV-UHFFFAOYSA-N	434.449	1.010	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CNC(=O)c2cccnc2)cc(OC)c1Br	763819565	DBLBHVCIHZBQFG-UHFFFAOYSA-N	437.250	1.052	50	20	IDGD	
CN(C)C(=O)c1cc(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)ccc1Cl	763842728	JZEJPLNPYKRLHQ-UHFFFAOYSA-N	436.827	1.346	50	20	IDGD	
Cc1cc(S(C)(=O)=O)ccc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1cccc(C)c1C	763849737	MODDQMZZOALIOI-OAHLLOKOSA-N	447.513	1.569	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)C(=O)Nc1ccc(F)nc1	763883503	PNURFFYEKOOOPG-SECBINFHSA-N	425.214	1.537	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)c2cnccn2)sc2c1CC[C@@H](C)C2	764033390	XGTKVUHYNWMUIR-SNVBAGLBSA-N	431.474	1.239	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2cccc(C(F)(F)F)c2)cccc1-n1cnnn1	764040872	PDGYNFDYUSNYOM-UHFFFAOYSA-N	433.350	1.389	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(NC(=O)C3CC3)cc2C(F)(F)F)n[nH]1	764100289	ZKGCMGAZVWMYEL-UHFFFAOYSA-N	438.366	1.485	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)nc1)C(=O)Nc1ccc(CCN2CCOCC2)cc1	764102450	ZMIRQJKAUZQDTR-UHFFFAOYSA-N	431.880	1.009	50	20	IDGD	
Cc1cn(-c2ccc(C#N)cn2)nc1NC(=O)C(=O)NNC(=O)c1ccc(Cl)cc1O	764125390	WSAWGWJRXVWXMA-UHFFFAOYSA-N	439.819	1.206	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cccc(OC(F)F)c2)cc1F	764250178	KYCDGKPUYOOXRN-UHFFFAOYSA-N	425.319	1.613	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)C(=O)N1CCc2c(Cl)cccc21	764259758	JAMADFLKWDPALT-UHFFFAOYSA-N	428.880	1.083	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1cccc(OCc2cccnc2)c1	764278467	ZAMFHNCFVIKCKC-UHFFFAOYSA-N	436.424	1.531	50	20	IDGD	
O=C(Cc1cc[nH]n1)NNC(=O)C(=O)Nc1ccc(Oc2cccc(C(F)(F)F)n2)cc1	764292473	BFTSHVDZOKXERI-UHFFFAOYSA-N	448.361	1.944	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)C(=O)Nc1ccc(OC[C@@H]2CCCO2)cc1	764342575	GDEZLDPZOLPFPQ-FQEVSTJZSA-N	449.467	1.830	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)C(=O)Nc1cccn(Cc2ccccc2)c1=O	764367883	PRVWMMJVHRKKCT-UHFFFAOYSA-N	434.452	1.199	50	20	IDGD	
CCNS(=O)(=O)c1ccc(CNC(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)cc1	764371916	ATCSHLIPOOXVRT-MRXNPFEDSA-N	448.545	1.900	50	20	IDGD	
COC(=O)c1c(NC(=O)C(=O)NNC(=O)c2ncccc2C)sc2c1CCCCC2	764385799	KAAHUDFAAPXBMZ-UHFFFAOYSA-N	430.486	1.907	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)CCC(=O)N2CCN(c3ccccc3)CC2)cc1	764523022	JJTJAWFCSCSDQV-UHFFFAOYSA-N	435.484	1.213	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)c1ccc(CN2CCC(CO)CC2)cc1	764589122	ORTSKBLCEJKAHC-NRFANRHFSA-N	425.485	1.492	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NN=C3CCOc4ccccc43)CC2)cc1	764818141	RPCFJXZOVIZLPZ-UHFFFAOYSA-N	442.541	1.604	50	20	IDGD	
Cc1cccc(-c2nnc(S)n2CC(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)c1	765322991	NBGCXJJMRCJZQD-UHFFFAOYSA-N	448.549	1.995	50	20	IDGD	
C[C@H](CC(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1)c1ccccc1F	765735023	GSTNLXMPMGFLDT-QGZVFWFLSA-N	426.492	1.925	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765736959	CMIIWHYTGQVHOR-MRXNPFEDSA-N	428.464	1.198	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3c(C(F)(F)F)n[nH]c3C)CC2)cc1	766642409	HLIUTQQWHPCKQA-UHFFFAOYSA-N	438.454	1.624	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)[C@@H]2C[C@@H]2c2cc(F)c(F)c(F)c2)n1	766781343	OKNBRRPQDHGXEJ-GHMZBOCLSA-N	427.404	1.906	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNc3ccc([N+](=O)[O-])cc3)CC2)cc1	768248622	SWPWFGMIEVTKAB-UHFFFAOYSA-N	433.490	1.353	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)c3ccnnc3)c2)cc1	769469010	LIAXOWGBSOGBOJ-UHFFFAOYSA-N	427.442	1.361	50	20	IDGD	
CCc1nn(C)cc1C=NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	770593328	ZVPBAGRHMIELFK-UHFFFAOYSA-N	433.534	1.086	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)c1cn([C@@H]2CCS(=O)(=O)C2)nc1C(C)C	772160815	FPOBVGMSOBOPEK-ZIAGYGMSSA-N	442.538	1.105	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)c2nnn(-c3cccc4cnccc34)c2C)c1	773073333	SOCCQKGUBDCEID-UHFFFAOYSA-N	430.428	1.552	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)c1ccc(S(N)(=O)=O)c(Cl)c1	773170321	DJECSFQDQMNFAX-VIFPVBQESA-N	432.285	1.869	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2cc(F)c(OC)cc2C)c2ccccc2c1=O	773494079	NNKVMUUPGOQFST-UHFFFAOYSA-N	441.419	1.272	50	20	IDGD	
Cc1ccc(-n2nccc2NC(=O)C(=O)NNC(=O)Cc2ccc3ccccc3c2)nn1	773496439	MBSWKXZYRPTJAX-UHFFFAOYSA-N	429.440	1.453	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)c(F)c1	774007258	CPRYFBFSOJGRFN-SNVBAGLBSA-N	437.811	1.819	50	20	IDGD	
Cc1cc(S(N)(=O)=O)ccc1CNC(=O)NNC(=O)[C@H](C)Oc1cccc(Cl)c1	775199526	AKFJPGBLYZRVSP-LBPRGKRZSA-N	440.909	1.594	50	20	IDGD	
CN1CCN(CC(=O)N(C)c2ccc(NC(=O)NNc3cnc4ccccc4n3)cc2)CC1	775600905	MZJBEIUPRAWAAE-UHFFFAOYSA-N	448.531	1.989	50	20	IDGD	
O=C(CN1CCCc2ccccc21)NNC(=O)C(=O)Nc1cc2c(cc1F)NC(=O)CC2	778706887	GTQGJLIMQVBZEN-UHFFFAOYSA-N	439.447	1.249	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2Br)cn1C	778759946	UJNYVTMVLCOPTO-UHFFFAOYSA-N	440.210	1.564	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)c1ccc(C)cc1)C(=O)NNc1cc(Cl)nc(N)n1	779373549	QDSLCULBRKIFMV-LBPRGKRZSA-N	444.970	1.564	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)NNC(=O)c2cccc(C#N)c2)cc1Br	780388300	YJMHNZMSHVAAOE-UHFFFAOYSA-N	437.275	1.902	50	20	IDGD	
COC(=O)c1scc(C)c1NC(=O)C(=O)NNC(=O)c1cc(-c2ccc(C)cc2)[nH]n1	782116651	DQMPWXLNRKBYRQ-UHFFFAOYSA-N	441.469	1.941	50	20	IDGD	
COC(=O)c1csc(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)c1C	782887336	SZMAFILOJQJPRK-UHFFFAOYSA-N	429.458	1.058	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2cccc(CSC3CCOCC3)c2)CCS(=O)(=O)C1	783426124	FWKRGHQOOBFAQJ-IBGZPJMESA-N	441.575	1.235	50	20	IDGD	
CCOC(=O)c1cc(F)c(F)cc1NC(=O)C(=O)NNc1ccc(-n2cccn2)nn1	783435915	BZFWCMXQGLTQIY-UHFFFAOYSA-N	431.359	1.199	50	20	IDGD	
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)NNC(=O)c1ccc2ccccc2n1	783800669	TVCZOSRGQUYYGL-UHFFFAOYSA-N	430.398	1.553	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2ccccc2S(=O)(=O)N(C)C2CCCCC2)ncn1	783939917	NFGGYWGMSYQTLH-UHFFFAOYSA-N	446.533	1.820	50	20	IDGD	
COc1ccc(I)c(NC(=O)C(=O)NNc2ccc(C)nn2)c1	783948056	QJFKSAQNFMXVSK-UHFFFAOYSA-N	427.202	1.480	50	20	IDGD	
N#Cc1ccc(Oc2cccc(NC(=O)C(=O)NNC(=O)CNC(=O)c3ccco3)c2)cc1	784002178	LMXDQHUIAXUVIA-UHFFFAOYSA-N	447.407	1.459	50	20	IDGD	
Cc1ccnc(-c2cccc(NC(=O)C(=O)NNC(=O)Cc3cn4ccccc4n3)c2)n1	785059800	ASYVNAVGGBOKME-UHFFFAOYSA-N	429.440	1.428	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)cc1Cl	785066689	GGTWUVSDUWDBJD-UHFFFAOYSA-N	445.863	1.342	50	20	IDGD	
COC(=O)CNC(=O)Cc1ccc(NC(=O)C(=O)NNc2cc(F)c(F)c(F)c2)cc1	785083665	YBDFMGQLIBTZKQ-UHFFFAOYSA-N	438.362	1.017	50	20	IDGD	
CNC(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3cc(C)ccc3C)[nH]n2)cc1	785125630	FDDPIOJXYRFWDA-UHFFFAOYSA-N	448.483	1.382	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1ccc(SC(F)F)nc1	785330458	HUJFATGIVQQBDL-UHFFFAOYSA-N	446.457	1.890	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)CCCc2ccc(O)c(F)c2)cc1	786687882	NVUHFDCCTAZHQJ-UHFFFAOYSA-N	437.493	1.631	50	20	IDGD	
NC(=O)[C@H]1CCC[C@@H](C(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)C1	786723427	OXJURGROJMDDHI-RBUKOAKNSA-N	447.499	1.441	50	20	IDGD	
CCOc1ccccc1[C@@](N)(C(=O)NNC(=O)CNC(=O)c1cccs1)C(F)(F)F	787996307	VMMUZAKAGHOQKX-QGZVFWFLSA-N	444.435	1.441	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(Cl)cc1-n1cccn1	788330720	KQIPAOIKPRWDID-UHFFFAOYSA-N	428.792	1.834	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NN=C3CCC[C@H](N(C)C)C3)CC2)cc1	788434851	KKJRUSVIJHDXOD-IBGZPJMESA-N	435.594	1.278	50	20	IDGD	
CN1C(=O)Cc2cc(NC(=O)C(=O)NNC(=O)c3ccc(COc4ccccc4)o3)ccc21	789732027	OBNJVMOBIQASTP-UHFFFAOYSA-N	448.435	1.777	50	20	IDGD	
COc1cc(NNC(=O)[C@@H](CCC(N)=O)N2C(=O)c3ccccc3C2=O)ccc1Cl	790186793	JIQAPAHTTSVKTB-OAHLLOKOSA-N	430.848	1.722	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)ccc1C(F)(F)F	790952292	QKTKYUKVWPEAEQ-UHFFFAOYSA-N	436.346	1.751	50	20	IDGD	
N#CCC1(O)CN(C(=O)/C(C#N)=C\c2cn(CCC(N)=O)nc2-c2ccc(Cl)cc2)C1	793867205	AAEBASOWVBJLAC-DHDCSXOGSA-N	438.875	1.473	50	20	IDGD	
C[C@H]1CCC(=NNC(=O)C(=O)NN=C2CC[C@@H](C)C[C@@H]2n2cncn2)[C@H](n2cncn2)C1	794453077	IVGFEELHLMMELH-PURYLZLUSA-N	440.512	1.236	50	20	IDGD	
CCOC(=O)c1cc2cc(S(=O)(=O)NNC(=O)C(=O)NC(CC)CC)ccc2s1	794589986	MDBMFOGWHIUTMI-UHFFFAOYSA-N	441.531	1.692	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)Nc1ccc(S(=O)(=O)N(C)C)cn1	797652398	CQXIVODVVBEXHX-UHFFFAOYSA-N	427.870	1.460	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CCC(=O)N2CCc3sccc3C2)cc1C	798310327	QGUMLUNNRKJTMW-UHFFFAOYSA-N	428.514	1.816	50	20	IDGD	
Cn1cc(C2=S=C(C=NNC(=O)c3ccc(S(=O)(=O)N4CCCC4)cc3)C=C2)cn1	800807481	VFKGYSFPJXPUFB-UHFFFAOYSA-N	443.554	1.616	50	20	IDGD	
Cc1c(NC(=O)NNC(=O)c2ccc3c(c2)OCO3)nnn1CCOc1ccc(F)cc1	801822301	GXYGSHZCFLXUJQ-UHFFFAOYSA-N	442.407	2.000	50	20	IDGD	
CNS(=O)(=O)c1csc(C(=O)NNC(=O)Nc2ccc(Br)cc2)c1	801999016	PSKXDUOAJSQCNH-UHFFFAOYSA-N	433.309	1.885	50	20	IDGD	
C[C@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(C(=O)NNC(=O)N=c3cc[nH]cc3)cc2)C1	802031491	GCENDHSCBKIGQH-GASCZTMLSA-N	431.518	1.637	50	20	IDGD	
CCCCC(=O)N1CSC[C@@H]1C(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	802069195	XPIOELGCUAMRIW-CQSZACIVSA-N	428.536	1.335	50	20	IDGD	
Cc1nc(C(F)(F)F)ccc1NC(=O)C(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	802566232	FMKPMXVUDWGIAN-UHFFFAOYSA-N	448.361	1.700	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(NC(=O)CC(F)(F)F)cc2)c(O)c1	802567578	ZJSKEXMPAPTNST-UHFFFAOYSA-N	438.362	1.991	50	20	IDGD	
CNS(=O)(=O)c1cc(NC(=O)NNC(=O)CSc2ccc(C)cc2)ccc1F	806546431	RCNHKBRCGSGCLK-UHFFFAOYSA-N	426.495	1.987	50	20	IDGD	
Cc1ccc([C@H](CNC(=O)NNC(=O)Cc2nc3ccccc3n2C)N2CCOCC2)o1	807023714	SBAJUBNCPOIRAZ-SFHVURJKSA-N	440.504	1.421	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)Nc2ccc(S(=O)(=O)N(C)C)cn2)c1C	808792563	KZVCDBRHBYQQRA-GZTJUZNOSA-N	431.518	1.942	50	20	IDGD	
NC(=O)c1ccc(NC(=O)NNC(=O)c2ccc3c(c2)OCCO3)c(OCC(F)F)c1	810304948	YXLLELHDANMLNG-UHFFFAOYSA-N	436.371	1.667	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cn(C)nc2C2CC2)cc1Br	812979913	GTFCAJLAHNUTBT-UHFFFAOYSA-N	436.266	1.468	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)[C@@H](C)NC(=O)c2cccs2)c2ccccc2c1=O	813300712	KOYGUZFFBVTDAY-GFCCVEGCSA-N	427.486	1.618	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN[C@@H](c2ccccc2)C2(CO)CCC2)cc1OC	814668539	VWMXURVUXRZCLG-NRFANRHFSA-N	427.501	1.958	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NN=C(C)CCCO)N(S(C)(=O)=O)CC2	814759257	WPZALEHWTFVYFL-MRXNPFEDSA-N	427.523	1.217	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(OC)c(C)c(OC)c2)cc1OC	815566875	HWOVHHABNASPPC-UHFFFAOYSA-N	431.445	1.819	50	20	IDGD	
N#Cc1ccccc1Oc1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2CCc3nncn3C2)cc1	815691821	BVYPGUUZCQFZKP-OAHLLOKOSA-N	445.439	1.291	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2CCc3nncn3C2)c(C(F)(F)F)c1	815691869	DCZGVAGCEGLHCX-SNVBAGLBSA-N	440.382	1.044	50	20	IDGD	
CC(C)c1cc(Br)ccc1NC(=O)C(=O)NNC(=O)[C@H]1CCc2nncn2C1	815692185	LNYFSZAPUBVSJB-NSHDSACASA-N	449.309	1.513	50	20	IDGD	
Cc1nc2ccccc2c(=O)n1CC(=O)NNC(=O)[C@H]1CCCN(C(=O)OC(C)(C)C)C1	816510644	BMLQTQSLHAFGSL-HNNXBMFYSA-N	443.504	1.499	50	20	IDGD	
Cc1ccc(-n2cc(C(=O)NNC(=O)[C@@H]3CCCN(C(=O)OC(C)(C)C)C3)nn2)cc1	816510979	LDFDOZGAIALLDB-OAHLLOKOSA-N	428.493	1.984	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)/C=C\c1ccccc1)C(=O)NNc1ncncc1F	817071056	NHUZJDYEAMZBNC-WKTRQSJXSA-N	425.511	1.771	50	20	IDGD	
Cc1cc(C)nc(SCc2ccc(C(=O)NNC(=O)CC[C@H]3NC(=O)NC3=O)cc2)n1	849120464	UMLMMUUEJKFSFB-OAHLLOKOSA-N	442.501	1.135	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)c(C)c2)c(C)c1	880231176	UTSPMQGGQRDKDL-UHFFFAOYSA-N	432.546	1.800	50	20	IDGD	
CCCS(=O)(=O)Nc1cccc(C(=O)OCC(=O)NNC(=O)c2cccs2)c1	900658886	LPEOGVGXCZXPJM-UHFFFAOYSA-N	425.488	1.518	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)NC2CCCC2)c1)c1ccc([N+](=O)[O-])cc1	913471030	DZQCDAFQTYCAII-UHFFFAOYSA-N	432.458	1.891	50	20	IDGD	
COc1ccc(NCC(=O)NN=C2CCN(S(=O)(=O)c3c(C)n[nH]c3C)CC2)cc1	914554444	KHGANIUIQCXUGQ-UHFFFAOYSA-N	434.522	1.404	50	20	IDGD	
C[C@@H]1CN(c2ccc(C(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)cn2)C[C@@H](C)O1	914877314	SAMBWZAPBJGBEF-ZIAGYGMSSA-N	436.472	1.017	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(OC)c(C(=O)NNC(=O)COc2cccc(C)c2)c1	915059607	FVWIKGCYORASDO-UHFFFAOYSA-N	449.529	1.874	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)c2c[nH]nc2-c2ccncc2)cc1	916163877	CJDKNVIWIZKZKK-UHFFFAOYSA-N	434.485	1.967	50	20	IDGD	
Cc1n[nH]cc1CCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	916259464	ITJMLDQZSORNFE-UHFFFAOYSA-N	448.549	1.470	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NCc2cccc(CN3CCCC3)c2)c2ccccc2c1=O	916401327	BMGUVIBRWDNEPW-UHFFFAOYSA-N	434.500	1.674	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NC[C@@H]2CCN(c3ccccc3)C2)c2ccccc2c1=O	916579657	JIPZEACYEYCKLT-INIZCTEOSA-N	434.500	1.887	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c(C(F)(F)F)n1	917361033	ZEPKBWDAGIUDBC-UHFFFAOYSA-N	445.423	1.298	50	20	IDGD	
CO[C@H](C)C(=O)NNC(=O)CN(Cc1ccccc1)S(=O)(=O)c1ccc(Cl)cc1	917688326	PKJZQOGCVAYWLX-CQSZACIVSA-N	439.921	1.713	50	20	IDGD	
O=C1CCCc2cc(S(=O)(=O)NNC(=O)c3cc(Br)c[nH]3)ccc2N1	917734086	XBRSCFVNEJKCJM-UHFFFAOYSA-N	427.280	1.675	50	20	IDGD	
CCS(=O)(=O)N1CCC[C@H](C(=O)NNC(=O)c2ccc(F)cc2Br)C1	918645285	FJKJNYOESOVHPP-JTQLQIEISA-N	436.303	1.411	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)c1cc(S(=O)(=O)Nc2ccccc2F)c[nH]1	919822711	CAHXTAOXBWXVKY-UHFFFAOYSA-N	446.460	1.967	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)CN2C(=O)N[C@@]3(C[C@@H](C)CC(C)(C)C3)C2=O)cc1	919836507	VFHSCJZIRBSWKR-NPMXOYFQSA-N	444.532	1.912	50	20	IDGD	
O=C(NCc1cccc(NC(=O)[C@H]2CCCO2)c1)NNC(=O)c1ccc2c(c1)OCCO2	920238421	WVWYVMZIEJIGTA-GOSISDBHSA-N	440.456	1.720	50	20	IDGD	
CNC(=O)CN(C)C(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccc(OC)c(OC)c1	920430981	NOFFOZHPYWUTRH-YBEGLDIGSA-N	436.472	1.592	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NCc1cccc(C(=O)N2CCOCC2)c1	920811304	GTZRUWQZVGAHNP-HNNXBMFYSA-N	444.463	1.596	50	20	IDGD	
Cc1ncccc1CC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	1117126945	AEBHZDHGEULHRJ-UHFFFAOYSA-N	438.509	1.872	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)c1ccccc1Cl	1324990182	AZMHHUIZTGGOBX-UHFFFAOYSA-N	443.934	1.748	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4cncn4c3)C2)C1	1778695327	GVBPIODJROBCRE-QFBILLFUSA-N	435.322	1.951	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2)c1nnc(-c2ccccc2)o1	1779424004	ZEWLHLBOVRVSBU-WHSLLNHNSA-N	448.907	1.464	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C=N/O[C@H]2CCCCO2)C1	1779428530	MURYFLLOXVJZBU-FNCSKKEUSA-N	445.944	1.283	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](COC(C)=O)OC(C)=O)C2	1780704959	YUNZKQKZGHSYHT-WOCWXWTJSA-N	446.928	1.013	50	20	IDGD	
O=C(c1ccc2c(Cl)ccnc2c1)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1782201446	ADRNLRNELSEQGS-PXNSSMCTSA-N	438.311	1.931	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H]1CC[C@@H]3CCC(=O)N3C1)C2)C(Cl)Cl	1782219376	YHGWWASYUMRIEW-LYKCQVCGSA-N	446.375	1.705	50	20	IDGD	
Cc1cccn2ncc(C(=O)N3CC[C@]4(CN(C(=O)CCBr)CCO4)C3)c12	1782519793	SNMGKXTXKBEIFJ-IBGZPJMESA-N	435.322	1.871	50	20	IDGD	
CCC(=O)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](Br)Cc1ccccc1)CCO2	1783095044	QPLFOTJUIFEHPY-OXJNMPFZSA-N	437.334	1.802	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)C(C)(C)NCCC#N)CCO2	1783343351	UOKPBBUJDCNFCO-KSSFIOAISA-N	429.359	1.272	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cnc4cc(Cl)ccn34)CCO2)C1	1783875969	QFDNEVXVYDFDHB-AUUYWEPGSA-N	441.315	1.685	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3(c4ccc(O)cc4)CC3)[C@H]2C1	1784142269	OZNZZKFGWVUZGO-FZDIXFNVSA-N	436.936	1.657	50	20	IDGD	
Cc1cccc(C(=O)N2CC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)c1Cl	1785028461	QPWBTHIGPCWSQX-JOCHJYFZSA-N	442.708	1.086	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)COc3ccc(C(=O)OC)cc3)C2)C1	1785721657	XLLBPNTUSBUSIM-DYESRHJHSA-N	438.908	1.699	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ncc(Cl)cn3)[C@H]2C1	1785821301	GMGOTIKEGDCNLJ-URBCHYCLSA-N	431.718	1.507	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(=O)oc3)[C@H]2C1	1786276514	DAEGDQFJWMWSHA-DHMWGJHJSA-N	427.295	1.264	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)COc3ccccc3)C[C@@H]21	1786404489	VMUKQGAVUZSDHI-XIRDDKMYSA-N	425.323	1.830	50	20	IDGD	
O=C(CCBr)Nc1ccc(C2(NC(=O)[C@@H](O)N3CCOCC3)CCC2)cc1	1787674915	BDYNSXNHUQKJIC-GOSISDBHSA-N	440.338	1.556	50	20	IDGD	
COc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]3C2)ccc1O	1788763730	ZAJOFNGCDDXTNY-BXWFABGCSA-N	436.581	1.846	50	20	IDGD	
Cc1ccncc1CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]2C1	1789922681	RTFPTBIOMMYBBY-NBOOPKSLSA-N	442.329	1.993	50	20	IDGD	
Cc1ccc(C(=O)C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]3C2)cc1	1789925578	RLEWZKGOIPRAAL-QBYUYEEZSA-N	441.297	1.848	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc4ccnn34)[C@H]2C1	1790341028	CCEAEQYGUBNRJF-OAOQPFQOSA-N	449.349	1.959	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3COc4ccccc4O3)C[C@@H]21	1791252559	MQXOJRZJTGRFAR-MXJLVENISA-N	438.908	1.060	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(C(F)(F)F)ccn3)C[C@@H]21	1791255239	HUAWKRLRMICDLN-ZIEJDFEHSA-N	449.857	1.948	50	20	IDGD	
C[C@H](Br)C(=O)Nc1ccc(C2(NC(=O)CN3C(=O)CNC3=O)CCC2)cc1	1791432340	VWDJWBURYCUFAR-NSHDSACASA-N	437.294	1.456	50	20	IDGD	
O=C(CCCn1cccc1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21	1791665936	BXIDAJBUTWNLCK-QBYUYEEZSA-N	430.318	1.939	50	20	IDGD	
CC(C)N1CCC[C@H]1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)Br)C[C@@H]21	1791811265	NJFPNUZUOQXJHK-XAJHFOFHSA-N	430.387	1.622	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1ccc(C#N)cc1	1792638066	KXUYEQCDIRXOSQ-SXRZSVBQSA-N	446.511	1.873	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1(F)CC1)C2	1793879266	TYVCVYWBCDZPFK-CRWXNKLISA-N	433.908	1.210	50	20	IDGD	
C[C@H](Nc1cccnc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)CBr)C2	1795603006	UPMJIAPPRSBKQQ-JGFGOLAASA-N	439.354	1.503	50	20	IDGD	
CN(CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C(C)(F)F)NC(=O)NCc1ccccc1	1795913840	BXNJYAGMEMCEOF-BJWYYQGGSA-N	437.491	1.626	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2sccn2c1	1796577835	JXKLBPCZWMQBFT-QDMKHBRRSA-N	438.513	1.565	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1n[nH]c2ccc(F)cc12	1797480321	DPEHYIKDWIXWFF-YYHMBLRTSA-N	439.285	1.689	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc2ncsc12	1798166553	KFRBLAQUYKPMOV-QDMKHBRRSA-N	429.546	1.921	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H]1CCc3ccoc3C1)C2	1798439485	CEAFVHVGWCNPTG-NXOAAHMSSA-N	437.500	1.335	50	20	IDGD	
COc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)Br)C3)cc1OC	1798895393	OQQLNDVDUCGNSM-MBMVNNNZSA-N	441.322	1.690	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1n[nH]c3c1CCCC3)C2	1799275505	SWNVVMHYKPZIDV-RHQBZFHZSA-N	429.348	1.728	50	20	IDGD	
C[C@H](Oc1ccccc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Br	1799347615	SQOARBTWXMZWOC-IGNRKKQASA-N	429.286	1.734	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc3n(n1)CCCNC3=O)C2	1800081656	IGVBQQKMKACMHJ-JHXTVGTDSA-N	442.347	1.505	50	20	IDGD	
CN1CCCn2nc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)[C@@H](F)Br)cc2C1	1800161327	DPYWYKSIHLEBHG-OQMKEHIESA-N	442.333	1.661	50	20	IDGD	
CC[C@H](C)[C@@H](O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C#N)=C/c1ccc(F)cc1F	1800332507	RUROZUMXNSFVRK-PFDWVEPPSA-N	447.482	1.868	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ncccc1C(F)(F)F)C2	1800977014	OBCUIDRZHVIEKK-ZMJPVWNMSA-N	435.830	1.557	50	20	IDGD	
Cc1ccc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Br)C3)c(C)n1	1801230897	KQVRLZUGTOLOMP-MVJTYMMSSA-N	442.329	1.911	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CO[Si](C)(C)C)C3)cc1	1801783610	XCUZBMVZSCBASO-XEMDLRDOSA-N	433.581	1.700	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@](O)(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](F)Cl)C3)C1	1802413455	NNQASKYHQPPKMM-UUUMGPIQSA-N	433.908	1.531	50	20	IDGD	
CCC(=O)N[C@H](C)C(=O)NC[C@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1	1803429933	GCVFCGGNBOYHQB-DDUZABMNSA-N	439.354	1.787	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)c2ccccn2)[C@@H]1c1cccnc1	1805446964	SPFWJPRKGJRCLG-JXFKEZNVSA-N	445.483	1.109	50	20	IDGD	
COc1ncc(C(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)cc1C	1806097085	NXFVMQDGYNBIEM-CGTJXYLNSA-N	432.908	1.713	50	20	IDGD	
COc1cnc(C(=O)N2CC[C@H](CNC(=O)CCBr)[C@H]2c2cccnc2)cn1	1806339691	QKGFJSDKDQDGAS-RDTXWAMCSA-N	448.321	1.985	50	20	IDGD	
COc1cccc(CC(=O)N2CCCC3(CCN(C(=O)CCC(=O)NN(C)C)CC3)C2)n1	1806912927	NSVNJBMEYXKPRO-UHFFFAOYSA-N	445.564	1.237	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@@H]1c1cccnc1)c1cc(O)n[nH]1	1807289521	OGXVRYYLNXGASM-GDLCADMTSA-N	426.246	1.520	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)s1	1807369454	KKTFYTHAGNMIJJ-GHTZIAJQSA-N	449.341	1.765	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)[C@H]1CC=CCC1	1808125566	QQGKMBCSCAFFKT-WEYGHZABSA-N	433.317	1.437	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC2(CCCN(C(=O)CCN3CCOCC3)C2)CC1	1809586314	CDYNDSBAIXZHEF-MRXNPFEDSA-N	430.387	1.723	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2nc[nH]c2[N+](=O)[O-])[C@H]1c1cccnc1	1813030206	FDYXRFBMKVPVGY-YDHLFZDLSA-N	436.856	1.286	50	20	IDGD	
O=C(CCn1cncn1)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@H]1c1cccnc1	1813319952	CBNKVAWQVWROSY-CWRNSKLLSA-N	439.289	1.460	50	20	IDGD	
Cc1nc[nH]c1CSCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](O)CCl)n[nH]1	1814873377	QFGIIVDRYUOCDG-HUUCEWRRSA-N	440.957	1.966	50	20	IDGD	
Cc1cc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)c(C)o1	1816414634	AREBRIFFGMSUGE-IBGZPJMESA-N	436.277	1.919	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1nccs1	1816568957	VCKCLWWUOKRALC-OAHLLOKOSA-N	425.279	1.166	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)Cc2cccnc2)[nH]n1)c1cccc(B(O)O)c1	1817475008	JMYZGZFVQFENQV-IBGZPJMESA-N	433.277	1.033	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1)c1cccn2c(O)nnc12	1817964397	ANMZOPLKAOJKBY-CHWSQXEVSA-N	433.856	1.064	50	20	IDGD	
Cc1c[nH]cc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1818217727	BUWMARABNVVTMR-QGZVFWFLSA-N	436.476	1.664	50	20	IDGD	
Cc1cc2nnc(C(=O)Nc3nc4c(s3)C[C@@H](NC(=O)[C@H](F)Cl)CC4)c(C)n2n1	1818248997	YCUVRSYQRRITBN-XPTSAGLGSA-N	437.888	1.958	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)CCN2CCOCC2)[nH]n1)[C@@H](F)Br	1820932053	CGYYOQRYUUTIGV-XJKSGUPXSA-N	446.321	1.815	50	20	IDGD	
CCOc1ccc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@@H](O)CCl)CC3)nn1	1821750194	QEQLUBFYQDTUMF-CABZTGNLSA-N	425.898	1.157	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(O)c(F)c2)[nH]n1	1822415986	VYSQGWNQTYRXCJ-INIZCTEOSA-N	446.483	1.933	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCC(=O)N1CCCC1)CC2	1825995510	YHYVQJMOLVCSQV-OLZOCXBDSA-N	442.969	1.712	50	20	IDGD	
C=C(CC(=O)OCC)C(=O)N[C@H]1CCc2nc(NC(=O)[C@H](Cl)COC)sc2C1	1826007015	POEHPLWCMKJUQL-NWDGAFQWSA-N	429.926	1.818	50	20	IDGD	
CN1CCN(C2(C(=O)N[C@H]3CCc4nc(NC(=O)C(Cl)Cl)sc4C3)CC2)CC1	1826104666	VANHGKFLFZHHJY-NSHDSACASA-N	446.404	1.639	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC([C@@H]2CCCCN2C(=O)C[C@H](NC)C(=O)O)CC1	1826947515	CSQVNAOFARKNSQ-JYJNAYRXSA-N	446.386	1.842	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCCC[C@H]1C1CCN(C(=O)CC[C@@H](N)C(N)=O)CC1	1829102286	NBOXJEZHXNQFGN-SJORKVTESA-N	426.634	1.050	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(=O)n3[nH]cnc3n2)CC1	1830305871	FEHOKBGFBCJXKN-GOEBONIOSA-N	434.928	1.668	50	20	IDGD	
O=C(c1cc2sccc2s1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1830730771	DQIDVFIZXRUBDA-KPZWWZAWSA-N	444.962	1.633	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cn4cccnc4n3)C2)C1	1831650479	IDLHZOPMMJJVCC-MGPUTAFESA-N	435.912	1.207	50	20	IDGD	
Cc1onc(C(=O)N2CCO[C@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)c1C	1831978381	TWICWPRONBDQHV-IBGZPJMESA-N	425.558	1.213	50	20	IDGD	
C[C@H](CC(N)=O)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)CBr)CC2)CC1	1833518000	VRABNFDCJCYWPS-KGLIPLIRSA-N	445.402	1.101	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cnoc3C3CC3)CC2)CC1	1834349037	VISYYLKNEPZUAN-SFHVURJKSA-N	438.956	1.991	50	20	IDGD	
Cc1nc(C(=O)N2CCOC[C@]3(CN(C(=O)CCBr)CCO3)C2)cs1	1834819404	PZHCQVJWVQIEOY-INIZCTEOSA-N	432.340	1.307	50	20	IDGD	
O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)CCBr)CCO2	1834822473	PKGDBBPLJVBTAJ-AWEZNQCLSA-N	442.148	1.013	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccc(F)cn3)CCO2)C1	1836034671	OYFOOJXFJJLJPA-RTBURBONSA-N	448.322	1.456	50	20	IDGD	
Cc1noc(N)c1C(=O)N1CCC(N2CCC(NC(=O)[C@@H](F)Br)CC2)CC1	1836412501	KBANYGQIRDZCOZ-CQSZACIVSA-N	446.321	1.441	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)CCc3cnc[nH]3)CC2)CC1)[C@H](F)Br	1836414214	YWHQDSKDXCZLBQ-KRWDZBQOSA-N	444.349	1.604	50	20	IDGD	
CN1C(=O)CC[C@H]1C(=O)NC1CCN(C2CCN(C(=O)[C@@](C)(Cl)CCl)CC2)CC1	1836416948	GTZGQEPRCRPBSH-JXFKEZNVSA-N	447.407	1.415	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC(OC2CCN(C(=O)CCC(N)=O)CC2)CC1	1836673101	AZMHXOPCISKEKR-CYBMUJFWSA-N	432.359	1.282	50	20	IDGD	
O=C(c1cc2cnccc2[nH]1)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836717084	HEQUXRFQQZJYOP-IBGZPJMESA-N	434.924	1.775	50	20	IDGD	
CC(C)n1nccc1C(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836718604	WAXMUYZYZGMURI-SFHVURJKSA-N	426.945	1.676	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc4ccccn34)C2)C1	1837713316	VQNDDRHQNPBVRS-NRFANRHFSA-N	446.580	1.256	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCC(OC2CCN(C(=O)CSC(=N)N)CC2)CC1	1837827869	OUBUCGMZQYQVLF-KRWDZBQOSA-N	439.409	1.848	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)CSC(=N)N)CC2)CC1	1837831538	UKNSJSFDQHDBTF-CQSZACIVSA-N	449.415	1.785	50	20	IDGD	
Cc1nccnc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1	1838217009	QMEMPISCTGZQIX-MSOLQXFVSA-N	431.320	1.091	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(O)nc3)CCO2)C1	1838655275	WEQMVEMLZVFGGD-KBXCAEBGSA-N	442.310	1.031	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)COc3cc(Cl)ccn3)C2)C1	1839145444	HXOWBRXANOZHNG-HNAYVOBHSA-N	446.331	1.588	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(=O)c3ccco3)C2)C1	1839150783	XJXUSSUUHIPFRC-ZWKOTPCHSA-N	433.288	1.155	50	20	IDGD	
CC(C)c1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)no1	1839197784	IHWUVKWXYDJVPD-PBHICJAKSA-N	448.289	1.559	50	20	IDGD	
O=C(Cc1ccc(F)cc1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839198721	APEDKLWMZBKZRS-SJLPKXTDSA-N	447.276	1.515	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc4nn(C)cc4c3)CCO2)C1	1839506080	ZKNAVXLZYBNMHB-DYESRHJHSA-N	434.924	1.661	50	20	IDGD	
C=CCC(F)(F)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)Br)C2)C1	1839890742	QVNVYAVETZCRAS-SWLSCSKDSA-N	425.270	1.438	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3scnc3C3CC3)C2)C1	1840151052	VPFRULCSHWOTSM-AUUYWEPGSA-N	443.953	1.344	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cc(C)ccc3C)C2)C1	1840155424	BKXUWMFQDLLZTO-UGKGYDQZSA-N	438.952	1.556	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(F)cc3OC)CCO2)C1	1840641456	GWLWHTGCVGCDQU-UZLBHIALSA-N	444.887	1.158	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(F)c(OC)c3)CCO2)C1	1840682806	HHYKOLJMZCYNKS-FOIQADDNSA-N	428.888	1.922	50	20	IDGD	
CC(=O)N[C@@H](C(=O)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1)c1cccc(Cl)c1	1841352302	HAHMEQQRMHUGFW-HZPDHXFCSA-N	428.316	1.320	50	20	IDGD	
O=C(c1csc(-c2cccnc2)n1)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843011219	FDITYRABNIMZQN-UHFFFAOYSA-N	448.313	1.016	50	20	IDGD	
COC(=O)C[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)[C@@H](F)Cl)C1	1843366824	SBVMGVJGCBVVOV-WCQYABFASA-N	435.880	1.181	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC2(CCCN2C(=O)[C@H](C)[C@@H]2SC(=N)NC2=O)C1	1843402826	QIGBZELVJPCKEO-MXWKQRLJSA-N	431.356	1.023	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1cccc(-c3cnco3)c1)C2	1844264945	BAEJLCGHWVEEPY-UHFFFAOYSA-N	446.467	1.471	50	20	IDGD	
Cn1cc(-n2cc(C(=O)N3CC[C@H]4[C@@H]3CCN4C(=O)[C@H](O)CCl)c3ccccc32)cn1	1847559293	GZUQARZLVQRZAY-SLFFLAALSA-N	441.919	1.779	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](O)CCl)nc1Br	1847566041	DPYBSRHENALDGR-SDDRHHMPSA-N	432.702	1.268	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1[C@@H](C(=O)N1CC[C@H]3[C@@H]1CCN3C(=O)[C@@H](O)CCl)C2	1847568117	BGBBOBBLZDVLLS-UYLCUJDWSA-N	441.956	1.576	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)[C@H](C)Oc2ccc(C#N)cc2)cc1OC	10780534	OTSIKZACLGZIGL-ZDUSSCGKSA-N	427.413	1.347	50	20	IDGD	
O=C(NNC(=O)c1c[nH]c(=S)n1-c1ccccc1)c1csc(N2CCOCC2)n1	21967625	CFLQCXLJBSXLOD-UHFFFAOYSA-N	430.515	1.903	50	20	IDGD	
C=CCc1cc(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc(OC)c1OC	24291923	HEGYVPBSRQODPA-UHFFFAOYSA-N	432.502	1.800	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)cc1F	28581022	TYOOBMAWWDUKDD-UHFFFAOYSA-N	449.504	1.549	50	20	IDGD	
O=C(NNC(=O)c1c[nH]c2ccccc2c1=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	32605220	AWKOGBFXVYLXOY-UHFFFAOYSA-N	440.481	1.387	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CCCC(=O)NNC(=O)c2ccc(OC)cc2)cc1	100049292	YEJIHHAHQGQZIL-UHFFFAOYSA-N	428.445	1.096	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)CNC(=O)c1cnc2ccccc2c1O	107910105	JWBUQGDLYCMFJQ-UHFFFAOYSA-N	438.440	1.295	50	20	IDGD	
O=C(NNc1nc(-c2ccncc2)no1)c1cccc(S(=O)(=O)NC[C@H]2CCCO2)c1	110329042	NEMNBJVOXUBORH-OAHLLOKOSA-N	444.473	1.346	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@@H]2CCCC[C@@H]2C(=O)N2CCCC2)cc(OC)c1OC	726864969	NCGASQXTOKKELA-CVEARBPZSA-N	433.505	1.902	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3cn(C)nc3C(F)(F)F)cc2)CC1	728216096	QHOJTPFMTVVMSP-UHFFFAOYSA-N	446.455	1.132	50	20	IDGD	
Cc1nc2c(c(C)nn2C)c(C)c1CC(=O)NNC(=O)C1CCN(c2ncccn2)CC1	728845939	QTCLJMPPZBLTLJ-UHFFFAOYSA-N	436.520	1.290	50	20	IDGD	
Cc1cc(NC(=O)CSCC(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)no1	728976420	NZFGBJGIFCDMKW-UHFFFAOYSA-N	434.446	1.794	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)N[C@H](C)[C@@H](C)N2CCOCC2)c2ccccc2c1=O	729624309	RTSHUNAVXJJYDM-HZPDHXFCSA-N	444.536	1.250	50	20	IDGD	
O=C(O)c1cc(C(=O)O)cc(S(=O)(=O)NNC(=O)c2cccc(C(F)(F)F)c2)c1	729963014	SBATWFLWBCALTM-UHFFFAOYSA-N	432.332	1.725	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)Cc2c(C)nc3[nH]n(C)c(=O)c3c2C)cc1OC	730104780	XQOGPLYKSPPSMQ-UHFFFAOYSA-N	427.461	1.289	50	20	IDGD	
O=C(CNC(=O)c1c(F)cccc1Cl)NNC(=O)c1nn(-c2ccccc2)cc1O	730585208	SKCDHMGNDHXQRC-UHFFFAOYSA-N	431.811	1.561	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)NC[C@H](c1cccc(F)c1)N1CCOCC1	730825749	WJDDHGLFBZMNHC-QGZVFWFLSA-N	432.452	1.314	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)c2nnn(-c3ccc4c(c3)OCCO4)c2C)c1	731453561	MGPILZBNMCGSNS-UHFFFAOYSA-N	437.456	1.804	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCc3ccccc32)c1	731852236	OZOBWBVLCJQIKK-UHFFFAOYSA-N	439.497	1.934	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)C(=O)c2cnn(-c3ccccc3)c2)c2ccccc2c1=O	733774723	QNZJHXOGJPACEA-UHFFFAOYSA-N	444.451	1.807	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)N[C@@H]1CCN(C2CC2)C1	734285305	IRNFXPSSNFNQPY-MRXNPFEDSA-N	435.550	1.042	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)c2ccc(Cn3cncn3)cc2)CC1	734825711	MXXZULPXBBIRLP-UHFFFAOYSA-N	443.508	1.670	50	20	IDGD	
COc1ccc(S(=O)(=O)C[C@@H](C)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)cc1	735124182	SBOBZJSIMBMLBG-CQSZACIVSA-N	442.497	1.956	50	20	IDGD	
Cc1cc(NNC(=O)CCNS(=O)(=O)c2cccc(Br)c2)nc(C)n1	736711748	JWIORCIITXOFNG-UHFFFAOYSA-N	428.312	1.668	50	20	IDGD	
CC(C)(CC(=O)NNC(=O)c1csc(N2CCOCC2)n1)NC(=O)OC(C)(C)C	739681079	SUSQYUHQTCHDTI-UHFFFAOYSA-N	427.527	1.434	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CCN2CCN(c3ccccn3)CC2)ccc1OC(C)C	741144487	UXBYXUQWPLAZTO-UHFFFAOYSA-N	441.532	1.851	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)c2ncoc2-c2ccc3c(c2)OCCO3)c2ccccc2c1=O	742034230	KOPBEDVUDPDZNO-UHFFFAOYSA-N	447.407	1.435	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)[C@H](c1ccccc1F)N1CCOCC1	742617938	CRKDDNUFJZSTDK-FQEVSTJZSA-N	448.520	1.783	50	20	IDGD	
Cc1cc2nc(C)c(CCC(=O)OCC(=O)NNC(=O)c3cccc(C#N)c3)c(C)n2n1	744588402	WEDRLJLTNLISDL-UHFFFAOYSA-N	434.456	1.463	50	20	IDGD	
Cn1cc(-c2nc(C(=O)NNc3ccccc3S(=O)(=O)N3CCOCC3)cs2)cn1	744619884	BQBCOZQODBOOMU-UHFFFAOYSA-N	448.530	1.321	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)[C@@H]2CCCN(C(=O)c3ccccc3)C2)c1	744994545	MYKOMHDECLHZRJ-LJQANCHMSA-N	434.452	1.415	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)c2ccc(N)cc2-n2nnnc2C)cc1C	745104670	XTTOLRPFVJOVEO-UHFFFAOYSA-N	443.489	1.103	50	20	IDGD	
CC(=O)c1cccc(O[C@H](C)C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)c1	745107410	BIZIDRMQFAECJY-CQSZACIVSA-N	432.502	1.719	50	20	IDGD	
Cn1ccc(N2CCC[C@H](NC(=O)NNC(=O)CC34CC5CC(CC(C5)C3)C4)C2=O)n1	745884579	YRPLNGBUMDBQOY-ATFGOMPUSA-N	428.537	1.852	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CN2CCC(C(=O)NCC(C)(C)CN(C)C)CC2)c1	746478379	ZMUKZRWLOOXQGX-UHFFFAOYSA-N	431.581	1.172	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@@H](C)CN(C)C(=O)OC(C)(C)C)c2ccccc2c1=O	746821032	FJNCHYKFRIGQPH-ZDUSSCGKSA-N	431.493	1.680	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)Nc2ccc(C(=O)NNc3nccn(C)c3=O)cc2)cc1	747942208	ZNHWFKJRHFZEIS-UHFFFAOYSA-N	441.469	1.541	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N2CCc3c[nH]nc3C2)cc1	750794544	PJYUDFKJDPZPLG-LICLKQGHSA-N	445.483	1.649	50	20	IDGD	
CC[C@H](C)C(=O)N1CCC[C@@H](C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)C1	751292835	BCLMJXRNBZTLIJ-WCQYABFASA-N	444.941	1.033	50	20	IDGD	
O=C(COC(=O)Cc1cc(Cl)cc2c1OCC2)NNC(=O)c1ccc([N+](=O)[O-])cc1	755091601	QEBJTDJYUHJGEW-UHFFFAOYSA-N	433.804	1.730	50	20	IDGD	
COc1ccc(C(=O)N2CCN(C)CC2)cc1NC(=O)NNC(=O)c1ccccc1C	756247538	GXOKLTYFNWPNQZ-UHFFFAOYSA-N	425.489	1.858	50	20	IDGD	
C[C@@H]1C[C@@H](C)CC2(C1)NC(=O)N(CC(=O)NNC(=S)Nc1ccc(N(C)C)cc1)C2=O	757649854	XGTNHEZYXVMLMH-ZIAGYGMSSA-N	446.577	1.817	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CSc2nnc(CO)n2-c2ccccc2)cc1OC	758006412	XCOLDOXEWLXCCC-UHFFFAOYSA-N	443.485	1.330	50	20	IDGD	
Cc1c(CCC(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)cnn1C	758070035	ZAPCYDLEMOCSGX-UHFFFAOYSA-N	444.495	1.881	50	20	IDGD	
O=C(NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)NNC(=O)c1ccc(Cl)cc1F	758692556	QRGFHSLSVJIWOU-UHFFFAOYSA-N	444.828	1.805	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccc(F)c(F)c2)c2c1CCC2)C(=O)Nc1ccccn1	758832101	IZYNBRZANISRBL-UHFFFAOYSA-N	426.383	1.434	50	20	IDGD	
C[C@H](CO)CCCNC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	759630253	AUFTVBFDZYKFHG-ZDUSSCGKSA-N	440.547	1.902	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1ccc(-c2cc[nH]n2)s1	761971929	KVCCXFDCEBVBQH-UHFFFAOYSA-N	433.515	1.916	50	20	IDGD	
CN(C)C(=O)C[C@H]1CN(C(=O)C(=O)NNC(=O)c2ccncc2)c2ccc(Cl)cc21	763462629	QTQAOIFMAIATKW-ZDUSSCGKSA-N	429.864	1.105	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)c2ccccn2)sc2c1CCSC2	763463827	MPPXKUZHODRLSJ-UHFFFAOYSA-N	434.499	1.509	50	20	IDGD	
CCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2Br)c(C)c1	763482036	BQFSEOLRLMLBJO-UHFFFAOYSA-N	447.289	1.907	50	20	IDGD	
Cc1c(F)cccc1NC(=O)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	763512308	PZCHBUGGZLRPKU-UHFFFAOYSA-N	448.476	1.318	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)C(=O)Nc1ccc(F)cc1OCC(F)F	763548834	TYRDRERYLBXWNK-UHFFFAOYSA-N	425.319	1.598	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)Nc1ccc(F)cc1C(F)(F)F	763573080	QCLQTOPEBVVRRJ-AWEZNQCLSA-N	427.310	1.770	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(O[C@H]3CCOC3)cc2)cc1	763661393	OSJOFBPOQSWIAP-SFHVURJKSA-N	429.429	1.028	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2ccc(C(=O)NCC(C)C)cc2)c1	763667902	DWEHMAREGWTFMH-UHFFFAOYSA-N	440.500	1.854	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccnc1N1CCCCC1	763682109	OGEWAGWCJDKGFF-UHFFFAOYSA-N	441.488	1.636	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(OC)c([N+](=O)[O-])c1	763685414	VCMKWFKAIFROJP-UHFFFAOYSA-N	432.389	1.167	50	20	IDGD	
Cc1cc(N2CCOCC2)ccc1NC(=O)C(=O)NNC(=O)Cc1c[nH]c2ccccc12	763860372	FBPKQFLCGCWDHI-UHFFFAOYSA-N	435.484	1.642	50	20	IDGD	
O=C(Cc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1ccccc1C(=O)N1CCCC1	763936136	FULOBFMDAZZIOY-UHFFFAOYSA-N	428.876	1.905	50	20	IDGD	
Cn1cnnc1-c1cccc(NC(=O)C(=O)NNC(=O)c2cccc(Br)c2)c1	764059739	YDKPGBOPBMHBGV-UHFFFAOYSA-N	443.261	1.644	50	20	IDGD	
COC(=O)CSCc1cccc(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)c1	764152357	DIGQQAFSTJLSBI-KRWDZBQOSA-N	443.481	1.182	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)C(=O)Nc2cnccc2SC)c1	764232501	PSLRHJDDGOZKLT-UHFFFAOYSA-N	439.291	1.974	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cccc(C#N)c2)c(OC(F)F)c1	764234847	LSSSXGFPXDQSCO-UHFFFAOYSA-N	432.339	1.346	50	20	IDGD	
O=C(NNC(=O)c1cccc(OC(F)F)c1)C(=O)Nc1cnn(Cc2ccncc2)c1	764249567	BFRIDSWBZXWAKL-UHFFFAOYSA-N	430.371	1.328	50	20	IDGD	
COc1ccc(C#N)cc1NC(=O)C(=O)NNC(=O)c1cc(Br)ccc1O	764279205	ZVODOYJEHNVWOD-UHFFFAOYSA-N	433.218	1.435	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)C(=O)Nc1ccccc1N1CCOC1=O	764344011	XNSOMEIZIVKOHS-UHFFFAOYSA-N	434.412	1.229	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)Cc2ccncc2)cc(OC)c1Br	764352940	FNHVZXLTLIBKCO-UHFFFAOYSA-N	437.250	1.190	50	20	IDGD	
Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)C(=O)NNC(=O)Cc1ccncc1	764355685	FWQRLSPHECPYBO-UHFFFAOYSA-N	430.424	1.778	50	20	IDGD	
Cc1cc(C(=O)N2CCC[C@@H](C)C2)ccc1NC(=O)C(=O)NNC(=O)Cc1ccncc1	764356013	PCRNHGMTZYXRFC-OAHLLOKOSA-N	437.500	1.591	50	20	IDGD	
COCCOc1ccc(F)cc1NC(=O)C(=O)NNC(=O)C(F)(F)Oc1ccccc1	764370563	SJHOLMXHLIBZEW-UHFFFAOYSA-N	441.362	1.609	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cnn(-c4ncccn4)c3)n[nH]2)cc1C	764387731	MESOIOFXIMCNEI-UHFFFAOYSA-N	445.443	1.069	50	20	IDGD	
CC(=NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1)c1cnc(C)nc1C	764819593	RTTJLKIDYOSJLC-UHFFFAOYSA-N	444.561	1.249	50	20	IDGD	
NS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)cc1Cl	765618054	HLVQDIIAHMGKLO-UHFFFAOYSA-N	437.840	1.591	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NC[C@@H]1CCCS1(=O)=O	765645956	YDYATXYSHDPZSZ-MFKMUULPSA-N	434.312	1.124	50	20	IDGD	
C[C@H](CC(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1)c1ccc(F)cc1	765737457	FOWDTCNCUGILLX-QGZVFWFLSA-N	426.492	1.925	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	765755067	CMIQWHVRCUFSOX-UHFFFAOYSA-N	434.899	1.823	50	20	IDGD	
COC(=O)[C@H](NNC(=O)C1CCN(c2ncccn2)CC1)c1cccc(Br)c1	766735087	QCVBTMRFHDFPKM-MRXNPFEDSA-N	448.321	1.991	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)CCC(=O)c1ccc2c(c1)CCC(=O)N2	767249013	QNAPNAUNMRHFKE-UHFFFAOYSA-N	447.492	1.389	50	20	IDGD	
CNS(=O)(=O)c1cccc(NC(=O)[C@H](C)NC(=O)[C@H](Br)C(C)(C)C)c1	767977655	BXKLKTUKOYGJBO-GWCFXTLKSA-N	434.356	1.848	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)C(=O)Nc1ccccc1OCC(=O)Nc1cccnc1	768243386	VGPJWDWSJCZHSX-UHFFFAOYSA-N	448.439	1.202	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)CN2C(=O)N[C@@]3(CCCC(C)(C)C3)C2=O)c1	768571049	LOBQAEQZCFCPDD-JOCHJYFZSA-N	430.505	1.720	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)N[C@H](C)CNC(=O)OC(C)(C)C)nc1	769539611	WALVZAGCBRCJCM-GFCCVEGCSA-N	430.531	1.308	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CC(=O)N(c2cccc3ccccc23)C1)c1ccc(-n2cnnn2)cc1	769596766	JXTAZPJEHUDYHU-QGZVFWFLSA-N	441.451	1.630	50	20	IDGD	
COc1ccccc1[C@]1(C)NC(=O)N(CC(=O)NNc2ncnc3ccsc23)C1=O	771650577	STCWVIVDNDKUMC-IBGZPJMESA-N	426.458	1.610	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2ccc(-c3ncn(C)n3)cc2)c2ccccc2c1=O	771781023	SXRBQOADMLWKDY-UHFFFAOYSA-N	432.444	1.678	50	20	IDGD	
COC(=O)c1ccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c(F)c1	771882479	PPRQJRAHNHXIAN-UHFFFAOYSA-N	449.460	1.472	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)[C@]12CCC(=O)N1c1ccccc1C(=O)N2CC(C)C	771970003	QQHISKWBYNKYTM-FPTDNZKUSA-N	444.488	1.111	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)C1CCN(C(=O)N2CCCC2)CC1	772889967	URRPAWVISIYTLT-UHFFFAOYSA-N	435.912	1.031	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)c1ccc(=O)n(-c2ccccc2F)n1	772897853	MZZFGRCVFJECPL-UHFFFAOYSA-N	443.822	1.102	50	20	IDGD	
CC(C)C(=O)NNC(=O)C(=O)Nc1ccc(OCCN2C(=O)c3ccccc3C2=O)cc1	773494741	XQKQNLBXTRNXNO-UHFFFAOYSA-N	438.440	1.104	50	20	IDGD	
Cc1oc2ccc(NC(=O)C(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)cc2c1C	773497656	ZTZWGIMZTNGGBX-UHFFFAOYSA-N	429.454	1.853	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)Cc1ccnc(O)c1Br	773631871	FIDGXMNHEKKGIW-UHFFFAOYSA-N	436.262	1.334	50	20	IDGD	
O=C(NNc1ccccc1[N+](=O)[O-])C(=O)Nc1ccc(C(=O)NC2CCOCC2)cc1	773655058	LPMKABGXHGFPTI-UHFFFAOYSA-N	427.417	1.585	50	20	IDGD	
N#Cc1ccnc(C(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)c1	774330442	RSGMXKXQYWQSBE-UHFFFAOYSA-N	435.465	1.507	50	20	IDGD	
Cc1nc(NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)ccc1Br	775782315	DMYYWTGEXATVCR-UHFFFAOYSA-N	431.250	1.866	50	20	IDGD	
Cc1ccc(S(=O)(=O)C[C@H](C)NC(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1	776191381	CJAVJPXDCWPSIB-AWEZNQCLSA-N	433.486	1.573	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)[C@@H]2CCCN2C(=O)C(F)(F)F)c2ccccc2c1=O	776314287	JDAGMYHZQUDUJG-ZDUSSCGKSA-N	439.394	1.292	50	20	IDGD	
CN(C(=O)OC(C)(C)C)[C@@H](C(=O)NNC(=O)[C@H]1COc2ccccc2O1)c1cnn(C)c1	776318252	RXBZFTOAHZGHID-IAGOWNOFSA-N	445.476	1.316	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)CN2CCN(C(=O)OCc3ccccc3)CC2)c1	776527368	FTWAGQAWUILKDB-UHFFFAOYSA-N	446.529	1.488	50	20	IDGD	
Cc1cc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)nn1[C@@H](C)C1CC1	777192806	YCFVHLHYZBYHDV-UGSOOPFHSA-N	428.445	1.307	50	20	IDGD	
O=C(c1cnc(-c2ccccc2)nc1)N1CCN(S(=O)(=O)CBr)CC1	777779131	FVXMNCCOBDQDKK-UHFFFAOYSA-N	425.308	1.584	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)c2ccc(S(=O)(=O)N(C)C(C)C)cc2)nc1C	778421469	BEFJTDJREWXDJS-UHFFFAOYSA-N	435.506	1.748	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)/C(=C/c2cccc(OC)c2)n2nnnc2C)nc1C	778427594	COVFCIVMJYECEN-YVLHZVERSA-N	438.448	1.407	50	20	IDGD	
Cc1cc2ccc(Cl)cc2nc1NNC(=O)C(=O)Nc1ccc(S(N)(=O)=O)cc1	779326977	DIOHFLCCNQSQEI-UHFFFAOYSA-N	433.877	1.926	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C(=O)Nc2ccc(Br)nc2)nc2ccccc21	782892234	ABWQOWKUHRDFLU-UHFFFAOYSA-N	431.250	1.059	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2cccc(Cl)c2SC(F)F)CCS(=O)(=O)C1	783426681	JOHGKVXAUKRMRG-AWEZNQCLSA-N	427.882	1.791	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2cccc(S(C)(=O)=O)c2)c(Br)c1	784838949	AZULXDQLNUGBDE-UHFFFAOYSA-N	442.291	1.943	50	20	IDGD	
C[C@H](c1cccc(NC(=O)C(=O)NNc2ccc(C(F)(F)F)nn2)c1)N1CCOCC1	784886334	OOYVWIMHINMKDO-GFCCVEGCSA-N	438.410	1.970	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1cc(NC(C)=O)ccc1C	785331100	OODJYRJNPQXHNA-UHFFFAOYSA-N	434.474	1.447	50	20	IDGD	
Cc1ccc(N2CCNC2=O)cc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccccc1F	787544548	UEMQVMQDSLPVNK-CYBMUJFWSA-N	443.435	1.217	50	20	IDGD	
Cc1cc(F)cc(-n2cc(C(=O)NNC(=O)c3sc(N4CCOCC4)nc3C)nn2)c1	788727209	XHSOCNMKJQSNHV-UHFFFAOYSA-N	445.480	1.391	50	20	IDGD	
CS(=O)(=O)CC[C@@H](C(=O)OCC(=O)NNC(=O)c1ccc(C#N)cc1)c1ccccc1	789109032	RXTCWZWCEMUUBT-GOSISDBHSA-N	443.481	1.081	50	20	IDGD	
Cc1cc(C)n(-c2ccc(NC(=O)C(=O)NNC(=O)[C@H]3OCC[C@H]3c3ccccc3)cn2)n1	789810635	PQXRXSZJEIOSAX-ICSRJNTNSA-N	448.483	1.543	50	20	IDGD	
COc1cc(OC2CC2)ccc1C(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1	790112747	JNYCEHDIFHDZIN-UHFFFAOYSA-N	447.513	1.627	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cccc(N4CCC4=O)c3)n[nH]2)cc1	790951488	FURXDGXSJDYAHA-UHFFFAOYSA-N	446.467	1.776	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)Cc2ccncc2)cc(N2CCN(C(C)C)CC2)c1	792265688	GTSVUDNSXJBZFY-UHFFFAOYSA-N	438.532	1.249	50	20	IDGD	
C[C@H](Cn1ncc2ccccc21)C(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	792849484	WVEFWGVGTYJQPX-CYBMUJFWSA-N	425.401	1.585	50	20	IDGD	
CCOc1cc(N2CCN(C(=O)NNC(=O)c3cccc(C)n3)CC2)ccc1[N+](=O)[O-]	793220378	NZVNMMBEUBCFQZ-UHFFFAOYSA-N	428.449	1.874	50	20	IDGD	
Cn1cc(-c2cc(F)ccc2NC(=O)C(=O)NNC(=O)COc2ccccc2O)cn1	797003549	DCODVXQXWZVAFU-UHFFFAOYSA-N	427.392	1.097	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNS(=O)(=O)c1cc(Cl)ccc1Br	797430142	PTCNZMBRZMFKDK-UHFFFAOYSA-N	436.671	1.435	50	20	IDGD	
C[C@]1(CNC(=O)NNC(=O)CNC(=O)c2cccs2)CCN(Cc2ccccc2)C1	798484115	GHYVQERVSQIVJT-OAQYLSRUSA-N	429.546	1.721	50	20	IDGD	
CCn1ncc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)c1C(F)(F)F	799258431	CRTMWMOLVRGYEK-UHFFFAOYSA-N	427.339	1.093	50	20	IDGD	
COC(=O)c1cccc(NC(=O)C(=O)NNC(=O)CCc2ccccc2)c1OC(C)C	799258447	AHSYRHKUIXYXOR-UHFFFAOYSA-N	427.457	1.979	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)N[C@@H]2CCN(C(=O)Nc3ccccc3)C2)c1	801077866	OBBSLBQZCFUUPS-MRXNPFEDSA-N	427.461	1.954	50	20	IDGD	
O=C(CNS(=O)(=O)c1c[nH]c2ncccc12)NNc1ccccc1OC(F)(F)F	803126627	APDDPMVKKGUXQT-UHFFFAOYSA-N	429.380	1.883	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)Nc1ccc2c(c1)C(=O)N(CC1CC1)C2=O	808831670	FGGWGQGJWRBHMH-UHFFFAOYSA-N	438.440	1.933	50	20	IDGD	
O=C1CN(Cc2cccc(NC(=O)C(=O)NNc3ccc(Br)cc3)c2)CCN1	812983481	SXENUBPGFAPJSF-UHFFFAOYSA-N	446.305	1.463	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)c2ncccc12	813033011	AGFRZLANLWEYKV-UHFFFAOYSA-N	443.485	1.576	50	20	IDGD	
CCC(=O)Nc1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)cc1	813034107	YGZXUQIEELFPEU-UHFFFAOYSA-N	433.490	1.367	50	20	IDGD	
CN(Cc1ccccc1S(N)(=O)=O)C(=O)NNC(=O)c1cccc(OC(F)F)c1	814295864	IPJVAUGMDOQBKM-UHFFFAOYSA-N	428.417	1.422	50	20	IDGD	
O=C1COC[C@@H](C[C@H]2CN(C(=O)C(=O)NNc3cccc(Cl)n3)c3ccccc32)N1	815729563	ZLVDPDJSJYJHRG-QWHCGFSZSA-N	429.864	1.214	50	20	IDGD	
CCCn1c(C)cc(/C=C(/C#N)C(=O)N2CCN(S(=O)(=O)c3cc[nH]n3)CC2)c1C	819493809	IBDSMNAWPPUKFN-AQTBWJFISA-N	430.534	1.678	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2ccccc2I)C[C@H](C)O1	912920950	GUGNOKDSDBLEAN-RYUDHWBXSA-N	431.274	1.552	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)c2nn(-c3ccc(Cl)cc3)cc2O)c1	913088096	KFWMUHCEXJVQND-UHFFFAOYSA-N	434.861	1.710	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc2ccccc2c1)NNC(=O)c1cc(-c2ccccc2)[nH]n1	913422735	OKBHYRPNGYADDU-UHFFFAOYSA-N	449.492	1.969	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)CCNS(=O)(=O)c2ccc(C)c(C)c2)cc1	913429566	IQYWBOSMSQMOGS-UHFFFAOYSA-N	434.518	1.240	50	20	IDGD	
COCCN1C[C@H](C(=O)NNC(=O)c2cn(-c3ccccc3)nc2-c2ccccc2)CC1=O	914457763	LQVALQJBGBAIAJ-GOSISDBHSA-N	447.495	1.795	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)NCc2ccc(S(N)(=O)=O)cc2)cc1OC	915884819	XMIWYFNUDMQDAM-UHFFFAOYSA-N	436.490	1.276	50	20	IDGD	
CC[C@H](C)C(=O)NNC(=S)Nc1cc(S(=O)(=O)N2CCOCC2)ccc1Cl	916018436	FWZDZCRYYVHSOH-NSHDSACASA-N	434.971	1.725	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NN=C2CCS(=O)(=O)c3ccc(F)cc32)ccc1Cl	916334163	HIWIYHFTHKKJMA-UHFFFAOYSA-N	445.881	1.438	50	20	IDGD	
CC1CCN(CCCCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)CC1	916503062	FVVBRZPWWDIOPA-UHFFFAOYSA-N	439.582	1.393	50	20	IDGD	
O=C(CN1CCN(C(=O)Cc2ccc(Cl)cc2)CC1)NNC(=O)c1ccc(F)cc1	917129204	YWMUNZWZYQDTCN-UHFFFAOYSA-N	432.883	1.627	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(F)cc3nccnc23)c1	917519127	JEEVRBZITCBSFF-UHFFFAOYSA-N	445.476	1.874	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)CNS(=O)(=O)c2c[nH]c3ncccc23)c1C	918758468	SOIOZCRQYVQWJI-CQSZACIVSA-N	445.501	1.073	50	20	IDGD	
C[C@@H]1CN(Cc2cccc(CNC(=O)NNC(=O)COc3ccccc3C#N)c2)CCO1	920236985	GNTAAGUCPFPGHD-QGZVFWFLSA-N	437.500	1.688	50	20	IDGD	
O=C(Cn1cnc2ccccc21)NNC(=O)c1cn(-c2ccc(Br)cc2)nn1	1318501901	CPYWWCIBBRFGFV-UHFFFAOYSA-N	440.261	1.841	50	20	IDGD	
Cc1nn(C)cc1CCC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	1318515524	ZAVDCSIFTXQJLN-UHFFFAOYSA-N	447.542	1.985	50	20	IDGD	
CC(C)[C@H](NC1CCOCC1)C(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1	1318763727	ATDIEZKSGSQTKA-KRWDZBQOSA-N	426.558	1.574	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)c2ccc(NS(C)(=O)=O)cc2)CC1	1318914663	JQZVVVBGWPOIBC-UHFFFAOYSA-N	440.522	1.466	50	20	IDGD	
Cc1ccoc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnccc1C(=O)NN)C2	1778148539	FPJKPPOFDQQSAN-VGOFRKELSA-N	441.488	1.028	50	20	IDGD	
Cn1ncc(C(=O)N2CCO[C@@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)c1C(F)(F)F	1779295683	AFTCEJFWRGNHOI-QGZVFWFLSA-N	448.518	1.734	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(=O)nc4sccn34)C2)C1	1779949380	WNIJYAFCVSGZEN-ORAYPTAESA-N	438.937	1.607	50	20	IDGD	
Cc1nn(C)cc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Br)C1	1780770412	MYUTXEKDEJNRLT-JKIFEVAISA-N	431.306	1.547	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)c1ccco1)C2)[C@@H](F)Br	1780770730	XZIQISBMHXLHTG-VMUDFCTBSA-N	433.274	1.517	50	20	IDGD	
CC(C)NC(=O)OC(C)(C)C(=O)N1CC[C@]2(CN(C(=O)[C@@H](C)Br)CCO2)C1	1781023899	PUVRRUFPMJSGKR-ACJLOTCBSA-N	448.358	1.513	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCN(C)C(C)=O)C2	1781901549	PVEYWXCVEQIWQW-GPMSIDNRSA-N	446.386	1.542	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnc3ncccn13)C2	1782173100	XGWVFIXXQPHPBM-YYFZDKIDSA-N	435.912	1.111	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnc3[nH]ncc3c1)C2	1782175171	FQGRXMWNGKMWQW-JXXFODFXSA-N	435.912	1.339	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C=C/c1cccs1)C2	1782212041	PQISWVMXANQHEP-FYNYVBPPSA-N	448.589	1.648	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)n2cncn2)C1	1782526022	LPARNAGFURCRDA-LUXYFRNMSA-N	442.358	1.384	50	20	IDGD	
Cc1ccc(CCC(=O)N2CC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)cc1	1783298362	AAFJLYAMMCFZLM-HSZRJFAPSA-N	430.549	1.131	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3nn(C)c4c3CCC4)CCO2)C1	1783347802	OWGQWMDTRCFBAQ-LIRRHRJNSA-N	439.354	1.526	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](C)CN(CC)CC)CCO2	1783355246	MVHQSIDJACBRDN-GJYPPUQNSA-N	432.403	1.968	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)c1ccc(F)nc1F	1783385037	OVAAJNPGSRHUKC-DRZSPHRISA-N	432.265	1.738	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)CNC(=O)OC(C)(C)C)C2)C1	1783395203	ZKTGAAOTHABBQA-SCLBCKFNSA-N	448.358	1.372	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4sccc4c3O)C[C@@H]21)[C@@H](O)CCl	1784092230	KZGFCJDIGRBSLG-DDWPSWQVSA-N	438.933	1.800	50	20	IDGD	
C[C@@H](Oc1cccnc1)C(=O)N1CC[C@@]2(CN(C(=O)CCBr)CCO2)C1	1784549116	XHSAVXAJFIZVCQ-RDTXWAMCSA-N	426.311	1.464	50	20	IDGD	
CC(C)(NCCC#N)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]21	1786859369	CTJSNIQBAHBKHO-XLPNERPQSA-N	433.380	1.484	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)[C@@H]1CNc2ccccc21	1786876729	GBNVXIUXDRHMLT-DNMXQMFDSA-N	436.350	1.960	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccsc3)C[C@@H]21	1787509032	XSWWWFHWQIQZIX-FUPWHNRLSA-N	443.529	1.475	50	20	IDGD	
N[C@@H](C(=O)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1)c1ccccn1	1788140659	GUYPIYMCYBMYMD-OAQYLSRUSA-N	444.300	1.209	50	20	IDGD	
Cc1noc(CC(=O)NC2(c3ccc(NC(=O)c4cccc(B(O)O)c4)cc3)CCC2)n1	1788143950	YVZFKEPIRQIGMQ-UHFFFAOYSA-N	434.261	1.048	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccn4nccc4c3)[C@H]2C1	1788449213	NNJRSTBSEKCMLE-QCPWZWHMSA-N	435.322	1.711	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]3C2)c(O)n1	1789870564	NPDXSFBLYXBWSC-XPVILTJLSA-N	430.332	1.925	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3F)C[C@@H]21	1790961356	IXKFKXQEKDICKO-ZIEJDFEHSA-N	428.302	1.988	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)Nc3nccs3)C[C@@H]21	1791057055	AGCOXJXENLCBMP-PEDHHIEDSA-N	445.383	1.707	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc4[nH]ncc34)C[C@@H]21	1791058082	YBOGGLMUQMZTHB-HJXMPXNTSA-N	435.322	1.940	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3ccc(F)nc3)C[C@@H]21	1791252941	ZGPRYAVQMXKFDO-NXOAAHMSSA-N	427.904	1.387	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3c(F)ccc(O)c3F)C[C@@H]21	1791257268	VRFBMIDKMINZSJ-ASHKBJFXSA-N	432.851	1.518	50	20	IDGD	
N#Cc1ccc(CCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)cc1	1792479903	KWDZMAIWHTYOQQ-KOUNCHBCSA-N	431.301	1.123	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)COc1ccc(O)cc1	1792774065	IMWMCSAAEWTKHR-FLTUCWPJSA-N	441.322	1.392	50	20	IDGD	
COc1cccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)CBr)c1	1792872591	QAUUAPPIGVYHSO-FAYQHZLMSA-N	425.323	1.929	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc3ccnn13)C2	1792874640	VPFBRAVTFQZAQH-VWPFQQQWSA-N	435.322	1.569	50	20	IDGD	
C[C@@H](NC(=O)c1ccc(F)cc1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCl	1793115783	XUUSUGGEKPTJMW-ZQOQDGPXSA-N	425.888	1.182	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnn(-c3cccnc3)c1)C2	1793445826	SCOZBGIYTHZLRT-NBMJBFSESA-N	431.924	1.878	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)NC(=O)c1ccccc1)C2	1793455167	CVRWAHYKDDUZIQ-IQZDNPOKSA-N	435.952	1.802	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CCN1C(=O)OC(C)(C)C	1793630886	XNMHZRXCOOFITM-ZHCJQAHYSA-N	443.972	1.993	50	20	IDGD	
CC(C)c1nc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@](C)(Cl)CCl)C3)no1	1794002692	XZTOZMPQYAFCTL-TYYYEBLRSA-N	433.336	1.561	50	20	IDGD	
Cc1cccc(CCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)n1	1794175410	YJJWSEVTLCQXBJ-BCDXTJNWSA-N	436.516	1.273	50	20	IDGD	
COc1cnc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)CBr)C3)c(F)c1	1794449688	ISICUXJAYUCJPN-OHTBPHCPSA-N	444.301	1.464	50	20	IDGD	
COc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCBr)ccc1F	1795117139	OXFNQYBUYOBNAW-FVCICTRLSA-N	429.286	1.823	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)nc2ccccc12	1796916011	RAHVWGOISAXECI-AODNKKSCSA-N	433.892	1.397	50	20	IDGD	
Cc1ccc(C(=O)NCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CO[Si](C)(C)C)cc1	1797958937	BTEHRYRVSVGYTD-RMFSNUHRSA-N	447.608	1.166	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C[C@H]1CNc2ccccc2O1	1798368864	NMNBIPVPGGRNMM-MHORFTMASA-N	443.548	1.261	50	20	IDGD	
Cc1ccccc1NCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnccc1C(=O)NN	1798439200	ODSLHSLKJMSDDH-BJWYYQGGSA-N	436.516	1.357	50	20	IDGD	
Cc1cccn2ncc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3cnccc3C(=O)NN)c12	1798442741	BKQRWSSIXOWLIX-MUJYYYPQSA-N	447.499	1.207	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2	1798522303	OHAQFIYJJHAKQJ-OXUXUCFPSA-N	443.815	1.258	50	20	IDGD	
CC(C)(C)n1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@](C)(Cl)CCl)C3)nn1	1798708017	CAQUVLFBWXNDPC-JPVZDGGYSA-N	432.352	1.473	50	20	IDGD	
Nc1ccccc1/C=C/C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Br	1799346452	RBYJTWDUCBQFGH-YBWDHYDSSA-N	426.286	1.562	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)CBr)C2	1800226436	YPRZNIMHHWQLLP-XGFWRYKXSA-N	435.315	1.169	50	20	IDGD	
COC(=O)[C@H]1CC[C@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)Br)CC1	1800757981	ZFGKEPITHJSZBS-SBOZNWLOSA-N	445.354	1.339	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C=C/c1cc(F)c(F)c(F)c1	1800873067	XTTHOXKGFVMBDZ-CNIQGABISA-N	446.853	1.961	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](C)Br	1801961704	PBXNGRJRMUNKBR-ZWVOWAKLSA-N	438.326	1.542	50	20	IDGD	
CN(CCCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2)C(=O)OC(C)(C)C	1802132519	AHYAZMSYSVXXEM-XRGAULLZSA-N	435.924	1.758	50	20	IDGD	
C=CCOCCCC(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1803560695	OGDKNODPHKWBFG-CVDCTZTESA-N	445.564	1.443	50	20	IDGD	
Cc1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)c(Cl)c1	1803624302	BOXZIOVQOAVFFM-BCDXTJNWSA-N	426.709	1.894	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)c2cccn(C)c2=O)[C@@H]1c1cccnc1	1803835050	HDKCEXGPVRHKIR-LXZKKBNFSA-N	447.333	1.883	50	20	IDGD	
Cn1nc(C(=O)NC[C@H]2CCN(C(=O)CO[Si](C)(C)C)[C@H]2c2cccnc2)cc1O	1804895263	IJPDYPUJFRGIAQ-BEFAXECRSA-N	431.569	1.692	50	20	IDGD	
O=C(CNC(=O)C(F)(F)F)N1CCC2(CCCN(C(=O)CCBr)C2)CC1	1809070604	WTCBVVQZOZVDPM-UHFFFAOYSA-N	442.276	1.681	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1CCN(C(=O)CN2CCOC2=O)[C@@H]1c1cccnc1	1810538174	TVFAXFJFPZSIFI-QFBILLFUSA-N	434.569	1.391	50	20	IDGD	
CN1N=C(C(=O)N2CC[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]2c2cccnc2)CCC1=O	1810539722	IKADJEWVZQHUBB-OXJNMPFZSA-N	445.596	1.547	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC2(CCCN(C(=O)c3cccc4[nH]ncc34)C2)CC1	1810587494	KLRZPCILJMWOOQ-UHFFFAOYSA-N	446.316	1.401	50	20	IDGD	
C#CC(=O)NC[C@@H]1CCN(C(=O)CN(C)NC(=O)NCc2ccccc2)[C@@H]1c1cccnc1	1812530669	KBUZXLMTKDLTDZ-NZQKXSOJSA-N	448.527	1.067	50	20	IDGD	
CCC(=O)C(=O)NC[C@@H]1CCN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@@H]1c1cccnc1	1812565708	MRPJYROIOPCDAX-AMZMXHDESA-N	438.488	1.201	50	20	IDGD	
COC(=O)C1(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](C)Br)[C@H]2c2cccnc2)CC1	1812690285	OOUGJYFJKGIXNA-SNPRPXQTSA-N	438.322	1.824	50	20	IDGD	
C[C@@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1)n1ccnc1	1815006652	GHUJKJUVDMQTQR-HOCLYGCPSA-N	430.513	1.233	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](F)Br)[nH]n1)c1cc(O)ncn1	1815359173	PWODHSNZENKBMQ-GXFFZTMASA-N	427.234	1.902	50	20	IDGD	
Cc1noc(CC(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@@H](C)Br)CC3)n1	1815567674	VLJARBJDOHVDII-APPZFPTMSA-N	428.312	1.773	50	20	IDGD	
C[C@](O)(CC(=O)O)CC(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCBr)n[nH]1	1816784227	ARGFOMMTEGIVIH-SJKOYZFVSA-N	445.314	1.803	50	20	IDGD	
Cc1ccnc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2ccc(B(O)O)cc2)CC3)c1	1817469218	LTLOUKYXUXEWCY-HNNXBMFYSA-N	436.302	1.066	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)/C=C/c2cccnc2)[nH]n1)c1cccc(B(O)O)c1	1817474630	WFHWXEYVSMUPGY-XTXLJPNXSA-N	445.288	1.504	50	20	IDGD	
O=C1Nc2c(C(=O)Nc3nc4c(s3)C[C@H](NC(=O)[C@H](O)CCl)CC4)cccc2C1=O	1819342242	WTUWPKBRGGBGHX-PRHODGIISA-N	448.888	1.103	50	20	IDGD	
CCNC(=S)NCC(=O)N[C@H]1CCc2nc(NC(=O)CO[Si](C)(C)C)sc2C1	1820168818	GYFCJSNIJGEGHQ-NSHDSACASA-N	443.671	1.391	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)CCl)CC2)c1cncc2cnccc12	1821208108	KDASQQDBFADHSA-ABAIWWIYSA-N	431.905	1.912	50	20	IDGD	
COc1cc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)ccn1	1822414332	BEDDSWOAVKIJLC-MRXNPFEDSA-N	443.508	1.492	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)C[C@](C)(O)CC(=O)O)n[nH]1	1822415759	XHPKZUHQFRLRFK-FNFWKMNBSA-N	430.889	1.271	50	20	IDGD	
C[C@@]1(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)CC1(F)F	1823393688	KTFNNVFYBNRLIL-BEFAXECRSA-N	432.236	1.441	50	20	IDGD	
C[C@H](NC(=O)c1ccccc1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1	1823503640	WASFVFRNVZYTFW-JQFCIGGWSA-N	447.923	1.820	50	20	IDGD	
CC(C)(C)[C@H](O)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827048947	DMIHCIZTDDTWNA-VQTJNVASSA-N	430.354	1.007	50	20	IDGD	
CC(C)N[C@H](C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2)C(C)C	1830357997	OCCRRYFNHBEXLK-LAUBAEHRSA-N	432.005	1.730	50	20	IDGD	
CC(=O)C(C)(C)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H](C)CBr)CCO2)C1	1830533302	JZVHSURJKPVVLM-SCLBCKFNSA-N	433.343	1.089	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccs3)C2)C1	1830537855	QRIPQLNFLXDKPD-CXAGYDPISA-N	431.352	1.849	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccccn3)C2)C1	1830538432	FTBPOOKVKOJVIK-DNVCBOLYSA-N	440.338	1.112	50	20	IDGD	
CCN(C)[C@@H](C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1	1831073428	KPKSDBVFFFKDTK-OXJNMPFZSA-N	444.580	1.259	50	20	IDGD	
O=C(Cc1cccc2ncccc12)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1831351327	XDJADKWXGBJQCV-TZIWHRDSSA-N	435.883	1.768	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](NC(C)=O)C(C)(C)C)C2)C1	1831639917	GWUSNOGDKLTFIN-FVJLSDCUSA-N	445.988	1.401	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccc(F)cn3)C2)C1	1831645993	HQDYGCYSHZBHHZ-XLIONFOSSA-N	427.904	1.627	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)COC(C)(C)C)CCO2)C1	1832317246	JQEREDKTWHIGLM-KDOFPFPSSA-N	435.359	1.431	50	20	IDGD	
C=CCNC(=O)/C=C\C(=O)NC1CCN(C2CCN(C(=O)[C@H](Cl)CCC)CC2)CC1	1833074660	WXZOCABTQIPVBV-LIXSYLKWSA-N	439.000	1.824	50	20	IDGD	
O=C(CCC(=O)N1CCCC1)NC1CCN(C2CCN(C(=O)[C@@H](F)Cl)CC2)CC1	1833698124	GAXDNPTWWHTWNJ-LJQANCHMSA-N	430.952	1.495	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCBr)C3)C2)c(C)o1	1834089831	BJPOGAJLZQSNIO-GOSISDBHSA-N	429.311	1.751	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc3[nH]ccc3n1)CCO2	1836906145	CFBSEYMNKNDQLZ-NRFANRHFSA-N	446.580	1.484	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc4c(c3)CNC4=O)CCO2)C1	1837147402	LBLSUVDASQOKJO-XMSQKQJNSA-N	449.935	1.408	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(C)cc(F)c3)CCO2)C1	1839285548	DEZDMEPAXJHQRU-XLIONFOSSA-N	428.888	1.458	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(F)c(C)c3)CCO2)C1	1839321752	SBCJIPYEYVWGRS-OXQOHEQNSA-N	428.888	1.458	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C)n(C)c3)C2)C1	1839964180	JKONYAYALVFKQY-VQIMIIECSA-N	442.354	1.577	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](Br)CC)CCO2	1839965515	APYGVCNSNCASEL-WWGRRREGSA-N	425.751	1.634	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(C#N)c[nH]3)C2)C1	1839966001	RICAWWVSCCSEJC-KBXCAEBGSA-N	439.310	1.130	50	20	IDGD	
CCc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)cn1	1840030911	AJSHEHLWMVZDEO-KUHUBIRLSA-N	440.338	1.497	50	20	IDGD	
CCc1ncsc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](Cl)COC)CCO2	1840154005	HVUHAZJJYCMKCE-ACJLOTCBSA-N	431.942	1.029	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](CC(=O)N2CC3(CCCN3C(=O)[C@H](O)CCl)C2)C1	1841347966	GLWNQFOQEASXBC-JKSUJKDBSA-N	443.972	1.827	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](C(=O)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1)C(C)(C)C	1841351088	LONNVANKKMCHAH-ZIAGYGMSSA-N	431.961	1.729	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)Cc1ccc(Cl)c(F)c1)C2	1844263331	SQQLYMSQQIXEJH-UHFFFAOYSA-N	445.882	1.537	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC2(CCCN2C(=O)CN2C(=O)CSC2=S)C1	1847050559	CTUJZNFNAQJBSL-JTQLQIEISA-N	434.381	1.081	50	20	IDGD	
O=C(CCNS(=O)(=O)c1cccc(Cl)c1)NNC(=S)NCCc1cccs1	21125243	AQBIBHQVZLHMRH-UHFFFAOYSA-N	447.007	1.808	50	20	IDGD	
CSc1ncc(C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)n1-c1ccccc1	21782942	CUDQUZOOTYQLGF-UHFFFAOYSA-N	434.481	1.916	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)NC[C@H](c1ccccc1Cl)N1CCOCC1	725872561	YUNSNQUMEFLFRD-MRXNPFEDSA-N	449.895	1.067	50	20	IDGD	
CCn1cc(S(=O)(=O)NNC(=O)[C@@H]2Cc3ccccc3CN2Cc2ccccc2)cn1	727360184	ZKXQXZXLCHHYAC-NRFANRHFSA-N	439.541	1.840	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N2CCCO[C@H](C)C2)cc1	727400028	SNACCCKXZXDBRE-YAJBTMAUSA-N	437.500	1.978	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)c2c(C)oc(C)c2S(N)(=O)=O)c1	728527500	LIGWKVYRJCDILR-UHFFFAOYSA-N	446.279	1.390	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1cccc(OC(F)F)c1)c1cccc(S(N)(=O)=O)c1	728599768	QUNHOHPJDAXOFS-SNVBAGLBSA-N	428.417	1.641	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2cnn(-c3ccc(Cl)cc3)c2)n1	728728834	CVDVCYHFHPPWEV-UHFFFAOYSA-N	433.877	1.838	50	20	IDGD	
N#Cc1cccc(C(=O)NNS(=O)(=O)c2cccc(C(=O)NCC(F)(F)F)c2)c1	728853520	QJSDVLDQVRPNSL-UHFFFAOYSA-N	426.376	1.474	50	20	IDGD	
Cc1cc(C)c(S(=O)(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1C(=O)O	728854113	LXZNEPBYZZHPBV-UHFFFAOYSA-N	433.490	1.018	50	20	IDGD	
CCCC[C@H](/N=C1/NS(=O)(=O)c2ccccc21)C(=O)NNC(=O)Cc1cccnc1	728891911	KFIOCTKZABHNKX-INIZCTEOSA-N	429.502	1.069	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)NCC(=O)N1CCN(c2ccccc2)CC1	729606678	STUHZJJVRXCRET-UHFFFAOYSA-N	434.500	1.321	50	20	IDGD	
CC(=NNC(=O)c1cccc(C#N)c1)c1cccc(N(S(C)(=O)=O)S(C)(=O)=O)c1	729819743	QSTCDOVOVWRSIN-UHFFFAOYSA-N	434.499	1.438	50	20	IDGD	
CC(C)C[C@H](C(=O)NNC(=O)CCc1ccccc1O)N1C(=O)[C@H]2CC=CC[C@@H]2C1=O	730034043	OIYSRVARBQNMPU-OKZBNKHCSA-N	427.501	1.838	50	20	IDGD	
CS(=O)(=O)Nc1ccc(F)cc1C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	730077139	LANYYHDKQGUSJK-UHFFFAOYSA-N	442.494	1.395	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)c1sc(-c2c(C)c(C)nn(C)c2=O)nc1C	731224473	GCJHEYILYPKKHQ-UHFFFAOYSA-N	441.513	1.841	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)CCCCC/N=C1/NS(=O)(=O)c2ccccc21	731494394	QAGBGRBBQUWJBN-UHFFFAOYSA-N	444.513	1.755	50	20	IDGD	
Cc1cc(COc2ccc(C=O)cc2)oc1C(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1	731616347	BQYAKJGUZWNQTH-CQSZACIVSA-N	435.458	1.111	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)NCCN/C(O)=C1\N=CC=CC1=O	732467896	YNDJANGPWBQSAJ-HFGXJBEUSA-N	437.456	1.464	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)N2CCC[C@@H]2C(=O)NNc2nccnc2Cl)o1	734260675	CYMOIXZPULUPFI-SNVBAGLBSA-N	443.869	1.196	50	20	IDGD	
Cc1cc(C(=O)Oc2ccc([N+](=O)[O-])cc2Br)nc2c1c(=O)n(C)c(=O)n2C	739310267	BQSWGIXLLNCHKG-UHFFFAOYSA-N	449.217	1.831	50	20	IDGD	
CSc1ccc(O[C@@H](C)C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1	740813282	BGCJGSPDTTUHPE-JTQLQIEISA-N	443.934	1.938	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccc(C)cc2)c1	740852154	NOBGINIIXJUMPQ-UHFFFAOYSA-N	446.529	1.862	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)/C(C#N)=C\c1cc(C)n(C[C@H]2CCCO2)c1C	740852832	KTHJIWKSQSTPJZ-DPWKNNTCSA-N	429.521	1.643	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@@H]2CCCN(C(=O)NCC(C)C)C2)c2ccccc2c1=O	741207238	KZUSKBTYHIBWKI-OAHLLOKOSA-N	442.520	1.255	50	20	IDGD	
C[C@@H](CC(=O)c1ccccc1F)C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	742472102	XPPSNEYHTBMCBP-ZDUSSCGKSA-N	435.477	1.746	50	20	IDGD	
COc1ccc(OCC(=O)NN[C@H](C(N)=O)c2ccc(Br)cc2F)cc1	743465198	WPWBJEFYFIHWIS-INIZCTEOSA-N	426.242	1.823	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)N[C@@H]2CC(=O)N(CCOc3ccccc3)C2)cc1	743636713	IEKOWCXDSJEWOA-QGZVFWFLSA-N	440.504	1.768	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)N[C@@H]1CC(=O)N([C@@H]2C[C@@H]2c2ccccc2)C1	743702303	OKJWSSHERDIHJZ-KZNAEPCWSA-N	436.468	1.559	50	20	IDGD	
CCOC(Cn1cc(C(=O)NNC(=O)c2cc(Br)ccc2O)nn1)OCC	743730161	QCTRRLOSEQNYNZ-UHFFFAOYSA-N	442.270	1.220	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)[C@@H]2CCCN2C(=O)CC(C)(C)C)cc1OC	748384369	GEHYYRJFEFYZMQ-HNNXBMFYSA-N	449.504	1.435	50	20	IDGD	
O=C(NC[C@@H]1CCN(c2cccc(Br)c2)C1)NNC(=O)C(=O)N1CCCC1	748455853	CREIPEVEURYSMP-ZDUSSCGKSA-N	438.326	1.228	50	20	IDGD	
Cc1cc(S(=O)(=O)NNC(=O)c2nnc(-c3ccccc3)o2)ccc1OCC(=O)O	748691685	OJISZDKRNXSOKL-UHFFFAOYSA-N	432.414	1.132	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCCc1cc(F)cc(F)c1	748831104	PCEKWCMEDRHRSG-UHFFFAOYSA-N	425.461	1.753	50	20	IDGD	
O=C(NNC(=O)C1(C(=O)NC2CC2)CC1)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	749403300	HVDHPSMSSOQVIB-UHFFFAOYSA-N	445.483	1.208	50	20	IDGD	
CC(C)CCN1CCC(CNC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)CC1	751112450	YQWMYYPFFVDKTN-UHFFFAOYSA-N	428.537	1.636	50	20	IDGD	
COCCCNC(=O)NNS(=O)(=O)c1cc(Cl)c(OC)cc1Br	751211739	CYCXXXLAEUVWHU-UHFFFAOYSA-N	430.708	1.640	50	20	IDGD	
CC(C)Cn1[nH]c(CC(=O)NNC(=O)[C@@H](C)Oc2cccc(Br)c2)cc1=O	751443661	PDIFOUULVNIPCG-GFCCVEGCSA-N	439.310	1.752	50	20	IDGD	
Cc1cccc(NS(=O)(=O)c2cc(C(=O)NNC(=O)CO)c(Cl)cc2Cl)c1	753440206	YGDGPTGVXYRYEG-UHFFFAOYSA-N	432.285	1.856	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C)c(C)c(NC(=O)NNC(=O)[C@@H](C)OCCOC)c1	755537233	MKKQIBNGKQJBHQ-OAHLLOKOSA-N	444.554	1.538	50	20	IDGD	
COC(=O)c1ccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1	755829436	WQEMZGQMIFVIQL-UHFFFAOYSA-N	446.485	1.724	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)Nc1cc(Cl)ccc1OC[C@@H]1CCCO1	756207353	QUKRYZOKRXNQGO-YPMHNXCESA-N	431.898	1.485	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)n(C2CCN(C)CC2)n1	756891615	GAVFYEDZDZJXFY-UHFFFAOYSA-N	437.545	1.916	50	20	IDGD	
O=C(Cc1ccn(-c2ccccc2)n1)NNc1ccccc1S(=O)(=O)N1CCOCC1	756954664	NTQUMYOJRDUIOZ-UHFFFAOYSA-N	441.513	1.579	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N[C@H](C)c2cn[nH]c2)cc1	757573396	DANIOWCUXCAIQU-SLVCOGOPSA-N	433.472	1.942	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)N[C@@H]2CN(C)Cc3ccccc32)nc1	757730399	DHLGGRQRLLADPA-GOSISDBHSA-N	432.550	1.925	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2ccn(CC(F)(F)F)n2)cc1	757748644	VOCIWHQGGWSBJZ-UHFFFAOYSA-N	448.427	1.227	50	20	IDGD	
Cn1cc(S(=O)(=O)N2CCCCC2)cc1C(=O)NNc1nc(O)c2ccccc2n1	758310625	HGDWAVAEZVKWFB-UHFFFAOYSA-N	430.490	1.605	50	20	IDGD	
CN(NC(=O)COc1cccc([N+](=O)[O-])c1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758787580	SPBGTGPEKAVCQR-UHFFFAOYSA-N	437.453	1.609	50	20	IDGD	
CS(=O)(=O)c1ccc(CNC(=O)NNC(=O)COCc2ccccc2)cc1Cl	759027535	MAOGYMMLHBZNGG-UHFFFAOYSA-N	425.894	1.791	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NC2CCC(O)(c3ccccc3)CC2)c2ccccc2c1=O	761030853	PKBKSYQODIYLNR-UHFFFAOYSA-N	435.484	1.708	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)c1cc([N+](=O)[O-])ccc1N1CCOCC1	762409116	NLXXASHERVAIKB-UHFFFAOYSA-N	446.485	1.993	50	20	IDGD	
O=C(NNc1nccc(N2CCOCC2)n1)c1cn(-c2ccccc2C(F)(F)F)nn1	762866586	PLOOCTACVORIDT-UHFFFAOYSA-N	434.382	1.670	50	20	IDGD	
CCCCS(=O)(=O)N1CCC[C@H]1C(=O)NNC(=O)c1cc(-c2ccccc2OC)[nH]n1	763154639	QGEFXKMUHPFHOA-KRWDZBQOSA-N	449.533	1.441	50	20	IDGD	
O=C(NNC(=O)c1ccncc1)C(=O)Nc1cc(Cl)ccc1C(=O)N1CCCCC1	763463142	AHOLMZNDYDUGRB-UHFFFAOYSA-N	429.864	1.761	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)c2cccnc2)sc2c1CCSC2	763495505	YHDAVVOPZCIURG-UHFFFAOYSA-N	434.499	1.509	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)C(=O)Nc1cc(N2CCCC2=O)ccc1Cl	763552164	WGOIVYCLQJJFEM-UHFFFAOYSA-N	444.831	1.595	50	20	IDGD	
CC(C)(C)c1ccc(OCC(=O)NNC(=O)C(=O)Nc2cnn(C[C@H]3CCCO3)c2)cc1	763594055	GBJAQAVEOFBFTC-GOSISDBHSA-N	443.504	1.525	50	20	IDGD	
Cc1cc(C)n(-c2ccc(NC(=O)C(=O)NNC(=O)c3cc(-c4ccccc4)[nH]n3)cn2)n1	763606290	XXNVBYQJDOEOEL-UHFFFAOYSA-N	444.455	1.674	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2F)ccc1N1CCOCC1	763683208	WYDJZQNJVFAMQM-UHFFFAOYSA-N	430.436	1.136	50	20	IDGD	
N#CCCSc1ccccc1NC(=O)C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	763920617	ANVGIEAIMLZOJH-UHFFFAOYSA-N	436.457	1.068	50	20	IDGD	
O=C(NNC(=O)c1cccc(C(F)(F)F)c1)C(=O)Nc1cnn(Cc2ccncc2)c1	764037667	SKYXYDWYMTUZHR-UHFFFAOYSA-N	432.362	1.745	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc(OCC(F)(F)C(F)F)nc1	764048311	OIYQCCUZGIVKRR-UHFFFAOYSA-N	444.341	1.769	50	20	IDGD	
CC[C@@H](C)C(=O)NNC(=O)C(=O)Nc1cc(S(=O)(=O)C(F)(F)F)ccc1OC	764081063	CDYWZOSSMAHWAX-MRVPVSSYSA-N	425.385	1.121	50	20	IDGD	
O=C(CC(F)(F)F)NNC(=O)C(=O)Nc1cnc(Br)c(Br)c1	764112653	NKCGRNRKCUUFKS-UHFFFAOYSA-N	447.993	1.645	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(C#N)ccc2OC(F)F)o1	764138831	KVCVVELCYAVKCP-UHFFFAOYSA-N	449.414	1.994	50	20	IDGD	
CS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)CCc2ccco2)cc1Cl	764171764	NFECDSUFTOQEGB-UHFFFAOYSA-N	428.854	1.023	50	20	IDGD	
CCN1CCN(c2ccc(NC(=O)C(=O)NNC(=O)Cc3ccccc3F)cc2)CC1	764318222	DKQBAMMXXWGCOJ-UHFFFAOYSA-N	427.480	1.296	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C(=O)Nc1cc(C(N)=O)ccc1-n1cc(C)cn1)c1ccccc1	764332776	YSWFGQFFXAPUDX-KRWDZBQOSA-N	448.483	1.559	50	20	IDGD	
C[C@@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc3ccccc3)cc2)CCO1	764379785	KMQGODVYKVRUBJ-CQSZACIVSA-N	448.426	1.669	50	20	IDGD	
CS(=O)(=O)[C@@H]1CCCCC1=NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	764841113	QTFPJOIKVQRPNN-LJQANCHMSA-N	440.997	1.917	50	20	IDGD	
C[C@H](CC(=O)NNC(=O)CNC(=O)c1cccnc1)C1CCN(C(=O)OC(C)(C)C)CC1	765510317	UJOCUGMCNMCDIX-OAHLLOKOSA-N	447.536	1.632	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)[C@H]1COc2ccccc2O1	765757966	ZGMLJSSOHMORLH-HXUWFJFHSA-N	444.919	1.445	50	20	IDGD	
O=C(COC(=O)[C@@H]1CC(=O)N(Cc2ccccn2)C1)NNC(=O)c1cccc(Cl)c1	766925207	HPZVXQRRLUVDKQ-CQSZACIVSA-N	430.848	1.088	50	20	IDGD	
O=C(Cc1ccc(F)cc1Cl)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	768291314	PYNRFZRQGNUJMS-UHFFFAOYSA-N	432.883	1.627	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)[C@H]1CCCN(C(=O)c2ccncc2)C1	768630633	VHLICWAAFLIWLG-HNNXBMFYSA-N	432.502	1.489	50	20	IDGD	
CC(=O)N1CCc2c(NC(=O)C(=O)NNC(=O)COc3ccc(Cl)cc3)cccc21	769264848	GZRHLANWNFQJGG-UHFFFAOYSA-N	430.848	1.414	50	20	IDGD	
CCOC(=O)c1nn(C)cc1C=NNC(=O)c1cccc(S(=O)(=O)N(CC)CC)c1	769762151	FOLFRBNBWHSCHU-UHFFFAOYSA-N	435.506	1.391	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)Nc1cc(F)cc(S(N)(=O)=O)c1	770460730	KJRPEMLHIJQLQE-SECBINFHSA-N	430.845	1.747	50	20	IDGD	
CCC1(CC)[C@@H](OC)[C@@H](C)[C@H]1NC(=O)NNC(=O)c1csc(N2CCOCC2)n1	770753845	OACKSPCOUMNZEW-CFVMTHIKSA-N	425.555	1.763	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)CCN3C(=O)[C@H]4CCCC[C@H]4C3=O)nc21	770958845	PWJJUORSTGCICY-TXEJJXNPSA-N	429.481	1.295	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)N2CCC(C(=O)NCCO)CC2)c(C)n1C[C@H]1CCCO1	771768301	HCWDVWICYLCLHQ-NNVROAHOSA-N	428.533	1.538	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1ccc(N(C)S(=O)(=O)c2ccc(C)cc2)cc1	771856479	DTQFKBYTGVZPSO-OAHLLOKOSA-N	447.513	1.923	50	20	IDGD	
CC(C)(C)c1ccc(C(=O)NCC(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)cc1	772194975	FXCTXMVIRAYMCC-UHFFFAOYSA-N	444.919	1.831	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H]2[C@@H]3CCc4ccccc4[C@@H]32)c1	772631111	QZCKUFJJBYINIQ-CEXWTWQISA-N	428.514	1.609	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)C1(c2ccc(F)cc2)CCOCC1	772904459	HZYYLRBYRJIMPM-UHFFFAOYSA-N	433.867	1.991	50	20	IDGD	
CN1C(=O)c2ccc(C(=O)NNC(=O)[C@@H]3CCCN(C(=O)OC(C)(C)C)C3)cc2C1=O	773421570	RKBBUYAZIVSOBQ-CYBMUJFWSA-N	430.461	1.321	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2cccc(-c3ncc4n3CCCC4)c2)CCS(=O)(=O)C1	773644265	IUHFUZITWGZXCJ-FQEVSTJZSA-N	431.518	1.023	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)NCCOc1ccc(NS(C)(=O)=O)cc1)c1ccccc1	773778113	CZRHHGSCMYARRD-SFHVURJKSA-N	434.518	1.961	50	20	IDGD	
Cc1c(/C=C(\C#N)C(=O)NCCOc2ccc(NS(C)(=O)=O)cc2)cc(C#N)n1C	774009068	MAYCODIONGHICO-MHWRWJLKSA-N	427.486	1.679	50	20	IDGD	
COc1cc(NC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)cc(OC)c1	775402513	DXKFZCAJGRRPJN-UHFFFAOYSA-N	449.533	1.789	50	20	IDGD	
Cc1sc2ncc(C(=O)NNc3nc(Br)cn4ccnc34)c(=O)n2c1C	776232878	XYCLPIGCWWOFLW-UHFFFAOYSA-N	434.279	1.935	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(OCC(=O)NNC(=O)COc2ccc(F)cc2)CC1	777231410	VJUWVQONVRNMRU-UHFFFAOYSA-N	425.457	1.768	50	20	IDGD	
COc1ccc(Cn2cc(C(=O)NNC(=O)Cc3cn4ccccc4n3)cn2)cc1OC	777709061	HUTKKGXJYSNZMR-UHFFFAOYSA-N	434.456	1.600	50	20	IDGD	
C[C@@H]1CCN(C(=O)OC(C)(C)C)[C@H](C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)C1	778725540	SZOBUWMWIWVFQW-WBVHZDCISA-N	446.552	1.876	50	20	IDGD	
NC(=O)c1ccc(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2Br)c(F)c1	778759653	LHORHZCLIFGWOK-UHFFFAOYSA-N	440.185	1.677	50	20	IDGD	
Nc1nc(Cl)cc(NNC(=O)CCNC(=O)c2cc(F)ccc2Br)n1	779373362	HUIBOGGVKHFOII-UHFFFAOYSA-N	431.653	1.877	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N2CC(n3ccnn3)C2)cc1	779552666	QJXZHVWDXFHTSC-MHWRWJLKSA-N	446.471	1.016	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)n(-c2ccccc2)n1	782893905	OPZFAAZITWLOKV-UHFFFAOYSA-N	431.456	1.396	50	20	IDGD	
CNS(=O)(=O)c1cc(NC(=O)C(=O)NNc2ccc(Br)cc2)ccc1C	783004833	NFXSHZXFSQRVNG-UHFFFAOYSA-N	441.307	1.747	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NN=Cc3cn(Cc4cccnc4)nn3)n[nH]2)cc1OC	783856569	ZUPANWRZLMPTRU-UHFFFAOYSA-N	432.444	1.893	50	20	IDGD	
Cc1c(NNC(=O)C(=O)Nc2ccc(C(=O)N3CCN(C)CC3)cc2)cccc1[N+](=O)[O-]	784357547	BUBKNOKDJFCJRU-UHFFFAOYSA-N	440.460	1.373	50	20	IDGD	
COC(=O)CCc1cccc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c1	786416100	AWMXMWQFTZTGGT-UHFFFAOYSA-N	435.440	1.378	50	20	IDGD	
CNS(=O)(=O)c1cccc(NC(=O)[C@H](C)NC(=O)/C(C#N)=C/c2ccc(O)cc2)c1	787330463	YYFJTLFBKOLLRI-LERPTODRSA-N	428.470	1.351	50	20	IDGD	
O=C(CCC(=O)N1CCN(c2ncccn2)CC1)NNC(=O)NCc1ccc(Cl)cc1	787435800	AKMBUBGJUYVWDO-UHFFFAOYSA-N	445.911	1.089	50	20	IDGD	
CCCCCn1nc(C(=O)NNS(=O)(=O)c2ccc(C)nc2)c2ccccc2c1=O	788140386	WUVVEPBGGDNVHU-UHFFFAOYSA-N	429.502	1.913	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccc(Cl)c(S(C)(=O)=O)c2)c1	788302334	WAMCKDTUHVDTEY-UHFFFAOYSA-N	445.906	1.614	50	20	IDGD	
Cc1ccc(-n2cccn2)cc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccccc2)[nH]n1	789585889	FZXIFRQXGJVVPO-UHFFFAOYSA-N	429.440	1.971	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)ccc1O)C(=O)Nc1nc2c(s1)CCC2	789734182	FNGLALGDIOPDPV-UHFFFAOYSA-N	425.264	1.500	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)c(F)cc1F	789810878	SEWVMXBSGWQFCP-SJCJKPOMSA-N	447.394	1.410	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCN(CC(F)(F)F)C1)c1cccc(S(=O)(=O)N2CCCC2)c1	791446010	LCFQCMUZBLQHKM-CQSZACIVSA-N	448.467	1.116	50	20	IDGD	
CS(=O)(=O)CCn1cccc(NC(=O)C(=O)NNc2cc(Cl)cc(Cl)c2)c1=O	792435687	UJLMJEXCRPOBPF-UHFFFAOYSA-N	447.300	1.282	50	20	IDGD	
Cn1cncc1CCC(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	792804894	YPSVVTJESMFRRW-UHFFFAOYSA-N	430.468	1.572	50	20	IDGD	
CC(C)c1ccc(-n2cnnc2SCC(=O)N([C@H]2CCS(=O)(=O)C2)N(C)C)cc1	792853457	DTFGJLUCUWFQKT-KRWDZBQOSA-N	437.591	1.975	50	20	IDGD	
CC(C)(C)c1ccc(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1[N+](=O)[O-]	793023113	HOVSOQFUIMXVNF-QGZVFWFLSA-N	442.428	1.818	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2cccc(C)n2)c(Br)cc1F	794599901	UAFOOIDKIFZOCQ-UHFFFAOYSA-N	446.254	1.702	50	20	IDGD	
CCOC(=O)c1ccc(NNC(=O)Cc2c(C)nn(-c3cncc4nnnn34)c2C)cc1C	794646171	INMHIXYHKODIHM-UHFFFAOYSA-N	449.475	1.493	50	20	IDGD	
Cc1cnc(COCC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)o1	794742609	UCTWKWFHPHLAKR-UHFFFAOYSA-N	436.490	1.135	50	20	IDGD	
CCCn1nc(C(=O)NNS(=O)(=O)c2ccc(C(=O)O)c(C)c2)c2ccccc2c1=O	795280860	UOSVLZKCDGZMBT-UHFFFAOYSA-N	444.469	1.436	50	20	IDGD	
COC(=O)c1cc(F)cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)c1F	796990725	WMQVACBVAPOWDF-LBPRGKRZSA-N	449.410	1.922	50	20	IDGD	
CC(C)(C(=O)NNC(=O)Nc1cc(S(=O)(=O)N2CCCC2)ccn1)c1ccccc1	797673877	NLCOOJBEZLGECE-UHFFFAOYSA-N	431.518	1.997	50	20	IDGD	
CN(C)Cc1cc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)ccc1Cl	799259343	UGPBCLVCNFOZNO-UHFFFAOYSA-N	436.921	1.985	50	20	IDGD	
CCn1ncc2cc(C(=O)NNC(=O)c3sc(N4CCOCC4)nc3C)c(C)nc21	799408264	RDINGYHLHYCODY-UHFFFAOYSA-N	429.506	1.436	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])c(C)c(OC)c1	800621827	ANBCYDFEJZYYOM-UHFFFAOYSA-N	432.389	1.085	50	20	IDGD	
O=C(CCNS(=O)(=O)c1cccc(Br)c1)NNC(=O)Nc1ccccc1	801986075	VVPADAKYFMYTDY-UHFFFAOYSA-N	441.307	1.970	50	20	IDGD	
CCCN(NC(=O)c1ccc(S(=O)(=O)N2CCOCC2)cc1)C(=O)OC(C)(C)C	804594710	NVMCADGXYHEBJM-UHFFFAOYSA-N	427.523	1.999	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)c1ccc2ncc(I)n2c1	804957757	AIIGVCOTMIOXNU-UHFFFAOYSA-N	446.212	1.672	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNc2nccnc2C2CCC2)sc1Br	805460214	GKKHPZMKUKZOKK-UHFFFAOYSA-N	432.325	1.972	50	20	IDGD	
C[C@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(NC(=O)C(=O)NNc3ncccc3F)cc2)C1	807301221	BFBWTNPWDYNIFB-OKILXGFUSA-N	449.508	1.969	50	20	IDGD	
COC[C@@]1(C(=O)NNC(=O)c2cc(Br)c[nH]2)CCN(C(=O)OC(C)(C)C)C1	809973292	XCZDQRDSWUSPPM-QGZVFWFLSA-N	445.314	1.812	50	20	IDGD	
CC(=O)N1C[C@@H]2CCC[C@H](NC(=O)NNc3nc(O)c4cnn(C(C)(C)C)c4n3)[C@H]2C1	812434770	UCVZCSWMBBZDKL-QEJZJMRPSA-N	430.513	1.560	50	20	IDGD	
CCn1nnnc1-c1cccc(NC(=O)NNc2ccccc2S(=O)(=O)N(C)C)c1	814645198	PVGGNGYBNWLZTL-UHFFFAOYSA-N	430.494	1.759	50	20	IDGD	
O=C(NN=Cc1cc(Cl)c(F)cc1O)c1cccc(S(=O)(=O)N2CCOCC2)c1	814689193	WTAUEDIADRMRER-UHFFFAOYSA-N	441.868	1.970	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)C(=O)Nc1ccc([C@@H]2CCOC2)cc1	815595137	IOQDLAHSKBBSFF-OAHLLOKOSA-N	444.513	1.713	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)c2ccc3[nH]c(=O)c(=O)[nH]c3c2)c1	818745303	GYPITHOEKMWOOX-UHFFFAOYSA-N	433.218	1.522	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc2ccccc2c1)NNC(=S)NCCc1cccs1	838822787	PIWWERZVEMUFDH-UHFFFAOYSA-N	448.595	1.918	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)c2ccc(-n3cncn3)nc2)cc(OCC)c1OCC	861772082	QVPZBSRZXXJJTI-UHFFFAOYSA-N	440.460	1.933	50	20	IDGD	
O=C(CCC(=O)c1ccc2c(c1)OCCO2)NNC(=O)c1csc(N2CCOCC2)n1	912852417	URPYFVIYUJKFBQ-UHFFFAOYSA-N	446.485	1.175	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCCCOCc1ccccc1	913638516	UYOWIGXWGZZZLU-UHFFFAOYSA-N	433.534	1.839	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCc2ccc(N3CCCC3)nc2)cc(OC)c1OC	914545022	VXMXUNVZZLWAEU-UHFFFAOYSA-N	429.477	1.852	50	20	IDGD	
COc1cccc(NCC(=O)NN=C2CCN(S(=O)(=O)c3c(C)n[nH]c3C)CC2)c1	914555025	GNZJNYMNSDTHIE-UHFFFAOYSA-N	434.522	1.404	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(N3CCOC3=O)cc2)cc1OC	915510562	KWWJPDUVSBRQMW-UHFFFAOYSA-N	443.412	1.278	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNS(=O)(=O)c2ccc([N+](=O)[O-])cc2OC)cc1	917724072	SJWGWFMNBSAMEZ-LBPRGKRZSA-N	439.446	1.779	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)NCc1ccc(CN2CCCC2=O)cc1	918124714	ABFUNYLXLZJFJL-UHFFFAOYSA-N	426.473	1.727	50	20	IDGD	
C[C@@H](Oc1ccc2c(c1)CCC2)C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	918203568	BJIJTWRCSIRMKG-LLVKDONJSA-N	437.905	1.705	50	20	IDGD	
CSCC[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)NNC(=O)NCC(F)(F)F	918707207	GQOYVGYTKOHQLO-LLVKDONJSA-N	437.400	1.339	50	20	IDGD	
O=C(CCCOc1ccccc1Br)NNC(=O)N[C@@H]1CCS(=O)(=O)C1	919886657	SZRMJFTXNQMNJZ-LLVKDONJSA-N	434.312	1.126	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)NCc1ccc(S(=O)(=O)N2CCCC2)cc1	919906866	INDZSXYMZWOGCK-UHFFFAOYSA-N	446.529	1.553	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2cn(C)nc2-c2ccncc2)c2ccccc2c1=O	920254932	SNVSQXGCNSPQBW-UHFFFAOYSA-N	431.456	1.677	50	20	IDGD	
COc1cc(C=NNC(=O)N[C@H]2CCS(=O)(=O)C2)ccc1OCc1c(C)noc1C	920384237	JQTIGKUKVYGDMP-HNNXBMFYSA-N	436.490	1.699	50	20	IDGD	
N#C/C(=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)N1CCC(O)CC1	920853301	MZQNUPMSFGJUKK-PTNGSMBKSA-N	427.892	1.969	50	20	IDGD	
COC(=O)[C@@H]1CS(=O)(=O)CCN1C(=O)/C(C#N)=C\c1cc(C)n(CCC(C)C)c1C	1120800335	YFBZPCOBIGAUJJ-LOHYDARVSA-N	435.546	1.857	50	20	IDGD	
COc1ccc2[nH]c(C)c(C(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)c2c1	1319358354	NXUTVQQYMQVUNV-UHFFFAOYSA-N	430.486	1.810	50	20	IDGD	
CSc1nc(O)nc(C)c1C(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1	1322473032	QNKUEUBHEKJGBV-UHFFFAOYSA-N	425.511	1.621	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)N[C@@H]1CCO[C@]2(CCS(=O)(=O)C2)C1	1324924267	NMTCVEYGCDOXNO-SJKOYZFVSA-N	431.898	1.029	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc3cccnn3n2)C1	1779994102	OSSZXVDRVUDIDO-WRWLIDTKSA-N	435.912	1.111	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnc4snnc4c3)C2)C1	1780071811	PLECVNSKRDLWRU-IRXDYDNUSA-N	444.344	1.766	50	20	IDGD	
CCOCC(=O)N1CCO[C@]2(CCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1	1780096822	HJVXQYYSPAZYCN-HXUWFJFHSA-N	435.433	1.000	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnc3c(c1)CCNCC3)C2	1780708010	PNNQZJKODSGLOZ-JXHRLWIKSA-N	448.995	1.915	50	20	IDGD	
Cc1nc2ncccn2c1C(=O)N1CCO[C@@]2(CCN(C(=O)[C@](C)(Cl)CCl)C2)C1	1781229295	FYILOIQNWJEMQP-MOPGFXCFSA-N	440.331	1.718	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)Cc3ccc(F)c(C#N)c3)C2)C1	1781300272	PNGTVRVNHPQQEW-BFUOFWGJSA-N	438.297	1.853	50	20	IDGD	
COc1ccc2[nH]cc(/C=C/C(=O)N3CC[C@]4(C3)CN(C(=O)[C@H](O)CCl)CCO4)c2c1	1781389124	XECIZNKXKZRBTJ-NNVWVVBJSA-N	447.919	1.619	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3c(O)cc(O)cc3O)C2)C1	1781818607	NAXRWXOARDBYIO-SGTLLEGYSA-N	443.294	1.420	50	20	IDGD	
CCC[C@H](NC(C)=O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](Cl)COC)C1	1782177704	ABGANNVRCUZQKW-AXVVYFOYSA-N	431.961	1.059	50	20	IDGD	
CCOC(=O)C(C)(C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](Cl)COC)C1	1782178254	JQSRCPSGMCMNEF-BXTJHSDWSA-N	432.945	1.343	50	20	IDGD	
O=C(c1nc2cc([N+](=O)[O-])ccc2[nH]1)N1CC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1782183781	LCRISHYPRLUHHW-QGZVFWFLSA-N	442.259	1.718	50	20	IDGD	
O=C(Nc1cccnc1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C(Cl)Cl)C1	1782218040	MYORKNNPSTVQOU-FZKQIMNGSA-N	429.304	1.338	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(CCN(C(=O)c3cn4c(F)cccc4n3)C2)C1	1782368887	NATXVNKIYGZWQQ-SFHVURJKSA-N	439.285	1.702	50	20	IDGD	
COc1cc(OC)cc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](C)Br)C3)C2)c1	1783538809	XPPHEYSQNFFKBU-BFUOFWGJSA-N	441.322	1.931	50	20	IDGD	
CC(C)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CC[C@@H]4CCC(=O)N4C3)C[C@@H]21	1783851745	GOFWBXMFDXOMFP-WKULXVSPSA-N	439.984	1.632	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)CCc3cncc(OC)c3)CCO2)C1	1783873822	VGVFZETUVXAMCA-PXNSSMCTSA-N	425.913	1.107	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)CCc3cnc4[nH]ccc4c3)CCO2)C1	1783879180	PHOQGYRLIAYTRF-LAUBAEHRSA-N	434.924	1.579	50	20	IDGD	
C#CCCCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2	1783903385	ROLFWZGMACQRTE-KKSFZXQISA-N	441.956	1.752	50	20	IDGD	
COc1ccc2oc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]4C3)cc2c1	1784093482	WKYMDDYMCDSVGM-XJTZBENFSA-N	436.892	1.634	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)Cc3ccc(C)o3)C2)C1	1784660999	QPXZXZXEWYBSLO-ZHNJOBQTSA-N	441.488	1.094	50	20	IDGD	
O=C(Cc1cccc(Cl)n1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21	1785430848	PZXVWIIGCVAAQN-RKOGSIPDSA-N	448.720	1.948	50	20	IDGD	
Cc1nccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)CBr)C[C@@H]32)n1	1787691069	WJCIDPLMCKFMMD-DSRCVFDASA-N	425.327	1.409	50	20	IDGD	
CN[C@H](CC(=O)Nc1ccc(C2(NC(=O)CCBr)CCC2)cc1)C(=O)O	1788060753	DEMLDZSPCNJUIR-CQSZACIVSA-N	426.311	1.968	50	20	IDGD	
CC(=O)N(C)[C@@H](C)C(=O)Nc1ccc(C2(NC(=O)CCC(=O)NN(C)C)CCC2)cc1	1788658092	CAOLXLKAYJMUND-HNNXBMFYSA-N	431.537	1.360	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnn4ncccc34)C[C@@H]21	1788765216	VMQAZFAZQVJTBM-ZVZYQTTQSA-N	431.569	1.174	50	20	IDGD	
Cc1ccc(CCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]3C2)cn1	1789922107	HGYASCRHQXBSNN-NBOOPKSLSA-N	442.329	1.993	50	20	IDGD	
C[C@@H](Cn1ccnc1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]2C1	1791064705	FCUJWWWSCUSCSF-QRJUGERDSA-N	427.343	1.282	50	20	IDGD	
CCOC(CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]2C1)OCC	1791065462	XYGGFMZRLICSAN-QPSCCSFWSA-N	435.359	1.539	50	20	IDGD	
COC(=O)c1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]3C2)cn1	1791295354	ACNJSTSUIJBLJG-OBJOEFQTSA-N	430.288	1.265	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3cn[nH]c3cn1)C2	1792870759	KRQBRJGBPIFSAQ-YGSHXTJESA-N	436.310	1.192	50	20	IDGD	
Cc1cc(C(=O)NCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](C)CBr)no1	1792987168	KRDYTTUDEFWBQF-RUZUBIRVSA-N	441.326	1.382	50	20	IDGD	
O=C(CCS(=O)(=O)c1ccccc1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCl	1793110854	ZFMIBGXFWXTCLC-IVSAIRAKSA-N	428.938	1.088	50	20	IDGD	
O=C(CCCN1C(=O)c2ccccc2C1=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCl	1793110905	RCWYWYTWFOWHJY-KRXQYRFLSA-N	447.919	1.301	50	20	IDGD	
C[C@@H](NC(=O)c1ccc(F)cc1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCl	1793115781	XUUSUGGEKPTJMW-UFRBAHOGSA-N	425.888	1.182	50	20	IDGD	
CC(=O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C#N)=C/c1ccc(Br)cc1)C2	1795063142	RDJQMHHHHXTRSP-BXOWQRHZSA-N	446.301	1.535	50	20	IDGD	
N#Cc1ccc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCBr)cc1	1795113635	GMPRACBGYORIJP-XEMDLRDOSA-N	434.334	1.865	50	20	IDGD	
COc1cccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCBr)c1F	1795116853	AIWDDQGFPBQUGA-DPIQGUFMSA-N	429.286	1.823	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cn2ccccc2n1	1796830943	MYDJBQXJXOBDRL-AODNKKSCSA-N	425.316	1.774	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cn2c(Cl)cccc2n1	1796854429	IXUGLAVDVIYQTN-LKQDWFRTSA-N	441.315	1.445	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(-c2ccncc2)[nH]n1	1798149847	SBDJUDSGSHXKFX-DPYKFYPSSA-N	448.321	1.458	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1ccc(O)c([N+](=O)[O-])c1	1799483295	HKTUZROVGSOHJT-DJBIQUGXSA-N	446.229	1.194	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)[C@H]1CCc2cccc(Cl)c21	1800325463	CDBYIWFAPYPTBU-TWTQLAGVSA-N	427.328	1.559	50	20	IDGD	
COC(=O)[C@H]1CC=CC[C@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CO[Si](C)(C)C)C2	1800955810	UHUDLTWPFRIYMU-OYNZLANYSA-N	438.597	1.183	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1C[C@@H]1c1ccc(OC)cc1)C2	1800971304	VERGOGCAKNLSJK-QBUATURESA-N	436.936	1.642	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc(SC)cc1)C2	1800980537	CNLJBZNUXHNHIO-LORHWOILSA-N	426.966	1.794	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cn3c(Cl)cccc3n1)C2)C(Cl)Cl	1801014890	RBFOLPTWOXRDPU-WDAIWFPHSA-N	431.707	1.995	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1ccccc1O	1801718325	PSALHYKCGXGEPF-DHMPJCMBSA-N	437.500	1.707	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc(C#N)c1Cl)C2	1802336407	MXFKDQJKAPCWOF-MUJYYYPQSA-N	431.924	1.836	50	20	IDGD	
O=C(CN1CCCC1)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@H]1c1cccnc1	1802555652	LJKLNWCDGAYVEB-XIRDDKMYSA-N	427.318	1.874	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H]2Cc3ccccc3N2)[C@H]1c1cccnc1)[C@H](O)CCl	1803148642	VUMSNSTYJYCXDN-FFGOWVMKSA-N	428.920	1.724	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H](CNC(=O)[C@@H]2CNC(=O)O2)[C@H]1c1cccnc1	1803642866	NYDQKNOYANMQPC-REBRKWNGSA-N	439.310	1.227	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)CSC1=S	1804336382	SFDATWKGEDAMBC-WRWGMCAJSA-N	448.408	1.658	50	20	IDGD	
O=C(CCN1C(=O)C=CC1=O)N1CCCC2(CCN(C(=O)[C@H](F)Br)CC2)C1	1806385443	FAYNMBYJGXXTCT-INIZCTEOSA-N	444.301	1.223	50	20	IDGD	
O=C(COCc1ccccc1)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1	1806874389	PUWQUQPVEOMVEC-QKNQBKEWSA-N	431.920	1.904	50	20	IDGD	
O=C(CC12CCCN1CCC2)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1	1808020708	BEMKTLXTVAIEBO-BJLQDIEVSA-N	434.968	1.706	50	20	IDGD	
CCOC(=O)/C=C/C(=O)N1CC[C@H](CNC(=O)[C@@H](F)Br)[C@@H]1c1cccnc1	1808662377	YXQBBJNAUMQYGC-UHVFYLGFSA-N	442.285	1.897	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC2(CCCN(C(=O)CN3CCOCC3)C2)CC1	1809540030	JFOGPWQKIHQOCO-MRXNPFEDSA-N	430.387	1.581	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)CN2CCN(C(C)=O)CC2)[C@@H]1c1cccnc1	1809670476	KRMUPHBMQYXPSB-ZJOUEHCJSA-N	449.983	1.269	50	20	IDGD	
Cn1cc(C(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@H]2c2cccnc2)c2cccnc21	1810081692	QCSRBAONLONNAN-IPELMVKDSA-N	441.919	1.888	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)c2cnnn2C)[C@@H]1c1cccnc1	1812773211	AYHQJBBDJFMKJY-IJEWVQPXSA-N	435.326	1.703	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)[C@H]2CC[C@H](O)CC2)[C@@H]1c1cccnc1	1813189924	BKAAIJPPXKEIDI-FUOQNJDISA-N	445.564	1.012	50	20	IDGD	
Cc1ncc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)s1	1815356762	QRGPEWNDBXYOGE-ZDUSSCGKSA-N	442.331	1.127	50	20	IDGD	
COC[C@@H](NC(C)=O)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCBr)n[nH]1	1816782744	YRSRTOZCEPMTHZ-KGLIPLIRSA-N	444.330	1.338	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@](C)(Cl)CCl)CC2	1817020625	BKPQYKHOEOYTAR-BEPCFFQHSA-N	436.365	1.738	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)ccn1	1817472168	MIYRGXGNNWQCRJ-IBGZPJMESA-N	433.277	1.413	50	20	IDGD	
CS(=O)(=O)N1CCC(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)[C@@H](F)Cl)n[nH]2)CC1	1818039062	JGNPLWPQJLCGBE-UKRRQHHQSA-N	449.936	1.608	50	20	IDGD	
CCC(=O)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)n[nH]1	1818113302	JKJWVOVFQNEPNI-AQXNZCSYSA-N	427.465	1.515	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc4c(c3)CNC4=O)sc2C1	1819373576	FEJMLEPIRZFGMK-OCCSQVGLSA-N	448.932	1.866	50	20	IDGD	
C[C@H](Br)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H]2CCCS2(=O)=O)[nH]n1	1822188448	JOZKJODDYHCERF-WCFLWFBJSA-N	447.355	1.762	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCc2cn[nH]c2)[nH]n1	1822410728	ROPVTNGWVIUAMX-INIZCTEOSA-N	430.513	1.131	50	20	IDGD	
Cn1cc2cc(C(=O)Nc3nc4c(s3)C[C@@H](NC(=O)[C@H](O)CCl)CC4)ccc2n1	1823949499	PUJZCIOTHISCTD-SWLSCSKDSA-N	433.921	1.855	50	20	IDGD	
COC1(CC(=O)N[C@@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)CCC1	1826092128	NBUQHVNIWYVJGL-CYBMUJFWSA-N	437.566	1.387	50	20	IDGD	
O=C(CSc1nc[nH]n1)Nc1nc2c(s1)C[C@H](NC(=O)CCBr)CC2	1826667498	QTXCNBSJKFYNTD-MRVPVSSYSA-N	445.368	1.751	50	20	IDGD	
Cc1ccc(CC(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)o1	1827054967	NFUVOUGOZLJMEX-QFIPXVFZSA-N	438.333	1.744	50	20	IDGD	
CSCC(C)(C)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827055830	LKZKWHXTROJESB-HXUWFJFHSA-N	446.422	1.989	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)[C@H]3CCCS3)sc2C1	1827297829	NCTQFYFYCXEXIL-WCQYABFASA-N	425.580	1.324	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H](N)CCC(N)=O)CC1	1829102055	GHNJVIOFZUXANK-DLBZAZTESA-N	426.634	1.050	50	20	IDGD	
Cc1ccc(F)cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)Br)C2)C1	1830079600	NLXBFOXOEIRJGY-AUUYWEPGSA-N	443.313	1.988	50	20	IDGD	
Cc1cc(C)n(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)n1	1830358106	LSZPZOSSMWADIM-HXUWFJFHSA-N	426.945	1.221	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1C[C@@H]1C1CC1)CCO2	1830490381	TVOOTHZKSGEBIF-RGPZOAQRSA-N	429.355	1.520	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3ccnc(OC)c3)CCO2)C1	1832595961	MHTSZSHXGCGWDT-UWJYYQICSA-N	439.940	1.497	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)[C@H]3CCCS3(=O)=O)CC2)CC1	1833534647	JYRJOLYZURFKMR-ZWKOTPCHSA-N	448.029	1.543	50	20	IDGD	
C=CCO[C@@H](C)C(=O)N1CCC(N2CCC(NC(=O)CCBr)CC2)CC1	1834422272	AQDKJBYAUHLVFM-HNNXBMFYSA-N	430.387	1.934	50	20	IDGD	
COc1ncc(C(=O)N2CCO[C@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)cc1C	1834575643	YBMNUVUACQQDKX-OAQYLSRUSA-N	439.940	1.734	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3ccc[nH]3)CCO2)C1	1836016062	VGLJSIWKZADCGV-MOPGFXCFSA-N	432.348	1.640	50	20	IDGD	
Cc1nc2ccncc2cc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1836837540	RYHGMZPKIQYSEL-FXAWDEMLSA-N	436.871	1.543	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3n[nH]c4ccc(F)cc34)CCO2)C1	1837043039	OXVVOWRXMOYLDX-QRWLVFNGSA-N	438.887	1.789	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCCCn3cccc3)CCO2)C1	1837623077	CYDZWZHMRFAIGW-NQIIRXRSSA-N	441.956	1.369	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4cccnn4c3)C2)C1	1837715950	SVJHXHUBNPDYFK-OAQYLSRUSA-N	446.580	1.256	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ncccc1F)CCO2	1838249402	UZYHJURCIVULLG-IBGZPJMESA-N	425.533	1.142	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)c(C)n1	1838363869	RENGDBOAISYZRE-MAUKXSAKSA-N	444.301	1.459	50	20	IDGD	
CC(=O)N/C(C)=C/C(=O)N1CCC(OC2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1838649085	WVZGMURQEHKSKL-FMQWLBJXSA-N	448.333	1.715	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3c(OC)cccc3OC)CCO2)C1	1838882506	JAALYMNEFKYWEF-VFNWGFHPSA-N	440.924	1.791	50	20	IDGD	
CCOc1ccccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](Cl)COC)C2)C1	1838886500	ZXDBQRNJOJPDJP-UTKZUKDTSA-N	440.924	1.409	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](NC(C)=O)C(C)(C)C)C2)C1	1839141706	QJZHIXJFJJBESK-TWOQFEAHSA-N	431.961	1.011	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)CCO2)C1	1839414652	USPWNPBFZMFHFA-QFBILLFUSA-N	441.868	1.388	50	20	IDGD	
Cc1cc(F)ccc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2	1840036015	CIMSQONSFGOMHB-AUUYWEPGSA-N	443.313	1.988	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3nccc4occc34)C2)C1	1840151993	TVADFSJBLYMWEF-QRWLVFNGSA-N	437.880	1.152	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccc(O)cn3)CCO2)C1	1840494862	XAYCXULENRBPMM-PXNSSMCTSA-N	425.913	1.194	50	20	IDGD	
COc1ccnc(C(=O)N2CC3(CCCN3C(=O)[C@H](C)CBr)C2)c1OC	1841288496	XUJGVICDIXOLJO-GFCCVEGCSA-N	426.311	1.947	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](CC(=O)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1)C1CC1	1841348519	VGDUZNXMXMNFFN-HUUCEWRRSA-N	429.945	1.483	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H](F)C[C@H]1C(=O)N1CCCC12CN(C(=O)[C@H](O)CCl)C2	1843818785	VIFOMEQJZWRUBJ-HZSPNIEDSA-N	433.908	1.137	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)c2cncc(C(F)(F)F)c2)C1	1844546155	ADCXWIMHTSTWOA-UHFFFAOYSA-N	427.427	1.290	50	20	IDGD	
CCOC(=O)N(CC(=O)N1CC2(CCCN2C(=O)[C@@H](Cl)COC)C1)Cc1ccco1	1846365179	DJIXPLNYZBGFDU-INIZCTEOSA-N	441.912	1.695	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@](C)(C(=O)N2CCCC23CN(C(=O)[C@@H](O)CCl)C3)C1	1847015936	ABGTVLOJUFYTNC-YWZLYKJASA-N	443.972	1.827	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@H](O)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@](C)(Cl)CCl	1847512626	QYXIQWBOZPRISB-RSLFNQERSA-N	438.352	1.310	50	20	IDGD	
COc1ccc(CC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2cnccc2C(=O)NN)cc1C	1847972721	XAYKQRITCNKRQE-OALUTQOASA-N	437.500	1.060	50	20	IDGD	
O=C(COC(=O)c1cc([N+](=O)[O-])ccc1Cl)NNC(=O)[C@@H]1COc2ccccc2O1	10665220	IICSNVXJNSQRAU-HNNXBMFYSA-N	435.776	1.392	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1OC	15314551	FCDTYRJXJQNGRL-UHFFFAOYSA-N	440.544	1.996	50	20	IDGD	
CC(C)n1nc(C(=O)NNS(=O)(=O)c2ccc3c(c2)OCCO3)c2ccccc2c1=O	16095353	XSDFEMOYLXAYAY-UHFFFAOYSA-N	444.469	1.372	50	20	IDGD	
C#CCNS(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(OCC)c(OC)c2)c1	16201373	PRJRBASVMJBFIJ-UHFFFAOYSA-N	431.470	1.080	50	20	IDGD	
O=C(COC(=O)c1cccc(N2CCCC2=O)c1)NNC(=O)c1cccc([N+](=O)[O-])c1	19480826	YZRNOWXENLJJSL-UHFFFAOYSA-N	426.385	1.340	50	20	IDGD	
CCn1c(=O)c2ccccc2n(CC(=O)NNC(=O)c2ccc(Cl)cc2OC)c1=O	21027902	MOXUGBFYSVBCEQ-UHFFFAOYSA-N	430.848	1.306	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1	21290927	HPIILSPLQPCYTH-UHFFFAOYSA-N	449.496	1.429	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)c1ccc(Cl)c(N2CCCC2=O)c1	21967568	MPDAIEQMEDTBCM-UHFFFAOYSA-N	449.920	1.835	50	20	IDGD	
O=C(NNC(=O)c1sccc1S(=O)(=O)N1CCCC1)c1cc(-c2ccccc2)n[nH]1	25323198	HGWWARNRVYZZPM-UHFFFAOYSA-N	445.526	1.998	50	20	IDGD	
CCNS(=O)(=O)c1ccc(C(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)cc1	26012150	FYQGRIVPTUVALX-UHFFFAOYSA-N	439.877	1.256	50	20	IDGD	
O=C(CCCc1ccccc1)NNC(=O)NCCNS(=O)(=O)c1cccc([N+](=O)[O-])c1	727845790	YNHAJDIAGTYNIK-UHFFFAOYSA-N	449.489	1.226	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1cccc(C(F)F)c1	729166174	OPAGTCJXIWWTEU-UHFFFAOYSA-N	439.440	1.720	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)NC[C@H](c1ccccc1Cl)N1CCOCC1	730820391	HGGSKYWNBMXICL-QGZVFWFLSA-N	448.907	1.828	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(C(=O)CNC(=O)NNC(=O)C(C)(C)c2ccccc2)CC1	731222630	QAFUOCSWQIXDJF-UHFFFAOYSA-N	447.536	1.374	50	20	IDGD	
CSCC[C@H](C(=O)NNC(=O)Cc1ccccc1F)N1C(=O)[C@@H]2CCCC[C@H]2C1=O	731329502	UKPABIISMHMHMC-BFYDXBDKSA-N	435.521	1.813	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N(C)Cc2ncc[nH]2)cc1	732092399	DMOFQISJFHWNHA-WJDWOHSUSA-N	433.472	1.723	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)N1CCN(S(=O)(=O)c2ccc3c(c2)CCC3)CC1	732197774	ZNEAFEFNYVBMGX-INIZCTEOSA-N	436.578	1.064	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NNC(=O)Cc2ccccc2F)cc1Br	732256119	VOELGXNSDZXNBF-UHFFFAOYSA-N	439.241	1.815	50	20	IDGD	
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC(=NNC(=O)c2cnn(-c3ccccc3)c2)CC1	733077116	IOQIIUCDZQXTNZ-UHFFFAOYSA-N	441.517	1.783	50	20	IDGD	
CC(C)N1CC[C@H](NC(=O)NNC(=O)[C@H]2Cc3ccccc3CN2Cc2ccccc2)C1=O	734168668	ZXDWJFNVRHQPDF-FCHUYYIVSA-N	449.555	1.953	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)CNC(=O)c1ccc(C(F)(F)F)cc1	734239431	CTJZQTOZXALKLS-UHFFFAOYSA-N	447.414	1.290	50	20	IDGD	
COc1ccc([C@H]2[C@@H](C(=O)NNC(=O)COc3ccc(C#N)cc3)CCC(=O)N2C)cc1	734417087	JOKKGMGKFIVTLZ-UGKGYDQZSA-N	436.468	1.703	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)Sc1nnc(-c2cncc(Br)c2)n1N	736441655	PWXULXOGKCVTPU-VIFPVBQESA-N	442.343	1.491	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)N1CCN(C(=O)COc2ccc(F)cc2)CC1	738496866	BNFINXGVFPCQAZ-UHFFFAOYSA-N	444.463	1.306	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNS(=O)(=O)c1ccc(OC)c(C(=O)OC)c1	739667545	PWUXONXUQPGXST-UHFFFAOYSA-N	438.458	1.269	50	20	IDGD	
O=Cc1ccc(OCC(=O)NNC(=O)CNC(=O)c2cccs2)c(Br)c1	742613202	PPZJGUIBZZZQIR-UHFFFAOYSA-N	440.275	1.279	50	20	IDGD	
NC(=O)[C@@H](NNC(=O)COc1ccccc1[N+](=O)[O-])c1ccc(Br)cc1F	743461289	GRWLTXVGDIHVTO-HNNXBMFYSA-N	441.213	1.723	50	20	IDGD	
C[C@H](c1ccc(F)cc1F)N1CCN(CC(=O)NNC(=O)c2ccc(C#N)cc2)CC1	744398497	JEGYSCHWFAHXMK-OAHLLOKOSA-N	427.455	1.976	50	20	IDGD	
Cc1noc(-c2ccccc2C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)n1	745259971	WBOXNURLNUFCKA-KRWDZBQOSA-N	438.396	1.189	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)Oc1cccc(F)c1	745878242	IKHRGOZKNJDYOS-CYBMUJFWSA-N	438.481	1.488	50	20	IDGD	
COc1cc(C)nc(NNC(=O)c2ccc(C(=O)NNc3nc(C)cc(OC)n3)cc2)n1	746694376	TWEPMXOEGMGHGU-UHFFFAOYSA-N	438.448	1.414	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NNc2ccc(OC)cc2)o1	746886130	JBJQLELBACYXCQ-HNNXBMFYSA-N	437.474	1.761	50	20	IDGD	
Cn1cc(C=NNC(=O)[C@H]2Cc3ccccc3CN2Cc2ccccc2)c(=O)n(C)c1=O	747614106	GLQHOHWWGWBAAS-OAQYLSRUSA-N	431.496	1.161	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(N2CCOCC2)c(C(=O)NNc2cccc(C#N)c2)c1	748050080	ZSFWYWPZSGDJTD-UHFFFAOYSA-N	429.502	1.402	50	20	IDGD	
CN1C(=O)c2ccc(C(=O)NNc3ccc(S(=O)(=O)C(F)(F)F)cc3)cc2C1=O	748522153	MGFBLMYECGKQEP-UHFFFAOYSA-N	427.360	1.963	50	20	IDGD	
Cc1nc(S(=O)(=O)NCCC(=O)NNc2ccc(OCC(F)(F)F)cc2)cn1C	748695500	LJLPKKPYQJKRJT-UHFFFAOYSA-N	435.428	1.481	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)c1cc(S(=O)(=O)N2CCC2)ccc1Cl	748712418	TWNWIQNKKVNSMM-UHFFFAOYSA-N	425.869	1.877	50	20	IDGD	
CN(CCNC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)Cc1ccc(F)cc1	748976584	KEJDRPRHNUHZAH-UHFFFAOYSA-N	426.452	1.149	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@@H](Cc2c[nH]c3cc(F)ccc23)NC(C)=O)cc1OC	749331038	CMXRVYCCCDHEAT-GOSISDBHSA-N	442.447	1.833	50	20	IDGD	
CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)NNC(=O)NCCc1cccs1	749356913	LUXWOXTXWYHUCD-GOSISDBHSA-N	431.493	1.989	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)[C@H]2CCCN2C(=O)c2ccc3c(c2)OCO3)c1	749563311	ZYVOEIVRKGQCNA-GOSISDBHSA-N	439.468	1.863	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCC[C@H]2CCO[C@H](C)C2)c1	753347617	SNDPZJQWZRYHIX-CVEARBPZSA-N	440.566	1.866	50	20	IDGD	
CN(Cc1ccccc1)S(=O)(=O)c1ccc(NC(=O)NNC(=O)Cc2cc[nH]n2)cc1	755444900	UHSWIMMCGCRDMW-UHFFFAOYSA-N	442.501	1.626	50	20	IDGD	
CCN(CCNC(=O)NNC(=O)c1csc(N2CCOCC2)n1)CCC(F)(F)F	755870755	WYYCAOZEDZACMW-UHFFFAOYSA-N	438.476	1.198	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)Nc1ccc(OCc2noc(C3CC3)n2)cc1	756610525	PGLJNCWBRLSVCX-LBPRGKRZSA-N	435.462	1.113	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)Nc1ccc(O[C@H]2CCOC2)cc1	756681987	LHLUIZXFKUNDKY-SFHVURJKSA-N	426.477	1.714	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)Nc1cccc(S(=O)(=O)NC2CC2)c1C	756705275	KXPAEFSPVMAPQE-UHFFFAOYSA-N	442.501	1.858	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)Nc1cccn(CC(F)(F)F)c1=O	757655433	DZBHZELIIBBWED-UHFFFAOYSA-N	436.350	1.768	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2ccc3c(c2)CCC(=O)N3C)cc1OC	758588906	APQBKPGLSWVTEJ-UHFFFAOYSA-N	441.440	1.231	50	20	IDGD	
CCNS(=O)(=O)c1ccc(CC(=O)NNC(=O)[C@@H](C)Oc2ccc(OCC)cc2)cc1	759355718	ABSKHFVRYHDYCV-OAHLLOKOSA-N	449.529	1.541	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)N=c1cc[nH]cc1I	760027813	BNTPGNVJVXYWMI-VIFPVBQESA-N	444.204	1.867	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)c2cnn(CCC#N)c2-c2ccccc2)c2ccccc2c1=O	760066337	NSRCIRLYCRSBSC-UHFFFAOYSA-N	441.451	1.785	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)Cn2cnc3sc(C)c(C)c3c2=O)cc1C	761688343	RVYGLSVJYPDGSW-UHFFFAOYSA-N	427.486	1.478	50	20	IDGD	
CCCS(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)NCc2ccco2)cc1F	762472497	SXAPRPBSWURCOQ-UHFFFAOYSA-N	434.471	1.263	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)n1	762992366	YSLJEXMZVZNXOV-UHFFFAOYSA-N	438.437	1.710	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)C(=O)Nc1cncc2ccccc12	763530881	KGFTULCBOYODGX-UHFFFAOYSA-N	446.511	1.533	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)Nc1ccc(OC(F)F)c(Cl)c1	763575616	ZHYMCFCWZSGWSA-CQSZACIVSA-N	441.774	1.867	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2nc(-c3nccn3C)cs2)c2ccccc2n1	763617351	YKLUTUVJWCVNSM-UHFFFAOYSA-N	435.469	1.800	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2ccccc2CN2CCSCC2)c1	763630882	PHEXEYYUVUVVEB-UHFFFAOYSA-N	442.541	1.709	50	20	IDGD	
COC(=O)Nc1cc(NC(=O)C(=O)NNC(=O)COc2ccc(C)c(C)c2)ccc1F	763667034	OHUKXTXMQYXLFT-UHFFFAOYSA-N	432.408	1.786	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(N(C)C)c2)cc1C	763757350	HLJLOMPMZCZAKP-UHFFFAOYSA-N	447.517	1.222	50	20	IDGD	
CCOc1cc(NC(=O)C(=O)NNC(=O)c2nn(CC)c(=O)c3ccccc23)ccc1C	763787406	ZVPLOZRCTLXBEN-UHFFFAOYSA-N	437.456	1.523	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)C(=O)Nc2cc(F)ccc2F)c2ccccc2c1=O	763790489	KFGWCMOEGKFINM-UHFFFAOYSA-N	429.383	1.655	50	20	IDGD	
Cc1noc(COc2ccc(NC(=O)C(=O)NNC(=O)COc3ccc(F)cc3)cc2)n1	763838750	ABMGCDGHMITWRX-UHFFFAOYSA-N	443.391	1.261	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)cc1S(C)(=O)=O	763849181	JTZUJQUONOHHBJ-HNNXBMFYSA-N	447.513	1.569	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(Br)nc2)cc1	763872078	JVENDSJESNDVFD-NSHDSACASA-N	449.261	1.600	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1cccc(C(=O)NC(C)(C)C)c1	763873503	UNEXZIZSKBKNKK-ZDUSSCGKSA-N	444.463	1.907	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)Cc2ccc(F)cc2)ccc1-n1nnnc1C(C)C	763920061	YQCSPENBOIBQOV-UHFFFAOYSA-N	439.451	1.562	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3cc(-n4cnnn4)ccc3F)cc2C1	763939315	CYLGBTAXKWUHCZ-JTQLQIEISA-N	443.464	1.387	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3ccc4c(c3)S(=O)(=O)CC4)cc2C1	763947578	BZYUFCJWEHXEER-NSHDSACASA-N	447.538	1.602	50	20	IDGD	
CCCc1cc(NC(=O)C(=O)NNC(=O)c2ccc(COc3ccccc3)o2)n(C)n1	763950715	OEDRGPKGWWUZTA-UHFFFAOYSA-N	425.445	1.944	50	20	IDGD	
CCCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2OC)cc1	764010791	DHPFCVOQSKRXOJ-UHFFFAOYSA-N	432.864	1.888	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccccc1CN1CCSCC1	764048280	NAYZFZPUQXASHE-UHFFFAOYSA-N	428.514	1.644	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1cc(C(=O)NC(C)C)ccc1Cl	764049414	ZAZJYSLHKSWKDQ-UHFFFAOYSA-N	432.864	1.887	50	20	IDGD	
O=C(NNC(=O)c1ccc(F)cc1Br)C(=O)Nc1nc2c(s1)COCC2	764084797	HVFLEVKAGAXTNB-UHFFFAOYSA-N	443.254	1.517	50	20	IDGD	
COC(=O)[C@H](C)Cc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccccc2OC)cc1	764136516	RLTYLVVPBJSQRT-CQSZACIVSA-N	427.457	1.375	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccn(-c3ccncc3)n2)o1	764138895	LVVJKCKRHRCAGL-UHFFFAOYSA-N	425.449	1.102	50	20	IDGD	
CC(C)(C)OC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)cn1	764152064	CAIJTXOZOVDXKM-OAHLLOKOSA-N	441.444	1.518	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)C(=O)Nc2cc(C)nn2CCC#N)c1	764229463	AGPWIMIZSASSBE-UHFFFAOYSA-N	449.265	1.276	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)Cc2ccccn2)sc2c1CCCCC2	764264828	UTBKWRNBAFBWHQ-UHFFFAOYSA-N	444.513	1.917	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1ccc(CCN2CCCCC2)cc1	764275712	RJOGCEINJJZAIR-UHFFFAOYSA-N	440.500	1.586	50	20	IDGD	
CC(C)CNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)CCc2ccccc2O)cc1	764281495	YDZLLAUXKHFTRD-UHFFFAOYSA-N	426.473	1.497	50	20	IDGD	
O=C(NNC(=O)C(F)(F)Oc1ccccc1)C(=O)Nc1cccc(N2CCCNC2=O)c1	764380224	SUGUUKAVVZVLNE-UHFFFAOYSA-N	447.398	1.364	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C[C@H]2CN(C(=O)OC(C)(C)C)CCO2)cc1OC	764576486	ZOWQHCZZADPZBQ-HNNXBMFYSA-N	437.493	1.881	50	20	IDGD	
CS(=O)(=O)[C@@H]1CCCCC1=NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	764829036	CNQYAQMWOKHJIQ-LJQANCHMSA-N	440.997	1.917	50	20	IDGD	
CCc1ccc(C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)cc1S(C)(=O)=O	766167018	IBQKQNALDISTKL-UHFFFAOYSA-N	429.454	1.142	50	20	IDGD	
Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	766259140	RBXBXROKWDATPX-UHFFFAOYSA-N	438.400	1.503	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)N[C@H]3CC(=O)N(c4ccc(Cl)c(F)c4)C3)nc21	766865245	GIOBGYQUAPJODL-QMMMGPOBSA-N	434.819	1.293	50	20	IDGD	
O=C(COC(=O)c1cc2c(cc1F)NC(=O)CC2)NNC(=O)c1ccc([N+](=O)[O-])cc1	768118015	XMSNYFCKKYUGSZ-UHFFFAOYSA-N	430.348	1.237	50	20	IDGD	
CCOc1ccc(S(=O)(=O)Nc2cccc(C(=O)NNC(=O)c3cc(C)[nH]n3)c2)cc1	768276756	OHRRDAYRKMHFDR-UHFFFAOYSA-N	443.485	1.992	50	20	IDGD	
C[C@@H]1CN(C(=O)/C(C#N)=C/c2cn(CCC(N)=O)nc2-c2ccc(Cl)cc2)C[C@H]1O	769128115	OAFWOOIGOAQZAY-XQQWQRRCSA-N	427.892	1.825	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)NC(C(N)=O)C(N)=O)c(C)n1-c1cc(Cl)ccc1Cl	769756093	KJAOFOOSLWKSAP-SDQBBNPISA-N	434.283	1.763	50	20	IDGD	
CSCCNC(=S)NNC(=O)[C@@H]1CCCN(S(=O)(=O)Cc2ccccc2)C1	769765018	HUNRCNMUMYPMBM-OAHLLOKOSA-N	430.621	1.087	50	20	IDGD	
CCOc1ccccc1C(=O)NCCCC(=O)NNC(=O)c1ccc2c(c1)OCCO2	770424087	JNUYUWABHUTPRQ-UHFFFAOYSA-N	427.457	1.828	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)CCCC(=O)Nc2ccccc2C#N)c2ccccc2c1=O	770635493	BOKKIFPBKCDGFX-UHFFFAOYSA-N	432.440	1.375	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)c3ccc(F)c(NS(C)(=O)=O)c3)nc21	770958022	GQEVQHYJCXRYDW-UHFFFAOYSA-N	437.457	1.554	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)Cc3csc(NC(=O)Cc4cccs4)n3)nc21	770981500	ZCOVZXVZXXJFBD-UHFFFAOYSA-N	444.502	1.454	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)CN2C(=O)N[C@@](C)(c3ccc(Br)cc3)C2=O)n1	771244998	LJIGEOUGFAVEQZ-SFHVURJKSA-N	447.293	1.766	50	20	IDGD	
Cn1ccnc1[C@@H](O)C1CCN(C(=O)NNC(=O)c2cc(Br)c[nH]2)CC1	771949188	QQKXFUFSJFLSBM-ZDUSSCGKSA-N	425.287	1.311	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)C2(OCc3ccccc3)CCOCC2)cc1	772412664	JHCSYHPTSGALPR-UHFFFAOYSA-N	437.452	1.628	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)c2ccccc2S(C)(=O)=O)C1	773418552	KCSNPNVGPLEOMA-ZDUSSCGKSA-N	425.507	1.498	50	20	IDGD	
CN1CCN(C(=O)NNC(=O)c2ccccc2S(=O)(=O)N(C)c2ccccc2)CC1	773659476	SXSIRWHYBDKLGU-UHFFFAOYSA-N	431.518	1.114	50	20	IDGD	
COC[C@@H](C)NS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2cccc(Cl)c2)cc1	773729704	UOYAOVGKVGGPBY-GFCCVEGCSA-N	440.909	1.735	50	20	IDGD	
Cc1noc(C)c1S(=O)(=O)NC1(C(=O)NNc2cc(Cl)nc(N)n2)CCCC1	773861104	BDCKLTSSXRCLSW-UHFFFAOYSA-N	429.890	1.051	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)Nc2ccc(C[C@@H]3NC(=O)NC3=O)cc2)c1C	775706853	JAIQBSJRHWXTGT-YOEHRIQHSA-N	439.472	1.674	50	20	IDGD	
Cc1ccc(S(=O)(=O)C[C@@H](C)NC(=O)NNC(=O)COc2ccccc2C#N)cc1	776191497	MKBXTQRKKWBKCG-OAHLLOKOSA-N	430.486	1.438	50	20	IDGD	
CCOC(=O)N1CCC([C@H](C)NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)CC1	777507234	FZRMOOQEYFEBGJ-HNNXBMFYSA-N	447.540	1.280	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)[C@H]2CCCN(C(=O)Cc3ccccc3)C2)nc1C	778422117	VBGMQZJOKBEDJN-KRWDZBQOSA-N	425.489	1.886	50	20	IDGD	
COc1cc(C=NNC(=O)N[C@@H]2CCS(=O)(=O)C2)c([N+](=O)[O-])cc1OCC(F)F	778540263	MJAYFHPRWZWUTI-SNVBAGLBSA-N	436.393	1.068	50	20	IDGD	
CCc1oc(C(=O)OC)cc1S(=O)(=O)NNC(=O)c1cc(OC)c(OC)c(OC)c1	778556040	HCJSIPLCOXQQOX-UHFFFAOYSA-N	442.446	1.278	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)N[C@@H](CO)c1ccc(Br)cc1	778587965	CLGWSBUTCDOQLN-HNNXBMFYSA-N	446.265	1.102	50	20	IDGD	
Cc1cc(C)nc(-n2nc(C)c(CC(=O)NNC(=O)CCNC(=O)OC(C)(C)C)c2C)n1	780974128	QHYNKKQBRFWKAS-UHFFFAOYSA-N	445.524	1.501	50	20	IDGD	
O=C(COC(=O)c1cn(-c2cccc(Cl)c2)nn1)NNC(=O)c1ccc([N+](=O)[O-])cc1	781389640	NQLNQPWFAIAYOD-UHFFFAOYSA-N	444.791	1.447	50	20	IDGD	
O=C(NNc1ncncc1Cl)c1cc(I)ccc1-n1cnnn1	781806720	ZYDYVNVIEKMSCE-UHFFFAOYSA-N	442.608	1.467	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2cc(S(=O)(=O)N(C)C(C)C)ccc2C)nc1	782141493	NOYMBPLRCMALOA-UHFFFAOYSA-N	435.506	1.509	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C(=O)Nc2cccc(CN3CCCCC3)c2)nc2ccccc21	782893657	KPOAQHHGENAVRT-UHFFFAOYSA-N	448.527	1.888	50	20	IDGD	
Cc1nc2cc(NC(=O)C(=O)NNc3ccc(S(=O)(=O)NC(C)C)cn3)ccc2o1	783264341	NAVYGDBKCFKBTL-UHFFFAOYSA-N	432.462	1.300	50	20	IDGD	
COc1cc(NC(=O)C(=O)NN=c2sc3ccccc3n2C)ccc1N1CCCC1=O	783349970	SAVDFHUUCPFNIC-UHFFFAOYSA-N	439.497	1.946	50	20	IDGD	
Cc1cn(C2CCCCC2)nc1NC(=O)C(=O)NNC(=O)CNC(=O)c1cccs1	784005192	TYLOFYOVADKTSQ-UHFFFAOYSA-N	432.506	1.274	50	20	IDGD	
Cc1ccc(C(N)=O)cc1NC(=O)C(=O)NNc1c(F)cc(C(=O)NC2CC2)cc1F	785100206	SYRDLULNODEHPH-UHFFFAOYSA-N	431.399	1.346	50	20	IDGD	
COC(=O)c1scc(C)c1S(=O)(=O)NNC(=O)C(=O)Nc1ccc(C)c(C)c1	785479909	CAZHBJZCYOVSGJ-UHFFFAOYSA-N	425.488	1.408	50	20	IDGD	
COC(=O)c1ccc(S(=O)(=O)NNC(=O)c2cccc(Br)c2)c(OC)c1	785489078	XFJXPBHJZHWNJF-UHFFFAOYSA-N	443.275	1.868	50	20	IDGD	
C[C@H]1[C@H](C(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)CCN1C(=O)OC(C)(C)C	786250213	OHDAORQBMFELHR-SWLSCSKDSA-N	440.522	1.888	50	20	IDGD	
CN(CCCC(=O)NNc1ccc(-n2ccnc2)nn1)S(=O)(=O)c1ccc(F)cc1	788179542	XJYIKVWBNRTEEQ-UHFFFAOYSA-N	433.469	1.345	50	20	IDGD	
COc1cccc(NNC(=O)NC[C@H](Cc2cccc(F)c2)C(=O)N2CCOCC2)n1	789841603	FTVXJTUUPHWBMX-INIZCTEOSA-N	431.468	1.573	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1cccc(C(=O)NNC(=O)CN2CCCC2=O)c1)c1ccccc1	789857909	LGYYVGKMAGIZJI-OAHLLOKOSA-N	444.513	1.110	50	20	IDGD	
CO[C@@H]1CCOc2c(NC(=O)C(=O)NNC(=O)COc3ccc(C)c(C)c3)cccc21	790951132	DANUMZCJAUWKQA-GOSISDBHSA-N	427.457	1.938	50	20	IDGD	
Cn1ccnc1[C@H]1CN(C(=O)OC(C)(C)C)CCN1CC(=O)NNC(=O)c1ccccc1	792913739	RYKXXHUNAHLJFF-QGZVFWFLSA-N	442.520	1.475	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)C[C@@H]2COCCN2C(=O)OC(C)(C)C)cc1C	794807973	XMBUIPKVDHLKPC-MRXNPFEDSA-N	434.493	1.415	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H]2CN(CC(=O)NNC(=O)c3ccc(C#N)cc3)CC[C@@H]21	795134533	WYLNUOVKDFNAGT-ROUUACIJSA-N	427.505	1.651	50	20	IDGD	
COc1cccc(CCC(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)c1F	796841686	VZXYNDIJCJEDDC-UHFFFAOYSA-N	437.493	1.931	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@H](C(=O)NNC(=O)c3ccc(C)c(O)c3)C2)cc1	797358551	RFJIECCMNLLVGO-KRWDZBQOSA-N	431.514	1.871	50	20	IDGD	
CC(=O)N[C@](C)(C(=O)NNC(=O)C(C)(C)c1ccccc1)c1ccc(S(C)(=O)=O)cc1	797449510	LWFWBSLHPFIFEN-QFIPXVFZSA-N	445.541	1.567	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cc(N3CCOCC3)ccc2C)cc1	797535302	LTNHMQBMQZQVJE-UHFFFAOYSA-N	442.472	1.005	50	20	IDGD	
COc1ccc(OC)c(C2=NO[C@@H](C(=O)NNC(=O)C(=O)Nc3ccc(C)cc3)C2)c1	801106664	XEUCIJWWSGXFRG-GOSISDBHSA-N	426.429	1.291	50	20	IDGD	
O=C(NNC(=O)C1=CN2CCS(=O)(=O)N=C2C=C1)Nc1ccc(Br)cc1	801995665	QZCBADOLIPFARK-UHFFFAOYSA-N	440.279	1.099	50	20	IDGD	
O=C(NC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1)NNC(=O)c1ccc2c(c1)OCCO2	802338318	RDQCMSREKZUQCS-INIZCTEOSA-N	438.440	1.530	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)N=c2ccnc3n(C)[nH]cc2-3)c2ccccc2c1=O	806480943	CTUPWYGFKFDEPS-UHFFFAOYSA-N	448.487	1.708	50	20	IDGD	
CCC(C)(C)[C@H]1CCc2nc(NC(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)sc2C1	806753104	OQLVVSNAWZOGFW-MNOVXSKESA-N	431.584	1.775	50	20	IDGD	
Cc1c(C(F)(F)F)nn(C)c1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1cccc(Cl)c1	807065355	JGPISYSQOWWMQQ-VIFPVBQESA-N	447.801	1.954	50	20	IDGD	
CN1CCN(C(=O)NNC(=O)CSCc2nc(O)c3c4c(sc3n2)CCC4)CC1	807379833	FUAIQYDYGXMLCV-UHFFFAOYSA-N	436.563	1.107	50	20	IDGD	
O=C(NNc1nccnc1C1CCC1)C(=O)Nc1ccc(F)c(N2CCCS2(=O)=O)c1	807460590	RFAPWGHPJVPNJU-UHFFFAOYSA-N	448.480	1.505	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)CNS(=O)(=O)c2c(C)c(C)cc(C)c2C)cc1	810195966	SVQBIPRBVJJOHH-UHFFFAOYSA-N	447.557	1.987	50	20	IDGD	
CC(C[C@@H]1CCC(=O)N1)=NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	811631201	OSLALUPTNPXCSS-SFHVURJKSA-N	428.514	1.940	50	20	IDGD	
CNS(=O)(=O)c1ccc(O)c(NC(=O)/C(C#N)=C/c2cc(C)n(CCOC)c2C)c1	812361022	LMNDWXUFOCXXHJ-MHWRWJLKSA-N	432.502	1.911	50	20	IDGD	
COC[C@H](NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)c1cccc(Cl)c1	812453537	LUUUVVCMGOYNSL-INIZCTEOSA-N	429.864	1.919	50	20	IDGD	
CCc1nc(C)c(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(CC)CC)c2)o1	813876935	DVAKPHUNMPVTAQ-UHFFFAOYSA-N	437.522	1.720	50	20	IDGD	
O=C(COC(=O)[C@H]1CCCN(c2ccccc2)C1=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	814606787	ICPWMGHCZPFZLY-KRWDZBQOSA-N	440.412	1.342	50	20	IDGD	
CC(C)(C(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1)c1csc(-c2ccccc2F)n1	814620217	ILFOARDCWKHBMV-LLVKDONJSA-N	440.522	1.744	50	20	IDGD	
O=C(NNc1ncncc1F)C(=O)Nc1cc(Cl)ccc1I	815765626	XKUQJNCGBIFXRA-UHFFFAOYSA-N	435.584	1.956	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1ccccc1NC(=O)C1CC1	815826845	CPEHSWLKVVPNEK-UHFFFAOYSA-N	449.511	1.254	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)/C=C\c1ccccc1)C(=O)NNc1nnc(C)c(O)n1	817278411	AGFFDPLQIUFMCH-FPAJZGIOSA-N	438.535	1.041	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)NCC2(O)CN(C(=O)OC(C)(C)C)C2)c1C	819623988	KNDDKGYDTPKADR-ZDLGFXPLSA-N	432.521	1.756	50	20	IDGD	
O=C(CN(Cc1ccccc1)S(=O)(=O)c1ccc(Cl)cc1)NNC(=O)C(F)F	913506175	GXYMVWPWSVFJEC-UHFFFAOYSA-N	431.848	1.943	50	20	IDGD	
COc1ccnc(NNC(=O)CCNS(=O)(=O)c2cccc(Br)c2)n1	914762924	CTGWITMNTBBMOK-UHFFFAOYSA-N	430.284	1.059	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)CCc2c(C)c3c(C)nn(C)c3[nH]c2=O)c1	914837552	MPULFDVCHUCPNZ-UHFFFAOYSA-N	427.461	1.289	50	20	IDGD	
Cc1cc(C=NNC(=O)[C@H](C)CN2C[C@H](C)O[C@@H](C)C2)c(C)n1CCN1CCOCC1	915954495	GDKXOWSRBUYXME-HOJAQTOUSA-N	433.597	1.633	50	20	IDGD	
CCCCS(=O)(=O)N1CCC(C(=O)NNC(=O)c2ccc3c(c2)OCCO3)CC1	916045195	QLPLMLPOBGHBFV-UHFFFAOYSA-N	425.507	1.061	50	20	IDGD	
CCCCS(=O)(=O)N1CCC(C(=O)NNC(=O)c2cc(Br)c[nH]2)CC1	916162541	YYUJRUSHJCJMOJ-UHFFFAOYSA-N	435.344	1.380	50	20	IDGD	
CC(C)[C@@H](CNC(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12)N1CCOCC1	916254011	BLMXIPJNVQUJOY-GOSISDBHSA-N	444.536	1.278	50	20	IDGD	
CCS(=O)(=O)N(C)CCCNC(=O)NNC(=O)c1ccc(OC(C)C)c(OC)c1	916580377	SSQVUWIIWSWABY-UHFFFAOYSA-N	430.527	1.098	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Cc2ccc3ccccc3c2)cc(OC)c1OCC(N)=O	917195404	LIVGKNYSLMCLTQ-UHFFFAOYSA-N	437.452	1.725	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@H]2C(=O)NNC(=O)c2ccc(Cl)nc2)c(OC)c1	917252592	PDNIAMGMFODSJY-HNNXBMFYSA-N	432.864	1.818	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@H](C)COc2ccccc2)cc1	918087601	HUFPGIUGUGPSGK-MRXNPFEDSA-N	434.518	1.413	50	20	IDGD	
COc1ccc(Br)c(CNC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c1	918232038	XRRVOETVTPNKEN-UHFFFAOYSA-N	446.265	1.578	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)NCc1ccc(N2CCOCC2)cc1	919789900	IEJKHBPXWOTJRQ-UHFFFAOYSA-N	428.489	1.831	50	20	IDGD	
O=C(NNS(=O)(=O)c1c(Cl)cc(Cl)cc1Cl)N[C@@H]1CCS(=O)(=O)C1	919961295	ZVWXEXMJHSVVBE-SSDOTTSWSA-N	436.726	1.326	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)NNC(=O)COc2cccc(C)c2)cc1OC	920930874	TUQDVLAEIRZCPJ-UHFFFAOYSA-N	436.490	1.997	50	20	IDGD	
CS(=O)(=O)Nc1ccccc1CC(=O)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	1116305022	UQDKJAAZGFOVNL-UHFFFAOYSA-N	431.449	1.591	50	20	IDGD	
CC(C)CN1CC[C@@H](CNC(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)C1	1319071730	JGKCMCVJXYVEQW-INIZCTEOSA-N	425.574	1.942	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)NC1CCN([C@H]2CCCC[C@H]2O)CC1	1319252861	QBEMRGNPOBXFOB-DLBZAZTESA-N	428.493	1.047	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2n[nH]c3c2CCCC3)nnn1-c1cccc2c1CCN(C)C2	1322870633	SIXQSNHWAXMVSZ-UHFFFAOYSA-N	434.504	1.240	50	20	IDGD	
O=C(COCc1ccncc1)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	1327646920	LTORKZVEVXOSJA-UHFFFAOYSA-N	432.502	1.234	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnc4cc(C)ccn4c3=O)C2)C1	1777993840	CGLNWGADHWQVOT-VGOFRKELSA-N	446.935	1.854	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4nncn4c3)C2)C1	1778600229	GWRQYFLSQMIVFH-KSSFIOAISA-N	436.310	1.346	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)/C=C3\C(=O)Nc4ccccc43)C2)C1	1778910083	ZUKQCIDMWDXDEF-ZCCVTUMWSA-N	433.892	1.106	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)C#CC3(O)CCCCC3)C2)C1	1779067687	XGSCGERIIPPEAC-HNAYVOBHSA-N	427.339	1.298	50	20	IDGD	
CN(CC(=O)N1CCO[C@]2(CCN(C(=O)CO[Si](C)(C)C)C2)C1)C(=O)c1ccccc1	1779294643	VWWQTNJFZQJUJT-QFIPXVFZSA-N	447.608	1.440	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(O)no3)C2)C1	1779677989	VWTMGXNIOYKMOV-MYHKYFONSA-N	444.394	1.709	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(OCCCO)cc3)C2)C1	1780126536	LTOKIVRUTUAPNS-GHTZIAJQSA-N	440.924	1.145	50	20	IDGD	
O=C(CC12CCCN1CCC2)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1781137555	UQDROLARYPQXKY-QAPCUYQASA-N	432.334	1.525	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cc(C(=O)O)n(C(C)C)n3)CCO2)C1	1781214549	ZMAMWNPXGFZYTB-ORAYPTAESA-N	426.901	1.623	50	20	IDGD	
Cn1cc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)c2cccnc21	1781331851	QZWCDLHAVWHPFW-KDOFPFPSSA-N	439.285	1.707	50	20	IDGD	
C[C@H](Nc1ccccn1)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781331909	RTXJKGYKGWEHIC-DXCKQFNASA-N	429.290	1.402	50	20	IDGD	
C[C@H](C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Br)C2)n1ccnn1	1781549340	AIPUBNUEEMGVPZ-BRXULGCHSA-N	432.294	1.044	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cncn1C)C2	1781900508	RJVGYFPTQVKAFR-JCKWVBRZSA-N	427.343	1.721	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnc(Cl)nc1)C2	1782168777	URRIJWRYGGKKEA-PMUMKWKESA-N	431.320	1.511	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)N1C[C@H]3C[C@@H]3C1)C2	1782175066	BOMUHBFZPSTSHL-ATVBHHLPSA-N	427.973	1.094	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)Cc3ccc(F)cn3)CCO2)C1	1783343243	RKZFZSYILYEJMQ-MAUKXSAKSA-N	428.302	1.767	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cnc(OC)c(F)c3)CCO2)C1	1783344949	UUYXNMJEUNNUBC-SCLBCKFNSA-N	444.301	1.846	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)C34CC(C(=O)OC)(C3)C4)C2)C1	1783446163	JLFUSXYOMRJOEL-KSBHDHOUSA-N	443.338	1.333	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(O)c(O)c(Cl)c3)CCO2)C1	1783536559	KDSHPNXHKDNOFN-BTDLBPIBSA-N	447.713	1.978	50	20	IDGD	
CN1CCN(C2(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)C(C)(C)CCl)[C@H]4C3)CC2)CC1	1783852454	ZYTYHEXXBJLPBW-BZSNNMDCSA-N	441.016	1.011	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(C)(C)CCl)[C@H]2C1	1783852651	GSTRCOPDYCFVPZ-KKUMJFAQSA-N	431.961	1.756	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](C)[S@](=O)c1ccccc1)CCO2	1783881031	JGNDRUXVKXGXER-VZDTXDAWSA-N	442.965	1.266	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)CCc3cnccn3)C2)C1	1784560818	GRJUUMCSONTKNU-MAUKXSAKSA-N	425.327	1.413	50	20	IDGD	
CC(C)c1nc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)Br)C[C@@H]32)no1	1785212200	GOMGIGMIASDOLQ-RFGFWPKPSA-N	443.342	1.499	50	20	IDGD	
COc1cnc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCBr)[C@H]3C2)c(F)c1	1786401188	SXYMCWQBJWWMDC-WHOFXGATSA-N	444.301	1.608	50	20	IDGD	
CCOCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C[C@@H]21	1786505906	VMJDAWYTIOWHMD-TYDTZWSASA-N	433.455	1.888	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccco3)C[C@@H]21	1787509001	WOOJVSRFGGVIDU-RBOWNIJDSA-N	427.461	1.007	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3[nH]nc4ccncc34)C[C@@H]21)[C@@H](F)Br	1789922330	CWWAIFROFLAOCX-YARBFKLUSA-N	440.273	1.242	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3CC(c4ccccc4)=NN3)[C@H]2C1	1790545407	OPJKGDSOLARKFL-OIGVQNGMSA-N	432.952	1.750	50	20	IDGD	
Cc1cc(/C=C/C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]3C2)no1	1791056354	VGEOQSBJSOUGFN-HFLCEVLVSA-N	426.311	1.759	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4c(c3)OCCO4)C[C@@H]21	1791253849	HOBLERNEJVWVQT-FPXQBCRKSA-N	438.908	1.305	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CS[C@@H]3CCCCO3)C[C@@H]21	1791255406	QNZCVEGTTFBVRZ-RNGZQALNSA-N	434.986	1.480	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]3C2)ncc1[N+](=O)[O-]	1791295573	NOTQTRNVABZYNR-MJVIPROJSA-N	431.276	1.695	50	20	IDGD	
COc1ccc(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)cc1	1795668770	FPYPSLKYUBYISP-BJWYYQGGSA-N	437.500	1.188	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)c1cc(F)c(F)c(Cl)c1	1796190663	WCSFAVBIFVLUOW-MUJYYYPQSA-N	448.662	1.864	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)c1cc(F)cc(F)c1F	1796192777	RQQMWZMKVIKDCC-MUJYYYPQSA-N	432.207	1.349	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H]2C[C@@]2(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Cl)C1	1796370826	PQKXJEIEKHBYQR-CMVVLZHBSA-N	445.919	1.367	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1csc2c1CCCO2	1796557225	KAUJICOJEPRKFF-QDMKHBRRSA-N	434.562	1.698	50	20	IDGD	
COCCn1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](C)CBr)C3)n1	1797066314	FKALSDKYAOFMDL-APIJFGDWSA-N	427.343	1.812	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ncon1	1799032909	AVZWXURMAVVUBG-RNJOBUHISA-N	427.889	1.454	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=N/O[C@@H]1CCCCO1)C2	1799276496	KRIFEUILLBELED-JGNDYJHSSA-N	436.336	1.341	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(O)c(F)c1	1799550984	ZHRKOGMMWUNMGG-ZWUHOBOKSA-N	429.286	1.908	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CC(c2ccccc2)=NN1	1800153798	UTONEIOAMMFQHT-FPPGBKCQSA-N	432.952	1.750	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COc1cc(Cl)ccn1)C2	1800759022	DPFSMZXALLRQRV-OVZMXSCWSA-N	446.729	1.487	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H]2C[C@]21C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2	1800849821	QIRBMFFDFAUQKP-RTDPWRILSA-N	445.919	1.510	50	20	IDGD	
CC#C[C@H](CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](Cl)COC)C2)c1ccc(O)cc1	1801058726	OVHIBZAQJKPRPX-IEATVEBOSA-N	448.947	1.733	50	20	IDGD	
N#C/C(=C\c1ccc(Br)cc1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C(O)O)C2	1801441992	REEJNNLQSOTDDQ-NOFFMGQBSA-N	434.290	1.305	50	20	IDGD	
COc1cc(F)ccc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc(B(O)O)c1)C2	1803472684	PWJNRRRCNQJZCD-BCDXTJNWSA-N	426.253	1.080	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(F)(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](O)CCl)C3)C1	1804547366	VUAQOAKKRCCPDH-CRWXNKLISA-N	433.908	1.183	50	20	IDGD	
C[C@H](C(=O)N1CC[C@@H](CNC(=O)CCBr)[C@H]1c1cccnc1)n1cnnn1	1806347380	WGCNLAFVPNWIMY-IVMMDQJWSA-N	436.314	1.120	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H](CNC(=O)CS(C)(=O)=O)[C@@H]1c1cccnc1	1806763387	DAUQSMBHWDUVSY-XPKDYRNWSA-N	446.367	1.163	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)[C@H]2C[C@H]2F)[C@@H]1c1cccnc1	1807821156	WAGNJVIXONUZGJ-QUODBWSBSA-N	440.479	1.579	50	20	IDGD	
Cn1cnc(C(=O)N2CC[C@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]2c2cccnc2)n1	1808292596	ZAEWJEDZPCPLME-LBTNJELSSA-N	425.320	1.766	50	20	IDGD	
Cc1c[nH]cc1C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1808581029	RMAHIIVMYWSTPI-RXVVDRJESA-N	432.289	1.031	50	20	IDGD	
COCCn1ccc(C(=O)NC[C@@H]2CCN(C(=O)[C@H](Cl)COC)[C@@H]2c2cccnc2)n1	1808659044	GARWDFMFJHBRQI-YQVWRLOYSA-N	449.939	1.498	50	20	IDGD	
COCc1oncc1C(=O)NC[C@@H]1CCN(C(=O)[C@H](Cl)COC)[C@@H]1c1cccnc1	1808824245	XHIWECGIZOOLNK-YXJHDRRASA-N	436.896	1.789	50	20	IDGD	
C/C(=C\c1cccnc1)C(=O)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1	1809972502	JTFVFVZOKQYSPZ-KNTRCKAVSA-N	447.344	1.710	50	20	IDGD	
CCCC(=O)N[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](Cl)COC)[C@H]1c1cccnc1	1810513882	IGNOIDOJDKPLOJ-WMEZAQDKSA-N	438.956	1.646	50	20	IDGD	
CC(C)CNC(=O)C(=O)N1CC[C@@H](CNC(=O)CO[Si](C)(C)C)[C@@H]1c1cccnc1	1810542758	XXQOKQUNYNOHBB-HKUYNNGSSA-N	434.613	1.711	50	20	IDGD	
Cc1noc(CC(=O)N2CC[C@H](CNC(=O)[C@@H](C)Br)[C@@H]2c2cccnc2)n1	1812865375	XCRVNKDMRCCIFC-ZLENFMNRSA-N	436.310	1.805	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1	1815337209	OPAOERWCWNDNLO-ZIAGYGMSSA-N	435.742	1.456	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc(Cl)o2)[nH]n1)c1cccc(B(O)O)c1	1817475410	QHPYORPSGODDKO-OAHLLOKOSA-N	442.668	1.956	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2nc3ncccn3n2)n[nH]1	1818621218	URZHEPWJTVDHLC-PWSUYJOCSA-N	447.297	1.937	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)c3n[nH]cc3[N+](=O)[O-])sc2C1	1820302558	HHDSMCQUZDVHEA-NKWVEPMBSA-N	443.283	1.784	50	20	IDGD	
C=CCC(F)(F)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1821986744	XHCCSRCHOSPQQP-HNNXBMFYSA-N	447.446	1.926	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN2CCCC2=O)[nH]n1	1822184214	QEQDQPHQVYYXOQ-YPMHNXCESA-N	426.315	1.808	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC([C@@H]2CCCCN2C(=O)C2=NN(C)C(=O)CC2)CC1	1824927261	APFIKVDGPJJHBG-CJNGLKHVSA-N	441.370	1.998	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc3cn[nH]c3cn1)CC2	1825999986	HNKJAFYWAMNWLT-QWRGUYRKSA-N	434.909	1.894	50	20	IDGD	
CC(C)c1cc(C(=O)N[C@@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)on1	1826088785	OXAHZOOBSMDMAW-GFCCVEGCSA-N	448.549	1.853	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)Cc2ccccc2)CC1	1826461405	AUOQMEFYJNFMKZ-HSZRJFAPSA-N	434.345	1.842	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)CCc2cccnc2)CC1	1827218776	YJJRARKVMORMEF-HSZRJFAPSA-N	449.360	1.628	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)cc(O)n1	1827625306	QXIRKRJJCHPDQG-IBGZPJMESA-N	445.564	1.702	50	20	IDGD	
C[C@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H](O)CCl)CC1)[C@@H]1SC(=N)NC1=O	1827665616	ZARDIDKTFJLHSQ-ATGSNQNLSA-N	444.985	1.008	50	20	IDGD	
C[C@]1(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)CC2)CC1(F)F	1828925270	IDWXBNWTQPROSQ-LAUBAEHRSA-N	449.502	1.964	50	20	IDGD	
O=C([C@@H](O)CCl)N1CCC([C@@H]2CCCCN2C(=O)c2cnc3snnc3c2)CC1	1829623869	RVBLRTBUXKRHBF-HOTGVXAUSA-N	437.953	1.919	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3cccc(C#N)c3)CCO2)C1	1830462338	BSYWTTGFTJQTSM-KNQAVFIVSA-N	449.935	1.201	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3C[C@@H]3C3CC3)C2)C1	1830533130	GIUJBXIJZVPWQP-JNNRSPCRSA-N	429.355	1.520	50	20	IDGD	
C#CCCCCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2	1830544275	SYGNTVHSSXHJKS-QFBILLFUSA-N	429.355	1.667	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)C[C@@H]3CCCCO3)CCO2)C1	1832347279	TYKFVGWOLLHOGH-SNRMKQJTSA-N	437.364	1.638	50	20	IDGD	
C[C@H](C(=O)NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1)C1(O)CCC1	1833067637	SOXPHLCZBRFEON-OAHLLOKOSA-N	444.414	1.894	50	20	IDGD	
CC[C@H](NC(C)=O)C(=O)NC1CCN(C2CCN(C(=O)C(C)(C)CCl)CC2)CC1	1833094201	RDLTYVSETSYNRL-SFHVURJKSA-N	429.005	1.738	50	20	IDGD	
C[C@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)c3nc[nH]n3)CC2)CC1	1833263704	RLADZYXKSGXYQZ-GFCCVEGCSA-N	427.347	1.021	50	20	IDGD	
CC[C@H](C)[C@H](O)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)CBr)CC2)CC1	1833494547	DRJRDHPIWOCSIA-MPGHIAIKSA-N	446.430	1.996	50	20	IDGD	
Cc1nocc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)CBr)C2)C1	1834332317	KTZISDKWJUUOPC-SJKOYZFVSA-N	430.299	1.084	50	20	IDGD	
O=C(Cc1cccc(F)c1)NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1834495373	SDQLPFXODSMRES-IBGZPJMESA-N	425.932	1.540	50	20	IDGD	
CC(C)CNC(=O)C(=O)N1CCC(N2CCC(NC(=O)[C@H](F)Br)CC2)CC1	1836412620	OIUGAVMYTVTUMA-HNNXBMFYSA-N	449.365	1.021	50	20	IDGD	
Cc1n[nH]c(C)c1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1	1837807067	KOEYODVXRQXMBE-ZWKOTPCHSA-N	433.336	1.333	50	20	IDGD	
N=C(N)SCCC(=O)N1CCC(OC2CCN(C(=O)C(Cl)Cl)CC2)CC1	1837865340	YYHIBPZWNSFEKX-UHFFFAOYSA-N	425.382	1.805	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cc4ncccn4n3)CC2)CC1	1838312880	PQLTUKUPKGMGFN-KRWDZBQOSA-N	449.939	1.595	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3ccnc(OC)c3)C2)C1	1839142308	LQUXVKKPHXOIIC-UTKZUKDTSA-N	439.940	1.497	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ncn(-c4ccccc4)n3)C2)C1	1839144633	HBNPUCZKJWLNBS-LAUBAEHRSA-N	447.923	1.355	50	20	IDGD	
CCc1nc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)co1	1839153751	QUZBTWUAYMZOCF-QZTJIDSGSA-N	434.320	1.543	50	20	IDGD	
O=C(c1[nH]cc2c1CCC2)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839201008	UWIVMGZGHBRVML-YJBOKZPZSA-N	444.301	1.264	50	20	IDGD	
CSCC(C)(C)C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](C)Br)CCO2)C1	1840030299	IDZJEMTVIFAGRO-GUYCJALGSA-N	437.400	1.615	50	20	IDGD	
Cc1ccn(C)c1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)Br)CCO2	1840034151	BRLXSFUOBWMWSV-KBXCAEBGSA-N	428.327	1.187	50	20	IDGD	
O=C(c1n[nH]c2c(F)cccc12)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840188589	RUONEJMDRBPRCG-GOSISDBHSA-N	445.278	1.576	50	20	IDGD	
Cc1cc(O)c(C(=O)N2CC3(CCCN3C(=O)[C@H](O)CCl)C2)cc1Br	1841353085	BSIDUCWBSULDEA-CQSZACIVSA-N	431.714	1.880	50	20	IDGD	
CC(C)(C)OC(=O)N1CCCC[C@@H](C(=O)N2CC3(CCCN3C(=O)[C@H](O)CCl)C2)C1	1841354798	WRNCISNDODKEFU-HZPDHXFCSA-N	443.972	1.827	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)c2cccnc2OCC2CC2)C1	1842270877	HAAKHRQUBGERPZ-UHFFFAOYSA-N	429.521	1.060	50	20	IDGD	
Cc1ccc(S(=O)(=O)CC(=O)N2CCCC23CN(C(=O)[C@@H](C)Br)C3)cc1	1842759054	XGAOJOIMUXGAGC-CQSZACIVSA-N	443.363	1.756	50	20	IDGD	
CCc1cc(C(=O)N2CC3(CCCN3C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)cc(C)n1	1843415953	HLVAZUILOMOKFE-WGOQTCKBSA-N	436.516	1.903	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2cc3ccccn3n2)C1	1843649126	XWBFNCVDXYSWDX-BUVRLJJBSA-N	433.472	1.285	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC12CN(C(=O)C[C@@H](O)CNC(=O)OC(C)(C)C)C2	1846178449	YELSNTJRFNQLGT-CHWSQXEVSA-N	448.358	1.249	50	20	IDGD	
O=C([C@H]1CN(Cc2ccccc2)CCO1)N1CC2(CCCN2C(=O)C(Cl)Cl)C1	1846387802	NXPLTXSTLLZCPL-MRXNPFEDSA-N	426.344	1.895	50	20	IDGD	
O=C(Cc1ccc(Br)cc1F)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl	1847563790	QFIAVZCFUVYAPZ-SOUVJXGZSA-N	433.705	1.932	50	20	IDGD	
O=C(COC(=O)CCc1nc2sc3c(c2c(=O)[nH]1)CCC3)NNC(=O)c1ccccc1	11651255	IUSTTWQNGXPALZ-UHFFFAOYSA-N	440.481	1.410	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNS(=O)(=O)c2ccc3c(c2)CC(=O)N3C)cc1	12969446	VLDRWNCFFIOJJY-ZDUSSCGKSA-N	433.486	1.381	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)COc2ccc(Cl)cc2C)cc1	17406470	BKCURDOPOODVPS-UHFFFAOYSA-N	439.921	1.804	50	20	IDGD	
CCOC(=O)Nc1ccc(C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1	17406936	DPOHNQUARJHGTQ-UHFFFAOYSA-N	448.501	1.645	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21	17582626	LGCJYAANWGJKMI-UHFFFAOYSA-N	438.400	1.700	50	20	IDGD	
CC(C)(C)OC(=O)NNC(=O)[C@@H](CCS(C)(=O)=O)NC(=O)c1ccccc1Cl	725897483	CNDMNTIILRMOGV-CYBMUJFWSA-N	433.914	1.429	50	20	IDGD	
COc1ccc(CN2C[C@@H](C(=O)NNC(=O)COc3ccc(C)c(C)c3)CC2=O)cc1	726523333	JDGSPQJLEWYEOH-SFHVURJKSA-N	425.485	1.887	50	20	IDGD	
COC(=O)Cc1cc(=O)n(-c2ccc(C(=O)NNC(=O)CCCc3ccccc3)cc2)[nH]1	727741563	YOCQGDUIKGKXKG-UHFFFAOYSA-N	436.468	1.665	50	20	IDGD	
O=C(CCCc1ccccc1)NNC(=O)N1CCN(CC(=O)N2CCc3ccccc32)CC1	727845629	WBEBXRXMDQKJBK-UHFFFAOYSA-N	449.555	1.957	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2cc(F)ccc2Cl)c1	728502620	OMFIZYYQMFTJBA-UHFFFAOYSA-N	435.886	1.353	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1cc(Br)c2c(c1)OCO2	728846796	RMFUJMFXILZOOK-UHFFFAOYSA-N	448.277	1.645	50	20	IDGD	
NS(=O)(=O)c1ccc(CC(=O)NNC(=O)c2ccc(Br)cc2Cl)cc1	728985206	AOKGCGAIPYAQFR-UHFFFAOYSA-N	446.710	1.754	50	20	IDGD	
Cc1ccc([N+](=O)[O-])c(OCCC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1	728985285	IPPBNOFVCZKPRD-UHFFFAOYSA-N	428.449	1.526	50	20	IDGD	
C[C@H](CC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)S(=O)(=O)c1ccc(F)cc1	729299745	FPZPQGSAUHATNK-GFCCVEGCSA-N	446.460	1.086	50	20	IDGD	
CCCCN1CCCC[C@H]1CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	731284686	FDTOIUMKFLZJJF-KRWDZBQOSA-N	439.582	1.536	50	20	IDGD	
COc1ccc([C@H](CNC(=O)NNC(=O)c2ccccc2OC)N2CCOCC2)cc1	731541874	DYWRVHNDOWMSSB-IBGZPJMESA-N	428.489	1.721	50	20	IDGD	
COc1ccc([C@@H]2CCCCC2=NNC(=O)CSc2nn(C)c(=O)n(C)c2=O)cc1F	732712368	DGNLZEXZWOSCRL-ZDUSSCGKSA-N	449.508	1.549	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2ccc(N3CCC(O)CC3)cc2)cc(OC)c1OC	733885204	UNJIUNJLFWUSPH-UHFFFAOYSA-N	429.473	1.748	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N(C)Cc2cn[nH]c2)cc1	733984685	ZSVLUNIWKKNJEF-RQZCQDPDSA-N	433.472	1.723	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)c2ccc3c(c2)NC(=O)CO3)CC1	734824982	PMDNGZMQVGSJJK-UHFFFAOYSA-N	433.465	1.361	50	20	IDGD	
Cc1oc2ncnc(O)c2c1C(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	734825062	SHCQUTIVFZIMIT-UHFFFAOYSA-N	434.453	1.580	50	20	IDGD	
O=C(COC(=O)c1cc(Cl)cc([N+](=O)[O-])c1)NNC(=O)[C@@H]1COc2ccccc2O1	736862241	DJPAAUQWJCPHQS-HNNXBMFYSA-N	435.776	1.392	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)CCc1nc(-c2ccoc2)no1	740282956	BSCXWGRJWUMYKN-UHFFFAOYSA-N	448.819	1.929	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)c1cccc(NC(=O)[C@H]2Cc3ccccc3O2)c1	740850114	UCDPLGVEGGTFKL-LJQANCHMSA-N	438.484	1.695	50	20	IDGD	
COc1cc(C=NNC(=O)Cc2cc(O)nc(O)n2)cc(Br)c1OC(F)F	743446043	NTQSTTYXFBMJSN-UHFFFAOYSA-N	447.192	1.953	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)NC[C@](C)(O)C2CC2)cc1	743776070	WNXZJTABPSJSDV-LJJIPZOBSA-N	437.500	1.618	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCCN(C)CC(=O)NNC(=O)c2ccccc2Cl)cc1	744423442	IVGGGKZVIVKGPK-UHFFFAOYSA-N	438.937	1.320	50	20	IDGD	
O=C(CCCn1cnc2ccccc21)NNc1ccccc1S(=O)(=O)N1CCOCC1	744621537	SFTUJOKMDHOHMY-UHFFFAOYSA-N	443.529	1.981	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)[C@@H]2CC(=O)N(c3ccc4c(c3)CCC4)C2)cc1	744683084	QYPLJEGAVXSKST-LJQANCHMSA-N	446.463	1.404	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2cc(C(=O)NNC(=O)C(=O)N3CCCC3)ccc2C)cc1	748246027	DDDOCHXBKWWTFR-UHFFFAOYSA-N	444.513	1.488	50	20	IDGD	
O=C(CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)NNC(=O)[C@@H]1Cc2ccccc2O1	748281547	ZODKKQXVJNOZIS-KRWDZBQOSA-N	426.385	1.434	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)c1ccc([C@@]2(C)NC(=O)NC2=O)cc1	748517274	RGMZKYUFMQENST-JOCHJYFZSA-N	434.456	1.115	50	20	IDGD	
COc1cc(CCC(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)ccc1OCC(F)(F)F	749783828	NQNDQPBWOCBLLO-LBPRGKRZSA-N	438.424	1.151	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CNC(=O)c2cccs2)c1I	751206107	CHORKQWXMBAWPX-UHFFFAOYSA-N	443.266	1.852	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNS(=O)(=O)c1c(Cl)cc(Cl)cc1Cl	751283505	XDHOQRVBHMXKAQ-UHFFFAOYSA-N	426.665	1.979	50	20	IDGD	
Cc1c(C(=O)NNC(=S)N[C@@H](C)C2CC2)cc(Br)cc1S(N)(=O)=O	751618731	KHNLGDOSCHSKBZ-QMMMGPOBSA-N	435.369	1.312	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)NCCNS(=O)(=O)c1ccc(Cl)s1	752688470	HZEKMINZOLPHTE-UHFFFAOYSA-N	446.938	1.262	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)N[C@@H]2CCN(Cc3ccc(C#N)cc3)C2=O)c1	753733445	QFUYMYLCXRZMDR-LJQANCHMSA-N	435.484	1.685	50	20	IDGD	
Cc1cc(C(=O)O)cc(S(=O)(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c1Cl	753775554	OHJLSQIMBQPBSY-UHFFFAOYSA-N	446.890	1.373	50	20	IDGD	
CCCOc1ccc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1N	754608227	NYSVRLNIBLBHQU-GOSISDBHSA-N	429.429	1.202	50	20	IDGD	
CC(C)C[C@@H](C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)N1CCCCC1=O	755066949	YTOSBDKXYBCBIB-NRFANRHFSA-N	443.592	1.773	50	20	IDGD	
C=CCN(C)S(=O)(=O)c1ccc(NC(=O)NNC(=O)COc2ccc(OC)cc2)cc1	755932855	OHVRWRBOPGTMSK-UHFFFAOYSA-N	448.501	1.733	50	20	IDGD	
CCNC(=O)c1ccc(NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c(C)c1	756083366	BSECAOGYTKWHDE-UHFFFAOYSA-N	425.493	1.604	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c(OC[C@H]2CCCO2)c1	756205274	QAYWLTJSQMPJQU-QGZVFWFLSA-N	437.460	1.995	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(F)c(NC(=O)NNC(=O)c2cc(Br)c[nH]2)c1	756681375	ANQGQYMYKPSOKQ-UHFFFAOYSA-N	448.274	1.633	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1)c1cn[nH]c1	757727192	SBPCPOCPTLSWNK-NSHDSACASA-N	434.503	1.977	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1csc(-c2ccc(Cl)c(Cl)c2)n1	758048106	OXTICKIFTALIJN-ZETCQYMHSA-N	437.330	1.816	50	20	IDGD	
CN(NC(=O)c1ccccc1S(C)(=O)=O)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758786945	QOKFXDHJCRBKGW-UHFFFAOYSA-N	440.522	1.339	50	20	IDGD	
COc1cc2ncn(CCCC(=O)NNc3ncccc3[N+](=O)[O-])c(=O)c2cc1OC	759294886	XCRRQAVACLWSDG-UHFFFAOYSA-N	428.405	1.640	50	20	IDGD	
CC(C)NC(=O)N1CCC[C@H]1C(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	760603534	IDLQEROQLQGVIF-HNNXBMFYSA-N	440.545	1.299	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)c2cc(N3CCCC3=O)ccc2Cl)c1	760660056	KLEJMWCLWABUHW-UHFFFAOYSA-N	440.843	1.956	50	20	IDGD	
CC(C)(C)C(=O)NNC(=O)C(=O)Nc1ccc(Cl)c(S(=O)(=O)N2CCCC2)c1	761063376	HSKVRBUDAWUSMB-UHFFFAOYSA-N	430.914	1.257	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H]1[C@H]1COCCC1=NNC(=O)[C@@H]1CCS(=O)(=O)C1	762418873	UMZZEJWIYKLXGX-IJEWVQPXSA-N	429.539	1.329	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=S)NCCc1ccc2c(c1)OCCO2	763296531	ANRHPGHNAARONX-UHFFFAOYSA-N	438.550	1.801	50	20	IDGD	
COCCSc1ccc([N+](=O)[O-])cc1C(=O)NNC(=O)[C@@H]1COc2ccccc2O1	763334545	IURHNXLHTWGFAQ-INIZCTEOSA-N	433.442	1.934	50	20	IDGD	
CC(=O)CCCCCCC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	763379602	ZIGKXQKTSMOIEX-UHFFFAOYSA-N	439.534	1.398	50	20	IDGD	
O=C(NNC(=O)c1cccnc1)C(=O)Nc1cccc(N2C(=O)c3ccccc3C2=O)c1	763488737	PBSVINMCQLRFDS-UHFFFAOYSA-N	429.392	1.282	50	20	IDGD	
N#CCn1cc(NC(=O)C(=O)NNC(=O)CCCOc2ccc(Cl)cc2Cl)cn1	763506143	RRIWZWPSYLTJBL-UHFFFAOYSA-N	439.259	1.659	50	20	IDGD	
CC(C)(C)c1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(CC(N)=O)cc2)cc1	763594168	HLPVRXFDAPIOGX-UHFFFAOYSA-N	426.473	1.177	50	20	IDGD	
O=C1CN(S(=O)(=O)c2ccc(C(=O)NNc3c(Cl)cccc3Cl)cc2)CCN1	763608996	LFGUJFHELHIENF-UHFFFAOYSA-N	443.312	1.871	50	20	IDGD	
CC(=O)N1CCCc2cc(NC(=O)C(=O)NNC(=O)c3c(C)nc4ccccn34)ccc21	763624399	MLLBIZCZGJBSIU-UHFFFAOYSA-N	434.456	1.342	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccc(-c2nccn2C)c1	763682761	VYJFPJPMBFQRIB-UHFFFAOYSA-N	437.456	1.651	50	20	IDGD	
C[C@H]1CN(C(=O)C(=O)NNC(=O)COc2ccc(Br)cc2)c2ccccc2O1	763693582	DYWWEJVZJWUSHU-LBPRGKRZSA-N	448.273	1.789	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)C(=O)Nc2cccc(-n3cccc3)c2)c2ccccc2c1=O	763789773	CPRMSWZESVABOO-UHFFFAOYSA-N	430.424	1.124	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)C(=O)Nc2scnc2CC)c2ccccc2c1=O	763804947	PLRGACIRCGBFMX-UHFFFAOYSA-N	442.501	1.615	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(S(=O)(=O)N(CC)CC)cc2)cc1	763831613	QDWBXCRNOZXFPS-UHFFFAOYSA-N	446.529	1.679	50	20	IDGD	
COC(=O)c1cc(Cl)ccc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccccc1F	763858433	RZWWBGZRCPCKFR-SNVBAGLBSA-N	437.811	1.819	50	20	IDGD	
CCn1cnnc1-c1cccc(NC(=O)C(=O)NNC(=O)Cc2c[nH]c3ccccc23)c1	763861213	PPJFCNHVJNUCDJ-UHFFFAOYSA-N	431.456	1.775	50	20	IDGD	
COc1cc(OC)c(OC)cc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccc(F)cc1	763873140	RZRFQQSZBBGSIW-NSHDSACASA-N	435.408	1.405	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2cccc(C(=O)OCc3ccccc3)c2)n1	763884174	CAGPOULTUUFENG-UHFFFAOYSA-N	449.467	1.643	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)CCSc2ccc(F)cc2)n(C2CCOCC2)n1	763902608	PBOOWWYTJBKYPQ-UHFFFAOYSA-N	449.508	1.950	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)CCCC(=O)N3)cc1OC	763904031	XWLOTPACVXREAN-UHFFFAOYSA-N	440.456	1.768	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(N(C)C(C)=O)cc2)cc1OC	763912421	ZQHQXQVQYGNOOI-UHFFFAOYSA-N	442.472	1.866	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2C)cc1	763958225	SLBSDZLOOQKJII-UHFFFAOYSA-N	432.502	1.425	50	20	IDGD	
CN(C)C(=O)COc1cccc(NC(=O)C(=O)NNC(=O)c2cccc3ccccc23)c1	764047763	HCQHYUHGHVXWAW-UHFFFAOYSA-N	434.452	1.707	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cccc3ccccc23)cc1S(N)(=O)=O	764050185	BGCCXOMJLFCUQN-UHFFFAOYSA-N	426.454	1.195	50	20	IDGD	
Cn1c(=O)oc2c(NC(=O)C(=O)NNC(=O)c3cccc(Br)c3)cccc21	764063215	LFFJWYYEKYKMBB-UHFFFAOYSA-N	433.218	1.294	50	20	IDGD	
Cc1nnnn1-c1cc(NC(=O)C(=O)NNC(=O)Cc2ccc3ccccc3c2)ccc1F	764090615	DINOLWMRWTZDEC-UHFFFAOYSA-N	447.430	1.592	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)CC(F)(F)F)nn1CCCOc1ccc(F)cc1	764116940	QFOCVYACACPQAD-UHFFFAOYSA-N	445.373	1.838	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1O)C(=O)Nc1ccnn1CCc1ccccc1	764126433	KSRLSWAFNZSZLC-UHFFFAOYSA-N	427.848	1.885	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(-c3nnc4n3CCCCC4)cc2)cc1	764177628	RVPHYUHONKYIJZ-UHFFFAOYSA-N	443.467	1.943	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2cc(F)ccc2Br)c(OC)n1	764270078	DVPAGNOKHIBXFJ-UHFFFAOYSA-N	441.213	1.400	50	20	IDGD	
Cc1cc(OCc2cccc(F)c2)ccc1NC(=O)C(=O)NNC(=O)Cc1cc[nH]n1	764296825	FZWLZIGMVOBJRX-UHFFFAOYSA-N	425.420	1.765	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)C(=O)Nc1ccccc1SCCC(N)=O)c1ccccc1	764327542	ARSRAPAMFCHNKZ-OAHLLOKOSA-N	428.514	1.934	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)C(=O)Nc1ccccc1N(C)S(C)(=O)=O)c1ccccc1	764330835	YPZRIHFEBHTESI-OAHLLOKOSA-N	432.502	1.362	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)C(=O)Nc1cnn(-c2ccccc2Br)c1	764385611	DYFVJNHGZBFURU-UHFFFAOYSA-N	443.261	1.738	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cc(C(N)=O)ccc3C)n[nH]2)cc1C	764388624	UGWLRMHGIJXWSO-UHFFFAOYSA-N	434.456	1.501	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ncccc2C)ccc1Br	764389765	XZVQCHOFVBSDRR-UHFFFAOYSA-N	435.234	1.339	50	20	IDGD	
Cc1ccn(-c2ccccc2NC(=O)C(=O)NNC(=O)CSc2ccccc2O)n1	764400019	DWIHADKXARGRKN-UHFFFAOYSA-N	425.470	1.765	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)CCCOc2ccc3c(c2)OCO3)c1	764528668	RZIYYLUQUWKZKY-UHFFFAOYSA-N	449.485	1.286	50	20	IDGD	
Cc1ccccc1-n1nc(C)c2cc(C(=O)NNC(=O)N[C@@H]3CCS(=O)(=O)C3)sc21	765070601	LSKGNSURRXEXDL-CYBMUJFWSA-N	447.542	1.835	50	20	IDGD	
COC(=O)c1ccc(C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)cc1	765757784	GFCQNKZHAZCLRE-UHFFFAOYSA-N	444.919	1.705	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3ccc(-c4ccco4)nc3O)CC2)cc1	766647860	WXWTYFWJEBOUNO-UHFFFAOYSA-N	449.511	1.934	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)C[C@@H]3C(=O)Nc4ccccc43)CC2)cc1	766648909	LRVGWRJIUQKKQQ-FQEVSTJZSA-N	435.528	1.386	50	20	IDGD	
O=C(Cn1cc(Br)cc([N+](=O)[O-])c1=O)NNC(=O)c1cccc(Cl)c1	767208840	NIFIFOMRZAAFOR-UHFFFAOYSA-N	429.614	1.634	50	20	IDGD	
COc1cc(S(=O)(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)cnc1Cl	767474556	DHHANZUETVOEFS-UHFFFAOYSA-N	433.273	1.023	50	20	IDGD	
CCn1c(=O)oc2cc(S(=O)(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)ccc21	767476251	XDDRVRLOYWTLJS-UHFFFAOYSA-N	442.494	1.229	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](OCC(=O)NNc2ccccc2S(C)(=O)=O)C1	768007187	MYJUIZWSDLNMKL-AWEZNQCLSA-N	427.523	1.949	50	20	IDGD	
CN(C)C(=O)c1cc(F)ccc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccccc2)on1	768238503	AUBGLBJDSMJTEV-UHFFFAOYSA-N	439.403	1.582	50	20	IDGD	
COc1ccc(NNC(=O)[C@@H](CSC)N2C(=O)[C@H]3CCCC[C@H]3C2=O)c([N+](=O)[O-])c1	768332281	RXTDOZRDJLZZCE-DVOMOZLQSA-N	436.490	1.953	50	20	IDGD	
Cc1cc(C)nc(SCc2ccc(C(=O)NN=Cc3cn(CC(=O)O)nn3)cc2)n1	768477765	YOESEBSBFWOMEQ-UHFFFAOYSA-N	425.474	1.826	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1	768612015	MACVHNUFAIOOOR-UHFFFAOYSA-N	431.430	1.950	50	20	IDGD	
COc1ccc(NNC(=O)c2nc(C)n(-c3n[nH]c(C(F)(F)F)n3)n2)c([N+](=O)[O-])c1	769309339	FTRBKJGNLWOUOC-UHFFFAOYSA-N	427.303	1.386	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1c(C)c2cc(Br)ccc2oc1=O	772184417	DTVYEYUHAVFPLV-SECBINFHSA-N	425.235	1.967	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)N[C@H]3CC(=O)N(C4CCCCC4)C3)nc21	772564320	YXIVYFZSLHNPAV-LBPRGKRZSA-N	430.513	1.847	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)C[C@H](O)c3cccc(F)c3)cc2)CC1	772818727	XUXQCEBGOSBHEM-IBGZPJMESA-N	436.509	1.329	50	20	IDGD	
Cc1ccc(-n2nccc2NC(=O)C(=O)NNc2ccc(F)cc2Br)nn1	773478904	NRLIYGLVRSWKGD-UHFFFAOYSA-N	434.229	1.954	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)C(=O)Nc2cc(S(=O)(=O)N3CCCCC3)ccc2C)n1	773479302	GPFGUDXDUQBENW-UHFFFAOYSA-N	446.533	1.658	50	20	IDGD	
CC(=O)N(C)c1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)cc1	774001558	ICYIHMLXDHZANB-GFCCVEGCSA-N	432.864	1.876	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1Cl)N[C@H]1CCO[C@]2(CCS(=O)(=O)C2)C1	776077050	PWZDHPJFZHLZQZ-MEDUHNTESA-N	436.317	1.674	50	20	IDGD	
CCc1ccccc1OCC(=O)NNS(=O)(=O)c1ccc(C2(C(=O)OC)CC2)cc1	776271534	GYELXDWPXSZKMN-UHFFFAOYSA-N	432.498	1.842	50	20	IDGD	
C[C@H]1[C@H](C)N(C(=O)OC(C)(C)C)CCN1C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	776316024	DZAGIVWRAPPSGW-KBPBESRZSA-N	444.496	1.346	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(I)c(C(=O)NNc2ccccn2)c1	777473394	GTQCDPRGXQLJNB-UHFFFAOYSA-N	446.270	1.693	50	20	IDGD	
O=C(NNc1ccccn1)c1cccc(NS(=O)(=O)c2ccc3nnn(O)c3c2)c1	777531174	GPHAGGBGXWQKLS-UHFFFAOYSA-N	425.430	1.621	50	20	IDGD	
CC1CCC2(CC1)OC[C@@H](CNC(=O)NNc1ccc(S(=O)(=O)NC(C)C)cn1)O2	777761317	MDWKEMGYPWYRCT-XAUUPUKJSA-N	441.554	1.716	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)N[C@@H]1CCCOc2c(F)cccc21	778589413	QXFQFTXYNGIQSJ-CQSZACIVSA-N	435.481	1.977	50	20	IDGD	
CCOC(=O)N1CCC([C@@H](C)NC(=O)NNC(=O)c2nnc(O)c3ccccc23)CC1	779673343	KWNNSVUZFZBCSV-GFCCVEGCSA-N	430.465	1.536	50	20	IDGD	
COc1cccc(NNC(=O)c2cc(S(=O)(=O)N3CCOCC3)ccc2Cl)n1	780773470	YTNOSVFXTIZBJM-UHFFFAOYSA-N	426.882	1.521	50	20	IDGD	
CN1C[C@@H](C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c2ccccc2C1=O	781821332	GZJDQQHDRMLGFW-OAQYLSRUSA-N	435.528	1.216	50	20	IDGD	
Cc1cnn(Cc2cc(F)ccc2F)c1NC(=O)C(=O)NNC(=O)c1ccc(O)cc1	782832109	LTKGQZRTLHHKHS-UHFFFAOYSA-N	429.383	1.623	50	20	IDGD	
CCOC(=O)[C@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNc2ccc(F)cc2F)cc1	783344519	AWEDGTSYSJERHZ-NSHDSACASA-N	434.399	1.728	50	20	IDGD	
O=C(NNc1ccc(-n2cccn2)nn1)C(=O)Nc1ccc([S@](=O)C(F)(F)F)cc1	783433500	USCDAJIGLDIZIZ-PMERELPUSA-N	439.379	1.372	50	20	IDGD	
O=C(NNc1cccc2c1CCCC2)C(=O)Nc1cccc(N2CCS(=O)(=O)CC2)c1	783451263	LMDWHLWNCZETGP-UHFFFAOYSA-N	442.541	1.882	50	20	IDGD	
CC(C)(C)NS(=O)(=O)Cc1cccc(NC(=O)C(=O)NNc2nccnc2Cl)c1	784777986	OOYFLMKQOICYMG-UHFFFAOYSA-N	440.913	1.430	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(NC(=O)C(=O)NNc2ccccn2)ccc1Cl	784795658	CVNLZTYBPLGEOD-UHFFFAOYSA-N	425.898	1.847	50	20	IDGD	
C[C@H](c1ccccc1)n1ccc(NC(=O)C(=O)NNc2cccc(S(C)(=O)=O)c2)n1	784844532	LQGIJTTURCIEAV-CQSZACIVSA-N	427.486	1.978	50	20	IDGD	
CC(C)Cn1ncc(NC(=O)C(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)c1C(C)C	785023486	NJDWSIRDDZEGSU-UHFFFAOYSA-N	432.437	1.676	50	20	IDGD	
CSc1cc2c(cc1NC(=O)C(=O)NNC(=O)c1cc([N+](=O)[O-])ccc1O)OCCO2	785023502	JXEBCIQLABNTNS-UHFFFAOYSA-N	448.413	1.193	50	20	IDGD	
Cc1cnn(-c2ccc(NC(=O)C(=O)NNC(=O)c3cc([N+](=O)[O-])ccc3O)cc2F)c1	785023709	OHCMPANBOVVBEQ-UHFFFAOYSA-N	442.363	1.333	50	20	IDGD	
Cc1nc(Br)ccc1NC(=O)C(=O)NNC(=O)c1cc([N+](=O)[O-])ccc1O	785023876	OMLHIFCDZHLRAG-UHFFFAOYSA-N	438.194	1.166	50	20	IDGD	
CN1CCN(C(=O)c2ccc(NC(=O)C(=O)NNc3cc(F)c(F)c(F)c3)cc2)CC1	785088335	JGQFGWOWRFVOBL-UHFFFAOYSA-N	435.406	1.573	50	20	IDGD	
O=C(NNc1ccc(F)cc1F)[C@@H]1C[C@H](O)CN1S(=O)(=O)c1ccc(Cl)cc1	785881565	MHJBKTXDMOXHKE-LRDDRELGSA-N	431.848	1.885	50	20	IDGD	
CCNC(=O)Nc1ccc(C)c(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)c1	787544520	SDBKXZGHZFUNQD-ZDUSSCGKSA-N	445.451	1.829	50	20	IDGD	
CCOc1ccccc1[C@](N)(C(=O)NNc1nc(O)c2cnn(C)c2n1)C(F)(F)F	788000301	QSTVTJDJCYFNKF-INIZCTEOSA-N	425.371	1.327	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)[C@@H]1CCN(c2cccc(Br)c2)C1=O	788178338	NIQYWYWAYNVSLD-AWEZNQCLSA-N	442.277	1.921	50	20	IDGD	
Cc1nc(N2CCOCC2)nc(O)c1CCC(=O)NNc1nnc(-c2ccccn2)s1	788561263	ASWJYVAXBNCULJ-UHFFFAOYSA-N	442.505	1.317	50	20	IDGD	
COCCCN1C(=O)C(=NNC(=O)N2CCN(C)CC2)c2cc(Br)ccc21	790174211	QAKCZGGVJRXGDG-UHFFFAOYSA-N	438.326	1.493	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N1CC[C@H](N2CCCC2=O)C1	791010462	VISURTLIPRAYOU-OCCSQVGLSA-N	439.310	1.654	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc(-n2cccn2)c1	792356757	SUADSLUPIYXLLD-UHFFFAOYSA-N	445.439	1.466	50	20	IDGD	
O=C(NNc1nc2ccccn2n1)C(=O)Nc1cc(Br)cnc1-n1cccn1	792392138	SPEJZZIXPKVXMM-UHFFFAOYSA-N	442.237	1.154	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)N(CC(F)F)CCS3)n1	793068935	TWADUQFSFSQDPB-UHFFFAOYSA-N	435.456	1.967	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)ccc1Cl	793993199	WJOAZSHSARNFEP-UHFFFAOYSA-N	446.268	1.259	50	20	IDGD	
O=C(COC(=O)c1cc(F)ccc1-n1cccn1)NNC(=O)[C@@H]1COc2ccccc2O1	796086508	SXQAJVJSEIVMPW-SFHVURJKSA-N	440.387	1.156	50	20	IDGD	
CNS(=O)(=O)N1CCC(C(=O)NNc2c(F)cc(F)cc2Br)CC1	796654637	DXFHJKAJSADXQG-UHFFFAOYSA-N	427.271	1.347	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccn(-c3cccc(C(F)(F)F)c3)n2)n1	797369723	GFHOQWAATRFZFI-UHFFFAOYSA-N	432.362	1.994	50	20	IDGD	
COC(=O)[C@H]1CC[C@H](C(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)CC1	797877463	UDFZGFFIOOAGOA-HDJSIYSDSA-N	426.514	1.696	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)C2=NO[C@H](CNC(=O)OC(C)(C)C)C2)cc1C	798310930	YDBHGVIFIKXROG-AWEZNQCLSA-N	433.465	1.059	50	20	IDGD	
O=C(NCCNS(=O)(=O)c1ccc(F)cc1F)NNc1ncnc2ccsc12	799669176	INSLINRBTAWITO-UHFFFAOYSA-N	428.446	1.574	50	20	IDGD	
CSCC[C@H](NC(=O)c1ccc2ccccc2n1)C(=O)NNC(=O)N=c1cc[nH]cc1	802028175	MOZJMPIUVKPXSP-SFHVURJKSA-N	438.513	1.756	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)C2CCN(c3ccc4nnnn4n3)CC2)c(Cl)c1	802047594	DZCZCJJTWPBTLY-UHFFFAOYSA-N	429.872	1.550	50	20	IDGD	
O=C(CN1C(=O)c2ccc(Br)cc2S1(=O)=O)NNC(=O)c1cccs1	804920895	OQCHVTWQLSPSFQ-UHFFFAOYSA-N	444.288	1.116	50	20	IDGD	
O=C(COc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1nc2c(s1)CSCC2	806974048	RIRHNYTVVQPKKK-UHFFFAOYSA-N	426.907	1.751	50	20	IDGD	
CCN(C)C(=O)c1cccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)c1	806974906	HVQQDGHNLFRQEV-MRXNPFEDSA-N	440.500	1.949	50	20	IDGD	
O=C(CCCc1ccccc1)NNC(=O)C(=O)Nc1cc(F)c(N2CCOCC2)cc1F	806978001	IEIWTKABCCTHPP-UHFFFAOYSA-N	446.454	1.910	50	20	IDGD	
C=C(CNC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)c1ccccc1	807580144	MBDGRHNGTBVYAD-UHFFFAOYSA-N	430.534	1.357	50	20	IDGD	
O=C(CN1CCC(NS(=O)(=O)c2cccs2)CC1)NNC(=O)c1ccc(F)cc1	809930926	AAMPRGPHKMHTCX-UHFFFAOYSA-N	440.522	1.091	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCC(=O)NN=c2cc[nH]c3ccccc23)cc1OCC	810361376	MRKCTINVLOYPCS-UHFFFAOYSA-N	444.513	1.876	50	20	IDGD	
COc1cccc(NNC(=O)C(=O)Nc2cc(C)c(F)cc2C(=O)NCC(F)(F)F)n1	810382769	MQTRPMIAWUHTAM-UHFFFAOYSA-N	443.357	1.912	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)[C@@H]2CCCCN2C2CCCC2)cc1OC	815447224	NZAHREITMVMSPB-KRWDZBQOSA-N	433.505	1.805	50	20	IDGD	
COC(=O)C(C)(C)c1csc(NC(=O)C(=O)NNC(=O)c2cccc(N(C)C)c2)n1	815565390	MTOFTCNVANYZJX-UHFFFAOYSA-N	433.490	1.059	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)C(=O)Nc1ccn(-c2ccc(Br)cc2)n1	815567475	ZOCFETCDJXKVCH-UHFFFAOYSA-N	431.250	1.373	50	20	IDGD	
COC(=O)C(C)(C)c1csc(NC(=O)C(=O)NNC(=O)CCc2ccc(OC)cc2)n1	815568629	OSRMEASSHMYPKO-UHFFFAOYSA-N	448.501	1.321	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1cnn(-c2ccccc2)c1	815752041	ZKFCGXNNHSAPQH-UHFFFAOYSA-N	428.474	1.204	50	20	IDGD	
CN(C)NC(=O)Nc1cccc(NC(=O)CNS(=O)(=O)c2ccc(Cl)s2)c1	819557596	XJRXDKJQUHNXJO-UHFFFAOYSA-N	431.927	1.917	50	20	IDGD	
COc1cccc([C@H](CNC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)N(C)C)c1	838524597	MZWMJLRCPFIHOC-SFHVURJKSA-N	438.488	1.833	50	20	IDGD	
CC(=O)c1cccc(S(=O)(=O)NCC(=O)NNC(=O)CNc2ccc(C)cc2C)c1	913164319	FQHQBMYPUHXBHJ-UHFFFAOYSA-N	432.502	1.044	50	20	IDGD	
COc1ccccc1NCC(=O)NN=C1CCN(S(=O)(=O)c2c(C)n[nH]c2C)CC1	914554899	ZHJITHFMHPCCSJ-UHFFFAOYSA-N	434.522	1.404	50	20	IDGD	
COc1ccc([C@H](CNC(=O)NNC(=O)c2c(C)nc3ccccn23)N(C)C)cc1OC	915898080	QJQAUAJZJGLELK-INIZCTEOSA-N	440.504	1.907	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)NCCCN2C(=O)NC3(CCCC3)C2=O)cc1	915905953	AHVGJLZNXUNVMV-UHFFFAOYSA-N	433.534	1.672	50	20	IDGD	
CCN1CCN(Cc2ccccc2CNC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)CC1	916420433	XYNCJMPQTTUDSC-UHFFFAOYSA-N	440.504	1.877	50	20	IDGD	
O=C(NCc1cc(Br)ccc1F)NNC(=O)c1ccc(-n2cnnn2)cc1	916568303	JASJEBFFJWHHPR-UHFFFAOYSA-N	434.229	1.708	50	20	IDGD	
COc1cccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1OC	916969286	KWXWSCUGHSIAQI-UHFFFAOYSA-N	448.501	1.955	50	20	IDGD	
CN(C)N(C(=O)[C@@H]1CCN(c2cccc(Br)c2)C1=O)[C@@H]1CCS(=O)(=O)C1	917621316	AIWHQBNSBFGCEP-HUUCEWRRSA-N	444.351	1.294	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)Cc2ccc(C(=O)NNC(=O)c3csnn3)cc2)cc1	917905348	JLDPCGHIRPHYQR-UHFFFAOYSA-N	445.526	1.742	50	20	IDGD	
CC(=O)NCC1CCN(C(=O)NNC(=O)[C@@H](C)Oc2cccc(Br)c2)CC1	918003262	YSVGHIMZGIOYEA-GFCCVEGCSA-N	441.326	1.805	50	20	IDGD	
Cc1c(/C=C(\C#N)C(=O)N2CCN(C3=NS(=O)(=O)c4ccccc43)CC2)cc(C#N)n1C	918613895	ZLYJHCVRVUNXKJ-GZTJUZNOSA-N	448.508	1.405	50	20	IDGD	
Cc1c(/C=C(\C#N)C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc(C#N)n1C	918645718	XEIULIKXOGLJQI-YBFXNURJSA-N	437.525	1.663	50	20	IDGD	
Cc1nccn1-c1ccc(CNC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1F	920240113	YSBSNZJSRBWZAE-UHFFFAOYSA-N	445.476	1.868	50	20	IDGD	
COC(=O)c1ccc(F)c(S(=O)(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)c1	920308537	YFNOWNFCSBLDKX-UHFFFAOYSA-N	442.421	1.261	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2cccnc2N2CCCC2)c1	920417836	XOLHJTBAENGBKZ-UHFFFAOYSA-N	432.506	1.399	50	20	IDGD	
Cn1c(=O)oc2cc(S(=O)(=O)NNC(=O)NCc3cccc(C(F)(F)F)c3)ccc21	921298354	VIEJQUAIRWRVCQ-UHFFFAOYSA-N	444.391	1.843	50	20	IDGD	
O=C(CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@@H]12)NNC(=O)c1cc(Br)c[nH]1	921304596	XXCRIHKBEBVFMZ-GMXVVIOVSA-N	430.328	1.264	50	20	IDGD	
Cc1nc(CN2CCC(C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)CC2)cs1	1251736868	FXRKNVWBMCDUSY-UHFFFAOYSA-N	443.577	1.518	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3ccc(OCC4CC4)nc3)CC2)cc1	1319288918	DSHCHXAWPDTQCR-UHFFFAOYSA-N	437.544	1.758	50	20	IDGD	
C[C@H](c1ccncc1)N1CCC(NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)CC1	1319386793	MCSWTFAUBVTMQA-OAHLLOKOSA-N	445.545	1.655	50	20	IDGD	
C[C@H]1Oc2c(cccc2C(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)NC1=O	1339205359	YBPKKDIOTDFKPG-GFCCVEGCSA-N	432.477	1.814	50	20	IDGD	
O=C(NCCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Cl)C1)c1ccc[nH]1	1778024195	RYYJAONZGKYOIC-IDHHARJASA-N	428.892	1.183	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(O)c([N+](=O)[O-])c3)CCO2)C1	1781235346	YBWVBDNUOMEADF-ROUUACIJSA-N	446.287	1.980	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](C)[S@](=O)c3ccccc3)C2)C1	1782688428	WYRURXSWSOKCRT-VZDTXDAWSA-N	442.965	1.266	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H]3Cc4[nH]nc(C(F)(F)F)c4C3)C2)C1	1782847625	AYULPLBHLBHQOB-SUFBMKPHSA-N	448.873	1.991	50	20	IDGD	
C[C@H](N[C@H](C(=O)N1CC[C@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1)C1CC1)c1ccccc1	1782887484	JMKXIDLTCSSZKD-YLTWVVNKSA-N	449.979	1.545	50	20	IDGD	
C/C=C(\C)C(=O)N1CC[C@]2(C1)CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)CCO2	1783070906	SHVDXZSQTZAMIB-JTJFFURRSA-N	431.445	1.930	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cn4ccccc4n3)CCO2)C1	1783347832	POJQVPQHSAACAU-LIRRHRJNSA-N	435.322	1.951	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cn4ccsc4n3)CCO2)C1	1783534786	ZHXUZCZNJIIFGE-BDJLRTHQSA-N	427.324	1.623	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)CCO2)C1	1783880139	GHZLRTHZHUKSCF-CRAIPNDOSA-N	429.832	1.431	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc4c(c3)CCNCC4)C[C@@H]21	1784622806	VWOXECCAGVZEEJ-ROPHOZQPSA-N	448.995	1.771	50	20	IDGD	
Cc1c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)CBr)C[C@@H]32)cnn1C	1786185473	JVBBSYSUCXOPDI-MZGVZZPPSA-N	427.343	1.353	50	20	IDGD	
CC(C)N[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCBr)[C@H]2C1)C(C)C	1786406030	MWEBIAUMZDZYIU-NBOOPKSLSA-N	432.403	1.774	50	20	IDGD	
O=C(CCBr)Nc1ccc(C2(NC(=O)CNCP(=O)(O)O)CCC2)cc1	1787672851	GVDXJUHMYYNIFH-UHFFFAOYSA-N	448.254	1.630	50	20	IDGD	
Nc1nc(C(=O)Nc2ccc(C3(NC(=O)c4cccc(B(O)O)c4)CCC3)cc2)cs1	1788077709	GMVQASIJEVNEAL-UHFFFAOYSA-N	436.302	1.467	50	20	IDGD	
CC(C)n1nccc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21	1788934149	SDANQDWUDBNTQE-JURCDPSOSA-N	431.306	1.748	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCNC(=O)c3ccccc3)C[C@@H]21	1789863991	ALQJTPRHENEUHJ-OKYOBFRVSA-N	435.952	1.804	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4c(c3)C(=O)CC4)C[C@@H]21	1791256787	HZBWLZJETUBWNB-BOLBYERCSA-N	434.920	1.663	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CCCCC3(F)F)C[C@@H]21	1791288057	RAJJKTZGCGNHKF-NXOAAHMSSA-N	444.523	1.165	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3CCc4nc[nH]c4C3)[C@H]2C1	1791531439	UWXNEUKQSFDOQF-KWQCBRBASA-N	443.375	1.731	50	20	IDGD	
COc1ccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCBr)C3)cc1O	1792729693	RTCZGAOQQZPEDS-HBCWATKFSA-N	441.322	1.318	50	20	IDGD	
COc1ccc(/C=C/C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](O)CCl)c(F)c1	1792982826	QSULHJTURMLABK-UYDRDUHSSA-N	426.872	1.037	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(C)(C)NC(=O)OC(C)(C)C	1793629539	ZXFXPPAFOORISN-XGUBFFRZSA-N	447.960	1.133	50	20	IDGD	
CC[C@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnccc1C(=O)NN)C2)N(CC)CC	1793687940	JZKOQEAMFWWEGD-YYAJDYIMSA-N	430.553	1.057	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CC(=O)N(C2CCCC2)C1	1793777706	ADBQRSWNIOLGIS-MBZOWXSBSA-N	425.957	1.385	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCBr)c1cnc2c(c1)CCNCC2	1795495006	OUHCGXHDGNHRMC-BJWYYQGGSA-N	435.366	1.807	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1(c3ccccc3F)CC1)C2	1796190560	MAFNJGPLJMUBII-REPLKXPHSA-N	436.292	1.489	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CC(=O)OC(C)(C)C)C2	1796890894	OHQKJJNMZXZUJW-BDHJUDLHSA-N	445.520	1.490	50	20	IDGD	
Cn1ccc2cccc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)c3cccc(B(O)O)c3)C4)c21	1797582497	JNRFZIRNMMSYBU-ACDBMABISA-N	431.301	1.424	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C[C@@H]1CNc2ccccc2O1	1797677633	JLWKRZQREMAMGF-YTMVRGIBSA-N	437.924	1.093	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C=N/O[C@H]1CCCCO1	1797815264	LXDPIBNXXGHCJR-LVTADRLUSA-N	436.336	1.341	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2)c1ccc(-n2cccn2)nc1	1798212706	SWCWJZNPIGBWFT-JLVBRIDZSA-N	448.321	1.256	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@](C)(Cl)CCl	1799273529	JTGOJTCRIBKRRO-QKZHPOIUSA-N	430.170	1.843	50	20	IDGD	
Cc1ccn2c(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@@H](C)Br)cnc2c1	1800762518	TZNRVYSAVGGKAE-VWPFQQQWSA-N	435.322	1.629	50	20	IDGD	
C[C@H](Oc1cccnc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@](C)(Cl)CCl)C2	1801404598	XWRDXJUAOPQMQI-MABMQTIPSA-N	430.332	1.675	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1=NO[C@@H](c3ccccc3)C1)C2	1802336171	JHTMXLMJURGIMY-AJYBTWMASA-N	441.532	1.515	50	20	IDGD	
O=C(CN1CCSCC1)NC[C@H]1CCN(C(=O)C(Cl)Cl)[C@H]1c1cccnc1	1802448996	MUIAZQQQPDNMSQ-ZBFHGGJFSA-N	431.389	1.940	50	20	IDGD	
Cc1ccn2ncc(C(=O)N3CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]3c3cccnc3)c2c1	1803139658	SKCDJLIPFBKEGK-LSTHTHJFSA-N	441.919	1.957	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)CS(=O)(=O)CC)[C@@H]1c1cccnc1	1803510075	PPFILHMYWVJVAE-BQFCYCMXSA-N	429.970	1.930	50	20	IDGD	
CC(=O)N(C)CCC(=O)NC[C@@H]1CCN(C(=O)[C@H](C)Br)[C@@H]1c1cccnc1	1804071611	GIWCVPHVCPFTCV-QANKJYHBSA-N	439.354	1.739	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](O)CCl)C3)CC1	1804589005	YYRXJXYYLXAQPH-YYIAUSFCSA-N	443.972	1.871	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC2(CCCN(C(=O)c3cccnc3S)C2)CC1	1804876271	GFENJMPLXLMPIC-UHFFFAOYSA-N	433.578	1.588	50	20	IDGD	
CN(CC(=O)N1CCC2(CCCN(C(=O)[C@@H](O)CCl)C2)CC1)C(=O)OC(C)(C)C	1805519001	KAZXTZCZHAXREA-HNNXBMFYSA-N	431.961	1.684	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)C1CCCCC1	1806225265	KVWZKZPNTHHVIV-RBBKRZOGSA-N	435.333	1.661	50	20	IDGD	
CCOC(=O)/C=C/C(=O)NC[C@@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1	1806294059	LRBUSVFGOWGQBU-IDVWOMCOSA-N	438.322	1.992	50	20	IDGD	
C#CCCCCC(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1807374136	IRPNOLNNYUYBNP-NZQKXSOJSA-N	433.317	1.275	50	20	IDGD	
C=CCC(F)(F)C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1807374497	ZSBJLZJGAKZJRD-MJGOQNOKSA-N	443.259	1.292	50	20	IDGD	
N[C@@H](Cc1cscn1)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Cl)[C@H]1c1cccnc1	1808204458	CZCIMBSCLCUZDQ-QCEMKRCNSA-N	425.917	1.648	50	20	IDGD	
O=C(CC(F)(F)C(=O)O)NC[C@@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1	1808286968	FTUVIROLNMHOIO-WFASDCNBSA-N	448.264	1.982	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)[C@H]2C[C@H]2F)[C@@H]1c1cccnc1	1808416189	GPBFKUXVZXGEPR-QVFLAULMSA-N	440.479	1.579	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC2(CCCN(C(=O)c3cc(=O)n4[nH]cnc4n3)C2)CC1	1809965198	SKDVJLPRHANLQL-UHFFFAOYSA-N	446.584	1.114	50	20	IDGD	
CC(=O)NCCC(=O)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@@H]1c1cccnc1	1812662614	ZXTFOMCWEMQFQF-IMJJTQAJSA-N	429.290	1.304	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)[C@@H]1C[C@]1(F)Cl	1813151404	CIFMHQSFKRVSPK-DZKDUJFISA-N	445.687	1.006	50	20	IDGD	
C[C@H](Oc1ccccn1)C(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1	1813407239	SUEWWNJLHCNOSS-ITQYTPKQSA-N	432.908	1.550	50	20	IDGD	
CN1CCCn2nc(C(=O)N[C@H]3CCc4nc(NC(=O)[C@H](F)Cl)sc4C3)cc2C1	1817133016	CNWXCVNZSQUFML-BONVTDFDSA-N	440.932	1.935	50	20	IDGD	
CC(=O)C[C@@H](C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1	1817474833	HJPRWACBHXKDBN-ACJLOTCBSA-N	426.282	1.011	50	20	IDGD	
C[C@H](Nc1nccs1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1	1818083240	CFECMJILTVZMPI-CYZMBNFOSA-N	426.930	1.959	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H]1CC1(F)F)CC2	1819797331	SQHRBSSAMPWZPX-KCJUWKMLSA-N	436.444	1.023	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccccc1)CC2	1819797781	JYSILUAJUQGWGZ-CYBMUJFWSA-N	436.497	1.681	50	20	IDGD	
C[Si](C)(C)OCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCN1CCOCC1)CC2	1820162516	KMZXEWPRFRFKQQ-CQSZACIVSA-N	440.642	1.629	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](F)Br)n[nH]1	1820935445	MMMULBXENBROPF-UDZFHETQSA-N	430.278	1.783	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2)c1ccc(O)cc1	1822230208	ZDDXEGOELNDMPQ-HNNXBMFYSA-N	437.286	1.068	50	20	IDGD	
CC(=O)C(C)(C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1	1824375019	GJDUBDPBKQLQDW-LJQANCHMSA-N	443.548	1.534	50	20	IDGD	
CCOc1cnc(C(=O)N[C@H]2CCc3nc(NC(=O)[C@@H](Cl)COC)sc3C2)cn1	1825993545	JTWXZJQVWULCGG-QWRGUYRKSA-N	439.925	1.811	50	20	IDGD	
CCc1ccc(C(=O)N[C@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)cn1	1826080774	XRZAXHJQKONCRV-HNNXBMFYSA-N	444.561	1.699	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H](O)C(C)C)CC1	1827677454	UGWKOVNTRODCRH-LZVXGSKFSA-N	445.564	1.757	50	20	IDGD	
CCCNC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830353627	HJZVYAWATSYBPF-HXUWFJFHSA-N	431.961	1.014	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(C(N)=O)cc3)C2)C1	1830370489	QRSILYMJSPPQLF-OAQYLSRUSA-N	437.924	1.121	50	20	IDGD	
CC(C)=NO[C@@H](C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1	1830414480	GEHWXZJOPAZRDA-LAUBAEHRSA-N	443.353	1.401	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cccnc3)C2)C1	1830538428	FSPKDFBIHXULHQ-DNVCBOLYSA-N	440.338	1.112	50	20	IDGD	
O=C([C@H](O)CCl)N1CCC([C@@H]2CCCCN2C(=O)c2cnc3c(c2)CCNCC3)CC1	1831148260	UWLBHNLECSDCFP-LEWJYISDSA-N	448.995	1.603	50	20	IDGD	
C=CCOCCCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1	1831412048	BGOZYQWLYHUOCR-MOPGFXCFSA-N	437.364	1.662	50	20	IDGD	
CSCC(C)(C)C(=O)N1CCO[C@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1	1831534697	CVLDGUISZDJBSK-IBGZPJMESA-N	432.659	1.684	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H]2CNC(=O)C2)CC1	1831553006	FAIFYARUGJHHRC-OWCLPIDISA-N	428.371	1.916	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cn3nnc4ccccc43)C2)C1	1831640344	LMUMAWJFZSFWEG-HRAATJIYSA-N	449.939	1.295	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)C(=O)c3cccn3C)C2)C1	1831657905	CEOOLMUXVSAQRY-FOIQADDNSA-N	425.913	1.072	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(OC)nc3)CCO2)C1	1831945818	QYNRELQHRLQFNU-JXFKEZNVSA-N	425.913	1.568	50	20	IDGD	
C[C@@H](Nc1ccccc1)C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)CCl)CC2)CC1	1833309873	CECKKTGUNXYMTF-OXQOHEQNSA-N	436.984	1.658	50	20	IDGD	
Cc1ncc(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](C)Br)CC3)CC2)cn1	1834066153	FUFNMSUXPJIVJF-CYBMUJFWSA-N	438.370	1.754	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3ccccc3)CCO2)C1	1834842126	QYJVMWLLAAPSCU-UZLBHIALSA-N	439.350	1.859	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)c1cnc2ccccc2n1	1835275118	NYVOYRILOHONHN-HXUWFJFHSA-N	445.951	1.415	50	20	IDGD	
O=C(/C=N/O[C@@H]1CCCCO1)NC1CCN(C2CCN(C(=O)[C@@H](F)Cl)CC2)CC1	1835767599	GJSBEWDSHIZMFG-QLCJNQITSA-N	432.924	1.621	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC(OC2CCN(C(=O)C3CC(=O)C3)CC2)CC1	1836674420	OPXTYYVWYMBBDW-ZDUSSCGKSA-N	429.355	1.995	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)COC(C)(C)C)CC2)CC1	1837045864	OWFKSPRLBDJDLO-UHFFFAOYSA-N	440.585	1.173	50	20	IDGD	
C[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1)N1C[C@H]2C[C@H]2C1	1837279271	SUNZTDICENZATA-VWXURSGXSA-N	427.973	1.048	50	20	IDGD	
CCc1noc(C)c1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1	1838058761	WGCFUWOJTKBQJY-RTBURBONSA-N	448.347	1.852	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnc4snnc4c3)CCO2)C1	1838510045	VOCGNUWVQUDXJW-FZKQIMNGSA-N	439.925	1.174	50	20	IDGD	
CC(C)c1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCBr)C3)C2)on1	1838774819	XNDSOPIUFXZUBV-GOSISDBHSA-N	444.326	1.653	50	20	IDGD	
COc1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)c1	1838929083	XPVTYNUMCCBGGP-YJBOKZPZSA-N	445.285	1.456	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc(OC)c(F)c3)C2)C1	1839143309	SIOHWIMHRPYJMH-LIRRHRJNSA-N	429.876	1.317	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccc(F)c(C#N)c3)C2)C1	1839147072	GEYUMMYYBAFOOK-DYESRHJHSA-N	437.899	1.714	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)C(C)(C)C)C2)C1	1839962174	WPAJXZOWJABBEC-IYOUNJFTSA-N	435.359	1.023	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(F)c[nH]3)CCO2)C1	1840063853	QFANASFFJXPWIP-SJCJKPOMSA-N	432.290	1.255	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)C2CCC(C(F)(F)F)CC2)C1	1841799376	NORDBUFOLCOSMH-UHFFFAOYSA-N	432.487	1.932	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H]2OC[C@H](C(=O)N3CC4(CCCN4C(=O)[C@H](F)Cl)C3)[C@H]2C1	1843366534	DHLKDQUZQLZYBT-BARDWOONSA-N	445.919	1.606	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)c2cc3cc[nH]c3cc2Cl)C1	1843788877	GGJRLCPTLOGQJE-UHFFFAOYSA-N	437.692	1.632	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)Cc2ccc(OC)cc2[N+](=O)[O-])C1	1845260716	LEMOHQSJOLWZHW-OAHLLOKOSA-N	425.869	1.603	50	20	IDGD	
CC[C@@H](NC(C)=O)C(=O)N1CC2(CCCN2C(=O)/C(C#N)=C/c2ccc(F)cc2F)C1	1845870264	XNOGGVNRSADCMO-SCFJZMLDSA-N	430.455	1.990	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@H](NC(C)=O)c1cccc(Cl)c1)C2	1846363552	PNLVSGAIAIBYFC-IAGOWNOFSA-N	442.343	1.974	50	20	IDGD	
COc1ccc(/C=C/C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](O)CCl)c(OC)c1OC	1847558148	IDNOKTKLECNYBM-NNTPNQPMSA-N	438.908	1.527	50	20	IDGD	
CCc1nc2ccc(Cl)cn2c1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl	1847560333	QOTKDFLYAQZRIF-SOUVJXGZSA-N	425.316	1.965	50	20	IDGD	
Cc1ccc2[nH]cc(CC(=O)N3CC[C@H]4[C@@H]3CCN4C(=O)c3ccc(B(O)O)cc3)c2c1	1848144088	KOLQHPJTCZFVCR-VXKWHMMOSA-N	431.301	1.214	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)Cc2c(C)nc3nc(SC)nn3c2C)cc1OC	15761894	YBJSYVKCDAQCIY-UHFFFAOYSA-N	444.517	1.874	50	20	IDGD	
CC(C)NC(=O)Nc1ccc(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1	108068735	OHDYLNSVEIJYIL-UHFFFAOYSA-N	432.506	1.584	50	20	IDGD	
C[C@H](CC(=O)NNC(=O)c1cc(Br)c[nH]1)S(=O)(=O)c1ccc(F)cc1	303240501	JHKONHXVVZRSEJ-SECBINFHSA-N	432.271	1.930	50	20	IDGD	
NC(=O)NCCC(=O)NNC(=O)c1ccc(CN2C(=O)c3cccc4cccc2c34)cc1	725906679	YPWFAZAGQDJRMI-UHFFFAOYSA-N	431.452	1.820	50	20	IDGD	
CN(C)CC(=O)N1CCN(C(=O)/C(C#N)=C/c2cn(CCC#N)nc2-c2ccccc2)CC1	728203674	ZHTSYFXBKHWJOF-HMMYKYKNSA-N	445.527	1.603	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)CCc2nc(-c3nc[nH]n3)no2)c1	728609234	TWALMOXSYKLTEO-UHFFFAOYSA-N	436.226	1.020	50	20	IDGD	
O=C(CS[C@@H]1CCS(=O)(=O)C1)NNC(=O)c1ccc(Br)cc1Cl	728870405	HZUIFNWGXFAQJR-SECBINFHSA-N	441.756	1.784	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)CN2C(=O)N[C@](C)(c3ccc(F)cc3)C2=O)cn1	729692962	ASOATMYCPBPLID-LJQANCHMSA-N	446.464	1.014	50	20	IDGD	
C[C@H](NC(=O)NN[C@@]1(C)CCS(=O)(=O)C1)c1cc(F)ccc1N1CCC(O)CC1	730677359	IFZFLDDGLHUIGA-DJJJIMSYSA-N	428.530	1.229	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)c1cc(F)ccc1I	730780207	KFSSPHZMNKWSBT-UHFFFAOYSA-N	430.173	1.976	50	20	IDGD	
CN(C)S(=O)(=O)c1ccsc1C(=O)NNC(=O)c1ccc(Br)s1	732053140	XOGJQBWRENICFC-UHFFFAOYSA-N	438.350	1.897	50	20	IDGD	
COC(=O)C[C@@H]1c2cc(OC)c(OC)cc2CCN1[C@H](C)C(=O)NNC(=O)CC(C)C	732197012	JPYDWQPJRYAAQY-RHSMWYFYSA-N	435.521	1.748	50	20	IDGD	
CC(C)CNS(=O)(=O)c1cc(C(=O)NNC(=O)CN(C)C)c(Cl)cc1Cl	733360131	CRLGVOTVCWRAML-UHFFFAOYSA-N	425.338	1.250	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)NCCn2cccn2)cc1	734126153	VATLXOWFWPBHOT-LGMDPLHJSA-N	433.472	1.354	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)CC1CCN(C(=O)OC(C)(C)C)CC1	734241564	QIULXSJZKDRDHC-UHFFFAOYSA-N	443.545	1.879	50	20	IDGD	
COc1ccc(CN2CC[C@@H](NC(=O)NNC(=O)Cc3c[nH]c4ccccc34)C2=O)cc1	734683646	IZCRZAADQRJEFR-HXUWFJFHSA-N	435.484	1.851	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)CNC(=O)c2ccc(C#N)cc2)CC1	734882450	UJWIRRZPZTUQSL-UHFFFAOYSA-N	444.492	1.018	50	20	IDGD	
C[C@@H](Cc1cccc(F)c1)C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	735116834	HXERGLRADNGZCR-HNNXBMFYSA-N	435.525	1.479	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)c2cc(-c3cccnc3)nc3c2cnn3Cc2ccco2)cn1	735445111	IACVZTHPFLDKFX-UHFFFAOYSA-N	442.439	1.943	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)[C@@H]2CN(C(C)=O)c3ccccc3O2)cc1C	736744306	OLFVEVJISHZBMA-INIZCTEOSA-N	445.497	1.737	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)COc1ccc(Br)cc1)CN1CCOCC1	739050250	VIQXORAWQSWNIP-ZDUSSCGKSA-N	429.315	1.127	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)Cc1csc(NC(=O)Cc2cccs2)n1	740852599	DUDKEDKPYYSLDD-UHFFFAOYSA-N	437.547	1.381	50	20	IDGD	
CC(=NNC(=O)c1ccc(-n2cnnn2)cc1)c1cccc(N2CCCS2(=O)=O)c1	741161675	DLUULSNPMKRQKT-UHFFFAOYSA-N	425.474	1.356	50	20	IDGD	
Cc1nn2c(nc(N3CCCC3)c3ccccc32)c1C=NNC(=O)Cc1cc(O)nc(O)n1	743447924	SGAWQUYZRUNOKV-UHFFFAOYSA-N	446.471	1.685	50	20	IDGD	
COc1cc([N+](=O)[O-])c(C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)cc1SC	744952308	JRYGVTCXYXBYNO-UHFFFAOYSA-N	444.425	1.815	50	20	IDGD	
CCOC(=O)N1CCC(NC(=O)CCCNC(=O)NNc2ccc(Cl)nc2)CC1	745614447	CDYZKPSPUGRIIX-UHFFFAOYSA-N	426.905	1.878	50	20	IDGD	
Cc1ccccc1NS(=O)(=O)c1ccc(C)c(C(=O)NNC(=O)N2CCOCC2)c1	745991708	FOKZAZFYMSUHLJ-UHFFFAOYSA-N	432.502	1.791	50	20	IDGD	
Cc1ncsc1C(=O)NNC(=O)c1ccc(F)c(S(=O)(=O)Cc2ncon2)c1	746223313	IRUYDYVJXGDDLS-UHFFFAOYSA-N	425.423	1.022	50	20	IDGD	
Cn1ccnc(NNC(=O)CCCS(=O)(=O)c2ccc(Br)cc2)c1=O	747941409	DCIVZGQBZHDYOI-UHFFFAOYSA-N	429.296	1.240	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@]2(F)CCN(C(=O)OC(C)(C)C)C2)cc(OC)c1OC	748283811	NYYDXHDMMBNGCG-FQEVSTJZSA-N	441.456	1.823	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@@]2(F)CCN(C(=O)OC(C)(C)C)C2)cc(OC)c1OC	748283812	NYYDXHDMMBNGCG-HXUWFJFHSA-N	441.456	1.823	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)[C@@H](C)Nc2ccccc2OCC(=O)N2CCOCC2)c1	748601471	KUBMFSNWARYXJL-QGZVFWFLSA-N	440.500	1.494	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)CCOc3ccccc3F)cc2)CC1	748618510	DFKPQAJWBNGQGC-UHFFFAOYSA-N	436.509	1.674	50	20	IDGD	
Cc1c(NNC(=O)CCC(=O)Nc2ccc3c(n2)n(C)c(=O)n3C)cccc1[N+](=O)[O-]	748673249	DLDNQWGUWMNSEQ-UHFFFAOYSA-N	427.421	1.351	50	20	IDGD	
CC[C@H](C(=O)N1CCC(NC(=O)NN[C@]2(C)CCS(=O)(=O)C2)CC1)c1ccccc1	749191539	SULPIUXUVIGUQJ-GHTZIAJQSA-N	436.578	1.552	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)c2ccc(Br)c(S(C)(=O)=O)c2)c1O	749267205	RCJWKLOUHWJQJV-UHFFFAOYSA-N	443.275	1.642	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)c1nn(-c2ccccc2)cc1O)CNC(=O)OC(C)(C)C	749870527	NSURKSMOOVBZCF-ZDUSSCGKSA-N	432.481	1.683	50	20	IDGD	
Cc1nn(-c2cncc3nnnn23)c(C)c1CC(=O)NNc1ccccc1Br	750423196	DQSVMXNANSRUPK-UHFFFAOYSA-N	442.281	1.770	50	20	IDGD	
O=C(NNC(=O)c1cnc2n1CCCC2)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	750721114	LKTHEWMSURNBNV-UHFFFAOYSA-N	442.483	1.996	50	20	IDGD	
C[C@H](CC(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1)c1ccc(F)cc1F	751859342	OZXXFRMSUYVQFV-XIKOKIGWSA-N	434.395	1.989	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)COCCNC(=O)c3ccccc3)nc21	752271305	VCQBECNXNOUPRD-UHFFFAOYSA-N	427.465	1.177	50	20	IDGD	
COc1cc(OC)cc(N2C[C@@H](C(=O)NNC(=O)COc3ccc(F)cc3)CC2=O)c1	752399045	PASIEOAEDQVZJJ-ZDUSSCGKSA-N	431.420	1.422	50	20	IDGD	
CCCC[C@@H](NC(=O)[C@H](C)NC(=O)C(C)(C)C)C(=O)NNc1cc(Cl)nc(N)n1	753450341	TWWSCCRMUOSSML-WDEREUQCSA-N	427.937	1.381	50	20	IDGD	
COc1cccc([C@H](C)CC(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1	753540215	VUCGZZODIKDKBR-AUUYWEPGSA-N	428.441	1.719	50	20	IDGD	
O=C(NNC(=O)c1c(Cl)cccc1Cl)NC1CCN(S(=O)(=O)C2CC2)CC1	753894862	XKBBLQFXZUTROE-UHFFFAOYSA-N	435.333	1.894	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NN=Cc1cn(C)nc1C)N(S(C)(=O)=O)CC2	755571446	BLMJUFAXCQAIAP-KRWDZBQOSA-N	449.533	1.145	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)c2cc(S(N)(=O)=O)c(C)o2)c1	755665659	UBPIMMPIVOMVRI-UHFFFAOYSA-N	432.252	1.081	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)NNC(=O)c3ccc4c(c3)OCCO4)cn2)C[C@H](C)O1	755866141	RXVMBPDWMKVOFO-KBPBESRZSA-N	427.461	1.933	50	20	IDGD	
NS(=O)(=O)c1cc(F)cc(NC(=O)NNC(=O)c2cccc(Br)c2)c1	756517805	ZRJXJDDDQHCDCE-UHFFFAOYSA-N	431.243	1.702	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1ccccc1-c1cc(F)c(F)c(F)c1	756855828	NPYGOBCKQGFAHM-VIFPVBQESA-N	430.408	1.861	50	20	IDGD	
C[C@@]12CCC(=O)N1c1ccccc1C(=O)N2CC(=O)NNc1nc(O)c2ccccc2n1	758299215	QROZJBSOWQGZLD-QFIPXVFZSA-N	432.440	1.778	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@@H]1CCCC[C@H]1NC(=O)NNC(=O)C(=O)Nc1ccccn1	758814269	YZLBAFPBELSYCM-UONOGXRCSA-N	434.497	1.434	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)c1cnc([C@@H]2CCCO2)s1	760224943	YKSKQTHZPMKRRG-KRWDZBQOSA-N	429.546	1.968	50	20	IDGD	
O=C(NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)c1ccc(-n2ccnn2)cc1	760263270	JQAHCUYJXRTRAU-UHFFFAOYSA-N	440.485	1.127	50	20	IDGD	
COc1ccc(C(=O)C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1Cl	760797979	LAUHNNKHCKDCKN-UHFFFAOYSA-N	446.268	1.293	50	20	IDGD	
CC(=O)N1CCc2cc(C(=O)OCC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)ccc21	760957281	AUVHKHXQJJYZRT-UHFFFAOYSA-N	426.385	1.122	50	20	IDGD	
CCN(CC)CCNC(=O)c1cc(NC(=O)C(=O)NNC(=O)C(C)(C)C)ccc1Cl	761072351	LZEGUSCIUKVQEB-UHFFFAOYSA-N	439.944	1.544	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)c2ccccc2OC)c(OC)c1	761272937	QGRDCORWFQDWRO-UHFFFAOYSA-N	443.503	1.089	50	20	IDGD	
CC(=O)N[C@@H](C)c1ccc(S(=O)(=O)NNC(=O)CSc2ccccc2O)s1	763411733	KCSYTQDRHWMVQT-JTQLQIEISA-N	429.545	1.753	50	20	IDGD	
CC(=O)N[C@H](C)c1ccc(S(=O)(=O)NNC(=O)CSc2ccccc2O)s1	763411734	KCSYTQDRHWMVQT-SNVBAGLBSA-N	429.545	1.753	50	20	IDGD	
COC(=O)c1ccc(OC(C)C)c(NC(=O)C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c1	763446406	SLJLKWGTITVSOI-UHFFFAOYSA-N	444.400	1.568	50	20	IDGD	
O=C(NNC(=O)c1c[nH]c2ccccc12)C(=O)Nc1ccc(F)c(-n2nnnc2C2CC2)c1	763535436	CKGITOXBLBPSHN-UHFFFAOYSA-N	448.418	1.560	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)C(=O)Nc1cc(F)c(N2CCCC2)c(F)c1	763559574	UMQIVGDQCXRJGX-UHFFFAOYSA-N	432.383	1.693	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)cnc1Br	763571300	LWUYNOWXNRPIIT-CYBMUJFWSA-N	435.234	1.078	50	20	IDGD	
COc1ccc(Cn2nccc2NC(=O)C(=O)NNC(=O)COc2cccc(C)c2)cc1	763623840	IWCNHYJWEGGYKX-UHFFFAOYSA-N	437.456	1.413	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(N2CCCC2)c(F)c1	763662823	ANMAVOQWWFFPSY-UHFFFAOYSA-N	430.436	1.599	50	20	IDGD	
Cn1ccnc1C(=O)c1ccc(NC(=O)C(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)cc1	763723864	SZYDXGOUPJFQRU-UHFFFAOYSA-N	449.511	1.953	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)ccc1Cl	763732565	CQKWGIWCQFIGTM-UHFFFAOYSA-N	444.875	1.665	50	20	IDGD	
O=C(CSc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1ncn(Cc2ccccc2)n1	763736686	SUYKAOATHMQUDI-UHFFFAOYSA-N	444.904	1.858	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2ccn([C@H](C)c3ccccc3)n2)c1	763772259	PFRNMYWKEKBTOV-CQSZACIVSA-N	437.456	1.909	50	20	IDGD	
CC(C)n1ncc2ccc(NC(=O)C(=O)NNC(=O)COc3ccccc3[N+](=O)[O-])cc21	763803313	LBDMKMNGZOESJJ-UHFFFAOYSA-N	440.416	1.690	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(CCN(C)C)cc2)cc1	763877584	LQBFDGGMUPRQKG-MRXNPFEDSA-N	440.500	1.547	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)C(=O)Nc1cccc(-c2cn(Cc3ccccc3)nn2)c1	763993233	MMEUFNCHAKBCPJ-UHFFFAOYSA-N	443.467	1.732	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(OC(F)F)c(F)c2)c1	764077273	LUVLEEYRHFNWDE-UHFFFAOYSA-N	445.375	1.230	50	20	IDGD	
COCCSc1ccc([N+](=O)[O-])cc1C(=O)NNC(=O)CNC(=O)c1cccs1	764102116	KOIYEWDMRDACIZ-UHFFFAOYSA-N	438.487	1.586	50	20	IDGD	
CC(C)CNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)cc1	764126415	KGROENZQADCSMK-UHFFFAOYSA-N	432.864	1.831	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1cc2c(cc1[N+](=O)[O-])OCCCO2	764135503	HOTUJWKUFWDDEG-UHFFFAOYSA-N	444.400	1.093	50	20	IDGD	
COC(=O)c1ccc(OC(C)C)c(NC(=O)C(=O)NNC(=O)CCc2ccccc2)c1	764191901	JANLICIXLVHJKA-UHFFFAOYSA-N	427.457	1.979	50	20	IDGD	
NC(=O)CCOc1ccccc1NC(=O)C(=O)NNC(=O)c1c(Cl)cccc1Cl	764226213	KBJRINAIDAHIAL-UHFFFAOYSA-N	439.255	1.647	50	20	IDGD	
CCCCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(C#N)c2)cc1	764234783	IZPNNZFGZMIEDW-UHFFFAOYSA-N	443.485	1.500	50	20	IDGD	
COCCOc1ccc(C(F)(F)F)cc1NC(=O)C(=O)NNC(=O)Cc1cccnc1	764267666	IUYMJNCCOKUDMI-UHFFFAOYSA-N	440.378	1.454	50	20	IDGD	
COc1ccccc1COc1cccc(NC(=O)C(=O)NNC(=O)Cc2cc[nH]n2)c1C	764296652	DUGQATXYRGQRKS-UHFFFAOYSA-N	437.456	1.634	50	20	IDGD	
COCC(=O)NNC(=O)C(=O)Nc1ccc(N2C[C@H](C)O[C@H](C)C2)c(C(F)(F)F)c1	764303835	PJYFKWNWYUDHMT-PHIMTYICSA-N	432.399	1.051	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)C(=O)Nc1ccc(NC(=O)NCc2ccco2)cc1	764355489	CKDLJSPLFRYXQZ-UHFFFAOYSA-N	436.428	1.325	50	20	IDGD	
Cc1cc(C)nc(Sc2ccc(NC(=O)C(=O)NNC(=O)c3cnn(C)c3)cc2)n1	764362222	BLGNWGULYGFUHR-UHFFFAOYSA-N	425.474	1.378	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cc(C(N)=O)ccc3C)n[nH]2)cc1	764384610	GHZBHIZZJXNJOF-UHFFFAOYSA-N	434.456	1.446	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)C(C)C)cc1NC(=O)C(=O)NNC(=O)c1ncccc1C	764385909	PMBFXJBAIDCSMY-UHFFFAOYSA-N	447.517	1.127	50	20	IDGD	
C[C@H](C(=O)NNC(=O)COc1ccccc1-c1ccccc1)S(=O)(=O)C1CCOCC1	764526594	WRTOHUXWXOTZNI-MRXNPFEDSA-N	446.525	1.862	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NN=Cc3cc(C)c(O)c(C)c3)CC2)cc1	764819975	UMGMYIMULLTGTC-UHFFFAOYSA-N	444.557	1.774	50	20	IDGD	
Cc1ccc([C@@H](C)[C@@H](O)C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)cc1	765129087	YJNZXQHBBXUBTI-OXQOHEQNSA-N	433.530	1.624	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2ccc([N+](=O)[O-])c3cccnc23)c2ccccc2c1=O	765529299	KNJNMIGMGPXXER-UHFFFAOYSA-N	432.396	1.948	50	20	IDGD	
C[C@H](NC(=O)OC(C)(C)C)[C@@H]1COCCC1=NNC(=O)c1ccc(-n2cnnn2)cc1	766015490	MIZSWYZXPNZRGK-BBRMVZONSA-N	429.481	1.698	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1ccc2c(c1)CCN2C(=O)OC(C)(C)C	766264540	LKTZSJPPZVOCBN-UHFFFAOYSA-N	428.449	1.865	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)[C@@H](c1cccc(F)c1)N1CCOCC1	767354473	VJFCKZFHXBENJW-JOCHJYFZSA-N	443.475	1.441	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(O)c(C(=O)NNC(=O)c2cccc(Br)c2)c1	768196628	FMGKTJWJDQSAHH-UHFFFAOYSA-N	442.291	1.480	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc2nc(O)cc(C(=O)NNC(=O)c3cc(C)[nH]n3)c2c1	768276007	HUHWDZASCPMOPD-UHFFFAOYSA-N	446.489	1.077	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)NC3CCN([C@H]4CCCC[C@@H]4O)CC3)nc21	770411322	GDHMFFDOICVUTR-HOTGVXAUSA-N	446.556	1.681	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)N2CCN(CC(=O)NNC(=O)c3cccc(C)c3)CC2)c1	770728794	OYCZSZOOCHQOMD-UHFFFAOYSA-N	438.528	1.596	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)CCCOc1ccc(I)cc1	772042151	FWMKLKXLYTUOLC-NSHDSACASA-N	448.257	1.939	50	20	IDGD	
N#Cc1cnn(-c2ccc(C(=O)NNC(=O)C(=O)NCc3ccc(Cl)cc3)cc2)c1N	772891746	MWVFBDYSQSMQML-UHFFFAOYSA-N	437.847	1.057	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)CCNS(=O)(=O)c1ccccc1F	772971158	JLNJGXLZXCGXDB-GFCCVEGCSA-N	443.884	1.762	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)c1ccc(C[C@H]2CC(=O)NC2=O)cc1	772971374	ZCOLACIDZAXYNU-DOMZBBRYSA-N	429.860	1.774	50	20	IDGD	
COC(=O)c1c(F)cccc1NNC(=O)CN1C(=O)N[C@@](C)(c2ccc(C)cc2)C1=O	773640290	BRFMYPVDKDVMFM-NRFANRHFSA-N	428.420	1.831	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)N[C@H](CS(C)(=O)=O)c1ccccc1	774281066	BIQRFMKCQFPXLA-OAHLLOKOSA-N	437.543	1.904	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)NCc2ccc(S(N)(=O)=O)cc2C)cc1OC	775203669	VZBKONYVIPGHOY-UHFFFAOYSA-N	436.490	1.194	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](OCC(=O)NNc2cccc(S(C)(=O)=O)c2)C1	776538840	KURGDLBLPQTUOM-HNNXBMFYSA-N	427.523	1.949	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)COC1CCN(C(=O)OC(C)(C)C)CC1	777178171	QIDQEYGYDVCJSF-UHFFFAOYSA-N	430.502	1.075	50	20	IDGD	
Cc1ccc2[nH]c3c(c2c1)C[C@@H](NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)CC3	778590020	WTSNOXPMMSLPGN-HNNXBMFYSA-N	430.472	1.954	50	20	IDGD	
COC[C@H](C)n1ccc(NC(=O)C(=O)NNC(=O)c2sc(-c3ccccc3)nc2C)n1	778710260	RADNNRXACSKNCJ-LBPRGKRZSA-N	442.501	1.922	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)CSc2nnc3ccccn23)CC1	782711738	PFOZMDTXBLAWPQ-UHFFFAOYSA-N	449.537	1.551	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1cccc(C#Cc2ccccc2)c1	784005358	XESCEECEMCJKBE-UHFFFAOYSA-N	446.488	1.664	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)Nc1cc(-c2ccccc2)ns1	785024732	ZDCDBZOWBQCSQS-UHFFFAOYSA-N	427.398	1.824	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)NCc1ccc(S(C)(=O)=O)s1	786883081	QLPGWSQLRWJNEP-UHFFFAOYSA-N	427.504	1.460	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3cccnc3C(F)(F)F)cc2)CC1	788588737	XGXXLEICWKMVSQ-UHFFFAOYSA-N	443.451	1.793	50	20	IDGD	
COc1c(C)cnc(Cn2cnc(NC(=O)C(=O)NNc3cccc([N+](=O)[O-])c3)n2)c1C	789727493	SSMHIFIJZDEERU-UHFFFAOYSA-N	440.420	1.337	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)ncc1Br	789810496	PESDTAWDRPPVBT-BBRMVZONSA-N	447.289	1.811	50	20	IDGD	
O=C(NC[C@H](Cc1cccc(F)c1)C(=O)N1CCOCC1)NNc1ncncc1Cl	789842026	YWDQLLQRZNQTKV-AWEZNQCLSA-N	436.875	1.613	50	20	IDGD	
CN(C)CCn1c(=O)oc2ccc(NC(=O)C(=O)NNc3cccc(F)c3[N+](=O)[O-])cc21	790998158	ILRDLQMHHZIQPH-UHFFFAOYSA-N	446.395	1.285	50	20	IDGD	
CCc1c(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cnn1C(CC)CC	791589998	MZIBPYASFALGDK-LJQANCHMSA-N	444.488	1.951	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2nc3ccccn3n2)cc1I	792393375	FQYBOYOKDJLNNE-UHFFFAOYSA-N	436.213	1.724	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)c1ccc(S(=O)(=O)NCCC#N)cc1	794710492	MBTVYBWUXXQUPK-UHFFFAOYSA-N	436.877	1.615	50	20	IDGD	
Cc1cc(N2C[C@H](C(=O)NNc3ccccc3S(=O)(=O)N(C)C)CC2=O)ccc1F	795160666	IBKTTXXEDMMDQT-CQSZACIVSA-N	434.493	1.881	50	20	IDGD	
CCOC(=O)c1ccc(OC)c(S(=O)(=O)NNC(=O)c2ccc3c(c2)OCCO3)c1	795290990	ULNMBNHDXVYAGH-UHFFFAOYSA-N	436.442	1.266	50	20	IDGD	
COC(=O)c1cc(F)c(Br)cc1NC(=O)C(=O)NNc1cc(C)nc(C)n1	797050930	XVNRJHFJJZTHBK-UHFFFAOYSA-N	440.229	1.863	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)cnc1OCC1CC1)C(=O)Nc1ccccn1	797163455	ZMMPZFXOQSKZLJ-UHFFFAOYSA-N	434.250	1.428	50	20	IDGD	
Cc1nc2cc(NC(=O)C(=O)NNC(=O)CNC(=O)OCc3ccccc3)ccc2o1	797368347	ALGKQIGKIXOVOM-UHFFFAOYSA-N	425.401	1.149	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CCn2c(S)nc3ccccc3c2=O)cc1C	798309811	KSNKQRVLCVTQBU-UHFFFAOYSA-N	439.497	1.478	50	20	IDGD	
O=C(NCC(F)(F)F)NNC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O	798316556	PEHVLFXUGKXZDM-UHFFFAOYSA-N	438.409	1.761	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@H]1CC(C(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)=NO1	798961633	ABYMHGXPKJPVPP-SNVBAGLBSA-N	448.484	1.400	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(OC(F)(F)F)c(C#N)c2)c1	799834454	NHAGFVLLHGSXLB-UHFFFAOYSA-N	436.346	1.930	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN1S(=O)(=O)c1cccc([N+](=O)[O-])c1)Nc1ccccc1	801989560	CTXQPGRZTOLBPL-MRXNPFEDSA-N	433.446	1.601	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)NS(=O)(=O)c2cnc3n2CCC3)c(C)n1C[C@H]1CCCO1	802206982	PMZNAKKMZOAVAQ-DAIOKFOQSA-N	443.529	1.839	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(OCC(=O)NNc2ncccc2F)c([N+](=O)[O-])c1	804214404	WJVOYAZHKNYYRM-UHFFFAOYSA-N	441.441	1.682	50	20	IDGD	
Cn1nnc2c1C[C@H](C(=O)NNC(=O)COc1ccc(OCc3ccccc3)cc1)CC2	809933767	UCIARRKTKFXGRT-QGZVFWFLSA-N	435.484	1.725	50	20	IDGD	
N#Cc1ccc(S(=O)(=O)NCC(=O)NNc2ccc(Br)c(F)c2)cc1	811140453	ZMSRWYTTZUUTIY-UHFFFAOYSA-N	427.255	1.881	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)NCC2=CCCOC2)cc1	813712891	POUSXKQTGKKLBZ-WQRHYEAKSA-N	435.484	1.804	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1)[C@@H]1OCCc2sccc21	814222701	RRRXSBPOCDDVKH-PSLIRLAXSA-N	443.934	1.760	50	20	IDGD	
NS(=O)(=O)c1cc(C=NNC(=O)CCN2CCN(c3ccccc3)CC2)ccc1Cl	814696729	NRGKIEKLYXINCZ-UHFFFAOYSA-N	449.964	1.650	50	20	IDGD	
CCOC1CC(=NNC(=O)C[C@@H]2c3cc(OC)c(OC)cc3CCN2S(C)(=O)=O)C1	814758919	LTRSQJGAYVMJDZ-OMOCHNIRSA-N	439.534	1.624	50	20	IDGD	
CCOCC(=O)NNC(=O)C(=O)Nc1cc(Cl)ccc1I	815569957	MRYDKOKVNDTYSZ-UHFFFAOYSA-N	425.610	1.067	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCc2nncn2C1)C(=O)Nc1ccc(Br)cc1Cl	815692261	NIUIPYYYGHFWBI-MRVPVSSYSA-N	441.673	1.043	50	20	IDGD	
CC(C)n1cc2cc(NC(=O)C(=O)NNc3ccccc3S(=O)(=O)N(C)C)ccc2n1	815751796	ONSUXAZDVXZJJK-UHFFFAOYSA-N	444.517	1.949	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)[C@@H]2COCCN2CC(F)(F)F)c1	816716632	UYJTUXDTLBQCMP-LBPRGKRZSA-N	440.216	1.942	50	20	IDGD	
O=C1CN(S(=O)(=O)c2cccc(C(=O)NNc3ccccc3C(F)(F)F)c2)CCN1	911585879	NLCIZDRLXXKCOY-UHFFFAOYSA-N	442.419	1.583	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)OCC(=O)NCC(=O)N2CCCC2)c(C)n1C[C@H]1CCCO1	912619753	QHGXLRMQQGLSNX-PYIVIEQSSA-N	442.516	1.473	50	20	IDGD	
CCCOc1cccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c1	915872581	JLRVGQSUDTXQOX-UHFFFAOYSA-N	447.513	1.571	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NC[C@@H](c2ccco2)N2CCCCC2)c2ccccc2c1=O	915895938	QQJINSNSRZZEJP-KRWDZBQOSA-N	438.488	1.698	50	20	IDGD	
CN1CCN([C@@H](CNC(=O)NNC(=O)c2cccc(N(C)C)c2)c2cccs2)CC1	915902664	ZCKJEWQPHZEVLW-SFHVURJKSA-N	430.578	1.747	50	20	IDGD	
COc1ccccc1NCC(=O)NN=C(C)c1ccc(S(=O)(=O)N2CCNCC2)cc1	915920017	GEFOAAUYFKIRST-UHFFFAOYSA-N	445.545	1.241	50	20	IDGD	
CN(C)N(C(=O)[C@H]1CCN(c2ccccc2Br)C1=O)[C@@H]1CCS(=O)(=O)C1	916109924	OYGYMHIPWJTJDK-OLZOCXBDSA-N	444.351	1.294	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)c3ccc(S(=O)(=O)N4CCCC4)cc3)n[nH]2)o1	916125671	RRYCIHIBQDHBEL-UHFFFAOYSA-N	443.485	1.837	50	20	IDGD	
Cc1ncc2c(n1)CC[C@H](NC(=O)NNC(=O)c1nn(C(C)C)c(=O)c3ccccc13)C2	916319419	QZLNTACMGWJJAS-HNNXBMFYSA-N	435.488	1.577	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)N[C@H](C)c2ccc(OCC(=O)NC3CC3)cc2)n1	916488440	CQWPPDMXKOVUIR-OAHLLOKOSA-N	428.493	1.249	50	20	IDGD	
CN(CCCNC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)C(=O)OC(C)(C)C	916579964	RGOWJNHXLRLLBP-UHFFFAOYSA-N	428.511	1.291	50	20	IDGD	
COc1cc(CNC(=O)NNC(=O)c2cc3c(s2)CCC3)ccc1OCC(=O)N(C)C	916641601	WKLVKNQBXGWZEN-UHFFFAOYSA-N	446.529	1.857	50	20	IDGD	
O=C(COC(=O)CCCOc1ccccc1F)NNC(=O)[C@H]1COc2ccccc2O1	918773422	UODOTWJEBUGDGF-GOSISDBHSA-N	432.404	1.515	50	20	IDGD	
C[C@@H](NC(=O)COC(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccccc1)C(=O)N(C)C	918805330	SPWRDWMHMDBBRC-UWCCDQBKSA-N	448.483	1.507	50	20	IDGD	
C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	920807941	QWULVKKIAOUSIU-SNVBAGLBSA-N	445.819	1.724	50	20	IDGD	
CCCNC(=O)NNC(=O)COc1ccc(N(C)S(=O)(=O)c2cccs2)cc1	921042302	MCMWECJNUCWLJS-UHFFFAOYSA-N	426.520	1.692	50	20	IDGD	
COc1cc2c(cc1OC)CN(Cc1ccccc1NC(=O)NNC(=O)CCO)CC2	1320401223	WHKAEFSQLNTKCZ-UHFFFAOYSA-N	428.489	1.797	50	20	IDGD	
COc1ccc(Cl)c(NC(=O)NNC(=O)c2cc3c(c(S(N)(=O)=O)c2)CCC3)c1	1322746174	JIPCUDQHZMJMRX-UHFFFAOYSA-N	438.893	1.951	50	20	IDGD	
O=C(NNC(=O)c1cncn1-c1ccccc1)N[C@@H]1CC(=O)N(CCOc2ccccc2)C1	1323369689	OMAJYIYGYXAOLI-QGZVFWFLSA-N	448.483	1.496	50	20	IDGD	
CS(=O)(=O)Nc1cccc(F)c1CNC(=O)NNC(=O)c1ccc2c(c1)OCCO2	1323720235	OLDNVMMBJCBMJR-UHFFFAOYSA-N	438.437	1.113	50	20	IDGD	
O=C(NNC(=O)c1cncn1-c1ccccc1)N[C@H]1CCCN(Cc2ccccn2)C1=O	1325282838	HCKSICFSUOTVEU-SFHVURJKSA-N	433.472	1.403	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)N[C@H]2COc3c(F)cc(F)cc3C2)c2ccccc2c1=O	1346928677	BVAQJMYSKKKFLU-GFCCVEGCSA-N	429.383	1.159	50	20	IDGD	
CC(C)n1nc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](F)Cl)C2)cc1C(=O)O	1778023977	LEFUPZHVSNCYAL-SPYBWZPUSA-N	444.891	1.824	50	20	IDGD	
COC(=O)c1ccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](F)Cl)C3)cn1	1778205060	FQYGUNNHCIWBEP-ZRGWGRIASA-N	427.860	1.530	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](N)c1ccccn1)C2	1779543474	CWHVPKKIRSLEBI-SLYNCCJLSA-N	434.613	1.447	50	20	IDGD	
O=C(c1cccc(OC2CCOCC2)n1)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Cl)CCO2	1779904005	MEMKHMKUHNLDKF-PXNSSMCTSA-N	441.887	1.617	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)[C@H]3C[C@@]34C(=O)Nc3ccccc34)CCO2)C1	1781221359	CPVGQUXIEFBXCQ-DJDZNOHASA-N	431.920	1.744	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(C)c(NC(C)=O)c3)C2)C1	1781913361	CGVKJSDBQKILAD-UWJYYQICSA-N	437.924	1.651	50	20	IDGD	
O=C(c1ccccc1N1CCCCC1)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1782025946	HWDZQBQPNXVEAB-DENIHFKCSA-N	435.952	1.720	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@]2(CN(C(=O)Cn3cccn3)CCO2)C1	1782864292	JHTDNHBGXRSRMG-BPNKPRMTSA-N	441.438	1.598	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](C)N1C[C@H]3C[C@H]3C1)CCO2	1783349388	LGSJQWXKEITORX-NAHJCDBISA-N	428.371	1.330	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(COC)c[nH]3)CCO2)C1	1783352770	SRFBBKYGWUCKBN-KDOFPFPSSA-N	428.327	1.778	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@]1(F)CCCCC1(F)F)CCO2	1783875658	SADLCKUKTUCYJD-XKQJLSEDSA-N	426.863	1.988	50	20	IDGD	
COC(=O)N[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21)c1ccccc1	1783876487	NGUPBBWBWOJTDI-VIQHNZTISA-N	441.887	1.598	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)C3=Cc4ccccc4NC(=O)C3)CCO2)C1	1783881120	JFUVKTIVFZTGLN-HTAPYJJXSA-N	447.919	1.496	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc(Cl)c(F)c3)C[C@@H]21)[C@H](O)CCl	1784084026	KGTMVWPIGNBMND-CLROSIBMSA-N	433.307	1.601	50	20	IDGD	
CC(C)(C)OC(=O)CCCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21	1784134323	MQNLGVCMRUZZDJ-VGWMRTNUSA-N	432.945	1.078	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)c1ncc(F)cc1F	1784768363	WFTIIAKLVCCOJV-JDVFRBCBSA-N	436.228	1.644	50	20	IDGD	
COc1cccc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]32)n1	1785199290	LEODEPAKBZCAOG-XCGRYBKZSA-N	444.359	1.849	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3ncccn3)[C@H]2C1	1785424470	OVFICYBJNMWJDM-AJNGGQMLSA-N	425.327	1.172	50	20	IDGD	
Cc1nnc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]32)s1	1787057987	QAIKXNVUJRWJRN-MRHIQRDNSA-N	435.377	1.605	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21)c1cc(-c2ccccn2)[nH]n1	1788949539	NXEVDMBHSQHWMQ-MKBNYLNASA-N	438.315	1.869	50	20	IDGD	
CCc1noc(C)c1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)Br)C[C@@H]21	1788951336	HUTICZWAMGWATQ-NHULGOKLSA-N	428.327	1.922	50	20	IDGD	
Cc1cc(CC(=O)Nc2ccc(C3(NC(=O)c4cccc(B(O)O)c4)CCC3)cc2)n[nH]1	1789586134	LDONXTRKYCDTPM-UHFFFAOYSA-N	432.289	1.388	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(O)nc3)C[C@@H]21	1790962973	HMHFDSZZBHJCRS-AJNGGQMLSA-N	426.311	1.554	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(C(F)(F)F)c[nH]3)C[C@@H]21	1791254031	IWNZSGJZNQUNNL-NHULGOKLSA-N	437.846	1.881	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CCC[C@H](C(=O)OC)C3)C[C@@H]21	1791257387	CPYNVTLPAINZSM-PXOUGSPUSA-N	444.956	1.199	50	20	IDGD	
CO[C@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C[C@@H]21	1791323195	VDRJGGYWTBADEQ-STGGQVBHSA-N	433.455	1.886	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1	1791433866	GYIWITALSIQLHX-CYBMUJFWSA-N	445.122	1.898	50	20	IDGD	
O=C(NC1(c2ccc(NC(=O)[C@H]3CC[C@H](O)CC3)cc2)CCC1)c1cccc(B(O)O)c1	1791700259	HIAAHVSMUWSEKC-OQIWPSSASA-N	436.317	1.665	50	20	IDGD	
COC(=O)[C@@H]1CC[C@@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)CBr)C1	1792868562	FFKSYDZZDGFYFQ-SDSMMKDESA-N	445.354	1.196	50	20	IDGD	
COc1cc(OC)c(F)c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](O)CCl)c1F	1793110675	XBRNOFGCYYTQPH-WRWGMCAJSA-N	432.851	1.834	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(-n3cncn3)c1)C2	1793451967	PRGLNICSFXVVSL-NBMJBFSESA-N	431.924	1.878	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(O)(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](F)Cl)C3)CC1	1793908101	XLQDCSMHFQIBDI-XGUBFFRZSA-N	447.935	1.921	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](Br)Cc1ccccc1)C2)C(F)F	1795165952	XDOXOLJXBITEGF-XGUBFFRZSA-N	431.277	1.847	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CN(Cc3ccccc3)CCO1)C2)[C@@H](F)Cl	1796365058	PPOUQXKWMMADCH-RHQZKXFESA-N	439.915	1.011	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)Nc1ccccn1	1797972087	XEZVWDIFJVUVDQ-LBKYZSNHSA-N	439.354	1.503	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc3cnccc3n1)C2	1798440166	FATOXPDWBNKEAY-MUJYYYPQSA-N	445.483	1.194	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCc1ccc(F)nc1)C2	1798440851	ZVNDTVAUSAWBLE-MUJYYYPQSA-N	440.479	1.104	50	20	IDGD	
COc1cncc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Br)c1	1799344431	MJJQRGNRMFWOBR-RMHZUWNSSA-N	444.301	1.303	50	20	IDGD	
Cc1ccn2c(=O)c(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)C(Cl)Cl)cnc2c1	1801014752	BQVHDFUHJFYJFD-JJLQDPRZSA-N	439.299	1.010	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3nc(CO)[nH]c3c1)C2)C(Cl)Cl	1801014802	HUOOSBCSWPZDRB-QHBPRCKVSA-N	427.288	1.062	50	20	IDGD	
Cc1nn2cc(CC(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)C(Cl)Cl)nc2s1	1801015336	IXYLFDHMEVXTKG-DDFAGTSDSA-N	432.333	1.035	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc2nccn12	1801018733	BGWVXEHLJVXVGG-CKFWPPNZSA-N	447.499	1.720	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cc1c(F)ccc(F)c1F)C2	1802334782	OSHHLZSVNNRPHB-BTTYYORXSA-N	440.466	1.658	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc3c(c1)CCN3C)C2	1802336009	DEDJISRAHTTYPY-REPLKXPHSA-N	427.549	1.304	50	20	IDGD	
O=C(COc1ccc(O)cc1)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1	1802886497	NDBHZFFOBXOBGG-QSFXBCCZSA-N	433.892	1.472	50	20	IDGD	
CC(C)(CCl)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)N2CCOCC2)[C@H]1c1cccnc1	1802901525	SVOZJNYRQCCKJE-OKZBNKHCSA-N	438.956	1.003	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC2(CCN(C(=O)CN3CCOCC3)CC2)C1	1805382337	GLWCAWBEOYXYMR-INIZCTEOSA-N	430.387	1.581	50	20	IDGD	
Cc1cc(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)c(C)o1	1805561512	LNNGZEJISVQISW-SIKLNZKXSA-N	447.300	1.605	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCCC2(CCN(C(=O)CN3CCN(C(C)=O)CC3)CC2)C1	1806159322	BBGNDPRIVGFCQS-LJQANCHMSA-N	441.016	1.789	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)cn1	1807361238	FHXKRDUETYCYGD-UGKGYDQZSA-N	444.300	1.098	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)CCc2ccoc2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807363841	BVFCWGYICCPUDV-NFBKMPQASA-N	447.300	1.307	50	20	IDGD	
C[C@@H](C(=O)NC[C@H]1CCN(C(=O)C(Cl)Cl)[C@H]1c1cccnc1)N1CCN(C)CC1	1807902778	IWXWYFXLCULJOC-UAGQMJEPSA-N	442.391	1.527	50	20	IDGD	
N[C@@H](Cc1cscn1)C(=O)NC[C@@H]1CCN(C(=O)[C@H](F)Cl)[C@H]1c1cccnc1	1808204462	CZCIMBSCLCUZDQ-TUUVXOQKSA-N	425.917	1.648	50	20	IDGD	
Cc1ccoc1C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1808502352	WYBHNQGMOAGZQJ-FXAWDEMLSA-N	427.505	1.676	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CN2CCCC2)[C@H]1c1cccnc1)[C@@H](F)Br	1808648993	HDAIKOAOZILBAN-BHYGNILZSA-N	427.318	1.874	50	20	IDGD	
CC[S@](=O)CCC(=O)N1CC[C@H](CNC(=O)[C@H](F)Br)[C@@H]1c1cccnc1	1808668146	JEENIZKEFXRTEG-KBEGWCKOSA-N	448.358	1.937	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@H](CNC(=O)CCN2CCOC2=O)[C@H]1c1cccnc1	1809532620	NMOHKMPRSUFXRU-FXAWDEMLSA-N	448.596	1.781	50	20	IDGD	
N#Cc1cccc(C(=O)N2CCC3(CCCN(C(=O)c4ccc(B(O)O)cc4)C3)CC2)c1	1809969601	KOKZLCLZJAEEJX-UHFFFAOYSA-N	431.301	1.397	50	20	IDGD	
O=C(c1cncc(F)c1)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1	1809976538	BRUFMOBUMLDVTN-UHFFFAOYSA-N	425.269	1.059	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)c2ccc[nH]2)[C@@H]1c1cccnc1	1810619484	KOZNJQQGJUQQKP-RYUIIRDCSA-N	447.499	1.863	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)c1ccn(C(F)F)n1	1810904739	FXFLSYPWKLHQMQ-CFVMTHIKSA-N	427.839	1.593	50	20	IDGD	
CCNC(=S)NCC(=O)NC[C@@H]1CCN(C(=O)C(Cl)Cl)[C@H]1c1cccnc1	1812333412	OGOXXMDDWPAADD-JSGCOSHPSA-N	432.377	1.375	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)[C@H](C)Nc2cnccn2)[C@H]1c1cccnc1	1813033140	ZYXVZQODHAYGQU-XPYUAMARSA-N	446.939	1.632	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1813067563	AQSCVEQFLKCDBC-FUHIMQAGSA-N	437.972	1.868	50	20	IDGD	
COc1cc(C(=O)N2CC[C@H](CNC(=O)C(Cl)Cl)[C@H]2c2cccnc2)nn1C	1813079822	NNONNFMOIRRPSF-IUODEOHRSA-N	426.304	1.947	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H](CNC(=O)CCn2ccnn2)[C@@H]1c1cccnc1	1813435974	MEVVARSBPALMBK-RYRKJORJSA-N	449.353	1.943	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3sc(N)nc3C)sc2C1	1815148576	LMLJYSQUYPIDNO-BDAKNGLRSA-N	429.955	1.970	50	20	IDGD	
O=C(Cc1ccccc1)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1	1815354727	BYNSJZYBTXXIHR-KRWDZBQOSA-N	435.314	1.291	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccncc2)n[nH]1	1816381090	RGPQZHZXYLSPPP-QGZVFWFLSA-N	434.460	1.423	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CO)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](F)Cl)[nH]n1	1817974888	RAWRNPJAEMABAT-SGMGOOAPSA-N	447.895	1.822	50	20	IDGD	
CCCC(=O)N[C@H](C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](Cl)COC)[nH]n1	1819565012	HODGCLDIUZRQCN-UMVBOHGHSA-N	427.933	1.960	50	20	IDGD	
C[Si](C)(C)OCC(=O)Nc1cc([C@H]2CCCCN2C(=O)COc2ccc(O)nn2)[nH]n1	1819596326	GSKVLXHSSXGLPL-CQSZACIVSA-N	448.556	1.828	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](F)Br)n[nH]1	1820932745	OKNHGMBLPWFIPJ-LQJRIPTKSA-N	432.294	1.959	50	20	IDGD	
O=C(CN1C(=O)CSC1=S)Nc1cc([C@H]2CCCCN2C(=O)[C@H](F)Cl)[nH]n1	1823497132	ADMIIFRNHSTIJL-RNCFNFMXSA-N	433.918	1.797	50	20	IDGD	
O=C([C@@H]1CC(c2ccccc2)=NN1)N1CCC([C@H]2CCCCN2C(=O)[C@@H](O)CCl)CC1	1824187916	LJTJPDAOYTZQOL-HBMCJLEFSA-N	446.979	1.972	50	20	IDGD	
Cc1ncsc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827050875	GPTMGPNLGYYDTH-LJQANCHMSA-N	441.362	1.678	50	20	IDGD	
CC[C@H](C)[C@@H](O)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827055807	JZGHQRMUIFQNEJ-ZLGUVYLKSA-N	430.354	1.007	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccc(OC)c(O)c3)CCO2)C1	1830246100	CMMGNVXDQVZEFU-IERDGZPVSA-N	440.924	1.417	50	20	IDGD	
CC(C)[C@H](S)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1	1831494204	YWKYDRAELKKDQG-XKQJLSEDSA-N	427.394	1.634	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnn4cc(C)cnc34)C2)C1	1831651424	PJNKCRZVNVTOPL-UTKZUKDTSA-N	449.939	1.515	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2nc(C)c(C)[nH]c2=O)CC1	1831828398	RMCIBODJAOKUHD-SJORKVTESA-N	438.956	1.874	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)C(F)(F)Cl)CC1	1832018398	KQKZMKSMNIFAEL-HNNXBMFYSA-N	443.882	1.750	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)C2(F)CCC2)CC1	1832504602	NUPWXVFBLCIBBO-GOSISDBHSA-N	431.512	1.811	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnccc3N(C)C)CCO2)C1	1833660411	ZDNBZXCFFVZFRK-LAUBAEHRSA-N	438.956	1.625	50	20	IDGD	
COc1cccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)c1	1835026619	VCXIGLDKAIRBRB-QFIPXVFZSA-N	438.952	1.959	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H]3COc4ccccc4O3)CC2)CC1)[C@@H](F)Cl	1835079090	LLQKGQMYGYLEGR-RBUKOAKNSA-N	439.915	1.932	50	20	IDGD	
CC(=O)NC(C)(C)C(=O)N1CCC(N2CCC(NC(=O)CO[Si](C)(C)C)CC2)CC1	1835835092	NUUOUOQQNJYEEP-UHFFFAOYSA-N	440.661	1.324	50	20	IDGD	
Cc1ccc(CCC(=O)N2CCC(OC3CCN(C(=O)[C@H](O)CCl)CC3)CC2)nc1	1836715570	VBJAVXDUJALZOB-HXUWFJFHSA-N	437.968	1.921	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc3nc[nH]c3c1)CCO2	1836932180	JCAOUNCHUNNNID-OAQYLSRUSA-N	446.580	1.484	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@H](C)N3C[C@H]4C[C@H]4C3)CC2)CC1	1838370713	SWEOUTYVMHIALC-LJCCNALRSA-N	442.000	1.579	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccccc3F)CCO2)C1	1838856971	KBLYSVGDNZABGJ-SCLBCKFNSA-N	429.286	1.679	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)c3ccco3)C2)C1	1839149347	CLYPOBXQQZMWOZ-FHLIZLRMSA-N	435.304	1.006	50	20	IDGD	
C=CCOCCCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839198532	HFHKNSDYPHRYCR-DOTOQJQBSA-N	437.306	1.116	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CC(F)(F)F)C2)C1	1839963306	HLMMIPHVXBUBIM-FZMZJTMJSA-N	431.249	1.569	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(F)c(C)c3N)C2)C1	1840152144	YKGZJUHFOIKSHA-MGPUTAFESA-N	443.903	1.040	50	20	IDGD	
COc1cc(Cl)cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)c1	1840742452	UQJGTXROLRBKSD-CRAIPNDOSA-N	435.279	1.953	50	20	IDGD	
O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1CCCSC1)CCO2	1840863823	UQLYKRKYVPVSKR-RHSMWYFYSA-N	435.384	1.371	50	20	IDGD	
C=C1CC(C(=O)N2CCCC23CN(C(=O)CN(C)NC(=O)NCc2ccccc2)C3)C1	1841019426	PYVRAYWPZGFGLA-UHFFFAOYSA-N	425.533	1.502	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC12CN(C(=O)c1cnc3c(c1)CCNCC3)C2	1841289200	PHYJYCAOZYRZMI-AWEZNQCLSA-N	435.366	1.618	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H]2C[C@H]2C[C@@H]1C(=O)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1	1841354842	ZNABXKCAYSTELK-XQLPTFJDSA-N	427.929	1.187	50	20	IDGD	
Cc1cc(C(=O)N2CC3(CCCN3C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)n(C)n1	1841924186	FNIMKVOFCPDZCM-AWEZNQCLSA-N	439.944	1.678	50	20	IDGD	
CN(CC(=O)N1CC2(CCCN2C(=O)c2cncs2)C1)NC(=O)NCc1ccccc1	1842533807	AWVCHAJOMMIVFW-UHFFFAOYSA-N	442.545	1.306	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@H](CCN)NC(=O)OC(C)(C)C)C1	1842910959	FRLPNZXYMRKJQD-LSDHHAIUSA-N	430.977	1.839	50	20	IDGD	
CC#CC[C@H](C(=O)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1)c1ccccc1	1843011580	SBOFLWVJDMNGJM-QFIPXVFZSA-N	430.313	1.381	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2ccnc3ccccc23)C1	1843618488	IHIIOQFMSRMSBL-UHFFFAOYSA-N	430.468	1.364	50	20	IDGD	
Cc1ccc2nc(C(=O)N3CC4(CCCN4C(=O)c4cnccc4C(=O)NN)C3)ccc2c1	1844264210	SUZDXOGCACQEAJ-UHFFFAOYSA-N	444.495	1.673	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@H](O)CC(=O)N1CCCC12CN(C(=O)CO[Si](C)(C)C)C2	1845230566	NVWOCOJGEGAEDN-OAHLLOKOSA-N	443.617	1.317	50	20	IDGD	
O=C([C@@H](O)CCl)N1CC2(CCCN2C(=O)c2ccc(Br)c([N+](=O)[O-])c2)C1	1845335496	ZFBPGPZBHSTZOC-ZDUSSCGKSA-N	446.685	1.774	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H]1CC(c2ccccc2)=NN1	1847501491	BWIPDGOBKXAWGF-ZSGPHXLJSA-N	433.350	1.985	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CNC(=O)OC(C)(C)C	1847510954	ITLYMHMBXJDGOL-XDQVBPFNSA-N	448.358	1.247	50	20	IDGD	
C[C@@H]1CCCN(C(=O)OC(C)(C)C)[C@@H]1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl	1847559580	OTDRVCNQMUWTSW-HMDCTGQHSA-N	443.972	1.824	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NN[C@H](C(=O)NC1CC1)c1ccc(F)cc1	10173098	KCFZOWHDICMRSE-QHCPKHFHSA-N	439.535	1.979	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)c(OC)c1OC	12700049	FXAYJFKGEBCUTI-UHFFFAOYSA-N	436.490	1.389	50	20	IDGD	
CCCCn1c(C)cc(/C=C(\C#N)C(=O)OCC(=O)c2c(N)n(C)c(=O)n(C)c2=O)c1C	22032275	NDKKNKPOLRQHQK-MHWRWJLKSA-N	441.488	1.218	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)on1)c1cccc(N2CCCS2(=O)=O)c1	22429577	MPEFPGLLBCAIKD-UHFFFAOYSA-N	426.454	1.956	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Cn2cc([N+](=O)[O-])ccc2=O)ccc1OCCC(C)C	109764153	CGPBDMFAOKQWSD-UHFFFAOYSA-N	432.433	1.651	50	20	IDGD	
Cc1nn(C)c(C)c1C=NNC(=O)c1cc(S(=O)(=O)NCc2ccccc2)ccc1O	725722074	BOGUBLMYXVHJSB-UHFFFAOYSA-N	441.513	1.985	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)[C@H](C)NC(=O)c2n[nH]c3ccccc23)cc1	726379036	DTKCTJSZOZZDSK-UONOGXRCSA-N	439.472	1.695	50	20	IDGD	
O=C(NNC(=S)NCC1CCC1)C1CCN(S(=O)(=O)c2cc(F)ccc2F)CC1	727866698	VFNQPKLOWCICAQ-UHFFFAOYSA-N	446.545	1.661	50	20	IDGD	
COc1cc(C(=O)OCC(=O)NNC(=O)Cc2nc(C)cs2)c(N)cc1OC(F)F	728728296	XROILMQXSQGFMB-UHFFFAOYSA-N	444.416	1.191	50	20	IDGD	
O=C1CCSc2ccc(C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)cc2N1	728889407	HNMLDLWRYJWNPA-UHFFFAOYSA-N	426.502	1.589	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)[C@@H]1CCN(c2ccc3c(c2)OCCO3)C1=O	730515419	SPMMTPQVHBMZEV-INIZCTEOSA-N	429.404	1.176	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)[C@H]1CCCN(S(=O)(=O)c2c(C)n[nH]c2C)C1)c1ccccc1	732132910	KLRBXNDEFOVRTM-ROUUACIJSA-N	447.561	1.768	50	20	IDGD	
Cc1ccc(-c2noc(CCC(=O)NNC(=O)CCN3C[C@H](C)O[C@H](C)C3)n2)cc1F	732262677	VGCXWSNCADXIRN-GASCZTMLSA-N	433.484	1.763	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)/C(=C\c1cccnc1)NC(=O)c1ccccc1	733143416	GFJROUKSBPSTFW-SFQUDFHCSA-N	433.424	1.023	50	20	IDGD	
Cn1c(NNC(=O)[C@H]2CS[C@H](Cc3ccccc3F)C(=O)N2)nc2ccccc2c1=O	733261490	CNYKYSZCULRAQF-IAGOWNOFSA-N	441.488	1.359	50	20	IDGD	
CNS(=O)(=O)[C@@H]1CCCN(C(=O)/C(C#N)=C/c2cc(C)n(C[C@H]3CCCO3)c2C)C1	733279217	RIAVNNXZKCGMCB-XFVDGSDISA-N	434.562	1.731	50	20	IDGD	
CS(=O)(=O)N1CCCC[C@@H]1C(=O)NNc1cc(C(F)(F)F)nc(-c2cccnc2)n1	734257795	QCRGOZUSMLQWDB-GFCCVEGCSA-N	444.439	1.815	50	20	IDGD	
COc1ccc([C@@H]2[C@H](C(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)CCC(=O)N2C)cc1	734315074	GLJORRCKKILBHX-IEBWSBKVSA-N	426.429	1.974	50	20	IDGD	
C[C@@H]1C[C@H]1c1ccc(CCC(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)o1	735117004	KSAFWSJCOLUROZ-NVXWUHKLSA-N	447.561	1.810	50	20	IDGD	
C[C@@H](CN1CCN(c2ccccn2)CC1)NC(=O)NNC(=O)c1cnn(-c2ccccc2)c1	735517241	AIGVAAUTCFVWRA-SFHVURJKSA-N	448.531	1.422	50	20	IDGD	
COCCS(=O)(=O)NNC(=O)CSc1nnc(-c2ccccc2)n1-c1ccccc1	737755573	CNMJKBLSDROZCY-UHFFFAOYSA-N	447.542	1.623	50	20	IDGD	
CC(C)NS(=O)(=O)Cc1ccccc1CNC(=O)NNC(=O)COCc1ccccc1	738451295	ZFJSEYDMIZVAPR-UHFFFAOYSA-N	448.545	1.562	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)[C@H]2CCCN(C(=O)c3ccncc3)C2)o1	742055163	KXAPLWSZNAGYET-KRWDZBQOSA-N	427.505	1.830	50	20	IDGD	
COC(=O)[C@@H](NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)c1ccccc1F	743461933	PMBRIUVMOAAROG-SFHVURJKSA-N	435.477	1.759	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN(C(=O)N2CCCC2)C1)c1cc(Br)ccc1O	743733093	BMOBUGUKPLIDQG-LBPRGKRZSA-N	439.310	1.844	50	20	IDGD	
COc1ccc(CCC(=O)N2CCN(CC(=O)NNC(=O)c3cccc(C)c3)CC2)cc1	744390694	ITKMJTIXKJXYST-UHFFFAOYSA-N	438.528	1.542	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1ccc2c(c1)OCCCO2	744621157	SJDUMLBWJYKBKG-UHFFFAOYSA-N	433.486	1.626	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cnnn2-c2ccccc2Cl)c1	745476626	PZSUFVJWEWIHAJ-UHFFFAOYSA-N	448.892	1.246	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CC[S@@](=O)c2ccc3c(c2)OCCO3)cc1OC	746092492	SOFYVCJDXGRLKA-SSEXGKCCSA-N	434.470	1.434	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)[C@H]1CC(=O)N(c2cccc(S(N)(=O)=O)c2)C1)c1ccccc1	746247374	MKZZFUMUXALZLM-YJBOKZPZSA-N	444.513	1.028	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)[C@H]1CN(Cc2nc(O)c3ccccc3n2)CCO1)c1ccccc1	746247804	PJSWIURTTGEREP-FXAWDEMLSA-N	449.511	1.877	50	20	IDGD	
COc1cc(C(C)=NNC(=O)[C@H](C)CN2C[C@@H](C)O[C@H](C)C2)ccc1S(C)(=O)=O	747042502	QQTJZJMTESOGHK-RBSFLKMASA-N	425.551	1.684	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(C(=O)N2CCOCC2)cc1)c1ccc(Cl)cc1F	747617836	NKNQYBUAEWYXAY-UHFFFAOYSA-N	441.868	1.575	50	20	IDGD	
CC(C)CCC(=O)NCC(=O)NNc1ccc(S(=O)(=O)Nc2nccs2)cc1	747943345	UAHHIBIZCPIPJF-UHFFFAOYSA-N	425.536	1.939	50	20	IDGD	
O=C(CCN1CCN(C(=O)[C@@H]2CCCO2)CC1)NNc1ccc(Br)cc1F	748203409	OHOGFMSFHZYVPP-INIZCTEOSA-N	443.317	1.745	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCc2ccc([C@H](C)O)cc2)cc1	749347911	DZDWYSXDBBNTHK-HNNXBMFYSA-N	434.518	1.199	50	20	IDGD	
O=C(Cn1cnc2ccccc21)NNC(=O)c1cc(Cn2cc(Br)cn2)on1	751550024	XPPWETTXFQSQIB-UHFFFAOYSA-N	444.249	1.493	50	20	IDGD	
COC(=O)c1cc2c(cc1NC(=O)C(=O)NNC(=O)Cc1c[nH]c3ccccc13)OCO2	753840347	JAOPAYTTZSUTRA-UHFFFAOYSA-N	438.396	1.012	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(NC(=O)NNC(=O)c2nnc(O)c3ccccc23)c1	755366331	HVGTUQLKKGBDSG-UHFFFAOYSA-N	430.446	1.052	50	20	IDGD	
Cc1cc(C)nc(-n2nc(C)cc2NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)n1	755516924	UWTDLBZQUJUOQR-UHFFFAOYSA-N	443.489	1.458	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)Nc1ccc(C[C@H]2CC(=O)NC2=O)cc1	756817259	WXXRKHRMQVBMCL-OCCSQVGLSA-N	428.420	1.651	50	20	IDGD	
O=C(/C=C\c1ccc(I)o1)NNC(=O)C(=O)Nc1ccccn1	758835275	VXHXMLXTJFDLMG-ALCCZGGFSA-N	426.170	1.079	50	20	IDGD	
COCCOc1cc(C(=O)NNC(=O)CNC(=O)c2cccs2)nc2ccccc12	758959591	FQSGOAZXKYEQER-UHFFFAOYSA-N	428.470	1.513	50	20	IDGD	
COC(=O)c1cccc(CC(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)c1	759122508	VSLIHRAKPXZYHP-UHFFFAOYSA-N	434.493	1.746	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)NC[C@@]3(Cc4ccc(F)cc4)CCC[C@@H]3O)nc21	759650352	OBCZMQBVUAJTRF-YWZLYKJASA-N	429.456	1.608	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)[C@@H]2CCCN(S(=O)(=O)c3c(C)noc3C)C2)nc1	759729616	ZYESGEGWAMGBSH-CQSZACIVSA-N	437.478	1.017	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)c2cnn(-c3cccnc3)c2)CC1	759794835	SVYZKSJQVQOVHS-UHFFFAOYSA-N	429.481	1.611	50	20	IDGD	
CCOC(=O)[C@@H]1CCC(=NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)[C@@H](C)C1	761267773	UJIMUFQPIXACRU-PKOBYXMFSA-N	428.533	1.916	50	20	IDGD	
CC(C)[C@H](NC(=O)OCc1ccccc1)C(=O)NNc1nccc(N2CCOCC2)n1	762868807	SQUFFQRAUXEHRC-SFHVURJKSA-N	428.493	1.707	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)[C@H]3CCCN3c3ncccn3)n[nH]2)cc1OC	763146643	CVHMSYKDOVYVST-MRXNPFEDSA-N	437.460	1.314	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNS(=O)(=O)c1cc2c(cc1F)NC(=O)CC2	763439344	LULULXNTDWVKSR-UHFFFAOYSA-N	444.485	1.325	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)Nc1ccccc1CN1C(=O)CNC1=O	763477075	FINJFOKIJVNUND-UHFFFAOYSA-N	429.458	1.389	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cnn(-c3ccccc3)c2)cc(OC)c1OC	763538484	CLNGYSMGUJPCGD-UHFFFAOYSA-N	439.428	1.298	50	20	IDGD	
COC(=O)c1ccc(N2CCCC2)c(NC(=O)C(=O)NNC(=O)c2c[nH]c3ccccc23)c1	763540673	IYKUHSJXCYXPNF-UHFFFAOYSA-N	449.467	1.954	50	20	IDGD	
COC(=O)[C@H](C)Cc1ccc(NC(=O)C(=O)NNC(=O)c2c(C)nc3ccccn23)cc1	763628811	FXYIBLILAVWKHC-CYBMUJFWSA-N	437.456	1.394	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(CCN2CCCC2)cc1	763648755	VGYSVFPJJRLZOA-UHFFFAOYSA-N	440.500	1.498	50	20	IDGD	
CCN(Cc1ccccc1NC(=O)C(=O)NNC(=O)COc1ccccc1OC)C(C)=O	763662921	MTTCETRDYSQRJA-UHFFFAOYSA-N	442.472	1.229	50	20	IDGD	
COC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)cc1	763745748	JTAQNYHEWLWDED-UHFFFAOYSA-N	425.445	1.404	50	20	IDGD	
CC(=O)N1CCc2cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc3cccc(C)c3C)ccc21	763848534	ITQACDRVCPUAJE-HNNXBMFYSA-N	438.484	1.766	50	20	IDGD	
Cc1nc(Br)ccc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccccc1F	763858476	SVEGRYWZIJIMAX-JTQLQIEISA-N	439.241	1.845	50	20	IDGD	
COc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccccc1F	763863879	DWMFSPBDXZGYHV-GFCCVEGCSA-N	446.435	1.090	50	20	IDGD	
CCCn1nccc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1cccc(Br)c1	763880757	ASJVIUZGXXOGIB-LLVKDONJSA-N	438.282	1.609	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccccc2N(C)C(C)=O)cc1OC	763902091	NALFHIYJSDLEAY-UHFFFAOYSA-N	428.445	1.476	50	20	IDGD	
CNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(OC(C)C)c(OC)c2)cc1	763920674	BQLVMJDRIZTWIF-UHFFFAOYSA-N	428.445	1.242	50	20	IDGD	
CS(=O)(=O)c1c(Cl)cccc1NC(=O)C(=O)NNC(=O)c1cc(Cl)ccc1O	763977454	QPWAFLALXXCLFN-UHFFFAOYSA-N	446.268	1.502	50	20	IDGD	
CCOCCOCc1cccc(NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)c1	763979561	YCKJXLCWMIZFNC-UHFFFAOYSA-N	435.864	1.998	50	20	IDGD	
CC(=O)N1CCc2cc(NC(=O)C(=O)NNC(=O)c3cc(Br)c[nH]3)ccc21	763994954	KEIWUNCWNXETLI-UHFFFAOYSA-N	434.250	1.086	50	20	IDGD	
O=C(NNC(=O)C1CCCC1)C(=O)Nc1ccc(CCn2nnc(-c3ccccc3)n2)cc1	764065826	CRIMSMICCMYLJB-UHFFFAOYSA-N	447.499	1.859	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3ccc(Cl)nc3)cc2)C[C@@H](C)O1	764093311	RXPKJHOGWZJZLY-BETUJISGSA-N	431.880	1.748	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)C(=O)Nc2ccc(Cl)nc2)c1	764233237	UPGZNPCKPIYHQW-UHFFFAOYSA-N	427.642	1.906	50	20	IDGD	
COC(=O)[C@@H](C)Cc1ccc(NC(=O)C(=O)NNC(=O)c2cccc3ncccc23)cc1	764257704	MBGJSZNBHASODT-AWEZNQCLSA-N	434.452	1.986	50	20	IDGD	
COC(=O)NCc1ccc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1	764351086	OOTKNTANRXWEQN-UHFFFAOYSA-N	436.428	1.128	50	20	IDGD	
N#Cc1cccc(-c2csc(NC(=O)C(=O)NNC(=O)COCc3ccccc3)n2)c1	764363048	KGPYHVGFFJSINR-UHFFFAOYSA-N	435.465	1.984	50	20	IDGD	
COc1ccccc1N1CC[C@@H](NC(=O)NNC(=O)CSc2ccccc2O)C1=O	764445408	FCBKRNJSSKHWLJ-CYBMUJFWSA-N	430.486	1.629	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H](O)c2ccccc2Cl)c1	764583714	AESMJOGELWMEME-QGZVFWFLSA-N	439.921	1.865	50	20	IDGD	
C[C@H](CCC(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1)NC(=O)OC(C)(C)C	765185161	JWDLXDFXZXSPRZ-SNVBAGLBSA-N	448.929	1.442	50	20	IDGD	
C[C@H](c1ccsc1)N1CCN(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)CC1	765245917	VKPZNFSBHWGAQD-MRXNPFEDSA-N	443.577	1.874	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)c2ccc(NS(C)(=O)=O)cc2)n[nH]1	765601806	USRSQALTXBXNQV-UHFFFAOYSA-N	429.458	1.532	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)C(=O)Nc1cnc(Cl)c(Br)c1	768242045	MCNHPZMVWAVKSO-UHFFFAOYSA-N	429.633	1.965	50	20	IDGD	
O=C(NNc1nnc(-c2ccccn2)s1)c1ccc(N2C(=O)CCC2=O)c([N+](=O)[O-])c1	768260067	LODDBRNSWRSTFR-UHFFFAOYSA-N	439.413	1.919	50	20	IDGD	
O=C(NN=c1cc[nH]cc1Cl)C1CCN(S(=O)(=O)c2ccc(F)c(F)c2)CC1	768443806	BKDGQXXRGKMHBH-UHFFFAOYSA-N	430.864	1.979	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)N[C@H]1CCOC2(CCC2)C1	769192397	AHOVRGXJVXWOLX-INIZCTEOSA-N	436.534	1.517	50	20	IDGD	
CC(=O)N1CCc2c(NC(=O)C(=O)NNC(=O)c3cc(Br)c[nH]3)cccc21	769264241	CMHGYLWODHERPE-UHFFFAOYSA-N	434.250	1.086	50	20	IDGD	
CN(NC(=O)C1CCN(S(=O)(=O)c2ccc(Cl)c(C(F)(F)F)c2)CC1)C(N)=O	770537475	XZWKCLQMSVXCFC-UHFFFAOYSA-N	442.847	1.801	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2cc(-c3ccco3)nc3ccccc23)co1	770573484	CQILIRHOTYEQTG-UHFFFAOYSA-N	426.410	1.810	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)Cc1cc(Cl)ccc1Br	771271809	HRBCFORWLROOFC-UHFFFAOYSA-N	425.670	1.617	50	20	IDGD	
COc1ccccc1[C@@]1(C)NC(=O)N(CC(=O)NNc2ncnc3ccsc23)C1=O	771650579	STCWVIVDNDKUMC-LJQANCHMSA-N	426.458	1.610	50	20	IDGD	
O=C(CCN1CCN(C(=O)[C@H]2CCCO2)CC1)NNc1ccc(Br)c(F)c1	771681734	WQSWPQMPNBFUKF-MRXNPFEDSA-N	443.317	1.745	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)[C@@](C)(O)CN1Cc2ccccc2C1=O	772968111	CHELTAPWLNMADH-ZSEKCTLFSA-N	431.876	1.662	50	20	IDGD	
Cc1ccc([C@@](O)(CC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)C(F)(F)F)o1	773334084	RWWOJLKBDSBWKG-SFHVURJKSA-N	441.410	1.582	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3ccc(OC(F)F)cn3)cc2)CC1	773459312	PXFJGIXUYSYVBY-UHFFFAOYSA-N	441.460	1.376	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2cccc(C(=O)Nc3ccc(Cl)cn3)c2)n1	773729988	CWODGULGBOCDAE-UHFFFAOYSA-N	441.835	1.868	50	20	IDGD	
CCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)c(C)c1	774008016	DMBMMVCYWDZNGG-ZDUSSCGKSA-N	446.891	1.952	50	20	IDGD	
COCc1ccc(S(=O)(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)cc1	774612001	XZMRQDINFWOOIC-UHFFFAOYSA-N	430.486	1.747	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NC[C@H]2COC3(CCCCC3)O2)c2ccccc2c1=O	776064621	LUSCKVRTQBPTRM-AWEZNQCLSA-N	429.477	1.436	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)c1cccc([N+](=O)[O-])c1N1CCOCC1	776285282	KRLOJVQPBPSUDZ-QGZVFWFLSA-N	428.401	1.032	50	20	IDGD	
Cc1c(C(=O)NNC(=O)CNC(=O)OC(C)(C)C)nnn1-c1ccc(F)c(Cl)c1	778436091	CRCNJKIQECDJKT-UHFFFAOYSA-N	426.836	1.654	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CNC(=O)OC(C)(C)C)cc(OC)c1Br	778437777	BNJSCTPGSXOTKP-UHFFFAOYSA-N	432.271	1.752	50	20	IDGD	
CCOc1cc(N2CCOC(C)(C)C2)ccc1NC(=O)C(=O)NNc1nccnc1OC	782124147	NJOYTAPYNGBULG-UHFFFAOYSA-N	444.492	1.581	50	20	IDGD	
COc1ccc(Cl)cc1S(=O)(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	782470867	TUNAOJTXYFENMG-UHFFFAOYSA-N	432.285	1.628	50	20	IDGD	
CC(=O)N1CCN(C(=O)[C@@H](OC(=O)/C(C#N)=C/c2cc(C#N)n(C)c2C)C(C)C)CC1	782627729	JRECOFGITNOQEJ-CYEGBWLXSA-N	425.489	1.371	50	20	IDGD	
CCCS(=O)(=O)Nc1cccc(NC(=O)C(=O)NNc2ncnc3ccsc23)c1	783254901	MUUOHYXRUQGZDH-UHFFFAOYSA-N	434.503	1.925	50	20	IDGD	
CC1CCN(C(=O)c2ccc(NC(=O)C(=O)NNc3ccc(-n4cccn4)nn3)cc2)CC1	783432613	BCSWDGJAAJGYNS-UHFFFAOYSA-N	448.487	1.616	50	20	IDGD	
C[C@H](c1ccc(NC(=O)C(=O)NNc2ccc(-n3cccn3)nn2)cc1)N1CCOCC1	783437148	TZHDHWQQKUAJNS-OAHLLOKOSA-N	436.476	1.137	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNc2ccc(C)nn2)c(OCC(F)(F)F)c1	783951749	WZFSEKQLESBQKD-UHFFFAOYSA-N	427.339	1.595	50	20	IDGD	
Cc1c(NNC(=O)C(=O)Nc2cccc(S(=O)(=O)N3CCCC3)c2)cccc1[N+](=O)[O-]	784350096	CXZRHXUXARECSH-UHFFFAOYSA-N	447.473	1.770	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2cccc([N+](=O)[O-])c2C)cc1N1CCCS1(=O)=O	784354744	NEZQCZKHTNTBIB-UHFFFAOYSA-N	447.473	1.833	50	20	IDGD	
CCOC(=O)[C@@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNc2ccc(F)cc2)cc1F	784785369	USHWWUJJHNYQID-LLVKDONJSA-N	434.399	1.728	50	20	IDGD	
CC(=O)Nc1ccc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)NC(C)(C)C)cc1	784832735	DVKLKLSOLSFYBW-UHFFFAOYSA-N	447.517	1.804	50	20	IDGD	
COC(=O)c1ccc(F)c(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)c1	784835211	HZSJEBLUALBTEK-UHFFFAOYSA-N	445.375	1.690	50	20	IDGD	
COC(=O)CCNC(=O)c1ccc(NC(=O)C(=O)NNc2nc3ccccc3cc2C)cc1	785158075	JLKXTKUTOUEKBG-UHFFFAOYSA-N	449.467	1.918	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1nn(-c2cccc(F)c2)cc1O	786099887	QWHXEPYTFIMMRK-UHFFFAOYSA-N	425.424	1.185	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)Nc1cccc(C(F)(F)F)n1	786415145	YGMUVQFOWUSJBV-UHFFFAOYSA-N	434.172	1.601	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(C(F)(F)F)n2)o1	786417637	UQGHTGXSUWASBX-UHFFFAOYSA-N	427.383	1.935	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)COc1cccc(I)c1	787502177	RQHKRNAVQPQMMJ-UHFFFAOYSA-N	449.245	1.342	50	20	IDGD	
COc1ccc(OC)c([C@H]2C[C@H]2C(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)c1	788102111	UTAMFZFOXDQUDV-NVXWUHKLSA-N	431.876	1.925	50	20	IDGD	
CCOCCC=NNC(=O)C[C@@H]1c2cc(OC)c(OC)cc2CCN1S(C)(=O)=O	788419821	BMEOXMIONRQVOH-MRXNPFEDSA-N	427.523	1.481	50	20	IDGD	
C[C@H](NS(=O)(=O)c1ccc(C#N)cc1)C(=O)NNc1nnc(-c2ccccn2)s1	788556767	ROQSASPVHMIZLW-NSHDSACASA-N	429.487	1.282	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)[C@@H]1CC(=O)N(c2cccc(Br)c2)C1	790063940	RQYUVPOGXQMEPM-GFCCVEGCSA-N	442.310	1.739	50	20	IDGD	
CO[C@@H]1CCOc2c(NC(=O)C(=O)NNC(=O)c3ccc4c(c3)OCCO4)cccc21	790952106	ODPWSKDXQJJSIF-OAHLLOKOSA-N	427.413	1.328	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H]2C[C@]2(C=NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)C1	792928579	QNVZDQNVSRBTJF-XIKOKIGWSA-N	442.925	1.960	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)CNS(=O)(=O)c1ccc(C(C)=O)cc1	794703839	JLMDKHBOHJJPRI-UHFFFAOYSA-N	439.877	1.291	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)c2cc(=O)c(OC)co2)c2ccccc2c1=O	798829313	FSDIRNVBDZBBCP-UHFFFAOYSA-N	426.429	1.623	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(OC(F)(F)F)c(C#N)c2)cc1	799833823	DSJDKAZWKDTKLR-UHFFFAOYSA-N	436.346	1.930	50	20	IDGD	
O=C(CCn1cnc2ccc(Br)cc2c1=O)NNC(=O)N=c1cc[nH]cc1	802026329	PVLIYYCISOYEOY-UHFFFAOYSA-N	431.250	1.219	50	20	IDGD	
COc1ccc(C2=NO[C@@H](CNC(=O)NNC(=O)COc3ccccc3O)C2)cc1C	802349235	OOUNYLBFHQJXMU-OAHLLOKOSA-N	428.445	1.612	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)CNS(=O)(=O)c2ccc(C)c(C)c2)o1	810199974	HXXZEMJLURFADE-UHFFFAOYSA-N	436.534	1.478	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@@H](C)C(=O)NNC(=O)C1(S(C)(=O)=O)CCOCC1	814101287	QQDULKVQCVRJRB-ZDUSSCGKSA-N	432.926	1.465	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2nnn(CCOc3ccc(F)cc3)c2C)cc1	815584427	CZYHTILPRZNRES-UHFFFAOYSA-N	428.424	1.895	50	20	IDGD	
CCN(CC)CCNC(=O)c1cccc(NC(=O)C(=O)NNc2cccc(Cl)n2)c1	815728237	WERFQDNRLAUJGA-UHFFFAOYSA-N	432.912	1.888	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1ccccc1O[C@@H]1CCOC1	815752116	CYZUEWCNGDIBKU-CQSZACIVSA-N	448.501	1.186	50	20	IDGD	
Cc1cc(CC(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)n[nH]1	823966269	IPVDRBBAARTYDE-UHFFFAOYSA-N	427.486	1.200	50	20	IDGD	
COc1ccc(CCNC(=O)CSc2ccccc2C(=O)NNC(C)=O)cc1OC	912691864	MIBPUYQVQMEBGI-UHFFFAOYSA-N	431.514	1.936	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)c1ccc(S(=O)(=O)N=c2cc[nH]cc2)cc1	914748923	OMSIOEGVWBEFPV-UHFFFAOYSA-N	444.444	1.283	50	20	IDGD	
CCCC[C@@H](CC)CNC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	915879363	ZBHIISBAOVMOJK-MRXNPFEDSA-N	426.587	1.860	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NC[C@H]2CN(Cc3ccccc3)CCO2)cc1C	915894711	NZQQXLKZYFCNCS-NRFANRHFSA-N	426.517	1.914	50	20	IDGD	
COc1cc(-n2cnnn2)c(Cl)cc1C(=O)NNC(=O)Cc1c[nH]c2ccccc12	916134153	FFMUTETWCXHADJ-UHFFFAOYSA-N	425.836	1.809	50	20	IDGD	
CCCOc1ccc(CNC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1	916392146	IIYIHHJRQGIDBQ-UHFFFAOYSA-N	448.545	1.935	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)NCCNS(=O)(=O)Cc2ccccc2)c2ccccc21	916517153	URUQOBXGZUXNTL-UHFFFAOYSA-N	429.502	1.242	50	20	IDGD	
O=C(NCCCS(=O)(=O)Cc1ccccc1)NNC(=O)c1ccc2c(c1)OCCO2	916576934	FRLYCQTWUQUYBK-UHFFFAOYSA-N	433.486	1.407	50	20	IDGD	
CCS(=O)(=O)N(C)CCCNC(=O)NNC(=O)c1cc(C)n(-c2ccccc2)c1C	916580424	XXKGFNSTMKEQKJ-UHFFFAOYSA-N	435.550	1.710	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)N1CCc2sccc2C1	916620269	XJYIWEKXPXQNHE-ZDUSSCGKSA-N	426.506	1.115	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CCC(=O)N2CCc3sccc3C2)cc(OC)c1OC	917542111	KXEFLXUTIZEMDL-UHFFFAOYSA-N	447.513	1.900	50	20	IDGD	
CCNS(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)CSc2ccc(C)cc2)c1	917922944	GVSZOFKECGTTEJ-UHFFFAOYSA-N	425.507	1.986	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)NCCN1C(=O)c2ccccc2C1=O	919788203	FSEDBFYAEGGUAZ-UHFFFAOYSA-N	426.429	1.091	50	20	IDGD	
CCCN1CC[C@@H](CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(CC)CC)c2)C1	919792812	INUSVSFFGMUZCM-INIZCTEOSA-N	439.582	1.393	50	20	IDGD	
C[C@H](Cc1ccc(O)cc1)NC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	919910936	CIFUUDCLCBUUGG-GOSISDBHSA-N	425.533	1.866	50	20	IDGD	
CCCNC(=O)NNC(=O)c1ccc(NS(=O)(=O)c2ccc3c(c2)OCCO3)cc1	921042632	GPNFNHHCSIBAFA-UHFFFAOYSA-N	434.474	1.613	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)CN1c2cccc3cccc(c23)S1(=O)=O	921303211	DAKBRBTXMXLHCJ-UHFFFAOYSA-N	434.474	1.021	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)c1ccc(N2CCC[C@@H](C(N)=O)C2)cc1	1251217001	KKHZZXOIRWCCIW-GDBMZVCRSA-N	428.464	1.756	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)[C@H]2CC(=O)N(CC(F)(F)F)C2)CC1	1251914414	ICBQOAJWUYWMLK-LBPRGKRZSA-N	436.431	1.192	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)[C@@H]2CN(Cc3ccccc3)CCO2)CC1	1318683312	UKCKMUHINHDGJF-IBGZPJMESA-N	446.548	1.682	50	20	IDGD	
O=C(COC(=O)c1cnn(C2CCCCC2)c1)NNC(=O)[C@H]1COc2ccccc2O1	1322731277	JDJGPFVEOQVIQZ-GOSISDBHSA-N	428.445	1.533	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NC2CCN(C(=O)c3ccco3)CC2)cc(OC)c1OC	1337298183	JKGVIWMELLCZCS-UHFFFAOYSA-N	446.460	1.554	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(O)nc4ccccc34)C2)C1	1777763712	RBQGOWLHTMPWMO-IIBYNOLFSA-N	433.892	1.638	50	20	IDGD	
Cn1ncc2cc(C(=O)N3CC[C@]4(C3)CN(C(=O)[C@H](F)Br)CCO4)ccc21	1778021556	UFFPGBGEMPPBIY-YJBOKZPZSA-N	439.285	1.707	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(Cl)Cl)C2)c1cc2n(n1)CCCO2	1779036409	QWAPUAWCTXARCN-FZKQIMNGSA-N	431.320	1.597	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)/C=N/O[C@H]3CCCCO3)C2)C1	1779104609	FIUKYYSPFXZXPY-BKYXWZFNSA-N	436.336	1.582	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccnc(Br)c3)C2)C1	1779401799	ADMUYVRVEARWQS-SUMWQHHRSA-N	446.729	1.541	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(OC)ccn3)C2)C1	1779539627	BHNVDZDOPHRUHF-RDTXWAMCSA-N	426.311	1.707	50	20	IDGD	
CN1CCCC[C@@H]1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CO[Si](C)(C)C)C2	1780591556	MJNOSNZWFARBJO-DBXWQHBBSA-N	425.646	1.836	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H]1C[C@@]13C(=O)Nc1ccccc13)CCO2	1781221364	CPVGQUXIEFBXCQ-LDHQQMMRSA-N	431.920	1.744	50	20	IDGD	
COc1ccc(OCC(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)cc1	1781324617	BAMXOXOPMLBTLC-SJLPKXTDSA-N	445.285	1.594	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)c1ccco1)C2	1781995848	XITPSZHXHWFKOR-SCFUHWHPSA-N	429.311	1.610	50	20	IDGD	
Cc1nnc(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](C)Br)C2)o1	1781998114	OEEIONAODINDRI-CJBNDPTMSA-N	429.315	1.218	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H]1Cc3ccccc3O1)C2	1782176159	WXZRAMXJTZPQJD-ITBLURSFSA-N	436.936	1.758	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc3cccnn3n1)C2)C(Cl)Cl	1782218412	ZEPZSMVXSSUXIQ-RDTXWAMCSA-N	426.304	1.661	50	20	IDGD	
O=C(c1cnc2cccc(Cl)c2c1)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1782497923	XZHONVDCFMOVHX-PXNSSMCTSA-N	438.311	1.931	50	20	IDGD	
COCCOCC(=O)N1CCO[C@@]2(CCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1	1782864061	FVKKKOXLENXNRZ-BPNKPRMTSA-N	449.454	1.365	50	20	IDGD	
CCC(=O)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](Br)Cc1ccccc1)CCO2	1783095046	QPLFOTJUIFEHPY-UZLBHIALSA-N	437.334	1.802	50	20	IDGD	
Cc1noc(C)c1CCC(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](C)Br)C2)C1	1783532567	PRNFZJDMCSJCFF-KZULUSFZSA-N	428.327	1.837	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](C)Br)C3)C2)nc2nccn12	1783537462	SJLBHQIHZOIPAK-UGSOOPFHSA-N	436.310	1.265	50	20	IDGD	
CSCC[C@H](O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]2C1	1783973457	AYFXYGJHUQDYFR-QTVXIADOSA-N	437.400	1.111	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnn(Cc4ccccc4)c3)C[C@@H]21)[C@H](O)CCl	1784091507	WJUNRGRXHVVYRX-FFGOWVMKSA-N	446.935	1.124	50	20	IDGD	
CC(C)c1nc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)C(C)(C)CCl)C[C@@H]32)no1	1785208362	FKZMHPFDZOAQET-KKUMJFAQSA-N	426.945	1.980	50	20	IDGD	
CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@@]2(CN(C(=O)C(Cl)Cl)CCO2)C1	1785348861	UAIBEFXDLNMSAG-SGTLLEGYSA-N	438.352	1.923	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)C(Cl)Cl)C[C@@H]32)n1	1785536871	FFMCRIZBWAJTFM-OBJOEFQTSA-N	429.304	1.437	50	20	IDGD	
O=C(NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])o3)cc2)CCC1)c1ccc(B(O)O)cc1	1785748577	SLAZAOBBSPDVKF-UHFFFAOYSA-N	449.228	1.929	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C/N=C/c3ccco3)[C@H]2C1	1788681446	UVXDUXOAOCDTJR-KYFJBTDQSA-N	426.311	1.462	50	20	IDGD	
Cn1nc2c(c1C(=O)N1CC[C@H]3CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]3C1)CCC2	1788763840	WMIKBEKFTWSDAY-ZVZYQTTQSA-N	434.613	1.354	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1ccc(C2(NC(=O)c3cccnn3)CCC2)cc1	1789521184	QWAFFQQHMFTOSV-UHFFFAOYSA-N	431.456	1.537	50	20	IDGD	
C[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21)N(C)C(=O)OC(C)(C)C	1789758599	YYEYHLZQVRVSDY-QTVXIADOSA-N	435.924	1.756	50	20	IDGD	
CC(=O)N/C(C)=C/C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)CBr)C[C@@H]21	1790556062	UVLYIXPEGRTCAC-NMJMFXAJSA-N	430.343	1.037	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(O)c(OC)c3)C[C@@H]21	1791253414	BRRNVIYTQVNIHL-XSWJXKHESA-N	426.897	1.248	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4ncsc4[nH]3)C[C@@H]21	1791255288	JQWGCQMNHWFPBF-ASHKBJFXSA-N	426.926	1.472	50	20	IDGD	
Cc1cc(F)cc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]3C2)c1	1791293058	HBRFLRCOAIJUJF-IHPCNDPISA-N	448.539	1.029	50	20	IDGD	
C[C@H](Br)C(=O)Nc1ccc(C2(NC(=O)[C@@H](N)CCC(N)=O)CCC2)cc1	1791433824	DXXKRQGUIWIOSE-FZMZJTMJSA-N	425.327	1.497	50	20	IDGD	
Cc1ncc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Br)C[C@@H]32)s1	1791590464	CJKRDLFUNJGZNW-NHULGOKLSA-N	434.331	1.664	50	20	IDGD	
CC(C)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CC[C@H]3CCC(=O)N3C1)C2	1792784312	DNAQTWXKWGKLME-KCYAQADSSA-N	425.957	1.242	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@](C)(O)C(F)(F)F	1793929169	ZFMVXYUIHUJFKZ-JKHKVNPQSA-N	443.426	1.072	50	20	IDGD	
COC(=O)[C@H]1CC=CC[C@@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCBr	1795117078	LQKIZEIUPXXOQC-PFFSRIRZSA-N	443.338	1.116	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CSC(=N)N	1795506737	HEODSFMTIHSBBI-XSDCOXNMSA-N	449.483	1.088	50	20	IDGD	
CC(C)NCCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)C2	1795711888	YJEQJMJXSDZFBK-BDCURPAKSA-N	446.498	1.849	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1noc2c1CCCC2	1796155375	WFMOWNZZGQVNNY-MCYUEQNJSA-N	426.311	1.540	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)c1cncc(C(F)(F)F)c1	1796191950	ULQXIAJBBSSYFE-BCDXTJNWSA-N	447.222	1.346	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)Nc1nccs1	1796411116	UBTHCJXBFWRFTB-XGFWRYKXSA-N	445.383	1.564	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2c(c1)OCO2	1796785251	SYYXNGLFHDRXMS-DPYKFYPSSA-N	439.306	1.650	50	20	IDGD	
CCOC(=O)[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](F)Cl	1796811514	RTZMEVUVBJVNBJ-NDKCEZKHSA-N	449.907	1.615	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc(F)c(F)c1)C2	1797954436	LFUUCZCKVJKEMK-YVWYUNDQSA-N	426.536	1.948	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)ccc1F	1799530986	JAFYIUZADVGAIE-VAECKANCSA-N	429.286	1.908	50	20	IDGD	
COc1cc(C)cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)c1	1800296841	DTGQBCJBLZHQHN-BJWYYQGGSA-N	437.500	1.568	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C#CC1(O)CCCCC1)C2	1800758988	BPIMDGFBNRVDPL-PNBKFKSVSA-N	427.339	1.058	50	20	IDGD	
C[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2	1800862530	HTSRUEYTOHBPNM-GUIRCDHDSA-N	448.358	1.274	50	20	IDGD	
Cc1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CCC(=O)NN(C)C)C3)cc2c[nH]nc12	1800924938	SLDSCQSWWQJXBC-BCDXTJNWSA-N	426.521	1.496	50	20	IDGD	
CC[C@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)COC(=O)C(F)(F)F)C2	1801802540	VUJVUJJZCUGSCU-VLEAKVRGSA-N	429.233	1.904	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)CN2CCSCC2)[C@@H]1c1cccnc1	1802448194	HXMDKWXZSBUJRM-LNLFQRSKSA-N	440.997	1.390	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc3ccnn3c2)[C@@H]1c1cccnc1)[C@H](O)CCl	1803148253	PRHJKFMFOSASQX-KFKAGJAMSA-N	427.892	1.649	50	20	IDGD	
COc1ccc(F)c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)c1	1803596333	GQTXAOGJLRKEBF-BJWYYQGGSA-N	426.253	1.080	50	20	IDGD	
COc1cccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)c1F	1803996612	UIQQIXPFKTWEKZ-BTTYYORXSA-N	441.463	1.398	50	20	IDGD	
COC(=O)NCC(=O)N1CC[C@H](CNC(=O)[C@@H](F)Br)[C@@H]1c1cccnc1	1808680109	HVKFMUDECPPKCL-KWCYVHTRSA-N	431.262	1.134	50	20	IDGD	
CC(=O)CCC(=O)N1CCCC2(CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CC2)C1	1809108172	JHGIKUGQZBYROP-JJIBRWJFSA-N	429.521	1.721	50	20	IDGD	
O=C(c1ccc2c(c1)COC2)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1	1809971959	DTJRYMRYHWBZOX-UHFFFAOYSA-N	448.328	1.555	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)c2ccccc2)[C@H]1c1cccnc1	1811670318	OQAVNQCIMGSQOB-GHTZIAJQSA-N	444.495	1.714	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)CNC(=O)OC)[C@H]1c1cccnc1	1812779130	PDIYPQGTBNLKOX-DZKIICNBSA-N	441.326	1.617	50	20	IDGD	
N[C@@H](Cc1cscn1)C(=O)N1CC[C@@H](CNC(=O)C(Cl)Cl)[C@@H]1c1cccnc1	1813079020	CNUKPVBIOLIBHC-QEJZJMRPSA-N	442.372	1.918	50	20	IDGD	
COc1ncc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)[C@H](O)CCl)n[nH]2)cc1F	1814867473	LVMYOVSTYPUNPS-UONOGXRCSA-N	425.848	1.858	50	20	IDGD	
Cc1cnc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)s1	1816283292	MTTRZUACMKSZAI-MRXNPFEDSA-N	439.306	1.474	50	20	IDGD	
CC[C@@H](NC)C(=O)N1CCCC[C@H]1c1cc(NC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)n[nH]1	1818112177	VJOAVLLFXBJPEY-GBWSIVELSA-N	442.524	1.534	50	20	IDGD	
Cc1cc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)CCC(=O)NN(C)C)CC3)c(C)n1C	1821117049	UGXOEXSGYXURFF-CQSZACIVSA-N	446.577	1.697	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@H]1c1cc(NC(=O)Cn2ccncc2=O)n[nH]1	1821659263	YLWQNYKYFAKBDS-AAEUAGOBSA-N	437.298	1.442	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccnc(F)c2)[nH]n1	1822410467	KQIUQEYEIQWYJN-HNNXBMFYSA-N	431.472	1.623	50	20	IDGD	
CC(=O)NCC(C)(C)C(=O)N[C@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1	1822998919	KVBBLERAENNDJX-CABZTGNLSA-N	449.346	1.908	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC([C@H]2CCCCN2C(=O)C(=O)C2CC2)CC1	1824121819	SURWYZGFDMLCOF-KWXFCVSUSA-N	441.532	1.719	50	20	IDGD	
O=C1CCc2ccc(C(=O)Nc3nc4c(s3)C[C@H](NC(=O)[C@H](O)CCl)CC4)cc2N1	1824329035	FKDDHFRHKAMXRW-IUODEOHRSA-N	448.932	1.853	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H]1CCC(F)(F)C1)CC2	1826080903	GZXJRYJOYAUTGS-NWDGAFQWSA-N	443.520	1.864	50	20	IDGD	
CS(=O)(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)CCBr)CC1	1826360131	FUACTAQJFOXVGW-HNNXBMFYSA-N	437.400	1.826	50	20	IDGD	
CN1CCN(C2(C(=O)N3CCC([C@@H]4CCCCN4C(=O)[C@H](F)Cl)CC3)CC2)CC1	1827611193	ODCIHUCGMVDHIT-ROUUACIJSA-N	428.980	1.921	50	20	IDGD	
O=C1NCCCn2nc(C(=O)N3CCCC[C@H]3C3CCN(C(=O)[C@@H](F)Cl)CC3)cc21	1828500298	MZJUPOOXHIJUDF-DOTOQJQBSA-N	439.919	1.784	50	20	IDGD	
O=C(C1CC1)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCN2C(=O)OCc1ccccc1	1828551999	ZJSZZAQDJXYXQU-GCJKJVERSA-N	449.935	1.448	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)C2(F)CCC2)CC1	1828925611	MVCFZYQDBIYYIH-GOSISDBHSA-N	431.512	1.811	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)c2ccncc2O)CC1	1829175239	SZKPIGQURWWBSZ-FQEVSTJZSA-N	437.305	1.014	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(N(C)C)nc3)C2)C1	1831652029	VQAVIDJTNLSQML-UTKZUKDTSA-N	438.956	1.625	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3c(C)nn(C)c3C)C2)C1	1831659195	OEAIZTHCSKEZMX-WIYYLYMNSA-N	440.972	1.443	50	20	IDGD	
COc1cc(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)ccn1	1832594817	QUDZCBSFWTVQPW-HKUYNNGSSA-N	429.876	1.014	50	20	IDGD	
CC[C@@H](NC(C)=O)C(=O)NC1CCN(C2CCN(C(=O)[C@@](C)(Cl)CCl)CC2)CC1	1833096776	CVBZVVMOHVBCBC-XLIONFOSSA-N	449.423	1.709	50	20	IDGD	
C[C@H](C(=O)N1CCC(N2CCC(NC(=O)CCBr)CC2)CC1)n1ccnn1	1834424326	RMWCFAQNRBLCOA-CQSZACIVSA-N	441.374	1.196	50	20	IDGD	
O=C(C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1)c1ccccc1	1834706373	IBMOSRPEWOATDV-CRAIPNDOSA-N	443.269	1.016	50	20	IDGD	
CC(C)(C)n1cc(C(=O)N2CCC(N3CCC(NC(=O)[C@@H](F)Cl)CC3)CC2)nn1	1835081994	JSIFNWXNJSSESQ-MRXNPFEDSA-N	428.940	1.753	50	20	IDGD	
CC(C)CNC(=O)C(=O)NC1CCN(C2CCN(C(=O)CO[Si](C)(C)C)CC2)CC1	1835129489	TZUXMLQMAMSNAT-UHFFFAOYSA-N	440.661	1.182	50	20	IDGD	
O=C(CCc1ccc(F)nc1)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836714889	AJOAPZYKUXHYAG-GOSISDBHSA-N	441.931	1.752	50	20	IDGD	
O=C(Cc1cccc(F)c1)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836716882	WGRKHRHHFVCEKJ-IBGZPJMESA-N	426.916	1.967	50	20	IDGD	
COc1cc(C(=O)N2CCC(OC3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)ccc1O	1836717364	CRAHOAGCBGKUFS-SFHVURJKSA-N	440.924	1.613	50	20	IDGD	
C[C@@H](Nc1ccccn1)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1837747205	JOXLJQWRZWHEIY-ACJLOTCBSA-N	431.320	1.142	50	20	IDGD	
COCCOCC(=O)N1CCC(OC2CCN(C(=O)[C@](C)(Cl)CCl)CC2)CC1	1837768445	YLUAUMZVJRUXAD-LJQANCHMSA-N	439.380	1.884	50	20	IDGD	
Cc1nc(C)c(C(=O)N2CCO[C@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)o1	1838004887	NMENAWFONVSTIY-IBGZPJMESA-N	425.558	1.213	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(C4CC4)cc3)CCO2)C1	1839441454	VRXSBCGCJJBHAC-DENIHFKCSA-N	436.936	1.888	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(C)n4ccnc4n3)CCO2)C1	1839546706	DQQZENSWUMUOCA-KKSFZXQISA-N	449.939	1.515	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccccc3O)CCO2)C1	1839909441	LNYLXJYNTYPKQW-LIRRHRJNSA-N	441.322	1.175	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C)on3)C2)C1	1839963726	UCOAHWXYFLULGF-DYVFJYSZSA-N	430.299	1.227	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnoc3C)C2)C1	1839963889	ZQOPAGXUYDMBJX-PBHICJAKSA-N	430.299	1.227	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@]3(C)CC3(F)F)C2)C1	1839967184	CUAKVVHOKVREFN-MAZHCROVSA-N	439.297	1.662	50	20	IDGD	
COc1ccsc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)Br)CCO2	1840034320	HWBKJDFMMZLGOY-SJCJKPOMSA-N	447.351	1.610	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3sc(C)nc3C)C2)C1	1840150236	IDQZOGXNJJNHTN-KDOFPFPSSA-N	431.942	1.084	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3ccccc3F)CCO2)C1	1840547815	WWZMGJRYIQCZPG-LAUBAEHRSA-N	442.915	1.469	50	20	IDGD	
O=C(Cc1ccc(Cl)c(F)c1)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843012662	BTDDVVUUPCAKNU-UHFFFAOYSA-N	430.672	1.219	50	20	IDGD	
O=C(c1cc2cc(F)ccc2s1)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843014040	QXBNQOZWWWJJRX-UHFFFAOYSA-N	438.289	1.851	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](O)[C@@H](C(=O)N2CCCC23CN(C(=O)[C@@H](F)Cl)C3)C1	1843822623	DSNBWBPIUGFXNW-MELADBBJSA-N	433.908	1.342	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)C1CCC(O)CC1)C2	1844693320	RLDHWVBQNUBKEX-UHFFFAOYSA-N	445.472	1.888	50	20	IDGD	
COc1cc(C(=O)N2CCCC23CN(C(=O)[C@H](F)Br)C3)c([N+](=O)[O-])cc1O	1844737988	YLMLFVQSGLUDMD-ZDUSSCGKSA-N	446.229	1.817	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)Cc1cccc2ncccc12	1847792220	HAIXWNKPKQYWHM-SFTDATJTSA-N	444.495	1.291	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CCc1nnc(C)s1	1848211281	JMZWUQDLAYNLIC-RQPWHRJUSA-N	443.533	1.115	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)c1cncc(Br)c1	15737621	MELITIHYQPAWHC-UHFFFAOYSA-N	432.322	1.817	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)CCN2C(=O)c3ccccc3C2=O)c2ccccc2c1=O	17196676	WPOULOJKILGFDN-UHFFFAOYSA-N	447.451	1.425	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)CCNS(=O)(=O)c2ccc(C)c(C)c2)c1	17202706	YTDCITOZRPYJLD-UHFFFAOYSA-N	433.530	1.815	50	20	IDGD	
CS(=O)(=O)NCCc1ccc(C(=O)NNC(=O)c2cc(-c3ccccc3)n[nH]2)cc1	17519504	YPSAMPIMBWEYKC-UHFFFAOYSA-N	427.486	1.243	50	20	IDGD	
NC(=O)c1ccc(C(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)cc1	17633306	AXJQFMDOURADRC-UHFFFAOYSA-N	441.451	1.562	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)c2ccc3c(c2)C(=O)N(Cc2ccccc2)C3=O)n1	23690792	QUCSAXKQJKPERU-UHFFFAOYSA-N	431.452	1.757	50	20	IDGD	
Cn1ccnc1[C@](O)(CC(=O)NNC(=O)c1ccc(Br)s1)C(F)(F)F	105567892	MQYMIWDEXQKCGM-GFCCVEGCSA-N	441.229	1.845	50	20	IDGD	
Cc1ccc(NC(=O)C2CCN(CC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)CC2)nc1	108444319	BZTSLOLCXRXESN-UHFFFAOYSA-N	440.460	1.410	50	20	IDGD	
CC[C@@H](C)C(=O)N1Cc2ccccc2C[C@@H]1C(=O)NNC(=O)CNC(=O)c1cccs1	725739864	NUHLHBUTWGLEBH-RHSMWYFYSA-N	442.541	1.625	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)NCCCNc1ccc(C(F)(F)F)cn1	725872681	ZYUGVIVQGVVBJW-UHFFFAOYSA-N	428.371	1.256	50	20	IDGD	
N#Cc1ccc(N2CCC[C@H]2C(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1	728170862	TWJDKBDBIOWXBN-KRWDZBQOSA-N	426.502	1.281	50	20	IDGD	
CC(C)(C)CC(=O)NNC(=O)c1ccc(Cl)c(S(=O)(=O)NC[C@@H]2CCCO2)c1	728609247	UQULSESYLIPXKA-ZDUSSCGKSA-N	431.942	1.995	50	20	IDGD	
CCN1CCN(c2ccc(F)cc2[C@H](C)NC(=O)NNC(=O)Cc2cccnc2)CC1	729053480	ITNZKCCGCZLICQ-INIZCTEOSA-N	428.512	1.997	50	20	IDGD	
O=C(CCNC(=O)c1cc(F)ccc1Br)NNC(=O)CNc1ccccc1	729513593	AJQLGNNGQXGZSI-UHFFFAOYSA-N	437.269	1.968	50	20	IDGD	
CC[C@@H](NC(=O)NNC(=O)COc1ccccc1C#N)c1cccc(S(N)(=O)=O)c1	729613401	RASXAASUUXQEBD-MRXNPFEDSA-N	431.474	1.066	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)NC[C@H](c1cccc(Cl)c1)N1CCOCC1	730827521	QRTQRMZNZQBUGX-QGZVFWFLSA-N	448.907	1.828	50	20	IDGD	
CCOC(=O)/C(C#N)=C\Nc1cc(S(=O)(=O)N2CCOCC2)ccc1N1CCCC1	730940821	LDYMDMGQBKJNFB-NXVVXOECSA-N	434.518	1.690	50	20	IDGD	
CCN(C1CCN(C(=O)/C(C#N)=C/c2cc(C)n(CCOC)c2C)CC1)S(C)(=O)=O	731347935	ZDWFTDZPYUBMQS-XMHGGMMESA-N	436.578	1.931	50	20	IDGD	
O=C(CS(=O)(=O)c1cccc(Br)c1)NNc1nc(-c2ccncc2)no1	732067204	CQIHBCNZBHWWBZ-UHFFFAOYSA-N	438.263	1.811	50	20	IDGD	
C[C@H](CC(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)S(=O)(=O)c1ccc(F)cc1	734240446	REESKAARRWRIMM-GFCCVEGCSA-N	446.501	1.233	50	20	IDGD	
Cc1nc(CNC(=O)/C(C#N)=C\c2cn(CCC(N)=O)nc2-c2ccc(Cl)cc2)no1	736091770	GWRMHPMRWHTDSS-ZSOIEALJSA-N	439.863	1.994	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)N2CCN(CC(=O)NNC(=O)c3ccc(F)cc3)CC2)c1	736620843	DNSHSNMFTGZGFK-QGZVFWFLSA-N	442.491	1.507	50	20	IDGD	
CC(C)Oc1ccc(NS(=O)(=O)CC(=O)NNC(=O)COCc2ccccc2)cc1	737927368	VNMJWEFBZDQUEL-UHFFFAOYSA-N	435.502	1.580	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)c1cccc(S(=O)(=O)NC[C@@H]2CCCO2)c1	738545674	KONQBEJYWYFLFN-SFHVURJKSA-N	447.513	1.122	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cccc(NC(=O)N(C)C)c2)cc1OC	740371398	CSCOIWVOCNAZDP-UHFFFAOYSA-N	444.444	1.415	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)c2ccc(S(=O)(=O)Cc3ccccc3)cc2)n1	741206664	BVGJJQISILRBQZ-UHFFFAOYSA-N	426.498	1.935	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)CCOc2ccc(F)cc2)cc(OC)c1OC	742025137	JBICIRXJOQEWEW-UHFFFAOYSA-N	428.438	1.495	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)CC1CCC1)N(S(C)(=O)=O)CC2	743297135	LHQRFRFWYUKLJJ-MRXNPFEDSA-N	439.534	1.290	50	20	IDGD	
O=C(NC[C@H](O)COc1cccc(F)c1)NNC(=O)c1cccc(Br)c1	743687821	QLFNSJSBDIITOZ-AWEZNQCLSA-N	426.242	1.972	50	20	IDGD	
Cc1ccc(CN2C[C@@H](C(=O)NNC(=O)Nc3ccc(S(C)(=O)=O)cc3)CC2=O)cc1	743829788	DJGUKPWGEFIXAI-INIZCTEOSA-N	444.513	1.600	50	20	IDGD	
Cc1cc(C(=O)O)c(O)c(S(=O)(=O)NNC(=O)c2ccc(F)cc2Br)c1	743835879	IPOJUCFXOWMHMU-UHFFFAOYSA-N	447.238	1.924	50	20	IDGD	
CCCCN1C(=O)CC[C@@H](C(=O)NNC(=O)C(=O)NC2CC2)[C@@H]1c1ccc(OC)cc1	744463436	DIWIJXZUFZVWJY-MJGOQNOKSA-N	430.505	1.201	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1ccn(-c2ccccc2)n1	744619817	ZSGXNVWSTDHXEO-UHFFFAOYSA-N	427.486	1.650	50	20	IDGD	
Cc1[nH]nc(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)c1Br	744620446	FMYZAWBWVKCDEK-UHFFFAOYSA-N	444.311	1.258	50	20	IDGD	
COc1cc(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)cc(OC)c1C	744620671	MNFYCFHNUSAULL-UHFFFAOYSA-N	435.502	1.790	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)[C@@H](c2ccccc2)N2CCC(O)CC2)cc1	744964428	RQZGXLTYFAALOC-OAQYLSRUSA-N	436.468	1.060	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)NCCN2CCN(C(=O)OC(C)(C)C)CC2)cc1	745786062	RTRIBBTVXWAQNV-UHFFFAOYSA-N	449.556	1.641	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)N[C@H](C)c2nc(C(C)(C)C)no2)nc1	745917737	OXEAMXDCHUQZAD-LLVKDONJSA-N	425.515	1.836	50	20	IDGD	
O=C(CCCc1ccccc1)NNC(=O)[C@H]1CN(Cc2nc(O)c3ccccc3n2)CCO1	746209722	AFAYSHXBZMECMA-HXUWFJFHSA-N	449.511	1.707	50	20	IDGD	
CC(=NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)c1cnn(C(C)C)c1	746679314	PUUFJISCVLPACL-UHFFFAOYSA-N	447.561	1.958	50	20	IDGD	
CN(C)C(=O)CNC(=S)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1	747623498	KKDQMIXIKYXQGE-LJQANCHMSA-N	425.558	1.197	50	20	IDGD	
O=C(NNC(=S)NCc1ccc(Br)cc1)c1ccc(-n2cnnn2)cc1	747647094	RDCACWCNELZHFR-UHFFFAOYSA-N	432.307	1.734	50	20	IDGD	
Cc1cccc(N2CCN(S(=O)(=O)CC(=O)NNc3cccc([N+](=O)[O-])c3)CC2)c1	748004677	POUAYTIAQDYKDD-UHFFFAOYSA-N	433.490	1.498	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)CCn3cc(Cl)cn3)cc2)CC1	748623333	MQDHKXSHKMPFLD-UHFFFAOYSA-N	426.930	1.006	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)[C@H]1OCCc2ccccc21	750422955	BSMMPYSCDZXGTC-QFIPXVFZSA-N	442.947	1.919	50	20	IDGD	
O=C(CCCN1C(=O)c2cccc3cccc(c23)C1=O)NNC(=O)CNC(=O)c1ccco1	751211328	GDSUYNYHFLUBJU-UHFFFAOYSA-N	448.435	1.386	50	20	IDGD	
CCOC(=O)C1(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(CC)CC)c2)CCC1	751539269	SXOWRFQGUSYUPA-UHFFFAOYSA-N	425.507	1.212	50	20	IDGD	
CCOC(=O)c1ccc(N2CC(NC(=O)NNC(=O)[C@@H](CC)c3ccccc3)C2)nc1	753281167	VFNNKZPTQPGUJX-SFHVURJKSA-N	425.489	1.971	50	20	IDGD	
Nc1nc(Cl)cc(NNC(=O)C2CCN(S(=O)(=O)c3cccnc3Cl)CC2)n1	753453185	AXHATYMULDCBSH-UHFFFAOYSA-N	446.320	1.305	50	20	IDGD	
CCCN(CCNC(=O)NNC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)OC(C)(C)C	754670212	XTZKBNYJYSRHLE-UHFFFAOYSA-N	425.442	1.892	50	20	IDGD	
O=C(NNC(=O)c1cccc(I)c1O)c1cccc([N+](=O)[O-])c1	754823917	FAHBHWDEZUPYNV-UHFFFAOYSA-N	427.154	1.980	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1ccccc1S[C@H](Cl)C(F)(F)F	755612923	FNWJGOBFXJODNQ-HQJQHLMTSA-N	448.876	1.996	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)Nc1cccc(N2C(=O)CN(C)C2=O)c1	755990417	FBUVRVGFYNETMO-UHFFFAOYSA-N	427.417	1.325	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)Nc2ccc(S(=O)(=O)NC)cc2)cc1	756639900	IEFWERFCICNVHQ-CYBMUJFWSA-N	436.490	1.614	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)Nc2ccn(CC(=O)OC)n2)c2ccccc2c1=O	756648772	ZSHJYRPHAXWWCX-UHFFFAOYSA-N	441.448	1.033	50	20	IDGD	
CCOC(=O)C1CCN(C(=O)c2ccc(NC(=O)NNC(=O)c3c[nH]nc3C)cc2)CC1	756684663	ZDJXMCBSRCMQSF-UHFFFAOYSA-N	442.476	1.600	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)c2cncc(N3CCOCC3)c2)CC1	757002670	AHNIVWAQQNIJPK-UHFFFAOYSA-N	448.524	1.262	50	20	IDGD	
CN(c1ccccc1)S(=O)(=O)c1cccc(C(=O)NNc2ccc(C(N)=O)nn2)c1	757402981	RWFNUHXITJIXLE-UHFFFAOYSA-N	426.458	1.158	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)CN2C(=O)N[C@]3(C[C@@H](C)C[C@@H](C)C3)C2=O)c(C)c1	757732171	GYVKICDMKQJRDD-YEZVWNJWSA-N	429.521	1.609	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2cc(C(N)=O)ccc2-n2cc(C)cn2)cc1OC	757873595	CBMRYMWYRJUYAF-UHFFFAOYSA-N	438.444	1.763	50	20	IDGD	
Cc1nc(-c2cccc(C(F)(F)F)c2)[nH]c1C(=O)NNC(=O)CNC(=O)c1cccnc1	757911939	CVCZENXYJNHQBE-UHFFFAOYSA-N	446.389	1.990	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)nn1-c1ccc(Cl)cc1Cl	758045105	BMINADWTRGMCDB-VIFPVBQESA-N	434.305	1.186	50	20	IDGD	
C[C@H](NC(=O)OC(C)(C)C)C(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758788265	YPFKCSKMJWDYLN-ZDUSSCGKSA-N	429.518	1.535	50	20	IDGD	
COc1cc(F)cc(NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1	759315194	PUNLEJCHRJDAKP-UHFFFAOYSA-N	437.493	1.931	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCCN2CCC(N(C)C)CC2)cc1Br	759602082	FCHJBUNIBWPWPM-UHFFFAOYSA-N	442.358	1.428	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)CCNC(=O)[C@H]2CCCN2C(=O)OC(C)(C)C)cc1	760793849	SAFQQXYNNRDKEE-QGZVFWFLSA-N	432.521	1.916	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c(OC[C@@H]2CCCO2)c1	763441727	ILMUEOFXWAZRIJ-INIZCTEOSA-N	442.428	1.861	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)C(=O)Nc1cccc(Cl)c1-n1cncn1	763454994	LWFBTCCTEMABOF-UHFFFAOYSA-N	429.780	1.229	50	20	IDGD	
CN(Cc1cccc(NC(=O)C(=O)NNC(=O)c2ccncc2)c1)C(=O)OC(C)(C)C	763463226	YNHBMXRCZJFEQF-UHFFFAOYSA-N	427.461	1.848	50	20	IDGD	
O=C(NNC(=O)c1ccccc1O)C(=O)Nc1cc(Br)cnc1-n1cccn1	763527992	UGZARQNPVZARMK-UHFFFAOYSA-N	445.233	1.135	50	20	IDGD	
CCN1CCN(Cc2ccc(NC(=O)C(=O)NNC(=O)c3ccccc3F)cc2)CC1	763561442	KSZPNSLBCORFEZ-UHFFFAOYSA-N	427.480	1.363	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1Br	763573307	YMLUSOFFLZYKFF-HNNXBMFYSA-N	434.246	1.683	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2ccccc2N2CCN(C)CC2)c1	763645239	SMMPITJHYCTQQT-UHFFFAOYSA-N	439.516	1.220	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2cnc(Br)cc2C)c1	763650809	QJFSIWKPBFOENA-UHFFFAOYSA-N	435.278	1.934	50	20	IDGD	
NC(=O)c1cc(NC(=O)C(=O)NNC(=O)CSc2ccc(Cl)cc2)ccc1Cl	763733716	HKHHJVPVKKAXQZ-UHFFFAOYSA-N	441.296	1.971	50	20	IDGD	
C[C@H]1Oc2ccc(NC(=O)C(=O)NNC(=O)CSc3ccc(Cl)cc3)cc2NC1=O	763734363	KGEAGGHIOXWLRX-SNVBAGLBSA-N	448.888	1.938	50	20	IDGD	
COC(=O)c1c(F)cccc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1cccc(C)c1C	763852482	WLTZMHRDTLJSSJ-ZDUSSCGKSA-N	431.420	1.783	50	20	IDGD	
CCN1CCC(n2nccc2NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)CC1	763857827	PGWWQVINLJKNGN-AWEZNQCLSA-N	446.483	1.232	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(N(C)C(C)=O)cc2)cc1	763861383	OYEUKVKZULRQIB-AWEZNQCLSA-N	442.472	1.621	50	20	IDGD	
CCn1ncc2ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc3ccc(C(C)=O)cc3)cc21	763877067	HIPPKSCETQUGAX-AWEZNQCLSA-N	437.456	1.812	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(OC)nc2C)cc1OC	763912669	RECMWVKOEYXMOH-UHFFFAOYSA-N	430.461	1.986	50	20	IDGD	
C[C@@H]1CCC2=S=C(C(=O)NNC(=O)C(=O)Nc3ccc(S(C)(=O)=O)cc3)C=C2C1	763939186	ALTFUKHWVXIVQD-LLVKDONJSA-N	435.527	1.014	50	20	IDGD	
COCCn1ncc2ccc(NC(=O)C(=O)NNC(=O)c3cc(-c4ccccc4)on3)cc21	764016262	KKQYWUBBKUVGKH-UHFFFAOYSA-N	448.439	1.737	50	20	IDGD	
CSc1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	764077244	JXIMHKGIULPABH-UHFFFAOYSA-N	441.918	1.865	50	20	IDGD	
COc1ccc(C(C)(C)C)cc1NC(=O)C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	764078524	VPIZIQRXLSOXNI-UHFFFAOYSA-N	447.513	1.796	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(CCC(=O)N3CCCC3)cc2)c(O)c1	764112385	WQZJCZWWGJJKAV-UHFFFAOYSA-N	438.484	1.655	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1O)C(=O)Nc1ccc(CN2C(=O)CCC2=O)cc1	764126200	FIIBXKBOCASVEQ-UHFFFAOYSA-N	444.831	1.094	50	20	IDGD	
CCn1cnnc1-c1cccc(NC(=O)C(=O)NNC(=O)CCc2ccc(OC)cc2)c1	764126532	IRFWNDNGPYEQLB-UHFFFAOYSA-N	436.472	1.692	50	20	IDGD	
CC[C@H](C)NS(=O)(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)CCC(C)C)c1	764202955	GKSNDNFDMDTJKN-AWEZNQCLSA-N	426.539	1.427	50	20	IDGD	
COc1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C	764204645	QVJZADGLGWZPLK-UHFFFAOYSA-N	428.873	1.739	50	20	IDGD	
CC(C)OC(=O)NCc1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2O)cc1	764277761	NOYQGUUUXOYMNK-UHFFFAOYSA-N	444.444	1.192	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)C(=O)Nc1sc2c(c1C(=O)OC(C)C)CC[C@@H](C)C2	764297588	CHCVRTFEWWEOSO-SNVBAGLBSA-N	447.517	1.869	50	20	IDGD	
CC(=O)Nc1cc(NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)c(F)cc1F	764345917	LZZNMBQKIFXTGH-UHFFFAOYSA-N	426.763	1.682	50	20	IDGD	
COC(=O)c1ccc(OC)cc1NC(=O)C(=O)NNC(=O)CSc1ccccc1OC	764392636	JGILIJPHJVSQAL-UHFFFAOYSA-N	447.469	1.369	50	20	IDGD	
Cc1cc(O[C@@H](C)c2ccccc2)ccc1NC(=O)C(=O)NNC(=O)[C@@H]1COCCO1	764424966	LGMPFYANNUEDLN-KXBFYZLASA-N	427.457	1.636	50	20	IDGD	
Cc1nc(S(=O)(=O)N2CCC(C(=O)NNc3cnc4ccccc4n3)CC2)cn1C	765989396	CVKLIVNOSPZDEN-UHFFFAOYSA-N	429.506	1.216	50	20	IDGD	
COc1ccc(Cn2nc(C)c(C=NNC(=O)CSc3nnc(O)nc3O)c2C)cc1	767361660	PWAAGVUHVWLGDN-UHFFFAOYSA-N	443.489	1.395	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)[C@@H]3CCCN(S(=O)(=O)CC)C3)n[nH]2)cc1	768268694	RCDKEIWDIBMFIE-MRXNPFEDSA-N	433.534	1.462	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)[C@@H]1CCCN(C(=O)c2ccncc2)C1	768630638	VHLICWAAFLIWLG-OAHLLOKOSA-N	432.502	1.489	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](C(=O)NNC(=O)c1csc(N2CCOCC2)n1)C(C)(C)C	769053409	QWWCIEVFNYVSGM-CYBMUJFWSA-N	441.554	1.680	50	20	IDGD	
C[C@@H](CNC(=O)NNc1nc(O)c2cnn(C)c2n1)Oc1ccc(Br)cc1	770400189	ODVNIBXMMAHERB-VIFPVBQESA-N	436.270	1.925	50	20	IDGD	
C[C@@H]1C[C@@H](NC(=O)NNC(=O)[C@H]2COc3ccccc3O2)CCN1C(=O)OC(C)(C)C	772466244	XZLIMVLEUKSCKS-JKIFEVAISA-N	434.493	1.945	50	20	IDGD	
C#CCOc1ccccc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccc(OCC)cc1	773500697	VVECSGHTBVCILQ-OAHLLOKOSA-N	425.441	1.651	50	20	IDGD	
CCCNC(=O)[C@@H]1CN(C(=O)C(=O)NNc2ccccc2[N+](=O)[O-])c2ccccc2O1	773651467	YUVKMFNIDYIEPX-KRWDZBQOSA-N	427.417	1.358	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)NC[C@@H]1CC[C@@H](C(=O)N(C)C)O1	774664358	VKAFQMSINVTJAV-GJZGRUSLSA-N	431.518	1.698	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cnn(C)c2-c2ccccc2)cc1	775521630	VVJUKOPOYDFNTQ-UHFFFAOYSA-N	441.513	1.477	50	20	IDGD	
CC(C)(O)CCNC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	776258909	HQEVHKNDMQMNDE-UHFFFAOYSA-N	434.518	1.270	50	20	IDGD	
CCn1cc(-c2nn(C)cc2C(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)cn1	777412203	KXJUJHUUMJQXPH-UHFFFAOYSA-N	428.449	1.404	50	20	IDGD	
CC(=O)c1cccc(OCCCC(=O)N2CCN(S(=O)(=O)CBr)CC2)c1	777778132	XXABBBCFOYCDHX-UHFFFAOYSA-N	447.351	1.875	50	20	IDGD	
CN(CC(=O)NNC(=O)c1cccc(Cl)c1)C[C@]1(O)CCN(Cc2ccccc2)C1	778498559	UBHKJWPUEVSHGT-JOCHJYFZSA-N	430.936	1.670	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)[C@@H]2CN(C)C(=O)c3ccccc32)c2ccccc2c1=O	781866305	MBBBUFFIUSVMTP-GOSISDBHSA-N	433.468	1.437	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(C(=O)OC)cc1OC	782120902	MGRZAFCSGMPGPO-UHFFFAOYSA-N	429.429	1.209	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)C(=O)Nc1cccc2c1CCCC2	782897284	MULNRPBNYBOQMF-UHFFFAOYSA-N	443.529	1.567	50	20	IDGD	
O=C(Cn1cc(NC(=O)C(=O)NNc2ccc(Br)cc2)cn1)NC1CCCC1	783008898	AYIYIQWTRLDLLF-UHFFFAOYSA-N	449.309	1.786	50	20	IDGD	
CC[C@H](C)NS(=O)(=O)Cc1cccc(NC(=O)C(=O)NNc2ccc(OC)cc2)c1	783037207	NMLLUUQQNOGAOK-AWEZNQCLSA-N	434.518	1.995	50	20	IDGD	
O=C(NNc1cncc(Cl)n1)C(=O)Nc1ccc2nc(N3CCOCC3)sc2c1	783260064	VMHUXAYKYGMJPF-UHFFFAOYSA-N	433.881	1.658	50	20	IDGD	
CC(C)COc1cccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)c1	783264359	NJRPKMBRTLYPSP-UHFFFAOYSA-N	449.533	1.885	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNc2cccnc2Cl)cc1OC	784839393	UGNRYJXPAAWZTO-UHFFFAOYSA-N	427.870	1.587	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)C(=O)Nc2ccc(N3CCN(C)CC3)c(Cl)c2)c1	784854530	JLMYRVQEMGZTFF-UHFFFAOYSA-N	445.907	1.960	50	20	IDGD	
CN(C)c1nccc(NNC(=O)C(=O)Nc2ccccc2I)n1	784969858	RHRRLNGWTIFGGV-UHFFFAOYSA-N	426.218	1.229	50	20	IDGD	
Cc1ccc(C(=O)N2C[C@@H](C)C[C@H](C)C2)cc1NC(=O)C(=O)NNc1nccn(C)c1=O	785090141	ODDFIXHSCZACTM-KBPBESRZSA-N	440.504	1.289	50	20	IDGD	
CNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2cc(-c3cc(C)ccc3C)[nH]n2)c1	785130156	SQECRXKRFTXSBH-UHFFFAOYSA-N	434.456	1.453	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)[C@@H]2CCN(C(=O)OC(C)(C)C)[C@@H]2C)n1	786374747	ATNJCILRRJMOKN-CHWSQXEVSA-N	440.522	1.330	50	20	IDGD	
CN(C)Cc1ccc(NC(=O)C(=O)NNC(=O)CCc2ccco2)cc1Br	786416708	IHJSKWBNHBDCRF-UHFFFAOYSA-N	437.294	1.822	50	20	IDGD	
CNS(=O)(=O)c1cccc(NC(=O)[C@H](C)NC(=O)/C(C#N)=C\c2ccc(O)cc2)c1	787330468	YYFJTLFBKOLLRI-OJNRTJSBSA-N	428.470	1.351	50	20	IDGD	
Cn1nc(-c2ccsc2)cc1NC(=O)C(=O)NNC(=O)c1cnn(-c2ccccc2)c1	787549254	IWCJSDBBELJYRS-UHFFFAOYSA-N	435.469	1.734	50	20	IDGD	
O=C(NC[C@H](O)c1cc(F)cc(Cl)c1)NNC(=O)c1csc(N2CCOCC2)n1	787737776	YEBLIKSPYDKBKV-AWEZNQCLSA-N	443.888	1.450	50	20	IDGD	
O=C(NNC(=O)[C@H]1OCC[C@H]1c1ccccc1)C(=O)Nc1ccnn1Cc1ccccc1	789810252	LWVAGFDHTJWSBX-ICSRJNTNSA-N	433.468	1.590	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNS(=O)(=O)c3ccccc3CC#N)CC2)cc1	794592041	IXUWOAQBQWJGBI-UHFFFAOYSA-N	441.557	1.188	50	20	IDGD	
CCOC(=O)c1ccc(NNC(=O)CCN2CCN(C(=O)[C@H]3CCCO3)CC2)cc1C	794645644	FRASETPPIYBMIH-LJQANCHMSA-N	432.521	1.328	50	20	IDGD	
Cc1nnnn1/C(=C/c1ccc(F)cc1)C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	794718013	VQVNQMSRQOKZAS-LDADJPATSA-N	445.480	1.512	50	20	IDGD	
CNC(=O)c1cc(Cl)cc(S(=O)(=O)NNC(=O)COCc2ccccc2)c1OC	795323753	IGTGEUJQFKAABQ-UHFFFAOYSA-N	441.893	1.235	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNS(=O)(=O)c1cc2c(cc1OC)NC(=O)CO2	797428849	HXVZNTGDAJYUNJ-UHFFFAOYSA-N	441.849	1.311	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)c(C)c(OC)c1	800624855	IPJXOKLEAVSNLV-UHFFFAOYSA-N	441.419	1.941	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(/C#N)C(=O)NS(=O)(=O)[C@H](C)[C@H](C)C(=O)OC)c1C	802163940	TZMMEKKSKRCBLO-VLTGQZQSSA-N	439.534	1.863	50	20	IDGD	
Cc1ccc(C2=NO[C@@H](CNC(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)C2)cc1C	802377160	DJMHYXZDZHFDRS-QGZVFWFLSA-N	444.513	1.844	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(NC(=O)NNC(=O)[C@H]2COc3ccccc3O2)ccc1F	806543489	YCMYQSFLAJZMRL-OAHLLOKOSA-N	438.437	1.069	50	20	IDGD	
Cc1c(Br)cc(I)cc1C(=O)NNC(=O)CN(C)C	806770787	AJSCJXROUOLKJV-UHFFFAOYSA-N	440.079	1.685	50	20	IDGD	
CNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2ccccc2OC)c1Br	806977188	YPBLTRQSHRZURC-UHFFFAOYSA-N	449.261	1.217	50	20	IDGD	
COC(=O)c1cc(C)c(NC(=O)C(=O)NNC(=O)c2cncc(NC(C)=O)c2)c(Cl)c1	806980924	ZIVFGWUKOIMGJY-UHFFFAOYSA-N	447.835	1.188	50	20	IDGD	
Cc1ccccc1NC(=O)NNC(=O)C(=O)Nc1ccc(F)c(S(=O)(=O)N(C)C)c1	807001198	SKADBCHPYUQHSJ-UHFFFAOYSA-N	437.453	1.176	50	20	IDGD	
CC1CCN(S(=O)(=O)c2ccc(NC(=O)C(=O)NNc3ncccc3F)cc2)CC1	807302541	ZAMGWHXQXMXFJT-UHFFFAOYSA-N	435.481	1.723	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNc2nccnc2C2CCC2)cc1C(=O)OC	807461943	CACYORQHVYQDQO-UHFFFAOYSA-N	427.417	1.399	50	20	IDGD	
C[C@H]1CSC[C@H]1NC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	807475606	IBEJPHFXSXAXCA-KBXCAEBGSA-N	448.570	1.861	50	20	IDGD	
Cc1nc2ccc(NC(=O)C(=O)NNC(=O)c3ccc(F)cc3Br)cn2n1	810384987	TXYJCAWWLBZMBU-UHFFFAOYSA-N	435.213	1.339	50	20	IDGD	
CNC(=O)c1cc(Oc2ccc(NC(=O)C(=O)NNC(=O)CC3CC3)cc2F)ccn1	810386774	QPUCZFLTCQXYMS-UHFFFAOYSA-N	429.408	1.259	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)CCC(=O)c2ccc3c(c2)OCCO3)cc1	812729822	VKYMSPLIKCDCBV-UHFFFAOYSA-N	433.486	1.814	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)CNC(=O)OC(C)(C)C)c1ccc(N2CCCNC2=O)cc1	812943994	JBAHFJJUCULMPR-CYBMUJFWSA-N	434.497	1.522	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCc2nncn2C1)C(=O)Nc1cc(Cl)ccc1Br	815692082	IUZMGNLGNORQHZ-MRVPVSSYSA-N	441.673	1.043	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)CCNC(=O)Cc2ccccc2)c2ccccc2c1=O	821877285	IMNOSFNXFPCDHC-UHFFFAOYSA-N	435.484	1.487	50	20	IDGD	
Cc1cccc(NNC(=O)[C@H](CCS(C)(=O)=O)NS(=O)(=O)c2ccccc2)c1	849610674	MSFGKVBEKWMOKH-KRWDZBQOSA-N	425.532	1.220	50	20	IDGD	
Cc1cc(C(=O)N([C@H]2CCS(=O)(=O)C2)N(C)C)c2cnn(Cc3cccs3)c2n1	886575830	MGVWDVWQVHWKNH-AWEZNQCLSA-N	433.559	1.955	50	20	IDGD	
C[C@H]1CCCCN1C(=O)CN1CCN(CC(=O)NNC(=O)c2cccc(Cl)c2)CC1	913053421	QNBZDXMICLHCPF-INIZCTEOSA-N	435.956	1.120	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)CNS(=O)(=O)c2ccc(Cl)cc2)cc1C	913450264	MQUQJXPNIQKJHN-UHFFFAOYSA-N	425.894	1.462	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CC(=O)N(c2ccc(F)cc2F)C1)c1nn(-c2ccccc2)cc1O	914830817	ZMSNMTURBZBZQG-GFCCVEGCSA-N	441.394	1.670	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)C2CCN(C(=O)COc3ccccc3)CC2)cc1	914846699	VTVXGGYSLLYJKO-UHFFFAOYSA-N	436.468	1.402	50	20	IDGD	
C[C@H]1C[C@@H]1C(=O)Nc1ccc(C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1	915407631	FTKJTBDNVZPJQE-SJCJKPOMSA-N	440.412	1.807	50	20	IDGD	
CN(C)N(C(=O)Cc1csc(NC(=O)c2ccccc2F)n1)[C@@H]1CCS(=O)(=O)C1	915828408	JCTGJFXWPUZWJK-CYBMUJFWSA-N	440.522	1.569	50	20	IDGD	
CN1CCC(NC(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)CC1	915898763	ZWTRVKYDWUWTGX-UHFFFAOYSA-N	437.547	1.587	50	20	IDGD	
CC(=NNC(=O)c1nn(C)c(=O)c2ccccc12)c1cccc(S(=O)(=O)N(C)C)c1	915947340	QBBMUMDLXILQKZ-UHFFFAOYSA-N	427.486	1.338	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NCCCCc3ccccc3)nc2)CC1	916230271	TZTRCARYWNWGPZ-UHFFFAOYSA-N	446.577	1.667	50	20	IDGD	
CCCOc1ccc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1	916392122	GBYIFXNUDMSZSX-UHFFFAOYSA-N	434.518	1.870	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NCCN1CCN(c2ccc(F)cc2)CC1	916513978	YLAYWDIZHIFZCJ-MRXNPFEDSA-N	447.486	1.885	50	20	IDGD	
CC(C)(Oc1ccc(F)cc1)C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	916519382	DVQAMKZMYAZSRE-KRWDZBQOSA-N	432.404	1.514	50	20	IDGD	
CC(C)(C)C(=O)NNC(=O)c1cccc(NS(=O)(=O)c2ccc3nnn(O)c3c2)c1	917181454	JEDYOHCLJUIKQU-UHFFFAOYSA-N	432.462	1.277	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)CCn2cc(Br)cn2)c2ccccc2c1=O	917914951	BHCBTRDNQRWUSR-UHFFFAOYSA-N	433.266	1.227	50	20	IDGD	
CN(C)[C@H](CNC(=O)NNC(=O)c1csc(N2CCOCC2)n1)c1ccc(F)cc1	918091396	VGDRYRPSVJZVFY-MRXNPFEDSA-N	436.513	1.366	50	20	IDGD	
NC(=O)[C@@H]1CC(C(=O)NNC(=O)c2ccc(F)cc2Br)=NN1c1ccccc1	918341235	GIVMNSRNUMOIQC-HNNXBMFYSA-N	448.252	1.469	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COc2ccc(Br)cc2)cc1OCCO	918688423	QAYIQTLTQVMDPT-UHFFFAOYSA-N	439.262	1.669	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)NNC(=O)C12CC3CC(CC(C3)C1)C2	918779538	YNKCCYCOOYTMDZ-UHFFFAOYSA-N	448.549	1.171	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)OCC(=O)N2CCC[C@H](NC(C)=O)C2)c1C	918808401	BLKYFUPEDUMAAQ-FJZBCQJGSA-N	430.505	1.329	50	20	IDGD	
CCOCCCN1CC[C@H](NC(=O)NNC(=O)c2cncn2-c2ccccc2)[C@H](C)C1	1116080432	ITUAMFDOCACGNP-MJGOQNOKSA-N	428.537	1.953	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cn(C)cc2C(F)(F)F)cc1	1116590261	NBMFPEXCBNAHDQ-UHFFFAOYSA-N	432.424	1.434	50	20	IDGD	
C[C@H](Sc1ncccc1C(=O)NNC(=O)c1n[nH]c2c1CCCC2)C(=O)N1CCCC1	1322304356	RERLUHJOWFLRHX-ZDUSSCGKSA-N	442.545	1.861	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)c2cnc(O)c(Br)c2)CC1	1323167359	FRRSTCNPJUWYRC-UHFFFAOYSA-N	443.298	1.958	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)Cc2ccc(C(=O)NNC(=O)[C@]3(F)CCOC3)cc2)cc1	1324062820	TXSMDYDHQVHNLW-NRFANRHFSA-N	449.504	1.705	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCc2ccccc2OCCN2CCOCC2)cc1	1324574945	BGCBWFVSPKCMNY-UHFFFAOYSA-N	428.489	1.550	50	20	IDGD	
O=C(c1ccc2nccnc2c1)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1777978829	CUFLRIVMENDLDZ-YJBOKZPZSA-N	437.269	1.764	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(O)c([N+](=O)[O-])c1)C2)[C@@H](F)Cl	1778028775	PIMOWIWOAIVMJS-IIDMSEBBSA-N	429.832	1.962	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnc3ccccn23)C1	1778587381	CQYZVLQUEQZYMC-LUQKVYGDSA-N	434.924	1.716	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)N1CCN(C)CC1)C2	1780708675	YBLKERZPLPTQGK-LXGFNABISA-N	429.005	1.154	50	20	IDGD	
O=C(/C=C/c1cccc(O)c1)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781335043	UYOGNWOHHGIOQQ-NCWIEVAOSA-N	427.270	1.926	50	20	IDGD	
O=C(c1ccc(N2CCCCC2)cc1)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1781711933	WFDZJBRCTDHSGA-UGKGYDQZSA-N	435.952	1.720	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc3c1cnn3C)C2	1782176055	WRQDWGMCIRISHQ-SFGWALBWSA-N	448.951	1.955	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)C(C)(C)CNC(C)=O)CCO2	1783343487	NJAOJALYGIGPNR-RDTXWAMCSA-N	432.359	1.152	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3c4c(nn3C)CCC4)CCO2)C1	1783353501	PCNZHCQXCAIZJB-KUHUBIRLSA-N	439.354	1.526	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(CCN(C(=O)Cc3ccc4c(c3)CCO4)C2)C1	1783419256	GDJYKBNFSUEMDP-JOCHJYFZSA-N	432.593	1.845	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)CCc3cc(F)ccn3)CCO2)C1	1783529808	NPUDTGBSCLETDQ-SCLBCKFNSA-N	428.302	1.767	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cncc(N(C)C)c3)CCO2)C1	1783531894	FIGLMVNRJDRZEU-FZKQIMNGSA-N	425.327	1.375	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cnc(OCF)cn3)CCO2)C1	1783533249	YIXNRRKNLVMVLZ-ZBEGNZNMSA-N	431.262	1.009	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)C[C@@H](C)NC(=O)OC(C)(C)C)CCO2)C1	1783876033	QTTPZCSEFFLGGM-SXGZJXTBSA-N	447.960	1.373	50	20	IDGD	
C[C@H](Oc1ccccn1)C(=O)N1CC[C@]2(CN(C(=O)[C@@H](F)Br)CCO2)C1	1784488096	MWLOEJRENXVYKQ-DXCKQFNASA-N	430.274	1.369	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(C(N)=O)cc3)C2)C1	1784931821	UYQXOQNMVXRTCH-OALUTQOASA-N	428.316	1.465	50	20	IDGD	
CC(=O)Nc1ccc(Cl)c(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)c1	1785270625	PFQBIXRTHXJQTK-APWZRJJASA-N	444.315	1.342	50	20	IDGD	
C[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CO[Si](C)(C)C)C[C@@H]21)n1cccc1C=O	1786996279	RBARDSNIVXHXKH-CAMMJAKZSA-N	435.597	1.693	50	20	IDGD	
O=C(Cc1ccc(F)cn1)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1	1788198902	GVBSZXPAXPCVLA-UHFFFAOYSA-N	447.275	1.891	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)c1c[nH]c2cnccc12	1788453316	UKEYUJRTKWRSLO-NUTKFTJISA-N	435.322	1.941	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3Cc4ccccc4N3)C[C@@H]21	1788763451	DRLDQPHGQVNTRE-ZULIPRJHSA-N	431.609	1.854	50	20	IDGD	
Cc1nc(F)ccc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21	1789062374	IFHRDFBGQGKCHQ-QEJZJMRPSA-N	428.302	1.907	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(OC)cc3OC)[C@H]2C1	1789470326	BJLUJWKYGIIQSU-UHEFJODHSA-N	440.924	1.551	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3Cc4ccccc4N3)[C@H]2C1	1790682719	FNIATUHWCBCEAX-FUXXODJASA-N	436.350	1.786	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3ccc(F)cc3)[C@H]2C1	1791099592	IEHNCRXNMNTGLI-WNHJNPCNSA-N	426.916	1.992	50	20	IDGD	
CN[C@H](CC(=O)NC1(c2ccc(NC(=O)[C@H](C)Br)cc2)CCC1)C(=O)O	1791434814	ZVMUXHSTEZTKLL-SMDDNHRTSA-N	426.311	1.967	50	20	IDGD	
CC(C)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(Cl)c3nncn3c1)C2	1792783582	XHARIVZEYOCGFJ-AGGWBTHJSA-N	440.331	1.851	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3ccc(Cl)cc3nn1)C2)[C@H](O)CCl	1792978519	YFUJHPSMNRQSLQ-CZAMWMTLSA-N	439.299	1.086	50	20	IDGD	
CCN(CC)[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](O)CCl)c1ccccc1	1792984407	ZVELZWCGDVILQG-LJDSDSDDSA-N	437.968	1.259	50	20	IDGD	
Cc1cccc(C)c1N1C[C@H](C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](O)CCl)C3)CC1=O	1794130189	YJYPYBLGQYPPRT-FQBWVUSXSA-N	447.963	1.894	50	20	IDGD	
COc1ncc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)Br)C3)cc1F	1794364595	AUZOHCXDBPBECG-SGESHTKJSA-N	430.274	1.216	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C(C)=N/NC(=O)c1ccc[nH]1	1796893838	YRKZYOYWPGBHOF-GNUOBCGASA-N	447.492	1.320	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2n(n1)CCCO2	1798096712	MQZRRIDHTYQAGY-YIYPIFLZSA-N	425.327	1.948	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cncc3cnccc13)C2	1798439800	GOFZZXKLTAYFIB-MUJYYYPQSA-N	445.483	1.194	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2)c1n[nH]c2c1CCc1ncccc1-2	1798475468	AHKANLPECILEOD-WQKDULPXSA-N	433.871	1.308	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(Cl)c(F)cc1F)c1cccc(B(O)O)c1	1800317497	SLTPMUMSSSYTTD-QDMKHBRRSA-N	448.662	1.864	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccno1)C2)[C@@H](Br)Cc1ccccc1	1800435676	LILDGSLWNMEUIV-DFGXFYAUSA-N	448.317	1.884	50	20	IDGD	
COC(=O)c1ccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CO[Si](C)(C)C)C3)cc1	1801144648	NJGOUACYGAVLDX-RMFSNUHRSA-N	448.592	1.457	50	20	IDGD	
C[C@H](NC=O)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](Br)Cc1ccccc1	1801570296	IEECOAQXPLEUAW-JFMONLCZSA-N	436.350	1.765	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H]1Cc3ccccc3CN1C)C2	1802333449	WWTUSECMCUBNCY-WOZUAGRISA-N	441.576	1.054	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2n[nH]c3c2CCCC3)[C@@H]1c1cccnc1)[C@H](O)CCl	1803138813	FNROWEOPQRDKJI-POZUXBRTSA-N	431.924	1.603	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cccn3cncc23)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803142687	GYGBYHLTQKJTFI-ZYSHUDEJSA-N	427.892	1.649	50	20	IDGD	
Cc1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)c(F)c1F	1803642218	MWAMYGKUGRZVLR-BJWYYQGGSA-N	428.244	1.519	50	20	IDGD	
C[C@H](CC(N)=O)C(=O)NC[C@@H]1CCN(C(=O)[C@@](C)(Cl)CCl)[C@@H]1c1cccnc1	1803672415	XHQJLLHOBJYBMW-FERZIJSQSA-N	429.348	1.835	50	20	IDGD	
C=CCSCC(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1804173580	XNSDKKUOUCTQMS-RXVVDRJESA-N	439.346	1.000	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)c2ccc(O)nn2)[C@@H]1c1cccnc1	1805271163	VBDWTHRQNRLORH-GHJWDPDVSA-N	434.294	1.680	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC2(CCN(C(=O)CCc3nc(N)n[nH]3)CC2)C1	1805385411	XHGDIYXWPZAYDI-CYBMUJFWSA-N	441.374	1.582	50	20	IDGD	
CC(=O)NCCC(=O)N1CC[C@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]1c1cccnc1	1808318310	UQAMMKRTJJCDKA-SZVBFZGTSA-N	429.348	1.850	50	20	IDGD	
Cc1cc(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)ncc1[N+](=O)[O-]	1808659566	LIOFBGIVOLJUKN-WBAXXEDZSA-N	447.879	1.613	50	20	IDGD	
O=C(c1ccc(Cl)nc1)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1	1809972655	KYNGASDVISDAGM-UHFFFAOYSA-N	441.724	1.573	50	20	IDGD	
C[C@H](C(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)n1ccccc1=O	1810515700	TVIVRQBJMRNAPX-NOCIGQNYSA-N	432.908	1.110	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1CCN(C(=O)[C@@H]2CCC(=O)NC2)[C@H]1c1cccnc1	1810538082	SALNVXXPNKHTEF-QKLQHJQFSA-N	432.597	1.465	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)n3)C2)CC1	1810891653	ZKJLDNXGHYSUMI-NSHDSACASA-N	427.299	1.516	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H](CNC(=O)[C@@H]2CCCS2(=O)=O)[C@H]1c1cccnc1	1812494329	SYZJWIZLEHFWFO-IXDOHACOSA-N	441.981	1.930	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)C(C)(C)NCCC#N)[C@H]1c1cccnc1	1813031839	SWDZJUFPXXYYCG-BZSNNMDCSA-N	435.956	1.623	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2cccs2)[C@@H]1c1cccnc1	1813070302	GZSVGNQYVGQFAX-OXQOHEQNSA-N	429.546	1.836	50	20	IDGD	
CN1CCCn2nc(C(=O)N3CCCC[C@@H]3c3cc(NC(=O)[C@H](O)CCl)n[nH]3)cc2C1	1814875072	NULHBBUGBITKAX-IAGOWNOFSA-N	449.943	1.347	50	20	IDGD	
Cc1cncc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)c1	1815339982	YVQCSCUCWPFNSF-MRXNPFEDSA-N	436.302	1.066	50	20	IDGD	
C[C@]1(C(=O)N[C@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)CC1(F)F	1815347880	VJKXOCZWLKXXKK-KPZWWZAWSA-N	435.261	1.094	50	20	IDGD	
O=C1CC[C@@H](C(=O)N2CCCC[C@@H]2c2cc(NC(=O)CCBr)n[nH]2)CN1	1816779311	FXPODBIIEQYOGO-DGCLKSJQSA-N	426.315	1.713	50	20	IDGD	
O=C1C[C@@H](C(=O)N2CCCC[C@@H]2c2cc(NC(=O)CCBr)n[nH]2)CCN1	1816784813	NYFKHSXXMLYLRL-WCQYABFASA-N	426.315	1.713	50	20	IDGD	
CC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1816812747	SELPXIJMHMEMCU-MRXNPFEDSA-N	427.465	1.083	50	20	IDGD	
O=C(Cc1ccccc1)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1816889527	ZENGMDHSMMYHRW-HXUWFJFHSA-N	432.289	1.638	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)C(F)(F)C(F)(F)C(=O)O)CC2)[C@@H](F)Cl	1817116377	XHBOHGGKWUGCOV-CLZZGJSISA-N	435.758	1.945	50	20	IDGD	
COc1cccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)n1	1817473420	SGSPPYXMOPCMIL-GOSISDBHSA-N	449.276	1.113	50	20	IDGD	
Cc1ncc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)s1	1817475448	RGLHXLPISOWEMJ-INIZCTEOSA-N	439.306	1.474	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ncccc2F)[nH]n1)c1cccc(B(O)O)c1	1817477035	WLZSSPJAQSDRMQ-KRWDZBQOSA-N	437.240	1.243	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc(F)c[nH]2)[nH]n1)c1cccc(B(O)O)c1	1817479408	MGLMROGMTYEYJF-QGZVFWFLSA-N	425.229	1.176	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)CC[C@@H]2CCOC2)[nH]n1)c1cccc(B(O)O)c1	1817479524	PATWJZGHWHYVLT-BEFAXECRSA-N	440.309	1.212	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccncn2)n[nH]1	1818177257	LGROLCHTYAHDRU-FCLYZYNOSA-N	449.475	1.640	50	20	IDGD	
Cc1nc(C)c(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)CCC(=O)NN(C)C)CC3)o1	1820582698	VPJRNXCRRSTSSC-GFCCVEGCSA-N	434.522	1.347	50	20	IDGD	
CNC(=S)NCCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](Cl)COC)n[nH]1	1822369148	DAWSUCRXPATQAT-DGCLKSJQSA-N	430.962	1.140	50	20	IDGD	
Cc1ccc(C(=O)N[C@@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)cn1	1826080465	MCRNEXZMHTXEBJ-CQSZACIVSA-N	430.534	1.445	50	20	IDGD	
C[C@@H]1CC[C@H](C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)O1	1827058994	CDLMLLWEJAKURV-TYCQWZJGSA-N	428.338	1.167	50	20	IDGD	
C[C@]1(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CCCN1	1830272479	KPUWCGSBYYGVQM-AUSIDOKSSA-N	442.564	1.061	50	20	IDGD	
C=CCC(CC=C)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCBr)C2)C1	1830639061	KMAVCEPIGNYOAX-LJQANCHMSA-N	429.355	1.996	50	20	IDGD	
O=C(Cn1ccc2c(F)cccc21)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1830653197	YHMGDYWWHOKHGB-AZUAARDMSA-N	441.862	1.771	50	20	IDGD	
C=CCSCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)CBr)C2)C1	1832446968	NMVYJASWLUCZTH-YOEHRIQHSA-N	435.384	1.393	50	20	IDGD	
O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(F)s1)CCO2	1833213370	OQABKRLCFZLMBR-MRXNPFEDSA-N	435.315	1.742	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)s1	1833425751	NLIOJYHREYGFQA-SJCJKPOMSA-N	447.351	1.610	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](F)Cl)CC2)CC1)[C@@H]1COc2ccccc2O1	1833715389	GATLJMOFIUWRET-OALUTQOASA-N	439.915	1.932	50	20	IDGD	
CCc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)cn1	1833892836	UWUJXXXAWCHHKU-PMACEKPBSA-N	444.359	1.950	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cn(C)nc3OC)CC2)CC1	1834082660	NKTWKZJRJWPJLA-QGZVFWFLSA-N	425.961	1.631	50	20	IDGD	
Cc1cnc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)cn1	1834084234	KASBRMCUZWWFNI-ZWKOTPCHSA-N	431.320	1.091	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cnoc1C1CC1)CCO2	1834613959	DISMSXMJVJJKOB-FQEVSTJZSA-N	437.569	1.474	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cccn4c(O)nnc34)CC2)CC1	1835046068	PHESKTRVIHNPBS-QGZVFWFLSA-N	448.955	1.638	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnccc3F)CCO2)C1	1836317796	BUFJQIXVQAEKAQ-MSOLQXFVSA-N	434.295	1.527	50	20	IDGD	
O=C(Cc1cnc2ccccn12)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836701051	AXHCVPUUZCTFRK-IBGZPJMESA-N	448.951	1.475	50	20	IDGD	
O=C(c1ccc2nccn2c1)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836717322	TYDTWCFJGKRLCE-GOSISDBHSA-N	434.924	1.546	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc4cccnc4n3)CCO2)C1	1836832466	BJHOGQYRDDAJFJ-IERDGZPVSA-N	432.908	1.717	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc4cccnc4[nH]3)CCO2)C1	1837005272	YXDATFGPEFWXIZ-OAQYLSRUSA-N	434.924	1.898	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(F)n3)C2)C1	1837715320	JOCKZQUYXSUQOT-LJQANCHMSA-N	425.533	1.142	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4c(c3)CCN4C)C2)C1	1839144957	PDJLHSCRGJXXGH-GCJKJVERSA-N	435.952	1.766	50	20	IDGD	
COc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)nc1	1839153025	RUYYRBPCHNFNLY-RTBURBONSA-N	446.331	1.397	50	20	IDGD	
O=C([C@H](F)Br)N1CCO[C@@]2(COCCN(C(=O)C(F)(F)C(F)F)C2)C1	1839199585	YCHKRQPOPSTVBZ-UFBFGSQYSA-N	439.175	1.034	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)c(C)n1	1839200870	RERLJOAVZBVUPN-CRAIPNDOSA-N	444.301	1.459	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)C[C@@H]3CCCCO3)C2)C1	1840030671	SCPQSIXEUUVHRY-MPGHIAIKSA-N	433.343	1.185	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cccs3)C2)C1	1840032113	OAPQASVKQRCLAD-CXAGYDPISA-N	431.352	1.530	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(C(C)C)on3)C2)C1	1840150416	KPPSMOCUUGAPEV-IFXJQAMLSA-N	429.901	1.122	50	20	IDGD	
COc1ccc(F)cc1CC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1840250409	XZBQAXVJTFLMNN-PKOBYXMFSA-N	432.851	1.368	50	20	IDGD	
C=CC[C@@H](CC(=O)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1)NC(=O)OC(C)(C)C	1841354825	YYWVXEXLNMLBLZ-LSDHHAIUSA-N	429.945	1.649	50	20	IDGD	
O=C(c1cccnc1-c1ccccc1)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843013893	ZWUHLTWQBHAANG-UHFFFAOYSA-N	441.296	1.559	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)[C@H]2Cc3ccccc3CN2)C1	1843368465	FMIVVMCTCVOQBA-CSWGWEJPSA-N	448.527	1.038	50	20	IDGD	
CO[C@H](C(=O)N1CC2(CCCN2C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C1)c1ccccc1	1843415698	BQFMGVLAZOJWII-PTFSYIGCSA-N	437.500	1.712	50	20	IDGD	
CC(C)[C@H](C(=O)N1CC2(CCCN2C(=O)c2cnccc2C(=O)NN)C1)c1ccccc1	1844263636	ZUCDWWMAUJXQOB-FQEVSTJZSA-N	435.528	1.942	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC12CN(C(=O)c1cc(=O)nc3cccnn13)C2	1846071185	BTCRXWRHHRAYPY-LBPRGKRZSA-N	434.294	1.080	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC12CN(C(=O)c1nc3ccccc3n(C)c1=O)C2	1846177109	YCKFTEAPALZNOL-GFCCVEGCSA-N	433.306	1.534	50	20	IDGD	
CC#C[C@@H](CC(=O)N1CC2(CCCN2C(=O)CCC(=O)NN(C)C)C1)c1ccc(O)cc1	1846386086	AORQETMREJXRTR-IBGZPJMESA-N	440.544	1.466	50	20	IDGD	
CSc1cccc(N2C[C@H](C(=O)OCC(=O)NNC(=O)c3ccccc3)CC2=O)c1	10265045	DEWPLGPTQKIPET-OAHLLOKOSA-N	427.482	1.766	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NN[C@H](C(=O)NC2CC2)c2ccccc2)cc1	15474358	IBIROIWEZUAIEU-FQEVSTJZSA-N	430.530	1.256	50	20	IDGD	
C[C@@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)NNC(=S)NCCc2cccs2)C1=O	21124400	JYVXGQRPYGVZPO-IBGZPJMESA-N	449.533	1.392	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)[C@H]2CCCN(C(=O)c3ccc(F)cc3)C2)nc2ccccc21	26538649	FXLPOMPEELNPER-INIZCTEOSA-N	437.475	1.955	50	20	IDGD	
CC(C)c1ccccc1NC(=S)NNC(=O)[C@H]1CC(=O)N([C@H]2CCS(=O)(=O)C2)C1	727171857	OHWDSXSBGQOLII-KBPBESRZSA-N	438.575	1.163	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)CNC(=O)c2ccc(Br)o2)cc1F	727498725	QANCEGRGMNLAEV-UHFFFAOYSA-N	445.270	1.937	50	20	IDGD	
CC(C)(C)OC(=O)N1CCCC[C@H]1C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	728889561	CEYWDEJXUQKOBV-INIZCTEOSA-N	432.525	1.630	50	20	IDGD	
CC(C)(C)OC(=O)N1CSC[C@H]1C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	728889926	ITUCVRIRCQMZQO-AWEZNQCLSA-N	436.538	1.150	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=O)COc2ccccc2O)c1	730782424	NHEMRKLZVBBXNM-UHFFFAOYSA-N	427.866	1.136	50	20	IDGD	
CC[C@@H]1CCCN(C(C)(C)CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)C1	732235347	AJBOBTGVNXWNNA-OAHLLOKOSA-N	438.598	1.824	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)Cc1cn2cccc(C)c2n1	732358765	TZEZQDUCHQTPHC-UHFFFAOYSA-N	430.848	1.852	50	20	IDGD	
O=C(NN=Cc1c(N2CCOCC2)nc2ccccn2c1=O)c1ccc(O)c(Cl)c1	734094331	LQTVHNSFRASYBU-UHFFFAOYSA-N	427.848	1.654	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@@H](CCN(C)C)C(C)(C)C)cc1	734952092	BVOMNYICNFTXCJ-KRWDZBQOSA-N	441.598	1.312	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)Sc1nc(C2CC2)nc2c1c(O)nc(=O)n2C1CC1	734980799	AWAIJHXUZRFIDL-SNVBAGLBSA-N	446.533	1.779	50	20	IDGD	
CC(C)(C)OC(=O)NC1CCC(NC(=O)NNC(=O)CNC(=O)c2cccs2)CC1	740043649	KQGIKBCGSZUTTK-UHFFFAOYSA-N	439.538	1.644	50	20	IDGD	
CCS(=O)(=O)N[C@@H](CCSC)C(=O)NNC(=O)c1cccc(Br)c1	742771494	WYIYBQZVGAMXAS-LBPRGKRZSA-N	438.369	1.271	50	20	IDGD	
CC(=O)N1c2ccc(S(=O)(=O)NNC(=O)c3cc([N+](=O)[O-])ccc3O)cc2C[C@@H]1C	743268487	UVOWWDUIXIAWEM-JTQLQIEISA-N	434.430	1.221	50	20	IDGD	
C[C@@H]1Oc2ccccc2N(CCC(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)C1=O	744531204	MKSXKEGOKXXJIF-AWEZNQCLSA-N	436.424	1.067	50	20	IDGD	
C[C@H]1CN(c2ccc(CNC(=O)NNC(=O)c3cc([N+](=O)[O-])ccc3O)cn2)C[C@H](C)O1	745469147	TWQVXTSNBMMNCF-STQMWFEESA-N	444.448	1.453	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)N[C@@H]3CCc4c(O)cccc43)nc2)CC1	745865376	OPXFRPFHMMQHIY-QGZVFWFLSA-N	446.533	1.037	50	20	IDGD	
Cc1ccc(N2CCC[C@H](NC(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)C2)cc1	745887873	LZTZPYMEMPKGKV-INIZCTEOSA-N	434.500	1.855	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)c1cccc(S(=O)(=O)NCc2cccs2)c1	747428695	SBCWSTBMJGCLOP-UHFFFAOYSA-N	430.511	1.625	50	20	IDGD	
O=C(NNc1ccc(F)cc1Br)C1=NN([C@@H]2CCS(=O)(=O)C2)C(=O)CC1	748075493	ZBYVWQGBSRQHSG-SNVBAGLBSA-N	447.286	1.197	50	20	IDGD	
O=C(CN1CCC[C@H](CN2CCN(c3ccccn3)CC2)C1)NNC(=O)c1cccs1	748320055	YWEBOWFQMCZONF-GOSISDBHSA-N	442.589	1.438	50	20	IDGD	
CCCCS(=O)(=O)N1CCC[C@H]1C(=O)NNc1ccc(S(=O)(=O)C(F)F)cc1	748611177	GMKZNHBOUKLFHH-AWEZNQCLSA-N	439.506	1.720	50	20	IDGD	
COCCOCC(=O)NC1CCC(C(=O)NNC(=O)c2ccc(Cl)cc2OC)CC1	748700833	GQCGXMGOCGLDLT-UHFFFAOYSA-N	441.912	1.448	50	20	IDGD	
CN1CCN([C@H](C(=O)NNc2nc(Br)cn3ccnc23)c2ccccc2)CC1	750248336	MNDYOMPVKSWDRB-INIZCTEOSA-N	444.337	1.924	50	20	IDGD	
O=C(Cc1ccc(O)cc1)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	751124719	BCQYOHZYBJFTKW-UHFFFAOYSA-N	439.493	1.874	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2ccc(CS(=O)(=O)C(F)F)cc2)cc1OC	751557894	IUNPORAHQDXTNT-UHFFFAOYSA-N	428.413	1.916	50	20	IDGD	
CC[C@H](CS(=O)(=O)c1ccccc1)NC(=O)NNC(=O)c1cc(OC)cc(OC)c1	752702779	FFBNNDDKYPAWLV-OAHLLOKOSA-N	435.502	1.900	50	20	IDGD	
CC(C)CCn1ncc(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1C(C)C	753839524	LGUKSLXZRNKSLV-SFHVURJKSA-N	443.504	1.979	50	20	IDGD	
COc1cc(NC2CCN(CC(=O)NNC(=O)c3cccc(C#N)c3)CC2)cc(OC)c1	754666806	ZIPZOIWFEIFVQN-UHFFFAOYSA-N	437.500	1.913	50	20	IDGD	
C[C@@](O)(C(=O)NNC(=O)C1CCN(c2ncccn2)CC1)c1cccc(C(F)(F)F)c1	754851517	RPEGARXQFKAZLN-IBGZPJMESA-N	437.422	1.767	50	20	IDGD	
N#Cc1ccc(N2C(=O)N[C@H](CCC(=O)NNc3ccc(C(F)(F)F)nn3)C2=O)cc1	755187882	SYGLTAZGBDXQLR-GFCCVEGCSA-N	433.350	1.715	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)Nc2ccccc2S(C)(=O)=O)c2ccccc2c1=O	755586409	WITANCGPSWPLPH-UHFFFAOYSA-N	443.485	1.847	50	20	IDGD	
CC(C)(C)S(=O)(=O)N1CCC(NC(=O)NNC(=O)CSc2ccccc2O)CC1	755926981	SOARZDQPFKGIAK-UHFFFAOYSA-N	444.579	1.407	50	20	IDGD	
Cn1cc(CCC(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c2ccccc21	756666816	MKSXKHICJHPUOO-HXUWFJFHSA-N	437.452	1.642	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)[C@@](C)(O)CN2Cc3ccccc3C2=O)c1C	756796307	HYAJBFZOTQPROK-HJPURHCSSA-N	425.485	1.625	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)Nc2cc(C(N)=O)ccc2CN(C)C)cc1	756826196	BSKUCXCOQRMEFR-CQSZACIVSA-N	443.504	1.866	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)c2cnn(CCO[C@@H]3CCCCO3)c2C)c1	758077752	BZSRNYRVFQFDNS-LJQANCHMSA-N	432.477	1.827	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)N[C@H]2CN(C(=O)OC(C)(C)C)C[C@H]2C#N)cc1C	758752122	LVWQSDMTOXWFQN-ZBFHGGJFSA-N	444.492	1.331	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)N[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1C#N	758758500	IKCXMKNMMMPUHC-ZIAGYGMSSA-N	427.465	1.346	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)N[C@H]2CN(C(=O)OC(C)(C)C)C[C@@H]2C#N)cc1	758770403	LDXNTPJZYAZOCT-RDJZCZTQSA-N	431.493	1.717	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NC[C@H](C[C@H](C)O)c1ccccc1	759611718	OWQGSOBZDIDHOA-YOEHRIQHSA-N	447.561	1.787	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(F)(F)[C@@H](C(=O)NNc2nccc(N3CCOCC3)n2)C1	760858370	CBDCPTZGIQCYCU-CYBMUJFWSA-N	442.467	1.649	50	20	IDGD	
O=C(NNc1ncc(F)cn1)c1cc(S(=O)(=O)NC2CC2)ccc1Br	760905943	DCUIVQPQWHLUNE-UHFFFAOYSA-N	430.259	1.576	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)CNC(=O)N1CCc2ccccc2C1	762361654	QIMHHFBMNXLNGG-UHFFFAOYSA-N	428.514	1.703	50	20	IDGD	
O=C(NNc1nccc(N2CCOCC2)n1)c1cccc(S(=O)(=O)NC2CCCC2)c1	762855580	HIOWOXCNBKTLDW-UHFFFAOYSA-N	446.533	1.291	50	20	IDGD	
CC(=NNC(=O)C(=O)Nc1ccc(C)c(C)c1)c1c(C)nn(CCS(C)(=O)=O)c1C	763156129	LMNSHKKNBDOOBZ-UHFFFAOYSA-N	433.534	1.640	50	20	IDGD	
CCc1noc(-c2ccc(C)c(NC(=O)C(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)c2)n1	763470191	HUCJDGIUVDYHQM-UHFFFAOYSA-N	438.400	1.915	50	20	IDGD	
O=C(NNC(=O)c1ccccc1F)C(=O)Nc1ccc(S(=O)(=O)N2CCCC2)cc1	763560886	CYFZBOWGMHHSGY-UHFFFAOYSA-N	434.449	1.010	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2ccccc2F)cccc1C(=O)N1CCOCC1	763561422	KLKGTCPDGQMKTD-UHFFFAOYSA-N	428.420	1.006	50	20	IDGD	
CCOC(=O)c1cn(C)nc1NC(=O)C(=O)NNC(=O)COc1ccc(C(C)(C)C)cc1	763595441	OYBCMKFAIBZIPS-UHFFFAOYSA-N	445.476	1.059	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2cccc(C(F)(F)F)c2)cc1	763638604	CPVBWEMYHSLPDG-UHFFFAOYSA-N	439.346	1.657	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2ccc(CCS(C)(=O)=O)cc2)c1	763665289	SGOWWGWMJPPXBZ-UHFFFAOYSA-N	447.513	1.055	50	20	IDGD	
COC(=O)c1cc(F)c(F)cc1NC(=O)C(=O)NNC(=O)COc1ccc(C)c(C)c1	763667135	QKATWEKICOYMHA-UHFFFAOYSA-N	435.383	1.533	50	20	IDGD	
CO[C@H](C)C(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)COc2cc(C)ccc2C)c1	763667493	ALBUARZSZJWIBB-OAHLLOKOSA-N	442.472	1.442	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)cnc1Br	763681589	WEQOBDNCBWKUPO-UHFFFAOYSA-N	432.234	1.189	50	20	IDGD	
Cc1cc(N2CCOCC2)ccc1NC(=O)C(=O)NNC(=O)c1cccc(N(C)C)c1	763755011	ZGYFKAXFWQNDBK-UHFFFAOYSA-N	425.489	1.297	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)C(=O)Nc1ccccc1OCC(F)(F)F	763791939	YYWWZVLBFRGKBI-UHFFFAOYSA-N	449.345	1.676	50	20	IDGD	
COCCOc1cccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)c1	763847697	FJCBAUZVGJCSMS-INIZCTEOSA-N	429.473	1.882	50	20	IDGD	
CC(=O)N1CCc2cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc3ccccc3F)ccc21	763866566	VZNVKWSNAOAUBZ-GFCCVEGCSA-N	428.420	1.288	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3cnn(Cc4ccccn4)c3)cc2C1	763942580	NXZJPSQJNRRLHO-ZDUSSCGKSA-N	438.513	1.912	50	20	IDGD	
Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)C(=O)NNC(=O)c1cccn1C	763994442	XSRBDYUANIAWQC-SFHVURJKSA-N	449.515	1.377	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2O1)C(=O)Nc1ccccc1OCc1cscn1	764154691	SXSXTPZVJHBGRU-GOSISDBHSA-N	438.465	1.812	50	20	IDGD	
CCOC(=O)[C@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)CC2CCCC2)cc1	764189196	YHWJYISUPDVCCZ-ZDUSSCGKSA-N	432.477	1.034	50	20	IDGD	
CS(=O)(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)CCCc2ccccc2)cc1F	764226461	MEZDZENWHAHHDF-UHFFFAOYSA-N	435.477	1.479	50	20	IDGD	
CC(C)Oc1cc(Br)cc(NC(=O)C(=O)NNC(=O)Cc2ccccn2)c1	764268063	YYRIFWDNUDILDE-UHFFFAOYSA-N	435.278	1.960	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)COc2ccccc2O)sc(C)c1CC	764276215	ZWGRRBPKFIFKAJ-UHFFFAOYSA-N	449.485	1.666	50	20	IDGD	
C[C@H]1CCCN(Cc2ccc(NC(=O)C(=O)NNC(=O)COc3ccccc3O)cc2)C1	764279876	GSPLLLBOOUJGSF-INIZCTEOSA-N	440.500	1.789	50	20	IDGD	
O=C(NNC(=O)c1cc2ccccc2o1)C(=O)Nc1ccc(C(=O)N2CCOCC2)cc1	764331631	WJWNFQHNPRJEIO-UHFFFAOYSA-N	436.424	1.305	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)C(=O)Nc1cnn(Cc2ccccc2)c1	764342603	HADUYDYESWWHFH-UHFFFAOYSA-N	429.440	1.517	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)COCc2ccccc2)cccc1N1CCOC1=O	764362648	GQQAKTTZCHZCHL-UHFFFAOYSA-N	426.429	1.254	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)C(=O)Nc1ccc(OC[C@@H]2CCCO2)cc1	764394650	VOXRSDYSOLETPS-INIZCTEOSA-N	445.497	1.828	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CC[C@@H](N2CCN(C)CC2)[C@H](C)C1	764470014	RYYWVQNWXRUGQU-CRAIPNDOSA-N	437.972	1.067	50	20	IDGD	
CN1CCC(NC(=S)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)CC1	764518833	JEOPKXCTICEYFM-UHFFFAOYSA-N	439.029	1.047	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN(C(=O)c2ccc(F)cc2)C1)[C@@H]1COc2ccccc2O1	766000230	JDBANQXTDXIGBY-BEFAXECRSA-N	427.432	1.665	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)[C@@H]1CC(=O)N(c2ccc(Cl)c(F)c2)C1	766432175	VRVDPSHLUURDTO-SNVBAGLBSA-N	438.868	1.471	50	20	IDGD	
COC(=O)[C@@H](NNC(=O)c1ccc(-n2cnnn2)cc1)c1cccc(Br)c1	766723735	DYMYVGRDDCWPSI-HNNXBMFYSA-N	431.250	1.574	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)COCCNC(=O)OC(C)(C)C)n[nH]2)c1	768264799	OEAWWACDRFHZRJ-UHFFFAOYSA-N	431.493	1.996	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2cc(F)cc(Cl)c2O)CC1	769105593	MCKNEOVTYBQZRP-UHFFFAOYSA-N	443.888	1.273	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)c2cccc([C@]3(C)NC(=O)NC3=O)c2)n[nH]1	769279865	FKSUTLDJLPSPEJ-QFIPXVFZSA-N	448.439	1.215	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)NCCCNC(=O)c3cccc(F)c3)nc21	770394673	BYJSFVKQSQRVLR-UHFFFAOYSA-N	444.471	1.872	50	20	IDGD	
O=C(NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1)c1ccc2nc[nH]c2n1	770549971	OVIDYKHGIXAGOH-UHFFFAOYSA-N	442.482	1.895	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)c3ccc(NS(=O)(=O)c4ccccc4)cc3)nc21	770985053	WRCQDQLGXWEQCM-UHFFFAOYSA-N	439.457	1.627	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCc1ccc(C(C)(C)O)cc1	773133230	WOSPEFTUGOSDNK-UHFFFAOYSA-N	433.534	1.660	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)C(=O)Nc2cccc(CS(=O)(=O)NC(C)(C)C)c2)n1	773482191	WZOISQKRTOSZLV-UHFFFAOYSA-N	434.522	1.393	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NC[C@H]2CC[C@@H](C(=O)N(C)C)O2)cc1Br	774715436	FQKRDRLJZBNVEM-RISCZKNCSA-N	443.298	1.038	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(C(=O)NNc2cccc(S(C)(=O)=O)c2)cc1	776538464	UIWNTUJKMIYTSE-UHFFFAOYSA-N	425.532	1.878	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)nn1-c1ccc(F)cc1	777274817	JZTIFAADGDZYAB-UHFFFAOYSA-N	445.476	1.645	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@H](C(=O)NNC(=O)c2cccc3ccccc23)[C@@H](C)O)cc1	779519958	NIGLIVMJHZELIH-QRWLVFNGSA-N	441.509	1.637	50	20	IDGD	
CC(C)(C)C(=O)NNC(=O)CN1CCN([C@H](C#N)c2ccc(Br)cc2)CC1	779598318	YTCOEWBZSARAAH-MRXNPFEDSA-N	436.354	1.825	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNS(=O)(=O)c1cc(C(=O)O)c(F)c(Cl)c1F	779845201	UHRUOIIOVMHNFK-UHFFFAOYSA-N	443.812	1.151	50	20	IDGD	
COc1cccc(NNC(=O)[C@@H](CCSC)NS(=O)(=O)c2ccccc2F)n1	780771873	GMRQDQVPNKRGMX-CYBMUJFWSA-N	428.511	1.773	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(NC(=O)C(=O)NNc2ncncc2Cl)ccc1C	782159205	OXMACQGIXUNFBZ-UHFFFAOYSA-N	440.913	1.551	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN[C@@H](CN1CCOCC1)c1ccccc1	782467861	HNDRKQUHHPXMJE-IBGZPJMESA-N	446.935	1.773	50	20	IDGD	
O=C(NNc1nc2ccccc2s1)C(=O)Nc1cccc(N2CCS(=O)(=O)CC2)c1	782811855	AAUWVLHCAOZXIS-UHFFFAOYSA-N	445.526	1.613	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2ccc(Cl)c(S(=O)(=O)N(C)C)c2)cc1	783021545	FZQOXRLJTWUKQL-UHFFFAOYSA-N	426.882	1.681	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NN(C)c2ccccc2)cc1S(=O)(=O)N1CCCCC1	783431977	MGSCEGFYOZMEED-UHFFFAOYSA-N	446.529	1.976	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(N(C)C)c(NC(=O)C(=O)NN(C)c2ccccc2)c1	783434634	SPTYDLQNYUYZRK-UHFFFAOYSA-N	447.561	1.889	50	20	IDGD	
CCNC(=O)c1cccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)c1	784835374	MKIDDMMRTTUAJE-UHFFFAOYSA-N	440.428	1.514	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2cccc(N3CCCNC3=O)c2)n1	785230700	CRPVCTDARGYCGB-UHFFFAOYSA-N	426.481	1.324	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)[C@H](CC(N)=O)NC(=O)c2ccccc2Cl)c1	786085725	JTDGDRCGKDPJKO-KRWDZBQOSA-N	446.891	1.157	50	20	IDGD	
CCNC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)COc2ccccc2OC)c1C	789732688	SYEQMMACNJMRQW-UHFFFAOYSA-N	443.460	1.310	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2nc3c(s2)CCCC3)cc1	789740796	IBOYYLVSLQPSTG-LBPRGKRZSA-N	432.502	1.974	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(\C#N)C(=O)N2CCN([C@@H]3CCS(=O)(=O)C3)CC2)c1C	790252235	LOXGHRHEZUNUNY-HAUBNOCLSA-N	448.589	1.551	50	20	IDGD	
COc1cccc(NNC(=O)NCC(=O)Nc2ccc(I)cc2)n1	790893156	XCGCYAQWCKIUSL-UHFFFAOYSA-N	441.229	1.960	50	20	IDGD	
O=C(NNc1nc2ccccn2n1)[C@H]1CC[C@H](C(=O)NNc2nc3ccccn3n2)CC1	791261392	FXHORIGKFHWRKC-HDJSIYSDSA-N	434.464	1.165	50	20	IDGD	
CC(C)(C)OC(=O)CCc1cccc(NC(=O)C(=O)NNC(=O)Cc2ccncc2)c1	792356727	SMAUSSIRJXWGAZ-UHFFFAOYSA-N	426.473	1.685	50	20	IDGD	
Cc1nc2c(C(=O)NNc3ncccc3S(=O)(=O)N3CCN(C)CC3)cccc2o1	792639526	PYTSLZJSSMKYQH-UHFFFAOYSA-N	430.490	1.224	50	20	IDGD	
Cc1cc(F)c(C(=O)O)cc1S(=O)(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	793414767	FCERCSDGZCCTSS-UHFFFAOYSA-N	443.840	1.112	50	20	IDGD	
Cn1nc(SCC(=O)NN=CCCc2ccc(-c3ccccc3)cc2)c(=O)n(C)c1=O	794886468	KRKYLWSLZZAOEG-UHFFFAOYSA-N	437.525	1.973	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccccc2CN2C[C@H](C)O[C@H](C)C2)n1	797369722	GFCMOTMBCBTNTJ-IYBDPMFKSA-N	425.489	1.399	50	20	IDGD	
Cn1c(=O)n(C)c2cc(N3CCCCC3)c(NC(=O)C(=O)NNc3cccc(C#N)c3)cc21	800625822	CIPSMSKUUUAGHE-UHFFFAOYSA-N	447.499	1.821	50	20	IDGD	
CSCC[C@H](NC(=O)Cc1ccccc1)C(=O)NNC(=O)C(=O)Nc1ccc(C)cc1	801105826	LBGRRFJKCJUYDP-SFHVURJKSA-N	442.541	1.562	50	20	IDGD	
CS(=O)(=O)Nc1ccc(F)cc1C(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	802063384	AVWPTACZXFYQKL-UHFFFAOYSA-N	444.466	1.067	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1cnn(C)c1-c1ccccc1	806975090	NEZKIFSDJKISKW-CYBMUJFWSA-N	425.420	1.780	50	20	IDGD	
C[C@@H](Oc1ccccc1NC(=O)C(=O)NNC(=O)Cc1cn2ccccc2n1)C(F)(F)F	807020180	RQDXPFVFJSUDOI-GFCCVEGCSA-N	449.389	1.993	50	20	IDGD	
COc1cc(NC(C)=O)c(Cl)cc1S(=O)(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	808066075	QVFFTQQCHNTFCZ-UHFFFAOYSA-N	442.837	1.839	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(C)n(-c3ccc(F)cc3F)n2)c(O)c1	808934749	TYHGBEMSJBNETK-UHFFFAOYSA-N	429.383	1.873	50	20	IDGD	
Cc1c(Cl)c(C(F)(F)F)nn1CC(=O)NNC(=O)CCNC(=O)OC(C)(C)C	810969899	BCBXLSKWILZEQL-UHFFFAOYSA-N	427.811	1.926	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNS(=O)(=O)c2cccc(CC(=O)OC)c2)cc1	811677842	LJQKJYGJSDWJQI-CQSZACIVSA-N	436.486	1.578	50	20	IDGD	
C[C@H]1C[C@H](NC(=O)NNC(=O)Cc2nc3ccccc3n2C)c2ccsc2S1(=O)=O	812658999	RBUDESBPTJGKNN-FZMZJTMJSA-N	447.542	1.815	50	20	IDGD	
CCC(=NNC(=O)c1nn(C)c(=O)c2ccccc12)c1ccccc1OCC(=O)N(C)C	814740713	UJUGJENATMKBNW-UHFFFAOYSA-N	435.484	1.945	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)Cc2cccnc2)cc1S(=O)(=O)C1CCCC1	815568964	AIZAVURKLMJLPS-UHFFFAOYSA-N	444.513	1.435	50	20	IDGD	
C[C@@H]1Cc2ccccc2N1C(=O)[C@@H]1CCCC[C@@H]1C(=O)NNC(=O)N1CCN(C)CC1	819721449	TXINQOMXOSXXOX-NZSAHSFTSA-N	427.549	1.759	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)CCOCC(F)(F)F)c1	914456844	CUYXAORLCJKUGJ-UHFFFAOYSA-N	425.429	1.447	50	20	IDGD	
COc1ccc([C@H](CNC(=O)NNC(=O)COc2ccc(F)cc2)N(C)C)cc1OC	915898180	UPTOJIDCNKBLHH-KRWDZBQOSA-N	434.468	1.855	50	20	IDGD	
COC(=O)c1ccc(C=NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1	916258600	HBZBVSCVFFJYNN-UHFFFAOYSA-N	431.470	1.258	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NN=C(C)c2cccc(-n3cnnn3)c2)c1	916261600	PRNOPQKXIHFONZ-UHFFFAOYSA-N	441.517	1.847	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)NCC[C@](O)(c2nccn2C)C(F)(F)F)c1	916377134	ABIGQWPBLYNIRD-SFHVURJKSA-N	443.426	1.586	50	20	IDGD	
CCCS(=O)(=O)N1CCC(NC(=O)NNC(=O)c2cc(C)nc3ccccc23)CC1	916383730	PRNGNSYKSAVFSS-UHFFFAOYSA-N	433.534	1.691	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)c1ccc(NC(=O)C2CC2)cc1	916497649	QKBOHRQEAPEKIR-CYBMUJFWSA-N	448.483	1.987	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCc1nnc2n1CCCC2	916648304	SAKMJQNKPSZBLN-LLVKDONJSA-N	437.298	1.675	50	20	IDGD	
Cc1nc2c(C(N)=O)cnn2c(C)c1CCC(=O)NNC(=O)[C@H](C)Oc1ccc(F)cc1	916734720	NLQAHSKEBXMNTN-ZDUSSCGKSA-N	442.451	1.132	50	20	IDGD	
O=C(CNC(=O)NCc1ccco1)NNC(=O)COc1ccc(Br)cc1	917907666	HSLDRVFMXKYEGX-UHFFFAOYSA-N	425.239	1.068	50	20	IDGD	
COc1ccc(Br)c2[nH]c(C(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)cc12	918208157	BLDHJDXIWBGPJA-QMMMGPOBSA-N	430.280	1.135	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NN=Cc1cn2ccccc2n1	918708045	HKVVCCXGMOPBTK-UHFFFAOYSA-N	441.513	1.438	50	20	IDGD	
Cc1ccc(C(=O)c2ccccc2C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)cc1C	919889999	YELBOFLSYGTPMO-INIZCTEOSA-N	429.498	1.666	50	20	IDGD	
N#C/C(=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)NCCn1ccnc1	920853792	HEYIBAKEDPMEAS-LFIBNONCSA-N	437.891	1.999	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)NC[C@H](c2cccc(F)c2)N2CCOCC2)cc1	921247282	CUJVVJHHWYECKO-HXUWFJFHSA-N	441.463	1.480	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Cn2nc3n(c2=O)CCCCC3)ccc1OCCC(C)C	1321556635	JXRGZAMMWLMMST-UHFFFAOYSA-N	445.520	1.666	50	20	IDGD	
CN(C)C(=O)[C@@H]1CCC[C@@H](NC(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)C1	1339221082	OTOMEKGYMHHCLE-HZPDHXFCSA-N	439.557	1.611	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(C(=O)NNc2cncc(Br)c2)cc1	1341214971	PESCKLKSINHHNJ-UHFFFAOYSA-N	429.296	1.526	50	20	IDGD	
COc1ccc([C@@H](O)C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](F)Cl)C2)cc1	1778022654	NOGDLTQGMBCXTA-PDOICOKGSA-N	428.888	1.777	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cn4ccsc4n3)C2)C1	1778632144	UPHUKVGJFJHLDM-BZNIZROVSA-N	427.324	1.623	50	20	IDGD	
CN1CCCC[C@@H]1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Br)C2	1780593401	QWHILTAHSBDXRH-ATNYBXOESA-N	434.350	1.675	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc[n+]([O-])c1)C2)[C@@H](F)Br	1780771045	RIBCKGMYJQVMEW-CKEIUWERSA-N	430.274	1.138	50	20	IDGD	
COc1ccnc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](F)Br)C2)c1	1780774966	RFVDQFGFBWKKBR-RVKKMQEKSA-N	444.301	1.908	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](Cl)COC)C2	1781904684	AAHFJVKLNGKTEU-ZOMKSWQUSA-N	439.778	1.928	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)Cc3ccc(F)cn3)CCO2)C1	1783343249	RKZFZSYILYEJMQ-YJBOKZPZSA-N	428.302	1.767	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cc(C(C)=O)[nH]n3)CCO2)C1	1783343443	IYTXZRSGTHVFSR-YVEFUNNKSA-N	427.299	1.229	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnn(C)c3Cl)C[C@@H]21	1783969110	DLWXVXWJKBVXMJ-IMIFBBOLSA-N	447.761	1.698	50	20	IDGD	
Cc1cc(C)n(CCC(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)n1	1784321799	SRUPMENNKBTWMU-NVXWUHKLSA-N	431.306	1.410	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)cc1	1785107895	RYHLBHBUCCRJHY-ORAYPTAESA-N	438.322	1.872	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(CCN(C(=O)COc3ccccc3C#N)C2)C1	1785380829	ZFVWFTAWDUPMPA-NRFANRHFSA-N	431.565	1.618	50	20	IDGD	
CCn1nc(C)cc1C(=O)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1	1788140779	WAIACGMXMKLQQS-UHFFFAOYSA-N	446.316	1.953	50	20	IDGD	
Cn1cc(F)cc1C(=O)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1	1788141426	ZQEFABHPHBEMPU-UHFFFAOYSA-N	435.264	1.906	50	20	IDGD	
C[C@@H](Nc1cnccn1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]21	1788629751	XBMMCYLCEBJPFR-QWHKOUAISA-N	444.363	1.493	50	20	IDGD	
O=C(CS(=O)(=O)N1CCCC1)Nc1ccc(C2(NC(=O)[C@H](O)CCl)CCC2)cc1	1788641531	ZNJVYGZJQWCHKK-MRXNPFEDSA-N	443.953	1.146	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21)c1cccc(-n2cncn2)c1	1790249063	STUPQSRDHASQSU-BPUTZDHNSA-N	438.315	1.664	50	20	IDGD	
CC(C)N[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)Br)[C@H]2C1)C(C)C	1791058105	POVSJKRNSLOZNC-QUSNUVHPSA-N	432.403	1.772	50	20	IDGD	
Cc1ccc(F)c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]3C2)c1	1791293789	JPSIRIXMXCWAEA-IEZWGBDMSA-N	434.512	1.100	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1ccc(C2(NC(=O)c3cn4ncccc4n3)CCC2)cc1	1791601733	SXKKVHMMPOVVHM-UHFFFAOYSA-N	449.515	1.850	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(F)c(C(F)(F)F)c1)C2)[C@H](O)CCl	1792983595	QGRICTLZZLUPCH-BAESOJJISA-N	438.805	1.647	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Cl)C3)C[C@H]2C[C@H]21	1792996535	FAJFJHNLERGVGG-GIAZKGQJSA-N	445.919	1.508	50	20	IDGD	
CCC[C@H](NC(=O)c1ccccc1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](O)CCl)C2	1793217002	KRSGJYILRBCCCS-XCDZQEORSA-N	435.952	1.823	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1COc2ccccc2O1	1793842333	IMDASVNUHMDIOC-RSSYPWKWSA-N	443.327	1.652	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1[nH]nc2ccncc12	1796213244	SJRFYDQPWXFITM-WZTYKQCMSA-N	426.304	1.397	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nn(-c3ccccc3)c3c1COC3)C2)[C@H](F)Cl	1796362737	CQVVICAUFRXBTO-JBYDNAENSA-N	448.882	1.640	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)COc1cc(Cl)ccn1	1797907341	DSCBXOIRSYKDOJ-LSSIXWDNSA-N	446.729	1.487	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c(c1)n(C)c(=O)n3C)C2	1799267551	BENIONLJPUBSIO-BASYENTBSA-N	434.924	1.098	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ncc(Cl)cn1)C2	1800639437	WJOOAUIAYAIEHG-LFSVMHDDSA-N	431.718	1.507	50	20	IDGD	
CC(C)(C)OC(=O)NC1(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C(Cl)Cl)CC1	1801019919	YQZIKXMKFKEGFV-ZSBIGDGJSA-N	436.336	1.437	50	20	IDGD	
C[C@H](Sc1ccccn1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Br)C2	1801321997	IMMFFEAHSUPFSB-YMSVYLFOSA-N	442.379	1.935	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)C2(Br)CC2)[C@H]1c1cccnc1)[C@H](O)CCl	1803141286	NYDXMTKIFTXPRX-MJBXVCDLSA-N	430.730	1.615	50	20	IDGD	
CSCC(C)(C)C(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1803631086	JXNIDLLDQFNXHR-YLJYHZDGSA-N	449.621	1.850	50	20	IDGD	
O=C(CCBr)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)CSC1=S	1804331606	IGEHUQMNCTUARW-JGPRNRPPSA-N	434.381	1.270	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC2(CCN(C(=O)[C@@H]3CCC(=O)N3C)CC2)C1	1805387498	ORQOOHBVGANHFM-GJZGRUSLSA-N	428.371	1.869	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1CCN(C(=O)Cn2nccn2)[C@H]1c1cccnc1	1808305973	XXAOUFSXVKRMBE-ZVZYQTTQSA-N	425.320	1.615	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)c2cc[nH]n2)[C@@H]1c1cccnc1	1808407781	DQEJDDBRWKJTID-CPJWQURSSA-N	448.487	1.258	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2ccc3nncn3c2)[C@H]1c1cccnc1	1809910288	GZULGIMGMVTEBK-VDZJLULYSA-N	442.907	1.698	50	20	IDGD	
Cc1nnc(CC(=O)N2CC[C@H](CNC(=O)CO[Si](C)(C)C)[C@@H]2c2cccnc2)o1	1810541643	LIWLTALTVFVCFI-UZLBHIALSA-N	431.569	1.873	50	20	IDGD	
CC(C)(C)n1cc(C(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@H]2c2cccnc2)nn1	1811549016	OSBOTOVEQJKYQJ-UAGQMJEPSA-N	434.928	1.347	50	20	IDGD	
Cc1nocc1C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1813070580	JONPGKLBCYOIPW-UZLBHIALSA-N	428.493	1.071	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)CCc2ccc[nH]2)[C@H]1c1cccnc1	1813071140	NUMWFMAUWNJGOM-JPYJTQIMSA-N	440.548	1.421	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)CN3CCOCC3)sc2C1	1814572673	VMORZOSNDULJFK-MNOVXSKESA-N	431.356	1.171	50	20	IDGD	
CN(CC(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](O)CCl)n[nH]1)C(=O)c1ccccc1	1814865004	VKEOMYASIRQVBN-IRXDYDNUSA-N	447.923	1.774	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)c3[nH]nnc3C)sc2C1	1815944078	MLEAAFZBZUKMLD-RKDXNWHRSA-N	427.328	1.969	50	20	IDGD	
O=C(CCN1CCOCC1)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](F)Br)[nH]n1	1817181125	MALRQBIIMZXTSQ-CZUORRHYSA-N	446.321	1.815	50	20	IDGD	
Cc1cc(NC(=O)CC(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@@H](F)Cl)CC3)no1	1817240319	IGBIHELQUZDAMJ-RMLUDKJBSA-N	429.861	1.915	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)CCc2ccc[nH]2)[nH]n1)c1ccc(B(O)O)cc1	1817470934	AHSIJNQUCVBBGD-IBGZPJMESA-N	435.293	1.356	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnc[nH]2)[nH]n1	1818111305	BRXVNWZFPWFCRS-KWJLSGNOSA-N	437.464	1.573	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)CCN2C(=O)C=CC2=O)[nH]n1)C(Cl)Cl	1822418967	JPMGSSJXLSPHGK-NSHDSACASA-N	428.276	1.521	50	20	IDGD	
Cc1ccc(CC(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)o1	1822903513	IYUGZOVOAHZJON-IBGZPJMESA-N	436.277	1.540	50	20	IDGD	
O=C(Cc1ncccn1)N[C@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1	1823001688	JDEVLVMBRHOZKO-SDBXPKJASA-N	428.287	1.778	50	20	IDGD	
Cc1ncoc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1	1826064572	VSDFNWNEIQFFRI-GOSISDBHSA-N	440.504	1.529	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cncs2)CC1	1826133203	CCFFISBVTQWKLP-QGZVFWFLSA-N	442.545	1.689	50	20	IDGD	
C=CCO[C@@H](C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827056081	RVHHASIFDVOLFZ-UWJYYQICSA-N	428.338	1.191	50	20	IDGD	
Cc1ccncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827059465	QZFQWDYGUWGYPR-JOCHJYFZSA-N	435.333	1.617	50	20	IDGD	
CCOCCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1)CC2	1827131799	PFPGIIDYBKBTPW-CJCQAYSXSA-N	446.533	1.616	50	20	IDGD	
C[C@H]1CC[C@H](C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2ccc(B(O)O)cc2)CC3)CC1	1827153314	KMUQKWYEGGMKAT-CKEIUWERSA-N	441.362	1.875	50	20	IDGD	
CCc1cc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)n[nH]1	1827294142	WAMKNJVPHBLUCG-LJQANCHMSA-N	432.569	1.578	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)n2)CC1	1827602119	BQPCNFCMBRBTQR-FZMZJTMJSA-N	441.326	1.905	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCCC[C@H]1C1CCN(C(=O)CCS(C)(=O)=O)CC1	1829103694	LLSQZORUKDPDNC-KRWDZBQOSA-N	432.659	1.892	50	20	IDGD	
Cn1c(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)cc2ccccc21	1830433279	MGAIGLORHXDGCG-FPOVZHCZSA-N	437.899	1.712	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3c(C)noc3C)C2)C1	1831640615	OKCRLBRUWOHPKP-PXNSSMCTSA-N	427.929	1.698	50	20	IDGD	
COc1ccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)c(Cl)c1	1832537310	AGUFAHJNIOSIEZ-PKOBYXMFSA-N	449.306	1.882	50	20	IDGD	
C/C=C/C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2	1832551328	JLPFVZSSVZUNDU-KJDRQLFNSA-N	445.944	1.151	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3ccco3)CCO2)C1	1833052755	WRXAHPXAMIZSQX-QFBILLFUSA-N	443.338	1.842	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)[C@@H]3CCCCO3)CC2)CC1	1833113622	ONVYSQCZGRTETN-YOEHRIQHSA-N	430.387	1.911	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ncc(OC)cc3F)CCO2)C1	1833634774	ZVTQGWOHEWLMBZ-AUUYWEPGSA-N	429.876	1.317	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)CBr)C3)C2)nc1	1834371731	QCANXNPEHMPNQP-DNVCBOLYSA-N	440.338	1.491	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](NC(C)C)C(C)C)CC2)CC1	1834787863	OPUVQOVIEYTTPC-UXHICEINSA-N	445.048	1.834	50	20	IDGD	
Cc1ccc(C(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)cc1	1834798389	OTXBKFBDNSSSML-UHFFFAOYSA-N	449.360	1.174	50	20	IDGD	
Cc1nccc(C(=O)NC2CCN(C3CCN(C(=O)CCBr)CC3)CC2)n1	1835217386	JEZDYTNRDKRJQP-UHFFFAOYSA-N	438.370	1.755	50	20	IDGD	
Cc1cc(CC(=O)NC2CCN(C3CCN(C(=O)[C@@H](F)Br)CC3)CC2)n[nH]1	1835788806	RBVBAEMZKFSLID-QGZVFWFLSA-N	444.349	1.523	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC1CCN(C2CCN(C(=O)c3ccnnc3O)CC2)CC1	1835836026	BNSPNWVRKLISOA-UHFFFAOYSA-N	435.601	1.219	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cc(OC)ccn3)CC2)CC1	1835924423	ZTQBDMYMDWUZMJ-SFHVURJKSA-N	438.956	1.529	50	20	IDGD	
Cc1cccc(CC(=O)N2CCOC[C@@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)c1	1837712517	WYTYZGIFNZKKPO-QFIPXVFZSA-N	434.609	1.845	50	20	IDGD	
NC(=O)c1ccc(C(=O)N2CCC(OC3CCN(C(=O)[C@@H](F)Cl)CC3)CC2)cc1	1838086334	ZSEFHKUBXRDFTG-QGZVFWFLSA-N	425.888	1.932	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)C3CC(F)(F)C3)C2)C1	1839150017	YDBOSFQUZAXCQC-CVEARBPZSA-N	429.291	1.724	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(C#N)c3)C2)C1	1839154699	UPOAAUWLNJLRBX-UXHICEINSA-N	440.327	1.865	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4ccoc4s3)C2)C1	1840151658	JRWZEANBDOUHMV-IFXJQAMLSA-N	442.921	1.818	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4c(c3)COC4)C2)C1	1840152614	NJSNZAWHESIELS-NQIIRXRSSA-N	438.908	1.041	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)C3CCC(O)CC3)CCO2)C1	1840272112	GWKWGZUMURFQSP-GKSFYBEXSA-N	447.370	1.025	50	20	IDGD	
C[C@@H](Cc1ccccn1)C(=O)N1CCO[C@@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1	1840334372	SRQCMTYBLPMOGD-PGRDOPGGSA-N	449.624	1.568	50	20	IDGD	
C[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1)c1ccccn1	1840503523	CSJKTRCUKREIQC-DHSIGJKJSA-N	444.301	1.332	50	20	IDGD	
COc1ccc(/C=C/C(=O)N2CC3(CCCN3C(=O)[C@@H](O)CCl)C2)c(OC)c1OC	1841347634	AKZQTBMMAPPUBI-VFADXPBXSA-N	438.908	1.529	50	20	IDGD	
Cn1ncc(C(=O)N2CCCC23CN(C(=O)[C@@H](F)Br)C3)c1C(F)(F)F	1842162190	ZZKBJRCGGONBJU-SNVBAGLBSA-N	427.196	1.946	50	20	IDGD	
CS(=O)(=O)CC(=O)N1CCCC12CN(C(=O)[C@H](Br)Cc1ccccc1)C2	1842780119	BLBJOQFBQWKLPD-OAHLLOKOSA-N	443.363	1.241	50	20	IDGD	
O=C(c1ccc2nc(Br)nn2c1)N1CC2(CCCN2C(=O)[C@@H](F)Cl)C1	1843363400	BQQVGNSTTMEKOG-LLVKDONJSA-N	430.665	1.843	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)c2ccc(OC)c(Br)n2)C1	1844613752	LWYKXRXJRKRDEG-LLVKDONJSA-N	446.729	1.924	50	20	IDGD	
CC(C)[C@H]1CC[C@H](C(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)CC1	1846079454	XGNCUGDFFNLPSJ-QAQDUYKDSA-N	427.549	1.965	50	20	IDGD	
CC[C@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)[C@H](O)CCl)C2	1847085568	IGQAZCQGYDZJTA-ZNMIVQPWSA-N	431.961	1.729	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)c1ccc(Cn2cccn2)cc1	10642326	LDCHGUDVHNHXJY-UHFFFAOYSA-N	432.528	1.905	50	20	IDGD	
COc1cc(C(=O)NNC(=O)COc2ccc(C)c(C)c2)cc(Cl)c1OCC(N)=O	14318299	HMFNTBFNSNRXDP-UHFFFAOYSA-N	435.864	1.670	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)Cn1c(=O)n(C)c2ccccc21	14372625	HLKUIKHWXVZPPC-GFCCVEGCSA-N	447.289	1.717	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2COc3ccc(Cl)cc3C2)c1	16594215	ZQJJBYUBNJPVDB-AWEZNQCLSA-N	437.905	1.603	50	20	IDGD	
C[C@@H]1CN(c2ccc(CNC(=O)NNC(=O)CNC(=O)c3ccco3)cc2F)C[C@@H](C)O1	725871658	PCUVUDLOPJHPON-ZIAGYGMSSA-N	447.467	1.293	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=S)NCCc2ccccn2)c1	726120475	OBDFXQPOVKPRIP-UHFFFAOYSA-N	435.575	1.464	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)c1ccn(-c2cccc([N+](=O)[O-])c2)n1	726863284	MDWYDGCSIGARTP-UHFFFAOYSA-N	442.457	1.978	50	20	IDGD	
CC(C)[C@@H](C(=O)NNC(=O)CNC(=O)c1cccs1)S(=O)(=O)C1CCCCC1	728474288	YCBSIVUKXDOLCX-INIZCTEOSA-N	429.564	1.397	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)NCC(=O)N2CCN(c3ccc(Cl)cc3)CC2)c1	729049353	NAUVZODVXAPJAP-UHFFFAOYSA-N	440.891	1.504	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)Cc2c(C)nc3cc(O)nn3c2C)c2ccccc2c1=O	729258418	UMXUPHCIMYFCKP-UHFFFAOYSA-N	449.471	1.175	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)[C@@H](c1ccccc1)N1CCC(O)CC1	729531637	LQHJOEGAGKXIGI-OAQYLSRUSA-N	444.557	1.768	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)c1cnn(-c2cccc(Br)c2)c1	730178415	GRCLHXOOHQJBHP-UHFFFAOYSA-N	448.302	1.887	50	20	IDGD	
CCOc1ccc(Br)cc1S(=O)(=O)NNC(=O)COc1ccccc1O	730813229	AZXMQNYCCCIVHU-UHFFFAOYSA-N	445.291	1.942	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)nnn1-c1cccc2ncccc12	731343966	YJQFTRYGTCJYIS-UHFFFAOYSA-N	440.427	1.174	50	20	IDGD	
CCc1nc([C@H](C)NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cs1	732474241	KGAZNJANODSKNG-NSHDSACASA-N	425.536	1.661	50	20	IDGD	
C[C@@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)NNC(=O)NCc2ccc(Cl)cc2)C1=O	733003540	BQFQLBVPWSHVAW-FQEVSTJZSA-N	447.854	1.777	50	20	IDGD	
CCOCCCn1c(NNC(=O)c2cnc3n(c2=O)CCS3)nc2ccccc2c1=O	733268449	LVGMNOPOTFDWLY-UHFFFAOYSA-N	442.501	1.242	50	20	IDGD	
O=C(NNc1cnccn1)c1cc(S(=O)(=O)N2CCOCC2)c(Cl)cc1Cl	734245028	GNTFHCCHGCTPRF-UHFFFAOYSA-N	432.289	1.561	50	20	IDGD	
COc1ccc(S(=O)(=O)C[C@H](C)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)cc1	734990853	BXMJDGZGTCIXCS-KBPBESRZSA-N	438.477	1.859	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)NCCNc2nccc(C(F)(F)F)n2)nc2ccccc21	739045046	FPEVSHPYCVHNCY-UHFFFAOYSA-N	436.398	1.367	50	20	IDGD	
C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	740903080	JMAHZLASBYTCTJ-KRWDZBQOSA-N	434.504	1.613	50	20	IDGD	
CC(C)[C@H](C(=O)OCC(=O)NNC(=O)c1cccc(Cl)c1)N1C[C@H](C)O[C@H](C)C1	741019276	DTOUGWZVOINLDF-QWQRMKEZSA-N	425.913	1.778	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@@H](NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)C1CC1	741272584	CLFJZRMERYTZQS-MRXNPFEDSA-N	447.540	1.327	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H](c2ccccc2F)N2CCOCC2)c1	742535096	NIFJRRDOZQOYGX-GOSISDBHSA-N	435.477	1.064	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)[C@@H](Cc1ccccc1)NC(=O)c1cccnc1	742814836	FHJKCIWDVYMSPF-HXUWFJFHSA-N	432.480	1.821	50	20	IDGD	
O=C(CCn1c(=O)nc(O)c2ccccc21)NNC(=O)c1cc(Br)ccc1O	743732124	LOILDCFBLCWISG-UHFFFAOYSA-N	447.245	1.422	50	20	IDGD	
Cc1nc(SCC(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)c(C#N)c(C)c1C	744578297	YBNANZSECFSRMW-UHFFFAOYSA-N	437.481	1.847	50	20	IDGD	
C[C@H]1CN(c2ccc(CNC(=O)NNC(=O)c3cc([N+](=O)[O-])ccc3O)cn2)C[C@@H](C)O1	745469142	TWQVXTSNBMMNCF-BETUJISGSA-N	444.448	1.453	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(Br)cc1Br)N1CCOCC1	745833666	BAWYYHZYJFSHTH-UHFFFAOYSA-N	443.117	1.447	50	20	IDGD	
CCC(=O)N1CC[C@@H](C(=O)NNc2nc3ccccc3c(=O)n2CCCOC(C)C)C1	746177089	AUFPXAIKCVVGNT-MRXNPFEDSA-N	429.521	1.913	50	20	IDGD	
C[C@H](C(=O)NNc1nc(-c2ccc(Cl)cc2)no1)N1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O	746256380	PFBBBTWTGCYIJI-OJGWYHNPSA-N	431.836	1.384	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)c2ccc3c(c2)CCCN3S(C)(=O)=O)o1	746393011	UULZVYCIBNNHRM-UHFFFAOYSA-N	448.545	1.908	50	20	IDGD	
CC(C)C[C@H](C(=O)NNC(=O)Cc1cn2ccccc2n1)N1C(=O)[C@H]2CC=CC[C@H]2C1=O	746553086	GBHMVCXDHSFTIU-FGTMMUONSA-N	437.500	1.390	50	20	IDGD	
C[C@@H](NC(=O)OC(C)(C)C)C(Cc1ccccc1)=NNC(=O)N[C@H]1CCS(=O)(=O)C1	746563997	FPNZWURYYUSVNI-ZBFHGGJFSA-N	438.550	1.985	50	20	IDGD	
C=CCOc1cn(-c2ccccc2)nc1C(=O)NNC(=O)CNC(=O)c1cccs1	746593602	SBZZWHYKPHCNMS-UHFFFAOYSA-N	425.470	1.690	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNS(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F	746598017	CMGFVUGUIJYALA-UHFFFAOYSA-N	426.373	1.228	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)N2CCC[C@@H]2C(=O)NNc2cccc(C#N)c2)o1	748031570	WMDMJYGUJDIHGU-OAHLLOKOSA-N	432.458	1.624	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCCNC(=O)Cc2cccc(F)c2)cc(OC)c1OC	748824179	HHTSSQOZZCOGJC-UHFFFAOYSA-N	448.451	1.154	50	20	IDGD	
O=C(NNc1nccc(N2CCOCC2)n1)c1cccc(F)c1I	750537436	VNTFWZWIMDQMMS-UHFFFAOYSA-N	443.220	1.814	50	20	IDGD	
CCOC(=O)[C@H]1Cc2cc(S(=O)(=O)NNC(=O)c3cc4ccccc4o3)ccc2O1	751548283	JUWKBISTQYQFPP-GOSISDBHSA-N	430.438	1.923	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN(Cc2ccccc2)C[C@H](O)c2ccco2)n1	752352569	APLNVNPOYBOUPX-KRWDZBQOSA-N	428.514	1.970	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)NC[C@@H]2CCN(S(C)(=O)=O)C2)c1	753669779	KHWSDKRCPHAITI-HNNXBMFYSA-N	426.539	1.109	50	20	IDGD	
COc1cc(OC)cc(OCCCNC(=O)NNC(=O)Cc2cn3ccccc3n2)c1	753926710	YQKMGTUIJQDVLM-UHFFFAOYSA-N	427.461	1.694	50	20	IDGD	
Cc1nc(N2CCOCC2)nc(O)c1CCC(=O)NNc1ccc(-c2ccccc2)nn1	754467123	DUFFIGDVFUBRTM-UHFFFAOYSA-N	435.488	1.860	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)c1cccc(I)c1O	754833644	IJOIDVCNIAZOTD-ZDUSSCGKSA-N	440.193	1.598	50	20	IDGD	
COc1ccc([C@@]2(C)NC(=O)N(CC(=O)NNc3ccc(C(F)(F)F)nn3)C2=O)cc1	755197316	IAEJNBYKBSQWEI-QGZVFWFLSA-N	438.366	1.414	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)c(Br)n1	755409013	FADDEBPQEVISGI-UHFFFAOYSA-N	447.698	1.528	50	20	IDGD	
Cc1c(NC(=O)NNC(=O)COc2ccc(Br)cc2)cccc1-n1cnnn1	755445190	WZXKARLXKFTWSV-UHFFFAOYSA-N	446.265	1.965	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2cccnc2-n2cncn2)cc1Br	756293254	YSUURNWLOXLBIO-UHFFFAOYSA-N	432.238	1.900	50	20	IDGD	
CN(C1CC1)S(=O)(=O)c1ccc(NC(=O)NNC(=O)COc2ccccc2C#N)cc1	756400791	FFWHAVKMNXEFSI-UHFFFAOYSA-N	443.485	1.573	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)Nc1cccc(C[S@](=O)c2ccccc2)c1	756590733	PMAFQHNVPAMNDB-HBIPHATFSA-N	435.527	1.582	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)NCC2CCS(=O)(=O)CC2)c1	756752626	FACPACKFYUORFP-UHFFFAOYSA-N	434.312	1.227	50	20	IDGD	
CC(=O)N1CC[C@@H](NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c2ccccc21	757021571	ARBFCQLREAVNAB-GOSISDBHSA-N	437.504	1.521	50	20	IDGD	
CC[C@@H]1CN(CC(=O)NNC(=O)Cc2nc(C)cs2)CC[C@H]1NC(=O)OC(C)(C)C	757110296	MJTVAMOIWRYPDG-HUUCEWRRSA-N	439.582	1.767	50	20	IDGD	
CN(C)C(=O)CNC(=O)c1ccc(NC(=O)NNC(=O)c2cccc(C#N)c2)cc1Cl	757724352	DGXMQCWKYKCVHO-UHFFFAOYSA-N	442.863	1.496	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)c1ccccc1NCCc1ccc(Cl)cc1	758028138	ZCGBYSBNXMRPHP-CYBMUJFWSA-N	438.937	1.693	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1cccnc1Br	758256630	OQLWJUNSRXQZCK-UHFFFAOYSA-N	441.307	1.622	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)NNC(=O)C(=O)Nc1ccccn1	758831005	MMGQXDZWVVARQR-HNNXBMFYSA-N	427.461	1.304	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)CN2CCO[C@H](c3cccc(OC(F)F)c3)C2)cc1	759357443	AJDNEKOUYZXUGA-SFHVURJKSA-N	430.411	1.994	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2ccc(OCC(F)F)nc2)cc1	761197147	PGGBPTHCLYOTJQ-UHFFFAOYSA-N	442.444	1.116	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=S)Nc2ccccc2OC)n(C)c1	761659772	HNYYJINLRLPZHM-UHFFFAOYSA-N	439.563	1.696	50	20	IDGD	
C[C@H](CCS(C)(=O)=O)NC(=O)NNC(=O)c1ccc(Br)cc1Cl	762026855	BGRUEVCVGTWKJY-MRVPVSSYSA-N	426.720	1.870	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2cc(C3CC3)nc3c2c(O)nc(=O)n3CC(C)C)n[nH]1	763137398	RPQBGCFZLBDKGI-UHFFFAOYSA-N	425.449	1.137	50	20	IDGD	
CN(C)CC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2cc3ccccc3cc2O)cc1	763528547	VGUKBGPGFSNGNJ-UHFFFAOYSA-N	449.467	1.445	50	20	IDGD	
CCOC(=O)/C=C/c1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)cc1	763551470	ONLBBCAZOGTTHD-BJMVGYQFSA-N	425.397	1.391	50	20	IDGD	
COc1ccc(NC(C)=O)cc1NC(=O)C(=O)NNC(=O)COc1ccc(C)c(C)c1	763680555	RAEVFCKJGIWIQT-UHFFFAOYSA-N	428.445	1.435	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(NC(=O)C2CC2)cc1	763681787	NCOBHJWRYWNZFH-UHFFFAOYSA-N	440.456	1.599	50	20	IDGD	
NC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)CC23CC4CC(CC(C4)C2)C3)cc1	763736928	VBBBMYRUIQHILH-UHFFFAOYSA-N	428.489	1.243	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)C(=O)N1CCc2ccc(Br)cc21	763808811	QVXLOOGYUKFBLS-UHFFFAOYSA-N	443.257	1.436	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)ccc1Cl	763809635	YCSZNYCSLWFOIV-UHFFFAOYSA-N	444.831	1.553	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)C(=O)Nc1cnn(Cc2ccc(Cl)cc2)c1	763839949	NWTWLWHTVOJXSM-UHFFFAOYSA-N	445.838	1.889	50	20	IDGD	
Cc1ccc(Cn2nccc2NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)s1	763859220	ZFQPDHQEBFDTJN-CYBMUJFWSA-N	445.476	1.994	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2nc(C(C)(C)C)ns2)cc1	763861197	MPKIEIOAYTWDRK-NSHDSACASA-N	435.506	1.788	50	20	IDGD	
COc1c(F)cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(C(C)=O)cc2)cc1F	763871147	DVWSXCRDHFVPCF-NSHDSACASA-N	435.383	1.729	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(OCC)c(OC)c2)cc1OC	763900401	DUVXVZYPSBWMII-UHFFFAOYSA-N	431.445	1.901	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3nc(C)cn3c2)cc1OC	763912350	XLSCPQZUNMTHFF-UHFFFAOYSA-N	425.445	1.840	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)C(=O)Nc1cc(Cl)cc2cccnc12	763916576	GPYDWAHUJOTQJK-UHFFFAOYSA-N	436.819	1.264	50	20	IDGD	
CCOC(=O)COc1cccc(NC(=O)C(=O)NNC(=O)Cc2ccc(Cl)cc2)c1	763931505	ILXORTLEVZYGCL-UHFFFAOYSA-N	433.848	1.611	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)Cc3ccc(Cl)cc3)cc2)CCO1	763936128	FIPQQNHDTUONFT-AWEZNQCLSA-N	430.892	1.894	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)C(=O)Nc1ccc(Br)nc1	763949068	NCWMNZWPWOGFBV-UHFFFAOYSA-N	445.233	1.135	50	20	IDGD	
COCCOc1ccc(Br)cc1NC(=O)C(=O)NNC(=O)c1ccc[nH]1	763980371	TYTGHPKAPHCYSX-UHFFFAOYSA-N	425.239	1.202	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)Nc1ccc(C(=O)NC2CC2)cc1	764001531	AFBIOYOKDOCART-UHFFFAOYSA-N	448.277	1.080	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1c(C)cnn1Cc1cc(F)ccc1F	764041386	UBDUQKGPOZSVFY-UHFFFAOYSA-N	443.410	1.926	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(Cl)c3ncccc23)c1	764077268	LLHBPDLWHQOTIX-UHFFFAOYSA-N	446.872	1.691	50	20	IDGD	
COC(=O)c1sccc1NC(=O)C(=O)NNC(=O)c1ccc(F)cc1Br	764086918	WSODVHQDBAQBEY-UHFFFAOYSA-N	444.238	1.836	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2cc3c(cc2Cl)OCCO3)cc1	764124136	CTMRUNIMSPHWQR-UHFFFAOYSA-N	433.848	1.839	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)cc1Br	764152246	CNVLMMATGSPMRJ-HNNXBMFYSA-N	434.246	1.547	50	20	IDGD	
CN1CCC[C@@H](N(C)C(=O)c2ccc(NC(=O)C(=O)NNC(=O)CC(C)(C)C)cc2)C1	764197537	DAGRXVCHAGNECX-QGZVFWFLSA-N	431.537	1.375	50	20	IDGD	
Cc1nc(-c2cccc(NC(=O)C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)c2)n[nH]1	764204412	SZXVMPYYNBQQLO-UHFFFAOYSA-N	445.480	1.171	50	20	IDGD	
NS(=O)(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2c(Cl)cccc2Cl)c1	764221348	NKSXSUQJUAXVKE-UHFFFAOYSA-N	431.257	1.041	50	20	IDGD	
CCn1cnnc1-c1cccc(NC(=O)C(=O)NNC(=O)c2cccc(OC(F)F)c2)c1	764250647	LDMVQZGOYLPCNH-UHFFFAOYSA-N	444.398	1.966	50	20	IDGD	
CN(Cc1ccccc1NC(=O)C(=O)NNC(=O)Cc1ccccn1)C(=O)OC(C)(C)C	764270781	TZAQSDPACSYZRW-UHFFFAOYSA-N	441.488	1.777	50	20	IDGD	
CN1CCN(c2ccccc2NC(=O)C(=O)NNC(=O)CCCc2cccs2)CC1	764339324	JTWWEUKNSBWMBT-UHFFFAOYSA-N	429.546	1.609	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)C(=O)Nc1ccnc(OCC(F)(F)F)c1	764351576	SXLPMHATYARRGB-UHFFFAOYSA-N	448.361	1.608	50	20	IDGD	
CSc1cc2c(cc1NC(=O)C(=O)NNC(=O)COCc1ccccc1)OCCO2	764366388	LATZBPZYIHAXDP-UHFFFAOYSA-N	431.470	1.482	50	20	IDGD	
COCCOc1ccccc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	764387231	GTACGQJDFXGZRF-UHFFFAOYSA-N	441.419	1.641	50	20	IDGD	
COc1ccc(Cn2nccc2NC(=O)C(=O)NNC(=O)c2ncccc2C)c(OC)c1	764388690	HJYHSQRDFWMTJZ-UHFFFAOYSA-N	438.444	1.052	50	20	IDGD	
CC(=O)NCc1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(C)c(C)c3)[nH]n2)cc1	764389182	YZXDWGKSEYARFI-UHFFFAOYSA-N	448.483	1.729	50	20	IDGD	
CCOC(=O)c1ccc(NC(=O)C(=O)NNC(=O)CSc2ccccc2OC)cc1	764397005	DOTRFDPURXVZFB-UHFFFAOYSA-N	431.470	1.750	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2cc(S(=O)(=O)NCc3ccccc3)ccc2C)n[nH]1	765587319	AAUXFFCLWWGDTA-UHFFFAOYSA-N	427.486	1.580	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)[C@H]1C[C@@H]1c1cccc(F)c1F	765738960	QGAZNXLYLVWCFU-MSOLQXFVSA-N	442.466	1.674	50	20	IDGD	
O=C(CCSc1ccccn1)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765739602	ZLFVQDFOSIEVTD-UHFFFAOYSA-N	427.530	1.169	50	20	IDGD	
CCCn1cc(C(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)nn1	766555129	MHFJKVCYHZWZLU-UHFFFAOYSA-N	434.503	1.625	50	20	IDGD	
COc1ccc(Cn2cc(C(=O)OCC(=O)NNC(=O)Cc3ccccc3C)cn2)cc1	767348611	XNLKQKIZRDJDRY-UHFFFAOYSA-N	436.468	1.795	50	20	IDGD	
N#Cc1ccc(OC2CCC(NC(=O)NNC(=O)c3nnc(O)c4ccccc34)CC2)nc1	769030537	TUTUHLVCWWYKIK-UHFFFAOYSA-N	447.455	1.936	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)c3cn(C)cn3)c2)cc1	769469428	WEOHHNCSVMTMPN-UHFFFAOYSA-N	429.458	1.304	50	20	IDGD	
C[C@]1(c2ccc(F)c(Cl)c2)NC(=O)N(CC(=O)NNC(=O)c2ccccc2F)C1=O	769728988	QWWLPVJEQCTAPH-LJQANCHMSA-N	436.802	1.846	50	20	IDGD	
COC(=O)c1cc(F)c(Br)c(S(=O)(=O)NNC(=O)c2ccccc2O)c1	769863791	XMELEAWQDNTGIJ-UHFFFAOYSA-N	447.238	1.704	50	20	IDGD	
CCn1c(NNC(=O)c2nccc3c(S(N)(=O)=O)cccc23)nc2ccccc2c1=O	770469925	XFCXKEOWUKBVEH-UHFFFAOYSA-N	438.469	1.369	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)c3ccc([C@@]4(C)NC(=O)NC4=O)cc3)nc21	770967141	ZDUXXRBWXDEAHD-HXUWFJFHSA-N	438.448	1.098	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1cccc(C(F)(F)F)c1)C(=O)NNC(=O)Cc1ccncc1	771031940	WGOORARLSYGQCL-LLVKDONJSA-N	430.408	1.157	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1ccc(S(=O)(=O)NCc2cccs2)cc1	772052945	CZXQRLPATKDJKX-LBPRGKRZSA-N	439.515	1.329	50	20	IDGD	
C=CCN1C(=O)c2ccc(C(=O)NNC(=O)C(=O)NCc3ccc(Cl)cc3)cc2C1=O	772188328	KUTYFILNXUXQBE-UHFFFAOYSA-N	440.843	1.199	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)ccc1NC(=O)OC(C)(C)C	772220947	ITDPMUMFEXJGHB-CYBMUJFWSA-N	426.495	1.473	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)Nc1cnn(Cc2nnc3n2CCCC3)c1	772635639	FJXPAZZCYHZLDJ-UHFFFAOYSA-N	440.464	1.100	50	20	IDGD	
O=C(NNc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(S(=O)(=O)C[C@H]2CCCO2)cc1	773642863	HHBWQOJQGOUGSC-MRXNPFEDSA-N	448.457	1.629	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(F)c(NC(=O)C(=O)NNc2ccccc2[N+](=O)[O-])c1	773647661	AGULTSPDGFNECV-UHFFFAOYSA-N	425.398	1.066	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)N[C@H](C)CN(C)Cc1ccccc1	775774435	QHGDHMQOCMSJGM-OAHLLOKOSA-N	446.577	1.753	50	20	IDGD	
CN(C)CC(=O)NNC(=O)Nc1ccc(OCCN2C(=O)c3ccccc3C2=O)cc1	775872925	WXJYTDGVTQDLRC-UHFFFAOYSA-N	425.445	1.076	50	20	IDGD	
COc1cccc([C@@H]2[C@H](C(=O)NNC(=O)Cn3nc(C)cc3C)CC(=O)N2C2CC2)c1	776448350	SBAAUZNVEQKHMF-WIYYLYMNSA-N	425.489	1.408	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)[C@@H](Cc2ccccc2)NC(=O)c2cccnc2)c1	776533804	LQSHPTIWZOBNTO-HXUWFJFHSA-N	438.509	1.970	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)N[C@@H]1CCN(c2ccccc2OC(F)F)C1	778672043	PHDREGPPUHQPKU-GFCCVEGCSA-N	443.451	1.722	50	20	IDGD	
O=C(C[C@@H](NC(=O)c1ccc(O)cc1)c1ccccc1)NNC(=O)C(=O)Nc1ccccn1	780634743	RLJSZRVKRPPDPS-GOSISDBHSA-N	447.451	1.435	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)cc1Cl	782896549	JYERYQZYYRLJNK-UHFFFAOYSA-N	437.909	1.650	50	20	IDGD	
CN1CCN(C(=O)c2ccc(NC(=O)C(=O)NNc3ncnc4ccsc34)cc2)CC1	783261728	IVVAFAWPVSDJAA-UHFFFAOYSA-N	439.501	1.161	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)CCS(=O)(=O)C1	783427177	MHWOGMXLJIICCQ-HXUWFJFHSA-N	445.501	1.467	50	20	IDGD	
Cc1cccc(COc2cccc(NC(=O)C(=O)NN[C@]3(C)CCS(=O)(=O)C3)c2)c1	783428678	YOONKEILOUWHDO-OAQYLSRUSA-N	431.514	1.711	50	20	IDGD	
NC(=O)[C@H](Cc1ccc(C(F)(F)F)cc1)NNC(=O)COc1ccccc1[N+](=O)[O-]	784061985	XHBWCERHTZMQMO-ZDUSSCGKSA-N	426.351	1.710	50	20	IDGD	
C[C@H](C#N)CSc1ccccc1NC(=O)C(=O)NNC(=O)Cc1cn2ccccc2n1	785068642	YOAIQRRWCNYWBZ-CQSZACIVSA-N	436.497	1.915	50	20	IDGD	
O=C(Cn1cc(NC(=O)C(=O)NNc2nc(C(F)(F)F)cs2)cn1)NC1CCCC1	785148086	VBMGWBKRAIRCAV-UHFFFAOYSA-N	445.427	1.499	50	20	IDGD	
CC[C@@H]1CCc2nc(NC(=O)C(=O)NNC(=O)COc3ccccc3[N+](=O)[O-])sc2C1	789731655	FHUHRQCDPTUFGW-LLVKDONJSA-N	447.473	1.731	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNc2c(OC)cccc2S(C)(=O)=O)ccc1Cl	789774494	FREOHEQCJLUJKQ-UHFFFAOYSA-N	427.866	1.843	50	20	IDGD	
COc1cc(OC)c(OC)cc1NC(=O)C(=O)NNC(=O)[C@H]1OCC[C@H]1c1ccccc1	789809599	BEKCXPYSVOQUOX-LIRRHRJNSA-N	443.456	1.371	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)[C@H](CCS(C)(=O)=O)c1ccccc1	790024616	SBOFUURSHGWBRY-OAHLLOKOSA-N	440.543	1.760	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccc(OC)cc2)c1)C(=O)OC	790104250	QJTYXNYGJCWNQX-QGZVFWFLSA-N	449.485	1.456	50	20	IDGD	
O=C(NNc1cccc(F)c1[N+](=O)[O-])c1cc(S(=O)(=O)N2CCOCC2)ccc1F	790585956	LOBRVMFVQAMQRW-UHFFFAOYSA-N	442.400	1.651	50	20	IDGD	
COc1ccc(C)cc1[C@]1(C)NC(=O)N(CC(=O)NNc2cccc(F)c2[N+](=O)[O-])C1=O	790585957	LPLQAEJXEFYTLL-FQEVSTJZSA-N	445.407	1.961	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)[C@@](C)(O)Cn2cc(C(F)(F)F)ccc2=O)cc1	792633166	PTPHFSXJVDSLGE-IBGZPJMESA-N	441.406	1.407	50	20	IDGD	
CC(C)(C)OC(=O)N1CCc2c(ccc(NC(=O)C(=O)NNC(=O)c3ccc[nH]3)c2F)C1	793021282	BENIATVRXUGWJU-UHFFFAOYSA-N	445.451	1.847	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNc2ccc3c(=O)[nH]ccc3c2)cc1	793069286	AATMNNRYYFTKEO-UHFFFAOYSA-N	429.458	1.372	50	20	IDGD	
CCOC(=O)c1cc(COC)cc(S(=O)(=O)NNC(=O)Cn2ccc3ccccc32)c1	793392676	SNMLCYWMUDYXHO-UHFFFAOYSA-N	445.497	1.974	50	20	IDGD	
COCc1cc(C(=O)OC)cc(S(=O)(=O)NNC(=O)c2ccc(OC)cc2OC)c1	793392933	YYYNPJUXFKWVOV-UHFFFAOYSA-N	438.458	1.260	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)[C@H]1[C@H]2[C@@H]3C[C@@H]4[C@@H]5C[C@@H]([C@@H]2[C@@H]53)[C@@H]41	793591963	NYGXRDJTPGVMEZ-ZCHBXKNESA-N	429.542	1.545	50	20	IDGD	
CC[C@H](C)CC[C@H](O)CC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	793710424	LVQVFTFGMABFNQ-WMZOPIPTSA-N	426.583	1.643	50	20	IDGD	
Cc1nn(-c2ccccc2)c(N)c1C=NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	794878831	DTVVUOAIGLCFSP-UHFFFAOYSA-N	432.893	1.828	50	20	IDGD	
C[C@@H]1CN(Cc2csc(NC(=O)NNc3ccc(-n4ccnc4)nn3)n2)C[C@@H](C)O1	796656095	QTNVADIJUYIPJI-CHWSQXEVSA-N	429.510	1.877	50	20	IDGD	
CCn1ncc2cc(C(=O)N3CCN(S(=O)(=O)CBr)CC3)c(C)nc21	799717850	MQNNWMFWWCYFLS-UHFFFAOYSA-N	430.328	1.200	50	20	IDGD	
N#Cc1ccc(NNC(=O)C(=O)Nc2cccc(S(N)(=O)=O)c2)c(C(F)(F)F)c1	799840299	JRKPYGWXZXHEEC-UHFFFAOYSA-N	427.364	1.306	50	20	IDGD	
CNC(=O)CNC(=O)c1cccc(NC(=O)NNC(=O)CSc2ccc(C)cc2)c1	800594759	GMHGFZIUUKZDQZ-UHFFFAOYSA-N	429.502	1.416	50	20	IDGD	
CC(C)(C)c1cnc(CCC(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)o1	801599827	DVWDCBPRBLGHJG-UHFFFAOYSA-N	428.898	1.667	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)c2cnn(CC(=O)NC3CCCCC3)c2)cc1	802121219	VHQMUCFOXAFMSQ-UHFFFAOYSA-N	427.509	1.865	50	20	IDGD	
N#Cc1cc(F)cc(C2(C(=O)OCC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)CC2)c1	803921733	HJWBIMATNDAOFJ-UHFFFAOYSA-N	426.360	1.642	50	20	IDGD	
CNC(=O)NNC(=O)c1ccc(NS(=O)(=O)c2ccc(Br)cc2)cc1	804028479	PMTYJPGDWDRSBQ-UHFFFAOYSA-N	427.280	1.824	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NC[C@@H]2CCCS(=O)(=O)C2)cc1Br	805103783	DPMNMNRFHZAZAR-JTQLQIEISA-N	434.312	1.227	50	20	IDGD	
COCCNC(=O)[C@H](C)OC(=O)c1ccc(NC(=O)NNC(=O)c2cc(C)oc2C)cc1	806749257	ATOBZGFXUXSPOK-AWEZNQCLSA-N	446.460	1.671	50	20	IDGD	
CNC(=O)c1cccc(NC(=O)C(=O)NNc2cccc([N+](=O)[O-])c2)c1Br	806968173	AGVUAOYIWCZWJA-UHFFFAOYSA-N	436.222	1.799	50	20	IDGD	
O=C(NNC(=O)N1CCN(c2ccccc2[N+](=O)[O-])CC1)c1cc(Br)c[nH]1	807149375	ZSQFLANPMLJQTM-UHFFFAOYSA-N	437.254	1.862	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)C(=O)Nc1cc(Br)c(F)cc1F	807429811	XJUGKKLWWRMCPF-UHFFFAOYSA-N	438.192	1.785	50	20	IDGD	
Cc1cc([N+](=O)[O-])ccc1NNC(=O)C(=O)Nc1ccccc1N1CCC(C(N)=O)CC1	807457709	KHWUCALPJMKRPV-UHFFFAOYSA-N	440.460	1.687	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)Cc1ccc(S(=O)(=O)N2CCCCC2)s1	808045486	MCJPHJYPRYTRGH-UHFFFAOYSA-N	447.579	1.402	50	20	IDGD	
Cc1c(/C=C(\C#N)C(=O)OCC(=O)Nc2cccc(S(C)(=O)=O)c2)cc(C#N)n1C	809303299	KYLKPSHFDBKDHA-VIZOYTHASA-N	426.454	1.698	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)cc1C	810586172	YTFKCRILUBZMRG-UHFFFAOYSA-N	445.476	1.572	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)NC[C@@]1(COC)OCCc2ccccc21	812478386	TYNRMHPESQOMNS-QHCPKHFHSA-N	443.500	1.909	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)[C@H]1CC2CCC1CC2	814252809	KAAMYNWGRAFSPD-QLOJAFMTSA-N	449.573	1.614	50	20	IDGD	
CC(=NNC(=O)Nc1ccc(S(N)(=O)=O)cc1)c1cc2c(s1)SCC(=O)N2	814965293	LPCDRCATARLTSM-UHFFFAOYSA-N	425.517	1.985	50	20	IDGD	
CS(=O)(=O)c1cccc(Oc2ccc(NC(=O)C(=O)NNC(=O)[C@H]3CCCO3)cc2)c1	815778270	JQMZBVBBLXAOIB-QGZVFWFLSA-N	447.469	1.147	50	20	IDGD	
Cc1ccc(NNC(=O)CCC(=O)N2CCN(S(=O)(=O)c3ccccc3)CC2)cc1	832680011	MQJJGLZHXLJJFG-UHFFFAOYSA-N	430.530	1.751	50	20	IDGD	
COCCCN(C(=O)/C(C#N)=C\c1cc(C)n(CCOC)c1C)[C@@H]1CCS(=O)(=O)C1	841771895	ZRSRNPJNMPFHHU-QRRJMBGHSA-N	437.562	1.711	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)c2cc(C)n(Cc3ccc(S(N)(=O)=O)cc3)c2C)n1	877463557	BOUZYBYRWBRILY-UHFFFAOYSA-N	428.518	1.964	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)CNS(=O)(=O)c2cccc(C#N)c2)c1C	915787678	HZPCAMMYMHKTFD-HNNXBMFYSA-N	430.486	1.068	50	20	IDGD	
CCCC[C@@H](CC)CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	915879177	CXBZLHHCIAXLEE-MRXNPFEDSA-N	440.566	1.868	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C2=NN(Cc3ccc(F)cc3)C(=O)CC2)c1	916035033	WTJQOKCTFRLGTJ-UHFFFAOYSA-N	428.420	1.783	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)NC1CCN(C(=O)c2ccccc2)CC1	916224541	UZEJBSXRTCZCSZ-UHFFFAOYSA-N	441.444	1.609	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)N[C@H](Cc2ccccc2)CN(C)C)nc1	918131959	QOFGWRAULIPZCE-GOSISDBHSA-N	448.593	1.911	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)c2ccc3c(c2)C[C@H](C)N3S(C)(=O)=O)cc1	919836476	SREMUPQMPCGYET-AWEZNQCLSA-N	431.514	1.800	50	20	IDGD	
C[C@@H]1CCCN(C[C@@H](C)NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)C1	919915458	VGCJSAAGWCRWLC-HUUCEWRRSA-N	425.555	1.001	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)CNS(=O)(=O)c2c(Cl)cccc2Cl)c1	920239082	APCVLQAHTROQCD-UHFFFAOYSA-N	445.328	1.799	50	20	IDGD	
CSc1nc(C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)c2ccccn12	920284717	HUWMBMCNCKTUNC-UHFFFAOYSA-N	447.542	1.446	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCC(=NNC(=O)COc3ccccc3C#N)CC2)cc1	920365549	RNCQLCQAUJFMDD-UHFFFAOYSA-N	442.497	1.903	50	20	IDGD	
O=C(CSc1ccccc1C(=O)NNC(=O)CN1CCCC1=O)NCC1CCCCC1	920436067	VKXYMQIKMYSVLL-UHFFFAOYSA-N	446.573	1.859	50	20	IDGD	
Cc1nc(C(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)nn1-c1ccccc1	1318668459	WQHXNYHVZQSKTO-UHFFFAOYSA-N	428.493	1.984	50	20	IDGD	
O=C([C@H]1CCCCN1Cc1cccnc1)N1CCN(S(=O)(=O)CBr)CC1	1325375690	FTBOMDLUKRJWLE-MRXNPFEDSA-N	445.383	1.263	50	20	IDGD	
C[C@@H](CCNC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)N(C)C(=O)OC(C)(C)C	1338931138	FFRNEABCBFPBSK-ZDUSSCGKSA-N	446.508	1.523	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4cnccc4n3)C2)C1	1777736597	YHZSPJJBALNRQM-DJJJIMSYSA-N	433.306	1.857	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(Cl)c4nncn4c3)C2)C1	1778947006	SHPIDRHANMEAGD-FZKQIMNGSA-N	426.304	1.844	50	20	IDGD	
C[C@@H](Cn1cccn1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Br)C1	1780770996	OTEQXYNIAUHOBK-JTOWHCCKSA-N	445.333	1.724	50	20	IDGD	
CC(=O)N[C@@H](C(=O)N1CC[C@@]2(CN(C(=O)[C@H](F)Cl)CCO2)C1)c1ccc(F)cc1	1780914843	POZZXJHNLGDKHR-GJYPPUQNSA-N	429.851	1.367	50	20	IDGD	
O=C(CCCn1c(O)nc2ccccc21)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Cl)CCO2	1780919494	DSFTXNLBWSAKAC-PXNSSMCTSA-N	438.887	1.886	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc4c(c3)CNC4=O)CCO2)C1	1781229489	DVHDVXGKNKPASA-PMACEKPBSA-N	440.327	1.610	50	20	IDGD	
Cc1noc(C)c1CCC(=O)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781325917	KBMTYDPQXBUJJX-DOTOQJQBSA-N	432.290	1.744	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cccc(NC(=O)OC)c3)C2)C1	1781443497	BHUYFNNWZQPJSQ-UZLBHIALSA-N	439.896	1.562	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc3nc[nH]c3c1)C2	1782175374	JWPYCZYAFUHCSK-RRMPHLOHSA-N	434.924	1.944	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)Cc1ccccc1)C2	1782178594	BHUFFJOITROGKJ-PSHVLCQKSA-N	438.952	1.358	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](C)N1C[C@@H]3C[C@H]3C1)CCO2	1783349385	LGSJQWXKEITORX-GMHRPJKWSA-N	428.371	1.330	50	20	IDGD	
COc1nc(C)ccc1C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](C)Br)C2)C1	1783535566	AAZHRBHJKDGAMP-UGSOOPFHSA-N	426.311	1.626	50	20	IDGD	
Cc1onc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]3C2)c1C	1783968548	BIINAGACBVUAMN-HJPIBITLSA-N	428.327	1.916	50	20	IDGD	
Cc1ccc2nc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]4C3)ccc2c1	1784090609	JHYVDQRGJSUDPH-FVCZOJIISA-N	431.920	1.736	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CC[C@@H](C(=O)OC)C3)C[C@@H]21	1784615595	SMDZQPYZXCNJAQ-ZMSHIADSSA-N	428.957	1.963	50	20	IDGD	
O=C(CN1CCc2sccc2C1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21	1785100121	RNXGHRWXIQUXRY-XSWJXKHESA-N	429.945	1.620	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)CCc3c[nH]c4ncccc34)C2)C1	1785489016	YPURSYOVIDMQTE-DYESRHJHSA-N	434.924	1.579	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)C3CCN(CC)CC3)C2)C1	1785647541	IWSGYQPVXFVGGY-VQIMIIECSA-N	430.387	1.722	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(N(C)C)cn3)[C@H]2C1	1785749881	LDKCEOWPRRVBQV-HPZZRFSDSA-N	439.354	1.524	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCN3CCCCC3)C[C@@H]21	1786404172	GNVRZCZQDDQEJR-ULQDDVLXSA-N	430.387	1.627	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(-c4ccncc4)[nH]n3)[C@H]2C1	1788926556	PFBVQZIVACPVTA-GGXPGOJBSA-N	447.923	1.319	50	20	IDGD	
Cn1nc(C(F)(F)F)cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21	1788964616	GPUKNSGAUIWDJS-QXEWZRGKSA-N	443.253	1.836	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnn(C)c3Cl)[C@H]2C1	1789083599	UIPYOFFKEWFWOX-URBCHYCLSA-N	433.734	1.450	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc4[nH]ncc34)C[C@@H]21)[C@H](F)Br	1789922722	LSGGOUMGDMLTDN-NZBMOFRJSA-N	439.285	1.847	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(-n4cnnc4)cc3)C[C@@H]21)C(Cl)Cl	1791294327	NIKBQPCSZQAZRA-BPUTZDHNSA-N	438.315	1.664	50	20	IDGD	
C[C@H](Br)C(=O)Nc1ccc(C2(NC(=O)C[C@H]3NC(=O)NC3=O)CCC2)cc1	1791432329	VUWUZEPGZJZIGY-GXFFZTMASA-N	437.294	1.502	50	20	IDGD	
Cn1ncc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C(C)(C)CCl)c1C(F)(F)F	1792782273	MIWTXROIMTWQQM-PTEHBNRSSA-N	436.862	1.907	50	20	IDGD	
COc1ccccc1CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCC(=O)NN(C)C)C2	1793330241	KPKNRRQNTWMGFR-REPLKXPHSA-N	430.549	1.639	50	20	IDGD	
O=C(COc1cccc2ccccc12)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2	1793814169	BGCCRDADGXSYMT-VWFIUDSGSA-N	432.904	1.408	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1COc2ccccc2O1	1793846991	YBEOKGSOYQHNTC-XIUQWWLSSA-N	439.306	1.199	50	20	IDGD	
O=C(Cc1cccc(Cl)n1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2	1794195931	DZRULWAZBHFSBV-OWLDWWDNSA-N	434.693	1.558	50	20	IDGD	
C[C@@H](Cn1cccn1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)CBr)C2	1794203093	DDGKALGGZUESGI-DGADGQDISA-N	427.343	1.140	50	20	IDGD	
Cn1c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](O)CCl)C3)cc2c1-c1ncccc1OC2	1796392974	YEPNQMVLPPUVNB-JYYAWHABSA-N	444.919	1.831	50	20	IDGD	
CCCC(=O)N[C@@H](C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C(C)=N/NC(=O)c1ccc[nH]1	1796891940	PVPFDYXAWDNRIC-BCCLYZLDSA-N	444.536	1.063	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)c1c[nH]c2cccc(Cl)c12	1797566777	OKAVYQUNWSIJMA-RERORNDZSA-N	426.300	1.624	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c(c1)NC(=O)CC3)C2	1797957379	MTSQIPUJTUQVCA-UPHUGPLXSA-N	445.592	1.626	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cc1cccnc1Cl)C2	1798440569	BQJVCWAPRZGXLY-QDMKHBRRSA-N	442.907	1.228	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1=CCN(C(=O)OC(C)(C)C)C1)C2	1799263169	HBRLLKSCGUOAPS-YVSFHVDLSA-N	441.956	1.771	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1COc3ccccc3O1)C2	1799273971	NNMATVLUHCKSGE-RSSYPWKWSA-N	443.327	1.652	50	20	IDGD	
CC(=O)Nc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@](C)(Cl)CCl)ccn1	1799275357	PXUOONLEGUPAJP-QHHYFVSCSA-N	443.331	1.480	50	20	IDGD	
CC(C)c1nc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Br)no1	1799344241	DCAOKBMATBMVFJ-RDBQEKCUSA-N	433.278	1.016	50	20	IDGD	
CC(C)(C)n1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Br)n1	1799346767	AAOKLGIHGGEUCC-ZMJPVWNMSA-N	431.306	1.532	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1c(F)cccc1F)C2)[C@H](F)Br	1799348979	SXDBZFSLTADHNJ-UIHHKEIPSA-N	435.240	1.787	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1n[nH]c2ccc(C#N)cc12	1800879135	ANPXPHNPBCXZRL-MUJYYYPQSA-N	437.504	1.059	50	20	IDGD	
CC1(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Cl)C3)CN(C(=O)OC(C)(C)C)C1	1802220870	NIMQZCVBZRBSBJ-OCVGTWLNSA-N	447.935	1.758	50	20	IDGD	
COC[C@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](COC)NC(=O)OC(C)(C)C)C2	1802277149	PXOPADMIMQSLGR-QRJUGERDSA-N	447.960	1.418	50	20	IDGD	
CN1CCN(CC(=O)N2CC[C@H](CNC(=O)C(C)(C)CCl)[C@H]2c2cccnc2)CC1	1802900576	BIVBGCIYXQYATR-UYAOXDASSA-N	436.000	1.600	50	20	IDGD	
O=C(Cc1cnccn1)NC[C@@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1	1803295554	JLLUNDBQECFUPX-HNAYVOBHSA-N	432.322	1.905	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc2c1CCCC2)c1ccc(B(O)O)cc1	1803698075	ZJAXVSYUVMULLA-WKCHPHFGSA-N	432.329	1.811	50	20	IDGD	
C[C@@H](CNC(=O)OC(C)(C)C)C(=O)N1CCC2(CCCN(C(=O)[C@H](O)CCl)C2)CC1	1805514922	GTIBCQXWANCZEN-JKSUJKDBSA-N	445.988	1.978	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H](CNC(=O)CN)[C@@H]1c1cccnc1	1807036916	OJJMEZGFPKWMMW-QRWLVFNGSA-N	441.444	1.193	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CCc2ccc[nH]2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1	1807371085	PGVZTKJWVTUSTH-WMZHIEFXSA-N	446.316	1.042	50	20	IDGD	
Cc1ccccc1C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1807376503	VZDHWJLZKAZZEQ-NFBKMPQASA-N	443.312	1.703	50	20	IDGD	
Cc1nnc(CC(=O)NC[C@@H]2CCN(C(=O)CCBr)[C@@H]2c2cccnc2)o1	1807467380	MLPOQZDEQQMIEU-KBXCAEBGSA-N	436.310	1.807	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2cnccc2F)[C@H]1c1cccnc1	1807829754	ZOZUBLVFMBPYGF-HRAATJIYSA-N	442.495	1.308	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1808259641	LPHMXHRGXNRRCW-WDSOQIARSA-N	429.713	1.098	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cc(CO)on2)[C@@H]1c1cccnc1)[C@@H](F)Br	1808675444	ABHCRNIQCYHDPS-NILFDRSVSA-N	441.257	1.572	50	20	IDGD	
CC(C)c1cc(C(=O)N2CCC3(CCCN(C(=O)c4ccc(B(O)O)cc4)C3)CC2)n[nH]1	1809971258	OCBFAHPJWADFAE-UHFFFAOYSA-N	438.337	1.372	50	20	IDGD	
CC(=O)N[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)[C@H](C)CBr)[C@H]1c1cccnc1	1812645908	NOYGEKNUKJIZOD-OMNBBPDLSA-N	439.354	1.643	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)[C@@](C)(O)C(F)(F)F)[C@H]1c1cccnc1	1813028394	PWHBMALYDZPZAY-AYMQEEERSA-N	437.846	1.655	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)[C@@H]2C[C@H]3CC[C@@H]2O3)[C@H]1c1cccnc1	1813074394	QPQNRVAHVNLMHB-DIGZUXTDSA-N	443.548	1.028	50	20	IDGD	
CCS(=O)(=O)N[C@@H](C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)C(C)(C)CCl)n[nH]1	1814695617	ZDTZSMVCWMJODJ-JSGCOSHPSA-N	447.989	1.995	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cnc3snnc3c2)[nH]n1)[C@@H](O)CCl	1814872586	DPKQBFHGFWBIKT-OLZOCXBDSA-N	435.897	1.715	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1coc(Cl)n1)CC2)c1ccc(B(O)O)cc1	1815337033	JGBANOCKTSUZCV-NSHDSACASA-N	446.681	1.004	50	20	IDGD	
Cc1cc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)cn1C	1815354876	WGZZCFFPGURYMC-MRXNPFEDSA-N	438.318	1.009	50	20	IDGD	
Cc1ccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)[nH]n2)o1	1815385115	BGTQTVFICAISIR-INIZCTEOSA-N	437.460	1.929	50	20	IDGD	
Cc1onc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)c1C	1815454153	KUNVGHMSOQDTKB-HNNXBMFYSA-N	431.497	1.693	50	20	IDGD	
Cc1nnc(CC(=O)Nc2nc3c(s2)C[C@H](NC(=O)CCBr)CC3)o1	1815485344	HXSOIMZASNEGST-SECBINFHSA-N	428.312	1.774	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccncc2F)[nH]n1)c1ccc(B(O)O)cc1	1817471641	KWVDBZXSPRDRBN-GOSISDBHSA-N	437.240	1.243	50	20	IDGD	
CCc1cc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)no1	1819891208	ZDDRNWVIJCYQEW-MRXNPFEDSA-N	431.497	1.639	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3cc(OC)n(C)n3)sc2C1	1821777624	GEWUERLJMKQQOI-UWVGGRQHSA-N	427.914	1.365	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCN2CCOCC2)[nH]n1	1822184831	WUWSDAZOCHSSGE-UKRRQHHQSA-N	442.358	1.908	50	20	IDGD	
Cc1ncccc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1	1822413438	WFXVAHSGVJZSLF-KRWDZBQOSA-N	427.509	1.792	50	20	IDGD	
C[C@@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1)C1(O)CCC1	1823732614	JZJFVWCWOHVJOT-LAUBAEHRSA-N	442.365	1.151	50	20	IDGD	
CC(C)[C@@H](S)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1	1824540160	HANKGCVPLPVHSH-RTBURBONSA-N	447.605	1.873	50	20	IDGD	
O=C(N[C@@H]1CCc2nc(NC(=O)[C@@H]3CCCS3(=O)=O)sc2C1)C(Cl)Cl	1824940570	XYFPKESZZHIDIJ-XCBNKYQSSA-N	426.347	1.436	50	20	IDGD	
O=C(COc1cccnn1)Nc1nc2c(s1)C[C@H](NC(=O)CCBr)CC2	1826758790	LYYQUFWRAAHEKM-SNVBAGLBSA-N	440.323	1.709	50	20	IDGD	
C[C@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)[C@H](C)n3cncn3)sc2C1	1826797120	FCXXJOBLRITJBW-GUBZILKMSA-N	427.328	1.691	50	20	IDGD	
Cc1ccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)cn1	1827056213	QXQCESKWUMLQCI-JOCHJYFZSA-N	435.333	1.617	50	20	IDGD	
Cc1nnsc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1	1827816736	QZQCGLMFXCJMQV-GOSISDBHSA-N	442.350	1.073	50	20	IDGD	
O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CCC(F)(F)C1)CCO2	1829645628	DURAWQWQXLDPAD-BBRMVZONSA-N	439.297	1.663	50	20	IDGD	
O=C(/C=C/c1ccc(F)cc1F)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1830726255	PXXUAUIHQUFBCG-YJVPDANMSA-N	444.862	1.034	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CNC(=O)OC(C)(C)C)C2)C1	1831657986	RVIWUNWHWINIIQ-FOIQADDNSA-N	447.960	1.375	50	20	IDGD	
COc1ncccc1CCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1833000353	PWZIKEALWFAZLC-APWZRJJASA-N	429.876	1.014	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)[C@@H]1CCCCC1(F)F	1833548390	GELLRBGFCPWMEI-IRXDYDNUSA-N	435.943	1.983	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cccn(C)c3=O)CC2)CC1	1833584364	NEAARWLMHFFDHO-LJQANCHMSA-N	436.984	1.978	50	20	IDGD	
O=C(Cc1ncccn1)NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1833876885	YFANISLFOUUJLY-QGZVFWFLSA-N	442.333	1.281	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3ccc4nccn4c3)CC2)CC1	1835413772	JKDODLIDNABBGM-IBGZPJMESA-N	447.967	1.773	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3ccc4nccn4c3)CC2)CC1	1835413774	JKDODLIDNABBGM-LJQANCHMSA-N	447.967	1.773	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)N3CCOCC3)CC2)CC1	1836922861	QNCKUPYOHUNCBT-GHTZIAJQSA-N	445.988	1.043	50	20	IDGD	
C[C@@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1)n1ccccc1=O	1837680371	IQBNLGMAPJSDPS-KKSFZXQISA-N	439.940	1.131	50	20	IDGD	
Cc1nc(C)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCBr)C3)C2)o1	1838002138	YYELNTUVBICOEJ-QGZVFWFLSA-N	430.299	1.146	50	20	IDGD	
COCc1c[nH]c(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCBr)C3)C2)c1	1838516838	STABRVLZKSAHNL-GOSISDBHSA-N	444.326	1.016	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(Cl)c(O)cc3O)C2)C1	1839147274	LYKAHJYFIODARK-ORAYPTAESA-N	447.315	1.839	50	20	IDGD	
COc1cc(C)cc(C(=O)N2CCO[C@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)c1	1839256638	NICAMIIOWKDBTF-LJQANCHMSA-N	431.316	1.877	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(CN(C(=O)CCC(C)C)CCO2)C1	1839848707	JTYGQDKNAYDFES-PCCDRTMGSA-N	447.536	1.013	50	20	IDGD	
COc1cc(OC)cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)c1	1840188978	OWWSWKHEISEREU-LJQANCHMSA-N	447.315	1.578	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CCCSC1)CCO2	1840867068	CUGIVSZAZUSZHU-VBQJREDUSA-N	435.384	1.369	50	20	IDGD	
COc1ccc(OC)c(C(=O)CCC(=O)N2CC3(CCCN3C(=O)[C@H](O)CCl)C2)c1	1841354169	LDUOVHPINSDMRI-QGZVFWFLSA-N	438.908	1.470	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)c1nc3c(=O)[nH]c4ccccc4n3n1)C2	1841668384	XAFCEUYVEKWKOV-ZDUSSCGKSA-N	442.907	1.795	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H]1C=C[C@@H](C(=O)N2CCCC23CN(C(=O)[C@@H](O)CCl)C3)C1	1841920782	LYGCTQKZFAUIPS-ILXRZTDVSA-N	427.929	1.259	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC2(CCCN2C(=O)[C@@H](CCN)NC(=O)OC(C)(C)C)C1	1842912536	ZUESXSQRXSAMLA-CHWSQXEVSA-N	447.374	1.215	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)C(=O)NC3CC3)c3ccccc3n2)cc1OC	9889814	WXNWYQCWFKDRKR-UHFFFAOYSA-N	434.452	1.959	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=S)NC(C)(C)C)CC2)cc1	14895106	NMCLVEFBGAVCQH-UHFFFAOYSA-N	428.580	1.390	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2ccc3c(=O)n4c(nc3c2)CCC4)cc(OC)c1OC	15662712	TWZQUOUIEYQANM-UHFFFAOYSA-N	438.440	1.443	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)COc2ccc(C#N)cc2)c1	15888955	PCIOAVQZANDCHN-UHFFFAOYSA-N	430.486	1.429	50	20	IDGD	
C[C@@H]1CC(C)(C)C[C@@]2(C1)NC(=O)N(CC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)C2=O	21001357	HDLBCNWSBADETQ-MPBGBICISA-N	431.449	1.493	50	20	IDGD	
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)CNC(=O)c1ccco1	725741447	RHBWOMLZZYKMJD-KRWDZBQOSA-N	439.472	1.022	50	20	IDGD	
COc1ccccc1[C@@H](CNC(=O)NNC(=O)CNC(=O)c1cccs1)N1CCCC1	726085162	YZIREJGFFIXSHG-MRXNPFEDSA-N	445.545	1.654	50	20	IDGD	
COc1ccc(CCNC(=O)NNC(=O)c2cc(Br)c[nH]2)c(OC)c1OC	727841175	VQHLDRBVGOVVFN-UHFFFAOYSA-N	441.282	1.990	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H]2CCCN2c2ccc(C#N)cc2)c1	728171151	YLVGYDCOWSLHOM-LJQANCHMSA-N	441.513	1.239	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3cc4ccccc4oc3=O)cc2)CC1	728214174	ZJXOEMAZALMKAG-UHFFFAOYSA-N	442.497	1.486	50	20	IDGD	
CCOc1ccccc1[C@H](CC(=O)NNC(=O)Cc1nc2ccccc2n1C)NC(C)=O	728264364	GQFHOVGOKCHHQD-SFHVURJKSA-N	437.500	1.929	50	20	IDGD	
Nc1nc(Cl)c(C=NNC(=O)c2cccc(OC(F)F)c2)c(N2CCOCC2)n1	728434270	FWEXCZLIWHXJOG-UHFFFAOYSA-N	426.811	1.914	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)CN2C(=O)NC3(CCCC3)C2=O)c1	728529459	YNKJXTXKGMJYDC-UHFFFAOYSA-N	439.266	1.083	50	20	IDGD	
CCOC(=O)C1=NN(c2ccccc2)[C@@H](C(=O)NNC(=O)CNc2ccc(OC)cc2)C1	728713562	WYJYJUOQZKPOIO-LJQANCHMSA-N	439.472	1.453	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)NCc2ccccc2S(=O)(=O)N2CCCCC2)c1	728943077	FTCOFPHFYQZBTA-UHFFFAOYSA-N	441.513	1.877	50	20	IDGD	
C[C@@H]1CN(C(=O)c2ccc(CNC(=O)NNC(=O)c3cccc(C#N)c3)cc2)C[C@@H](C)O1	728953618	SIJCSSLEFRZGMZ-HZPDHXFCSA-N	435.484	1.952	50	20	IDGD	
COc1cccc([C@H](CNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)N(C)C)c1	729045566	WQJKIJGGRWMQCF-IBGZPJMESA-N	441.536	1.335	50	20	IDGD	
Cn1cc(NS(=O)(=O)c2ccsc2C(=O)NNC(=O)CNc2ccccc2)cn1	729513894	XKYDSXNROBTDDG-UHFFFAOYSA-N	434.503	1.156	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCN(c2ccc3c(c2)OCCO3)C1=O)c1cccc([N+](=O)[O-])c1	730512461	QGSGZUDOAZJPIL-HNNXBMFYSA-N	426.385	1.180	50	20	IDGD	
Cc1nn([C@H]2CCS(=O)(=O)C2)c(C)c1C=NNC(=O)c1cnn(-c2ccccc2)c1	733078701	SKMNKUOILNRCGH-SFHVURJKSA-N	426.502	1.809	50	20	IDGD	
COc1ccc(S(=O)(=O)C[C@H](C)C(=O)NNC(=O)COc2ccccc2OC)cc1	735028222	JTLUQSLEUCCMCV-AWEZNQCLSA-N	436.486	1.340	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2ccc3ncsc3c2)CC1	735116826	HRTXITSULRPIQA-UHFFFAOYSA-N	432.531	1.384	50	20	IDGD	
CC(CS(=O)(=O)c1ccccc1)=NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	735408968	NQZXNHLRSSRAKE-UHFFFAOYSA-N	429.907	1.567	50	20	IDGD	
COc1ccc(C(=O)N2CCC(C(=O)NNC(=O)c3cnn(C)c3)CC2)c2ccccc12	735446027	POLWPVYVOOMILK-UHFFFAOYSA-N	435.484	1.895	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NC[C@@H](O)c1cc(Cl)cc(Cl)c1	735682293	GGAAOUNQRMWLAU-GFCCVEGCSA-N	431.301	1.849	50	20	IDGD	
O=C(CCNS(=O)(=O)c1cccc([N+](=O)[O-])c1)NNc1ncccc1C(F)(F)F	740090917	AINGQQJGZSFTDT-UHFFFAOYSA-N	433.368	1.820	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)[C@H]2CCCN(C(=O)COc3ccccc3)C2)cc1	741207064	OHKXQUNJBTZTTB-SFHVURJKSA-N	436.468	1.402	50	20	IDGD	
O=C(NNc1ccc(Cl)cc1Cl)C(=O)Nc1cnn(CC(=O)N2CCOCC2)c1	741703959	PGFRWTOTQLIFOO-UHFFFAOYSA-N	441.275	1.131	50	20	IDGD	
C[C@@H](CC(=O)NNc1ccccc1S(C)(=O)=O)/N=C1/NS(=O)(=O)c2ccccc21	743366767	AIYAYDBAHLREDJ-LBPRGKRZSA-N	436.515	1.051	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)CN2C(=O)N[C@]3(CCc4ccccc43)C2=O)cc1	743828461	MNMIFRNEJOVDAZ-QFIPXVFZSA-N	436.472	1.299	50	20	IDGD	
C[C@@H]1Cc2ccccc2N1CCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	744886823	HSRROGHJUMDSHJ-OAHLLOKOSA-N	445.545	1.332	50	20	IDGD	
COc1ccc(Br)c(C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)c1N	745289574	PISRZPLKBGPHHJ-UHFFFAOYSA-N	447.245	1.530	50	20	IDGD	
C[C@@H](O)CC(C)(C)CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	745846232	FDDYPGLIOSWSHQ-OAHLLOKOSA-N	440.566	1.602	50	20	IDGD	
O=C(NNC(=O)[C@@H](O)c1ccccc1)c1nn(Cc2ccccc2)c(=O)c2ccccc12	746094814	FJNPZJOMFAXHDN-NRFANRHFSA-N	428.448	1.939	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2ccc(-n3cnnn3)cc2)ccc1OC(C)C	747406617	FGPJWYFPERUVKF-UHFFFAOYSA-N	432.462	1.081	50	20	IDGD	
COc1ccc2c(c1)OC[C@H](C(=O)NNC(=O)c1sc(N3CCOCC3)nc1C)C2	747412552	TVUUSQFGQKYEMU-CQSZACIVSA-N	432.502	1.309	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NNC(=O)Cc1ccncc1	747491177	PXCFBOFPKSGFFZ-NSHDSACASA-N	436.266	1.216	50	20	IDGD	
C[C@@H](c1ccccc1)[C@](C)(O)C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	748620575	RCUHUJHFQKJFGW-JTSKRJEESA-N	446.573	1.621	50	20	IDGD	
NC(=O)CC[C@@H](C(=O)NNc1ccc([N+](=O)[O-])cc1Cl)N1C(=O)c2ccccc2C1=O	748711109	OXEILRALQZEWMM-HNNXBMFYSA-N	445.819	1.622	50	20	IDGD	
NC(=O)c1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)s1	749715102	FVAFVFHHZUTHDK-UHFFFAOYSA-N	436.515	1.096	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(CNC(=O)NNC(=O)CCc2ccccc2)cc1	749928520	YGTXTGDIJVCVSB-UHFFFAOYSA-N	434.518	1.075	50	20	IDGD	
O=C(CNC(=O)c1ccc(F)cc1F)NNc1nc(Br)cn2ccnc12	750247575	FEKQYVUWMHDDQX-UHFFFAOYSA-N	425.193	1.643	50	20	IDGD	
CC(C)(C)NC(=O)CN1CCC(CNC(=O)NNC(=O)CCCc2ccccc2)CC1	751112017	QUGWRJUIQUYPMR-UHFFFAOYSA-N	431.581	1.966	50	20	IDGD	
COC(=O)[C@H](C)NC(=O)/C(C#N)=C\c1cn(CCC(N)=O)nc1-c1ccc(OC)cc1	751315720	KWKHFHIWOXJNAV-OJNRTJSBSA-N	425.445	1.019	50	20	IDGD	
CCn1cc([C@@H]2C[S@](=O)CCN2C(=O)NNC(=O)c2c(C)nc3ccccn23)cn1	753030531	HXLJBKLLSXNWIH-INCQDFKNSA-N	429.506	1.019	50	20	IDGD	
CCOC(=O)c1ccc(N2CC(NC(=O)NNC(=O)CCCc3ccccc3)C2)nc1	753278161	BPBYILWVXHTMJA-UHFFFAOYSA-N	425.489	1.800	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)N[C@H]2CCN(Cc3ccc(C#N)cc3)C2=O)c1	753290678	DMSDLALHZPDIBH-IBGZPJMESA-N	437.456	1.321	50	20	IDGD	
O=C(NNc1ccc(-c2ccccc2)nn1)c1cc(S(=O)(=O)N2CCSCC2)c[nH]1	754471196	FPRNUHWKGYWSLX-UHFFFAOYSA-N	444.542	1.966	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)Cc2ccc([N+](=O)[O-])cc2Br)cc1	755036594	XEBOVAYSAUROKK-UHFFFAOYSA-N	433.218	1.998	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)Nc1ccc(S(=O)(=O)N2C[C@@H](C)C[C@H](C)C2)cc1	755420959	OSDOTXGMPCICCY-STQMWFEESA-N	434.522	1.851	50	20	IDGD	
CCn1ncc(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)c1-c1ccccc1	756797592	PXTOCPATQRYDTI-UHFFFAOYSA-N	447.904	1.946	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)NNC(=O)c2ccc3c(c2)OCO3)cc(S(C)(=O)=O)c1	757609058	KKTVHHYRAXOQQY-UHFFFAOYSA-N	449.441	1.462	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1ccc(Oc2ccc(C(C)(C)C)cc2)nc1	758041093	WLNXWPPKKQWMLV-ZDUSSCGKSA-N	434.518	1.870	50	20	IDGD	
CC(C)Cn1ncc(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)c1C(F)F	758075630	LHRNSMHLBKVNJY-UHFFFAOYSA-N	449.867	1.852	50	20	IDGD	
O=C(NNC(=O)c1nnn(-c2ccccc2F)c1C(F)(F)F)C(=O)Nc1ccccn1	758831536	BZROIUIMKOZJED-UHFFFAOYSA-N	437.313	1.220	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)NC[C@H](C)CC2(C)OCCO2)c2ccccc2c1=O	758852960	JRLOHBFMUUTXAG-CQSZACIVSA-N	431.493	1.711	50	20	IDGD	
C[C@H](NC(=O)OC(C)(C)C)[C@@H]1CCCN(C(=O)NNC(=O)CNC(=O)c2ccco2)C1	758861800	OCKQJDOUNGMDOX-UONOGXRCSA-N	437.497	1.375	50	20	IDGD	
O=C(NNC(=O)c1cc(N2CCCC2=O)ccc1Cl)c1csc(N2CCOCC2)n1	760264533	VMHCVSMCLMKLRA-UHFFFAOYSA-N	449.920	1.835	50	20	IDGD	
COc1cc(OC)c(Cn2nccc2NC(=O)C(=O)NNC(=O)C(C)(C)C)c(OC)c1	761064301	VRJWROBQODXCDW-UHFFFAOYSA-N	433.465	1.089	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2)c(C)c1S(=O)(=O)NC1CC1	763426024	PHTCESWLGLNTRD-UHFFFAOYSA-N	430.486	1.144	50	20	IDGD	
NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2Br)cc1Cl	763483505	VMJWVRBCVDRUFS-UHFFFAOYSA-N	439.653	1.601	50	20	IDGD	
Cc1cc(=O)n(C)cc1NC(=O)C(=O)NNC(=O)CCCOc1ccc(Cl)cc1C	763510861	SRFCGNFVJAMHKA-UHFFFAOYSA-N	434.880	1.601	50	20	IDGD	
CC(C)Oc1c(F)cc(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1F	763572570	SAVCTFACXDNWKY-INIZCTEOSA-N	435.383	1.678	50	20	IDGD	
C[C@H]1Oc2ccc(NC(=O)C(=O)NNC(=O)c3cc(-c4ccccc4)[nH]n3)cc2NC1=O	763605333	RHMPVSBIBXADAY-LLVKDONJSA-N	434.412	1.196	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc([S@@](C)=O)c(F)c2)c2ccccc2n1	763616027	SMGZSHRMUNVVQE-SSEXGKCCSA-N	428.445	1.819	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)C(=O)Nc1cccc(CN2CCCCC2=O)c1	763679316	KWPWRIVZYCVDPJ-UHFFFAOYSA-N	442.447	1.503	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccc(N2CCCCC2=O)c1	763711356	IJLOUKKSYADCBO-UHFFFAOYSA-N	438.484	1.931	50	20	IDGD	
Cn1c(C2CC2)nc2cc(NC(=O)C(=O)NNC(=O)CN3CCCc4ccccc43)ccc21	763728796	RDRHJXUZCKVMPJ-UHFFFAOYSA-N	446.511	1.989	50	20	IDGD	
O=C(NNC(=O)C12CC3CC(CC(C3)C1)C2)C(=O)Nc1ccc(NC(=O)C2CC2)nc1	763733799	GWLVFJXRKYZRDV-UHFFFAOYSA-N	425.489	1.732	50	20	IDGD	
Cn1ccnc1-c1cccc(NC(=O)C(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])c1	763802736	GKCARIPUGZXZLQ-UHFFFAOYSA-N	438.400	1.160	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccccc2-n2cccn2)cc1	763861386	OYQGXLIIJUVHGJ-HNNXBMFYSA-N	437.456	1.824	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1cccc(N2CCCCC2=O)c1	763864265	HRZYHYCUEBBISL-AWEZNQCLSA-N	442.447	1.896	50	20	IDGD	
COC(=O)c1cc(F)c(F)cc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccc(F)cc1	763864589	DDZYBNJXJISGBR-SECBINFHSA-N	439.346	1.444	50	20	IDGD	
CCN(CC)C(=O)c1ccccc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccc(F)cc1	763865040	HMMZKZNKHDAOIG-CQSZACIVSA-N	444.463	1.861	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1cccc(OC[C@H]2CCCO2)c1	763866398	PADQMOSUGUAMFI-AUUYWEPGSA-N	445.447	1.937	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccc(Cl)cc2)cc1N1CCOC1=O	763939026	BVAWREPQBSFVBS-UHFFFAOYSA-N	446.847	1.634	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)Nc1ccc(-c2ncco2)cc1	764001738	DSLWHABJLLHVPF-UHFFFAOYSA-N	432.234	1.842	50	20	IDGD	
CC(C)(C)NC(=O)c1ccccc1NC(=O)C(=O)NNC(=O)c1ccc2c(c1)OCCO2	764006055	JLTDQRDFUSDMRU-UHFFFAOYSA-N	440.456	1.386	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)C2CCCC2)n([C@H]2CCN(Cc3ccccc3)C2)n1	764078129	YSWKZUDEGBQLBV-IBGZPJMESA-N	438.532	1.915	50	20	IDGD	
CSc1cnn(-c2ccccc2)c1NC(=O)C(=O)NNC(=O)[C@H]1Cc2ccccc2O1	764162732	FLLMIXSHGDDLBQ-MRXNPFEDSA-N	437.481	1.684	50	20	IDGD	
CCCCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(C#N)cc2)cc1	764183352	WZLNTWXRBGTHGM-UHFFFAOYSA-N	443.485	1.500	50	20	IDGD	
CCN1CCN(c2ccc(Cl)cc2NC(=O)C(=O)NNC(=O)Cc2ccccn2)CC1	764264928	VJVIOGXVJKILAV-UHFFFAOYSA-N	444.923	1.206	50	20	IDGD	
CC1CCN(Cc2ccc(NC(=O)C(=O)NNC(=O)COc3ccccc3O)cc2)CC1	764277718	NGDDUYNHTPALGF-UHFFFAOYSA-N	440.500	1.789	50	20	IDGD	
COc1ccc(CN(C)C)cc1NC(=O)C(=O)NNC(=O)c1cnn(-c2ccccc2)c1	764350717	IWLVTRNDKCYYJR-UHFFFAOYSA-N	436.472	1.342	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)C(=O)Nc1cc(F)c(N2CCCC2)c(F)c1	764366463	BCKXXWRCEAIOOR-UHFFFAOYSA-N	432.427	1.868	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2cccs2)[nH]n1)C(=O)Nc1ccccc1N1CCOC1=O	764378004	UWNWXFWHOUMDPL-UHFFFAOYSA-N	440.441	1.495	50	20	IDGD	
CCN1CCc2ccc(NC(=O)C(=O)NNC(=O)c3cc(-c4ccc(F)cc4)[nH]n3)cc21	764388097	PUFMHPAQUVMUNS-UHFFFAOYSA-N	436.447	1.998	50	20	IDGD	
COC(=O)c1c(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)sc(C)c1C	764399942	BOBWIDNBJNTCBU-UHFFFAOYSA-N	437.499	1.735	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@]2(CCN(CC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)C2)C1	765032804	NHRCKSDILPTQOZ-OAQYLSRUSA-N	447.492	1.689	50	20	IDGD	
NC(=O)c1csc(C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)c1	766669107	MVNDHSGCZQNYRV-UHFFFAOYSA-N	435.937	1.079	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)[C@H]1CC(=O)N(c2ccc3c(c2)CCC3)C1	767279254	QDWCIRMRFQRCSU-FQEVSTJZSA-N	449.507	1.770	50	20	IDGD	
CC(=NNC(=O)Cc1cc(O)nc(O)n1)c1cc2c(cc1Br)NC(=O)CO2	767378057	DONUWYMBXDBKNG-UHFFFAOYSA-N	436.222	1.064	50	20	IDGD	
O=C(COC(=O)c1c[nH]nc1-c1c(F)cccc1F)NNC(=O)c1ccc([N+](=O)[O-])cc1	768141052	VIVXULRFZSAQIS-UHFFFAOYSA-N	445.338	1.881	50	20	IDGD	
CC(C)[C@H](NC(=O)OC(C)(C)C)C(=O)NCC(=O)NNC(=O)c1cccc2ncccc12	768391676	RZAYAWDTOQULQG-SFHVURJKSA-N	443.504	1.661	50	20	IDGD	
CO[C@@H](CNC(=O)OC(C)(C)C)CC(=O)NNc1nc(Br)cn2ccnc12	770034532	QUKNEHUZPBETCV-SNVBAGLBSA-N	443.302	1.865	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)CCNC(=O)NC34CC5CC(CC(C5)C3)C4)nc21	770979508	GCFAJHGRXWOEGF-UHFFFAOYSA-N	428.497	1.170	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@H](C(=O)O[C@@H](C)C(=O)NNC(=O)CC(C)C)C(C)C)cc1	771847621	UCOSKSTYNJIEBN-YJBOKZPZSA-N	441.550	1.423	50	20	IDGD	
CCc1nc2ccccc2n1C1CCN(C(=O)NNC(=O)CNC(=O)c2ccco2)CC1	771960063	YTPMOCZQIZRHTD-UHFFFAOYSA-N	438.488	1.999	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)c2cnn(CC(=O)NC3CCCC3)c2)cc1OC	772046678	LBQFYNNCXJENPC-UHFFFAOYSA-N	429.477	1.424	50	20	IDGD	
CC(C)Oc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)C(=O)NNc1cccc(C#N)c1	773688583	GHTGKGCAWVYHEO-UHFFFAOYSA-N	445.501	1.678	50	20	IDGD	
CCOC(=O)[C@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNc2nccnc2C(C)C)cc1	773992221	MPGOHNYFCCLHIA-ZDUSSCGKSA-N	442.476	1.363	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)Nc2ccc(S(=O)(=O)NC(C)(C)C)cn2)c1	776062327	FGCIUZQYYYKMSX-UHFFFAOYSA-N	435.506	1.699	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)c2ccc(F)c(S(=O)(=O)NC3CC3)c2)c1	776714581	IJUMOYMFGPEVQM-UHFFFAOYSA-N	427.479	1.427	50	20	IDGD	
COC(=O)N1CCC([C@@H](C)NC(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)CC1	777261742	LEQCAMZEFAYHCK-CYBMUJFWSA-N	442.542	1.261	50	20	IDGD	
COCCO[C@@H]1COCC[C@H]1NC(=O)NNC(=O)c1cc(C)n(-c2ccccc2)c1C	777275159	NMTKDSZQDCEVGB-WOJBJXKFSA-N	430.505	1.859	50	20	IDGD	
CC(=NNC(=O)CNC(=O)OC(C)(C)C)c1ccc(S(=O)(=O)N2CCOCC2)cc1	777904746	WVVZPBQLDHNMGW-UHFFFAOYSA-N	440.522	1.072	50	20	IDGD	
CN(CC(=O)NNC(=O)CNC(=O)OC(C)(C)C)C(=O)c1ccc(Br)s1	778436591	MHMZEOBACIPOHU-UHFFFAOYSA-N	449.327	1.255	50	20	IDGD	
C[C@H](C1CC1)n1cc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)cn1	778696743	AILWUGOEAKZCTP-SNVBAGLBSA-N	427.433	1.932	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1)c1ncn(C)n1	780703883	UUEGTBWZLXWOQD-UZLBHIALSA-N	433.516	1.834	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)c2cccc(S(=O)(=O)NC[C@@H]3CCCO3)c2)c1	780789623	IVOYAHFTHRXCHZ-KRWDZBQOSA-N	433.486	1.687	50	20	IDGD	
Cc1cnc(O)n1-c1ccccc1NC(=O)C(=O)NNC(=O)Cc1nc2ccccc2n1C	782894625	QXAHXUHTMUGNKP-UHFFFAOYSA-N	447.455	1.102	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2ccc(C(=O)N3C[C@H](C)O[C@H](C)C3)cc2)nc(C)n1	783324382	KEOXRESSCCILJM-OKILXGFUSA-N	426.477	1.425	50	20	IDGD	
Cc1ccccc1NC(=O)NNC(=O)C(=O)Nc1ccc(N2C[C@@H](C)O[C@H](C)C2)nc1	783416820	BGVZOSHMQLSBGQ-HUUCEWRRSA-N	426.477	1.795	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2ccccc2Nc2c(F)cccc2F)CCS(=O)(=O)C1	783427279	QZPHWXOYMZMQJX-LJQANCHMSA-N	438.456	1.845	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2ccc(N3CCCCCCC3)c(F)c2)CCS(=O)(=O)C1	783428464	VLTGFDAWDFCWIE-HXUWFJFHSA-N	440.541	1.733	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNc2ccc(Br)nc2)c(F)cc1F	784814936	XOGOVNPREJQKHT-UHFFFAOYSA-N	429.177	1.991	50	20	IDGD	
COC(=O)c1ccc(Cl)cc1NC(=O)C(=O)NNc1cccc(S(C)(=O)=O)c1	784842433	ZUCCOZRHLZMWQF-UHFFFAOYSA-N	425.850	1.612	50	20	IDGD	
CCCCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNc2ccnc(N(C)C)n2)cc1	784970475	HXPZMSLEAFXYNV-UHFFFAOYSA-N	435.510	1.166	50	20	IDGD	
COc1cc(OC)c(NC(=O)C(=O)NNc2ccnc(N(C)C)n2)cc1Br	784971304	YAGFXNJKGMHBCH-UHFFFAOYSA-N	439.270	1.404	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)cc1OCC(F)F	785023661	NLGQGDQCCYHBOV-UHFFFAOYSA-N	438.343	1.652	50	20	IDGD	
CN1CCN(Cc2cccc(NC(=O)C(=O)NNc3nc(C(F)(F)F)cs3)c2)CC1	785147492	KBOLTXNODLQJDW-UHFFFAOYSA-N	442.467	1.991	50	20	IDGD	
CON(C)S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccc(Cl)c(F)c2)cc1	785179178	VBZYNRXOGYZYTN-UHFFFAOYSA-N	430.845	1.743	50	20	IDGD	
COC(=O)c1ccc(F)c(NC(=O)C(=O)NNc2c(OC)cccc2S(C)(=O)=O)c1	785330477	IQOHVVPSTJKJMR-UHFFFAOYSA-N	439.421	1.106	50	20	IDGD	
COC(=O)c1csc(NC(=O)C(=O)NNc2c(OC)cccc2S(C)(=O)=O)c1C	785337240	FOMJYJWJFDBTDV-UHFFFAOYSA-N	441.487	1.337	50	20	IDGD	
CCN(C(=O)c1cc(NC(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)ccc1Cl)C(C)C	786471716	MWYHWMOJHCKRTQ-LLVKDONJSA-N	447.945	1.301	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CCC2CCCCC2)cc1C(=O)N1CCOCC1	787542292	JASYJICCFOGCCN-UHFFFAOYSA-N	444.532	1.914	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCCC(=O)NNc2cccc(F)c2[N+](=O)[O-])cc1	790585138	CDACRNURYWXOCF-UHFFFAOYSA-N	426.426	1.944	50	20	IDGD	
CN1CCC(Oc2ccc(CNC(=O)NNC(=O)CNC(=O)c3cccs3)cc2)CC1	790690762	FTYBZEXFZJXICW-UHFFFAOYSA-N	445.545	1.482	50	20	IDGD	
CNC(=O)c1cc2cc(NC(=O)C(=O)NNC(=O)Cc3ccc(Cl)cc3)ccc2[nH]1	792352068	AOGHJPDYJLTYEG-UHFFFAOYSA-N	427.848	1.510	50	20	IDGD	
O=C(NNC(=O)c1ccccc1)C(=O)Nc1ccc2c(c1)N(CC(F)F)C(=O)CS2	793017893	KMUNXIROMQAZHQ-UHFFFAOYSA-N	434.424	1.790	50	20	IDGD	
C[C@H]1Oc2ccccc2N(CCC(=O)NNc2ccccc2S(=O)(=O)N(C)C)C1=O	795168988	HOYVHWCQNGEZEF-CQSZACIVSA-N	432.502	1.584	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNc2ccc(-n3cccn3)nn2)c(OC)c(C)c1OC	797055142	SIQVOOLDDGFXPT-UHFFFAOYSA-N	427.421	1.078	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2nc3cc4c(cc3s2)OC(F)(F)O4)n1	797369943	BMQZQILRVWQHNV-UHFFFAOYSA-N	435.368	1.721	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2[nH]nnc2-c2ccccc2)c1	797701097	BHUVITRDKKLKPT-UHFFFAOYSA-N	442.501	1.577	50	20	IDGD	
CCn1ncc(NC(=O)C(=O)NNC(=O)c2ccc(OC)c(OC)c2)c1C(F)(F)F	799257340	IYXBGPOLKQRMFT-UHFFFAOYSA-N	429.355	1.339	50	20	IDGD	
C[C@@H](c1ccccc1)N(C)C(=O)CN(C)C(=O)NNC(=O)CNC(=O)c1cccs1	799912004	NZQCGTNCHDMSTQ-AWEZNQCLSA-N	431.518	1.370	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)N[C@H](C)CCNS(=O)(=O)c2ccccc2)cc1	801795836	FFYNSLLNXMVUKQ-MRXNPFEDSA-N	448.545	1.715	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@H](C(=O)NNC(=O)Nc2cc(F)cc(F)c2)[C@@H](C)O)cc1	802004315	MQUZXJRXQLZGPF-BZNIZROVSA-N	442.444	1.154	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)[C@H](CSC)N2C(=O)[C@@H]3CCCC[C@H]3C2=O)cc1	802063259	XHLRRLAVMNSFSF-OAGGEKHMSA-N	434.518	1.755	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2cccc(NC(=O)NC3CC3)c2)cc1	802064130	YGWNMZAPVSTPLC-UHFFFAOYSA-N	431.474	1.841	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@@H]2CCCN(C(=O)N3CCCC3)C2)cc1	802066246	RUKSNJLNQZGABL-CQSZACIVSA-N	437.522	1.171	50	20	IDGD	
CCS(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)c1	802066866	BUFOTRHTAOAITM-UHFFFAOYSA-N	443.478	1.489	50	20	IDGD	
O=C(COCc1ccccn1)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	805157115	MDRPLJNIGCUKTG-UHFFFAOYSA-N	446.510	1.922	50	20	IDGD	
O=C(NNc1nccnc1C1CCC1)[C@H]1CN(Cc2nc(O)c3ccccc3n2)CCO1	805463929	OEOUQHUTNOHGEV-QGZVFWFLSA-N	435.488	1.737	50	20	IDGD	
COCCn1cc(C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)c(=O)cc1C	806272666	IZMUHYHHTFMELW-UHFFFAOYSA-N	439.472	1.169	50	20	IDGD	
O=C1COC[C@@H](C[C@@H]2CN(C(=O)C(=O)NNc3cccc(F)c3F)c3ccccc32)N1	807017885	QOFXUVPLDORNTB-CHWSQXEVSA-N	430.411	1.443	50	20	IDGD	
CN1CCN(C(=O)NNC(=O)[C@@H]2CCCN(C(=O)c3ccccc3OC(F)F)C2)CC1	807380687	MFHOBECWMGAXLO-CQSZACIVSA-N	439.463	1.128	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NN=Cc1cc(Br)cc(Br)c1	807970647	RLKWPZODZXOJSO-SSDOTTSWSA-N	427.118	1.599	50	20	IDGD	
COC(=O)c1c(F)ccc(NC(=O)C(=O)NNC(=O)c2cn(C)c3ccccc23)c1F	810384591	NFUIUTXPHWWGKS-UHFFFAOYSA-N	430.367	1.643	50	20	IDGD	
COC(=O)Cc1occ(C)c1C(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	811032276	GELRKEOEYLLFJS-UHFFFAOYSA-N	438.481	1.553	50	20	IDGD	
COCCc1ccc(Oc2ccc(NC(=O)C(=O)NNC(=O)[C@H]3CCCO3)cc2)cc1	815779582	MBBXESDVXUVSJC-LJQANCHMSA-N	427.457	1.933	50	20	IDGD	
COC(=O)c1ccc(C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)[nH]1	815827388	XMDHHUHTMPNJJR-UHFFFAOYSA-N	433.896	1.034	50	20	IDGD	
Cc1oc(-c2cnn(C)c2)nc1C(=O)NNC(=O)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	816510551	YZCHQFMVMRUODI-CYBMUJFWSA-N	432.481	1.792	50	20	IDGD	
COc1ccc(NNC(=O)C2=NN([C@@H]3CCS(=O)(=O)C3)C(=O)CC2)c(C(F)(F)F)c1	816703925	ZDCVZBFYGYADGY-SNVBAGLBSA-N	448.423	1.323	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)CCNC(=O)c1n[nH]c2ccccc12	817054834	AHFJNDVTIWXRHQ-UHFFFAOYSA-N	430.490	1.076	50	20	IDGD	
CCOC(=O)c1c[nH]nc1S(=O)(=O)NNC(=O)c1cc2c(s1)CCCCCC2	818789488	YWGSDTKFTSOSTC-UHFFFAOYSA-N	426.520	1.930	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)[C@H]1CC(=O)N(c2ccc3c(c2)OCCO3)C1	825615174	LOAFTVNIPJKSPJ-AWEZNQCLSA-N	440.456	1.079	50	20	IDGD	
C[C@@H](Oc1ccc(Cl)cc1Br)C(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1	893188147	OUYSHLVKISLCFZ-BDAKNGLRSA-N	439.715	1.452	50	20	IDGD	
COCCOC(=O)c1c(C)[nH]c(C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)c1C	915637114	JIGLDNDUNLMMKE-UHFFFAOYSA-N	441.444	1.401	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCCN1S(=O)(=O)c1cccs1)c1ccc2c(c1)OCO2	915685159	YMFDTTRHVLQKOR-ZDUSSCGKSA-N	437.499	1.481	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)[C@H](Cc2cccc(F)c2)n2nnnc2C)c1	915695215	CMDWEIGLJZEYNR-IBGZPJMESA-N	426.452	1.748	50	20	IDGD	
CC(=NNC(=O)CNc1ccccc1)c1ccc(S(=O)(=O)NCCCC(=O)O)cc1	915918721	IEMQFZMCVCURJV-UHFFFAOYSA-N	432.502	1.782	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2oc(Br)cc2C)cc1	916112254	GAGSKGZVTYYGKH-UHFFFAOYSA-N	444.307	1.741	50	20	IDGD	
Cc1cccc([C@H](CNC(=O)NNC(=O)COc2ccc(C#N)cc2)N2CCOCC2)c1	916435862	PVCGTOQXXJAGPN-NRFANRHFSA-N	437.500	1.649	50	20	IDGD	
CCCC(=O)Nc1cccc(CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)c1	916514117	XNTPOZUYOQVZQD-UHFFFAOYSA-N	446.533	1.863	50	20	IDGD	
CC(=O)Nc1ccc(S[C@@H](C)C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1	917926293	VTINWRRBRNTJJW-LBPRGKRZSA-N	425.474	1.563	50	20	IDGD	
CCn1c(NNC(=O)[C@@H](Cc2cccc(OC)c2)n2nnnc2C)nc2ccccc2c1=O	918017332	STVKPHGDGRSYTO-LJQANCHMSA-N	448.487	1.647	50	20	IDGD	
CN(CCCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)c1ccccc1	919782324	PWORABJXBLTPGM-UHFFFAOYSA-N	447.561	1.798	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)[C@@H]2CS[C@@H](Cc3ccccc3F)C(=O)N2)cc1	920212648	FRSXQOLFAXJPBL-OALUTQOASA-N	445.516	1.757	50	20	IDGD	
COC(=O)c1cc(NC(=O)NNC(=O)c2cc(Br)c[nH]2)cc(C(=O)OC)c1	920933419	XMEUYVRDETXNHL-UHFFFAOYSA-N	439.222	1.817	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cccc4c3OCCO4)C2)C1	1777839932	IREBDXNXGKMGEQ-ORAYPTAESA-N	439.306	1.685	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H]2Cc3ccccc3O2)C1	1778840601	MQPGFTYWBLYQKZ-OSGXGRJZSA-N	436.936	1.758	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)CS[C@@H]3CCCCO3)C2)C1	1779084970	LBEPKOXRDQZFTM-LXZKKBNFSA-N	435.384	1.860	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)N1CCO[C@@]2(CCN(C(=O)CO[Si](C)(C)C)C2)C1	1779300176	PMYYOKTVTLJJFN-HXUWFJFHSA-N	443.617	1.583	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(-c4ccncc4)[nH]n3)C2)C1	1779593810	WFUQPAYLWHXWPD-YWZLYKJASA-N	433.896	1.169	50	20	IDGD	
CCc1cc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](Br)CC)CCO3)n(C)n1	1779625737	BOVJZELXGAWJBV-KSSFIOAISA-N	427.343	1.600	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](N)c1ccccn1)C2	1780713577	ZAIWCJOAZCJUOQ-WOUAJJJCSA-N	443.375	1.832	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)CN1CCCCC1=O)C2)[C@@H](F)Br	1780777518	VJASMNVYEYDOSD-MZMPZRCHSA-N	448.333	1.203	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2)c1cc(F)c(F)cc1F	1780891773	YWHQYDIXLRCYKZ-FRQCXROJSA-N	434.842	1.831	50	20	IDGD	
CC(=O)N[C@H](C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1)C(C)(C)C	1781324998	HKEMSIPWNFBRAT-IIYDPXPESA-N	436.322	1.058	50	20	IDGD	
O=C(c1ccn2ccnc2c1)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781332510	ZYZIWXGLBMDVRJ-PBHICJAKSA-N	425.258	1.468	50	20	IDGD	
COc1ccc(F)cc1CC(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781335419	YDRGGBYBJRDFSK-SJLPKXTDSA-N	447.276	1.897	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C=C(\C)NC(C)=O)C2	1781904919	FJEWZHKHVVOMQG-IISUWSKNSA-N	444.370	1.714	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc4cccnn4c3)C2)C1	1782381175	UAXAPOCMGQMXEG-KUHUBIRLSA-N	435.322	1.809	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)C[C@H](N)c3cccnc3)CCO2)C1	1783532432	HTAGVRCCXCRSEH-YEWWUXTCSA-N	425.327	1.085	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3nn(C)c4c3CCC4)CCO2)C1	1783533628	CHMAJKLJVNJOFN-SGTLLEGYSA-N	425.327	1.136	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)COc3ccc(O)cc3)[C@H]2C1	1783842721	MUXRWFZLJJAZMG-FDRFZEDHSA-N	445.343	1.987	50	20	IDGD	
O=C(c1cccc(N2CCOCC2)n1)N1CCO[C@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783945119	DJBKLNDCMYMCDG-IBGZPJMESA-N	443.331	1.165	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc(C(F)(F)F)cc3)C[C@@H]21)[C@@H](O)CCl	1784090254	VYVATDICGADCSI-HJWJTTGWSA-N	448.869	1.827	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3CCC(F)(F)CC3)[C@H]2C1	1784274808	KWIIGULOBHIBKZ-ULQDDVLXSA-N	444.523	1.165	50	20	IDGD	
CC(=O)N[C@H](Cc1cccc(F)c1)C(=O)N1CC[C@]2(CN(C(=O)[C@@H](F)Cl)CCO2)C1	1785454266	LTWUCUYUHPCHIR-MBOZVWFJSA-N	443.878	1.237	50	20	IDGD	
CCOc1cnc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)Br)C[C@@H]32)cn1	1785611276	WXRLSKVEHJWSGK-ABHRYQDASA-N	441.326	1.252	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)[C@@H]1CNc2ccccc21	1786876943	XZJDTXLBISLPQL-PRIPBFSGSA-N	440.313	1.866	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CC(F)(F)C(=O)O)[C@H]2C1	1787432782	PZNOSQYEQSBWCG-RHYQMDGZSA-N	441.269	1.107	50	20	IDGD	
CC(C)COc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](O)CCl)C[C@@H]32)ccn1	1787518513	CRCZXNHCWQXSMI-FJIDUMEYSA-N	439.940	1.309	50	20	IDGD	
CC(=O)NCC(=O)NC1(c2ccc(NC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)cc2)CCC1	1788649202	XOLIIWDHFYRELU-MZJWZYIUSA-N	438.488	1.391	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CSc3ccncc3)C[C@@H]21)[C@H](F)Br	1789922151	IBDXTRQUMBQMDH-PCBIJLKTSA-N	446.342	1.844	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3(F)CC3)[C@H]2C1	1790714940	NNACNOMGBGLOMZ-OWQGQXMQSA-N	449.435	1.616	50	20	IDGD	
CC(C)n1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](C)Br)[C@H]3C2)n1	1791059222	RRQCQOXQKDIONO-YXWQFLTLSA-N	427.343	1.841	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1ccc(C2(NC(=O)C[C@H]3NC(=O)NC3=O)CCC2)cc1	1791432335	VUWUZEPGZJZIGY-ZWNOBZJWSA-N	437.294	1.502	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3CCc4nc[nH]c4C3)[C@H]2C1	1791531442	UWXNEUKQSFDOQF-YBLKDPSYSA-N	443.375	1.731	50	20	IDGD	
Cc1nccn1[C@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21	1791704991	QNUNHYHYCSVIHA-QPGZIWCOSA-N	431.306	1.423	50	20	IDGD	
Cn1cc(CC(=O)Nc2ccc(C3(NC(=O)c4cnccc4C(=O)NN)CCC3)cc2)cn1	1791906054	YRMDNXFFENDIKD-UHFFFAOYSA-N	447.499	1.409	50	20	IDGD	
CC(C)N1CCC[C@H]1C(=O)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1	1792016193	BZQCZVBUQZSSHZ-QFIPXVFZSA-N	449.360	1.987	50	20	IDGD	
CCOC(=O)C(C)(C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21	1792226519	OWHOWKZBPKJQNL-IHRRRGAJSA-N	433.343	1.340	50	20	IDGD	
CC(C)Oc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](O)CCl)cc1Cl	1792980056	KLOASILPAMJCOY-KPEUIFRASA-N	445.343	1.930	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cccnc1Cl	1793954666	FXHFRBXIOMDRGV-DNVSUFBTSA-N	430.730	1.651	50	20	IDGD	
O=C(CCn1c(=O)oc2ccccc21)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2	1793985005	KXLMTWXVCAKPPO-CZAMWMTLSA-N	425.844	1.109	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)c1cccc(C(F)(F)F)n1	1796188876	WMLZGUJQRMBMKT-MUJYYYPQSA-N	447.222	1.346	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)[C@@H]1CCc2ccccc2C1	1796190015	GZPCLZHFECAWSQ-XBYSBRQOSA-N	432.329	1.423	50	20	IDGD	
Cc1nc2cc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3cccc(B(O)O)c3)ccc2s1	1796191369	DIQTYIZZJOPIMA-REPLKXPHSA-N	449.341	1.850	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Cl)C[C@@H]2C[C@@H]21	1796361194	KZFMWZDHUWULNS-NDTOZGPPSA-N	445.919	1.508	50	20	IDGD	
C[C@H](Nc1nccs1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Br)C2	1796418255	ZMGTUENPSSQXHQ-RXGFPQBGSA-N	431.356	1.317	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(-c2ccco2)no1)c1ccc(B(O)O)cc1	1796591274	UVEXSXNNNIXMOJ-BJWYYQGGSA-N	435.245	1.180	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)c1cc(Cl)sc1Cl	1798294463	ZOKKSYRKSVMAOJ-NUODRBITSA-N	427.737	1.858	50	20	IDGD	
COc1ccnc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C3)c1	1798785156	MLMIBZOAKVUBIQ-MVRRYPJTSA-N	438.488	1.476	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nn(C)c(C)c1Br)C2	1799269273	VWIVIPFKVFFVHL-GFQSEFKGSA-N	447.761	1.712	50	20	IDGD	
CN(C)c1cncc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@](C)(Cl)CCl)c1	1799277040	NUCPARWKYWVSRY-QHHYFVSCSA-N	429.348	1.587	50	20	IDGD	
C#CCCCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN(C)NC(=O)NCc1ccccc1	1799869100	DHPIXHMPXNJWQK-WKCHPHFGSA-N	439.560	1.774	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CCCOC1)C2	1800334342	OJXYJLCDQPFEHQ-LEDJYJADSA-N	445.466	1.888	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnoc1C1CC1)C2	1800639490	ZTQNAENCUQGERC-NEBZKDRISA-N	426.311	1.929	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccnc1OCC1CC1)C2	1800973500	BJUJWXCJEQZBAL-CYGHRXIMSA-N	437.924	1.327	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC2(CCCN(C(=O)[C@H]3CCC(F)(F)C3)C2)CC1	1804769498	MSAKZGKROFOYEC-KRWDZBQOSA-N	434.292	1.647	50	20	IDGD	
Cn1nc(C(=O)N2CC[C@H](CNC(=O)CO[Si](C)(C)C)[C@H]2c2cccnc2)cc1O	1810538907	AXCPBOAJVZFJLD-DNVCBOLYSA-N	431.569	1.692	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)Cn2ccncc2=O)[C@@H]1c1cccnc1	1812868738	LEHLSLKTFWFJJW-JCKWVBRZSA-N	448.321	1.128	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccccc2-n2nccn2)[nH]n1)[C@@H](O)CCl	1814873289	UKYDPPLPGKNCKT-SJORKVTESA-N	443.895	1.896	50	20	IDGD	
Cc1cnc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)s1	1815355472	SQEPPJOBXUVYGE-ZDUSSCGKSA-N	442.331	1.127	50	20	IDGD	
C[C@@H](C(=O)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1)n1cccc1	1815362000	XVJPOLXYAUPWMZ-XJKSGUPXSA-N	438.318	1.111	50	20	IDGD	
Cc1cnc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)[nH]n2)cn1	1816410082	MFWPCJHFVMDCMH-QGZVFWFLSA-N	449.475	1.126	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2sccc2F)[nH]n1)c1ccc(B(O)O)cc1	1817470511	TUTVMTFNZIRFQV-MRXNPFEDSA-N	442.281	1.910	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnc(O)nc2O)n[nH]1	1818021270	XHGKNDIRSSZMFM-CYBMUJFWSA-N	434.529	1.768	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(O)nc(O)n2)n[nH]1	1818031032	JIJCKVWYMUQVOE-ZDUSSCGKSA-N	434.529	1.768	50	20	IDGD	
COC(OC)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)n[nH]1	1818110377	CZLMFSMVMLEVIE-AQXNZCSYSA-N	445.480	1.155	50	20	IDGD	
CCOC(=O)N[C@H](O)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)C(C)(C)CCl)[nH]n1	1819238013	OXUIRWWFBAFVAE-SWLSCSKDSA-N	429.905	1.731	50	20	IDGD	
Cc1nc[nH]c1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819403085	USRZDRDBAYSKCW-HNNXBMFYSA-N	437.464	1.059	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)COC(=O)C(F)(F)F)sc2C1	1819616480	QYFVIHHSLUKXME-SFYZADRCSA-N	443.831	1.414	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(F)c[nH]1)CC2	1819800908	UYRCUVGPIWLQDG-SNVBAGLBSA-N	443.464	1.148	50	20	IDGD	
C[Si](C)(C)OCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(O)nc(O)n1)CC2	1820165017	PVQPYYYQOBANPU-VIFPVBQESA-N	437.554	1.422	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3n[nH]cc3[N+](=O)[O-])sc2C1	1820303689	YVPDTPFGOUFJNF-HTQZYQBOSA-N	428.858	1.254	50	20	IDGD	
CN(CC(=O)Nc1cc([C@@H]2CCCCN2C(=O)C(C)(C)CCl)[nH]n1)C(=O)C(=O)O	1821710720	WHCRAOLXJJYJPC-LBPRGKRZSA-N	427.889	1.210	50	20	IDGD	
O=C(Cc1ccc2ncnn2c1)N1CCC([C@H]2CCCCN2C(=O)[C@H](O)CCl)CC1	1824184424	MTPAKRSFDBKUSX-QZTJIDSGSA-N	433.940	1.491	50	20	IDGD	
CC(=O)N[C@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@H](O)CCl)CC1)C(C)(C)C	1824359057	YHZHQWUZXJYYAN-RCCFBDPRSA-N	429.989	1.757	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)Cn2cc([N+](=O)[O-])cn2)CC1	1825128189	DBVUSRKGTCIYJD-IAGOWNOFSA-N	441.916	1.665	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CN1CCSCC1)CC2	1825991448	KSFFRRZCQLUNIS-NEPJUHHUSA-N	432.999	1.358	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc3c(c1)CNC3=O)CC2	1826000227	OTZKQEKAFQFOHR-JSGCOSHPSA-N	448.932	1.866	50	20	IDGD	
CC(C)[C@@H](S)C(=O)N[C@@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1	1826083944	VTHSBFDPVRQHCR-BDJLRTHQSA-N	427.596	1.383	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1CCc2nc(NC(=O)C(Cl)Cl)sc2C1	1826099785	QXCVSDLDJMKIKD-SSDOTTSWSA-N	443.316	1.171	50	20	IDGD	
Cc1cc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)cnc1C	1827049995	CTMRFNVSLOLVJB-QHCPKHFHSA-N	449.360	1.925	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(O)cc2)CC1	1830041811	RWOOUIQERLKLID-QFIPXVFZSA-N	436.317	1.619	50	20	IDGD	
CC(=O)N1CCC([C@H]2CCCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)CC1	1830165920	NWGMDIHCKQONSO-OAQYLSRUSA-N	429.565	1.972	50	20	IDGD	
Cc1ocnc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)CBr)CCO2	1830543553	UBNZAJCPPAMITC-PXAZEXFGSA-N	430.299	1.084	50	20	IDGD	
O=C(CCBr)N1CCC([C@H]2CCCCN2C(=O)[C@H]2CCCS2(=O)=O)CC1	1831280924	DGJJZMMNFFWXGE-HZPDHXFCSA-N	449.411	1.968	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1831654968	ZISLLDJTZYUHFI-ZOWXZIJZSA-N	429.714	1.541	50	20	IDGD	
CC[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)Br)C2)C1)N(CC)CC	1831674126	CTHXDJJMMGMQLN-FCEWJHQRSA-N	448.402	1.347	50	20	IDGD	
Cc1noc(C)c1CC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)Br)C2)C1	1832561048	KJWQAJVCRPHHGM-KPZWWZAWSA-N	444.326	1.074	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3cccnc3OC)CCO2)C1	1833003750	SCMANDWBVOSCDS-LAUBAEHRSA-N	439.940	1.497	50	20	IDGD	
COc1cc(C(=O)N2CCC(N3CCC(NC(=O)C(C)(C)CCl)CC3)CC2)n(C)n1	1833212188	OYNDICAOZHFWAC-UHFFFAOYSA-N	439.988	1.879	50	20	IDGD	
CC(C)(CCl)C(=O)NC1CCN(C2CCN(C(=O)C[C@@](C)(O)CC(=O)O)CC2)CC1	1833216076	SOEVGWOVMDFKLD-OAQYLSRUSA-N	445.988	1.439	50	20	IDGD	
CC[C@H](C)[C@H](N)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](C)CBr)CC2)CC1	1833261963	FGXGSSCPNJPHIY-MPGHIAIKSA-N	445.446	1.962	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)C(=O)C3CC3)CC2)CC1	1833277399	NCOYWKYOVOYXQW-ZDUSSCGKSA-N	428.371	1.568	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3ccnc(F)c3)CC2)CC1	1833589635	NRGFALVNPFSTJJ-QGZVFWFLSA-N	426.920	1.660	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)CCC(=O)N3CCCC3)CC2)CC1	1833699455	NFTXIXOWECGDAY-LJQANCHMSA-N	441.016	1.978	50	20	IDGD	
Cc1noc(C)c1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1834068689	IHWUBTJWAQGOLM-CJNGLKHVSA-N	434.262	1.052	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)N2CCC(N3CCC(NC(=O)[C@@H](F)Cl)CC3)CC2)n1	1835078771	WIMUJYDAAHZFOJ-GOSISDBHSA-N	439.919	1.760	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)COc3ccccc3C)CCO2)C1	1835155413	PUQQGFHFDQYUME-LAUBAEHRSA-N	440.924	1.084	50	20	IDGD	
O=C(CCc1ccccc1Cl)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1	1835173076	OSVFOCGMJCKEMP-XLIONFOSSA-N	445.343	1.329	50	20	IDGD	
C[C@@H](Nc1ccccc1)C(=O)NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1835692765	VJNAQMJWGXEOSN-OXQOHEQNSA-N	436.984	1.658	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)C[C@@H](N)c3cccnc3)CCO2)C1	1835824020	HDZXYZSHIIVHRF-UEXGIBASSA-N	438.956	1.335	50	20	IDGD	
Cc1noc(CC(=O)N2CCC(N3CCC(NC(=O)[C@](C)(Cl)CCl)CC3)CC2)n1	1836398200	BWPFMUXGGSDQPR-LJQANCHMSA-N	446.379	1.728	50	20	IDGD	
O=C(CS[C@H]1CCCCO1)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1837510636	OXLSKRHUXVEQBJ-YOEHRIQHSA-N	441.377	1.506	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](C)CBr)C3)C2)ccn1	1837934809	NLGSGPRPGLGYJD-IFXJQAMLSA-N	440.338	1.491	50	20	IDGD	
CC(C)c1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)on1	1838777630	QYXBSFSVJHKLBA-YOEHRIQHSA-N	448.289	1.559	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)c3ccc(OC)cc3)C2)C1	1839141648	OMMGMBREZHNQBL-WAOWUJCRSA-N	440.924	1.202	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3ncccc3OC)C2)C1	1839142094	DSXLBJHGRQAPIS-IIBYNOLFSA-N	439.940	1.497	50	20	IDGD	
CSCC(C)(C)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](F)Br)CCO2)C1	1839198548	HWAOUORUDKDGDH-BLLLJJGKSA-N	441.363	1.523	50	20	IDGD	
Cc1cccc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)c1	1839199629	RCTPGQLOEPTZJJ-PKOBYXMFSA-N	443.313	1.684	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3nc4ccccc4o3)CCO2)C1	1839503829	ZGDXEEBRICBIKT-VBKZILBWSA-N	437.880	1.152	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CC(F)(F)F)C2)C1	1839963308	HLMMIPHVXBUBIM-SMDDNHRTSA-N	431.249	1.569	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(O)cn3)C2)C1	1839963723	UBMCNQYWAZNVRG-KSSFIOAISA-N	442.310	1.031	50	20	IDGD	
C#CCCCCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)CBr)C2)C1	1840291542	USQVSQOFAKBYME-QFBILLFUSA-N	429.355	1.667	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)[C@@H]2CCc3ccoc3C2)C1	1841450173	NXTFVAWFLYMCDU-SCELWYEFSA-N	437.500	1.722	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)C[C@H]2OCCc3ccccc32)C1	1841555214	ZIWZWVKXSOEZJI-LJQANCHMSA-N	428.533	1.267	50	20	IDGD	
O=C(C1CCC(C(F)(F)F)CC1)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843010598	IXJXPHVVSOQFLD-UHFFFAOYSA-N	438.255	1.552	50	20	IDGD	
O=C(CCc1ccccc1Cl)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843013353	KMRIHFAWOWQVTN-UHFFFAOYSA-N	426.709	1.470	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)CSc1ccncc1)C2	1843415295	JENOISZIBPYTKO-BUVRLJJBSA-N	440.529	1.511	50	20	IDGD	
Cc1ccc2oc(C(=O)N3CC4(CCCN4C(=O)c4cnccc4C(=O)NN)C3)cc2n1	1844263938	NCDOZGKRERDGAZ-UHFFFAOYSA-N	434.456	1.266	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)C(F)(F)c2ccco2)C1	1845794392	UOVQXWBYFAWVIY-ZMOGYAJESA-N	433.415	1.709	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCCC12CN(C(=O)[C@H](O)NC(=O)OC(C)(C)C)C2	1846071932	WCQXJODHEDBIQA-NEPJUHHUSA-N	434.331	1.206	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC[C@H]2[C@@H]1CCN2C(=O)c1ccccc1OC(F)(F)F	1847366640	XOAHGOHFBZFIIL-IRXDYDNUSA-N	448.206	1.394	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CCNC(=O)c1ccc[nH]1	1848179224	FLWDSHZAVGCUMN-QEJZJMRPSA-N	425.327	1.510	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)c1nn(-c2ccccc2F)c(C)cc1=O	15430054	DSYHEUMUCUJDTA-UHFFFAOYSA-N	426.404	1.529	50	20	IDGD	
CC(C)n1nc(C(=O)NNS(=O)(=O)c2ccc(F)c(C(=O)O)c2)c2ccccc2c1=O	16095391	FJVKPHJAVKNARE-UHFFFAOYSA-N	448.432	1.438	50	20	IDGD	
COc1ccc(C)cc1N1C[C@H](C(=O)NNC(=O)Cc2nc3ccccc3n2C)CC1=O	16179056	IYNPUKYDPVEQQU-OAHLLOKOSA-N	435.484	1.633	50	20	IDGD	
Cn1c(N)c(C(=O)/C(C#N)=C/c2ccc(Br)c([N+](=O)[O-])c2)c(=O)n(C)c1=O	16881401	BXPISHGXRULEKA-WEVVVXLNSA-N	434.206	1.127	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)[C@H]2CC(=O)N(Cc3ccco3)C2)c2ccccc2c1=O	28580715	ZFAQECVPHZXHRH-AWEZNQCLSA-N	437.456	1.380	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)CCc2nc(-c3ccc(Cl)cc3)no2)C[C@@H](C)O1	726164411	QMFYVPNPUFSHEO-OKILXGFUSA-N	435.912	1.969	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)NS(=O)(=O)c2ccc(Cl)cc2)cc1	726276581	WNHPZDUMHALVNI-LBPRGKRZSA-N	438.893	1.101	50	20	IDGD	
CCCCC(=O)N1CSC[C@@H]1C(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12	728018910	WSECUXPVYCASOW-MRXNPFEDSA-N	445.545	1.830	50	20	IDGD	
Cc1cc(C(=O)O)c(O)c(S(=O)(=O)NNC(=O)c2cc(F)ccc2Br)c1	728510443	YXZOVIZHHZSYAD-UHFFFAOYSA-N	447.238	1.924	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2ccc(CN3CCCCC3)cc2)n1	728720477	DXQGDXPEYAMZOO-UHFFFAOYSA-N	430.530	1.984	50	20	IDGD	
C#Cc1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)nc1	728855881	WORXCLFUQLJRAK-UHFFFAOYSA-N	434.477	1.616	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)NNC(=S)Nc2ccc(N(C)C)cc2)ccc1OC	729689439	KLKXJKRICOOSJH-UHFFFAOYSA-N	437.547	1.301	50	20	IDGD	
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)COc1ccccc1O	730779489	BCHMKOZMLUOTGO-GOSISDBHSA-N	438.484	1.783	50	20	IDGD	
Cc1cccc(N2C(=O)N[C@@H](CCC(=O)OCC(=O)NNC(=O)c3cccs3)C2=O)c1	730864098	ICCBWJXTDVJMFT-AWEZNQCLSA-N	444.469	1.266	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)CNC(=O)c1c(Cl)cccc1[N+](=O)[O-]	731050412	JXOSGPHUJCTGPN-UHFFFAOYSA-N	436.808	1.213	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCCC2)cc1)NNC(=O)Cc1ccccc1F	731330243	GHESOIZGLKMLMT-UHFFFAOYSA-N	433.505	1.933	50	20	IDGD	
COCCCn1c(S)nc2cc(C(=O)NNC(=O)Cc3ccccc3F)ccc2c1=O	731344765	HPWBMVGDGLIUMJ-UHFFFAOYSA-N	444.488	1.865	50	20	IDGD	
O=C(NCCS(=O)(=O)Cc1ccccc1)NNC(=O)c1cnn(-c2ccccc2)c1	733343552	WJSHRQZAKCGQMU-UHFFFAOYSA-N	427.486	1.431	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)N[C@H]2CCC[C@@H](C(=O)N(C)C)C2)nc1	734223123	YFENSWVWNGHIJE-KGLIPLIRSA-N	426.543	1.041	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)CN1C(=O)NC2(CCCC2)C1=O	734251048	WDIXSUXROKPAPB-UHFFFAOYSA-N	437.522	1.071	50	20	IDGD	
CS(=O)(=O)N1CCCC[C@H]1C(=O)NNc1cc(C(F)(F)F)nc(-c2cccnc2)n1	734257796	QCRGOZUSMLQWDB-LBPRGKRZSA-N	444.439	1.815	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)Sc1nnc(COc2c(Cl)cccc2Cl)n1N	735414681	QXDGJDWSIWHBPT-QMMMGPOBSA-N	433.321	1.916	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)N[C@H]2CCN(c3cnn(C)c3)C2=O)cc1OC	735583682	AVALANYQSRCXIY-INIZCTEOSA-N	444.492	1.357	50	20	IDGD	
Cn1cc(N2CC[C@H](NC(=O)NNC(=O)c3cc4c(s3)CCCCCC4)C2=O)cn1	735583782	FDRMIXGROZVKMV-HNNXBMFYSA-N	430.534	1.890	50	20	IDGD	
CC[C@@H](Nc1c([N+](=O)[O-])c(C)nn1C)C(=O)NNc1nc2ccccc2c(=O)n1CC	735880247	PIVVIGLNUMGFGP-CYBMUJFWSA-N	428.453	1.700	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)N[C@H](C)[C@@H]2CN(Cc3ccccc3)CCO2)c1	741268241	WCWISMRKFPUVCH-NQIIRXRSSA-N	426.517	1.994	50	20	IDGD	
C[C@H](CC(=O)c1cccc(Br)c1)C(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1	741662941	UKXOGHMJKOSXHI-PWSUYJOCSA-N	431.308	1.240	50	20	IDGD	
O=S(=O)(Cc1ccon1)N1CCN(S(=O)(=O)c2ccc(CCCCl)cc2)CC1	742335194	YKRSHAYWEGBOJQ-UHFFFAOYSA-N	447.966	1.682	50	20	IDGD	
COCCn1cc(C=NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)cn1	743423964	YWDORDSMWGLMCE-UHFFFAOYSA-N	430.472	1.995	50	20	IDGD	
CCO[C@@H](C)c1noc(CN2CCN(C(=O)NNC(=O)c3ccc(C#N)cc3)CC2)n1	743567954	DBFCFPZFQXKOKW-AWEZNQCLSA-N	427.465	1.211	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)CN2CCN(Cc3nc4ccccc4s3)CC2)cc1	744383679	WVCBXJCDSGOHRB-UHFFFAOYSA-N	434.525	1.747	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN2CCCC[C@@H]2CCNS(C)(=O)=O)cc1C	744389079	IIYAAFAXZRXADL-CQSZACIVSA-N	430.596	1.174	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1cnn(-c2ccc(F)cc2)n1	744619939	ASKZZOFPKLUMGH-UHFFFAOYSA-N	446.464	1.184	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)CNc2cccc(C(F)(F)F)c2)n1	745012500	PQDMPASIRBPTJI-UHFFFAOYSA-N	430.408	1.816	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)N[C@@H](Cc1ccccc1)CN1CCOCC1	745815138	DVYYJHIXUYNTBD-INIZCTEOSA-N	443.460	1.188	50	20	IDGD	
O=C(NNS(=O)(=O)c1cccc(I)c1)c1ccc(Cl)nc1	747607776	YLGJTGCMTCDJRG-UHFFFAOYSA-N	437.646	1.963	50	20	IDGD	
Cn1ccnc(NNC(=O)Cc2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2)c1=O	747937732	MHJZZTGHYXDVRB-UHFFFAOYSA-N	431.449	1.406	50	20	IDGD	
Cc1nc(C)c(S(=O)(=O)NNC(=O)c2ccc(CSc3nncn3C)cc2)s1	748674343	QPAJEQZYHYCQBQ-UHFFFAOYSA-N	438.560	1.804	50	20	IDGD	
CN(C)S(=O)(=O)c1ccsc1C(=O)NNc1c(F)cc(C(=O)NC2CC2)cc1F	748827330	HFCUQHYQZRHSDG-UHFFFAOYSA-N	444.485	1.926	50	20	IDGD	
Cc1nn(C)c(C)c1-c1cc(C(=O)NNc2nc(Br)cn3ccnc23)n[nH]1	750247703	RVNYLGBMPKXJGX-UHFFFAOYSA-N	430.270	1.989	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNS(=O)(=O)c1cnn([C@@H]2CCOC2)c1	751537918	DVMPTNOZGGQHQH-RHSMWYFYSA-N	430.486	1.775	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NCc2nccn2CCc2ccccc2)c2ccccc2c1=O	751810967	XWIQNLPPJKGZSC-UHFFFAOYSA-N	445.483	1.517	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)N[C@@H]1CCCN(Cc2ccccn2)C1=O	753299307	QKPDGYKFFZBLPM-WMLDXEAASA-N	429.452	1.510	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NC(=O)NNC(=O)COc2ccccc2C#N)cc1	755361669	WZFQEDLDAGCKCA-UHFFFAOYSA-N	445.501	1.820	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)Nc1ccc(S(=O)(=O)NC2=NCCCCC2)cc1	755501832	YAWVNHPPLJQPAA-UHFFFAOYSA-N	444.517	1.728	50	20	IDGD	
CN1CCN(C(=O)c2ccccc2NC(=O)NNC(=O)Cn2ccc3ccccc32)CC1	755622853	MHSFFEFUMAZGGR-UHFFFAOYSA-N	434.500	1.882	50	20	IDGD	
Cc1nc(N2CCOCC2)nc(O)c1CCC(=O)NNc1nc(C(F)(F)F)cs1	755856416	VHYNSEGUZZVFGP-UHFFFAOYSA-N	432.428	1.878	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)Nc1ccc(N2CCN(C(=O)C3CC3)CC2)nc1	756295959	VGXZPNZDGIKQHN-UHFFFAOYSA-N	440.479	1.675	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)Nc1cccn(Cc2ccccc2)c1=O	757654375	AZPXHPZHMZRNFR-UHFFFAOYSA-N	430.428	1.339	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)Nc1ccc(S(=O)(=O)N(C)C)c(OC)c1	757776561	RUJFFYCTASMHOE-UHFFFAOYSA-N	436.490	1.350	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H](C#N)[C@@H](NC(=O)NNC(=O)c2cc(Br)c[nH]2)C1	758780260	ZSRCMAFUBXRAEL-CABZTGNLSA-N	441.286	1.480	50	20	IDGD	
CC(C)NC(=O)N1CCC[C@H]1C(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758785205	CNPIMGHDWKIRSX-HNNXBMFYSA-N	440.545	1.205	50	20	IDGD	
CC(C)C[C@@H](CCC(=O)NNC(=O)c1cccn1C)C(=O)NNC(=O)c1cccn1C	759112351	YVVGDLMKAZWABS-OAHLLOKOSA-N	430.509	1.028	50	20	IDGD	
CC[C@H](NC(=O)NNC(=O)CNC(=O)c1ccco1)[C@@H]1CN(Cc2ccccc2)CCO1	760751387	NASAPIYQDHAYKV-HKUYNNGSSA-N	443.504	1.019	50	20	IDGD	
CCCS(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)c2ncccc2C)c(OC)c1	761270063	BBOVIUNVCGJBAM-UHFFFAOYSA-N	442.519	1.174	50	20	IDGD	
N#Cc1cccc([C@@H]2CN(C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)CCO2)c1	762413687	COSGXNOISLQFDJ-IBGZPJMESA-N	435.488	1.379	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)N2CCC[C@@H](n3cc(C(=O)OC)nn3)C2)c1C	762728536	PLYYHDFACXVDHV-WAGPWIPHSA-N	440.504	1.900	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)c2cccc(CN3CCS(=O)(=O)CC3)c2)n1	762912577	FJAKQAOYIDQQOS-UHFFFAOYSA-N	432.550	1.310	50	20	IDGD	
CCCN1C(=O)CCc2cc(NC(=O)C(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)ccc21	763446309	QRYUDZIAWJLFFX-UHFFFAOYSA-N	439.428	1.684	50	20	IDGD	
O=C(NNC(=O)c1ccccc1Br)C(=O)Nc1ccc(-n2ccnn2)cc1	763483399	RBUCVXZIJZPGBA-UHFFFAOYSA-N	429.234	1.430	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(C(=O)NC(C)(C)C)c2)cc1OC	763550133	HARTXDOZQAWQTE-UHFFFAOYSA-N	442.472	1.632	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)cc(OC)c1OC	763611663	BVEZEGAACNRAGI-UHFFFAOYSA-N	439.428	1.502	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(-c3n[nH]c(C4CC4)n3)cc2)cc1	763682004	ZNZZKKUNZZLFSR-UHFFFAOYSA-N	445.439	1.386	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)n(C2CCOCC2)n1	763734989	OQDOFMGMVIVBAM-UHFFFAOYSA-N	440.504	1.082	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(CN3CCOC3=O)cc2)c1	763759823	COVBBBIGTMVILF-UHFFFAOYSA-N	425.445	1.105	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)c(OC)cc1Cl	763814171	QRIVNXPUJABQSQ-UHFFFAOYSA-N	432.820	1.394	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc([S@@](=O)C(F)(F)F)cc2)cc1	763820328	FQDBWXITBTWLLW-SSEXGKCCSA-N	443.403	1.787	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(N3CCOC3=O)cc2)c1C	763839968	HIWFRRVTAVKTIR-HNNXBMFYSA-N	440.456	1.813	50	20	IDGD	
CO[C@H](C)C(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)Cc2c[nH]c3ccccc23)c1	763860598	KAWZFEQSTNLNLX-CYBMUJFWSA-N	437.456	1.470	50	20	IDGD	
CCCc1c(NC(=O)C(=O)NNC(=O)Cn2nc(C)cc2C)cnn1-c1cccc(F)c1	763892263	DNRHZAKORRRXII-UHFFFAOYSA-N	441.467	1.563	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1cccc(CN2CCCCC2=O)c1	764133507	VPLNNUPVENMSDU-UHFFFAOYSA-N	438.484	1.536	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(NC(=O)OC)cc2)o1	764139525	WQRHKQWWFDWIRZ-UHFFFAOYSA-N	431.449	1.699	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1cccc2c1CN(c1ccccn1)C2	764274738	CIHLLNICOGKDLN-UHFFFAOYSA-N	447.451	1.472	50	20	IDGD	
O=C1Cc2cc(NC(=O)C(=O)NNC(=O)c3cc(Br)ccc3O)ccc2N1	764279091	YGPKBWONSGEMSZ-UHFFFAOYSA-N	433.218	1.049	50	20	IDGD	
Cc1cc(C(=O)N2CCCC2)ccc1NC(=O)C(=O)NNC(=O)CCc1ccccc1O	764281170	KPFBYUAOHVQWOZ-UHFFFAOYSA-N	438.484	1.655	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C(=O)Nc1ccc(CCN2CCOCC2)cc1)c1ccccc1	764328353	PHSWFKAXBJTUIN-NRFANRHFSA-N	438.528	1.841	50	20	IDGD	
CN1CC(=O)N(c2cccc(NC(=O)C(=O)NNC(=O)CCCc3cccs3)c2)C1=O	764339188	GCHWFQAAHOQMAV-UHFFFAOYSA-N	443.485	1.255	50	20	IDGD	
O=C(CCc1nnc(-c2cc3ccccc3o2)o1)NNC(=O)CNC(=O)c1cccnc1	764343353	PEVMTBLUGRTCKU-UHFFFAOYSA-N	434.412	1.388	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)cc1	764378439	ZWNBYLNRGZTYLD-UHFFFAOYSA-N	429.458	1.563	50	20	IDGD	
CC(C)(C)n1cc(C#N)c(NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)n1	764381973	FDCPEHNIMPNEHL-UHFFFAOYSA-N	426.462	1.361	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1c(C)cnn1[C@@H]1CCCc2ccccc21	764400241	OXFNIHJGBBHLBN-CRAIPNDOSA-N	443.504	1.255	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CC[C@H](N2CCN(C)CC2)[C@H](C)C1	764470017	RYYWVQNWXRUGQU-QAPCUYQASA-N	437.972	1.067	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H]2CCO[C@H](C(C)(C)C)C2)c1	764512264	ITKDGCYREXHQCR-ZBFHGGJFSA-N	426.539	1.475	50	20	IDGD	
CC(=NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C)c1ccc(SC(C)C)cc1	764817434	PJFGURAVCBNHTB-UHFFFAOYSA-N	428.518	1.475	50	20	IDGD	
N#Cc1ccc(S(=O)(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)cc1	765118379	CDXWKAHJZLRODD-UHFFFAOYSA-N	447.948	1.339	50	20	IDGD	
COc1cccc(/C=C(\C(=O)NNC(=O)CSc2ccccc2O)n2nnnc2C)c1	765247810	BMUWRVLLUPYVBW-LFIBNONCSA-N	440.485	1.634	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)c3cc(S(N)(=O)=O)ccc3F)n[nH]2)cc1	765577608	YUVCWLXDCXUVQV-UHFFFAOYSA-N	431.449	1.500	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)c2cccc(C#N)c2)cc1F	765644192	PHEXRGWIMPSKLV-UHFFFAOYSA-N	426.451	1.082	50	20	IDGD	
CCN1C(=O)c2ccc(C(=O)NNC(=O)c3cc(-c4cccs4)[nH]n3)cc2S1(=O)=O	768263742	YQEAYGIZDDQKPL-UHFFFAOYSA-N	445.482	1.377	50	20	IDGD	
CC(C)O[C@H]1C[C@@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)C1(C)C	768448577	MRIIUCAFQKCSSO-CVEARBPZSA-N	426.539	1.473	50	20	IDGD	
CSCC[C@H](NC(=O)c1ccccc1Cl)C(=O)NNc1nc(O)c2cnn(C)c2n1	770972196	FYOWDSWITSZJNP-ZDUSSCGKSA-N	449.924	1.717	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccccc1	771848555	BTUFBXLGPKOCPO-WBVHZDCISA-N	439.534	1.355	50	20	IDGD	
Cc1ccc(C(=O)N[C@H](C(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)C(C)C)cc1	772188836	YWYKVKHSPAMUGY-SFHVURJKSA-N	444.919	1.867	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)c1cc(O)nc2ccc([N+](=O)[O-])cc12	772897807	MQIJAMXZTMEXGF-UHFFFAOYSA-N	443.803	1.579	50	20	IDGD	
Cc1cn(-c2ccc(C#N)cn2)nc1NC(=O)C(=O)NNc1ccc(C(F)(F)F)cn1	773668840	BQEGAFXNVAAQJP-UHFFFAOYSA-N	430.350	1.943	50	20	IDGD	
COC[C@H](NC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)c1ccc(F)c(F)c1	773787311	SAMJBGOYNDGBRN-INIZCTEOSA-N	427.429	1.700	50	20	IDGD	
CC(C)c1nccnc1NNC(=O)C(=O)Nc1cccc(CS(=O)(=O)NC(C)(C)C)c1	773992713	KPRYRNAGIPIIRS-UHFFFAOYSA-N	448.549	1.900	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)c2ccc(C(N)=O)c(Cl)n2)c2ccccc2c1=O	774322642	NGTLDNKTIIHJPP-UHFFFAOYSA-N	428.836	1.200	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)[C@@H]1CCc2c(Cl)cccc21	775780542	OAWCEWKCZGVXIA-LJQANCHMSA-N	440.931	1.975	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN([C@@H]2CCCN(C(=O)NNC(=O)C(C)(C)C)C2)C(=O)C1	776878379	XYBNHVAGCMAGAW-CQSZACIVSA-N	425.530	1.317	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)c1ccc(Cl)c(Cl)c1)C(=O)NN(C)C(N)=O	778417857	GMBHXSMQSOZILS-NSHDSACASA-N	429.351	1.435	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCC(=O)NNc2cc(Cl)ccn2)cc1OCC	778452928	FBWIHGDIJKJFJN-UHFFFAOYSA-N	428.898	1.954	50	20	IDGD	
COC[C@H](C)n1ccc(NC(=O)C(=O)NNC(=O)c2cc(F)ccc2Br)n1	778709890	KCCIGRWGLRIHNC-VIFPVBQESA-N	442.245	1.392	50	20	IDGD	
COCC(=O)N1CCc2cc(NC(=O)C(=O)NNC(=O)C(C)(C)c3ccccc3)ccc21	778712792	IUZWSODYYODZOR-UHFFFAOYSA-N	438.484	1.286	50	20	IDGD	
Cn1c(=O)nc(O)c2cc(C(=O)NNc3ccc([N+](=O)[O-])cc3Br)cnc21	779136675	OFSXFEQCYBDHQM-UHFFFAOYSA-N	435.194	1.462	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)N[C@H]1CCN(c2ccc(Cl)c(Cl)c2)C1=O	779379351	APQUIODDSGILDA-YGRLFVJLSA-N	433.292	1.481	50	20	IDGD	
C[C@H]1CN(Cc2ccc(C(=O)NNC(=O)CCNC(=O)OC(C)(C)C)cc2)C[C@H](C)O1	780971940	VYNTUAUQEGYQCP-HOTGVXAUSA-N	434.537	1.972	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)c(OC)c1	782121117	UDYCODPARFBUQU-LLVKDONJSA-N	433.392	1.174	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1ncc(Cc2ccccc2Cl)s1	782123264	FNFPGYKIOUUSMN-LLVKDONJSA-N	440.909	1.525	50	20	IDGD	
O=C(NNC(=O)C(=O)NC1CC1)C(=O)Nc1ccccc1OCc1cccc(Cl)c1	782967601	UTAMAHFTSUUWCG-UHFFFAOYSA-N	430.848	1.284	50	20	IDGD	
C[C@@H]1CCC[C@@H](OCc2cccc(NC(=O)C(=O)NN[C@]3(C)CCS(=O)(=O)C3)c2)C1	783426780	KFHXXZVIUVEUKF-FQELHTAISA-N	437.562	1.918	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1ccc2oc(C3CC3)nc2c1	784004113	BGMVFTSSTDSAFU-UHFFFAOYSA-N	427.442	1.283	50	20	IDGD	
COC(=O)CNC(=O)Cc1ccc(NC(=O)C(=O)NNc2ccc(C(C)(C)C)cc2)cc1	784803612	QWLKHWZLYVYYAX-UHFFFAOYSA-N	440.500	1.898	50	20	IDGD	
CCN1CCN(C(=O)c2ccc(NC(=O)C(=O)NNc3cc(F)c(F)c(F)c3)cc2)CC1	785086653	DEKQKHHCMIKCQZ-UHFFFAOYSA-N	449.433	1.963	50	20	IDGD	
O=C(NNc1cc(C(F)(F)F)ccc1F)C(=O)Nc1cnn(CCN2CCOCC2)c1	785167317	SGDGQSNTKOSVKU-UHFFFAOYSA-N	444.389	1.455	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCc2ccc(CCN(C)C)cc2)c2ccccc2c1=O	786255087	OMRXGHYIOFLBCV-UHFFFAOYSA-N	436.516	1.665	50	20	IDGD	
CC(C)(C)OC(=O)NCc1cccc(C(=O)NNC(=O)CNC(=O)c2cccnc2)c1	787332261	QVJRTNDAGRFOEZ-UHFFFAOYSA-N	427.461	1.297	50	20	IDGD	
COc1ccc(-c2nn(CCC#N)cc2/C=C(/C#N)C(=O)NCc2nnn(C)n2)cc1OC	787853657	HBPBIVBNHLOIEP-DHDCSXOGSA-N	447.459	1.228	50	20	IDGD	
CC(C)(C)[C@@H]1CCc2nc(NC(=O)C(=O)NN[C@@]3(C)CCS(=O)(=O)C3)sc2C1	789751301	VLASUXMOZMCUJH-ZMZPIMSZSA-N	428.580	1.431	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)N[C@@H]1CCN(Cc2ccc(F)cc2)C1=O	790674888	ATEWAYVRYAOPMH-OAHLLOKOSA-N	445.407	1.244	50	20	IDGD	
CN(C)N(C(=O)Cc1csc(NC(=O)c2cccc(O)c2)n1)[C@@H]1CCS(=O)(=O)C1	792854884	LGFIFSNANHYDNU-CQSZACIVSA-N	438.531	1.136	50	20	IDGD	
Cc1nc2cc(F)c(F)cc2n1CC(=O)NNC(=O)NCCNC(=O)OC(C)(C)C	793518710	MKTUTUDWTFJJJU-UHFFFAOYSA-N	426.424	1.478	50	20	IDGD	
COC(=O)c1cc(F)cc(NC(=O)C(=O)NNc2cccc(S(C)(=O)=O)c2)c1F	796987024	XUSIOPJYYYZEMC-UHFFFAOYSA-N	427.385	1.237	50	20	IDGD	
CC[C@@H](C)n1nc(NC(=O)C(=O)NNC(=O)CNC(=O)OCc2ccccc2)cc1C	797369375	UFHXHXMQZRUASI-CYBMUJFWSA-N	430.465	1.175	50	20	IDGD	
O=C(NCC(F)(F)F)NNC(=O)c1cc([N+](=O)[O-])ccc1I	798316815	WFNNZNKKGDEUQU-UHFFFAOYSA-N	432.096	1.706	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)Nc1ccc(O[C@@H]2CCN(C)C2=O)cc1C	799238964	QBPPOWKVGUJFMB-LJQANCHMSA-N	442.472	1.845	50	20	IDGD	
CSC[C@H](C)C(=O)N1CCC(C(=O)NNC(=O)Cc2nc3ccccc3n2C)CC1	799407631	BMIWKDCFDYPOCR-AWEZNQCLSA-N	431.562	1.501	50	20	IDGD	
O=C(NNC(=O)c1ccc(F)c(S(=O)(=O)NC2CC2)c1)Nc1ccc2c(c1)OCO2	802097310	JQIAAEBTVZVPGG-UHFFFAOYSA-N	436.421	1.462	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)NC[C@H]2CC(c3ccc4c(c3)CCO4)=NO2)c1	802336270	ADOOGLHKMPRMHO-MRXNPFEDSA-N	430.486	1.844	50	20	IDGD	
O=C(COCC(=O)NNc1nccnc1C1CCC1)NNc1nccnc1C1CCC1	805463965	PGOXNXBTPLXTPZ-UHFFFAOYSA-N	426.481	1.405	50	20	IDGD	
CNS(=O)(=O)c1cc(NC(=O)C(=O)NNc2ccc(C(F)(F)F)cn2)ccc1F	806984772	ULYGXFZOTPLLCV-UHFFFAOYSA-N	435.359	1.229	50	20	IDGD	
C#CC[C@@]1(C(=O)NNC(=O)CNC(=O)c2cccs2)CCCN1C(=O)OC(C)(C)C	809646626	DSZRUUZINJPJTB-FQEVSTJZSA-N	434.518	1.418	50	20	IDGD	
COc1ccnc(NNC(=O)CNS(=O)(=O)c2cc(C(F)(F)F)ccc2Cl)n1	810089935	BSGLIFVWIUQDLJ-UHFFFAOYSA-N	439.803	1.579	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NCc2nnc(CC)s2)c2ccccc2c1=O	812597808	QRISHWGUXMNHET-UHFFFAOYSA-N	429.506	1.755	50	20	IDGD	
CCOC(=O)c1ccc(NNC(=O)c2cccc(S(=O)(=O)NCCOC)c2)cc1C	812722603	SBYFLWYMXQMBTP-UHFFFAOYSA-N	435.502	1.853	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)c2c(I)cnn2C)cc1C	814102182	LPPHZUCBEKNSHX-UHFFFAOYSA-N	428.230	1.482	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCc2nncn2C1)C(=O)Nc1cccc(COc2ccccc2)c1	815691350	NDGGXXOHHLTEDE-MRXNPFEDSA-N	434.456	1.206	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCc2nncn2C1)C(=O)Nc1ccc(SC2CCCC2)cc1	815692352	OZQZACPBGAEDJV-ZDUSSCGKSA-N	428.518	1.661	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1cc(F)ccc1OC(F)F	815750826	LDTQEXXCCICOEM-UHFFFAOYSA-N	446.407	1.759	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCO1)C(=O)Nc1ccc(Br)cc1Br	815778787	GAOJPRCPIRSPKQ-SNVBAGLBSA-N	435.072	1.477	50	20	IDGD	
CCOc1ccc(NNC(=O)C(=O)Nc2ccc(OCCN3CCN(C)CC3)cc2)cc1	815816549	BJZWPRZETPARPT-UHFFFAOYSA-N	441.532	1.793	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)c1ccc(S(C)(=O)=O)c([N+](=O)[O-])c1	817053262	KHEWAFSMPHQIEK-UHFFFAOYSA-N	442.475	1.006	50	20	IDGD	
COC(=O)c1c(F)cccc1NNC(=O)[C@@H](NS(=O)(=O)c1ccc(C)cc1)[C@H](C)O	819710280	DREOXNFNFLXQPN-SJCJKPOMSA-N	439.465	1.092	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)N(C)CC(Cl)Cl)o1	819842610	BRPWEMGPUNRJGL-JTQLQIEISA-N	427.306	1.872	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)[C@H]1CC(=O)N(c2cc(C)ccc2OC)C1	825624008	BBICQGQMMSTEPI-HNNXBMFYSA-N	426.473	1.625	50	20	IDGD	
CC(C)CNS(=O)(=O)c1ccc(C(=O)NNC(=O)Cn2cnc3ccccc32)cc1	914748040	CVQFWUAWAHNWJO-UHFFFAOYSA-N	429.502	1.432	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)COCC3CC3)c2)cc1	915636724	QEQORDXXQJCVOE-UHFFFAOYSA-N	433.486	1.684	50	20	IDGD	
CCOc1ccc(C(=O)NNS(=O)(=O)c2cc(NC(C)=O)ccc2OC)cc1OC	916105344	AYKXUQOMELNICV-UHFFFAOYSA-N	437.474	1.684	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)N[C@@H](CN1CCOCC1)c1ccccc1	916214667	SIQFYUZBXUOIAA-APWZRJJASA-N	430.480	1.997	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NCc2cccc(CN3CCCC3=O)c2)c2ccccc2c1=O	916415532	UELOVKROXBFZSW-UHFFFAOYSA-N	448.483	1.200	50	20	IDGD	
O=C(NCCCN1CCN(c2ccccc2)CC1)NNC(=O)[C@H]1COc2ccccc2O1	916489043	LHVWDCMCPBMEBJ-OAQYLSRUSA-N	439.516	1.369	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)NC[C@@H](c2ccccc2)N2CCOCC2)c1	916508619	BNRHPRWMOFWARG-FQEVSTJZSA-N	428.489	1.721	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)n1)c1cccc(S(=O)(=O)N2CCCC2)c1	916556252	OOBBOZSFOGMFDV-UHFFFAOYSA-N	440.485	1.127	50	20	IDGD	
O=C(NCc1ccc(N2CCSCC2)cc1)NNC(=O)c1ccc(-n2cnnn2)cc1	916626255	VQDBPHIYWSRXND-UHFFFAOYSA-N	438.517	1.360	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)c1cnc2nc(O)nc(O)c2c1	916722824	DSOABEYGIFLYTL-UHFFFAOYSA-N	434.206	1.039	50	20	IDGD	
COc1cc(S(=O)(=O)NNC(=O)c2ccc(Cl)cc2O)cc(C(=O)O)c1OC	917758065	NMGDHMYEDHEIJM-UHFFFAOYSA-N	430.822	1.384	50	20	IDGD	
COc1ccccc1/C=C(/C(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1)c1ccccc1	919889348	LJPXGJYOYLOFAB-NAVNFMRLSA-N	429.498	1.753	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)[C@H]2CC(=O)N(c3ccc(F)c([N+](=O)[O-])c3)C2)cc1	920012742	YQVSLBUFCIIUEL-AWEZNQCLSA-N	444.419	1.876	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)CN3CCCC3=O)c2)c(C)c1	920825701	FLVUGDIMBMPLMW-UHFFFAOYSA-N	444.513	1.488	50	20	IDGD	
CCN1CCN(C(=O)/C(C#N)=C/c2cn(CCC(N)=O)nc2-c2ccc(OC)cc2)CC1	920848803	XFZANRUGHATSGD-NBVRZTHBSA-N	436.516	1.505	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)Cc2c(C)nn(C(F)F)c2C)cc1OC	920917089	SVNSCQPKXLWRPJ-UHFFFAOYSA-N	440.403	1.459	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)NCCN2CCN(S(C)(=O)=O)CC2)c(C)n1CC(C)C	921164972	BSWJSXKKBHGUMX-MOSHPQCFSA-N	435.594	1.361	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCOC1)c1ccc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1	921203313	XZJNJUCOVQZEKJ-ZDUSSCGKSA-N	434.430	1.193	50	20	IDGD	
O=C1Cc2cc(S(=O)(=O)NNC(=O)NCc3cccc(C(F)(F)F)c3)ccc2N1	921297780	FGODTRXVKXFNDK-UHFFFAOYSA-N	428.392	1.893	50	20	IDGD	
COc1ccc(N2CCN(CCCNC(=O)NNc3nncc(N)c3Cl)CC2)cc1	1319310850	WWXHEOKDDHABGN-UHFFFAOYSA-N	434.932	1.559	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NN=C[C@@H](C#N)C(C)C)N(S(C)(=O)=O)CC2	1319380782	LIMRYOLRQXPCMY-WBVHZDCISA-N	436.534	1.850	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)c2ncc(C(N)=O)cc2Cl)c1	1340971915	DZFKTEWVDFPCAP-UHFFFAOYSA-N	427.642	1.680	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2[nH]nc3ccncc23)C1	1777908378	SYQMYQSKRRLWEN-AKCHCHLHSA-N	435.912	1.339	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc(OC)cn2)C1	1778388552	FHESKXZQOKZSPF-XAUMDUMWSA-N	425.913	1.472	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3c(C)cc(C(N)=O)cc3C)C2)C1	1779012537	YJSKKVYJRICHFL-HRAATJIYSA-N	437.924	1.100	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@]2(CN(C(=O)CCC(=O)N3CCCC3)CCO2)C1	1779294526	SPEXOPXHCLCLKZ-FQEVSTJZSA-N	425.602	1.070	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc(C)nc2OC)C1	1779850957	KWCMJCXJENEWJX-CBGDNZLLSA-N	439.940	1.780	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CN1C(=O)CSC1=S)C2	1780705507	BBWQNDYHLQCTAQ-SNUQEOBHSA-N	448.010	1.378	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)cc1OC	1781332903	CHUUXCSTLXPUPH-QAPCUYQASA-N	445.285	1.838	50	20	IDGD	
O=C(c1ccc2nn[nH]c2c1)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781335217	WGYJYRYKYOMRLF-BBRMVZONSA-N	426.246	1.092	50	20	IDGD	
C[C@@H](CN)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C(C#N)=C/c2ccc(F)cc2F)C1	1781597193	SHPLBZJFUCYMKM-ZIRFYFLZSA-N	446.498	1.980	50	20	IDGD	
CCC(=O)N[C@@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](Br)CC)C1	1781897634	NGJOYUCYPJOCGM-NRTGNBEESA-N	446.386	1.589	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(C#N)cc3Cl)C2)C1	1781972623	IWIFHFLUEMNLKK-APWZRJJASA-N	426.300	1.909	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4ccnn4c3)C2)C1	1782405825	GUSPOTXFCBMAAA-KUHUBIRLSA-N	435.322	1.809	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)CCC(=O)N3CCCC3)CCO2)C1	1783530229	VPXMINAAQSDLLT-KBXCAEBGSA-N	430.343	1.002	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)NC(=O)OC(C)(C)C)[C@H]2C1	1783820787	IYJDKGASXNYHHM-QXKUPLGCSA-N	431.961	1.897	50	20	IDGD	
C=CCCc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]3C2)c(O)n1	1784086058	CVORNODCEDMUPS-RUGDWHBFSA-N	437.924	1.099	50	20	IDGD	
Cc1cc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]32)nn1C	1784241435	TYQBZVCUZOJXOE-FJXLLPKBSA-N	431.364	1.487	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)c1n[nH]c2c1CCCC2	1787314257	PTNTZKVJQNJYSH-NOLJZWGESA-N	439.354	1.667	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)c1cnn2c1CCC2	1790390498	MANHCKNDDWMFHT-HQRZJTNHSA-N	429.290	1.113	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cncnc3)C[C@@H]21	1790960694	BBWVHIZGNBFHOU-JONQDZQNSA-N	425.327	1.172	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C#CC3(O)CCCCC3)C[C@@H]21	1791055788	HXHUWMRBUMHDDV-QZWWFDLISA-N	441.366	1.448	50	20	IDGD	
Cn1cnc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C(C)(C)CCl)c1C(F)(F)F	1792782195	YCXLKBFVZIKYGE-ZSBIGDGJSA-N	436.862	1.907	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CNC(=O)c1cccnc1	1794226756	HWTJDIVYEBYJND-QKPAOTATSA-N	437.338	1.623	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CCc3ccccc3O1)C2	1795117122	NQQOPLCEMRGATM-HIRMHNASSA-N	437.334	1.755	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1cc(C(F)F)no1	1795916103	BNHCWUDHYWWVRQ-LRMGWDNHSA-N	426.189	1.506	50	20	IDGD	
CC1=NN(c2ccc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@@H](F)Cl)cc2)C(=O)C1	1796367434	IPAJLLPWPUEYNI-LTCOOKNTSA-N	436.871	1.537	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C[C@@H](C)NC(=O)OC(C)(C)C	1796389834	SUXHPLIVPZLXMA-LFYQSXPISA-N	431.961	1.897	50	20	IDGD	
COc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Cl)C3)c([N+](=O)[O-])cc1O	1798595893	YDQZEVMKRJWREJ-QTGCHDBNSA-N	431.804	1.047	50	20	IDGD	
CC(C)NC(=O)OC(C)(C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CO[Si](C)(C)C)C2	1799128981	IQCKCUIAFIEQJU-SCAQPMJSSA-N	443.617	1.341	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=C2c3ccccc3C(=O)N2CC1)[C@@H](O)CCl	1799136560	CMYVWNOWGKWRGG-AHXJXLJNSA-N	429.904	1.495	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2nn(C)cc2c1	1799911119	CULQZXKLZCODDJ-KYHPRHEASA-N	449.349	1.950	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(F)(F)c1ccco1	1800237872	CNTZZJBBFCLAMK-FMSGJZPZSA-N	435.265	1.992	50	20	IDGD	
Cn1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)/C(C#N)=C/c2ccc(F)cc2F)n1	1800332316	CNBZDCPUFMGTNO-AOWDBCOTSA-N	441.438	1.509	50	20	IDGD	
COc1cc(C#N)cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)Br)c1	1800760575	SUMXDEHSJZBSOR-RMIITELYSA-N	436.306	1.553	50	20	IDGD	
CC[C@@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cn1cc([N+](=O)[O-])cn1)C2	1801797924	FNVAJVYWISLVBN-GFQSEFKGSA-N	428.287	1.603	50	20	IDGD	
Cn1ncnc1C(=O)N1CC[C@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]1c1cccnc1	1808292640	ZUEGHQSYVXEHMR-LBTNJELSSA-N	425.320	1.766	50	20	IDGD	
CC(=O)O[C@H](C(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)C(C)C	1810098235	GXPXCJVABKOHNX-MHORFTMASA-N	425.913	1.275	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@@H](CNC(=O)c2ccnnc2O)[C@@H]1c1cccnc1	1811220632	DMMUJDYYQKGCAG-INWMFGNUSA-N	448.321	1.928	50	20	IDGD	
CC(C)(C)n1cc(C(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)nn1	1811549017	OSBOTOVEQJKYQJ-USXIJHARSA-N	434.928	1.347	50	20	IDGD	
CC(=O)N[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)[C@@](C)(Cl)CCl)[C@H]1c1cccnc1	1812657694	XCJJRQBWZZXNRK-OYWVLEMYSA-N	429.348	1.848	50	20	IDGD	
C=CCNC(=O)/C=C\C(=O)N1CC[C@H](CNC(=O)[C@@H](Cl)COC)[C@H]1c1cccnc1	1813028138	LMFYYIUGWRWCHU-SQOMTDJASA-N	434.924	1.200	50	20	IDGD	
CCCC(=O)N[C@H](C)C(=O)N1CC[C@H](CNC(=O)[C@@H](Cl)COC)[C@@H]1c1cccnc1	1813031095	JIBPYHLBRDULQR-NWGLXNPWSA-N	438.956	1.646	50	20	IDGD	
NC(=O)c1ccc(C(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@H]2c2cccnc2)cc1	1813733947	MEVAYKIUGJGBJF-KSZLIROESA-N	430.892	1.100	50	20	IDGD	
N#Cc1cccc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)c1	1815360358	GPCPTTSTWUEOHX-QGZVFWFLSA-N	446.297	1.234	50	20	IDGD	
CCOC(=O)N[C@H](O)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCBr)n[nH]1	1816781427	ARUGHKFVWUEXNL-SMDDNHRTSA-N	446.302	1.251	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CN2CCOCC2)n[nH]1	1817150510	GFCVNQZHQXAPGX-OCCSQVGLSA-N	428.331	1.517	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCN2CCOCC2)n[nH]1	1817181992	LOWDTELNVXPMNK-GDBMZVCRSA-N	427.933	1.378	50	20	IDGD	
Cc1ccnc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)[nH]n2)c1	1818191719	NTKRMWQRIQTIKB-SFHVURJKSA-N	448.487	1.731	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCBr)[nH]n1	1819578788	LCBNAXJATDKEOP-YPMHNXCESA-N	426.315	1.878	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)n2)[nH]n1)[C@H](F)Br	1820931927	BHMOPLOEUSDPOK-CABZTGNLSA-N	443.233	1.607	50	20	IDGD	
CC(C)(C)n1cc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@@H](O)CCl)CC3)nn1	1821631020	VXDRUVHUOKFFOS-SKDRFNHKSA-N	426.930	1.315	50	20	IDGD	
CC(C)=NO[C@H](C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1	1822415693	PDSNMFKRRZJTQB-ZBFHGGJFSA-N	435.529	1.576	50	20	IDGD	
C[C@H](C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1)n1cccn1	1822802404	GNHFCDDCKSGXTH-GDBMZVCRSA-N	430.513	1.233	50	20	IDGD	
O=C(CCc1ccoc1)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1822918515	ITBYYNMITXUGQY-IBGZPJMESA-N	436.277	1.621	50	20	IDGD	
O=C(COc1cccnn1)N[C@@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1	1823013987	MECDJZZWELFKFH-AMIZOPFISA-N	444.286	1.615	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc[nH]n2)CC1	1824668871	DVABTNHSBYQCNC-KWXFCVSUSA-N	439.520	1.777	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCC([C@H]2CCCCN2C(=O)CN2C(=O)CNC2=O)CC1	1824904951	VUBJTPSKJVNBBA-AUUYWEPGSA-N	447.363	1.394	50	20	IDGD	
O=C(CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H](O)CCl)CC1)N1CCCC1	1824944328	ZLOWLZYSRRVHGK-QZTJIDSGSA-N	427.973	1.608	50	20	IDGD	
CC[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)Cn1cncn1)CC2	1825446266	ASYHEMDJKSCOTD-NXEZZACHSA-N	427.328	1.520	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H]1CCC(=O)N1C)CC2	1825646060	OHYDUNBMYMRADW-NGZCFLSTSA-N	429.340	1.459	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)/C=N/N1CCCCC1)CC2	1826000084	KLNZJVJRRLHHMQ-RDFRODCOSA-N	427.958	1.781	50	20	IDGD	
O=C([C@@H]1CCC=CO1)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827051893	ILFQRMAHIFZVOG-RTWAWAEBSA-N	426.322	1.292	50	20	IDGD	
Cc1cc2nnc(C(=O)N3CCCC[C@@H]3C3CCN(C(=O)[C@@H](O)CCl)CC3)c(C)n2n1	1828144808	OEWYXYCYDGDQLY-SJORKVTESA-N	448.955	1.574	50	20	IDGD	
Cc1c(Cl)cccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1	1830130916	PBVZYWWHFFHWJR-LPHOPBHVSA-N	431.316	1.318	50	20	IDGD	
C[C@@H]1C[C@]1(C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1	1830218849	HOWVJTTUOGOVJB-VVWXKSFDSA-N	427.549	1.965	50	20	IDGD	
Cc1ccn2c(C(=O)N3CCOC[C@]4(C3)CN(C(=O)C(C)(C)CCl)CCO4)cnc2c1	1830365704	FOTVOQQLHZFMMB-QFIPXVFZSA-N	448.951	1.978	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccccn3)C2)C1	1830537514	JPSYDVXIMVZSMU-RDTXWAMCSA-N	426.311	1.183	50	20	IDGD	
COC1(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)CCC1	1830545728	MGGZBZYSCFPHTM-BEFAXECRSA-N	447.370	1.433	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3ncccc3OC)CCO2)C1	1832865388	IECOLSDRILPUFL-IERDGZPVSA-N	439.940	1.497	50	20	IDGD	
Cc1ncc(CC(=O)N2CCC(N3CCC(NC(=O)[C@@H](O)CCl)CC3)CC2)s1	1833313190	YWVZQCAWPWZSSL-KRWDZBQOSA-N	428.986	1.165	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(O)nc(Cl)c3)CCO2)C1	1833574691	KWVCILGHVOOSLU-KUHUBIRLSA-N	446.331	1.918	50	20	IDGD	
Cc1occc1C(=O)NC1CCN(C2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1	1834183584	XVGDYMIRTHUXHI-UHFFFAOYSA-N	433.553	1.146	50	20	IDGD	
Cc1cncc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](C)CBr)C3)C2)c1	1834277868	GVGQOKIDYUJRMY-BEFAXECRSA-N	440.338	1.491	50	20	IDGD	
CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1	1834813747	MFHYHOJEQXEGIA-HXUWFJFHSA-N	435.433	1.000	50	20	IDGD	
O=C(Cc1ccccn1)NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1834890375	HCJPBKQNOMRCFZ-GOSISDBHSA-N	441.345	1.886	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cnn4ccncc34)CC2)CC1	1835406429	OCFWITIDKIERBR-SFHVURJKSA-N	432.956	1.932	50	20	IDGD	
O=C(CCBr)N1CCC(OC2CCN(C(=O)Cn3nccn3)CC2)CC1	1837654336	AMVDTYURLPKDRY-UHFFFAOYSA-N	428.331	1.062	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccnc(Cl)n3)C2)C1	1837715610	ZZAZRJVVONKUTO-SFHVURJKSA-N	442.976	1.052	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1[nH]cc3c1CCC3)CCO2	1838453608	KMWNZJAMOKIYLP-OAQYLSRUSA-N	435.597	1.425	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)COc3ccc(F)cc3)C2)C1	1839143273	RFWWWIXUMHEMKL-YLJYHZDGSA-N	428.888	1.678	50	20	IDGD	
CC(C)=NO[C@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)Br)C2)C1	1839228020	QLPREDLLQAGEKN-CPUCHLNUSA-N	434.331	1.027	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3cncc(C)c3)C2)C1	1840150728	PRQRIIYMMKIMLU-NQIIRXRSSA-N	439.940	1.033	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cc(C)ccc3C)C2)C1	1840155421	BKXUWMFQDLLZTO-DENIHFKCSA-N	438.952	1.556	50	20	IDGD	
O=C(c1cnc(Cl)s1)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840188984	PJRCEXBUOFKZNM-CQSZACIVSA-N	428.725	1.670	50	20	IDGD	
O=C(C(Cl)Cl)N1CCO[C@]2(COCCN(C(=O)C3(Br)CC3)C2)C1	1840189469	SSDJEBCTFYBFTB-CYBMUJFWSA-N	430.126	1.174	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CCOC[C@@]2(CN(C(=O)C(Cl)Cl)CCO2)C1	1840190726	KCZDNBPJMMRPOA-KSMMKXTCSA-N	449.331	1.002	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1C[C@@]1(F)Cl)CCO2	1840247738	HTHINSIBLYCKSV-KOZAUXTDSA-N	441.725	1.541	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)/C=C/c2ccc(F)cc2F)C1	1841795931	HJKVSVLSMGBPEW-SOFGYWHQSA-N	426.228	1.175	50	20	IDGD	
COC(=O)c1ccc(OCC(=O)N2CC3(CCCN3C(=O)CCBr)C2)cc1	1842639592	ZMGYDHXJDYSECB-UHFFFAOYSA-N	439.306	1.840	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1ccc3nc[nH]c3c1)C2	1843416318	WIXYHRRJHRUCMA-VULFUBBASA-N	433.472	1.514	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1cc3ccoc3cn1)C2	1843416587	BQVMQORGTKNKPA-AFUMVMLFSA-N	434.456	1.779	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@H]1[C@@H](O)CCN1Cc1ccccc1)C2	1846364453	QCFAQEAFIVKXQT-FHWLQOOXSA-N	435.952	1.079	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)C[C@@H]1OCCc3ccccc31)C2	1846383946	LPEPYTGVQNWBDU-IBGZPJMESA-N	428.533	1.267	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1ccc(Cn2cncn2)cc1	10655442	DBFCQIKYFIHHTG-UHFFFAOYSA-N	443.847	1.606	50	20	IDGD	
Cn1c(SCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)nnc1-c1cccs1	10710257	WTTOTIOEHKFUFZ-ZDUSSCGKSA-N	431.499	1.623	50	20	IDGD	
CCn1c(NNC(=O)c2ccc(S(=O)(=O)NC3CC3)cc2)nc2ccccc2c1=O	11164568	ZKRJPZCGOLKRBW-UHFFFAOYSA-N	427.486	1.614	50	20	IDGD	
Cc1cccn2cc(COc3ccc(C(=O)NNC(=O)[C@H]4CCS(=O)(=O)C4)cc3)nc12	11715535	TVXNNMQDTQDLMR-INIZCTEOSA-N	442.497	1.417	50	20	IDGD	
O=C(COC(=O)CCCN1C(=O)c2ccccc2C1=O)NNC(=O)c1ccc(Cl)cc1	23562352	VAEXHVNKIHVLIQ-UHFFFAOYSA-N	443.843	1.721	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2ccc(C(N)=O)cc2)ccc1OCCC(C)C	105237389	IZNXTKKEWBQLKJ-UHFFFAOYSA-N	435.502	1.842	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NCCOc1cccc(C(F)(F)F)c1	725872878	IAODPMYOFLSLPN-UHFFFAOYSA-N	430.408	1.906	50	20	IDGD	
CCc1cccc2c1OCC[C@H]2NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	726276643	XNJIZOOEMIBIQY-GOSISDBHSA-N	446.529	1.967	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)c2ncoc2C)c1	726521598	NMYJNVKVHVGLNW-UHFFFAOYSA-N	430.442	1.867	50	20	IDGD	
CN1C(=C(C#N)C(=O)COC(=O)CNC(=O)Cc2ccc(O)cc2)N(C)c2ccccc21	726821772	LURMNCZQQKCMQV-UHFFFAOYSA-N	434.452	1.485	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)CNC(=O)NC2CCCCC2)c1	728525604	DAIBXWLDDDXDRK-UHFFFAOYSA-N	427.299	1.851	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)NCc2nnc3n2CCCCC3)c1	728741476	QALYCHITQHGQFE-UHFFFAOYSA-N	437.298	1.920	50	20	IDGD	
CCCOC(=O)c1ccc(S(=O)(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1	728854353	SLVUBKRNIXQQAB-UHFFFAOYSA-N	447.517	1.270	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)NCCNS(=O)(=O)Cc1ccccc1	729507538	VUFZSFLZPMDQPK-UHFFFAOYSA-N	429.502	1.091	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CC(=O)N(c2ccc3c(c2)OCCO3)C1)c1cccc2ncccc12	730227808	NRBYKKHRTLBLLE-CQSZACIVSA-N	432.436	1.820	50	20	IDGD	
C[C@@H]1CCC[C@@H](NC(=O)CN2CCN(CC(=O)NNC(=O)c3ccccc3Cl)CC2)C1	731214872	URIDLAYRVKLRBM-IAGOWNOFSA-N	449.983	1.414	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)NCCCCN1CCN(c2ncccn2)CC1	731362637	HPSJQRLPWLAYRE-UHFFFAOYSA-N	429.500	1.091	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)[C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)cc1	732054486	XQQRYNOQKKXGAI-CQSZACIVSA-N	432.458	1.796	50	20	IDGD	
O=C(NNc1cnccn1)c1cccc(S(=O)(=O)NCc2ccc3c(c2)OCO3)c1	734245228	MYAUFACRBBNKQN-UHFFFAOYSA-N	427.442	1.441	50	20	IDGD	
CC(=O)N(c1nc(C=NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cs1)C1CC1	734294639	DCTBKWWJJBYCTK-UHFFFAOYSA-N	449.558	1.738	50	20	IDGD	
CCN(CC(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1)C(=O)OC(C)(C)C	734826054	VEQRYWANLOLCQC-UHFFFAOYSA-N	443.545	1.973	50	20	IDGD	
Cc1c(Cl)cccc1OCC(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	736065673	MFLLKRLUQMATNL-UHFFFAOYSA-N	432.285	1.789	50	20	IDGD	
CC[C@@H](CNC(=O)NNC(=O)C(=O)N1CCCC1)Cc1cccc(Br)c1	737061894	VNZBTUAFOQPOHN-CYBMUJFWSA-N	425.327	1.971	50	20	IDGD	
CC(=NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)c1cncc(F)c1	737417916	OAKDXILADHSHOJ-UHFFFAOYSA-N	434.493	1.715	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NCCNc1nccc(C(F)(F)F)n1	739045858	OOTWXKOLBFECOO-JTQLQIEISA-N	430.362	1.844	50	20	IDGD	
C[C@H]1C[C@@H](C)CN(S(=O)(=O)c2cccc(C(=O)NNc3ncnc4[nH]cnc34)c2)C1	740746921	YXJXSRALCRUIEN-BETUJISGSA-N	429.506	1.776	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)N[C@H]2CCC[C@@H](S(C)(=O)=O)C2)cc1	741094008	VPSPGYNVGWTNPD-JKIFEVAISA-N	427.523	1.539	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@H]2CCCN(C(=O)c3ccncc3)C2)c2ccccc2c1=O	742033954	HOSPVPMXCQMIQB-INIZCTEOSA-N	448.483	1.125	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CNC(=O)c2cc3ccccc3[nH]2)cc(OC)c1OC	742472736	QETQEXNYUUHZDG-UHFFFAOYSA-N	426.429	1.385	50	20	IDGD	
CS(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2cccc(Br)c2)cc1	743534272	HRWRYDQYJWEYMA-UHFFFAOYSA-N	426.292	1.997	50	20	IDGD	
Cc1c(C(=O)O)cc(Br)cc1S(=O)(=O)NNC(=O)c1ccc(C#N)cc1	747609692	XUULWUVSMZMVLI-UHFFFAOYSA-N	438.259	1.951	50	20	IDGD	
CC(=NNC(=O)Cc1csc(N2CCOCC2)n1)c1nnn(-c2ccccc2)c1C	747612122	VNLWKDNQNYYRKK-UHFFFAOYSA-N	425.518	1.952	50	20	IDGD	
NS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cccc3ncccc23)cc1Br	748079523	FOXCHEFMAHFPCH-UHFFFAOYSA-N	449.286	1.720	50	20	IDGD	
O=C(CCCOc1ccc(I)cc1)NNC(=O)C(=O)N1CCCC1	748240422	VYUIPKOTPZPYDZ-UHFFFAOYSA-N	445.257	1.220	50	20	IDGD	
CCc1cccc(NC(=O)CNC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)c1	748329493	QZJMRGBLQDKAKQ-UHFFFAOYSA-N	446.533	1.433	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCN(C(=O)OCC(C)C)CC1	749251855	LRETVMCYKUHNQT-UHFFFAOYSA-N	426.901	1.520	50	20	IDGD	
O=C(CCNS(=O)(=O)c1cccc([N+](=O)[O-])c1)NNC(=O)c1cc2ccccc2o1	749474323	KTDXZMFQWFQJCI-UHFFFAOYSA-N	432.414	1.471	50	20	IDGD	
C[C@@H]1C[C@@H](C)CN(C(=O)CN2CCN(C(=O)NNC(=O)c3cc4ccccc4o3)CC2)C1	750288943	NIRDRHTWKRHIKF-IAGOWNOFSA-N	441.532	1.909	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)N[C@H]1CCN(CCCc2ccccc2)C1=O	750660509	NFJMGESMSPMOOI-SFHVURJKSA-N	425.445	1.773	50	20	IDGD	
CCOCCNC(=S)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	750972077	ARVCAOLGYGEZSC-UHFFFAOYSA-N	425.518	1.534	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2ccc(CCCCl)cc2)c1	751269094	JXBVAYYMZADNKI-UHFFFAOYSA-N	430.935	1.885	50	20	IDGD	
COc1cc(OC)cc(N2C[C@H](C(=O)NNC(=O)Cc3ccccc3OC)CC2=O)c1	752294468	OFLGJWJDYIOSBD-OAHLLOKOSA-N	427.457	1.455	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)/C(C#N)=C/c3ccc(F)cc3)cc2)CC1	752635036	WDCCNGCZXVZTNO-SAPNQHFASA-N	443.504	1.812	50	20	IDGD	
COC(=O)CCNC(=O)c1ccc(NC(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1	755603714	MSEWKZPXWNOTRR-UHFFFAOYSA-N	442.428	1.217	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1ccc(Oc2ccc(Cl)cc2)nc1	756228294	RBDKTWJITOASAG-SNVBAGLBSA-N	427.870	1.618	50	20	IDGD	
COC(=O)CCCc1nnc(NC(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)s1	756683247	HCJZWETUUPCSME-UHFFFAOYSA-N	435.491	1.952	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)CN1C(=O)N[C@]2(C[C@@H](C)C[C@@H](C)C2)C1=O	756862092	ABCYJFZKXOIKJB-YEZVWNJWSA-N	446.504	1.358	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NNc2nc(O)c3ccccc3n2)cc1	758308782	CNWRJBBRPPFFGH-KRWDZBQOSA-N	427.486	1.940	50	20	IDGD	
Cc1sc(=O)n(CC(=O)NNC(=O)C(=O)Nc2ccccn2)c1-c1ccc(F)cc1	758834732	QVRSHMXKYJLDSV-UHFFFAOYSA-N	429.433	1.205	50	20	IDGD	
CC(C)(C)c1nnc(CNC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)s1	758888868	NLUXABHEFQCEPD-UHFFFAOYSA-N	445.593	1.878	50	20	IDGD	
O=C(NNc1ncccc1[N+](=O)[O-])c1ccc2c(c1)S(=O)(=O)N(C[C@@H]1CCCO1)C2=O	759285834	QAZYOFWIJZJYLR-LBPRGKRZSA-N	447.429	1.070	50	20	IDGD	
Cc1ccnc(-n2nccc2NC(=O)C(=O)NNC(=O)c2cccc(C(F)(F)F)c2)c1	760278329	WFFNLHVSMPUAPR-UHFFFAOYSA-N	432.362	1.994	50	20	IDGD	
COc1ccc(C(=O)NNc2nc(-c3ccncc3)no2)nc1I	761154853	GJSVXZOIVDSXDW-UHFFFAOYSA-N	438.185	1.897	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)CC[C@@H]2NC(=O)N(c3ccc(C#N)cc3)C2=O)n1	762896406	VVDBIFQDDUBXPL-INIZCTEOSA-N	436.476	1.543	50	20	IDGD	
O=C(NNC(=O)c1ccccn1)C(=O)Nc1cccc(-c2cn(Cc3ccccc3)nn2)c1	763463456	JGHLKFNYMAXXMY-UHFFFAOYSA-N	441.451	1.788	50	20	IDGD	
Cc1cc(Oc2ncccn2)ccc1NC(=O)C(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	763468644	PDKHUODACZZJRK-UHFFFAOYSA-N	436.384	1.885	50	20	IDGD	
CC[C@@H](C)NS(=O)(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2ccccc2F)c1	763568520	MMSXZHKIPSDCEF-GFCCVEGCSA-N	436.465	1.302	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccccc2C(=O)N2CCCC2)cc1	763661955	RFQMQLWCKWVQMY-UHFFFAOYSA-N	440.456	1.096	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(F)cc1C(=O)OC	763681746	MREXRYYBKOPVJT-UHFFFAOYSA-N	433.392	1.176	50	20	IDGD	
CC(C)Oc1ccc(F)cc1NC(=O)C(=O)NNC(=O)COc1ccccc1[N+](=O)[O-]	763803791	NTPYVOMUBXNNRP-UHFFFAOYSA-N	434.380	1.686	50	20	IDGD	
N#Cc1ccccc1OCc1cccc(C(=O)NNC(=O)CNC(=O)c2cccnc2)c1	763814386	ONBMVTGPKONSLW-UHFFFAOYSA-N	429.436	1.723	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)NC(=O)[C@@H](C)O3)c1C	763850525	OONOEDBTATZCTD-KGLIPLIRSA-N	440.456	1.576	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1cnn(Cc2ccccn2)c1	763865060	NJGZEKAEVVHXPA-CYBMUJFWSA-N	426.408	1.019	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1cccc(N2CCOC2=O)c1	763872630	OBSCGTMGIBFVPI-LBPRGKRZSA-N	430.392	1.336	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(NC(=O)CC)cc2)cc1OC	763901917	LHGHZNKJTJCCBK-UHFFFAOYSA-N	428.445	1.842	50	20	IDGD	
COc1ncnc(N(C)C)c1NC(=O)C(=O)NNC(=O)c1cc2c(s1)CC[C@@H](C)C2	763939219	BEPSZPLUORMVBR-SNVBAGLBSA-N	432.506	1.137	50	20	IDGD	
C[C@@H]1CCC2=S=C(C(=O)NNC(=O)C(=O)Nc3ccnn3Cc3ccccn3)C=C2C1	763941929	ZGUCMIFUILLPMO-CYBMUJFWSA-N	438.513	1.250	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)cccc1C(=O)N1CCCC1	763974804	XNYKDBLZGBQEBT-UHFFFAOYSA-N	444.875	1.990	50	20	IDGD	
CCN(CC)C(=O)c1ccccc1NC(=O)C(=O)NNC(=O)c1cc(Cl)ccc1O	763978548	LAKPPVUFCYKSGN-UHFFFAOYSA-N	432.864	1.927	50	20	IDGD	
CCOC(=O)C(C)(C)n1cc(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3c2)cn1	764064673	NKVQRMHBYQAFLP-UHFFFAOYSA-N	437.456	1.734	50	20	IDGD	
COC(=O)c1cc(Br)c(F)cc1NC(=O)C(=O)NNC(=O)C1CCCC1	764071235	SDBZDPVMBLNIPT-UHFFFAOYSA-N	430.230	1.651	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc([C@H](C)N3CCOCC3)cc2)c(O)c1	764105616	WJTZQFXHJSHMHH-HNNXBMFYSA-N	426.473	1.494	50	20	IDGD	
COC(=O)c1cc(F)ccc1NC(=O)C(=O)NNC(=O)c1cccc(OC(F)F)c1	764250800	NMFVXFWEPQDEIF-UHFFFAOYSA-N	425.319	1.613	50	20	IDGD	
O=C(NNC(=O)c1cccc2ncccc12)C(=O)Nc1ccc(CCN2CCOCC2)cc1	764257470	HMGHNZSSAVKNHX-UHFFFAOYSA-N	447.495	1.509	50	20	IDGD	
O=C(NNC(=O)C(F)(F)Oc1ccccc1)C(=O)Nc1cccn(CC(F)(F)F)c1=O	764380149	PUZBZYYZKDNSOG-UHFFFAOYSA-N	448.304	1.168	50	20	IDGD	
COC(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)c1	764386819	DBZVQMKXNVURSC-UHFFFAOYSA-N	439.403	1.331	50	20	IDGD	
C[C@H](C(=O)NNC(=O)c1ccc(Br)s1)S(=O)(=O)C1CCOCC1	764568945	ODVQUBQHHZWAKG-MRVPVSSYSA-N	425.326	1.254	50	20	IDGD	
C[C@](O)(CNC(=O)NNC(=O)c1csc(N2CCOCC2)n1)c1ccccc1Cl	765191625	ANHADRQXPATPOW-SFHVURJKSA-N	439.925	1.485	50	20	IDGD	
O=C(CCC(=O)N1CCN(c2ccccc2)CC1)NNC(=O)CSc1ccccc1O	765249749	PCXXZSSIOVOFEY-UHFFFAOYSA-N	442.541	1.761	50	20	IDGD	
COc1ccc(OCCC(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cc1	765732513	IKSUNEFHLZOAJJ-UHFFFAOYSA-N	440.500	1.070	50	20	IDGD	
N#C/C(=C/c1cn(CCC(N)=O)nc1-c1ccc(Br)cc1)C(=O)N1CC(O)C1	765853476	ASPDIJSQFLHCOI-QPEQYQDCSA-N	444.289	1.298	50	20	IDGD	
O=C(NNC(=O)[C@H]1C[C@@H]1c1cc(F)c(F)c(F)c1)c1csc(N2CCOCC2)n1	766630112	MSYWEOUWVASBDM-MNOVXSKESA-N	426.420	1.962	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cccnc3N3CCCC3)CC2)cc1	766650997	YOQTYQPAINFBAT-UHFFFAOYSA-N	436.560	1.569	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)CSc1nnc(-c2ccco2)o1	767268716	VDHHKFMAPSXUOD-UHFFFAOYSA-N	430.442	1.663	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)C[C@@H](NC(N)=O)c1ccccc1C	767278413	DPXJHGPBRFLGKU-GOSISDBHSA-N	426.473	1.336	50	20	IDGD	
Cc1nc(-c2ccccc2)ncc1C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	767625164	STCURKZZZQJOEN-LJQANCHMSA-N	448.435	1.596	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)c3cc(NS(C)(=O)=O)ccc3O)n[nH]2)c1	768265125	TVWOUJOCRAVCKL-UHFFFAOYSA-N	443.485	1.845	50	20	IDGD	
Cc1cccc(NC(=O)C(=O)NNC(=O)c2nnc(O)c3ccccc23)c1Br	769266613	OJTJXCVCOBJCGL-UHFFFAOYSA-N	444.245	1.806	50	20	IDGD	
CC(C)(C)NC(=S)NNC(=O)CN1C(=O)N[C@](C)(c2ccc(F)c(Cl)c2)C1=O	770213527	KMOMIMBKZRCLSF-QGZVFWFLSA-N	429.905	1.540	50	20	IDGD	
CNS(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)nc1	770760862	TYHMQFWPVXCHAS-SNVBAGLBSA-N	427.870	1.263	50	20	IDGD	
NC(=O)c1cc(OC2CCN(C(=O)NNC(=O)c3cnn(-c4ccccc4)c3)CC2)ccn1	771985850	OQYNSDINDMBYPF-UHFFFAOYSA-N	449.471	1.264	50	20	IDGD	
CC(C)[C@@H](NC(=O)c1cccs1)C(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772188142	HFRMRWUCVYZTIR-OAHLLOKOSA-N	436.921	1.620	50	20	IDGD	
Cc1ccc(-n2nc(C)cc2NC(=O)C(=O)NNC(=O)c2cc3ccccc3cc2O)nn1	773489878	CJMBLVCZTOGEFH-UHFFFAOYSA-N	445.439	1.538	50	20	IDGD	
Cc1ccc(-n2nc(C)cc2NC(=O)C(=O)NNC(=O)COc2ccc(C)c(C)c2)nn1	773493582	DKUJEAGVYJANBC-UHFFFAOYSA-N	437.460	1.061	50	20	IDGD	
O=C(NNc1ccccc1[N+](=O)[O-])C(=O)Nc1cccc(C(=O)N2CCSCC2)c1	773650298	IDDGTOOCXWALQG-UHFFFAOYSA-N	429.458	1.866	50	20	IDGD	
COc1cccc(Cn2nccc2NC(=O)C(=O)NNc2ccccc2[N+](=O)[O-])c1OC	773655459	PWSIOJFTDVAVCU-UHFFFAOYSA-N	440.416	1.939	50	20	IDGD	
CN(c1ccccc1NC(=O)C(=O)NNc1ncc(Cl)cc1Cl)S(C)(=O)=O	773676863	KIQGLKITRRRWBB-UHFFFAOYSA-N	432.289	1.866	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(N3CCCS3(=O)=O)cc2)cc1F	773885707	PULVRVMQTRXBKZ-UHFFFAOYSA-N	434.449	1.074	50	20	IDGD	
COCCOc1cccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)c1	774002139	MURQFASNMKGVLW-ZDUSSCGKSA-N	435.864	1.919	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)CCC(=O)N2	774008771	KYOIIMVKSSQYTQ-LLVKDONJSA-N	430.848	1.778	50	20	IDGD	
CCNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)c1	774008911	MPIIXVAWDRNMME-LBPRGKRZSA-N	432.864	1.643	50	20	IDGD	
Cc1cc(S(N)(=O)=O)ccc1CNC(=O)NNC(=O)CCSc1ccc(F)cc1	775213659	ZDETZDZLUHOSJG-UHFFFAOYSA-N	440.522	1.794	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NC[C@H]2COC3(CCOCC3)O2)cc1Br	776914384	WTTJAWSRLWROAW-LBPRGKRZSA-N	444.282	1.324	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)NCC[C@H]1CCN(C(=O)OC(C)(C)C)C1	778663184	SHYDXMYPDHZFHC-ZDUSSCGKSA-N	429.518	1.489	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)C(=O)Nc1cc2c(cc1F)NC(=O)CC2	778715603	YUPXDRYHMXFOAB-UHFFFAOYSA-N	432.433	1.294	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1S(=O)(=O)NNC(=O)c1cc2c(s1)CCC2	780366005	PTYOKHHYNIGRES-UHFFFAOYSA-N	429.545	1.110	50	20	IDGD	
COC(=O)c1ccccc1NNC(=O)CN(C)S(=O)(=O)c1ccc(NC(C)=O)cc1	780736996	CNKSTCBMPYBAMD-UHFFFAOYSA-N	434.474	1.195	50	20	IDGD	
COc1ccc(NNC(=O)CCCNS(=O)(=O)c2ccc3c(c2)OCCCO3)nc1	781536166	SPVNNVTZZDCVGM-UHFFFAOYSA-N	436.490	1.453	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NCC(=O)NNc2ncncc2Cl)c1	781820196	OCPXNHGVYGYSEJ-UHFFFAOYSA-N	440.913	1.034	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C(=O)Nc2cccc(OCCCC#N)c2)nc2ccccc21	782884525	BIGZXHUXDSHXFU-UHFFFAOYSA-N	434.456	1.584	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2ccc(Br)cc2F)ccc1-n1cnnn1	783080687	KJBQHJHMVQEMSE-UHFFFAOYSA-N	434.229	1.954	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNc2ncnc3ccsc23)cc1C(=O)OC	783253258	LRHVWTQDBBVXIQ-UHFFFAOYSA-N	429.414	1.346	50	20	IDGD	
Cc1c(COc2ccccc2)cccc1NC(=O)C(=O)NN[C@]1(C)CCS(=O)(=O)C1	783426445	HKAQKKYWRAMOJV-OAQYLSRUSA-N	431.514	1.711	50	20	IDGD	
CCOC(=O)c1cc(C(C)(C)C)sc1NC(=O)C(=O)NN[C@]1(C)CCS(=O)(=O)C1	783428838	XYUVPZRIIIMOED-GOSISDBHSA-N	445.563	1.359	50	20	IDGD	
CN1CCN(C(=O)Cc2ccc(NC(=O)C(=O)NNc3ccc(F)c(F)c3F)cc2)CC1	784806801	LTAFUWDEHPUNDQ-UHFFFAOYSA-N	449.433	1.502	50	20	IDGD	
COC(=O)c1ccsc1NC(=O)C(=O)NNC(=O)c1cc(-c2cc(C)ccc2C)[nH]n1	785127284	DYLHIIIPZDQXKD-UHFFFAOYSA-N	441.469	1.941	50	20	IDGD	
CNC(=O)Cc1ccc(NC(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)cc1	785836571	XQKNUNBPHNNBMK-UHFFFAOYSA-N	448.524	1.616	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2cc(C(=O)NCC3CC3)ccc2C)c1O	785990439	HAFJVRGIFHDPOK-UHFFFAOYSA-N	440.456	1.249	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@@]3(O)CCc4ccccc4C3)CC2)cc1	786390812	JRMVDWUPFLXNBB-RUZDIDTESA-N	436.556	1.180	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(NS(=O)(=O)c2ccc(CCCCl)cc2)(C(N)=O)C1	787909474	GCZZOPIAUZFNDE-UHFFFAOYSA-N	431.942	1.611	50	20	IDGD	
COc1cc(F)ccc1NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	788192267	BLYOALNHCCBEIU-UHFFFAOYSA-N	437.493	1.931	50	20	IDGD	
CS(=O)(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cccc(Cl)c2)ccc1Cl	788330974	NZHWNYBOBUVUIC-UHFFFAOYSA-N	430.269	1.797	50	20	IDGD	
CCC[C@H]1CCc2nc(NC(=O)C(=O)NNC(=O)[C@H]3COc4ccccc4O3)sc2C1	789731591	FZBHGRDNTMYBFA-BLLLJJGKSA-N	444.513	1.974	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)[C@H]1CC(=O)c2ccccc21	789813946	KXAUTRMLQUCTBV-FQEVSTJZSA-N	440.931	1.975	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)Nc2cn(C)nc2OC)cc1	789861812	FHQBEAZHWYIYPQ-XNTDXEJSSA-N	449.471	1.722	50	20	IDGD	
CC(=O)N1CCc2ccc(S(=O)(=O)NNC(=O)c3ccc4ccccc4n3)cc2CC1	790050572	UCQDHZNMYHPAOB-UHFFFAOYSA-N	438.509	1.805	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)NCC2([S@](C)=O)CCC2)c2ccccc2c1=O	798120910	BXUGYOPQAZQWCO-HKBQPEDESA-N	447.561	1.832	50	20	IDGD	
COC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c1OC(C)C	799257711	QOYXDVVDVIHKFL-UHFFFAOYSA-N	444.400	1.568	50	20	IDGD	
CCn1ncc(NC(=O)C(=O)NNC(=O)COc2ccccc2OC)c1C(F)(F)F	799258028	YLEPZLMXYROOFJ-UHFFFAOYSA-N	429.355	1.095	50	20	IDGD	
C[C@@]1(C2CC2)NC(=O)N(CC(=O)NNc2cc([N+](=O)[O-])ccc2Br)C1=O	800618705	UOBGZCDURABWGN-HNNXBMFYSA-N	426.227	1.521	50	20	IDGD	
CN(C)CCN1C[C@H](C(=O)NNC(=O)Nc2ccc(Br)cc2Cl)CC1=O	802041212	XUSGHRMKRSKUNN-SNVBAGLBSA-N	446.733	1.665	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	802066597	RUSPIQAITSMMMO-AWEZNQCLSA-N	426.495	1.642	50	20	IDGD	
O=C(NNc1ccc2c(=O)[nH]ccc2c1)c1ccc(S(=O)(=O)NC[C@@H]2CCCO2)cc1	803430869	PGHFRUOKEUOJIL-KRWDZBQOSA-N	442.497	1.742	50	20	IDGD	
COc1ccc([C@]2(C)NC(=O)N(CC(=O)NNc3ccc4c(=O)[nH]ccc4c3)C2=O)cc1	803430876	PMKYIUYGOWUDLA-QFIPXVFZSA-N	435.440	1.447	50	20	IDGD	
CCCN(NC(=O)[C@@H](CCC(N)=O)N1C(=O)c2ccccc2C1=O)C(=O)OC(C)(C)C	804594998	CSJJUMAHSVZYIO-OAHLLOKOSA-N	432.477	1.595	50	20	IDGD	
COc1ccc(CCNC(=O)/C(C#N)=C/c2ccc(F)c(S(N)(=O)=O)c2)cc1OC	806565939	UICMGUABFOMMMT-OQLLNIDSSA-N	433.461	1.756	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(F)c(N3CCCNC3=O)c2)cc1F	806987939	VNNNGUKRSSKWDB-UHFFFAOYSA-N	431.399	1.593	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)c1ccc(C)c(S(=O)(=O)N(CC)CC)c1	807371987	XXZSMOBTTKMUDC-UHFFFAOYSA-N	429.539	1.576	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)cnn1-c1ccc(Cl)cc1	808934784	VIABQNDKUDBZHB-GOSISDBHSA-N	439.859	1.924	50	20	IDGD	
CN(C)c1cc(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)nc2ccccc12	809980595	QJLPYHAAWGHEGB-UHFFFAOYSA-N	426.502	1.669	50	20	IDGD	
CCc1cc(NNC(=O)CNS(=O)(=O)c2cccc(F)c2)nc(-c2ccccn2)n1	810384845	JDTLBYDRNJAEIP-UHFFFAOYSA-N	430.465	1.662	50	20	IDGD	
COC[C@@]1(CNC(=O)NNC(=O)COc2ccccc2OC)OCCc2ccccc21	811851586	JVYVMRXSDWSVPU-JOCHJYFZSA-N	429.473	1.519	50	20	IDGD	
CC(C)Cn1ncc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)c1C1CC1	813034051	WLNYEKSTCHAIOC-UHFFFAOYSA-N	448.549	1.749	50	20	IDGD	
CNC(=O)c1cc(Oc2cccc(NC(=O)C(=O)NNC(=O)CCC(C)C)c2)ccn1	815568924	YVXZWVJYKAHNBA-UHFFFAOYSA-N	427.461	1.756	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)C(=O)Nc1cc(COC)cc(C(=O)OC)c1)c1ccccc1	815570136	SJBOJMBQBHEGPL-GOSISDBHSA-N	427.457	1.899	50	20	IDGD	
COCc1cc(NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)cc(C(=O)OC)c1	815570139	SKFRSYTZLJVPRD-UHFFFAOYSA-N	435.820	1.378	50	20	IDGD	
O=C(NNc1ncncc1F)C(=O)Nc1cc(C(F)(F)F)ccc1N1CCOCC1	815764531	LDBAQMIVVSBKQH-UHFFFAOYSA-N	428.346	1.553	50	20	IDGD	
CC(C)[C@H](NS(=O)(=O)c1ccc(Br)cc1)C(=O)NNc1ncncc1F	817077504	HRGWRPYUNWFGGQ-ZDUSSCGKSA-N	446.302	1.824	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)[C@H]1CCCN(C(=O)c2ccc(F)cc2)C1	825649147	BFZBTRQSMAKWRX-INIZCTEOSA-N	428.464	1.946	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)N1CCCN(C(=O)c2ccccc2F)CC1	913462897	GWNGPCXVUJFEFT-UHFFFAOYSA-N	438.463	1.984	50	20	IDGD	
COc1ccc(-c2nn(CCC#N)cc2/C=C(/C#N)C(=O)NCC(=O)N(C)C)cc1OC	914464851	YHIDWONXSXVVDL-YBEGLDIGSA-N	436.472	1.592	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)CN(C)S(=O)(=O)c1cccnc1	915109613	MGPUMQPJNJMDDR-UHFFFAOYSA-N	445.526	1.595	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)CCOC[C@@H]2CCCO2)c1	915615895	FDUBALONNAGVFM-INIZCTEOSA-N	427.523	1.064	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)[C@H](Cc1cccc(F)c1)n1nnnc1C	915685008	JEJOUKICICBDQR-KRWDZBQOSA-N	442.451	1.530	50	20	IDGD	
Cc1cccc(-n2ncc(C(=O)NNC(=O)N[C@H]3CCS(=O)(=O)C3)c2C(F)(F)F)c1	919889624	QDOOZBSCXBHTIB-NSHDSACASA-N	445.423	1.331	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NCc2cccc(CN3CCO[C@H](C)C3)c2)cc1	920237463	JSNKRSMLNHBTOU-QGZVFWFLSA-N	442.516	1.825	50	20	IDGD	
CCOc1ccc(NC(=S)NNC(=O)c2ccc(N3NC(=O)CCC3=O)cc2)cc1	920297856	CZDGYXFAXXXZNL-UHFFFAOYSA-N	427.486	1.875	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2cnn(-c3ccccc3)c2)cc(OC)c1OC	921017370	LOAGXOMGPVWTGM-UHFFFAOYSA-N	432.458	1.521	50	20	IDGD	
CCCCS(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)c2ccc(OC)cc2)cc1	1116111695	SEOCZTADQLIJAF-UHFFFAOYSA-N	441.531	1.860	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@@H]2CCCCN2Cc2ccncc2)cc1	1116937087	USHWJLJBSMBZEJ-SFHVURJKSA-N	431.518	1.693	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)Cc2csc(NC(=O)c3ccccc3)n2)C[C@H](C)O1	1317782255	MDABXOIXRKVKPQ-GJZGRUSLSA-N	445.545	1.585	50	20	IDGD	
CSc1nnc(CNC(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)s1	1321604724	MBYOBFKZVSRCMK-UHFFFAOYSA-N	430.556	1.738	50	20	IDGD	
COC(=O)c1cc(Cl)cc(S(=O)(=O)NNC(=O)c2n[nH]c3c2CCCC3)c1OC	1325688553	YACXNTZRCFOKFC-UHFFFAOYSA-N	442.881	1.360	50	20	IDGD	
O=C(COc1ccccc1Br)NNC(=O)Cn1cc(C(F)(F)F)ccc1=O	1333126482	AIGPHGBODPSJQJ-UHFFFAOYSA-N	448.195	1.856	50	20	IDGD	
COc1cc(CCC(=O)N2CCO[C@@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)ccn1	1779294736	XSGLJPQWXQNUDE-OAQYLSRUSA-N	435.597	1.704	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@]2(CN(C(=O)/C=N/O[C@H]3CCCCO3)CCO2)C1	1779297256	YUVAXKQQCUKPJP-WPWRXMBVSA-N	427.574	1.197	50	20	IDGD	
CC[C@H](NC(C)=O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CO[Si](C)(C)C)C1	1779538784	IABIVBQOHGCDNE-SQGPQFPESA-N	427.618	1.267	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3[nH]cnc3-c3cccnc3)C2)C1	1780055937	GIHMVBXRSZBCEG-YWZLYKJASA-N	433.896	1.169	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cccc(F)c3[N+](=O)[O-])C2)C1	1781772042	ITIXOTSPTITYIX-SCLBCKFNSA-N	429.832	1.431	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(=O)oc1)C2	1781996461	KQJDMDJBGUYCSN-WPKBUWHJSA-N	427.295	1.551	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)CBr)C2	1782171949	HJTJDMHCAUKUQX-UMPJEAMMSA-N	439.778	1.785	50	20	IDGD	
CN1CCN(C2(C(=O)N3CC[C@H]4OCCC[C@@]4(CNC(=O)C(Cl)Cl)C3)CC2)CC1	1782219249	NSOIUPGYAORELR-DNVCBOLYSA-N	447.407	1.084	50	20	IDGD	
CCn1nc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](Cl)COC)C3)C2)c2ccccc21	1783874813	HKPKGDQOBLILJE-KKSFZXQISA-N	434.924	1.754	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cc([N+](=O)[O-])c(O)cc3C)CCO2)C1	1783880273	GXTJFTJLXXUPFI-KUHUBIRLSA-N	441.868	1.306	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)c1c(Cl)ccc2c1OCO2	1787921539	ZNHPTUYSGBALHE-MEDZGJRSSA-N	445.299	1.262	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccn4nccc4c3)[C@H]2C1	1788449211	NNJRSTBSEKCMLE-CSFVBSKPSA-N	435.322	1.711	50	20	IDGD	
CCn1nc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)Br)C[C@@H]32)cc1C	1789003288	DGLYHPZASDSNBB-HOSILWTGSA-N	427.343	1.588	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc(O)c4ccn(C)c34)[C@H]2C1	1789149840	OMAGAYSJMZJGGC-SJWGOKEGSA-N	434.924	1.890	50	20	IDGD	
CCOC(=O)O[C@@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]21	1790609462	ANHZQQIGHNTFCS-PLGIXQIDSA-N	439.336	1.764	50	20	IDGD	
COc1ccc(Cl)cc1CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21	1790756588	HGWGNYLNEFDWTG-RPZXMPESSA-N	445.343	1.471	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3CCC(CO)CC3)C[C@@H]21	1790957916	CTHKHACSQPYLNK-NLLISWIWSA-N	445.398	1.938	50	20	IDGD	
CC(C)N[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]2C1)C(C)C	1791058109	POVSJKRNSLOZNC-XAJHFOFHSA-N	432.403	1.772	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3cc(C)cc(F)c3)[C@H]2C1	1791363245	NGHJJDLHUYYUCH-KANFNMMFSA-N	426.916	1.910	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1ccc(C2(NC(=O)c3nc[nH]c3[N+](=O)[O-])CCC2)cc1	1791600153	ROQJUTPJWNDUCT-UHFFFAOYSA-N	443.464	1.439	50	20	IDGD	
Cc1ccc(CCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)cc1F	1793527476	MOECBLOGUFPSJB-WKCHPHFGSA-N	438.308	1.699	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1cc(F)ccc1Cl)c1ccc(B(O)O)cc1	1793984409	XQUGBBLOQGCDTN-REPLKXPHSA-N	444.699	1.653	50	20	IDGD	
C[C@@H](Nc1nccs1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@](C)(Cl)CCl)C2	1796414931	HCADKCMSWSAQIX-GUFWIUQMSA-N	435.377	1.769	50	20	IDGD	
COc1ccccc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)CBr)C2	1798815328	QBNGGUYKLJTQKX-VWPFQQQWSA-N	425.323	1.929	50	20	IDGD	
COc1cc(C)ccc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Br	1799352422	WIEJMYVXKYKYAB-VZAMPYOESA-N	429.286	1.897	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc3c(c1)OCO3)C2	1800756267	LMJPWRVWMVRUDO-GNTLTTKYSA-N	439.306	1.331	50	20	IDGD	
C[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CO[Si](C)(C)C)C2	1800863724	MVSWDFBTBQCVSL-PNBKFKSVSA-N	443.617	1.341	50	20	IDGD	
CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](Cl)COC	1800983319	YIZUVPJBBUMJEC-DGADGQDISA-N	447.960	1.133	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)CCNC(=S)NC)[C@@H]1c1cccnc1	1803692073	PFSHIOYFOCUZHE-XYJFISCASA-N	440.013	1.979	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)c2cccc(=O)n2C)[C@@H]1c1cccnc1	1805315057	DDOWWGUTLRBGKQ-JOQOYGCGSA-N	447.333	1.883	50	20	IDGD	
Cc1ccsc1C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1805397598	ULIPAFRXYSGKSV-AZUAARDMSA-N	449.341	1.765	50	20	IDGD	
O=C(c1ccc(-n2cccn2)nc1)N1CCC2(CCCN(C(=O)[C@@H](O)CCl)C2)CC1	1805522736	KRCQIBYEMAJSQO-KRWDZBQOSA-N	431.924	1.712	50	20	IDGD	
Cc1onc(-c2ccncn2)c1C(=O)N1CCC2(CCCN(C(=O)[C@@H](O)CCl)C2)CC1	1805523119	PBDCJLUYRBXDQZ-INIZCTEOSA-N	447.923	1.885	50	20	IDGD	
O=C(CCBr)NC[C@@H]1CCN(C(=O)[C@H]2CCNC(=O)C2)[C@@H]1c1cccnc1	1806346246	DACLXLKRMYTHFQ-DHSIGJKJSA-N	437.338	1.399	50	20	IDGD	
O=C(CCBr)NC[C@H]1CCN(C(=O)Cn2ccncc2=O)[C@H]1c1cccnc1	1806346492	ISJLSUYNIHTNOR-BEFAXECRSA-N	448.321	1.129	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccsc2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1	1807369810	WLNZCLKGAROAIT-FXAWDEMLSA-N	435.314	1.456	50	20	IDGD	
Cc1ccnc(C(=O)NC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)c1	1808540462	YKFOIXWCUNGGLU-AVRDEDQJSA-N	438.532	1.478	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2nc3ncccn3n2)[C@H]1c1cccnc1	1813030395	IVMGAIUUWXXDRQ-PMPSAXMXSA-N	443.895	1.093	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCN2C(=O)C=CC2=O)n[nH]1	1815470029	JKMAKQNLQLRIHW-CQSZACIVSA-N	435.912	1.982	50	20	IDGD	
O=C(Cc1ccsc1)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(B(O)O)cc1)CC2	1815606033	KIXFAZMZTISDJP-HNNXBMFYSA-N	441.343	1.353	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](F)Cl)CC2)c1n[nH]c2c1CS(=O)(=O)C2	1815851687	UWIQMZXMPCQUGF-PWCHPLFNSA-N	447.901	1.055	50	20	IDGD	
C[C@H](C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1)c1ccccn1	1817474238	BGIJEFJMDLRVHE-YWZLYKJASA-N	447.304	1.594	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@H]2C[C@@]2(F)Cl)[nH]n1)c1ccc(B(O)O)cc1	1817475748	RIDGBQUIYAHHFC-WTANOLMUSA-N	434.664	1.320	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](C)N2CCN(C)CC2)n[nH]1	1820789969	SLEWRZOYISJLBR-ZOBUZTSGSA-N	440.976	1.292	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@H](O)CCl)CC2)c1cnc2snnc2c1	1821273283	LTGZEDHQCNZQQF-LDYMZIIASA-N	438.922	1.368	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(=O)ccn3C)sc2C1	1821318521	CSZWNCZIPJMFPQ-VHSXEESVSA-N	439.335	1.851	50	20	IDGD	
C[C@@](O)(CC(=O)O)CC(=O)Nc1cc([C@@H]2CCCCN2C(=O)CO[Si](C)(C)C)[nH]n1	1822410445	PQVYFTUPVLFTAF-LIRRHRJNSA-N	440.573	1.869	50	20	IDGD	
COc1nccnc1C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1	1823001520	HHUAMHAQASJQCU-WRWORJQWSA-N	444.286	1.858	50	20	IDGD	
CC(C)(C)[C@@H](O)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1	1824133020	JHWMXNKJEXQKQJ-UXHICEINSA-N	430.354	1.007	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC([C@@H]2CCCCN2C(=O)CN2CCOC2=O)CC1	1824334169	ZDWPSBBOSVWYOC-KRWDZBQOSA-N	425.602	1.910	50	20	IDGD	
N[C@@H](Cc1cscn1)C(=O)N[C@H]1CCc2nc(NC(=O)C(Cl)Cl)sc2C1	1826099052	OPUOJMXUKDFCMG-CBAPKCEASA-N	434.374	1.885	50	20	IDGD	
CCOC(=O)/C=C/C(=O)N1CCCC[C@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1	1826329036	AUTYXFATGLWRBR-ZGKFYVQTSA-N	436.553	1.098	50	20	IDGD	
O=C(c1cncc(F)c1)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827055741	DIKFOHCIPBESGG-NRFANRHFSA-N	439.296	1.448	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H](C)Br)CC1	1827567408	ULVDYIZKISRZNY-VHDGCEQUSA-N	431.375	1.836	50	20	IDGD	
CC(=O)N1CCN(CC(=O)N2CCCC[C@@H]2C2CCN(C(=O)C(Cl)Cl)CC2)CC1	1828495997	XIJNBSYIRSTBDL-QGZVFWFLSA-N	447.407	1.574	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3nsnc3NC)CCO2)C1	1829748664	CYWXGIQXQBAHEW-SJCJKPOMSA-N	431.946	1.057	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc4c3OCC4)C2)C1	1830361823	FKPQKXJGIJNQAP-QFIPXVFZSA-N	436.936	1.957	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccccc3C(N)=O)C2)C1	1830363533	AQDGZVWULBMVSM-NRFANRHFSA-N	437.924	1.121	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccccc3)C2)C1	1830543138	KLQUHZZPQAISFL-HNAYVOBHSA-N	425.323	1.788	50	20	IDGD	
Cc1cccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)n1	1830916344	NSPLNMBFWUXJAI-OAQYLSRUSA-N	435.597	1.240	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)C3CCC(F)(F)CC3)CCO2)C1	1831010026	ZRJAXHVHACLDFM-MAUKXSAKSA-N	438.899	1.522	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc4[nH]ncc4c3)C2)C1	1831651539	RAPVNPOVNDKJPB-JXFKEZNVSA-N	435.912	1.435	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CC(=O)OC(C)(C)C)CCO2)C1	1831987353	YLEBALJAFDHEAR-QRWLVFNGSA-N	432.945	1.582	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H]3CCCCC3(F)F)CC2)CC1)[C@@H](O)CCl	1833305891	BYPCIDFRMDYPDR-SJORKVTESA-N	435.943	1.983	50	20	IDGD	
CC(C)N1CCC(C(=O)N2CCC(N3CCC(NC(=O)[C@@H](O)CCl)CC3)CC2)CC1	1833308165	KQWNFJDSFSRAHA-FQEVSTJZSA-N	443.032	1.278	50	20	IDGD	
O=C(c1n[nH]c(C2CC2)c1F)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1833686515	JFTHJHBZOAQLNZ-KRWDZBQOSA-N	435.283	1.300	50	20	IDGD	
Cc1cc(CC(=O)NC2CCN(C3CCN(C(=O)[C@H](F)Br)CC3)CC2)on1	1833733141	HCRWWIDPAKTEGG-KRWDZBQOSA-N	445.333	1.788	50	20	IDGD	
Cc1cc(/C=C/C(=O)N2CCOC[C@@]3(C2)CN(C(=O)CCBr)CCO3)no1	1834823026	FEEKHTNFLHBOPL-ZMUQKWFASA-N	442.310	1.238	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCC(N2CCC(NC(=O)Cn3cccn3)CC2)CC1	1834884245	RZHGRFUGCLCJPL-IBGZPJMESA-N	430.380	1.691	50	20	IDGD	
O=C(CCCCn1cccc1)NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1835799059	XPZVYRVBPBGXBU-HXUWFJFHSA-N	439.000	1.830	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3sc(N)nc3C)CCO2)C1	1835801585	WNMLJASJGRHWPX-SCLBCKFNSA-N	430.958	1.511	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC(OC2CCN(C(=O)Cc3ncccn3)CC2)CC1	1837210759	RWNQTAXVUHMYFA-UHFFFAOYSA-N	434.613	1.869	50	20	IDGD	
Cc1cc(/C=C/C(=O)N2CCO[C@@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)no1	1837552309	JLFSDFJCQUCFDM-SGSXCFNPSA-N	425.913	1.718	50	20	IDGD	
CCc1ncccc1C(=O)N1CCOC[C@@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1837712229	KLPDMTGVIXOSQJ-OAQYLSRUSA-N	435.597	1.566	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)C(Cl)(Cl)Cl)C2)C1	1837716052	YRJQHIOOOLUWKP-CQSZACIVSA-N	447.819	1.665	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C#Cc3ccccc3)C2)C1	1839151404	QNFDCTKDHJRGCQ-LEWJYISDSA-N	439.339	1.731	50	20	IDGD	
CCc1ccnc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)c1	1839152239	RNVMSVCKGIXTJG-WOJBJXKFSA-N	444.359	1.950	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccc(O)cn3)C2)C1	1839156208	HQKXIIDEESMADN-RTBURBONSA-N	446.331	1.022	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CC[C@H]3CCOC3)C2)C1	1840035941	AFUHKRZZYLCWFG-MPGHIAIKSA-N	433.343	1.043	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@H]1C(=O)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1840144284	WUTJXLRTLAOHBP-LPMFXHHGSA-N	449.331	1.002	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)Cc3ccco3)C2)C1	1840156135	IXIQXPILGHLUIN-SYNHAJSKSA-N	428.913	1.168	50	20	IDGD	
O=C(c1cccc2c1OCC2)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840187778	WMYGKGYGBHFRMQ-LJQANCHMSA-N	429.300	1.495	50	20	IDGD	
O=C(c1cn2cc(F)ccc2n1)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840188403	HUYJBPXWLIVMDP-GOSISDBHSA-N	445.278	1.347	50	20	IDGD	
CSc1ccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)cc1	1840302731	IHLVYHZAQXPWQW-IEBWSBKVSA-N	430.929	1.942	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)/C=C/c3cnc(C)s3)CCO2)C1	1840520273	XELFNZBQFRUHKZ-HLIGJIKWSA-N	427.954	1.939	50	20	IDGD	
C[C@@H]1[C@@H](C(=O)N2CC3(CCCN3C(=O)[C@H](O)CCl)C2)CCN1C(=O)OC(C)(C)C	1841354501	FBJHAIQTBUGLIJ-QLFBSQMISA-N	429.945	1.435	50	20	IDGD	
O=C(c1cnc(Cl)c(Cl)c1)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843011519	LSNHIXYSFOKPFG-UHFFFAOYSA-N	434.088	1.199	50	20	IDGD	
CC(C)(C)OC(=O)N(CC(=O)N1CCCC12CN(C(=O)[C@H](O)CCl)C2)C1CCCC1	1843319906	BYHFUKVZHUBZLA-MRXNPFEDSA-N	443.972	1.969	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1[C@H](C(=O)N1CCCC13CN(C(=O)[C@@H](O)CCl)C3)C2	1847093014	LYPZXMPBUVPAOW-FZKCQIBNSA-N	441.956	1.578	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc(Cl)cnc1O	1847189181	ISYLILNIWOSGBX-HDBWEKFSSA-N	444.879	1.390	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)c2ccc(C(=O)NNc3nnc(C)c(=O)[nH]3)cc2)cc1	11335045	QHCYGSHIIQZDRL-UHFFFAOYSA-N	428.474	1.364	50	20	IDGD	
COc1cc(C(=O)NNC(=O)COc2cc(C)ccc2C)cc(OC)c1OCC(N)=O	15705563	AHSNHTKYTOBDND-UHFFFAOYSA-N	431.445	1.025	50	20	IDGD	
Cc1c(NC(=O)[C@@H](C)SCC(=O)NNC(=O)C2CC2)c(=O)n(-c2ccccc2)n1C	15794008	NLFSCPYXWZKKSQ-CYBMUJFWSA-N	431.518	1.102	50	20	IDGD	
O=C(COc1ccccc1Cc1ccccc1)NNC(=O)CN1C(=O)[C@H]2CC=CC[C@H]2C1=O	16592757	WSXOULYHDXJAHY-BGYRXZFFSA-N	447.491	1.755	50	20	IDGD	
CC(C)CC(=O)NNC(=O)c1ccc(Cl)c(S(=O)(=O)N2C[C@H](C)O[C@@H](C)C2)c1	22699053	QTQKMJNONYVHJJ-STQMWFEESA-N	431.942	1.945	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1	725873695	PFYCTCKAHDEVBA-UHFFFAOYSA-N	449.508	1.109	50	20	IDGD	
O=C(NCCCNC(=O)c1ccc(Br)cc1)NNC(=O)c1ccccc1O	726711618	RNHVTHJOSSNALI-UHFFFAOYSA-N	435.278	1.919	50	20	IDGD	
COc1cc(Br)c(CNC(=O)NN[C@@]2(C)CCS(=O)(=O)C2)cc1OC	727228619	QCOYOACKKCVQNE-HNNXBMFYSA-N	436.328	1.347	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NC1CCN(c2ccc(C#N)cn2)CC1	727605609	QJUZPZUUYSEGSG-CQSZACIVSA-N	426.452	1.859	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)NNC(=O)c2cccc(C#N)c2)N(C)c2ccccc21	728871826	FXNOPFFUWZCJIC-UHFFFAOYSA-N	428.452	1.990	50	20	IDGD	
CS(=O)(=O)CCNC(=S)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1	729159825	YCDDWBIRRWCLIT-IBGZPJMESA-N	446.598	1.153	50	20	IDGD	
N#CCn1c(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc2ccccc21	729769856	WRRJZQYCOYJVJP-LJQANCHMSA-N	434.408	1.309	50	20	IDGD	
C[C@@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)NNC(=O)CCc2ccccc2O)C1=O	730033552	DQJQRGAPUIFGTP-NRFANRHFSA-N	428.420	1.079	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)[C@@H]1CCCCN1C(=O)c1ccco1	730077242	PPPNNGCFGMSSKS-KRWDZBQOSA-N	432.502	1.858	50	20	IDGD	
C=CCN1CCC(NC(=O)NNC(=O)c2nn(CCCC)c(=O)c3ccccc23)CC1	730125320	SOMYFLODSNJUQN-UHFFFAOYSA-N	426.521	1.791	50	20	IDGD	
CO[C@](C)(C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)c1ccccc1	730159924	YAOPNZCNTQJNDE-NRFANRHFSA-N	431.514	1.794	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Cc2cccc(NS(C)(=O)=O)c2)cc(OC)c1OC	730206676	XVYGCINNRQYXIF-UHFFFAOYSA-N	437.474	1.088	50	20	IDGD	
C[C@H](NC(=O)OC(C)(C)C)C1CCN(CC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)CC1	730266642	ZHJLKFCXKPOXGM-AWEZNQCLSA-N	449.508	1.981	50	20	IDGD	
CC(C)COc1ccccc1C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	731378886	RDQVNUFIRKCAOD-LJQANCHMSA-N	428.441	1.866	50	20	IDGD	
CN(CC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)[C@H]1CCN(c2ccccc2Cl)C1=O	732206797	CXBMXGHITNETDO-KRWDZBQOSA-N	445.863	1.747	50	20	IDGD	
CCc1cc(CNC(=O)/C(C#N)=C\c2cn(CCC(N)=O)nc2-c2ccc(OC)cc2)n[nH]1	732794110	UEKWBRXXYXLJPH-YBEGLDIGSA-N	447.499	1.943	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc(F)cc1)NNC(=O)c1cnn(-c2ccccc2)c1	733170282	WIWLBUUPEBUWOD-UHFFFAOYSA-N	431.449	1.141	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)CN(CCOC)C(=O)OC(C)(C)C)c2ccccc2c1=O	733948021	OEAYDNMMFGKJNK-UHFFFAOYSA-N	447.492	1.061	50	20	IDGD	
CN(C)C(=O)N1CCC(C(=O)NNc2ccccc2S(=O)(=O)NC(C)(C)C)CC1	734252584	XDKYGRHHUGHCGO-UHFFFAOYSA-N	425.555	1.600	50	20	IDGD	
Cc1nc(-c2ccccn2)nc(NNC(=O)CCc2ccc(S(N)(=O)=O)cc2)c1C	734257131	GLAPBQIKHVYVKF-UHFFFAOYSA-N	426.502	1.879	50	20	IDGD	
COc1ccc([C@@H]2[C@@H](C(=O)NNC(=O)COc3ccccc3O)CCC(=O)N2C)cc1	734433286	CDOLEUTXXJAQPT-HRAATJIYSA-N	427.457	1.537	50	20	IDGD	
Cn1cc(N2CC[C@H](NC(=O)NNC(=O)c3ccc(F)cc3Br)C2=O)cn1	735584764	YVSMFZPCHDLIIB-ZDUSSCGKSA-N	439.245	1.071	50	20	IDGD	
CN(CCCNC(=S)NNC(=O)Nc1ccc(S(N)(=O)=O)cc1)c1ccccc1	741870029	LBQAXCPVGLMAQZ-UHFFFAOYSA-N	436.563	1.361	50	20	IDGD	
COCCCOc1cccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1	742033753	RNIQJAVOKBIGHD-UHFFFAOYSA-N	435.502	1.427	50	20	IDGD	
CCC[C@H](NC(=O)Cc1ccccc1)C(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	743830067	MDADUXQUDVQTSW-SFHVURJKSA-N	446.529	1.770	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)CCc2nc(-c3cccs3)no2)c1	744526824	SZYNKZBNJCVVGS-UHFFFAOYSA-N	425.426	1.607	50	20	IDGD	
CC(=O)N/C(=C\c1ccccc1)C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	744621737	PAQHBQXESAIQAJ-CYVLTUHYSA-N	444.513	1.328	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)NC[C@@H]2CCC[C@]23NC(=O)NC3=O)c(C)n1C[C@@H]1CCCO1	744630784	VVGINJGSFILOBM-OUFUBVDASA-N	439.516	1.685	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNS(=O)(=O)c2c(F)cccc2[N+](=O)[O-])cc1	745822742	NFWKBNXQEKHWHG-LLVKDONJSA-N	427.410	1.910	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)c1cc(S(=O)(=O)CC)ccc1F	746096841	ZTGUZWMVCMWQAR-UHFFFAOYSA-N	432.477	1.993	50	20	IDGD	
C[C@]12CCC(=O)N1c1ccccc1C(=O)N2CC(=O)NNC(=O)Cc1cn2ccccc2n1	746550418	MRPBNJYYYNDRMT-HSZRJFAPSA-N	446.467	1.023	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)Cc3ccncc3)CC2)c(C)c1	747324768	NJRODFOPEJQGDJ-UHFFFAOYSA-N	430.530	1.489	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)Nc3ccc([N+](=O)[O-])cc3)cc2)CC1	747823291	GRAUSYHYDFNDMN-UHFFFAOYSA-N	434.478	1.680	50	20	IDGD	
O=C(NNc1ccc(F)cc1Br)[C@@H]1CC(=O)N([C@@H]2CCS(=O)(=O)C2)C1	748073770	YHLQOGGMIOSIAI-MWLCHTKSSA-N	434.287	1.067	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)C(=O)N3CCCC3)nn2-c2ccccc2)cc1	748239496	HTXYTCFHDPZNOO-UHFFFAOYSA-N	433.468	1.931	50	20	IDGD	
CCC[C@@H](NC(=O)NNC(=O)[C@H](C)OCCOC)C(=O)N1CCc2sccc2C1	748633475	ZBGNLLOLCFNCRY-DZGCQCFKSA-N	426.539	1.183	50	20	IDGD	
CC[C@@H](Oc1ccccc1C)C(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1	749330418	NURMSGICNDBNLG-GOSISDBHSA-N	433.530	1.929	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)NNc2nc(Br)cn3ccnc23)c(C)o1	751399573	MYKQSUBQOPTIEC-UHFFFAOYSA-N	429.256	1.058	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)N[C@H]1CCCN(Cc2ccccn2)C1=O	753297405	IFUOASWSNSSEDC-KSSFIOAISA-N	429.452	1.510	50	20	IDGD	
C[C@H](C[S@](C)=O)NC(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	753357762	HVUVBRQDWXJXNA-YSVRNHBLSA-N	441.517	1.099	50	20	IDGD	
COC(=O)c1cc2c(cc1NC(=O)C(=O)NNC(=O)c1ccc3ccccc3c1)OCO2	753840807	OFUTUVPFOXEXOM-UHFFFAOYSA-N	435.392	1.755	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2ccc3c(c2)CCC(=O)N3)cc1OC	753896707	ZZEONJMOLAJBIH-UHFFFAOYSA-N	427.413	1.207	50	20	IDGD	
O=C(NNC(=O)C1(O)CCCCC1)c1cccc(S(=O)(=O)NCc2ccccc2)c1	754973197	FNBUMVKPQFEDMV-UHFFFAOYSA-N	431.514	1.621	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)N[C@@H]1[C@H]2CCO[C@H]2C12CCCC2	755091727	VOMIDHZWQNFWTR-CEMLEFRQSA-N	441.576	1.877	50	20	IDGD	
COc1ccc(N2CCN(CC(=O)NNC(=O)c3ccc(OC)c(OC)c3)CC2)cc1	755361540	JAYXGXFPZNXDNB-UHFFFAOYSA-N	428.489	1.296	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1cccc(NC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1	755514417	HFZVILHYVFCQNL-KRWDZBQOSA-N	448.501	1.756	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)N[C@H]1CCN(c2c(F)cccc2F)C1=O	756213369	VKLHNYXREGZRFU-AWEZNQCLSA-N	442.382	1.363	50	20	IDGD	
CCN1CCN(C(=O)c2ccc(NC(=O)NNC(=O)c3ccccc3OC)cc2)CC1	756252512	GXQUTOFZAYGCMD-UHFFFAOYSA-N	425.489	1.939	50	20	IDGD	
C[C@H](CN1CCOCC1)N(CC(=O)NNC(=O)c1cccc(C#N)c1)Cc1ccccc1	756522505	RKVYPZXJSDTNLS-LJQANCHMSA-N	435.528	1.542	50	20	IDGD	
CS(=O)(=O)CCn1ccc(NC(=O)NNC(=O)CCSc2ccc(F)cc2)n1	756763062	YCEKANDPKCMTCY-UHFFFAOYSA-N	429.499	1.402	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)N[C@H]1CCN(C(=O)CCc2ccccc2)C1	756980629	UPZPLZZXGYSULC-KRWDZBQOSA-N	426.473	1.335	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)Nc1cc(Br)cn(C)c1=O	757597222	IMGVUJMTOQUIBN-VIFPVBQESA-N	427.230	1.907	50	20	IDGD	
COC(=O)c1cncc(NC(=O)NNC(=O)c2cc(-c3ccc(OC)c(OC)c3)[nH]n2)c1	757720988	JRHBAHGUCXDRNE-UHFFFAOYSA-N	440.416	1.742	50	20	IDGD	
CNS(=O)(=O)c1cccc(NC(=O)NNC(=O)[C@@H](C)Oc2ccc(C(C)=O)cc2)c1C	757727377	QJRXSJVORVCOGY-CQSZACIVSA-N	448.501	1.726	50	20	IDGD	
O=C(COc1ccc(F)cc1Cl)N1CCN(S(=O)(=O)CBr)CC1	758535657	PWUAVAKQSPQMQY-UHFFFAOYSA-N	429.695	1.684	50	20	IDGD	
Cn1c(=O)nc(O)c2c(C(=O)N3CC=C(C#N)CC3)cc(-c3ccc4c(c3)OCO4)nc21	760010156	VLNQHSBFFFNBHH-UHFFFAOYSA-N	431.408	1.726	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)c1noc(-c2ccccc2)n1	761795665	DCCSZKHCRBTXSB-LBPRGKRZSA-N	433.428	1.689	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)C(=O)Nc1cc(F)ccc1OCC(F)(F)F	763550661	JGIHZCCGRVVFGS-UHFFFAOYSA-N	443.309	1.895	50	20	IDGD	
CS(=O)(=O)c1ccc(F)c(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)c1	763601680	TVXQWMMBNOBXCU-UHFFFAOYSA-N	445.432	1.019	50	20	IDGD	
CCN(CC)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2cc(C)cc(C)c2)cc1	763645739	YWFNDIZKYAXCBB-UHFFFAOYSA-N	440.500	1.950	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(-n3cncn3)nc2)cc1	763767348	HTUOXJNPLITTBW-UHFFFAOYSA-N	437.460	1.487	50	20	IDGD	
Cc1ccnc(Oc2ccc(NC(=O)C(=O)NNC(=O)COc3ccccc3C#N)cc2)n1	763813287	JUVIDHVATVJKNM-UHFFFAOYSA-N	446.423	1.614	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1cc2c(cc1Cl)OCCO2	763849842	KWEIAJOTNURZHZ-JTQLQIEISA-N	437.811	1.804	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccccc2O[C@H](C)C#N)cc1	763862455	XMAUCUNIMNBDEQ-HUUCEWRRSA-N	440.456	1.930	50	20	IDGD	
C#CC[C@@]1(C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)CCCN1C(=O)OC(C)(C)C	763920789	RIUAYTJGUVPKAB-JTSKRJEESA-N	429.473	1.767	50	20	IDGD	
Cc1ccc(-n2nc(NC(=O)C(=O)NNC(=O)c3cc(Br)c[nH]3)cc2C)cc1	763996164	CRZSFOAXXIRYTD-UHFFFAOYSA-N	445.277	1.979	50	20	IDGD	
Cc1cc(Sc2ccccc2)ccc1NC(=O)C(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1	764002264	LALGABSSMUJGAO-AWEZNQCLSA-N	447.538	1.667	50	20	IDGD	
COC(=O)N(C)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)on2)cc1	764016112	HBMUPKKJOMVQOY-UHFFFAOYSA-N	437.412	1.944	50	20	IDGD	
CNC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccc3ccccc3c2)cc1	764091240	GVMAKEFCGUGZHC-UHFFFAOYSA-N	434.452	1.293	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc(N4CCOC4=O)cc3)n[nH]2)cc1	764110208	HKBCRSDBLRXENG-UHFFFAOYSA-N	448.439	1.741	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccnn3-c3ccncc3)n[nH]2)cc1	764111836	UMBGFKNKXFYOFO-UHFFFAOYSA-N	430.428	1.366	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1O)C(=O)Nc1cccc(Cn2cccnc2=O)c1	764126015	DRKBRMKXSWRVGP-UHFFFAOYSA-N	441.831	1.050	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2ccccc2O[C@@H]2CCOC2)cc1	764126525	IORLMSWWVNBJNZ-QGZVFWFLSA-N	427.457	1.582	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccccc2OC[C@H]2CCCCO2)c1O	764131797	OJOBWTMKEPITFQ-CQSZACIVSA-N	443.456	1.748	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(F)c(NC(C)=O)c2)o1	764139275	QSMWLYJIJYMEGT-UHFFFAOYSA-N	433.440	1.619	50	20	IDGD	
CC(C)OC(=O)NCc1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)cc1	764151962	BAERJUJBYFXKGX-SFHVURJKSA-N	440.456	1.411	50	20	IDGD	
CCN(CC)CCOc1ccccc1NC(=O)C(=O)NNC(=O)[C@H]1Cc2ccccc2O1	764166576	COGGJUAVWALNFP-HXUWFJFHSA-N	440.500	1.497	50	20	IDGD	
Cc1ncsc1C(=O)NNC(=O)C(=O)Nc1cc(Cl)ccc1C(=O)N1CCCC1	764245928	BCWRWOXGYXLTBE-UHFFFAOYSA-N	435.893	1.741	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(F)c1	764297300	NQGNKZKHBUKBDI-UHFFFAOYSA-N	436.403	1.708	50	20	IDGD	
CCCS(=O)(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)Cc2ccccc2F)c1	764314066	RGRFPTCJZPKTHZ-UHFFFAOYSA-N	436.465	1.306	50	20	IDGD	
COCCNS(=O)(=O)c1c[nH]c(C(=O)NNC(=O)Cc2ccc3ccccc3c2)c1	764316555	GGBTWLGEYQYGLX-UHFFFAOYSA-N	430.486	1.096	50	20	IDGD	
CN(C)c1nnc(-c2ccc(NC(=O)C(=O)NNC(=O)CCCc3cccs3)cc2)o1	764340869	JUBKZEAUHWSKSB-UHFFFAOYSA-N	442.501	1.973	50	20	IDGD	
COc1ccccc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccc(OC)c(OC)c2)[nH]n1	764378532	JQHDATGCOVZDFD-UHFFFAOYSA-N	439.428	1.502	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cnc(C)s3)n[nH]2)cc1OC	764379034	OXHXKJCAQWHKNW-UHFFFAOYSA-N	430.446	1.259	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)CSc2ccccc2OC)ccc1F	764393180	DBJJIYCUJQVQHY-UHFFFAOYSA-N	435.433	1.499	50	20	IDGD	
O=C(NNC(=O)[C@H]1COCCO1)C(=O)Nc1cccc(OCc2ccc(Cl)cc2)c1	764426066	SMDKIPCXEUVGGQ-QGZVFWFLSA-N	433.848	1.420	50	20	IDGD	
C[C@H](CC(=O)NNC(=O)CSc1ccccc1O)/N=C1/NS(=O)(=O)c2ccccc21	765249260	QOYIFXKTYVMYQL-GFCCVEGCSA-N	448.526	1.149	50	20	IDGD	
O=C(CSc1nnc(-c2ccco2)n1Cc1ccco1)NNC(=O)N1CCOCC1	765331193	PGZAALKATBGQNF-UHFFFAOYSA-N	432.462	1.345	50	20	IDGD	
CNS(=O)(=O)c1ccc(C)c(C(=O)NNC(=O)c2cc(-c3cc(C)ccc3C)[nH]n2)c1	765574968	CVEMONQQHCORBZ-UHFFFAOYSA-N	441.513	1.985	50	20	IDGD	
CS(=O)(=O)Nc1cccc(CC(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)c1	765618858	PTBMYFMWPZMBLL-UHFFFAOYSA-N	431.449	1.591	50	20	IDGD	
Cc1nc(-c2ncccn2)nc(O)c1CC(=O)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	768275723	CEVZXCHEXWBXFF-UHFFFAOYSA-N	448.418	1.481	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)Cn1c(S)nnc1-c1cccs1	768630763	WLUJCDBUEJNNFP-UHFFFAOYSA-N	439.544	1.851	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)NCCNC(=O)c3ccc(F)cc3)nc21	770354847	GZOJGLQHAZRPHI-UHFFFAOYSA-N	430.444	1.482	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)CNS(=O)(=O)c1ccc2ccccc2c1	771936513	BNAOLGDBMWGTRX-CQSZACIVSA-N	435.502	1.243	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H]2CCO[C@@H](C(C)C)C2)c1	772607646	OTZOPIQFDHBINI-FUHWJXTLSA-N	440.566	1.865	50	20	IDGD	
CCc1nn(C)c(OC)c1CNC(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12	772608691	ICTPALLEXXSUBO-UHFFFAOYSA-N	441.492	1.426	50	20	IDGD	
Cc1cc(C)c(CC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c(C)c1	773161784	SNBURNOZFITADY-UHFFFAOYSA-N	445.541	1.636	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NNC(=O)[C@H]2CSCN2C(=O)C(C)(C)C)C1	773418368	TYAJXJMQOUIJEX-ZIAGYGMSSA-N	442.582	1.729	50	20	IDGD	
O=C(NNc1ccc2ccccc2n1)C(=O)Nc1ccc(F)c(S(=O)(=O)NC2CC2)c1	773661453	KTLGZGQCEWKWLU-UHFFFAOYSA-N	443.460	1.896	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(OC)c(NC(=O)C(=O)NNc2ccc(C#N)cc2)c1	773702583	WYNNOFRKOROEAE-UHFFFAOYSA-N	445.501	1.679	50	20	IDGD	
O=C(NNc1c(F)cccc1F)C(=O)Nc1cccc(Cn2nc3ccccn3c2=O)c1	773709751	PTQCXNGAUQXRFI-UHFFFAOYSA-N	438.394	1.904	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNc2c(F)cccc2F)cc(S(C)(=O)=O)c1	773714561	VYEALTOWUPWMLF-UHFFFAOYSA-N	441.412	1.627	50	20	IDGD	
Cc1cc(S(N)(=O)=O)ccc1CNC(=O)NNC(=O)Cc1cccc2ccccc12	775203819	XGFZNJFLIMLDHU-UHFFFAOYSA-N	426.498	1.869	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)c2cn(-c3cccc(Cl)c3F)nn2)nc2ccccc21	776337262	OYIDDGOZJNWTEV-UHFFFAOYSA-N	427.827	1.950	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)C2CCN(C(=O)COc3ccccc3)CC2)c1	776533547	FWIXCXYVPHRZHN-UHFFFAOYSA-N	431.514	1.851	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2N2CCOCC2)c1	776560231	OYYDFMBPIPGOQW-UHFFFAOYSA-N	428.445	1.888	50	20	IDGD	
COCCO[C@H]1COCC[C@H]1NC(=O)NNC(=O)Nc1cc(Cl)c(OC)cc1OC	776939808	RZRPDVAAIFFMDW-WBMJQRKESA-N	446.888	1.513	50	20	IDGD	
CC(C)c1ccc(S(=O)(=O)NCCC(=O)NNC(=O)CNC(=O)OC(C)(C)C)cc1	778436749	PDGCBQFKMKLBMJ-UHFFFAOYSA-N	442.538	1.151	50	20	IDGD	
CC[C@@H](C)C(=O)NNS(=O)(=O)c1ccc(I)c(C(=O)OC)c1	778558013	OKMZBRZEWBBEKM-MRVPVSSYSA-N	440.259	1.433	50	20	IDGD	
COc1cc2ncn(CCCC(=O)NNc3cc(Cl)nc(N)n3)c(=O)c2cc1OC	779374845	HIFMKFYMYFYTQF-UHFFFAOYSA-N	433.856	1.363	50	20	IDGD	
Cc1cccnc1C(F)(F)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	780851548	QUJJIZLLFMEFRF-UHFFFAOYSA-N	438.456	1.728	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H](C)[C@H]2CCCOC2)c1	780864080	ZOSJEIDDFJMBHT-HOCLYGCPSA-N	426.539	1.476	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)CCc1ccc([N+](=O)[O-])cc1[N+](=O)[O-]	781575416	HYUFJFWRXZHXIJ-UHFFFAOYSA-N	440.210	1.998	50	20	IDGD	
O=C(NNC(=O)C(=O)NC1CC1)C(=O)Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1	782966713	OUILJDPBTZBLBE-UHFFFAOYSA-N	426.273	1.089	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)ccc1C	784213882	QMUQZEZNTGYNHY-UHFFFAOYSA-N	446.485	1.304	50	20	IDGD	
COc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NNc1nc(C(F)(F)F)cs1	785148239	ZUOFHWWTZKTLSE-UHFFFAOYSA-N	431.396	1.954	50	20	IDGD	
COCCc1ccccc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	786425169	AKYUVAQARCXSIR-UHFFFAOYSA-N	432.502	1.398	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cc(-c3ccsc3)nn2C)cc1	787540982	HXJUUVSCVXNNNR-UHFFFAOYSA-N	429.458	1.322	50	20	IDGD	
COC[C@H](C)Oc1ccc(Cl)cc1NC(=O)C(=O)NNc1ccc(-n2cccn2)nn1	787897826	CIDNRTGNWSBAPN-LBPRGKRZSA-N	445.867	1.811	50	20	IDGD	
CC1(C)Cc2cccc(NC(=O)C(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)c2O1	789584544	MOOSGFTWILWTIN-UHFFFAOYSA-N	431.470	1.203	50	20	IDGD	
C[C@](O)(CN1C(=O)NC2(CCCC2)C1=O)C(=O)NNc1nc(-c2ccc(Cl)cc2)no1	790070988	OBZIABPNOHMTPT-SFHVURJKSA-N	448.867	1.449	50	20	IDGD	
CC(=NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)c1ccnc(O)c1	790288031	NXRUOVLBJOABPC-UHFFFAOYSA-N	432.502	1.281	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)ccc1C(F)(F)F	790951494	GUXQARHZRMJCRK-UHFFFAOYSA-N	449.349	1.089	50	20	IDGD	
COc1cc(C(F)(F)F)ncc1NC(=O)C(=O)NNC(=O)c1cccc(OC)c1O	792267381	FUBGYGZQIZJOSS-UHFFFAOYSA-N	428.323	1.223	50	20	IDGD	
CCc1c(NC(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)cnn1-c1ccccc1Cl	792483646	DFIKRABCRNIAKU-NSHDSACASA-N	425.898	1.676	50	20	IDGD	
COc1ccc([N+](=O)[O-])cc1CNC(=O)NNC(=O)CNC(=O)OCc1ccccc1	792824170	KVUXLLZXDWHBIR-UHFFFAOYSA-N	431.405	1.360	50	20	IDGD	
CN(C)N(C(=O)c1cc(NS(C)(=O)=O)cc(C(F)(F)F)c1)[C@H]1CCS(=O)(=O)C1	792855261	QTGSRDRUUFXMRR-ZDUSSCGKSA-N	443.469	1.183	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)N2CCN([C@H](C)C(=O)Nc3cccc(F)c3)CC2)n1	793220785	PQCDOJMQKJZXTF-OAHLLOKOSA-N	428.468	1.528	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)Cc3ccc4n[nH]cc4c3)cc2)CC1	793709513	AOJSQAMCDGSIQP-UHFFFAOYSA-N	428.518	1.185	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(CC(=O)NNC(=O)Nc2ccc(OC(F)F)cc2)cc1	798126892	KSOPBFHOGSKVCB-UHFFFAOYSA-N	442.444	1.934	50	20	IDGD	
NS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cc(-c3ccco3)nc3ccccc23)nc1	798316993	PDIGJANJJIUJDR-UHFFFAOYSA-N	437.437	1.612	50	20	IDGD	
CC1=C(C(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)[C@@H](C)n2ncnc2N1C	798981311	GPTWVWOHEXYETD-SNVBAGLBSA-N	430.412	2.000	50	20	IDGD	
Cc1cc(O[C@H]2CCN(C)C2=O)ccc1NC(=O)C(=O)NNc1ncnc2ccsc12	799260840	AVGHOKHXRPOFCC-HNNXBMFYSA-N	440.485	1.691	50	20	IDGD	
O=C(NCCN1CCCS1(=O)=O)NNc1ccc(-c2cccc(C(F)(F)F)c2)nn1	805027878	SPVNUVOCLSYXEE-UHFFFAOYSA-N	444.439	1.824	50	20	IDGD	
COc1cc(NC(=O)NNc2ccc(-n3ccnc3)nn2)ccc1S(=O)(=O)N(C)C	806368015	AGSLVKHEAIBQTE-UHFFFAOYSA-N	432.466	1.070	50	20	IDGD	
O=C(NNC(=O)c1c[nH]c2ccccc12)C(=O)Nc1ccc(F)c(N2CCCNC2=O)c1	806972838	NWXGYSLYEYVVRV-UHFFFAOYSA-N	438.419	1.626	50	20	IDGD	
COC(=O)c1c(C)csc1NC(=O)C(=O)NNC(=O)c1cc(-c2cccs2)[nH]n1	806979017	LAJWDBVJDHQLNB-UHFFFAOYSA-N	433.471	1.694	50	20	IDGD	
O=C(NNC(=O)c1cc2ccccc2o1)C(=O)Nc1cc(F)c(N2CCOCC2)cc1F	806979923	KFJQHMBMLGAALX-UHFFFAOYSA-N	444.394	1.947	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)C(=O)Nc1nc(C2CCOCC2)cs1	806980901	YPPPSMPJAAAVCB-UHFFFAOYSA-N	436.515	1.621	50	20	IDGD	
Cc1cc([N+](=O)[O-])ccc1NNC(=O)C(=O)Nc1cccc(CN2C(=O)CNC2=O)c1	807456891	JRJRZSKTSYPFDP-UHFFFAOYSA-N	426.389	1.037	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2ccc3c(C)cc(O)nc3c2)cc1	809143007	IWQWXEAIWZJHPE-UHFFFAOYSA-N	442.497	1.639	50	20	IDGD	
CC(=O)c1cccc(S(=O)(=O)NCC(=O)NNC(=O)c2cccc3cccnc23)c1	810269569	JESLYFAORIIUPA-UHFFFAOYSA-N	426.454	1.177	50	20	IDGD	
COC(=O)c1c(F)ccc(NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1F	810339867	QZMJHKJKCDOVEX-UHFFFAOYSA-N	434.403	1.611	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3cccc4c3OCC(=O)N4)cc2C1	810385196	XOWVGWGIWXCFOT-SNVBAGLBSA-N	428.470	1.604	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)Cc2ccc(C(=O)NN=Cc3cnn(C)c3N)cc2)cc1	814702741	YUXLJXNOMIVRMS-UHFFFAOYSA-N	440.529	1.895	50	20	IDGD	
N#Cc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(OCc3ccccc3)cc2)nc1	815565062	BGHCRGUGWRSIMD-UHFFFAOYSA-N	445.435	1.697	50	20	IDGD	
CC(C)(C)CC(=O)NNC(=O)C(=O)Nc1ccc([N+](=O)[O-])c(I)c1	815568537	LTSHTPILUAWFGP-UHFFFAOYSA-N	448.217	1.722	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1ccc(O[C@@H]2CCOC2)cc1	815751491	BKCMJNAMOMTGEN-MRXNPFEDSA-N	448.501	1.186	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)C(=O)Nc2cc(C)nn2CCC#N)c1	815866844	QZABVTPKNCJUOO-UHFFFAOYSA-N	449.265	1.736	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)CN1C(=O)C(F)(F)Oc2ccccc21	815890782	PZOHGUMQRBVFCS-UHFFFAOYSA-N	442.419	1.457	50	20	IDGD	
CN(C)c1nc(N)nc(C(=O)NNC(=O)c2ccc(COc3ccc(Cl)cc3)cc2)n1	816812620	VMHYUMRRULVJHI-UHFFFAOYSA-N	441.879	1.827	50	20	IDGD	
O=C(COC(=O)CSc1cnc2ccccc2n1)NNC(=O)c1ccc([N+](=O)[O-])cc1	844255872	QNKXCIPNDMDNEM-UHFFFAOYSA-N	441.425	1.635	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(C(F)(F)F)cn2)cc1OC	844423729	WRSVMDAIPLRQJF-UHFFFAOYSA-N	427.335	1.736	50	20	IDGD	
COC[C@@H](C)n1c(C)cc(/C=C(/C#N)C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c1C	894394035	IPUNJPIDOMWIGI-SMLKNPDNSA-N	448.487	1.656	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)NCC(=O)Nc2ccc3nc(O)[nH]c3c2)c1C	914757432	NQMXOCARTNLCGB-SXGWCWSVSA-N	436.472	1.995	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCCOc2ccccc2OC)c2ccccc2c1=O	915890092	UHWQNPGSEYKAQN-UHFFFAOYSA-N	425.445	1.448	50	20	IDGD	
O=C(CN1CCCC1=O)NNC(=O)c1ccc(NC(=O)c2ccc(Br)o2)cc1	916148170	ZCAPESSGLQLUQP-UHFFFAOYSA-N	449.261	1.678	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc([C@@H](C)NCC(=O)NNC(=O)c2ccccc2)cc1	916149269	WUOVMWWCMKZXAV-MRXNPFEDSA-N	432.546	1.829	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)N[C@@H](C)CCc1ccc(O)cc1	916235403	RJQFNZTZBKUXKI-ZDUSSCGKSA-N	433.534	1.959	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)NC1CCN(C(=O)c2ccccc2F)CC1	916379369	CLPXZONLKOADGD-UHFFFAOYSA-N	439.447	1.711	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)c1ccnc(-n2cncn2)c1	917500921	AHWBFWBMJKSZBN-NSHDSACASA-N	431.250	1.653	50	20	IDGD	
O=C(NCC(F)(F)F)c1cccc(S(=O)(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c1	917714177	YESZOECOKPZWQW-UHFFFAOYSA-N	446.363	1.510	50	20	IDGD	
COc1ccc(CNC(C)=O)cc1S(=O)(=O)NNC(=O)c1cc(C)nc2ccccc12	917719774	IGCSFLVHNAWSSU-UHFFFAOYSA-N	442.497	1.811	50	20	IDGD	
O=C(COc1ccccc1CNC(=O)NNC(=O)c1ccccc1F)NC[C@H]1CCCO1	918217535	JISIUYKWJRJKJC-MRXNPFEDSA-N	444.463	1.644	50	20	IDGD	
O=C(NNC(=O)C1=NN(c2ccccc2)[C@H](c2ccccc2)C1)N[C@H]1CCS(=O)(=O)C1	919888909	HPJYRCNKTUVDTM-LPHOPBHVSA-N	441.513	1.512	50	20	IDGD	
C[C@@H]1CCCC[C@H]1CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	920241856	HAUMFFZBCRIEAL-WBVHZDCISA-N	438.550	1.478	50	20	IDGD	
CCN(CC)C(=O)c1ccc(S(=O)(=O)NNC(=O)c2cc(OC)cc(OC)c2)cc1	920309383	VPWOBWBZVVXCLB-UHFFFAOYSA-N	435.502	1.809	50	20	IDGD	
O=C(COC(=O)c1ccc(OCC2CC2)cc1)NNC(=O)[C@H]1COc2ccccc2O1	920416539	MWYKIVTVSCTNTD-LJQANCHMSA-N	426.425	1.620	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)Nc1cccc(CN2C(=O)CNC2=O)c1	920931392	NDKVERSDAMHSFE-UHFFFAOYSA-N	441.444	1.369	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)Nc1cccc(CN2CCC[C@@H]2C(N)=O)c1	920932697	BCXWHAWMCQTGLC-AUUYWEPGSA-N	443.479	1.896	50	20	IDGD	
C[C@@H]1CN(c2ccc(NC(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)cc2F)C[C@@H](C)O1	920933179	RMMRPWFEHCXDGS-JHJVBQTASA-N	428.486	1.027	50	20	IDGD	
Cn1ncc(I)c1C(=O)NNC(=O)c1ccc(Br)cc1	1261232289	ZQSIWTYMSGRBLX-UHFFFAOYSA-N	449.046	1.862	50	20	IDGD	
O=C(CNS(=O)(=O)c1c[nH]c2ncccc12)NNc1cncc(Br)c1	1322457726	GUKULVWTXFXSJK-UHFFFAOYSA-N	425.268	1.142	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)Nc2cnn(C[C@@H]3CCCO3)c2)CC1	1323828895	FBUKKYWQBJBZFD-INIZCTEOSA-N	436.513	1.862	50	20	IDGD	
C[C@@H]1CN(S(=O)(=O)c2ccc(C(=O)NNc3nncc(N)c3Cl)cc2)C[C@@H](C)O1	1324009516	RWCZZCKQRLHYAE-GHMZBOCLSA-N	440.913	1.267	50	20	IDGD	
CN1CCC(n2ccc(NC(=O)NNC(=O)C3CCN(C(=O)OC(C)(C)C)CC3)n2)CC1	1343982289	SRVHJUUOASHBQY-UHFFFAOYSA-N	449.556	1.950	50	20	IDGD	
Cc1ccc(NC(=S)NNC(=O)c2ccc(S(=O)(=O)NC[C@H](C)O)cc2)cc1C	1346621224	SSWDDVGFWSGFHM-AWEZNQCLSA-N	436.559	1.594	50	20	IDGD	
Cn1c(=O)n(CC(=O)N2CC[C@@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)c2ccccc21	1778161095	CAFAQYOTKWRVHU-JOCHJYFZSA-N	448.951	1.435	50	20	IDGD	
C[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1C(=O)N1CC[C@]2(CN(C(=O)[C@@H](F)Cl)CCO2)C1	1778348834	HHBFVKWTEYDAIQ-UJKGCTCZSA-N	447.935	1.854	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Br)C2)c1n[nH]cc1[N+](=O)[O-]	1779603198	NJKYFXTUPJXXKX-IXPVHAAZSA-N	448.249	1.136	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(CN(C(=O)c3ccc[nH]3)CCO2)C1	1780097779	JTIAIAAVIZQXNN-OAQYLSRUSA-N	442.428	1.606	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)ncc1[N+](=O)[O-]	1781329899	NFYKCPPUXBURRT-CJNGLKHVSA-N	445.245	1.432	50	20	IDGD	
Cc1c(F)ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](F)Br)C3)C2)c1N	1781330805	GOEJCQDGRTXWDF-WMLDXEAASA-N	432.265	1.850	50	20	IDGD	
CC(=O)N/C(C)=C/C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Br)C2	1781463800	QFHBWZDVAZPMGH-NLLZUWNASA-N	434.306	1.231	50	20	IDGD	
CCn1ccc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](C)Br)C2)n1	1781996857	WAPWOKHUCABRRK-JCKWVBRZSA-N	427.343	1.814	50	20	IDGD	
C[C@@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)Br)C1)n1ccnc1	1781997143	GGIFTCSFWVNNRH-BASYENTBSA-N	427.343	1.741	50	20	IDGD	
CC(C)C1(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cccc(B(O)O)c2)C3)CCC1	1782805638	WKUKQLHISSSUIH-NFBKMPQASA-N	442.365	1.320	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](C)n1cc(C)cn1)CCO2	1783354525	SKYAIPYZUXDTPP-VKJFTORMSA-N	427.343	1.756	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)C(Cl)Cl)C[C@@H]32)c1	1783748913	SICGWBDXEGIXSQ-QEJZJMRPSA-N	449.356	1.487	50	20	IDGD	
O=C(CSc1ccccc1[N+](=O)[O-])N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1783781450	HOSSINNTGWGNJI-RDTXWAMCSA-N	443.909	1.117	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)C[C@H]3OCCc4ccccc43)CCO2)C1	1783871533	SSIUQZHWLVXGPQ-NNMXDRDESA-N	436.936	1.774	50	20	IDGD	
C[C@H]1Oc2ccc(C(=O)N3CCO[C@]4(CCN(C(=O)C(Cl)Cl)C4)C3)cc2NC1=O	1783948282	HRBSCPKPFNURDG-WYRIXSBYSA-N	442.299	1.653	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H]3CCOC3)C2)C1	1784722132	IQQLGBOXXMFYAW-YCRPNKLZSA-N	447.444	1.000	50	20	IDGD	
O=C(c1ccc(N2C(=O)C=CC2=O)cc1)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Cl)CCO2	1785221715	MRYSBLPFGKZZDY-PXNSSMCTSA-N	435.839	1.094	50	20	IDGD	
O=C(COc1ccc(F)cc1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21	1786489664	GQNXMRMKAUROPL-SIUGBPQLSA-N	447.276	1.875	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC1(c2ccc(NC(=O)CCN3C(=O)C=CC3=O)cc2)CCC1	1786554182	SVYGWBMDSBDJPC-MRXNPFEDSA-N	433.892	1.689	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)[C@@H](O)c1ccccc1	1786666578	WREPDYZSBSYXOT-UVPYHEFZSA-N	429.286	1.390	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C[C@@H](N)c3cccnc3)[C@H]2C1	1786928456	KDPJBVCFHHAIAZ-GHHWKCCRSA-N	443.375	1.688	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)n3cccc3C=O)[C@H]2C1	1786995916	ZGEHNCNUFXQVQV-IAVJCBSLSA-N	425.913	1.095	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc4n(n3)CCCO4)[C@H]2C1	1788351804	MMSMGVXNDHFPNC-ABHRYQDASA-N	441.326	1.042	50	20	IDGD	
Cc1cnc2c(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]4C3)cnn2c1	1788764260	ICHRHRYGGVTLAN-SZMVWBNQSA-N	445.596	1.483	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)c1cc(C(F)(F)F)ccn1	1788964199	RFGIPYCSTPRCOQ-LVGORTOPSA-N	435.830	1.293	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CCC[C@@H](C(=O)OC)C3)C[C@@H]21	1789864423	BTUWBMOUGOWDAW-ZMSHIADSSA-N	428.957	1.963	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)COc3cccnn3)C[C@@H]21	1789872213	DMCXDYHDYRCUEF-NUXNZHGMSA-N	431.320	1.071	50	20	IDGD	
CC(C)(C)OC(=O)CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]2C1	1789921398	GHXAPNYKOJIWQL-JUFZMCDQSA-N	437.306	1.388	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc[nH]3)C[C@@H]21	1790693365	HVPKSVPORNQNML-XSNPIBBVSA-N	441.438	1.888	50	20	IDGD	
CC(=O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](Br)Cc3ccccc3)[C@H]2C1	1790780801	SWZKXWWABKLREL-XSLAGTTESA-N	437.334	1.561	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3cccc(OC)n3)C[C@@H]21	1791252115	CIBKEGTYMQDWSX-OWLYRPNTSA-N	439.940	1.256	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)n3cccc3C=O)C[C@@H]21	1791254890	VWECFUTZOUNUOU-XWJBARJFSA-N	425.913	1.095	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(-c4cc[nH]n4)cc3)C[C@@H]21	1791257297	XHILPLAOCAIPRI-JPLJXNOCSA-N	446.935	1.924	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cn2nc(C)sc2n1	1793662329	ITYLOGPDUJHCGG-LMWOUKEDSA-N	425.942	1.249	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)COCCOCCOCCOC)C2	1793684552	HNJWFHHORHZYLZ-FCGDIQPGSA-N	448.988	1.728	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)[C@@H]1CNc2ccccc21	1795621197	VKAYATCLHUYPAI-PDGPNTQRSA-N	426.286	1.476	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](N)c1cccc(Cl)c1	1796076980	RXKWTGKIZFRQCD-CLWJZODNSA-N	435.956	1.351	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1csc(N)n1	1796112324	CAMCFETTWBJZGR-PNEZKNQNSA-N	429.506	1.111	50	20	IDGD	
Cc1cc(NC(=O)CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@](C)(Cl)CCl)C3)no1	1796420061	YCPFAKAUQBZGER-GWLLULGVSA-N	447.319	1.138	50	20	IDGD	
COc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Cl)C3)c([N+](=O)[O-])cc1O	1798595895	YDQZEVMKRJWREJ-WUEYEGCSSA-N	431.804	1.047	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](Br)Cc1ccccc1)C2)[C@H]1C[C@H]1F	1799181512	WAWOTSUDZBSREV-ZKZVPCBQSA-N	439.325	1.940	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1Cc3ccccc3CN1)C2	1799275272	OBLJHHXSRKJENS-UONLAYADSA-N	440.371	1.527	50	20	IDGD	
COc1cccnc1CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)Br	1800756750	HRVMODYDNYKEKY-ZUMXRPEOSA-N	440.338	1.396	50	20	IDGD	
COc1ccc(F)cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)Br	1800763189	SAVYDJLEZXXFMO-OVZMXSCWSA-N	429.286	1.821	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1c(F)ccc(F)c1F)C2	1800971041	OOFPGZTZUGBDAZ-IMEWIIRVSA-N	434.842	1.490	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)Sc1ccccn1)C2	1800980934	HMUZDXUSYDFIPR-XGYYKPKNSA-N	427.954	1.406	50	20	IDGD	
CC(C)c1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCC(=O)NN(C)C)cc1	1801011857	MAEDTKAHHAREDD-HATOLVCRSA-N	430.549	1.386	50	20	IDGD	
Cc1cc(C(N)=O)cc(C)c1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(Cl)Cl	1801016871	ADVHQHHVWICYOR-AGGWBTHJSA-N	428.316	1.409	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@H]1CCN(C(=O)Cn2ccnn2)[C@@H]1c1cccnc1	1803008623	MKCRXYUQYDZIRO-FRFSOERESA-N	435.326	1.410	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)/C=N/O[C@@H]2CCCCO2)[C@H]1c1cccnc1)[C@H](O)CCl	1803142753	IDTILXNXECIRQL-MNNSWCIVSA-N	438.912	1.216	50	20	IDGD	
CN(C)c1cncc(C(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)c1	1804848833	VEMGQQMAVBZKGV-KFKAGJAMSA-N	431.924	1.462	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC2(CCCN(C(=O)[C@@H]3CCC(=O)NC3)C2)CC1	1804970609	CNZGJKKRGPBXED-LSDHHAIUSA-N	428.371	1.775	50	20	IDGD	
Cc1ncccc1C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1805496023	OUZONPQMWPAXBK-UGKGYDQZSA-N	444.300	1.098	50	20	IDGD	
Cc1nc[nH]c1CSCC(=O)N1CCC2(CCCN(C(=O)[C@@H](O)CCl)C2)CC1	1805522558	JSQDUOUMGGEOBS-INIZCTEOSA-N	428.986	1.782	50	20	IDGD	
CN(C)C(=O)NCC(=O)N1CC[C@H](CNC(=O)CCBr)[C@@H]1c1cccnc1	1806339188	ZRBSSPOGOLDLRF-PBHICJAKSA-N	440.342	1.144	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)COc2cccnn2)[C@@H]1c1cccnc1	1813390445	BZEJYZILGWLIGT-BXWFABGCSA-N	433.896	1.210	50	20	IDGD	
O=C(N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1)C1=CCCS1	1815350146	GJPJBOFNIZMOMC-ZDUSSCGKSA-N	429.332	1.070	50	20	IDGD	
C[C@]1(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)CC1(F)F	1815362032	ZGYKWIMQORDDJY-KZULUSFZSA-N	435.261	1.094	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(F)cc2)[nH]n1)c1ccc(B(O)O)cc1	1817472283	DFZKHSFFTMCJCL-IBGZPJMESA-N	436.252	1.848	50	20	IDGD	
O=C(Cc1ccsc1)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1817584060	PSWGBTGMZBZRRY-SFHVURJKSA-N	438.318	1.700	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccncn2)n[nH]1	1818177259	LGROLCHTYAHDRU-ROCQKPIASA-N	449.475	1.640	50	20	IDGD	
C=CC[C@@H](C)C(=O)N[C@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1	1819799413	BUIDYLLLFSWMFU-NEPJUHHUSA-N	428.518	1.580	50	20	IDGD	
C/C=C/C=C\C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1	1819800312	MVCVUDIXFPIQAT-MJMJCPQHSA-N	426.502	1.500	50	20	IDGD	
CC[C@@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CN2CCN(C(C)=O)CC2)[nH]n1	1820855625	ZDVKXVFIANBHDK-NVXWUHKLSA-N	438.960	1.583	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)[C@@H]1[C@@H]2C=CS[C@@H]12	1821706743	GQEBPYQSTZFQLC-IAAVTCLWSA-N	438.318	1.271	50	20	IDGD	
COc1cc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)ccn1	1822414331	BEDDSWOAVKIJLC-INIZCTEOSA-N	443.508	1.492	50	20	IDGD	
Cc1ncc(CC(=O)Nc2cc([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)s1	1822741708	VBARKNHIJLVGCP-INIZCTEOSA-N	447.565	1.782	50	20	IDGD	
CN1CCC(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1	1823809433	ZDEQDSZJNXYWQG-HXUWFJFHSA-N	435.613	1.321	50	20	IDGD	
CCOC(=O)N[C@H](O)C(=O)N1CCC([C@@H]2CCCCN2C(=O)C(C)(C)CCl)CC1	1824013823	RYAZECRARZNSAT-JKSUJKDBSA-N	431.961	1.936	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC([C@@H]2CCCCN2C(=O)C[C@H]2NC(=O)NC2=O)CC1	1825075469	ZWJMIQNQVLVOKX-CVEARBPZSA-N	438.601	1.056	50	20	IDGD	
Cc1nnc(CCC(=O)N2CCCC[C@@H]2C2CCN(C(=O)[C@@H](O)CCl)CC2)s1	1825226013	LVPNTWKDIYELNM-CVEARBPZSA-N	428.986	1.999	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(C(=O)O)ncn1)CC2	1825993025	DEWDTEMLXHFHKC-IUCAKERBSA-N	439.881	1.111	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)c1ccccc1)CC2	1826085357	NZBUZMRJPBGFLD-KUHUBIRLSA-N	445.545	1.162	50	20	IDGD	
C=C[C@H](O)C(C)(C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827052142	PQYDOIZEFTXDAH-SFTDATJTSA-N	442.365	1.173	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)Cc2cccs2)CC1	1827155216	ZSRHEGJPFYDZFK-NRFANRHFSA-N	440.374	1.904	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4ncccc4[nH]3)C2)C1	1830366904	ZHQGJGSCAFJQNN-NRFANRHFSA-N	434.924	1.898	50	20	IDGD	
CCS(=O)(=O)CC(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H](F)Br)CC1	1830375528	DQFFYJSFFPLPPL-ZFWWWQNUSA-N	441.363	1.731	50	20	IDGD	
O=C(/C=C/c1ccc([N+](=O)[O-])o1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1830908658	RLEVVBSVKGCJFB-UTJUFJDESA-N	431.804	1.192	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)/C=C\C(=O)NC3CC3)CC2)CC1	1833533849	SOMYIDJODUSXAX-LIXSYLKWSA-N	439.000	1.800	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccn(C(C)(C)C)n3)CCO2)C1	1833588753	NYQJVIHZHUPTHF-MGPUTAFESA-N	426.945	1.726	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ncc(Cl)cn1)CCO2	1833787768	ZONLPRNRHQEIKY-SFHVURJKSA-N	442.976	1.052	50	20	IDGD	
O=C(CCBr)NC1CCN(C2CCN(C(=O)[C@@H]3CCCOC3)CC2)CC1	1834423270	AQNHRDFGNLRLML-OAHLLOKOSA-N	430.387	1.770	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)CCC(=O)OC)CC2)CC1	1834436462	SYFCYCCHLNHTFN-MRXNPFEDSA-N	446.386	1.685	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)Cc3ccccc3O)C2)C1	1834824701	HYEREIXPQBEKHP-LJQANCHMSA-N	441.322	1.176	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCC(N2CCC(NC(=O)c3cc[n+]([O-])cc3)CC2)CC1	1836052688	SYIORORPWWGSBX-FQEVSTJZSA-N	443.375	1.742	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CSCc3[nH]cnc3C)CCO2)C1	1837330650	DCXCGQMXSINRJG-DNVCBOLYSA-N	444.985	1.425	50	20	IDGD	
CC#CC[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1)c1ccccc1	1837611231	FOHUOEPBBNIWIP-JTAQYXEDSA-N	448.947	1.240	50	20	IDGD	
CNc1ccc(C(=O)N2CCOC[C@@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)cc1	1837711298	CHDYLCJYTFXTDY-OAQYLSRUSA-N	435.597	1.650	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccc(F)cc3)C2)C1	1837712354	NHNAGMPFINEPBH-OAQYLSRUSA-N	438.572	1.676	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cccs3)C2)C1	1839152398	YCYNAWUGNATEAD-MSOLQXFVSA-N	435.373	1.983	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)c(C)n1C	1839153427	HXXVGEVEWPZFNT-PMACEKPBSA-N	446.375	1.948	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(F)n3)C2)C1	1839153516	IXCGIHYQVNJIIQ-ROUUACIJSA-N	434.295	1.527	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(C4CC4)cc3)CCO2)C1	1839441456	VRXSBCGCJJBHAC-SIKLNZKXSA-N	436.936	1.888	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)C(F)(F)Cl)C2)C1	1839967142	CAVRQPOSKNIONF-GXFFZTMASA-N	433.677	1.448	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)ccc1O	1840035561	VUZWCMVAVDMLOJ-KUHUBIRLSA-N	441.322	1.554	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(Cl)s3)C2)C1	1840149798	AFNOVRCZHBCMMQ-YVEFUNNKSA-N	437.345	1.725	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)/C=C/c3cnc(C)s3)CCO2)C1	1840519611	OSXYPDLTVQYLQE-HLPXUMPJSA-N	443.953	1.175	50	20	IDGD	
O=C([C@@H]1CCCS1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1840578700	BAQSBGYLWYEILB-SLEUVZQESA-N	425.320	1.029	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(F)ccc3OC)CCO2)C1	1840689500	MGBKHKCLCVDVGE-OXQOHEQNSA-N	428.888	1.922	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCCC12CN(C(=O)c1ccc(-n3c(O)nnc3O)cc1)C2	1841226764	PVDQXPCSHXLGBB-UHFFFAOYSA-N	433.896	1.761	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC12CN(C(=O)CN(C)C(=O)c1ccccc1)C2	1841285487	ATAFWXPHBBDEQN-HNNXBMFYSA-N	436.350	1.993	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCCC12CN(C(=O)[C@H]1CC[C@H](O)CC1)C2	1841925401	SFSOGYNIBNDMKG-JYJNAYRXSA-N	443.972	1.873	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1ccccc1C(F)(F)F)C2	1844264786	IJSPILMEZZKPQG-UHFFFAOYSA-N	447.417	1.835	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)c2ncccc2Br)C1	1844507200	CEPCVPLPGGPVPN-UHFFFAOYSA-N	438.326	1.034	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)C(=O)c1ccco1)C2	1844692049	ACHBAVOVPCNVIO-UHFFFAOYSA-N	441.396	1.813	50	20	IDGD	
C[C@H](NC(=O)c1ccccn1)C(=O)N1CCCC12CN(C(=O)[C@@H](C)CBr)C2	1845769089	RBUWZPVPXWTPKI-KBPBESRZSA-N	437.338	1.434	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)CSc2ccccc2[N+](=O)[O-])C1	1846303686	GMJFAABXVHPGJI-UHFFFAOYSA-N	449.533	1.263	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)C13CC(NC(=O)OC(C)(C)C)(C1)C3)C2	1846364906	QGJZPOVFNIAYMI-JAGHRAMZSA-N	441.956	1.891	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CCc1cccc(C#N)c1	1847468283	LACJECMLTQZUHS-NRTQMZOKSA-N	446.511	1.827	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNc3nnc(C)c(=O)[nH]3)c2)cc1	11265982	AIDBBBOKLWNGIT-UHFFFAOYSA-N	430.446	1.040	50	20	IDGD	
CC(C)N(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)COc2ccc(C#N)cc2)c1	15888714	JSKCEGJJZPBMNF-UHFFFAOYSA-N	430.486	1.427	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(C)c(C(=O)NNC(=O)CNc2ccc(C)cc2C)c1	104739113	ISHGKHSNWURNND-UHFFFAOYSA-N	448.545	1.410	50	20	IDGD	
CNS(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=O)c2ccc3c(c2)OCCO3)c1	105366116	XWDPUTCIXUKOCU-UHFFFAOYSA-N	425.850	1.094	50	20	IDGD	
CCOc1ccc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)c3cc[nH]n3)cc2)cc1	116950907	GBGLJKCNEAHSNR-UHFFFAOYSA-N	429.458	1.684	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)CCNC(=O)c2n[nH]c3ccccc23)cc1	726884162	YGAZFJFBEKJODE-CQSZACIVSA-N	439.472	1.696	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)CNC(=O)c2ccc(C#N)cc2)c2ccccc2c1=O	726983115	JEVFIMIZPRSEDZ-UHFFFAOYSA-N	432.440	1.040	50	20	IDGD	
CCOc1ccccc1[C@H](CC(=O)NNC(=O)[C@@H]1COc2ccccc2O1)NC(C)=O	728230006	CQHKDXVRYAPGNC-JXFKEZNVSA-N	427.457	1.640	50	20	IDGD	
O=C(C[C@H](NC(=O)c1ccccc1)c1ccccc1)NNC(=O)[C@@H]1CCS(=O)(=O)C1	728371597	ADUKGLHABCIILQ-MSOLQXFVSA-N	429.498	1.130	50	20	IDGD	
CC(=NNC(=O)c1cccc(C#N)c1)c1ccc(S(=O)(=O)NCCCC(=O)O)cc1	728785150	WXCPBYGDJACICS-UHFFFAOYSA-N	428.470	1.855	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1cccc(NC(=O)c2cccnc2)c1	728847799	PYWWVPRDVALSKZ-UHFFFAOYSA-N	445.483	1.802	50	20	IDGD	
C[C@H]1C[C@H](C)CN(S(=O)(=O)c2ccc(C(=O)NNC(=O)Cc3cccnc3)cc2)C1	728852157	PLMHBWQNUZGJHI-HOTGVXAUSA-N	430.530	1.752	50	20	IDGD	
O=C(NC[C@H](c1ccco1)N1CCCC1)NNC(=O)C1CCN(c2ncccn2)CC1	728941379	YAHIYJLWFSQRBH-QGZVFWFLSA-N	427.509	1.454	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C2=NN(c3ccccc3)[C@@H](C(=O)OC(C)(C)C)C2)n1	728959926	LHMPCWLHSGFXLE-GOSISDBHSA-N	440.504	1.624	50	20	IDGD	
C[C@@H]1CCCCN1C(=O)CN1CCN(C(=O)NNC(=O)Cn2ccc3ccccc32)CC1	729511066	QRCCRXPSFFSLKA-GOSISDBHSA-N	440.548	1.401	50	20	IDGD	
NC(=O)[C@H](NNC(=O)C1CCN(c2ncccn2)CC1)c1ccc(Br)cc1	729676079	AWVYPPKXISQQGR-OAHLLOKOSA-N	433.310	1.303	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)COc1ccccc1O)c1ccc(OCC(=O)NC2CC2)cc1	730900971	GWEIYIDESSAJII-CQSZACIVSA-N	442.472	1.520	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2cncc(-c3cnn(C)c3)c2)c2ccccc2c1=O	731161539	HHKPKTZOMJOZER-UHFFFAOYSA-N	431.456	1.677	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2ccc(C)c(C(N)=O)c2)cc1Br	732048753	RREVFHYCEBPEAB-UHFFFAOYSA-N	442.291	1.488	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1	732053515	FFOAKLTXDDSHJU-CYBMUJFWSA-N	436.421	1.626	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)N2CCC[C@H](CS(N)(=O)=O)C2)c(C)n1C[C@H]1CCCO1	732093176	SEYOYZIDFLBZJY-YUHPSRBCSA-N	434.562	1.718	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)NCc2ccc(N(C)S(C)(=O)=O)cc2)c1	732256523	GFXDSCNSOGCDJN-UHFFFAOYSA-N	436.490	1.244	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)[C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)c1O	732276841	SZZIDOSVBZZFLP-LLVKDONJSA-N	434.430	1.436	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCCNC(=O)c2ccc(C)cc2)c2ccccc2c1=O	732468421	QFFSSOALLQXSTM-UHFFFAOYSA-N	436.472	1.099	50	20	IDGD	
O=C(/C=C/C1CCOCC1)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	732653886	NSGQJFOHVDJDPY-MDZDMXLPSA-N	443.525	1.909	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)sc2nc3n(c(=O)c12)CCC3	733109073	SIISTIYDFFPWPY-UHFFFAOYSA-N	434.481	1.973	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N(C)[C@H](C)[C@@H](C)S(C)(=O)=O)cc1Br	733347701	HNQWYYAFZXWKJT-NXEZZACHSA-N	436.328	1.566	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NN[C@H](C(N)=O)c2ccc(C#N)cc2)c1	734506679	BXSFMNWSBYJBMD-SFHVURJKSA-N	429.502	1.050	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc3c(nc2O)CCCCC3)c1	737767428	ZXPUACLSJRTCJV-UHFFFAOYSA-N	432.502	1.381	50	20	IDGD	
CN(CC(=O)NNC(=O)c1cc(Cl)ccc1O)S(=O)(=O)c1cccc([N+](=O)[O-])c1	738507276	JJPIFOZIQQNSFF-UHFFFAOYSA-N	442.837	1.036	50	20	IDGD	
O=C(NNS(=O)(=O)N1CCCCC1)c1nn(Cc2ccccc2)c(=O)c2ccccc12	742025672	QCIOYWPNOXWMDK-UHFFFAOYSA-N	441.513	1.410	50	20	IDGD	
Cc1ccc(CN2C(=O)CC[C@@H]2C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)cc1	742676700	KXYGXBAXOLATLJ-MRXNPFEDSA-N	433.509	1.341	50	20	IDGD	
COc1ccc2c(c1)OCC[C@H]2NC(=O)NNC(=O)c1csc(N2CCOCC2)n1	743509329	BKHHVKSYNPYQLA-CQSZACIVSA-N	433.490	1.456	50	20	IDGD	
CO[C@H](CNC(=O)NNC(=O)c1csc(N2CCOCC2)n1)c1ccc(Cl)cc1	743509739	JSTOQQVRDVZDHE-OAHLLOKOSA-N	439.925	1.965	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)c2cccn(Cc3ccccc3)c2=O)c1	744866994	STJGBVFRGBRPDO-UHFFFAOYSA-N	430.420	1.386	50	20	IDGD	
N#Cc1ccc(NNC(=O)C(=O)Nc2ccc(S(N)(=O)=O)cc2)cc1C(F)(F)F	746890032	QVNGSPYCJILTFP-UHFFFAOYSA-N	427.364	1.306	50	20	IDGD	
CS(=O)(=O)N1CCC(=NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)CC1	747624982	XFLNZLSBGYYZEF-UHFFFAOYSA-N	442.563	1.002	50	20	IDGD	
CC(C)NC(=O)CCNC(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1	747866632	RVUPDAUVNSNEIW-OAQYLSRUSA-N	437.544	1.859	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)NCCCN2CCN(c3ccncc3)CC2)c1	748343726	MZNXKQKHPGDNDB-UHFFFAOYSA-N	426.521	1.312	50	20	IDGD	
CC(=O)Nc1c(C)cccc1C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	748621270	ZFMSZDKFKJHZRG-UHFFFAOYSA-N	445.545	1.646	50	20	IDGD	
Cc1cc(Br)ccc1NNC(=O)[C@@H]1CC(=O)N(CCN2CCOCC2)C1	748737447	VVFMRPHLDPTMRL-CQSZACIVSA-N	425.327	1.381	50	20	IDGD	
CC(C)CC(=O)N1CCC(NC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)CC1	749197646	OXBHVCCQAVBLLU-UHFFFAOYSA-N	428.493	1.559	50	20	IDGD	
CCn1c(NNC(=O)c2ccc(S(=O)(=O)CCOC)cc2)nc2ccccc2c1=O	749567375	LLIIQWYWZUBDNP-UHFFFAOYSA-N	430.486	1.593	50	20	IDGD	
CCO[C@H]1C[C@H](NC(=O)NNC(=O)c2csc(N3CCOCC3)n2)C1(CC)CC	749619579	WTPPAMOVTJQPFW-GJZGRUSLSA-N	425.555	1.908	50	20	IDGD	
Cc1ccc(C(=O)NNc2nc(Br)cn3ccnc23)cc1NS(C)(=O)=O	750243473	JELNYYKJLFELKU-UHFFFAOYSA-N	439.295	1.929	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)N[C@@H]1CCN(CCCc2ccccc2)C1=O	750267018	KJTRVDSOGDGBBM-OAHLLOKOSA-N	448.321	1.955	50	20	IDGD	
CC(C)(C)N1C[C@@H](NC(=O)NNC(=O)COc2ccc(Br)cc2)CC1=O	750659240	FJIPMQKRXWTKMY-LBPRGKRZSA-N	427.299	1.558	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)[C@H]2CCCN2C(=O)c2ccc3ccccc3c2O)n1	750663271	LIJMUMBUMPMZTP-LJQANCHMSA-N	435.484	1.811	50	20	IDGD	
CC[C@H](C)C(=O)N1Cc2ccccc2C[C@H]1C(=O)NNC(=O)[C@@H]1COc2ccccc2O1	751291899	YQWREXFRINGNDE-XERREHJYSA-N	437.496	1.973	50	20	IDGD	
COc1ccc(-c2cc(C(=O)OCC(=O)NNC(=O)c3cccc(C#N)c3)n[nH]2)cc1OC	751764866	DZQPZDICYPXLKA-UHFFFAOYSA-N	449.423	1.584	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2ncccc2C)cc1S(=O)(=O)Cc1cc(C)no1	752240725	QAAHXIDXKWBYRQ-UHFFFAOYSA-N	444.469	1.744	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)N[C@@H]1CCCN(Cc2ccccn2)C1=O	753296693	DNNAJQJYRLOWQY-MRXNPFEDSA-N	443.529	1.704	50	20	IDGD	
CC(C)(C)OC(=O)NC1(CNC(=O)NNC(=O)CNC(=O)c2cccs2)CCC1	753326709	BAVRWUCLPTYHOL-UHFFFAOYSA-N	425.511	1.256	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)NC2CCN(S(=O)(=O)C3CC3)CC2)cc1	753965794	HOVDAIUOARXKDB-UHFFFAOYSA-N	426.564	1.374	50	20	IDGD	
O=C(NCCN1C(=O)[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)NNC(=O)c1cc2c(s1)CCCCC2	755248666	WPKWGOBISUFKEN-DFEHZGFQSA-N	442.541	1.768	50	20	IDGD	
COCCN(C)S(=O)(=O)[C@@H]1CCCN(C(=O)NNC(=O)c2cc3ccccc3o2)C1	755264697	HXXYAJPINJLBPT-OAHLLOKOSA-N	438.506	1.160	50	20	IDGD	
CN1CCN(c2ncc(C=NNC(=O)c3nc(Cl)c(Cl)c(N)c3Cl)cn2)CC1	755533944	SENNLOSQYSHJEH-UHFFFAOYSA-N	443.726	1.930	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)Nc1ccc(N2CCCS2(=O)=O)cc1	755594635	RVZQEYNCARRNKX-KRWDZBQOSA-N	432.458	1.219	50	20	IDGD	
COCCOc1ccc(F)cc1NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1	756330628	MLFJOOQXVYCKIW-UHFFFAOYSA-N	432.456	1.710	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1ccc(C(=O)NNc2ccc(C(N)=O)nn2)cc1	757392096	KJLJHENNMPWDGO-UHFFFAOYSA-N	442.457	1.142	50	20	IDGD	
CC[C@H](C)NS(=O)(=O)Cc1cccc(NC(=O)NNC(=O)Cn2nc(C)cc2C)c1	757804489	XCYFEIFNHIYUNY-ZDUSSCGKSA-N	436.538	1.571	50	20	IDGD	
Cc1csc(SCc2ccccc2C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)n1	758040003	NBWRXVIBZUIDFQ-LLVKDONJSA-N	428.561	1.443	50	20	IDGD	
COCCc1noc(CN(C)C(=O)NNC(=O)c2ccc(OC)c(Br)c2)n1	758873264	TVOWUULNOHABBP-UHFFFAOYSA-N	442.270	1.516	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCCCc2ccc3c(c2)OCCO3)nc1	758894864	PUOBDJGRXSXAJB-UHFFFAOYSA-N	449.533	1.798	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)N=c1cc[nH]cc1I	760028924	JYZVYGLWKSQOHO-UHFFFAOYSA-N	430.177	1.479	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)C(=O)Nc2ccnn2-c2nc(C)cc(C)n2)cc1	760278615	ZYJMYVMSWOFTLE-UHFFFAOYSA-N	439.501	1.466	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccnn2Cc2ccc(F)cc2)cc1	760279625	OMRCYBWFTBUSKV-UHFFFAOYSA-N	425.420	1.544	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cnc([C@H]3CCCO3)s2)cc1OC	760663777	JHUZGHLZQZQAFX-CYBMUJFWSA-N	435.458	1.630	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)c2ccc(=O)n(-c3cnn(C)c3)c2)cc1OC	760797465	AHXZIXNYDNJRTN-UHFFFAOYSA-N	425.445	1.443	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)c1ccc(I)c(O)c1	761041808	UFDYIANLERGASE-UHFFFAOYSA-N	441.225	1.879	50	20	IDGD	
O=C(NNC(=O)C1SCCS1)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	761138921	BJCYPTKWKPIJNJ-UHFFFAOYSA-N	426.527	1.956	50	20	IDGD	
C[C@H](CN1CCOCC1)C(=O)NN=C1CCOc2c1cc(Br)cc2[N+](=O)[O-]	761803904	HEDZTCCSQGLEKR-LLVKDONJSA-N	441.282	1.928	50	20	IDGD	
COC(=O)CCc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(OC)c(OC)c2)cc1	763550621	HYGZBNQRBBIRLP-UHFFFAOYSA-N	429.429	1.209	50	20	IDGD	
COc1cccc(CC(=O)N2CCc3ccc(NC(=O)C(=O)NNC(=O)C4CC4)cc32)c1	763559054	QJCZERFFKOPRCR-UHFFFAOYSA-N	436.468	1.323	50	20	IDGD	
O=C(NNC(=O)c1ccccc1F)C(=O)Nc1ccc(I)cc1	763561564	NQVQFGHPDWMIPY-UHFFFAOYSA-N	427.173	1.830	50	20	IDGD	
CCn1nnnc1-c1cccc(NC(=O)C(=O)NNC(=O)COc2cc(C)cc(C)c2)c1	763649003	XFEFZIRLHWFMGK-UHFFFAOYSA-N	437.460	1.142	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(-c3csnn3)cc2)cc1	763662278	WXOUPAGADJUFFT-UHFFFAOYSA-N	427.442	1.379	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccc(OCc3ccccc3)cc2)n(C)n1	763679778	LIVDVNJMPXNXJO-UHFFFAOYSA-N	437.456	1.472	50	20	IDGD	
C[C@@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3cccc(N(C)C)c3)cn2)C[C@@H](C)O1	763760831	UKUNTJAGEYKULV-HUUCEWRRSA-N	440.504	1.161	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(S(C)(=O)=O)cc2)c1C	763847643	DSNUWJFGEJWKMZ-CQSZACIVSA-N	433.486	1.260	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(OC)cc2OC)cc1	763859735	FPDNIUMZFLRESJ-CYBMUJFWSA-N	431.445	1.656	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)nc(C)n3C)cc1	763864616	DKGAJLHMZNHVKY-CYBMUJFWSA-N	439.472	1.834	50	20	IDGD	
COC(=O)c1c(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)sc(C)c1C	763872362	NOUPETXXOYWZTF-JTQLQIEISA-N	437.449	1.844	50	20	IDGD	
C#Cc1cccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(Br)c2)c1	763883769	QMXXBDDQKGUTFX-LBPRGKRZSA-N	430.258	1.984	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCCCC3)cn1C	763967362	BFHPQALQKXUHRS-UHFFFAOYSA-N	432.502	1.932	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)C(=O)Nc1cc2c(cc1Cl)OCCO2	763994736	FREYGKFGCWZCJZ-UHFFFAOYSA-N	443.641	1.602	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(-c3nccn3C)c2)o1	764138952	MOSGRFKFUPWDSV-UHFFFAOYSA-N	438.488	1.922	50	20	IDGD	
CC[C@@H](C)NS(=O)(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2cccc(C#N)c2)c1	764233677	CUYYBCSJFOEAAW-CYBMUJFWSA-N	443.485	1.035	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1cc(F)c(Br)cc1F	764275260	LCTQFYREZRXOQJ-UHFFFAOYSA-N	444.188	1.598	50	20	IDGD	
O=C(Cc1cc[nH]n1)NNC(=O)C(=O)Nc1ccc(Cl)c(C(=O)NC2CCCCC2)c1	764294126	VMDIPIXUIYSDME-UHFFFAOYSA-N	446.895	1.454	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(SC)nc2)cc1Br	764325937	BCZQDHJMTWKWNN-UHFFFAOYSA-N	439.291	1.974	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)cccc1N1CCOC1=O	764345963	OJLSAPGXQZFTCX-UHFFFAOYSA-N	432.820	1.710	50	20	IDGD	
CC(=O)Nc1ccc(Cl)c(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)c1	764394244	QHNAROMKGYDQPZ-UHFFFAOYSA-N	436.877	1.882	50	20	IDGD	
CCNC(=O)c1ccc(C)c(NC(=O)C(=O)NNC(=O)CSc2ccccc2OC)c1	764397749	MLGPPOMIVFPXJG-UHFFFAOYSA-N	444.513	1.632	50	20	IDGD	
O=C(CO)NNC(=O)C(=O)Nc1ccc(NC(=O)c2ccc(F)cc2)cc1C(F)(F)F	764428859	LPZBCUJDQWEUDS-UHFFFAOYSA-N	442.325	1.175	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)c1ccc2c(c1)nc(O)n2CC(F)(F)F	764512324	BSQGGGKRTZUOCH-HNNXBMFYSA-N	436.346	1.905	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)[C@H]1CN(C(=O)OC(C)(C)C)CCO1	765313208	OIKZWNTWTCJOPA-CYBMUJFWSA-N	430.502	1.075	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@@H]2CN(Cc3ccccc3)C[C@@H]2C)c2ccccc2c1=O	765890881	HBHYSJSSCDRSAH-OXJNMPFZSA-N	448.527	1.881	50	20	IDGD	
O=C(CCOc1ccccc1)NNC(=O)c1ccc(N2C(=O)CCC2=O)c([N+](=O)[O-])c1	767779270	SSPJCSAWELBYQE-UHFFFAOYSA-N	426.385	1.478	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)[C@H]1CN(C(=O)OC(C)(C)C)CCO1	768629292	QEUZFXAPSYRKOD-CYBMUJFWSA-N	429.495	1.178	50	20	IDGD	
CC[C@H]1CCCC[C@H]1OCC(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	768712311	PNQQEQAVFFHEMG-DLBZAZTESA-N	439.582	1.446	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)cc1S(N)(=O)=O	770483825	HLNGIBONGCECRX-LLVKDONJSA-N	426.882	1.916	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)CCCC(=O)Nc2ccccc2C#N)c2ccccc2c1=O	770635529	CHNCLPYESMRKQM-UHFFFAOYSA-N	446.467	1.858	50	20	IDGD	
Cc1sc(C(=O)O)cc1S(=O)(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	771607423	MLPOTYIULDTPFL-UHFFFAOYSA-N	431.879	1.034	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2cccc(-c3ncn(C)n3)c2)c1	771786308	UNGRAPHYQUYKTP-UHFFFAOYSA-N	443.489	1.199	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)[C@@H]1CC(=O)N(c2ccccc2Br)C1	771986268	VWHXXULRGJSLHQ-GHMZBOCLSA-N	426.267	1.291	50	20	IDGD	
CCNS(=O)(=O)c1ccc(C(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)cc1	772952416	HJTXHEOYWLNJAO-GFCCVEGCSA-N	425.894	1.867	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)CNC(=O)NC2CCCCC2)C1	773416932	DPTKSQFBKIAQNG-AWEZNQCLSA-N	425.530	1.413	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccc(F)cc1OCC#N	774001912	LIMXIUKGZMKCGW-NSHDSACASA-N	434.811	1.935	50	20	IDGD	
COC(=O)c1cn(CCOC(=O)/C(C#N)=C\c2cc(C)n(C[C@@H]3CCCO3)c2C)nn1	774595105	VAEZCBAUJOSFET-BHEJFATLSA-N	427.461	1.812	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1I)NNC(=O)C(=O)NC1CC1	775204860	HOXBAUQFNSOUJP-UHFFFAOYSA-N	436.637	1.054	50	20	IDGD	
Cn1ncc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)c1-c1ccccc1	775541895	FWIXMCGIJASZAV-UHFFFAOYSA-N	446.511	1.306	50	20	IDGD	
CCO[C@@H]1C[C@H](NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)[C@@H]1Oc1ccccc1	776472925	LPFISYATHUNHSQ-OTWHNJEPSA-N	437.460	1.231	50	20	IDGD	
C[C@H]1CC(C)(C)C[C@@]2(C1)NC(=O)N(CC(=O)NNc1cccc(S(C)(=O)=O)c1)C2=O	776528789	XBTZVCQMGBHCRW-RNODOKPDSA-N	436.534	1.670	50	20	IDGD	
COc1cc(C)nc(NNC(=O)[C@H]2CC[C@H](C(=O)NNc3nc(C)cc(OC)n3)CC2)n1	778302018	GIMMFSWFIGXBAM-HDJSIYSDSA-N	444.496	1.293	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)c1cc(I)ccc1F	778436678	NMAYTZPCZCDWRR-UHFFFAOYSA-N	437.209	1.716	50	20	IDGD	
CC(C)Oc1ccc(S(=O)(=O)N2CCOCC2)cc1NC(=O)CN1CC=C(C#N)CC1	779591192	XULGIGQFLGUNHQ-UHFFFAOYSA-N	448.545	1.589	50	20	IDGD	
C=CCn1c(S)nc2cc(C(=O)NNC(=O)CCNC(=O)OC(C)(C)C)ccc2c1=O	780970618	DVWFEUHWQKGNQI-UHFFFAOYSA-N	447.517	1.547	50	20	IDGD	
O=C(NNc1c(F)cccc1Cl)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(F)cc1	781032252	ZVPQEUCTGYYQHU-ABAIWWIYSA-N	431.848	1.885	50	20	IDGD	
O=C(COC(=O)c1cc(Cl)ncc1Cl)NNC(=O)[C@@H]1COc2ccccc2O1	781365664	BLCGENGICIACEP-ZDUSSCGKSA-N	426.212	1.533	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)N2C[C@H](C(=O)N3CCCCC3)Oc3ccccc32)nc1	782141557	OCQZXPRTEBSOSR-GOSISDBHSA-N	439.472	1.340	50	20	IDGD	
O=C(Cc1cccnc1)NNS(=O)(=O)c1cc(C(=O)O)c(Cl)cc1Br	782462431	KFPYDIIZUROCAR-UHFFFAOYSA-N	448.682	1.748	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2ccc3cc(Br)ccc3c2)CCS(=O)(=O)C1	783428882	YIAMWTPSWHSNFA-KRWDZBQOSA-N	440.319	1.739	50	20	IDGD	
Cc1cc([N+](=O)[O-])c(Cl)c(S(=O)(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c1	783809744	FNGBGYNJFWLXQS-UHFFFAOYSA-N	447.878	1.583	50	20	IDGD	
CN1CCC/C1=N\S(=O)(=O)c1cccc(NC(=O)C(=O)NNc2ccnc(F)c2)c1	784851647	FHHVOZCLLRYEJS-LFVJCYFKSA-N	434.453	1.115	50	20	IDGD	
Cc1ccccc1-c1cc(NC(=O)C(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)n(C)n1	785023445	ISSYFLLGMVXERL-UHFFFAOYSA-N	438.400	1.409	50	20	IDGD	
COc1ccccc1COc1cccc(NC(=O)C(=O)NNc2nccn(C)c2=O)c1C	785087235	YVUISPBCFGLAGH-UHFFFAOYSA-N	437.456	1.758	50	20	IDGD	
CCN(CC)Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)cc1	787902371	XFPNVSWQGQLKET-UHFFFAOYSA-N	429.433	1.542	50	20	IDGD	
CN1CCN(C(=O)NNC(=O)c2cc(Br)sc2Br)CC1	788167211	YKJRKUVFPIENOM-UHFFFAOYSA-N	426.134	1.875	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CN(Cc2ccccc2)C[C@H]1c1ccc(Cl)cc1)C(=O)NC1CC1	788739480	UOBZTBAPGHTHLK-VQTJNVASSA-N	440.931	1.982	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)CN(C)C1=NS(=O)(=O)c2ccccc21	789910692	SGTREIJPARNUOI-UHFFFAOYSA-N	436.877	1.191	50	20	IDGD	
CS(=O)(=O)CC[C@@H](C(=O)NNC(=O)c1cnn(-c2ccccc2)c1)c1ccccc1	789951029	XMXIUUBICOBNNN-LJQANCHMSA-N	426.498	1.852	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)Cn2ccc3ccccc3c2=O)cc1C	790721573	MJYJDHKSZBDLKT-UHFFFAOYSA-N	427.482	1.938	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1cc([C@H]2CCCOC2)nn1C	790965197	HWYYKTKOPZKKJF-OLZOCXBDSA-N	449.895	1.521	50	20	IDGD	
COc1cc(NNC(=O)CNS(=O)(=O)c2ccc3c(c2)OCCCO3)ccc1Cl	791026553	DKUZYWMSZHHKJB-UHFFFAOYSA-N	441.893	1.932	50	20	IDGD	
CC1C[C@H](C(=O)NNc2nc3ccccn3n2)[C@@H](C(=O)NNc2nc3ccccn3n2)C1	791259519	UUHNTELZDKMTOA-KBPBESRZSA-N	434.464	1.021	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)Nc1nnc(-c2ccc(Cl)cc2F)s1	791899678	JUGDXQPQGUHIIO-ZETCQYMHSA-N	433.874	1.585	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)[C@@H]2CCN(CC(F)(F)F)C2)c2ccccc2c1=O	792016665	RZTFZRCIIYVSGA-GFCCVEGCSA-N	425.411	1.623	50	20	IDGD	
CS(=O)(=O)C1(C(=O)NNC(=O)[C@@H]2Cc3ccccc3CN2Cc2ccccc2)CC1	792113829	HYVFWTUJLAHKRX-IBGZPJMESA-N	427.526	1.338	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)cc(Cl)c1F	792284972	BAICXIAQIAVIHR-UHFFFAOYSA-N	447.810	1.242	50	20	IDGD	
Cc1cccnc1NNC(=O)C(=O)Nc1cccc(S(=O)(=O)/N=C2/CCCN2C)c1	792374612	CYLQGHKKTARRHD-JLPGSUDCSA-N	430.490	1.285	50	20	IDGD	
CS(=O)(=O)Nc1cc(C(=O)NNC(=O)CNc2ccccc2)cc(C(F)(F)F)c1	792630768	ZMGBQCBNANVYOB-UHFFFAOYSA-N	430.408	1.950	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)C(=O)Nc2ccc(OC(C)C)nn2)c1	793023024	GDOLVUWQDBCQKY-UHFFFAOYSA-N	429.477	1.861	50	20	IDGD	
COC(=O)c1cc(C(=O)NNC(=O)CNC(=O)OCc2ccccc2)cc([N+](=O)[O-])c1	794062919	DODVAZBDDMYMPO-UHFFFAOYSA-N	430.373	1.069	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1cnc2c(F)cccc2c1	794391315	AHFRMUAMPRVCQV-UHFFFAOYSA-N	435.459	1.593	50	20	IDGD	
O=C(NNS(=O)(=O)C[C@H]1CCCOC1)[C@@H]1Cc2ccccc2CN1Cc1ccccc1	795305316	MBFDIWGZQOSSRR-UGKGYDQZSA-N	443.569	1.991	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](c2ccccc2F)N2CCOCC2)cc1C	798308997	SSAPFAPLRFYHRY-LJQANCHMSA-N	428.464	1.602	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NN=CC1(SC)CC1)N(S(C)(=O)=O)CC2	800808920	VBAGCIAPYLHVJV-OAHLLOKOSA-N	441.575	1.950	50	20	IDGD	
Cn1nnnc1SCCC(=O)NNC(=O)Nc1ccc(Br)cc1Cl	802040431	FGFJCBWYQNTZIP-UHFFFAOYSA-N	434.707	1.961	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)CCC(=O)NCC(=O)c2ccc(OC)cc2)cc1	802053312	NVQMFWSZGSRORG-UHFFFAOYSA-N	428.445	1.636	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2ccc(F)c(S(=O)(=O)Cc3ncon3)c2)cc1	802058357	YHZZBRSYKHCSHP-UHFFFAOYSA-N	449.420	1.658	50	20	IDGD	
Cc1ccccc1C(=O)NNS(=O)(=O)c1ccc(S(C)(=O)=O)cc1Br	802720281	DJNMXNTXFURIGC-UHFFFAOYSA-N	447.332	1.784	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)N(C)CC(=O)NNc2ccc([N+](=O)[O-])cc2C)cc1	805381629	SLLMXGCPMIHKTB-UHFFFAOYSA-N	435.462	1.625	50	20	IDGD	
CNS(=O)(=O)c1cc(NC(=O)NNC(=O)CSc2ccccc2O)ccc1F	806546511	ORDWISCKBXZVOB-UHFFFAOYSA-N	428.467	1.384	50	20	IDGD	
O=C1COC[C@@H](C[C@H]2CN(C(=O)C(=O)NNc3cccc(F)c3F)c3ccccc32)N1	807017887	QOFXUVPLDORNTB-QWHCGFSZSA-N	430.411	1.443	50	20	IDGD	
CN1CCN(C(=O)NNC(=O)[C@@H]2CCC(=O)N(C)[C@H]2c2ccc(C(F)(F)F)cc2)CC1	807380625	KWDSNOBXZXLQPR-WBVHZDCISA-N	441.454	1.603	50	20	IDGD	
O=C(NNc1cccc(F)n1)C(=O)Nc1cc(N2CCCS2(=O)=O)ccc1Cl	807392274	XLRUAHJCHQGTHC-UHFFFAOYSA-N	427.845	1.496	50	20	IDGD	
CC[C@@H](C)NS(=O)(=O)c1cccc(NC(=O)C(=O)NNc2nccnc2C2CCC2)c1	807460423	PBRFIHMKTTXGOI-CYBMUJFWSA-N	446.533	1.903	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)NCC(=O)NNc2cccc(Br)c2)cc1	810042550	ZPMAKKGXXLBXGC-UHFFFAOYSA-N	441.307	1.829	50	20	IDGD	
O=C(CNS(=O)(=O)c1cccc(F)c1)NNc1c(F)cc(C(=O)NC2CC2)cc1F	810563358	FZLNUTNBJLXYNT-UHFFFAOYSA-N	442.419	1.418	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N1C[C@H](C)S(=O)(=O)[C@@H](C)C1	811853254	RRKKYLWNVFTWRH-SRVKXCTJSA-N	448.339	1.465	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)Cc1cn2ccccc2n1)c1ccc(N2CCCNC2=O)cc1	812940833	DSZCHXFPTJRIPP-OAHLLOKOSA-N	435.488	1.888	50	20	IDGD	
CC(C)Oc1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)c(F)c1	813033584	AKUOKYGEJQIXFP-UHFFFAOYSA-N	438.481	1.945	50	20	IDGD	
CN(Cc1ccccc1S(N)(=O)=O)C(=O)NNC(=O)c1cnn(-c2ccccc2)c1	814300712	PDXICTMJEBZEKR-UHFFFAOYSA-N	428.474	1.006	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NN=C2C(=O)Nc3cc4c(cc32)OCCO4)C1	814971536	IFWDKIHZIMONFS-GFCCVEGCSA-N	430.461	1.877	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1nc(C(C)(C)C(=O)OC)cs1	815565458	OTXMEKNCLDCOEG-UHFFFAOYSA-N	448.501	1.321	50	20	IDGD	
COCc1cc(NC(=O)C(=O)NNC(=O)Cc2c[nH]c3ccccc23)cc(C(=O)OC)c1	815566279	OGFQGQMVTVQZRP-UHFFFAOYSA-N	438.440	1.430	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)C(=O)Nc1ccc(C#N)cn1	815566348	QXGCTLZIXPJWTA-SNVBAGLBSA-N	432.234	1.269	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)nc2)cc1)[C@H]1C[C@@H]1C	815567623	FUQQRZUNYVDCHD-ZBEGNZNMSA-N	429.864	1.896	50	20	IDGD	
CNC(=O)[C@H](C)NC(=O)/C(C#N)=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	817055856	YZLMRXNQJYUFGQ-CJAAZZPWSA-N	428.880	1.237	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)c2cn(Cc3ccccn3)nn2)C1	819658613	OBMISVAVGBNKCZ-AWEZNQCLSA-N	429.481	1.130	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)[C@@H]2CS[C@@H](Cc3ccccc3F)C(=O)N2)cc1C	888438409	YWLYTQNELVYPHF-OALUTQOASA-N	445.516	1.812	50	20	IDGD	
Cn1cc(C(=O)NNS(=O)(=O)c2ccc(S(=O)(=O)NC3CC3)cc2)c2ccccc21	912980558	PLXWDZPWLOXWNZ-UHFFFAOYSA-N	448.526	1.242	50	20	IDGD	
C[C@H]1CCCCN1C(=O)CN1CCN(CC(=O)NNC(=O)c2ccccc2Cl)CC1	913053394	MLMFSEOKUFITCC-INIZCTEOSA-N	435.956	1.120	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)CNS(=O)(=O)c2ccc(Cl)cc2)c1	913450238	HUFJPUHWYVTHFX-UHFFFAOYSA-N	425.894	1.462	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)CCc2ccc(S(=O)(=O)NC3CC3)cc2)c1	913465287	QSAKKSJHLDOKSR-UHFFFAOYSA-N	447.513	1.538	50	20	IDGD	
O=C(NNC(=O)c1ccc(S(=O)(=O)N=c2cc[nH]cc2)cc1)c1ccc([N+](=O)[O-])cc1	914747378	HWSQQCLNXOSGHA-UHFFFAOYSA-N	441.425	1.287	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)o1	914749262	KEIUBJQVZAVTMD-GFCCVEGCSA-N	425.438	1.432	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)NCCNS(=O)(=O)c2ccccc2)c1C	916295103	IWCQXICDWHXPEB-MRXNPFEDSA-N	434.518	1.380	50	20	IDGD	
COc1cc(C=NNC(=O)Cn2nc(C)cc2C)cc(I)c1O	916342771	ANSJFRWFMNJDET-UHFFFAOYSA-N	428.230	1.969	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)N[C@@H](C)c2ccc(OCC(=O)NC3CC3)cc2)n1	916488431	CQWPPDMXKOVUIR-HNNXBMFYSA-N	428.493	1.249	50	20	IDGD	
CO[C@@H](C)C(=O)NNC(=O)CN(Cc1ccccc1)S(=O)(=O)c1ccc(Cl)cc1	917688325	PKJZQOGCVAYWLX-AWEZNQCLSA-N	439.921	1.713	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)[C@@H](C)NS(=O)(=O)c2cccs2)c1C	917918951	IOMRJEBOSRLCGA-KGLIPLIRSA-N	425.532	1.647	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CC(=O)N(CC(F)(F)F)C1)c1ccc(F)cc1Br	918342097	REVTZXQCHQHJOT-SSDOTTSWSA-N	426.164	1.760	50	20	IDGD	
CNC(=O)NNC(=O)c1ccc(OC)c(S(=O)(=O)NCc2ccc(Cl)cc2)c1	919877626	DNSMZHFIGMIAQL-UHFFFAOYSA-N	426.882	1.401	50	20	IDGD	
Cn1c(C=NNC(=O)COc2ccc(Cl)cc2Cl)nc2c1c(O)nc(=O)n2C	920356105	JLUJKVBDXYQYBV-UHFFFAOYSA-N	425.232	1.209	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC2(CC1)CC(C(=O)NNC(=O)c1n[nH]c3c1CCCC3)=NO2	1320747843	XECKKNYRXWIJFC-UHFFFAOYSA-N	446.508	1.596	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2ccc(NC(=O)c3ccc(O)nc3)cc2)C[C@@H](C)O1	1321730462	KAIHHQYXBJCBJK-GASCZTMLSA-N	441.488	1.300	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C2(NS(=O)(=O)c3c(C)noc3C)CCCC2)cc1	1322210838	HPODIWIXASNESR-UHFFFAOYSA-N	436.490	1.352	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@H](C)[C@@H](C)C(=O)NNC(=O)c2ccc(OC)cc2)cc1	1326288250	PQVRHJOIDALMSB-ZIAGYGMSSA-N	442.472	1.198	50	20	IDGD	
CS(=O)(=O)c1cncc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](F)Cl)C2)c1	1778024218	SMRQLCPIHIRUQA-IIDMSEBBSA-N	447.916	1.147	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc4cn[nH]c4cn3)C2)C1	1778777152	PAFQBSWXXSKDBR-FZKQIMNGSA-N	436.310	1.575	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)/C=C/C(=O)NCc3ccco3)C2)C1	1779207759	YKJMZKKYKOUYAB-WSRXNHEDSA-N	437.924	1.689	50	20	IDGD	
C[C@@H]1CCC[C@@H]1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1	1779372209	BQZLQAGCEQQZAO-QIEVIBBNSA-N	443.548	1.249	50	20	IDGD	
C[C@@H](Cn1cncn1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@](C)(Cl)CCl)C2	1779500549	QDTDPLXXGHZLHT-QGWWYQLQSA-N	446.379	1.664	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(N(C)C)nc3)C2)C1	1779764585	JWAOTESRDGOYOM-KXBFYZLASA-N	439.354	1.765	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2nn[nH]c2C(F)(F)F)C1	1780196478	BPWNUFNSXYEILH-LYOVBCGYSA-N	437.850	1.968	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)n(C(F)F)n1	1780312741	FQUKPJADMFWDPI-XHDPSFHLSA-N	439.232	1.721	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3nccc(OC)c3OC)C2)C1	1780444860	GQGWEPWUXOZEMF-XOBRGWDASA-N	425.913	1.950	50	20	IDGD	
COc1ncccc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Br)C1	1780770890	IHTLYNDJQLEUAB-QWQRMKEZSA-N	444.301	1.908	50	20	IDGD	
Cc1nccn1[C@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Br)C1	1780777302	QNSYWHIBQGXUKZ-SCFUHWHPSA-N	445.333	1.957	50	20	IDGD	
COc1cnc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@](C)(Cl)CCl)C3)C2)c(F)c1	1781227554	BGRYJPDQWPIWRY-MSOLQXFVSA-N	434.295	1.909	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc3ncccc3[nH]1)C2	1782178496	KMIFLRCCASGHHG-CFCCAZDESA-N	434.924	1.944	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cnn4cccc(F)c34)CCO2)C1	1783537968	VBXLWFIHECOWSQ-SGTLLEGYSA-N	439.285	1.700	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)Cc3cc(Cl)ccc3OC)CCO2)C1	1783880854	HUNDDBUNVKIDQM-OXQOHEQNSA-N	445.343	1.975	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CC(F)(F)C(=O)O)C[C@@H]21	1783965370	KAEHCFFPBMEROG-BJDJZHNGSA-N	441.269	1.107	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3csc(N)n3)C[C@@H]21	1783968524	WOVKWJFXBHYSST-BLFANLJRSA-N	431.356	1.350	50	20	IDGD	
CC#C[C@H](CC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](Cl)COC)CCO2)c1ccc(O)cc1	1784019189	CCPHBQRMBSJCPM-KKLQWCBXSA-N	448.947	1.973	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCCc3ccccc3F)C[C@@H]21)[C@@H](O)CCl	1784083960	ILOSPAPMDCTDJZ-CAMMJAKZSA-N	426.916	1.728	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(C(F)(F)F)ccn3)C[C@@H]21)[C@@H](O)CCl	1784091316	MYCMUXVPGNIFQS-LVGORTOPSA-N	435.830	1.293	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN(C)C(=O)OC(C)(C)C)[C@H]2C1	1786622912	VXOGPOQHLCZYEJ-VGWMRTNUSA-N	447.960	1.087	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)n3cccc3C=O)[C@H]2C1	1786994860	LCOYQUVZBKOHPM-AUOOEQCUSA-N	440.338	1.625	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)n3cccc3C=O)[C@H]2C1	1786995919	ZGEHNCNUFXQVQV-XWJBARJFSA-N	425.913	1.095	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CNC(=O)c3ccco3)[C@H]2C1	1787080930	PMFPSRZXBSTGMI-DZKIICNBSA-N	425.913	1.254	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/C3CC3)C[C@@H]21	1787507115	YEOQKTFNPYIEMW-RKKLMNDLSA-N	427.505	1.066	50	20	IDGD	
Cn1ncc2c(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)CCBr)C[C@@H]43)cccc21	1788063856	YNIBIFZJPOVGCB-OWQGQXMQSA-N	449.349	1.952	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](OC(C)=O)C(C)C)[C@H]2C1	1788479646	LOBZBBJEGXPGLJ-WOYTXXSLSA-N	447.370	1.727	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc4cccnn4n3)[C@H]2C1	1789144139	GILXSBQPCRLYQS-HAHWVIBASA-N	440.331	1.559	50	20	IDGD	
CCOc1cccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](Cl)COC)C[C@@H]32)c1O	1790236162	TVPBENYRJSDMOF-SCNOPHJPSA-N	440.924	1.638	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)Cn3cccn3)C[C@@H]21	1790960792	GGGYHMQMFPUWKP-HMDCTGQHSA-N	441.370	1.672	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC1(c2ccc(NC(=O)CN(CCO)CCO)cc2)CCC1	1791323407	GFIXSNDVQLFMFD-SFHVURJKSA-N	425.957	1.815	50	20	IDGD	
COc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](O)CCl)C[C@@H]32)c(Cl)c1	1792016654	XZDOVBLFXNTMNK-WPUCRFQZSA-N	431.316	1.542	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)c1	1794065409	PACUSWBYBLHYJL-WKCHPHFGSA-N	436.317	1.314	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnnc(Cl)c1	1794219213	PYLXFNAOLVUNMI-OPDFLTKYSA-N	431.718	1.507	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccnnc1	1795024460	LVMDLHGHSSTFNH-MUJYYYPQSA-N	439.428	1.876	50	20	IDGD	
COc1nccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)CBr)C3)c1F	1795908624	XQXVLFDTXUJKFB-MCYUEQNJSA-N	444.301	1.464	50	20	IDGD	
O=C(Cc1cccc(F)c1F)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1	1796192309	YWNCDLBJTHNHKM-BCDXTJNWSA-N	428.244	1.139	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2c(c1)CCCC2=O	1797024557	LGRMOMWNYUGXNT-YNVMFWSZSA-N	434.920	1.663	50	20	IDGD	
COc1cc(C#N)cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)Br)C3)c1	1798579748	OHHPMEHLWNHKDC-FIUQPQMISA-N	436.306	1.553	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1ccc2ccnn2c1	1800026929	FYPFDYJDXAEAIC-AYRXBEOTSA-N	425.258	1.228	50	20	IDGD	
COc1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)c(F)c1	1800384643	TVKJUOJJUXLZCO-BJWYYQGGSA-N	426.253	1.080	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2)[C@H]1CCc2ccccc2O1	1800946676	NWHUZACNYXOCKT-LORHWOILSA-N	437.334	1.755	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(C)(C)CCl)C2	1800951417	DBBGPCWSNWILKF-NNXHMXCWSA-N	426.941	1.596	50	20	IDGD	
C[C@@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cncc(S(C)(=O)=O)c1)C2	1801959652	NBMDMAXELZFPQF-RUZUBIRVSA-N	444.351	1.520	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)NC(=O)c1ccccc1	1802111359	FKUPRZRSBBDYIT-IQZDNPOKSA-N	435.952	1.802	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)CNC(=S)NCC)[C@@H]1c1cccnc1	1803693641	AJHCVDPFDVREPN-SOLBZPMBSA-N	440.013	1.979	50	20	IDGD	
COc1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)cc1Cl	1803735463	SKRHRJXJXSAXPL-BCDXTJNWSA-N	442.708	1.594	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1)c1cccc(=O)n1O	1804954700	ZPCZOGZGQXLUEZ-KDOFPFPSSA-N	449.305	1.585	50	20	IDGD	
CN(C)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1	1805104800	XZFXYWUDMKKNNN-SNRMKQJTSA-N	431.924	1.462	50	20	IDGD	
Cc1ccc(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)s1	1805409429	PYONBNQOCIILOW-WIYYLYMNSA-N	449.341	1.765	50	20	IDGD	
O=C(/C=C/c1ccsc1)N1CCCC2(CCN(C(=O)c3cccc(B(O)O)c3)CC2)C1	1807202944	PDBPAMQRJYUOGD-AATRIKPKSA-N	438.358	1.986	50	20	IDGD	
CC(C)CNC(=O)C(=O)NC[C@H]1CCN(C(=O)CO[Si](C)(C)C)[C@H]1c1cccnc1	1808447164	FHNFHRASCADKCM-MJGOQNOKSA-N	434.613	1.711	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cc(O)no2)[C@H]1c1cccnc1)[C@@H](F)Br	1808667917	GRVYDWIHGGBAKK-LEWSCRJBSA-N	427.230	1.785	50	20	IDGD	
C[C@H](C(=O)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1)c1ccccn1	1809980251	QVXWWUXHISDCIU-SFHVURJKSA-N	435.333	1.410	50	20	IDGD	
O=C(Cn1ccncc1=O)NC[C@@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1	1812342643	YGCGVRQHQHBFRK-KXBFYZLASA-N	448.321	1.129	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)C2=COCCC2)[C@@H]1c1cccnc1	1813073361	IUZGUWDACDDYPE-DYESRHJHSA-N	429.521	1.155	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)[C@@H]2CCCSC2)[C@@H]1c1cccnc1	1814142982	YRRSPVSTFSXIRM-OPYAIIAOSA-N	447.605	1.604	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@H]1CCc2nc(NC(=O)C(C)(F)F)sc2C1	1814653392	LKUNSWVUVZZOSH-QQUKTLKZSA-N	438.460	1.844	50	20	IDGD	
C[C@H](CBr)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2CCC(=O)NC2)[nH]n1	1814776333	MMOOBUKPKFECCY-BZPMIXESSA-N	440.342	1.959	50	20	IDGD	
CC(C)NC(=O)OC(C)(C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](O)CCl)n[nH]1	1814872556	LPNBLIONCPQUSA-KGLIPLIRSA-N	443.932	1.915	50	20	IDGD	
CCS(=O)(=O)CC(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](C)Br)[nH]n1	1815173929	INQCREAQADEKSG-PWSUYJOCSA-N	435.344	1.620	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)C(C)(C)CNC(C)=O)n[nH]1	1815343047	VHJYGLBEJXAEPV-HIFRSBDPSA-N	427.933	1.818	50	20	IDGD	
C#CCCCCC(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1	1815348363	LFQJLHIXVRULHN-MRXNPFEDSA-N	425.319	1.242	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2nc(C)c(C)[nH]c2=O)n[nH]1	1816116075	ZJWRARBNFCFCKO-GXTWGEPZSA-N	436.900	1.670	50	20	IDGD	
CCc1ccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)cn1	1817470897	LEYQPVUSMVNIJD-HXUWFJFHSA-N	447.304	1.667	50	20	IDGD	
O=C(Cc1ccccn1)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1817637069	IGBAJKQRHKLHCX-LJQANCHMSA-N	433.277	1.033	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)C[C@@](C)(O)CC(=O)O)[nH]n1	1822374112	DHRNEIMFDTWFIS-RRUGBERISA-N	430.889	1.271	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](O)CCl)CC2)c1cc2cccnc2nc1O	1823981013	VPNRWGVVEHJUFT-GWCFXTLKSA-N	447.904	1.617	50	20	IDGD	
CC(=O)N/C(C)=C/C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](C)Br)CC2	1824477310	BFXNRKIEVZQVDF-VAMACUPYSA-N	429.340	1.878	50	20	IDGD	
Cc1noc(C)c1CC(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1	1825012029	BVGGJJXWTCZYEV-HXUWFJFHSA-N	447.580	1.827	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)C2CCOCC2)CC1	1826582577	LVCCDYQXLCKNHY-HXUWFJFHSA-N	443.548	1.345	50	20	IDGD	
O=C([C@@H](F)Br)N1CCC([C@@H]2CCCCN2C(=O)c2cnc(O)nc2O)CC1	1827590773	SIERAMRINWBZMU-QWHCGFSZSA-N	445.289	1.812	50	20	IDGD	
C=CCOCCCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)CBr)CCO2	1830535316	MJADIQMBSDSPRO-APWZRJJASA-N	447.370	1.457	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)c(C)o1	1830537840	QCOSFZWKRNJNKO-DJJJIMSYSA-N	443.338	1.997	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(F)n3)C2)C1	1830540084	MQUKOHIKTOANID-FZKQIMNGSA-N	444.301	1.322	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CC(OCC)OCC)C2)C1	1831656553	GNCPWNVUKMGGCS-OXJNMPFZSA-N	434.961	1.640	50	20	IDGD	
CC(C)n1cnc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)n1	1831873006	CNKVAINIUVDTGH-SFHVURJKSA-N	447.584	1.465	50	20	IDGD	
CC(C)=NO[C@H](C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1	1831874900	XRCFBGXQOYFXGH-MJGOQNOKSA-N	437.585	1.780	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)CN3CCCC3)CC2)CC1	1833098251	QMPNTSMUFVPNKF-INIZCTEOSA-N	443.430	1.685	50	20	IDGD	
C[C@@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)C3(C#N)CC3)CC2)CC1	1833262301	MXVWJDFFNFFNGB-AWEZNQCLSA-N	425.371	1.893	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)C(C)(C)NCCC#N)CC2)CC1	1834716777	XAVXMODAPQQPDO-GOSISDBHSA-N	426.005	1.857	50	20	IDGD	
Cc1nc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCBr)CCO3)C2)ccc1F	1834819532	VECZVVRAZCQGLE-GOSISDBHSA-N	444.301	1.384	50	20	IDGD	
O=C(Cc1cccnc1)NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1	1834880443	DYEFYZXPJADNJE-SFHVURJKSA-N	441.345	1.886	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)C#Cc3ccccc3)CCO2)C1	1835101987	MKZJWLUCKXWROF-RTWAWAEBSA-N	439.339	1.731	50	20	IDGD	
O=C(c1nccc2occc12)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1836295693	OKFUJIMWSJABHH-GOSISDBHSA-N	428.272	1.702	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H]3Cc4ccccc4O3)CCO2)C1	1836644844	UTYAPQWGMFMRFA-PGRDOPGGSA-N	436.936	1.712	50	20	IDGD	
C=C[C@H](O)C(C)(C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](Br)CC)C2)C1	1837403398	SIFBBNPXLGWOKL-ZRGWGRIASA-N	447.370	1.189	50	20	IDGD	
O=C(c1cc(F)cnc1Cl)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1837858443	HRSYNMSYZBEYHG-INIZCTEOSA-N	440.686	1.748	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)c(OC)c1	1838879424	MKOMABGXSORFQF-IBGZPJMESA-N	447.315	1.578	50	20	IDGD	
O=C([C@@H](F)Cl)N1CCOC[C@@]2(C1)CN(C(=O)C1(c3ccc(F)c(F)c3)CC1)CCO2	1839042475	YMBJRJXHOXWKSM-VQIMIIECSA-N	446.853	1.987	50	20	IDGD	
COc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)cn1	1839150256	GYZQGJFGCQJRDQ-MOPGFXCFSA-N	446.331	1.397	50	20	IDGD	
CCc1ncccc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2	1839150889	AWOUHZKJCAIVGP-UXHICEINSA-N	444.359	1.950	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)cnc1C	1839197928	MZGMUVODYLNQKQ-CRAIPNDOSA-N	444.301	1.459	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(C)ccc3F)CCO2)C1	1839314085	QBIBBQQVXBRUQS-UZLBHIALSA-N	428.888	1.458	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cc3cccnn3c1)CCO2	1839560624	AWFMBKKLAVZAJE-NRFANRHFSA-N	446.580	1.256	50	20	IDGD	
C=CCC(F)(F)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)CBr)C2)C1	1839886633	HFCHQENSYHMGHP-BBRMVZONSA-N	439.297	1.685	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3csc(C)n3)C2)C1	1839963428	JWYRSPMMKUTCCG-DYVFJYSZSA-N	446.367	1.695	50	20	IDGD	
CN(CC(=O)N1CC2(CCCN2C(=O)[C@H]2C[C@@H]2C2CC2)C1)NC(=O)NCc1ccccc1	1841273251	SATVXAGWFSJLNM-UXHICEINSA-N	439.560	1.582	50	20	IDGD	
C#CCCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1	1841352615	AVSWSUFYUDHEHF-JKSUJKDBSA-N	441.956	1.486	50	20	IDGD	
O=C(c1cc(Cl)cc(Cl)n1)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843014330	XWRHNBDIWUKJOZ-UHFFFAOYSA-N	434.088	1.199	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)C2=NO[C@H](c3ccccc3)C2)C1	1843863275	OTWYJGUGFBUYSO-IBGZPJMESA-N	448.483	1.020	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)c2cc(C(F)(F)F)ccn2)C1	1844511879	PKSDGRSBXAMLBC-UHFFFAOYSA-N	427.427	1.290	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2cc(F)ccc2Cl)C1	1845372411	YLGGYGYEGOQIAY-UHFFFAOYSA-N	431.855	1.608	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)CCc1cnc3[nH]ccc3c1)C2	1846386025	VYAKSHKCAJSHFG-UHFFFAOYSA-N	426.521	1.072	50	20	IDGD	
C=CC[C@H](CC(=O)N1CCCC12CN(C(=O)[C@@H](O)CCl)C2)NC(=O)OC(C)(C)C	1846932589	CCQDAZGUNKVXIE-CABCVRRESA-N	429.945	1.649	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H]1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](F)Br	1847959278	XBQZZVAAVCSUAL-ZDEQEGDKSA-N	434.306	1.888	50	20	IDGD	
C[C@@H]1Oc2ccccc2O[C@@H]1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	14287687	JCSMCEHKSYGYRT-LIRRHRJNSA-N	445.497	1.461	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)CNC(=O)c1ccc(OC)c([N+](=O)[O-])c1	21026002	IXDMNTLGZXNHIN-UHFFFAOYSA-N	436.808	1.456	50	20	IDGD	
COc1ccc(Cl)cc1CC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	26745575	OUEDJFMFKLJMKY-UHFFFAOYSA-N	425.894	1.603	50	20	IDGD	
CON(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(-c3ccccc3)n[nH]2)c1	28785770	YKKOTJNUSPGMRZ-UHFFFAOYSA-N	429.458	1.333	50	20	IDGD	
COC(=O)/C=C/c1cc(OC)c(OC)c(S(=O)(=O)NNC(=O)c2ccccc2C)c1	109205346	QLWYYUFDMYHQJY-MDZDMXLPSA-N	434.470	1.822	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)[C@H]2CCCN(C(C)=O)C2)c2ccccc2c1=O	115234234	YYKOKTBBHYTOPN-INIZCTEOSA-N	427.505	1.606	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCC2(c3ccccc3C)CC2)cc1	726718227	CIMQFFIHORRFJT-UHFFFAOYSA-N	444.557	1.986	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2)c1cc(Br)c[nH]1	728260530	GXOKEAVMTCUPTP-UHFFFAOYSA-N	447.223	1.080	50	20	IDGD	
COC(=O)Nc1cccc(C(=O)OCC(=O)NNC(=O)c2ccc(OC)c(OC)c2)c1	728660178	XGSFQCULXOWJCE-UHFFFAOYSA-N	431.401	1.500	50	20	IDGD	
CN(C)C(=O)CN1C(=O)C(=NNC(=O)Cc2cccnc2)c2cc(Br)ccc21	728786589	OAEMVBBZSDGSDZ-UHFFFAOYSA-N	444.289	1.342	50	20	IDGD	
CC(C)COc1ccc(S(=O)(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1	728854158	OCSULZQIGQPIHV-UHFFFAOYSA-N	433.534	1.738	50	20	IDGD	
COc1ccccc1CC(=O)N1CCC(NC(=O)NNC(=O)Cc2cccnc2)CC1	729050464	VUMVPKWDXBVIIQ-UHFFFAOYSA-N	425.489	1.197	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)CCc3c(C)nc4[nH]n(C)c(=O)c4c3C)n[nH]2)cc1	729520858	UHJPRWMUKQBTAC-UHFFFAOYSA-N	447.499	1.971	50	20	IDGD	
O=C(NN=Cc1c(N2CCOCC2)nc2ccccn2c1=O)c1cccc2ncccc12	730146038	BZEKAUAAPSPLSJ-UHFFFAOYSA-N	428.452	1.843	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H](C(C)C)N(C)C)c1	730272586	GLIOXPIZUIVFHE-IBGZPJMESA-N	448.545	1.843	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1nc(C)n(-c2ccccc2)n1	731743754	FRQNPLGAHSIGMZ-UHFFFAOYSA-N	443.847	1.856	50	20	IDGD	
CCNC(=O)CCC(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2OC)c1	732049628	WQNTXGDXDHZZCL-UHFFFAOYSA-N	448.501	1.173	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)NCCCCN1C(=O)c2ccccc2C1=O	732236312	UCTZUKAJEXMUTI-UHFFFAOYSA-N	428.420	1.611	50	20	IDGD	
O=C(COC(=O)Cc1cccc(Br)c1)NNC(=O)c1cccc([N+](=O)[O-])c1	732335569	MGDOLPAIUZOIEK-UHFFFAOYSA-N	436.218	1.904	50	20	IDGD	
CN(C)Cc1ccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc1	733793560	JLGDBQXZULHYGN-UHFFFAOYSA-N	430.530	1.608	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)CC(=O)NNC(=O)COc2ccc(C)c(C)c2)cc1F	734810248	VYIMWTWTDCDFRU-UHFFFAOYSA-N	436.461	1.645	50	20	IDGD	
CC(=O)N[C@H](C(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1)C1CCCC1	734824975	PIWOBZIMMIJJKN-INIZCTEOSA-N	425.530	1.411	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCc1ccc(N2CC=CC2)cc1	740903955	XJUWPBMXQISFDK-UHFFFAOYSA-N	442.545	1.809	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)c1ccc(N2CCCS2(=O)=O)cc1C	741518205	RQFNNNXNLCMQOU-UHFFFAOYSA-N	447.513	1.774	50	20	IDGD	
CCS(=O)(=O)NCc1ccc(C(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)cc1	741662249	MIVCQULYPYLJAN-INIZCTEOSA-N	433.530	1.971	50	20	IDGD	
COc1ccccc1O[C@H](C)CNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1	743588793	JIKGYQSAGANNSY-OAHLLOKOSA-N	428.493	1.500	50	20	IDGD	
O=C(NNc1ncccn1)[C@@H]1CCCCN1S(=O)(=O)c1ccc(Br)s1	743759988	ZILFMPLJXMYZKF-JTQLQIEISA-N	446.352	1.987	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)[C@H]2CC(=O)N(c3ccc(C)c(F)c3)C2)c1	744498943	ZCTNUHWQXKMHLA-INIZCTEOSA-N	427.432	1.800	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)[C@@H](NC(=O)c2ccco2)c2ccccc2)cc1	744548222	YLLUOUDDJQWEMU-FQEVSTJZSA-N	446.419	1.627	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc([N+](=O)[O-])cc1Br)c1ccc([N+](=O)[O-])cc1	746592589	ZMWAYVOEQDLNIJ-UHFFFAOYSA-N	445.207	1.889	50	20	IDGD	
COC(=O)/C=C/c1ccc(S(=O)(=O)NNC(=O)c2nnc(-c3ccccc3)o2)cc1	747607760	CUZFGOJHUUGWGQ-FMIVXFBMSA-N	428.426	1.546	50	20	IDGD	
Cc1cc(C)nc(SCc2ccc(C(=O)NNC(=O)C3=NN4CCCN=C4N3)cc2)n1	748010791	CDWGWOGQSJDDMQ-UHFFFAOYSA-N	438.517	1.125	50	20	IDGD	
Cc1nn(C)c(C)c1S(=O)(=O)N[C@H](C)C(=O)NNc1ccccc1Br	748058842	YVBPJIIQPZEBQR-SNVBAGLBSA-N	430.328	1.610	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)CNC(=O)NCc2ccc([N+](=O)[O-])cc2)cc1OC	748212421	MMHKUXJPSDDIHO-UHFFFAOYSA-N	445.432	1.263	50	20	IDGD	
COc1cc(OC)cc(N2CC[C@@H](NC(=O)NNC(=O)COc3ccccc3F)C2)c1	748661491	KHXHTGHQCWGPFD-CQSZACIVSA-N	432.452	1.831	50	20	IDGD	
CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)NNC(=O)COc1ccc(C#N)cc1	749330747	TWIAFQIPOWGTGP-HXUWFJFHSA-N	437.431	1.452	50	20	IDGD	
C[C@@H](O)c1ccc(CNC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc1	749348232	JEPKIAZHYDAAKT-OAHLLOKOSA-N	446.529	1.669	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)N2CCN(c3cnn(C)c3)C(=O)C2)c(C)n1C[C@@H]1CCCO1	750072701	RPGPCWACFJWQIN-LYFUXTGPSA-N	436.516	1.800	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)c1cnn(-c2ccc(Br)cc2)c1	751207109	ZVDBFPUEPCHCGI-UHFFFAOYSA-N	448.302	1.887	50	20	IDGD	
COc1ccc(C(=O)NNC(=S)N[C@H](C)C2CC2)cc1S(=O)(=O)NC1CCCC1	751618325	GNBUCPPQFBKKQM-GFCCVEGCSA-N	440.591	1.824	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)NC[C@@H]2CCC[C@@]23NC(=O)N(C)C3=O)c1C	752726574	WFECILJKZYOGMC-GHJUEYTQSA-N	427.505	1.495	50	20	IDGD	
CCc1cc(Br)ccc1NNC(=O)[C@@H]1CC(=O)N(CCN2CCOCC2)C1	753184226	CRYSOJGFOBJEQM-OAHLLOKOSA-N	439.354	1.635	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCN(C/C=C/c3ccccc3)CC2)cc1OC	755025455	XQRYBXXVVAZXTR-RMKNXTFCSA-N	438.528	1.796	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2c[nH]nc2C)cc1S(=O)(=O)N1CCCCC1	755413635	PHFUFDUSQQSTRI-UHFFFAOYSA-N	436.494	1.368	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)n([C@@H]2CCS(=O)(=O)C2)n1	755531779	IZHWNKHUPDYCNE-LLVKDONJSA-N	449.518	1.469	50	20	IDGD	
CC(=O)Nc1ccc(C)c(NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)c1	755901626	HSMNBTZKVGSGJM-UHFFFAOYSA-N	447.517	1.735	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])c(OCC(=O)N(C)C)c1	756204698	YVDDLMWZAANHSZ-UHFFFAOYSA-N	445.432	1.602	50	20	IDGD	
COCCS(=O)(=O)c1ccc(NC(=O)NNC(=O)COc2ccc(C)c(C)c2)cc1	756553966	NMWFVKKRCLXBHQ-UHFFFAOYSA-N	435.502	1.955	50	20	IDGD	
COC(=O)c1n[nH]c2ccc(NC(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)cc12	756575583	WDOANKRGOYIVCC-UHFFFAOYSA-N	435.400	1.063	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)Nc2ccc(S(=O)(=O)NCC(F)(F)F)cc2)c1	756641039	RTWJGXMRNDRSHC-UHFFFAOYSA-N	441.391	1.865	50	20	IDGD	
CN(C)C(=O)c1cc(NC(=O)NNC(=O)COc2ccc(Br)cc2)ccn1	756646199	JKNXTFFIFPZNKT-UHFFFAOYSA-N	436.266	1.778	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)NNC(=O)Cn1nc(C)cc1C	756674130	IDSHYVXOTACUQK-UHFFFAOYSA-N	438.510	1.002	50	20	IDGD	
CCCS(=O)(=O)Nc1cccc(NC(=O)NNC(=O)COc2ccccc2C#N)c1	756687661	XCVJKHWBZIFCNM-UHFFFAOYSA-N	431.474	1.942	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)Nc1ccc(S(=O)(=O)NC2CC2)cc1	756776540	PWZBVHFKTCEOIU-UHFFFAOYSA-N	429.458	1.231	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)Nc2cc(COC)ncn2)c2ccccc2c1=O	757721394	RTVMPVFSFHXZBT-UHFFFAOYSA-N	425.449	1.600	50	20	IDGD	
Cc1ccc(NC(=O)OC(C)(C)C)cc1NC(=O)NNC(=O)[C@H](C)NS(C)(=O)=O	757770278	HQZKSUSUIKZMCK-NSHDSACASA-N	429.499	1.432	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)Cc2ccc(OCCOC)cc2)c2ccccc2c1=O	757813030	DKOQWLANSGIXNQ-UHFFFAOYSA-N	438.484	1.835	50	20	IDGD	
Cn1cnn(-c2ccc(NC(=O)NNC(=O)c3cc(-c4ccc(F)cc4)[nH]n3)cc2)c1=O	757862090	FCGUDFOBKQPOOD-UHFFFAOYSA-N	436.407	1.567	50	20	IDGD	
O=C(NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)N[C@@H]1Cc2cccc(O)c2C1	759461418	GXFQWHWAPUZPID-MRXNPFEDSA-N	444.513	1.288	50	20	IDGD	
CCS(=O)(=O)c1cc(F)ccc1NC(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	760013554	MUXFBHAFSSSDAU-UHFFFAOYSA-N	447.448	1.977	50	20	IDGD	
CC1(C)C(=O)N(C[C@](C)(O)C(=O)NNC(=O)Cc2c[nH]c3ccccc23)c2ccccc21	760064625	AHZDSOXRTUNTIP-DEOSSOPVSA-N	434.496	1.933	50	20	IDGD	
O=C(COc1ccccc1OCC(F)(F)F)NNc1nccc(N2CCOCC2)n1	762860068	CMSULAJFTYTROK-UHFFFAOYSA-N	427.383	1.776	50	20	IDGD	
COCCOc1ccc(Br)cc1NC(=O)C(=O)NNC(=O)c1cccnc1	763490850	CKEJSIVYQYCCKM-UHFFFAOYSA-N	437.250	1.269	50	20	IDGD	
CC(=O)NNC(=O)C(=O)Nc1ccc(N2CCN(Cc3ccccc3)CC2)c(Cl)c1	763517288	WEUXPNFTSVGHIW-UHFFFAOYSA-N	429.908	1.768	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(NC(=O)C3CC3)cc2)cc1OC	763541713	APQVWVSEEFGAND-UHFFFAOYSA-N	426.429	1.452	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)[nH]n1)C(=O)Nc1cncc(Br)c1	763604242	KCBIIMNKINTGRJ-UHFFFAOYSA-N	429.234	1.634	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(=O)n(Cc3ccccc3)c2)cc1C	763664662	DQBBIXBQFJKYRB-UHFFFAOYSA-N	448.479	1.678	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(N3CCCC3=O)c(F)c2)cc1C	763667055	OQBOFVRKACPQCA-UHFFFAOYSA-N	442.447	1.734	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl	763679659	CBCPDACLMZCWRF-UHFFFAOYSA-N	436.808	1.812	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)C(=O)Nc1ccccc1CN1CCSCC1	763682180	YTVIBMMVNQUJFI-UHFFFAOYSA-N	446.504	1.539	50	20	IDGD	
CCNC(=O)c1ccc(C)c(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)c1	763684436	LIYPSZOBFZBNBI-UHFFFAOYSA-N	432.864	1.563	50	20	IDGD	
COc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NNC(=O)COc1ccc(Cl)cc1	763685979	HIXZTSMOATUXAT-UHFFFAOYSA-N	448.863	1.215	50	20	IDGD	
NC(=O)c1n[nH]c2ccc(NC(=O)C(=O)NNC(=O)CSc3ccc(Cl)cc3)cc12	763732789	FLBLEIFWOHKQDH-UHFFFAOYSA-N	446.876	1.193	50	20	IDGD	
O=C(CSc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1ccccc1-n1ccnn1	763733875	IGRGFBBHBMQBLE-UHFFFAOYSA-N	430.877	1.799	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2ccc3ccn(C)c3c2)c2ccccc2c1=O	763787334	XNNZMBZGCLKBOE-UHFFFAOYSA-N	432.440	1.308	50	20	IDGD	
C#Cc1cccc(NC(=O)C(=O)NNC(=O)c2nn(CCCCC)c(=O)c3ccccc23)c1	763821735	XBDAVOWIFAMBGW-UHFFFAOYSA-N	445.479	1.968	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)ccc1NC(C)=O	763867975	ZKAOXGICRVUNFP-LLVKDONJSA-N	432.408	1.346	50	20	IDGD	
CCOc1cc(F)ccc1NC(=O)C(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	763943280	CLDUVKOLYSARRA-UHFFFAOYSA-N	427.392	1.515	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CSc2ccccc2O)cc1S(=O)(=O)N(C)C	764045760	PJZHSDYLSNIJGT-UHFFFAOYSA-N	439.515	1.204	50	20	IDGD	
COCCOc1c(Cl)cccc1NC(=O)C(=O)NNC(=O)c1ccc(Cl)nc1	764101679	TWOHYMUKZYGHSD-UHFFFAOYSA-N	427.244	1.813	50	20	IDGD	
COCCOc1ccccc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccc(C)cc2)[nH]n1	764110400	IVHCYGMZFUWCPS-UHFFFAOYSA-N	437.456	1.810	50	20	IDGD	
CN(C)CC1CCN(c2ccc(NC(=O)C(=O)NNC(=O)CC(F)(F)F)cc2)CC1	764112979	RSAFJMBPCYYYCB-UHFFFAOYSA-N	429.443	1.503	50	20	IDGD	
COc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NNC(=O)c1ccc(Cl)cc1O	764126365	ITEWWIVPTJVOQR-UHFFFAOYSA-N	434.836	1.156	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2ccc(C(=O)NC(C)(C)C)cc2)cc1	764126919	MDJUJUHLSXMJII-UHFFFAOYSA-N	440.500	1.942	50	20	IDGD	
CCOC(=O)c1c(C2CC2)csc1NC(=O)C(=O)NNC(=O)c1cccc(OC)c1O	764131530	PYHDUKIAMPFRSR-UHFFFAOYSA-N	447.469	1.916	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)sc(C)c1CC	764166854	FRNQXUUANMCQRP-HNNXBMFYSA-N	445.497	1.885	50	20	IDGD	
Cc1c(CS(C)(=O)=O)cccc1NC(=O)C(=O)NNC(=O)C(C)(C)c1ccccc1	764303021	RCYNMCBXHAAGKH-UHFFFAOYSA-N	431.514	1.603	50	20	IDGD	
Cn1cc(Br)cc(NC(=O)C(=O)NNC(=O)c2cc3ccccc3o2)c1=O	764330664	FILJGGQFUCBMPI-UHFFFAOYSA-N	433.218	1.294	50	20	IDGD	
CCCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1	764343018	LZUCHSGCHYVQNX-UHFFFAOYSA-N	434.456	1.412	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)C(=O)Nc1ccc(Cl)c(C(=O)NC2CC2)c1	764366519	MWCDYYAQZLUOQB-UHFFFAOYSA-N	444.875	1.535	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)C(=O)Nc1ccc(C(=O)NCc2ccccc2)cc1	764387377	QRWBTWCYPDBHLH-UHFFFAOYSA-N	431.452	1.720	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1cnn(-c2ccccn2)c1	764392801	LEABPXYFHWQUCO-UHFFFAOYSA-N	426.458	1.154	50	20	IDGD	
CC(=O)Nc1c(C)ccc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)c1C	764392953	AZNCFVOZXCEWHB-UHFFFAOYSA-N	430.486	1.846	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)ccc1N1CCOCC1	764404380	JZMMSZKYFLLVQP-UHFFFAOYSA-N	444.513	1.415	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCCOCC(F)(F)C(F)F	764756396	CGNYIOTVKYDVJL-UHFFFAOYSA-N	443.423	1.149	50	20	IDGD	
O=C(CC[S@](=O)c1ccc2c(c1)OCCO2)NNC(=O)CSc1ccccc1O	765247860	LBBDGSFROCSIAG-LJAQVGFWSA-N	436.511	1.601	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)[C@H]1CC(c2cc(F)ccc2F)=NO1	765317206	LZOKJPWESKJRPB-OAHLLOKOSA-N	426.420	1.910	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NCC2(N3CCOCC3)CC2)c2ccccc2c1=O	765640039	BLJZKOSOQBSQHU-UHFFFAOYSA-N	442.520	1.005	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)Cc3cn4cccc(C)c4n3)CC2)cc1	766647861	WXXKNGSMXBGPOZ-UHFFFAOYSA-N	434.544	1.459	50	20	IDGD	
CC(C)(O)C(=O)NNC(=O)C1(NC(=O)NCc2cccc(Br)c2)CCCC1	768258981	CFCBNXRWNSHADH-UHFFFAOYSA-N	441.326	1.479	50	20	IDGD	
CC(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)c1	770253242	KGXGINNSDPWGTI-UHFFFAOYSA-N	437.905	1.600	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)NCc1cc(S(N)(=O)=O)ccc1F	770626918	XAFFVYKYTFDSNL-SNVBAGLBSA-N	444.872	1.424	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)c1	770967722	HCPHHXOYWUJHGD-UHFFFAOYSA-N	433.494	1.294	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)[C@@H](Cc3ccccc3)NC(=O)c3ccccc3)nc21	770990795	ORWSAYRIDTWOSA-QGZVFWFLSA-N	431.456	1.553	50	20	IDGD	
CCc1ccccc1OCC(=O)NNS(=O)(=O)c1ccc(NS(C)(=O)=O)c(F)c1	771147582	GEXZKFMGEARCSN-UHFFFAOYSA-N	445.494	1.148	50	20	IDGD	
COc1ccc(-n2nc(C(=O)OCC(=O)NNC(=O)c3cccc(C#N)c3)cc2C)cc1	771170269	JIOZQWKHESSOLK-UHFFFAOYSA-N	433.424	1.679	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)N[C@@H]1[C@H]2CCc3ccccc3[C@H]21	772631884	SWOMQLRZLZYQCZ-GVDBMIGSSA-N	427.530	1.961	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)[C@]2(C)Cc3ccccc3C(=O)O2)C1	773421099	QWNLCJRUTPBLLB-NYHFZMIOSA-N	431.489	1.953	50	20	IDGD	
CCC(C)(C)NC(=S)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	774138926	MSJRBORCOJXZKV-UHFFFAOYSA-N	442.607	1.324	50	20	IDGD	
CS(=O)(=O)C[C@H](NC(=O)NNC(=O)c1nn(-c2ccccc2)cc1O)c1ccccc1	774279836	NKYHXIMBRJWPTC-INIZCTEOSA-N	443.485	1.308	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN[C@H](CC(=O)N(C)C)c2ccccc2)cc1OC	775218516	SHJDATTWMGLWFK-QGZVFWFLSA-N	428.489	1.274	50	20	IDGD	
COc1ccnc(NNC(=O)Nc2ccc(Cl)c(S(=O)(=O)N3CCOCC3)c2)n1	775421285	DOVHNRMIOWBVPG-UHFFFAOYSA-N	442.885	1.308	50	20	IDGD	
CC1C[C@@H](C(=O)NNc2nccnc2Cl)[C@H](C(=O)NNc2nccnc2Cl)C1	776148708	TWDYEMSEWGHVHA-NXEZZACHSA-N	425.280	1.822	50	20	IDGD	
CCOc1ccccc1[C@](N)(C(=O)NNC(=O)[C@@H]1COc2ccccc2O1)C(F)(F)F	776318190	QNFKSJLOHNKFQL-LPHOPBHVSA-N	439.390	1.789	50	20	IDGD	
COC(=O)CNC(=O)Cc1ccc(NC(=O)NNc2cccc(S(C)(=O)=O)c2)cc1	776465773	MRROGENGSIWLCI-UHFFFAOYSA-N	434.474	1.070	50	20	IDGD	
CCO[C@@H]1C[C@@H](NC(=O)NNC(=O)CNC(=O)c2cccs2)[C@H]1Oc1ccccc1	776476698	KWSHAWGQVWZVOU-IIDMSEBBSA-N	432.502	1.433	50	20	IDGD	
COc1ccccc1[C@]1(C)NC(=O)N(CC(=O)NNc2cccc(S(C)(=O)=O)c2)C1=O	776541090	GTASCOYTJNGXBN-FQEVSTJZSA-N	446.485	1.009	50	20	IDGD	
Cc1cc(C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)nn1[C@@H](C)C1CC1	777524155	SJYSNYANKAHSEN-HNNXBMFYSA-N	447.565	1.251	50	20	IDGD	
C[C@@H]1CCN(C(=O)OC(C)(C)C)[C@H](C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)C1	778420674	UIVFDWOTCVPVRO-PBHICJAKSA-N	444.488	1.898	50	20	IDGD	
COCCN1C(=O)CCc2cc(NC(=O)C(=O)NNC(=O)c3c[nH]c4ccccc34)ccc21	778706841	ZGUFAMLSLBMSLO-UHFFFAOYSA-N	449.467	1.493	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)N[C@H]2CCN(c3ccc(Cl)c(Cl)c3)C2=O)n1	779379607	FAWSHXDHWGEKNK-HNNXBMFYSA-N	439.303	1.943	50	20	IDGD	
O=C(COCc1ccccc1)NNS(=O)(=O)c1cc(C(=O)O)c(F)c(Cl)c1F	779837510	TURUSABZOLNTPZ-UHFFFAOYSA-N	434.804	1.843	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)C2CCN(S(=O)(=O)c3c(C)noc3C)CC2)c1	780792924	VFIYPRPCXZOMTQ-UHFFFAOYSA-N	436.490	1.622	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)NC[C@@H]2CC(=O)N(C3CC3)C2)cc1Cl	780891022	MQHUDEQFUQVCGP-JTQLQIEISA-N	425.873	1.704	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)N[C@H]3CCc4nnc(-c5ccc(F)cc5)n4C3)nc21	780909583	RLJVFMSWFGJBLU-LBPRGKRZSA-N	438.427	1.108	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)NC[C@H](C)C#N)c2)cc1	781943758	FJFPMNZINBJZGP-CYBMUJFWSA-N	431.474	1.600	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN[C@H](CN2CCOCC2)c2ccccc2)cc1OC	782456360	MHIYXXKKAXUBPC-LJQANCHMSA-N	442.516	1.128	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C(=O)N2C[C@H]3CCCN3c3ccccc32)nc2ccccc21	782888595	VTAJFGOCOZJTJJ-OAHLLOKOSA-N	432.484	1.279	50	20	IDGD	
O=C(NNc1ccccc1Br)C(=O)Nc1cccc(CN2C(=O)CNC2=O)c1	782989063	UFGQSLDGDHRNJJ-UHFFFAOYSA-N	446.261	1.583	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2ccccc2Oc2cc(F)cc(F)c2)CCS(=O)(=O)C1	783428355	VBMZGYPAQOXKJC-LJQANCHMSA-N	439.440	1.894	50	20	IDGD	
C[C@@H]1CN(c2ccc(NC(=O)C(=O)NNc3ccc(Br)cn3)cn2)C[C@@H](C)O1	784340315	AAVJTJAYRBFGMX-VXGBXAGGSA-N	449.309	1.935	50	20	IDGD	
Cc1ccc(NC(=O)C2CC2)cc1NC(=O)C(=O)NNc1cccc(S(C)(=O)=O)c1	784839877	RQCAAOJFABAUMS-UHFFFAOYSA-N	430.486	1.829	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNc2nc(C(F)(F)F)cs2)cc1C(=O)OC	785148158	XLTJGFQCUZLXDU-UHFFFAOYSA-N	446.363	1.817	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl	785330544	JZLRVZRHBNHFDD-UHFFFAOYSA-N	442.837	1.742	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1ccc(S(=O)(=O)Nc2ccccc2OC)cc1	785456419	ORURIHIHVQOVGY-ZDUSSCGKSA-N	449.485	1.599	50	20	IDGD	
Cc1noc(C)c1S(=O)(=O)N1CCCN(C(=O)/C(C#N)=C/c2ccc(O)cc2)CC1	786784052	PNPXNIYLMZJKGY-SFQUDFHCSA-N	430.486	1.827	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)Cc2c(C(=O)NNC(=O)c3ccc(C)o3)c(C)cn2C)o1	787417984	MUXPUICIPVLPEB-UHFFFAOYSA-N	441.444	1.215	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(C)c(N2CCNC2=O)c1	787541423	RTRIUMIYKNTFPC-UHFFFAOYSA-N	439.472	1.252	50	20	IDGD	
CC(C)N1C(=O)C[C@H](C(=O)NNC(=O)N2CCN(C)CC2)[C@@H]1c1ccc(Cl)c(F)c1	788168768	BVWCNVJEXXKMCK-KSSFIOAISA-N	439.919	1.765	50	20	IDGD	
CN(C)[C@@H]1CCOc2c(NC(=O)C(=O)NNc3cccc(S(C)(=O)=O)c3)cccc21	789728169	XXGXKFSIIDSFNT-QGZVFWFLSA-N	432.502	1.557	50	20	IDGD	
Cn1nc([C@@H]2CCCO2)cc1NC(=O)C(=O)NNC(=O)CSc1ccc(Cl)cc1	789731999	KBMALUOPTGDOCE-AWEZNQCLSA-N	437.909	1.803	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])n1	790742693	KKEVDLHWKSPCRT-UHFFFAOYSA-N	444.828	1.628	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)c2c[nH]c3ncc(Br)cc23)c1	792056919	IZKPXGXLFJYFDP-UHFFFAOYSA-N	437.275	1.804	50	20	IDGD	
CC(C)(C)n1nccc1NC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	792379179	GTIJMJQCZKFMLN-UHFFFAOYSA-N	434.522	1.889	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCC1(S(C)(=O)=O)CCC1	792782070	YULDMTSBXZPQEE-LLVKDONJSA-N	448.339	1.514	50	20	IDGD	
CN(C)c1nnc(-c2ccc(NC(=O)C(=O)NNc3ccc4c(=O)[nH]ccc4c3)cc2)o1	793069954	SKABFBXKWPNWON-UHFFFAOYSA-N	433.428	1.726	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCOc3ccc(Br)cc3C2)n1	801967866	LQQTWXNOOZCYOE-UHFFFAOYSA-N	439.335	1.799	50	20	IDGD	
N#Cc1ccc(N2C(=O)N[C@H](CCC(=O)NNC(=O)Nc3cc(F)cc(F)c3)C2=O)cc1	802000708	XWTCLLQLXZKZLB-MRXNPFEDSA-N	442.382	1.894	50	20	IDGD	
Cc1c(C(=O)NNC(=O)Nc2ccc3c(c2)OCO3)cnn1CCO[C@@H]1CCCCO1	802104552	FWVAKBPBIFEXIX-GOSISDBHSA-N	431.449	1.930	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)N1CC[C@H](N2CCN(C(=O)OC(C)(C)C)CC2)C1	804868315	CPIZNOISBJAKRG-KRWDZBQOSA-N	431.537	1.976	50	20	IDGD	
CN(NC(=O)Nc1cccc2c1CNC2=O)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	806753517	PZROKOMMDVFZHU-UHFFFAOYSA-N	432.481	1.571	50	20	IDGD	
COCc1cnc(NC(=O)C(=O)NNC(=O)c2cc(F)ccc2Br)s1	806978867	MNQQEFXKACEQIW-UHFFFAOYSA-N	431.243	1.591	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)C(=O)Nc1cc(C(F)(F)F)cc(Br)n1	806979384	SGVDHBQZCIEDJL-UHFFFAOYSA-N	446.183	1.966	50	20	IDGD	
CN(C)[C@@H](CNC(=O)NNC(=O)c1csc(N2CCOCC2)n1)c1cccc(F)c1	807005870	HGVCPHLWRTZMKB-INIZCTEOSA-N	436.513	1.366	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2ccsc2C(=O)NNC(=O)N2CCN(C)CC2)cc1	807382074	WCYUFJJPLGSNKT-UHFFFAOYSA-N	437.547	1.459	50	20	IDGD	
CC[C@H](C)N[C@H](CNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)c1ccco1	807439972	BFFYVFJHRBKZOD-DOTOQJQBSA-N	429.525	1.746	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2cnc(NC(C)=O)s2)cc1Br	808092368	YQSSAHCLRHFUKU-UHFFFAOYSA-N	449.308	1.496	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)Cc2ccc(F)cc2)nn1-c1ccc(F)cc1F	808934371	BYZMXMGIXMEODY-UHFFFAOYSA-N	431.374	1.927	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)Nc1ccn2ccnc2c1	810230488	HNAGZDNKQKYSFJ-UHFFFAOYSA-N	428.474	1.585	50	20	IDGD	
COC(=O)c1cc(Br)cc(C(=O)NNC(=O)Cc2cn3ccccc3n2)c1	812525664	JFFDHKMNQWSSAO-UHFFFAOYSA-N	431.246	1.887	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)CN2C(=O)COc3ccc(Cl)cc32)cc1	812726509	GVQNQOPNZHYSBD-UHFFFAOYSA-N	438.893	1.459	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2ccc3c(c2)CCCC3=O)cc1OC	815375608	BXNSBPIZHGUSIU-UHFFFAOYSA-N	426.425	1.841	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NNc2ccccc2S(=O)(=O)N(C)C)cc1	817053519	VIUSOLZVJAYZER-AWEZNQCLSA-N	440.547	1.055	50	20	IDGD	
CC(C)n1ncc2cc(/C=C(\C#N)C(=O)c3c(N)n(C)c(=O)n(C)c3=O)c(Cl)nc21	873937463	AULSOZMIIYQEIU-VZUCSPMQSA-N	427.852	1.435	50	20	IDGD	
Cc1nc(C(=O)NNC(=S)Nc2cc(C(F)(F)F)ccc2Cl)nn1-c1nc[nH]n1	913479043	LMIOVJWWXNHODX-UHFFFAOYSA-N	445.818	1.997	50	20	IDGD	
O=C(NNC(=O)[C@H]1CC(=O)N(c2ccccc2Br)C1)c1ccc2c(c1)OCO2	913632673	NIELWDMUHURODL-LBPRGKRZSA-N	446.257	1.992	50	20	IDGD	
CC(=NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)c1cccc(O)c1	915914565	VYHUSUGCXWULKM-UHFFFAOYSA-N	431.514	1.886	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCCc2cnn(-c3ccccc3)c2)nc1	916242787	DCWKKNBJLTVYIP-UHFFFAOYSA-N	443.533	1.823	50	20	IDGD	
O=C(NC[C@H]1Cc2ccccc2O1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	916516154	KSOGBZMZEXLDKX-QGZVFWFLSA-N	444.513	1.419	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H]2CC(=O)N(c3ccc(Cl)cc3)C2)c1	917108937	VJJWLLPLZKDOAB-ZDUSSCGKSA-N	435.889	1.558	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)CN(C)C(=O)c1ccc(Br)o1	917393389	LQAPOUZQEIKUNG-UHFFFAOYSA-N	439.266	1.382	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)c1ccc(-n2nccc2-c2ccc(F)cc2)cc1	919694297	UTMUTQKMRINUTP-INIZCTEOSA-N	442.472	1.874	50	20	IDGD	
Cn1cc(CNC(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)cn1	919792906	VAZUXVQSAOKZFD-UHFFFAOYSA-N	431.456	1.323	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)NCCN2CCN(c3ccccc3)CC2)cc1	919905648	GXQRGOJHPAFWJC-UHFFFAOYSA-N	425.533	1.780	50	20	IDGD	
CCOc1ccc(/C=C(/C#N)C(=O)NCCNS(=O)(=O)c2ccc([N+](=O)[O-])cc2)cc1	920039794	LYRPKXFVHGOSCK-SSZFMOIBSA-N	444.469	1.995	50	20	IDGD	
NC(=O)[C@@H]1CCCN1Cc1cccc(NC(=O)NNC(=O)c2nnc(O)c3ccccc23)c1	920928512	KOXLUNGKEBQLOJ-KRWDZBQOSA-N	449.471	1.252	50	20	IDGD	
COCCN1C(=O)/C(=C/NNC(=O)c2ccc(OCCC(C)C)cc2)C(=O)NC1=S	920978948	WVFMWBFSYPXKJI-FOWTUZBSSA-N	434.518	1.120	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCC[C@@H](C(=O)NNC(=O)c2ccccc2F)C1)c1ccccc1F	921273275	GTVJCSRRRAKOCV-ZIAGYGMSSA-N	444.438	1.993	50	20	IDGD	
CS(=O)(=O)Cc1cccc(CNC(=O)NNC(=O)c2cncn2-c2ccccc2)c1	1115924507	LAJMQCFDRURLNT-UHFFFAOYSA-N	427.486	1.561	50	20	IDGD	
O=C(CCc1ccc2c(c1)CCO2)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	1116237379	UXTGEJTZSYRIHT-UHFFFAOYSA-N	443.525	1.800	50	20	IDGD	
COC(=O)N1CCCN(C(=O)CCC(=O)C(C#N)=C2N(C)c3ccccc3N2C)CC1	1318142870	HKCMJNQXOZFLEH-UHFFFAOYSA-N	425.489	1.958	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)N[C@H]2CCC[C@H](S(C)(=O)=O)C2)CC1	1318801336	RWQJJBJJSVGODI-GJZGRUSLSA-N	446.570	1.320	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)c2cccc(C(=O)NC)n2)c2ccccc2c1=O	1319158815	ZSKUAAFICYXRQL-UHFFFAOYSA-N	436.472	1.416	50	20	IDGD	
Cc1cc(C(=O)N2CCOCC2)ccc1NC(=O)NNC(=O)c1n[nH]c2c1CCCC2	1320257533	BPWDXDQXTGDHFZ-UHFFFAOYSA-N	426.477	1.536	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)C1CCN(c2ncccn2)CC1)c1ccc(S(C)(=O)=O)cc1	1331661281	OQSVWLZEIALAKP-CQSZACIVSA-N	431.518	1.048	50	20	IDGD	
COCc1oncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](Cl)COC)C2	1778344246	DRNLQXQUTCEZRK-ZSZQSSIHSA-N	429.901	1.202	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2)c1n[nH]c2c(F)cccc12	1779094549	QHHBFKRVFOLDMN-BXTJHSDWSA-N	438.887	1.429	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(Cl)nc(OC)c3)C2)C1	1779794473	LQAQNCIVJVYNSN-SCLBCKFNSA-N	432.304	1.441	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3c[nH]c4ccc(OC)nc34)C2)C1	1780045788	FRTCIXPLIKTZNV-VBKZILBWSA-N	436.896	1.269	50	20	IDGD	
COc1cc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@](C)(Cl)CCl)C2)nn1C	1780714614	FQJGKTSBRAALRU-MDASCCDHSA-N	447.363	1.793	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc([N+](=O)[O-])cc3F)C2)C1	1781555381	ZHNDPYDRQZGICC-KSSFIOAISA-N	429.832	1.431	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnn(C)c1Cl)C2	1782173536	HPOMHDCAZOJXRI-PMUMKWKESA-N	433.336	1.455	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CCC(=O)NN(C)C)C2)c(C)o1	1782210897	XRWSDNRVLVPGNM-XMSQKQJNSA-N	434.537	1.397	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4c(c3)NC(=O)CC4)C2)C1	1782517046	WIQZGBVGJRMFHZ-JOCHJYFZSA-N	445.592	1.866	50	20	IDGD	
CC(C)[C@H]1CC[C@H](C(=O)N2CC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)CC1	1783370426	CJBNBZBFNRVQBV-KHCICDEESA-N	442.365	1.272	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@H](C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](C)Br)C3)C2)C1	1783539846	OHYVKMMZECYGBP-NXEZDXNNSA-N	445.354	1.579	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)CCOCCOCCOC)C2)C1	1783661548	KCFGYLMCHVWHOM-PXNSSMCTSA-N	434.961	1.294	50	20	IDGD	
COc1ccnc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)C(C)(C)CCl)[C@H]3C2)c1OC	1783851577	BFPPVSBPWSZQDU-DZKIICNBSA-N	439.940	1.957	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccc(Cl)c(F)c1)CCO2	1783934430	GYXFOFIOOWGPNH-HXUWFJFHSA-N	440.903	1.296	50	20	IDGD	
CC(=O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](Br)Cc3ccccc3)C[C@@H]21	1786347998	IEEAEYRTOPTDFZ-FJIDUMEYSA-N	437.334	1.561	50	20	IDGD	
O=C(NCCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]2C1)c1ccccc1	1787451287	GDKHSVQHXNSFDW-OVWQWFNUSA-N	425.888	1.321	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4c(c3)OCCO4)[C@H]2C1	1787813663	ORQUTLCYSOSTEQ-FPXQBCRKSA-N	438.908	1.305	50	20	IDGD	
CN(CC(=O)NC1(c2ccc(NC(=O)CN)cc2)CCC1)NC(=O)NCc1ccccc1	1787972599	PBMWINZEIBQLHQ-UHFFFAOYSA-N	438.532	1.425	50	20	IDGD	
CC(=O)N/C(C)=C/C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)CBr)C[C@@H]21	1790556061	UVLYIXPEGRTCAC-GKVARZMTSA-N	430.343	1.037	50	20	IDGD	
CC[C@H]1CC[C@H](C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]32)CC1	1791106149	LEAAGAULIQVXOW-HVTWWXFQSA-N	436.597	1.556	50	20	IDGD	
O=C(Cn1cccc([N+](=O)[O-])c1=O)Nc1ccc(C2(NC(=O)[C@@H](O)CCl)CCC2)cc1	1791111213	NTMXNPFYRQLQMW-INIZCTEOSA-N	448.863	1.490	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(=O)c2ccccc2o1	1792765385	HPFZHRFXLWCQNN-FCIKYMEBSA-N	434.876	1.250	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)CBr)C2	1792866552	FZUMVQCFQDGZSR-NJMOYASZSA-N	440.176	1.638	50	20	IDGD	
CC(C)(CCl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1CCN(S(C)(=O)=O)CC1)C2	1792881286	CEZDIWGBOQLQJB-MUJYYYPQSA-N	434.002	1.561	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCl)[C@@H](O)c1cccc(Br)c1	1793115797	ZGYGVRZUWLFHOO-QRJUGERDSA-N	445.741	1.720	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCc1ccc(C)c(F)c1	1793310910	AGHSIMZUQIUBFX-AXVVYFOYSA-N	426.916	1.910	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCN1C(=O)c2ccccc2C1=O	1793862559	ZJIANFXQBGOZFS-QOIYZWAUSA-N	447.919	1.280	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CNC(=O)c1cccnc1	1794226502	RMHLGNQQGLXFFV-NXEZDXNNSA-N	427.332	1.686	50	20	IDGD	
O=C(Cc1ccc(C(F)(F)F)cc1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2	1795262304	CETGYSQCJBRFJI-IARIHHJXSA-N	434.842	1.437	50	20	IDGD	
O=C(Cc1ccc(Cl)s1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1	1796188370	VWSLDCGGRMAPKN-MUJYYYPQSA-N	432.738	1.576	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@](F)(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](O)CCl)C3)C1	1797898770	XOJMEUHLOQYVAD-SGQRUEDASA-N	447.935	1.573	50	20	IDGD	
COc1cccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Br)c1C	1799352051	JLNUHOJNEUVBJM-VZAMPYOESA-N	429.286	1.897	50	20	IDGD	
CCOc1cccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)Br)C3)c1O	1799756707	NSCLMGQQYQWSSU-JFILPPLUSA-N	441.322	1.778	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CCCN1C(C)C)C2	1800644103	IKTMFRYXJOUEMS-QEOTZNIISA-N	430.387	1.622	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cn1cnc3ccccc31)C2	1800644228	NZKDVSXBIREJHQ-NXEZDXNNSA-N	449.349	1.799	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3cnccc3n1)C2	1800756586	ATPJBXVWYMRQNG-DPYKFYPSSA-N	433.306	1.616	50	20	IDGD	
COC(=O)C12CC(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)[C@@H](C)CBr)C4)(C1)C2	1801874871	MBXIEDCNHMGIHW-DUGJLFPFSA-N	427.339	1.999	50	20	IDGD	
COC[C@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cc1ccc(S(C)(=O)=O)cc1)C2	1802273669	OBSAOCLTDFIYEZ-DFGXFYAUSA-N	442.965	1.525	50	20	IDGD	
COc1ccc(CCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CCC(=O)NN(C)C)cn1	1802332320	AUCIAXKRCDNRLA-BCDXTJNWSA-N	431.537	1.034	50	20	IDGD	
CC(C)(CCl)C(=O)NC[C@H]1CCN(C(=O)CCN2C(=O)C=CC2=O)[C@H]1c1cccnc1	1802898562	XTZZKEGZSIUBMB-UZLBHIALSA-N	446.935	1.668	50	20	IDGD	
CCC(=O)N[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)Br)[C@@H]1c1cccnc1	1803436563	GEZJTTVJKMHSJU-LNCBFAARSA-N	439.354	1.786	50	20	IDGD	
C[C@H](CC(N)=O)C(=O)NC[C@@H]1CCN(C(=O)[C@@](C)(Cl)CCl)[C@H]1c1cccnc1	1803672410	XHQJLLHOBJYBMW-AGLNLLDASA-N	429.348	1.835	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)c2cccnc2)[C@H]1c1cccnc1	1805465952	YTGBTEALMMHPPJ-OXJNMPFZSA-N	445.483	1.109	50	20	IDGD	
CCOC(=O)/C=C/C(=O)N1CC[C@@H](CNC(=O)CCBr)[C@@H]1c1cccnc1	1806339469	MPVADAMOTIIAEX-IDVWOMCOSA-N	438.322	1.992	50	20	IDGD	
CN(C)CC(=O)N1CCC2(CCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)CC1	1806757399	ZKGXIKILJROIQX-INIZCTEOSA-N	445.004	1.911	50	20	IDGD	
CN1CCN(CCC(=O)NC[C@@H]2CCN(C(=O)C(Cl)Cl)[C@H]2c2cccnc2)CC1	1806915742	COPPDYBVOZIUST-WMZOPIPTSA-N	442.391	1.529	50	20	IDGD	
CC1(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)CCCC1	1807365793	PFYDUSYAPCJMQW-PZJWPPBQSA-N	435.333	1.661	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)[C@H]1Cc2ccccc2CN1	1808321797	WNNNOFOEODNIGE-WOZUAGRISA-N	442.947	1.402	50	20	IDGD	
Cc1cccc(CC(=O)N2CCC3(CCCN(C(=O)c4cccc(B(O)O)c4)C3)CC2)n1	1809977275	CUZQIQGEHQKRDC-UHFFFAOYSA-N	435.333	1.157	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)[C@H]2C[C@@H]2F)[C@H]1c1cccnc1	1812476279	WAGNJVIXONUZGJ-CCTKTUGFSA-N	440.479	1.579	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)Cn2ccccc2=O)[C@H]1c1cccnc1	1812865412	YBCQQMJEGFFVDN-QOKNQOGYSA-N	447.333	1.733	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)CCn2cncn2)[C@H]1c1cccnc1	1812867350	ICOJYTULYHWQOK-QRTARXTBSA-N	435.326	1.553	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)Cc2cc(C)n(C)n2)[C@H]1c1cccnc1	1813028596	PUZOWMBAZFTZDT-KPFFTGBYSA-N	433.940	1.626	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)C(C)(C)CCl)[C@H]1c1cccnc1	1813068924	QUZGOSLGONORNB-LPHOPBHVSA-N	437.972	1.725	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)C[C@@H]2CCCCO2)n[nH]1	1815608385	FDMPDAKWTSRPKY-RDJZCZTQSA-N	434.541	1.734	50	20	IDGD	
COCCC(=O)Nc1cc([C@H]2CCCCN2C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[nH]n1	1817038847	GHMPTDUROZGURY-DXRSZSRVSA-N	429.481	1.572	50	20	IDGD	
Cc1ccoc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2	1817415945	VLSXPRJHUWTZCH-AWEZNQCLSA-N	425.275	1.264	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cncc(F)c2)[nH]n1)c1ccc(B(O)O)cc1	1817470914	MKWFBRXJVJWVQU-GOSISDBHSA-N	437.240	1.243	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)c(C)n1C	1817472354	ROFUMLZGXCLBTL-FQEVSTJZSA-N	449.320	1.665	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1	1817479357	LLHWFCJJZLMXLI-ABAIWWIYSA-N	449.114	1.179	50	20	IDGD	
CO/C=C(\C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819403433	LWSFSTPCLSSZGO-PCUGXKRQSA-N	427.465	1.264	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](C)Br)CC2	1819694331	CUNDZNABQJBDIE-BBBLOLIVSA-N	446.371	1.546	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)c2cccc(O)n2)CC1	1825943426	KZCPEIYEFHSALA-HXUWFJFHSA-N	437.305	1.014	50	20	IDGD	
N#Cc1cccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)c1	1829952766	YFUZCCZGCOWGAF-HSZRJFAPSA-N	445.328	1.785	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)COc3ccc(O)cc3)CCO2)C1	1830345661	CJDKHHADGJMHNW-XLIONFOSSA-N	426.897	1.245	50	20	IDGD	
Cc1cccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)c1Cl	1830737307	GZZUIAXZHCXRDV-KXBFYZLASA-N	431.316	1.318	50	20	IDGD	
O=C(Cc1c(F)ccc(F)c1F)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1832072833	WGHCMRTUMINCKF-FUHWJXTLSA-N	438.805	1.637	50	20	IDGD	
CC(C)[C@@H](O)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)CBr)CC2)CC1	1833344044	RWHGJKIFUSUJFR-WMLDXEAASA-N	432.403	1.606	50	20	IDGD	
CC(C)c1nc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)co1	1833346447	JYOIJCLUXKUIFP-SUMWQHHRSA-N	448.289	1.559	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)Cn3cc([N+](=O)[O-])cn3)CC2)CC1	1833786963	ONVBBQXQNCWJGP-QGZVFWFLSA-N	440.932	1.380	50	20	IDGD	
Cn1nncc1C(=O)NC1CCN(C2CCN(C(=O)[C@](C)(Cl)CCl)CC2)CC1	1833898874	FLBWQTXMRMQLMP-GOSISDBHSA-N	431.368	1.237	50	20	IDGD	
Cn1cccc1C(=O)NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1	1834100563	RZUICBJVZSABSN-INIZCTEOSA-N	429.334	1.901	50	20	IDGD	
Cc1nc(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](F)Br)CC3)CC2)co1	1834204537	FQVSBMDNNWVYJL-OAHLLOKOSA-N	431.306	1.859	50	20	IDGD	
O=C(CCBr)NC1CCN(C2CCN(C(=O)[C@H](O)c3ccco3)CC2)CC1	1834421805	WOMBOZVFGWZIPE-GOSISDBHSA-N	442.354	1.670	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCC(N2CCC(NC(=O)c3cc(O)n[nH]3)CC2)CC1	1834770701	LKKRKWBBTNGRQN-SFHVURJKSA-N	432.352	1.537	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3cscn3)CCO2)C1	1836044594	BBEDMINJXCQUAO-RHSMWYFYSA-N	446.367	1.316	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnccc3F)CCO2)C1	1836319796	ZPKVWYKIGVXURC-KBXCAEBGSA-N	444.301	1.464	50	20	IDGD	
O=C(c1cnc2[nH]ncc2c1)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836717288	RZRRAOZHSHEDCD-KRWDZBQOSA-N	435.912	1.170	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836718929	JARGOFIFTNFLQM-MRXNPFEDSA-N	447.960	1.109	50	20	IDGD	
O=C(c1n[nH]cc1[N+](=O)[O-])N1CCC(OC2CCN(C(=O)C(Cl)Cl)CC2)CC1	1838444053	WAXHFXUENUQZPZ-UHFFFAOYSA-N	434.280	1.734	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(C)ccc3O)CCO2)C1	1838894427	SIYCHQDHQOTTCJ-OXQOHEQNSA-N	426.897	1.024	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3c(OC)cccc3OC)C2)C1	1839145840	FMLMHPKMTFMAEW-VFNWGFHPSA-N	440.924	1.791	50	20	IDGD	
O=C(c1n[nH]c2cccc(F)c12)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1839599849	LUIIWZIVEXMFFB-GOSISDBHSA-N	445.278	1.576	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)c3ccccn3)C2)C1	1840156806	ZYDQOIMJIIUSSM-IIBYNOLFSA-N	439.940	1.069	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC12CN(C(=O)[C@@H](O)CNC(=O)OC(C)(C)C)C2	1841285077	BBZNUBWFEWZUAI-OLZOCXBDSA-N	448.358	1.106	50	20	IDGD	
CC(C)(C)OC(=O)NC12CC(C(=O)N3CC4(CCCN4C(=O)[C@H](O)CCl)C3)(C1)C2	1841353615	HDSDZGWAASPMRA-XYJCDUHRSA-N	427.929	1.237	50	20	IDGD	
Cc1ccc(NCCC(=O)N2CC3(CCCN3C(=O)c3ccc(B(O)O)cc3)C2)c(C)c1	1843011420	BMCPQZHYJQNJSJ-UHFFFAOYSA-N	435.333	1.302	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@H]2C[C@H](O)CN2C(=O)OC(C)(C)C)C1	1843105026	YYIHTVYETRNPJU-KKUMJFAQSA-N	429.945	1.578	50	20	IDGD	
CCc1nc2ccc(Cl)cn2c1C(=O)N1CCCC12CN(C(=O)[C@H](O)CCl)C2	1843310591	UKJBBALLZGPFNC-CQSZACIVSA-N	425.316	1.967	50	20	IDGD	
CC(=O)N[C@@H](C(=O)N1CCCC12CN(C(=O)[C@H](C)Br)C2)c1ccc(F)cc1	1845010423	SBPBTHDUMFNFEJ-BLLLJJGKSA-N	440.313	1.990	50	20	IDGD	
COC(=O)C[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)[C@@H](F)Cl)C2	1846212685	OQVMFWVQEHVBRN-WCQYABFASA-N	435.880	1.181	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	5199610	SCRHJFHMGXQGJW-UHFFFAOYSA-N	426.517	1.824	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)c1cnn(Cc2ccccc2)c1	21186328	OWSZVUNCKMCZGY-UHFFFAOYSA-N	432.528	1.905	50	20	IDGD	
CCOc1ccc(C(=O)NNS(=O)(=O)c2ccc(N3CCCC3=O)cc2)cc1OC	28808440	RNAUKFXQLVUELU-UHFFFAOYSA-N	433.486	1.844	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(C)=O	726097487	GUQKGIGKVFJHMH-FQEVSTJZSA-N	446.511	1.975	50	20	IDGD	
C[C@H](C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1)N1C(=O)[C@@H]2CCCC[C@H]2C1=O	728210074	QFAUNQHLYFQVJG-CSMYWGQOSA-N	434.518	1.134	50	20	IDGD	
O=C(NNC(=O)[C@H]1CC[C@@H](C(F)(F)F)NC1=O)c1cc(F)ccc1Br	728550066	XPECTJPQWCNGIV-XVKPBYJWSA-N	426.164	1.806	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)[C@H](C(C)C)S(=O)(=O)C1CCCCC1	729297647	CFXICZMHCSXQMP-IBGZPJMESA-N	426.535	1.994	50	20	IDGD	
CC[C@@H](N=c1nn[nH]n1-c1ccccc1)C(=O)NNC(=O)c1cccc(OC(F)F)c1	729533878	VHQQCRIKRCPTNR-OAHLLOKOSA-N	431.403	1.337	50	20	IDGD	
COC(=O)c1sc2ccccc2c1S(=O)(=O)NNC(=O)COc1ccccc1O	731672919	PYWWZKKMZCGTNL-UHFFFAOYSA-N	436.467	1.782	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)N[C@H]1CCN(c2ccccc2Cl)C1=O	732236423	VTBCRXRCMLWOIP-HNNXBMFYSA-N	440.851	1.065	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)COc2cccc(NC(=O)c3ccco3)c2)C[C@@H](C)O1	732264556	VILLUQMJTSCDCD-HZPDHXFCSA-N	444.488	1.557	50	20	IDGD	
CSCC[C@@H](NC(=O)Cc1ccccc1)C(=O)NNC(=O)Cn1cnc2ccccc21	732750515	SNDUEHSYHGQVMP-GOSISDBHSA-N	439.541	1.664	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)NCCNC(=O)c2c(F)cccc2F)cc1C	733042631	MXYHGMNDCPFLFE-UHFFFAOYSA-N	433.415	1.281	50	20	IDGD	
COc1cccc(C[C@H](C(=O)NNc2nc3ccccc3c(=O)n2C)n2nnnc2C)c1	733260587	IZHXZVBDYJAROH-GOSISDBHSA-N	434.460	1.164	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)N[C@H]1CCN(c2ccc(C(F)(F)F)cc2)C1	734525503	NNOTXUDXPYJSRD-ZDUSSCGKSA-N	439.394	1.638	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)CC(=O)NNC(=O)COc2cc(C)ccc2C)cc1F	734810450	YZACZAKVLPDJHE-UHFFFAOYSA-N	436.461	1.645	50	20	IDGD	
Cc1c(C(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)cc(S(N)(=O)=O)cc1[N+](=O)[O-]	740738912	UUMNDIWYOXVIGK-UHFFFAOYSA-N	436.490	1.528	50	20	IDGD	
COc1cccc(-c2noc([C@@H](C)NC(=O)NNC(=O)[C@@H]3COc4ccccc4O3)n2)c1	743703151	IHSXPPVOTZMJKE-PXAZEXFGSA-N	439.428	1.977	50	20	IDGD	
Cc1cc(C)c(N2C[C@@H](C(=O)OCC(=O)NNC(=O)c3cccc(C#N)c3)CC2=O)c(C)c1	744699479	WNAKUMGVYMGRHZ-IBGZPJMESA-N	448.479	1.841	50	20	IDGD	
Cc1ccc(C)n1-c1ccc(C(=O)NNC(=O)NC[C@@H](C)CN2CCN(C)CC2)cc1	745863763	XEQLQFGETMBIHA-QGZVFWFLSA-N	426.565	1.922	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)N2CCOCC2)cc1S(=O)(=O)NCc1ccccc1	745992977	PXZVKKLPHVQIRK-UHFFFAOYSA-N	432.502	1.160	50	20	IDGD	
COc1cc(S(=O)(=O)NNC(=O)c2ccc3c(c2)OCO3)ccc1Br	747596379	NBKAKIQLWHMCFY-UHFFFAOYSA-N	429.248	1.810	50	20	IDGD	
CC(C)S(=O)(=O)CC(=O)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1	747778716	AGIDKTFNOFAFRA-FQEVSTJZSA-N	429.542	1.584	50	20	IDGD	
COc1cc(OC)cc(N2CC[C@@H](NC(=O)NNC(=O)Cc3ccccc3OC)C2=O)c1	747956843	WSSCSTXJXYCVSF-GOSISDBHSA-N	442.472	1.391	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2ccc(C(=O)NNC(=O)C(=O)N3CCCC3)cc2)cc1	748245982	BPUUQPJXZOKQTI-UHFFFAOYSA-N	430.486	1.179	50	20	IDGD	
CC(C)Cn1ncc2cc(C(=O)OCC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)cnc21	748411663	XFVNXUIBHDIZLU-UHFFFAOYSA-N	440.416	1.614	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCCC(=O)N2CCCCCC2)nc1	748463615	YLRNYPJUTHOHEJ-UHFFFAOYSA-N	440.570	1.531	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)NCC(=O)Nc2cc(Br)ccc2C)n1	749189199	UAZIFONXKGNKCF-UHFFFAOYSA-N	437.298	1.540	50	20	IDGD	
CC(C)Cn1cnc(S(=O)(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)c1	749864850	VPOVXMPVPVVCTD-UHFFFAOYSA-N	432.506	1.453	50	20	IDGD	
Cc1cnc([C@@H](C)NC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)s1	750659876	DMFJFRNZCXNWNF-CYBMUJFWSA-N	439.567	1.170	50	20	IDGD	
O=C(O)CCCOc1ccc(S(=O)(=O)NNC(=O)NCCc2cccs2)cc1F	751271319	INRQGGHYLDOXFQ-UHFFFAOYSA-N	445.494	1.866	50	20	IDGD	
C[C@@H](NC(=S)NNC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(F)cc2)C1)C1CC1	751620696	XSFNAPVKMPEZNK-TZMCWYRMSA-N	428.555	1.520	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)NC[C@@H]3CCC[C@@]34NC(=O)N(C)C4=O)cc2C1	752000096	PWIIVWGVBMQRAP-POEZALAKSA-N	433.534	1.537	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc2c(c1)OCCCO2)NNc1cccnc1Cl	754483884	PFJYTLQJLHXVQP-UHFFFAOYSA-N	426.882	1.708	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)NNC(=O)c3nnc(O)c4ccccc34)cn2)C[C@H](C)O1	755866842	YIHPPTVCLYIXPE-STQMWFEESA-N	437.460	1.811	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)Nc2cccc(Cn3nc4ccccn4c3=O)c2)c1O	755937439	JBHWJTFXRKTYNO-UHFFFAOYSA-N	448.439	1.725	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)Nc2cccc(C(=O)N3CCOCC3)c2C)cc1	756184987	WBXUEYZLFMQZOQ-UHFFFAOYSA-N	442.472	1.708	50	20	IDGD	
CN1CCN(CC(=O)N(C)c2ccc(NC(=O)NNC(=O)c3ccccc3F)cc2)CC1	756360378	SHHQBDNAWIBFRM-UHFFFAOYSA-N	442.495	1.502	50	20	IDGD	
Cc1ccc(C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c(Br)n1	756425639	JJBVITLEWMSSAN-UHFFFAOYSA-N	437.206	1.679	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)[C@@H](C)NS(=O)(=O)c2ccc(C#N)cc2)c(OC)c1	757198271	LXAKHGBAAAOEIB-GFCCVEGCSA-N	432.458	1.164	50	20	IDGD	
CC[C@H](C)NS(=O)(=O)c1cccc(NC(=O)NNC(=O)c2cccc(OC)c2O)c1	757711841	UKPANOGFSCTDSS-LBPRGKRZSA-N	436.490	1.944	50	20	IDGD	
CCCC(=O)N1CSC[C@H]1C(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758787835	WNCJRPWFTPYYKK-AWEZNQCLSA-N	443.570	1.324	50	20	IDGD	
C[C@@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3ccc4ccccc4n3)cn2)C[C@@H](C)O1	763451345	VCEMUXXGPRHEDT-HUUCEWRRSA-N	448.483	1.643	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(C(=O)NC2CCCC2)cc1	763470146	GWKWVLBBFITRFX-UHFFFAOYSA-N	439.428	1.667	50	20	IDGD	
CC(C)(C)c1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(-n3ccnc3)nc2)cc1	763601407	YUSFUMUWMGWHBP-UHFFFAOYSA-N	436.472	1.730	50	20	IDGD	
CCN1CCN(c2ccc(NC(=O)C(=O)NNC(=O)COc3cccc(C)c3)cc2)CC1	763623920	REGPFUSCQPOTTF-UHFFFAOYSA-N	439.516	1.302	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1ccccc1C(=O)NC(C)(C)C	763628941	NGVIYTJKVJYRQL-UHFFFAOYSA-N	436.472	1.571	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)COc2cc(C)ccc2C)ccc1Cl	763664830	ITOWAZALMWCIMP-UHFFFAOYSA-N	433.848	1.908	50	20	IDGD	
Cc1ccnc(-c2ccc(NC(=O)C(=O)NNC(=O)CN3CCCc4ccccc43)cc2)n1	763746218	QSFKGNGIXNUREM-UHFFFAOYSA-N	444.495	1.991	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2ccc(C)c(Cl)c2)c2ccccc2c1=O	763787351	XVRWJNXONPIVPC-UHFFFAOYSA-N	427.848	1.778	50	20	IDGD	
C[C@@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)COc3ccc(F)cc3)cc2)CCO1	763838196	PTCWDBRJHTYSSB-CQSZACIVSA-N	430.436	1.216	50	20	IDGD	
CCOc1cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(C(C)=O)cc2)ccc1OC	763873040	RUXBZZXJGHGGFA-CQSZACIVSA-N	443.456	1.850	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)CCSc2ccc(F)cc2)cc1	763894354	ARRLESIHXKWBCU-UHFFFAOYSA-N	439.490	1.498	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(OC(C)C)c(OC)c2)cc1C	763916738	VEMKNQYBSPJXAH-UHFFFAOYSA-N	443.456	1.977	50	20	IDGD	
CC(C)Cn1ncc(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)c1C(F)F	763994174	AONBNEOLHIKOJB-UHFFFAOYSA-N	447.240	1.967	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)c(F)c1	763995839	RHRAVOQAIYSILE-UHFFFAOYSA-N	427.186	1.103	50	20	IDGD	
Cc1nccn1-c1ccc(NC(=O)C(=O)NNC(=O)c2cc(Br)cn2C)cn1	764002456	MMGLZJFUHOKKAY-UHFFFAOYSA-N	446.265	1.076	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c1	764084166	FENBYUNKVUQGKX-UHFFFAOYSA-N	440.821	1.051	50	20	IDGD	
CC(=O)N(C)c1ccccc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccc(C)cc2)[nH]n1	764111653	QISWIURHRZFKOB-UHFFFAOYSA-N	434.456	1.768	50	20	IDGD	
COC(=O)c1cc(C(C)(C)C)sc1NC(=O)C(=O)NNC(=O)[C@@H]1Cc2ccccc2O1	764167734	MAUFWZWGWLMFIM-AWEZNQCLSA-N	445.497	1.922	50	20	IDGD	
Cc1ncsc1C(=O)NNC(=O)C(=O)Nc1cccc(F)c1I	764247545	ZBCMRLQKIKMIQZ-UHFFFAOYSA-N	448.217	1.595	50	20	IDGD	
CC[C@@H](C)NS(=O)(=O)c1cccc(NC(=O)NNC(=O)COc2ccccc2O)c1	764255538	ZBTNHBUNPUFSBZ-CYBMUJFWSA-N	436.490	1.701	50	20	IDGD	
COCCOc1cc(NC(=O)C(=O)NNC(=O)C(C)(C)c2ccccc2)ccc1OC	764309570	QKXVZEWGMCKECZ-UHFFFAOYSA-N	429.473	1.784	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)C(=O)Nc1cnn(-c2cnc3ccccc3n2)c1	764313912	OJACKVCFTJQCEQ-UHFFFAOYSA-N	433.403	1.283	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)C(=O)Nc1cccc(N2C(=O)CN(C)C2=O)c1)c1ccccc1	764329857	PCFCZXVNZKBOCR-QGZVFWFLSA-N	437.456	1.365	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1c(C)c(C(C)(C)C)nn1-c1ccccc1	764398249	QMTSBNSVSZEULI-HNNXBMFYSA-N	445.520	1.616	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCCCN2CCCO[C@@H](C)C2)cc1Br	764587272	PLZWPXIZURROTJ-ZDUSSCGKSA-N	443.342	1.903	50	20	IDGD	
Cc1ccc(Br)c(C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)c1N	764593212	VLHHEFXUDFCGFD-UHFFFAOYSA-N	431.246	1.829	50	20	IDGD	
COc1cc(Br)c(S(=O)(=O)NNC(=O)OC(C)(C)C)cc1C(=O)O	764932568	OXRUOWIKJZEWKX-UHFFFAOYSA-N	425.257	1.874	50	20	IDGD	
COc1cc(OC)c(Cn2nccc2NC(=O)C(=O)NNC(=O)OC(C)(C)C)c(OC)c1	765392701	JSWJMJVPTAWUBA-UHFFFAOYSA-N	449.464	1.452	50	20	IDGD	
N#Cc1cc(Cl)nc(NNC(=O)[C@@H]2CCCC[C@H]2C(=O)N[C@H]2CCS(=O)(=O)C2)c1	769055349	GJTPJNDQOHHIOY-BFHYXJOUSA-N	439.925	1.159	50	20	IDGD	
CSCCNC(=S)NNC(=O)Cc1ccc(S(=O)(=O)CC(F)(F)F)cc1	769768839	GSPDTROBSZNOSK-UHFFFAOYSA-N	429.511	1.423	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2ccc(O)c(C(=O)NNc3ncc(F)cn3)c2)cc1	770132222	ANZGAXYFFFDGSB-UHFFFAOYSA-N	433.421	1.888	50	20	IDGD	
CCNC(=O)N(C)NC(=O)[C@H](CCSC)NC(=O)c1ccccc1Br	770548178	BGBKSEVTXOPLLB-ZDUSSCGKSA-N	431.356	1.993	50	20	IDGD	
COc1cccc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)NC(C)(C)C)c1F	770764161	IWWXDXORPXGLHG-UHFFFAOYSA-N	438.481	1.993	50	20	IDGD	
Cc1cccc(F)c1NNC(=O)C(=O)Nc1ccc(C(=O)NCCN2CCOCC2)cc1	770814892	FGNNAEVRFJDRMV-UHFFFAOYSA-N	443.479	1.278	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)Cn3nc(-c4ccccc4)ccc3=O)nc21	770957728	DWSUMQZEWSZZRV-UHFFFAOYSA-N	434.460	1.654	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)c1	771809887	DJXZSHNMSTUEOG-UHFFFAOYSA-N	431.430	1.401	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)c1ccc(CN2CCCC2=O)cc1	772193519	VXXGZXGZQGHZHE-UHFFFAOYSA-N	428.876	1.540	50	20	IDGD	
CSc1cc(CNC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)ccn1	772596005	XHIZUMUJPMKDJG-UHFFFAOYSA-N	428.562	1.846	50	20	IDGD	
Cc1ccc(I)cc1NC(=O)C(=O)NNC(=O)Cc1ccsc1	773500587	UHJBUASSZHNZPL-UHFFFAOYSA-N	443.266	1.990	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(F)c(NC(=O)C(=O)NNc2ccc3ccccc3n2)c1	773654733	LYNZZPYURHGUCR-UHFFFAOYSA-N	431.449	1.706	50	20	IDGD	
CSCC[C@@H](C(=O)NNc1cc(Cl)nc(N)n1)N1C(=O)[C@H]2CCCC[C@H]2C1=O	773860930	KBEBFYWBUIQTML-AXFHLTTASA-N	426.930	1.452	50	20	IDGD	
COC(=O)CCCOc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(C)c(F)c2)cc1	773884784	BATNBLIEWPMUMM-UHFFFAOYSA-N	431.420	1.866	50	20	IDGD	
C[C@H](NCC(=O)NNC(=O)c1cccc(Cl)c1)c1ccc(S(=O)(=O)N(C)C)cc1	775192254	QESNTKZWAVQIOH-ZDUSSCGKSA-N	438.937	1.702	50	20	IDGD	
CNS(=O)(=O)c1cccc([C@H](C)NC(=O)NNc2cccc(S(C)(=O)=O)c2)c1	776619681	FEOSVXBJMURGBU-LBPRGKRZSA-N	426.520	1.386	50	20	IDGD	
O=C(COc1ccc(C(F)(F)F)cc1)N1CCN(S(=O)(=O)CBr)CC1	777779212	GSTOOAUZBIMXKW-UHFFFAOYSA-N	445.257	1.911	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)C[C@@H]3C=CCCC3)CC2)cc1	777812956	KENQVVTVKMJVCO-GOSISDBHSA-N	434.562	1.195	50	20	IDGD	
CCn1cc(-c2nn(C)cc2C(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)cn1	778573910	KJENMPZLIOHWRT-UHFFFAOYSA-N	430.852	1.575	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1cc(F)cc2c(=O)c3cc(F)ccc3[nH]c12	780232846	CDMURVFOBBGCIJ-SECBINFHSA-N	435.408	1.155	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)C[C@H]2CCO[C@@H](C(C)C)C2)cc1	781575962	BILCPTOMMNWSQY-FUHWJXTLSA-N	425.551	1.604	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CN2CCNC(=O)[C@@H]2c2ccccc2C(F)(F)F)c1	782100546	FRLCRLZNFGAIBX-SFHVURJKSA-N	445.401	1.511	50	20	IDGD	
CC(C)[C@H]1C[C@@H](CC(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)CCO1	782118239	TWGRSVKFVMOANG-DLBZAZTESA-N	439.582	1.302	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)C(=O)Nc1cccc2[nH]ccc12	782898069	YKMIJMUDIXGNBX-UHFFFAOYSA-N	428.474	1.169	50	20	IDGD	
CC(=O)N[C@@H](CC(C)C)C(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	783587142	BLNLHHBMFNDJIM-IBGZPJMESA-N	437.972	1.156	50	20	IDGD	
CS(=O)(=O)c1ccccc1NC(=O)C(=O)NNc1nc(-c2ccc(Cl)cc2)no1	784800271	YNJGHKZSVPFYDN-UHFFFAOYSA-N	435.849	1.875	50	20	IDGD	
Cc1cnn(-c2ccc(C(N)=O)cc2NC(=O)C(=O)NNc2cccc(C(F)(F)F)n2)c1	784952739	OXRZXNXJLZREFR-UHFFFAOYSA-N	447.377	1.775	50	20	IDGD	
O=C(COC(=O)Cc1ccc([N+](=O)[O-])cc1Cl)NNC(=O)[C@@H]1COc2ccccc2O1	785949174	SUNKHXWCPJVBLI-INIZCTEOSA-N	449.803	1.321	50	20	IDGD	
CCc1c(C(=O)NNC(=O)CCN2C[C@H](C)O[C@H](C)C2)nnn1Cc1ccc(F)cc1	787865558	SRTOIFNBYVHWPU-GASCZTMLSA-N	432.500	1.288	50	20	IDGD	
CC(C)n1cnc(S(=O)(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)c1	788917841	WHPWHGFBNYWTAV-UHFFFAOYSA-N	430.531	1.262	50	20	IDGD	
CCCCOc1ccc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c(O)c1	789252923	YYQHITBDMWZOCB-LJQANCHMSA-N	444.440	1.715	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1cc(C#N)cn1C(C)(C)C	789775487	KOLACFIGFXCKNG-UHFFFAOYSA-N	433.490	1.609	50	20	IDGD	
O=C(NNC(=O)[C@H]1OCC[C@H]1c1ccccc1)C(=O)Nc1cc(C(F)(F)F)cnc1O	789809950	HZKRMXOZOYFTHE-JSGCOSHPSA-N	438.362	1.465	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)[C@](C)(O)Cn2ccc(C)cc2=O)cc1OC	790484637	GIUQSCYKIJMYFI-JOCHJYFZSA-N	431.489	1.556	50	20	IDGD	
CN(C)N(C(=O)c1ccnc(Cl)c1I)[C@@H]1CCS(=O)(=O)C1	792849467	IWGRQTTVKLMXOP-MRVPVSSYSA-N	443.694	1.446	50	20	IDGD	
CC(C)O[C@H](C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1)c1ccccc1	794394574	ZQDOFNNECDKAHN-QFIPXVFZSA-N	438.528	1.758	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@H]2C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1	798830723	SSDJXYJRSKARTJ-SFHVURJKSA-N	449.467	1.008	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(CC(=O)NNC(=O)Nc2cc(F)cc(F)c2)C(=O)C1	802003517	PHOCUTCQIOZMOI-UHFFFAOYSA-N	427.408	1.197	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2cc(S(=O)(=O)N3CCCCC3)cn2C)cc1	802055334	HVWVHVQSRYTSNG-UHFFFAOYSA-N	435.506	1.675	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)CN(C)S(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1	802060401	FQIHUFAROCFVDU-UHFFFAOYSA-N	437.434	1.077	50	20	IDGD	
Cc1c(C(F)(F)F)nn(C)c1NC(=O)C(=O)NNC(=O)c1ccccc1Br	806972140	IXQLCIOAYRNIJK-UHFFFAOYSA-N	448.199	1.910	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)C(=O)Nc1ccc(F)cc1OC1CCOCC1	806980459	WUXJNRANQDXNND-UHFFFAOYSA-N	433.411	1.851	50	20	IDGD	
COC(=O)N1CCC(CNC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)CC1	807523683	NYAZOYRWIOJBPS-UHFFFAOYSA-N	446.552	1.008	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H](N2CCN(C(=O)NNC(=O)c3ccc(C#N)cc3)CC2)C1	808255318	GYCTXUUXFHFFGB-GOSISDBHSA-N	442.520	1.540	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@@H]1CCN(c2ccccc2F)C1	809980610	RJUGGPAYMBNNMV-CQSZACIVSA-N	433.509	1.715	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3c(C)nn(C)c3c2)cc1OC	812979291	NKQOMSRWHIYVGH-UHFFFAOYSA-N	425.445	1.689	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)c3ccc4c(c3)NC(=O)CNC4=O)n[nH]2)c1	815887624	NMYUVEBFCLHCMW-UHFFFAOYSA-N	432.440	1.450	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)[C@H](C)NS(=O)(=O)c1ccc(Cl)cc1	825637503	WXMVBFUJSYURGM-LBPRGKRZSA-N	440.909	1.275	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)c1cnc2c(c1)c(O)nc(=O)n2C1CC1	879394598	LMFNJLQDYBSWIY-UHFFFAOYSA-N	439.428	1.071	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)COc2ccc(F)cc2)c1	914749479	CKFWIKSSQKIQSQ-UHFFFAOYSA-N	427.429	1.492	50	20	IDGD	
Cc1cccc(C)c1OCCC(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	914809090	KDCCPYCJRUXASR-GOSISDBHSA-N	428.441	1.603	50	20	IDGD	
O=C(COC(=O)C1CCN(C(=O)CCc2ccccc2)CC1)NNC(=O)c1cccs1	915025289	TUEHODSHHBCJIZ-UHFFFAOYSA-N	443.525	1.924	50	20	IDGD	
COc1cc(C=NNC(=O)c2cccc(S(C)(=O)=O)c2)cc(Cl)c1OCC(N)=O	915052294	JPKLELNEGVJRBP-UHFFFAOYSA-N	439.877	1.380	50	20	IDGD	
CC(=NNC(=O)COc1ccc(Cl)cc1)c1ccc(S(=O)(=O)NCC(=O)O)cc1	916302237	OKUSYJWPVCQGNO-UHFFFAOYSA-N	439.877	1.622	50	20	IDGD	
Cc1cccc([C@H](CNC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)N2CCOCC2)c1	916436251	ZMKAIYNXCPNUBY-IBGZPJMESA-N	427.461	1.921	50	20	IDGD	
CNS(=O)(=O)c1cccc(CNC(=O)NNC(=O)CSc2ccc(Cl)cc2)c1	916486000	RFNVFMBIQLHOIY-UHFFFAOYSA-N	442.950	1.871	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)NCCN2CCN(c3ccc(F)cc3)CC2)c1	916513648	IZMXFLCBTHVFCM-UHFFFAOYSA-N	428.512	1.658	50	20	IDGD	
C[C@@H]1CCCN(C(=O)C2CCN(CC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)CC2)C1	917106507	XALOBCJCAZBSDG-OAHLLOKOSA-N	431.493	1.326	50	20	IDGD	
CC[C@H](NC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)c1ccccc1OCC(=O)NC	918221183	HEUIIAYPWOZQKA-INIZCTEOSA-N	429.433	1.815	50	20	IDGD	
O=C(NCc1cccc(NC(=O)[C@@H]2CCCO2)c1)NNC(=O)c1ccc([N+](=O)[O-])cc1	920236420	BXSBKXGHWQWZHV-KRWDZBQOSA-N	427.417	1.857	50	20	IDGD	
COc1ccc(CCC(=O)NN=Cc2c(N3CCOCC3)nc3ccccn3c2=O)cc1	920380401	SWAGGBBDIDTDPL-UHFFFAOYSA-N	435.484	1.623	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@H](C(C)C)N1C[C@H](C)O[C@@H](C)C1	921202941	MEKJZGQOTKFVID-DZKIICNBSA-N	439.582	1.183	50	20	IDGD	
O=C(Cn1cc(C2CC2)nn1)NNC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1	1116266984	YDTCOHSOWAPJJO-UHFFFAOYSA-N	428.456	1.864	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2ccc3c(c2)C(=O)N(Cc2ccncc2)C3=O)cc1	1317711137	CFZBHZQQSKZTNS-UHFFFAOYSA-N	430.420	1.961	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)CCN2C(=O)c3ccccc3C2=O)CC1	1318558524	QKXACZXJOLVWJF-UHFFFAOYSA-N	444.488	1.467	50	20	IDGD	
CCOC(=O)[C@@H]1CN(C(=O)OC(C)(C)C)CCN1[C@@H](C)C(=O)NNC(=O)CC(C)C	1340800231	COMNRZLGJCKRCO-GJZGRUSLSA-N	428.530	1.053	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3n[nH]c4cc(Cl)ccc34)C2)C1	1778666966	MNPQPFJLGVYACN-AUUYWEPGSA-N	441.315	1.914	50	20	IDGD	
Cc1ccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C3)c(C)c1	1780343307	CVBIJQYMEISWDB-HYBUGGRVSA-N	444.576	1.804	50	20	IDGD	
Cn1ccc(=O)cc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@](C)(Cl)CCl)C1	1780715227	OSFBWBQSOOHVJL-NSISKUIASA-N	444.359	1.749	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)[C@@H](C)CNC(=O)OC(C)(C)C)CCO2)C1	1781211276	OOLBDQWYKWVWEF-BXTJHSDWSA-N	431.961	1.995	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@](C)(Cl)CCl)C3)C2)n1	1781225482	YUPZIRKSMCPAMW-MOPGFXCFSA-N	443.331	1.720	50	20	IDGD	
COc1cc(F)ccc1C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781333897	HLXXFZTYIWIARH-WMLDXEAASA-N	433.249	1.968	50	20	IDGD	
CSCC[C@H](O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)Br)C1	1782001715	JVBQPQHSHILZQU-UMPJEAMMSA-N	437.400	1.398	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc3c(c1)OCO3)C2	1782173071	VYHXNCRRYUJMLU-FQELHTAISA-N	438.908	1.797	50	20	IDGD	
COC[C@H](C)C(=O)N1CCO[C@@]2(CCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1	1782862113	PBUOARQMYOGNME-QLBMNLSNSA-N	433.455	1.984	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H]3CCCO3)C2)C1	1783479466	CJLGYNBUXHRVEO-MDOVXXIYSA-N	445.944	1.127	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H]1CC[C@H](C(=O)OC)CC1)CCO2	1783870891	JDIQLQUKPIVJOY-NLDJYOPPSA-N	430.929	1.050	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1[C@H]3Sc4ccccc4[C@H]31)CCO2	1783877962	SQUOKXPJKWYJCH-KDBGDGBXSA-N	436.961	1.958	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3n[nH]c4c(Cl)cccc34)CCO2)C1	1783882017	PAEFREIGUNFYPF-KUHUBIRLSA-N	441.315	1.914	50	20	IDGD	
C[C@H](Oc1cccnc1)C(=O)N1CC[C@]2(CN(C(=O)CCBr)CCO2)C1	1784549110	XHSAVXAJFIZVCQ-KSSFIOAISA-N	426.311	1.464	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nn[nH]c3C(F)(F)F)C[C@@H]21	1784620425	AMOVSBBFPIBASU-BJDJZHNGSA-N	437.850	1.824	50	20	IDGD	
CN(C)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21	1785758543	MDMMFKJSSSXJJW-DLKVLKDVSA-N	443.317	1.431	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC1(c2ccc(NC(=O)[C@@](C)(O)C(F)(F)F)cc2)CCC1	1786599055	PEVUTTNQXPHUIV-GOSISDBHSA-N	444.454	1.807	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)c1cccnc1-c1ccccc1	1787606145	KSKWBOHELFZSTJ-LEAZDLGRSA-N	443.931	1.942	50	20	IDGD	
Cc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)C(Cl)Cl)C[C@@H]32)ncc1[N+](=O)[O-]	1787641984	GGCZTFDSHWVFKK-MJVIPROJSA-N	431.276	1.695	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc4ccccn4n3)[C@H]2C1	1787844150	MFORTSRDVOCBLM-IEZWGBDMSA-N	430.581	1.779	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnn4c3OCCC4)C[C@@H]21	1788763788	UNERXMCKIBCTCE-XIRDDKMYSA-N	436.585	1.110	50	20	IDGD	
Cc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)Br)C[C@@H]32)n(C(F)F)n1	1789336718	QCCYYNSLJXQRRK-UHXUPSOCSA-N	449.296	1.963	50	20	IDGD	
CCOC(=O)N[C@H](O)C(=O)Nc1ccc(C2(NC(=O)[C@H](F)Br)CCC2)cc1	1789407115	WXDNEGKGZOGQOJ-SWLSCSKDSA-N	446.273	1.876	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(OC)cc(OC)c3)[C@H]2C1	1789548862	BSVHXJZEZQFEMA-VKOGCVSHSA-N	440.924	1.551	50	20	IDGD	
Cc1cc(C)n(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]3C2)n1	1789869026	WACMQMGJHIMKMI-IUVQAAGXSA-N	431.364	1.716	50	20	IDGD	
CCn1nc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](Cl)COC)[C@H]3C2)c2ccccc21	1791254023	INQUZEKNUXYVBT-XPYUAMARSA-N	448.951	1.903	50	20	IDGD	
CCC[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2C1)n1cccc1	1791290980	HIOXQSKSUJAPBO-HAGHYFMRSA-N	447.580	1.182	50	20	IDGD	
COCC1(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)/C(C#N)=C/c2ccc(F)cc2F)C3)CC1	1793339796	RBKLOJDYGZYGFW-UGROSQSRSA-N	445.466	1.888	50	20	IDGD	
COc1cccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)Br)C3)n1	1793989203	YGZDJIXFXRCGBS-JRATXPSKSA-N	426.311	1.006	50	20	IDGD	
Cc1ccc(S(=O)(=O)CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](O)CCl)C3)cc1	1795746749	LVNFWYSBAFNJFW-JYYAWHABSA-N	428.938	1.007	50	20	IDGD	
C[C@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@](C)(Cl)CCl)C2)n1cccc1C=O	1795750258	JISGUJBOGXUQSL-HUYPOWGKSA-N	430.332	1.688	50	20	IDGD	
Cc1cnc(Cl)c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)c1	1796187140	NCYSNWQTXSBURF-BJWYYQGGSA-N	427.697	1.289	50	20	IDGD	
O=C(C[C@@H]1OCCc2ccccc21)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1	1796187930	MOBINXXZLMWSKF-KGSLCBSSSA-N	448.328	1.322	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)c1ccc(-n2cccn2)cc1	1796191621	GDADMZRXNULGQV-QQFNCUIESA-N	444.300	1.118	50	20	IDGD	
Cc1nc[nH]c1CSCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)Br)C2	1797665056	WPZCQDDZFVHFDE-VFFTVRQLSA-N	445.383	1.324	50	20	IDGD	
COc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)Br)C3)cc(Cl)n1	1798291364	CCSAZNKPSMJFKB-ADGXKJENSA-N	446.729	1.730	50	20	IDGD	
C[C@H]1Oc2ccc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@@H](F)Cl)C4)cc2NC1=O	1798583331	ZUZYNIOYYXRKQA-LFIDFRPQSA-N	425.844	1.144	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(F)cnc1Cl	1798727501	PHNMUKLJMXXLMF-CLLJXQQHSA-N	446.870	1.438	50	20	IDGD	
C[C@@H](Cc1ccncc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Br	1799347233	NCWQWQLOENNIOV-SLZITWOASA-N	428.302	1.540	50	20	IDGD	
COc1cc(OC)cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CCC(=O)NN(C)C)C3)c1	1799643046	MINABYKZIIMEGS-BJWYYQGGSA-N	432.521	1.329	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2nn(C)cc2c1	1799911683	ULVUYBOLFSREHT-RMIITELYSA-N	435.322	1.560	50	20	IDGD	
Cc1c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CCC(=O)NN(C)C)nc2ccccn12	1802335960	CFMYEAKJAFCKED-BJWYYQGGSA-N	426.521	1.268	50	20	IDGD	
O=C([C@H]1C[C@@]12C(=O)Nc1ccccc12)N1CCC2(CCCN(C(=O)[C@@H](O)CCl)C2)CC1	1805526332	RBRNKWJOJDHOLV-QSAZIKIQSA-N	445.947	1.727	50	20	IDGD	
CCOC(=O)/C=C/C(=O)NC[C@@H]1CCN(C(=O)[C@H](C)Br)[C@@H]1c1cccnc1	1806299305	LCIBZGCNKSTPKJ-PSCNXVHHSA-N	438.322	1.990	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)Cc2ccncc2)[C@@H]1c1cccnc1	1807520179	AQJDGOVPVKGGNV-CVDCTZTESA-N	438.532	1.098	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)COc2cccnn2)[C@H]1c1cccnc1	1813033369	MGLDSJVCJRPDHJ-GJYPPUQNSA-N	433.896	1.210	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)Cc2cccs2)[C@H]1c1cccnc1	1813070087	DGOSITRJHVDBCH-JTSKRJEESA-N	443.573	1.765	50	20	IDGD	
Cc1ccn(C)c1C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1813072378	GRQPQMSNKKVVIO-XMSQKQJNSA-N	440.548	1.421	50	20	IDGD	
O=C(Cc1ccccc1)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2	1813805544	YPMCDWGZDRHTMK-QGZVFWFLSA-N	435.314	1.291	50	20	IDGD	
CCOC(=O)C(C)(C)C(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1	1814166734	IYXGESYIPWZTSQ-ARFHVFGLSA-N	425.913	1.276	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cnc3snnc3c2)[nH]n1)[C@H](O)CCl	1814872588	DPKQBFHGFWBIKT-QWHCGFSZSA-N	435.897	1.715	50	20	IDGD	
CC[C@H](C)[C@@H](N)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1817266481	WTJQUOYRYWHDJL-BJOOFOGMSA-N	442.524	1.088	50	20	IDGD	
CC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)n[nH]1	1818111381	HQEQGXWTUUGBQK-PTZPRWATSA-N	441.492	1.905	50	20	IDGD	
C[C@@H]1CCC[C@@H]1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(B(O)O)cc1)CC2	1818876558	OYORUQBMXVAIIC-KCXAZCMYSA-N	427.335	1.485	50	20	IDGD	
CC[C@H](C)[C@H](O)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819401514	FRNLYQMONYNZCD-IWEFOYFVSA-N	443.508	1.121	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)COC(=O)C(F)(F)F)sc2C1	1819616477	QYFVIHHSLUKXME-JGVFFNPUSA-N	443.831	1.414	50	20	IDGD	
Cc1nc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)ccc1F	1822411034	XKGRKQSKQCQTAM-KRWDZBQOSA-N	445.499	1.931	50	20	IDGD	
CCC[C@@H](NC(C)=O)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1	1822418168	VUXCGTIOORKLPP-NVXWUHKLSA-N	449.556	1.080	50	20	IDGD	
CC(C)CNC(=O)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1	1823005333	WZKMWEABFDCRAM-KCJUWKMLSA-N	435.319	1.518	50	20	IDGD	
Cc1ccc(C(=O)NCC(=O)N2CCC([C@@H]3CCCCN3C(=O)[C@H](O)CCl)CC2)cc1	1824188217	PUQAILSPVOFYOQ-VQTJNVASSA-N	449.979	1.944	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1c[nH]c(=O)cn1)CC2	1825645705	ILLPNCKERDKTOE-SFYZADRCSA-N	426.296	1.236	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ncn(C(C)C)n1)CC2	1825997844	CYGUFSZFPWMONG-MNOVXSKESA-N	426.930	1.795	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)CCC(F)(F)F)CC1	1826668415	HAVYSHASHJWMPN-SFHVURJKSA-N	440.271	1.942	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H](N)CCC(N)=O)CC1	1826821093	SQDRPECCUSSYMJ-QMTMVMCOSA-N	435.396	1.435	50	20	IDGD	
CCOC(=O)N[C@H](O)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCBr)CC1	1828758101	DXKHIMKMXRKUNG-GDBMZVCRSA-N	448.358	1.456	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc3n(n2)CCNC3=O)CC1	1830305470	QRTWBGHFDAFBNC-RDJZCZTQSA-N	435.956	1.877	50	20	IDGD	
COCc1oncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830357844	LULHOYMKRVPAAL-IBGZPJMESA-N	429.901	1.156	50	20	IDGD	
O=C(c1cccc2ccccc12)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1830728129	PTRCGTMGMRRHBW-DENIHFKCSA-N	432.904	1.510	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CSc3ncccn3)C2)C1	1831646550	MMULEGYTPIKEMR-HNAYVOBHSA-N	442.969	1.433	50	20	IDGD	
C[C@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1)c1ccccn1	1832330536	UDPHGIGHVUQUJQ-FDDCHVKYSA-N	449.360	1.798	50	20	IDGD	
Cc1ccc(CCC(=O)N2CCO[C@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)cn1	1832903698	NKZRYRFZAIJLTB-JOCHJYFZSA-N	449.624	1.631	50	20	IDGD	
COc1ccc(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)cc1F	1833166442	OETXUGWJFWBGCG-SFHVURJKSA-N	441.931	1.619	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3ccn(C(F)F)n3)CC2)CC1)[C@@H](O)CCl	1833312627	SXOFFNQYAJSVCQ-HNNXBMFYSA-N	433.887	1.063	50	20	IDGD	
CC[C@@H](C)[C@@H](O)C(=O)NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1	1833496459	BOQXIGSCADZIRF-RDTXWAMCSA-N	432.403	1.750	50	20	IDGD	
CCc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)cn1	1833892742	PXGIOKLSIVFDHL-QAPCUYQASA-N	444.301	1.405	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)cn1	1833998375	GSXBIIZKXDWFGP-KDOFPFPSSA-N	426.311	1.243	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cncc(F)c3)CCO2)C1	1834352660	HPUHHXPXWDOFGC-UGSOOPFHSA-N	444.301	1.322	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCC(N2CCC(NC(=O)CN3CCCC3=O)CC2)CC1	1834626747	AVMMQVPNNLTMEX-FQEVSTJZSA-N	447.407	1.417	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)c3ccncn3)CC2)CC1	1835143899	DCFPGJFIKQLSSU-AWEZNQCLSA-N	438.370	1.693	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3snnc3C)CC2)CC1	1835185856	OEKOLFQSMUORTC-HNNXBMFYSA-N	429.974	1.286	50	20	IDGD	
NC(=O)c1ncccc1C(=O)N1CCC(OC2CCN(C(=O)[C@@H](F)Cl)CC2)CC1	1837249297	HGMHAWCVWURHQP-MRXNPFEDSA-N	426.876	1.327	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)/C=N/O[C@@H]3CCCCO3)CCO2)C1	1837526128	SNOPFUFBQYFOCS-PXADHFOBSA-N	445.944	1.379	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3onc4ccccc34)C2)C1	1837715887	QAVMFONVODGCJO-NRFANRHFSA-N	447.564	1.749	50	20	IDGD	
CC(C)=CCCC(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1	1837920071	IWQMNEQMHLXYJO-UHFFFAOYSA-N	442.365	1.725	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)CCN3CCOC3=O)CC2)CC1	1838273070	OHYCHKWHZJGAAT-KRWDZBQOSA-N	429.945	1.845	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3nc(C)c(C)s3)CCO2)C1	1838411959	RXFCVYLAFYIKEF-KSSFIOAISA-N	431.942	1.084	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@H](Cl)COC)CC2)CC1	1838787634	ZOISDBJXPUPBIQ-IYBDPMFKSA-N	425.353	1.493	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3ncccc3OC)C2)C1	1839142092	DSXLBJHGRQAPIS-HRAATJIYSA-N	439.940	1.497	50	20	IDGD	
O=C(c1cccc(F)c1Cl)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1	1839322693	VHHLAAFBJUZJAW-RDTXWAMCSA-N	435.279	1.149	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc4ccnn34)CCO2)C1	1839497207	ZNHNHMXTVUAKJD-NRFANRHFSA-N	434.924	1.669	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc3nccn13)CCO2	1839552198	NAHDUTILFQQXET-OAQYLSRUSA-N	446.580	1.256	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3ccc(C)cn3)C2)C1	1840150380	KIWMGCYRXJAHPZ-GHTZIAJQSA-N	439.940	1.033	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4ccoc4cn3)C2)C1	1840154715	DPEHCCADKRKMAZ-FOIQADDNSA-N	437.880	1.152	50	20	IDGD	
C[C@@H](Cc1ccccn1)C(=O)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1840335830	XVCJOLCDGDMOSU-IFXJQAMLSA-N	430.332	1.520	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)/C=C/c3cnc[nH]3)CCO2)C1	1840344298	DEAJLCOJOPWTKZ-AWXCJNTOSA-N	441.326	1.053	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)CCBr)C3)C2)c(O)c1	1840667906	IODCRVYKESLZKU-IBGZPJMESA-N	441.322	1.556	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(C)c3Cl)CCO2)C1	1840693230	NYGGXRMSIJHTLT-OXQOHEQNSA-N	445.343	1.972	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)[C@@H]2C[C@H]2c2ccc(F)c(F)c2)C1	1841400968	QRWRFBFFNQTOPL-JKSUJKDBSA-N	434.487	1.645	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCCC12CN(C(=O)c1cc(CO)on1)C2	1841925154	QQYGEAGVNDTSMC-AWEZNQCLSA-N	442.900	1.116	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2cc3cnccc3[nH]2)C1	1844111867	VPARSXWEMGDYAX-VULFUBBASA-N	433.472	1.514	50	20	IDGD	
Cc1c(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](C)CBr)cn2[nH]cnc(=O)c12	1847498513	GIPTUSHCYGWDHV-SWHYSGLUSA-N	436.310	1.177	50	20	IDGD	
Cc1ccc2[nH]cc(CC(=O)N3CC[C@H]4[C@@H]3CCN4C(=O)c3cccc(B(O)O)c3)c2c1	1848144076	IWUGIAVPGLRIJH-VXKWHMMOSA-N	431.301	1.214	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)CCn2cnc3c(C)cccc3c2=O)c2ccccc2c1=O	26546628	PBYGBAQCHIIGLA-UHFFFAOYSA-N	446.467	1.286	50	20	IDGD	
Cc1ccc(CC(=O)N2CCN(CC(=O)NNC(=O)c3cccc(Cl)c3)CC2)cc1	725813786	YTYWTUMFKQSHOR-UHFFFAOYSA-N	428.920	1.796	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)c2ccc(-n3cnnc3)cc2)cc1	725881569	MTNZJGRIVXFBPY-UHFFFAOYSA-N	434.485	1.763	50	20	IDGD	
Cc1nc2n(n1)C[C@@H](NC(=O)NNC(=O)[C@@H](C)Oc1cccc(Br)c1)CC2	727230013	YLFVWGNHXRFMES-MFKMUULPSA-N	437.298	1.462	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNS(=O)(=O)c2cc(F)ccc2C(=O)OC)cc1	727351539	MPENZOJLAZMXAZ-LBPRGKRZSA-N	440.449	1.788	50	20	IDGD	
CC(C)[C@@H](NC(=O)NNC(=O)c1csc(N2CCOCC2)n1)c1nc(C2CC2)no1	727944313	XRFDBIBFJVHDEV-CYBMUJFWSA-N	435.510	1.581	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN1C(=O)OCC(F)(F)F)C1CCN(c2ncccn2)CC1	728844732	AWLXORNPGFMROV-CYBMUJFWSA-N	444.414	1.004	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2nc3ccccc3o2)CC1)C1CCN(c2ncccn2)CC1	728847685	LAQDDODRASNYNA-UHFFFAOYSA-N	449.515	1.898	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)c1cccc(S(=O)(=O)NC[C@@H]2CCCO2)c1	730034416	RKZWUPADLPDJHB-KRWDZBQOSA-N	447.513	1.243	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N[C@H]2CCN(C3CC3)C2)cc1	730773930	MKNXHROHSOJIPY-GTVARFKMSA-N	448.527	1.694	50	20	IDGD	
CC1CCC(N2C[C@@H](C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)CC2=O)CC1	731328267	CEQUPOCHHDJHDZ-NXYGQSRBSA-N	428.537	1.268	50	20	IDGD	
COc1cc(C=O)c([N+](=O)[O-])cc1OCC(=O)NNC(=O)CN1CCCc2ccccc21	731597965	YWRDJUDPDKDUJL-UHFFFAOYSA-N	442.428	1.395	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)[C@@H](C)NC(=O)c2cccc(Cl)c2Cl)C[C@@H](C)O1	732265076	YTLPTEYJEWDFLH-FRRDWIJNSA-N	445.347	1.758	50	20	IDGD	
C[C@]1(NNC(=O)N[C@@H]2CCCN(Cc3ccc(F)cc3Cl)C2)CCS(=O)(=O)C1	732469382	GYVNTPHJRCWEET-QAPCUYQASA-N	432.949	1.825	50	20	IDGD	
C[C@]1(NNC(=O)N[C@H]2CCCN(Cc3ccc(F)cc3Cl)C2)CCS(=O)(=O)C1	732469384	GYVNTPHJRCWEET-YJBOKZPZSA-N	432.949	1.825	50	20	IDGD	
C[C@@]1(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)CCOC1	733654975	PMONGAUSVWYUAU-NRFANRHFSA-N	446.529	1.536	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)CSCC(=O)N1CCCCC1	734250061	OBCXRNNOBBTYMO-UHFFFAOYSA-N	442.607	1.952	50	20	IDGD	
CCOCCCN1CC[C@H](NC(=O)NNC(=O)c2nnc(O)c3ccccc23)[C@@H](C)C1	734682508	BJQGUXOLSUEREG-YOEHRIQHSA-N	430.509	1.416	50	20	IDGD	
Cc1c(C(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)nnn1-c1ccccc1	734824816	JJOZNIDQQDMRAY-UHFFFAOYSA-N	443.508	1.919	50	20	IDGD	
O=C(CSc1nnnn1-c1ccc2c(c1)OCO2)NNC(=O)c1ccc(Cl)cc1	734982957	XGDHATYTPKDPMM-UHFFFAOYSA-N	432.849	1.598	50	20	IDGD	
O=C(CSc1nnnn1-c1ccc2c(c1)OCO2)NNC(=O)c1cccc(Cl)c1	734983169	YYGYPUDRJIROHO-UHFFFAOYSA-N	432.849	1.598	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)[C@@]2(O)CCN(Cc3ccccc3)C2)cc1	735836773	IMXYKHZSSCLAPY-UZUQRXQVSA-N	427.501	1.637	50	20	IDGD	
COc1ccccc1-c1nn(C)cc1C(=O)OCC(=O)NNC(=O)Cc1nc(C)cs1	740997116	BGWZQSZBUFGOKX-UHFFFAOYSA-N	443.485	1.408	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)N[C@@H]2CCCN(c3ccn(C)n3)C2=O)cc1OC	745883996	SOHWWISJPOXRJD-OAHLLOKOSA-N	444.492	1.357	50	20	IDGD	
C[C@@H](CCNC(=O)NNC(=O)c1csc(N2CCOCC2)n1)N(C)Cc1ccccc1	746773742	IECQXABDMKEGSK-INIZCTEOSA-N	446.577	1.834	50	20	IDGD	
N#C/C(=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)NCC1(CO)COC1	747525838	JLGBRESLRDPPGQ-VIZOYTHASA-N	443.891	1.111	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2ccc[nH]2)cc1S(=O)(=O)N1C[C@@H](C)C[C@@H](C)C1	747663405	MIJHSXFCFJFVSC-OKILXGFUSA-N	434.518	1.765	50	20	IDGD	
COC(=O)c1ccc(COc2ccc(C=NNC(=O)C(=O)N3CCCC3)cc2OC)o1	748137500	JMYLMNKRZJXKMM-UHFFFAOYSA-N	429.429	1.726	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)Cn1cc([N+](=O)[O-])ccc1=O	748697398	GPEXGSPVZKJQRJ-SNVBAGLBSA-N	439.222	1.134	50	20	IDGD	
Cc1cccc(NC(=O)N2CCC[C@H](C(=O)NNC(=O)CNC(=O)c3cccs3)C2)c1	751206085	BREPUFRBQLLPMP-HNNXBMFYSA-N	443.529	1.878	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)Cn3nnc(-c4ccccc4)n3)n[nH]2)cc1OC	751297754	RRINOXDCBSIYFC-UHFFFAOYSA-N	448.443	1.209	50	20	IDGD	
COc1cc(OC)cc(N2C[C@H](C(=O)NNC(=O)Cn3ccc4ccccc43)CC2=O)c1	752309621	HWJHBMVAEPKKJZ-MRXNPFEDSA-N	436.468	1.859	50	20	IDGD	
COC(=O)CNC(=O)c1ccc(NC(=O)NNC(=O)CSc2ccccc2OC)cc1	755551686	YKOLPWDFLZDDIR-UHFFFAOYSA-N	446.485	1.543	50	20	IDGD	
COCCOC(=O)Nc1cccc(NC(=O)NNC(=O)c2cncc(NC(C)=O)c2)c1	756220312	DFRINXJUZSCYBH-UHFFFAOYSA-N	430.421	1.701	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)COc2ccc(C#N)cc2)cc1NS(C)(=O)=O	756781436	FJIFBGCPSQBRSR-UHFFFAOYSA-N	433.446	1.170	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)N[C@@H]1CCN(C(=O)CCc2ccccc2)C1	756917009	MQSOARWAYRXUMW-QGZVFWFLSA-N	428.464	1.769	50	20	IDGD	
C[C@@]1(NNC(=O)NCCCOc2ncc(C(F)(F)F)cc2Cl)CCS(=O)(=O)C1	757714608	ZJKVFXYHQXWXGN-CQSZACIVSA-N	444.863	1.904	50	20	IDGD	
Cn1cnn(-c2ccc(NC(=O)NNC(=O)c3ccc(F)cc3Br)cc2)c1=O	757864492	ZGDMOTPZLJRMJD-UHFFFAOYSA-N	449.240	1.939	50	20	IDGD	
O=C(CNC(=O)c1ccc(Oc2ccccc2)cc1)NNc1nccc(N2CCOCC2)n1	762866595	PXFHZAKULZTGLB-UHFFFAOYSA-N	448.483	1.979	50	20	IDGD	
COC(=O)c1c(C)cccc1S(=O)(=O)NNC(=O)CCCNC(=O)OC(C)(C)C	763439871	WOYHGYWGGJVZDJ-UHFFFAOYSA-N	429.495	1.396	50	20	IDGD	
Cn1ccnc1Sc1ccc(NC(=O)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1	763471802	LEDHBMHWSJZZBZ-UHFFFAOYSA-N	440.441	1.879	50	20	IDGD	
COC(=O)c1cc(F)ccc1NC(=O)C(=O)NNC(=O)c1ccccc1Br	763483421	RRJGEYGPWUVZNL-UHFFFAOYSA-N	438.209	1.775	50	20	IDGD	
CCC(C)(C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)cc1	763551589	QKYHKITWVFJXMR-UHFFFAOYSA-N	440.456	1.733	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)[nH]n1)C(=O)Nc1ccc(O[C@H]2CCOC2)cc1	763606313	YFBKHRJUEPPSTJ-KRWDZBQOSA-N	435.440	1.644	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cc(F)c(SC)c(F)c2)cc1	763661903	QPTYUYWBBCKTHJ-UHFFFAOYSA-N	425.413	1.860	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(NC(=O)CC(C)C)cc1	763663498	JRCZZNRVMQAKOB-UHFFFAOYSA-N	442.472	1.845	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccnc1Br	763680834	BUGZNMGPOUUPKR-UHFFFAOYSA-N	437.250	1.408	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1c(F)cccc1-n1cccn1	763711346	HVQHWLFFVJUVMX-UHFFFAOYSA-N	425.420	1.739	50	20	IDGD	
CCOc1cc2c(cc1NC(=O)C(=O)NNC(=O)c1cc(OC)cc(OC)c1)O[C@@H](C)C2	763773089	UKGAWKZWGPYYDQ-LBPRGKRZSA-N	443.456	1.826	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)Nc2cnn(-c3cnc4ccccc4n3)c2)cc1	763831705	RJNRCUPMKSKAPL-UHFFFAOYSA-N	429.440	1.778	50	20	IDGD	
Cc1ccc(-c2nnco2)cc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccc(F)cc1	763871935	IXMCXNFJPMWJJT-GFCCVEGCSA-N	427.392	1.738	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccnn2CCC(C)C)cc1	763878544	QZUGCLKKKOJHLZ-HNNXBMFYSA-N	429.477	1.685	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(-n3ccnn3)c2)cc1OC	763911912	QZBSJATXLHYFGC-UHFFFAOYSA-N	438.444	1.464	50	20	IDGD	
O=C(NNC(=O)c1ccc(Br)s1)C(=O)Nc1ncn(Cc2ccccc2)n1	763941193	OVMFQFYZVZUNTR-UHFFFAOYSA-N	449.290	1.550	50	20	IDGD	
CC(=O)Nc1ccc(C)c(NC(=O)C(=O)NNC(=O)c2cc(Br)cn2C)c1	764004860	PGVOZEXXDGNPAI-UHFFFAOYSA-N	436.266	1.454	50	20	IDGD	
COC(=O)CNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3c2)cc1	764067001	NESYZXKBWMWRPO-UHFFFAOYSA-N	448.435	1.142	50	20	IDGD	
CC(C)COc1ccccc1NC(=O)C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	764076696	FITOGYYXCISNCE-UHFFFAOYSA-N	433.486	1.525	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2ccc(OC[C@@H]3CCCO3)cc2)cc1	764125097	RKJWGRPMOLPBGY-FQEVSTJZSA-N	441.484	1.972	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2ccccc2-n2c(C)cnc2O)cc1	764131779	NUMJKPDKIYCQMK-UHFFFAOYSA-N	437.456	1.614	50	20	IDGD	
C[C@H]1CCCCN1CC(=O)Nc1ccc(F)c(NC(=O)C(=O)NNC(=O)CC2CC2)c1	764143588	WKUWMSJINAJPJX-ZDUSSCGKSA-N	433.484	1.525	50	20	IDGD	
O=C(CCc1ccco1)NNC(=O)C(=O)Nc1ccc(C(=O)NCC(F)(F)F)cc1	764177304	MUBBLJGAWIVSGA-UHFFFAOYSA-N	426.351	1.290	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc(C#N)cc2)ccc1-n1nnnc1C(C)C	764177828	VYXIXSSFGBQYPM-UHFFFAOYSA-N	432.444	1.366	50	20	IDGD	
CCS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cccc(OC(F)F)c2)cc1	764249425	ABCZOLYRSADDLW-UHFFFAOYSA-N	441.412	1.481	50	20	IDGD	
O=C(NNC(=O)c1cccc(OC(F)F)c1)C(=O)Nc1cccc(N2CCOC2=O)c1	764250727	MJEIDPOAKSPTEM-UHFFFAOYSA-N	434.355	1.644	50	20	IDGD	
CN(C)C(=O)c1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)c1cccc2ncccc12	764257635	LHRBQCXZUFTAPM-UHFFFAOYSA-N	439.859	1.990	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc4c(c3)OCCO4)n[nH]2)cc1	764384749	KWNSIOSXDDNPHA-UHFFFAOYSA-N	435.440	1.810	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc(CNC(C)=O)cc3)n[nH]2)cc1	764385111	RJDDNNWTDFZRCD-UHFFFAOYSA-N	448.483	1.675	50	20	IDGD	
CC(C)Cc1cc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)n(C)n1	764389042	WZAORRVUFIAVMQ-UHFFFAOYSA-N	427.440	1.548	50	20	IDGD	
Cc1ccc(C(=O)N2CCSCC2)cc1NC(=O)C(=O)NNC(=O)c1ncccc1C	764389758	XLSXIMYBYKMEIQ-UHFFFAOYSA-N	441.513	1.287	50	20	IDGD	
CC(C)Oc1ccc(C#N)cc1NC(=O)C(=O)NNC(=O)CSc1ccccc1O	764394121	OCDLOVMYSHFJNH-UHFFFAOYSA-N	428.470	1.929	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2F)c(=O)n(-c2ccccc2)n1C	764410266	CQVCQVWSHNCYHC-UHFFFAOYSA-N	445.838	1.677	50	20	IDGD	
Cc1onc(-c2ccccn2)c1C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	764553987	UNHAOJGSHRFFCD-UHFFFAOYSA-N	435.849	1.421	50	20	IDGD	
Cc1ccc(S(=O)(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)cc1	765119032	KTSVFMQWNNUFCR-UHFFFAOYSA-N	436.965	1.776	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNS(=O)(=O)c3cc(C#N)ccc3C)CC2)cc1	765125495	GDNUBXQTWHUTKN-UHFFFAOYSA-N	441.557	1.302	50	20	IDGD	
CCOc1ccc(OCC(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cc1	765739374	VFLJOTUCVDBEOS-UHFFFAOYSA-N	440.500	1.070	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@@H]3Cc4cc(F)ccc4O3)CC2)cc1	766646637	ULGJUIWIERIIID-NRFANRHFSA-N	426.492	1.403	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)CN1CCN(C(=O)c2c(F)cccc2Cl)CC1	766872341	BKLDWVKCCSHMGQ-UHFFFAOYSA-N	446.910	1.935	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(O)c(C(=O)NNC(=O)Cc2cccc3ccccc23)c1	767008790	WJPYXZAOEMWHDP-UHFFFAOYSA-N	427.482	1.799	50	20	IDGD	
CC(C)(C)[C@H](Br)C(=O)N1CCN(S(=O)(=O)c2ccc(C(N)=O)o2)CC1	767032435	MBQVILPSWJOMBJ-GFCCVEGCSA-N	436.328	1.021	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2cc([N+](=O)[O-])c(C)s2)cc(OC)c1OC	767438977	ZDQNOXFUTHMKEF-UHFFFAOYSA-N	431.448	1.614	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)c2ccccc2COC2CCOCC2)c1	768115923	OGJAOUCTWREVFX-UHFFFAOYSA-N	437.452	1.872	50	20	IDGD	
NC(=O)[C@@H]1CC(C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)=NN1c1ccc(F)cc1	768261995	CGJDGBHYFLWGKD-HNNXBMFYSA-N	441.448	1.159	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)Cn1cnc2c(oc3ccccc32)c1=O	768636853	YZDYCFXENJCYKH-UHFFFAOYSA-N	442.453	1.698	50	20	IDGD	
CCNS(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)c2cc(-c3ccc(C)cc3)[nH]n2)c1	768848063	NEUTVLQGCHLRCX-UHFFFAOYSA-N	445.476	1.897	50	20	IDGD	
C[C@@]1(c2cccc(C(=O)NNC(=O)CSc3ccc(Cl)cc3)c2)NC(=O)NC1=O	768900124	OPAQPDLWKCWAPC-IBGZPJMESA-N	432.889	1.948	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)Nc1ccc(C)c(NS(C)(=O)=O)c1	769233434	WUSNMCVXPXOFMO-UHFFFAOYSA-N	442.519	1.927	50	20	IDGD	
O=C(NNS(=O)(=O)c1c[nH]c2cccc(F)c12)c1csc(N2CCOCC2)n1	769858388	DKIMYPFWMWLSLC-UHFFFAOYSA-N	425.467	1.223	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)NCCCN1CCC[C@H](C(N)=O)C1	770513362	SWAQDIWHTNNDLY-KBPBESRZSA-N	425.917	1.025	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)[C@H]3Cc4ccccc4CN3C(=O)OC(C)(C)C)nc21	770982375	HEJRWCUPHSTBTB-OAHLLOKOSA-N	439.476	1.874	50	20	IDGD	
CS(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)cc1F	771147708	HEWDHJWGDQXBBP-UHFFFAOYSA-N	445.538	1.723	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1O)c1cccc(S(=O)(=O)N2CCCCC2)c1	771852222	GIYSMVPOAKGSTP-UHFFFAOYSA-N	448.457	1.550	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)c1ccccc1S(=O)(=O)N1CCCCC1	771862075	ORXKRNBGBHVVTH-OAHLLOKOSA-N	439.534	1.600	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)C1CCN(S(=O)(=O)c2ccc(C)cc2C)CC1	771927801	DUCQADQLPYJXRW-OAHLLOKOSA-N	439.534	1.193	50	20	IDGD	
C[C@@H]1C[C@@H](NC(=O)NNC(=O)CNC(=O)OC(C)(C)C)CCN1C(=O)OC(C)(C)C	772483557	VEUJLTHLCZUGHD-OLZOCXBDSA-N	429.518	1.630	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)N[C@@H](c1ccc(F)c(Cl)c1)C(F)(F)F	772628224	LACZFEOTJIMOAY-KCJUWKMLSA-N	431.795	1.848	50	20	IDGD	
Cc1ccc(CC(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)cc1O	772920750	BYSMIPACESUXQO-UHFFFAOYSA-N	430.936	1.862	50	20	IDGD	
N#Cc1ccc(NNC(=O)C(=O)Nc2cccc(Cn3nc4ccccn4c3=O)c2)cc1	773692327	FFJSRALBMSOFNJ-UHFFFAOYSA-N	427.424	1.498	50	20	IDGD	
COc1ccc(F)cc1CC(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	773856417	HTYMJGLYSOVCPL-UHFFFAOYSA-N	448.926	1.995	50	20	IDGD	
CCn1c(=O)c(C(=O)/C(C#N)=C/c2cc(C(=O)OC)co2)c(N)n(Cc2ccccc2)c1=O	774113581	DPDXJQWCWHQHHD-OQLLNIDSSA-N	448.435	1.830	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1cnn(C)c1-c1ccccc1	775521227	DOKRJQZJZAUEOE-UHFFFAOYSA-N	426.502	1.763	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2ccc(C#N)cn2)c1	780655596	YGBUEDYOPXISKY-UHFFFAOYSA-N	430.490	1.128	50	20	IDGD	
CCNC(=O)N(C)NC(=O)CCC(=O)N[C@H](C)C(=O)c1ccc(Br)cc1	780711051	IODQOCXJZOVIIX-LLVKDONJSA-N	427.299	1.609	50	20	IDGD	
Cc1ccc(F)cc1C(=O)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	781552820	ZXKFFRMXIUUKLT-UHFFFAOYSA-N	433.461	1.563	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc2c(c1)CCN2C(=O)C(=O)NNc1ccc(OC)cn1	782144871	GPNCWZBIJRZQEC-UHFFFAOYSA-N	447.517	1.153	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)c2c(OC)ccc(S(N)(=O)=O)c2OC)cc1Cl	782804390	DYGKEELOHHKLLE-UHFFFAOYSA-N	443.865	1.548	50	20	IDGD	
COC(=O)c1cc2cc(NC(=O)C(=O)NNc3ccc(S(C)(=O)=O)cc3)ccc2o1	783071620	KECSAPAZIPCDMW-UHFFFAOYSA-N	431.426	1.705	50	20	IDGD	
CCOC(=O)Cn1cccc(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2Cl)c1=O	784379748	FUAAOYYPUZPVNX-UHFFFAOYSA-N	437.796	1.055	50	20	IDGD	
COC(=O)c1csc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)c1C	784835854	KXIGWVXEFZLZAV-UHFFFAOYSA-N	447.441	1.921	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc(OC4COC4)cc3)n[nH]2)c1	785126150	JSMYKPKRMXQANZ-UHFFFAOYSA-N	449.467	1.871	50	20	IDGD	
COc1cc(F)cc(NNC(=O)C(=O)Nc2ccc(C)c(S(=O)(=O)NC3CC3)c2)c1	785235332	WTSQMOIPWXSKBK-UHFFFAOYSA-N	436.465	1.665	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)N[C@H]3CCN(c4cccc(Br)c4)C3)nc21	787370046	OBAXMYDIGOONOZ-NSHDSACASA-N	447.297	1.736	50	20	IDGD	
Cc1ccc(N2CCNC2=O)cc1NC(=O)C(=O)NNC(=O)c1cc(Br)c[nH]1	787543021	GKBSKNMDWXNQJJ-UHFFFAOYSA-N	449.265	1.015	50	20	IDGD	
CC[C@H](C)NS(=O)(=O)c1ccc(C(=O)NNc2ccccc2S(N)(=O)=O)cc1	788224249	RTSGFTLHQLHBNS-LBPRGKRZSA-N	426.520	1.168	50	20	IDGD	
CN(C)c1ccc(S(=O)(=O)N(C)C)cc1NC(=O)NNc1cc(Cl)nc(N)n1	789010144	BRSJOLWXZUYAOI-UHFFFAOYSA-N	428.906	1.177	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)CC(=O)N3C)cc1	789741596	XLDOBMYCRHMEMX-CYBMUJFWSA-N	440.456	1.158	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cc([C@H]3CCCO3)nn2C)cc1	789741677	YJHPCAATWFYVGZ-SUMWQHHRSA-N	445.476	1.224	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(/C#N)C(=O)N2CCN([C@@H]3CCS(=O)(=O)C3)CC2)c1C	790252238	LOXGHRHEZUNUNY-YTORKTKBSA-N	448.589	1.551	50	20	IDGD	
O=C(NCCCCn1cc(Br)cn1)NNC(=O)c1cccc([N+](=O)[O-])c1	792220655	KNGAQPQJRIMKLB-UHFFFAOYSA-N	425.243	1.978	50	20	IDGD	
O=C(NC[C@H]1CCN(Cc2ccccc2)C1)NNC(=O)C1CCN(c2ncccn2)CC1	792224544	FRRRABWXQYVCDP-LJQANCHMSA-N	437.548	1.546	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccccc2O)cc(N2CCN(C(C)C)CC2)c1	792264338	NDNYIWQDMRICIC-UHFFFAOYSA-N	439.516	1.631	50	20	IDGD	
O=C(NNc1nc2ccccn2n1)Nc1ccc2c(ccn2CC(=O)N2CCOCC2)c1	792286389	BMVMDDGYEGTEFF-UHFFFAOYSA-N	434.460	1.691	50	20	IDGD	
CSSCCNC(=O)C(=O)Nc1cccc(S(=O)(=O)/N=C2/CCCN2C)c1	793078051	ATESGOXWFJLHCR-RGEXLXHISA-N	430.577	1.565	50	20	IDGD	
CCn1ncnc1CNC(=O)/C(C#N)=C/c1cn(CCC(N)=O)nc1-c1ccc(OC)cc1	794232926	OGNGVXJSPXONDP-MHWRWJLKSA-N	448.487	1.269	50	20	IDGD	
O=C(NNS(=O)(=O)C[C@H]1CCCOC1)[C@H]1Cc2ccccc2CN1Cc1ccccc1	795305315	MBFDIWGZQOSSRR-SIKLNZKXSA-N	443.569	1.991	50	20	IDGD	
CCOc1ccc([C@@H]2C[C@H]2NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1	798113372	ZKJUKGJWLNOTQX-RBUKOAKNSA-N	446.529	1.836	50	20	IDGD	
Cc1nnnn1[C@@H](Cc1cccc(F)c1)C(=O)NNC(=O)Nc1ccc2c(c1)OCO2	802096899	AOCOUSCHIWHVLY-HNNXBMFYSA-N	427.396	1.486	50	20	IDGD	
Cc1nn(C)c2sc(C(=O)N[C@H](C)C(=O)NNc3ccc(-n4ccnc4)nn3)cc12	804954642	MMBSTNJLAIKEGV-LLVKDONJSA-N	425.478	1.181	50	20	IDGD	
CCN(CC)CC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(C)cc2O)c1	806976654	UECBYWBATUBKDV-UHFFFAOYSA-N	441.488	1.381	50	20	IDGD	
O=C1COC[C@H](C[C@H]2CN(C(=O)C(=O)NNc3c(F)cccc3F)c3ccccc32)N1	806984294	POCOWCAIMVNHMK-STQMWFEESA-N	430.411	1.443	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NC[C@@H](Cc1ccccc1)N(C)C	807005841	GCZIKSZXTXVHIR-QGZVFWFLSA-N	446.577	1.405	50	20	IDGD	
C[C@]1(C2CC2)NC(=O)N(c2ccc(CNC(=O)NNc3nc4ccccn4n3)cc2)C1=O	807243245	ZYTURUXSSFDFEN-OAQYLSRUSA-N	434.460	1.781	50	20	IDGD	
Cc1cc2cc(CNC(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)ccc2[nH]1	807561864	ZUARCHTUIMUYHF-UHFFFAOYSA-N	429.502	1.871	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)C(=O)OC3)cc1OC	808934678	QFDWOMZCJKFZTA-UHFFFAOYSA-N	441.440	1.944	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCC(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)cc1C	810382267	MADJTFAISWCJQM-UHFFFAOYSA-N	447.521	1.325	50	20	IDGD	
CC(C)CC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)NNc1nc(O)c2cnn(C(C)(C)C)c2n1	810382566	QJFJYJCXZHVOEN-AWEZNQCLSA-N	443.512	1.227	50	20	IDGD	
C[C@H](CC(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1)c1ccc(F)c(Br)c1	812535457	WROSACJIRKDZPH-KOLCDFICSA-N	436.303	1.599	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccc(-c3ncon3)cc2)cc1	813033831	NHZZCEMTIZGKFS-UHFFFAOYSA-N	430.446	1.069	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)N[C@H]2CC(=O)N(c3ccccc3F)C2)cc1C	813235904	CEZALVGOBMGFJC-HNNXBMFYSA-N	427.436	1.517	50	20	IDGD	
CC(=NNC(=O)CNC(=O)c1ccco1)c1cc(Br)ccc1OCC(=O)O	814827231	ZZKVQYQXCWFSTK-UHFFFAOYSA-N	438.234	1.776	50	20	IDGD	
Cc1ccnn1-c1ccccc1NC(=O)C(=O)NNc1ccccc1S(=O)(=O)N(C)C	815751723	LPQZCPIYVYKIBP-UHFFFAOYSA-N	442.501	1.513	50	20	IDGD	
O=C1CNC(=O)c2ccc(C(=O)NNC(=O)Nc3ccc(Br)cc3)cc2N1	816595169	CFMZBEIZIXDGST-UHFFFAOYSA-N	432.234	1.598	50	20	IDGD	
O=C(COC(=O)COc1cccc2ccccc12)NNC(=O)[C@@H]1COc2ccccc2O1	844161232	CSYFQDOFNJHRPO-FQEVSTJZSA-N	436.420	1.749	50	20	IDGD	
COc1ccc(C(=O)NCCCC(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)cc1	914881936	ODHGKESFYANSIF-UHFFFAOYSA-N	426.473	1.608	50	20	IDGD	
COC(=O)Cc1cc(=O)n(-c2ccc(C(=O)NNC(=O)c3cccc(Cl)c3)cc2)[nH]1	915188572	ZDYYYFAYHKPWNU-UHFFFAOYSA-N	428.832	1.609	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCCn2c(C)nc3ccccc32)c2ccccc2c1=O	916195481	LDXXPERIBWBPOO-UHFFFAOYSA-N	433.472	1.719	50	20	IDGD	
CC(=NNC(=O)COc1ccc(F)cc1)c1ccc(S(=O)(=O)N2CCOCC2)cc1	916336931	SYTQUZULBIRBDK-UHFFFAOYSA-N	435.477	1.766	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)NCC[C@@](O)(c2nccn2C)C(F)(F)F)c1	916377130	ABIGQWPBLYNIRD-GOSISDBHSA-N	443.426	1.586	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2ccc(C#N)cc2)c1	916409502	AZQGAOOSEOWCPK-UHFFFAOYSA-N	429.502	1.733	50	20	IDGD	
C[C@H]1CCCCN1[C@H](C)CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	916446744	AVBLBTNZSQFXBD-LSDHHAIUSA-N	425.555	1.144	50	20	IDGD	
N#Cc1cccnc1NCCNC(=O)NNC(=O)COc1ccc(Br)cc1	916641312	UKSUURMTJOIHMP-UHFFFAOYSA-N	433.266	1.537	50	20	IDGD	
CCCC(=O)N1CCC[C@@H]1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	917529024	JUYQGIOCGZTGSA-QGZVFWFLSA-N	436.534	1.023	50	20	IDGD	
CCCc1ccc(S(=O)(=O)N2CCN(C(=O)NNC(=O)c3ccccc3)CC2)cc1	918005514	ZSYHASMJAJCDRH-UHFFFAOYSA-N	430.530	2.000	50	20	IDGD	
COC(=O)COc1ccc(C(=O)NNC(=O)COc2ccc(Br)cc2)cc1	918277549	DVEXSGWMHOROCL-UHFFFAOYSA-N	437.246	1.841	50	20	IDGD	
CSCC[C@@H](NC(=O)c1ccc([N+](=O)[O-])o1)C(=O)NNC(=O)Cc1ccc(F)cc1	919810034	RNHDSWWWJOYVSB-CYBMUJFWSA-N	438.437	1.569	50	20	IDGD	
O=C(CCc1nc2ccccc2n1-c1ccccc1)NNC(=O)N[C@H]1CCS(=O)(=O)C1	919886227	RHUPIMKICAPBCD-HNNXBMFYSA-N	441.513	1.476	50	20	IDGD	
O=C(Cc1ccc(Cl)cc1)NNC(=O)NCc1cccc(C(=O)N2CCOCC2)c1	920419617	GPCCDOKLIQZDEU-UHFFFAOYSA-N	430.892	1.886	50	20	IDGD	
CC(=O)N/C(=C\c1ccccc1)C(=O)NNC(=O)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	920435486	HOBLSSDOQUQGQZ-GFWHJHDHSA-N	430.505	1.958	50	20	IDGD	
CN(C1CCCCC1)S(=O)(=O)c1cccc(C(=O)NNC(=O)CN2CCCC2=O)c1	920827437	TZBMAJFRWVKKJX-UHFFFAOYSA-N	436.534	1.023	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)NCc1ccco1)N1C(=O)c2ccc(Br)cc2C1=O	920857848	RDCOOYUKBZIDOP-VIFPVBQESA-N	435.234	1.557	50	20	IDGD	
N#CCc1ccc(S(=O)(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc1	1318965731	JPHCOWMWCDKAHK-UHFFFAOYSA-N	448.526	1.160	50	20	IDGD	
C[C@@H]1CN(c2ccc(CNC(=O)NNC(=O)c3cncn3-c3ccccc3)cn2)CCO1	1321725333	RSNBAXKLLKUBFA-MRXNPFEDSA-N	435.488	1.637	50	20	IDGD	
CC1=C(C(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)[C@@H](C)n2ncnc2N1C	1344531727	GHXVEEAMHZODFW-CYBMUJFWSA-N	433.513	1.357	50	20	IDGD	
CN1CCCn2nc(C(=O)N3CC[C@H]4OCCC[C@@]4(CNC(=O)[C@H](F)Cl)C3)cc2C1	1778029473	MUSDKBOBMHHFNS-FUHIMQAGSA-N	441.935	1.381	50	20	IDGD	
CC(C)CNC(=O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CO[Si](C)(C)C)C2	1778117377	WYZSTQYMVAGXNN-OXQOHEQNSA-N	427.618	1.124	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Cl)C2)c1ccc2nc(CO)[nH]c2c1	1778515934	KYFXNNKVFQSEGW-WRWLIDTKSA-N	438.887	1.717	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)c3cccc(Cl)c3)C2)C1	1780630082	YMUBOAYDOYBGJN-NRFANRHFSA-N	443.891	1.096	50	20	IDGD	
CC(=O)N(C)[C@@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Br)C1	1780773784	WMJJIQYRGXQLNW-XZBIERFOSA-N	436.322	1.058	50	20	IDGD	
COc1c(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](O)CCl)C3)ccc(F)c1F	1781040872	SYFLCYMZXLIODZ-BXTJHSDWSA-N	446.878	1.701	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@](C)(Cl)CCl)C2)C1	1781233241	ROFXFONXCSGUKU-DQYPLSBCSA-N	425.309	1.614	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2)c1cc2cccnc2nc1O	1781249723	QFHNTRNHDSDXSP-WHSLLNHNSA-N	448.907	1.063	50	20	IDGD	
N#Cc1cc(CC(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)ccc1F	1781333262	NHPVTBSVAZFQTM-AEFFLSMTSA-N	442.260	1.760	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Cl)C2)[C@@H]1CC(c2ccccc2)=NN1	1781449864	VANHMPFYKOLMHO-XKGFGPFHSA-N	436.915	1.801	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H]2CCCS2(=O)=O)C1	1781649715	ITYRROCVYHZQSM-YYAJDYIMSA-N	434.986	1.485	50	20	IDGD	
C=CC[C@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2	1781740074	VPIHVZVDKVDHDY-BKISJYPXSA-N	443.548	1.847	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1nnc(C)s1)C2	1782170252	DQPZULCZJGHJDA-PMUMKWKESA-N	430.958	1.157	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cn(C(C)(C)C)nn1)C2	1782173761	OLWRHZBOGNUZHS-AKCHCHLHSA-N	441.960	1.414	50	20	IDGD	
COc1ccccc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCC(=O)NN(C)C)C1	1782212158	KMIJMKFXCCADLW-AUSIDOKSSA-N	446.548	1.196	50	20	IDGD	
CCOCCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2	1782674107	SAANRQGMNVHGHX-UPRBLEQPSA-N	447.536	1.061	50	20	IDGD	
CCS(=O)(=O)c1ccc(CC(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](F)Cl)CCO3)cc1	1783017194	JTCGYLOZJUUKPL-IEBWSBKVSA-N	446.928	1.387	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3noc4c3CCCC4)CCO2)C1	1783534540	LDJUYCNRAJMYQL-SGTLLEGYSA-N	426.311	1.780	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc([N+](=O)[O-])cc3F)CCO2)C1	1783538667	XGKKDVRLPAJTKJ-DIFFPNOSSA-N	444.257	1.961	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(OC(F)F)cc3)CCO2)C1	1783880950	NSIVZFOHVGDWBX-KXBFYZLASA-N	432.851	1.985	50	20	IDGD	
Cn1ccc2c(O)ncc(C(=O)N3CCO[C@]4(CCN(C(=O)C(Cl)Cl)C4)C3)c21	1783948322	JWHWGLKESSCCAZ-SFHVURJKSA-N	427.288	1.526	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)c3ccccc3)C[C@@H]21	1783968117	QSYGRFVQEDKZGB-HILJTLORSA-N	439.350	1.731	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)COCc3ccc(OC)cc3)C2)C1	1784098354	IZXPQGHNMKBUDN-WIYYLYMNSA-N	440.924	1.296	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCC#N)[C@H]2C1	1786705969	BRCRDYBMDOSTSG-FNHZYXHNSA-N	444.444	1.417	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3ccc(F)cn3)[C@H]2C1	1787031185	BWIVCWPIAJHZHQ-OQUILHJVSA-N	442.329	1.774	50	20	IDGD	
CCc1ccnc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Br)C[C@@H]32)c1	1787231038	MXZRDFZWOVDHBI-DARAHFNDSA-N	428.302	1.928	50	20	IDGD	
COC(=O)c1ccc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]3C2)s1	1787449317	PFOPDWGQDQXXDX-RKOGSIPDSA-N	432.901	1.591	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3snnc3C)[C@H]2C1	1787633146	MBUPPZYMNTYLSW-CYDGBPFRSA-N	431.356	1.613	50	20	IDGD	
C[C@@H](CBr)C(=O)NC1(c2ccc(NC(=O)CC[C@@H](N)C(N)=O)cc2)CCC1	1788054598	JVYJQTOOZAMEME-SWLSCSKDSA-N	439.354	1.744	50	20	IDGD	
C[C@H](Nc1cnccn1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]2C1	1788764734	TYMAQPNANUCMSX-QAETUUGQSA-N	435.601	1.108	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)C[C@@H]21	1789859961	FUHZQAVWXNAQTD-XPYUAMARSA-N	446.935	1.776	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](N)c3ccccn3)C[C@@H]21	1789866728	XBCJFJRCAQDNNF-FZQIUNFVSA-N	429.348	1.297	50	20	IDGD	
CCc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]3C2)nn1C	1789924632	QBDANENCEAYEQX-HQRZJTNHSA-N	431.306	1.266	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C=C/c3cccc(OC)c3)[C@H]2C1	1791001712	ZETJHSPVUQWAHP-ZTXCGUALSA-N	436.936	1.942	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@](C)(O)C(F)(F)F)C[C@@H]21	1791055210	OFGWLOAOFZWLIJ-VITBEWHZSA-N	431.249	1.063	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3N(C)C)C[C@@H]21	1791056780	BCAFPBXQNLCWEJ-HPZZRFSDSA-N	439.354	1.524	50	20	IDGD	
C[C@H](Nc1cccnc1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]2C1	1791058049	NROJYHXFVAANOC-HZRXROBNSA-N	439.354	1.645	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1ccc(C2(NC(=O)[C@](C)(O)C(F)(F)F)CCC2)cc1	1791599907	OVCWCKYTZAYNLC-SFHVURJKSA-N	444.454	1.807	50	20	IDGD	
C[C@H](NNc1ccccc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2	1792508412	NAHUKGPTYIYMSD-PLPKTUSISA-N	443.317	1.272	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CC(=O)N(C3CCCC3)C1)C2	1793445875	UESJERRCRBBWAL-XYKCEAJKSA-N	439.984	1.775	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2)[C@H]1CC(=O)N(C2CCCC2)C1	1793779465	HQYGXIPQHDWYHP-JFILPPLUSA-N	432.348	1.171	50	20	IDGD	
COc1ccc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)Br)C3)cn1	1793895165	VBYDJKSRHAGTFU-LJGDNWOOSA-N	440.338	1.396	50	20	IDGD	
COc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCBr)ccc1C	1795114861	GPEQNOSQGMHDJY-JLVBRIDZSA-N	425.323	1.992	50	20	IDGD	
Cc1ccccc1OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)CBr)C2	1795302519	CPTRDTZZJRJCJV-OAFZBRQQSA-N	439.350	1.994	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1ccc2c(c1)COC2	1797014801	HRYFLPSEQZTKPZ-FZKCQIBNSA-N	427.270	1.611	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2cccnc2n1	1797358295	KUIQIILSYKRJRA-HGKCTWBKSA-N	428.565	1.685	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C=N/O[C@H]1CCCCO1	1797817106	YJAQLWQBPHZPSJ-QEUSUPOWSA-N	446.342	1.279	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cc1ccc(F)cc1F)C2	1798442792	FMZQVZJXHZKSBE-MUJYYYPQSA-N	443.454	1.458	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnn3ccncc13)C2	1799274778	AXBOWXMKBFOGOS-TYYYEBLRSA-N	426.304	1.169	50	20	IDGD	
C[C@H](Sc1ccccn1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Br	1799352436	WTRRXUSIWOGXFM-ZZVJUGKHSA-N	446.342	1.842	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1c(C)n[nH]c1C	1799417178	LMCGJPFXMYJPCJ-IARIHHJXSA-N	427.343	1.332	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccccc1C(F)(F)F)c1ccc(B(O)O)cc1	1799585438	DXHTYLXILFKCNY-BJWYYQGGSA-N	446.234	1.951	50	20	IDGD	
O=C(/C=C/c1cc(F)c(F)c(F)c1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2	1800867879	VSLGZIZZKMRQMR-HQPDXQKMSA-N	432.826	1.306	50	20	IDGD	
C#CCCCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1800991016	OINMIPMWDAMDEL-DFGXFYAUSA-N	441.956	1.512	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1C[C@@]13C(=O)Nc1ccccc13)C2)C(Cl)Cl	1801018152	OXFBDPUCDGRURK-FTJMNEKSSA-N	438.311	1.290	50	20	IDGD	
Cc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Br)C3)cc(C)c1O	1801703129	IACSWILHAIWBSB-FQLMCAECSA-N	429.286	1.903	50	20	IDGD	
COC[C@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H]1CC(=O)N(C3CCCC3)C1)C2	1802271158	YOEGDORLVZNRME-ABJHKEKUSA-N	425.957	1.670	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cnc3snnc3c2)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803140908	IXYWTGVAAWVZIE-VBNZEHGJSA-N	446.920	1.401	50	20	IDGD	
O=C(CCBr)NC[C@@H]1CCN(C(=O)Cc2cnccn2)[C@H]1c1cccnc1	1806343044	RNPRHAPMBUAKMJ-KXBFYZLASA-N	432.322	1.905	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)CCC2CCC2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807359684	KYSZQTYGTLEOAL-OFNKIYASSA-N	435.333	1.661	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)nc1	1807361636	BYJJPFCRCQKPCI-SIKLNZKXSA-N	444.300	1.098	50	20	IDGD	
CCOC(=O)N[C@H](O)C(=O)N1CC[C@H](CNC(=O)[C@H](Cl)CC)[C@@H]1c1cccnc1	1808264528	YSMGNRWTWGOEHC-PNBKFKSVSA-N	426.901	1.169	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)CCC#N)[C@@H]1c1cccnc1	1808414852	MWFRFUTZPYPCGN-BLCOGNGMSA-N	435.488	1.525	50	20	IDGD	
O=C(/C=C/C1CCCC1)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1808482468	XPMLEUPSBSWUOY-DYCBHTBMSA-N	447.344	1.827	50	20	IDGD	
Cc1ccnc(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)c1	1808534269	ZQHOZCSDCCMRRL-KNQAVFIVSA-N	444.300	1.098	50	20	IDGD	
Cn1cc(CC(=O)N2CC[C@H](CNC(=O)[C@@H](F)Br)[C@H]2c2cccnc2)cn1	1808681061	OLLKEOLGGQDYRZ-DJIMGWMZSA-N	438.301	1.754	50	20	IDGD	
CN1C(=O)CC[C@H]1C(=O)NC[C@@H]1CCN(C(=O)CO[Si](C)(C)C)[C@@H]1c1cccnc1	1808768665	BKFULTGBSUVPFL-ABSDTBQOSA-N	432.597	1.560	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)CCNC(=S)NC)[C@H]1c1cccnc1	1810306548	VPPCILNAISXWOQ-XYJFISCASA-N	440.013	1.979	50	20	IDGD	
C[C@H](NC(=O)c1cnccn1)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Cl)[C@@H]1c1cccnc1	1810446727	IXZDQLGVENNDPM-GUDXXQAFSA-N	448.886	1.230	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@H]1c1cccnc1)c1ccnnc1O	1811231119	XRGOMPJTZOELJQ-FPMFFAJLSA-N	438.257	1.587	50	20	IDGD	
Cc1nccn1CC(=O)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@@H]1c1cccnc1	1812406558	ICHHHVHITGHRJU-UAGQMJEPSA-N	438.301	1.983	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2cc3n(n2)CCC3)[C@H]1c1cccnc1	1813031007	IQJSHBWMZYFKBN-AYBZRNKSSA-N	431.924	1.798	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)Cc2c(C)n[nH]c2C)[C@H]1c1cccnc1	1813033501	UDFROWYULQXKHB-KPFFTGBYSA-N	433.940	1.924	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@H]1CCc2nc(NC(=O)CS(C)(=O)=O)sc2C1	1814314721	JAJPZITZCKJGCK-BDAKNGLRSA-N	438.369	1.131	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CNC(=O)N(C)C)n[nH]1	1814566641	KLULVCVRUHWULT-WCQYABFASA-N	443.346	1.847	50	20	IDGD	
CC(C)(CCl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1814696993	HMPHCFRZPXQWAU-OAHLLOKOSA-N	447.927	1.979	50	20	IDGD	
O=C(NCCC(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](O)CCl)n[nH]1)c1ccccc1	1814875793	IRYHXDKVJVCRFG-DLBZAZTESA-N	447.923	1.822	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1sccc1F)CC2)c1ccc(B(O)O)cc1	1815337599	UMSSZCHMBZLYLY-GFCCVEGCSA-N	445.306	1.563	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](C)[C@@H]3SC(=N)NC3=O)sc2C1	1817249526	DZZLWUXHUMXOKJ-NHRVJRKFSA-N	443.982	1.875	50	20	IDGD	
Cc1cn(CC(=O)N2CCCC[C@H]2c2cc(NC(=O)[C@@H](F)Cl)n[nH]2)c(=O)nc1O	1818045377	UIRRJKLPAVVFPJ-SMDDNHRTSA-N	426.836	1.207	50	20	IDGD	
C[Si](C)(C)OCC(=O)Nc1cc([C@H]2CCCCN2C(=O)CNC(=O)C(F)(F)F)[nH]n1	1819597237	MUEPZWFJUKXEMB-GFCCVEGCSA-N	449.506	1.932	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CN)CC2	1821304446	KYMDKHYVWDNGQZ-JTQLQIEISA-N	433.446	1.161	50	20	IDGD	
CN(CC(=O)Nc1cc([C@H]2CCCCN2C(=O)C(C)(C)CCl)[nH]n1)C(=O)C(=O)O	1821710719	WHCRAOLXJJYJPC-GFCCVEGCSA-N	427.889	1.210	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CS(C)(=O)=O)CC1	1824093023	KCFQENFJDCSUAT-UKRRQHHQSA-N	437.400	1.682	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(F)c1)CC2	1826089003	TVMMQONMQUCMTQ-CQSZACIVSA-N	433.509	1.881	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)CCCn3ccnc3)sc2C1	1826690466	KXXFUHYMOKYQRH-STQMWFEESA-N	425.942	1.986	50	20	IDGD	
O=C(CCC(F)(F)F)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827055413	ZKDUUGXBDBDIJS-SFHVURJKSA-N	440.271	1.942	50	20	IDGD	
CN1CCC(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@](C)(Cl)CCl)C3)C2)CC1	1829894614	QHJRLMJXFYKLER-RTBURBONSA-N	436.380	1.021	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(O)ccc3F)C2)C1	1830363658	HEHOVMFFANLYKY-HXUWFJFHSA-N	428.888	1.866	50	20	IDGD	
CC(C)c1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)n[nH]1	1830365286	WJBJZNUFNPYOHV-FQEVSTJZSA-N	426.945	1.868	50	20	IDGD	
CC(C)(C)c1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)s1	1830727836	HQVAJDHUQUCNRF-VLIAUNLRSA-N	444.981	1.715	50	20	IDGD	
Cc1cc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)cc(O)n1	1831870755	FHTQRDBHTUDNNO-IBGZPJMESA-N	445.564	1.702	50	20	IDGD	
Cc1cncc(C(=O)N2CCC([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)c1	1831872396	UIAPCKFILSYHCE-HXUWFJFHSA-N	429.565	1.996	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2cnccn2)CC1	1832305077	KVQZLPILMJYAES-CPSHHHPTSA-N	442.564	1.483	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cnc(Cl)s3)CC2)CC1)[C@H](O)CCl	1833312152	GRINVMYYTHWNHZ-CYBMUJFWSA-N	435.377	1.581	50	20	IDGD	
CC(C)c1cc(C(=O)N2CCC(N3CCC(NC(=O)[C@@H](O)CCl)CC3)CC2)n[nH]1	1833312705	XYBDLQSRZUYCIO-SFHVURJKSA-N	425.961	1.318	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(N(C)C)cn3)CCO2)C1	1833643374	QHYDUZISTMXELJ-LAUBAEHRSA-N	438.956	1.625	50	20	IDGD	
O=C(CCc1ccc(F)nc1)NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1833793664	CEMHLQLUSPUKLU-SFHVURJKSA-N	440.947	1.325	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3c(C)noc3C)CCO2)C1	1834067986	FIDAPGFJNBLQHH-RDTXWAMCSA-N	444.326	1.535	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cncc(F)c3)CCO2)C1	1834358818	FOURGWFVZUBOQO-YJBOKZPZSA-N	444.301	1.464	50	20	IDGD	
Cc1cccc(C(=O)N2CCOC[C@]3(CN(C(=O)CCBr)CCO3)C2)c1	1834823699	DOQVIDHWUHKGSF-IBGZPJMESA-N	425.323	1.850	50	20	IDGD	
COc1ccnc(C(=O)N2CCC(N3CCC(NC(=O)[C@H](F)Cl)CC3)CC2)c1OC	1835082199	VOAILWRCLJRQQJ-SFHVURJKSA-N	442.919	1.818	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CNc3ccc(F)cc3)CCO2)C1	1835583164	JQNFHYCBLVCRQC-PXNSSMCTSA-N	427.904	1.711	50	20	IDGD	
O=C(c1ccc(OCCCO)cc1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1838547586	FTHBXEMHJYGFHL-XLIONFOSSA-N	444.887	1.052	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cc(F)ccc1F)CCO2	1838859891	XGYUAGWQVJJDRA-FQEVSTJZSA-N	442.535	1.886	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(F)c(F)c3)CCO2)C1	1839011741	XXZDVUFATJTICL-KZULUSFZSA-N	447.276	1.818	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(Cl)cnc3OC)C2)C1	1839141532	KRWQZRUOGUDINB-HNAYVOBHSA-N	446.331	1.831	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3n[nH]c4ccc(C#N)cc34)C2)C1	1839147956	ICFYTHPHSQKHNE-HRAATJIYSA-N	445.907	1.522	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3snnc3C)C2)C1	1839963989	BRXAVKVCXNMMBT-BLLLJJGKSA-N	447.355	1.090	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C4CC4)on3)C2)C1	1840030352	JINWJOZCLHWKLX-XIKOKIGWSA-N	442.310	1.405	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1	1840033649	MJGFLWDNUGNLSI-CZUORRHYSA-N	437.407	1.078	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccccc3O)C2)C1	1840035444	RNWIELOXMFUZOT-IFXJQAMLSA-N	441.322	1.175	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)N2CC3(CCCN3C(=O)[C@@H](O)CCl)C2)CC1	1841354614	KSNIWHLYXPCHHO-HNNXBMFYSA-N	429.945	1.437	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CCCC12CN(C(=O)[C@@H](O)CCl)C2)C1CC1	1841409919	WEPXXMUOUYNRBC-GJZGRUSLSA-N	429.945	1.483	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)Cc2cc(F)ccc2Cl)C1	1841832183	KYNVBTFEISZODJ-UHFFFAOYSA-N	445.882	1.537	50	20	IDGD	
O=C([C@H]1C[C@@H]1c1ccc(F)c(F)c1)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843010436	PVRKOFIAAWCTML-MSOLQXFVSA-N	440.255	1.265	50	20	IDGD	
C[C@H](Br)C(=O)N1CC2(CCCN2C(=O)c2cc(=O)nc3sccn23)C1	1844625755	VHLUCJQAVWHVQQ-JTQLQIEISA-N	425.308	1.356	50	20	IDGD	
CC(C)(NC(=O)c1ccc(Cl)s1)C(=O)N1CCCC12CN(C(=O)[C@@H](O)CCl)C2	1845042833	UXYVKAIFWURACT-NSHDSACASA-N	448.372	1.713	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC12CN(C(=O)c1cc3n(n1)CCCN(C)C3)C2	1846072300	QYZMWTNYXWRUSR-HNNXBMFYSA-N	438.370	1.709	50	20	IDGD	
CCOC(=O)c1c(CCC(=O)N2CC3(CCCN3C(=O)[C@@H](Cl)COC)C2)c[nH]c1C	1846360396	KBJBEHCKZWIZGX-INIZCTEOSA-N	439.940	1.890	50	20	IDGD	
Cc1ccc(C(=O)NCC(=O)N2CCCC23CN(C(=O)[C@H](F)Br)C3)cc1	1847065896	JCDCJRGAMXSRGD-HNNXBMFYSA-N	426.286	1.619	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CN1CCCC1	1847301710	TTXUXPBHCBXWHT-ROUUACIJSA-N	430.461	1.431	50	20	IDGD	
C[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl	1847556962	UIMWCDLCCWDFDM-UHDSXZAQSA-N	443.972	1.681	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)Cc1ccc2c(c1)CCC2	1848075137	INPFAVQECVHEME-SFTDATJTSA-N	433.512	1.232	50	20	IDGD	
CCn1c(NNC(=O)c2cc(OC)c(OCC(N)=O)c(OC)c2)nc2ccccc2c1=O	11162663	MPFWNPOFUGPKFE-UHFFFAOYSA-N	441.444	1.055	50	20	IDGD	
Cc1nn(C)c(Cl)c1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	14236013	UOODAWDZIGIGMT-UHFFFAOYSA-N	425.898	1.241	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1cc([N+](=O)[O-])ccc1Sc1ccccc1	15639598	RZWUPXVKGIWVFN-GFCCVEGCSA-N	435.483	1.942	50	20	IDGD	
CC(C)N(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Cc2nc3ccccc3n2C)c1	15926109	MHJSTUVKMXFGOQ-UHFFFAOYSA-N	443.529	1.606	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)CCc1nc(-c2ccsc2)no1	16053089	AYQRFIZNMHIOGA-UHFFFAOYSA-N	448.530	1.793	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)CCn1nnc2ccccc2c1=O	23566090	GJIWMROSIRQCSV-HNNXBMFYSA-N	431.452	1.950	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)c2cc(S(=O)(=O)N(C)C)ccc2F)cc1	24784929	ZGRLKCPPRJUENF-UHFFFAOYSA-N	437.449	1.002	50	20	IDGD	
COc1cc([N+](=O)[O-])ccc1OC(=O)c1cc(S(=O)(=O)N2CCSCC2)c[nH]1	725733107	UZDQFYLMEHGEOF-UHFFFAOYSA-N	427.460	1.888	50	20	IDGD	
Cc1ccc(CNC(=O)N[C@H](CC(C)C)C(=O)NNC(=O)CNC(=O)c2ccco2)cc1	725741672	UCLAEFWZXMFRKD-QGZVFWFLSA-N	443.504	1.379	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)c2ccc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)cc2)cn1	725906770	FGERZLFESZWFIB-UHFFFAOYSA-N	444.429	1.204	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(C)c(C(=O)NN(C)C(=S)NCCCOC)c1	726076988	KKBCUBBVRRQGPG-UHFFFAOYSA-N	430.596	1.513	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)[C@H](C)NC(=O)c1n[nH]c2ccccc12	726379895	UYJSQQUADXQLDZ-ZDUSSCGKSA-N	425.445	1.306	50	20	IDGD	
COc1ccc(CN2C[C@H](C(=O)NNC(=O)[C@@H]3COc4ccccc4O3)CC2=O)cc1	726496692	GRBBKOJSWSFIJC-BEFAXECRSA-N	425.441	1.031	50	20	IDGD	
CNS(=O)(=O)c1cccc([C@H](C)NC(=O)NNC(=O)COc2ccc(C)c(C)c2)c1	727607314	BJXKTDOUMZCRIT-HNNXBMFYSA-N	434.518	1.682	50	20	IDGD	
CCCn1c(=O)nc(O)c2c(C(=O)NNc3nc(-c4ccncc4)no3)cc(C3CC3)nc21	728073346	HAZUCABTJGGKMJ-UHFFFAOYSA-N	448.443	1.986	50	20	IDGD	
O=C(COC(=O)c1ccn(-c2cccc(F)c2)n1)NNC(=O)[C@@H]1COc2ccccc2O1	728334424	YMFRXCIKULWDLS-SFHVURJKSA-N	440.387	1.156	50	20	IDGD	
C[C@H]1Cc2cc(C(=O)NNC(=O)Cn3ccc4ccccc43)ccc2N1S(C)(=O)=O	729450051	KPBBYRQYNOAYMQ-AWEZNQCLSA-N	426.498	1.813	50	20	IDGD	
CN(C)c1ccc(NC(=S)NNC(=O)c2ccc(S(=O)(=O)NC3CC3)cc2)cc1	729690965	SDCAIVLWALAIAN-UHFFFAOYSA-N	433.559	1.825	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCCCCC2)cc1)NNC(=O)Cc1cc[nH]n1	730102898	RWDMQGSLNSHKKH-UHFFFAOYSA-N	433.534	1.297	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2c(Cl)cccc2[N+](=O)[O-])cc1OC	730642771	GCBUUNAWQDIGJK-UHFFFAOYSA-N	437.792	1.883	50	20	IDGD	
CC(C)NC(=O)C(=O)NNS(=O)(=O)c1csc(-c2cccc(Br)c2)n1	730765729	NATQHHLZNVTRON-UHFFFAOYSA-N	447.336	1.407	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2nnc(O)c3ccccc23)nnn1-c1ccc2ncccc2c1	731341977	ZREMOCMYURKZLG-UHFFFAOYSA-N	440.423	1.848	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@H]1CC(=O)N(C2CCC(C)CC2)C1	731343079	DMSADTSYGWMQMV-SIWZUTFBSA-N	449.577	1.476	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)NC2CCN(CCS(C)(=O)=O)CC2)c1C	731648831	VFRLKOUWTPYCRF-XMHGGMMESA-N	436.578	1.284	50	20	IDGD	
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC(C(=O)NNc2nc(-c3ccccc3)no2)CC1	732113529	WGJULRACBCPIEF-UHFFFAOYSA-N	445.505	1.621	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNc2ccccc2S(C)(=O)=O)c1	732305664	NZZFYYLFPAOFIQ-UHFFFAOYSA-N	425.532	1.878	50	20	IDGD	
CCN1CCCC[C@H]1CNC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	732471161	KRYLDBTWNBGBRI-KRWDZBQOSA-N	437.566	1.290	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CC(=O)N(c2ccc3c(c2)OCCO3)C1)c1cnn(-c2ccccc2)c1	733110067	PVYDGIZDUCNKLA-OAHLLOKOSA-N	447.451	1.458	50	20	IDGD	
C[C@@H]1CN(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)C[C@@H](C)N1C(=O)OC(C)(C)C	733335861	FNOYKFKXOCSBPK-ZIAGYGMSSA-N	444.496	1.346	50	20	IDGD	
O=C(NCCNC(=O)c1ccccc1Cl)NNC(=O)c1cnn(-c2ccccc2)c1	733350205	RXQLLUZJBSVWIU-UHFFFAOYSA-N	426.864	1.900	50	20	IDGD	
COC[C@@H](C)n1c(C)cc(/C=C(\C#N)C(=O)NS(=O)(=O)CCCC(=O)OC)c1C	734087821	CLIQCFXVCXWNLR-NGWPFTMJSA-N	425.507	1.619	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)NC[C@@H]1CCCN1Cc1ccccc1	734218438	SQLAUVJIBIGLMU-KRWDZBQOSA-N	427.461	1.969	50	20	IDGD	
CN1CCC(N2CC[C@H](NC(=O)NNC(=O)c3ccc(F)cc3Br)C2)CC1	734281398	IUHYNDQXWDYURL-ZDUSSCGKSA-N	442.333	1.701	50	20	IDGD	
O=C(Cc1cccc2ccccc12)NNC(=O)N[C@@H]1CCN(CCN2CCOCC2)C1	734685783	HJKWZOYBSGQTGW-HXUWFJFHSA-N	425.533	1.119	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)CN2CCCCCCC2=O)CC1	734821282	IZXXOGCBOGBFQN-UHFFFAOYSA-N	425.530	1.509	50	20	IDGD	
COc1ccc(S(=O)(=O)C[C@H](C)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1	734990410	IXSGVYAECKMNDV-UGSOOPFHSA-N	434.470	1.092	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCc2cccc(-n3cncn3)c2)c2ccccc2c1=O	735584011	CBBZOIIPIQHVEU-UHFFFAOYSA-N	432.444	1.141	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)N[C@@H](C)C(=O)N2CCCC[C@H]2C)nc1	737048062	RSDNMGKSKTWWMA-KGLIPLIRSA-N	426.543	1.184	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)N[C@H](C)c2cn(C)nc2C)c2ccccc2c1=O	739035901	YQPFXXHZWNQMOJ-CYBMUJFWSA-N	425.493	1.944	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)[C@@H](C)Oc1cccc(Br)c1)CN1CCOCC1	739049573	PXWKTERJZZSWPI-ZIAGYGMSSA-N	443.342	1.515	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)NCc1cc(F)ccc1N1CCOCC1	741094244	XZFQJQIWTWXOAS-UHFFFAOYSA-N	446.479	1.970	50	20	IDGD	
Cc1nn(C)c2sc(C(=O)N[C@H](C)C(=O)NNC(=O)[C@@H]3COc4ccccc4O3)cc12	742033981	WVDQDBOGCHPIGF-ABAIWWIYSA-N	443.485	1.049	50	20	IDGD	
COc1cccc(OCc2nnc(SCC(=O)NNC(=O)c3cccc(C)c3)n2N)c1	742449693	MKMYWROQBSPYML-UHFFFAOYSA-N	442.501	1.441	50	20	IDGD	
N=C1NC(=O)[C@@H](CC(=O)NNC(=O)[C@@H]2Cc3ccccc3CN2Cc2ccccc2)S1	742600160	SSPZRFKPKSLWDO-ZWKOTPCHSA-N	437.525	1.317	50	20	IDGD	
O=C(NNC(=O)c1cccc(Br)c1)NC1CCN(C[C@@H]2CCOC2)CC1	743620082	AHODSYUZYIMTAI-ZDUSSCGKSA-N	425.327	1.894	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)CCNS(=O)(=O)/C=C/c2ccccc2)cc1	743826380	BSGFQCXVZYGRHU-FYWRMAATSA-N	431.518	1.886	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CN2CCN(Cc3nc(N)c4ccccc4n3)CC2)c1	744386070	YUDDOEOPOGXAQE-UHFFFAOYSA-N	433.516	1.099	50	20	IDGD	
Cc1ccc(N2C(=O)CC[C@@H](C(=O)NNC(=O)C(=O)NC3CC3)[C@H]2c2cccs2)cc1	744463538	KAEIRKQQSTYQJW-APWZRJJASA-N	440.525	1.967	50	20	IDGD	
CS(=O)(=O)N1CCC[C@@H](NC(=O)NNc2c(F)cc(F)cc2Br)C1	745777928	ZBMCYCIEJZZQAK-SECBINFHSA-N	427.271	1.777	50	20	IDGD	
O=C(NCCN1C(=O)CNC1=O)NNc1c(Cl)cc(Br)cc1Cl	745819080	WLKXXRNOLZGYNM-UHFFFAOYSA-N	425.070	1.934	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCC2(N(C)C)Cc3ccccc3C2)c2ccccc2c1=O	745842852	PYIFSYQFLYKFCK-UHFFFAOYSA-N	448.527	1.460	50	20	IDGD	
Cc1ccc(C)c(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)N3CCOCC3)cc2)c1	745992966	PTQVXKAOSZMLKF-UHFFFAOYSA-N	432.502	1.791	50	20	IDGD	
COc1cc(C)nc(NNC(=O)c2ccc(N3CCN(C(C)=O)CC3)c([N+](=O)[O-])c2)n1	746631437	ZVTFBGBNTAOQTB-UHFFFAOYSA-N	429.437	1.127	50	20	IDGD	
O=C(Cn1ccc([N+](=O)[O-])n1)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1	747778243	CTXNTBVUULTQSI-IBGZPJMESA-N	434.456	1.566	50	20	IDGD	
CCS(=O)(=O)N1CCN(C(=O)/C(C#N)=C/c2cc(C)n(C[C@@H]3CCCO3)c2C)CC1	748055254	OXNROXQSTDVMGG-ACSPXDACSA-N	434.562	1.685	50	20	IDGD	
C[C@H]1CCC[C@H](C)N1C(=O)COc1ccc(C(=O)NNC(=O)C(=O)N2CCCC2)cc1	748246600	MLXUEELHQAHIDL-HOTGVXAUSA-N	430.505	1.238	50	20	IDGD	
Cc1ccc(F)c(NC(=S)NNC(=O)CNC(=O)NCc2ccc([N+](=O)[O-])cc2)c1	748361002	YNGUAXSGMQXZLN-UHFFFAOYSA-N	434.453	1.859	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNS(=O)(=O)c2ccc(OCC(=O)O)c(Cl)c2)c1	748689918	QGZHBBIAIKFPCE-UHFFFAOYSA-N	444.849	1.444	50	20	IDGD	
Cc1cc(N2CCC(NC(=O)NNC(=O)Cc3nc4ccccc4n3C)CC2)nc(C)n1	749616457	OVGSQAVZOLNSMA-UHFFFAOYSA-N	436.520	1.522	50	20	IDGD	
COc1cc(CNC(=O)NNC(=O)CCc2ccccc2)ccc1OCC(=O)N(C)C	749928303	QACLVZMALNOKTA-UHFFFAOYSA-N	428.489	1.625	50	20	IDGD	
O=C(NNC(=O)[C@H]1CSCCS1)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	750983045	DLOYYFCUCXFCLG-QGZVFWFLSA-N	440.554	1.998	50	20	IDGD	
CC(C)Oc1cccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)n1	754827839	YDLHXZNNQVFDEO-UHFFFAOYSA-N	432.502	1.728	50	20	IDGD	
O=C(NCCN1C(=O)[C@@H]2[C@@H](C1=O)[C@H]1C=C[C@H]2C1)NNC(=O)Nc1ccc(OC(F)F)cc1	755261579	YLMMBFKQCKPCCL-GVARAGBVSA-N	449.414	1.431	50	20	IDGD	
CCOc1ccc(NC(=O)NNC(=O)c2c[nH]nc2C)cc1S(=O)(=O)N(CC)CC	755452348	ZINHKUFDFZHVJD-UHFFFAOYSA-N	438.510	1.614	50	20	IDGD	
Cc1nc2ccccc2n1C[C@@H]1CCCN1C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	756049078	COPHMDFVUOQOJS-SFHVURJKSA-N	445.487	1.839	50	20	IDGD	
COc1ccc2c(c1)C=C(C(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)CO2	756471887	URMTYVRZMMIQJF-UHFFFAOYSA-N	427.369	1.384	50	20	IDGD	
COCCS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1	756553923	NHFDHTHNABQFPG-UHFFFAOYSA-N	443.485	1.759	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)Nc1cc(Br)cn(C)c1=O	757597217	IMGVUJMTOQUIBN-SECBINFHSA-N	427.230	1.907	50	20	IDGD	
CS(=O)(=O)Cc1cc(F)ccc1NC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	757680232	ZGICVPQAJSWISE-UHFFFAOYSA-N	443.478	1.240	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1ccc(Br)c2ccccc12	757886439	BUFYTNGZEFKWJV-SECBINFHSA-N	429.296	1.693	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)N[C@H]2CN(C(=O)OC(C)(C)C)C[C@H]2C#N)c1	758755078	SKNSTDZISOXBFI-CJNGLKHVSA-N	433.465	1.407	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN2CC[C@@H](N3CC(=O)Nc4ccccc43)C2)cc1C	759895962	APWNYRCRMYRBMK-OAHLLOKOSA-N	441.557	1.913	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)c3ccc(I)c(O)c3)nc21	760867596	OICOKGLVHUEYRF-UHFFFAOYSA-N	426.174	1.136	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)[C@H](Cc1ccc(F)cc1)n1nnnc1C	762409748	RQQBXFHWGNICTD-INIZCTEOSA-N	444.492	1.853	50	20	IDGD	
CCN1CCN(Cc2ccc(NC(=O)C(=O)NNC(=O)c3c[nH]c4ccccc34)cc2)CC1	763536240	OFMNNUKPMGAUOX-UHFFFAOYSA-N	448.527	1.705	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)C(=O)Nc1cccc(NC(=O)c2ccoc2)c1	763549339	YBZBDEZAQWPTPA-UHFFFAOYSA-N	436.380	1.660	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cccc(S(=O)(=O)N3CCCC3)c2)c(C)o1	763580704	WTGPFUKFCBREQW-UHFFFAOYSA-N	434.474	1.081	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(Cl)c(C[S@@](C)=O)c2)c1	763630839	OMWAEIXCDWACGS-GDLZYMKVSA-N	437.905	1.692	50	20	IDGD	
Cc1ccc(C(F)(F)F)cc1NC(=O)C(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	763791498	UCSGLDUKVDWXPM-UHFFFAOYSA-N	447.373	1.660	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Br)s2)c(OC)n1	763940286	GNMIDVCGXKWUDF-UHFFFAOYSA-N	429.252	1.323	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)C(=O)Nc1cccc(C(=O)NCc2ccccn2)c1	763958166	RJQXBDWRDXLOSP-UHFFFAOYSA-N	431.452	1.720	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)Nc1ccc(C[C@@H]2CC(=O)NC2=O)cc1	763967647	LHDWWRIMMYGZMD-CYBMUJFWSA-N	428.470	1.542	50	20	IDGD	
CS(=O)(=O)CCOc1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)C1CCCC1	764069402	CACHRYVZWZWWBG-UHFFFAOYSA-N	431.898	1.040	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)c1	764078527	VPLVGFAKHLBDSJ-UHFFFAOYSA-N	440.821	1.051	50	20	IDGD	
O=C(NNC(=O)c1ccc(F)cc1Br)C(=O)Nc1ccc2nccnc2c1	764084831	IOAAMNYQDWEIAH-UHFFFAOYSA-N	432.209	1.931	50	20	IDGD	
CCOC(=O)c1cnn(-c2cccc(NC(=O)C(=O)NNC(=O)CC(F)(F)F)c2)c1C	764115758	UZNKJZMNRHZCOR-UHFFFAOYSA-N	441.366	1.396	50	20	IDGD	
O=C(CC1CC1)NNC(=O)C(=O)Nc1ccc(CCn2nnc(-c3ccccc3)n2)cc1	764144641	YSVNQQXPHWKFMN-UHFFFAOYSA-N	433.472	1.469	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)C(=O)Nc1cccc(-n2cccc2)c1	764203744	CALAVPYVRDDMPP-UHFFFAOYSA-N	429.477	1.868	50	20	IDGD	
CCOc1ccc(C(F)(F)F)cc1NC(=O)C(=O)NNC(=O)COc1ccccc1O	764278362	XEBHZASQHMVRNY-UHFFFAOYSA-N	441.362	1.975	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2cccs2)[nH]n1)C(=O)Nc1ccc(N2CCCC2=O)cc1	764382340	HGCPOCYPBQTAKS-UHFFFAOYSA-N	438.469	1.665	50	20	IDGD	
COC(=O)c1ccc(OC)cc1NC(=O)C(=O)NNC(=O)c1cc(-c2cccs2)[nH]n1	764382452	KPZJGUFBHFIVLL-UHFFFAOYSA-N	443.441	1.333	50	20	IDGD	
C[C@@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)CSc3ccccc3O)cc2)CCO1	764402345	ZKCCJPIJHRQKIF-CQSZACIVSA-N	444.513	1.496	50	20	IDGD	
Cc1cc(S(N)(=O)=O)cc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2F)c1C	764410535	QEYRPLDLCHVKSK-UHFFFAOYSA-N	442.856	1.143	50	20	IDGD	
O=C(NNC(=O)[C@H]1COCCO1)C(=O)Nc1cnccc1-c1ccc(C(F)(F)F)cc1	764432005	HYTVTMJLVVEEHA-OAHLLOKOSA-N	438.362	1.269	50	20	IDGD	
COc1ccccc1Oc1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2COCCO2)cc1F	764434691	RHEBBKDAKDXORN-KRWDZBQOSA-N	433.392	1.128	50	20	IDGD	
CC(C)NS(=O)(=O)c1cc(C(=O)NNC(=O)CSc2ccccc2O)ccc1F	765247928	ASCCJPXBNYYJND-UHFFFAOYSA-N	441.506	1.771	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)c1cc(O)nc2ccc([N+](=O)[O-])cc12	765321969	FRAZWBYTBVSYQD-UHFFFAOYSA-N	433.421	1.915	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3c4ccccc4C[C@H]3C)c2)n[nH]1	765587025	NHNCYEAKTLJPRC-CQSZACIVSA-N	439.497	1.933	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N2CC(O)(C(C)C)C2)cc1	765589276	LIEKSRVENGJENQ-LICLKQGHSA-N	437.500	1.570	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)C3CCCCCC3)CC2)cc1	765730849	XTHAXGDWRQSJAF-UHFFFAOYSA-N	436.578	1.419	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)CCc3cccc([N+](=O)[O-])c3)CC2)cc1	765753177	BPEVVCUTOKPFPE-UHFFFAOYSA-N	439.516	1.801	50	20	IDGD	
CC(C)(C)OC(=O)NCC1(CC(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)CCCCC1	766107687	VMIJKSWAIBGPKL-CQSZACIVSA-N	431.555	1.434	50	20	IDGD	
COc1cc(C(=O)N2CCN(CC(=O)NNC(=O)Cc3ccccc3C)CC2)ccc1C	766854162	RNTDYTRGMVZRDM-UHFFFAOYSA-N	438.528	1.460	50	20	IDGD	
COc1ccc(C(=O)OCC(=O)NNC(=O)Cc2ccccc2C)cc1N1CCNC1=O	767379494	YQTODEKDCVDECF-UHFFFAOYSA-N	440.456	1.080	50	20	IDGD	
C[C@@H](C(=O)OCC(=O)C(C#N)=C1N(C)c2ccccc2N1C)S(=O)(=O)C1CCOCC1	767495171	PFFPAKYDCOSIHO-AWEZNQCLSA-N	447.513	1.402	50	20	IDGD	
CC(C)c1ccc2c(c1)C(=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O)CCCO2	767763026	CVVFPZGOEPZKDC-UHFFFAOYSA-N	431.518	1.388	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)CN3C(=O)[C@@H]4[C@@H](C3=O)[C@H]3C=C[C@H]4C3)n[nH]2)c1	768264334	HPTLLTSIJYBOSB-FEBSWUBLSA-N	433.468	1.262	50	20	IDGD	
C[C@@H]1CN(C(=O)/C(C#N)=C\c2cn(CCC(N)=O)nc2-c2ccc(Cl)cc2)C[C@@H]1O	769128113	OAFWOOIGOAQZAY-NGCSTKRBSA-N	427.892	1.825	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)NCCN1C(=O)c2ccccc2C1=O	770315580	ILRAQGWTMLOJLS-LBPRGKRZSA-N	430.848	1.734	50	20	IDGD	
CC(=NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1)c1ccc(F)cn1	770616216	SMXUIKRQOQAIIJ-UHFFFAOYSA-N	433.509	1.376	50	20	IDGD	
CS(=O)(=O)c1cc(S(=O)(=O)NNC(=O)c2ccc3c(c2)OCO3)c(Cl)s1	770636976	YOCIBPSNMWMPRJ-UHFFFAOYSA-N	438.892	1.157	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)NCc1nc(COc2ccccc2)n[nH]1	771379292	UVUBSTZAZIIYFB-ZDUSSCGKSA-N	428.424	1.821	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@H]2CCO[C@@H](C)C2)c1	771434704	QUEAPNLFYXVSDV-GJZGRUSLSA-N	426.539	1.476	50	20	IDGD	
Cc1cc(S(=O)(=O)NCCNC(=O)NNC(=O)Cc2ccc(F)cc2)c(C)s1	772621842	AFVYSMYHCMOSAM-UHFFFAOYSA-N	428.511	1.355	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc2c(c1)CCN2C(=O)C(=O)NNc1nc(C)cc(C)n1	773481730	VIPGEQKZVQFPLP-UHFFFAOYSA-N	446.533	1.156	50	20	IDGD	
COc1ccc(C(=O)N2CCCC2)cc1NC(=O)C(=O)NNc1ccccc1[N+](=O)[O-]	773653566	AVPZLOFVQZJRLG-UHFFFAOYSA-N	427.417	1.921	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)[C@H](c2cnn(C)c2)N(C)C(=O)OC(C)(C)C)c1	776314616	LLEBQFGKDJYITN-SFHVURJKSA-N	431.493	1.863	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCN(C(=O)OC(C)(C)C)[C@H](C)[C@@H]2C)n1	776607337	STQNDQZIQRFQJV-UONOGXRCSA-N	425.555	1.471	50	20	IDGD	
CC(C)CS(=O)(=O)N1CCC(NC(=O)NNC(=O)Nc2ccc(N(C)C)cc2)CC1	777765414	PEFQHCGGZIYZQT-UHFFFAOYSA-N	440.570	1.539	50	20	IDGD	
O=C(c1cccc(Br)c1)N1CCN(S(=O)(=O)CBr)CC1	777777489	JSTIUWJUKKXMQV-UHFFFAOYSA-N	426.130	1.889	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)c1oc2ccccc2c1CS(C)(=O)=O	778445793	QUHAROWTSIGMDJ-UHFFFAOYSA-N	425.463	1.263	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H]1C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	780842280	UXSZTRJSEYOZHE-OAHLLOKOSA-N	440.522	1.160	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N[C@@H](C)c2ncn(C)n2)cc1	781392466	MMTONQSANGBJSP-KNGSKEOJSA-N	448.487	1.347	50	20	IDGD	
O=C1C[C@@H](Cc2ccc(NC(=O)C(=O)NNc3ccc(Br)cc3)cc2)C(=O)N1	783008993	BICPDYVEWGJDKU-GFCCVEGCSA-N	445.273	1.736	50	20	IDGD	
CNC(=O)COc1ccc(NC(=O)C(=O)NNc2ccc(Br)cc2F)cc1	783085141	BWHKKXVIVFGTOM-UHFFFAOYSA-N	439.241	1.795	50	20	IDGD	
COC(=O)c1cc(OC)c(OC)cc1NC(=O)C(=O)NNc1ncnc2ccsc12	783253704	RJXKNHRSZFAQAZ-UHFFFAOYSA-N	431.430	1.577	50	20	IDGD	
CN1CCC/C1=N/S(=O)(=O)c1ccc(NC(=O)C(=O)NN(C)c2ccccc2)cc1	783424492	FRVWKIYOQXOXNU-NKFKGCMQSA-N	429.502	1.606	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2ccnc(Oc3ccccc3Cl)c2)CCS(=O)(=O)C1	783425880	JLVMJUABKKJOTC-GOSISDBHSA-N	438.893	1.664	50	20	IDGD	
COc1cccc(NNC(=O)C(=O)Nc2cc(Cl)ccc2OCCS(C)(=O)=O)n1	784842625	RGEXTXYJUKRNHA-UHFFFAOYSA-N	442.881	1.249	50	20	IDGD	
C[C@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(NC(=O)C(=O)NNc3ccnc(F)c3)cc2)C1	784848677	LEJNPOFUHGVEIF-OKILXGFUSA-N	449.508	1.969	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccccc3C(=O)N(C)C)n[nH]2)c1	785126989	XMUYKRAJALUCIS-UHFFFAOYSA-N	448.483	1.795	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)N1C[C@H]2CCCN2c2ccccc21	785330779	LZNKFWJJRHDKHW-CQSZACIVSA-N	444.513	1.557	50	20	IDGD	
CC(C)CN1C[C@H]2CN(C(=O)NNC(=O)c3cccc(Br)c3)CCN2C1=O	787858507	COHMYTRHVOLXJU-OAHLLOKOSA-N	438.326	1.881	50	20	IDGD	
CC[C@@H]1CCc2nc(NC(=O)C(=O)NNC(=O)[C@H]3COc4ccccc4O3)sc2C1	789731199	BFKNKQWLDFUGPP-IAQYHMDHSA-N	430.486	1.584	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)c1ccnn1CC(F)F	789990509	KGDDGFNUOMWZEA-UHFFFAOYSA-N	440.882	1.380	50	20	IDGD	
Nc1c(Cl)c(Cl)nc(C(=O)NNS(=O)(=O)c2cnn(CC(F)F)c2)c1Cl	790045085	JKKWZFCPGUMZTC-UHFFFAOYSA-N	449.654	1.709	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1cc(Br)c(N)c(Br)c1	791482505	LRHHBCKEFCYOIG-LURJTMIESA-N	437.088	1.897	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)c1ccc(Br)cn1	792772386	IHERRAODPIHHMB-JTQLQIEISA-N	431.254	1.525	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)C(=O)Nc1cccc(F)n1	793022411	XHSIEJFHXGHWIW-SECBINFHSA-N	425.214	1.537	50	20	IDGD	
CC[C@@H](C)CC[C@@H](O)CC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	793710421	LVQVFTFGMABFNQ-SJLPKXTDSA-N	426.583	1.643	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)[C@@H]1[C@H]2CN(C(=O)OC(C)(C)C)C[C@H]21	794183342	ROBCGTDNRKUAEW-BDQBCWGISA-N	427.505	1.859	50	20	IDGD	
O=C(Cc1ccc(Cl)cc1)NNC(=O)NCCNS(=O)(=O)c1ccc(F)cc1F	799669458	SBYXZVACXBBQNQ-UHFFFAOYSA-N	446.863	1.470	50	20	IDGD	
O=C(CN1C(=O)N[C@]2(CCc3ccccc32)C1=O)NNC(=O)Nc1ccc(Cl)cc1	802016551	GASCLHBPECIBEI-FQEVSTJZSA-N	427.848	1.886	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)N1CCC(c2nnc3n2CCN(C(=O)OC(C)(C)C)C3)CC1	802023643	RFOLZAGVCFJTBD-AWEZNQCLSA-N	449.556	1.154	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)cc1NS(C)(=O)=O	802066539	QMQDPHXQHIOJNG-UHFFFAOYSA-N	440.503	1.237	50	20	IDGD	
COc1ccc(Cl)c(NC(=O)NNC(=O)c2cccc([C@]3(C)NC(=O)NC3=O)c2)c1	802114722	DEQWRMVNHUBAJT-IBGZPJMESA-N	431.836	1.870	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)F)cc1)C(=O)Nc1ccc(OC(F)F)nc1	802564104	DOZTWYNUZKIBOG-UHFFFAOYSA-N	436.343	1.761	50	20	IDGD	
Nc1cc(I)cc(C(=O)OCC(=O)NNC(=O)c2ccccc2)c1	803851517	MFRPRNWVMQSJMP-UHFFFAOYSA-N	439.209	1.491	50	20	IDGD	
CCCN(NC(=O)C1CCN(S(=O)(=O)c2cn(C)c(C)n2)CC1)C(=O)OC(C)(C)C	804595167	KRHCADATHPDBSY-UHFFFAOYSA-N	443.570	1.808	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN([C@H]2CCN(C(=O)NNC(=O)c3ccc(C#N)cc3)C2)CC1	805026190	GIFMARJQKZDWKU-SFHVURJKSA-N	442.520	1.540	50	20	IDGD	
COC(=O)CC[C@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)c1cc(Cl)ccc1O	806354280	CZVPPCONELOYHD-LBPRGKRZSA-N	429.857	1.653	50	20	IDGD	
Cc1c(C(F)(F)F)nn(C)c1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccc(F)cc1	806975420	YEZZTGVONIJHIE-VIFPVBQESA-N	431.346	1.440	50	20	IDGD	
Cc1ccc(C)c(S(=O)(=O)Nc2ccccc2C(=O)NNC(=O)N2CCN(C)CC2)c1	807380811	RFYFYVFLNOMYFT-UHFFFAOYSA-N	445.545	1.706	50	20	IDGD	
CCCN(NC(=O)CNS(=O)(=O)c1ccc2c(c1)OCCCO2)C(=O)OC(C)(C)C	807703130	SUGQQVHLUACJIO-UHFFFAOYSA-N	443.522	1.805	50	20	IDGD	
O=C(NNC(=O)C1(S(=O)(=O)c2ccccc2)CCOCC1)c1c[nH]c2ccccc12	809145233	ZJFJRGZAKXFKAB-UHFFFAOYSA-N	427.482	1.952	50	20	IDGD	
CN1CC(=O)N(c2cccc(NC(=O)NNc3ccc(S(=O)(=O)N(C)C)cc3)c2)C1=O	812924009	ZACCWDSSRXIAAM-UHFFFAOYSA-N	446.489	1.484	50	20	IDGD	
Cc1nn(C)c2cc(NC(=O)C(=O)NNC(=O)c3nn(-c4ccccc4)cc3O)ccc12	812979673	ZWCNVXAPZNZHBV-UHFFFAOYSA-N	433.428	1.173	50	20	IDGD	
COC(=O)CCc1cccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)c1	813033427	SCFMTDRATCAALL-UHFFFAOYSA-N	448.501	1.124	50	20	IDGD	
COCc1cc(NC(=O)C(=O)NNC(=O)COc2ccc(C)c(C)c2)cc(C(=O)OC)c1	815565439	NYAOMYGHPBBVIU-UHFFFAOYSA-N	443.456	1.401	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)cc(OC)c1C	815565723	XTXXMAOGQAFSBI-UHFFFAOYSA-N	426.473	1.551	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)C(C)(C)O)c([C@@H]2CCCN(C(=O)OCc3ccccc3)C2)n1	816360488	VUYVPOCZFYJIJH-MRXNPFEDSA-N	443.504	1.468	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)c2ccc(S(=O)(=O)N(C)C(C)C)cc2)c1	825811179	ZRYLMJFLGGXEOS-UHFFFAOYSA-N	434.518	1.597	50	20	IDGD	
O=C(COC(=O)c1ccc(OC[C@H]2CCCO2)cc1)NNC(=O)c1ccc([N+](=O)[O-])cc1	844160432	RQVWFUKDTKHVKM-GOSISDBHSA-N	443.412	1.771	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2ccccc2NC(=O)CC(C)C)n1	904224500	AFMVFPFIJSOATB-UHFFFAOYSA-N	432.502	1.983	50	20	IDGD	
N#Cc1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2cc3c(s2)CCCCC3)cc1	913404241	QLXXAUQCVTUUHB-UHFFFAOYSA-N	432.527	1.628	50	20	IDGD	
COc1ccnc(NNC(=O)c2ccc(S(=O)(=O)NCCc3cccs3)cc2)n1	914763578	VFAZPQXZDDIJLL-UHFFFAOYSA-N	433.515	1.825	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)c2ccc(S(=O)(=O)N(C)C)o2)cc1	914838609	YLYUVZFTRRXOTJ-LBPRGKRZSA-N	425.463	1.157	50	20	IDGD	
O=C(COC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccccc2)C1)NNC(=O)c1ccccc1	915394489	MMCYKIGCLLMPHZ-QGZVFWFLSA-N	445.497	1.092	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)[C@H](Cc2ccc(F)cc2)n2nnnc2C)c1	915691084	KKZHHONZIDSMRI-SFHVURJKSA-N	428.424	1.383	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)NC[C@@H](c2cccs2)N2CCOCC2)cc1C	915893246	HELWKEXIWQOUNH-KRWDZBQOSA-N	445.545	1.707	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCc2ccc(C(=O)N(C)C)cc2)nc1	916249957	GJPCFYNHZUOTTO-UHFFFAOYSA-N	434.522	1.296	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)C(=O)NC1CC1)c1cccc(NC(=O)Cc2ccccc2F)c1	916491968	OHXNFJQZSNEZDV-CYBMUJFWSA-N	441.463	1.677	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NCCN1CCN(c2ccccc2)CC1	916515068	ZVEMNHBFBMAQMI-QGZVFWFLSA-N	429.496	1.746	50	20	IDGD	
O=C(CCn1cccn1)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	918198948	LILCWMYYRUXOML-UHFFFAOYSA-N	427.486	1.213	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)Cc2ccc(C(=O)NNC(=O)c3cnsn3)cc2)cc1	918292428	JEKHJSLIHLJNSA-UHFFFAOYSA-N	445.526	1.742	50	20	IDGD	
O=C(NNC(=O)C1C[C@H]2CCC[C@H](C1)C2)c1cccc(S(=O)(=O)N2CCOCC2)c1	1116791889	UCPANVTUORQSLA-HOTGVXAUSA-N	435.546	1.685	50	20	IDGD	
C[C@H](C(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1)n1nnc(-c2ccccc2)n1	1322170025	PPLBIYICWIBLAO-CQSZACIVSA-N	443.508	1.696	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)Nc2ccnn2C[C@H]2CCOC2)c2ccccc2c1=O	1324159737	QDWNQTKPSUXQJI-CQSZACIVSA-N	439.476	1.677	50	20	IDGD	
CN1CCCn2nc(C(=O)N3CC[C@H]4OCCC[C@@]4(CNC(=O)[C@@H](F)Cl)C3)cc2C1	1778029474	MUSDKBOBMHHFNS-MBOZVWFJSA-N	441.935	1.381	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C1=CCCC1)C2	1778091120	HGVONCMIOWVRPN-LVGVVDSRSA-N	441.532	1.745	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)COC(=O)C(F)(F)F)C2)C1	1778899089	ZKNMLYSRLRXLSZ-UONOGXRCSA-N	435.226	1.158	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc([N+](=O)[O-])cc4c3OCC4)C2)C1	1780093098	BETGKWBTCAXFNK-OXQOHEQNSA-N	437.880	1.991	50	20	IDGD	
COc1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)CCBr)C3)nn1C	1780241113	MMKYQRZKIMYBEQ-RDTXWAMCSA-N	443.342	1.341	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3cccc(Cl)c3)C2)C1	1780630083	YMUBOAYDOYBGJN-OAQYLSRUSA-N	443.891	1.096	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@](C)(Cl)CCl)C1	1780714793	IQRLLODNWOZOLT-UTJXIGIESA-N	429.772	1.990	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCn1cncn1)C2	1780715537	RFZXMFGFQFHPJJ-ZTFGCOKTSA-N	432.352	1.418	50	20	IDGD	
O=C(CC12CCCN1CCC2)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1781137552	UQDROLARYPQXKY-MAUKXSAKSA-N	432.334	1.525	50	20	IDGD	
O=C([C@H](F)Br)N1CC[C@]2(C1)CN(C(=O)[C@H]1CCc3ccccc3O1)CCO2	1781332800	FNMHPOALSHCWGP-GJYPPUQNSA-N	441.297	1.901	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)Br)C2	1781516990	YSYRIVVSNZBBOB-HNSFDTNUSA-N	449.342	1.845	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(CCN(C(=O)c3ccccc3-n3nccn3)C2)C1	1781839755	NMELQRJUOPBQHX-OAQYLSRUSA-N	443.580	1.562	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H]1Cc3ccccc3O1)C2	1782176161	WXZRAMXJTZPQJD-OSGXGRJZSA-N	436.936	1.758	50	20	IDGD	
O=C1CCc2ccc(C(=O)N3CC[C@@]4(C3)CN(C(=O)C(Cl)Cl)CCO4)cc2N1	1782515018	PYILVGZGRZUWBE-LJQANCHMSA-N	426.300	1.819	50	20	IDGD	
C[C@H](Cn1ccnc1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCBr)C2	1782542834	AFAVFZUPTSMMGR-GPMSIDNRSA-N	441.370	1.818	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cnc(OCF)cn3)CCO2)C1	1783343898	KVBZPYUGEPAKMD-SJCJKPOMSA-N	445.289	1.399	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)CCc3ccc(F)nc3)CCO2)C1	1783530470	YWIWWZZMNCMFSG-SCLBCKFNSA-N	428.302	1.767	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc4c(c3)OCCO4)CCO2)C1	1783534879	QMRVTIBLBWVIKW-YJYMSZOUSA-N	439.306	1.685	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)CCO2)C1	1783537980	VDEAYCOSYHKGEI-GTNSWQLSSA-N	442.266	1.527	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)Cc3ccc(NC(C)=O)cc3)CCO2)C1	1783875823	UEQZFQDPNDRNSA-WIYYLYMNSA-N	437.924	1.271	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CSC3CCCC3)[C@H]2C1	1784464518	SOIQJDLLMZWFBD-SZMVWBNQSA-N	440.610	1.015	50	20	IDGD	
Cc1nn(C)c(C)c1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]21	1784702861	RPTAVIWQNGQMIA-XLPNERPQSA-N	431.364	1.867	50	20	IDGD	
COc1cc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)cc(OC)c1C	1785173795	WCZATKCYMCPHND-MGPUTAFESA-N	426.897	1.055	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)Cc3ccc(F)cc3OC)C2)C1	1785660246	GSPYXCSTHYWOCP-UZLBHIALSA-N	428.888	1.461	50	20	IDGD	
CN(C)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21	1785758544	MDMMFKJSSSXJJW-MZGVZZPPSA-N	443.317	1.431	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3[nH]nc4ccncc34)[C@H]2C1	1787341525	PAZRBOWUJDSDGJ-KNNTWTGDSA-N	440.331	1.788	50	20	IDGD	
Cc1cnn([C@@H](C)C(=O)NC2(c3ccc(NC(=O)c4cccc(B(O)O)c4)cc3)CCC2)c1	1788149240	FQYJQZBXBGNVOR-KRWDZBQOSA-N	446.316	1.880	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc4cn[nH]c4cn3)[C@H]2C1	1788468246	YWXSHNCOWWQIDW-YEWWUXTCSA-N	431.569	1.403	50	20	IDGD	
Cn1ccc(C(=O)NC2(c3ccc(NC(=O)c4cnccc4C(=O)NN)cc3)CCC2)n1	1789521075	DNPUHARLOCVTJX-UHFFFAOYSA-N	433.472	1.480	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)COC(=O)C(F)(F)F)C[C@@H]21	1789868103	MREQLCJGDPFDKS-VEABSNGSSA-N	449.253	1.308	50	20	IDGD	
Cc1ccccc1CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]21	1790938647	SASFBVLMEPXWRG-ACRUOGEOSA-N	444.576	1.280	50	20	IDGD	
CCN(C)[C@H](C)C(=O)Nc1ccc(C2(NC(=O)c3cnccc3C(=O)NN)CCC2)cc1	1791018114	ZGNYNIWOWRKQJG-OAHLLOKOSA-N	438.532	1.773	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccn4cncc34)C[C@@H]21	1791055828	IZSPBAXVTOZYBJ-RMRKRWHISA-N	435.322	1.711	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cn4c(F)cccc4n3)C[C@@H]21	1791257184	SHBAAOHHZHBESB-AYDFFVQHSA-N	438.887	1.321	50	20	IDGD	
CCNC(=S)NCC(=O)NC1(c2ccc(NC(=O)[C@H](Cl)COC)cc2)CCC1	1791570737	CEHQIBQMEOVCRK-OAHLLOKOSA-N	426.970	1.858	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1(C(F)(F)F)CC1)C2	1792871441	YTCDKVLUCFBDGK-YFKTTZPYSA-N	427.261	1.950	50	20	IDGD	
CC(C)(C)OC(=O)N1CCO[C@H](C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](F)Cl)C3)C1	1793241576	JWHKUDCLUVSIHF-AICCOOGYSA-N	433.908	1.795	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cn2nc(C)sc2n1	1793660813	WQNRIUZCSGBDJL-IARIHHJXSA-N	439.969	1.639	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H]1C=C[C@@H](C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](O)CCl)C3)C1	1794138250	WBSIFNNGYNXQMO-PHPOFCCKSA-N	441.956	1.694	50	20	IDGD	
Cn1nncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1794141070	JGXOEZRVZAVXOF-CRWXNKLISA-N	440.932	1.199	50	20	IDGD	
Cc1ccccc1NCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2	1795697998	VCYAUMZJAQSHJI-DLTLXFJOSA-N	428.302	1.687	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2)c1ccnc2ncccc12	1799975747	HADHVKQSXJQGAA-FVCICTRLSA-N	433.306	1.618	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](F)Br)[C@@H]1CC[C@H]2CCC(=O)N2C1	1800161669	CGRSFTZOVOVSLO-DKTZCXADSA-N	430.318	1.716	50	20	IDGD	
COC(=O)Nc1cccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CCC(=O)NN(C)C)C3)c1	1800269442	AHDGGWUWBKLZLP-BCDXTJNWSA-N	445.520	1.490	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=N/N1CCCCC1)C2	1800641682	HAWBAFWFPCSDQD-UIARLXCXSA-N	429.359	1.221	50	20	IDGD	
COC(=O)CCCCCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2	1801072429	LFEYLTBHOPHEOJ-ZSBFGKGUSA-N	433.343	1.485	50	20	IDGD	
COCCOCCOCCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CO[Si](C)(C)C)C2	1802083484	YWESTIPKYIRBMS-BCDXTJNWSA-N	430.618	1.546	50	20	IDGD	
CC(C)Cc1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CCC(=O)NN(C)C)n(C)n1	1802332458	BUCMHYLBCBFWBF-VBUUOAMHSA-N	432.569	1.243	50	20	IDGD	
COc1ccc(CC(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)cc1O	1803136905	GCTMTHXYTYEHJQ-MMOPVJDHSA-N	447.919	1.644	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CNc2ccc(F)cc2)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803138620	LOXVHTWMBGFXOC-ZAAXVRCTSA-N	434.899	1.938	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cnc3[nH]ncc3c2)[C@H]1c1cccnc1)[C@H](O)CCl	1803143123	UTBVDCOWBLXWBY-XKQJLSEDSA-N	428.880	1.272	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)CC(=O)NC)[C@H]1c1cccnc1	1803483244	ULQYJLSSSLGAJR-GRDNDAEWSA-N	425.327	1.397	50	20	IDGD	
Cc1cncc(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)c1	1807369305	FNEVNSZVNAHYAR-UGKGYDQZSA-N	444.300	1.098	50	20	IDGD	
O=C(/C=C/C1CCCC1)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1808482435	WWQZIUVRWGLFTC-LSTWCFQCSA-N	447.344	1.827	50	20	IDGD	
COC[C@H](NC(C)=O)C(=O)N1CCC2(CCCN(C(=O)CCBr)C2)CC1	1809067384	XVANNAOLNOESCG-HNNXBMFYSA-N	432.359	1.154	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2cccc(C#N)c2)[C@@H]1c1cccnc1	1811797308	WTMJJKTYPABIML-REWPJTCUSA-N	448.527	1.646	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)c2nc[nH]c2[N+](=O)[O-])[C@@H]1c1cccnc1)C(Cl)Cl	1813080074	MJQPWNBBGDEGHJ-ZYHUDNBSSA-N	427.248	1.836	50	20	IDGD	
C[C@]1(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)CC1(F)F	1814073365	BWWHZRKHGSNZTH-HGHGUNKESA-N	443.259	1.126	50	20	IDGD	
CC(C)(CCl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc3n(n2)CCNC3=O)[nH]n1	1814695634	XMTKKFPTUXJPMQ-CQSZACIVSA-N	447.927	1.921	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1CCc2nc(NC(=O)Cn3cncn3)sc2C1	1815657535	XGXMKVAXTGHFLY-NXEZZACHSA-N	427.328	1.378	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](N)Cc2cccnc2)n[nH]1	1818073707	YNYVPIBWFSVFDM-VYDXJSESSA-N	434.928	1.621	50	20	IDGD	
Cc1cc(CC(=O)Nc2cc([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)n[nH]1	1819500238	DPSGRIOPMQSWBN-MRXNPFEDSA-N	430.513	1.049	50	20	IDGD	
C/C=C/C=C\C(=O)N[C@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1	1819800310	MVCVUDIXFPIQAT-GSTVFTAWSA-N	426.502	1.500	50	20	IDGD	
CCc1cc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)CCC(=O)NN(C)C)CC3)no1	1820743584	DRJPFQLMKRECJD-NSHDSACASA-N	434.522	1.292	50	20	IDGD	
CC[C@@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1820857094	YNUFCSRKGAMIGN-UKRRQHHQSA-N	433.900	1.732	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)Cc2cccnc2)[nH]n1	1822414345	RYRJFSHQQQOMOR-KRWDZBQOSA-N	427.509	1.413	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)Cc3c(C)n[nH]c3C)sc2C1	1823131835	CIISPYVKJVBNGZ-DGCLKSJQSA-N	425.942	1.892	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H](N)CCC(N)=O)CC1	1824093572	OIZJLSCKYABHPD-CWRNSKLLSA-N	445.402	1.230	50	20	IDGD	
CCS(=O)(=O)CC(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCBr)CC1	1824465505	IYPMQVJZRDOUIR-OAHLLOKOSA-N	437.400	1.826	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)Cc1nnc(C)s1)CC2	1825998728	JBDWEXUPJOXZOE-VHSXEESVSA-N	429.955	1.712	50	20	IDGD	
COC1(CC(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)CCC1	1827054451	FRSRTBLIDQRVID-NRFANRHFSA-N	442.365	1.559	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)cn1C	1827869063	LKCRVXLHOXOQCU-FQEVSTJZSA-N	431.581	1.940	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccc(F)cn3)C2)C1	1830357841	LMGGHDNPCJIJIQ-HXUWFJFHSA-N	427.904	1.485	50	20	IDGD	
O=C(C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1)c1ccc(Cl)cc1	1830686648	NBRYPWLUBAHQJU-QAPCUYQASA-N	433.263	1.514	50	20	IDGD	
CC(=O)N/C(C)=C/C(=O)N1CCCC[C@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1	1831081402	AGXIHNRSJPMNFK-VVLLFNJHSA-N	435.569	1.019	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)C(=O)OCC)C2)C1	1831659292	QGUODYRJIRLFGS-YWZLYKJASA-N	432.945	1.440	50	20	IDGD	
C[C@@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1)n1cccn1	1832239409	FTPJVOWZJDQIEO-HKUYNNGSSA-N	432.569	1.437	50	20	IDGD	
C[C@H](C(=O)NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1)n1ccnc1	1833378114	DQGRIGHQWCLWDI-CZUORRHYSA-N	444.349	1.706	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccn(C)c3)CCO2)C1	1833847753	JRSAWKLSADNZSW-KDOFPFPSSA-N	428.327	1.126	50	20	IDGD	
CC(=O)C(C)(C)C(=O)N1CCC(N2CCC(NC(=O)CCBr)CC2)CC1	1834422330	IBXWKYQRSFEPAS-UHFFFAOYSA-N	430.387	1.958	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC(N2CCC(NC(=O)Cn3ccccc3=O)CC2)CC1	1834824308	RHTSCLSKDVKQSL-UHFFFAOYSA-N	448.640	1.271	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CCNC(C)C)CCO2)C1	1835888915	BWLVVSZWRAOZLL-CRAIPNDOSA-N	434.375	1.004	50	20	IDGD	
CCc1noc(C)c1C(=O)NC1CCN(C2CCN(C(=O)[C@@H](Cl)COC)CC2)CC1	1835963387	NUKDGXPLRPDRGZ-KRWDZBQOSA-N	440.972	1.984	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccsc3)CCO2)C1	1836095008	NQWZUORPIYOQLJ-RDTXWAMCSA-N	445.379	1.778	50	20	IDGD	
CCn1nc(C)cc1C(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836717558	FLJMMRIXNYJSBT-SFHVURJKSA-N	426.945	1.423	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc3cncn3c1)CCO2	1837122296	FVWQGMMHYLNSIM-NRFANRHFSA-N	446.580	1.256	50	20	IDGD	
O=C(c1csc(C(F)(F)F)n1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1838189329	LKMKBJNPVSMJRJ-HZMBPMFUSA-N	445.822	1.766	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3ncccc3OC)C2)C1	1839142095	DSXLBJHGRQAPIS-KKSFZXQISA-N	439.940	1.497	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C1(C(=O)OCC)CC1)CCO2	1839760035	ZESSHGFHBBGQNL-DNVCBOLYSA-N	430.929	1.194	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(F)cc(F)c3)C2)C1	1840034358	ISGWOWJGTJRMAV-XIKOKIGWSA-N	447.276	1.818	50	20	IDGD	
CC(C)c1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)n[nH]1	1840034462	MFFCJILDHMIHGI-UGSOOPFHSA-N	443.342	1.387	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(C)c(F)c3)C2)C1	1840154217	PMIDIXUWBIRSGM-JXFKEZNVSA-N	428.888	1.458	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(OC)ccc3F)C2)C1	1840156146	JFBPHYCSCKXHGQ-UZLBHIALSA-N	444.887	1.158	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(C)cc3O)C2)C1	1840156635	RHPGGVDWOMIONI-JXFKEZNVSA-N	426.897	1.024	50	20	IDGD	
C[C@H](Cc1ccco1)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1840471696	HBUQSFQSZDCLGF-DDUZABMNSA-N	447.301	1.605	50	20	IDGD	
COc1cc(Cl)cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)c1	1840742455	UQJGTXROLRBKSD-YJBOKZPZSA-N	435.279	1.953	50	20	IDGD	
COC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)CCBr)C1	1842638234	CSBAYOYDSFGCSR-ZDUSSCGKSA-N	448.358	1.515	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@](C)(C(=O)N2CCCC23CN(C(=O)[C@@H](O)CCl)C3)C1	1843867223	HZLRFWBXSQWJJQ-IFXJQAMLSA-N	429.945	1.437	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CCCC23CN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C3)o1	1844261619	HDFZIJNKSKZGNB-ZMOGYAJESA-N	440.460	1.189	50	20	IDGD	
C[C@@H](Cc1ccc(F)cc1)C(=O)N1CC2(CCCN2C(=O)c2cnccc2C(=O)NN)C1	1844264939	AGOXTCWYNVWWTM-HNNXBMFYSA-N	439.491	1.520	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)[C@@H]2[C@@H]3Sc4ccccc4[C@H]32)C1	1844275955	WHWUREVMCFFAPE-SLFFLAALSA-N	428.558	1.451	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1O)C2	1845162934	VXTVYYVCKKJXFF-PMPSAXMXSA-N	443.972	1.825	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)c2cncc(O)c2)C1	1846219574	GVSULWUMXUHQGX-UHFFFAOYSA-N	440.412	1.752	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)c1ccc(N3C(=O)C=CC3=O)cc1)C2	1846365342	OPGZLAKWSFKVSG-INIZCTEOSA-N	431.876	1.187	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)C1CN(C(=O)c2ccccc2OC)C1	1847456628	RDUANGMGZZQGLH-BZSNNMDCSA-N	433.936	1.986	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@]2(C[C@@H]2C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](O)CCl)C1	1847564137	RMAIWOVBFDKKDL-HJFIXNJZSA-N	441.956	1.435	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H]1C[C@H]1c1ccc(F)c(F)c1	1847606279	LWHGXFRSGWMQCL-JWWGGVBKSA-N	440.255	1.264	50	20	IDGD	
Nn1c(SCC(=O)NNC(=O)c2ccccc2)nnc1-c1ccc(OC(F)F)cc1	3534978	WVKAXKHSIKPJRM-UHFFFAOYSA-N	434.428	1.814	50	20	IDGD	
Cc1nnc(NNC(=O)c2csc(S(=O)(=O)N3CCc4ccccc4C3)c2)[nH]c1=O	11548560	GRSDYFFUDDOQPC-UHFFFAOYSA-N	446.514	1.039	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)c1cc(Cl)c(OCC(N)=O)c(OC)c1	14317374	JAIVFCGCFAEWII-UHFFFAOYSA-N	437.836	1.061	50	20	IDGD	
Cc1cc(OCc2ccc(C(=O)NNC(=O)Cn3ccc(=O)[nH]c3=O)cc2)ccc1Cl	26774346	KUYVUOPYLPEWIG-UHFFFAOYSA-N	442.859	1.539	50	20	IDGD	
CS(=O)(=O)NCCc1ccc(C(=O)NNC(=O)c2cc(-c3ccccc3)on2)s1	27264422	ZPVSSCSPCANMRL-UHFFFAOYSA-N	434.499	1.570	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)N2CCN(c3ccc(C(N)=O)cn3)CC2)c1C	725885271	VMPGLAFVVVVLQZ-DEDYPNTBSA-N	436.516	1.501	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	726151575	GZCXXVKOLBZYES-UHFFFAOYSA-N	434.902	1.053	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NNC(=O)c2ccc(Br)s2)cc1	726196596	ZPDJALDABLIIIG-JTQLQIEISA-N	446.348	1.947	50	20	IDGD	
C[C@]1(c2ccc(CNC(=O)NNC(=O)c3ccc4ccccc4n3)cc2)NC(=O)NC1=O	726282557	OTBXBQQLVNZNNJ-JOCHJYFZSA-N	432.440	1.434	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)[C@H]3CCCOC3)c2)cc1	727722290	ICZCGJMBWQDZON-HNNXBMFYSA-N	433.486	1.684	50	20	IDGD	
Cc1ccccc1CN1CCCN(CC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)CC1	727827740	FNACRSROWFVAML-UHFFFAOYSA-N	425.489	1.872	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CC(=O)N(Cc2ccccn2)C1)c1cc(F)ccc1Br	728550005	WXRNZPCWPIHCJB-LLVKDONJSA-N	435.253	1.793	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(C(=O)NCC(=O)NNC(=O)CC(C)(C)C)cc1	728607544	AGRWWGMEYQOCHE-UHFFFAOYSA-N	426.539	1.031	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)cc(Cl)c1OCCC(C)C	729277322	ZBRPLUGHLOHRSR-NSHDSACASA-N	435.930	1.472	50	20	IDGD	
CC[C@H](N=c1nn[nH]n1-c1ccccc1)C(=O)NNC(=O)[C@@H](C)Oc1cccc(C)c1C	729282718	GSUCSPQJEXCKLW-AEFFLSMTSA-N	437.504	1.506	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)NCc2nc(C)no2)cc1	729329621	VPWRJRGPRKDJCU-DHDCSXOGSA-N	435.444	1.349	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	729510760	LIHWZICRDFDPFU-UHFFFAOYSA-N	433.428	1.208	50	20	IDGD	
Cc1nc2c(c(O)nn2C)c(C)c1CC(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	729513083	VGTISXMUZGFEGV-UHFFFAOYSA-N	435.444	1.186	50	20	IDGD	
CC(C)(C)C(=O)N1CSC[C@@H]1C(=O)NNC(=O)COc1ccc(Br)cc1	730073912	RGQXDHJBUAFJTP-CYBMUJFWSA-N	444.351	1.923	50	20	IDGD	
C[C@H]1CCCN(S(=O)(=O)c2cc(C(=O)NNc3nc(-c4cccnc4)no3)n(C)c2)C1	730283998	BCQRALNMBOULQZ-ZDUSSCGKSA-N	445.505	1.648	50	20	IDGD	
CCOC(=O)C1=NN(c2ccccc2)[C@H](C(=O)NNC(=O)COc2ccccc2O)C1	730835942	NECQTVXMHNUGHX-INIZCTEOSA-N	426.429	1.116	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)c2nnn(-c3ccc4c(c3)OCCO4)c2C)cn1	731501564	WYMLGZFUQDHKQE-UHFFFAOYSA-N	441.473	1.382	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)NC2CCN(CC(=O)N(C)C)CC2)cc1OC	731762016	VZHNVNQWHKATRG-UHFFFAOYSA-N	449.552	1.371	50	20	IDGD	
CSCC[C@H](C(=O)NNc1nc(-c2cccnc2)no1)N1C(=O)[C@H]2CCCC[C@@H]2C1=O	732110809	OPLJAHMDZFDLEW-SOUVJXGZSA-N	444.517	1.872	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)Cc2csc(NC(=O)c3ccco3)n2)C[C@@H](C)O1	732259559	HJGZHZNHCUXCTQ-BETUJISGSA-N	435.506	1.178	50	20	IDGD	
CC(C)(C)OC(=O)NCCOCC(=O)NNC(=O)c1ccc(F)cc1Br	732551512	OBJUKFZPNXHVDH-UHFFFAOYSA-N	434.262	1.891	50	20	IDGD	
O=C(NCc1ccnc(OC2CCOCC2)c1)NNC(=O)[C@H]1COc2ccccc2O1	733352257	AQLYCGZLDXRTRC-GOSISDBHSA-N	428.445	1.310	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)c1ccc(Cl)c(S(C)(=O)=O)c1	734239804	DRXIMPZWMXLFHC-UHFFFAOYSA-N	434.902	1.212	50	20	IDGD	
Cc1ccc(C#N)cc1S(=O)(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	734807593	WWCTYPHRWGQWQU-UHFFFAOYSA-N	437.522	1.759	50	20	IDGD	
C[C@H](c1ccccc1)N1CCC(NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)CC1	734947269	UFJOZLXGYBPLHV-MRXNPFEDSA-N	434.504	1.832	50	20	IDGD	
COc1cc(OC)cc(C(=O)Nc2ccc(O)c(C(=O)NNC(=O)c3c[nH]nc3C)c2)c1	735516053	GIHBUOYAHRBDIZ-UHFFFAOYSA-N	439.428	1.768	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)c3ccc(-n4cncn4)c([N+](=O)[O-])c3)n[nH]2)cc1	740923948	PCXHUFWJKUWBLO-UHFFFAOYSA-N	432.400	1.949	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)NCc2nc(-c3ccc(F)cc3)n[nH]2)cc1C	741418308	ZWZDKNZUMSRCGN-UHFFFAOYSA-N	425.424	1.697	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2ccc3ccccc3n2)cc(NS(C)(=O)=O)c1OC	742463802	PWNPJNYZQJGWPZ-UHFFFAOYSA-N	444.469	1.698	50	20	IDGD	
C[C@@H](CC(=O)NNc1nc(-c2ccncc2)no1)/N=C1/NS(=O)(=O)c2ccccc21	742612504	JYRSJYGDYOPNDG-NSHDSACASA-N	427.446	1.092	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)NC[C@@](C)(O)C(C)C)cc1	743773882	MPMJIRWOKIDYBX-XMQQHFNTSA-N	439.516	1.864	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)CCNS(=O)(=O)/C=C\c2ccccc2)cc1	743826382	BSGFQCXVZYGRHU-SQFISAMPSA-N	431.518	1.886	50	20	IDGD	
Cc1ccc([N+](=O)[O-])c(OCCC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)c1	743830337	SCEUNHMVFKBJGT-UHFFFAOYSA-N	436.446	1.929	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)CNC(=O)NCc2ccco2)cc1Cl	743834417	FAUFZFPCADPQAN-UHFFFAOYSA-N	425.829	1.602	50	20	IDGD	
CCOC(=O)c1ccc(N2CCCN(CC(=O)NNC(=O)c3cccc(C)c3)CC2)nc1	744395317	QWAKBZNWMQXWQJ-UHFFFAOYSA-N	439.516	1.540	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)c1	744565793	XRQLCSHAHVINAP-UHFFFAOYSA-N	437.412	1.685	50	20	IDGD	
O=C(NCCCN1CCN(c2ccccc2)CC1)NNC(=O)c1cc([N+](=O)[O-])ccc1O	745504762	XPLRMWOMDNISKB-UHFFFAOYSA-N	442.476	1.457	50	20	IDGD	
CN(C)c1nc(CNC(=O)NNC(=O)COc2ccc(Br)cc2)cs1	747507666	JKTLESGNPGEILH-UHFFFAOYSA-N	428.312	1.881	50	20	IDGD	
CC(C)(C)c1ccc(S(=O)(=O)NNC(=O)c2csc(N3CCOCC3)n2)s1	747777837	SZPIJXBCFZGHSN-UHFFFAOYSA-N	430.577	1.962	50	20	IDGD	
COc1cc(C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)sc1S(N)(=O)=O	748610852	SYAZOKNSESAHRX-UHFFFAOYSA-N	441.459	1.157	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)c2cnn3c2C[C@H](CNC(C)=O)CC3)o1	752888455	FMAUPUAAQSJDAA-OAHLLOKOSA-N	430.509	1.091	50	20	IDGD	
Cc1cc(NC(=O)COC(=O)/C(C#N)=C/c2ccc(O)cc2)n([C@@H]2CCS(=O)(=O)C2)n1	754552009	ZOBBVOQVVVHBJZ-HTRKUNOGSA-N	444.469	1.346	50	20	IDGD	
CN1CCCCC/C1=N/S(=O)(=O)c1cccc(NC(=O)NNC(=O)Cc2cc[nH]n2)c1	756164949	IJAMQYDQUBDHBN-UQQQWYQISA-N	447.521	1.398	50	20	IDGD	
CCOc1ccc(C(=O)N(C)C)cc1NC(=O)NNC(=O)COc1ccccc1C#N	756879556	IADZBYKJKRXJGG-UHFFFAOYSA-N	425.445	1.890	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2cnc3c(c2)CCCC3)cc1	757999868	XYRTTXJTTIYGPW-UHFFFAOYSA-N	431.518	1.742	50	20	IDGD	
Cn1nnc2cc(C(=O)NNc3ccc(S(=O)(=O)Nc4nccs4)cc3)cnc21	758310510	RBWOYELPLDJSAP-UHFFFAOYSA-N	430.475	1.378	50	20	IDGD	
Cc1nn(-c2ccccc2)c2sc(C(=O)NNC(=O)N[C@H]3CCCS(=O)(=O)C3)cc12	758657347	IQKRVIJHSPNPAG-ZDUSSCGKSA-N	447.542	1.917	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)[C@@](C)(OC)c2ccccc2F)cc1OC	759280722	OXWRNYMJAICSMG-NRFANRHFSA-N	434.420	1.709	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)NCc2ccc(S(C)(=O)=O)c(Cl)c2)c1	759387103	FMADSNRMIBZYMH-UHFFFAOYSA-N	431.923	1.973	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCCC(=O)NNC(=S)NCC1CCC1	760808954	NCIZPCWVINRHNZ-CQSZACIVSA-N	427.571	1.188	50	20	IDGD	
O=C(NNC(=O)c1cc(I)ccc1F)C(=O)Nc1ccccn1	762188228	XCUYSWWHXXKIRT-UHFFFAOYSA-N	428.161	1.225	50	20	IDGD	
O=C(NNc1nccc(N2CCOCC2)n1)c1ccccc1I	762852981	NXRXOHDOYFHRCK-UHFFFAOYSA-N	425.230	1.675	50	20	IDGD	
COc1cc(C)c(S(=O)(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)cc1OC	763439053	HJGXQNYGZDGRFJ-UHFFFAOYSA-N	431.511	1.627	50	20	IDGD	
COc1ncc(C)cc1NC(=O)C(=O)NNC(=O)COc1cccc(C(F)(F)F)c1	763638596	CLFXGFDMUWHMKM-UHFFFAOYSA-N	426.351	1.582	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)C(=O)Nc1ccc(OCC(F)(F)F)nc1	763679502	MGZHLOONIXFAJC-UHFFFAOYSA-N	430.314	1.327	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(NC(=O)CC)ccc1C	763679788	DDQZQEKMQBAJAA-UHFFFAOYSA-N	442.472	1.907	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc2c(cc1SC)OCCO2	763712496	SSZQEVZCVLAVMB-UHFFFAOYSA-N	445.497	1.907	50	20	IDGD	
O=C(CN1CCCc2ccccc21)NNC(=O)C(=O)Nc1cccc(N2CCOC2=O)c1	763745321	CGWNLYCGQJEUDW-UHFFFAOYSA-N	437.456	1.182	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)C(=O)Nc2cccn(Cc3ccccc3)c2=O)c1	763759015	RKXNNJCCVUBCTP-UHFFFAOYSA-N	433.468	1.362	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(CC(N)=O)cc2)cc1	763768955	YOTFXVXRUIAXBR-UHFFFAOYSA-N	426.473	1.539	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cnn(Cc3ccncc3)c2)c1C	763849741	MQLRPXADIKOAOB-INIZCTEOSA-N	436.472	1.497	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)NNC(=O)C(=O)Nc1ccc(OCC(F)(F)F)nc1	763859178	XXQISEJWKVVEIF-UHFFFAOYSA-N	435.362	1.833	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)C(=O)Nc1ccc2c(c1)oc1ccccc12	763922681	YQLXLCVYYAHIDO-UHFFFAOYSA-N	441.407	1.961	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccccc1S(=O)(=O)N1CCCCC1	763960645	SBYCWZVHLAJDRJ-UHFFFAOYSA-N	444.513	1.569	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)C(=O)N(C)CC2	764010820	DDQSXYQVACSHCF-UHFFFAOYSA-N	430.848	1.376	50	20	IDGD	
O=C(NNC(=O)c1cnccn1)C(=O)Nc1cccc(COCCOc2ccccc2)c1	764023674	CGXYUZKJEKSMEY-UHFFFAOYSA-N	435.440	1.472	50	20	IDGD	
CS(=O)(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)Cc2cccc3ccccc23)cc1	764037539	YWQMNFFALNMVJT-UHFFFAOYSA-N	439.493	1.713	50	20	IDGD	
CCN(CC)CCn1ccc2cc(NC(=O)C(=O)NNC(=O)c3cc(C)[nH]n3)ccc21	764106540	MKIDMFJPJPMFIU-UHFFFAOYSA-N	425.493	1.414	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2O1)C(=O)Nc1ccc2oc(C(F)(F)F)nc2c1	764152629	FHQJISIIARJHLG-CQSZACIVSA-N	434.330	1.936	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)n(-c2cccc(Cl)c2)n1	764152768	FUCJOPZZBJXWDK-KRWDZBQOSA-N	439.859	1.924	50	20	IDGD	
CS(=O)(=O)Cc1cc(F)ccc1NC(=O)C(=O)NNC(=O)CCC1CCCCC1	764215394	QSGOWFZDHXUVLQ-UHFFFAOYSA-N	427.498	1.817	50	20	IDGD	
CC[C@@H](C)Oc1ccc(NC(=O)C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1	764259330	FVGOLYXNGJCSNT-OAHLLOKOSA-N	440.504	1.656	50	20	IDGD	
COC(=O)c1c(NC(=O)C(=O)NNC(=O)CCc2ccccc2O)sc2c1CCCC2	764288716	LJJOUGYCWIVIHS-UHFFFAOYSA-N	445.497	1.838	50	20	IDGD	
Cc1cc(S(N)(=O)=O)cc(NC(=O)C(=O)NNC(=O)C(C)(C)c2ccccc2)c1C	764312434	BSDQQXVZFWCNLS-UHFFFAOYSA-N	432.502	1.015	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2cccs2)[nH]n1)C(=O)Nc1cc2c(cc1Cl)OCCO2	764376270	AVYONIGAHMAGEF-UHFFFAOYSA-N	447.860	1.963	50	20	IDGD	
CCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)c(C)c1	764378270	XNFDDVWWDLMYQJ-UHFFFAOYSA-N	440.485	1.596	50	20	IDGD	
COC(=O)c1cc2cc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc3ccccc3)ccc2o1	764379826	LVMIDEBWAHBZIX-UHFFFAOYSA-N	447.350	1.977	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1cccc(NC(=O)C2CCCCC2)c1	764398967	IYGNLXZMYXMMCK-AWEZNQCLSA-N	434.493	1.343	50	20	IDGD	
COC(=O)c1ccc(OC)cc1NC(=O)C(=O)NNC(=O)CSc1ccccc1O	764404375	JSRXZBXAMCDUQK-UHFFFAOYSA-N	433.442	1.066	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNS(=O)(=O)c2ccc(O)c(NC(C)=O)c2)cc1	765030885	STXWFHVGOKEERN-GFCCVEGCSA-N	437.474	1.526	50	20	IDGD	
Cc1nn(C)c(=O)c(C(=O)NNc2nc3ccccc3c(=O)n2CCCOC(C)C)c1C	765045203	DSIFFNHKXKKVAK-UHFFFAOYSA-N	440.504	1.679	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)Nc3ccc(S(N)(=O)=O)cc3)n[nH]2)cc1C	765300652	QDIUPAGXUHTCJQ-UHFFFAOYSA-N	428.474	1.807	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3ccc(N4CCCC4=O)cc3)CC2)cc1	765748113	JOTBRUAKPCFJPB-UHFFFAOYSA-N	449.555	1.701	50	20	IDGD	
N#C/C(=C/c1cn(CCC(N)=O)nc1-c1cccc(Br)c1)C(=O)N1CC(O)C1	765855517	YCRJVODUCJRRNU-MLPAPPSSSA-N	444.289	1.298	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)c3cc(S(=O)(=O)N(C)C)ccc3O)n[nH]2)cc1	767033907	FSKBGUONOLRXQR-UHFFFAOYSA-N	443.485	1.416	50	20	IDGD	
CCn1c(=O)oc2cc(S(=O)(=O)NNC(=O)c3cc(Br)c[nH]3)ccc21	767446296	RCEFDXCARMFPRI-UHFFFAOYSA-N	429.252	1.328	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](OCC(=O)NNC(=O)COc2ccccc2F)C1	767736928	ONZZVVWRCNYREB-AWEZNQCLSA-N	425.457	1.768	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccc(F)cc1C(=O)N(C)C	768238736	TYYUEYOYHCMGKL-NSHDSACASA-N	434.399	1.220	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)CC[C@@H]2NC(=O)N(c3ccc(Cl)c(Cl)c3)C2=O)n[nH]1	768276651	AZZHXXHNCSHZNX-LBPRGKRZSA-N	439.259	1.691	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCOCC2)cc1C(=O)NNc1nc2ccccc2[nH]1	768505425	SRBUHNAIFLQMMF-UHFFFAOYSA-N	431.474	1.349	50	20	IDGD	
COc1cc(C(=O)NNC(=O)N[C@@H]2CCO[C@@]3(CCSC3)C2)cc(OC)c1OC	768516293	KILOLHZHMVPPIF-YJYMSZOUSA-N	425.507	1.711	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)CCn3nc(O)c4ccccc4c3=O)n[nH]2)cc1	768847649	DLGYBPTYAUQMLM-UHFFFAOYSA-N	432.440	1.652	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)c1ccc(-c2nc[nH]n2)cc1	770210264	WAAODUBCNFNHLP-UHFFFAOYSA-N	440.485	1.331	50	20	IDGD	
CCN1CCN(c2cccc(NC(=O)C(=O)NNc3cccc(C(=O)OC)c3)c2)CC1	770765899	QYQRWTMZEBBUFK-UHFFFAOYSA-N	425.489	1.697	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(C)c(C(=O)NNc2ccc(F)c([N+](=O)[O-])c2)c1	771592214	JBGLCLAPYKHYKK-UHFFFAOYSA-N	426.426	1.724	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)ccc1F	772971903	QGTZIDVUZZRCGJ-SNVBAGLBSA-N	429.857	1.616	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)Cc2c(C)nn(-c3nc(C)cc(C)n3)c2C)c1	773069165	DELUAHBPUXHLEE-UHFFFAOYSA-N	436.476	1.253	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)C(=O)Nc2cc(Br)ccc2N2CCOCC2)n1	773479948	MRHCBQPLUGVOKU-UHFFFAOYSA-N	449.309	1.774	50	20	IDGD	
O=C(NNc1ncccn1)C(=O)Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1	773720389	XOKKPXTUADJYEN-UHFFFAOYSA-N	445.527	1.923	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)NNc2cc(Cl)nc(N)n2)N(C)c2ccccc21	773863174	ROAIQCZEXFQBFY-UHFFFAOYSA-N	426.868	1.826	50	20	IDGD	
COC(=O)c1ccc(F)c(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)c1	774008321	GESDMYABOAXOTA-JTQLQIEISA-N	437.811	1.819	50	20	IDGD	
CN(CC(=O)NNc1ccc(C(F)(F)F)cn1)S(=O)(=O)c1cccc([N+](=O)[O-])c1	775265256	IHMJLOYXKGFPTB-UHFFFAOYSA-N	433.368	1.772	50	20	IDGD	
Cc1cccn2cc(CC(=O)NN(C)C(=O)N3CCN(C(=O)OC(C)(C)C)CC3)nc12	776206201	QWXZGZJDJVHORZ-UHFFFAOYSA-N	430.509	1.821	50	20	IDGD	
O=C(NNC(=O)N1CC[C@@H](C(=O)NCC(F)(F)F)C1)c1cc(Br)c[nH]1	777412398	SEKYSFBUOIAVFV-SSDOTTSWSA-N	426.193	1.132	50	20	IDGD	
CNS(=O)(=O)c1cccc(NC(=O)C(=O)NNc2ccccc2OC(F)(F)F)c1C	778800746	FTIOKRNOYMBWEU-UHFFFAOYSA-N	446.407	1.884	50	20	IDGD	
C[C@](O)(CC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)c1ccccc1	780849885	QSHWHSCHUPPVJK-NRFANRHFSA-N	431.514	1.530	50	20	IDGD	
CC(=O)N1CCN(Cc2ccccc2NC(=O)C(=O)NNc2ccc3ccccc3n2)CC1	782123211	DFFYIRWKGKGDGL-UHFFFAOYSA-N	446.511	1.981	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2cccc3c2CCCC3)nc1	783262921	DXZOLUQBODPWQR-UHFFFAOYSA-N	431.518	1.729	50	20	IDGD	
Cc1cc(C)nc(Sc2ccc(NC(=O)C(=O)NN[C@@]3(C)CCS(=O)(=O)C3)cc2)n1	783428744	WXAXLTSOMKHUFQ-IBGZPJMESA-N	449.558	1.381	50	20	IDGD	
CCOC(=O)[C@H](Cc1ccccc1)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1	783575197	VEGXXKFUQUQJQO-IBGZPJMESA-N	433.530	1.411	50	20	IDGD	
COC[C@@H]1CN(C(=O)NNC(=O)[C@H](C)Oc2cccc(Br)c2)C[C@H](C)O1	784058631	YBJSAETXDGKYJU-HUBLWGQQSA-N	430.299	1.693	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NN[C@@H](Cc2ccc(C(F)(F)F)cc2)C(N)=O)c1	784065189	JKGPPIHPQFXZSW-HNNXBMFYSA-N	429.420	1.440	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ccc(F)cc2Br)cc1-n1cnnn1	784802886	TVTXIKJAGWGTHR-UHFFFAOYSA-N	434.229	1.954	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CCCCCCC2)cn1)C(=O)Nc1ccon1	784933835	PQHOSEFAYBDXQD-UHFFFAOYSA-N	436.494	1.543	50	20	IDGD	
CN(C)c1nccc(NNC(=O)C(=O)Nc2ccnn2Cc2ccc(Cl)c(F)c2)n1	784970591	KGOLYYQOLCYZLP-UHFFFAOYSA-N	432.847	1.662	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2cccnc2-c2cnn(C)c2)c1	786209514	ZWHGDKUFYRGGHL-UHFFFAOYSA-N	443.489	1.199	50	20	IDGD	
CSCC[C@@H](O)C(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	788626351	XJASAFYHUNCUHH-CYBMUJFWSA-N	429.545	1.424	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NN=Cc1ccc(Cl)c(I)c1O	788713614	BZPVZYUPAOAPKM-ZCFIWIBFSA-N	445.666	1.038	50	20	IDGD	
COc1nn(C)cc1NC(=O)C(=O)NNC(=O)c1ccc(Br)cc1Cl	789585026	VOHJLJDUCYKHNC-UHFFFAOYSA-N	430.646	1.244	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)c3ccccc32)cc(OC)c1OC	790112358	OFFJHGKLMUNMDK-CQSZACIVSA-N	434.470	1.435	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)Cc2c(C)nc3nc(N)nn3c2C)c1	790178802	LGXSYAWVIQPDNW-UHFFFAOYSA-N	425.493	1.524	50	20	IDGD	
Cn1nc([C@@H]2CCCOC2)cc1NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1	790551144	JPGXYQSURDMRBN-OAHLLOKOSA-N	428.497	1.173	50	20	IDGD	
CCc1nn(C)c(CC)c1CC(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	790697847	SQXKFBYJKNNNQP-UHFFFAOYSA-N	435.550	1.252	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(N3CCC3=O)c2)o1	790951657	JWSNOSNAJJTORZ-UHFFFAOYSA-N	427.461	1.258	50	20	IDGD	
C[C@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)N(C)CC(F)(F)F	792774807	XJMUIWJRUKSGGG-GFCCVEGCSA-N	436.456	1.115	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)N2CCC[C@@H](NS(=O)(=O)c3cccc(F)c3)C2)n1	793228717	PQDZOLKDXQWJEA-OAHLLOKOSA-N	435.481	1.326	50	20	IDGD	
CC(C)(C)OC(=O)N=c1cc[nH]cc1C(=O)NNC(=O)CNC(=O)OCc1ccccc1	794061221	UUCYLJLANKNZOR-UHFFFAOYSA-N	443.460	1.538	50	20	IDGD	
COc1cccc(NCC(=O)NN=C[C@@H]2CCCN(C(=O)CNC(=O)OC(C)(C)C)C2)c1	794478432	OJHSYLACZWKXIQ-INIZCTEOSA-N	447.536	1.972	50	20	IDGD	
COc1ccccc1-n1ncc(C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)c1C	798966291	NISIWKXBZUCMJZ-UHFFFAOYSA-N	432.481	1.658	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2nnn(CCOc3ccc(F)cc3)c2C)cc1	801111341	PCSFQENIXLACKG-UHFFFAOYSA-N	440.435	1.513	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)[C@@](C)(O)CCc3ccccc3)cc2)CC1	801176248	SZPJQKOCGFKNQL-QFIPXVFZSA-N	446.573	1.450	50	20	IDGD	
C[C@@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(C(=O)NNC(=O)N=c3cc[nH]cc3)cc2)C1	802031493	GCENDHSCBKIGQH-HUUCEWRRSA-N	431.518	1.637	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)CCS(=O)(=O)c2ccc3c(c2)OCCCO3)cc1	802060653	JHTWUWSITWRZMZ-UHFFFAOYSA-N	449.485	1.873	50	20	IDGD	
COc1cc(OC)cc(C(=O)NCC(=O)NNC(=O)Nc2cc(OC)ccc2Cl)c1	802108398	WCPXHBJAHJHABD-UHFFFAOYSA-N	436.852	1.949	50	20	IDGD	
COc1ccc(C2=NO[C@H](CNC(=O)NNC(=O)c3ccc(OC)c(OC)c3)C2)cc1F	802345102	KNIHQAGLEYCRNF-AWEZNQCLSA-N	446.435	1.989	50	20	IDGD	
COc1cc(C)c(CN(C)C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1OC	807135957	UOIMOQMFVPNNKN-UHFFFAOYSA-N	425.449	1.474	50	20	IDGD	
COC[C@@]1(C(=O)NNC(=O)[C@H]2COc3ccccc3O2)CCN(C(=O)OC(C)(C)C)C1	809950820	ZIDSPHXRFMVIAI-IIBYNOLFSA-N	435.477	1.247	50	20	IDGD	
COC[C@]1(C(=O)NNC(=O)c2ccc(OC)cc2OC)CCN(C(=O)OC(C)(C)C)C1	810356107	NFTRVNCEVVGRNB-NRFANRHFSA-N	437.493	1.738	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)NS(=O)(=O)c2cncc(C#N)c2)c(C)n1C[C@@H]1CCCO1	813984908	GEFAXHTTXFNWDO-YSLLPBIDSA-N	439.497	1.963	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2nc(CC(F)(F)F)cs2)cc1	815568883	XQLSAXNKAGJGGO-UHFFFAOYSA-N	430.408	1.975	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C(=O)Nc2nc(CC(F)(F)F)cs2)nc2ccccc21	815582841	QKTSJGNTHNZHQZ-UHFFFAOYSA-N	440.407	1.463	50	20	IDGD	
O=C(NNc1ncc(F)cn1)C(=O)Nc1ccc([N+](=O)[O-])c(I)c1	815604115	DMYROMMGRJINOE-UHFFFAOYSA-N	446.136	1.210	50	20	IDGD	
CCn1c(NNC(=O)Cc2[nH]c(C(C)=O)c(C)c2C(=O)OC)nc2ccccc2c1=O	823904743	NLCINHFZOXLFKZ-UHFFFAOYSA-N	425.445	1.728	50	20	IDGD	
COc1ccccc1NC(=O)COc1ccc(C(=O)N2CC[C@@H](B(O)O)C2)cc1OC	864233147	FXWHKSXIGPKAAQ-OAHLLOKOSA-N	428.250	1.410	50	20	IDGD	
N#Cc1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2ccc(Br)s2)cc1	913161235	XJWWZABZHZQVPY-UHFFFAOYSA-N	443.304	1.122	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(Cl)cc1)NNC(=O)c1cc(-c2ccccc2)[nH]n1	913422989	APXQPTQHWXZKPQ-UHFFFAOYSA-N	433.877	1.470	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)C(=O)Nc1ccccc1	916096186	KRVYYHMFYNQAHU-UHFFFAOYSA-N	430.486	1.261	50	20	IDGD	
CC(=NNC(=O)COc1ccc(F)cc1)c1ccc(S(=O)(=O)NCCC(=O)O)cc1	916331241	JUEHSWZOXVZGOJ-UHFFFAOYSA-N	437.449	1.498	50	20	IDGD	
CCNC(=O)COc1ccc(CNC(=O)NNC(=O)c2ccc(CC)cc2)cc1OC	916388753	GZOQMPTUBFDCNS-UHFFFAOYSA-N	428.489	1.917	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NC[C@@H](C)N2CCCC[C@H]2C)cc1	916446930	DTJLFPZZZAOPON-IAGOWNOFSA-N	439.582	1.209	50	20	IDGD	
CC(C)NS(=O)(=O)c1cccc(CNC(=O)NNC(=O)COc2ccc(C#N)cc2)c1	916486189	BLPQDOFACBSWCK-UHFFFAOYSA-N	445.501	1.154	50	20	IDGD	
Cc1csc(CCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)n1	916573621	HAWYRLSSKGFLKL-UHFFFAOYSA-N	437.547	1.423	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)N[C@H]1CCN2CCCC[C@@H]12	916638467	GWADOXWYEHNLNJ-OALUTQOASA-N	449.577	1.432	50	20	IDGD	
CC(=NNC(=O)C(=O)Nc1ccc(C)cc1)c1ccc(S(=O)(=O)N2CCNCC2)cc1	917030689	KORNRXZYCVNFIB-UHFFFAOYSA-N	443.529	1.068	50	20	IDGD	
Cc1noc(C)c1S(=O)(=O)N1CCN(S(=O)(=O)c2ccc(CCCl)cc2)CC1	917864193	LRPGQMRIELUDJD-UHFFFAOYSA-N	447.966	1.768	50	20	IDGD	
CCc1n[nH]cc1C(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccc(OC)cc2)c1	917899625	KOWALQJPLXPMNZ-UHFFFAOYSA-N	443.485	1.856	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)[C@@H](C)NS(=O)(=O)c2cccs2)cc1OC	917924789	MHCQKOYSPDGEPD-GFCCVEGCSA-N	441.531	1.674	50	20	IDGD	
CC(=O)c1cccc(S(=O)(=O)NCCC(=O)NNC(=O)c2ccc(Cl)cc2O)c1	918359018	HLYUKXXNHGASOC-UHFFFAOYSA-N	439.877	1.378	50	20	IDGD	
CCc1c(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)cnn1-c1cccc(Cl)c1	919886523	SBSRZUUJKKMITN-GFCCVEGCSA-N	425.898	1.219	50	20	IDGD	
CCOC(=O)C1CCC(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)CC1	921118246	NNQVXYAXNXKSDW-UHFFFAOYSA-N	440.522	1.003	50	20	IDGD	
COC(=O)C(=O)NNC(=O)N[C@@H](c1cccc(S(C)(=O)=O)c1)c1ccc(C)cc1C	1319300520	XNUFLSXSHQOEGU-KRWDZBQOSA-N	433.486	1.300	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)NC[C@@H]2COC3(CCCC3)O2)CC1	1319893677	AAYDFEQRWBBSEQ-OAHLLOKOSA-N	426.514	1.650	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCC(=O)NNc2cncc(Br)c2)cc1	1324194063	ZEBGANBQQOTWQT-UHFFFAOYSA-N	429.296	1.664	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)CSCc3csc(C)n3)CC2)cc1	1333507257	GVUZKKFXMBKKGC-UHFFFAOYSA-N	447.630	1.958	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)N[C@@H]2CCO[C@@]3(CCOC3)C2)CC1	1337107896	CXOUZRGMMXREEP-QRWLVFNGSA-N	426.514	1.302	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)C3=NO[C@H](c4ccccc4)C3)C2)C1	1778173306	CMPRZOKHSHMKDZ-DJPFJPOOSA-N	435.908	1.588	50	20	IDGD	
O=C(c1ccc2nc[nH]c2c1)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1778511754	UDRVZIHFGFCBJA-PBHICJAKSA-N	425.258	1.697	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc4n(n3)CCC4)C2)C1	1778671689	NQYLIWCUEFIWSK-KSSFIOAISA-N	425.327	1.446	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(CCN(C(=O)c3cccn(C(F)F)c3=O)C2)C1	1779357811	UPRZIIYTAZPXFM-KRWDZBQOSA-N	448.264	1.472	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(-c4cccnc4)[nH]n3)C2)C1	1779613688	RYQVWIBYINSSNJ-NRFANRHFSA-N	443.580	1.767	50	20	IDGD	
CCO/C=C/C(=O)N1CCO[C@]2(CCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1	1780098093	BIXOUPUQZBZXHF-VMLCMGRWSA-N	447.444	1.514	50	20	IDGD	
N#Cc1cc(CC(=O)N2CC[C@]3(CN(C(=O)CCBr)CCO3)C2)ccc1F	1781296926	JTLDWFNHKQPBLH-LJQANCHMSA-N	438.297	1.855	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](F)Br)C3)C2)n(C(F)F)n1	1781333134	DCSDLCCAATVXQU-XHDPSFHLSA-N	439.232	1.721	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(O)nn1)C2	1781996668	PRUXHQSXVSQETM-XTQGRXLLSA-N	427.299	1.093	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)CBr)C2	1782171950	HJTJDMHCAUKUQX-VMUDFCTBSA-N	439.778	1.785	50	20	IDGD	
O=C(C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](Br)Cc3ccccc3)C2)C1)C1CC1	1783017836	FXCGLNIIKPJCLG-UWJYYQICSA-N	449.345	1.802	50	20	IDGD	
COc1cccc(CCC(=O)N2CCO[C@]3(CCN(C(=O)[C@H](C)Br)C3)C2)n1	1783529204	GOOPEZBGCWGQIM-IFXJQAMLSA-N	440.338	1.636	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)Cc3ccc(F)c(C#N)c3)CCO2)C1	1783535782	CCYWGOZPFDOMIQ-YJYMSZOUSA-N	438.297	1.853	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)Cc3ccc(C(=O)OC)cc3)C2)C1	1784162274	YUXJVHHIKVSAQW-UTKZUKDTSA-N	438.908	1.099	50	20	IDGD	
CCOCCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2	1784689242	DSZDCUMMHJJSRG-MGPUTAFESA-N	447.960	1.375	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(CO)c(F)c3)C2)C1	1785266128	KPKOVUIPQMMPPC-KXBFYZLASA-N	443.313	1.935	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](F)Cl)CCO3)CC1	1785716632	RWUCREPKBAVGER-FOIQADDNSA-N	447.935	1.998	50	20	IDGD	
COc1ccc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Br)C[C@@H]32)cc1	1786547488	ZPPUJPQFOLPJNF-MBGYTDRXSA-N	443.313	1.908	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)c1cnc2ncccn12	1788004598	ORJWOWNASWRPSJ-YDHLFZDLSA-N	436.310	1.108	50	20	IDGD	
C[C@H](Nc1nccs1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]2C1	1788762727	QDUZSZMYZGBIOR-VGWMRTNUSA-N	440.642	1.775	50	20	IDGD	
Cc1nc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]3C2)c(=O)[nH]c1C	1789868740	KVZGIEGIHKQUSH-WFTHSTBKSA-N	445.347	1.216	50	20	IDGD	
O=C(NC1(c2ccc(NC(=O)c3ncccc3F)cc2)CCC1)c1ccc(B(O)O)cc1	1789908952	CYCDVTXWWVATIY-UHFFFAOYSA-N	433.248	1.962	50	20	IDGD	
Cc1nnc(CC(=O)NC2(c3ccc(NC(=O)CCC(=O)NN(C)C)cc3)CCC2)s1	1791599219	DMYPYOYYOXZGCD-UHFFFAOYSA-N	444.561	1.896	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(=O)c3cccn3C)[C@H]2C1	1791695138	KMTXDCFGGSCSED-AYDFFVQHSA-N	440.338	1.361	50	20	IDGD	
C=C1CC(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cc([N+](=O)[O-])ccc2OC(C)=O)C3)C1	1792440937	ITJYEVPVABOFCW-CWPLJXCYSA-N	443.456	1.690	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc(C#N)cc1)C2	1792866488	AYSHNQTXPZXLRH-KUZCPNRJSA-N	434.334	1.721	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(C(C)(C)C)n[nH]1)C2	1792870728	JHVHJDUZTZTTCB-NFFDBFGFSA-N	441.370	1.941	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccn3nccc3c1)C2	1792870967	NQYYRZLJZKGZAX-JJAZEVLHSA-N	435.322	1.569	50	20	IDGD	
CCc1[nH]nc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](Br)CC)C3)c1F	1794514938	YPNXAZJNGIBENQ-MIJXAVMKSA-N	431.306	1.488	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccccc1F	1795221393	OTAGAYOKBGGFLC-LJGDNWOOSA-N	427.314	1.989	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)c1ccc2scnc2c1	1796189022	NEIDVYUOWCCYOW-BCDXTJNWSA-N	435.314	1.542	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(C(F)(F)F)n1C	1796712583	MQKOLNQKOSWPIK-OXIQGZBJSA-N	437.846	1.501	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cn2ccccc2n1	1796829590	QBKAQAVLRUWEJO-LOUJCGABSA-N	435.322	1.711	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccn2nccc2c1	1797557026	AAMWKOGDZWTHRN-YALNPMBYSA-N	435.322	1.711	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](N)c1cccc(Cl)c1)C2	1797954793	KQCPAZZGXTZKTK-QXGSTGNESA-N	440.016	1.781	50	20	IDGD	
C[C@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnccc1C(=O)NN)c1ccc(O)cc1	1798442007	RIQICTWTXKFBCH-LLLHUVSDSA-N	437.500	1.446	50	20	IDGD	
Cc1c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@](C)(Cl)CCl)cn2[nH]cnc(=O)c12	1800081783	NDHVVDYPAYCXHI-JHXTVGTDSA-N	440.331	1.819	50	20	IDGD	
C=C(CC(=O)OCC)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2	1800109469	CJYUQSDHUZJTTA-GSWMANSFSA-N	443.504	1.268	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c(c1)CC(=O)N3)C2	1800759595	XKHABHJBOPFQET-JAMKOXHTSA-N	436.306	1.168	50	20	IDGD	
C[C@@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C(C#N)=C/c1ccc(F)cc1F)n1cnnn1	1801439011	RTSCLUGTTUBKPM-SFMYWWGTSA-N	441.442	1.758	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H]2C[C@@]21C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](O)CCl)C2	1801980597	YTUQJYYTBSJLSC-YFYQZICJSA-N	441.956	1.624	50	20	IDGD	
C=C[C@@H]1C[C@]1(NC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2	1802139644	JYVZCCILZAFOKH-CMVVLZHBSA-N	445.919	1.580	50	20	IDGD	
CCS(=O)(=O)CC(=O)N1CC[C@H](CNC(=O)C(C)(C)CCl)[C@H]1c1cccnc1	1802896605	DFTAVXOKEIILKS-NVXWUHKLSA-N	429.970	1.787	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1CCN(C(=O)Cn2ccnn2)[C@H]1c1cccnc1	1803008626	MKCRXYUQYDZIRO-KMFMINBZSA-N	435.326	1.410	50	20	IDGD	
N#Cc1ccccc1OCC(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]1c1cccnc1	1803147289	FGWGQIYCEYYXRS-OPYAIIAOSA-N	442.903	1.638	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)nc2nccn12	1803148029	NJSXSDYSCKVGQH-NJAFHUGGSA-N	442.907	1.352	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@H]1c1cccnc1)c1cc(O)ncn1	1803739979	BEVGPSSBCGXSFB-TUKIKUTGSA-N	438.257	1.587	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C12CC(c3ccccc3)(C1)C2)c1ccc(B(O)O)cc1	1804575636	XAUCKUVWOAUGGX-GPCVTYTCSA-N	444.340	1.740	50	20	IDGD	
Cn1nc(C(=O)NC[C@@H]2CCN(C(=O)[C@H](F)Br)[C@H]2c2cccnc2)cc1O	1804898888	VSDMNTLNQJTFPP-CQDKDKBSSA-N	440.273	1.531	50	20	IDGD	
Cc1cc(C(=O)NC[C@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)on1	1805706024	JDUCLDTVXQTJKA-BEFAXECRSA-N	449.471	1.010	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)C2=CCCS2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1	1807365486	OZZRVWHZICLADU-YLJYHZDGSA-N	437.330	1.102	50	20	IDGD	
O=C(c1cncn1-c1ccncc1)N1CCCC2(CCN(C(=O)[C@@H](O)CCl)CC2)C1	1807747879	DNOVDADXPBKOKR-SFHVURJKSA-N	431.924	1.712	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)c1c[nH]c2nccc-2c1	1808077837	ROXLFVALYLSTCD-JQHSSLGASA-N	427.892	1.829	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)[C@H]2C[C@@H]2F)[C@H]1c1cccnc1	1808416187	GPBFKUXVZXGEPR-PUEUITJWSA-N	440.479	1.579	50	20	IDGD	
Cc1cc(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)nc2nccn12	1812167963	NHSUYODZNFBXRX-RYQLBKOJSA-N	442.907	1.352	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)[C@@H]2CNC(=O)C2)[C@@H]1c1cccnc1	1812778655	JBFMZQLZYTYSMY-QBYUYEEZSA-N	437.338	1.397	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)[C@H]1CCC(F)(F)C1	1814387679	PEQBLGZIPXPDNT-WMLDXEAASA-N	446.263	1.831	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)[C@H](O)CCl)n[nH]2)ncc1[N+](=O)[O-]	1814870668	AHYOWYNANJPNGB-DZGCQCFKSA-N	436.856	1.927	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)[C@H](O)CCl)[nH]n2)n1	1816086588	OMJDUSJQHTWLKL-HUUCEWRRSA-N	434.884	1.669	50	20	IDGD	
O=C(CCBr)Nc1cc([C@H]2CCCCN2C(=O)c2cc(CO)on2)[nH]n1	1816782971	AMBUTUULVIUPNF-CYBMUJFWSA-N	426.271	1.981	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3ncn(C(C)C)n3)sc2C1	1817689829	BTZZDKVRXGCZQQ-GHMZBOCLSA-N	426.930	1.795	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1)c1cc2cccnc2nc1O	1821423437	IVHNWWGMFKVPLU-CABCVRRESA-N	444.879	1.964	50	20	IDGD	
O=C(CCBr)N[C@@H]1CCc2nc(NC(=O)c3cc(CO)on3)sc2C1	1821698124	ZFBVSYNLFLUJSI-MRVPVSSYSA-N	429.296	1.634	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnncc2C(=O)O)[nH]n1	1822373130	VAZLHLRAQLXKCC-TZMCWYRMSA-N	436.856	1.458	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cncc(F)c2)[nH]n1	1822412866	IBCHUYYTHYCFPF-MRXNPFEDSA-N	431.472	1.623	50	20	IDGD	
CC1CCN(CC(=O)N2CCCC[C@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)CC1	1822413153	WXYKXJHXWWDHMR-SFHVURJKSA-N	447.584	1.507	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(O)nc2)[nH]n1	1822415094	SLGMPMREOKGKNO-HNNXBMFYSA-N	429.481	1.189	50	20	IDGD	
Cc1cc(C(=O)N2CCC([C@H]3CCCCN3C(=O)[C@@H](O)CCl)CC2)nc2nccn12	1824187900	LCWFXPZNEANCBJ-MSOLQXFVSA-N	433.940	1.871	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)c2coc(Cl)n2)CC1	1825535395	HWJRPISXGNHQAS-SFHVURJKSA-N	445.712	1.555	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(=O)n1O)CC2	1825994604	WONFNQAPIPYRHB-UWVGGRQHSA-N	426.882	1.022	50	20	IDGD	
O=C(c1ccnc(F)c1)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827056462	ZWQNEPROJLYIOU-FQEVSTJZSA-N	439.296	1.448	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ncon2)CC1	1827678975	BXLLWDBXXYITFV-ZZQPOVDQSA-N	441.492	1.437	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)/C=C/c3cccc(C)n3)CCO2)C1	1829728359	LPITVUBMSBKVIV-RVLLMHTFSA-N	437.924	1.113	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(=O)n3[nH]nnc3n2)CC1	1830306463	LNPOQWDVHPQSBW-DZGCQCFKSA-N	435.916	1.063	50	20	IDGD	
CN[C@H](CC(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](F)Br)CC1)C(=O)O	1830375914	WSFJOMMHEWPNGR-VNHYZAJKSA-N	436.322	1.359	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)nc1	1830537371	FWNJSNDOPRGUNP-DNVCBOLYSA-N	440.338	1.491	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)C3CC(C)(C)C3)C2)C1	1830543868	GSELPNDQDVIVFO-AUUYWEPGSA-N	431.371	1.910	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)C[C@H](NC)C(=O)O)CC1	1831548298	AMJMLDSNCCNPHF-HRCADAONSA-N	446.386	1.842	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(C)nn3CC)C2)C1	1831647266	SXGIVNYJGKCETP-OXQOHEQNSA-N	426.945	1.689	50	20	IDGD	
CCn1nc(C)cc1C(=O)N1CCC([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1	1831871221	NLAQNIYONILJHX-LJQANCHMSA-N	446.596	1.818	50	20	IDGD	
O=C([C@@H](F)Br)N1CCOC[C@@]2(C1)CN(C(=O)C(F)(F)C(F)F)CCO2	1832190370	VYFIATIQDPSREL-PRHODGIISA-N	439.175	1.034	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCC(N2CCC(NC(=O)[C@H]3CCC(=O)NC3)CC2)CC1	1833122170	ZNBWPDFZDYGKEA-VBKZILBWSA-N	447.407	1.321	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCC(N2CCC(NC(=O)c3cc(O)ncn3)CC2)CC1	1833554697	FRJLUTSGUQVZTK-IBGZPJMESA-N	444.363	1.604	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3c(F)c(C)nn3C)CCO2)C1	1833702868	OPIMPAICIISVSL-LIRRHRJNSA-N	430.908	1.345	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3ncon3)CC2)CC1	1836046753	JNAHPLLKKYCZRP-AWEZNQCLSA-N	428.331	1.428	50	20	IDGD	
Cc1ccc(C(=O)NC2CCN(C3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)cc1	1836308509	RXMPVCMNSRHCFB-UHFFFAOYSA-N	443.592	1.553	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)c3ccc(O)nn3)CC2)CC1	1837368890	XPOZMSOCMOCUCO-LBPRGKRZSA-N	441.326	1.578	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc4c3cnn4C)C2)C1	1839144757	KBUYLJPGUCYCCH-LAUBAEHRSA-N	434.924	1.661	50	20	IDGD	
Cc1n[nH]c(C)c1CC(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1839238514	QMGJLHXDOMGNTI-HXUWFJFHSA-N	426.945	1.290	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(F)ccc3Cl)CCO2)C1	1839327607	UBKFHGKSAQIKPK-LPHOPBHVSA-N	449.306	1.803	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(O)cn3)C2)C1	1839963724	UBMCNQYWAZNVRG-RDTXWAMCSA-N	442.310	1.031	50	20	IDGD	
O=C([C@H](F)Cl)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CCc3ccccc3O1)CCO2	1840136648	HBAUEOOZXOFILF-UWVAXJGDSA-N	426.872	1.371	50	20	IDGD	
O=C(C(Cl)Cl)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1CCc3ccccc3O1)CCO2	1840139288	NVMLGXVNRUHTJL-JXFKEZNVSA-N	443.327	1.640	50	20	IDGD	
C[C@H](Cn1ccnc1)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1	1840433610	ZJFKNPPLBNRRQY-MNEFBYGVSA-N	447.363	1.212	50	20	IDGD	
COc1cc(F)ccc1CC(=O)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1840935506	HXCPBCUOYBNDNL-IBGZPJMESA-N	449.306	1.637	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)[C@@H]2C[C@@H]2c2ccc(F)c(F)c2)C1	1841397394	LVEHXNAZZOKIPS-QZTJIDSGSA-N	440.255	1.265	50	20	IDGD	
Cc1ccc(=O)n(C(C)(C)C(=O)N2CC3(CCCN3C(=O)CCBr)C2)n1	1842638154	USWGMPVGBFPRMS-UHFFFAOYSA-N	425.327	1.275	50	20	IDGD	
Cc1cc(Br)c(N)cc1C(=O)N1CCCC12CN(C(=O)[C@H](O)CCl)C2	1842855218	MGFGQFGCPMPMAP-CQSZACIVSA-N	430.730	1.756	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC12CN(C(=O)C1(c3ccc(F)c(F)c3)CC1)C2	1843014520	SGBALFIIQKFKMG-UHFFFAOYSA-N	440.255	1.193	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@]2(F)CCN(C(=O)OC(C)(C)C)C2)C1	1843955025	NMJJUYAVBBDWGQ-VBKZILBWSA-N	447.935	1.793	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCCC12CN(C(=O)c1ccc(CS(C)(=O)=O)nc1)C2	1844378052	YXDNIFMXKSDPSI-UHFFFAOYSA-N	439.610	1.295	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)CCc1cn[nH]c1)C2	1844692072	CHIORJDFDXOWSU-UHFFFAOYSA-N	441.444	1.693	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)[C@H](C)N(C)C(C)=O)C2	1844692655	VFSVHEXIUBBFFE-ZDUSSCGKSA-N	446.460	1.204	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC2(CCCN2C(=O)c2ccc(-n3c(O)nnc3O)cc2)C1	1844738739	CTHJFEKAQKQUBQ-UHFFFAOYSA-N	433.896	1.761	50	20	IDGD	
CN(CC(=O)N1CCCC12CN(C(=O)C(F)(F)Cl)C2)NC(=O)NCc1ccccc1	1845039378	JNEZFBGSPSTKST-UHFFFAOYSA-N	443.882	1.368	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC2(CCCN2C(=O)[C@H](C)NC(=O)c2ccccn2)C1	1845770662	WQPBTYAPEBJQAK-UONOGXRCSA-N	437.338	1.577	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)C[C@@H](NC(=O)OC(C)(C)C)C(=O)OC)C1	1846304800	BMRPYUCXABZODY-UONOGXRCSA-N	445.944	1.664	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H]1C=C[C@H](NC(=O)OC(C)(C)C)C1	1848096828	CKQVWSFSLDADJJ-XAJHFOFHSA-N	441.956	1.911	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)c2c[nH]nc2-c2ccc3c(c2)OCCO3)nc2ccccc21	14343135	GVDDHFCSICHNHQ-UHFFFAOYSA-N	432.440	1.738	50	20	IDGD	
CSCC[C@@H](NC(=O)c1ccccc1)C(=O)NNC(=O)COc1ccc(C#N)cc1	15888900	OUYNSOWZQGSHKF-GOSISDBHSA-N	426.498	1.636	50	20	IDGD	
Nn1c(SCC(=O)NNC(=O)c2cccs2)nnc1-c1ccc(OC(F)F)cc1	21607598	FVCJTKGNLMEDOW-UHFFFAOYSA-N	440.457	1.875	50	20	IDGD	
C[C@@H]1CC(C)(C)C[C@@]2(C1)NC(=O)N(CC(=O)NNC(=O)[C@@H]1COc3ccccc3O1)C2=O	22929451	BUPOMHVJDZLSPD-JFUMZLFPSA-N	444.488	1.111	50	20	IDGD	
CCN1CCC(CNC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)CC1	726279023	NMPIELPYDUEXHS-UHFFFAOYSA-N	437.566	1.147	50	20	IDGD	
CCCCC(=O)N1CSC[C@@H]1C(=O)NNC(=O)c1nn(CCC)c(=O)c2ccccc12	727984399	NLSHDBVQYRDZMB-MRXNPFEDSA-N	445.545	1.659	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)CCc2ccc(S(=O)(=O)NC3CC3)cc2)c(C)c1	728205638	VDMXUHPCXGOMRU-UHFFFAOYSA-N	444.557	1.936	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3nccc4ccccc34)cc2)CC1	728216172	UHSDEPRTOJGYLR-UHFFFAOYSA-N	425.514	1.928	50	20	IDGD	
C[C@@H](Sc1nnnn1C1CC1)C(=O)NNC(=O)c1cc(F)ccc1Br	728546435	SIJSXIKBUBQDCE-SSDOTTSWSA-N	429.275	1.851	50	20	IDGD	
COC(=O)Nc1cccc(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)c1	728606117	COTWRGAUCREUQU-UHFFFAOYSA-N	447.517	1.558	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)N(C)CCCC(=O)NNC(=O)c2cccc(C#N)c2)cc1	728827876	CEEQTOCMCISJQK-UHFFFAOYSA-N	442.497	1.623	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)Cc2c(C)[nH]c3ccnn3c2=O)cc1OC	729282356	SYVZJSMYLINAFM-UHFFFAOYSA-N	427.461	1.522	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)NCc1ccc(CN2CCC(O)CC2)cc1	729493872	BBOKTFCYWYOCDC-UHFFFAOYSA-N	430.480	1.692	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1CNC(=O)NNC(=O)Cn1ccc2ccccc21	729495337	XKMBCTXWRDDECK-UHFFFAOYSA-N	429.502	1.422	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C1CCN(C(=O)CCc2ccccc2)CC1	730780475	WRMFYJNVJBFADD-UHFFFAOYSA-N	425.485	1.790	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCCOC[C@H]1CCOC1	731680447	LSCTUDDVMCXAES-OLZOCXBDSA-N	430.299	1.600	50	20	IDGD	
CC[C@H](C)C(=O)N1CCC[C@H](C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)C1	732334842	APVWZUUMPRYCAT-ZFWWWQNUSA-N	434.449	1.184	50	20	IDGD	
CN(C)CC(=O)NNC(=O)c1cccc(NC(=O)Cc2ccc(Br)cc2)c1	733359355	DSLINGKDWSJIEW-UHFFFAOYSA-N	433.306	1.953	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)CCN/C(O)=C1/N=CC=CC1=O	733886501	MWALLFXYVBMCIR-VLGSPTGOSA-N	425.470	1.796	50	20	IDGD	
COc1ncc(C(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)cn1	733949771	VVBIZIHEQCLDMB-UHFFFAOYSA-N	433.471	1.422	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@H]2CCCN2Cc2ccccc2)c1	734173274	GXJIYTIXYCCCBU-GOSISDBHSA-N	430.530	1.699	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)CSc1nnnn1C1CC1	734250102	QEFWSDCMSDFVNO-UHFFFAOYSA-N	425.540	1.320	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)CNC(=O)c2cccc(F)c2)CC1	734882457	UMMRWIPFJZZKPZ-UHFFFAOYSA-N	437.472	1.285	50	20	IDGD	
CC(=O)N[C@@H](CC(=O)NNC(=O)c1nnc(O)c2ccccc12)c1ccc(F)cc1F	741659862	GDRIWKFNJCDUGK-INIZCTEOSA-N	429.383	1.642	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)Cn2nnc([C@@H]3CN(Cc4ccccc4)CCO3)n2)c1	742453564	GMXZGUXSRRIRKD-IBGZPJMESA-N	435.488	1.016	50	20	IDGD	
O=C(NNC(=O)c1ccc2ccccc2n1)N[C@@H]1CC(=O)N(CCOc2ccccc2)C1	743636810	KNCQCGBSJPWHRQ-QGZVFWFLSA-N	433.468	1.859	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)[C@H]2CS[C@@H](Cc3ccccc3F)C(=O)N2)cc1	743828828	JHRMJZQZFAENRY-MSOLQXFVSA-N	445.520	1.887	50	20	IDGD	
CC(C)C(=O)Nc1nc(CC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)cs1	743831593	ZJPUDMJFRAKJTB-UHFFFAOYSA-N	439.519	1.537	50	20	IDGD	
Cc1[nH]c(C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)c(C)c1C(=O)OC(C)C	744571200	FPCNHWOXBIYIDD-UHFFFAOYSA-N	426.429	1.686	50	20	IDGD	
Cc1cc(=O)c(C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)nn1-c1ccccc1F	744595098	LLCARWPKPUMILV-UHFFFAOYSA-N	449.398	1.170	50	20	IDGD	
COC(=O)[C@@H](C)Sc1ccccc1C(=O)OCC(=O)NNC(=O)c1ccc(C#N)cc1	744823980	ACQCGANYLNIKKG-CYBMUJFWSA-N	441.465	1.830	50	20	IDGD	
CC(C)CNC(=O)N1CCC[C@H](CC(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)C1	745112590	VMCPLMQRPHJZLF-QGZVFWFLSA-N	443.504	1.330	50	20	IDGD	
COc1ccc(O[C@@H](C)CNC(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)cc1	745898764	BCLUDLXLVARVRR-AWEZNQCLSA-N	437.522	1.871	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)[C@@H]2CCCN(C(=O)c3ccc4n[nH]cc4c3)C2)c1	746300438	UICVKPJRTAUMIE-OAHLLOKOSA-N	449.471	1.230	50	20	IDGD	
O=C(NN=Cc1cnc2cnc(Br)cn12)c1csc(N2CCOCC2)n1	746369163	SYAREQNDGWYJAJ-UHFFFAOYSA-N	436.295	1.549	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(CC(=O)NNc2ccccc2Br)C(=O)C1	748070270	KFYWVOQTMDTJTL-UHFFFAOYSA-N	427.299	1.972	50	20	IDGD	
O=C(NNC(=O)c1ccc(NS(=O)(=O)c2ccc(F)cc2)cc1)C(=O)N1CCCC1	748246014	CRHBVSRRAGEUIC-UHFFFAOYSA-N	434.449	1.010	50	20	IDGD	
O=C(NCCC1CCN(CC(F)(F)F)CC1)NNC(=O)c1cc([N+](=O)[O-])ccc1O	748966557	LINGTMIDXRVCRK-UHFFFAOYSA-N	433.387	1.909	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-]	751203435	PKFAXBXYIOGYCF-UHFFFAOYSA-N	430.295	1.320	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(C(F)(F)F)cc1Cl)N[C@H]1CCS(=O)(=O)C1	751540924	NCKMOVAXKDVFRE-QMMMGPOBSA-N	435.833	1.038	50	20	IDGD	
C[C@H](NC(=S)NNC(=O)c1cc(S(=O)(=O)N2CCC[C@@H](C)C2)cn1C)C1CC1	751617831	LEQXYMAMQQYNTQ-OLZOCXBDSA-N	427.596	1.353	50	20	IDGD	
O=C(NNC(=O)N1CCO[C@@]2(CCc3ccccc32)C1)C1CCN(c2ncccn2)CC1	753058264	QEMVKQVGXKBZFY-QHCPKHFHSA-N	436.516	1.608	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2ccc(C)o2)c(Br)cc1F	753080051	DUPRGAWGCFUDEX-UHFFFAOYSA-N	435.227	1.900	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)Nc2ccc(C)c(S(=O)(=O)NC)c2)cc1OC	755516632	VAAPKOPNMMBGPA-UHFFFAOYSA-N	436.490	1.777	50	20	IDGD	
CCOC(=O)Cc1cccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1	756671414	CSGHDSJSWXVTOG-UHFFFAOYSA-N	448.501	1.509	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)COc2ccc(C)cc2)cc1S(=O)(=O)NC1CC1	756682954	QTNNENNXNYZVIX-UHFFFAOYSA-N	448.501	1.676	50	20	IDGD	
CCNC(=O)N1CCc2ccc(NC(=O)NNC(=O)c3cncc(NC(C)=O)c3)cc21	756736355	FIJXYROSJGYQJP-UHFFFAOYSA-N	425.449	1.599	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)COc2ccc(C#N)cc2)cc1N1CCOC1=O	756816920	CYFSUDNKKJTCOK-UHFFFAOYSA-N	425.401	1.755	50	20	IDGD	
O=C(Cc1ccc(Cl)cc1)NNC(=O)Nc1ccccc1OCC(=O)N1CCOCC1	756875232	UOHMZWKFSHENSA-UHFFFAOYSA-N	446.891	1.973	50	20	IDGD	
CCOC(=O)c1cn(C)nc1NC(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12	757924818	AYOPMRHUDOUAFY-UHFFFAOYSA-N	441.448	1.354	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)Cc1cccc(OCc2cccc(Cl)c2)c1	758029010	HTFXSQQFCLFABQ-CYBMUJFWSA-N	439.921	1.547	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1cc(Cl)ccc1Oc1ccc(F)cc1	758041335	YGYICNHKIYCYTO-JTQLQIEISA-N	429.857	1.970	50	20	IDGD	
O=C(c1cc(-c2ccccc2F)on1)N1CCN(S(=O)(=O)CBr)CC1	758528740	XKNVGVBYPKWSKL-UHFFFAOYSA-N	432.271	1.921	50	20	IDGD	
CCC(=O)N1CCCC[C@H]1C(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758785340	FAPJDMRSJIEFOY-HNNXBMFYSA-N	425.530	1.413	50	20	IDGD	
CS(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1Cl	759386753	BSDYJAGMAGYUFU-UHFFFAOYSA-N	426.838	1.796	50	20	IDGD	
O=C(N=c1cc[nH]cc1I)NNC(=O)c1ccc2c(c1)OCCO2	760027878	DBUJBNMWWNAGPR-UHFFFAOYSA-N	440.197	1.346	50	20	IDGD	
CCC(=O)NNC(=O)C(=O)Nc1ccc(C)c(S(=O)(=O)Nc2ccccc2OC)c1	763441075	QYFIHKIYERJXOB-UHFFFAOYSA-N	434.474	1.300	50	20	IDGD	
CCC(=O)NNC(=O)C(=O)Nc1cc(Br)ccc1I	763444681	ZUVVNNOYHUVPHM-UHFFFAOYSA-N	440.035	1.550	50	20	IDGD	
COC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3n2)cc1F	763467587	UWUOWSQTLHMRJW-UHFFFAOYSA-N	425.376	1.952	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1ccccc1CN1CCSCC1	763468387	JWVLYXXHZPIJFK-UHFFFAOYSA-N	443.485	1.543	50	20	IDGD	
O=C(NNC(=O)c1ccccc1Br)C(=O)Nc1cccc(N2CCOC2=O)c1	763484390	ZGOLMBAEHYFLGP-UHFFFAOYSA-N	447.245	1.805	50	20	IDGD	
O=C(NNC(=O)c1cc2ccccc2cc1O)C(=O)Nc1cc(-n2cnnn2)ccc1F	763522665	NZKXGLOYDXDMTI-UHFFFAOYSA-N	435.375	1.060	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)ccc1NC(C)=O	763728420	POVAMTMRQUKSGW-UHFFFAOYSA-N	439.472	1.192	50	20	IDGD	
NC(=O)COc1cccc(NC(=O)C(=O)NNC(=O)CSc2ccc(Cl)cc2)c1	763733786	IWEVJIRKJAKJFZ-UHFFFAOYSA-N	436.877	1.082	50	20	IDGD	
CN(C)C(=O)COc1ccc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCC3)cc1	763775868	WSCZCCMXWZZJGH-UHFFFAOYSA-N	430.486	1.104	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)C(=O)Nc2cc(F)c(F)c(F)c2)c2ccccc2c1=O	763789861	DJXONAONKFXQRR-UHFFFAOYSA-N	447.373	1.794	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)C(=O)N1CCc2c1cccc2C(F)(F)F	763790569	LELXMHDAJKXEMT-UHFFFAOYSA-N	445.357	1.705	50	20	IDGD	
CN(C)c1ccc(NC(=O)C(=O)NNC(=O)c2nnc(O)c3ccccc23)cc1Cl	763791547	VNINXARDXKHCAH-UHFFFAOYSA-N	428.836	1.455	50	20	IDGD	
CCCNS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(CC)cc2)cc1	763829826	NBXAXQQVGPCRFH-UHFFFAOYSA-N	432.502	1.337	50	20	IDGD	
COC(=O)CCc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)cc1	763852677	XHDBLMIMJYIQGA-MRXNPFEDSA-N	441.484	1.962	50	20	IDGD	
CN(C)C(=O)c1ccccc1NC(=O)C(=O)NNC(=O)c1ccc(Br)s1	763940588	KFMFLPNRYLYUEX-UHFFFAOYSA-N	439.291	1.612	50	20	IDGD	
COc1cc(C(=O)N(C)C)ccc1NC(=O)C(=O)NNC(=O)c1cccc2ccccc12	764052928	ZFSMLLGNDUWZNE-UHFFFAOYSA-N	434.452	1.950	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cccc(Br)c2)ccc1F	764062924	FXUBHUZVFUFPBQ-UHFFFAOYSA-N	438.209	1.775	50	20	IDGD	
O=C(NNC(=O)c1ccc(F)cc1Br)C(=O)Nc1ccc2c(c1)C(=O)NCC2	764083920	CMSWVIFLEQLOOR-UHFFFAOYSA-N	449.236	1.274	50	20	IDGD	
CCOCCOCc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(C)cc2O)c1C	764105187	LTNWQEXDXJBTAL-UHFFFAOYSA-N	429.473	1.962	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccc(-n2nc(C)cc2C)c(F)c1	764138830	KOCQGIIGEDKDJV-UHFFFAOYSA-N	439.447	1.965	50	20	IDGD	
CC(C)N1CCN(c2cccc(NC(=O)C(=O)NNC(=O)CCc3ccccc3)c2)CC1	764192783	LPMCZGYZTGTDGB-UHFFFAOYSA-N	437.544	1.936	50	20	IDGD	
O=C(CCC1CCCCC1)NNC(=O)C(=O)Nc1ccc(N2CCCS2(=O)=O)cc1	764218653	SJYUJNZYXFKZHM-UHFFFAOYSA-N	436.534	1.673	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cccc(C#N)c2)ccc1-n1nnnc1C(C)C	764236279	CTDKQFXIILQWLP-UHFFFAOYSA-N	432.444	1.366	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)C(=O)Nc1ccc(NC(=O)C2CC2)nc1	764351523	SJJBORFSCGERTQ-UHFFFAOYSA-N	433.428	1.016	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cc(C(N)=O)ccc3F)n[nH]2)cc1	764385312	WTMDSSZGWYGFMT-UHFFFAOYSA-N	438.419	1.277	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc(C(N)=O)cc3F)n[nH]2)cc1C	764388061	OWMNEHWOAJIDCY-UHFFFAOYSA-N	438.419	1.331	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)CCC(=O)N1CCN(c2ccccn2)CC1	764553145	RYVWHJDXGZSVSB-INIZCTEOSA-N	443.479	1.264	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)[C@H](C)NS(=O)(=O)c2ccc(C#N)cc2)cc1OC	764576106	ZAZPVWWLMISCHY-ZDUSSCGKSA-N	446.485	1.094	50	20	IDGD	
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	765316497	SUGGWACXMMLBQH-KXBFYZLASA-N	445.545	1.946	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1ccc2c(c1)CCCC(=O)N2	766643739	RUVIFQFHYLIQKJ-UHFFFAOYSA-N	449.511	1.180	50	20	IDGD	
CCn1c(=O)nc(O)c2c(C(=O)NNc3ccccc3S(C)(=O)=O)cc(C(C)C)nc21	766662767	MLHFITAYBYJPLO-UHFFFAOYSA-N	445.501	1.801	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)c3cc(S(=O)(=O)N(C)C)ccc3O)cc2C1	766967831	CSMLKBXMKIASCN-LLVKDONJSA-N	437.543	1.904	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)[C@@H]1CCC[C@H]1NC(=O)OC(C)(C)C	767343574	BIOAHBKUGAIOAS-IAGOWNOFSA-N	433.505	1.922	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)c1cc(S(C)(=O)=O)cc(Br)c1C	767350835	PNKKGIFJMHMMFP-UHFFFAOYSA-N	448.339	1.227	50	20	IDGD	
O=C(COc1ccccc1O)NNS(=O)(=O)c1ccc(OC[C@@H]2CCOC2)c(F)c1	767764647	FSRLIZDCMRYKCA-CYBMUJFWSA-N	440.449	1.335	50	20	IDGD	
CC(C)(O)C(=O)NNC(=O)CSc1nnc(COc2ccccc2)n1Cc1ccco1	768241389	NCHCIIKZLRRHRK-UHFFFAOYSA-N	445.501	1.509	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)CN(C)S(=O)(=O)c3cccnc3)n[nH]2)c1	768264300	GVKUYFANQISAND-UHFFFAOYSA-N	442.501	1.170	50	20	IDGD	
C=CCNC(=S)NNC(=O)COc1ccc(N(C)S(=O)(=O)c2cccs2)cc1	768264885	QOKZHIJESNZCQL-UHFFFAOYSA-N	440.572	1.633	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1ccc(Br)cc1Br	768273105	ZGSPFGYRMGKOPO-SSDOTTSWSA-N	440.113	1.407	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3ccc(N4CCCC4)nn3)n[nH]2)cc1OC	768275748	GKCFHDVENOPOAY-UHFFFAOYSA-N	437.460	1.559	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=S)Nc2ccccn2)ccc1OC	768583664	FIZAUEFEBUNGRE-UHFFFAOYSA-N	437.547	1.752	50	20	IDGD	
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC[C@H](C(=O)NNc2cc(C#N)cc(Cl)n2)C1	768695845	RMDPXASIEVLLIM-ZDUSSCGKSA-N	437.913	1.491	50	20	IDGD	
COCCCNC(=S)N(C)NC(=O)[C@@H]1CC(=O)N(c2cc(Cl)ccc2OC)C1	768735391	KTPWGTKZCBAYDD-GFCCVEGCSA-N	428.942	1.576	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)NCc1cc(S(N)(=O)=O)ccc1F	770626917	XAFFVYKYTFDSNL-JTQLQIEISA-N	444.872	1.424	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N[C@H]2CC(=O)N(c3c(F)cccc3F)C2)cc1OC	770758064	QYLITYZRVMBIRV-LBPRGKRZSA-N	434.399	1.732	50	20	IDGD	
C[C@H]1CN(c2ccnc(C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)c2)C[C@H](C)O1	772224502	PCVQFDOHMSISAR-HOTGVXAUSA-N	439.520	1.163	50	20	IDGD	
O=C(NNC(=O)N1CCC(Oc2ncccc2F)CC1)C1CCN(c2ncccn2)CC1	772359460	SMRURLNRPIJNPV-UHFFFAOYSA-N	443.483	1.511	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)C(=O)Nc2ccc(S(=O)(=O)N3CCC[C@H](C)C3)cc2)n1	773478280	OAPCUGGKSWEORL-ZDUSSCGKSA-N	446.533	1.596	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cc(C(F)(F)F)ccn2)cc1	773530052	SZDPDIKHHIBRDA-LLVKDONJSA-N	438.362	1.856	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)CN[C@@H](C)c1ccc(S(=O)(=O)N(C)C)cc1	775194332	XHCMKCLFKUQXDN-INIZCTEOSA-N	432.546	1.286	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CN2CCN(c3nnc(C(F)(F)F)s3)CC2)c1	776860345	BJGUSPAETCKOKK-UHFFFAOYSA-N	439.423	1.012	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNS(=O)(=O)c1cc(Br)sc1Cl	777941732	VXMWIUZHCUHMAN-UHFFFAOYSA-N	448.748	1.998	50	20	IDGD	
CCOC(=O)N1[C@@H](C(=O)NNC(=O)CNC(=O)OC(C)(C)C)CC[C@@H]1c1ccc(C)o1	778441536	LWLWSPJNURUWFH-ZIAGYGMSSA-N	438.481	1.922	50	20	IDGD	
C[C@@H](C1CC1)n1cc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)cn1	778696742	AILWUGOEAKZCTP-JTQLQIEISA-N	427.433	1.932	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)C[C@@](C)(O)c2ccccc2)c1	780849716	NQJIBRHIRYQVMQ-OAQYLSRUSA-N	433.530	1.776	50	20	IDGD	
CN1C[C@@H](C(=O)NNC(=O)COc2ccc(Br)cc2)c2ccccc2C1=O	781855414	KAIZUSIAQOCPJA-MRXNPFEDSA-N	432.274	1.845	50	20	IDGD	
CCCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)Nc2ccccc2C)cc1	783416363	UCRCIQIRYMYUEK-UHFFFAOYSA-N	433.490	1.938	50	20	IDGD	
Cc1cccc(-n2nc(C(C)(C)C)cc2NC(=O)C(=O)NN[C@@]2(C)CCS(=O)(=O)C2)c1	783428669	YGAZERHVGHNZHU-NRFANRHFSA-N	447.561	1.615	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)C(=O)Nc1cccc(N2CCCCCC2)c1	784002926	XNQGOUYBKUZQID-UHFFFAOYSA-N	427.461	1.176	50	20	IDGD	
CN(c1ccccc1)S(=O)(=O)c1cccc(NC(=O)C(=O)NNc2ccccn2)c1	784794239	KBZUUEMKHPAYDQ-UHFFFAOYSA-N	425.470	1.989	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)Nc1ccc(-c2nccs2)cc1	785023969	SLKXKCSPOSJWAI-UHFFFAOYSA-N	427.398	1.824	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN1C1CC1)c1cccc(S(=O)(=O)NCc2ccccc2)c1	786635722	WPBVOGVSIZZNML-FQEVSTJZSA-N	442.541	1.553	50	20	IDGD	
COc1cc(C=O)c([N+](=O)[O-])cc1OCC(=O)NNC(=O)NCc1ccc(Cl)cc1	787423691	BZLAVUGUMKZSHS-UHFFFAOYSA-N	436.808	1.979	50	20	IDGD	
Cc1cc(F)c(Br)cc1NC(=O)C(=O)NNC(=O)COc1ccc(C#N)cc1	789585665	BMTCQVKJNNMBTQ-UHFFFAOYSA-N	449.236	1.933	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)N[C@@H](C)c2nnnn2C2CC2)c2ccccc2c1=O	790712002	YMIDEBMQAMLBPT-NSHDSACASA-N	425.453	1.004	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)[C@@H]1CCN(CC(F)(F)F)C1	792210200	RSGQPKIHPDSKAQ-CYBMUJFWSA-N	436.456	1.035	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)C(C)(C)c2cc(F)cc(C#N)c2)c1	794763319	BPOSIMGPTXEDBJ-UHFFFAOYSA-N	432.477	1.686	50	20	IDGD	
Cc1ccc(N2CCOCC2)cc1NC(=O)C(=O)NNC(=O)Cn1ccc2ccccc21	797535922	RVBABTCATQDBLM-UHFFFAOYSA-N	435.484	1.572	50	20	IDGD	
N#Cc1nc(-c2ccco2)oc1N1CCC(C(=O)NNC(=O)NCC(F)(F)F)CC1	798315856	CMAAVKGIXRACHQ-UHFFFAOYSA-N	426.355	1.915	50	20	IDGD	
COC(=O)NNC(=O)c1ccc(I)c(I)c1	799102195	UNTDBMHSFOFZJP-UHFFFAOYSA-N	445.982	1.897	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(O[C@@H]3CCN(C)C3=O)cc2C)cc1	799258421	CHLHICMWPFMYPV-LJQANCHMSA-N	438.484	1.567	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)NCCN2CCN(C)C(C)(C)C2)cc1Cl	799395911	CRICJRYLYXQYDR-UHFFFAOYSA-N	442.948	1.719	50	20	IDGD	
NS(=O)(=O)Cc1cccc(CNC(=O)NNC(=O)c2cccc(OC(F)F)c2)c1	799916140	IQMQJPBYXCGLHO-UHFFFAOYSA-N	428.417	1.221	50	20	IDGD	
CCS(=O)(=O)N1CCC(C(=O)NNc2cc([N+](=O)[O-])ccc2Br)CC1	800617202	ZSCLTSGEJVFANZ-UHFFFAOYSA-N	435.300	1.862	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)C[C@](O)(c2nc(C)cs2)C(F)(F)F)cc1	801106367	VJXVIOVWDGVTEH-INIZCTEOSA-N	430.408	1.686	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2n[nH]c3c2CN(C(=O)OC(C)(C)C)CC3)cc1	801108404	NCQCRBRSYTVLCP-UHFFFAOYSA-N	442.476	1.411	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(N2CCOCC2)c(C(=O)NNC(=O)Nc2ccccc2)c1	801986133	YNRLASPMOZTWCO-UHFFFAOYSA-N	447.517	1.240	50	20	IDGD	
COc1ccccc1C(=O)N[C@H](CCS(C)(=O)=O)C(=O)NNC(=O)Nc1ccccc1	801987139	SYARRFUBXMMGTD-MRXNPFEDSA-N	448.501	1.081	50	20	IDGD	
O=C(NNc1ncccc1F)C1CCN(S(=O)(=O)c2ccc3c(c2)OCCO3)CC1	804216857	LLYCAOHWRYVABK-UHFFFAOYSA-N	436.465	1.536	50	20	IDGD	
O=C(CCCCCNS(=O)(=O)c1ccc2c(c1)OCCO2)NNc1ncccc1F	804217433	YXTQRTQQFKEDCE-UHFFFAOYSA-N	438.481	1.974	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)Nc2ccc(S(=O)(=O)[C@@H](C)C#N)cc2)cc1	806461562	SQPBPNLWCGTMHO-ZDUSSCGKSA-N	432.458	1.613	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cccnc2)c(C)cc1Br	806972254	NKNCRNNLDGSPMS-UHFFFAOYSA-N	435.234	1.339	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ccc(-n3ccnc3)nn2)c(OCC(F)(F)F)c1	807429311	STKGZOIZLPTBKJ-UHFFFAOYSA-N	435.366	1.994	50	20	IDGD	
CC1CCN(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)CC1	808068123	KNLNNPMWNUSPJL-UHFFFAOYSA-N	444.579	1.072	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)C(=O)Nc2cccc3c2COC3=O)c1	808935064	HHMZECAVQCONCN-UHFFFAOYSA-N	448.229	1.528	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)C(=O)OC3)c1	808935391	VREQZVCOTUABCI-UHFFFAOYSA-N	448.229	1.528	50	20	IDGD	
O=C(COC(=O)[C@@H]1CCN(c2ccccc2F)C1)NNC(=O)c1ccc([N+](=O)[O-])cc1	811377600	CYJLHXUNBJNGOA-CQSZACIVSA-N	430.392	1.565	50	20	IDGD	
CCn1nc(C)c(C(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)n1	814874883	IMWRFEXBQCLLMI-UHFFFAOYSA-N	431.460	1.383	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2cccc(Cl)n2)cc1-n1nnnc1C1CC1	815726104	OYWPTBPMBINVSY-UHFFFAOYSA-N	428.840	1.679	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)CCN1CCN(c2ccccc2)CC1	817053128	DRUUREGTQYCITO-UHFFFAOYSA-N	431.562	1.592	50	20	IDGD	
CCOC(=O)c1ccc(C(=O)NNC(=O)[C@H]2CCCN(C(=O)OC(C)(C)C)C2)nc1C	819659117	SWKSBDRZGKWDGL-AWEZNQCLSA-N	434.493	1.975	50	20	IDGD	
CS(=O)(=O)c1cc(S(=O)(=O)NNC(=O)c2ccc3ccccc3n2)ccc1Cl	821116406	NIOVOZWNUNHJGM-UHFFFAOYSA-N	439.902	1.915	50	20	IDGD	
O=C(COC(=O)/C=C\c1nc2ccccc2s1)NNC(=O)[C@H]1COc2ccccc2O1	849190090	YVPJNEBVTHJHQA-ZBTGYSDGSA-N	439.449	1.840	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(/C#N)C(=O)O[C@@H](C)C(=O)N2CCN(C(C)=O)CC2)c1C	853647613	BIJUKLDXATVEAV-QIQVEEHJSA-N	444.532	1.842	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H](C)NC(=O)C(C)(C)C)c1	875538002	CMQVDYWNXJGTRX-CYBMUJFWSA-N	426.539	1.029	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)CSCc2cc(=O)n3ccsc3n2)cc1	887923491	CCBXTYOLQRLDCT-UHFFFAOYSA-N	429.483	1.087	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)O[C@@H](C)C(=O)N2CCC(C(N)=O)CC2)c1C	913026860	ARULAEZITAAACC-QUYZQLMHSA-N	430.505	1.314	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)NCCNS(=O)(=O)c1cccc(Cl)c1	914598876	YGZCXPULRFJNJB-UHFFFAOYSA-N	444.872	1.167	50	20	IDGD	
CS(=O)(=O)CC[C@@H](NC(=O)c1ccccc1Cl)C(=O)NNC(=O)C1CCCC1	914848952	LBGVPAJRRXMDPW-OAHLLOKOSA-N	429.926	1.211	50	20	IDGD	
CN(C)c1ccc([C@H](CNC(=O)NNC(=O)C(=O)NC2CC2)c2c[nH]c3ccccc23)cc1	915889386	BKMUHPWIYFYDJS-IBGZPJMESA-N	448.527	1.975	50	20	IDGD	
CCNC(=O)COc1ccc(C=NNC(=O)Cn2nnc(-c3ccccc3)n2)cc1OC	915907259	VCZBZGYUXAYCMX-UHFFFAOYSA-N	437.460	1.014	50	20	IDGD	
Cc1oc(C(=O)NNC(=O)c2cn(C)c3ccccc23)cc1S(=O)(=O)N1CCCC1	916146400	PXEYVXOZDYZBCS-UHFFFAOYSA-N	430.486	1.939	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NCCCN2CCN(c3ccccc3)CC2)cc1	916487454	DZKYIAGHNMMOJP-UHFFFAOYSA-N	425.533	1.917	50	20	IDGD	
COc1cc(C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)cc(Cl)c1OCCC(C)C	919884329	HWNHANYYOPTCJL-ZDUSSCGKSA-N	447.941	1.905	50	20	IDGD	
CN(C)C(=O)C[C@@H](NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)c1ccccc1	920048234	XWIRRMZMAQEOFW-QGZVFWFLSA-N	436.472	1.097	50	20	IDGD	
CCOc1ccc(NC(=O)CNC(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)cc1	920342979	LUHISPJNKMWIKE-UHFFFAOYSA-N	446.460	1.694	50	20	IDGD	
O=C(NC[C@]1(N2CCOCC2)CCSC1)NNC(=O)c1ccc(Br)cc1	1115884827	XMCIDHBZVPGALB-QGZVFWFLSA-N	443.367	1.601	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCc2ccc(S(=O)(=O)N(C)C(C)C)cc2)cc1	1317971552	AIIDQQOAENJZBX-UHFFFAOYSA-N	434.518	1.868	50	20	IDGD	
COc1ccc(OCCCS(=O)(=O)NNC(=O)c2cncn2-c2ccccc2)cc1	1318199276	IXDWVTSVMCJFGQ-UHFFFAOYSA-N	430.486	1.914	50	20	IDGD	
CNS(=O)(=O)c1ccc(Br)c(C(=O)NNC(=O)c2ccc(Cl)nc2)c1	1323824151	XXXSWLPBACALFA-UHFFFAOYSA-N	447.698	1.480	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4c(cnn4C)c3)C2)C1	1778025430	ZGBXZDPRDJORDT-YJYMSZOUSA-N	435.322	1.800	50	20	IDGD	
O=C(C#CC1(O)CCCCC1)N1CC[C@@]2(C1)CN(C(=O)CCBr)CCO2	1779062600	MDYRKXVDODZCLB-LJQANCHMSA-N	427.339	1.300	50	20	IDGD	
Cc1ccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](F)Br)C3)c(O)n1	1780140428	HHTLVDRABNUPJR-QWQRMKEZSA-N	444.301	1.914	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)CCN3C(=O)c4ccccc4C3=O)CCO2)C1	1781215664	UTUDDOIGXDSNMQ-VGOFRKELSA-N	447.919	1.520	50	20	IDGD	
CC(C)(C)OC(=O)N[C@]1(C(=O)N2CC[C@]3(CN(C(=O)[C@@H](F)Cl)CCO3)C2)CCOC1	1781308797	IRANNCQFXDRBJX-ZNZDAUKMSA-N	449.907	1.035	50	20	IDGD	
COc1ccc(CCC(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](F)Br)C3)C2)cn1	1781325339	BPMICCWYRZLEFL-WMZOPIPTSA-N	444.301	1.543	50	20	IDGD	
COc1cc(CCC(=O)N2CCO[C@]3(CCN(C(=O)[C@H](F)Br)C3)C2)ccn1	1781326757	SVAOJJYGLOGJNF-FUHWJXTLSA-N	444.301	1.543	50	20	IDGD	
O=C(c1ccc2ncoc2c1)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781330138	RCBIMIGXZNNKBS-PBHICJAKSA-N	426.242	1.962	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnn3ncccc13)C2	1782172613	HRQFESXYCABJOU-WRWLIDTKSA-N	435.912	1.111	50	20	IDGD	
O=C(c1cc2cccnn2c1)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1782385687	GXAOPGCBPSGCAS-WMLDXEAASA-N	425.258	1.468	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccn4nccc4c3)CCO2)C1	1783349572	NTZYIWLNHBLCRL-APWZRJJASA-N	435.322	1.951	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc4c(c3)CC(=O)N4)CCO2)C1	1783533750	GZMNMRBMPHVVGU-BLVKFPJESA-N	436.306	1.408	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cc4cccnc4nc3O)CCO2)C1	1783538508	XSKIIOOXAFQPSJ-BUXKBTBVSA-N	449.305	1.562	50	20	IDGD	
O=C(Cc1ccc(F)cc1Cl)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21	1784926129	FJGDGTOFJVQBNQ-CSFVBSKPSA-N	433.307	1.601	50	20	IDGD	
CCOc1cnc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)Br)C[C@@H]32)cn1	1785611278	WXRLSKVEHJWSGK-OSFYFWSMSA-N	441.326	1.252	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)c1ccnc(C(F)(F)F)c1	1785822537	VBKRCYYTUUYSNA-XUXIUFHCSA-N	435.830	1.293	50	20	IDGD	
O=C(CC(F)(F)C(=O)O)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1	1788143651	JUXCNJVEWMIXMS-UHFFFAOYSA-N	446.215	1.224	50	20	IDGD	
O=C(C/N=C/c1ccco1)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1	1789577450	ZXIVLWUPPUPBTI-CVKSISIWSA-N	445.284	1.826	50	20	IDGD	
COC[C@@H](NC(C)=O)C(=O)Nc1ccc(C2(NC(=O)[C@H](F)Br)CCC2)cc1	1789660310	RBJLJTPZPWFTMR-CABCVRRESA-N	444.301	1.962	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCCn3ccnc3)C[C@@H]21	1789872221	DRJNTTKBRVBFRH-FPXQBCRKSA-N	431.364	1.879	50	20	IDGD	
CCc1ccnc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]3C2)c1	1789922696	LHHXBRGZYBGMPC-DARAHFNDSA-N	428.302	1.928	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(O)cc([N+](=O)[O-])c3)[C@H]2C1	1790216409	WVJRBGAZDOHRFL-UQCMEYCASA-N	425.869	1.911	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnn4c3CCC4)[C@H]2C1	1790388451	UOCBQJRMJUYRKG-HPZZRFSDSA-N	439.354	1.454	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN3CCC(C)CC3)C[C@@H]21	1790957870	APFVJBUTLSMKMU-XSLAGTTESA-N	444.414	1.872	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccn(C)n3)C[C@@H]21	1790961981	SXTJZVXZDOTYKO-TUUVXOQKSA-N	427.343	1.116	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)Br)C[C@@H]21	1790964432	PZKMYZKFNFWAFF-SJHCENCUSA-N	440.176	1.923	50	20	IDGD	
CC(C)c1nc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](C)Br)[C@H]3C2)no1	1791057443	UYPZFTWVEUBMBM-XUXIUFHCSA-N	443.342	1.499	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]3C2)c(F)c1	1791293942	PZPSSGREYRWBBH-IEZWGBDMSA-N	434.512	1.100	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3COc4ccccc4O3)C[C@@H]21)C(Cl)Cl	1791294353	ZDOZDUJTDCBGKL-APYUEPQZSA-N	429.300	1.610	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)CBr)o1	1792871362	WHERHQZBPVKUDO-YGSHXTJESA-N	442.310	1.472	50	20	IDGD	
CC(C)c1nc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)Br)C3)no1	1794003027	KQAAKCCCDSUDTJ-OHTBPHCPSA-N	429.315	1.109	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1csc(C)n1	1794082095	LALYDRDNFQZYPY-LMWOUKEDSA-N	430.368	1.757	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1CCC1	1795019381	GCQAZBDHBVKLQY-CCWDJLKJSA-N	431.445	1.523	50	20	IDGD	
CCn1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C3)n1	1795252630	GADFJTYEFAWVDP-YDOXXCSQSA-N	425.493	1.289	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](CN)c1ccccc1	1795676992	WEQVKCCQKYGACJ-ADHGMGHFSA-N	438.366	1.492	50	20	IDGD	
Cc1nc2cc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3ccc(B(O)O)cc3)ccc2s1	1796189003	LJQCFWYERILGJL-REPLKXPHSA-N	449.341	1.850	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cn1ccnn1)[C@@H](Br)Cc1ccccc1	1796336446	WYVTWBSPRJWUMN-MHORFTMASA-N	446.349	1.923	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCn1c(=O)oc3ccccc31)C2)[C@@H](F)Cl	1796361797	NVGONUSXVFFCTO-CZAMWMTLSA-N	425.844	1.109	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnc2ccccn12	1796954858	XOXUTZVVPNEGDG-UMPJEAMMSA-N	435.322	1.711	50	20	IDGD	
CC(=O)OC[C@@H](OC(C)=O)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@](C)(Cl)CCl	1800080995	YXFIFKAAPZRJJA-VTWRMFPLSA-N	437.320	1.356	50	20	IDGD	
Cc1ccc(OCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)Br)cc1	1800756196	HCZNGGYOXCPCIN-ZXFNITATSA-N	425.323	1.747	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc3c1OC(C)(C)C3)C2	1800974791	AQANXJJSQQVUHG-CYGHRXIMSA-N	436.936	1.857	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CC[C@@H]1CNc3ccccc3C1)C2	1800975834	VEIRSBHRYIXOHA-WTLZFGJLSA-N	449.979	1.894	50	20	IDGD	
CC#C[C@H](CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](Cl)COC)c1ccc(O)cc1	1800981816	SGUPVUULPOKUAJ-IEATVEBOSA-N	448.947	1.733	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CCc2ccccc2O1	1802240074	VOWRBSAFZGOIOV-DMUMMCEESA-N	428.533	1.391	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)Cc2ccccc2)[C@H]1c1cccnc1)[C@H](O)CCl	1803146505	BHVLIHFTDNEWJB-NMLBUPMWSA-N	431.920	1.291	50	20	IDGD	
Cc1ccn2c(=O)c(C(=O)N3CCC4(CCCN(C(=O)[C@H](O)CCl)C4)CC3)cnc2c1	1805523921	GAPFWXCCGKNQQE-QGZVFWFLSA-N	446.935	1.447	50	20	IDGD	
O=C(Cc1ccsc1)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1807559796	QOUMKQYOEYINNG-KNQAVFIVSA-N	449.341	1.385	50	20	IDGD	
Cc1noc(C)c1C(=O)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1	1809967642	ARRLXCJKJFSLCM-UHFFFAOYSA-N	425.294	1.130	50	20	IDGD	
O=C1Cc2cccc(C(=O)NC[C@@H]3CCN(C(=O)[C@H](O)CCl)[C@H]3c3cccnc3)c2N1	1812207978	LZUYKQMSYPITBG-VPWXQRGCSA-N	442.903	1.496	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2cc(F)c[nH]2)[C@H]1c1cccnc1	1812922367	WJVFATSIMIBXHT-MGPUTAFESA-N	430.484	1.241	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)CCC(F)(F)F)[C@@H]1c1cccnc1	1813071128	NMJDJZIOVOMEHP-DNVCBOLYSA-N	443.470	1.803	50	20	IDGD	
O=C(CCn1cncn1)NC[C@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1	1813318991	ZKRZPDODQOVAPP-QAPCUYQASA-N	435.326	1.554	50	20	IDGD	
N[C@@H](C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCBr)CC2)c1ccccn1	1815011782	HXWMHVVKQIHLIH-MEBBXXQBSA-N	438.351	1.935	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@](C)(Cl)CCl)CC2	1817020626	BKPQYKHOEOYTAR-GLSBUQGYSA-N	436.365	1.738	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnc(N)s2)n[nH]1	1817417783	NXPBQNHOQSETOF-GFCCVEGCSA-N	434.526	1.127	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)[nH]n1)[C@H](F)Cl	1818045619	ZDFNQKMQSIIHTL-ZANVPECISA-N	433.918	1.797	50	20	IDGD	
Cc1c[nH]cc1C(=O)N[C@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1	1819797694	XWKAVBPLXIIRJQ-NSHDSACASA-N	439.501	1.318	50	20	IDGD	
CC[C@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](C)NS(=O)(=O)CC)[nH]n1	1820855770	WXVPJMJHMZXSPR-DYEKYZERSA-N	433.962	1.747	50	20	IDGD	
CCOC(=O)C1(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)[C@@H](Cl)COC)[nH]n2)CC1	1821805241	GRSDQSXRLXZMFI-JSGCOSHPSA-N	426.901	1.999	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(O)nc(O)n1)CC2	1822863064	FRQLIIBPDZHTBB-GYKQLYQFSA-N	446.316	1.806	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827049109	LSTXPJUOKJEBJN-IBGZPJMESA-N	434.773	1.865	50	20	IDGD	
CCOC(=O)N[C@H](O)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CO[Si](C)(C)C)CC1	1828760547	CPMYDQXQWGRGAW-SJLPKXTDSA-N	443.617	1.522	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2n[nH]cc2[N+](=O)[O-])CC1	1829163787	NMGQIVYQZATDMW-KGLIPLIRSA-N	427.889	1.805	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3cnc4ccccn34)CCO2)C1	1830655483	SJAVZKXTZLEYSQ-JOCHJYFZSA-N	448.951	1.598	50	20	IDGD	
Cc1cc2cc(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)[C@H](O)CCl)CCO4)ccc2[nH]1	1830735342	HHVMPQGFNDVFFY-WIYYLYMNSA-N	435.908	1.146	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(N(C)C)cn3)C2)C1	1831644266	SQIFNAHPSJGZAS-LAUBAEHRSA-N	438.956	1.625	50	20	IDGD	
CN1Cc2ccccc2C[C@@H]1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1832468854	SILBPZGRBVLPFO-OPYAIIAOSA-N	439.915	1.034	50	20	IDGD	
O=C(/C=C/c1cccnc1)N1CCO[C@@]2(COCCN(C(=O)CCBr)C2)C1	1833099652	FPRNUJHRDVDTJM-GNAXCBTBSA-N	438.322	1.336	50	20	IDGD	
CC(C)(C)[C@@H](O)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1833287886	QCSJDOJTAKKTNE-LSDHHAIUSA-N	436.366	1.656	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)Cn3cncn3)CC2)CC1	1834873835	OKHWJDFCPHTSEO-MRXNPFEDSA-N	441.374	1.023	50	20	IDGD	
CC[C@@H](Br)C(=O)NC1CCN(C2CCN(C(=O)c3cn[nH]c3)CC2)CC1	1836541869	KKJUYPLYOHVELX-MRXNPFEDSA-N	426.359	1.768	50	20	IDGD	
CCc1[nH]nc(C(=O)N2CCOC[C@@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)c1F	1837712413	PJSJTFXEDKPMDW-LJQANCHMSA-N	442.564	1.033	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)CC3CCC3)CC2)CC1	1838395526	YSDJYSTYNDFQHS-UHFFFAOYSA-N	443.548	1.488	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CC(c3ccccc3)=NN1)CCO2	1839636071	HHCGYRKAGFNFIN-LRXVAGHRSA-N	448.951	1.226	50	20	IDGD	
N#CCCC(=O)N1CCOC[C@]2(C1)CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)CCO2	1839743284	HSMDMKVNDYCVSA-BPNKPRMTSA-N	444.438	1.632	50	20	IDGD	
O=C1CCc2ccc(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)C(Cl)Cl)CCO4)cc21	1840190036	ZZUAUPRNMLUNCJ-HXUWFJFHSA-N	441.311	1.689	50	20	IDGD	
O=C(c1ccncc1-c1ccccc1)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843014223	LYPPKHVCVGSWBJ-UHFFFAOYSA-N	441.296	1.559	50	20	IDGD	
CCc1[nH]nc(C(=O)N2CCCC23CN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C3)c1Cl	1843109296	AZUCTNZSXOIBQR-FSJBWODESA-N	445.911	1.577	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)c2ccnc(Br)c2)C1	1844417918	BRFDRESILIQUJW-UHFFFAOYSA-N	438.326	1.034	50	20	IDGD	
O=C([C@H](F)Cl)N1CC2(CCCN2C(=O)c2n[nH]cc2I)C1	1844466301	DTRLHBYLURDZEZ-VIFPVBQESA-N	426.617	1.366	50	20	IDGD	
C[C@H]1C[C@]1(C)C(=O)N1CC2(CCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)C1	1845039274	YPOABBIFPKNQDF-JTSKRJEESA-N	427.549	1.582	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@]2(C(=O)N2CCCC23CN(C(=O)[C@H](O)CCl)C3)C1	1846127750	CDGSQJQIQXOYAM-ZSDSOXJFSA-N	441.956	1.437	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)c1ccc(N3C(=O)C=CC3=O)cc1)C2	1846365343	OPGZLAKWSFKVSG-MRXNPFEDSA-N	431.876	1.187	50	20	IDGD	
CS(=O)(=O)c1ccc(Cl)c(C(=O)N2CCCC23CN(C(=O)[C@@H](O)CCl)C3)c1	1846922076	ACKSYOAQIKLSLZ-AWEZNQCLSA-N	435.329	1.160	50	20	IDGD	
CC[C@@H](C)[C@@H](N)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1848099155	HIZAMBVBRRYDBL-OLMNGRFOSA-N	430.977	1.694	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)Cc1nc(C)sc1C	1848256711	RKHCJBHVYMWOGZ-XUYLAZSVSA-N	442.545	1.638	50	20	IDGD	
COc1cc(C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)ccc1OC(F)F	3489705	CKETWOXQMYUZFU-UHFFFAOYSA-N	439.327	1.823	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2cc(S(C)(=O)=O)ccc2C)c2ccccc2c1=O	15947391	KGEIXJSJHZJPIH-UHFFFAOYSA-N	442.497	1.593	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2Cc3c(OC)ccc(OC)c3[C@H](O)C2)cc1OC	26159838	CSJWVTFPVULZPU-OAHLLOKOSA-N	445.472	1.031	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)NCC(=O)Nc1ccc(-n2cccn2)cc1	725860304	KGYJWSTXZAYYFY-UHFFFAOYSA-N	432.444	1.411	50	20	IDGD	
COc1ccc(C2(CNC(=O)NNC(=O)CNC(=O)c3cccs3)CCOCC2)cc1	725873097	KEOQGWHZAKXKGN-UHFFFAOYSA-N	446.529	1.565	50	20	IDGD	
COCCCNC(=S)N(C)NC(=O)c1ccc(F)c(S(=O)(=O)N2CCCCC2)c1	726075755	FKWGYUWJDWTIJG-UHFFFAOYSA-N	446.570	1.488	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)CN2C(=O)N[C@](C)(c3ccccc3)C2=O)cc1F	727499186	OCTBTRHVDGEPBB-HXUWFJFHSA-N	445.476	1.619	50	20	IDGD	
COc1ccc(Cl)cc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)CN(C)C)c1	727761650	WXQGRUGOTJQQDB-UHFFFAOYSA-N	440.909	1.472	50	20	IDGD	
O=C(Cc1ccc(Cl)cc1)NNC(=O)[C@@H]1C[C@@H](O)CN1C(=O)OCc1ccccc1	727764675	GJOWGFZXDWRHPA-MSOLQXFVSA-N	431.876	1.802	50	20	IDGD	
COc1cccc(N2CC[C@H](NC(=O)NNC(=O)c3csc(N4CCOCC4)n3)C2)c1	728221092	OEEMIPKAIFOXOR-AWEZNQCLSA-N	446.533	1.211	50	20	IDGD	
Cc1ccc([C@]2(C)NC(=O)N(CC(=O)NNC(=O)c3cccc(OC(F)F)c3)C2=O)cc1	728488046	FWGXYHPDCKNKRE-NRFANRHFSA-N	446.410	1.825	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)[C@H]2CC(=O)N(Cc3ccco3)C2)c1	728527239	DJFSJBRCBHVOFZ-NSHDSACASA-N	436.262	1.860	50	20	IDGD	
O=C(NNC(=O)c1cccc(OC(F)F)c1)c1ccc(S(=O)(=O)NC2CC2)cc1	728544865	MYXXCJRXMVGNLY-UHFFFAOYSA-N	425.413	1.804	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3cc4c(s3)CCOC4)cc2)CC1	728607004	TYMJTQUOSVSXBQ-UHFFFAOYSA-N	436.559	1.514	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)[C@@H]2CCN(c3ccc4c(c3)OCCO4)C2=O)c1	730512206	JMSFXQGDXNHZRB-SFHVURJKSA-N	439.468	1.654	50	20	IDGD	
O=C(COc1ccccc1O)NNS(=O)(=O)c1ccc(C(=O)NCC(F)(F)F)cc1	730813272	CQJMJGBBZZTQSH-UHFFFAOYSA-N	447.391	1.073	50	20	IDGD	
C[C@H]1CCC[C@H](NC(=O)CN2CCN(CC(=O)NNC(=O)c3ccccc3Cl)CC2)C1	731214873	URIDLAYRVKLRBM-IRXDYDNUSA-N	449.983	1.414	50	20	IDGD	
CC1CCC(N2C[C@H](C(=O)NNC(=O)c3csc(N4CCOCC4)n3)CC2=O)CC1	731343770	RSKWMVTWKBLYQY-SHARSMKWSA-N	435.550	1.168	50	20	IDGD	
COc1ccc([N+](=O)[O-])cc1NS(=O)(=O)c1ccc(C(=O)NNC(=O)C2CCC2)cc1	732143852	HBGYLTOAIYQKFH-UHFFFAOYSA-N	448.457	1.965	50	20	IDGD	
CCN1C(=O)c2ccc(C(=O)Oc3ccc([N+](=O)[O-])c(C(=O)OC)c3)cc2S1(=O)=O	732653511	XQZZGEJTWLXWOX-UHFFFAOYSA-N	434.382	1.765	50	20	IDGD	
CC(C)(C)OC(=O)NCc1nc(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cs1	732751372	MZDQGZAQWQMTLU-UHFFFAOYSA-N	444.477	1.218	50	20	IDGD	
CCC[C@@H](C)C(=O)NNC(=O)Cn1c(=O)c2c(ncn2CC)n(Cc2ccccc2)c1=O	733129245	YZRWYXCRQWZULD-OAHLLOKOSA-N	440.504	1.012	50	20	IDGD	
O=C(O)COc1cccc(C=NNC(=O)CN2c3cccc4cccc(c34)S2(=O)=O)c1	733200833	CVULXJDQSZYGPY-UHFFFAOYSA-N	439.449	1.962	50	20	IDGD	
CCN1CCC[C@H]1CN1C[C@@H](C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)CC1=O	733362611	TYGCLUUOYDGONA-ZFWWWQNUSA-N	444.504	1.459	50	20	IDGD	
CCOc1cc(CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)ccc1OC	734007673	XQDRCWMBWYAKCB-UHFFFAOYSA-N	435.506	1.531	50	20	IDGD	
CC(=NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1)c1ccc(S(N)(=O)=O)cc1	734750038	TYOZOCHGWCDVBF-UHFFFAOYSA-N	439.538	1.757	50	20	IDGD	
Cc1c(C(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)cnn1-c1ccccn1	734824860	KGUXODOLSJZSOD-UHFFFAOYSA-N	443.508	1.919	50	20	IDGD	
O=C(Cc1ccc(S(=O)(=O)C(F)F)cc1)NNC(=O)c1cc(Br)c[nH]1	740815883	SWTQARVXJQFGKZ-UHFFFAOYSA-N	436.234	1.777	50	20	IDGD	
CC(=O)N[C@@H](CC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)c1ccc(F)cc1F	741660156	JEQSDJYYLVIZMA-KRWDZBQOSA-N	443.410	1.240	50	20	IDGD	
Cc1ccc([C@@H](CN2CCOCC2)NCC(=O)NNC(=O)Cc2nc(C)cs2)cc1	741907818	WFXZZIOLVCBXTC-GOSISDBHSA-N	431.562	1.113	50	20	IDGD	
CSc1nc(C2CC2)nc(C)c1C(=O)NNC(=O)c1csc(N2CCOCC2)n1	742240100	IXIWXLWJAJSRJL-UHFFFAOYSA-N	434.547	1.752	50	20	IDGD	
C[C@@]1(c2ccccc2)NC(=O)N(CC(=O)NNC(=O)Nc2ccc(OC(F)F)cc2)C1=O	743833259	MXQWNORSQCFSHW-FQEVSTJZSA-N	447.398	1.908	50	20	IDGD	
CN(CC(=O)NNC(=O)c1ccc(C#N)cc1)CC(=O)Nc1ccc(Br)cn1	744395984	BGQDBJKZZDIDRZ-UHFFFAOYSA-N	445.277	1.047	50	20	IDGD	
COCCOc1ccc(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)cc1	744619972	BYCXZJODBWJAPE-UHFFFAOYSA-N	435.502	1.490	50	20	IDGD	
COc1cc(C(=O)OCC(=O)NNC(=O)c2cccc(C)c2)cc(Cl)c1OCC(N)=O	744630538	RIENYOMOCQXPFO-UHFFFAOYSA-N	449.847	1.139	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)CC[S@@](=O)c1ccc2c(c1)OCCO2	746102355	AHOZAHKBZGEBQN-SSEXGKCCSA-N	428.470	1.373	50	20	IDGD	
CC(C)CN1CCC[C@@H](CNC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)C1	746328593	NJBHNXWEMZOYSD-HNNXBMFYSA-N	425.555	1.794	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)NCCCN1CCN(c2ccccc2)CC1	746750803	VUTSCBIXBMOBSJ-UHFFFAOYSA-N	435.532	1.420	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN(C)c2ccc(C(=O)N3CCOCC3)cc2C)n1	748828460	IXIMEZQQLSGYPH-UHFFFAOYSA-N	445.545	1.059	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CN2CCCN(C(=O)Cc3cccc(F)c3)CC2)c1	748836403	STAFOOYOIJNWSF-UHFFFAOYSA-N	437.475	1.235	50	20	IDGD	
COC(=O)c1ccc(S(=O)(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)cc1Cl	749755383	LHWMRBYBEOSOQC-UHFFFAOYSA-N	439.877	1.692	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)N[C@H]1CCN(c2cccc(Cl)c2)C1=O	750670928	PEBOVVLISOTTPM-INIZCTEOSA-N	427.848	1.726	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@](C)(C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)C1	751769099	KRKUNIUQVBMHLI-QFIPXVFZSA-N	444.488	1.900	50	20	IDGD	
CS(=O)(=O)CC1(CNC(=O)NNC(=O)c2ccc(Br)cc2Cl)CC1	752007328	SUSPLLNXWAUUFY-UHFFFAOYSA-N	438.731	1.871	50	20	IDGD	
CC[C@H](CNC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)Oc1cccc(F)c1	753349388	XYFYGRNYTXCVRQ-CQSZACIVSA-N	427.436	1.874	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)NC[C@H]2CCCN2S(C)(=O)=O)c1	753697552	OWQJTIDKIDZVOO-OAHLLOKOSA-N	426.539	1.252	50	20	IDGD	
COC(=O)c1c(Br)ccc(NC(=O)C(=O)NNc2nccc(OC)n2)c1C	753840449	HWQVHFIPGBLUIL-UHFFFAOYSA-N	438.238	1.425	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@@H]2[C@@H]3CCO[C@H]3C23CCCC3)c2ccccc2c1=O	755076939	DIJKBTXJUMVAQX-CGTJXYLNSA-N	425.489	1.708	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)CNC(=O)c1ccccc1C(F)(F)F	755376884	PLVVNANSEVZYOT-UHFFFAOYSA-N	447.414	1.290	50	20	IDGD	
O=C(CN1CCOCC1)Nc1ccc(NC(=O)NNC(=O)c2ccc(Cl)cc2O)cc1	755600770	VSHBRRJNJXYDNS-UHFFFAOYSA-N	447.879	1.783	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)Nc1cccc(N2CCS(=O)(=O)CC2)c1	756208192	VODBRTHSIXWZPZ-UHFFFAOYSA-N	432.502	1.291	50	20	IDGD	
CO[C@@H](C)C(=O)Nc1cccc(NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c1	756230427	WSCLSRYKXFOQRD-LBPRGKRZSA-N	434.474	1.530	50	20	IDGD	
COC(=O)CCOc1ccc(NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1	756277923	BFRGOEUTFYBRQB-UHFFFAOYSA-N	439.428	1.342	50	20	IDGD	
CC(=O)NCc1ccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1	756552680	GVFFJLXMHKJPND-UHFFFAOYSA-N	433.490	1.040	50	20	IDGD	
Cc1cc(Cl)ccc1OCCCC(=O)NNC(=O)Nc1cnn(CC(=O)N(C)C)c1	756803150	XGTYCNHXTDFGBC-UHFFFAOYSA-N	436.900	1.945	50	20	IDGD	
C[C@@H]1C[C@@H](C)CC2(C1)NC(=O)N(CC(=O)NNC(=O)c1cc(-c3ccccc3)on1)C2=O	756901056	HWJPQXGFEZMTDG-ZIAGYGMSSA-N	439.472	1.849	50	20	IDGD	
NC(=O)c1ccc(NNC(=O)[C@H](c2ccc(Cl)cc2Cl)N2CCOCC2)nn1	757403798	FVWLNDZUACWXPF-HNNXBMFYSA-N	425.276	1.399	50	20	IDGD	
O=C(Nc1ccc(C(=O)NNC(=O)C(=O)Nc2ccccn2)cc1)OCC(F)(F)F	758838901	JPOVWJMAHALVJF-UHFFFAOYSA-N	425.323	1.592	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)NC[C@H]2CN(Cc3ccccc3)CCCO2)cc1	759350417	DCWFXLRRJOVCAP-NRFANRHFSA-N	437.500	1.559	50	20	IDGD	
NC(=O)[C@H]1CC[C@@H](CNC(=O)NNC(=O)c2cn(-c3ccccc3)nc2-c2ccccc2)O1	760205199	XLRBNVCXJYLBEE-PKOBYXMFSA-N	448.483	1.516	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)N[C@@H]2CC[C@H]3SCCS[C@@H]23)cc1	762636197	YKLTZPPUYCLGTB-MCIONIFRSA-N	430.577	1.805	50	20	IDGD	
Cc1sc(Cl)nc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	762838875	SXAIBXPOTWNNFH-UHFFFAOYSA-N	428.923	1.964	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cn(CC(F)(F)F)nc2C)cc1	763120919	BLKLUDJELIWYGY-UHFFFAOYSA-N	447.439	1.144	50	20	IDGD	
Cn1c(=O)oc2cc(NC(=O)C(=O)NNC(=O)c3ccccc3Br)ccc21	763484045	WERMVEWBKWYBBI-UHFFFAOYSA-N	433.218	1.294	50	20	IDGD	
CC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)COc2cccc(C(F)(F)F)c2)cc1	763639648	KCPHMSMSGQXGEH-UHFFFAOYSA-N	438.362	1.829	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccn(Cc3ccccc3)c2=O)cc1C	763680592	RMBMWABUZXFRFL-UHFFFAOYSA-N	448.479	1.678	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cccc3c2OCCC3=O)cc1	763859448	BEGLKOZUEQADGE-ZDUSSCGKSA-N	441.440	1.604	50	20	IDGD	
CC(C)n1nccc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1cccc(Br)c1	763882316	IPKARFKISCLMCA-LLVKDONJSA-N	438.282	1.780	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)C2=S=C(c3ccc(F)cc3)C=C2)cccc1[N+](=O)[O-]	763975426	IQFZVCLYXUXSIS-UHFFFAOYSA-N	442.428	1.824	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc(C(=O)NCC(F)(F)F)cc1	764047531	GXIJMCLFSJLHKA-UHFFFAOYSA-N	438.362	1.387	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(NC(=O)[C@@H]3CCCO3)cc2)c(O)c1	764110059	WJQHVKGFPXAXKO-KRWDZBQOSA-N	426.429	1.218	50	20	IDGD	
CCCCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2scnc2C)cc1	764246347	NVSGSUCUASYFFF-UHFFFAOYSA-N	439.519	1.393	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(OC(F)F)c2)cc1	764259392	GHVNPYJGEZQLQE-UHFFFAOYSA-N	437.355	1.240	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)C(=O)Nc1ccc(-n2cccn2)cc1C(F)(F)F	764264889	ZKVAMPRMZLUPTK-UHFFFAOYSA-N	432.362	1.615	50	20	IDGD	
CN(C)C(=O)C[C@H]1CN(C(=O)C(=O)NNC(=O)Cc2cccnc2)c2ccc(Cl)cc21	764268335	IBPHSCHLANDPIV-AWEZNQCLSA-N	443.891	1.034	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccccc1)NNc1c(F)cc(C(=O)NC2CC2)cc1F	764335625	XPVNTTSAKZYITG-UHFFFAOYSA-N	438.456	1.669	50	20	IDGD	
Cc1nn2cc(S(=O)(=O)NNC(=O)c3cc(Br)c[nH]3)cnc2c1Cl	766308721	BOHOSJWUSYNJIR-UHFFFAOYSA-N	433.675	1.405	50	20	IDGD	
COc1cc(/C=C\C(=O)OCC(=O)NNC(=O)Cc2ccccc2C)cc(OC)c1O	767353794	OUPWKRRLJRBGKW-HJWRWDBZSA-N	428.441	1.664	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc(Cl)c(F)c(C(=O)O)c1)c1nnc(-c2ccccc2)o1	767733603	RTXZVZZQQGGJAC-UHFFFAOYSA-N	440.796	1.851	50	20	IDGD	
COc1cc2c(cc1NC(=O)C(=O)NNC(=O)c1cccc3ncccc13)NC(=O)CC2	768238931	HOVFSVROKUHYOU-UHFFFAOYSA-N	433.424	1.528	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)c1nn(-c2ccccc2)c(C)cc1=O	768640129	XDXPIBVZLUHSCW-UHFFFAOYSA-N	428.470	1.710	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)N[C@@H]2CCO[C@@]3(CCSC3)C2)c2ccccc2c1=O	769229697	FITWYJOREVAZEY-SZNDQCEHSA-N	445.545	1.976	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@H]2COc3cc(C)c(C)cc32)cc1	770213050	XAPIMJBEBQCCMI-SFHVURJKSA-N	431.514	1.556	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)NCCN(C)S(=O)(=O)c2cccs2)c1	771946056	HJQHEFAFTKUNHR-UHFFFAOYSA-N	426.520	1.086	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	772896757	BRZAHOJGFCXWFJ-HNNXBMFYSA-N	448.932	1.860	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C1=NN(c2ccc(F)cc2)[C@H](C(N)=O)C1	772968136	DCGYVWPXSUEEPQ-GTNSWQLSSA-N	447.854	1.514	50	20	IDGD	
N#Cc1cccc(NNC(=O)C(=O)Nc2ccc(N3CCN(C(=O)C4CC4)CC3)nc2)c1	773682356	JJPWPMKZCUCKSW-UHFFFAOYSA-N	433.472	1.094	50	20	IDGD	
CCNC(=O)c1ccc(C)c(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)c1	774009689	SGTLWEMQVHNTFL-CYBMUJFWSA-N	446.891	1.952	50	20	IDGD	
Cc1cc(S(N)(=O)=O)ccc1CNC(=O)NNC(=O)Nc1ccc(OC(F)F)cc1	775201129	HUDLLHCWSWPDBN-UHFFFAOYSA-N	443.432	1.780	50	20	IDGD	
CC(=O)c1cc(C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)c(C)nc1C	777100226	ZOFKVXFTBZIJFO-UHFFFAOYSA-N	432.502	1.291	50	20	IDGD	
O=S(=O)(c1ccc(CCCl)cc1)N1CCC[C@H](S(=O)(=O)N2CCOCC2)C1	779635844	VVFVJNKGSPWPTO-KRWDZBQOSA-N	436.983	1.283	50	20	IDGD	
O=C(CCCOc1ccc2c(c1)NC(=O)CC2)NNC(=O)[C@@H]1COc2ccccc2O1	781845930	DZNJSIULSVZVDX-IBGZPJMESA-N	425.441	1.718	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)cc1)C(=O)Nc1cc(Br)ccc1-n1cccn1	782832511	ODYJYFAYUMKKRF-UHFFFAOYSA-N	444.245	1.740	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C(=O)Nc2ccc(-n3cccn3)c(F)c2)nc2ccccc21	782886519	OTWYDNLAXQHDQR-UHFFFAOYSA-N	435.419	1.227	50	20	IDGD	
CC(=O)c1ccc(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)cc1Cl	782893345	IEZOJGAIKPBYGC-UHFFFAOYSA-N	427.848	1.758	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2cc(C3CCC3)nn2-c2ccccc2)CCS(=O)(=O)C1	783424892	GHFJXNUVYHESDS-HXUWFJFHSA-N	431.518	1.276	50	20	IDGD	
O=C(NNc1nccc2sccc12)C(=O)Nc1ccc(C(=O)N2CCOCC2)c(F)c1	783440451	YQPFLJNDYWPGPD-UHFFFAOYSA-N	443.460	1.990	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)[C@H]1C[C@H]2CC[C@H]1C2	783457087	IIJOLYMDXLBWNQ-LNLFQRSKSA-N	435.546	1.224	50	20	IDGD	
Cc1ccc(NNC(=O)C(=O)Nc2cc(Br)cnc2OCC(F)(F)F)nn1	783951666	JNZZRGLAZCYRGE-UHFFFAOYSA-N	449.187	1.965	50	20	IDGD	
N#Cc1ccc(NNC(=O)C(=O)Nc2cccnc2N2CCOCC2)cc1C(F)(F)F	784237243	QBIDSBBZLLTEMS-UHFFFAOYSA-N	434.378	1.890	50	20	IDGD	
O=C(NNc1cc(Cl)ccn1)C(=O)N1C[C@H](C(=O)N2CCCCC2)Oc2ccccc21	784856052	DLAAGFJNNDMJCB-QGZVFWFLSA-N	443.891	1.985	50	20	IDGD	
CC(=O)N1CCN(Cc2ccc(NC(=O)C(=O)NNc3cc(Cl)ccn3)cc2)CC1	784856120	BXCMPPADOOPGGE-UHFFFAOYSA-N	430.896	1.481	50	20	IDGD	
CC[C@H](N=c1nn[nH]n1-c1ccccc1)C(=O)NNC(=O)NCc1ccc(Cl)cc1	787424700	MIDZPYKCXWBCMH-INIZCTEOSA-N	428.884	1.459	50	20	IDGD	
O=C(O)[C@H]1CCCN(S(=O)(=O)c2ccc(NS(=O)(=O)CCCCCl)cc2)C1	788062824	ZQIOLMANCJBZSZ-ZDUSSCGKSA-N	438.955	1.933	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cnc1Br	788445117	JNQRUDLRFGFCEQ-UHFFFAOYSA-N	435.282	1.320	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3ccc4c(c3)CC(=O)N4C)cc2C1	789732241	RZYJZSPOEWSKOD-LLVKDONJSA-N	426.498	1.792	50	20	IDGD	
CN(C)[C@H]1CCOc2c(NC(=O)C(=O)NNC(=O)c3cc(-c4ccccc4)[nH]n3)cccc21	789733002	WPKWISSFVBERAP-IBGZPJMESA-N	448.483	1.862	50	20	IDGD	
CCOc1cc(Br)c(CC(=O)NNC(=O)CN2CCCC2=O)cc1OCC	789857619	IUAQZVUXQTUESY-UHFFFAOYSA-N	442.310	1.559	50	20	IDGD	
CC(=O)N1CCc2ccc(S(=O)(=O)NNC(=O)c3c[nH]c4ccccc34)cc2CC1	790048967	CLXOWZSCGWPLFG-UHFFFAOYSA-N	426.498	1.738	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Cc2sc(S)nc2C)c1	790756275	AVWJALAZUKOMDV-UHFFFAOYSA-N	442.588	1.774	50	20	IDGD	
CN1CCN(Cc2cccc(NC(=O)C(=O)NNc3cccc(F)c3[N+](=O)[O-])c2)CC1	790997916	WVLKAYXZBMFNPL-UHFFFAOYSA-N	430.440	1.563	50	20	IDGD	
O=C(NNc1cccc(F)c1[N+](=O)[O-])C(=O)Nc1ccccc1S(=O)(=O)C(F)F	790998681	RPRTVGBRNSKLDX-UHFFFAOYSA-N	432.336	1.812	50	20	IDGD	
O=C(NNC(=O)c1cccnc1F)c1cccc(S(=O)(=O)NCc2ccccc2)c1	791195775	IOYDXFIYCJFCSO-UHFFFAOYSA-N	428.445	1.774	50	20	IDGD	
COc1cc(OC2CC2)ccc1C(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	791619296	OESKLFIDAWMPDJ-UHFFFAOYSA-N	429.385	1.763	50	20	IDGD	
CC(C)CNC(=O)c1ccc(NC(=O)C(=O)NNc2nc3ccccn3n2)cc1Cl	792387050	AOTOECWQPCNEEB-UHFFFAOYSA-N	429.868	1.850	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)c2cnc(Br)c(Cl)c2)c1	792605547	XCDGYLWSMXRWQG-UHFFFAOYSA-N	437.637	1.987	50	20	IDGD	
COc1c(NC(=O)C(=O)NNC(=O)Cc2c[nH]c3ccccc23)cc(Cl)cc1C(N)=O	793021609	GWGUPXKFUVVYNQ-UHFFFAOYSA-N	443.847	1.257	50	20	IDGD	
CC(C)Oc1ccc(NC(=O)C(=O)NNC(=O)c2cc(Br)ccc2O)nn1	793026109	PTJQZSDWOPYUGV-UHFFFAOYSA-N	438.238	1.132	50	20	IDGD	
C[C@H]1CCC(=NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)[C@@H](n2cncn2)C1	794453052	IDQQODVGVBJZDR-KXBFYZLASA-N	446.533	1.446	50	20	IDGD	
CCOC(=O)c1ccc(NNC(=O)c2ccccc2S(=O)(=O)N2CCOCC2)cc1C	794648485	GGAIGVKOJWFRKM-UHFFFAOYSA-N	447.513	1.950	50	20	IDGD	
CCOc1cc(N2CCN(CC(=O)NNC(=O)c3cccc(C)c3)CC2)ccc1[N+](=O)[O-]	796467730	WHZNAFLBTFIRGE-UHFFFAOYSA-N	441.488	1.885	50	20	IDGD	
O=C(CN1CCCC[C@H]1COC(=O)N[C@@H]1CCOC1)NNC(=O)c1cccc(Cl)c1	796548548	NGMVNYUIASKPMA-SJORKVTESA-N	438.912	1.471	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)C(=O)Nc1ccc(F)c(N2CCOC2=O)c1	797005394	FCBXCIUORUREOX-UHFFFAOYSA-N	430.392	1.085	50	20	IDGD	
CCOCC(=O)NNC(=O)NCc1cc(Cl)c(I)cc1OC	797540533	JJGQNXGLLMXRHJ-UHFFFAOYSA-N	441.653	1.820	50	20	IDGD	
CSC[C@H](C)C(=O)N1CCC(C(=O)OCC(=O)NNC(=O)c2cccc(C)c2)CC1	799539091	SUDGZQPRXWWWKO-HNNXBMFYSA-N	435.546	1.537	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)[C@@H](C(C)C)N2CCCS2(=O)=O)cc1Cl	802077027	FNIWDXPXZFQOOT-OAHLLOKOSA-N	448.929	1.570	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CS[C@@H](Cc2ccccc2F)C(=O)N1)Nc1ccc2c(c1)OCO2	802102649	ARKCEFVOJJHCKB-YOEHRIQHSA-N	446.460	1.550	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)Nc2ccc(N(C)C)cc2)cc1S(=O)(=O)NCC#N	802124969	XPBQIWYENAJERH-UHFFFAOYSA-N	430.490	1.329	50	20	IDGD	
CC(=O)N[C@](C)(C(=O)NNc1ccc2c(=O)[nH]ccc2c1)c1ccc(S(C)(=O)=O)cc1	803433570	TUIPCMGUNPJAII-NRFANRHFSA-N	442.497	1.426	50	20	IDGD	
CN1CCN(C(=O)NNC(=O)CSc2nnc(-c3ccco3)n2-c2ccccc2)CC1	807381041	APKFWQOWIIWYJX-UHFFFAOYSA-N	441.517	1.608	50	20	IDGD	
CCC(C)(C)NC(=O)c1ccc(NC(=O)C(=O)NNc2ccc(-n3ccnc3)nn2)cc1	807428296	CKLYFAWCVYEFIR-UHFFFAOYSA-N	436.476	1.663	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)C(=O)Nc1ccnc(OCc2ccccc2)c1	807429505	UGLGEPNKOVTXAW-UHFFFAOYSA-N	430.428	1.718	50	20	IDGD	
O=C(NCc1ccncc1OC[C@@H]1CCOC1)NNC(=O)[C@@H]1COc2ccccc2O1	807615197	OUPOHQMHMRQGCR-KUHUBIRLSA-N	428.445	1.167	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNS(=O)(=O)c2cccc(CC(=O)OC)c2)cc1	811677841	LJQKJYGJSDWJQI-AWEZNQCLSA-N	436.486	1.578	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@@H]2CCCN(c3ccccc3)C2=O)c2ccccc2c1=O	814365030	WPPPPOWWAAKUIK-SFHVURJKSA-N	433.468	1.621	50	20	IDGD	
Cn1nc(SCC(=O)NN=C(Cc2ccccc2Cl)c2ccoc2)c(=O)n(C)c1=O	814785610	YURWLWDUVNJIMZ-UHFFFAOYSA-N	447.904	1.581	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc([C@H]3CCOC3)cc2)cc1	815566035	HEUIVOKJNXOQLM-YJBOKZPZSA-N	439.468	1.947	50	20	IDGD	
O=C(NNC(=O)c1cnccn1)C(=O)Nc1cc(Cl)ccc1I	815568082	UWJYWOIFEHWNHZ-UHFFFAOYSA-N	445.604	1.134	50	20	IDGD	
COCCCOc1ccc(C(=O)NNC(=O)[C@H]2CCCN(C(=O)OC(C)(C)C)C2)cn1	816510214	PIGXFNAGWWIFIA-INIZCTEOSA-N	436.509	1.905	50	20	IDGD	
COCCN(C)NC(=O)C1CCN(S(=O)(=O)c2cccc(OC(F)(F)F)c2)CC1	816562260	FCVITSNHFUBYTL-UHFFFAOYSA-N	439.456	1.595	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCc2nncn2C1)c1cc([N+](=O)[O-])ccc1NCc1ccccc1	816879227	KKDGNJRUNIRWMG-OAHLLOKOSA-N	435.444	1.822	50	20	IDGD	
CN(C(=O)CSCC(=O)NNc1ccccc1S(=O)(=O)N(C)C)C1CCCCC1	817051324	JWQOSCDTKCIHBT-UHFFFAOYSA-N	442.607	1.904	50	20	IDGD	
CCN(c1ccccc1)S(=O)(=O)c1cccc(C(=O)NNc2nnc(C)c(O)n2)c1	817280708	KKHHHTXMZBTDIO-UHFFFAOYSA-N	428.474	1.858	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)/C=C/c2ccc(NS(C)(=O)=O)cc2)cc1C	818327189	CDFBFIVPOYTYLN-YRNVUSSQSA-N	430.486	1.474	50	20	IDGD	
COc1c(C)cc(S(=O)(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1C	915184901	JFKIYVPRHNHZDM-UHFFFAOYSA-N	447.922	1.236	50	20	IDGD	
C[C@H]1CN(c2ccccc2C=NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)CCO1	915949895	UQXFOSYIIFISKR-ZDUSSCGKSA-N	436.921	1.976	50	20	IDGD	
CN(C(=O)C1CC1)c1ccccc1C(=O)NNC(=O)c1csc(N2CCOCC2)n1	916135962	AZKBUFYIIYAPEJ-UHFFFAOYSA-N	429.502	1.427	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)N(C)CC(=O)N2CCN(C)CC2)c(C)n1C[C@@H]1CCCO1	916558345	LHYCMMCJUYYSEC-MSTPFNHUSA-N	427.549	1.423	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)N[C@H]2CCCc3c2cnn3C)c2ccccc2c1=O	916604484	HWLYOALTARWJRF-KRWDZBQOSA-N	437.504	1.952	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCN(c2ccc(Cl)cc2)C1=O)c1nnc(O)c2ccccc12	919692821	VVUQOVABSXWKRN-OAHLLOKOSA-N	425.832	1.803	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)[C@@H](CSC)N1C(=O)[C@H]2CCCC[C@H]2C1=O	919822966	XMBPJIOQAVOWLQ-OWCLPIDISA-N	433.530	1.292	50	20	IDGD	
Cc1onc(-c2c(F)cccc2Cl)c1C(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1	919885780	RCLLQTUILOKEBR-SECBINFHSA-N	430.845	1.574	50	20	IDGD	
COc1ccc(C(=O)Nc2ccccc2C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)cc1	920746076	RUQNQGGUPCWSIF-AWEZNQCLSA-N	446.485	1.079	50	20	IDGD	
NC(=O)c1ccc(C(=O)NNC(=O)[C@H]2Cc3ccccc3CN2Cc2ccccc2)cn1	1318084330	SNHNNCFMPALUQR-OAQYLSRUSA-N	429.480	1.569	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)c2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1	1318234456	NSLLYJHKGHWUIH-INIZCTEOSA-N	425.489	1.270	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2cncc(OCC(F)F)c2)c2ccccc2c1=O	1319275446	DGEPGYHEEXXJMX-UHFFFAOYSA-N	431.399	1.920	50	20	IDGD	
O=C(CN1CCC(O)(Cc2ccccc2F)CC1)NNC(=O)c1ccc([N+](=O)[O-])cc1	1324808352	WNHHBFCBYIGHPA-UHFFFAOYSA-N	430.436	1.565	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(O)nc4ccccc34)C2)C1	1777763699	RBQGOWLHTMPWMO-HRAATJIYSA-N	433.892	1.638	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)C3(F)CCCCC3)C2)C1	1778207345	SWHNRYBVVJBFQE-HUXSYLCKSA-N	447.511	1.623	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cncc(C(F)(F)F)c3)C2)C1	1779751134	SESVXULAOCVNDN-PBHICJAKSA-N	435.830	1.798	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(=O)ccn3C)C2)C1	1780107040	XNBCXLJYTGPUHU-KBXCAEBGSA-N	426.311	1.002	50	20	IDGD	
COc1ccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](O)CCl)C3)c(O)c1	1780319632	KHZWPZUPOJOSBO-MBOZVWFJSA-N	426.897	1.128	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CNC(=O)c1cccnc1)C2	1780699390	DGDUIXBPGMSPJL-CSODHUTKSA-N	436.940	1.343	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)CNC(=O)c3ccco3)CCO2)C1	1781226846	BASXCGVSBUKXIU-QZTJIDSGSA-N	432.304	1.076	50	20	IDGD	
O=C(c1cc(F)cc([N+](=O)[O-])c1)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781332825	JTNVWAZPHQTLTN-CZUORRHYSA-N	448.220	1.868	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)NC(C)=O)C2	1781904756	BFNSQSJDXALQTP-SCFUHWHPSA-N	432.359	1.198	50	20	IDGD	
O=C(c1cc2ccoc2cn1)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1782191171	RSIAXXSOSHSFIG-YOEHRIQHSA-N	426.242	1.962	50	20	IDGD	
Cc1cccn2ncc(C(=O)N3CC[C@@]4(CN(C(=O)CO[Si](C)(C)C)CCO4)C3)c12	1782519718	CHHXOEWXUBTSID-OAQYLSRUSA-N	430.581	1.938	50	20	IDGD	
Cc1ccccc1CCC(=O)N1CC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1	1783305559	DULTWAXWIBXAAT-QHCPKHFHSA-N	430.549	1.131	50	20	IDGD	
Cc1noc(N)c1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]2C1	1783968133	QTJFXBCCNFCSME-BQUFFADESA-N	429.315	1.190	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(F)c(F)c(Cl)c3)C[C@@H]21)[C@H](O)CCl	1784096483	XQTAEEWHAFUQMM-NDMCHQMPSA-N	437.270	1.811	50	20	IDGD	
Cc1ccc(/C=C/C(=O)N2CC[C@@]3(C2)CN(C(=O)CCC(=O)NN(C)C)CCO3)s1	1784432810	VFMCDTWJNHJBCA-HSTAZWAASA-N	434.562	1.273	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cn3nnc4ccccc43)[C@H]2C1	1784898792	HRKOAMRMSPQWGU-BXWFABGCSA-N	445.596	1.263	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)N1CC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1785333976	CMCOCEPLQUMPME-FQEVSTJZSA-N	431.961	1.996	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4n(n3)CCCO4)C[C@@H]21	1786406850	KIKUHPPQARAUEZ-YDHLFZDLSA-N	441.326	1.044	50	20	IDGD	
Cc1ccn(CC(=O)Nc2ccc(C3(NC(=O)c4cccc(B(O)O)c4)CCC3)cc2)n1	1786917150	LGMMBJWMKSSWFA-UHFFFAOYSA-N	432.289	1.319	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)Nc3cnccn3)[C@H]2C1	1788630311	LRCHGRBTHWUALS-AICCOOGYSA-N	440.342	1.040	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4nccn4c3)C[C@@H]21	1788762754	TZZBCWIDVPYEOV-BZSNNMDCSA-N	430.581	1.779	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)c1ccncc1-c1ccccc1	1789077791	IVGCUBQAMOLRIZ-FIRPJDEBSA-N	443.931	1.942	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(=O)ccn3C)[C@H]2C1	1789222046	DJJKXIFXIJSBLL-HPZZRFSDSA-N	440.338	1.010	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccccc3C(N)=O)C[C@@H]21	1791060894	LJDJCVYSMOQWPS-APYUEPQZSA-N	438.322	1.162	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3C[C@@]34C(=O)Nc3ccccc34)[C@H]2C1	1791066732	SGVMJIGSJSXTLE-IRDHXIRGSA-N	445.947	1.894	50	20	IDGD	
CCOC(=O)N[C@@H](O)C(=O)NC1(c2ccc(NC(=O)[C@@H](Cl)COC)cc2)CCC1	1791568847	KAPYRVLMVWJXCX-HOCLYGCPSA-N	427.885	1.439	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CSc1ccncc1)C2	1792868809	QBMMPFVPZNRXJN-ZJOBFFGXSA-N	442.379	1.794	50	20	IDGD	
Cc1n[nH]c(C)c1CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)CBr	1792873609	FMMPXWLKSWNPJW-JAMKOXHTSA-N	427.343	1.190	50	20	IDGD	
CS(=O)(=O)c1ccc(F)c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](O)CCl)c1	1793115008	VFNFNECJFAPQRM-AZKPJATDSA-N	432.901	1.081	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](Br)Cc1ccccc1)C2)[C@@H]1C[C@@H]1F	1793674229	WAWOTSUDZBSREV-BQULAQKPSA-N	439.325	1.940	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)n[nH]1)C2	1794142437	AEQLEXBYANPBLA-OPDFLTKYSA-N	441.916	1.499	50	20	IDGD	
Cc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)Br)C3)ncc1[N+](=O)[O-]	1796603061	CPXSUMVDCUPQQE-OHTBPHCPSA-N	441.282	1.285	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](F)Cl)c1nc2c(=O)[nH]c3ccccc3n2n1	1796808663	FZIJQOODXKPILN-MIJXAVMKSA-N	432.843	1.357	50	20	IDGD	
Cn1ncc2c(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)CO[Si](C)(C)C)cccc21	1797955772	AEOJWCWDNKZCOI-YVWYUNDQSA-N	430.581	1.628	50	20	IDGD	
CN(C)c1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Cl)C3)c1	1798537742	DKVZQIREDZUDCZ-OXUXUCFPSA-N	428.848	1.398	50	20	IDGD	
C[C@@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2)c1ccc(O)cc1	1799297691	ODPVMRCQVOWBGI-LJGDNWOOSA-N	425.323	1.870	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(OC)c(OC)c1O	1799664045	FEGBIAVBUUVQEH-LMWOUKEDSA-N	426.897	1.630	50	20	IDGD	
COc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)Br)c(OC)c1	1800760236	KENUZZVZJLFZTN-KOFHJDLBSA-N	441.322	1.690	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CSc1ccc(F)cc1F)C2	1800970782	JHFLDZVBBHWQDE-AZGFTEDZSA-N	448.919	1.900	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)[C@H]2CCCCO2)[C@H]1c1cccnc1	1802586556	AQYIEELNVUNYPR-DBXWQHBBSA-N	431.537	1.030	50	20	IDGD	
Cc1csc(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)c1	1803770583	JCFJKXWVQFAECI-GHTZIAJQSA-N	449.341	1.765	50	20	IDGD	
Cc1nc(C(=O)NC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)co1	1805694510	OXYGNMMJURAYTC-JXFKEZNVSA-N	428.493	1.071	50	20	IDGD	
N=C(N)SCC(=O)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@H]1c1cccnc1	1807005815	HWUHYFOMIZGVCB-DRZSPHRISA-N	432.319	1.405	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)Cn2cncn2)[C@H]1c1cccnc1)[C@H](F)Br	1808662166	WYPJOWCHNPOPNQ-QEJZJMRPSA-N	425.262	1.070	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)c3cnc4ccccn34)CC2)C1	1809972634	WDMYGXCOXOITGU-UHFFFAOYSA-N	446.316	1.173	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)c1cccn2cncc12	1809990709	BHLRROHENSCKBA-SNRMKQJTSA-N	427.892	1.649	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)c2cccn(C)c2=O)[C@H]1c1cccnc1	1812864415	HMAMQFYOGVLDIJ-LXZKKBNFSA-N	447.333	1.883	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)c2cc[n+]([O-])cc2)[C@@H]1c1cccnc1	1812866776	KJMWDUVTGSWNJS-IAOVAPTHSA-N	433.306	1.818	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2nccc3nc[nH]c23)[C@@H]1c1cccnc1	1813032205	UXNJPPIAVYFBLX-ZRGWGRIASA-N	442.907	1.926	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2ccnc(F)c2)[C@@H]1c1cccnc1	1813069216	WDZBSUVIDHOZBE-LAUBAEHRSA-N	442.495	1.308	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)CSc2nc[nH]n2)[C@@H]1c1cccnc1)C(Cl)Cl	1813081881	FGEVREHSFVTQGJ-DGCLKSJQSA-N	429.333	1.802	50	20	IDGD	
CC/C=C(\C)C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1	1813703912	YWHZCJBZDYJNIG-ARKAMOEASA-N	436.516	1.756	50	20	IDGD	
O=C(CCN1CCOCC1)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](F)Br)CC2	1814643358	BVFBZWPFUOEORF-HZMBPMFUSA-N	449.346	1.468	50	20	IDGD	
C[C@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)[C@H](N)c3ccccn3)sc2C1	1815022242	KHECPEKJDYESTD-PKFCDNJMSA-N	438.351	1.934	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC[C@@H]1c1cc(NC(=O)C(F)(F)C(F)F)n[nH]1	1815542391	DZMJFQAQGFDROA-CYBMUJFWSA-N	442.178	1.296	50	20	IDGD	
CCc1cc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)no1	1817477067	YAQVFDQUHMPUNR-SFHVURJKSA-N	437.265	1.260	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H]2C[C@@H](O)C2)[nH]n1	1818112870	REYDWDZZPCSCLT-UITOYEBDSA-N	441.492	1.307	50	20	IDGD	
C=CC[C@@H](C(=C)C)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2	1819597806	MHZULFROAKOFRS-SJORKVTESA-N	439.346	1.817	50	20	IDGD	
C[Si](C)(C)OCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCc1nc(N)n[nH]1)CC2	1820165677	LSWPQMMFAGNSGN-JTQLQIEISA-N	437.602	1.240	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1)c1cc(O)cc([N+](=O)[O-])c1	1821263031	ZBUWAIIPAJPSRF-LSDHHAIUSA-N	437.840	1.929	50	20	IDGD	
C[C@H](Br)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H]2CCC(=O)NC2)[nH]n1	1822184240	DCOIAPUSQBDEEP-GVXVVHGQSA-N	426.315	1.711	50	20	IDGD	
O=C(CCn1ccnn1)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](F)Br)[nH]n1	1822809731	PVHILUBHSKQKST-FZMZJTMJSA-N	428.266	1.774	50	20	IDGD	
O=C(Cn1ccncc1=O)N[C@@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1	1823009647	RWPSGGZWJDYXQN-OQPBUACISA-N	444.286	1.003	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H](O)N2CCOCC2)CC1	1824013865	VILFIIUARBGRET-PKOBYXMFSA-N	429.989	1.522	50	20	IDGD	
CC(C)c1nc(CC(=O)N2CCCC[C@@H]2C2CCN(C(=O)[C@H](O)CCl)CC2)no1	1825119009	WQXRXCCOKDABCP-HZPDHXFCSA-N	426.945	1.955	50	20	IDGD	
COC(=O)C1(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)CO[Si](C)(C)C)CC3)CC1	1825278339	VWPDACRTXVBKRY-LLVKDONJSA-N	425.583	1.860	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2coc(Cl)n2)CC1	1825536803	IWJPUJUWJYSKRD-INIZCTEOSA-N	439.944	1.934	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccn(C)c1=O)CC2	1825635485	HLHLUSLGFQTZRC-UWVGGRQHSA-N	439.335	1.851	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccccc1C(N)=O)CC2	1826006614	KSYINVRCSXHEKE-MFKMUULPSA-N	436.921	1.722	50	20	IDGD	
Cc1ncsc1C(=O)N[C@@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1	1826080406	IWCHZVLXPZMGNE-LLVKDONJSA-N	436.563	1.507	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)CCn3ccnn3)sc2C1	1826879858	VZNUEGMSJXFENM-GHMZBOCLSA-N	441.355	1.910	50	20	IDGD	
Cc1cnc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)s1	1827055780	FPHCCDQKCAMCKE-IBGZPJMESA-N	441.362	1.678	50	20	IDGD	
C=C[C@H](O)C(C)(C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1	1828889738	VCHQQKYFBVDBJX-OALUTQOASA-N	436.597	1.552	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H]2C[C@H]2C2CC2)CC1	1828923671	RZMQCZFUIFCGQJ-QKNQBKEWSA-N	439.560	1.965	50	20	IDGD	
O=C([C@H](O)CCl)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2CC[C@@H]3CCC(=O)N3C2)CC1	1830208810	FTUUBURWZRMXSA-AKHDSKFASA-N	439.984	1.607	50	20	IDGD	
C[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1)c1ccc(Cl)cc1	1830259676	XWMQJNJTIQWFFG-GZRFBZBPSA-N	445.343	1.500	50	20	IDGD	
CC(C)(C)OC(=O)CCCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1830800422	FBSWRXHXOUHFSP-VQIMIIECSA-N	436.908	1.489	50	20	IDGD	
CC(=O)C[C@H](C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1	1831801009	YXUBXQLNACZBMN-MGPUTAFESA-N	443.548	1.534	50	20	IDGD	
Cc1ccnc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)c1	1831873084	IYLADMMFQNOZSP-FQEVSTJZSA-N	429.565	1.996	50	20	IDGD	
O=C([C@@H](F)Br)N1CCC([C@H]2CCCCN2C(=O)CCn2ccnn2)CC1	1832246466	HEQAOFNCVPAKFM-GDBMZVCRSA-N	430.322	1.978	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)C[C@H]1CCCCO1)CCO2	1832345481	YUNSOWMAXLWJDK-YLJYHZDGSA-N	428.602	1.254	50	20	IDGD	
C[C@@H](Oc1ccccn1)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)CCl)CC2)CC1	1833312860	JAWPMCPSDYXNET-QAPCUYQASA-N	438.956	1.020	50	20	IDGD	
CC[C@H](C)[C@@H](O)C(=O)NC1CCN(C2CCN(C(=O)[C@H](C)Br)CC2)CC1	1833503749	ZGRFDBQIZNFRBH-GRDNDAEWSA-N	432.403	1.748	50	20	IDGD	
Cc1ncccc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)Br)C2)C1	1834042483	AKGNAWGPJRYYAV-UGSOOPFHSA-N	426.311	1.243	50	20	IDGD	
CCn1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)CBr)C3)C2)n1	1834401525	JREMBVVZDFCARS-RDTXWAMCSA-N	443.342	1.004	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCC(N2CCC(NC(=O)CSC(=N)N)CC2)CC1	1834655499	KIPPJWCWRZZWKV-KRWDZBQOSA-N	438.425	1.421	50	20	IDGD	
C=CC[C@@H](C(=C)C)C(=O)N1CCOC[C@@]2(CN(C(=O)CCBr)CCO2)C1	1834823423	UDVJQBXJPTZCLP-QFBILLFUSA-N	429.355	1.996	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)c1cc(C(F)F)no1	1834910363	ZURUZECXSFEOSQ-CQSZACIVSA-N	434.871	1.397	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)C#Cc3ccccc3)CCO2)C1	1835102143	MMHALQXYKORMON-OXQOHEQNSA-N	435.318	1.278	50	20	IDGD	
Cc1cc(NC(=O)CC(=O)NC2CCN(C3CCN(C(=O)[C@@H](F)Cl)CC3)CC2)no1	1835107591	DRTOUFLOYQBOHT-GOSISDBHSA-N	443.907	1.418	50	20	IDGD	
C[C@@H](Nc1cccnc1)C(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1835685648	RCOFVACSHOHOEG-IIBYNOLFSA-N	438.956	1.603	50	20	IDGD	
C[C@]1(C(=O)NC2CCN(C3CCN(C(=O)[C@H](F)Br)CC3)CC2)CCCN1	1836384221	DSTMTHDDBYGLII-MAUKXSAKSA-N	433.366	1.391	50	20	IDGD	
CCc1cnc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)s1	1837724448	OTVJFVQDVHOTLH-YVEFUNNKSA-N	446.367	1.559	50	20	IDGD	
O=C(c1ccn(C(F)F)n1)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1838039760	WWCXWYZBGDIQHG-HNNXBMFYSA-N	427.235	1.152	50	20	IDGD	
COc1cc(C#N)cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)c1	1838579202	FQMAWRQFEJYYDU-QFIPXVFZSA-N	449.935	1.902	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CC=CCC1)CCO2	1839126530	IUILNONXIJMKET-BXWFABGCSA-N	429.355	1.830	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C=C/c3ccco3)C2)C1	1839150399	LMXLIGQEQWVQGC-WWAPKCSDSA-N	431.316	1.986	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(C)c4n[nH]cc4c3)CCO2)C1	1839511305	QYQCRVBSGOTPQV-LAUBAEHRSA-N	434.924	1.959	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)c3ccccc3)C2)C1	1840030848	YCNPDFIVTFCLDZ-ZSZQSSIHSA-N	443.313	1.937	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(O)cc3F)C2)C1	1840035129	GWMXSRARJPMKNW-SGTLLEGYSA-N	445.285	1.385	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H](F)C[C@@H](C(=O)N2CC3(CCCN3C(=O)[C@@H](O)CCl)C2)C1	1841351618	WEKZVZUULZHQGX-KFWWJZLASA-N	447.935	1.385	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@H]2C[C@@H](F)CN2C(=O)OC(C)(C)C)C1	1843820289	MELLLJVYTIRBMX-KFWWJZLASA-N	447.935	1.791	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)c2cnc(O)[nH]2)C1	1844504115	LJPDKUHYRMALDU-UHFFFAOYSA-N	429.389	1.080	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)N1CC2(CCCN2C(=O)[C@H](Br)Cc2ccccc2)C1	1845941493	BRECIASYLKOURW-NVXWUHKLSA-N	448.361	1.887	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@]1(F)CCN(C(=O)OC(C)(C)C)C1)C2	1846362518	JBAUFAANLZWGFC-XOBRGWDASA-N	447.935	1.793	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@]13C[C@@H]1CCN3C(=O)OC(C)(C)C)C2	1846364807	KQACJYZDYRZPED-GXZWQRSESA-N	441.956	1.843	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@H](C(=O)NNC(=O)c2cccc(N(C)C)c2)C(C)C)cc1	17250853	DQAQECKSZMNQOS-IBGZPJMESA-N	432.546	1.825	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cccc(-n3cccc3)c2)cc1	17406797	ZRWPCQIZVYICRF-UHFFFAOYSA-N	426.498	1.867	50	20	IDGD	
CC(C)(C)c1nc(CN2CCN(C(=O)NNC(=O)CNC(=O)c3ccco3)CC2)cs1	725870609	LVIZWLNCYHQOSD-UHFFFAOYSA-N	448.549	1.322	50	20	IDGD	
COc1ccccc1[C@@H](NC(=O)NNC(=O)CNC(=O)c1cccs1)c1nccn1C	725874299	YIOGGBRIXGOYQB-QGZVFWFLSA-N	442.501	1.340	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)C[C@H](C)NC(=O)C1CCCC1	727202114	XMXZWKJPBLOAAO-LBPRGKRZSA-N	439.896	1.738	50	20	IDGD	
CC(C)(C)OC(=O)N(CCNC(=O)NNC(=O)CNC(=O)c1cccs1)C1CC1	727480195	UIZXJBMYESHWAA-UHFFFAOYSA-N	425.511	1.208	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)CN2C(=O)N[C@]3(CCCC[C@H]3C)C2=O)cc1F	727498295	HYFGCVASOCZJDH-WYRIXSBYSA-N	437.497	1.653	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCc2ccc3c(c2)OCCCO3)nc1	727605638	SGKAGWLASNPOEE-UHFFFAOYSA-N	435.506	1.756	50	20	IDGD	
CN(C)N(C(=O)[C@H]1CCCN(C(=O)c2ccc(Cl)cc2)C1)[C@@H]1CCS(=O)(=O)C1	728176900	OYATVDDKVBKSEA-DOTOQJQBSA-N	427.954	1.685	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3ccn(-c4ccccc4)n3)cc2)CC1	728215391	YVHOKLDAEBZWAK-UHFFFAOYSA-N	440.529	1.565	50	20	IDGD	
NS(=O)(=O)c1ccc(CC(=O)NNC(=O)NCc2cccc(C(F)(F)F)c2)cc1	728314525	VIYYHMGRDYJJRP-UHFFFAOYSA-N	430.408	1.426	50	20	IDGD	
CC(=O)c1cccc(O[C@@H](C)C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1	728338165	GOCPRWURVWHAII-IFXJQAMLSA-N	442.424	1.187	50	20	IDGD	
CC(=O)N(c1cccc(Cl)c1)c1nc(C=NNC(=O)[C@@H](C)NS(C)(=O)=O)cs1	728436072	KMFRZNJTOSYIEW-SNVBAGLBSA-N	443.938	1.869	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)c2ccc(F)c(S(N)(=O)=O)c2)c1	728527468	KGAOURPADNLVDS-UHFFFAOYSA-N	446.254	1.319	50	20	IDGD	
C[C@H](C(=O)NNC(=O)c1cc(F)ccc1Br)N1C(=O)NC2(CCCC2)C1=O	728546280	QCSZRWRGGVJIIP-SECBINFHSA-N	441.257	1.602	50	20	IDGD	
O=C(NNC(=O)c1cccc(OC(F)F)c1)NNC(=O)c1cc(Br)c[nH]1	728594375	MPCMAFIVINYXHJ-UHFFFAOYSA-N	432.181	1.668	50	20	IDGD	
O=C(COC(=O)[C@H]1CCCN1c1ncnc2sccc12)NNC(=O)c1cccs1	728674888	VTGXNRSZQLDKLY-GFCCVEGCSA-N	431.499	1.726	50	20	IDGD	
C[C@]1(C2CC2)NC(=O)N(CC(=O)NNC(=O)c2ccc(Br)cc2Cl)C1=O	728832576	NRKGWFCKXCWPCI-MRXNPFEDSA-N	443.685	1.584	50	20	IDGD	
CC(C)OCCCn1c(NNC(=O)c2ccc(-n3cnnn3)cc2)nc2ccccc2c1=O	729279643	MBMPENKRYVIIBA-UHFFFAOYSA-N	448.487	1.944	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NCC2CCN(C(C)=O)CC2)c2ccccc2c1=O	729623788	IJKVPGPZGSWSEH-UHFFFAOYSA-N	442.520	1.399	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)c1c(F)ccc(S(=O)(=O)NC2CC2)c1F	729835614	LQZGIUOUCFGTGY-UHFFFAOYSA-N	443.403	1.385	50	20	IDGD	
Cc1c(C(=O)NNC(=O)CNC(=O)c2ccco2)cnn1-c1cccc(Br)c1	729948939	PJQDBEHDWXCBNN-UHFFFAOYSA-N	446.261	1.727	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)N[C@H]3CCN(c4ccccc4C(N)=O)C3)n[nH]2)cc1	732595727	WIVSPKXSHWFTPH-INIZCTEOSA-N	447.499	1.707	50	20	IDGD	
COCCNS(=O)(=O)c1cccc(CNC(=O)NNc2cccc([N+](=O)[O-])c2C)c1	735586708	OCXJFMCCVRTGCZ-UHFFFAOYSA-N	437.478	1.654	50	20	IDGD	
O=C(NNS(=O)(=O)C[C@@H]1CCCO1)[C@@H]1Cc2ccccc2CN1Cc1ccccc1	735646324	PEDNZNXXYRYENJ-SFTDATJTSA-N	429.542	1.743	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)N[C@@H]1CCN(CC2CC2)C1	739034886	KUCFUIKLCOEYSR-GOSISDBHSA-N	449.577	1.290	50	20	IDGD	
Cc1cc(=O)c(C(=O)NNc2ncnc3[nH]cnc23)nn1-c1cccc(C(F)(F)F)c1	740746764	KTZAUQDTBZBVDG-UHFFFAOYSA-N	430.350	1.983	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2ccc(C[C@H]3CC(=O)NC3=O)cc2)ccc1OC(C)C	741144584	WEOATEZEFAQPDA-KRWDZBQOSA-N	439.468	1.762	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N[C@@H]2CCSC2)cc1	742778520	PAVNZWDQEKSZQA-IUYQLWOBSA-N	425.514	1.963	50	20	IDGD	
O=C(CCn1cnc2ccccc2c1=O)NNC(=O)c1cc(Br)ccc1O	743729660	CBPKYJXXYAMYRL-UHFFFAOYSA-N	431.246	1.716	50	20	IDGD	
COc1ccccc1N1C[C@H](C(=O)OCC(=O)NNC(=O)c2cccc(C)c2)CC1=O	744500101	UWWYJTNIXLCMSE-MRXNPFEDSA-N	425.441	1.361	50	20	IDGD	
CSCc1nc2ccccc2n1CC(=O)OCC(=O)NNC(=O)c1cccc(C#N)c1	744599803	CMRBUMPRDVMXAK-UHFFFAOYSA-N	437.481	1.775	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)CCc2nnc(-c3ccsc3)o2)c1	744654006	PBRYNRQYOHDTGI-UHFFFAOYSA-N	425.426	1.607	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)N[C@@H]2CCN(Cc3ccccc3)C2=O)nc1	744877928	LERKNCHARHYGHK-QGZVFWFLSA-N	446.533	1.196	50	20	IDGD	
C[C@]1(C(=O)OCC(=O)NNC(=O)c2cccs2)CCCN(C(=O)c2ccccc2)C1	745346032	SQISRQJIUOAGMJ-NRFANRHFSA-N	429.498	1.995	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)[C@@H](O)[C@H](C)c2ccc(C)cc2)cc1OC	745756333	MNGZAEMVORCJRM-VLIAUNLRSA-N	430.457	1.481	50	20	IDGD	
CO[C@H](CNC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)c1ccc(Cl)cc1	745864120	WMGVQLDPLDYJIW-MRXNPFEDSA-N	429.864	1.919	50	20	IDGD	
C[C@H]1CC[C@H](C)N1CC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	746093063	JLZGBMQPPLUPAA-IRXDYDNUSA-N	444.557	1.799	50	20	IDGD	
COc1ccc(CCNC(=O)NNC(=O)Cc2cn3ccccc3n2)c(OC)c1OC	746761794	NHLWESXFGODXAV-UHFFFAOYSA-N	427.461	1.476	50	20	IDGD	
Cc1c(C(=O)NNC(=O)Cc2ccc(F)cc2)cc(Br)cc1S(N)(=O)=O	747348569	SKIOOTMOSUOIFS-UHFFFAOYSA-N	444.282	1.548	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)CN2C(=O)N[C@@](C)(c3ccccc3)C2=O)o1	747715879	RWUTVDAVTCKDPI-QFIPXVFZSA-N	441.488	1.350	50	20	IDGD	
Cn1ccnc(NNC(=O)CCCOc2ccc(I)cc2)c1=O	747938291	NXRDJKVZZSWMOC-UHFFFAOYSA-N	428.230	1.687	50	20	IDGD	
O=C(NCCS(=O)(=O)N1CCOCC1)NNC(=O)c1cc2c(s1)CCCCCC2	748112381	XVUGDSSFJYZTGH-UHFFFAOYSA-N	444.579	1.013	50	20	IDGD	
COC(=O)c1ccoc1CSc1ccccc1C(=O)NNC(=O)C(=O)N1CCCC1	748240392	VCKJFORNJFFUTM-UHFFFAOYSA-N	431.470	1.742	50	20	IDGD	
Cc1ccc(F)cc1S(=O)(=O)Nc1cccc(C(=O)NNC(=O)C(=O)N2CCCC2)c1	748342360	GBLQNZQHXCAKQV-UHFFFAOYSA-N	448.476	1.318	50	20	IDGD	
C=CCn1c(SCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)nnc1-c1cccnc1	748346626	PTHKYOUTTVOFQX-UHFFFAOYSA-N	439.457	1.988	50	20	IDGD	
O=C(Cn1ncc2ccccc2c1=O)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1	748523021	LKFFFTNJHKQWRF-UHFFFAOYSA-N	426.376	1.833	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)CCc3ccccc3)CC2)cc1	749804008	QJOBIQSRPGWIGG-UHFFFAOYSA-N	445.541	1.876	50	20	IDGD	
O=C(CCNS(=O)(=O)c1cccc(Br)c1)NNC(=O)CC1CCCC1	749951968	SOKDQMAHCHORKG-UHFFFAOYSA-N	432.340	1.845	50	20	IDGD	
CC[S@](=O)[C@@H]1CCC[C@H](NC(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)C1	750671790	VVRYPODTWITZMH-SSWHHONOSA-N	431.584	1.474	50	20	IDGD	
COCCCNC(=O)NN=C1C(=O)N(CCCOC)c2ccc(Br)cc21	750936195	OOVIFHWLJPDQFW-UHFFFAOYSA-N	427.299	1.872	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)COc1cccc(NC(=O)c2ccco2)c1	751206782	UBZPVYNHVXLAID-UHFFFAOYSA-N	442.453	1.550	50	20	IDGD	
COc1ccc(-c2nnc(SCC(=O)NNC(=O)CNC(=O)c3ccco3)o2)cc1	751207370	WOIOBWPZMJHCTK-UHFFFAOYSA-N	431.430	1.008	50	20	IDGD	
CC(C)[C@H](NC(=O)OCc1ccccc1)C(=O)NNC(=O)CNC(=O)c1cccs1	751211240	OSEWVGDXGWABAI-KRWDZBQOSA-N	432.502	1.576	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)NCc1csc(CCc2ccccc2)n1	751810057	NEMHSADPDTWKRQ-UHFFFAOYSA-N	427.486	1.782	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)c1c[nH]nc1-c1ccc2c(c1)OCO2	752737534	ZULUPJKZJMDTAV-UHFFFAOYSA-N	441.831	1.536	50	20	IDGD	
C[S@](=O)c1ccc(CNC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1	753052081	SMTIVQZCHHJDDQ-HKBQPEDESA-N	443.573	1.467	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCC[C@@H]2CCO[C@H](C)C2)cc1	753344555	KXWVPWCMINBXMU-HZPDHXFCSA-N	426.539	1.151	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cc3ccccc3o2)c(C)c([N+](=O)[O-])c1	753841927	VREDZTASLYKFPB-UHFFFAOYSA-N	440.368	1.836	50	20	IDGD	
Cc1ccc(CNC(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)c(N2CCOCC2)c1	753946281	IHRSNYKCBMSJGU-UHFFFAOYSA-N	439.516	1.918	50	20	IDGD	
COc1ccc2c(c1)C=C(C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)CO2	755041717	RPGXIFMOFDSATM-UHFFFAOYSA-N	431.470	1.183	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN2CCN(c3nccnc3C#N)C[C@@H]2C)cc1C	756909286	NCSUASUTEZSQEB-AWEZNQCLSA-N	427.534	1.252	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc(F)c(Br)cc1F)[C@@H]1COc2ccccc2O1	756929073	YBRUTZRHNYFKKQ-ZDUSSCGKSA-N	449.229	1.877	50	20	IDGD	
NC(=O)c1ccc(NNC(=O)CSCC(=O)Nc2cccc(Br)c2)nn1	757392721	RLPHSJRSEJDBAE-UHFFFAOYSA-N	439.295	1.153	50	20	IDGD	
CC(C)CNC(=O)N1CCC[C@H](CC(=O)NNC(=O)CCNC(=O)OC(C)(C)C)C1	760440284	ZYCNPDOKVJNCNO-OAHLLOKOSA-N	427.546	1.516	50	20	IDGD	
CCCS(=O)(=O)N1CCC(NC(=O)NNC(=O)CSc2ccccc2OC)CC1	761654816	JPXPPGVHZWZUDS-UHFFFAOYSA-N	444.579	1.322	50	20	IDGD	
O=C(Cn1cc(Br)c(=O)c([N+](=O)[O-])c1)NNC(=O)c1cccc(Cl)c1	763272548	RTUWFHIQGPXLKL-UHFFFAOYSA-N	429.614	1.634	50	20	IDGD	
NC(=O)c1cnn2c(C(=O)NNC(=O)c3ccccc3OCc3ccc(F)cc3)ccnc12	763285620	VLEVPNLCJHFMNZ-UHFFFAOYSA-N	448.414	1.621	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2cc(Cl)cc(C(=O)O)c2C)cc1OC	763416418	HYRXTXIPFGWPDJ-UHFFFAOYSA-N	428.850	1.987	50	20	IDGD	
Cc1cc(C(=O)O)cc(S(=O)(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)c1Cl	763439395	OBFWFQCZSUGCAV-UHFFFAOYSA-N	449.913	1.961	50	20	IDGD	
CCN(CC)C(=O)c1ccccc1NC(=O)C(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	763471856	NWDWIGVUUDMMQY-UHFFFAOYSA-N	427.417	1.477	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(OC[C@H]2CCCO2)cc1	763472539	XAYOZXIGIXDZOQ-QGZVFWFLSA-N	428.401	1.552	50	20	IDGD	
CNC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cc3ccccc3cc2O)ccc1Cl	763523573	VFMPHQSEKCNMHF-UHFFFAOYSA-N	440.843	1.958	50	20	IDGD	
COC(=O)NCc1ccc(NC(=O)C(=O)NNC(=O)c2cc3ccccc3cc2O)cc1	763528137	SQYOFQJMGHFMDQ-UHFFFAOYSA-N	436.424	1.801	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccnn2C2CCCCC2)cc(OC)c1OC	763540741	YWYCYYYXEXMCSY-UHFFFAOYSA-N	445.476	1.814	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3ccc4c(c3)OCO4)cc2)C[C@H](C)O1	763548117	JLZNONAGNJLLEF-KBPBESRZSA-N	440.456	1.429	50	20	IDGD	
COC(=O)NCc1ccc(NC(=O)C(=O)NNC(=O)c2cc(C)nc3ccccc23)cc1	763615681	FRBVDYAFYFFVER-UHFFFAOYSA-N	435.440	1.799	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccccc1-c1nncn1CC	763716459	HEHHJQMZYQBNLA-UHFFFAOYSA-N	436.472	1.692	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)n(Cc2ccccc2)n1	763728247	KXTKAWBKQLLBBB-UHFFFAOYSA-N	446.511	1.779	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)NC(C)C)cc2C)c1	763771123	GFCJFSULHARKIA-UHFFFAOYSA-N	442.472	1.550	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2cccc(CN3CCCC3=O)c2)c1	763775933	ZHXLVHHTXZGVIA-UHFFFAOYSA-N	440.456	1.226	50	20	IDGD	
Cc1cccc2c1N(C(=O)C(=O)NNC(=O)c1nn(C(C)C)c(=O)c3ccccc13)CC2	763789883	FBYADJMWLPEVIY-UHFFFAOYSA-N	433.468	1.636	50	20	IDGD	
COCCOc1ncccc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccccc2)on1	764003178	BLRLRFIGKVCINC-UHFFFAOYSA-N	425.401	1.162	50	20	IDGD	
COC(=O)[C@@H]1CN(C(=O)C(=O)NNC(=O)Cc2cccc3ccccc23)c2ccccc2O1	764019552	PHJAWGNOYVGQNF-FQEVSTJZSA-N	447.447	1.497	50	20	IDGD	
COCc1c(Br)cccc1NC(=O)C(=O)NNC(=O)Cc1ccsc1	764026376	YFKFMGYMKQHOEG-UHFFFAOYSA-N	426.292	1.986	50	20	IDGD	
CN(C)CC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)Cc2cccc3ccccc23)cc1	764035628	GORQDMTUUZZQNJ-UHFFFAOYSA-N	447.495	1.669	50	20	IDGD	
O=C(CC(F)(F)F)NNC(=O)C(=O)Nc1ccc(=O)n(Cc2ccccc2Cl)c1	764115942	GJFLCUOOFFSPDZ-UHFFFAOYSA-N	430.770	1.588	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccc([S@](=O)C(F)(F)F)cc1	764136565	SIOFAWGSMCMOKV-PMERELPUSA-N	443.403	1.651	50	20	IDGD	
CCN1CCN(c2ccc(Cl)cc2NC(=O)C(=O)NNC(=O)CCc2ccco2)CC1	764168946	JQCKSJHICBDNCM-UHFFFAOYSA-N	447.923	1.794	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccnn2Cc2ccc(Cl)c(F)c2)c1	764236203	BYQDJRQFWMAIII-UHFFFAOYSA-N	440.822	1.995	50	20	IDGD	
Cc1oc(C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)cc1S(=O)(=O)N(C)C	764333711	DZUIRNALBZHJST-UHFFFAOYSA-N	442.444	1.766	50	20	IDGD	
Cc1nc(COc2ccccc2C(=O)NNC(=O)CNC(=O)c2cccnc2)cs1	764341333	GOMIIYMLRWURRR-UHFFFAOYSA-N	425.470	1.617	50	20	IDGD	
CC(C)(C)OC(=O)N1CCc2cc(NC(=O)C(=O)NNC(=O)Cc3ccncc3)ccc21	764354508	UXLIIDIVRDAFMF-UHFFFAOYSA-N	439.472	1.708	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc4c(c3)CCC(=O)N4)n[nH]2)cc1	764385293	VXGGBCJORYXBCT-UHFFFAOYSA-N	446.467	1.924	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1ccnc(Oc2ccccc2Cl)c1	764398617	HTTJOSQXOMJADW-LBPRGKRZSA-N	436.852	1.665	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H](O)c2cc(Cl)cc(Cl)c2)c1	764599886	VJEJIXDQKXPEMF-HNNXBMFYSA-N	446.312	1.738	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)CCC(=O)OC(C)(C)C)c1	764939642	QYYSQHDPLFCEGK-UHFFFAOYSA-N	427.523	1.600	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)Cc3ccc(S(N)(=O)=O)s3)n[nH]2)cc1C	765567603	QHLGWQRBMJYFIS-UHFFFAOYSA-N	433.515	1.406	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)Cc3ccc(S(N)(=O)=O)cc3)n[nH]2)cc1C	765568865	ZIDXWHUCBWTWQY-UHFFFAOYSA-N	427.486	1.345	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)CN1CCc2c(cccc2NS(C)(=O)=O)C1	766863976	HIOYIMILIPCTNC-UHFFFAOYSA-N	430.530	1.115	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CO[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1OC	767778735	CSLKSMJBSGIZIM-OAHLLOKOSA-N	437.493	1.881	50	20	IDGD	
COCCOc1ccccc1N1CCN(CC(=O)NNC(=O)c2ccc(F)cc2)CC1	768551068	FTZMHNRBHUHENQ-UHFFFAOYSA-N	430.480	1.434	50	20	IDGD	
CCCS(=O)(=O)N1CCC(NC(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)CC1	770144541	GWKHBWSYFNUJRM-ZDUSSCGKSA-N	446.957	1.642	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)NCc3cccc(C(=O)NCc4ccco4)c3)nc21	770352745	XIYOBIBMCHSZQV-UHFFFAOYSA-N	436.432	1.418	50	20	IDGD	
CCOc1ccccc1N1C[C@H](C(=O)NNC(=O)c2ccc3c(c2)OCCO3)CC1=O	770394179	XUFNWPHTCVKZQP-OAHLLOKOSA-N	425.441	1.671	50	20	IDGD	
CCOc1ccccc1C(=O)N1CCC[C@H]1C(=O)NNc1nc(O)c2cnn(C)c2n1	770981507	ZDSCYCFSUVHNAD-AWEZNQCLSA-N	425.449	1.216	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)[C@H](NS(=O)(=O)c1ccc2ccccc2c1)C(C)C	771881673	BRKBNCOCFMPUPJ-IFXJQAMLSA-N	449.529	1.632	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)[C@H]1CC(c2cc(F)ccc2F)=NO1	772897377	GSXDARHNYSKBOF-MRXNPFEDSA-N	436.802	1.575	50	20	IDGD	
O=C(NNc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(C(=O)NCC(F)(F)F)cc1	773656167	JXOBVLYPHYKJEE-UHFFFAOYSA-N	425.323	1.969	50	20	IDGD	
O=C(NNc1cnc2ccccc2n1)C(=O)Nc1ccc(CC(=O)N2CCOCC2)cc1	773718030	IMYGZIVHBQWVEI-UHFFFAOYSA-N	434.456	1.113	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1cnn(-c2ccncc2)c1	774000993	BVDWKDYBFVRKMZ-GFCCVEGCSA-N	428.836	1.474	50	20	IDGD	
CCc1[nH]nc(C(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)c1[N+](=O)[O-]	776201092	DYHJFBVJPOWUGL-UHFFFAOYSA-N	425.446	1.130	50	20	IDGD	
CN(NC(=O)c1c[nH]nc1-c1cccnc1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776206342	SMRXPRLBITXBEZ-UHFFFAOYSA-N	429.481	1.721	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)NCCCCN2C(=O)c3ccccc3C2=O)c1	776623066	LAEBJOAFYUHXGI-UHFFFAOYSA-N	430.486	1.793	50	20	IDGD	
COCCO[C@H]1COCC[C@H]1NC(=O)NNC(=O)c1ccc(F)cc1Br	777274226	HVYXYQWISOGIAT-KGLIPLIRSA-N	434.262	1.353	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)c1cnn(-c2ccccn2)c1C(F)(F)F	778441906	YCMVRGYQAINBMC-UHFFFAOYSA-N	428.371	1.572	50	20	IDGD	
CCOc1ccc(C(=O)NNS(=O)(=O)c2cc(C(=O)OC)oc2CC)cc1OC	778557808	TVQHZTSJKHKQSE-UHFFFAOYSA-N	426.447	1.659	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)[C@@H]2CCCN(S(=O)(=O)c3c(C)n[nH]c3C)C2)c1	780800552	LNLKIOXJNFJYEH-OAHLLOKOSA-N	435.506	1.357	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N[C@@H](C)c2ncn(C)n2)cc1	781392394	MMTONQSANGBJSP-FBKCMUNRSA-N	448.487	1.347	50	20	IDGD	
O=C(NN=c1cc[nH]cc1)Nc1cc(S(=O)(=O)N2CCOCC2)ccc1N1CCCC1	782006791	PGNNQFBWTZQTJQ-UHFFFAOYSA-N	446.533	1.273	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc2c(c1)CCN2C(=O)C(=O)NNc1nc2ccccc2s1	782813124	XPLKQMTXTOHLQU-UHFFFAOYSA-N	445.526	1.579	50	20	IDGD	
CO[C@@H](C)c1cccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)c1	784215251	GLQAPQPEQMCSRQ-ZDUSSCGKSA-N	432.502	1.917	50	20	IDGD	
CCCNC(=O)[C@H]1CN(C(=O)C(=O)NNc2cccc([N+](=O)[O-])c2C)c2ccccc2O1	784351258	MHRRYXZNCSSXBW-GOSISDBHSA-N	441.444	1.667	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)Nc1cccc(CN2CCCCC2)c1	785022987	FICSPUMJLFHNOE-UHFFFAOYSA-N	441.444	1.686	50	20	IDGD	
Nc1c(Cl)ccc(Cl)c1C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	785619670	ZDQARFDVMLLZOZ-ZDUSSCGKSA-N	440.239	1.720	50	20	IDGD	
Cc1nnnn1[C@H](Cc1ccccc1)C(=O)OCC(=O)NNC(=O)c1cccc(Cl)c1	786129965	WMOWDPKRCMMIJJ-QGZVFWFLSA-N	442.863	1.423	50	20	IDGD	
CC(C)(C)C(=O)NC1CCC(C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)CC1	789212221	GLTMJUBWLLRVKR-UHFFFAOYSA-N	428.489	1.584	50	20	IDGD	
COC(=O)[C@@H]1CCCCN1C(=O)c1cccc(NC(=O)C(=O)NNc2ncccc2C)c1	792378256	LVNAPZXSFGDAJT-KRWDZBQOSA-N	439.472	1.640	50	20	IDGD	
C[C@@](O)(CN1C(=O)NC2(CCCC2)C1=O)C(=O)NNc1ccc([N+](=O)[O-])cc1Cl	793711211	YKFBKQPWDWTENK-MRXNPFEDSA-N	425.829	1.307	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)N2CCC(=NNC(=O)c3cccc(C)n3)CC2)cc1	794564017	DEFRTWJQEOZHDS-UHFFFAOYSA-N	429.502	1.919	50	20	IDGD	
O=C(COC(=O)CN1C(=O)C(F)(F)Oc2ccccc21)NNC(=O)c1cccs1	796062183	HQDLZJKNYHAMBV-UHFFFAOYSA-N	425.369	1.071	50	20	IDGD	
O=C(CN1CC[C@]2(CCN(Cc3ccccc3)C2)C1)NNC(=O)c1cccc([N+](=O)[O-])c1	796438391	YQFWEEZAWATSTO-QHCPKHFHSA-N	437.500	1.954	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN2CCN(C(=O)OC(C)(C)C)C[C@@H]2C#N)cc1C	796485909	MDCSKNUCGSBNEA-AWEZNQCLSA-N	435.550	1.825	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN[C@H](C)c2ccc(Br)cn2)cc1OC	796498677	PGFAQWFQZYDOCN-LLVKDONJSA-N	437.294	1.973	50	20	IDGD	
CC1(C)Oc2ccc(NC(=O)C(=O)NNC(=O)CNC(=O)OCc3ccccc3)cc2O1	797369097	NSMLDVCQJAWFBT-UHFFFAOYSA-N	442.428	1.206	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN1C(=O)OCc1ccccc1)[C@H]1COc2ccccc2O1	797407022	IXVAJGBURJKEKY-VQIMIIECSA-N	425.441	1.775	50	20	IDGD	
Cc1ccccc1NS(=O)(=O)c1ccc(C)c(C(=O)NNC(=O)C(=O)NC2CC2)c1	799779182	UQTLXGHLPHQOEN-UHFFFAOYSA-N	430.486	1.144	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)C1(c2ccc(I)cc2)CC1	800501213	KWPXSOQUOPKCIQ-UHFFFAOYSA-N	443.285	1.775	50	20	IDGD	
CCc1cc(C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)c2c(CC(C)(C)C)noc2n1	800690671	HDMXWWCBRXRICK-SNVBAGLBSA-N	425.511	1.073	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)c1nn(-c2ccccc2F)cc1O	801379986	PIYMCSUQBRSOSQ-UHFFFAOYSA-N	426.404	1.572	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)CNC(=O)c2cc(OC)c(OC)c(OC)c2)cc1	802054017	JWAHCZOLDNGULD-UHFFFAOYSA-N	432.433	1.304	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)[C@H](C)NS(=O)(=O)c2ccc(Cl)cc2)cc1	802054724	TYCPIYLVGSXFBA-NSHDSACASA-N	426.882	1.868	50	20	IDGD	
CC(C)OCCS(=O)(=O)NCC(=O)NNC(=O)Nc1ccc(Cl)cc1Cl	802091210	XVXSXCQZEMSEQH-UHFFFAOYSA-N	427.310	1.491	50	20	IDGD	
O=C(NNC(=O)[C@@H]1C[C@@H](O)CN1C(=O)OCc1ccccc1)Nc1ccc2c(c1)OCO2	802106739	SQVDFWDEWIBWSP-CVEARBPZSA-N	442.428	1.340	50	20	IDGD	
O=C(NNC(=O)c1ccc(COc2ccccc2)o1)NNc1ccc(-n2ccnc2)nn1	804869237	WNUJXQSAWPRONC-UHFFFAOYSA-N	434.416	1.805	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCC2(S(C)(=O)=O)CCCC2)ccc1OC(C)C	805840563	RNUKFMLXMWYJJJ-UHFFFAOYSA-N	427.523	1.784	50	20	IDGD	
CC(C)c1nccnc1NNC(=O)C(=O)N1C[C@H](C[C@H]2COCC(=O)N2)c2ccccc21	807065067	CNBVNFXGPTUZNJ-GJZGRUSLSA-N	438.488	1.079	50	20	IDGD	
O=C(NCCc1cc(Cl)c2c(c1)OCCO2)NNC(=O)c1ccc(-n2cnnn2)cc1	807106733	SGVKBENZECPYJQ-UHFFFAOYSA-N	443.851	1.274	50	20	IDGD	
C[C@@]1(C2CC2)NC(=O)N(c2ccc(CNC(=O)NNC(=O)c3ccccc3O)cc2)C1=O	807242130	PJWMORGEZZUFTJ-QFIPXVFZSA-N	437.456	1.761	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)[C@H]1CCCN1C(=O)c1cc(Cl)ccc1OC	807371786	UFITVOUMVZXMHT-OAHLLOKOSA-N	441.912	1.890	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(C(=O)OC)c2cc[nH]c2c1	808934676	QBMWHADNUDKFMC-UHFFFAOYSA-N	438.440	1.682	50	20	IDGD	
COC(=O)c1c(F)ccc(NC(=O)C(=O)NNC(=O)c2cccc(OC(F)F)c2)c1C	810387467	XJULPLPZHYBWCY-UHFFFAOYSA-N	439.346	1.922	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](C(=O)OCC(=O)NNC(=O)c1cccc(C#N)c1)C(F)(F)F	811423959	YYOGPQVFWIJPNH-CYBMUJFWSA-N	444.366	1.318	50	20	IDGD	
CCOC(=O)c1ccc(NNC(=O)c2ccc(S(=O)(=O)N3CCOCC3)cc2)cc1C	812723340	JTCFZNQMABBTME-UHFFFAOYSA-N	447.513	1.950	50	20	IDGD	
CCc1ccc(N2C[C@@H](C(=O)NNc3ccc(S(=O)(=O)N(C)C)cc3)CC2=O)cc1	812726675	JLMHWANWDIOFIC-INIZCTEOSA-N	430.530	1.996	50	20	IDGD	
COC(=O)N(C)c1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)cc1	813033173	IBXFUAVORKVUCP-UHFFFAOYSA-N	449.489	1.221	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)cc1	813034305	HOOQARPHVJHVTM-UHFFFAOYSA-N	441.853	1.580	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)NCC(=O)NCCN3CCCCCC3)cc2C1	814270394	IKMJWOCYCFQYKK-OAHLLOKOSA-N	435.594	1.809	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(Br)c(C#N)c2)cc1	815565280	ISNGPSHYKCKGGK-UHFFFAOYSA-N	442.229	1.357	50	20	IDGD	
Cc1c([N+](=O)[O-])ccc(F)c1NC(=O)C(=O)NNc1ccccc1S(=O)(=O)N(C)C	815752467	TZCFLVUMYRASEM-UHFFFAOYSA-N	439.425	1.374	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N2C[C@@H]3[C@@H](CO)[C@@H]3C2)cc1	816860446	LVTGSDRUSBNUGQ-YHSYIFEBSA-N	435.484	1.038	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)c2cc(S(=O)(=O)NC3CC3)ccc2C)cc1	825553790	BVWLKQHCZXUXJP-UHFFFAOYSA-N	432.502	1.317	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)NCc1ccc(C(=O)N2CCOCC2)cc1	913628119	XANRDFPUPLQZHZ-UHFFFAOYSA-N	442.472	1.077	50	20	IDGD	
Cc1cc(Cl)ccc1OCCCC(=O)NNC(=O)CN(C)[C@@H]1CCS(=O)(=O)C1	914531879	KRUPIVMCAWJHSF-OAHLLOKOSA-N	431.942	1.074	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)NC[C@H](c2ccc(C)o2)N2CCOCC2)c1	916228063	GQPDYBCOABMBDC-LJQANCHMSA-N	430.505	1.988	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NN=Cc1ccc(O)cc1)N(S(C)(=O)=O)CC2	916354541	DZIQSZSPAYBPOL-GOSISDBHSA-N	447.513	1.809	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)NCc2cccc(OCCN(C)C)c2)cc1C	916387660	UCQCOLYLRQMBRJ-UHFFFAOYSA-N	427.505	1.713	50	20	IDGD	
CN1CCN(Cc2ccc(CNC(=O)NNC(=O)COc3ccccc3F)cc2)CC1	916387924	MITMWFQRSKYNLE-UHFFFAOYSA-N	429.496	1.483	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NCc2cccnc2OC2CCCC2)c2ccccc2c1=O	916395247	NRDHBEDICNFMJE-UHFFFAOYSA-N	436.472	1.794	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N[C@H](C)CN1CCOCC1	916470108	JKVMDPZYJURHDY-OLZOCXBDSA-N	429.315	1.268	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2cc[nH]n2)c1	916637146	FJASVWKRBNFFQC-UHFFFAOYSA-N	444.473	1.363	50	20	IDGD	
O=C(COc1ccc(CCNC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1)NC1CC1	918105987	PLPWMRHCGINZSQ-UHFFFAOYSA-N	441.444	1.439	50	20	IDGD	
CCc1ccccc1OCC(=O)NNS(=O)(=O)c1ccc(CCNC(C)=O)s1	918724832	DYYGAYJYOZWKLO-UHFFFAOYSA-N	425.532	1.378	50	20	IDGD	
CNS(=O)(=O)c1ccc([C@@H](C)NC(=O)NNC(=O)Cc2nc3ccccc3n2C)cc1	919779793	ZUZOSELBEZAYMF-CYBMUJFWSA-N	444.517	1.116	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCC(C)(C)N1CCC[C@@H](C)C1	919796634	HWHPFBMHTKXYMD-CQSZACIVSA-N	438.598	1.743	50	20	IDGD	
COc1cc(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)cc(Cl)c1OCC(C)C	919886025	SQTZMUBFWOXHTB-GFCCVEGCSA-N	433.914	1.515	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)c2cc3c(c(S(N)(=O)=O)c2)CCC3)c1C	1321968685	PQJDDSCZBCMDPT-CQSZACIVSA-N	431.514	1.668	50	20	IDGD	
C[C@H](C(=O)N1CC[C@@]2(CN(C(=O)C(Cl)Cl)CCO2)C1)N1CSCSC1	1779150133	UNQWRZDYNNNSCU-ABAIWWIYSA-N	428.407	1.663	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(OC)cc(OC)c3)C2)C1	1780663269	BLBARBBNVBVDDI-FXAWDEMLSA-N	426.897	1.401	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cc(C(=O)O)n(C(C)C)n3)CCO2)C1	1781214546	ZMAMWNPXGFZYTB-BFUOFWGJSA-N	426.901	1.623	50	20	IDGD	
Cn1nc2c(c1C(=O)N1CCO[C@@]3(CCN(C(=O)[C@@H](F)Br)C3)C1)CCC2	1781332791	JICWGQNOXBNKNL-RHSMWYFYSA-N	429.290	1.043	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1c[nH]c3nccc-3c1)C2	1782172693	KKASOCUXVGPKSX-CBGDNZLLSA-N	434.924	1.896	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H]1CCC(F)(F)C1)C2	1782210306	NZYLZTMKHNVOQC-RZQQEMMASA-N	444.523	1.309	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cc4cn[nH]c4cn3)CCO2)C1	1783349861	USBLLVNZPJNGAB-FZKQIMNGSA-N	436.310	1.575	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3CCC(CO)CC3)[C@H]2C1	1785058736	YXFZSQXQFXWQJR-VCUUKQMESA-N	431.371	1.548	50	20	IDGD	
O=C1CC(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](Br)Cc2ccccc2)CCO3)C1	1785409005	FLRFVDJACXXJRB-WIYYLYMNSA-N	449.345	1.802	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Cl)C[C@@H]21)c1cnc(-c2ccccn2)nc1	1785504793	WLHGNTRTQZPTDC-ZFZWDLNGSA-N	433.871	1.666	50	20	IDGD	
CCc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCBr)[C@H]3C2)n(C)n1	1786406068	GPWUFIWMKBWWJF-NOLJZWGESA-N	427.343	1.361	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3cnn(C)c3)[C@H]2C1	1787012256	KJQNJZSBVBDGEU-TUUVXOQKSA-N	427.343	1.116	50	20	IDGD	
O=C(NC1(c2ccc(NC(=O)[C@@H](O)c3ccccc3)cc2)CCC1)c1cccc(B(O)O)c1	1787852755	DJKPVDMMASCKFT-QFIPXVFZSA-N	444.296	1.848	50	20	IDGD	
Cc1cn2c(=O)c(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)[C@@H](F)Cl)C[C@@H]43)cnc2s1	1788036170	QYCLYNHMALZLLJ-DOERSZECSA-N	442.900	1.192	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CO[Si](C)(C)C)C[C@@H]32)o1	1788605880	WIIRUYLZQXWJBX-ZOBUZTSGSA-N	437.569	1.683	50	20	IDGD	
O=C(/C=N/O[C@H]1CCCCO1)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21	1788657588	BROYVYOYWDNARR-PEDMVSAGSA-N	446.342	1.280	50	20	IDGD	
Cn1cncc1C(=O)NC1(c2ccc(NC(=O)c3cnccc3C(=O)NN)cc2)CCC1	1789521355	ZKWVDUPNGVSBFJ-UHFFFAOYSA-N	433.472	1.480	50	20	IDGD	
CCOC(=O)C(C)(C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]2C1	1789872585	ONHRJLUHGVYKCA-WFTHSTBKSA-N	437.364	1.792	50	20	IDGD	
CCOC(=O)C(C)(C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]2C1	1789927056	OQDIRLOACUIACY-ZDEQEGDKSA-N	437.306	1.246	50	20	IDGD	
CCN(CC)C[C@@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)CBr)C[C@@H]21	1790595688	VJHAAOUMLJXAPD-ADHGMGHFSA-N	446.430	1.975	50	20	IDGD	
COc1ncc(Cl)cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)Br)C2	1792402959	USEBINFDWSVQEI-DYNIEEOBSA-N	446.729	1.730	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CCc2ccccc2[C@@H]1O	1793039075	ZXVBRWLNUQUWKO-VVMYPULBSA-N	446.620	1.724	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccc(F)cc1	1795249640	IRHLXMBPVBKAGU-FRQROOTJSA-N	427.314	1.989	50	20	IDGD	
CCc1[nH]nc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)CBr)C3)c1Cl	1795902992	GPVQSSHBFVXRPJ-NJBDSQKTSA-N	447.761	1.860	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2)c1nn(-c2ccccc2)c2c1COC2	1796096906	XBQANLUQJKUUQM-JBYDNAENSA-N	448.882	1.640	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)c1ccncc1C(F)(F)F	1796191005	NRYXVEOGEJTEQQ-MUJYYYPQSA-N	447.222	1.346	50	20	IDGD	
Cc1nc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)CBr)C3)sc1C	1798405911	HLBRNEBLZUQALV-WTDIUWLJSA-N	430.368	1.994	50	20	IDGD	
COc1ccnc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@](C)(Cl)CCl)c1OC	1799277993	ZZWONBWUINSTHU-MAAUKKLOSA-N	446.331	1.538	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccccc1O	1800570586	YRZHQUAYPBABQE-KRXQYRFLSA-N	425.323	1.698	50	20	IDGD	
COc1ccccc1CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Br)C2	1800630624	DKFPKDSUSXUJSW-LJGDNWOOSA-N	425.323	1.611	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cnc3ccccn13)C2	1800638026	MBZLKYMGOHGKDS-QHHYFVSCSA-N	449.349	1.640	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(O)c(OC)c1)C2	1800642428	HPRXISMUJRIVOD-LOUJCGABSA-N	441.322	1.778	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1ccc3c(c1)OCO3)C2	1800975270	KCCPCBOATREQSZ-UIVXKWKOSA-N	438.908	1.191	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCNc1ccc(C)cc1C)C2	1800977376	ZECUOSRYQMIYOK-BMQTXXJKSA-N	437.968	1.949	50	20	IDGD	
CC[C@@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](C)NS(=O)(=O)CC)C2	1801798422	HLIOWXCXBRXOLS-PDWCTOEPSA-N	438.388	1.126	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cc(F)ccc1[N+](=O)[O-]	1802095580	VVDCJDBSHSKAAM-ZFHGCVPZSA-N	443.859	1.120	50	20	IDGD	
COc1ccc(OCC(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)cc1	1802813011	XHXAXIUREYARIC-NBHGPNQESA-N	447.919	1.775	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc3cnccc3n2)[C@@H]1c1cccnc1)[C@H](O)CCl	1803139798	WACOAVHTACJSRV-PWIZWCRZSA-N	439.903	1.944	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)Cc2cccc(Cl)n2)[C@H]1c1cccnc1)[C@H](O)CCl	1803141830	SIQLTNZLYIAKRN-GMBSWORKSA-N	437.327	1.978	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)c1	1803145725	HJRNUSJBWUEPRF-RLLQIKCJSA-N	444.919	1.959	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC2(CCN(C(=O)CN3C(=O)C=CC3=O)CC2)C1	1805389161	KABRVHUAUPADHO-CQSZACIVSA-N	440.338	1.174	50	20	IDGD	
O=C(c1cccn(C(F)F)c1=O)N1CCC2(CCCN(C(=O)[C@H](O)CCl)C2)CC1	1805523712	ZPDWAWDUQFCIGX-CQSZACIVSA-N	431.867	1.688	50	20	IDGD	
CCOC(=O)/C=C/C(=O)NC[C@@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1	1806294060	LRBUSVFGOWGQBU-LBLGZAAXSA-N	438.322	1.992	50	20	IDGD	
CC1(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)CCCC1	1807365782	PFYDUSYAPCJMQW-CTNGQTDRSA-N	435.333	1.661	50	20	IDGD	
C[C@H](C(=O)NC[C@@H]1CCN(C(=O)C(Cl)Cl)[C@H]1c1cccnc1)N1CCN(C)CC1	1807877482	IWXWYFXLCULJOC-PVAVHDDUSA-N	442.391	1.527	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2ncn(C(C)C)n2)[C@H]1c1cccnc1	1808721524	NICJESKREYEIRJ-YESZJQIVSA-N	434.928	1.827	50	20	IDGD	
Cc1nc(CC(=O)N2CCC3(CCCN(C(=O)c4ccc(B(O)O)cc4)C3)CC2)cs1	1809968763	DLZACYPFSQSALM-UHFFFAOYSA-N	441.362	1.219	50	20	IDGD	
C=CCNC(=O)/C=C\C(=O)N1CC[C@H](CNC(=O)CO[Si](C)(C)C)[C@H]1c1cccnc1	1810537559	KZLMDTBXPVAAJG-YYNCDVECSA-N	444.608	1.797	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC2(CCCN(C(=O)c3cccc4c[nH]nc34)C2)CC1	1810614721	MNGVJJSFBCDETD-UHFFFAOYSA-N	446.316	1.401	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2cccnc2C(N)=O)[C@@H]1c1cccnc1	1813027796	DGRAFCMWHCRCNW-QILLFSRXSA-N	445.907	1.149	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)Cc2ccccc2)[C@@H]1c1cccnc1	1813070507	IIMGIXVRIYFOMC-GBXCKJPGSA-N	437.544	1.703	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)C2CC(C)(C)C2)[C@H]1c1cccnc1	1813074388	QLMDCYUDZSQSQJ-UWJYYQICSA-N	429.565	1.897	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2nc(O)n3c2CCCC3)[nH]n1)[C@H](O)CCl	1814872356	HDEWEEGDICDORT-TZMCWYRMSA-N	436.900	1.554	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@H]2CC(c3ccccc3)=NN2)[nH]n1)[C@H](O)CCl	1814875148	QAZRRGXZDVCGQA-FGTMMUONSA-N	444.923	1.768	50	20	IDGD	
COCCOCCOCCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](O)CCl)n[nH]1	1814877727	JMEYOYJFHLQGPV-CVEARBPZSA-N	446.932	1.071	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@H]1CCc2nc(NC(=O)Cn3ccnn3)sc2C1	1815764678	YZIKWCHAACUOKS-ZJUUUORDSA-N	427.328	1.378	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@H](F)Br)[nH]n1)c1cccc(=O)n1O	1816148878	NHPNVIFFNIBSJN-HZMBPMFUSA-N	442.245	1.805	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)cn1C	1817471741	LNORZKVHANRWLU-IBGZPJMESA-N	435.293	1.356	50	20	IDGD	
CC(=O)Nc1cc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)[C@@H](O)CCl)[nH]n2)ccn1	1818416589	TYNVLJLEGFEFJH-CABCVRRESA-N	434.884	1.669	50	20	IDGD	
COc1ccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)cc1	1820570242	POTOBDDMZRZIAJ-FQEVSTJZSA-N	448.288	1.718	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc(O)c(F)c2)n[nH]1	1821094986	AMVDTCAMZJPITC-INIZCTEOSA-N	446.483	1.933	50	20	IDGD	
Cc1cc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)[C@@H](O)CCl)[nH]n2)nc2nccn12	1821478065	QQCUDVFNVUYULC-CABCVRRESA-N	431.884	1.666	50	20	IDGD	
CC(C)CNC(=O)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](C)Br)n[nH]1	1822187671	YPPWADNVRQKLJU-WCQYABFASA-N	428.331	1.957	50	20	IDGD	
Cc1[nH]nc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)c1F	1822412887	JGPPIDBPCYXTTH-CYBMUJFWSA-N	434.476	1.259	50	20	IDGD	
O=C(/C=C/C1CCCC1)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2	1822936706	VOZPZPXPGSPYQS-UPKKBRNCSA-N	439.346	1.795	50	20	IDGD	
CC(=O)c1cc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)n[nH]1	1825709180	ADTGHGVVANJSON-IBGZPJMESA-N	446.552	1.219	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2csc(N)n2)CC1	1826966280	AAIKQLUFCKRFGS-INIZCTEOSA-N	436.582	1.332	50	20	IDGD	
O=C(CCBr)N1CCC([C@H]2CCCCN2C(=O)[C@@H](O)N2CCOCC2)CC1	1828967090	UEAAAELXOZVNFM-SJLPKXTDSA-N	446.386	1.042	50	20	IDGD	
O=C(c1cccc2c1CCCC2)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1830738277	NHDDNBFAJIHOQZ-KNQAVFIVSA-N	436.936	1.235	50	20	IDGD	
O=C(CCCC(F)(F)F)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1832261613	LFUKCYBROGTWMC-OCCSQVGLSA-N	449.239	1.866	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)/C=C/c3ccsc3)CCO2)C1	1833142816	QJIOZMFXJBDWLY-BAXQNQMVSA-N	428.938	1.472	50	20	IDGD	
C[C@@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)c3cnc[nH]3)CC2)CC1	1833262629	ZMUOHCFRSIAPBW-ZDUSSCGKSA-N	426.359	1.626	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cccc4nc[nH]c34)CC2)CC1)[C@@H](O)CCl	1833310794	SRZLQBPPBQQXND-SFHVURJKSA-N	433.940	1.348	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnc(OC)c(F)c3)CCO2)C1	1833485771	SFEKRFMUHHGGIY-KUHUBIRLSA-N	429.876	1.317	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)CBr)C3)C2)no1	1834343563	LQOCHZOUJGUYQZ-SJKOYZFVSA-N	430.299	1.084	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)CN3CCCCC3)CC2)CC1	1834613672	RIKYOADDDUUXMZ-MRXNPFEDSA-N	443.430	1.827	50	20	IDGD	
Cc1cc(F)cc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCBr)CCO3)C2)c1	1834823740	HOZMNYGLSXWUPL-LJQANCHMSA-N	443.313	1.989	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H]3Cc4ccccc4CN3)CC2)CC1)[C@H](F)Cl	1835079760	QCOZWCFJYVHDPG-UXHICEINSA-N	436.959	1.807	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](CN)c3ccccc3)C2)C1	1837711879	VDUCDTKWXNDCTD-SIKLNZKXSA-N	449.624	1.037	50	20	IDGD	
CC(C)c1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)n[nH]1	1838698745	XESQPCSAEHJBPZ-RBUKOAKNSA-N	447.363	1.839	50	20	IDGD	
CCNC(=S)NCC(=O)N1CCC(OC2CCN(C(=O)C(Cl)Cl)CC2)CC1	1838722984	ZMLOSBGQGVJRSN-UHFFFAOYSA-N	439.409	1.273	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccnc(NC(C)=O)c3)C2)C1	1839145011	QLKOOLNJEAWKCP-UZLBHIALSA-N	438.912	1.127	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnoc3C3CC3)C2)C1	1839151193	KMIZRWKDDVSDIY-OALUTQOASA-N	446.331	1.858	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(F)cn3)C2)C1	1839963869	ZEAPLYCRRWDKQZ-KBXCAEBGSA-N	444.301	1.464	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(F)cn3C)C2)C1	1839964619	XKHAIQHQUGWXDT-KSSFIOAISA-N	446.317	1.408	50	20	IDGD	
Cc1nscc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)Br)CCO2	1840031511	SBVFELMRZLGTFZ-MEDUHNTESA-N	432.340	1.305	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(Cl)ccc3F)C2)C1	1840149010	APFFPQNEYPWEBB-DNVCBOLYSA-N	449.306	1.803	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(OC)c3)C2)C1	1840154363	VLJHKKHHIOWDKL-XLIONFOSSA-N	426.897	1.019	50	20	IDGD	
COc1nccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)c1F	1840188091	NEYYEQONCKZTJW-KRWDZBQOSA-N	436.267	1.103	50	20	IDGD	
COC(=O)CCCCCC(=O)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840190908	USPHDLBXTUKPLP-SFHVURJKSA-N	439.336	1.370	50	20	IDGD	
Cc1ccc(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)c(C)n1	1840337577	CFEKJJHTUCNCKL-QUCCMNQESA-N	427.904	1.622	50	20	IDGD	
N#Cc1ccccc1OCC(=O)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1840820421	OSEMGTUTWSDCPB-IBGZPJMESA-N	442.299	1.197	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@H](O)C(=O)N1CCCC12CN(C(=O)[C@](C)(Cl)CCl)C2	1841300854	ZNSBFCHVGQOJKJ-YVEFUNNKSA-N	438.352	1.312	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC2(CCCN2C(=O)CCN2C(=O)c3ccccc3C2=O)C1	1841910374	JMWLUMKQVSKQPL-UHFFFAOYSA-N	443.576	1.728	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)c2cnc(N)s2)C1	1842981010	SHFAISFGFFOUQH-UHFFFAOYSA-N	445.457	1.690	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1cn(C)c3ncccc13)C2	1843416337	YBVWVSADZAMORX-CVKSISIWSA-N	447.499	1.524	50	20	IDGD	
C[C@H](Br)C(=O)N1CC2(CCCN2C(=O)c2c(Br)cnn2C)C1	1843605429	MFOGTGFFLWVQLV-VIFPVBQESA-N	434.132	1.783	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)C2CCN(c3ccc(F)cn3)CC2)C1	1845830683	VNNJZIGPPCEYJQ-KRWDZBQOSA-N	438.931	1.894	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)c2nn(-c3ccccc3F)c(C)cc2=O)cc1	11273731	CSJJHBATKIJKCM-UHFFFAOYSA-N	438.415	1.606	50	20	IDGD	
O=C(CCc1nnc(-c2ccccc2)o1)NNC(=O)c1csc(N2CCOCC2)n1	21967666	GJPOERVIWWPJHG-UHFFFAOYSA-N	428.474	1.424	50	20	IDGD	
COc1ccc(-c2nnc(S)n2CC(=O)NNC(=O)c2ccc(OC)c(OC)c2)cc1	26961649	GFOUQERREPBLDG-UHFFFAOYSA-N	443.485	1.721	50	20	IDGD	
CSc1cccc(N2C[C@H](C(=O)NNC(=O)[C@@H]3COc4ccccc4O3)CC2=O)c1	26974258	HOCSSXHDLOVVGL-ACJLOTCBSA-N	427.482	1.749	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)CN2C(=O)N[C@@]3(C[C@H](C)CC(C)(C)C3)C2=O)c1	104669864	QCHMNGCZXGKSCP-IVZQSRNASA-N	430.505	1.658	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)c2ccc(S(=O)(=O)NCCC#N)cc2)c(C)c1	104870384	HDQGGYJJLSERHD-UHFFFAOYSA-N	429.502	1.369	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1Br	725892190	LNLWXCBDDPLAJF-UHFFFAOYSA-N	430.236	1.989	50	20	IDGD	
COc1cc(Br)c(CNC(=O)NNC(=O)Cn2nc(C)cc2C)cc1OC	727228497	OJCNSVVNHAQQCM-UHFFFAOYSA-N	440.298	1.810	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)COc1cccc(N2CCCC2=O)c1	727969848	QEBAGFXYNZDDLP-UHFFFAOYSA-N	427.457	1.817	50	20	IDGD	
O=C(CCNS(=O)(=O)c1cccc([N+](=O)[O-])c1)NNc1nc(-c2ccccc2)no1	728079695	VZPOSWGFZHSURG-UHFFFAOYSA-N	432.418	1.457	50	20	IDGD	
O=C(CCN1C(=O)NC2(CCCC2)C1=O)NNC(=O)c1cc(F)ccc1Br	728549353	DASBPOZSLPXKDI-UHFFFAOYSA-N	441.257	1.604	50	20	IDGD	
CC(C)COc1ncccc1C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	728606819	QNRRNRLEEQLXFF-UHFFFAOYSA-N	447.561	1.809	50	20	IDGD	
CCN(CC)C(=O)N1CCC(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)CC1	728844901	AJOSUZVISQAEOQ-UHFFFAOYSA-N	431.541	1.014	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1Cl	728853923	HVRWEDBXWYVWLO-UHFFFAOYSA-N	425.898	1.365	50	20	IDGD	
CC[C@@H](NC(=O)NNC(=O)c1cc(OC)cc(OC)c1)c1cccc(S(N)(=O)=O)c1	729231772	YDACRTKLGOAEKE-QGZVFWFLSA-N	436.490	1.447	50	20	IDGD	
O=C(NCc1cccc(C(=O)N2CCOCC2)c1)NNC(=O)c1cccc2ncccc12	730122446	NXXADEBELURSKR-UHFFFAOYSA-N	433.468	1.851	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)c1nnn(-c2cccc(F)c2)c1C(F)(F)F	730778125	JASIOBFYJZLWPV-UHFFFAOYSA-N	439.325	1.971	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ncccc2Cl)c1C(F)(F)Cl)C(=O)NC1CC1	730999236	QOARNJITFOCVIL-UHFFFAOYSA-N	433.202	1.248	50	20	IDGD	
CC(=O)Nc1ccc(NS(C)(=O)=O)c(C(=O)NNC(=O)c2c(C)nc3ccccn23)c1	731434222	LCIXHLVWEHOOEL-UHFFFAOYSA-N	444.473	1.047	50	20	IDGD	
CCCCN(C)C(=O)c1ccccc1S(=O)(=O)NNC(=O)[C@@H]1COc2ccccc2O1	731469504	WTNDDKFNDGNHNA-SFHVURJKSA-N	447.513	1.708	50	20	IDGD	
C[C@H]1CN(C(=O)OC(C)(C)C)CCN1C(=O)NNC(=O)CNC(=O)c1cccs1	731682620	CVAWNABYJMCNMV-LBPRGKRZSA-N	425.511	1.160	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)c1cccc(CN2CCOCC2)c1	732067394	BWOYZLOVUULMRH-UHFFFAOYSA-N	430.530	1.716	50	20	IDGD	
Cn1c(N)c(C(=O)/C(C#N)=C\c2ccc(N3CCCCC3)c([N+](=O)[O-])c2)c(=O)n(C)c1=O	732578116	GUMLYYPTRSOPQT-UVTDQMKNSA-N	438.444	1.355	50	20	IDGD	
COc1cc(OC)cc([C@H](O)CNC(=O)NNC(=O)c2cccc(OC(F)F)c2)c1	735682287	GEZUVDUQKINYFT-MRXNPFEDSA-N	425.388	1.983	50	20	IDGD	
CCc1ccccc1OCC(=O)NNS(=O)(=O)c1ccc2c(c1)N(C(C)=O)CCC2	736063564	LCTALUQBPGIPJY-UHFFFAOYSA-N	431.514	1.937	50	20	IDGD	
Cc1cc(NNC(=O)C2CCN(S(=O)(=O)c3cc([N+](=O)[O-])ccc3C)CC2)nc(C)n1	736717025	RSNOGGKPLFKAPB-UHFFFAOYSA-N	448.505	1.854	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@H](CCCO)c2ccccc2)cc1	741093648	BMWDGUOPQNPEHX-LJQANCHMSA-N	448.545	1.460	50	20	IDGD	
CCO[C@@H](C)c1noc(CN2CCN(C(=O)NNC(=O)c3ccccc3OC)CC2)n1	743602499	JRJAAFFLYWYYLD-AWEZNQCLSA-N	432.481	1.348	50	20	IDGD	
C[C@@H](Oc1ccc(F)c(F)c1)C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	744620602	IPRKWLDRMICJMM-CYBMUJFWSA-N	441.456	1.896	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccccc2CNC(=O)NNc2ccc(Cl)nc2)CC1	745830935	SSKHQAMGZBBTHX-UHFFFAOYSA-N	438.941	1.497	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CC(=O)NNC(=O)CNC(=O)c1ccco1)c1ccccc1	746162761	NQIXTIIFXWKGMS-HNNXBMFYSA-N	430.461	1.813	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)c2cc3c(N(C)C)ncnc3n2C)cc1	747199702	UQZFKOIBTSTUBM-CYBMUJFWSA-N	426.477	1.662	50	20	IDGD	
Cc1nc(C(=O)NNC(=O)Cc2c[nH]c3ccccc23)nn1-c1n[nH]c(C(F)(F)F)n1	747348232	MRPBFPRMVZOCLW-UHFFFAOYSA-N	433.354	1.198	50	20	IDGD	
COc1cc(OC)cc(N2CC[C@H](NC(=O)NNC(=O)COc3ccc(C#N)cc3)C2)c1	748662171	QOCZLXLZLSVXGL-INIZCTEOSA-N	439.472	1.564	50	20	IDGD	
CC[C@@H](C)C(=O)N1CCC[C@@H](C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)C1	751043852	RGHBPKGJZDTVAW-WOJBJXKFSA-N	443.592	1.631	50	20	IDGD	
O=C(COC(=O)c1cnn(-c2ccc(Cl)cc2)n1)NNC(=O)c1cccc([N+](=O)[O-])c1	751820165	QBKOLMHOKXDSAD-UHFFFAOYSA-N	444.791	1.447	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)c1cccc2nc(O)oc12	752127668	PZDSIUJAKHMRSF-UHFFFAOYSA-N	443.891	1.766	50	20	IDGD	
COc1cc(OC)cc(N2C[C@@H](C(=O)NNC(=O)c3cc(-c4ccccc4)[nH]n3)CC2=O)c1	752520020	KWYHXWPFSFZOJF-HNNXBMFYSA-N	449.467	1.908	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2cc(Cl)c(Cl)cc2Cl)cc1O)C(=O)N1CCCC1	752795671	UPWRNEBMTUWZDZ-UHFFFAOYSA-N	446.678	1.922	50	20	IDGD	
O=C(NNC(=O)N1CCO[C@@]2(CCc3ccccc32)C1)c1csc(N2CCOCC2)n1	753000419	PPXDKITTZUBVJV-NRFANRHFSA-N	443.529	1.508	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)N[C@H]2CCCN(Cc3ccccn3)C2=O)c1C	753297060	FZYRFCLAQWMZCB-MJGOQNOKSA-N	439.516	1.987	50	20	IDGD	
O=C(NNC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1)c1ccc2nnc(O)n2c1	754383102	PYHSMQNXZNOECV-UHFFFAOYSA-N	440.423	1.757	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)c([N+](=O)[O-])c1)c1cccc(S(=O)(=O)N2CCCCC2)c1	754829456	MSCZWCDGDUNBJS-UHFFFAOYSA-N	448.457	1.550	50	20	IDGD	
CC(=O)c1cccc(S(=O)(=O)NCCC(=O)NNc2ccc(C(F)(F)F)nn2)c1	755187862	RNHFQVRUISDYRD-UHFFFAOYSA-N	431.396	1.510	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)Nc2ccc(S(=O)(=O)N(C)OC)cc2)cc1	755535125	GSCUNYHKYPMSLQ-UHFFFAOYSA-N	438.462	1.109	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc1-n1cnnn1	756748579	ZRAMOFVALWLONI-UHFFFAOYSA-N	435.404	1.029	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)Nc1cnn(CC2CC2)c1	756813552	QFFVNERWKQZVBH-UHFFFAOYSA-N	432.506	1.544	50	20	IDGD	
C[C@H]1CN(C(=O)Cn2cc(NC(=O)NNC(=O)CCCc3ccccc3)cn2)C[C@@H](C)O1	756838160	LXEKRXQOLCBLBV-CALCHBBNSA-N	442.520	1.695	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)cc1S(C)(=O)=O	757780977	XFOLYXPKEHBSKX-UHFFFAOYSA-N	428.511	1.856	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)Nc1cccc2c1CCN2S(C)(=O)=O	758296251	LMNKEVMCEMGTCO-UHFFFAOYSA-N	448.501	1.639	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)N[C@H]2CN(C(=O)OC(C)(C)C)C[C@H]2C#N)cc1C	758751658	KIJGGLCJWWDFPD-WBVHZDCISA-N	431.493	1.772	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)c2ccc(=O)n(-c3cnn(C)c3)c2)cc1Cl	760820570	WXONWPHFUJLGKB-UHFFFAOYSA-N	446.851	1.708	50	20	IDGD	
O=C(COC(=O)c1cnc(-c2cccnc2)s1)NNC(=O)c1cccc([N+](=O)[O-])c1	761609506	DBTMNANPNWDRBB-UHFFFAOYSA-N	427.398	1.731	50	20	IDGD	
CC(C)CNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1	763441405	CSJQPFVGXCHMBL-UHFFFAOYSA-N	427.417	1.380	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1Br	763445731	JXISAOICQNEOOD-UHFFFAOYSA-N	437.206	1.766	50	20	IDGD	
COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NNC(=O)c1ccccc1Br	763482057	DJMFEBLYTUGMQI-UHFFFAOYSA-N	437.206	1.766	50	20	IDGD	
C[C@@H]1Oc2ccc(NC(=O)C(=O)NNC(=O)c3cc4ccccc4cc3O)cc2NC1=O	763521048	AYLDPTJMKVNSOK-NSHDSACASA-N	434.408	1.665	50	20	IDGD	
COC(=O)c1cc(OC)ccc1NC(=O)C(=O)NNC(=O)c1cc(C)nc2ccccc12	763618519	BJCBTPPSIDCFTQ-UHFFFAOYSA-N	436.424	1.738	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2ccccc2-c2nncn2C(C)C)c1	763618856	GGICXUVHSYNSOW-UHFFFAOYSA-N	436.472	1.999	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2cc(Cl)ccc2C(=O)N(C)C)c1	763628961	CTQAWRDZOYVVHD-UHFFFAOYSA-N	432.864	1.515	50	20	IDGD	
O=C(COc1cccc(C(F)(F)F)c1)NNC(=O)C(=O)Nc1nc2c(s1)COCC2	763639581	OUUJNUOUVRFTKJ-UHFFFAOYSA-N	444.391	1.400	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2ccc3oc(N(C)C)nc3c2)c1	763665445	JFPMJRQWQAVAFB-UHFFFAOYSA-N	425.445	1.676	50	20	IDGD	
COc1cc(OC)c(NC(=O)C(=O)NNC(=O)COc2ccccc2F)cc1Cl	763682164	YPFUVYYBHBHHBO-UHFFFAOYSA-N	425.800	1.661	50	20	IDGD	
CCOC(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)c1	763683803	AKHRGXBDDULMKE-UHFFFAOYSA-N	433.848	1.611	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc2nc3n(c(=O)c2c1)CCC3	763712526	JDDJTBMGHNTMGJ-UHFFFAOYSA-N	449.467	1.070	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2ccc(Oc3cccnc3)nc2)c1	763772686	OOCWJGXJEXMHRL-UHFFFAOYSA-N	437.412	1.686	50	20	IDGD	
CCOC(=O)c1cc(CC)sc1NC(=O)C(=O)NNC(=O)c1cc(OC)cc(OC)c1	763773072	TXDLAHUOXUKUTD-UHFFFAOYSA-N	449.485	1.904	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2ccc(N3CCOCC3)cc2C)c1	763773272	UQYRMWRBXALHBM-UHFFFAOYSA-N	442.472	1.249	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)C(=O)Nc2cccc(OC(F)(F)F)c2)c2ccccc2c1=O	763791772	YNPHKDXTCRJBMQ-UHFFFAOYSA-N	449.345	1.232	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1c(F)c(F)c(F)c(F)c1F	763808614	YZTQNTWGBDHLBY-UHFFFAOYSA-N	428.273	1.419	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)c1ccc(-c2ccc3c(c2)OCCO3)s1	763825548	ZLIHRBBRVOLRRT-UHFFFAOYSA-N	438.465	1.772	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2nn(C(C)(C)C)cc2C#N)cc1	763859306	AJUMDIROSORDEG-CYBMUJFWSA-N	442.476	1.462	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1cccc(CN2CCOC2=O)c1	763865433	KNTVYUYSFJUWSO-CYBMUJFWSA-N	444.419	1.331	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)N1C[C@@H]2CCCN2c2ccccc21	763873430	STRCMZPJDKQEOW-ZBFHGGJFSA-N	426.448	1.756	50	20	IDGD	
O=C(NNC(=O)c1cc2c(s1)CCCCCC2)C(=O)Nc1cccnc1-n1cncn1	763912693	ZWALBRBGZXCCBF-UHFFFAOYSA-N	439.501	1.783	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccccc2S(C)(=O)=O)ccc1OC(C)C	763915700	FGIDHVNBWKNMLW-UHFFFAOYSA-N	449.485	1.286	50	20	IDGD	
CCCn1ccc2cc(NC(=O)C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)ccc21	763916204	CWLYHVWVEKAPIS-UHFFFAOYSA-N	432.444	1.427	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)C(=O)Nc1ccccc1OCC(F)F	763945032	SBNADOMEVKTNTK-UHFFFAOYSA-N	445.382	1.622	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)C(=O)Nc1ccccc1N1CCCCC1	763948288	IWCUNNRRFRNFEU-UHFFFAOYSA-N	448.483	1.968	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)C(=O)Nc1ccnn1Cc1ccc(C(F)(F)F)cc1	763992398	DHBMIIKNXVEJDA-UHFFFAOYSA-N	434.378	1.688	50	20	IDGD	
CCNC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)c2cccc3ccccc23)cc1	764059065	YWEKGUULOUDJLS-UHFFFAOYSA-N	434.452	1.754	50	20	IDGD	
CC[C@@H](C)C(=O)NNC(=O)C(=O)Nc1cccc(S(=O)(=O)N(C)c2ccccc2)c1	764082599	DYBWIXLXABCILP-CQSZACIVSA-N	432.502	1.644	50	20	IDGD	
O=C(CC(F)(F)F)NNC(=O)C(=O)Nc1cccc(CS(=O)(=O)C2CCCCC2)c1	764115695	UJLPRKIAJQPXLH-UHFFFAOYSA-N	449.451	1.972	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)cc1S(C)(=O)=O	764125905	AJZRNOQDKPEBLY-UHFFFAOYSA-N	425.850	1.157	50	20	IDGD	
O=C1CCc2cc(NC(=O)C(=O)NNC(=O)c3cc(Br)ccc3O)ccc2N1	764278017	PYFBUFDHTSZHES-UHFFFAOYSA-N	447.245	1.439	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C(=O)Nc1cc(F)c(S(C)(=O)=O)c(F)c1)c1ccccc1	764328971	IMDQGCDAVVQSIO-ZDUSSCGKSA-N	439.440	1.648	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1ccccc1Nc1ccc(F)cc1F	764399588	KOPDJZOANOJHLA-LBPRGKRZSA-N	436.415	1.846	50	20	IDGD	
CCS(=O)(=O)c1cccc(CC(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)c1	764615288	OTHQLICXBFTPPJ-UHFFFAOYSA-N	438.889	1.681	50	20	IDGD	
CC(C)(C)OC(=O)N1CCO[C@@H](C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)C1	765385108	MSVZNTFGFRQCHN-MRXNPFEDSA-N	440.522	1.206	50	20	IDGD	
CC(C)(C)OC(=O)N1CCO[C@@H](CC(=O)NNC(=S)NCCc2cccs2)C1	765395045	SCIFQFFIFXQAIM-ZDUSSCGKSA-N	428.580	1.812	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3ccnc(Br)c3)CC2)cc1	766639473	AOSHRIVFLFUZOO-UHFFFAOYSA-N	446.349	1.731	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCN(S(=O)(=O)CBr)CC2)cc1Cl	767852279	WMPYEYFYFQFPHV-UHFFFAOYSA-N	447.760	1.337	50	20	IDGD	
CCn1c(=O)c2ccccc2n(CC(=O)NNC(=S)Nc2ccc(C)c(C)c2)c1=O	768055385	MUJPINXSRBDPNW-UHFFFAOYSA-N	425.514	1.818	50	20	IDGD	
O=C(CCCc1ccccc1)NNC(=O)C(=O)Nc1cc(C2CC2)nn1-c1ncccn1	768240410	WDRDSKKOOLFKIP-UHFFFAOYSA-N	433.472	1.649	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(OCC(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)C1	768288895	HAVCESUQBBSHBJ-UHFFFAOYSA-N	433.440	1.613	50	20	IDGD	
CCCCS(=O)(=O)N1CCC[C@H]1C(=O)NNc1c(OC)cccc1S(C)(=O)=O	768636638	WLDOIEADBPSSNS-ZDUSSCGKSA-N	433.552	1.136	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)(C)C)c2ccccc2c1=O	769050126	ZTFPJDKTTCJDJB-OAHLLOKOSA-N	431.493	1.634	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NC2CCN([C@@H]3CCC[C@H]3O)CC2)ccc1OC(C)C	769152362	DTGLIZPUFMEBON-QZTJIDSGSA-N	434.537	1.804	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)Nc1cc(S(C)(=O)=O)ccc1C	769225143	JWEDQQLUPBOSMF-UHFFFAOYSA-N	427.504	1.959	50	20	IDGD	
CN1CCN(CCCNC(=O)NNc2nc(O)c3cnn(C)c3n2)[C@H](c2ccccc2)C1	770339080	CSNRQSZDSCPCGY-KRWDZBQOSA-N	439.524	1.074	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3ccoc3Br)CC2)cc1	770622053	JPXMJDIAHAEZPH-UHFFFAOYSA-N	435.322	1.929	50	20	IDGD	
COC(=O)c1ccnc(NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1	770680197	XEVFMPCUIMEQEM-UHFFFAOYSA-N	447.473	1.119	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)[C@@H]3CC(c4ccccc4)=NO3)cc2)CC1	772442454	NNGIYCOVZSJLAY-FQEVSTJZSA-N	443.529	1.259	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(F)cn2)cc(OCC)c1OCC	773511502	NMIVHEXSTCSMMR-UHFFFAOYSA-N	434.424	1.817	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2ccc(C(F)(F)F)cn2)n[nH]1	773545924	KXEWOLONTZVKIA-UHFFFAOYSA-N	448.361	1.899	50	20	IDGD	
CCCNC(=O)[C@H]1CN(C(=O)C(=O)NNC(=O)c2ccc(C)c(F)c2)c2ccccc2O1	773888126	AJUXOHKWVCSNNL-GOSISDBHSA-N	442.447	1.216	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccccc1OCCC(N)=O	774006117	ADHRHQHNBVNNJE-GFCCVEGCSA-N	448.863	1.148	50	20	IDGD	
O=C(CN1CCN(Cc2nc3ccccc3[nH]2)CC1)NNC(=O)c1cccc([N+](=O)[O-])c1	774727201	LNPPYVMIGQQPQU-UHFFFAOYSA-N	437.460	1.050	50	20	IDGD	
O=C(NC[C@@H]1COC2(CCOCC2)O1)NNC(=O)c1ccc(COc2ccccc2)o1	776885759	SPKHEAFJGLRKOO-QGZVFWFLSA-N	431.445	1.725	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H](CC(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)C1	777817365	OTHPZNOFPYHKRU-AWEZNQCLSA-N	438.912	1.751	50	20	IDGD	
CN(CC(=O)NNc1cc(Cl)nc(N)n1)S(=O)(=O)c1ccc(Br)cc1	779376714	XHFGZCIDCDRFGV-UHFFFAOYSA-N	449.718	1.239	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CSc2nnc(Cc3csc(C)n3)o2)cc1OC	779990663	AEZSPXPFDAUMDS-UHFFFAOYSA-N	449.514	1.996	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2ccc(C(=O)OC)cc2OC)c2ccccc2c1=O	782079482	FJIFDLOJYHVMJC-UHFFFAOYSA-N	439.428	1.678	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)C(=O)Nc1cc(Cl)cc(Cl)c1	782896195	CINIOHDDCKURTC-UHFFFAOYSA-N	444.300	1.686	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)Nc2ccccc2C)cc1C	783417435	SGOJSALPKDHRFS-UHFFFAOYSA-N	433.490	1.856	50	20	IDGD	
COC(=O)[C@H](Cc1ccc(F)cc1)NNC(=O)CCN1CCN(c2ccccc2)CC1	783574164	TZCPJCLXLJECCC-NRFANRHFSA-N	428.508	1.743	50	20	IDGD	
CSc1nnnn1-c1cccc(NC(=O)C(=O)NNc2cccc([N+](=O)[O-])c2C)c1	784353456	DVJUQONAFDJJSB-UHFFFAOYSA-N	428.434	1.683	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1cccc(NC(=O)C(=O)NNc2ncccc2Cl)c1	784820959	FDKODJWKQHSSQF-UHFFFAOYSA-N	425.898	1.894	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)C(=O)Nc1cccc(Oc2cnccn2)c1	785060865	QCKGQCACWGAYLM-UHFFFAOYSA-N	431.412	1.245	50	20	IDGD	
COc1cc(F)cc(NNC(=O)C(=O)Nc2ccc3oc(=O)n(CCN(C)C)c3c2)c1	785235350	XXNAJIDXHKASRT-UHFFFAOYSA-N	431.424	1.386	50	20	IDGD	
COc1cc(F)cc(NNC(=O)C(=O)Nc2ccc(C(=O)N3CCOCC3)cc2C)c1	785241742	POXVKZQZUJTNJE-UHFFFAOYSA-N	430.436	1.697	50	20	IDGD	
CC1=C(C(=O)NNC(=O)[C@H](C)Oc2cccc(Br)c2)[C@@H](C)n2ncnc2N1C	788266585	XYPNCJXVHPKNEO-NEPJUHHUSA-N	449.309	1.940	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ncc(C(C)(C)C)s2)cc(OC)c1OC	789730742	ZXLUGQLBADCHOP-UHFFFAOYSA-N	436.490	1.866	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)Nc1cc(C#N)cn1C(C)(C)C	789732031	OFUYKIWFXMDEJJ-UHFFFAOYSA-N	435.282	1.615	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)Nc1ccnn1-c1ccc(Br)cn1	790580261	UHIYFLRPSGEEKX-JTQLQIEISA-N	427.259	1.234	50	20	IDGD	
CCS(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2ccc3c(c2)OCCO3)s1	792222184	GMPUENJSJSPZLX-UHFFFAOYSA-N	425.488	1.457	50	20	IDGD	
COc1cc(C(F)(F)F)ncc1NC(=O)C(=O)NNC(=O)c1ccc(Cl)cc1O	792269417	SMLSKIXBNAFLCV-UHFFFAOYSA-N	432.742	1.868	50	20	IDGD	
CCN=c1nc(NCC)n2c(SCC(=O)NNC(=O)c3cccc(Cl)c3)n[nH]c2n1	794563164	MFIZISYCNKHVML-UHFFFAOYSA-N	449.928	1.012	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CN2CC[C@@H](N3CCN(C(=O)OC(C)(C)C)CC3)C2)cc1	796620367	ZKFAOOINFYQTJC-LJQANCHMSA-N	445.564	1.383	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@]2(F)CCN(C(=O)OCc3ccccc3)C2)cc1	801108012	DDLBLPALRRBVJU-QFIPXVFZSA-N	442.447	1.832	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)c2ccc(S(C)(=O)=O)c([N+](=O)[O-])c2)o1	801139375	DBEZKTGVQUZUFN-UHFFFAOYSA-N	438.462	1.508	50	20	IDGD	
O=C(N=c1cc[nH]cc1)NNC(=O)c1ccc(S(=O)(=O)NCCc2cccs2)cc1	802024714	JGODPNODKJLJNQ-UHFFFAOYSA-N	445.526	1.553	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccc(C(=O)NNC(=O)Nc2ccc3c(c2)OCO3)cc1	802096117	XAFZTWLDJMRKAI-UHFFFAOYSA-N	434.474	1.959	50	20	IDGD	
Cc1ccc(Cc2ccccn2)cc1NC(=O)C(=O)NNC(=O)[C@@H]1COc2ccccc2O1	802566085	YPYHAWORGIUTAD-NRFANRHFSA-N	446.463	1.907	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)c2cc(S(N)(=O)=O)ccc2F)c(OC)cc1Cl	803396082	AVHKLXNHPONARG-UHFFFAOYSA-N	446.844	1.610	50	20	IDGD	
CCCN(NC(=O)c1ccccc1S(=O)(=O)N1CCOCC1)C(=O)OC(C)(C)C	804593813	FITOVSNZENIEDH-UHFFFAOYSA-N	427.523	1.999	50	20	IDGD	
CN(C)C(=O)COc1ccc(C(F)(F)C(=O)NNc2ccc(-n3ccnc3)nn2)cc1	804954870	RTEIUAYFQGUQET-UHFFFAOYSA-N	431.403	1.364	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)[C@@]1(C(F)(F)F)CCN(C(=O)OC(C)(C)C)C1	805649206	NRXBJAXNSXBYBM-QLJPJBMISA-N	425.404	1.665	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)Nc1ccc(F)c(S(=O)(=O)NC2CC2)c1	806383908	DJKKGORXJMRBFE-UHFFFAOYSA-N	432.441	1.391	50	20	IDGD	
O=C(NC[C@@H](c1cccs1)N1CCOCC1)NNC(=O)c1nnc(O)c2ccccc12	806993505	AXLLWUYJIHIYDT-HNNXBMFYSA-N	442.501	1.414	50	20	IDGD	
CNS(=O)(=O)c1cc(NC(=O)C(=O)NNc2cccc(C(F)(F)F)n2)ccc1F	807016203	PJQMIOPEBAEULT-UHFFFAOYSA-N	435.359	1.229	50	20	IDGD	
Cc1cc(I)cc(NC(=O)C(=O)NNc2nc3ccccn3n2)c1	807033500	RTZUOAMYAJRPBW-UHFFFAOYSA-N	436.213	1.724	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)C2(S(=O)(=O)c3ccccc3)CCOCC2)cc1	809143004	IVLHQBQTGOXLAQ-UHFFFAOYSA-N	443.481	1.108	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)c2cccc(C[S@](C)=O)c2)c2ccccc2c1=O	810465717	KLUZWQYCQBFPHM-PMERELPUSA-N	426.498	1.931	50	20	IDGD	
O=C(NNC(=O)N1CC[C@@]2(CCc3ccccc3O2)C1)c1csc(N2CCOCC2)n1	811851947	YUZAVNJBVACYBA-NRFANRHFSA-N	443.529	1.804	50	20	IDGD	
COC(=O)c1cc(Br)cc(C(=O)NNC(=O)CCN2C[C@@H](C)O[C@H](C)C2)c1	812451595	IOYAAKHICJOFKT-VXGBXAGGSA-N	442.310	1.496	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccc(OC(F)F)nc2)cc1	813033050	BUALFNVZDHXHNO-UHFFFAOYSA-N	429.405	1.015	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2cc(C#N)cn2C(C)(C)C)cc1	813033152	HEZJWMGUAZIODB-UHFFFAOYSA-N	432.506	1.447	50	20	IDGD	
CC(=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O)c1nc(-c2ccccc2)cs1	814785335	QKJYYHZIBIEBAW-UHFFFAOYSA-N	430.515	1.235	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCc2nncn2C1)C(=O)Nc1ccc(Oc2cccc(F)c2)cc1	815691437	QAORTZWAIJNMRT-CYBMUJFWSA-N	438.419	1.558	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1ccnn1-c1cccc(F)c1	815751598	GCBUGFBXCPWNQN-UHFFFAOYSA-N	446.464	1.344	50	20	IDGD	
COC(=O)Nc1ccc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)N(C)C)cc1	815751777	NXJIQSURKZRIEE-UHFFFAOYSA-N	435.462	1.197	50	20	IDGD	
NS(=O)(=O)N1CCC[C@@H](C(=O)NNC(=O)c2ccc(-c3ccc(F)cc3)s2)C1	816830219	WTYPJVKDHDSKQJ-GFCCVEGCSA-N	426.495	1.231	50	20	IDGD	
O=C(NNC(=O)c1cn(-c2ccccc2)nc1-c1ccccc1)N[C@@H]1CCS(=O)(=O)C1	915880704	WJHMWGZQOHGGIY-MRXNPFEDSA-N	439.497	1.670	50	20	IDGD	
CNS(=O)(=O)c1ccc(CNC(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)s1	916233532	ZSYHXFVIUNSHEM-CYBMUJFWSA-N	440.547	1.571	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)NCCS(=O)(=O)Cc2ccccc2)cc1C	916636189	RQQQCOJTTWAEME-UHFFFAOYSA-N	432.502	1.187	50	20	IDGD	
CCC[C@@H](C)N1C[C@@H](C(=O)NNC(=O)c2nn(CCC)c(=O)c3ccccc23)CC1=O	917519031	HDZTYSTWQMYJPE-CABCVRRESA-N	427.505	1.605	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2nn(-c3ccccc3)cc2O)cc1OC	917944635	BSDUXSYTXMXOJW-UHFFFAOYSA-N	440.412	1.213	50	20	IDGD	
CCC(CC)C(=O)N1CCC(NC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])CC1	918231924	JWBAJYKPOZCJSH-UHFFFAOYSA-N	435.481	1.731	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)Cn2cnc3ccc(Br)cc3c2=O)c(O)c1	918339129	INMXOLHJQFNIGV-UHFFFAOYSA-N	431.246	1.634	50	20	IDGD	
NC(=O)[C@H]1CC(C(=O)NNC(=O)c2ccc(F)cc2Br)=NN1c1ccccc1	918341236	GIVMNSRNUMOIQC-OAHLLOKOSA-N	448.252	1.469	50	20	IDGD	
O=C(CC(F)(F)F)NNC(=O)c1ccc(NC2=NS(=O)(=O)c3ccccc32)cc1	918365805	LETBKRXUWGBJFI-UHFFFAOYSA-N	426.376	1.961	50	20	IDGD	
COc1cc(C=NNC(=O)c2nnc(-c3ccccc3)o2)cc(OC)c1OCC(N)=O	920381474	MZZPELFHWCNHJF-UHFFFAOYSA-N	425.401	1.382	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)NCc2cccc(C(=O)N3CCOCC3)c2)c2ccccc21	920423534	UNZHKGOXYSTIFH-UHFFFAOYSA-N	435.484	1.795	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)[C@@H](C(C)C)n2nnc(-c3ccccc3)n2)cc1	920584784	QENXLOTVUJEAJZ-LJQANCHMSA-N	436.472	1.850	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)c1nc(S(C)(=O)=O)n2ccccc12	921166075	FSUCGYFKFWZJQR-UHFFFAOYSA-N	440.485	1.111	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)CCCC[C@@H]2SC[C@@H]3NC(=O)N[C@@H]23)cc1OC	921302884	RFOIFQQURLOKMA-QANKJYHBSA-N	436.534	1.581	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(Cl)s1)NNc1cncc(Br)c1	1116395505	MKVRDXMQZHCXLU-UHFFFAOYSA-N	425.717	1.981	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)[C@@H]2CC23CCS(=O)(=O)CC3)cc1Cl	1325261868	IOYXHKPSJSCQQN-JTQLQIEISA-N	431.898	1.725	50	20	IDGD	
O=C(NNS(=O)(=O)c1c(F)cccc1Br)[C@@H]1COc2ccccc2O1	1340314861	FBVCUVFLBWMHNY-ZDUSSCGKSA-N	431.239	1.738	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H]3Cc4ccccc4O3)C2)C1	1778249581	UXRFAWFVDVSYNU-XAUMDUMWSA-N	437.334	1.994	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H]2Cc3ccccc3O2)C1	1778840602	MQPGFTYWBLYQKZ-WGQQHEPDSA-N	436.936	1.758	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(CCN(C(=O)[C@@H]3ON=C(c4ccccc4)O3)C2)C1	1778873526	QIYPUJZSTAKAKQ-LEWJYISDSA-N	447.564	1.403	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cn(C)nc3C(F)(F)F)C2)C1	1779544853	VXCYLEYFAYCWPO-MLGOLLRUSA-N	438.834	1.136	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(N(C)C)nc3)C2)C1	1779759512	CBVSLNFXTNWSTD-LIRRHRJNSA-N	439.354	1.622	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cn(C(C)(C)C)nn3)C2)C1	1780355935	CJNOUQGXUYPWDQ-YVEFUNNKSA-N	428.331	1.260	50	20	IDGD	
COc1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](O)CCl)C3)ccc1O	1780442346	QSWJAUJTZJOGCA-WRWLIDTKSA-N	426.897	1.128	50	20	IDGD	
CCOC(CC(=O)N1CCO[C@@]2(CCN(C(=O)[C@](C)(Cl)CCl)C2)C1)OCC	1781232442	FYJZVSMHFDECMN-MSOLQXFVSA-N	425.353	1.842	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc3ccnn13)C2	1782179804	UPUHZFNUCJOCDD-YRISNDGFSA-N	434.924	1.716	50	20	IDGD	
CCOC(=O)C(C)(C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](Cl)COC)C2	1783229001	UACMHDPQTRUSGG-STXHMFSFSA-N	432.945	1.343	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)CN(C)C(=O)OC(C)(C)C)CCO2)C1	1783532125	DLUXDNRFBUOXPI-ACJLOTCBSA-N	448.358	1.467	50	20	IDGD	
COc1cc(F)ccc1CC(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](C)Br)C2)C1	1783536727	GZBQPPPQZKEQJP-BFUOFWGJSA-N	443.313	1.990	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(S(C)(=O)=O)c3)[C@H]2C1	1783749277	YUSKHSSLPUIDHR-OWLYRPNTSA-N	442.965	1.701	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(=O)c4ccccc4o3)[C@H]2C1	1783825813	JKRPMIKLBGXRNK-NTNQKNOYSA-N	448.903	1.640	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)CC(C)(C)C(=O)OC(C)(C)C)CCO2)C1	1783881315	KTIZQOVCOXYXFF-QVKFZJNVSA-N	446.972	1.828	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cccc(C(=O)N(C)C)c3)CCO2)C1	1783883916	MWGLLHBBGJWKAT-UTKZUKDTSA-N	437.924	1.086	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1c[nH]c(C(C)(C)C)c1)CCO2	1783935644	AZSKSOMGBMBTKS-QFIPXVFZSA-N	433.553	1.129	50	20	IDGD	
O=C(/C=C/c1ccc(O)c(O)c1O)N1CCO[C@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783951337	FURXIVUGCFLQRF-ROVVAWJSSA-N	431.272	1.450	50	20	IDGD	
C=C[C@@H](O)C(C)(C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]2C1	1783966252	BSNLNGWRLCFJHT-OLMNGRFOSA-N	431.371	1.570	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(-c4ccccc4)no3)C[C@@H]21)[C@H](O)CCl	1784091359	PPECAAPHWCXBLD-BVYOLEPJSA-N	433.892	1.535	50	20	IDGD	
CCCNC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](Br)CC)C[C@@H]21	1784375741	DJDXHBJOHJNEHR-JONQDZQNSA-N	446.386	1.446	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)c1cnnc(Cl)c1	1785452724	COMCISKGUIFPGU-KYVBTAMFSA-N	435.681	1.414	50	20	IDGD	
C[C@H]1[C@@H](C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](F)Cl)CCO3)CCN1C(=O)OC(C)(C)C	1785739423	WOLIQFUCQKOMKV-KZDUYQQSSA-N	447.935	1.996	50	20	IDGD	
Cc1nc2ccc(F)cn2c1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]2C1	1787450532	ZAGKZHUYJFRSPB-MJFSBKNWSA-N	426.851	1.910	50	20	IDGD	
CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]2C1	1787450538	ZEMZIYVANIFTER-GQGQLFGLSA-N	442.875	1.789	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)c3cncc(F)c3)CCC2)cc1)c1ccc(B(O)O)cc1	1788140371	VOSYHTRANFMJED-UHFFFAOYSA-N	433.248	1.962	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccncc3O)[C@H]2C1	1788823443	AKGMCPVQIYTILZ-DUPGQFARSA-N	426.311	1.412	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3[nH]nc4ncccc34)C[C@@H]21	1789865925	JOTFGKWAAGXVLP-LDBIXWDDSA-N	440.331	1.788	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]2C1)N1C[C@H]2C[C@H]2C1	1789867846	GZYBEDQBAVMZEX-UQSYLFMPSA-N	432.392	1.543	50	20	IDGD	
CC(=O)O[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]2C1)C(C)C	1789868106	NLZZKXQVGIGBRC-GMHRPJKWSA-N	437.364	1.790	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]2C1)c1ccccn1	1789926817	GGIOCSQAOQAJLI-YOPIWALVSA-N	428.302	1.855	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)c1cccc2nccn12	1790414120	VKBVGLARPTZORB-DZKIICNBSA-N	435.322	1.713	50	20	IDGD	
C#CC[C@@H](NC(=O)OC(C)(C)C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Cl)C[C@@H]21	1792257969	QZCIPHXNJVSVDJ-ARKGTOAJSA-N	445.919	1.417	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(=O)c2ccccc2o1	1792853967	HCIJKSPGIFGZQW-MUJYYYPQSA-N	440.500	1.418	50	20	IDGD	
COCCn1nccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](C)CBr	1792988315	VBABQZUEBAQEKL-XQLPTFJDSA-N	427.343	1.812	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(OC)nc1	1793574067	WMAHJRXGABOEQR-FQLMCAECSA-N	426.311	1.467	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnn2ncccc12	1796275942	ZMBSNGPQKLOYQS-ABXQLRGKSA-N	426.304	1.169	50	20	IDGD	
Cc1cc2nc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)c3ccc(B(O)O)cc3)C4)[nH]c2cc1C	1798360362	ICZWODRXEUHWRO-REPLKXPHSA-N	446.316	1.425	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CNC(=O)c1cc(C)on1	1798511118	GBLQVHZVONXJSR-XJFOESAGSA-N	441.326	1.525	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc3cc(C)ccn3c1=O)C2	1799268365	WLNLXEVKDOLHER-CXHZTBPHSA-N	432.908	1.224	50	20	IDGD	
N[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Br)c1cccc(Cl)c1	1799346589	SFYRDNJBOAPANA-BJBXXJATSA-N	448.720	1.620	50	20	IDGD	
COc1ccc2[nH]cc(/C=C/C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@@H](O)CCl)C4)c2c1	1799387051	QURDTVATIFHCOL-HLUXNRJXSA-N	447.919	1.379	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)ccc1O	1799793997	PCYMVZVFTUFFTO-VAECKANCSA-N	427.295	1.475	50	20	IDGD	
CN(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cn[nH]c1)C2)NC(=O)NCc1ccccc1	1799871534	MMVQWTVQGZIBDX-REPLKXPHSA-N	439.520	1.008	50	20	IDGD	
COC[C@@H](C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C#N)=C/c1ccc(F)cc1F	1800332168	DBSCHSWALGIMRF-GBCXSXDXSA-N	433.455	1.744	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1C[C@@H]1c1ccc(F)c(F)c1)C2	1800970676	GYZLWUCZDZPEIO-NWBCRBGPSA-N	442.890	1.912	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)n1ccccc1=O	1803142831	KEOONVVIYYVIGO-VYCZESIESA-N	432.908	1.110	50	20	IDGD	
Cn1ncc(Br)c1C(=O)N1CCC2(CCCN(C(=O)[C@H](O)CCl)C2)CC1	1805522905	FOUYHLAKOVRONN-CYBMUJFWSA-N	447.761	1.627	50	20	IDGD	
Cc1ccc(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)nc1	1805870762	XVNVMUCZLPTDIJ-UGKGYDQZSA-N	444.300	1.098	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)CCSC(=N)N)[C@H]1c1cccnc1	1807127970	YFPZQVGPVISVKY-CORIIIEPSA-N	442.383	1.888	50	20	IDGD	
CC(C)[C@H](S)C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1807359098	DTGPEUWTPZBIRK-RLLQIKCJSA-N	441.362	1.035	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)cn1	1807369712	SEUAQVGMXRDZDG-SIKLNZKXSA-N	444.300	1.098	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)Cc2ncccn2)[C@@H]1c1cccnc1)[C@@H](F)Br	1808651106	IIUPVSGZKLAFCT-IAOVAPTHSA-N	436.285	1.811	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@H]1CCN(C(=O)CSCC(=O)O)[C@@H]1c1cccnc1	1810549246	ZGZGSINMGXOVPJ-DNVCBOLYSA-N	439.610	1.757	50	20	IDGD	
C=C(C(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1)C(F)(F)F	1812682071	JLQRJWCMXOVCMA-CRAIPNDOSA-N	441.454	1.579	50	20	IDGD	
O=C(COc1cccnn1)NC[C@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1	1813389491	RRFYHMGPQOAVRZ-DNVCBOLYSA-N	448.321	1.741	50	20	IDGD	
C[C@H](CBr)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCS(C)(=O)=O)[nH]n1	1814783620	QXVJSVIBCUKQLE-DGCLKSJQSA-N	449.371	1.868	50	20	IDGD	
Cc1ncc(C(=O)N[C@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)s1	1815341328	WOXBUMFKKBNPBS-ZDUSSCGKSA-N	442.331	1.127	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1sccc1F)CC2)c1cccc(B(O)O)c1	1815350319	QGMNYACZJHBSRU-GFCCVEGCSA-N	445.306	1.563	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccnnc3O)sc2C1	1821093309	YYESRNYCRNFKPE-DTWKUNHWSA-N	440.323	1.896	50	20	IDGD	
O=C(N[C@H]1CCc2nc(NC(=O)c3ccoc3Cl)sc2C1)c1cccc(B(O)O)c1	1821809097	BJHOMDZQYCZIDO-LBPRGKRZSA-N	445.693	1.609	50	20	IDGD	
CC[C@@H](Br)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2c[nH]c(=O)cn2)[nH]n1	1822089590	DLSDWYJHAFPMTN-MFKMUULPSA-N	437.298	1.972	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2CCCSC2)[nH]n1	1822418297	ZFAQTBMCKUMUFM-ZBFHGGJFSA-N	436.582	1.918	50	20	IDGD	
O=C(N[C@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1)c1cc(O)ncn1	1822999478	SCTVDJSJMCDTAG-UPONEAKYSA-N	430.259	1.555	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H]3CNC(=O)C3)sc2C1	1825203204	HRWFKEGQURBDPP-BBBLOLIVSA-N	429.340	1.365	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CN1CCOCC1)CC2	1825445404	WAOQNYZEJHBAIO-RYUDHWBXSA-N	445.383	1.561	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnc(O)nc1O)CC2	1825640900	KWLWJPKNFJDLBZ-NKWVEPMBSA-N	442.295	1.354	50	20	IDGD	
C[C@@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1)c1ccccn1	1827060342	YEMRVIWIVJATPK-JPYJTQIMSA-N	449.360	1.798	50	20	IDGD	
C[C@@]1(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2ccc(B(O)O)cc2)CC3)CC1(F)F	1828047763	UMRCVUSJXPITTR-XIKOKIGWSA-N	435.261	1.094	50	20	IDGD	
COc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)c(O)c1	1830363545	BHAKGGGOSGGTKD-NRFANRHFSA-N	440.924	1.736	50	20	IDGD	
C=CCOCCCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)CBr)C2)C1	1831404395	MRPRUPRMCHKTKH-APWZRJJASA-N	447.370	1.457	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H](N)CCC(N)=O)CC1	1831549043	MGAQVRFNKUBDKX-PMPSAXMXSA-N	445.402	1.372	50	20	IDGD	
COC(=O)NCC(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@H](C)CBr)CC1	1832062284	AYXCCTVYNZXHQX-HIFRSBDPSA-N	432.359	1.993	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3cccs3)CCO2)C1	1833160678	WEHDBOLBZYISHI-QFBILLFUSA-N	430.954	1.391	50	20	IDGD	
C[C@@H](Nc1cccnc1)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1834718487	IQYJJZWTZLWYMO-BEFAXECRSA-N	437.972	1.053	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cnn4ncccc34)CC2)CC1	1835040175	NTCOLXULXFRFKS-SFHVURJKSA-N	432.956	1.932	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](F)Cl)CC2)CC1)[C@@H]1Cc2ccccc2CN1	1835058840	ZSVGVDQVXQFNNS-PMACEKPBSA-N	436.959	1.807	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)/C=C/c3cccc(O)c3)C2)C1	1837715915	RKQRTASOZOXFNX-DORXLWPQSA-N	448.592	1.713	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3nccnc3C)CCO2)C1	1838216090	BBLPHIKCEPAKOO-KSSFIOAISA-N	441.326	1.029	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)cc1	1838984940	CHJAJYZRTPTOHF-BEFAXECRSA-N	425.323	1.848	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(OC)cc3OC)C2)C1	1839146648	RJWQGGSXYBLMAD-UTKZUKDTSA-N	440.924	1.791	50	20	IDGD	
CCn1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)n1	1839150970	DJKYYPWTAGGPEH-ROUUACIJSA-N	433.336	1.209	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)COc3ccccc3)C2)C1	1840031783	BZTTUZZWGSGPBA-HNAYVOBHSA-N	441.322	1.305	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(F)ccc3OC)C2)C1	1840156947	YPRRNOGBWTYRIS-OXJNMPFZSA-N	444.887	1.158	50	20	IDGD	
COc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)ccc1C	1840189323	LAJVCBLBDPEDGH-IBGZPJMESA-N	431.316	1.877	50	20	IDGD	
C=CC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCCC12CN(C(=O)[C@H](O)CCl)C2	1845209558	ROYWEHMUGLECNV-QZTJIDSGSA-N	449.935	1.661	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC12CN(C(=O)/C=C/C(=O)NCc1ccco1)C2	1846070842	HVBROTASNPBKBN-LFAOLKIESA-N	438.322	1.829	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@H]1CC(=O)N(c3cccc(OC)c3)C1)C2	1846359663	FDKFNQGSRZTMEQ-YJBOKZPZSA-N	449.935	1.505	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@H]1CCCN1C(=O)OC(C)(C)C)C2	1846364983	UECXUPGSQYHASX-LSDHHAIUSA-N	429.945	1.843	50	20	IDGD	
CCOC(=O)N(CC(=O)N1CCCC12CN(C(=O)[C@@H](Cl)COC)C2)Cc1ccco1	1846531211	OWCDQUDIHFWUBL-INIZCTEOSA-N	441.912	1.695	50	20	IDGD	
CN(C)C(=O)c1cccc(C(=O)N2CCCC23CN(C(=O)[C@@H](F)Br)C3)c1	1846924038	OROJUQSINFSGQO-CQSZACIVSA-N	426.286	1.896	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2cc(Br)cn2C)cc([N+](=O)[O-])cc1[N+](=O)[O-]	12393470	LLNYSXCYAPQBPO-UHFFFAOYSA-N	426.183	1.987	50	20	IDGD	
CC(=O)c1ccc(N2CCN(CC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)CC2)c(F)c1	15040052	GLBMQRUSAZLIHW-UHFFFAOYSA-N	443.435	1.520	50	20	IDGD	
O=C(NNC(=O)c1ccc(-c2ccc(F)cc2)s1)C1=CN2CCS(=O)(=O)N=C2C=C1	15822206	LGPUUCZRUBHHSX-UHFFFAOYSA-N	446.485	1.813	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)c2cn(C)c3ccccc23)cc1	17320121	XBIRNOOXGSYIQE-UHFFFAOYSA-N	436.515	1.052	50	20	IDGD	
CCn1nc(C(=O)NNC(=S)Nc2ccc3c(c2)OCCO3)c2ccccc2c1=O	17451341	XXGHEYMNJGJMJR-UHFFFAOYSA-N	425.470	1.819	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CN2C(=O)N[C@@](C)(C3CC3)C2=O)ccc1OCCC(C)C	22739504	RBZCBJUMCPHQNE-QFIPXVFZSA-N	446.504	1.602	50	20	IDGD	
CSCC[C@H](C(=O)NNC(=O)c1ccc2c(c1)OCO2)N1C(=O)c2ccccc2C1=O	26964223	ITYPSOCYIYMUMU-OAHLLOKOSA-N	441.465	1.594	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(C(=O)NNC(=S)Nc2ccc(C)cc2C)cc1	28616848	AQKRNRXZUATGRD-UHFFFAOYSA-N	436.559	1.860	50	20	IDGD	
O=C(Cc1cc(=O)[nH]c(=S)[nH]1)NN/C=C1/C(=O)N(c2ccccn2)C(=O)c2ccccc21	28807724	ZIFDQPLENNSSRH-RVDMUPIBSA-N	448.464	1.219	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C2=NN(c3ccc(F)cc3)[C@@H](C(N)=O)C2)o1	109422249	UYOXBTRETHKDIA-QGZVFWFLSA-N	444.467	1.142	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCC(=O)Nc1cccnc1	725859775	GEDFQQSCSVLHLR-NSHDSACASA-N	436.266	1.581	50	20	IDGD	
COc1ccc(CN2C[C@@H](C(=O)NNC(=O)CNc3ccc(OC)cc3)CC2=O)cc1	726618692	BABWDAMXOVEQAA-INIZCTEOSA-N	426.473	1.312	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)c2ccc(S(N)(=O)=O)c(Cl)c2)cc1F	727500443	ZUPQTGYMZCFPRL-UHFFFAOYSA-N	432.886	1.767	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)NCc1cccc(C(=O)NCCN(C)C)c1	727604219	SDVUKOKMONYLRI-OAHLLOKOSA-N	445.495	1.415	50	20	IDGD	
O=C(Cn1cc(Br)c(O)nc1=O)NNC(=O)c1c(Cl)cccc1Cl	727806440	XYHAJGPOJAULIH-UHFFFAOYSA-N	436.049	1.479	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)c2ccc(Cl)c(NS(C)(=O)=O)c2)c1	728208003	IIQZBLJMYCKQMW-UHFFFAOYSA-N	426.882	1.593	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)c2cc(F)ccc2Br)cc1C(=O)O	728509782	NFVJZNFMEWSNEP-UHFFFAOYSA-N	447.238	1.918	50	20	IDGD	
NC(=O)COc1ccc(NC(=O)NNC(=O)c2cc(F)ccc2Br)cc1	728743010	WZWQCDHHXGNGLR-UHFFFAOYSA-N	425.214	1.919	50	20	IDGD	
O=C(NNC(=O)N1CCO[C@@H](c2cccc(F)c2)C1)C1CCN(c2ncccn2)CC1	728961666	KQNPHIYJRDWFST-GOSISDBHSA-N	428.468	1.646	50	20	IDGD	
CC(=O)N1Cc2ccccc2C[C@@H]1C(=O)NNC(=O)c1sc(N2CCOCC2)nc1C	729300441	PIGLRUWYJCRHTI-QGZVFWFLSA-N	443.529	1.023	50	20	IDGD	
Cc1c(/C=C(\C#N)C(=O)NCc2cccnc2N2CCC(C(N)=O)CC2)cc(C#N)n1C	729377048	WHZIBAFWPDZFJK-VXLYETTFSA-N	431.500	1.525	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CCCCCC(=O)NNC(=O)c2cccc(C#N)c2)c1	729831155	UXCADMCXWHSHFA-UHFFFAOYSA-N	446.467	1.603	50	20	IDGD	
Cc1cc(S(C)(=O)=O)c(C)c(S(=O)(=O)NNC(=O)c2c(C)nc3ccccn23)c1	730203593	UMQTVSPGXIQWDD-UHFFFAOYSA-N	436.515	1.286	50	20	IDGD	
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC[C@@H](C(=O)NN=c2cc[nH]c3ccccc23)C1	730288876	CQPFIWVPAVITOH-OAHLLOKOSA-N	428.518	1.541	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NC2CCN(CC#N)CC2)c2ccccc2c1=O	730674574	NUDCAOYGEZEZTI-UHFFFAOYSA-N	425.493	1.129	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)[C@@H](C)N2CCN(c3ccc(F)cc3)CC2)cc1	732264466	SDJSLLKKINBZAV-MRXNPFEDSA-N	429.496	1.604	50	20	IDGD	
CS(=O)(=O)N1CCCc2cc(C(=O)NNC(=O)c3cnn(-c4ccccc4)c3)ccc21	733110364	KJZLFLHZLUPCIY-UHFFFAOYSA-N	439.497	1.659	50	20	IDGD	
CS(=O)(=O)N1CCC(C(=O)NNc2cc(C(F)(F)F)nc(-c3ccccn3)n2)CC1	734259761	UFKFVUVUYDCHIM-UHFFFAOYSA-N	444.439	1.672	50	20	IDGD	
COCc1cccc(S(=O)(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)c1	734807501	SJOBMKBDICGZDI-UHFFFAOYSA-N	442.538	1.725	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)N[C@H]1CCN(c2ccccc2OC(F)F)C1	735097178	SCMGMWYXAHCMDO-LBPRGKRZSA-N	437.403	1.220	50	20	IDGD	
CC(=O)NCC(=O)N1CCc2cc(C(=O)NNC(=S)Nc3cc(C)ccc3F)ccc21	735704307	WXKWWYGUPPOOSN-UHFFFAOYSA-N	443.504	1.791	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)NCc2nonc2C)cc1	736152961	PSOGDMYGRMNSGR-DHDCSXOGSA-N	435.444	1.349	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)NCc1ccc(C(=O)N2CCOCC2)cc1	738448104	CZMBEFCZBFYGSM-UHFFFAOYSA-N	426.473	1.206	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNc2ncnc3[nH]cnc23)c1	740746900	XDFJBTTVYYIBIY-UHFFFAOYSA-N	439.457	1.919	50	20	IDGD	
CC(C)c1nn([C@@H]2CCS(=O)(=O)C2)cc1C(=O)NNC(=O)COc1ccccc1F	742471943	VROPPUSKQJOFMB-CYBMUJFWSA-N	438.481	1.345	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)c2cccc(Br)c2)cc1[N+](=O)[O-]	743264157	PMIYPHVBEADHGK-UHFFFAOYSA-N	430.236	1.989	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)N2CCC[C@@H]2C(=O)NNc2ccc(Cl)nc2)o1	743816884	WPIVTDCNGGVGGT-GFCCVEGCSA-N	442.881	1.801	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)CN2CCC(c3n[nH]c(-c4ccccc4)n3)CC2)cc1	744392815	ZHSXDGVQENATBM-UHFFFAOYSA-N	429.484	1.984	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)CNC(=O)c2ccc(Br)cc2)c1	744461144	UWUWDYIXWCLCKM-UHFFFAOYSA-N	448.273	1.492	50	20	IDGD	
COc1cc(C(=O)OCC(=O)NNC(=O)c2cccs2)cc(OC)c1OC(F)F	745605177	BXENUZLSSXOOCR-UHFFFAOYSA-N	430.385	1.985	50	20	IDGD	
COc1ccc(N2CCN(CCCNC(=O)NNC(=O)Cc3ccncc3)CC2)cc1	747580715	HYDIYWJKPKNCPW-UHFFFAOYSA-N	426.521	1.175	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)Nc3ccc4c(c3)OCCO4)cc2)CC1	747823261	FNLIBRFELRVCBY-UHFFFAOYSA-N	447.517	1.543	50	20	IDGD	
CC(C)OCCS(=O)(=O)NCC(=O)NNC(=O)Nc1ccc(-c2ccccc2)cc1	748867387	YKQWLAMEFXZVCU-UHFFFAOYSA-N	434.518	1.851	50	20	IDGD	
CCCOc1ccc(C(=O)NNS(=O)(=O)c2cc(C(=O)OC)cs2)cc1OC	749151155	GRLBSBRSURIKLP-UHFFFAOYSA-N	428.488	1.955	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2ccc([C@H](C)O)cc2)c1	749348778	VOUAEXIBGYISBZ-HNNXBMFYSA-N	448.545	1.915	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)c1ccc2c(=O)n3c(nc2c1)CCC3	750713742	ZJPCIPBYXOZLER-UHFFFAOYSA-N	429.477	1.409	50	20	IDGD	
C[C@@H]1C[C@@H](NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)CCN1Cc1ccccc1	751097043	BBELASOEGMSVKL-AEFFLSMTSA-N	448.527	1.931	50	20	IDGD	
C[C@@H]1C[C@H](NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)CCN1Cc1ccccc1	751098572	GNSZNRJVIOBIAJ-VQIMIIECSA-N	434.504	1.659	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)c1cc(F)ccc1I	751211759	KHKLONOOESLDGJ-UHFFFAOYSA-N	447.229	1.683	50	20	IDGD	
C[C@@H](NC(=S)NNC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(F)cc2)C1)C1CC1	751620695	XSFNAPVKMPEZNK-OCCSQVGLSA-N	428.555	1.520	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)[C@H]2CC(=O)N(c3cc(OC)cc(OC)c3)C2)c1	752791023	FSODNEWYBWDIOE-AWEZNQCLSA-N	442.472	1.325	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)N[C@@H]1CCCN(Cc2ccccn2)C1=O	753299305	QKPDGYKFFZBLPM-RHSMWYFYSA-N	429.452	1.510	50	20	IDGD	
COCCN1C(=O)c2ccc(C(=O)NNc3ccc(C#N)c(Cl)c3)cc2S1(=O)=O	753301943	BGWSIPDNZAOBIK-UHFFFAOYSA-N	434.861	1.759	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2cnc(C(C)(C)C)nc2)cc1	756247725	VIOPMHMFHHBCTN-UHFFFAOYSA-N	434.522	1.556	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1cccc(CO[C@H]2CCC[C@@H](C)C2)c1	756255687	AJEHAVIFNSOYPV-KEYYUXOJSA-N	426.539	1.872	50	20	IDGD	
C[C@H]1C[C@@H](C)C[C@]2(C1)NC(=O)N(CC(=O)NNC(=O)Cc1nc3ccccc3n1C)C2=O	756863243	IWVHZHQFTKLUQL-HSAQVAQVSA-N	440.504	1.010	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1C(=O)N(C)C	757588349	MZIYADNRAXPFTF-UHFFFAOYSA-N	447.517	1.414	50	20	IDGD	
Cc1cnn(-c2ccc(S(=O)(=O)NNC(=O)C(=O)Nc3ccc(C)c(C)c3)cc2F)c1	757644177	KYEZTTBNLBJDMV-UHFFFAOYSA-N	445.476	1.885	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1ccc(Br)c(Cl)c1Cl	758291897	WPOLGHXIZHSTKS-YFKPBYRVSA-N	448.126	1.846	50	20	IDGD	
O=C(NC[C@@H]1CC(=O)N(Cc2ccccc2)C1)NNC(=O)c1cc(Br)c[nH]1	758649690	DXNVNLBSXMWLGN-ZDUSSCGKSA-N	434.294	1.770	50	20	IDGD	
CCN(CC)[C@H](CNC(=O)NNC(=O)C(=O)Nc1ccccn1)c1cccc(OC)c1	758684679	GELQDVADRFTAII-QGZVFWFLSA-N	428.493	1.442	50	20	IDGD	
O=S(=O)(c1ccc(F)c(F)c1F)N1CCN(CCI)CC1	759325403	BXSFWUPUCMRCQJ-UHFFFAOYSA-N	434.221	1.845	50	20	IDGD	
COCc1nc(C)c(C(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)s1	759607131	HZOYYOPJUAIFSM-UHFFFAOYSA-N	431.562	1.485	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H]1[C@@H]1COCCC1=NNC(=O)C(=O)Nc1ccccn1	762434532	QANXSKOOQVKALS-GDBMZVCRSA-N	431.493	1.928	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)C(=O)Nc1cc(F)c(N2CCCC2)c(F)c1	763456242	YEKAUSRBZSWJDC-UHFFFAOYSA-N	433.371	1.873	50	20	IDGD	
Cc1cc(Cl)ccc1OCCCC(=O)NNC(=O)C(=O)Nc1ccn(CCC#N)n1	763511229	YMLFYUJQYSTWHZ-UHFFFAOYSA-N	432.868	1.704	50	20	IDGD	
Cc1nc(COc2ccc(NC(=O)C(=O)NNC(=O)c3ccc4c(c3)OCO4)cc2)no1	763552200	XSGKKCGDMKAQAP-UHFFFAOYSA-N	439.384	1.085	50	20	IDGD	
Cc1cc(Br)ccc1NC(=O)C(=O)NNC(=O)[C@H]1COc2ccccc2O1	763569794	BRVXIJAROUEIFR-OAHLLOKOSA-N	434.246	1.683	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cccnc2-n2cncn2)c(C)n1-c1ccccc1	763603272	YUYIKDVHGJIERH-UHFFFAOYSA-N	444.455	1.470	50	20	IDGD	
COC(=O)c1c(C2CC2)csc1NC(=O)C(=O)NNC(=O)COc1cccc(C)c1	763619288	QNQQFEJRIIBZBJ-UHFFFAOYSA-N	431.470	1.885	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(Cl)ccc1C(=O)OC	763681768	MXSPPHCLDVYMBA-UHFFFAOYSA-N	449.847	1.690	50	20	IDGD	
COC(=O)CCc1ccc(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)cc1	763737205	ZMVSRJPPECYXIS-UHFFFAOYSA-N	438.484	1.331	50	20	IDGD	
CCOc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NNC(=O)COc1ccc(F)cc1	763838107	NNFWJIANFONKTH-UHFFFAOYSA-N	446.435	1.091	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(-n3ccnc3)nc2)cc1	763866432	PMPHJLPRZAXABI-AWEZNQCLSA-N	438.444	1.219	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccc(NC(=O)OC(C)(C)C)nc2)n1	763886395	XAOYQAYEKQPYPM-UHFFFAOYSA-N	431.453	1.028	50	20	IDGD	
O=C(CCSc1ccc(F)cc1)NNC(=O)C(=O)Nc1cc(-n2cnnn2)ccc1F	763894963	ILQPVJUUTHFWMJ-UHFFFAOYSA-N	447.427	1.209	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)C(=O)Nc2ccc3c(c2)NC(=O)[C@H](C)O3)cc1	763898224	NUAJENWJZIPQDT-LBPRGKRZSA-N	428.470	1.593	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2cccn(Cc3ccccc3)c2=O)c1O	764130351	FOLUDCZWXWBRTQ-UHFFFAOYSA-N	436.424	1.011	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(Oc3ccc(C)nn3)cc2)c1O	764131166	HBEIPICKXFULKC-UHFFFAOYSA-N	437.412	1.691	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)Cc3cccnc3)cc2F)C[C@@H](C)O1	764263857	MMRUQTWQBGJLPV-OKILXGFUSA-N	429.452	1.163	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@@H]2C)ccc1NC(=O)C(=O)NNC(=O)Cc1cccnc1	764268400	LYHWAOIWHANOHT-INIZCTEOSA-N	437.500	1.733	50	20	IDGD	
CC(C)(C)OC(=O)NCc1cccc(NC(=O)C(=O)NNC(=O)Cc2cccnc2)c1	764268733	PGSGZSLYKCPQNO-UHFFFAOYSA-N	427.461	1.435	50	20	IDGD	
CC(C)S(=O)(=O)c1ccccc1NC(=O)C(=O)NNC(=O)CCc1ccccc1O	764277324	BRHOSIBYDDCZES-UHFFFAOYSA-N	433.486	1.293	50	20	IDGD	
COC(=O)c1ccsc1NC(=O)C(=O)NNC(=O)c1cc(Br)ccc1O	764280641	QWMCVTROUBXWHM-UHFFFAOYSA-N	442.247	1.403	50	20	IDGD	
O=C(Cc1cc[nH]n1)NNC(=O)C(=O)Nc1cccc(C[S@@](=O)C2CCCCC2)c1	764294406	YMFPLHICFLTISX-SSEXGKCCSA-N	431.518	1.320	50	20	IDGD	
Cc1nnc(Sc2ccc(NC(=O)C(=O)NNC(=O)c3c[nH]nc3C)c(C)c2)s1	764297595	CXMMEDZUHNWJRV-UHFFFAOYSA-N	431.503	1.737	50	20	IDGD	
CCCOC(=O)c1ccc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)cc1	764403767	AQMJMXJNAXLCAQ-UHFFFAOYSA-N	431.470	1.837	50	20	IDGD	
CN1CCN(c2ccccc2NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2F)CC1	764412013	COMQXUCPHDKUIZ-UHFFFAOYSA-N	433.871	1.631	50	20	IDGD	
Cc1cc(O[C@H](C)c2ccccc2)ccc1NC(=O)C(=O)NNC(=O)[C@@H]1COCCO1	764424963	LGMPFYANNUEDLN-BEFAXECRSA-N	427.457	1.636	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)Cc1csc(N2CCCC2=O)n1	765318776	PRCALRXFRWTHDJ-UHFFFAOYSA-N	425.511	1.265	50	20	IDGD	
Cc1nn(CCCl)c(C)c1C(=O)Nc1cccc(S(=O)(=O)NCCN(C)C)c1	765724117	MBGOUPHIINLMHC-UHFFFAOYSA-N	427.958	1.831	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)c3cccc(C)c3C)CC2)cc1	765729411	RDMLOODSNCAWPH-UHFFFAOYSA-N	444.557	1.379	50	20	IDGD	
CC(C)c1nnc(CCC(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)o1	766668454	JGDUWDDWKZHFGI-UHFFFAOYSA-N	448.955	1.744	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)N[C@H]2COc3cc(OC)ccc3C2)nc1	768110700	FXSNHJJSTJHOFQ-OAHLLOKOSA-N	449.533	1.751	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)C(=O)Nc2ccc(C)c(NC(=O)CCN(C)C)c2)c1	768230380	MCFVEJHIDRURMD-UHFFFAOYSA-N	441.488	1.754	50	20	IDGD	
O=C(NNc1nc2ccccc2[nH]1)[C@H]1CCCN1S(=O)(=O)c1cccc([N+](=O)[O-])c1	768499425	FIPVTOGTAQIFHG-MRXNPFEDSA-N	430.446	1.768	50	20	IDGD	
CSCCNC(=S)NNC(=O)[C@H]1CC(=O)N(c2ccc(Br)c(C)c2)C1	769768431	AAKRKVYXVWMIOR-NSHDSACASA-N	445.408	1.969	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)Nc1ccc(-n2cnnn2)cc1	769933321	XFLUZPZNAPQTKD-UHFFFAOYSA-N	430.494	1.888	50	20	IDGD	
C[C@H](NC(=O)NNc1nc(O)c2cnn(C)c2n1)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	770369670	PPLTXGHUEPQSJY-NWDGAFQWSA-N	434.501	1.731	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2ncccc2C(F)(F)F)cc1	770574262	JMKISSUWWBCBOW-UHFFFAOYSA-N	430.408	1.491	50	20	IDGD	
Cc1ccc2c(c1)C(=O)N([C@@H](C)C(=O)NNc1nc(O)c3cnn(C(C)(C)C)c3n1)C2=O	770966433	LHVHKPKLOYAYCD-NSHDSACASA-N	437.460	1.723	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@H]1CN(C(=O)NNC(=O)Cn2ccc3ccccc32)CCO1	773270941	AJHFSMNCSKFVGY-INIZCTEOSA-N	431.493	1.608	50	20	IDGD	
Cc1ccc(I)cc1NC(=O)C(=O)NNC(=O)c1ncccc1C	773497692	YAGNCCNKLCZVOP-UHFFFAOYSA-N	438.225	1.703	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2cccc(Cl)c2)cc1	773729189	MJIJRIOVJOMEEB-UHFFFAOYSA-N	426.882	1.347	50	20	IDGD	
COCC[S@@](=O)Cc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(C)c(F)c2)c1	773890663	YTOHGEPAPOYZKC-SSEXGKCCSA-N	435.477	1.429	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccccc1N1CCOC1=O	774010617	YKXCDEHNGRYTML-LBPRGKRZSA-N	446.847	1.850	50	20	IDGD	
Cc1cc(CNC(=O)NNC(=O)NCc2ccc(Cl)cc2)ccc1S(N)(=O)=O	775232956	YEWAUIURMUSPET-UHFFFAOYSA-N	425.898	1.509	50	20	IDGD	
CN(C1CCCCC1)S(=O)(=O)N1CCN(C(=O)/C(C#N)=C/c2ccc(O)cc2)CC1	776623541	KGGALURJBZHJLV-OBGWFSINSA-N	432.546	1.953	50	20	IDGD	
O=C(c1ccc(OCC(F)F)nc1)N1CCN(S(=O)(=O)CBr)CC1	777777100	DYCUUDNLNYHOIN-UHFFFAOYSA-N	428.255	1.166	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)CO[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	778433829	SYBGCINWFJDDIX-CYBMUJFWSA-N	430.502	1.075	50	20	IDGD	
COc1ccc([C@H]2[C@@H](C(=O)NNC(=O)CNC(=O)OC(C)(C)C)CCC(=O)N2C)cc1	778437027	RLDFZLUFKJTZEH-YJBOKZPZSA-N	434.493	1.277	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NNc2cc(Cl)ccn2)o1	778450950	CZZHJXDFCQDQLQ-LBPRGKRZSA-N	442.881	1.801	50	20	IDGD	
Cc1ncsc1C(=O)NNC(=O)C(=O)Nc1ccc(CNC(=O)OC(C)(C)C)cc1	778709452	GJDACVWHYUZXDE-UHFFFAOYSA-N	433.490	1.876	50	20	IDGD	
C[C@H](NC(=O)CC(C)(C)C)C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	778941212	PIPNKELXDLJGOM-AWEZNQCLSA-N	426.539	1.092	50	20	IDGD	
O=[N+]([O-])c1cccc(S(=O)(=O)N2CCN(S(=O)(=O)CCCCCl)CC2)c1	780664728	ALAUFPBYTIKWMT-UHFFFAOYSA-N	425.916	1.250	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2ccc(OC)c(-n3cnnn3)c2)cc1Br	781652427	ZJYBLLTVXUYGDP-UHFFFAOYSA-N	447.249	1.517	50	20	IDGD	
CCOc1cc(N2CCOC(C)(C)C2)ccc1NC(=O)C(=O)NNC(=O)C1CCCC1	782117986	VAWZYXFZMVLJAU-UHFFFAOYSA-N	432.521	1.977	50	20	IDGD	
CC(=O)N1CCN(Cc2cccc(NC(=O)C(=O)NNc3cnc4ccccc4n3)c2)CC1	782123720	JGXMQQMZYBBUCL-UHFFFAOYSA-N	447.499	1.376	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2cc(OC)ccc2I)nc1	782140312	GXYPTSKZMIMHFJ-UHFFFAOYSA-N	442.213	1.785	50	20	IDGD	
COc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)C(=O)NNc1ccc(Cl)cc1	783340360	QAHZWBQOFHOVAP-UHFFFAOYSA-N	426.882	1.681	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NC2CCN(c3cc(C)[nH]n3)CC2)c2ccccc2c1=O	784664979	XSWJOCGUJXDWKO-UHFFFAOYSA-N	438.492	1.061	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2cc(C)ccc2F)cc1S(=O)(=O)NC1CC1	784887927	MYVVHCNMFMLKFJ-UHFFFAOYSA-N	436.465	1.665	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNc2ncc(F)cn2)sc2c1CCSC2	784958417	ZENXIZYCMVNXAS-UHFFFAOYSA-N	425.467	1.725	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](c2cc(C(=O)NNC(=O)c3ccc4c(c3)OCO4)n[nH]2)C1	786624867	MKZBOXDSXZPLBT-ZDUSSCGKSA-N	443.460	1.938	50	20	IDGD	
NC(=O)[C@H]1CCC[C@@H](C(=O)NNC(=O)c2nc(-c3ccccc3)n(-c3ccccc3)n2)C1	786687826	ITARMAXBPCCUAH-DLBZAZTESA-N	432.484	1.987	50	20	IDGD	
Cc1cc(N2C[C@@H](C(=O)NNC(=O)N3CCN(C)CC3)CC2=O)ccc1Br	788167020	TYPJUSBHRQUHTL-ZDUSSCGKSA-N	438.326	1.099	50	20	IDGD	
CS(=O)(=O)c1cc(NC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])ccc1Cl	788308461	WLOGQUBYYGCVQA-UHFFFAOYSA-N	442.837	1.883	50	20	IDGD	
COC[C@@H](Cc1ccccc1)N(C)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	789014255	ZISKBEKRWWIGOH-LJQANCHMSA-N	426.521	1.623	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)NNc2cc(Cl)nc(N)n2)cc(S(C)(=O)=O)c1	789135859	QUERWZZXMIUFCX-UHFFFAOYSA-N	428.858	1.441	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c(OC(F)F)c1	789727772	QYGWCCJFEDRLFD-UHFFFAOYSA-N	443.428	1.622	50	20	IDGD	
Cn1nc([C@H]2CCCO2)cc1NC(=O)C(=O)NNC(=O)C1=S=C2CCCCCC2=C1	789731148	DHQDZKOYNZXXLT-CQSZACIVSA-N	431.518	1.340	50	20	IDGD	
COc1cc(Cl)c(S(=O)(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1OC	790339945	JPEGVYNUECCTHD-HNNXBMFYSA-N	428.850	1.507	50	20	IDGD	
CS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cc(-c3ccccc3)on2)cc1[N+](=O)[O-]	791044792	ONTGNIZPUDELQF-UHFFFAOYSA-N	430.398	1.728	50	20	IDGD	
O=C(Cc1ncccc1F)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	792039982	MTCZZQSOBFGCMM-UHFFFAOYSA-N	431.431	1.926	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)N[C@H](C(N)=O)c1cccc(Br)c1	792776643	JXIWECCTFXFLNM-AWEZNQCLSA-N	445.277	1.576	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2ccccc2)c(C)n1Cc1ccc(S(N)(=O)=O)cc1	792810443	FMHSIKFYHBBQMH-UHFFFAOYSA-N	426.498	1.875	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@H](O)c1cccc(C(F)(F)F)c1	794779986	IPSSBEFSHCBFDV-CYBMUJFWSA-N	444.435	1.802	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)CN2CCC[C@H](CNC(=O)OCc3ccccc3)C2)cc1	796466468	QHTONNFZHAQPID-HXUWFJFHSA-N	449.511	1.958	50	20	IDGD	
COC(=O)CN(CCN1CCN(C)CC1)C(=O)/C(C#N)=C/c1cc(C)n(CC(C)C)c1C	798555868	TXWJOFZZJNVNSV-HYARGMPZSA-N	443.592	1.917	50	20	IDGD	
O=C(NCCNS(=O)(=O)c1ccc(Cl)cc1F)NNc1cccc([N+](=O)[O-])c1	799666141	YOBKEFWBRFTQPD-UHFFFAOYSA-N	431.833	1.992	50	20	IDGD	
COc1c(C)cc(C)cc1S(=O)(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	800838950	VGMHAJVLSQJHGC-UHFFFAOYSA-N	425.894	1.591	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)c2coc(C)n2)c1	801600583	QZVIAHIZCCVXNM-UHFFFAOYSA-N	430.442	1.867	50	20	IDGD	
Cc1cc(=O)c(C(=O)NNC(=O)Nc2ccc3c(c2)OCO3)nn1-c1ccccc1F	802092741	ANWUUUBNYLXVHB-UHFFFAOYSA-N	425.376	1.875	50	20	IDGD	
COc1ccc(C2=NO[C@@H](CNC(=O)NNC(=O)COCc3ccccc3)C2)cc1F	802343060	UYWYHTYVPNXRTC-MRXNPFEDSA-N	430.436	1.875	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NNc2cccc(F)n2)o1	804770314	ZXHWUYLLIZTJGI-NSHDSACASA-N	426.426	1.287	50	20	IDGD	
Cc1nc(Cl)c(Cl)cc1C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	805720298	UAHAXMNPTNAYDB-CQSZACIVSA-N	440.239	1.841	50	20	IDGD	
O=C1COC[C@H](C[C@@H]2CN(C(=O)C(=O)NNc3ccc(F)c(F)c3F)c3ccccc32)N1	806968036	VDHLHWOJACPDKY-NEPJUHHUSA-N	448.401	1.583	50	20	IDGD	
COCCCOc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)cc1OC	806977500	MENOZBSXJPPKIM-LJQANCHMSA-N	443.456	1.200	50	20	IDGD	
COc1ccc(C)cc1NC(=O)CNC(=O)COC(=O)/C(C#N)=C\c1cc(C#N)n(C)c1C	809302062	LTKIRETXAYASKC-IUXPMGMMSA-N	449.467	1.727	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)CNS(=O)(=O)c3cccc(F)c3)n[nH]2)cc1	810147785	RYJCDZKPBKNGKU-UHFFFAOYSA-N	431.449	1.264	50	20	IDGD	
O=C(CSc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1cccc2c1OCC(=O)N2	810385943	GCLZOBTVVCIFSJ-UHFFFAOYSA-N	434.861	1.549	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)Cn2nc(C(F)(F)F)cc2C)cc1OC	811243279	UMJVZTCONRAIGX-UHFFFAOYSA-N	444.366	1.232	50	20	IDGD	
NS(=O)(=O)c1ccc(C=NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)cc1	811645358	JEKBTWQYYCWYKZ-UHFFFAOYSA-N	449.964	1.255	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)c2c(I)cnn2C)c1	814103587	RHZSPTBUWLKTMT-UHFFFAOYSA-N	428.230	1.482	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)cc1)[C@@H]1C[C@H]1C	815566522	XFVANUXHGVGUOR-AUUYWEPGSA-N	449.467	1.484	50	20	IDGD	
O=C(NNC(=O)c1cccc(Br)c1)C(=O)Nc1cn(Cc2ccccc2)nn1	815567669	HEWPEGYQHAPBFX-UHFFFAOYSA-N	443.261	1.489	50	20	IDGD	
COc1cccc(/C=C(\C(=O)NNC(=O)COc2cc(C)cc(C)c2)n2nnnc2C)c1	818022670	KUSPSWSQCZPFMZ-UDWIEESQSA-N	436.472	1.831	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)CCc2nc(O)c3cnn(C)c3n2)c1	818746906	WNKZUNGHJRIVKB-UHFFFAOYSA-N	449.265	1.694	50	20	IDGD	
CSCC[C@H](NC(=O)c1cccc(C)c1)C(=O)NNC(=O)[C@@H]1COc2ccccc2O1	859420411	XRKFRRDZYNHLNR-LPHOPBHVSA-N	443.525	1.834	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)CNS(=O)(=O)c2ccc(Cl)cc2)c1	913446115	NXIVSPQZTSATAB-UHFFFAOYSA-N	425.894	1.462	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)N2CCCN(S(C)(=O)=O)CC2)c(C)n1C[C@@H]1CCCO1	914847233	AIQYGVWAPHWULG-ACSPXDACSA-N	434.562	1.685	50	20	IDGD	
O=C(NN=C1CCN(CC(F)(F)F)CC1)c1cccc(S(=O)(=O)N2CCOCC2)c1	915938572	BXXLIPJDAOBSHL-UHFFFAOYSA-N	448.467	1.451	50	20	IDGD	
COc1ccc(OCC(=O)NN=C(C)c2ccc(OCC(=O)N3CCOCC3)cc2)cc1	916296783	LAOSPWIHEMFBIW-UHFFFAOYSA-N	441.484	1.852	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NN=Cc1ccncc1)N(S(C)(=O)=O)CC2	916354600	GJPZFNWMVIWRRU-QGZVFWFLSA-N	432.502	1.498	50	20	IDGD	
C[C@H]1CCCC[C@@H]1OCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	916514339	MMJPAUZYANSYHK-YOEHRIQHSA-N	426.539	1.476	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)NCCS(=O)(=O)NC(C)(C)C)cc1OC	916622463	SPCDLPCUPDEFQR-UHFFFAOYSA-N	430.527	1.146	50	20	IDGD	
O=C(NCC(F)(F)F)NNC(=O)c1cc(S(=O)(=O)NC2CC2)c(Cl)cc1Cl	918707158	AIDHBGZVEGFAQR-UHFFFAOYSA-N	449.238	1.940	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)[C@@H]2CCCCN2C(=O)C(C)C)cc1OC	919601948	QBYLSVXAQXGKLA-HNNXBMFYSA-N	435.477	1.045	50	20	IDGD	
CNC(=O)NNC(=O)c1cccc(NS(=O)(=O)c2ccc(Br)cc2)c1	919879738	BMXBALHNJHFKDG-UHFFFAOYSA-N	427.280	1.824	50	20	IDGD	
COC(=O)[C@H]1CS(=O)(=O)CCN1C(=O)/C(C#N)=C\c1cc(C)n(CCC(C)C)c1C	1120800338	YFBZPCOBIGAUJJ-ZYNFKGNASA-N	435.546	1.857	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NCc2cnn(CC(F)(F)F)c2)cc1	1253071530	PPPHUAVVQLORNL-UHFFFAOYSA-N	434.400	1.385	50	20	IDGD	
O=C(NCc1cc(F)ccc1N1CCOCC1)NNC(=O)c1cncn1-c1ccccc1	1318662269	RXLLOTURZVUTJQ-UHFFFAOYSA-N	438.463	1.992	50	20	IDGD	
O=C(NNc1nc(Br)cn2ccnc12)c1n[nH]cc1I	1320324265	SLYSJGONBGATJE-UHFFFAOYSA-N	448.022	1.576	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)c1ccccc1)C(=O)NNc1nncc(N)c1Cl	1322679729	RZEUCLBEPBVTPN-LBPRGKRZSA-N	430.943	1.256	50	20	IDGD	
Cc1ncnc(O)c1CCC(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	1324046937	BRWCDUVRKOWQCH-UHFFFAOYSA-N	446.939	1.042	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)CNC(=O)c2cccc(Cl)c2)CC1	1328652555	FIOPIRMOWZZDNC-UHFFFAOYSA-N	438.912	1.864	50	20	IDGD	
C[C@H](NC(=O)c1ccccn1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Cl)C1	1778030863	ZFYFZQYVEWQJNC-NOUYOMCBSA-N	440.903	1.248	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)cc1F	1781325083	IRPGDLSSUXPYNS-RHSMWYFYSA-N	433.249	1.968	50	20	IDGD	
O=C(Cc1ccc2c(c1)CCO2)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2	1781947695	VTNCMEIFXABNBC-SFGWALBWSA-N	436.936	1.278	50	20	IDGD	
O=C(Cc1cc(F)ccc1F)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2	1783118319	RZEMUIHEXSTPAN-SQGPQFPESA-N	430.879	1.621	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)COc3ccccc3OC)CCO2)C1	1783869119	OBKLLGDMQNCWBV-MGPUTAFESA-N	426.897	1.158	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc4cc(O)ccc4n3)CCO2)C1	1783874277	FXUWOMPJIJYOPO-IIBYNOLFSA-N	433.892	1.638	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cc3sccc3[nH]1)CCO2	1783936148	RQPMDUBNNJYCDP-HXUWFJFHSA-N	433.534	1.046	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3coc(Cl)n3)C[C@@H]21	1783970437	ZSVOICDFBLATEG-BLFANLJRSA-N	434.718	1.952	50	20	IDGD	
Cc1ccc(C(=O)NCC(=O)N2CC[C@]3(C2)CN(C(=O)CO[Si](C)(C)C)CCO3)cc1	1785565126	YMCJFBXJZBNGRG-QFIPXVFZSA-N	447.608	1.406	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3c(O)cc(O)cc3O)C[C@@H]21	1786407291	OBKUHLSQGJDTQS-WBIUFABUSA-N	443.294	1.182	50	20	IDGD	
O=C(CN1C(=O)CNC1=O)Nc1ccc(C2(NC(=O)[C@@H](F)Br)CCC2)cc1	1786641095	GUDRPOMHYRKSFE-CQSZACIVSA-N	441.257	1.363	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H]1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]2C1	1787443624	OYSLOMOPGHOECR-YYFQZIEXSA-N	433.908	1.510	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccncc3C(F)(F)F)[C@H]2C1	1787662683	ITLMOLKXRBNUFK-MZGVZZPPSA-N	449.857	1.948	50	20	IDGD	
O=C1CN(CC(=O)NC2(c3ccc(NC(=O)CCBr)cc3)CCC2)C(=O)N1	1787670387	SVAAJEXZTUWLIR-UHFFFAOYSA-N	437.294	1.457	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)c1nc2ccccc2[nH]1	1787836424	PMFCLJMTLQAJIK-XEZPLFJOSA-N	435.322	1.941	50	20	IDGD	
Cn1nc2c(c1C(=O)N1CC[C@H]3CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]3C1)CCC2	1789872323	SBYDYQGDGKYZPD-DXJCSPRDSA-N	443.375	1.738	50	20	IDGD	
Cc1nnc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]3C2)s1	1789923112	YOPSWFXENCTIDU-AYGWYOGXSA-N	435.319	1.059	50	20	IDGD	
C[C@@H](Cc1ccccn1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]2C1	1789926645	DZSZRRFSNLTRPZ-PTTAZLHSSA-N	442.329	1.930	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](Cl)COC)C[C@@H]21	1790963556	IJFZJUPXZGWDID-PEDHHIEDSA-N	425.751	1.393	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)Oc3ccccn3)[C@H]2C1	1791627524	XIJHIGODXPIURK-XAJHFOFHSA-N	425.913	1.082	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)NC(=O)c3ccccc3)[C@H]2C1	1792249739	CBPGHWRFJFDLKP-RFZNHBKKSA-N	435.952	1.802	50	20	IDGD	
CC(C)N1CCC[C@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)CBr	1792872930	HDGRQIZXCANLSQ-UHDSXZAQSA-N	430.387	1.480	50	20	IDGD	
O=C(CSc1ccccc1[N+](=O)[O-])N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCl	1793116060	GCSXBTZKIOPQGV-QVHKTLOISA-N	427.910	1.925	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CCN1C(=O)OC(C)(C)C)C2	1793447841	NKUQDZNHINNJAQ-ZHCJQAHYSA-N	443.972	1.993	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccno1)C2	1793878306	QFLPYEOQIDFMLP-XFMPKHEZSA-N	442.900	1.010	50	20	IDGD	
O=C(CCBr)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C(F)(F)C(F)(F)C(=O)O	1793972287	HSUJNKHLTAGZTI-AYMMMOKOSA-N	433.196	1.765	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccnc1CS(C)(=O)=O	1794724749	NJZWSVLPQJPYOM-HLPPOEQASA-N	443.953	1.132	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2)c1snnc1C1CC1	1796705914	DJWQTBMATFILLR-PTEHBNRSSA-N	429.340	1.404	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2c(c1)CC(=O)N2	1797331679	QJIKZXHANAFJIF-JAMKOXHTSA-N	436.306	1.168	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccn2ccnc12	1797455796	UAHHYJUIYQRBPD-OCVGTWLNSA-N	435.322	1.711	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H]1CCc3ccccc3O1)C2	1798443616	NYZQMUSEWNSRPF-DLRJPAPCSA-N	449.511	1.331	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cn(C)cn1)C2	1799217666	AQJVYPOVZNNLRN-QDMKHBRRSA-N	441.444	1.819	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C=C/C1CCCC1	1799309100	BTLUPASMNNXQMH-QGXUUIPSSA-N	441.532	1.456	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)cc([N+](=O)[O-])c1	1799732022	GAXFSQHCRNRYES-BTABJRDXSA-N	442.266	1.287	50	20	IDGD	
Cc1cccc2c(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@H](C)Br)C4)n[nH]c12	1800074099	CIQCFSXWZYYPTG-JFILPPLUSA-N	435.322	1.858	50	20	IDGD	
COc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C(Cl)Cl)cc1NC(C)=O	1801016681	RJCXPWYPCREXAX-YWVIFJGQSA-N	444.315	1.661	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](O)CCl)C3)C1	1801974880	FZCIHMVTAJDBRG-NQNKBUKLSA-N	443.972	1.871	50	20	IDGD	
Cc1ccc(C(=O)NCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)C(Cl)Cl)C3)cc1	1802120506	RJGVDZFGBUNUCA-MIFYACCESA-N	428.316	1.118	50	20	IDGD	
CC(C)N1CCC(C(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)CC1	1803136036	MBCDSWTUIMAACV-AABGKKOBSA-N	436.984	1.808	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2c[nH]c3cnccc23)[C@@H]1c1cccnc1)[C@H](O)CCl	1803142674	GXTGCHQILAGSRN-GDIGMMSISA-N	427.892	1.877	50	20	IDGD	
Cc1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)cc(C)c1O	1803572415	AYSCCQOOGOHJHN-BJWYYQGGSA-N	437.500	1.573	50	20	IDGD	
O=C([C@H](F)Cl)N1CC[C@@H](CNC(=O)C(F)(F)C(F)(F)C(=O)O)[C@@H]1c1cccnc1	1804042147	GZZSLZPHXALDFQ-DCAQKATOSA-N	443.756	1.977	50	20	IDGD	
O=C(Cc1ncccn1)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@@H]1c1cccnc1	1804694176	HBSWOLSBEAMYKM-XKQJLSEDSA-N	436.285	1.811	50	20	IDGD	
COc1ccc([N+](=O)[O-])c(C(=O)N2CCC3(CCCN(C(=O)[C@H](O)CCl)C3)CC2)n1	1805523601	QAILLGOOCIXHMD-CQSZACIVSA-N	440.884	1.443	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccsc2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1	1807369811	WLNZCLKGAROAIT-PXNSSMCTSA-N	435.314	1.456	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)Cc2ccncc2)[C@@H]1c1cccnc1	1807520184	AQJDGOVPVKGGNV-XXBNENTESA-N	438.532	1.098	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H](CNC(=O)[C@@H]2C[C@H](O)CN2)[C@@H]1c1cccnc1	1807707852	PDGBBLJZPOIJLW-CUGJGTHOSA-N	429.348	1.047	50	20	IDGD	
COCCOCC(=O)N1CC[C@H](CNC(=O)[C@H](F)Br)[C@H]1c1cccnc1	1808661315	IERVULYEIYEVEO-BMFZPTHFSA-N	432.290	1.441	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](CCN)C(=O)N1CCCC2(CCN(C(=O)[C@H](F)Cl)CC2)C1	1809750721	XYHBCJQIUQKBBY-CABCVRRESA-N	448.967	1.994	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)CCc2ccc(O)nn2)[C@H]1c1cccnc1	1812328325	MWFMVFYHMNRTDS-OXFYSEKESA-N	447.923	1.470	50	20	IDGD	
CCc1cc(C(=O)N2CC[C@H](CNC(=O)[C@H](Cl)COC)[C@H]2c2cccnc2)nn1C	1813030403	CTXOEULXAMIDID-SZVBFZGTSA-N	433.940	1.951	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2nc3ccccn3n2)[C@@H]1c1cccnc1	1813030896	NCOWOIWEDMEDHQ-XYJFISCASA-N	442.907	1.698	50	20	IDGD	
COCc1oncc1C(=O)N1CC[C@H](CNC(=O)[C@H](Cl)COC)[C@H]1c1cccnc1	1813031841	XODXUXSDNLKWIX-QGPMSJSTSA-N	436.896	1.789	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2cccs2)[C@@H]1c1cccnc1	1813070301	GZSVGNQYVGQFAX-OXJNMPFZSA-N	429.546	1.836	50	20	IDGD	
CC(=O)Nc1nc2c(s1)C[C@H](NC(=O)CN(C)NC(=O)NCc1ccccc1)CC2	1814217857	QHHQCWQZDPDCLP-OAHLLOKOSA-N	430.534	1.421	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1CCc2nc(NC(=O)CCN(C)C)sc2C1	1814543351	PKGZRLOCHQRXSK-CJCQAYSXSA-N	445.549	1.141	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)C[C@H](N)c3cccnc3)sc2C1	1815182606	LCGPQEDNEINHSI-IHRRRGAJSA-N	437.953	1.794	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)N[C@@H]1CCc2nc(NC(=O)[C@H](F)Cl)sc2C1	1817118232	UXMWWEVHUSQYAH-YGRLFVJLSA-N	425.873	1.415	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)C(F)(F)Cl)CC2	1819801368	JZUBHGDOSUQAHD-SSDOTTSWSA-N	444.851	1.199	50	20	IDGD	
COCc1oncc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1	1822414478	VDHXXFDWNGBWBK-OAHLLOKOSA-N	447.496	1.223	50	20	IDGD	
CN1CCC[C@H]1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1	1824790728	OODKDCBYSQQYIZ-UXHICEINSA-N	442.564	1.013	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnc3[nH]ncc3c1)CC2	1825999773	CLSWFMHFOSCPKX-NWDGAFQWSA-N	434.909	1.894	50	20	IDGD	
Cc1c(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)[C@@H](O)CCl)CC2)cn2[nH]cnc(=O)c12	1829598061	QLRSAYAEKOHYQB-SJORKVTESA-N	449.939	1.164	50	20	IDGD	
O=C(c1cc(O)nc(O)n1)N1CCC([C@H]2CCCCN2C(=O)[C@H](F)Br)CC1	1830379003	ZPIHBFBXHIKOBZ-OCCSQVGLSA-N	445.289	1.812	50	20	IDGD	
CCCNC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](Cl)CCC)C2)C1	1831195497	DEELRCWMHMUXIN-JXFKEZNVSA-N	431.961	1.157	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccc(F)cn3)C2)C1	1831645998	HQDYGCYSHZBHHZ-YLJYHZDGSA-N	427.904	1.627	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(F)(F)C(F)F)CCO2	1832183858	XZGOCXIQXZOWRF-HZMBPMFUSA-N	449.239	1.374	50	20	IDGD	
O=C(C(Cl)Cl)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1COc3ccccc3O1)CCO2	1832499722	WSMCAXAAXIVQKU-HNAYVOBHSA-N	445.299	1.087	50	20	IDGD	
CC[C@@H](NC)C(=O)N1CCC(N2CCC(NC(=O)[C@H](C)CBr)CC2)CC1	1833263167	FGBWPQBIMGCOIK-RHSMWYFYSA-N	431.419	1.587	50	20	IDGD	
Cc1nc(CC(=O)NC2CCN(C3CCN(C(=O)[C@@H](C)Br)CC3)CC2)no1	1833812179	PVBILLVQTZZJRE-GFCCVEGCSA-N	442.358	1.276	50	20	IDGD	
Cc1cc(C(=O)NC2CCN(C3CCN(C(=O)CCBr)CC3)CC2)nn1C	1834172552	KDRNXOCFQPVDQV-UHFFFAOYSA-N	440.386	1.699	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)CCN3CCOC3=O)CC2)CC1	1835451266	NHNIFJKJNCYDLF-SFHVURJKSA-N	442.988	1.808	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)[C@H]3CCCS3(=O)=O)CC2)CC1	1836397152	AUBMDZDXXHMKKO-IAGOWNOFSA-N	434.002	1.153	50	20	IDGD	
C[C@@H](Cc1ccccn1)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836720345	QYYLASVGPKBWBK-JXFKEZNVSA-N	437.968	1.859	50	20	IDGD	
O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(F)nc1)CCO2	1837843347	HKCJEASKPGIYIN-KRWDZBQOSA-N	430.274	1.076	50	20	IDGD	
O=C(c1cc(-c2ccccn2)[nH]n1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1838050629	VAFGZFDWSSAWFA-APWZRJJASA-N	437.859	1.076	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](OC(C)=O)C(C)C)CC2)CC1	1838360964	IQPIPCWGXKPWRU-MOPGFXCFSA-N	446.972	1.827	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)cc1	1838984320	QGGDERKFCCCELL-QAPCUYQASA-N	429.286	1.756	50	20	IDGD	
Cc1nscc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839197879	KOKRGLCMRKXYQK-WFASDCNBSA-N	436.303	1.212	50	20	IDGD	
Cc1ncc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)s1	1839200240	DRNACPHTJFKIQF-SWLSCSKDSA-N	436.303	1.212	50	20	IDGD	
COc1cc(C)c(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)c(C)c1	1839408352	PTHYZEQXPLJJKM-FXAWDEMLSA-N	428.888	1.916	50	20	IDGD	
O=C(c1ccc2c(c1)OCCO2)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840187669	PKSSYJSJZRKARK-IBGZPJMESA-N	445.299	1.332	50	20	IDGD	
Cc1ccc(CCC(=O)N2CCOC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)c(C)n1	1840190558	ALGDZDTWBHMKLU-FQEVSTJZSA-N	444.359	1.891	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)C[C@@H](O)CNC(=O)OC(C)(C)C)C2	1841669867	XZZYRYFWWFMLPR-HUUCEWRRSA-N	431.961	1.873	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC2(CCCN2C(=O)Cc2cccnc2)C1	1843086057	AZVKAXFGSDQRTH-INIZCTEOSA-N	436.940	1.960	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1cnc3cc(C)ccn13)C2	1843416776	ZGCBUUARUDPENX-WGOQTCKBSA-N	447.499	1.594	50	20	IDGD	
O=C(c1ccc([N+](=O)[O-])c2c1OCO2)N1CC2(CCCN2C(=O)[C@@H](F)Br)C1	1845218657	SNQYNLJRFOCAMU-CYBMUJFWSA-N	444.213	1.831	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@H](CC(=O)OC)NC(=O)OC(C)(C)C)C1	1846213101	OYSLUFITJIMWSI-UONOGXRCSA-N	445.944	1.664	50	20	IDGD	
O=C(/C=C/c1ccc(Cn2ccnc2)cc1)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl	1847556212	DXMUFOBMUUJZPO-OAOPFVHKSA-N	428.920	1.746	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc1	10159986	GIYMLZXRZGWTPY-UHFFFAOYSA-N	443.485	1.339	50	20	IDGD	
O=C(Cc1csc(N2CCOCC2)n1)NN[C@@H](C(=O)NC1CC1)c1ccc(F)cc1	10836985	BFQARRLWKHYPFF-GOSISDBHSA-N	433.509	1.302	50	20	IDGD	
COc1cc(C(=O)NNC(=O)COc2cc(C)cc(C)c2)cc(OC)c1OCC(N)=O	15668504	QGEFHLRPKAOQLR-UHFFFAOYSA-N	431.445	1.025	50	20	IDGD	
Cc1cc(C)n2ncc(C(=O)NNC(=O)c3ccc(S(=O)(=O)N4CCCC4)cc3)c2n1	23043687	DZICLCRFRVMHOJ-UHFFFAOYSA-N	442.501	1.205	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)N2CCN(S(=O)(=O)Cc3ccccc3)CC2)cc(C#N)n1C	255949817	PTHBYNOPFPDGCQ-NDENLUEZSA-N	437.525	1.786	50	20	IDGD	
Cc1cccc(-c2nnc(S)n2CCC(=O)NNC(=O)CNC(=O)c2cccs2)c1	725902333	KWYNBEFOXMFCKX-UHFFFAOYSA-N	444.542	1.571	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c2n[nH]cc2c1	726521780	RUEOWTLENFMMFD-UHFFFAOYSA-N	427.486	1.731	50	20	IDGD	
O=C(NNC(=O)c1ccc[nH]1)c1ccc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1	726629500	CHXZPKGSEWMSDI-UHFFFAOYSA-N	429.414	1.799	50	20	IDGD	
Cc1cc(C(=O)NC2CCN(CC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)CC2)c(C)o1	727437215	OKKFSZWMUGLVBS-UHFFFAOYSA-N	443.460	1.460	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)c1ccccc1)C(=O)NNC(=O)c1cccc(C#N)c1	728871669	ABAVNNBCQNMOCZ-QGZVFWFLSA-N	432.527	1.419	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)NCCNC(=O)c2cccc(Br)c2)c1	728953490	HHNZDPJDQKQFFS-UHFFFAOYSA-N	430.262	1.695	50	20	IDGD	
CCN1CCC[C@H]1CN1C[C@H](C(=O)NNC(=O)c2cc(-c3ccccc3)on2)CC1=O	729625678	AYWWJVRIYBMINQ-SJORKVTESA-N	425.489	1.435	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)NCCCN1CCN(Cc2ccccc2)CC1	731499528	XWIFDJQBOXWBGF-UHFFFAOYSA-N	425.533	1.847	50	20	IDGD	
Cc1cccc(-n2c(NNC(=O)CC[C@H]3NC(=O)NC3=O)nc3ccccc3c2=O)c1C	733264340	JHWGMEDYBJQYOQ-MRXNPFEDSA-N	434.456	1.434	50	20	IDGD	
O=C(NCCN1CCN(Cc2ccccc2)CC1)NNC(=O)c1cnn(-c2ccccc2)c1	733340772	PVSXVUULSMRMGP-UHFFFAOYSA-N	447.543	1.634	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)NCC2(C(=O)N(C)C)CCCC2)c2ccccc2c1=O	733659212	WLQTVQZAWMBDOC-UHFFFAOYSA-N	442.520	1.570	50	20	IDGD	
COC(=O)CCCS(=O)(=O)NC(=O)/C(C#N)=C\c1cc(C)n(C[C@H]2CCCO2)c1C	734090619	VLCTULHJXGVZDH-UWKDKTGGSA-N	437.518	1.590	50	20	IDGD	
CCc1cc(NNC(=O)CN(C)S(=O)(=O)c2cccnc2)nc(-c2ccccn2)n1	734357413	TYBDUYOQIOQRPD-UHFFFAOYSA-N	427.490	1.260	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)N[C@H]1CCCN(c2cccc(F)c2)C1	734861292	JYFUCRDNZORBKQ-SFHVURJKSA-N	441.511	1.832	50	20	IDGD	
CC(=NNC(=O)Cn1nnc(-c2ccccc2)n1)c1ccc(S(=O)(=O)C(F)F)cc1	735224075	LAMGBDVDMHFLAT-UHFFFAOYSA-N	434.428	1.877	50	20	IDGD	
Cc1ccc(NC(=O)[C@H]2CCCN(C(=O)NNC(=O)COCc3ccccc3)C2)nc1	738496931	FWKFQDVKRRCKKY-SFHVURJKSA-N	425.489	1.998	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)COc1ccccc1C#N)[C@H]1CN(Cc2ccccc2)CCO1	741426164	QAUMINGSKNRUBG-DYESRHJHSA-N	437.500	1.557	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)CCCn2c(=O)oc3ccccc32)cc1	743829714	BOUHWKFGCZWHCN-UHFFFAOYSA-N	432.458	1.631	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CN2CCC(NS(=O)(=O)c3ccc(F)cc3)CC2)c1	744386648	CYJSQSKHJGHTOU-UHFFFAOYSA-N	448.520	1.338	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CN2CCN(CC(=O)N3CCCc4ccccc43)CC2)c1	744403066	UWEDBSQDBICONC-UHFFFAOYSA-N	449.555	1.353	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)N2CCc3nn(C)c(=O)cc3C2)N(C)c2ccccc21	744622654	HEJYDSAIZFUZKP-UHFFFAOYSA-N	432.484	1.336	50	20	IDGD	
CCOC(=O)C1CCN(C(=O)[C@@H](C)OC(=O)/C(C#N)=C\c2cc(C#N)n(C)c2C)CC1	744630590	ARLVDLFWCPEZQH-YQYFLZKSSA-N	426.473	1.846	50	20	IDGD	
CC(C)[C@H](C(=O)OCC(=O)NNC(=O)c1cccc(C#N)c1)n1nnc(-c2ccccc2)n1	744847654	YBUFFLYUKPSUCJ-LJQANCHMSA-N	447.455	1.413	50	20	IDGD	
O=C(CCc1nnc(-c2ccc(Cl)cc2)o1)NNC(=O)c1ccc(-n2cnnn2)cc1	746014824	KSNWUWZDUWJSDE-UHFFFAOYSA-N	438.835	1.760	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1ccc(Sc2ccccc2Cl)nn1	746102410	CLIMUYWWXOAVPI-SNVBAGLBSA-N	426.907	1.477	50	20	IDGD	
O=C1CN(S(=O)(=O)c2cccc(C(=O)NNc3ccc(Cl)c(F)c3)c2)CCN1	746698428	GIYMVYVSLCUACD-UHFFFAOYSA-N	426.857	1.357	50	20	IDGD	
C[C@H](CN(C)C(=O)OC(C)(C)C)C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	746815847	GFYAMVOEBHJMRM-GOSISDBHSA-N	447.580	1.849	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NCc2ccccc2CN2CCC(O)CC2)cc1	749590013	JYGWEUXQOKVZJJ-UHFFFAOYSA-N	426.517	1.861	50	20	IDGD	
O=C(Cn1c(=O)nc(O)c2ccccc21)NNc1nc(Br)cn2ccnc12	750248386	MVAFMCZBFBHDIT-UHFFFAOYSA-N	430.222	1.051	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)N[C@@H]2CCC[C@@H]([S@](=O)CC)C2)nc1	750670881	OVMLULCXBADCKQ-SLBZEPJWSA-N	445.611	1.818	50	20	IDGD	
Cc1nc(COc2ccc(F)cc2)sc1C(=O)NNC(=O)CNC(=O)c1ccco1	751202369	RPSAZXHCGIINDW-UHFFFAOYSA-N	432.433	1.954	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)Cc1csc(NC(=O)c2ccccc2)n1	751204758	OJFXHEYAOKCXPY-UHFFFAOYSA-N	427.442	1.108	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)NNC(=O)[C@H](C)Oc2c(C)cc(Cl)cc2C)c(C)o1	751297571	IRTBHQCDDPZDLM-LBPRGKRZSA-N	443.909	1.995	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)NNC(=O)c2cc(Br)ccc2O)c(C)o1	751393517	VCEWBPWENQMUHU-UHFFFAOYSA-N	432.252	1.039	50	20	IDGD	
COc1ccc(-c2cc(C(=O)OCC(=O)NNC(=O)c3cccs3)n[nH]2)cc1OC	751762887	GNLLJVIUYVBQRB-UHFFFAOYSA-N	430.442	1.773	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2ccc(C)o2)cc1S(=O)(=O)NCc1ccccn1	752525065	VCUVYYXWUOUHCB-UHFFFAOYSA-N	444.469	1.545	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cc(S(=O)(=O)N(C)C)oc2C)ccc1OC(C)C	753280251	UXOCYXSDPCAKCK-UHFFFAOYSA-N	439.490	1.709	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)Cc2cc(F)cc3c2OCOC3)cc1OC	753874712	MNLMXKMWTAQOBK-UHFFFAOYSA-N	448.403	1.256	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N(C)Cc2nc[nH]n2)cc1	754859041	OYTNVPJFWARSLW-OQLLNIDSSA-N	434.460	1.118	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)c2ccc(O)c(Cl)c2)n([C@@H]2CCS(=O)(=O)C2)n1	755531846	JLKMSWJETIJURK-LLVKDONJSA-N	427.870	1.377	50	20	IDGD	
COc1ccc(S(=O)(=O)NC2CC2)cc1NC(=O)NNC(=O)c1ccc(C#N)cc1	755615621	UGCRMFSKPRXTGN-UHFFFAOYSA-N	429.458	1.474	50	20	IDGD	
CO[C@@H](C)C(=O)Nc1cccc(NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1	756228237	QDYYWUWHXHUHJB-AWEZNQCLSA-N	441.492	1.519	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2csc([C@@H]3CCCO3)n2)cc1OC	756446696	RMMPXHIKUSQUKC-AWEZNQCLSA-N	435.458	1.630	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)Nc1ccn(CCN(C)C)n1	756766772	YVSSOVNKDVFUQE-GFCCVEGCSA-N	439.314	1.827	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)Nc1ccc(C[C@H]2CC(=O)NC2=O)cc1	756815942	PLAQWVRETKLPBN-JSGCOSHPSA-N	428.420	1.651	50	20	IDGD	
CCN1CCN(C(=O)Cc2ccc(NC(=O)NNC(=O)c3ccc(C#N)cc3)cc2)CC1	757582885	QEYUINHEVNUKDT-UHFFFAOYSA-N	434.500	1.731	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)Nc1ccc(F)cc1CS(C)(=O)=O	757677833	IIBJXYBSKGREHN-UHFFFAOYSA-N	446.501	1.828	50	20	IDGD	
NC(=O)c1cccc(NC(=O)NNC(=O)[C@@H]2Cc3ccccc3CN2Cc2ccccc2)n1	757737687	CDZRKHQJGWMCKC-FQEVSTJZSA-N	444.495	1.960	50	20	IDGD	
COCCCS(=O)(=O)c1ccc(NC(=O)NNC(=O)Cc2ccccc2OC)cc1	757823403	QJYALTNBSCINFK-UHFFFAOYSA-N	435.502	1.901	50	20	IDGD	
COC(=O)c1ccccc1CCC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	758041311	SDDZBNZFMJRLNL-UHFFFAOYSA-N	438.528	1.766	50	20	IDGD	
CCOc1ccc(OCc2ccc(C(=O)NNC(=O)CNS(=O)(=O)CC)cc2)cc1	758058670	NDDZSSZXJROWPF-UHFFFAOYSA-N	435.502	1.365	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)NCc2ccc3c(c2)C(=O)NCC3)cc1	758682580	HYVJILYQNBTRID-CQSZACIVSA-N	426.473	1.669	50	20	IDGD	
CN(NC(=O)[C@@H]1CC(=O)N(Cc2ccco2)C1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758781428	CRPSROOMWNCYQQ-OAHLLOKOSA-N	449.508	1.264	50	20	IDGD	
CCCn1ccnc1CCCN(C)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	758980825	VQIVGZDBTPPOIM-UHFFFAOYSA-N	428.541	1.605	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)N[C@H]1CCCN(c2ccccc2F)C1=O	761817684	RXTWCGFPIRJVTI-HNNXBMFYSA-N	430.436	1.739	50	20	IDGD	
CC(=NNC(=O)[C@H](C)CN1C[C@@H](C)O[C@H](C)C1)c1c(C)nn(CCS(C)(=O)=O)c1C	763155220	IWJCDFAADNOWGF-RBSFLKMASA-N	441.598	1.130	50	20	IDGD	
COC(=O)c1c(C2CC2)csc1NC(=O)C(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	763466156	HDGHZHRMMXEPPH-UHFFFAOYSA-N	432.414	1.720	50	20	IDGD	
CCOC(=O)c1cc(CC)sc1NC(=O)C(=O)NNC(=O)c1ccc2c(c1)OCO2	763548591	NIYCVMPIPMJSRF-UHFFFAOYSA-N	433.442	1.616	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)C(=O)Nc1ccccc1OC[C@H]1CCCCO1	763550370	DTWXXTCVUJSWTH-OAHLLOKOSA-N	441.440	1.763	50	20	IDGD	
O=C(NNC(=O)c1ccccc1F)C(=O)Nc1cc2c(cc1Br)OCCO2	763557104	VIGFITXXSBPKFU-UHFFFAOYSA-N	438.209	1.759	50	20	IDGD	
Cc1nn(-c2ccc(Br)cc2)cc1C(=O)NNC(=O)C(=O)Nc1ccccn1	763582371	FVMGQIBTYHKGJG-UHFFFAOYSA-N	443.261	1.738	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)cc1N1CCOC1=O	763612384	IEFUHPYDNJUFKE-UHFFFAOYSA-N	448.439	1.741	50	20	IDGD	
Cc1cnc(O)n1-c1ccccc1NC(=O)C(=O)NNC(=O)COc1ccccc1F	763682046	VUZDXVLMGCLONW-UHFFFAOYSA-N	427.392	1.190	50	20	IDGD	
CC(=O)c1cccc(NC(=O)C(=O)NNC(=O)COc2ccc(Br)cc2)c1	763694813	MIBQCIDJEBVMDR-UHFFFAOYSA-N	434.246	1.817	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2cc(C#N)ccc2OC(F)F)c1	763772711	OWLPDSYFZIHFAE-UHFFFAOYSA-N	434.355	1.577	50	20	IDGD	
CC(C)C(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)cc1	763866956	RUQIUBCVAGOAQN-CYBMUJFWSA-N	430.436	1.974	50	20	IDGD	
Cc1cn(-c2ccccc2)nc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccc(F)cc1	763871055	CNOVAISBNHUBHO-CQSZACIVSA-N	425.420	1.873	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CC[C@@H](C)C3)ccc1-n1cnnn1	763938173	AZUAVDKHRCPPTK-LLVKDONJSA-N	439.501	1.557	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)c2cccnc12	763950943	XGGTYBMGDUECGZ-UHFFFAOYSA-N	430.424	1.834	50	20	IDGD	
CCN(CC)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1	764003271	AVTMCNHWBHDRNH-UHFFFAOYSA-N	440.456	1.340	50	20	IDGD	
CCNC(=O)COc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2OC)c1	764012164	MCXMZALZOYHOOU-UHFFFAOYSA-N	448.863	1.263	50	20	IDGD	
Cc1ccc(S(C)(=O)=O)cc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccccc2)on1	764017145	RXTQGRLUMHRVEO-UHFFFAOYSA-N	442.453	1.453	50	20	IDGD	
COC(=O)c1cc(OC)ccc1NC(=O)C(=O)NNC(=O)c1ccc(Cl)cc1OC	764019821	RSJWULRHZQJFQF-UHFFFAOYSA-N	435.820	1.544	50	20	IDGD	
COc1ccc(C(=O)N2CCCC2)cc1NC(=O)C(=O)NNC(=O)Cc1ccsc1	764035224	PULGEPPAUBFMJR-UHFFFAOYSA-N	430.486	1.321	50	20	IDGD	
O=C(NNC(=O)C1CCCC1)C(=O)Nc1ccccc1CS(=O)(=O)c1ccccc1	764071185	QTPJYYXMEYUYLI-UHFFFAOYSA-N	429.498	1.937	50	20	IDGD	
O=C(CC1CC1)NNC(=O)C(=O)Nc1cc(Br)cnc1OCC(F)(F)F	764142119	LAIDLKVIURDZMQ-UHFFFAOYSA-N	439.188	1.671	50	20	IDGD	
CN(C)C1CCN(c2ccc(NC(=O)C(=O)NNC(=O)c3ccc(C#N)cc3)cc2)CC1	764177388	LVPCKVYCNQLWQA-UHFFFAOYSA-N	434.500	1.488	50	20	IDGD	
C[C@@H](C(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)CCc2ccccc2)c1)n1cccn1	764187508	GIBQAXXESSPZPV-INIZCTEOSA-N	448.483	1.802	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C)c(C)c(NC(=O)C(=O)NNC(=O)CC(C)(C)C)c1	764199844	XYVRGOAUAFTFMA-UHFFFAOYSA-N	440.566	1.856	50	20	IDGD	
Cc1nn(-c2ccc(Cl)c(Cl)c2)c(NC(=O)C(=O)NNC(=O)CN(C)C)c1C	764210361	BGEPTTOUFSYDPD-UHFFFAOYSA-N	427.292	1.443	50	20	IDGD	
Cc1nnnn1-c1cc(NC(=O)C(=O)NNC(=O)C(C)(C)c2ccccc2)ccc1F	764309843	WHGABSUUMZRNJP-UHFFFAOYSA-N	425.424	1.174	50	20	IDGD	
Cc1nn(Cc2ccccc2)c(Cl)c1C(=O)NNC(=O)CNC(=O)c1cccnc1	764345188	OUXHTHDMHGKZQJ-UHFFFAOYSA-N	426.864	1.479	50	20	IDGD	
CC(C)CC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)COCc2ccccc2)cc1	764367214	KIOAMTXXLDHSRC-UHFFFAOYSA-N	426.473	1.974	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)c(OC)c1OC	764376772	HHVBEVWNODSLHZ-UHFFFAOYSA-N	445.457	1.564	50	20	IDGD	
COC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)CSc2ccccc2OC)cc1	764392573	GATAKWLRBYPLHY-UHFFFAOYSA-N	432.458	1.752	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)C(=O)Nc1ccccc1C(=O)N1CCCC1	764404259	HEPOJZALVKGQQA-UHFFFAOYSA-N	442.497	1.506	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)C(=O)Nc2ccnc(Oc3ccccc3)c2)c1	764431466	YAGUZJADWSCLNS-UHFFFAOYSA-N	434.412	1.627	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)C(=O)Nc2ccnn2-c2ccc(Cl)cc2)c1	764433649	PHBSMPUPWOIDCZ-UHFFFAOYSA-N	441.835	1.279	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)N[C@@H](C)Cn2ncc3ccccc3c2=O)cc1C	764460278	FBQQQYBKYPCEFY-HNNXBMFYSA-N	436.472	1.371	50	20	IDGD	
COc1cc(C)c(Br)cc1NC(=O)C(=O)NNC(=O)[C@@H]1Cc2ccccc2O1	765375348	CGANKEHYDREJRB-INIZCTEOSA-N	448.273	1.856	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)C[C@H](C)CC(C)C)CC2)cc1	765729329	ONQAOCOFCHQPOA-GOSISDBHSA-N	438.594	1.521	50	20	IDGD	
COCCOc1ccc(C(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)cc1	765754792	NNGZZACGMRTBOL-UHFFFAOYSA-N	440.544	1.599	50	20	IDGD	
C[C@@H](CN1CCN(c2ccccn2)CC1)NC(=O)NNc1ccccc1S(C)(=O)=O	765779262	IMRXUWUKYMDKOG-INIZCTEOSA-N	432.550	1.322	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2c(-c3ccccn3)noc2C)cc1OC	767558388	CQXGZKWKXIFBAP-UHFFFAOYSA-N	440.412	1.680	50	20	IDGD	
Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)Oc1ccc(C(=O)NNC(=O)C(C)(C)O)cc1	768260822	XMSTUOSYFJXLLP-UHFFFAOYSA-N	437.430	1.203	50	20	IDGD	
C[C@@]1(NNC(=O)N[C@H]2CC(=O)N(Cc3ccccc3C(F)(F)F)C2)CCS(=O)(=O)C1	768519196	LUVMHOAOGFAJQJ-SUMWQHHRSA-N	448.467	1.187	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)N1CC=C(c2ccc3c(c2)OCCO3)CC1	770775001	MBDDOSRIBMZOJH-UHFFFAOYSA-N	442.497	1.779	50	20	IDGD	
COC(=O)CNC(=O)Cc1ccc(NC(=O)C(=O)NNc2c(F)cccc2Cl)cc1	770810760	AQEXSVYITYFHDJ-UHFFFAOYSA-N	436.827	1.393	50	20	IDGD	
COc1c(NC(=O)C(=O)NNc2ccc(Br)c(F)c2)cccc1C(N)=O	770816583	ZNICMHQKTHKWBF-UHFFFAOYSA-N	425.214	1.778	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)N[C@@H]2CC(=O)N(c3c(F)cccc3F)C2)cc1	771434692	PKCBHKCAFATXSK-CYBMUJFWSA-N	429.383	1.351	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)c1nccc2c(S(N)(=O)=O)cccc12	772994225	JODNSOUSCVRTTJ-NSHDSACASA-N	448.888	1.764	50	20	IDGD	
CN1CCN(C(=O)NNC(=O)C2(S(=O)(=O)c3ccc(Cl)cc3)CCCC2)CC1	773671772	BLPNMFKLXCTCKF-UHFFFAOYSA-N	428.942	1.415	50	20	IDGD	
COc1ccnc(NNC(=O)Nc2ccc(OC)c(S(=O)(=O)N3CCCCC3)c2)n1	775446509	XYWFDXYJJOLILN-UHFFFAOYSA-N	436.494	1.817	50	20	IDGD	
COC(=O)N1CCC[C@H]([C@H](C)NC(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)C1	776244467	NIOPTRNHMYYDSL-RYUDHWBXSA-N	434.501	1.780	50	20	IDGD	
COCCO[C@@H]1COCC[C@@H]1NC(=O)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1	777279993	WQGHEBIANLVRAT-UONOGXRCSA-N	441.428	1.427	50	20	IDGD	
O=C(CCc1cnn(-c2ccccc2)c1)N1CCN(S(=O)(=O)CBr)CC1	777777519	LFMOFZUXUVJYRZ-UHFFFAOYSA-N	441.351	1.631	50	20	IDGD	
CCc1[nH]c(C(=O)N2CCN(S(=O)(=O)CBr)CC2)c(C)c1C(=O)OC	777778155	YZEVFKNOJUKPJL-UHFFFAOYSA-N	436.328	1.112	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1cc([N+](=O)[O-])ccc1OC(F)F	778704906	OOQDKXNROGMJEZ-UHFFFAOYSA-N	436.375	1.664	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@@H](C(=O)NNC(=O)CCCc2ccccc2)[C@H](C)O)cc1	779515019	RRSXVLHZIZPLTD-OXJNMPFZSA-N	433.530	1.193	50	20	IDGD	
N#Cc1ccc(N2CCC[C@H](NC(=O)NNC(=O)c3ccc4c(c3)OCCO4)C2=O)cc1	780895104	WKSKXHUKEYZIMD-KRWDZBQOSA-N	435.440	1.469	50	20	IDGD	
COc1ccc(NNC(=O)[C@@H]2CCCCN2S(=O)(=O)c2ccc(C(C)=O)cc2)nc1	781533982	QTAPWLLSMJCLJL-SFHVURJKSA-N	432.502	1.979	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCC2(N(C)C)CCC2)c1	783004812	LRGDGJKVVPYNIQ-UHFFFAOYSA-N	425.555	1.145	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2ccc(OCc3ccccc3F)cc2)CCS(=O)(=O)C1	783427945	RIIVVEGARBIOGT-FQEVSTJZSA-N	435.477	1.541	50	20	IDGD	
O=C(NNc1ccc(Br)cn1)C(=O)Nc1ccc2c(c1)S(=O)(=O)CC2	784341670	QXNVYSVOYTZVRQ-UHFFFAOYSA-N	425.264	1.256	50	20	IDGD	
O=C(COCCNC(=O)c1ccccc1)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	784683478	CHKRFFYHJZZZHU-UHFFFAOYSA-N	425.420	1.423	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNc3ccc(Br)nc3)cn2)C[C@@H](C)O1	784808831	GPWAQKKZZCWBOS-TXEJJXNPSA-N	449.309	1.935	50	20	IDGD	
CCOC(=O)COc1ccc(NC(=O)C(=O)NNc2ccc(Br)nc2)cc1	784808929	IQGLOJGUDHSISR-UHFFFAOYSA-N	437.250	1.868	50	20	IDGD	
Cn1c(=O)oc2c(NC(=O)C(=O)NNc3ccc(S(=O)(=O)C(F)F)cc3)cccc21	784835513	QGVZOXKGJQPJLK-UHFFFAOYSA-N	440.384	1.210	50	20	IDGD	
Cn1nc(-c2ccsc2)cc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccccc2)[nH]n1	787541494	TWBIKEDTVSZAAD-UHFFFAOYSA-N	435.469	1.938	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)C(=O)Nc2ccc(Cl)c(S(C)(=O)=O)c2)c1	788331666	UDEYEYGVVDZNMI-UHFFFAOYSA-N	425.850	1.612	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2nc3ccccn3n2)cc1NC(=O)c1ccncc1	792394029	LSHFLONLPIXFIW-UHFFFAOYSA-N	430.428	1.767	50	20	IDGD	
CN(CCC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)C(=O)OCc1ccccc1	793422174	FWJQHJKYOYEAEN-UHFFFAOYSA-N	440.504	1.499	50	20	IDGD	
CC1(C)C(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)C1(C)C	793477895	LUNBBWWLAPNXPB-UHFFFAOYSA-N	438.550	1.334	50	20	IDGD	
CC(C)n1nc(C(=O)NNS(=O)(=O)c2cccc(CC#N)c2)c2ccccc2c1=O	794577495	XSHGGRRBPUCYRU-UHFFFAOYSA-N	425.470	1.667	50	20	IDGD	
Cc1nc2c3cccnc3nn2c(C)c1CCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	794761089	WFHIWVPPBZBFSC-IBGZPJMESA-N	446.467	1.814	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)[C@H]1N(C(=O)OC(C)(C)C)CC1(C)C	796218542	OLYBRHPZFONLEB-GOSISDBHSA-N	433.505	1.874	50	20	IDGD	
COc1cc2c(cc1NC(=O)NNC(=O)CNC(=O)OCc1ccccc1)NC(=O)CC2	797645638	SFWWRPNZHXMUQL-UHFFFAOYSA-N	441.444	1.659	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@@H]2C(=O)NNc2c(OC)cccc2S(C)(=O)=O)cc1	798992553	JNYPEOWQLJUDHL-MRXNPFEDSA-N	447.513	1.855	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)NCc1cccc(CS(N)(=O)=O)c1	800718279	FMJBPSQCVWQQHW-UHFFFAOYSA-N	426.882	1.281	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(CN3C(=O)CSC3=O)c2)cc1	801108395	NCNYXGJZAVQVBJ-UHFFFAOYSA-N	426.454	1.590	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CS(=O)(=O)Nc2ccc(OC(C)C)cc2)cc1	801109800	CRPFLNTYRGKPCW-UHFFFAOYSA-N	448.501	1.310	50	20	IDGD	
CC(C)(C(=O)NNC(=O)[C@@H]1COc2ccccc2O1)S(=O)(=O)c1ccc(Cl)cc1	806294416	NFVDCHSVVRFPTD-INIZCTEOSA-N	438.889	1.880	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2cc3ccccn3n2)c1	806648916	NZWJWQCICVLUAG-UHFFFAOYSA-N	430.490	1.831	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2cc(Cl)cc3c2OCC(=O)N3)c1	806974836	VQDIWKQYPAWITB-UHFFFAOYSA-N	448.819	1.088	50	20	IDGD	
COCc1cnc(NC(=O)C(=O)NNC(=O)c2cc(OC)ccc2Br)s1	806977947	FXRUBASGHFEOON-UHFFFAOYSA-N	443.279	1.460	50	20	IDGD	
O=C1COC[C@H](C[C@H]2CN(C(=O)C(=O)NNc3cc(F)c(F)cc3F)c3ccccc32)N1	807014043	PCPKXHWVNADGMG-RYUDHWBXSA-N	448.401	1.583	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)N[C@@H]2CCCN(C(=O)CCC(F)(F)F)C2)cc1	807573896	HWKSRLQISVPMBM-CYBMUJFWSA-N	446.426	1.738	50	20	IDGD	
COc1cc(NC(C)=O)c(Cl)cc1S(=O)(=O)NNC(=O)c1ccc(Cl)nc1	808077556	LGGFQHDDWSGTIA-UHFFFAOYSA-N	433.273	1.979	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)C(=O)Nc1c2c(cc3c1CCC3)CCC2	810384341	JTPDITRKPZKBKY-UHFFFAOYSA-N	445.479	1.955	50	20	IDGD	
CC(=NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1)[C@H](C)NC(=O)OC(C)(C)C	811645299	HJZFETWUKRGJGG-INIZCTEOSA-N	431.537	1.850	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)Nc2ccccc2CS(C)(=O)=O)cc1	812927659	ABFDCEXKXFZYJQ-UHFFFAOYSA-N	426.520	1.630	50	20	IDGD	
CC(C)(C)OC(=O)N1CCOc2ccc(NC(=O)C(=O)NNC(=O)C(C)(C)C)cc2C1	812976964	PQORZDITPWVNNQ-UHFFFAOYSA-N	434.493	1.948	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)c(Cl)n1	813034028	VTSKSDLWNXMTHM-UHFFFAOYSA-N	427.870	1.076	50	20	IDGD	
O=C(NN=C1CC(C(=O)O)(c2cccc(Br)c2)C1)N[C@H]1CCS(=O)(=O)C1	814816182	OSQDYXXGPIYVDT-HKALDPMFSA-N	444.307	1.408	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2nnn(CCOc3ccc(F)cc3)c2C)c(C)o1	815564889	WLLPNOSZGGNYTN-UHFFFAOYSA-N	444.423	1.414	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(Br)c(C3CC3)n2)c1O	815568404	GNJLUKIGSGWBOO-UHFFFAOYSA-N	449.261	1.835	50	20	IDGD	
Cc1ccccc1-n1nccc1NC(=O)C(=O)NNc1ccccc1S(=O)(=O)N(C)C	815751569	FGFCNMSJKKWHNL-UHFFFAOYSA-N	442.501	1.513	50	20	IDGD	
O=C(Cc1ccc(Br)cc1O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	815934152	OMLSDGDIQVAMDH-UHFFFAOYSA-N	440.681	1.814	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2cc(C(=O)NNc3cnnn3C)ccc2Cl)C[C@@H](C)O1	816771762	ZTTVOHSWIHLWDR-PHIMTYICSA-N	428.902	1.023	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)sc(C)c1C	913055109	GYLRXMPRNUYPEQ-AWEZNQCLSA-N	447.469	1.468	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)c1cn(-c2ccccc2C(F)(F)F)nn1	914728693	HJXRGPIDXMLVCB-MRXNPFEDSA-N	433.346	1.887	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)CS(=O)(=O)Cc2ccc(C#N)cc2)c1C	916111288	KAWHPSGDPKBFLZ-INIZCTEOSA-N	429.498	1.705	50	20	IDGD	
CC(=NNC(=O)c1cccc(N(C)C)c1)c1ccc(S(=O)(=O)N2CCOCC2)cc1	916281422	XLVOJPJTRXIICM-UHFFFAOYSA-N	430.530	1.928	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)NCc1cccc(S(=O)(=O)NC(C)C)c1	916486465	UBQBDPATCYXNGO-UHFFFAOYSA-N	448.545	1.845	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)CNS(=O)(=O)c2ccc(Cl)cc2)c2ccccc2n1	917365507	ZSHTZMMUCWVPFG-UHFFFAOYSA-N	432.889	1.936	50	20	IDGD	
C=CCNC(=O)c1cccc(S(=O)(=O)NNC(=O)c2cc(Br)c[nH]2)c1	917733476	SYFSWOGSHRIFOP-UHFFFAOYSA-N	427.280	1.316	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)[C@H](C)NS(=O)(=O)c1cccs1	917908562	NGNPZNOELBTPTL-LBPRGKRZSA-N	427.504	1.040	50	20	IDGD	
O=C(NCCCCn1ccnc1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	918138964	IMHHOJZUVXUYRM-UHFFFAOYSA-N	434.522	1.092	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NCc2cccc(OCC(=O)N(C)C)c2)cc1C	918224411	WHDZTMRMQPXRNW-UHFFFAOYSA-N	428.489	1.680	50	20	IDGD	
O=C(CSCc1ccccn1)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	918279339	RGKPLAMKKQDFAV-UHFFFAOYSA-N	448.570	1.951	50	20	IDGD	
O=C(CCNS(=O)(=O)c1cccnc1)NNC(=O)c1ccc(F)cc1Br	918342033	PZMCHFQJHANHQL-UHFFFAOYSA-N	445.270	1.113	50	20	IDGD	
CC(C)C[C@@H](/N=C1/NS(=O)(=O)c2ccccc21)C(=O)NNC(=O)c1ccc(Cl)nc1	918599443	FHDBVCXUPLIYBM-CQSZACIVSA-N	449.920	1.649	50	20	IDGD	
NC(=O)[C@H]1CC(C(=O)NNC(=O)c2cc3ccccc3cc2O)=NN1c1ccc(F)cc1	918781297	PYMDPOYFVSPHAH-GOSISDBHSA-N	435.415	1.566	50	20	IDGD	
O=C(CSC(F)F)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	920821276	VMZQASAEMSWYBV-UHFFFAOYSA-N	429.470	1.882	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)Cc2ccc(C(=O)NNC(=O)[C@@H]3CCOC3)cc2)cc1	921202813	GCVCNCYUHSHLKJ-GOSISDBHSA-N	431.514	1.613	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(C(=O)NNC(=O)c2cncn2-c2ccccc2)ccc1F	1327112367	DZEDFTMORNTRNF-UHFFFAOYSA-N	431.449	1.337	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(CCN(C(=O)c3cc4n(n3)CCCC4)C2)C1	1778558823	WHTGLWLOODJJDL-GOSISDBHSA-N	425.327	1.448	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccn4ccnc4c3)C2)C1	1778570003	JKNNGBGQAXJCEN-HNAYVOBHSA-N	435.322	1.951	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4c(c3)CNC4=O)C2)C1	1778729051	NLUBAKJLVKTNDB-CWTRNNRKSA-N	436.306	1.157	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc3nncn3c2)C1	1779066554	ITWRVIHUOMLLON-DYESRHJHSA-N	445.596	1.708	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Cl)C2)c1nc(O)n2c1CCCC2	1779576485	KHTMQJDJEWBAMZ-FRIZHTMISA-N	428.892	1.587	50	20	IDGD	
Cn1ccc2c(O)ncc(C(=O)N3CC[C@]4(CN(C(=O)CO[Si](C)(C)C)CCO4)C3)c21	1779975427	BFUBFFIVKIPHLG-NRFANRHFSA-N	446.580	1.574	50	20	IDGD	
O=C(c1cccc(-c2cnccn2)c1)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1780184845	BMKHOESKYHCKMH-RXVVDRJESA-N	430.892	1.187	50	20	IDGD	
CCC(=O)N[C@@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)Br)C1	1781997397	UUCZSFKYTVFDCC-KYZVSKTDSA-N	432.359	1.198	50	20	IDGD	
CCCC(=O)N[C@@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)Br)C1	1781998189	UXAKDEUKGRLFFN-XTDOFWJNSA-N	446.386	1.589	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)CCc3cc(F)ccn3)CCO2)C1	1783529809	NPUDTGBSCLETDQ-UGSOOPFHSA-N	428.302	1.767	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(O)nc(Cl)c3)CCO2)C1	1783532353	MMGHISDYLLTVPR-HWPZZCPQSA-N	432.702	1.668	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)C(Cl)Cl)C3)C2)c(-n2nccn2)c1	1783948149	COPBBSDHGCCAGG-LJQANCHMSA-N	438.315	1.823	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CNC(=O)OC(C)(C)C)C[C@@H]21	1784622732	SEIXBAVSLMQESM-JONQDZQNSA-N	431.961	1.898	50	20	IDGD	
COc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCBr)[C@H]3C2)ccc1O	1786408898	JSWQGJRGEYNTEH-ZQIUZPCESA-N	441.322	1.779	50	20	IDGD	
O=C(C[C@H]1NC(=O)NC1=O)Nc1ccc(C2(NC(=O)[C@H](F)Br)CCC2)cc1	1786761731	JVMVBFVEBFMDDM-YPMHNXCESA-N	441.257	1.409	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C[C@@H](N)c3cccnc3)[C@H]2C1	1786928458	KDPJBVCFHHAIAZ-SAGLZJIZSA-N	443.375	1.688	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3ON=C(c4ccccc4)O3)C[C@@H]21	1789863357	OQYNVNCGCSSMKX-QHXHSKPESA-N	435.908	1.718	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CCc4nc[nH]c4C3)C[C@@H]21	1791064644	BIPGNNSYXUCPHB-DEEHTKSCSA-N	439.354	1.278	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCOc3ccc(F)cc3)C[C@@H]21	1791249175	FNFFEGYQKHLVFL-FZDIXFNVSA-N	442.915	1.828	50	20	IDGD	
CCS(=O)(=O)N[C@H](C)C(=O)NC1(c2ccc(NC(=O)[C@H](Cl)COC)cc2)CCC1	1791565620	SMQBHBLQNSDRCN-CZUORRHYSA-N	445.969	1.702	50	20	IDGD	
N#Cc1ccc(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)cc1	1792638801	DSNCSDBTTCBMGK-BCDXTJNWSA-N	432.484	1.051	50	20	IDGD	
CC(C)c1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)CBr)n[nH]1	1792872530	MKXCKPBIUNAIMP-NFFDBFGFSA-N	427.343	1.767	50	20	IDGD	
O=C([C@H](F)Br)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1(c2ccc(O)cc2)CC1	1793028263	WTTNUMXRRZFQSL-VZAMPYOESA-N	441.297	1.704	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1c(C)nn(C)c1C	1793527046	PWPLFXIOJMOACE-HLPPOEQASA-N	427.343	1.414	50	20	IDGD	
COc1cccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCBr)c1	1795112422	HJIAQAPMAHGBKK-CCWDJLKJSA-N	425.323	1.612	50	20	IDGD	
COc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Cl)c([N+](=O)[O-])cc1O	1796366521	ZJPGLKQUJLSPJX-QTGCHDBNSA-N	431.804	1.047	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ncccc1F)C2	1796891708	GOFCJMNEANLVTB-SSJPOKSSSA-N	426.452	1.607	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)COc1cc(Cl)ccn1	1797907346	DSCBXOIRSYKDOJ-OVZMXSCWSA-N	446.729	1.487	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc3n[nH]cc3c1)C2	1798440215	HMGCVIYBCNMMQA-MUJYYYPQSA-N	433.472	1.127	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2c(c1)NC(=O)[C@H](C)O2	1798582529	GKTWJCYKZYAOLY-VGXVWSLXSA-N	435.908	1.627	50	20	IDGD	
C[Si](C)(C)c1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Br)co1	1799349893	MUGFQBACEFWHBY-NEBZKDRISA-N	447.377	1.719	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](C)N1CCN(C)CC1	1799968774	VPQWAFFLLSCPHQ-UUAJXVIYSA-N	429.403	1.434	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H]2C[C@@]21C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](O)CCl)C2	1801980593	YTUQJYYTBSJLSC-DKQNDJRWSA-N	441.956	1.624	50	20	IDGD	
CC(C)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C=C/c1ccc(O)c(O)c1O	1802078801	INVXGWVZRHZTAK-ZYBHWSPSSA-N	438.908	1.671	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)CSC1=S	1804336146	XLAYZQUCMKALND-CLLJXQQHSA-N	429.640	1.336	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@H](CNC(=O)c2ccc[n+]([O-])c2)[C@@H]1c1cccnc1	1804783547	STIKLFVUIHUAOE-PXNSSMCTSA-N	428.565	1.886	50	20	IDGD	
CCS(=O)(=O)CC(=O)N1CCC2(CCCN(C(=O)[C@H](C)CBr)C2)CC1	1805384252	UVQWTXXNKQGNIK-CQSZACIVSA-N	437.400	1.683	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)c2ccon2)[C@H]1c1cccnc1	1805996639	WEUHQEWMCOYMNZ-JMBUVSEHSA-N	449.471	1.523	50	20	IDGD	
C[C@@H](C(=O)N1CCC2(CCCN(C(=O)CCBr)C2)CC1)N1CCN(C)CC1	1809070333	ZWGYXRMGNHOSPU-KRWDZBQOSA-N	443.430	1.639	50	20	IDGD	
C#CCCCC(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1	1810305943	QXNLRMVISFTKNX-UTKZUKDTSA-N	434.500	1.203	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)CCn2ccnn2)[C@H]1c1cccnc1	1812779355	SWQNXWHTSKTSJW-RYRKJORJSA-N	449.353	1.943	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)Cc2ccsc2)[C@H]1c1cccnc1	1813070448	GUIDTMGODOJTHK-GCJKJVERSA-N	443.573	1.765	50	20	IDGD	
O=C1C[C@H](C(=O)NC[C@@H]2CCN(C(=O)[C@@H](F)Br)[C@H]2c2cccnc2)CCN1	1813136424	UZVKDTZEJZISRD-SHPPOPEUSA-N	441.301	1.304	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)CN2C(=O)C=CC2=O)[C@@H]1c1cccnc1	1813175641	LTSGLAGVKVZVBD-FTRWYGJKSA-N	432.908	1.420	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(F)c1)CC2)c1ccc(B(O)O)cc1	1815343817	QLONOMNVKVSGNS-MRXNPFEDSA-N	439.277	1.502	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H]3CCCO3)sc2C1	1815794537	JZIKXFQAMRIGID-CBZIDRGTSA-N	444.517	1.368	50	20	IDGD	
Cc1cc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)[nH]n2)on1	1816473355	MJTOYUYGKACAJD-OAHLLOKOSA-N	438.448	1.324	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CN2CCOCC2)[nH]n1	1820864207	SQQLCWOCWIUZKL-KDOFPFPSSA-N	432.352	1.970	50	20	IDGD	
COc1ccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)cn1	1822410598	MKCCVEFRYUDDQQ-INIZCTEOSA-N	443.508	1.492	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCc1nc(N)n[nH]1)CC2	1822867591	JTAHXTGDDQFTKL-BCTVWOGZSA-N	446.364	1.625	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](NC(C)=O)C(C)(C)C)CC2	1825993806	FPOFPCSHZNINAC-HUBLWGQQSA-N	444.985	1.860	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)Cc1ccc(F)cc1)CC2	1826085498	XIFYRNBONYNRQF-OAHLLOKOSA-N	447.536	1.810	50	20	IDGD	
O=C(C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1)c1ccccc1	1826288863	ZKQCKRHSYOXOSO-JOCHJYFZSA-N	448.328	1.483	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)CCn3cncn3)sc2C1	1826611213	QMLWUGDISYGIIQ-MNOVXSKESA-N	441.355	1.910	50	20	IDGD	
O=C(C[C@@H]1CCCCO1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827050039	FFLLEPAHROJERV-VXKWHMMOSA-N	442.365	1.559	50	20	IDGD	
Cc1ncsc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827050870	GPTMGPNLGYYDTH-IBGZPJMESA-N	441.362	1.678	50	20	IDGD	
O=C(c1cc(F)c[nH]1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827053119	DKBNRYIURADNAB-FQEVSTJZSA-N	427.285	1.381	50	20	IDGD	
Cc1[nH]ccc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1	1827880852	OBRNWIIOWQWILL-FQEVSTJZSA-N	438.532	1.869	50	20	IDGD	
O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)c1cccnc1Cl)CCO2	1829493488	KTUYJZVGRWANAN-KRWDZBQOSA-N	446.729	1.590	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(Cl)nc3)CCO2)C1	1829513004	SUMJILJMUDWDHR-RDTXWAMCSA-N	432.304	1.059	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(C)c(Cl)c3)CCO2)C1	1830114840	KUBJIJKHOLIKCO-FXAWDEMLSA-N	445.343	1.972	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccn3C)CCO2)C1	1833905418	LKZZSSDCRDAQOT-KSSFIOAISA-N	428.327	1.126	50	20	IDGD	
Cc1nc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)CBr)C3)C2)cs1	1834450316	ANQVKTOOIJAAPK-SJKOYZFVSA-N	446.367	1.553	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](N)c3ccccn3)CC2)CC1	1834720937	HJJSPFXALZGNAP-IBGZPJMESA-N	436.000	1.918	50	20	IDGD	
N#Cc1cccc(C(=O)N2CCOC[C@]3(CN(C(=O)CCBr)CCO3)C2)c1	1834824140	SBYNQDHLOJPFMA-IBGZPJMESA-N	436.306	1.413	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cnc(OCF)cn3)CC2)CC1)[C@@H](F)Cl	1835078609	OUVCLMVQIUQFQY-MRXNPFEDSA-N	431.871	1.502	50	20	IDGD	
CCNC(=O)N[C@@H](C)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](Cl)CC)CC2)CC1	1835709008	NOQTWKHOJFVITG-YOEHRIQHSA-N	429.993	1.283	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cc(Cl)ncn3)CC2)CC1	1836027928	YSECWQRYGFWCSF-OAHLLOKOSA-N	444.363	1.569	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC(OC2CCN(C(=O)c3ncnn3C)CC2)CC1	1836669718	ARMSNSFGXNLUNF-CYBMUJFWSA-N	442.358	1.458	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccn4cncc34)CCO2)C1	1837108149	SJMFSLNMJNOBSV-OAQYLSRUSA-N	434.924	1.669	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)C3=CCCC3)CC2)CC1	1837615778	ZFPSSEBGYRXIAJ-UHFFFAOYSA-N	441.532	1.408	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4ncccc4[nH]3)C2)C1	1837715655	CLOWNNRRKYMIDB-NRFANRHFSA-N	446.580	1.484	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(Cl)ncn3)CCO2)C1	1838254865	YCJYAKFHLGRKPU-UGSOOPFHSA-N	431.320	1.608	50	20	IDGD	
C=C[C@H](O)C(C)(C)C(=O)N1CCC(OC2CCN(C(=O)[C@H](Cl)COC)CC2)CC1	1838386193	BVKCERHUDYTCQG-MSOLQXFVSA-N	430.973	1.812	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3[nH]cc4c3CCC4)CCO2)C1	1838456568	JBQLNTIBVBEVPB-BFUOFWGJSA-N	440.338	1.357	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(NC(C)=O)o3)C2)C1	1839146427	ZAGPFLNWMVUDGZ-KUHUBIRLSA-N	427.885	1.325	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccc(F)cc3F)C2)C1	1839147845	DTTRKPUKEBSMQC-OXJNMPFZSA-N	430.879	1.981	50	20	IDGD	
C=CCC(F)(F)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H](F)Br)CCO2)C1	1839202671	MLSSTLQMCZDYRN-RISCZKNCSA-N	429.233	1.345	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)s1	1840030978	BRJOSDMTZZRPGX-DYVFJYSZSA-N	431.352	1.910	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)c3ccccc3)C2)C1	1840150274	HXPBZIUBJIOOIP-SQGPQFPESA-N	428.888	1.407	50	20	IDGD	
COc1cccc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)c1	1840187907	DPJGBMQCAAZXHI-IBGZPJMESA-N	431.316	1.498	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCNC(=O)OC(C)(C)C)CCO2)C1	1840802575	UNRWAMYQQOJPEP-FOIQADDNSA-N	447.960	1.375	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@](O)(C(=O)N2CC3(CCCN3C(=O)C(C)(C)CCl)C2)C1	1841227387	INUAWHCWFAGBEF-NRFANRHFSA-N	443.972	1.827	50	20	IDGD	
Cn1c(C(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)cc2ccccc21	1843615089	GVUJPXMIGNGAOG-UHFFFAOYSA-N	432.484	1.308	50	20	IDGD	
COc1cc(C(=O)N2CCCC23CN(C(=O)[C@@H](O)CCl)C3)ccc1Br	1845341489	HTHPDPZMLPGLNZ-ZDUSSCGKSA-N	431.714	1.874	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@]2(C(=O)N3CCCC34CN(C(=O)[C@H](O)CCl)C4)C[C@@H]2C1	1846103985	PVYZTAJFCFCBND-PZPWOCDFSA-N	441.956	1.437	50	20	IDGD	
O=C(c1c(C(F)(F)F)nc2ccc(F)cn12)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl	1847562706	KCAQZPOFZGVZEW-SRVKXCTJSA-N	448.804	1.907	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1ccc(F)c(C)n1	1848341657	MRBIORRBHGYCPI-WECDIVOHSA-N	426.452	1.479	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)[C@@H]2Oc3ccccc3O[C@@H]2C)cc1OC	10948474	DAKNFVOOLLVJGW-CWTRNNRKSA-N	430.413	1.237	50	20	IDGD	
O=C(CCn1cnc2ccccc2c1=O)NNC(=O)COc1ccc(Br)cc1	12613903	JAJUSBWANVBSJX-UHFFFAOYSA-N	445.273	1.776	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2[nH]c3c(c2C)C(=O)CCC3)cc1	21778938	HDSABNUNMLLMKA-UHFFFAOYSA-N	432.502	1.232	50	20	IDGD	
CSc1nc2nc(C)c(CC(=O)NNC(=O)c3ccc4c(c3)OCCO4)c(C)n2n1	105309244	DYTLUNMLKGRFFR-UHFFFAOYSA-N	428.474	1.238	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)c1ccc2c(=O)[nH]c(S)nc2c1	110549618	VEEVMKIIFYPEFG-UHFFFAOYSA-N	431.499	1.409	50	20	IDGD	
CC[C@@H](C)C(=O)N1CCC[C@H](C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)C1	726033391	GRTJDGBBBXAQTC-HIFRSBDPSA-N	434.449	1.184	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)NCC(=O)N2CCc3ccccc3C2)cc1OC	726618699	LXWYZDLULWDYIF-UHFFFAOYSA-N	426.473	1.623	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)NCC(=O)N(C)CCc2ccccn2)c1C	727608054	KASOZQWYCVDTTF-QGZVFWFLSA-N	427.505	1.497	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Cc2ccc(OC)c([N+](=O)[O-])c2)c2ccccc2c1=O	727671695	IVAGEXNZFIOKOR-UHFFFAOYSA-N	425.401	1.337	50	20	IDGD	
C[C@@]12CCC(=O)N1c1ccccc1C(=O)N2CC(=O)NNc1nc(-c2ccncc2)no1	728072399	IBYJLGVYLWHGFF-NRFANRHFSA-N	433.428	1.574	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2ccc[nH]2)c(Br)cc1Cl	728261694	VRMJZOSQENUJJR-UHFFFAOYSA-N	436.671	1.841	50	20	IDGD	
C[C@H](C(=O)NNc1ccc(S(=O)(=O)C(F)F)cc1)N1C(=O)[C@H]2CCCC[C@@H]2C1=O	728974732	ZQVKJDFDTVGMKG-SWHYSGLUSA-N	429.445	1.690	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(C(C)=NNC(=O)C2CCN(c3ncccn3)CC2)cc1	729636117	BWEPMVCWDGLAJJ-UHFFFAOYSA-N	430.534	1.995	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)c2c(F)ccc(S(=O)(=O)NC3CC3)c2F)c1	729837274	GZZKPCZXNKIOER-UHFFFAOYSA-N	438.456	1.546	50	20	IDGD	
CN(C)N(C(=O)c1cnn(-c2cccc(Br)c2)c1)[C@H]1CCS(=O)(=O)C1	730161524	IJKHTEZEOMRBIV-HNNXBMFYSA-N	427.324	1.741	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)c1cc(S(=O)(=O)N2CCC[C@H](C)C2)cn1C	730176511	WYCAFFYBXMBRGR-HNNXBMFYSA-N	448.545	1.458	50	20	IDGD	
CC(C)c1nc(C#N)c(NNC(=O)[C@@H]2CCCC[C@H]2C(=O)N[C@@H]2CCS(=O)(=O)C2)o1	731620825	OSCVZBHTPJADLJ-MGPQQGTHSA-N	437.522	1.222	50	20	IDGD	
CCc1nc([C@@H](C)NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cs1	732474238	KGAZNJANODSKNG-LLVKDONJSA-N	425.536	1.661	50	20	IDGD	
Cc1nn(-c2ccccc2)c2sc(C(=O)NNC(=O)[C@@H]3CCCN3S(C)(=O)=O)cc12	732920289	SUTSUFCNWOLKLO-HNNXBMFYSA-N	447.542	1.580	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1cnn(-c2ccccc2)c1)c1cccc(S(N)(=O)=O)c1	733335067	HTXWWLQOCBUWCB-CYBMUJFWSA-N	428.474	1.225	50	20	IDGD	
CC(C)c1cc(CNC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)on1	734072384	XQFBMRUULIVTAX-UHFFFAOYSA-N	435.506	1.727	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)c1ccc(N2CCOCC2)c(F)c1	734242016	NZDXVIDABWTHNI-UHFFFAOYSA-N	425.461	1.131	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCCOC[C@@H]1CCCO1	734518986	MJNBXXXDVIEXGG-DOMZBBRYSA-N	430.299	1.742	50	20	IDGD	
C[C@@H](CC(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1)NC(=O)c1ccccc1	734824821	JOKOJWKYESOAJS-HNNXBMFYSA-N	447.536	1.925	50	20	IDGD	
COc1cccc(CCC(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)c1	735116872	JFWCTHRBQSOHGM-UHFFFAOYSA-N	433.534	1.102	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)c1ccc(N2CCCS2(=O)=O)cc1Cl	736067101	DYFVWDWRBRDMJI-UHFFFAOYSA-N	447.904	1.911	50	20	IDGD	
CC(C)CCn1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)nn1	740634334	LBVHHRYJJPGZSE-UHFFFAOYSA-N	434.522	1.184	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cccc(-c3cnn(C)c3)c2)cc1	741659501	BHSTYKKJHKKAFT-UHFFFAOYSA-N	441.513	1.477	50	20	IDGD	
COC(=O)Cn1cc(S(=O)(=O)NNC(=O)c2sc(-c3ccccc3)nc2C)cn1	743251001	MRQVRWBPGGOJPI-UHFFFAOYSA-N	435.487	1.111	50	20	IDGD	
COc1cc(OC)cc(C(=O)N2CCC(C(=O)NNc3ncnc4[nH]cnc34)CC2)c1	743471429	HEFXVLFNMLPVLN-UHFFFAOYSA-N	425.449	1.366	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)[C@@H]2CCCN(C(=O)Cc3ccccc3)C2)cc1	744701011	MZAGFOUZJXEQAQ-HXUWFJFHSA-N	448.479	1.344	50	20	IDGD	
COc1cc(C=NNC(=O)C(=O)Nc2ccc(C)c(C)c2)cc(Cl)c1OCC(N)=O	745987023	VOLFILCJZVUMPY-UHFFFAOYSA-N	432.864	1.918	50	20	IDGD	
O=C(NNC(=O)[C@H]1CS[C@@H](Cc2ccccc2F)C(=O)N1)c1cccc2cccnc12	747425304	FOXZKMVKRHHJSQ-MSOLQXFVSA-N	438.484	1.978	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNS(=O)(=O)c1ccc(C(=O)CCC(=O)O)cc1	751203923	YZMUCUVAFQSVFW-UHFFFAOYSA-N	430.442	1.314	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2ccc(F)c(NS(C)(=O)=O)c2)c2ccccc2c1=O	751292893	CTEASGVOVGAIAD-UHFFFAOYSA-N	447.448	1.002	50	20	IDGD	
Cc1nc(Cl)ccc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	751539078	OYVFBVQCVLYBHP-UHFFFAOYSA-N	438.893	1.139	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)N[C@@H]2CC(=O)N(c3cccc(C(F)(F)F)c3)C2)n1	753034172	CYSNAAXVVDOOMY-CQSZACIVSA-N	438.410	1.655	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@H]2CCCCS2)c1	753259772	DACOSMRYUDKUGH-OAHLLOKOSA-N	428.580	1.947	50	20	IDGD	
Cc1oc(C(=O)NNC(=O)c2ccc(Br)s2)cc1S(=O)(=O)N(C)C	753565846	LBNDUWSFLHFRJL-UHFFFAOYSA-N	436.309	1.737	50	20	IDGD	
C[C@@H](NCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	754319180	PMTLPFPEAXRYOU-GDBMZVCRSA-N	449.508	1.981	50	20	IDGD	
O=C(NNc1nc(C(F)(F)F)cs1)c1ccc(S(=O)(=O)N2CCOCC2)o1	755858535	XZNJTJDEBVKFDU-UHFFFAOYSA-N	426.398	1.533	50	20	IDGD	
COc1cc(CN2CC[C@H](NC(=O)NNC(=O)c3cccc(N(C)C)c3)C2)cc(OC)c1	756098331	CMNCMLNNEKCORI-SFHVURJKSA-N	441.532	1.988	50	20	IDGD	
COC(=O)CCSCc1cccc(NC(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)c1	756393602	OMMFAVKKPPYNCQ-ZDUSSCGKSA-N	429.520	1.070	50	20	IDGD	
CN(C)N(C(=O)c1cn(-c2ccc(Br)cc2)cn1)[C@@H]1CCS(=O)(=O)C1	756502703	GZLOYXYOOGDBFB-CQSZACIVSA-N	427.324	1.741	50	20	IDGD	
NC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)NNC(=O)C12CC3CC(CC(C3)C1)C2	756774101	FPQNZIVWLFJBMB-WMVQRKQLSA-N	442.516	1.521	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)Nc2ccc(F)cc2CS(C)(=O)=O)c2ccccc2c1=O	757678914	QXEQLLZNGRREAT-UHFFFAOYSA-N	447.448	1.084	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)Cc2ccc(Br)cc2)n1	758038501	XIOUPCKBPLJNCK-UHFFFAOYSA-N	426.292	1.690	50	20	IDGD	
O=C(CN1c2cccc3cccc(c23)S1(=O)=O)NNC(=S)NC[C@H]1CCCCO1	758180508	LNZGPVBJWSABRX-CQSZACIVSA-N	434.543	1.413	50	20	IDGD	
CCc1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)c(C)nn1	758998787	XXOQHKOZWFJAOK-UHFFFAOYSA-N	431.518	1.597	50	20	IDGD	
COc1ccc2c(c1)OC[C@@H]2CC(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	760620639	WLSQKCDUOAJGOU-ORAYPTAESA-N	442.424	1.092	50	20	IDGD	
CCC(=O)NNC(=O)C(=O)Nc1ccc(I)cc1Br	763437767	GPHIKCXLTFDWIZ-UHFFFAOYSA-N	440.035	1.550	50	20	IDGD	
CNC(=O)c1ccc(C)c(NC(=O)C(=O)NNC(=O)c2ccccc2Br)c1	763482300	GGFZJCCDKFSVHR-UHFFFAOYSA-N	433.262	1.517	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)C(=O)Nc1ccccc1F	763511411	CUHPJJLUJXIBHZ-UHFFFAOYSA-N	448.476	1.400	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)Nc1cccc(C(=O)c2ccccc2)c1	763569777	BOTNBGYERJXVCD-FQEVSTJZSA-N	445.431	1.844	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)Nc1cc(C(F)(F)F)ccc1F	763572728	OERGMPFSWHOAKR-AWEZNQCLSA-N	427.310	1.770	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)Nc1ccc2c(c1)OC1(CCCC1)O2	763573879	VTRDHPWOEXUHRW-SFHVURJKSA-N	439.424	1.654	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)COc2cc(C)ccc2C)cc1	763666037	VBWGAKBNWXJXKO-UHFFFAOYSA-N	429.429	1.020	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(C(=O)NC3CCCC3)cc2)cc1	763679288	LZAKHDZPQKDLAR-UHFFFAOYSA-N	449.467	1.396	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)C(=O)Nc1ccc([S@](=O)C(F)(F)F)cc1	763682204	ZBYVQAYXNGTDTG-PMERELPUSA-N	447.366	1.618	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(Br)cc2)cc1F	763696265	VRTYYLFZEQBDHP-UHFFFAOYSA-N	440.225	1.762	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2nnc(O)c3ccccc23)c2cccnc2c1C	763790291	HMKRUMGMZXXUEE-UHFFFAOYSA-N	430.424	1.900	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CNC(=O)c2cccnc2)ccc1OCc1cscn1	763820697	PPJJRIAYDXOAFW-UHFFFAOYSA-N	441.469	1.317	50	20	IDGD	
CCOc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NNC(=O)c1ccc(CC)cc1	763831593	PJAOUTIPNWTNSK-UHFFFAOYSA-N	426.473	1.749	50	20	IDGD	
COC(=O)c1cc2cc(NC(=O)C(=O)NNC(=O)COc3ccc(F)cc3)ccc2o1	763839330	JOJQQZOPBPSWQB-UHFFFAOYSA-N	429.360	1.523	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(NC(=O)OC)cc2)cc1	763862252	WTURRDHZJHZQIM-CYBMUJFWSA-N	444.444	1.817	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1cncc(Br)c1	763872028	JPCBEVMBLPPVPE-SECBINFHSA-N	425.214	1.537	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)c(OCCN(C)C)c1	763976544	ANNURYBFUSMIGT-UHFFFAOYSA-N	434.880	1.694	50	20	IDGD	
Cc1ccn(-c2ccccc2NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)n1	763994177	AWJXNKBCEQEBMQ-UHFFFAOYSA-N	431.250	1.671	50	20	IDGD	
O=C(NNC(=O)c1cccc(Br)c1)C(=O)Nc1cnn(Cc2ccncc2)c1	764063045	JPURAQUFLMBRIH-UHFFFAOYSA-N	443.261	1.489	50	20	IDGD	
O=C(NNC(=O)c1cccc(Br)c1)C(=O)Nc1ccc(-n2ccnc2)nc1	764063240	LSVLPXOGEIURIY-UHFFFAOYSA-N	429.234	1.430	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2cccc(C(=O)N3CCCCC3)c2)c1O	764131267	JNKJFNGTRINENS-UHFFFAOYSA-N	440.456	1.427	50	20	IDGD	
CC(C)(C(=O)NNC(=O)C(=O)Nc1ccc(CN2C(=O)CCC2=O)cc1)c1ccccc1	764309133	MHYZKRHACKDWQR-UHFFFAOYSA-N	436.468	1.399	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)C(C)(C)c2ccccc2)c(C)c1	764310070	YQKPQDKGVKTAGF-UHFFFAOYSA-N	427.457	1.611	50	20	IDGD	
Cc1cc(C(=O)NCC(C)C)ccc1NC(=O)C(=O)NNC(=O)Cc1ccccc1F	764312899	BZMBDHKHDNIYPT-UHFFFAOYSA-N	428.464	1.849	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)cnc1Br	764349618	RAWARLYCQUDDEI-UHFFFAOYSA-N	427.642	1.911	50	20	IDGD	
O=C1CCc2cc(NC(=O)C(=O)NNC(=O)c3cc(-c4ccc(F)cc4)[nH]n3)ccc2N1	764388466	SIHXVQQNGGHMRY-UHFFFAOYSA-N	436.403	1.500	50	20	IDGD	
COCCOc1ncccc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	764389079	YDUSADLTUYTOHF-UHFFFAOYSA-N	442.407	1.036	50	20	IDGD	
COC(=O)c1csc(NC(=O)C(=O)NNC(=O)CSc2ccccc2OC)c1C	764392622	IPFZRQWZFMSIQD-UHFFFAOYSA-N	437.499	1.730	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1cccc(C#N)c1)C(=O)NNC(=O)Cc1c[nH]c2ccccc12	764551085	CBTWWMNFHHYJOP-CYBMUJFWSA-N	425.470	1.096	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)NCc2ccc(N3CCCS3(=O)=O)cc2)cc1	764779360	OXAUXFGDZNZZMK-UHFFFAOYSA-N	443.485	1.008	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cc4ccccc4oc3=O)CC2)cc1	765749445	NULBHOPFRXKPFM-UHFFFAOYSA-N	434.496	1.680	50	20	IDGD	
O=C(NNC(=O)c1ccc(N2C(=O)CCC2=O)c([N+](=O)[O-])c1)c1ccc2c(c1)OCCO2	766373876	KQJZEFYLPBFOAE-UHFFFAOYSA-N	440.368	1.094	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)[C@H]1CCN(C2CCCCC2)C1	766644976	XYCOXVJPJYSSEA-FQEVSTJZSA-N	441.576	1.246	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)C[C@H]1CN(C(=O)OC(C)(C)C)CCO1	767488082	IPOURPQIWMHUPP-KRWDZBQOSA-N	449.504	1.254	50	20	IDGD	
CCOC1CC(CNC(=O)NNC(=O)CSc2ccccc2O)(N2CCOCC2)C1	767888715	UZODOBDGGSLBPX-UHFFFAOYSA-N	438.550	1.085	50	20	IDGD	
COc1ccc(CN2CCCN(CC(=O)NNC(=O)c3ccc(F)cc3)CC2=O)cc1	767931510	MRHYSKILCLWINU-UHFFFAOYSA-N	428.464	1.330	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)c1cnn(CC(=O)NC2CCCC2)c1	768630421	YMYHRKBTKBQFLB-UHFFFAOYSA-N	435.506	1.111	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NC[C@H]2[C@H]3c4ccccc4C[C@H]32)cc1	769151922	QYPBYWCFIZHORP-ZVDOUQERSA-N	442.541	1.532	50	20	IDGD	
Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	769886935	HVBXUAPCPKQVDL-INIZCTEOSA-N	443.412	1.664	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)N1CCN(c2nccnc2C#N)C[C@@H]1C	770647517	MQVGAXDLVMJRMC-KBPBESRZSA-N	443.895	1.720	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2c(C)cccc2F)cc1S(=O)(=O)NC1CC1	770816062	QRYRPICXZGROCV-UHFFFAOYSA-N	436.465	1.665	50	20	IDGD	
CC(C)c1[nH]nc(C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)c1[N+](=O)[O-]	771230946	XKHMAKVKMQWIRZ-UHFFFAOYSA-N	427.421	1.807	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)COc1ccc(Br)cc1C=O	772014078	TZOQOMYBQJFRDG-NSHDSACASA-N	429.267	1.766	50	20	IDGD	
C[C@@H]1C[C@@H](NC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)CCN1C(=O)OC(C)(C)C	772466246	XZLIMVLEUKSCKS-KEYYUXOJSA-N	434.493	1.945	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)c1cc(C(N)=O)n(-c2ccccc2)n1	772963350	IWLKRGDEECCUIX-LBPRGKRZSA-N	427.848	1.853	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)NCc2ccc(S(N)(=O)=O)cc2C)c1	775203088	RPDSBZJDXIYPJW-UHFFFAOYSA-N	448.545	1.984	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@@H]2CCCO[C@H]2CC(C)C)cc1	776259897	SYWUZKSLEXZPFP-MSOLQXFVSA-N	440.566	1.540	50	20	IDGD	
O=C(Cc1n[nH]c2c1CCCC2)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	777230608	GPOPSQDEVYWRPW-UHFFFAOYSA-N	431.518	1.077	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc(Cl)cc(C(F)(F)F)c1)N[C@@H]1CCS(=O)(=O)C1	777614878	TZXFMHDQHKBALX-SECBINFHSA-N	435.833	1.038	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)Cc1csc(NC(=O)c2cccc(O)c2)n1	778440445	GWNLPUBUJZERCV-UHFFFAOYSA-N	449.489	1.316	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N[C@@H]2C[C@H](O)C2(C)C)cc1	779228362	AGCGIZUGCVQZHC-MFJAVSIHSA-N	437.500	1.617	50	20	IDGD	
Cc1cnc(C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)c(C)c1	779719609	LZDJENDCCUTCBX-UHFFFAOYSA-N	446.529	1.113	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(NC(=O)c2ccncc2)cc1)c1ccc([N+](=O)[O-])cc1	779825230	PNYKRWBHMPVGGN-UHFFFAOYSA-N	441.425	1.865	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)c2c[nH]ccc2=NC(=O)OC(C)(C)C)c2ccccc2c1=O	780170665	ATNKHVBZWJIEKT-UHFFFAOYSA-N	438.444	1.172	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@]2(C[C@H]2C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)C1	780347889	PPFQXNSANUJHBW-YWZLYKJASA-N	437.518	1.498	50	20	IDGD	
CCO[C@@H]1C[C@@](NC(=O)OC(C)(C)C)(C(=O)NNC(=O)C(=O)Nc2ccccn2)C1(C)C	780896612	KVILBQTXFSIJDZ-LRTDBIEQSA-N	449.508	1.266	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)nc1Br	781929398	HZIHEVQXYBZMNZ-UHFFFAOYSA-N	432.234	1.174	50	20	IDGD	
CN1CCN(c2ccc(NC(=O)C(=O)NNC(=O)c3ccc(O)cc3)cc2Cl)CC1	782831229	AEKXPHVIHDGZKX-UHFFFAOYSA-N	431.880	1.197	50	20	IDGD	
O=C(Cn1cc(NC(=O)C(=O)NNc2ncc(C(F)(F)F)cc2Cl)cn1)NC1CC1	782853519	SUPZLJXPDLGCEL-UHFFFAOYSA-N	445.789	1.311	50	20	IDGD	
COC(=O)Nc1cc(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)ccc1F	782894152	NFHGATYGPUSPAK-UHFFFAOYSA-N	442.407	1.219	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2cccc(COCCc3ccccc3)c2)CCS(=O)(=O)C1	783423947	BRCWPTMMFMZOFE-QFIPXVFZSA-N	445.541	1.582	50	20	IDGD	
Cc1cccc(Oc2ncccc2NC(=O)C(=O)NNC(=O)C(=O)N2CCCC2)c1C	783999293	DINQMVHIWSHADP-UHFFFAOYSA-N	425.445	1.199	50	20	IDGD	
CC(C)CCNS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2nccnc2Cl)cc1	784776612	ORHIAPQKDJWLJO-UHFFFAOYSA-N	440.913	1.536	50	20	IDGD	
COc1cc(OC)c(OC)cc1NC(=O)C(=O)NNc1ccc(Br)nc1	784809960	WMLBDCFJDWSTIB-UHFFFAOYSA-N	425.239	1.952	50	20	IDGD	
COCCS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2cc(F)c(F)c(F)c2)cc1	785083083	DPTBBDAGOISHHD-UHFFFAOYSA-N	431.392	1.606	50	20	IDGD	
CS(=O)(=O)c1cc(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)ccc1F	785683020	YOZDPIIDXNXSSK-UHFFFAOYSA-N	448.520	1.203	50	20	IDGD	
CCC(O)(CC)CCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	788324233	NIAKNSHXMYZCOR-UHFFFAOYSA-N	426.539	1.356	50	20	IDGD	
CC(C)(C)OC(=O)N1CC2(C[C@@H]2C(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)C1	789191399	GODKKHBABKYDHW-CQSZACIVSA-N	438.506	1.500	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccc3c2OCC[C@@H]3N(C)C)cc1	789733303	YYBNRSJGWWUGFD-SFHVURJKSA-N	426.473	1.545	50	20	IDGD	
O=C1CCc2cc(NC(=O)C(=O)NNC(=O)[C@H]3OCC[C@H]3c3ccccc3)c(F)cc2N1	789810002	JXGJXUABJNJQAB-LIRRHRJNSA-N	440.431	1.369	50	20	IDGD	
O=C(NNC(=O)[C@H]1OCC[C@H]1c1ccccc1)C(=O)Nc1ccn(Cc2ccccc2)n1	789812733	NJAYTRMLVSHOQQ-ICSRJNTNSA-N	433.468	1.590	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1ccc(O[C@@H]2CCOC2)cc1	789971500	UKTUDQVONFFQBD-GOSISDBHSA-N	447.513	1.632	50	20	IDGD	
Cn1cncc1CCC(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	790069960	HXHSCIGFFLMMAT-UHFFFAOYSA-N	430.472	1.516	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@H]2CCS(=O)(=O)c3ccccc32)cc1	791049898	SJOBASMUKCJIOD-HNNXBMFYSA-N	437.499	1.204	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)[C@H]1CC(c2cc(OC)ccc2OC)=NO1	791445838	SPVUYNVAGMFBCZ-HXUWFJFHSA-N	443.456	1.822	50	20	IDGD	
C[C@@](O)(Cn1cc(C(F)(F)F)ccc1=O)C(=O)NNC(=O)NCc1ccc(Cl)cc1	792474502	GQFGEAGYYWOTKK-QGZVFWFLSA-N	446.813	1.802	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)Cc2ccc(S(=O)(=O)N(C)C)cc2)c1C	792810224	USJXYIVZJFWQRK-MRXNPFEDSA-N	433.530	1.711	50	20	IDGD	
COc1cc(C)cc(NC(=O)C(=O)NNC(=O)CNC(=O)OCc2ccccc2)c1C	797369440	XDLBALMCZONPBT-UHFFFAOYSA-N	428.445	1.324	50	20	IDGD	
C[S@@](=O)c1ccc(CC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1	797788625	QDSUUOQSXAUYNN-SSEXGKCCSA-N	428.558	1.326	50	20	IDGD	
O=C(NCCS(=O)(=O)CCc1ccccc1)NNC(=O)c1cccc(OC(F)F)c1	799917641	ZMULJVOKGUHNQY-UHFFFAOYSA-N	441.456	1.890	50	20	IDGD	
O=C(NNC(=O)c1nc2cccnc2s1)c1cccc(S(=O)(=O)N2CCCCC2)c1	801102292	JTXGGVQVYPYUKE-UHFFFAOYSA-N	445.526	1.941	50	20	IDGD	
Cc1nn(C)c(Br)c1C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	801148453	ZMGBVBUWWNUIHM-UHFFFAOYSA-N	428.312	1.689	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1)Nc1ccccc1	801991069	CMDNESYREJBLGK-AWEZNQCLSA-N	447.473	1.848	50	20	IDGD	
O=C(N=c1cc[nH]cc1)NNC(=O)C1CCN(S(=O)(=O)c2cc(F)ccc2F)CC1	802030794	RWCJTQOXEGCKKJ-UHFFFAOYSA-N	439.444	1.035	50	20	IDGD	
O=C(CCS(=O)(=O)c1ccc2c(c1)OCCCO2)NNc1ccc(-n2ccnc2)nn1	804951993	CZDAUESNBVAPEW-UHFFFAOYSA-N	444.473	1.131	50	20	IDGD	
COc1ccc(C(=O)CCC(=O)NNc2ccc(-n3ccnc3)nn2)c(OC)c1OC	804957774	APPWDSZMAFNIGZ-UHFFFAOYSA-N	426.433	1.794	50	20	IDGD	
CN(C)S(=O)(=O)C[C@@H](NC(=O)NNc1ccnc(Br)c1)C(F)(F)F	806565598	PRCNCQHCBDKTMI-MRVPVSSYSA-N	434.238	1.293	50	20	IDGD	
COc1ccc(CS(C)(=O)=O)cc1NC(=O)C(=O)NNC(=O)CCC1CCCCC1	806977867	BZHZSNMGYJJWNR-UHFFFAOYSA-N	439.534	1.686	50	20	IDGD	
O=C(CCc1ccccc1)NNC(=O)C(=O)Nc1ccc(F)c(N2C(=O)CCC2=O)c1	806977954	GFTPIBQJYVBIBP-UHFFFAOYSA-N	426.404	1.198	50	20	IDGD	
COc1cc(F)cc(NNC(=O)C(=O)N2C[C@@H](C[C@@H]3COCC(=O)N3)c3ccccc32)c1	807025813	WKETWBRJIFXZDN-CZUORRHYSA-N	442.447	1.313	50	20	IDGD	
CN1CCC/C1=N\S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2cccc(F)n2)cc1	807392882	NEJCXQVHLWLMGP-LFVJCYFKSA-N	434.453	1.115	50	20	IDGD	
O=C(NCc1cnn2ccccc12)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	807462464	BKCZUTINSMSOQA-UHFFFAOYSA-N	442.501	1.263	50	20	IDGD	
CCCNS(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)c2cc3c(s2)CCC3)cc1	808068984	LLBCHZRGIUNQQW-UHFFFAOYSA-N	443.572	1.548	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)c2cc(CN3CCCC3)on2)CC1	813457164	ZRTMLGGVKVGGSZ-UHFFFAOYSA-N	436.513	1.614	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCc2nncn2C1)C(=O)Nc1ccc(C(F)(F)F)cc1Cl	815691392	OVFYRLNLSMAHTP-QMMMGPOBSA-N	430.774	1.299	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)Cn1nnc(-c2ccc(Cl)cc2)n1	817053986	OJTNAZCCQIXOEH-UHFFFAOYSA-N	435.897	1.387	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)c2cccc(CS(N)(=O)=O)c2)c1	818762880	GANAEASDVCHSPG-UHFFFAOYSA-N	442.291	1.781	50	20	IDGD	
COc1cc(S(=O)(=O)N2CCOCC2)cc(C(=O)NNc2ccccc2C)c1OC	865536549	BYBLZBZLJRNULE-UHFFFAOYSA-N	435.502	1.790	50	20	IDGD	
COCCCNC(=S)N(C)NC(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc(C)s1	899890021	DBULLNZJWHBIJE-ZDUSSCGKSA-N	434.609	1.084	50	20	IDGD	
CN(C)c1nc(N)nc(COC(=O)/C(C#N)=C\c2cn(CCC#N)nc2-c2ccccc2)n1	913215945	DZZPVDITAYEKCU-WJDWOHSUSA-N	443.471	1.947	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N[C@H](CCSC)C(=O)NNC(=O)C2CCCC2)cc1	914849126	POUNGYPWUPUZOR-QGZVFWFLSA-N	443.591	1.823	50	20	IDGD	
CCN(CC)[C@@H](CNC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)c1ccsc1	916436910	KXTUEOMNXFOXQZ-KRWDZBQOSA-N	428.522	1.751	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCCC(=O)N1CCCCC1	916438006	UJTLXQHIMQFFQS-ZDUSSCGKSA-N	441.326	1.949	50	20	IDGD	
COc1ccc(OC)c([C@H](O)CNC(=O)NNC(=O)c2cc(Br)c[nH]2)c1	916473411	GYNSCKLMMUXIQF-CYBMUJFWSA-N	427.255	1.472	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2ccc(Cl)cc2)cc1	916650045	YXGXOMANCYXIHI-UHFFFAOYSA-N	440.909	1.409	50	20	IDGD	
COc1cc(C=NNC(=O)[C@@H]2CCS(=O)(=O)C2)cc(Br)c1OC(F)F	917544908	OBWPQQLMVNKFOP-SECBINFHSA-N	441.250	1.944	50	20	IDGD	
O=C(Cc1csc(N2CCOCC2)n1)NN=Cc1cc(Cl)cc([N+](=O)[O-])c1O	917565042	RKVMLOOSBWBOFD-UHFFFAOYSA-N	425.854	1.940	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)N1CCN(C(=O)N(C)Cc2ccccc2)CC1	918776756	ZHDGGINYXSXWQL-UHFFFAOYSA-N	449.515	1.867	50	20	IDGD	
CSCC[C@H](NC(=O)c1ccc([N+](=O)[O-])o1)C(=O)NNC(=O)c1ccc(Cl)nc1	919814739	OUFRIMQWOAZIKH-JTQLQIEISA-N	441.853	1.549	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)ccc1OCc1cccnc1	919887123	XMCILRHCRQHVML-INIZCTEOSA-N	448.501	1.190	50	20	IDGD	
Cc1ccc(C)n1-c1ccc(C(=O)NNC(=O)N[C@H]2CCCN(S(C)(=O)=O)C2)cc1	920238720	JODFFIDDBBAARX-KRWDZBQOSA-N	433.534	1.462	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NN=Cc2ccccc2OCC(=O)N(C)C)cc1	920364637	HLRWAHZQPMUJSP-UHFFFAOYSA-N	446.529	1.233	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2cccc(CN(C)C)c2)cc1	920931293	JWANGFQLTZCEPV-UHFFFAOYSA-N	433.534	1.530	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)ccc1N1CCCC1=O	1116582143	CDJBTAAXXLMSOA-UHFFFAOYSA-N	430.486	1.992	50	20	IDGD	
COc1cccc(C[C@H](O)C(=O)NNC(=O)[C@H](C)Oc2cccc(Br)c2)c1	1320740177	RGXKZEKKWRQIGW-SJCJKPOMSA-N	437.290	1.976	50	20	IDGD	
CS(=O)(=O)Cc1nc2ccccc2n1CC(=O)NNc1ccc2c(=O)[nH]ccc2c1	1322511816	HPTCAGAAACJRCA-UHFFFAOYSA-N	425.470	1.566	50	20	IDGD	
Cc1ccc(NC(=O)N(C)C)c(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1	1339760202	LRBAOEPAYDLATC-UHFFFAOYSA-N	447.517	1.414	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnn4ccncc34)C2)C1	1777985608	AVBKLLWEZAPECG-KDOFPFPSSA-N	436.310	1.346	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3nc4cc(C)c(C)cc4[nH]3)C2)C1	1778925870	CJRCQRJYOCHTJK-QVKFZJNVSA-N	434.924	1.877	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCBr)C2)c1ccc(O)nc1	1780125646	YFEHXTYKQXJUJY-RDTXWAMCSA-N	426.311	1.700	50	20	IDGD	
COc1cc(C#N)cc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)c1	1780175468	JWGBRJVJZLXCRT-DJJJIMSYSA-N	436.306	1.794	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CNC(=O)c1cc(C)on1)C2	1780704881	WQBPDJDFTJVACI-AKCHCHLHSA-N	440.928	1.244	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](CCN)NC(=O)OC(C)(C)C)CCO2	1781213928	VYQLQRGZCACNCR-STXHMFSFSA-N	446.976	1.076	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cnc(-c4ccccn4)nc3)CCO2)C1	1781214314	TZEJNZOJXQXZCP-HRAATJIYSA-N	429.908	2.000	50	20	IDGD	
O=C(c1ccc2nn[nH]c2c1)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781335223	WGYJYRYKYOMRLF-XJKSGUPXSA-N	426.246	1.092	50	20	IDGD	
Cc1cc(C)n2ccc(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)[C@@H](O)CCl)C4)c2n1	1781436164	IZKCLOSQBRDKEG-NJNPRVFISA-N	448.951	1.678	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3c(O)cc(O)cc3O)C2)C1	1781814845	UXZITHZUUGGDEP-ZWKOTPCHSA-N	433.288	1.483	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)Cn1ccnc1)C2	1782178497	NEZDAHVJVVCQRP-MIALQEHNSA-N	426.945	1.287	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)C3CCC4(CC3)OCCO4)C2)C1	1782943916	FAXXWWKTUMLSMQ-MOPGFXCFSA-N	449.375	1.986	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cc(Cl)ncn3)CCO2)C1	1783353546	XMPZAPMEHNDZOX-BDJLRTHQSA-N	431.718	1.747	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc4nn(C)cc4c3)CCO2)C1	1783536276	ILUOHLSNQAIUEE-DJJJIMSYSA-N	435.322	1.800	50	20	IDGD	
CC(=O)N[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)C(C)(C)C	1784315488	UOHNWMDJECDNME-JKQORVJESA-N	446.386	1.302	50	20	IDGD	
N#Cc1ccccc1OCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1785379824	VFAGXZWWQZCIED-SJLPKXTDSA-N	440.269	1.457	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3c(F)ccnc3Cl)[C@H]2C1	1785483514	YVAZWZZUIZGZIC-FMSGJZPZSA-N	434.295	1.721	50	20	IDGD	
CN(C)c1ncc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCBr)[C@H]3C2)o1	1786404126	BJGOJJMGAFLGSN-AVGNSLFASA-N	429.315	1.119	50	20	IDGD	
Cn1ccc(CC(=O)NC2(c3ccc(NC(=O)c4ccc(B(O)O)cc4)cc3)CCC2)n1	1788140767	USMVEEDOGIUPNC-UHFFFAOYSA-N	432.289	1.090	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc4n(n3)CCCO4)[C@H]2C1	1788351108	ADMYJQWPJAUJEX-ZOBUZTSGSA-N	436.585	1.110	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccn4ccnc4c3)[C@H]2C1	1788359342	DZLQZMPBVXQHAW-BZSNNMDCSA-N	430.581	1.779	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C=N/O[C@@H]3CCCCO3)[C@H]2C1	1788652373	CIKZGBZKHRPAFO-VROHHENTSA-N	429.945	1.903	50	20	IDGD	
CCn1nccc1C(=O)NC1(c2ccc(NC(=O)c3cnccc3C(=O)NN)cc2)CCC1	1789521203	LYGBAZRJTIGCKB-UHFFFAOYSA-N	447.499	1.963	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)n3ccnc3C)C[C@@H]21	1790963971	QIZLIYXYEHVNJK-GWFJUFKTSA-N	441.370	1.906	50	20	IDGD	
COC(=O)C12CC(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)[C@H](C)Br)C[C@@H]43)(C1)C2	1791019375	FDKJJNHMLYGHFU-MQGLGVLZSA-N	443.338	1.093	50	20	IDGD	
C[C@H]1CCc2c(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]4C3)n[nH]c21	1791055974	LBSBZOCQANBECN-XXUMUBMXSA-N	439.354	1.836	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3(C(F)(F)F)CCC3)C[C@@H]21	1791251874	YNZUPLCFGMZFQD-XUXIUFHCSA-N	426.863	1.953	50	20	IDGD	
C[C@H]1CC[C@@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Cl)C3)N1C(=O)OC(C)(C)C	1792429350	JHIXLBRLRJOKFS-IATJYDTKSA-N	447.935	1.898	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccnc(Cl)c1)C2	1792869927	DMMQNFTZJDIBPM-DNVSUFBTSA-N	430.730	1.969	50	20	IDGD	
CC(=O)N[C@@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCl)c1ccc(F)cc1	1793115372	LRPLWASDMYYWEQ-FLXSYLCISA-N	425.888	1.241	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CS(=O)(=O)c1ccc(C)cc1	1795323787	UWKZLCKPQVKTOC-LORHWOILSA-N	442.965	1.376	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1[nH]nc2ncccc12	1796663140	GLSISWATEMACIE-SSJPOKSSSA-N	448.487	1.344	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1noc3ccccc13)C2	1797954897	QKWFCHPMEDCVLI-USGNIVHTSA-N	431.565	1.811	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(Cl)cnc1O)C2	1799273256	AAOWMTFMLCUEBT-ZYYNGRNUSA-N	436.723	1.880	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CNC(=O)c1cccnc1)C2	1800078038	RMJMXJIHWUHDKR-NXEZDXNNSA-N	427.332	1.686	50	20	IDGD	
COC(=O)Nc1cccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C(Cl)Cl)c1	1801017338	NGTYBQURHUJODJ-DABQJJPHSA-N	430.288	1.872	50	20	IDGD	
COC[C@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCN1Cc3ccccc3C1=O)C2	1802273250	MTTWHEFPOCUFGI-ZMMAXQRCSA-N	433.936	1.925	50	20	IDGD	
CCOC(=O)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](F)Cl)C2	1804300960	RTFRUTLNYMNXIY-ZUWCUPBKSA-N	449.907	1.615	50	20	IDGD	
O=C(c1cc(=O)nc2sccn12)N1CCC2(CCCN(C(=O)[C@H](O)CCl)C2)CC1	1805523167	QOKRLBDQSDQIQL-CQSZACIVSA-N	438.937	1.201	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccsc2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807365602	ZELJTVZSESFBOB-FXAWDEMLSA-N	435.314	1.456	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC2(CCCN(C(=O)c3ccnc(Cl)c3)C2)CC1	1808359267	PCICNNYRAUBKRP-UHFFFAOYSA-N	435.956	1.953	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)c2cc(CO)on2)[C@H]1c1cccnc1	1812866396	FHUMUGUISPZOAG-RBOXIYTFSA-N	437.294	1.665	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)[C@@H]2CCCCO2)[C@@H]1c1cccnc1	1813068359	LKJZZHRVWHEURJ-BBTUJRGHSA-N	431.537	1.030	50	20	IDGD	
Cc1[nH]ccc1C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1813071642	VIWGEHXNZUYYPW-UTKZUKDTSA-N	426.521	1.411	50	20	IDGD	
CCc1cc(C(=O)N2CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)no1	1813074047	QMWRXQUEHPSPTC-IERDGZPVSA-N	442.520	1.325	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CCN2CCOCC2)[C@@H]1c1cccnc1)C(Cl)Cl	1813076371	PSCSUIAWAGKLNA-DOTOQJQBSA-N	429.348	1.613	50	20	IDGD	
CC(C)(CCl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](O)N2CCOCC2)[nH]n1	1814697214	SGQDDXAIKRZSRJ-HOCLYGCPSA-N	427.933	1.317	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H]2C[C@H]2C2CC2)n[nH]1	1814759185	JISIZAMHORACBT-HDMKZQKVSA-N	437.504	1.760	50	20	IDGD	
O=C(CCc1ccc[nH]1)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2	1815468655	FPBHYFSCQSGLAC-INIZCTEOSA-N	438.318	1.010	50	20	IDGD	
Cc1noc(CC(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@H](C)Br)CC3)n1	1815567675	VLJARBJDOHVDII-CBAPKCEASA-N	428.312	1.773	50	20	IDGD	
CC(C)O[C@H](C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1	1817472326	QNKGAWYPPCQQNP-KDOFPFPSSA-N	428.298	1.209	50	20	IDGD	
CC(=O)N1CCN(CC(=O)N2CCCC[C@H]2c2cc(NC(=O)[C@@H](F)Cl)n[nH]2)CC1	1818039358	RWULLNIWPSUZAP-WMLDXEAASA-N	428.896	1.100	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)CCl)CC2	1818081070	JOCWVQLOOYRZED-YPMHNXCESA-N	433.921	1.925	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)CN2C(=O)C=CC2=O)[nH]n1)[C@@H](F)Br	1820938491	WHJIVAVUVPVYAX-ZUZCIYMTSA-N	442.245	1.017	50	20	IDGD	
CN1C(=O)CC[C@H]1C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](F)Br)n[nH]1	1820939395	HVRAUBGOPCLMQS-COPLHBTASA-N	430.278	1.713	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H]2CCCCN2C)[nH]n1	1822412162	KVRQBINAOPWIOV-IAGOWNOFSA-N	433.557	1.259	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H]2CCCOC2)n[nH]1	1823468656	BWJLYPIZALJFGU-CXAGYDPISA-N	441.492	1.141	50	20	IDGD	
CC(=O)N[C@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H](O)CCl)CC1)C(C)(C)C	1824179555	TYVYXFNVUHKUPR-RCCFBDPRSA-N	429.989	1.757	50	20	IDGD	
CC(=O)NCCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](C)CBr)CC2	1825232367	NUNLNJUZSRKTKR-KOLCDFICSA-N	431.356	1.612	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H]1CCC(=O)N1C)CC2	1825452024	UXPRDBXVXKPILI-SCVCMEIPSA-N	443.367	1.849	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)C(C)(C)CNC(C)=O)CC2	1825993781	FLOIUXBRHRZTLV-NEPJUHHUSA-N	430.958	1.471	50	20	IDGD	
CNc1ccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)cc1	1826849877	CMLORVRIVXMBPB-QHCPKHFHSA-N	449.360	1.955	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)CCCn3cccc3)sc2C1	1826930001	SHHFMUFUDKSPJE-OAHLLOKOSA-N	446.577	1.710	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)C[C@@H]2NC(=O)NC2=O)CC1	1829097217	DDUHCHZROOMYLC-JKSUJKDBSA-N	438.601	1.056	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc([N+](=O)[O-])o3)CCO2)C1	1829481106	HZBULAHOGMJBFQ-FZKQIMNGSA-N	429.857	1.665	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(F)nc3F)CCO2)C1	1829525437	RWBWYZTVNKSOOU-IBGZPJMESA-N	431.867	1.695	50	20	IDGD	
COc1ccnc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)[C@@H](O)CCl)CC2)c1OC	1829852760	DMOHUGAIXAMPGF-HOTGVXAUSA-N	439.940	1.932	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)C34CC(F)(C3)C4)C2)C1	1830535602	QSJAKNVKQDOFMR-BQPQTXTPSA-N	433.318	1.366	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)nc2ccccc12	1830728567	UZDSRDLLKAWLGO-KNQAVFIVSA-N	447.919	1.213	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C1(COC)CC1)CCO2	1831382986	KPSZSJBLRCGINX-KBXCAEBGSA-N	433.343	1.043	50	20	IDGD	
C[C@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1)n1cccc1	1832108250	MRVIDAFUMUQWIX-XMSQKQJNSA-N	437.349	1.662	50	20	IDGD	
C[C@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@H](F)Br)CC1)n1cnnn1	1832293695	LGFMSIYUUXAPND-XBFCOCLRSA-N	431.310	1.544	50	20	IDGD	
C[C@@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)[C@H](O)C(C)(C)C)CC2)CC1	1833264501	DCTHNMXBRMQTJP-YOEHRIQHSA-N	446.430	1.996	50	20	IDGD	
CCC(=O)N[C@@H](C)C(=O)NC1CCN(C2CCN(C(=O)[C@@](C)(Cl)CCl)CC2)CC1	1833422382	XVPCRPTXRMOLRR-XOBRGWDASA-N	449.423	1.709	50	20	IDGD	
CCc1nn(C)c(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](Cl)CC)C3)C2)c1Cl	1833595928	KOHFOOIYEGMLNC-YJYMSZOUSA-N	447.363	1.723	50	20	IDGD	
Cc1nscc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)Br)C2)C1	1833748707	IMDOMBDOYWUEIS-ZBEGNZNMSA-N	432.340	1.305	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccccc3O)CCO2)C1	1833759068	WHLCWHACLJXTMA-BEFAXECRSA-N	441.322	1.636	50	20	IDGD	
CN1CCCC[C@H]1C(=O)N1CCC(N2CCC(NC(=O)CCBr)CC2)CC1	1834421456	HGBHGDJWYYULPJ-SFHVURJKSA-N	443.430	1.827	50	20	IDGD	
Cc1nc(CC(=O)N2CCOC[C@]3(CN(C(=O)CCBr)CCO3)C2)cs1	1834819108	HDAHOSOSEJARPA-KRWDZBQOSA-N	446.367	1.235	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)c3cc(C4CC4)on3)C2)C1	1834820294	VRGFSPBNHUMJBE-GOSISDBHSA-N	442.310	1.407	50	20	IDGD	
O=C(Cc1ccc(F)cc1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1835051035	IPDOJLZSPSOVAL-FUHWJXTLSA-N	447.276	1.515	50	20	IDGD	
CC(=O)N(C)[C@@H](C)C(=O)NC1CCN(C2CCN(C(=O)CO[Si](C)(C)C)CC2)CC1	1835122826	RKYQYHNOQWILHK-INIZCTEOSA-N	440.661	1.276	50	20	IDGD	
O=C(Cc1noc2ccccc12)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1835980396	NQLIQPUVNITYNG-PKOBYXMFSA-N	425.844	1.361	50	20	IDGD	
CC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)c3ccc4nncn4c3)CC2)CC1	1836396745	MZZLVVBFUPAKMM-SFHVURJKSA-N	432.956	1.932	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)c3cn4cccnc4n3)CC2)CC1	1836397205	UIDRMYVITDSZDH-QGZVFWFLSA-N	432.956	1.932	50	20	IDGD	
CC1CCN(CC(=O)N2CCC(OC3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)CC1	1836714700	ZUYNRUSGPSJENJ-IBGZPJMESA-N	429.989	1.317	50	20	IDGD	
O=C(c1noc2c1CCCC2)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836717417	APNNUNJNOJRFIY-QGZVFWFLSA-N	439.940	1.765	50	20	IDGD	
O=C(c1cnccn1)N1CCC(OC2CCN(C(=O)[C@H](F)Br)CC2)CC1	1837411897	BVEFYGMHAWIOHP-HNNXBMFYSA-N	429.290	1.779	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)CCBr)C3)C2)cc1	1838964968	MMKGESXFOKQEHU-IBGZPJMESA-N	441.322	1.550	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(CC(C)C)nn3C)C2)C1	1839144332	VOGRMGPONMBGHA-DYESRHJHSA-N	440.972	1.706	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cc(C)no3)C2)C1	1839962566	KSJJMGIWQGNHSO-MAUKXSAKSA-N	444.326	1.155	50	20	IDGD	
N#Cc1cccc(CCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)c1	1840186984	HIVYTJJQKVPJFS-HXUWFJFHSA-N	440.327	1.751	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)CCc2ccc(C#N)cc2)C1	1841005535	AOWCCRBFFFOHTH-WPWMEQJKSA-N	446.511	1.828	50	20	IDGD	
O=C(C(Cl)Cl)N1CC2(CCCN2C(=O)CCN2C(=O)Cc3ccccc3C2=O)C1	1841402944	ZZPNTYNDTUTMSF-UHFFFAOYSA-N	438.311	1.609	50	20	IDGD	
CC[C@@H](C)[C@H](O)C(=O)N1CC2(CCCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C1	1841923995	LRFLAYDDQAWRIX-ILXRZTDVSA-N	431.961	1.729	50	20	IDGD	
O=C(/C=C/c1ccc(F)cc1F)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843010616	LDSAQIZXJJGVNW-WEVVVXLNSA-N	426.228	1.175	50	20	IDGD	
COc1ccc2oc(C(=O)N3CC4(CCCN4C(=O)c4ccc(B(O)O)cc4)C3)cc2c1	1843011446	FCFVPXUMANSBBE-UHFFFAOYSA-N	434.257	1.252	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)COC1CCCCC1)C2	1843415149	QKIXAGIDHGLXCM-LFVJCYFKSA-N	429.521	1.673	50	20	IDGD	
C[C@H](Sc1ccccc1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cnccc1C(=O)NN	1847732833	SFGJEXNWEOWUHV-JVPBZIDWSA-N	439.541	1.681	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)c3ccc(Cl)c(S(N)(=O)=O)c3)[nH]n2)cc1	14368705	SSXBRTSPNGSUNK-UHFFFAOYSA-N	433.877	1.761	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Cc2ccc(Cl)cc2)cc(Cl)c1OCC(N)=O	14393849	LPBRVALJXYPJLJ-UHFFFAOYSA-N	426.256	1.870	50	20	IDGD	
CON(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)cc1	14889958	XXPHTWIEFKPHTQ-GFCCVEGCSA-N	425.438	1.236	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Cn2nnc3ccccc3c2=O)ccc1OCCC(C)C	15764976	XZCXKTQLQSENBT-UHFFFAOYSA-N	439.472	1.686	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)c1ccc2c(=O)n3c(nc2c1)CCCCC3	15939051	CMOQIFYRWSDYFE-UHFFFAOYSA-N	436.468	1.972	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCCC3)cc2)cc1	17113397	XDCQPLPGIOCWQJ-UHFFFAOYSA-N	445.541	1.939	50	20	IDGD	
Cc1nn(CC(C)C)c(C)c1CC(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	18384214	PGIZXNCIDIRXHK-UHFFFAOYSA-N	431.449	1.611	50	20	IDGD	
CCc1cccc(NC(=S)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c1	18919102	VYRSBEVESSKPMO-UHFFFAOYSA-N	448.570	1.901	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2ccc(S(=O)(=O)C(F)F)cc2)cc(OC)c1OC	26688445	PDHHRZRGLHMQID-UHFFFAOYSA-N	444.412	1.784	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cc(S(=O)(=O)NC3CC3)ccc2C)cc1OC	28777389	PIGCDUAWBOYRLF-UHFFFAOYSA-N	433.486	1.528	50	20	IDGD	
Cn1c(=O)n(C)c2cc(S(=O)(=O)NNC(=O)c3ccc(Br)s3)ccc21	215784979	PLQOYQGOMMRMBF-UHFFFAOYSA-N	445.320	1.324	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H](c2ccccc2)[C@@H]2CCCO2)c1	726711371	DHOUKWYLZTTWHQ-RBUKOAKNSA-N	446.529	1.801	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)Cc2csc(-c3nc[nH]n3)n2)c2ccccc2c1=O	727753233	XZRSXRBSATWXJY-UHFFFAOYSA-N	438.473	1.052	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)[C@H]1CCCN1C(=O)OCC(F)(F)F	727786938	HOLHLJBCKNVLFI-GFCCVEGCSA-N	433.383	1.775	50	20	IDGD	
O=C(CN1CCN(C(=O)c2c(F)cccc2F)CC1)NNC(=O)c1cccc([N+](=O)[O-])c1	727831763	NRLUNJHXUODHBO-UHFFFAOYSA-N	447.398	1.092	50	20	IDGD	
Cc1c(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)oc2c1C(=O)CCC2	728213437	BSPHIUSEHIWSEF-UHFFFAOYSA-N	446.529	1.800	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)[C@H]3Cc4ccccc4S3)cc2)CC1	728215224	WXOSLGMAFUMNPC-LJQANCHMSA-N	432.571	1.783	50	20	IDGD	
C[C@@H](C(=O)NNc1ccc(S(=O)(=O)C(F)F)cc1)N1C(=O)[C@H]2CCCC[C@H]2C1=O	728974731	ZQVKJDFDTVGMKG-LEWSCRJBSA-N	429.445	1.690	50	20	IDGD	
COc1ccc(NNC(=O)CCC(=O)N2CCN(S(=O)(=O)c3ccccc3)CC2)cc1	729271878	HNPWTSWMKMNHDL-UHFFFAOYSA-N	446.529	1.452	50	20	IDGD	
O=C(NNC(=O)c1cccc2ncccc12)c1ccc2c(c1)S(=O)(=O)N(C1CC1)C2=O	730227806	NPEKRTXYEFAURZ-UHFFFAOYSA-N	436.449	1.617	50	20	IDGD	
Cc1ccc2nc(-c3cccnc3)cc(C(=O)NNC(=O)N[C@H]3CCS(=O)(=O)C3)c2c1	730533547	HUDKNWLNCVNRGG-HNNXBMFYSA-N	439.497	1.736	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)Cn1cnc2ccc(Br)cc2c1=O	730778047	AMGXLEFTLHZYRT-UHFFFAOYSA-N	447.245	1.091	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)Cc1ccc(S(=O)(=O)N2CCCCC2)s1	731492279	FLTWKJDFLGPHTJ-UHFFFAOYSA-N	437.543	1.935	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)N1CCC[C@@H](C(=O)Nc2ccc(Br)cn2)C1	731849113	RIVFVQPETPRUBT-VXGBXAGGSA-N	426.315	1.441	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])o2)c(OC)c1	731989913	ALHRTDIJVWQVKV-CYBMUJFWSA-N	432.389	1.271	50	20	IDGD	
CCOc1ccccc1OS(=O)(=O)c1cccc(C(=O)NNC(=O)c2c[nH]nc2C)c1	732083122	UWXDRHYDAPANQC-UHFFFAOYSA-N	444.469	1.959	50	20	IDGD	
CCN(CC)C(=O)c1ccc(S(=O)(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1	733123048	OOFCGMLCAOWKCO-UHFFFAOYSA-N	441.513	1.978	50	20	IDGD	
CCS(=O)(=O)CC(C)=NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	733745508	NPAUQBFTFAFMQC-UHFFFAOYSA-N	426.502	1.929	50	20	IDGD	
COc1ccc(CN2CC[C@@H](NC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)C2=O)cc1	734683180	GIVZYEXAJALWRH-QGZVFWFLSA-N	427.417	1.349	50	20	IDGD	
COc1ccc(CN2CC[C@@H](NC(=O)NNC(=O)[C@@H](C)Oc3ccccc3F)C2=O)cc1	734685818	VVTUNGLASPTDKY-RDTXWAMCSA-N	444.463	1.733	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)CNC(=O)CC2CCCC2)CC1	734825111	VAUYPWYNFBGELO-UHFFFAOYSA-N	425.530	1.413	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)Sc1nnc(N2CCOCC2)n1CC(F)(F)F	734981963	HQVJNHPWKTYHJH-LLVKDONJSA-N	438.476	1.351	50	20	IDGD	
CCCn1c(C)cc(/C=C(\C#N)C(=O)N[C@H]2CC(=O)N(CCN3CCOCC3)C2)c1C	735822634	FYRGBHULZNRNFI-OABJIQBASA-N	427.549	1.471	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)CCCc2nc(C3CC3)no2)ccc1Cl	739681042	SIKXRQSONIJSKY-UHFFFAOYSA-N	427.870	1.032	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNS(=O)(=O)c1ccc(N2CCOC2=O)cc1	740809864	HNBUVGNFNLXVNL-UHFFFAOYSA-N	435.458	1.430	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)C3=CCCCO3)c2)cc1	742240890	VUFCWHHJRCMOII-UHFFFAOYSA-N	431.470	1.951	50	20	IDGD	
CCn1c(NNC(=O)CCCC[C@@H]2SC[C@@H]3NC(=O)N[C@H]23)nc2ccccc2c1=O	742275992	SYLVOAXHRQWFLC-ZOBUZTSGSA-N	430.534	1.585	50	20	IDGD	
O=C(NNC(=O)N1CCn2c(nnc2C(F)(F)F)C1)c1cccc(Br)c1	743688174	VXHARYLHBUIZGY-UHFFFAOYSA-N	433.188	1.930	50	20	IDGD	
CCO[C@H](C)c1noc(CN2CCN(CC(=O)NNC(=O)c3ccc(C)cc3)CC2)n1	744412105	NUWSQFWLECGYQM-MRXNPFEDSA-N	430.509	1.054	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N[C@@H](CCSC)C(=O)NNC(=O)NC(C)C)cc1	745146417	RUPGJZNQJZAYKN-HNNXBMFYSA-N	432.568	1.224	50	20	IDGD	
CCOc1c(OC)cc(CNC(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)cc1OC	745785898	BSYYLCQKSRSOEU-UHFFFAOYSA-N	434.405	1.861	50	20	IDGD	
COc1ccccc1N1CC[C@@H](CNC(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)C1	745792322	IXWBSYBEQXNBNF-ZDUSSCGKSA-N	429.433	1.780	50	20	IDGD	
Cc1noc(C)c1S(=O)(=O)NC1(C(=O)NNC(=O)NCc2ccco2)CCCC1	746166613	BFABMPCDDMAJFT-UHFFFAOYSA-N	425.467	1.006	50	20	IDGD	
CN1CCN(CCCNC(=O)NNC(=O)Cc2cn3ccccc3n2)[C@H](c2ccccc2)C1	746750097	KQHWOVWRGKRHFA-NRFANRHFSA-N	449.559	1.586	50	20	IDGD	
C[C@@H](c1ccccc1)[C@](C)(O)C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	747413611	UDWHZMRMTCYZAS-KKSFZXQISA-N	433.530	1.705	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N1CCC[C@H](CC(N)=O)C1	747491185	QJBNQPIRSBVPBG-NWDGAFQWSA-N	427.299	1.545	50	20	IDGD	
C#CCNC(=O)C1CCN(C(=O)CCC(=O)C(C#N)=C2N(C)c3ccccc3N2C)CC1	747735195	MNAVHHGBNZDGCB-UHFFFAOYSA-N	433.512	1.645	50	20	IDGD	
CCc1cc(N2CCC(NC(=O)NNC(=O)COc3ccccc3[N+](=O)[O-])CC2)ncn1	748662663	BHOYDTVGSMGTMA-UHFFFAOYSA-N	443.464	1.325	50	20	IDGD	
O=C(NNC(=O)N1CCN([C@@H]2C[C@H]3CC[C@H]2C3)CC1)C1CCN(c2ncccn2)CC1	749111572	MGRUZDXNBANKQA-YTQUADARSA-N	427.553	1.240	50	20	IDGD	
CC(C)c1noc(CCCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)n1	749356394	LNOSKYDYTIEAHG-UHFFFAOYSA-N	438.510	1.020	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(CCNC(=O)NNC(=O)c2cc3ccccc3o2)CC1	749566563	ZBKVQSVJGDYGLY-UHFFFAOYSA-N	431.493	1.930	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)NO[C@@H]2CCCCO2)cc1	749618044	VCIJVCWDYFXUTH-ZRNYNZGJSA-N	439.472	1.915	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)C1CCN(c2ccc3nncn3n2)CC1	751293711	JGBNVWBUAWOCQY-UHFFFAOYSA-N	447.503	1.100	50	20	IDGD	
Nc1cc(C(=O)OCC(=O)NNC(=O)c2ccccc2)ccc1I	751695343	HCYJMGGAVLAKEV-UHFFFAOYSA-N	439.209	1.491	50	20	IDGD	
CC(C)Oc1ccc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1N	754585852	AJVDEZGKLVCQGB-SFHVURJKSA-N	429.429	1.200	50	20	IDGD	
CCc1ccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1	755389240	WAWCYJBHYWXZTN-UHFFFAOYSA-N	432.502	1.736	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccc(OCC(F)(F)F)nc2)c1	755869186	JSRWCEVNBLZFDQ-UHFFFAOYSA-N	432.380	1.893	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2ccc(NC(C)=O)c(OC)c2)c2ccccc2c1=O	755913137	DTLJRNXWUCXNOH-UHFFFAOYSA-N	438.444	1.850	50	20	IDGD	
COc1cc(CN2CC[C@@H](NC(=O)NNC(=O)Cc3ccccc3OC)C2)cc(OC)c1	756097365	VEVDNKIRKSVDLH-GOSISDBHSA-N	442.516	1.860	50	20	IDGD	
COc1cc(C#N)ccc1Oc1ccc(NC(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)cc1	756297653	NRVSCRRJHPCDAP-LBPRGKRZSA-N	447.473	1.450	50	20	IDGD	
Cc1cc(C(=O)N2CCOCC2)ccc1NC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	757829752	FGPUUMASXNNVBK-IBGZPJMESA-N	440.456	1.460	50	20	IDGD	
Cc1cc([N+](=O)[O-])c(C)c(S(=O)(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1	758149887	FYSQGGJRWKANTR-UHFFFAOYSA-N	434.478	1.228	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCCC[C@@H]2CCCCO2)cc1	761036985	SSEPGRFMEBJMIG-INIZCTEOSA-N	426.539	1.295	50	20	IDGD	
Nc1c(Cl)cc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1Cl	761452695	RTISQJKOWDPATJ-CQSZACIVSA-N	440.239	1.720	50	20	IDGD	
C[C@@H]1Cc2ccccc2N1S(=O)(=O)c1cccc(C(=O)NNc2nccn(C)c2=O)c1	761572010	KPEAQLCMMIHGQP-CQSZACIVSA-N	439.497	1.677	50	20	IDGD	
Cc1cc(Cl)c([N+](=O)[O-])cc1S(=O)(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	761886070	FMBMEBZKGKDJJY-UHFFFAOYSA-N	447.878	1.583	50	20	IDGD	
CCN(CC(=O)NNC(=O)c1ccc(C)cc1)CC(=O)Nc1ccc2c(c1)OCCO2	762268396	HPFSJOXOGOBCSP-UHFFFAOYSA-N	426.473	1.488	50	20	IDGD	
CC(=NNC(=O)[C@@H](C)CN1CCC(C)CC1)c1c(C)nn(CCS(C)(=O)=O)c1C	763136825	HCTGPBDBOPIWPM-HNNXBMFYSA-N	425.599	1.753	50	20	IDGD	
O=C(CN1CCCCCC1)Nc1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2)cc1	763431799	RBOBZJRHTKLTHV-UHFFFAOYSA-N	437.500	1.901	50	20	IDGD	
C[C@@H](c1ccc(NC(=O)C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1)N1CCOCC1	763441422	DFERUMWKMZTBHD-AWEZNQCLSA-N	441.444	1.388	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)nn1-c1cccc(F)c1	763442228	OCQGKSKQQGLSKJ-UHFFFAOYSA-N	426.364	1.628	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)C(=O)Nc1cccc(CN2CCCCC2=O)c1	763446345	RFGQKVUYRVHSOU-UHFFFAOYSA-N	439.428	1.507	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)C(=O)Nc2ccc3c(c2)NC(=O)CO3)c1	763598187	WRCQOZIINFOKSG-UHFFFAOYSA-N	440.456	1.614	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2ccn(-c3cccc(F)c3C#N)n2)c1	763619432	WQSNHVYOKGFRBU-UHFFFAOYSA-N	436.403	1.356	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1ccc(-c2n[nH]c(C3CC3)n2)cc1	763628866	HCROJVVLONKWAR-UHFFFAOYSA-N	444.455	1.705	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cc(OC)ccc2OC(F)F)cc1	763658859	FPUINFMLHYEBBO-UHFFFAOYSA-N	439.371	1.470	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(C(=O)c3nccn3C)cc2)cc1C	763664951	OJQVSIIPXMHYFM-UHFFFAOYSA-N	449.467	1.433	50	20	IDGD	
C[C@@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)COc3ccc(Cl)cc3)cc2)CCO1	763686896	WWGUQCUIXKJKRT-CQSZACIVSA-N	446.891	1.730	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)n(Cc2ccccc2)n1	763840326	RQWRQTFIIGFWBI-UHFFFAOYSA-N	425.420	1.544	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)C(=O)Nc1ccc(F)c(C(N)=O)c1	763855432	WLWLNSHJNYNQGH-LBPRGKRZSA-N	438.415	1.631	50	20	IDGD	
CCOC(=O)c1cc(C)sc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccc(F)cc1	763867500	VVQWRPYZPTWIQO-NSHDSACASA-N	437.449	1.926	50	20	IDGD	
COC(=O)c1ccc(C)c(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(C(C)=O)cc2)c1	763879499	WZFJNPCCLAYPSG-CQSZACIVSA-N	441.440	1.538	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)OC[C@H]2COC(=O)O2)cc1	763892677	REXOMVNUOKBXBI-AAKUMTKESA-N	440.412	1.420	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccc(Cl)cc2Br)n1	763893267	SNNQOIJYBZEGEJ-UHFFFAOYSA-N	428.674	1.702	50	20	IDGD	
CCOC(=O)c1ccsc1NC(=O)C(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	763948786	LOGBDXFGYUTWGG-UHFFFAOYSA-N	443.441	1.216	50	20	IDGD	
CNC(=O)[C@@H]1CN(C(=O)C(=O)NNC(=O)Cc2ccc3ccccc3c2)c2ccccc2O1	764083197	PZMDCKIAYSLDPQ-FQEVSTJZSA-N	446.463	1.070	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccccc2CN2C[C@H](C)O[C@@H](C)C2)c(O)c1	764105820	ZHFNFMMEFHUZPW-HOTGVXAUSA-N	440.500	1.710	50	20	IDGD	
C[C@@H](c1cccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)c1)N1CCOCC1	764117195	OHQKWKSPPHQMBZ-ZDUSSCGKSA-N	446.891	1.839	50	20	IDGD	
CCOC(=O)c1cnn2c(C(=O)NNc3ccc(S(=O)(=O)C(F)F)cc3)ccnc12	764148074	BPJWEHVFQIDWGO-UHFFFAOYSA-N	439.400	1.659	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2O1)C(=O)Nc1cccc2c1CN(c1ccccn1)C2	764164760	SUZIMVMASPFVRZ-HXUWFJFHSA-N	443.463	1.691	50	20	IDGD	
CN(C)CC(=O)NNC(=O)C(=O)Nc1ccc(OCc2cccc(C(F)(F)F)c2)cc1	764210782	HUJSPCKMOKZZIN-UHFFFAOYSA-N	438.406	1.932	50	20	IDGD	
CC(C)(C(=O)NNC(=O)C(=O)Nc1ccccc1S(=O)(=O)C(F)F)c1ccccc1	764309743	UODDDEBRGQQFAD-UHFFFAOYSA-N	439.440	1.747	50	20	IDGD	
Cc1cc(C(=O)N2CCC(C)CC2)ccc1NC(=O)C(=O)NNC(=O)Cc1ccncc1	764354558	RVFCUBFXFHXWHU-UHFFFAOYSA-N	437.500	1.591	50	20	IDGD	
CNC(=O)c1cc(Oc2ccccc2NC(=O)C(=O)NNC(=O)c2ccc(C)o2)ccn1	764371830	MOLJBRZKHKXLGC-UHFFFAOYSA-N	437.412	1.535	50	20	IDGD	
C[C@@H]1CCCN(S(=O)(=O)c2ccc(NC(=O)C(=O)NNC(=O)OC(C)(C)C)cc2)C1	765386784	OKSQUVHKHRORAZ-CYBMUJFWSA-N	440.522	1.602	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)c2ccc(C)cc2O)cc1F	765639612	ASTBPELGELZCNA-UHFFFAOYSA-N	431.467	1.225	50	20	IDGD	
O=C(CSc1ccncc1)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	766662754	FNIAXOFAWJWNIF-UHFFFAOYSA-N	433.965	1.792	50	20	IDGD	
N#Cc1ccc(NCC(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)cc1	766663734	MVNRHIHOBOCROL-UHFFFAOYSA-N	440.935	1.589	50	20	IDGD	
CCS(=O)(=O)Nc1ccccc1C(=O)OCC(=O)NNC(=O)Cc1ccccc1C	767306850	YXFSWPCMGBZSQU-UHFFFAOYSA-N	433.486	1.304	50	20	IDGD	
Cc1cc(F)ccc1-n1cc(C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)nn1	767817084	FJMMDQLDJKJPEY-UHFFFAOYSA-N	442.363	1.241	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)cc1NS(C)(=O)=O	768276311	HMCAFGLSWZCBKT-UHFFFAOYSA-N	431.449	1.971	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)N2CCN(S(=O)(=O)c3nc[nH]n3)CC2)c(C)n1CC(C)C	768726137	UMBPTWQHFVWDQH-VCHYOVAHSA-N	445.549	1.319	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)NCc1ccnc(N2CCN(C)CC2)c1	770147936	WXEBICNVKLYBHV-OAHLLOKOSA-N	446.939	1.785	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1cc(S(=O)(=O)NCc2ccccc2)ccc1C	771937735	GPNNEMFKAYITLO-OAHLLOKOSA-N	447.513	1.576	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)C1CCN(c2oc(-c3ccco3)nc2C#N)CC1	771996860	IYFMWGNERUGYCX-GFCCVEGCSA-N	429.433	1.512	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)Nc1cnn(Cc2nnc3n2CCCC3)c1	772638500	AXAMAPNVLPQYTQ-CYBMUJFWSA-N	442.455	1.619	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)c1cc(I)c[nH]1	772905301	MEOUSNLJBRFROK-UHFFFAOYSA-N	446.632	1.350	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C1=NN(c2ccc(F)cc2)[C@@H](C(N)=O)C1	772968137	DCGYVWPXSUEEPQ-PIGZYNQJSA-N	447.854	1.514	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2cccc(C(F)(F)F)n2)c1	775742755	RWUVVSWIWLASCG-UHFFFAOYSA-N	431.396	1.817	50	20	IDGD	
C[C@@H](NC(=O)NNc1cccc(S(C)(=O)=O)c1)c1ccc(S(=O)(=O)N(C)C)cc1	776613042	MYDCFOMBSUKSKP-CYBMUJFWSA-N	440.547	1.728	50	20	IDGD	
O=C(CO)NNC(=O)c1cccc(S(=O)(=O)N(Cc2ccccc2)c2ccccc2)c1	777781564	AUQSZWCTBFTRFO-UHFFFAOYSA-N	439.493	1.835	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)[C@@H]1CCCN(C2CCC2)C1	781402612	HFEFQHWQLOFXGV-LSDHHAIUSA-N	426.521	1.531	50	20	IDGD	
CCCCN(C)S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccc(OC)cn2)cc1	782141114	LEUYNMKTJMZXJK-UHFFFAOYSA-N	435.506	1.593	50	20	IDGD	
CCOC(=O)c1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)cc1	783265856	YQEDUHWKNQHGQL-UHFFFAOYSA-N	449.489	1.027	50	20	IDGD	
COc1ccccc1Oc1ccc(NC(=O)C(=O)NN[C@]2(C)CCS(=O)(=O)C2)cc1	783428463	WONDIJREZSFVPE-HXUWFJFHSA-N	433.486	1.624	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNc2cccc([N+](=O)[O-])c2C)cccc1C(=O)N1CCOCC1	784357648	HMEMPYUSBDUCGI-UHFFFAOYSA-N	441.444	1.766	50	20	IDGD	
Cc1nc(-c2cccc(NC(=O)C(=O)NNC(=O)Cc3cn4ccccc4n3)c2)oc1C	785060878	RCQANDQKOAJTCZ-UHFFFAOYSA-N	432.440	1.935	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-]	785182110	JABNYSAKKINTHK-UHFFFAOYSA-N	449.423	1.760	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)c1C	785445629	SMCGOQSHFJNGQO-UHFFFAOYSA-N	432.502	1.344	50	20	IDGD	
CN(NS(=O)(=O)c1ccccc1C=O)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	788917817	VRMLDEJJYHXADV-UHFFFAOYSA-N	426.495	1.297	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCC(C)(C)CN2CCCC2)c1	790711981	YGNUXJULJSKRLA-UHFFFAOYSA-N	425.555	1.003	50	20	IDGD	
O=C(NNC(=O)c1nc(Br)ccc1F)c1csc(N2CCOCC2)n1	792022502	PTRCTUBUDSMELN-UHFFFAOYSA-N	430.259	1.351	50	20	IDGD	
O=C(Cc1cc[nH]n1)NNC(=O)C(=O)Nc1c2c(nn1-c1ccc(Cl)cc1)CCC2	792265989	KHUWCUDBSMGZPZ-UHFFFAOYSA-N	427.852	1.066	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cnc(CC(C)C)nc2)cc1	792352209	DXLRLEOTRIIUSX-AWEZNQCLSA-N	427.461	1.431	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cnc(CC(C)C)nc2)cc1	792352211	DXLRLEOTRIIUSX-CQSZACIVSA-N	427.461	1.431	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)[C@@H](O)Cc1ccccc1	793681740	KQZSTADCIUJZIN-FQEVSTJZSA-N	430.936	1.209	50	20	IDGD	
CC(=O)N[C@H](CC(=O)NNc1ccccc1S(=O)(=O)N(C)C)c1ccc(F)cc1F	795169680	SPQSSAOQJULJFU-QGZVFWFLSA-N	440.472	1.926	50	20	IDGD	
COC(=O)Cn1ncc(NC(=O)C(=O)NNc2ccc(Br)cc2Cl)c1C	796990274	VQMFKJGYGBRVBA-UHFFFAOYSA-N	444.673	1.862	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNc2nc3ccccn3n2)cc(Br)cc1[N+](=O)[O-]	797540192	SBRWAFIFBFYBEW-UHFFFAOYSA-N	434.210	1.790	50	20	IDGD	
Cc1ccc([C@@H](NCC(=O)NNC(=O)c2cccc(C#N)c2)[C@H](C)S(C)(=O)=O)cc1	797997554	NAPKIRFEPSBBTG-YWZLYKJASA-N	428.514	1.392	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNS(=O)(=O)c1ccc(S(=O)(=O)N(C)C)cc1	798164897	WYWQYPLSJGSMLV-UHFFFAOYSA-N	447.922	1.222	50	20	IDGD	
C=CCNC(=S)NNC(=O)c1cc(S(=O)(=O)Nc2ccc(OC)cc2)ccc1O	798305163	KAPIQCFVQTUKTP-UHFFFAOYSA-N	436.515	1.497	50	20	IDGD	
COc1ccc(-c2nc(C)c(C(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)s2)c(F)c1	799863476	DHBOOYHBJGXAIL-JTQLQIEISA-N	427.479	1.462	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)c2cnc(C(=O)OC(C)(C)C)cn2)n[nH]1	801933649	BIIHAESTDFCYRH-UHFFFAOYSA-N	438.444	1.905	50	20	IDGD	
Cc1c(C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)nnn1Cc1ccncc1	802831548	VEOQGRFDARVUTP-UHFFFAOYSA-N	427.415	1.957	50	20	IDGD	
C=C[C@](C)(O)CC(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2OC)c1	809980171	IFAPJPDVHYVTNW-FQEVSTJZSA-N	433.486	1.584	50	20	IDGD	
Cc1nn(C)c(C)c1C(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	810457342	DEAIBRADOQLADF-UHFFFAOYSA-N	430.468	1.870	50	20	IDGD	
CC(C[C@@H]1CCC(=O)N1)=NNC(=O)c1cc(S(=O)(=O)NCc2ccccc2)ccc1O	811637245	XQKUTMUEJQVQLJ-INIZCTEOSA-N	444.513	1.645	50	20	IDGD	
C[C@@H](C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1)C1CN(C(=O)OC(C)(C)C)C1	812731753	SPQWIYPBQVNOTQ-CYBMUJFWSA-N	426.539	1.883	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)N2CCN([C@@H](C)C(=O)NC3CC3)CC2)c1C	812757800	VICIGQGGGVEZAT-HJHGFDQJSA-N	427.549	1.470	50	20	IDGD	
CCOc1ccc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)[C@@H](O)C(C)C)cc2)cc1	813363305	HMWZSCYCGFTXGX-SFHVURJKSA-N	435.502	1.664	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H](O)c2ccc(Cl)cc2F)c1	813367199	VCISLBOBXPLEAP-OAHLLOKOSA-N	429.857	1.224	50	20	IDGD	
O=C(NCc1cccc(N2CCOCC2)c1)NNC(=O)C1CCN(c2ncccn2)CC1	814367630	UDOVGSYQSVSIAO-UHFFFAOYSA-N	439.520	1.060	50	20	IDGD	
COCCN1[C@H]2CC[C@H]1CC(=NNC(=O)c1cccc(S(=O)(=O)N3CCCC3)c1)C2	814689961	NVSYNJUJDTUNHV-OALUTQOASA-N	434.562	1.830	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)[C@@H]2COCCN2CC(F)(F)F)C1	816510409	VLGZTNGTEMYHOE-STQMWFEESA-N	438.447	1.044	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NNC(=O)c2cnc(C3OCCO3)s2)C1	816510545	YWJPXQVQOUWQLL-LLVKDONJSA-N	426.495	1.597	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)c2cnn(C)c2I)cc1	816597848	HSYLSARHCRDNOY-UHFFFAOYSA-N	428.234	1.557	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)c1nn(-c2ccccc2F)c(C)cc1=O	825644163	WPPNTCFYHCMTOV-UHFFFAOYSA-N	425.420	1.562	50	20	IDGD	
CSCC[C@H](NC(=O)c1ccccc1)C(=O)NNC(=O)[C@@H]1COc2ccccc2O1	859439209	PKJGEFJJYRTOTG-YJBOKZPZSA-N	429.498	1.526	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)CN1C(=O)[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O	912601344	ZIIDAQLYYMHCQD-YFDDECCXSA-N	433.464	1.562	50	20	IDGD	
CON=Cc1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1	912643040	KIRJSKJYRJLFGH-UHFFFAOYSA-N	430.486	1.526	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)c1cc(S(=O)(=O)NCCOC)ccc1C	913459281	JEFUYPSYGWGAJV-UHFFFAOYSA-N	449.529	1.322	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)c1	914881448	GGILQJZYUSCNFG-UHFFFAOYSA-N	445.476	1.977	50	20	IDGD	
CC(=O)N1CCc2ccccc2[C@@H]1CC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	915077219	MORGTTMQZPFTHY-IBGZPJMESA-N	429.498	1.387	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cn2cccn2)o1)c1cccc(S(=O)(=O)N2CCCC2)c1	915261591	REKNNRARHMOXNJ-UHFFFAOYSA-N	443.485	1.384	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccco3)c2)cc1	915774364	PSEAFJQHZWDPLI-UHFFFAOYSA-N	443.481	1.907	50	20	IDGD	
COc1cc(C=NNC(=O)COc2ccc(F)cc2)ccc1OCC(=O)N1CCOCC1	916331711	RQLMRGBTUSKKCP-UHFFFAOYSA-N	445.447	1.601	50	20	IDGD	
COc1cc(C=NNC(=O)[C@@H](C)CN2CCOCC2)cc(I)c1O	916361760	FLIIHTFWHYAYKN-NSHDSACASA-N	447.273	1.424	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)NC[C@]2(N3CCOCC3)CCSC2)cc1OC	916636458	DCMOXWCDJINYLU-HXUWFJFHSA-N	438.550	1.246	50	20	IDGD	
CSCC[C@@H](C(=O)NNC(=O)c1ccc(C)cc1O)N1C(=O)c2ccccc2C1=O	918340871	FZSUGXPRAGUTJF-INIZCTEOSA-N	427.482	1.880	50	20	IDGD	
O=C(NNC(=O)C1CCN(S(=O)(=O)c2cccnc2)CC1)c1ccc(Cl)cc1O	918359254	RXOODBYWDVRHCL-UHFFFAOYSA-N	438.893	1.303	50	20	IDGD	
CC(=NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)c1ccc(-n2cnnn2)cc1	918708096	VXFRMKCVSJFPHC-UHFFFAOYSA-N	439.501	1.601	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@@H](C)Cc2ccc(O)cc2)cc1	919911030	FYACKMYCYQTXCR-HNNXBMFYSA-N	434.518	1.283	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c1	920213629	VTZNEXWZQCPSNV-UHFFFAOYSA-N	441.853	1.965	50	20	IDGD	
COc1ccc([N+](=O)[O-])c(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1	920274555	SPVIBJZAJIWOHB-UHFFFAOYSA-N	448.457	1.463	50	20	IDGD	
N#C/C(=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)NNC(=O)C1CC1	920847509	FONHDYJDNIDNHE-ZROIWOOFSA-N	426.864	1.543	50	20	IDGD	
N#C/C(=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)NNc1ncccn1	920853024	GCXHTDKWQHBZGZ-GXDHUFHOSA-N	436.863	1.919	50	20	IDGD	
CN(C)Cc1cccc(NC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)c1	920929962	YBZCWNFIHZMJOG-UHFFFAOYSA-N	447.565	1.228	50	20	IDGD	
CCS(=O)(=O)c1cccc(S(=O)(=O)NNC(=O)c2cncn2-c2ccccc2)c1	1116266627	HTJYNXSUQSLRKX-UHFFFAOYSA-N	434.499	1.289	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N2CC(O)(C3CC3)C2)cc1	1116778068	RWJIQPRPNFZYIZ-MHWRWJLKSA-N	435.484	1.324	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)c1ccc(N2CCC[C@H](C(N)=O)C2)cc1	1251217004	KKHZZXOIRWCCIW-ZBFHGGJFSA-N	428.464	1.756	50	20	IDGD	
Cn1c(=O)n(CC(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)c2ccccc21	1318566869	PDLIDJYQKISDIN-UHFFFAOYSA-N	431.493	1.135	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3ccc(-c4nc(C)no4)cc3)CC2)cc1	1319209407	WFUOPPLWLIZXKI-UHFFFAOYSA-N	448.527	1.932	50	20	IDGD	
CN(CCO)S(=O)(=O)c1ccc(C(=O)NNc2cncc(Br)c2)cc1	1321135851	GQEAGZVSRTYZNW-UHFFFAOYSA-N	429.296	1.214	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCc2cc(OCC(F)F)ccn2)cc(OC)c1OC	1325038131	IQOMGTRFLBQKIH-UHFFFAOYSA-N	440.403	1.896	50	20	IDGD	
Cc1ccc2oc(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)[C@@H](O)CCl)C4)cc2n1	1777716838	MLCNPOZSOROAPX-RRMPHLOHSA-N	435.908	1.863	50	20	IDGD	
O=C(c1cc2c(F)cc(F)cc2[nH]1)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1777795373	UUMWVCXTNJCDHH-VQIMIIECSA-N	427.835	1.489	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3c(Cl)ccc4c3OCO4)C2)C1	1777802828	BYNAYMVYWCQQBY-DJJJIMSYSA-N	445.299	1.766	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H]3CN(Cc4ccccc4)CCO3)C2)C1	1778278486	LCDJVLHMQMEPLC-MIZPHKNDSA-N	449.979	1.735	50	20	IDGD	
O=C(c1ccc(OC(F)F)cc1F)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1780140203	SCLSCOPWOXBAAZ-KBXCAEBGSA-N	436.814	1.470	50	20	IDGD	
O=C(c1cccc(-c2cnccn2)c1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1780184843	BMKHOESKYHCKMH-GHTZIAJQSA-N	430.892	1.187	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Br)C1)N1C[C@@H]2C[C@H]2C1	1780775038	VHRMKDCHUFYHNV-DRVLGICASA-N	446.361	1.531	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CN1CCOCC1)C2	1781899906	HDBYZUCLGXFMAT-GPMSIDNRSA-N	446.386	1.006	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc3n(n1)CCCC3)C2	1782175303	GIPWWIDGMZCPCH-HGHGUNKESA-N	438.956	1.601	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3cccc4nccn34)C2)C1	1782356882	ZKISJFPUZWYDMO-KUHUBIRLSA-N	435.322	1.809	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc4cncn4c3)CCO2)C1	1783349736	SBFWZHRIXOUHQR-APWZRJJASA-N	435.322	1.951	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)Cc3ccc4c(c3)OCO4)CCO2)C1	1783532578	KOZSDVNBVDSJAA-ORAYPTAESA-N	439.306	1.571	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](C)Oc1ccccn1)CCO2	1783540331	UFQNSOPCKPQGOK-DEYYWGMASA-N	426.311	1.462	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)NNc3ccccc3)[C@H]2C1	1783553315	BQUWHQJSUCBQGS-FQQAFBJJSA-N	438.956	1.225	50	20	IDGD	
O=C(CCCc1ccccc1F)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21	1784063969	XMZNNUPCMJVYHB-DKKFBQAASA-N	426.916	1.728	50	20	IDGD	
CCCNC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCBr)[C@H]2C1	1786404279	BNYSMWKDHJTLPD-KKUMJFAQSA-N	432.359	1.058	50	20	IDGD	
Cc1[nH]nc(C(=O)Nc2ccc(C3(NC(=O)c4cccc(B(O)O)c4)CCC3)cc2)c1F	1787161713	DDZHFRWBOKOJLK-UHFFFAOYSA-N	436.252	1.599	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cc([N+](=O)[O-])ccc3F)C[C@@H]21)[C@@H](F)Cl	1787444144	POBOQUSSWDFOLQ-CDUAKIRFSA-N	431.823	1.791	50	20	IDGD	
CC(C)n1cnc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCBr)C[C@@H]32)n1	1787667359	PGLVGHPISLIUEM-IHRRRGAJSA-N	428.331	1.237	50	20	IDGD	
C[C@H]1CCc2c(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)[C@@H](C)Br)C[C@@H]43)n[nH]c21	1787953310	PDPFCHZKWQQROF-XXUMUBMXSA-N	439.354	1.836	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(O)cc3F)C[C@@H]21	1791060892	LIZLGDGXICOUMO-AZLWOZFGSA-N	429.286	1.908	50	20	IDGD	
Cc1ccc(C(=O)C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCBr)C[C@@H]32)cc1	1791171240	ORUGSPGOIITMAX-ULQDDVLXSA-N	437.334	1.942	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)COc3ccc(F)cc3)C[C@@H]21	1791251229	APRRPAKVSIMJFC-RUGDWHBFSA-N	428.888	1.438	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccccc3-n3nccn3)C[C@@H]21)C(Cl)Cl	1791296589	BAOSNBRCAXBPDC-NOLJZWGESA-N	438.315	1.664	50	20	IDGD	
Cn1cccc1C(=O)C(=O)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1	1791920882	HROQFXBIMBEHQP-UHFFFAOYSA-N	445.284	1.336	50	20	IDGD	
O=C(CCNC(=O)c1ccccc1)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21	1792120989	DFYYQVJBFVZSFC-JYJNAYRXSA-N	442.343	1.590	50	20	IDGD	
COc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)Br)C3)cc1F	1792679270	RXXOKRHGCNQTSP-VFFTVRQLSA-N	429.286	1.821	50	20	IDGD	
C[C@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(C)(C)CCl	1792782803	FCJBRTCTWYPYSG-XQLPTFJDSA-N	431.961	1.754	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccnc1Cl)C2	1792866965	PFLIDIVKJKSNNE-FMSGJZPZSA-N	430.730	1.969	50	20	IDGD	
CC[C@H](C)[C@H](O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)C2	1793398811	CMGDSCSLMYAOOO-SUADVCAXSA-N	447.482	1.868	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cccc(Cl)n1	1794196951	JBDSYYHCTKILBE-HBCWATKFSA-N	425.989	1.719	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(C)(C)C	1795158216	CGLZQFHFSBRUOW-ZSBFGKGUSA-N	433.461	1.769	50	20	IDGD	
O=C(Cc1ccc(Cl)cc1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1	1796186988	DTTVOQHVONFUIP-ACDBMABISA-N	426.709	1.514	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](C)n1cccn1)C2	1796893015	HLGJOVULMGVYHD-PIEAIKFESA-N	425.493	1.216	50	20	IDGD	
CCc1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)cc(C)n1	1797182502	PSXJKDVUYFOACF-BCDXTJNWSA-N	436.516	1.517	50	20	IDGD	
O=C(CCBr)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1CC[C@@H]2CCC(=O)N2C1	1799927173	IYNRMNBDSKUICX-RBZJEDDUSA-N	426.355	1.811	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COc1cccnc1)C2	1800640417	WTAWABSFNNJXHH-YXPYIKCWSA-N	426.311	1.224	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(Cl)c1OC)C2	1800982801	LRKAMTDUHGKKFR-NOXHYTERSA-N	431.316	1.806	50	20	IDGD	
C=C(Oc1ccccc1O)C(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]1c1cccnc1	1803139677	SWGMZNZZUTXBCG-IMFGXOCKSA-N	445.903	1.985	50	20	IDGD	
COC(=O)C12CC(C(=O)N3CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]3c3cccnc3)(C1)C2	1803147002	FPWOIOOBNUYPQB-UVQFAXKASA-N	435.908	1.030	50	20	IDGD	
COc1nccnc1C(=O)NC[C@@H]1CCN(C(=O)[C@H](C)Br)[C@H]1c1cccnc1	1804983281	YWNYSAVXZKCSKR-NOLJZWGESA-N	448.321	1.983	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC2(CCCN(C(=O)C(F)(F)C(F)(F)C(=O)O)C2)CC1	1806538610	NWHJPZGMHRZSQC-NSHDSACASA-N	446.825	1.827	50	20	IDGD	
Cc1ccn(C)c1C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1807373448	BCFQIMVGEJBHSA-KNQAVFIVSA-N	446.316	1.042	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CCn2ccnn2)[C@@H]1c1cccnc1)[C@@H](F)Br	1808681549	VSRPKQJFJVDSBZ-NUEKZKHPSA-N	439.289	1.460	50	20	IDGD	
Cc1cc(C(=O)NC[C@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)c[nH]1	1808779406	XRCCMMGTBZQBIB-UZLBHIALSA-N	447.499	1.350	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)c1ccnc2c1OCO2	1811309942	VFGIOKYONOFLRG-IMJJTQAJSA-N	432.864	1.125	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@@H](CNC(=O)CCC(N)=O)[C@@H]1c1cccnc1	1812625957	CRMWWVUIRGMRTN-IFIJOSMWSA-N	425.327	1.384	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2ccc([N+](=O)[O-])[nH]2)[C@H]1c1cccnc1	1813032720	LJCQXACJNRQONV-ZQIUZPCESA-N	435.868	1.891	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)Cc2cccnc2)[C@@H]1c1cccnc1	1813070778	JUHYMBFKXOWDLT-WMZHIEFXSA-N	438.532	1.098	50	20	IDGD	
COC(=O)NCC(=O)NC[C@@H]1CCN(C(=O)[C@@](C)(Cl)CCl)[C@@H]1c1cccnc1	1813266389	IQDGHJHOYAZLIQ-JOQOYGCGSA-N	431.320	1.680	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)[C@H](C)n2cncn2)[C@@H]1c1cccnc1	1813403018	CYPRKOSJZIKZSF-UGQVUOCMSA-N	435.326	1.724	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@@H]2Cc3ccccc3CN2)[nH]n1)[C@H](O)CCl	1814870359	PWLSOWCHDCQQOQ-RCCFBDPRSA-N	431.924	1.716	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(O)n[nH]3)sc2C1	1815203396	BGUGNRSWFIEIFP-HTQZYQBOSA-N	428.312	1.829	50	20	IDGD	
C[C@H](C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1)c1ccccc1	1815347748	NIAUMAASHMIPMI-KBXCAEBGSA-N	449.341	1.852	50	20	IDGD	
C=CCSCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1815654524	UJEBXQRPOWLPTM-KRWDZBQOSA-N	428.323	1.315	50	20	IDGD	
Cc1cccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)[nH]n2)n1	1816395959	FXKXVYBJADSCFM-GOSISDBHSA-N	448.487	1.731	50	20	IDGD	
O=C(CCc1cccnc1)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1817631331	YVGRABWGYOFDCV-FQEVSTJZSA-N	447.304	1.423	50	20	IDGD	
Cc1[nH]ccc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnccc1C(=O)NN)CC2	1817727389	DSFIVVCFIMPWLF-NSHDSACASA-N	439.501	1.318	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)[nH]n1)[C@@H](F)Cl	1818045616	ZDFNQKMQSIIHTL-NOZJJQNGSA-N	433.918	1.797	50	20	IDGD	
CC(C)CNC(=O)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](C)Br)[nH]n1	1818135849	NXMUKLWPLRSOOJ-YPMHNXCESA-N	428.331	1.957	50	20	IDGD	
CCc1noc(C)c1C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1	1819846599	YVGUKDOJEABYOQ-MRXNPFEDSA-N	445.524	1.947	50	20	IDGD	
Cn1ccc(CC(=O)N[C@@H]2CCc3nc(NC(=O)[C@@H](F)Br)sc3C2)n1	1823003493	LLRYUCSYNICRCF-AMIZOPFISA-N	430.303	1.722	50	20	IDGD	
O=C(c1nn[nH]c1C(F)(F)F)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)CC1	1824185467	JMWHVHIALGRUKZ-RYUDHWBXSA-N	437.850	1.657	50	20	IDGD	
CC[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CNC(=O)N(C)C)CC2	1825440274	NWBGWEFBCCVKPG-NXEZZACHSA-N	446.371	1.500	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(F)s1)CC2	1826080359	FLSJPCXREMUAFT-SNVBAGLBSA-N	439.538	1.943	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@]1(C)CC1(F)F)CC2	1826092053	KAZUKVDXNGQAIT-QGHHPUGFSA-N	429.493	1.473	50	20	IDGD	
O=C1C[C@H](C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@H](F)Br)CC3)CCN1	1826222515	ZYKNZBCHMVLTNW-LWINAJNOSA-N	433.303	1.272	50	20	IDGD	
O=C([C@@H]1C[C@@]1(F)Cl)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827055274	SYIMMCVHKPXLHT-UEXGIBASSA-N	436.720	1.524	50	20	IDGD	
CS(=O)(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](F)Br)CC2	1827211286	DKOLROSJWXEIHG-WRWORJQWSA-N	442.332	1.180	50	20	IDGD	
Cc1c(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)[C@H](O)CCl)CC2)cn2[nH]cnc(=O)c12	1829598058	QLRSAYAEKOHYQB-IAGOWNOFSA-N	449.939	1.164	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)/C(C)=C/c3cccs3)CCO2)C1	1829706993	ZTCVTWWCLYNVAQ-GDSHAZEPSA-N	442.965	1.862	50	20	IDGD	
CC(C)(C)n1cc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)[C@@H](O)CCl)CC2)nn1	1829784316	ARKBBKZZIZYMCM-IRXDYDNUSA-N	425.961	1.866	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1	1830307575	HDLDSZFBISISLC-MSOLQXFVSA-N	435.956	1.936	50	20	IDGD	
CCc1oncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)CBr)CCO2	1830538002	TVNCFWTZLGEQSC-FZKQIMNGSA-N	444.326	1.338	50	20	IDGD	
Cc1ccc2[nH]c(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)[C@H](O)CCl)CCO4)cc2c1	1830728581	VKTVGARPJJTJTE-WIYYLYMNSA-N	435.908	1.146	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ncccc3C)CCO2)C1	1831842209	RGXCVEWHHAQXMC-HNAYVOBHSA-N	440.338	1.634	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(O)n2)CC1	1831872400	UIVRHVGIKZQBPO-SFHVURJKSA-N	431.537	1.394	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3cc(C)cs3)CCO2)C1	1832985865	XJEUEHKYRMYDSH-XLIONFOSSA-N	444.981	1.699	50	20	IDGD	
N#Cc1ccc(CC(=O)NC2CCN(C3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)cc1	1833107559	BCMSLYSVSXBVMT-FQEVSTJZSA-N	432.952	1.272	50	20	IDGD	
O=C(/C=C/c1ccccc1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1835109604	BZFJJNVWLQXEJD-BUPXIBQPSA-N	441.297	1.847	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)CSCC(=O)OC)CC2)CC1	1836872321	RVAVCILOMCORJD-INIZCTEOSA-N	434.986	1.909	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)CCc3cnc[nH]3)CC2)CC1	1837138787	NYROJZWVUHSFDR-SFHVURJKSA-N	426.945	1.595	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccnc3SC)CCO2)C1	1838287207	FPMLOGCUXBUWIZ-HNAYVOBHSA-N	427.954	1.891	50	20	IDGD	
COCc1c[nH]c(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@](C)(Cl)CCl)C3)C2)c1	1838519101	ZTGJJSOZMKNQEW-MOPGFXCFSA-N	448.347	1.467	50	20	IDGD	
O=C(c1ccc(Cl)c(F)c1)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1	1839269670	QSMKIKOIIVVREY-CRAIPNDOSA-N	435.279	1.149	50	20	IDGD	
Cc1cccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)c1F	1840030756	VSYTVGGIZLSYKZ-LIRRHRJNSA-N	443.313	1.988	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1C[C@H]3CC[C@@H]1O3)CCO2	1840048173	SKDUTZRTVQFZHT-RGQDEETRSA-N	445.354	1.041	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(Cl)(Cl)Cl)C2)C1	1840155435	BVGWYHPNAKSNMF-MFKMUULPSA-N	438.135	1.067	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)/C=C/c3cccc(O)c3)C2)C1	1840155987	LTXFJZIRNLSZCT-WMDOEDGGSA-N	438.908	1.116	50	20	IDGD	
COC(=O)CCCCCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840190907	USPHDLBXTUKPLP-GOSISDBHSA-N	439.336	1.370	50	20	IDGD	
O=C(c1nc2ccc(C(F)(F)F)cn2n1)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1	1841350561	KFQAHWHXKXJVLL-LLVKDONJSA-N	431.802	1.165	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)CCOCCNC(=O)OC(C)(C)C)C1	1841515989	OQSDGFDPTVAHKA-OAHLLOKOSA-N	447.960	1.375	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC12CN(C(=O)c1ccc3c(c1)n(C)c(=O)n3C)C2	1846070496	MIZWRODPVQFOSM-AWEZNQCLSA-N	449.349	1.868	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H]1C[C@@H]2C[C@@H]2N1C(=O)OC(C)(C)C	1847573671	SOMLPQKCCAMGMA-UYLCUJDWSA-N	441.956	1.840	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CCNC(=O)c1ccc[nH]1	1848179229	FLWDSHZAVGCUMN-SNPRPXQTSA-N	425.327	1.510	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)C2CCN(S(=O)(=O)c3ccc4c(c3)OCCO4)CC2)n1	11333663	XVGKUKYXHXGDIJ-UHFFFAOYSA-N	447.517	1.409	50	20	IDGD	
Cc1nnc(NNC(=O)c2ccc(S(=O)(=O)Nc3ccc(Cl)cc3)cc2)[nH]c1=O	11335593	OPQIQRWBMMLXHC-UHFFFAOYSA-N	434.865	1.684	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)c2ccc3c(c2)C(=O)N(Cc2ccco2)C3=O)cc1	15888674	LWKLTKGZDYNCIS-UHFFFAOYSA-N	444.403	1.787	50	20	IDGD	
O=C(CSc1ccc(S(=O)(=O)N2CCCCC2)cn1)NNC(=O)c1ccccc1	22217617	GNIXLYPQEXEFBD-UHFFFAOYSA-N	434.543	1.810	50	20	IDGD	
COc1ccc(C(=O)NNc2nc(-c3ccncc3)no2)cc1S(=O)(=O)NC(C)C	110374462	OCZSDINHTYNANC-UHFFFAOYSA-N	432.462	1.584	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)CCNC(=O)c2ccc([N+](=O)[O-])cc2)c1C	196399343	VFCXQVNEMAQZSR-HNNXBMFYSA-N	428.445	1.946	50	20	IDGD	
COc1ccc([C@H](C)NC(=O)NNC(=O)CNC(=O)c2ccco2)cc1Br	725871076	FZMHYPAZRACGBJ-JTQLQIEISA-N	439.266	1.872	50	20	IDGD	
COc1ccc(OC)c(-n2nnnc2SCC(=O)NNC(=O)c2ccc(Cl)cc2)c1	726432334	JTNQGTRSQVUIAW-UHFFFAOYSA-N	448.892	1.886	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)[C@H](C)N2C(=O)NC3(CCCC3)C2=O)cc1	726498720	ZBOAWJSVPHQOHS-UONOGXRCSA-N	432.477	1.253	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)c1nccnc1C(=O)NCc1ccc(F)cc1	726522213	GDWBTHJLBGOMLR-UHFFFAOYSA-N	441.394	1.525	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1	726522414	JDRDYMRCIOLRTG-SNVBAGLBSA-N	440.254	1.904	50	20	IDGD	
C[C@@H]1CCCC[C@@]12NC(=O)N(CC(=O)NNc1ccc(S(=O)(=O)NC3CC3)cc1)C2=O	726867223	BCVPDIFQXYAYPV-ZUOKHONESA-N	449.533	1.071	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)c2csc(-c3cnccn3)n2)c2ccccc2c1=O	728265089	PRQLBWPRQIKECZ-UHFFFAOYSA-N	435.469	1.966	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN1c1ncnc2sccc12)c1ccc2c(c1)OCCO2	728462658	QLZYJOIRTGNOKJ-CQSZACIVSA-N	425.470	1.893	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)c2cccc(OC(F)F)c2)c1	728544604	HWMCFHZWOUYRDY-UHFFFAOYSA-N	431.392	1.752	50	20	IDGD	
CCS(=O)(=O)N1CCC(C(=O)NNC(=O)Cc2ccccc2F)(c2ccccc2)CC1	731330508	ZEAKCJUGWMWJEB-UHFFFAOYSA-N	447.532	1.899	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)cc1	732054484	XQQRYNOQKKXGAI-AWEZNQCLSA-N	432.458	1.796	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2occc2COc2cccc(C#N)c2)C[C@H](C)O1	732260376	DIRZXDXWHWHYSE-HOTGVXAUSA-N	426.473	1.991	50	20	IDGD	
O=C(NCC1(N2CCSCC2)CCCCC1)NNC(=O)c1ccc(-n2cnnn2)cc1	732705153	RTRQLBXWULYPLQ-UHFFFAOYSA-N	444.565	1.358	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)N2CCc3ccccc3C2)cc1Br	732749619	RVKBXKWACXPFPR-UHFFFAOYSA-N	440.319	1.995	50	20	IDGD	
C[C@@H]1CN(c2ccc(CNC(=O)NNC(=O)c3cnn(-c4ccccc4)c3)cn2)CCO1	733342514	YLFJIWFASARPDG-MRXNPFEDSA-N	435.488	1.637	50	20	IDGD	
COC(=O)CCCS(=O)(=O)NC(=O)/C(C#N)=C/c1cc(C)n(C[C@@H]2CCCO2)c1C	734090617	VLCTULHJXGVZDH-RLGUWMIQSA-N	437.518	1.590	50	20	IDGD	
CN(C)c1nccc(NNC(=O)C2=NN(c3ccccc3)[C@@H](C(=O)OC(C)(C)C)C2)n1	740112855	RFKNCVFRPXNGKI-MRXNPFEDSA-N	425.493	1.962	50	20	IDGD	
Cc1nc(N2CCOCC2)nc(O)c1CCC(=O)NNc1cccc(C(F)(F)F)n1	740140369	ZTGDPULLWHXZST-UHFFFAOYSA-N	426.399	1.817	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)CSc1nnc(-c2cccc(C)c2)n1CC	740850941	HLHIQJKSJBXJEH-UHFFFAOYSA-N	432.550	1.818	50	20	IDGD	
NS(=O)(=O)c1ccc(CNC(=S)NNC(=O)Nc2ccc(OC(F)F)cc2)cc1	741865988	IUNHJVWHAVGREK-UHFFFAOYSA-N	445.473	1.636	50	20	IDGD	
O=C(NNC(=O)c1c[nH]nc1-c1cccc(OC(F)F)c1)c1ccc(-n2cnnn2)cc1	742481475	YCZIFAZWXOEDPM-UHFFFAOYSA-N	440.370	1.729	50	20	IDGD	
CCOC(=O)[C@@H]1CCCN(C(=O)[C@@H](C)OC(=O)/C(C#N)=C/c2cc(C#N)n(C)c2C)C1	744632038	IXOKMNFVVLCZQZ-FENQTLIPSA-N	426.473	1.846	50	20	IDGD	
Cc1nc2c(C#N)cnn2c(C)c1CCC(=O)OCC(=O)NNC(=O)c1ccc(C#N)cc1	744705145	KDACWPWAADEIMF-UHFFFAOYSA-N	445.439	1.027	50	20	IDGD	
COc1cc(C=NNC(=O)C(=O)NC2CC2)ccc1OS(=O)(=O)c1ccc(C)cc1	744824125	ONIGECIHNUPXTM-UHFFFAOYSA-N	431.470	1.500	50	20	IDGD	
Cc1nn(-c2ccc(F)cc2)nc1C(=O)OCC(=O)NNC(=O)c1ccc(Cl)cc1	745465812	GZDFCQFCAZSVLA-UHFFFAOYSA-N	431.811	1.986	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)[C@H]1CN(Cc2nc(O)c3ccccc3n2)CCO1	746238729	QYNMQCWUXDCJOL-GOSISDBHSA-N	439.447	1.065	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1	746821191	NLTYHRYJDWUAQM-UHFFFAOYSA-N	445.379	1.982	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(N2CCCS2(=O)=O)cc1)c1ccc(Cl)cc1F	747617784	LPUHIMYSVYVVEG-UHFFFAOYSA-N	447.897	1.642	50	20	IDGD	
CSCC[C@@H](NC(=O)c1ccc([N+](=O)[O-])o1)C(=O)NNc1cc(Cl)nc(C)n1	748336488	WTVGOOLLKVJLOQ-SECBINFHSA-N	428.858	1.934	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)[C@@H]2CCCN2S(=O)(=O)c2cccs2)c1	749160540	LELYILYJMKJMAC-INIZCTEOSA-N	437.543	1.744	50	20	IDGD	
O=C(CCOc1ccccc1)NNC(=O)NCC(=O)N1CCN(c2ccccc2)CC1	749214631	CVRQXTROHNKOOP-UHFFFAOYSA-N	425.489	1.135	50	20	IDGD	
C[C@H](c1ccncc1)N1CCC(NC(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)CC1	749235366	AFINZHFKOBAVTE-CYBMUJFWSA-N	428.449	1.865	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(Cl)s1)NNC(=O)Cc1c[nH]c2ccccc12	749837034	BVJQQCBYRYNYGH-UHFFFAOYSA-N	426.907	1.551	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)N[C@@H]2CC(=O)N(C(C)C)C2)c2ccccc2c1=O	750644961	HAJDMHVGKDXUSU-OAHLLOKOSA-N	442.520	1.540	50	20	IDGD	
CC(=O)N1CCC(C(=O)NNc2nc3ccccc3c(=O)n2CCCOC(C)C)CC1	751894786	WSWWMNYHMXVZOS-UHFFFAOYSA-N	429.521	1.913	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)N[C@@H]2CCN(Cc3ccc(C#N)cc3)C2=O)cc1C	753722249	IPWSRYILMGTEQM-LJQANCHMSA-N	448.483	1.245	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)c(Cl)cc1F	755973637	AJVLBLASJKQSEG-UHFFFAOYSA-N	447.784	1.503	50	20	IDGD	
CN1CCC/C1=N\S(=O)(=O)c1ccc(NC(=O)NNC(=O)c2ccccc2O)cc1	756073161	NDHWFUCJSHCJLZ-HAVVHWLPSA-N	431.474	1.672	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)Nc1ccc(F)c(-n2nnnc2C)c1	756336284	UJDJUMYPYMSPMA-UHFFFAOYSA-N	429.412	1.740	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)CN2C(=O)NC3(C[C@H](C)C[C@@H](C)C3)C2=O)c1	756863759	MOBGECPBCSYOQK-CHWSQXEVSA-N	432.477	1.212	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)c2nn(CCC(C)C)c(=O)c3ccccc23)c(=O)n(C)c1	757719786	LSHDHFYZDDWESD-UHFFFAOYSA-N	438.488	1.916	50	20	IDGD	
CC(C)C[C@H](Cc1cccc(Br)c1)C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O	758043062	DOINZSALRIGZEN-TZMCWYRMSA-N	448.383	1.739	50	20	IDGD	
Cc1c(C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cnn1CCO[C@@H]1CCCCO1	758053177	FLWWEPXOURKPCB-RBUKOAKNSA-N	430.461	1.336	50	20	IDGD	
COC(=O)[C@@H](c1cc(F)c(F)c(F)c1)N(C)CC(=O)NNC(=O)Cc1nc(C)cs1	759767371	KWGKNPYGJXGRPF-QGZVFWFLSA-N	444.435	1.405	50	20	IDGD	
NC(=O)CC[C@@H](NC(=O)OCc1ccccc1)C(=O)NNc1ncnc2ccsc12	760173955	YXLFXIMMMGWQMF-CQSZACIVSA-N	428.474	1.695	50	20	IDGD	
NC(=O)[C@@H]1CC[C@H](CNC(=O)NNC(=O)c2cn(-c3ccccc3)nc2-c2ccccc2)O1	760205197	XLRBNVCXJYLBEE-MJGOQNOKSA-N	448.483	1.516	50	20	IDGD	
C[C@H]1CN(C(=O)OC(C)(C)C)CC[C@H]1NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	763132883	MOIPFOLXWJRETD-XJKSGUPXSA-N	444.496	1.252	50	20	IDGD	
Cc1c(F)cc(C(=O)O)cc1S(=O)(=O)NNC(=O)CCCNC(=O)OC(C)(C)C	763432639	HRSLUKTUTXNOOT-UHFFFAOYSA-N	433.458	1.447	50	20	IDGD	
C[C@@H]1CN(C(=O)c2ccc(NC(=O)C(=O)NNC(=O)c3ccccc3O)cc2)C[C@@H](C)O1	763527256	OGOGUSVWOYQSIH-ZIAGYGMSSA-N	440.456	1.041	50	20	IDGD	
COC(=O)c1c(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)sc(C)c1C	763569855	CLRUFHJQVVYIHZ-ZDUSSCGKSA-N	433.442	1.077	50	20	IDGD	
Cc1cn(C2CCCCC2)nc1NC(=O)C(=O)NNC(=O)[C@H]1COc2ccccc2O1	763574432	BDQDLFRMSGLTEI-QGZVFWFLSA-N	427.461	1.623	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cnn(-c3ncccn3)c2)c(C)n1-c1ccccc1	763600690	AHZVVNGNJDYGHN-UHFFFAOYSA-N	444.455	1.470	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1)C(=O)Nc1cccnc1	763611521	ABZRMZFXEBDLKO-UHFFFAOYSA-N	442.439	1.183	50	20	IDGD	
COCCOc1c(Cl)cccc1NC(=O)C(=O)NNC(=O)c1c(C)nc2ccccn12	763629002	NPBNQLQUDNACEJ-UHFFFAOYSA-N	445.863	1.721	50	20	IDGD	
Cc1ccc(C(N)=O)cc1NC(=O)C(=O)NNC(=O)COc1ccccc1-c1ccccc1	763643365	DOTUVYUTKXSKSH-UHFFFAOYSA-N	446.463	1.926	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(NC(=O)C(C)C)ccc1C	763657434	MAKSBMLGIYEMHE-UHFFFAOYSA-N	442.472	1.763	50	20	IDGD	
CCCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2cc(C)ccc2C)cc1	763665560	JWMQEXZYAQATQM-UHFFFAOYSA-N	426.473	1.608	50	20	IDGD	
CC1(C)Cc2cc(NC(=O)C(=O)NNC(=O)COc3ccccc3[N+](=O)[O-])ccc2O1	763802844	BGGMGSKZPHSELL-UHFFFAOYSA-N	428.401	1.473	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(OC)c(OC)cc2C(=O)OC)cc1	763835030	UQNKQYZKZZJREY-UHFFFAOYSA-N	429.429	1.453	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccc(OCc2cccnc2)cc1	763838242	QXAIOTRHNYGROX-UHFFFAOYSA-N	438.415	1.965	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc3ccccc3c2)nn1CCC#N	763856147	YQGLKKZJVBLDQU-OAHLLOKOSA-N	434.456	1.812	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(S(C)(=O)=O)cc2)cc1	763862209	VNDUKBDOCRCRPP-CYBMUJFWSA-N	449.485	1.042	50	20	IDGD	
Cc1c(Br)cccc1NC(=O)C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	763921796	OYDSDZAPRPBZAV-UHFFFAOYSA-N	444.249	1.133	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Br)s2)cc1OC	763940950	MZKCJJBIRICNLW-UHFFFAOYSA-N	428.264	1.928	50	20	IDGD	
Cc1nc(-c2cccc(NC(=O)C(=O)NNC(=O)c3nn(-c4ccccc4)cc3O)c2)no1	763944096	MDTCVDSPBOXGDB-UHFFFAOYSA-N	447.411	1.336	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)C(=O)Nc1cccc(-c2ncco2)c1	763951158	ZGXKWRVTUGYZMV-UHFFFAOYSA-N	432.396	1.633	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2cnn(Cc3ccc(Cl)cc3)c2)c1O	764132703	POBLYFZLUXZKPJ-UHFFFAOYSA-N	443.847	1.699	50	20	IDGD	
CCOc1cc(Br)ccc1NC(=O)C(=O)NNC(=O)[C@@H]1Cc2ccccc2O1	764166637	FMEVIKOVUOGJIZ-INIZCTEOSA-N	448.273	1.937	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)Cc2cccnc2)cnc(Cl)c1Br	764263409	HTVIPQTVQJFYDQ-UHFFFAOYSA-N	426.658	1.530	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)C(=O)Nc1ccc(CC(=O)Nc2ccccc2F)cc1	764298145	OTNHHXBDLPWWDQ-UHFFFAOYSA-N	438.419	1.438	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(NC(=O)C(=O)NNC(=O)C(C)(C)c2ccccc2)c1	764301333	BDGQWIOZQITRFZ-UHFFFAOYSA-N	432.502	1.001	50	20	IDGD	
C[C@H]1CN(Cc2ccccc2NC(=O)C(=O)NNC(=O)Cc2ccccc2F)C[C@@H](C)O1	764313327	KYIKHEQLXNILLO-IYBDPMFKSA-N	442.491	1.764	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)c1cn(-c2ccccc2)nc1-c1cccnc1	764344991	NEBCJFKJNZVAFC-UHFFFAOYSA-N	441.451	1.520	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)COCc2ccccc2)cnn1-c1ccccc1F	764365767	AKWVGGDMKHZBPR-UHFFFAOYSA-N	425.420	1.623	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)NCCc3ccccc3)cc2)o1	764369574	IFWNFGCHUKJNGA-UHFFFAOYSA-N	434.452	1.960	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)ccc1N1CCOCC1	764377373	CQRKFEMSLZAVTH-UHFFFAOYSA-N	448.426	1.589	50	20	IDGD	
COCCn1ncc2ccc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc3ccccc3)cc21	764379601	FWSGKVLXMHWQDL-UHFFFAOYSA-N	447.398	1.440	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1cc(F)cc(F)c1OC	764396805	CAPMKHLZGKOHKA-UHFFFAOYSA-N	425.413	1.860	50	20	IDGD	
O=C(NN=Cc1ccn(-c2ccccc2)n1)c1cccc(S(=O)(=O)N2CCOCC2)c1	766678837	QHTGXMOCMTXTRI-UHFFFAOYSA-N	439.497	1.657	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)c2nccc3c(S(N)(=O)=O)cccc23)cc1	768460170	KZQXOXZAIOPJQY-UHFFFAOYSA-N	430.511	1.744	50	20	IDGD	
CC1(C)CCC[C@@]2(C1)NC(=O)N(CC(=O)NNC(=O)Cn1cnc3ccccc31)C2=O	768565042	ABNNGDUFNWJZRU-NRFANRHFSA-N	426.477	1.075	50	20	IDGD	
COc1ccc2c(c1)nc(CNC(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)n2C	770561754	LUAMPILUPAVKHO-UHFFFAOYSA-N	434.497	1.717	50	20	IDGD	
O=C(NNc1ccc(Br)c(F)c1)C(=O)Nc1cccnc1N1CCOCC1	770816587	ZWHXIVSMWBIUKM-UHFFFAOYSA-N	438.257	1.902	50	20	IDGD	
COc1ccc(C(=O)NNc2nc(O)c3cnn(C)c3n2)cc1I	770983646	NXOGUJIJRHGJIT-UHFFFAOYSA-N	440.201	1.439	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)c1nc2ncc(Br)cn2n1	772998359	XIEWQBMQUGGBQT-MRVPVSSYSA-N	439.657	1.769	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1ccn(Cc2ccccc2)n1	773389382	GVMGVTYHKDDSAR-UHFFFAOYSA-N	446.511	1.150	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)C(=O)Nc2ccc(OCC(F)F)c(C(F)(F)F)c2)cn1	773544891	FTGMBMKHBQRNSA-UHFFFAOYSA-N	435.309	1.483	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)NC[C@H]2CC[C@H](C(=O)N(C)C)O2)cc1Cl	774773229	WLHFAGDSYIBSLE-ZWNOBZJWSA-N	443.888	1.329	50	20	IDGD	
C[C@@H](CNC(=O)NNc1cccc(S(C)(=O)=O)c1)N1CCN(c2ccccc2)CC1	776616589	IATMDFKYLKFKSM-KRWDZBQOSA-N	431.562	1.927	50	20	IDGD	
CC(=NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1)c1cc(C(=O)O)c(C)nc1C	776724446	SULIZGADTDHAMA-UHFFFAOYSA-N	432.502	1.866	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)[C@H](O)[C@@H](O)c1nc2ccccc2s1	779511854	SVSLOLQKWBRELA-IAGOWNOFSA-N	448.526	1.275	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)[C@@H]1CCCN1c1ncnc2sccc12	780973667	FDNFWDMKXKMMSL-ZDUSSCGKSA-N	434.522	1.722	50	20	IDGD	
CC(=O)N1CCN(c2cccc(NC(=O)NNC(=O)c3c(C)nc4ccccn34)c2)CC1	782081107	DXRJETNGHROUBR-UHFFFAOYSA-N	435.488	1.778	50	20	IDGD	
CC(=O)N1CCN(c2cccc(NC(=O)NNC(=O)COCc3ccccc3)c2)CC1	782084083	VBQAYHFLUMIJQS-UHFFFAOYSA-N	425.489	1.725	50	20	IDGD	
CCOc1cccc2[nH]cc(CC(=O)OCC(=O)NNC(=O)Cc3nc(C)cs3)c12	782457939	HCIWZSFNXQFVDF-UHFFFAOYSA-N	430.486	1.807	50	20	IDGD	
CC(C)CNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(O)cc2)cc1Cl	782832801	TWNCELJYDSXXLD-UHFFFAOYSA-N	432.864	1.831	50	20	IDGD	
CN(Cc1ccccc1)c1ccccc1NC(=O)C(=O)NN[C@@]1(C)CCS(=O)(=O)C1	783425876	JIHGDJTVHJSEHQ-NRFANRHFSA-N	430.530	1.460	50	20	IDGD	
CN1CCN(c2ccccc2NC(=O)C(=O)NNc2ccc(Br)nc2)CC1	784806471	HXQACFCOBMXZKY-UHFFFAOYSA-N	433.310	1.678	50	20	IDGD	
COc1ccc(C#N)cc1NC(=O)C(=O)NNc1c(F)cc(C(=O)NC2CC2)cc1F	785099288	CSHVXRKGXOICHL-UHFFFAOYSA-N	429.383	1.819	50	20	IDGD	
Cc1cc(NC(=O)COC(=O)/C(C#N)=C/c2ccccc2)n([C@@H]2CCS(=O)(=O)C2)n1	785343399	FFQJUZBAGCKWNX-BRVCPTFNSA-N	428.470	1.640	50	20	IDGD	
O=C([C@H]1[C@H]2CC[C@@H](O2)[C@@H]1C(F)(F)F)N1CCN(S(=O)(=O)CBr)CC1	785626689	XJBIHTIDNCSVDH-ZNSHCXBVSA-N	435.262	1.169	50	20	IDGD	
O=C(COC(=O)C1(Cc2ccccc2F)CC1)NNC(=O)[C@@H]1COc2ccccc2O1	785808618	HJKGNOYFVZOJBT-SFHVURJKSA-N	428.416	1.679	50	20	IDGD	
CN(CC(=O)NNC(=O)C1CC1)Cc1cccc(Br)c1OCC(C)(C)O	786450620	WTIOYERLRFVNOP-UHFFFAOYSA-N	428.327	1.588	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N2CCOCC2)cc1NS(=O)(=O)CCCCCl	788045943	CXSZOZQLGNXWQX-UHFFFAOYSA-N	440.971	1.867	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNS(=O)(=O)CCCCCl	788063469	UKIFLAOCNMUOIM-UHFFFAOYSA-N	437.393	1.427	50	20	IDGD	
Cc1nc2cc(C(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)ccc2n1Cc1ccsc1	788427230	FHIIGKSSULRJFK-OAHLLOKOSA-N	432.527	1.650	50	20	IDGD	
C[C@@](O)(CN1C(=O)NC2(CCCC2)C1=O)C(=O)NNC(=O)c1cc2c(s1)CCCCC2	790070226	MGCGJAGVYRJKLH-HXUWFJFHSA-N	448.545	1.394	50	20	IDGD	
CCCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNc2cccc(F)c2[N+](=O)[O-])cc1	790994393	WJXIQJSZNHOULZ-UHFFFAOYSA-N	439.425	1.967	50	20	IDGD	
CN1CCCN(c2ccc(NC(=O)C(=O)NNc3cccc(F)c3[N+](=O)[O-])cc2)CC1	790998342	KGZSMJJDIOSFSB-UHFFFAOYSA-N	430.440	1.958	50	20	IDGD	
CS(=O)(=O)c1c(F)cc(NC(=O)C(=O)NNc2cccc(F)c2[N+](=O)[O-])cc1F	790998963	MGDGIQZUKFFRBR-UHFFFAOYSA-N	432.336	1.497	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)cc(-n2cccn2)c1	792352246	FYAAFWPBMUULIF-UHFFFAOYSA-N	447.455	1.096	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)NCc2cccc(S(=O)(=O)N3CCCCC3)c2)n1	792890583	KSUYLQNOVYRHBB-UHFFFAOYSA-N	431.518	1.709	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(CC(=O)NNC(=O)c2cc(-c3ccccc3)on2)cc1	792893474	CCUZHIBZZYKQRY-UHFFFAOYSA-N	428.470	1.596	50	20	IDGD	
C[C@@H]1CCN(C(=O)OC(C)(C)C)[C@H](C)[C@@H]1NCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	796646446	BOLGNUPDNIXAGK-HBUWYVDXSA-N	449.508	1.979	50	20	IDGD	
CNC(=O)COc1ccc(NC(=O)C(=O)NNc2nc(C(F)(F)F)cs2)c(C)c1	797095657	XNLRAYJVGXKWED-UHFFFAOYSA-N	431.396	1.677	50	20	IDGD	
COc1cc(C)c(NC(=O)C(=O)NNC(=O)CNC(=O)OCc2ccccc2)cc1F	797368969	KMEABBJQYVLXLF-UHFFFAOYSA-N	432.408	1.155	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3[nH]nnc3-c3ccccc3)CC2)cc1	797743012	NDZVLDCDCJTOKC-UHFFFAOYSA-N	433.516	1.359	50	20	IDGD	
Cc1ccc(-c2ccnn2C)cc1NC(=O)C(=O)NNC(=O)c1cnn(-c2ccccc2)c1	799258696	GTSZBEXEMWOXNO-UHFFFAOYSA-N	443.467	1.981	50	20	IDGD	
COC(=O)CCc1c(C)nn(-c2ccc(C(=O)NNC(=O)N=c3cc[nH]cc3)cc2)c1C	802030819	SPFZXIDMDKZXDQ-UHFFFAOYSA-N	436.472	1.878	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cnn(C)c2-c2ccccc2)o1	806977310	DHFFXGMHYJDVDS-UHFFFAOYSA-N	438.488	1.922	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)C(=O)Nc1cccc2cc(Br)cnc12	806979351	ZMXNJOIWXDHGHF-UHFFFAOYSA-N	428.246	1.721	50	20	IDGD	
COCC[C@H](Cc1cccc(Br)c1)C(=O)NNC(=O)N1CCN(C)CC1	807380844	SMIVKPIJMOESBR-OAHLLOKOSA-N	427.343	1.633	50	20	IDGD	
CCCNS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2C)cc1	807455006	DBRNTRMVLMSMMY-UHFFFAOYSA-N	435.462	1.673	50	20	IDGD	
C[C@@H](CN(C)C)NC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	807576790	WZQMTNOMAOSIPG-HNNXBMFYSA-N	433.534	1.059	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)CCCn1c(C)cc(=O)cc1C	809980017	GHTDGEXCGBTQHC-UHFFFAOYSA-N	433.534	1.308	50	20	IDGD	
Cc1ncsc1C(=O)NNC(=O)C(=O)Nc1ccc(Br)c([N+](=O)[O-])c1	810386606	JMRDKXSEOIONLV-UHFFFAOYSA-N	428.224	1.522	50	20	IDGD	
Cc1cc(C)nc(-n2nc(C(=O)NNc3ccc(S(=O)(=O)N(C)C)cc3)cc2C)n1	812727003	CLHMPHFOTMPMPJ-UHFFFAOYSA-N	429.506	1.595	50	20	IDGD	
CN(C)c1ccc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)N(C)C)cc1Cl	815752534	WGUWEJKRBRBYCI-UHFFFAOYSA-N	439.925	1.738	50	20	IDGD	
Cn1nc(Br)cc1C(=O)NNC(=O)[C@H]1CCCN(C(=O)OC(C)(C)C)C1	816509897	GEFIUFSAGKLWSC-JTQLQIEISA-N	430.303	1.591	50	20	IDGD	
Cc1ncc(S(N)(=O)=O)cc1C(=O)NNC(=O)c1sc(-c2ccccc2)nc1C	816827417	REHLDUXEEJNXHL-UHFFFAOYSA-N	431.499	1.544	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)c2ccc(S(N)(=O)=O)cn2)c1	818750984	UHKYBXHSTQSBFV-UHFFFAOYSA-N	429.252	1.035	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)N2CC(CN3CCN(C)CC3)C2)c(C)n1C[C@@H]1CCCO1	820458392	DSBLSIQVVNYVOS-TYBHGIAWSA-N	425.577	1.897	50	20	IDGD	
O=C(COC(=O)COc1cccc2ccccc12)NNC(=O)[C@H]1COc2ccccc2O1	844161233	CSYFQDOFNJHRPO-HXUWFJFHSA-N	436.420	1.749	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)NC[C@H]2CCCO2)c1)c1ccc([N+](=O)[O-])cc1	912764978	SFQOEOCAEYVETG-MRXNPFEDSA-N	448.457	1.127	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)CNS(=O)(=O)c2ccc(Cl)c(Cl)c2)cc1	913431557	RNVNYFLTPKECFX-UHFFFAOYSA-N	445.328	1.840	50	20	IDGD	
Cc1nnnn1[C@@H](Cc1cccc(F)c1)C(=O)NNC(=O)c1ccc2c(c1)OCCO2	915695949	CVUJELSYUDZWDK-INIZCTEOSA-N	426.408	1.137	50	20	IDGD	
O=C(NNC(=O)c1ccccc1OCCOc1ccccc1)N[C@H]1CCS(=O)(=O)C1	915880281	DQLSLTPDNQQUSU-HNNXBMFYSA-N	433.486	1.276	50	20	IDGD	
NS(=O)(=O)c1ccc(CCNC(=O)NNC(=O)CCSc2ccc(F)cc2)cc1	915883752	HJTQEZNGCUVPLM-UHFFFAOYSA-N	440.522	1.528	50	20	IDGD	
CN(C)[C@@H](CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)c1ccccc1	915891199	KTEUXQBNFGSKOD-SFHVURJKSA-N	433.534	1.184	50	20	IDGD	
O=C(NNC(=O)c1cnn2c(-c3ccccc3)ccnc12)c1ccc(-n2cnnn2)cc1	916144534	CTCAHEMPFDQHNR-UHFFFAOYSA-N	425.412	1.447	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)NCCNC(=O)c2ccccc2Cl)cc1C	916263542	JEOYJCHKGOCUOM-UHFFFAOYSA-N	431.880	1.656	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)NCCNS(C)(=O)=O)c3ccccc3n2)cc1	916294252	GXMGDSTXMKTTCX-UHFFFAOYSA-N	441.513	1.703	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)c3ccnc(C)n3)c2)cc1	917392133	RNTLRYUVIDCUCM-UHFFFAOYSA-N	441.469	1.669	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)N[C@H](c1ccc(F)cc1)[C@@H]1CCCO1	918126137	HCOLGWYNWVJRRZ-DLBZAZTESA-N	449.508	1.983	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)NCc1cccc(CN2CCOCC2)c1	918223452	HQCQTURIKDVDRJ-UHFFFAOYSA-N	428.489	1.437	50	20	IDGD	
CCCn1c(CCC(=O)NNC(=O)CC(F)(F)F)nc2cc(S(N)(=O)=O)ccc21	918365516	BDSQSBCZPJTAED-UHFFFAOYSA-N	435.428	1.126	50	20	IDGD	
COCCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N[C@@H](C)c2ccccc2)c1	920862461	IBOMBZOLAORPLD-HNNXBMFYSA-N	434.518	1.707	50	20	IDGD	
Cc1ccc(CCNC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)c(C)c1	920920696	RHVPNLNLFWZJHF-UHFFFAOYSA-N	446.577	1.503	50	20	IDGD	
CS(=O)(=O)c1ccc(OCCCCC(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1	921279621	VNOGGMHAWACFEW-UHFFFAOYSA-N	448.497	1.872	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)c1sccc1S(=O)(=O)N1CCSCC1	921303366	LIFIHOGYTQIJET-UHFFFAOYSA-N	425.557	1.869	50	20	IDGD	
CC1(C)CCC[C@]2(C1)NC(=O)N(CC(=O)NNC(=O)c1cncn1-c1ccccc1)C2=O	1253190072	IKJPEYSYAJYWLF-JOCHJYFZSA-N	438.488	1.524	50	20	IDGD	
COc1ccc(S(=O)(=O)N[C@H](C)C(=O)NNC(=O)c2cncn2-c2ccccc2)cc1	1317709849	IVXMOWOGAZGYJG-CQSZACIVSA-N	443.485	1.009	50	20	IDGD	
O=C(Cn1nc2n(c1=O)CCCCC2)NNc1cc(C(F)(F)F)nc(-c2cccnc2)n1	1318501216	JIFIBEDWRLNZTF-UHFFFAOYSA-N	448.409	1.785	50	20	IDGD	
COCc1nc(CNC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)cs1	1323986529	UNCCOEGOYXTYOS-UHFFFAOYSA-N	426.524	1.035	50	20	IDGD	
C[C@](O)(Cn1cc(C(F)(F)F)ccc1=O)C(=O)NNc1cncc(Br)c1	1324952820	GPUFKYHMOZQZKQ-AWEZNQCLSA-N	435.200	1.919	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4c(cnn4C)c3)C2)C1	1778025391	ZGBXZDPRDJORDT-BFUOFWGJSA-N	435.322	1.800	50	20	IDGD	
O=C1Nc2c(cccc2C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](F)Cl)C2)C1=O	1778025412	ALIWFNCTPVKQIB-JOTOCRJQSA-N	437.855	1.483	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2nc[nH]c2[N+](=O)[O-])C1	1778061793	VGZVMYWFBVCISA-KZULUSFZSA-N	427.889	1.710	50	20	IDGD	
O=C(c1cc2cnccc2[nH]1)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1778678175	SBXHJNPOPUHHQM-YOEHRIQHSA-N	425.258	1.697	50	20	IDGD	
CCOc1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)nn1	1781230927	BEMCTCFHOMNWMW-ROUUACIJSA-N	431.320	1.555	50	20	IDGD	
O=C(c1cc2cccnn2c1)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781332405	GZSBMDKOOGRLRC-WMLDXEAASA-N	425.258	1.468	50	20	IDGD	
CC(=O)N[C@@](C)(C(=O)N1CC[C@]2(CN(C(=O)[C@@H](F)Cl)CCO2)C1)c1ccccc1F	1781415934	IGVAIJQNQWHAFQ-AHRSYUTCSA-N	443.878	1.541	50	20	IDGD	
CC(=O)N[C@@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)CBr)C2	1781781901	OOIJVLRXICUZNL-FHKFTOANSA-N	432.359	1.056	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnn3cccnc13)C2	1782175699	PFKKTIWKDFKTML-RZQQEMMASA-N	435.912	1.111	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccc4c(n3)OCCO4)CCO2)C1	1783534164	FWDZGLUIHYCKHN-KPZWWZAWSA-N	440.294	1.080	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ncn(-c4ccccc4)n3)CCO2)C1	1783534200	GKCYTQKRIBYTSZ-KUHUBIRLSA-N	448.321	1.494	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cc(Cl)cnc3OC)CCO2)C1	1783869307	OSBXWYARNAIIJO-KBXCAEBGSA-N	432.304	1.441	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3c(C)nc4sccn34)CCO2)C1	1783878498	ZDPWFFJFESTSRZ-FZKQIMNGSA-N	426.926	1.402	50	20	IDGD	
O=C(C(Cl)Cl)N1CC[C@]2(C1)CN(C(=O)[C@H]1CC(c3ccccc3)=NO1)CCO2	1783942050	GUMOQXZBELSTQW-BEFAXECRSA-N	426.300	1.813	50	20	IDGD	
Cc1nn(C)cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)CBr)C[C@@H]21	1784720796	IVRRVSLVZVWNHN-XTBFLFJDSA-N	427.343	1.353	50	20	IDGD	
CN(C)c1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Br)C[C@@H]32)nc1	1785749352	PQXJHVPASIVTOU-DLKVLKDVSA-N	443.317	1.431	50	20	IDGD	
Cc1nn[nH]c1C(=O)Nc1ccc(C2(NC(=O)c3cnccc3C(=O)NN)CCC2)cc1	1788345124	DCDRJDICXLUVGI-UHFFFAOYSA-N	434.460	1.173	50	20	IDGD	
CCCC(=O)N[C@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)CBr)C[C@@H]21	1788738716	GLLCIZKEPBTRHB-QRJUGERDSA-N	446.386	1.302	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CCOC3)C[C@@H]21	1790695523	NKHOSQKAWXAKMS-OQWVWTCMSA-N	445.466	1.888	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)CCSC)[C@H]2C1	1791308793	NQKOHGUIUVHHHM-YTFOTSKYSA-N	437.400	1.254	50	20	IDGD	
Cc1cnn([C@@H](C)C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Br)C[C@@H]32)c1	1791597581	QZXIQUPQSNPECR-YTFOTSKYSA-N	431.306	1.423	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(F)cc(C(F)(F)F)c1)C2)[C@@H](O)CCl	1792979736	DHJOHYBKIRYUAU-JLUCKKNBSA-N	438.805	1.647	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1c(C)nn(C)c1C	1793757819	GJMPWSPPLZWFLO-XTUBRDOVSA-N	439.520	1.423	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1nc(Cl)ccc1F	1794234885	AHYMDVBPINODMT-XXEYQXHCSA-N	438.656	1.768	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](Br)Cc1ccccc1)C2)c1cocn1	1794939798	UJWRJZLUGVBHDA-DFGXFYAUSA-N	448.317	1.884	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnc(N(C)C)o1	1794945826	ZSGDSJODYBMERD-JWBKOJIWSA-N	441.492	1.126	50	20	IDGD	
CC(C)(C)CCCCCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(B(O)O)c1	1795741431	XGOOIXNYDGVRDU-HATOLVCRSA-N	444.381	1.566	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnc2sc(C)cn2c1=O	1797606429	UAVAZEJMHWQYNK-QVHKTLOISA-N	438.937	1.570	50	20	IDGD	
COc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)CBr)C3)ccn1	1798120293	IGMDEDQTDGHFNX-OEYIWLLWSA-N	426.311	1.324	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CC12CCCN1CCC2	1799211565	OFSCFFZQYOFMCG-XLMAVXFVSA-N	442.398	1.626	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)nc(Cl)c1)C2)[C@@H](F)Br	1799347107	FDCLQJJIGLXOPT-OTMMVIPVSA-N	436.665	1.334	50	20	IDGD	
CC(C)n1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)n1	1799453927	JNOQUUNQDUVRNU-QDMKHBRRSA-N	425.493	1.028	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(Cl)c(F)c1	1799482101	ZRSPTPDMXGGTCU-HBCWATKFSA-N	440.903	1.055	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(O)cc1F	1799562416	BYHSSCUYJLANSF-LSSIXWDNSA-N	429.286	1.766	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Cc1ccc(F)cc1)C2	1800979734	YAVHHRQYUNERIL-DRACIFKTSA-N	426.916	1.848	50	20	IDGD	
COC(=O)CCCCCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2	1801075220	LCPBQLJCOXBEMJ-VZAMPYOESA-N	437.306	1.390	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cn3ccsc3n2)[C@@H]1c1cccnc1)[C@H](O)CCl	1803142875	LOCXVPMJOMDRJB-NUEKZKHPSA-N	433.921	1.710	50	20	IDGD	
O=C1COc2ccc(C(=O)N3CCC4(CCCN(C(=O)[C@@H](O)CCl)C4)CC3)cc2N1	1805524611	VVHAQIRUAAZYIB-INIZCTEOSA-N	435.908	1.462	50	20	IDGD	
O=C(CCBr)NC[C@@H]1CCN(C(=O)CN2CCOCC2)[C@H]1c1cccnc1	1806340849	OMIGTWUYOSHHDS-LPHOPBHVSA-N	439.354	1.205	50	20	IDGD	
O=C(CCBr)NC[C@@H]1CCN(C(=O)c2cc[n+]([O-])cc2)[C@H]1c1cccnc1	1806344295	ZNSCJHPXAPNCHN-WMZOPIPTSA-N	433.306	1.820	50	20	IDGD	
O=C(Cc1ccc2c(c1)OCO2)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1	1806674274	DCXRNFMQAUESRL-XGHQBKJUSA-N	445.903	1.659	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC2(CCCN(C(=O)C[C@H](NC)C(=O)O)C2)CC1	1809839106	MNTUVQUXUKBRLB-KBPBESRZSA-N	432.359	1.454	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)/C=C\C(=O)NC2CC2)[C@@H]1c1cccnc1	1810134955	SCNQTLZETLGGMK-VIUWEYCZSA-N	434.924	1.176	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)c1cncc2cnccc12	1811295756	TYFARWKHEOCIBP-RYGJVYDSSA-N	439.903	1.944	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2ccccc2F)[C@H]1c1cccnc1	1811679932	AHBPUMFEZBQPDN-VGOFRKELSA-N	441.507	1.913	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)CC(F)(F)F)[C@H]1c1cccnc1	1813071888	VSUSWHCTVNSPPR-KSSFIOAISA-N	429.443	1.413	50	20	IDGD	
O=C(/C=C\C(=O)N1CC[C@@H](CNC(=O)C(Cl)Cl)[C@@H]1c1cccnc1)NC1CC1	1813076905	BGWYUOBDSNAWTH-HSYSNWJFSA-N	425.316	1.726	50	20	IDGD	
O=C(N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1)C1=CCCS1	1815337177	NXMCDRJIUPVJHV-ZDUSSCGKSA-N	429.332	1.070	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](O)C(=O)N[C@H]1CCc2nc(NC(=O)[C@H](F)Cl)sc2C1	1817128483	LXKAVIIRHSXUTQ-LCWDIZFYSA-N	436.893	1.433	50	20	IDGD	
Cc1cncc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cnccc3C(=O)NN)n[nH]2)c1	1819402136	PBOOMXMOXKUQTR-SFHVURJKSA-N	448.487	1.731	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1nccs1)CC2	1819794871	FXLGURMUVPNVLI-SECBINFHSA-N	443.514	1.138	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](C)N2CCN(C)CC2)n[nH]1	1820793746	SLEWRZOYISJLBR-BFYDXBDKSA-N	440.976	1.292	50	20	IDGD	
COc1ccc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@H](F)Br)CC3)nn1	1821069389	PJZBGQZGPCRSOK-KRTXAFLBSA-N	444.286	1.858	50	20	IDGD	
COc1ccnc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@@H](O)CCl)CC3)c1OC	1821792963	BPOABTFJRCSFEI-KOLCDFICSA-N	440.909	1.381	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CSc2nc[nH]n2)[nH]n1	1822374523	MQDFKLKVTQGKBR-CMPLNLGQSA-N	427.918	1.566	50	20	IDGD	
Cc1nc(CC(=O)N2CCCC[C@@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)cs1	1822410305	DXEGBSCBYJXSCE-MRXNPFEDSA-N	447.565	1.782	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H](C)CS(C)(=O)=O)CC1	1824529037	YZFDYNJHWQTSLX-BHYGNILZSA-N	437.002	1.541	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2cccnc2)CC1	1825280329	SVRLWGDCSWEIGC-JJNABOQBSA-N	447.344	1.708	50	20	IDGD	
Cc1ncccc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1	1825842382	CAJYFDSVXZCRPO-JOCHJYFZSA-N	435.333	1.617	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@H](C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@H](O)CCl)CC3)C1	1825973636	AHSTTYDDYWTOAY-KZVDOYCCSA-N	443.953	1.634	50	20	IDGD	
Cc1cc(C)nc(C(=O)N[C@@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)c1	1826085438	UAOINTVOIOXGQP-CQSZACIVSA-N	444.561	1.754	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)Cc2cscn2)CC1	1827124871	CDZOOEBZRHLTTC-HXUWFJFHSA-N	441.362	1.299	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC[C@H]1C1CCN(C(=O)Cn2ccncc2=O)CC1	1831655961	GKHLFXWWOLVGNV-ZBFHGGJFSA-N	439.354	1.646	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)C(C)(F)F)CCO2	1831686478	GVAIPAHUAPTBOM-FZKQIMNGSA-N	426.888	1.378	50	20	IDGD	
O=C(COc1ccc(O)nn1)N1CCC([C@H]2CCCCN2C(=O)C(Cl)Cl)CC1	1831879886	IPSZXOKVJPMCQR-CYBMUJFWSA-N	431.320	1.984	50	20	IDGD	
CC(C)N(C)CC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1	1832418386	LYGDRWIKLCFSHL-FQEVSTJZSA-N	444.580	1.259	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(F)s3)CCO2)C1	1833212456	VDMJPEXJMADJBA-SJCJKPOMSA-N	449.342	1.988	50	20	IDGD	
C[C@@H](Nc1ccccc1)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)CCl)CC2)CC1	1833309874	CECKKTGUNXYMTF-UZLBHIALSA-N	436.984	1.658	50	20	IDGD	
CC[C@H](C)[C@@H](O)C(=O)NC1CCN(C2CCN(C(=O)CO[Si](C)(C)C)CC2)CC1	1833499162	WZHKDZDPPMOKBK-OXJNMPFZSA-N	427.662	1.817	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)nc1C	1833695098	FMBCOLWVUFENJY-KUHUBIRLSA-N	440.338	1.552	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccns3)CCO2)C1	1833779015	PQINPVFPHZFSHV-BLLLJJGKSA-N	432.340	1.387	50	20	IDGD	
Cc1cnc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)s1	1833802530	MOYYODDODBTIQB-GOSISDBHSA-N	427.599	1.373	50	20	IDGD	
Cc1noc(C)c1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1	1834069049	REKILENUKOCBDE-ZWKOTPCHSA-N	434.320	1.598	50	20	IDGD	
Cn1ncnc1C(=O)NC1CCN(C2CCN(C(=O)[C@](C)(Cl)CCl)CC2)CC1	1834075726	PRKBVNFIVLEAEI-GOSISDBHSA-N	431.368	1.237	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3cnn(C)c3)CC2)CC1	1834192696	GKQURKUHEJBDNF-CYBMUJFWSA-N	426.359	1.389	50	20	IDGD	
CCN(CC)C[C@H](C)C(=O)N1CCOC[C@]2(CN(C(=O)CCBr)CCO2)C1	1834825346	XTDXEMCDYUBMPO-LPHOPBHVSA-N	448.402	1.206	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3nc4ncccn4n3)CC2)CC1	1835350758	HJQVWTJBCHJCJM-QGZVFWFLSA-N	447.971	1.717	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)C/N=C/c3ccco3)CC2)CC1	1835781900	SKHBLHGQLSIJQT-QMFLXTPQSA-N	438.956	1.524	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC1CCN(C2CCN(C(=O)[C@@H](N)c3ccccn3)CC2)CC1	1835833354	BEHYDWLFPKFWMK-NRFANRHFSA-N	447.656	1.505	50	20	IDGD	
CN1CCC[C@H]1C(=O)N1CCC(N2CCC(NC(=O)[C@@H](F)Br)CC2)CC1	1836413465	FQDUSFHGDPNKCQ-JKSUJKDBSA-N	433.366	1.343	50	20	IDGD	
COC(OC)C(=O)N1CCC(OC2CCN(C(=O)[C@H](F)Br)CC2)CC1	1836789762	HIMIPSIRJWBHIY-ZDUSSCGKSA-N	425.295	1.294	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cccnc3OC)CC2)CC1	1837455340	IJOVFDUJWYUBNY-SFHVURJKSA-N	439.940	1.956	50	20	IDGD	
Cn1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)c(C(F)(F)F)n1	1837960771	TXVYOMXJFIAVPY-SWLSCSKDSA-N	442.797	1.043	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](C)NC(C)=O)CC2)CC1	1838755839	VEOWOWKPTGOWKL-CXAGYDPISA-N	446.386	1.683	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)CCn3ccnn3)CC2)CC1	1838773574	OJOQAWAJHLBDKY-CQSZACIVSA-N	442.358	1.450	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)COc3ccc(O)cc3)C2)C1	1839141856	VHGNISAKESLPOM-XLIONFOSSA-N	426.897	1.245	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CC34CCCN3CCC4)C2)C1	1839147556	VBMIHNMIYYBEPW-UTKZUKDTSA-N	427.973	1.479	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)cn1	1839151325	NVSOXJSBHTZBBP-OALUTQOASA-N	430.332	1.696	50	20	IDGD	
Cc1ccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)cc1[N+](=O)[O-]	1839189297	VDJWKYCFLMGOBR-MJGOQNOKSA-N	443.859	1.437	50	20	IDGD	
C[C@H](C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H](F)Br)CCO2)C1)c1ccccn1	1839203796	WOYDXFVWTXRSBC-JCKWVBRZSA-N	444.301	1.332	50	20	IDGD	
CCN(CC)C[C@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1839674865	LEWCFMVFQHPPFF-UWJYYQICSA-N	432.005	1.686	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ncccc3F)C2)C1	1839965769	KEJKEQTUTKEUJK-ACJLOTCBSA-N	444.301	1.464	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)C3(C(F)(F)F)CC3)C2)C1	1840033894	UKZUQSJEFVPMDL-SMDDNHRTSA-N	443.260	1.569	50	20	IDGD	
COc1ccccc1C(=O)N1CC(C(=O)N2CCCC23CN(C(=O)C(Cl)Cl)C3)C1	1841249233	KPGOYHBEEGITEQ-UHFFFAOYSA-N	440.327	1.774	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CCC[C@H](C(=O)N2CC3(CCCN3C(=O)[C@H](O)CCl)C2)C1	1841354040	FQJSNULDDAFWOP-ARFHVFGLSA-N	443.972	1.873	50	20	IDGD	
Cc1ncc(C(=O)N2CCCC23CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C3)[nH]1	1841713554	RCZLEDHVVSGJHL-ZDUSSCGKSA-N	425.917	1.667	50	20	IDGD	
O=C1CC[C@@H](C(=O)N2CCCC23CN(C(=O)[C@H](Br)Cc2ccccc2)C3)N1	1842737368	JZRQPOLDTUEYOS-CVEARBPZSA-N	434.334	1.475	50	20	IDGD	
O=C(c1cnc(Cl)c(Cl)c1)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843014200	KCWHMOJBUSFBQE-UHFFFAOYSA-N	434.088	1.199	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1cccc3[nH]ncc13)C2	1843415695	BLTFHPXDIHBDKX-AFUMVMLFSA-N	433.472	1.514	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1ccc3occc3c1O)C2	1844265035	NEHGERDGSYFZIJ-UHFFFAOYSA-N	435.440	1.268	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)c1csc(N)n1)C2	1844692405	SVFXRJGRNFFNQD-UHFFFAOYSA-N	445.457	1.690	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)[C@@H]1[C@H]3COC[C@H]31)C2	1844693454	GRNGKOODAWHJEK-VQFNDLOPSA-N	429.429	1.230	50	20	IDGD	
COc1ccc(/C=C(\C)C(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)cc1	1845834573	SRTFWQXIEIXTOP-FOWTUZBSSA-N	449.511	1.614	50	20	IDGD	
CC1(C)C=C(C(=O)N2CCCC23CN(C(=O)[C@H](O)CCl)C3)CN1C(=O)c1ccccc1	1846263192	WGNLPSLQLRZJOS-GOSISDBHSA-N	445.947	1.651	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CCN1C(=O)Cc2ccccc2C1=O	1847612381	ODQDPYNYOHGNRZ-BZSNNMDCSA-N	447.919	1.057	50	20	IDGD	
O=C(Cc1cccc2ccccc12)NNC(=O)CN1C(=O)c2cccc([N+](=O)[O-])c2C1=O	9894189	LFGKEDZTWCGMGZ-UHFFFAOYSA-N	432.392	1.734	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)c2ccccc2F)cc1	16148672	DQCUVIOCLSBUPX-UHFFFAOYSA-N	429.495	1.480	50	20	IDGD	
C#CCNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2ccc(Cl)cc2Cl)cc1	26071545	IINTYIVZAUACBR-UHFFFAOYSA-N	426.281	1.980	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)Cc2n[nH]c(=O)c3ccccc23)cc1	26751882	SSQFINHVYPPPNB-UHFFFAOYSA-N	449.496	1.348	50	20	IDGD	
NC(=O)CCc1nnc(SCC(=O)NNC(=O)c2ccc(F)cc2)n1Cc1ccco1	28946895	KKGPHIIIONINJR-UHFFFAOYSA-N	446.464	1.030	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)CN2C(=O)COc3ccc([N+](=O)[O-])cc32)c(C)c1	105106211	XAFQFDKMZYZEBD-UHFFFAOYSA-N	427.417	1.197	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Cc2cn3cccc(C)c3n2)c1	725878428	LAZQUUSZRMAPBT-UHFFFAOYSA-N	443.529	1.677	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)[C@@H](c2ccccc2)N2CCCCC2=O)c2ccccc2c1=O	728150815	JQYBQXLOAYZCRD-HXUWFJFHSA-N	433.468	1.448	50	20	IDGD	
CCc1ccccc1N1C[C@@H](C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)CC1=O	728847730	NFBOABIUTZXSCU-SFHVURJKSA-N	436.516	1.456	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)Cc3cccnc3)CC2)cc1	728851108	ODHXEXCIMVALET-UHFFFAOYSA-N	444.513	1.075	50	20	IDGD	
O=C(Cc1ccc(Cl)cc1)NNC(=O)NCCCCN1CCN(c2ncccn2)CC1	729232413	GRBYXVOTGXXBAD-UHFFFAOYSA-N	445.955	1.605	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)NC[C@@H]1CN2CCC[C@H]2CO1	729507771	VTUUIZWZZSWAHS-DZGCQCFKSA-N	427.299	1.022	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNS(=O)(=O)c1ccc2c(c1)C[C@H](C)O2	729965090	SNTWMGTWLLEIHK-NSHDSACASA-N	438.531	1.235	50	20	IDGD	
COCCN1C(=O)c2ccc(C(=O)NN=c3cc[nH]c4ccccc34)cc2S1(=O)=O	730288735	YTWHHLXVZCQGJU-UHFFFAOYSA-N	426.454	1.205	50	20	IDGD	
C[C@@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)NNc2ccc(Br)nc2)C1=O	732835910	BLXXWHVJAOBUGP-KRWDZBQOSA-N	436.241	1.894	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)n(C)c1	733109205	WUEGQHSOHKSZPF-UHFFFAOYSA-N	444.517	1.316	50	20	IDGD	
O=C(Cn1cnc2c(oc3ccccc32)c1=O)NNC(=O)c1cnn(-c2ccccc2)c1	733110329	IVJCPYFKBQYGOJ-UHFFFAOYSA-N	428.408	1.790	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCCCC2)cc1S(=O)(=O)NNC(=O)CC(C)(C)C	733249794	SVXBJEJZASWDTP-UHFFFAOYSA-N	431.580	1.915	50	20	IDGD	
CC(=NNC(=O)c1cnn(C)c1)c1ccc(S(=O)(=O)N2CCCC[C@H]2C(=O)O)cc1	735413141	GPSSRNNJTTYEIR-KRWDZBQOSA-N	433.490	1.202	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)[C@H](CC)Nc2c([N+](=O)[O-])c(C)nn2C)cc1OC	735837372	SNVPVBUPVUQOPD-ZDUSSCGKSA-N	434.453	1.696	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)c1ccc(N2CCCS2(=O)=O)cc1Cl	736077053	IRHCVNZNBIVHNP-UHFFFAOYSA-N	439.877	1.426	50	20	IDGD	
CCc1ccccc1O[C@H](C)C(=O)N1CCN(CC(=O)NNC(=O)c2ccccc2)CC1	736623931	URFBUPFWIZGMTJ-GOSISDBHSA-N	438.528	1.622	50	20	IDGD	
CCCC[C@H](COC)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	737061620	SSLDQIOIMPVYBW-MRXNPFEDSA-N	426.539	1.620	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)Cc1ccc(S(=O)(=O)C(F)F)cc1	740813647	PEFFPSGQIMELHV-UHFFFAOYSA-N	428.413	1.460	50	20	IDGD	
CCc1nc(C(=O)NNC(=O)c2nn(CC)c(=O)c3ccccc23)nn1-c1ccccc1F	741661862	ZEMJWQVUYCIHKC-UHFFFAOYSA-N	449.446	1.773	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@@H]2CCCN(C(=O)c3ccncc3)C2)cc(OC)c1OC	741882541	SQFUXTPOHPJAML-OAHLLOKOSA-N	442.472	1.421	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)[C@@H]2CCCN(C(=O)c3ccncc3)C2)cc1	741886718	ARIYBFBKHJXOOA-FUHWJXTLSA-N	440.500	1.947	50	20	IDGD	
CCC(CC)[C@H](C(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12)N1CCOCC1	742034769	PGUCJRIYJAMCJK-HXUWFJFHSA-N	443.548	1.875	50	20	IDGD	
O=C(NNC(=O)[C@@H](c1ccccc1F)N1CCOCC1)c1cc(Br)c[nH]1	742490218	ZUDSGLAWBMSCSI-OAHLLOKOSA-N	425.258	1.751	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)[C@@H](C)NC(=O)c1cc2c(C)nn(C)c2s1	743318265	FBIFFQTUHNQLCP-GFCCVEGCSA-N	429.502	1.460	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)N[C@@H]2CC(=O)N(CCOc3ccccc3)C2)cc1	743638643	STSZSKNNNNUIAR-GOSISDBHSA-N	440.500	1.638	50	20	IDGD	
COC[C@@H](C)n1c(C)cc(/C=C(/C#N)C(=O)OCc2nc(CS(C)(=O)=O)no2)c1C	744459962	HFSDFFVAFCBHIX-YSTIZTGUSA-N	436.490	1.890	50	20	IDGD	
C[C@@H](CC(=O)c1cccc(F)c1)C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	745398256	BARLAVWGCXJPBC-DJJJIMSYSA-N	444.415	1.565	50	20	IDGD	
CC(C)(C)OC(=O)NCc1ccc(C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)o1	745633396	NQFXMQWNNLGDBI-UHFFFAOYSA-N	442.428	1.794	50	20	IDGD	
C[C@H](C(=O)NNC(=O)CSc1ccc(Cl)cc1)N1C(=O)[C@H]2[C@H](C1=O)[C@H]1CC[C@H]2O1	746093721	LOXOLCJWPPXCBS-FBVUGSABSA-N	437.905	1.130	50	20	IDGD	
CC[C@H](C)NS(=O)(=O)c1ccc(C(=O)NNC(=O)Cc2cn3ccccc3n2)cc1	746545897	YYZOEGCYLMTCRD-AWEZNQCLSA-N	429.502	1.415	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)NCCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-]	747490808	LZVPJHBOMICZBM-UHFFFAOYSA-N	426.355	1.994	50	20	IDGD	
CS(=O)(=O)N1CCC(C(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)CC1	748513052	YJASPTRAQUPIJL-UHFFFAOYSA-N	429.442	1.095	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NC2CCN(C(=O)CC(C)C)CC2)cc(OC)c1OC	749197305	ADMQYILCLGEFJS-UHFFFAOYSA-N	436.509	1.694	50	20	IDGD	
CC[C@@H](NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)c1nnc2n1CCCCC2	749579868	QFCZTVBPYXZPPK-OAHLLOKOSA-N	438.492	1.347	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)CNC(=O)OC(C)(C)C	749819460	PHPCCLVWMKBHQU-CQSZACIVSA-N	435.529	1.184	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNS(=O)(=O)c1ccc(OCc2ccccc2)cc1	751283128	UGSUFJVRXXMIJV-UHFFFAOYSA-N	429.454	1.598	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)N1CCN(c2ccc(C(F)(F)F)cc2)CC1	752155347	NPZUDPWUJKYSGI-UHFFFAOYSA-N	439.394	1.591	50	20	IDGD	
COc1cc(OC)cc(N2C[C@H](C(=O)NNC(=O)[C@@H]3COc4ccccc4O3)CC2=O)c1	752269327	VIMSDZNECZATOI-YJYMSZOUSA-N	441.440	1.044	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)[C@@H](CCS(C)(=O)=O)NC(=O)c2ccccc2Cl)o1	752523448	XDCXARDPWJLROY-CQSZACIVSA-N	441.893	1.236	50	20	IDGD	
COc1cc(CN2CC[C@H](NC(=O)NNC(=O)c3ccccc3OC)C2)cc(OC)c1	755156899	JVAYGQRRFVXEAR-INIZCTEOSA-N	428.489	1.931	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NC(=O)NNC(=O)COc2ccc(C#N)cc2)cc1	755360611	RNKGAOLWLHJHDU-UHFFFAOYSA-N	445.501	1.820	50	20	IDGD	
CCOc1ccc(NC(=O)NNC(=O)Cc2cccnc2)cc1S(=O)(=O)N(CC)CC	755450617	NOTWKBFYWYEGDJ-UHFFFAOYSA-N	449.533	1.906	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)Nc1cccc(C(=O)N2CCOCC2)c1	755933326	KFFIIDXLASYVQW-CQSZACIVSA-N	430.436	1.918	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)Nc2ccc(=O)n(Cc3ccccc3)c2)c2ccccc2c1=O	755960587	NLNROQBOUPYFAO-UHFFFAOYSA-N	444.451	1.610	50	20	IDGD	
CNC(=O)c1cc(NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)ccc1Cl	756039176	SSCLZUOHRUBCAY-UHFFFAOYSA-N	428.836	1.413	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1cccc(C[S@@](=O)c2ccccc2)c1	756593433	ZFFSWSZICUUYLI-CFJPQMKISA-N	438.531	1.085	50	20	IDGD	
C[C@H]1CN(C(=O)Cn2cc(NC(=O)NNC(=O)c3cccc(N(C)C)c3)cn2)C[C@H](C)O1	756840502	VPXIDEFBAZQQME-GJZGRUSLSA-N	443.508	1.051	50	20	IDGD	
CN(CC(=O)N1CCN(S(=O)(=O)CBr)CC1)C(=O)OCc1ccccc1	757595854	VRMGVQAGROCRSZ-UHFFFAOYSA-N	448.339	1.081	50	20	IDGD	
CC(C)(C)OC(=O)N1CCc2c(NC(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)cccc21	757619684	AVZQOCFJQHQTIM-GFCCVEGCSA-N	438.506	1.572	50	20	IDGD	
COCc1cc(NC(=O)NNC(=O)c2cc(-c3ccc(OC)c(OC)c3)[nH]n2)ncn1	757722295	XQSSVCUCOYLYID-UHFFFAOYSA-N	427.421	1.497	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)Nc2ccc(C)c(S(=O)(=O)NC3CC3)c2)c1	757872638	DILUBRJDLWJPKJ-UHFFFAOYSA-N	446.489	1.256	50	20	IDGD	
CCc1ccc(S(C)(=O)=O)cc1C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C	759112950	GKYWXCNRGBRPEY-UHFFFAOYSA-N	428.511	1.121	50	20	IDGD	
CC(C)N1CCN(c2cccc(NC(=O)C(=O)NNC(=O)c3ccccc3F)c2)CC1	763561426	KNHFXOZMWDOMQE-UHFFFAOYSA-N	427.480	1.756	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2ccc(-n3cncn3)c(Cl)c2)c1	763668054	GVVPWXGIMJMDTP-UHFFFAOYSA-N	442.863	1.702	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)CNC(=O)c2cccnc2)cc1Br	763824327	NJXFQJSXBGKDPO-UHFFFAOYSA-N	435.278	1.363	50	20	IDGD	
CCOC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(C(C)=O)cc2)cc1	763873693	XOOVYQVATTYUIN-AWEZNQCLSA-N	441.440	1.619	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)C(=O)Nc2ccccc2SCCC(N)=O)cc1	763898452	VSSAEHCMMHCPQY-UHFFFAOYSA-N	446.554	1.841	50	20	IDGD	
CC(C)(C)OCc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1	763916609	HMVQVCICSVZXNL-UHFFFAOYSA-N	437.460	1.377	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)C(=O)Nc1ccc(-c2nccs2)cc1	763917086	PETJIZINOYQDEM-UHFFFAOYSA-N	434.441	1.186	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)C(=O)Nc1ccc(F)cc1C(F)(F)F	763922695	ZMGYGIKSOFRXBF-UHFFFAOYSA-N	437.313	1.220	50	20	IDGD	
CCOC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)cc1C#N	763973957	IMWODEUHFNMGOF-UHFFFAOYSA-N	445.819	1.885	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)c(O)c1	764105557	UONIGJHUNVEJIL-KBPBESRZSA-N	444.463	1.853	50	20	IDGD	
CCOC(=O)N(C)c1ccc(NC(=O)C(=O)NNC(=O)Cc2ccccc2OC)cc1	764131588	JLPBDJPDIHZPDQ-UHFFFAOYSA-N	428.445	1.617	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)C(=O)Nc1cccc(C(=O)OCc2ccccc2)c1	764266977	ORVSIEUFEXPWAG-UHFFFAOYSA-N	432.436	1.767	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)CCc2ccccc2O)cc1Br	764281276	PTXATANQVMKGJD-UHFFFAOYSA-N	436.262	1.882	50	20	IDGD	
COC(=O)N(C)Cc1ccc(NC(=O)C(=O)NNC(=O)CCc2ccccc2O)cc1	764289700	YOMGGJUCMGGYFE-UHFFFAOYSA-N	428.445	1.309	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)c1ccc(-n2cc(Br)cn2)cc1	764344504	DYOCDZPLXVFVNC-UHFFFAOYSA-N	443.261	1.221	50	20	IDGD	
CCNC(=O)c1ccc(C)c(NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)c1	764377916	SIAJKDPKPIFQTF-UHFFFAOYSA-N	440.485	1.596	50	20	IDGD	
CNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(C)c(C)c3)[nH]n2)c1	764388036	OJMGGYYLPAPOFB-UHFFFAOYSA-N	434.456	1.453	50	20	IDGD	
C[C@H]1COCCN1c1ccc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)cc1	764394143	OOVKXTORMAHCOT-AWEZNQCLSA-N	444.513	1.496	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1cc(F)c(N2CCCCC2)c(F)c1	764397397	IMRFJBYVQMKJHX-GFCCVEGCSA-N	428.436	1.093	50	20	IDGD	
COc1cc(I)c(C(=O)NNc2nccnc2OC)cc1OC	764464300	MHACQISHZOQTIL-UHFFFAOYSA-N	430.202	1.864	50	20	IDGD	
COc1cc2c(cc1OC)CN(C(=O)CCC(=O)NNC(=O)c1ccccc1OC)CC2	765472698	NYJXTCXLMBJYEQ-UHFFFAOYSA-N	441.484	1.839	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3ccc(-n4cnnc4)cc3)CC2)cc1	766650650	XOCITBWTAZJHRV-UHFFFAOYSA-N	433.516	1.155	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc2c(c1)OCCCO2)NNc1ncnc2ccsc12	766674900	CIMIELCZNTWPEZ-UHFFFAOYSA-N	449.514	1.664	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCc2nc(C3CC3)cs2)cc1	767138679	ATNYJFQIPZXISX-UHFFFAOYSA-N	437.547	1.480	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1cccc(C#N)c1)C(=O)NNC(=O)c1cc2ccccc2cc1O	767828660	WSQOZIKRSFPSHX-CYBMUJFWSA-N	438.465	1.545	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)c3ccc(C[C@@H]4CC(=O)NC4=O)cc3)n[nH]2)c1	768269580	OPFAOJNKDOBUHC-QGZVFWFLSA-N	445.479	1.974	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)c1ccc2c(=O)n3c(nc2c1)CCC3	768629327	ITOZPJRKTSILJB-UHFFFAOYSA-N	428.470	1.512	50	20	IDGD	
Cn1nc(SCC(=O)NN=CCCCc2cccc(C(F)(F)F)c2)c(=O)n(C)c1=O	769777469	KOWXESUXPNFESJ-UHFFFAOYSA-N	443.451	1.715	50	20	IDGD	
CSCCNC(=S)NNC(=O)c1ccc2c(c1)S(=O)(=O)c1ccccc1C2=O	770241158	VNLFUFATPYICBY-UHFFFAOYSA-N	435.552	1.536	50	20	IDGD	
CCOC(=O)C1(CNC(=O)NNC(=O)[C@H](C)Oc2cccc(Br)c2)CC1	770327830	VYQKOWSQAIVGFE-NSHDSACASA-N	428.283	1.890	50	20	IDGD	
CCN1CCN(c2cccc(NC(=O)C(=O)NNC(=O)c3ccc4ccccc4n3)c2)CC1	770773092	DFXDIFPOPBMGQG-UHFFFAOYSA-N	446.511	1.776	50	20	IDGD	
Cc1cc2c(N3CCC[C@@H]3C(=O)NNC(=O)C(=O)Nc3ccccn3)ncnc2s1	771029972	CRRSBCXFUVBBGY-CYBMUJFWSA-N	425.474	1.150	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NN=C1C(=O)Nc2cc3c(cc21)OCCCO3	771568241	PUHAPINMMSHCAB-UHFFFAOYSA-N	428.832	1.590	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)c1cn(-c2ccccc2Br)nn1	771994886	TYJCIYGAUULNKM-LLVKDONJSA-N	438.282	1.769	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)CN1C(=O)c2cccc([N+](=O)[O-])c2C1=O	772955119	PSJONXLVIBBQDE-JTQLQIEISA-N	446.803	1.459	50	20	IDGD	
CC(C)[C@@H](C(=O)OCC(=O)C(C#N)=C1N(C)c2ccccc2N1C)N1CCCS1(=O)=O	773188524	NLKCDIXSQBCYOV-IBGZPJMESA-N	446.529	1.480	50	20	IDGD	
CN1CCC(=O)Nc2cc(C(=O)NNC(=O)[C@@H]3CCCN(C(=O)OC(C)(C)C)C3)ccc21	773421673	SOGOBKPSNSPRMW-OAHLLOKOSA-N	445.520	1.873	50	20	IDGD	
Cc1ccc(-n2nccc2NC(=O)C(=O)NNC(=O)c2c(Cl)cccc2Cl)nn1	773496677	PJINIYUDXJZUHG-UHFFFAOYSA-N	434.243	1.677	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNc2ccc3ccccc3n2)ccc1S(=O)(=O)N(C)C	773662408	UTKNRGPHGOPZAA-UHFFFAOYSA-N	443.485	1.576	50	20	IDGD	
CC(C)c1nccnc1NNC(=O)C(=O)Nc1ccccc1C(=O)N1CCN(C)CC1	773997684	KVFKQMOMZHREBT-UHFFFAOYSA-N	425.493	1.069	50	20	IDGD	
Cn1cc([C@H](NCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c2ccc(F)cc2)cn1	774341082	IRRBIYXDQBKYRV-LJQANCHMSA-N	426.408	1.608	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)N[C@@H]1CCc2cc(O)ccc2C1	775069591	FLXKWPZTXMLBRD-OAHLLOKOSA-N	431.518	1.495	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)N[C@@H]2CCN(c3cccc(Br)c3)C2=O)n1	775227222	YCPBSFYGUKJAEP-OAHLLOKOSA-N	449.309	1.398	50	20	IDGD	
CN(NC(=O)c1ccc(-c2nc(=O)o[nH]2)cc1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776211728	GNCAJWOBNYCQIT-UHFFFAOYSA-N	446.464	1.279	50	20	IDGD	
Cc1ccc(C)n1-c1ccc(C(=O)NNC(=O)NC[C@@H]2COC3(CCOCC3)O2)cc1	777761769	VZTYNFKAEAUQSS-LJQANCHMSA-N	428.489	1.960	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)CNC(=O)OC(C)(C)C)n1nnc(-c2ccc(Cl)cc2)n1	778438410	WDCIYAOSGUYEHJ-ZDUSSCGKSA-N	437.888	1.617	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNC(=O)Cn2nc(C)cc2C)cc1Br	778707020	FJZPMSYRMNODOR-UHFFFAOYSA-N	438.282	1.447	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)C(=O)Nc1ccc(OCC2CC2)cc1	782896350	GINSXHHNBFWBJB-UHFFFAOYSA-N	445.501	1.168	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(NC(=O)C(=O)NNc2nccnc2Cl)ccc1Cl	784781056	WQFQHOGJFKJESY-UHFFFAOYSA-N	433.277	1.116	50	20	IDGD	
CN(C)Cc1cccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)c1	784834985	FOTSMNGPVOJFCW-UHFFFAOYSA-N	426.445	1.826	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)C(=O)Nc2ccc(N3C[C@H](C)O[C@@H](C)C3)nc2)c1	784850696	ADRGNRSJRAZKEN-KBPBESRZSA-N	427.461	1.564	50	20	IDGD	
CN(C)c1nccc(NNC(=O)C(=O)Nc2cc(Cl)ccc2C(=O)N2CCCCC2)n1	784969172	JFOFIFASXDOEEZ-UHFFFAOYSA-N	445.911	1.904	50	20	IDGD	
Cc1cccc(Cn2nccc2NC(=O)C(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)c1	785023665	NOMRVFPDPYIECY-UHFFFAOYSA-N	438.400	1.253	50	20	IDGD	
C[C@@H]1Cc2cc(S(N)(=O)=O)ccc2N1C(=O)COC(=O)/C(C#N)=C/c1ccccc1	785352741	ZSEIBSJRDGYIKI-NGWPFTMJSA-N	425.466	1.762	50	20	IDGD	
CCOC1CC(CCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)C1	788864922	JPAVJCOMOVEEAG-UHFFFAOYSA-N	438.550	1.620	50	20	IDGD	
COC(=O)c1ccc(C=NNC(=O)CSc2nnc(O)nc2O)c(Br)c1	788975469	NLWBDTUSZUJYBB-UHFFFAOYSA-N	442.251	1.074	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2nc(C(C)C)cs2)nc1	789747129	RRYFKQIJICOZIN-UHFFFAOYSA-N	426.524	1.430	50	20	IDGD	
CC(=O)c1cc(C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)ccc1C	790730723	RWCSYAXIOHCGPT-UHFFFAOYSA-N	431.518	1.286	50	20	IDGD	
CN(C)N(C(=O)c1cccc(NS(=O)(=O)c2cccs2)c1)[C@H]1CCS(=O)(=O)C1	792856249	XJAYFSMIFDUWLA-HNNXBMFYSA-N	443.572	1.655	50	20	IDGD	
COc1cc(N2CCN(C(=O)NNC(=O)c3cccc(C)n3)CC2)cc(OC)c1OC	793229623	BKTVWDOVQVSJAU-UHFFFAOYSA-N	429.477	1.592	50	20	IDGD	
CC(C)(C)OC(=O)N1CCOC[C@H]1CC(=O)NNC(=O)c1cc(-c2ccccc2)[nH]n1	794762352	LFLWICVSKOYXFW-OAHLLOKOSA-N	429.477	1.864	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(C)(C)[C@H]1C(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	794894314	FZJBQTSYWRVLIS-MRXNPFEDSA-N	429.477	1.984	50	20	IDGD	
CN(C(=O)OC(C)(C)C)[C@@H](C(=O)NNC(=O)Cc1cn2ccccc2n1)c1cnn(C)c1	796884495	AGOVIRRMQYKLAC-GOSISDBHSA-N	441.492	1.366	50	20	IDGD	
Cn1cc2c(n1)CCC[C@H]2C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	798822926	CIERZARTTZDDKS-QGZVFWFLSA-N	445.545	1.476	50	20	IDGD	
CC[C@@](O)(C(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)c1cccc(Cl)c1	800322434	TWFBQGKFLKETJQ-IBGZPJMESA-N	435.820	1.850	50	20	IDGD	
CC1(C)CN(Cc2ccccc2)CC[C@@H]1NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	800983857	WTBGIKYXGIRSNX-FQEVSTJZSA-N	448.531	1.907	50	20	IDGD	
Cc1cc(N2C[C@@H](C(=O)NNC(=O)N=c3cc[nH]cc3)CC2=O)ccc1Br	802033344	UZWXPIAPEMHFQY-LBPRGKRZSA-N	432.278	1.780	50	20	IDGD	
CNS(=O)(=O)c1cc(NC(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)ccc1F	806545003	FUNBDLFMKMIFGH-UHFFFAOYSA-N	432.437	1.590	50	20	IDGD	
Cc1cc(I)cc(NC(=O)C(=O)NNC(=O)c2cc(C)[nH]n2)c1	806976201	ILHUIZUQAIZRIL-UHFFFAOYSA-N	427.202	1.031	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)C(=O)Nc2nc(-c3ccc(F)cc3)cs2)c1	806980588	QXHYBWOROCIPFN-UHFFFAOYSA-N	442.432	1.702	50	20	IDGD	
COC(=O)C[C@H](C)CC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	809545508	MAZYUZVJAMMNAO-CQSZACIVSA-N	425.507	1.212	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)CNS(=O)(=O)c2ccccc2C(F)(F)F)cc1	810267913	IVPCNUYLKSMHNY-UHFFFAOYSA-N	426.376	1.317	50	20	IDGD	
CCc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NNc1c(OC)cccc1S(C)(=O)=O	810400891	RVFCGGWQYXLTNH-UHFFFAOYSA-N	436.446	1.651	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)C(=O)Nc2cn(C)nc2C2CC2)c1	812980289	OHLSOQGBGKLUJC-UHFFFAOYSA-N	436.266	1.468	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)c2cnn(C)c2I)c1	814719135	ASWJTXKSQXOOJS-UHFFFAOYSA-N	428.230	1.482	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)cn2ccnc12	815566008	GNKYESPKMYGWQG-UHFFFAOYSA-N	447.455	1.333	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(C)c3nccn3c2)cc1Br	815569793	IEKVZTFOHMLEAK-UHFFFAOYSA-N	446.261	1.814	50	20	IDGD	
CC(C)NC(=O)C(=O)NNC(=O)C1CCN(C(=O)c2ccc(C(F)(F)F)cc2)CC1	822054014	JPOCJKQBIXUJLK-UHFFFAOYSA-N	428.411	1.230	50	20	IDGD	
O=C(c1cc(S(=O)(=O)N2CCCCC2)ccc1Br)N1CC[C@H](B(O)O)C1	864232806	CLQJADTYITVABR-LBPRGKRZSA-N	445.144	1.313	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)CCC(=O)c2ccc3c(c2)OCCCO3)C[C@H](C)O1	912919426	NSYGFVHFSXYKSX-HOTGVXAUSA-N	433.505	1.458	50	20	IDGD	
CCOc1ccccc1N1C[C@H](C(=O)NNC(=O)CCN2C[C@H](C)O[C@H](C)C2)CC1=O	912919861	RSOGCVHDKCPHEC-IXDOHACOSA-N	432.521	1.085	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)[C@@H](C)NS(=O)(=O)c2ccc(Cl)cc2)c1	913446002	FQEVZCRZMBIDGQ-CQSZACIVSA-N	439.921	1.850	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)NC1CCN(Cc2ccccc2)CC1	913459076	FMEFPPYGBVHUEV-UHFFFAOYSA-N	427.461	1.969	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)NC1CCN(CC(=O)Nc2ccccc2)CC1	914542691	FLFCONDPBAGBCG-UHFFFAOYSA-N	427.480	1.802	50	20	IDGD	
Cc1ccccc1[C@H](CC(=O)OCC(=O)NNC(=O)c1ccc(Cl)cc1)NC(N)=O	914644349	UEMDWWCBPONZFZ-INIZCTEOSA-N	432.864	1.752	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NCCOC)c(C(=O)NNC(=O)C2CCCC2)c1	914843716	VTEMJQRJORMWCW-UHFFFAOYSA-N	440.566	1.727	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)N[C@H](CN1CCOCC1)c1ccccc1	916214672	SIQFYUZBXUOIAA-VQIMIIECSA-N	430.480	1.997	50	20	IDGD	
CCOCc1ccc(CNC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1	916426033	CUNFNPDWDFNAQP-UHFFFAOYSA-N	448.545	1.683	50	20	IDGD	
CN1CCN(CCCNC(=O)NNC(=O)COc2ccc(F)cc2)[C@H](c2ccccc2)C1	916485143	POBLOMBAMYVZCM-NRFANRHFSA-N	443.523	1.914	50	20	IDGD	
CCCS(=O)(=O)N1CCCC[C@H]1C(=O)NNC(=O)[C@@H](C)Oc1ccc(OCC)cc1	918549401	KBSWFPLQQNKYQC-QAPCUYQASA-N	441.550	1.594	50	20	IDGD	
O=C(NC[C@@H](c1cccc(F)c1)N1CCOCC1)NNC(=O)c1cccc([N+](=O)[O-])c1	921248366	WQFPHJASYOUXLZ-SFHVURJKSA-N	431.424	1.751	50	20	IDGD	
CN(CCCC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)C(=O)OC(C)(C)C	921301503	AUKICWSUJCTHPS-UHFFFAOYSA-N	442.538	1.345	50	20	IDGD	
Nc1cnnc(NNC(=O)[C@H]2CC(=O)N(c3cccc(Br)c3)C2)c1Cl	1116298124	KOYWIFDTMIIUKR-QMMMGPOBSA-N	425.674	1.971	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)cnn1-c1ccncc1	1116402269	AUAWYPSIVPDEHK-UHFFFAOYSA-N	431.456	1.941	50	20	IDGD	
CN(CCNC(=O)NNC(=O)c1cncn1-c1ccccc1)S(=O)(=O)c1cccs1	1319416383	QGYYNNVFUVBWSC-UHFFFAOYSA-N	448.530	1.199	50	20	IDGD	
COc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](F)Cl)C2)n1	1778025815	GIOSJAAHCDWUKC-HNJNHCNJSA-N	444.847	1.660	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc4ncccn4n3)C2)C1	1778467551	PTGPMKWBZFSDGI-ACJLOTCBSA-N	436.310	1.346	50	20	IDGD	
Cc1c(C(=O)N2CCO[C@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)nc2ccccn12	1779295960	YKBZSGVDRSWVBR-NRFANRHFSA-N	430.581	1.938	50	20	IDGD	
CSCC[C@@H](O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CO[Si](C)(C)C)C1	1779545904	QFDBOSGNVVGWIV-GPMSIDNRSA-N	432.659	1.466	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(C1)CN(C(=O)C1(C)COC1)CCO2	1780095691	XFSVHEYMQGJYLA-OAQYLSRUSA-N	447.444	1.000	50	20	IDGD	
O=C(Cc1c(F)cccc1F)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2	1780472295	XORLLYBQEWRNHT-MBOZVWFJSA-N	430.879	1.621	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1c(O)cc(O)cc1O)C2	1780707009	BBMKVJDAWKAKRH-GQWAEJPESA-N	426.897	1.948	50	20	IDGD	
COc1cccc(CC(=O)N2CCO[C@@]3(CCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)n1	1781224098	HLSCDEGWCORTTR-OALUTQOASA-N	430.332	1.699	50	20	IDGD	
O=C(c1cn2c(F)cccc2n1)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781332272	FLNXXPXGFWZTAS-WMLDXEAASA-N	443.248	1.607	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc([N+](=O)[O-])[nH]1)C2	1782003598	OCCRKNXLWDPZFX-XTQGRXLLSA-N	443.298	1.834	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)COc2cccnn2)C1	1782521589	VICGAJYMZMEBQF-NIKGAXFTSA-N	445.347	1.606	50	20	IDGD	
Cn1cccc1C(=O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@](C)(Cl)CCl)C2	1782611065	XVOHJQNKKXUGTM-UIAACRFSSA-N	444.359	1.958	50	20	IDGD	
Cc1ccc(C(=O)C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)cc1	1783743386	LXZGZUYFUUNALF-QAPCUYQASA-N	427.270	1.698	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)CCc3cnc4[nH]ccc4c3)CCO2)C1	1783879184	PHOQGYRLIAYTRF-UWJYYQICSA-N	434.924	1.579	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccc3ncccc3c1)CCO2	1783935224	QWVNTRSLFFEYKO-HSZRJFAPSA-N	439.516	1.051	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cc3sccc3[nH]1)CCO2	1783936144	RQPMDUBNNJYCDP-FQEVSTJZSA-N	433.534	1.046	50	20	IDGD	
O=C(c1ncn(-c2cccc(F)c2)n1)N1CCO[C@@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783942905	CFNPIAMEUMIRRH-GOSISDBHSA-N	442.278	1.654	50	20	IDGD	
Cc1cc(C)n2ncc(C(=O)N3CCO[C@]4(CCN(C(=O)C(Cl)Cl)C4)C3)c2n1	1783947849	KBNYBBRUMFFZDH-SFHVURJKSA-N	426.304	1.593	50	20	IDGD	
COc1ccc(CCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](O)CCl)C[C@@H]32)c(F)c1	1788204382	FPFVEYIZLNAEQY-WQCNXYOZSA-N	442.915	1.346	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCC(=O)N3CCCC3)C[C@@H]21	1789868691	JAPQIFMPPYXJOT-ZKNHNOBHSA-N	448.391	1.605	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)c3ccccc3)C[C@@H]21)[C@H](F)Br	1789922985	VTDCGAYYBIWCTO-QXKUPLGCSA-N	429.286	1.390	50	20	IDGD	
C[C@H](O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](Br)Cc3ccccc3)[C@H]2C1	1790780291	VZSDURQHZCNYSB-HILJTLORSA-N	439.350	1.353	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)Cc3ccccc3)[C@H]2C1	1790957044	PIJCXLWMRVXZLY-ZZAJSIFASA-N	443.371	1.806	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc(OC)cn3)C[C@@H]21	1790961018	HEIJUZVPFOPMRT-XPCVCDNBSA-N	441.326	1.252	50	20	IDGD	
Cc1nn(C)c(C)c1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]2C1	1791055408	VFQLDJZGWQHYME-KJEVXHAQSA-N	427.343	1.414	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)n3cccc3C=O)C[C@@H]21	1791058442	YUFPPRHUEGPTLQ-BJMQQELFSA-N	440.338	1.625	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)ccc3F)C[C@@H]21	1791060841	JXEWQYZPHIECIR-AZLWOZFGSA-N	429.286	1.908	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3snnc3C3CC3)C[C@@H]21	1791255000	YMVUSCBPKNMGBV-FQUUOJAGSA-N	428.942	1.263	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnnc3ccccc13)C2	1792868098	PPEPTBYXJHUEGL-ZUMXRPEOSA-N	447.333	1.864	50	20	IDGD	
CN1CCC[C@H]1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1794141235	PBKAXPOXRULEJZ-QEOTZNIISA-N	442.988	1.851	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1CCN(Cc2ccccn2)CC1	1794161400	NETABNUHNPMGNL-KOUHRCEDSA-N	448.995	1.901	50	20	IDGD	
CS(=O)(=O)c1cncc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](F)Br)C3)c1	1794625461	IFUPEAVXIHXNKU-OPDFLTKYSA-N	448.314	1.427	50	20	IDGD	
C[C@H](Oc1ccccn1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCBr	1795116904	FGWDHPREWSAZLW-ZJOBFFGXSA-N	426.311	1.224	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](CCN)NC(=O)OC(C)(C)C	1796031165	ZIRUFDHORITREH-XFIYOXNOSA-N	446.976	1.121	50	20	IDGD	
Cn1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@](C)(Cl)CCl)C3)c(C(F)F)n1	1796702377	LHONWLPYVNPUIL-SKCRNORWSA-N	439.290	1.797	50	20	IDGD	
CSc1ncccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnccc1C(=O)NN	1798440047	WGAPREFHZVTIOA-BTTYYORXSA-N	440.529	1.368	50	20	IDGD	
Cc1ncc(/C=C/C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)s1	1798443588	KYLGIXZCHHWOAH-HOYONBQMSA-N	440.529	1.415	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1scnc1C1CC1)C2)[C@H](F)Br	1799347409	JYHKIYZHMDDWKD-MIJXAVMKSA-N	432.315	1.914	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(O)c(F)c1	1799550983	ZHRKOGMMWUNMGG-OQMKEHIESA-N	429.286	1.908	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnn2cccc(F)c12	1800125489	KDCDTGZQADZXAE-OHTBPHCPSA-N	439.285	1.460	50	20	IDGD	
O=C(Cc1cccc(C(F)(F)F)c1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2	1800406854	NTPYLPAHIRNPIE-IARIHHJXSA-N	434.842	1.437	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ncc(OC)cc1F)C2	1800638841	ATXDHKBIVVWFAW-NDPMZMCLSA-N	444.301	1.606	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CSc1ccccc1[N+](=O)[O-])[C@H](O)CCl	1802181170	KNDDNKXXZNVFDE-QVHKTLOISA-N	427.910	1.925	50	20	IDGD	
CC(C)(C)n1cc(C(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)cn1	1803142197	WPQHLCYNDDKJLV-NJAFHUGGSA-N	433.940	1.952	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1ccc(C)o1	1803157423	LAGLZMFEQQLIMD-GSWMANSFSA-N	425.489	1.903	50	20	IDGD	
O=C(CCBr)NC[C@H]1CCN(C(=O)CN2CCOCC2)[C@@H]1c1cccnc1	1806340851	OMIGTWUYOSHHDS-VQIMIIECSA-N	439.354	1.205	50	20	IDGD	
O=C(Cc1ccccc1)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1806512652	OTEJSLRONBJNEB-XUZZJYLKSA-N	443.312	1.324	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)CCC#N)[C@@H]1c1cccnc1	1806863960	UPJYOULTRXQZFF-ZXRGJLGVSA-N	435.488	1.525	50	20	IDGD	
Cn1nncc1C(=O)N1CC[C@H](CNC(=O)[C@](C)(Cl)CCl)[C@@H]1c1cccnc1	1808291925	QWQNULQGQLYZQY-QIIPPGSGSA-N	425.320	1.766	50	20	IDGD	
Cc1cscc1C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1808620994	QXDWYTONEJSKTH-GHTZIAJQSA-N	449.341	1.765	50	20	IDGD	
CCn1nccc1C(=O)N1CCCC2(CCN(C(=O)c3cnccc3C(=O)NN)CC2)C1	1808647573	KXDUWRLVBGPIHT-UHFFFAOYSA-N	439.520	1.060	50	20	IDGD	
CCc1nc(C(=O)NC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)co1	1811013120	HCTWTUZFGJFHHF-KKSFZXQISA-N	442.520	1.325	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2nc(C)c(C)[nH]c2=O)[C@@H]1c1cccnc1	1813028298	NYDZHEIJWAMGCM-XYJFISCASA-N	447.923	1.355	50	20	IDGD	
C=CCSCC(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1813069715	AWUOXAJIBFNAQO-LAUBAEHRSA-N	433.578	1.380	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)on1	1813070399	ILXBWKMBSDPZBS-UZLBHIALSA-N	428.493	1.071	50	20	IDGD	
CS(=O)(=O)CCC(=O)NC[C@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1	1813574010	KGHSSCOZZSATPN-RHSMWYFYSA-N	446.367	1.307	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)C1CC2(CCC2)C1	1813650700	ZMCQHAMKNNKQMQ-UGKGYDQZSA-N	447.344	1.661	50	20	IDGD	
COCCOCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](C)CBr)CC2	1814299769	IWVABRSCUWXZGR-GHMZBOCLSA-N	434.356	1.749	50	20	IDGD	
CC(=O)NCCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](C)CBr)n[nH]1	1814782947	FHXJZUDBCVDNQZ-SMDDNHRTSA-N	428.331	1.959	50	20	IDGD	
CCC[C@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1815317720	HATYFQUWJIJTQX-RDJZCZTQSA-N	432.717	1.803	50	20	IDGD	
C[C@@]1(C(=O)N[C@@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)CC=CCC1	1815347892	VTTVZLPLVIPMNS-OPAMFIHVSA-N	439.346	1.795	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](O)CCl)CC2)c1ccc2ncncc2c1	1819183530	ASXLPPZXXJELSE-WFASDCNBSA-N	431.905	1.912	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)C2CCOCC2)[nH]n1	1819402260	XGHHVCHUUGROBT-QGZVFWFLSA-N	441.492	1.141	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)CCBr)[nH]n1)c1cc(CO)on1	1820346768	NFAUTRYHIMGHLK-CYBMUJFWSA-N	426.271	1.981	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)COc2ccc(O)nn2)n[nH]1	1821665579	BTSFUALZTBUQTB-CQSZACIVSA-N	448.556	1.828	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CN1C(=O)C=CC1=O)CC2	1822868973	DHTHJGKGJIHUHB-VVVCHXIZSA-N	445.328	1.216	50	20	IDGD	
CC(=O)NC(C)(C)C(=O)N[C@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1	1822998432	CWFNCQQQVHJYOK-KWQFWETISA-N	435.319	1.660	50	20	IDGD	
O=C(/C=C\C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1)NC1CC1	1823008988	YGRDQDSTGQBTHJ-VYOAUYJHSA-N	445.314	1.580	50	20	IDGD	
N#CC1(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)[nH]n2)CCC1	1823379174	ZFHWLSCZYBJOFF-MRXNPFEDSA-N	436.476	1.408	50	20	IDGD	
O=C(NCC(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H](O)CCl)CC1)c1cccs1	1824180662	LKGIKOJVDDPEEH-CVEARBPZSA-N	441.981	1.697	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccnc1C(N)=O)CC2	1825993031	DKMLAACGOIBSKW-GXSJLCMTSA-N	437.909	1.117	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](C)S)sc2C1	1826017270	FQZXBUVOPZCKFR-MRDTYBEOSA-N	434.547	1.507	50	20	IDGD	
Cc1nn(C)c(C)c1CC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](O)CCl)CC2	1826836027	CTJOULXDUFBREY-SMDDNHRTSA-N	425.942	1.248	50	20	IDGD	
Cc1noc(N)c1C(=O)N1CCCC[C@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1	1826869271	KMNVWRGTLJMQBN-INIZCTEOSA-N	434.541	1.172	50	20	IDGD	
COc1ccc(OCC(=O)N2CCO[C@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)cc1	1830242441	KGFFEPRVHNVSGZ-LJQANCHMSA-N	447.315	1.334	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccncc3F)C2)C1	1830538458	FXNPOTYASMUTFP-UGSOOPFHSA-N	444.301	1.322	50	20	IDGD	
Cc1oc(C(C)(C)C)cc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1830725922	SPYDTIXEZLWTTA-KKSFZXQISA-N	442.940	1.555	50	20	IDGD	
COc1ccc(Cl)c(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)c1	1830738361	NWMUSHXDYKGVFE-QFBILLFUSA-N	447.315	1.018	50	20	IDGD	
Cc1ccc(/C=C/C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)s1	1830738595	QJXIOENLHAOHBT-QDYBUIJZSA-N	428.938	1.126	50	20	IDGD	
O=C(CCBr)N1CCC([C@@H]2CCCCN2C(=O)[C@H]2CCCS2(=O)=O)CC1	1831280925	DGJJZMMNFFWXGE-JKSUJKDBSA-N	449.411	1.968	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cnc4ccccn34)C2)C1	1831639344	QPGSIODWARSYFR-AVRDEDQJSA-N	448.951	1.741	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3snnc3C3CC3)C2)C1	1831647093	QDGUHRNZFRXIIE-IFXJQAMLSA-N	442.969	1.893	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(C)nc(O)c3)C2)C1	1831647502	WMSUSBCYADLEPC-UZLBHIALSA-N	425.913	1.573	50	20	IDGD	
Cc1nn(C)c(C)c1C(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1831804642	SNBUMDBMRHJVEC-HXUWFJFHSA-N	426.945	1.372	50	20	IDGD	
CSCC[C@H](O)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1	1831874557	KFSSBMNZGISFDU-ROUUACIJSA-N	442.626	1.093	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H](F)Br)CC1	1831874796	WDNVAQUEXHNJPF-WMLDXEAASA-N	449.365	1.670	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CC(=O)OC(C)(C)C)CCO2)C1	1831987349	YLEBALJAFDHEAR-FOIQADDNSA-N	432.945	1.582	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)c3cccc(=O)n3C)CC2)CC1	1833531189	IGZCTBYOVRBDFW-SFHVURJKSA-N	436.984	1.978	50	20	IDGD	
C[C@H](C(=O)N1CCC(N2CCC(NC(=O)CCBr)CC2)CC1)C1(O)CCC1	1834421473	IRGSBIFDHIHFAV-OAHLLOKOSA-N	444.414	1.894	50	20	IDGD	
O=C(/C=C/c1ccccc1)N1CCOC[C@]2(C1)CN(C(=O)CCBr)CCO2	1834822564	VXANMBSIQZWGPY-YJJPMGAVSA-N	437.334	1.941	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(C)c(F)c3)CCO2)C1	1838916525	XGGZTOMOMNZRJN-OXQOHEQNSA-N	428.888	1.458	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(F)c(F)c3)CCO2)C1	1839010736	DKQDRSGJZHNCOO-LIRRHRJNSA-N	432.851	1.289	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(F)F)C2)C1	1839743537	XGLYGKIVTBYCQT-FZXOMJPYSA-N	441.381	1.593	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc4cnccc34)C2)C1	1840153186	GXTDSENFVCXVEO-KNQAVFIVSA-N	447.919	1.559	50	20	IDGD	
Cc1cc(C)n(CCC(=O)N2CCO[C@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)n1	1840348661	VOSFFUAFNQLEPU-GOSISDBHSA-N	433.336	1.150	50	20	IDGD	
Cc1ccc2[nH]cc(CC(=O)N3CCCC34CN(C(=O)c3cnccc3C(=O)NN)C4)c2c1	1841974713	HTUBFGPJYQFRFX-UHFFFAOYSA-N	446.511	1.535	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCCC12CN(C(=O)[C@H]1CCNC(=O)C1)C2	1845872020	QMDZXVKOKZBUDY-MDNIKOHYSA-N	428.439	1.601	50	20	IDGD	
O=C([C@H](O)CCl)N1CC2(CCCN2C(=O)[C@H](Br)Cc2ccccc2)C1	1845940178	BFHSLLWVTDLEJB-HUUCEWRRSA-N	429.742	1.796	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)c1cc(F)c(N(C)C)c(F)c1)C2	1846385782	VJSUQFMFRTVIQW-UHFFFAOYSA-N	437.491	1.221	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC2(CCCN2C(=O)CCn2cncn2)C1	1846547186	CKCMRGSWEBERKF-LZYBPNLTSA-N	426.427	1.757	50	20	IDGD	
C=CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](Cl)COC	1847942339	SHNXRVIIEKFUKW-WCVJEAGWSA-N	429.945	1.911	50	20	IDGD	
C=C1c2ccccc2C(=O)N1CC(=O)NNC(=O)c1sc(N2CCOCC2)nc1C	10291753	ZQZJEKGEBHRYMQ-UHFFFAOYSA-N	427.486	1.176	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2ccc(C(=O)NNC(=S)NC(C)(C)C)cc2)C[C@@H](C)O1	14894873	GHDOBFDJMKZBNG-BETUJISGSA-N	428.580	1.392	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCN(C(=O)N2CCCCC2)CC1	23663001	YFPRAFVVQLPHGW-UHFFFAOYSA-N	437.928	1.333	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCN(c3ccccc3OC)CC2)cc1OC	28901726	JFGXPUCNBYYYAU-UHFFFAOYSA-N	428.489	1.296	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)[C@@H]1CCCN1S(=O)(=O)c1cccs1	109905536	OZHAEYWCLKGEFS-WFASDCNBSA-N	441.506	1.655	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@@H]2C(=O)NNc2nc(-c3ccncc3)no2)c(OC)c1	728073291	CARGYBHVYFNQHQ-MRXNPFEDSA-N	438.444	1.897	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)N2CCN(CC(=O)NC3CCC(C)CC3)CC2)cc(C#N)n1C	728281706	OKRJROMMNSWNID-NDENLUEZSA-N	436.560	1.951	50	20	IDGD	
C[C@@H](Oc1ccc(F)c(F)c1)C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	728336308	JTXMZCDWCCZNCM-DIFFPNOSSA-N	436.367	1.263	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2ccc(OCc3ccccc3)nc2)n1	728730023	GAYKHDJOTRAYAZ-UHFFFAOYSA-N	440.481	1.972	50	20	IDGD	
CN(Cc1ccc2c(c1)OCCO2)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	728958099	SGQXXWAOZLYKHZ-UHFFFAOYSA-N	426.477	1.337	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CN2CCN(Cc3nc(-c4cccs4)no3)CC2)cc1	729471465	TXQWMOYEMCSBLE-UHFFFAOYSA-N	440.529	1.685	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N[C@H](C)[C@@H](C)N1CCOCC1	729623062	FTIRFADONNORKG-MCIONIFRSA-N	443.342	1.656	50	20	IDGD	
CC(C)C[C@@H](C(=O)NNC(=O)CCc1ccccc1O)N1C(=O)[C@H]2CC=CC[C@H]2C1=O	730034041	OIYSRVARBQNMPU-KSZLIROESA-N	427.501	1.838	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)CCCc2ccc3nc(O)[nH]c3c2)c2ccccc2c1=O	730205227	JRXDNKCYWIFEGN-UHFFFAOYSA-N	434.456	1.782	50	20	IDGD	
O=C(Cc1ccc(Cl)cc1)NNC(=O)[C@H]1CCN(c2ccc3c(c2)OCCO3)C1=O	730515243	KQQKWJWTXBXKAR-MRXNPFEDSA-N	429.860	1.854	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)COc1ccccc1O)c1cc(F)ccc1N1CCN(C)CC1	730907249	FMAPYQYWTQSDRF-OAHLLOKOSA-N	445.495	1.754	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)NCC1(N2CCC(OC)CC2)CCCC1	730912800	AVXFZAHKEPJHTR-UHFFFAOYSA-N	434.537	1.828	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)[C@@H](c2ccccc2)N2CCC(O)CC2)cc1	731249563	TWSIZYDMFKYBIV-OAQYLSRUSA-N	425.485	1.497	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)[C@@H]3CCCCN3C)c2)cc1	731865183	HTLBTUKBVVLLNS-IBGZPJMESA-N	446.529	1.741	50	20	IDGD	
COCCOc1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1	731956034	HEOVERUYOCUOJC-UHFFFAOYSA-N	447.513	1.571	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)COc1ccc(N2CCCC2=O)cc1	734240942	XEOBCDXYXYWHTJ-UHFFFAOYSA-N	435.481	1.047	50	20	IDGD	
C[C@H](CN1CCN(c2ccccn2)CC1)NC(=O)NNC(=O)COCc1ccccc1	738485071	UHRFVLHKFFWTSA-GOSISDBHSA-N	426.521	1.139	50	20	IDGD	
CN(C)C(=O)Nc1cccc(C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c1	740370166	VGNMYGTZENTLHQ-UHFFFAOYSA-N	429.389	1.306	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCc2ccccc2)cc1C(=O)NNc1ncnc2[nH]cnc12	740746677	DBHXSDYQKBBZQF-UHFFFAOYSA-N	437.485	1.897	50	20	IDGD	
COc1cc(CCNC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)ccc1C	741425083	JFGDZLAECBFIJW-UHFFFAOYSA-N	448.545	1.506	50	20	IDGD	
COC(=O)c1cc(Cl)cc(S(=O)(=O)NNC(=O)c2cc(Br)c[nH]2)c1	741648269	YKLABNSMFUYYHF-UHFFFAOYSA-N	436.671	1.841	50	20	IDGD	
COC(=O)c1cc(Cl)cc(S(=O)(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c1	741657561	QXNKYDLZTNIPSZ-UHFFFAOYSA-N	434.861	1.936	50	20	IDGD	
Cc1nn(C)c2sc(C(=O)N[C@@H](C)C(=O)NNC(=O)COc3ccccc3F)cc12	742032888	BAGPQACZGQGDCE-NSHDSACASA-N	433.465	1.427	50	20	IDGD	
CN(C)C1(CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)Cc2ccccc2C1	743509654	JBDOVXHKGUYIRB-UHFFFAOYSA-N	444.561	1.023	50	20	IDGD	
O=C(NNC(=O)N1CCc2c(cccc2N2CCOC2=O)C1)c1ccc(-n2cnnn2)cc1	743510604	BOQYBGMFCVDLAS-UHFFFAOYSA-N	448.443	1.032	50	20	IDGD	
CS(=O)(=O)Nc1ccc(C(=O)NNC(=O)c2cc(Br)ccc2O)cc1	743733525	KSJDLMUCZNYNRY-UHFFFAOYSA-N	428.264	1.601	50	20	IDGD	
CC(=O)N1CCc2ccccc2[C@@H]1CC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	743830618	ZTUZWQLYPPFAGL-IBGZPJMESA-N	444.513	1.779	50	20	IDGD	
COCCCOc1cccc(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)c1	744620511	GRBNLBMDWSAGGJ-UHFFFAOYSA-N	449.529	1.880	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)CC[S@@](=O)c2ccc3c(c2)OCCO3)cc1	746094457	KHDKYHCEXNTFCZ-SSEXGKCCSA-N	429.454	1.054	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)[C@H]1CCCN(C(=O)c2ccc3n[nH]cc3c2)C1	746636957	JCWABYGSBLZWQD-INIZCTEOSA-N	445.483	1.453	50	20	IDGD	
Cc1ccc(S(=O)(=O)Nc2cccc(C(=O)NNC(=O)C(=O)N3CCCC3)c2)cc1F	748247105	UJODCRQZDRLZEO-UHFFFAOYSA-N	448.476	1.318	50	20	IDGD	
O=C(NCCC1CCN(CC(F)(F)F)CC1)NNC(=O)c1nnc(O)c2ccccc12	748968367	VDPKAALSGSEXMU-UHFFFAOYSA-N	440.426	1.944	50	20	IDGD	
CCOc1ccccc1C(=O)N1CCC[C@@H]1C(=O)NNC(=O)CNC(=O)c1cccs1	751210009	ZTEURKTYWIJVNI-OAHLLOKOSA-N	444.513	1.329	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)NCC1(CN2CCOCC2)CCCCC1	751603811	RYAKYXFNNBNCGJ-UHFFFAOYSA-N	428.537	1.869	50	20	IDGD	
C[C@H]1C[C@H](CNC(=O)OC(C)(C)C)CN1CC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	752071986	GHJCLGHIUFVAOA-UONOGXRCSA-N	435.481	1.591	50	20	IDGD	
O=C(NN=C1CCCC[C@@H](N2C(=O)c3ccccc3C2=O)C1)N[C@@H]1CCS(=O)(=O)C1	752728254	YFTYWRXIXJRGIZ-HUUCEWRRSA-N	432.502	1.458	50	20	IDGD	
CC(C)c1cccc(-n2cc(O)c(C(=O)NNC(=O)CCN3C[C@H](C)O[C@H](C)C3)n2)c1	752788296	DSFXLHOBCPXWQJ-IYBDPMFKSA-N	429.521	1.962	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)Nc2nnc(C)n2C)cc1	753128132	PHNRFGIMGZRSEZ-XNTDXEJSSA-N	434.460	1.417	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)NCCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)c1	754136205	VOVGTFXNVTXQEE-UHFFFAOYSA-N	436.446	1.086	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)N[C@H]1CCO[C@H](c2ccc(F)cc2)C1	754136961	WYRDPICPDROBJA-WMZOPIPTSA-N	425.424	1.666	50	20	IDGD	
O=C(CC(F)(F)F)NNC(=O)Nc1ccc(N2CCOCC2)cc1N1CCOCC1	755455555	UXZICAZOGDCQJV-UHFFFAOYSA-N	431.415	1.465	50	20	IDGD	
COc1ccc(S(=O)(=O)NC2CC2)cc1NC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	755614859	TXIDIHBRDPVGFC-UHFFFAOYSA-N	449.445	1.511	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)CS(=O)(=O)c2ccc(F)cc2)cc1C	755623304	QVYCOYBKBMLYJB-CQSZACIVSA-N	435.477	1.638	50	20	IDGD	
CNC(=O)c1ccc(C)c(NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)c1	755666228	VANQNBSTTBVLQX-UHFFFAOYSA-N	447.517	1.136	50	20	IDGD	
COc1ccc(C(=O)N2CCN(C)CC2)cc1NC(=O)NNC(=O)Cc1ccc(F)cc1	756249558	XROJDIBTNWOCRA-UHFFFAOYSA-N	443.479	1.617	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)Nc2ccc(S(=O)(=O)N(C)C3CC3)cc2)c1	756404329	WICSLVKDANBZKU-UHFFFAOYSA-N	446.489	1.289	50	20	IDGD	
CC(C)NC(=O)CN(C)CC(=O)NNC(=O)c1cn(-c2ccccc2)nc1-c1ccccc1	756772800	MLVIWGCGDFUQPZ-UHFFFAOYSA-N	448.527	1.757	50	20	IDGD	
Cc1nn([C@@H]2CCS(=O)(=O)C2)c(C)c1NC(=O)NNC(=O)COCc1ccccc1	757872174	UOKQZGHTDCBAFX-MRXNPFEDSA-N	435.506	1.229	50	20	IDGD	
Cc1cnc(O)n1-c1ccc(C(=O)N2CCN(S(=O)(=O)CBr)CC2)cc1	758528483	VUVZYEZUMHYBJD-UHFFFAOYSA-N	443.323	1.326	50	20	IDGD	
CN(NC(=O)[C@]1(C)Cc2ccccc2C(=O)O1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758787619	UJUDXEXOVAUBGA-QFIPXVFZSA-N	446.504	1.794	50	20	IDGD	
C[C@H](CC(=O)NNC(=O)c1cccc(Cl)c1)NS(=O)(=O)c1cccnc1Cl	760263517	FDALPGGQNXPLNV-SNVBAGLBSA-N	431.301	1.907	50	20	IDGD	
Cc1cc(C)nc(-n2nccc2NC(=O)C(=O)NNC(=O)c2cccc(OC(F)F)c2)n1	760278570	ZPKQCRATSFISRX-UHFFFAOYSA-N	445.386	1.280	50	20	IDGD	
CCCS(=O)(=O)Nc1ccc(C(=O)NNC(=O)CCNC(=O)OC(C)(C)C)cc1	760431827	IEFMDSURLCTPOD-UHFFFAOYSA-N	428.511	1.514	50	20	IDGD	
C=C(C)COCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	762377982	ZNSOHYAFEJLRSZ-UHFFFAOYSA-N	446.529	1.702	50	20	IDGD	
O=C(C[C@@H]1Sc2ccc(Cl)cc2NC1=O)NNc1nccc(N2CCOCC2)n1	762856289	JUAIEKZQURJIPI-AWEZNQCLSA-N	434.909	1.913	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)c1	763261848	HTUFTAFFKGZOFY-SFHVURJKSA-N	445.497	1.652	50	20	IDGD	
CC(=O)N1CCCc2ccc(S(=O)(=O)NNC(=O)CSc3ccccc3O)cc21	763408088	BKIDSPWYJWERGE-UHFFFAOYSA-N	435.527	1.793	50	20	IDGD	
C[C@@H]1CN(c2ccc(CNC(=O)NNC(=O)CSc3ccccc3O)cn2)CCO1	763471568	BVMIIERHZWGADY-CQSZACIVSA-N	431.518	1.635	50	20	IDGD	
O=C(NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1)C(=O)Nc1cccnc1	763599894	ACWKVTQYOZJCAD-UHFFFAOYSA-N	445.482	1.344	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2c(C)nc3ccccn23)n([C@@H]2C[C@H]3CC[C@H]2C3)n1	763629807	UCQPBCSUQRJHNF-HRCADAONSA-N	435.488	1.908	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(C(=O)NC(C)(C)C)c2)cc1C	763666504	HCSVCRSGFGJJRV-UHFFFAOYSA-N	440.500	1.997	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccccc1O[C@H](C)C#N	763679593	AOYGBFMFCDXWJV-CQSZACIVSA-N	426.429	1.541	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccc(N2CCOC2=O)c1	763710886	CXCNCMNSSGDPMG-UHFFFAOYSA-N	426.429	1.371	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(C(=O)N[C@@H](C)CC)cc1	763712336	OQQJKPLJORMHBR-HNNXBMFYSA-N	440.500	1.942	50	20	IDGD	
CN(C)CCC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(N(C)C)c2)cc1	763754291	PBEGBTHQQDTMJQ-UHFFFAOYSA-N	440.504	1.043	50	20	IDGD	
CCCCn1ncc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(C(C)=O)cc2)c1C	763872146	KUMJESJZOPVQDK-HNNXBMFYSA-N	429.477	1.748	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)C(=O)CCC3)cc1	763877075	HJOKPYDVZWYLGY-CQSZACIVSA-N	437.452	1.962	50	20	IDGD	
Cc1nnnn1-c1cccc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CC[C@@H](C)C3)c1	763940561	TXXFQRILVHJOBY-LLVKDONJSA-N	439.501	1.557	50	20	IDGD	
CCN(CC)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)cc1	763978185	FPNBPRSZTPPVNU-UHFFFAOYSA-N	432.864	1.927	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)n([C@H]2C[C@H]3CC[C@H]2C3)n1	764006350	PLCMVDPPMGAXER-DZKIICNBSA-N	439.472	1.724	50	20	IDGD	
COc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NNC(=O)Cc1cccc2ccccc12	764034283	BCYNOCMCWLOVOK-UHFFFAOYSA-N	448.479	1.879	50	20	IDGD	
CC(C)n1ncc2cc(NC(=O)C(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)ccc21	764077272	LSBSOYIEZONATD-UHFFFAOYSA-N	443.485	1.420	50	20	IDGD	
C[C@@H](c1cccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)nc2)c1)N1CCOCC1	764091329	BIAWTKGJJZARHD-ZDUSSCGKSA-N	431.880	1.528	50	20	IDGD	
COC(=O)c1cc(F)c(F)cc1NC(=O)C(=O)NNC(=O)c1ccc(Cl)cc1O	764116762	GKRURMILBWTQBP-UHFFFAOYSA-N	427.747	1.510	50	20	IDGD	
O=C(CC1CCCC1)NNC(=O)C(=O)Nc1ccc(NC(=O)NC[C@@H]2CCCO2)cc1	764178471	AGGOGMIJXBYFOF-KRWDZBQOSA-N	431.493	1.653	50	20	IDGD	
CS(=O)(=O)Cc1cc(F)ccc1NC(=O)C(=O)NNC(=O)Cn1ccc2ccccc21	764239055	CERBRRHTPGGMSS-UHFFFAOYSA-N	446.460	1.111	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1cccc(CN2CCCCC2)c1	764277803	OCIWYZMWMJOQCJ-UHFFFAOYSA-N	426.473	1.543	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)C(=O)Nc1ccc(N2CCOCC2)c(F)c1)c1ccccc1	764332603	UZPMGHVAGINVGU-QGZVFWFLSA-N	428.464	1.942	50	20	IDGD	
Cc1nc(C)n(-c2ccccc2NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)n1	764350104	XOJKGKIGPCZKKE-UHFFFAOYSA-N	428.836	1.643	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(N2CCCCC2)c(Cl)c1	764397653	LMKQPUHJNRDURI-ZDUSSCGKSA-N	426.901	1.468	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)c(OCCN(C)C)c1	764405340	RYZDYXXAFXZDHG-UHFFFAOYSA-N	446.529	1.519	50	20	IDGD	
COC(=O)[C@@H]1CN(C(=O)C(=O)NNC(=O)c2ccc(Cl)cc2F)c2ccccc2O1	764412001	CLTHFENAVXECGF-HNNXBMFYSA-N	435.795	1.207	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=S)NCC(C)(C)CN(C)C)n[nH]2)cc1OC	764501462	YLOWKYKCWSICGD-UHFFFAOYSA-N	434.566	1.791	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)CCC(=O)N2CCN(c3ccccc3)CC2)cc1C	764525543	VKZJVLHFIMRWMT-UHFFFAOYSA-N	438.528	1.959	50	20	IDGD	
O=C(NNC(=O)[C@@H](O)c1cccnc1)c1nn(Cc2ccccc2)c(=O)c2ccccc12	764596382	JQDKBGVIFJZMIW-FQEVSTJZSA-N	429.436	1.334	50	20	IDGD	
CNC(=O)c1ccc(C=NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)cc1	764838176	BNPSZWNDWWHUQO-UHFFFAOYSA-N	427.936	1.968	50	20	IDGD	
N#Cc1ccccc1S(=O)(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	765119480	RUVRYAMGPMVVDH-UHFFFAOYSA-N	447.948	1.339	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)c1ccc(Cl)c(N2CCNC2=O)c1	765320553	PZWHQNABSUJCCN-UHFFFAOYSA-N	439.900	1.936	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCCOCC(F)(F)C(F)F)c2ccccc2c1=O	765644377	BSJWDQOJVHUWES-UHFFFAOYSA-N	433.362	1.277	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)[C@H]1C[C@H]1c1cccc(F)c1F	765739098	QGAZNXLYLVWCFU-ROUUACIJSA-N	442.466	1.674	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H]2CCO[C@H](c3ccccc3)C2)c1	765915463	JHQBBQYRUPVDPL-HKUYNNGSSA-N	446.529	1.801	50	20	IDGD	
COC(=O)c1nccc2c(S(=O)(=O)NNC(=O)CCc3ccccc3O)cccc12	766319117	TXNIGTIMRYVSKD-UHFFFAOYSA-N	429.454	1.669	50	20	IDGD	
CS(=O)(=O)c1ccc(OCCNC(=O)NNc2ccccc2S(C)(=O)=O)cc1	766961770	JQIZMXFXHBBMOX-UHFFFAOYSA-N	427.504	1.199	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)CCC(=O)N2CCN(c3ccccc3)CC2)cc1	767853234	OZCRTHKIMWWYEQ-UHFFFAOYSA-N	439.516	1.384	50	20	IDGD	
COc1cc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)ccc1OC(C)C	768182635	JDVIFKYMDDFEEP-LJQANCHMSA-N	444.440	1.627	50	20	IDGD	
COc1cc2c(cc1NC(=O)C(=O)NNC(=O)c1cc3c(s1)CCC3)NC(=O)CC2	768236903	GJDOJBNSMZJVBP-UHFFFAOYSA-N	428.470	1.530	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cccc(C(F)(F)F)c2)n(-c2ncccn2)n1	768238933	HSWQZLWPLXJXEN-UHFFFAOYSA-N	433.350	1.389	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)c3cc(NS(C)(=O)=O)ccc3O)n[nH]2)cc1C	768262897	MDSBQWZTADHFNB-UHFFFAOYSA-N	443.485	1.845	50	20	IDGD	
CCS(=O)(=O)N1CCC[C@@H](C(=O)NNC(=O)c2cc(-c3cc(C)ccc3C)[nH]n2)C1	768269591	ORHGPKAEJQDENV-OAHLLOKOSA-N	433.534	1.516	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)/C(=C/c1ccc(F)cc1)n1nnnc1C	768641534	RULKWOODJXNYTP-PTNGSMBKSA-N	446.464	1.674	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)/C(=C/c1cccs1)n1nnnc1-c1ccccc1	771914465	RZIIKQGPNCXKCO-OPCAMPFDSA-N	440.485	1.889	50	20	IDGD	
CCc1c(C(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)cnn1-c1ccccn1	772898874	UJHYNJZNMPMFAV-UHFFFAOYSA-N	426.864	1.561	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(C(F)(F)F)ccn1	773523331	BZILKYBPGDTUNR-UHFFFAOYSA-N	426.351	1.664	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)[C@H]2CCN(C(=O)OCc3ccccc3)C2)cc1	773576538	IMLTVNDDJVNPDN-IBGZPJMESA-N	439.468	1.958	50	20	IDGD	
O=C(CC12CC3CC(CC(C3)C1)C2)NNC(=O)N[C@@H]1CCO[C@]2(CCS(=O)(=O)C2)C1	776075841	HAGLQFIWTKIWJI-LFSUDDHMSA-N	439.578	1.660	50	20	IDGD	
COc1ccccc1[C@@](N)(C(=O)NNC(=O)c1nnc(O)c2ccccc12)C(F)(F)F	776096483	LQIQSJLTQAREFW-GOSISDBHSA-N	435.362	1.522	50	20	IDGD	
Cc1n[nH]c(C)c1CC(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	776323420	OPKYFZHALVYSIB-UHFFFAOYSA-N	430.472	1.732	50	20	IDGD	
CON(C)S(=O)(=O)c1cc(C(=O)NNc2cccc(S(C)(=O)=O)c2)ccc1Cl	776720769	HERCKTJRYNPQFO-UHFFFAOYSA-N	447.922	1.682	50	20	IDGD	
CC(C)(C)OC(=O)N1CC=C(CNC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)CC1	777411701	CDLYKCHZTMUCJM-UHFFFAOYSA-N	442.480	1.174	50	20	IDGD	
CCCCN(CC(=O)NNC(=O)c1cc(Cl)ccc1OC)[C@H]1CCS(=O)(=O)C1	779031934	CKDCBDUAXMUVIT-AWEZNQCLSA-N	431.942	1.399	50	20	IDGD	
CC(C)(C)c1ccc(Cn2nccc2NC(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)cc1	779461207	FZECFWQHKOIVAC-OAHLLOKOSA-N	433.534	1.816	50	20	IDGD	
O=C(NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12)N[C@H]1CCC[C@H]1CCO	779710317	CHKUTMVYQKQYPZ-PXNSSMCTSA-N	449.511	1.940	50	20	IDGD	
CCO[C@H]1C[C@](NC(=O)OC(C)(C)C)(C(=O)NNC(=O)C(=O)Nc2ccccn2)C1(C)C	780896615	KVILBQTXFSIJDZ-ZSEKCTLFSA-N	449.508	1.266	50	20	IDGD	
CCc1ccc(C(=O)NNc2ncncc2Cl)cc1S(=O)(=O)N1CCOCC1	781819950	LNFZHIHSPYJSIJ-UHFFFAOYSA-N	425.898	1.470	50	20	IDGD	
CC(=O)N1CCN(c2cccc(NC(=O)NNC(=O)COc3ccccc3C#N)c2)CC1	782084117	WBWQOZHKDUUMCH-UHFFFAOYSA-N	436.472	1.458	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNc2nc3ccccc3s2)cc1C(=O)OC	782813149	ZAPKVRNHZBAVFR-UHFFFAOYSA-N	428.426	1.951	50	20	IDGD	
CN1CC(=O)N(c2cccc(NC(=O)C(=O)NNc3ccccc3Br)c2)C1=O	782989331	YGVNQJURGRDOFO-UHFFFAOYSA-N	446.261	1.929	50	20	IDGD	
CC(C)(C)OC(=O)Nc1cnc(C(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)cn1	783060078	FQQXTZZTFCAJSG-UHFFFAOYSA-N	448.867	1.554	50	20	IDGD	
O=C(NNc1cncc(Cl)n1)C(=O)Nc1cc(Br)cnc1-n1cccn1	783266355	ROQQREXIJKVQTL-UHFFFAOYSA-N	437.645	1.555	50	20	IDGD	
CN1CCC/C1=N\S(=O)(=O)c1ccc(NC(=O)C(=O)NN(C)c2ccccc2)cc1	783424498	FRVWKIYOQXOXNU-PTGBLXJZSA-N	429.502	1.606	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCCN(c3ncccc3F)CC2)cc1OC	784407010	UIYHHUQPBFSVQR-UHFFFAOYSA-N	431.468	1.211	50	20	IDGD	
CN(C)C(=O)C[C@@H]1CN(C(=O)C(=O)NNc2nccnc2Cl)c2ccc(Cl)cc21	784777798	LUCZPZAPCPEFCN-SNVBAGLBSA-N	437.287	1.835	50	20	IDGD	
COC(=O)Nc1cccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)c1	784835401	NSOCRKHXTWCOOJ-UHFFFAOYSA-N	442.400	1.943	50	20	IDGD	
CC(C)Cn1ncc(NC(=O)C(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)c1C(F)F	785022675	IQFGTEFKVOSLID-UHFFFAOYSA-N	440.363	1.490	50	20	IDGD	
COc1cc(C(=O)NNC(=O)N[C@H]2CCCN(C3CCCCC3)C2=O)cc(OC)c1OC	785565254	WBDCPYAJFLXASK-INIZCTEOSA-N	448.520	1.980	50	20	IDGD	
COc1cc(Br)ccc1[C@H](C)NC(=O)NNC(=O)C(=O)Nc1ccccn1	786930051	QQLQFZMAQJWKMF-JTQLQIEISA-N	436.266	1.883	50	20	IDGD	
CN1CCC(n2ccc(NC(=O)C(=O)NNC(=O)c3cc4c(s3)CCCCC4)n2)CC1	787544583	VVPRYGUWLFRMTF-UHFFFAOYSA-N	444.561	1.880	50	20	IDGD	
COc1cccc(C[C@@H](C(=O)NNc2nnc(-c3ccccn3)s2)n2nnnc2C)c1	788566627	JHVZFBXHUHDTOW-INIZCTEOSA-N	437.489	1.831	50	20	IDGD	
CCS(=O)(=O)c1cc(F)ccc1NC(=O)C(=O)NNc1cccc(F)c1[N+](=O)[O-]	790999708	XKPWYEBYZSKVQR-UHFFFAOYSA-N	428.373	1.748	50	20	IDGD	
C[C@@]1(c2ccc(F)c(Cl)c2)NC(=O)N(CC(=O)NNc2nc3ccccn3n2)C1=O	791242319	PQVWLISXLNMFFX-SFHVURJKSA-N	431.815	1.432	50	20	IDGD	
CN(C)N(C(=O)c1c(O)cnc2c(Br)cccc12)[C@@H]1CCS(=O)(=O)C1	792855740	SNMVAFNSGRXQNR-SNVBAGLBSA-N	428.308	1.809	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CCNS(=O)(=O)c2ccc(OC(F)(F)F)cc2)n1	794077635	YBFKHWBSLAWOIE-UHFFFAOYSA-N	446.407	1.418	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cccc(C)n2)cc1S(=O)(=O)NC1CCCC1	794081041	ZUKNQLYTJNMWSP-UHFFFAOYSA-N	432.502	1.694	50	20	IDGD	
O=C(NNC(=O)c1ccc2ccccc2n1)Nc1cc(S(=O)(=O)N2CCCC2)ccn1	797674392	UCPZGEHJQGMRLZ-UHFFFAOYSA-N	440.485	1.881	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)[C@H](CC(N)=O)NC(=O)CC(C)C)c(C)n1-c1ccccc1	798272683	HFRRDGOFBKBVBK-SFHVURJKSA-N	427.505	1.261	50	20	IDGD	
CN(CCO)S(=O)(=O)c1ccc(C(=O)NNc2ccc(OC(F)(F)F)cc2)cc1	798334907	WGUNSBPKODKTSW-UHFFFAOYSA-N	433.408	1.955	50	20	IDGD	
Cc1cc(O[C@@H]2CCN(C)C2=O)ccc1NC(=O)NNC(=O)COc1ccc(F)cc1	799241517	UECHRDBRVZBICX-GOSISDBHSA-N	430.436	1.975	50	20	IDGD	
O=C(NCCNS(=O)(=O)c1ccc(Cl)cc1F)NNC(=O)c1ccccc1F	799384583	GUONOXBRRJOSSE-UHFFFAOYSA-N	432.836	1.541	50	20	IDGD	
CSC[C@H](C)C(=O)N1CCC(C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)CC1	799407536	VJYDOZHOSDSTTC-UONOGXRCSA-N	425.526	1.978	50	20	IDGD	
CNS(=O)(=O)c1ccccc1S(=O)(=O)NNC(=O)c1c(Cl)cccc1Cl	799529913	TZGATGMNVMSBPZ-UHFFFAOYSA-N	438.314	1.525	50	20	IDGD	
C[C@@H](NC(=O)CCc1ccccc1)C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	799601529	WGMDAJJGMMWFQM-OAHLLOKOSA-N	430.530	1.708	50	20	IDGD	
CCc1cc(C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)c2c(CC(C)(C)C)noc2n1	800690670	HDMXWWCBRXRICK-JTQLQIEISA-N	425.511	1.073	50	20	IDGD	
Cc1c(/C=C(\C#N)C(=O)NCCNS(=O)(=O)c2ccc(F)cc2Cl)cc(C#N)n1C	801516328	CESSSAATELIMHQ-VGOFMYFVSA-N	449.895	1.999	50	20	IDGD	
COc1ccc(CN2C[C@@H](C(=O)NNC(=O)Nc3ccc4c(c3)OCO4)CC2=O)cc1	802101629	RDDJWZXYGPPHIB-AWEZNQCLSA-N	426.429	1.625	50	20	IDGD	
C#Cc1cc(F)c(NC(=O)C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)c(F)c1	802566173	CMYFVMZPHVMWMI-UHFFFAOYSA-N	425.351	1.237	50	20	IDGD	
Cc1cc(=O)c(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)cn1C1CC1	806782849	YJQWSHSUKXGSFH-UHFFFAOYSA-N	445.545	1.185	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)C(=O)Nc1nc2c(s1)CSCC2	806975906	UAIFTKRYVYYYAZ-UHFFFAOYSA-N	444.498	1.223	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)Cc2ccc(Cl)cc2)cc2[nH]ccc12	808934681	QHPYHYVVJPQSLR-UHFFFAOYSA-N	428.832	1.937	50	20	IDGD	
COC(=O)Cc1occc1C(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	810593644	FHTSHMJLIWDCSP-UHFFFAOYSA-N	448.907	1.227	50	20	IDGD	
O=C(NNC(=O)N1CC[C@H](n2cc(Cl)cn2)C1)c1csc(N2CCOCC2)n1	811850756	DKVBVSBVKBUMFT-LBPRGKRZSA-N	425.902	1.131	50	20	IDGD	
CC(C)(C)OC(=O)NC/C=C\CNC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	812466198	KQEDQPDSWKYHMH-WAYWQWQTSA-N	441.510	1.507	50	20	IDGD	
CSC1(CNC(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)CCN(C)CC1	812548253	GQNXQXSQVWXZGP-UHFFFAOYSA-N	430.600	1.222	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)NC[C@@H]1C[C@H](F)CN1C(=O)OC(C)(C)C	813814172	JEFZQOBMBFNYLT-KBPBESRZSA-N	434.472	1.934	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N1CC[C@H](CS(C)(=O)=O)C1	814271478	MXYAZGDQIMDMKZ-RYUDHWBXSA-N	448.339	1.324	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NN=Cc1nc2c(s1)CCC2	814709943	HXHZLMGRVVHGRJ-UHFFFAOYSA-N	448.570	1.736	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)C2CCC(OC[C@@H]3CCCO3)CC2)c2ccccc2c1=O	814729827	FEUGKRKMAHWLID-GPANFISMSA-N	428.489	1.449	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2cnc3c(F)ccc(F)c3c2)ccc1Cl	814735630	CCUVVHUQSMUQOB-UHFFFAOYSA-N	440.815	1.889	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)CN2C(=O)[C@H]3CC=CC[C@H]3C2=O)cc1OC	814757548	HLIXECVZZRLOLI-IYBDPMFKSA-N	429.473	1.586	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)C(=O)Nc1ccc(C#N)cn1	815566347	QXGCTLZIXPJWTA-JTQLQIEISA-N	432.234	1.269	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)cc1)C1CC1	815566423	SXBVEXKLTOXPPS-ZDUSSCGKSA-N	442.447	1.894	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)cc2cccnc12	815629156	VVNZNNJSSRVMQX-PXNSSMCTSA-N	434.452	1.902	50	20	IDGD	
COC(=O)CCc1cccc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)N(C)C)c1	815751042	PZNIDTOUABDQIW-UHFFFAOYSA-N	448.501	1.124	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NN=C1C(=O)Nc2c(Cl)cc(Br)cc21	864323716	VUZSTHXZONEQKI-UHFFFAOYSA-N	436.653	1.700	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])cc(OC)c1OC	912979265	ACBQCWSLTPXKKG-UHFFFAOYSA-N	445.837	1.897	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2cc3c(s2)CC[C@@H](C)C3)cc1	913162547	YKRFKDRKTPORRA-GFCCVEGCSA-N	449.554	1.815	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1	913391839	HNONFJWWNQMMRP-UHFFFAOYSA-N	433.895	1.009	50	20	IDGD	
COc1cc(N2C[C@H](C(=O)NNC(=O)Cc3ccc(F)cc3)CC2=O)cc(OC)c1OC	913471802	YVBZVJIRAAERBD-CQSZACIVSA-N	445.447	1.595	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(N2C[C@@H](C(=O)O)CC2=O)cc1)c1cccc(Cl)c1	914746598	OEKULTPHRAQPJY-LBPRGKRZSA-N	437.861	1.401	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)[C@H]2CC(=O)N(c3ccccc3)C2)c2ccccc2c1=O	914750550	LZBXNAHTUQAZOT-HNNXBMFYSA-N	433.468	1.792	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@H]2CCCO2)c1	915879576	ZBQLPCYBTZCWFG-OAHLLOKOSA-N	448.501	1.619	50	20	IDGD	
COCCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccc(OC)cc2)c1	915879684	WLKNQWJYKROMOV-UHFFFAOYSA-N	436.490	1.477	50	20	IDGD	
CNS(=O)(=O)c1cccc(C(C)=NNC(=O)CCN2CCN(c3ccccc3)CC2)c1	915935889	VQCITPHZHADFDX-UHFFFAOYSA-N	443.573	1.647	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NCc2ccc(N3CCCC3=O)cc2)c2ccccc2c1=O	916218704	OJNPUXZEZDZJPQ-UHFFFAOYSA-N	434.456	1.205	50	20	IDGD	
COc1cc(C=NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc(OC)c1	916258126	KUEAFGFVLYHREN-UHFFFAOYSA-N	433.486	1.489	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)NCc3ccc(S(C)(=O)=O)cc3)n[nH]2)cc1	916567976	OPROMCBLEDJMOH-UHFFFAOYSA-N	427.486	1.933	50	20	IDGD	
CCS(=O)(=O)N1CCC[C@H](C(=O)NNC(=O)COc2ccc(Br)cc2)C1	918552443	TVWDAGXIYVRACQ-LBPRGKRZSA-N	448.339	1.037	50	20	IDGD	
Cc1ccc(C)c(C(=O)c2ccccc2C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)c1	919889814	USOFPDBYBNQEKN-OAHLLOKOSA-N	429.498	1.666	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Cc2nnn(-c3ccccc3)c2C)c2ccccc2c1=O	919959033	NFZMGBULPWICOI-UHFFFAOYSA-N	431.456	1.309	50	20	IDGD	
Cn1c(=NNC(=O)[C@@H]2CCCN2C(=O)/C=C\c2ccc(C(N)=O)cc2)sc2ccccc21	920017865	GFSOSSAZULUZGV-IRCCXMDISA-N	449.536	1.975	50	20	IDGD	
O=C(NNC(=O)c1sc(N2CCCC2)nc1Cl)c1csc(N2CCOCC2)n1	920274620	CZVCXCPRGUNZRW-UHFFFAOYSA-N	442.954	1.765	50	20	IDGD	
O=C(CCCn1ccnc1)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	921058195	AOTWBGPVZTYTTF-UHFFFAOYSA-N	441.513	1.603	50	20	IDGD	
CC(=O)N[C@@H](CC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)c1ccc(Cl)cc1	921160777	FZMIAZHLIVZVKA-KRWDZBQOSA-N	427.852	1.344	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)NCCCOC2CCOCC2)CC1	1319244030	MOVQGJBUUHWPDO-UHFFFAOYSA-N	428.530	1.550	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)N[C@@H]2CCN(CC(F)(F)F)C2)CC1	1321919634	FQJLMSJMPZTOGZ-CYBMUJFWSA-N	437.463	1.601	50	20	IDGD	
C[C@H](C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1)c1ccc(F)cc1F	1340529049	RHPJOZKBLKEMRC-HNNXBMFYSA-N	430.455	1.674	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@]2(C1)CN(C(=O)Cc1ccc3c(c1)OCO3)CCO2	1779296378	QGDOLVYDYPBQEL-OAQYLSRUSA-N	434.565	1.639	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(-n4cccn4)nc3)C2)C1	1779690358	YIBRHHGYJFWRFJ-NRFANRHFSA-N	443.580	1.562	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(-n4ccnc4)ccn3)C2)C1	1780392279	ONONQJGICZODPL-LIRRHRJNSA-N	448.321	1.494	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Cl)C2)[C@H]1CC[C@H]2CCC(=O)N2C1	1780612157	VMXLOZASOSKPRO-FXTXOLNPSA-N	429.920	1.436	50	20	IDGD	
CN(C)c1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@](C)(Cl)CCl)C3)C2)cn1	1781229613	GNSZBFOSHLZBOP-RTBURBONSA-N	429.348	1.827	50	20	IDGD	
O=C(c1cc(F)cc([N+](=O)[O-])c1)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781332814	JTNVWAZPHQTLTN-BBRMVZONSA-N	448.220	1.868	50	20	IDGD	
C[C@H](CN)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C(C#N)=C/c2ccc(F)cc2F)C1	1781597187	SHPLBZJFUCYMKM-IMGAFSBNSA-N	446.498	1.980	50	20	IDGD	
Cc1cccc(Cl)c1C(=O)N1CC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1	1781727278	SOLHHBJAYSWKKP-NRFANRHFSA-N	436.940	1.465	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(O)ccc3O)C2)C1	1782049517	VKSXKTFKSQSCAN-KDOFPFPSSA-N	427.295	1.715	50	20	IDGD	
NC(=O)c1ccc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)C(Cl)Cl)C2)cc1	1782219743	FKVQQZYIVBZUIR-AUUYWEPGSA-N	428.316	1.717	50	20	IDGD	
CCCCCc1ncc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)s1	1782712431	HWNKSTUHSLGJCR-IFXJQAMLSA-N	429.970	1.919	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1782861052	GGNLMTQFFUJPSP-NIYLOASJSA-N	439.846	1.301	50	20	IDGD	
COc1ccc(CCC(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)c(OC)c1	1782991786	UNNVUFUOFOPVAN-UTKZUKDTSA-N	440.924	1.066	50	20	IDGD	
COC(=O)[C@@H]1CC[C@H](C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](C)Br)C3)C2)C1	1783527616	DPEYCBYPXPEZFE-UYAYXHRUSA-N	431.327	1.189	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3n[nH]c(C4CC4)c3F)CCO2)C1	1783532518	PATHLGHNSOUWPB-BTDLBPIBSA-N	429.290	1.653	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccncc3F)C[C@@H]21	1783965274	GPFSFIMIRCRQJK-DUPGQFARSA-N	428.302	1.845	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc(Cl)c(Cl)c3)C[C@@H]21)[C@H](O)CCl	1784091582	YBZNTGFKIQKSJA-VMXABPDPSA-N	436.723	1.581	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)N3CCN(C)CC3)C[C@@H]21	1784620651	GBBOTHUCTPQRMT-SPOLIRPYSA-N	429.005	1.010	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@]2(CCN(C(=O)C3=COCC3)C2)C1	1784762359	OWWJVFLERVEDDQ-YWZLYKJASA-N	443.928	1.253	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(OC)c(C)c(OC)c3)C2)C1	1785177974	GSTFXYFSGMLRJK-IERDGZPVSA-N	440.924	1.710	50	20	IDGD	
COCC1(C(=O)Nc2ccc(C3(NC(=O)c4cnccc4C(=O)NN)CCC3)cc2)CC1	1786351851	CUXJNINSEOQEJS-UHFFFAOYSA-N	437.500	1.859	50	20	IDGD	
COC(=O)[C@@H]1CC[C@H](C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCBr)[C@H]3C2)C1	1786404444	IVNAJCKKPYEKNM-QRJUGERDSA-N	445.354	1.340	50	20	IDGD	
O=C(CCc1cncnc1)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21	1787042828	GKXNVOAOUIUDOV-JYJNAYRXSA-N	425.327	1.174	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]3C2)cc1O	1787449535	GPNUTSRFAOAHAW-MGBSGCIJSA-N	427.860	1.478	50	20	IDGD	
Cc1cc2nc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)[C@H](O)CCl)C[C@@H]43)[nH]c2cc1C	1788545595	YPWIUKRUUSKLMV-ZZCKCESHSA-N	434.924	1.373	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)c1[nH]cc2c1CCC2	1789162577	CVMUUCHFJJBSNY-PCBIJLKTSA-N	428.302	1.787	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21)[C@@H]1CC[C@@H]2CCC(=O)N2C1	1789770626	ABIJFUUNPNDFFX-SEBNEYGDSA-N	432.348	1.171	50	20	IDGD	
O=C(CC12CCCN1CCC2)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21	1789820076	RGDWUFFJXUGSHD-ULQDDVLXSA-N	442.398	1.770	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3n[nH]c(C)c3F)C[C@@H]21	1790961921	XTEWVQLZGRNMOQ-RVMXOQNASA-N	431.306	1.624	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21	1791082147	FFYSHMONWSNONN-QXKUPLGCSA-N	447.935	1.900	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(-n4cnnc4)cc3)C[C@@H]21	1791251235	AZVKKGWSYCBBNM-WNHJNPCNSA-N	447.923	1.114	50	20	IDGD	
O=C(CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]2C1)Nc1ccc(F)cc1	1791296632	PNHAHBORHCTYKT-CQDKDKBSSA-N	446.306	1.938	50	20	IDGD	
COC(=O)[C@@H]1CC[C@@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@](C)(Cl)CCl)C3)C1	1792974127	XLCIJZMJSXAUES-VZTYJIHUSA-N	435.348	1.402	50	20	IDGD	
C[C@H](CBr)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cn1cc([N+](=O)[O-])cn1)C2	1792986935	GEDIQCKVTYAVGW-FVCCEPFGSA-N	428.287	1.461	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(C)(C)C	1795153930	HYCJDHWIHMALEI-XGUBFFRZSA-N	431.961	1.754	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1scnc1C	1795167392	KUZKQMDVXCUHLC-NGYDUSEUSA-N	428.518	1.837	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CC1CC1	1795343231	DUPQBWQADGBVSE-YVWYUNDQSA-N	431.445	1.523	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc[nH]c2nccc1-2	1796186296	LTRCQRUOBBJBNE-RHQBZFHZSA-N	425.316	1.954	50	20	IDGD	
O=C(Cc1ccc(Cl)cc1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1	1796191112	AADSXMCRIDHJCE-ACDBMABISA-N	426.709	1.514	50	20	IDGD	
Cc1cc2[nH]c(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3cccc(B(O)O)c3)cc2s1	1796192967	FVDHDKVVQNCJIQ-BJWYYQGGSA-N	437.330	1.783	50	20	IDGD	
Cc1cc(NC(=O)CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@](C)(Cl)CCl)C3)no1	1796420062	YCPFAKAUQBZGER-XBCDXLOZSA-N	447.319	1.138	50	20	IDGD	
CCC[C@@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnccc1C(=O)NN)C2)n1cccc1	1796828278	WRMXFOPXMYYVNU-CLWJZODNSA-N	438.532	1.780	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(Cl)nn1	1798037336	CDWRFDZRPVPVEG-MIJXAVMKSA-N	431.718	1.507	50	20	IDGD	
COC[C@H](C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O	1798522584	AWANNEVKOJFYOP-FIIQBIKZSA-N	449.460	1.006	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(OC)nc1)C2	1800640425	XJHYPCHRAITDQV-HLPPOEQASA-N	426.311	1.467	50	20	IDGD	
COc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)Br)c(C)c1	1800760072	YURRNBIJUTUKQY-ZJOBFFGXSA-N	425.323	1.990	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H]2C[C@@]21C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2	1800772875	QIRBMFFDFAUQKP-QCXOTSQMSA-N	445.919	1.510	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c(Cl)cccc1OC)C2	1800983256	UFTLGWXSKDYHFD-IFOZYUSPSA-N	431.316	1.806	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CS[C@H]1CCCCO1)C2	1802337466	MCLPBWUAQPIWMR-QOIOWGMHSA-N	426.583	1.257	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)COc2cccnc2)[C@@H]1c1cccnc1	1804338198	CIECKAJAAQPSJH-KPFFTGBYSA-N	432.908	1.815	50	20	IDGD	
Cc1cccc(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)n1	1805508385	VCIVTIOIYONZPZ-KNQAVFIVSA-N	444.300	1.098	50	20	IDGD	
O=C(COc1ccc(F)cc1)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1	1806475392	UFJJUJWQJTUQAW-QKYXUNIQSA-N	435.883	1.905	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)c1[nH]nc2ncccc12	1808104592	KJLYQURZJYSACY-QRTARXTBSA-N	428.880	1.272	50	20	IDGD	
Cc1ccnc(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)c1	1808534267	ZQHOZCSDCCMRRL-DENIHFKCSA-N	444.300	1.098	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)c3n[nH]c4ccccc34)CC2)C1	1809972323	MJQKSLPSKWDEHD-UHFFFAOYSA-N	446.316	1.401	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)[C@H](O)c1ccccc1	1817079063	LRTDFUAJWXTGRK-TZIWHRDSSA-N	448.288	1.129	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)C2CC3(CCC3)C2)[nH]n1)c1ccc(B(O)O)cc1	1817475419	NYDJZJZULDZAOT-LJQANCHMSA-N	436.321	1.976	50	20	IDGD	
C[Si](C)(C)OCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1nc3ncccn3n1)CC2	1820165106	UEHBUIXXRUNYNM-LLVKDONJSA-N	445.581	1.658	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCc2cncnc2)[nH]n1	1822413912	GYVLPGSQNMYQKP-KRWDZBQOSA-N	442.524	1.198	50	20	IDGD	
CCCC(=O)N[C@H](C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1	1822414906	NUIBSDHCELQKPJ-GDBMZVCRSA-N	449.556	1.080	50	20	IDGD	
C#CC(=O)N[C@@H]1CCc2nc(NC(=O)CN(C)NC(=O)NCc3ccccc3)sc2C1	1822518922	XVSPGNQHDFIALE-OAHLLOKOSA-N	440.529	1.035	50	20	IDGD	
O=C(Cn1ccncc1=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1	1823009645	RWPSGGZWJDYXQN-AMIZOPFISA-N	444.286	1.003	50	20	IDGD	
C[C@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1)n1ccnc1	1824316777	FMUKJPVAIGKCTC-MJGOQNOKSA-N	432.569	1.437	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](C)n1cnnn1)CC2	1825648077	XVFKQAGYRDXCRU-XHNCKOQMSA-N	428.316	1.086	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CNCP(=O)(O)O)CC1	1826800744	IOQWWYXUZSMWAL-HOTGVXAUSA-N	437.905	1.738	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC([C@H]2CCCCN2C(=O)CN2CCNC2=N)CC1	1826873924	PCVWBANAJOHOJT-UKRRQHHQSA-N	428.375	1.229	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)CCn3ccnn3)sc2C1	1826879340	MZOGPDNYWDICAM-VHSXEESVSA-N	427.328	1.520	50	20	IDGD	
COCC1(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)CC1	1827056074	RQFWLAWKUJIXDI-HXUWFJFHSA-N	428.338	1.026	50	20	IDGD	
Cc1cc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)cn1C	1827059393	OQQRKPGQPMVCDE-QFIPXVFZSA-N	437.349	1.560	50	20	IDGD	
CCC1(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)COC1	1827060173	BTOPLHTXLSCKSH-HXUWFJFHSA-N	428.338	1.026	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)C[C@H]2NC(=O)NC2=O)CC1	1829097216	DDUHCHZROOMYLC-HZPDHXFCSA-N	438.601	1.056	50	20	IDGD	
CCSc1ncccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1829578052	CUTGLVKWPXKVHY-KDOFPFPSSA-N	431.917	1.798	50	20	IDGD	
Cc1nc(N)sc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830358906	GSFYGZOJKRFSPD-GOSISDBHSA-N	430.958	1.369	50	20	IDGD	
CS(=O)(=O)CC(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H](F)Br)CC1	1830374639	KOMDRFTYTOULFA-TZMCWYRMSA-N	427.336	1.341	50	20	IDGD	
C=CCC(CC=C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1830642385	AGCCUJFARHNTBW-QAPCUYQASA-N	433.318	1.902	50	20	IDGD	
Cc1ccc(CCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)cc1F	1830726902	VVDLNUZGCSWONI-WIYYLYMNSA-N	442.915	1.123	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)C#CC3(O)CCCCC3)C2)C1	1831650900	MDWXEVJZWWNEAI-AVRDEDQJSA-N	440.968	1.549	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@@H]3CCC(=O)NC3)CC2)CC1	1833117846	BTDVCCCDKNGDOG-CRAIPNDOSA-N	426.989	1.492	50	20	IDGD	
C[C@@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)c3cc[nH]n3)CC2)CC1	1833265051	NMHMRUMTONIRCM-ZDUSSCGKSA-N	426.359	1.626	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)[C@H]1CCCCC1(F)F	1833548389	GELLRBGFCPWMEI-IAGOWNOFSA-N	435.943	1.983	50	20	IDGD	
Cn1ccc(C(=O)NC2CCN(C3CCN(C(=O)[C@](C)(Cl)CCl)CC3)CC2)n1	1834217404	NAFFQXKLJGHRHI-LJQANCHMSA-N	430.380	1.842	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCC(N2CCC(NC(=O)Cn3ccnc3)CC2)CC1	1834266694	BTQUDXHDOSFFBM-IBGZPJMESA-N	430.380	1.691	50	20	IDGD	
Cc1nocc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)CBr)C2)C1	1834332314	KTZISDKWJUUOPC-PXAZEXFGSA-N	430.299	1.084	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)Cn3cccn3)CC2)CC1	1834884639	ICWGHJKWRQZGJE-AWEZNQCLSA-N	426.359	1.238	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccccc3)CCO2)C1	1834998934	AYANTKFBVDGVSF-HNAYVOBHSA-N	425.323	1.469	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@H](C)N(C)C(C)=O)CC2)CC1	1835120394	BIXMDQUJGJLBMC-HNAYVOBHSA-N	429.005	1.832	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)c1cc2cccnc2[nH]1	1835580051	GCCHONFJVBGIJL-SFHVURJKSA-N	433.940	1.348	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC(OC2CCN(C(=O)C3CC(O)C3)CC2)CC1	1836670782	SYBGCKGHHALHPL-WLYUNCDWSA-N	431.371	1.787	50	20	IDGD	
O=C(CS[C@H]1CCCCO1)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836717250	PQGVWCJRTTZOAY-HKUYNNGSSA-N	449.013	1.845	50	20	IDGD	
O=C([C@@H](O)CCl)N1CCC(OC2CCN(C(=O)C3(Br)CC3)CC2)CC1	1836717385	DGKJRFMNRPNKRK-AWEZNQCLSA-N	437.762	1.512	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)Cn3cncn3)CC2)CC1	1837965033	PXVBUWPBVVELAT-MRXNPFEDSA-N	442.358	1.450	50	20	IDGD	
CC(C)n1nccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1	1838024185	WMFPBPMMUUUYGJ-OALUTQOASA-N	447.363	1.770	50	20	IDGD	
CC(C)n1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)n1	1838788339	UKMAWACHEUAKQV-OALUTQOASA-N	447.363	1.770	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc([N+](=O)[O-])[nH]3)CCO2)C1	1838825349	QHKVGSRBXUEDAC-ACJLOTCBSA-N	428.873	1.400	50	20	IDGD	
CCOc1ccccc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](Cl)COC)C2)C1	1838886498	ZXDBQRNJOJPDJP-DYESRHJHSA-N	440.924	1.409	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)cc1F	1838915997	MYQRIIUBYUMVEW-MAUKXSAKSA-N	447.276	1.895	50	20	IDGD	
Cc1cccc(C(=O)N2CCO[C@]3(COCCN(C(=O)CCBr)C3)C2)c1	1838939060	ZDFYFYBEFQVCMJ-IBGZPJMESA-N	425.323	1.850	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cn(C(C)(C)C)nn3)C2)C1	1839146096	KBQHAIYTJTZFMC-KUHUBIRLSA-N	427.933	1.121	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3cccc(F)c3F)CCO2)C1	1839982751	ZEGNLEFBVUVGPC-FOIQADDNSA-N	430.879	1.981	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3ccnc(C)c3)C2)C1	1840149902	AQLXEFYUFKUUFG-WIYYLYMNSA-N	439.940	1.033	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccc(C)c(C)c3)C2)C1	1840150962	URGZLFHZQVDFMY-UGKGYDQZSA-N	438.952	1.556	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3sccc3Cl)C2)C1	1840153825	BGOPJWAJXBPXBS-SUMWQHHRSA-N	437.345	1.725	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccccc3C3CC3)C2)C1	1840156197	KGPJKICDKITZGT-DENIHFKCSA-N	436.936	1.888	50	20	IDGD	
COC1(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](C)CBr)C3)C2)CCC1	1840615181	ALCCWYUDYDEMEB-DNVCBOLYSA-N	447.370	1.433	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CCCSC1)CCO2	1840867878	SCLRRVNORFBLSZ-MPGHIAIKSA-N	449.411	1.760	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)Cc2ccc(C#N)cc2)C1	1841099309	CSYMTJLEDOHGTN-WGOQTCKBSA-N	432.484	1.438	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCCC12CN(C(=O)C1CCC(O)CC1)C2	1841925400	SFSOGYNIBNDMKG-GPANFISMSA-N	443.972	1.873	50	20	IDGD	
Cc1ccc(COCC(=O)N2CC3(CCCN3C(=O)c3ccc(B(O)O)cc3)C2)cc1C	1843011250	JHVBHBHLPLHDLF-UHFFFAOYSA-N	436.317	1.017	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC2(CCCN2C(=O)[C@@H](C)[C@H]2SC(=N)NC2=O)C1	1843402827	QIGBZELVJPCKEO-OUAUKWLOSA-N	431.356	1.023	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC2(CCCN2C(=O)[C@@H](C)[C@H]2SC(=N)NC2=O)C1	1843409389	WZWBVFPTMVRLAW-GARJFASQSA-N	431.356	1.166	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)[C@@H](C)Oc1ccccc1)C2	1843416723	SOVVFEOCKCGITO-GZPJKGAFSA-N	437.500	1.791	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC2(CCCN2C(=O)c2cnc3cc(C)ccn3c2=O)C1	1843788071	SSBNXTUMYLWGLY-OAHLLOKOSA-N	447.333	1.993	50	20	IDGD	
O=C([C@@H](O)CCl)N1CC2(CCCN2C(=O)c2cnc3ccc(Br)cn23)C1	1844146486	AQXDAMFMLSNIMI-ZDUSSCGKSA-N	441.713	1.514	50	20	IDGD	
CCn1nc(C(C)C)cc1C(=O)N1CC2(CCCN2C(=O)c2cnccc2C(=O)NN)C1	1844264640	SPLOKYPRFOUGTQ-UHFFFAOYSA-N	439.520	1.156	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)CCc1ccc(F)cc1)C2	1844265286	NZAYZAARFCWQQT-UHFFFAOYSA-N	425.464	1.274	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)Cc1cc(F)ccc1F)C2	1844265474	HMWRXPSHWQONSP-UHFFFAOYSA-N	429.427	1.023	50	20	IDGD	
CC[C@@H](NC(N)=O)C(=O)N1CC2(CCCN2C(=O)/C(C#N)=C/c2ccc(F)cc2F)C1	1845871160	VNQWYEZHPNNGOJ-LEHPZIBWSA-N	431.443	1.522	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(=O)C[C@H]1C(=O)N1CC2(CCCN2C(=O)C(Cl)Cl)C1	1846386730	SDKIQVKMBZYCJP-LBPRGKRZSA-N	434.320	1.572	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)CCc2cccc(O)c2)C1	1846463984	CETFSMCHFXSKHN-PCLIKHOPSA-N	437.500	1.662	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC[C@H]2[C@@H]1CCN2C(=O)C1CCN(c2ccccc2)CC1	1847525803	UGAZWHATPQKYIM-GOTSBHOMSA-N	447.344	1.098	50	20	IDGD	
C#CCCC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl	1847565406	PHRAPTOTELSANQ-QZWWFDLISA-N	441.956	1.485	50	20	IDGD	
Cn1c(=O)[nH]c(=O)c2cc(C(=O)NNC(=O)COc3ccccc3-c3ccccc3)cnc21	25597683	RTYZJYNHZUALJL-UHFFFAOYSA-N	445.435	1.129	50	20	IDGD	
CCOC(=O)N1CCC(C(=O)OCC(=O)NNC(=O)c2cc(Cl)ccc2OC)CC1	26146037	BJXSPVMKERYEAF-UHFFFAOYSA-N	441.868	1.521	50	20	IDGD	
O=C(NNS(=O)(=O)c1cccc(S(=O)(=O)NC2CC2)c1)c1c[nH]c2ccccc12	26219569	XUQXLEKFNXYAKT-UHFFFAOYSA-N	434.499	1.232	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)c2cccc(NC(=O)c3ccco3)c2)c2ccccc2c1=O	117473719	NTCPCTKIEUZPTA-UHFFFAOYSA-N	431.408	1.854	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)c1cc(S(=O)(=O)NC2CC2)c(Cl)cc1Cl	726540645	ITRGIDPYFBPROP-UHFFFAOYSA-N	431.301	1.847	50	20	IDGD	
CN(C)CC(=O)NNC(=O)CN(Cc1ccccc1)S(=O)(=O)c1ccc(Cl)cc1	727363733	ANIAPVUHOPFZJE-UHFFFAOYSA-N	438.937	1.240	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CCC(=O)Nc2nnc(C3CC3)o2)cc(OC)c1OC	727753341	YYEFQHKOVOMQLQ-UHFFFAOYSA-N	433.421	1.153	50	20	IDGD	
C[C@H]1C[C@H](C)CN(S(=O)(=O)c2ccc(S(=O)(=O)NNC(=O)C(C)(C)C)cc2)C1	728260819	SYSLHHLBSYYGFG-KBPBESRZSA-N	431.580	1.709	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)N2CCC(NS(=O)(=O)c3cccs3)CC2)cc1	728305366	CTMIRQSMANVCPZ-UHFFFAOYSA-N	433.515	1.417	50	20	IDGD	
CCCS(=O)(=O)Nc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)cc1	728312116	CCCWNSWORWMQBU-UHFFFAOYSA-N	432.502	1.855	50	20	IDGD	
Cc1ccc(-n2c(N(C)C)nc(C=NNC(=O)[C@@H](C)NS(C)(=O)=O)c2Cl)cc1	728435029	TYLLIJFLLXHEBD-GFCCVEGCSA-N	426.930	1.288	50	20	IDGD	
C=CCOc1c(Br)cc(C=NNC(=O)[C@H](C)NS(C)(=O)=O)cc1OCC	728435995	BWWYUJYVPHSADY-NSHDSACASA-N	448.339	1.800	50	20	IDGD	
Cn1c(=NNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)sc2ccccc21	728959490	MQJUYTYXWKVEOM-UHFFFAOYSA-N	426.506	1.093	50	20	IDGD	
CC1CCC(NS(=O)(=O)CC(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)CC1	728972537	WJWKXFUKCUKBHP-UHFFFAOYSA-N	439.506	1.624	50	20	IDGD	
COCCOc1cn(-c2ccccc2)nc1C(=O)NNC(=O)Cc1nc2ccccc2n1C	729300167	KBZUIQDOBGEAFK-UHFFFAOYSA-N	448.483	1.788	50	20	IDGD	
NC(=O)c1ncn2c(C(=O)NNC(=O)Cn3ccc4ccccc43)cc(-c3ccco3)nc12	729451511	YVLQEWMMCCAAFA-UHFFFAOYSA-N	443.423	1.504	50	20	IDGD	
CCOC(=O)C1=NN(c2ccccc2)[C@@H](C(=O)NNC(=O)COc2ccccc2F)C1	729508808	BBDCMGMNZCSYRF-QGZVFWFLSA-N	428.420	1.550	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)N[C@@H]1CCN(c2ccc(F)cc2F)C1	730136346	HELQEEZXMZNYJW-GFCCVEGCSA-N	428.399	1.837	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(NC(=S)NNC(=O)c2cc(Br)c[nH]2)c1	730594044	ZQMIPFJWKGJSCR-UHFFFAOYSA-N	446.352	1.659	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)NC[C@H](c1ccc(F)cc1)N1CCOCC1	730820158	GJEVFKZRLCQRDR-QGZVFWFLSA-N	432.452	1.314	50	20	IDGD	
O=C(CCc1nc(O)c2c3c(sc2n1)CCC3)NNC(=O)COc1ccccc1O	730835541	IDLUASOJHDKQGI-UHFFFAOYSA-N	428.470	1.750	50	20	IDGD	
Cn1cc(-c2cncc(C(=O)NNC(=O)c3ccc(CSc4nncn4C)cc3)c2)cn1	731185710	DIGZRKDKSGIJCB-UHFFFAOYSA-N	448.512	1.978	50	20	IDGD	
CC(=NNC(=O)c1ccnc(N(C)C)c1)c1ccc(S(=O)(=O)NCCCN(C)C)cc1	731560968	IEIWZVZLDACVRB-UHFFFAOYSA-N	446.577	1.532	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)C1	734163598	NOJXQYRDTSQPTA-AWEZNQCLSA-N	430.469	1.006	50	20	IDGD	
O=C(NNc1cccnn1)c1cc(S(=O)(=O)N2CCOCC2)c(Cl)cc1Cl	736711161	XPALBRCMBQTTNI-UHFFFAOYSA-N	432.289	1.561	50	20	IDGD	
C[C@H]1CC(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)C[C@H](C)C1	740490206	OHLAAXRMCMNTDG-HUUCEWRRSA-N	438.550	1.476	50	20	IDGD	
CCC(C)(C)C1CCC2(CC1)NC(=O)N(CC(=O)NNc1ncnc3[nH]cnc13)C2=O	740746632	XEQCCIYDJWMKPD-UHFFFAOYSA-N	428.497	1.713	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)[C@H]1CCN(c2ccccc2Br)C1=O	740852610	FHBVWVKQMPACOV-GFCCVEGCSA-N	439.310	1.254	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)CN2CCN(C(=O)OC(C)(C)C)CC2=O)c2ccccc2n1	741299617	IMKIOOCIULMJDV-UHFFFAOYSA-N	441.488	1.384	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)[C@H](C)NC(=O)c1cc2c(C)nn(C)c2s1	742032865	CVKRJKNHNYLVOA-LBPRGKRZSA-N	445.501	1.297	50	20	IDGD	
CS(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)c2cccc(Br)c2)cc1	743264549	YIWQSFGSXQAFOT-UHFFFAOYSA-N	433.305	1.476	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)NC1CCN(C(=O)c2ccccc2F)CC1	745452875	PVXUKHMADJFWQK-UHFFFAOYSA-N	445.407	1.688	50	20	IDGD	
O=C(COC(=O)[C@@H]1C[C@@]12CCCc1ccccc12)NNC(=O)[C@H]1COc2ccccc2O1	745713162	AVMKBRAMBLXLDP-WPSZSDGUSA-N	436.464	1.811	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)N[C@@H]3CC[C@@H]4CCC[C@H]4C3)nc2)CC1	745875405	GERGSQVTECVIJZ-YESZJQIVSA-N	436.582	1.613	50	20	IDGD	
O=C(Cc1cccc2ccccc12)NNC(=O)[C@H]1CCCCN1C(=O)c1ccc(O)nn1	746108613	BWDOSZAIAVPWHP-LJQANCHMSA-N	433.468	1.720	50	20	IDGD	
CCn1c(=O)nc(O)c2c(C(=O)NNC(=O)Cc3cn4ccccc4n3)cc(C(C)C)nc21	746641650	RBORNAITQYAGSQ-UHFFFAOYSA-N	449.471	1.292	50	20	IDGD	
CC(C)(CO)[C@H](CNC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)c1ccccc1	747456014	JXENOXFQVNLNRS-GOSISDBHSA-N	433.530	1.836	50	20	IDGD	
Cc1ccc(C(=O)NC2CCN(CC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)CC2)s1	747834319	GLIBQSZPHKUUCK-UHFFFAOYSA-N	445.501	1.620	50	20	IDGD	
O=C(CCC(=O)N1CCN(c2ncccn2)CC1)NNc1cccc(Br)c1	748022075	OROGXNVSLBJHNT-UHFFFAOYSA-N	433.310	1.811	50	20	IDGD	
Cc1nc(Cl)cc(NNC(=O)[C@H]2CCCN(S(=O)(=O)c3c(C)n[nH]c3C)C2)n1	748339218	QEVVVMKIHXZBGX-LBPRGKRZSA-N	427.918	1.322	50	20	IDGD	
COc1ccccc1C(=O)N[C@H](CCS(C)(=O)=O)C(=O)NNc1ccc(F)cc1C	748551252	FFFGONXVWYEGPS-QGZVFWFLSA-N	437.493	1.819	50	20	IDGD	
CC(C)N1C[C@@H](NC(=O)NNC(=O)[C@H](C)Oc2cccc(Br)c2)CC1=O	750644305	QCLXWSVPGLWCLT-AAEUAGOBSA-N	427.299	1.556	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2ccc(C)o2)c(F)cc1Br	753084424	DTRUCUYVHUIHPF-UHFFFAOYSA-N	435.227	1.900	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)N[C@@H]2C[C@H](C)N(C3CC3)C2)c2ccccc2c1=O	753944909	OPOSDGFCJDEVGP-LSDHHAIUSA-N	426.521	1.766	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N2CCOC[C@H](C)C2)cc1	754230858	WUCOMTUOPPENMI-CJMVGXJBSA-N	437.500	1.836	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)c1cccc(I)c1O	754830998	FFYKAPCGOAPELZ-UHFFFAOYSA-N	430.173	1.976	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)Nc2cc(C)nn2[C@@H]2CCS(=O)(=O)C2)cc1	755532815	MFBKCHYBWUWXDG-CQSZACIVSA-N	437.547	1.805	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)Nc1ccc(C(=O)NCc2ccc(F)cc2)cc1	756060526	COIJHHHFQGXGLQ-OAHLLOKOSA-N	448.476	1.343	50	20	IDGD	
CCOC(=O)[C@]1(NCC(=O)NNC(=O)c2ccc(OC)c(OC)c2)CCc2ccccc21	756599689	SWISUCUFADILAF-QHCPKHFHSA-N	441.484	1.459	50	20	IDGD	
COCC[S@@](=O)Cc1cccc(NC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1	756613946	RVGYVVYJQKBAMX-YVGXBJCXSA-N	433.486	1.574	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccnnc2)c1	756743663	BDAZNEAODDMZCK-UHFFFAOYSA-N	427.442	1.361	50	20	IDGD	
CCOC(=O)[C@@H](C)NC(=O)c1ccc(NC(=O)NNC(=O)Cn2nc(C)cc2C)cc1F	756818831	PYXIALFKWJEXOR-CYBMUJFWSA-N	448.455	1.173	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)CN2C(=O)NC3(C[C@@H](C)C[C@H](C)C3)C2=O)o1	756949485	HWUWICWUZDIVPS-GJZGRUSLSA-N	447.536	1.629	50	20	IDGD	
C[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)C(=O)N1CCN(S(=O)(=O)CBr)CC1	757592540	JZNNVNVQKQNNJE-VXGBXAGGSA-N	442.376	1.362	50	20	IDGD	
COc1ncnc(N(C)C)c1NC(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12	757709091	NAWHMWLFDNXPQF-UHFFFAOYSA-N	440.464	1.309	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)nn1C	757756471	RGTLHLKUWHSVEP-UHFFFAOYSA-N	431.456	1.953	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1cccnc1Nc1cccc(C(F)(F)F)c1	758034116	DPQYUUNJHMVUEE-JTQLQIEISA-N	445.423	1.543	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2ccnc(Br)c2)cc1	758152258	QLKCPXXHCHMSQJ-UHFFFAOYSA-N	441.307	1.234	50	20	IDGD	
Cc1cc(C)nc(SCc2ccc(C(=O)NNC(=O)c3ccc4nnnn4c3)cc2)n1	758164299	UTLPEKYQYYXBLA-UHFFFAOYSA-N	434.485	1.898	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)N[C@@H]2CCCS(=O)(=O)C2)cc(OCC)c1OCC	758664759	XKDLQWWVSAWUOC-CQSZACIVSA-N	443.522	1.404	50	20	IDGD	
COCc1nc(C)c(C(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)s1	759123064	ZJTXRNITAPSJQK-UHFFFAOYSA-N	427.527	1.941	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)NC[C@H]1CN(Cc2ccccc2)CCCO1	759213592	BADFUKIATCPJST-SFHVURJKSA-N	428.489	1.393	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)N[C@@H]1CCN(c2ccccc2OC)C1=O	761734087	CLOWTGIMFFIOIU-CQSZACIVSA-N	444.513	1.932	50	20	IDGD	
CC[C@H](C)NS(=O)(=O)c1ccc(C(=O)NNc2nccc(N3CCOCC3)n2)cc1	762847356	HASOWXWAFYDMAQ-AWEZNQCLSA-N	434.522	1.147	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2ccccc2)cccc1C(=O)N1CCSCC1	763431818	RTIVDSOAUAIMFQ-UHFFFAOYSA-N	426.498	1.584	50	20	IDGD	
CC(C)CC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1	763471547	VDGYZGGXTBPCOR-UHFFFAOYSA-N	427.417	1.979	50	20	IDGD	
O=C(NCc1csc(-c2ccco2)n1)NNC(=O)c1csc(N2CCOCC2)n1	763537393	INZUCGVKMQFGQP-UHFFFAOYSA-N	434.503	1.840	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(C#N)ccc2OC(C)C)cc1OC	763543169	MCFDUVGLRLNAFQ-UHFFFAOYSA-N	426.429	1.762	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)Nc1cccc(CN2CCCCC2)c1	763573507	SPWMIFLFOZZMPW-HXUWFJFHSA-N	438.484	1.598	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(N3C[C@@H](C)O[C@H](C)C3)cc2)c1	763618922	JFBDNMZZESFPIB-IAGOWNOFSA-N	440.500	1.774	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1ccc(F)cc1Br	763628560	ABVWXEBGLBIJMZ-UHFFFAOYSA-N	434.225	1.944	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(-c3nccs3)c2)cc1	763660398	BSDQVDIXNQWBFT-UHFFFAOYSA-N	426.454	1.984	50	20	IDGD	
CCOc1cc2c(cc1NC(=O)C(=O)NNC(=O)COc1ccccc1F)O[C@@H](C)C2	763681321	SNFBMTVCSWRGLH-LBPRGKRZSA-N	431.420	1.713	50	20	IDGD	
Cc1cc(Br)ncc1NC(=O)C(=O)NNC(=O)COc1ccccc1F	763683182	VQANBNJQNHLQEC-UHFFFAOYSA-N	425.214	1.457	50	20	IDGD	
CC(C)Oc1ccccc1NC(=O)C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	763717990	FINXIUGTCCZSNN-UHFFFAOYSA-N	448.501	1.124	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)cc1C(=O)N(C)C	763724206	YMENDWMTAWZRQJ-UHFFFAOYSA-N	426.517	1.999	50	20	IDGD	
CCN(CC)C(=O)c1ccccc1NC(=O)C(=O)NNC(=O)COc1ccc(C)cc1	763809759	OXVJKQABESCJIH-UHFFFAOYSA-N	426.473	1.642	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(C)c(C(=O)OC)c2)cc1	763860494	HVAYTCVBVCJURZ-CQSZACIVSA-N	443.456	1.734	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1cc(N2CCCC2=O)ccc1F	763865188	JHIBUXGBJYIZEE-GFCCVEGCSA-N	446.410	1.645	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccc(Cn2cncn2)cc1	763866233	VBINNQLMIKXHGA-ZDUSSCGKSA-N	426.408	1.019	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)cc(OC)c1OC	763873396	SGWFMQPGCTXACU-LLVKDONJSA-N	435.408	1.405	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1cccc(OC[C@@H]2CCCO2)c1	764004151	LIGDMRBSBOEQCL-KRWDZBQOSA-N	441.440	1.415	50	20	IDGD	
NC(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(F)cc2Br)cc1	764086973	ZIRKSSXRPWKWLY-UHFFFAOYSA-N	437.225	1.016	50	20	IDGD	
CN(Cc1cccc(NC(=O)C(=O)NNC(=O)CC(F)(F)F)c1)C(=O)C(F)(F)F	764116583	KZZSBQQCTNVORN-UHFFFAOYSA-N	428.289	1.246	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2cnc(Br)cc2C)cc1	764131253	JFNHXFFGBUUJLU-UHFFFAOYSA-N	435.278	1.880	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(OCc3cccnc3)cc2)c1O	764132542	YLJGJOPSHILCQD-UHFFFAOYSA-N	436.424	1.775	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccc(Cl)c(C(=O)NC2CC2)c1	764133773	ZDNKSGKJRJYPPY-UHFFFAOYSA-N	444.875	1.569	50	20	IDGD	
CCOC(=O)c1c(C2CC2)csc1NC(=O)C(=O)NNC(=O)[C@H]1Cc2ccccc2O1	764168128	NTVHHVBAUWZDTQ-OAHLLOKOSA-N	443.481	1.892	50	20	IDGD	
O=C(NNC(=O)c1cccc2ncccc12)C(=O)Nc1ccc(CN2CCOC2=O)cc1	764258887	CGVULXIESXPSDA-UHFFFAOYSA-N	433.424	1.587	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1Cl	764259306	FIPGTDWTVINEHZ-UHFFFAOYSA-N	446.895	1.531	50	20	IDGD	
O=C(NNC(=O)c1cccc(OC(F)F)c1)C(=O)Nc1cnn(Cc2ccccc2)c1	764259384	GAAJLCNLGKFTNW-UHFFFAOYSA-N	429.383	1.933	50	20	IDGD	
O=C(Cc1cc[nH]n1)NNC(=O)C(=O)Nc1ccc(C(=O)N2CCCCC2)c(Cl)c1	764292556	FECPSTQRSIHTBF-UHFFFAOYSA-N	432.868	1.018	50	20	IDGD	
CC(C)S(=O)(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)Cc2ccccc2F)c1	764312879	AZOVBWGFFZASIQ-UHFFFAOYSA-N	435.477	1.478	50	20	IDGD	
CC(C)S(=O)(=O)c1ccccc1NC(=O)C(=O)NNC(=O)c1ccc(O)c(Cl)c1	764345993	PPOVXEYNCIMVBG-UHFFFAOYSA-N	439.877	1.627	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c(OC)cc1Cl	764346161	UNVCWBOWFDKEHU-UHFFFAOYSA-N	443.847	1.943	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cnn(-c3ccccc3Br)c2)o1	764371270	JRCJMDCOOWEEAY-UHFFFAOYSA-N	432.234	1.936	50	20	IDGD	
CCS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)cc1	764379347	CHBKFCYWSZBVTM-UHFFFAOYSA-N	441.412	1.238	50	20	IDGD	
Cc1ccc(NC(=O)c2cccc(C(F)(F)F)c2)cc1NC(=O)C(=O)NNC(=O)CO	764428885	MGTLWUGYDPNHFN-UHFFFAOYSA-N	438.362	1.344	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)C(=O)Nc2ccnn2-c2cccc(Cl)c2)c1	764432240	DIXFIQOFQXQRBI-UHFFFAOYSA-N	441.835	1.279	50	20	IDGD	
Cc1ccc([C@H](C)[C@@H](O)C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1	764586439	VGONRCXBGQXCKN-OXJNMPFZSA-N	445.541	1.705	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)Nc2nc(CS(C)(=O)=O)no2)c1	765238949	CRQWQXWXUHIPTM-UHFFFAOYSA-N	425.467	1.278	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)c2ccc(CN3C(=O)CCC3=O)cc2)n[nH]1	765588940	VIWQSUCTFGJLQK-UHFFFAOYSA-N	447.451	1.809	50	20	IDGD	
CN(C)CCNC(=O)c1cccc(CNC(=O)NNc2ccccc2S(C)(=O)=O)c1	765741935	DGBIKHOQYLJXKP-UHFFFAOYSA-N	433.534	1.208	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)nnn1Cc1ccc(F)cc1	767430456	GXKBZAUHFZWRHN-UHFFFAOYSA-N	435.419	1.096	50	20	IDGD	
CC(C)(C)OC(=O)N1CCO[C@@H](C(=O)NNc2nc(Br)cn3ccnc23)C1	768225828	DALCIWNBHKEEFD-SNVBAGLBSA-N	441.286	1.571	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)CNC(=O)N2CCc3ccccc3C2)n[nH]1	768273490	FPFPTUPGVAQYQP-UHFFFAOYSA-N	448.483	1.614	50	20	IDGD	
Cn1ccnc1[C@](O)(CC(=O)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1)C(F)(F)F	768275806	DKCBOWOTKCJTLX-QGZVFWFLSA-N	440.357	1.551	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)NC2CCC(Oc3ccc(C#N)cn3)CC2)cc1	769026095	SIWWADQGVIONBC-UHFFFAOYSA-N	434.456	1.924	50	20	IDGD	
O=C(NNC(=O)c1cc(F)ccc1Br)NC1CCN([C@@H]2CCC[C@@H]2O)CC1	769154470	KLPGDZPWWZQCSU-CVEARBPZSA-N	443.317	1.910	50	20	IDGD	
CCc1nc(-c2ccc(C(=O)OCC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)cc2)n[nH]1	770154462	LNIKZBIBMIXIFT-UHFFFAOYSA-N	438.400	1.560	50	20	IDGD	
CNS(=O)(=O)c1ccc(C(=O)NNC(=O)COc2ccccc2-c2ccccc2)cn1	770208034	FIYZKRVFQPMSQL-UHFFFAOYSA-N	440.481	1.497	50	20	IDGD	
COc1ccc(C(=O)NN(C)C(N)=O)cc1S(=O)(=O)NCc1ccc(Cl)cc1	770533234	PMZWYPAOUPSKSD-UHFFFAOYSA-N	426.882	1.482	50	20	IDGD	
CN1C(=O)N[C@@]2(CCC[C@H]2CNC(=O)NNc2ccc(Br)c(F)c2)C1=O	771335287	SVDJZJQJLGKMIV-XXFAHNHDSA-N	428.262	1.935	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)CCc1nc(O)c2c3c(sc2n1)CCC3	771914657	PGGUYGXVGYKPNV-LLVKDONJSA-N	434.518	1.943	50	20	IDGD	
COc1cccc(C)c1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	772495422	AFVGIYIPFJXZRO-UHFFFAOYSA-N	448.501	1.491	50	20	IDGD	
O=C(NNC(=O)c1c[nH]c2ccc(I)cc2c1=O)c1ccncc1	772556398	VXUWIRUXNRVBBB-UHFFFAOYSA-N	434.193	1.603	50	20	IDGD	
Cc1[nH]c(C(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)c(C)c1C(=O)OC(C)C	772888229	HCPXAAGFXOKQRE-UHFFFAOYSA-N	434.880	1.928	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccccc1C[S@@](C)=O	774003572	XRHLJNFJNDGCLP-WUTCKBNWSA-N	437.905	1.772	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1cnn(Cc2ccncc2)c1	774008632	JYMATUZNHWVYJD-ZDUSSCGKSA-N	442.863	1.533	50	20	IDGD	
CN(C)C(=O)[C@H]1CC[C@@H](CNC(=O)NNC(=O)c2ccc(F)cc2Br)O1	775462224	WWJJAPOZRCEDJL-GXFFZTMASA-N	431.262	1.168	50	20	IDGD	
COc1cccc(C(=O)NNS(=O)(=O)c2ccc(Br)c(C(C)=O)c2)c1O	775672753	LQTIRTHMFLYZOR-UHFFFAOYSA-N	443.275	1.989	50	20	IDGD	
CC(C)Oc1ccc([C@H]2CCCC2=NNC(=O)CSc2nn(C)c(=O)n(C)c2=O)cc1	776763797	PMKSOPUWCMLZEF-MRXNPFEDSA-N	445.545	1.798	50	20	IDGD	
CCn1cc(-c2nn(C)cc2C(=O)NNC(=O)COc2ccc(Br)cc2)cn1	777410653	BGTFUDSJGIPIHF-UHFFFAOYSA-N	447.293	1.906	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNS(=O)(=O)c1ccc(OCC(F)(F)F)cc1	777940091	VXGKFUGNQLBUIW-UHFFFAOYSA-N	427.401	1.462	50	20	IDGD	
C[C@]1(C2CC2)NC(=O)N(CC(=O)NNc2ccc([N+](=O)[O-])cc2Br)C1=O	779140300	GOFWYMGIFVTIER-OAHLLOKOSA-N	426.227	1.521	50	20	IDGD	
CC1(C)C[C@@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)C(C)(C)O1	779385910	WZNXHTQTLMMRIR-MRXNPFEDSA-N	438.550	1.761	50	20	IDGD	
CC(C)(C)C(=O)NNC(=O)CN1CCN([C@@H](C#N)c2ccc(Br)cc2)CC1	779598307	YTCOEWBZSARAAH-INIZCTEOSA-N	436.354	1.825	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)c1cc(O)cc([N+](=O)[O-])c1	780647458	XTGMXFIWVZDYNF-UHFFFAOYSA-N	447.879	1.533	50	20	IDGD	
O=C(NNc1ncncc1Cl)c1ccc2c(c1)S(=O)(=O)N(C[C@H]1CCCO1)C2=O	781820701	YUFAUVKGBVCQMN-LLVKDONJSA-N	437.865	1.210	50	20	IDGD	
COc1ccc(NNC(=O)Nc2ccc(OC)c(S(=O)(=O)N3CCOCC3)c2)nc1	782006778	ORASLHPTPYLUJH-UHFFFAOYSA-N	437.478	1.268	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2cnn(C)c2C(F)(F)F)cc1	782100892	SAJXWEWJSNVSOH-UHFFFAOYSA-N	448.427	1.221	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccc(Cl)cc2F)nc1	783262962	GADSJONTWZQELG-UHFFFAOYSA-N	429.861	1.643	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2cc(S(=O)(=O)N(C)C(C)C)ccc2C)nc(C)n1	783325129	UAFUBQBHMRGCJO-UHFFFAOYSA-N	434.522	1.513	50	20	IDGD	
Cc1ccccc1NC(=O)NNC(=O)C(=O)Nc1cccc(OCC(=O)N2CCCC2)c1	783415025	WLJJWROAPAHHSB-UHFFFAOYSA-N	439.472	1.788	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)[C@@H]1CC=CC[C@H]1C(=O)N1CCOCC1	784290376	NKCSFKQPLJTPPA-IAGOWNOFSA-N	431.489	1.053	50	20	IDGD	
CCc1ccc(NC(=O)C(=O)NNc2ccc(Br)cn2)cc1S(N)(=O)=O	784340585	ZOLCPOCOEXWPTF-UHFFFAOYSA-N	442.295	1.136	50	20	IDGD	
O=C(NNc1ccc(Br)nc1)C(=O)Nc1ccccc1CN1C(=O)CCC1=O	784806260	DXFRHGBNRAQZLU-UHFFFAOYSA-N	446.261	1.575	50	20	IDGD	
CCNC(=O)N(C)NC(=O)C(=O)Nc1cc(Br)ccc1OCCOCC	784916691	SQJVZBXBPCSCRC-UHFFFAOYSA-N	431.287	1.495	50	20	IDGD	
CCOc1c(Br)cc(Cl)cc1NC(=O)C(=O)NNc1nccn(C)c1=O	785086859	SWDFPUJUKZFGES-UHFFFAOYSA-N	444.673	1.677	50	20	IDGD	
CCCc1c(NC(=O)C(=O)NNC(=O)Cc2ccncc2)cnn1-c1cccc(C#N)c1	785992081	VYIMHJXJPKCZBR-UHFFFAOYSA-N	431.456	1.420	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccc(F)cc2)cc1C(=O)N(C)C(C)C	787542892	FRVADSUYBVLXGK-UHFFFAOYSA-N	428.464	1.943	50	20	IDGD	
CC(C)(C)c1ccc(C(=O)N[C@H](CCS(C)(=O)=O)C(=O)NNC(=O)c2ccc[nH]2)cc1	787930245	ZTENTYRHUKLCGM-QGZVFWFLSA-N	448.545	1.307	50	20	IDGD	
CN1CCN(C(=O)NNC(=O)c2ccc(S(=O)(=O)N(C)c3ccccc3)cc2)CC1	788166112	NRNXHFQZWDDKSV-UHFFFAOYSA-N	431.518	1.114	50	20	IDGD	
COc1cccc(C(=O)NNS(=O)(=O)c2ccc(C#N)c(Br)c2)c1O	788479765	IADNCMOWSNAYEX-UHFFFAOYSA-N	426.248	1.658	50	20	IDGD	
CC(=O)OC(C)(C)C(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	788624854	MMXQFVQQEBSYKD-UHFFFAOYSA-N	425.488	1.652	50	20	IDGD	
Cc1cc(C)nc(-n2nccc2NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)n1	789309762	LHMFULVVEFNWFA-UHFFFAOYSA-N	429.462	1.149	50	20	IDGD	
CC[C@H]1CCc2nc(NC(=O)C(=O)NNC(=O)COc3ccc(C#N)cc3)sc2C1	789733202	YXIHNSPYVPJWTF-LBPRGKRZSA-N	427.486	1.695	50	20	IDGD	
Cc1noc(-c2ccc(C(F)(F)F)cc2NC(=O)C(=O)NNC(=O)Cc2cc[nH]n2)n1	789735564	ZSULWNVAXXNUKS-UHFFFAOYSA-N	437.338	1.116	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc4c(c3)CC(=O)N4C)n[nH]2)c1	789774006	JSXBHQRDAPNNGM-UHFFFAOYSA-N	446.467	1.612	50	20	IDGD	
N#CCOc1cc(F)ccc1NC(=O)C(=O)NNC(=O)[C@H]1OCC[C@H]1c1ccccc1	789810978	BEDYEVSKYWOPPV-YJBOKZPZSA-N	426.404	1.387	50	20	IDGD	
CCc1nn(C)c(CC)c1CC(=O)OCC(=O)NNC(=O)c1cc(Cl)ccc1OC	791489816	QNKMTARFPMPYQZ-UHFFFAOYSA-N	436.896	1.754	50	20	IDGD	
C[C@@](O)(Cn1cc(C(F)(F)F)ccc1=O)C(=O)NNC(=O)CCCc1ccccc1	792128515	OEUXFNWFKGWKCH-LJQANCHMSA-N	425.407	1.788	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N1CCO[C@]2(CCO[C@H]2C)C1	792779242	DSOJNJLLAHSKKE-ZJNRKIDTSA-N	442.310	1.837	50	20	IDGD	
Nc1nc(Cl)cc(NNC(=O)c2cccc(NN3C(=O)[C@H]4CC=CC[C@@H]4C3=O)c2)n1	793799093	BQFPOPINIXZFBM-STQMWFEESA-N	427.852	1.747	50	20	IDGD	
Cc1nc2cc(O)nn2c(C)c1CCC(=O)NNC(=O)CNC(=O)OCc1ccccc1	794062782	AGEIHPBSUQBGAY-UHFFFAOYSA-N	440.460	1.058	50	20	IDGD	
CC(Cn1cc(C(F)(F)F)ccc1=O)=NNC(=O)c1csc(N2CCOCC2)n1	794482060	NHROGBVEAPTYFJ-UHFFFAOYSA-N	429.424	1.966	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NN=C1CCOC[C@H]1C)N(S(C)(=O)=O)CC2	794485835	LTHAHVUCJNXMFR-CXAGYDPISA-N	439.534	1.481	50	20	IDGD	
O=C(COC(=O)[C@H]1CCCCN1Cc1ccccn1)NNC(=O)c1ccc([N+](=O)[O-])cc1	795606115	KANDAUACRKAKEI-GOSISDBHSA-N	441.444	1.349	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)c1cc(S(=O)(=O)C2CCCC2)ccc1F	797443110	PCFMWXXEILTCMX-UHFFFAOYSA-N	437.449	1.326	50	20	IDGD	
CCn1ncc(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)c1C(F)(F)F	799260750	XKLGXXCACXRAIA-UHFFFAOYSA-N	437.382	1.137	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)NCc2cccc(CS(N)(=O)=O)c2)c1C	800718031	ZIOUPHMYMBAAPS-OAHLLOKOSA-N	434.518	1.390	50	20	IDGD	
CC(=O)N1CCN(S(=O)(=O)c2cc(C(=O)NNc3ccc(F)cc3)ccc2F)CC1	801114711	HFNOQFVWZXPPSW-UHFFFAOYSA-N	438.456	1.575	50	20	IDGD	
C[C@H](CC(=O)NNc1ccc2c(=O)[nH]ccc2c1)NS(=O)(=O)c1cccnc1Cl	803436002	RJFSQSMEBMATDC-LLVKDONJSA-N	435.893	1.777	50	20	IDGD	
Cc1ccc2[nH]cc(C(=O)N3CCN(S(=O)(=O)CBr)CC3)c(=O)c2c1	804539283	ZVMAFXXMFLIUPT-UHFFFAOYSA-N	428.308	1.277	50	20	IDGD	
COCCNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2cc(C)nc3ccccc23)c1	806973931	YFTZRKQFSDYWKP-UHFFFAOYSA-N	449.467	1.319	50	20	IDGD	
CNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2ccccc2C)c1Br	806975739	MVSGHCZIPSJONY-UHFFFAOYSA-N	433.262	1.517	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)C1CCN(C(=O)N(C)Cc2ccccc2)CC1	807370978	ATXWLFAMUAQWEX-UHFFFAOYSA-N	434.537	1.887	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)Cc1sc(N2CCOCC2)nc1-c1ccccc1	811239480	NLMZOPLXPYEAOK-AWEZNQCLSA-N	446.529	1.678	50	20	IDGD	
COC(=O)c1cn(-c2cccc(NC(=O)NNC(=O)COc3cc(C)cc(C)c3)c2)nn1	812981366	WXEDQQUWWLMVCJ-UHFFFAOYSA-N	438.444	1.902	50	20	IDGD	
CC(=NNC(=O)Nc1ccc(S(N)(=O)=O)cc1)c1ccc(O)c(CN2CCOCC2)c1	814963847	IVTWRDJDCGETIG-UHFFFAOYSA-N	447.517	1.418	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)c2c(C)nc3ccccn23)cc1)[C@@H]1C[C@H]1C	815564377	HJJNHRKRIIZKFK-FZKQIMNGSA-N	448.483	1.804	50	20	IDGD	
CCOC(=O)c1cc(Br)ccc1NC(=O)C(=O)NNc1ncncc1F	815765152	HJZDBMBFRGGVPN-UHFFFAOYSA-N	426.202	1.637	50	20	IDGD	
CN(C)C(=O)COc1ccccc1C(=O)NNC(=O)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	816509730	ABUBDHFEKACLIN-OAHLLOKOSA-N	448.520	1.562	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)CCc3ccon3)c2)cc1	816827823	GQEPHFANGXRLAQ-UHFFFAOYSA-N	444.469	1.878	50	20	IDGD	
NC(=O)N[C@@H](CC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)c1ccccc1	821892974	ZICXAYQAMJFQHE-FQEVSTJZSA-N	438.532	1.146	50	20	IDGD	
Cc1nc(CSc2ccccc2C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)cs1	841751463	ZBWGCDZNTAEJNV-GFCCVEGCSA-N	425.557	1.940	50	20	IDGD	
CC(C)C[C@H](C(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)N1C(=O)[C@H]2CC=CC[C@H]2C1=O	866751095	UEMREQWLDXESBV-IXDOHACOSA-N	428.445	1.722	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)[C@@H]1CCCCN1S(C)(=O)=O	896317294	RUGJVVYYODYEEN-FZMZJTMJSA-N	448.339	1.178	50	20	IDGD	
CSCC[C@@H](C(=O)NNC(=O)Cn1nc(C)cc1C)N1C(=O)c2ccccc2C1=O	913025847	HUYOHKVOMFDOMY-INIZCTEOSA-N	429.502	1.065	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)CNS(=O)(=O)c2cccc(C(C)=O)c2)cc1OC	913068089	PTGAAQNCIARFMY-UHFFFAOYSA-N	449.485	1.036	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)c1cccc(S(=O)(=O)NC2CCCC2)c1	913465156	JFSUCBJGKRUIHG-LJQANCHMSA-N	445.497	1.509	50	20	IDGD	
CCN1C[C@H](C(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)CC1=O	914711886	LFHHDJFSUNTBHP-MRXNPFEDSA-N	433.468	1.074	50	20	IDGD	
O=C(Cn1cc(Br)ccc1=O)NNC(=O)c1ccc(Br)s1	914865108	RUXIPBVHSGYSHH-UHFFFAOYSA-N	435.097	1.896	50	20	IDGD	
COc1cc(-n2cnnn2)c(Cl)cc1C(=O)NNC(=O)Cn1cnc2ccccc21	916111362	FJCIUAZDEFYDOG-UHFFFAOYSA-N	426.824	1.135	50	20	IDGD	
CCn1c(NNC(=O)c2cc(S(=O)(=O)N3CCCC3)c(C)o2)nc2ccccc2c1=O	916157011	CYGDZHQGZWQMDC-UHFFFAOYSA-N	445.501	1.859	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)NCCCN1C(=O)NC2(CCCCC2)C1=O	916266549	CSRBGCFEXRKENO-AWEZNQCLSA-N	449.483	1.568	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NN=C(C)c1ccc[nH]1)N(S(C)(=O)=O)CC2	916355778	MHXKTVFMCCJEAE-KRWDZBQOSA-N	434.518	1.821	50	20	IDGD	
CN1CCN(C(=O)c2ccc(CNC(=O)NN=c3sc4ccccc4n3C)cc2)CC1	916390385	NFVRHOOBZKMRMS-UHFFFAOYSA-N	438.557	1.943	50	20	IDGD	
O=C(NCCNC(=O)c1cccnc1)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1	916443840	VEIPFHPBZODSOL-UHFFFAOYSA-N	431.396	1.431	50	20	IDGD	
CC(C)Oc1ccc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cn1	916512150	VCOWYMLNIKXGFF-UHFFFAOYSA-N	435.506	1.263	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)C[C@H]1Oc2ccccc2NC1=O	916787424	BUPNUJQJBPVCHF-HXUWFJFHSA-N	437.500	1.136	50	20	IDGD	
C[C@H](c1nc(-c2ccccc2)no1)N1CCN(CC(=O)NNC(=O)c2ccccc2)CC1	917110180	XMSNUZTXGGVVLW-QGZVFWFLSA-N	434.500	1.876	50	20	IDGD	
Cc1ccc(S(C)(=O)=O)cc1S(=O)(=O)NNC(=O)c1cc(Br)c[nH]1	917730761	CTASWPJPXIWXRD-UHFFFAOYSA-N	436.309	1.112	50	20	IDGD	
NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NNC(=O)COc3ccc(F)cc3)cc2)C1	918117596	HCKYIYBWJFNBFA-INIZCTEOSA-N	443.479	1.437	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)NCc1cccc(OCC(=O)N(C)C)c1	918223431	HEDFXSONPVPFGR-CQSZACIVSA-N	432.452	1.591	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)NCCN2C(=O)CSC2=O)N(C)c2ccccc21	919848267	FWLQMUROVDORPT-UHFFFAOYSA-N	427.486	1.469	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)C3(c4cccc(C#N)c4)CC3)cc2)CC1	1319313070	JPBXMXMJHBJBPW-UHFFFAOYSA-N	439.541	1.669	50	20	IDGD	
CC[C@@H](N=c1nn[nH]n1-c1ccccc1)C(=O)NNC(=O)c1cc(C)nc2ccccc12	1322585786	OJNSLVVZKVBGGF-GOSISDBHSA-N	430.472	1.593	50	20	IDGD	
Cc1n[nH]c(C)c1C[C@H](C)C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	1322858096	XQHSNSNISNSLDB-AWEZNQCLSA-N	434.566	1.285	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(O)nc(O)n2)C1	1778014876	FWACSJIRLIDNKF-BBEJJTJUSA-N	426.901	1.423	50	20	IDGD	
CCOC(=O)N1CCC(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](F)Cl)C2)CC1	1778027186	CMLFYGWMQGRPOA-GQIGUUNPSA-N	447.935	1.903	50	20	IDGD	
Cc1cc(NC(=O)CC(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](F)Cl)C3)no1	1778074095	PZEZBDIDFVKVNC-XHBKTUGNSA-N	430.864	1.360	50	20	IDGD	
O=C1Nc2ccccc2/C1=C/C(=O)N1CC[C@]2(C1)CN(C(=O)CCBr)CCO2	1778901119	KXSZSBFNWKFKIO-HFZJLKNISA-N	448.317	1.637	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H]3[C@H]4Sc5ccccc5[C@@H]43)C2)C1	1779049029	MPZHKZBUNIWQFN-DFBFWZJZSA-N	436.961	1.958	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(OC)c(O)cc3[N+](=O)[O-])C2)C1	1780198970	WPUPKQGTGXUVGJ-DJJJIMSYSA-N	441.868	1.770	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H]1C(=O)N1CC[C@@]2(CN(C(=O)C(Cl)Cl)CCO2)C1	1781015892	VPMBYIQJGCBIEX-XIKOKIGWSA-N	436.336	1.629	50	20	IDGD	
O=C(c1nccc2occc12)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781331373	PWFSNUAUJAZKQA-RHSMWYFYSA-N	426.242	1.962	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3nc4ccc(F)cn4n3)C2)C1	1782570228	FIKIZFAGXRBCDR-GTNSWQLSSA-N	440.273	1.095	50	20	IDGD	
CCOC(=O)C1(C(=O)N2CC[C@@]3(CN(C(=O)[C@@H](Br)CC)CCO3)C2)CC1	1782923717	YNXNEPQYAJXDKX-SUMWQHHRSA-N	431.327	1.333	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(C)nc3O)CCO2)C1	1783353706	ZIDMNSDMEFATKI-KBXCAEBGSA-N	426.311	1.713	50	20	IDGD	
COc1ccc(CCC(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](C)Br)C3)C2)cn1	1783529280	HJFJUQHTUZJDDE-AUUYWEPGSA-N	440.338	1.636	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(CCN(C(=O)Cn3cnc4ccccc43)C2)C1	1783747166	HJHRYIHMOQMEPY-LJQANCHMSA-N	435.322	1.651	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)Cc3ccc(Cl)cc3OC)CCO2)C1	1783880174	CRTFHIBJCOPDTM-OXQOHEQNSA-N	445.343	1.975	50	20	IDGD	
Cc1ccc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]3C2)cn1	1783969945	RSOSKTPJUXYRHS-QCSYZSNVSA-N	438.366	1.943	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3CCCCN3C)[C@H]2C1	1784114524	WARLIKFYJBUDFE-VIQHNZTISA-N	430.387	1.624	50	20	IDGD	
O=C(COc1ccccc1)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21	1786482201	HALJOQHQEZPDPR-XIRDDKMYSA-N	425.323	1.830	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]2C1)N(C)C(=O)OC(C)(C)C	1787448640	DHJSVUTUHLKCEJ-CAEXGNQWSA-N	435.924	1.756	50	20	IDGD	
COc1cnc(C(=O)NC2(c3ccc(NC(=O)c4ccc(B(O)O)cc4)cc3)CCC2)cn1	1788140668	ICONILXIMMIJDY-UHFFFAOYSA-N	446.272	1.227	50	20	IDGD	
O=C(C#CC1(O)CCCCC1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21	1788637452	LBMDTCJOIMREGO-QBYUYEEZSA-N	445.329	1.355	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(-n4cnnc4)cc3)C[C@@H]21	1789861308	OYPAZVIWQKILDR-KANFNMMFSA-N	431.924	1.878	50	20	IDGD	
Cc1nc(N)sc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]2C1	1789922860	SKVBGQKBSAXTHY-GMOBBJLQSA-N	435.319	1.318	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(-c4ccccc4)[nH]n3)C[C@@H]21	1791253771	JHQJFWGUUKZSKV-BOSXTWCSSA-N	446.935	1.924	50	20	IDGD	
CCOC(=O)C(C)(C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)Br)C[C@@H]21	1792228170	BLRWNAFXGZCHLO-XUXIUFHCSA-N	433.343	1.339	50	20	IDGD	
C=C(CC(=O)OCC)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)CBr	1792873616	FMXLPQYNOJWCCA-AYDFFVQHSA-N	431.327	1.116	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CC[C@H]3CCC(=O)N3C1)C2	1793452342	ZOLNTRBMTFARTE-VGTAHMJBSA-N	425.957	1.385	50	20	IDGD	
COCCOCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1795781060	DBSOKMXPEMAPIL-FZKCQIBNSA-N	447.960	1.420	50	20	IDGD	
C=CCCc1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)c(O)n1	1796188199	AERLSAYQOUBWGW-ACDBMABISA-N	449.316	1.151	50	20	IDGD	
COc1ccc(-c2cc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@H](F)Cl)C4)n[nH]2)cc1	1796495684	PUSSAQJIXISOKJ-GGNLRSJOSA-N	436.871	1.823	50	20	IDGD	
C[C@@H]1CCc2c(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)CCBr)C4)n[nH]c21	1796972416	ZDKNTBZFRGLWOM-LSSIXWDNSA-N	425.327	1.448	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1Cc2ccccc2O1	1797224589	ANAZOEHPAMBLGX-IVFVNLKQSA-N	437.334	1.611	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ncccc1C(F)(F)F	1798228667	CDJYRSXUXUIFCV-XCCSTKFXSA-N	435.830	1.557	50	20	IDGD	
Cc1cccc2c(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3cnccc3C(=O)NN)n[nH]c12	1798443141	VZKGDXHQECSTDP-QDMKHBRRSA-N	447.499	1.435	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](COC)NC(=O)OC(C)(C)C)C2	1799269575	IFEHRAUQJCYXKP-YIDVYQOGSA-N	447.960	1.133	50	20	IDGD	
Cc1cccn2ncc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@@H](C)CBr)C4)c12	1800103839	LZHVRCVTPAHQDO-MPTYRVRUSA-N	449.349	1.877	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c(F)c(C)nn1C)C2	1800638873	BTIFKUCMQZPFMY-GFQSEFKGSA-N	431.306	1.244	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1ccc(F)c(F)c1)C2	1800973589	IWJLLZUSCLBLDP-YGTYGHESSA-N	430.879	1.741	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2nc3ccccn3n2)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803139108	KJYCAOSPYFQRPU-YQQAZPJKSA-N	428.880	1.044	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cc3cccnn3n2)[C@H]1c1cccnc1)[C@H](O)CCl	1803142186	XVMFPKCBLGLYTP-QGTPRVQTSA-N	428.880	1.044	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)CN2C(=O)CNC2=O)[C@@H]1c1cccnc1	1803686498	OEMQNEBZCGQPLI-RLFYNMQTSA-N	435.912	1.047	50	20	IDGD	
O=C(/C=C/c1ccco1)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1804616862	ZUOMIGKZDCDLRN-OITNKYAQSA-N	445.284	1.387	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC2(CCN(C(=O)Cn3ccncc3=O)CC2)C1	1805388807	HBJKGELVDWZRHE-HNNXBMFYSA-N	439.354	1.506	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)CCSC(=N)N)[C@H]1c1cccnc1	1807127026	MQJVSSIHRXYVBJ-OFQRWUPVSA-N	427.958	1.358	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H]2CC=CCC2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807359056	DJPRWNIGCOMOBW-CBQOVEMMSA-N	433.317	1.437	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)CCC(F)(F)F)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807362739	ITLFKUGFHGUWRI-APWZRJJASA-N	449.238	1.424	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CC2CCCC2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807366217	XSEHLZUMQWNTCP-NZQKXSOJSA-N	435.333	1.661	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1CCN(C(=O)CN2CCOC2=O)[C@H]1c1cccnc1	1808290949	ZRUWTXANKDBFFQ-QOKNQOGYSA-N	443.331	1.776	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)[C@H]2CC2(F)F)[C@@H]1c1cccnc1	1809524178	ZFNRABYSISVXRT-XYPHTWIQSA-N	444.442	1.055	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)Cc2ccccn2)[C@H]1c1cccnc1	1813070028	CTTINRCEPBLWDU-JPYJTQIMSA-N	438.532	1.098	50	20	IDGD	
Cc1ocnc1C(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1813074742	WMXAARBFKQTADM-OXJNMPFZSA-N	428.493	1.071	50	20	IDGD	
O=C(CN1C(=O)CSC1=S)NC[C@@H]1CCN(C(=O)[C@H](F)Cl)[C@@H]1c1cccnc1	1814189144	MMSHBTNOEKMCHT-GLQYFDAESA-N	444.941	1.482	50	20	IDGD	
CCS(=O)(=O)CC(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](C)CBr)n[nH]1	1814778376	GOSHXJSBPAQXFU-AAEUAGOBSA-N	449.371	1.868	50	20	IDGD	
Cc1nnc(CC(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@H](C)Br)CC3)o1	1815494885	GTBGSPHCALCVTG-CBAPKCEASA-N	428.312	1.773	50	20	IDGD	
O=C(Cn1nnc2ccccc21)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1	1815546829	WJNQNOOAWBMLQF-ZBFHGGJFSA-N	431.884	1.446	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)/C=C/c2cccnc2)n[nH]1	1815963152	WPSQYLUXMYWFHQ-BLGFXRMMSA-N	439.520	1.883	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2nccs2)[nH]n1)c1ccc(B(O)O)cc1	1817470755	GMSJCHVFPYGHCE-OAHLLOKOSA-N	425.279	1.166	50	20	IDGD	
Cc1ccnc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)CCC(=O)NN(C)C)CC3)c1	1817478233	ZXWDDMYVRFPGNR-ZDUSSCGKSA-N	430.534	1.445	50	20	IDGD	
CNC(=S)NCCC(=O)N1CCCC[C@H]1c1cc(NC(=O)CO[Si](C)(C)C)n[nH]1	1819595668	VSHDFGSDAABNNX-AWEZNQCLSA-N	440.646	1.737	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccsc1)CC2	1819795179	JAYJPBXYYWFKAX-LLVKDONJSA-N	442.526	1.743	50	20	IDGD	
C[C@@H](Cn1cncn1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCBr)CC2	1820066300	MIYGHUFLEHYNOI-QWRGUYRKSA-N	441.355	1.768	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](C)CBr)CC2	1820134009	CQFJSVYMUOUXAU-HBNTYKKESA-N	443.367	1.777	50	20	IDGD	
Cn1ccc2c(O)ncc(C(=O)Nc3nc4c(s3)C[C@H](NC(=O)[C@@H](O)CCl)CC4)c21	1821175562	IQVZTQPSOOCCFK-RNCFNFMXSA-N	449.920	1.561	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2[nH]cc3c2CCC3)[nH]n1	1822415030	RTJPJUMXSPINNS-KRWDZBQOSA-N	441.536	1.905	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)C(Cl)Cl	1822418068	KPSDJMACJHZIEN-CYBMUJFWSA-N	425.081	1.199	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)CCl)CC2)c1ccnc2ncccc12	1824087113	WHBBMXXVNBNHJF-YGRLFVJLSA-N	431.905	1.912	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC[C@H]1C1CCN(C(=O)Cn2cncn2)CC1	1824094469	WTRCVKFAVHJXFN-ZBFHGGJFSA-N	426.359	1.929	50	20	IDGD	
CC(C)(CCl)C(=O)N[C@H]1CCc2nc(NC(=O)COc3ccc(O)nn3)sc2C1	1824554145	SVOJXTMWQJLXMI-JTQLQIEISA-N	439.925	1.895	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](N)c1ccccn1)CC2	1825640615	BSUFLFOUVPMGCN-PKFCDNJMSA-N	438.351	1.934	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1c(C)nc3ncccn13)CC2	1826000627	YRSGEHHVOFTSLE-VXGBXAGGSA-N	448.936	1.974	50	20	IDGD	
CCOC(=O)N[C@H](O)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CCBr)CC1	1826358322	DRLPZBYQJOEWRL-GOEBONIOSA-N	448.358	1.456	50	20	IDGD	
COCCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)CC1	1826611063	LFFBNFZJADLPNT-GXDFBKAQSA-N	431.537	1.777	50	20	IDGD	
O=C(/C=C/c1cnc[nH]1)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827055209	SFOSNSVUDLNHDW-MHNQQFQPSA-N	436.321	1.036	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(C(N)=O)cc3)sc2C1	1827506889	YDTMGGVZOIYZLR-STQMWFEESA-N	436.921	1.722	50	20	IDGD	
O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)C1CC(F)(F)C1)CCO2	1829984773	MPZWKRXBOBSDSZ-HNNXBMFYSA-N	425.270	1.273	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830366293	OJOWLLXUMLYUPC-FQEVSTJZSA-N	447.960	1.233	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)c(Cl)c1	1830736923	BWUYIWWJXQAVON-QFBILLFUSA-N	431.316	1.318	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3n[nH]c(C4CC4)c3F)C2)C1	1831643418	BNQHNGMJYHLKNI-JLTOFOAXSA-N	442.919	1.904	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3nnc(C)s3)C2)C1	1831645586	DTURCQVPGBUYBC-RDTXWAMCSA-N	430.958	1.253	50	20	IDGD	
C[C@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)c3cccnn3)CC2)CC1	1833263293	OTWCEKJLWZRPJQ-CQSZACIVSA-N	438.370	1.693	50	20	IDGD	
Cn1cnc(C(=O)NC2CCN(C3CCN(C(=O)[C@](C)(Cl)CCl)CC3)CC2)n1	1834088647	GEINWXTVXYXEAK-GOSISDBHSA-N	431.368	1.237	50	20	IDGD	
CC(=O)N1CCO[C@@]2(COCCN(C(=O)/C(C#N)=C/c3ccc(Br)cc3)C2)C1	1835205645	JDSJDAOMLOSARB-YZILGEIOSA-N	448.317	1.832	50	20	IDGD	
Cc1nc(C(=O)N2CCOC[C@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)ccc1F	1837712480	UKMVMIDMCCMFHL-FQEVSTJZSA-N	439.560	1.451	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(F)cc3F)CCO2)C1	1839006861	WIXGPQSZCJZBMZ-KXBFYZLASA-N	432.851	1.289	50	20	IDGD	
CCc1nn(C)c(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](Cl)CC)CCO3)c1Cl	1839143166	NLKODSHHUBOTHH-BFUOFWGJSA-N	447.363	1.723	50	20	IDGD	
C[C@H](C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2)C1(O)CCC1	1839149923	WGSSVPBPMPGLEG-ZTFGCOKTSA-N	437.364	1.230	50	20	IDGD	
Cc1ccsc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839198043	RCHFCRAIQFNIEA-XJKSGUPXSA-N	435.315	1.817	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)c(C)n1	1839200873	RERLJOAVZBVUPN-YJBOKZPZSA-N	444.301	1.459	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1840030436	MKEZLKYPZGYSRA-WBMJQRKESA-N	425.751	1.491	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(Cl)c(F)c3)C2)C1	1840155068	OUVLXCYKIIDPPE-DNVCBOLYSA-N	449.306	1.803	50	20	IDGD	
Cn1ncc(C(=O)N2CCCC23CN(C(=O)[C@H](F)Br)C3)c1C(F)(F)F	1842162189	ZZKBJRCGGONBJU-JTQLQIEISA-N	427.196	1.946	50	20	IDGD	
O=C1CC[C@@H](C(=O)N2CC3(CCCN3C(=O)[C@H](Br)Cc3ccccc3)C2)CN1	1845939923	IAFQTZYAWCNYMH-IAGOWNOFSA-N	448.361	1.722	50	20	IDGD	
CC(C)[C@@H](CC(=O)N1CCCC12CN(C(=O)[C@@H](O)CCl)C2)NC(=O)OC(C)(C)C	1846293200	AHFJRVBWYXJMSG-CABCVRRESA-N	431.961	1.729	50	20	IDGD	
O=C(CCN1C(=O)Cc2ccccc2C1=O)N1CC2(CCCN2C(=O)C(Cl)Cl)C1	1846386763	VOYPQBJVEAPRHE-UHFFFAOYSA-N	438.311	1.609	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2cccc(C(=O)NNC(=O)c3ccccc3F)c2)C[C@@H](C)O1	15794807	RBPQHAINENRDNB-OKILXGFUSA-N	435.477	1.698	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)C(=O)N(C[C@H]1CCCO1)C2=O)c1ccc2c(c1)OCO2	26963454	SINXBGSVKVHALH-CQSZACIVSA-N	437.408	1.265	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)c2nc3nccc(C)n3n2)c2ccccc2c1=O	105294113	IVAUYCKDOFYJGL-UHFFFAOYSA-N	434.460	1.408	50	20	IDGD	
O=C(CN1C(=O)Cn2c(cc3ccccc32)C1=O)NNC(=O)c1cc(-c2ccccc2)[nH]n1	725879731	MFQIPIJUWBHHTI-UHFFFAOYSA-N	442.435	1.475	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)[C@H]2CC(=O)N(Cc3ccc(OC)cc3)C2)cc1	726502573	IDFOWVSNTVJDBH-SFHVURJKSA-N	425.485	1.833	50	20	IDGD	
COc1ccc(N2CCC(NC(=O)NNC(=O)CNC(=O)c3cccs3)CC2)cc1	726616767	UNYMFOJTWNSAKT-UHFFFAOYSA-N	431.518	1.486	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1ccc(N2CCC(C)CC2)nc1	727098540	CKGZCLOZBMTIAI-UHFFFAOYSA-N	444.561	1.994	50	20	IDGD	
C[C@@H](Nc1nc2ccccc2s1)C(=O)NNC(=O)CCc1nc(-c2ncccn2)no1	727723031	CSSPDFLMHGEOGM-LLVKDONJSA-N	438.473	1.717	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NCCC(=O)NC(C)(C)C)c2ccccc2c1=O	728133689	CALKTQFNHCAEFS-UHFFFAOYSA-N	430.509	1.445	50	20	IDGD	
O=C(NNC(=O)[C@H]1CC(=O)N(CC(F)(F)F)C1)c1cc(F)ccc1Br	728549448	LXYNEKXVIFVNIH-ZETCQYMHSA-N	426.164	1.760	50	20	IDGD	
CC(C)(C)CC(=O)NNC(=O)CCCCCNS(=O)(=O)c1ccc2c(c1)OCCO2	728607607	DKRHCBCMGNBEAQ-UHFFFAOYSA-N	441.550	1.880	50	20	IDGD	
Cc1nc(-c2ccccc2)[nH]c1C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	728727399	LTKHGXIMCHPQLW-KRWDZBQOSA-N	436.424	1.529	50	20	IDGD	
COc1ccc(C)cc1CN1CCN(C(=O)NNC(=O)CNC(=O)c2cccs2)CC1	728952124	TWWLUEXATITDOS-UHFFFAOYSA-N	445.545	1.354	50	20	IDGD	
O=C(CNC(=O)c1ccc(O)cc1)NNC(=O)c1ccc(Br)cc1Cl	728977350	GZOYSSVWVKYPJB-UHFFFAOYSA-N	426.654	1.999	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)c1sc(-c2ccco2)nc1-c1ccccc1	729275130	LPPUDGNXEYQDEH-LLVKDONJSA-N	434.499	1.769	50	20	IDGD	
Cc1ccc(S(=O)(=O)NC2CC2)cc1C(=O)NNC(=O)Cn1ccc2ccccc21	729450381	ZRBDNDYQPQAPIY-UHFFFAOYSA-N	426.498	1.852	50	20	IDGD	
COc1ccc(N2C[C@H](C(=O)NNC(=S)Nc3ccc(OC)nc3)CC2=O)c(OC)c1	729693452	ZMGHEQFKMARXJH-GFCCVEGCSA-N	445.501	1.478	50	20	IDGD	
CSCC[C@@H](C(=O)NNC(=O)COc1ccccc1O)N1C(=O)c2ccccc2C1=O	730780477	WTPNUFGUJHAGDX-HNNXBMFYSA-N	443.481	1.336	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)c1cccc(S(=O)(=O)NC2CCCC2)c1	730780660	QPUVQLBELALGPK-UHFFFAOYSA-N	433.486	1.453	50	20	IDGD	
Cc1ccc(-c2noc(CCC(=O)NNC(=O)CCN3C[C@@H](C)O[C@H](C)C3)n2)cc1F	732262682	VGCXWSNCADXIRN-HUUCEWRRSA-N	433.484	1.763	50	20	IDGD	
O=C(COC(=O)c1ccccc1N1CCOCC1)NNC(=O)c1cccc([N+](=O)[O-])c1	732334097	YTWXUJGJNADNLS-UHFFFAOYSA-N	428.401	1.049	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc(Cl)c1OCC(N)=O	733110690	ONRKPNUGFANGGK-UHFFFAOYSA-N	443.847	1.473	50	20	IDGD	
Cn1c(NNC(=O)c2c(F)ccc(S(=O)(=O)NC3CC3)c2F)nc2ccccc2c1=O	733264258	ZFVIJOCVDCTAHR-UHFFFAOYSA-N	449.439	1.409	50	20	IDGD	
CCOCCCn1c(NNC(=O)C2(C(=O)NC3CC3)CCC2)nc2ccccc2c1=O	733268478	NCRPCXKEFLDGQO-UHFFFAOYSA-N	427.505	1.715	50	20	IDGD	
CNS(=O)(=O)[C@@H]1CCCN(C(=O)NNC(=O)c2ccc(COc3ccccc3)o2)C1	733335842	FBNKZBOIBRSGNK-MRXNPFEDSA-N	436.490	1.227	50	20	IDGD	
CC(=O)Nc1ccc(S[C@H](C)C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)cc1	734241190	HCPLXPGKALWWQY-GFCCVEGCSA-N	439.538	1.981	50	20	IDGD	
COc1ccc(C)cc1N1C[C@H](C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)CC1=O	734241874	LJPYCHWWAJPAHS-CQSZACIVSA-N	449.508	1.212	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN2CCN(CC(=O)Nc3ccccc3)CC2)cc1C	736308541	PHJBENNFBYLACN-UHFFFAOYSA-N	443.573	1.636	50	20	IDGD	
CN1CC[C@H](NC(=O)NNc2ccc(S(=O)(=O)NC3CCCCCCC3)cn2)C1=O	739059653	RWRWMUUAJAQEBP-INIZCTEOSA-N	438.554	1.330	50	20	IDGD	
COCCOCc1cc(C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)ccc1F	742034814	WPRBUNKYHINSTF-UHFFFAOYSA-N	428.420	1.310	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)ccc1-n1cncn1	742077423	RKHVZXSERDCDSL-UHFFFAOYSA-N	443.508	1.919	50	20	IDGD	
O=C(CCN1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O)NNC(=O)c1cc2c(s1)CCCCCC2	742480967	OULSJFVHWJSXQY-OHHBCXFOSA-N	445.541	1.721	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)NCC2(O)CCS(=O)(=O)CC2)c(C)n1C[C@@H]1CCCO1	743756745	QTVHOWGJBALNDQ-LOHYDARVSA-N	435.546	1.247	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)CCn2cnc3sccc3c2=O)cc1	743829257	IXNBRASLKUKLSW-UHFFFAOYSA-N	435.487	1.105	50	20	IDGD	
CCN(CC)C(=O)N1CCC(C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)CC1	744751421	TZNGFPXLVKGVLF-UHFFFAOYSA-N	429.477	1.036	50	20	IDGD	
Cc1nccn1CCCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	745843051	YITFUYCRANXFJM-UHFFFAOYSA-N	448.549	1.400	50	20	IDGD	
COC(C)(C)C[C@@H](C)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	745866914	BONIRWCIMOANLH-CQSZACIVSA-N	426.539	1.619	50	20	IDGD	
CCCCNC(=O)NNC(=O)CNC(=O)[C@@H]1c2ccccc2C(=O)N1Cc1ccccc1	745867940	QNBOMIVTEKCCEJ-FQEVSTJZSA-N	437.500	1.630	50	20	IDGD	
CC(C)(CNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)NC(=O)OC(C)(C)C	745924527	AKOYUOKRDVEMDI-UHFFFAOYSA-N	435.529	1.327	50	20	IDGD	
COC(=O)c1cn(CC(=O)NNC(=O)c2cn(-c3ccccc3)nc2-c2ccccc2)nn1	747349683	HSQAOPAEBWFEHY-UHFFFAOYSA-N	445.439	1.379	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1CNC(=O)NNC(=O)c1ccc(Cl)cc1F	747490318	IXVJTYLUELFOMT-UHFFFAOYSA-N	428.873	1.874	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)N2CCC(=NNC(=O)Cc3ccncc3)CC2)cc1	747641614	FZDSOGGAEQHWBW-UHFFFAOYSA-N	429.502	1.539	50	20	IDGD	
O=C(Cc1cc(O)nc(S)n1)NNC(=S)NCc1ccc(Br)cc1	747647507	WUKLUAUWFTUNPL-UHFFFAOYSA-N	428.337	1.471	50	20	IDGD	
Cc1cccc(C)c1NC(=O)C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	748619597	LSALQOJZTJHZOV-UHFFFAOYSA-N	445.545	1.321	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)N[C@H](C)c1cc(F)ccc1N1CCN(C)CC1	748628134	PHBLYSLSMTXCAI-HUUCEWRRSA-N	425.505	1.020	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN1S(=O)(=O)c1cccs1)c1cc2c(s1)CCC2	749161238	VXGHHDYLFPDWGF-LBPRGKRZSA-N	425.557	1.913	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1)c1cnn(C)c1	749874700	SJWQJTBDNMJHSR-GFCCVEGCSA-N	433.515	1.847	50	20	IDGD	
CS(=O)(=O)Nc1ccc(O)c(C(=O)NNc2nc(Br)cn3ccnc23)c1	750248822	WEMLYUQMGRXXAB-UHFFFAOYSA-N	441.267	1.326	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)[C@H]2CC(=O)N(c3cc(OC)cc(OC)c3)C2)cc1	752294472	OIBLTCCXAGBSDB-INIZCTEOSA-N	441.484	1.846	50	20	IDGD	
O=C(CNc1ccccc1)NNC(=O)[C@@H]1CC(=O)N(CCOc2ccccc2Cl)C1	752610792	GVFWDDSMHXVTFK-OAHLLOKOSA-N	430.892	1.827	50	20	IDGD	
Cc1cc(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c(F)cc1F	753362709	VWKJSEFFMNAYGD-UHFFFAOYSA-N	433.458	1.147	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H](C)C(C)(C)CN(C)C)c1	754376540	WWVMCPYTLYUIQD-OAHLLOKOSA-N	441.598	1.637	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)c3cccc(S(N)(=O)=O)c3C)n[nH]2)cc1C	754474728	IYUZQTWKRWJPPC-UHFFFAOYSA-N	427.486	1.724	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2cc([N+](=O)[O-])c(C)cc2C)cc(OC)c1OC	755007480	ZUTNOOYTILYOFS-UHFFFAOYSA-N	439.446	1.861	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Cc2cccc(F)c2F)c1	755036855	JDCNLGWVURBIFQ-UHFFFAOYSA-N	425.457	1.999	50	20	IDGD	
COc1ccc(S(=O)(=O)NCCC(=O)NNc2ccc(C(F)(F)F)nn2)cc1OC	755198534	SXWKVYJOEFPOFV-UHFFFAOYSA-N	449.411	1.324	50	20	IDGD	
COC(=O)CNC(=O)c1ccc(NC(=O)NNC(=O)[C@H](C)Oc2ccccc2F)cc1	755545641	JKYXBPPSXDAVIW-LBPRGKRZSA-N	432.408	1.349	50	20	IDGD	
C[C@@]1(C(=O)NNC(=O)c2ccc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)cc2)CCCO1	755684197	RZOWATPUJJUBPP-IBGZPJMESA-N	448.457	1.726	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c(OCC(=O)N(C)C)c1	756202645	KSJDVBFJTILWSP-GOSISDBHSA-N	428.445	1.455	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)Nc2ccc(OC)c(-n3nnnc3C)c2)c1	756321348	SPTPSXKFRAIKGA-UHFFFAOYSA-N	427.421	1.463	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)Nc1ccc(C)c(NS(C)(=O)=O)c1	756516043	IVNLSNBDTQLQBI-UHFFFAOYSA-N	436.490	1.997	50	20	IDGD	
CCOC(=O)C1CCN(C(=O)c2ccc(NC(=O)NNC(=O)c3ccncc3)cc2)CC1	756682100	MRHKXVOCCPJMHK-UHFFFAOYSA-N	439.472	1.963	50	20	IDGD	
O=C(NN=c1cc[nH]cc1Cl)[C@H]1CCCCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1	757419016	IYOKJGUXLZXGOT-MRXNPFEDSA-N	439.881	1.752	50	20	IDGD	
O=C(NNc1ncnc2[nH]cnc12)[C@H]1CCC(=O)N1Cc1ccc(Br)cc1	757660391	AURCNQPWOQXNRD-GFCCVEGCSA-N	430.266	1.750	50	20	IDGD	
COC(=O)c1ccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1F	757697299	ZSPVDAMZZZPFKX-UHFFFAOYSA-N	438.437	1.329	50	20	IDGD	
CC(C)Cn1ncc(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)c1C(F)F	758079495	LNJXIWMSORJKLW-UHFFFAOYSA-N	428.465	1.845	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2ccc3c(c2)OCCO3)cnn1CCO[C@H]1CCCCO1	758160179	UATWWGBDWNBSEG-IBGZPJMESA-N	430.461	1.581	50	20	IDGD	
CCC(C)(C)CNC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	759258761	KOGMIPBIJDIQFU-UHFFFAOYSA-N	440.566	1.407	50	20	IDGD	
COc1cc(F)cc(NNC(=O)[C@@H]2CN(Cc3nc(O)c4ccccc4n3)CCO2)c1	759314993	MYWGLQYBYAROOY-SFHVURJKSA-N	427.436	1.827	50	20	IDGD	
Cc1noc(C[C@H](NC(=O)NNC(=O)c2nnc(O)c3ccccc23)c2ccccc2)n1	759840752	MRGZDKPZEQPKKI-INIZCTEOSA-N	433.428	1.955	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2ccc(=O)n(-c3cnn(C)c3)c2)cc1Br	760579895	KOMDJNMKTVGYGH-UHFFFAOYSA-N	446.261	1.417	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)N2CC[C@H](n3cc(C(=O)OC)nn3)C2)c1C	760675987	IXIDQYUUNVPBMQ-BHEJFATLSA-N	426.477	1.510	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)N[C@@H]1CCC[C@@H]2OCC[C@H]21	761796571	YJXXQEYMAUDMMV-KSZLIROESA-N	436.534	1.373	50	20	IDGD	
COCC(=O)NN=Cc1ccc(-c2nn(-c3ccccc3)cc2C=NNC(=O)COC)o1	761817033	IYVIOFVULSEDOA-UHFFFAOYSA-N	438.444	1.325	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)c1cn(CC(=O)C(C)(C)C)nn1	762541346	WYVCWLFWQNMAAD-UHFFFAOYSA-N	436.538	1.727	50	20	IDGD	
Cc1nnnn1/C(=C/c1ccccc1)C(=O)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	763173149	KQPXWFHVVLTRIB-YBFXNURJSA-N	432.419	1.970	50	20	IDGD	
Cc1nn(-c2ccc(Br)cc2)cc1C=NNC(=O)N[C@@H]1CCS(=O)(=O)C1	763356523	SDIABRNKQPODBL-CQSZACIVSA-N	440.323	1.763	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(C(=O)N2CCCC2)c(F)c1)c1ccc2c(c1)OCO2	763415822	ARMYOTMRCXVVLQ-UHFFFAOYSA-N	435.433	1.414	50	20	IDGD	
CCN1C(=O)CCc2cc(NC(=O)C(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)ccc21	763442445	RAJBAFVIDKSBJQ-UHFFFAOYSA-N	425.401	1.294	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccnn1Cc1ccccc1F	763445497	IYIDHNTZTSGIMC-UHFFFAOYSA-N	426.364	1.378	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(OC)c(OC)c2OC)cc1OC	763542505	GHDYUCLNGLFKBX-UHFFFAOYSA-N	433.417	1.129	50	20	IDGD	
COc1cc(Br)cc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)c1	763550710	FYYHIUVRJLJFAR-UHFFFAOYSA-N	436.218	1.586	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)ccc1C(=O)NC(C)C	763604890	KOWRRMDQCGCQIE-UHFFFAOYSA-N	448.483	1.923	50	20	IDGD	
Cc1cn2cc(NC(=O)C(=O)NNC(=O)COc3cccc(C(F)(F)F)c3)ccc2n1	763640240	ULKOMKQCWRWUJX-UHFFFAOYSA-N	435.362	1.826	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cc3c(cc2SC)OCCO3)cc1	763661349	NIQOXRVVNXRWPA-UHFFFAOYSA-N	447.469	1.353	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cc(C)nn2[C@H]2C[C@H]3CC[C@H]2C3)cc1	763662657	YXPLSGGICANWJV-MPGHIAIKSA-N	441.488	1.726	50	20	IDGD	
CN(C)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)cc1Cl	763682326	UXPWSUKFQQYOAZ-UHFFFAOYSA-N	443.847	1.078	50	20	IDGD	
Cc1cc(Cl)ncc1NC(=O)C(=O)NNC(=O)COc1ccc(Br)cc1	763694460	JNJXHKIBSRNIML-UHFFFAOYSA-N	441.669	1.971	50	20	IDGD	
O=C(NCc1ccc(N2CCCS2(=O)=O)cc1)NNC(=O)c1ccc2c(c1)OCCO2	763705055	LIBGETPBBLQWJS-UHFFFAOYSA-N	446.485	1.142	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(N)=O)cc2F)cc1	763768491	QYZZXHRLZQOMPM-UHFFFAOYSA-N	430.436	1.749	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)C(=O)Nc2nc(-c3ccccc3)cs2)c2ccccc2c1=O	763789779	CVTPGIXWEHLEOI-UHFFFAOYSA-N	448.464	1.457	50	20	IDGD	
CCN(c1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])cc1)C(C)C	763802366	CSIFLTQOWZLZCR-UHFFFAOYSA-N	443.460	1.994	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)C(=O)Nc1ccc(OCC2CC2)cc1	763945359	XAISXHASUVFCID-UHFFFAOYSA-N	435.440	1.766	50	20	IDGD	
O=C(NNC(=O)c1cccc(Br)c1)C(=O)Nc1cnn(-c2ccncc2)c1	764062693	AFJUYBTYKCTQBQ-UHFFFAOYSA-N	429.234	1.430	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)nc2)cc1Cl	764092785	NJCCPJVUIKBTCB-UHFFFAOYSA-N	441.227	1.340	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc(NC(=O)C4CC4)nc3)n[nH]2)cc1	764110867	MDZPIVBAUGFXJI-UHFFFAOYSA-N	447.455	1.528	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cncc(Br)c2)o1	764139386	SAHJWZIHICQSLQ-UHFFFAOYSA-N	438.282	1.679	50	20	IDGD	
N#Cc1cccc(-c2csc(NC(=O)C(=O)NNC(=O)[C@H]3Cc4ccccc4O3)n2)c1	764152813	GHVGKELFLBMRMQ-QGZVFWFLSA-N	433.449	1.771	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2O1)C(=O)Nc1ccc([S@@](=O)C(F)(F)F)cc1	764168255	PAANSEZGRXRILU-NGFNCXNUSA-N	441.387	1.404	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)C(=O)Nc1cccc(Br)c1	764204920	VMQYURAECKWXAY-UHFFFAOYSA-N	443.298	1.840	50	20	IDGD	
O=C(CCCc1ccccc1)NNC(=O)C(=O)Nc1ccc(N2CCOCC2)c(F)c1	764224070	PCIMGAUQZXXOTB-UHFFFAOYSA-N	428.464	1.771	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)C(=O)Nc2cnc(C3CC3)nc2)c1	764231986	LOWMLEQQHAJKHB-UHFFFAOYSA-N	434.250	1.525	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)C(=O)Nc2nc3cc4c(cc3s2)OC(F)(F)O4)c1	764234844	LNAFUAADDUBZJP-UHFFFAOYSA-N	445.363	1.889	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)C(=O)Nc1ncn(Cc2ccc(Cl)cc2)n1	764319561	NFXQGMHQRBWXMZ-UHFFFAOYSA-N	430.827	1.448	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)C(=O)Nc1ccc(CCN2CCSCC2)cc1	764355832	JVTRRMAJYWZMOW-UHFFFAOYSA-N	427.530	1.002	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)COCc2ccccc2)cc1C(=O)NC(C)C	764367040	HZMOOKCRNPCKCW-UHFFFAOYSA-N	426.473	1.436	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)C(=O)Nc2cccnc2OCc2ccccc2)c1	764434496	XEGOSZSJMMLRJQ-UHFFFAOYSA-N	448.439	1.414	50	20	IDGD	
COc1ccc(C(=O)NNc2nccnc2OC)cc1S(=O)(=O)N1C[C@H](C)C[C@@H](C)C1	764465518	NEBRSAFJOPOYLB-ZIAGYGMSSA-N	449.533	1.917	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=S)NCCc1ccccc1	764515306	OLZKMENENJFIHV-UHFFFAOYSA-N	425.558	1.182	50	20	IDGD	
O=C(NNC(=O)c1ccnc(Cl)c1I)C(=O)Nc1ccccn1	764593577	SUVPOFHQCKQQJC-UHFFFAOYSA-N	445.604	1.134	50	20	IDGD	
Cc1c(Br)cc(C(=O)NNC(=O)Cc2nc3ccccc3n2C)c(=O)n1C	765187174	XFCZZSMDSCJLPW-UHFFFAOYSA-N	432.278	1.347	50	20	IDGD	
NC(=O)c1ccc(C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)s1	766660596	OGOPSIIZPDVGTO-UHFFFAOYSA-N	435.937	1.079	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)[C@@H](c1ccccc1)N1CCCCC1=O	767338192	BCLULGNVOOZWKK-HSZRJFAPSA-N	437.496	1.982	50	20	IDGD	
N#Cc1cc(Cl)nc(NNC(=O)c2cc(S(N)(=O)=O)ccc2Br)c1	768696369	XWSCEEOTRFCVMQ-UHFFFAOYSA-N	430.671	1.773	50	20	IDGD	
Cn1cc(CCNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)c2ccc(F)cc21	770308557	UTMQCNUOSVOXEK-UHFFFAOYSA-N	446.508	1.797	50	20	IDGD	
C[C@H](CNC(=O)NNc1nc(O)c2cnn(C)c2n1)Oc1ccccc1Br	770402075	OEDXGYURZRDFGU-SECBINFHSA-N	436.270	1.925	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)NC1CCN(CCC(=O)N(C)C)CC1	770514732	UBCCRWTWMIXRSF-AWEZNQCLSA-N	439.944	1.380	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)cc(S(N)(=O)=O)c1C	772951513	CHXSNQAWFPCQEQ-GFCCVEGCSA-N	425.894	1.833	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C1CCN(c2ccc3nncn3n2)CC1	772954751	RIGJUZPQLDVWBK-ZDUSSCGKSA-N	443.895	1.609	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNS(=O)(=O)c1cc2c3c(c1)CC(=O)N3CCC2	773250451	DHVIBQBUWKMOTM-LBPRGKRZSA-N	449.916	1.952	50	20	IDGD	
O=C(NNc1cnccn1)C(=O)Nc1ccc(OCCN2C(=O)c3ccccc3C2=O)cc1	773478909	NUQIFBZCHUADHD-UHFFFAOYSA-N	446.423	1.233	50	20	IDGD	
Cc1ccc(-n2nccc2NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)nn1	773498702	CJIFKZWWJLXYRQ-HNNXBMFYSA-N	437.460	1.141	50	20	IDGD	
CNC(=O)c1ccc(C)c(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)c1	774010197	VTPNEWBWOQRSHJ-LBPRGKRZSA-N	432.864	1.561	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)N[C@H]1CCN(c2cccc(Br)c2)C1=O	775224367	ZXCLOWIOMRFKGB-HNNXBMFYSA-N	432.278	1.523	50	20	IDGD	
O=C(NNC(=O)N1CC[C@](O)(c2ccc(F)cc2)C1)C1CCN(c2ncccn2)CC1	776908047	OJTWMNPKOJGWRY-OAQYLSRUSA-N	428.468	1.166	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)C(=O)Nc2cc3c(cc2F)NC(=O)CC3)cc1	778707654	PIHZKGAEVYLDFV-UHFFFAOYSA-N	430.461	1.897	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H]2CC[C@@H](C1)N2CC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	782505993	RERILJXEXWEWKK-WBVHZDCISA-N	447.492	1.830	50	20	IDGD	
CC(C)C(=O)NNC(=O)Nc1cc(S(=O)(=O)N2CCOCC2)ccc1N1CCCC1	782537972	PKBPYKLIQCYYON-UHFFFAOYSA-N	439.538	1.116	50	20	IDGD	
CN1CCN(C(=O)c2ccc(NC(=O)C(=O)NNc3nc4ccccc4s3)cc2)CC1	782816164	PJHUPJZRBZBGJY-UHFFFAOYSA-N	438.513	1.766	50	20	IDGD	
COCCc1ccc(Oc2ccc(NC(=O)C(=O)NNC(=O)C(=O)NC3CC3)cc2)cc1	782964888	CXZQPLFXWZCVGB-UHFFFAOYSA-N	440.456	1.032	50	20	IDGD	
Cn1cc(Br)cc(NC(=O)C(=O)NNc2ccc(Br)cc2)c1=O	783006404	RQFKRIYWNHRTBX-UHFFFAOYSA-N	444.083	1.992	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2cccc(NC(=O)C3CCCCC3)c2)CCS(=O)(=O)C1	783424997	HDIRXXSIBZFARK-HXUWFJFHSA-N	436.534	1.342	50	20	IDGD	
CC1CCN(c2ccc(NC(=O)C(=O)NNC(=O)CNC(=O)c3ccco3)cc2)CC1	784004054	HJJKSSIJSGSVJQ-UHFFFAOYSA-N	427.461	1.032	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2ccc(C(C)(C)C)cc2)n([C@H]2CCS(=O)(=O)C2)n1	784805928	WAQDAIDJAGRUTQ-INIZCTEOSA-N	433.534	1.930	50	20	IDGD	
C[C@H]1C[C@@H](C)CN(C(=O)c2ccccc2NC(=O)C(=O)NNc2ccnc(N(C)C)n2)C1	784969040	HDRAJQZYTXVJJF-GASCZTMLSA-N	439.520	1.743	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNc2ccc(C#N)c(Cl)c2)cc1C(=O)OC	785095159	QHHJLIZTSUZRFQ-UHFFFAOYSA-N	430.804	1.867	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)C(=O)Nc1cc(F)cc(Br)c1F	787541945	YJYXPNXUWVAGKS-UHFFFAOYSA-N	442.172	1.856	50	20	IDGD	
O=S(=O)(CBr)N1CCN(S(=O)(=O)C2=Cc3ccccc3OC2)CC1	788905222	NWZYCILKOLHPQL-UHFFFAOYSA-N	437.337	1.050	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1cc([C@@H]2CCCO2)nn1C	789783645	WNZFZBIBPZJIFY-NHYWBVRUSA-N	435.868	1.478	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC[C@H]2C)cc1	790063129	FBSAYOJKEZFKGO-OAHLLOKOSA-N	441.550	1.800	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccc(C)s1	790064127	UGNDNOJZXQERHR-CYBMUJFWSA-N	433.552	1.146	50	20	IDGD	
C[C@]1(C2CC2)NC(=O)N(c2ccc(CNC(=O)NNC(=O)Cc3cccnc3)cc2)C1=O	790709342	OJUTXNSQDCIPES-JOCHJYFZSA-N	436.472	1.380	50	20	IDGD	
Cc1cccc(=O)n1C[C@@](C)(O)C(=O)NNC(=O)NCc1cccc(C(F)(F)F)c1	792097048	PGILOIVMYSKJTM-GOSISDBHSA-N	426.395	1.457	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)Cc2ccccc2OC)cc(Cl)c1F	792266587	AMONXXQWTUOYCN-UHFFFAOYSA-N	437.811	1.603	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)Cc2ccsc2)cc(N2CCN(C(C)C)CC2)c1	792269719	VEZSNUIPPMCVAP-UHFFFAOYSA-N	443.573	1.916	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(N(C)C)c(NC(=O)C(=O)NNc2ncccc2C)c1	792375285	HEQFKEIJCBCWLZ-UHFFFAOYSA-N	448.549	1.568	50	20	IDGD	
CC(C)Oc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Br)s2)nn1	793021362	CPVYWQZKHROJSW-UHFFFAOYSA-N	428.268	1.488	50	20	IDGD	
CCNC(=O)N(C)c1cccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)c1	796989927	MLLHVSKIIUNLHU-CYBMUJFWSA-N	445.451	1.545	50	20	IDGD	
CC(=O)N[C@](C)(C(=O)NNC(=O)c1c[nH]c2ccccc12)c1ccc(S(C)(=O)=O)cc1	797610585	SFPBKPANZTUEPO-NRFANRHFSA-N	442.497	1.384	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)N2CCN(c3cnc(O)nc3N)CC2)c1C	797995541	GCWPWJKGWJKDSH-BOPFTXTBSA-N	425.493	1.085	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@@H](C(=O)NN=c2sc3ccccc3n2C)[C@@H](C)O)cc1	798304107	JTXIZUMCGUXKMC-CXAGYDPISA-N	434.543	1.208	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CCc2c(C)nc3c(c(O)nn3C)c2C)cc1C	798308789	NZQCBCDJXUAWOB-UHFFFAOYSA-N	438.488	1.626	50	20	IDGD	
CO[C@@H](C(=O)NNC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1)c1cnn(C)c1	798829586	IFBOADSJNHMLFT-GOSISDBHSA-N	431.456	1.817	50	20	IDGD	
CCc1ccc(C(=O)NNS(=O)(=O)c2cc(Br)cc(C(N)=O)c2)cc1	799519231	RSEGXNZJEHKQIW-UHFFFAOYSA-N	426.292	1.734	50	20	IDGD	
C[C@H](CCNS(=O)(=O)c1ccccc1)NC(=O)NNC(=O)c1ccc2ccccc2n1	801798264	UANBNZTUTAVCDH-OAHLLOKOSA-N	441.513	1.936	50	20	IDGD	
O=C(CN1C(=O)Cn2c(cc3ccccc32)C1=O)NNC(=O)Nc1cc(F)cc(F)c1	802002857	BFDGTJZFBMAWFF-UHFFFAOYSA-N	427.367	1.755	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)[C@](C)(O)Cn2cc(C(F)(F)F)ccc2=O)cc1	802123368	ODMJSAQUSLDJEQ-GOSISDBHSA-N	441.410	1.537	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])o2)cc1	802123753	SPZJNEGBJBAOJE-AWEZNQCLSA-N	430.421	1.711	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)Nc1cc2n(n1)CCCC2	806720384	PXRWSHNRMIRBBK-UHFFFAOYSA-N	432.506	1.470	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc3c2CNC3=O)cc1OC	806975412	XVXBRUARXMVXOB-UHFFFAOYSA-N	440.456	1.517	50	20	IDGD	
CNc1nc(C)cc(C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)n1	807093466	NDPNKUIWTOXQLO-UHFFFAOYSA-N	431.928	1.059	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)[C@@H]2C[C@@H](c3ccccc3)OC2=O)ccc1Cl	809555606	BNEGWYCQZTUPSE-JSGCOSHPSA-N	437.861	1.053	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)c2cnc3[nH]c(O)nc3c2)c2ccccc2c1=O	809558190	YZKGVBNISXWSFM-UHFFFAOYSA-N	435.444	1.638	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)Nc1ccc(-n2ccc(C(F)(F)F)n2)cc1	810314632	DLMFHJCKEJMIKU-JTQLQIEISA-N	431.396	1.479	50	20	IDGD	
CCOc1cc(Br)c(F)cc1NC(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1	810340100	AJEAMYBXVOSDAZ-MRVPVSSYSA-N	438.275	1.574	50	20	IDGD	
O=C1CC(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)(c2cccc(Cl)c2)C1	810348501	OPQQRUMZMKEIJF-UHFFFAOYSA-N	427.892	1.795	50	20	IDGD	
NC(=O)c1ccc(OCC(F)F)c(NC(=O)C(=O)NNc2ccc(C(F)(F)F)cn2)c1	810388262	FLTYZNLQBIUTGU-UHFFFAOYSA-N	447.320	1.925	50	20	IDGD	
CN(C)c1noc(CNC(=O)NNC(=O)COc2ccc(OCc3ccccc3)cc2)n1	812219259	SSQCZMUQADEQTN-UHFFFAOYSA-N	440.460	1.624	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2nc3c(s2)CCCCC3)cc1	813033064	CRBIMESHAWVGHR-UHFFFAOYSA-N	437.547	1.744	50	20	IDGD	
COc1cc(C(C)=NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)on1	814710474	OHQFLVLLRIJROL-UHFFFAOYSA-N	436.490	1.177	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)c2cn3c(Br)cnc3s2)c2ccccc2c1=O	814730819	UJXGOKIJUJBXGE-UHFFFAOYSA-N	447.274	1.480	50	20	IDGD	
CCOC(=O)CN1C(=O)C(F)(F)c2cc(NC(=O)C(=O)NNc3ccc(C)cn3)ccc21	815590846	LBLRUUMVDJKBLL-UHFFFAOYSA-N	447.398	1.473	50	20	IDGD	
Cc1ccc(OCc2ccccc2)c(NC(=O)C(=O)NNC(=O)[C@@H]2CCc3nncn3C2)c1	815691443	QCPJVYGAHPSYEK-QGZVFWFLSA-N	448.483	1.514	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCS(=O)(=O)C1)c1nc(-c2ccccc2)n(-c2ccccc2)n1	816828921	UJZNHNDALBJFEU-MRXNPFEDSA-N	439.497	1.520	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)CN1C(=O)N[C@@]2(C[C@@H](C)CC(C)(C)C2)C1=O	863999673	XIFKZNGGOAIHOV-RCDICMHDSA-N	446.504	1.358	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)COc2ccc(Br)cc2F)C[C@H](C)O1	912920193	XSOUHSXEGKKXQH-RYUDHWBXSA-N	432.290	1.614	50	20	IDGD	
COCCNS(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(Cl)cc2OC)c1	913055246	LZHFYJGRIVOXJA-UHFFFAOYSA-N	441.893	1.348	50	20	IDGD	
O=C(CNS(=O)(=O)c1c(Cl)cccc1Cl)NNC(=O)Cc1ccc(F)cc1	913155485	YRWGMSLTHUJWEU-UHFFFAOYSA-N	434.276	1.801	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)NC[C@@H]2CN(Cc3ccccc3)CCO2)c1	915894445	KCXXXVKLNCVRSG-HXUWFJFHSA-N	426.517	1.914	50	20	IDGD	
CCN(CC)c1ccc(CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)cn1	916389606	AKPLRKCUMUUSCH-UHFFFAOYSA-N	433.538	1.365	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NCc1ccnc(N2CCN(C)CC2)c1	916390458	RHCDJNPDHFRYLL-OAHLLOKOSA-N	430.484	1.270	50	20	IDGD	
CCOC(=O)N1CCC(NC(=O)CCCNC(=O)NNc2ccc(Cl)nn2)CC1	916639848	QMJIBSBWBMPTJS-UHFFFAOYSA-N	427.893	1.273	50	20	IDGD	
O=C(NCCOc1cccc(C(F)(F)F)c1)NNC(=O)c1ccc(-n2cnnn2)cc1	916650636	DQVMUQBZYSIYFA-UHFFFAOYSA-N	435.366	1.704	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CCNS(=O)(=O)c2ccc(C)c(C)c2)cc1	916830655	NLCKUVSUCKILKB-UHFFFAOYSA-N	432.502	1.066	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CCn2cc(Br)cn2)cc(OC)c1OC	917541672	FKNZTCYHSZYLBI-UHFFFAOYSA-N	427.255	1.523	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNS(=O)(=O)c2ccc(OC)c(C(=O)O)c2)cc1	917725930	WZUQAUBFUUVEDT-GFCCVEGCSA-N	438.458	1.569	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)[C@@H](C)Sc1nncn1C	917921827	DOKXDWIWWDOXHM-NXEZZACHSA-N	428.312	1.673	50	20	IDGD	
C[C@@H](CN1CCC[C@@H](C)C1)NC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	919914733	LFFBIROXJPGBHL-UXHICEINSA-N	430.597	1.650	50	20	IDGD	
COc1cccc(C(=O)NNS(=O)(=O)c2cccc(C(=O)NCC(F)(F)F)c2)c1O	919958644	UCQXVIIPEQHKOJ-UHFFFAOYSA-N	447.391	1.316	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)N[C@@H]2CCCN(S(C)(=O)=O)C2)c(C)n1C[C@@H]1CCCO1	920292074	LPSDMOATFQKZJO-INQFTJRBSA-N	434.562	1.731	50	20	IDGD	
O=C(COC(=O)[C@H]1CCCN1C(=O)Cc1ccccc1)NNC(=O)c1cccc(Cl)c1	920684146	YNODGBWAROAJGO-GOSISDBHSA-N	443.887	1.878	50	20	IDGD	
C=CCNC(=O)c1cccc(S(=O)(=O)NNC(=O)c2cncn2-c2ccccc2)c1	1115864122	XJEXINRTTLRCAQ-UHFFFAOYSA-N	425.470	1.411	50	20	IDGD	
O=C(NNC(=O)c1n[nH]c2c1CCCC2)Nc1ccc(C(=O)NC2CCOCC2)cc1	1254736362	CJENAIQYNQIOFT-UHFFFAOYSA-N	426.477	1.664	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)c1ccc([S@](C)=O)cc1	1319501103	ISBKTXURARWGLA-KJEZJMDVSA-N	430.534	1.522	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cc(S(C)(=O)=O)ccc2Br)cc1	1322459033	CPJRKUPTRGHTDB-UHFFFAOYSA-N	427.276	1.936	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)[C@@H]1CC(=O)N(c2ccc(C#N)cc2)C1	1324347900	GBRANCANLUUQFC-OAHLLOKOSA-N	427.486	1.305	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(N2CCOC2=O)cc1)c1cncn1-c1ccccc1	1329232602	RGKGGWGGPARMIF-UHFFFAOYSA-N	427.442	1.452	50	20	IDGD	
Cc1nn([C@@H]2CCS(=O)(=O)C2)c2nc(C3CC3)cc(C(=O)NNc3ncccn3)c12	1337271197	BOMIMLNDCJOMDT-CYBMUJFWSA-N	427.490	1.524	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N1CCC2(CC1)CNC(=O)O2	1520844783	IWSZBSFQBIEMIW-NSHDSACASA-N	441.282	1.532	50	20	IDGD	
CC(C)Cc1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](O)CCl)C3)n(C)n1	1777764174	IITKIQFVDLYQBD-DBXWQHBBSA-N	440.972	1.346	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccn(C(F)F)n3)C2)C1	1779618718	WVZSKZOIYWVJEW-ZBEGNZNMSA-N	435.269	1.895	50	20	IDGD	
COc1nccnc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Br)C1	1780771196	VYZOESUIHOPWJG-BTJLNZGRSA-N	445.289	1.303	50	20	IDGD	
CC(=O)N[C@H](C(=O)N1CC[C@@]2(CN(C(=O)C(Cl)Cl)CCO2)C1)c1ccc(F)cc1	1780911164	YNFWSXJXKWYOQU-KXBFYZLASA-N	446.306	1.637	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Cl)C2)c1ccccc1-n1nccn1	1781040230	HEEJFQXUEYDZHL-MBOZVWFJSA-N	435.887	1.929	50	20	IDGD	
O=C(c1cccc2nc[nH]c12)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781331764	VWSHCMJMWXLZQB-WMLDXEAASA-N	425.258	1.697	50	20	IDGD	
Cc1cc(C)n2ccc(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)[C@H](O)CCl)C4)c2n1	1781436160	IZKCLOSQBRDKEG-JBYIUTFZSA-N	448.951	1.678	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)Br)C2	1782180115	SFABIHYYQDNTGM-OQMKEHIESA-N	425.751	1.538	50	20	IDGD	
Cn1cnc(C(=O)N2CCO[C@@]3(CCN(C(=O)/C(C#N)=C/c4ccc(F)cc4F)C3)C2)n1	1782863526	FLXXZOSDCGDWNU-JTVVXKTLSA-N	442.426	1.144	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)C(C)(C)NCCC#N)CCO2	1783343349	UOKPBBUJDCNFCO-KBXCAEBGSA-N	429.359	1.272	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)CN3CCC(C)CC3)CCO2)C1	1783344918	WRASGIOTVDYNRB-QFBILLFUSA-N	430.387	1.722	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cc4n(n3)CCCO4)CCO2)C1	1783349856	UIQDSVGHEVZKJR-ACJLOTCBSA-N	441.326	1.283	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H]1CC(c3ccccc3)=NN1)CCO2	1783535328	BJSYEBHSUIFAOW-GZRFBZBPSA-N	449.349	1.366	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)Cc3c(F)ccc(F)c3F)CCO2)C1	1783871028	LVSMFHRSRUQAGL-DJJJIMSYSA-N	434.842	1.730	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cccc(NC(=O)OC)c3)CCO2)C1	1783880778	LNUZDRCUYMPEGE-OXQOHEQNSA-N	439.896	1.562	50	20	IDGD	
CCc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]3C2)nn1C	1783969148	DVSAFBGJJUXRKC-RMRKRWHISA-N	441.370	1.607	50	20	IDGD	
CC#C[C@@H](CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]2C1)c1ccc(O)cc1	1784096509	YYGHRMJIGHPYRQ-UGKANONSSA-N	448.947	1.469	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)n3ccnc3)[C@H]2C1	1784258113	SZJZRDBPOPOTJZ-GVRJEKJASA-N	427.343	1.597	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)Cc3c(C)nn(C)c3C)C2)C1	1784515199	QENSJSDQBGDOEB-APWZRJJASA-N	441.370	1.583	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)Cc3c(C)nn(C)c3C)C2)C1	1784515202	QENSJSDQBGDOEB-VQIMIIECSA-N	441.370	1.583	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1ccc(C2(NC(=O)C3=NNC(=O)C3)CCC2)cc1	1788646263	ZVJVEEPJWYZUGN-LGJNPRDNSA-N	449.471	1.130	50	20	IDGD	
CCc1cnc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Br)C[C@@H]32)s1	1788772857	ZYFNPBAWMGTRMK-BQUFFADESA-N	434.331	1.989	50	20	IDGD	
C[C@@H](Cc1ccccn1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21	1791492302	OWQDYNHDPCOBHO-PTTAZLHSSA-N	442.329	1.930	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4c(c3)CCCO4)[C@H]2C1	1791914468	NILHGZAPPJMYBR-GNBUJSLZSA-N	436.936	1.859	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnn3ccccc13)C2	1792868454	ZOPUVESTVOVOND-ZJOBFFGXSA-N	435.322	1.569	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)n1ccccc1=O)C2	1792870365	FPJJZIVCGUFKKW-WVCIDPQESA-N	440.338	1.030	50	20	IDGD	
C[C@@H](Cc1ccccn1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)CBr	1792872144	NVTDLUGVROQCSB-FDPKGLCPSA-N	438.366	1.881	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccncc1-c1ccccc1)C2)[C@@H](O)CCl	1792981107	QEWYHFCWJCTLFU-JSJNYSNDSA-N	429.904	1.552	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CC[C@H](C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](O)CCl)C1	1793106673	GUPMDOHHPCMLEW-QROFKTNTSA-N	443.972	1.918	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H]1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](O)CCl)C2	1793332253	CHPJCEFKJAGRRW-RHJCGQNESA-N	443.972	1.918	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ncc(Cl)cn1	1794537595	TUKJETITBBAMLM-KQXIARHKSA-N	431.718	1.364	50	20	IDGD	
Cc1c[nH]c(C)c1CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCBr	1795113047	KOZMEULYBKWSIW-CCWDJLKJSA-N	426.355	1.939	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2n(n1)CCNC2=O	1795354109	OYHXLKCCIWOAGW-RNJOBUHISA-N	438.326	1.052	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C[C@@H](N)c1cccnc1	1795681497	FEDBICNJDUCBML-ORDFZIBCSA-N	439.354	1.235	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2cccnc2[nH]1	1797457544	OJJBEJZKZNMKEU-OEYIWLLWSA-N	435.322	1.797	50	20	IDGD	
Cc1nc2sccn2c1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2	1797546687	KIDZMFLUSWSBBX-NOHGZBONSA-N	445.314	1.598	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)n1ccccc1=O	1797930800	BGUMUAOIFONUDC-WVCIDPQESA-N	440.338	1.030	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc3ccccc3o1)C2	1798440326	IDYODMAQSQDJSA-MUJYYYPQSA-N	433.468	1.997	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(C)nc1O	1798657329	WWBPEELLZQSGNT-NEBZKDRISA-N	426.311	1.472	50	20	IDGD	
CCOc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](Br)CC)C3)nn1	1798754165	QGIPNXSOCNLCBG-OQMKEHIESA-N	441.326	1.252	50	20	IDGD	
Cc1c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@](C)(Cl)CCl)C3)cn2[nH]cnc(=O)c12	1799154427	DHDAFNMPTKUBOL-JHXTVGTDSA-N	440.331	1.819	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1(F)CC1	1800356990	SWAJRHNVHDMOIS-CRWXNKLISA-N	433.908	1.210	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cn1cnc2ccccc21	1800889816	UMYKLPNLSVOVDB-FLTUCWPJSA-N	435.322	1.409	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1nc2ccccc2o1	1800900884	BRSNRUDZNYNZEE-BTTYYORXSA-N	434.456	1.392	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COc1cccc(Cl)c1)C2	1800971324	WFUOSAGDEHZYOP-ZDFLXESQSA-N	431.316	1.562	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCCn1cccc1	1801411194	VFFIFTGJAYCRFY-XLMAVXFVSA-N	426.355	1.889	50	20	IDGD	
C[C@@H](Sc1ccccn1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCC(=O)NN(C)C	1802340048	ZRHFPOGYZGDXPY-WCXIOVBPSA-N	433.578	1.573	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cc3cccnn3n2)[C@H]1c1cccnc1)[C@@H](O)CCl	1803142188	XVMFPKCBLGLYTP-WBAXXEDZSA-N	428.880	1.044	50	20	IDGD	
Cc1cc(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)c(C)o1	1805561510	LNNGZEJISVQISW-KNQAVFIVSA-N	447.300	1.605	50	20	IDGD	
CN(C)C(=O)NCC(=O)N1CC[C@@H](CNC(=O)CCBr)[C@@H]1c1cccnc1	1806339198	ZRBSSPOGOLDLRF-YOEHRIQHSA-N	440.342	1.144	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)[C@H]1CC=CCC1	1808125562	QQGKMBCSCAFFKT-RBDMOPTHSA-N	433.317	1.437	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)CCNC(=S)NC)[C@H]1c1cccnc1	1808263181	DCAYJGLITPJJSN-VYDXJSESSA-N	425.986	1.589	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@@H]1c1cccnc1	1808431154	IAZONOSNWVMHPZ-MSQAHXEGSA-N	443.317	1.645	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2c[nH]c(=O)cn2)[C@H]1c1cccnc1)[C@H](F)Br	1808676146	NKAXFGAZHCECLB-CQDKDKBSSA-N	438.257	1.175	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)[C@H]2CC=CCC2)[C@@H]1c1cccnc1	1810305370	KNUMLXOKZKGGIZ-YRISNDGFSA-N	448.527	1.756	50	20	IDGD	
CCOc1ccc(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)nn1	1811622869	PSKOUWOSDRLIBG-ZVZYQTTQSA-N	433.896	1.190	50	20	IDGD	
C=C(C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1)C(F)(F)F	1812682072	JLQRJWCMXOVCMA-MAUKXSAKSA-N	441.454	1.579	50	20	IDGD	
Cc1cccnc1C(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1813068999	RIGLYUYLOWYCSN-PGRDOPGGSA-N	438.532	1.478	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2cccc(C#N)c2)[C@H]1c1cccnc1	1813073245	ODZMJJDQVKEXGX-OFNKIYASSA-N	448.527	1.646	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)[C@@H]2C[C@@]2(F)Cl)[C@H]1c1cccnc1	1813159613	NPKNGEAEPJEQPE-SLGAXEFGSA-N	439.919	1.385	50	20	IDGD	
COCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CC2	1813734562	HKJMTHSDBOVNQL-PWSUYJOCSA-N	446.957	1.834	50	20	IDGD	
CCS(=O)(=O)CC(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](F)Br)[nH]n1	1815174420	RZDUSKABIGGJHU-GXFFZTMASA-N	439.307	1.527	50	20	IDGD	
Cc1cscc1C(=O)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1	1815354829	SNVRPAKVOGNOAW-AWEZNQCLSA-N	441.343	1.732	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)C1CCCCC1)CC2)c1cccc(B(O)O)c1	1815355461	SBZKSLGMUQDDPY-INIZCTEOSA-N	427.335	1.629	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc3n(n2)CCNC3=O)n[nH]1	1816625795	IHPIJLNOTCRGMW-BXUZGUMPSA-N	433.900	1.673	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)Cc2ccccc2)[nH]n1)c1cccc(B(O)O)c1	1817473241	NHGVOJISQYNHMZ-FQEVSTJZSA-N	432.289	1.638	50	20	IDGD	
C[C@@H](C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1)n1cccc1	1817474860	HSCOOHYZNICCHL-KXBFYZLASA-N	435.293	1.458	50	20	IDGD	
Cc1ncc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)s1	1818405879	JOOKTVLBAOZJGW-MRXNPFEDSA-N	439.306	1.474	50	20	IDGD	
Cc1ccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cnccc3C(=O)NN)n[nH]2)cn1	1819401813	BAKSSBMUQCDSQX-SFHVURJKSA-N	448.487	1.731	50	20	IDGD	
Cc1cc(/C=C/C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)no1	1819471435	CNJMTQOWARFRDG-JBVUFVISSA-N	449.276	1.405	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](Cl)COC)CC2	1819694966	MYPYAJUXROFJDL-OUAUKWLOSA-N	431.946	1.017	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)C2CCC(O)CC2)n[nH]1	1822552767	QKRRVOIZWXBBIN-DQPZFDDXSA-N	434.541	1.326	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)C2=CCCS2)CC1	1824567387	UQSBKHXMVRTSRL-GOSISDBHSA-N	443.573	1.939	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](N)CN)CC2	1824804198	HEWLWHFYDSVCLI-QPAPFBILSA-N	446.483	1.226	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(OC)nn2C)CC1	1825478597	JRKOSUFWGLGUPS-HZPDHXFCSA-N	426.945	1.916	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H]1CCC(F)(F)C1)CC2	1826080902	GZXJRYJOYAUTGS-NEPJUHHUSA-N	443.520	1.864	50	20	IDGD	
Cc1ccc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)cn1	1827051407	XKQNDDXPXRHVPH-QFIPXVFZSA-N	435.333	1.617	50	20	IDGD	
C[C@@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1)C1(O)CCC1	1827056155	UOWWWQUZDHTBLR-LAUBAEHRSA-N	442.365	1.151	50	20	IDGD	
O=C([C@@H](F)Br)N1CCC([C@@H]2CCCCN2C(=O)c2c[nH]c(=O)cn2)CC1	1829717002	WBWOSVUIMISFPL-DZGCQCFKSA-N	429.290	1.694	50	20	IDGD	
O=C1C[C@H](C(=O)N2CCC([C@@H]3CCCCN3C(=O)[C@H](F)Br)CC2)CCN1	1830381751	MUWRPDJBCMARLZ-YCPHGPKFSA-N	432.334	1.823	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3CCCCO3)C2)C1	1830534235	YPUFTNNIMBAVHB-IIDMSEBBSA-N	433.343	1.043	50	20	IDGD	
Cc1n[nH]c(C)c1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2	1830539095	AYFPIUUHLPHUJP-KPZWWZAWSA-N	443.342	1.128	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)C[C@@](C)(O)CC(=O)O)CC1	1831869431	NHWWRXXTVLWLKQ-TWOQFEAHSA-N	432.945	1.476	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccncc2O)CC1	1831873798	YGXZHADGZYKPLH-SFHVURJKSA-N	431.537	1.394	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1COc3ccccc3O1)CCO2	1832501032	YUGMBXBEPSMBKL-UQASEVPWSA-N	438.908	1.300	50	20	IDGD	
Cc1nnc(CCC(=O)N2CCO[C@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)s1	1833016931	MFVNIMVVAAIGHT-LJQANCHMSA-N	444.985	1.501	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)Cc3ccccc3F)CC2)CC1)[C@H](O)CCl	1833308993	HUOZSRIDUQRLDQ-LJQANCHMSA-N	425.932	1.540	50	20	IDGD	
C[C@@H](C(=O)NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1)n1ccnc1	1833378104	DQGRIGHQWCLWDI-BBRMVZONSA-N	444.349	1.706	50	20	IDGD	
Cc1cccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)c1	1835042377	OMOCWKBLOMNMHQ-HKUYNNGSSA-N	443.313	1.684	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cc4n(n3)CCC4)CC2)CC1	1835609858	FMBGJYVAGZVCFF-GOSISDBHSA-N	437.972	1.268	50	20	IDGD	
COC(=O)C1(C(=O)N2CCC(N3CCC(NC(=O)[C@H](F)Br)CC3)CC2)CC1	1836413442	CIXGAESEPRQGIV-AWEZNQCLSA-N	448.333	1.202	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@H](O)N3CCOCC3)CC2)CC1	1836922863	QNCKUPYOHUNCBT-NQIIRXRSSA-N	445.988	1.043	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccnc(F)c3)C2)C1	1837710276	SCJQLIGRNRCKHG-LJQANCHMSA-N	425.533	1.142	50	20	IDGD	
N#Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)cc1	1838953323	YPYFEGKBRLUBDI-QAPCUYQASA-N	440.269	1.319	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccc(OC)cc3C#N)CCO2)C1	1839133020	XUUZMRWZJZJKMO-UGKGYDQZSA-N	449.935	1.583	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)C3CCN(C(C)C)CC3)C2)C1	1839142002	BDAZWDWPCSSJDX-RXVVDRJESA-N	429.989	1.581	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3c(C)nc4ncccn34)C2)C1	1839144514	CQRZLFUUJDWEPT-QRWLVFNGSA-N	435.912	1.125	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccc(OC)c(F)c3)C2)C1	1839149221	YAYLPUPMRWDPKS-IERDGZPVSA-N	442.915	1.851	50	20	IDGD	
O=C(/C=C/c1cccnc1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839197935	NEKNDNGVZXPUOF-YPZLONQISA-N	442.285	1.242	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)cn1	1839197974	OEPYNZWVZFKRHV-WMLDXEAASA-N	430.274	1.151	50	20	IDGD	
Cc1cccc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)c1	1839199623	RCTPGQLOEPTZJJ-HKUYNNGSSA-N	443.313	1.684	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(O)ccc3O)CCO2)C1	1839445664	FLSMGWPVHXUHPF-HXUWFJFHSA-N	426.897	1.433	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)C(C)(F)F)C2)C1	1840030636	QZZMHTGKICSUAW-YVEFUNNKSA-N	441.313	1.908	50	20	IDGD	
C[C@@H](Sc1ccccn1)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1840393048	FFEWHFTYTSMJCV-ACJLOTCBSA-N	448.372	1.822	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3cnccn3)CCO2)C1	1840458059	JAXDBODGROVGDH-RTBURBONSA-N	445.347	1.102	50	20	IDGD	
C[C@]1(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)CC1(F)F	1840828114	NJJDJNWCYKMLNO-HONMWMINSA-N	429.233	1.179	50	20	IDGD	
N#Cc1cc(C(=O)N2CC3(CCCN3C(=O)[C@H](O)CCl)C2)ccc1Br	1841353017	ZFEZEEJDJOBMHS-CQSZACIVSA-N	426.698	1.737	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)c2scnc2C(F)(F)F)C1	1842568807	IHACOOGEHIWSSW-UHFFFAOYSA-N	433.456	1.352	50	20	IDGD	
O=C(c1ccc2c(Cl)ccnc2c1)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843014628	HSCQTCNYDKKTOR-UHFFFAOYSA-N	449.703	1.699	50	20	IDGD	
Cc1ccc2c(/C=C/C(=O)N3CC4(CCCN4C(=O)c4cccc(B(O)O)c4)C3)c[nH]c2c1	1843015544	NVENSQCPYZJTPG-VQHVLOKHSA-N	443.312	1.687	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2cnn(C)c2Cl)C1	1844589799	RLKMXYJLUDGWDO-FSJBWODESA-N	431.884	1.025	50	20	IDGD	
Cn1c(=O)n(C)c2cc(C(=O)N3CC4(CCCN4C(=O)[C@@H](F)Br)C3)ccc21	1845217604	JUTLRKGIHNTKLC-CQSZACIVSA-N	439.285	1.385	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CCCC23CN(C(=O)[C@@H](F)Br)C3)cc1O	1845556447	CPZAKHLCAAMQMU-CQSZACIVSA-N	428.258	1.858	50	20	IDGD	
COc1ccc(OC)c(C(=O)CCC(=O)N2CCCC23CN(C(=O)[C@@H](O)CCl)C3)c1	1846354267	ROSIZBDGJPPVMD-KRWDZBQOSA-N	438.908	1.470	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H]1CC(c2ccccc2)=NN1	1847501482	BWIPDGOBKXAWGF-NBMRYCAZSA-N	433.350	1.985	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CN1CCOC1=O	1847693654	HGITZEOLEJPPNS-UMYNOAJGSA-N	430.411	1.526	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)CCCNS(=O)(=O)c2ccc(F)cc2)cc1C	15886564	PWAXYESAJNEFET-UHFFFAOYSA-N	437.493	1.727	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNS(=O)(=O)c1ccc(OC)cc1[N+](=O)[O-]	23391795	ZORNZNSDXBTJMJ-UHFFFAOYSA-N	425.419	1.391	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cc(Cl)ccc2[N+](=O)[O-])cc1OC	104545024	TYPIKUBXQFOIAN-UHFFFAOYSA-N	437.792	1.883	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)Cn1c(SC(F)F)nc2ccccc21	725740437	DUKBYVNZKSYVFL-UHFFFAOYSA-N	439.469	1.990	50	20	IDGD	
Cn1ccnc1[C@H](NC(=O)NNC(=O)CNC(=O)c1cccs1)c1cccc(F)c1	725873497	OHZBWQCKFWKAQL-MRXNPFEDSA-N	430.465	1.471	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)[C@H]2CC(=O)N(Cc3ccc(OC)cc3)C2)cc1OC	726522203	FXNXOEDQVQWTDH-KRWDZBQOSA-N	441.484	1.912	50	20	IDGD	
COc1ccccc1CN1CCN(CC(=O)NNC(=O)c2ccc(OC)c(OC)c2)CC1	728055668	DDLJKEOBFRQPMH-UHFFFAOYSA-N	442.516	1.291	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)NCCCN2CCC[C@H](C(N)=O)C2)c(C)n1C[C@H]1CCCO1	728078310	YLDSSROZYKJBPW-CIYPURDQSA-N	441.576	1.895	50	20	IDGD	
O=C(NNC(=O)C1(c2ccc(F)cc2)CCOCC1)C1CCN(c2ncccn2)CC1	728846864	UMQCTUJKLMRJSI-UHFFFAOYSA-N	427.480	1.728	50	20	IDGD	
CN(CCCNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)Cc1ccccc1	728943859	WBVLSHAJYKLVLU-UHFFFAOYSA-N	425.537	1.546	50	20	IDGD	
O=C(NNC(=O)N1CCN(c2ccccc2F)CC1)C1CCN(c2ncccn2)CC1	728957889	LEHBTDSXKAZLJG-UHFFFAOYSA-N	427.484	1.395	50	20	IDGD	
O=C(NC[C@@H](c1ccccc1)N1CCCC1)NNC(=O)C1CCN(c2ncccn2)CC1	729041653	WMDCYCIYDUDJKF-FQEVSTJZSA-N	437.548	1.861	50	20	IDGD	
NC(=O)c1ncn2c(C(=O)NNC(=O)CCc3ccccc3O)cc(-c3ccco3)nc12	730033792	TYPLXGLFIPENNT-UHFFFAOYSA-N	434.412	1.188	50	20	IDGD	
CC(C)(C(=O)NNC(=O)CNS(=O)(=O)c1ccc2c(c1)OCCCO2)c1ccccc1	731230983	FMTZBPDJXPIANO-UHFFFAOYSA-N	447.513	1.251	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)C1CCN(S(=O)(=O)c2ccc3c(c2)CCCC3)CC1	731853020	OXXUOLWQDXFPOY-UHFFFAOYSA-N	445.545	1.459	50	20	IDGD	
COc1cc(C(=O)NNc2ccccc2S(C)(=O)=O)ccc1OCC(=O)NC(C)C	732303939	OHPLITCKOGVTRD-UHFFFAOYSA-N	435.502	1.759	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)N[C@H](Cc1ccccc1)CN1CCOCC1	732476850	ZMCQMINYOMOKSL-GOSISDBHSA-N	427.461	1.482	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN1S(=O)(=O)c1cccc([N+](=O)[O-])c1)c1ccccc1F	732931743	FNFJKRAXMVDLTH-INIZCTEOSA-N	436.421	1.348	50	20	IDGD	
C[C@@H]1Oc2ccccc2N(CCC(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)C1=O	734240342	OOMSAGBHPHPBPB-ZDUSSCGKSA-N	435.481	1.046	50	20	IDGD	
COc1ccc(S(=O)(=O)C[C@H](C)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1	734994412	ZAJGRVAMBKIESN-ZDUSSCGKSA-N	434.470	1.337	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)NC1CCN(S(=O)(=O)Cc2ccccc2)CC1	735584313	SDURTNWVXBXVCN-UHFFFAOYSA-N	448.520	1.693	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)Cc1cc(-c2ccccc2)on1	735836095	CXSXCCKLEUHSDZ-UHFFFAOYSA-N	427.486	1.947	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cccc(Oc3cnccn3)c2)c1	736544065	XGTUOMDHKSFAKL-UHFFFAOYSA-N	441.469	1.594	50	20	IDGD	
Cc1cccc(NC(=O)N2CCN(CC(=O)NNC(=O)Cc3nc(C)cs3)CC2)c1	738307840	BCOGMXNELWZBNE-UHFFFAOYSA-N	430.534	1.300	50	20	IDGD	
CN1CCN(C[C@@H](NC(=O)NNC(=O)COCc2ccccc2)c2ccccc2)CC1	738496885	CJKCXTXKRHJPSH-OAQYLSRUSA-N	425.533	1.522	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)COc1ccc(F)cc1)[C@@H]1CN(Cc2ccccc2)CCO1	741436004	SSXMNBPRDZATSW-UZLBHIALSA-N	430.480	1.824	50	20	IDGD	
O=C(CNS(=O)(=O)c1cccs1)NNC(=O)NCc1cccc(C(F)(F)F)c1	742452885	KMVSOKDWARFMDP-UHFFFAOYSA-N	436.437	1.576	50	20	IDGD	
Cc1cc(COc2ccc(C=NNC(=O)Cc3cc(O)nc(O)n3)cc2)oc1C(=O)O	743447463	ITYPRQJSOWVBKC-UHFFFAOYSA-N	426.385	1.759	50	20	IDGD	
Cn1ccnc1[C@H](NC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)c1ccccc1	743527219	MUCPAHJKMHWDKA-QGZVFWFLSA-N	442.501	1.949	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NCc2ccc(Cn3cccn3)cc2)cc1	743532620	URUQZWOJKGSWCH-UHFFFAOYSA-N	442.501	1.871	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)NCc2ccc(S(=O)(=O)N(C)C)cc2)cc1	743536138	DGNDPLFLZLSZJC-UHFFFAOYSA-N	434.522	1.539	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)[C@@H](c2cccc(F)c2)N2CCOCC2)cc1	745423977	LZTOQVRARXAKEZ-HXUWFJFHSA-N	440.431	1.075	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(CNC(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)CC1	745794075	VQCIBWDFKIOIMB-UHFFFAOYSA-N	437.453	1.892	50	20	IDGD	
Cc1cccc(-n2c(NNC(=O)c3nccnc3C(N)=O)nc3ccccc3c2=O)c1C	746257621	DIGJIGPADOOOJW-UHFFFAOYSA-N	429.440	1.648	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)c1nc(NCc2ccco2)ncc1Cl	746549862	ZZRGGZFBXXGBLA-UHFFFAOYSA-N	425.836	1.987	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)cc1	747823269	FUHBXGGXMAKPBK-UHFFFAOYSA-N	431.518	1.013	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCC(=O)N(C)C2CCCCC2)nc1	748665258	URFKLRQVYVWLDD-UHFFFAOYSA-N	440.570	1.529	50	20	IDGD	
COC[C@H](NC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1)C1CC1	750446712	OCKYSFRHHZNXKH-HNNXBMFYSA-N	438.531	1.918	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)c1cc(Cn2cc(Br)cn2)on1	751540049	CJJLTUXPHGPNQY-OAHLLOKOSA-N	448.233	1.283	50	20	IDGD	
COc1ccc(N2CCN(C(=O)NNC(=O)CNC(=O)c3cccs3)CC2)cc1F	753894108	FORMFJUUNRFNJQ-UHFFFAOYSA-N	435.481	1.189	50	20	IDGD	
CSCC[C@@H](NC(=O)c1ccc([N+](=O)[O-])o1)C(=O)NNc1ccc(C(F)(F)F)nn1	755189535	ONKPUMKCUQWGRL-MRVPVSSYSA-N	448.383	1.991	50	20	IDGD	
COC(=O)c1nscc1S(=O)(=O)NNC(=O)c1ccc(COc2ccccc2)o1	755955640	ICRYPUPVVCKOAM-UHFFFAOYSA-N	437.455	1.725	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)Nc1cccc(N2C(=O)CN(C)C2=O)c1	755994296	XYQNKHAANBWOQD-GFCCVEGCSA-N	429.408	1.844	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)C(=O)Nc1ccc(N2C[C@H]3CC[C@H]2C3)cc1	756164048	MLXQWMMQXTWOHM-YOEHRIQHSA-N	426.448	1.979	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)Nc2cc(S(=O)(=O)N(C)C)ccc2F)cc1C	756687493	ZWJRQOGNYPPHBO-UHFFFAOYSA-N	438.481	1.925	50	20	IDGD	
NC(=O)c1ccc(NNC(=O)c2sccc2S(=O)(=O)NC2CCCCCC2)nn1	757391965	IMWAPMINVZWGAE-UHFFFAOYSA-N	438.535	1.395	50	20	IDGD	
CSc1nsc(NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)n1	757590418	VHLQQWYWRPRAAH-UHFFFAOYSA-N	430.537	1.042	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c(N(C)C)n1	757762248	QVNKLNACALHESM-UHFFFAOYSA-N	446.533	1.707	50	20	IDGD	
Cc1cccc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1Br	757823250	XRLVTSXZVZPEMQ-OAHLLOKOSA-N	449.257	1.902	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)c1ccc(-c2ccc(OC(F)F)cc2)s1	758040851	SJCAXFOVDFNXDC-SECBINFHSA-N	433.458	1.715	50	20	IDGD	
CC(C)(C)OC(=O)NCC1(C(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)CC1	759649570	MWLUSXRVDDIKFV-UHFFFAOYSA-N	425.869	1.949	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)N=c2cc[nH]cc2I)c1O	760031051	WNXCWYQSHLEWJN-UHFFFAOYSA-N	428.186	1.289	50	20	IDGD	
NC(=O)[C@H]1CC[C@@H](CNC(=O)NNC(=O)COc2ccccc2Cc2ccccc2)O1	760204841	UMNGBCHBVJLCLI-PKOBYXMFSA-N	426.473	1.020	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)c1ccc(I)c(O)c1	760798772	JYUXIEFXKISLNK-UHFFFAOYSA-N	426.166	1.800	50	20	IDGD	
NC(=O)c1ccc(NNC(=O)c2c[nH]c3c(Cl)cc(Br)cc3c2=O)nn1	760851279	WLBLVXSTXXOICG-UHFFFAOYSA-N	437.641	1.590	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)CSc2nnc(-c3ccco3)o2)n1	760887104	RNARSSFSUUFFKO-UHFFFAOYSA-N	437.459	1.120	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)[C@@H]2CCCN2C(=O)c2ccc3c(c2)OCO3)n1	762912053	FYJHGECUVKFAMO-HNNXBMFYSA-N	426.477	1.799	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2c[nH]c3ccccc23)c(OCC(=O)N(C)C)c1	763534924	MHAAYIGHAPCQBQ-UHFFFAOYSA-N	437.456	1.343	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)OCCCO3)cc(OC)c1OC	763540523	WGDLIPKHHJUJOY-UHFFFAOYSA-N	445.428	1.273	50	20	IDGD	
C[C@@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)C3CC3)cc2C(F)(F)F)C[C@@H](C)O1	763562426	NNOZWZYMIUOVPZ-GHMZBOCLSA-N	428.411	1.815	50	20	IDGD	
COC(=O)c1cc2cc(NC(=O)C(=O)NNC(=O)[C@@H]3COc4ccccc4O3)ccc2o1	763570364	DTXJSQJEDJUTOW-KRWDZBQOSA-N	439.380	1.145	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccnn1CCc1ccccc1	763661413	BESZOFNNAYVVFW-UHFFFAOYSA-N	437.456	1.299	50	20	IDGD	
COCCOc1ccc(C#N)cc1NC(=O)C(=O)NNC(=O)COc1ccc(C)c(C)c1	763679714	KPNVMHYYUDKCGX-UHFFFAOYSA-N	440.456	1.365	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(NC(C)=O)c(C)c1	763682960	XBHQRKKBEXSVKR-UHFFFAOYSA-N	428.445	1.517	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)c2cccnc12	763746014	OIEXJCPKIWNVRO-UHFFFAOYSA-N	433.468	1.782	50	20	IDGD	
COCC[S@@](=O)Cc1cccc(NC(=O)C(=O)NNC(=O)c2cccc(Cl)c2)c1	763747244	DANSGKLNNNXKDH-GDLZYMKVSA-N	437.905	1.635	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)C(=O)Nc2ccc(F)cc2OC(F)F)c2ccccc2c1=O	763790402	IFSAVCCWGFTQNV-UHFFFAOYSA-N	449.345	1.074	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cccc1C(F)(F)F	763790424	IKHVMEATAQMPAX-UHFFFAOYSA-N	447.373	1.660	50	20	IDGD	
O=C(CCc1ncc(-c2ccc(F)cc2F)o1)NNC(=O)CNC(=O)c1cccnc1	763823630	JQSYJBPIJHSLII-UHFFFAOYSA-N	429.383	1.525	50	20	IDGD	
CCCS(=O)(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(CC)cc2)c1	763831666	QWKUNTABOGCTPD-UHFFFAOYSA-N	432.502	1.800	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@@H](C)C(=O)NNC(=O)C(=O)Nc1cccc(C(N)=O)n1	763877264	IXWOXEFXMYZTSE-NSHDSACASA-N	433.852	1.004	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccccc2C[S@](C)=O)cc1	763878675	SLZLSNGDVQSDCC-YSVRNHBLSA-N	445.497	1.321	50	20	IDGD	
C#Cc1cccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(Br)c2)c1	763883766	QMXXBDDQKGUTFX-GFCCVEGCSA-N	430.258	1.984	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)OC)cc2F)cc1OC	763910321	DNDVKHGVFFSEHQ-UHFFFAOYSA-N	447.419	1.809	50	20	IDGD	
COC(=O)c1cc(Br)c(F)cc1NC(=O)C(=O)NNC(=O)c1ccc[nH]1	763978710	AHYQEXCXZPCBDL-UHFFFAOYSA-N	427.186	1.103	50	20	IDGD	
O=C(NNC(=O)c1ccc2ccccc2c1)C(=O)Nc1cccc(CN2C(=O)CNC2=O)c1	764064027	AZDCYLLPGAZUAL-UHFFFAOYSA-N	445.435	1.291	50	20	IDGD	
O=C(NNC(=O)C1CCCC1)C(=O)Nc1ccc2c(ccn2CCN2CCOCC2)c1	764066155	ILTFYCHWYXHQMV-UHFFFAOYSA-N	427.505	1.250	50	20	IDGD	
CS(=O)(=O)c1c(F)cc(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3c2)cc1F	764066520	JAOJQGNGWPFWDJ-UHFFFAOYSA-N	447.419	1.921	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cccc(-c4n[nH]c(C)n4)c3)n[nH]2)cc1	764111875	SAQGYUJRUHOGGF-UHFFFAOYSA-N	444.455	1.878	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(N3CCCC3=O)c(Cl)c2)c1O	764132224	MBAJRIHOCYKPIC-UHFFFAOYSA-N	446.847	1.581	50	20	IDGD	
CN1CCCCC/C1=N\S(=O)(=O)c1cccc(NC(=O)C(=O)NNC(=O)CC2CC2)c1	764141989	JOFLSSBCYFCWMO-JJIBRWJFSA-N	449.533	1.166	50	20	IDGD	
O=C(CCCc1cccs1)NNC(=O)C(=O)Nc1ccccc1CN1CCNC1=O	764340833	JANGRGLQOXKXBL-UHFFFAOYSA-N	429.502	1.382	50	20	IDGD	
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1	765243492	KYZBQBCETZPWTP-FXAWDEMLSA-N	437.548	1.544	50	20	IDGD	
CN(c1ccc(CNC(=O)NNc2ccccc2S(C)(=O)=O)cc1)S(C)(=O)=O	765775728	MYJHFGKBTYNGEV-UHFFFAOYSA-N	426.520	1.312	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@@H](C)OC[C@@H]3CCCCO3)CC2)cc1	766650948	YCIGFBPABCGNNV-CTNGQTDRSA-N	432.565	1.234	50	20	IDGD	
CS(=O)(=O)NCC(=NNC(=O)COc1ccc(Br)cc1)c1ccccc1	766682288	FPFHWFUQRAXZEW-UHFFFAOYSA-N	440.319	1.898	50	20	IDGD	
CC(C)(C)[C@H](Br)C(=O)OCC(=O)NCCc1ccc(S(N)(=O)=O)cc1	766749652	DCBDRPZGERWGFV-CQSZACIVSA-N	435.340	1.346	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)c1ccc(N2CCOCC2)c(F)c1	767336134	LNQGRBLZBUVHCY-UHFFFAOYSA-N	429.448	1.518	50	20	IDGD	
Cc1ccc(CN2C(=O)CC[C@@H]2C(=O)OCC(=O)NNC(=O)Cc2ccccc2C)cc1	767358225	QFHHLRBHIUNQKM-HXUWFJFHSA-N	437.496	1.728	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(OC[C@@H]2CCOC2)c(F)c1)c1ccc(Cl)nc1	767447495	BXKLYYVPJPHPHK-LLVKDONJSA-N	429.857	1.913	50	20	IDGD	
C#Cc1cccc(NC(=S)NNC(=O)c2ccc(N3C(=O)CCC3=O)c([N+](=O)[O-])c2)c1	768211142	MPNPDTHWONUOJE-UHFFFAOYSA-N	437.437	1.861	50	20	IDGD	
CC(C)(O)C(=O)NNC(=O)[C@@H]1CCCN1C(=O)NCc1cccc(Br)c1	768246130	XKBCFUAHJBADSS-ZDUSSCGKSA-N	427.299	1.041	50	20	IDGD	
C[C@@]1(c2ccc(C(=O)NNC(=O)c3cc(-c4ccc(F)cc4)[nH]n3)cc2)NC(=O)NC1=O	768279763	RLHSSQYYHDYKLT-NRFANRHFSA-N	436.403	1.345	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1cccc(OC)c1[N+](=O)[O-]	769601115	KMBUNIHTXBJDGG-UHFFFAOYSA-N	437.792	1.883	50	20	IDGD	
CO[C@H](CNC(=O)OC(C)(C)C)CC(=O)NNC(=O)c1cc(Br)ccc1O	770000976	JSTLSUZZAJVIDV-NSHDSACASA-N	446.298	1.846	50	20	IDGD	
CCN1CCC[C@@H]1CN1C[C@@H](C(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)CC1=O	770958114	IPPDWKKYYDRDEX-UONOGXRCSA-N	444.540	1.063	50	20	IDGD	
COc1cccc([C@@H]2[C@H](C(=O)O[C@H](C)C(=O)NNC(=O)CC(C)C)CC(=O)N2C2CC2)c1	772234810	FKMXGFOPESCRRO-CFCCAZDESA-N	445.516	1.872	50	20	IDGD	
C[C@H]1CN(c2ccnc(C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)c2)C[C@@H](C)O1	772486184	GIBVEIMJOSGZKS-GASCZTMLSA-N	435.525	1.761	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1cc(C)nn1-c1ccc(C)nn1	773500940	XUKKJHNNVNFQHQ-UHFFFAOYSA-N	443.851	1.341	50	20	IDGD	
CCCNC(=O)[C@H]1CN(C(=O)C(=O)NNc2ccccc2[N+](=O)[O-])c2ccccc2O1	773651469	YUVKMFNIDYIEPX-QGZVFWFLSA-N	427.417	1.358	50	20	IDGD	
COC(=O)[C@@H](C)n1cccc1C=NNC(=O)CN1CCN(Cc2ccc(C)cc2)CC1	774584820	DAJDZITZDKKTAC-LJQANCHMSA-N	425.533	1.798	50	20	IDGD	
CCN(CC)c1ccc(S(=O)(=O)N2CCOCC2)cc1NC(=O)NNc1ncccn1	775432759	LPHQUUZHWVSBLA-UHFFFAOYSA-N	449.537	1.492	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(N(C)C)c(NC(=O)NNc2ncc(F)cn2)c1	775450134	KZYWSVQDHWVHIA-UHFFFAOYSA-N	425.490	1.861	50	20	IDGD	
CC1C[C@@H](C(=O)NNc2ccc(Cl)nn2)[C@H](C(=O)NNc2ccc(Cl)nn2)C1	776153330	VEKLJPYLBCXSJV-NXEZZACHSA-N	425.280	1.822	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccc(NC(=O)/C(C#N)=C\c3ccc(O)cc3)c2)CC1	776636665	VCWFYPAJXSGVSH-LGMDPLHJSA-N	426.498	1.874	50	20	IDGD	
CC(C)C[C@@H]1C[C@@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)CCO1	777752205	YOWYYPKZBOJOGL-JKSUJKDBSA-N	426.539	1.475	50	20	IDGD	
CN1CCc2cc(C(=O)NNC(=O)CN3CCN(Cc4ccc(Cl)cc4)CC3)ccc21	778997912	LKJYLPFWOCHCII-UHFFFAOYSA-N	441.963	1.911	50	20	IDGD	
CCn1cc(-c2nn(C)cc2C(=O)NNc2nc(Br)cn3ccnc23)cn1	779384826	LCWJJFGQERZTGX-UHFFFAOYSA-N	430.270	1.866	50	20	IDGD	
CN1C(=O)C[C@H](C(=O)NNC(=O)CCNC(=O)OC(C)(C)C)[C@H]1c1cccc(Cl)c1	780974472	XZNUGIATPLTZPX-WMLDXEAASA-N	438.912	1.922	50	20	IDGD	
O=C(COC(=O)c1ccc(OC2CCCC2)nc1)NNC(=O)[C@H]1COc2ccccc2O1	781769496	VPDHTTWEYHNKHV-GOSISDBHSA-N	441.440	1.547	50	20	IDGD	
Cc1nc(Cn2cc(C(=O)NNC(=O)COc3ccccc3-c3ccccc3)nn2)no1	781856159	NEMAENNMNDHXMK-UHFFFAOYSA-N	433.428	1.525	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)C(=O)Nc1ccc2ccn(C)c2c1	782897012	LIXXTXZOBPFACO-UHFFFAOYSA-N	442.501	1.180	50	20	IDGD	
O=C1C[C@H](Cc2ccc(NC(=O)C(=O)NNc3ccccc3Br)cc2)C(=O)N1	782989483	WELHAAOZLPHFFY-LBPRGKRZSA-N	445.273	1.736	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2ccnn2Cc2ccc(Br)cc2)ncn1	783948333	MQCGOPUFDCSBGZ-UHFFFAOYSA-N	430.266	1.874	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)C(=O)Nc2ccc(NC(=O)CCN(C)C)cc2)c1	784853098	WUISLJXGLGUKME-UHFFFAOYSA-N	427.461	1.445	50	20	IDGD	
COc1ccc(I)c(NC(=O)C(=O)NNc2cccc(OC)n2)c1	784853120	XVJCAJVVDBGCKM-UHFFFAOYSA-N	442.213	1.785	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNc2cccc(C(F)(F)F)n2)cc1C(=O)OC	784951311	JKJLVQGCCDAKPX-UHFFFAOYSA-N	440.334	1.755	50	20	IDGD	
CCCCN1C(=O)CC[C@@H](C(=O)NNC(=O)N2CCN(C)CC2)[C@@H]1c1ccccc1OC	788169520	QQPCZXJMOYYQPI-NQIIRXRSSA-N	445.564	1.763	50	20	IDGD	
CS(=O)(=O)c1cc(NC(=O)NNC(=O)c2ccc3c(c2)OCCO3)ccc1Cl	788301102	JIBUVVUTERUZML-UHFFFAOYSA-N	425.850	1.981	50	20	IDGD	
CN(NS(=O)(=O)c1cc(Cl)cnc1N)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	788915249	IUQCYEAPVMUQCW-UHFFFAOYSA-N	448.933	1.115	50	20	IDGD	
COc1cc(OC)c(Cn2nccc2NC(=O)C(=O)NNc2ncccc2C)c(OC)c1	792378750	WIEGNIJUUFQJGN-UHFFFAOYSA-N	440.460	1.742	50	20	IDGD	
CC(C)CCC(=O)NNC(=O)C(=O)Nc1ccc2c(c1)N(CC(F)F)C(=O)CS2	793026854	UIMWWGSRLQNPIH-UHFFFAOYSA-N	428.461	1.913	50	20	IDGD	
COCCCNC(=S)N(C)NC(=O)[C@H]1CS[C@@]2(c3ccc(F)cc3)CCC(=O)N12	793274194	VAIADSPUJKWSOS-DNVCBOLYSA-N	440.566	1.590	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CC[C@H](C)CC(=O)NNC(=O)c2cccc(C)n2)n1	794079885	GVACVRYCKBSMDB-ZDUSSCGKSA-N	426.477	1.122	50	20	IDGD	
CCC(=NNC(=O)Cn1nnc(-c2ccccc2)n1)c1ccc(Cl)c(S(N)(=O)=O)c1	794464100	DFJALAWVWRXIBE-UHFFFAOYSA-N	447.908	1.571	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)[C@H](F)CC2CCCCC2)CC1	795109766	QOEDUIILBVRTDC-MRXNPFEDSA-N	427.546	1.769	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)CS(=O)(=O)CCCc1ccccc1	795177334	LJIRNUHGPJFGMC-UHFFFAOYSA-N	439.559	1.428	50	20	IDGD	
CNC(=O)c1cc(Cl)cc(S(=O)(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c1OC	795276970	FPLRBNQBBRNYBS-UHFFFAOYSA-N	442.837	1.240	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNC(=O)C(=O)Nc1cc2c(cc1Cl)OCO2	797369456	XYDPDBPNCIWCJY-UHFFFAOYSA-N	448.819	1.081	50	20	IDGD	
COC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c1C	798041992	JKCXQETYEQFCPW-UHFFFAOYSA-N	436.428	1.759	50	20	IDGD	
CC(C)C[C@@H](/N=C1/NS(=O)(=O)c2ccccc21)C(=O)NNC(=O)NCC(F)(F)F	798315982	GUKROEWLIRYTID-LLVKDONJSA-N	435.428	1.033	50	20	IDGD	
CN1C(=O)COc2cc(NC(=O)C(=O)NNC(=O)c3cccc(Br)c3)ccc21	799258789	LPGPQZZITCHCMY-UHFFFAOYSA-N	447.245	1.204	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2cccc(C(=O)NNC(=O)Nc3ccccc3)c2)C[C@H](C)O1	801991889	ZQWGQLXQGOALAI-GJZGRUSLSA-N	432.502	1.951	50	20	IDGD	
CC(C)C[C@H](C(=O)NNC(=O)Nc1ccc2c(c1)OCO2)N1C(=O)[C@H]2CC=CC[C@@H]2C1=O	802106340	BWDBNWMTMWCRDD-HRCADAONSA-N	442.472	1.934	50	20	IDGD	
C[C@H](NS(=O)(=O)c1ccc(C#N)cc1)C(=O)NNC(=O)Nc1ccc(N(C)C)cc1	802123619	PHWBEXJLFYISNC-ZDUSSCGKSA-N	430.490	1.144	50	20	IDGD	
COc1ccc(-c2ccc(C)c(NC(=O)C(=O)NN[C@]3(C)CCS(=O)(=O)C3)c2)cn1	802569599	VAODTXFPMRTKRZ-HXUWFJFHSA-N	432.502	1.202	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)c1occ2c1CCOC2	802762313	BDPPHQIPFRNYNN-UHFFFAOYSA-N	432.908	1.585	50	20	IDGD	
CC(C)(C)C1CCC2(CC1)NC(=O)N(CC(=O)NNc1ccc(-n3ccnc3)nn1)C2=O	804956532	RMHFUZFDCYTCPM-UHFFFAOYSA-N	440.508	1.632	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3c(C)nn(C)c3c2)o1	812980126	LLWLBRNGKPCQIL-UHFFFAOYSA-N	426.477	1.716	50	20	IDGD	
COC(=O)[C@@]1(c2ccccc2)CCN(C(=O)NNC(=O)c2ccc(OC)cc2OC)C1	814298463	JWSMOZJQUQJFEU-QFIPXVFZSA-N	427.457	1.875	50	20	IDGD	
Cc1cc(Cl)c(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1[N+](=O)[O-]	815405047	HOAAMHBWRIXVBD-INIZCTEOSA-N	449.803	1.701	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)c2ccoc2C2(O)CCOCC2)cc1C	815450483	CWUCQNWEIZLFBR-UHFFFAOYSA-N	436.486	1.828	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)nnn1Cc1ccccc1F	815569216	KVTADZQEFHJJBN-UHFFFAOYSA-N	449.446	1.515	50	20	IDGD	
COC(=O)C(C)(C)c1csc(NC(=O)C(=O)NNc2ccc(Br)cn2)n1	815595986	HRFFYPFCUQEUHZ-UHFFFAOYSA-N	442.295	1.833	50	20	IDGD	
CN1CCC[C@H](N(C)C(=O)c2ccc(NC(=O)C(=O)NNc3cccc(Cl)n3)cc2)C1	815726006	JQONHLYSOWTQBR-INIZCTEOSA-N	444.923	1.983	50	20	IDGD	
COC[C@@H](C)n1c(C)cc(/C=C(\C#N)C(=O)NS(=O)(=O)c2cnn3c2OCCC3)c1C	816205300	RGPKILOKXCAVEW-IREQLNLFSA-N	447.517	1.703	50	20	IDGD	
Cc1ccc(F)cc1S(=O)(=O)Nc1cccc(C(=O)NNc2nnc(C)c(O)n2)c1	817282593	JCKQYQLWBZUFMT-UHFFFAOYSA-N	432.437	1.891	50	20	IDGD	
CNS(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=O)CNc2ccc(OC)cc2)c1	825554179	LBCIIYYIVSRQNT-UHFFFAOYSA-N	426.882	1.130	50	20	IDGD	
Cn1c(=NNC(=O)CCS(=O)(=O)c2ccc3c(c2)OCCO3)sc2ccccc21	855566289	BMBSQHWBHJDZDY-UHFFFAOYSA-N	433.511	1.807	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccccc1C(F)(F)F)NNC(=O)c1ccc([N+](=O)[O-])cc1	912764969	QBABEBPJDUQQNU-UHFFFAOYSA-N	446.363	1.353	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCc3ccccc32)cc1C(=O)NNc1ncccn1	913039987	FBSBBUUVFHEREV-UHFFFAOYSA-N	425.470	1.994	50	20	IDGD	
O=C(NNC(=O)[C@H]1CC(=O)N(Cc2ccccc2Cl)C1)c1ccc(-n2cnnn2)cc1	913155979	NBWQXXQJAJOHMV-HNNXBMFYSA-N	439.863	1.125	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)c1	914714692	BDODDXIACTWKPH-GFCCVEGCSA-N	441.456	1.880	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)N[C@@H](CN2CCCC2=O)c2ccccc2)cc1C	916459992	UPBFSNNVWGWPGB-IBGZPJMESA-N	437.500	1.936	50	20	IDGD	
C[C@H](C(=O)Nc1cccc(F)c1)N1CCN(CC(=O)NNC(=O)c2cccs2)CC1	917124834	UQMNXKYLNIEZOY-CQSZACIVSA-N	433.509	1.293	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)/C=C\c1ccccc1)C(=O)NNC(=O)CC(F)(F)F	918363654	BJNVSDOFGIQECV-KJJQSCHISA-N	439.481	1.798	50	20	IDGD	
O=C(Cc1ccc2c(c1)OCO2)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	918550428	SDMKZQRTODRPHW-UHFFFAOYSA-N	431.470	1.204	50	20	IDGD	
CC(=NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1)c1ccc(-n2cnnn2)cc1	918709476	MAIVSAQYTZOGPE-UHFFFAOYSA-N	427.490	1.132	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)OCC(=O)N2CCN(C(=O)C3CC3)CC2)c1C	918809746	JTLXZDGYCGXYEE-MOSHPQCFSA-N	442.516	1.282	50	20	IDGD	
O=C(NNC(=O)c1nc(-c2cccs2)n(-c2ccccc2)n1)N[C@@H]1CCS(=O)(=O)C1	919888982	JJDQTVOIUHIZFN-GFCCVEGCSA-N	446.514	1.127	50	20	IDGD	
CC(C)n1nc(C(=O)NNS(=O)(=O)c2c(F)cccc2[N+](=O)[O-])c2ccccc2c1=O	920245833	SKBRXIVICZGNNA-UHFFFAOYSA-N	449.420	1.648	50	20	IDGD	
O=C(NCc1cc(OCC(F)F)ccn1)NNC(=O)c1nn(-c2ccccc2)cc1O	1116501072	AHPGMTKLXLKJKL-UHFFFAOYSA-N	432.387	1.761	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC(C(=O)NNc3nncc(N)c3Cl)CC2)c(C)c1	1319800030	AHAUUMRDMYDGJL-UHFFFAOYSA-N	438.941	1.873	50	20	IDGD	
Cn1cc(-c2ccc(C=NNC(=O)CN3CCN(C(=O)c4ccccc4)CC3)cc2)cn1	1321100361	WAWKVCBUDOFGQV-UHFFFAOYSA-N	430.512	1.995	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)Nc2nccs2)C1	1778074169	ULUOFRHHKZNKPH-NXEZDXNNSA-N	444.985	1.711	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2)c1cc(C(F)(F)F)c[nH]1	1778186046	NHBCTXCNDLALSP-CKEIUWERSA-N	437.846	1.761	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cn4cccnc4n3)C2)C1	1778478293	IGFKPRKLDLILMI-ZWKOTPCHSA-N	426.304	1.409	50	20	IDGD	
O=C(C[C@@H]1CNc2ccccc2O1)N1CC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1778931443	HYBZUXGWDUHWDS-YJYMSZOUSA-N	428.316	1.883	50	20	IDGD	
Cc1nc(F)ccc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)C2	1779904188	JFYYVJURUZOTNW-VGOFRKELSA-N	449.527	1.030	50	20	IDGD	
COc1cccc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](F)Br)C2)n1	1780770986	NOWNHTZFWSXSMR-QIIPPGSGSA-N	444.301	1.908	50	20	IDGD	
Nc1nc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](F)Br)C2)cs1	1780771529	KGMYYIACGFEBDH-JRPNMDOOSA-N	435.319	1.543	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@](C)(Cl)CCl)C2)C1	1781233244	ROFXFONXCSGUKU-JLZZUVOBSA-N	425.309	1.614	50	20	IDGD	
O=C(CSc1ncccn1)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781332116	ZVNDWRVUJRISRH-IUODEOHRSA-N	433.303	1.089	50	20	IDGD	
O=C(c1ccn2cncc2c1)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781332188	VMVMCPROELDVAJ-RHSMWYFYSA-N	425.258	1.468	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(OC)c(OC)c3O)C2)C1	1781828849	AEHAMMWCRBHSPU-VBKZILBWSA-N	442.896	1.107	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnc(N)s1)C2	1781998180	OYCGTSHPNKQCKI-NSODJVPESA-N	431.356	1.636	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(CCN(C(=O)c3cccc(-n4cncn4)c3)C2)C1	1782014345	FKAJVSYTDQVCBJ-LJQANCHMSA-N	448.321	1.496	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)Oc1cccnc1)C2	1782178223	JHFTYQJAVBBBQS-LNNXQNCSSA-N	439.940	1.617	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(F)nc3F)[C@H]2C1	1783381163	NBZDPASWTMCYCS-IMIFBBOLSA-N	446.292	1.984	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3n[nH]c(C4CC4)c3F)CCO2)C1	1783532520	PATHLGHNSOUWPB-QGHHPUGFSA-N	429.290	1.653	50	20	IDGD	
CC(=O)Nc1ccccc1C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](C)Br)C2)C1	1783535974	CEOZXDXUBIMCBU-YJYMSZOUSA-N	438.322	1.872	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H]1Cc3ccccc3CN1C)CCO2	1783873683	SFWWFJYOOOSJPJ-NNMXDRDESA-N	435.952	1.127	50	20	IDGD	
CCOC(=O)c1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)C(Cl)Cl)C3)C2)ccn1	1783948524	RSVCMQCUKHVFDK-GOSISDBHSA-N	430.288	1.506	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/c3cnc[nH]3)C[C@@H]21	1783974829	VMRPUKYUPWUBHW-WMUZAFSRSA-N	425.327	1.434	50	20	IDGD	
CCSc1ncccc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]2C1	1784084456	SMXVZDMKXMRIOR-HNKHHVNMSA-N	427.954	1.387	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C3CCC(C(F)(F)F)CC3)C[C@@H]21)[C@@H](O)CCl	1784085330	GGMHORQSRMEFOE-IFQCYBEWSA-N	440.890	1.935	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)[C@H]1C[C@@H]1c1ccc(F)c(F)c1	1784155057	MPRSOQDJWMIHTK-PVJFWNNRSA-N	442.890	1.648	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3CCN3C(=O)OC(C)(C)C)[C@H]2C1	1784822601	PWPKKARIXSROJS-KSWRQPAISA-N	443.972	1.993	50	20	IDGD	
C[C@](O)(C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)C(F)(F)F	1784871635	YWSONYBSUKEVIW-RMIALFOJSA-N	431.249	1.064	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H]3CCCSC3)C2)C1	1785473138	NWRGVLOKHIQJJA-JTKSSWDBSA-N	447.561	1.094	50	20	IDGD	
N[C@@H](CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCBr)[C@H]2C1)c1cccnc1	1786406174	XGYKLEFYQVBKNF-QAETUUGQSA-N	439.354	1.236	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)N3C[C@H]4C[C@H]4C3)[C@H]2C1	1788507412	VVFJTUMCKVZANU-MRMCGTTGSA-N	442.398	1.337	50	20	IDGD	
CCc1noc(C)c1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]2C1	1789924802	WYUOZBGKSNQPSG-UHXUCMFUSA-N	432.290	1.829	50	20	IDGD	
C[C@H](Oc1ccccn1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]2C1	1789926923	LIGQGCJJDOOBQL-SMSYFYOWSA-N	444.301	1.519	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3[nH]cnc3-c3cccnc3)C[C@@H]21)C(Cl)Cl	1791296701	VDAKUFDAZDZRRI-IHRRRGAJSA-N	438.315	1.869	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cn1cc(Cl)cn1)C2	1792867475	CCKLYQIQLMKVQJ-MCYUEQNJSA-N	433.734	1.157	50	20	IDGD	
Cc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)CBr)c(O)n1	1792872694	WSFVOEHIGOCUSL-IKVITTDRSA-N	426.311	1.330	50	20	IDGD	
Cc1c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](O)CCl)[nH]c2c(Cl)cccc12	1792978331	QVWFDUHGSFMIRT-DJZPMSPPSA-N	440.327	1.933	50	20	IDGD	
COc1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](O)CCl)nc1Br	1793113856	VIQWPRCKUIWYIX-NOHGZBONSA-N	446.729	1.704	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CC(=O)OC(C)(C)C	1793588709	UYRPOIUMQNEPFL-JFILPPLUSA-N	433.343	1.339	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)c1ccnc2ccccc12	1796188981	JOUZTKKHKUHLAG-REPLKXPHSA-N	429.285	1.480	50	20	IDGD	
Cc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@](C)(Cl)CCl)C3)ncc1[N+](=O)[O-]	1796602162	VLTZMXWFTLZBLI-TYYYEBLRSA-N	445.303	1.738	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1cnc2ccccn12	1796953987	WKEZZAGWBYNAMH-BAESOJJISA-N	425.258	1.228	50	20	IDGD	
Cc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](O)CCl)C3)c2cc(O)ccc2n1	1797352088	LKXUHCCPWDGTLR-ATNYCFDYSA-N	433.892	1.052	50	20	IDGD	
CO/C=C(\C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2	1797619219	ZAMVYYOGBLYPBA-UQPONMPSSA-N	447.444	1.274	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H]1C[C@H]1c1ccccc1)C2	1798443501	CJXZCAGDZITJJP-VYMYIBDJSA-N	433.512	1.741	50	20	IDGD	
CCOC(=O)c1cccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](O)CCl)C3)c1F	1799228187	CPVBUFZKFIIJKY-ZWUHOBOKSA-N	426.872	1.854	50	20	IDGD	
CCCOc1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)cc1	1799760094	APXUZEVHBLQIPA-WKCHPHFGSA-N	436.317	1.721	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1(N2CCN(C)CC2)CC1	1799975710	ADZBFCYMYUEXRQ-WCXIOVBPSA-N	441.414	1.436	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1cccc2nccn12	1799995302	QEYUWAUBXKIGQN-BAESOJJISA-N	425.258	1.228	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3nonc3c1)C2	1800641137	OFDOVTZSZNDTIZ-OQMKEHIESA-N	437.294	1.600	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)Br)C2	1800644145	KBAGCEZIDCMTSH-SVNGYHJRSA-N	426.149	1.533	50	20	IDGD	
CC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](Cl)CC)C2	1801961035	NMZXLLGMEASTGV-DGADGQDISA-N	431.961	1.897	50	20	IDGD	
CCOc1ccc(C(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]2c2cccnc2)nn1	1803142054	WSIYDPXZXPWJKO-QGPMSJSTSA-N	433.896	1.190	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc3cccnc3n2)[C@H]1c1cccnc1)[C@H](O)CCl	1803142857	LDNQRNDJAMOKIX-UHOSZYNNSA-N	439.903	1.944	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cc3ncccc3[nH]2)[C@@H]1c1cccnc1)[C@H](O)CCl	1803146393	ASCJMHWHHALYMT-GDIGMMSISA-N	427.892	1.877	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)COc2ccccc2F)[C@H]1c1cccnc1)[C@@H](O)CCl	1803148047	NOBIATBYMKGORN-KNBMTAEXSA-N	435.883	1.905	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)[C@H](O)NC(=O)OCC)[C@H]1c1cccnc1	1803691865	MIIOVGSQYANDII-OVWQWFNUSA-N	440.928	1.559	50	20	IDGD	
Cn1ccc(CC(=O)NC[C@H]2CCN(C(=O)CCBr)[C@H]2c2cccnc2)n1	1807512042	BXIBCCNXNZEJCJ-BEFAXECRSA-N	434.338	1.849	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@H]1CCN(C(=O)CN2CCOCC2)[C@@H]1c1cccnc1	1808295411	HTKYXNBDKAZISC-POAQFYNOSA-N	443.375	1.656	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)c1n[nH]c2ccccc12	1809822858	TXQVTNLAPXJXOW-UCLAIMLFSA-N	427.892	1.877	50	20	IDGD	
O=C(CCc1ccccc1)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1	1809967683	DVHUIPSSCJALGZ-UHFFFAOYSA-N	434.345	1.844	50	20	IDGD	
CC(C)c1cc(C(=O)N2CCC3(CCCN(C(=O)c4cccc(B(O)O)c4)C3)CC2)no1	1809976598	JGCSZWGAPAXCKS-UHFFFAOYSA-N	439.321	1.636	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)C3(Br)CC3)CC2)C1	1809980730	QJJHVQZLIPVYCQ-UHFFFAOYSA-N	449.154	1.139	50	20	IDGD	
CC(=O)C(C)(C)C(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1813069548	ZRMZLIGZUAAOCC-PXNSSMCTSA-N	431.537	1.076	50	20	IDGD	
C=C(C(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1)C(F)(F)F	1813074442	RCHTZDAZFQQHFN-MAUKXSAKSA-N	441.454	1.579	50	20	IDGD	
Cc1nn(C)c(C)c1CC(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1	1813415561	MMDCYBXXLZZPFC-HQRMLTQVSA-N	433.940	1.280	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)C1CC(F)(F)C1	1814537986	ZIMMHUILYKCWFA-INIZCTEOSA-N	432.236	1.441	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)CN3CCCC3=O)sc2C1	1814600578	GHFDTWSKKARUAU-MNOVXSKESA-N	443.367	1.851	50	20	IDGD	
COc1ccc([C@H](O)C(=O)N2CCCC[C@@H]2c2cc(NC(=O)[C@@H](O)CCl)n[nH]2)cc1	1814863961	DJOMKSSSJGPRRI-RYRKJORJSA-N	436.896	1.744	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)CCC(=O)N2CCCC2)[nH]n1)[C@H](O)CCl	1814867313	HUFXMPDTPRHAGL-LSDHHAIUSA-N	425.917	1.404	50	20	IDGD	
Cc1oncc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1816514576	KQBIKCLJFXCHRF-MRXNPFEDSA-N	438.448	1.324	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CC1CC1)CC2	1817279894	KTTFEZTWVFQVNM-BTIIEKFUSA-N	428.518	1.989	50	20	IDGD	
CO[C@H](C)C(=O)N[C@@H]1CCc2nc(NC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)sc2C1	1817283019	QFEGUCPQFTWZED-HXPORVOZSA-N	432.506	1.224	50	20	IDGD	
CN[C@H](CC(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](F)Br)[nH]n1)C(=O)O	1817372304	PMNFNIMQTHLMOY-GBIKHYSHSA-N	434.266	1.155	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](C)CBr)[nH]n1	1817989132	QEYUIQRGEYTSPO-MDZLAQPJSA-N	443.346	1.880	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3nn(C)c4c3CCC4)sc2C1	1818476388	QVIIDBZKRXEVCX-JQWIXIFHSA-N	437.953	1.845	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](O)N2CCOCC2)n[nH]1	1819441867	OJJCZIGFOKSQLK-RHSMWYFYSA-N	427.933	1.317	50	20	IDGD	
C[C@@H](NC(=O)OC(C)(C)C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1	1822275357	YHRIXSCXBMPNJB-KWCYVHTRSA-N	443.932	1.915	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CN2C(=O)C=CC2=O)n[nH]1	1822531481	HWOOXEYKKNILEP-ZYHUDNBSSA-N	438.282	1.110	50	20	IDGD	
C[C@@H](C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1ccccn1	1822899358	SZFIJQOXUNNHIY-FOIQADDNSA-N	447.304	1.594	50	20	IDGD	
CC[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CSC(=N)N)CC2	1825447167	QSHWTZLBYVLBQS-JGVFFNPUSA-N	434.385	1.855	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)Cn1cc([N+](=O)[O-])cn1)CC2	1825993016	DACLOTWSAQVOND-KOLCDFICSA-N	442.885	1.114	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)Cc1ccncc1)CC2	1826088222	CGMSCAMOUKJOHE-AWEZNQCLSA-N	430.534	1.066	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(=O)n3[nH]nnc3n2)CC1	1827400212	IOJHGVRMAMUHLI-DZGCQCFKSA-N	435.916	1.063	50	20	IDGD	
COc1ccnc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)[C@@H](O)CCl)CC2)c1OC	1829852759	DMOHUGAIXAMPGF-CVEARBPZSA-N	439.940	1.932	50	20	IDGD	
Cc1cc(CCC(=O)N2CCO[C@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)ccn1	1832627294	HWJFTXYIIZORHR-LJQANCHMSA-N	430.332	1.583	50	20	IDGD	
Cc1nc(CC(=O)N2CCO[C@]3(COCCN(C(=O)CCBr)C3)C2)cs1	1832967409	UWLXDJFHYRAVNO-KRWDZBQOSA-N	446.367	1.235	50	20	IDGD	
C[C@H](C(=O)N1CCC(N2CCC(NC(=O)C(C)(C)CCl)CC2)CC1)n1cnnn1	1833216156	WHAUYQDBZFUYLU-CQSZACIVSA-N	425.965	1.071	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)CN3CCOCC3)CC2)CC1	1833532120	CZXSHQCJTKETAK-LJQANCHMSA-N	429.005	1.298	50	20	IDGD	
Cc1noc(C)c1CC(=O)NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1833728084	VMYIMVLHFYOFOO-GOSISDBHSA-N	426.945	1.005	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccccn3)CCO2)C1	1833980588	OCNVRUFDKOGSCR-KDOFPFPSSA-N	426.311	1.183	50	20	IDGD	
O=C(CCBr)NC1CCN(C2CCN(C(=O)c3ccnnc3O)CC2)CC1	1834423389	SDWXHTVHAHMBDM-UHFFFAOYSA-N	440.342	1.152	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC1CCN(C2CCN(C(=O)[C@@H]3CCCOC3)CC2)CC1	1835837908	RQYBPBWADAQEBX-QGZVFWFLSA-N	425.646	1.836	50	20	IDGD	
Cc1nc(F)ccc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1	1838267694	BABKURLNKSDGIA-RBUKOAKNSA-N	448.322	1.835	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)c3cccc(F)n3)CC2)CC1	1838457630	JGCAUSFVCJYUKK-UHFFFAOYSA-N	449.527	1.206	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCC(OC2CCN(C(=O)COCCO)CC2)CC1	1838638240	DDMVMQUVCIHIQP-GOSISDBHSA-N	425.353	1.230	50	20	IDGD	
O=C([C@H](F)Br)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CCCSC3)C2)C1	1839203200	CYAABXBCBPZQGO-HEHGZKQESA-N	439.347	1.277	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3oncc3C)C2)C1	1839966069	TZPMQAWEEPIKIE-CXAGYDPISA-N	430.299	1.227	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)n3cccc3)C2)C1	1839967370	KEKOEPRWEFZKMN-TXPKVOOTSA-N	442.354	1.679	50	20	IDGD	
C=C(C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2)C(F)(F)F	1840034955	BJXQDBSOYGBTFR-BXUZGUMPSA-N	429.233	1.345	50	20	IDGD	
O=C(c1cc(C(F)(F)F)c[nH]1)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840187727	SLYJCOUHFXUDJO-HNNXBMFYSA-N	444.237	1.907	50	20	IDGD	
CCCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1	1841349986	ASRLEARUYLZHNN-LSDHHAIUSA-N	431.961	1.873	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1ccc(C(F)(F)F)[nH]1)C2	1844264577	JNJSKSFIWHSLED-UHFFFAOYSA-N	436.394	1.163	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)c2ccccc2C(F)(F)F)C1	1844886314	LSLJXTJLTBCUII-UHFFFAOYSA-N	432.207	1.516	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)Cc2c(F)cccc2F)C1	1844962350	QYOBRLWTJXFTOE-VULFUBBASA-N	443.454	1.845	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@H](O)C[C@H]1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)C(C)(C)CCl	1847435663	MGWRLYMSMNASOJ-VGWMRTNUSA-N	443.972	1.824	50	20	IDGD	
Cn1cc(C[C@H](NC(=O)OC(C)(C)C)C(=O)NCCSSCCC(=O)O)cn1	2088601297	AXHRUVPPWCYHBL-ZDUSSCGKSA-N	432.568	1.828	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)CN2C(=O)c3cccc([N+](=O)[O-])c3C2=O)c1	15879037	GCHDCMLWUFFISB-UHFFFAOYSA-N	426.385	1.034	50	20	IDGD	
O=C(CC[C@H]1CCCO1)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	106011950	MWEPTWCIJPXWCE-GOSISDBHSA-N	431.514	1.885	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Cc2ccc(S(N)(=O)=O)cc2)ccc1OCCC(C)C	110920897	HEINGESYIHLXKK-UHFFFAOYSA-N	449.529	1.771	50	20	IDGD	
CCCC(=O)N1CSC[C@H]1C(=O)NNC(=O)c1nn(CCC)c(=O)c2ccccc12	727297088	FRDWYCXBYBXQIX-HNNXBMFYSA-N	431.518	1.269	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCc2ccc(OCC#N)cc2)nc1	727942420	KBRDJOIZYRFJDB-UHFFFAOYSA-N	432.506	1.841	50	20	IDGD	
CC(C)(C)c1ccc(C(=O)N2CSC[C@H]2C(=O)NNC(=O)C(=O)N2CCCC2)cc1	728025516	JFIALUZDJFMAQX-INIZCTEOSA-N	432.546	1.269	50	20	IDGD	
COc1cccc(/C=C(/C#N)C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1	728320739	YMXQWFZXSNBQDN-XKSYAXFZSA-N	437.408	1.133	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)C2CCN(C(=O)N(C)C)CC2)c1	728528022	YCCDJOIBQNQALY-UHFFFAOYSA-N	427.299	1.612	50	20	IDGD	
COc1ccc(Cl)cc1CC(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	730031396	NDCOZDXSRAIZHZ-KRWDZBQOSA-N	434.832	1.422	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@H]2CCCN(C(=O)c3ccccc3)C2)c2ccccc2c1=O	731186464	PGOHDEMOZXJSFM-KRWDZBQOSA-N	447.495	1.730	50	20	IDGD	
CSCC[C@@H](NC(=O)c1ccc([N+](=O)[O-])o1)C(=O)NNC(=O)Cc1ccccc1F	731345143	BJFARUWONVSLRR-CYBMUJFWSA-N	438.437	1.569	50	20	IDGD	
COc1cc(CNC(=O)NNC(=O)c2ccccc2OC)ccc1OCC(=O)N(C)C	731499687	ZXCZCHHHERQLDE-UHFFFAOYSA-N	430.461	1.315	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)cc1S(N)(=O)=O	731679240	CDNILNLFYUROKR-UHFFFAOYSA-N	443.485	1.008	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)c1cc(S(=O)(=O)NC2CC2)c(Cl)cc1Cl	731851721	RGOXOQGOUUZKLC-UHFFFAOYSA-N	432.289	1.540	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN(C)C(=O)[C@@H](C)n2cccn2)cc1Br	732173822	HWBHGDRDBPWMES-LLVKDONJSA-N	438.282	1.135	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)N1CCC(C(=O)c2ccc3c(c2)NC(=O)[C@@H](C)O3)CC1	732199025	DIPAMEQVMGVDBX-LSDHHAIUSA-N	444.532	1.883	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)c1ccc(S(=O)(=O)NCc2ccco2)cc1	732303865	GAYBOLUJNFNXFS-UHFFFAOYSA-N	449.510	1.919	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)COc1ccc(Br)cc1F	734239886	YUJPJPCHIBOLEO-UHFFFAOYSA-N	449.277	1.822	50	20	IDGD	
CCCCN1C(=O)CC[C@@H](C(=O)NNC(=O)c2cnn(C)c2)[C@H]1c1ccc(OC)cc1	735446263	IRVKDCJLPBADMK-UYAOXDASSA-N	427.505	1.970	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)Cn2nnc(-c3ccc(C)cc3)n2)cc1C	736750882	JGUOLRXCPROJJC-UHFFFAOYSA-N	442.501	1.585	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)C[C@@H](NC(N)=O)c2ccccc2)cc1C	736755950	YABBDUJUIAZERU-CQSZACIVSA-N	432.502	1.723	50	20	IDGD	
CN(C)c1nccc(NNC(=O)c2ccc(S(=O)(=O)N(C)C)c(Br)c2)n1	740104197	FSSLJIIMIKHKMJ-UHFFFAOYSA-N	443.327	1.312	50	20	IDGD	
CC(C)CCn1cc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)nn1	740813742	SNBJKZUOUFTCRS-UHFFFAOYSA-N	434.522	1.184	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)c1ccccc1Cn1cncn1	742468359	GHFJCSXNHZLKKM-UHFFFAOYSA-N	433.516	1.300	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNS(=O)(=O)c2cccc(F)c2C)cc1	743249622	IVFLTUNXDITFST-UHFFFAOYSA-N	429.495	1.073	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)c2cccc(Br)c2)cc1C(=O)O	743263923	KYCPMJGZMFMBQF-UHFFFAOYSA-N	429.248	1.779	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)[C@@H]2SCCc3ccccc32)CC1	743417708	APCZPGKIMWPAHT-GOSISDBHSA-N	447.586	1.491	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)[C@@H]2CCCN2C(=O)Cc2ccccc2)cc1	744861974	LNYGJUSXMLZVBX-IBGZPJMESA-N	434.452	1.096	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)[C@@H](Cc2ccc(F)cc2)n2nnnc2C)c1	745017274	KTHPCCWMPULANR-GOSISDBHSA-N	440.435	1.217	50	20	IDGD	
CN(C)C(=O)c1cccc(CCNC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])c1	745846764	HTCXAIHSEZOLBT-UHFFFAOYSA-N	429.433	1.249	50	20	IDGD	
CN(CC(=O)NNC(=O)[C@H]1COc2ccccc2O1)c1ccc(C(F)(F)F)cc1C=O	746447133	RCEGLRRRIBUACB-QGZVFWFLSA-N	437.374	1.942	50	20	IDGD	
COc1ccc(-n2c(C)nnc2SCC(=O)N([C@@H]2CCS(=O)(=O)C2)N(C)C)cc1	746949617	MAJYSFQUHFAOQD-OAHLLOKOSA-N	439.563	1.169	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)NNC(=O)c1cccc2cccnc12	747461930	JUGSRRHRWONNCC-UHFFFAOYSA-N	431.412	1.415	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1ccc(C(N)=O)cc1)C(=O)NNc1ccccc1Br	748069045	WCHIYOBDDFINPK-SNVBAGLBSA-N	441.307	1.358	50	20	IDGD	
Cc1nc(S(=O)(=O)NCCC(=O)NNc2ccc(Br)cc2F)cn1C	748173331	GMEYVRWUXNSIOE-UHFFFAOYSA-N	434.291	1.442	50	20	IDGD	
O=C(CNC(=O)c1ccccc1I)NNC(=O)CC1CCCC1	749951450	UFDNEWFPVJJNOH-UHFFFAOYSA-N	429.258	1.749	50	20	IDGD	
Cc1cc(CC(=O)NN=C2C(=O)N(Cc3ncon3)c3ccc(Br)cc32)n[nH]1	750932336	HXEPLVTYPAEHKR-UHFFFAOYSA-N	444.249	1.473	50	20	IDGD	
CCOc1ccc(Br)cc1S(=O)(=O)NNC(=O)CNC(=O)c1ccco1	751281219	CBZIVAZKCHMZAO-UHFFFAOYSA-N	446.279	1.180	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)c1ccc(=O)n(-c2cccc(F)c2)c1	751382864	ZKUYNLKVTGTLLY-UHFFFAOYSA-N	433.440	1.445	50	20	IDGD	
CCOC(=O)[C@H]1Cc2cc(S(=O)(=O)NNC(=O)COCc3ccccc3)ccc2O1	751547159	JWJCAZBWDOFMRF-GOSISDBHSA-N	434.470	1.080	50	20	IDGD	
CCn1cc([C@H]2C[S@](=O)CCN2C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cn1	753134496	FQTHQNYTMDPEPJ-WTPASJBYSA-N	441.517	1.249	50	20	IDGD	
Cc1ccc(C(C)C)c2c1C(=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O)CCO2	753923505	IYZWGAIYRZOOLJ-UHFFFAOYSA-N	431.518	1.306	50	20	IDGD	
CCCC[C@@H](NC(=O)[C@H](C)NC(=O)C(C)(C)C)C(=O)NNC(=O)c1cccc(C#N)c1	755327153	PIVMRUTWWXCNNT-WMLDXEAASA-N	429.521	1.545	50	20	IDGD	
CCOC(=O)c1cc2cc(NC(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)ccc2s1	755862230	OTNWFHPXEUIPRX-SECBINFHSA-N	428.492	1.168	50	20	IDGD	
CC(C)(C)S(=O)(=O)N1CCC(NC(=O)NNC(=O)c2cccc(OC(F)F)c2)CC1	755899881	UYYAMRMWSWRKIG-UHFFFAOYSA-N	448.492	1.825	50	20	IDGD	
CC(C)(C)OC(=O)NCc1cccc(NC(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)c1	756526901	SFLBPXMXTXTJCS-CYBMUJFWSA-N	426.495	1.299	50	20	IDGD	
CNS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)cc1	756640991	RLGBEJZUGVMTNU-UHFFFAOYSA-N	432.437	1.590	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)c1cncc(I)c1	757004540	WQPAPZMYZIHNKS-UHFFFAOYSA-N	449.249	1.155	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)Nc1cc(Br)cn(C)c1=O	757589359	DLQANPUDYLDVKW-SECBINFHSA-N	427.230	1.907	50	20	IDGD	
CC(C)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCN(S(=O)(=O)CBr)CC1	758512328	LDTDJOPRJDCZED-LBPRGKRZSA-N	442.376	1.362	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCCc2ccc(Cl)nc2)cc1	761774767	PEFJEQZDNIDSQJ-UHFFFAOYSA-N	439.925	1.237	50	20	IDGD	
O=C(NCCOc1ncc(Cl)cc1Cl)NNC(=O)c1ccc(-n2cnnn2)cc1	761990723	FNXCRTRKCQRIDG-UHFFFAOYSA-N	437.247	1.387	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)[C@@H]3CS[C@@]4(C)CCC(=O)N34)n[nH]2)cc1OC	763149034	NTQQSCVFMNGMRV-XOBRGWDASA-N	445.501	1.309	50	20	IDGD	
Cc1cc(CC(=O)NN=Cc2ccc(OCCn3cc(C(=O)O)nn3)c(Cl)c2)n[nH]1	763150767	HIQZQQFPHKJLNR-UHFFFAOYSA-N	431.840	1.433	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1N1CCOCC1)c1cc(-c2cccs2)[nH]n1	763159324	WAVPBXUMQHGNMG-UHFFFAOYSA-N	442.457	1.958	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)CNS(=O)(=O)c3cccs3)n[nH]2)cc1	763166613	VMQLHNBWRUQWEZ-UHFFFAOYSA-N	433.515	1.440	50	20	IDGD	
CN(C(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccncc2)cc1)c1ccccc1	763464010	JZZGXNMZRFABGK-UHFFFAOYSA-N	431.452	1.687	50	20	IDGD	
CCS(=O)(=O)c1cc(F)ccc1NC(=O)C(=O)NNC(=O)c1c[nH]c2ccccc12	763535683	YPFWRNUMOQLFOJ-UHFFFAOYSA-N	432.433	1.500	50	20	IDGD	
COC(=O)[C@H](C)Cc1ccc(NC(=O)C(=O)NNC(=O)COc2cc(C)cc(C)c2)cc1	763648908	GZOPITSYXCHZNA-MRXNPFEDSA-N	441.484	1.820	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)COc2ccc(OCc3ccccc3)cc2)cnn1C	763680006	NQPIZRUSUQSNLR-UHFFFAOYSA-N	437.456	1.472	50	20	IDGD	
Cc1ccc2c(c1)N(C(=O)C(=O)NNC(=O)COc1ccc(Br)cc1)CC2	763695856	YPIZFHRLYZHUPR-UHFFFAOYSA-N	432.274	1.873	50	20	IDGD	
CCNC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)c1	763745991	NCTGLHVXAKHLTC-UHFFFAOYSA-N	438.488	1.367	50	20	IDGD	
C[S@@](=O)Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)ccc1Cl	763813278	JIZKESLSPJSCBT-SSEXGKCCSA-N	448.888	1.255	50	20	IDGD	
Cc1ccc(-c2nnco2)cc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccccc1F	763863780	CDZWZGKYZOIFQZ-LBPRGKRZSA-N	427.392	1.738	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccc(C(=O)NC(C)(C)C)cc1	763871547	HJNRDRPFMNEALG-ZDUSSCGKSA-N	444.463	1.907	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(C(C)=O)cc2)cc1	763872125	KMDCBBWYZIITBZ-ZDUSSCGKSA-N	427.413	1.229	50	20	IDGD	
CC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(C(C)=O)cc2)cc1C	763879592	ZELVAQDZPNSHTL-CQSZACIVSA-N	440.456	1.709	50	20	IDGD	
COC(=O)CCc1ccc(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)cc1	763996572	DMAZYLNKFBBOFJ-UHFFFAOYSA-N	437.250	1.283	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)Nc1ccc(N2CCCC2)nc1	764005344	ZCSNVXJLRMHWKL-UHFFFAOYSA-N	435.282	1.183	50	20	IDGD	
COc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NNC(=O)c1ccc(Cl)cc1OC	764011545	IKBWXGIEQBBWSX-UHFFFAOYSA-N	448.863	1.459	50	20	IDGD	
CC1(C)Cc2cc(NC(=O)C(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)ccc2O1	764077754	NBLKRWIXVNHSNG-UHFFFAOYSA-N	431.470	1.203	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc4c(c3)NC(=O)[C@@H](C)O4)n[nH]2)cc1	764112205	XZRVLELWHSWSIY-GFCCVEGCSA-N	448.439	1.504	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccc(NC(=O)c2ccccc2)nc1	764136957	WXDZRKBSLIORPX-UHFFFAOYSA-N	447.451	1.671	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)OCCCO3)o1	764139548	XPVNKOVRIUPALS-UHFFFAOYSA-N	430.461	1.682	50	20	IDGD	
CCN(CC)CCOc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)cc1	764170153	ZXOCVLVYWQDCOV-HXUWFJFHSA-N	440.500	1.497	50	20	IDGD	
CC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2cc(Br)ccc2O)c1	764279728	DNTPFIWJPDIDIY-UHFFFAOYSA-N	435.234	1.513	50	20	IDGD	
CC(C)(C)S(=O)(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)Cc2ccccc2F)c1	764320505	ZGEYBWJSBOPLTI-UHFFFAOYSA-N	449.504	1.868	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)C(=O)Nc1cc(F)c(S(C)(=O)=O)c(F)c1)c1ccccc1	764328968	IMDQGCDAVVQSIO-CYBMUJFWSA-N	439.440	1.648	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1ccc(Cn2cncn2)cc1	764393906	UIDUTNJGWYEHGU-UHFFFAOYSA-N	440.485	1.213	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1ccc2c(c1)OC(F)(F)O2	764398597	VCUGGNXUUMLSMQ-UHFFFAOYSA-N	439.396	1.895	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1F)C(=O)Nc1ccc(CCN2CCOCC2)cc1	764410612	KEFYVFKTPUFUGB-UHFFFAOYSA-N	448.882	1.754	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)C(=O)Nc2ccc(-c3nc(C)cs3)cc2)c1	764432661	IRHPFJBJHUAVOF-UHFFFAOYSA-N	438.469	1.872	50	20	IDGD	
C[C@H](NS(=O)(=O)c1ccc(C#N)cc1)C(=O)NNC(=O)Cc1c[nH]c2ccccc12	764554027	VHLRKOOVKFUHMZ-ZDUSSCGKSA-N	425.470	1.096	50	20	IDGD	
Cc1cc(I)cc(C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)c1C	764616723	QXHAWPUSBLGFQX-SNVBAGLBSA-N	436.271	1.104	50	20	IDGD	
C[C@H](C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)c1ccc(S(C)(=O)=O)cc1	765320579	QKQGSHUQDMDFJP-ZDUSSCGKSA-N	427.523	1.646	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cc1	765734917	FMDDOKJTKUNTOA-UHFFFAOYSA-N	426.542	1.693	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@H](C)Oc3ccc(C#N)cc3)CC2)cc1	765749646	ZUGSMBPTTJGWAS-IBGZPJMESA-N	435.528	1.599	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)c1	765755755	RUQNIAFQATWMPA-UHFFFAOYSA-N	426.517	1.591	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)c1ccc2nc(O)[nH]c2c1	766664360	PXDJKYCVOWSSOU-UHFFFAOYSA-N	442.907	1.501	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)N[C@H](Cc1ccccc1)CN1CCOCC1	766990734	NUIMOOGCKMIHRY-GOSISDBHSA-N	432.546	1.660	50	20	IDGD	
CN(c1cccc(Cl)c1)S(=O)(=O)c1cccc(C(=O)NNC(=O)C(C)(C)O)c1	768245678	DJRFCKWWCJSKSX-UHFFFAOYSA-N	425.894	1.697	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)Cc3csc4nccn34)n[nH]2)cc1OC	768278286	XKSFXRIAMOTWOV-UHFFFAOYSA-N	426.458	1.807	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@@H](C)C(=O)NNC(=O)c1ccc(S(N)(=O)=O)cn1	769738912	PHFVMNJHKOFRLJ-NSHDSACASA-N	426.882	1.228	50	20	IDGD	
CCc1c(C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)cnn1-c1ccc(OC)cc1	770553551	JGCMTSFWNNFJPO-UHFFFAOYSA-N	447.451	1.933	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)c3cc(N4CCCC4=O)cc(C(F)(F)F)c3)nc21	770975381	WBAMESOKJNDIOX-UHFFFAOYSA-N	435.366	1.971	50	20	IDGD	
CS(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)c2cccc3ncccc23)cc1F	771145012	SUPATNNNACXRGB-UHFFFAOYSA-N	438.462	1.369	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)[C@H](O)Cc2ccccc2Cl)c2ccccc2c1=O	771881384	HWGNOZWTZIXGHG-QGZVFWFLSA-N	428.876	1.825	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)CSCc1cc(=O)n2ccsc2n1	771921921	NJUAAYRIFWTBTM-LLVKDONJSA-N	426.520	1.114	50	20	IDGD	
CC(C)[C@H]1C[C@@H](NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)CCO1	772619764	NOYCYVVJVDTWEZ-FUHWJXTLSA-N	438.550	1.619	50	20	IDGD	
CC(C)c1nccnc1NNC(=O)Cc1ccc(S(=O)(=O)N2CCOCC2)s1	772868282	FNPKQANXRXFYJK-UHFFFAOYSA-N	425.536	1.368	50	20	IDGD	
O=C(COC(=O)c1cncnc1-c1ccccc1)NNC(=O)[C@H]1COc2ccccc2O1	773607179	MUVFCKMKODYXNX-GOSISDBHSA-N	434.408	1.288	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)c1ccc(C(N)=O)c(Cl)n1	774327326	OMEHXTAYOFPZLC-QMMMGPOBSA-N	441.669	1.825	50	20	IDGD	
C#C[C@@H](NC(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12)[C@H]1CCCO1	776230234	KFIVPSWFYKXZLG-WOJBJXKFSA-N	445.479	1.570	50	20	IDGD	
CCO[C@@H]1C[C@@H](NC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])[C@@H]1Oc1ccccc1	776534406	PNNQAHDAKBJVES-ZTNFWEORSA-N	444.444	1.929	50	20	IDGD	
N#C/C(=C\c1ccc(O)cc1)C(=O)N1CCN(S(=O)(=O)c2cccc([N+](=O)[O-])c2)CC1	776596297	IFQNHMVIDAGGKH-FOWTUZBSSA-N	442.453	1.740	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@H]2COC3(CCCCCC3)O2)c1	776960034	YIIOXWWOYNQATE-HNNXBMFYSA-N	425.507	1.500	50	20	IDGD	
CCOc1ccc(C(=O)CCC(=O)N2CCN(S(=O)(=O)CBr)CC2)cc1	777779823	SGRLGTBUWUEKHQ-UHFFFAOYSA-N	447.351	1.875	50	20	IDGD	
Cc1cc(N2C[C@@H](C(=O)NNC(=O)c3csc(N4CCOCC4)n3)CC2=O)ccc1F	779877945	SXVPPWZWCZDCSI-ZDUSSCGKSA-N	447.492	1.241	50	20	IDGD	
O=S(=O)(CCCCCl)N1CCN(S(=O)(=O)c2ccc(F)c(F)c2F)CC1	780669756	TYSQKECSFGNNSK-UHFFFAOYSA-N	434.889	1.759	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(Cl)c(C(=O)NNc2ccccc2C(=O)OC)c1	780730602	KNYAFKYSUXPEQI-UHFFFAOYSA-N	441.893	1.808	50	20	IDGD	
COCCO[C@H]1CCN(C(=O)NNC(=O)[C@H](C)Oc2cccc(Br)c2)C1	780951969	MHJQQVZUOUSJIX-WFASDCNBSA-N	430.299	1.695	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)ccc1F	782120926	MNJXUSRPQGAJEW-UHFFFAOYSA-N	441.419	1.525	50	20	IDGD	
COC(=O)[C@H](c1cccc(Cl)c1)N1CCN(S(=O)(=O)CBr)CC1	782473139	UXJAVKJSPULJJI-ZDUSSCGKSA-N	425.732	1.854	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNc2ccc(F)cc2F)cc1OC	783347820	ZLZFLCCCEWISDE-UHFFFAOYSA-N	428.417	1.817	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)(F)F)cc1)C(=O)Nc1ccn(CC(F)F)n1	783407566	DDCVSJJWBWJWLH-UHFFFAOYSA-N	441.338	1.524	50	20	IDGD	
C[C@@H]1CCC[C@@H](OCc2cccc(NC(=O)C(=O)NN[C@@]3(C)CCS(=O)(=O)C3)c2)C1	783426775	KFHXXZVIUVEUKF-FPDPHYFHSA-N	437.562	1.918	50	20	IDGD	
COC(=O)[C@@H]1CCCCN1C(=O)c1cccc(NC(=O)C(=O)NNc2cc(C)ncn2)c1	783945873	QNOFKBHLLRRIOU-INIZCTEOSA-N	440.460	1.035	50	20	IDGD	
CCNS(=O)(=O)c1ccc2c(c1)N(C(=O)C(=O)NNc1ccc(F)c(F)c1F)CC2	784813702	UMIAYNMLMMENDB-UHFFFAOYSA-N	442.419	1.435	50	20	IDGD	
O=C(NNc1cccnc1Cl)C(=O)Nc1ccc(N2CCN(C(=O)C3CC3)CC2)nc1	784848351	JDTRTCNDKHIXNU-UHFFFAOYSA-N	443.895	1.270	50	20	IDGD	
C=CCN(C)S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2cccc(C(=O)OC)c2)cc1	784852518	UTBYIEOUQUZZJK-UHFFFAOYSA-N	446.485	1.362	50	20	IDGD	
COc1ccc(S(=O)(=O)NC2CC2)cc1NC(=O)C(=O)NNc1cc(Cl)ccn1	784856397	HWHVMBGQPJWXDD-UHFFFAOYSA-N	439.881	1.266	50	20	IDGD	
N#Cc1ccc(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)cc1C(F)(F)F	785067803	OTOXIKPESSZAFE-UHFFFAOYSA-N	430.346	1.553	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2ccc(N3CCCS3(=O)=O)cc2)cc1Cl	785120213	MNSMDQZPXKZNFX-UHFFFAOYSA-N	438.893	1.970	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2cccc(CN3CCOC3=O)c2)n1	785227687	WVSRUISRTBRLFN-UHFFFAOYSA-N	427.465	1.357	50	20	IDGD	
Cc1ccc(C(=O)NCC2CC2)cc1NC(=O)C(=O)NNC(=O)c1ccc(Cl)nc1	785991538	SGHATRWDSMFRCN-UHFFFAOYSA-N	429.864	1.583	50	20	IDGD	
NC(=O)[C@H]1CCC[C@@H](C(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)C1	786688864	XLRLWHPOODVTHH-DLBZAZTESA-N	447.495	1.498	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)NCc3ccc(S(C)(=O)=O)s3)n[nH]2)cc1	786875689	LVSNRKDMNRZXSH-UHFFFAOYSA-N	433.515	1.994	50	20	IDGD	
CO[C@@H]1CCOc2c(NC(=O)C(=O)NNC(=O)c3cc(-c4ccccc4)[nH]n3)cccc21	790951761	LGEKCGJKBZSZOD-GOSISDBHSA-N	435.440	1.946	50	20	IDGD	
O=C(Cn1cc(NC(=O)C(=O)NNc2cccc(F)c2[N+](=O)[O-])cn1)NC1CCCC1	790998531	GLFMUFGCXPMAMC-UHFFFAOYSA-N	433.400	1.071	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)[C@](C)(O)Cn2cc(C(F)(F)F)ccc2=O)c1	792014748	MDWOVCKIAGSEJA-LJQANCHMSA-N	441.406	1.461	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)C(C)C)c(Br)cc1Br	792267431	GBVJUSPRRQSZPD-UHFFFAOYSA-N	437.088	1.962	50	20	IDGD	
Cc1ccc(C(=O)N2CCSCC2)cc1NC(=O)C(=O)NNc1nc2ccccn2n1	792391910	KXWPFNUAZRUCJN-UHFFFAOYSA-N	439.501	1.309	50	20	IDGD	
O=C(NNc1nc2ccccn2n1)C(=O)Nc1ccc(C(=O)NCc2ccccc2)cc1	792393251	ASQLGXXFTZFDLA-UHFFFAOYSA-N	429.440	1.741	50	20	IDGD	
O=C(NNS(=O)(=O)c1cccc(OC(F)(F)F)c1F)c1cc([N+](=O)[O-])ccc1O	793401230	PJWZLXRQSHRWBP-UHFFFAOYSA-N	439.299	1.961	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)C2CCN(c3ccc(C#N)cc3F)CC2)c1	795196885	SAXPAWCRWCAAJU-UHFFFAOYSA-N	444.488	1.778	50	20	IDGD	
COCCNC(=O)c1cccc(S(=O)(=O)NNC(=O)c2ccc3ccccc3n2)c1	795277408	JNGGVPIJYJQKOQ-UHFFFAOYSA-N	428.470	1.234	50	20	IDGD	
CCOC(=O)Cc1cccc(S(=O)(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)c1	795287303	VONQCPSYOGPNPW-UHFFFAOYSA-N	433.486	1.357	50	20	IDGD	
CNC(=O)c1cc(Cl)cc(S(=O)(=O)NNC(=O)c2ccc(C)cc2O)c1OC	795301151	WXQXNQCGZBUDAO-UHFFFAOYSA-N	427.866	1.346	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)N1CC=C(CCN2C(=O)c3ccccc3C2=O)CC1	796462419	CHKYQWBPCDMRMI-MRXNPFEDSA-N	426.517	1.887	50	20	IDGD	
O=C(CN[C@@H](CO)c1ccccc1OC(F)(F)F)NNC(=O)c1ccc([N+](=O)[O-])cc1	796524753	DQUVUAMPUDNSKS-AWEZNQCLSA-N	442.350	1.578	50	20	IDGD	
Cc1ccc(N2CCOCC2)cc1NC(=O)C(=O)NNC(=O)COc1ccc(Cl)cc1	797535897	QNAUJYJQFCTVFI-UHFFFAOYSA-N	446.891	1.650	50	20	IDGD	
Cc1ccccc1NC(=O)NNC(=O)[C@H]1CCCN1C(=O)/C=C\c1ccc(C(N)=O)cc1	798313728	SNASZHRISBHIJI-QTJNJRLBSA-N	435.484	1.951	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C1CCN(C(=O)[C@H](C)CSC)CC1	799295035	WKLNDLRMSDSXRO-OAHLLOKOSA-N	437.562	1.849	50	20	IDGD	
CCOc1cccc(S(=O)(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)c1	799914775	ZIMRFTUVYZSMMK-UHFFFAOYSA-N	433.895	1.009	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(S(=O)(=O)NNC(=O)c2cccc(Cl)c2)c1	800830787	HVKUFSWIRNGGBJ-UHFFFAOYSA-N	445.950	1.994	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)CN2C(=O)N[C@](C)(c3ccc(C)cc3)C2=O)cc1	802057279	PAVKQQLAWBFZJB-OAQYLSRUSA-N	425.445	1.624	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)CN(C)C(=O)c2ccc(Br)o2)cc1	802061983	BCXVZKSYIRRZQJ-UHFFFAOYSA-N	425.239	1.976	50	20	IDGD	
CC(C)(C)n1ccnc1SCC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	802066199	JEGIWJQBWJRBCS-UHFFFAOYSA-N	425.536	1.987	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2n[nH]c(C3CC3)c2Br)cc1	802066840	BGUOPMZZQKIOLX-UHFFFAOYSA-N	442.295	1.920	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)NS(=O)(=O)c2cnc3n2CCC3)c(C)n1C[C@@H]1CCCO1	802206981	PMZNAKKMZOAVAQ-BHEJFATLSA-N	443.529	1.839	50	20	IDGD	
O=C(NC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1)NNC(=O)c1ccc([N+](=O)[O-])cc1	802331484	NPHIGUPXEIDAES-INIZCTEOSA-N	425.401	1.667	50	20	IDGD	
CCCCCCOc1ccc(C(=O)NN=Cc2c(N(C)C)n(C)c(=O)n(C)c2=O)cc1	807951217	MKAHNHCDRNJMIT-UHFFFAOYSA-N	429.521	1.873	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCCC[C@@H]2COC(=O)NC2CC2)cc1OC	810038273	QRLQLOOHXHIJQY-MRXNPFEDSA-N	434.493	1.208	50	20	IDGD	
COCCC(COC)=NNC(=O)c1cc(S(=O)(=O)NCc2ccccc2)ccc1O	812224426	NBMYTLGAHGWURU-UHFFFAOYSA-N	435.502	1.639	50	20	IDGD	
Cn1cc(C(=O)NNS(=O)(=O)c2ccc3c(c2)NC(=O)CC(=O)N3)c2ccccc21	812555799	LGZMMLXZQBGDHW-UHFFFAOYSA-N	427.442	1.082	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccc(NC(=O)C3CC3)cc2)cc1	813034273	GGVKXNKGPKSEAI-UHFFFAOYSA-N	445.501	1.367	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)[C@H]2CCCN(c3ccccc3)C2=O)n1	814609200	ZKNTVVONKMGFON-HNNXBMFYSA-N	430.486	1.128	50	20	IDGD	
O=C(NNc1cccc(Cl)n1)C(=O)Nc1ccc(N2CCN(C(=O)C3CC3)CC2)nc1	815728164	UPDWYESOJCPTMA-UHFFFAOYSA-N	443.895	1.270	50	20	IDGD	
Cc1ccc(N2C[C@@H](C(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)CC2=O)cc1F	844256026	YYHCWFWOWQNPSV-ZDUSSCGKSA-N	437.431	1.195	50	20	IDGD	
CN(Cc1ccccc1)S(=O)(=O)c1ccc(Cl)c(C(=O)N2CC[C@@H](B(O)O)C2)c1	864234765	VQRQJELPQGNDAN-OAHLLOKOSA-N	436.726	1.850	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)CN1C(=O)NC2(CCC(CC)CC2)C1=O	871635467	POIUUNYQXLLVCR-UHFFFAOYSA-N	430.505	1.666	50	20	IDGD	
COCCNS(=O)(=O)c1cccc(C(=O)NNC(=O)COc2ccc(C)c(C)c2)c1	913055052	ANQGXIIKGBWOQF-UHFFFAOYSA-N	435.502	1.068	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CN2C(=O)[C@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2=O)ccc1OC(C)C	913154149	NUFMYGBPDHUHBC-BIPCEHGGSA-N	427.457	1.051	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)CCC(C)C)N(S(C)(=O)=O)CC2	913161836	YGGOALVDVBFILH-MRXNPFEDSA-N	441.550	1.536	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCCCN(C)c1ccccc1	913635942	JOQXXZAICIJSBP-UHFFFAOYSA-N	432.550	1.759	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN1C(=O)c1cc(Cl)cc(Cl)c1)[C@H]1CCS(=O)(=O)C1	914719753	PQVIXLPIFLOLOD-IINYFYTJSA-N	448.328	1.180	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)NC[C@@H]1CN(Cc2ccccc2)CCO1	915893865	CTFPLPFPCRDWPD-LJQANCHMSA-N	442.516	1.696	50	20	IDGD	
COc1cc2c(cc1OC)C(=NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)C(=O)N2	915944055	BFADUHHMWUKUIR-UHFFFAOYSA-N	432.458	1.040	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NCc2ccccc2CN2CCCC2)c2ccccc2c1=O	916221357	HORKFCDFDMSENJ-UHFFFAOYSA-N	434.500	1.674	50	20	IDGD	
NS(=O)(=O)c1cccc(CNC(=O)NNC(=O)CSc2ccc(Cl)cc2)c1	916625702	LSTGQCTWNJXZPD-UHFFFAOYSA-N	428.923	1.610	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2cc(C#N)c(SC)nc2O)c2ccccc2c1=O	916728516	YYKMFCJXLISUJB-UHFFFAOYSA-N	438.469	1.575	50	20	IDGD	
O=P(CCN1CCN([C@H]2CCS(=O)(=O)C2)CC1)(c1ccccc1)c1ccccc1	917056100	RBAIJSYHMWCFOJ-FQEVSTJZSA-N	432.526	1.805	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)nc1)c1ccc(S(=O)(=O)N=c2cc[nH]cc2)cc1	917252332	LEPLSEKEEIIPAG-UHFFFAOYSA-N	431.861	1.428	50	20	IDGD	
Cn1c(=NNC(=O)NCC(=O)N2CCN(C(=O)OC(C)(C)C)CC2)sc2ccccc21	918140192	RXTINXHSAIHTAP-UHFFFAOYSA-N	448.549	1.434	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)c2cccc(NC(=O)CSc3nncn3C)c2)c(O)c1	918337146	DIYZNDRLSYMZAP-UHFFFAOYSA-N	440.485	1.635	50	20	IDGD	
CCOc1ccc(/C=C(/C#N)C(=O)NCc2ccc(C(=O)N3CCNC(=O)C3)cc2)cc1	918608695	JXXLORUSAGUSGR-MOSHPQCFSA-N	432.480	1.881	50	20	IDGD	
COc1cc(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)cc(Cl)c1OCCC(C)C	919884328	HWNHANYYOPTCJL-CYBMUJFWSA-N	447.941	1.905	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)NCCNS(=O)(=O)Cc2ccccc2)cc1	919905962	NTVANAAYEQGGDY-UHFFFAOYSA-N	434.518	1.078	50	20	IDGD	
CCCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccc3c(c2)OCO3)c1	920823039	LDSGYVZIRIHEQG-UHFFFAOYSA-N	448.501	1.638	50	20	IDGD	
CCS(=O)(=O)Nc1cccc(C(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)c1	1115831692	JIBJMAZMGGGNPQ-UHFFFAOYSA-N	439.877	1.720	50	20	IDGD	
Cc1ccc(N2C(=O)/C(=C/NNC(=O)CCN3CCOCC3)c3ccccc3C2=O)cc1	1317700759	SNHQMAYBGXDVCN-LTGZKZEYSA-N	434.496	1.866	50	20	IDGD	
CC[C@@]1(C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)CCN(C(=O)OC(C)(C)C)C1	1319982147	PZZWHJAIKHTOPX-HXUWFJFHSA-N	439.534	1.888	50	20	IDGD	
Cc1nn2cc(CC(=O)N3CC[C@H]4OCCC[C@@]4(CNC(=O)[C@@H](F)Cl)C3)nc2s1	1778023171	XWCLKLYXSTVPLZ-DDUZABMNSA-N	443.932	1.690	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc4cnccc4nc3C)C2)C1	1778441483	RRSQDNRQTMPWJF-LAUBAEHRSA-N	432.908	1.636	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cc(-c3ccccn3)[nH]n1)CCO2	1779298274	IOPSSVNCPZUIFR-NRFANRHFSA-N	443.580	1.767	50	20	IDGD	
COc1c(Cl)ccnc1C(=O)N1CC[C@]2(CN(C(=O)CCBr)CCO2)C1	1780326311	MAZSWJMQXAYXJD-KRWDZBQOSA-N	446.729	1.972	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc4nonc4c3)CCO2)C1	1781229314	GHDWJLGBKIXILX-ROUUACIJSA-N	427.288	1.903	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)c3cnc4[nH]ncc4c3)CCO2)C1	1781229618	GOVFTZFLBDQUHJ-ROUUACIJSA-N	426.304	1.638	50	20	IDGD	
COc1c(C)cc(C(=O)N2CC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)cc1C	1781876464	OKFPQOLENXGESU-HSZRJFAPSA-N	446.548	1.129	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnc3[nH]ncc3c1)C2)C(Cl)Cl	1782217967	FHBUALMDUCZYHN-FZKQIMNGSA-N	426.304	1.889	50	20	IDGD	
O=C(c1n[nH]c2cccc(F)c12)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1782486445	SKOOCZLJRPWWHZ-YOEHRIQHSA-N	443.248	1.836	50	20	IDGD	
CCC[C@H](NC(C)=O)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](Br)CC)C2)C1	1783351811	BHYZNOIAIVQWIG-MPGHIAIKSA-N	432.359	1.295	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](C)n1cccc1C=O)CCO2	1783532821	NPOKAVXKNIJADF-SUNYJGFJSA-N	426.311	1.475	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](C)NC(=O)OC(C)(C)C)C2)C1	1783711872	BCJMJVZBSUCVJJ-SNUQEOBHSA-N	448.358	1.513	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3c(C)cc(C(N)=O)cc3C)CCO2)C1	1783877696	NMRGVQOBHAGIPL-HRAATJIYSA-N	437.924	1.100	50	20	IDGD	
C[C@H](Cc1ccccc1)C(=O)N1CCO[C@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1	1783938497	ZRKYGKMMBGSOMR-JPYJTQIMSA-N	430.549	1.068	50	20	IDGD	
Cc1cccc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)CBr)C[C@@H]32)n1	1784220788	BZWIDBNVKHRXGJ-KCMWZYNZSA-N	438.366	1.943	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)COc3cccnc3)[C@H]2C1	1785146605	FQOQCXQGXYNGHY-FJXLLPKBSA-N	430.332	1.676	50	20	IDGD	
COc1ccc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Br)C[C@@H]32)cc1	1786547490	ZPPUJPQFOLPJNF-OWIUFQIYSA-N	443.313	1.908	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3nc[nH]n3)[C@H]2C1	1787224611	HOSBOBUQQLTPKX-MJKMTRRRSA-N	442.426	1.283	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3noc4c3CCCC4)[C@H]2C1	1787305730	DPKOMDAOBXBNAE-FAYQHZLMSA-N	425.913	1.401	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(-n4cncn4)c3)C[C@@H]21	1789865592	YOUMRBOQQKBIFX-WNHJNPCNSA-N	431.924	1.878	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccnc(Cl)n3)C[C@@H]21)[C@@H](F)Br	1789924444	DLBDQMKXALAUPM-FSZOTQKASA-N	435.681	1.414	50	20	IDGD	
Cc1cnn([C@H](C)C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]3C2)c1	1789926983	MXXWUJGMHHUDBO-QTVXIADOSA-N	431.306	1.423	50	20	IDGD	
C[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Cl)C[C@@H]21)[S@@](=O)c1ccccc1	1790595335	HSUBNWKHXVGRNW-LQELTKFPSA-N	430.929	1.697	50	20	IDGD	
Cc1cnc2c(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]4C3)cnn2c1	1791294793	LLAKJXHILOZVIG-UBHSHLNASA-N	426.304	1.435	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1ccc(C2(NC(=O)[C@@H](N)CCC(N)=O)CCC2)cc1	1791360401	FRYBECPOFFAGMS-GJZGRUSLSA-N	439.354	1.887	50	20	IDGD	
C[C@H](Cc1ccccn1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21	1791492305	OWQDYNHDPCOBHO-ZAZJUGBXSA-N	442.329	1.930	50	20	IDGD	
C[C@H](NNc1ccccc1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCC(=O)NN(C)C)C2	1792589967	XASQTEWVKITIPP-KANFNMMFSA-N	430.553	1.003	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(N(C)C)nc1)C2	1792872369	BKERQCWFGPOGIH-FAYQHZLMSA-N	439.354	1.382	50	20	IDGD	
Cc1c[nH]c(C)c1CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Br)C2	1793103037	YZHZCWAWDKGIIM-LJGDNWOOSA-N	426.355	1.937	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1nc2ccccn2n1	1796102703	YYLXMVDCTTXPPU-JPVZDGGYSA-N	426.304	1.169	50	20	IDGD	
Cc1ccc(COCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CCC(=O)NN(C)C)C3)cc1C	1796922399	QGCDNDOPMMFWQL-WKCHPHFGSA-N	444.576	1.831	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CN(Cc2ccccc2)CCO1	1797248134	JFEGVRHOLBUUED-VIYGXFRKSA-N	449.979	1.494	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1CCN(S(C)(=O)=O)CC1	1797705347	SGJCOFJWYJVWGT-YVSFHVDLSA-N	434.002	1.704	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CO[Si](C)(C)C)C1	1797956793	ZMASIIWLSVKXMX-KMOPNRPKSA-N	440.613	1.407	50	20	IDGD	
Cc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Br)C3)nn1C(F)F	1798676755	LSYCLKXQGKOZCZ-QCMRWSPLSA-N	439.232	1.480	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](NC(C)=O)c1ccc(F)cc1)C2	1799269373	YGZIKAGCAHZKKB-CGHHPOIWSA-N	439.915	1.610	50	20	IDGD	
Cc1cnc2c(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@H](C)Br)cnn2c1	1800759329	LRWJFLGWUSOREW-XPCVCDNBSA-N	436.310	1.024	50	20	IDGD	
Cc1ncc(/C=C/C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)Br)s1	1800763291	VUBYWPYPBWDBFM-WXDAGQQPSA-N	428.352	1.838	50	20	IDGD	
COc1cncc(CCC(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)c1	1803141386	NLHDBLUOGOPXLL-QFUCXCTJSA-N	446.935	1.724	50	20	IDGD	
COc1cc(F)ccc1CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(B(O)O)cc1)C2	1804510434	HHNMJXYAOKJXEO-ACDBMABISA-N	440.280	1.009	50	20	IDGD	
O=C([C@H](O)CCl)N1CCCC2(CCN(C(=O)[C@@H]3C[C@@]34C(=O)Nc3ccccc34)CC2)C1	1805526339	RBRNKWJOJDHOLV-XAEMIUIASA-N	445.947	1.727	50	20	IDGD	
Cc1nc(CC(=O)N2CCCC3(CCN(C(=O)c4ccc(B(O)O)cc4)CC3)C2)cs1	1807040559	DPQUKSYDKSFNBF-UHFFFAOYSA-N	441.362	1.219	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)Cc2ccccc2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1	1807371470	VLYGAKIGGCCTIZ-URXFXBBRSA-N	443.312	1.324	50	20	IDGD	
O=C(Cn1cc(Cl)cn1)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1	1807404125	SBFOVUURIQKHKV-QRTARXTBSA-N	426.304	1.237	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)CN2CCN(C(C)=O)CC2)[C@@H]1c1cccnc1	1808264730	BXIUZXIOTQGMEG-IRFCIJBXSA-N	449.983	1.269	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H](CNC(=O)c2cc(O)nc(O)n2)[C@H]1c1cccnc1	1808304115	USBAPAVSBAJSKG-RDTXWAMCSA-N	445.552	1.454	50	20	IDGD	
Cc1ccc(=O)n(C(C)(C)C(=O)NC[C@@H]2CCN(C(=O)[C@@H](F)Cl)[C@H]2c2cccnc2)n1	1810492568	YMOQDEQWYPBHPQ-RYQLBKOJSA-N	449.914	1.922	50	20	IDGD	
CCC(=O)N[C@H](C)C(=O)N1CC[C@H](CNC(=O)CO[Si](C)(C)C)[C@@H]1c1cccnc1	1810537392	FFOQZWKKDWAUKV-MDYRTPRTSA-N	434.613	1.854	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2nc(C)c(C)[nH]c2=O)[C@@H]1c1cccnc1	1813028297	NYDZHEIJWAMGCM-SOLBZPMBSA-N	447.923	1.355	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)CCN2CCOC2=O)[C@@H]1c1cccnc1	1813029955	CDRRTIDSBDANDD-XYJFISCASA-N	438.912	1.184	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2ccnc3c2OCO3)[C@@H]1c1cccnc1	1813031338	LUUDEGXCIUZGDK-BHYGNILZSA-N	446.891	1.779	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)[C@@H]2C[C@@]2(F)Cl)[C@H]1c1cccnc1	1813074004	NPWDPLQJKRYXOL-OFVDUGFESA-N	439.919	1.385	50	20	IDGD	
CC(C)(CCl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(=O)n3[nH]nnc3n2)[nH]n1	1814693892	IJVBROYGJCVAJO-GFCCVEGCSA-N	447.887	1.107	50	20	IDGD	
CC(C)(CCl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2nccnc2C(N)=O)[nH]n1	1814697410	DYLVUXLGSPJLRY-GFCCVEGCSA-N	433.900	1.870	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](F)Cl)CC2)c1n[nH]c2c1CS(=O)(=O)C2	1815851689	UWIQMZXMPCQUGF-SREIQFSDSA-N	447.901	1.055	50	20	IDGD	
O=C(CNC(=O)c1cccs1)Nc1cc([C@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1	1815919721	FWTISOWSNBNPHX-CHWSQXEVSA-N	439.925	1.493	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)CC(F)(F)C(=O)O)sc2C1	1817095577	JLNQYFKLFJYBIZ-YUMQZZPRSA-N	425.841	1.419	50	20	IDGD	
C[C@@]1(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cnccc3C(=O)NN)n[nH]2)CC1(F)F	1819404320	GVJMPUMGHHNMAN-LIRRHRJNSA-N	447.446	1.759	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1)c1ccc(-n2cccn2)nc1	1819882176	RCFGARVOLLKNHJ-CVEARBPZSA-N	443.895	1.896	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)CNC(=O)c3cc(C)on3)sc2C1	1819931265	RWDQFINAFSGZST-MNOVXSKESA-N	439.925	1.799	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)CCN2CCOC2=O)[nH]n1)[C@@H](F)Br	1820933105	AEKJAUWGSHMGJV-SMDDNHRTSA-N	446.277	1.935	50	20	IDGD	
CC(C)(CCl)C(=O)N[C@H]1CCc2nc(NC(=O)c3nccnc3C(N)=O)sc2C1	1821033464	WQYNFVOIXPBFIA-VIFPVBQESA-N	436.925	1.523	50	20	IDGD	
CCOC(=O)C1(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)CC1	1821805816	SWIKBPXSIVGYBB-HNNXBMFYSA-N	448.524	1.118	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](C)Br)n[nH]1	1822189038	NAOANJWWIHQRND-WZRBSPASSA-N	443.346	1.893	50	20	IDGD	
Cc1cccc(CC(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)n1	1824282475	JMGXXZQGYMBLAA-QHCPKHFHSA-N	449.360	1.546	50	20	IDGD	
Cc1nccn1[C@@H](C)C(=O)N[C@@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1	1826091800	DFRZBGAYEGOHAV-GXTWGEPZSA-N	447.565	1.194	50	20	IDGD	
O=C([C@H]1CCCSC1)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827059386	AAVJETXDNIPUAD-FPOVZHCZSA-N	444.406	1.743	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)CCc2cncnc2)CC1	1827135096	PZDGHXHSQORGEY-FQEVSTJZSA-N	444.580	1.402	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnc(O)nc2O)CC1	1827592920	YACMGIWJCLCGCY-LSDHHAIUSA-N	426.901	1.375	50	20	IDGD	
Cc1cn(CC(=O)N2CCC([C@H]3CCCCN3C(=O)[C@@H](F)Cl)CC2)c(=O)nc1O	1827615217	DAALDCGCJKXADC-GDBMZVCRSA-N	428.892	1.411	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cn4cccnc4n3)C2)C1	1830362300	QSSUFQQYIBXZQN-FQEVSTJZSA-N	435.912	1.064	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)Cc3ccccc3)C2)C1	1830366240	LRPCZNDEQLDCTH-GCJKJVERSA-N	438.952	1.311	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)/C=C/c3ccco3)C2)C1	1830536148	YVQHENGLMMMDDX-LTGPNDRFSA-N	441.322	1.780	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C1(c3ccc(O)cc3)CC1)CCO2	1830811748	XFZVBTGBJJXHCT-GHTZIAJQSA-N	436.936	1.898	50	20	IDGD	
CCC1(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)COC1	1831274877	HIVROYYPLAWJCY-HXUWFJFHSA-N	428.338	1.026	50	20	IDGD	
O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)CSC1CCCC1)CCO2	1831357182	IPMWMSCPYWLQHT-GOSISDBHSA-N	449.411	1.904	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CCc2nc(N)n[nH]2)CC1	1831655267	MZZCBIKQPNVIDE-JSGCOSHPSA-N	441.374	1.723	50	20	IDGD	
C=CCNC(=O)/C=C\C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H](Cl)COC)CC1	1831827449	YFFSDGWDWJCBAI-JKCVZHOFSA-N	425.957	1.718	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)C(=O)c2ccccc2)CC1	1831872471	ZAAFBMUVLPDCAE-FQEVSTJZSA-N	442.560	1.862	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3ccnc(C)c3)CCO2)C1	1832627513	LGTPLIWUEODSPS-WIYYLYMNSA-N	439.940	1.033	50	20	IDGD	
CN(C)c1cncc(C(=O)N2CCO[C@@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)c1	1833365859	ITYQZASWCCFHOA-SFHVURJKSA-N	431.320	1.021	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnn(-c4cccnc4)c3)CCO2)C1	1833621451	IUTZXDGYRTUUMY-RXVVDRJESA-N	447.923	1.355	50	20	IDGD	
CCc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)cn1	1833895331	VNSITFOFWOSBSM-NRFANRHFSA-N	435.597	1.566	50	20	IDGD	
Cc1cc(C(=O)NC2CCN(C3CCN(C(=O)[C@H](C)Br)CC3)CC2)n(C)n1	1834189853	JCMXCVDQWXRLGZ-AWEZNQCLSA-N	440.386	1.697	50	20	IDGD	
CCc1oncc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1	1834521003	RTONUGOCTFZFKW-QZTJIDSGSA-N	434.320	1.543	50	20	IDGD	
C[C@@H](C(=O)NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)n1cccc1C=O	1834805607	QIPXUXNEYWJBMV-HNAYVOBHSA-N	438.956	1.033	50	20	IDGD	
COC1(CC(=O)N2CCOC[C@@]3(CN(C(=O)CCBr)CCO3)C2)CCC1	1834826094	BBKJVANQGYZUDE-GOSISDBHSA-N	433.343	1.187	50	20	IDGD	
Cc1nn[nH]c1C(=O)NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1	1834931155	PUUDQFQRZIHLTL-UHFFFAOYSA-N	427.347	1.083	50	20	IDGD	
CNC(=S)NCCC(=O)N1CCC(OC2CCN(C(=O)C(C)(C)CCl)CC2)CC1	1836623704	HWELQAISHLQPHG-UHFFFAOYSA-N	447.045	1.734	50	20	IDGD	
O=C(c1c[nH]c2ncccc12)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836717738	IHYVAFDYKNLREU-GOSISDBHSA-N	434.924	1.775	50	20	IDGD	
C[C@@H](Cc1ccncc1)C(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836718752	CPNBXKBQADVUBI-OXJNMPFZSA-N	437.968	1.859	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)/C=C3\C(=O)Nc4ccccc43)CCO2)C1	1837325587	WYHYKXYFXINCES-VCLZSNQESA-N	447.919	1.496	50	20	IDGD	
CC(C)c1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)on1	1838778617	AEVYQYHXJZFOHU-SCLBCKFNSA-N	444.326	1.651	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3c(C)ccn3C)CCO2)C1	1838822382	KVIDEZJFHUTGBP-BEFAXECRSA-N	442.354	1.577	50	20	IDGD	
O=C(/C=C/C1CCCC1)N1CCO[C@@]2(COCCN(C(=O)CCBr)C2)C1	1839178244	QYWKRLWMLQJLJT-ZMBJWTFHSA-N	429.355	1.974	50	20	IDGD	
O=C(c1cccc(-c2cnco2)c1)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1	1839365034	WMPFNBYKSRAIIO-LAUBAEHRSA-N	449.891	1.011	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCCCCC(=O)OC)CCO2)C1	1840236831	XBZYMYQHZQEECJ-UZLBHIALSA-N	432.945	1.584	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)C1Cc3ccccc3C1)CCO2	1840943690	QROQYPKFEZTPQQ-HSZRJFAPSA-N	446.620	1.709	50	20	IDGD	
O=C(Cc1ccc(Br)cc1F)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1	1841353730	LUTOAGRZAHMVMS-AWEZNQCLSA-N	433.705	1.934	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC2(CCCN2C(=O)c2cccnc2CS(C)(=O)=O)C1	1842241209	XARKXEJVLAOXRG-KRWDZBQOSA-N	448.372	1.680	50	20	IDGD	
Cc1noc(-c2ccccc2)c1C(=O)N1CCCC12CN(C(=O)c1ccc(B(O)O)cc1)C2	1843439434	LWRWIPKTIFKJCK-UHFFFAOYSA-N	445.284	1.461	50	20	IDGD	
COc1ccc2oc(C(=O)N3CCCC34CN(C(=O)c3cccc(B(O)O)c3)C4)cc2c1	1844018475	NOVHXDVHKDVWHU-UHFFFAOYSA-N	434.257	1.252	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1cc(F)c(F)c(Cl)c1)C2	1844265501	JLTPTBPFOPVOCT-UHFFFAOYSA-N	449.845	1.748	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)C[C@@H](NC(=O)OC(C)(C)C)C(=O)OC)C2	1845167688	PBIQAEIPZDFQGG-ZIAGYGMSSA-N	445.944	1.664	50	20	IDGD	
CC[C@H](NC(C)=O)C(=O)N1CC2(CCCN2C(=O)/C(C#N)=C/c2ccc(F)cc2F)C1	1845870263	XNOGGVNRSADCMO-HVRVZBDQSA-N	430.455	1.990	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@]13C[C@H]1CCN3C(=O)OC(C)(C)C)C2	1846364808	KQACJYZDYRZPED-LRAJWGHMSA-N	441.956	1.843	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)c3cccs3)CC2)cc1C	15408909	QQPLPGLWAFLKMR-UHFFFAOYSA-N	436.559	1.132	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)c3ccccc3)c2)n1	15462652	MVDBUKAEYWCFMH-UHFFFAOYSA-N	441.513	1.786	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)CCN2C(=O)NC3(CCCC3)C2=O)cc1	18071397	MNJUPUXWYKHDHO-AWEZNQCLSA-N	432.477	1.255	50	20	IDGD	
Cc1nc2c(C(N)=O)cnn2c(C)c1CCC(=O)NNC(=O)c1cc(Cl)ccc1O	108061489	GCRVQTONXVTTHI-UHFFFAOYSA-N	430.852	1.198	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CCN2C(=O)[C@H]3CCCC[C@@H]3C2=O)cc(OC)c1OC	197983275	ZNVWRQACVLSRBA-KBPBESRZSA-N	433.461	1.039	50	20	IDGD	
C[C@H](COc1ccccc1C(F)(F)F)NC(=O)NNC(=O)CNC(=O)c1ccco1	726237100	IFJFLHOXZYLAGU-LLVKDONJSA-N	428.367	1.826	50	20	IDGD	
O=C(NN=Cc1cc(F)c(F)c(F)c1)c1cccc(S(=O)(=O)N2CCOCC2)c1	727969318	CVCXWJHPXXMLHZ-UHFFFAOYSA-N	427.404	1.889	50	20	IDGD	
Cc1noc(C)c1S(=O)(=O)N1CCC(C(=O)NNc2nc(-c3ccccc3)no2)CC1	728080373	FQPPAQOKLZSLNJ-UHFFFAOYSA-N	446.489	1.885	50	20	IDGD	
CC(=O)Nc1cc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)ccc1C	728327463	AXAIPKWXWRVPSG-GOSISDBHSA-N	427.413	1.098	50	20	IDGD	
C=CCn1c(=O)c2ccccc2n2c(SCC(=O)NNC(=O)CC(C)(C)C)nnc12	728608435	ZCIDQERYSMJXQH-UHFFFAOYSA-N	428.518	1.906	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NC[C@@H]2CN3CCC[C@H]3CO2)ccc1OCCC(C)C	729619392	PPMKKGPNZLLPJX-ZWKOTPCHSA-N	434.537	1.927	50	20	IDGD	
COc1ccc(-c2nnc(S)n2CC(=O)NNC(=O)CCc2ccccc2O)cc1	730034160	XFHPECAIOHGXNV-UHFFFAOYSA-N	427.486	1.728	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2cc(C(=O)O)cs2)cc1Br	732048559	OBTNUVMLZWXUNT-UHFFFAOYSA-N	435.277	1.841	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2c[nH]nc2C)cc1S(=O)(=O)Cc1cc(C)no1	732082307	FEMLLGBUPHAVPS-UHFFFAOYSA-N	433.446	1.072	50	20	IDGD	
Cc1cc(C)n(-c2ccc(C(=O)NNC(=O)c3csc(N4CCOCC4)n3)cc2F)n1	732654096	UGVAUPPZAWTGBO-UHFFFAOYSA-N	444.492	1.996	50	20	IDGD	
CCCC[C@H](NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)C(=O)Nc1cc(C)on1	732917716	FSLJMAOTOJQZFL-INIZCTEOSA-N	437.522	1.665	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1Cl)C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	733124059	QATSBAYAUCBGMA-LLVKDONJSA-N	443.884	1.958	50	20	IDGD	
CCc1ccc(N2C[C@@H](C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)CC2=O)cc1	734241379	CSQONRSUOPKLIF-HNNXBMFYSA-N	433.509	1.457	50	20	IDGD	
CC(=O)N1CCN(S(=O)(=O)c2ccc(C(=O)NNc3ncccc3Cl)cc2)CC1	734245926	DRRNHCOMEBKXGO-UHFFFAOYSA-N	437.909	1.345	50	20	IDGD	
Cc1[nH]c2ccnn2c(=O)c1CC(=O)NNc1cc(C(F)(F)F)nc(-c2cccnc2)n1	734257384	UUUILHUCNYWCSL-UHFFFAOYSA-N	444.377	1.888	50	20	IDGD	
Cc1cc(N(C)C)ccc1CNC(=O)NNC(=O)c1sc(N2CCOCC2)nc1C	734517979	WCMVXLSBLTVJRQ-UHFFFAOYSA-N	432.550	1.807	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2ccc(-c3cnco3)cc2)CC1	735117026	LPYLQMQGELSXII-UHFFFAOYSA-N	442.501	1.430	50	20	IDGD	
Cc1[nH]c2ccc(C(=O)NNc3ncccc3S(=O)(=O)N3CCN(C)CC3)cc2c1C	735117374	TVXKTULUZDFJTK-UHFFFAOYSA-N	442.545	1.873	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)CC1(N2CCOCC2)CCCC1	735989910	CMDNQSSFRQOCKF-UHFFFAOYSA-N	443.592	1.381	50	20	IDGD	
CC(C)(C)OC(=O)NC1CCC(NC(=O)NNC(=O)[C@H]2COc3ccccc3O2)CC1	740071171	XGJQCVYGOGKWCR-MQBCKMQZSA-N	434.493	1.993	50	20	IDGD	
CN(C)c1nccc(NNC(=O)C2=NN(c3ccccc3)[C@H](C(=O)OC(C)(C)C)C2)n1	740112854	RFKNCVFRPXNGKI-INIZCTEOSA-N	425.493	1.962	50	20	IDGD	
C[C@H](CC(=O)c1cccc(Br)c1)C(=O)NNC(=O)CNC(=O)c1ccco1	741685145	PVLFVRMIRQMUJV-LLVKDONJSA-N	436.262	1.828	50	20	IDGD	
CC(=NNC(=O)c1ccc(-n2cnnn2)cc1)c1ccc(S(=O)(=O)CC(F)F)cc1	741757251	PQHVXFLHPNYWMX-UHFFFAOYSA-N	434.428	1.855	50	20	IDGD	
CCC(CC)[C@H](C(=O)NNC(=O)c1nn(CC)c(=O)c2ccccc12)N1CCOCC1	742034029	IZLZZBVKCFHGCI-LJQANCHMSA-N	429.521	1.314	50	20	IDGD	
O=C(O)c1cc(C(=O)O)cc(S(=O)(=O)NNC(=O)c2cccc(Br)c2)c1	743264506	WJYCDRRUIZVRTK-UHFFFAOYSA-N	443.231	1.469	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CN2CCN(Cc3nc(-c4ccccc4)no3)CC2)c1	744386953	IWHAGSKKFUOJSI-UHFFFAOYSA-N	434.500	1.624	50	20	IDGD	
CC(=NNC(=O)C(=O)NN=C(C)c1nc2ccccc2n1C)c1nc2ccccc2n1C	744566514	HJPRVCBVHZPLAX-UHFFFAOYSA-N	430.472	1.841	50	20	IDGD	
C[C@H](CC(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1)NC(=O)c1ccccc1	744621951	KAQYTRWITBVSCN-MRXNPFEDSA-N	446.529	1.359	50	20	IDGD	
CN(C)c1ccc(C(=O)c2ccccc2C(=O)NNC(=O)[C@H]2COCCO2)cc1[N+](=O)[O-]	744651560	XOEQWAHHUPRXHN-GOSISDBHSA-N	442.428	1.068	50	20	IDGD	
CC(=O)N[C@@H](CC(=O)OCC(=O)NNC(=O)c1cccc(C#N)c1)c1ccc(F)cc1F	745141718	PIWMEUFJJDHNBM-SFHVURJKSA-N	444.394	1.408	50	20	IDGD	
Cn1ccc(N2CCC[C@@H](NC(=O)NNC(=O)CC34CC5CC(CC(C5)C3)C4)C2=O)n1	745884580	YRPLNGBUMDBQOY-GOWZHPGHSA-N	428.537	1.852	50	20	IDGD	
CC(C)CO[C@H](C)c1noc(CN(C)C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)n1	745998301	IYVGJSBCCXGOCI-CYBMUJFWSA-N	443.468	1.265	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CN(Cc2nc(O)c3ccccc3n2)CCO1)c1cccc(Cl)c1	746095507	SDRORSSKJXXPFF-KRWDZBQOSA-N	441.875	1.651	50	20	IDGD	
CSCC[C@@H](C(=O)NNC(=O)c1cccc(N(C)C)c1)N1C(=O)[C@H]2CCCC[C@H]2C1=O	746102675	GFHJVWFWRMBNNN-KSZLIROESA-N	446.573	1.811	50	20	IDGD	
O=C(C[C@H]1C=CS(=O)(=O)C1)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1	747786971	GMLVGCYJEHMZJL-NQIIRXRSSA-N	439.537	1.709	50	20	IDGD	
CCn1cc(CC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)c2ccccc21	748214906	YTAIUOWOYISSKR-UHFFFAOYSA-N	442.541	1.980	50	20	IDGD	
CCN(c1ccccc1)S(=O)(=O)c1ccc(C(=O)NNC(=O)C(=O)N2CCCC2)cc1	748247281	XABKEIIHGZJEIL-UHFFFAOYSA-N	444.513	1.285	50	20	IDGD	
CCCc1nnc(S)n1CC(=O)NNC(=O)COc1ccc(Br)cc1	751199478	BBEXTFXHIOACHA-UHFFFAOYSA-N	428.312	1.508	50	20	IDGD	
COc1cc(OC)cc(N2C[C@@H](C(=O)NNc3nc4ccccc4c(=O)n3C)CC2=O)c1	752627675	QDBMSGOEMFSWOV-ZDUSSCGKSA-N	437.456	1.447	50	20	IDGD	
C[C@@H]1C[C@H](CCNC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)CN1Cc1ccccc1	752996897	HVTKUWADHPRIIV-MJGOQNOKSA-N	448.531	1.907	50	20	IDGD	
CCOc1ccccc1C(F)(F)C(=O)NNC(=O)c1csc(N2CCOCC2)n1	753391190	DBQKCHQMNUXJTK-UHFFFAOYSA-N	426.445	1.931	50	20	IDGD	
C[C@H]1CCCN(S(=O)(=O)c2cc(C(=O)NNc3cc(Cl)nc(N)n3)n(C)c2)C1	753455707	XXGGWQQGSITGCS-JTQLQIEISA-N	427.918	1.228	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNS(=O)(=O)c2cc(C(=O)OC)oc2C)cc1	754744732	LTUIEWNHLRAWHP-LBPRGKRZSA-N	426.447	1.550	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)[C@@](C)(O)CN3Cc4ccccc4C3=O)n[nH]2)cc1	756811826	FCXKXRQFGZAYPS-QHCPKHFHSA-N	433.468	1.553	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)Nc1ccc2c(c1)COC2	757854313	ZQDTXSHHKNNEBO-UHFFFAOYSA-N	446.485	1.204	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1[N+](=O)[O-]	757993543	MYEHFNONQISMIY-UHFFFAOYSA-N	442.476	1.968	50	20	IDGD	
COc1ccc(CC(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)cc1OC	758782626	UOWHMEZYIUWRIB-UHFFFAOYSA-N	436.509	1.882	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)CNS(=O)(=O)c2ccc(Br)s2)nc1	759730845	NCATVPCTOPCWFH-UHFFFAOYSA-N	449.308	1.114	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)CCS(=O)(=O)c2ccc3c(c2)OCCCO3)nc1	759739428	LCAWXBLYRUCPIO-UHFFFAOYSA-N	435.458	1.337	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccnn1Cc1ccc(F)cc1	760278311	BUYSNOMIWOLKNR-UHFFFAOYSA-N	436.403	1.107	50	20	IDGD	
C[C@@H](C1CC1)n1nccc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)C(F)F)cc1	760279547	CBYCCIFTHQGYDB-JTQLQIEISA-N	427.433	1.932	50	20	IDGD	
O=C(NNS(=O)(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)c1ccccc1F	760336249	ZVECFOCZCCTRSY-UHFFFAOYSA-N	441.506	1.624	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)CCNC(=O)[C@H]2CCCN2C(=O)OC(C)(C)C)c1	760797531	BJTWORCMXJLDSP-QGZVFWFLSA-N	447.536	1.419	50	20	IDGD	
CNC(=O)NCC(=O)NNC(=O)c1ccc(CN2C(=O)c3cccc4cccc2c34)cc1	761134832	CMBICISQJKHIRC-UHFFFAOYSA-N	431.452	1.690	50	20	IDGD	
O=C(NCCc1cccs1)NNS(=O)(=O)c1cc(Br)cc(C(=O)O)c1	762472121	OEFOFOSYYNJGFX-UHFFFAOYSA-N	448.320	1.944	50	20	IDGD	
CN(C)C(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)cc1	763604843	NQEITOVPCNULIC-UHFFFAOYSA-N	434.456	1.107	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2ccccc2C(=O)NC(C)(C)C)c1	763647972	RODRSDSIASDMJX-UHFFFAOYSA-N	440.500	1.997	50	20	IDGD	
COC(=O)c1cc(Cl)cc(NC(=O)C(=O)NNC(=O)COc2cc(C)cc(C)c2)c1	763649868	ZJZHMEGHUHCCDI-UHFFFAOYSA-N	433.848	1.908	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(C)ccc1Br	763656831	FJQJJBJGEYUITP-UHFFFAOYSA-N	436.262	1.931	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2cccn(CC(F)(F)F)c2=O)c1	763666415	ZTQUCISHKBKECC-UHFFFAOYSA-N	440.378	1.192	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccccc1N(C)C(C)=O	763680738	HLUKZPUEIUAHLP-UHFFFAOYSA-N	428.445	1.233	50	20	IDGD	
O=C(COc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1ccc(-n2cncn2)c(F)c1	763686743	SETTZLPKYXNUQM-UHFFFAOYSA-N	432.799	1.225	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCC3)ccc1N1CCOCC1	763783952	RRIOXCVCJIZXGR-UHFFFAOYSA-N	428.514	1.782	50	20	IDGD	
C[C@H]1CCCN(Cc2ccc(NC(=O)C(=O)NNC(=O)COc3ccccc3C#N)cc2)C1	763807858	HLKTYIBZUKJVFP-KRWDZBQOSA-N	449.511	1.955	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)C(=O)Nc1cnc(-c2ccccc2)nc1	763808694	PJUCLPXZVOAESS-UHFFFAOYSA-N	436.384	1.217	50	20	IDGD	
CCNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)c1	763838557	AIUUUPIQTHAWQP-OAHLLOKOSA-N	426.473	1.607	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccc(-n2cccn2)c(Cl)c1	763839323	DXNBCOTUZYDBLP-UHFFFAOYSA-N	431.811	1.830	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)NNC(=O)C(=O)Nc1cccc(CN2CCOC2=O)c1	763860600	KCSVKMRYUNZIFF-UHFFFAOYSA-N	435.440	1.449	50	20	IDGD	
COCC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)CSc2ccc(C)cc2)cc1	763897750	FIGDYWFZHZGRFG-UHFFFAOYSA-N	430.486	1.458	50	20	IDGD	
O=C(Cc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1cccn(Cc2ccccc2)c1=O	763942247	SNJOGQXOGJXJEB-UHFFFAOYSA-N	438.871	1.879	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CC[C@@H](C)C3)cccc1-n1cnnn1	763943907	VRTYPAPXJYGFNR-LLVKDONJSA-N	439.501	1.557	50	20	IDGD	
CC[C@H](C)C(=O)NNC(=O)C(=O)Nc1c(C)cnn1[C@@H]1CCN(Cc2ccccc2)C1	764081922	KTGMCWHYZMJOJE-MAUKXSAKSA-N	426.521	1.771	50	20	IDGD	
O=C(CCc1ccco1)NNC(=O)C(=O)Nc1ccc(NC(=O)NC[C@H]2CCCO2)cc1	764171222	IMDJWUISOYLCIW-QGZVFWFLSA-N	443.460	1.299	50	20	IDGD	
COc1cccc(Cn2nccc2NC(=O)C(=O)NNC(=O)CC2CCCC2)c1OC	764189204	YMDKVIPKKRGEAY-UHFFFAOYSA-N	429.477	1.615	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)C(=O)Nc1ccccc1-n1cccn1	764204312	KMHFNGWNVXVVAS-UHFFFAOYSA-N	430.465	1.263	50	20	IDGD	
COC(=O)c1ccc(N2CCCC2)c(NC(=O)C(=O)NNC(=O)c2cccc(C#N)c2)c1	764234788	JHFZPEKJLRZSAI-UHFFFAOYSA-N	435.440	1.345	50	20	IDGD	
COC(=O)[C@H](C)Cc1ccc(NC(=O)C(=O)NNC(=O)CCc2ccccc2O)cc1	764287858	BHCCXMPZLMOYAS-CQSZACIVSA-N	427.457	1.463	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)c(C)o1	764333545	ADUPYTPMDMGPDH-UHFFFAOYSA-N	428.417	1.423	50	20	IDGD	
COC(=O)c1ccccc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccccc2OC)[nH]n1	764376374	CDGFFZNQRCVYBU-UHFFFAOYSA-N	437.412	1.272	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cccnc3-n3cncn3)n[nH]2)cc1	764385290	VTNXBFSGIDXQGW-UHFFFAOYSA-N	445.443	1.015	50	20	IDGD	
Cc1ccccc1-c1cc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)n(C)n1	764404565	LJYPMSOEKQQNRQ-UHFFFAOYSA-N	439.497	1.979	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)N2CCC3(CC2)NC(=O)N(C)C3=O)c(C)n1C[C@@H]1CCCO1	764406810	LIFFRRNCCUBKAB-OVCORXIESA-N	439.516	1.734	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NN=Cc3cccc(C#N)c3)CC2)cc1	764818221	SORDRFKEGJCRQT-UHFFFAOYSA-N	425.514	1.323	50	20	IDGD	
Cc1c(S(=O)(=O)NNC(=O)c2nnc(-c3ccccc3)o2)cnn1-c1ccccn1	765062727	YMDLZRKAPIBGRV-UHFFFAOYSA-N	425.430	1.249	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)c3cc(S(=O)(=O)N(C)C)c[nH]3)n[nH]2)cc1	765576182	QTKYCVYQYQBPME-UHFFFAOYSA-N	430.490	1.292	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)c1cn2ccccc2n1	765755360	GHWCUXGTNJZIHU-UHFFFAOYSA-N	426.908	1.567	50	20	IDGD	
CN(C)C(=O)Cn1cnc(NC(=O)C(=O)NNc2c(Cl)cc(Cl)cc2Cl)n1	766261667	GLFVPAOYXCMBCZ-UHFFFAOYSA-N	434.671	1.408	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1ccc(C(=O)N2CCCC[C@H]2C)cc1C	766264053	DKQYKWLYEIYCPV-CQSZACIVSA-N	426.477	1.890	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2ccc(C#N)cc2OC)cc1Br	766367840	ADSGNUSOIUAPSA-UHFFFAOYSA-N	440.275	1.961	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3c[nH]nc3-c3ccccc3)CC2)cc1	766649642	RSOJUJAIOTWCCI-UHFFFAOYSA-N	432.528	1.964	50	20	IDGD	
CN(C)C(=O)c1cc(F)ccc1NC(=O)C(=O)NNC(=O)c1cnn(-c2ccccc2)c1	768241809	LBLZSYYITRMGGP-UHFFFAOYSA-N	438.419	1.113	50	20	IDGD	
CCOc1ccc(-n2c(SCC(=O)NNC(=O)C(C)(C)O)nnc2-c2ccco2)cc1	768255431	JTOKAZPUAUUORR-UHFFFAOYSA-N	445.501	1.936	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)CCc1c(C)nc2[nH]n(C)c(=O)c2c1C	768645910	UFFJVFYNJGJRBO-UHFFFAOYSA-N	447.517	1.366	50	20	IDGD	
COCCC(=O)N1CCC(NC(=O)NNC(=O)c2ccc(F)cc2Br)CC1	769166212	UTKLRLJBOMAEIF-UHFFFAOYSA-N	445.289	1.560	50	20	IDGD	
CSCCNC(=S)NNC(=O)c1ccc(NS(=O)(=O)C(F)(F)F)c(C)c1	770246170	JVOGJFKGECUPFR-UHFFFAOYSA-N	430.499	1.728	50	20	IDGD	
COc1ccccc1[C@@]1(C)NC(=O)N(CC(=O)NNC(=O)c2ccc(Cl)cc2O)C1=O	771253178	UTRBBFRPARWFAJ-HXUWFJFHSA-N	446.847	1.282	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)ccc1O	773252663	VXDGWOWNCWMPGD-JTQLQIEISA-N	428.850	1.609	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NC[C@H]2COC3(CCCC3)O2)c2ccccc2c1=O	774301465	GUSYFMVNPDIKKS-HNNXBMFYSA-N	443.504	1.826	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)cc(OC)c1	775403723	RXLQGBYUPNPHGJ-UHFFFAOYSA-N	441.532	1.983	50	20	IDGD	
O=C(NNC(=O)c1cccc(Br)c1)Nc1ccc(C[C@H]2NC(=O)NC2=O)cc1	775703722	QYDKBDYMZPEOSA-CQSZACIVSA-N	446.261	1.666	50	20	IDGD	
Cn1cc([C@H](NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c2ccc(F)cc2)cn1	776197907	XYBQJSGFQNOQHX-GOSISDBHSA-N	445.476	1.696	50	20	IDGD	
COCCC1(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)CCCCC1	776263571	FZTQTAJUGUGHPA-UHFFFAOYSA-N	440.566	1.868	50	20	IDGD	
C[C@H](CC(=O)NNc1cccc(S(C)(=O)=O)c1)/N=C1/NS(=O)(=O)c2ccccc21	776528294	NMLGRGOMUKWZAP-GFCCVEGCSA-N	436.515	1.051	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(C(=O)NNc2cccc(S(C)(=O)=O)c2)ccc1Cl	776714724	LMLFDYAAGDZMEN-UHFFFAOYSA-N	431.923	1.751	50	20	IDGD	
CCOC(=O)N1CCC[C@@H]([C@H](C)NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)C1	777266147	NWODYCHQJZMUDP-UONOGXRCSA-N	444.492	1.135	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)NC2CCN(S(=O)(=O)CC(C)C)CC2)c2ccccc2n1	777767559	GBFOHXSYCINDAG-UHFFFAOYSA-N	447.561	1.937	50	20	IDGD	
COc1ccc(N(CCC(=O)NN(C)C(N)=O)S(=O)(=O)c2cccc(Cl)c2)cc1	778416783	HUMMHFPBAXQCPO-UHFFFAOYSA-N	440.909	1.976	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)c2cc(S(=O)(=O)NC3CC3)ccc2C)nc1C	778422769	ULQQJWDOZVAJHL-UHFFFAOYSA-N	433.490	1.468	50	20	IDGD	
Cc1ccc(C)c(NNC(=O)C(=O)N2C[C@H](C(=O)N3CCOCC3)Oc3ccccc32)c1	783366843	RKZHOPNJGLXINF-HXUWFJFHSA-N	438.484	1.400	50	20	IDGD	
O=C(NNc1nccc2sccc12)C(=O)Nc1cccc(C(=O)N2CCOCC2)c1	783440003	RPZDWKKROPFKQW-UHFFFAOYSA-N	425.470	1.851	50	20	IDGD	
COc1cc(C=NNC(=O)c2csc(N3CCOCC3)n2)ccc1OCCC(=O)O	783813496	NAVFCZONMJOUDW-UHFFFAOYSA-N	434.474	1.606	50	20	IDGD	
Cc1nc(-c2cccc(NC(=O)C(=O)NNC(=O)CNC(=O)c3cccs3)c2)cs1	784003753	NRWFTHLQYYSJFO-UHFFFAOYSA-N	443.510	1.696	50	20	IDGD	
CCN1CCN(S(=O)(=O)c2cccc(NC(=O)C(=O)NNc3ccc(F)cc3)c2)CC1	784790437	UQPUWEDLEKHRSD-UHFFFAOYSA-N	449.508	1.234	50	20	IDGD	
O=C(NNc1ncccc1Cl)C(=O)Nc1ccc(C(=O)N2CCOCC2)c(Cl)c1	784815272	SWAFKSDGEOUMAL-UHFFFAOYSA-N	438.271	1.943	50	20	IDGD	
O=C(NNc1ccnc(F)c1)C(=O)N1C[C@@H](C(=O)N2CCCCC2)Oc2ccccc21	784851346	AXKXAJJLUHINBW-KRWDZBQOSA-N	427.436	1.471	50	20	IDGD	
CN(C)C(=O)COc1cccc(NC(=O)C(=O)NNc2cccc(C(F)(F)F)n2)c1	784953535	GDRADJLBIIUJGR-UHFFFAOYSA-N	425.367	1.649	50	20	IDGD	
COCCOc1ncccc1NC(=O)C(=O)NNc1c(F)cc(C(=O)NC2CC2)cc1F	785100204	SWQCHYCHAZNDAQ-UHFFFAOYSA-N	449.414	1.359	50	20	IDGD	
CC(C)CN1C[C@@H]2CN(C(=O)NNC(=O)c3ccc(Br)s3)CCN2C1=O	787756434	HKIKGPBZAIYLCL-NSHDSACASA-N	444.355	1.943	50	20	IDGD	
C[C@@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)NNc2nnc(-c3ccccn3)s2)C1=O	788564704	BPOZSLIRFMOHIM-IBGZPJMESA-N	441.448	1.650	50	20	IDGD	
COc1ccc(-c2nc(SCC(=O)NNC(=O)C3CC3)n[nH]2)cc1Br	788824149	YUHSCQMITKYTRM-UHFFFAOYSA-N	426.296	1.892	50	20	IDGD	
CCn1cccc(CNC(=O)NNC(=O)[C@@H](C)Oc2cccc(Br)c2)c1=O	789298234	KRYLCIHBRHFBEV-GFCCVEGCSA-N	437.294	1.929	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1cc(C(F)(F)F)ccc1-c1nc(C)no1	789745811	GRBMVLXQMXGQTC-UHFFFAOYSA-N	437.338	1.944	50	20	IDGD	
Cc1nn[nH]c1C(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2Cl)c1	789867670	VVLYJGHNBZKPRB-UHFFFAOYSA-N	434.865	1.642	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccccc2N2C[C@H]3CC[C@H]2C3)cc1	790952760	VBAWDJKCBRCQGL-IRXDYDNUSA-N	433.468	1.712	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc(-n2cccn2)c1	791968100	ARXPHDDQKQQVIG-UHFFFAOYSA-N	429.458	1.751	50	20	IDGD	
Cc1cccc(CCNC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)n1	792235664	DGYMRQYBUQHHTO-UHFFFAOYSA-N	431.518	1.361	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)[C@@](C)(O)CN2C(=O)C(C)(C)c3ccccc32)cc1	792801922	DEZMVOPYDOOFEF-DEOSSOPVSA-N	439.512	1.851	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(OC(C)C)nn2)cc1OC	793022625	ZCGJBOPXNPYCAO-UHFFFAOYSA-N	431.449	1.461	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CNS(=O)(=O)c2ccc(OC(F)(F)F)cc2)n1	794075163	LZYBJTYICUZYMY-UHFFFAOYSA-N	432.380	1.028	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)c1ccc(S(=O)(=O)NC2CC2)cc1	795151981	MWSPSSVZMZWBFX-UHFFFAOYSA-N	438.531	1.135	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCCC[C@@H]1COC(=O)N(C)C	796554986	PFZHECURNOKFHT-CQSZACIVSA-N	426.901	1.662	50	20	IDGD	
CNC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2OC)c(C)c1	796998644	LGJSMMKSBGISDU-UHFFFAOYSA-N	448.863	1.182	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)CCC(=O)N3CC(F)(F)F)n1	797370471	MVPRMMJNPDXNGQ-UHFFFAOYSA-N	449.389	1.631	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)Nc2ccc(S(=O)(=O)N(C)C)cn2)c1C	797652668	NTOOGGSDGFMOGK-CQSZACIVSA-N	435.506	1.569	50	20	IDGD	
Cc1c(C(=O)NNC(=O)COc2ccccc2O)nnn1CCOc1ccc(F)cc1	800486602	MEHMIAHPEPEDQW-UHFFFAOYSA-N	429.408	1.350	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NNc2nc3ccccc3c(=O)n2C)ccc1F	801156159	KMCJNSRTKJCCHH-UHFFFAOYSA-N	447.492	1.860	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)c2cncc(-n3ccnn3)c2)c2ccccc2c1=O	801796960	VESYZNRGYTYPEA-UHFFFAOYSA-N	446.471	1.637	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1)Nc1ccccc1	801991820	YBJGCSQHCJHCIR-KRWDZBQOSA-N	447.473	1.991	50	20	IDGD	
COCCN1C[C@H](C(=O)NNC(=O)Nc2ccc(Br)cc2Cl)CC1=O	802043163	RTOPKXZYTLSMCG-SECBINFHSA-N	433.690	1.750	50	20	IDGD	
Cc1nc(O)c(C(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)cc1Br	802067623	XJJAANBJIZQUNO-UHFFFAOYSA-N	443.279	1.728	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)CN2C(=O)COc3ccccc32)c(OC)cc1Cl	802077873	FUTXITPBTJIGJK-UHFFFAOYSA-N	434.836	1.936	50	20	IDGD	
CS(=O)(=O)c1ccc(OCCCC(=O)NNC(=O)Nc2ccc3c(c2)OCO3)cc1	802094895	IYNZVWPCOMXYCJ-UHFFFAOYSA-N	435.458	1.831	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2ccnc(NC(=O)C3CC3)c2)cc1OC	803905006	WLJSBLRPMQSASC-UHFFFAOYSA-N	442.428	1.065	50	20	IDGD	
COC(=O)N(C)NC(=O)c1ccc(S(=O)(=O)Nc2cc([N+](=O)[O-])ccc2OC)cc1	804121111	ATXOWAWYRUGUGN-UHFFFAOYSA-N	438.418	1.747	50	20	IDGD	
O=C1COC[C@H](C[C@@H]2CN(C(=O)C(=O)NNc3ccc(Cl)nc3)c3ccccc32)N1	807014307	UNTSJDXUEGCJAR-OCCSQVGLSA-N	429.864	1.214	50	20	IDGD	
Cc1cc(C)c(NC(=O)CN(C)C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c(C)c1	807135799	MDIHZRNMYUIAMH-UHFFFAOYSA-N	436.476	1.512	50	20	IDGD	
COc1cc(OC)c(Cn2nccc2NC(=O)C(=O)NNc2cccc(F)n2)c(OC)c1	807392522	CLFXBFHVCUFVDM-UHFFFAOYSA-N	444.423	1.573	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NN=C1CCCC[C@@H]1[C@@H]1CCCN1C(=O)OC(C)(C)C	811642073	YGXQTDBVYQHDOH-DZKIICNBSA-N	430.571	1.986	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N2CCC[C@H](CNC(=O)C(F)(F)F)C2)c(OC)c1	811875452	CGVPLZODMSIUTM-LLVKDONJSA-N	432.399	1.449	50	20	IDGD	
Cc1noc2nc(C3CC3)cc(C(=O)NNC(=O)c3csc(N4CCOCC4)n3)c12	813536628	YNZVLIQSTSKFRR-UHFFFAOYSA-N	428.474	1.777	50	20	IDGD	
CC(=O)N1CCN(S(=O)(=O)NC(=O)/C(C#N)=C/c2cc(C)n(CCC(C)C)c2C)CC1	813948785	KYDKJYAWAOORML-DEDYPNTBSA-N	449.577	1.583	50	20	IDGD	
Nc1ncc2c(n1)CCCC2=NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	814879710	YMIUUCLQDACSHZ-UHFFFAOYSA-N	427.940	1.687	50	20	IDGD	
COCc1cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)cc(C(=O)OC)c1	815566625	ZLMMUAPMQHPEAO-LBPRGKRZSA-N	447.419	1.312	50	20	IDGD	
Cn1nncc1NNC(=O)c1cc(S(=O)(=O)N2CCCC2)ccc1Br	816769668	QVQGPXBXWHPAFH-UHFFFAOYSA-N	429.300	1.119	50	20	IDGD	
O=C(Cc1ccc(Br)cc1)N[C@@H](C(=O)N1CC[C@@H](B(O)O)C1)c1ccccc1	864233830	KNFNEHISZWXBIS-VQIMIIECSA-N	445.122	1.924	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)O[C@@H](C)C(=O)Nc2ncnc3[nH]cnc23)c1C	897563598	XKHNNQAKUYVWJH-BRSWLGOBSA-N	437.460	1.895	50	20	IDGD	
C=CCNS(=O)(=O)c1cccc(C(=O)NNC(=O)Cn2c(CC)nc3ccccc32)c1	915776307	KGDQZPBMDWYTSC-UHFFFAOYSA-N	441.513	1.524	50	20	IDGD	
CCOC(=O)N1CCC(NC(=O)NNc2ccc(S(=O)(=O)N(CC)CC)cn2)CC1	915878848	NJZNFINWPYAXEF-UHFFFAOYSA-N	442.542	1.359	50	20	IDGD	
CN(CCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)c1ccccc1	916226249	RFTIRGDWURHLGR-UHFFFAOYSA-N	445.545	1.552	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NN=C1CCSCC1)N(S(C)(=O)=O)CC2	916356291	QDSKFXLKDNEYBU-INIZCTEOSA-N	441.575	1.952	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)NCc2ccnc(N3CCOCC3)c2)cc1OC	916389458	ZYUJLTBRUBRVIB-UHFFFAOYSA-N	429.477	1.470	50	20	IDGD	
CC(C)NS(=O)(=O)c1cccc(CNC(=O)NNC(=O)Cc2c[nH]c3ccccc23)c1	916486551	XXKOZVJCYQBUSK-UHFFFAOYSA-N	443.529	1.928	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)NCCCN2CCN(Cc3ccccc3)CC2)c1	916489015	LAXYKOYYRWKTPA-UHFFFAOYSA-N	439.560	1.912	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)CS(=O)(=O)Cc1ccc(Cl)s1	916551019	AHGZTOWWYFPZMZ-UHFFFAOYSA-N	446.934	1.941	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCCCC(=O)NC1CC1	916577504	GDIZHZLQDJQOLY-NSHDSACASA-N	427.299	1.606	50	20	IDGD	
Cc1nnc([C@@H]2Cc3ccccc3CN2CC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)o1	917194836	RLTLYXKXPQHOAK-SFHVURJKSA-N	436.428	1.847	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)Cc2ccc(C(=O)NNC(=O)c3cc(C)[nH]n3)cc2)cc1	917393812	WMKHOZABKIPXJG-UHFFFAOYSA-N	441.513	1.922	50	20	IDGD	
Cc1nn(Cc2ccccc2)c2sc(C(=O)NNC(=O)N[C@@H]3CCS(=O)(=O)C3)cc12	919884952	LTJJTOVLSOJZJJ-CQSZACIVSA-N	447.542	1.586	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2cccc(-n3cnnn3)c2)ccc1OC(C)C	920244926	JBBASNXKWBXRDI-UHFFFAOYSA-N	432.462	1.081	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])c1	920312279	TZELBGUYZXSEDI-UHFFFAOYSA-N	433.851	1.275	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)N1CCN(C(=O)Cc2ccccc2F)CC1	921199115	BCQIPRAXUUQXNZ-UHFFFAOYSA-N	438.463	1.523	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)/C(=C/c2ccccc2)n2nnnc2C)c2ccccc2c1=O	933448507	KGJFDVIYTUCITN-AQTBWJFISA-N	444.455	1.171	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccc(F)cc2C1)c1cccc(S(=O)(=O)N2CCCC2)c1	1116399285	XXLHGCLFUHNIJX-INIZCTEOSA-N	447.488	1.623	50	20	IDGD	
C[C@H]1C[C@@H](C)C[C@]2(C1)NC(=O)N(CC(=O)NNC(=O)c1cncn1-c1ccccc1)C2=O	1319504490	IAWFBTMZNUVDDQ-YEZVWNJWSA-N	438.488	1.380	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)c2n[nH]cc2I)c1C	1320432066	DZAMGTCEIYLMGB-SNVBAGLBSA-N	428.230	1.860	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3nnc4cc(C)nn4c3C)C2)C1	1777778969	GSYQJTBVBAURGP-FOIQADDNSA-N	434.928	1.592	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(CCN(C(=O)c3cc4ncsc4[nH]3)C2)C1	1779330807	JLNSVOWOYQSGTF-INIZCTEOSA-N	427.324	1.853	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)Nc2ccccn2)C1	1779566718	KXLUFUPQCHEHMQ-BIZBXSGISA-N	438.956	1.650	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnn(Cc4ccccc4)c3)C2)C1	1779599159	IHKINTZIZUVDSY-DENIHFKCSA-N	446.935	1.629	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](C)N(C)C(=O)OC(C)(C)C)C2)C1	1781041992	ZDMAMDLBEOYOHB-SXGZJXTBSA-N	447.960	1.326	50	20	IDGD	
CC(C)(C)n1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)n1	1781325638	GMQVOGGKXVADMU-CXAGYDPISA-N	431.306	1.772	50	20	IDGD	
O=C(c1cnc2ccccn12)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781330465	XOUGSYKGGHPVJT-YOEHRIQHSA-N	425.258	1.468	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@](C)(O)C(F)(F)F)C2	1781997425	VWGFCZKWIIEZEW-IDTSFGKNSA-N	445.276	1.597	50	20	IDGD	
CCN(CC)C[C@H](C)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2	1782685489	DDCMKZSRPLKKGG-TXPKVOOTSA-N	432.403	1.825	50	20	IDGD	
CC1(C(=O)N2CCO[C@@]3(CCN(C(=O)/C(C#N)=C/c4ccc(F)cc4F)C3)C2)COC1	1782862437	USTMGPDNIAEVFO-XXFFJTNUSA-N	431.439	1.738	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)Cc3cccnc3Cl)CCO2)C1	1783530521	ZZWDVGAPKWTOBU-SJCJKPOMSA-N	430.730	1.891	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](C)Nc1ccccn1)CCO2	1783534331	SOIVLVHSNOXIGV-DEYYWGMASA-N	425.327	1.495	50	20	IDGD	
COc1ccc([C@@H](O)C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)C(C)(C)CCl)C[C@@H]32)cc1	1783766087	QRLDQTZPWKSNAO-DSLXNQLJSA-N	438.952	1.973	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)CCc3cccc([N+](=O)[O-])c3)CCO2)C1	1783871228	OEKFWGCCHGRQQA-YLJYHZDGSA-N	439.896	1.611	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(OC)c(OC)c3O)CCO2)C1	1783881146	PFLQMZJSEUUFJI-VLIAUNLRSA-N	442.896	1.107	50	20	IDGD	
CN1CCC(C(=O)Nc2ccc(C3(NC(=O)c4cccc(B(O)O)c4)CCC3)cc2)CC1	1785878054	RDWLLYDGCXMNIA-UHFFFAOYSA-N	435.333	1.456	50	20	IDGD	
CC(=O)OC[C@H](OC(C)=O)C(=O)NC1(c2ccc(NC(=O)[C@H](O)CCl)cc2)CCC1	1786134191	BGXMUKJYKBKOHN-SJORKVTESA-N	440.880	1.215	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cncc(F)c3)[C@H]2C1	1786144081	QUBUEUPFHUVCBA-KNPMLCFXSA-N	428.302	1.845	50	20	IDGD	
COc1nc(C)ccc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCBr)[C@H]2C1	1786406543	XHJKABKVVJCDIY-BPUTZDHNSA-N	440.338	1.777	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnn4ncccc34)[C@H]2C1	1787378070	UJRIWOFNEJAVAX-DSPQJCBJSA-N	436.310	1.106	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C=C/C(=O)c3cccs3)[C@H]2C1	1787513552	KAOWXPLDSLYGQM-MWDSRFMCSA-N	440.949	1.721	50	20	IDGD	
COc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)Br)C[C@@H]32)ccc1O	1789603690	TYCWMVHRGRTCFE-YSLLHCQFSA-N	441.322	1.778	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cn3cc(Cl)cn3)C[C@@H]21	1789866070	LLZLZNIUVNLGFW-PLNCSYRRSA-N	437.755	1.753	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccccc3O)C[C@@H]21)[C@@H](F)Br	1789924920	HZDZQXGMZUUOON-GZIXRCOHSA-N	429.286	1.605	50	20	IDGD	
Cc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)C(Cl)Cl)C[C@@H]32)nc2nccn12	1790410252	MNPHDKMWKWWKOT-OBJOEFQTSA-N	426.304	1.435	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)Cn3cccn3)C[C@@H]21	1791056959	JFRFYEPNDVRZHL-OWYFMNJBSA-N	427.343	1.282	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnn4ncccc34)C[C@@H]21	1791057181	GRCLRZKZBSXWFZ-DSPQJCBJSA-N	436.310	1.106	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc4snnc4c3)C[C@@H]21)C(Cl)Cl	1791296322	CDGZIDKJPVWWTM-PEXQALLHSA-N	430.317	1.483	50	20	IDGD	
COc1ccc(OCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CO[Si](C)(C)C)C3)cc1	1792725559	YQQKQYKQKYVFOS-VPTLXERWSA-N	436.581	1.515	50	20	IDGD	
CCOC(=O)N(CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCl)Cc1ccco1	1793116768	SVHAFMAQYYWATR-JYYAWHABSA-N	441.912	1.476	50	20	IDGD	
O=C(CCc1ccc(F)nc1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2	1794020244	ZVSSLMOVKYYAOX-ZSBFGKGUSA-N	428.302	1.528	50	20	IDGD	
COc1cc(C)cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCBr)c1	1795115117	KDIQCHMMWPTYGH-JLVBRIDZSA-N	425.323	1.992	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc2nccn2c1	1797621304	OCVRUTODTBKTCH-MVUGMWCJSA-N	447.499	1.720	50	20	IDGD	
Cc1nnc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Br)s1	1799344700	RUJXGFWBLRRVRB-RDBQEKCUSA-N	435.319	1.059	50	20	IDGD	
CN(C)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Br	1799347959	VRUMMCDEVQOITO-BAESOJJISA-N	429.290	1.041	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(-c2ccccc2)[nH]n1)c1ccc(B(O)O)cc1	1799385087	XLDGLBRIQUHOAF-ACDBMABISA-N	444.300	1.322	50	20	IDGD	
COc1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)c(F)c1	1800386281	CXDWJIPRVYQNHS-BTTYYORXSA-N	441.463	1.398	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)n1ccccc1=O)C2	1800641723	IFTIPSUMPFOCPP-OWVAZHOYSA-N	440.338	1.172	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)n1ccnc1C)C2	1800644450	UKCIJJJHBUDLOY-YMILTQATSA-N	427.343	1.516	50	20	IDGD	
COc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)Br)ccc1F	1800762872	IORKWMOYPGVRPN-YGSHXTJESA-N	429.286	1.821	50	20	IDGD	
C[C@@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C=C/C(=O)NCc1ccco1)C2	1801962849	ABBWGVAZWDVHDV-DJWHXZHKSA-N	438.322	1.874	50	20	IDGD	
COc1ccc(Cl)c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CCC(=O)NN(C)C)c1	1802339905	UAZDNXVLKQFGOM-QDMKHBRRSA-N	436.940	1.973	50	20	IDGD	
CSc1ccc(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CCC(=O)NN(C)C)C3)cc1	1802652430	KJNNSCJDQVQHEE-BCDXTJNWSA-N	432.590	1.962	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H]2CNc3ccccc32)[C@H]1c1cccnc1)[C@@H](O)CCl	1803139232	VLBCDUXUFLQQFE-RKOGWWSCSA-N	428.920	1.896	50	20	IDGD	
CC(=O)N[C@H](C(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)C(C)(C)C	1803377697	JTKKUSRDCIERAU-WNRNVDISSA-N	438.956	1.238	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)CN2CC(=O)NC2=O)[C@H]1c1cccnc1	1803686641	RGQVXRMGAVYFRD-VKJFTORMSA-N	435.912	1.047	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)Cn2ccncc2=O)[C@H]1c1cccnc1	1803693653	AOVMWPHHADEFRP-UWVAXJGDSA-N	431.924	1.752	50	20	IDGD	
CC(F)(F)C(C)(C)C(=O)N1CCCC2(CCN(C(=O)c3cccc(B(O)O)c3)CC2)C1	1806178663	DDLQLZHTGCTIOP-UHFFFAOYSA-N	436.308	1.893	50	20	IDGD	
CC(C)=CCCC(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1807373140	NGWKONIVGBMFBA-NZQKXSOJSA-N	435.333	1.827	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@H]1CCN(C(=O)[C@@H]2CNC(=O)O2)[C@@H]1c1cccnc1	1808290351	SOLINDJLVHMVDG-NPSOMJIGSA-N	429.304	1.432	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)c2cn[nH]c2)[C@H]1c1cccnc1	1808416476	AFPFUTZLWCXAES-ULJMSJBCSA-N	448.487	1.258	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@@H]1c1cccnc1	1808431149	IAZONOSNWVMHPZ-CAPXZKIUSA-N	443.317	1.645	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)NC[C@@H]1CCN(C(=O)C(O)O)[C@@H]1c1cccnc1	1812440583	LZJQFIGHRXOPHR-XKSXBQJNSA-N	442.422	1.283	50	20	IDGD	
CC1=C(C(=O)N2CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)CCO1	1813069869	AKQPSPMFBKJFKB-LAUBAEHRSA-N	429.521	1.155	50	20	IDGD	
CC(C)(CCl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCN2C(=O)C=CC2=O)[nH]n1	1814694359	DBXAWZPMTKJKIA-AWEZNQCLSA-N	435.912	1.982	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](O)C(C)C)n[nH]1	1814944915	VEKPHDDMHVMAPP-DWLLQQPHSA-N	443.508	1.553	50	20	IDGD	
CCCNC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](Cl)COC)[nH]n1	1815114100	PIQCUJIZTLMIKX-UKRRQHHQSA-N	427.933	1.962	50	20	IDGD	
COc1ccccc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1	1817472412	INSOQJYBXIDKIY-IBGZPJMESA-N	448.288	1.718	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cnoc2C2CC2)[nH]n1)c1cccc(B(O)O)c1	1817473394	RBDBAHGIDMCLPV-GOSISDBHSA-N	449.276	1.575	50	20	IDGD	
Cc1cccc(CC(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)c1	1817473471	VOMNDPIQWYDNDC-OAQYLSRUSA-N	446.316	1.947	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(F)cn2C)n[nH]1	1818388393	UNJSGZGRNBJDMT-OAHLLOKOSA-N	433.488	1.566	50	20	IDGD	
CCn1nc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)CCC(=O)NN(C)C)CC3)cc1C	1820777453	JPHHTGVMMWEHIT-CYBMUJFWSA-N	447.565	1.267	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)C23CC(C(=O)OC)(C2)C3)[nH]n1	1822377555	XVGKBQXYWSPZDA-BZUWMGCQSA-N	438.912	1.999	50	20	IDGD	
CN(C)C(=O)NCC(=O)N[C@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1	1822999778	XTZOZRCSUVZUTK-CPCISQLKSA-N	436.307	1.017	50	20	IDGD	
COC(=O)C1(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@@H](C)Br)CC3)CC1	1825281908	LVDOJJXGYFQAMX-RKDXNWHRSA-N	430.324	1.792	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)C[C@@H](NC)C(=O)O)CC2	1825446940	LXUUXRHPZFRXCU-WCABBAIRSA-N	447.355	1.291	50	20	IDGD	
Cc1ncoc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1	1826063824	RBGWLYPEIRQERO-LJQANCHMSA-N	425.294	1.210	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)C2CCOCC2)CC1	1826579447	VNTCQOKHMYBASP-NRFANRHFSA-N	428.338	1.026	50	20	IDGD	
CNC(=S)NCCC(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H](Cl)COC)CC1	1828931300	GVCJYYAAUYMBNO-HOTGVXAUSA-N	433.018	1.344	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCCC[C@H]1C1CCN(C(=O)Cn2ccncc2=O)CC1	1829103814	OAJTUPUMSCXVLS-SFHVURJKSA-N	434.613	1.715	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnc(Cl)nc3)CCO2)C1	1829513790	CKKWROBESGCVMM-KDOFPFPSSA-N	431.320	1.608	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CC3(F)F)C2)C1	1830540283	PIZSREBOTMUQLV-TYNCELHUSA-N	425.270	1.129	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccnc3OCC)C2)C1	1831638463	CWWMLIFAKDGNQN-UTKZUKDTSA-N	439.940	1.958	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccnn3CCOC)C2)C1	1831647577	XTWZNHLFZAMJKN-UZLBHIALSA-N	442.944	1.007	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)Cc3ccccc3)C2)C1	1831657444	OHSWJOODWRGATN-CNNODRBYSA-N	438.952	1.454	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCN2CCN(C)CC2)CC1	1831830021	HDDDQXVMDXZQJH-VQTJNVASSA-N	443.032	1.497	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC([C@H]2CCCCN2C(=O)CN2C(=O)C=CC2=O)CC1	1831987437	HYDXAEDZFDDFJG-DZGCQCFKSA-N	440.338	1.315	50	20	IDGD	
Cc1noc(C)c1CC(=O)N1CCO[C@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1	1832559240	KQOZDLREUIBZPY-RTBURBONSA-N	448.347	1.527	50	20	IDGD	
CCOc1ncccc1C(=O)NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1833018897	MCJFTHCGBSDABS-SFHVURJKSA-N	438.956	1.265	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)[C@H](C)NC(=O)NCC)CC2)CC1	1833534035	YGOOCAOGXPHVFK-MAUKXSAKSA-N	444.020	1.673	50	20	IDGD	
COc1ncc(C(=O)NC2CCN(C3CCN(C(=O)[C@H](F)Cl)CC3)CC2)cc1F	1833966486	QMZCIFZVJWZABZ-INIZCTEOSA-N	430.883	1.949	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCC(N2CCC(NC(=O)c3cnccn3)CC2)CC1	1834123265	UIKOZNHZLGPGMB-LJQANCHMSA-N	428.364	1.898	50	20	IDGD	
CCOC(=O)/C=C/C(=O)NC1CCN(C2CCN(C(=O)C(C)(C)CCl)CC2)CC1	1834403509	IRUUVCCIRHBDPE-AATRIKPKSA-N	427.973	1.942	50	20	IDGD	
CCc1oncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)CBr)C2)C1	1834514382	WTJNSAKMZIJCOL-SCLBCKFNSA-N	444.326	1.338	50	20	IDGD	
Cc1nc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCBr)CCO3)C2)cs1	1834819406	PZHCQVJWVQIEOY-MRXNPFEDSA-N	432.340	1.307	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)Cc3ccn(C)n3)CC2)CC1	1834848040	LCKCSUPFPBHHQF-AWEZNQCLSA-N	440.386	1.318	50	20	IDGD	
O=C(Nc1cccnc1)C(=O)N1CCC(N2CCC(NC(=O)[C@H](F)Cl)CC2)CC1	1835084073	JNQKGSHGPWARBE-INIZCTEOSA-N	425.892	1.126	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@H](C)Cn3cncn3)CC2)CC1	1835805375	CQTSNTIYFFKWHK-VQIMIIECSA-N	439.004	1.893	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](Cl)CCC)CC2)CC1	1835827823	YSFNHYYWMITEHL-QAPCUYQASA-N	426.989	1.656	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccsc3)CCO2)C1	1836101813	OKVUFIAILVCHJA-SUMWQHHRSA-N	431.352	1.530	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC(OC2CCN(C(=O)[C@@H]3[C@H]4COC[C@H]43)CC2)CC1	1836674678	XABIMNQZLZKJHR-ZSGPHXLJSA-N	443.382	1.908	50	20	IDGD	
O=C(c1ccc(Cl)nn1)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836718578	UIEIAQGJTJVLHB-OAHLLOKOSA-N	431.320	1.342	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CS[C@@H]3CCCCO3)CCO2)C1	1837507352	BNHAGDPHBBBPAR-WDYCEAGBSA-N	434.986	1.720	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccc(F)cn3)C2)C1	1837711659	MYEFBGPOYXYOPL-FQEVSTJZSA-N	439.560	1.071	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(F)ccc3F)C2)C1	1837714878	QTECLGYUDFQZQZ-HXUWFJFHSA-N	442.535	1.886	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)/C=C/c3cccc(O)c3)C2)C1	1837715916	RKQRTASOZOXFNX-VQKOGROQSA-N	448.592	1.713	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnccc3Cl)CCO2)C1	1837780883	QALZIPUTVFNZQK-QAPCUYQASA-N	432.304	1.059	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1c(F)cncc1F)CCO2	1838165675	QKCLKLPKBYCRAH-IBGZPJMESA-N	443.523	1.281	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCSC)CC2)CC1	1838786667	PTLWJMRRPWANGA-IRXDYDNUSA-N	437.002	1.353	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cnc4ccccn34)C2)C1	1839141686	QBDXTNVUJAXGGK-UTKZUKDTSA-N	434.924	1.351	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3n[nH]c4c(C)cccc34)C2)C1	1839148355	WLWCOZCBISWFEJ-IERDGZPVSA-N	434.924	1.959	50	20	IDGD	
Cc1ncc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)s1	1839200239	DRNACPHTJFKIQF-IUODEOHRSA-N	436.303	1.212	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3coc(C)n3)C2)C1	1839963176	CBEDJFZJSRPBFK-SUMWQHHRSA-N	430.299	1.227	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](Br)CC)CCO2	1839965516	APYGVCNSNCASEL-XEZPLFJOSA-N	425.751	1.634	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(C)c(OC)c3)C2)C1	1840154554	ZGIWQSITDKGQKF-UWJYYQICSA-N	440.924	1.327	50	20	IDGD	
O=C(COCc1ccccc1)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840187993	JCDZJNGDYNNDCA-IBGZPJMESA-N	431.316	1.463	50	20	IDGD	
C[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1)c1cccs1	1840375878	DFDSHRXGYOIECP-RVSPLBMKSA-N	449.342	1.999	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)c(Cl)c1	1840733626	LDZZKIRDGBTJJS-VQIMIIECSA-N	447.315	1.018	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3cc(F)ccc3F)CCO2)C1	1840812004	VAKJLGGXCNSPIV-UZLBHIALSA-N	446.878	1.218	50	20	IDGD	
O=C([C@@H]1CCCN1C(=O)c1ccc(F)cc1)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1	1841348101	KFZLYNZIJZKGMF-DLBZAZTESA-N	437.899	1.233	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1ccc3cccnc3n1)C2	1843416173	IDXSHDAYUYJGPM-JFLMPSFJSA-N	445.483	1.581	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2ccn3cncc3c2)C1	1844104296	PUYQDRHVGOTDBZ-MFKUBSTISA-N	433.472	1.285	50	20	IDGD	
C[C@@H](C(=O)N1CC2(CCCN2C(=O)c2cnccc2C(=O)NN)C1)c1ccc(Cl)cc1	1844263344	UONFKIPSFKMGSF-CQSZACIVSA-N	441.919	1.959	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)c2cc(Cl)cc(Cl)n2)C1	1844568870	UGWNVFWTHCNAOK-UHFFFAOYSA-N	428.320	1.578	50	20	IDGD	
C=CC(=O)N[C@@H](C)C(=O)N1CC2(CCCN2C(=O)c2cc([N+](=O)[O-])ccc2OC(C)=O)C1	1844692774	IZSCNRXRJWDARQ-ZDUSSCGKSA-N	444.444	1.028	50	20	IDGD	
CSc1cccc(C(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)c1O	1844717089	DZEQHGQSZHWQGI-UHFFFAOYSA-N	441.513	1.243	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H]1C[C@@H](O)CN1C(=O)OC(C)(C)C	1847868186	UXUGASMVTADSNZ-NRKLIOEPSA-N	443.972	1.966	50	20	IDGD	
CC(C)(C)OC(=O)N1CCOC[C@@H]1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)C(Cl)Cl	1847944968	BGTACBYVCIDLQC-RWMBFGLXSA-N	436.336	1.628	50	20	IDGD	
CC(=O)N/C(C)=C/C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1848098590	KPKWFBKXVXDJKQ-IQDGFBTQSA-N	442.944	1.360	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Cc2nc3ccccc3n2C)c1	9219982	LAPROPFQPHTBBH-UHFFFAOYSA-N	443.529	1.608	50	20	IDGD	
O=C(C[C@H](NC(=O)c1ccccc1Cl)c1ccccc1)NNC(=O)C(=O)NC1CC1	9889603	AMEQIPMWNGFBRW-KRWDZBQOSA-N	428.876	1.627	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cnn1-c1ccccc1	12614933	CVBKNMAIRGJEGX-UHFFFAOYSA-N	427.486	1.506	50	20	IDGD	
COc1ccc(Cl)cc1N1C[C@@H](C(=O)NNC(=O)c2ccc3c(c2)OCO3)CC1=O	15663098	GTYJUQDIBZAKPX-LBPRGKRZSA-N	431.832	1.891	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)c2cccc(S(=O)(=O)Nc3cc(C)on3)c2)cc1	17114017	GFZRTGUKSSZJDU-UHFFFAOYSA-N	444.469	1.932	50	20	IDGD	
CCc1ccccc1NC(=O)CN1CCN(CC(=O)NNC(=O)c2cccs2)CC1	23298701	OCYXFGLXUNSFEX-UHFFFAOYSA-N	429.546	1.328	50	20	IDGD	
O=C(NNC(=O)[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)c1ccc(Cl)cc1)C(=O)N1CCCC1	726160881	MTEDPDJSEMFPQT-JQHSSLGASA-N	446.935	1.883	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)CNC(=O)c1cccs1)c1ccc(N2CCOCC2)cc1	726247965	VYPIFDBHXZEQIP-AWEZNQCLSA-N	431.518	1.406	50	20	IDGD	
CC(C)(C)OC(=O)N1CSC[C@@H]1C(=O)NNC(=O)c1csc(N2CCOCC2)n1	727116007	UGISCRKKKSZCHJ-GFCCVEGCSA-N	443.551	1.051	50	20	IDGD	
COc1ccc(CC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)cc1F	728213087	DZMJEOPOTXXINQ-UHFFFAOYSA-N	436.509	1.456	50	20	IDGD	
Cc1oc(C)c(S(N)(=O)=O)c1C(=O)NNC(=O)c1cc(F)ccc1Br	728549072	BOUBZDNXPIWLNW-UHFFFAOYSA-N	434.243	1.520	50	20	IDGD	
CN(C)CCOc1cccc(CNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1	728947920	VDYQIECGWSCPKB-UHFFFAOYSA-N	441.536	1.164	50	20	IDGD	
CCOC(=O)[C@H]1CCCN(C(=O)CN(C)C(=O)NNC(=O)CCCc2ccccc2)C1	728953797	BXSOWRHOKNJIMG-SFHVURJKSA-N	432.521	1.484	50	20	IDGD	
O=C(CNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)Nc1cccc2cccnc12	728961135	AEXWUGANTATFRE-UHFFFAOYSA-N	448.487	1.210	50	20	IDGD	
CS(=O)(=O)c1cc(C(=O)NNC(=O)CNc2ccccc2)ccc1Br	729513899	YDDXZOJORPQUFB-UHFFFAOYSA-N	426.292	1.726	50	20	IDGD	
CC(=NNC(=O)NC1CCCCC1)c1cccc(N(S(C)(=O)=O)S(C)(=O)=O)c1	729816278	GGQBVWZMVNTZPN-UHFFFAOYSA-N	430.552	1.768	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2ccc3c(c2)OCCO3)nnn1-c1ccc2ncccc2c1	731326939	HDMYYPNITUMCOH-UHFFFAOYSA-N	430.424	1.970	50	20	IDGD	
Cc1c(C(=O)NNC(=O)Cn2cnc3ccccc32)nnn1-c1cccc2ncccc12	731341337	BPZLMEOJMSZSAL-UHFFFAOYSA-N	426.440	1.935	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)NCc1cccc(OCCN2CCOCC2)c1	731361513	MALJEZDCPGDNCK-UHFFFAOYSA-N	430.480	1.610	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)NCCc1ccc(OCC(=O)NC2CC2)cc1	731498798	QLHOTNSNEISVIQ-UHFFFAOYSA-N	426.473	1.539	50	20	IDGD	
O=C1Cc2cc(S(=O)(=O)NNC(=O)c3cnn(-c4ccccc4)c3)c(Cl)cc2N1	733123164	VSMLWWVHAAJIFV-UHFFFAOYSA-N	431.861	1.644	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)Oc1ccccc1	733849833	OFKRZNIZOGDUBF-IBGZPJMESA-N	425.533	1.997	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)O[C@H]2CCN(C)C2=O)cc1	734889015	VHTPYEFSPYCPGI-OTMARIDSSA-N	437.456	1.115	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)N[C@H](C)CN1CCN(c2ccccn2)CC1	735517896	GSWBAYSAJZMMRM-QGZVFWFLSA-N	426.521	1.174	50	20	IDGD	
COC(=O)c1cc(Br)cc(S(=O)(=O)NNC(=O)c2ccc(C)cc2O)c1	736064361	SECSBQFHFUWGKW-UHFFFAOYSA-N	443.275	1.873	50	20	IDGD	
Cc1ccc(NCCCNC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c([N+](=O)[O-])c1	740488792	ALYSWJIHRMCTFQ-UHFFFAOYSA-N	449.489	1.753	50	20	IDGD	
CS(=O)(=O)CC[C@H](Cc1cccc(Br)c1)C(=O)NNc1ncccn1	741208805	JONOALZHKGNBPW-CYBMUJFWSA-N	427.324	1.976	50	20	IDGD	
CC(C)(NS(C)(=O)=O)C(=O)NNC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1	742034182	GGHFPSORMMYNGM-UHFFFAOYSA-N	442.501	1.023	50	20	IDGD	
CC(C)(C)OC(=O)N(CC(=O)NNC(=O)c1nnc(O)c2ccccc12)C[C@@H]1CCCO1	742034810	WOSPALCCVIHKEI-ZDUSSCGKSA-N	445.476	1.513	50	20	IDGD	
CCOC(=O)[C@H](C)NC(=O)c1ccc(NC(=O)NNC(=O)COc2ccccc2O)cc1	743221562	ROXUFDXFJYMARM-ZDUSSCGKSA-N	444.444	1.305	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)CNC(=O)c1ccco1)c1nc(-c2ccc(Cl)cc2)no1	743578217	VYPNXTBGFWXEMC-JTQLQIEISA-N	432.824	1.804	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NCc2cccc(-n3cncn3)c2)cc1	743619272	OEWIEKCOBAKIPW-UHFFFAOYSA-N	429.462	1.207	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)N[C@@H]2CC(=O)N([C@@H]3C[C@@H]3c3ccccc3)C2)c1	743702055	NNJKAZSGCSOZRW-NSISKUIASA-N	438.484	1.805	50	20	IDGD	
O=C(NNc1ncccn1)[C@H]1CCCCN1S(=O)(=O)c1ccc(Br)s1	743759992	ZILFMPLJXMYZKF-SNVBAGLBSA-N	446.352	1.987	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1C	744407113	LJKLBUZYZRBYGC-ZDUSSCGKSA-N	432.506	1.870	50	20	IDGD	
COc1ccccc1-c1nn(C)cc1C(=O)OCC(=O)NNC(=O)c1cccc(C#N)c1	745075763	HJFAWFVLWQAHDX-UHFFFAOYSA-N	433.424	1.585	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1ccccc1Cn1cncn1	745523671	NXXXSMLEBAETET-UHFFFAOYSA-N	443.847	1.606	50	20	IDGD	
CN(C)C(=O)NNC(=O)c1cc(S(=O)(=O)NCCOc2ccccc2)ccc1Cl	746012898	OLKOFDTZIYJKJT-UHFFFAOYSA-N	440.909	1.613	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)c1nccnc1C(=O)Nc1ccc(Cl)cc1	746291489	INFJIWSANZODHC-UHFFFAOYSA-N	432.868	1.448	50	20	IDGD	
CC[C@@H](NC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1)C1CCOCC1	746426338	PMFABTSLOOWLRS-QGZVFWFLSA-N	426.539	1.151	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1F)c1ccc2c(c1)S(=O)(=O)N(C1CC1)C2=O	747329040	DZVSEJUZURDITP-UHFFFAOYSA-N	437.836	1.861	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)COc2ccccc2O)ccc1NS(=O)(=O)C(F)(F)F	747383128	HQABAQWCVGZXDO-UHFFFAOYSA-N	447.391	1.802	50	20	IDGD	
CS(=O)(=O)c1ccc(OCCNC(=O)NNC(=O)c2ccc(Cl)cc2F)cc1	747583034	VHHFMGRRZDZOSH-UHFFFAOYSA-N	429.857	1.906	50	20	IDGD	
COc1cc(OC)c(S(=O)(=O)NNC(=O)NCc2ccco2)cc1Br	747608642	IPBBMCGONUEZMZ-UHFFFAOYSA-N	434.268	1.752	50	20	IDGD	
NC(=O)[C@@H]1CN(C(=O)C(=O)Nc2ccccc2S[C@H](Cl)C(F)(F)F)CCO1	748001593	MOQUFHHSZUWTSX-XPTSAGLGSA-N	425.816	1.557	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=S)N[C@@H](C)C3CC3)CC2)cc1	751617727	BXVRJMIXBCLMEH-ZDUSSCGKSA-N	440.591	1.390	50	20	IDGD	
COc1cc(OC)cc(N2C[C@H](C(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)CC2=O)c1	752510834	ZOMDDOWWPLUVLQ-CYBMUJFWSA-N	428.401	1.426	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(Cl)c(C(=O)NNc2cc(Cl)nc(N)n2)c1	753454356	RIZJZRAWSCSMCB-UHFFFAOYSA-N	435.293	1.047	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)NC2CCN(S(=O)(=O)C3CC3)CC2)c1C	753789451	MDRKNTQSCPAMJX-AQTBWJFISA-N	434.562	1.731	50	20	IDGD	
COC(=O)c1cc2c(cc1NC(=O)C(=O)NNC(=O)COc1ccc(Cl)cc1)OCO2	753841968	WGKVUOWWIGJNBV-UHFFFAOYSA-N	449.803	1.020	50	20	IDGD	
Cc1c(C(=O)NNc2ccccc2S(=O)(=O)NC(C)(C)C)cccc1S(N)(=O)=O	754085173	UNBXZBIQKCLHFS-UHFFFAOYSA-N	440.547	1.476	50	20	IDGD	
CC(C)Cn1c(=O)nc(O)c2c(C(=O)NNC(=O)CC(F)(F)F)cc(C(C)C)nc21	754425345	UEEYZJQKJXUSFX-UHFFFAOYSA-N	429.399	1.990	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cc3cc(F)ccc3oc2=O)cc1OC	754593127	MOGJCFTYHGMYHG-UHFFFAOYSA-N	444.371	1.567	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@@]23CCC(=O)N2c2ccccc2S3)c2ccccc2c1=O	754717635	VEWCQWXDYFZFCU-QFIPXVFZSA-N	449.492	1.806	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2cccs2)n(-c2ccccc2)n1)N[C@@H]1CCS(=O)(=O)C1	755229271	BCBICHVGMXCMFQ-CYBMUJFWSA-N	445.526	1.732	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)c2cc3ccccc3cc2O)n([C@@H]2CCS(=O)(=O)C2)n1	755535549	QJSTWOXUPOEBCH-OAHLLOKOSA-N	443.485	1.876	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)Nc1ccc(CN2C(=O)CCC2=O)cc1	755663963	RJCLQKKNCMCRBM-UHFFFAOYSA-N	434.250	1.893	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)Nc1ccc(S(=O)(=O)NCC2CC2)cc1	756785074	RWIOBLJQYOPFLU-GOSISDBHSA-N	446.485	1.368	50	20	IDGD	
CC[C@H](NC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1)c1c(C)noc1C	757780078	IROGWFDGQXOJJT-INIZCTEOSA-N	437.522	1.702	50	20	IDGD	
O=C(c1ccc(-n2ccnc2S)cc1)N1CCN(S(=O)(=O)CBr)CC1	758534116	CALNCZFTONERDU-UHFFFAOYSA-N	445.364	1.601	50	20	IDGD	
O=C(NC[C@H]1CSCCN1Cc1ccccc1)NNC(=O)[C@@H]1COc2ccccc2O1	759199902	HBJJOCGYCOIGHD-PXNSSMCTSA-N	442.541	1.774	50	20	IDGD	
C[C@@H](CO)CCCNC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	759630252	AUFTVBFDZYKFHG-CYBMUJFWSA-N	440.547	1.902	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1)NC1CC(F)(F)C1	759723488	WWGVQVFVYWMTCY-UHFFFAOYSA-N	438.456	1.907	50	20	IDGD	
CC1(C)C(=O)N(C[C@@](C)(O)C(=O)NNC(=O)COCc2ccccc2)c2ccccc21	760351941	IXUYENPVBFYZPD-HSZRJFAPSA-N	425.485	1.426	50	20	IDGD	
COCCn1ncc2ccc(NC(=O)C(=O)NNC(=O)COc3cc(C)cc(C)c3)cc21	763647597	NYUSUBVWSYKOAH-UHFFFAOYSA-N	439.472	1.464	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccn(-c2ccccc2Cl)n1	763663365	HSJQNDYQESZKEK-UHFFFAOYSA-N	443.847	1.699	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(C)cc1C(=O)OC	763679859	DMWRONDFXNGIKR-UHFFFAOYSA-N	429.429	1.345	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(C(=O)OC)ccc1F	763684228	HQJJVRMZOMTUFF-UHFFFAOYSA-N	433.392	1.176	50	20	IDGD	
O=C(COc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1cccc(N2CCNC2=O)c1	763685250	AABNPWRGKKFPIP-UHFFFAOYSA-N	431.836	1.035	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)CSc2ccc(Cl)cc2)cn1	763732144	APRUDCPWYPRXKE-UHFFFAOYSA-N	442.906	1.017	50	20	IDGD	
CN1C(=O)c2ccc(NC(=O)C(=O)NNC(=O)CC34CC5CC(CC(C5)C3)C4)cc2C1=O	763732718	GRUYIDVENNZEAV-UHFFFAOYSA-N	438.484	1.605	50	20	IDGD	
O=C(CSc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1cnn(CC(F)(F)F)c1	763736856	WGSWWRPOSKIZJQ-UHFFFAOYSA-N	435.815	1.977	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc(OCCC(C)C)cc2)n(CCC#N)n1	763767906	NQOCEPDBHKVWPL-UHFFFAOYSA-N	426.477	1.930	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)C(=O)Nc1cc(Br)ccc1F	763791401	QVDLORHFGNAGRW-UHFFFAOYSA-N	448.208	1.637	50	20	IDGD	
COC(=O)[C@@H](C)Cc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C)cc2)cc1	763821404	PKSKKHHQXNQHMF-HNNXBMFYSA-N	427.457	1.512	50	20	IDGD	
COCCOc1ccccc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1cccc(C)c1C	763849745	MSKQFXZIAUFOTQ-MRXNPFEDSA-N	429.473	1.882	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccccc2N(C)C(C)=O)cc1	763861893	SWGSNBFXIRHISE-CQSZACIVSA-N	442.472	1.621	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)CC(C)C)n([C@@H]2CCN(Cc3ccccc3)C2)n1	763888778	QQGDHRXKVLGBQQ-GOSISDBHSA-N	426.521	1.771	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccc(CCN2CCOCC2)cc1	763919185	SLQORWMBKCNWIO-UHFFFAOYSA-N	428.464	1.029	50	20	IDGD	
N#Cc1c(F)cccc1-n1ccc(NC(=O)C(=O)NNC(=O)Cc2ccc(Cl)cc2)n1	763931169	DCWMRMVNSICBFI-UHFFFAOYSA-N	440.822	1.865	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3cccc(-n4cnnn4)c3)cc2C1	763943903	VPSYCQZSMJIJNS-LLVKDONJSA-N	425.474	1.248	50	20	IDGD	
Cc1ccccc1-n1nccc1NC(=O)C(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	763950153	TXCNZITZGAAMBQ-UHFFFAOYSA-N	445.439	1.472	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)C(=O)Nc1ccc(N2CCCC2=O)cc1	763995122	MRUOXHISKJSTRB-UHFFFAOYSA-N	434.250	1.304	50	20	IDGD	
CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)NNC(=O)CSc1ccccc1O	764047073	OXUHOWLCRIHCMS-QGZVFWFLSA-N	444.488	2.000	50	20	IDGD	
CCCN1C(=O)CCc2cc(NC(=O)C(=O)NNC(=O)c3ccc(Cl)nc3)ccc21	764099636	BTNZDOUFACDGRU-UHFFFAOYSA-N	429.864	1.824	50	20	IDGD	
COc1c(Br)cc(Cl)cc1NC(=O)C(=O)NNC(=O)c1cc(C)[nH]n1	764108661	LUQOZSUNSBCFKR-UHFFFAOYSA-N	430.646	1.542	50	20	IDGD	
CS(=O)(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)CCC2CCCCC2)cc1F	764218638	RYIXSZGAZFQZEM-UHFFFAOYSA-N	427.498	1.817	50	20	IDGD	
CO[C@@H](C)C(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)CCCc2ccccc2)c1	764224376	PKURVYUUBHTILS-HNNXBMFYSA-N	426.473	1.769	50	20	IDGD	
CC(C)Oc1ccc(NC(=O)C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c(F)c1	764259776	JEVOOVFIRKRIGR-UHFFFAOYSA-N	444.467	1.405	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1cc(C2CC2)nn1-c1ccccc1	764278023	OXDUJHVJBUZGHQ-UHFFFAOYSA-N	435.440	1.620	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)c1cc(Br)cc(Cl)c1O	764345124	ODMSQKOAJMOORH-UHFFFAOYSA-N	427.642	1.394	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)C(=O)Nc1cccc(C(=O)N2CCCCC2)c1	764363539	RLYWSXQZBOXVFV-UHFFFAOYSA-N	438.484	1.615	50	20	IDGD	
CC(=O)N1CCc2cc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc3ccccc3)ccc21	764379755	JDEAMMFWTXMAAE-UHFFFAOYSA-N	432.383	1.353	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)CSc2ccccc2OC)cc1NC(C)=O	764396718	AVEILNXTKIGDEV-UHFFFAOYSA-N	446.485	1.540	50	20	IDGD	
C[C@H](CC(=O)NNC(=O)CNC(=O)c1ccco1)C1CCN(C(=O)OC(C)(C)C)CC1	765384533	YZBRPPGERSPFRE-CQSZACIVSA-N	436.509	1.830	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1cc(F)c(I)c(F)c1	766261357	VPTDJOQKQPCLKP-UHFFFAOYSA-N	449.155	1.450	50	20	IDGD	
COc1ccc(F)cc1CN1CCN(CC(=O)NNC(=O)Cc2ccccc2C)CC1	766828742	BAMONTNTILPQNQ-UHFFFAOYSA-N	428.508	1.650	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)N2CCC(C(=O)NCCCO)CC2)c(C)n1C[C@H]1CCCO1	769333669	FHGGCOFJKPTFPC-QJUACMODSA-N	442.560	1.928	50	20	IDGD	
CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)NNC(=O)CNC(=O)c1cccs1	769535726	RCHUVMVPZVANMC-QGZVFWFLSA-N	431.562	1.965	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)c3ccc(S(=O)(=O)N(C)C)nc3)n[nH]2)c1	770244806	JPCXCKJVMDTTCJ-UHFFFAOYSA-N	442.501	1.414	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1ccc(C(N)=O)cc1)C(=O)NNc1ccnc2cc(Cl)ccc12	770952329	MRHANLWOFMYDTE-LLVKDONJSA-N	447.904	1.797	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)[C@H]1CC(=O)N(c2c(F)cccc2F)C1	771148805	JMOJRQRXWQASOS-HNNXBMFYSA-N	445.422	1.559	50	20	IDGD	
CC(C)(C)NS(=O)(=O)Cc1cccc(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2)c1	773643348	OQFULBCIHNHMCP-UHFFFAOYSA-N	449.489	1.895	50	20	IDGD	
CS(=O)(=O)CCOc1cccc(NC(=O)C(=O)NNc2ccc3ccccc3n2)c1	773654805	NGFHLSHEGYFUDL-UHFFFAOYSA-N	428.470	1.740	50	20	IDGD	
CS(=O)(=O)CCOc1cccc(NC(=O)C(=O)NNc2ncc(Cl)cc2Cl)c1	773677554	OZBLRZZYMZLHHS-UHFFFAOYSA-N	447.300	1.894	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(OC)c(NC(=O)C(=O)NNc2cccc(C#N)c2)c1	773699826	ZVVMDZCUNGDODD-UHFFFAOYSA-N	445.501	1.679	50	20	IDGD	
CN1CCCCC/C1=N/S(=O)(=O)c1cccc(NC(=O)C(=O)NNc2ncccn2)c1	773723800	FIHMNKIXTZMOKG-XYGWBWBKSA-N	445.505	1.151	50	20	IDGD	
COc1ccc(F)cc1CC(=O)NNC(=O)CN1CCN(Cc2ccc(C)cc2)CC1	773857486	KKGPDQUBKKTJLF-UHFFFAOYSA-N	428.508	1.650	50	20	IDGD	
CCOC(=O)c1c(NC(=O)NNC(=O)c2cccc(N(C)C)c2)c(C#N)cn1CCOC	775768087	XCBRHNAWNVZWKW-UHFFFAOYSA-N	442.476	1.715	50	20	IDGD	
COc1cccc([C@@H]2[C@H](C(=O)NNC(=O)c3ccc4c(c3)OCO4)CC(=O)N2C2CC2)c1	776447824	OWRXKVLDIWTLBB-DYESRHJHSA-N	437.452	1.937	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)Nc2ccccc2OCC(=O)N2CCOCC2)c1	776472851	AXAJRAVXJVROPC-UHFFFAOYSA-N	448.501	1.476	50	20	IDGD	
Cc1cc(=O)n(CC(=O)NC(C)C)c(C)c1C(=O)NNc1cccc(S(C)(=O)=O)c1	776714437	CSOFSMYNFHHYLJ-UHFFFAOYSA-N	434.518	1.150	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cnn([C@@H](C)C3CC3)c2)cc1	778708345	YXRXDRHVKFJUJA-UONOGXRCSA-N	429.477	1.806	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)N[C@H]1CCN(c2ccc(Cl)c(F)c2)C1	778716290	VOEWSMHKJXNSNU-NSHDSACASA-N	429.880	1.913	50	20	IDGD	
C[C@@H](O)c1cn(C2CN(C(=O)CCC(=O)C(C#N)=C3N(C)c4ccccc4N3C)C2)nn1	779562292	NNBQUAJRGKNENI-CQSZACIVSA-N	435.488	1.385	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-]	782061800	NNCVHMMNIUHJPH-CQSZACIVSA-N	433.442	1.370	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cnn(C)c2C(F)(F)F)cc1	782121071	RBUCLPWDKZOXLP-JTQLQIEISA-N	443.382	1.391	50	20	IDGD	
C[C@H](C(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(O)cc2)c1)n1cccn1	782834553	YNHZUMZNSABTKO-CYBMUJFWSA-N	436.428	1.188	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2ccc3nc(-c4ccccn4)oc3c2)CCS(=O)(=O)C1	783426582	NSFWMUNJJKTDJK-LJQANCHMSA-N	429.458	1.026	50	20	IDGD	
CS(=O)(=O)c1cccc(Cl)c1C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	784096267	ZKNPSZWLDWBNMO-UHFFFAOYSA-N	437.909	1.211	50	20	IDGD	
COC(=O)CCOc1ccc(NC(=O)C(=O)NNc2ccc(Br)cn2)cc1	784339093	JHVCMHYFGUUBAS-UHFFFAOYSA-N	437.250	1.868	50	20	IDGD	
COC(=O)[C@@H]1CN(C(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2O1	784380095	MMRFQAWXJDPWMS-HNNXBMFYSA-N	434.792	1.659	50	20	IDGD	
O=C(NNc1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(S(=O)(=O)C[C@@H]2CCCO2)cc1	784828802	UNAFETAFCFFCCJ-INIZCTEOSA-N	448.457	1.629	50	20	IDGD	
COc1cccc(NNC(=O)C(=O)N2C[C@@H](CC(=O)N(C)C)c3cc(Cl)ccc32)n1	784846762	VHMWOBVHUMOKTM-GFCCVEGCSA-N	431.880	1.795	50	20	IDGD	
O=C(NNc1ccc(C(F)(F)F)nn1)C(=O)Nc1cc(F)cc(N2CCOCC2)c1	784885794	BNROGTQKSYSFCK-UHFFFAOYSA-N	428.346	1.553	50	20	IDGD	
O=C(NNC(=O)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-])N[C@@H]1CCS(=O)(=O)C1	784892311	DDASUJJHWRREFI-CQSZACIVSA-N	448.457	1.305	50	20	IDGD	
N#Cc1ccc(NNC(=O)C(=O)Nc2ccc(N3CCCS3(=O)=O)cc2)cc1Cl	785085691	CONYPYZWBZFVNO-UHFFFAOYSA-N	433.877	1.833	50	20	IDGD	
N#Cc1ccc(NNC(=O)C(=O)Nc2ncn(CC(=O)N3CCCCCC3)n2)cc1Cl	785092238	VEUURZOEEZTPKS-UHFFFAOYSA-N	444.883	1.288	50	20	IDGD	
Cc1ccc(Br)nc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	786687581	MEFJGZYHONSYPH-UHFFFAOYSA-N	441.307	1.478	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1cccc(N2CCNC2=O)c1C	787544952	ZJDJXDZTEAVKEY-UHFFFAOYSA-N	445.863	1.586	50	20	IDGD	
COc1ccc(NC(=O)NNc2cc(Cl)nc(N)n2)cc1S(=O)(=O)NC1CC1	789105969	IYYCDMOHFOAQTF-UHFFFAOYSA-N	427.874	1.310	50	20	IDGD	
COc1nc(Br)ccc1NC(=O)NNC(=O)COc1ccccc1[N+](=O)[O-]	789387107	LKIOUHKCXMZQEP-UHFFFAOYSA-N	440.210	1.993	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)cccc1NC(=O)N(C)C	792357029	XXZVOUGDJUZZNK-UHFFFAOYSA-N	445.501	1.672	50	20	IDGD	
C[C@@H](NC(=O)c1ccc(Br)s1)C(=O)N([C@@H]1CCS(=O)(=O)C1)N(C)C	792854061	INMNNKWNSTVLSO-NXEZZACHSA-N	438.369	1.121	50	20	IDGD	
COc1ccc(Cn2cc(NC(=O)C(=O)NNC(=O)c3cc(Cl)ccc3O)cn2)cc1	793022339	VUJRWIUNCPAGGC-UHFFFAOYSA-N	443.847	1.699	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2ccc(C)c(Br)n2)c1	793023569	RUFHHVKDRGBLSJ-UHFFFAOYSA-N	435.278	1.934	50	20	IDGD	
Cc1nc(C#N)c(N2CCC(C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)CC2)o1	793749037	OIHGSFRVXHSFDO-UHFFFAOYSA-N	434.497	1.523	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2nnn(Cc3cc(C)no3)c2C)cc1Br	794319893	JKOVZCXSSHRTAV-UHFFFAOYSA-N	449.265	1.777	50	20	IDGD	
Cc1cncc(CCC(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)c1	794392108	FYIYZKBZRKLYJD-UHFFFAOYSA-N	429.952	1.941	50	20	IDGD	
O=C(CNS(=O)(=O)c1c[nH]c2ncccc12)NNC(=O)c1cc2c(s1)CCCCC2	794799718	PDEYRGWUBZMDCP-UHFFFAOYSA-N	447.542	1.633	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](c2nnc(SCC(=O)NNC(=O)C3CC3)o2)C1	795262266	MCOZJGJOUIMKEV-LBPRGKRZSA-N	425.511	1.834	50	20	IDGD	
CN(C(=O)[C@H]1CCN(C(=O)NNC(=O)CNC(=O)c2cccs2)C1)c1ccccc1	797607180	GYKLEGZGGWJKBR-AWEZNQCLSA-N	429.502	1.204	50	20	IDGD	
Cc1ccc(-c2n[nH]c(SCC(=O)NNC(=O)[C@@H]3COc4ccccc4O3)n2)cc1	799324616	IRALYLODOMSKEW-INIZCTEOSA-N	425.470	1.860	50	20	IDGD	
Cc1ccc(-n2c(C)cc(/C=C(\C#N)C(=O)NCCC(=O)NS(C)(=O)=O)c2C)cc1	800551069	OMCKOYFPGXUVCM-LDADJPATSA-N	428.514	1.892	50	20	IDGD	
COCCOc1cncc(C(=O)NNC(=O)c2ccc(CSc3nncn3C)cc2)c1	801102339	LWPPEHKYSDEAGS-UHFFFAOYSA-N	442.501	1.602	50	20	IDGD	
O=C(CCCS(=O)(=O)N1CCCC1)NNC(=O)Nc1ccc(Br)cc1	801994365	ONVGVJDUQILJOV-UHFFFAOYSA-N	433.328	1.808	50	20	IDGD	
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC[C@H](C(=O)NNc2ccc3c(=O)[nH]ccc3c2)C1	803437979	YDXVICBYKHUVRB-HNNXBMFYSA-N	444.517	1.412	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)c(C)c1OC	804458699	NLZHVXGXBPDFDN-UHFFFAOYSA-N	440.500	1.231	50	20	IDGD	
CCc1nnc(NC(=O)[C@@H](C)[C@@H](C)NC(=O)NNC(=O)COc2cccc(C)c2)s1	804867054	FGWPSQMEEIMUFG-QWHCGFSZSA-N	434.522	1.781	50	20	IDGD	
O=C(NNC(=O)c1[nH]cnc1C(=O)c1ccccc1)c1csc(N2CCOCC2)n1	806337784	IDZVNGKAINXGSL-UHFFFAOYSA-N	426.458	1.009	50	20	IDGD	
O=C(Cn1cc(Cl)cn1)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	806348329	ZUGPPDHVWVASLE-UHFFFAOYSA-N	436.863	1.700	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(CNC(=O)NNc2ccc3c(=O)[nH]ccc3c2)cc1	806454296	RXVYDIXFSFLFBE-UHFFFAOYSA-N	445.501	1.279	50	20	IDGD	
CN(C1CCN(C(=O)OC(C)(C)C)CC1)S(=O)(=O)NNC(=O)c1ccc(C#N)cc1	808085867	QGBHBLMYGDRDIH-UHFFFAOYSA-N	437.522	1.369	50	20	IDGD	
N#Cc1ncn(-c2ccccc2NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCCCC3)n1	810384353	JVXUWLGEPMJFFY-UHFFFAOYSA-N	449.496	1.869	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(Br)cc1)NNc1cnc2ccccc2n1	811461502	MINIUOXSZKBJKR-UHFFFAOYSA-N	436.291	1.814	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCC[C@](CO)(Cc3ccccc3)C2)cc1OC	812874085	VBRJDVKEGDBEBB-DEOSSOPVSA-N	441.528	1.782	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)[C@@H](O)c1ccc(Cl)cc1F	813467420	GVOVRMQDBHKBBZ-KRWDZBQOSA-N	443.884	1.677	50	20	IDGD	
CC(CCc1ccc(O[C@@H](C)C(=O)O)cc1)=NNC(=O)CSc1nnc(O)nc1O	814785200	SSWJRXYIYMQEFY-NSHDSACASA-N	435.462	1.352	50	20	IDGD	
CC(C)(C)c1csc(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1C#N	815564564	MMCOCOPCZBBDOI-HNNXBMFYSA-N	428.470	1.843	50	20	IDGD	
COc1c(F)cc(F)cc1NC(=O)C(=O)NNc1ccccc1S(=O)(=O)N(C)C	815751866	ROVHBSGAAYICBZ-UHFFFAOYSA-N	428.417	1.306	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1cc(F)cc(N2CCOCC2)c1	857431962	UNVJVUJKEDRPRO-UHFFFAOYSA-N	449.508	1.339	50	20	IDGD	
Cc1nc(N)sc1C(=O)NN=Cc1ccc(C=NNC(=O)c2sc(N)nc2C)cc1	874105928	RJUIBEMCHBULAZ-UHFFFAOYSA-N	442.530	1.909	50	20	IDGD	
Cc1cc(Cl)ccc1OCCCC(=O)NNC(=O)CN1C(=O)[C@@H]2[C@@H](C1=O)[C@H]1C=C[C@H]2C1	913110594	PTHHWOFISCLIFF-FEBSWUBLSA-N	445.903	1.762	50	20	IDGD	
CC(=NNC(=O)c1cccc(S(C)(=O)=O)c1)c1ccc(O)c(CN2CCOCC2)c1	915052675	VQVSXWDFZNKQOI-UHFFFAOYSA-N	431.514	1.782	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNC(=O)CN(C)S(=O)(=O)c2cccnc2)cc1	915131647	MUMGRUQTPJJHOA-UHFFFAOYSA-N	434.518	1.588	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)CNS(=O)(=O)c2ccc(Cl)cc2)c1C	915787932	NRXAMNMQLHHDSA-AWEZNQCLSA-N	439.921	1.850	50	20	IDGD	
O=C(NC[C@H](c1ccc(F)cc1)N1CCOCC1)NNc1ccc(-n2cccn2)nn1	915898138	SFROTLCTAKSPIL-QGZVFWFLSA-N	426.456	1.501	50	20	IDGD	
C[C@@H](CCc1ccc(O)cc1)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	916235232	FIUCACCXQQVOSC-AWEZNQCLSA-N	434.518	1.608	50	20	IDGD	
COCc1ccc(CNC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1	916425394	MZPBCNQRCXCVQJ-UHFFFAOYSA-N	434.518	1.293	50	20	IDGD	
C[C@@H]1CCCN([C@H](C)CNC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)C1	916450123	CMTUHGPQBWQBFU-WOJBJXKFSA-N	430.597	1.650	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NNC(=O)c2ccc3ccccc3c2)c1	918779748	AGQUCMTZRSYJTB-UHFFFAOYSA-N	426.454	1.532	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)OCC(=O)NCCOc2ccc3c(c2)OCO3)cc(C#N)n1C	919043965	DOEXLGQCCJEYSY-APSNUPSMSA-N	436.424	1.579	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)NCCCN1CCN(C)C[C@H]1c1ccccc1	919904192	AFWQZSQLRXSRFU-NRFANRHFSA-N	439.560	1.947	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NCc2cccc(NC(=O)[C@@H]3CCCO3)c2)cc1	920238351	VQHWYCFHWKUIRV-IBGZPJMESA-N	442.472	1.722	50	20	IDGD	
O=C(CN1CCCC1=O)NNC(=O)[C@@H]1CCCN1C(=O)c1cc(Cl)ccc1Cl	920435051	BKKBECXIFWHSRJ-AWEZNQCLSA-N	427.288	1.368	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2cc(C(=O)NNC(=O)NC3CC3)ccc2Cl)C[C@H](C)O1	920766529	PHPXRPRLFRIXPS-QWRGUYRKSA-N	430.914	1.244	50	20	IDGD	
CO[C@H](C)c1nc(CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)cs1	1116220231	HJQGVKGNRIFZQO-SNVBAGLBSA-N	426.524	1.288	50	20	IDGD	
COc1ccccc1[C@]1(C)NC(=O)N(CC(=O)NNc2cncc(Br)c2)C1=O	1116399712	IYOCDQXYQXCWCA-SFHVURJKSA-N	448.277	1.763	50	20	IDGD	
CN1CCN(C(=O)NNC(=O)CN(CCNC(=O)OC(C)(C)C)Cc2ccccc2)CC1	1323356298	MERGCXAUWPAABL-UHFFFAOYSA-N	448.568	1.002	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2cc(C(C)(C)C)nn2C)cc1	1342365306	DVBOUJWUJFMVSZ-UHFFFAOYSA-N	436.538	1.499	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnc4[nH]ncc4c3)C2)C1	1778416954	UAAZZUGKCWHDNT-ZWKOTPCHSA-N	426.304	1.638	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccn3cncc3c2)C1	1779115059	LYRVDPSJWRUDLB-DBXWQHBBSA-N	434.924	1.716	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cc(Cl)cnc1O)CCO2	1779294295	FNAZWPUTGJYEQJ-GOSISDBHSA-N	427.961	1.736	50	20	IDGD	
C[C@@H](C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(Cl)Cl)C2)n1ccccc1=O	1779530115	AJXFFCZZQSDTKW-IQUTYRLHSA-N	430.332	1.727	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](F)Br)C2)nc1	1780773702	RNZIFAYCIZAPIB-RVKKMQEKSA-N	444.301	1.908	50	20	IDGD	
O=C(c1c[nH]c2cnccc12)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781331942	SIBQDIBYDTZXOR-YOEHRIQHSA-N	425.258	1.697	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](F)Br)C3)C2)nn1C(F)F	1781334474	NZSWVCFZCOCONJ-NHYWBVRUSA-N	439.232	1.721	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1cc[nH]n1)C2	1781905792	UYINJLUIQFFWSC-HDMKZQKVSA-N	427.343	1.640	50	20	IDGD	
Cc1n[nH]c(C)c1CC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)Br)C1	1782003574	NROGMSMNQRDILF-JOKNJTHLSA-N	441.370	1.866	50	20	IDGD	
CN(C)c1c(F)cc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)cc1F	1782104850	IESAUWHVUMYDCV-BEFAXECRSA-N	431.867	1.074	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnn3ccncc13)C2	1782172468	CKLXPNQCUCZIBB-WRWLIDTKSA-N	435.912	1.111	50	20	IDGD	
CSCC[C@H](O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Br)C2	1782232273	DXAWIKVRGKNDKT-VPWBDBDCSA-N	441.363	1.305	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cccn4nccc34)C2)C1	1782335310	CWRICBUZFKXQIU-DNVCBOLYSA-N	435.322	1.951	50	20	IDGD	
CCC[C@H](NC(C)=O)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](Br)CC)C2)C1	1783351814	BHYZNOIAIVQWIG-RLFYNMQTSA-N	432.359	1.295	50	20	IDGD	
CC(=O)Nc1ccc(CC(=O)N2CCO[C@]3(CCN(C(=O)C(Cl)Cl)C3)C2)cc1	1783947691	GXCBPEOVOFYERS-LJQANCHMSA-N	428.316	1.821	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(=O)oc3)C[C@@H]21	1783967112	BTJBRVTZTZFTEB-DHMWGJHJSA-N	427.295	1.264	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(F)(F)C(F)F)[C@H]2C1	1784886900	DDGJZTWKQVQUPZ-NAKRPEOUSA-N	433.240	1.898	50	20	IDGD	
CN(C)C(=O)c1cccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)c1	1785286132	WNBLLFUEQIGEAL-LJQANCHMSA-N	428.316	1.636	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)[C@H](O)c1ccccc1	1786670983	SDJGZKYRCYUZLI-NBOOPKSLSA-N	425.323	1.485	50	20	IDGD	
Nc1c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]3C2)sc2nccnc12	1787445838	OJCMJWLCCCZWKV-QSDJMHMYSA-N	427.889	1.401	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1(c2ccc(NC(=O)C(=O)N(C)C)cc2)CCC1	1787923170	UGILQHOUSDSDBX-VULFUBBASA-N	438.488	1.343	50	20	IDGD	
C[C@@H](Nc1cnccn1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]21	1788629748	XBMMCYLCEBJPFR-FACIQBDNSA-N	444.363	1.493	50	20	IDGD	
Cc1nc(F)ccc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]2C1	1789924809	XEWKYOHYBZTHGE-GZCFXPHUSA-N	432.265	1.813	50	20	IDGD	
Cc1noc(C)c1CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]2C1	1791055235	PHRACYJGUWOFHR-AFCVYNCWSA-N	428.327	1.597	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ncc(F)cc3F)C[C@@H]21	1791055384	VADJRWIFNASOPD-IHOMSZDFSA-N	432.265	1.737	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnn4cccc(F)c34)C[C@@H]21	1791256825	JAKUXIRNZPAHPM-FAYQHZLMSA-N	438.887	1.321	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc4c(c3)CCO4)C[C@@H]21)C(Cl)Cl	1791296374	QWHUZURSCPQTBP-ZOBUZTSGSA-N	427.328	1.947	50	20	IDGD	
Cn1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]3C2)c2cccnc21	1791298199	HQXTVNJGCCFVPD-WHOFXGATSA-N	425.316	1.970	50	20	IDGD	
O=C(CCN1CCCC1)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1	1792366781	AEZFBTMSMXYTCQ-UHFFFAOYSA-N	435.333	1.600	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(Cl)nc1)C2	1792867143	YMPYMRVIGHMJPT-DNVSUFBTSA-N	430.730	1.969	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c[nH]c3c(Cl)cccc13)C2)[C@@H](O)CCl	1792983149	BALACBVUDQNNLL-OJXGSEEGSA-N	426.300	1.624	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@](F)(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](O)CCl)C1	1793111831	YCTUMGOUFGHRNG-MTCCJSQRSA-N	447.935	1.573	50	20	IDGD	
CC[C@@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnccc1C(=O)NN)C2)N(CC)CC	1793687939	JZKOQEAMFWWEGD-RCJHGTSTSA-N	430.553	1.057	50	20	IDGD	
Cc1cc(NC(=O)CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CCBr)no1	1795492515	OHEXCDXSIHXLGS-CLLJXQQHSA-N	427.299	1.735	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1c[nH]c2nccc-2c1	1796197496	OTEBHRDESFRZDS-NXEZDXNNSA-N	425.316	1.954	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1c(F)cncc1F)C2	1796892007	VVGLMNLDJVXOSZ-BTSNSQKGSA-N	444.442	1.746	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2n(n1)CCCNC2=O	1797968983	MBBJYVXTICYQLO-JHXTVGTDSA-N	442.347	1.505	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1c[nH]c2ccccc12	1799904871	UQXFDVXBZWPJAY-BCDXTJNWSA-N	425.533	1.722	50	20	IDGD	
C[C@H](NC(=O)c1ccccn1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](F)Br	1800161872	QRNDEIFQSCLKJC-AIUMHDJVSA-N	441.301	1.529	50	20	IDGD	
COc1c(C)cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CCC(=O)NN(C)C)C3)cc1C	1800610954	NYHOLQSSYIGENF-REPLKXPHSA-N	430.549	1.937	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1C[C@H]1c1ccc(F)c(F)c1)C2	1800970673	GYZLWUCZDZPEIO-AOWFHFJHSA-N	442.890	1.912	50	20	IDGD	
CC(C)OC(=O)c1ncccc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(Cl)Cl	1801015949	SCRPXJPLOXAOGI-DABQJJPHSA-N	444.315	1.654	50	20	IDGD	
COCCOCCOCCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](F)Br)C2	1802085857	LJHBAZXNTYHNER-HLPPOEQASA-N	439.322	1.385	50	20	IDGD	
O=C(CC(=O)N1CCC2(CCCN(C(=O)[C@@H](O)CCl)C2)CC1)Nc1ccc(F)cc1	1805525567	ZAHNWCVMYCYFKG-KRWDZBQOSA-N	439.915	1.985	50	20	IDGD	
O=C(C[C@H]1CCCCO1)N1CCCC2(CCN(C(=O)c3cccc(B(O)O)c3)CC2)C1	1806591797	GYBOVOFGDKEHAD-HXUWFJFHSA-N	428.338	1.170	50	20	IDGD	
C=CCC(F)(F)C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1807374501	ZSBJLZJGAKZJRD-PKOBYXMFSA-N	443.259	1.292	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@H]1CCN(C(=O)[C@H]2CCC(=O)N2)[C@H]1c1cccnc1	1808296577	SCGWNIVGEBFRFR-ZLHSVIROSA-N	427.332	1.602	50	20	IDGD	
COCCC(=O)N1CC[C@H](CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@@H]1c1cccnc1	1808415596	ZDRRKRBBRGAIPE-QOZRKGCKSA-N	440.504	1.258	50	20	IDGD	
O=C(O)c1cnncc1C(=O)NC[C@H]1CCN(C(=O)C(Cl)Cl)[C@@H]1c1cccnc1	1810804773	UZMKOMRUECFQDE-BXUZGUMPSA-N	438.271	1.693	50	20	IDGD	
O=C(COc1ccc(O)nn1)NC[C@@H]1CCN(C(=O)C(Cl)Cl)[C@H]1c1cccnc1	1812353460	QBGRREZDYFXNDK-LRDDRELGSA-N	440.287	1.466	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)[C@H](C)CC(N)=O)[C@H]1c1cccnc1	1812774242	NHIJSYHENKSXNI-DYWXZXKOSA-N	439.354	1.772	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)CCSC(=N)N)[C@H]1c1cccnc1	1812864807	RLGOBWJYSNSZAZ-LNSITVRQSA-N	442.383	1.888	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)c2cccc(=O)n2O)[C@H]1c1cccnc1	1812865686	RUAMJZOIEVFJAE-JDFRZJQESA-N	449.305	1.584	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1	1813030533	IZMGQTIBTBBFSR-QIIPPGSGSA-N	434.880	1.461	50	20	IDGD	
Cc1cc[nH]c1C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1813069732	BBCCTQUFUFLTPQ-DYESRHJHSA-N	426.521	1.411	50	20	IDGD	
Cc1occc1C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1	1815339894	SIMGKVKOWOUUSD-CQSZACIVSA-N	425.275	1.264	50	20	IDGD	
CC(C)[C@@H](S)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1	1815350257	MCOGZASEGOOKNJ-CZUORRHYSA-N	433.364	1.003	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CN2CC(=O)NC2=O)n[nH]1	1815668366	YCGBSWUBPZAQLD-GTNSWQLSSA-N	445.307	1.190	50	20	IDGD	
COc1ncc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)[C@@H](O)CCl)[nH]n2)cc1F	1816149775	FQKGOXFYGLBYNU-KBPBESRZSA-N	425.848	1.858	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnc(N(C)C)o2)n[nH]1	1816330845	KKDKUMOKVLRDII-AWEZNQCLSA-N	446.512	1.143	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](F)Br)CC2)c1cnc(O)nc1O	1817087676	VOVASPFVCXUKIM-MLUIRONXSA-N	446.258	1.261	50	20	IDGD	
C[C@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1)n1cccc1	1817480037	ZSWSRWZAIYOXMJ-DNVCBOLYSA-N	435.293	1.458	50	20	IDGD	
O=C(CN1CCOC1=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1	1822999636	VRSFCMFSBZYMOD-RDDDGLTNSA-N	435.275	1.198	50	20	IDGD	
COc1cc(C(=O)N[C@H]2CCc3nc(NC(=O)[C@H](F)Br)sc3C2)n(C)n1	1823001867	MBXHFTSCCDVJQV-MADCSZMMSA-N	446.302	1.802	50	20	IDGD	
O=C(N[C@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1)c1cc(O)nc(O)c1	1823003381	ILTMEPXELZKPPK-JVXZTZIISA-N	445.270	1.866	50	20	IDGD	
Cc1cc(C(=O)N[C@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)cnc1C	1826080428	KKMLTJCBSJKWGJ-HNNXBMFYSA-N	444.561	1.754	50	20	IDGD	
Cc1ccnc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)c1	1827052929	OYIQBECWMKOJDP-QFIPXVFZSA-N	435.333	1.617	50	20	IDGD	
Cc1cnc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)s1	1827055781	FPHCCDQKCAMCKE-LJQANCHMSA-N	441.362	1.678	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(O)cc3)C2)C1	1830543564	URKXRYQEFOMOSF-LIRRHRJNSA-N	441.322	1.493	50	20	IDGD	
CCCC(=O)N[C@H](C)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H](Cl)CCC)CCO2)C1	1831651588	RPLCBFGREMDIHH-GUXCAODWSA-N	431.961	1.155	50	20	IDGD	
Cc1cc(CC(=O)N2CCC([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)on1	1831871936	XCIPJPKWTCGTAG-LJQANCHMSA-N	433.553	1.518	50	20	IDGD	
Cc1nnsc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1	1831873277	OLAHFEZLNRCXQB-INIZCTEOSA-N	436.582	1.453	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cnc4ccoc4c3)CC2)CC1)[C@H](O)CCl	1833310893	XWELBRNMIUVOMY-GOSISDBHSA-N	434.924	1.613	50	20	IDGD	
C[C@@H](Oc1ccccc1)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)CCl)CC2)CC1	1833312050	JEOQQVAPMWOVJN-UZLBHIALSA-N	437.968	1.625	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)Cc3c[nH]c4ccccc34)CC2)CC1)[C@H](O)CCl	1833313528	JSABGXMJGZNLML-OAQYLSRUSA-N	446.979	1.882	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)CSCC(=O)OC)CC2)CC1	1833530142	MMAPMXGHISYWLL-QGZVFWFLSA-N	448.029	1.872	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)C(=O)c3ccccc3)CCO2)C1	1834708247	YECZLQSKORPZLH-LIRRHRJNSA-N	439.306	1.109	50	20	IDGD	
Cc1ncsc1C(=O)N1CCOC[C@]2(CN(C(=O)CCBr)CCO2)C1	1834819324	NGZFLDARXONKPE-INIZCTEOSA-N	432.340	1.307	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3cccc(F)c3)CCO2)C1	1835028881	XZLWIUSPBIWBRU-FXAWDEMLSA-N	428.888	1.078	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cnn4ncccc34)CC2)CC1	1835040514	PTWHMJCMYZGCJW-GOSISDBHSA-N	448.955	1.168	50	20	IDGD	
O=C1Cc2cc(C(=O)N3CCC(N4CCC(NC(=O)[C@@H](F)Cl)CC4)CC3)ccc2N1	1835080162	FRNUBLKAIAOQIS-LJQANCHMSA-N	436.915	1.901	50	20	IDGD	
C=CC[C@@H](C)C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1	1835738069	BEXGFXFVMHTPOS-MRXNPFEDSA-N	442.564	1.083	50	20	IDGD	
Cc1ccc2oc(C(=O)N3CCO[C@]4(COCCN(C(=O)[C@H](F)Cl)C4)C3)cc2n1	1836264915	MTEVOTPZPDGKTN-QFBILLFUSA-N	425.844	1.741	50	20	IDGD	
C[C@@H](Oc1ccccn1)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836720372	RTBUBDWLDCEXCW-QAPCUYQASA-N	439.940	1.447	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4c(c3)CNC4=O)C2)C1	1839145986	SNVUJYNIUDFAIR-UTKZUKDTSA-N	435.908	1.017	50	20	IDGD	
COc1cccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)n1	1839151658	ZNSNBZUVRDQELS-RBUKOAKNSA-N	446.331	1.397	50	20	IDGD	
Cc1ccnc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)c1	1839152452	ZUGBMOMDCUMRRH-RBUKOAKNSA-N	430.332	1.696	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3cnccn3)C2)C1	1839155151	KTLNDKZCUFRTIN-RBUKOAKNSA-N	445.347	1.102	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(C)c(C)n3)C2)C1	1840151075	VXHUUTXOAIRUOT-OXJNMPFZSA-N	425.913	1.022	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccc(Cl)cc3)C2)C1	1840151562	FWSMWWCXYXEIDT-PXNSSMCTSA-N	445.343	1.593	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)cc1Cl	1840732040	GVWSUTRWWYBNLF-QAPCUYQASA-N	435.279	1.953	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)c2cc(-c3ccccc3)on2)C1	1840993873	CFAKGYCFTVTVFC-UHFFFAOYSA-N	431.257	1.152	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)CN2CCCC2)C1	1841092184	KVTJFRSSYCWKIT-UHFFFAOYSA-N	430.461	1.433	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)C2(c3ccccc3)CCCC2)C1	1841215244	QSLGTPWDJHKAHJ-UHFFFAOYSA-N	432.329	1.695	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCCC12CN(C(=O)c1ccc(O)nc1)C2	1841924714	TUEFGFXLWDOHQG-AWEZNQCLSA-N	438.912	1.736	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2ccc(Cl)nc2F)C1	1842143442	BJIZCHUQZDZZJD-UHFFFAOYSA-N	432.843	1.003	50	20	IDGD	
O=C(CCn1c(=O)oc2ccccc21)N1CC2(CCCN2C(=O)[C@H](F)Br)C1	1845216219	CHEHLMASYPPTQS-HNNXBMFYSA-N	440.269	1.879	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)C[C@@H](O)CNC(=O)OC(C)(C)C)C1	1845229035	YZDWDBOLKGFUNY-CABCVRRESA-N	431.961	1.873	50	20	IDGD	
Cc1ccc(C(=O)NCC(=O)N2CCCC23CN(C(=O)[C@H](C)CBr)C3)cc1	1847065063	BLMZRXIHKMJNTQ-OAHLLOKOSA-N	436.350	1.959	50	20	IDGD	
CCN1CCN(c2ccc(C(=O)N3CC[C@H]4[C@@H]3CCN4C(=O)[C@@H](O)CCl)cc2)CC1	1847567766	DBJNUNULZOYOQO-UFYCRDLUSA-N	434.968	1.244	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H]1CCc2ccoc2C1	1847661897	ZBQZBTKGVUQEBA-GWCYAMNJSA-N	437.500	1.720	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1ccc(=O)oc1	1848095606	DFAXUGJDIQYQCT-KKUMJFAQSA-N	439.896	1.587	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CCc1cnccc1C	1848208446	ODUGBSNPLFGLFT-FMEPYYHXSA-N	436.516	1.658	50	20	IDGD	
COc1ccc(/C=C/C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1OC	3377875	NVXSLYZWENWJBB-ONNFQVAWSA-N	429.385	1.630	50	20	IDGD	
COc1ccc(-c2nnc(SCC(=O)NNC(=O)c3ccccc3)n2N)cc1OC	3531622	TVZNTRGQENDJAS-UHFFFAOYSA-N	428.474	1.229	50	20	IDGD	
COC(=O)c1cc(CNC(=O)NNC(=O)Cc2nc3ccccc3n2C)ccc1OC	9753105	BENHKRQNAPRGMF-UHFFFAOYSA-N	425.445	1.442	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2ccc(OC)c(OC)c2OC)c2ccccc2c1=O	17189523	BJUDXAFEVIJSMK-UHFFFAOYSA-N	426.429	1.517	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NNC(=O)c2cc(-c3ccccc3)n[nH]2)cc1	17519596	WSPSHIOKYQNHQE-AWEZNQCLSA-N	427.486	1.513	50	20	IDGD	
CCS(=O)(=O)N1CCC(C(=O)NNC(=O)[C@@H](C)Oc2ccc3ccccc3c2)CC1	18053035	MKLBTZPQOXERMM-OAHLLOKOSA-N	433.530	1.816	50	20	IDGD	
C[C@H](NS(=O)(=O)c1ccc(Cl)cc1)C(=O)NNC(=O)[C@@H](C)Oc1ccccc1F	18054840	AUCPLGWFFLWPSV-NWDGAFQWSA-N	443.884	1.761	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc2c1O[C@@H](C)C2	26745590	BMXWUTTYGRDCBK-LBPRGKRZSA-N	433.486	1.344	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCN(c2ccc([N+](=O)[O-])cc2)CC1	28928290	NDRAHELUSBJFEB-UHFFFAOYSA-N	447.879	1.840	50	20	IDGD	
COc1ccc(F)cc1CN1CCN(CC(=O)NNC(=O)Cc2nc(C)cs2)CC1	29158125	ROBNAOIXCBNDLB-UHFFFAOYSA-N	435.525	1.107	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)c1ccc(CNC(=O)C2CCCC2)cc1	727791260	NQFGITQUPMQDLU-UHFFFAOYSA-N	428.514	1.746	50	20	IDGD	
C[C@@H](NC(=O)c1n[nH]c2ccccc12)C(=O)NNC(=O)c1ccc(Br)s1	728203118	GEYIPRJMCXWDPC-MRVPVSSYSA-N	436.291	1.966	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)Cc2ccc(S(N)(=O)=O)cc2)cc1OC	728312291	LBRPYHOUKLPQRK-UHFFFAOYSA-N	435.502	1.525	50	20	IDGD	
COc1ccc(CC(=O)O)cc1S(=O)(=O)NNC(=O)c1cccc(OC(F)F)c1	728510684	QNOYRBHLRIGBHR-UHFFFAOYSA-N	430.385	1.547	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)[C@H]2CC(=O)N(C[C@@H]3CCCN3CC)C2)cc1	729625936	FDUIEIWZVIDVCH-SQNIBIBYSA-N	446.548	1.333	50	20	IDGD	
O=C(Cc1cn2cc(Cl)cc(Cl)c2n1)NNC(=O)c1ccc(-n2cnnn2)cc1	729629163	QXVIUXKDMZOFCK-UHFFFAOYSA-N	431.243	1.621	50	20	IDGD	
Cc1ccc(-c2nnn(CC(=O)NNc3ccc(S(=O)(=O)NC4CC4)cc3)n2)cc1	730076165	YECAWYAVQQLONY-UHFFFAOYSA-N	427.490	1.233	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	730831517	LXQSDMYYSFXZAN-CQSZACIVSA-N	440.522	1.434	50	20	IDGD	
CS(=O)(=O)CCCC(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1	731188481	BTCCVVOBHZVYCT-HXUWFJFHSA-N	429.542	1.586	50	20	IDGD	
CN(C)C(=O)CN1CCC(NC(=O)NNC(=O)CCSc2ccc(F)cc2)CC1	731761796	FUZZUCIXOJJGAF-UHFFFAOYSA-N	425.530	1.191	50	20	IDGD	
COC(=O)c1cc(OC(=O)CN2C(=O)N[C@@](C)(c3ccc(F)cc3)C2=O)ccc1[N+](=O)[O-]	732652929	WUJNZCVWURNFGF-FQEVSTJZSA-N	445.359	1.893	50	20	IDGD	
CCOCCCn1c(NNC(=O)c2cnc3cc(C)ccn3c2=O)nc2ccccc2c1=O	733268267	JLAFYNVQXVWPIN-UHFFFAOYSA-N	448.483	1.896	50	20	IDGD	
O=C(NC[C@@]1(N2CCOCC2)CCSC1)NNC(=O)c1cnn(-c2ccccc2)c1	733342795	IVABVWQGABLHBT-FQEVSTJZSA-N	430.534	1.024	50	20	IDGD	
Cc1nn(-c2ccccc2)c2sc(C(=O)NNC(=O)NCCN3C(=O)CCC3=O)cc12	733847440	ATKQOOUNZFVXJT-UHFFFAOYSA-N	440.485	1.488	50	20	IDGD	
CCc1nc(COc2ccc(C(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)cc2)no1	734318101	KZIQCGDHFGCDBA-UHFFFAOYSA-N	444.469	1.689	50	20	IDGD	
CC(=O)NCC(=O)N1CCc2cc(C(=O)NNC(=S)Nc3cccc(Cl)c3)ccc21	735704229	UKOPMRUNTBWYTN-UHFFFAOYSA-N	445.932	1.997	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@@H]2CCC[C@@H]2NC(=O)OC(C)(C)C)c2ccccc2c1=O	739679123	PHVYPAIQIGENEP-CVEARBPZSA-N	443.504	1.871	50	20	IDGD	
COc1ccc(-c2nn(CCC#N)cc2/C=C(\C#N)C(=O)N2CCN(C)C(=O)C2)cc1OC	740836325	GWAXPCHJLQMJSG-GZTJUZNOSA-N	448.483	1.689	50	20	IDGD	
CCCc1ncc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)s1	741879689	MCYKZYPXENKRSM-UHFFFAOYSA-N	438.531	1.191	50	20	IDGD	
Cn1nnnc1-c1cccc(S(=O)(=O)NNC(=O)c2cc3c(s2)CCCCC3)c1	742025930	LLLZGZDCEYFVKW-UHFFFAOYSA-N	432.531	1.831	50	20	IDGD	
Cc1ccc(N2CC[C@@H](NC(=O)NNC(=O)C3CCN(c4ncccn4)CC3)C2=O)cc1	743588555	CCRBSUAUVMZVEZ-GOSISDBHSA-N	437.504	1.137	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)CCCNC(=O)c2ccc(F)cc2)cc1	743830382	CZYPLOASVHQHJE-UHFFFAOYSA-N	436.465	1.592	50	20	IDGD	
CC(=O)N1C[C@@H](C(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)Oc2ccccc21	743831116	PXIATBJNHIZUEL-KRWDZBQOSA-N	432.458	1.057	50	20	IDGD	
C[C@H](C(=O)NNC(=O)c1c(Cl)cccc1Cl)N1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O	744362205	XNQFERFUVCDDEZ-KNKYVABDSA-N	426.256	1.305	50	20	IDGD	
Cc1ccc(CN2C[C@H](C(=O)OCC(=O)NNC(=O)c3ccc(C#N)cc3)CC2=O)cc1	744461355	AHQZMLYJOGULAD-LJQANCHMSA-N	434.452	1.220	50	20	IDGD	
CC(C)S(=O)(=O)c1ccccc1C(=O)OCC(=O)NNC(=O)c1ccc(C#N)cc1	744733450	IMQLMTFOHUTCQT-UHFFFAOYSA-N	429.454	1.358	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCCCOC2CCOCC2)nc1	745845039	FXGDFICJMRVTPE-UHFFFAOYSA-N	429.543	1.324	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)C[C@H]2C=CS(=O)(=O)C2)cc(OCC)c1OCC	746076660	ZCKWUGGEXXLQSO-CYBMUJFWSA-N	426.491	1.592	50	20	IDGD	
CC(C)(C)C(=O)Cn1cc(C(=O)NNC(=O)COc2ccc(Br)cc2)nn1	746094588	MRVQYDPMDIEGSJ-UHFFFAOYSA-N	438.282	1.496	50	20	IDGD	
COC(=O)[C@H]1CCC[C@H](C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)C1	746332848	QHGGARYGCOXWPJ-GJZGRUSLSA-N	425.507	1.130	50	20	IDGD	
CCO[C@@H](CCNC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)C(C)C	746420234	JEYZVDXHOOLSCP-SFHVURJKSA-N	440.566	1.866	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)CN1CCN(C(=O)OCc2ccccc2)CC1	747387546	VZIOGVQQSBZDRP-UHFFFAOYSA-N	428.464	1.470	50	20	IDGD	
COC(=O)c1ccc(S(=O)(=O)NNC(=O)c2cccc3cccnc23)c([N+](=O)[O-])c1	747407478	HRXOGHBBWNMORT-UHFFFAOYSA-N	430.398	1.553	50	20	IDGD	
CC(=O)c1cccc(S(=O)(=O)NCCC(=O)NNC(=O)c2ccc(Cl)cc2F)c1	747516071	XNKKIQSVFZOFQU-UHFFFAOYSA-N	441.868	1.811	50	20	IDGD	
CC(C)c1nc(C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)nn1-c1ccccc1Cl	748232185	KOZJXQUGDIYYJQ-NSHDSACASA-N	440.913	1.175	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NC1CCN(C2CCCC2)CC1	748982867	MQHLQMQBLTXADU-UHFFFAOYSA-N	436.582	1.639	50	20	IDGD	
O=C(NCC1CCOCC1)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	749187596	ZQWHRGOQSIBMNH-UHFFFAOYSA-N	435.488	1.759	50	20	IDGD	
O=C(NNc1nc(Br)cn2ccnc12)c1cc([N+](=O)[O-])cc2c1OCCO2	750247633	PVTBHNVLIPQBDP-UHFFFAOYSA-N	435.194	1.928	50	20	IDGD	
C[C@H]1C[C@@H](C)CN(c2ccc(C(=O)NNC(=O)CNC(=O)c3ccco3)cc2[N+](=O)[O-])C1	751212809	YPRLDZVNIQTJRO-OKILXGFUSA-N	443.460	1.861	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)c2ccc(F)c(S(=O)(=O)NC)c2)o1	752515131	NSKCRIKKBQUUIE-UHFFFAOYSA-N	426.470	1.243	50	20	IDGD	
N#C/C(=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)NCc1nc(O)n[nH]1	754355076	MZSGOWQEKZBZBO-KPKJPENVSA-N	440.851	1.126	50	20	IDGD	
C[C@@H](OC(=O)/C(C#N)=C/c1ccc(O)cc1)C(=O)NCCc1ccc(S(N)(=O)=O)cc1	754541463	ODQIRLACYATGSV-RFRKOGIWSA-N	443.481	1.237	50	20	IDGD	
COc1ccc2c(c1)C=C(C(=O)NNC(=O)c1sc(N3CCOCC3)nc1C)CO2	755049692	PXBRDQNINZRPSL-UHFFFAOYSA-N	430.486	1.534	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1OC	755373425	FWNHOBWXWDICKM-UHFFFAOYSA-N	436.490	1.486	50	20	IDGD	
CC(C)N(C)S(=O)(=O)c1ccc(NC(=O)NNC(=O)COc2ccc(C#N)cc2)cc1	755450953	HCYLKRGWDQQYIQ-UHFFFAOYSA-N	445.501	1.819	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)NCCN2C(=O)[C@@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2=O)c1C	755459112	NRPYAZBRQBLYOJ-ZYPGPYSCSA-N	436.512	1.582	50	20	IDGD	
CCN(CCNC(=O)NNC(=O)c1nn(-c2ccccc2)cc1O)CCC(F)(F)F	755856449	KAQGDWLXJODXIA-UHFFFAOYSA-N	428.415	1.796	50	20	IDGD	
CCNC(=O)c1ccc(NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1	755942157	YOWHHHPGDVPMLH-UHFFFAOYSA-N	438.532	1.801	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(N3C[C@H]4CC[C@H]3C4)cc2)cc1	756164906	QWSWYGNGJJSRKG-LPHOPBHVSA-N	433.468	1.712	50	20	IDGD	
C[C@@H]1CCC[C@@H](C)N1C(=O)COc1ccc(C(=O)NNc2ccc(C(N)=O)nn2)cc1	757402715	OJINZCGPMHIOSD-ZIAGYGMSSA-N	426.477	1.501	50	20	IDGD	
COCc1nc2n(n1)C[C@H](NC(=O)NNC(=O)[C@@H](C)Oc1ccc3ccccc3c1)CC2	757773482	CFMBHWOLYYGKFU-RHSMWYFYSA-N	438.488	1.690	50	20	IDGD	
CCOc1ccc(C(=O)NNS(=O)(=O)c2cccc(S(=O)(=O)CC)c2)cc1OC	760333989	CEBUVJPZBRQTGQ-UHFFFAOYSA-N	442.515	1.511	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=S)NCC3CCN(C)CC3)n[nH]2)cc1OC	760497058	RBCYLJXTKBSPJF-UHFFFAOYSA-N	432.550	1.545	50	20	IDGD	
COC(=O)c1nc(Cl)ccc1S(=O)(=O)NNC(=O)CSc1ccccc1O	763412768	NXVIUOYHPIWSKH-UHFFFAOYSA-N	431.879	1.329	50	20	IDGD	
CCN(c1ccccc1)S(=O)(=O)c1cc(NC(=O)C(=O)NNC(C)=O)ccc1Cl	763515928	DYFNVJYAXPWGAU-UHFFFAOYSA-N	438.893	1.661	50	20	IDGD	
O=C(NNC(=O)c1ccccc1O)C(=O)Nc1ccccc1I	763528200	NEJNSPXQJMYMJX-UHFFFAOYSA-N	425.182	1.397	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)C(=O)Nc1cccc(C(F)F)c1	763532391	ZBWUHCDMPRIZAC-UHFFFAOYSA-N	445.470	1.922	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)C[C@@H](OC)C3)cc(OC)c1OC	763538612	DZWYIZFDGRWISR-INIZCTEOSA-N	443.456	1.226	50	20	IDGD	
Cc1ccc(Oc2ccc(NC(=O)C(=O)NNC(=O)c3ccc4c(c3)OCO4)cc2)nn1	763552158	WFLJNICIERHKBM-UHFFFAOYSA-N	435.396	1.706	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)c(Br)n1	763674636	OTXLHPNJGKBQAH-UHFFFAOYSA-N	432.234	1.189	50	20	IDGD	
Cc1nc(-c2cccc(NC(=O)C(=O)NNC(=O)COc3ccc(C#N)cc3)c2)oc1C	763675705	ZFHHSUNSRMZMDX-UHFFFAOYSA-N	433.424	1.995	50	20	IDGD	
COC(=O)N(C)Cc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)cc1	763695345	RUZOGGGUWGWCRS-UHFFFAOYSA-N	448.863	1.703	50	20	IDGD	
O=C(COc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1cncc(Br)c1	763695363	SKMVQJXFNWZZNO-UHFFFAOYSA-N	427.642	1.662	50	20	IDGD	
O=C(COc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1ccnn1Cc1ccccc1	763695774	WNVLJBLJMMYREK-UHFFFAOYSA-N	427.848	1.750	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2ccc(F)cc2OCC(F)F)c1	763771712	FDICFTUTLCPFJN-UHFFFAOYSA-N	441.362	1.887	50	20	IDGD	
CNC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cc(OC)cc(OC)c2)ccc1Cl	763772644	NZGPZWHCGSWBHW-UHFFFAOYSA-N	434.836	1.117	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)C(=O)Nc2cc(-c3ccccc3)ns2)c2ccccc2c1=O	763791715	XYOXMSCBRBIBQT-UHFFFAOYSA-N	448.464	1.457	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)C(=O)Nc1cccc(Br)c1	763804645	VDWJRXJZAWRIAF-UHFFFAOYSA-N	437.206	1.522	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)c1ccn(-c2ccc(Cl)c(Cl)c2)n1	763826410	ZBZUDASJDUBCTI-UHFFFAOYSA-N	433.255	1.765	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cnc(C(C)(C)C)nc2)cc1	763866430	PKKAIBNHTXWVIZ-CYBMUJFWSA-N	429.477	1.726	50	20	IDGD	
Cc1cc(S(C)(=O)=O)ccc1NC(=O)C(=O)NNC(=O)c1cc(Cl)ccc1O	763977974	CBGTWKNFPJGCBQ-UHFFFAOYSA-N	425.850	1.157	50	20	IDGD	
COCCOc1c(Cl)cc(NC(=O)C(=O)NNC(=O)c2cccn2C)cc1Cl	763992833	JLIOJXANSQJEBA-UHFFFAOYSA-N	429.260	1.757	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1ccc(NC(=O)C2CC2)nc1	764011852	KSPDCIQWHHRLOB-UHFFFAOYSA-N	431.836	1.492	50	20	IDGD	
O=C(COC(=O)c1cccc(OC(F)(F)F)c1)NNC(=O)[C@@H]1COc2ccccc2O1	764064604	QVWJFCHNLFSFFX-HNNXBMFYSA-N	440.330	1.729	50	20	IDGD	
CNC(=O)[C@H]1CN(C(=O)C(=O)NNC(=O)Cc2ccc3ccccc3c2)c2ccccc2O1	764083202	PZMDCKIAYSLDPQ-HXUWFJFHSA-N	446.463	1.070	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccc(C(=O)NC(C)C)c(C)c1	764136036	MBUMVCYTOPMATL-UHFFFAOYSA-N	426.473	1.470	50	20	IDGD	
CC(C)(C)CC(=O)NNC(=O)C(=O)Nc1cc(Cl)ccc1OCCS(C)(=O)=O	764198663	MQVPSDRVNHDLFB-UHFFFAOYSA-N	433.914	1.286	50	20	IDGD	
CN(C)CC(=O)NNC(=O)C(=O)Nc1ccc(NC(=O)OC(C)(C)C)cc1C(F)(F)F	764203936	MRGJPXHSXJRKKV-UHFFFAOYSA-N	447.414	1.700	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)C(=O)Nc1ccccc1-n1cc(Br)cn1	764297616	FDRCQGAQMSEHBA-UHFFFAOYSA-N	432.238	1.066	50	20	IDGD	
O=C(CCCc1cccs1)NNC(=O)C(=O)Nc1ccc(N2CCOCC2)c(F)c1	764344083	YXCSPVADYULFPG-UHFFFAOYSA-N	434.493	1.833	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(F)cc2I)o1	764370694	AURLSSOTJMWRHL-UHFFFAOYSA-N	431.161	1.731	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccnn3-c3ccncc3)n[nH]2)cc1C	764387839	MNKVVFRWYQULDM-UHFFFAOYSA-N	444.455	1.674	50	20	IDGD	
CC(C)(C)c1ncc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)cn1	764389184	ZAYMUISFGQJKCY-UHFFFAOYSA-N	425.424	1.703	50	20	IDGD	
COc1cc(F)c(NC(=O)C(=O)NNC(=O)CSc2ccccc2OC)cc1OC	764394152	XGWLPFKMKGPVRC-UHFFFAOYSA-N	437.449	1.730	50	20	IDGD	
COc1nccnc1NNC(=O)[C@@H](CCSC)NS(=O)(=O)c1ccc(C)cc1	764483949	JWTPEMCTSJLQBD-CQSZACIVSA-N	425.536	1.337	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNC(=O)[C@@H](C)S(=O)(=O)C2CCOCC2)cc1	764543341	LYOOHILIYDRAGM-OAHLLOKOSA-N	426.535	1.855	50	20	IDGD	
COc1cccc2cc(C(=O)NNC(=O)CN3CCN(C(=O)c4ccccc4)CC3)oc12	765736742	ADUCKAKXDWRZTN-UHFFFAOYSA-N	436.468	1.660	50	20	IDGD	
COc1ccnc(NNC(=O)N[C@@H]2CCN(c3ccc(Br)c(C)c3)C2=O)n1	765914727	DOOAOLGBBYHOOK-CYBMUJFWSA-N	435.282	1.988	50	20	IDGD	
C[C@@H](O)C(=O)N1CCN(C(=O)/C(C#N)=C/c2cn(CCC#N)nc2-c2ccccc2)CC1	766017238	ZQBXNDOIUOPTOL-GMYFBSLISA-N	432.484	1.422	50	20	IDGD	
C[C@H](CC(=O)NNc1ncnc2ccsc12)NS(=O)(=O)c1cccnc1Cl	766671017	YOMJIZQTRKOQMW-SECBINFHSA-N	426.911	1.940	50	20	IDGD	
O=C(NNc1c(Cl)cc(F)cc1Cl)C1=NN([C@H]2CCS(=O)(=O)C2)C(=O)CC1	767397234	YAOZZTHJYVRYSB-VIFPVBQESA-N	437.280	1.741	50	20	IDGD	
O=C(CCC(=O)N1CC(=O)Nc2ccccc21)NNC(=O)c1cc(-c2cccs2)[nH]n1	768263640	WQPHVBCNFOQYPL-UHFFFAOYSA-N	438.469	1.665	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)CS[C@@H](C)C(=O)Nc1cc(C)on1	768636463	RXVFVSPEMGCMNA-NSHDSACASA-N	442.519	1.599	50	20	IDGD	
Cn1cc(C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c(-c2cccs2)n1	768672857	GMHLMVSVKHRONW-UHFFFAOYSA-N	429.414	1.675	50	20	IDGD	
N#Cc1ccc(OC2CCC(NC(=O)NNC(=O)COc3ccccc3C#N)CC2)nc1	769026048	QEHFQBOXOKYUIC-UHFFFAOYSA-N	434.456	1.924	50	20	IDGD	
O=C(NNC(=O)c1nccnc1-c1nc2ccccc2s1)c1ccc(-n2cnnn2)cc1	769596760	JSIBDWDQRKKQHB-UHFFFAOYSA-N	443.452	1.804	50	20	IDGD	
CN(C)S(=O)(=O)CCCS(=O)(=O)NNC(=O)c1cc2c(s1)CCCCCC2	769651759	RPVVXBJHPGCHOV-UHFFFAOYSA-N	437.609	1.253	50	20	IDGD	
CCc1nn(C)c(OC)c1CNC(=O)NNC(=O)COc1ccc(Br)cc1	772106226	IEQMYYWBHWTTJS-UHFFFAOYSA-N	440.298	1.663	50	20	IDGD	
CCCc1c(C(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)[nH]c(C)c1C(=O)OC	772883821	FRGSMOVOGJMVCZ-UHFFFAOYSA-N	434.880	1.793	50	20	IDGD	
Cc1ccc(-n2nnc(CC(=O)NNC(=O)C(=O)NCc3ccc(Cl)cc3)c2C)cc1	772899210	ZMAYFUFSQNLWER-UHFFFAOYSA-N	440.891	1.544	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)cc1	772972131	SNEAGJMGZBKIHY-UONOGXRCSA-N	439.921	1.930	50	20	IDGD	
CCCc1c(NC(=O)C(=O)NN[C@@]2(C)CCS(=O)(=O)C2)cnn1-c1cccc(C)c1	773646199	STITYMNJGRHSOU-FQEVSTJZSA-N	433.534	1.270	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN[C@@H](C)c2cc(OC)c(OC)cc2F)cc1OC	775424370	STPUURUXKGPXBC-LBPRGKRZSA-N	435.452	1.972	50	20	IDGD	
CN(C)C(=O)[C@@H]1CC[C@@H](CNC(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)O1	775461517	QZUFSTKRBCSOQV-AAEUAGOBSA-N	438.428	1.242	50	20	IDGD	
Cc1sc2ncc(C(=O)NNC(=O)c3cc(Br)ccc3O)c(=O)n2c1C	776231380	NIGDJEJFMFODLG-UHFFFAOYSA-N	437.275	1.916	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCN(Cc3ccc(C#N)cc3)CC2)cc1OC	776247558	FRCXRIDMKSZOGJ-UHFFFAOYSA-N	437.500	1.154	50	20	IDGD	
Cc1cc(C)n2nc(C)c(C(=O)N3CCN(S(=O)(=O)CBr)CC3)c2n1	777831618	FJGSBRIXXCMHKV-UHFFFAOYSA-N	430.328	1.095	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)NCCCN1CCN(c2ccccc2)CC1	778617844	ZAMZQHNIQYEBGO-UHFFFAOYSA-N	434.541	1.054	50	20	IDGD	
O=C(NNc1ccc([N+](=O)[O-])cc1Br)C(=O)Nc1ccc2c(c1)C(=O)NCC2	778754498	ZMFGNSWLPYQVOD-UHFFFAOYSA-N	448.233	1.725	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)Nc1ccnn1Cc1c(Cl)cccc1Cl	779471816	OMSLYSSOSOHUTE-SNVBAGLBSA-N	446.316	1.826	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2cn(C)nc2-c2cnn(C)c2)c2ccccc2c1=O	780171273	JYKHWOWSKXVOKD-UHFFFAOYSA-N	434.460	1.015	50	20	IDGD	
O=C(C[C@@H](O)c1ccc(OCc2ccccc2)cc1)NNC(=O)N[C@H]1CCS(=O)(=O)C1	780906658	FKKQZSSVLRFKTR-PKOBYXMFSA-N	447.513	1.207	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)N2CCC[C@@H]2C(=O)NNc2ccnc(F)c2)o1	781360674	HMOYZGYJVWZUKG-GFCCVEGCSA-N	426.426	1.287	50	20	IDGD	
CS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccn(-c3cccc(F)c3C#N)n2)cc1	783078413	YLIACKMKSFMEOW-UHFFFAOYSA-N	442.432	1.368	50	20	IDGD	
C=CCS(=O)(=O)CCNC(=O)NNC(=O)c1cc2c(C)nn(-c3ccccc3)c2s1	783304027	QTLOZGZVCGDLOQ-UHFFFAOYSA-N	447.542	1.940	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)[C@@H]3CO[C@H](C)C3)c2)cc1	784142966	DBRYMQUNLVRONG-HIFRSBDPSA-N	433.486	1.682	50	20	IDGD	
CCOC(=O)c1cn(C)nc1NC(=O)C(=O)NNc1nc(-c2ccc(Cl)cc2)no1	784799852	PSNLPKCMWZNPBP-UHFFFAOYSA-N	433.812	1.382	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2cc(F)c(F)cc2F)cc1	784891863	IBNZZBCDWGGZNU-UHFFFAOYSA-N	446.407	1.110	50	20	IDGD	
CC(C)n1cc2cc(NC(=O)C(=O)NNC(=O)c3cc([N+](=O)[O-])ccc3O)ccc2n1	785023636	MUGQZSRDYWRBGF-UHFFFAOYSA-N	426.389	1.631	50	20	IDGD	
C[C@@H](O)C(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2cccc(C(F)(F)F)c2)c1	786682928	MRYNWZXRZXDHLW-SNVBAGLBSA-N	431.392	1.648	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)C(=O)Nc2ccc(-c3ccco3)cc2F)c2ccccc2c1=O	787541860	XNQLACWRJQFCHC-UHFFFAOYSA-N	449.398	1.732	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)[C@@H]1CC(=O)N(c2cc(Cl)ccc2OC)C1	788163955	LZPSMKSSCPVJNE-GFCCVEGCSA-N	427.885	1.638	50	20	IDGD	
Cc1nn(C)c(-n2ccnc2C)c1C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	788301647	RHBVNGBSJFGIMP-UHFFFAOYSA-N	429.506	1.420	50	20	IDGD	
O=C(NNC(=O)[C@H]1OCC[C@H]1c1ccccc1)C(=O)Nc1ccccc1N1CCOC1=O	789810854	QYQVJCAIAVYWOI-YJBOKZPZSA-N	438.440	1.302	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cccc(N3CCC3=O)c2)cc1	790951052	BMMQGKANJZXKTE-AWEZNQCLSA-N	440.456	1.375	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)c2nnn(Cc3ccc(F)cc3F)c2C)cc1	792215409	FLSFKCBFUXMXSC-UHFFFAOYSA-N	430.415	1.795	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)NCCCCn2cc(Br)cn2)cc1	792223770	FTNQPOKOLVGLPR-UHFFFAOYSA-N	435.282	1.707	50	20	IDGD	
Cc1csc(C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)c1Cl	792334672	BJLXSTDFMRUSNA-UHFFFAOYSA-N	429.955	1.798	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)COc2ccc(C)c(C)c2)cc(-n2cccn2)c1	792352125	BFJTZSUIROAVSK-UHFFFAOYSA-N	437.456	1.663	50	20	IDGD	
COc1ccc2c(c1NC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1)CCC2	792460484	WMJVCQODRITZJC-UHFFFAOYSA-N	446.529	1.966	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)C(=O)Nc1cnc(CC2CC2)nc1	793023938	YMIXAARDWZSPSY-UHFFFAOYSA-N	448.277	1.357	50	20	IDGD	
Cc1c(S(=O)(=O)NNC(=O)c2nn(CCC(C)C)c(=O)c3ccccc23)cnn1C	793350191	HCINFPPIIGBDJT-UHFFFAOYSA-N	432.506	1.108	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N[C@H](C)[C@@H](C)OC)cc1	794004217	IFHKAKFSQOWHEX-FNBYNPPRSA-N	425.489	1.881	50	20	IDGD	
O=C(CN[C@H](CO)c1ccc(Br)cc1)NNC(=O)c1ccc([N+](=O)[O-])cc1	794825972	AIFMRRFHJRZSIU-OAHLLOKOSA-N	437.250	1.442	50	20	IDGD	
C[C@@H]1CCN(C(=O)OC(C)(C)C)[C@H](C)[C@H]1NCC(=O)NNC(=O)c1ccc(C#N)cc1	796658523	MWRZIPJMNDPKJT-CLCXKQKWSA-N	429.521	1.943	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)Nc2cc(Cl)ccc2OCCS(C)(=O)=O)n1	797631550	XKOCUSPOAARIKV-UHFFFAOYSA-N	426.882	1.933	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)N[C@H]1CC[C@@H](C(=O)N2CCCCC2)C1	798119582	JSDWNVHPGGHBOW-CABCVRRESA-N	433.465	1.485	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)NCCS(=O)(=O)CCc1ccccc1	800061619	FEARDVKTAGRTLX-UHFFFAOYSA-N	425.532	1.374	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2c(C)nn(C)c2Br)c2ccccc2c1=O	801103294	CYQINJUHQOECDS-UHFFFAOYSA-N	433.266	1.296	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1)NNC(=O)Nc1cc(F)cc(F)c1	802001863	XHYLPCRCHYKKEY-UHFFFAOYSA-N	443.388	1.394	50	20	IDGD	
O=C(Cc1ccc(NS(=O)(=O)c2cccs2)cc1)NNC(=O)N=c1cc[nH]cc1	802024999	OMMSTJIDFFUASO-UHFFFAOYSA-N	431.499	1.761	50	20	IDGD	
Cc1c(C(=O)NNC(=O)Nc2ccc3c(c2)OCO3)nnn1-c1cccc([N+](=O)[O-])c1	802099356	HPXOULGSRHFTHB-UHFFFAOYSA-N	425.361	1.679	50	20	IDGD	
C[C@H](CCNS(=O)(=O)c1ccccc1)NC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	802526830	LFKQUQFOJVVDRJ-CYBMUJFWSA-N	435.462	1.296	50	20	IDGD	
CC(C)(C)OC(=O)N1CCOC[C@H]1CC(=O)NNC(=O)c1cc(-c2cccs2)[nH]n1	802936564	AMSKTSOYHUHLHG-GFCCVEGCSA-N	435.506	1.925	50	20	IDGD	
CSCC[C@@H](NC(=O)c1cccc(C)c1)C(=O)NNc1ccc(-n2ccnc2)nn1	804957601	MKPDUVUXOWVYRW-MRXNPFEDSA-N	425.518	1.966	50	20	IDGD	
CCc1nnc(NC(=O)[C@H](C)[C@H](C)NC(=O)NNc2ccc(-n3ccnc3)nn2)s1	805881173	XNJOCIDSXATJFQ-MNOVXSKESA-N	430.498	1.366	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)Nc1ccc(F)c(N2CCCNC2=O)c1	806806242	MMKSUXHMJXBARU-UHFFFAOYSA-N	426.408	1.849	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(C(=O)N(C)CC)c2)o1	806977728	WQPIJGVLRIAMMR-UHFFFAOYSA-N	443.504	1.613	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C)c(C)c(NC(=O)C(=O)NNc2cccc(F)n2)c1	807392639	UMQAGRJHRFVNPD-UHFFFAOYSA-N	437.497	1.950	50	20	IDGD	
COC[C@]1(C(=O)NNC(=O)c2cc(OC)cc(OC)c2)CCN(C(=O)OC(C)(C)C)C1	809948989	VARINFJLHIADMJ-NRFANRHFSA-N	437.493	1.738	50	20	IDGD	
NC(=O)c1ccc(NC(=O)NNC(=O)COc2ccccc2F)c(OCC(F)F)c1	810307524	ZQTZTPCFYNIXKH-UHFFFAOYSA-N	426.351	1.800	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)C(=O)Nc1cnn(-c2ccc(F)cc2)c1C(F)(F)F	810384160	FUWGDXOHZLJIAE-UHFFFAOYSA-N	438.341	1.768	50	20	IDGD	
O=C1Nc2cc(Br)ccc2C1=NNC(=O)c1csc(N2CCOCC2)n1	812434662	WLHXNSVLGOLPRA-UHFFFAOYSA-N	436.291	1.828	50	20	IDGD	
Cc1ccc([C@H](CN2CCOCC2)NC(=O)NNC(=O)c2c(C)nc3ccccn23)cc1	813492399	LTKMRAGMALYOSK-IBGZPJMESA-N	436.516	1.969	50	20	IDGD	
COC(=O)C(C)(C)c1csc(NC(=O)C(=O)NNC(=O)COc2cccc(C)c2)n1	815564239	COJSOAGRQWFRJX-UHFFFAOYSA-N	434.474	1.067	50	20	IDGD	
CS(=O)(=O)CC[C@@H](Cc1cccc(Br)c1)C(=O)NNC(=O)CC1CC1	819114711	RLYQUYRRGDGILM-AWEZNQCLSA-N	431.352	1.990	50	20	IDGD	
CCn1c(NNC(=O)c2ccc(N3CCCS3(=O)=O)cc2)nc2ccccc2c1=O	823911231	DLJBDHDBDLSOOU-UHFFFAOYSA-N	427.486	1.713	50	20	IDGD	
Cc1cc(C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c2c(C)nn(C)c2n1	899606368	STOYRIRJLKZTLY-UHFFFAOYSA-N	426.389	1.111	50	20	IDGD	
Cc1c(NC(=O)[C@H](C)SCC(=O)NNc2ncccn2)c(=O)n(-c2ccccc2)n1C	913044406	WLISUWKUGNFXJI-AWEZNQCLSA-N	441.517	1.478	50	20	IDGD	
C=CCNC(=S)NNC(=O)[C@H](CCSC)NS(=O)(=O)/C=C\c1ccccc1	913435512	OFPQLNVWSUHOSK-WVUXNXBLSA-N	428.605	1.380	50	20	IDGD	
C=CCNC(=S)NNC(=O)c1ccc(Cl)c(S(=O)(=O)N2C[C@H](C)O[C@@H](C)C2)c1	913435557	ASSXPOVOQLKEDA-RYUDHWBXSA-N	446.982	1.433	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=S)Nc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1	913444437	SZQMAZIOAGMYMS-UHFFFAOYSA-N	445.526	1.211	50	20	IDGD	
CN(C)c1cc(C(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)ccn1	915808747	MZBWUBBNFYBKMN-UHFFFAOYSA-N	442.479	1.981	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NC[C@H](Cc2ccccc2)N(C)C)nc1	915899235	BMDWKLNIPBXRNI-KRWDZBQOSA-N	434.566	1.567	50	20	IDGD	
COc1ccccc1OCc1ccc(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)o1	916144901	WKJFZXVFVLQRFD-UHFFFAOYSA-N	434.412	1.918	50	20	IDGD	
CCCCn1c(C)cc(/C=C(/C#N)C(=O)N2CCN(C(=O)C(=O)NC3CC3)CC2)c1C	916409018	MTOYTLLUBWADBA-RGEXLXHISA-N	425.533	1.761	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCc2ccc(Cl)s2)cc1	916594700	MCHGNQPZRNVNIO-UHFFFAOYSA-N	430.939	1.861	50	20	IDGD	
CCCCS[C@H](C)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	918140981	GATATPXTURSEGH-CQSZACIVSA-N	429.564	1.390	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1OC	918217772	MLKDZJYERGFUNR-UHFFFAOYSA-N	432.452	1.824	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)NCc1cccc(OCC(=O)N(C)C)c1	918223429	HEDFXSONPVPFGR-AWEZNQCLSA-N	432.452	1.591	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1O)c1ccc2c(c1)C(=O)N(C[C@@H]1CCCO1)C2=O	918357438	FJXIXJNBMWWZFK-ZDUSSCGKSA-N	443.843	1.895	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)[C@@H](CSC)N2C(=O)[C@H]3CCCC[C@H]3C2=O)cc1	919836523	VWZCPKUBVSGPES-FGTMMUONSA-N	447.557	1.682	50	20	IDGD	
O=C(NCc1cccc(C(=O)NC[C@H]2CCCO2)c1)NNc1ccc(-n2cccn2)nn1	920349194	WGUOTXRNJMLXBD-QGZVFWFLSA-N	436.476	1.397	50	20	IDGD	
COc1cc(C=NNC(=O)N[C@H]2CCS(=O)(=O)C2)ccc1OC(=O)c1cccs1	920381037	NOHMYRNGJROVCU-ZDUSSCGKSA-N	437.499	1.796	50	20	IDGD	
CN(C)C(=O)C1(CNC(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)CCCC1	1318579552	YDDPZALUFQUPSE-UHFFFAOYSA-N	439.557	1.613	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2ccc([N+](=O)[O-])cc2Br)cc1	1319959069	BPVAQKYZNLKUJF-UHFFFAOYSA-N	430.236	1.989	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1nn(-c2ccccc2F)cc1Br	1321331524	VDQHPOUMBFMWIS-VIFPVBQESA-N	427.230	1.877	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1	1328625100	BNIGYRFKEDKOFW-UHFFFAOYSA-N	440.522	1.602	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccccc1)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1	1347361198	LHTRPTZPGHCVFD-UHFFFAOYSA-N	437.421	1.402	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(CCN(C(=O)c3cccc4c3OCCO4)C2)C1	1777836667	ASZFOVRCHZHTCE-NRFANRHFSA-N	434.565	1.753	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2)c1ccc2cnccc2n1	1778530208	AFKQKFAMQVGSEI-WAOWUJCRSA-N	432.908	1.357	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4c(c3)CNC4=O)C2)C1	1778723827	XSJGOIMZYVWTSU-OAQYLSRUSA-N	431.565	1.225	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cc3cccnc3nc1O)CCO2	1779299089	OSVGVQULVXMEJC-OAQYLSRUSA-N	444.564	1.630	50	20	IDGD	
O=C(c1ccn(C(F)F)n1)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1779617041	OUJKTRJFDZAJCC-YGRLFVJLSA-N	425.205	1.412	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(Cl)ncn3)C2)C1	1779819354	XOGIVGWVFZGSCF-BZNIZROVSA-N	431.718	1.747	50	20	IDGD	
Cc1ncc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](F)Br)C2)cn1	1780771052	RKSMJZMDFQQKSI-CKEIUWERSA-N	429.290	1.603	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCc1ncc[nH]1)C2)[C@H](F)Br	1780777634	VTFFPBWJCGUFEY-ISTRZQFTSA-N	431.306	1.547	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)c3cc4cccnn4n3)CCO2)C1	1781231259	IWODCEHKQNLAOQ-QZTJIDSGSA-N	426.304	1.409	50	20	IDGD	
O=C(c1nc2ccccc2[nH]1)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781329262	CIHHHZRTWYWPII-CXAGYDPISA-N	425.258	1.697	50	20	IDGD	
O=C(c1ccc2ccnn2c1)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781333427	OJEOZETXQBYMKD-WMLDXEAASA-N	425.258	1.468	50	20	IDGD	
N#Cc1ccccc1OCC(=O)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781334329	LDACIXFQEABXNY-FUHWJXTLSA-N	440.269	1.457	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H]1[C@H]3COC[C@H]31)C2	1781903810	DTOUSCSMTWSIJG-XPYFFNBCSA-N	429.355	1.566	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CN2CCCCC2=O)C1	1782100227	LEDXVFNFKOJLLU-CBGDNZLLSA-N	427.973	1.920	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H]1CC[C@H](C)CC1)C2	1782214482	RSIARCKMTGJIMR-FZONSQQESA-N	436.597	1.700	50	20	IDGD	
NC(=O)c1ncccc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C(Cl)Cl)C1	1782216082	ALRVFHMHRVFUOV-KZULUSFZSA-N	429.304	1.112	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)n2cccn2)C1	1782555034	SCEBZQUQLYJFDM-WFXMFSGNSA-N	441.370	1.989	50	20	IDGD	
O=C(Cc1cccc(C(F)(F)F)c1)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1782979460	MEXNXHPHNXOLSB-YJBOKZPZSA-N	434.842	1.678	50	20	IDGD	
CCOC(=O)C1(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](Br)CC)C3)C2)CC1	1783355851	YQYDEHAHZAOWGN-CXAGYDPISA-N	431.327	1.333	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)C[C@@H](N)c3cccnc3)CCO2)C1	1783532428	HTAGVRCCXCRSEH-JCKWVBRZSA-N	425.327	1.085	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cnc(C(F)(F)F)cn3)CCO2)C1	1783874213	ANBQROXGKIFMCK-MEDUHNTESA-N	436.818	1.193	50	20	IDGD	
CSCC[C@@H](O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]2C1	1783973449	AYFXYGJHUQDYFR-FQKPHLNHSA-N	437.400	1.111	50	20	IDGD	
Cc1ncc(/C=C/C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)s1	1784687669	BKCRBJHDIUZFCT-OZRQEOMLSA-N	432.315	1.985	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)COc3ccccc3C#N)C2)C1	1785383670	WFJGTPYOXKHBLG-IFXJQAMLSA-N	436.306	1.550	50	20	IDGD	
CN1CCC(C(=O)Nc2ccc(C3(NC(=O)c4ccc(B(O)O)cc4)CCC3)cc2)CC1	1785878036	QCSWUPWXVGPPME-UHFFFAOYSA-N	435.333	1.456	50	20	IDGD	
O=C(Cc1ccc(O)cn1)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1	1788149192	CJAMLUIEGGYICW-UHFFFAOYSA-N	445.284	1.457	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cn4cc(F)ccc4n3)[C@H]2C1	1788346090	LTKSUGFDLFAILV-FAYQHZLMSA-N	438.887	1.321	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=N/O[C@@H]3CCCCO3)C[C@@H]21	1788764270	IXKFAOQVDSYAOL-LIWHVUMVSA-N	441.601	1.347	50	20	IDGD	
C[C@@H](Oc1ccccn1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]2C1	1788766216	XHRCWGVRWJBBKG-OWSLCNJRSA-N	435.597	1.680	50	20	IDGD	
COc1cnc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]3C2)cn1	1789866458	PQSXVDUVMKDYKD-XBPIAWKYSA-N	431.320	1.315	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccccc3C(N)=O)[C@H]2C1	1790129422	NXESDESOAZWNBW-KNPMLCFXSA-N	438.322	1.162	50	20	IDGD	
CCOC(=O)O[C@@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CO[Si](C)(C)C)C[C@@H]21	1790608718	SGALYCPZPVMYIR-VGWMRTNUSA-N	430.574	1.379	50	20	IDGD	
CCOc1ncccc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](Br)CC)C2	1792382626	QHECCHPOZHJXNC-OCVGTWLNSA-N	440.338	1.857	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1csc(-c3cccnc3)n1)C2)[C@@H](O)CCl	1792978246	MOVKLEKALRBJEE-XRGAULLZSA-N	436.921	1.008	50	20	IDGD	
CN(C)[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](O)CCl)c1ccccc1Cl	1792983462	IOQYRWLYYLIRNA-KQIDPQQZSA-N	444.359	1.132	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCCC(=O)OC(C)(C)C	1793165596	GUQINLOIUNVDQY-BJWYYQGGSA-N	438.569	1.510	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)c1cccnc1-c1ccccc1	1796566077	FLMMRIWBOCLLTG-NBMJBFSESA-N	429.904	1.552	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cn2c(Cl)cccc2n1	1796854428	IXUGLAVDVIYQTN-IPJQOSJUSA-N	441.315	1.445	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1c(Br)cnn1C	1797253457	WHIXTKQLSSRVBT-LSCVPOLPSA-N	433.734	1.688	50	20	IDGD	
Cn1nc(C(F)(F)F)cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CO[Si](C)(C)C)C2	1798189123	FOFNIETVHGORNN-DRXBFXEBSA-N	448.518	1.494	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2cn[nH]c2cn1	1798259657	QIZHUZVWJJFNKY-CABXZLHPSA-N	448.487	1.344	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(N(C)C)nc1	1798268640	YXUZGNQENOFLPP-IVSAIRAKSA-N	439.354	1.524	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c[nH]c3cnccc13)C2)[C@@H](F)Br	1799349991	PCESDMXIQWCWMT-ANGCBRKESA-N	425.258	1.457	50	20	IDGD	
CC[C@H](CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2)NC(=O)OC(C)(C)C	1799368197	ZDBWKYNUDYINRN-RHBQXOTJSA-N	435.924	1.804	50	20	IDGD	
CC[C@H](C)[C@H](O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C#N)=C/c1ccc(F)cc1F	1800332508	RUROZUMXNSFVRK-SUADVCAXSA-N	447.482	1.868	50	20	IDGD	
COCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](Br)Cc1ccccc1	1800435727	MCWIEPCAQLRTOJ-DFGXFYAUSA-N	425.323	1.229	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Oc1ccccn1)C2	1800762915	KIPNCAALFKOODS-AQDIXCGQSA-N	426.311	1.222	50	20	IDGD	
CN(CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1C[C@@H]1F)NC(=O)NCc1ccccc1	1801497744	ZWGPAPRTHSGYQJ-PJVZLEMVSA-N	431.512	1.329	50	20	IDGD	
CC[C@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1(N3CCN(C)CC3)CC1)C2	1801804391	ZFENOWMNDDTROC-YVSFHVDLSA-N	441.414	1.578	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](C)Br	1801961702	PBXNGRJRMUNKBR-VYZKQCBTSA-N	438.326	1.542	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCN1Cc3ccccc3C1=O)C2	1802273246	MTTWHEFPOCUFGI-SFNKJDCFSA-N	433.936	1.925	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)[C@H]1C[C@H]1C1CC1	1802990754	VFZFZUFCSHKDRV-JKLQHZFJSA-N	433.317	1.127	50	20	IDGD	
CC(C)Cc1cc(C(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)n(C)n1	1803138984	QKMPDDUCXSCWRZ-LSTHTHJFSA-N	447.967	1.933	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)[C@@H](C)CS(C)(=O)=O)[C@@H]1c1cccnc1	1803586831	FHKDOPDUYVSEAL-ORQFMDKSSA-N	429.970	1.786	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)C[C@H]2NC(=O)NC2=O)[C@@H]1c1cccnc1	1803686586	QKIZQMKYTHXWPW-LJIGWXMPSA-N	435.912	1.093	50	20	IDGD	
COc1cc(F)ccc1CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc(B(O)O)c1)C2	1804510426	GYAQTVQMRBZYAT-ACDBMABISA-N	440.280	1.009	50	20	IDGD	
C[C@H](C(=O)N1CC[C@@H](CNC(=O)CCBr)[C@@H]1c1cccnc1)n1cncn1	1806346149	ALRCTZKYEGASDP-KMFMINBZSA-N	435.326	1.725	50	20	IDGD	
CC(C)[C@H](S)C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1807365345	NZSWICPULXZMHU-SXLOBPIMSA-N	441.362	1.035	50	20	IDGD	
C[C@@H](C(=O)NC[C@@H]1CCN(C(=O)[C@H](F)Cl)[C@H]1c1cccnc1)N1CCN(C)CC1	1807897509	AYBKPPJCOXHKEH-DKIMLUQUSA-N	425.936	1.258	50	20	IDGD	
CCc1oncc1C(=O)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1	1809976552	DDKKHPBDNLUOKK-UHFFFAOYSA-N	425.294	1.075	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2cccc(C#N)c2)[C@H]1c1cccnc1	1811797304	WTMJJKTYPABIML-NZQKXSOJSA-N	448.527	1.646	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)CS(C)(=O)=O)[C@@H]1c1cccnc1	1812774734	FHONKTHJKQXSGN-OFQRWUPVSA-N	446.367	1.306	50	20	IDGD	
O=C(NCC(=O)N1CC[C@H](CNC(=O)C(Cl)Cl)[C@H]1c1cccnc1)c1ccco1	1813075395	AKEIUYHQEIQJDS-CZUORRHYSA-N	439.299	1.914	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cnc3snnc3c2)[nH]n1)[C@H](O)CCl	1814872585	DPKQBFHGFWBIKT-CHWSQXEVSA-N	435.897	1.715	50	20	IDGD	
Cc1cc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)ccn1	1815344115	INHSLXCFUKLFMO-MRXNPFEDSA-N	436.302	1.066	50	20	IDGD	
CC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)sc2C1	1817277179	LZYBJZGKIPTOHE-CJCQAYSXSA-N	444.517	1.558	50	20	IDGD	
CNC(=S)NCCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CO[Si](C)(C)C)CC2	1819809089	JEQAROANEGOKBE-NSHDSACASA-N	443.671	1.391	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)[C@H](C)n3ccccc3=O)sc2C1	1820130876	LWZNUCHLAZUYSG-AVGNSLFASA-N	438.937	1.732	50	20	IDGD	
CC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnccc1C(=O)NN)CC2	1822850174	PTLJQHYIFDJXTD-BXKDBHETSA-N	436.925	1.385	50	20	IDGD	
COC(=O)C1(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@H](C)Br)CC3)CC1	1825281904	LVDOJJXGYFQAMX-DTWKUNHWSA-N	430.324	1.792	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](C)Br)sc2C1	1825640465	AQBWGLBBYOPHIP-BBBLOLIVSA-N	446.371	1.546	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(O)n2)CC1	1825945729	ANWKULLCQSKEJO-SFHVURJKSA-N	431.537	1.394	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)c2cncc(F)c2)CC1	1826057036	MSLDRLFVFKWSEX-NRFANRHFSA-N	439.296	1.448	50	20	IDGD	
CN[C@H](CC(=O)N1CCC([C@@H]2CCCCN2C(=O)CCBr)CC1)C(=O)O	1826357594	BLAGWWQTUIRIPU-CABCVRRESA-N	432.359	1.454	50	20	IDGD	
O=C(CC(F)(F)F)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827055314	XOHOOMMXSHSUMX-KRWDZBQOSA-N	426.244	1.552	50	20	IDGD	
COc1ncccc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830358411	BOKGYPAAAMOUFP-FQEVSTJZSA-N	425.913	1.425	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4cccnc4[nH]3)C2)C1	1830361701	AQODZIZJWZQMIE-OAQYLSRUSA-N	434.924	1.898	50	20	IDGD	
Cc1cnc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)s1	1830535974	WANHKYKVQZXWEC-SJCJKPOMSA-N	446.367	1.553	50	20	IDGD	
CC(C)[C@H](C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1)c1ccccc1	1830719361	CCEBJYLCKCCYMV-XQBPLPMBSA-N	438.952	1.482	50	20	IDGD	
O=C(CCc1ccccc1Cl)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1830724719	YOYOLNXBPBHFSQ-XLIONFOSSA-N	445.343	1.329	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)nc2ccccc12	1830728569	UZDSRDLLKAWLGO-UGKGYDQZSA-N	447.919	1.213	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)/C=C\C(=O)NC2CC2)CC1	1831831325	UUDAFSRVTPRKIG-MZIIKBMYSA-N	425.957	1.695	50	20	IDGD	
O=C([C@@H](F)Br)N1CCC([C@@H]2CCCCN2C(=O)CCn2cncn2)CC1	1832119361	ICDLITPEMGUFAZ-GOEBONIOSA-N	430.322	1.978	50	20	IDGD	
CC(C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1	1832315700	HWVWVBGYEGIRLO-QZTJIDSGSA-N	425.353	1.494	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3cc(C)no3)CCO2)C1	1832573764	PRUPFTVTKIITMK-YJBOKZPZSA-N	444.326	1.155	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)n(C)n1	1834165797	XYGPBNQQDMDWQZ-ZWKOTPCHSA-N	433.336	1.035	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)c1ccc2cnccc2n1	1835324638	PGWQPMNSCDWZQP-FQEVSTJZSA-N	445.951	1.415	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CN3CCCCC3)CCO2)C1	1835378719	COTMCRWCOGSXJA-APWZRJJASA-N	446.386	1.102	50	20	IDGD	
O=C(CS[C@@H]1CCCCO1)NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1835757080	NMLONGMTOBAICM-PKOBYXMFSA-N	448.029	1.418	50	20	IDGD	
Cc1ccc(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)cc1F	1836262939	CAZKHIAHOUCBTM-IBGZPJMESA-N	425.932	1.919	50	20	IDGD	
COc1cccc(C(=O)N2CCC(OC3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)n1	1836715776	ZNNUZVVJBPBYLS-KRWDZBQOSA-N	425.913	1.302	50	20	IDGD	
Cc1cnc(C(=O)N2CCOC[C@@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)s1	1837712202	ITRRPHZWUXPJET-GOSISDBHSA-N	427.599	1.373	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)nc1C	1837712459	SOMUFAUBGWSLKH-OAQYLSRUSA-N	435.597	1.620	50	20	IDGD	
Cc1cccc(CC(=O)N2CCOC[C@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)c1	1837712515	WYTYZGIFNZKKPO-JOCHJYFZSA-N	434.609	1.845	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3c(F)cccc3Cl)CCO2)C1	1838871050	DSKIPLYHEVAZQF-IFXJQAMLSA-N	449.306	1.803	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(F)c(F)c3)CCO2)C1	1839010735	DKQDRSGJZHNCOO-KUHUBIRLSA-N	432.851	1.289	50	20	IDGD	
CCOc1ncccc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](Cl)CC)CCO2	1839141305	DPHZQPUYUDTQQX-OXJNMPFZSA-N	425.913	1.568	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnn(-c4cccnc4)c3)C2)C1	1839143094	LEVNMALOTCXUPX-GHTZIAJQSA-N	447.923	1.355	50	20	IDGD	
Cc1ccc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)cn1	1839197535	AHNVGLWNUNZJNI-WMZOPIPTSA-N	444.301	1.079	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc4nn[nH]c4c3)CCO2)C1	1839628311	YWOUDWZLAASCOB-FQEVSTJZSA-N	435.912	1.293	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccccc3O)CCO2)C1	1839909214	ZMEJEYJQAJSQJX-VQTJNVASSA-N	445.343	1.627	50	20	IDGD	
C=CCOCCCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](Br)CC)CCO2	1839962478	GYOYUSASDRWCQL-LPHOPBHVSA-N	447.370	1.599	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc(C)s3)C2)C1	1839964529	URVLXTQQRYZWNQ-CXAGYDPISA-N	446.367	1.695	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(Cl)nc3)C2)C1	1840029334	AVUSVDPFSWPHHM-SJCJKPOMSA-N	446.729	1.588	50	20	IDGD	
Cc1ccc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)o1	1840036831	RMQFBPSRBXGKIO-KSSFIOAISA-N	429.311	1.370	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3ccccc3C)C2)C1	1840155427	BPKLZGZPQHBWMO-SIKLNZKXSA-N	438.952	1.638	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccc(F)cc3OC)CCO2)C1	1840934565	FZHVGTICSMRBKU-UWJYYQICSA-N	442.915	1.851	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@H](O)CCNC(=O)OC(C)(C)C)C2	1841669282	KYWAAEUQIXNCBQ-LSDHHAIUSA-N	431.961	1.873	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)[C@H](C)Nc1cccnc1)C2	1843415894	ZXCAGAQTYNSATR-CXEIWHQESA-N	437.504	1.219	50	20	IDGD	
C[C@H](CC(=O)N1CC2(CCCN2C(=O)c2cnccc2C(=O)NN)C1)Oc1ccccc1	1844264983	GCFMFQMFKLVEBU-MRXNPFEDSA-N	437.500	1.360	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC2(CCCN2C(=O)c2cnc3c(c2)NC(=O)CS3)C1	1845670547	XRKCTKOEFWEWPL-SNVBAGLBSA-N	439.335	1.726	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)CC2Cc3ccccc3C2)C1	1847115976	PERQWONDRZRLQF-UHFFFAOYSA-N	433.512	1.307	50	20	IDGD	
Cc1cccc(NC(=S)NNC(=O)Cn2c(=O)ccn(Cc3ccccc3)c2=O)c1C	14807341	SCPHFHJZKSYRMP-UHFFFAOYSA-N	437.525	1.693	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])c2ccccc2c1=O	15945713	KGRJFTDQOYXXGX-UHFFFAOYSA-N	425.401	1.726	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)Cc2csc(NC(=O)c3ccco3)n2)nc2ccccc21	17411234	LWPUNTPIKMRONP-UHFFFAOYSA-N	438.469	1.808	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccccc1)c1cccc([N+](=O)[O-])c1	21001464	HDUXNSYNQLYYCA-QGZVFWFLSA-N	432.458	1.599	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCN(c3cccc(C(F)(F)F)c3)CC2)n1	26468765	MEPWWMIXZODFKC-UHFFFAOYSA-N	441.479	1.982	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)c1ccc(S(=O)(=O)N(C)OC)cc1	26737295	QBBDLIJUXVGHMP-UHFFFAOYSA-N	437.474	1.107	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)CN2C(=O)NC3(CCCCC3)C2=O)c1	27069107	GFXWWCWKPHJLEA-UHFFFAOYSA-N	430.505	1.899	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cc(-c3ccccc3)on2)cc(OC)c1OCC(N)=O	27264223	LIOKPBNHJSSLBH-UHFFFAOYSA-N	440.412	1.298	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CCNS(=O)(=O)c2ccc(C)c(C)c2)cc1OC	28776363	LTCSFXRACGOWRN-UHFFFAOYSA-N	435.502	1.450	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)c2ccc3c(c2)C[C@H](C)N3S(C)(=O)=O)c(C)c1	726100825	HFPXUXXSSMLIIS-HNNXBMFYSA-N	430.530	1.887	50	20	IDGD	
CCOC(=O)[C@H]1CCCN(C(=O)CN(C)C(=O)/C(C#N)=C/c2cc(C#N)n(C)c2C)C1	726174556	BTYOXPQZAPJWKB-ZJTXRKTBSA-N	425.489	1.372	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2ccccc2O)nnn1C1CCN(C(=O)OC(C)(C)C)CC1	726190747	YKNFIBYKJSVFDH-UHFFFAOYSA-N	444.492	1.939	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)[C@@H]1CCCN1C(=O)OCC(F)(F)F	727799186	HUQMUGPBGKHAIX-AWEZNQCLSA-N	441.410	1.909	50	20	IDGD	
CN(C)N(C(=O)CNC(=O)c1ccc(Oc2ccccc2)cc1)[C@@H]1CCS(=O)(=O)C1	728176200	LNTJFXUKFJSMHS-QGZVFWFLSA-N	431.514	1.701	50	20	IDGD	
Cc1nc(C(=O)NNC(=O)CNC(=O)c2ccco2)nn1-c1c(Cl)cccc1Cl	728242459	YJAXSTIDDUJZBQ-UHFFFAOYSA-N	437.243	1.667	50	20	IDGD	
Cn1cc(NS(=O)(=O)c2ccsc2C(=O)NNC(=O)c2cccc(C#N)c2)cn1	728871264	SZQYTTQPHIAUES-UHFFFAOYSA-N	430.471	1.229	50	20	IDGD	
O=C(Cc1ccc(NS(=O)(=O)c2ccc(F)cc2)cc1)NNC(=O)Cc1cccnc1	728893819	VJSUJRUPLAVILO-UHFFFAOYSA-N	442.472	1.954	50	20	IDGD	
CCCC(=O)Nc1ccc(CNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1	728945690	FRBRXAPWGVNXDV-UHFFFAOYSA-N	439.520	1.962	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(CCNC(=O)NNC(=O)c2cccc3ncccc23)CC1	730123454	QCWOPFGCBPSDCF-UHFFFAOYSA-N	442.520	1.732	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)NCCOc1ccc(F)c(F)c1	730128957	MJCBICUQKUGJFB-UHFFFAOYSA-N	447.486	1.886	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)CC[C@@H]2NC(=O)N(c3ccc(Cl)cc3)C2=O)c1O	730832845	NRMAGDXSAWKUOB-AWEZNQCLSA-N	446.847	1.720	50	20	IDGD	
CC[C@H]1CCCN(C(C)(C)CNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)C1	732245595	BAFNCFFAONNOGZ-KRWDZBQOSA-N	431.585	1.924	50	20	IDGD	
Cc1nn(CCCl)c(C)c1C(=O)NCCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1	733925825	DYTQWNSCQXZZNW-UHFFFAOYSA-N	429.886	1.355	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)c2ccc(-n3ccnc3)nc2)CC1	734824540	BSCKHBZMXMNCET-UHFFFAOYSA-N	429.481	1.611	50	20	IDGD	
CN(CCOc1cccc(CNC(=O)NNC(=O)c2cnn(C)c2)c1)C1CCOCC1	735514417	YRZHLHXXQFYWLC-UHFFFAOYSA-N	430.509	1.054	50	20	IDGD	
CCn1c(=O)nc(O)c2c(C(=O)NNC(=O)COCc3ccccc3)cc(C3CC3)nc21	737923748	XHNNOMTUWWYPBR-UHFFFAOYSA-N	437.456	1.372	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NCCNc1nccc(C(F)(F)F)n1	739045859	OOTWXKOLBFECOO-SNVBAGLBSA-N	430.362	1.844	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CCS(=O)(=O)c2ccc3c(c2)OCCCO3)c1	741186290	VWVULZBHHHKVGJ-UHFFFAOYSA-N	429.454	1.345	50	20	IDGD	
CCc1cc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)on1	741425840	SGJNQHQJWGWTOE-UHFFFAOYSA-N	435.506	1.556	50	20	IDGD	
CC(C)(C)C(=O)Nc1nc(CC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cs1	742635772	YXGRAPRDRVOZIG-UHFFFAOYSA-N	445.549	1.524	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NCC[S@](=O)Cc2ccccc2)cc1	743618938	UGRFRGHHMVNNAB-NDEPHWFRSA-N	438.531	1.375	50	20	IDGD	
CC(=O)N1CCN(S(=O)(=O)c2cccc(C(=O)NNc3ccc(Cl)nc3)c2)CC1	743815449	DQIKIZKLOAWJNO-UHFFFAOYSA-N	437.909	1.345	50	20	IDGD	
Cc1ccccc1O[C@H](C)C(=O)N1CCN(CC(=O)NNC(=O)c2cccc(C#N)c2)CC1	744406573	FUOLVASJFIWICB-GOSISDBHSA-N	449.511	1.239	50	20	IDGD	
Cc1nc2ccccc2n1CC(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	744619859	AZYWZPAYDBFSBO-UHFFFAOYSA-N	429.502	1.509	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)[C@@H]2CCCN(C(=O)Cc3ccccc3)C2)c1	744701120	OHKDYFDSBGNODK-HXUWFJFHSA-N	448.479	1.344	50	20	IDGD	
CC(C)(CNC(=O)NNC(=O)c1csc(N2CCOCC2)n1)NC(=O)OC(C)(C)C	745926987	ZLRQWPUYZKZVKF-UHFFFAOYSA-N	442.542	1.227	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H]2C[C@@](C)(OC)C2(C)C)c1	745932138	KMTBMEAEEOSCAY-OXJNMPFZSA-N	440.566	1.865	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)NCCC(=O)N2CCN(c3ccccc3)CC2)c1	748464422	CSCBAQPBJOINDO-UHFFFAOYSA-N	438.532	1.436	50	20	IDGD	
CN1CCC[C@@H](NC(=O)NNC(=O)[C@H]2Cc3ccccc3CN2Cc2ccccc2)C1=O	748664612	LRVANZWEAVQWOB-NHCUHLMSSA-N	435.528	1.565	50	20	IDGD	
Cn1cc(C(=O)NNS(=O)(=O)c2ccc(OCC(=O)O)c(Cl)c2)c2ccccc21	748691868	XEKGTXGIVVXDMY-UHFFFAOYSA-N	437.861	1.918	50	20	IDGD	
Cc1nc(S(=O)(=O)N2CCC(C(=O)NNc3cccc4cnccc34)CC2)cn1C	748762873	DUCXJBQHHSYWNE-UHFFFAOYSA-N	428.518	1.821	50	20	IDGD	
O=C(NNC(=O)c1cc2ccccc2o1)c1cccc(CN2CCS(=O)(=O)CC2)c1	749473719	LVFYSAVYIOJHMN-UHFFFAOYSA-N	427.482	1.738	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)NCc1cccc(COCC(F)(F)F)c1	749809230	ZCGNAGLMLUEJMK-UHFFFAOYSA-N	428.367	1.619	50	20	IDGD	
NC(=O)c1ccc(CNC(=O)NNC(=O)[C@@H]2Cc3ccccc3CN2Cc2ccccc2)o1	752009171	FFULEGBBBOKSJV-FQEVSTJZSA-N	447.495	1.836	50	20	IDGD	
Cc1noc(C)c1[C@@H](C)CNC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	752700292	SZUCXIKVDXPQNN-ZDUSSCGKSA-N	449.533	1.824	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)N[C@@H]1CCCN(Cc2ccccn2)C1=O	753297407	IFUOASWSNSSEDC-RDTXWAMCSA-N	429.452	1.510	50	20	IDGD	
CN1C(=O)c2cccc3c(S(=O)(=O)NNC(=O)c4ccc(-n5cnnn5)cc4)ccc1c23	753769483	LCTDOTFUFMKZHP-UHFFFAOYSA-N	449.452	1.029	50	20	IDGD	
CN(C)c1cc(C(=O)N2CCN(S(=O)(=O)CBr)CC2)c2ccccc2n1	755893428	BYRQOQJQHDWZEC-UHFFFAOYSA-N	441.351	1.741	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)NNC(=S)Nc2cccc(Br)c2)co1	756128155	XJHZBKRWZYIPIX-UHFFFAOYSA-N	433.309	1.582	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)C(=O)Nc2ncc(C3CCCCC3)s2)c1	756169637	MIDNXYTTZPEAFY-UHFFFAOYSA-N	430.490	1.944	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1)Nc1cccnc1N1CCOCC1	756183369	KVEKBULLHYKJBS-UHFFFAOYSA-N	425.424	1.914	50	20	IDGD	
CS(=O)(=O)CCOc1cccc(NC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1	756298541	YWSYEASNZIBCBT-KRWDZBQOSA-N	435.458	1.103	50	20	IDGD	
NC(=O)CCSc1ccccc1NC(=O)NNC(=O)c1nnc(O)c2ccccc12	756363305	PZGHNWCBOYQCQJ-UHFFFAOYSA-N	426.458	1.769	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)Nc2ccc(OC)c(-n3cnnn3)c2)cc1	756747467	PDDMAAPMXXKJIC-CYBMUJFWSA-N	441.448	1.690	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCCCO[C@@H]1CCOC1	756915839	CKMVOJFCKJAMHW-SWLSCSKDSA-N	430.299	1.742	50	20	IDGD	
Cn1ncc(C(=O)NNC(=O)c2cccc(S(=O)(=O)Nc3ccccc3Cl)c2)c1N	757709086	NACLNFDAGZYHIG-UHFFFAOYSA-N	448.892	1.531	50	20	IDGD	
COCCOc1ccc(CC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)cc1	757780525	JIXDPYAGNICMTC-UHFFFAOYSA-N	434.518	1.317	50	20	IDGD	
Cc1cnn(-c2ccc(C(N)=O)cc2NC(=O)NNC(=O)COc2ccccc2C#N)c1	757876284	QAILRBUBQPIHJM-UHFFFAOYSA-N	433.428	1.383	50	20	IDGD	
C[C@@H](Oc1ccc2c(c1)CCC2)C(=O)N1CCN(S(=O)(=O)CBr)CC1	758526444	CQSDESOFUYDQJX-CYBMUJFWSA-N	431.352	1.769	50	20	IDGD	
C[C@@H]1CN(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)C[C@H](c2ccsc2)O1	759747096	CTSUROPWXFVKPS-RHSMWYFYSA-N	430.534	1.957	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1cnn(-c2cccnc2)c1	759809526	DZWGPEMVDSPJKF-UHFFFAOYSA-N	428.474	1.045	50	20	IDGD	
COCc1nc(OC)c2c(C)c(C(=O)NNC(=O)C(=O)Nc3ccc(C)cc3)sc2n1	761736186	VHQROQMTXYMRGM-UHFFFAOYSA-N	443.485	1.863	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)CN2C(=O)N[C@](C)(c3ccc(F)cc3)C2=O)n1	762910101	WPOBAMOLOKPKNX-HXUWFJFHSA-N	429.456	1.372	50	20	IDGD	
CN(C)C(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3n2)ccc1Cl	763453805	AKBOXGMURLOMNH-UHFFFAOYSA-N	439.859	1.990	50	20	IDGD	
CC(C)S(=O)(=O)c1ccccc1NC(=O)C(=O)NNC(=O)c1c[nH]c2ccccc12	763534943	NCIQDWKTXTXCMP-UHFFFAOYSA-N	428.470	1.750	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)Nc1cccc(OCc2cccnc2)c1	763573825	USKOZMYHANDOFX-FQEVSTJZSA-N	448.435	1.587	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(C(=O)NC(C)(C)C)cc1	763712480	SBNSWZPOBHAJGS-UHFFFAOYSA-N	440.500	1.942	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(CNC(=O)OC)cc1	763717289	VETABZCKECBFRK-UHFFFAOYSA-N	428.445	1.270	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccccc2C(=O)NC(C)(C)C)c1	763757229	GJJBJQXZQADPQN-UHFFFAOYSA-N	425.489	1.681	50	20	IDGD	
O=C(NNC(=O)c1cc2c(s1)CCC2)C(=O)Nc1ccc(NC(=O)[C@H]2CCCO2)cc1	763775520	VCPRRPPEMWUEKO-OAHLLOKOSA-N	442.497	1.754	50	20	IDGD	
Cc1cc(C)n(-c2ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc3ccc(F)cc3)cn2)n1	763867617	XQMYQEFELIYMOR-CQSZACIVSA-N	440.435	1.577	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)C(=O)Nc1cc(N2CCCC2=O)ccc1Cl	763920146	GEYNDYJRNLBYFM-UHFFFAOYSA-N	432.839	1.935	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccc(C(=O)NCC(F)(F)F)cc1	763932847	SYMZLDVELGRTOX-UHFFFAOYSA-N	440.353	1.446	50	20	IDGD	
COCCS(=O)(=O)c1ccc(NC(=O)NNC(=O)CSc2ccccc2O)cc1	763963776	SUBMVBRNMGIQKH-UHFFFAOYSA-N	439.515	1.757	50	20	IDGD	
CNC(=O)Cn1ccc2ccc(NC(=O)C(=O)NNC(=O)c3cc(Cl)ccc3O)cc21	763974061	KBHJDKBOJPMGTK-UHFFFAOYSA-N	443.847	1.146	50	20	IDGD	
O=C(NNC(=O)c1cc(Cl)ccc1O)C(=O)Nc1cccc(Cn2cccnc2=O)c1	763974064	KEWFLKZBOHGQFC-UHFFFAOYSA-N	441.831	1.050	50	20	IDGD	
CC(C)C[C@H](C)n1nccc1NC(=O)C(=O)NNC(=O)c1cc(Br)cn1C	764004701	LREFIQKZDHEREL-NSHDSACASA-N	439.314	1.991	50	20	IDGD	
O=C(Cc1ccsc1)NNC(=O)C(=O)Nc1ccc(Cl)cc1C(=O)N1CCCC1	764034972	WPKJLNDTSHQZOT-UHFFFAOYSA-N	434.905	1.966	50	20	IDGD	
CN(C)C(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)Cc2cccc3ccccc23)cc1	764037612	ZZTXJHXYKOEKMP-UHFFFAOYSA-N	432.480	1.799	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1cccc(Cl)c1N1CCOCC1	764048331	PAECPKHYWYVRKG-UHFFFAOYSA-N	432.864	1.585	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(Br)c2)cc1	764059343	SFMORQOMQFURAJ-UHFFFAOYSA-N	436.262	1.874	50	20	IDGD	
O=C(CC(F)(F)F)NNC(=O)C(=O)Nc1ccc2nc(N3CCOCC3)sc2c1	764117805	WQPSMIQMEQZFAJ-UHFFFAOYSA-N	431.396	1.171	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccc(N2C[C@H](C)O[C@H](C)C2)nc1	764136838	UTKYDAYWDGCBPM-GASCZTMLSA-N	441.488	1.032	50	20	IDGD	
COc1ccc(Cn2nccc2NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)cc1	764164875	UPBKQIDMTFIHAE-SFHVURJKSA-N	435.440	1.030	50	20	IDGD	
C[C@H](C(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)CCc2ccco2)c1)n1cccn1	764166912	RYUMWTSBDVILLC-CQSZACIVSA-N	438.444	1.395	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1cccc(CCN2CCCC2)c1	764278245	OPFZLHOBCLPZKA-UHFFFAOYSA-N	426.473	1.195	50	20	IDGD	
COc1ccc(C(=O)Nc2ccccc2C(=O)NNC(=O)CNC(=O)c2cccnc2)cc1	764342873	JCIZAQRWFMSTKD-UHFFFAOYSA-N	447.451	1.534	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)cc1	764356575	ZEEBDYUKIQEEMY-UHFFFAOYSA-N	440.865	1.207	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2ccccc2-n2ccnn2)n[nH]1	764377370	OICSSNNHAFXYJI-UHFFFAOYSA-N	446.427	1.066	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cc(C(=O)OC)n(C)c3)n[nH]2)cc1	764387982	PCUHFQIPJFSQKE-UHFFFAOYSA-N	438.444	1.164	50	20	IDGD	
COC(=O)c1c(F)cccc1NC(=O)C(=O)NNC(=O)CSc1ccccc1OC	764392357	DZSSTESYLJKKMF-UHFFFAOYSA-N	435.433	1.499	50	20	IDGD	
COc1nccnc1NNC(=O)Nc1cc(S(=O)(=O)N2CCCCC2)ccc1N(C)C	764593204	VJQURXFKTOSCEI-UHFFFAOYSA-N	449.537	1.874	50	20	IDGD	
CC1=C(C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)C(=O)OC1(C)C	766670404	XZTSMIFFUXMLSE-UHFFFAOYSA-N	434.924	1.257	50	20	IDGD	
CN1C(=C(C#N)C(=O)COC(=O)[C@@H]2CC(=O)N(Cc3ccccn3)C2)N(C)c2ccccc21	766935800	XDMSFMFYWIHFCO-MRXNPFEDSA-N	445.479	1.864	50	20	IDGD	
COc1cc2ncn(CCCC(=O)NNC(=S)Nc3ccccn3)c(=O)c2cc1OC	768584736	XCHXOLRKCGDHEM-UHFFFAOYSA-N	442.501	1.607	50	20	IDGD	
CC(C)S(=O)(=O)c1cccc(C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)c1	770439096	RFANRNKXQBGAAW-UHFFFAOYSA-N	429.454	1.358	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2cc(C(=O)OC)ccn2)c1	770696801	XROVIYUSONQXFJ-UHFFFAOYSA-N	449.489	1.365	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)N[C@@H]1CC(=O)N(c2c(F)cccc2F)C1	770835112	LIYNOZAWPRAWOG-GFCCVEGCSA-N	432.383	1.486	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1cccs1)C(=O)NNc1ccc(S(=O)(=O)C(F)F)cc1	771011590	HMIWJBNKUNEGBU-SECBINFHSA-N	439.487	1.555	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)c2cc(-c3ccc4c(c3)CCO4)no2)cc1	771429866	ZEFIJGBLDHMUGI-UHFFFAOYSA-N	432.392	1.766	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)Nc1cnn(Cc2nnc3n2CCCC3)c1	772636497	RXSCKNMUQQHGQY-UHFFFAOYSA-N	425.409	1.234	50	20	IDGD	
CCOC[C@H](C(=O)OC)N(C)C(=O)CCC(=O)C(C#N)=C1N(C)c2ccccc2N1C	772709121	TWHUDRJYKKQFSB-GOSISDBHSA-N	428.489	1.694	50	20	IDGD	
CCOC(=O)c1cnn2c(C(=O)NNC(=O)[C@@H](C)Oc3cccc(Cl)c3)ccnc12	773000253	ZDFKYFQFAPETBP-LLVKDONJSA-N	431.836	1.788	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)C(=O)Nc2cccc(N3C(=O)c4ccccc4C3=O)c2)n1	773482377	XUKIAXYUZLLQHT-UHFFFAOYSA-N	430.424	1.976	50	20	IDGD	
O=C(NNC(=O)c1ccccc1F)C(=O)Nc1ccc(I)cn1	773511489	NHAOZLSVPWCUBK-UHFFFAOYSA-N	428.161	1.225	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2ccoc2Br)cc1OC	773534441	ZSXUBSMEWXEOOQ-UHFFFAOYSA-N	427.207	1.677	50	20	IDGD	
CC[C@@H](C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1)c1ccc(OC)cc1	775946218	UJHXGKBSPNDKJK-APWZRJJASA-N	428.441	1.719	50	20	IDGD	
CN(NC(=O)c1cn(C)nc1-c1cccnc1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776201967	NYUTUDSEQPAZRR-UHFFFAOYSA-N	443.508	1.731	50	20	IDGD	
CN(c1ccc(CNC(=O)NNc2cccc(S(C)(=O)=O)c2)cc1)S(C)(=O)=O	776623022	IJVZWJSWECQGQZ-UHFFFAOYSA-N	426.520	1.312	50	20	IDGD	
CNC(=O)CCCC(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2OC)c1	780155142	VQRFEHGHGOWOAK-UHFFFAOYSA-N	448.501	1.173	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)ccc1N(C)C	783265861	YTNLGHOYFKPWAY-UHFFFAOYSA-N	434.522	1.225	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2cc(S(=O)(=O)N3CCCCC3)ccc2C)nc(C)n1	783324367	JPFIXWNUNMIOTI-UHFFFAOYSA-N	446.533	1.658	50	20	IDGD	
COC(=O)CN1CCN(c2ccc(NC(=O)C(=O)NNc3ccc(C)cc3)cc2)CC1	783343555	YCPROHRMNFWLMO-UHFFFAOYSA-N	425.489	1.372	50	20	IDGD	
NC(=O)c1cccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)c1	783409990	ZTXVXVKVTLVTGX-UHFFFAOYSA-N	430.364	1.161	50	20	IDGD	
CCCN(CCC)C(=O)c1ccc(NC(=O)C(=O)NN[C@@]2(C)CCS(=O)(=O)C2)cc1	783425321	BYGHRGRPYWVKMT-FQEVSTJZSA-N	438.550	1.085	50	20	IDGD	
CNS(=O)(=O)CCNC(=O)NNC(=O)c1cc(-c2ccccc2)nc2ccccc12	784664268	NIWIVFIGWMIBTH-UHFFFAOYSA-N	427.486	1.395	50	20	IDGD	
COC(=O)c1cc(Br)c(F)cc1NC(=O)C(=O)NNc1ccc(Cl)nn1	784792275	LYPYROVBWZZLFG-UHFFFAOYSA-N	446.620	1.900	50	20	IDGD	
CC(C)OC(=O)NCc1ccc(NC(=O)C(=O)NNc2cccc(S(C)(=O)=O)c2)cc1	784841573	LRRUIFXATQMSFU-UHFFFAOYSA-N	448.501	1.807	50	20	IDGD	
Cc1cc(C)n(-c2cccc(NC(=O)C(=O)NNC(=O)c3cc([N+](=O)[O-])ccc3O)c2)n1	785023451	IYMGHOJQCYANDX-UHFFFAOYSA-N	438.400	1.503	50	20	IDGD	
COCCCn1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3cc(C)ccc3C)[nH]n2)n1	785127963	KESARVADDFGCEH-UHFFFAOYSA-N	439.476	1.326	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1csc(-c2ccccn2)n1	785331680	YGRXALJHKUPPKL-UHFFFAOYSA-N	447.498	1.699	50	20	IDGD	
Cc1ccc(C(=O)NCC2CC2)cc1NC(=O)C(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	785987694	GRQFYVREMDXSIG-UHFFFAOYSA-N	439.428	1.443	50	20	IDGD	
CC(C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)cc1	789822267	VJYWOVJQXATOFV-OALUTQOASA-N	438.484	1.483	50	20	IDGD	
COc1ccc(NNC(=O)NC[C@@H](Cc2cccc(F)c2)C(=O)N2CCOCC2)nc1	789841941	UHRMISQVJMULNU-MRXNPFEDSA-N	431.468	1.573	50	20	IDGD	
CCOCCCn1c(NNC(=O)CN2CCc3ccccc3C2=O)nc2ccccc2c1=O	789951560	ZQQJPCWFGPVCMD-UHFFFAOYSA-N	449.511	1.965	50	20	IDGD	
CCCCOc1cc(OCCC)ccc1C(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1	790490919	FSTPIFQIQHKIMP-CQSZACIVSA-N	427.523	1.785	50	20	IDGD	
CCc1ccc([C@@H]2CN(C(=O)NNC(=O)c3csc(N4CCOCC4)n3)CCO2)cc1	791010368	QAZNCFRQRGRKFK-SFHVURJKSA-N	445.545	1.970	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCCC[C@@H]2C(=O)OCc2ccccc2)n1	791644180	ZKQHHVHGYNHTOL-QGZVFWFLSA-N	430.530	1.739	50	20	IDGD	
C[C@@](O)(Cn1cc(C(F)(F)F)ccc1=O)C(=O)NNc1ccc(C(F)(F)F)nn1	792278924	PSIYCLYEDVRKGZ-CYBMUJFWSA-N	425.289	1.570	50	20	IDGD	
O=C(COc1ccccc1NC(=O)C(=O)NNc1nc2ccccn2n1)Nc1cccnc1	792392219	VPIZHYLEIGMXOR-UHFFFAOYSA-N	446.427	1.224	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1	793027353	XDRGKYWHBFKMHU-UHFFFAOYSA-N	439.197	1.825	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)c2cccc(NN3C(=O)[C@@H]4CC=CC[C@H]4C3=O)c2)c1	793417633	DEHFWZBGYWHOPJ-RTBURBONSA-N	429.436	1.911	50	20	IDGD	
O=C(Cc1ccc2n[nH]cc2c1)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	793682564	ONLJLRHMCNUFEI-UHFFFAOYSA-N	440.935	1.724	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)Nc2ccc(N(C)C(=O)CN3CCN(C)CC3)cc2)n1	797623082	ICYHFUTWLMWISB-UHFFFAOYSA-N	439.520	1.067	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)Nc1cc(S(=O)(=O)N2CCCC2)ccn1	797673440	DKWIAXJWXVIELO-UHFFFAOYSA-N	447.517	1.660	50	20	IDGD	
CCOc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NNC(=O)c1cnn(-c2ccccc2)c1	799258474	AZMQFOFITHRUHZ-UHFFFAOYSA-N	438.400	1.579	50	20	IDGD	
C[S@](=O)C1(CNC(=O)NNC(=O)[C@@H]2Cc3ccccc3CN2Cc2ccccc2)CC1	799368673	YKYJCCFRDQBMOU-GEFUHLBYSA-N	440.569	1.855	50	20	IDGD	
CC(C)(COCc1ccccc1)C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	800380323	OVPUCAPGOVKGND-UHFFFAOYSA-N	439.921	1.991	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)N[C@@H]1CCN(C(=O)Nc2ccccc2)C1	801078005	RRFRKKPLBSXXCA-MRXNPFEDSA-N	425.445	1.708	50	20	IDGD	
Nc1cc(F)c([N+](=O)[O-])cc1C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	801914034	RGVTWIDCVJYYFJ-UHFFFAOYSA-N	439.425	1.094	50	20	IDGD	
O=C(NNC(=O)c1cnc2c(c1)c(O)nc(=O)n2C1CC1)Nc1ccc(OC(F)F)cc1	802045308	KJICDINSNZXZEU-UHFFFAOYSA-N	446.370	1.900	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2ccc(N3CCOCC3)c(F)c2)cc1	802063929	TWJBFQOOXPEAIK-UHFFFAOYSA-N	436.465	1.532	50	20	IDGD	
COc1ccc(C2=NO[C@H](CNC(=O)NNC(=O)c3cc([N+](=O)[O-])ccc3O)C2)cc1	802369673	LNHIGQPFIBEEMC-AWEZNQCLSA-N	429.389	1.446	50	20	IDGD	
O=C(COc1cccc(C(F)(F)F)c1)NNC(=O)C(=O)Nc1ccc(OC(F)F)nc1	802565899	PYNAVHGOQLFAAE-UHFFFAOYSA-N	448.304	1.867	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1ccc(OC(F)F)nc1	802567097	IEJFPADQKCSSCI-UHFFFAOYSA-N	426.401	1.570	50	20	IDGD	
Cc1nn(Cc2ccccc2)c(N)c1C(=O)OCC(=O)NNC(=O)c1cccc(C#N)c1	803935181	XRKDDYCCQGMMRO-UHFFFAOYSA-N	432.440	1.312	50	20	IDGD	
CCOC(=O)C(C)(C)c1csc(NC(=O)C(=O)NNC(=O)Cc2ccccc2F)n1	806979969	LDQVSNFBRMQIFW-UHFFFAOYSA-N	436.465	1.452	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNc2ccc(-c3cccc(C(F)(F)F)c3)nn2)nn1C	807298524	DOEWUXIQVBTCRS-UHFFFAOYSA-N	435.366	1.986	50	20	IDGD	
Cc1cc([N+](=O)[O-])ccc1NNC(=O)C(=O)Nc1cccc(S(=O)(=O)N2CCCC2)c1	807457570	IAALQNUGKTUZBH-UHFFFAOYSA-N	447.473	1.770	50	20	IDGD	
Cc1ccc(S(C)(=O)=O)cc1C(=O)NNC(=O)[C@H]1CCCN(C(=O)OC(C)(C)C)C1	808010522	BJEJWNBVRZVOMM-AWEZNQCLSA-N	439.534	1.807	50	20	IDGD	
COC(=O)Cc1occc1C(=O)NNC(=O)c1ccc(CSc2nncn2C)cc1	810021523	IQHUJBISEMVVFY-UHFFFAOYSA-N	429.458	1.491	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2cccnc2N2CCCCC2)cc1	813033877	PEBYZRYYNCBVND-UHFFFAOYSA-N	446.533	1.404	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)COc2ccc(Cl)c(F)c2)c1	814722026	GXGYYNZCOVNDIC-UHFFFAOYSA-N	429.857	1.569	50	20	IDGD	
COC(=O)C(C)(C)c1csc(NC(=O)C(=O)NNC(=O)Cc2c[nH]c3ccccc23)n1	815566390	SCJXNRLJDXDUHY-UHFFFAOYSA-N	443.485	1.404	50	20	IDGD	
O=C(NNC(=O)c1ccoc1)C(=O)Nc1cc(Cl)ccc1I	815568262	BFFJJDXOUVNPHR-UHFFFAOYSA-N	433.589	1.937	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)cc2cccnc12	815569130	ILMPJGJIAHJTHZ-UHFFFAOYSA-N	445.476	1.634	50	20	IDGD	
CCOC(=O)CN1C(=O)C(F)(F)c2cc(NC(=O)C(=O)NCCSSC)ccc21	815639846	IQEIKQMWKIOKPW-UHFFFAOYSA-N	447.485	1.754	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(\C#N)C(=O)OCC(=O)NC2CCN(C(C)=O)CC2)c1C	897620470	OXVLVVYADIVZDA-YODDIOPGSA-N	444.532	1.890	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)NCC(=O)NNC(=O)COc2ccc(C)c(C)c2)cc1	913450233	HFINPRQMKWSGEH-UHFFFAOYSA-N	433.486	1.011	50	20	IDGD	
COc1cc(C(=O)N([C@H]2CCS(=O)(=O)C2)N(C)C)ccc1OCc1cscn1	914437431	LFWQVITVWBMBLW-HNNXBMFYSA-N	425.532	1.837	50	20	IDGD	
COCCc1ccc(S(=O)(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)cc1	914845672	IIXKJOQBEPILBE-UHFFFAOYSA-N	444.513	1.790	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)N[C@@H](CN2CCOCC2)c2ccccc2)c1	916216718	SHCIFMJRNBXZBS-FQEVSTJZSA-N	428.489	1.721	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)N[C@H](C)c2nnc3ccccn23)nc1	916222024	QBTYZRUDJHBEBE-CYBMUJFWSA-N	432.510	1.542	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)NCc2ccccc2S(=O)(=O)N(C)C)cc1	916237660	PADDZVFJSNCJSS-UHFFFAOYSA-N	436.559	1.868	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NN=Cc1cccnc1)N(S(C)(=O)=O)CC2	916356338	SHOOUADLDFQHEX-KRWDZBQOSA-N	432.502	1.498	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CN2CCN([C@H](C)C(=O)Nc3cccc(F)c3)CC2)cc1	917124078	DLMBMVXEDLZOEH-QGZVFWFLSA-N	441.507	1.540	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(NC(=S)NNC(=O)c2ccc(Cl)cc2O)c1	917592685	YEXYLNMQZFSGIJ-UHFFFAOYSA-N	428.923	1.927	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)Cc2nc3ccccc3n2C)c(OC)c1OC	917695394	LSKGPZLROCJLQT-UHFFFAOYSA-N	426.473	1.922	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)COc1ccc(C#N)cc1)c1cccc(NS(C)(=O)=O)c1	918086773	OXVDJRZNROCMIH-ZDUSSCGKSA-N	431.474	1.400	50	20	IDGD	
CC[C@@H](NC(=O)NNC(=O)COc1ccccc1C#N)c1ccccc1OCC(=O)NC	918221438	JKVBEYVRFRISIM-QGZVFWFLSA-N	439.472	1.544	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NC2CCN(Cc3ccncc3)CC2)c2ccccc2c1=O	918227084	RQMYMCIFZYXDFB-UHFFFAOYSA-N	449.515	1.420	50	20	IDGD	
CN(C)N(C(=O)[C@H]1CC(=O)N(c2cc(Cl)cc(Cl)c2)C1)[C@@H]1CCS(=O)(=O)C1	919988106	LETGBHXMCYJOMB-SMDDNHRTSA-N	434.345	1.839	50	20	IDGD	
CS(=O)(=O)N1CCC[C@H](NC(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)C1	920239257	ZGEUYCOHTAWEHF-NSHDSACASA-N	444.457	1.030	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)Cc2ccc(C(=O)NNC(=O)c3c[nH]nc3C)cc2)cc1	920404325	ALHZEIQYLNKHJF-UHFFFAOYSA-N	441.513	1.922	50	20	IDGD	
N#C/C(=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)NCCn1ccnc1	920853798	HEYIBAKEDPMEAS-WJDWOHSUSA-N	437.891	1.999	50	20	IDGD	
CCNC(=O)NNC(=O)CSc1nc2ccccc2c(=O)n1Cc1ccccc1OC	920858804	DVVJJNQUKCAJKF-UHFFFAOYSA-N	441.513	1.896	50	20	IDGD	
C[C@H]1CN(Cc2csc(NC(=O)NNC(=O)COc3ccccc3C#N)n2)C[C@H](C)O1	920930684	TYAVKOQMUVJXCU-KBPBESRZSA-N	444.517	1.856	50	20	IDGD	
O=C(CN1C(=O)COc2cc(Br)ccc21)NNC(=O)c1n[nH]c2c1CCCC2	1115844741	WYWFLUVMAGITOF-UHFFFAOYSA-N	448.277	1.238	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCC(=O)N2CCN(c3ccc(Cl)cc3)CC2)cc1	1115936127	YKSDRFVNTPQRJV-UHFFFAOYSA-N	445.907	1.641	50	20	IDGD	
O=C(CCO)NNC(=O)Nc1ccc(I)cc1Br	1320566231	AAAVXHLRKSGACU-UHFFFAOYSA-N	428.024	1.589	50	20	IDGD	
O=C(CCO)NNC(=O)Nc1ccc(CNC(=O)c2ccc(Br)cc2)cc1	1320566312	CDOVFJJAFJZQAX-UHFFFAOYSA-N	435.278	1.914	50	20	IDGD	
CN(C)N(C(=O)C1CCN(C(=O)c2ccc(F)cc2F)CC1)[C@@H]1CCS(=O)(=O)C1	1321404204	UOJFMISXBZKRHM-OAHLLOKOSA-N	429.489	1.309	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3nn(C)c4c3CCC4)C2)C1	1777959799	ZDOPYQLAFOYOJR-ORAYPTAESA-N	439.354	1.383	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)cc([N+](=O)[O-])c1)C2)[C@@H](F)Cl	1778027918	DULFMQNVGNYQSM-IIDMSEBBSA-N	429.832	1.962	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)C3CN(C(=O)OC(C)(C)C)C3)C2)C1	1778124411	MIJCJVFOPPCLTH-QRWLVFNGSA-N	429.945	1.701	50	20	IDGD	
O=C([C@@H]1Cc2ccccc2O1)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1778253241	SWFXHAWJVYWHJR-RLFYNMQTSA-N	427.270	1.511	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)O)C2	1780055188	KFXGBRRIBHXBRL-XMLVGPMBSA-N	449.460	1.028	50	20	IDGD	
C[C@@H]1Oc2ccc(C(=O)N3CC[C@]4(C3)CN(C(=O)[C@@H](F)Cl)CCO4)cc2NC1=O	1780177956	XCVMMGANGIFWSF-CQOVVYFZSA-N	425.844	1.384	50	20	IDGD	
CCOC(=O)C1(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](F)Br)C2)CC1	1780776223	BAZGBNGRWIPETG-IIYDPXPESA-N	449.317	1.534	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2)c1cc(O)cc([N+](=O)[O-])c1	1781093085	WVCUGJZCHSGMJC-FRQCXROJSA-N	441.868	1.028	50	20	IDGD	
C[C@H](Oc1ccccn1)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@](C)(Cl)CCl)C2)C1	1781234613	XCXDNKADCGXZMD-ZOCIIQOWSA-N	430.332	1.915	50	20	IDGD	
COc1nccc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](F)Br)C3)C2)c1F	1781330922	IWHCLSFRFZYJPO-LRDDRELGSA-N	434.237	1.363	50	20	IDGD	
O=C(c1nc2ccccc2o1)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781331965	BRYAQQJYLUGJCW-DYVFJYSZSA-N	426.242	1.962	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccncc1O)C2	1781998074	SGNXELCNTLQERM-CDHAZOANSA-N	426.311	1.698	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(C)ccc3-n3ccnn3)C2)C1	1782169605	VFVMUJQTNYIWMJ-UTKZUKDTSA-N	447.923	1.273	50	20	IDGD	
O=C1Cc2cccc(C(=O)N3CC[C@]4(C3)CN(C(=O)[C@@H](F)Br)CCO4)c2N1	1782411382	DXSOYALUALMJMG-QAPCUYQASA-N	440.269	1.315	50	20	IDGD	
CC[C@@H](O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C[C@@H]21	1783961010	JZTWNLVQRYYBRU-LEUCMJNISA-N	433.455	1.622	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccn4ccnc34)C[C@@H]21	1783966929	MTAVIMSKLIYNTP-OTRWWLKZSA-N	449.349	1.959	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21)[C@@H]1CC(c2ccccc2)=NO1	1784406868	BBMCFYZILXVDSI-OTRWWLKZSA-N	440.327	1.963	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)CCc3cnccn3)C2)C1	1784560819	GRJUUMCSONTKNU-QAPCUYQASA-N	425.327	1.413	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(=O)nc4cccnn34)C[C@@H]21	1784620717	HSECNKWPCNTGRH-JKQORVJESA-N	447.923	1.090	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(CO)c(F)c3)C2)C1	1785266076	IGKJQKISKBPXNP-SGTLLEGYSA-N	429.286	1.545	50	20	IDGD	
Cc1cc(C)n(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)CBr)C[C@@H]32)n1	1785335986	ZZRSVMXMIGXCBO-STECZYCISA-N	441.370	1.511	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnn4ccncc34)C[C@@H]21	1786407236	SQLVICFLWHEZJY-NOLJZWGESA-N	436.310	1.108	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN3CCCCC3)[C@H]2C1	1786711148	VENHPRMEWSUSFX-QAETUUGQSA-N	430.387	1.483	50	20	IDGD	
Cc1cnc(C(=O)Nc2ccc(C3(NC(=O)c4cnccc4C(=O)NN)CCC3)cc2)cn1	1787339745	SSUASHXXUIQDEL-UHFFFAOYSA-N	445.483	1.845	50	20	IDGD	
CN(C)c1ccc([N+](=O)[O-])c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]3C2)c1	1787447695	CPBLCBLJHMYIGO-YJOCZYATSA-N	442.875	1.789	50	20	IDGD	
Cc1ccc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]3C2)cc1[N+](=O)[O-]	1787448585	AKBSZMYPBBEMAK-ILXVDBEPSA-N	427.860	1.960	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)c1cc(O)nc2ccccc12	1787901110	QZBZFXSIDGRUJS-FRJURHEUSA-N	433.892	1.133	50	20	IDGD	
CCc1oncc1C(=O)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1	1788140793	XQYGADVOOUIJOS-UHFFFAOYSA-N	433.273	1.978	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)c1cc2ncccn2n1	1788303743	GCSLQARKCIXDBK-TZQJONAQSA-N	440.273	1.013	50	20	IDGD	
Cc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCBr)C[C@@H]32)c(O)n1	1789307643	LYGNKOGDMBZTFX-QEJZJMRPSA-N	426.311	1.474	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1)c1ccc(O)nc1	1790103266	MXYZLZRGAJZNCV-UHFFFAOYSA-N	431.257	1.529	50	20	IDGD	
CC(C)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(-c3ccccn3)[nH]n1)C2	1792783905	GKDZWOVPFAXUBI-ZSBFGKGUSA-N	431.924	1.940	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1[nH]nc3ccncc13)C2	1792868092	PFNXIXJWJQLWIC-OHTBPHCPSA-N	436.310	1.192	50	20	IDGD	
CC[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)CBr)N(CC)CC	1792868903	VMLUNVRTRKUPNZ-UHDSXZAQSA-N	432.403	1.727	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@@H](C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](O)CCl)C[C@H]2C[C@H]21	1793107830	XDXDPANEWCGADG-OCWHGYOISA-N	441.956	1.622	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nc(Cl)ccc1F)C2	1795111580	XXXLUSQCUFRSHL-WDAIWFPHSA-N	434.693	1.862	50	20	IDGD	
CN(CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1(C)CC1)NC(=O)NCc1ccccc1	1795393862	AKHQIBFXDXXSLF-REPLKXPHSA-N	427.549	1.771	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](N)c1cccc(Cl)c1	1795630506	YMPBRQNZQJSSGT-PEHHYFEISA-N	430.332	1.183	50	20	IDGD	
COc1ccc(-c2cc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@@H](F)Cl)C4)n[nH]2)cc1	1796495686	PUSSAQJIXISOKJ-JGTCGTHISA-N	436.871	1.823	50	20	IDGD	
CN(CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](F)Cl)NC(=O)NCc1ccccc1	1796808586	QOYYJHZEORGXPS-DFGXFYAUSA-N	439.919	1.505	50	20	IDGD	
C[C@@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CO[Si](C)(C)C)C2)[C@@H]1SC(=N)NC1=O	1796878551	HNAURSNUHBKNQS-VVSAWPALSA-N	426.615	1.279	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1=NO[C@@H](c2ccccc2)C1	1797179197	NWFPQBFDAGVKOQ-LMCLKVLCSA-N	435.908	1.347	50	20	IDGD	
COc1cccc(OC)c1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)Br)C2	1798828126	YQUBMEMRLRVREQ-JRATXPSKSA-N	441.322	1.690	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COc1ccc(O)cc1)C2	1799273692	NAZHCRVAYYPCBD-JBYDNAENSA-N	431.316	1.597	50	20	IDGD	
C[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@](C)(Cl)CCl)n1cccc1C=O	1799274663	DIHCOBXSXOBLEZ-HUYPOWGKSA-N	430.332	1.688	50	20	IDGD	
Cn1ncc2c(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@H](F)Br)cccc21	1799347255	JYADTCUQWSFNTQ-OJXGSEEGSA-N	439.285	1.467	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCC(=O)NN(C)C)C2	1799777876	VXIVWBZPFCSRHO-MUJYYYPQSA-N	436.940	1.973	50	20	IDGD	
C[C@@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](C)CBr)C2)N1CCN(C)CC1	1799965406	MCECCBXNKBEABU-VIQHNZTISA-N	429.403	1.292	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H](O)[C@H](C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](F)Cl)C3)C1	1799981955	QXKRPJJFZIMDIK-QLKXBERHSA-N	433.908	1.387	50	20	IDGD	
CN(C)[C@@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)c1ccccc1Cl	1800308817	BCPLPGFJEGYKCZ-KQIDPQQZSA-N	444.359	1.132	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3n(n1)CCCO3)C2	1800641631	GEGCUVPXRCNSQC-OQMKEHIESA-N	441.326	1.042	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)Br)C3)C1	1800967348	OVRXOXZURVEIBV-KLOLGFOXSA-N	445.354	1.339	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(C)nc3ccc(O)cc13)C2	1800976650	AKUJWNQUYCAXAZ-ZZXMYQEDSA-N	447.919	1.706	50	20	IDGD	
Cc1nc2ccc(F)cn2c1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(Cl)Cl	1801016509	GHCRHKPZLJNAKB-GNXNZQSNSA-N	429.279	1.789	50	20	IDGD	
COC(=O)C12CC(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)[C@H](C)CBr)C4)(C1)C2	1801874869	MBXIEDCNHMGIHW-CPBSFBEJSA-N	427.339	1.999	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1CCc2ccccc21	1802528310	XNFOCXJAGOLFHB-CLWJZODNSA-N	433.512	1.667	50	20	IDGD	
CCS(=O)(=O)CC(=O)N1CC[C@@H](CNC(=O)C(C)(C)CCl)[C@H]1c1cccnc1	1802896602	DFTAVXOKEIILKS-DOTOQJQBSA-N	429.970	1.787	50	20	IDGD	
O=C1Cc2cccc(C(=O)N3CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]3c3cccnc3)c2N1	1803146372	AOOURBOKANHFHZ-SYNHAJSKSA-N	442.903	1.496	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cnc3ccc(F)cn23)[C@@H]1c1cccnc1)[C@H](O)CCl	1803147446	HTHRTTKAEBZTJH-POZUXBRTSA-N	445.882	1.788	50	20	IDGD	
CC(C)N1CCC(C(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)CC1	1804143075	ZNWKBFVYPAZNGI-XUVXKRRUSA-N	436.984	1.808	50	20	IDGD	
O=C(/C=C/c1ccoc1)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1804313869	LXCOVXWLVSLOAS-MXBTTZKWSA-N	445.284	1.387	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC2(CCCN(C(=O)C3=NN(C)C(=O)CC3)C2)CC1	1806629167	PBRWAGCHPQASMU-ZDUSSCGKSA-N	427.343	1.609	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)NC[C@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1	1808427740	RWLBXHVHCIOIDV-MZMPZRCHSA-N	439.354	1.739	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)c2cc(CO)on2)[C@H]1c1cccnc1	1812866393	FHUMUGUISPZOAG-GHJWDPDVSA-N	437.294	1.665	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)Cn2ccccc2=O)[C@H]1c1cccnc1	1813030509	IVGZNUYFRQSNQF-UWVAXJGDSA-N	432.908	1.203	50	20	IDGD	
C[C@H]1CC[C@H](C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)CC1	1813546342	OYEWVRGHTFWYJG-SVVKQXANSA-N	449.360	1.907	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)C2CC(F)(F)C2)n[nH]1	1814541720	OECKMUGZQNITII-CQSZACIVSA-N	426.468	1.820	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@H]1CCCSC1)CC2)c1cccc(B(O)O)c1	1815362001	XYQFRSGRKUQKKX-DZGCQCFKSA-N	445.375	1.192	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@H](O)CCl)CC2)c1ccc2c(n1)OCCO2	1816951817	DBLLDLVDCQOEGW-BXKDBHETSA-N	438.893	1.135	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@H]1CCc2nc(NC(=O)c3cnc(O)nc3O)sc2C1	1817086659	AAXWCOSRJYLXKA-HYORBCNSSA-N	446.316	1.806	50	20	IDGD	
CC(C)CNC(=O)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](F)Br)CC2	1817332452	MEIQKPLESLONQM-KCJUWKMLSA-N	435.319	1.518	50	20	IDGD	
Cc1ncc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)s1	1817471790	NKXZIWLGASHDMV-INIZCTEOSA-N	439.306	1.474	50	20	IDGD	
Cc1cc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)cc(O)n1	1818051327	HITRRZYVBNDKNX-GOSISDBHSA-N	449.276	1.118	50	20	IDGD	
Cc1nc(C)c(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)o1	1819799251	ACFRAYGDXRTXSI-QGZVFWFLSA-N	437.265	1.314	50	20	IDGD	
Cc1ccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)c(C)n1	1820046663	LZYKUEGZAXANMZ-HXUWFJFHSA-N	447.304	1.721	50	20	IDGD	
O=C1NCCn2nc(C(=O)N3CCCC[C@@H]3c3cc(NC(=O)C(Cl)Cl)n[nH]3)cc21	1822418319	NFFMYPULVRIXEZ-LLVKDONJSA-N	440.291	1.459	50	20	IDGD	
C[C@H](C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1ccccn1	1822898966	SRLITIVVUUXFGA-MGPUTAFESA-N	447.304	1.594	50	20	IDGD	
O=C(/C=C/C1CCCC1)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2	1822936250	JKMLTJDAICLADP-VGMNTSGFSA-N	439.346	1.795	50	20	IDGD	
O=C(N[C@@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1)c1cnc(O)nc1O	1823005418	ZWJOOWXHYMVTGX-ANLVUFKYSA-N	446.258	1.261	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CNC(=O)N(C)C)CC2	1825632118	PKINLGAOEKBSBX-RKDXNWHRSA-N	432.344	1.110	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1nc(C)c(C)[nH]c1=O)CC2	1825992992	BUNYFXXEMZELJW-MNOVXSKESA-N	439.925	1.323	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](C)S)sc2C1	1826017271	FQZXBUVOPZCKFR-VGCOHKFJSA-N	434.547	1.507	50	20	IDGD	
CN[C@H](CC(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@H](C)CBr)CC1)C(=O)O	1826938454	AAOFAWVIOFSYEG-BMFZPTHFSA-N	446.386	1.700	50	20	IDGD	
COc1ccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)nn1	1829525891	CUSBLHCYPQIFQR-SFHVURJKSA-N	446.552	1.092	50	20	IDGD	
O=C(c1cc2sccc2s1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1830730773	DQIDVFIZXRUBDA-SGTLLEGYSA-N	444.962	1.633	50	20	IDGD	
O=C([C@H](O)CCl)N1CCO[C@]2(COCCN(C(=O)C3(c4ccccc4)CCC3)C2)C1	1830738504	PGDTWTOVNWGXJC-WIYYLYMNSA-N	436.936	1.164	50	20	IDGD	
O=C(c1cc(F)cc(Cl)c1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1830738799	TXAIGUBCJXHFCR-YJBOKZPZSA-N	435.279	1.149	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(OC)n3)C2)C1	1831644490	YPWGWUKOBIUPET-YWZLYKJASA-N	425.913	1.568	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)CCc2cnc[nH]2)CC1	1831872017	ZBGBOBLRYCNKPN-IBGZPJMESA-N	432.569	1.335	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(F)nc2)CC1	1831873549	NYDJNNDBCWJZRM-SFHVURJKSA-N	433.528	1.827	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)C[C@H]3CCCCO3)CCO2)C1	1832351497	PDCBUTGLTFVNON-JTDSTZFVSA-N	447.370	1.576	50	20	IDGD	
CCN(C)[C@@H](C)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](C)CBr)CC2)CC1	1833265007	UXSCYMBBKGSYLP-HOTGVXAUSA-N	445.446	1.929	50	20	IDGD	
Cc1c(F)ccc(C(=O)N2CCC(N3CCC(NC(=O)[C@@H](O)CCl)CC3)CC2)c1N	1833310172	ATVZDJFZRODZCS-SFHVURJKSA-N	440.947	1.501	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccsc3)CCO2)C1	1833959263	DJQCPHNDUIEINX-SUMWQHHRSA-N	431.352	1.849	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccnc(Cl)c3)CCO2)C1	1834185607	KEZXCAUYKAKRKM-SJCJKPOMSA-N	446.729	1.588	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)CC(C)(C)O)CC2)CC1	1834575330	FWQWGYRASYTYOH-MRXNPFEDSA-N	432.403	1.893	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)CSC(=N)N)CC2)CC1	1834652756	AYFJSZTWZGIIIO-GFCCVEGCSA-N	448.431	1.216	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3ccc(C=O)s3)CC2)CC1	1834805024	VAOQYZPLZCHJRU-KRWDZBQOSA-N	441.981	2.000	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cc4cn[nH]c4cn3)CC2)CC1	1835643350	RUIUDSRHPSMMJG-QGZVFWFLSA-N	448.955	1.397	50	20	IDGD	
C[C@@H](Nc1nccs1)C(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836717853	LXAWOLZEAYEDNZ-CZUORRHYSA-N	444.985	1.542	50	20	IDGD	
Cc1nc(C(=O)N2CCC(OC3CCN(C(=O)[C@H](O)CCl)CC3)CC2)sc1C	1836718186	JLUSRYYAQFWDNW-MRXNPFEDSA-N	429.970	1.972	50	20	IDGD	
C[C@@H](Cn1ccnc1)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836720018	GURBXYZPDFPLRV-YJBOKZPZSA-N	426.945	1.118	50	20	IDGD	
Cc1ncc(CC(=O)N2CCOC[C@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)s1	1837718188	ZXXNJIIXBSZUMM-LJQANCHMSA-N	441.626	1.302	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccncc3Cl)CCO2)C1	1837890816	GKQWFCRWBVEUFW-QAPCUYQASA-N	432.304	1.059	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3ccc(O)nc3)CC2)CC1	1838541245	DCSAPZYXDMPSNX-QGZVFWFLSA-N	425.913	1.653	50	20	IDGD	
CCOc1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](Cl)COC)C3)C2)c1	1839020223	QYDKTCYZHGZGOK-NQIIRXRSSA-N	440.924	1.409	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cn(C(C)(C)C)nn3)C2)C1	1839146094	KBQHAIYTJTZFMC-AUUYWEPGSA-N	427.933	1.121	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(O)c([N+](=O)[O-])c3)C2)C1	1839147509	SWLNDFGXORXMTG-LIRRHRJNSA-N	441.868	1.388	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(Cl)c(O)cc3O)CCO2)C1	1839251709	GSMYYCCINXFFSM-YJYMSZOUSA-N	447.315	1.839	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(C)cc(OC)c3)CCO2)C1	1839256792	PSPULRHCVQGYEJ-WIYYLYMNSA-N	440.924	1.327	50	20	IDGD	
O=C(c1ccc(O)c(F)c1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1839305349	IWGCDNQQXQBMNU-RHSMWYFYSA-N	449.248	1.292	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc4ccnn34)CCO2)C1	1839496958	LYDZYNNJAXOYQE-LAUBAEHRSA-N	434.924	1.812	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1[C@@H]3C=CS[C@@H]13)CCO2	1839696552	ABHGEMINUHDDLK-WFEDQXDTSA-N	426.611	1.169	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)n3ccnc3)C2)C1	1839961853	KVHSVFHHSMEHBM-RVKKMQEKSA-N	443.342	1.074	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc4ncccc34)C2)C1	1840152622	NRLKXYQTSNXGAR-GCJKJVERSA-N	447.919	1.559	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)n1cccn1)CCO2	1840444085	CQQAPNUDICVFAV-MPGHIAIKSA-N	443.342	1.074	50	20	IDGD	
O=C(c1ccc(-c2ncc[nH]2)cc1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1840747614	ZXGSOAZPKMCUGX-JXFKEZNVSA-N	436.871	1.681	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H](C(=O)N2CC3(CCCN3C(=O)[C@H](O)CCl)C2)C1	1841354041	FQJSNULDDAFWOP-BZUAXINKSA-N	443.972	1.873	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)[C@H]2C[C@@H]2c2ccc(F)c(F)c2)C1	1841400965	QRWRFBFFNQTOPL-CVEARBPZSA-N	434.487	1.645	50	20	IDGD	
O=C(c1ccc(Cl)nc1Cl)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843011641	ZEFCIOVIVACSJP-UHFFFAOYSA-N	434.088	1.199	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC2(CCCN2C(=O)c2ccc(CS(C)(=O)=O)nc2)C1	1843216653	JJSWAZOCYHPPMX-GFCCVEGCSA-N	444.351	1.227	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1cnc3ccoc3c1)C2	1843415954	HPCFPAOVCBBPKC-AFUMVMLFSA-N	434.456	1.779	50	20	IDGD	
O=C(CCBr)N1CC2(CCCN2C(=O)c2cc(Cl)c3nncn3c2)C1	1844225722	CZCWWTJKRYHIHP-UHFFFAOYSA-N	426.702	1.985	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](C)n1ccnc1	1847677035	XKCLFLFKABYHNA-BVGQSLNGSA-N	441.444	1.793	50	20	IDGD	
C=C1c2ccccc2C(=O)N1[C@@H](C)C(=O)NNC(=O)c1sc(N2CCOCC2)nc1C	10291809	RBCXYPCWEBEXCQ-AWEZNQCLSA-N	441.513	1.564	50	20	IDGD	
Cc1ccnn1-c1ccc(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1	20920287	HCZYOCKMUJAHLM-UHFFFAOYSA-N	433.877	1.556	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)CCn2cnc3sc(C)c(C)c3c2=O)cc1	23565370	ZNRIFSCHXBMHEC-UHFFFAOYSA-N	442.497	1.778	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)CNC(=O)Cc2cccc3ccccc23)C[C@@H](C)O1	38688500	FZHCFRNGXQWXLP-CALCHBBNSA-N	426.517	1.145	50	20	IDGD	
Cc1cccc([C@H](CNC(=O)NNC(=O)CNC(=O)c2cccs2)N2CCOCC2)c1	725874095	XHAZWYJWWBUMIA-KRWDZBQOSA-N	445.545	1.190	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2N2CCOCC2)cc1C	726281191	FJDVXVFDJRUHAB-UHFFFAOYSA-N	441.444	1.448	50	20	IDGD	
Cc1ccccc1C1(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)CC1	726718661	JWFMAOLGSYIWHT-UHFFFAOYSA-N	430.530	1.921	50	20	IDGD	
N#Cc1ccc(C(=O)NCC(=O)NNC(=O)COc2ccc(Br)cc2)cc1	726983060	GWIPVFMRNFFZRV-UHFFFAOYSA-N	431.246	1.277	50	20	IDGD	
O=C(CSc1nnc(O)nc1O)NN=C1CCc2c(F)cc(Br)cc21	727776723	CTSAXPRIBMJZMT-UHFFFAOYSA-N	428.243	1.743	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)c2ccc(S(=O)(=O)N(C)CCO)cc2)c1C	728312290	LBGVFDVZEKUPJF-MRXNPFEDSA-N	449.529	1.145	50	20	IDGD	
C[C@@H](NC(=O)c1n[nH]c2ccccc12)C(=O)OCC(=O)NNC(=O)c1ccc(Cl)cc1	728371353	XNCRCKAABPXPDE-LLVKDONJSA-N	443.847	1.339	50	20	IDGD	
O=C(CN1C(=O)Cn2c(cc3ccccc32)C1=O)NNC(=O)Cn1ccc2ccccc21	729454450	VBPRYKUHDIMMOD-UHFFFAOYSA-N	429.436	1.426	50	20	IDGD	
CC(=NNC(=O)CCc1ccccc1O)c1ccc(S(=O)(=O)N2CCOCC2)cc1	729935198	MXAANVOOZHXLDD-UHFFFAOYSA-N	431.514	1.886	50	20	IDGD	
O=C(COC(=O)c1cc(F)ccc1N1CCOCC1)NNC(=O)c1ccc([N+](=O)[O-])cc1	730862499	QEUYUBZAEGJQNN-UHFFFAOYSA-N	446.391	1.189	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)c1cccc(NC(=O)CSc2nncn2C)c1	731494608	YFPHHJIBGAJEFS-UHFFFAOYSA-N	440.485	1.629	50	20	IDGD	
COc1ccccc1N(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)c2c[nH]nc2C)cc1	731879698	WDHRAQJQSIZYFV-UHFFFAOYSA-N	443.485	1.627	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)NCCCC(=O)N2Cc3ccccc3C2)cc1C	732474048	FJCOPVHENZSHGQ-UHFFFAOYSA-N	437.500	1.895	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN(C)[C@H]1CCN(CC(F)(F)F)C1=O	732815134	VVHQEMLRGSWFNZ-LBPRGKRZSA-N	436.818	1.205	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc(F)c(F)c1)NNc1ccc(Br)nc1	732837240	YXOAJXOVHGHVNA-UHFFFAOYSA-N	435.250	1.934	50	20	IDGD	
CN1CCN(c2ncccc2CNC(=O)NNC(=O)NCc2ccc(Cl)cc2)CC1	732996314	FYOIEBRXORJQHW-UHFFFAOYSA-N	431.928	1.700	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N[C@H](CCSC)C(=O)NNc2cnccn2)cc1	734245022	CHCIYOCDKKEDAM-OAHLLOKOSA-N	425.536	1.419	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)[C@H]1CCCCN1S(C)(=O)=O	734250899	OORNYKZAPPDFKB-CQSZACIVSA-N	432.568	1.021	50	20	IDGD	
COc1ccc([C@H]2[C@H](C(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)CCC(=O)N2C)cc1	734315075	GLJORRCKKILBHX-MJGOQNOKSA-N	426.429	1.974	50	20	IDGD	
CCOc1ccc(CN2C(=O)c3ccccc3C2=O)cc1C(=O)NNC(=O)c1cnn(C)c1	735446190	CFJWSXHUPNGSJC-UHFFFAOYSA-N	447.451	1.690	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)N2CCC(C(=O)NNc3cccnn3)CC2)cc1	736702066	WPRFEZWOBSUCKA-UHFFFAOYSA-N	433.490	1.197	50	20	IDGD	
CN(C)[C@H](C(=O)NNC(=O)c1csc(N2CCOCC2)n1)c1c(F)cccc1Cl	740740091	OAPOJHGYLIKKJI-HNNXBMFYSA-N	441.916	1.836	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](C(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1)c1cccc(Cl)c1	740815046	IABQZOWRJLTBQH-JSGCOSHPSA-N	445.925	1.488	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NCc2nc(-c3ccc(F)cc3)n[nH]2)c2ccccc2c1=O	741414499	JXDBNWUHZQANAC-UHFFFAOYSA-N	436.407	1.002	50	20	IDGD	
CCCc1c(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)nnn1-c1cccc(C(C)C)c1	741672740	PVXAQCAFJCOXTB-OAHLLOKOSA-N	448.549	1.474	50	20	IDGD	
O=C(NNc1c(F)cc(F)cc1Br)C1=CN2CCS(=O)(=O)N=C2C=C1	741979807	ITZTXFIPGCKSMU-UHFFFAOYSA-N	433.234	1.668	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2ccc(OCCC(C)C)c(OC)c2)c[nH]1	743251696	UWDAXYYBJGMSEG-UHFFFAOYSA-N	439.490	1.858	50	20	IDGD	
COC(=O)c1ccc(S(=O)(=O)NNC(=O)c2ccc(C)cc2O)c(Br)c1	743254976	WHJGCWHQNMWZDM-UHFFFAOYSA-N	443.275	1.873	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)N[C@@H]1CCCN(c2ccccc2Cl)C1=O	743580126	ULWUDRDAOMYNIQ-CYBMUJFWSA-N	449.920	1.657	50	20	IDGD	
Cc1[nH]c(C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)c(C)c1C(=O)OC(C)C	744572495	RFTMQAJAJVLBJJ-UHFFFAOYSA-N	426.429	1.686	50	20	IDGD	
O=Cc1cccc(OCCC(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)c1	744620060	BBTIXXYLXNXRPR-UHFFFAOYSA-N	433.486	1.432	50	20	IDGD	
C[C@H](CC(=O)c1ccccc1F)C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	745488036	HDLZCIOBACIAJZ-YJYMSZOUSA-N	444.415	1.565	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)NCCCN2CCC[C@H](C(N)=O)C2)c(C)n1-c1ccccc1	745831321	FSTKCHCIGNPANR-SFHVURJKSA-N	440.548	1.626	50	20	IDGD	
Cc1ccc(N2CCC[C@H](NC(=O)NNC(=O)COc3ccccc3[N+](=O)[O-])C2=O)cc1	745879497	SSBBLEOSAYVVKK-INIZCTEOSA-N	441.444	1.808	50	20	IDGD	
Cn1c(NNC(=O)CC[S@](=O)c2ccc3c(c2)OCCO3)nc2ccccc2c1=O	746257550	AJZNKPBGVGRJFT-PMERELPUSA-N	428.470	1.346	50	20	IDGD	
CN(CC(=O)NNC(=O)CNC(=O)c1cccs1)c1ccc(C(F)(F)F)cc1C=O	746591575	FQFBXAVQSAUCLJ-UHFFFAOYSA-N	442.419	1.593	50	20	IDGD	
CN1CCN(C[C@H](NC(=O)NNC(=O)Cc2cn3ccccc3n2)c2ccccc2)CC1	746761277	KYAJNXAMFGDTPW-FQEVSTJZSA-N	435.532	1.196	50	20	IDGD	
C[C@@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)NNC(=O)c2cccc3cccnc23)C1=O	747427162	CXEQKXDLGPQPLJ-QFIPXVFZSA-N	435.415	1.602	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)NCCCN2CCN(c3ccncc3)CC2)c1	748464432	DAFXNQWPPJDPNA-UHFFFAOYSA-N	440.548	1.620	50	20	IDGD	
CC(C)OCCS(=O)(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	748790370	FWVJYKKBXUJLFY-UHFFFAOYSA-N	444.517	1.378	50	20	IDGD	
Cc1c(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)c(=O)oc2ccccc12	750623882	MMECNSPNQSFIHI-UHFFFAOYSA-N	443.481	1.879	50	20	IDGD	
O=C(O)c1cc([N+](=O)[O-])cc(S(=O)(=O)NNC(=O)c2cccc(C(F)(F)F)c2)c1	751141568	FIZHIXJXRWTPSM-UHFFFAOYSA-N	433.320	1.935	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2ccc(C(=O)CCC(=O)O)cc2)cc1OC	751203941	ZDPXOIKNOSEDAB-UHFFFAOYSA-N	436.442	1.375	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(S(=O)(=O)NCC(F)(F)F)cc1)C1CCCC1	751269440	MDEUUFSPACDASW-UHFFFAOYSA-N	429.442	1.027	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)NNC(=O)c2cc(F)ccc2Br)c(C)o1	751377087	SPBSTIVSOGBKPU-UHFFFAOYSA-N	434.243	1.473	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)N[C@@H]2CCCN(Cc3ccccn3)C2=O)nc2ccccc21	753301268	ZXYMZTCLEMUTEQ-QGZVFWFLSA-N	435.488	1.032	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(NC(=O)NNC(=O)[C@H](C)OCCOC)ccc1C	755395002	XWFNLBBOERCSNU-AWEZNQCLSA-N	430.527	1.230	50	20	IDGD	
Cc1ccc(C(=O)Nc2ccccc2)cc1NC(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O	755826952	QUWZDJWMOLVAJP-CYBMUJFWSA-N	433.490	1.338	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)Nc2ccc(OC[C@@H]3CCCO3)cc2)c2ccccc2c1=O	755960405	MZZKUCSYMXIGLR-INIZCTEOSA-N	437.456	1.958	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)Nc1ccc(N2CCc3sccc3C2)cc1	756276960	OMGCHDGEQLNSQI-CQSZACIVSA-N	434.543	1.898	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)N[C@H]1CCN(c2ccccc2OC)C1=O	757287821	SPKIFZMOVVPHEP-INIZCTEOSA-N	426.473	1.772	50	20	IDGD	
CC(C)[C@H](NS(=O)(=O)c1ccc2ccccc2c1)C(=O)NNc1ccc(C(N)=O)nn1	757409293	ZUDOFEKEDXCSBX-SFHVURJKSA-N	442.501	1.175	50	20	IDGD	
COc1ccc(OC)c(CCCNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1	758760359	GOCLJRKVMBVBIU-UHFFFAOYSA-N	442.520	1.673	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)c3ccc(Br)cc3-n3cncn3)nc21	759109172	VCHAMBGGBBZNAK-UHFFFAOYSA-N	430.226	1.169	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(-c3nnc(S)o3)cc2)c1	759375729	QEZOFAURMNOSLY-UHFFFAOYSA-N	447.498	1.350	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccnn1Cc1ccc(F)cc1	760278741	GOECTPIWFOWYGU-UHFFFAOYSA-N	426.364	1.378	50	20	IDGD	
C[C@H]1Cc2cc(C(=O)NNC(=O)CCNC(=O)OC(C)(C)C)ccc2N1S(C)(=O)=O	760437616	IIBDYEGZEFCEDL-LBPRGKRZSA-N	440.522	1.073	50	20	IDGD	
Cc1ccc(-c2n[nH]c(SCC(=O)NNC(=O)CCNC(=O)OC(C)(C)C)n2)cc1	760439529	PHQQTBFMMZHXHM-UHFFFAOYSA-N	434.522	1.934	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNC(=O)C(C)(C)C)cc1S(=O)(=O)N1CCCC1	761072102	JWWNRKWJIXLJLE-UHFFFAOYSA-N	440.522	1.002	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)[C@@H](Cc1ccc(F)cc1)n1nnnc1C	762409752	RQQBXFHWGNICTD-MRXNPFEDSA-N	444.492	1.853	50	20	IDGD	
O=C(NNc1nccc(N2CCOCC2)n1)c1occc1CS(=O)(=O)c1ccccc1	762850897	NDLKBMUYLRDNBB-UHFFFAOYSA-N	443.485	1.637	50	20	IDGD	
CSCC[C@H](NC(=O)Cc1ccccc1)C(=O)NNc1nccc(N2CCOCC2)n1	762856983	PNYZGUJILGRJJL-KRWDZBQOSA-N	444.561	1.237	50	20	IDGD	
CN1CC[C@@H](CNC(=O)NNC(=O)C(=O)N2CCCC2)[C@H]1c1ccc(Cl)c(F)c1	763090263	BCSQQZRRESIGGW-XJKSGUPXSA-N	425.892	1.425	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)NCc2ccnc(OCCN(C)C)c2)c1C	763097675	IHRZJEXBSKMNOV-KRWDZBQOSA-N	429.521	1.937	50	20	IDGD	
Cc1noc(COc2ccc(NC(=O)C(=O)NNC(=O)c3ccc4ccccc4n3)cc2)n1	763450449	OFLGAONIAJTDNX-UHFFFAOYSA-N	446.423	1.905	50	20	IDGD	
O=C(NNC(=O)c1cccnc1)C(=O)Nc1cccc(COCC(F)(F)C(F)F)c1	763491554	NUYCYDPVPSFLFQ-UHFFFAOYSA-N	428.342	1.898	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cccc(CSC)c2)cc(OC)c1OC	763540018	PKCBIGCRUWBKHJ-UHFFFAOYSA-N	433.486	1.975	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)cccc1N1CCOC1=O	763547548	DKEJFLQRBPBTIZ-UHFFFAOYSA-N	426.385	1.080	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)n([C@@H]2C[C@H]3CC[C@H]2C3)n1	763573861	VKOJRRKTDVXART-AFIMGQEJSA-N	439.472	1.479	50	20	IDGD	
CC(=O)N1CCCc2cc(NC(=O)C(=O)NNC(=O)c3cc(-c4ccccc4)[nH]n3)ccc21	763601062	NQRMZONTPHYBIY-UHFFFAOYSA-N	446.467	1.776	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccc(Oc2cnccn2)c1	763663808	NWMRMIMEYFBANR-UHFFFAOYSA-N	437.412	1.442	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cc(C3CC3)nn2-c2ccccc2)cc1	763675249	UHUJCSSILCNUGT-UHFFFAOYSA-N	444.451	1.786	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(C)c(C(=O)NC(C)C)c2)cc1C	763678670	ABRSRANQSZUTNK-UHFFFAOYSA-N	440.500	1.915	50	20	IDGD	
Cc1coc(-c2ccc(C)c(NC(=O)C(=O)NNC(=O)COc3ccc(C#N)cc3)c2)n1	763680511	FLAYKTXJEQQHIQ-UHFFFAOYSA-N	433.424	1.995	50	20	IDGD	
CN(C)CCOc1ccc(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)cc1	763745721	JETASYPDVQJBBP-UHFFFAOYSA-N	439.516	1.166	50	20	IDGD	
CCCNC(=O)[C@@H]1CN(C(=O)C(=O)NNC(=O)c2cccc(Cl)c2)c2ccccc2O1	763747526	ANNMLOLKQGIDOZ-KRWDZBQOSA-N	444.875	1.421	50	20	IDGD	
CN1CCCN(c2ccc(NC(=O)C(=O)NNC(=O)c3cccc(Cl)c3)cc2)CC1	763751041	WCPVRECQBSDJPU-UHFFFAOYSA-N	429.908	1.882	50	20	IDGD	
CCNC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2cc(OC)cc(OC)c2)c1	763775939	ZQZDSLRYCNLHMG-UHFFFAOYSA-N	429.433	1.245	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccccc2CS(C)(=O)=O)c1C	763838570	ALOWPFZZTSWXLI-HNNXBMFYSA-N	447.513	1.401	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)C(=O)Nc1ccc(-n2cccn2)nc1	763856290	ZEEGLAGYIWUNBF-OAHLLOKOSA-N	444.451	1.974	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccn(CC(F)F)n2)cc1	763865865	LVGIUYCQYIYIJW-NSHDSACASA-N	425.392	1.100	50	20	IDGD	
CSc1cc2c(cc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccccc1F)OCCO2	763866154	UJXSPHSTQNMENA-LLVKDONJSA-N	449.460	1.872	50	20	IDGD	
COCCn1ccc2ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc3ccc(F)cc3)cc21	763866439	PPTJZYCFBDBGCA-CQSZACIVSA-N	442.447	1.980	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccc(CC(=O)N(C)C)cc1	763871367	GCVOFESULFMGRI-CYBMUJFWSA-N	430.436	1.010	50	20	IDGD	
CNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(C(C)=O)cc2)c1C	763873210	SMQPMKJBVSZNMZ-AWEZNQCLSA-N	440.456	1.111	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2nc(C(C)(C)C)ns2)cc1	763879040	VTWYKTHSWVBLDR-LLVKDONJSA-N	433.490	1.592	50	20	IDGD	
O=C(CCSc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccccc1-n1cncn1	763894565	CUABXVFFYCJOAJ-UHFFFAOYSA-N	428.449	1.675	50	20	IDGD	
O=C(NNC(=O)c1cc(Cl)ccc1O)C(=O)Nc1ccc(CN2C(=O)CCC2=O)cc1	763978072	ZYULPMANHOVWCY-UHFFFAOYSA-N	444.831	1.094	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)N1C[C@H]2CCCN2c2ccccc21	764004853	PBSOMOGDJJYGOS-CYBMUJFWSA-N	446.305	1.564	50	20	IDGD	
CN1C(=O)COc2ccc(NC(=O)C(=O)NNC(=O)c3cccc(Br)c3)cc21	764058179	DDVJVYALTLLXSG-UHFFFAOYSA-N	447.245	1.204	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cccc([C@H]4CNC(=O)C4)c3)n[nH]2)cc1	764111636	PQXYEDUFZUVZOU-MRXNPFEDSA-N	446.467	1.388	50	20	IDGD	
CN1CCCCC/C1=N/S(=O)(=O)c1cccc(NC(=O)C(=O)NNC(=O)CC2CC2)c1	764141990	JOFLSSBCYFCWMO-ULJHMMPZSA-N	449.533	1.166	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)C(=O)Nc2cc(C#N)ccc2OC)c1	764232345	SNCDEFBDAAHLMF-UHFFFAOYSA-N	447.245	1.738	50	20	IDGD	
Cc1ncsc1C(=O)NNC(=O)C(=O)Nc1ccc(F)cc1-c1nc(C2CC2)no1	764248085	YWDQHIAQKYDPPO-UHFFFAOYSA-N	430.421	1.918	50	20	IDGD	
O=C(NNC(=O)c1cc(F)ccc1Br)C(=O)Nc1ccc(-n2nccn2)cc1	764276422	DMCXVGPNULKGQZ-UHFFFAOYSA-N	447.224	1.569	50	20	IDGD	
CCOCC(=O)NNC(=O)C(=O)Nc1ccc(N2CCC(OC)CC2)c(C(F)(F)F)c1	764317065	FESIPZZHMLCYBE-UHFFFAOYSA-N	446.426	1.443	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)C(=O)Nc1cccc(CN2CCOC2=O)c1	764350414	FOYARJZUZRAUOQ-UHFFFAOYSA-N	448.439	1.224	50	20	IDGD	
CCN1CCN(c2ccc(NC(=O)C(=O)NNC(=O)COCc3ccccc3)cc2)CC1	764366026	IWGZZOBRIGKBJP-UHFFFAOYSA-N	439.516	1.131	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NN=Cc3ccc(F)c(F)c3)CC2)cc1	764820379	XJDGWRTXPZFYKF-UHFFFAOYSA-N	436.484	1.730	50	20	IDGD	
COc1ccc(N2C[C@@H](C(=O)NNC(=O)c3cc(-c4ccccc4OC)[nH]n3)CC2=O)cc1	765598813	AHWJMSGEGSJVMN-AWEZNQCLSA-N	449.467	1.908	50	20	IDGD	
CC(C)(C)OC(=O)N1CCO[C@H](C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)C1	765606469	AANJKIPLUPDQPO-INIZCTEOSA-N	433.440	1.613	50	20	IDGD	
C[C@@H]1CCCC[C@@]12NC(=O)N(CC(=O)NNC(=O)c1cc(-c3ccc(F)cc3)[nH]n1)C2=O	765617316	GCBYCNFYJOLSEB-XUSGNXJCSA-N	442.451	1.478	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccn(-c3ccc(F)cc3F)n2)c1	766629085	BDECUEVIYWAAIF-UHFFFAOYSA-N	449.439	1.476	50	20	IDGD	
CC(C)COc1ccccc1C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	766635910	IPMRVMCKTFKODP-UHFFFAOYSA-N	438.528	1.940	50	20	IDGD	
CCOC(=O)NNC(=O)c1ccc(NC(=O)C[C@@H]2SC(N3CCCC3)=NC2=O)cc1	767185507	BQDGAGABMLPVKW-AWEZNQCLSA-N	433.490	1.500	50	20	IDGD	
O=C(CCC(=O)N1CCN(c2ccccn2)CC1)NNc1ccc(Br)nc1	768026808	CTCSQNPYMBGOLN-UHFFFAOYSA-N	433.310	1.811	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)Cc2cc(F)c(F)cc2F)cc1OC	768081853	NGDXOZJZFQFPKM-UHFFFAOYSA-N	426.347	1.668	50	20	IDGD	
CCC(=O)N1CCCC[C@H]1C(=O)NNC(=O)c1cc(-c2ccc(OC)c(OC)c2)[nH]n1	768276224	IVMZAAMZQUDBFV-INIZCTEOSA-N	429.477	1.646	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1cc(Br)cc([N+](=O)[O-])c1	770174260	KWYJMISQMYZJLM-UHFFFAOYSA-N	449.265	1.825	50	20	IDGD	
COC(=O)C1(NCCP(=O)(c2ccccc2)c2ccccc2)CCS(=O)(=O)CC1	770176735	MCSGCSAAGSXLJI-UHFFFAOYSA-N	435.482	1.711	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)NCc3cccc(NC(=O)c4ccccn4)c3)nc21	770349765	MDRGKXUHSHZSNU-UHFFFAOYSA-N	433.432	1.543	50	20	IDGD	
COC(=O)c1cc(C(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)cc([N+](=O)[O-])c1	770965671	MMCZJKNBDUEWDN-UHFFFAOYSA-N	429.393	1.739	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1c(Cl)ccc(S(=O)(=O)NC)c1Cl	772181581	NITQNTNJKGUCAF-SSDOTTSWSA-N	426.278	1.004	50	20	IDGD	
O=C(COc1ccc2ccc(=O)oc2c1)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772192633	MZPOTNYWKKCLOY-UHFFFAOYSA-N	429.816	1.289	50	20	IDGD	
O=C(C[C@H]1CN(Cc2ccccc2)CCO1)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772889572	QXFCRYDRABGZJB-IBGZPJMESA-N	444.919	1.395	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNS(=O)(=O)c1cccc(S(C)(=O)=O)c1	773267046	VSLUUFVHKNREAX-NSHDSACASA-N	432.907	1.521	50	20	IDGD	
Cc1cccc(-n2cc(C(=O)NNC(=O)[C@H]3CCCN(C(=O)OC(C)(C)C)C3)nn2)c1	773416612	CKNQFCDTJOVRQA-HNNXBMFYSA-N	428.493	1.984	50	20	IDGD	
O=C(NNc1ccccc1[N+](=O)[O-])C(=O)Nc1ccc(CC(=O)N2CCSCC2)cc1	773648200	ONXJJEXTVRSZDA-UHFFFAOYSA-N	443.485	1.795	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2cccc(N3C(=O)c4ccccc4C3=O)c2)n1	773725937	BZATXEFWYBFSRT-UHFFFAOYSA-N	432.396	1.368	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)N[C@@H](C)[C@H](OC)c1ccc(Br)cc1	774343152	HLBMWDFGNRHWQZ-ZOWXZIJZSA-N	432.315	1.907	50	20	IDGD	
COc1ccccc1[C@](N)(C(=O)NNC(=O)CNC(=O)c1cccs1)C(F)(F)F	776133873	APURZEWWGMMDGW-INIZCTEOSA-N	430.408	1.050	50	20	IDGD	
O=C(NCCCC(=O)N1CCN(S(=O)(=O)CBr)CC1)c1ccccc1	777777428	IZTZCPXFBGYLFU-UHFFFAOYSA-N	432.340	1.023	50	20	IDGD	
CN1CCc2cc(C(=O)NNC(=O)c3ccc(S(=O)(=O)N4CCCC4)cc3)ccc21	778292492	CIOWHZKGWNZBAX-UHFFFAOYSA-N	428.514	1.538	50	20	IDGD	
CCOc1ccc(/C=C(/C#N)C(=O)N2CCC[C@H](S(=O)(=O)N3CCOCC3)C2)cc1	779581869	CIEAIKBCYIOETO-BXWQOUMASA-N	433.530	1.645	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)nn1-c1cccc(F)c1	782893898	OJFNHQIJTPDIMW-UHFFFAOYSA-N	449.446	1.535	50	20	IDGD	
COc1ccc(C(=O)N2CCN(C)CC2)cc1NC(=O)C(=O)NNc1ccc(F)cc1C	783447675	KMENRHFDWKNRFM-UHFFFAOYSA-N	443.479	1.612	50	20	IDGD	
CCOCCOc1ccc(Br)cc1NC(=O)C(=O)NNc1ncc(F)cn1	784955131	BVLQJFQKTRSUFE-UHFFFAOYSA-N	442.245	1.875	50	20	IDGD	
CCCCN1CCc2ccc(NC(=O)C(=O)NNC(=O)c3cc([N+](=O)[O-])ccc3O)cc21	785022919	BISAEVZQGJJZJJ-UHFFFAOYSA-N	441.444	1.863	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)N[C@H]1CCOc2c(F)cccc21	785562447	FTURWYGKKFTFJE-AWEZNQCLSA-N	435.481	1.895	50	20	IDGD	
O=C(COC(=O)c1c[nH]cc1-c1ccccc1F)NNC(=O)[C@@H]1COc2ccccc2O1	787199876	PKJRYEXYYWQBOW-IBGZPJMESA-N	439.399	1.965	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)CN1CCc2ccccc2C1=O	788719562	HXSGVEMXIJLARA-UHFFFAOYSA-N	435.528	1.045	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)N1CCC(c2ncc3n2CCCC3)CC1	789840261	WXROOTDCLNJOOG-UHFFFAOYSA-N	430.534	1.631	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc([N+](=O)[O-])c1C	790110597	NHXICAZXOYDXCP-UHFFFAOYSA-N	441.488	1.885	50	20	IDGD	
O=C(NNc1c(F)cc(C(=O)NC2CC2)cc1F)C(=O)Nc1cccc(N2CCC2=O)c1	790965846	IQUZWLHCCAHOMX-UHFFFAOYSA-N	443.410	1.676	50	20	IDGD	
C[C@](O)(Cn1cc(C(F)(F)F)ccc1=O)C(=O)NNC(=O)c1cccc(OC(F)F)c1	792135994	IOFXAKLXJSBCOA-KRWDZBQOSA-N	449.332	1.681	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1ncsc1C(F)(F)F	792208634	GJEJPNGYJKRGCN-UHFFFAOYSA-N	436.437	1.940	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@@H](C(=O)NNC(=O)C(=O)Nc1ccccn1)c1ccc(F)cc1	792222393	RUFUOUDBHFZIEG-OAHLLOKOSA-N	445.451	1.615	50	20	IDGD	
COc1ccc(-c2nnc(SCC(=O)NNC(=O)c3ccccc3Cl)n2N)cc1	792852995	BIIJMCASRFKJLJ-UHFFFAOYSA-N	432.893	1.874	50	20	IDGD	
C[C@H](O)CN1CCN(C(=O)CCC(=O)C(C#N)=C2N(C)c3ccccc3N2C)[C@H](C)C1	793873492	GZUKDZDQOMBUOQ-SJORKVTESA-N	425.533	1.571	50	20	IDGD	
CCNC(=O)N(C)c1cccc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCC3)c1	796989887	KPCRLEFBZOVGPK-UHFFFAOYSA-N	429.502	1.802	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)Nc3ccc(S(=O)(=O)N(C)C)cn3)cc2C1	797652790	PDNSBEWFKSCSIQ-NSHDSACASA-N	437.547	1.985	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(O[C@H]3CCN(C)C3=O)cc2C)c(C)o1	799256948	BVHYDWFORLPYEH-KRWDZBQOSA-N	428.445	1.214	50	20	IDGD	
NC(=O)c1ccc(NNC(=O)c2sc(N3CCOCC3)nc2-c2ccccc2)nn1	799839137	LDPUJVODVRLUIC-UHFFFAOYSA-N	425.474	1.293	50	20	IDGD	
N#Cc1ccc(NNC(=O)C(=O)Nc2ccc(OCCC(N)=O)cc2)c(C(F)(F)F)c1	799839879	BPZIAQXIPNWKOZ-UHFFFAOYSA-N	435.362	1.913	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)Nc2cccc(C(=O)NCC(=O)NC)c2)o1	800597397	VYJRQDPKGZSQOQ-UHFFFAOYSA-N	444.492	1.064	50	20	IDGD	
CC(=O)N1Cc2ccccc2C[C@H]1C(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	802066368	MHUFAHVPQGZYPW-SFHVURJKSA-N	430.486	1.216	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)CSc2nnnn2C2CCCC2)cc1	802066899	DFIFNABTIVAVQL-UHFFFAOYSA-N	439.523	1.137	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(NC(=O)CC(F)(F)F)cc2)c1	802566895	HWCCBNDKUHOQRM-UHFFFAOYSA-N	433.346	1.849	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C(=O)Nc2ccc(OC(F)F)cc2F)nc2ccccc21	802570482	PZQRWBSBLZXFBW-UHFFFAOYSA-N	435.362	1.642	50	20	IDGD	
CC(C)c1nccnc1NNC(=O)C1(S(C)(=O)=O)CCN(C(=O)OC(C)(C)C)CC1	803226398	VFXZZAUJPBUWIM-UHFFFAOYSA-N	441.554	1.857	50	20	IDGD	
NS(=O)(=O)c1ccc(Br)c(C(=O)NNc2ccc3c(=O)[nH]ccc3c2)c1	803430212	BPFHLEYZYXIXFM-UHFFFAOYSA-N	437.275	1.695	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)C1(n2cccn2)CCN(C(=O)OC(C)(C)C)CC1	803619483	AQRKWXXIKIEGMB-CQSZACIVSA-N	437.497	1.098	50	20	IDGD	
O=C(NNC(=O)c1cccc(OC(F)F)c1)N[C@@H]1CCCN(C(=O)N2CCCC2)C1	805065876	PRHVQGXHDHLRJU-CQSZACIVSA-N	425.436	1.912	50	20	IDGD	
O=C(NC[C@H](c1cccs1)N1CCOCC1)NNC(=O)c1nnc(O)c2ccccc12	806993506	AXLLWUYJIHIYDT-OAHLLOKOSA-N	442.501	1.414	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc2c(c1)CCN2C(=O)C(=O)NNc1cccc(F)n1	807392326	KWMWRJYNVMPMBX-UHFFFAOYSA-N	435.481	1.284	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2nccnc2C2CCC2)cc1S(=O)(=O)N(C)C	807462003	FZEJZKMDCMCTAG-UHFFFAOYSA-N	432.506	1.385	50	20	IDGD	
O=C(NNc1nccnc1C1CCC1)C(=O)Nc1cc2c(cc1[N+](=O)[O-])OCCCO2	807462339	WEMPFMUWEWZYMG-UHFFFAOYSA-N	428.405	1.895	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cccc3cccnc23)cc2[nH]ccc12	808934558	KXYYUCGJECQLPZ-UHFFFAOYSA-N	431.408	1.902	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)cc2[nH]ccc12	808934725	SJZZCLRBAKPVCT-NSHDSACASA-N	442.403	1.647	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)OCC(=O)N(CCC(N)=O)c2ccc(F)cc2)cc(C#N)n1C	809303041	PLWMBNNJXIMFBW-SXGWCWSVSA-N	437.431	1.703	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)CNS(=O)(=O)c3cccc(F)c3)n[nH]2)cc1C	810584878	ICAXLGNJHYABNI-UHFFFAOYSA-N	445.476	1.572	50	20	IDGD	
COC(=O)Cc1cccc(S(=O)(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)c1	811700345	JTFYADKTEMFOPT-LBPRGKRZSA-N	426.878	1.833	50	20	IDGD	
COC[C@]1(CNC(=O)NNC(=O)c2cc(OC)cc(OC)c2)OCCc2ccccc21	811922437	OAPFTORDIPZWFJ-QFIPXVFZSA-N	429.473	1.762	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(=NNC(=O)N[C@@H]2CCS(=O)(=O)C2)[C@H]([C@H]2CCOC2)C1	812227167	SVOBWYFUGIUVJT-ZNMIVQPWSA-N	444.554	1.122	50	20	IDGD	
O=C(NNc1nc(-c2ccccn2)nc2c1CCC2)C(=O)N1CCN(c2ccccc2)CC1	812521865	WDNQNFWYGJLTJY-UHFFFAOYSA-N	443.511	1.819	50	20	IDGD	
C[C@H]1C[C@H](NC(=O)NNC(=O)COc2ccc(C#N)cc2)c2ccsc2S1(=O)=O	812649872	IJVOCJIAQNADNY-NHYWBVRUSA-N	434.499	1.636	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)cc1)C1CC1	815569474	VRWZBOBFGOWUTF-UHFFFAOYSA-N	433.468	1.943	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNc2ccc(S(C)(=O)=O)cc2)cc1)[C@H]1C[C@H]1C	815585182	ADPKSNMRPIDWHK-YJYMSZOUSA-N	444.513	1.933	50	20	IDGD	
N#Cc1ccc(Oc2ccc(NC(=O)C(=O)NNC(=O)[C@@H]3CCc4nncn4C3)cc2)cc1	815690961	AVTWWENMIWOBLK-OAHLLOKOSA-N	445.439	1.291	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)NNc2cc(C(=O)OC)ccc2Br)c(C)o1	816717094	NMFWCYVHGAAARR-UHFFFAOYSA-N	446.279	1.802	50	20	IDGD	
COc1ccc(OC)c(C2=NO[C@@H](C(=O)NNc3ccccc3S(=O)(=O)N(C)C)C2)c1	817051681	OSOGKWWHFOFJIP-GOSISDBHSA-N	448.501	1.590	50	20	IDGD	
Cc1ccc2c(c1)C(=O)N([C@@H](C)C(=O)NNc1ccccc1S(=O)(=O)N(C)C)C2=O	817055192	QLNISUCKKLJRLY-ZDUSSCGKSA-N	430.486	1.373	50	20	IDGD	
CCN(C(=O)/C(C#N)=C\c1cn(CCC(N)=O)nc1-c1ccc(OC)cc1)[C@@H](C)CO	818635285	XQSPDLZNAFSNLV-ZCQLHAAUSA-N	425.489	1.570	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)CN1C(=O)N[C@@]2(C[C@H](C)CC(C)(C)C2)C1=O	863999669	XIFKZNGGOAIHOV-JLCFBVMHSA-N	446.504	1.358	50	20	IDGD	
Cc1cc([N+](=O)[O-])c(C)c(S(=O)(=O)Nc2ccccc2C(=O)N2CC[C@H](B(O)O)C2)c1	864234638	YELHTZMYXZQMGT-AWEZNQCLSA-N	447.278	1.701	50	20	IDGD	
CCOc1ccc(N2C(=O)/C(=C\NNC(=O)CN3CCCC3=O)c3ccccc3C2=O)cc1	912745458	FWYAKFFVAFHOTM-ZHZULCJRSA-N	448.479	1.856	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)N[C@@H](c1ccccc1OC)c1nccn1C	914598897	ZIRCLJOCIMYAJW-FQEVSTJZSA-N	439.472	1.936	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2ccccc2SCC(N)=O)c2ccccc2c1=O	915931164	IOKYLXNBOFVLDL-UHFFFAOYSA-N	440.485	1.460	50	20	IDGD	
CC(=NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1ccc([N+](=O)[O-])cc1	916258601	HDQBJSBYBFWGEO-UHFFFAOYSA-N	432.458	1.770	50	20	IDGD	
O=C(NCCNC(=O)c1ccccc1Cl)NNC(=O)c1nn(-c2ccccc2)cc1O	916263567	KNAXEYAUOCBVMB-UHFFFAOYSA-N	442.863	1.605	50	20	IDGD	
CCCS(=O)(=O)N1CCC(NC(=O)NNC(=O)CSc2ccc(Cl)cc2)CC1	916383363	FQHLIEHGACLQME-UHFFFAOYSA-N	448.998	1.967	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H](CN2CCCC2)c2ccccc2)c1	916469564	KPHFMTORLRLKDA-IBGZPJMESA-N	430.530	1.871	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)NCCNS(=O)(=O)Cc1ccccc1	916517528	XOAWTTBALROKNY-CQSZACIVSA-N	438.481	1.043	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NCCS(=O)(=O)NCc1ccccc1	916645308	PRHDRBOUJARPPK-CQSZACIVSA-N	438.481	1.043	50	20	IDGD	
CCOC(=O)c1c(S(=O)(=O)NNC(=O)c2cc3c(s2)CCCCC3)n[nH]c1C	917728038	KNQIXULYQQQROY-UHFFFAOYSA-N	426.520	1.849	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1	918219931	RHEOKRPYGWDFBQ-UHFFFAOYSA-N	429.496	1.997	50	20	IDGD	
CC(=O)N[C@@H](C)c1ccc(S(=O)(=O)NNC(=O)[C@H]2COc3ccccc3O2)s1	918399384	NCLYMILKPVVYKB-IINYFYTJSA-N	425.488	1.095	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)[C@H]1CCCCN1C(=O)C(C)C	919601826	WQHLUMMFTYUMMT-OAHLLOKOSA-N	439.896	1.690	50	20	IDGD	
CCOC(=O)C[C@@H](NC(=O)NNC(=O)c1csc(N2CCOCC2)n1)c1ccccc1	920837330	XOPKOVAVXPSWEG-OAHLLOKOSA-N	447.517	1.618	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)CCNC(=O)OCC(F)(F)F)CC1	1322957168	JEXRQCSZZDZIKB-UHFFFAOYSA-N	440.419	1.460	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)[C@H]2CCCN2C(=O)C(F)(F)F)CC1	1326759928	XMBAORXXAHURBN-GFCCVEGCSA-N	436.431	1.334	50	20	IDGD	
CC(=O)N[C@@H](Cc1c[nH]c2ccc(Br)cc12)C(=O)NNC(=S)NC(C)C	1329554746	GNSAAECVLKKILF-HNNXBMFYSA-N	440.367	1.881	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4c(c3)n(C)c(=O)n4C)C2)C1	1777867689	QXADGSXHICDMLI-BTYIYWSLSA-N	434.924	1.338	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H]1COc3ccccc3O1)C2)[C@@H](F)Cl	1778023179	XWFKRWLWPDJSHA-TVKQPGBESA-N	426.872	1.875	50	20	IDGD	
CC(=O)N/C(=C\c1ccco1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Cl)C1	1778028731	NSMCXEULUZPYTE-MSVJCGOZSA-N	441.887	1.805	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3cccn4ccnc34)C2)C1	1778577804	KJQJHVSOCQQHKN-KUHUBIRLSA-N	435.322	1.809	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3n[nH]c4c(F)cccc34)C2)C1	1778636755	FAAHTIORGHKSMP-ADLMAVQZSA-N	439.285	1.929	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3n[nH]c4cc(Cl)ccc34)C2)C1	1778666968	MNPQPFJLGVYACN-IFXJQAMLSA-N	441.315	1.914	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2)c1ccc2cccnc2n1	1778946405	VMUHKGRIXVKVTC-CBGDNZLLSA-N	432.908	1.357	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@](C)(Cl)CCl)C1	1780712214	XIKFXVCBQNQMIK-SVYNMNNPSA-N	436.380	1.603	50	20	IDGD	
Cc1nc(N)sc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Br)C1	1780771199	HAHMYKSXKAVSED-RSAASHCRSA-N	449.346	1.852	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)C[C@@H](N)c3cccnc3)CCO2)C1	1781227333	JGOOYJZAQNAKGG-AYOQOUSVSA-N	429.348	1.538	50	20	IDGD	
CCOc1cnc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](F)Br)C3)C2)cn1	1781326959	VOINPOWZZHONRN-BBRMVZONSA-N	431.262	1.009	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781330327	WITAKTNYZNIARV-MAUKXSAKSA-N	439.285	1.777	50	20	IDGD	
O=C(c1ccc2ccnn2c1)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781333424	OJEOZETXQBYMKD-RHSMWYFYSA-N	425.258	1.468	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](O)CCNC(=O)OC(C)(C)C)C2)C1	1781340928	UBBUHRDPTLELDJ-MDOVXXIYSA-N	447.960	1.109	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)Cc2cc[nH]n2)C1	1781568700	URRFYLBLYTWDCY-IIDMSEBBSA-N	427.343	1.640	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)COCCOC)C2	1781899967	INDXNGOTDDVUDJ-HDMKZQKVSA-N	435.359	1.337	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(Cl)nn1)C2	1782176252	YSWCKRKSIKIDKD-RVZJWNSFSA-N	431.320	1.511	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C=C/c1ccccc1)C2	1782210889	WPWFRXLCMLNATE-OLUFXSETSA-N	442.560	1.587	50	20	IDGD	
O=C([C@H](F)Br)N1CCO[C@]2(CCN(C(=O)C(Cl)(Cl)Cl)C2)C1	1783266306	XNEOKGGOWLDZEF-OIBJUYFYSA-N	426.497	1.877	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)CCCn3ccnc3)CCO2)C1	1783351866	BYNTUVNPPGIKBV-YJBOKZPZSA-N	427.343	1.667	50	20	IDGD	
Cc1c(C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](C)Br)C3)C2)nc2ccccn12	1783535061	XCKVUFUOHSSENN-DJJJIMSYSA-N	435.322	1.870	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](C)Br)C3)C2)c(O)c1	1783535761	CKDBBHVILAYIID-SGTLLEGYSA-N	427.295	1.628	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cnn4cccc(F)c34)CCO2)C1	1783537961	VBXLWFIHECOWSQ-KPZWWZAWSA-N	439.285	1.700	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)COCc3ccc(C)c(C)c3)CCO2)C1	1783874547	DRBOULNKYWRUEV-SIKLNZKXSA-N	438.952	1.904	50	20	IDGD	
COCc1c[nH]c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]3C2)c1	1783969836	LLPHABAHMCPAHX-QEWYBTABSA-N	442.354	1.785	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(CCN(C(=O)[C@H]3CCOC3)C2)C1	1784722129	IQQLGBOXXMFYAW-BTYIYWSLSA-N	447.444	1.000	50	20	IDGD	
CC(C)N1CCC[C@H]1C(=O)N1CC[C@]2(CN(C(=O)[C@H](C)CBr)CCO2)C1	1784801843	ZKUHKKASGDBEIX-JTDSTZFVSA-N	430.387	1.720	50	20	IDGD	
Cn1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCBr)[C@H]3C2)c2cccnc21	1786406762	BOCRAUVQBOTWPP-QRTARXTBSA-N	449.349	1.952	50	20	IDGD	
CN1CCC[C@@H](C(=O)NC2(c3ccc(NC(=O)c4cccc(B(O)O)c4)cc3)CCC2)C1	1788150464	LFXDWSUDSJIHJY-GOSISDBHSA-N	435.333	1.456	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccn4ccnc4c3)C[C@@H]21)[C@@H](F)Br	1789925682	HHZZKFIIPWTCQF-RZLSGREXSA-N	439.285	1.618	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccnc(F)c3)C[C@@H]21	1790957872	BCCGSKWEWVZWMH-AJNGGQMLSA-N	428.302	1.988	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(C)nn3CC)C[C@@H]21	1790961023	FBWPICYZRIAQNX-JKQORVJESA-N	441.370	1.978	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(O)nc3)C[C@@H]21	1790962974	HMHFDSZZBHJCRS-XQLPTFJDSA-N	426.311	1.554	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN3CCCCC3=O)[C@H]2C1	1791183017	CFLLGZQYWFYGAF-JONQDZQNSA-N	444.370	1.152	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnn(C(C)(C)C)c1)C2	1792869966	FIOCXSCLFHAYRT-DMRZNYOFSA-N	441.370	1.872	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)c1ccc2occc2c1O	1796192966	FSEORLNHKURLEN-BJWYYQGGSA-N	434.257	1.384	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1nc2ccccc2n(C)c1=O	1796998404	VTDULRKUSAUXHX-LOUJCGABSA-N	432.908	1.154	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnc2[nH]ncc2c1	1797346140	DNFSCHOPPWJJQH-KYZVSKTDSA-N	426.304	1.397	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccn2ccnc12	1797454271	PTXAMJKDJYMQRC-AYDFFVQHSA-N	435.322	1.569	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cn1c(=O)n(C)c2ccccc21	1797750405	VBFGIUXZFMVKPO-APIJFGDWSA-N	449.349	1.762	50	20	IDGD	
CCOC(=O)c1cccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Cl)C3)c1F	1798533447	YEDOPGCNHFPSTK-OXUXUCFPSA-N	430.835	1.740	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnn3ccncc13)C2	1800640620	CDEVQVNNMBBLJF-FAXLKDOZSA-N	436.310	1.106	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@](C)(Cl)CCl)C2	1800673667	ICZZAVFWBHHYAX-AZGFTEDZSA-N	438.352	1.337	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2)[C@@H]1C[C@@]12C(=O)Nc1ccccc12	1800765553	YXDRKXWUBLSJBA-AYFJUFKTSA-N	438.311	1.290	50	20	IDGD	
O=C1C[C@H](C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](Br)Cc2ccccc2)CN1	1801570782	WENVNWSITNWPHR-IECFSIQFSA-N	448.361	1.767	50	20	IDGD	
CC[C@@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](COC(C)=O)OC(C)=O)C2	1801801301	CZERGPPLGHBPBX-YIDVYQOGSA-N	447.326	1.293	50	20	IDGD	
C[C@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H]1CC[C@@H]3CCC(=O)N3C1)C2	1801968468	WHBBVEZCQFGXNI-AYYATWNNSA-N	426.355	1.809	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H]1CCN1C(=O)OC(C)(C)C)C2	1802269168	DYJPBPAKDWGVTB-YIDVYQOGSA-N	429.945	1.888	50	20	IDGD	
Cn1nncc1C(=O)NC[C@@H]1CCN(C(=O)[C@](C)(Cl)CCl)[C@@H]1c1cccnc1	1804750642	XSJUWDSYQRHJLT-JCKWVBRZSA-N	425.320	1.766	50	20	IDGD	
Cn1c(C(=O)NC[C@@H]2CCN(C(=O)CCBr)[C@@H]2c2cccnc2)cccc1=O	1805311259	VEDCOGIYFOXSIW-HNAYVOBHSA-N	447.333	1.885	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)CC(F)(F)F)[C@H]1c1cccnc1)c1cccc(B(O)O)c1	1807370339	ARRJKYITRAVDSI-QAPCUYQASA-N	435.211	1.033	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)CCc2ccoc2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1	1807374157	IWNKWRDAJGMZCT-OFNKIYASSA-N	447.300	1.307	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)C(Cl)Cl)[C@H]1c1cccnc1)c1cccn2c(O)nnc12	1808193842	GKAQVYQFPOVLFG-JSGCOSHPSA-N	449.298	1.953	50	20	IDGD	
Cc1ccccc1NCC(=O)N1CCCC2(CCN(C(=O)c3cccc(B(O)O)c3)CC2)C1	1809913559	KUCKIPCKANRUTM-UHFFFAOYSA-N	449.360	1.632	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)c1ccn(C(F)F)n1	1810904745	FXFLSYPWKLHQMQ-QEJZJMRPSA-N	427.839	1.593	50	20	IDGD	
C[C@H](CBr)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H]2CCC(=O)N2)[nH]n1	1814780334	MBAAHPSAFUUWCZ-WZRBSPASSA-N	426.315	1.711	50	20	IDGD	
CC(=O)N/C(=C\c1ccco1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](O)CCl)n[nH]1	1814873141	STLNZETUCPRWQI-CBNFBOEASA-N	449.895	1.772	50	20	IDGD	
Cc1cccc(CC(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)n1	1814969241	OUBQMJDQZGQIMH-FQEVSTJZSA-N	447.304	1.342	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccnc2)[nH]n1	1819402039	JYXJXTCUMUATDT-KRWDZBQOSA-N	434.460	1.423	50	20	IDGD	
C#CCCCC(=O)N[C@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1	1819799479	CVHQSPCETHIKMK-LBPRGKRZSA-N	426.502	1.171	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CN2CCOCC2)[nH]n1	1822088477	WRCDNTLFJMUUFF-DZGCQCFKSA-N	442.358	1.908	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2nc[nH]c2[N+](=O)[O-])[nH]n1	1822367843	BIKIWNPWKFDOFY-KOLCDFICSA-N	425.833	1.601	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CC[C@H](N)C(N)=O)CC1	1824094394	VOLYHPWOCYWJFJ-KBMXLJTQSA-N	445.402	1.230	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cn3cccnc3n1)CC2	1825999648	BHXNEAGPKNACPP-QWRGUYRKSA-N	434.909	1.665	50	20	IDGD	
CS(=O)(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)CCBr)CC1	1826360132	FUACTAQJFOXVGW-OAHLLOKOSA-N	437.400	1.826	50	20	IDGD	
CCOCC(=O)N1CCC([C@H]2CCCCN2C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)CC1	1827681407	UYXJORGKTVWGQK-GXDFBKAQSA-N	431.537	1.777	50	20	IDGD	
C#CC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](Cl)COC)CCN2C(=O)OCc1ccccc1	1829341108	XADVSUTXZKKWPM-GCJKJVERSA-N	447.919	1.326	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(Cl)cnc3O)C2)C1	1830352331	LBRFXOPEGZHZMQ-IBGZPJMESA-N	446.331	1.776	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc([N+](=O)[O-])o3)C2)C1	1830352908	UNEXMVGAVHJUJQ-GOSISDBHSA-N	429.857	1.523	50	20	IDGD	
O=C(Cc1ccc(F)cc1Cl)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1830726665	SOAGHUKZXKUCEJ-APWZRJJASA-N	449.306	1.078	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnn4ccncc34)C2)C1	1831645516	BTNIPLWSAZIZME-OXJNMPFZSA-N	435.912	1.207	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)CC(F)(F)C(=O)O)CC1	1831870636	BJWXNDZWIMSMMA-HNNXBMFYSA-N	446.495	1.089	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)C[C@H]3CCCCO3)CCO2)C1	1832350415	HJONAKIBMVRBQF-HDMKZQKVSA-N	433.343	1.185	50	20	IDGD	
O=C(/C=C/c1ccoc1)N1CCO[C@]2(COCCN(C(=O)CCBr)C2)C1	1832646029	XZDRAIDRWCRHCN-KROLTMCQSA-N	427.295	1.534	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3ccc(F)c(C)n3)CC2)CC1	1833962558	FWSRAPNQIVAEHX-KRWDZBQOSA-N	440.947	1.968	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccnc(Cl)c3)CCO2)C1	1834185433	IADKWNJZYCBMMM-KDOFPFPSSA-N	432.304	1.059	50	20	IDGD	
Cc1cc(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](F)Br)CC3)CC2)on1	1834209155	RGRIHZKMYROJPA-OAHLLOKOSA-N	431.306	1.859	50	20	IDGD	
Cc1cnc(C(=O)N2CCC(N3CCC(NC(=O)CCBr)CC3)CC2)cn1	1834421162	MEQZSLPCWXFYMG-UHFFFAOYSA-N	438.370	1.755	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(F)cn3)CCO2)C1	1834481398	OCMNZKDWLFTJRU-QZTJIDSGSA-N	434.295	1.527	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CCC(F)(F)C3)C2)C1	1834818979	CAOZOZARENLRTK-CZUORRHYSA-N	439.297	1.663	50	20	IDGD	
Cc1ncccc1C(=O)N1CCOC[C@]2(CN(C(=O)CCBr)CCO2)C1	1834819523	UEGIJHJKKNFMGP-SFHVURJKSA-N	426.311	1.245	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)C3CC(F)(F)C3)C2)C1	1834820206	PQQTXMFYJZVNMJ-HNNXBMFYSA-N	425.270	1.273	50	20	IDGD	
C=CC[C@H](C(=C)C)C(=O)N1CCOC[C@@]2(CN(C(=O)CCBr)CCO2)C1	1834823424	UDVJQBXJPTZCLP-VQIMIIECSA-N	429.355	1.996	50	20	IDGD	
C[C@@H](Nc1ccccn1)C(=O)NC1CCN(C2CCN(C(=O)[C@H](F)Cl)CC2)CC1	1835847114	KNCVHZNJBMMLEJ-KDOFPFPSSA-N	425.936	1.988	50	20	IDGD	
Cc1cc(C(=O)NC2CCN(C3CCN(C(=O)[C@H](C)CBr)CC3)CC2)n[nH]1	1836145989	XCEUELZNHRDXIH-CYBMUJFWSA-N	440.386	1.934	50	20	IDGD	
O=C(c1ccn2ccnc2c1)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836717532	XSFURCHYQSURMT-SFHVURJKSA-N	434.924	1.546	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc4cccnn4n3)CCO2)C1	1838423222	JPVVDNUWYSINMS-JXFKEZNVSA-N	435.912	1.207	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1nc3ccccc3o1)CCO2	1839502224	JEPWPTZXURJKOP-OAQYLSRUSA-N	447.564	1.749	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3[C@H]4SC=C[C@H]43)C2)C1	1839966684	MISKWBCQELRTKT-PYOGLGTISA-N	445.379	1.491	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)c1	1840190150	HMQIGLXELGHMKR-LJQANCHMSA-N	444.315	1.519	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(F)c(OC)c3)CCO2)C1	1840682807	HHYKOLJMZCYNKS-MGPUTAFESA-N	428.888	1.922	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)[C@@H]2CNc3ccccc32)C1	1842933959	LBHRBEPIDBXDGN-CIRUFVMISA-N	434.500	1.533	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1cc(F)c(F)cc1F)C2	1844264809	KBILRDFIWOBGES-UHFFFAOYSA-N	433.390	1.233	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)c2ccncc2-c2ccccc2)C1	1844587431	FAYLOFOCSVYGHI-UHFFFAOYSA-N	441.296	1.559	50	20	IDGD	
Cc1ccoc1C(=O)N1CC2(CCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)C1	1845038676	HLYIDGBUPRNKFH-UHFFFAOYSA-N	439.516	1.751	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCCC12CN(C(=O)c1cnc3c(c1)CCNCC3)C2	1845172642	WJOWAADCYDHAGD-LJQANCHMSA-N	425.360	1.823	50	20	IDGD	
COC(=O)CSCC(=O)N1CC2(CCCN2C(=O)/C(C#N)=C/c2ccc(F)cc2F)C1	1845870498	RXCIETNTYJPASV-VIZOYTHASA-N	449.479	1.981	50	20	IDGD	
COc1ccc(Cl)cc1CC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1	26772642	YRMPDTGFJVQZAW-UHFFFAOYSA-N	439.921	1.668	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)on1)c1ccc(S(=O)(=O)NC2CC2)cc1	28792198	XXLXGHXAYNQLEG-UHFFFAOYSA-N	426.454	1.857	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Cc2ccccc2OC(C)C)cc1	116344127	LLWHKOMOEGVCJM-UHFFFAOYSA-N	433.530	1.793	50	20	IDGD	
O=C(NCCNS(=O)(=O)c1ccccc1)NNC(=O)c1c(Cl)cccc1Cl	727845964	CMVFTOLXIRREDZ-UHFFFAOYSA-N	431.301	1.916	50	20	IDGD	
O=C(CCn1nnc2ccccc2c1=O)NNC(=O)c1cc(F)ccc1Br	728548879	UDBCRDCFDUYNOZ-UHFFFAOYSA-N	434.225	1.544	50	20	IDGD	
CCCS(=O)(=O)c1ccccc1C(=O)OCC(=O)NNC(=O)Cc1nc(C)cs1	728722223	NKXGRULVAYRZPQ-UHFFFAOYSA-N	439.515	1.182	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2c(Br)ccc(F)c2N)n1	728730319	MAQLZDQMFGAKFE-UHFFFAOYSA-N	445.270	1.482	50	20	IDGD	
CC(C)[C@@H]1CCC[C@H](NC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)C1	729058856	QZAGGBQETVURGS-SJORKVTESA-N	438.598	1.859	50	20	IDGD	
CN(C)c1ccc(NC(=S)NNC(=O)c2ccc(N3CCCS3(=O)=O)cc2)cc1	729691420	WFRQUFYNXDNNKR-UHFFFAOYSA-N	433.559	1.924	50	20	IDGD	
O=C(COC(=O)[C@@H]1CSCN1C(=O)c1ccc(Cl)cc1)NNC(=O)c1ccccc1	730332238	GRRJBDQWAXDQJA-INIZCTEOSA-N	447.900	1.860	50	20	IDGD	
CCN1CCN(C(=O)CC2CCN(CC(=O)NNC(=O)c3ccccc3Cl)CC2)CC1	731214966	YWXWGBNTAWVFIU-UHFFFAOYSA-N	449.983	1.367	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)NCc1cccc(C(=O)NC[C@H]2CCCO2)c1	731403150	DGYMLCCPSAUZKM-GOSISDBHSA-N	428.464	1.808	50	20	IDGD	
COc1ccccc1C(=O)NNS(=O)(=O)c1cc(Br)cc([N+](=O)[O-])c1	731494261	WBIGOVCOZUOZHA-UHFFFAOYSA-N	430.236	1.989	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2nn(-c3ccccc3F)c3c2CCC3)C[C@@H](C)O1	732261634	OCEKQTGGHXLUCR-GASCZTMLSA-N	429.496	1.760	50	20	IDGD	
CCc1cc(N2CCC[C@@H](NC(=O)NNC(=O)[C@H](C)Oc3ccccc3F)C2)ncn1	732914589	UIXMOBPXKORZFD-GOEBONIOSA-N	430.484	1.945	50	20	IDGD	
CN1CCN(c2cc(CNC(=O)NNC(=O)c3cnn(-c4ccccc4)c3)ccn2)CC1	733339920	SUGVWRCXTKUZLA-UHFFFAOYSA-N	434.504	1.163	50	20	IDGD	
COc1ccc(CN2CC[C@H](NC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)C2=O)cc1	734685713	VVSRORJWPYDUDT-KRWDZBQOSA-N	427.417	1.349	50	20	IDGD	
CCOC(=O)C(=O)N1CCN(C(=O)/C(C#N)=C/c2cc(C)n([C@@H](C)COC)c2C)CC1	736130210	DBGGIPIDYYMKJK-QUYZQLMHSA-N	430.505	1.453	50	20	IDGD	
CN(C)N(C(=O)Cc1ccc(S(=O)(=O)CC(F)(F)F)cc1)[C@@H]1CCS(=O)(=O)C1	736458040	CUWHLPFONMBUSO-CYBMUJFWSA-N	442.481	1.057	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)c2ccc(N3CCCS3(=O)=O)cc2C)c1	741516085	QLAVJTSXXHPHNO-UHFFFAOYSA-N	433.486	1.627	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNS(=O)(=O)c2ccc(C(=O)OC)c(C)c2)cc1	741646127	GCETXAMMKJKIEQ-AWEZNQCLSA-N	436.486	1.957	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)[C@H](CC)N2CCCC2=O)c2ccccc2c1=O	741746058	KAJNAVMOHBCXRP-KRWDZBQOSA-N	427.505	1.749	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)[C@H](C)NC(=O)c2cc3c(C)nn(C)c3s2)cc1	742034240	GLXSKNKTBCMYEI-ZDUSSCGKSA-N	429.502	1.596	50	20	IDGD	
CC(C)c1nn([C@@H]2CCS(=O)(=O)C2)cc1C(=O)NNC(=O)c1cccc(N(C)C)c1	742487284	NYIYKNDIKUUBLT-MRXNPFEDSA-N	433.534	1.507	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNS(=O)(=O)c1cc2oc(=O)[nH]c2cc1Cl	743249971	SQNYXCJPAARBJV-UHFFFAOYSA-N	441.849	1.562	50	20	IDGD	
CC(C)NC(=O)C(=O)NNC(=O)C[C@H](NC(N)=O)c1cccc(Oc2ccccc2)c1	744446954	QFUMPEAUZAYCLG-KRWDZBQOSA-N	427.461	1.250	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)CN2C(=O)COc3ccc(Cl)cc32)c1	744541875	KIKNXIQUGGTUFP-UHFFFAOYSA-N	431.832	1.378	50	20	IDGD	
C[C@@H](Oc1ccc(C#N)cc1)C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	744622141	OBWRZJBJPIVVMQ-OAHLLOKOSA-N	430.486	1.490	50	20	IDGD	
CCOC(=O)N1CCN(C(=O)[C@@H](C)OC(=O)/C(C#N)=C\c2cc(C#N)n(C)c2C)CC1	744631388	DOLWOFOWPSVXCM-DISPHTKASA-N	427.461	1.345	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)N[C@@H]1C[C@H](C)N(c2ccccc2)C1=O	745881402	IVQOMPHAHGMRKJ-DOTOQJQBSA-N	426.473	1.989	50	20	IDGD	
NC(=O)COc1cccc(CNC(=O)NNC(=O)c2ccc(COc3ccccc3)o2)c1	745899353	LJOYNBMDJRJPFP-UHFFFAOYSA-N	438.440	1.867	50	20	IDGD	
CC(C)c1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)N3CCOCC3)CC2)cc1	745991745	GHDKHTBMUVKKJY-UHFFFAOYSA-N	438.550	1.284	50	20	IDGD	
CCN(CC)CCSCC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	746093303	PAANWAYSHAGHRD-UHFFFAOYSA-N	442.607	1.307	50	20	IDGD	
C[C@@H](CCNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)N(C)Cc1ccccc1	746774229	NFMYSEJZAQPROU-SFHVURJKSA-N	439.564	1.934	50	20	IDGD	
Cc1nc(C(=O)NNC(=O)c2cccc(OC(F)F)c2)nn1-c1n[nH]c(C(F)(F)F)n1	747380808	AAURUTPWZKKQPA-UHFFFAOYSA-N	446.296	1.389	50	20	IDGD	
O=C(CN1C(=O)c2ccccc2C1=O)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1	748512001	NBJFVMYEIAIEII-UHFFFAOYSA-N	427.360	1.719	50	20	IDGD	
CO[C@@](C)(C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1)c1ccccc1	748620632	SHUWWXYCQLUQTE-OAQYLSRUSA-N	432.546	1.628	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)Cc3noc4ccccc34)cc2)CC1	748623260	JHTIYZJBMYDLIH-UHFFFAOYSA-N	429.502	1.450	50	20	IDGD	
COCCN1C(=O)c2ccc(C(=O)NNc3cccc([N+](=O)[O-])c3C)cc2S1(=O)=O	748684544	DJABWLHDDCEZOQ-UHFFFAOYSA-N	434.430	1.451	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H]2CCC[C@@H](N(C)C)C2)c1	749589839	JGYOTPCNNHPDQA-IAGOWNOFSA-N	439.582	1.534	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)N[C@@H]2CC(=O)N(C(C)C)C2)c2ccccc2c1=O	750643238	HFCXRECZJIHPLA-CQSZACIVSA-N	428.493	1.150	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N[C@@H]2CCN(Cc3ccc(C#N)cc3)C2=O)cc1OC	753025753	OXGWBUPUDRWYJR-QGZVFWFLSA-N	437.456	1.321	50	20	IDGD	
C[C@H]1C[C@H](C)CN(S(=O)(=O)c2ccc(NC(=O)NNC(=O)c3cnn(C)c3)cc2)C1	755419293	BTPQOGAAYDKISC-KBPBESRZSA-N	434.522	1.553	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)Nc1ncc(Cc2cc(F)cc(F)c2)s1	755480222	UDPPVOJOCPKKOK-SNVBAGLBSA-N	430.458	1.600	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)Nc2cc(C)nn2[C@H]2CCS(=O)(=O)C2)c1	755537547	WEXXLTSBBBGYQQ-ZDUSSCGKSA-N	437.478	1.035	50	20	IDGD	
CNC(=O)c1ccc(OC)c(NC(=O)NNC(=O)c2cc(Br)ccc2O)c1	755918574	GXYHXAWJKPMCKI-UHFFFAOYSA-N	437.250	1.989	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2nc(C(C)(C)C)ns2)c1	756356393	BFWKGLXDRZMEFY-UHFFFAOYSA-N	426.524	1.552	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)C(F)(F)c2nccs2)c1	756420164	OWBUUAPXMKRKMJ-UHFFFAOYSA-N	432.474	1.727	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1cc(NC(=O)OC(C)(C)C)ccc1F	756621902	UPLGKIDGMVDGJW-SECBINFHSA-N	433.462	1.263	50	20	IDGD	
CS(=O)(=O)CCn1ccc(NC(=O)NNC(=O)c2ccc(COc3ccccc3)o2)n1	756759201	IWWKGTXWHQFRAT-UHFFFAOYSA-N	447.473	1.566	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)Nc2cc(C3CC3)nn2[C@H]2CCS(=O)(=O)C2)c1O	756855023	JVBNJYAAHHSSJP-LBPRGKRZSA-N	449.489	1.301	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(n2cccc2C(=O)NNc2ccc(C(N)=O)nn2)CC1	757404242	NKGKSFQVWRCTRS-UHFFFAOYSA-N	429.481	1.706	50	20	IDGD	
COc1cccc(CCC(=O)N2CCN(S(=O)(=O)CBr)CC2)c1OC	758528660	XAZKSBLFPDEQRB-UHFFFAOYSA-N	435.340	1.463	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)[C@@H]1CCCN(c2ncnc3sccc23)C1	760443372	XRNUQHDKQNRMDJ-CYBMUJFWSA-N	448.549	1.970	50	20	IDGD	
COC[C@@H](C)n1c(C)cc(/C=C(/C#N)C(=O)NCCNS(=O)(=O)NC(C)C)c1C	760639136	DFGFBYPDUOVZAX-YQYFLZKSSA-N	425.555	1.168	50	20	IDGD	
CC(C)n1cccc1C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	763284669	PZKSHYVVMNBISW-UHFFFAOYSA-N	448.545	1.484	50	20	IDGD	
CN(C)C(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)ccc1Cl	763442832	DIDSAFFAPARRFH-UHFFFAOYSA-N	433.808	1.350	50	20	IDGD	
O=C(NNC(=O)c1ccccn1)C(=O)Nc1ccc(=O)n(Cc2ccccc2Cl)c1	763464565	UYEQLMLCUJLYHN-UHFFFAOYSA-N	425.832	1.345	50	20	IDGD	
O=C(NNC(=O)c1ccncc1)C(=O)Nc1ccc(C(=O)NCCc2ccccc2)cc1	763465142	TXWXHUIZFNJUHM-UHFFFAOYSA-N	431.452	1.454	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cccnc2)n([C@@H]2CCN(Cc3ccccc3)C2)n1	763491517	LNKBAVWFLFBUHX-LJQANCHMSA-N	447.499	1.433	50	20	IDGD	
CCOC(=O)c1cc(Br)ccc1NC(=O)C(=O)NNC(=O)c1cccnc1	763491772	NPPZGVFBBVZABS-UHFFFAOYSA-N	435.234	1.421	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(NC(C)=O)c(F)cc2F)cc1OC	763543872	SNJHGRXIPNEGRZ-UHFFFAOYSA-N	436.371	1.340	50	20	IDGD	
CCOC(=O)Cn1ccc2cc(NC(=O)C(=O)NNC(=O)c3ccccc3F)ccc21	763562070	TXVOXSLLRQRXDV-UHFFFAOYSA-N	426.404	1.743	50	20	IDGD	
CCOC(=O)/C=C\c1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)cc1	763680709	GIQZZKMVEPPIIG-GHXNOFRVSA-N	436.424	1.299	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)C(=O)Nc2ccnn2C(C)C)c2ccccc2c1=O	763802764	AEWYBCSQFFTJNS-UHFFFAOYSA-N	439.476	1.374	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)COc1ccc(Br)cc1Cl	763823332	GKCTVKGCXVTTJK-UHFFFAOYSA-N	441.669	1.454	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccnn1-c1ccc(Cl)cc1	763839012	DINQKRQKEFWMTI-UHFFFAOYSA-N	431.811	1.830	50	20	IDGD	
O=C(CCSc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccccc1Cn1cncn1	763894889	FHMQCSUBSYXZFW-UHFFFAOYSA-N	442.476	1.734	50	20	IDGD	
CCOC(=O)c1ccc(NC(=O)C(=O)NNC(=O)C2=S=C3CCCCCC3=C2)cc1	763961320	DTMZINWBGGWYLS-UHFFFAOYSA-N	429.498	1.931	50	20	IDGD	
CCCS(=O)(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2ccccc2C)c1C	763962108	LGVPPBAKQQAYJT-UHFFFAOYSA-N	432.502	1.855	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2OC)cc1F	764012885	UGRMAQSSOSXEPS-UHFFFAOYSA-N	439.827	1.913	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3c2)cc1C(=O)OC	764061319	CCBGDPMUDTYCSP-UHFFFAOYSA-N	449.419	1.813	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)CC(C)(C)C)ccc1S(=O)(=O)N1CCCC1	764200053	XFSYSEBUZWWCOR-UHFFFAOYSA-N	440.522	1.002	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)cc1C(=O)N(C)C	764204540	YBHBILGFGGQFQW-UHFFFAOYSA-N	449.508	1.088	50	20	IDGD	
Cc1ccc(N2CCOC2=O)cc1NC(=O)C(=O)NNC(=O)c1cccc(OC(F)F)c1	764253300	PARRSEVBBFJOQO-UHFFFAOYSA-N	448.382	1.953	50	20	IDGD	
COc1cc(C#N)ccc1Oc1ccc(NC(=O)C(=O)NNC(=O)Cc2cc[nH]n2)cc1	764285768	LIAQVKMNSXIYPV-UHFFFAOYSA-N	434.412	1.411	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)C(=O)Nc1ccc(-n2cccn2)c(Cl)c1	764288494	IBKPDVCMIZDONO-UHFFFAOYSA-N	427.848	1.950	50	20	IDGD	
CCc1cc(O)nc(-c2cccc(NC(=O)C(=O)NNC(=O)COCc3ccccc3)c2)n1	764365852	FNZDFXWJQXZTDL-UHFFFAOYSA-N	449.467	1.714	50	20	IDGD	
CC(=NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1)c1csc(C)n1	764819317	QRHPYGXKHRRJHG-UHFFFAOYSA-N	435.575	1.607	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)CN2C(=O)[C@@H]3CCCC[C@H]3C2=O)n[nH]1	765603735	SQNMSKSCFQVLPP-CHWSQXEVSA-N	425.445	1.022	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1)c1cccc(S(=O)(=O)NC2CC2)c1	765617911	GWLGLSQNKMAXSK-UHFFFAOYSA-N	443.460	1.731	50	20	IDGD	
O=C(CCc1ccc(Cl)s1)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765738713	NHOZSRLVPWVNMQ-UHFFFAOYSA-N	434.949	1.940	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNc3cnc4ccccc4n3)CC2)cc1	765992508	GPBHMBQNXOURKE-UHFFFAOYSA-N	440.529	1.388	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1cc(C)nn1-c1cccc(Br)c1	766264537	LKEVGACOIWUURZ-UHFFFAOYSA-N	446.265	1.824	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)CN1CCCN(C(=O)CCc2ccccc2)CC1	766917147	DJAWYHOFZWZEOS-UHFFFAOYSA-N	436.556	1.852	50	20	IDGD	
CCn1c(S)nc2cc(C(=O)NNc3c(OC)cccc3S(C)(=O)=O)ccc2c1=O	768639421	QFXKBEJYVJCSJZ-UHFFFAOYSA-N	448.526	1.874	50	20	IDGD	
CC(=O)N1CCc2c(NC(=O)C(=O)NNC(=O)c3cnn(-c4ccccc4)c3)cccc21	769267410	RMPFASPSSOFSKS-UHFFFAOYSA-N	432.440	1.181	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)N[C@@H]3CCN(C4CCCCC4)C3=O)nc21	770413698	WBYHNGAUJGGECL-CQSZACIVSA-N	430.513	1.847	50	20	IDGD	
C[C@@H](C(=O)NNc1nc(O)c2cnn(C(C)(C)C)c2n1)N1C(=O)[C@H]2CCCC[C@H]2C1=O	770958041	GWCIWSCMGRKBHC-SDDRHHMPSA-N	429.481	1.294	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)[C@@H](c3cccc(F)c3)N3CCOCC3)nc21	770966695	NVMLNZKAPNEPLO-MRXNPFEDSA-N	443.483	1.943	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)CN1C(=O)NC2(CCC(C(C)(C)CC)CC2)C1=O	771855799	NSKYLTHXAVWEAO-QQKMHPFRSA-N	438.525	1.393	50	20	IDGD	
COc1ccccc1N1C[C@@H](C(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)CC1=O	772193308	ULEIDUDMKXDTHT-AWEZNQCLSA-N	444.875	1.165	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCCNC(=O)NNC(=O)c2ccc3ccccc3n2)s1	772631214	SDBLYAVQCXASMR-UHFFFAOYSA-N	433.515	1.527	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)c1cc(Br)cc(Br)c1	773208714	NVBIRYOGCDDYHT-ZETCQYMHSA-N	440.113	1.407	50	20	IDGD	
Cc1c(C(=O)NNC(=O)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)cnn1-c1ccccn1	773420954	PWNXPARPVRLULN-OAHLLOKOSA-N	428.493	1.984	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)ncc1Br	773524377	IDINSOJJLASSLY-UHFFFAOYSA-N	432.234	1.189	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)N[C@@H]1CCc2cc(O)ccc2C1	775091117	XEHBSSAZCDWKTM-HXUWFJFHSA-N	437.544	1.792	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](OCC(=O)NNc2cccc(S(C)(=O)=O)c2)C1	776538843	KURGDLBLPQTUOM-OAHLLOKOSA-N	427.523	1.949	50	20	IDGD	
O=C(NNC(=O)N1CC[C@H](n2cncn2)C1)[C@@H]1Cc2ccccc2CN1Cc1ccccc1	776868442	ZGHDKCRTHUTMEB-VXKWHMMOSA-N	445.527	1.893	50	20	IDGD	
COCCO[C@H]1COCC[C@H]1NC(=O)NNC(=O)c1ccc(OC)c(Br)c1	776876170	AQCMATHRQYQAEV-HIFRSBDPSA-N	446.298	1.222	50	20	IDGD	
Cc1cc2ccccc2nc1NNC(=O)Cn1c(=O)oc2cc(S(N)(=O)=O)ccc21	777481673	FOBCQWWLVAFCLT-UHFFFAOYSA-N	427.442	1.242	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)NC[C@H]2COC3(CCOCC3)O2)N(C)c2ccccc21	777505452	KICQHRNGPBKWQW-INIZCTEOSA-N	440.500	1.695	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)CO[C@H]1CCCN(C(=O)OC(C)(C)C)C1	778433831	SYBGCINWFJDDIX-ZDUSSCGKSA-N	430.502	1.075	50	20	IDGD	
Cc1ccc2[nH]c3c(c2c1)C[C@H](NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)CC3	778590028	WTSNOXPMMSLPGN-OAHLLOKOSA-N	430.472	1.954	50	20	IDGD	
COc1cccc2[nH]cc(CC(=O)OCC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)c12	778866900	VUTQVMWXHFHFCC-UHFFFAOYSA-N	426.385	1.632	50	20	IDGD	
C[C@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1NC(=O)NNC(=O)c1nnc(O)c2ccccc12	779715459	ZJVBIAHVHVWPJI-WFASDCNBSA-N	444.492	1.925	50	20	IDGD	
Cn1cc(-c2n[nH]cc2C(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)cn1	780726325	JGXKQIZVPMYBFJ-UHFFFAOYSA-N	432.485	1.154	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N2CC[C@H]([C@@H](C)O)C2)cc1	781044165	VJFNPMFHFBRZKX-PCRVIDNCSA-N	437.500	1.570	50	20	IDGD	
Cc1ccnc(OC2CCN(C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)CC2)c1	782509949	PRNOXVGYOMWUJB-UHFFFAOYSA-N	439.520	1.681	50	20	IDGD	
CCOC(=O)/C=C/c1ccc(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)cc1	782893476	IZWWXVIKSLFMQM-JLHYYAGUSA-N	449.467	1.478	50	20	IDGD	
CCC(=O)Nc1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)cc1	783263709	KFVGJWUAKSFRNI-UHFFFAOYSA-N	448.505	1.199	50	20	IDGD	
O=C(NNC(=O)C(=O)N1CCCC1)C(=O)Nc1cc(Cl)ccc1Oc1ccccc1	784003470	XKCTZBDIAGBVQU-UHFFFAOYSA-N	430.848	1.841	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1cc(F)ccc1OC(F)F	784004648	IMFKVLHFXOLNRF-UHFFFAOYSA-N	430.364	1.005	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)[C@@H]2CC=CC[C@@H]2C(=O)N2CCOCC2)cc1OC	784296199	LJPDMTXQCGYCDM-MSOLQXFVSA-N	445.516	1.686	50	20	IDGD	
CN1CCCCC/C1=N/S(=O)(=O)c1cccc(NC(=O)C(=O)NNc2ccccn2)c1	784796984	XGELWWDYWNLMGL-BWAHOGKJSA-N	444.517	1.756	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)C(=O)Nc2ccc(CN3CCOC3=O)cc2)c1	784841788	RCJWBXPCYHKULK-UHFFFAOYSA-N	432.458	1.124	50	20	IDGD	
COc1cccc(NNC(=O)C(=O)Nc2ccc(C(=O)N3C[C@H](C)O[C@H](C)C3)cc2)n1	784844466	ZDLMEABVVAJGAU-OKILXGFUSA-N	427.461	1.421	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)C(=O)Nc1cccc(C(=O)c2ccccc2)c1	785060822	OCCCJMNAEYIPPG-UHFFFAOYSA-N	441.447	1.894	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc4c(c3)C(=O)NCC4)n[nH]2)c1	785125651	FINBLTFLJLPZRQ-UHFFFAOYSA-N	446.467	1.379	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](CC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)C1CC1	785227039	JKZWDTAASKBVEM-OAHLLOKOSA-N	425.507	1.545	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)[C@@H]2[C@H](C(F)(F)F)[C@H]3CC[C@H]2O3)c2ccccc2c1=O	785442931	GPVUEYXBZWUFMO-APIJFGDWSA-N	438.406	1.923	50	20	IDGD	
Cc1ccc(N2CCNC2=O)cc1NC(=O)C(=O)NNC(=O)c1cccc2ncccc12	787543038	UBPTVZPNEXXLCK-UHFFFAOYSA-N	432.440	1.473	50	20	IDGD	
COc1ccc(OC)c([C@@H]2C[C@H]2C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1	788091925	UZXBJOGRYBYWQL-FUHWJXTLSA-N	425.489	1.661	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)c1ccccc1)C(=O)NNc1ccc(-n2ccnc2)nn1	788179722	YXOMILPTKMAWFO-OAHLLOKOSA-N	447.546	1.206	50	20	IDGD	
COc1ccc(C(=O)NCC(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)cc1[N+](=O)[O-]	788870180	UQZYYSFSHRDQJM-KXBFYZLASA-N	442.428	1.053	50	20	IDGD	
CN(NS(=O)(=O)C1Cc2ccccc2C1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	788914744	FHXKYBWOHCFNQU-UHFFFAOYSA-N	438.550	1.593	50	20	IDGD	
CN(C)[C@H]1CCOc2c(NC(=O)C(=O)NNC(=O)COc3ccccc3F)cccc21	789732323	OVWPTFVENBOFIY-INIZCTEOSA-N	430.436	1.376	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)c3ccccc32)cc1	790126827	MDSINVZMENGQNJ-KBXCAEBGSA-N	432.498	1.961	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(OC(F)F)c(F)c1)C1CCN(c2ncccn2)CC1	790338115	DEHGBUGZDDQUCW-UHFFFAOYSA-N	445.423	1.443	50	20	IDGD	
CC(C)[C@H](NC(=O)OC(C)(C)C)C(=O)NCC(=O)NNc1cccc(F)c1[N+](=O)[O-]	791075935	JUTJGWPJDWDSPL-AWEZNQCLSA-N	427.433	1.843	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NN=C[C@@]23C[C@H]2CN(C(=O)OC(C)(C)C)C3)c1	792901875	YRZRDDOVPJDDLF-MGPUTAFESA-N	436.534	1.910	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(OC(C)C)nn2)cc1	793022098	PBHLERMGUWLVFR-CYBMUJFWSA-N	431.449	1.216	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21	794072340	VGMIOOQPWIBARP-UHFFFAOYSA-N	425.401	1.623	50	20	IDGD	
C[C@H]1CN(c2ccnc(C(=O)NNc3ccc(S(=O)(=O)N(C)C)cc3)c2)C[C@@H](C)O1	794730563	MTCNXDALOOMGRD-GASCZTMLSA-N	433.534	1.702	50	20	IDGD	
COCC1(C(=O)OCC(=O)NNC(=O)c2ccccc2)CCN(C(=O)OC(C)(C)C)CC1	796356436	JSQFWNIANYHNIU-UHFFFAOYSA-N	449.504	1.655	50	20	IDGD	
C[C@H](C(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)[C@H]1OCCc2sccc21	796496795	YVCZKWXSXZHONY-APPDUMDISA-N	433.442	1.911	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNc2ccc(S(C)(=O)=O)cc2)c(OC)c(C)c1OC	797039361	SDZXAYYVOICCRH-UHFFFAOYSA-N	437.474	1.506	50	20	IDGD	
CCCc1nc(C)c(NC(=O)C(=O)NNC(=O)CNC(=O)OCc2ccccc2)s1	797368354	ANHUEFJZXRHCJS-UHFFFAOYSA-N	433.490	1.416	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccnn2Cc2ccc(Cl)c(F)c2)n1	797371213	RFQRBGWHBGXWER-UHFFFAOYSA-N	430.827	1.827	50	20	IDGD	
CSc1cccc(F)c1C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	798980048	BUJHTMHJVWQKAH-UHFFFAOYSA-N	430.505	1.767	50	20	IDGD	
CCn1ncc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)c1C(F)(F)F	799262840	DOHILQQDIKFFRD-JSGCOSHPSA-N	439.394	1.580	50	20	IDGD	
Cn1nnc(COC(=O)/C(C#N)=C/c2cn(CCC(N)=O)nc2-c2ccc(Cl)cc2)n1	799453688	SXKUOGZYQLXMQP-MDWZMJQESA-N	440.851	1.253	50	20	IDGD	
CN(C)CCOc1ccc(/C=C\C(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)cc1	802066950	FMKATLGIBOGLSM-MLPAPPSSSA-N	446.529	1.897	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)CN2C(=O)[C@H]3CCCC[C@@H]3C2=O)c(OC)cc1Cl	802084773	JIOSCHPJYKVKDR-QWRGUYRKSA-N	438.868	1.685	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)c1cc(Br)cnc1OCC1CC1	803053399	AGRBYUWBGSCVPL-UHFFFAOYSA-N	443.298	1.919	50	20	IDGD	
CS(=O)(=O)C1(CNC(=O)NNC(=O)COc2ccc(Br)cc2)CCCC1	805839523	DXPBWCDBUFNBGC-UHFFFAOYSA-N	448.339	1.516	50	20	IDGD	
Cc1cc([N+](=O)[O-])ccc1NNC(=O)Nc1cccc(S(=O)(=O)N2CCN(C)CC2)c1	806230752	VZFBTVORDQJITN-UHFFFAOYSA-N	448.505	1.988	50	20	IDGD	
COCCOc1ccc(S(C)(=O)=O)cc1NC(=O)C(=O)NNc1c(F)cccc1F	806983790	HBFISGTWRIUUJF-UHFFFAOYSA-N	443.428	1.475	50	20	IDGD	
CN1CCC/C1=N\S(=O)(=O)c1cccc(NC(=O)C(=O)NNc2cccc(F)n2)c1	807390457	CQNDZBRVBJQXST-LFVJCYFKSA-N	434.453	1.115	50	20	IDGD	
Cc1cc(C)c(C)c(S(=O)(=O)NCC(=O)NNc2nc(-c3ccncc3)no2)c1C	810312485	VDIJGGJUBOBHER-UHFFFAOYSA-N	430.490	1.787	50	20	IDGD	
O=C(COC(=O)[C@H]1CCN(c2ccccc2F)C1)NNC(=O)[C@H]1COc2ccccc2O1	811378638	RUYBPTAMSLJBAF-IFXJQAMLSA-N	443.431	1.183	50	20	IDGD	
CCCCCn1nc(C(=O)NNS(=O)(=O)c2cncc(C#N)c2)c2ccccc2c1=O	811677628	DWWICUQEMKMZLW-UHFFFAOYSA-N	440.485	1.477	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccc3c(c2)CCCC(=O)N3)cc1	813033468	VAYUSYJOTPYYKX-UHFFFAOYSA-N	445.501	1.294	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2cccc(OC(F)(F)F)c2)cc1	813034047	WJMWFSIPQZNCQI-UHFFFAOYSA-N	446.407	1.917	50	20	IDGD	
COc1ccc(NC(=O)NNc2ccccc2S(=O)(=O)N(C)C)cc1-n1cnnn1	814648388	ABIJPOVJAXZHJB-UHFFFAOYSA-N	432.466	1.070	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)ccc1O)C(=O)Nc1cc(F)cc(F)c1F	815569462	VFIHJMVFYMBJTP-UHFFFAOYSA-N	432.152	1.972	50	20	IDGD	
Cc1cccc(COc2cccc(NC(=O)C(=O)NNC(=O)[C@@H]3CCc4nncn4C3)c2)c1	815691491	RLJFCIYHLCAFGA-QGZVFWFLSA-N	448.483	1.514	50	20	IDGD	
CC(=O)c1ccc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)N(C)C)cc1Cl	815752515	VOIBWCANSYJMQD-UHFFFAOYSA-N	438.893	1.875	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)c2cccnc2-c2cnn(C)c2)c2ccccc2c1=O	816805830	KAVIFJQJKWRDJR-UHFFFAOYSA-N	431.456	1.848	50	20	IDGD	
O=C(CCCCCNS(=O)(=O)c1ccc2c(c1)OCCO2)NNC(=O)CC1CC1	819140220	DWWLSDPJUFAPNE-UHFFFAOYSA-N	425.507	1.244	50	20	IDGD	
CCS(=O)(=O)N1CCC(C(=O)NNC(=O)c2ccccc2O)(c2ccccc2)CC1	849205390	BIIHNPHZTGIESM-UHFFFAOYSA-N	431.514	1.537	50	20	IDGD	
O=C(CSc1ccccc1[N+](=O)[O-])NNC(=O)c1cn(CCO)nc1C1CCOCC1	856690792	YEOLMTCNXGZLSR-UHFFFAOYSA-N	449.489	1.231	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)CNS(=O)(=O)c2ccc3ccccc3c2)cc1	913431361	JHBCMLCSBFRKID-UHFFFAOYSA-N	426.498	1.686	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(NC(=S)NNC(=O)c2ccc3c(c2)OCCO3)c1	913445784	LOFCVMNPSGXDID-UHFFFAOYSA-N	436.515	1.340	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc(Br)cc1)NNC(=O)NC1CCCCC1	913451385	VVFQVQMYPGMRHK-UHFFFAOYSA-N	447.355	1.781	50	20	IDGD	
Cc1cc(C)n([C@H](C)CC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)n1	915685723	JIJKNWYNHRGDAM-MRXNPFEDSA-N	433.534	1.697	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)[C@@H](C)NS(=O)(=O)c2ccc(Cl)cc2)cc1	915774202	MFJZYWUSUFCIHU-CYBMUJFWSA-N	425.894	1.542	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)CNS(=O)(=O)c1cccc(F)c1	915788137	VUXTUZVBUUNDLZ-CQSZACIVSA-N	445.472	1.872	50	20	IDGD	
Cc1ccc([C@@H](CN2CCOCC2)NC(=O)NNC(=O)COc2ccc(F)cc2)cc1	916216585	XAGNKLSCIOFJHC-HXUWFJFHSA-N	430.480	1.917	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)NCc1ccc(N2CCN(C)CC2)nc1	916246740	KXPYRKQPXPBVJC-UHFFFAOYSA-N	432.912	1.640	50	20	IDGD	
C[C@H]1CN(CCCNC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)C[C@@H](C)O1	916249886	QJLQKNNAKYTTLW-BGYRXZFFSA-N	446.596	1.028	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NC2CCN(C(=O)C3CC3)CC2)nc1	916260792	GGTOPVQURAEVQP-UHFFFAOYSA-N	438.554	1.139	50	20	IDGD	
O=C(NC[C@@H]1CCS(=O)(=O)C1)NNC(=O)c1ccccc1OCc1ccc(F)cc1	916375256	RAMJTXRDTUDIQV-HNNXBMFYSA-N	435.477	1.783	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H](CN2CCCC2=O)c2ccccc2)c1	916463398	ZMNGYKVOHRVPIW-SFHVURJKSA-N	444.513	1.398	50	20	IDGD	
COc1cc(C(=O)N2CCN(CC(=O)NNC(=O)c3ccc(F)cc3)CC2)ccc1C	917140986	FBRIXDQQDHYWCS-UHFFFAOYSA-N	428.464	1.362	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1ccc(COc2ccc(Cl)cc2)cc1	920297794	GPSOQWGMMFRSLS-LBPRGKRZSA-N	425.894	1.618	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)Nc1ncc(Cc2ccccc2Cl)s1	920933049	LVBWGRUKWPJILU-LLVKDONJSA-N	428.923	1.975	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)NCc2ccccc2N2CCN(C)CC2)c1	1115985673	LSQBYJUXLWCDSP-UHFFFAOYSA-N	427.505	1.600	50	20	IDGD	
CCCn1nc(C(=O)NN=Cc2ccc(OC)c(OCC(N)=O)c2)c2ccccc2c1=O	1317716931	LKIISAQHIKNHGF-UHFFFAOYSA-N	437.456	1.443	50	20	IDGD	
CN1CCN(c2ccccc2CNC(=O)NNC(=O)c2nnc(O)c3ccccc23)CC1	1318332121	MSBNXSYKUZZBAG-UHFFFAOYSA-N	435.488	1.231	50	20	IDGD	
CC(=O)N[C@@](C)(C(=O)NNC(=O)c1ccccc1Cl)c1ccc(S(C)(=O)=O)cc1	1321107681	VXOCMIXYDFNIHB-LJQANCHMSA-N	437.905	1.556	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)N(C)CC(=O)NNc2ccc(C(C)(C)C)nn2)cc1	1328737204	OSWYQKKYCJMVJC-UHFFFAOYSA-N	434.522	1.496	50	20	IDGD	
Nc1cnnc(NNC(=O)[C@H]2CC(=O)N(c3ccccc3Br)C2)c1Cl	1333509551	RRJZFJKMEGWOOA-QMMMGPOBSA-N	425.674	1.971	50	20	IDGD	
CC(C)(C)c1ccc(NNC(=O)NCc2ccc(C(=O)N3CCNC(=O)C3)cc2)nn1	1339244592	SJYSPXGHCCMRCH-UHFFFAOYSA-N	425.493	1.172	50	20	IDGD	
O=C(c1cc(Cl)nc2ccccc12)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1777803898	CEDZMNVIYQBXAP-JXFKEZNVSA-N	438.311	1.931	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccc3c(c1)OCCO3)CCO2	1779295329	IKVZLYGIKQKSAZ-OAQYLSRUSA-N	434.565	1.753	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C1CCCCC1)C2	1779371269	YVDPDHHUAVLTTQ-AUSIDOKSSA-N	443.548	1.393	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CO[Si](C)(C)C)C1	1779546327	LVPKETXEIBXEMK-JXXFODFXSA-N	444.601	1.913	50	20	IDGD	
CCn1nc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](Cl)COC)C3)cc1C	1779834983	LMIONUQKTIFDBU-WRWLIDTKSA-N	426.945	1.593	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc[n+]([O-])cc2)C1	1779945127	LIIWRLIINGSTHH-ATZDWAIDSA-N	430.332	1.684	50	20	IDGD	
CCOc1ccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)C(Cl)Cl)C3)nn1	1780239816	OMKKPFDYQXXZHK-FZKQIMNGSA-N	431.320	1.807	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)CN1CCCCC1=O)C2)[C@H](F)Br	1780777519	VJASMNVYEYDOSD-RPVQJOFSSA-N	448.333	1.203	50	20	IDGD	
CC(C)=NO[C@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Br)C2	1780808725	IGBTZJUNMCHVDQ-VWPFQQQWSA-N	436.322	1.992	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)CCS(=O)(=O)c3ccccc3)CCO2)C1	1781213064	LAEIBKZEEQFRCA-FXAWDEMLSA-N	442.965	1.698	50	20	IDGD	
CC(C)(C)n1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](F)Br)C3)C2)n1	1781325642	GMQVOGGKXVADMU-GUYCJALGSA-N	431.306	1.772	50	20	IDGD	
COc1ccc(CC(=O)N2CCO[C@]3(CCN(C(=O)[C@H](F)Br)C3)C2)cc1F	1781335628	XXNHWNATFXISLP-FUHWJXTLSA-N	447.276	1.897	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnc(OC)c(C)c1)C2	1782171090	NVWXZFWXXSPIKO-CBGDNZLLSA-N	439.940	1.780	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1cnc3ccccn13)C2	1782171807	GNXLAVBSXFVLFG-JBYIUTFZSA-N	448.951	1.645	50	20	IDGD	
CCCCC[C@@H](C)C(=O)N1CC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1	1783223267	CKWYORJDNDHKMZ-ZHRRBRCNSA-N	431.537	1.345	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H]3CCCO3)C2)C1	1783491111	PQWLMURGAZLKDH-WFCRQVQFSA-N	431.439	1.881	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cc(Cl)nc4n[nH]cc34)CCO2)C1	1783875719	PLCKRVKLKRRVAT-SCLBCKFNSA-N	442.303	1.309	50	20	IDGD	
COc1ccc(Cl)cc1CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]2C1	1784094982	XXJONTYGXNWDPL-PTOXDTDZSA-N	445.343	1.471	50	20	IDGD	
CCOC(=O)C(C)(C)C(=O)N1CC[C@@]2(CN(C(=O)[C@H](C)CBr)CCO2)C1	1785517311	HTQFNBBHWZOTKC-FZKQIMNGSA-N	433.343	1.437	50	20	IDGD	
C[C@H](Nc1nccs1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)Br)C[C@@H]21	1787490074	YXIBSRHQCHJCNJ-QMVSFRDZSA-N	445.383	1.707	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cn4ccccc4n3)[C@H]2C1	1787838781	HIQBKETZDOAOEH-AESZEHBQSA-N	449.349	1.959	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)c1cc2cccnc2[nH]1	1788373005	ZQKNMZKRLDAKQI-NZBPQXDJSA-N	439.285	1.847	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4nncn4c3)[C@H]2C1	1788376295	HFCYRQWIOTXADX-UNQGMJICSA-N	436.310	1.106	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccnc4c3OCO4)[C@H]2C1	1789182020	AQDWTOGMKUNAFG-XWUBHJNHSA-N	440.294	1.187	50	20	IDGD	
Cc1nn(C)c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]3C2)c1F	1789868732	KTDHGZKXFCNYNN-RSLFNQERSA-N	435.327	1.697	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3Cc4ccccc4O3)C[C@@H]21)[C@@H](F)Br	1789925678	HHFLZHXTOFLYLU-LZDOMEQBSA-N	441.297	1.660	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc4nccn34)[C@H]2C1	1790419025	VKIWZPJOXGPOOY-YXWQFLTLSA-N	435.322	1.711	50	20	IDGD	
CCc1[nH]nc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)CBr)c1Cl	1792867942	OGNFFBYQWFIOOB-NJBDSQKTSA-N	447.761	1.860	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)C(=O)c1ccc(Cl)cc1	1792949213	DCUAXRONSVHMTN-WJNVRWDZSA-N	447.688	1.803	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCc1cccs1	1794473324	SSHHVEXSBJMZTL-QDMKHBRRSA-N	427.530	1.631	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)COc1ccccc1	1795188837	ZYHLNQSHAINANA-ZXFNITATSA-N	425.323	1.686	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2ncccn2n1	1797380566	WUDYDERGLAEFBM-TYYYEBLRSA-N	426.304	1.169	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1cn2ccsc2n1	1797485885	MCCIGRJXNQZNAN-QCMRWSPLSA-N	431.287	1.290	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C=N/O[C@@H]1CCCCO1	1797817114	YJAQLWQBPHZPSJ-YLCWOVCDSA-N	446.342	1.279	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COc1cc(Cl)ccn1)C2	1797956872	IOQITPBSOBFZST-HBCWATKFSA-N	441.988	1.555	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc([N+](=O)[O-])cc1F)C2)[C@H](F)Br	1799349471	WZGYCUVNFMPKQS-WAYYCVMKSA-N	448.220	1.628	50	20	IDGD	
C[C@@H](Oc1cccnc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Br	1799351863	DAGSPITZHHLAJW-GGUBGCTKSA-N	430.274	1.129	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](F)Br)c1nc2ccc(F)cn2n1	1800161224	AATAYMJOQDJAJX-LSCVPOLPSA-N	428.237	1.811	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(Cl)nn1)C2	1800641414	APCVGHWJLCWDOC-FBKDDSFISA-N	431.718	1.507	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=N/O[C@@H]1CCCCO1)C2	1800641999	PZFIBHHBTIPVND-YLCWOVCDSA-N	446.342	1.279	50	20	IDGD	
Cc1nccn1CCCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@](C)(Cl)CCl)C2	1801311806	ZUFCBAOGCFVVFC-HIRMHNASSA-N	431.364	1.798	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1C[C@@H]1c1ccccc1	1802208276	WJBAWADZAMPIQT-DSJDWBEOSA-N	433.512	1.741	50	20	IDGD	
CCOC(=O)c1cc(C(=O)N2CCC3(CCCN(C(=O)[C@H](O)CCl)C3)CC2)ccn1	1805525166	GDMPRMGSGRUZIX-QGZVFWFLSA-N	437.924	1.703	50	20	IDGD	
Cc1cccc(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)n1	1807369092	AIRKAANEFCOHGG-KNQAVFIVSA-N	444.300	1.098	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@@H](CNC(=O)COc2ccc(O)nn2)[C@@H]1c1cccnc1	1812349074	AJKXIVCQEBAVIV-KXBFYZLASA-N	447.923	1.927	50	20	IDGD	
Cc1ncoc1C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1813070416	IVFBSJNMTIKVCL-APWZRJJASA-N	428.493	1.071	50	20	IDGD	
Cc1nccn1CCCC(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1	1813356322	UNJJCZAYVITUCS-NSHGMRRFSA-N	433.940	1.672	50	20	IDGD	
CN(C)C(=O)NCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](F)Br)[nH]n1	1814564165	VWLUHASCGMLXKX-GXFFZTMASA-N	433.282	1.364	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)[C@H](O)CCl)n[nH]2)n1	1814868079	VALMOQFUUPBRLY-HUUCEWRRSA-N	434.884	1.669	50	20	IDGD	
Cc1cccc(CC(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)n1	1814969252	OUBQMJDQZGQIMH-HXUWFJFHSA-N	447.304	1.342	50	20	IDGD	
CC(C)[C@H](S)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1815240992	XNXZQRLEJCIUFA-WMZOPIPTSA-N	430.339	1.350	50	20	IDGD	
CC[C@H](C)[C@@H](O)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1815253854	SXOLELFMMJANNT-BJOOFOGMSA-N	443.508	1.121	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)C2CC(F)(F)C2)[nH]n1)c1ccc(B(O)O)cc1	1817470439	RAECKJBXAHYUJG-MRXNPFEDSA-N	432.236	1.441	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@H](O)CCl)CC2)c1snnc1C1CC1	1817831237	CWFUFQCCEPDLCV-PSASIEDQSA-N	427.939	1.698	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3nn(C)c4c3CCC4)sc2C1	1818476387	QVIIDBZKRXEVCX-CMPLNLGQSA-N	437.953	1.845	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)Cc2ccccc2)[nH]n1	1819402262	XGOSMQVSBWUGKD-LJQANCHMSA-N	447.499	1.957	50	20	IDGD	
Cc1n[nH]cc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1820270799	QGIPBDWKCXYHEJ-MRXNPFEDSA-N	437.464	1.059	50	20	IDGD	
Cn1ccc(=O)cc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCBr)CC2	1821309261	CTLSIOXMQPLXNY-JTQLQIEISA-N	439.335	1.853	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(OC)n(C)n3)sc2C1	1821777629	GEWUERLJMKQQOI-ZJUUUORDSA-N	427.914	1.365	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCN2CCOCC2)[nH]n1	1822369242	NRTFDRVVSSCKOB-GOEBONIOSA-N	427.933	1.378	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)Cc2ccc3ncnn3c2)[nH]n1	1822374667	ZFUUAWVXQNZUPH-HOCLYGCPSA-N	445.911	1.941	50	20	IDGD	
C=CCOCCCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1	1822410675	OMRVVABSXHWTJB-QGZVFWFLSA-N	434.541	1.758	50	20	IDGD	
CN1CCC(C(=O)N2CCCC[C@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)CC1	1822412003	HWGOJOBZVYYBBX-KRWDZBQOSA-N	433.557	1.117	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(O)cc2)[nH]n1	1822415876	SZGANKICRXYIRO-KRWDZBQOSA-N	428.493	1.794	50	20	IDGD	
O=C(CCn1ccnn1)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](F)Br)[nH]n1	1822809729	PVHILUBHSKQKST-BXUZGUMPSA-N	428.266	1.774	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H]2CCCOC2)n[nH]1	1823468660	BWJLYPIZALJFGU-GUYCJALGSA-N	441.492	1.141	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@H](O)N2CCOCC2)CC1	1824013860	VILFIIUARBGRET-HKUYNNGSSA-N	429.989	1.522	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H]1CCNC(=O)C1)CC2	1825647237	LEXNBORUSRUDFI-LPEHRKFASA-N	429.340	1.365	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CSc1ncccn1)CC2	1825998925	KFOJWYMXWXCCQV-GHMZBOCLSA-N	441.966	1.891	50	20	IDGD	
COCCn1nccc1C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](Cl)COC)sc2C1	1825999307	UPNDYEWRCZRVPI-VXGBXAGGSA-N	441.941	1.466	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cncc(F)c2)CC1	1826059786	PQMVOOKTCUXHIN-IBGZPJMESA-N	433.528	1.827	50	20	IDGD	
O=C(Nc1cccnc1)C(=O)N[C@@H]1CCc2nc(NC(=O)C(Cl)Cl)sc2C1	1826099985	XZGWGNVOXINNFO-MRVPVSSYSA-N	428.301	1.893	50	20	IDGD	
Cc1nn(C)c(C)c1CC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](O)CCl)CC2	1826836023	CTJOULXDUFBREY-FZMZJTMJSA-N	425.942	1.248	50	20	IDGD	
CCc1oncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827054753	JHNPHNHFFTZBPU-FQEVSTJZSA-N	439.321	1.464	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)n(C(F)F)n1	1830364371	HJZAGOCSMGOVMS-LJQANCHMSA-N	448.898	1.922	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cccnc3)C2)C1	1830538427	FSPKDFBIHXULHQ-BEFAXECRSA-N	440.338	1.112	50	20	IDGD	
COc1ccccc1CCC(=O)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1830996354	GVKLWYXYNJPJJJ-HXUWFJFHSA-N	445.343	1.888	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(Cl)cnc3O)C2)C1	1831638999	JHTNZLBTKZGJKA-DNVCBOLYSA-N	446.331	1.918	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)C(C)(F)F)CCO2	1831684172	GTEIMBXXLUOZDJ-YVEFUNNKSA-N	441.313	1.908	50	20	IDGD	
CC1CCN(CC(=O)N2CCC([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)CC1	1831871568	UTSRVEVRKDQMLD-NRFANRHFSA-N	449.640	1.711	50	20	IDGD	
C=CCSCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1	1832458675	VHFOCVVFKYBCBH-DLBZAZTESA-N	425.378	1.598	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cncn3-c3ccncc3)CCO2)C1	1833654273	FDXLRBZVJPQGBL-UTKZUKDTSA-N	447.923	1.355	50	20	IDGD	
Cc1cnc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)s1	1833804502	ZNCVMQYZDWQTCX-DLBZAZTESA-N	436.361	1.758	50	20	IDGD	
Cn1c(C(=O)NC2CCN(C3CCN(C(=O)C(Cl)Cl)CC3)CC2)cccc1=O	1834087067	RATUMQGIILJYTR-UHFFFAOYSA-N	429.348	1.374	50	20	IDGD	
Cc1c(C(=O)NC2CCN(C3CCN(C(=O)CCBr)CC3)CC2)cnn1C	1834280284	RWDFEPUCAKGJHS-UHFFFAOYSA-N	440.386	1.699	50	20	IDGD	
Cc1cncc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@](C)(Cl)CCl)C3)C2)c1	1834285121	IRIHOYRKTYMOBP-MOPGFXCFSA-N	430.332	1.696	50	20	IDGD	
Cc1noc(CC(=O)NC2CCN(C3CCN(C(=O)[C@H](C)Br)CC3)CC2)n1	1834851509	FPEHCMDCLMEQJQ-LBPRGKRZSA-N	442.358	1.276	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)CCN3CCN(C)CC3)CC2)CC1	1836395894	QDWUZXKPEPHXHV-HXUWFJFHSA-N	442.048	1.213	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc4ncncc4c3)CCO2)C1	1837022054	CPMNCNVGBZVLEF-JOCHJYFZSA-N	446.935	1.965	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccc(F)cc3F)C2)C1	1839147846	DTTRKPUKEBSMQC-OXQOHEQNSA-N	430.879	1.981	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccccc3)C2)C1	1839150914	CCGDOOOQKNTSHR-VQTJNVASSA-N	429.344	1.922	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccccc3O)CCO2)C1	1839909213	ZMEJEYJQAJSQJX-UXHICEINSA-N	445.343	1.627	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)C#Cc3ccccc3)C2)C1	1839963407	JJWLIFWBNJVCJA-GHTZIAJQSA-N	449.345	1.668	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCN3CCCC3)C2)C1	1839967545	PYCPLXKHFIAJDT-QFBILLFUSA-N	446.386	1.102	50	20	IDGD	
Cc1cnc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)s1	1840031184	HYZOISXQYOWWOK-WBMJQRKESA-N	432.340	1.305	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)CC[C@@H]3CCOC3)CCO2)C1	1840585154	AITHNGOHRPBKDT-GPMSIDNRSA-N	447.370	1.291	50	20	IDGD	
Cc1[nH]nc(C(=O)N2CC3(CCCN3C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)c1F	1841924196	GLHXLEOIUDGUEP-LBPRGKRZSA-N	443.907	1.806	50	20	IDGD	
Cc1nc(CC(=O)N2CC3(CCCN3C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)no1	1841924246	OIQNPSKEYKKEJB-ZDUSSCGKSA-N	441.916	1.256	50	20	IDGD	
CC[C@H](C)[C@H](N)C(=O)N1CC2(CCCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C1	1841924435	MFROIMPPHLIWQG-KKUMJFAQSA-N	430.977	1.695	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)CCc2c[nH]c3ccccc23)C1	1843070086	IKGWRTBMEGFXJI-UHFFFAOYSA-N	431.301	1.298	50	20	IDGD	
Cc1occ(C(F)(F)F)c1C(=O)N1CCCC12CN(C(=O)CCC(=O)NN(C)C)C2	1843534729	CBQGBIWFAQKHIY-UHFFFAOYSA-N	430.427	1.797	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2cc(-c3ccccc3)no2)C1	1844478704	QVLNQNVKQSZDMR-UHFFFAOYSA-N	446.467	1.471	50	20	IDGD	
CC(=O)NC(C)(C)C(=O)N1CC2(CCCN2C(=O)c2cc([N+](=O)[O-])ccc2OC(C)=O)C1	1844692045	ZWOYATRMNOPFFE-UHFFFAOYSA-N	446.460	1.252	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCCC12CN(C(=O)c1cc3n(n1)CCCNC3=O)C2	1845171392	WZCUJUIVOGZYBK-QGZVFWFLSA-N	428.320	1.070	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cccc(S(C)(=O)=O)c1	1847383163	OJXIRWPHWLFKQT-KCXAZCMYSA-N	443.363	1.937	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@H](F)C[C@H]1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl	1847568165	CNESKWNUTDGBCZ-YYFQZIEXSA-N	433.908	1.135	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(=O)n(-c3ccccc3F)c(=S)[nH]c2c1)C(=O)NC1CC1	9890251	DPNIFDZCMXYENF-UHFFFAOYSA-N	441.444	1.227	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2ccc(C(=O)NNc3nnc(C)c(=O)[nH]3)cc2)cc1C	11266032	PNJKLPQTNZFOHU-UHFFFAOYSA-N	428.474	1.648	50	20	IDGD	
O=C(NNC(=O)c1n[nH]c(=O)c2ccccc12)c1ccccc1I	15941653	LMZUBNHDIUWSJH-UHFFFAOYSA-N	434.193	1.603	50	20	IDGD	
Cc1nnc(NNC(=O)C2CCN(S(=O)(=O)c3ccc(C(C)C)cc3)CC2)nc1O	23309711	SKTQRXTZFDDZDD-UHFFFAOYSA-N	434.522	1.553	50	20	IDGD	
COc1ccc2cc(C(=O)NNC(=O)c3ccc(Cl)c(S(N)(=O)=O)c3)c(C)nc2c1	27082717	SUMOLCMAIJNKBK-UHFFFAOYSA-N	448.888	1.927	50	20	IDGD	
Cc1cc2ncc(C(=O)NNC(=O)c3ccc(CSc4nncn4C)cc3)c(C)n2n1	27802555	PVFILVUMDRZBRB-UHFFFAOYSA-N	436.501	1.842	50	20	IDGD	
C[C@@H]1CCCC[C@@]12NC(=O)N(CC(=O)NNC(=O)c1cc(-c3ccccc3)on1)C2=O	28792809	BTSWNCMCQWLISQ-LRTDBIEQSA-N	425.445	1.603	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)NCc1cccc(OCCN2CCOCC2)c1	60103741	NUWPZLBZRFIOED-UHFFFAOYSA-N	430.480	1.610	50	20	IDGD	
CC(=O)Nc1ccc(S[C@@H](C)C(=O)NNC(=O)c2n[nH]c(=O)c3ccccc23)cc1	108114163	PGAMLMOYSGQDSM-NSHDSACASA-N	425.470	1.823	50	20	IDGD	
COc1ccc(-c2cnc(CCC(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)o2)cc1	116133771	BWOPEBPZTBGNFK-UHFFFAOYSA-N	447.451	1.991	50	20	IDGD	
C[C@H](NC(=O)c1ccc(Cl)cc1)C(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	726083992	PLNSWLOATLOMJO-NSHDSACASA-N	427.848	1.166	50	20	IDGD	
C[C@@]1(NNC(=O)NC[C@H](c2cccc(Cl)c2)N2CCOCC2)CCS(=O)(=O)C1	727034921	YAPWKZSYCGCBBE-SJLPKXTDSA-N	430.958	1.094	50	20	IDGD	
O=C(CN1CCC(C(=O)Nc2ccc3c(c2)OCO3)CC1)NNC(=O)c1ccc(F)cc1	727325667	RPNYWYLOMUEXPA-UHFFFAOYSA-N	442.447	1.666	50	20	IDGD	
CC(C)(C)SCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	727608471	UADNHNJDTZSQLF-UHFFFAOYSA-N	444.579	1.183	50	20	IDGD	
COc1ccc(CCNC(=O)NNC(=O)Cc2nc3ccccc3n2C)c(OC)c1OC	727944941	HQEWCEKWRHBZOP-UHFFFAOYSA-N	441.488	1.715	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)[C@@H]1CCCN(Cc2cccnc2)C1	728211026	DNTUFDRSZSITIS-QGZVFWFLSA-N	429.546	1.878	50	20	IDGD	
O=C(C[C@H](NC(=O)c1ccccc1)c1ccccc1)NNC(=O)[C@H]1CCS(=O)(=O)C1	728371600	ADUKGLHABCIILQ-ROUUACIJSA-N	429.498	1.130	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)[C@H]2CCCN2c2ncnc3sccc23)cc1	728600755	RNIWMSVIBZDQRO-MRXNPFEDSA-N	426.502	1.928	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)Nc2cccc(OCC(N)=O)c2)c1	728742285	AAQZBXBJROFNMY-UHFFFAOYSA-N	437.250	1.788	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCN(c2ccc(Cl)cc2)C1=O)C1CCN(c2ncccn2)CC1	728890744	ZEMYEMVOEDBIQM-QGZVFWFLSA-N	442.907	1.547	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)[C@@H](c2ccccc2)N2CCN(C)CC2)o1	729528385	VCUJEWNCVKYIBF-OAQYLSRUSA-N	427.549	1.871	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)[C@H]2CC(=O)N(C[C@H]3CCCN3CC)C2)cc1OC	729628450	UVUVGOQYTIKOLP-DLBZAZTESA-N	432.521	1.188	50	20	IDGD	
CC(C)C[C@H](C(=O)NNC(=O)CCc1ccccc1O)N1C(=O)[C@H]2CC=CC[C@H]2C1=O	730034040	OIYSRVARBQNMPU-FGTMMUONSA-N	427.501	1.838	50	20	IDGD	
C[C@@H]1CCCN(S(=O)(=O)c2cc(C(=O)NNC(=O)c3ccc(C#N)cc3)n(C)c2)C1	730215068	ACHPKAAMRRQZLV-CQSZACIVSA-N	429.502	1.392	50	20	IDGD	
N#CCN1CCC(NC(=O)NNC(=O)COc2ccc(OCc3ccccc3)cc2)CC1	730674064	DUHSRNSSBYRPFD-UHFFFAOYSA-N	437.500	1.963	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N[C@H](C)c1nnc2n1CCC2	730937450	QHDMMQPWIIGEQO-GHMZBOCLSA-N	437.298	1.846	50	20	IDGD	
COC(=O)c1ccc(CCC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)cc1	731596995	PPCCOGYRAWOPFK-UHFFFAOYSA-N	432.502	1.469	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)NCc2ccc(N(C)S(C)(=O)=O)cc2)cc1	732256535	GPRGHOUADSZQOU-UHFFFAOYSA-N	434.518	1.554	50	20	IDGD	
O=C(NCCN1C(=O)CNC1=O)NNC(=O)c1cc(-c2ccccc2)nc2ccccc12	733656995	DUINLWCZLDTJFB-UHFFFAOYSA-N	432.440	1.398	50	20	IDGD	
Cc1ccc(N2CCCC2)c(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)c1	735027648	AIZRUSZLETZVBT-UHFFFAOYSA-N	436.921	1.971	50	20	IDGD	
C[C@@H](OCc1ccccc1)C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	735118026	NDIPDUFNBPOMTL-MRXNPFEDSA-N	433.534	1.066	50	20	IDGD	
CCc1cc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)n[nH]1	739027315	WZCFKRCHFGFQTH-UHFFFAOYSA-N	434.522	1.291	50	20	IDGD	
O=C(NCc1ccccc1OCC1CC1)NNC(=O)c1csc(N2CCOCC2)n1	740072580	PHNINUUZTMBIEX-UHFFFAOYSA-N	431.518	1.913	50	20	IDGD	
Cc1nn(C)c(C)c1S(=O)(=O)N[C@@H](C)C(=O)NNC(=O)Cc1ccc2ccccc2c1	743311665	QMTKODOGQLSPIU-AWEZNQCLSA-N	443.529	1.247	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)c1cn([C@@H]2CCS(=O)(=O)C2)nc1C(C)C	744361786	CLKRZQGKVFKGAD-OAHLLOKOSA-N	434.518	1.378	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CN2CCN(C(=O)c3cc4occc4s3)CC2)c1	744405113	MREHEQBXULNCBA-UHFFFAOYSA-N	437.481	1.585	50	20	IDGD	
Cc1nc(CN2CCC(CNC(=O)NNC(=O)c3cc([N+](=O)[O-])ccc3O)CC2)oc1C	745816268	WPRDUENENZWATN-UHFFFAOYSA-N	446.464	1.761	50	20	IDGD	
C[C@@H](O)CC(C)(C)CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	745848975	YZXRGKCRQOCRMC-CQSZACIVSA-N	426.539	1.212	50	20	IDGD	
CN(C)C(=O)NNC(=O)c1cccc(NC(=O)C[C@@H]2SC(N3CCCCC3)=NC2=O)c1	746005973	GDHSSLVGLIQSCM-HNNXBMFYSA-N	446.533	1.415	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)c1cnn(CC(=O)NC2CCCCC2)c1	746579645	KQPHATCYFHUBCG-UHFFFAOYSA-N	429.477	1.181	50	20	IDGD	
CCO[C@@H](CCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)C1CCCC1	747591514	BWUBSEPMPIBIEJ-SFHVURJKSA-N	440.566	1.866	50	20	IDGD	
O=C(CN1CCOC[C@H]1C[C@@H](O)c1ccccc1)NNC(=O)c1ccc([N+](=O)[O-])cc1	747661469	XWSXWGJILPNIKF-RTBURBONSA-N	428.445	1.180	50	20	IDGD	
CCN(C[C@@H]1CCN(CC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)C1)CC(F)(F)F	747968111	SVAKDBVCJLHTEG-ZDUSSCGKSA-N	431.415	1.562	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NCC(=O)NNc2ccc(C#N)cc2)c1	748117341	ZVADOVQOWJSJNF-UHFFFAOYSA-N	429.502	1.462	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)[C@](C)(O)[C@H](C)c2ccccc2)cc1OC	748484862	UICCQSOLTDNLED-JLCFBVMHSA-N	430.457	1.563	50	20	IDGD	
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)NNC(=O)CNC(=O)c1cccs1	749588909	PDKWJSVPHRSTLL-WBVHZDCISA-N	429.546	1.719	50	20	IDGD	
CO[C@@H](C)c1noc(CN2CCCN(C(=O)NNC(=O)COCc3ccccc3)CC2)n1	750283003	YKQNCLLIJVUJMN-INIZCTEOSA-N	446.508	1.242	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CNC(=O)c2cccs2)c([N+](=O)[O-])cc1OC(F)F	751208155	ATCTXAPJNORUAV-UHFFFAOYSA-N	444.372	1.457	50	20	IDGD	
Cn1cnc(S(=O)(=O)NNC(=O)[C@H]2Cc3ccccc3CN2Cc2ccccc2)c1	751276291	MVUHUAUAQHLJJI-LJQANCHMSA-N	425.514	1.357	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C2CCN(S(=O)(=O)c3cc(F)ccc3F)CC2)o1	752528563	YLLJKUSXSBBPKM-UHFFFAOYSA-N	427.429	1.728	50	20	IDGD	
CCOC(=O)c1ccc(N2CC(NC(=O)NNC(=O)CSc3ccccc3O)C2)nc1	753278178	BZCYLPNONSMWPA-UHFFFAOYSA-N	445.501	1.275	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NCc2ccc(C)cc2N2CCOCC2)cc1	753948439	ZJQWRNYCUXRPMT-UHFFFAOYSA-N	428.489	1.750	50	20	IDGD	
O=C(COC(=O)c1cccc(I)c1O)NNC(=O)c1cccs1	755148050	OLGBJORVOMGYPB-UHFFFAOYSA-N	446.222	1.676	50	20	IDGD	
CC(C)[C@H](NS(=O)(=O)c1ccc2ccccc2c1)C(=O)NNC(=O)Cc1cc[nH]n1	755283951	HBLZSDUFMQQUBP-IBGZPJMESA-N	429.502	1.256	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1OC	755374814	YXUSZFMFOYZQIG-UHFFFAOYSA-N	448.501	1.955	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2ccn(-c3ccccc3)n2)cc1	755484262	PDBGPULXUVWQLR-UHFFFAOYSA-N	442.501	1.654	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)cn2)C[C@H](C)O1	755867097	YAUQHYABDDGAQS-KBPBESRZSA-N	447.517	1.565	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)Nc1cc(F)cc(N2CCOCC2)c1	756281071	SHFFTZAATGDDCK-UHFFFAOYSA-N	433.396	1.802	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)Nc2cc(C3CC3)nn2[C@@H]2CCS(=O)(=O)C2)c1O	756855022	JVBNJYAAHHSSJP-GFCCVEGCSA-N	449.489	1.301	50	20	IDGD	
COc1ccccc1N1CC[C@@H](NC(=O)NNC(=O)COc2cc(C)ccc2C)C1=O	757285414	IDPPOSYTOGFVPD-MRXNPFEDSA-N	426.473	1.827	50	20	IDGD	
O=C(NN=c1cc[nH]cc1Cl)c1ccc2c(c1)S(=O)(=O)N(C[C@@H]1CCCO1)C2=O	757420065	LUUGCXROVIQEFG-LBPRGKRZSA-N	436.877	1.237	50	20	IDGD	
Cc1nccc(NCc2cccc(C(=O)NNC(=O)CCN3C[C@@H](C)O[C@H](C)C3)c2)n1	757716254	TXBUHXXYYSAEBH-HZPDHXFCSA-N	426.521	1.657	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1cccc2c1oc(=O)n2C	757806008	DJAXPFDVVXIBPL-UHFFFAOYSA-N	433.804	1.412	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)Nc1ccc(C(=O)N2CCOCC2)cc1C	757831547	UBCLVEYLNSDSDE-UHFFFAOYSA-N	426.473	1.871	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N[C@@H]2CN(C(=O)OC(C)(C)C)C[C@H]2C#N)c(OC)c1	758757158	FYGVZZYIFFQGLE-IUODEOHRSA-N	433.465	1.407	50	20	IDGD	
C[C@H]1Oc2c(cccc2C(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)NC1=O	758785178	BWDAWSCWRSQBSU-CYBMUJFWSA-N	447.492	1.655	50	20	IDGD	
CCCC(=O)N1CCC[C@H]1C(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758785180	BWOUTXTYGFFLDX-HNNXBMFYSA-N	425.530	1.413	50	20	IDGD	
Cc1nn(-c2ccc(Br)cc2)cc1C=NNC(=O)N[C@H]1CCS(=O)(=O)C1	763356522	SDIABRNKQPODBL-AWEZNQCLSA-N	440.323	1.763	50	20	IDGD	
O=C(NCc1cccnc1OCC(F)F)NNC(=O)C1CCN(c2ncccn2)CC1	763497295	FTITWJOLNIYAGN-UHFFFAOYSA-N	435.435	1.263	50	20	IDGD	
Cc1cc(F)ccc1NC(=O)C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	763530248	GPGRFVOGNIZEKG-UHFFFAOYSA-N	427.480	1.432	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)[nH]n1)C(=O)Nc1ccc(-n2cncn2)c(F)c1	763605638	WRTDUOMPCYKYHA-UHFFFAOYSA-N	434.391	1.196	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cccc(C(=O)NC3CC3)c2)c2ccccc2n1	763619282	QFBXRBUSTARNPB-UHFFFAOYSA-N	431.452	1.835	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2ccc(C)c(NS(C)(=O)=O)c2)c1	763668052	GVHABOITNVWPEV-UHFFFAOYSA-N	448.501	1.148	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1nn(C(C)(C)C)cc1C#N	763682675	TUXSIVBYLYYGFP-UHFFFAOYSA-N	428.449	1.073	50	20	IDGD	
COCC[S@](=O)Cc1cccc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCC3)c1	763786200	XDAYBKUMVPOFKQ-PMERELPUSA-N	449.554	1.532	50	20	IDGD	
COCCOc1c(Cl)cccc1NC(=O)C(=O)NNC(=O)COc1ccccc1C#N	763806454	DDLOEOGOOTVLLB-UHFFFAOYSA-N	446.847	1.402	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(S(=O)(=O)N[C@H](C)CC)c2)cc1	763832616	YWHYJXOOWQLTEY-CQSZACIVSA-N	446.529	1.726	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cc(OC)cc(OC)c2)cc1	763861515	QIUVAOROMYNBHK-ZDUSSCGKSA-N	431.445	1.656	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2sc(C)c(C)c2C(=O)OC)cc1OC	763902728	PPWGVQMDDYBXKJ-UHFFFAOYSA-N	449.485	1.959	50	20	IDGD	
O=C(NNC(=O)c1ccc(Br)s1)C(=O)Nc1ccccc1Cn1cncn1	763938405	FHQOSGNAEBROBY-UHFFFAOYSA-N	449.290	1.550	50	20	IDGD	
Cn1cnnc1-c1cccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)on2)c1	764004516	YFPQVRMIUIFSJR-UHFFFAOYSA-N	431.412	1.537	50	20	IDGD	
O=C(NNC(=O)C1CCCC1)C(=O)Nc1cc(F)c(F)cc1I	764070534	MDBBLOMEZRDQML-UHFFFAOYSA-N	437.184	1.846	50	20	IDGD	
CC(C)S(=O)(=O)c1ccccc1NC(=O)C(=O)NNC(=O)c1ccc(Cl)cc1O	764116441	FVDAGKSQIVTCIB-UHFFFAOYSA-N	439.877	1.627	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2O1)C(=O)Nc1ccccc1OC[C@@H]1CCCCO1	764151238	IEGOAYYUYPQEMQ-JXFKEZNVSA-N	439.468	1.724	50	20	IDGD	
Cc1ncsc1C(=O)NNC(=O)C(=O)Nc1ccc(C(=O)N2CCC(C)CC2)cc1	764244949	LBDKBXMIHOZMDR-UHFFFAOYSA-N	429.502	1.723	50	20	IDGD	
COc1ccc(Cn2nccc2NC(=O)C(=O)NNC(=O)c2scnc2C)c(OC)c1	764246490	IWAOBDIJNMMQES-UHFFFAOYSA-N	444.473	1.113	50	20	IDGD	
CC(C)S(=O)(=O)c1ccccc1NC(=O)C(=O)NNC(=O)c1cccc2ncccc12	764252705	KKAUSXOGLZPHAH-UHFFFAOYSA-N	440.481	1.817	50	20	IDGD	
COCCOc1ccc(C(F)(F)F)cc1NC(=O)C(=O)NNC(=O)Cc1ccncc1	764354580	TZCLGEPSJAWTNC-UHFFFAOYSA-N	440.378	1.454	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)C(=O)Nc1ccc(OCc2ccccc2)nc1	764366365	AIWHIYYGWMATCC-UHFFFAOYSA-N	434.452	1.963	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1)C(=O)Nc1cnn(-c2ccccc2)c1	764386894	FBGBKMZOEDRHHG-UHFFFAOYSA-N	433.403	1.801	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)c2c3c(nn2C)CCCC3)cc1	764518718	HWFZONMPQBAWGA-UHFFFAOYSA-N	425.518	1.795	50	20	IDGD	
C[C@H](NC(=O)C(C)(C)C)C(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	765755198	OUIVWFVIJRZWHP-HNNXBMFYSA-N	437.972	1.156	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCCc2nc3c(s2)CCCC3)c2ccccc2c1=O	766265757	AAGTYZOKXFRBHQ-UHFFFAOYSA-N	440.529	1.938	50	20	IDGD	
C[C@]1(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)CCc2ccccc2C1	766635530	AIUPYEDEJOBWFF-VWLOTQADSA-N	434.540	1.787	50	20	IDGD	
O=C(NN=c1cc[nH]cc1Cl)c1cc(I)ccc1-n1cnnn1	768448191	PNOQIPHEGRATKT-UHFFFAOYSA-N	441.620	1.494	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3ncn(-c4ccccc4)n3)n[nH]2)cc1OC	768466298	XXUUBNJUVQAFLJ-UHFFFAOYSA-N	433.428	1.749	50	20	IDGD	
COCCCNC(=S)N(C)NC(=O)[C@H]1CC(=O)N(c2cc(Cl)ccc2OC)C1	768735392	KTPWGTKZCBAYDD-LBPRGKRZSA-N	428.942	1.576	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)N[C@@H]1CC(=O)N(c2c(F)cccc2F)C1	770753785	MAHTZTIJBBJTQP-GFCCVEGCSA-N	434.399	1.488	50	20	IDGD	
COc1ccccc1[C@]1(C)NC(=O)N(CC(=O)NNC(=O)c2cccc3ncccc23)C1=O	771265895	HZXZKFZRTDYHBB-QHCPKHFHSA-N	447.451	1.472	50	20	IDGD	
CCN1CCN(c2cccc(NC(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)c2)CC1	771276086	FVIDLBOJRDPDKF-UHFFFAOYSA-N	449.515	1.542	50	20	IDGD	
COc1ccc(C)cc1[C@@]1(C)NC(=O)N(CC(=O)NNc2ccc([N+](=O)[O-])cc2)C1=O	771649765	OBCYDHKLZYUYIK-HXUWFJFHSA-N	427.417	1.822	50	20	IDGD	
Cn1cnc(-c2cccc(NC(=O)NNC(=O)CCN3CCN(c4ccccc4)CC3)c2)n1	771783773	DNIZGQKAOCUIQX-UHFFFAOYSA-N	448.531	1.847	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)nn1C	771867536	LHTUYJOFGMMCIW-UHFFFAOYSA-N	432.440	1.262	50	20	IDGD	
Cc1ccc(CN2C[C@@H](C(=O)NNC(=O)C(=O)NCc3ccc(Cl)cc3)CC2=O)cc1	772197834	ZGRIQNQLHFGFOE-KRWDZBQOSA-N	442.903	1.461	50	20	IDGD	
CNS(=O)(=O)c1ccc(C)c(NC(=O)C(=O)NNc2ncc(Cl)cc2Cl)c1	773677630	QRIHATUINDSNSE-UHFFFAOYSA-N	432.289	1.687	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2ccc3c(c2)CN(C(=O)OC(C)(C)C)CC3)n1	773730023	DNFGOIUCIABIOU-UHFFFAOYSA-N	442.476	1.860	50	20	IDGD	
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	775687614	CKVUFZTVSPFXGO-JXFKEZNVSA-N	425.489	1.856	50	20	IDGD	
COc1cc([C@H](NC(=O)NNC(=O)c2cnccn2)C(F)(F)F)cc(OC)c1OC	776001587	QIPOZOZOTYIJET-AWEZNQCLSA-N	429.355	1.750	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)c2c(C)nn(C)c2-n2cc(C)cn2)n[nH]1	777812475	FVHDHTFTRKBZAQ-UHFFFAOYSA-N	434.460	1.696	50	20	IDGD	
Cc1ccnc2c(S(=O)(=O)N3CCN(S(=O)(=O)CBr)CC3)cccc12	778070620	PWQPWFITNVKUHW-UHFFFAOYSA-N	448.364	1.532	50	20	IDGD	
CCn1c(NNC(=O)[C@@H](O)[C@@H](O)c2nc3ccccc3s2)nc2ccccc2c1=O	779475398	LGRNJZSGQKEGKH-JKSUJKDBSA-N	425.470	1.564	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)c(OC)c1	782121451	ZDTNAFYZQACVAI-LLVKDONJSA-N	433.392	1.174	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCCN(S(=O)(=O)CBr)CC2)cc1	782470196	AYVVLULNUTYRCQ-UHFFFAOYSA-N	427.342	1.074	50	20	IDGD	
Cc1ccc(Br)c(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)c1	782888837	ZDVBNOHUDFMTQD-UHFFFAOYSA-N	444.289	1.973	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C(=O)Nc2ccc(O[C@H]3CCOC3)cc2)nc2ccccc21	782893086	HNEGMWSILLAMMF-INIZCTEOSA-N	437.456	1.070	50	20	IDGD	
Cc1nc2ccc(NC(=O)C(=O)NNC(=O)c3csc(N4CCOCC4)n3)cc2s1	782896395	HOTRYQRTTVRAEI-UHFFFAOYSA-N	446.514	1.298	50	20	IDGD	
COC(=O)CCNC(=O)c1ccc(NC(=O)C(=O)NNc2c(C)cc(C)cc2C)cc1	783369017	YPZQHPIPHCYWDT-UHFFFAOYSA-N	426.473	1.987	50	20	IDGD	
Cc1cc(C)c(NNC(=O)C(=O)Nc2ccc(NC(=O)CN3CCOCC3)cc2)c(C)c1	783369130	JNWHEVDRMMTENG-UHFFFAOYSA-N	439.516	1.964	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(OC(C)C)c(NC(=O)C(=O)NN=c2cc[nH]cc2)c1	783376147	IBBFMXWRNXRZBG-UHFFFAOYSA-N	449.533	1.403	50	20	IDGD	
C[C@H](c1cccc(NC(=O)C(=O)NNc2ccc(-n3cccn3)nn2)c1)N1CCOCC1	783433654	WXLXDGJIYBKBRI-OAHLLOKOSA-N	436.476	1.137	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)N[C@@H]1CCC[C@@H]2CN(Cc3ccccc3)C[C@@H]21	784264057	VKSOTRKUJTYVFS-CEXWTWQISA-N	439.516	1.641	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)N[C@@H]1CCC[C@H]2CN(Cc3ccccc3)C[C@H]21	784264060	VKSOTRKUJTYVFS-IPMKNSEASA-N	439.516	1.641	50	20	IDGD	
COCC[S@@](=O)Cc1cccc(NC(=O)C(=O)NNc2cccc([N+](=O)[O-])c2C)c1	784358766	YVILZCBGMDFTTH-SSEXGKCCSA-N	434.474	1.880	50	20	IDGD	
CCNC(=O)N1CCc2ccc(NC(=O)C(=O)NNc3cccc(C(=O)OC)c3)cc21	784854192	DIQGBNPUIPUDLF-UHFFFAOYSA-N	425.445	1.647	50	20	IDGD	
O=C(NNc1ncc(F)cn1)C(=O)Nc1ccnn1Cc1ccc(Br)cc1	784950243	VUQNHUBEGSXWAQ-UHFFFAOYSA-N	434.229	1.705	50	20	IDGD	
Cn1ccnc(NNC(=O)C(=O)Nc2ccc(-c3n[nH]c(-c4ccccc4)n3)cc2)c1=O	785090138	OCLXMUNBGORNFL-UHFFFAOYSA-N	430.428	1.314	50	20	IDGD	
COCC[C@@H](NC(=O)C(=O)Nc1ccccc1S[C@@H](Cl)C(F)(F)F)C(N)=O	785285899	NMKIBRIDIWANEY-YMTOWFKASA-N	427.832	1.851	50	20	IDGD	
CC(C)C(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)cc1	789811416	ZLEMNVXPKJBZCB-OALUTQOASA-N	438.484	1.940	50	20	IDGD	
COc1ccc(C(=O)NNc2nccc(N3CCOCC3)n2)c(OCCOC(C)C)c1	789904365	GZBPBIIBQPABBB-UHFFFAOYSA-N	431.493	1.883	50	20	IDGD	
C[C@H]1CCC2=S=C(C(=O)NNC(=O)C(=O)Nc3cc([C@@H]4CCCOC4)nn3C)C=C2C1	790951577	JHZOWXGYNDBZCG-QWHCGFSZSA-N	445.545	1.238	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H](OC)C2CC2)c1	792010895	BSAHJGRJDRNVKZ-SFHVURJKSA-N	433.486	1.682	50	20	IDGD	
C[C@](O)(Cn1cc(C(F)(F)F)ccc1=O)C(=O)NNC(=O)c1cc(-c2ccccc2)[nH]n1	792014250	HXFWQPFDAAWCJA-IBGZPJMESA-N	449.389	1.469	50	20	IDGD	
N#Cc1ccc(C(=O)NNS(=O)(=O)c2ccc(C(=O)O)cc2OC(F)(F)F)cc1	792698339	MZLHERFOHNJBND-UHFFFAOYSA-N	429.332	1.778	50	20	IDGD	
Cc1cccc(C(=O)NNS(=O)(=O)c2cc(Br)cc(C(=O)O)c2C)n1	794599128	CPFBXSBIIZRWDG-UHFFFAOYSA-N	428.264	1.782	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)c2cnn(CCO)c2-c2ccccc2)cc1	794716886	GZJAIQBSQIIIGC-UHFFFAOYSA-N	429.502	1.550	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)[C@]2(C)CCN(C(=O)OCc3ccccc3)C2)C[C@@H](C)O1	794898432	FQNXYFNOCMJEBS-PMAPCBKXSA-N	446.548	1.682	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)c1cc([N+](=O)[O-])cc(S(C)(=O)=O)c1	795169447	PWQZPFDVDSESDJ-UHFFFAOYSA-N	442.475	1.006	50	20	IDGD	
COC(=O)c1cc(F)c(Br)cc1NC(=O)C(=O)NNC(=O)c1ccoc1	797002253	PCVJLTHXHMGHTK-UHFFFAOYSA-N	428.170	1.368	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)Nc2cc(S(=O)(=O)N3CCCC3)ccn2)cc1	797675389	RSAUMQJHEBHPKR-UHFFFAOYSA-N	449.489	1.106	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NC[C@H]2CCCN2C2CCCCC2)c2ccccc2c1=O	798118709	BYPWZAVUNJRKNK-MRXNPFEDSA-N	426.521	1.675	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)[C@@]23CCC(=O)N2c2ccccc2C(=O)N3C2CC2)cc1	802054424	OMFFTZDKZUTPJQ-HSZRJFAPSA-N	449.467	1.989	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1cccc(C#N)c1)C(=O)NNC(=O)Nc1ccc(N(C)C)cc1	802121264	WPMJUVPVKFNVBX-CYBMUJFWSA-N	430.490	1.144	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)c2cc(S(N)(=O)=O)oc2C)c(OC)cc1Cl	803395342	HMLQZHXIXGEGFA-UHFFFAOYSA-N	432.842	1.373	50	20	IDGD	
CCc1ccccc1OCCC(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	803965383	SUZGCCODGDWFNC-IBGZPJMESA-N	428.441	1.549	50	20	IDGD	
COCc1csc(NC(=O)C(=O)NNC(=O)COc2ccc(Br)cc2)n1	806974133	WRBABKYPCNVMEG-UHFFFAOYSA-N	443.279	1.217	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2ccc(F)c(N3CCCNC3=O)c2)n1	807024530	HXRFFAQVZVQKCZ-UHFFFAOYSA-N	444.471	1.463	50	20	IDGD	
CN1CCN(C(=O)NNC(=O)c2sccc2S(=O)(=O)NC2CCCCCC2)CC1	807381034	ZZXIYHUWKQDTFX-UHFFFAOYSA-N	443.595	1.351	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)[C@@H](c1ccccc1)N(C)C	807403968	FQPIUPWIJMMBCI-KXBFYZLASA-N	447.561	1.572	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNc3nccnc3C3CCC3)cn2)C[C@@H](C)O1	807460335	OAMIPHDKCHFDKI-OKILXGFUSA-N	425.493	1.835	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNc2ccc(-n3cccn3)nn2)cnn1-c1ccc(Cl)cc1	808938514	XTAAFZNAHJJUNX-UHFFFAOYSA-N	437.851	1.892	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@H]2CCCN(c3ccccc3)C2=O)c2ccccc2c1=O	814365029	WPPPPOWWAAKUIK-GOSISDBHSA-N	433.468	1.621	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCO1)C(=O)Nc1ccc(I)cc1Cl	815779394	DDOPWFADRMOCLS-SNVBAGLBSA-N	437.621	1.210	50	20	IDGD	
Cc1cccc(NNC(=O)CCC(=O)N2CCN(S(=O)(=O)c3ccccc3)CC2)c1	832686382	VDCVOQLQNLVOJP-UHFFFAOYSA-N	430.530	1.751	50	20	IDGD	
CCCn1c(C)cc(/C=C(\C#N)C(=O)N(CC)CC(=O)N[C@@H]2CCS(=O)(=O)C2)c1C	912663584	JUGPCUKJIVQCHC-WAGPWIPHSA-N	434.562	1.574	50	20	IDGD	
CCOc1ccc(N2C[C@H](C(=O)NNC(=O)CCN3C[C@H](C)O[C@@H](C)C3)CC2=O)cc1	912924614	BTNCGCORRSEEOB-YESZJQIVSA-N	432.521	1.085	50	20	IDGD	
CCc1ccc(C(=O)NNC(=S)NC(C)(C)C)cc1S(=O)(=O)N1CCOCC1	913901430	ZNACUQDZZPPMEE-UHFFFAOYSA-N	428.580	1.177	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)o2)cc1OC	914752271	ZRMOFDKDXSRMFT-UHFFFAOYSA-N	437.474	1.546	50	20	IDGD	
COc1ccccc1CCNC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	915903778	DCGAWGORTSCCBN-UHFFFAOYSA-N	425.533	1.780	50	20	IDGD	
O=C(COc1ccc(C(=O)c2ccc(Cl)cc2)cc1)NNC(=O)CN1CCCC1=O	916147974	QNYHHTLPDKJEHV-UHFFFAOYSA-N	429.860	1.720	50	20	IDGD	
COc1ccc(N2CCN(CCCNC(=O)NNC(=O)c3ccccc3O)CC2)cc1	916198016	FWZOPZPQKJWSOT-UHFFFAOYSA-N	427.505	1.557	50	20	IDGD	
O=C(CN1CCC(NC(=O)NNc2ccc(-n3cccn3)nn2)CC1)Nc1ccccc1	916237064	RUOQOADKXVXCCF-UHFFFAOYSA-N	435.492	1.392	50	20	IDGD	
C[C@H](CN1CCOCC1)NC(=O)NNC(=O)[C@@H](C)Oc1cccc(Br)c1	916470107	JKVMDPZYJURHDY-CHWSQXEVSA-N	429.315	1.268	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CNC(=O)c2ccccc2OC(F)F)cc1C	916562986	XJGMBDJSDQPGTC-UHFFFAOYSA-N	434.399	1.421	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)c1	916606270	BZIMLKNFYJDVNV-GOSISDBHSA-N	430.530	1.699	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCC(=O)NCc1ccccc1	916636030	NSWWROAGSBCSAO-CYBMUJFWSA-N	449.305	1.863	50	20	IDGD	
CSCC[C@@H](NC(=O)COc1ccccc1)C(=O)NNC(=O)c1ccc(Cl)nc1	917252036	REAZNCLOJFYPAR-OAHLLOKOSA-N	436.921	1.813	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@H](C)S(=O)(=O)c2ccc(F)cc2)c2ccccc2c1=O	917915011	FWUYEDAMDGAZOI-LBPRGKRZSA-N	446.460	1.179	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(OC)c(C(=O)NNC(=O)c2ccc(C)cc2O)c1	918338908	FPTJAOPJUUXQJF-UHFFFAOYSA-N	435.502	1.815	50	20	IDGD	
CCCn1c(C)cc(/C=C(/C#N)C(=O)N2CCN(C(=O)CN3C(=O)CCC3=O)CC2)c1C	918701528	CWWRWYMLFBWMSY-UYRXBGFRSA-N	439.516	1.242	50	20	IDGD	
Cc1nn(-c2ccc(C(=O)NNC(=O)N[C@H]3CCS(=O)(=O)C3)cc2)c(C)c1Cl	919883919	GKVZTIBBKPRPNX-ZDUSSCGKSA-N	425.898	1.274	50	20	IDGD	
COC(=O)N1CCC(NC(=O)NNC(=O)[C@@H](C)Oc2cccc(Br)c2)CC1	920052102	YGBDAEHIZFQIOM-LLVKDONJSA-N	443.298	1.778	50	20	IDGD	
CCOC(=O)CNC(=O)/C(C#N)=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	920853661	DJXKPTZZMAOTTQ-ZROIWOOFSA-N	429.864	1.665	50	20	IDGD	
C[C@@H]1CCCN(Cc2csc(NC(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)n2)C1	920931978	LQLNWSWUYLGKAQ-CYBMUJFWSA-N	441.521	1.817	50	20	IDGD	
O=C(N[C@H](Cc1ccccc1)C(=O)NNC(=O)[C@@H]1COc2ccccc2O1)c1cccnc1	921299405	RNBQCNVCEBMPOR-NQIIRXRSSA-N	446.463	1.410	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)N[C@@H]2CCC[C@H](S(C)(=O)=O)C2)CC1	1318801335	RWQJJBJJSVGODI-CABCVRRESA-N	446.570	1.320	50	20	IDGD	
COC(=O)c1cccc([C@H](NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)C(=O)OC)c1	1319674968	DJWBEJVZQNSLLD-KRWDZBQOSA-N	449.504	1.955	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)c2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cn1	1332497016	LZYSDAHDQIGXNW-AWEZNQCLSA-N	428.518	1.423	50	20	IDGD	
CCCCS(=O)(=O)N1CCC[C@@H]1C(=O)NNC(=O)c1ccc(Br)cc1	1337446248	LGBHNDLAEDLMDY-CQSZACIVSA-N	432.340	1.804	50	20	IDGD	
CCn1nc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](O)CCl)C3)c2ccccc21	1777765414	BCKSADLRUPEWNS-JBYIUTFZSA-N	448.951	1.783	50	20	IDGD	
CN1CCN(CC(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)C(C)(C)CCl)C3)CC1	1778845915	GJLVWOITWROXAK-DYESRHJHSA-N	429.005	1.013	50	20	IDGD	
C[C@H](Nc1nccs1)C(=O)N1CCO[C@@]2(CCN(C(=O)CO[Si](C)(C)C)C2)C1	1779295643	VBEGNIMEVBPQNH-KBXCAEBGSA-N	426.615	1.625	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3c(-c4ccncn4)noc3C)C2)C1	1780049619	RRISOBHVRDIGLP-VLIAUNLRSA-N	433.896	1.901	50	20	IDGD	
COCCOCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@](C)(Cl)CCl)C1	1780713528	WSTCNSPWCBWOHK-ZTFGCOKTSA-N	425.353	1.400	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CN1CCCCC1=O)C2	1780714375	BNQUNUFHLSUWSM-UIAACRFSSA-N	448.391	1.749	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cccc(S(C)(=O)=O)c3)CCO2)C1	1781211453	UWDQHIPVTDDCET-VQIMIIECSA-N	428.938	1.551	50	20	IDGD	
COc1cccc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](F)Br)C3)C2)c1F	1781335016	RATGDHXUMJXZAT-WMLDXEAASA-N	433.249	1.968	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C2(C(=O)OC)CC2)C1	1781813842	PHVVAPBNNHXWLA-HBUWYVDXSA-N	445.354	1.627	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)Cc3ccc(F)cn3)CCO2)C1	1783343246	RKZFZSYILYEJMQ-QAPCUYQASA-N	428.302	1.767	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc4ccnn4c3)CCO2)C1	1783351495	BFBIJZFTKCBFKT-LPHOPBHVSA-N	435.322	1.951	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](C)NNc1ccccc1)CCO2	1783528086	JJFAJQHYMSWXJO-QMTMVMCOSA-N	439.354	1.605	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)/C=C3\C(=O)Nc4ccccc43)CCO2)C1	1783534514	VNZJDAKVSANQQR-HKGQPFLSSA-N	448.317	1.635	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)CCc3cnc4[nH]ccc4c3)C2)C1	1783679120	YEBGYCCTHNTPQD-UWJYYQICSA-N	434.924	1.579	50	20	IDGD	
COc1cccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]3C2)n1	1783970370	YAZLPDYLSMUQOI-YXWQFLTLSA-N	440.338	1.715	50	20	IDGD	
O=C(Cn1ccc2c(F)cccc21)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21	1784040478	QFEPFRDIIYVQOV-BMIPRAEKSA-N	437.899	1.360	50	20	IDGD	
CC(=O)NCC(C)(C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)CBr)C[C@@H]21	1784640315	CDTMRTKAYBOCGF-TUUVXOQKSA-N	446.386	1.159	50	20	IDGD	
CN(C)c1cncc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]32)c1	1785554713	FHAQPOUBMRBTNC-FDRFZEDHSA-N	443.375	1.977	50	20	IDGD	
COc1nn(C)cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)CBr)C[C@@H]21	1785860558	PLHGGFSXYHTLFS-ABHRYQDASA-N	443.342	1.053	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3C=CCN3)[C@H]2C1	1787403598	NJNPSRGBVCCLOR-SNVXUZMMSA-N	442.466	1.379	50	20	IDGD	
O=C(Cc1ccc(Br)nc1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Cl)C[C@@H]21	1789678971	KNJVCLCROUYLIB-WFGGJUAMSA-N	448.720	1.901	50	20	IDGD	
CC[C@H](O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C(C#N)=C/c3ccc(F)cc3F)[C@H]2C1	1790693572	KPVKXUBWQTXEKY-KNTDACPZSA-N	433.455	1.622	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc4nc[nH]c34)C[C@@H]21	1791057164	FYJIMCJCRCWRJF-DSPQJCBJSA-N	435.322	1.940	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(OC)c3F)C[C@@H]21	1791255993	AVZZPMIOFZKGHF-QEWYBTABSA-N	428.888	1.681	50	20	IDGD	
CCOc1ncccc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)CBr	1792867133	XZVODVBSHGTREH-AYDFFVQHSA-N	440.338	1.715	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1cc(F)ccn1)C2	1792868798	PNJHGHADIZPNBU-FLTUCWPJSA-N	442.329	1.774	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)CBr	1792872297	XGWOHZWHAVHETR-NGDQXYMTSA-N	426.149	1.390	50	20	IDGD	
COc1ccc2nc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@H](O)CCl)ccc2c1	1792978054	BERFFNOJTSUKJC-GTYSZEQSSA-N	433.892	1.046	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)COc1ccc(F)cc1	1795198140	LOSXPYJORIQGRF-VLWCASSMSA-N	443.313	1.968	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1ccc(F)c(F)c1	1795712410	PAYABLPBBOBAGY-QDMKHBRRSA-N	443.454	1.458	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)c1cccc2nscc12	1796189399	HTFYYOVVZJSGPB-BJWYYQGGSA-N	435.314	1.542	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc([N+](=O)[O-])cc3c1OCC3)C2)[C@@H](F)Cl	1796366470	WGUISNYLOUOZKJ-YHYOWMERSA-N	427.816	1.267	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CCc3ccccc3[C@H]1O)C2	1797953978	ZOHMIWNSPQBWJE-IZHZWAPYSA-N	446.620	1.724	50	20	IDGD	
COc1cc(C#N)cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CO[Si](C)(C)C)C3)c1	1798578480	SRHVKZXGLUUQQJ-XEMDLRDOSA-N	431.565	1.622	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc(OCF)cn1)C2	1799275939	GOYWGTUDEPAEOS-UOHMRFDXSA-N	435.283	1.222	50	20	IDGD	
Cc1c[nH]c(C)c1CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Br	1799343377	UDYNLDKZPITXDW-RMHZUWNSSA-N	430.318	1.844	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](NC(C)C)C(C)C)C2	1800640161	WWHGUULTOYYYQI-ZHCJQAHYSA-N	432.403	1.772	50	20	IDGD	
C[C@H](Oc1ccccn1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)Br	1800762918	KIPNCAALFKOODS-YMSVYLFOSA-N	426.311	1.222	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](O)CCNC(=O)OC(C)(C)C)C2	1802282519	FPKVRUVNSQCAAF-JKJDWNRSSA-N	447.960	1.154	50	20	IDGD	
CC[C@H](NC(C)=O)C(=O)NC[C@@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1	1802541048	IQKDSNQHSSNKDD-XYJFISCASA-N	439.354	1.787	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)Cn2nnc3ccccc32)[C@@H]1c1cccnc1)[C@H](O)CCl	1803136793	VIKLFBIGUJMLJR-QKYXUNIQSA-N	442.907	1.132	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)Cc2cccc(Cl)n2)[C@H]1c1cccnc1)[C@@H](O)CCl	1803141833	SIQLTNZLYIAKRN-QOKNQOGYSA-N	437.327	1.978	50	20	IDGD	
COc1ccc(Cl)c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)c1	1803507247	PUEMQOCBHFETDM-BJWYYQGGSA-N	442.708	1.594	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)C1=CCCS1	1803631948	BOYLYKNZVUBGTK-PXNSSMCTSA-N	437.330	1.102	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2cscn2)[C@@H]1c1cccnc1	1805748434	ODBIOZJKHWYTEI-KXBFYZLASA-N	430.534	1.231	50	20	IDGD	
CCNC(=S)NCC(=O)N1CC[C@H](CNC(=O)[C@H](Cl)CC)[C@@H]1c1cccnc1	1808277363	DFVBIOYGKKCJLG-INMHGKMJSA-N	425.986	1.589	50	20	IDGD	
C[C@H](CS(C)(=O)=O)C(=O)N1CCC2(CCCN(C(=O)CCBr)C2)CC1	1809065952	BAIKDXUIVQBEOP-CQSZACIVSA-N	437.400	1.683	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)C(Cl)Cl)[C@H]1c1cccnc1)c1n[nH]cc1[N+](=O)[O-]	1810638994	TVTYQVHNWAAMNU-MFKMUULPSA-N	427.248	1.836	50	20	IDGD	
COc1cc(C#N)cc(C(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)c1	1811407547	WOJQXVFPBYJMPL-PWIZWCRZSA-N	442.903	1.881	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)c1cnn2cccc(F)c12	1812280602	NQXJFCOMTXQZDT-WBAXXEDZSA-N	445.882	1.788	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)NC[C@@H]1CCN(C(=O)C(O)O)[C@H]1c1cccnc1	1812440576	LZJQFIGHRXOPHR-TWBVCCKASA-N	442.422	1.283	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2nccs2)[C@H]1c1cccnc1	1813070355	IAZJNDNJJQWOAN-QAPCUYQASA-N	430.534	1.231	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)COC(=O)C(F)(F)F)[C@H]1c1cccnc1)C(Cl)Cl	1813077400	ICMGGZBDJOBGCF-JQWIXIFHSA-N	442.221	1.997	50	20	IDGD	
COC(=O)CCCCCC(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1	1813137738	GGDXGTNFAQFQME-ABSDTBQOSA-N	439.940	1.811	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)C2CC(O)C2)[nH]n1	1818110870	REYDWDZZPCSCLT-BKEKHZTHSA-N	441.492	1.307	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnco2)[nH]n1	1818111015	YFSAXTRFNYTHGM-ZIFAQYRBSA-N	438.448	1.838	50	20	IDGD	
Cc1nccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)[nH]n2)n1	1818322939	IKUQXMZMDPSFTP-QGZVFWFLSA-N	449.475	1.126	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H]2CCCOC2)[nH]n1	1819404225	DVRHYSLZDLKGEK-SUMWQHHRSA-N	441.492	1.141	50	20	IDGD	
O=C([C@@H]1Cc2ccccc2CN1)N1CCC([C@@H]2CCCCN2C(=O)[C@H](O)CCl)CC1	1824182996	NCVTXUUXGDUJRP-PCCBWWKXSA-N	433.980	1.920	50	20	IDGD	
CC(=O)NCCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](C)CBr)CC2	1825232366	NUNLNJUZSRKTKR-GXSJLCMTSA-N	431.356	1.612	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)Cc1cccc(OC)n1)CC2	1825993616	LXMDZOFBDINBEV-OLZOCXBDSA-N	438.937	1.955	50	20	IDGD	
C[C@H](C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCBr)CC2)n1cncn1	1826787317	UOUXRCWBKWPBPO-NXEZZACHSA-N	427.328	1.693	50	20	IDGD	
CN[C@H](CC(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@](C)(Cl)CCl)CC1)C(=O)O	1826946804	ZTWFVDQRILSQLA-CLCXKQKWSA-N	436.380	1.905	50	20	IDGD	
O=C(Cc1ccccn1)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827052882	MLNCRGLYZSZOIU-JOCHJYFZSA-N	435.333	1.237	50	20	IDGD	
Cc1cc(CC(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)no1	1827055291	UAXLRJWCKXBVIT-NRFANRHFSA-N	439.321	1.139	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)C3CCSCC3)sc2C1	1828343935	KODALTIPJNJIHH-ZDUSSCGKSA-N	439.607	1.571	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CN2CC(=O)NC2=O)CC1	1830313846	ORHYWXNIUUYIFZ-KUHUBIRLSA-N	447.363	1.394	50	20	IDGD	
O=C([C@@H](O)CCl)N1CCO[C@]2(COCCN(C(=O)C3(c4ccccc4)CCC3)C2)C1	1830738496	PGDTWTOVNWGXJC-GHTZIAJQSA-N	436.936	1.164	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](CN)c3ccccc3)C2)C1	1831646143	IAAUFBVPAZFPBF-DXIQSLLYSA-N	437.968	1.593	50	20	IDGD	
Cc1n[nH]c(C)c1C(=O)N1CCC([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1	1831873407	JEESBTLABFNUIX-GOSISDBHSA-N	432.569	1.633	50	20	IDGD	
CC[C@H](C)[C@H](O)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](C)CBr)CC2)CC1	1833264725	JDEGDBRHMWIUGQ-MPGHIAIKSA-N	446.430	1.996	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3noc(C)c3C)CC2)CC1	1833605925	KAQPKQNYUMVXMA-QGZVFWFLSA-N	426.945	1.730	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3n[nH]c(C4CC4)c3F)CCO2)C1	1833677767	STRRIGYDGPEIKQ-VBKZILBWSA-N	442.919	1.904	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)C(=O)c3ccco3)CC2)CC1	1833757054	BUBGFEUJZOVLPK-ZDUSSCGKSA-N	440.338	1.817	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(O)cn3)CCO2)C1	1834589197	KUPZCWFQEZNZNL-RDTXWAMCSA-N	442.310	1.031	50	20	IDGD	
C=C[C@@H](O)C(C)(C)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)Br)CC2)CC1	1835717584	FDVSADCRIMNHHC-RHSMWYFYSA-N	444.414	1.915	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3cccnc3)CCO2)C1	1836182551	OVPSKPRELVJTSP-UXHICEINSA-N	444.359	1.707	50	20	IDGD	
CC[C@@H](Br)C(=O)NC1CCN(C2CCN(C(=O)Cc3cnc[nH]3)CC2)CC1	1836541927	NLDODSGOZKYVGU-QGZVFWFLSA-N	440.386	1.697	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)C[C@H](NC)C(=O)O)CC2)CC1	1836918631	BAWKRVXNVHWMOU-IRXDYDNUSA-N	431.961	1.455	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3[nH]nc4ncccc34)CC2)CC1	1838049589	BXISURWCVWXFAC-KRWDZBQOSA-N	449.939	1.824	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cc(O)nc(O)n3)CC2)CC1	1838081603	MHRXAUWNPMWCLT-CQSZACIVSA-N	426.901	1.517	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cn4cc(F)ccc4n3)C2)C1	1839146248	WWTPSVCVNPEXAO-MGPUTAFESA-N	438.887	1.561	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)Oc3ccccn3)C2)C1	1839149246	ZBWDNMMQLZJHIM-GUXCAODWSA-N	425.913	1.323	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1Cc3ccccc3N1)CCO2	1839733680	UUWDUERDRCBCSE-LQBOVUBWSA-N	435.952	1.887	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)CC(C)=O)C2)C1	1839966955	VBKOHNBTXZDPDU-XUWXXGDYSA-N	433.343	1.232	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccnc3S)C2)C1	1840029973	XARQSWOWFXVEOJ-PXAZEXFGSA-N	444.351	1.224	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)COC3CCCCC3)C2)C1	1840030448	MSCCYYSCJZMRHN-KXBFYZLASA-N	447.370	1.576	50	20	IDGD	
CCc1noc(C)c1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2	1840033324	ALJHLSDJFSVDBH-KZULUSFZSA-N	444.326	1.399	50	20	IDGD	
CCn1nc(C(C)C)cc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840188947	MRJMJUPTUUHTTD-IBGZPJMESA-N	447.363	1.900	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1cc3cccnc3[nH]1)C2	1843416311	VMYQIZPXHVWWHG-VULFUBBASA-N	433.472	1.514	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1ccc(-c3ncc[nH]3)cc1)C2	1844265470	GWFIZNOJFUMGBZ-UHFFFAOYSA-N	445.483	1.206	50	20	IDGD	
C[C@H]1Oc2ccc(C(=O)N3CC4(CCCN4C(=O)[C@@H](F)Br)C3)cc2NC1=O	1845218569	NHTGDQVUDUSGJU-QMTHXVAHSA-N	440.269	1.914	50	20	IDGD	
O=C1NC[C@@H](C(=O)N2CC3(CCCN3C(=O)[C@H](Br)Cc3ccccc3)C2)O1	1845940214	CZEBFLOJLGWQET-CABCVRRESA-N	436.306	1.304	50	20	IDGD	
C/C(=C\c1cccnc1)C(=O)N1CCCC12CN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2	1846595612	XMSBDYUTVFKGDG-OZVSRTATSA-N	434.500	1.822	50	20	IDGD	
CCOC(=O)N1CCC(C(=O)N2CCCC23CN(C(=O)CCBr)C3)CC1	1846977670	DHTWXQOTRIBCSK-UHFFFAOYSA-N	430.343	1.843	50	20	IDGD	
N#Cc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)c3ccccc3F)CC2)cc1	15426980	YTSBETFGDJJYHG-UHFFFAOYSA-N	430.461	1.559	50	20	IDGD	
O=C(CCc1ccccc1F)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	19172894	FRMQVTDZKRJSFR-UHFFFAOYSA-N	435.477	1.240	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)CN1C(=O)COc2ccc(Cl)cc21	24917291	IPWUSCFRJAYUGL-UHFFFAOYSA-N	433.848	1.691	50	20	IDGD	
CCOc1ccc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1OCC	104557959	JYHLZLGCHIMOLT-LJQANCHMSA-N	444.440	1.628	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)c2nnn(-c3cccc([N+](=O)[O-])c3)c2C)o1	109421723	FRKZOOXCEJPOOT-UHFFFAOYSA-N	441.448	1.994	50	20	IDGD	
CSCC[C@@H](NC(=O)c1ccc2ccccc2n1)C(=O)NNC(=O)c1cccn1C	116390078	DEOBPUSQMLQBIQ-QGZVFWFLSA-N	425.514	1.886	50	20	IDGD	
O=C(NCCc1cccs1)NNS(=O)(=O)c1ccc(N2CCCS2(=O)=O)cc1	726766747	JTJZLKYOCZZZHL-UHFFFAOYSA-N	444.560	1.023	50	20	IDGD	
Cc1ccc(C(=O)N2CCC(NC(=O)NNC(=O)COc3ccccc3C#N)CC2)cc1	727606653	SXEOGHYWBIDCLD-UHFFFAOYSA-N	435.484	1.881	50	20	IDGD	
O=C(CN1C(=O)COc2ccc([N+](=O)[O-])cc21)NNC(=O)c1cccc(OC(F)F)c1	728486819	LTMDQSPQNHZIFM-UHFFFAOYSA-N	436.327	1.383	50	20	IDGD	
COC(=O)CCc1c(C)nn(-c2ccc(C(=O)NNC(=O)Cc3cccnc3)cc2)c1C	728852593	IAKQYOKIFLPBOM-UHFFFAOYSA-N	435.484	1.993	50	20	IDGD	
CSCC[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)NNC(=O)c1scnc1C	729452976	SMGRQGISKQWJGN-ZDUSSCGKSA-N	437.503	1.672	50	20	IDGD	
CN(CCNC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)C(=O)OC(C)(C)C	729611296	MOAJRJXGIDBCNE-UHFFFAOYSA-N	448.568	1.396	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)CCCOc2ccc(S(C)(=O)=O)cc2)cn1	729691908	UNCNYVGAQPNFFE-UHFFFAOYSA-N	438.531	1.671	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2C(=O)c3ccc(C)cc3C2=O)cc1Br	732036035	RUFYPVUSHJTIFH-UHFFFAOYSA-N	446.257	1.823	50	20	IDGD	
COC(=O)c1cc(OC(=O)c2cccc(CN3CCS(=O)(=O)CC3)c2)ccc1[N+](=O)[O-]	732651626	OSDQVDOOSLLFQR-UHFFFAOYSA-N	448.453	1.831	50	20	IDGD	
CS(=O)(=O)N1CCC[C@H]1C(=O)NNC(=O)COc1ccccc1Cc1ccccc1	732960410	IOADEABDQPJRLY-SFHVURJKSA-N	431.514	1.228	50	20	IDGD	
CC(C)OCCCn1c(NNC(=O)CCn2ccccc2=O)nc2ccccc2c1=O	733265788	KUUAYOCTYCSWMK-UHFFFAOYSA-N	425.489	1.907	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)CN1CC(=O)Nc2ccccc21	733612494	SXEGASMXFKSOQO-UHFFFAOYSA-N	446.847	1.112	50	20	IDGD	
C[C@@H]1Oc2ccccc2O[C@@H]1C(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	734824503	AQPNNDKBPWTOTL-GUYCJALGSA-N	434.493	1.945	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	735116742	DGQFJBSVRSMOAM-AWEZNQCLSA-N	437.497	1.067	50	20	IDGD	
COc1cc(CC(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)ccc1C	735117337	RLEDNWPZGKISCC-UHFFFAOYSA-N	433.534	1.021	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2cc3ccc(Cl)cc3[nH]2)CC1	735117635	ZTQPUKNZJZJVLO-UHFFFAOYSA-N	448.936	1.909	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)c2cc(Br)ccc2I)cn1	735446151	ZKCLPJRWLJQZHK-UHFFFAOYSA-N	449.046	1.862	50	20	IDGD	
O=C(NNc1ccc(Cl)nn1)c1ccc(Cl)c(S(=O)(=O)NC[C@H]2CCCO2)c1	735687711	VXKXJWIRGSSACM-LLVKDONJSA-N	446.316	1.998	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)NC2CCN(C[C@H]3CCOC3)CC2)cc1	737055713	FEWVWJNWFOWLDI-IAGOWNOFSA-N	434.537	1.684	50	20	IDGD	
COc1ccc(S(=O)(=O)CCC(=O)NNC(=O)Cc2c[nH]c3ccccc23)cc1OC	740813441	ITRLOUXJTOYOKW-UHFFFAOYSA-N	445.497	1.739	50	20	IDGD	
CC(C)CNC(=O)N1CCC[C@H](CC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)C1	741186536	JCLZHZJXYBEXLX-QGZVFWFLSA-N	445.568	1.308	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(CC(=O)NNC(=O)Cc2ccc3ccccc3c2)C(=O)C1	741283691	ZUQWVCQQSQKTPK-UHFFFAOYSA-N	440.500	1.609	50	20	IDGD	
Cc1cc(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc(C)c1F	742025441	MXVGWMRMZNKDGC-UHFFFAOYSA-N	429.495	1.316	50	20	IDGD	
CCOC(=O)c1cc(S(=O)(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)ccc1F	743268063	BLRKLODOUWSOQD-UHFFFAOYSA-N	427.366	1.240	50	20	IDGD	
Cn1cc([C@@H](O)CNC(=O)NNC(=O)[C@@H]2Cc3ccccc3CN2Cc2ccccc2)cn1	743574702	WKSOXADXCCWMOO-VXKWHMMOSA-N	448.527	1.411	50	20	IDGD	
Cc1nc2ccnn2c(C)c1CCC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	743829195	GAVPNUGCXOFOMM-UHFFFAOYSA-N	430.490	1.535	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CN2CCN(C(=O)c3c(F)cccc3F)CC2)c1	744396637	NRRXBEXQMHIXCC-UHFFFAOYSA-N	427.411	1.055	50	20	IDGD	
Cc1ccccc1NC(=O)NNC(=O)c1cc(S(N)(=O)=O)c(Br)s1	744471300	NXSYWSAWAWSSKY-UHFFFAOYSA-N	433.309	1.933	50	20	IDGD	
C[C@@H](NC(=O)OC(C)(C)C)C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	744620619	IVVIFWVTVKRIOV-CYBMUJFWSA-N	428.511	1.064	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)c2cc([N+](=O)[O-])ccc2Br)cc1	744915119	JNGQLWUQUHHDAE-UHFFFAOYSA-N	447.201	1.847	50	20	IDGD	
Cc1ccc(C)n1-c1ccc(C(=O)NNC(=O)NCCCN2CCC[C@@H](C(N)=O)C2)cc1	745830271	NLWVLKYQHVMIQA-LJQANCHMSA-N	440.548	1.626	50	20	IDGD	
NC(=O)COc1cccc(CNC(=O)NNC(=O)c2ccc(F)cc2Br)c1	745900361	VRBLHDOTAVDUNZ-UHFFFAOYSA-N	439.241	1.597	50	20	IDGD	
Cc1nc(C(=O)NNC(=O)c2ccc(Cl)cc2F)nn1-c1n[nH]c(C(F)(F)F)n1	747432283	ZUIHMNXEEZLLPN-UHFFFAOYSA-N	432.725	1.580	50	20	IDGD	
Cc1c(Cl)cc(C(=O)O)cc1S(=O)(=O)NNC(=O)[C@@H]1COc2ccccc2O1	747595870	IMSSYKSANHGTQB-AWEZNQCLSA-N	426.834	1.496	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)NCC(=O)N2CCN(c3ccccc3)CC2)c2ccccc21	749220100	HWJYJTIXSQEFGS-UHFFFAOYSA-N	434.500	1.471	50	20	IDGD	
CCOc1ccc(N2C[C@H](C(=O)NNC(=O)CNC(=O)c3cccs3)CC2=O)cc1	751211797	VFJUIVHJYDRANL-CYBMUJFWSA-N	430.486	1.077	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)N[C@H]2CCCN(c3cccnc3)C2=O)cc1	753356093	JIJTWMBYSJILFO-INIZCTEOSA-N	446.489	1.016	50	20	IDGD	
C[C@H](C[S@](C)=O)NC(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	753359676	RJIKPOZLXIWXMV-YSVRNHBLSA-N	441.513	1.156	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)C(=O)Nc2cnn(CCC(C)C)c2C(C)C)c1	753839703	CQSFFOFXZBUGHX-UHFFFAOYSA-N	443.508	1.806	50	20	IDGD	
NS(=O)(=O)c1cccc(NC(=O)NNC(=O)c2cc(Br)ccc2O)c1	756507064	ABZILJGJVFVRTM-UHFFFAOYSA-N	429.252	1.269	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	756524444	JGOIPKLVJWMKFV-INIZCTEOSA-N	448.501	1.756	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@@H](C)C(=O)NNC(=O)Nc1ncn(CC(=O)N(C)C)n1	756770005	HMFHIBHCQHCDDL-LBPRGKRZSA-N	437.888	1.257	50	20	IDGD	
CC(=O)N1CC[C@H](NC(=O)NNC(=O)c2csc(N3CCOCC3)n2)c2ccccc21	757003499	PCGMROKYYCWIJR-HNNXBMFYSA-N	444.517	1.422	50	20	IDGD	
CN(C)C(=O)c1cc(NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)ccc1F	757609871	DUIQZMCNOWDGGB-UHFFFAOYSA-N	426.408	1.241	50	20	IDGD	
O=C(NNC(=S)NC[C@H]1CCCCO1)c1cccc(S(=O)(=O)N2CCCCC2)c1	758171361	FTRPMPYMMZBSIA-MRXNPFEDSA-N	440.591	1.539	50	20	IDGD	
CSCC[C@@H](NC(=O)c1ccccc1Cl)C(=O)NNC(=O)C(=O)Nc1ccccn1	758840603	KSOJQBWNXOVAFT-CQSZACIVSA-N	449.920	1.373	50	20	IDGD	
Cc1nnc(-c2ccc(C(=O)OCC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)cc2)o1	758976853	ZTCITLVRHOEWKE-UHFFFAOYSA-N	425.357	1.571	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)c2ccc(-n3ccnn3)cc2)CC1	760385114	AAXGRXLPPPMISR-UHFFFAOYSA-N	429.481	1.611	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)CSc1nnnn1CC(F)(F)F	762409620	QXVYSPWDBZAZJE-UHFFFAOYSA-N	436.441	1.276	50	20	IDGD	
O=C(O)c1cc(Br)cc(S(=O)(=O)NNC(=O)c2ccc(Cl)nc2)c1	762468739	XKDFBUREOAHOLR-UHFFFAOYSA-N	434.655	1.819	50	20	IDGD	
Cc1sc(=O)n(CC(=O)NNc2nccc(N3CCOCC3)n2)c1-c1ccc(F)cc1	762850028	BMOVGKMBXMTELE-UHFFFAOYSA-N	444.492	1.794	50	20	IDGD	
CC(C)(C)OC(=O)N1CCc2ccc(NC(=O)C(=O)NNC(=O)c3ccncc3)cc2C1	763463931	IAQILKNEFCIWBB-UHFFFAOYSA-N	439.472	1.775	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2cccnc2OCC(F)F)c1	763574942	MKOCVZPHVAFMLB-UHFFFAOYSA-N	428.417	1.273	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cccc(Cn3nc4ccccn4c3=O)c2)c(C)o1	763585837	HCNNUUSJDPCPKR-UHFFFAOYSA-N	448.439	1.154	50	20	IDGD	
Cc1nnc(-c2ccc(NC(=O)C(=O)NNC(=O)c3cc(-c4ccccc4)[nH]n3)cc2)o1	763614171	SISGZMYUTZCPLU-UHFFFAOYSA-N	431.412	1.835	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cccc(-c3nncn3C)c2)c2ccccc2n1	763614579	GPMOJZBJWMSNQJ-UHFFFAOYSA-N	429.440	1.738	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)cc1OCC	763682054	QNGUECUHEJYBBG-UHFFFAOYSA-N	426.429	1.521	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)C(=O)Nc1ccccc1OCC(F)(F)F	763682103	XCZZZFYKWSZAOX-UHFFFAOYSA-N	429.326	1.932	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)C(=O)Nc1cnc2c(c1)CCCC2	763694371	GGSFXAGVQUVPIR-UHFFFAOYSA-N	447.289	1.888	50	20	IDGD	
C[C@@H]1COCCN1c1ccc(NC(=O)C(=O)NNC(=O)c2cccc(N(C)C)c2)cc1	763754534	UTXIFCKMYLADBH-OAHLLOKOSA-N	425.489	1.377	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)C(=O)Nc2ccc(Cl)c(Cl)c2)c2ccccc2c1=O	763789769	COCJEIBBURCSJF-UHFFFAOYSA-N	434.239	1.640	50	20	IDGD	
COc1cc(F)ccc1NC(=O)C(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12	763790717	NLODJBKSWYHZCF-UHFFFAOYSA-N	441.419	1.525	50	20	IDGD	
CSCCc1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])cc1	763802925	CEERZACDVBJUKB-UHFFFAOYSA-N	432.458	1.665	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cnccc1-c1cccc(F)c1	763807653	PSUBMSSPFKUWKB-UHFFFAOYSA-N	433.399	1.924	50	20	IDGD	
Cc1cccc(Cn2nccc2NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)c1	763841385	QWZDAVQGMDPJAJ-UHFFFAOYSA-N	425.420	1.544	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cnc3c(c2)CCCC3)cc1	763861173	MOHXMBSPSZSZQJ-AWEZNQCLSA-N	426.473	1.913	50	20	IDGD	
Cc1cc(S(C)(=O)=O)ccc1NC(=O)C(=O)NNC(=O)c1cn(C)c2ccccc12	763981141	FVFYCJRYTMBUHK-UHFFFAOYSA-N	428.470	1.290	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1ccc(-n2ccnc2C)nc1	764012196	OGHJCQXPDSQEKC-UHFFFAOYSA-N	428.836	1.637	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])o1	764043865	YSAVVYMUPFIIMP-LLVKDONJSA-N	434.430	1.438	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc(OCCN(C)C)c(Cl)c1	764047026	ALYJNPZELPXEPK-UHFFFAOYSA-N	434.880	1.689	50	20	IDGD	
CCN(CC)Cc1cccc(NC(=O)C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c1	764078439	UVRYUIKWRYEYMO-UHFFFAOYSA-N	446.529	1.332	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cccc(-n4ccnn4)c3)n[nH]2)cc1	764111719	SDYPCZZCIZVUNM-UHFFFAOYSA-N	430.428	1.366	50	20	IDGD	
CS(=O)(=O)c1c(F)cc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)cc1F	764127052	RONNMVHQWVKZCC-UHFFFAOYSA-N	447.803	1.127	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cnn(-c3ccccc3F)c2)o1	764138739	JCVNJLKFLSXDJL-UHFFFAOYSA-N	442.451	1.846	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2O1)C(=O)Nc1ccc(OC[C@H]2CCCO2)cc1	764154336	PKZZLIWIPUODOR-MJGOQNOKSA-N	425.441	1.334	50	20	IDGD	
COC(=O)[C@H]1CCCCN1C(=O)c1cccc(NC(=O)C(=O)NNC(=O)CC(C)(C)C)c1	764198630	MFHKAFFVYNLCPN-MRXNPFEDSA-N	446.504	1.376	50	20	IDGD	
CCN(CC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)Cc1ccc(C(=O)N(C)C)cc1	764236229	UQJBRBDRFLERMZ-UHFFFAOYSA-N	427.461	1.580	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c2cccnc12	764261039	WATNFFMWAARNJU-UHFFFAOYSA-N	433.472	1.336	50	20	IDGD	
CN(C)CC1CCN(c2ccc(NC(=O)C(=O)NNC(=O)Cc3ccccn3)cc2)CC1	764263242	CEHKMLKEPASDGY-UHFFFAOYSA-N	438.532	1.188	50	20	IDGD	
Cc1ccc(Cn2nccc2NC(=O)C(=O)NNC(=O)COc2ccccc2O)s1	764277809	HRLWNLCDZOKENX-UHFFFAOYSA-N	429.458	1.172	50	20	IDGD	
Cn1cnc2cc(NC(=O)C(=O)NNC(=O)c3cc(Br)ccc3O)ccc21	764280656	RCYLCHPFHLDANH-UHFFFAOYSA-N	432.234	1.441	50	20	IDGD	
CNC(=O)Cn1ccc2ccc(NC(=O)C(=O)NNC(=O)C(C)(C)c3ccccc3)cc21	764310150	ZYXBELOCWBUJFT-UHFFFAOYSA-N	435.484	1.451	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)C(=O)Nc2cc(Br)cc(C(F)(F)F)c2)cn1	764358945	KQFAZUZYRVOYPJ-UHFFFAOYSA-N	434.172	1.601	50	20	IDGD	
CS(=O)(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)c1	764389146	ZZRATJKKEWLTAU-UHFFFAOYSA-N	445.432	1.019	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)C(=O)Nc2ccc3oc(C(C)(C)C)nc3c2)c1	764434293	TZNFNYMANFNGET-UHFFFAOYSA-N	438.444	1.878	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)[C@H](C)NS(=O)(=O)c1ccc(C#N)cc1	764635731	NPDYWILUZRHEGC-NSHDSACASA-N	436.877	1.348	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ccc(C)o2)cc(Br)c1F	764665436	ZSDBEYDMKKVLKR-UHFFFAOYSA-N	442.197	1.676	50	20	IDGD	
CC(C)(C)OC(=O)CCC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	764939247	NQXFZIYNDDQYBR-UHFFFAOYSA-N	439.534	1.744	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cc(-c3cc(C)ccc3C)[nH]n2)ccc1OCC(N)=O	765575328	HBUGWWJMLSPKGV-UHFFFAOYSA-N	437.456	1.641	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)c1	765755517	IASKSMXTSDEFNB-UHFFFAOYSA-N	446.935	1.936	50	20	IDGD	
CC(C)(C)OC(=O)NCC1(CC(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)CCCCC1	766156637	SERMUZZWIWTWTB-AWEZNQCLSA-N	446.570	1.369	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NC[C@H]1[C@H]2c3ccccc3C[C@H]21	767926168	BHNLMRJZWQZBQH-BBWFWOEESA-N	427.530	1.818	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)c2ccc(-n3cncn3)c([N+](=O)[O-])c2)n[nH]1	768273291	CDLAPCNSWWNPRI-UHFFFAOYSA-N	448.399	1.649	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)COc1cccc(N2CCCC2=O)c1	768630291	QAVFUJVDRQDILL-UHFFFAOYSA-N	433.486	1.748	50	20	IDGD	
CSCCNC(=S)NNC(=O)c1cc(S(=O)(=O)N2CCCC2)ccc1Cl	769776827	HLFZUBKLVWBLEO-UHFFFAOYSA-N	437.012	1.596	50	20	IDGD	
CSCCNC(=S)NNC(=O)CN(C)C(=O)c1ccc(Br)s1	770246989	KYGJGNWKKCDZJC-UHFFFAOYSA-N	425.399	1.441	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N2CCO[C@@H](COC(C)C)C2)cc1Br	770403798	LVDDEKQIUVROIM-CYBMUJFWSA-N	430.299	1.938	50	20	IDGD	
COC(=O)c1cn([C@H]2CCN(C(=O)NNC(=O)[C@H](C)Oc3cccc(Cl)c3)C2)nn1	770648492	RNHMJZYKLCCDGD-AAEUAGOBSA-N	436.856	1.173	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)C3=NN(Cc4ccccc4)C(=O)CC3)nc21	770965226	IHLPYLLVNJLMEM-UHFFFAOYSA-N	436.476	1.909	50	20	IDGD	
COCCCS(=O)(=O)NCC(=O)NNc1nnc(-c2ccccc2)n1-c1ccccc1	770967126	WTMGTMWPGNOIIP-UHFFFAOYSA-N	444.517	1.333	50	20	IDGD	
COc1ccccc1[C@@]1(C)NC(=O)N(CC(=O)NNC(=O)c2cc3ccccc3o2)C1=O	771272804	DFQKUGPRVCGJOI-JOCHJYFZSA-N	436.424	1.670	50	20	IDGD	
O=C(NNc1ccc(Br)c(F)c1)[C@H]1CC(=O)N(CCN2CCOCC2)C1	771681263	IIDMHRANFVSWMN-LBPRGKRZSA-N	429.290	1.212	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1ccccc1NC(=O)NC(C)C	771807816	KPUGKFMMVAWGLY-UHFFFAOYSA-N	446.533	1.893	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)[C@H]1CCCN(C(=O)NC2CCCC2)C1	772889537	QOLYLRORGSBXLR-HNNXBMFYSA-N	449.939	1.468	50	20	IDGD	
Cn1nc(-c2cc(F)cc(F)c2)cc1NC(=O)C(=O)NNC(=O)COCc1ccccc1	773547618	WOAXZGMRJFQLCP-UHFFFAOYSA-N	443.410	1.668	50	20	IDGD	
C=CCN(C)S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2)cc1	773640035	SKJQOEOXNABSLZ-UHFFFAOYSA-N	433.446	1.483	50	20	IDGD	
NC(=O)C1CCN(Cc2cccc(NC(=O)C(=O)NNc3ccc([N+](=O)[O-])cc3)c2)CC1	773644160	JZWYYGXDXBUIAM-UHFFFAOYSA-N	440.460	1.374	50	20	IDGD	
CN(C1CC1)S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccccc2[N+](=O)[O-])cc1	773655390	NPMGXWFABVAVAN-UHFFFAOYSA-N	433.446	1.460	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2cnc3ccccc3n2)cc1	773722899	PFEFFVLDLQDIEX-UHFFFAOYSA-N	442.501	1.742	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)NC[C@@H]2COC3(CCOCC3)O2)N(C)c2ccccc21	777505453	KICQHRNGPBKWQW-MRXNPFEDSA-N	440.500	1.695	50	20	IDGD	
O=C(CN1CCNC(=O)[C@@H]1c1cccc(Br)c1)NNC(=O)c1ccccc1	777716802	MWCQJOMFCPMBIN-KRWDZBQOSA-N	431.290	1.383	50	20	IDGD	
O=C(CCc1nc(-c2ccco2)no1)N1CCN(S(=O)(=O)CBr)CC1	777777407	IIEITDCIBHOVKV-UHFFFAOYSA-N	433.284	1.089	50	20	IDGD	
C[C@@H]1CCN(C(=O)OC(C)(C)C)[C@H](C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)C1	778296257	VCKCHTMPEBKDQX-CJNGLKHVSA-N	443.504	1.730	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1cc2c(cc1F)NC(=O)CC2	778714823	UIZSTPZQPZMCLP-UHFFFAOYSA-N	446.460	1.597	50	20	IDGD	
CCC[C@@H]1C[C@@H](C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)CCO1	779713072	KCKUHDUUKFPCAF-DLBZAZTESA-N	439.534	1.064	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2c[nH]nc2-c2ccsc2)cc1	780171919	UQVFUDCDTVNUFY-UHFFFAOYSA-N	433.515	1.528	50	20	IDGD	
N#C/C(=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)NCCn1ccnn1	782829302	JGIWBFGVQPNGTD-PTNGSMBKSA-N	438.879	1.394	50	20	IDGD	
CN(Cc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(O)cc2)c1)C(=O)C(F)(F)F	782831436	RLFCLVASAWUNMA-UHFFFAOYSA-N	438.362	1.313	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)cc1)C(=O)Nc1ccc(N2CCOCC2)c2ccncc12	782831745	GKHLGQGWJBPPOJ-UHFFFAOYSA-N	435.440	1.177	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C(=O)Nc2ccc3c(c2)OC(F)(F)O3)nc2ccccc21	782885389	KNJWWTANEFYKEP-UHFFFAOYSA-N	431.355	1.223	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)C(=O)Nc1cccc(C(F)(F)F)c1	782896339	FQXIPQOKLVCIAT-UHFFFAOYSA-N	443.407	1.398	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NN=c2cc[nH]cc2)cc1S(=O)(=O)N(CC)CC	783376768	PHZKVADHBIHEKH-UHFFFAOYSA-N	435.506	1.015	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2ccc(S(=O)(=O)N3CCC(C)CC3)cc2)ncn1	783945167	UXUUVEHEBFSBFO-UHFFFAOYSA-N	432.506	1.287	50	20	IDGD	
Cc1ccc(NNC(=O)C(=O)Nc2cc(C)nn2[C@H]2CCN(Cc3ccccc3)C2)nn1	783953561	XVRMKDYAOBJOGQ-SFHVURJKSA-N	434.504	1.819	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)[C@@H]3CC=CC[C@@H]3C(=O)N3CCOCC3)nc21	784400651	ZKHRYSOGCURYNP-KGLIPLIRSA-N	443.508	1.171	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccc(F)c(F)c2F)cc1	784810885	LAJSJEOEPFRWJO-UHFFFAOYSA-N	446.407	1.110	50	20	IDGD	
CS(=O)(=O)CCOc1ccc(Cl)cc1NC(=O)C(=O)NNc1cccnc1Cl	784842328	OTSIDWBPXXXDES-UHFFFAOYSA-N	447.300	1.894	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNc2ccnc(N(C)C)n2)ccc1NC(=O)OC(C)(C)C	784969853	RDNYLNRKTXMXEU-UHFFFAOYSA-N	445.480	1.980	50	20	IDGD	
CN1CCC(n2ccc(NC(=O)NNC(=O)C3CCN(c4ncccn4)CC3)n2)CC1	786714429	FVBWUACBMDUVBE-UHFFFAOYSA-N	427.513	1.009	50	20	IDGD	
COc1cc(Br)ccc1[C@@H](C)NC(=O)NNC(=O)C(=O)Nc1ccccn1	786930054	QQLQFZMAQJWKMF-SNVBAGLBSA-N	436.266	1.883	50	20	IDGD	
CCNC(=O)Nc1ccc(C)c(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)c1	787541012	IFYQCGOPLWKITD-UHFFFAOYSA-N	447.879	1.955	50	20	IDGD	
Cc1cc(=O)c(C(=O)NNC(=O)N2CCN(C)CC2)nn1-c1cccc(C(F)(F)F)c1	788166211	JZHZUMLESCEVQX-UHFFFAOYSA-N	438.410	1.162	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)C1CCC(NC(=O)C(C)(C)C)CC1	789204576	RLGNTEPVLUVUAS-UHFFFAOYSA-N	431.533	1.949	50	20	IDGD	
Cc1nnc(-c2ccc(NC(=O)C(=O)NNC(=O)[C@H]3OCC[C@H]3c3ccccc3)cc2)o1	789810758	QGJVFIYXQRETSD-ROUUACIJSA-N	435.440	1.704	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2cc(C(=O)O)c(OC)cc2Cl)cc1OC	790385348	GUJHIJOQQUETQZ-UHFFFAOYSA-N	444.849	1.687	50	20	IDGD	
COc1cc(Cl)c(S(=O)(=O)NNC(=O)c2ccc3c(c2)OCO3)cc1C(=O)O	790387631	SMMAFWNBFBGPGY-UHFFFAOYSA-N	428.806	1.399	50	20	IDGD	
COc1cc(CC(=O)NNC(=O)c2cc(Br)ccc2O)cc(OC)c1O	790800675	RYKOQSZQOPTVQB-UHFFFAOYSA-N	425.235	1.881	50	20	IDGD	
O=C(NC[C@@H]1CCSC1)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	790877274	LPZFDCWBUHEWFN-AWEZNQCLSA-N	426.564	1.558	50	20	IDGD	
CO[C@H]1CCOc2c(NC(=O)C(=O)NNC(=O)[C@H](C)Oc3ccccc3F)cccc21	790951876	MJDWUULCZKBBJC-LRDDRELGSA-N	431.420	1.849	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1nnc(-c2ccc(Cl)cc2F)s1	791900889	VBIDNAOKKMEBIK-LURJTMIESA-N	436.878	1.088	50	20	IDGD	
COc1ccc(OCC(=O)NN=C[C@H]2CCCN(C(=O)CNC(=O)OC(C)(C)C)C2)cc1	794469015	QCHMGVGERAIZLC-MRXNPFEDSA-N	448.520	1.939	50	20	IDGD	
O=C(NNC(=O)c1cnccn1)C(=O)Nc1cc(C(F)(F)F)ccc1Br	796998603	JNVSVYSQNHIUMY-UHFFFAOYSA-N	432.156	1.658	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)Nc1cc(S(=O)(=O)N2CCCC2)ccn1	797674443	VQKHHZVNWAPEBL-UHFFFAOYSA-N	449.489	1.106	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)Nc1ccc(OCC(=O)NC)cc1C	797679727	ZCHBSICVJHOZQT-UHFFFAOYSA-N	430.461	1.750	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@@H]2C(=O)OCC(=O)NNC(=O)c2cccs2)cc1	798792614	BJALWOCAPSUDMZ-OAHLLOKOSA-N	431.470	1.366	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)NCCS(=O)(=O)CCc2ccccc2)nc2ccccc21	800757606	BJYKXOJTFGNQGU-UHFFFAOYSA-N	443.529	1.104	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2CS[C@@H](Cc3ccccc3F)C(=O)N2)cc1	801105228	BTGBYRAVGTYDOF-IRXDYDNUSA-N	444.488	1.063	50	20	IDGD	
NC(=O)CC[C@@H](NC(=O)CCC1CCCC1)C(=O)NNC(=O)Nc1cc(F)cc(F)c1	802006083	GYSYJNFGQNLNEV-MRXNPFEDSA-N	439.463	1.838	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)N[C@@H]1CCCN(C(=O)Cc2ccccc2)C1	802475207	DXNNSRUDKJEJKF-GOSISDBHSA-N	428.464	1.769	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)c2nnn(Cc3ccncc3)c2C)n[nH]1	802936594	ASEQXAOWOAWRRZ-UHFFFAOYSA-N	432.444	1.503	50	20	IDGD	
CN(NC(=O)c1ccnc(NC(=O)C2CC2)c1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	803101736	IMAPSGXUTLQPDT-UHFFFAOYSA-N	446.508	1.679	50	20	IDGD	
O=C(NNc1ccc2c(=O)[nH]ccc2c1)C1CCN(S(=O)(=O)c2cccnc2)CC1	803431526	BKNCCKOFSOYOOE-UHFFFAOYSA-N	427.486	1.467	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N(C)[C@@H]2CCCOC2)cc1	804287793	OYASXOUCJXOVPK-LYPXWFNGSA-N	437.500	1.978	50	20	IDGD	
O=C(NCC1(c2ccc3c(c2)OCO3)CCOCC1)NNc1ccc(-n2ccnc2)nn1	804990115	MYHRRHKYASDMND-UHFFFAOYSA-N	437.460	1.766	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)NC[C@H](N1CCOCC1)C(F)(F)F	805369485	YKPPQWRUXQHSEQ-FZMZJTMJSA-N	438.834	1.701	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)N2CC[C@H](N3CCN(C(=O)OC(C)(C)C)CC3)C2)n1	805405015	BRWNWTKDQBIQBY-INIZCTEOSA-N	432.525	1.371	50	20	IDGD	
O=C(NNC(=O)N1CCN(c2cccc(Cl)c2)CC1)c1ccc(-n2cnnn2)cc1	807135477	JDWRFOPYLAUJLL-UHFFFAOYSA-N	426.868	1.492	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)[C@]1(F)CCN(C(=O)OCc2ccccc2)C1	807370456	JFQXTKIEHXTACL-FQEVSTJZSA-N	425.457	1.674	50	20	IDGD	
Cn1nc(-c2ccc(Cl)s2)cc1NC(=O)C(=O)NNc1ccc(-n2ccnc2)nn1	807428918	KUEUCBYUBZGZML-UHFFFAOYSA-N	443.880	1.860	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)NCCC2(O)CCOCC2)c2ccccc2c1=O	807449093	FWLZOHFHGDJPAR-UHFFFAOYSA-N	445.520	1.462	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)c1cncc(C(F)(F)F)c1	807924870	YAIPPBNELSZREX-UHFFFAOYSA-N	442.419	1.960	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1)NNc1cnnc2ccccc12	810404775	XYCXHIUUXDDQOG-UHFFFAOYSA-N	441.391	1.950	50	20	IDGD	
O=C(COC(=O)c1cnnc(-c2ccccc2)c1)NNC(=O)[C@@H]1COc2ccccc2O1	811287010	QGMHOABWIWEFEO-IBGZPJMESA-N	434.408	1.288	50	20	IDGD	
O=C(COC(=O)[C@H]1CCN(c2ccccc2F)C1)NNC(=O)[C@@H]1COc2ccccc2O1	811378640	RUYBPTAMSLJBAF-LIRRHRJNSA-N	443.431	1.183	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)CCn2c(S)nc3ccccc3c2=O)cc1	812731380	KCSZQRDURQUYKW-UHFFFAOYSA-N	447.542	1.469	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ncc(C(C)(C)C)s2)cc1	813033251	KZSJJKLRTWLPQS-UHFFFAOYSA-N	425.536	1.773	50	20	IDGD	
CC(C)(O)CN1CCC(=NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)CC1	814225982	ZGCRVWAFLFWLRR-UHFFFAOYSA-N	436.000	1.797	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1nn(C)cc1Br	814602782	YKESTEJGPBUGJB-UHFFFAOYSA-N	445.657	1.463	50	20	IDGD	
CC(=NNC(=O)C(=O)Nc1ccc(C)c(C)c1)c1ccc(S(=O)(=O)CC(N)=O)cc1	814768418	AGOPDXJDNLJCAB-UHFFFAOYSA-N	430.486	1.041	50	20	IDGD	
COc1cc(C(C)=NNC(=O)N[C@@H]2CCS(=O)(=O)C2)ccc1OCCCC(=O)O	814815688	GNNJKIRCSYGOBN-CQSZACIVSA-N	427.479	1.149	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2ccnc(NC(=O)C(C)C)c2)cc1OC	815481331	CCYNKERHMAEUPS-UHFFFAOYSA-N	444.444	1.311	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(N(C(C)=O)C2CC2)cc1	815565201	GBZQRQMIZDZNRL-UHFFFAOYSA-N	438.484	1.929	50	20	IDGD	
Cc1cc(N(C)C)cc(C)c1NC(=O)C(=O)NNc1ccccc1S(=O)(=O)N(C)C	815751513	CGLJLLGLCXWNPN-UHFFFAOYSA-N	433.534	1.702	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1c(F)cccc1-n1cccn1	815751824	PTGKQXJLVBTJGO-UHFFFAOYSA-N	446.464	1.344	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)/C(=C/c2ccc(F)cc2)n2nnnc2C)cc1OC	818013016	WUOUVTOEISFOGN-YBEGLDIGSA-N	426.408	1.597	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)Cn2c3ccccc3c(=O)c3ccccc32)C[C@@H](C)O1	844263644	BVZIFNRNYBZLEK-CALCHBBNSA-N	436.512	1.801	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1	914709128	MMVZQUIMBHKODD-KRWDZBQOSA-N	437.449	1.113	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cc(S(=O)(=O)NC(C)C)ccc2F)cc1OC	914709166	ODGQWBRCKVBBMN-UHFFFAOYSA-N	439.465	1.604	50	20	IDGD	
O=C(NCCCN1CCCC1)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	916195989	JLZBSVCHOHNYSE-UHFFFAOYSA-N	448.531	1.818	50	20	IDGD	
O=C(NCCCN1C(=O)NC2(CCCCC2)C1=O)NNC(=O)c1cccc([N+](=O)[O-])c1	916267946	YPJOZNCCFRMVQR-UHFFFAOYSA-N	432.437	1.184	50	20	IDGD	
CN(C)N(C(=O)c1cccc(NC(=O)[C@@H]2Cc3ccccc3O2)c1)[C@@H]1CCS(=O)(=O)C1	916373911	RZGGOGQOPAZPRG-QUCCMNQESA-N	443.525	1.735	50	20	IDGD	
C[C@]1(NNC(=O)NC[C@@H](c2ccccc2Cl)N2CCOCC2)CCS(=O)(=O)C1	916437934	RCAJVGUDAQLVTM-WMZOPIPTSA-N	430.958	1.094	50	20	IDGD	
Cn1c(=NNC(=O)c2ccc3c(c2)S(=O)(=O)N(C2CC2)C3=O)sc2ccccc21	916740756	KCSICAICXSAOGH-UHFFFAOYSA-N	428.495	1.792	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=O)c2ccc(Cl)cc2O)n(C)c1	918357848	CHCIZTHTMYQCPW-UHFFFAOYSA-N	428.898	1.489	50	20	IDGD	
O=C(NNC(=O)C1(S(=O)(=O)c2ccc(Cl)cc2)CC1)c1ccc2c(c1)OCCO2	919697177	ODVQBMPBWJQAHJ-UHFFFAOYSA-N	436.873	1.879	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)c2nc3ncc(Br)cn3n2)c1C	919808713	GEUXMFIXMIBJGI-LLVKDONJSA-N	433.266	1.732	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)Cc2c(C)nc3nc(SC)nn3c2C)cc1	919833871	IDMFQACERFYDGH-UHFFFAOYSA-N	428.518	1.794	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)NCc2ccnc(C)n2)cc1	920854907	UMDWTHSMEMVICG-BOPFTXTBSA-N	445.483	1.756	50	20	IDGD	
CN(C)Cc1cccc(NC(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)c1	920928615	WGEDXZJLDZYRBI-UHFFFAOYSA-N	425.898	1.516	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)Nc3ccccc3CN3C(=O)CNC3=O)n[nH]2)cc1	920936472	YQTQNOAMLWTZOY-UHFFFAOYSA-N	447.455	1.903	50	20	IDGD	
CCn1c(=O)nc(O)c2c(C(=O)NNC(=O)c3ccc(OC)cc3)cc(C(C)C)nc21	1115835407	VCXKSRCLGYCEDI-UHFFFAOYSA-N	425.445	1.724	50	20	IDGD	
CCc1ccnc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C3)c1	1777782324	KJZNIDZSACRGCV-AUSIDOKSSA-N	445.564	1.145	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2)c1snnc1C1CC1	1778362751	GOLOYOBCJMTUJC-SNUQEOBHSA-N	428.942	1.143	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)C#CC3(O)CCCCC3)C2)C1	1779068357	YZWWCAPQBBYAEK-QUCCMNQESA-N	431.360	1.751	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccnc(Cl)n3)C2)C1	1779500578	ZZPFUQSQQNULSS-MEDUHNTESA-N	431.718	1.605	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C=N/N1CCCCC1)C2	1779545319	CBLZESDGXOFZRA-ORHXZUFZSA-N	438.645	1.824	50	20	IDGD	
O=C(CC12CCCN1CCC2)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2	1780662971	ZDQKNPMMYGFGSE-MBOZVWFJSA-N	427.973	1.119	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@]2(C)CCCN2)C1	1780674555	QHWMKIABUVAUOR-OSGQAZFXSA-N	430.387	1.816	50	20	IDGD	
CN(C)c1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](F)Br)C3)C2)cc1	1781334939	RMMXSYLEVHWZQM-MAUKXSAKSA-N	428.302	1.887	50	20	IDGD	
Cn1nc2c(c1C(=O)NC[C@@]13CCCO[C@@H]1CCN(C(=O)CO[Si](C)(C)C)C3)CCC2	1781368682	GPYNXANIAOCOMP-XMSQKQJNSA-N	448.640	1.888	50	20	IDGD	
O=C([C@@H]1C=CCN1)N1CCO[C@]2(CCN(C(=O)[C@H](Br)Cc3ccccc3)C2)C1	1783024164	UZSDYTKYTRHOPW-LQWHRVPQSA-N	448.361	1.351	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cccc(=O)n3C)CCO2)C1	1783344989	VIBDHRYZVRIBCF-SCLBCKFNSA-N	426.311	1.002	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3c[nH]c4nccc-4c3Cl)CCO2)C1	1783875001	JWINHRRIRFYLME-LIRRHRJNSA-N	441.315	1.865	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)[C@@H]1C[C@@H]1c1ccc(F)c(F)c1	1784155055	MPRSOQDJWMIHTK-ACIZPKGOSA-N	442.890	1.648	50	20	IDGD	
C[C@H](C#N)c1cccc(C(=O)N2CC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c1	1785084757	WXXQRHASLCQOCM-HXOBKFHXSA-N	441.532	1.130	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC1(c2ccc(NC(=O)C[C@@H]3NC(=O)NC3=O)cc2)CCC1	1786762910	ZQPWRPIADNSIAK-SCLBCKFNSA-N	441.315	1.955	50	20	IDGD	
C[C@@H](C(=O)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1)N1C[C@H]2C[C@H]2C1	1788145563	CLGCWRFCZMJVPS-YTQUADARSA-N	447.344	1.454	50	20	IDGD	
O=C(NC1(c2ccc(NC(=O)c3ccncc3F)cc2)CCC1)c1ccc(B(O)O)cc1	1788855799	FEJUSPJDSFTNKJ-UHFFFAOYSA-N	433.248	1.962	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc(O)c4ccn(C)c34)C[C@@H]21	1789861579	FSSWOMYZJAFVNP-STECZYCISA-N	434.924	1.890	50	20	IDGD	
CN(C)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]2C1	1789922241	IQCUUMGVCUEJQY-MZGVZZPPSA-N	443.317	1.431	50	20	IDGD	
C[C@H](Nc1ccccn1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]2C1	1789926063	MCHKXUIRPBFKQG-SMSYFYOWSA-N	443.317	1.552	50	20	IDGD	
Cc1cc(/C=C/C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]3C2)no1	1789926185	QGKAJWTWBHWCKB-VEGNLECUSA-N	430.274	1.666	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc4c[nH]nc34)C[C@@H]21	1791057104	CEAYWSANPXZKNK-MZGVZZPPSA-N	435.322	1.940	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3CCOC3)[C@H]2C1	1791757649	ZEVXXNIGZXMURR-OQWVWTCMSA-N	445.466	1.888	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(C(F)(F)F)cc1F)C2)[C@@H](O)CCl	1792983979	WHMVNLKWVPSUSY-OWLDWWDNSA-N	438.805	1.647	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(C)cs1	1793509676	GKIQIXPXWWCCFO-SNOXVSQISA-N	443.529	1.394	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H]1[C@H]3COC[C@H]31)C2	1794143372	AYIUPQFAFRIGIE-DKGRAKJVSA-N	441.956	1.649	50	20	IDGD	
COc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCBr)c(F)c1	1795115051	CGEJESJTCRMGCJ-DPIQGUFMSA-N	429.286	1.823	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnn(C)c1C	1795265113	WCUJHMBWPYGZNR-XMOXNHLCSA-N	425.493	1.114	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(N3CCOCC3)c1)C2)[C@@H](F)Cl	1796366937	OWMUSRQQBCRREZ-CYGHRXIMSA-N	425.888	1.261	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CCC[C@H]1C)C2	1796441947	JHFGKINVNLKMCZ-OAUVYZRFSA-N	429.521	1.146	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1CN(C(=O)OC(C)(C)C)C1	1797143263	OAFSZWGLECAQSI-YYIAUSFCSA-N	443.972	1.850	50	20	IDGD	
C[C@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(C)(C)CCl)C2)N1CSCSC1	1797840829	YIQHZVSOHWSDKU-APIJFGDWSA-N	436.043	1.884	50	20	IDGD	
CCc1cnc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)CBr)C3)s1	1797958801	ZCGVICXYJOKXFR-NRWUCQMLSA-N	430.368	1.940	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc([N+](=O)[O-])[nH]1	1798743457	BMRWTFKEYLFNHP-NJBDSQKTSA-N	429.271	1.157	50	20	IDGD	
COc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Br)C3)cc1OC	1798896366	STDMNQZRKVLVEH-NOXHYTERSA-N	445.285	1.598	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2)[C@H](O)c1cccc(Br)c1	1799096938	CQIPTYIDBOVGEQ-OBRUSBNWSA-N	449.704	1.607	50	20	IDGD	
CC(=O)Nc1ccccc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Br	1799352295	ONFPKPXAKHONHS-NOXHYTERSA-N	442.285	1.539	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C#CC1CC1)C2	1800332155	BMBVMPZBAYCNLY-BDCURPAKSA-N	425.435	1.875	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3nn(C)cc3c1)C2	1800642908	BUEFKSORRUGJPW-KYHPRHEASA-N	449.349	1.950	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C1\C(=O)Nc3ccccc31)C2	1800759104	HTUSJTPHHKBVFD-BKDZVLTGSA-N	448.317	1.395	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CC(c3ccccc3)=NO1)C2)C(Cl)Cl	1801015897	WWZYYRCRNBBQSM-OCVGTWLNSA-N	426.300	1.573	50	20	IDGD	
N#Cc1ccccc1OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2	1801991737	LDZASPWTKMXVCD-RMHZUWNSSA-N	440.269	1.217	50	20	IDGD	
CCOC(=O)C(C)(C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)CBr)C2	1802085203	FRRYSSONPCGHDT-YIYPIFLZSA-N	433.343	1.196	50	20	IDGD	
CC(=O)NCCC(=O)N1CC[C@H](CNC(=O)[C@H](C)CBr)[C@H]1c1cccnc1	1803013758	ACUMEWXASCJLRC-MZMPZRCHSA-N	439.354	1.645	50	20	IDGD	
O=C([C@H](O)CCl)N1CCCC2(CCN(C(=O)[C@@H]3CC[C@H]4CCC(=O)N4C3)CC2)C1	1805525378	PXRDDLIDMCUUAJ-IXDOHACOSA-N	425.957	1.218	50	20	IDGD	
CN1C(=O)CC[C@H]1C(=O)N1CC[C@@H](CNC(=O)CCBr)[C@H]1c1cccnc1	1806343926	LKHFKDBYGZNXSS-RLFYNMQTSA-N	437.338	1.493	50	20	IDGD	
Cc1nn[nH]c1C(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)CBr)[C@H]1c1cccnc1	1807797534	LSCFWGLNDWTIHH-PJODQICGSA-N	435.326	1.859	50	20	IDGD	
N#Cc1cc(CC(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)ccc1F	1808550361	VGNYPTOREPHFOB-NBHGPNQESA-N	444.894	1.941	50	20	IDGD	
Cn1cnc(C(=O)N2CC[C@H](CNC(=O)[C@@H](F)Br)[C@@H]2c2cccnc2)n1	1808652140	UFJPROGDNYAWLQ-FRRDWIJNSA-N	425.262	1.220	50	20	IDGD	
CN1C(=O)CC[C@H]1C(=O)N1CC[C@H](CNC(=O)[C@@H](F)Br)[C@H]1c1cccnc1	1808676005	KDGVCLUOZCFNPO-OCVGTWLNSA-N	441.301	1.399	50	20	IDGD	
Cc1[nH]ccc1C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1808749999	MMYLLYDCJUVNQO-GHTZIAJQSA-N	432.289	1.031	50	20	IDGD	
O=C(Cn1nccn1)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@@H]1c1cccnc1	1808959307	BYDXXMSYUKRSEZ-NWANDNLSSA-N	425.262	1.070	50	20	IDGD	
C[C@@H](CS(C)(=O)=O)C(=O)N1CCC2(CCCN(C(=O)CCBr)C2)CC1	1809065951	BAIKDXUIVQBEOP-AWEZNQCLSA-N	437.400	1.683	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)c3ccc(F)nc3F)CC2)C1	1809968499	ZMJHVJUWMIMKMH-UHFFFAOYSA-N	443.259	1.198	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1	1810305176	IYKKCLGGPCHPCR-JCGIZDLHSA-N	444.923	1.417	50	20	IDGD	
Cn1nc(C(=O)N2CC[C@@H](CNC(=O)CO[Si](C)(C)C)[C@@H]2c2cccnc2)cc1O	1810538912	AXCPBOAJVZFJLD-KXBFYZLASA-N	431.569	1.692	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](F)Cl)[C@@H]1c1cccnc1)c1cc(=O)nc2cccnn12	1811336183	PKVWTYRDEUXXLQ-MORSLUCNSA-N	444.854	1.339	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1ccccc1	1811662857	BPEBYZMPVGQUDF-RBBKRZOGSA-N	429.285	1.395	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2c3c(nn2C)CCC3)[C@@H]1c1cccnc1	1812227368	XGPZGHUUKIKXNM-IEZWGBDMSA-N	445.951	1.877	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)NC[C@H]1CCN(C(=O)CN)[C@@H]1c1cccnc1	1812442462	XEOAVEHFLIBISS-FBVTXZAOSA-N	425.439	1.931	50	20	IDGD	
COCCn1nccc1C(=O)N1CC[C@H](CNC(=O)[C@H](Cl)COC)[C@@H]1c1cccnc1	1813031445	VHPYWVCDGZKGSY-LMMKCTJWSA-N	449.939	1.498	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)C23CC(C(=O)OC)(C2)C3)[C@H]1c1cccnc1	1813032501	CPNINVYMKALYGS-PCIKLCOZSA-N	449.935	1.685	50	20	IDGD	
O=C(CCc1ccc[nH]1)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1	1815339892	SELFFXLZMVZYFP-MRXNPFEDSA-N	438.318	1.010	50	20	IDGD	
C[C@@H](C(=O)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1)c1ccccc1	1815363961	CSTMDZFHTGNBFY-RDTXWAMCSA-N	449.341	1.852	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)Cc3ccccn3)sc2C1	1815747881	BJAMRCDJMKQIKZ-AWEZNQCLSA-N	430.534	1.066	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2coc(Cl)n2)n[nH]1	1816179803	PJFZKOBAOKQDQG-ZDUSSCGKSA-N	437.888	1.730	50	20	IDGD	
O=C(N[C@H]1CCc2nc(NC(=O)[C@@H](F)Cl)sc2C1)c1cc(=O)nc2cccnn12	1817128827	QVUDKKKRZKWMHG-RMLUDKJBSA-N	436.856	1.306	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(F)nc2)[nH]n1)c1cccc(B(O)O)c1	1817476986	VDGUOGDGCKCBIK-KRWDZBQOSA-N	437.240	1.243	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccns1)CC2	1819795588	PETWPQJGNALDQA-VIFPVBQESA-N	443.514	1.138	50	20	IDGD	
Cn1ccc2c(O)ncc(C(=O)Nc3cc([C@H]4CCCCN4C(=O)[C@H](O)CCl)[nH]n3)c21	1820090848	IHMQHSVKHOPHCC-HUUCEWRRSA-N	446.895	1.908	50	20	IDGD	
C=C(C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1)C(F)(F)F	1821993799	DCZBFOBNEYLUBX-CYBMUJFWSA-N	430.431	1.893	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)N[C@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1	1823003013	GLEAIXQEDHLYQL-FDOIEUKUSA-N	435.319	1.612	50	20	IDGD	
COCCOCCOCCC(=O)N1CCC([C@H]2CCCCN2C(=O)[C@H](O)CCl)CC1	1824185618	JRRXLTKQYDRRAZ-RTBURBONSA-N	448.988	1.276	50	20	IDGD	
CC(C)[C@H](S)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1	1824536944	BBQWSSOJCYDTQO-UXHICEINSA-N	432.395	1.554	50	20	IDGD	
Cc1noc(CC(=O)N[C@H]2CCc3nc(NC(=O)[C@@H](C)Br)sc3C2)n1	1825642871	WHROSTCUDXEZRQ-APPZFPTMSA-N	428.312	1.773	50	20	IDGD	
CCc1cc(C(=O)N[C@@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)no1	1826087652	IHBFIXPHRQQARW-LLVKDONJSA-N	434.522	1.292	50	20	IDGD	
C[C@H](C(=O)N[C@@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1)c1ccccn1	1826092180	PUPBAYLTSWGAGI-UONOGXRCSA-N	444.561	1.627	50	20	IDGD	
O=C(CCc1ccoc1)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827054688	JJDDPVXQMMNTPY-JOCHJYFZSA-N	438.333	1.826	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)n2)CC1	1827602121	BQPCNFCMBRBTQR-SMDDNHRTSA-N	441.326	1.905	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccncn2)CC1	1828926508	LNSODIIFPAMDOX-LJQANCHMSA-N	437.504	1.022	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccnc3S)CCO2)C1	1829791702	IYZNSQCCZMDTKN-BEFAXECRSA-N	427.954	1.848	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)C3CC(F)(F)C3)CCO2)C1	1829993340	ZXZPRDFZRFUHNN-BBRMVZONSA-N	439.297	1.662	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc(Cl)nc3)C2)C1	1830352549	PUZMSHHTFKXMPO-SFHVURJKSA-N	431.320	1.465	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3C[C@H]4CC[C@@H]3O4)C2)C1	1830543897	HCGXHIMYQJWEBR-IPXJXJKCSA-N	445.354	1.041	50	20	IDGD	
O=C([C@H](O)CCl)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CCC[C@H]4CCCC[C@@H]43)C2)C1	1830732074	UFGQTDMCIIKGCT-XPEFGHIFSA-N	442.984	1.649	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H]2CCCS2(=O)=O)CC1	1831286314	VYQYSAZMKXFKEG-CWRNSKLLSA-N	449.411	1.967	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CSC3CCCC3)CCO2)C1	1831363054	ACBFAFBROKEAIV-KBXCAEBGSA-N	449.411	1.902	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C)nc(O)c3)C2)C1	1831647496	WMSUSBCYADLEPC-OXJNMPFZSA-N	425.913	1.573	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(CO)c(F)c3)C2)C1	1831658414	FHKXGVXWYADEHX-UTKZUKDTSA-N	442.915	1.796	50	20	IDGD	
O=C(CN1CCSCC1)NC1CCN(C2CCN(C(=O)C(Cl)Cl)CC2)CC1	1833063036	MNKDRLIKHUBJFS-UHFFFAOYSA-N	437.437	1.411	50	20	IDGD	
Cc1cccc(/C=C/C(=O)NC2CCN(C3CCN(C(=O)[C@H](O)CCl)CC3)CC2)n1	1833063889	WCBQDFAWIUMVFB-RRFGBZISSA-N	434.968	1.575	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)cnc1C	1833299854	TUKQAGUOTJAPNM-YJBOKZPZSA-N	444.301	1.459	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3ncc(F)cc3F)CC2)CC1)[C@H](O)CCl	1833306555	VGVYFXXDYUDNON-MRXNPFEDSA-N	430.883	1.145	50	20	IDGD	
COc1cc(C(=O)N2CCC(N3CCC(NC(=O)[C@H](O)CCl)CC3)CC2)ccc1C	1833313967	WZMUVEUWSHWFAC-LJQANCHMSA-N	437.968	1.789	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3coc(Cl)n3)CCO2)C1	1833557903	YWXSJLWTVTVUHS-CVEARBPZSA-N	440.711	1.634	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(O)n3)CCO2)C1	1834197732	VKASFADZOTZPPV-UGSOOPFHSA-N	442.310	1.031	50	20	IDGD	
Cc1nocc1C(=O)NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1	1834247433	WLBRQTSIQFDQPI-UHFFFAOYSA-N	427.343	1.953	50	20	IDGD	
CCn1nccc1C(=O)NC1CCN(C2CCN(C(=O)[C@@H](Cl)COC)CC2)CC1	1834278419	WWPHDIGZYKKHSG-KRWDZBQOSA-N	425.961	1.342	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)c3sccc3F)C2)C1	1834819864	ZTGNHMQCNIWJNO-MRXNPFEDSA-N	435.315	1.742	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)CN3CCN(C)CC3)CC2)CC1	1835479516	HLPKMLLDJONWDX-HXUWFJFHSA-N	442.048	1.213	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3cccs3)CCO2)C1	1836091558	PMNAWAUDQMSAEK-MSOLQXFVSA-N	435.373	1.983	50	20	IDGD	
CN(C)c1cccc(C(=O)NC2CCN(C3CCN(C(=O)[C@H](O)CCl)CC3)CC2)c1	1836269516	JUAZHTLQWZAPPB-HXUWFJFHSA-N	436.984	1.538	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](OC(C)=O)C(C)C)CCO2	1837214769	ZNBUVWXOKVUBAJ-ZWOKBUDYSA-N	432.945	1.438	50	20	IDGD	
CCc1noc(C)c1C(=O)N1CCOC[C@@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1837715562	XORFULGHCVDAPP-HXUWFJFHSA-N	439.585	1.467	50	20	IDGD	
CC(=O)N/C(C)=C/C(=O)N1CCC(OC2CCN(C(=O)[C@@H](C)Br)CC2)CC1	1838721221	MCQSNMSLQRCULZ-XTZCOPOCSA-N	444.370	1.808	50	20	IDGD	
CCc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)nn1C	1839153586	LNRLBBGMNGQEJP-MOPGFXCFSA-N	447.363	1.289	50	20	IDGD	
CC1=CC[C@H](C(=O)N2CCOC[C@@]3(CN(C(=O)[C@H](F)Br)CCO3)C2)CC1	1839201084	RACQMECEXGGAHR-MPGHIAIKSA-N	433.318	1.880	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(OC)c3C)CCO2)C1	1840645219	JJKAIFXTSRBQSQ-LAUBAEHRSA-N	440.924	1.327	50	20	IDGD	
COc1cc(C(=O)N2CC3(CCCN3C(=O)[C@@H](O)CCl)C2)ccc1Br	1841352655	CSINQMXAFAWGNY-ZDUSSCGKSA-N	431.714	1.874	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)Cc2c(F)ccc(F)c2F)C1	1841773947	SAEPHGSSGOPNPZ-UHFFFAOYSA-N	447.417	1.162	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCCC12CN(C(=O)CCn1ccnn1)C2	1841925315	KKWWGZDZLIBRKX-AWEZNQCLSA-N	440.932	1.004	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC2(CCCN2C(=O)c2cccc(N3CCOCC3)n2)C1	1843529066	ZQQUHQUJMSGHTR-CQSZACIVSA-N	437.338	1.519	50	20	IDGD	
CN(CC(=O)N1CCCC12CN(C(=O)[C@@H](F)Cl)C2)NC(=O)NCc1ccccc1	1845038629	ANDMBKJJSXMKPY-MRXNPFEDSA-N	425.892	1.070	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@H]1Cc3[nH]nc(C(F)(F)F)c3C1)C2	1846364499	RTABLKYEFAZIJP-PWSUYJOCSA-N	434.846	1.601	50	20	IDGD	
Cc1ocnc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1848099290	HVAFRDOPLLYQMX-IHRRRGAJSA-N	426.901	1.931	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)Cn2cnc3sc(C)c(C)c3c2=O)cc1OC	12692066	DTXWQDLRSJLSAV-UHFFFAOYSA-N	430.486	1.943	50	20	IDGD	
C[C@H]1Cc2cc(C(=O)NNC(=O)Cc3c[nH]c4ccccc34)ccc2N1S(C)(=O)=O	24455164	QOXAFWMCYXRFSS-ZDUSSCGKSA-N	426.498	1.882	50	20	IDGD	
COc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NNC(=O)c2cc(-c3ccccc3)on2)cc1	27259552	VGUNQZJFSUYKLT-ZDUSSCGKSA-N	444.469	1.478	50	20	IDGD	
O=C(NNS(=O)(=O)/C=C\c1ccccc1Cl)c1csc(N2CCOCC2)n1	727351530	MJGDLODRKDEPGH-YHYXMXQVSA-N	428.923	1.868	50	20	IDGD	
COc1ccccc1-n1c(C)nnc1SCC(=O)N([C@H]1CCS(=O)(=O)C1)N(C)C	728180731	XDBNENZZJOAFEW-AWEZNQCLSA-N	439.563	1.169	50	20	IDGD	
CC(C)Oc1ccccc1CC(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	728341395	XIYICZZCWJGRTF-IBGZPJMESA-N	428.441	1.547	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@H]2C(=O)NNC(=O)Cc2cccnc2)cc1	728852226	UQMYSEWMXZNBQA-IBGZPJMESA-N	444.513	1.218	50	20	IDGD	
NC(=O)[C@@H]1CCCN1Cc1cccc(NC(=O)NNC(=O)Cn2ccc3ccccc32)c1	729493975	JLWGQWIPWOUMHK-FQEVSTJZSA-N	434.500	1.944	50	20	IDGD	
CS(=O)(=O)c1ccc(Cl)c(S(=O)(=O)NNC(=O)c2cccc3ncccc23)c1	730203702	BASLLNCZWUOJLS-UHFFFAOYSA-N	439.902	1.915	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N[C@@H](C)c1nnc2n1CCC2	730937452	QHDMMQPWIIGEQO-QWRGUYRKSA-N	437.298	1.846	50	20	IDGD	
C[C@H]1CCC[C@@H](NC(=O)CN2CCN(C(=O)NNC(=O)c3cccc(C#N)c3)CC2)C1	731220609	MCQQPSLICHEVMK-QFBILLFUSA-N	426.521	1.225	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)NCCCCN1C(=O)c2ccccc2C1=O	732472451	SWVSCFFXGDSXRJ-UHFFFAOYSA-N	435.440	1.344	50	20	IDGD	
Cn1c(CCC(=O)NNc2cnccn2)nc2cc(S(=O)(=O)N3CCCCC3)ccc21	734245328	VAXIKRMQSWZCCE-UHFFFAOYSA-N	443.533	1.614	50	20	IDGD	
C[C@@H](NC(=O)c1ccc(Br)s1)C(=O)NNC(=O)COCc1ccccc1	737926209	BONZWFVMAMALJZ-LLVKDONJSA-N	440.319	1.993	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CCC[C@H]1C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	739511821	OCRQITKZQSBPRO-HUUCEWRRSA-N	425.507	1.545	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C[C@@H]2CN(Cc3ccccc3)CCO2)c2ccccc2c1=O	740748833	AFBIWAQQHZJADX-GOSISDBHSA-N	449.511	1.469	50	20	IDGD	
CC(C)(C)OC(=O)N(CC(=O)NNC(=O)COc1ccc(C#N)cc1)C[C@H]1CCCO1	742032926	CTWGSFIXLRSBLV-QGZVFWFLSA-N	432.477	1.501	50	20	IDGD	
CC(C)(C)OC(=O)c1ccc(CNC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1	743510207	RQFLSVSPMYQWAV-UHFFFAOYSA-N	437.460	1.762	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)N1CCN(c2ncnc3ccsc23)CC1	743625543	ULYYEVLCQSEIAT-UHFFFAOYSA-N	426.502	1.771	50	20	IDGD	
CS(=O)(=O)NCCc1ccc(C(=O)NNC(=O)Nc2ccc(OC(F)F)cc2)cc1	743832711	RZCJKYONWISDJW-UHFFFAOYSA-N	442.444	1.846	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)Cn2ncc3ccccc3c2=O)cc1Cl	743834801	UTMMHXAYKSPCPK-UHFFFAOYSA-N	431.836	1.920	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCC(C(=O)NC3CCCCC3)CC2)cc1OC	744220756	ASKBVSYENQZKKG-UHFFFAOYSA-N	446.548	1.626	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)C(C)(C)C)c1	746093521	QASNBQQLBFFPLW-UHFFFAOYSA-N	433.486	1.872	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)NCC(=O)NCCO)c(C)n1-c1ccc(Br)cc1	746225196	BPRWXMXRPFHAII-YBEGLDIGSA-N	445.317	1.988	50	20	IDGD	
O=C(CCNS(=O)(=O)c1c(Cl)cccc1Cl)NNC(=O)Cc1ccncc1	747428710	STYGFQUQSLKILQ-UHFFFAOYSA-N	431.301	1.447	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)[C@@](C)(O)Cc3ccccc3)cc2)CC1	748619548	KBALCRVZGWOAIB-NRFANRHFSA-N	432.546	1.060	50	20	IDGD	
Cc1cc(Br)ccc1NNC(=O)[C@H]1CC(=O)N([C@@H]2CCS(=O)(=O)C2)C1	748730173	KJMVIBPDHBORHY-WCQYABFASA-N	430.324	1.236	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)NCCC1CCN(CC(F)(F)F)CC1	748969055	ZGBWCJHZGLGEJQ-UHFFFAOYSA-N	427.427	1.932	50	20	IDGD	
COc1cc(OC)cc(N2C[C@@H](C(=O)NNC(=O)COc3cc(C)ccc3C)CC2=O)c1	752398523	HWZMEFQECUFCQA-INIZCTEOSA-N	441.484	1.900	50	20	IDGD	
CCOC(=O)c1ccc(N2CC(NC(=O)NNC(=O)COc3cccc(C)c3)C2)nc1	753279792	NIEKALHTSXYUOG-UHFFFAOYSA-N	427.461	1.165	50	20	IDGD	
C[C@H](OC(=O)/C(C#N)=C\c1ccc(O)cc1)C(=O)NCCc1ccc(S(N)(=O)=O)cc1	754541465	ODQIRLACYATGSV-VMOJBDSFSA-N	443.481	1.237	50	20	IDGD	
O=C(Cc1ccc2c(c1)COC2)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	755515601	DWTLAMOQDCRELN-UHFFFAOYSA-N	442.947	1.878	50	20	IDGD	
COCC(=O)NNC(=O)Nc1ccc(CC(=O)N2CCN(c3ccccc3)CC2)cc1	755691245	ILAZHHLAFMDSEB-UHFFFAOYSA-N	425.489	1.377	50	20	IDGD	
Cn1cc(-c2nc3ccccn3c2NC(=O)NNC(=O)COc2ccccc2C#N)cn1	757667192	WCEUAZVNOKOYIX-UHFFFAOYSA-N	430.428	1.838	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)Cc1cccc(OCc2cccc(Cl)c2)c1	758029011	HTFXSQQFCLFABQ-ZDUSSCGKSA-N	439.921	1.547	50	20	IDGD	
Cc1c(CCC(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)cnn1C	758195393	ZJBILOLKZGFBSV-UHFFFAOYSA-N	444.499	1.824	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccc([N+](=O)[O-])cc2F)c1	758334016	ACDTXKREGQIYHS-UHFFFAOYSA-N	425.398	1.451	50	20	IDGD	
Cc1nc2cc(F)cc(C(=O)N3CCN(S(=O)(=O)CBr)CC3)c2nc1C	758534386	GEIMNYRVYHDGQB-UHFFFAOYSA-N	445.314	1.826	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)c2cn(CCOc3ccc(C=O)cc3Cl)nn2)c1	763355592	YJQOXQUZNPPBFP-UHFFFAOYSA-N	438.831	1.769	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)ccc1N1CCCC1=O	763468752	TWDVAHCXUYFMNL-UHFFFAOYSA-N	441.400	1.130	50	20	IDGD	
COC(=O)[C@@H](C)Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(OC)c(OC)c2)cc1	763552123	VYBOCJKZRJCPFI-ZDUSSCGKSA-N	443.456	1.455	50	20	IDGD	
CNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)COc2ccccc2-c2ccccc2)c1	763644275	STUCGSKMTIOVPR-UHFFFAOYSA-N	446.463	1.878	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2cccc(N3CCOC3=O)c2C)c1	763644288	HZLDYOZYSXRFAF-UHFFFAOYSA-N	440.456	1.733	50	20	IDGD	
COCCOc1cc(C)ccc1NC(=O)C(=O)NNC(=O)COc1cc(C)cc(C)c1	763651235	YKNLMQDDUXUOCR-UHFFFAOYSA-N	429.473	1.802	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cnc(-c3ccccc3)s2)cc1	763661867	QGLNLLVWNFNPQD-UHFFFAOYSA-N	426.454	1.984	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(C(C)(C)C(=O)OC)cc1	763710635	BMMMTUYESIPJIQ-UHFFFAOYSA-N	441.484	1.865	50	20	IDGD	
COC(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)c1	763728834	ROTQMCXEOCYUID-UHFFFAOYSA-N	444.875	1.665	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(-n3ccnc3C)nc2)c1C	763839278	CXVRUTGVJJLTFS-OAHLLOKOSA-N	436.472	1.746	50	20	IDGD	
Cc1ccc(Cn2nccc2NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)s1	763859221	ZFQPDHQEBFDTJN-ZDUSSCGKSA-N	445.476	1.994	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cccc(OCC#N)c2)cc1	763862412	XFYBNWPRJMGZNQ-AWEZNQCLSA-N	426.429	1.541	50	20	IDGD	
CC(C)CC(=O)NNC(=O)C(=O)Nc1ccc(S(=O)(=O)NC2=NCCCCC2)cc1	763880976	CELLYMRQRYZFJT-UHFFFAOYSA-N	437.522	1.069	50	20	IDGD	
COC(=O)c1cc(OC)ccc1NC(=O)C(=O)NNC(=O)CCSc1ccc(F)cc1	763902589	NYXQOMIPLKDLMH-UHFFFAOYSA-N	449.460	1.889	50	20	IDGD	
CSCc1cccc(NC(=O)C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)c1	763944075	LJLKNLCUHUTPNW-UHFFFAOYSA-N	425.470	1.841	50	20	IDGD	
O=C(Cc1ccsc1)NNC(=O)C(=O)Nc1ccc(CCN2CCSCC2)cc1	764024051	ABZVKBLWAZMJAA-UHFFFAOYSA-N	432.571	1.668	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1cc(F)ccc1OC[C@H]1CCCO1	764040296	DVLOPEHKBCXJEU-CQSZACIVSA-N	431.420	1.792	50	20	IDGD	
O=C(NNC(=O)c1cccc(C(F)(F)F)c1)C(=O)Nc1ccc(N2CCOCC2)cc1	764040902	QUXMLMHGWUPRHP-UHFFFAOYSA-N	436.390	1.942	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccc(C(=O)N(C)C)c(Cl)c1	764135264	FNHKYIPFFYXUDQ-UHFFFAOYSA-N	432.864	1.379	50	20	IDGD	
C[C@@H]1CN(Cc2cccc(NC(=O)C(=O)NNC(=O)Cc3cccnc3)c2)C[C@@H](C)O1	764268364	JQVPHKUKLFMGHG-HZPDHXFCSA-N	425.489	1.019	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1ccc(-c2ncc3n2CCCC3)cc1	764276908	FASKWEFDAOIIAB-UHFFFAOYSA-N	449.467	1.757	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)C(=O)Nc1ccccc1CN1CCSCC1	764288894	OFUTWHMCWHWURQ-UHFFFAOYSA-N	442.541	1.660	50	20	IDGD	
COc1cccc(Cn2ccc3ccc(NC(=O)C(=O)NNC(=O)Cc4cc[nH]n4)cc32)c1	764292835	GLUURRXXCHEYCN-UHFFFAOYSA-N	446.467	1.750	50	20	IDGD	
COc1cc(OC)c(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1F	764345698	IWRDNPDXHWXJKO-UHFFFAOYSA-N	427.392	1.428	50	20	IDGD	
CCN(CC)C(=O)c1ccccc1NC(=O)C(=O)NNC(=O)c1ccc(O)c(Cl)c1	764345980	PCCBCYAYFJRXAF-UHFFFAOYSA-N	432.864	1.927	50	20	IDGD	
CN(C)C(=O)C[C@@H]1CN(C(=O)C(=O)NNC(=O)Cc2ccncc2)c2ccc(Cl)cc21	764353954	NPQSHCGONPEDQZ-CQSZACIVSA-N	443.891	1.034	50	20	IDGD	
CN(C)CCOc1cccc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)c1	764371411	ZNNBAVGOTOBYON-UHFFFAOYSA-N	436.415	1.385	50	20	IDGD	
Cc1ccccc1-n1nccc1NC(=O)C(=O)NNC(=O)C(F)(F)Oc1ccccc1	764379786	KOWGYGNCRWPNPV-UHFFFAOYSA-N	429.383	1.938	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)cc1OC	764382408	JOLUQAAXXSKCGQ-UHFFFAOYSA-N	429.458	1.945	50	20	IDGD	
Cc1nc(-c2ccc(NC(=O)C(=O)NNC(=O)c3cc(-c4cccs4)[nH]n3)cc2)n[nH]1	764382615	NGEFFZFQMPWUCL-UHFFFAOYSA-N	436.457	1.631	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc4c(c3)C(=O)NCC4)n[nH]2)cc1	764384881	LWJNQQIUWZJXGS-UHFFFAOYSA-N	446.467	1.325	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)C(=O)Nc1ccc2c(c1)OC(F)(F)O2	764393944	LKCDDRQXINJHAM-UHFFFAOYSA-N	425.369	1.592	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)n(-c2ccccc2)n1	764405722	XMGULFKASJQRKI-UHFFFAOYSA-N	425.470	1.765	50	20	IDGD	
CN(C)C(=O)c1ccc(C=NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)[nH]1	764830780	MRXYMUQTUIESLI-UHFFFAOYSA-N	430.940	1.638	50	20	IDGD	
Cc1cccc(S(=O)(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)c1	765118932	IHUDCCBSLKMMSH-UHFFFAOYSA-N	436.965	1.776	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)Cn1cc2ccccc2n1	766664307	PDWVNISDMJSFEM-UHFFFAOYSA-N	440.935	1.655	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)[C@@H](c1ccccc1F)N1CCOCC1	767351889	CFKORCJVHNBVQJ-JOCHJYFZSA-N	443.475	1.441	50	20	IDGD	
CCc1cccc(CC)c1S(=O)(=O)N1CCN(S(=O)(=O)CBr)CC1	767849442	FFGPIAYTRITWJM-UHFFFAOYSA-N	439.397	1.800	50	20	IDGD	
CC(=O)N1CCN(c2ccc(C(=O)NNc3cc(C#N)cc(Cl)n3)cc2[N+](=O)[O-])CC1	768696036	WPJVDFZBCDLKCY-UHFFFAOYSA-N	443.851	1.940	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)c3ccccc3S(=O)(=O)N3CCCCC3)nc21	770969489	QRPXROFJKGLMJF-UHFFFAOYSA-N	431.478	1.000	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)[C@H]1CC(=O)N(Cc2ccccc2)C1	772199256	NGZMLEJBKJPZKH-INIZCTEOSA-N	428.876	1.152	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C1=NN(c2ccc(F)cc2)[C@@H](C(N)=O)C1	772968134	DCGYVWPXSUEEPQ-APPDUMDISA-N	447.854	1.514	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)N[C@@H]1CCCO[C@@H]1CC(C)C	773133239	XAPIEFVXPBRAIB-HUUCEWRRSA-N	425.555	1.826	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNc2c(F)cccc2F)cc(S(C)(=O)=O)c1	773709718	NOBZOEFFSZFWGR-UHFFFAOYSA-N	427.385	1.237	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc([C@H](C)N3CCOCC3)c2)cc1F	773885295	LJWJQXPIQHZOOC-HNNXBMFYSA-N	428.464	1.927	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(N3CCN(C)CC3)c(Cl)c2)cc1F	773889123	MLOPGCFGFBOKPE-UHFFFAOYSA-N	447.898	1.939	50	20	IDGD	
CN(NC(=O)c1ccc(N2CCCC2)nn1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776212763	KVPKCNBXTGWCGN-UHFFFAOYSA-N	433.513	1.326	50	20	IDGD	
Cc1cc(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)nn1[C@H](C)C1CC1	777405139	GVVODXZZWGGUJD-OAHLLOKOSA-N	433.534	1.940	50	20	IDGD	
COCCCNC(=O)NNS(=O)(=O)c1cc([N+](=O)[O-])c(Br)cc1C	777617729	ZGANUDFNXNPLOM-UHFFFAOYSA-N	425.261	1.195	50	20	IDGD	
Cc1cc(OCC(=O)N2CCN(S(=O)(=O)CBr)CC2)ccc1Cl	777777033	CJYBZGAQFQKNJA-UHFFFAOYSA-N	425.732	1.854	50	20	IDGD	
COC(=O)c1scc(C)c1NC(=O)C(=O)NNC(=O)c1cc(-c2ccccc2)on1	782120742	KRUVVARGFJXWBN-UHFFFAOYSA-N	428.426	1.898	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)N1CCC[C@H](n2ccc(C(F)(F)F)n2)C1	782501666	AYTSGPNWWHJOOX-NSHDSACASA-N	444.439	1.771	50	20	IDGD	
Cn1cnn(-c2ccc(NC(=O)C(=O)NNc3ccc(Br)cc3F)cc2)c1=O	783087039	SNAHKMDQWOGBKB-UHFFFAOYSA-N	449.240	1.554	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)c1cnc(NC(=O)OC(C)(C)C)cn1	783240090	VFCPCANSGPBIJK-UHFFFAOYSA-N	443.460	1.679	50	20	IDGD	
CN1CCN(Cc2cccc(NC(=O)C(=O)NN=c3sc4ccccc4n3C)c2)CC1	783349567	MIHXHEIILGRSPX-UHFFFAOYSA-N	438.557	1.558	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccc(Br)cc2Cl)cn1	784840615	BNGPFWUHYMDLMN-UHFFFAOYSA-N	447.698	1.983	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)C(=O)Nc2ccc(N3CCSCC3)cc2)c1	784844878	SKXGPHISVIBFOZ-UHFFFAOYSA-N	434.543	1.725	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)N1C[C@H]2CCCN2c2ccccc21	785023921	QFASMUWSAOXHSN-CYBMUJFWSA-N	425.401	1.077	50	20	IDGD	
C#CCOc1ccc(F)cc1NC(=O)C(=O)NNc1c(OC)cccc1S(C)(=O)=O	785330462	HVPPAWOXOXZHCG-UHFFFAOYSA-N	435.433	1.332	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1ccn(Cc2ccccc2)n1	785337528	GJKREDBALSRCIJ-UHFFFAOYSA-N	443.485	1.425	50	20	IDGD	
N#C/C(=C\c1ccccc1)C(=O)OCC(=O)N(C[C@@H]1CCCO1)[C@H]1CCS(=O)(=O)C1	785378828	SXQWSQVSKZSJTB-GFLCFMILSA-N	432.498	1.331	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)N2CCCN(c3nnc(C(F)(F)F)s3)CC2)c1	786116507	BTAXKSSJLKRLLY-UHFFFAOYSA-N	439.423	1.995	50	20	IDGD	
C=C[C@@](C)(O)CC(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccc(OC)cc2)c1	788267660	NEKALUJZMRRCFD-HXUWFJFHSA-N	433.486	1.584	50	20	IDGD	
CN(NS(=O)(=O)c1ccc(Cl)nc1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	788918727	ZQLISUWEURKLCO-UHFFFAOYSA-N	433.918	1.533	50	20	IDGD	
COc1cc(NNC(=O)C(=O)Nc2ccc(S(=O)(=O)N(C)OC)cc2)ccc1Cl	789804363	AGOWFHRZSPXBBT-UHFFFAOYSA-N	442.881	1.612	50	20	IDGD	
CCc1nnc(-c2cccc(NC(=O)C(=O)NNC(=O)[C@H]3OCC[C@H]3c3ccccc3)c2)o1	789812813	NYWHCSRAEUGGBA-HKUYNNGSSA-N	449.467	1.958	50	20	IDGD	
Cc1sc(CC(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)nc1C(C)C	789992190	VBJBJMPZAMXGOP-UHFFFAOYSA-N	443.573	1.723	50	20	IDGD	
C[C@@H](CN1CCOCC1)N(C)C(=O)CCC(=O)C(C#N)=C1N(C)c2ccccc2N1C	790134847	DCJIHURYUKXNRK-KRWDZBQOSA-N	425.533	1.836	50	20	IDGD	
CC[C@@H](C)CC(=O)NNC(=O)C[C@H]1c2cc(OC)c(OC)cc2CCN1S(C)(=O)=O	791092504	WOVMEBDVOCDBCF-CJNGLKHVSA-N	441.550	1.536	50	20	IDGD	
COC(=O)Cc1cccc(NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)n1	792406513	JTDUSQXKNAWMOH-UHFFFAOYSA-N	440.504	1.162	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2ccc(C)c(Br)n2)cc1	793025252	JJBYEYDWLNABPQ-UHFFFAOYSA-N	435.278	1.880	50	20	IDGD	
COC(=O)Cn1ncc(NC(=O)C(=O)NNc2ncc(C(F)(F)F)cc2Cl)c1C	797027912	GCVOUGUOKYGGTB-UHFFFAOYSA-N	434.762	1.514	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C2(S(C)(=O)=O)CCN(C(=O)OC(C)(C)C)CC2)o1	797052118	IFADIKHGWYCQJM-UHFFFAOYSA-N	429.495	1.163	50	20	IDGD	
O=C(NNC(=O)C(=O)N1CCCC1)C(=O)Nc1ccc(OC(F)F)c(C(F)(F)F)c1	797068988	DUIMJDDFXOAJDL-UHFFFAOYSA-N	438.309	1.015	50	20	IDGD	
CO[C@@H](C(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12)c1cnn(C)c1	798826083	HKOZGTFIHVYXRE-HXUWFJFHSA-N	446.467	1.327	50	20	IDGD	
C[C@H](C(=O)NNC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1)n1cnc(C#N)n1	798830508	SHFWYQGYSBTZBH-CQSZACIVSA-N	427.428	1.420	50	20	IDGD	
CC(C)(Cc1nc2ccccc2[nH]1)C(=O)N1CCN(S(=O)(=O)CBr)CC1	798990621	XUBPXZSHJAWWMD-UHFFFAOYSA-N	443.367	1.958	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)N[C@@H]2CCCN(C(=O)Cc3ccccc3)C2)nc2ccccc21	802475519	DHZCCTIUOPKOBL-GOSISDBHSA-N	448.527	1.680	50	20	IDGD	
CNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)CCc2ccccc2)c1Br	806977833	ALMCKAZGVCFSON-UHFFFAOYSA-N	447.289	1.527	50	20	IDGD	
COc1cccc([C@H](CNC(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)N(C)C)c1	807005202	BZFVRWWSZANOCN-KRWDZBQOSA-N	446.504	1.968	50	20	IDGD	
COC[C@@]1(C(=O)NNC(=O)CNc2cccc(OC)c2)CCN(C(=O)OC(C)(C)C)C1	810006769	PJMPYOPDDGXOIV-OAQYLSRUSA-N	436.509	1.528	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@H](C)Cc1cnc2ccccc2n1	814736847	SXYCQULYMRERGM-CYBMUJFWSA-N	440.529	1.871	50	20	IDGD	
Cc1ccccc1COc1cccc(NC(=O)C(=O)NNC(=O)[C@@H]2CCc3nncn3C2)c1	815691074	DWJMTBLJQJOPFJ-MRXNPFEDSA-N	448.483	1.514	50	20	IDGD	
Cc1c(CSC(C)C)cccc1NC(=O)C(=O)NNC(=O)[C@H]1CCc2nncn2C1	815691907	FJBWAIGYCYEXMT-AWEZNQCLSA-N	430.534	1.577	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCO1)C(=O)Nc1cc(Cl)ccc1I	815779859	ZFAZLNFPHINNAQ-SNVBAGLBSA-N	437.621	1.210	50	20	IDGD	
O=C(Cn1nnc2c1CCCC2)NNC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1	816828484	GYPIVUUXPDIKNB-UHFFFAOYSA-N	442.483	1.866	50	20	IDGD	
CCn1c(NNC(=O)Cc2c(C)nc3nc(SC)nn3c2C)nc2ccccc2c1=O	849212635	LHQCEZDEZHINEC-UHFFFAOYSA-N	438.517	1.879	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)[C@H]1CS[C@@H](Cc2ccccc2F)C(=O)N1	892665579	QHDSEPUIISBIEZ-XZOAIXRZSA-N	449.479	1.722	50	20	IDGD	
Cc1cc(C)nc(SCc2ccc(C(=O)NNC(=O)Cn3cc([N+](=O)[O-])cn3)cc2)n1	912979750	TVVXCFUMQSDFKB-UHFFFAOYSA-N	441.473	1.952	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(C)c(C(=O)NNC(=O)COc2cc(C)cc(C)c2)c1	913446149	WJQWRGVXBLNFLT-UHFFFAOYSA-N	449.529	1.377	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)CNC(=O)Cc2cccc3ccccc23)c2ccccc2c1=O	913573074	PMKGYGLDSRYYAO-UHFFFAOYSA-N	443.463	1.207	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)NCCNS(=O)(=O)c1ccc(C)cc1	914536164	KLPJVHCKFACWKT-UHFFFAOYSA-N	440.909	1.580	50	20	IDGD	
COc1ccnc(NNC(=O)c2ccc(OC)c(S(=O)(=O)N3C[C@H](C)C[C@@H](C)C3)c2)n1	914763134	QISCISFLNQPQMB-ZIAGYGMSSA-N	449.533	1.917	50	20	IDGD	
O=C(NCC#Cc1ccccc1)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	916246363	UARPAWAQMYLTBV-UHFFFAOYSA-N	426.498	1.467	50	20	IDGD	
CC(=NNC(=O)CCN1CCCCCC1)c1ccc(S(=O)(=O)N2CCNCC2)cc1	916356001	UAGVOWHCTWSSGM-UHFFFAOYSA-N	435.594	1.387	50	20	IDGD	
CCNC(=O)COc1ccc(CNC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1OC	916388908	LVHNJPSEUMXDDX-UHFFFAOYSA-N	445.432	1.263	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NC[C@@H](C)N2CCc3ccccc32)nc1	916622982	UVDDSRMITKNQHZ-OAHLLOKOSA-N	432.550	1.846	50	20	IDGD	
NC(=O)c1cn(CC(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)c2ccccc12	919568623	IPQNVFOLCHNBRB-UHFFFAOYSA-N	428.832	1.398	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)N[C@@H]1CCCN(S(C)(=O)=O)C1	920239912	IGKVMGCNDANUKN-RHSMWYFYSA-N	434.518	1.362	50	20	IDGD	
CCCCOc1ccc(C(=O)NN/C=C2\C(=O)NC(=S)N(CC(C)C)C2=O)cc1OC	920980108	XJTMBZODVUOQNG-RVDMUPIBSA-N	448.545	1.892	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNC(=O)C2=CC=CN3CCS(=O)(=O)N=C23)cc1	921235540	NFXHERRTZITEMS-UHFFFAOYSA-N	432.502	1.370	50	20	IDGD	
CC(C)c1noc2ncc(C(=O)OCC(=O)NNC(=O)[C@H]3COc4ccccc4O3)cc12	928713104	AELUJFQYKINGHG-MRXNPFEDSA-N	440.412	1.490	50	20	IDGD	
Cc1cc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c2ccc(F)cc2n1	1115982643	QVWXZSGJZCNLJM-IBGZPJMESA-N	439.399	1.827	50	20	IDGD	
CN1CCN(c2ccccc2CNC(=O)NNC(=O)Cc2nc3ccccc3n2C)CC1	1115991430	BFQRSQSZKQQHTM-UHFFFAOYSA-N	435.532	1.398	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)c2n[nH]cc2I)cc1OC	1116622865	LQSFPWUOFNKSIB-UHFFFAOYSA-N	430.202	1.496	50	20	IDGD	
O=C(NNC(=O)[C@@H]1C[C@@H](O)CN1C(=O)OCc1ccccc1)c1cncn1-c1ccccc1	1319261628	QVGSJBXNOZQRFJ-MOPGFXCFSA-N	449.467	1.405	50	20	IDGD	
COc1ccc2c(c1)OC[C@H](NC(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1)C2	1319911591	NOHLQGIIRGMPAW-MRXNPFEDSA-N	448.520	1.976	50	20	IDGD	
COc1cccc(C[C@@H](O)C(=O)NNC(=O)[C@H](C)Oc2cccc(Br)c2)c1	1320740179	RGXKZEKKWRQIGW-YVEFUNNKSA-N	437.290	1.976	50	20	IDGD	
O=C(CN1CCC([C@@H]2C(=O)Nc3ccccc32)CC1)NNC(=O)c1cccc([N+](=O)[O-])c1	1322781448	QWFTXKAHFYRVDL-FQEVSTJZSA-N	437.456	1.804	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNS(=O)(=O)c2ccc(C#N)cc2F)CC1	1323086259	VSYKSJWEMVHLKJ-UHFFFAOYSA-N	426.470	1.654	50	20	IDGD	
C[C@@](O)(Cn1cc(C(F)(F)F)ccc1=O)C(=O)NNC(=O)c1cncn1-c1ccccc1	1344337254	ZHFPAFSRSFFKKE-LJQANCHMSA-N	449.389	1.265	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(Cl)c4nncn4c3)C2)C1	1778947011	SHPIDRHANMEAGD-UGSOOPFHSA-N	426.304	1.844	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)C/N=C/c3ccco3)C2)C1	1779133330	YAGPSWAPGVDQHN-PHJHEXBDSA-N	426.311	1.559	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1ncn(-c3ccccc3)n1)CCO2	1779295277	DQIBZHCPMRUIIL-OAQYLSRUSA-N	443.580	1.562	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1nc3ccccn3n1)C2	1779543430	BEUBFLHJHSGCLZ-IIBYNOLFSA-N	445.596	1.708	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@](C)(Cl)CCl)C1)n1ccnn1	1780716454	IQNUCPUXUCDWGX-KJWYOANISA-N	432.352	1.589	50	20	IDGD	
COc1ccccc1OCC(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781324937	FVENLHHBYQIWQI-SJLPKXTDSA-N	445.285	1.594	50	20	IDGD	
O=C(c1cncc2cnccc12)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781334148	MNUKKXZCZKSFFP-CRAIPNDOSA-N	437.269	1.764	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnc(N(C)C)o1)C2	1782171103	ONKJQGJCDYKVOV-ZXYWRSMDSA-N	428.917	1.122	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3nc4cc([N+](=O)[O-])ccc4[nH]3)C2)C1	1782187319	YULPVHFPBQEYLU-ORAYPTAESA-N	435.868	1.932	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3n[nH]c4c(Cl)cccc34)C2)C1	1782219623	CEMRBPWBDFAGOQ-IFXJQAMLSA-N	441.315	1.914	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)Oc2cccnc2)C1	1782573668	MVVCAYZSBDQJIF-DZKDUJFISA-N	439.940	1.617	50	20	IDGD	
O=C(/C=C/c1ccc(O)c(O)c1O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Cl)C2	1783222001	DYRWGYQWYSKNOH-HNJKLQPHSA-N	442.871	1.865	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)C3(O)CCC3)[C@H]2C1	1783516163	MNEBOFRANQXWQZ-YXMSTPNBSA-N	431.371	1.691	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)/C=C/c3ccc([N+](=O)[O-])o3)CCO2)C1	1783529785	MVWNPMXHHNASSU-VKFAVASQSA-N	442.266	1.814	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc4nccnc4c3)CCO2)C1	1783534555	WEMZVBZZZVRUCG-DJJJIMSYSA-N	433.306	1.857	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cc(-c4cccnc4)[nH]n3)CCO2)C1	1783536153	FGHQRGAJXJHULX-BFUOFWGJSA-N	448.321	1.699	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCOc3ccc(F)cc3)[C@H]2C1	1783792610	KYEFVYLFJFVGDY-FZDIXFNVSA-N	442.915	1.828	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cc4ccc(OC)cc4[nH]3)CCO2)C1	1783875197	OSEYRCGUZXUQRE-IIBYNOLFSA-N	435.908	1.874	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1c(F)cccc1Cl)CCO2	1783934993	MKSUCFXQIQSOMV-HXUWFJFHSA-N	440.903	1.296	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C3CCC(C(F)(F)F)CC3)C[C@@H]21)[C@H](O)CCl	1784085329	GGMHORQSRMEFOE-CBNMCHAISA-N	440.890	1.935	50	20	IDGD	
COc1c(Cl)cccc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]2C1	1784095876	NCJFXUBFRKNIPW-MZGVZZPPSA-N	431.316	1.542	50	20	IDGD	
CCCNC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](Br)CC)C[C@@H]21	1784375744	DJDXHBJOHJNEHR-VGWMRTNUSA-N	446.386	1.446	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(C)(C)NC(C)=O)[C@H]2C1	1784530849	VMTHTWKRRZFNLU-AJNGGQMLSA-N	432.359	1.054	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3ccc4c(c3)CCC4)[C@H]2C1	1785047396	IFPFSKJLSRMZFH-TUFLPTIASA-N	434.964	1.951	50	20	IDGD	
Cc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)CBr)C[C@@H]32)nn1C	1786005227	MUSRSDHSIFNZLQ-PCBIJLKTSA-N	427.343	1.353	50	20	IDGD	
Cc1ccc(NCCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](O)CCl)C[C@@H]32)c(C)c1	1788665083	DBRZFXOTHLOMJX-XEYPJELSSA-N	437.968	1.685	50	20	IDGD	
COc1ccnc(C(=O)Nc2ccc(C3(NC(=O)c4ccc(B(O)O)cc4)CCC3)cc2)c1	1789756307	AXHFACUQBIOHKA-UHFFFAOYSA-N	445.284	1.832	50	20	IDGD	
Cn1cc(CCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]3C2)cn1	1789866380	QLZZQZJRLUCKRJ-IUVQAAGXSA-N	431.364	1.569	50	20	IDGD	
CC[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]2C1)N(CC)CC	1789921812	XPCJOPHHIRZOGP-UVPYHEFZSA-N	436.366	1.777	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C3(C(F)(F)F)CC3)C[C@@H]21)[C@H](F)Br	1789926364	VDAZUVQODHSTEU-NAKRPEOUSA-N	431.224	1.999	50	20	IDGD	
CCCCC[C@@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21	1790892949	QFOOUVNPTZCDJA-LGYWMIHWSA-N	430.354	1.176	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(C(F)F)no3)C[C@@H]21	1791057360	BLAUUGODHGJEHE-YVNDNENWSA-N	436.253	1.989	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc(F)c(C#N)c3)C[C@@H]21	1791253519	DVDPKYDPVXOLAA-RMRDIRSESA-N	437.899	1.473	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)COc1cccc(Cl)c1	1792832995	UHJFAUMUGGRXPH-BJWYYQGGSA-N	436.940	1.730	50	20	IDGD	
Cc1nnc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)CBr)s1	1792868490	YRRZLWGSAVORDG-ADGXKJENSA-N	431.356	1.010	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1csnn1	1793731083	SKQOZDQOVFGKHO-RNJOBUHISA-N	443.957	1.922	50	20	IDGD	
CCOCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](Br)Cc1ccccc1)C2	1795212477	XHNSPCWHUIAMIZ-ZMMAXQRCSA-N	439.350	1.619	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2n[nH]cc2c1	1796147000	KTMZXEPKIWXSPW-RMIITELYSA-N	435.322	1.797	50	20	IDGD	
O=C(Cc1c(F)cccc1F)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1	1796188502	NVKZWGNFQNXKCC-BJWYYQGGSA-N	428.244	1.139	50	20	IDGD	
CCn1nc(C(C)C)cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1	1796191902	NLLCZHJJMWFTGS-REPLKXPHSA-N	438.337	1.272	50	20	IDGD	
COc1cccc2[nH]cc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3cccc(B(O)O)c3)c12	1796192946	CUCXJNGJLOJPGD-BCDXTJNWSA-N	447.300	1.422	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnc3ncccn13)C2	1796892434	BBHABWUUNLOBTQ-LCFLCXBCSA-N	448.487	1.115	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C/N=C/c1ccco1	1797839723	ZZEWJICMDOGZNY-BYWNUXONSA-N	426.311	1.462	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3cnccc3[nH]1)C2)[C@@H](F)Br	1799349028	GCKGBKPPXWWVJD-BAESOJJISA-N	425.258	1.457	50	20	IDGD	
Cc1cc(C(=O)NCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@](C)(Cl)CCl)no1	1800080540	IHTZOJKNPQCDLU-SJBDTSRBSA-N	431.320	1.587	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCc1ccc(O)nn1	1801234535	XRUSYPHMJMFJAH-REBRKWNGSA-N	425.327	1.784	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc3c(c1)NC(=O)[C@@H](C)O3)C2	1802279645	YTQIAXGPMUHWNZ-YMILTQATSA-N	435.908	1.912	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cn(C)c3ncccc13)C2	1802337802	TUWCECVYNKYFPT-MUJYYYPQSA-N	426.521	1.198	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)c2ccsc2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1	1807369812	WLNZCLKGAROAIT-XLIONFOSSA-N	435.314	1.456	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@H](CNC(=O)Cn2ccccc2=O)[C@@H]1c1cccnc1	1807440829	RPJCWLVQBLDIKJ-AVRDEDQJSA-N	442.592	1.801	50	20	IDGD	
Cc1cc(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)c[nH]1	1808776628	VNWMMTYELGQLFG-NQIIRXRSSA-N	432.289	1.031	50	20	IDGD	
CC(C)N[C@H](C(=O)N1CCCC2(CCN(C(=O)CCC(=O)NN(C)C)CC2)C1)C(C)C	1809949888	PXPNNVKECQRSIH-NRFANRHFSA-N	437.629	1.613	50	20	IDGD	
O=C(/C=C\C(=O)NC1CC1)NC[C@@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1	1810123637	DZMOWQMIYKNFBM-SXZZRKSZSA-N	449.349	1.707	50	20	IDGD	
CC(=O)N(C)CCC(=O)N1CC[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]1c1cccnc1	1810539830	JJMCMIWSIXMOIG-GHTZIAJQSA-N	434.613	1.807	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@@H]1c1cccnc1)c1ccnnc1O	1811231121	XRGOMPJTZOELJQ-IACUBPJLSA-N	438.257	1.587	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)c1cnc2ccc(F)cn12	1812237938	LZGJUTNNWAGKSI-FNHZYXHNSA-N	445.882	1.788	50	20	IDGD	
CC(=O)N(C)CCC(=O)N1CC[C@H](CNC(=O)[C@@H](C)Br)[C@@H]1c1cccnc1	1812864173	GBSNJCYCWYORMS-QBIMZIAESA-N	439.354	1.739	50	20	IDGD	
CCOC(=O)C(C)(C)C(=O)N1CC[C@H](CNC(=O)[C@@H](Cl)COC)[C@@H]1c1cccnc1	1813036984	AAYQLNLGWYYIMB-IKGGRYGDSA-N	439.940	1.931	50	20	IDGD	
C[C@]1(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)CC=CCC1	1813579538	OFNCUJHVPSMOIV-LFAGZIFBSA-N	447.344	1.827	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](O)CCl)n[nH]1	1814871230	LFYGNVTVMFJYQV-TYOURTJLSA-N	449.899	1.136	50	20	IDGD	
Cc1nnc(CCC(=O)Nc2cc([C@H]3CCCCN3C(=O)[C@H](O)CCl)[nH]n2)s1	1815913154	NMVGFXRVBPJHAY-CHWSQXEVSA-N	426.930	1.794	50	20	IDGD	
O=C(CCBr)Nc1cc([C@H]2CCCCN2C(=O)CN2CCOC2=O)[nH]n1	1816782249	RHWPVXBKDTUJAK-GFCCVEGCSA-N	428.287	1.639	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1ncccc1F	1819971764	GFCQVSBNMOOIDW-QGZVFWFLSA-N	437.240	1.243	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@](C)(O)C(F)(F)F)[nH]n1	1822410955	UBGIIMDEUYXQLK-SJCJKPOMSA-N	448.446	1.088	50	20	IDGD	
CCC[C@H](NC(C)=O)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](Cl)COC)[nH]n1	1823441894	CHWIJPUIVQPIFL-IJEWVQPXSA-N	427.933	1.960	50	20	IDGD	
CC[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCn1cncn1)CC2	1825453285	VEKPVWDALIFAOQ-GHMZBOCLSA-N	441.355	1.910	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1[nH]nc3ccncc13)CC2	1825998618	KLPWQLGQMVDHOS-MWLCHTKSSA-N	434.909	1.894	50	20	IDGD	
C[C@@H](C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2)n1cccc1	1826589047	SHPSUWGXNKDRBJ-XJKSGUPXSA-N	438.318	1.111	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(F)nc1F)CCO2	1829532752	XMFKCUMHKSZDRQ-IBGZPJMESA-N	443.523	1.281	50	20	IDGD	
Cc1ccc(OCCC(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)cc1	1830206147	VTFQTNDBPSZMNQ-UYAOXDASSA-N	428.888	1.755	50	20	IDGD	
C=CCO[C@H](C)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H](C)CBr)CCO2)C1	1830536084	XXTVFIMJTZZDAJ-DAYGRLMNSA-N	433.343	1.065	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)COc3cccnc3)CCO2)C1	1832672062	NJIWRZXLSODEPA-XLIONFOSSA-N	425.913	1.324	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)/C=C/c3ccco3)CCO2)C1	1833078555	ZVYFDZOGVBTEFC-FHWYHTKLSA-N	427.295	1.533	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)C3CC(O)C3)CC2)CC1	1833276215	BJUNXIBLFCIBIX-IMRCBTMISA-N	430.387	1.502	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3ccnc(Cl)c3)CC2)CC1)[C@@H](O)CCl	1833309104	NOEXPLPLOKDTFN-INIZCTEOSA-N	429.348	1.520	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3nc(C)c(C)[nH]c3=O)CC2)CC1	1833939542	DRFZWFAVSWKJIA-KRWDZBQOSA-N	437.972	1.589	50	20	IDGD	
CC(C)NCCC(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)CBr)CC2)CC1	1834780064	MVZRVDFRYKBWOG-INIZCTEOSA-N	445.446	1.977	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3cc(F)cc(F)c3)CCO2)C1	1836121652	HDVLGUPPBGGCNY-YLJYHZDGSA-N	430.879	1.981	50	20	IDGD	
O=C(C1=NO[C@H](c2ccccc2)C1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1836587281	IDNBBGWISQGRRQ-ZWOKBUDYSA-N	439.871	1.495	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836717273	AAPPWIMLFJFQTM-PBHICJAKSA-N	429.772	1.821	50	20	IDGD	
O=C1Cc2cc(C(=O)N3CCO[C@]4(COCCN(C(=O)C(Cl)Cl)C4)C3)ccc2N1	1836791694	MQTIKRQAGNQFCG-LJQANCHMSA-N	442.299	1.055	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cnnc(Cl)c3)CC2)CC1	1837225473	CYVANHZWDHJGTD-MRXNPFEDSA-N	445.347	1.996	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(CC#N)cc3)C2)C1	1837715077	UMIYQUHPGXZIFJ-JOCHJYFZSA-N	445.592	1.674	50	20	IDGD	
C[C@H](Cc1ccco1)C(=O)N1CCOC[C@@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1837717694	MCSSHXGWHWMSCT-DYESRHJHSA-N	438.597	1.766	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)Cc3ccn(C)n3)CC2)CC1	1837948223	XEXSZLJLVGIWCU-AWEZNQCLSA-N	441.370	1.745	50	20	IDGD	
O=C(c1cc(CO)on1)N1CCC(OC2CCN(C(=O)[C@H](F)Br)CC2)CC1	1838556003	SSEUCDDXFLUFNH-HNNXBMFYSA-N	448.289	1.470	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)cc1N(C)C	1839116000	QMVBMHKAXLBKEM-XLIONFOSSA-N	443.903	1.366	50	20	IDGD	
CC(C)N1CCC[C@H]1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2	1840036110	FONCARCNMKXDSV-GJYPPUQNSA-N	446.386	1.099	50	20	IDGD	
O=C(c1cc2ncsc2[nH]1)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840188439	JVXASJOTEIUCKA-INIZCTEOSA-N	433.317	1.498	50	20	IDGD	
O=C(c1cccn2cncc12)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840188600	SKDRVTQUCNZOPG-SFHVURJKSA-N	427.288	1.208	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CC[C@H](O)CC1)CCO2	1840271501	BDXBIRGPOUWOMT-FPXQBCRKSA-N	447.370	1.167	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)n1cccc1)CCO2	1840354037	AYFHTJPAPWNABE-GJYPPUQNSA-N	442.354	1.679	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)c2c[nH]c(-c3ccc(F)cc3)c2)C1	1842263517	KWHLDGYOKYOLPM-UHFFFAOYSA-N	447.275	1.631	50	20	IDGD	
Cc1nn[nH]c1C(=O)N1CCCC12CN(C(=O)[C@H](Br)Cc1ccccc1)C2	1843161375	XQURPFFTPZGUKH-OAHLLOKOSA-N	432.322	1.936	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)CCN1C(=O)Cc3ccccc3C1=O)C2	1845162866	RPNQMHLPSMYUAV-QGZVFWFLSA-N	431.920	1.822	50	20	IDGD	
C[C@H](C(=O)N1CCCC12CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)C2)n1cnnn1	1846647830	VCYOXNZKOTVPSJ-BKNIFWKGSA-N	427.415	1.323	50	20	IDGD	
CC[C@H](C)C(=O)N1CCC[C@@H](C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)C1	726033389	GRTJDGBBBXAQTC-DZGCQCFKSA-N	434.449	1.184	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=S)Nc2ccc(C(N)=O)cc2)c2ccccc2c1=O	726438904	FOAPOVDBOYOXAQ-UHFFFAOYSA-N	438.513	1.927	50	20	IDGD	
C[C@]1(NNC(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)CCS(=O)(=O)C1	726720214	VIJGCHUFDSXXJE-SFHVURJKSA-N	432.493	1.638	50	20	IDGD	
CC(C)[C@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	727115271	NLPGNNIWKFDAME-FQEVSTJZSA-N	447.580	1.895	50	20	IDGD	
CC(C)(C)OC(=O)N(CCNC(=O)NNC(=O)c1nnc(O)c2ccccc12)C1CC1	727605738	BQNHQRGWNQQJJA-UHFFFAOYSA-N	430.465	1.679	50	20	IDGD	
O=C(CCc1nc(-c2ncccn2)no1)NNC(=O)Cc1nc(-c2ccccc2)cs1	727725166	RXOPDEXBKWRWCK-UHFFFAOYSA-N	435.469	1.973	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)[C@H]2CCCN2C(=O)/C=C\c2ccc(C(N)=O)cc2)cc1	728204287	CGTGWNSVMQOEPO-LOJRPPCJSA-N	449.511	1.358	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)[C@H]2CC[C@@H](C(F)(F)F)NC2=O)c1	728527774	RZRZVPKRPMTKPA-KWQFWETISA-N	438.200	1.676	50	20	IDGD	
O=C(CCc1nc(-c2ncccn2)no1)NNC(=O)c1cc(F)ccc1Br	728546135	NYNFRKDGBCAVOY-UHFFFAOYSA-N	435.213	1.822	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)C1(NS(=O)(=O)c2cccc(F)c2)CCCCC1	728849861	ADNGWGLHTFSWNQ-UHFFFAOYSA-N	434.493	1.592	50	20	IDGD	
O=C(NCc1ccc(N2CCOCC2)cc1)NNC(=O)C1CCN(c2ncccn2)CC1	728949341	PJJZMUHDUXNBAQ-UHFFFAOYSA-N	439.520	1.060	50	20	IDGD	
CCN1CCC[C@@H]1CN1C[C@@H](C(=O)NNC(=O)c2cc(-c3ccccc3)on2)CC1=O	729625634	AYWWJVRIYBMINQ-DLBZAZTESA-N	425.489	1.435	50	20	IDGD	
CN(C)N(C(=O)c1ccn(-c2cccc(Br)c2)n1)[C@@H]1CCS(=O)(=O)C1	730162788	VQHIEUQRYIHXFY-CQSZACIVSA-N	427.324	1.741	50	20	IDGD	
C[C@@H]1CCCCN1S(=O)(=O)c1cccc(C(=O)NNC(=O)COc2ccccc2O)c1	730782515	OUIYBHFGJDIDHM-OAHLLOKOSA-N	447.513	1.795	50	20	IDGD	
CCN(CC(=O)Nc1ccc(N2CCOCC2)cc1)[C@H](C)C(=O)NNC(=O)CC(C)C	732195114	HDSFUPJIIPPKGU-QGZVFWFLSA-N	433.553	1.366	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)c2occc2CS(=O)(=O)c2ccccc2)C[C@@H](C)O1	732259463	DYNKTSBEXLMONN-HZPDHXFCSA-N	449.529	1.514	50	20	IDGD	
C[C@@]1(NNC(=O)N[C@H]2CCN(c3ccccc3Br)C2)CCS(=O)(=O)C1	732476168	AFLHVGLNIMNBDX-BLLLJJGKSA-N	431.356	1.409	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)N[C@H](Cc2ccccc2)CN2CCOCC2)c1	732476746	VFGVVESNXDYXEP-HXUWFJFHSA-N	425.533	1.640	50	20	IDGD	
Cn1c(NNC(=O)[C@@H]2CS[C@@H](Cc3ccccc3F)C(=O)N2)nc2ccccc2c1=O	733261491	CNYKYSZCULRAQF-IRXDYDNUSA-N	441.488	1.359	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)c2c[nH]c3ccccc3c2=O)CC1	734825232	WLNSFGDDTNPJEE-UHFFFAOYSA-N	429.477	1.872	50	20	IDGD	
Cc1nn(C)cc1[C@@H](C)NC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	739033412	CBLAVJMSFPMEIP-CYBMUJFWSA-N	434.522	1.218	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c(Cl)c1Cl	742026606	UIBFNRRJFJHSHN-UHFFFAOYSA-N	443.272	1.601	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)CCN2C(=O)COc3ccccc32)cc1	743830395	DIPFOLXYTHRWJL-UHFFFAOYSA-N	432.458	1.059	50	20	IDGD	
COc1nc2sccn2c1C=NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	744563495	RXDKCIBJHOHQRR-UHFFFAOYSA-N	433.515	1.953	50	20	IDGD	
CCN1CCN(C[C@H](C)CNC(=O)NNC(=O)Nc2ccc(OC(F)F)cc2)CC1	745862936	QHRAPADDLZGBST-CQSZACIVSA-N	428.484	1.897	50	20	IDGD	
C[C@H](Oc1cccc(C=NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)c1)C(=O)O	746683016	QPKURNQKTSXYFB-JTQLQIEISA-N	425.850	1.603	50	20	IDGD	
Cc1nc(Cl)cc(NNC(=O)c2cc(S(=O)(=O)N3CCC[C@@H](C)C3)cn2C)n1	748334326	IQDMLZKIHOILCE-LLVKDONJSA-N	426.930	1.954	50	20	IDGD	
COc1cc(OC)cc(N2CC[C@@H](NC(=O)NNC(=O)COc3ccccc3OC)C2)c1	748659617	BQDGUKLCRYZYCQ-OAHLLOKOSA-N	444.488	1.701	50	20	IDGD	
CNS(=O)(=O)C1=CC(C(=O)NNC(=O)c2ccc(-c3ccc(F)cc3)s2)=S=C1	748696335	YVYXIDRSLGTMBG-UHFFFAOYSA-N	439.515	1.470	50	20	IDGD	
COc1ccccc1CC(=O)N1CCC(NC(=O)NNC(=O)Cn2nc(C)cc2C)CC1	749018664	MZZPWCYGYPYBBD-UHFFFAOYSA-N	442.520	1.073	50	20	IDGD	
CC(C)N1CCN(c2ccc(C(=O)OCC(=O)NNC(=O)c3cccs3)cc2)CC1	749282821	IMWFABCQFGFFCK-UHFFFAOYSA-N	430.530	1.897	50	20	IDGD	
CCC(CC)[C@H](C(=O)OCC(=O)NNC(=O)c1ccc(Cl)cc1)N1CCOCC1	750510994	CHXRKDWQLOLHRF-GOSISDBHSA-N	425.913	1.781	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=S)N[C@H](C)C2CC2)c1	751618645	IREOEIMZOMUXHG-SNVBAGLBSA-N	434.971	1.172	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2cc(C(=O)O)cc(C)c2Cl)cc1OC	753771302	VENDXEYCXFWUQJ-UHFFFAOYSA-N	428.850	1.987	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)c1cc(-c2cccs2)n(-c2ccccc2)n1	755065533	SFQRUZIKDGYNGG-ZDUSSCGKSA-N	430.511	1.797	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N(C)C[C@H](O)C2CC2)cc1	755519626	XCCDNCYIUFXYLH-OWMRDYPQSA-N	437.500	1.570	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)Nc2cccc(S(=O)(=O)NC3CC3)c2)cc1C	755584519	CJYQLYVQCDQJSP-UHFFFAOYSA-N	432.502	1.976	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)Nc2ccc(N3CCNC(=O)C3)c(Cl)c2)cc1	755938631	WKCCBGLOKCDYLE-UHFFFAOYSA-N	442.863	1.380	50	20	IDGD	
CC(C)CSCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	756750318	YDPUXVQUOWZXII-UHFFFAOYSA-N	444.579	1.041	50	20	IDGD	
CC[C@@H]1CN(CC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)CC[C@@H]1NC(=O)OC(C)(C)C	757111072	QCSVIHXIDOCBQT-PBHICJAKSA-N	449.508	1.981	50	20	IDGD	
CC(C)(C)OC(=O)NCC1(C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)CCCC1	757174268	YBBMFJIZYOCOOR-UHFFFAOYSA-N	444.488	1.948	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Nc2cccn(CC(F)(F)F)c2=O)cc(OC)c1OC	757655632	GCMAUAYUYZAVSK-UHFFFAOYSA-N	444.366	1.903	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2cnc([C@H]3CCCO3)s2)ccc1Cl	760265152	VXARITCYRHIHKZ-SNVBAGLBSA-N	430.895	1.370	50	20	IDGD	
CC1(C)C(=O)N(C[C@](C)(O)C(=O)NNC(=O)COCc2ccccc2)c2ccccc21	760351943	IXUYENPVBFYZPD-QHCPKHFHSA-N	425.485	1.426	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)c1ccc(I)c(O)c1	760801519	YMSJNRXZUFASQA-AWEZNQCLSA-N	440.193	1.598	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)CN1C(=O)N[C@@]2(CCCC[C@H]2C)C1=O	761622939	ZXXAYBKMQPZYKV-ZUOKHONESA-N	434.518	1.435	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)C3=Cc4cc(F)ccc4OC3)cc2)CC1	762002764	DZKIXOSOOOBGJE-UHFFFAOYSA-N	446.504	1.681	50	20	IDGD	
COCCc1noc(-c2cc(Cl)ccc2NC(=O)C(=O)NNC(=O)c2ccccc2)n1	763432048	XPPXZZNEFCJNGK-UHFFFAOYSA-N	443.847	1.979	50	20	IDGD	
CC(=O)N1CCCc2cc(NC(=O)C(=O)NNC(=O)c3ccc4ccccc4n3)ccc21	763454990	LVEAQAWIGFVYJD-UHFFFAOYSA-N	431.452	1.934	50	20	IDGD	
O=C(CN1CCCCCC1)Nc1cccc(NC(=O)C(=O)NNC(=O)c2ccccn2)c1	763465024	QZMWZLBPDSUCLJ-UHFFFAOYSA-N	438.488	1.296	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(C)c(C(=O)NC(C)C)c2)cc1	763662296	XESUTJZOVGSFOF-UHFFFAOYSA-N	442.472	1.307	50	20	IDGD	
COCc1cccc(NC(=O)C(=O)NNC(=O)COc2ccc(Br)cc2)c1	763695578	PJYWQHNZSILMJZ-UHFFFAOYSA-N	436.262	1.760	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C)cc2)cc1C	763811661	KIEBTBNSYWGOGV-UHFFFAOYSA-N	448.501	1.230	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cnn(CC(C)C)c2C)cc1	763862125	UNWDPORMANBMAL-OAHLLOKOSA-N	431.493	1.800	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(-n3cccn3)nc2)cc1	763862557	XZAAZCAZEGQPRG-CQSZACIVSA-N	438.444	1.219	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cccc([S@](C)=O)c2)cc1	763862714	ZIBQLPPDUOBKBH-OSXTUODASA-N	433.486	1.376	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2cc(C)nn2-c2ccc(Cl)cc2)n1	763893743	YHBLPLWPAXIWOY-UHFFFAOYSA-N	429.868	1.434	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCCCCC3)cn1C	763913966	HLASZCACYDQEIY-UHFFFAOYSA-N	432.502	1.932	50	20	IDGD	
COC(=O)c1cc(C)ccc1NC(=O)C(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	763945579	ZNXCQLLMUIOCPM-UHFFFAOYSA-N	437.412	1.073	50	20	IDGD	
Cc1ccc(N2CCOC2=O)cc1NC(=O)C(=O)NNC(=O)c1cc(Cl)ccc1O	763976828	FHCWXNMMIINYIH-UHFFFAOYSA-N	432.820	1.710	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)C(=O)Nc1ccc(OCCNC(=O)OC(C)(C)C)cc1	763993317	NWIHHYJJIUXYEQ-UHFFFAOYSA-N	445.476	1.328	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)Nc1cccc(Br)c1	764005342	ZBAWEVATVPFGFK-UHFFFAOYSA-N	444.083	1.950	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccc(N2CCO[C@H](C)C2)cc1	764135968	KKXRXZAZNVMFOV-OAHLLOKOSA-N	426.473	1.249	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)C(=O)Nc1ccc(CN2CCOC2=O)cc1	764246116	WMLLBJBLFXWGAX-UHFFFAOYSA-N	435.440	1.380	50	20	IDGD	
C[C@@H]1CN(Cc2ccccc2NC(=O)C(=O)NNC(=O)Cc2ccccc2F)C[C@@H](C)O1	764313323	KYIKHEQLXNILLO-HZPDHXFCSA-N	442.491	1.764	50	20	IDGD	
CS(=O)(=O)c1ccc(Oc2ccc(NC(=O)C(=O)NNC(=O)C3CCC3)cc2)cc1	764336122	ZAYUNBBXKOEPCJ-UHFFFAOYSA-N	431.470	1.768	50	20	IDGD	
O=C(CCCc1cccs1)NNC(=O)C(=O)Nc1ccc(CN2C(=O)CCC2=O)cc1	764341466	NOIAOQNBYKLQNA-UHFFFAOYSA-N	442.497	1.506	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@@H]2C)ccc1NC(=O)C(=O)NNC(=O)Cc1ccncc1	764352705	BSMAWZDAXAXLIG-INIZCTEOSA-N	437.500	1.733	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)c(Cl)c1)C(=O)Nc1cccn(Cc2ccccc2)c1=O	764355499	CUGFMAMZXFKWNJ-UHFFFAOYSA-N	440.843	1.655	50	20	IDGD	
CCNS(=O)(=O)c1ccc(CNC(=O)NNC(=O)COc2cc(C)ccc2C)cc1	764371872	AIXMLAPFFBBKAQ-UHFFFAOYSA-N	434.518	1.511	50	20	IDGD	
CN(C)CCc1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)cc1	764385368	ZGQXUCZNXSUXCO-UHFFFAOYSA-N	426.502	1.642	50	20	IDGD	
COc1nccnc1NNC(=O)CN1C(=O)N[C@@](C)(c2ccc(Br)cc2)C1=O	764469222	DYMRGJAFYKLHBM-KRWDZBQOSA-N	449.265	1.158	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)[C@H](c1cccc(F)c1)N1CCOCC1	765311357	VVXWKNIKZYYVKE-SFHVURJKSA-N	438.500	1.651	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cc(C(=O)NNC(=O)c3cc(C)[nH]n3)ccc2C)cc1	765588170	SPFGBKHPWFAASB-UHFFFAOYSA-N	443.485	1.911	50	20	IDGD	
COc1cccc(OCC(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)c1	765757535	VCCYEZCXWARJFL-UHFFFAOYSA-N	446.935	1.693	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)N[C@H](c2ccc(Cl)cc2)[C@@H]2CN(C)CCO2)n1	766320661	QOKXJMKQQOWGTO-PKOBYXMFSA-N	434.928	1.556	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	766663041	ISGASAMHSJTZDC-UHFFFAOYSA-N	439.944	1.130	50	20	IDGD	
C[C@H]1Cc2cc(S(N)(=O)=O)ccc2N1C(=O)COC(=O)[C@@H](Br)C(C)(C)C	766750500	RLFVTBUHIFCVGW-ZUZCIYMTSA-N	447.351	1.964	50	20	IDGD	
CCN(CC(=O)NNC(=O)Cc1ccccc1C)CC(=O)Nc1ccc(NC(C)=O)cc1	766829584	HRJOLDNZAMSNHD-UHFFFAOYSA-N	439.516	1.604	50	20	IDGD	
C[C@@H]1CC(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)C[C@@H](C)O1	768124088	JXIAKYCIYOPABY-HUUCEWRRSA-N	438.550	1.761	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)Cn1cnc2sc(C)c(C)c2c1=O	768641703	VSGRRQVEODPLBW-UHFFFAOYSA-N	436.515	1.630	50	20	IDGD	
C[C@H](O)CNC(=O)/C(C#N)=C\c1cn(CCC(N)=O)nc1-c1cccc(Br)c1	769083758	PRZVHJADNUIIQH-OBTCNRAFSA-N	446.305	1.592	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1nn(-c2ccccc2C(F)(F)F)c(C)cc1=O	771914715	GYSVALLBMADAMZ-LLVKDONJSA-N	440.378	1.662	50	20	IDGD	
CC[C@@H](C)[C@H](NC(=O)N1CCCC1)C(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772887615	AXFVOQSGTBZOSL-CJNGLKHVSA-N	437.928	1.324	50	20	IDGD	
Cn1ccnc(NNC(=O)C(=O)Nc2ccc(OCC(F)F)c(C(F)(F)F)c2)c1=O	773693774	XDGHLZNDNDXANE-UHFFFAOYSA-N	435.309	1.525	50	20	IDGD	
CC[C@H](NCC(=O)NNC(=O)c1cccc(Cl)c1)c1ccccc1OCC(=O)NC	775130238	NLRTZBJGCRYBCW-KRWDZBQOSA-N	432.908	1.967	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)[C@H]2CCCN2C(=O)c2ccc3c(c2)OCO3)c1	776533422	NIMUXJYFIKNAFI-MRXNPFEDSA-N	431.470	1.567	50	20	IDGD	
Cn1c(NNC(=O)COC2CCN(C(=O)OC(C)(C)C)CC2)nc2ccccc2c1=O	777143193	HRJSTMRVOKUXOT-UHFFFAOYSA-N	431.493	1.793	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)NC1CCC(NC(=O)OC(C)(C)C)CC1	778673727	IIOYZCWVDBLTAK-UHFFFAOYSA-N	429.518	1.677	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1ccnn1Cc1ccc(C(F)(F)F)cc1	779462780	SZTPUHWPBVINAP-SNVBAGLBSA-N	448.427	1.041	50	20	IDGD	
COc1cc(OC)c(Cn2nccc2NC(=O)NNC(=O)c2ccccn2)c(OC)c1	779482592	JMRDAUQAVITIJC-UHFFFAOYSA-N	426.433	1.819	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)[C@@H]1CC(c2ccccc2[N+](=O)[O-])=NO1	782043480	YHEORBYZHJILEW-INIZCTEOSA-N	445.819	1.205	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2ccccc2S(=O)(=O)N2CCCCC2)nc(C)n1	783326433	FRWLDYXJWKPXDI-UHFFFAOYSA-N	432.506	1.350	50	20	IDGD	
CCS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccc(Br)nc2)cc1	784808906	HVMFFHOAQAAXND-UHFFFAOYSA-N	427.280	1.720	50	20	IDGD	
COc1ccc(C#N)cc1NC(=O)C(=O)NNc1ccccc1S(=O)(=O)NC(C)(C)C	784834047	RUHYWGGCRJPAMX-UHFFFAOYSA-N	445.501	1.725	50	20	IDGD	
COC(=O)c1cccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)c1C	784835723	GDYPOAUIKQLXAM-UHFFFAOYSA-N	441.412	1.860	50	20	IDGD	
CC(=O)N1CCN(Cc2cccc(NC(=O)C(=O)NNc3cccnc3Cl)c2)CC1	784841918	AULQGIQSZUSAEG-UHFFFAOYSA-N	430.896	1.481	50	20	IDGD	
CCOC(=O)[C@](C)(CNC(=O)NNC(=O)c1ccc2c(c1)OCCO2)c1ccccc1	787311720	YSGOOQBOFIZBIZ-JOCHJYFZSA-N	427.457	1.923	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)cc1N1CCNC1=O	787549318	KVTMYXVYOOKETC-UHFFFAOYSA-N	431.836	1.283	50	20	IDGD	
C[C@H]1[C@@H](C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)CCN1C(=O)OC(C)(C)C	787993213	OKJBLBNWGDMTKH-ZFWWWQNUSA-N	429.477	1.984	50	20	IDGD	
O=C(NNC(=O)c1ccnc(F)c1F)c1cccc(S(=O)(=O)NCc2ccccc2)c1	788624052	HLEHOSZTCXVHGF-UHFFFAOYSA-N	446.435	1.913	50	20	IDGD	
Cc1sc2nc(CC(=O)NN=C3CCCc4nc(O)c(C(N)=O)cc43)nc(O)c2c1C	788979187	UCMVIOFQTCCWQX-UHFFFAOYSA-N	440.485	1.613	50	20	IDGD	
CN1CCN(CC(=O)N(C)c2ccc(NC(=O)NNc3cc(Cl)nc(N)n3)cc2)CC1	789091758	VMVWTKRUGOWJJV-UHFFFAOYSA-N	447.931	1.071	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)NC[C@@H](C)NC(=O)OC(C)(C)C)c2ccccc2c1=O	792255906	GMVKRICOSFQWBZ-CYBMUJFWSA-N	446.508	1.835	50	20	IDGD	
CCN(CC)C(=O)c1ccc(NC(=O)C(=O)NNc2nc3ccccn3n2)cc1Cl	792394292	PFOTTZXOUUSJJR-UHFFFAOYSA-N	429.868	1.947	50	20	IDGD	
O=C(NNS(=O)(=O)c1cccc(OC(F)(F)F)c1F)[C@H]1COc2ccccc2O1	793350856	RDMITSNKXJZHJW-GFCCVEGCSA-N	436.339	1.874	50	20	IDGD	
Cn1nc(C2CCCC2)cc1NC(=O)C(=O)NNC(=O)CNC(=O)OCc1ccccc1	797367666	CYCFFKNCVLVHRH-UHFFFAOYSA-N	442.476	1.090	50	20	IDGD	
Cc1ccc(N2CCOCC2)cc1NC(=O)C(=O)NNC(=O)COc1ccccc1F	797534598	ASLLFKPXDDRYBM-UHFFFAOYSA-N	430.436	1.136	50	20	IDGD	
CSC[C@@H](C)C(=O)N1CCC(C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)CC1	799832057	XIPCROKWCVGXOZ-CQSZACIVSA-N	445.545	1.577	50	20	IDGD	
COCCn1cc(CNC(=O)NNC(=O)[C@@H](C)Oc2cccc(Br)c2)cn1	799859309	GDOOAOZFJWQRNB-GFCCVEGCSA-N	440.298	1.590	50	20	IDGD	
COCCOc1cn(-c2ccccc2)nc1C(=O)NNC(=O)C(=O)Nc1ccc(C)cc1	801106416	ULBIUXPCTRPLSY-UHFFFAOYSA-N	437.456	1.606	50	20	IDGD	
NC(=O)[C@H]1CC(C(=O)NNC(=O)Nc2ccc(OC(F)F)cc2)=NN1c1ccccc1	802045820	YITIGWCVHMWAKA-OAHLLOKOSA-N	432.387	1.561	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)Cc2cncn2C)c1	806338069	LWVURLJFEJDLDN-UHFFFAOYSA-N	443.485	1.233	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(Br)ncc2Cl)c1	806445111	LETUNICERNHDMM-UHFFFAOYSA-N	432.683	1.976	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)c1ccc(Cl)c(S(=O)(=O)NC(C)(C)C)c1	807369830	LRTVWAOBHRCULS-UHFFFAOYSA-N	449.957	1.967	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NN=Cc2ccc(S(N)(=O)=O)c(Br)c2)cc1	807958245	QKJQSWKPXMFVIA-UHFFFAOYSA-N	439.291	1.494	50	20	IDGD	
Cc1ncc2n1CC[C@H](C(=O)NNC(=O)c1ccc(CSc3nncn3C)cc1)C2	810021907	RFZOZKKGTRLUPC-INIZCTEOSA-N	425.518	1.636	50	20	IDGD	
COc1cc(C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)cnc1Br	812732771	AXHCQSRXDDFHSM-UHFFFAOYSA-N	429.296	1.860	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@@](C)(OC)C2CC2)c1	813203430	LADHSXNBBYCIIS-LJQANCHMSA-N	426.539	1.476	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)Nc2ccc3c(c2)OCCO3)ccc1Cl	813457589	UYYWGIUNVXYLSW-UHFFFAOYSA-N	426.838	1.225	50	20	IDGD	
CC(=NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)c1cccc(CO)c1	814710761	RIZOYEPFNCNOQO-UHFFFAOYSA-N	445.541	1.673	50	20	IDGD	
COCCOc1ccccc1NC(=O)C(=O)NNc1ccccc1S(=O)(=O)N(C)C	815752502	UYXYVLOBVIUEMS-UHFFFAOYSA-N	436.490	1.044	50	20	IDGD	
NC(=O)[C@H]1CC(C(=O)NNC(=O)CCSc2ccc(F)cc2)=NN1c1ccccc1	913082126	NHMCQPCPIRKZBT-QGZVFWFLSA-N	429.477	1.576	50	20	IDGD	
CSCC[C@@H](C(=O)NNC(=O)CNc1ccc(C)cc1)N1C(=O)c2ccccc2C1=O	913431348	IILYHBLOGYKWIX-SFHVURJKSA-N	440.525	1.972	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)c(C)n1-c1nccs1	915188625	FCFZZGWCEKQVHI-UHFFFAOYSA-N	432.531	1.919	50	20	IDGD	
CN(C)[C@@H](CNC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)c1ccco1	915897151	XFFLQPRMJWEKRD-IBGZPJMESA-N	428.537	1.425	50	20	IDGD	
CCc1ccc([C@@H](CNC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)N(C)C)cc1	915902464	VASMWOMRKGDWCA-LJQANCHMSA-N	432.546	1.899	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCCc2ccc(OC(F)F)cc2)c1	915925820	YTWSONIRXUWUTO-UHFFFAOYSA-N	427.429	1.878	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)N[C@H](CN1CCOCC1)c1ccccc1	916216446	JPXSMLZZPLTKML-QGZVFWFLSA-N	443.460	1.378	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)NCc1nnc2ccc(C(F)(F)F)cn12	916222639	IOYRYWNITLTBFT-UHFFFAOYSA-N	426.330	1.797	50	20	IDGD	
CCC(CC)[C@@H](CNC(=O)NNC(=O)Cc1nc2ccccc2n1C)N1CCOCC1	916256352	SRPCABXFHIDYMM-LJQANCHMSA-N	430.553	1.583	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)NCCNS(=O)(=O)c2ccccc2)cc1OC	916295113	JCMCPLVHWMXSSC-UHFFFAOYSA-N	436.490	1.016	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)NCCCN2CCN(Cc3ccccc3)CC2)c1	916486027	UAMOLFLLONRBCC-UHFFFAOYSA-N	438.576	1.905	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCc2ccc(S(=O)(=O)N(C)C)cc2)cc1OC	916646910	VHUOUFDOOKDJMP-UHFFFAOYSA-N	436.490	1.098	50	20	IDGD	
CCCn1c(C)cc(/C=C(\C#N)C(=O)NS(=O)(=O)c2cccc(-n3cnnn3)c2)c1C	916763899	ANSIZDKOSMRYIE-LICLKQGHSA-N	439.501	1.903	50	20	IDGD	
O=C(NC[C@@H]1CCCOC1)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	918124229	LHLFESHIHGZDKS-ZDUSSCGKSA-N	438.531	1.920	50	20	IDGD	
CCc1ccccc1OCC(=O)NNS(=O)(=O)c1ccc([C@H](C)NC(C)=O)s1	918399918	TVPONJJAYDYRGJ-LBPRGKRZSA-N	425.532	1.896	50	20	IDGD	
CCCC(=O)N1CCCC[C@H]1C(=O)OCC(=O)NNC(=O)c1cc(Cl)ccc1OC	919619313	NJMJNDQFGAVCDV-HNNXBMFYSA-N	439.896	1.834	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@@H](C)C(=O)NNC(=O)c1cnc2nc(O)nc(O)c2c1	919690613	QQSCZOURSDDPIG-JTQLQIEISA-N	431.836	1.935	50	20	IDGD	
C[C@H](c1ccccc1)N1CC[C@H](NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)C1	919785956	NYPBHDBEUIFQCQ-WBVHZDCISA-N	434.500	1.713	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)CN2C(=O)N[C@@]3(C[C@H](C)CC(C)(C)C3)C2=O)cc1	919836506	VFHSCJZIRBSWKR-IQMFZBJNSA-N	444.532	1.912	50	20	IDGD	
O=C(NNC(=O)C12C[C@H]3C[C@@H](CC(Br)(C3)C1)C2)N[C@@H]1CCS(=O)(=O)C1	919889531	NWYFINTUIKGSMJ-AALXLURJSA-N	434.356	1.238	50	20	IDGD	
COCCn1cc(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)c2ccccc21	920031581	GMIKGDPDDFUTNJ-UHFFFAOYSA-N	429.502	1.656	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)Nc1cccc(N2C(=O)CNC2=O)c1	920931358	LPCOFXRCLPKIEN-UHFFFAOYSA-N	427.417	1.373	50	20	IDGD	
Cc1cc(N2CCN(C)CC2)ccc1NC(=O)NNC(=O)[C@H]1COc2ccccc2O1	920932576	QCNMXVSXNBLUJY-HXUWFJFHSA-N	425.489	1.740	50	20	IDGD	
CCn1c(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cc2ccccc21	1116301441	LYQIDUWPBOACNK-UHFFFAOYSA-N	433.512	1.880	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(\C#N)C(=O)N2CCS(=O)(=O)C[C@@H]2C(=O)OC)c1C	1121236918	GECAJNZTNAPZRX-UFTLVFPDSA-N	437.518	1.018	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@@H]2CC(=O)N(CCc3ccc(OC)c(OC)c3)C2)cc1	1317702625	NFEDGMCITBPFOR-QGZVFWFLSA-N	441.484	1.565	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCc2cccc(C(=O)NC[C@@H]3CCCO3)c2)cc1	1318066234	WKVGUXIBKNQXIC-IBGZPJMESA-N	426.473	1.748	50	20	IDGD	
O=C(NNC(=O)c1ccccc1Cl)NC1CCN(S(=O)(=O)C2CCOCC2)CC1	1318987216	WMMBEMQTFQJWKD-UHFFFAOYSA-N	444.941	1.257	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)CSc2nnc3ccccn23)CC1	1320001810	HTGOGZTZTLZZBF-UHFFFAOYSA-N	434.522	1.616	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNS(=O)(=O)c2ccc(NC(C)=O)c(F)c2)cc1	1321142205	MBEHQCMONJWPPZ-LBPRGKRZSA-N	439.465	1.960	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NC2CCN(c3nccs3)CC2)cc1	1339823608	DLGNJKYKEADXFX-UHFFFAOYSA-N	438.535	1.551	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)N[C@H]1COc2c(F)cc(F)cc2C1	1346318017	CKBTULYTZGUHRJ-CYBMUJFWSA-N	429.383	1.804	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(Cl)Cl)C2)c1cn2ncccc2n1	1778667219	UWBMPCJYEMMOQI-FZKQIMNGSA-N	426.304	1.661	50	20	IDGD	
CCc1cc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)nn1C	1779830309	VZEXQGWBWSEZDS-FZKQIMNGSA-N	427.343	1.457	50	20	IDGD	
COc1cc(OC)cc(C(=O)N2CC[C@@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)c1	1780662584	YJNYEYPLPKYGNE-OAQYLSRUSA-N	436.581	1.999	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)c3cnc(OCF)cn3)CCO2)C1	1781228586	VGOBTKYKXVVAMB-IRXDYDNUSA-N	435.283	1.462	50	20	IDGD	
O=C([C@@H]1CNc2ccccc21)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781331059	KHGZSAWWRRAQQF-QIIPPGSGSA-N	426.286	1.716	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(CCN(C(=O)c3cnn4cccc(F)c34)C2)C1	1782550791	DPMHDNOLYUAEGZ-FQEVSTJZSA-N	434.544	1.768	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccnc(OC)c3)CCO2)C1	1783350096	ZYIVCYMPNRCQQT-RDTXWAMCSA-N	426.311	1.707	50	20	IDGD	
COc1cccc(CC(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](C)Br)C3)C2)n1	1783530379	XDFWWEFZQTVBEU-ACJLOTCBSA-N	426.311	1.246	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)Cn3cccn3)C[C@@H]21	1783969095	INCMQBUZSLXDFR-XAJHFOFHSA-N	441.370	1.530	50	20	IDGD	
CCOC(CC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2)OCC	1784165766	GAOGDFXHYJCAES-GDBMZVCRSA-N	425.295	1.296	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CNC(=O)c3cccs3)[C@H]2C1	1785336656	NUBVYMIDWUDJGG-XQLPTFJDSA-N	427.954	1.475	50	20	IDGD	
COCCn1nccc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]21	1787626847	LUQYLVVKTVZKJW-IWKLRQMXSA-N	447.363	1.359	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1ccc(C2(NC(=O)c3cnnn3C)CCC2)cc1	1788643762	AOVUUHRSSYFUEJ-MZJWZYIUSA-N	448.487	1.697	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CC[C@H]4CCC(=O)N4C3)C[C@@H]21	1789867067	WSCLHUNIDPPLEV-QQCJEOGWSA-N	425.957	1.385	50	20	IDGD	
C=CCNC(=O)/C=C\C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]2C1	1789867742	ITJJLDASKVJXPM-NWUHITEESA-N	432.348	1.061	50	20	IDGD	
O=C(CN(CCO)CCO)NC1(c2ccc(NC(=O)[C@H](F)Br)cc2)CCC1	1790536753	SKTRFMCKSYTOON-INIZCTEOSA-N	446.317	1.098	50	20	IDGD	
Cc1noc(C)c1CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)Br)[C@H]2C1	1791057174	OPUCTQZEMVTAHD-GQGQLFGLSA-N	442.354	1.987	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CS[C@H]3CCCCO3)C[C@@H]21	1791255408	QNZCVEGTTFBVRZ-RPUYLAQPSA-N	434.986	1.480	50	20	IDGD	
C[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]21)c1ccccc1	1792238047	FNZJXIKGLJUFPU-GTAWCEEGSA-N	430.549	1.143	50	20	IDGD	
N#Cc1ccc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Br)C3)cc1	1792425692	WNXCSRBRYCZVFS-CYGHRXIMSA-N	438.297	1.771	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H]2C[C@]21C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCl	1793115939	BOSKTJMOJZJKCJ-PYWNROJRSA-N	441.956	1.624	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H](CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](O)CCl)C1	1793116852	XHYUSRMFCGHMMD-KSWRQPAISA-N	443.972	1.871	50	20	IDGD	
C[C@H]1CCc2c(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)CCBr)n[nH]c21	1795114547	VAQRISZNPOJDDP-OVZMXSCWSA-N	425.327	1.448	50	20	IDGD	
Cc1cc2cc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3cccc(B(O)O)c3)ccc2[nH]1	1796192986	GUIDHWAUSDFUNC-WKCHPHFGSA-N	431.301	1.722	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2c(c1)CC(=O)N2	1797330089	PDBQXEGIALWVNB-CWPLJXCYSA-N	431.565	1.236	50	20	IDGD	
COc1cccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@](C)(Cl)CCl)n1	1799273679	GAIZMIDKIGGMJV-JBYDNAENSA-N	430.332	1.459	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Br	1799343535	ZRXGCFJDKAZQKL-QUARPLMYSA-N	430.112	1.298	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1onc3ccccc13)C2)[C@H](F)Br	1799346491	AMDHXGHRBZFCSQ-FJHTZYQYSA-N	426.242	1.722	50	20	IDGD	
COc1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CCC(=O)NN(C)C)C3)c(OC)c1	1799561346	XUHYBVVHOFBRRF-MUJYYYPQSA-N	432.521	1.329	50	20	IDGD	
C/C=C(/C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN(C)NC(=O)NCc1ccccc1	1799869467	PZDLSCMRHYAYSS-PMIWBGAVSA-N	427.549	1.937	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2)c1nc2cc([N+](=O)[O-])ccc2[nH]1	1799877573	VAQCPICEQDOHSN-WAYYCVMKSA-N	425.804	1.209	50	20	IDGD	
COCCOCCOCCOCCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](F)Cl)C2	1800204019	FBFQXPIJUIWCNI-DFGXFYAUSA-N	438.924	1.245	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c[nH]c3nccc-3c1)C2	1800639601	KDJDSIRGSNOOFZ-QKPAOTATSA-N	435.322	1.891	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@H]1CCN(C(=O)CSC(=N)N)[C@@H]1c1cccnc1	1803007724	FJTBVHQLEVRBCS-UXIGCNINSA-N	442.383	1.745	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)[C@](C)(O)C(F)(F)F)[C@H]1c1cccnc1	1803998605	QFEAZERUSDXGTR-OEUWWYETSA-N	437.846	1.655	50	20	IDGD	
CC(C)(C)n1cc(C(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@H]2c2cccnc2)cn1	1804925210	BKGHTEKMWBMSIP-JQHSSLGASA-N	433.940	1.952	50	20	IDGD	
COC(=O)CCC(=O)NC[C@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1	1806372055	MPABMGYUAGOVCV-RDTXWAMCSA-N	426.311	1.826	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCC2(CCCN(C(=O)C[C@@H]3NC(=O)NC3=O)C2)CC1	1806849838	YZQAZKNNPJXKRJ-SJCJKPOMSA-N	433.336	1.052	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)CSc2ncccn2)[C@H]1c1cccnc1	1807576510	NXCFCFWDDPFJKV-XYJFISCASA-N	449.964	1.924	50	20	IDGD	
C#CCCC(=O)N1CC[C@H](CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@H]1c1cccnc1	1808420881	ATPIYQFDQXWARO-ZNPGGGMWSA-N	434.500	1.635	50	20	IDGD	
CN1N=C(C(=O)N2CC[C@H](CNC(=O)CO[Si](C)(C)C)[C@H]2c2cccnc2)CCC1=O	1810539724	IKADJEWVZQHUBB-OXQOHEQNSA-N	445.596	1.547	50	20	IDGD	
Cn1ccc(CC(=O)N2CC[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]2c2cccnc2)n1	1810542739	XPKDPDMTSGCCIZ-LAUBAEHRSA-N	429.597	1.915	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1ccccc1	1811662853	BPEBYZMPVGQUDF-IFMALSPDSA-N	429.285	1.395	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1ccc(O)cc1	1811932691	MVHKELGBZKPWBG-DENIHFKCSA-N	445.284	1.100	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)[C@]2(C)CC2(F)F)[C@@H]1c1cccnc1	1813075190	ZYRRFMPBTUGSDW-CVAIRZPRSA-N	437.491	1.506	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H](CNC(=O)[C@@H]2CCNC(=O)C2)[C@@H]1c1cccnc1	1813139163	WVYURUSGJAPWDW-MDYRTPRTSA-N	432.597	1.465	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)COc3ccccc3)sc2C1	1813710450	QZYGDBGTLFGHSF-CQSZACIVSA-N	445.545	1.507	50	20	IDGD	
CCC[C@@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CN(C)C(=O)C(=O)O)[nH]n1	1815321998	GHTSVTILUKRPPP-DGCLKSJQSA-N	427.889	1.352	50	20	IDGD	
Cc1cccc(C(=O)N[C@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)n1	1815339925	UZTHOLXBGSZVHM-HNNXBMFYSA-N	436.302	1.066	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)Cn3ccnn3)sc2C1	1815783027	NTQIVQKXSTWABN-ZJUUUORDSA-N	427.328	1.520	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1	1817475966	XPCMIQWWEHSTTD-IAQYHMDHSA-N	449.114	1.179	50	20	IDGD	
Cc1cc(C)nc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)c1	1817726048	MLIGUKSOOBGMDA-FQEVSTJZSA-N	447.304	1.721	50	20	IDGD	
C=CC[C@H](C)C(=O)N[C@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1	1819799415	BUIDYLLLFSWMFU-RYUDHWBXSA-N	428.518	1.580	50	20	IDGD	
CCc1noc(C)c1C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1	1822414777	LWOXDYDFJYADJQ-INIZCTEOSA-N	445.524	1.947	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)CCc2ccccn2)CC1	1825331438	WDQCVZVPLNCHKV-QHCPKHFHSA-N	449.360	1.628	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccco2)CC1	1825772891	DFNNURQIPCLLFY-SFHVURJKSA-N	425.489	1.825	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC([C@H]2CCCCN2C(=O)CCN(C)C)CC1	1826708761	NRGNXZGJEZZTQF-GGVNPZCGSA-N	444.580	1.692	50	20	IDGD	
CCc1ncccc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827055791	FXKUNTZVGOVQIC-QHCPKHFHSA-N	449.360	1.871	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)CN)CCN2C(=O)OCc2ccccc2)C1	1828961653	UWZAYNUFUCPYAX-UTKZUKDTSA-N	436.940	1.415	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)cc1Cl	1830107417	QSDWCOCVUNJQEM-VQIMIIECSA-N	431.316	1.318	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)o1	1830364376	HUEBDTFCPCSWRJ-FQEVSTJZSA-N	441.912	1.573	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)nc1	1830537370	FWNJSNDOPRGUNP-BEFAXECRSA-N	440.338	1.491	50	20	IDGD	
CC(C)(Cc1ccccc1)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1	1830547246	IMPLDTNHBNAWMU-XMSQKQJNSA-N	438.952	1.311	50	20	IDGD	
C=CCOCCCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1	1831412049	BGOZYQWLYHUOCR-OALUTQOASA-N	437.364	1.662	50	20	IDGD	
O=C(Cc1cccnc1Cl)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1832723705	WEOKEMOKQOGVJZ-KRWDZBQOSA-N	436.723	1.538	50	20	IDGD	
CC(C)(CCl)C(=O)NC1CCN(C2CCN(C(=O)Cn3ccncc3=O)CC2)CC1	1833215579	ODHRBAMQGJFNHI-UHFFFAOYSA-N	437.972	1.080	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)c1c(F)ccnc1Cl	1833901744	HXOZOMQVEIEVLU-OAHLLOKOSA-N	447.338	1.659	50	20	IDGD	
CCn1ccc(C(=O)NC2CCN(C3CCN(C(=O)CO[Si](C)(C)C)CC3)CC2)n1	1834272770	SPBIMXXOEMCXDO-UHFFFAOYSA-N	435.645	1.940	50	20	IDGD	
Cc1nccc(C(=O)N2CCC(N3CCC(NC(=O)CCBr)CC3)CC2)n1	1834421742	HVWJASRCFOBHDG-UHFFFAOYSA-N	438.370	1.755	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCC(N2CCC(NC(=O)[C@@H]3CCC(=O)N3)CC2)CC1	1834526798	GDYYGEJFWWFFGV-KXBFYZLASA-N	433.380	1.073	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)c3ccc(Cl)o3)C2)C1	1834821791	YTQZTSDSWJQVCG-INIZCTEOSA-N	435.702	1.788	50	20	IDGD	
CC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)[C@H](C)Nc3cnccn3)CC2)CC1	1836397213	UIRCOUDLSVKADU-YJBOKZPZSA-N	436.988	1.866	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC(OC2CCN(C(=O)[C@@H]3C[C@H]3C3CC3)CC2)CC1	1836657461	RGLOZPZIURVOLZ-FCHUYYIVSA-N	440.349	1.025	50	20	IDGD	
O=C(c1c(F)ccc(O)c1F)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836718274	TYSPATJFHWZKEL-INIZCTEOSA-N	446.878	1.882	50	20	IDGD	
Cc1cccc2cc(C(=O)N3CCO[C@]4(COCCN(C(=O)[C@H](O)CCl)C4)C3)[nH]c12	1836851480	MVGPEAPSNRQHBX-DYESRHJHSA-N	435.908	1.146	50	20	IDGD	
O=C(CCCCn1cccc1)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1837624009	XECIMJSTBCCHIJ-IBGZPJMESA-N	432.348	1.919	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3c[nH]c4ncccc34)C2)C1	1837713114	IAVSXPBQVAKEBQ-NRFANRHFSA-N	446.580	1.484	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)CSC(=N)N)CC2)CC1	1837831702	XRLPWLYBNWJWEA-NSHDSACASA-N	435.388	1.395	50	20	IDGD	
CCn1nc(C(=O)N2CCO[C@@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)cc1C	1838146394	NQKVMLTXDNSHMR-FQEVSTJZSA-N	426.945	1.546	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccncc3)CCO2)C1	1839057474	FDXUCAADJCPWQH-HNAYVOBHSA-N	440.338	1.112	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(C)n(C(F)F)n3)C2)C1	1839146009	IGPNSWAUVWAYHA-FZKQIMNGSA-N	434.871	1.674	50	20	IDGD	
CN(C)c1ncc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)o1	1839151606	XTPHOYQBFGJCQR-ROUUACIJSA-N	449.335	1.047	50	20	IDGD	
COC1(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)CCC1	1840618415	GOKWFGVDILJWLM-KDOFPFPSSA-N	433.343	1.185	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(OC)c3F)CCO2)C1	1840794752	UEZGSJGOHQTQGV-MGPUTAFESA-N	444.887	1.158	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC2(CCCN2C(=O)c2ccc(N3CCOCC3)cn2)C1	1842266032	NQSAMJDLHVXJIY-UHFFFAOYSA-N	432.597	1.587	50	20	IDGD	
COc1cc(C)cc(C(=O)N2CC3(CCCN3C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)c1	1843416672	LPLHOPGXQFBDPQ-PCLIKHOPSA-N	437.500	1.955	50	20	IDGD	
Cc1ccc2nc(C(=O)N3CCCC34CN(C(=O)c3cnccc3C(=O)NN)C4)ccc2c1	1843663921	RWSXDMIRTOTVNL-UHFFFAOYSA-N	444.495	1.673	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)C23CCC(C(=O)OC)(CC2)CC3)C1	1843943223	PFSLFXZGITVDJM-APMMTJHUSA-N	426.941	1.957	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H]1CCC(=O)N1CCCC12CN(C(=O)[C@@H](O)CCl)C2	1843949331	PCKZLIOHBHBNSC-HOTGVXAUSA-N	443.972	1.969	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)c2ccc(Cl)nc2Cl)C1	1844423376	WOWVLJVFFOWKLV-UHFFFAOYSA-N	428.320	1.578	50	20	IDGD	
O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)[C@H](F)Br)C1	1845217685	OVNDTYMUUCAHHQ-HNNXBMFYSA-N	437.269	1.673	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC2(CCCN2C(=O)[C@@H]2[C@@H](O)CCN2Cc2ccccc2)C1	1845836699	SEIQOKHEOLRKKM-FPOVZHCZSA-N	445.636	1.677	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)c1c[nH]c3nccc-3c1Cl)C2	1846384533	DYMIFAHHSFRFDW-UHFFFAOYSA-N	432.912	1.358	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@](O)(C(=O)N2CC3(CCCN3C(=O)C(Cl)Cl)C2)C1	1846389073	ADAVRNYMOXZRJL-SFHVURJKSA-N	436.336	1.365	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)[C@@H]2[C@H]3COC[C@H]32)C1	1846741664	OHIWMUNODZFXGB-VQFNDLOPSA-N	429.429	1.230	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC2(CCCN2C(=O)CN2C(=O)CSC2=S)C1	1847055979	VNUFLCWPZYJKHE-JTQLQIEISA-N	434.381	1.224	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1ccc(S(C)(=O)=O)cn1	1847495844	OJDDPYZYGRSMRT-CQDKDKBSSA-N	444.351	1.332	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)c1	10791589	MHCYHZRHXWOYBA-UHFFFAOYSA-N	439.877	1.208	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)CN1C(=O)N[C@](C)(C2CC2)C1=O	12689186	BYHLJRYJODPPBJ-HXUWFJFHSA-N	427.486	1.600	50	20	IDGD	
C=CCOc1ccc(C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1OC	17407096	CJDDJUCKEPOCQV-UHFFFAOYSA-N	447.513	1.650	50	20	IDGD	
CC(C)N(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)c2n[nH]c(=O)c3ccccc23)cc1	26070026	ZUMQQCOSSLXAAI-UHFFFAOYSA-N	443.485	1.027	50	20	IDGD	
CCCS(=O)(=O)N1CCCC[C@H]1C(=O)NNC(=O)c1ccc(OC(C)C)c(OC)c1	108756785	QRIYNAPHWNFBMQ-INIZCTEOSA-N	441.550	1.838	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)NCCN1C(=O)Cc2ccccc21	725874175	AEQKEWBQOLZCBZ-UHFFFAOYSA-N	447.289	1.748	50	20	IDGD	
O=C(CN1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1)NNC(=O)c1ccc([N+](=O)[O-])cc1	726187380	TVSWGAQJTIYGNR-INIZCTEOSA-N	444.423	1.391	50	20	IDGD	
CSc1nnc(CCCNC(=O)NNC(=O)CNC(=O)c2ccco2)n1C1CCCC1	728134942	QJMFTNULELBIHK-UHFFFAOYSA-N	449.537	1.401	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@@H]1CCCN1c1ccc(C#N)cc1	728169983	FCDIIQCKWFUTKM-KRWDZBQOSA-N	440.529	1.590	50	20	IDGD	
CC(=O)N1CCN(CCNC(=O)/C(C#N)=C/c2cn(CCC#N)nc2-c2ccccc2)CC1	729317226	XKRFTESWEWFUCW-LTGZKZEYSA-N	445.527	1.651	50	20	IDGD	
CN(CC(=O)NNC(=O)c1cccs1)CC(=O)Nc1ccc(Br)cn1	729473276	VFCIJPYAQFUFDW-UHFFFAOYSA-N	426.296	1.237	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N[C@@H](C)[C@@H](C)N1CCOCC1	729623063	FTIRFADONNORKG-MJBXVCDLSA-N	443.342	1.656	50	20	IDGD	
O=C(CSc1nnnn1CC(F)(F)F)NNC(=O)c1cccc(OC(F)F)c1	729949694	ZCEVLJHLJAKGKO-UHFFFAOYSA-N	426.327	1.390	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)c1ccc(-c2noc(C(F)(F)F)n2)cc1	730515066	IDDHZYPNBOJPKR-UHFFFAOYSA-N	444.333	1.806	50	20	IDGD	
COc1ccc(C(=O)Oc2ccc(C=NNC(=O)[C@H]3CCS(=O)(=O)C3)cc2OC)cc1	730575415	CSQLHUSJGJBACN-INIZCTEOSA-N	446.481	1.808	50	20	IDGD	
COc1cc(N2C[C@H](C(=O)NNC(=O)Cc3ccccc3F)CC2=O)cc(OC)c1OC	731328086	QWXCFFFCMAFIRL-CQSZACIVSA-N	445.447	1.595	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)CNS(=O)(=O)c1cccc(C(F)(F)F)c1	731493955	DHHGQJWNLSFRDT-UHFFFAOYSA-N	431.392	1.454	50	20	IDGD	
CCOc1ccc(-c2noc(CCC(=O)NNC(=O)CCN3C[C@H](C)O[C@@H](C)C3)n2)cc1	732261036	AFKFJXAVVZGESZ-HOTGVXAUSA-N	445.520	1.715	50	20	IDGD	
Cc1oc(C(=O)NNc2ccccc2S(C)(=O)=O)cc1S(=O)(=O)N1CCCC1	732302222	DROBPDRKNRFVJE-UHFFFAOYSA-N	427.504	1.533	50	20	IDGD	
C[C@@]1(NNC(=O)N[C@@H]2CCCN(Cc3ccc(F)cc3Cl)C2)CCS(=O)(=O)C1	732469375	GYVNTPHJRCWEET-CRAIPNDOSA-N	432.949	1.825	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)N[C@@H]2CCN(c3ccccc3Cl)C2=O)cc1	732469772	MJONKNILVZYGGG-MRXNPFEDSA-N	432.864	1.863	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)COCCNC(=O)OC(C)(C)C)c1	732554228	OPHYYPZNYQWOBZ-UHFFFAOYSA-N	446.298	1.760	50	20	IDGD	
CCS(=O)(=O)N[C@@H](CCSC)C(=O)NNc1nc(-c2ccc(Cl)cc2)no1	732976855	NCXHAAUWGXVAHU-LBPRGKRZSA-N	433.943	1.894	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)[C@@H](Cc2cccc(F)c2)n2nnnc2C)cc1	733517697	YQDBPNBSGXWTHF-GOSISDBHSA-N	440.435	1.217	50	20	IDGD	
COc1ccccc1NCC(=O)NN=C(C)c1cccc(S(=O)(=O)N2CCOCC2)c1	739399237	APXHHEJPEZTACZ-UHFFFAOYSA-N	446.529	1.668	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)C1=NN(c2ccccc2)[C@@H](C(=O)OC(C)(C)C)C1	740851957	DFSZHISFMHFUPH-QGZVFWFLSA-N	445.520	1.415	50	20	IDGD	
O=C(NC[C@H](O)c1ccccc1Cl)NNC(=O)c1csc(N2CCOCC2)n1	740904033	ZUPCLEGHMCXAED-AWEZNQCLSA-N	425.898	1.311	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)C[C@@H]2CCCN(C(=O)NCC(C)C)C2)cc1	741377732	YFFOYBSQFWXEJE-KRWDZBQOSA-N	432.521	1.767	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C[C@H](C)/N=C2/NS(=O)(=O)c3ccccc32)cc1C	742472629	UCWIGADFSRFDHQ-HNNXBMFYSA-N	444.513	1.347	50	20	IDGD	
O=C(CN1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O)NNc1ccc(C(F)(F)F)cc1[N+](=O)[O-]	743297735	WBWSGXNSJIKFGO-OXHZDVMGSA-N	428.323	1.219	50	20	IDGD	
O=C(NCc1c(O)ccc2c1CCCC2)NNC(=O)c1csc(N2CCOCC2)n1	743509496	DWFQPKRZMCUNGZ-UHFFFAOYSA-N	431.518	1.708	50	20	IDGD	
C[C@H]1C[C@H](C)CN(CCCNC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)C1	743549010	TZRHBRSSCIHUPA-GJZGRUSLSA-N	425.555	1.794	50	20	IDGD	
Cc1nc(COc2ccc(C(=O)OCC(=O)NNC(=O)c3cccc(C#N)c3)cc2)no1	744530911	BZGVUWREINBUFP-UHFFFAOYSA-N	435.396	1.447	50	20	IDGD	
Cc1nc2c(c(C)nn2C)c(C)c1CCC(=O)OCC(=O)NNC(=O)c1cccc(C#N)c1	744544559	SZISNRVTGFEHFJ-UHFFFAOYSA-N	448.483	1.702	50	20	IDGD	
CCOC(=O)C1CCN(C(=O)[C@@H](C)OC(=O)/C(C#N)=C/c2cc(C#N)n(C)c2C)CC1	744630581	ARLVDLFWCPEZQH-BFERYNQYSA-N	426.473	1.846	50	20	IDGD	
O=C(Nc1ccccc1C(=O)NNC(=O)[C@H]1COCCO1)c1ccc([N+](=O)[O-])cc1Cl	744649502	ULYWZJSXZBGSNL-MRXNPFEDSA-N	448.819	1.677	50	20	IDGD	
COc1ccc(-n2nnc(C(=O)OCC(=O)NNC(=O)c3cccc(C#N)c3)c2C)cc1	744716899	FYYRSORFUGTIOD-UHFFFAOYSA-N	434.412	1.074	50	20	IDGD	
O=C(NCc1cccc(CN2CCCC2=O)c1)NNC(=O)c1cc([N+](=O)[O-])ccc1O	745479628	VQAJTGVQMVFWIJ-UHFFFAOYSA-N	427.417	1.567	50	20	IDGD	
C[C@@H](CNC(=O)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1)CN1CCN(C)CC1	745863759	XCIARDIUEWMHAJ-ZDUSSCGKSA-N	437.488	1.490	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)O[C@H](C)C(=O)N(C)C)cc1	746159818	MQXSMRHXVODJDT-VQCBNXJZSA-N	439.472	1.361	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)[C@@H]1CCCN(C(=O)NC2CCCC2)C1	746269462	AWLLQBXGAJUGMV-CQSZACIVSA-N	440.545	1.206	50	20	IDGD	
COC(=O)c1ccc(Br)c(S(=O)(=O)NNC(=O)c2ccc(C#N)cc2)c1	747072967	WHSDHKZYWGWSBR-UHFFFAOYSA-N	438.259	1.731	50	20	IDGD	
CC(=O)N1CCCc2cc(S(=O)(=O)NNC(=O)c3cc(Br)c[nH]3)ccc21	747848558	OPHDUJIVYHYTDW-UHFFFAOYSA-N	441.307	1.700	50	20	IDGD	
O=C(NNC(=O)c1cc(F)c(O)c(F)c1)c1ccc(S(=O)(=O)N2CCCC2)cc1	748013968	ZUBSRTPEQIJXNN-UHFFFAOYSA-N	425.413	1.530	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)c3cc(C#N)c[nH]3)c2)cc1	748287759	SGZLCLLCFAJHBS-UHFFFAOYSA-N	439.453	1.771	50	20	IDGD	
O=C(NCCc1cccs1)NNC(=O)c1cn(-c2ccc(C(F)(F)F)cn2)nn1	751372406	RKXSEWPDEXYHDB-UHFFFAOYSA-N	425.396	1.929	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)NCCn1c(O)nc2ccccc21	753035861	CGGVVIVQIVVEJO-UHFFFAOYSA-N	448.277	1.914	50	20	IDGD	
COc1cccc([C@@H](C)CC(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1	753540224	VUCGZZODIKDKBR-LIRRHRJNSA-N	428.441	1.719	50	20	IDGD	
C[C@@]12CCC(=O)N1c1ccccc1C(=O)N2CC(=O)NNc1ccc(C(F)(F)F)nn1	755183526	NXRXOJZDNURVLR-SFHVURJKSA-N	434.378	1.938	50	20	IDGD	
CCc1ccccc1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	755419382	CQTJUJFWIWSNPY-UHFFFAOYSA-N	432.502	1.736	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NN=Cc3cnc(N4CCOCC4)s3)CC2)cc1	755791509	DWSIUBOWTKPPTF-UHFFFAOYSA-N	442.589	1.556	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)Nc1ccc(CC(=O)N2CCOCC2)cc1	755862477	QELDIRIMYOVVFG-UHFFFAOYSA-N	437.456	1.191	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCCc2ccc(F)cc2C)cc1	756071545	VLRGXCRWRFDCBH-UHFFFAOYSA-N	436.509	1.636	50	20	IDGD	
CC(C)C[C@@H](C(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)N1CCCCC1=O	756576247	HQJWOUMQGGESLO-INIZCTEOSA-N	434.449	1.326	50	20	IDGD	
CN(C1CCCCC1)S(=O)(=O)c1cccc(NC(=O)NNC(=O)c2cnccn2)c1	756625247	IDZUBXCTHWHXER-UHFFFAOYSA-N	432.506	1.896	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)Nc1ccc(CNS(C)(=O)=O)cc1	756629223	ZXMJYVXNOFZWSO-UHFFFAOYSA-N	443.526	1.193	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)Nc2ccc(OC)c(-n3cnnn3)c2)cc1OC	756746296	IYFRVNWVNIGMFM-UHFFFAOYSA-N	427.421	1.545	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])cc1N1CCOC1=O	756820819	YVSDXCYNAPCIGB-UHFFFAOYSA-N	445.388	1.792	50	20	IDGD	
C[C@@](O)(CN1Cc2ccccc2C1=O)C(=O)NNc1ccc(S(=O)(=O)C(F)F)cc1	756875350	JQNNMQYJBPRHJM-LJQANCHMSA-N	439.440	1.533	50	20	IDGD	
O=C(NN=c1cc[nH]cc1Cl)[C@@H]1CCCCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1	757419015	IYOKJGUXLZXGOT-INIZCTEOSA-N	439.881	1.752	50	20	IDGD	
CNS(=O)(=O)c1cccc(NC(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)c1C	757720119	BMNPHGOVCBGTBX-UHFFFAOYSA-N	434.503	1.821	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)nc1)Nc1ccc(F)c(S(=O)(=O)NC2CC2)c1	757873135	HXCUSPQYBNNKDH-UHFFFAOYSA-N	427.845	1.781	50	20	IDGD	
COC(=O)[C@@H](C)Oc1ccc(C=NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1	758365763	NZVMELYDFNIKLX-LLVKDONJSA-N	439.877	1.692	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)NC2CCN(c3cccnn3)CC2)cc1	759612190	FYERQMDLCBJZFR-OAHLLOKOSA-N	428.493	1.642	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)[C@@H](CCC(N)=O)NC(=O)OCc2ccccc2)c(O)c1	760138927	NIPNPPPWUQSYEE-MRXNPFEDSA-N	428.445	1.022	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2ccnn2Cc2ccc(F)cc2)c1	760280212	SHHGYHOBFQRLJO-UHFFFAOYSA-N	441.419	1.487	50	20	IDGD	
N#Cc1c([N+](=O)[O-])cccc1S(=O)(=O)NNC(=O)c1cccc(Br)c1	760362083	LMHXBUGTZNEJIE-UHFFFAOYSA-N	425.220	1.852	50	20	IDGD	
O=C(CCCC[C@@H]1SC[C@H]2NC(=O)N[C@@H]21)NNC(=O)c1cc(-c2cccs2)[nH]n1	763157861	MAIGBIGHCMJRFQ-INWMFGNUSA-N	434.547	1.625	50	20	IDGD	
O=C(NNC(=O)c1ccccc1)C(=O)Nc1ccc(Cl)c(-n2nnnc2C2CC2)c1	763419884	JDRACJLTQUTZBD-UHFFFAOYSA-N	425.836	1.593	50	20	IDGD	
O=C(NNC(=O)c1ccccc1Br)C(=O)Nc1ccn(-c2ncccc2F)n1	763482495	GXZGCFSFFUUVKK-UHFFFAOYSA-N	447.224	1.569	50	20	IDGD	
O=C(NNC(=O)c1ccccc1Br)C(=O)Nc1ccc(-n2nccn2)cc1	763482945	PJZHOYUCYPSVGB-UHFFFAOYSA-N	429.234	1.430	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)CCCOc2ccc(Cl)cc2Cl)ncn1	763498730	AHAFFVDLBZDBEA-UHFFFAOYSA-N	442.259	1.737	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)N2CCCc3ccc(F)cc32)cc(OC)c1OC	763538624	FAYANIAKSDUODQ-UHFFFAOYSA-N	431.420	1.592	50	20	IDGD	
Cc1ccccc1-n1nccc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccccc2)[nH]n1	763605745	UFGMCKCQNGJJJD-UHFFFAOYSA-N	429.440	1.971	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCOC[C@@H]1C[C@H](O)c1ccccc1	763636765	SWFCPTJVZSIGDR-HKUYNNGSSA-N	447.919	1.934	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2ccc(OC(F)F)c(F)c2)c1	763773067	UGLUQESZPLBDSM-UHFFFAOYSA-N	427.335	1.844	50	20	IDGD	
Cc1nc2ccc(NC(=O)C(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)cc2s1	763785639	KKEVVXQUUBBCTA-UHFFFAOYSA-N	436.453	1.251	50	20	IDGD	
CSCCc1ccc(NC(=O)C(=O)NNC(=O)c2nnc(O)c3ccccc23)cc1	763791709	XVYRRQBDHBYECM-UHFFFAOYSA-N	425.470	1.641	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(OC[C@@H]3CCCO3)cc2)cc1	763808939	HYNDTKPWBAOSHI-IBGZPJMESA-N	427.457	1.718	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2nn(C(C)(C)C)cc2C#N)c1C	763851304	RPRLPVYSLFDRBB-CQSZACIVSA-N	426.477	1.680	50	20	IDGD	
CCOc1ccc(C#N)cc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccc(C(C)=O)cc1	763873732	YEJFFNUEPVHJHW-CQSZACIVSA-N	438.440	1.713	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(F)cc2OCC#N)cc1	763878315	OSQLISUFAJBLAN-ZDUSSCGKSA-N	442.403	1.484	50	20	IDGD	
Cn1cnnc1-c1cccc(NC(=O)C(=O)NNC(=O)CCSc2ccc(F)cc2)c1	763894342	AKYHJFNYQNDPFE-UHFFFAOYSA-N	442.476	1.890	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(C(=O)OC)ccc2F)cc1OC	763910904	GWVZFUSSRRYYMF-UHFFFAOYSA-N	447.419	1.809	50	20	IDGD	
COc1cccc(-c2nsc(NC(=O)C(=O)NNC(=O)Cc3ccc(F)cc3)n2)c1	763918094	AGRJUPOJPKNFGD-UHFFFAOYSA-N	429.433	1.681	50	20	IDGD	
O=C1CCc2cc(F)c(NC(=O)C(=O)NNC(=O)c3cc(Br)c[nH]3)cc2N1	763994141	AFPIZPPRNRKXIT-UHFFFAOYSA-N	438.213	1.201	50	20	IDGD	
COCCn1ccc2ccc(NC(=O)C(=O)NNC(=O)c3cc(Br)c[nH]3)cc21	763994896	JFEZFNMMEPMYHW-UHFFFAOYSA-N	448.277	1.778	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1ccc(OCC(F)(F)F)cc1	764004738	SSGBEYOSPFWHMT-UHFFFAOYSA-N	439.346	1.799	50	20	IDGD	
O=C(NNC(=O)c1cnccn1)C(=O)Nc1ccc(C(F)(F)F)cc1Br	764023700	DEUYHXSRGZJNPX-UHFFFAOYSA-N	432.156	1.658	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc(Sc2nccn2C)cc1	764042431	JUGLMXFNZRSDMX-UHFFFAOYSA-N	425.470	1.980	50	20	IDGD	
COC(=O)[C@@H]1CN(C(=O)C(=O)NNC(=O)c2ccc3ccccc3c2)c2ccccc2O1	764061869	OFWBYFSIEVXJMT-IBGZPJMESA-N	433.420	1.568	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ncn(Cc3ccc(Cl)cc3)n2)c(O)c1	764110285	IFZUDJCRLDHUKX-UHFFFAOYSA-N	428.836	1.394	50	20	IDGD	
C#CCOc1cc(F)ccc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccc(C)cc2)[nH]n1	764111806	UAUAXMHUDSMZEX-UHFFFAOYSA-N	435.415	1.936	50	20	IDGD	
Cc1cccc(Cn2nccc2NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)c1	764125123	RUXBQKPXTIQAEM-UHFFFAOYSA-N	427.848	1.999	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2O1)C(=O)Nc1cccc(OC[C@H]2CCCO2)c1	764154498	REMQZXJLYWSJQH-MJGOQNOKSA-N	425.441	1.334	50	20	IDGD	
CC(C)(C)OC(=O)NCc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(C#N)cc2)c1	764177363	LKUUBFHKPYTGFE-UHFFFAOYSA-N	437.456	1.983	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)ccc1C(=O)N(C)C	764204093	SBTFIXPRQROQCP-UHFFFAOYSA-N	449.508	1.088	50	20	IDGD	
CCN(CC)C(=O)c1ccccc1NC(=O)C(=O)NNC(=O)Cn1ccc2ccccc21	764243789	ZKBRTOAHUCSYFC-UHFFFAOYSA-N	435.484	1.909	50	20	IDGD	
CC(=O)CCCCCCC(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	764281654	HGRKZNSRYNGNKJ-UHFFFAOYSA-N	425.555	1.390	50	20	IDGD	
CC(C)(C(=O)NNC(=O)C(=O)Nc1ccc(-n2cncn2)c(Cl)c1)c1ccccc1	764309631	SCMBXLCJCZBGME-UHFFFAOYSA-N	426.864	1.984	50	20	IDGD	
CC(C)Oc1ccc(Br)cc1NC(=O)C(=O)NNC(=O)Cc1ccncc1	764356195	QETZYHSDLXBQNU-UHFFFAOYSA-N	435.278	1.960	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)c(OC)c1OC	764370030	LEPSCOHPBFXSAQ-UHFFFAOYSA-N	439.371	1.470	50	20	IDGD	
CNC(=O)c1cc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)ccc1Cl	764379655	GUJUFRPIBXXKBW-UHFFFAOYSA-N	440.790	1.457	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(OC2CCCC2)c(Cl)c1	764398059	CLHVSFKGHSEGFY-GFCCVEGCSA-N	427.885	1.799	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3sc(N4CCOCC4)nc3C)n[nH]2)cc1	764558450	HEKZKOKIYHXAPG-UHFFFAOYSA-N	442.501	1.762	50	20	IDGD	
C[C@H](C(=O)NNC(=O)c1ccc(COc2ccccc2)o1)S(=O)(=O)C1CCOCC1	764570530	DXFJUBDEPOEXEM-CQSZACIVSA-N	436.486	1.602	50	20	IDGD	
CCOC(=O)[C@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)OC(C)(C)C)cc1F	765390201	KQFWNTDXHKHUCA-JTQLQIEISA-N	440.428	1.002	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)CNC(=O)Cc1ccc(O)cc1	765605861	WEIXKUQRBIEVNR-UHFFFAOYSA-N	434.518	1.271	50	20	IDGD	
O=C(CCc1cccc(F)c1F)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765737603	HDHCCEZFVYAKOO-UHFFFAOYSA-N	430.455	1.503	50	20	IDGD	
CCCCS(=O)(=O)c1ccc(C(=O)NNC(=O)CCN2C[C@H](C)O[C@@H](C)C2)cc1	765817865	TUCBYZVCPMIINJ-HOTGVXAUSA-N	425.551	1.521	50	20	IDGD	
CCCC(=O)N1CCC[C@H]1C(=O)NNC(=O)CN1CCN(Cc2ccc(C)cc2)CC1	766650375	TVCFDUCAYPZTFG-FQEVSTJZSA-N	429.565	1.051	50	20	IDGD	
COc1ccc(NNC(=O)CNC(=O)c2cc(OC)c(OC)c(OC)c2)c([N+](=O)[O-])c1	768331709	MNPYZZZTNAPXGI-UHFFFAOYSA-N	434.405	1.502	50	20	IDGD	
CSCCNC(=S)NNC(=O)CCn1cnc2ccc(Br)cc2c1=O	769767826	VWUWKYGENLTYLP-UHFFFAOYSA-N	444.380	1.407	50	20	IDGD	
COc1ccccc1[C@H](NC(=O)OC(C)(C)C)C(=O)NNc1nc(O)c2cnn(C)c2n1	770979509	GCYVSZXQZWSAOF-AWEZNQCLSA-N	443.464	1.787	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1cccc(S(=O)(=O)N2C[C@H](C)C[C@@H](C)C2)c1	771886852	DRHPAMMPCIXZCQ-KFWWJZLASA-N	439.534	1.456	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)CCc1nc(C2(NC(C)=O)CCCCCC2)no1	772047893	ZXSIAUCWUJTOBH-ZDUSSCGKSA-N	437.497	1.177	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H]2[C@H]3CCc4ccccc4[C@H]32)c1	772631120	QZCKUFJJBYINIQ-IPMKNSEASA-N	428.514	1.609	50	20	IDGD	
CC(C)[C@@]1(C)C[C@@H]1C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	773771262	REBBWLMQNUOJKW-WIYYLYMNSA-N	437.562	1.470	50	20	IDGD	
CO[C@H](c1ccc(Br)cc1)[C@H](C)NC(=O)NN[C@]1(C)CCS(=O)(=O)C1	774338762	BBOQCXSUPBIHLO-HZUKXOBISA-N	434.356	1.906	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)Nc3ccnn3C)c2)cc1	775752879	KACFKNYIEHSDIR-UHFFFAOYSA-N	444.473	1.696	50	20	IDGD	
NS(=O)(=O)c1cccc(N2C[C@H](C(=O)NNc3ccc4ccccc4n3)CC2=O)c1	777465719	YPCCWLBBXCXMME-CQSZACIVSA-N	425.470	1.378	50	20	IDGD	
COC(=O)c1ccccc1NNC(=O)CNS(=O)(=O)c1cccc(C(F)(F)F)c1	777828253	LBTQCUYSJSFIPU-UHFFFAOYSA-N	431.392	1.914	50	20	IDGD	
COc1cc(OC)c(NC(=O)C(=O)NNC(=O)c2ccccc2O)cc1Br	778706489	SHRJUOZQPXLYJA-UHFFFAOYSA-N	438.234	1.572	50	20	IDGD	
CC(C)[C@H](C(=O)NNc1ccc([N+](=O)[O-])cc1Br)N1CCCS1(=O)=O	779144065	CGKWKVMRZRIKMQ-CYBMUJFWSA-N	435.300	1.861	50	20	IDGD	
Cc1noc(C2(C)CCN(C(=O)NNC(=O)c3csc(N4CCOCC4)n3)CC2)n1	781415729	DVAGHZXFQGTDJW-UHFFFAOYSA-N	435.510	1.079	50	20	IDGD	
O=C(NNc1ncncc1Cl)[C@@H]1CCCC[C@H]1C(=O)NNc1ncncc1Cl	781823938	PMXWXIWAPDIMAV-NXEZZACHSA-N	425.280	1.966	50	20	IDGD	
CCc1c(C(=O)NNC(=O)[C@H]2COc3ccccc3O2)nnn1Cc1ccc(F)cc1	781847687	WDPWJSQAXMFQRW-GOSISDBHSA-N	425.420	1.629	50	20	IDGD	
C=CCS(=O)(=O)CCNC(=O)NNC(=O)[C@@H](C)Oc1cccc(Br)c1	782997956	SKAGZTAHVPTECT-LLVKDONJSA-N	434.312	1.148	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)cnc1Cl	783263686	JLSVREBJFFRSIC-UHFFFAOYSA-N	426.886	1.207	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNc2ccc(F)cc2C)cc1S(=O)(=O)N(C)C	783444696	NEEWNPQREKAXLL-UHFFFAOYSA-N	438.481	1.865	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2cccc(OCCNC(=O)OC(C)(C)C)c2)ncn1	783940969	YQYHXFZEONLROM-UHFFFAOYSA-N	430.465	1.770	50	20	IDGD	
CC(C)Cn1ccc2cc(NC(=O)C(=O)NNC(=O)CNC(=O)c3cccs3)ccc21	784003769	OEWPVLDKOVUWEC-UHFFFAOYSA-N	441.513	1.875	50	20	IDGD	
Cc1ccc(NC(=O)C(C)C)cc1NC(=O)C(=O)NNC(=O)CNC(=O)c1cccs1	784003936	RKQOZSSWNCECLB-UHFFFAOYSA-N	445.501	1.167	50	20	IDGD	
COc1cccc(Cn2nccc2NC(=O)C(=O)NNc2nccnc2Cl)c1OC	784780618	DHEMNALMLBUWPD-UHFFFAOYSA-N	431.840	1.474	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNc2ccc(Br)nc2)cc(OC)c1OC	784810946	HQBAZSWCAUXNLF-UHFFFAOYSA-N	425.239	1.952	50	20	IDGD	
CNS(=O)(=O)c1cc(NC(=O)C(=O)NNc2cccc(C(F)(F)F)n2)ccc1C	784955477	XIUBSAIFXLCEJJ-UHFFFAOYSA-N	431.396	1.399	50	20	IDGD	
Cc1cc(C)n(-c2ccc(NC(=O)C(=O)NNC(=O)Cc3cn4ccccc4n3)cc2F)n1	785061567	XVICYCJAXRRFQU-UHFFFAOYSA-N	449.446	1.605	50	20	IDGD	
Cc1cccc(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)c1Br	785067125	HKVQCHIDHRUREY-UHFFFAOYSA-N	430.262	1.734	50	20	IDGD	
CN(C)C(=O)c1ccc(NC(=O)C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)cc1	785099296	DBFNDTJPJXAAAO-UHFFFAOYSA-N	445.426	1.641	50	20	IDGD	
O=C(NNc1c(F)cc(C(=O)NC2CC2)cc1F)C(=O)Nc1cnn(CC(F)(F)F)c1	785100689	XSIGIPGFHODVHR-UHFFFAOYSA-N	446.336	1.698	50	20	IDGD	
CCCCCn1nc(C(=O)NNS(=O)(=O)C[C@H]2CCCOC2)c2ccccc2c1=O	788138836	GWRSJWMXZHMZIA-HNNXBMFYSA-N	436.534	1.578	50	20	IDGD	
CN(C)[C@H]1CCOc2c(NC(=O)C(=O)NNC(=O)c3cc([N+](=O)[O-])ccc3O)cccc21	789769824	UUTBXCPFOZLNGN-HNNXBMFYSA-N	443.416	1.085	50	20	IDGD	
O=C(NCc1nnc2n1CCOC2)NNC(=O)c1ccc(Br)cc1Cl	790672763	BOFUJSDCMCJJAW-UHFFFAOYSA-N	429.662	1.368	50	20	IDGD	
C[C@]1(c2ccc(F)c(Cl)c2)NC(=O)N(CC(=O)NNc2nc3ccccn3n2)C1=O	791242317	PQVWLISXLNMFFX-GOSISDBHSA-N	431.815	1.432	50	20	IDGD	
Cc1cc2n[nH]cc2cc1NC(=O)C(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12	792268110	LIEOHQIMFPKBFC-UHFFFAOYSA-N	447.455	1.562	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNC(=O)COc2cccc(C)c2)c(F)cc1C	793023583	RXHFRDLEDIZWNI-UHFFFAOYSA-N	431.420	1.784	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@H]2COCCN2C2CCCC2)cc1Br	793485528	YPROCHJXPKZPKH-OAHLLOKOSA-N	426.311	1.862	50	20	IDGD	
O=C(c1ncccc1Br)N1CCN(S(=O)(=O)CBr)CC1	793776030	WLKKKYGDTXXXME-UHFFFAOYSA-N	427.118	1.284	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)CN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)cc1	796385801	TXQNIKLLOYKGSH-HSZRJFAPSA-N	446.555	1.211	50	20	IDGD	
Cc1c([N+](=O)[O-])ccc(F)c1NC(=O)C(=O)NNC(=O)c1cc(-c2ccccc2)[nH]n1	800622488	MMBPHQMSELXRDQ-UHFFFAOYSA-N	426.364	1.832	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)N[C@@H]1CCN(C(=O)Nc2ccccc2)C1	801077463	DEPIPTMRGMBSKS-MRXNPFEDSA-N	448.524	1.928	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2ccc(OC)c(S(=O)(=O)N3CCCC3)c2)cc1	802062952	WGQLKXYODLRLMN-UHFFFAOYSA-N	448.501	1.955	50	20	IDGD	
COC(=O)c1c(F)cc(NC(=O)C(=O)NNC(=O)CCCc2cccs2)cc1F	802566876	CTGSQYZBCMEZTK-UHFFFAOYSA-N	425.413	1.922	50	20	IDGD	
COCCNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3n2)c1	806972415	VRWDYDRBIVMQLF-UHFFFAOYSA-N	435.440	1.011	50	20	IDGD	
COc1cc(C(=O)NNC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)cc(OC)c1OC	807007970	SYNUUNGDQVTGKH-QGZVFWFLSA-N	428.489	1.931	50	20	IDGD	
Cc1cc([N+](=O)[O-])ccc1NNC(=O)C(=O)Nc1cc(S(=O)(=O)N(C)C)ccc1F	807455776	UDTOMIVRFLEGCI-UHFFFAOYSA-N	439.425	1.374	50	20	IDGD	
CCc1nnc(NC(=O)[C@H](C)[C@@H](C)NC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)s1	807566614	YQHQOGLYTUXOLF-NXEZZACHSA-N	435.466	1.616	50	20	IDGD	
CCCN(NC(=O)CCNS(=O)(=O)c1ccc(NC(C)=O)cc1)C(=O)OC(C)(C)C	807702668	AGXDPAPNXSMIAK-UHFFFAOYSA-N	442.538	1.992	50	20	IDGD	
Cc1ccc(CNC(=O)NCC(=O)NNC(=O)[C@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1	808011342	TZRCTQYJCMDNET-KRWDZBQOSA-N	447.536	1.589	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2C[C@@H](c3ccccc3)OC2=O)c1	809541981	SGWRRIBEUQSSCZ-IRXDYDNUSA-N	431.470	1.002	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)c3ncn(C)n3)c2)c(C)c1	809977301	UTQZKSCQFAZINJ-UHFFFAOYSA-N	428.474	1.308	50	20	IDGD	
CC(=NNC(=O)Nc1ccc(S(N)(=O)=O)cc1)c1ccc(NS(C)(=O)=O)cc1	814964210	OVMJCBJGSFIPHF-UHFFFAOYSA-N	425.492	1.251	50	20	IDGD	
CC(C)(C)OC(=O)N1CCc2ccc(NC(=O)C(=O)NNc3ncncc3F)cc2C1	815765371	OOSLNUTXFLWEEK-UHFFFAOYSA-N	430.440	1.991	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNC(=O)CCc2nc(O)c3cnn(C)c3n2)cc1	823982696	ZCQIDKZQXROVFX-UHFFFAOYSA-N	426.477	1.888	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)c1ccc(-n2cncn2)nc1	828879009	MPZUFKDSOFEVDI-LLVKDONJSA-N	431.250	1.653	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)[C@H]2CCCN2S(=O)(=O)c2ccc(C)s2)cc1	893642796	MBSSINZZPLNZAS-MRXNPFEDSA-N	437.543	1.744	50	20	IDGD	
CCC1(CC)NC(=O)N(CC(=O)NNC(=O)[C@H](C)Oc2c(C)cc(Cl)cc2C)C1=O	912864554	JNOPULVBCYWJIZ-ZDUSSCGKSA-N	438.912	1.982	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)c2ccccc2F)cc1S(=O)(=O)N1CCOCC1	913632729	SIGIOEIUJJWIDA-UHFFFAOYSA-N	435.477	1.484	50	20	IDGD	
O=C(CCCOc1ccc2c(c1)CCC(=O)N2)NNC(=O)c1ccc2c(c1)OCCO2	914466245	KEWZDSZGDDHCSV-UHFFFAOYSA-N	425.441	1.963	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@@H]1CC(=O)N(C2CCCCC2)C1	914831160	CUBLLUSUPHLGNU-CQSZACIVSA-N	435.550	1.230	50	20	IDGD	
Cc1cc(C=NNC(=O)c2csc(N3CCOCC3)n2)c(C)n1CCN1CCOCC1	915952789	AGHNUSQDBVYNHB-UHFFFAOYSA-N	446.577	1.494	50	20	IDGD	
CCn1cnc2c1c(=O)n(CC(=O)NN=C[C@H]1CC=CCC1)c(=O)n2Cc1ccccc1	916331931	MRHBNIWPSRAMFR-KRWDZBQOSA-N	434.500	1.886	50	20	IDGD	
O=C1CN(C(=O)c2ccc(CNC(=O)NNC(=O)c3ccc(Cl)cc3)cc2)CCN1	916391896	MEZUIKBCFVWQFZ-UHFFFAOYSA-N	429.864	1.056	50	20	IDGD	
COc1ccc(C(=O)NCC(=O)NNC(=O)Cc2ccc3ccccc3c2)cc1[N+](=O)[O-]	917196510	WBBUOVQLYMKCGY-UHFFFAOYSA-N	436.424	1.877	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)N1CCCCC1	918122126	WNHPZCMTEOULKE-INIZCTEOSA-N	437.566	1.290	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)NCc2nc(C3CC3)no2)c2ccccc2c1=O	918233178	IOUHWYAJMKFWIH-UHFFFAOYSA-N	439.476	1.991	50	20	IDGD	
O=C(NNC(=O)c1cc(F)cc2nc[nH]c12)c1cccc(S(=O)(=O)N2CCCC2)c1	918279570	WXNBFXFTMXGINL-UHFFFAOYSA-N	431.449	1.561	50	20	IDGD	
O=C(NCCS(=O)(=O)c1ccc(Cl)cc1)NNC(=O)c1cc(Br)c[nH]1	919785741	IQBIPTSKIGVUFW-UHFFFAOYSA-N	449.714	1.849	50	20	IDGD	
O=C(NNC(=O)C1=NN(c2ccccc2)[C@H](c2ccccc2)C1)N[C@@H]1CCS(=O)(=O)C1	919888908	HPJYRCNKTUVDTM-APWZRJJASA-N	441.513	1.512	50	20	IDGD	
C[C@H](C(=O)OCC(=O)NNC(=O)c1cccc(Cl)c1)S(=O)(=O)c1ccc(F)cc1	920532551	LNDVPECTDINAJZ-LLVKDONJSA-N	442.852	1.646	50	20	IDGD	
Cn1cnnc1CNC(=O)/C(C#N)=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	920853643	REHGCYNKDQIRAB-ZSOIEALJSA-N	438.879	1.431	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)Nc1cccc(CN2CCC[C@@H]2C(N)=O)c1	920934161	GWFKDYSMYSMMFB-QGZVFWFLSA-N	435.488	1.559	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)Nc1ccnn1C[C@@H]1CCOC1	1116654666	KDTXADDNMOAAAY-SFHVURJKSA-N	441.536	1.285	50	20	IDGD	
Cn1c(=O)n(CCC(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)c2ccccc21	1251914923	OCPGKLFFHVDEEQ-UHFFFAOYSA-N	445.520	1.525	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)c2ccc(Br)cc2)cc1C(=O)O	1321784409	YMWUNUJLYVGQLY-UHFFFAOYSA-N	429.248	1.779	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)(C)O	1330155110	XAJJNLWTIHBSQL-BXUZGUMPSA-N	429.901	1.919	50	20	IDGD	
CN(CCO)S(=O)(=O)c1ccc(C(=O)NNc2ccnc(Br)c2)cc1	1344523393	HZQKHEQDBNOGMD-UHFFFAOYSA-N	429.296	1.214	50	20	IDGD	
O=C(c1cc2cn[nH]c2cn1)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1778781207	QNTANJXIZVXFSS-BBRMVZONSA-N	426.246	1.092	50	20	IDGD	
C[C@H](Cn1cncn1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@](C)(Cl)CCl)C2	1779500546	QDTDPLXXGHZLHT-OHDICMOHSA-N	446.379	1.664	50	20	IDGD	
COc1nn(C)cc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CO[Si](C)(C)C)C1	1779540860	XYXYQKZWKVIYIW-OXQOHEQNSA-N	438.601	1.408	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)Cc3ccc(C(=O)OC)s3)CCO2)C1	1781218056	MNJHCOKQRFWEPQ-AUUYWEPGSA-N	428.938	1.925	50	20	IDGD	
CC(C)(C)n1cc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@](C)(Cl)CCl)C3)C2)nn1	1781232441	UOTNWZRLMBFPEB-QZTJIDSGSA-N	432.352	1.713	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](F)Br)C3)C2)cc1F	1781325085	IRPGDLSSUXPYNS-WMLDXEAASA-N	433.249	1.968	50	20	IDGD	
Cc1ccn2ncc(C(=O)N3CCO[C@]4(CCN(C(=O)[C@@H](F)Br)C4)C3)c2c1	1781330916	IRUHVWQJCZKLCT-QAPCUYQASA-N	439.285	1.777	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H]1CCNC(=O)C1)C2	1781905656	SSILMHGMEJGNAO-DEXNDLTESA-N	444.370	1.200	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1csc(N)n1)C2	1781998413	SXKHZGOEZZSXFW-NSODJVPESA-N	431.356	1.636	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)nc2nccn12	1782357609	UVYVAKOIYOKLLK-UGSOOPFHSA-N	436.310	1.265	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3nnc(-c4ccccc4)o3)CCO2)C1	1783534157	QOPOPQWRSDRBLM-ORAYPTAESA-N	449.305	1.964	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc4c(c3)CCN4C)CCO2)C1	1783534804	ZITYZQZQIIJQKA-XOBRGWDASA-N	436.350	1.906	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)Cc3c[nH]c4cc(OC)ccc34)CCO2)C1	1783871166	NINYVMLQUCBYBD-PGRDOPGGSA-N	449.935	1.803	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)CCO2)C1	1783880144	GHZLRTHZHUKSCF-YJBOKZPZSA-N	429.832	1.431	50	20	IDGD	
C[C@H](CNC(=O)OC(C)(C)C)C(=O)N1CCO[C@@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783940118	QZFBXHIXSNFCNC-KZULUSFZSA-N	438.352	1.781	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C#Cc3ccc(Cl)cc3)C[C@@H]21)[C@@H](O)CCl	1784084195	NPTVUAWKRXTBBW-DKIMLUQUSA-N	425.312	1.271	50	20	IDGD	
CC#CC[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]2C1)c1ccccc1	1784091494	VXTKQAXIXBAZFZ-LUYSREMJSA-N	432.948	1.763	50	20	IDGD	
Cc1cc(C)c(OCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](O)CCl)C[C@@H]32)c(C)c1	1784358507	PWGWQNSLOYWXKE-OKYOBFRVSA-N	438.952	1.570	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cn3nnc4ccccc43)[C@H]2C1	1784895886	FUSNJLPYXYDMKE-MPGHIAIKSA-N	433.940	1.676	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3(C)CC3)C[C@@H]21	1785075295	DTTLOOAECANZAW-VGWMRTNUSA-N	443.972	1.898	50	20	IDGD	
CC(C)(C)[C@@H](O)C(=O)Nc1ccc(C2(NC(=O)c3cnccc3C(=O)NN)CCC2)cc1	1786098052	CSSVJHBPLWVQJH-SFHVURJKSA-N	439.516	1.840	50	20	IDGD	
CC(=O)O[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]2C1)C(C)C	1788764664	RDKNXPSEWVSNDH-DWRORGKVSA-N	428.602	1.405	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3CCC4(CC3)OCCO4)C[C@@H]21	1789865563	YHBUDZLBEGCRHN-FJIDUMEYSA-N	428.957	1.917	50	20	IDGD	
CC(=O)O[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]2C1)C(C)C	1789868107	NLZZKXQVGIGBRC-SIBFUHKCSA-N	437.364	1.790	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ncc(F)cc3F)C[C@@H]21	1791055388	VADJRWIFNASOPD-WRZDFSGXSA-N	432.265	1.737	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(NC(C)=O)c3)C[C@@H]21	1791256041	DJEJCVOLHGIQSM-WNHJNPCNSA-N	437.924	1.492	50	20	IDGD	
C=CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2	1793597151	DRBCAHPLYMLVTA-KHMAMNHCSA-N	433.908	1.580	50	20	IDGD	
C=CCCc1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)c(O)n1	1794823909	VQUPRNUMXFUXEZ-ACDBMABISA-N	449.316	1.151	50	20	IDGD	
CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(C)(C)CCl)C2)C(=O)OC(C)(C)C	1795336749	LPJDSJVTUADCNO-MIFYACCESA-N	431.961	1.708	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CNc2ccccc21	1795620408	NFENZTOWMKWTKR-FEZYCPBGSA-N	436.350	1.816	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1ccc2n[nH]cc2c1	1796151135	ZLAJTPHQSVXIAW-AYRXBEOTSA-N	425.258	1.457	50	20	IDGD	
COC(=O)c1ccccc1CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Cl	1796364096	FGDJSJAMPRJRKG-LTCOOKNTSA-N	426.872	1.530	50	20	IDGD	
CC(C)(C)c1ncccc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(B(O)O)cc1)C2	1796421277	KMQIUPAKTMYWAZ-REPLKXPHSA-N	435.333	1.625	50	20	IDGD	
COCCn1nccc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](C)CBr)C2	1797054632	ZPPRJIVWNCTZLL-XQLPTFJDSA-N	427.343	1.812	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1Cc2ccccc2O1	1797224590	ANAZOEHPAMBLGX-QMQAMEMWSA-N	437.334	1.611	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@]1(C)C[C@@H]1C)C2	1798524548	GFWGCWCUJUHOGJ-DWDJSLCVSA-N	445.472	1.769	50	20	IDGD	
CC(C)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CC[C@@H]2CCC(=O)N2C1	1799144784	SIADJNVYHWUOKF-UJHHCITNSA-N	425.957	1.242	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C[C@H](N)c1cccnc1)C2	1799275035	LTTBBJMGLRMUGM-BSZJXLGXSA-N	429.348	1.297	50	20	IDGD	
COc1ncc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@](C)(Cl)CCl)cc1C	1799277657	UKKGVUFLXIBLNH-NXEZDXNNSA-N	430.332	1.838	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](O)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](F)Br	1800162203	LUGVBHAEVTVHIT-TUTUZKQUSA-N	438.294	1.158	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@](O)(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](F)Cl)C3)C1	1802413447	NNQASKYHQPPKMM-IMDDZUEWSA-N	433.908	1.531	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2c[nH]c3ncccc23)[C@@H]1c1cccnc1)[C@H](O)CCl	1803139653	SIJAYZSFTMIPGB-BMGDILEWSA-N	427.892	1.877	50	20	IDGD	
Cc1cc(C(=O)NC[C@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)on1	1805709730	QRWODURLNRORHK-OXQOHEQNSA-N	428.493	1.071	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H](CNC(=O)c2cc(CO)on2)[C@@H]1c1cccnc1	1811592070	FUFPDUTWVZEHJO-BEFAXECRSA-N	432.553	1.733	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2ccc(F)nc2)[C@H]1c1cccnc1	1813074276	SLELNUPTDIEKOX-KKSFZXQISA-N	442.495	1.308	50	20	IDGD	
C[C@@H](C(=O)N1CC[C@H](CNC(=O)C(Cl)Cl)[C@H]1c1cccnc1)N1CCN(C)CC1	1813078801	KWRHHSJGFVUHKI-USXIJHARSA-N	442.391	1.527	50	20	IDGD	
COC(=O)NCC(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)CBr)[C@H]1c1cccnc1	1813262105	CBXDNRXSQWARMZ-NOLJZWGESA-N	441.326	1.474	50	20	IDGD	
CCS(=O)(=O)CC(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](F)Br)[nH]n1	1815174424	RZDUSKABIGGJHU-ZWNOBZJWSA-N	439.307	1.527	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CN2C(=O)CNC2=O)n[nH]1	1815599831	SYCAKELBNPOECM-APPDUMDISA-N	445.307	1.190	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)C/N=C/c2ccco2)[nH]n1)c1ccc(B(O)O)cc1	1817472471	UAUXDQBPGUXFLX-NZYROCMPSA-N	449.276	1.108	50	20	IDGD	
Cc1cc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)cc(O)n1	1818053778	DJSYCRKKMVQVIA-MRXNPFEDSA-N	443.508	1.498	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)CCN3CCOC3=O)sc2C1	1818697157	NIICVSSFNPABQQ-GHMZBOCLSA-N	430.914	1.151	50	20	IDGD	
O=C(CCN1CCOC1=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](F)Br)[nH]n1	1818848441	FPJBTSRTQOIFMN-SMDDNHRTSA-N	446.277	1.935	50	20	IDGD	
C=CC[C@@H](C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819403845	ILXBJRJHOPRRNM-DYVFJYSZSA-N	425.493	1.926	50	20	IDGD	
CC(C)CCC(=O)N[C@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1	1819800947	VOUPXVVKHXHUTE-LBPRGKRZSA-N	430.534	1.804	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CN2C(=O)CNC2=O)[nH]n1	1820862828	UVFDXDCYUZWGOO-PIGZYNQJSA-N	445.307	1.190	50	20	IDGD	
CC(C)=NO[C@H](C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1820970356	ZPANVQKNMDMQMG-RDTXWAMCSA-N	441.297	1.196	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1[nH]nc3ncccc13)CC2	1825997946	DROYTGYGMIIPPY-MWLCHTKSSA-N	434.909	1.894	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)Cc2cccnc2)CC1	1827202551	ZQPILGQYBQMNFJ-JOCHJYFZSA-N	435.333	1.237	50	20	IDGD	
Cc1cc(NC(=O)CC(=O)N2CCCC[C@H]2C2CCN(C(=O)[C@@H](O)CCl)CC2)no1	1827660091	LXWNJSOKHAQYQP-HOTGVXAUSA-N	440.928	1.531	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@H]2C[C@@H](O)C2)CC1	1828366322	MCSRQNIXSNGLCJ-SJUMRLIMSA-N	443.548	1.511	50	20	IDGD	
O=C(CCOc1ccc(F)cc1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1830254176	DZKCRVLGODABHF-MJGOQNOKSA-N	432.851	1.585	50	20	IDGD	
COc1cc(Cl)cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)c1	1830738049	KWOKETCNUGAOHR-VQIMIIECSA-N	447.315	1.018	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)Cc2cncnc2)CC1	1831871916	IBAUCFUUYMITLE-IBGZPJMESA-N	430.553	1.012	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3c(C)noc3C)CCO2)C1	1833065424	CCXFMFJQTHWNJN-PXNSSMCTSA-N	427.929	1.698	50	20	IDGD	
C[C@@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)c3ncc[nH]3)CC2)CC1	1833262452	QGLRVDKVCKPOCQ-ZDUSSCGKSA-N	426.359	1.626	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)CCc3ccc(F)nc3)CC2)CC1)[C@H](O)CCl	1833308616	XUQUNBQEMSIWBB-GOSISDBHSA-N	440.947	1.325	50	20	IDGD	
CC(=O)N[C@@H](C(=O)NC1CCN(C2CCN(C(=O)C(Cl)Cl)CC2)CC1)C(C)(C)C	1833402780	DJUSIFREKFYHFF-INIZCTEOSA-N	449.423	1.913	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCC(N2CCC(NC(=O)Cc3cncnc3)CC2)CC1	1833862259	JQYNAJVQERSYGM-FQEVSTJZSA-N	442.391	1.827	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cnc(N)s3)CC2)CC1	1834768481	XCOIKLCWYOMZKT-AWEZNQCLSA-N	429.974	1.164	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCC(OC2CCN(C(=O)CCn3cncn3)CC2)CC1	1836625048	GWJIFIRCLRMLHL-UHFFFAOYSA-N	425.961	1.932	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc4[nH]ccc4n3)CCO2)C1	1836902351	AYASLXLBAQFJOY-NRFANRHFSA-N	434.924	1.898	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4nc[nH]c4c3)C2)C1	1837713028	CZOJEDVHAVLJCS-OAQYLSRUSA-N	446.580	1.484	50	20	IDGD	
CC(C)(C)c1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)[nH]n1	1837993940	NIKBWFYOFGBRAQ-SFHVURJKSA-N	433.336	1.581	50	20	IDGD	
Cc1ncc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)cn1	1839151366	PDMIHQOMVGGIAM-ROUUACIJSA-N	431.320	1.091	50	20	IDGD	
N#Cc1cc(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)ccc1F	1839187162	NPCBXOUZWHZBAF-IEBWSBKVSA-N	427.835	1.231	50	20	IDGD	
O=C(c1sccc1F)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839198889	OMQHVRYBADZPAZ-WFASDCNBSA-N	439.278	1.648	50	20	IDGD	
CC(C)=NO[C@@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1	1839227098	JLOGTAAWYONTHA-QFBILLFUSA-N	429.590	1.095	50	20	IDGD	
Cn1cc2cc(C(=O)N3CCO[C@@]4(COCCN(C(=O)C(Cl)Cl)C4)C3)ccc2n1	1839506118	ANMCYZJWBDMHGK-IBGZPJMESA-N	441.315	1.447	50	20	IDGD	
O=C1CCc2ccc(C(=O)N3CCO[C@@]4(COCCN(C(=O)[C@@H](F)Cl)C4)C3)cc2N1	1839609169	UHXPNDLUUNSBOG-XLIONFOSSA-N	439.871	1.176	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1CCc3ccccc3O1)CCO2	1840137995	FVTGPRWZVJBXQN-LQBOVUBWSA-N	436.936	1.854	50	20	IDGD	
COc1cccc(/C=C/C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)c1	1840189827	NOQSOJUGCURSHB-RRFGBZISSA-N	443.327	1.969	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(C)cc3O)CCO2)C1	1840669770	OQVZSZYOYTVEBZ-JXFKEZNVSA-N	426.897	1.024	50	20	IDGD	
O=C(c1cccc2nc(C(F)(F)F)[nH]c12)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1	1841351424	PORJQBYFSSAWAO-LBPRGKRZSA-N	430.814	1.998	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)c2ccc(C(F)(F)F)n2C)C1	1843581762	RSZPTRHWLNCTMV-UHFFFAOYSA-N	429.443	1.234	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2cc3cccn3cn2)C1	1843806144	NZSAJQULKRBSKV-MFKUBSTISA-N	433.472	1.285	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCO)C(=O)N1CC2(CCCN2C(=O)CO[Si](C)(C)C)C1	1844377317	ODBABCDTQYYLBW-HNNXBMFYSA-N	443.617	1.317	50	20	IDGD	
C=CC[C@@H](C)C(=O)N1CCCC12CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2	1845980656	BBMXVNLURIBALC-GOSISDBHSA-N	427.549	1.748	50	20	IDGD	
CN(CC(=O)N1CC2(CCCN2C(=O)C2=COCCC2)C1)NC(=O)NCc1ccccc1	1846408687	AUSWZJLDUQIDHU-UHFFFAOYSA-N	441.532	1.230	50	20	IDGD	
CCSc1ncccc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cccc(B(O)O)c1	1847193685	AGBHCPKVAXXKLP-ROUUACIJSA-N	425.319	1.003	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc(-c2ccccc2)on1	1847198921	KSHPKANVSITZSB-PMACEKPBSA-N	431.257	1.151	50	20	IDGD	
CCCc1n[nH]c(=S)n1CC(=O)NNC(=O)c1nn(CCC)c(=O)c2ccccc12	17163548	SGVAOSKEAYRYGJ-UHFFFAOYSA-N	429.506	1.474	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)OC)c1	25414275	ULVOFHFCAHYVDK-UHFFFAOYSA-N	437.474	1.107	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Cc2ccc(C(F)(F)F)cc2)c1	26745580	AGGJUNMNSYNFHF-UHFFFAOYSA-N	429.420	1.959	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)c2ccccc2c1=O	726523390	LDCZMORUMQGVHD-UHFFFAOYSA-N	427.421	1.278	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccc3c(c2)OCO3)c1	726541036	QDOBIVVPMQJQOR-UHFFFAOYSA-N	442.453	1.629	50	20	IDGD	
COc1cc([N+](=O)[O-])ccc1OC(=O)Cn1cnc2c(c(Br)nn2C)c1=O	727089861	AJJBXWVJIUUZGG-UHFFFAOYSA-N	438.194	1.415	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3ccc(OC(F)F)cc3)cc2)CC1	728212872	ITFDOJXHMVAMJI-UHFFFAOYSA-N	440.472	1.981	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2)C12CC3CC(CC(C3)C1)C2	728261483	SGPJEGXNJLNARS-UHFFFAOYSA-N	437.474	1.892	50	20	IDGD	
CC[C@H](NC(=O)NNC(=O)c1ccc2c(c1)OCCO2)c1cccc(S(N)(=O)=O)c1	729230785	NWBNPCNWNQHDHU-HNNXBMFYSA-N	434.474	1.201	50	20	IDGD	
O=C(CCc1nc2cc(C(F)(F)F)ccc2s1)NNC(=O)[C@H]1CCS(=O)(=O)C1	730457353	HBMABCUEZBRZBS-VIFPVBQESA-N	435.449	1.830	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)CNC(=O)c1c(F)cccc1Cl	730597061	RGXPOYPVJGLJKP-UHFFFAOYSA-N	431.855	1.969	50	20	IDGD	
O=C(COc1cccc(NC(=O)c2ccco2)c1)NNC(=O)COc1ccccc1O	730782263	KSOSJEMORKJUPR-UHFFFAOYSA-N	425.397	1.843	50	20	IDGD	
CSCC[C@H](C(=O)NNC(=O)Cc1ccccc1F)N1C(=O)[C@H]2CCCC[C@H]2C1=O	731329503	UKPABIISMHMHMC-HLLBOEOZSA-N	435.521	1.813	50	20	IDGD	
Cn1cnnc1SCC(=O)Nc1cccc(C(=O)NNC(=O)Cc2ccccc2F)c1	731344226	AQFOVCHHJRTKNC-UHFFFAOYSA-N	442.476	1.689	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NC[C@@H]2CN(CC(C)C)CCO2)cc1Br	732255682	KAROWPSUKSUTNY-CQSZACIVSA-N	443.342	1.759	50	20	IDGD	
Cc1cc(C)c(N2C[C@H](C(=O)NNC(=O)CCN3C[C@H](C)O[C@H](C)C3)CC2=O)c(C)c1	732261983	PYSIHTXDOUUQLM-CEXWTWQISA-N	430.549	1.611	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)NCCCC(=O)N2CCc3ccccc32)nc2ccccc21	732475323	BKSULQPFYHRZHY-UHFFFAOYSA-N	434.500	1.816	50	20	IDGD	
CCN(CC)[C@H](C(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1cccc(C(F)(F)F)c1	733915907	ZNVIGOVJYWVHDG-HIFRSBDPSA-N	435.468	1.670	50	20	IDGD	
CN(CC(=O)NNc1cc(C(F)(F)F)nc(-c2cccnc2)n1)[C@H]1CCS(=O)(=O)C1	734259110	QEBAIZGNSVFCHD-LBPRGKRZSA-N	444.439	1.119	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1ccc(O)c(C(=O)NNC(=O)c2cnn(C)c2)c1	735446270	JMWRSCDFUSCMLG-UHFFFAOYSA-N	445.457	1.010	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)CC2(N3CCOCC3)CCCC2)c2ccccc2c1=O	735833593	KKYKFLREYDKYJG-UHFFFAOYSA-N	427.505	1.213	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COCc2ccccc2)cc1S(=O)(=O)N1CCCC1	737636382	LXNPEXAAJSHVIL-UHFFFAOYSA-N	447.513	1.458	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)[C@@H](C)Oc1cccc(Br)c1)CN1CCOCC1	739049571	PXWKTERJZZSWPI-UONOGXRCSA-N	443.342	1.515	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)NCc1cc(F)ccc1N1CCOCC1	740902750	GXBXVRNBSLWOLD-UHFFFAOYSA-N	426.452	1.763	50	20	IDGD	
COCCOCc1cc(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)ccc1F	742036165	GPMQMALHOAMWDY-UHFFFAOYSA-N	438.481	1.357	50	20	IDGD	
Cc1nn(C)c(C)c1S(=O)(=O)N[C@H](C)C(=O)NNC(=O)c1cccc2ccccc12	742081624	GSBFGVIRQOVEMW-CYBMUJFWSA-N	429.502	1.318	50	20	IDGD	
Cc1cccc(-n2c(SCC(=O)NNC(=O)C(C)(C)C)nnc2N2CCOCC2)c1	742451725	ZQUAMEJZMQYOPC-UHFFFAOYSA-N	432.550	1.698	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(Cl)c(N3CCNC3=O)c2)c1	742534203	AQANKJSULKRPCT-UHFFFAOYSA-N	436.877	1.348	50	20	IDGD	
CC[C@@H](C)NC(=O)CN1CCN(C(=O)NNC(=O)c2cccc(Br)c2)CC1	743685798	FBTLQTYQSZPYAU-CYBMUJFWSA-N	440.342	1.336	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)N[C@H](CN1CCCC1=O)c1ccccc1	745499101	AVAPVJSREFJXCO-MRXNPFEDSA-N	427.417	1.608	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)N[C@@H]3C[C@]3(C)c3ccccc3)nc2)CC1	745859463	YZUSOTKCISYERJ-WIYYLYMNSA-N	444.561	1.374	50	20	IDGD	
CC(C)[C@@H](NS(=O)(=O)c1ccc2ccccc2c1)C(=O)NNC(=O)N1CCOCC1	745992038	SVFLVRCNPGDUKH-GOSISDBHSA-N	434.518	1.216	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cc(C(=O)NNC(=O)N3CCOCC3)ccc2C)cc1	745992992	QYRLUKVYLRPUDG-UHFFFAOYSA-N	448.501	1.491	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)[C@H]3CN(C)CCO3)c2)c(C)c1	746092557	WMRLFZMBEXERPH-LJQANCHMSA-N	446.529	1.196	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCCc2cn3cccc(C)c3n2)cc(OC)c1OC	746775605	JBVGARNJTJTRBU-UHFFFAOYSA-N	427.461	1.855	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)C1CCN(S(=O)(=O)c2cc(F)ccc2F)CC1	747322921	CMVHVVRKECGFQI-UHFFFAOYSA-N	438.456	1.151	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)[C@@H]2CCCN2c2ncccn2)CC1	747397277	JLSIIYVJCFHHRC-HNNXBMFYSA-N	433.513	1.175	50	20	IDGD	
C[C@@H]1CCCN(S(=O)(=O)c2ccc(CNC(=O)NNC(=O)Cc3ccncc3)cc2)C1	747493657	CBEVCRLIJSIYPK-MRXNPFEDSA-N	445.545	1.575	50	20	IDGD	
CCC[C@H](C)NC(=O)[C@@H]1CCCN(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)C1	747853539	XORZOLQIAMXSMW-GOEBONIOSA-N	428.497	1.034	50	20	IDGD	
COCCO[C@@H](C)C(=O)NN=Cc1cc(I)c(OC)c(OC)c1	748258839	CYGHPRZLRWGCNY-JTQLQIEISA-N	436.246	1.810	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1CC(CC(=O)NNC(=O)CNC(=O)c1ccco1)C2	748303504	JYPYICRKLICWHB-GJZGRUSLSA-N	434.493	1.725	50	20	IDGD	
Cc1nccn1C[C@H](C)CNC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	749195536	GCWBLOPLXRONMH-GOSISDBHSA-N	427.553	1.370	50	20	IDGD	
CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)NNc1nc2ccccc2c(=O)n1C	749390746	YKASRCLUDLPAPJ-LJQANCHMSA-N	436.447	1.744	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2ccc3c(c2)NC(=O)[C@H](C)N3C)c2ccccc2c1=O	749866449	OQYPGGVULNTLQN-ZDUSSCGKSA-N	448.483	1.658	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)N[C@H]3CCS(=O)(=O)C3)c3c(C)noc3n2)cc1	751363929	YJKDMYGSQOUJRF-AWEZNQCLSA-N	443.485	1.638	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)c1noc(Cc2ccccc2)n1	753038288	NUFORHIDJHBTOR-CYBMUJFWSA-N	433.432	1.341	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H]2[C@@H]3CCO[C@H]3C23CCCC3)c1	755088501	MQBXVJITVIBFBM-GVDBMIGSSA-N	436.534	1.229	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2cccnc2)cc1S(=O)(=O)N1CCCCC1	755414573	YVMWCKSDOOHJGH-UHFFFAOYSA-N	433.490	1.731	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)Nc2ccc(N3CCNC(=O)C3)c(Cl)c2)c1	755937431	IORUEIAEOIXGHK-UHFFFAOYSA-N	445.867	1.096	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1O)Nc1cccc(N2CCS(=O)(=O)CC2)c1	756205300	FTFKUJNSIFAXFA-UHFFFAOYSA-N	438.893	1.747	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)N[C@@H]1CCN(c2c(F)cccc2F)C1=O	756209400	ARGGGZBMQSVJCD-CQSZACIVSA-N	432.383	1.486	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)Nc1ccc(S(=O)(=O)NCc2ccccc2)cc1	756865305	PZWREOCZXBKHKG-UHFFFAOYSA-N	428.474	1.663	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)CN2C(=O)N[C@]3(C[C@@H](C)C[C@@H](C)C3)C2=O)cc1OC	756868480	USODPEZXFFPQGH-HSAQVAQVSA-N	446.504	1.602	50	20	IDGD	
C[C@H]1C[C@H](C)CC2(C1)NC(=O)N(CC(=O)NNc1nc3ccccc3c(=O)n1C)C2=O	756996321	PYZDSSLICYUPNF-STQMWFEESA-N	426.477	1.123	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(N3CCCC3=O)ccc2Cl)c1	760341179	ACOGSYDLVJNYON-UHFFFAOYSA-N	435.889	1.945	50	20	IDGD	
NS(=O)(=O)c1ccc(C(=O)NNC(=S)Nc2cccc(Br)c2)cn1	762739446	ZHZLPJHVKCSXKW-UHFFFAOYSA-N	430.309	1.123	50	20	IDGD	
O=C(NNc1nccc(N2CCOCC2)n1)c1nn(-c2ccccc2C(F)(F)F)cc1O	762855554	GOBAITWZPICOIU-UHFFFAOYSA-N	449.393	1.980	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccc3oc(C)nc3c2)cc(OC)c1OC	763538644	FVDJLMZYKLJVRU-UHFFFAOYSA-N	428.401	1.562	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ccc(OC)c(OC)c2)c(F)cc1F	763550433	MUBRXXBWWFGVMI-UHFFFAOYSA-N	437.355	1.168	50	20	IDGD	
CCOC(=O)/C=C\c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(OC)c(OC)c2)cc1	763552348	ZAJVJXQFKUCGPW-GHXNOFRVSA-N	441.440	1.680	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1ccn(-c2ccccc2Cl)n1	763629907	SJAPDBLDOYCNRB-UHFFFAOYSA-N	437.847	1.882	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(CCN3CCCCC3)cc2)cc1	763682533	VXOYQDFMIAYJQH-UHFFFAOYSA-N	449.511	1.752	50	20	IDGD	
CCNC(=O)c1ccc(C)c(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)c1	763849002	GVVUAVWKEVZMMO-ZDUSSCGKSA-N	430.436	1.437	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccc(N2CCOC[C@H]2C)cc1	763852339	WRLOELAUXZYGJX-CABCVRRESA-N	444.463	1.604	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(NC(C)=O)c(C)c2)cc1	763859718	FJSPBURMYBYYGH-AWEZNQCLSA-N	442.472	1.906	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccc(N2C(=O)CCCC2=O)cc1	763920999	OTMNNQBPWZTUCA-UHFFFAOYSA-N	426.404	1.198	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccc(C(=O)NC2CCOCC2)cc1	763921566	SVBNSYGPXFJBAY-UHFFFAOYSA-N	442.447	1.063	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)C(=O)Nc1cc(C(F)(F)F)ccc1N1CCOCC1	763992844	JUMALAKNUSRCCG-UHFFFAOYSA-N	439.394	1.280	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)Nc1ccc(C(F)(F)F)nc1	764004799	MZKLAGJTCDANOX-UHFFFAOYSA-N	434.172	1.601	50	20	IDGD	
COc1ccc(NC(C)=O)cc1NC(=O)C(=O)NNC(=O)c1cccc(Br)c1	764063369	OPZQNTQXXRARFV-UHFFFAOYSA-N	449.261	1.816	50	20	IDGD	
COC(=O)NCc1ccc(NC(=O)C(=O)NNC(=O)CCc2ccc(OC)cc2)cc1	764130605	AGBMPQXPOSFTMI-UHFFFAOYSA-N	428.445	1.270	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2O1)C(=O)N1CCc2cc(Br)cc(F)c21	764153187	JSKGRAMPGVAMBT-HNNXBMFYSA-N	448.248	1.628	50	20	IDGD	
COC(=O)CCOc1ccc(NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)cc1	764242650	KOLKXCRHFFBDFC-UHFFFAOYSA-N	438.440	1.369	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)Cc3ccccc3F)cc2F)C[C@@H](C)O1	764313266	JSVIGQRPCMYJQO-OKILXGFUSA-N	446.454	1.907	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)C(=O)Nc1ccc(CCN2CCSCC2)cc1	764320898	NKOOIPUFHHRRMX-UHFFFAOYSA-N	444.532	1.746	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)C(=O)Nc1ccc(C(=O)OC)c(C(=O)OC)c1)c1ccccc1	764328037	AWJKOSJUMFLBKM-OAHLLOKOSA-N	441.440	1.540	50	20	IDGD	
Cn1ccnc1C(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc3ccccc3o2)cc1	764331802	HKYJPRJZXLIJFH-UHFFFAOYSA-N	431.408	1.797	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)C(=O)Nc1cccc2c1CCN2S(C)(=O)=O)c1ccccc1	764331810	HTSGBOXJUTXBAL-OAHLLOKOSA-N	444.513	1.288	50	20	IDGD	
CC(C)(C)c1cc(NC(=O)C(=O)NNC(=O)[C@H]2COCCO2)n(-c2cccc(Cl)c2)n1	764423989	FDYXLVFOBUJNRM-CQSZACIVSA-N	449.895	1.325	50	20	IDGD	
CCN(C(C)=O)c1nc(C=NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cs1	764830594	MKALZTMTSOTFGK-UHFFFAOYSA-N	442.545	1.424	50	20	IDGD	
C[C@@H](CCC(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1)NC(=O)OC(C)(C)C	765483839	WWXSTCCILJCXOQ-LBPRGKRZSA-N	426.901	1.797	50	20	IDGD	
C[C@H]1Cc2cc(C(=O)NNC(=O)c3cc(-c4cccs4)[nH]n3)ccc2N1S(C)(=O)=O	765570131	SGEZTQPOTXTXFR-NSHDSACASA-N	445.526	1.924	50	20	IDGD	
O=C(Cc1c[nH]c2cc(F)ccc12)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765732057	FXBRXUGRRAFWGC-UHFFFAOYSA-N	437.475	1.455	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(CCC(=O)NNC(=O)CNC(=O)c2cccnc2)CC1	765807277	ZTNBXNXHPHPFFN-UHFFFAOYSA-N	433.509	1.386	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)CN1CCC(C(=O)Nc2cccc(C#N)c2)CC1	766863144	KPGVSKWHSAQJBQ-UHFFFAOYSA-N	433.512	1.907	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2cc(C3CC3)nn2-c2ncccn2)c1	768233181	KVMADSPYPIPWHL-UHFFFAOYSA-N	435.444	1.013	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)c2ccc(S(=O)(=O)N(C)C)nc2)c1	769728192	NEANHTNNHMWTER-UHFFFAOYSA-N	434.518	1.604	50	20	IDGD	
CCN1CCN(CCCCNC(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)CC1	770181600	WKLMOJLLIBPFIH-MRXNPFEDSA-N	425.961	1.855	50	20	IDGD	
COC(=O)CNC(=O)Cc1ccc(NC(=O)NNc2ccnc(Br)c2)cc1	771115810	BZPSAACJJMMSON-UHFFFAOYSA-N	436.266	1.824	50	20	IDGD	
COc1cc(C(=O)NNc2ccnc(Br)c2)cc(OC)c1OCC(N)=O	771547495	PBHHWLITPYVEJH-UHFFFAOYSA-N	425.239	1.482	50	20	IDGD	
Cn1c(O)nc2ncc(-c3cccc(C(=O)NNC(=O)CNC(=O)OC(C)(C)C)c3)cc21	771827394	SNDUZGNNEBETHH-UHFFFAOYSA-N	440.460	1.627	50	20	IDGD	
CCOC(=O)CON=C(C(=O)NNc1ccc(F)cc1Br)c1cc[nH]n1	772427811	RXNOHCFKWYOLSN-UHFFFAOYSA-N	428.218	1.738	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)C1(S(=O)(=O)c2ccccc2)CC1	772885240	XTPSTYOYZUYGHB-UHFFFAOYSA-N	435.889	1.110	50	20	IDGD	
CC(C)Oc1ccc(S(=O)(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)cc1	773238825	VGOUFJASKXIDCG-UHFFFAOYSA-N	425.894	1.753	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)c2cnc(O)c(Br)c2)C1	773422865	ZEAORINXRRJZHJ-JTQLQIEISA-N	443.298	1.958	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)C(=O)Nc2ccc(NC(=O)NC[C@H]3CCCO3)cc2)n1	773483428	WTBTVXVVJRWVLE-MRXNPFEDSA-N	427.465	1.476	50	20	IDGD	
CCOc1ccc(-c2nnc(S)n2CCC(=O)NNC(=O)N2CCN(C)CC2)cc1	773660186	WDUXXLXBGUGEJC-UHFFFAOYSA-N	433.538	1.011	50	20	IDGD	
COC(=O)CN1CCN(c2ccc(NC(=O)C(=O)NNc3c(F)cccc3F)cc2)CC1	773708948	ZIVDEELTSWNXNM-UHFFFAOYSA-N	447.442	1.342	50	20	IDGD	
O=C(NNc1cccc(Cl)c1)C(=O)Nc1ccc(N2CCN(C(=O)C3CC3)CC2)nc1	773736679	ROHRZPRRKXLSBX-UHFFFAOYSA-N	442.907	1.875	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)N[C@H]1CCN(c2ccccc2OC(F)F)C1	778672044	PHDREGPPUHQPKU-LBPRGKRZSA-N	443.451	1.722	50	20	IDGD	
COCCN1C(=O)CCc2cc(NC(=O)C(=O)NNc3cccc(C(=O)OC)c3)ccc21	778698177	ZAPFRAVJNRZXMK-UHFFFAOYSA-N	440.456	1.481	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1ccnn1Cc1cccc(Cl)c1Cl	779462751	SBQCMXBZELHVSM-SECBINFHSA-N	449.320	1.329	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1ccnn1Cc1c(Cl)cccc1Cl	779471022	DTQKACHPVWZGGL-SECBINFHSA-N	449.320	1.329	50	20	IDGD	
C[C@]1(c2ccc(Br)cc2)NC(=O)N(CC(=O)NNc2ccnc(F)c2)C1=O	781367526	CSIOKMLLICFSCX-QGZVFWFLSA-N	436.241	1.894	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)c1	781712569	JBNJOPKUOZTEBK-UHFFFAOYSA-N	434.311	1.686	50	20	IDGD	
CNC(=O)[C@@H]1CN(CC(=O)NNC(=O)c2cc(Cl)ccc2OC)c2ccccc2O1	781732584	XIABPZOZJUVYQE-KRWDZBQOSA-N	432.864	1.123	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ncncc2Cl)cc1NC(=O)CN1CCCCC1	782159317	GZALWVBPCFMHDF-UHFFFAOYSA-N	445.911	1.945	50	20	IDGD	
Cn1c(=O)c2cc(NC(=O)C(=O)NN(c3ccccc3)c3ccccc3)cnc2n(C)c1=O	782821579	OHJIJGIPCKMDCI-UHFFFAOYSA-N	444.451	1.440	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)cc1)C(=O)Nc1nc2cc3c(cc2s1)OC(F)(F)O3	782832612	PSVIOWOYISYBLR-UHFFFAOYSA-N	436.352	1.723	50	20	IDGD	
CN(c1ccccc1NC(=O)C(=O)NNc1ccccc1Br)S(C)(=O)=O	782984989	WTBOKGGMZQXXNL-UHFFFAOYSA-N	441.307	1.927	50	20	IDGD	
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)NNC(=O)c1cccc2ncccc12	783828648	WYPXHHKFKCNOSY-UHFFFAOYSA-N	430.398	1.553	50	20	IDGD	
Cc1cc(S(N)(=O)=O)cc(NC(=O)C(=O)NNc2ccc(Br)cn2)c1C	784339342	HCSUEGOQSRXHRV-UHFFFAOYSA-N	442.295	1.190	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](n2cc(C(=O)NNC(=O)NCC(F)(F)F)cn2)C1	784625965	SCZJFJQMUDCOFK-LBPRGKRZSA-N	434.419	1.961	50	20	IDGD	
COC(=O)CNC(=O)Cc1ccc(NC(=O)C(=O)NNc2ccc(F)c(F)c2F)cc1	784807481	ZNNGDGVMXNOKMF-UHFFFAOYSA-N	438.362	1.017	50	20	IDGD	
COc1cccc(NNC(=O)[C@@H]2CC(=O)C[C@H](C)[C@H]2C(=O)NNc2cccc(OC)n2)n1	791141829	XHNYWNVSHLFBKG-BBEJJTJUSA-N	442.476	1.312	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)Nc1ccc(N2CCCCC2)c2ncccc12	791946462	NYABLCINBMBBRV-AWEZNQCLSA-N	431.518	1.813	50	20	IDGD	
CO[C@H]1CCC[C@@H](CC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)C1	792773424	RHFRCRXJYHBOIL-WBVHZDCISA-N	439.534	1.064	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)c(OC)c(C)c1OC	796991673	GUQNLISPMWQMAJ-UHFFFAOYSA-N	442.428	1.057	50	20	IDGD	
Cn1cc(-c2cc(F)ccc2NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)cn1	797006711	MIAFUTJVADBXAT-UHFFFAOYSA-N	447.373	1.984	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(=O)n(Cc3ccccc3Cl)c2)n1	797369611	BAFLXIIKKWVMFW-UHFFFAOYSA-N	439.859	1.653	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)Nc1ccc(S(=O)(=O)N(C)C)cn1	797653217	MBDFIVIIPAJFQG-NSHDSACASA-N	425.442	1.091	50	20	IDGD	
CC(C)(Cc1nc2ccccc2[nH]1)C(=O)NNC(=O)c1csc(N2CCOCC2)n1	798834554	YGKGVNGXOUDNHB-UHFFFAOYSA-N	428.518	1.886	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)N1CCC(N2CCc3ccccc32)CC1	799912076	QWBKVSGOLIEACA-UHFFFAOYSA-N	427.530	1.746	50	20	IDGD	
Cn1cc(Oc2ccccc2C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cn1	801466858	ZBEYUDSPVWBNBH-UHFFFAOYSA-N	439.384	1.739	50	20	IDGD	
O=C(CNC(=O)c1c(Cl)cccc1[N+](=O)[O-])NNC(=O)Nc1ccc2c(c1)OCO2	802101810	WAWQSZLMOTUWGF-UHFFFAOYSA-N	435.780	1.560	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cn(C3CC3)c(C)cc2=O)c1	806307057	WXEGOPBLSPSQGX-UHFFFAOYSA-N	446.529	1.597	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)C2CCN(c3ccc(C#N)cc3F)CC2)C[C@H](C)O1	806341041	YKZZQMVXVTYWGD-HOTGVXAUSA-N	431.512	1.560	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cccc4c3CNC4=O)n[nH]2)cc1	806978708	FAQNUBOSGZGOTL-UHFFFAOYSA-N	432.440	1.282	50	20	IDGD	
Nc1ccc(C=NNC(=O)c2cc(S(=O)(=O)NCc3ccccc3)ccc2O)cn1	807960420	SFLPIQDHYIHYDS-UHFFFAOYSA-N	425.470	1.612	50	20	IDGD	
Cc1ccc(S(=O)(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1C(=O)OC(C)C	808071114	NCNPIONHGUPCPZ-UHFFFAOYSA-N	434.470	1.955	50	20	IDGD	
CSCc1cccnc1C(=O)NNC(=O)CN1CCN(Cc2ccc(C)cc2)CC1	810593870	LQLRQIJBRYKJHE-UHFFFAOYSA-N	427.574	1.832	50	20	IDGD	
COc1cccc(NNC(=O)CNS(=O)(=O)c2ccc(NC(C)C)c([N+](=O)[O-])c2)n1	810971711	DHQLTUQZRNHZNP-UHFFFAOYSA-N	438.466	1.240	50	20	IDGD	
O=C(CCCc1ccccc1)NNS(=O)(=O)CCCN1C(=O)c2ccccc2C1=O	811683736	ZLMDVIXWMYPRHM-UHFFFAOYSA-N	429.498	1.646	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(=NNC(=O)C(=O)Nc2ccccn2)[C@H]([C@H]2CCOC2)C1	812226313	KVBPIBFYZBDEMM-GJZGRUSLSA-N	431.493	1.786	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)NCc1cc(C)nc(N2CCCC2)n1	813861319	QTMNWSOAMLCTAW-UHFFFAOYSA-N	428.493	1.693	50	20	IDGD	
CC(C)(C)Oc1ccc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)nc1	814516871	FWXLLTSYIFVOLL-KRWDZBQOSA-N	429.429	1.403	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2F)cc1)[C@@H]1C[C@H]1C	815565176	FIXAAECYSDGNEI-FZKQIMNGSA-N	442.447	1.752	50	20	IDGD	
CS(=O)(=O)c1cccc(Oc2ccc(NC(=O)C(=O)NNc3ncncc3F)cc2)c1	815764102	QYRYVHQDYMBAOI-UHFFFAOYSA-N	445.432	1.893	50	20	IDGD	
Cc1nc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c(Br)s1	816810470	NDALGVOUDWSYRL-UHFFFAOYSA-N	447.336	1.539	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2ccc(O)c(C(=O)NNC(=O)c3ccc[nH]3)c2)cc1	822065289	BJEZKVKCQXBFEX-UHFFFAOYSA-N	430.442	1.605	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NN=Cc1c(N2CCOCC2)nc2ccccn2c1=O	874103088	ACXYLXHVUHUYIT-UHFFFAOYSA-N	441.875	1.957	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)OCC(=O)NCC(=O)N2CCCC2)c(C)n1C[C@H]1CCCO1	912619750	QHGXLRMQQGLSNX-DEWISIQVSA-N	442.516	1.473	50	20	IDGD	
O=C(/C=C\c1ccc2c(c1)OCO2)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	912642910	IEBTYRWUSSWJFV-CLFYSBASSA-N	443.481	1.674	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)[C@@H]2CC(c3cccc(F)c3)=NO2)c2ccccc2c1=O	915133418	POCIYMSLJLKTAY-SFHVURJKSA-N	437.431	1.900	50	20	IDGD	
CC(=O)c1cccc(S(=O)(=O)NCC(=O)NNC(=O)Cc2c[nH]c3ccccc23)c1	915787619	HAIJWKQRUNJRSN-UHFFFAOYSA-N	428.470	1.039	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2csc(C)n2)c1	916230263	SQUQWTHWNFFXTP-UHFFFAOYSA-N	425.536	1.626	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)NCCCn2nc3n(c2=O)CCCC3)cc1OC	916649516	FVHDAWVJUCHCLL-UHFFFAOYSA-N	446.508	1.213	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)c1ccc2c(c1)S(=O)(=O)N(C(C)C)C2=O	916746377	ABCKYNOESBBQLN-UHFFFAOYSA-N	441.469	1.270	50	20	IDGD	
C[C@@H](CN1C[C@H](C)C[C@@H](C)C1)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	919924796	XLCBXCJMNWXGMW-OAGGEKHMSA-N	439.582	1.247	50	20	IDGD	
COCCCNC(=O)NN=C(C)c1ccc(S(=O)(=O)N2CCC(C(=O)O)CC2)cc1	920829268	CFXGCDSUTIZFKM-UHFFFAOYSA-N	440.522	1.232	50	20	IDGD	
CC(C)(C)OC(=O)N1CCCC[C@@H]1CNC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	921070705	BEMCXZGJENOHNF-MRXNPFEDSA-N	444.496	1.396	50	20	IDGD	
CC(C)[C@@H](C(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12)N1C[C@H](C)O[C@H](C)C1	921201323	MNDPLKPHCAZFGB-YRNRMSPPSA-N	443.548	1.872	50	20	IDGD	
COc1ccccc1C1(C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)CCC1	1115942068	ICUBZWIIZOMIQG-UHFFFAOYSA-N	445.541	1.893	50	20	IDGD	
CC[C@@]1(C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)CCN(C(=O)OC(C)(C)C)C1	1319365138	IOLFIUXWRBQZEB-JOCHJYFZSA-N	443.504	1.732	50	20	IDGD	
CCc1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)nn1C	1319972365	HUYVXPIAQYBWKJ-UHFFFAOYSA-N	441.513	1.536	50	20	IDGD	
Cn1c(=O)oc2c(NC(=O)NNC(=O)C3CCN(C(=O)OC(C)(C)C)CC3)cccc21	1320260048	RGHULWZZBATSPU-UHFFFAOYSA-N	433.465	1.931	50	20	IDGD	
CS(=O)(=O)CC[C@H](NS(=O)(=O)/C=C/c1ccccc1)C(=O)N1CC=C(C#N)CC1	1321049148	RKBBHAJMJUGYEE-MXHVWWQHSA-N	437.543	1.062	50	20	IDGD	
CCc1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](C)Br)C3)n[nH]1	1777730583	DKISNVHVQPSJRP-CDHAZOANSA-N	427.343	1.883	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)c2cc(O)ccc2n1	1778423065	IXCFJVBFMPZGOM-RXVVDRJESA-N	433.892	1.292	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(C)nc4ccc(O)cc34)C2)C1	1778429202	HPKQWSZAPBKUIG-AVRDEDQJSA-N	447.919	1.946	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc4n(n3)CCCC4)C2)C1	1778557796	SKMZHCQGEXUODZ-IFXJQAMLSA-N	439.354	1.694	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)c3cccc4cnccc34)C2)C1	1778612354	DARBVXINUSQQBK-HSZRJFAPSA-N	439.516	1.051	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cccc4c3NC(=O)C4=O)C2)C1	1778709039	WSGSANUIPVBAMA-QVKFZJNVSA-N	433.892	1.672	50	20	IDGD	
CN(C)c1ccc([N+](=O)[O-])c(C(=O)N2CC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)c1	1780124501	SZUPQGFKTFDGGR-GOSISDBHSA-N	445.303	1.908	50	20	IDGD	
COc1cc(OC)cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](O)CCl)C3)c1	1780384562	KNZLSNSHOOUUNA-WAOWUJCRSA-N	440.924	1.431	50	20	IDGD	
CC(=O)N/C(=C\c1ccco1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Cl)C2	1781057616	ZXBHDOFSGDOHCN-MSVJCGOZSA-N	441.887	1.805	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)c3n[nH]c4c3CCCC4)CCO2)C1	1781228203	ZOKBPBPUNZDFPH-OALUTQOASA-N	429.348	1.968	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc4nonc4c3)CCO2)C1	1781229308	GHDWJLGBKIXILX-MSOLQXFVSA-N	427.288	1.903	50	20	IDGD	
Cc1cc(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](C)Br)C2)n[nH]1	1781998202	VKVUFBZMYGFJEA-DDUZABMNSA-N	427.343	1.558	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cn4ccsc4n3)CCO2)C1	1783534790	ZHXUZCZNJIIFGE-BZNIZROVSA-N	427.324	1.623	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)Cc3ccc(C(=O)OC)cc3)CCO2)C1	1783879469	VFLFMPWYSOZRAY-UTKZUKDTSA-N	438.908	1.099	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(OC)c(OC)cc3C)CCO2)C1	1783879786	AUXYVYDSGKCRHM-KKSFZXQISA-N	440.924	1.710	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3c(F)cc(OC)cc3F)CCO2)C1	1783881525	RWVTWJRPKNLCDN-BFUOFWGJSA-N	432.851	1.671	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cccc3cnccc13)CCO2	1783936551	XIDGNBAPXJXALC-HSZRJFAPSA-N	439.516	1.051	50	20	IDGD	
COc1nccnc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]21	1785648458	MUBSRXOZIXALJC-RSLFNQERSA-N	431.320	1.315	50	20	IDGD	
O=C1CCc2ccc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)C(Cl)Cl)C[C@@H]43)cc2N1	1790504322	NLHHCLPVRQWTDI-DZKIICNBSA-N	440.327	1.968	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cncc(F)c3)C[C@@H]21	1790961176	KVHRXPNUBCSMSX-KSYCFECVSA-N	428.302	1.988	50	20	IDGD	
COC(=O)N[C@@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2)c1ccccc1	1792799949	NSAGYADDBMCOLS-JKJDWNRSSA-N	427.860	1.208	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc3ccccn13)C2	1792868094	PHTUWOFGZTVAAA-ZJOBFFGXSA-N	435.322	1.569	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nn(C)c3c1CCC3)C2	1792868367	VWNQPPSIKGSNGE-NFFDBFGFSA-N	439.354	1.143	50	20	IDGD	
CCOc1cnc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](Br)CC)C3)cn1	1794339481	GJQXWZVXLSZIFL-ZWUHOBOKSA-N	441.326	1.252	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CNc1ccc(F)cc1)C2	1795112479	GOFOEBCGQAKHME-IVWMJMPLSA-N	428.302	1.612	50	20	IDGD	
CC(C)(C)c1ncccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1	1796191278	UBAQRXKJTRGQLG-REPLKXPHSA-N	435.333	1.625	50	20	IDGD	
Cc1cc2cccc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3cccc(B(O)O)c3)c2[nH]1	1796191492	QRTKGMHOMDYWQJ-ACDBMABISA-N	431.301	1.722	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)c1ccn(-c2ccccc2)n1	1796191935	RLQZEXFGTWNXHJ-NUZGMZIFSA-N	444.300	1.118	50	20	IDGD	
O=C(CCCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Cl)Nc1ccccc1	1796361480	RLEGLPNEEDVSIM-GTYSZEQSSA-N	425.888	1.919	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccnc(Br)c1	1798020831	CMJCWODBFXGPNF-QVHKTLOISA-N	446.729	1.301	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnc(O)[nH]1	1798181983	YWPXXUHDHBFYCG-XSDCOXNMSA-N	443.410	1.204	50	20	IDGD	
CN(C)c1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Cl)C3)c1	1798537741	DKVZQIREDZUDCZ-OJXGSEEGSA-N	428.848	1.398	50	20	IDGD	
CN(C)c1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Br)C3)cc1	1798937592	FURPEBZIVGVJJO-OCVGTWLNSA-N	428.302	1.646	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(N3CCOCC3)c1)C2	1799268130	LJAOTZUEUFPKDO-PIKOESSRSA-N	435.952	1.744	50	20	IDGD	
Cc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@](C)(Cl)CCl)ncc1[N+](=O)[O-]	1799275398	QVBRBKJWUZMYGX-TYYYEBLRSA-N	445.303	1.738	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccccc1C(N)=O	1799625714	IYDOEURDESIUIG-VZAMPYOESA-N	438.322	1.162	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnn3c1OCCC3)C2	1800643027	KHCSRENHZZPAQB-AYRXBEOTSA-N	441.326	1.042	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](Br)CC)C2	1800644156	KUUQRXJMTRCXRD-PPCPHDFISA-N	440.176	1.923	50	20	IDGD	
COc1ncc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)Br)cc1F	1800757681	IISOKRRVBQUWJY-ZKCLLBTKSA-N	430.274	1.216	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]1c1cccnc1	1803139276	NGQQMDINDJBWJB-HLIPFELVSA-N	441.919	1.957	50	20	IDGD	
C[C@H](Cc1ccccn1)C(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]1c1cccnc1	1803146254	MMFQHLVMDMJUNK-QOJCHSLYSA-N	430.936	1.961	50	20	IDGD	
COc1ccccc1CC(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]1c1cccnc1	1803148223	PJUDCZLOMKFQKS-DBXWQHBBSA-N	431.920	1.938	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H](CNC(=O)c2cc(O)ncn2)[C@H]1c1cccnc1	1803744510	PJPSULHCAWAZMN-DNVCBOLYSA-N	429.553	1.748	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@H]1c1cccnc1)c1cnsn1	1804995484	IGSXRMYURQHNSJ-WCFLWFBJSA-N	428.287	1.943	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)C(C)(C)C#N)[C@@H]1c1cccnc1	1808410612	VFDOFGSUXDQXTQ-HMDFAQMRSA-N	449.515	1.771	50	20	IDGD	
CSCC[C@H](O)C(=O)N1CC[C@H](CNC(=O)[C@@H](F)Br)[C@@H]1c1cccnc1	1808678996	SMZKUCDKDNEVNF-CBBWQLFWSA-N	448.358	1.892	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@@H](CNC(=O)c2c[nH]c(=O)cn2)[C@H]1c1cccnc1	1811446574	GBDOPOVZRRUPLQ-HACGYAERSA-N	448.321	1.516	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1ccccc1	1811662859	BPEBYZMPVGQUDF-UNMCSNQZSA-N	429.285	1.395	50	20	IDGD	
COc1cc(C(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@H]2c2cccnc2)ccc1O	1811940959	VSVNYCAIHKBKOV-WDYCEAGBSA-N	433.892	1.715	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)Cc2cscn2)[C@H]1c1cccnc1	1813071183	ODKKADIOHOODNV-KKSFZXQISA-N	444.561	1.160	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)[C@H]2CC=CCC2)[C@H]1c1cccnc1	1813073105	MJXGRSSFJUYNMK-JLMWRMLUSA-N	427.549	1.817	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@H](CNC(=O)CSc2nc[nH]n2)[C@@H]1c1cccnc1	1813346242	CKVVGIGWYXWATK-YJBOKZPZSA-N	448.625	1.849	50	20	IDGD	
CC(C)(CCl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1814693963	LSTIUVGXBBGWMG-MRXNPFEDSA-N	432.717	1.660	50	20	IDGD	
C[C@H](CBr)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2c[nH]c(=O)cn2)[nH]n1	1814782298	QRUQNESCJOMMES-MFKMUULPSA-N	437.298	1.830	50	20	IDGD	
C[C@H](CBr)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H]2CCNC(=O)C2)[nH]n1	1814783690	SXJJIUUTNRPAOP-DYEKYZERSA-N	440.342	1.959	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)C2=CCCS2)n[nH]1	1815269180	IASKWVACUNEMIW-HNNXBMFYSA-N	441.517	1.735	50	20	IDGD	
O=C(CCNC(=O)c1ccc[nH]1)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1	1815848666	NGFMRZHTNHQKRX-CABCVRRESA-N	436.900	1.150	50	20	IDGD	
COc1cccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)n1	1816270809	LWKXMNKKEJLFPA-MRXNPFEDSA-N	443.508	1.492	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnccn2)[nH]n1	1818111315	CICSDTGHARYCJU-FCLYZYNOSA-N	449.475	1.640	50	20	IDGD	
CC[C@H](C)[C@@H](O)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819401515	FRNLYQMONYNZCD-ULFGMLNVSA-N	443.508	1.121	50	20	IDGD	
C[Si](C)(C)OCC(=O)Nc1cc([C@H]2CCCCN2C(=O)Cn2ccncc2=O)[nH]n1	1819596405	IYGVHMRQRSJOQK-OAHLLOKOSA-N	432.557	1.510	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccnc4c3OCO4)sc2C1	1821235878	VHFNRGXYWPKBTD-KOLCDFICSA-N	438.893	1.746	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](C)O)n[nH]1	1822175667	KWOSTPRWRXJWQS-ZBEGNZNMSA-N	445.432	1.930	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC[C@H]1C1CCN(C(=O)Cn2ccnn2)CC1	1824092957	JRXVSHFYMQSOLI-HOCLYGCPSA-N	426.359	1.929	50	20	IDGD	
CN1CCCn2nc(C(=O)Nc3nc4c(s3)C[C@H](NC(=O)[C@H](F)Cl)CC4)cc2C1	1824381412	DQPQEHVHQFEBSG-BMIGLBTASA-N	440.932	1.935	50	20	IDGD	
CC(C)[C@@H](S)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1	1824544033	KEJSBOGYNZXPDO-FXAWDEMLSA-N	426.627	1.934	50	20	IDGD	
Cc1nnc(CCC(=O)N2CCCC[C@H]2C2CCN(C(=O)[C@@H](O)CCl)CC2)s1	1825226015	LVPNTWKDIYELNM-HOTGVXAUSA-N	428.986	1.999	50	20	IDGD	
O=C(c1ccc(F)nc1)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827051828	HGXCRSUJMLGNOM-HXUWFJFHSA-N	439.296	1.448	50	20	IDGD	
O=C(CCc1ccoc1)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2	1827106629	RBHJHKWKQFMPRQ-INIZCTEOSA-N	439.302	1.275	50	20	IDGD	
CCc1cc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)n[nH]1	1827288795	SUGDMZGRCDJIEL-NRFANRHFSA-N	438.337	1.199	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(=O)n3[nH]nnc3n2)CC1	1827400121	ZWRGVORZMQIVDK-ZBFHGGJFSA-N	449.943	1.453	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](N)CN)CC1	1827585539	ULWTUGXUMRHTLC-VPZDZECISA-N	445.514	1.777	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc4c[nH]nc34)C2)C1	1830357758	KCEMYKCHOQASDE-NRFANRHFSA-N	434.924	1.898	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(C(N)=O)cc3)C2)C1	1830370488	QRSILYMJSPPQLF-NRFANRHFSA-N	437.924	1.121	50	20	IDGD	
Cc1ccoc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2	1830538751	OWCBPJZVOFGXCT-KBXCAEBGSA-N	429.311	1.689	50	20	IDGD	
O=C(Cn1ccc2c(F)cccc21)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1830653203	YHMGDYWWHOKHGB-QUCCMNQESA-N	441.862	1.771	50	20	IDGD	
CC(C)[C@H](S)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1	1831494197	YWKYDRAELKKDQG-IAOVAPTHSA-N	427.394	1.634	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3nn(C)c4c3CCC4)C2)C1	1831646621	LVCWMMKHNAUJEY-IERDGZPVSA-N	438.956	1.386	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4ncccn4n3)C2)C1	1831651624	RZJXTJDGJCNUKQ-QRWLVFNGSA-N	435.912	1.207	50	20	IDGD	
O=C([C@H]1CCCS1(=O)=O)N1CCC([C@@H]2CCCCN2C(=O)C(Cl)Cl)CC1	1831881061	SGKXMAWVFQEQLP-UONOGXRCSA-N	425.378	1.987	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)/C=C/c3cccnc3)CCO2)C1	1833104645	KWTPVKAKNLBOQP-UPILZFLTSA-N	438.322	1.335	50	20	IDGD	
O=C(CCCC(F)(F)F)NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1833661761	AQKQXDQYZJTGKS-OAHLLOKOSA-N	427.895	1.890	50	20	IDGD	
Cc1nc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)cs1	1834457201	QDAUPJUYILOXKJ-IUODEOHRSA-N	436.303	1.212	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](NC(C)C)C(C)C)CC2)CC1	1834787862	OPUVQOVIEYTTPC-PMACEKPBSA-N	445.048	1.834	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)c3cnoc3C3CC3)C2)C1	1834818808	BEPCUMFDVMHQRX-SFHVURJKSA-N	442.310	1.407	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cccc(-n4cncn4)c3)CC2)CC1)[C@H](F)Cl	1835081732	ZYVLBKYQZBDDGG-IBGZPJMESA-N	448.930	1.987	50	20	IDGD	
Cc1noc(N)c1C(=O)N1CCC(N2CCC(NC(=O)CO[Si](C)(C)C)CC2)CC1	1835833643	ZFZOZGSPALCJEC-UHFFFAOYSA-N	437.617	1.602	50	20	IDGD	
CCc1ncsc1C(=O)NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836204148	HXMPBWWSRMXDBC-INIZCTEOSA-N	428.986	1.490	50	20	IDGD	
O=C(/C=C/C(=O)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1)c1cccs1	1836520968	ZXBJMNNXPVEENB-OAJJDEHYSA-N	447.340	1.747	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC(OC2CCN(C(=O)c3ncon3)CC2)CC1	1836673147	JKZGXKXBDGFQMI-LBPRGKRZSA-N	429.315	1.713	50	20	IDGD	
O=C(c1cccn2cncc12)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836717569	YIXJLTIBPQOYPO-IBGZPJMESA-N	434.924	1.546	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc4ncsc4[nH]3)CCO2)C1	1837747295	URAZWABLHRBXFN-LJQANCHMSA-N	440.953	1.959	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cnccc1Cl)CCO2	1837777563	YKWKXXIKPHUKSV-LJQANCHMSA-N	441.988	1.657	50	20	IDGD	
COc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@](C)(Cl)CCl)C3)C2)ccn1	1837979311	JJBSTRUYWVQZKL-RTBURBONSA-N	446.331	1.397	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cn4cccnc4n3)CC2)CC1	1838315133	GXJUFOMYOQMJIR-KRWDZBQOSA-N	449.939	1.595	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3n[nH]c4c(F)cccc34)C2)C1	1839145975	SJBFUZTUUJFRMI-XOBRGWDASA-N	438.887	1.789	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3[C@H]4SC=C[C@H]43)C2)C1	1839155147	KLUZMZQLCNTEKO-UKCJKJFHSA-N	435.373	1.554	50	20	IDGD	
Cc1cccc(Cl)c1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1	1839338869	ROONTSDFPFBHDU-DNVCBOLYSA-N	431.316	1.318	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cn4c(F)cccc4n3)CCO2)C1	1839555481	CPLCOHCEXGWIGC-VBKZILBWSA-N	438.887	1.561	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc4ccnn4c3)CCO2)C1	1839569277	WDZZQJGSOLXRFB-NQIIRXRSSA-N	434.924	1.812	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C)on3)C2)C1	1839963727	UCOAHWXYFLULGF-GUYCJALGSA-N	430.299	1.227	50	20	IDGD	
CCC[C@H]1CC[C@H](C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)CC1	1839970554	DWOUQYKYBQWKIB-IKVWTGGYSA-N	430.973	1.649	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cc(F)ccc3F)C2)C1	1840155660	CCNXTZDAJKTKKU-OXQOHEQNSA-N	446.878	1.218	50	20	IDGD	
O=C(c1nc2ccccc2[nH]1)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840187584	KSNJXWBBKJYWKU-SFHVURJKSA-N	427.288	1.437	50	20	IDGD	
Cc1ccc(OCC(=O)N2CCOC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)cc1	1840188229	YBIKKDVDFFYULQ-IBGZPJMESA-N	431.316	1.634	50	20	IDGD	
O=C(C(Cl)Cl)N1CCO[C@@]2(COCCN(C(=O)C(Cl)(Cl)Cl)C2)C1	1840189846	ONITWMZSDSLGAP-NSHDSACASA-N	428.527	1.617	50	20	IDGD	
O=C(C(Cl)Cl)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3CCc4ccccc4O3)C2)C1	1840191000	ZEXTYELUBXCENT-OXJNMPFZSA-N	443.327	1.640	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)Oc1ccccn1)CCO2	1840426990	RBGCGHUWRCYDSN-FTRWYGJKSA-N	425.913	1.323	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)C[C@@H]2OCCc3ccccc32)C1	1841553788	UQKMEBHRRSVSLK-FQEVSTJZSA-N	449.511	1.206	50	20	IDGD	
C[C@@H](Sc1cccs1)C(=O)N1CC2(CCCN2C(=O)c2cnccc2C(=O)NN)C1	1844264382	MOTITXCDZWCHCT-CYBMUJFWSA-N	445.570	1.744	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1ccc3c(c1)CCCO3)C2	1844265554	OFURPIUBYSDPBK-UHFFFAOYSA-N	435.484	1.141	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)c2cc(Cl)sc2Cl)C1	1844565602	GWIZWJIFMPBBIU-UHFFFAOYSA-N	439.129	1.866	50	20	IDGD	
C[C@H](Br)C(=O)N1CC2(CCCN2C(=O)c2ccc([N+](=O)[O-])c3c2OCO3)C1	1844758772	WQHAENXHKWOJEG-JTQLQIEISA-N	440.250	1.924	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2cc(C)cc(C#N)c2)C1	1845522213	AGQFFUMTHNDZPY-WGOQTCKBSA-N	432.484	1.818	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)c1ccco1	1847280528	QOZDVGFYCCOYLZ-YXWQFLTLSA-N	441.912	1.647	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@]2(C(=O)N3CC[C@H]4[C@@H]3CCN4C(=O)[C@H](O)CCl)C[C@@H]2C1	1847563077	MINRKPCMHGXPEW-HJFIXNJZSA-N	441.956	1.435	50	20	IDGD	
CO[C@H](C)[C@@H](C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl)N(C)C(=O)OC(C)(C)C	1847565677	WXPLXVGAKJACPM-CWVYHPPDSA-N	447.960	1.058	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](CCO)NC(=O)OC(C)(C)C	1847644494	XNVWNTOYPPGREB-CRWXNKLISA-N	448.358	1.247	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)N1CCCN(S(=O)(=O)c2c(C)noc2C)CC1	9797524	COJVMRRQFUAEBN-UHFFFAOYSA-N	435.506	1.351	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)CCn2c(=O)oc3cc(Cl)ccc32)nc2ccccc21	14854297	BTRLXZAAQHEWSS-UHFFFAOYSA-N	427.848	1.915	50	20	IDGD	
O=C(NCc1coc(-c2cccs2)n1)NNC(=O)c1csc(N2CCOCC2)n1	24895081	IPZKZYDFVGIAOY-UHFFFAOYSA-N	434.503	1.840	50	20	IDGD	
CS(=O)(=O)N1CCC(C(=O)NNC(=S)Nc2cccc(Br)c2)CC1	27011146	YLOXGSGQYHRKBM-UHFFFAOYSA-N	435.369	1.438	50	20	IDGD	
COc1ccnc(NNC(=O)c2nnn(C3CCN(C(=O)OC(C)(C)C)CC3)c2C)n1	726158943	KREKUUNXZKTIPN-UHFFFAOYSA-N	432.485	1.714	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)CSC[C@H]3CCCCO3)cc2)CC1	728214376	NCOCBQYMTGSRNU-QGZVFWFLSA-N	442.607	1.368	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3ccc([N+](=O)[O-])cc3F)cc2)CC1	728215849	KHIKEBMOKLWWHZ-UHFFFAOYSA-N	437.453	1.427	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)NCC(=O)N2CCc3ccccc32)c1	728751029	FNAVYFJWECUHNZ-UHFFFAOYSA-N	447.289	1.991	50	20	IDGD	
CN(CC(=O)NNC(=O)c1ccc(Br)cc1Cl)c1ncnc2[nH]cnc12	728870151	UFCDNGTYWRETFG-UHFFFAOYSA-N	438.673	1.666	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCCCN2CCC[C@@H](C(N)=O)C2)ccc1OC(C)C	729505516	LCLKPLLATGWBAH-MRXNPFEDSA-N	435.525	1.014	50	20	IDGD	
O=C(Cc1cc[nH]n1)NNC(=O)c1ccc(Cl)c(S(=O)(=O)NCc2ccccc2)c1	730102647	JQZNXBHRSYUNSC-UHFFFAOYSA-N	447.904	1.545	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)[C@H]1CS[C@]2(c3ccc(F)cc3)CCC(=O)N12	730778708	UCUKAPMXRGAQNT-VFNWGFHPSA-N	445.472	1.648	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)NC2CCN(CC(=O)N(C)C)CC2)c(C)n1C[C@@H]1CCCO1	731655622	QZEXNFLPMNGKQR-WLJFKGHSSA-N	441.576	1.860	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)CCNS(=O)(=O)c1ccccc1Cl	732304197	RSGGPSOHHGIENC-UHFFFAOYSA-N	431.923	1.555	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NCCCC(=O)N2CCc3ccccc32)cc1	732475832	PWZGILQAHNSKBU-UHFFFAOYSA-N	426.473	1.774	50	20	IDGD	
Cc1ccc(-n2c(NNC(=O)[C@@H]3CCS(=O)(=O)C3)nc3ccccc3c2=O)c(C)c1	733265206	LWEJUQRAIFOGKG-OAHLLOKOSA-N	426.498	1.880	50	20	IDGD	
COc1cccc2cc(C(=O)NNc3ncccc3S(=O)(=O)N3CCN(C)CC3)oc12	735117032	LVFUKUOGNHVBSH-UHFFFAOYSA-N	445.501	1.529	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCC[C@H](c3nnc4ccccn34)C2)cc1OC	738319532	WDEZIDCZQBKGFS-INIZCTEOSA-N	438.488	1.387	50	20	IDGD	
CC(=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O)c1ccc(SCC(F)F)cc1	741762964	SGZMBGIBRCOIEJ-UHFFFAOYSA-N	443.501	1.469	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)[C@@H](C)NC(=O)c2cc3c(C)nn(C)c3s2)cc1	743321687	ZSBUMYVALWJDCM-CYBMUJFWSA-N	443.529	1.850	50	20	IDGD	
O=C(CSCC(=O)Nc1cccc(Br)c1)NNc1ncnc2[nH]cnc12	743468802	INCNWZHLWCTJHQ-UHFFFAOYSA-N	436.295	1.930	50	20	IDGD	
CC(=O)N[C@H](CC(=O)NNC(=O)C(=O)Nc1ccc(C)c(C)c1)c1ccc(F)cc1F	743821718	WSSJQPZHMOKTQA-GOSISDBHSA-N	432.427	1.935	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)CN2CCN(C(=O)c3cccc(Cl)c3)CC2)cc1	744384967	FDHVOSAHSLDCHD-UHFFFAOYSA-N	425.876	1.431	50	20	IDGD	
COc1cc(/C=C\C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)cc(OC)c1O	745510190	AMPSWAITIILJAT-SREVYHEPSA-N	425.397	1.299	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](CNC(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)C1	745798034	UQCJFGCMZAVZCR-LBPRGKRZSA-N	437.453	1.892	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN1Cc1ccc(F)cc1)C1CCN(c2ncccn2)CC1	747379345	DVRVCHFJATXCGM-LJQANCHMSA-N	426.496	1.644	50	20	IDGD	
COc1ccc(C[C@@H](NC(=O)NNC(=O)C(=O)N2CCCC2)c2ccc(OC)cc2)cc1	748446249	IFFZVRPFCIKAGM-HXUWFJFHSA-N	440.500	1.940	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2ccc([C@@H](C)O)cc2)c1	749348779	VOUAEXIBGYISBZ-OAHLLOKOSA-N	448.545	1.915	50	20	IDGD	
CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)NNc1ccccc1S(C)(=O)=O	749535219	PPMVNMSGKPLKJQ-SFHVURJKSA-N	432.477	1.901	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)[C@H]2CCCN2C(=O)c2ccc3c(c2)OCO3)cc1	749719906	HCTNLRIDTTXNNI-QGZVFWFLSA-N	440.456	1.288	50	20	IDGD	
CCOC(=O)[C@@H]1Cc2cc(S(=O)(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)ccc2O1	751538839	OZNVPPPRCZCKJD-INIZCTEOSA-N	435.414	1.085	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)NC[C@H]2CCCCS2(=O)=O)N(C)c2ccccc21	752844793	YIUGSNLYQZBQOY-OAHLLOKOSA-N	430.530	1.741	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)[C@@H](CC(C)C)N2CCCCC2=O)c2ccccc2c1=O	755048262	YNEILSDOVQPHEJ-GOSISDBHSA-N	441.532	1.995	50	20	IDGD	
COc1ccc(C(=O)NNc2ccc(C(F)(F)F)nn2)cc1S(=O)(=O)NC1CC1	755197191	BFYQRIMRDOPLMX-UHFFFAOYSA-N	431.396	1.702	50	20	IDGD	
C[C@H](NC(=O)OC(C)(C)C)[C@H](C)C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	755314802	ZTEXJUYPIRDURV-ROUUACIJSA-N	447.580	1.895	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)Nc1cccc(S(=O)(=O)N2CCOCC2)c1	755354594	RFPHLNDCCCVVNO-UHFFFAOYSA-N	449.445	1.082	50	20	IDGD	
COc1ccc(C(=O)N2CCOCC2)cc1NC(=O)NNC(=O)c1cccc(N(C)C)c1	756256255	GIKSAQOFLPEJFX-UHFFFAOYSA-N	441.488	1.700	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1N1CCCS1(=O)=O	756707241	XCKHKBJZPNXURE-UHFFFAOYSA-N	446.485	1.773	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)COc2ccc(C)c(C)c2)cc1NS(C)(=O)=O	756782949	WYKWQHOODJRITE-UHFFFAOYSA-N	436.490	1.915	50	20	IDGD	
CCOC(=O)[C@H](C)NC(=O)c1ccc(NC(=O)NNC(=O)c2ccc(C)cc2O)cc1	756789976	KEAAUJGTJRGLGN-ZDUSSCGKSA-N	428.445	1.849	50	20	IDGD	
O=C(Cn1cc(NC(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)cn1)NC1CCCC1	756794266	BFYQMSGUOBXSII-UHFFFAOYSA-N	436.476	1.799	50	20	IDGD	
CCOC(=O)[C@H](C)NC(=O)c1ccc(NC(=O)NNC(=O)c2ccc(C)cc2O)cc1F	756819537	STLXMWCLBXFXKU-LBPRGKRZSA-N	446.435	1.988	50	20	IDGD	
O=C(Cc1ccc2ccccc2c1)NNC(=O)Nc1cnn(CC(=O)N2CCOCC2)c1	756836197	UEBYLDCDJXKAKE-UHFFFAOYSA-N	436.472	1.291	50	20	IDGD	
C[C@H]1C[C@H](C)CC2(C1)NC(=O)N(CC(=O)NNC(=O)c1cc(Br)c[nH]1)C2=O	756871035	NVNADIGXZXFKKM-UWVGGRQHSA-N	440.298	1.285	50	20	IDGD	
CN1C(=O)CC[C@@H](C(=O)NNc2ccc(C(N)=O)nn2)[C@@H]1c1ccc(C(F)(F)F)cc1	757404274	OARYPLAWKHQACM-WBMJQRKESA-N	436.394	1.647	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)Nc1ccc2nc(N3CCOCC3)oc2c1	757776327	CUFWFDNBRSERDK-UHFFFAOYSA-N	439.428	1.902	50	20	IDGD	
COC(=O)c1cnc(C(=O)NNc2ccc(S(=O)(=O)Nc3nccs3)cc2)cn1	758309433	GNHLOIKYANNWLF-UHFFFAOYSA-N	434.459	1.277	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)C(=O)Nc1ccnn1Cc1ccc(F)cc1	760291268	MJEMWRDDSSBOIJ-UHFFFAOYSA-N	425.420	1.373	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)C2=Cc3cc(F)ccc3OC2)cc1	761197338	RYVGWNUOBHREBU-UHFFFAOYSA-N	433.461	1.378	50	20	IDGD	
COc1ccc(-c2nnc(S)n2CC(=O)NNc2nccc(N3CCOCC3)n2)cc1	762869323	VYDKDXWITGQAGF-UHFFFAOYSA-N	442.505	1.012	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(N3CCCC3=O)c(F)c2)cc1OC	763551658	ZBTJTHCFVADTGF-UHFFFAOYSA-N	444.419	1.369	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1nc(-c2ccccc2)cs1	763656571	CVRYLUZGCUAJDC-UHFFFAOYSA-N	426.454	1.984	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2cccc(N3CCCCC3=O)c2)c1	763665100	DULZIEFSFAFNBF-UHFFFAOYSA-N	438.484	1.985	50	20	IDGD	
O=C(COc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1cnn(Cc2ccccn2)c1	763685981	HJMFUJBAUVDOHG-UHFFFAOYSA-N	428.836	1.145	50	20	IDGD	
O=C(CN1CCCc2ccccc21)NNC(=O)C(=O)Nc1ccc(Br)cc1	763728437	QHGJTEJZRSFPNS-UHFFFAOYSA-N	431.290	1.988	50	20	IDGD	
NC(=O)CCOc1ccc(NC(=O)C(=O)NNC(=O)CC23CC4CC(CC(C4)C2)C3)cc1	763732060	CVEZHVWRWZIYOB-UHFFFAOYSA-N	442.516	1.633	50	20	IDGD	
O=C(CSc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1ccn(-c2ncccc2F)n1	763736970	NKCRYAIAYNTKRM-UHFFFAOYSA-N	448.867	1.938	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2nnc(O)c3ccccc23)n([C@H]2C[C@H]3CC[C@H]2C3)n1	763790562	KZLYIAACVXQALY-XEZPLFJOSA-N	449.471	1.601	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2nc(-c3ccccc3)n(-c3ccccc3)n2)n(C)n1	763804643	NYJADVAONPOIRC-UHFFFAOYSA-N	444.455	1.376	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(N3CCOC3=O)c2C)cc1	763810058	YGZQGBYAJSRKBX-UHFFFAOYSA-N	426.429	1.425	50	20	IDGD	
COC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)cc1F	763858564	VCSRYVIMPXROOE-SNVBAGLBSA-N	436.371	1.697	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cnn(C[C@@H]3CCCO3)c2)cc1	763861391	PAMONMSAZOEXJI-KDOFPFPSSA-N	445.476	1.014	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccccc2O[C@H](C)C#N)cc1	763876533	GRFWFMSXFQLCAX-HIFRSBDPSA-N	438.440	1.733	50	20	IDGD	
COC(=O)c1cc(OC)ccc1NC(=O)C(=O)NNC(=O)CSc1ccc(C)cc1	763896505	OKDOVXODVMCENZ-UHFFFAOYSA-N	431.470	1.668	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)CSc2ccc(C)cc2)cc(OC)c1OC	763896613	PCFHGYWKBBDEGU-UHFFFAOYSA-N	433.486	1.899	50	20	IDGD	
COC(=O)COc1cccc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CC[C@@H](C)C3)c1	763942852	PDGDZRAOXZMVHA-GFCCVEGCSA-N	445.497	1.824	50	20	IDGD	
CCCC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)c1C	764004158	LXUWHTYOEHSORY-UHFFFAOYSA-N	440.456	1.905	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1ccc(OC2CCCC2)nc1	764004669	QEBLMOFLXPMFTK-UHFFFAOYSA-N	426.429	1.574	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1ccc(N2CCOC[C@@H]2C)cc1	764012469	RTCCVHWHZKKTPK-ZDUSSCGKSA-N	446.891	1.973	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)nc1)C(=O)Nc1ccc(C(=O)NCC(F)(F)F)cc1	764099869	UMOGHHRRPUSOEF-UHFFFAOYSA-N	443.769	1.427	50	20	IDGD	
CO[C@H]1Cc2ccc(NC(=O)C(=O)NNC(=O)c3cc(-c4ccc(C)cc4)[nH]n3)cc2C1	764111051	MUAKQKMHUBBFHT-SFHVURJKSA-N	433.468	1.898	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(OCc3ccccc3)nc2)c1O	764130947	LLCOPKMJXDVNJC-UHFFFAOYSA-N	436.424	1.775	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(=O)n(Cc3ccccc3Cl)c2)cc1	764181710	FMCXVVHKOWFSNI-UHFFFAOYSA-N	449.854	1.821	50	20	IDGD	
CCCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2scnc2C)cc1	764246034	CMYOFIMUMVKTDF-UHFFFAOYSA-N	425.492	1.003	50	20	IDGD	
COc1c(Br)cc(Cl)cc1NC(=O)C(=O)NNC(=O)Cc1ccccn1	764270584	PPUHXNSMBNYYFK-UHFFFAOYSA-N	441.669	1.835	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)ccc1O)C(=O)Nc1cnn(-c2ccccc2)n1	764281008	VRMMKSSVTMLJSA-UHFFFAOYSA-N	445.233	1.135	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)COc2ccccc2O)cccc1OCC(F)(F)F	764281092	XLEHAKAZQNOYPN-UHFFFAOYSA-N	441.362	1.807	50	20	IDGD	
CCNC(=O)COc1cccc(NC(=O)C(=O)NNC(=O)C(C)(C)c2ccccc2)c1	764309750	VCMLZPPNMLCEHU-UHFFFAOYSA-N	426.473	1.265	50	20	IDGD	
COC(=O)[C@@H](C)Cc1ccc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)cc1	764380326	VYVZWOHXDCVDJY-ZDUSSCGKSA-N	449.410	1.796	50	20	IDGD	
Cc1ccc(C(=O)NC2CC2)cc1NC(=O)C(=O)NNC(=O)CSc1ccccc1O	764402367	ZQBHHLYXWLWMTR-UHFFFAOYSA-N	442.497	1.471	50	20	IDGD	
Cc1ccc([C@H](C)[C@@H](O)C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)cc1	765198233	KZNFHTLSJLQZLA-LAUBAEHRSA-N	446.573	1.539	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)c2cnn(-c3ccccc3)c2)n[nH]1	765598634	CHZZKZLMEICMPM-UHFFFAOYSA-N	430.424	1.915	50	20	IDGD	
Cc1ccc(Br)c(S(=O)(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c1	765642575	MIGKYVOHUFLVHB-UHFFFAOYSA-N	447.332	1.784	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@H](C)NC(=O)c3cccs3)CC2)cc1	765749733	RZEPJCUANUBDOG-KRWDZBQOSA-N	443.573	1.140	50	20	IDGD	
C[C@](O)(Cc1ccccc1)C(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	766669104	MUVTVLPDOKQNIT-QHCPKHFHSA-N	444.963	1.599	50	20	IDGD	
N#Cc1ccc(NCC(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)cc1	766669665	QSTOMRKHBWZSMX-UHFFFAOYSA-N	440.935	1.589	50	20	IDGD	
CC(C)(C)S(=O)(=O)CC(=O)NNc1ccc(S(=O)(=O)Nc2nccs2)cc1	768420257	BGKNPLJUHCOKPF-UHFFFAOYSA-N	432.549	1.600	50	20	IDGD	
CCOC(=O)c1[nH]c(C)c(C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c1C	769125980	GCPRHHBVJBPIGT-UHFFFAOYSA-N	432.389	1.334	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)N1CCN(C(=O)c2cccn2C)CC1	770659766	VJOANVHHRBGSOG-CQSZACIVSA-N	433.896	1.645	50	20	IDGD	
CCNc1ncc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(CC)CC)c2)s1	770956428	UTARQCROFMVAEY-UHFFFAOYSA-N	425.536	1.680	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)Cc3csc(NC(=O)c4ccccc4F)n3)nc21	770992935	YCSBDGCETVTTOE-UHFFFAOYSA-N	442.436	1.603	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)cc1C	771606682	INYUMEUZMJULNW-UHFFFAOYSA-N	425.894	1.673	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N=c2cc[nH]c(C)c2Cl)cc1	771768440	HXFBNNIHYCLJFP-UHFFFAOYSA-N	425.898	1.247	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2cccc(-c3ncn(C)n3)c2)c2ccccc2c1=O	771794616	VHAAIMSREWAYQK-UHFFFAOYSA-N	432.444	1.678	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)O[C@@H](C)C(=O)NNC(=O)CC(C)C)ccc1F	771876907	ZVYJUOOSQWGSPB-ZDUSSCGKSA-N	445.513	1.595	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)[C@@]1(F)CCN(C(=O)OCc2ccccc2)C1	772241650	RMGLBNQWLDCLKP-YCRPNKLZSA-N	437.468	1.862	50	20	IDGD	
O=C(NNC(=O)N1CC[C@H]2[C@H](CCCN2C2CC2)C1)c1csc(N2CCOCC2)n1	772973573	RLNYSFKELALDFM-PBHICJAKSA-N	434.566	1.283	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2)cc1-n1nnnc1C1CC1	773656520	MZHXHVSHCNBHLN-UHFFFAOYSA-N	438.404	1.538	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)ncc1Br	773686082	VWEFXCIZPKXRAT-UHFFFAOYSA-N	438.194	1.166	50	20	IDGD	
O=C(NNc1c(Cl)cccc1Cl)C(=O)Nc1cnn(CCN2CCOCC2)c1	773692199	ZHXYGEOIYXOURN-UHFFFAOYSA-N	427.292	1.604	50	20	IDGD	
O=C(NNC(=O)c1ccccc1O)C(=O)Nc1cc(Cl)ccc1OC[C@H]1CCOC1	778706202	OJTBEVIJDVGTHB-LBPRGKRZSA-N	433.848	1.861	50	20	IDGD	
CCOC(=O)Cn1cccc(NC(=O)C(=O)NNc2ccccc2OC(F)(F)F)c1=O	778798759	ZUSQOMSYBRFFGI-UHFFFAOYSA-N	442.350	1.392	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)NCc2ccc(C#N)cn2)c2ccccc2c1=O	780658962	TZPYAXPPTDXHDC-UHFFFAOYSA-N	433.472	1.998	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)[C@@H]1C[C@@]12CCN(C(=O)OC(C)(C)C)C2	780715526	JUSXCCHOQJUHSM-RNODOKPDSA-N	441.529	1.489	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)NCC2CCN(S(=O)(=O)C(F)(F)F)CC2)c1	780827567	IKEGPNIKTDDCHV-UHFFFAOYSA-N	438.428	1.661	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2cccc(C(F)F)c2)nc1	783263909	MOQSPVIMAUAUPE-UHFFFAOYSA-N	427.433	1.788	50	20	IDGD	
Cc1ccccc1NC(=O)NNC(=O)C(=O)Nc1ccccc1N1CCC(C(N)=O)CC1	783415998	NVBOTPKLSNWQGO-UHFFFAOYSA-N	438.488	1.488	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)Cc2cc(F)cc3c2OCOC3)c2ccccc2c1=O	783660790	NOGMQATWJKYNAK-UHFFFAOYSA-N	440.431	1.816	50	20	IDGD	
O=C(NNc1ccccc1Cl)C(=O)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1	784771252	ZDYMZBSFQCBIDI-UHFFFAOYSA-N	438.893	1.443	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1cccc2c1OCCO2	784834009	QHPMLLKUJMRIGD-UHFFFAOYSA-N	448.501	1.616	50	20	IDGD	
Cc1ccc(C)c(-n2ncc(NC(=O)C(=O)NNC(=O)Cc3cn4ccccc4n3)c2C)c1	785061635	ZPYXQQLMBZOWCN-UHFFFAOYSA-N	445.483	1.774	50	20	IDGD	
CN(NC(=O)Nc1ccc(-n2cccn2)nc1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	785837368	NUVWLQPVXYXPJT-UHFFFAOYSA-N	444.496	1.908	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCCc1ccc(F)c(F)c1	786820396	IHUKRQWERFNCNI-UHFFFAOYSA-N	425.461	1.753	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NC[C@@H](c1ccnn1C)C(C)C	788092772	QSLZPWXUOYHQPQ-CQSZACIVSA-N	435.554	1.405	50	20	IDGD	
NS(=O)(=O)c1ccccc1NNC(=O)COc1ccc(I)cc1	788227342	CCTPVSZOXBEWMU-UHFFFAOYSA-N	447.254	1.461	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccc(OC)cc2)c1)[C@H](C)O	790070492	UMADUDIMLSDJTO-UGSOOPFHSA-N	435.502	1.664	50	20	IDGD	
Cc1cccnc1NNC(=O)C(=O)Nc1ccc(S(=O)(=O)N2C[C@@H](C)O[C@H](C)C2)cc1	792375315	IEIJAUHXBVXOJP-HUUCEWRRSA-N	447.517	1.270	50	20	IDGD	
O=C(COCc1ccccc1)NNS(=O)(=O)c1ccccc1S(=O)(=O)C(F)F	794588926	BZDOHFUULGDBGZ-UHFFFAOYSA-N	434.442	1.209	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2c(C)nn(Cc3ccccc3)c2N)cc(OC)c1OC	794756265	DZNXEVPKKDZALX-UHFFFAOYSA-N	439.472	1.923	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)c2cccc(C#N)c2)(n2cccn2)CC1	796139431	NAPDTXGFRORKHC-UHFFFAOYSA-N	438.488	1.942	50	20	IDGD	
CC[C@H](C)n1ncc(NC(=O)C(=O)NNC(=O)CNC(=O)OCc2ccccc2)c1C	797368788	GYFAPECDBWQVRC-ZDUSSCGKSA-N	430.465	1.175	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)C(=O)Nc2ccnc(OCc3ccccc3)c2)c1	800624696	HDUGQFQBANEQQK-UHFFFAOYSA-N	448.439	1.414	50	20	IDGD	
Cc1ccc(C2=NO[C@@H](CNC(=O)NNC(=O)Nc3ccc(S(C)(=O)=O)cc3)C2)cc1	800750035	IOZRXKNXRKVKLV-MRXNPFEDSA-N	445.501	1.927	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2cc(S(=O)(=O)N3CCC[C@@H](C)C3)cn2C)cc1	802064887	FGCOQAXTPUIERC-CQSZACIVSA-N	449.533	1.921	50	20	IDGD	
COc1cccc(C(=O)NCC(=O)OCC(=O)NNC(=O)c2cc(Cl)ccc2OC)c1	802167507	YRPZUQVOUZZFKB-UHFFFAOYSA-N	449.847	1.091	50	20	IDGD	
O=C(COc1cccc(I)c1)NNc1ccc(-n2ccnc2)nn1	804957357	UPOCJMTYMJWZFY-UHFFFAOYSA-N	436.213	1.789	50	20	IDGD	
CCc1nnc(NC(=O)[C@@H](C)[C@@H](C)NC(=O)NNC(=O)Cc2ccccc2OC)s1	805881116	VKPVOEAFTVRNSM-NWDGAFQWSA-N	434.522	1.645	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)c2cnc(C3CC3)nc2N)c2ccccc2c1=O	806339983	MGOZUMBKDRXVTG-UHFFFAOYSA-N	435.488	1.911	50	20	IDGD	
CNS(=O)(=O)c1cc(NC(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)ccc1F	806544591	JWUWLOAQYBAYKT-SNVBAGLBSA-N	428.417	1.493	50	20	IDGD	
O=C1COc2c(cc(Cl)cc2NC(=O)C(=O)NNC(=O)c2ccc3ccccc3n2)N1	806972441	WVWGOSBIIQCNGB-UHFFFAOYSA-N	439.815	1.619	50	20	IDGD	
COC(=O)c1cc(C)c(NC(=O)C(=O)NNC(=O)COc2ccc(OC)cc2)c(Cl)c1	806973306	JXXUUVHRYUUFBD-UHFFFAOYSA-N	449.847	1.609	50	20	IDGD	
CCOc1ccc(CCNC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1OCC	806987679	QNBIEUKPPHHVEA-UHFFFAOYSA-N	439.476	1.646	50	20	IDGD	
CCOC(=O)[C@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNc2ncccc2F)cc1F	807300150	BDPARTGBPRZWNG-JTQLQIEISA-N	435.387	1.123	50	20	IDGD	
CNS(=O)(=O)c1cc(NC(=O)/C(C#N)=C\c2cc(C)n(CCOC)c2C)ccc1O	807386029	XQUNDJXWVJKVMO-YBEGLDIGSA-N	432.502	1.911	50	20	IDGD	
COC(=O)c1c(F)ccc(NC(=O)C(=O)NNC(=O)CSc2ccccc2OC)c1C	810387438	WKDDNIQLUBDSEG-UHFFFAOYSA-N	449.460	1.808	50	20	IDGD	
COc1ccc2c(c1OC)OCC2=NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	814746634	KSCUAQIQKQCNTH-UHFFFAOYSA-N	425.850	1.531	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)C(=O)Nc2nnn(Cc3ccccc3F)c2C)c1	815558920	RQYVNGOWRXICJM-UHFFFAOYSA-N	426.408	1.642	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccc(Br)c(C3CC3)n2)n1	815566784	FRCBKBOOIPXXCE-UHFFFAOYSA-N	435.282	1.321	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)c1cc(C2CC2)nc2c1c(O)nn2C	817052773	OXKLMOQBEGMXTJ-UHFFFAOYSA-N	430.490	1.559	50	20	IDGD	
Cc1nc2cc(O)nn2c(C)c1CCC(=O)NNc1ccccc1S(=O)(=O)N(C)C	817054163	WJYUKGBFWOAUMZ-UHFFFAOYSA-N	432.506	1.378	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)Cn2c(S)nnc2-c2cccc(C)c2)c1	825801110	KFUHCPUVFCDSSB-UHFFFAOYSA-N	426.502	1.810	50	20	IDGD	
CCOc1ccc(NC(=S)NNC(=O)CNS(=O)(=O)c2ccc(C#N)cc2)cc1	913443973	OWXFTTNXUBIRQA-UHFFFAOYSA-N	433.515	1.253	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NC[C@H](c2cccs2)N2CCN(C)CC2)cc1	915901002	BIVQKTHTCDDPIB-GOSISDBHSA-N	431.562	1.754	50	20	IDGD	
CCN(C(=O)CCC(=O)C(C#N)=C1N(C)c2ccccc2N1C)[C@H]1CCS(=O)(=O)C1	919706614	ORMBOHZGQAYLAF-HNNXBMFYSA-N	430.530	1.693	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)[C@@H]2CCCN(CC(F)(F)F)C2)c2ccccc2c1=O	919806561	FSDUSKLPPGXKIW-CYBMUJFWSA-N	439.438	1.842	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CC=CC[C@@H]1c1nc2ccccc2s1)N[C@@H]1CCS(=O)(=O)C1	919889264	KHYREDAWZCGXHO-MCIONIFRSA-N	434.543	1.864	50	20	IDGD	
CCNC(=O)NNC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(Br)cc2)C1	920858678	YEWUHRBGLUCEHT-LLVKDONJSA-N	433.328	1.200	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)N[C@@H]2CC(=O)N(c3ccccc3)C2)cc1	921125704	VGVHHMFBMGWHBL-HZPDHXFCSA-N	426.473	1.989	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H]2CCCCN2Cc2cccnc2)c1	1116020683	SLYXYSPNKSUFOJ-LJQANCHMSA-N	445.545	1.148	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)NC1CCN(c2nccs2)CC1	1116911016	LPHATKJEUCIQNR-UHFFFAOYSA-N	430.538	1.149	50	20	IDGD	
CNC(=O)COc1ccc(C(=O)NNC(=O)c2ccc(Br)cc2)cc1OC	1317947115	DFQOFAHPLNGLIC-UHFFFAOYSA-N	436.262	1.657	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCc2cccc(Cl)c2F)cc1	1318901232	HWGNHWCABRCFGW-UHFFFAOYSA-N	442.900	1.939	50	20	IDGD	
COc1cc(Br)cc(S(=O)(=O)NNC(=O)c2n[nH]c3c2CCCC3)c1	1337862129	UWIPUGRSIPPWLH-UHFFFAOYSA-N	429.296	1.683	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnc4ncccn34)C2)C1	1777930170	NCRVIICSPKVKQD-FZKQIMNGSA-N	436.310	1.204	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4ncnn4c3)C2)C1	1778742032	NDVXDPWYQJPFRN-QZTJIDSGSA-N	426.304	1.409	50	20	IDGD	
O=C(c1cc(Cl)c2nncn2c1)N1CC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1778948578	WCUYBMPZIFPQQN-INIZCTEOSA-N	432.695	1.630	50	20	IDGD	
COc1nc(C)ccc1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1779741139	PILXZXVEPKQNMU-DYVFJYSZSA-N	430.274	1.533	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(CO)c(F)c3)CCO2)C1	1781234787	ZCLIGTUKUAQDGG-OALUTQOASA-N	433.307	1.998	50	20	IDGD	
Cc1cccn2ncc(C(=O)N3CCO[C@]4(CCN(C(=O)[C@@H](F)Br)C4)C3)c12	1781332284	FUUPLRXHNYZBLI-QAPCUYQASA-N	439.285	1.777	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)c(O)c1OC	1781829559	IUZPIOHXRMVQPW-SFHVURJKSA-N	433.288	1.657	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)N1CC[C@@]2(CN(C(=O)[C@H](C)CBr)CCO2)C1	1782698059	FUMTXLPIMZROMR-XNJGSVPQSA-N	435.315	1.409	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@]2(C)CC=CCC2)C1	1782726347	MCWZYHCNBPILPV-SXSPYAJSSA-N	434.581	1.620	50	20	IDGD	
O=C1CC(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](Br)Cc4ccccc4)C3)C2)C1	1783021729	GJQFDIYWAPZMHE-WIYYLYMNSA-N	449.345	1.802	50	20	IDGD	
O=C(CCN1CCCC1)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Br)C2	1783319347	OEJNDZZYJCXXMI-UWWQBHOKSA-N	434.350	1.677	50	20	IDGD	
CO[C@H](C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](C)Br)C2)C1)c1ccccc1	1783532880	ONBHTGVEPRGRHQ-QOKNQOGYSA-N	425.323	1.987	50	20	IDGD	
COCc1oncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]2C1	1783965786	ROOGSCRGUAMOTI-DHMWGJHJSA-N	444.326	1.445	50	20	IDGD	
Cc1nc(N)sc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]2C1	1783968175	QZERIINKWMZMJN-IXOXFDKPSA-N	445.383	1.658	50	20	IDGD	
CC#C[C@@H](CC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2)c1ccc(O)cc1	1784015473	ZAQSCPGNKILMNE-JLMWRMLUSA-N	434.920	1.319	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CCc4cccc(Cl)c43)C[C@@H]21)[C@H](O)CCl	1784094763	RBJVKSTYLCLTEI-FZMWSMFESA-N	441.355	1.949	50	20	IDGD	
C[C@H](Oc1ccccn1)C(=O)N1CC[C@@]2(CN(C(=O)CCBr)CCO2)C1	1784486657	PONLEUSWYLJODM-KBXCAEBGSA-N	426.311	1.464	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CC(=O)OC(C)(C)C)[C@H]2C1	1784777331	JAGYFEZIFPQUSS-QPSCCSFWSA-N	447.370	1.729	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cncn3-c3ccncc3)[C@H]2C1	1785753444	YVYDBJWPECTPPH-XPYUAMARSA-N	431.924	1.878	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)COc3ccc(F)cc3)[C@H]2C1	1786491539	CKKPDIYWIAYKFI-OQUILHJVSA-N	443.313	1.968	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCSC(=N)N)[C@H]2C1	1786849322	CBRMAJCSMPOGFK-CYDGBPFRSA-N	435.388	1.156	50	20	IDGD	
CCC(=O)N[C@H](C)C(=O)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1	1788140360	NYFBSFLBMKOLQH-OAHLLOKOSA-N	437.305	1.029	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)c1ccn2cncc2c1	1788408061	JPMJGEVVVPQZPJ-TUUVXOQKSA-N	439.285	1.618	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnn4c(C)cc(C)nc34)C[C@@H]21	1789860019	RPTMIFVWNHABGK-DKIMLUQUSA-N	433.940	1.957	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)c1cc(Cl)c(F)cc1F	1790008633	VWAWMPQPSGRJQW-NAMSACQYSA-N	437.270	1.811	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)c1n[nH]c2c(Cl)cccc12	1790340142	HSDIERJTVQOWOD-FATJJJSSSA-N	441.315	1.409	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3nc(C)sc3C)C[C@@H]21	1791252576	OFOZRHUSZMIIFC-MPTYRVRUSA-N	429.970	1.536	50	20	IDGD	
COc1ccccc1OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]2C1	1791292241	KCVOFSVYAYDNCS-XEZPLFJOSA-N	431.316	1.857	50	20	IDGD	
COc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](O)CCl)C[C@@H]32)cc1Cl	1792009790	LPFKKQGVLKGZMT-LBEHMCEESA-N	431.316	1.542	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CSc1ncccn1)C2	1792868191	TVNVHZHWHKBJGN-XPCVCDNBSA-N	443.367	1.189	50	20	IDGD	
CCc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)CBr)n(C)n1	1792871369	WTGFWIVZXWIZRI-NFFDBFGFSA-N	427.343	1.217	50	20	IDGD	
CCOc1cccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)c1O	1796193022	IRUILPJRRPWNCU-BCDXTJNWSA-N	438.289	1.036	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(C)cs1)C2	1796439626	SPBQCVYKSJKIOV-SNOXVSQISA-N	443.529	1.394	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(F)c1)C2	1796441685	PXBRHYDBVRDITD-WVNFENISSA-N	441.463	1.163	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CCN(C(=O)OC(C)(C)C)C1	1797220335	MCVDGKMMHOVKLX-NQNKBUKLSA-N	443.972	1.850	50	20	IDGD	
COc1cc(F)ccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnccc1C(=O)NN	1798443548	GXKHLAPRALWDHR-QDMKHBRRSA-N	441.463	1.398	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2)c1ccc([N+](=O)[O-])c2c1OCO2	1798625948	DMTATJNLBBFAFB-KTBFAXTASA-N	429.788	1.061	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CCc3nc[nH]c3C1)C2	1799278330	ATBSVVZMMHQJOJ-XARJKEAYSA-N	429.348	1.341	50	20	IDGD	
CN(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1(F)CCC1)C2)NC(=O)NCc1ccccc1	1799869096	CTFGMJSHBNUOQR-REPLKXPHSA-N	445.539	1.863	50	20	IDGD	
C#CCO[C@@H](C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C#N)=C/c1ccc(F)cc1F	1800332438	LSSRYMPJXUMREL-XVOKVJDBSA-N	443.450	1.500	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(OC)c(OC)cc1C)C2	1800977451	PGVBXUJXIGEZPX-MVWRLGRASA-N	440.924	1.469	50	20	IDGD	
Cc1nc2ccncc2cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCC(=O)NN(C)C	1802337918	XEUJZAHNRKUOLX-BCDXTJNWSA-N	438.532	1.563	50	20	IDGD	
CN1N=C(C(=O)NC[C@@H]2CCN(C(=O)C(Cl)Cl)[C@H]2c2cccnc2)CCC1=O	1804124750	VWRPPPTXEXMHLP-WFASDCNBSA-N	426.304	1.499	50	20	IDGD	
Cc1cc[nH]c1C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1805012664	QJRJKKPUXYAICU-UWJYYQICSA-N	426.521	1.411	50	20	IDGD	
O=C(Cc1ccccc1)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1806515827	PVCZULXKXYNEFT-ZJSXRUAMSA-N	443.312	1.324	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H](CNC(=O)CN2CCOCC2)[C@H]1c1cccnc1	1806909887	ZMVJVPBIJZRKBS-POAQFYNOSA-N	443.375	1.656	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)cn1	1807361235	FHXKRDUETYCYGD-SIKLNZKXSA-N	444.300	1.098	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)CC2CCCC2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807366218	XSEHLZUMQWNTCP-OFNKIYASSA-N	435.333	1.661	50	20	IDGD	
CC1=CC[C@H](C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)CC1	1807376760	WFKIYPBTKRIJBI-QTGUNEKASA-N	447.344	1.827	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CN2CCOC2=O)[C@H]1c1cccnc1)[C@@H](F)Br	1808649534	SYQHFQTVHNFDTB-AEGPPILISA-N	443.273	1.230	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2nc3ncccn3n2)[C@@H]1c1cccnc1	1809236481	JKKHAYWPCWGLCQ-PMPSAXMXSA-N	443.895	1.093	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)CCc2nc(N)n[nH]2)[C@@H]1c1cccnc1	1810150700	YPWXWODNHATFKW-MPGHIAIKSA-N	433.944	1.828	50	20	IDGD	
CC(=O)OC[C@H](OC(C)=O)C(=O)NC[C@@H]1CCN(C(=O)[C@H](F)Cl)[C@@H]1c1cccnc1	1810339217	WKYOEBKXKJPPJJ-NXOAAHMSSA-N	443.859	1.117	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)c2ccc[nH]2)[C@H]1c1cccnc1	1810619488	KOZNJQQGJUQQKP-TYXIVBLQSA-N	447.499	1.863	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)C2(F)CC2)[C@H]1c1cccnc1	1812457016	ORJSXEIJJOKBLS-AENKRZKSSA-N	440.479	1.724	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)[C@H]1CCC(F)(F)C1	1814386675	FEQTZLBZGGHLLN-YOEHRIQHSA-N	446.263	1.831	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)CN3CCCC3=O)sc2C1	1814601220	GJCSABQCFGTNOO-ZJUUUORDSA-N	429.340	1.461	50	20	IDGD	
C=CCC(CC=C)C(=O)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1	1815350017	DQICYUWWQKQLLX-KRWDZBQOSA-N	439.346	1.817	50	20	IDGD	
CO[C@@H](C)C(=O)N[C@@H]1CCc2nc(NC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)sc2C1	1817283021	QFEGUCPQFTWZED-ISZNBHMKSA-N	432.506	1.224	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)C(Cl)Cl)[nH]n1)c1cc(=O)n2[nH]cnc2n1	1817468950	QRWNNRFKZGPUAH-SNVBAGLBSA-N	439.263	1.250	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](F)Br)[nH]n1	1818124954	WQJWAZHLHGDGCC-LJWDBELGSA-N	432.294	1.959	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@H](O)CCl)CC2)c1ccc2ncncc2c1	1819183528	ASXLPPZXXJELSE-IUODEOHRSA-N	431.905	1.912	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](O)NC(=O)OCC)sc2C1	1819458120	IBOFLJSTFKPTIN-HFBDOXOYSA-N	432.930	1.527	50	20	IDGD	
CC(C)[C@@H](S)C(=O)N[C@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1	1819793154	LKBALAQXKBFEGS-ZUZCIYMTSA-N	448.574	1.322	50	20	IDGD	
CC(C)O[C@H](C)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCC(=O)NN(C)C)CC2	1820015242	FXMSKGQVTJQRDU-OLZOCXBDSA-N	425.555	1.242	50	20	IDGD	
C[C@H](Cn1cncn1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](F)Br)CC2	1820072923	VPWXYFGYGTVKCC-VDDIYKPWSA-N	445.318	1.673	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@H](F)Br)[nH]n1)c1cc(CO)on1	1820350450	JNKDDDPVJZLFLH-AAEUAGOBSA-N	430.234	1.886	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3c[nH]c(=O)cn3)sc2C1	1821471936	BOWHGEQIEDXEIH-BCTVWOGZSA-N	430.317	1.689	50	20	IDGD	
CCNC(=S)NCC(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](C)Br)[nH]n1	1821644021	FQWKOHHIPVSCRP-ZYHUDNBSSA-N	445.387	1.669	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CN(CCO)CCO)n[nH]1	1822022405	DDZJPDCIHWRLCF-HOCLYGCPSA-N	429.949	1.096	50	20	IDGD	
O=C(Cn1nnc2ccccc21)N1CCC([C@H]2CCCCN2C(=O)[C@H](O)CCl)CC1	1824177838	ADEJCRPUTYAPEB-IEBWSBKVSA-N	433.940	1.651	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCN1CCOCC1)CC2	1825999989	ZIWDIRFSVDBABI-STQMWFEESA-N	430.958	1.031	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)CCN2CCOCC2)CC1	1826749094	FWHPXEFRTDNUBA-RTBURBONSA-N	429.989	1.582	50	20	IDGD	
CC[C@H](C)[C@H](N)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1	1826842865	LNWLXUYPQAJPKY-BEVDRBHNSA-N	444.580	1.292	50	20	IDGD	
O=C(c1ccc(O)cn1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827051394	WSOCMXDHACXDRK-NRFANRHFSA-N	437.305	1.014	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3nsnc3NC)CCO2)C1	1829748667	CYWXGIQXQBAHEW-SJKOYZFVSA-N	431.946	1.057	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(F)ccc3C)CCO2)C1	1830079494	LXCVBLALSUQLON-YLJYHZDGSA-N	428.888	1.458	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)Cc2ccncc2)CC1	1830172939	FAIGQIUMQVRFBF-QFIPXVFZSA-N	435.333	1.237	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3[C@H]4C=CS[C@@H]43)C2)C1	1830544200	QHZYFYSGOGJODQ-ZURLZEQWSA-N	445.379	1.349	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3c(F)c(C)nn3C)C2)C1	1831643841	IGINSEZQVYKTRV-AUUYWEPGSA-N	430.908	1.345	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4ccccn4n3)C2)C1	1831647447	VBJSDVGEEYFZTH-UWJYYQICSA-N	434.924	1.812	50	20	IDGD	
CC(C)n1cnc(C(=O)N2CCC([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)n1	1831873005	CNKVAINIUVDTGH-GOSISDBHSA-N	447.584	1.465	50	20	IDGD	
CSCC[C@@H](O)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1	1831874559	KFSSBMNZGISFDU-ZWKOTPCHSA-N	442.626	1.093	50	20	IDGD	
O=C(Cc1ccc2ncccc2c1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1832031221	JVMTVAQZSXGSPG-CTNGQTDRSA-N	435.883	1.768	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3cccc(OC)n3)CCO2)C1	1832823779	BZVHCMOPRIWAII-UTKZUKDTSA-N	439.940	1.497	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)CN3CCSCC3)CC2)CC1	1833061572	WLSRDYGKIRKQHN-GOSISDBHSA-N	431.046	1.624	50	20	IDGD	
C=CCNC(=O)/C=C\C(=O)N1CCC(N2CCC(NC(=O)C(C)(C)CCl)CC2)CC1	1833213926	KQBUANIERCCMPV-WAYWQWQTSA-N	439.000	1.681	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cc(C(F)F)no3)CC2)CC1)[C@H](O)CCl	1833310890	XRUDYSWVFZLDAJ-CQSZACIVSA-N	434.871	1.397	50	20	IDGD	
CN1CCCC[C@H]1C(=O)NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1	1833320256	XGQZXJKTCFMBGH-SFHVURJKSA-N	443.430	1.827	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccccn3)CCO2)C1	1833989889	VBBYZJXPEPXHMU-RDTXWAMCSA-N	426.311	1.325	50	20	IDGD	
O=C(CCBr)NC1CCN(C2CCN(C(=O)c3cc(=O)cco3)CC2)CC1	1834421184	OGLCMTZLZHAIDJ-UHFFFAOYSA-N	440.338	1.610	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3nc4ccc(F)cn4n3)CC2)CC1)[C@H](F)Cl	1835081047	DWZFIYNTXZAYAW-INIZCTEOSA-N	440.882	1.588	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)NC1CCN(C2CCN(C(=O)[C@@](C)(Cl)CCl)CC2)CC1	1835833105	VJGYVYXSTXHACF-VLIAUNLRSA-N	447.407	1.485	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC1CCN(C2CCN(C(=O)Cc3ncccn3)CC2)CC1	1835835384	XTPARDVLFLDVIM-UHFFFAOYSA-N	433.629	1.442	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)Cn3ccncc3=O)CC2)CC1	1836921929	CQXJLHSLDMUBBF-GOSISDBHSA-N	438.956	1.649	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccncc3Cl)CCO2)C1	1837890711	GKQWFCRWBVEUFW-MAUKXSAKSA-N	432.304	1.059	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3c(C)nc4sccn34)C2)C1	1839146222	WUMZKROSVYGIPH-IFXJQAMLSA-N	440.953	1.792	50	20	IDGD	
O=C(c1ccc(O)cc1F)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1839316984	CXPXTFCSEOBMAA-PBHICJAKSA-N	449.248	1.292	50	20	IDGD	
CCN(CC)C[C@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1	1839678456	XZVHIIYJMLVCOT-RXVVDRJESA-N	443.661	1.272	50	20	IDGD	
CCc1ncccc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2	1840031553	UETWXCIZSYJTGU-AUUYWEPGSA-N	440.338	1.497	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4ccccc4n3C)C2)C1	1840152747	RVIIRPWNNAJSIU-VGOFRKELSA-N	449.935	1.502	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3onc4ccccc34)C2)C1	1840154765	FSPGQTFLWOFWKR-QRWLVFNGSA-N	437.880	1.152	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(C#N)ccc3F)C2)C1	1840155394	ZWJWIKWEVDXIJO-UZLBHIALSA-N	439.871	1.021	50	20	IDGD	
O=C([C@H](F)Cl)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)c1ccccc1Cl)CCO2	1840317216	OLAZHBFVOLASPP-RVKKMQEKSA-N	435.279	1.364	50	20	IDGD	
C[C@@H](Oc1cccnc1)C(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1840450213	VRHNMZBEZNRBCJ-IIBYNOLFSA-N	439.940	1.570	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)c1	1840729553	SEZMBQODZGZEFP-APWZRJJASA-N	427.860	1.249	50	20	IDGD	
O=C(c1cccc(Br)c1[N+](=O)[O-])N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1	1841352649	CPTSGRNDZAUGHL-LBPRGKRZSA-N	446.685	1.774	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)c1n[nH]c(C)c1F)C2	1844692180	QMMNFTRYGRNNBO-UHFFFAOYSA-N	445.407	1.822	50	20	IDGD	
COc1ccnc(C(=O)N2CCCC23CN(C(=O)[C@@H](C)CBr)C3)c1OC	1844840649	UIDKNOGUFFGGHL-LBPRGKRZSA-N	426.311	1.947	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCCC12CN(C(=O)c1cnc3c(c1)CCNCC3)C2	1845172641	WJOWAADCYDHAGD-IBGZPJMESA-N	425.360	1.823	50	20	IDGD	
COc1ccc(C(=O)N2CCCC23CN(C(=O)[C@H](F)Br)C3)c(O)c1OC	1845426081	IWGNEBSMXLWFRY-AWEZNQCLSA-N	431.258	1.917	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCCC12CN(C(=O)c1cccc(=O)n1O)C2	1845870752	ZKMXEYYJYKRCRY-OQLLNIDSSA-N	440.406	1.788	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](O)CCl)C1	1847562865	CPGBZFRFPANBAM-UHDSXZAQSA-N	443.972	1.871	50	20	IDGD	
COc1ccc(-c2n[nH]cc2C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1	11260698	NXWKSYMTNUQXPT-UHFFFAOYSA-N	449.876	1.461	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1cn(-c2ccccc2)nc1-c1cccnc1	16785720	OTWZCRUABWNOFY-OAHLLOKOSA-N	425.470	1.130	50	20	IDGD	
Cc1nnc(NNC(=O)c2cc(S(=O)(=O)NC3CC3)c(Cl)cc2Cl)nc1O	23311760	HKWSXGULUXWCCY-UHFFFAOYSA-N	433.277	1.390	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)o2)cc1F	727497884	FGMICNGIUMXUAT-UHFFFAOYSA-N	442.494	1.843	50	20	IDGD	
CCCCS(=O)(=O)N1CCC(C(=O)NNC(=O)CNc2cccc(OC)c2)CC1	728206207	BBBRVVAFCQNRSZ-UHFFFAOYSA-N	426.539	1.096	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)C[C@H](c2ccccc2)N2CCOC2=O)c1	728240908	VCGQNSPONVBBCL-QGZVFWFLSA-N	431.470	1.435	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)[C@@H]1CCCN1c1ncnc2sccc12	728455435	PSWONTVRZIZBFR-XJKSGUPXSA-N	425.470	1.648	50	20	IDGD	
CC(C)CN1C(=O)/C(=C/NNC(=O)c2cc(F)ccc2Br)C(=O)NC1=S	728611293	YWDDDIFXDGPDLU-IZZDOVSWSA-N	443.298	1.606	50	20	IDGD	
CCOc1ccc(/C=C(\C#N)C(=O)N2CCN([C@H](C)C(=O)NCCCOC)CC2)cc1	728889241	SBRHENQJVGBCJR-RILMWAFASA-N	428.533	1.678	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)Nc1cccc(N2CCOC2=O)c1	729491711	DFNXTBNRDNVXAQ-UHFFFAOYSA-N	425.449	1.503	50	20	IDGD	
C[C@H]1CCCCN1CCOc1ccccc1C(=O)NNC(=O)CNC(=O)c1ccco1	729532149	ZJNLXDMWNOCCJR-INIZCTEOSA-N	428.489	1.724	50	20	IDGD	
O=C(NCCOc1ccc(F)c(F)c1)NNC(=O)c1csc(N2CCOCC2)n1	730128913	KGEGKNGVGSFTMT-UHFFFAOYSA-N	427.433	1.281	50	20	IDGD	
COc1ccccc1C[C@H](C)CC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	730517640	YMBSIMDCALTCLA-HNNXBMFYSA-N	433.530	1.975	50	20	IDGD	
CCc1noc(-c2ccc(CCNC(=O)NNC(=O)COc3ccccc3O)cc2)n1	730824840	GVEXLPGKZUNVHO-UHFFFAOYSA-N	425.445	1.957	50	20	IDGD	
COc1cc(OC)c(CCNC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c(OC)c1	731045646	GABAYIQKYLCYRR-IBGZPJMESA-N	431.445	1.425	50	20	IDGD	
N#Cc1cccc(C(=O)NNS(=O)(=O)c2cc(Br)cc([N+](=O)[O-])c2)c1	731178760	QJJLMNUMXXMERK-UHFFFAOYSA-N	425.220	1.852	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)NCc1ccc(S(=O)(=O)N(C)C(C)C)cc1	731497631	FPBNUZWXQZMFNC-UHFFFAOYSA-N	434.518	1.868	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)N1CCN(CC(=O)N[C@H]2CCC[C@@H](C)C2)CC1	731499961	SVUBDBGCQKYMEM-SJORKVTESA-N	431.537	1.362	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)c1cc(S(=O)(=O)N2CCSCC2)c[nH]1)c1ccccc1	732132115	CHQHICADMIRVOV-INIZCTEOSA-N	436.559	1.707	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc(F)cc1)NNC(=O)NCc1ccc(Cl)cc1	733004408	GDHCZQPZFYLOAG-UHFFFAOYSA-N	428.873	1.678	50	20	IDGD	
CCC[C@H](C)NS(=O)(=O)c1cc(C(=O)NNC(=O)CN(C)C)c(Cl)cc1Cl	733359388	GODAXIGVAZLUFI-JTQLQIEISA-N	439.365	1.783	50	20	IDGD	
CN(C)CC(=O)NNC(=O)c1cnn(-c2ncccc2Cl)c1C(F)(F)C(F)(F)F	733359954	YXKAJYONDHSAIC-UHFFFAOYSA-N	440.760	1.897	50	20	IDGD	
N#Cc1ccc(N2C(=O)N[C@@H](CCC(=O)NNC(=O)c3c[nH]c4ccccc34)C2=O)cc1	733777226	SOXHYGDYPMFVIV-SFHVURJKSA-N	430.424	1.706	50	20	IDGD	
Cc1cc(C)nc(SCC(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)n1	734825449	FXRSSSMMCFPIFC-UHFFFAOYSA-N	438.554	1.915	50	20	IDGD	
Cc1ccc(OCCCC(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)cc1	735117197	CPGSRAHIPWNCSX-UHFFFAOYSA-N	447.561	1.628	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)N[C@H](C)CN1CCN(c2ccccn2)CC1	735585269	CTOYGFKNLKUKAJ-SJORKVTESA-N	444.511	1.529	50	20	IDGD	
C[C@@H](CN1CCN(c2ccccn2)CC1)NC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	735588060	ZFSQERJCAMSUJV-HNNXBMFYSA-N	427.465	1.145	50	20	IDGD	
COCCN1CC[C@H](NC(=O)NNC(=O)[C@H](C)Oc2cccc(Br)c2)C1	736650579	XFEXUFBPNZIUCS-JSGCOSHPSA-N	429.315	1.268	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)CCN2C(=O)CCc3ccccc32)c1	737766663	LEQOWAXANVPVOV-UHFFFAOYSA-N	444.513	1.067	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N[C@@H](C)[C@H]2CN(Cc3ccccc3)CCO2)cc1OC	741270065	OPXGCOXQGSFTJT-HRAATJIYSA-N	442.516	1.937	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)NC1CCN(S(=O)(=O)c2cnn(C)c2)CC1)c1ccccc1	741279600	YZCRNGRXQAGRLQ-GOSISDBHSA-N	448.549	1.097	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)CCN3C(=O)[C@@H]4[C@H]5CC[C@@H](O5)[C@@H]4C3=O)cc2C1	742480455	PLQHYAMOCCEVRY-YVPZYXGXSA-N	431.514	1.186	50	20	IDGD	
Cc1nn(C)c(C)c1S(=O)(=O)N[C@H](C)C(=O)NNC(=O)c1cc2ccccc2cc1O	743291316	JVIABQCGQHIEBY-GFCCVEGCSA-N	445.501	1.024	50	20	IDGD	
O=C(NNC(=O)[C@@H](Oc1ccc(Cl)cc1)c1ccccc1)N[C@@H]1CCS(=O)(=O)C1	743885376	WBCDELREZCMIHC-WBVHZDCISA-N	437.905	1.978	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)N[C@@H]1CCN(Cc2ccccc2)C1=O	744877866	JXWWGPGKSRAHCY-QGZVFWFLSA-N	426.473	1.596	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)c2ccc(S(N)(=O)=O)s2)cc1OC	745485468	OZYCTVDWRLOFKY-UHFFFAOYSA-N	427.504	1.658	50	20	IDGD	
CC(C)C[C@@H](C(=O)NNC(=O)Cc1cn2ccccc2n1)N1C(=O)[C@H]2CC=CC[C@H]2C1=O	746553087	GBHMVCXDHSFTIU-KSZLIROESA-N	437.500	1.390	50	20	IDGD	
O=C(NNC(=O)[C@@H]1C[C@@H]1c1cccc(Br)c1)c1ccc(-n2cnnn2)cc1	747411587	CMUMRPDRCXSAES-HZPDHXFCSA-N	427.262	1.990	50	20	IDGD	
O=C(NNc1cccc([N+](=O)[O-])c1)[C@@H]1CCCN1S(=O)(=O)c1cccc([N+](=O)[O-])c1	748004631	NHULBJYDDCXBJV-INIZCTEOSA-N	435.418	1.799	50	20	IDGD	
COc1cc([C@@H](C)NC(=O)NNC(=O)C(=O)N2CCCC2)ccc1OCc1ccncc1	748462585	VCZAZTVKDAKPRB-OAHLLOKOSA-N	441.488	1.683	50	20	IDGD	
C[C@@H]1NC(C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)=NN(c2ccccc2)C1=O	748835496	ZHOADBRWAPCHSF-NSHDSACASA-N	442.426	1.639	50	20	IDGD	
O=C(NCCc1nnc(-c2ccccc2)o1)NNC(=O)c1nn(-c2ccccc2)cc1O	749203332	JGYWMPBFOAHJOW-UHFFFAOYSA-N	433.428	1.815	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCCCc2nc(C(C)C)no2)nc1	749356509	PBUKTSZDHWUWPW-UHFFFAOYSA-N	439.542	1.877	50	20	IDGD	
NC(=O)c1ccc(CNC(=O)NNC(=O)COc2ccccc2Cc2ccccc2)cn1	753956349	XUVFOCCAKMSZJZ-UHFFFAOYSA-N	433.468	1.681	50	20	IDGD	
COc1cc(C=NNC(=O)C(=O)Nc2ccc(C)c(C)c2)c([N+](=O)[O-])cc1OCC(=O)O	755600066	FLMBSPAGUSVJGF-UHFFFAOYSA-N	444.400	1.772	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)cc1NC(=O)OC(C)(C)C	755695630	ZLZFJRLRIQCELG-JTQLQIEISA-N	445.498	1.133	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)[C@H]1CCC(=O)N1Cc1ccc(Br)cc1	755719191	DANOZRQMYXOFIY-SMDDNHRTSA-N	440.294	1.429	50	20	IDGD	
CCN(Cc1ccccc1NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)C(C)=O	755757881	HFYMFVXCUAOQQI-UHFFFAOYSA-N	439.520	1.914	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)Nc3cnn(CCN4CCOCC4)c3)n[nH]2)cc1	756826741	KKCMXBJCVZYVCT-UHFFFAOYSA-N	438.492	1.380	50	20	IDGD	
NC(=O)c1ccc(NNC(=O)[C@@H]2CCCN2C(=O)c2ccc(Br)cc2)nn1	757403834	GNRGXRQYVLMEHS-ZDUSSCGKSA-N	433.266	1.086	50	20	IDGD	
O=C(c1cn(-c2ccccc2Cl)nn1)N1CCN(S(=O)(=O)CBr)CC1	758528110	PPIPOJVNSKGNKO-UHFFFAOYSA-N	448.730	1.361	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H](C#N)[C@H](NC(=O)NNC(=O)CSc2ccccc2O)C1	758758027	HZIZOAVVLWRYNM-QWHCGFSZSA-N	435.506	1.574	50	20	IDGD	
CN1C(=O)C[C@@H](C(=O)NNC(=O)CNC(=O)c2ccco2)[C@H]1c1ccc(Cl)c(F)c1	758960138	KPYQOEQADMUQSI-PIGZYNQJSA-N	436.827	1.169	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN(C(=O)c2cccc3ccccc23)C1)C(=O)Nc1ccccn1	759098437	GJJCHZGFAPJWNJ-KRWDZBQOSA-N	445.479	1.873	50	20	IDGD	
COc1cc(S(=O)(=O)NNC(=O)c2cccc(Br)c2)ccc1[N+](=O)[O-]	759165591	ORFBOQPTCUUUCM-UHFFFAOYSA-N	430.236	1.989	50	20	IDGD	
C=Cc1ccc(C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)cc1	760068909	OMJPUSIFAGDFOZ-UHFFFAOYSA-N	443.525	1.744	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)N1CCO[C@@H]([C@H](C)NC(=O)OC(C)(C)C)C1	760713881	DZAWOZJJRPPHJN-DZGCQCFKSA-N	446.508	1.611	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NCCOC)c(C(=O)NNc2ncc(F)cn2)c1	760905963	DRUWUIRBEUZMHK-UHFFFAOYSA-N	440.501	1.461	50	20	IDGD	
O=C(NNC(=O)c1ccccc1Br)C(=O)Nc1ccc2c(c1)C(=O)NCC2	763483524	QAXXZKJLVUNSFD-UHFFFAOYSA-N	431.246	1.135	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)Nc1ccc(Cl)c2ncccc12	763574457	ZPWDOADHQPICHJ-MRXNPFEDSA-N	426.816	1.814	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccc(-c2nnc(C)o2)c1	763657895	SLGGJAGIQNPGEK-UHFFFAOYSA-N	425.401	1.219	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cc(C)n(-c3cccc(F)c3)n2)cc1	763660486	ALCSZOGGSYKCDJ-UHFFFAOYSA-N	441.419	1.493	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cc(Cl)ccc2C(=O)N(C)C)cc1	763661262	MDDVYIXNJZFXLE-UHFFFAOYSA-N	448.863	1.215	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccn(-c3ccccc3Cl)n2)cc1	763661550	OBBURUGYLPDHST-UHFFFAOYSA-N	443.847	1.699	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccccc2-n2c(C)cnc2O)cc1C	763679902	MHZILTFBNYAEAZ-UHFFFAOYSA-N	437.456	1.668	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)C(=O)Nc1ccc(Br)c(F)c1	763682096	XAHCCLYDRFIDKB-UHFFFAOYSA-N	428.189	1.892	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(OC)ccc1C(=O)OC	763717537	YUYXMBRKZRRAHY-UHFFFAOYSA-N	429.429	1.209	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)ccc1NC(C)=O	763726802	AZWGNSWZIORDFY-UHFFFAOYSA-N	428.489	1.956	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)C(=O)Nc2ccc(C(C)C)cc2)cc1	763731702	BRKXZEVZJXBQEZ-UHFFFAOYSA-N	446.529	1.525	50	20	IDGD	
O=C(CN1CCCc2ccccc21)NNC(=O)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl	763736182	QQGYMWAAPBDBPS-UHFFFAOYSA-N	431.836	1.787	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2cccc(Cl)c2OC)c2ccccc2c1=O	763787293	WOKDOMNPPYEHTF-UHFFFAOYSA-N	443.847	1.478	50	20	IDGD	
COC(=O)N(C)Cc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C)cc2)cc1	763820339	FSTPETUULMEIIC-UHFFFAOYSA-N	428.445	1.358	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)ncn3C)cc1	763860483	HMXQEWCOYNSKPC-CYBMUJFWSA-N	425.445	1.525	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccc(-c2csnn2)cc1	763872249	MVFNCWYVCNLURV-LLVKDONJSA-N	429.433	1.898	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cnc(C(C)(C)C)nc2)cc1	763878364	PHDLZDPTVSRIMR-CYBMUJFWSA-N	427.461	1.530	50	20	IDGD	
N#Cc1c(F)cccc1-n1ccc(NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)n1	763979515	XMUJICFJKYKEOC-UHFFFAOYSA-N	442.794	1.642	50	20	IDGD	
CC(C)Sc1c(Cl)cccc1NC(=O)C(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1	763998283	OHFVLKOHDBOIKH-SNVBAGLBSA-N	433.939	1.361	50	20	IDGD	
COc1ccc2cc(NC(=O)C(=O)NNC(=O)c3cc(Br)cn3C)ccc2n1	764003035	WWPRNMKSBIVXNI-UHFFFAOYSA-N	446.261	1.744	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1cccc(CN2C[C@H](C)O[C@@H](C)C2)c1	764042320	GEYBDZHGWRIUNS-HOTGVXAUSA-N	440.500	1.704	50	20	IDGD	
O=C(NNC(=O)C1CCCC1)C(=O)Nc1ncn(Cc2cccc(Br)c2)n1	764076874	JEDLFOATKXLZBU-UHFFFAOYSA-N	435.282	1.365	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(Cl)cc2Cl)c1	764078443	VAZUSOPQGIYYKF-UHFFFAOYSA-N	430.269	1.797	50	20	IDGD	
COC(=O)c1ccccc1NC(=O)C(=O)NNC(=O)c1ccc(F)cc1Br	764086305	QJYGXCQYQRUHIZ-UHFFFAOYSA-N	438.209	1.775	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)nc1)C(=O)Nc1cccc(CN2CCCCC2=O)c1	764092827	ODVFTYBIINPYDP-UHFFFAOYSA-N	429.864	1.647	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3nnc(C(C)(C)C)s3)n[nH]2)cc1	764110216	GMUPPMQBDZGPHN-UHFFFAOYSA-N	427.490	1.934	50	20	IDGD	
CC[C@H](C)NS(=O)(=O)c1cccc(NC(=O)C(=O)NNC(=O)CCc2ccco2)c1	764177224	KRYYQSARBKOCNG-ZDUSSCGKSA-N	436.490	1.075	50	20	IDGD	
Cn1nccc1NC(=O)C(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1	764178520	CEJRSTDNAYFCCS-LJQANCHMSA-N	432.484	1.133	50	20	IDGD	
COC(=O)c1cc(OC)c(OC)cc1NC(=O)C(=O)NNC(=O)CCc1ccccc1	764184765	DYWDXHABOYJHHD-UHFFFAOYSA-N	429.429	1.209	50	20	IDGD	
COc1c(F)cc(F)cc1NC(=O)C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C	764204036	RKJKIDYPEPDFNG-UHFFFAOYSA-N	430.408	1.364	50	20	IDGD	
C[C@@H](C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1)c1c(F)cccc1F	764283300	UKPCXBYUCLTVPU-CYBMUJFWSA-N	439.488	1.543	50	20	IDGD	
O=C1CSc2ccc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc3ccccc3)cc2N1	764379816	LJPFSOQLOHFOJN-UHFFFAOYSA-N	436.396	1.489	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1C	764399747	LOAXABYFKCFVFH-OAHLLOKOSA-N	440.456	1.796	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNS(=O)(=O)c1cc2c3c(c1)CC(=O)N3CCC2	764931983	JGVPQCVXEYTDPP-UHFFFAOYSA-N	435.889	1.807	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@H](C)Cc3c(C)nn(C)c3C)CC2)cc1	765755446	QDYZABSQRRVRSC-GOSISDBHSA-N	440.592	1.489	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)c1ccc(=O)n(-c2ccccc2F)n1	766078235	UJHMOMBCWOHTIT-UHFFFAOYSA-N	434.387	1.338	50	20	IDGD	
C[C@H]1C[C@H](C)CN(S(=O)(=O)c2ccc(NC(=O)C(=O)NNc3cnccn3)cc2)C1	766258152	AYMGEPWOIYIIIM-KBPBESRZSA-N	432.506	1.225	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNc2nccnc2OC)sc2c1CC[C@H](C)C2	766268943	CFVDTLLHLKTITB-JTQLQIEISA-N	433.490	1.930	50	20	IDGD	
CC[S@](=O)c1ccccc1C(=O)NNC(=O)CN1CCN(Cc2ccc(C)cc2)CC1	766642353	RFZXOTZEMPXQTP-HKBQPEDESA-N	442.585	1.701	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3[nH]c4c(c3C)C(=O)CCC4)CC2)cc1	766642427	RKUNOLHPRFPVJK-UHFFFAOYSA-N	437.544	1.729	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1ccc([N+](=O)[O-])cc1Cl	766649691	IYQNSYDAQWKNEW-UHFFFAOYSA-N	445.863	1.467	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCN(Cc3cccc(F)c3)CC2)cc1OC	767041887	VKMSAGLLGOKTMW-UHFFFAOYSA-N	430.480	1.422	50	20	IDGD	
CSc1nc(C)c(CCC(=O)OCC(=O)NNC(=O)Cc2ccccc2C)c(C)n1	767263963	CQVPIHUWSYKOJJ-UHFFFAOYSA-N	430.530	1.990	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc(C)c(NC(=O)CCN(C)C)c1	768240579	YOONXLNYHCFHTH-UHFFFAOYSA-N	441.488	1.294	50	20	IDGD	
CCOc1ccc(NC(=S)NNC(=O)c2cccc([C@@]3(C)NC(=O)NC3=O)c2)cc1	768928672	GDDQXRWCKRMOIW-HXUWFJFHSA-N	427.486	1.771	50	20	IDGD	
CNS(=O)(=O)c1ccc(CNC(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)s1	770110910	PDSBFXLVNILJDU-SNVBAGLBSA-N	446.938	1.608	50	20	IDGD	
CNS(=O)(=O)c1ccc(C(=O)NNC(=O)[C@H](C)Oc2c(C)cc(Cl)cc2C)cn1	770219846	NARPXVNTQKYHHX-LBPRGKRZSA-N	440.909	1.488	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)N[C@H]3CCCN(c4ccccc4Cl)C3=O)nc21	770399082	DKMMOSHCUHHOTI-LBPRGKRZSA-N	430.856	1.544	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1cccc(S(=O)(=O)Nc2ccc(F)cc2)c1	771869489	YPNJIUMWTLQSRA-LBPRGKRZSA-N	437.449	1.729	50	20	IDGD	
CCc1csc(-n2cc(C(=O)NNC(=O)C(=O)NCc3ccc(Cl)cc3)cn2)n1	772184800	ZVOBEUMOKHZTCJ-UHFFFAOYSA-N	432.893	1.622	50	20	IDGD	
COc1cc(OC)cc(C(=O)NCC(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)c1	772995845	PAGWBFYLOFLRLE-LBPRGKRZSA-N	435.864	1.702	50	20	IDGD	
O=C(NNC(=O)N1CCO[C@H](c2ccc(F)cc2Cl)C1)c1ccc(-n2cnnn2)cc1	773131221	IZEZJKXUTLBSGG-KRWDZBQOSA-N	445.842	1.883	50	20	IDGD	
CNC(=O)c1cc(Oc2ccccc2NC(=O)C(=O)NNc2nc(C)cc(C)n2)ccn1	773478249	NJNJNZNNWZFFKI-UHFFFAOYSA-N	435.444	1.722	50	20	IDGD	
CS(=O)(=O)NCc1ccc(NC(=O)C(=O)NNc2ncc(Cl)cc2Cl)cc1	773677581	PLDWZVRQLXKJRU-UHFFFAOYSA-N	432.289	1.519	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)N[C@@H]2CCO[C@@]3(CCS(=O)(=O)C3)C2)c1C	776004654	UFECBXATSCYZPJ-HDIATQEYSA-N	435.546	1.511	50	20	IDGD	
CCCc1c(C(=O)N2CCN(S(=O)(=O)CBr)CC2)[nH]c(C)c1C(C)=O	777779322	JNEVFKJHHOPMGB-UHFFFAOYSA-N	434.356	1.918	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)c2c(C)nn(C)c2-n2cc(C)cn2)cc1C	778553659	NMPQOVQBISBFQW-UHFFFAOYSA-N	444.517	1.773	50	20	IDGD	
COC[C@@H](C)n1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C(C)(C)C)cc2)n1	778706497	SPMQUGZUUXXCTO-CQSZACIVSA-N	431.493	1.553	50	20	IDGD	
CCCCn1c(N)c(N(CC(C)C)C(=O)CCC(=O)N2CC=C(C#N)CC2)c(O)nc1=O	780686397	ZQZQGURMGWQGJX-UHFFFAOYSA-N	444.536	1.783	50	20	IDGD	
O=C(CN1CCC[C@H](S(=O)(=O)NC2CCCC2)C1)NNC(=O)c1cccc(Cl)c1	782057114	YAVXIEOPACVMBT-KRWDZBQOSA-N	442.969	1.427	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1Cl)C(=O)Nc1cccc(N2CCNC2=O)c1	782926719	KSCDQGDVKYRBFO-UHFFFAOYSA-N	436.255	1.923	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)[C@@H]3CC=CC[C@H]3C(=O)N3CCOCC3)nc21	784400657	ZKHRYSOGCURYNP-ZIAGYGMSSA-N	443.508	1.171	50	20	IDGD	
CC(C)NC(=O)C(=O)NNC(=O)[C@H]1CC(=O)N(C(C)(C)C)[C@@H]1c1ccc(Cl)c(F)c1	785064138	CRVISJWCIMBDTO-BLLLJJGKSA-N	440.903	1.839	50	20	IDGD	
Cn1ccnc(NNC(=O)C(=O)Nc2cccc(COc3ccc4c(c3)OCO4)c2)c1=O	785086469	PSNZFELBSVRYEM-UHFFFAOYSA-N	437.412	1.170	50	20	IDGD	
CC(=O)N1CCN(c2cccc(NC(=O)C(=O)NNc3cc(F)c(F)c(F)c3)c2)CC1	785090696	WXLKZBXSHFOFNP-UHFFFAOYSA-N	435.406	1.854	50	20	IDGD	
COc1cc(F)cc(NNC(=O)C(=O)Nc2ccccc2C(=O)N2CCN(C)CC2)c1	785237258	NFSRTIRPCXGUKM-UHFFFAOYSA-N	429.452	1.304	50	20	IDGD	
O=C(NNC(=O)C(F)(F)C1(O)CCCC1)c1cccc(S(=O)(=O)N2CCCC2)c1	785671034	UGLJDTXEMAILTG-UHFFFAOYSA-N	431.461	1.173	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)C(=O)Nc1ccc(Cl)cc1-n1cccn1	788331092	PUBIGWILNJCVTB-UHFFFAOYSA-N	431.811	1.830	50	20	IDGD	
COC(=O)CN1CCN(c2ccc(NC(=O)NNc3cc(Cl)nc(N)n3)cc2)CC1	789092795	MNZFQJBVEWBPRJ-UHFFFAOYSA-N	434.888	1.156	50	20	IDGD	
COC[C@H](NC(=O)NNC(=O)[C@@H](C)Oc1cccc(Br)c1)[C@@H]1CCCO1	789335694	SYDDSMIPLIEWEH-UGFHNGPFSA-N	430.299	1.741	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2ccnc(Oc3ccc(F)cc3F)c2)CCS(=O)(=O)C1	789750114	CKNAUGGSFZSLNG-SFHVURJKSA-N	440.428	1.289	50	20	IDGD	
CCS(=O)(=O)c1ccc(CNC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])s1	792223047	MCMFMNJJILZWRF-UHFFFAOYSA-N	442.475	1.359	50	20	IDGD	
CCc1c(NC(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)cnn1-c1ccc(Cl)cc1	792485497	FTVMFCYTOLHAOX-LLVKDONJSA-N	425.898	1.676	50	20	IDGD	
CN(C)N(C(=O)[C@H]1CCN(c2cc(Cl)ccc2Cl)C1=O)[C@H]1CCS(=O)(=O)C1	792851931	YTNHDFUBJCRDDX-STQMWFEESA-N	434.345	1.839	50	20	IDGD	
C[C@](O)(CN1C(=O)NC2(CCCC2)C1=O)C(=O)NNc1ccc(Br)cc1F	793706977	QHEOFHIWKHMTMT-INIZCTEOSA-N	443.273	1.647	50	20	IDGD	
CCOc1ccc(N2C[C@@H](C(=O)NNc3ccccc3S(=O)(=O)N(C)C)CC2=O)cc1	795169866	ZPHHCZOBTZGGOE-HNNXBMFYSA-N	446.529	1.832	50	20	IDGD	
O=S(=O)(CBr)N1CCN(S(=O)(=O)CCc2cccc(Cl)c2)CC1	795926773	SPAPBPCKQYCTSE-UHFFFAOYSA-N	445.788	1.512	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)c2nnn(Cc3ccncc3)c2C)c1	796123715	ZXVJWEDJVHHDFV-UHFFFAOYSA-N	445.277	1.876	50	20	IDGD	
COC(=O)Cn1ncc(NC(=O)C(=O)NNc2ccc(Br)cc2F)c1C	797038377	IGOXMAHMFRUJQR-UHFFFAOYSA-N	428.218	1.348	50	20	IDGD	
CS(=O)(=O)Cc1ccccc1NC(=O)NNC(=O)CNC(=O)OCc1ccccc1	797620659	TYBIXCLJYPKZBQ-UHFFFAOYSA-N	434.474	1.310	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)[C@H]1CCCN1C(=O)OCc1ccccc1	798113873	DZKYEHJYUQNGGE-MRXNPFEDSA-N	434.493	1.850	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C(C)C)n2nnc(-c3ccccc3)n2)cc1C	798309327	KMKPSVQDQVSUBF-GOSISDBHSA-N	435.488	1.940	50	20	IDGD	
NS(=O)(=O)c1ccc(C(=O)NNc2nc(-c3ccccc3)no2)cc1Br	798325957	GZHVTUBFZAFFBC-UHFFFAOYSA-N	438.263	1.903	50	20	IDGD	
CNC(=O)CNC(=O)c1cccc(NC(=O)/C(C#N)=C/c2cc(C)n(CCOC)c2C)c1	800370294	DOKDRAYKOCPNJY-YBFXNURJSA-N	437.500	1.773	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)c2nn(-c3ccc(F)cc3C)cc2O)c1	801427770	KLIBDCYHPAYBGB-UHFFFAOYSA-N	426.404	1.952	50	20	IDGD	
CN(C)C(=O)CS(=O)(=O)c1ccc(C(=O)NNC(=O)Nc2cc(F)cc(F)c2)cc1	802006464	NFPJVPGXGJFKBY-UHFFFAOYSA-N	440.428	1.293	50	20	IDGD	
O=C(NNC(=O)c1cccc(CN2CCS(=O)(=O)CC2)c1)Nc1ccc2c(c1)OCO2	802104413	BIOXZAYGJWJNRG-UHFFFAOYSA-N	446.485	1.112	50	20	IDGD	
COc1ccc(Cl)c(NC(=O)NNC(=O)C2CCN(c3ccc4nncn4n3)CC2)c1	802110041	QCERFTFCCIEKGW-UHFFFAOYSA-N	444.883	1.856	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)c1cccc(NN2C(=O)[C@H]3CC=CC[C@@H]3C2=O)c1	802490861	YKYNPEJLGCMIND-OALUTQOASA-N	448.479	1.977	50	20	IDGD	
O=C(NNc1ccc2c(=O)[nH]ccc2c1)c1sccc1S(=O)(=O)N1CCOCC1	803435175	NIPLPUZRTWCGNU-UHFFFAOYSA-N	434.499	1.367	50	20	IDGD	
O=C(NCCCN1C(=O)c2ccccc2C1=O)NNC(=O)c1cnn(-c2ccccc2)c1	805110562	YVALLMJENKIQTM-UHFFFAOYSA-N	432.440	1.503	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNC(=O)Nc1cc(Cl)cc2c1OCC(=O)N2	806754936	FXUPVUQPLASZOA-UHFFFAOYSA-N	447.835	1.750	50	20	IDGD	
COCc1csc(NC(=O)C(=O)NNC(=O)c2ccc(F)cc2Br)n1	806976046	BFGBXTRMUHKPQE-UHFFFAOYSA-N	431.243	1.591	50	20	IDGD	
O=C(NNC(=O)[C@H]1COCCO1)C(=O)Nc1cccc(-c2ccc(Br)cc2)c1	806980157	KIDRTFRMNUSSCA-MRXNPFEDSA-N	448.273	1.617	50	20	IDGD	
O=C1COC[C@@H](C[C@@H]2CN(C(=O)C(=O)NNc3cnc4ccccc4n3)c3ccccc32)N1	806984064	LLZRIFVEPCOLDH-HUUCEWRRSA-N	446.467	1.108	50	20	IDGD	
COCCOc1ccc(S(C)(=O)=O)cc1NC(=O)C(=O)NNc1cccc(F)c1F	807018065	RHAYPLIPCCXDDK-UHFFFAOYSA-N	443.428	1.475	50	20	IDGD	
COc1ccc(S(=O)(=O)C(F)(F)F)cc1NC(=O)C(=O)NNc1ncccc1F	807300595	GSQGUGPAPQZYLW-UHFFFAOYSA-N	436.343	1.605	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNc2ccc(-n3ccnc3)nn2)c(F)cc1C	807429087	NHOWRQPWKMUQPP-UHFFFAOYSA-N	427.396	1.368	50	20	IDGD	
N#Cc1ncn(CCNC(=O)NNC(=O)CCCOc2ccc(Cl)cc2Cl)n1	807511562	ZUCABMPMBHUGBN-UHFFFAOYSA-N	426.264	1.646	50	20	IDGD	
COC(=O)N1CCC(CNC(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)CC1	807525819	UBQUFUXGTDSOTR-UHFFFAOYSA-N	444.492	1.400	50	20	IDGD	
CCc1nnc(NC(=O)[C@H](C)[C@H](C)NC(=O)NNc2cccc(S(C)(=O)=O)c2)s1	807566538	XRXVGXSWMIEOJR-MNOVXSKESA-N	440.551	1.793	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1cc(C)n(-c2ccc(F)cc2F)n1	808934445	FWGTVRGAHLPSOM-UHFFFAOYSA-N	429.383	1.867	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cccc3c2OCC(=O)N3)c1C	810386245	RKCVKONGRYSGHN-CYBMUJFWSA-N	426.429	1.188	50	20	IDGD	
O=C(NCc1ccc(C(=O)OCc2ccccc2)cc1)NNC(=O)C(=O)Nc1ccccn1	812537467	BWKGAXXDFIJEHY-UHFFFAOYSA-N	447.451	1.908	50	20	IDGD	
CNC(=O)[C@H](CCSC)NC(=O)CCC(=O)C(C#N)=C1N(C)c2ccccc2N1C	813836350	JISUWCRJZLRUIN-HNNXBMFYSA-N	429.546	1.641	50	20	IDGD	
Cn1ncc(C(=O)NNC(=O)Nc2ccc3c(c2)OCO3)c1I	816597423	QXWJAUBHKPZYDS-UHFFFAOYSA-N	429.174	1.220	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)CN2C(=O)c3ccccc3C2=O)c1	816716822	CUCPCTDYDAGBIR-UHFFFAOYSA-N	432.230	1.975	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)CN2C(=O)N[C@@]3(C[C@H](C)CC(C)(C)C3)C2=O)c1	864001595	QAIAUHVRZKUQGA-IQMFZBJNSA-N	444.532	1.966	50	20	IDGD	
O=C(COC(=O)c1cccc(NC(=O)C2CC2)c1)NNC(=O)[C@@H]1COc2ccccc2O1	899131932	ZFXGJAVNHASMAE-SFHVURJKSA-N	439.424	1.179	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@@H](C)C(=O)NNC(=O)c1cc(S(N)(=O)=O)ccc1F	912865751	ACJYIJVDWYZUOW-NSHDSACASA-N	443.884	1.972	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)NNC(=O)c2cc3c(s2)CC[C@@H](C)C3)ccc1OC	913162432	HZBWUGMFWHNPTC-LLVKDONJSA-N	437.543	1.864	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)OCC(=O)Nc2sc3c(c2C(N)=O)CCC3)cc(C#N)n1C	913287127	UJUVMPFBWJWPMF-MLPAPPSSSA-N	437.481	1.943	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2cccc(C(=O)NNC(=O)NC3CCCCC3)c2)C[C@@H](C)O1	913449221	LZBALVVPUKCRQC-GASCZTMLSA-N	438.550	1.761	50	20	IDGD	
O=C(NNc1cccc(Br)c1)c1ccc(S(=O)(=O)N2CCOCC2)o1	914835013	LEHQNOIMTARISX-UHFFFAOYSA-N	430.280	1.820	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@@H](c2ccccc2)N2CCCC2)c1	915877852	FCXAVOSYEWBHCC-IBGZPJMESA-N	430.530	1.871	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NCCSCc2ccccc2C#N)c2ccccc2c1=O	915926576	FWQHHWVAWBSIQE-UHFFFAOYSA-N	436.497	1.683	50	20	IDGD	
CCCS(=O)(=O)N1CCC(NC(=O)NNC(=O)COc2cc(C)cc(C)c2)CC1	916383312	CKMHPGDJAPNUPV-UHFFFAOYSA-N	426.539	1.217	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)NCCCN2CCN(C)C[C@@H]2c2ccccc2)n1	916485063	LIEXCHVHKPYBLU-HXUWFJFHSA-N	427.553	1.209	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)COc1ccccc1F)N1CCN(c2ccccc2)CC1	916514980	WIXMHUPLQWWKOR-KRWDZBQOSA-N	429.496	1.746	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCCNc1ncccc1C#N	916641321	VFKZLGXDSSJJDS-GFCCVEGCSA-N	447.293	1.926	50	20	IDGD	
C[C@@H](NC(=O)c1ccoc1)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	916726665	SPXZAHKQHMJPIQ-CQSZACIVSA-N	448.501	1.034	50	20	IDGD	
CCN(CC)C(=O)c1ccc(S(=O)(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1	920308528	XTFQYPUHVQMPOQ-GOSISDBHSA-N	433.486	1.318	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CS(=O)(=O)Cc2ccc(Br)cc2)cc1	1115852245	VOYORIDCDXRDKI-UHFFFAOYSA-N	441.303	1.834	50	20	IDGD	
O=C(NCc1ccc(CN2CCC(O)CC2)cc1)NNC(=O)c1cncn1-c1ccccc1	1318286331	CEAXXYOKKXSXPY-UHFFFAOYSA-N	448.527	1.973	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1)C(=O)NCC(F)(F)F	1318621922	ASGMSHQMLRTPSO-SNVBAGLBSA-N	439.435	1.031	50	20	IDGD	
CS(=O)(=O)Nc1cccc(F)c1CNC(=O)NNC(=O)c1cc2c(s1)CCC2	1319048179	YROFRVHFFLVKDI-UHFFFAOYSA-N	426.495	1.892	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CC(=O)N(CCOc2ccccc2Cl)C1)c1n[nH]c2c1CCCC2	1319519759	YEIBBEOFESIUQP-CYBMUJFWSA-N	445.907	1.630	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCCNS(=O)(=O)c2cc(C)sc2C)cc1	1319520831	QUVUTFIKGFDVLH-UHFFFAOYSA-N	426.520	1.296	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)c2csc(S(C)(=O)=O)c2)CC1	1319745147	BVHVQGNSIFMAIR-UHFFFAOYSA-N	431.536	1.560	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNS(=O)(=O)c2cnn(CC(F)F)c2)CC1	1323313780	WKKQJYSVSGUDMA-UHFFFAOYSA-N	437.469	1.105	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)N[C@@H]2CC(=O)N(C(C)(C)C)C2)CC1	1331208956	OQUHNPIDIMRNAN-CQSZACIVSA-N	425.530	1.363	50	20	IDGD	
C=C(Oc1ccccc1O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2	1778083051	CMJQXBPWQUUKKF-HGHGUNKESA-N	438.908	1.398	50	20	IDGD	
O=C(c1ccc2cncn2c1)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1778692351	KZRGUJDZQCPENA-PBHICJAKSA-N	425.258	1.468	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)COC(=O)C(F)(F)F)C2)C1	1778899093	ZKNMLYSRLRXLSZ-ZIAGYGMSSA-N	435.226	1.158	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCC1CCC1)C2	1779371314	OGYIAZSAMGMMKI-AUSIDOKSSA-N	443.548	1.393	50	20	IDGD	
CSc1ncccc1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1779838710	FAYBTLQEYMREOK-LRDDRELGSA-N	432.315	1.938	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)CSc3ncccn3)CCO2)C1	1781227218	IKEHNDXZBKLSKX-IRXDYDNUSA-N	433.361	1.635	50	20	IDGD	
COc1ccc(CC(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)cc1	1781328687	WJJZYVWUGNLHLN-AEFFLSMTSA-N	429.286	1.758	50	20	IDGD	
O=C(CCc1cccc(O)c1)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781333063	BFPUUAUKQJUPBU-SJLPKXTDSA-N	429.286	1.845	50	20	IDGD	
Cc1ccn(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](C)Br)C2)n1	1781996430	IYEZZFYGVSUWSD-HDMKZQKVSA-N	427.343	1.489	50	20	IDGD	
COCc1oncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)Br)C1	1781999101	PMJSIZZSGIYWFU-WBHUJUFNSA-N	444.326	1.732	50	20	IDGD	
C[C@@H](NC(=O)OC(C)(C)C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Cl)C2	1782083155	XMYJBMHYBLBGGE-VYGYDYRJSA-N	435.924	1.948	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3c[nH]c4cccc(OC)c34)C2)C1	1782375535	KKJSJJSNPGPFEJ-BTYIYWSLSA-N	435.908	1.874	50	20	IDGD	
O=C(/C=C/c1cnccn1)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Br)C2	1782619236	FFPBVWMNTMOCLJ-KHFHEFGLSA-N	441.301	1.694	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(OC)n(C)n3)CCO2)C1	1783351259	HFROLWZFHLHOKL-PXAZEXFGSA-N	429.315	1.046	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1783399850	JCIKXMSPWMRFEN-MLGOLLRUSA-N	438.294	1.032	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccnc(OCC(C)C)c3)CCO2)C1	1783876976	ZCMAEBBBLMKMRB-DYESRHJHSA-N	439.940	1.814	50	20	IDGD	
CCOc1ncc(Cl)cc1C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](Cl)COC)C2)C1	1783877647	MNMSQYMUTIDIME-HNAYVOBHSA-N	446.331	1.831	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cncc(C(F)(F)F)c3)CCO2)C1	1783878231	WSLRJDQVKFPEEB-RHSMWYFYSA-N	435.830	1.798	50	20	IDGD	
Cc1ccc(SCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]3C2)cc1	1784091846	DWKJPHCPKKRRHL-DKIMLUQUSA-N	426.966	1.667	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ncc(Cl)cn3)[C@H]2C1	1785818175	PVLKUGNHPRJMKO-IMIFBBOLSA-N	445.745	1.754	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3nccc4nc[nH]c34)[C@H]2C1	1787354833	JHZKUTCMRDPJPL-SWDXJLKVSA-N	440.331	1.788	50	20	IDGD	
CC[C@H](Br)C(=O)NC1(c2ccc(NC(=O)CC[C@@H](N)C(N)=O)cc2)CCC1	1788062397	ZJLGBBOHAVKLLI-LSDHHAIUSA-N	439.354	1.887	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4cccnn4c3)C[C@@H]21	1788763751	RZNVSCNGULRMBS-SNRMKQJTSA-N	430.581	1.779	50	20	IDGD	
CCOc1cnc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]3C2)cn1	1789868341	CRRJZZAPHNHVSF-VODUFIJXSA-N	445.347	1.705	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc(F)cn3)C[C@@H]21)[C@@H](F)Br	1789923111	YNNQUQOWTZHEMV-LOHUMSBYSA-N	432.265	1.433	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3ccc(F)cc3F)[C@H]2C1	1790979622	RIIDCYGENLQHAB-SCNOPHJPSA-N	430.879	1.741	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)COc3cccc(Cl)c3)C[C@@H]21	1791249658	OFIXLJUMWWPEPF-MGHWNKPDSA-N	445.343	1.952	50	20	IDGD	
Cc1cc(C)c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]3C2)c(C)c1	1791292203	FOEIHWXVBPIIAC-UFYCRDLUSA-N	444.576	1.578	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CSc3nc[nH]n3)[C@H]2C1	1791558719	DTPMYOFRWWSNPB-RVMXOQNASA-N	446.371	1.050	50	20	IDGD	
C[C@@H](C(=O)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1)n1cccn1	1791878989	NGHAPIYPPOUGHT-INIZCTEOSA-N	432.289	1.572	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1(C)COC1	1792691881	XZXXTTCKVONOID-XGUBFFRZSA-N	429.945	1.793	50	20	IDGD	
CC1CCN(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)CBr)C3)CC1	1793199831	PZXCBRXKTJFHDP-XLMAVXFVSA-N	430.387	1.339	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccc2ncccc2c1	1793621475	BTYSRKINXUBPIW-NYUBLWNDSA-N	431.920	1.621	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1(C)CCC1)C2	1793879861	QANCNHOBNBVIPH-FZKCQIBNSA-N	443.972	1.898	50	20	IDGD	
O=C(CCOc1ccccc1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2	1795119892	UUGUWDCZPCFWHP-RMHZUWNSSA-N	429.286	1.736	50	20	IDGD	
CS(=O)(=O)c1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CCBr)nc1	1795491185	XLVCAZNJUFVABQ-CLLJXQQHSA-N	444.351	1.522	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1ccc(F)c(F)c1)c1ccc(B(O)O)cc1	1795710838	JNLRKQDVSTUMEO-BCDXTJNWSA-N	428.244	1.139	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCc1ccc(OC)cc1F	1797255883	SKMLLIQMYSFARA-MQJTVSLUSA-N	442.915	1.610	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1c[nH]c2ncccc12	1797394543	DVIUCCKZSINIEU-BTTYYORXSA-N	433.472	1.127	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2cccnc2[nH]1	1797461103	XZDZOVXCJMDEJI-FQLMCAECSA-N	435.322	1.940	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)cc([N+](=O)[O-])c1	1799732703	KQDPMHUEMGLMNO-TYYYEBLRSA-N	446.287	1.740	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)c1c(Cl)ccc(Cl)c1O	1799733887	IWGMWVUTVXOPTC-NVVZYBJKSA-N	437.707	1.502	50	20	IDGD	
CCOc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](Br)CC)nn1	1800642623	SLYRNQUCOZGTOW-ZWUHOBOKSA-N	441.326	1.252	50	20	IDGD	
Cn1ncc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C(Cl)Cl)c1C(F)(F)F	1801016071	ZYOWASNKMZVWBJ-DIYOJNKTSA-N	429.226	1.446	50	20	IDGD	
O=C(/C=C/c1ccc([N+](=O)[O-])o1)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1	1803260190	NUNRIUGYCHRBML-LEHHUITDSA-N	448.863	1.902	50	20	IDGD	
O=C(CCc1ccc(F)nc1)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1	1804436317	DOZSXDVIESOOEQ-QKLQHJQFSA-N	434.899	1.854	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2cccc(=O)n2O)[C@@H]1c1cccnc1	1804949926	HLLXZCDKCUANTN-MPGHIAIKSA-N	434.880	1.054	50	20	IDGD	
N=C(N)SCCC(=O)NC[C@@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1	1807122240	OBOYSYCLZUWXJM-XJKSGUPXSA-N	442.383	1.889	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC2(CCCN(C(=O)/C=C/c3cccnc3)C2)CC1	1807166749	IDXVIMRSWQIYKX-SOFGYWHQSA-N	427.549	1.699	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)c3cccc4ccnn34)CC2)C1	1809973316	GZFUVIJHBWONQO-UHFFFAOYSA-N	446.316	1.173	50	20	IDGD	
Cn1cccc(C(=O)N2CC[C@@H](CNC(=O)CO[Si](C)(C)C)[C@@H]2c2cccnc2)c1=O	1810541959	WZTDPXZETFHQEO-PXNSSMCTSA-N	442.592	1.951	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)c1cc2cccnn2c1	1812187121	MMJBGEXKRVDNNJ-IPELMVKDSA-N	427.892	1.649	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)CCc2cnn(C)c2)[C@@H]1c1cccnc1	1813032902	ZBVDGEXZNDEDSQ-CMKODMSKSA-N	433.940	1.708	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)[C@H](C)Cn2ccnc2)[C@@H]1c1cccnc1	1813416860	JCCCFJRJYDIVST-YSHGAJCASA-N	433.940	1.874	50	20	IDGD	
C[C@@H](CBr)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2C[C@H](O)CN2)[nH]n1	1814784377	WVEJCGVRFZZSAA-IMIFBBOLSA-N	428.331	1.156	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)C23CC(F)(C2)C3)[nH]n1)c1ccc(B(O)O)cc1	1817470490	SJLGCHHCBWCHFI-ATIQYGATSA-N	426.257	1.288	50	20	IDGD	
Cc1cccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)n1	1817473246	NLAFVWYKWHFNIO-IBGZPJMESA-N	433.277	1.413	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)C2CN(C)C2)[nH]n1	1818114050	DZZVZEUCJVOSGG-PDERCVKFSA-N	440.508	1.097	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1)c1ncn(-c2ccccc2)n1	1818197989	UKQRKCXGVNOBNT-HOTGVXAUSA-N	443.895	1.896	50	20	IDGD	
C[C@H](Br)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCN2CCOCC2)[nH]n1	1822184833	WUWSDAZOCHSSGE-ZFWWWQNUSA-N	442.358	1.908	50	20	IDGD	
CCc1ccc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2ccc(B(O)O)cc2)CC3)cc1	1822287393	ITGPMVBADFKYLK-SFHVURJKSA-N	449.341	1.925	50	20	IDGD	
O=C(CC12CCCN1CCC2)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](O)CCl)CC2	1822749547	ZEVPEQUILBBOPF-GXTWGEPZSA-N	426.970	1.673	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CN1CCOC1=O)CC2	1822861401	ZJNJVRXMFLURLO-ABKXIKBNSA-N	435.333	1.744	50	20	IDGD	
N[C@H](C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1)c1ccccn1	1823002278	CCRZKUVMYGTUTI-JCOFBHIZSA-N	442.314	1.841	50	20	IDGD	
Cc1nc(CC(=O)N2CCCC[C@@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)cs1	1825202243	HYJWJJZTVQHTNQ-LJQANCHMSA-N	449.621	1.987	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1CCc2nc(NC(=O)CN3CCCCC3=O)sc2C1	1825864104	DWXPYVFZHYRPMW-CYBMUJFWSA-N	438.626	1.919	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(F)cn1)CC2	1826080700	UOOLFQRFOUNXSZ-GFCCVEGCSA-N	434.497	1.276	50	20	IDGD	
O=C(c1ccc(O)cn1)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827051395	WSOCMXDHACXDRK-OAQYLSRUSA-N	437.305	1.014	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CN2CCN(C)CC2)CC1	1828444729	YLBGBFFOUXWJPM-AEFFLSMTSA-N	443.430	1.637	50	20	IDGD	
Nc1n[nH]c(CCC(=O)N2CCCC[C@H]2C2CCN(C(=O)[C@@H](F)Br)CC2)n1	1828805281	SKAKSAMPPYNZGL-SWLSCSKDSA-N	445.337	1.630	50	20	IDGD	
O=C([C@H](O)CCl)N1CCC([C@H]2CCCCN2C(=O)/C=N/O[C@@H]2CCCCO2)CC1	1828971003	AGEMTEBFWGLUBT-GDDMNMOSSA-N	429.945	1.735	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(Cl)nc1)CCO2	1829508294	LKARCJIQSLXZAS-IBGZPJMESA-N	441.988	1.657	50	20	IDGD	
C=C[C@H](O)C(C)(C)C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](C)CBr)CCO2)C1	1830540818	TYBFJXSGRZXDJR-VCBZYWHSSA-N	447.370	1.047	50	20	IDGD	
O=C(Cc1ccc(F)cc1Cl)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1830726668	SOAGHUKZXKUCEJ-QFBILLFUSA-N	449.306	1.078	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc(N(C)C)o3)C2)C1	1831643938	LUZNFSHTRANTBS-IFXJQAMLSA-N	428.917	1.218	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc4ccnn34)C2)C1	1831654574	VISKYSAZRMKXLX-UWJYYQICSA-N	434.924	1.812	50	20	IDGD	
Cc1nn(C)c(C)c1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1	1831815401	JVFUQYXKZXIZSX-RBUKOAKNSA-N	447.363	1.343	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1	1831834520	DIXVKJRFDYSOHS-IRXDYDNUSA-N	430.977	1.233	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3cccnc3Cl)CCO2)C1	1832720721	OSGLGWXVGCJVMQ-KXBFYZLASA-N	430.332	1.751	50	20	IDGD	
Cc1ccc(CCC(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)s1	1832882290	LNKFWBVAZLJABF-QFBILLFUSA-N	430.954	1.045	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCC(N2CCC(NC(=O)c3csnn3)CC2)CC1	1833558592	QLQAZYKREVISHK-KRWDZBQOSA-N	434.393	1.960	50	20	IDGD	
C=C(C(=O)N1CCOC[C@@]2(CN(C(=O)CCBr)CCO2)C1)C(F)(F)F	1834824930	PGUHLRQJZLLFJK-CQSZACIVSA-N	429.233	1.346	50	20	IDGD	
COc1cnc(C(=O)N2CCC(N3CCC(NC(=O)[C@H](F)Cl)CC3)CC2)c(F)c1	1835078380	CGPPYFIEVCADLN-KRWDZBQOSA-N	430.883	1.949	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3nc[nH]c3[N+](=O)[O-])CC2)CC1	1838095100	NGNOLKTWBKILQG-AWEZNQCLSA-N	427.889	1.948	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(COC)c[nH]3)CCO2)C1	1838512955	UWRIRSGZFNWRRM-OXJNMPFZSA-N	427.929	1.639	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(F)c3)CCO2)C1	1838909217	RVDYGEZECQJQIW-LIRRHRJNSA-N	443.313	1.927	50	20	IDGD	
Cc1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)c1	1838940742	WVHIYHQQUWRFSX-YJBOKZPZSA-N	429.286	1.756	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)CC34CCCN3CCC4)CCO2)C1	1839117106	ZJTWWJZSBXJWIS-JOCHJYFZSA-N	442.000	1.726	50	20	IDGD	
Cc1c(F)cccc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839197272	OIJINGFHSHMOPW-QAPCUYQASA-N	447.276	1.895	50	20	IDGD	
Cc1cscc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2	1840032999	QFRIYVFIBZHKRO-CXAGYDPISA-N	431.352	1.910	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(F)c[nH]3)CCO2)C1	1840068345	ZBRFXWOLMHAZMH-GUYCJALGSA-N	432.290	1.397	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)C(Cl)(Cl)Cl)C2)C1	1840155436	BVGWYHPNAKSNMF-ZWNOBZJWSA-N	438.135	1.067	50	20	IDGD	
COc1c(Cl)cccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1	1840738317	CNXKGBIPCMRLQO-BEFAXECRSA-N	447.315	1.018	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1CCCSC1)CCO2	1840859849	AOBVXDGUPSTVLP-IIDMSEBBSA-N	449.411	1.617	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC12CN(C(=O)[C@@H](C)[C@@H]1SC(=N)NC1=O)C2	1841286725	WHRFCXZJXATOPO-VWYCJHECSA-N	431.356	1.023	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC2(CCCN2C(=O)[C@H](O)CNC(=O)OC(C)(C)C)C1	1841300147	ROUKWCIEFVSWFN-CHWSQXEVSA-N	448.358	1.249	50	20	IDGD	
O=C([C@@H](Br)Cc1ccccc1)N1CC2(CCCN2C(=O)c2cc(O)n[nH]2)C1	1842984699	KLBHYXGOLVFBFM-AWEZNQCLSA-N	433.306	1.939	50	20	IDGD	
Cc1nc(C(=O)N2CCCC23CN(C(=O)CCC(=O)NN(C)C)C3)c(C(F)(F)F)o1	1843392955	AZFYKXNPGDQOMN-UHFFFAOYSA-N	431.415	1.192	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@H]1[C@H]3CN(C(=O)OC(C)(C)C)C[C@H]31)C2	1846364838	MLRWUQXAZWMHGE-QXSJWSMHSA-N	441.956	1.557	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cc(-c3ccccc3)n[nH]2)cc(Cl)c1OCC(N)=O	10125080	ZGMGCDUYTQECPN-UHFFFAOYSA-N	443.847	1.678	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2cc(Br)cn2C)c2ccccc2c1=O	16270085	GYNDPIFVIYUSNY-UHFFFAOYSA-N	432.278	1.982	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H](c2ccccc2)n2cccn2)c1	109764028	JQMIANYJPMPTRR-SFHVURJKSA-N	427.486	1.184	50	20	IDGD	
CCOC(=O)C1=NN(c2ccccc2)[C@@H](C(=O)NNC(=O)COc2ccc(C#N)cc2)C1	111188153	LUFXYTUMEDFPDP-LJQANCHMSA-N	435.440	1.282	50	20	IDGD	
Cn1ccnc1[C@@H](NC(=O)NNC(=O)CNC(=O)c1cccs1)c1ccc(Cl)cc1	725871040	BQCFZOKVFPLXLU-INIZCTEOSA-N	446.920	1.985	50	20	IDGD	
O=C(CCN1C(=O)[C@H]2CCCC[C@@H]2C1=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	726867256	CBWKCHLVOAUZJJ-IRXDYDNUSA-N	434.518	1.136	50	20	IDGD	
O=C(NNC(=O)c1ccc2nccn2c1)c1cccc(S(=O)(=O)NCc2ccccc2)c1	727765508	IELSGFPPBSDDHR-UHFFFAOYSA-N	449.492	1.888	50	20	IDGD	
CCN(CC)C(=O)CCCC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	728716780	JXKBMOSTTMLIJP-UHFFFAOYSA-N	439.582	1.105	50	20	IDGD	
CCOc1ccc(NC(=O)CNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1	728961770	ORCWKKGQVUNLBB-UHFFFAOYSA-N	441.492	1.061	50	20	IDGD	
CC(C)OCCCn1c(NNC(=O)C[C@@H]2CCS(=O)(=O)C2)nc2ccccc2c1=O	729279853	RMEBZMZWHACFQX-HNNXBMFYSA-N	436.534	1.480	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)CCNS(=O)(=O)c2cccc(Cl)c2)cn1	729693104	JAZBPGQVFUFVQJ-UHFFFAOYSA-N	443.938	1.430	50	20	IDGD	
O=C(Cc1cc[nH]n1)NNC(=O)c1sccc1S(=O)(=O)N1CCc2ccccc2C1	730090430	ARAGQPWERAEMJY-UHFFFAOYSA-N	445.526	1.222	50	20	IDGD	
CC[C@H](C)C(=O)N1Cc2ccccc2C[C@@H]1C(=O)NNC(=O)COc1ccccc1O	730781227	IHSQJEVZVDBXSI-MAUKXSAKSA-N	425.485	1.918	50	20	IDGD	
COc1cc(OC)c(CCNC(=O)NNC(=O)Cc2nc3ccccc3n2C)c(OC)c1	731119438	RRRIQFLEMTVHPU-UHFFFAOYSA-N	441.488	1.715	50	20	IDGD	
C[S@@](=O)CCCNC(=O)/C(C#N)=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	732111964	BWQMYGQSFCWDBP-HTWYCSDMSA-N	447.948	1.871	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)[C@@H]1CCCN(C(=O)Nc2ccccc2)C1	734240345	OQKXVWSLUJNJGR-OAHLLOKOSA-N	448.524	1.786	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(N2C[C@@H](C(=O)NNc3cnccn3)CC2=O)cc1	734242756	YZVIJHVETGMVHN-AWEZNQCLSA-N	432.506	1.003	50	20	IDGD	
CCC(=O)N[C@H](CCSC)C(=O)NNc1ccccc1S(=O)(=O)NC(C)(C)C	734251122	ZXNVCAQWPGJNQS-CQSZACIVSA-N	430.596	1.854	50	20	IDGD	
O=P(CCN[C@@H]1CS(=O)(=O)C[C@H]1N1CCOCC1)(c1ccccc1)c1ccccc1	734837400	IAYRBGNQVWXUFM-FGZHOGPDSA-N	448.525	1.088	50	20	IDGD	
CCN(c1ccccc1)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cnn(C)c2)c1	735445452	VPZHCBHWLRJODF-UHFFFAOYSA-N	427.486	1.710	50	20	IDGD	
CCCCN1C(=O)CC[C@H](C(=O)NNC(=O)c2cnn(C)c2)[C@@H]1c1ccccc1OC	735445952	KVIBKLDOSAGDIT-PXNSSMCTSA-N	427.505	1.970	50	20	IDGD	
C[C@H]1Cc2cc(S(=O)(=O)NNC(=O)CNC(=O)c3cccs3)cc(Cl)c2O1	736062749	IGIUCWGDOMOYFI-VIFPVBQESA-N	429.907	1.464	50	20	IDGD	
CC[C@@H](C)[C@H](NC(=O)N1CCCC1)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	736075418	XYKAJAAILJWXPK-WBVHZDCISA-N	431.541	1.061	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2cccc(Br)c2)c2c1CCC2)C(=O)NC1CC1	741662495	OFSYFYBLBMLWML-UHFFFAOYSA-N	432.278	1.163	50	20	IDGD	
O=C(NNC(=O)c1cccc2ccccc12)NNC(=O)C1CCN(c2ncccn2)CC1	743589759	YCNSFJOXVDEIBS-UHFFFAOYSA-N	433.472	1.522	50	20	IDGD	
C[C@H]1Sc2ccc(C(=O)NNC(=O)Nc3ccc(S(C)(=O)=O)cc3)cc2NC1=O	743830492	WEFBMVBKTLXJIS-SNVBAGLBSA-N	434.499	1.989	50	20	IDGD	
Cc1nn(-c2ccccc2)c(C)c1C(=O)C(=O)OCC(=O)NNC(=O)c1cccc(C#N)c1	744523093	YVIPVTQMHKQHEX-UHFFFAOYSA-N	445.435	1.548	50	20	IDGD	
Cc1ccc(N2CC[C@H](NC(=O)NNc3ccc(S(=O)(=O)NC(C)C)cn3)C2=O)cc1	745851226	DNIULHOLQXMFFL-KRWDZBQOSA-N	446.533	1.508	50	20	IDGD	
Cc1cc(C)n2nc(C(=O)NNc3ccc(S(=O)(=O)Nc4nccs4)cc3)nc2n1	747944847	XYYFNUBUKRYYDD-UHFFFAOYSA-N	444.502	1.755	50	20	IDGD	
O=C(NCCCn1cncn1)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1	747981705	SLYGRHALGXGCQS-OAQYLSRUSA-N	433.516	1.626	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)NCCCN2CCN(c3ccncc3)CC2)cc1	748344326	UDIYPMSWXDYLIK-UHFFFAOYSA-N	440.548	1.566	50	20	IDGD	
Cn1cc(S(=O)(=O)N2CCOCC2)cc1C(=O)NNc1ccc(OC(F)F)cc1	748654606	XAHCHWBZVSSGBG-UHFFFAOYSA-N	430.433	1.404	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)NCCNC(=O)Cc3cccc(F)c3)n[nH]2)cc1	749014703	LXOADMRXDHMYRA-UHFFFAOYSA-N	438.463	1.827	50	20	IDGD	
O=C(NNC(=O)C1(C(=O)NC2CC2)CC1)c1ccccc1NS(=O)(=O)c1cccs1	749403257	HCIRPUBXSDWLDO-UHFFFAOYSA-N	448.526	1.369	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)NCC1CCN(CC(=O)NC(C)(C)C)CC1	751112180	UUGOOSGSCZYXCY-UHFFFAOYSA-N	433.553	1.195	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ccccc2OC)c(C)c([N+](=O)[O-])c1	753840382	JLZJWPKZVBUPCT-UHFFFAOYSA-N	430.373	1.098	50	20	IDGD	
NC(=O)[C@@H](c1ccc(Cl)cc1)N1CCN(CC(=O)NNC(=O)c2ccc(F)cc2)CC1	754236743	KDILZZFWYBNHJN-LJQANCHMSA-N	447.898	1.084	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)NCCN1C(=O)[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O	755262169	YSMOUWNMXQZQGT-KUDNYVPYSA-N	432.864	1.100	50	20	IDGD	
COC(=O)CCNC(=O)c1ccc(NC(=O)NNC(=O)Cc2c[nH]c3ccccc23)cc1	755603608	LLFUXTPBVSXSAV-UHFFFAOYSA-N	437.456	1.856	50	20	IDGD	
COCCOc1cc(NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)ccc1OC	755694798	FMLRGZVGUKPHGL-UHFFFAOYSA-N	441.444	1.434	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)Nc1ccccc1CN1C(=O)CCC1=O	756220126	CEFYVIMYNGMKKU-UHFFFAOYSA-N	441.400	1.476	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)Nc2cc(S(=O)(=O)N(C)C)ccc2F)cc1	756681418	AVJRZZILKKHQFL-UHFFFAOYSA-N	438.481	1.870	50	20	IDGD	
COc1ncnc(N(C)C)c1NC(=O)NNC(=O)c1cc(F)ccc1Br	757708733	KBNHYFSPFUMPSA-UHFFFAOYSA-N	427.234	1.919	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)c2cnc(OCc3ccccc3)cn2)c1	757835423	CUPVXARPVWVZTQ-UHFFFAOYSA-N	426.454	1.534	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)[C@@H](C)Sc1ccnc2cc(Cl)ccc12	758031654	XMEJIKRQZAAJQY-VHSXEESVSA-N	430.939	1.454	50	20	IDGD	
C=C[C@@H](CC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1ccccc1	758044594	XPOZMLAKPVBFIJ-KRWDZBQOSA-N	443.525	1.828	50	20	IDGD	
Cc1ccc(-c2nc(C(=O)NNC(=O)c3csc(N4CCOCC4)n3)cs2)n1C	758079707	QBDJGMMDQZUUAM-UHFFFAOYSA-N	432.531	1.825	50	20	IDGD	
O=C(NCC1(c2cccc(Cl)c2)CCOCC1)NNC(=O)C(=O)Nc1ccccn1	758710111	JGQNXQPORKSFFR-UHFFFAOYSA-N	431.880	1.752	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NCc2ccc(S(C)(=O)=O)c(Cl)c2)cc1	759390193	QYPDNBFEYOORCR-UHFFFAOYSA-N	425.894	1.961	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)[C@](C)(O)CN2C(=O)C(C)(C)c3ccccc32)cc1	760068051	YNKCBYTWDMWDQI-HSZRJFAPSA-N	425.485	1.597	50	20	IDGD	
CCO[C@@H]1C[C@@H](NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)[C@]12CCCO2	760141256	HKCMONULQSRVBQ-TXTKFYIRSA-N	445.564	1.256	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)[C@H](C)NS(=O)(=O)c1ccc(C#N)cc1	762349428	IMVDTALBWIDHBB-ZDUSSCGKSA-N	448.526	1.173	50	20	IDGD	
COC(=O)Nc1cc(C(=O)NNC(=O)CNC(=O)c2ccco2)cc(C(F)(F)F)c1	763324476	VVHLCFXTPOLARO-UHFFFAOYSA-N	428.323	1.668	50	20	IDGD	
O=C(NNC(=O)C1CCCC1)c1cc(C(=O)NNC(=O)C2CCCC2)cc([N+](=O)[O-])c1	763403914	NNGKUDCJOOXZNK-UHFFFAOYSA-N	431.449	1.497	50	20	IDGD	
CC(=O)Nc1cc(S(=O)(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)ccc1C	763439826	VLOZAKLDJDZCRI-UHFFFAOYSA-N	428.511	1.568	50	20	IDGD	
CN(C)CCCOc1ccc(NC(=O)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1	763471203	FPOLRUJNCOPQCY-UHFFFAOYSA-N	429.433	1.325	50	20	IDGD	
COC(=O)CCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2)cc1	763505314	UNOSCAMSGKHMKU-UHFFFAOYSA-N	446.847	1.033	50	20	IDGD	
Cc1cc(C(=O)N2CCOCC2)ccc1NC(=O)C(=O)NNC(=O)c1ccccc1F	763561971	QPVLFMRIQAJOOD-UHFFFAOYSA-N	428.420	1.006	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)Nc1ccc(OC2CCC2)c(F)c1	763574401	ANONWWHFKRKIEK-GOSISDBHSA-N	429.404	1.683	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1ccc(OCC(F)(F)F)nc1	763625773	YDQIGZNBRKUWRW-UHFFFAOYSA-N	436.350	1.379	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)C(=O)Nc1ccc(Cl)nc1	763695618	QXVRMUYPXXJJRD-UHFFFAOYSA-N	427.642	1.662	50	20	IDGD	
O=C(CN1CCCc2ccccc21)NNC(=O)C(=O)Nc1ccc(N2CCOC2=O)cc1	763729076	UGIALXQGEJETKQ-UHFFFAOYSA-N	437.456	1.182	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)C(=O)Nc1ccc(OCC(F)F)cc1	763804441	SNSJJLBCYCJJAP-UHFFFAOYSA-N	438.343	1.404	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(C)c(N3CCOC3=O)c2)cc1	763820722	NPNIZDDWMXXKKH-UHFFFAOYSA-N	426.429	1.425	50	20	IDGD	
CC[C@@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)cc1	763839331	JRULGJHMXFNWGV-CYBMUJFWSA-N	430.436	1.519	50	20	IDGD	
COc1ccc(Cn2nccc2NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)cc1	763842412	ZXFJBRVLIVXRPB-UHFFFAOYSA-N	441.419	1.244	50	20	IDGD	
COc1ccc(OC(F)F)c(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)c1	763865094	IDOFJHQVFLEZOS-SNVBAGLBSA-N	441.362	1.989	50	20	IDGD	
CC(C)C(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)c1	763865886	LXMFDOYNHNORER-ZDUSSCGKSA-N	430.436	1.974	50	20	IDGD	
CO[C@@H]1Cc2ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc3ccc(C(C)=O)cc3)cc2C1	763871151	DWHBXKKTCTXPHA-VBKZILBWSA-N	439.468	1.556	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)on2)cn1	764015962	BIDBJTNIWQPCJH-UHFFFAOYSA-N	425.401	1.162	50	20	IDGD	
CCOC(=O)c1cn(C)nc1NC(=O)C(=O)NNC(=O)c1cccc(C(F)(F)F)c1	764039820	ACLMSCWNBZTPDX-UHFFFAOYSA-N	427.339	1.015	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2OC)cc1	764041349	SDDIWHVYRGIRCV-UHFFFAOYSA-N	448.501	1.125	50	20	IDGD	
CC[C@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(Cl)c(S(=O)(=O)N2CCCCC2)c1	764081095	CTWGSXLBQINIMD-LBPRGKRZSA-N	444.941	1.647	50	20	IDGD	
COc1cc(C(=O)N(C)C)ccc1NC(=O)C(=O)NNC(=O)CCCc1ccccc1	764224414	QRSUZEWXCCKDRQ-UHFFFAOYSA-N	426.473	1.506	50	20	IDGD	
CNS(=O)(=O)c1cccc(NC(=O)C(=O)NNC(=O)CCCc2ccccc2)c1C	764224686	SZWUGXSMYATVIP-UHFFFAOYSA-N	432.502	1.012	50	20	IDGD	
O=C(CN1C(=O)[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)NNc1c(F)cc(C(=O)NC2CC2)cc1F	764329217	FHXSYPAZZXXHAW-DIRVTVSLSA-N	430.411	1.107	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2Sc2cccs2)cn1	764360218	USYIXENYHKNSRO-UHFFFAOYSA-N	446.470	1.941	50	20	IDGD	
O=C(NNC(=O)C(F)(F)Oc1ccccc1)C(=O)Nc1ccc(O[C@H]2CCOC2)cc1	764379304	BFWJAMUVGGJACN-INIZCTEOSA-N	435.383	1.612	50	20	IDGD	
COC(=O)N(C)c1ccc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)cc1	764379692	HQBCGFGFFCZQBG-UHFFFAOYSA-N	436.371	1.647	50	20	IDGD	
CNC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)ccc1Cl	764383247	ZCBWYPQROSTJCA-UHFFFAOYSA-N	446.876	1.551	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc4c(c3)NC(=O)CC4)n[nH]2)cc1C	764389159	YGEGMKBFBAMEMN-UHFFFAOYSA-N	446.467	1.978	50	20	IDGD	
COC(=O)Nc1cc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)ccc1F	764400744	GVJXJFXLDYSQDX-UHFFFAOYSA-N	436.421	1.588	50	20	IDGD	
Cc1nc(N2CCOCC2)ccc1NC(=O)C(=O)NNC(=O)c1ccc(Cl)cc1F	764411456	XFTSMWQKDCAMAI-UHFFFAOYSA-N	435.843	1.419	50	20	IDGD	
C[C@H](Cc1ccc(F)c(Br)c1)C(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1	765070413	IYJQDWQMKVUAEL-KOLCDFICSA-N	436.303	1.284	50	20	IDGD	
Cc1nnc(-c2ccccc2C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)o1	766656315	ZGOHWJBHYRWQBP-UHFFFAOYSA-N	448.483	1.264	50	20	IDGD	
COCCC(=O)N1CCC(NC(=O)NNC(=O)c2cccc(Br)c2)CC1	767960052	PBSRQXORARQILK-UHFFFAOYSA-N	427.299	1.421	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1ccc2ccccc2c1O	768292282	XVKKKKURPDZCJW-UHFFFAOYSA-N	432.480	1.764	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)N[C@H]3CCN(Cc4ccccc4)C3=O)nc21	770369340	YKYKOUKSEKLUIU-HNNXBMFYSA-N	438.492	1.714	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2nn(-c3ccccc3)cc2C)cc1OC	770613235	SHDHIWJMCWCZEN-UHFFFAOYSA-N	438.440	1.816	50	20	IDGD	
COC(=O)c1cn(CC(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)c2ccccc12	772193311	UMGPAUNGTNOLBB-UHFFFAOYSA-N	442.859	1.545	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)NCCN(C)S(=O)(=O)c1cccs1	772622385	CHBKVRJIWOTARK-UHFFFAOYSA-N	440.547	1.340	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)[C@H]1CCCC[C@H]1C(=O)N1CCCC1	772890088	VURVAJBRUCXACW-DLBZAZTESA-N	434.924	1.532	50	20	IDGD	
CCCCNS(=O)(=O)c1cccc(NC(=O)C(=O)NNc2ccccc2[N+](=O)[O-])c1	773651502	ZTXTZNPEYSRFJL-UHFFFAOYSA-N	435.462	1.755	50	20	IDGD	
N#Cc1ccc(NNC(=O)C(=O)Nc2cc(N3CCCS3(=O)=O)ccc2Cl)cc1	773699471	GKPHLAACRPICTQ-UHFFFAOYSA-N	433.877	1.833	50	20	IDGD	
NS(=O)(=O)c1ccc(N2CCOCC2)c(C(=O)NNc2ccc(C(F)(F)F)cn2)c1	775251034	FBYRCMUFTXJPPO-UHFFFAOYSA-N	445.423	1.341	50	20	IDGD	
CON(C)S(=O)(=O)c1ccc(NC(=O)NNc2cccc(S(C)(=O)=O)c2)cc1	776466011	KSWJKSOZTGEIIJ-UHFFFAOYSA-N	428.492	1.421	50	20	IDGD	
COc1cc(C(=O)CCC(=O)NNC(=O)Cc2cn3ccccc3n2)cc(OC)c1OC	776981610	VUXOCQLNMREJMV-UHFFFAOYSA-N	440.456	1.713	50	20	IDGD	
COc1nc(C)c(Br)cc1C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	777231023	NBSBNRQEPRKDCU-UHFFFAOYSA-N	432.238	1.212	50	20	IDGD	
Cc1c(C(=O)NNC(=O)CNC(=O)OC(C)(C)C)sc2nc3n(c(=O)c12)CCCCC3	778441040	OJSDNZMWOMQLRI-UHFFFAOYSA-N	449.533	1.779	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)NC[C@@H]1CCCN(Cc2cccs2)C1	778640007	LGMKGJSSXZXJFX-AWEZNQCLSA-N	425.555	1.815	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H](CC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)C1	779370220	AOPBNYHFHPHDLJ-AWEZNQCLSA-N	429.477	1.986	50	20	IDGD	
O=C(CN1CCN([C@H]2CCCN(Cc3ccccc3)C2=O)CC1)NNC(=O)c1ccccc1	780315223	PCNJEVCRTCSGIR-QFIPXVFZSA-N	449.555	1.256	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)c2cc(S(=O)(=O)N3CCOCC3)ccc2OC)c1	780791872	QLEGIVAYZYEZJD-UHFFFAOYSA-N	449.485	1.260	50	20	IDGD	
CCOC(C)(C)CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	780826977	WLCAAISHIIYMDY-UHFFFAOYSA-N	426.539	1.620	50	20	IDGD	
CC(C)S(=O)(=O)c1ccc(CC(=O)NNC(=O)Cc2nc3ccccc3n2C)cc1	781236252	QJPNQGARJRQVIP-UHFFFAOYSA-N	428.514	1.688	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)c1	781612828	AALBRZWJDMGUFO-UHFFFAOYSA-N	429.357	1.675	50	20	IDGD	
COC(=O)c1scc(C)c1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccc(C(C)=O)cc1	782120985	NSVXGXJNDOHVOT-LBPRGKRZSA-N	447.469	1.599	50	20	IDGD	
COC(=O)c1cc(Br)c(F)cc1NC(=O)C(=O)NNc1ncncc1Cl	782158617	GDWZJVBYJGSOAJ-UHFFFAOYSA-N	446.620	1.900	50	20	IDGD	
O=C1CN(c2ccc(NC(=O)C(=O)NNc3nc4ccccc4s3)cc2Cl)CCN1	782813873	PRVRCTJJGWJGBH-UHFFFAOYSA-N	444.904	1.968	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)C(=O)Nc1cc(Cl)ccc1F	782897286	MVBIPTMEVGDNPN-UHFFFAOYSA-N	427.845	1.172	50	20	IDGD	
CCN1CCN(S(=O)(=O)c2cccc(NC(=O)C(=O)NNc3cccc(F)c3)c2)CC1	783040072	XNVPMSJZOUZYSR-UHFFFAOYSA-N	449.508	1.234	50	20	IDGD	
COc1cccc(NNC(=O)C(=O)Nc2ccnn2[C@H]2CCN(Cc3ccccc3)C2)n1	784846566	TVTNKUUONKZNLK-KRWDZBQOSA-N	435.488	1.816	50	20	IDGD	
CCNC(=O)N(C)NC(=O)C(=O)Nc1ccc(C(=O)Nc2ccc(OCC)cc2)cc1	784915337	LXMAZLWYJYZIRZ-UHFFFAOYSA-N	427.461	1.969	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)C(=O)Nc1ccnn1-c1cccc(Cl)c1	785061122	SPKSYFJFYZZXIJ-UHFFFAOYSA-N	437.847	1.502	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1)[C@H](C)S(C)(=O)=O	788265458	LQNZKMDVTDDMIH-CABCVRRESA-N	441.513	1.765	50	20	IDGD	
C=CCNS(=O)(=O)c1cc(C(=O)NNc2nnc(-c3ccccn3)s2)ccc1F	788563435	CTRYXRRAIRLCLX-UHFFFAOYSA-N	434.478	1.960	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)NOC[C@H]2CCOC2)cc1	788573696	HKDZKKOPCVKGAM-HAKPAVFJSA-N	439.472	1.425	50	20	IDGD	
CC(C)(C)OC(=O)N1CC2(C[C@H]2C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)C1	789755371	ULWLQLOPZXAIHQ-INIZCTEOSA-N	436.534	1.827	50	20	IDGD	
Cc1nc(-c2ccccc2NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)no1	789813859	WYLZGZYKYXNGQL-YJBOKZPZSA-N	435.440	1.704	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	790063355	IFOIUEHBRYKPKA-UHFFFAOYSA-N	427.523	1.411	50	20	IDGD	
COC(=O)c1nc([C@H]2CCCN2CC(=O)NNC(=O)Cc2nc(C)cs2)sc1C	791613240	DHUIXHDIZBVWJE-GFCCVEGCSA-N	437.547	1.530	50	20	IDGD	
COc1cc(OC2CC2)ccc1C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	791615750	QDHGEQRLNFYWET-LJQANCHMSA-N	442.424	1.381	50	20	IDGD	
C[C@](O)(Cn1cc(C(F)(F)F)ccc1=O)C(=O)NNC(=O)c1ccc(Cl)cc1F	792212691	BXPDGSLRWYIFTO-INIZCTEOSA-N	435.761	1.872	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)c2cccc(C)n2)cc1S(=O)(=O)N1CCOCC1	794080534	TVWNDBILUROIKB-UHFFFAOYSA-N	432.502	1.048	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)NCCCNS(=O)(=O)c1ccccc1Cl	798492233	BECVCOCNEJOAEA-UHFFFAOYSA-N	442.900	1.721	50	20	IDGD	
N#Cc1cccc(-n2ccc(C(=O)NNC(=O)c3ccc(Cl)c(S(N)(=O)=O)c3)n2)c1	798834176	VDQKWYDQRCYBEK-UHFFFAOYSA-N	444.860	1.120	50	20	IDGD	
CCS(=O)(=O)N1CCC[C@@H](C(=O)NNC(=O)Nc2cc(OC)c(Cl)cc2OC)C1	802084115	OFKFKQGYRAYYBV-LLVKDONJSA-N	448.929	1.572	50	20	IDGD	
COc1cc(N)c(C(=O)OCC(=O)NNC(=O)c2ccc(C)cc2)cc1Br	803951859	QFYQHMBXAPDBBD-UHFFFAOYSA-N	436.262	1.966	50	20	IDGD	
O=C(NNC(=O)N1CC[C@]2(CCN(Cc3ccccc3)C2)C1)c1ccc(-n2cnnn2)cc1	804867389	AHLWLZWCUGYZJR-QHCPKHFHSA-N	446.515	1.615	50	20	IDGD	
Cc1cc(=O)c(C(=O)NNc2ccc(-n3ccnc3)nn2)nn1-c1ccccc1[N+](=O)[O-]	804950878	HFMNLAXOQXUFFE-UHFFFAOYSA-N	433.388	1.182	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)Nc2ccc(F)c(S(=O)(=O)N(C)C)c2)c1	806543601	CLTDTTUDHXLKLN-UHFFFAOYSA-N	440.453	1.560	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1cc(Br)ncc1Cl	806794148	XEUAXKIOUTYMJW-UHFFFAOYSA-N	439.701	1.965	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2nc(C3CCOCC3)cs2)cc1	806974202	YXDBNOWOXMUJAA-UHFFFAOYSA-N	429.458	1.074	50	20	IDGD	
CN(C)CCn1ncc(C(=O)NNC(=O)CNC(=O)OC(C)(C)C)c1-c1ccccc1	807206699	ZALKZMKFBDVWEW-UHFFFAOYSA-N	430.509	1.397	50	20	IDGD	
CC(C)(C)OC(=O)Cc1cccc(NC(=O)C(=O)NNc2ccc(-n3ccnc3)nn2)c1	807429631	SWRGHWWWRRULDF-UHFFFAOYSA-N	437.460	1.628	50	20	IDGD	
C[C@]1(NNC(=O)NCCc2c[nH]c3cccc(Br)c23)CCS(=O)(=O)C1	812514556	AOFYFDCYJHQXTE-INIZCTEOSA-N	429.340	1.854	50	20	IDGD	
CN(C)c1ccc(C2(C(=O)NNC(=O)c3ccc(Cl)c(S(N)(=O)=O)c3)CC2)cc1	814735873	GKMLXNIBAWCCGX-UHFFFAOYSA-N	436.921	1.546	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)C(=O)Nc2cc(F)cc(F)c2F)c2ccccc2c1=O	815566604	YYZQMVMUIOIGPJ-UHFFFAOYSA-N	447.373	1.794	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)c2cc(C)c(C)c(S(=O)(=O)N(C)C)c2)c1	825791384	IRPWUYBLCGAXRL-UHFFFAOYSA-N	434.518	1.435	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)c2cc(-c3ccco3)nc3c(C(N)=O)ncn23)cc1C	913081447	PRJUHAMRBFWLKP-UHFFFAOYSA-N	448.439	1.545	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2ccn(-c3ccc(F)cc3)n2)ccc1Cl	915188624	FAORVMOISXIHNT-UHFFFAOYSA-N	437.840	1.387	50	20	IDGD	
CC(=NNC(=O)CCN1CCN(c2ccccc2)CC1)c1cccc(S(N)(=O)=O)c1	915934837	JNJKYFCVWRNSRE-UHFFFAOYSA-N	429.546	1.387	50	20	IDGD	
O=C(NNS(=O)(=O)c1cccs1)c1cccc(S(=O)(=O)N2CCCCC2)c1	916107952	VDIXLCFNMVMHFK-UHFFFAOYSA-N	429.545	1.546	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2c(C)oc(C)c2S(N)(=O)=O)ccc1OC(C)C	916144805	NPMHPKGUULCOEX-UHFFFAOYSA-N	425.463	1.414	50	20	IDGD	
CCOc1ccc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)c3cn[nH]c3)cc2)cc1	916146335	AWJFUKADHPZXJE-UHFFFAOYSA-N	429.458	1.684	50	20	IDGD	
COC(=O)C[C@H]1c2cc(OC)c(OC)cc2CCN1CC(=O)NNC(=O)c1ccccc1	916148174	ZCUPIBWLDKFEII-SFHVURJKSA-N	441.484	1.627	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)NNC(=O)NCCCN1CCN(c2ncccn2)CC1	916267113	BSRLFXUBSZPOQR-UHFFFAOYSA-N	436.520	1.043	50	20	IDGD	
CC(=NNC(=O)c1nn(C)c(=O)c2ccccc12)c1ccc(O)c(CN2CCOCC2)c1	916316372	VDVUSTORZFVVQL-UHFFFAOYSA-N	435.484	1.625	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NC2CCN(C(=O)C(C)(C)C)CC2)cc(OC)c1OC	916375380	YATBORKZBFHYDX-UHFFFAOYSA-N	436.509	1.694	50	20	IDGD	
CCCS(=O)(=O)N1CCC(NC(=O)NNC(=O)COc2ccccc2CC)CC1	916383718	PEBFKNIIGRRRMA-UHFFFAOYSA-N	426.539	1.162	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@@H]2CCC[C@@H]32)cc1	916585278	WIVWIYMLVWFLRO-LZBKUMLDSA-N	434.562	1.771	50	20	IDGD	
CCOc1ccccc1C(=O)N1CCN(CC(=O)NNC(=O)c2cccc(Cl)c2)CC1	917138565	IRCAZXKPVUAZCD-UHFFFAOYSA-N	444.919	1.958	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)CN(C)C(=O)c2ccc(Br)o2)c1	917545342	AGOHJQVTNVDGTP-UHFFFAOYSA-N	438.278	1.957	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(F)cc1Br)c1ccc2c(c1)OCCO2	917731777	NMUSJCFPCYWKQB-UHFFFAOYSA-N	431.239	1.983	50	20	IDGD	
CCCC(=O)N1CCC[C@H](C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)C1	917903979	LWHDKECQGBEFFZ-IBGZPJMESA-N	429.565	1.385	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)Cc1c(C)[nH]c(-c2ccncc2)nc1=O	917976530	JNTVOCHXXKAOSL-UHFFFAOYSA-N	427.848	1.806	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)NCc1cccc(CN2CCOCC2)c1	918223425	HBNUVNNYBXEZBH-MRXNPFEDSA-N	430.480	1.956	50	20	IDGD	
Cc1nccn1-c1ncccc1CNC(=O)NNc1ccc(S(=O)(=O)NC(C)C)cn1	919783431	CNIVHOLMSBDAHP-UHFFFAOYSA-N	444.521	1.484	50	20	IDGD	
O=C(CCCNC(=O)c1ccc(F)cc1)NNC(=O)c1nn(-c2ccccc2)cc1O	919809159	AVAYXJNTIRUPNI-UHFFFAOYSA-N	425.420	1.688	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)NCc1cccc(NC(=O)[C@@H]2CCCO2)c1	920238730	ZSZPPGDYWHEYID-IBGZPJMESA-N	442.472	1.722	50	20	IDGD	
CCNC(=O)CN1CCCN(C(=O)/C(C#N)=C/c2cc(C)n([C@H](C)COC)c2C)CC1	920455979	KKMSHZFLDLAZPN-KOMLCTQHSA-N	429.565	1.890	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NC2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)cc1	1115854618	KGEOJCHMHLAKEW-UHFFFAOYSA-N	446.529	1.801	50	20	IDGD	
NC(=O)c1ccccc1N1CC[C@@H](NC(=O)NNC(=O)c2cncn2-c2ccccc2)C1	1321757654	YPMFGCMTEUREHX-OAHLLOKOSA-N	433.472	1.194	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cn4cccnc4n3)C2)C1	1778480787	RGQQMWBSKTZUFX-SCLBCKFNSA-N	436.310	1.346	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Cl)C2)[C@H]1ON=C(c2ccccc2)O1	1779260813	RPXGRQCGMCIUCX-HRYATBACSA-N	439.871	1.769	50	20	IDGD	
C=C(C)CC(C)(C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2	1779510582	GUUJGNFRIAKVFA-HYBUGGRVSA-N	442.365	1.486	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(CN(C(=O)c3ccon3)CCO2)C1	1780097396	YTCUHRSTVSNEKS-FQEVSTJZSA-N	444.400	1.265	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnnc(Cl)c1)C2)[C@@H](F)Br	1780770885	ICXPMIZMLMUKCP-AXAPSJFSSA-N	449.708	1.948	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)C1(O)CCC1)C2	1781995859	XRVVZNVLOHEMTO-OIPACUDHSA-N	431.371	1.835	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1n[nH]c3ccccc13)C2	1782175646	OFQITOBVXSCFRN-QLVMHMETSA-N	434.924	1.944	50	20	IDGD	
Cc1cccn2ncc(C(=O)N3CC[C@]4(C3)CN(C(=O)[C@@H](F)Br)CCO4)c12	1782522166	UUPODZOWAGSLOW-QAPCUYQASA-N	439.285	1.777	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@@]2(C1)CN(C(=O)c1ncccn1)CCO2	1782863456	BLWJWJRFDFHKHN-JLOHOZFJSA-N	439.422	1.805	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(N(C)C)cn3)CCO2)C1	1783532301	LROHLLPWDAXCQM-SCLBCKFNSA-N	425.327	1.375	50	20	IDGD	
COc1ccc([C@H](O)C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)C(C)(C)CCl)[C@H]3C2)cc1	1783847221	HKBZYYTXKAGNQH-WNHJNPCNSA-N	438.952	1.973	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(NC(=O)C4CC4)cc3)CCO2)C1	1783880062	FNTLPRAWOKJMRH-GCJKJVERSA-N	449.935	1.732	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1ccoc1C(F)(F)F)CCO2	1783935602	WHZJNBDHJFBHOM-SFHVURJKSA-N	446.426	1.115	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(F)(F)C(F)(F)C(=O)O)[C@H]2C1	1784912009	CILAMLNJNYJQGK-BJDJZHNGSA-N	446.825	1.729	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21)c1cncn1-c1ccncc1	1785754577	RLCSVJDMTGLSQQ-NOLJZWGESA-N	438.315	1.664	50	20	IDGD	
Cn1ccc(=O)cc1C(=O)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1	1788142368	UNHXRHWUBGZFMO-UHFFFAOYSA-N	445.284	1.127	50	20	IDGD	
Cc1nnc(CC(=O)Nc2ccc(C3(NC(=O)CCC(=O)NN(C)C)CCC3)cc2)s1	1788230246	WKAVJBDVYCBWHL-UHFFFAOYSA-N	444.561	1.896	50	20	IDGD	
C=C[C@H](O)C(C)(C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](Br)CC)C[C@@H]21	1788575738	BTUPOGGDIACZNY-QXKUPLGCSA-N	431.371	1.713	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc4cc(C)ccn4c3=O)C[C@@H]21	1789859461	CXVPMXKHBIINOG-DKIMLUQUSA-N	446.935	1.614	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccccc3C(N)=O)C[C@@H]21	1789872835	XKEFQKPAKVUSKJ-NADSTKFWSA-N	442.343	1.615	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnoc3COC)C[C@@H]21	1790961874	RVYHFWXYTKXJIJ-MHEUCROKSA-N	444.326	1.588	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCN3CCCC3)C[C@@H]21	1790962572	JEQBZRJQWSSMSW-NXOAAHMSSA-N	430.387	1.626	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4ccccn4n3)C[C@@H]21	1791058114	ZAEGTJLHSZOKBX-HPZZRFSDSA-N	435.322	1.711	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21	1791061001	NXSOYCIZHSURPZ-QHZLYTNSSA-N	430.112	1.440	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4ccoc4c3)C[C@@H]21	1791293716	DGXQNVZJKXNCMR-BJLQDIEVSA-N	442.516	1.399	50	20	IDGD	
Cc1nc2ncccn2c1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]2C1	1791294592	CMVWMNDHRMWGAW-AVGNSLFASA-N	426.304	1.435	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)c1ccc(-c2ncc[nH]2)cc1	1792032996	AKRQWWKJZSSTRA-XSLAGTTESA-N	432.908	1.270	50	20	IDGD	
CCc1cnc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)CBr)s1	1792870963	NOGDDDMMKZCDSP-NRWUCQMLSA-N	430.368	1.940	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3ncccc3[nH]1)C2	1792873502	BIBPDRHEEJZPNF-KOFHJDLBSA-N	435.322	1.797	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)NC(=O)OC(C)(C)C)C2	1793444817	DMDCPDAGKAVOTM-QMHWVQJVSA-N	431.961	1.897	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CNC(=O)O1	1793651643	ZTAFSBLWHUAEAQ-QLEUGIHGSA-N	430.411	1.618	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)COc1ccc(F)cc1	1795198765	WXBKTISZMDGHMA-JRATXPSKSA-N	429.286	1.578	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCc1ccccc1Cl)c1cccc(B(O)O)c1	1795737904	HDAJWWKGADMRME-ACDBMABISA-N	440.736	1.904	50	20	IDGD	
CN(C)c1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](O)CCl)C3)c2ccccc12	1796946971	GAKNNSVTQCWRBR-YQMDMEMYSA-N	445.947	1.709	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1=NO[C@@H](c2ccccc2)C1	1797179193	NWFPQBFDAGVKOQ-CTRAYCPCSA-N	435.908	1.347	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(-c2ccccn2)[nH]n1	1798855309	CJJCKWMMWGWKJY-MUJYYYPQSA-N	439.520	1.097	50	20	IDGD	
O=C(CCCn1c(O)nc2ccccc21)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2	1799062382	NJPDSRSYBRWSPO-GGNLRSJOSA-N	438.887	1.646	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(CO)c(F)c1)C2	1799282016	HOAHEJHQFCEJSK-QHHYFVSCSA-N	433.307	1.758	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COc1ccc(F)cc1)C2)[C@H](F)Br	1799347707	PCWLIMIZUBDING-OJXGSEEGSA-N	433.249	1.485	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Br)c1	1799352487	ZEXWLJALJWSYHX-OCVGTWLNSA-N	442.285	1.539	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)ccc1O	1799789383	UYEIUKXJQHCYRK-OVZMXSCWSA-N	427.295	1.332	50	20	IDGD	
CN1CCN(C2(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)CCBr)C4)CC2)CC1	1799977157	LDFLUESURREPBD-MUJYYYPQSA-N	427.387	1.190	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)no1)C2	1800333447	VAWKIIVCJWFXRZ-RMRMTIIFSA-N	444.394	1.469	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3nn(C)cc3c1)C2	1800762091	NKOUQGPBGYWQJL-RMIITELYSA-N	435.322	1.560	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H]1C[C@@]13C(=O)Nc1ccccc13)C2	1802284949	STBHIMIYBYLGBA-BIHDVVPSSA-N	431.920	1.788	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)c1cc(Cl)cnc1O	1802331702	YQQZDQDCRNFOEH-APHBMKBZSA-N	439.299	1.755	50	20	IDGD	
CC(C)(C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnccc1C(=O)NN)C2)c1ccccn1	1802723520	TZQRHNPXRQPPFC-MUJYYYPQSA-N	436.516	1.310	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cccc3nc[nH]c23)[C@H]1c1cccnc1)[C@@H](O)CCl	1803139857	XFVVZQKSKMSYJG-FNHZYXHNSA-N	427.892	1.877	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)c2ccccn2)[C@H]1c1cccnc1	1805446967	SPFWJPRKGJRCLG-OXJNMPFZSA-N	445.483	1.109	50	20	IDGD	
Cc1ccc(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)nc1	1805870760	XVNVMUCZLPTDIJ-SIKLNZKXSA-N	444.300	1.098	50	20	IDGD	
O=C(CCBr)NC[C@@H]1CCN(C(=O)[C@H]2CCNC(=O)C2)[C@H]1c1cccnc1	1806346249	DACLXLKRMYTHFQ-YEWWUXTCSA-N	437.338	1.399	50	20	IDGD	
CSCC[C@H](O)C(=O)N1CC[C@@H](CNC(=O)CCBr)[C@H]1c1cccnc1	1806346466	HODPLHFCMNGDGF-YQQAZPJKSA-N	444.395	1.986	50	20	IDGD	
N[C@H](CC(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)c1cccnc1	1807260441	OPHPYCQBEJUZQP-JRBPQWBISA-N	431.924	1.172	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccnnc2O)[C@@H]1c1cccnc1)[C@@H](F)Br	1808675677	DDAWHGFNWDNQPO-IACUBPJLSA-N	438.257	1.587	50	20	IDGD	
Cc1cc(C(=O)NCC(=O)NC[C@@H]2CCN(C(=O)[C@@H](F)Cl)[C@@H]2c2cccnc2)no1	1810375531	IZFYCEREUVMKBO-IAOVAPTHSA-N	437.859	1.348	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1CCN(C(=O)c2cnc(O)nc2O)[C@@H]1c1cccnc1	1810540583	FQNDBKLXGYQFSA-WMLDXEAASA-N	445.552	1.454	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H](CNC(=O)CO[Si](C)(C)C)[C@@H]1c1cccnc1)n1ccnn1	1810543912	GQVFSWNFGJQIDO-SUMDDJOVSA-N	430.585	1.792	50	20	IDGD	
Cc1occc1C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1813069853	CXFLSBCZFZMLGE-UTKZUKDTSA-N	427.505	1.676	50	20	IDGD	
O=C(Cc1ccc2c(c1)OCO2)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](O)CCl)CC2	1814133476	QAGOOXNFTOYJOV-WCQYABFASA-N	437.905	1.626	50	20	IDGD	
Nc1c(C(=O)N2CCCC[C@H]2c2cc(NC(=O)[C@@H](O)CCl)n[nH]2)sc2nccnc12	1814870258	MSVQPFLJROCDNK-QWRGUYRKSA-N	449.924	1.902	50	20	IDGD	
COC[C@@H](C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[nH]n1	1815307035	YFSZOTIYGCMPLY-AZVIPXTKSA-N	443.508	1.818	50	20	IDGD	
COC[C@H](C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[nH]n1	1815307040	YFSZOTIYGCMPLY-REQSCQPASA-N	443.508	1.818	50	20	IDGD	
C[C@H](CS(C)(=O)=O)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCBr)n[nH]1	1816781180	FXOQELDWFOMJBZ-DGCLKSJQSA-N	449.371	1.868	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CS(C)(=O)=O)n[nH]1	1817054041	WPXVDUSMTQQRAP-CMPLNLGQSA-N	435.344	1.477	50	20	IDGD	
Cc1ccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)c(O)c1	1817474607	CTHOXHJPQKCTBL-IBGZPJMESA-N	448.288	1.723	50	20	IDGD	
O=C(CCc1ccc[nH]1)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1817529736	JVUONXJSSMCLFA-IBGZPJMESA-N	435.293	1.356	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(O)ccc2F)n[nH]1	1821081153	SFSPICZAWSRFCT-KRWDZBQOSA-N	446.483	1.933	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3cc4cccnn4n3)sc2C1	1821168472	MYSLMWCMSHGAJT-CMPLNLGQSA-N	434.909	1.665	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)CCBr)[nH]n1)[C@@H]1CCCS1(=O)=O	1821830766	AVJXRNIISZMNHT-STQMWFEESA-N	447.355	1.764	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)C23CC(C(=O)OC)(C2)C3)n[nH]1	1822148999	XXUYAHCHYGCXHF-KQQHOMHOSA-N	438.912	1.999	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)C(Cl)Cl	1822417906	JDLJMLLVGPHHIN-CYBMUJFWSA-N	425.081	1.199	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](C)Br)sc2C1	1825641355	NVLBLHWDZAWTGW-FXPVBKGRSA-N	431.356	1.705	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnc3[nH]ncc3c1)CC2	1825999771	CLSWFMHFOSCPKX-NEPJUHHUSA-N	434.909	1.894	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc3n(n1)CCCO3)CC2	1826000397	SMKBXQUODFWKFV-QWRGUYRKSA-N	439.925	1.602	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(F)s1)CC2	1826080358	FLSJPCXREMUAFT-JTQLQIEISA-N	439.538	1.943	50	20	IDGD	
CC(=O)Nc1ccccc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)CCl)CC2	1827717806	AAWSKVMQFDRKSA-ABAIWWIYSA-N	436.921	1.927	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4cccnc4n3)C2)C1	1830361775	CFOUGEDJOBCASR-QFIPXVFZSA-N	446.935	1.965	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)COC3CCCCC3)CCO2)C1	1830383746	HRPZQZILYFYCNQ-DNVCBOLYSA-N	447.370	1.576	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3sccc3F)C2)C1	1830535287	LQWOILOEYXOOSV-YVEFUNNKSA-N	449.342	1.988	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CC[C@H](O)CC3)C2)C1	1830544034	LQNIMXJGTQNXNA-FPXQBCRKSA-N	447.370	1.025	50	20	IDGD	
CC(C)(C)c1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)s1	1830727834	HQVAJDHUQUCNRF-JLTOFOAXSA-N	444.981	1.715	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)COc2cccnc2)CC1	1831870821	HLZGTVCCFRZQNY-FQEVSTJZSA-N	445.564	1.453	50	20	IDGD	
C[C@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)c3cncn3C)CC2)CC1	1833262553	VCUDHRUCHGBHGK-CQSZACIVSA-N	440.386	1.636	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3ccnc(C(F)F)c3)CC2)CC1)[C@H](O)CCl	1833307994	GKVDLRIIAIOQDP-QGZVFWFLSA-N	444.910	1.804	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)CCc3ccc(F)cc3)CC2)CC1)[C@@H](O)CCl	1833313010	QEHQXVQLRKAOKW-FQEVSTJZSA-N	439.959	1.930	50	20	IDGD	
Cc1cnc(C(=O)N2CCOC[C@]3(CN(C(=O)CCBr)CCO3)C2)s1	1834819449	SBEWVWHOMOWQDP-INIZCTEOSA-N	432.340	1.307	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)C3(C(F)(F)F)CC3)C2)C1	1834821683	UCOFMTUNYOUCQB-CQSZACIVSA-N	443.260	1.570	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)[C@H]3C[C@@]3(F)Cl)C2)C1	1834826182	FPQAJXAWCZXQJR-DFBGVHRSSA-N	427.698	1.152	50	20	IDGD	
CC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)[C@H](C)n3ccccc3=O)CC2)CC1	1836396875	ODEWGYGPCKYJCN-LPHOPBHVSA-N	436.984	1.998	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)N1CCC(OC2CCN(C(=O)C(C)(C)CCl)CC2)CC1	1836623618	XOOGCMIIWJMIHR-INIZCTEOSA-N	430.977	1.697	50	20	IDGD	
Cc1nn(C)c(C)c1C(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836714139	QXGXGWJKCUBPPL-QGZVFWFLSA-N	426.945	1.249	50	20	IDGD	
N[C@H](CC(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1)c1cccnc1	1836716889	WKUPUXYIDKEGTO-RTBURBONSA-N	438.956	1.070	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)CCBr)C2)C1	1837712048	CKYYSGDGCWGKJV-INIZCTEOSA-N	437.407	1.079	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(C)nc3O)CCO2)C1	1838667381	DEVJEXJGLXFCPX-OXJNMPFZSA-N	425.913	1.573	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)n(C(F)F)n1	1838716589	WIQNMLGAUIHOPL-MRXNPFEDSA-N	441.262	1.460	50	20	IDGD	
O=C(CC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1)Nc1ccc(F)cc1	1839029540	RXVCELZROAPRRZ-HKUYNNGSSA-N	445.850	1.145	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(Cl)cnc3O)C2)C1	1839141892	WOKLVWMVVNATPJ-KBXCAEBGSA-N	432.304	1.528	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CSCc3[nH]cnc3C)C2)C1	1839145364	FPBKBCBXYVFWQN-HNAYVOBHSA-N	444.985	1.425	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4c(c3)C(=O)CC4)C2)C1	1839148494	ZKLDPDNRWYEOIH-GCJKJVERSA-N	434.920	1.903	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(NC(C)=O)cc3)C2)C1	1839148648	FIYBCHHYVQJVOH-WIYYLYMNSA-N	437.924	1.732	50	20	IDGD	
Cc1cccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)n1	1839151108	IGIHWOXTVJWAJR-MOPGFXCFSA-N	430.332	1.696	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)COc3ccccc3)C2)C1	1839151115	ILNSJNWDKRPFCY-WOJBJXKFSA-N	445.343	1.758	50	20	IDGD	
O=C(c1cc(Cl)c(O)cc1O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1839252080	PLPSTDOAGUOWFY-PBHICJAKSA-N	437.251	1.356	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(F)c3[N+](=O)[O-])CCO2)C1	1839356701	SPCVXYVSPZUIDV-AUUYWEPGSA-N	443.859	1.821	50	20	IDGD	
C[C@@H](Cc1ccncc1)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1839656676	YKQVNCADAZEJJB-JTSKRJEESA-N	437.968	1.982	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H](C)CN(CC)CC)CCO2)C1	1839675074	QOFPGOWAROWHDZ-BBTUJRGHSA-N	432.005	1.828	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(C)nc3)C2)C1	1839963595	PQALPYDHFZGBIU-APWZRJJASA-N	440.338	1.634	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(F)cn3C)C2)C1	1839964618	XKHAIQHQUGWXDT-KDOFPFPSSA-N	446.317	1.408	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccc(F)cc3)C2)C1	1840032109	NZSFNGNJLTXAGQ-AUUYWEPGSA-N	443.313	1.608	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)cn1C	1840032803	KNQQDFFPTFEATF-KBXCAEBGSA-N	428.327	1.187	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(F)c(F)c3)C2)C1	1840154310	RWMDDWXCKVGGGZ-IFXJQAMLSA-N	432.851	1.289	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(N(C)C)cc3)C2)C1	1840154532	YNTAEULEQLDOCD-WIYYLYMNSA-N	439.940	1.076	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(F)cc3C)C2)C1	1840156910	XXQJGGONHXQUNG-FXAWDEMLSA-N	428.888	1.458	50	20	IDGD	
CCCc1onc(C)c1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840187705	RICGBWAILKHMAO-GOSISDBHSA-N	434.320	1.809	50	20	IDGD	
O=C(c1cn2cc(C(F)(F)F)ccc2n1)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1	1841350898	AOPQBOPGNZNRFX-CYBMUJFWSA-N	430.814	1.770	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCCC12CN(C(=O)c1csc(N)n1)C2	1841924442	MMKJMXUCLUYUPL-NSHDSACASA-N	443.957	1.674	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC12CN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2	1846180006	KHVPBAJQVJFFOR-DUMNWFOQSA-N	425.279	1.803	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@]1(NC(=O)OC(C)(C)C)CCOC1)C2	1846364049	USCACJSZSWGCQA-VLIAUNLRSA-N	445.944	1.127	50	20	IDGD	
O=C(c1cn2c(Br)cccc2n1)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl	1847564371	YPYCDZVOBRFXSQ-AVGNSLFASA-N	441.713	1.512	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H]1C[C@H]2C[C@H]2N1C(=O)OC(C)(C)C	1847574237	SOMLPQKCCAMGMA-KOWPAETKSA-N	441.956	1.840	50	20	IDGD	
COc1ccc(CC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2cccc(B(O)O)c2)c(Cl)c1	1848086248	IYIRKHDJYPRXCP-PMACEKPBSA-N	442.708	1.087	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1	15886355	JNUZQLVOQFMOPW-UHFFFAOYSA-N	431.514	1.928	50	20	IDGD	
Cn1cc(Br)cc1C(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	16164813	MMUHXIRDBJLSKF-UHFFFAOYSA-N	425.195	1.314	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc(F)c(F)c1)NNC(=O)c1ccc2ccccc2n1	27686312	CVLVMFLTQCSAMX-UHFFFAOYSA-N	434.424	1.643	50	20	IDGD	
COc1cccc2c1OCC[C@H]2NC(=O)NNC(=O)c1sc(N2CCOCC2)nc1C	725874050	FUMZKDKPKHHJRN-CQSZACIVSA-N	447.517	1.765	50	20	IDGD	
CC(=O)N(CCC(=O)NNC(=O)c1sc(N2CCOCC2)nc1C)Cc1ccccc1	726157806	UXTMEZHGMIXDRA-UHFFFAOYSA-N	445.545	1.488	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)[C@@H](C)N2C(=O)NC3(CCCC3)C2=O)cc1	726498721	ZBOAWJSVPHQOHS-ZIAGYGMSSA-N	432.477	1.253	50	20	IDGD	
CC(C)c1nc(CCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cs1	726717282	PZVYXXVQTXQBIY-UHFFFAOYSA-N	439.563	1.704	50	20	IDGD	
O=C(NNC(=S)NCC1CCC1)C1CCN(C2=NS(=O)(=O)c3ccccc32)CC1	727867264	ZDYMSXVZEUCHND-UHFFFAOYSA-N	435.575	1.143	50	20	IDGD	
CC1CCN(S(=O)(=O)c2ccc(C(=O)N([C@@H]3CCS(=O)(=O)C3)N(C)C)cc2)CC1	728180808	YMSYANVOZLMCBH-QGZVFWFLSA-N	443.591	1.213	50	20	IDGD	
C[C@@H](OC[C@H]1CCCCO1)C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	728214567	AJLSAQNGKXBTQY-SJLPKXTDSA-N	440.566	1.040	50	20	IDGD	
CC(C)(C)CC(=O)NNC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1	728606789	PVTCEBLGUMCWLY-ZDUSSCGKSA-N	426.495	1.579	50	20	IDGD	
O=C(NNC(=O)N1CCC([C@H](O)c2ccccc2)CC1)C1CCN(c2ncccn2)CC1	728961260	DWYRKVREJGZYFQ-HXUWFJFHSA-N	438.532	1.879	50	20	IDGD	
CCCCN1C(=O)CC[C@H](C(=O)NNC(=O)Cc2cc[nH]n2)[C@@H]1c1ccccc1OC	730102463	FCVFKFPHGPIOOC-UWJYYQICSA-N	427.505	1.888	50	20	IDGD	
C[C@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1ccccc1F	731322825	PWYHEQABFABUSF-AWEZNQCLSA-N	435.477	1.411	50	20	IDGD	
NC(=O)c1cc(C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)nn1-c1ccccc1	732286306	FBFULTADRAFKKT-UHFFFAOYSA-N	435.412	1.724	50	20	IDGD	
O=C(NNC(=O)[C@H]1CC(=O)N(c2ccc3c(c2)OCCO3)C1)c1cnn(-c2ccccc2)c1	733110066	PVYDGIZDUCNKLA-HNNXBMFYSA-N	447.451	1.458	50	20	IDGD	
Cn1c(NNC(=O)[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)nc2ccccc2c1=O	733262452	YXAXRJLFUNIKNR-ZDUSSCGKSA-N	442.457	1.651	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)NC[C@H]1CCCN1Cc1ccccc1	734218439	SQLAUVJIBIGLMU-QGZVFWFLSA-N	427.461	1.969	50	20	IDGD	
CC(C)c1[nH]nc(C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)c1Br	734241857	WQPWMMNXPXTIMF-UHFFFAOYSA-N	433.307	1.764	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)CCC(=O)N1CCc2sccc2C1	734241900	MIOYFWGMTQZGHC-UHFFFAOYSA-N	439.538	1.268	50	20	IDGD	
Cc1cc(F)ccc1S(=O)(=O)Nc1ccc(C(=O)NNC(=O)c2cnn(C)c2)cc1	735470761	HNUWZNZYSXEWRD-UHFFFAOYSA-N	431.449	1.743	50	20	IDGD	
COC(=O)c1cc(OC(=O)c2ccc3c(c2)CCN3C(=O)CNC(C)=O)ccc1[N+](=O)[O-]	735636787	OGBKEMWRVUSFCN-UHFFFAOYSA-N	441.396	1.626	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)CCc2nc(-c3ncccn3)no2)cc1C	736816578	QIQZVSGVJQHSPE-UHFFFAOYSA-N	444.473	1.396	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)N[C@H](C)[C@H]2CN(Cc3ccccc3)CCO2)c1	741277702	CPAGXCRWNYCIJU-IIBYNOLFSA-N	442.516	1.937	50	20	IDGD	
CCc1nc(C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)nn1-c1ccccc1F	741536271	WCMPXCPSEXSPRF-UHFFFAOYSA-N	431.449	1.447	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)Cn2c(-c3cccc(Br)c3)noc2=O)cc1	742452295	XSNJTVRGZSSBOJ-UHFFFAOYSA-N	442.229	1.599	50	20	IDGD	
CC(C)c1nn([C@@H]2CCS(=O)(=O)C2)cc1C(=O)NNC(=O)c1c[nH]c2ccccc12	742487411	PVCGINVGMNCNLS-CYBMUJFWSA-N	429.502	1.922	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CCN2C[C@H](C)O[C@@H](C)C2)cc(OC)c1OC(F)F	743289510	XJDPMKKJVQLSLZ-RYUDHWBXSA-N	431.436	1.566	50	20	IDGD	
CCCS(=O)(=O)c1ccccc1C(=O)OCC(=O)NNC(=O)c1ccc(C#N)cc1	744730908	CMSVEDNVVNLJRK-UHFFFAOYSA-N	429.454	1.360	50	20	IDGD	
Cc1ccc(C)n1-c1nc(CC(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)cs1	744764362	PWYUFOBGUMALDY-UHFFFAOYSA-N	437.481	1.969	50	20	IDGD	
CC(C)CO[C@H](C)c1noc(CN(C)C(=O)NNC(=O)CNC(=O)c2cccs2)n1	745998008	FDPVWSFTZOCZNE-GFCCVEGCSA-N	438.510	1.467	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CN(Cc2nc(O)c3ccccc3n2)CCO1)NC1CCCCC1	746094382	IGQVZVRDJNUQFP-KRWDZBQOSA-N	428.493	1.199	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccn2)no1)c1ccc(S(=O)(=O)N2CCCC2)cc1	746097195	WLQAQRXRZCZHPO-UHFFFAOYSA-N	441.469	1.596	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)CN[C@H](c2ccccc2)C(F)(F)F)c1	746123396	OSIDVFGHMTZRGH-MRXNPFEDSA-N	429.420	1.744	50	20	IDGD	
Cc1nc2ccc(C(=O)OCC(=O)NNC(=O)[C@H]3COc4ccccc4O3)cc2nc1C	746177330	BSSCHOUOSAAGIV-LJQANCHMSA-N	436.424	1.391	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCCN1C(=O)c1ccc(O)nn1)c1c(Cl)cccc1Cl	746210873	XSYCIDJVRHOVDV-CYBMUJFWSA-N	438.271	1.945	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)[C@H]1CC(=O)N(c2cccc(S(N)(=O)=O)c2)C1)c1ccccc1	746247370	MKZZFUMUXALZLM-MAUKXSAKSA-N	444.513	1.028	50	20	IDGD	
COc1ccccc1C(C)(C)C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	746818084	NODSVRBPURXLJO-UHFFFAOYSA-N	425.894	1.735	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN1C1CCCC1)c1ccc(S(=O)(=O)N2CCCC2)cc1	747649942	XJNHRRRJAPVYAL-LJQANCHMSA-N	434.562	1.639	50	20	IDGD	
NS(=O)(=O)c1ccc(N2CCOCC2)c(C(=O)NNc2cccc3c2CCCC3)c1	748588905	SMBZAIVEIUKTEW-UHFFFAOYSA-N	430.530	1.806	50	20	IDGD	
COc1ccc(OCCC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)cc1	748619934	NAZPKMQPZZRDGL-UHFFFAOYSA-N	448.545	1.544	50	20	IDGD	
CCOC(=O)N1CCN(S(=O)(=O)NNC(=O)c2cc3c(s2)CCCCC3)CC1	748674336	QNINJKOFMFLOSN-UHFFFAOYSA-N	430.552	1.270	50	20	IDGD	
O=C(O)COc1ccc(S(=O)(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1Cl	748689532	KFSXJJROLXPJFH-UHFFFAOYSA-N	429.794	1.335	50	20	IDGD	
O=C(CCN1C(=O)[C@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O)NNc1ccc(OCC(F)(F)F)cc1	748701707	WYSIIZPRCIJFJR-VDERGJSUSA-N	427.379	1.623	50	20	IDGD	
COc1ccc(-c2cc(C(=O)OCC(=O)NNC(=O)c3ccc(C#N)cc3)n[nH]2)cc1OC	751762707	DRPYOAJZIOWUKW-UHFFFAOYSA-N	449.423	1.584	50	20	IDGD	
Cn1c(=O)c2c(ncn2CCC(=O)NNc2cc(C(F)(F)F)ccc2F)n(C)c1=O	754146962	GRGVQZFGKPOXBX-UHFFFAOYSA-N	428.346	1.125	50	20	IDGD	
CCOC(=O)Cn1cccc(NC(=O)C(=O)NNc2ccc(Cl)cc2Cl)c1=O	754171121	XLEHWPKUZHBUPH-UHFFFAOYSA-N	427.244	1.800	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)[C@@H](C)CS(=O)(=O)c1ccc(F)cc1	755046770	HAOLFJCDWNHMBG-AWEZNQCLSA-N	446.504	1.995	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)nn1-c1ccccc1	757892509	TWNKVBGQSNTZNX-UHFFFAOYSA-N	442.501	1.898	50	20	IDGD	
Cn1cnc(C(=O)NNC(=O)c2cccc(S(=O)(=O)Nc3ccccc3Cl)c2)c1	758043764	QRQHXKVZZPTLRK-UHFFFAOYSA-N	433.877	1.949	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)NC[C@@H]1CN(Cc2ccccc2)CCCO1	759350765	IVXQXKBPBQFUGN-HXUWFJFHSA-N	437.500	1.559	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2cn(Cc3cccc(F)c3)nn2)cc1	759504690	ZTPWRMBFKIECIJ-UHFFFAOYSA-N	432.437	1.336	50	20	IDGD	
O=C(NC[C@@H](O)c1ccc(Cl)c(F)c1)NNC(=O)C1CCN(c2ncccn2)CC1	762576358	MDAYIIWRQTXHEO-MRXNPFEDSA-N	436.875	1.550	50	20	IDGD	
CN1CC[C@H](CNC(=O)NNC(=O)C(=O)N2CCCC2)[C@@H]1c1ccc(Cl)c(F)c1	763090261	BCSQQZRRESIGGW-CJNGLKHVSA-N	425.892	1.425	50	20	IDGD	
O=C(NNC(=O)c1ccccc1)C(=O)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1	763429665	JFMXPGGYUCDANY-IBGZPJMESA-N	432.484	1.730	50	20	IDGD	
CC1CCN(c2cccc(NC(=O)C(=O)NNC(=O)[C@@H]3COc4ccccc4O3)c2)CC1	763579055	TVMFDCZJDVFXBK-FQEVSTJZSA-N	438.484	1.849	50	20	IDGD	
COCCOc1c(Cl)cccc1NC(=O)C(=O)NNC(=O)COc1cccc(C)c1	763630598	OBCPATLQEVFQSR-UHFFFAOYSA-N	435.864	1.839	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cnn(CC(C)C)c1C(C)C	763645772	AYNBHTNHHOTAOW-UHFFFAOYSA-N	431.493	1.836	50	20	IDGD	
CCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)c(C)c1	763685919	ZOHADPZVARBTFT-UHFFFAOYSA-N	432.864	1.563	50	20	IDGD	
CN(C)CCC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(Cl)c2)cc1	763753403	VGYHVHLZOXETSM-UHFFFAOYSA-N	431.880	1.630	50	20	IDGD	
CCOC(=O)c1cc(F)c(F)cc1NC(=O)C(=O)NNC(=O)c1cccc(N(C)C)c1	763760800	SNEPZVUVJJMCEU-UHFFFAOYSA-N	434.399	1.607	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2ccc(OC[C@H]3CCCO3)cc2)c1	763773563	YTJMBNUUQPOLCU-QGZVFWFLSA-N	443.456	1.661	50	20	IDGD	
C=CCOc1cccc(NC(=O)C(=O)NNC(=O)c2nn(CC)c(=O)c3ccccc23)c1	763787031	UUPMJNFHUOUZDE-UHFFFAOYSA-N	435.440	1.381	50	20	IDGD	
Cc1cc(N2CCCC2)ccc1NC(=O)C(=O)NNC(=O)COc1ccccc1[N+](=O)[O-]	763802954	DCMHQOGPARPFDV-UHFFFAOYSA-N	441.444	1.668	50	20	IDGD	
Cc1cc(C(=O)N2CCCC2)ccc1NC(=O)C(=O)NNC(=O)COc1ccccc1C#N	763813378	LOJAYLPZSHOGRY-UHFFFAOYSA-N	449.467	1.268	50	20	IDGD	
COCCn1ccc2ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc3ccccc3F)cc21	763865797	QJWIJTGXNHRJAO-AWEZNQCLSA-N	442.447	1.980	50	20	IDGD	
CCc1nnc(-c2ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc3ccc(F)cc3)cc2)o1	763873651	XBHANBQDCOTGTM-GFCCVEGCSA-N	441.419	1.992	50	20	IDGD	
C[S@](=O)Cc1ccccc1NC(=O)C(=O)NNC(=O)CCSc1ccc(F)cc1	763903446	RXFZDPNQUCERSM-LJAQVGFWSA-N	437.518	1.973	50	20	IDGD	
CNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2ccc(OC(C)C)c(OC)c2)c1C	763915593	AUVAYXDMZIRFLF-UHFFFAOYSA-N	442.472	1.550	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)cc1	763977339	OETBTHCDUVRJHK-UHFFFAOYSA-N	440.865	1.207	50	20	IDGD	
CCCNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)c1	763995001	BYPVODXCRHBOGN-UHFFFAOYSA-N	436.266	1.317	50	20	IDGD	
Cc1ccc(NC(=O)C(C)C)cc1NC(=O)C(=O)NNC(=O)c1ccc2c(c1)OCCO2	764006746	UHRGBAYJEDVBML-UHFFFAOYSA-N	440.456	1.760	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1ccc(-c2n[nH]c(C)n2)cc1	764012344	ORUCGYYOSSFTGK-UHFFFAOYSA-N	428.836	1.842	50	20	IDGD	
COc1cc(C(=O)N(C)C)ccc1NC(=O)C(=O)NNC(=O)Cc1cccc2ccccc12	764034624	CEQSWBGPMWDWRC-UHFFFAOYSA-N	448.479	1.879	50	20	IDGD	
CCN1CCN(Cc2ccc(NC(=O)C(=O)NNC(=O)c3ccccc3OC)cc2)CC1	764041525	WHOXOPCXEINZQT-UHFFFAOYSA-N	439.516	1.232	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cccc(COc3ccc4c(c3)OCO4)c2)n[nH]1	764105873	AGMLPJHVPQCDEP-UHFFFAOYSA-N	437.412	1.426	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)c2scnc2C)cc1Cl	764248089	YZQZZBYITLBGDL-UHFFFAOYSA-N	426.838	1.056	50	20	IDGD	
N#Cc1c(F)cccc1-n1ccc(NC(=O)C(=O)NNC(=O)c2cccc3ncccc23)n1	764252763	KZBFELDPCAHOGJ-UHFFFAOYSA-N	443.398	1.831	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)C(=O)Nc1cccc(-n2cccc2)c1	764266983	PCXMKJZYLZGWEL-UHFFFAOYSA-N	433.472	1.270	50	20	IDGD	
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC(=O)C(=O)NNC(=O)C1CCC1	764335377	OPRMWQXNODOVCH-UHFFFAOYSA-N	440.456	1.842	50	20	IDGD	
CN(C)C(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)ccc1F	764342744	JBSGEVMOJROHRC-UHFFFAOYSA-N	438.419	1.113	50	20	IDGD	
CNC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)ccc1Cl	764349153	FWNFOBPWQAPVHE-UHFFFAOYSA-N	425.228	1.458	50	20	IDGD	
CC(C)CNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)cc1	764350142	YXWBTTANFLOWMJ-UHFFFAOYSA-N	432.864	1.831	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)C(=O)Nc1ccc(C(=O)NCc2ccc(F)cc2)cc1	764353473	HPIZTMXSRLOCKN-UHFFFAOYSA-N	449.442	1.479	50	20	IDGD	
O=C(NNC(=O)C(F)(F)Oc1ccccc1)C(=O)Nc1ccc(N2CCOC2=O)cc1	764370495	RQZQRGGSEOWNGT-UHFFFAOYSA-N	434.355	1.401	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1ccc2c(c1)OCCCO2	764393477	OPKXCBDEQNHYNV-UHFFFAOYSA-N	431.470	1.735	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1cc(C2CCC2)nn1-c1ccccc1	764398253	QMUGYVHWRBBSJY-CQSZACIVSA-N	429.477	1.277	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1ccnc(Oc2ccccc2Cl)c1	764398616	HTTJOSQXOMJADW-GFCCVEGCSA-N	436.852	1.665	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)C(=O)Nc2ccc(NC(=O)CC(C)C)cc2)c1	764430518	HVSQCUZNGRFKQK-UHFFFAOYSA-N	440.460	1.424	50	20	IDGD	
Cc1ccc(-c2ncc(C=NNC(=O)Cn3cnc4c3c(=O)n(C)c(=O)n4C)s2)cc1	764820350	ZGWFSKWGJXEZAG-UHFFFAOYSA-N	437.485	1.016	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1	765318790	QCRAFWOXPPHNLZ-UHFFFAOYSA-N	432.437	1.846	50	20	IDGD	
CCOc1cccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(CC)CC)c2)n1	765321283	PPBRTRUAFOFOME-UHFFFAOYSA-N	435.506	1.977	50	20	IDGD	
O=C(NCc1ccc(O)c(Br)c1)NNC(=O)c1ccc(-n2cnnn2)cc1	765632142	BPRKOHHEGBCDRL-UHFFFAOYSA-N	432.238	1.275	50	20	IDGD	
COc1ccccc1/C(C)=C\C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765733910	SSUGRCATRDLJNP-VLGSPTGOSA-N	436.512	1.704	50	20	IDGD	
O=C(NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)N[C@@H]1CCO[C@H](C2CC2)C1	765921068	WSVDNKYVUJRIES-AEFFLSMTSA-N	436.534	1.373	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)[C@@H]1CC(=O)N(c2ccc(Cl)c(F)c2)C1	766486219	QBQUMKLMQMBOAP-GFCCVEGCSA-N	429.839	1.870	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)CO[C@H]1CCCN(C(=O)OC(C)(C)C)C1	767824462	OGCRECTYYMBTCS-HNNXBMFYSA-N	431.493	1.820	50	20	IDGD	
O=C(CSc1nnnn1C1CCCC1)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	768278692	JIWKXCBDIBZCLP-UHFFFAOYSA-N	430.469	1.871	50	20	IDGD	
Cc1cn(-c2ccccc2)nc1C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	770208813	OCLFYWYOGWXZGQ-UHFFFAOYSA-N	433.877	1.556	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccncn2)c1	770763010	KIDSXCUOLURNOH-UHFFFAOYSA-N	442.457	1.753	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)C3(NC(=O)OC(C)(C)C)Cc4ccccc4C3)nc21	770971914	CCPDXWFRFCOZBD-UHFFFAOYSA-N	439.476	1.574	50	20	IDGD	
COc1cc(Br)c(S(=O)(=O)NNC(=O)c2ccccn2)cc1C(=O)O	772860437	CYVVAEGRDIJBJA-UHFFFAOYSA-N	430.236	1.174	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)c1cc(S(=O)(=O)N(C)C)cn1C	772963337	ISJAOYOIVWTWQL-NSHDSACASA-N	428.898	1.157	50	20	IDGD	
CCOC(=O)c1cnc(C)c(C(=O)OCC(=O)NNC(=O)c2cc(Cl)ccc2OC)c1	775059295	IMUMPBACCLHFRW-UHFFFAOYSA-N	449.847	1.847	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)Nc2ccc(CC(=O)N3CCOCC3)cc2)c1	776466432	WSFVCWWICVCUQA-UHFFFAOYSA-N	432.502	1.640	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)NCC(=O)NNc2ccc3ccccc3n2)cc1	777460067	NCBLBIAYMSYDGR-UHFFFAOYSA-N	428.470	1.833	50	20	IDGD	
CCNS(=O)(=O)c1ccccc1S(=O)(=O)NNC(=O)c1ccc(Cl)cc1OC	777599600	IPGOEABXVACNRR-UHFFFAOYSA-N	447.922	1.270	50	20	IDGD	
CN(C)c1cnc(C(=O)NNC(=O)[C@H]2Cc3ccccc3CN2Cc2ccccc2)cn1	779660751	MRBWVZLBBRBCBX-OAQYLSRUSA-N	430.512	1.931	50	20	IDGD	
O=C(CN1CCN([C@@H]2CCCN(Cc3ccccc3)C2=O)CC1)NNC(=O)c1ccccc1	780315222	PCNJEVCRTCSGIR-JOCHJYFZSA-N	449.555	1.256	50	20	IDGD	
O=C(C[C@H]1SC(N2CCCC2)=NC1=O)Nc1ccc(C(=O)NN=c2cc[nH]cc2)cc1	780755321	VLRFKLJCHOEBDF-QGZVFWFLSA-N	438.513	1.683	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)NCc2ccccc2CN2CC[C@@H](O)C2)c1	781836436	YFTZHWUAYOXYKI-GOSISDBHSA-N	428.489	1.415	50	20	IDGD	
O=C(NNc1ncncc1Cl)Nc1ccc(F)c(S(=O)(=O)N2CCOCC2)c1	782018763	JMDQLVJNCWMEBC-UHFFFAOYSA-N	430.849	1.439	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)C(=O)Nc1cccc2cc[nH]c12	782898041	XQMXQHSSYQBJQK-UHFFFAOYSA-N	428.474	1.169	50	20	IDGD	
COc1ncnc(N(C)C)c1NC(=O)C(=O)NNC(=O)c1ccc(Cl)cc1Cl	782926494	VPSRXSXEXLAIEL-UHFFFAOYSA-N	427.248	1.258	50	20	IDGD	
COc1cc(F)c(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)cc1F	784210154	FOUOEHUFEXKQNV-UHFFFAOYSA-N	440.428	1.496	50	20	IDGD	
COC(=O)c1cc(F)c(F)cc1NC(=O)C(=O)NNc1ccc(Br)cn1	784340372	XSNFOWAYCVKHFE-UHFFFAOYSA-N	429.177	1.991	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)[C@H]3CC=CC[C@H]3C(=O)N3CCOCC3)nc21	784400653	ZKHRYSOGCURYNP-UONOGXRCSA-N	443.508	1.171	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ncccc2Cl)cc1-n1nnnc1C1CC1	784820992	GXUHQHHZKKMKET-UHFFFAOYSA-N	428.840	1.679	50	20	IDGD	
O=C(NNc1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(CN2C(=O)CSC2=O)cc1	784827813	JYEGHYDKDVUIJJ-UHFFFAOYSA-N	429.414	1.872	50	20	IDGD	
NS(=O)(=O)c1cc(F)cc(NC(=O)C(=O)NNc2cc(C(F)(F)F)ccc2F)c1	785167173	ZITYRCZWFLWFNX-UHFFFAOYSA-N	438.334	1.713	50	20	IDGD	
CC1(C)CCC[C@@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)C1	785905502	QHAAWMQRECUGIA-MRXNPFEDSA-N	438.550	1.620	50	20	IDGD	
CCN(C(=O)c1cc(NC(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)ccc1Cl)C(C)C	786466459	QUNISSNIHPERGU-LBPRGKRZSA-N	444.941	1.798	50	20	IDGD	
Cc1noc(C)c1S(=O)(=O)NC1(C(=O)NNC(=O)NCc2ccccc2)CCCC1	787595168	VXMQZMNXPPGFJE-UHFFFAOYSA-N	435.506	1.413	50	20	IDGD	
CN(C)[C@H]1CCOc2c(NC(=O)C(=O)NNC(=O)c3cc(Cl)ccc3O)cccc21	789732776	XITALSYTTCMVTE-HNNXBMFYSA-N	432.864	1.831	50	20	IDGD	
CCNC(=O)c1ccc(C)c(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)c1	789810258	MCOKVSHRCWUPFQ-HKUYNNGSSA-N	438.484	1.403	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2cc(Cl)ccc2F)c1	790045760	RPWCOCSUVJCEAX-UHFFFAOYSA-N	435.886	1.353	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)N2CCN(S(=O)(=O)c3ccc(Cl)cc3)CC2)n1	793231111	KWAQXFYOSVHBSS-UHFFFAOYSA-N	437.909	1.404	50	20	IDGD	
O=C(Cc1cc(O)nc(O)n1)NN=Cc1c(F)ccc(I)c1F	794516951	XOOGFQGCMOWYBV-UHFFFAOYSA-N	434.140	1.463	50	20	IDGD	
COC(=O)c1ccc(S(=O)(=O)NNC(=O)c2cccc(C)n2)c(Br)c1	794599251	FEFULNPTOVXPEF-UHFFFAOYSA-N	428.264	1.562	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNS(=O)(=O)c1c(F)c(F)cc(F)c1F	795344940	LAVZWTNMQQDQJI-UHFFFAOYSA-N	429.392	1.857	50	20	IDGD	
O=C(COC(=O)c1occc1CS(=O)(=O)c1ccccc1)NNC(=O)c1cccs1	798087714	QGIAHTVJTYOSPV-UHFFFAOYSA-N	448.478	1.933	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)NCCCNS(=O)(=O)c1ccccc1Cl	798494617	HFMPOUCUMMKOKW-UHFFFAOYSA-N	440.909	1.661	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@H]1CC(C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)=NO1	798986333	MYDQAQINCBBSHP-CYBMUJFWSA-N	446.439	1.646	50	20	IDGD	
COCCO[C@@H]1CCCN(C(=O)NNC(=O)c2ccc(OC)c(Br)c2)C1	801016867	AONZWKFXQJOPQD-CYBMUJFWSA-N	430.299	1.940	50	20	IDGD	
CN1C(=O)C(=O)N(CC(=O)NNc2c(Br)cccc2Br)C1=O	801499978	IVGLAUYLDOLDRT-UHFFFAOYSA-N	434.044	1.075	50	20	IDGD	
CCOc1ccc(-n2ncc(C(=O)NNC(=O)Nc3ccc4c(c3)OCO4)c2C)nn1	802099767	BZWBTDJGJLTBEO-UHFFFAOYSA-N	425.405	1.565	50	20	IDGD	
Cc1ccc(/C=C(\C#N)C(=O)OCC(=O)Nc2cc(C)nn2[C@H]2CCS(=O)(=O)C2)cc1	802399577	CXWPHJNJAMEGLO-LTXFRBGYSA-N	442.497	1.948	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN([C@H](CNC(=O)NNC(=O)c2ccc[nH]2)C(F)(F)F)CC1	802465656	QIDWSKKUMKGISB-CYBMUJFWSA-N	448.446	1.442	50	20	IDGD	
COC(=O)N(C)NC(=O)c1cc(S(=O)(=O)N2CCOCC2)c(Cl)cc1Cl	804123861	GETLLEHBARQWTQ-UHFFFAOYSA-N	426.278	1.357	50	20	IDGD	
O=C(NCCn1cc(Br)cn1)NNC(=O)c1nn(-c2ccccc2)cc1O	805838576	XQDQEQCTHNZBHA-UHFFFAOYSA-N	434.254	1.181	50	20	IDGD	
CCc1nnc(NC(=O)[C@H](C)[C@@H](C)NC(=O)NNC(=O)Cc2ccccc2OC)s1	805881118	VKPVOEAFTVRNSM-VXGBXAGGSA-N	434.522	1.645	50	20	IDGD	
CNS(=O)(=O)c1cc(NC(=O)NNC(=O)COc2ccc(Cl)cc2)ccc1F	806546107	OATFELBXDKDYOX-UHFFFAOYSA-N	430.845	1.619	50	20	IDGD	
CNC(=O)c1cccc(NC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1Br	806734139	AYIDRPWBLXDGHU-CQSZACIVSA-N	449.261	1.801	50	20	IDGD	
O=C(NNC(=O)c1cc2c(s1)CCCCCC2)NC1CCC2(CC1)NC(=O)NC2=O	807546393	LONUTKHGQLQKKZ-UHFFFAOYSA-N	433.534	1.872	50	20	IDGD	
CCOc1cc(C(=O)NNS(=O)(=O)c2cn(C)nc2C)cc(OCC)c1OCC	808069437	WULSXJCYZWZQDB-UHFFFAOYSA-N	426.495	1.548	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cccc3c2COC3=O)ccc1OC(C)C	808934697	RCHOVUGCFFXFPF-UHFFFAOYSA-N	427.413	1.553	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2c(F)ccc(O)c2F)c1	809546189	YKVPEHVSERZVKQ-UHFFFAOYSA-N	427.429	1.776	50	20	IDGD	
O=C(Cn1c(-c2ccc(F)c(Cl)c2)noc1=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	809965345	IAUGPMUAAWNVBB-UHFFFAOYSA-N	435.755	1.665	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2c3c(cc4c2CCC4)CCC3)c1	810384301	JADZBHKKSHTFOV-UHFFFAOYSA-N	441.509	1.467	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccc(Br)cc2)cc1	813033749	JUTUKRUXNOCBIZ-UHFFFAOYSA-N	441.307	1.781	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@H](F)C[C@H]1CNC(=O)NNC(=O)[C@H]1COc2ccccc2O1	813815408	LVIRXVSEZOHKRI-HEHGZKQESA-N	438.456	1.504	50	20	IDGD	
CC(=NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1ccc(CN(C)C)cc1	814689204	WVDNECRLNGZLAD-UHFFFAOYSA-N	444.557	1.923	50	20	IDGD	
Cc1nc(NC(=O)C(=O)NNC(=O)CCCOc2ccc(Cl)cc2Cl)nn1C	815563458	CKGXLXIWDDTJDG-UHFFFAOYSA-N	429.264	1.375	50	20	IDGD	
O=C(COc1ccc2ccccc2c1Br)NNC(=O)[C@H]1CCS(=O)(=O)C1	818583626	FVMNZSMRWJQQEQ-LBPRGKRZSA-N	441.303	1.563	50	20	IDGD	
CC(=O)N1Cc2ccccc2C[C@H]1C(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12	823777166	QPZCAKJULVZGJN-FQEVSTJZSA-N	447.495	1.712	50	20	IDGD	
CCC1(CC)NC(=O)N(CC(=O)NNC(=O)Cc2nc(-c3ccccc3)cs2)C1=O	849212082	WMKMQORQTCAYCB-UHFFFAOYSA-N	429.502	1.611	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)[C@H](CC(C)C)N2C(=O)[C@H]3CC=CC[C@H]3C2=O)c1	863971749	DITLFVHJZKLAOD-OTWHNJEPSA-N	427.501	1.887	50	20	IDGD	
O=C(COC(=O)COc1cccc(NC(=O)c2ccco2)c1)NNC(=O)c1ccccc1	914978860	GXMKFLIMJDWHAF-UHFFFAOYSA-N	437.408	1.915	50	20	IDGD	
Cc1nc(SCC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c(C#N)c(C)c1C	915165797	NPBZIRNTYHRBQM-UHFFFAOYSA-N	432.527	1.835	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)NCC1(N2CCOCC2)CCCCC1	915896854	MJCUEGIRASFNIU-UHFFFAOYSA-N	435.481	1.339	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)NC[C@@H](C(C)C)N2CCN(C)CC2)cc1	916258258	PVPYMBZZMWHTIJ-PXNSSMCTSA-N	435.569	1.455	50	20	IDGD	
COc1cccc(C=NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c1OC	916258801	LXYCUASFFDKQMB-UHFFFAOYSA-N	433.486	1.489	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)c1ccc(F)c(S(=O)(=O)N(C)C)c1	916311666	HCOCUOILVCOVJN-UHFFFAOYSA-N	439.465	1.315	50	20	IDGD	
CNS(=O)(=O)c1cccc(CNC(=O)NNC(=O)COc2cc(C)ccc2C(C)C)c1	916486006	RMHNTFQLYLPJTN-UHFFFAOYSA-N	448.545	1.936	50	20	IDGD	
Cn1cc(CCNC(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)cn1	916595182	PJEKANOQALQWKD-UHFFFAOYSA-N	448.530	1.469	50	20	IDGD	
Cc1ccccc1OCCNC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	918128666	LPKGWRQJQVQYER-UHFFFAOYSA-N	425.533	1.917	50	20	IDGD	
Cc1cc(C)nc(SCc2ccc(C(=O)NNC(=S)NCC(=O)N(C)C)cc2)n1	918717640	XQHQFDRRBDOPDU-UHFFFAOYSA-N	432.575	1.583	50	20	IDGD	
N#Cc1ccc(CS(=O)(=O)CC(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)cc1	919316204	WACPKIYDVDOPEL-UHFFFAOYSA-N	449.872	1.131	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)N2CCC(=NNC(=O)c3ccc(O)cc3)CC2)cc1	920357040	AGKSBDQYFDOQNZ-UHFFFAOYSA-N	430.486	1.921	50	20	IDGD	
Cc1cccc(C(=O)Nc2ccccc2C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)c1	920745865	QIMLYNAYMQUQCN-HNNXBMFYSA-N	430.486	1.378	50	20	IDGD	
N#Cc1cccc(C2(C(=O)NNC(=O)c3ccc(S(=O)(=O)N4CCCC4)cc3)CC2)c1	1319915204	FXYCWHPLEUIWMK-UHFFFAOYSA-N	438.509	1.836	50	20	IDGD	
C[C@H](C(=O)NNc1nncc(N)c1Cl)N1C(=O)c2ccc(Br)cc2C1=O	1320606361	VPXWRTVXSLLASG-ZCFIWIBFSA-N	439.657	1.603	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnc(O)nc2O)C1	1778004466	HPTRMLVFAKNRHJ-PJIJBLCYSA-N	426.901	1.423	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4ncnn4c3)C2)C1	1778742036	NDVXDPWYQJPFRN-ROUUACIJSA-N	426.304	1.409	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C=N/N2CCCCC2)C1	1779365845	RRWXGKGIFWYLDD-ORHXZUFZSA-N	438.645	1.824	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cnc(-c4ccccn4)nc3)CCO2)C1	1781214316	TZEJNZOJXQXZCP-IERDGZPVSA-N	429.908	2.000	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cc([N+](=O)[O-])cc4c3OCC4)CCO2)C1	1781220707	CHPDENXUHLNIPN-JXFKEZNVSA-N	437.880	1.991	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)[C@H]3Cc4ccccc4CN3)CCO2)C1	1781229821	MJFFZSARQWGEQY-DUXKGJEZSA-N	440.371	1.767	50	20	IDGD	
CCc1[nH]nc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](Cl)COC)C2)c1F	1782170908	FQCQIODAIIOREM-BBEJJTJUSA-N	430.908	1.493	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H]1CC[C@@H](C(=O)OC)C1)C2	1782171795	GILXNVCYUMXFBY-IXBXCVQTSA-N	444.956	1.343	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CNC(=O)C(F)(F)F)C1	1782236029	BLYFXJCWBYUVTO-HWWQOWPSSA-N	427.851	1.196	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc4cccnc4nc3O)C2)C1	1782267045	CFPPUSLITZWUKY-MGPUTAFESA-N	434.880	1.033	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc4nonc4c3)CCO2)C1	1783347155	AKIQRGWZKSNFEY-UGSOOPFHSA-N	437.294	1.840	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccc([N+](=O)[O-])[nH]3)CCO2)C1	1783351133	FNKMRWXQDYLJEO-BDJLRTHQSA-N	429.271	1.540	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cccc4ccnn34)CCO2)C1	1783352968	LOXJLDFNXPCRNV-BEFAXECRSA-N	435.322	1.951	50	20	IDGD	
CCc1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](Br)CC)C3)C2)nn1C	1783353747	ZYEUDKKYMMJDIA-KBXCAEBGSA-N	427.343	1.600	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1CCCN1C(C)C)CCO2	1783354017	LZJOTGPONDPRKO-BXWFABGCSA-N	430.387	1.863	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(O)ccc3O)CCO2)C1	1783354322	YCWQLFHMSXAMPM-KSSFIOAISA-N	427.295	1.715	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cn4ccsc4n3)CCO2)C1	1783534794	ZHXUZCZNJIIFGE-ZBEGNZNMSA-N	427.324	1.623	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3[nH]cnc3-c3cccnc3)CCO2)C1	1783881364	LAIRCWZGYOIOKK-FOIQADDNSA-N	433.896	1.169	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cc3ccccc3o1)CCO2	1783934382	FOOPRVNYBBEEKK-JOCHJYFZSA-N	428.489	1.249	50	20	IDGD	
O=C(NCCC(=O)N1CCO[C@]2(CCN(C(=O)C(Cl)Cl)C2)C1)c1ccccc1	1783951362	GKZVWNPMCIAHBE-LJQANCHMSA-N	428.316	1.440	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cn(C)nc3C)[C@H]2C1	1784727687	ALIUAKFSCJMDRO-HNKHHVNMSA-N	427.343	1.495	50	20	IDGD	
O=C(NC1(c2ccc(NC(=O)[C@H](O)CCl)cc2)CCC1)c1cc(=O)nc2cccnn12	1786136787	QJYINQLHNQGBQH-MRXNPFEDSA-N	441.875	1.437	50	20	IDGD	
Cc1cc(C)n(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCBr)[C@H]3C2)n1	1786400825	ANXZHGCPPZGQEV-JYJNAYRXSA-N	427.343	1.265	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3c[nH]c4nccc-4c3)C[C@@H]21	1786406140	TWGKNKPCVLPIAK-BPUTZDHNSA-N	435.322	1.893	50	20	IDGD	
O=Cc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Br)C[C@@H]32)s1	1786990342	GROMJZGKLUXJRX-HVTMNAMFSA-N	433.299	1.844	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)c1noc2c1CCCC2	1787305254	XHIPIGZIGGUWBA-NOLJZWGESA-N	440.338	1.932	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3C[C@@H]3C3CC3)C[C@@H]21	1787506818	OPYRYSIGHDMBPD-AXDINXHVSA-N	441.532	1.146	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc4n(n3)CCC4)[C@H]2C1	1788415549	GFECGJXXSLPQDF-DUPGQFARSA-N	425.327	1.206	50	20	IDGD	
Cn1nc(C(F)(F)F)cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21	1788961109	KLQLZGZJJHXCIC-PZEZNAACSA-N	426.798	1.567	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(Cl)ncn3)[C@H]2C1	1789058329	AEJSJJTVCDXXKR-YDHLFZDLSA-N	426.977	1.575	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3cnccn3)C[C@@H]21	1791065373	WRFVNFMFBATKDV-SDADXPQNSA-N	425.327	1.172	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/c1ccccc1N)C2	1792867854	NCSOTNCWXCQVRI-CFBXBJJBSA-N	436.350	1.903	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](CCO)NC(=O)OC(C)(C)C	1793250019	NZPJIXJUGOVLFR-QRJUGERDSA-N	447.960	1.154	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnccc1C(F)(F)F)c1ccc(B(O)O)cc1	1795077004	ZWHADDOUDNYLJD-MUJYYYPQSA-N	447.222	1.346	50	20	IDGD	
CCOCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](Br)Cc1ccccc1)C2	1795212476	XHNSPCWHUIAMIZ-SFNKJDCFSA-N	439.350	1.619	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1n[nH]c2c1CCCC2	1796164816	OHGVGRIDXZATAO-CVGJEZRXSA-N	429.348	1.728	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@]1(C)CC=CCC1)C2	1796446211	PAFNPRPDIOWNLB-UWOXXUHBSA-N	441.532	1.456	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](F)Cl)c1n[nH]cc1I	1796807531	PQXMWZZNJHPGKA-PJFCORBGSA-N	440.644	1.801	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1n[nH]c3cccc(F)c13)C2	1797957694	YDUXQPQNCDOYBU-IVWMJMPLSA-N	434.544	1.757	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2cccnc2[nH]1	1798117006	MMFSDWXMFMODFP-FKDCUARVSA-N	447.499	1.949	50	20	IDGD	
Cc1cc(F)c(F)c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)c1	1798441750	HTDSIPVQAXVFEW-BTTYYORXSA-N	443.454	1.837	50	20	IDGD	
COc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCBr)C3)c(OC)c1	1798820970	CTURBDKARAVCBG-IVWMJMPLSA-N	441.322	1.692	50	20	IDGD	
Cc1nc(F)ccc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnccc1C(=O)NN)C2	1799002832	VDHYTPGCTDFUDG-BTTYYORXSA-N	426.452	1.093	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1c(-c2ccncn2)noc1C	1799181829	HZSSWPZERNDPHH-LXTVHRRPSA-N	433.896	1.946	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(N3CCOCC3)cc1)C2	1799270251	VMPVZZWQRYKXET-HNJRGHQBSA-N	435.952	1.744	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1COc3ccccc3O1)C2)[C@@H](F)Br	1799344784	VROOMSMWYYPBDW-DCIASYOESA-N	443.269	1.107	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(OC(F)F)cc1)C2	1800977493	RSNQQVNMWHPNCW-OCVGTWLNSA-N	432.851	1.745	50	20	IDGD	
CCC[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2	1802133301	YSRAWHQIEAKYQI-KHMAMNHCSA-N	435.924	1.804	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](O)c1ccccc1Cl)C2	1802339597	BAPIQUXPRPAUHH-IGMJJTELSA-N	436.940	1.385	50	20	IDGD	
CC(=O)N[C@H](C)C(=O)N1CC[C@H](CNC(=O)[C@@H](C)CBr)[C@@H]1c1cccnc1	1803015367	MAPHHSIUJTZDBH-IXKJSCDLSA-N	439.354	1.643	50	20	IDGD	
CC(C)[C@H](S)C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1807365343	NZSWICPULXZMHU-RLLQIKCJSA-N	441.362	1.035	50	20	IDGD	
Cc1ccncc1C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1807375569	QBEJIUFSDXWYNH-SIKLNZKXSA-N	444.300	1.098	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)Cc2ccncc2)[C@H]1c1cccnc1	1807520176	AQJDGOVPVKGGNV-AUSIDOKSSA-N	438.532	1.098	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)NC[C@H]1CCN(C(=O)CO[Si](C)(C)C)[C@H]1c1cccnc1	1808228126	AFYUJIQGOZFNRK-RYRKJORJSA-N	435.601	1.386	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@H]1CCN(C(=O)CN2CCCC2=O)[C@H]1c1cccnc1	1808295345	GUOVPOPSNRIKDU-BPAFIMBUSA-N	441.359	1.946	50	20	IDGD	
Cc1c[nH]cc1C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1808580567	NJXFTBFJJXSYJJ-RXVVDRJESA-N	432.289	1.031	50	20	IDGD	
CC(C)=NO[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1808869474	RWOJYLDDROROPM-PLMTUMEDSA-N	446.552	1.261	50	20	IDGD	
CCOC(=O)N[C@H](O)C(=O)NC[C@@H]1CCN(C(=O)[C@H](Cl)CC)[C@H]1c1cccnc1	1810100425	SNZCOTQIKRONRP-QSJFSLAZSA-N	426.901	1.169	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)[C@H]2CCCSC2)[C@@H]1c1cccnc1	1813074756	UTEXOBRVNWCVRK-BBTUJRGHSA-N	447.605	1.604	50	20	IDGD	
COC[C@H](C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[nH]n1	1815307042	YFSZOTIYGCMPLY-XJULRZDRSA-N	443.508	1.818	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CN2CCNC2=N)n[nH]1	1817296250	CHDRIZKTVSMZMH-YVEFUNNKSA-N	430.340	1.478	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H]2C=CCN2)[nH]n1	1818112209	WJUIHKWKCKSWCK-KWJAWIQSSA-N	438.492	1.064	50	20	IDGD	
C[C@@H]1CCC[C@H]1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2	1818876557	OYORUQBMXVAIIC-DAXOMENPSA-N	427.335	1.485	50	20	IDGD	
O=C1COc2ccc(C(=O)Nc3cc([C@@H]4CCCCN4C(=O)[C@@H](O)CCl)[nH]n3)cc2N1	1819100802	FLPCABXEHQOPAV-GJZGRUSLSA-N	447.879	1.646	50	20	IDGD	
CCc1nc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)co1	1819896076	SKYREQPTDACRNY-KRWDZBQOSA-N	437.265	1.260	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)Cc2ccc3ncnn3c2)n[nH]1	1820703271	XMQNBDAMFRHFNO-HOCLYGCPSA-N	445.911	1.941	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)c3ccccc3F)sc2C1	1821858980	CAONALRZSZMAHQ-GFCCVEGCSA-N	433.509	1.881	50	20	IDGD	
C=C(C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)C(F)(F)F	1821992086	QXMYLXFGUWOIRV-OAHLLOKOSA-N	436.199	1.514	50	20	IDGD	
CC(C)n1nccc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1	1822415069	RTJZIKHBIUKLMM-INIZCTEOSA-N	444.540	1.866	50	20	IDGD	
CC(=O)N[C@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H](O)CCl)CC1)C(C)(C)C	1824359054	YHZHQWUZXJYYAN-FGTMMUONSA-N	429.989	1.757	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCN1CCOCC1)CC2	1825999987	ZIWDIRFSVDBABI-QWHCGFSZSA-N	430.958	1.031	50	20	IDGD	
C[C@@](O)(CC(=O)O)CC(=O)Nc1nc2c(s1)C[C@H](NC(=O)CO[Si](C)(C)C)CC2	1826073786	IXLLTVMBJMPTNZ-ZMZPIMSZSA-N	443.598	1.522	50	20	IDGD	
Cc1cc(C(=O)N[C@@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)ccc1O	1826088826	QDCUVZDSQNVVOL-CQSZACIVSA-N	445.545	1.756	50	20	IDGD	
CS(=O)(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](F)Br)CC2	1827211277	DKOLROSJWXEIHG-CPCISQLKSA-N	442.332	1.180	50	20	IDGD	
COCCn1nccc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H](O)CCl)CC1	1827809778	HUHVUMYUMJXFNH-AEFFLSMTSA-N	426.945	1.363	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@H](COC)NC(C)=O)CC1	1829117355	GVZFCKCXKRRRPX-OKZBNKHCSA-N	431.961	1.011	50	20	IDGD	
Cc1c(F)cccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)Br)C2)C1	1830164042	UNWDDQLSBDVZEW-IFXJQAMLSA-N	443.313	1.988	50	20	IDGD	
CCOc1cnc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)cn1	1830358926	SBHUBVFTBWZIGG-FQEVSTJZSA-N	440.928	1.210	50	20	IDGD	
O=C([C@@H](F)Br)N1CCC([C@H]2CCCCN2C(=O)Cn2ccncc2=O)CC1	1831109754	BIMQANDBWUIVLD-RHSMWYFYSA-N	443.317	1.554	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1C[C@@H]1F)CCO2	1832128349	BPIFVCGKEKTVAO-DVRJMELHSA-N	449.429	1.686	50	20	IDGD	
CC(C)(CCl)C(=O)NC1CCN(C2CCN(C(=O)CN3CCCCC3=O)CC2)CC1	1833216090	UGDNBZGRKFCRGU-UHFFFAOYSA-N	441.016	1.836	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)CCc3ccc(F)nc3)CC2)CC1)[C@@H](O)CCl	1833308617	XUQUNBQEMSIWBB-SFHVURJKSA-N	440.947	1.325	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccccn3)CCO2)C1	1833980590	OCNVRUFDKOGSCR-KSSFIOAISA-N	426.311	1.183	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccn(CC)n3)CCO2)C1	1834408951	LULGHAZWUFGUDE-RDTXWAMCSA-N	443.342	1.147	50	20	IDGD	
CC[C@H](C(=O)N1CCOC[C@@]2(CN(C(=O)CCBr)CCO2)C1)N(CC)CC	1834819786	UXSJQERDFQRZHJ-VQIMIIECSA-N	448.402	1.348	50	20	IDGD	
CC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)[C@](C)(O)C(F)(F)F)CC2)CC1	1836395154	UYTNVSQTJBLLBA-YOEHRIQHSA-N	427.895	1.889	50	20	IDGD	
COc1ccc(CC(=O)N2CCC(OC3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)cc1	1836716694	JKLWOKRMJISJPK-FQEVSTJZSA-N	438.952	1.836	50	20	IDGD	
CC(C)n1nccc1C(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836718603	WAXMUYZYZGMURI-GOSISDBHSA-N	426.945	1.676	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)C34CC(F)(C3)C4)CC2)CC1	1836905948	KHPPVCXJHRTEAV-UHFFFAOYSA-N	438.544	1.250	50	20	IDGD	
Cc1cc(C(N)=O)cc(C)c1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1837435828	DTKXXADZCXQGDV-OXJNMPFZSA-N	441.887	1.007	50	20	IDGD	
Cc1nnc(CC(=O)N2CCC(OC3CCN(C(=O)[C@@H](C)Br)CC3)CC2)o1	1837940251	BPDHPCWFXYJMDM-GFCCVEGCSA-N	443.342	1.703	50	20	IDGD	
Cc1cnn(CC(=O)N2CCC(OC3CCN(C(=O)[C@@H](C)Br)CC3)CC2)c1	1837979546	UXCIWTPKCHDVMX-OAHLLOKOSA-N	441.370	1.974	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3Cc4ccccc4CN3C)C2)C1	1839142056	CRELMGSZPBFZDI-JTAQYXEDSA-N	449.979	1.517	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)C#CC3(O)CCCCC3)C2)C1	1839146342	XESTVVYVWYDLFF-UTKZUKDTSA-N	426.941	1.159	50	20	IDGD	
O=C(Cc1ccccc1O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839202873	RVHUUYZCVLEVKB-SJLPKXTDSA-N	445.285	1.082	50	20	IDGD	
CCOc1cccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](Cl)CC)C3)C2)c1O	1839427063	FFYSMIMVRWETDN-IIBYNOLFSA-N	440.924	1.878	50	20	IDGD	
Cc1cccn2ncc(C(=O)N3CCO[C@@]4(COCCN(C(=O)C(Cl)Cl)C4)C3)c12	1839612214	FKYHQYJMISNLIK-IBGZPJMESA-N	441.315	1.516	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(C)n(C)c3)C2)C1	1839964178	JKONYAYALVFKQY-LPHOPBHVSA-N	442.354	1.577	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CCC[C@H](C(=O)OC)C1)CCO2	1840147011	GASXJQZJHLEJRM-MXTNKPTQSA-N	444.956	1.440	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc4ccncc34)C2)C1	1840154712	DDVNICQIVVKWNA-KNQAVFIVSA-N	447.919	1.559	50	20	IDGD	
Cc1nc2sccn2c1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840188616	TYSXHKSBSRUDPJ-QGZVFWFLSA-N	447.344	1.578	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)CCc1ccc(C)nc1)C2	1843415278	HZFXCEDHOSLSNE-YZSQISJMSA-N	436.516	1.660	50	20	IDGD	
CCCOc1ccc(C(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)cc1	1844975865	AVLYDSAZHJDDLE-UHFFFAOYSA-N	437.500	1.605	50	20	IDGD	
CC(=O)C[C@H](C)C(=O)N1CCCC12CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2	1846328263	YJURNAOLQUFYCC-ZDUSSCGKSA-N	431.445	1.952	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)c1cnccc1C(F)(F)F)C2	1846384387	MBLWLPVFEIFEJA-UHFFFAOYSA-N	427.427	1.290	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)c1cccnc1OCC1CC1)C2	1846384478	XUGOXURJMXXOGL-UHFFFAOYSA-N	429.521	1.060	50	20	IDGD	
CC(C)(C)OC(=O)N1C(=O)CC[C@@H]1C(=O)N1CC2(CCCN2C(=O)C(Cl)Cl)C1	1846389135	HHRYLXUGFBFKTM-LLVKDONJSA-N	434.320	1.920	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H]1CC(=O)CN1C(=O)OC(C)(C)C	1847642311	CPURUPQWSQZAOS-VGWMRTNUSA-N	427.929	1.784	50	20	IDGD	
C[C@@H]1CC[C@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)O1	1848099970	GQXDVRGZQUFJDK-OLMNGRFOSA-N	429.945	1.888	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CCCN2C(=O)c3ccccc3C2=O)cc(OC)c1OC	3621332	VYHWAEHQAJSTKT-UHFFFAOYSA-N	441.440	1.550	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)[C@@H]2CC(=O)Nc3cc(F)ccc32)ccc1Cl	10414949	AIDPWYFNBRJLIX-LLVKDONJSA-N	440.840	1.014	50	20	IDGD	
CCNS(=O)(=O)c1cccc(C(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)c1	10601326	GTWAVEWIMUIMPM-UHFFFAOYSA-N	439.877	1.256	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(C(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1	11006046	OBEPXLCFMKYOFS-UHFFFAOYSA-N	433.486	1.563	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)CCn2c(=O)n(C)c3ccccc32)c2ccccc2c1=O	14222462	DFDUZDLXURAURW-UHFFFAOYSA-N	448.483	1.482	50	20	IDGD	
CC(=O)c1ccc(N2CCN(CC(=O)NNC(=O)Cc3nc(C)cs3)CC2)c(F)c1	15041278	QEZDORSUWJTFSY-UHFFFAOYSA-N	433.509	1.305	50	20	IDGD	
COc1ccc(N2C[C@H](C(=O)NNC(=O)c3c(C)nc4ccccn34)CC2=O)c(OC)c1	17580760	WOSDZJFJXBPQFY-CQSZACIVSA-N	437.456	1.474	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)c1sc2nc3n(c(=O)c2c1C)CCC3	26736470	TZOXPDVJFIYRCL-UHFFFAOYSA-N	442.497	1.951	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Cc2ccc(OC(F)F)cc2)cc1	26772701	PFEUWEPCRVSINW-UHFFFAOYSA-N	441.456	1.607	50	20	IDGD	
CCCS(=O)(=O)Nc1cccc(C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)c1	45948621	WRPGIBOXMHVZCE-UHFFFAOYSA-N	443.485	1.804	50	20	IDGD	
NS(=O)(=O)c1ccc(C(=O)NNC(=O)c2ccc(Br)s2)cc1Cl	725908000	YVKMQRLMGHWYRU-UHFFFAOYSA-N	438.712	1.886	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)N2CCC(N3CCC[C@H]3C(N)=O)CC2)c1C	726800144	GZDGJKHHWLUKIC-PHJXOXRPSA-N	427.549	1.599	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NN=Cc1ccc(OC(=O)c2cccc([N+](=O)[O-])c2)cc1	728437186	MLTZDLSQCFFTPN-LBPRGKRZSA-N	434.430	1.202	50	20	IDGD	
CCOC(=O)C1=NN(c2ccccc2)[C@@H](C(=O)NNC(=O)c2ccc(OC)c(OC)c2)C1	728454963	CJDGPUYEAOIESZ-QGZVFWFLSA-N	440.456	1.663	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(C(=O)NNC(=O)c2cccc(OC(F)F)c2)ccc1F	728484698	HBAJAOGKRSCUTM-UHFFFAOYSA-N	431.392	1.752	50	20	IDGD	
O=C(NCCCN1CCN(c2ccncc2)CC1)NNC(=O)c1cccc(OC(F)F)c1	728597150	OEDVNVRJWPQXHW-UHFFFAOYSA-N	448.474	1.839	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1ccc(Cl)c(N2CCCC2=O)c1	728848182	YTQRKNKHKDUXHE-UHFFFAOYSA-N	442.907	1.934	50	20	IDGD	
CC[C@@H](NC(=O)NNC(=O)[C@@H](C)Oc1ccc(F)cc1)c1cccc(S(N)(=O)=O)c1	729612190	BJGBUELYVPWNIB-SJKOYZFVSA-N	438.481	1.722	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@H]2CSCN2C(=O)C(C)(C)C)c2ccccc2c1=O	730073528	NIUGVRXJHIWZFQ-CQSZACIVSA-N	431.518	1.125	50	20	IDGD	
CC(=NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1ccc(OCC(=O)Nc2ccccc2)cc1	730576069	LLAFZPKCEKZICF-QGZVFWFLSA-N	429.498	1.979	50	20	IDGD	
C[C@H]1CC(C)(C)C[C@@]2(C1)NC(=O)N(CC(=O)NNC(=O)COc1ccccc1O)C2=O	730782176	JDHVHCSOECSFMG-YEJXKQKISA-N	432.477	1.055	50	20	IDGD	
Cc1nn(C)c(C)c1S(=O)(=O)NNC(=O)c1ccc(CSc2nncn2C)cc1	731046053	LZRFVLLCITVTIV-UHFFFAOYSA-N	435.535	1.081	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)c2cnc3c(cnn3Cc3ccccc3)c2)C[C@@H](C)O1	732261470	CUECQWWYEVAUPQ-IAGOWNOFSA-N	436.516	1.740	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)NCc1ccc(Cl)cc1)c1cccc(S(N)(=O)=O)c1	732991317	CVURPPIFTXFDEO-NSHDSACASA-N	425.898	1.762	50	20	IDGD	
Cn1c(NNC(=O)c2cc(-c3ccco3)nc3c(C(N)=O)ncn23)nc2ccccc2c1=O	733263278	SPEUERGKUFJDMZ-UHFFFAOYSA-N	444.411	1.092	50	20	IDGD	
Cc1ccc(S(N)(=O)=O)cc1C(=O)NNc1ccccc1S(=O)(=O)NC(C)(C)C	734251055	WRSNZWHNZXFMIW-UHFFFAOYSA-N	440.547	1.476	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(I)c[nH]2)c1	734421989	JTSFPMUUQDGCPE-UHFFFAOYSA-N	433.227	1.098	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNS(=O)(=O)c2ccc3c(c2)C(=O)NCC3)cc1	734806729	HBBLPEYIQJMJQK-ZDUSSCGKSA-N	433.486	1.148	50	20	IDGD	
COCCOc1ccc(-n2nc(C)c(C(=O)NNC(=O)COc3ccc(F)cc3)n2)cc1	735028783	OSSQCAAJYIMOHX-UHFFFAOYSA-N	443.435	1.580	50	20	IDGD	
C[C@H](CN1CCOCC1)C(=O)NN=C1C(=O)Nc2c(Cl)cc(Br)cc21	735613129	ZFUQVEQIDFCIQZ-SECBINFHSA-N	429.702	1.843	50	20	IDGD	
Cc1ccc([C@H](CNC(=O)NNC(=O)COCc2ccccc2)N2CCOCC2)cc1	738987798	XVDAOBCRWGZAHJ-NRFANRHFSA-N	426.517	1.916	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2ccn(C(C)C)n2)c1	739050848	BOHCYHIQBWIFFY-UHFFFAOYSA-N	436.538	1.639	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)c2cn(Cc3cccs3)nn2)CC1	742683322	YIRHEDIEJBHATM-UHFFFAOYSA-N	449.537	1.731	50	20	IDGD	
CN(C)[C@H](CNC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)c1ccc(F)cc1	743620565	BTKLYIQAALDOTC-QGZVFWFLSA-N	437.497	1.868	50	20	IDGD	
CN1CCN([C@H](C(=O)NNC(=O)c2cc(Br)ccc2O)c2ccccc2)CC1	743730205	RUOCNDONBSUMOA-SFHVURJKSA-N	447.333	1.904	50	20	IDGD	
O=C(NNC(=O)c1cc(N2CCNC2=O)ccc1F)c1cc(Br)ccc1O	743731971	GDRYAEIHBRILJC-UHFFFAOYSA-N	437.225	1.898	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)/C=C/c1ccccc1)C(=O)NNC(=O)NC1CCCC1	744052477	FDZYLEZNRPISGQ-ABDJAZHISA-N	440.591	1.971	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1ccc(Cn2ccnc2)cc1	744619422	NXIZCGLIEOUWGR-UHFFFAOYSA-N	441.513	1.709	50	20	IDGD	
CN1CCN(C[C@H](NC(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)c2ccccc2)CC1	745799249	PHCKLFLKTYKGKB-SFHVURJKSA-N	442.476	1.233	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN(C(=O)NC2CCCC2)C1)c1nnc(O)c2ccccc12	746096181	BVNKYGDJCNRYNB-ZDUSSCGKSA-N	426.477	1.461	50	20	IDGD	
CC[C@H](Nc1c([N+](=O)[O-])c(C)nn1C)C(=O)NNC(=O)c1cc(-c2ccccc2)on1	746108347	PJDBTNIFFCQLSE-ZDUSSCGKSA-N	427.421	1.943	50	20	IDGD	
COc1ccc(C(=O)NNc2cc(F)c(F)c(F)c2)cc1S(=O)(=O)N1CCOCC1	746708876	CPKLWRWWDWVDAI-UHFFFAOYSA-N	445.419	1.890	50	20	IDGD	
CCOc1ccc(OCc2ccc(C(=O)NNC(=O)CN3C(=O)CN(C)C3=O)cc2)cc1	747458682	PPHXYJSAXUZVSE-UHFFFAOYSA-N	440.456	1.319	50	20	IDGD	
O=C(CNC(=O)c1ccc(F)cc1)NNc1ccc(S(=O)(=O)Nc2nccs2)cc1	747943299	FBAQSLQCXYBREQ-UHFFFAOYSA-N	449.489	1.956	50	20	IDGD	
CCS(=O)(=O)N[C@@H](CCSC)C(=O)NNc1ccc(S(=O)(=O)C(F)F)cc1	748610379	LOQZQKUARZDORC-LBPRGKRZSA-N	445.535	1.187	50	20	IDGD	
CS(=O)(=O)N1CCN(CCNC(=O)NNc2c(Cl)cc(Cl)cc2Cl)CC1	749352084	FRAQGVWNUKTTEU-UHFFFAOYSA-N	444.772	1.850	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)N2CCN(/C(=C/C#N)c3cccc([N+](=O)[O-])c3)CC2)C[C@@H](C)O1	750037023	UHNUTMDOKXJLQF-ZUDPWCTJSA-N	435.506	1.431	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1cccn1Cc1ccncc1	751295304	WOSLPCCRIAJZMM-UHFFFAOYSA-N	426.502	1.608	50	20	IDGD	
Cc1ccc([C@H](C)NC(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1[N+](=O)[O-]	752000893	WZWYZVNJNXKDAJ-LBPRGKRZSA-N	434.478	1.902	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)Cc2ccc(C(=O)NNC(=O)N[C@@H]3CCOC3)cc2)cc1	752699139	JVVGFYXTWZIVRY-GOSISDBHSA-N	446.529	1.549	50	20	IDGD	
CCc1cc(Br)ccc1NNC(=O)[C@H]1CC(=O)N([C@@H]2CCS(=O)(=O)C2)C1	753175442	KFSDOOIZCVPQEB-GXTWGEPZSA-N	444.351	1.490	50	20	IDGD	
C[C@H](OC(=O)/C(C#N)=C\c1ccc(O)cc1)C(=O)N[C@@H](C)c1ccc(S(N)(=O)=O)cc1	754543153	SRPANFOXROQCMQ-KWTCJJERSA-N	443.481	1.756	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H]2CCOC(C)(C)C2)c1	754676039	QMIRNEXUCFNMPR-HNNXBMFYSA-N	426.539	1.619	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N(CC)CC)cc1NC(=O)NNC(=O)c1cnn(C)c1	755442091	PJLYUJMSQDHZQE-UHFFFAOYSA-N	438.510	1.316	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)Nc1ccc(NC(=O)[C@@H]2CCCO2)cc1	755640634	KHKUVVYWZXJTMY-ZWKOTPCHSA-N	426.429	1.797	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)Nc2ccc(CN3C(=O)CCC3=O)cc2)c1	755664621	YEDCVHPRNPDQTC-UHFFFAOYSA-N	426.429	1.819	50	20	IDGD	
O=C(Cc1cc(Cl)cc2c1OCC2)N1CCN(S(=O)(=O)CBr)CC1	755894975	YBPJCXPHOAIKHT-UHFFFAOYSA-N	437.743	1.644	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)Nc1cccc(COCC(F)(F)C(F)F)c1	755965330	YHBCWZCCAMBKLT-LLVKDONJSA-N	441.403	1.691	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(N2C[C@H]3CC[C@H]2C3)cc1	756164151	MSIONLHIPWAXBJ-KXBFYZLASA-N	433.468	1.712	50	20	IDGD	
CC[C@H](C)NS(=O)(=O)c1cccc(NC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1	757709638	OOSLEWBMLXYTFS-UGSOOPFHSA-N	448.501	1.756	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)Nc2cccn(CCS(C)(=O)=O)c2=O)c2ccccc2n1	757781713	UKFPZJBGVBWPIP-UHFFFAOYSA-N	443.485	1.216	50	20	IDGD	
Cc1nn([C@@H]2CCS(=O)(=O)C2)c(C)c1NC(=O)NNC(=O)c1cc2c(s1)CCC2	757870987	CCUTWSDJPSBJQU-CYBMUJFWSA-N	437.547	1.876	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H](C(=O)NNC(=O)C(=O)Nc2ccccn2)C[C@H]2CCCC[C@@H]21	758830391	KHRCBKRLGKWJBQ-ILXRZTDVSA-N	431.493	1.736	50	20	IDGD	
COc1cccc(/C=C(/C#N)C(=O)OCC(=O)Nc2cc(S(N)(=O)=O)ccc2OC)c1	759871856	NKCGBBULVVDKLS-ZSOIEALJSA-N	445.453	1.440	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)CCNC(=O)[C@H]2CCCN2C(=O)OC(C)(C)C)nc1	760922377	KNKOSWSLZJTGQO-CQSZACIVSA-N	435.481	1.217	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)c1ccc(CCNS(C)(=O)=O)s1	761638279	XKYLZQCNANWUOW-UHFFFAOYSA-N	443.572	1.402	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)cc(OC)c1O	762604557	IJOZRFDCOJCFSI-UHFFFAOYSA-N	438.481	1.753	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NN=Cc1ccc(OCCBr)c(Cl)c1	763172493	NWQHYBGJVXMZLE-SECBINFHSA-N	426.720	1.502	50	20	IDGD	
CN(C)CC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3n2)cc1	763448983	AQTKZISEQQMDFC-UHFFFAOYSA-N	434.456	1.135	50	20	IDGD	
CO[C@@]1(CNC(=O)NNC(=O)[C@H]2Cc3ccccc3CN2Cc2ccccc2)CCOC1	763646808	JYDPNBJVNGLXCG-ZJSXRUAMSA-N	438.528	1.749	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2ccn(CCc3ccncc3)n2)c1	763648429	DJLFGPCAUIJRTP-UHFFFAOYSA-N	436.472	1.303	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)N[C@@H]1CCCC[C@H]1N1CCOCC1	763661415	WFLSJLBPSWUVLA-IAGOWNOFSA-N	428.493	1.165	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2nn(-c3ccc(C#N)cn3)cc2C)cc1C	763678882	FHBALUOEPPZZSQ-UHFFFAOYSA-N	447.455	1.229	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)COc2ccccc2F)sc2c1CCC2	763681576	GXXGMVIYKYGFGN-UHFFFAOYSA-N	449.460	1.718	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)C(=O)Nc1cc(N2CCCC2=O)ccc1Cl	763682003	ZLJFQWYDHVKBPE-UHFFFAOYSA-N	448.838	1.771	50	20	IDGD	
CCN(Cc1ccccc1NC(=O)C(=O)NNC(=O)COc1ccc(C)cc1)C(C)=O	763820396	GSOLTTLXKCUOAD-UHFFFAOYSA-N	426.473	1.528	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)C(=O)Nc2cccc(C#N)c2)c2ccccc2c1=O	763820625	LTKKAFQUULOKNH-UHFFFAOYSA-N	446.467	1.858	50	20	IDGD	
CC(C)C(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)c1	763864429	JCCLODWFUPIZIV-CYBMUJFWSA-N	430.436	1.974	50	20	IDGD	
Cc1noc(C)c1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1cccc(Br)c1	763884723	XHKAGUTZASUCGW-JTQLQIEISA-N	425.239	1.607	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2nn(C(C)(C)C)cc2C#N)cc1OC	763911369	LHXOCDUHTQSPSR-UHFFFAOYSA-N	442.476	1.707	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)C(=O)Nc1cccc(OC(F)(F)F)c1	763944053	KYYKACVYUUDSSL-UHFFFAOYSA-N	449.345	1.876	50	20	IDGD	
Cc1ccc(C(=O)N2C[C@H](C)C[C@@H](C)C2)cc1NC(=O)C(=O)NNC(=O)c1cccn1C	763993412	PSYCSDXQVNDTLS-HUUCEWRRSA-N	439.516	1.851	50	20	IDGD	
CCn1cnnc1-c1cccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)c1	764006930	VSICKHUPVNUKIQ-UHFFFAOYSA-N	436.428	1.136	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccn(-c3ccc(C#N)cc3Cl)n2)c(O)c1	764110051	OKSFGXCSWDAXNF-UHFFFAOYSA-N	438.831	1.811	50	20	IDGD	
Cc1ccnc(Oc2ccc(NC(=O)C(=O)NNC(=O)[C@@H]3Cc4ccccc4O3)cc2)n1	764163736	LMOVXKLNXKJFNE-SFHVURJKSA-N	433.424	1.667	50	20	IDGD	
CN(Cc1ccccc1NC(=O)C(=O)NNC(=O)Cc1cccnc1)C(=O)OC(C)(C)C	764267172	AHSPMQPWYSDETE-UHFFFAOYSA-N	441.488	1.777	50	20	IDGD	
CCOC(=O)/C=C\c1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2O)cc1	764275757	TWWAVUUUTRHVNR-XFXZXTDPSA-N	427.413	1.133	50	20	IDGD	
O=C(Cc1cc[nH]n1)NNC(=O)C(=O)Nc1ccc(-c2nnc3n2CCCCCC3)cc1	764285875	ODYIMZSEIHBNHN-UHFFFAOYSA-N	436.476	1.113	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2cc(F)c(F)c(F)c2)n[nH]1	764376849	JQTWVXJJEFUNCH-UHFFFAOYSA-N	433.346	1.902	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)NCC2(N3CCOCC3)CC2)cc1Cl	764832364	VSCYKWOIFODKAI-UHFFFAOYSA-N	427.889	1.558	50	20	IDGD	
COc1ccc(-n2nnc(C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)c2C)cc1	765323404	OIGXEFMMRZGYFA-UHFFFAOYSA-N	432.481	1.650	50	20	IDGD	
COc1cc(C)c(Br)cc1NC(=O)C(=O)NNC(=O)Cn1nc(C)cc1C	765375301	AWTBZAXUSNOQQX-UHFFFAOYSA-N	438.282	1.366	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2)c(I)c1	765698316	NYAWTKTZJMGSFG-UHFFFAOYSA-N	439.209	1.700	50	20	IDGD	
O=C(CSCc1ccc(F)cc1)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765736520	UDGARYKXVXPHKD-UHFFFAOYSA-N	444.532	1.664	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1occc1Br	765737436	FLCQMQBPYVUBSQ-UHFFFAOYSA-N	435.278	1.261	50	20	IDGD	
Cc1nn2cc(S(=O)(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)cnc2c1Cl	766320708	OCPIDVXFMAWYGT-UHFFFAOYSA-N	446.917	1.306	50	20	IDGD	
C[C@@H](NC(=O)NNc1ccccc1S(C)(=O)=O)c1ccc(S(=O)(=O)N(C)C)cc1	766880261	KZURJHAWZJKSMB-CYBMUJFWSA-N	440.547	1.728	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccncc2)n(-c2ccc(C(F)(F)F)cn2)n1	768233877	OTWYMYBMNWIXRD-UHFFFAOYSA-N	433.350	1.389	50	20	IDGD	
CC[C@@H]1CCCC[C@@H]1OCC(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	768276100	OMHSBSKINHKWOX-QUCCMNQESA-N	430.549	1.577	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)Sc1nnc(-c2cc(-c3ccc(CC)cc3)[nH]n2)n1N	768417211	RVVUMGKBZPUNHB-LLVKDONJSA-N	428.522	1.649	50	20	IDGD	
O=C(NNC(=O)c1csc(NC2CC2)n1)c1cccc(S(=O)(=O)N2CCCC2)c1	768918297	IKGVFOQIJYVNAU-UHFFFAOYSA-N	435.531	1.577	50	20	IDGD	
CC(C)[C@H](NC(=O)C12CC3CC(CC(C3)C1)C2)C(=O)NNc1nc(O)c2cnn(C)c2n1	770993033	ZHGFPMUOGLRBFY-UTQJESMHSA-N	441.536	1.869	50	20	IDGD	
Cc1cc(NNC(=O)CN2C(=O)N[C@](C)(c3ccc(Br)cc3)C2=O)ncn1	771578487	PFDVTBYZXCYOBE-QGZVFWFLSA-N	433.266	1.458	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)ccc1NC(=O)OC(C)(C)C	772220950	ITDPMUMFEXJGHB-ZDUSSCGKSA-N	426.495	1.473	50	20	IDGD	
Cc1nc(CN2CCC(C(=O)NNC(=O)C(=O)NCc3ccc(Cl)cc3)CC2)cs1	772887740	BVIOMSAQMQLHNU-UHFFFAOYSA-N	449.964	1.781	50	20	IDGD	
N#Cc1ccccc1NC(=O)CCCC(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772888743	LEYRYDGOHKHAAH-UHFFFAOYSA-N	441.875	1.784	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2cc(OC)c(Br)c(OC)c2)n1	773727360	YERXBGNPRTYVHU-UHFFFAOYSA-N	426.227	1.347	50	20	IDGD	
Cc1cc(S(N)(=O)=O)ccc1CNC(=O)NNC(=O)c1cc2c(s1)CC[C@H](C)C2	775210508	BVTHBTNHPOWHGG-NSHDSACASA-N	436.559	1.973	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNS(=O)(=O)c2c(C)cccc2F)cc1	775252089	CDWFXRXPZYFIND-UHFFFAOYSA-N	429.495	1.073	50	20	IDGD	
Cc1ocnc1CNC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	775454602	MPGVOWMTINQLQE-UHFFFAOYSA-N	443.485	1.606	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)[C@H](C)Nc1nc(C)cs1	775909317	OKRYRSYVBWBFCP-JTQLQIEISA-N	426.882	1.918	50	20	IDGD	
CN(NC(=O)C1(NC(=O)OC(C)(C)C)CC1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776213820	QUJFRXAKPVDDIG-UHFFFAOYSA-N	441.529	1.679	50	20	IDGD	
CC(=O)c1ccc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)c(F)c1	777420871	ZKSCGBYNLOLRGJ-UHFFFAOYSA-N	426.448	1.247	50	20	IDGD	
COCCN1C(=O)CCc2cc(NC(=O)C(=O)NNC(=O)c3ccccc3OC)ccc21	778711930	ZXIAKGLVIOUQIQ-UHFFFAOYSA-N	440.456	1.021	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)N[C@H](C)c2ncn(C)n2)c2ccccc2c1=O	780704590	PTNZEGGVCSLWFM-CYBMUJFWSA-N	426.481	1.420	50	20	IDGD	
Cc1nc(CC(C)C)c(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)s1	782892430	DGAQKBGJPXRLHI-UHFFFAOYSA-N	428.518	1.865	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ccccc2Br)cc1OCC(N)=O	782987994	BISATUMRZNWCNY-UHFFFAOYSA-N	437.250	1.404	50	20	IDGD	
O=C(NNc1cncc(Cl)n1)C(=O)Nc1ccc(F)cc1I	783259737	KSBUQDOZGJMPJR-UHFFFAOYSA-N	435.584	1.956	50	20	IDGD	
CC[C@@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNc2cccc(S(C)(=O)=O)c2)cc1	784839638	MXXOWNJKAYZPDB-CYBMUJFWSA-N	432.502	1.700	50	20	IDGD	
CN(C)C(=O)c1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)Cc1cn2ccccc2n1	785061629	ZGCVBGYKBSMXFV-UHFFFAOYSA-N	442.863	1.018	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2cccn(Cc3ccc(C)cc3)c2=O)n1	785225002	AGDRRGDQZYVNTD-UHFFFAOYSA-N	449.515	1.923	50	20	IDGD	
Cn1cc(-c2ncccc2NC(=O)C(=O)NNC(=O)c2ccc(Br)s2)cn1	786414287	KNXGWFPQLVOBOL-UHFFFAOYSA-N	449.290	1.706	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)CCC(C)(C)O)c2)cc1	786611769	STPMTRIPJKILHH-UHFFFAOYSA-N	435.502	1.808	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)[C@@H]1CC(=O)N(c2ccccc2Br)C1	788177753	JAFMULKGJRNLNW-GFCCVEGCSA-N	442.277	1.921	50	20	IDGD	
CN1C(=O)Cc2cc(NC(=O)NNC(=O)CCN3CCN(c4ccccc4)CC3)ccc21	788711387	SQAGKVAOVFLAJO-UHFFFAOYSA-N	436.516	1.571	50	20	IDGD	
Cc1cc(-n2cccn2)ccc1NC(=O)C(=O)NNC(=O)c1cc(Br)c[nH]1	789584134	DWWWZJGLCGQIRX-UHFFFAOYSA-N	431.250	1.671	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)C(=O)Nc2cccc3c2OC(C)(C)C3)c2ccccc2c1=O	789585616	AYJDZCACPHCBJA-UHFFFAOYSA-N	435.440	1.047	50	20	IDGD	
Cn1cnnc1-c1cccc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)c1	789811289	YMGOCJYFYVPPPV-ROUUACIJSA-N	434.456	1.141	50	20	IDGD	
CCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)c(C)c1	789812078	JCVJZXOUZNKUBA-HKUYNNGSSA-N	438.484	1.403	50	20	IDGD	
COc1cc(NNC(=O)Cn2c(=O)oc3cc(S(N)(=O)=O)ccc32)ccc1Cl	790180408	KJMFXOSYSKQMLU-UHFFFAOYSA-N	426.838	1.047	50	20	IDGD	
O=C(CNC(=O)NNc1ccc(Cl)nn1)Nc1ccc(I)cc1	790887261	AXDSGFWMCJCDHT-UHFFFAOYSA-N	446.636	1.999	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)ccc1C(F)(F)F	790951118	CRFLNYFECMCWEC-UHFFFAOYSA-N	436.346	1.751	50	20	IDGD	
CO[C@@H]1CCOc2c(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc3ccccc3F)cccc21	790951880	MJDWUULCZKBBJC-MLGOLLRUSA-N	431.420	1.849	50	20	IDGD	
CC(C)NC(=O)NC1(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)CCCCC1	792141341	JREUJRPWJALECD-UHFFFAOYSA-N	431.541	1.251	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NC[C@@H]2CCN(Cc3ccccc3)C2)nc1	792228820	FONFNLLMZCJFOG-SFHVURJKSA-N	446.577	1.917	50	20	IDGD	
Cc1cc2n[nH]cc2cc1NC(=O)C(=O)NNC(=O)c1cc(Br)ccc1O	792267371	FSWBDCWGDSDDRQ-UHFFFAOYSA-N	432.234	1.739	50	20	IDGD	
CC[C@H](C)n1ncc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)c1C	792283968	SIERFGUYDYRTQX-LBPRGKRZSA-N	434.522	1.685	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)CCc2cnc[nH]2)c1	792773224	QTJLUIRLJRQXKH-UHFFFAOYSA-N	443.485	1.613	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)N[C@@H](C(N)=O)c1cccc(Br)c1	792776645	JXIWECCTFXFLNM-CQSZACIVSA-N	445.277	1.576	50	20	IDGD	
C[C@H](NC(=O)c1ccc(Br)s1)C(=O)N([C@@H]1CCS(=O)(=O)C1)N(C)C	792854065	INMNNKWNSTVLSO-VHSXEESVSA-N	438.369	1.121	50	20	IDGD	
Cn1cc(-c2cc(F)ccc2NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)cn1	796989252	BUWSOLSLOUNEDU-UHFFFAOYSA-N	429.383	1.530	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)cc1OC	796989926	MGPRINSUYUGMHJ-UHFFFAOYSA-N	440.456	1.021	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2OC)cc1OC	796999784	UIDGEKZEYFLSMW-UHFFFAOYSA-N	435.820	1.544	50	20	IDGD	
COC(=O)c1cc(F)c(Br)cc1NC(=O)C(=O)NNC(=O)CC(F)(F)F	797002267	PQCDEGCLUKIKDK-UHFFFAOYSA-N	444.135	1.413	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccc(F)cc1-c1cnn(C)c1	797003035	VBCLWIANMAFLGL-UHFFFAOYSA-N	425.420	1.563	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)c2cccc(C)n2)sc2c1CCSC2	797370205	WCDDLMLCENDCIX-UHFFFAOYSA-N	448.526	1.817	50	20	IDGD	
O=C(CN1C(=O)NC2(CCCC2)C1=O)NNc1cc([N+](=O)[O-])ccc1Br	800618148	INNYNSNAHSZLTF-UHFFFAOYSA-N	426.227	1.665	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@H]2CCCN2C(=O)c2ccccc2O)cc1	802068031	XEBNTLVZDXGYON-MRXNPFEDSA-N	446.485	1.253	50	20	IDGD	
COC(=O)Cc1c(C(=O)OCC(=O)NNC(=O)Cc2ccccc2C)[nH]c2ccccc12	803710402	ASMZMRUEEGQRSD-UHFFFAOYSA-N	437.452	1.739	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NC[C@H](Cc2ccccc2)N(C)C)cc(OC)c1OC	807006611	PQBGGMOAIRYYCJ-KRWDZBQOSA-N	430.505	1.829	50	20	IDGD	
CN1CCC/C1=N\S(=O)(=O)c1cccc(NC(=O)C(=O)NNc2ncccc2F)c1	807300380	LBZBJXFTLIRBPW-BUVRLJJBSA-N	434.453	1.115	50	20	IDGD	
O=C(NNc1ncccc1F)C(=O)Nc1cc(Br)ccc1N1CCOCC1	807301082	UJSNHSKUHGKLRH-UHFFFAOYSA-N	438.257	1.902	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc2ccccc2c1)NNC(=O)Cn1ccc2ccccc21	810353160	AXJHNRWCSQJOEE-UHFFFAOYSA-N	436.493	1.920	50	20	IDGD	
COC(=O)c1c(F)ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)c1F	810386765	QDVORBOULZFHFB-UHFFFAOYSA-N	427.747	1.510	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)CNC(=O)c2cccs2)nn1C1CCCCC1	810396476	WHNYHAKLEXSVNU-UHFFFAOYSA-N	432.506	1.274	50	20	IDGD	
CC1(C)CN(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)C[C@H](C(F)(F)F)O1	814295828	HEELAUBZKLQJHB-CYBMUJFWSA-N	430.431	1.476	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCc2nncn2C1)C(=O)Nc1cccc(-c2ccc3c(c2)CCO3)c1	815691872	DFGWBFHHVRYSIT-KRWDZBQOSA-N	446.467	1.229	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)c1c[nH]n2c1nc(=O)c1ccccc12	817052485	CVTMXVNUYAJQSR-UHFFFAOYSA-N	426.458	1.183	50	20	IDGD	
Cc1cc(Cl)ccc1OCCCC(=O)NNC(=O)CNS(=O)(=O)c1cccs1	915188172	GNKQLHTXMXFWFS-UHFFFAOYSA-N	445.950	1.995	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCc2ccc(-n3ccnc3)nc2)nc1	916236104	NVAHCANDVHLIEQ-UHFFFAOYSA-N	430.494	1.175	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NN=Cc1ccccn1)N(S(C)(=O)=O)CC2	916354990	HLXMESULKAPIAV-QGZVFWFLSA-N	432.502	1.498	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCN(C(=O)N(C)Cc3ccccc3)CC2)n1	917134525	XZGGRJULBOYDBQ-UHFFFAOYSA-N	444.561	1.011	50	20	IDGD	
CCN(CCCNC(=O)NNC(=O)c1ccc(F)cc1Br)S(C)(=O)=O	918119566	YLHSPSGBFCPOAN-UHFFFAOYSA-N	439.307	1.204	50	20	IDGD	
CCS(=O)(=O)NCCNC(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccccc1	918561674	FAIVSCRPJTYLEH-LGMDPLHJSA-N	426.502	1.426	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)c(C)c2)cc1	919836414	NHLFBIKFSIAHPS-UHFFFAOYSA-N	433.530	1.713	50	20	IDGD	
CCOC(=O)c1ccc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1	919919076	GKQHAKDBGYBOTG-UHFFFAOYSA-N	448.501	1.258	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)N[C@H]3CCc4cc(F)ccc43)nc2)CC1	919919440	CSHBXYQJODGCOJ-SFHVURJKSA-N	448.524	1.470	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)[C@@H]2CCCN(C(=O)C(C)(C)C)C2)c2ccccc2c1=O	920339768	LNKFBXXDFKGUIL-OAHLLOKOSA-N	441.532	1.852	50	20	IDGD	
COc1ccc(CCC(=O)NN=C(C)c2ccc(S(=O)(=O)NCC(=O)O)cc2)cc1	920379643	FCNLUSKTEBHORD-UHFFFAOYSA-N	433.486	1.531	50	20	IDGD	
COc1cccc(-c2nn(Cc3ccccc3)cc2C(=O)NNC(=O)CN2CCCC2=O)c1	920826098	ORWPUMFILVYKCJ-UHFFFAOYSA-N	447.495	1.990	50	20	IDGD	
CSC[C@H](C(=O)NNC(=O)NCCc1cccs1)N1C(=O)[C@H]2CCCC[C@H]2C1=O	920860464	FHCUWQVUGBGXAJ-QLFBSQMISA-N	438.575	1.528	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NC[C@H](c2cccc(F)c2)N2CCOCC2)cc1	921247259	CIUAVCFVVICAIA-HXUWFJFHSA-N	446.479	1.617	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1cccc(C(F)(F)F)c1)C(=O)NNc1nncc(N)c1Cl	1116319126	XZPTWXIEFXEQQD-SSDOTTSWSA-N	438.819	1.541	50	20	IDGD	
CN(NC(=O)c1ccn(-c2ccncc2)n1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	1116787179	CWVIEJGLYIMFSQ-UHFFFAOYSA-N	429.481	1.517	50	20	IDGD	
COc1cccc(N2CCC(NC(=O)NNC(=O)[C@@H]3COc4ccccc4O3)CC2)c1	1251875313	VMTKTBGQEFJBGU-FQEVSTJZSA-N	426.473	1.834	50	20	IDGD	
O=C(NNC(=O)c1nc(-c2ccc(F)cc2)n2c1CCCCC2)N[C@H]1CCS(=O)(=O)C1	1317977186	BIYZDDBEDIQNGW-HNNXBMFYSA-N	449.508	1.547	50	20	IDGD	
CS(=O)(=O)CC[C@H](NS(=O)(=O)/C=C\c1ccccc1)C(=O)N1CC=C(C#N)CC1	1321049149	RKBBHAJMJUGYEE-WAFIBAPDSA-N	437.543	1.062	50	20	IDGD	
O=C(C#CC1(O)CCCCC1)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1779066988	KEIGKWLRNMSDII-YJBOKZPZSA-N	431.302	1.205	50	20	IDGD	
CCOC(=O)c1cccc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)c1F	1780108900	WIWUDECDLVHPBQ-QRWLVFNGSA-N	442.871	1.046	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cn1cc([N+](=O)[O-])cn1)C2	1780700635	VNVAKTLRTBVIIC-HDMKZQKVSA-N	427.889	1.323	50	20	IDGD	
Cc1noc(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@](C)(Cl)CCl)C2)n1	1780713347	RXHLPMXGKCSBCW-JEBQAFNWSA-N	433.336	1.671	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccnnc1O)C2	1780715004	LXVHSIKVALDSSE-JEBQAFNWSA-N	431.320	1.546	50	20	IDGD	
Cc1ccn2ncc(C(=O)N3CCO[C@]4(CCN(C(=O)[C@H](F)Br)C4)C3)c2c1	1781330918	IRUHVWQJCZKLCT-YJBOKZPZSA-N	439.285	1.777	50	20	IDGD	
CCN(CC)C[C@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](Cl)COC)C2	1781507821	JDUSTVGYXGLEKS-LXGFNABISA-N	432.005	1.732	50	20	IDGD	
C[C@@H](C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCBr)C2)n1ccnn1	1781544994	PUESJYLUJMZFNU-JJRVBVJISA-N	428.331	1.138	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H]1CNc3ccccc31)C2	1782170722	VDAFXICKHFKJQJ-ZRAXVTTISA-N	435.952	1.963	50	20	IDGD	
CC(C)c1cc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CCC(=O)NN(C)C)C2)no1	1782210771	JPHFRJNGKOKPCJ-XMSQKQJNSA-N	449.552	1.299	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)Cn3cc(Cl)cn3)CCO2)C1	1783342193	JKMWXLVPQQVVPH-BBRMVZONSA-N	433.734	1.540	50	20	IDGD	
CCCC(=O)N[C@H](C)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](Br)CC)C2)C1	1783348934	DIVVESWBVVUWKJ-HBUWYVDXSA-N	432.359	1.295	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3n[nH]c4ccc(F)cc34)CCO2)C1	1783534272	RWFSGMVHQPYKPK-VOJFVSQTSA-N	439.285	1.929	50	20	IDGD	
CCSc1ncccc1C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](Cl)COC)C2)C1	1783869070	NKYHBMYLGBPLMS-HNAYVOBHSA-N	427.954	1.891	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(OC(F)F)cc3)C[C@@H]21)[C@H](O)CCl	1784092617	RHSQEJONTMILDI-HNKHHVNMSA-N	432.851	1.481	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)CCc3cnccn3)C2)C1	1784552306	LCEUHNMCCNGWHM-KSSFIOAISA-N	425.327	1.270	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)[C@@H]3SC(=N)NC3=O)C[C@@H]21	1784618731	QZQOZLUVTIKWPW-LZXPERKUSA-N	444.985	1.176	50	20	IDGD	
COc1cc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)ccc1F	1785011328	XMPZQNYXFJDWER-YOEHRIQHSA-N	433.249	1.968	50	20	IDGD	
COc1cccc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CO[Si](C)(C)C)C[C@@H]32)n1	1785198891	WTOJCVLGYLZCNX-SZMVWBNQSA-N	435.597	1.464	50	20	IDGD	
COc1ncccc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]21	1786010967	IGHQSCLUTTUPEB-VFSPDHHESA-N	430.332	1.920	50	20	IDGD	
NC(=O)CC[C@H](N)C(=O)Nc1ccc(C2(NC(=O)[C@H](F)Br)CCC2)cc1	1787980128	YTZUGCPYGXGUDL-JSGCOSHPSA-N	429.290	1.404	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3Cc4ccccc4O3)[C@H]2C1	1788185350	BIWYKDPOQLERCA-ZULIPRJHSA-N	432.593	1.821	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3Cc4ccccc4O3)[C@H]2C1	1788186039	BIKMBZBYQHZFRK-YOQCSXPPSA-N	437.334	1.753	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)c1ccn2ccnc2c1	1788360312	ODFRLLFMOPEMCG-YXWQFLTLSA-N	439.285	1.618	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccn4ccnc34)[C@H]2C1	1788368603	DGHKSIDFSGVLQO-VRKREXBASA-N	435.322	1.711	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nc4ccccc4n(C)c3=O)C[C@@H]21	1789860253	XXJBGMVUCKHTLA-AFIMGQEJSA-N	446.935	1.544	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCN3CCCCC3)C[C@@H]21)[C@H](F)Br	1789922174	FSJIGQLNKPXSJN-JKQORVJESA-N	434.350	1.533	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3c(C)noc3N)C[C@@H]21	1790961967	SUBXLKORAFSRKB-RVMXOQNASA-N	429.315	1.332	50	20	IDGD	
CCN1CCC(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CO[Si](C)(C)C)C[C@@H]32)CC1	1792295143	DUDSDUREPHWYPW-FHWLQOOXSA-N	425.646	1.550	50	20	IDGD	
CC[C@@H](O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](Br)Cc1ccccc1)C2	1792864870	DMPADPZMPVZNCN-RZFLPCETSA-N	439.350	1.353	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1c[nH]c3ccc(F)cc13)C2)[C@H](O)CCl	1792982775	NHHLBEZSHNKIAH-VLBMKZOESA-N	437.899	1.429	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H]1CCC[C@@H]1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCl	1793117641	UWGTXKQEZFGQNP-FHULIHMCSA-N	443.972	1.918	50	20	IDGD	
COc1nccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CO[Si](C)(C)C)C3)c1F	1795911021	LQPGBOHRMBBRHQ-FVCICTRLSA-N	425.533	1.284	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2)c1ncn(-c2ccccc2)n1	1796539893	QZXZUSOOCWREIV-XOIINTDNSA-N	448.321	1.256	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1cccc2c1OCCO2	1796962647	UVJGMRQGZRFTKS-VAECKANCSA-N	443.269	1.352	50	20	IDGD	
COc1ccc(F)cc1CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Br	1799351773	AISYLNMDRDPSPC-LZDSYCOUSA-N	447.276	1.657	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(N(C)C)cn1)C2	1800639307	NPGLPFRNCXWTEL-IARIHHJXSA-N	439.354	1.524	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)n1ccnc1C	1801459163	ZUOFKAKXHZQNQW-SLZITWOASA-N	427.343	1.516	50	20	IDGD	
CC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](Cl)COC)C2	1801964055	HVZRVNMHAWZDMQ-QRJUGERDSA-N	447.960	1.133	50	20	IDGD	
CC[C@H](NC(C)=O)C(=O)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@H]1c1cccnc1	1802549472	NOGGUPSJMVHILA-VGWMRTNUSA-N	443.317	1.693	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2snnc2C2CC2)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803139235	MPGJZXNAOSUPIR-OFQRWUPVSA-N	435.937	1.730	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cnc3snnc3c2)[C@H]1c1cccnc1)[C@@H](O)CCl	1803140904	IXYWTGVAAWVZIE-RCBQFDQVSA-N	446.920	1.401	50	20	IDGD	
NC(=O)c1ccccc1C(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]1c1cccnc1	1803140997	JWIZRMFRQXUWIF-ZTFGCOKTSA-N	430.892	1.100	50	20	IDGD	
CCOC(CC(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)OCC	1803146797	QKZKUAUBPQFRSL-JTDSTZFVSA-N	427.929	1.476	50	20	IDGD	
Cc1ccc(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)o1	1803779106	IQUPDIYUYFMRED-RXVVDRJESA-N	433.273	1.296	50	20	IDGD	
CC(C)(C)n1ccc(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)n1	1805042183	YTFFSENWPDVNRC-RYQLBKOJSA-N	433.940	1.952	50	20	IDGD	
CC(C)n1nc(C(=O)N2CCC3(CCCN(C(=O)[C@H](O)CCl)C3)CC2)cc1C(=O)O	1805518591	PXTKQYMZWVRVQS-MRXNPFEDSA-N	440.928	1.607	50	20	IDGD	
O=C(CCBr)NC[C@@H]1CCN(C(=O)c2ccc(O)nn2)[C@H]1c1cccnc1	1806339194	JPUDPUBNHLKORC-GUYCJALGSA-N	434.294	1.682	50	20	IDGD	
O=C(CCBr)NC[C@@H]1CCN(C(=O)c2ccnnc2O)[C@@H]1c1cccnc1	1806342537	KJBMNEYYXOUEFX-XJKSGUPXSA-N	434.294	1.682	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC2(CCCN(C(=O)c3ccc(N(C)C)cn3)C2)CC1	1807740215	GKYGERARUREMGH-UHFFFAOYSA-N	444.580	1.365	50	20	IDGD	
CN1CCC[C@H]1C(=O)N1CC[C@H](CNC(=O)[C@H](F)Br)[C@H]1c1cccnc1	1808652651	YWHQOSJVPHOMEL-QXSJWSMHSA-N	427.318	1.872	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H](CNC(=O)c2cnc(O)[nH]2)[C@H]1c1cccnc1	1810942134	BDTPGUKPRYAHBG-UXIGCNINSA-N	436.310	1.861	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@@H](CNC(=O)CCS(C)(=O)=O)[C@H]1c1cccnc1	1813574483	WATYLHXFBBPQGC-DOTOQJQBSA-N	429.970	1.787	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3[nH]nc4ccncc34)sc2C1	1816866430	WZSWNSKGHAGMLB-KOLCDFICSA-N	434.909	1.894	50	20	IDGD	
CO/C=C(\C)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1)CC2	1819539272	DGXNBTVNNBVXNK-CKGZQHNFSA-N	444.517	1.739	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)CN2CCOC2=O)[nH]n1)[C@H](F)Br	1820932195	YWRMDMYUTCIKEC-GWCFXTLKSA-N	432.250	1.545	50	20	IDGD	
C[C@@H](C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)n1cccc1	1822672931	UNGULQRFKJNWFD-HNAYVOBHSA-N	435.293	1.458	50	20	IDGD	
O=C(CCn1cncn1)Nc1cc([C@H]2CCCCN2C(=O)[C@H](F)Br)[nH]n1	1822682735	CMDDLBRVIZEJAP-RISCZKNCSA-N	428.266	1.774	50	20	IDGD	
Cn1nc(C(=O)N[C@@H]2CCc3nc(NC(=O)[C@H](F)Br)sc3C2)cc1O	1823003159	WHUANCVNSQBODR-KBUNVGBDSA-N	432.275	1.499	50	20	IDGD	
CSCC[C@H](O)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1	1823013522	CMYZEJOLEBSHPM-HDBBIHSSSA-N	440.360	1.860	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)CCl)CC2)c1nc2ccc(F)cn2n1	1824387727	GUXIFKSKKKJFLP-KOLCDFICSA-N	438.872	1.150	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCn1ccnn1)CC2	1825647625	RVUBSJHOAFTYOH-NXEZZACHSA-N	427.328	1.520	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)on1	1825964976	UOSIBYKSDMDNTF-IBGZPJMESA-N	425.294	1.210	50	20	IDGD	
Cc1ccc(C(=O)N[C@@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)c(O)n1	1826088856	QWHFUGXAJPKXAV-GFCCVEGCSA-N	446.533	1.151	50	20	IDGD	
O=C(C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1)c1ccco1	1827055924	KEJBEBCXOHXVKJ-LJQANCHMSA-N	438.289	1.076	50	20	IDGD	
COC[C@H](NC(C)=O)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H](C)Br)CC1	1829119504	XNAFYYVWECBQOK-XOKHGSTOSA-N	446.386	1.541	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(OC)n(C)n2)CC1	1829847173	ZLTSMBUXWVCHSQ-WBVHZDCISA-N	426.945	1.916	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(C)c3F)CCO2)C1	1830104127	WNQLNOCJISPFDT-OXJNMPFZSA-N	428.888	1.458	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)COc3ccc(O)cc3)CCO2)C1	1830339460	SONWZMQQERDATJ-NQIIRXRSSA-N	440.924	1.635	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cn(C)nc3C(F)F)C2)C1	1831645837	DVDKKOPBIAZLLN-IFXJQAMLSA-N	448.898	1.835	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(C(N)=O)cc3)C2)C1	1831659842	WGJGYBMJBGMSFQ-UWJYYQICSA-N	437.924	1.263	50	20	IDGD	
C[C@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1)n1cccc1	1832108244	MRVIDAFUMUQWIX-GCJKJVERSA-N	437.349	1.662	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)C[C@H]3CCCCO3)CCO2)C1	1832339265	XSDKFUAINLKMGK-GPMSIDNRSA-N	447.370	1.433	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)CCc3cn[nH]c3)CC2)CC1	1833814305	XARSSBYFICLUNY-SFHVURJKSA-N	425.961	1.168	50	20	IDGD	
Cc1ncccc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1834039998	XBDUVAWQDRMOBY-RHSMWYFYSA-N	430.274	1.151	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3ncc(C)s3)CC2)CC1	1834061318	JZOISYPVZMPECK-INIZCTEOSA-N	428.986	1.891	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3cccc(O)n3)CC2)CC1	1834199336	DHNPWPDUFGBWIF-ZDUSSCGKSA-N	439.354	1.756	50	20	IDGD	
CC(C)N[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)CCBr)C2)C1)C(C)C	1835895290	YPFHGJBUCCLARP-PKOBYXMFSA-N	448.402	1.250	50	20	IDGD	
O=C(CCc1cc(F)ccn1)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836715140	KEDSEMXODVQLDH-LJQANCHMSA-N	441.931	1.752	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc4ncccn4n3)CCO2)C1	1836866279	DZABMMPEJZEOBW-FQEVSTJZSA-N	435.912	1.064	50	20	IDGD	
COc1ccsc1C(=O)N1CCOC[C@@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1837715232	DDGMFIIADBHDFS-LJQANCHMSA-N	442.610	1.678	50	20	IDGD	
CCn1nc(C(=O)N2CCO[C@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)cc1C	1838146395	NQKVMLTXDNSHMR-HXUWFJFHSA-N	426.945	1.546	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(Cl)nc(OC)c3)CCO2)C1	1838233018	ZQRKHRVSHHJPOR-IFXJQAMLSA-N	446.331	1.831	50	20	IDGD	
CN(C)c1c(F)cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)cc1F	1839468862	HVHUYWLQHXNKLT-VQIMIIECSA-N	449.857	1.635	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3sccc3Cl)C2)C1	1840153821	BGOPJWAJXBPXBS-DYVFJYSZSA-N	437.345	1.725	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc([C@H](C)C#N)c3)C2)C1	1840156959	YWKHGLDKRORKJR-GTCCEBARSA-N	449.935	1.637	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(F)ccc3OC)CCO2)C1	1840691066	SQUYHPVGYQYSFS-JXFKEZNVSA-N	444.887	1.158	50	20	IDGD	
C#CCCC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1	1841352614	AVSWSUFYUDHEHF-HZPDHXFCSA-N	441.956	1.486	50	20	IDGD	
C=C[C@@H]1C[C@]1(NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1	1841354634	LYLZPJIOCLGUGK-ARGWCVDVSA-N	427.929	1.259	50	20	IDGD	
Cc1onc(-c2ccccc2)c1C(=O)N1CCCC12CN(C(=O)c1ccc(B(O)O)cc1)C2	1842365247	QXNPBZDSJWQNDF-UHFFFAOYSA-N	445.284	1.461	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1n[nH]c(C3CC3)c1F)C2	1843415494	MASDPWLDPQAJDX-WYMPLXKRSA-N	441.467	1.377	50	20	IDGD	
O=C1CC(C(=O)N2CCCC23CN(C(=O)[C@H](Br)Cc2ccccc2)C3)=NN1	1844224520	BSNOQQSRUPADMJ-CQSZACIVSA-N	433.306	1.072	50	20	IDGD	
Cc1cc(C(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)cc2c[nH]nc12	1844265055	QKPAAUUPIPKUHP-UHFFFAOYSA-N	433.472	1.001	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@]2(NC(=O)OC(C)(C)C)CCOC2)C1	1845208867	CYJBKVXHZRUJBG-VLIAUNLRSA-N	445.944	1.127	50	20	IDGD	
COc1cc(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](O)CCl)cc([N+](=O)[O-])c1OC	1847561864	JNEFVOSVGZTHGQ-SGMGOOAPSA-N	427.841	1.027	50	20	IDGD	
C=CCO[C@H](C)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CN(C)NC(=O)NCc1ccccc1	1847813497	JLZPDYRMGQQEQJ-HOJAQTOUSA-N	443.548	1.126	50	20	IDGD	
C[C@H]1Oc2ccccc2O[C@H]1C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	14330734	GEDHXECJKZFIDM-AUUYWEPGSA-N	445.497	1.461	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc(F)c(F)c1)NNC(=O)c1cccc([N+](=O)[O-])c1	17330401	BLJVLGKLWBRYMU-UHFFFAOYSA-N	428.373	1.003	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)Cc2csc(N3CCCC3=O)n2)cc1	18071640	ZBOYGSCXWRFFSX-CYBMUJFWSA-N	432.502	1.826	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCN(Cc2ccc(C#N)cc2)CC1	28972455	ZCFQPEQEAZZGQA-UHFFFAOYSA-N	441.919	1.799	50	20	IDGD	
Cc1nc(SCC(=O)NNC(=O)CNC(=O)c2ccco2)[nH]c1Cc1ccccc1	725740408	UWNNPKVIKXBISZ-UHFFFAOYSA-N	427.486	1.571	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=S)NCc2ccc(S(N)(=O)=O)cc2)c1C	726445289	VBENBRHWDDDRJX-CQSZACIVSA-N	436.559	1.414	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)C	727115945	SNGTZOVPEFSXDK-ZDUSSCGKSA-N	441.554	1.598	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(C(=O)NNC(=S)NCC2CCC2)ccc1Br	727866020	KTNBTKYFMWEUEO-UHFFFAOYSA-N	449.396	1.608	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)N[C@H](CN1CCN(C)CC1)c1ccccc1	727946359	WZCLVEBGNVFDLR-FXAWDEMLSA-N	443.523	1.912	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)C1=NN(c2ccccc2)C(=O)CC1	728210241	KVMXMFPEPYLSGG-UHFFFAOYSA-N	427.486	1.753	50	20	IDGD	
CC(C)C[C@H](NC(=O)c1ccc(Cl)cc1)C(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1	728370793	CEIIMSRFLTWCHK-HIFRSBDPSA-N	429.926	1.067	50	20	IDGD	
C[C@H]1CN(c2ccc(C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)cn2)C[C@@H](C)O1	728848225	ZYBKIXRNUKTJTJ-IYBDPMFKSA-N	439.520	1.163	50	20	IDGD	
CN(Cc1ccc(Br)o1)C(=O)NNC(=O)c1csc(N2CCOCC2)n1	728944617	HLUOILBFKPDSAK-UHFFFAOYSA-N	444.311	1.822	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)CCc2c(C)nc3[nH]n(C)c(=O)c3c2C)c1	729258419	UNCPTFVCTTUBAD-UHFFFAOYSA-N	425.489	1.654	50	20	IDGD	
O=C(CSc1ccccc1C(=O)NNC(=O)c1cnn[nH]1)Nc1ccc2c(c1)OCO2	729455403	BPDQBUIJMSBODK-UHFFFAOYSA-N	440.441	1.339	50	20	IDGD	
O=C(NCC1(N2CCCC2)CCOCC1)NNC(=O)c1nn(-c2ccccc2)cc1O	729624232	UJFVUYOUWSUCBX-UHFFFAOYSA-N	428.493	1.167	50	20	IDGD	
CCOc1ccccc1C(=O)N1CCC[C@@H]1C(=O)NNC(=O)COc1ccccc1O	730780589	ZHBIHZDZQFFKFB-MRXNPFEDSA-N	427.457	1.622	50	20	IDGD	
O=C(COc1ccccc1O)NNS(=O)(=O)c1ccc(I)cc1	730812550	TWQJYKPJROBWKG-UHFFFAOYSA-N	448.238	1.385	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)[C@H]1CCCN(S(=O)(=O)c2ccccc2)C1	732301944	ORDWAGCZGWVINY-HNNXBMFYSA-N	437.543	1.634	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)N[C@@H]1CCN(c2ccccc2C(N)=O)C1	732595557	RUTCZYNIFYEDCM-UKRRQHHQSA-N	429.452	1.301	50	20	IDGD	
CN1CCN(c2ccc(CNC(=O)NNC(=O)NCc3ccc(Cl)cc3)cn2)CC1	732990756	RLDKJZIKHLKDNF-UHFFFAOYSA-N	431.928	1.700	50	20	IDGD	
C[C@@H]1CN(C(=O)NNC(=O)CNC(=O)c2cccs2)C[C@@H](C)N1C(=O)OC(C)(C)C	733342884	PDLLNYCSBCWJJY-CHWSQXEVSA-N	439.538	1.548	50	20	IDGD	
CCCCS(=O)(=O)N1CCC[C@@H]1C(=O)NNC(=O)c1ccc(CN(CC)CC)o1	734125417	GKNCHYFHIDMJAY-MRXNPFEDSA-N	428.555	1.477	50	20	IDGD	
COc1ccc(C(=O)NNc2cc(C)ncn2)cc1S(=O)(=O)NCc1ccccn1	734254198	NHOPOJUWZUNGRR-UHFFFAOYSA-N	428.474	1.424	50	20	IDGD	
CC(=O)N1CCCc2ccc(S(=O)(=O)NNC(=O)c3ccc4c(c3)OCCO4)cc21	736064616	WJUDDHNSDVEVLD-UHFFFAOYSA-N	431.470	1.380	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@H](C)C(=O)N2CCCC[C@@H]2C)c2ccccc2c1=O	737054711	SUCXTQWQWCNPSA-UONOGXRCSA-N	428.493	1.150	50	20	IDGD	
O=C(NCCNc1nccc(C(F)(F)F)n1)NNC(=O)c1nnc(O)c2ccccc12	739046713	VALSEHOEZVIIEE-UHFFFAOYSA-N	436.354	1.200	50	20	IDGD	
Cc1ccc(NCCCNC(=O)NNC(=O)COc2ccc(C#N)cc2)c([N+](=O)[O-])c1	740489725	JSIQPNKIUATJGX-UHFFFAOYSA-N	426.433	1.986	50	20	IDGD	
C[C@@H]1CN(CC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)CC[C@@H]1NC(=O)OC(C)(C)C	740881706	AYMXNLKOMRIWDQ-CJNGLKHVSA-N	435.481	1.591	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCN(Cc2c(C)noc2C)CC1	742593795	HZPQDOGSFBZMEX-UHFFFAOYSA-N	435.912	1.532	50	20	IDGD	
CCOCCOc1ccc(Br)cc1C=NNC(=O)Cc1cc(O)nc(O)n1	743447850	PZFSPZQJBDEHNH-UHFFFAOYSA-N	439.266	1.758	50	20	IDGD	
CCc1ccc(N2CCN(CC(=O)NNC(=O)c3ccc(OC)c(OC)c3)CC2)cc1	744422407	FKXXFUXDXYPEOA-UHFFFAOYSA-N	426.517	1.849	50	20	IDGD	
CN(CC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)C[C@H]1CCN(Cc2ccccc2)C1	744425985	NKAVAIQVDHNCDL-GOSISDBHSA-N	425.489	1.810	50	20	IDGD	
C[C@H](Oc1ccc(C#N)cc1)C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	744622140	OBWRZJBJPIVVMQ-HNNXBMFYSA-N	430.486	1.490	50	20	IDGD	
Cc1cc(N2CC[C@H](NC(=O)NNC(=O)[C@@H](C)Oc3cccc(C)c3C)C2=O)n(C)n1	745906869	VYBWNPGHTHAGHF-CVEARBPZSA-N	428.493	1.249	50	20	IDGD	
COc1cc(OC)cc(N2CC[C@@H](NC(=O)NNC(=O)COc3cccc(C)c3)C2=O)c1	747956838	WHAMALFXLDQCCW-LJQANCHMSA-N	442.472	1.527	50	20	IDGD	
O=C(COC(=O)C1(S(=O)(=O)c2ccccc2)CC1)NNC(=O)c1ccc(Cl)cc1	748135277	DPFLQEWGVUIFNN-UHFFFAOYSA-N	436.873	1.651	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2cc(F)cc(C(=O)O)c2)cc(OC)c1OC	749141414	JKCJUUNRICPONX-UHFFFAOYSA-N	428.394	1.173	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)[C@@H]1CCCN1C(=O)c1ccc2c(c1)OCO2	749720971	PLNZZZOTEUQVBK-INIZCTEOSA-N	440.456	1.288	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1c(C)c2ccccc2oc1=O	750015384	XZPTXQHBEMCBKR-UHFFFAOYSA-N	428.470	1.778	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)NC[C@H]1CCN(c2ccccc2OC)C1	750330694	HETKXEBDADRVQJ-MRXNPFEDSA-N	428.489	1.940	50	20	IDGD	
CNS(=O)(=O)CC(=O)NNC(=O)c1ccc(COc2ccc(Cl)c(C)c2)cc1	751558266	RMEFMHNTCQCIHU-UHFFFAOYSA-N	425.894	1.538	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)OCc2noc(C)n2)cc1	753475228	DEAQLYDITHQUGF-DHDCSXOGSA-N	436.428	1.776	50	20	IDGD	
O=C(CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@H]12)NNC(=O)c1cc(-c2ccccc2)[nH]n1	754178428	OCWBRLQJZAXWMJ-BQFCYCMXSA-N	428.518	1.564	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)c2ccnc(O[C@H]3CCOC3)c2)cc1C	755048947	HVYYZIJEOABIOY-AWEZNQCLSA-N	433.486	1.800	50	20	IDGD	
CCc1nnc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(CC)CC)c2)s1	755404184	BTLDPIMEWDGYSG-UHFFFAOYSA-N	426.524	1.598	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)Cc2c[nH]c3ccccc23)n([C@@H]2CCS(=O)(=O)C2)n1	755537570	WJTJDXFWZVMKIV-CQSZACIVSA-N	430.490	1.428	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)Nc2ccc(OCC(F)(F)F)nc2)c2ccccc2c1=O	755871691	RCLLERZILCMJGL-UHFFFAOYSA-N	436.350	1.736	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)Nc1ccc(C(=O)N2CCOCC2)cc1	755933644	MSLVNUYHPWUQCC-UHFFFAOYSA-N	428.445	1.399	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)Nc1ccc(S(=O)(=O)NCC2CC2)cc1	756784672	PZDMASNSNPIWQL-UHFFFAOYSA-N	432.502	1.779	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1ccc(Oc2cccc(Cl)c2Cl)nc1	758044923	AOMHYKHHWWCHIK-VIFPVBQESA-N	447.300	1.879	50	20	IDGD	
O=C(NCC1CCN(Cc2ccccc2Cl)CC1)NNC(=O)C(=O)Nc1ccccn1	758741125	AYJQPEBPTXSSIA-UHFFFAOYSA-N	444.923	1.916	50	20	IDGD	
C[C@H](NC(=O)OC(C)(C)C)[C@@H]1CCCN(CC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)C1	758781152	VWVYSLMUKPQRRK-GOEBONIOSA-N	449.508	1.981	50	20	IDGD	
Cc1nnc(-c2cccc(C(=O)OCC(=O)NNC(=O)[C@@H]3COc4ccccc4O3)c2)o1	758978805	OFNNITCYGWOPBG-KRWDZBQOSA-N	438.396	1.189	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNc1ncccc1[N+](=O)[O-]	759294364	LTOURUQADMYOEO-UHFFFAOYSA-N	435.462	1.087	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NC[C@H](C[C@@H](C)O)c2ccccc2)nc1	759610511	MDTKCZWEKVVEFA-WBVHZDCISA-N	435.550	1.949	50	20	IDGD	
Cc1cc([N+](=O)[O-])cc(S(=O)(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c1F	760345373	YTHDICRLZYOIHQ-UHFFFAOYSA-N	431.423	1.069	50	20	IDGD	
COc1ccc2c(c1)[C@H](C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1)CC2	761972267	MQTZTTZVFVUYAP-QGZVFWFLSA-N	431.514	1.889	50	20	IDGD	
CNS(=O)(=O)c1ccc(Sc2ccccc2C(=O)NNC(=O)c2cc(C)[nH]n2)cc1	763136332	NBUVRUWUBQOBBE-UHFFFAOYSA-N	445.526	1.852	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2cccc(OC(F)(F)F)c2)ccc1Cl	763143197	SGZXEPGJJSANPV-UHFFFAOYSA-N	437.783	1.961	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)OCC(=O)NNC(=O)c2ccc(C)cc2)c1C	763283484	JIVSQBUUPMBQRZ-NDENLUEZSA-N	438.484	1.971	50	20	IDGD	
COC(=O)c1cccc(S(=O)(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)c1C	763438547	BFRHQFHQEMVYRQ-UHFFFAOYSA-N	429.495	1.396	50	20	IDGD	
CCN(CC)C(=O)Cn1ccc2cc(NC(=O)C(=O)NNC(=O)c3ccccn3)ccc21	763463846	NBYIZQMQKFUNRL-UHFFFAOYSA-N	436.472	1.304	50	20	IDGD	
C[C@@H](CC(=O)NNC(=O)C(=O)Nc1ccccn1)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	763565309	ZJMBBUIBBHVXEI-LSDHHAIUSA-N	433.509	1.841	50	20	IDGD	
C[C@H](C#N)CSc1ccccc1NC(=O)C(=O)NNC(=O)[C@H]1COc2ccccc2O1	763578333	ORHMASNRXQFARA-CXAGYDPISA-N	440.481	1.864	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc3c(c2)CCCN3C(C)=O)cc1	763658863	FVEHPUJLQHSQQN-UHFFFAOYSA-N	440.456	1.159	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(OC(F)F)c(F)c2)cc1	763661950	QUUJBABQOHAJLI-UHFFFAOYSA-N	427.335	1.601	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)C(=O)Nc1ccccc1CC(F)(F)F	763790826	PPMYZOPQYUKOFY-UHFFFAOYSA-N	433.346	1.840	50	20	IDGD	
Cn1cc(NC(=O)C(=O)NNC(=O)c2nc(-c3ccccc3)n(-c3ccccc3)n2)cn1	763803961	IQSCDTVXMBDIFQ-UHFFFAOYSA-N	430.428	1.068	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])c2cccnc12	763803997	QNLDIFZIEGTBSN-UHFFFAOYSA-N	439.384	1.317	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccccc2Cn2cncn2)c1C	763851229	RGTOCJNHFDINOI-MRXNPFEDSA-N	436.472	1.497	50	20	IDGD	
CCn1nnnc1-c1cccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)c1	763863696	AWVSPVGASKGKNU-LBPRGKRZSA-N	441.423	1.053	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)C(=O)Nc1cccc(Br)c1	763945584	ZQXIGNUBFFRANE-UHFFFAOYSA-N	444.245	1.740	50	20	IDGD	
O=C(NNC(=O)c1cnccn1)C(=O)Nc1ccc(Br)c(C(F)(F)F)c1	764030802	GXJBMLICLYSCKT-UHFFFAOYSA-N	432.156	1.658	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)nc1)C(=O)Nc1cc(F)ccc1OC[C@H]1CCCO1	764102293	YDPVOBIIMKMZDU-CYBMUJFWSA-N	436.827	1.832	50	20	IDGD	
CCCNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)CCc2ccc(OC)cc2)c1	764124163	DQUZWLUWDVFTPZ-UHFFFAOYSA-N	426.473	1.554	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(-n3ccnc3C)nc2)o1	764138088	AKSBISFGOOSPAI-UHFFFAOYSA-N	439.476	1.410	50	20	IDGD	
O=C(COC(=O)COC/C=C\c1ccccc1)NNC(=O)[C@@H]1COc2ccccc2O1	764196124	LTUSKTIJOJUHAX-QBUQCISBSA-N	426.425	1.247	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1	764345947	NTSOROFDACQOJD-UHFFFAOYSA-N	428.792	1.834	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cccc4[nH]ccc34)n[nH]2)cc1OC	764377247	BJIUMXOAOYYORO-UHFFFAOYSA-N	448.439	1.975	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2cccs2)[nH]n1)C(=O)Nc1ccc(-n2cncn2)c(F)c1	764382376	IUKVGYDTWIWOCI-UHFFFAOYSA-N	440.420	1.258	50	20	IDGD	
O=C(NNC(=O)[C@H](O)CCc1ccccc1)c1cccc(S(=O)(=O)N2CCCC2)c1	764583849	BTEOYTCJIHXSME-LJQANCHMSA-N	431.514	1.226	50	20	IDGD	
C[C@@H](c1ccsc1)N1CCN(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)CC1	765245916	VKPZNFSBHWGAQD-INIZCTEOSA-N	443.577	1.874	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)cc1	766258873	NZPSPMWJIYNVAO-AWEZNQCLSA-N	442.428	1.968	50	20	IDGD	
CNC(=O)c1cc(Oc2ccccc2NC(=O)C(=O)NNc2nccnc2OC)ccn1	766260610	HXKSWMXDWCQLIO-UHFFFAOYSA-N	437.416	1.114	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(C(=O)NC(C)C)cc2)cc1OC	767801339	MLZQAOXPMAPVJG-UHFFFAOYSA-N	443.456	1.460	50	20	IDGD	
CC(=O)Nc1ccc(Cl)c(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1	768098005	SAZJRQGMFHXLJZ-KRWDZBQOSA-N	447.831	1.443	50	20	IDGD	
CC[C@@H](Nc1c([N+](=O)[O-])c(C)nn1C)C(=O)NNC(=O)c1cc(-c2cccs2)[nH]n1	768263551	UJTKIZHPMQUFAS-SNVBAGLBSA-N	432.466	1.740	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H]2CCOC3(CCC3)C2)c1	769193508	KFFRIMVVNZVYEG-INIZCTEOSA-N	438.550	1.763	50	20	IDGD	
COCCNS(=O)(=O)c1cccc(C(=O)NNc2ccnc(Br)c2)c1	771553971	SLVGAKPFSVBJCI-UHFFFAOYSA-N	429.296	1.526	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)cc1S(C)(=O)=O	772188389	MPVWHGMJUBSISB-UHFFFAOYSA-N	437.905	1.383	50	20	IDGD	
Cn1cc(NC(=O)C(=O)NNC(=O)COc2ccc(C(C)(C)C)cc2)c(C(F)(F)F)n1	773519825	KNWNIWSRKUOXKX-UHFFFAOYSA-N	441.410	1.901	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1cc(-c2cc(F)cc(F)c2)nn1C	773542385	YVFRWDMKYAFZLX-UHFFFAOYSA-N	443.410	1.703	50	20	IDGD	
CS(=O)(=O)Nc1ccc(OCCNC(=O)NNC(=O)Cn2ccc3ccccc32)cc1	773543851	QBTIFSCZANPKGD-UHFFFAOYSA-N	445.501	1.422	50	20	IDGD	
CCOC(=O)[C@@H](NC(=O)OC(C)(C)C)C(=O)NNc1nc2ccccc2c(=O)n1CC	776616371	XXEJDWAZVWYZIC-AWEZNQCLSA-N	433.465	1.316	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(OCC(=O)NNC(=O)Cc2cn3ccccc3n2)CC1	777162826	NRCBJGHKUUYUJV-UHFFFAOYSA-N	431.493	1.440	50	20	IDGD	
COc1c(F)cc(S(=O)(=O)NNC(=O)c2cccc(OC(F)F)c2)cc1[N+](=O)[O-]	777623650	HYUBGWFTBPKPSO-UHFFFAOYSA-N	435.336	1.967	50	20	IDGD	
C[C@H]1OC(C)(C)N(C(=O)OC(C)(C)C)[C@H]1C(=O)NNC(=O)CNC(=O)OC(C)(C)C	778445934	XDUCAYCSAFAQKV-DGCLKSJQSA-N	430.502	1.419	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(Oc2ccccc2)c(C#N)c1	778712767	HXFHBGXWXDRAAI-AWEZNQCLSA-N	426.429	1.488	50	20	IDGD	
O=C(NCCS(=O)(=O)NC[C@H]1CCCCO1)NNc1ccccc1OC(F)(F)F	779572488	UTFBAJDOSOQZGT-GFCCVEGCSA-N	440.444	1.700	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12)c1ncn(C)n1	780703797	SHMMRDASLFURCZ-AWEZNQCLSA-N	446.471	1.279	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN(C)[C@@H](C)c2ccc(-n3cncn3)cc2)cc1OC	780724087	AVFIWKCMJQWDKA-HNNXBMFYSA-N	438.488	1.739	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)cc1OC(C)C	782885792	IXGMKLQVAHFINW-UHFFFAOYSA-N	439.472	1.698	50	20	IDGD	
CCc1ccc(NC(=O)C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)cc1F	782896959	LBRHWPFIQSKAKW-UHFFFAOYSA-N	435.481	1.389	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccc(OC(C)C)nc2)nc1	783262189	BQQLKFIUWAFDPQ-UHFFFAOYSA-N	436.494	1.032	50	20	IDGD	
Cc1nn(CC(C)C)c(C)c1S(=O)(=O)NNC(=O)CCCNC(=O)OC(C)(C)C	783842767	XIQIZOFASBMTOV-UHFFFAOYSA-N	431.559	1.770	50	20	IDGD	
CCN(CC)CCNC(=O)c1cc(NC(=O)C(=O)NNc2cc(C)ncn2)ccc1Cl	783945233	VMNFNRLTXFLQHO-UHFFFAOYSA-N	447.927	1.592	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)[C@H](F)C(C)C)N(S(C)(=O)=O)CC2	784145107	MWEPGIZTWDXCJH-RDTXWAMCSA-N	445.513	1.094	50	20	IDGD	
O=C(NNc1ccc(Br)cn1)C(=O)Nc1cccc(Cn2cccnc2=O)c1	784340875	GGMTXOQNSWQUOR-UHFFFAOYSA-N	443.261	1.531	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1cc(NC(=O)C(=O)NNc2ccc(Cl)nn2)ccc1F	784789681	MURNISAXCMPEBV-UHFFFAOYSA-N	444.876	1.428	50	20	IDGD	
CCCNC(=O)[C@H]1CN(C(=O)C(=O)NNc2cc(F)c(F)cc2F)c2ccccc2O1	784886616	PMRQJOLYCLWYGU-QGZVFWFLSA-N	436.390	1.867	50	20	IDGD	
CCNC(=O)N(C)NC(=O)C(=O)Nc1cc(C(=O)OC)ccc1OCc1ccccc1	784917200	HLCFFIWKDLBMOF-UHFFFAOYSA-N	428.445	1.683	50	20	IDGD	
C#CCOc1ccc(NC(=O)C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)cc1	785099510	HLZQSRWFJZMDHO-UHFFFAOYSA-N	428.395	1.951	50	20	IDGD	
CCNC(=O)Nc1ccc(C)c(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)c1	787542689	FGEKOVDHXPDSLH-UHFFFAOYSA-N	441.444	1.307	50	20	IDGD	
Cc1c(C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)nnn1CC1CCCC1	789187591	GAPXENVNOIIGAE-UHFFFAOYSA-N	430.421	1.303	50	20	IDGD	
COc1nc(Br)ccc1NC(=O)C(=O)NN=c1sc2ccccc2n1C	789594305	IOIQMTHSNBNIFS-UHFFFAOYSA-N	436.291	1.977	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)c1n[nH]c2c1CCCCC2	789814508	RVFLQLIPCIORHL-UHFFFAOYSA-N	444.967	1.911	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)[C@@H]3CC(c4cccnc4)=NO3)n[nH]2)cc1OC	790829955	JPSVVTWQXRDZKR-IBGZPJMESA-N	436.428	1.443	50	20	IDGD	
CN1CCC(Oc2ccc(CNC(=O)NNC(=O)[C@H]3COc4ccccc4O3)cc2)CC1	790926070	KSMFPASBNFVUSI-OAQYLSRUSA-N	440.500	1.830	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C[C@@H]2COCCN2C(=O)OC(C)(C)C)nc2ccccc21	794765602	BBNSYJZBATXXSB-CQSZACIVSA-N	431.493	1.289	50	20	IDGD	
Cc1cccc(C(=O)NNS(=O)(=O)c2cc(Br)c(F)cc2[N+](=O)[O-])n1	795361758	QJQCVCXLBBKTRD-UHFFFAOYSA-N	433.215	1.823	50	20	IDGD	
Cc1ncsc1C(=O)NNC(=O)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1C	797534970	IPVMWRFXCDOLQK-UHFFFAOYSA-N	442.251	1.830	50	20	IDGD	
Cc1ccc(-c2ccnn2C)cc1NC(=O)C(=O)NNC(=O)c1ccc2c(c1)OCCO2	799258862	OCSJLRYDGYANNE-UHFFFAOYSA-N	435.440	1.566	50	20	IDGD	
CC(=NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1c[nH]c2ccc(Br)cc2c1=O	799874096	WGPFUZASICYAKS-SNVBAGLBSA-N	426.292	1.566	50	20	IDGD	
CCc1oc(C=NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1C(=O)OC	800805564	SKQHOKUSKLQRKA-UHFFFAOYSA-N	449.485	1.413	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@H]2C(=O)NNC(=O)N=c2cc[nH]cc2)cc1	802025208	WRSSJQWLIBBEHA-SFHVURJKSA-N	445.501	1.102	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)CN2C(=O)c3ccccc3N3C(=O)CC[C@]23C)cc1	802052256	MFLBOXNGYNUAAO-JOCHJYFZSA-N	437.456	1.847	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)[C@H]2CC(=O)N(c3ccc4c(c3)OCCO4)C2)cc1	802059612	MBIZAIAXLAMBFM-ZDUSSCGKSA-N	426.429	1.672	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)CS[C@@H]2CCS(=O)(=O)C2)cc1Cl	802076813	XRQPSQQJJKSMIG-SECBINFHSA-N	437.927	1.430	50	20	IDGD	
COc1cc(-n2cnnn2)c(Cl)cc1C(=O)NNC(=O)Nc1ccc2c(c1)OCO2	802099947	FQAXBXPOKDNVLD-UHFFFAOYSA-N	431.796	1.520	50	20	IDGD	
O=C(NCCNS(=O)(=O)c1cccc(Cl)c1Cl)NNC(=O)c1ccccc1	804892487	SXSNEXOWLNSRGK-UHFFFAOYSA-N	431.301	1.916	50	20	IDGD	
CCNC(=O)COc1ccc(CNC(=O)NNc2ccc3c(=O)[nH]ccc3c2)cc1OC	806377944	VDLAQCRVDNNGTP-UHFFFAOYSA-N	439.472	1.878	50	20	IDGD	
COCCNC(=O)[C@H](C)OC(=O)c1ccc(NC(=O)NNC(=O)c2cccc(C)n2)cc1	806746769	VRHUHZXFILKUHI-AWEZNQCLSA-N	443.460	1.164	50	20	IDGD	
CC1(C)CC(=O)c2cc(NC(=O)C(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)ccc2O1	806972242	MWVMDUPDORAYHL-UHFFFAOYSA-N	426.385	1.738	50	20	IDGD	
Cc1cc(-c2csc(NC(=O)C(=O)NNC(=O)[C@H]3COc4ccccc4O3)n2)c(C)o1	806972481	AXDUHZUAJFFFDK-MRXNPFEDSA-N	442.453	1.946	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2cnn(CC(C)C)c2C2CC2)c1	806974309	DUWWNXXBGYPLMD-UHFFFAOYSA-N	429.477	1.833	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2O1)C(=O)Nc1ccc(F)cc1OC1CCOCC1	806977271	BWTQZZNVXKBFMY-IBGZPJMESA-N	443.431	1.473	50	20	IDGD	
COc1ccc(CCNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1OC	806986354	KVKYRPRBDDJZSD-UHFFFAOYSA-N	435.506	1.184	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNc2nccnc2C2CCC2)cccc1C(=O)N1CCOCC1	807462125	KWMGXULGJCAKBR-UHFFFAOYSA-N	438.488	1.607	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)N[C@@H](C)CN(C)C)c2)c(C)c1	807576983	YWHLDEWOTWYORR-INIZCTEOSA-N	447.561	1.998	50	20	IDGD	
Cc1ccc(Sc2nsc(NC(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)n2)cc1	810244980	MBZPVIVMSMPKSM-SECBINFHSA-N	430.537	1.088	50	20	IDGD	
Cn1nnc2c1C[C@H](C(=O)NNC(=O)[C@@H]1Cc3ccccc3CN1Cc1ccccc1)CC2	810273107	IMLSALPYZDSSMU-XXBNENTESA-N	444.539	1.695	50	20	IDGD	
O=C(NN=C1CC(C(=O)O)(c2cccc(Br)c2)C1)[C@H]1CCS(=O)(=O)C1	814782191	SFVFCDJCJIZTLP-VQVVDHBBSA-N	429.292	1.472	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)C[C@@H]2Sc3ccc(Cl)cc3NC2=O)C[C@@H](C)O1	842471120	BPIMBZACMJBXRL-OZVIIMIRSA-N	440.953	1.790	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N(C)c2ccc(OCC(=O)NNC(=O)C3CC3)cc2)cc1	859375131	PRWRZQIJCNVJSX-UHFFFAOYSA-N	447.513	1.847	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)c2cnn(Cc3cccs3)c2n1	887554347	VLQVFQUTQNXWMQ-LBPRGKRZSA-N	433.515	1.045	50	20	IDGD	
Nn1c(SCC(=O)OCC(=O)NNC(=O)c2cccs2)nnc1C1CCCCC1	913240072	RGAXPDHMXMYAFF-UHFFFAOYSA-N	438.535	1.198	50	20	IDGD	
CCCc1ccc(N2C[C@H](C(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)CC2=O)cc1	914279604	ALTDOJFESXSUEP-MRXNPFEDSA-N	447.495	1.700	50	20	IDGD	
CC(C)CNS(=O)(=O)c1ccc(C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)cc1	914749819	MGWGWYXXOXJNDO-CQSZACIVSA-N	437.493	1.989	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@H]2CC(=O)N(Cc3ccccn3)C2)ccc1OC(C)C	914881268	GKVDDMIFHBJORR-INIZCTEOSA-N	426.473	1.687	50	20	IDGD	
CCN(CC)C(=O)N1CCC(C(=O)NNC(=O)c2nn(CC)c(=O)c3ccccc23)CC1	915055148	YETWZXKNOMCRTR-UHFFFAOYSA-N	442.520	1.351	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)CCc1nc(-c2ccccn2)no1	915063978	WLUSXIGOBRSYNO-UHFFFAOYSA-N	443.489	1.127	50	20	IDGD	
NC(=O)c1ccc(S(=O)(=O)N2CCN(C(=O)CCCC[C@@H]3CCSS3)CC2)o1	915297099	AFRCASUVCRAHQE-CYBMUJFWSA-N	447.604	1.926	50	20	IDGD	
COc1c(F)cc(CC(=O)NNc2cccc(Br)c2)cc1S(N)(=O)=O	915638930	TZMUTUYISDGEBB-UHFFFAOYSA-N	432.271	1.930	50	20	IDGD	
O=C(NCc1ccncc1)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	915880327	AETMILHILBZYHM-UHFFFAOYSA-N	428.456	1.928	50	20	IDGD	
CC(=NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1)c1cccc(OCC(=O)O)c1	916276584	JJHYBIZXCRNALP-UHFFFAOYSA-N	433.486	1.619	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)NCc2ccc(C(=O)N3CCN(C)CC3)cc2)c1	916389864	BHDHTARQSKYGPD-UHFFFAOYSA-N	439.516	1.292	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NCCN2CCC[C@@H](C)C2)c2ccccc2c1=O	916452488	MUNQKKPIYNITLA-MRXNPFEDSA-N	428.537	1.873	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCCCN2CCN(c3ccccc3)CC2)cc1OC	916489827	QAZPOABSBNTMOI-UHFFFAOYSA-N	441.532	1.860	50	20	IDGD	
COc1ccnc(NNC(=O)CN(C)S(=O)(=O)c2ccc(Br)cc2)n1	917099636	POCAIZOCYXWSMN-UHFFFAOYSA-N	430.284	1.012	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc(Br)cc1)NNC(=O)CC(F)(F)F	918364050	IDYMKFMIHKDZFF-UHFFFAOYSA-N	432.218	1.217	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)[C@@H]2CCCN(S(=O)(=O)CC)C2)cc1OC	918550345	HCNMMVFYNPJVMK-MRXNPFEDSA-N	441.550	1.697	50	20	IDGD	
CC(C)N1C(=O)c2ccc(C(=O)NNC(=O)Cn3cnc4ccccc43)cc2S1(=O)=O	919689976	JOZBYQJBAJYZFK-UHFFFAOYSA-N	441.469	1.050	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)NCCS(=O)(=O)c2ccc(Cl)cc2)cc1	919786765	YSFBJRJBEXWXCJ-UHFFFAOYSA-N	436.877	1.395	50	20	IDGD	
CNC(=O)CN(C)C(=O)/C(C#N)=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	920849005	KZASVXVKAGWVGY-NTEUORMPSA-N	428.880	1.190	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)CC2(CC(=O)N3CCOCC3)CCCC2)c1	1321497262	GQCFRCBWLLGIRK-UHFFFAOYSA-N	432.521	1.454	50	20	IDGD	
COc1ccc2[nH]c(C)c(C(=O)OCC(=O)NNC(=O)[C@@H]3COc4ccccc4O3)c2c1	1334627782	NPMHARZCXOXBTM-SFHVURJKSA-N	439.424	1.629	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cccn3c(O)nnc23)C1	1777955730	NYURKBCUBSQGIW-WHSLLNHNSA-N	449.939	1.970	50	20	IDGD	
Cn1nc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)c2c1CCC2	1777963343	QKRIRCPCIUKMCZ-MOPGFXCFSA-N	429.348	1.589	50	20	IDGD	
O=C(c1cc2cn[nH]c2cn1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1778781210	QNTANJXIZVXFSS-CZUORRHYSA-N	426.246	1.092	50	20	IDGD	
COC(=O)c1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)cn1	1779295765	WVCAQRWBFWVAIC-HXUWFJFHSA-N	435.553	1.163	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccnnc2O)C1	1779963853	GZRMIPABIORLLP-RVZJWNSFSA-N	441.326	1.341	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(-c4ccccc4)[nH]n3)C2)C1	1780291450	ZVFQATHHIRWBDQ-HRAATJIYSA-N	432.908	1.774	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)COc3ccc(C(=O)OC)cc3)CCO2)C1	1781226514	ZPGKOGGMLFFNNJ-UWJYYQICSA-N	438.908	1.699	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCBr)C2)c1cnn2c1CCC2	1781281839	JQMZYRKBAYTMGF-VQIMIIECSA-N	439.354	1.742	50	20	IDGD	
O=C(c1ccc(Br)cc1O)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1781522084	AGNUKANYWDOVRA-RHSMWYFYSA-N	447.713	1.198	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccccc3C(N)=O)C2)C1	1781761323	FCBKZYSCCUYWQQ-BEFAXECRSA-N	438.322	1.403	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3nn(C)c4c3CCC4)CCO2)C1	1783533627	CHMAJKLJVNJOFN-KZULUSFZSA-N	425.327	1.136	50	20	IDGD	
O=C(/C=C/C(=O)N1CCO[C@@]2(CCN(C(=O)C(Cl)Cl)C2)C1)NCc1ccccc1	1783940596	XQJXMWUYRBKMPF-YJJPMGAVSA-N	440.327	1.493	50	20	IDGD	
Cc1cnn(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]3C2)c1	1783966001	YMRUSTPUVPRNIS-UGUYLWEFSA-N	427.343	1.202	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3cnccn3)C[C@@H]21	1783973475	BHXFTMBWFHUJMN-OHFALNGGSA-N	439.354	1.420	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CCCN3Cc3ccccc3)C[C@@H]21)[C@@H](O)CCl	1784096398	WDQVKPYXGVAXHA-SXYSDOLCSA-N	449.979	1.230	50	20	IDGD	
CCOC(CC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2)OCC	1784165767	GAOGDFXHYJCAES-GOEBONIOSA-N	425.295	1.296	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](C)Oc3cccnc3)C2)C1	1784547486	PIUZLDCPDSZCQC-DEYYWGMASA-N	426.311	1.462	50	20	IDGD	
CC(=O)OC[C@@H](OC(C)=O)C(=O)NC1(c2ccc(NC(=O)[C@@H](O)CCl)cc2)CCC1	1786134188	BGXMUKJYKBKOHN-DLBZAZTESA-N	440.880	1.215	50	20	IDGD	
Cc1nc(N)sc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)CBr)C[C@@H]21	1786916679	WCNNZZWYQQSBHI-IXOXFDKPSA-N	445.383	1.658	50	20	IDGD	
O=C(CCBr)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1	1787672871	IXVPQSHXCJSQHH-UHFFFAOYSA-N	445.122	1.899	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)c3nc[nH]c3[N+](=O)[O-])CCC2)cc1)c1ccc(B(O)O)cc1	1788141276	SAJULWPSIUWPIC-UHFFFAOYSA-N	449.232	1.059	50	20	IDGD	
CC[S@](=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]21	1788492591	ZRXKTJNRQQTVSX-DKFQIZQTSA-N	427.394	1.361	50	20	IDGD	
Cn1ncc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Br)C[C@@H]32)c1Cl	1789084395	OYHDCPGMRDSCCF-VGDYDELISA-N	437.697	1.357	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(C)(C)CCl)C[C@@H]21	1790173877	QEYPGIZBYRIMQM-RZLSGREXSA-N	447.960	1.074	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc([N+](=O)[O-])o3)C[C@@H]21	1790961287	KCTFMZHKNDIBPT-MNXVOIDGSA-N	444.282	1.955	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)COc3cccnn3)C[C@@H]21	1790963779	MCIXMVPNMFQCIR-AJNGGQMLSA-N	441.326	1.009	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)c3ccccc3)C[C@@H]21	1791057505	FAAYQLXIRQYPCA-VFTHGPRRSA-N	425.323	1.483	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3n[nH]c4ccc(C#N)cc34)C[C@@H]21	1791256587	CTKXNAOFYHWMRU-MBGYTDRXSA-N	445.907	1.282	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]3C2)ccc1F	1791293940	PYNJKLWGJPXLCA-LNLFQRSKSA-N	434.512	1.100	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1ccc(C2(NC(=O)CN(C)C(=O)C(=O)O)CCC2)cc1	1791435922	MGFVWOYAROIVPY-LLVKDONJSA-N	440.294	1.447	50	20	IDGD	
COC[C@H](NC(C)=O)C(=O)NC1(c2ccc(NC(=O)[C@H](Cl)COC)cc2)CCC1	1791569388	TWRNOLANSYFGBG-SJORKVTESA-N	425.913	1.525	50	20	IDGD	
O=C(/C=C/c1ccc(O)c(O)c1O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Cl)C[C@@H]21	1792219542	XURCUZAGDOYYPZ-GEMNDURDSA-N	428.844	1.331	50	20	IDGD	
COC(=O)[C@H]1CC[C@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CO[Si](C)(C)C)C3)C1	1792969880	RFBHAMRNPKHPKN-FDPKGLCPSA-N	426.586	1.017	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1n[nH]c3cc(Cl)ccc13)C2)[C@@H](O)CCl	1792981843	XPLWTGMYRYXKAB-OWLDWWDNSA-N	427.288	1.019	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C12CC(C(F)(F)F)(C1)C2)c1ccc(B(O)O)cc1	1793709304	OUTYCLKLNVWLOR-CVMQENGJSA-N	436.239	1.351	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCc1ccc(F)nc1	1794016225	HHHAPJKZANBRTH-LJGDNWOOSA-N	442.329	1.774	50	20	IDGD	
Cn1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)n1	1794141345	VEGPZVWRYKYBFP-FQLMCAECSA-N	439.944	1.804	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1c(F)c(C)nn1C	1794497323	YCNLHWNUMKCAMH-GFQSEFKGSA-N	431.306	1.244	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1cnc2ccoc2c1	1796232693	COOPNMSDEHNWMI-JLUCKKNBSA-N	426.242	1.722	50	20	IDGD	
Cc1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](F)Cl)C3)n(-c2cccc(=O)n2C)n1	1796388778	LVAQIXOHTAIYLZ-AHXJXLJNSA-N	435.887	1.666	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NO[C@H](c2ccccc2)C1)c1cccc(B(O)O)c1	1797752166	TXKWRYBNIHZSOO-IIZPIQPGSA-N	447.300	1.136	50	20	IDGD	
C[C@@H](Nc1cnccn1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@](C)(Cl)CCl)C2	1797780645	QODCESNFQLNVQT-XPNGNPLTSA-N	430.336	1.103	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN1CCc3sccc3C1)C2	1799263284	JHSCVPUDVWIUKS-YYAJDYIMSA-N	425.982	1.713	50	20	IDGD	
COc1cccnc1CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@](C)(Cl)CCl	1799274326	XSGPIOFZPKPVAJ-ZZXMYQEDSA-N	444.359	1.849	50	20	IDGD	
COc1ccccc1CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Br	1799343423	WLZXPNAZAJOJBE-LTCOOKNTSA-N	443.313	1.908	50	20	IDGD	
COc1ncc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Br)cc1F	1799347045	CUHVUTBVSGCLQN-LYIQGSDWSA-N	434.237	1.123	50	20	IDGD	
CCOc1cccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)Br)c1O	1800759860	MFJYWTCUBROBEE-NFFDBFGFSA-N	441.322	1.778	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc3ccoc13)C2	1801013255	YSHALYPENSKIRK-CWPLJXCYSA-N	428.489	1.009	50	20	IDGD	
C#CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](Cl)COC	1802283184	PUPCNMDVEHTGLX-ZHCJQAHYSA-N	441.956	1.795	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cnc3ncccn23)[C@@H]1c1cccnc1)[C@H](O)CCl	1803143190	WKLPHUJJNRBOTG-USXIJHARSA-N	428.880	1.044	50	20	IDGD	
CC1(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](O)CCl)C3)CN(C(=O)OC(C)(C)C)C1	1804579466	ZAYQCIDTDQWTQF-FZKCQIBNSA-N	443.972	1.871	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC2(CCCN(C(=O)COc3ccc(O)cc3)C2)CC1	1805256130	UXRGBCONSAFDDA-UHFFFAOYSA-N	446.548	1.375	50	20	IDGD	
COc1ccc(CC(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)cc1	1806582848	FDCHDVPSEBBQCY-FBBABVLZSA-N	431.920	1.938	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)c2ccccc2F)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807359979	FYZZMNRCWIARIX-GCJKJVERSA-N	447.275	1.534	50	20	IDGD	
C[C@H]1CC[C@H](C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)CC1	1807376399	YSGXPWWICKGNJD-SVVKQXANSA-N	449.360	1.907	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)[C@H]2CCC(=O)NC2)[C@H]1c1cccnc1	1812862709	CSYQMDZZLXNMRZ-QEWYBTABSA-N	437.338	1.397	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)C[C@@H](N)c2cccnc2)[C@H]1c1cccnc1	1813032027	UFONXSDZWBKKMA-HUUJSLGLSA-N	445.951	1.826	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)CSc2nc[nH]n2)[C@H]1c1cccnc1	1813349974	FCDZYKBEXXAOEG-IJEWVQPXSA-N	438.941	1.252	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ncccn2)n[nH]1	1816503060	PHZGCFWMRGBDNQ-NLOAGFHQSA-N	449.475	1.640	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)C13CC(C1)C3)CC2	1817282536	IEWIXELLADTSKR-WYQOQFIBSA-N	440.529	1.989	50	20	IDGD	
COc1ccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)cn1	1817470292	OEYRIPDBWWUGHW-GOSISDBHSA-N	449.276	1.113	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](O)CCl)CC2)c1n[nH]c2c(F)cccc12	1819228054	OIHGMZOINGMRLL-UFBFGSQYSA-N	437.884	1.984	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](F)Br)[nH]n1	1819583212	GLPXFSSFNUECJI-OLUVUFQESA-N	430.278	1.783	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)Cc2ccncc2)n[nH]1	1820720960	ABOZLIBYTDBQFR-KRWDZBQOSA-N	427.509	1.413	50	20	IDGD	
C=C(C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1)C(F)(F)F	1822416789	PJHUQAGGQMHBTA-ZDUSSCGKSA-N	430.431	1.893	50	20	IDGD	
O=C(N[C@@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1)c1c[nH]c(=O)cn1	1823006835	IWSSAPDGXIBVEP-KSBSHMNSSA-N	430.259	1.143	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H]3CNC(=O)C3)sc2C1	1825190986	GEJFWOHWOVGKHJ-OPRDCNLKSA-N	429.340	1.222	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CN1CCCCC1=O)CC2	1825647040	ICYCRCTYALEERX-GHMZBOCLSA-N	443.367	1.851	50	20	IDGD	
Cc1noc(C)c1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1	1825861401	FHUCNUGHVWMFNU-GOSISDBHSA-N	433.553	1.898	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(C(=O)O)ncn1)CC2	1825993024	DEWDTEMLXHFHKC-DTWKUNHWSA-N	439.881	1.111	50	20	IDGD	
O=C(C[C@H]1CCCCO1)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827050037	FFLLEPAHROJERV-FGZHOGPDSA-N	442.365	1.559	50	20	IDGD	
O=C(c1cccs1)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827055670	BYASBRBNCFCLDD-IBGZPJMESA-N	426.347	1.975	50	20	IDGD	
C[C@H](Cc1ccncc1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830365188	BHFFBAPFJPEVFS-VGOFRKELSA-N	437.968	1.982	50	20	IDGD	
Cc1cccc2[nH]c(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)[C@@H](O)CCl)CCO4)cc12	1830731699	OMKKPSQCLUVXAY-GHTZIAJQSA-N	435.908	1.146	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CN(CCO)CCO)CC1	1831481649	FTVHVJSZYRXYAX-SFHVURJKSA-N	432.005	1.158	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CN3CCC(C)CC3)C2)C1	1831639482	ACHVNPQBPBAOFV-GHTZIAJQSA-N	429.989	1.582	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)[C@H]2CC[C@H](O)CC2)CC1	1831997286	ZEVAMAFTQOYLEB-NYVOZVTQSA-N	442.365	1.151	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)C(=O)c3ccco3)CCO2)C1	1832667438	FFKDZRKUDLWTRF-ACJLOTCBSA-N	443.294	1.092	50	20	IDGD	
Cc1cncc(CCC(=O)N2CCO[C@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)c1	1832962733	LBZWHCBLAUGLKH-LJQANCHMSA-N	430.332	1.583	50	20	IDGD	
CC(C)(CCl)C(=O)NC1CCN(C2CCN(C(=O)[C@@H]3CCNC(=O)C3)CC2)CC1	1833216027	NBSPVTGCHMRCOP-OAHLLOKOSA-N	426.989	1.349	50	20	IDGD	
CCOc1ccsc1C(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)CCl)CC2)CC1	1833306322	BGLSYVRTTKPIMV-INIZCTEOSA-N	443.997	1.932	50	20	IDGD	
Cc1nc(CC(=O)N2CCC(N3CCC(NC(=O)[C@@H](O)CCl)CC3)CC2)cs1	1833308458	STBMUOKQLVPVQY-KRWDZBQOSA-N	428.986	1.165	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)C3Cc4ccccc4C3)CC2)CC1)[C@@H](O)CCl	1833313851	WHIINZDZQGCOEP-NRFANRHFSA-N	433.980	1.573	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3cc(O)ncn3)CC2)CC1	1833555753	IBYPZRYNAZJRAW-GFCCVEGCSA-N	440.342	1.151	50	20	IDGD	
C[C@H](Nc1ccccn1)C(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836718474	PMZUCQUOQTZSAZ-MAUKXSAKSA-N	438.956	1.480	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cn4cccnc4n3)CCO2)C1	1836885300	ROMJVXVLRDKQCM-FOIQADDNSA-N	435.912	1.207	50	20	IDGD	
Cn1nncc1C(=O)N1CCC(OC2CCN(C(=O)[C@H](F)Br)CC2)CC1	1837231493	RHDDLYULIQLMKY-AWEZNQCLSA-N	432.294	1.118	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)C#CC3(O)CCCCC3)CCO2)C1	1837492081	ABFQUYZAYRJWMU-UWJYYQICSA-N	426.941	1.159	50	20	IDGD	
Cc1cc(/C=C/C(=O)N2CCO[C@@]3(COCCN(C(=O)CCBr)C3)C2)no1	1837554136	DKORUUQJHSVCHT-ZMUQKWFASA-N	442.310	1.238	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(F)nc3F)C2)C1	1837708377	DZAGZBPSKLQVNF-IBGZPJMESA-N	443.523	1.281	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)c3cc(O)no3)CC2)CC1	1838482564	LFOZTFIFGGQUFL-LLVKDONJSA-N	430.299	1.776	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)n(C(F)F)n1	1838716588	WIQNMLGAUIHOPL-INIZCTEOSA-N	441.262	1.460	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3nccc(Cl)c3OC)CCO2)C1	1838727563	KDXPRSURXFCDNT-ORAYPTAESA-N	446.331	1.831	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3snnc3C3CC3)C2)C1	1839144918	OHXVYTGRIUEGAK-SCLBCKFNSA-N	428.942	1.503	50	20	IDGD	
Cc1cccc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)n1	1839198583	JJRZXNHRHQIQOM-WMZOPIPTSA-N	444.301	1.079	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc3ccnn13)CCO2	1839498882	VXXBOFYMAVWXSV-OAQYLSRUSA-N	446.580	1.256	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)C(C)=O)C2)C1	1839961656	DUJSBYWSBINXPY-KDOFPFPSSA-N	433.343	1.232	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)cc1Cl	1840731343	JRUOGGAYZPFEIB-HNAYVOBHSA-N	447.315	1.018	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCCC12CN(C(=O)Cn1cccn1)C2	1841924480	QZAAGBVONHBBTB-AWEZNQCLSA-N	425.917	1.219	50	20	IDGD	
O=C(CCc1cnc2ccccc2c1)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843010330	DQLJURGPPFMDFD-UHFFFAOYSA-N	443.312	1.364	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)c2csc(-c3cccnc3)n2)C1	1843444765	RJYGHMBFLDQBBB-UHFFFAOYSA-N	442.545	1.395	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)C1(C(F)(F)F)CCC1)C2	1844263982	QZIMRNUOVALAEF-UHFFFAOYSA-N	425.411	1.235	50	20	IDGD	
CN(CC(=O)N1CCCC12CN(C(=O)C1=COCCC1)C2)NC(=O)NCc1ccccc1	1845039347	GUAPIVUBCZPVFY-UHFFFAOYSA-N	441.532	1.230	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)C2	1846385906	JNJFRQZXCJSHFJ-MHWRWJLKSA-N	445.470	1.448	50	20	IDGD	
COC(OC)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](Br)Cc1ccccc1	1847696070	OTGPQNSSZLZELW-PMPSAXMXSA-N	425.323	1.813	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H]1CC(=O)N(Cc2cccs2)C1	1848148503	DEVZKJMYWGQFBS-IWCQGFGOSA-N	439.965	1.552	50	20	IDGD	
CC(C)Oc1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1	3324541	FJDNSPBQMKKWCH-UHFFFAOYSA-N	447.513	1.570	50	20	IDGD	
CS(=O)(=O)c1ccc(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1	15314895	LDPBLWJJPPTVCV-UHFFFAOYSA-N	430.530	1.063	50	20	IDGD	
CC(C)N(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1	15795023	RHBMYYVKQWKITN-SFHVURJKSA-N	433.486	1.317	50	20	IDGD	
Cc1cccc2c(=O)n(CC(=O)OCC(=O)NNC(=O)c3ccc(Cl)cc3)cnc12	18398698	AXHXIBLRKZPHAK-UHFFFAOYSA-N	428.832	1.363	50	20	IDGD	
CCCc1nnc(S)n1CC(=O)NNC(=O)[C@H](C)Oc1cccc(Br)c1	24312601	LNOXQHWFLSCKRJ-JTQLQIEISA-N	442.339	1.897	50	20	IDGD	
O=C(COC(=O)c1sccc1S(=O)(=O)N1CCCC1)NNC(=O)c1cccs1	25806810	RKCJOSPHHCAVOI-UHFFFAOYSA-N	443.528	1.212	50	20	IDGD	
Cn1c(=NNC(=O)c2ccc(S(=O)(=O)N3CCOCC3)cc2)sc2ccccc21	254616788	VAQPAVNTFACUEB-UHFFFAOYSA-N	432.527	1.506	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](CNC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)C1	725860495	QLSSYYRPRMIDHX-CQSZACIVSA-N	444.496	1.253	50	20	IDGD	
CCN(CC(=O)N[C@H]1CCS(=O)(=O)C1)S(=O)(=O)c1ccc(CCCCl)cc1	726972160	MESWXJYORHRYDV-HNNXBMFYSA-N	436.983	1.172	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)N(C2CC2)[C@@H]2CCS(=O)(=O)C2)N(C)c2ccccc21	728868785	YOYYJNBSJNBORC-MRXNPFEDSA-N	442.541	1.835	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNS(=O)(=O)c2cc(C(=O)O)sc2C)cc1	729663223	YDDXFLZPQFQDME-SNVBAGLBSA-N	428.488	1.930	50	20	IDGD	
O=C(COC(=O)CCCc1ccc2nc(O)[nH]c2c1)NNC(=O)c1ccc([N+](=O)[O-])cc1	730376736	RHALMBFANKCNEQ-UHFFFAOYSA-N	441.400	1.504	50	20	IDGD	
CC(C)n1nc(C(=O)NN=C2CCN(CCN3CCOCC3)CC2)c2ccccc2c1=O	731557664	VQFJGJMKXLQQKY-UHFFFAOYSA-N	440.548	1.491	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCc2cn3c(C)cccc3n2)cc1	731761881	LLKFDOJEICEZSE-UHFFFAOYSA-N	444.517	1.102	50	20	IDGD	
Cc1nn(-c2ccccc2)c(C)c1C(=O)C(=O)NNC(=O)CCN1C[C@H](C)O[C@H](C)C1	732259297	CIYQHLDUVJMIBS-GASCZTMLSA-N	427.505	1.319	50	20	IDGD	
COc1ccc(-c2noc(CCC(=O)NNC(=O)CCN3C[C@H](C)O[C@@H](C)C3)n2)cc1	732260223	QJKPPIPDVYBQLQ-GJZGRUSLSA-N	431.493	1.325	50	20	IDGD	
C[C@@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)NNc2ccccc2S(C)(=O)=O)C1=O	732301556	DDCMPRPBEKDTDK-IBGZPJMESA-N	434.449	1.140	50	20	IDGD	
CCc1nc(CN2CCC(CNC(=O)NNC(=O)CNC(=O)c3ccco3)CC2)cs1	732470714	PDTJQNAOINVGAO-UHFFFAOYSA-N	448.549	1.271	50	20	IDGD	
Cc1ccccc1-n1cc(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cn1	732653843	LPOUEQWQFABTSO-UHFFFAOYSA-N	433.877	1.556	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)N[C@@H]2CCN(c3ccccc3F)C2=O)cc1OC	732892889	IQEVLWKFGVPWMX-OAHLLOKOSA-N	430.436	1.983	50	20	IDGD	
NC(=O)c1ccccc1N1CC[C@H](NC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)C1	733348403	NEDUPOAEPVBJTI-INIZCTEOSA-N	433.472	1.194	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)CC[C@@H]1NC(=O)N(c2ccc(C#N)cc2)C1=O	733777172	QGRQQURCHUURCY-INIZCTEOSA-N	445.439	1.181	50	20	IDGD	
O=C(Cn1nnc2ccccc2c1=O)NNc1cc(C(F)(F)F)nc(-c2ccccn2)n1	734258894	OZSAVYZDXHSNBP-UHFFFAOYSA-N	442.361	1.806	50	20	IDGD	
CC(=O)NCC(=O)N1CCc2cc(C(=O)NNC(=O)[C@H](C)Oc3ccc(F)cc3)ccc21	735647135	HTLDPHZFTONXLU-ZDUSSCGKSA-N	442.447	1.079	50	20	IDGD	
CC(=O)NCC(=O)N1CCc2cc(C(=O)NNC(=O)c3cc(-c4ccccc4)[nH]n3)ccc21	735687942	VIITZDIEXRZTDP-UHFFFAOYSA-N	446.467	1.177	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCC[C@H](c3nncn3C(C)C)C2)cc1OC	735872434	DIQICNOBCCVHHC-INIZCTEOSA-N	430.509	1.517	50	20	IDGD	
O=C(COC(=O)c1ccc(N2CCC(O)CC2)cc1)NNC(=O)c1ccc([N+](=O)[O-])cc1	740963034	RQPFUKBOZOXTDX-UHFFFAOYSA-N	442.428	1.174	50	20	IDGD	
O=C(COC(=O)c1ccccc1Cn1cccn1)NNC(=O)[C@H]1COc2ccccc2O1	741348458	XQVUXLJEQXVXFR-LJQANCHMSA-N	436.424	1.076	50	20	IDGD	
O=C(CCN1C(=O)[C@H]2[C@H](C1=O)[C@H]1CC[C@H]2O1)NNC(=O)c1cc2c(s1)CCCCCC2	742480971	OULSJFVHWJSXQY-TWKYDXJASA-N	445.541	1.721	50	20	IDGD	
Cc1ccc([C@@H](CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)N(C)C)cc1	743334146	OULIDFGSQQXPCC-LJQANCHMSA-N	447.561	1.492	50	20	IDGD	
COC(=O)N1CCC(NC(=O)NNC(=O)Nc2cc(Cl)c(OC)cc2OC)CC1	743581248	RHNVPFYCTKHFLU-UHFFFAOYSA-N	429.861	1.924	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)N[C@@H]1CC(=O)N([C@H]2C[C@@H]2c2ccccc2)C1	743700377	BDDPTFXUQGMGJV-WWNBULGVSA-N	436.468	1.314	50	20	IDGD	
C[C@@H]1CCN(CC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)CCN1Cc1ccccc1	744425751	BANHIMYIERTSQO-QGZVFWFLSA-N	425.489	1.952	50	20	IDGD	
CC(C)c1nn(C)c(Cl)c1C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	744620409	DUXIQTKGQRHXNH-UHFFFAOYSA-N	441.941	1.975	50	20	IDGD	
CC(C)S(=O)(=O)c1ccc(C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)cc1	744786555	VRQJXXJHXYPKIW-UHFFFAOYSA-N	429.454	1.358	50	20	IDGD	
CN1C(=C(C#N)C(=O)COC(=O)c2ccc(S(N)(=O)=O)s2)N(C)c2ccccc21	745258943	KVMQSQXYRLUIMM-UHFFFAOYSA-N	432.483	1.443	50	20	IDGD	
CSCC[C@H](C(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)N1C(=O)[C@H]2CCCC[C@@H]2C1=O	746022143	ABTBECRFWLSMRV-HRCADAONSA-N	448.501	1.653	50	20	IDGD	
COc1cc(C(=O)NNC(=O)N[C@H]2CCCN(CC(F)(F)F)C2=O)ccc1OC(C)C	746339840	RYYWFCFMLBSTPH-ZDUSSCGKSA-N	446.426	1.980	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)NCc1ccc(N2CCOCC2)c(F)c1	746758681	ODPQVLQJLTZIKV-UHFFFAOYSA-N	426.452	1.383	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)C1CCN(S(=O)(=O)c2cc(F)ccc2F)CC1	747597932	MRSSJYKZDARHDT-UHFFFAOYSA-N	426.445	1.165	50	20	IDGD	
COc1ccc(Br)c(S(=O)(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)c1	747617504	OLDKFGQDYQDVQR-UHFFFAOYSA-N	446.235	1.695	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)c3ccc[nH]3)CC2)cc1	747661777	APJNKQBTMKEJDF-UHFFFAOYSA-N	448.501	1.053	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)cc1Cl	748648502	RZBXVTGFDYFQIU-UHFFFAOYSA-N	428.810	1.536	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)[C@@H]1CCn2ccnc2C1	749258031	JCOCEZBILNNLPS-MRXNPFEDSA-N	430.940	1.064	50	20	IDGD	
C[C@H](NC(=O)c1n[nH]c2ccccc12)C(=O)NNc1nc(Br)cn2ccnc12	750248851	YCTKTTRSVPNEFU-VIFPVBQESA-N	443.265	1.630	50	20	IDGD	
O=C(CCNC(=O)C12CC3CC(CC(C3)C1)C2)NNC(=O)CNC(=O)c1cccs1	751209787	UDKKKEHSDACZOV-UHFFFAOYSA-N	432.546	1.348	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCc1c(F)c(F)cc(F)c1F	753038621	BRQZFOHWDJIKPW-UHFFFAOYSA-N	447.414	1.989	50	20	IDGD	
CCOC(=O)c1ccc(N2CC(NC(=O)NNC(=O)[C@H](C)Oc3ccc(F)cc3)C2)nc1	753279831	OMKGZCZPXZQUDQ-ZDUSSCGKSA-N	445.451	1.384	50	20	IDGD	
COCCOc1cc(C)ccc1CNC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	755253704	KNVFRNDRNFFYLC-UHFFFAOYSA-N	435.502	1.568	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(F)c(NC(=O)NNC(=O)c2cc(Cl)ccc2O)c1	756683318	LYJSTEQRZVNYQZ-UHFFFAOYSA-N	430.845	1.902	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Nc2cnn(CCN3CCOCC3)c2)ccc1OC(C)C	756827402	SXXVCHBCRBRBGH-UHFFFAOYSA-N	446.508	1.478	50	20	IDGD	
CCN(CC(=O)NNC(=O)c1cccs1)Cc1nc(O)c2cc(OC)c(OC)cc2n1	757220493	MWPDGAOOWFVQSR-UHFFFAOYSA-N	445.501	1.697	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(N2CCOCC2)c(C(=O)NN=c2cc[nH]cc2Cl)c1	757422612	ZRMHPYXULGOXPY-UHFFFAOYSA-N	439.925	1.001	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)CC12C[C@H]3C[C@@H](CC(Br)(C3)C1)C2	758044916	NDUSVONCNBKCDL-AALXLURJSA-N	436.372	1.196	50	20	IDGD	
O=C(CCc1nc(C2CCCC2)no1)N1CCN(S(=O)(=O)CBr)CC1	758514075	YOHBDONIVJHPQT-UHFFFAOYSA-N	435.344	1.486	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)C(=O)Nc1ccccn1)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	758748508	NXBGSQMRRSXUCK-ZIAGYGMSSA-N	434.497	1.386	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2cnn(CC(C)C)c2C(F)F)n1	758840494	UQAJVEKCWCKWJQ-UHFFFAOYSA-N	429.449	1.789	50	20	IDGD	
CNc1nnc(CC(=O)NNC(=O)COc2ccc(OCc3ccccc3)cc2)s1	759380031	UCVCPWAGSNZUTA-UHFFFAOYSA-N	427.486	1.928	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)Cn2cnc3ccc(Br)cc3c2=O)nc1	759721657	PVNUOUFGHHVAGM-UHFFFAOYSA-N	432.234	1.484	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3n2)c(C)c1	763465837	CMXFLPSUHWXZNQ-UHFFFAOYSA-N	436.424	1.495	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cc3c(cc2Cl)OCCO3)cc1OC	763543819	QUPFDZWZQAQVNI-UHFFFAOYSA-N	435.820	1.528	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)Nc1nc(-c2cccs2)cs1	763573047	WXRIQOUWYSZQSN-CYBMUJFWSA-N	430.467	1.798	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2ccc(-c3nccc(C)n3)cc2)c1	763771914	HLRVJRGEUWXWFU-UHFFFAOYSA-N	435.440	1.869	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(C)c([N+](=O)[O-])c2)cc1	763861319	NZLQCJIMIZQZRT-CYBMUJFWSA-N	430.417	1.855	50	20	IDGD	
O=C(CCSc1ccc(F)cc1)NNC(=O)C(=O)Nc1cccnc1N1CCOCC1	763896231	ZPJTXYGLLZMRQY-UHFFFAOYSA-N	447.492	1.326	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)C(=O)Nc1ccc(Cl)c2cccnc12	763917575	YDERTHZCQFFQSK-UHFFFAOYSA-N	436.819	1.264	50	20	IDGD	
Cc1c(COc2ccccc2)cccc1NC(=O)C(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1	763996576	DQCWJRDHKQUQAO-INIZCTEOSA-N	445.497	1.095	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)C(=O)Nc1cccc(CCCc2ccccc2)c1	764001959	HWDXHRSCIVNEAE-GOSISDBHSA-N	443.525	1.383	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1cnn(-c2cnc3ccccc3n2)c1	764040784	LUCIAZZFQDXGMH-UHFFFAOYSA-N	431.412	1.224	50	20	IDGD	
COc1ccc(Cn2nccc2NC(=O)C(=O)NNC(=O)C2CCCC2)c(OC)c1OC	764070426	KPMQYKUNZDWIGR-UHFFFAOYSA-N	445.476	1.233	50	20	IDGD	
COc1cc(Br)c(NC(=O)C(=O)NNC(=O)CC(F)(F)F)cc1OC	764115873	ZEBUPDFZRKRBLZ-UHFFFAOYSA-N	428.161	1.505	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)ccc1N1CCOCC1	764124502	JAPRVUXDOKUSPJ-UHFFFAOYSA-N	432.864	1.590	50	20	IDGD	
CN(C)c1ccc(NC(=O)C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)cc1Cl	764204116	SGOHRKPHRQBANV-UHFFFAOYSA-N	441.916	1.797	50	20	IDGD	
CSc1ccc(NC(=O)C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1Cl	764259885	KTQOYEXKEJQUDG-UHFFFAOYSA-N	448.936	1.854	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)C(=O)Nc1ccc(OCC(F)(F)F)nc1	764277370	CRTREDMVBCGYJF-UHFFFAOYSA-N	426.351	1.447	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C(=O)Nc1ccccc1C(=O)N1CCOCC1)c1ccccc1	764327953	IBDHTFSNNQYMBI-KRWDZBQOSA-N	438.484	1.439	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C(=O)Nc1cc(OC)c(OC)cc1C(=O)OC)c1ccccc1	764332195	OXPDQIFDMWEJGG-AWEZNQCLSA-N	443.456	1.770	50	20	IDGD	
CS(=O)(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)CCCc2cccs2)cc1F	764338847	FFYPQBDDXXYIAL-UHFFFAOYSA-N	441.506	1.541	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(CS(=O)(=O)c3ccccc3)c2)o1	764372028	UWSYKNKOONEEJE-UHFFFAOYSA-N	441.465	1.962	50	20	IDGD	
CC(C)C1CCC(NC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)CC1	764372649	CIXGDDSIXKOXRJ-UHFFFAOYSA-N	438.598	1.859	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2ccc(-n3nccn3)cc2)n[nH]1	764377903	RVMXTMRFCLCXRH-UHFFFAOYSA-N	446.427	1.066	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc(C(=O)OC)cc3)n[nH]2)cc1	764384506	BZDLRTMUCXRCBE-UHFFFAOYSA-N	435.440	1.825	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1ccc2cc(Br)ccc2c1	764401466	WYAOZBROSRWGJH-NSHDSACASA-N	438.278	1.740	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCCCN2CCCO[C@@H](C)C2)nc1	764572337	CXJLEMLNYPWGAC-INIZCTEOSA-N	442.586	1.239	50	20	IDGD	
C=CCN1C(=O)C(=NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)c2ccccc21	764826832	BOHWNVHLPYDIPD-UHFFFAOYSA-N	431.496	1.498	50	20	IDGD	
CCOC(=O)c1cnn(-c2cccc(NC(=O)C(=O)NNC(=O)OC(C)(C)C)c2)c1C	765388841	ANODUAHZKNVRCM-UHFFFAOYSA-N	431.449	1.852	50	20	IDGD	
COc1ccc(Cn2ncc(C)c2NC(=O)C(=O)NNC(=O)OC(C)(C)C)cc1OC	765389404	LGOKNLMADRYOFM-UHFFFAOYSA-N	433.465	1.751	50	20	IDGD	
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	765895649	XNNBZGXCUXKMMC-DNVCBOLYSA-N	434.500	1.398	50	20	IDGD	
O=C(NNc1nccc(N2CCOCC2)n1)[C@H]1CC(=O)N(c2ccc(Cl)c(F)c2)C1	767148755	QBCGMTUTLGRVFW-LBPRGKRZSA-N	434.859	1.602	50	20	IDGD	
Cc1cc(F)ccc1-n1cc(C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)nn1	767192420	SVPZGVGTKXVOHO-UHFFFAOYSA-N	445.480	1.391	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NN=Cc1cncc(Br)c1	767386245	CDKWMMSXXOOQFY-UHFFFAOYSA-N	430.306	1.752	50	20	IDGD	
CC(C)(C)OC(=O)N1CCO[C@H](CC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)C1	767828033	QOYIOYKFFLBXHI-OAHLLOKOSA-N	445.476	1.365	50	20	IDGD	
CC(C)Oc1cncc(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)c1	767961659	KSZJYAWJIPPCRP-UHFFFAOYSA-N	433.534	1.562	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2cnc(Cl)c(Br)c2)c1	768234710	YTGAXEXIRUSBMH-UHFFFAOYSA-N	441.669	1.971	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)NCC2(C)OCCO2)cc1	769025144	VSQHHGRZJRPJJX-WJDWOHSUSA-N	439.472	1.220	50	20	IDGD	
COc1ccc([C@H](CNC(=O)NNc2nc(O)c3cnn(C)c3n2)N2CCCC2)cc1	769819649	UIILZPUQDJCTGP-INIZCTEOSA-N	426.481	1.541	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)[C@](C)(O)C(C)C)c2)cc1	770207818	BMBJAAVGVZORGZ-HXUWFJFHSA-N	435.502	1.664	50	20	IDGD	
CC1CCN(c2ccc(C(=O)NNc3nc(O)c4cnn(C)c4n3)cc2[N+](=O)[O-])CC1	770981696	AUIVKQUDJREJFC-UHFFFAOYSA-N	426.437	1.970	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNS(=O)(=O)c1cc(C(=O)O)ccc1Cl	771609213	WTNWVZVXPHILQG-UHFFFAOYSA-N	446.268	1.318	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)O[C@H](C)C(=O)NNC(=O)CC(C)C)ccc1C	771931284	FKQHELWODPTLER-OAHLLOKOSA-N	441.550	1.764	50	20	IDGD	
Cc1cc(S(=O)(=O)NCCNC(=O)NNC(=O)c2cccc(Cl)c2)c(C)s1	772624564	KQKMENQMHFWRLE-UHFFFAOYSA-N	430.939	1.941	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1ccc(Cl)cn1	773488559	IHUIZDXJCBUWOQ-UHFFFAOYSA-N	425.898	1.894	50	20	IDGD	
CC[C@@H](C)NS(=O)(=O)Cc1cccc(NC(=O)C(=O)NNc2cccc(C#N)c2)c1	773686346	VCSFRRHFNCCGTM-CQSZACIVSA-N	429.502	1.858	50	20	IDGD	
COc1ccc(S(=O)(=O)NC2CC2)cc1NC(=O)C(=O)NNc1ccc(C#N)cc1	773702623	ZUCYKSSJHVOHMU-UHFFFAOYSA-N	429.458	1.089	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)N[C@H]3CCO[C@@]4(CCS(=O)(=O)C4)C3)cc2C1	776077007	PQUUKQWCLUREND-UHYGZKCKSA-N	441.575	1.553	50	20	IDGD	
O=C(CN1CCNC(=O)[C@@H]1c1cccc(Br)c1)NNC(=O)c1cccs1	777717187	QMBVZIFKAUJVCE-HNNXBMFYSA-N	437.319	1.445	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNS(=O)(=O)c1cc(Br)ccc1Cl	777939264	KPLLSZXHTMZBMZ-UHFFFAOYSA-N	442.719	1.937	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2c(N)ccc(Br)c2C)n1	778350454	DNBVQRZKABVIQL-UHFFFAOYSA-N	441.307	1.652	50	20	IDGD	
CC[C@H](C)C(=O)N1Cc2ccccc2C[C@@H]1C(=O)NNC(=O)CNC(=O)OC(C)(C)C	778441021	HMTKQQYAHLQHDM-WMLDXEAASA-N	432.521	1.658	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)CCc1nc(O)c2c3c(sc2n1)CCCC3	778441785	XKHIGEUGHLSAGN-UHFFFAOYSA-N	449.533	1.880	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)NCC2CCN(CC(F)(F)F)CC2)cc1C	780626175	OCEOAVBBJYZFQL-UHFFFAOYSA-N	429.443	1.847	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@]2(C[C@@H]2C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)C1	781280864	JDTBULCJOLKYLZ-ZHRRBRCNSA-N	442.472	1.510	50	20	IDGD	
CCOc1cc(N2CCOC(C)(C)C2)ccc1NC(=O)C(=O)NNC(=O)c1ccccn1	782121882	XQFKVGJPBILMDF-UHFFFAOYSA-N	441.488	1.495	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C(=O)Nc2cccc(OC(F)(F)F)c2)nc2ccccc21	782888026	RLKANYYRXYRYAD-UHFFFAOYSA-N	435.362	1.801	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)C(=O)Nc1cccc(Cl)c1C	782897568	QWHRYJVJRFQOOA-UHFFFAOYSA-N	437.909	1.650	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNc2cncc(Cl)n2)c(Br)cc1F	783258462	JOUBWAUHZJUICV-UHFFFAOYSA-N	446.620	1.900	50	20	IDGD	
Cc1cc(C)c(NNC(=O)C(=O)Nc2cnn(CC(=O)N3C[C@H](C)O[C@H](C)C3)c2)c(C)c1	783367241	WIFDVABLVMWUCC-CALCHBBNSA-N	442.520	1.526	50	20	IDGD	
CCCNC(=O)[C@H]1CN(C(=O)C(=O)NNC(=O)Nc2ccccc2C)c2ccccc2O1	783410674	FJNSNAZOGMBLTF-GOSISDBHSA-N	439.472	1.468	50	20	IDGD	
COC[C@@H]1CN(C(=O)NNC(=O)[C@@H](C)Oc2cccc(Br)c2)C[C@@H](C)O1	784058632	YBJSAETXDGKYJU-JMSVASOKSA-N	430.299	1.693	50	20	IDGD	
Cn1cc(NC(=O)C(=O)NNc2ccc(OC(F)F)cc2)cc(Br)c1=O	784313013	GSJHSEJBSRBFSB-UHFFFAOYSA-N	431.193	1.831	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2cccc([N+](=O)[O-])c2)cc1OCC(=O)NC1CC1	784833879	ULRMGQUIZMDNHQ-UHFFFAOYSA-N	443.416	1.343	50	20	IDGD	
COC(=O)c1[nH]c(C)cc1NC(=O)C(=O)NNc1c(F)cc(C(=O)NC2CC2)cc1F	785099437	FXHUVJMJMWGKMB-UHFFFAOYSA-N	435.387	1.362	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2O1)C(=O)Nc1cc(Br)c(F)cc1F	786417198	OTCSIPZWYIDBHS-AWEZNQCLSA-N	440.200	1.817	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)NNC(=O)[C@H]1CCCCN1C(=O)c1ccc(O)nn1	787429102	ORVHLQLGGKOPOP-OAHLLOKOSA-N	432.868	1.361	50	20	IDGD	
CCN(C(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cccn2C)ccc1Cl)C(C)C	787544526	SNUNJMLNZJQJEA-UHFFFAOYSA-N	433.896	1.949	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)cc1OC(C)C	787554446	BBDMKTUKFUFGAA-UHFFFAOYSA-N	449.533	1.946	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNS(=O)(=O)c1cc(Cl)c(Br)cc1F	788060203	VVKGPNFTRVRCES-UHFFFAOYSA-N	444.710	1.856	50	20	IDGD	
Cc1noc(-c2ccc(C(F)(F)F)cc2NC(=O)C(=O)NNC(=O)c2cnn(C)c2)n1	789734221	GWMVZWBSQJGPAQ-UHFFFAOYSA-N	437.338	1.197	50	20	IDGD	
CCOC(=O)C1(CC(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)CCC1	789806622	OQANHRJJAWFQMN-UHFFFAOYSA-N	425.507	1.274	50	20	IDGD	
Cc1ccccc1-n1nccc1NC(=O)C(=O)NNC(=O)[C@H]1OCC[C@H]1c1ccccc1	789810812	QPEBGPBCEIBYPA-PXNSSMCTSA-N	433.468	1.839	50	20	IDGD	
COc1cc(F)c(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)cc1OC	789813832	WKRDUEUDAIOCQP-UGSOOPFHSA-N	431.420	1.502	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)c1ccc(C)c(S(=O)(=O)N2CCCCC2)c1	790065956	USHNKBYWOUUNCG-UHFFFAOYSA-N	441.550	1.720	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)[C@H]2CCS(=O)(=O)c3ccccc32)cc1	790126830	MDSINVZMENGQNJ-KSSFIOAISA-N	432.498	1.961	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)[C@H](C#N)Cc2ccc(C#N)cc2)CC1	792187808	QNJROIQGTDIZMN-KRWDZBQOSA-N	440.504	1.970	50	20	IDGD	
CC(C)Cc1ncc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)cn1	792356400	ORXBQISXWRGHEP-UHFFFAOYSA-N	425.424	1.604	50	20	IDGD	
O=C(/C=C/C(=O)Nc1ccc2n[nH]cc2c1)NNC(=O)CNC(=O)OCc1ccccc1	794061509	HTTAQWMEUGGTSC-CMDGGOBGSA-N	436.428	1.131	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)[C@H]2CCCN(S(=O)(=O)c3ccc([N+](=O)[O-])cc3)C2)n1	794075016	GQSLOHGADCLWHO-AWEZNQCLSA-N	447.473	1.160	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNS(=O)(=O)c2cccc(CC#N)c2)cc1	794577963	DBFYRXGJWIWAPT-UHFFFAOYSA-N	442.526	1.797	50	20	IDGD	
O=C(NNC(=O)c1cc(F)c(Br)c(Cl)c1)N[C@@H]1CCS(=O)(=O)C1	795526961	GBYKOKQOSFJYQG-SSDOTTSWSA-N	428.667	1.373	50	20	IDGD	
COC(=O)c1cc(Cl)c(Cl)cc1NC(=O)C(=O)NNC(=O)Cc1ccncc1	797534957	IGEHGXYFOUQBCW-UHFFFAOYSA-N	425.228	1.504	50	20	IDGD	
C[C@@]1(CNC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)CCN(Cc2ccccc2)C1	798481808	NUQZWCURSDMDCD-QFIPXVFZSA-N	434.504	1.519	50	20	IDGD	
CSC[C@H](C)C(=O)N1CCC(C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)CC1	799416551	JQBHUWWYKJPEHM-ZDUSSCGKSA-N	445.586	1.079	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)C(C)(C)COCc2ccccc2)c1	800378771	GFXRSXNYSRLGIF-UHFFFAOYSA-N	433.530	1.941	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)cnc1Br	802068197	DVPOGAPHHQXKCO-UHFFFAOYSA-N	443.279	1.723	50	20	IDGD	
COc1cccc(/C=C(\C(=O)NNC(=O)Nc2ccc3c(c2)OCO3)n2nnnc2C)c1	802098128	YXWBBFBQBKDUDW-CXUHLZMHSA-N	437.416	1.570	50	20	IDGD	
C[C@@H](C(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)n1ccc2ccccc2c1=O	805628659	KBZHYHBRPRHLKC-ZDUSSCGKSA-N	438.396	1.475	50	20	IDGD	
COc1ccc(CS(C)(=O)=O)cc1NC(=O)NNC(=O)c1ccc(OC)c(OC)c1	806638690	LQXZSWKZTWZZIJ-UHFFFAOYSA-N	437.474	1.724	50	20	IDGD	
CSSCCNC(=O)N1CCC(C(=O)Nc2ccc(S(N)(=O)=O)cc2)CC1	807228239	SIJKSENSFYDNBT-UHFFFAOYSA-N	432.593	1.705	50	20	IDGD	
C[C@@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(NC(=O)C(=O)NNc3ncccc3F)cc2)C1	807301222	BFBWTNPWDYNIFB-ZIAGYGMSSA-N	449.508	1.969	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)N[C@@H](C1CC1)C(F)(F)F	808869552	KPOGBPOACGJLHM-AWEZNQCLSA-N	434.440	1.756	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)CNS(=O)(=O)c1ccc2ccccc2c1	810007543	KJEWPQSHQXOTCA-UHFFFAOYSA-N	442.497	1.386	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(=NNC(=O)[C@@H]2CCS(=O)(=O)C2)[C@@H]([C@H]2CCOC2)C1	812224140	BTXIPAWXMBOPDE-RRFJBIMHSA-N	429.539	1.187	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C[C@@H]2CN(Cc3ccccc3)CCO2)cc1	812729631	SDKMVJJPCCKBRM-LJQANCHMSA-N	432.546	1.671	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)CNC(=O)c1cccs1)c1ccc(N2CCCNC2=O)cc1	812882667	UGNLRNZRZNALLG-CYBMUJFWSA-N	444.517	1.489	50	20	IDGD	
CNS(=O)(=O)c1ccc(C)c(NC(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)c1	812936647	PZPVCPRFRAFYIV-UHFFFAOYSA-N	441.535	1.302	50	20	IDGD	
CN(C)c1ncc(C=NNC(=O)c2cccc(NN=Cc3cnc(N(C)C)nc3)c2)cn1	814701995	JVYYVDSZBHGQRH-UHFFFAOYSA-N	432.492	1.609	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2ccc([C@@H]3CCOC3)cc2)c2ccccc2c1=O	815565784	AALBHTLUAPTKBZ-OAHLLOKOSA-N	449.467	1.320	50	20	IDGD	
COc1cccc(C(=O)CCCC(=O)N2CCN(S(=O)(=O)CBr)CC2)c1	815965015	ZSGCULFQJSZZEB-UHFFFAOYSA-N	447.351	1.875	50	20	IDGD	
CNS(=O)(=O)NC1CCN(C(=O)/C(C#N)=C\c2cc(C)n([C@@H](C)COC)c2C)CC1	816468622	KJQOLPMOKZLJRK-GZQZNAIASA-N	437.566	1.264	50	20	IDGD	
Cc1cc(S(=O)(=O)Nc2ccccc2C(=O)N2CC[C@H](B(O)O)C2)cc([N+](=O)[O-])c1C	864233174	HQADBMYODQXQMC-AWEZNQCLSA-N	447.278	1.701	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)c1ccc(Cn2ccnc2)cc1	916099327	DCWJYRPXZXAYLB-UHFFFAOYSA-N	432.528	1.905	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)NCC2(NS(C)(=O)=O)CCCCC2)cc1	916253975	WPXDLIVMTHISJJ-UHFFFAOYSA-N	428.580	1.670	50	20	IDGD	
O=C(NCc1ccc(-n2cncn2)nc1)NNC(=O)c1ccc(COc2ccccc2)o1	916396192	ZEAXPHGKTMWJDX-UHFFFAOYSA-N	433.428	1.979	50	20	IDGD	
Cc1nnc([C@H]2Cc3ccccc3CN2CC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)o1	917194323	HEXVHJQFMJLYKG-GOSISDBHSA-N	436.428	1.847	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2ccc(C)c(F)c2)c1	917718366	WLGUGQWTTDWMBW-UHFFFAOYSA-N	443.522	1.788	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)NCCNC(=O)c2ccc(Br)cc2)c1	918001516	ACOZRDBOBWLWIR-UHFFFAOYSA-N	449.305	1.897	50	20	IDGD	
COc1cccc(CNC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c1OC	918233844	QAGZLDVDPDKYHC-UHFFFAOYSA-N	441.532	1.747	50	20	IDGD	
O=C(NNC(=O)N1CCCN(Cc2ccccc2)CC1)c1csc(N2CCOCC2)n1	918775945	GHECRIFZQCDNPD-UHFFFAOYSA-N	444.561	1.542	50	20	IDGD	
COC1(C(=O)OCC(=O)NNC(=O)c2ccccc2)CCN(C(=O)OC(C)(C)C)CC1	919518273	RFIGTFUCVDKVKJ-UHFFFAOYSA-N	435.477	1.407	50	20	IDGD	
O=C(CN1CCc2ccccc21)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	919963150	GXIOZMFQRYDTSQ-UHFFFAOYSA-N	442.541	1.685	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)c2ccccc2S(=O)(=O)N2CCOCC2)cc1	920012080	GSSHKXIHKWXLJL-UHFFFAOYSA-N	447.513	1.110	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)CN2C(=O)Cn3c(cc4ccccc43)C2=O)c1C	920274763	XNSQQURJKFDKTE-INIZCTEOSA-N	448.479	1.855	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)c2cc([N+](=O)[O-])cc(S(C)(=O)=O)c2)c1C	920288240	PLJZWHSAGTVJTJ-CYBMUJFWSA-N	435.458	1.844	50	20	IDGD	
C[C@@H](CN1C[C@@H](C)O[C@H](C)C1)C(=O)NN=Cc1c(Br)cc(C(=O)O)n1C	1116077156	OMXZYWJZDCYYTQ-QJPTWQEYSA-N	429.315	1.681	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3c[nH]c(Br)c3)CC2)cc1	1116292775	QORJXBLHTINQTP-UHFFFAOYSA-N	434.338	1.664	50	20	IDGD	
CN1CCN(c2ccccc2CNC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)CC1	1251635642	FXSJMXUVEGSAQQ-UHFFFAOYSA-N	449.515	1.474	50	20	IDGD	
O=C(NNC(=O)c1cncn1-c1ccccc1)c1cn(-c2ccc(C(F)(F)F)cn2)nn1	1318278373	JLNUBRMQUWVLMF-UHFFFAOYSA-N	442.361	1.942	50	20	IDGD	
Cc1ccnc(O)c1C(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	1319919519	XTVZLOTZCCTKEW-UHFFFAOYSA-N	440.481	1.649	50	20	IDGD	
CCC[C@H](CCCS(C)(=O)=O)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	1324901115	RFGUMMZUUZIUQX-OAHLLOKOSA-N	425.555	1.082	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)CN2CCN(C(=O)Nc3ccc(Cl)cc3)CC2)cc1	1325221730	CFWVTHHHSZLOID-UHFFFAOYSA-N	440.891	1.822	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4nccnc4c3)C2)C1	1777978741	ANTLQRMFDIBHFY-NRFANRHFSA-N	428.565	1.925	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H]1COc3ccccc3O1)CCO2	1779293748	BOWKFVKZGJHSDC-GHTZIAJQSA-N	434.565	1.508	50	20	IDGD	
C[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCO[C@@]2(CCN(C(=O)CO[Si](C)(C)C)C2)C1	1779301555	RDGXFUOTXGNNIN-FOIQADDNSA-N	443.617	1.581	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccnc(Cl)n3)C2)C1	1779505567	WHOHSBWCBLUEBB-BDJLRTHQSA-N	431.718	1.747	50	20	IDGD	
COC(=O)[C@@H]1CC[C@H](C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](F)Br)C3)C2)C1	1781325587	ODBVPRGQAGTYKJ-LKQDWFRTSA-N	435.290	1.096	50	20	IDGD	
O=C(CNc1ccc(F)cc1)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781331816	XWIFIWUBLREBDU-DOTOQJQBSA-N	432.265	1.758	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CNC(=S)NCC)C1	1781470491	FBEOAZKTJOMAAR-QMTMVMCOSA-N	433.018	1.392	50	20	IDGD	
Cc1nc(F)ccc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCC(=O)NN(C)C)C1	1782212341	VCGQJGPDKWBSAB-VGOFRKELSA-N	449.527	1.030	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cccc4nccn34)CCO2)C1	1783354255	XBJPIOOPJCPYFK-KUHUBIRLSA-N	435.322	1.951	50	20	IDGD	
Cc1c(C(=O)N2CCO[C@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)oc2ccccc12	1783934668	KFLOLGHLPVLEIC-QHCPKHFHSA-N	442.516	1.558	50	20	IDGD	
COC(=O)CCCCCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2	1784044676	XPVXCJDYJNFZAS-HNAYVOBHSA-N	447.370	1.971	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](O)c3ccccc3Cl)C2)C1	1784250566	HHAIEALTIIQGMT-MDZRGWNJSA-N	431.316	1.457	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccnc(C(F)(F)F)c3)[C@H]2C1	1785824495	QYPFMNJRJBAPGN-AJNGGQMLSA-N	449.857	1.948	50	20	IDGD	
COC(=O)[C@H]1CC[C@@H](C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCBr)[C@H]3C2)C1	1786404447	IVNAJCKKPYEKNM-YXMSTPNBSA-N	445.354	1.340	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21)[C@@H]1ON=C(c2ccccc2)O1	1788519818	AGIPOJCPIHFNDP-OXMIBSBGSA-N	425.844	1.235	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3nc(O)n4c3CCCC4)[C@H]2C1	1788788536	AZIXDOOYVQSFNO-JKQORVJESA-N	438.956	1.926	50	20	IDGD	
CCc1noc(C)c1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21	1788951304	WONTVVNQNPSXCT-TZQJONAQSA-N	432.290	1.829	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccnc3C(N)=O)C[C@@H]21	1789868331	CEYPVKHIALVFQU-LDBIXWDDSA-N	443.331	1.010	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3n[nH]c4c3CCCC4)C[C@@H]21)[C@H](F)Br	1789922637	JXARXEZVLQVAML-ZAJUMQRFSA-N	443.317	1.572	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(-n4cncn4)c3)[C@H]2C1	1790249164	UICQEAMFPFOKQT-KANFNMMFSA-N	447.923	1.114	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3snnc3C)C[C@@H]21	1790961559	LSKAKJLZMXXDCJ-RVMXOQNASA-N	431.356	1.613	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN3CCSCC3)C[C@@H]21	1790962441	YPYFYWZGVFYADX-VGWMRTNUSA-N	448.427	1.188	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)n3ccccc3=O)C[C@@H]21	1791056306	SDFFMDCXUBKEQV-QXKUPLGCSA-N	440.338	1.172	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@H]1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21	1791239447	VAQIRIDKLCBYBA-QRTUWBSPSA-N	433.332	1.525	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC1(c2ccc(NC(=O)CN(CCO)CCO)cc2)CCC1	1791328389	JGZKKMDSQNVVJS-LJQANCHMSA-N	446.375	1.643	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)COc1ccc(F)cc1	1795196461	ZVIUCYOAGORZAT-FLTUCWPJSA-N	443.313	1.825	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)[C@H]1CNc2ccccc21	1795621195	VKAYATCLHUYPAI-AREYPJKDSA-N	426.286	1.476	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2)C1CC1	1796360149	HAVANOWVDWJYSU-AICCOOGYSA-N	433.908	1.414	50	20	IDGD	
CC(C)(C)OC(=O)N1CCCC[C@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Cl	1796366389	NNWCAHQLGYVQMV-QRJUGERDSA-N	447.935	1.900	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(O)cc1F)C2	1798441796	LCNJCESOUDQLNM-CLLJXQQHSA-N	427.436	1.095	50	20	IDGD	
COc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)CBr)C3)c(O)c1	1798831394	MOHAWZPVUQBHLU-KOFHJDLBSA-N	441.322	1.635	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnc(Cl)s1	1798926925	JFSUKLFFTUUEIF-JGPRNRPPSA-N	434.909	1.361	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc3ncnn3c1)C2	1799276141	HDVGPZOQKULRAU-CSHUHZATSA-N	440.331	1.098	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(OC)ccn1)C2	1800642107	XGARXAVIKRGGOS-LMWOUKEDSA-N	426.311	1.467	50	20	IDGD	
C[C@@H](S)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](Br)Cc1ccccc1)C2	1800987438	QNBZZBJCCHHPGM-FMPTWSOUSA-N	441.391	1.901	50	20	IDGD	
COc1ccc(F)c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)Br)C3)c1	1801720091	WMOULHPHWKOJFW-LSSIXWDNSA-N	429.286	1.821	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(CO)c(F)c1	1801903257	QQQWSSRHAKUPLG-IVSAIRAKSA-N	443.313	1.695	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CNC(=O)c1ccc(C)cc1	1802114759	DBPNJLIIKSEDEM-AJYBTWMASA-N	435.952	1.722	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(OC(F)F)cn1)C2	1802333358	VGMBBGGQYPRFKO-BTTYYORXSA-N	439.463	1.308	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cnn3ccncc23)[C@H]1c1cccnc1)[C@@H](O)CCl	1803143239	XPPIUDYEENJUHH-WBAXXEDZSA-N	428.880	1.044	50	20	IDGD	
CC(C)(C)n1ccc(C(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@H]2c2cccnc2)n1	1805042182	YTFFSENWPDVNRC-JQHSSLGASA-N	433.940	1.952	50	20	IDGD	
O=C(CN1CCOCC1)NC[C@@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1	1806903626	GBGYIGBQRFITNM-QFBILLFUSA-N	439.354	1.205	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@@H](CNC(=O)Cn2cncn2)[C@H]1c1cccnc1	1807597437	VXTOHPCGWDOMTP-UKPHBRMFSA-N	435.326	1.410	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1CCN(C(=O)CSC(=N)N)[C@H]1c1cccnc1	1808297384	ZDGWRRJUUABPAE-JDFRZJQESA-N	432.377	1.950	50	20	IDGD	
Cc1cccn2ncc(C(=O)NC[C@@H]3CCN(C(=O)[C@H](O)CCl)[C@@H]3c3cccnc3)c12	1812268221	XKKUFHNNJDUEOL-ILZDJORESA-N	441.919	1.957	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2cc(=O)ccn2C)[C@H]1c1cccnc1	1813032243	VZKZONJZPSOUIG-AYBZRNKSSA-N	432.908	1.354	50	20	IDGD	
CC[C@@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1)N(CC)CC	1815333419	MJKYAXYVROMLDP-ROUUACIJSA-N	449.600	1.895	50	20	IDGD	
Cc1nnc(CC(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@H](F)Br)CC3)o1	1815491164	HNIQEPKVLVFMPV-KRTXAFLBSA-N	432.275	1.680	50	20	IDGD	
CC[C@H](C)[C@@H](N)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1817266483	WTJQUOYRYWHDJL-ULFGMLNVSA-N	442.524	1.088	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2CCC(F)(F)C2)[nH]n1)c1ccc(B(O)O)cc1	1817470813	ZDIAMWGYBNFKNV-PBHICJAKSA-N	446.263	1.831	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1cnccc1F	1817732822	KVQBDXIDZUCJAH-GOSISDBHSA-N	437.240	1.243	50	20	IDGD	
Cc1cc(NC(=O)CC(=O)Nc2cc([C@@H]3CCCCN3C(=O)[C@H](O)CCl)[nH]n2)no1	1818092397	ZNLQUTGTGKCMLC-QWHCGFSZSA-N	438.872	1.327	50	20	IDGD	
Cc1c(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@@H](O)CCl)CC3)nc2ccccn12	1818103416	YGGVGNCAFQUKOK-AAEUAGOBSA-N	433.921	1.925	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cn4cccnc4n3)sc2C1	1819030113	YGRHHOCXVDYZBS-MNOVXSKESA-N	434.909	1.665	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)C2=COCCC2)[nH]n1	1819404790	YZYKAACWDAVZNP-QGZVFWFLSA-N	439.476	1.408	50	20	IDGD	
Cc1nccn1[C@@H](C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1	1822883148	DICSSEXUEIFWMM-YOEHRIQHSA-N	444.540	1.541	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)C2=COCC2)n[nH]1	1822984866	KXIWAVUNDXOJEU-ZRWQFTNJSA-N	439.476	1.840	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)Cn3nccn3)sc2C1	1823119401	JQQXECIMKYOJML-ZJUUUORDSA-N	427.328	1.520	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccccc2O)CC1	1825667770	LFVCJYQVZUJSRC-LJQANCHMSA-N	430.549	1.999	50	20	IDGD	
CC1(C)CC(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cnccc2C(=O)NN)CC3)C1	1826202558	PNGJUZKZZVRJGW-LBPRGKRZSA-N	442.545	1.804	50	20	IDGD	
O=C([C@@H]1CCCOC1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827054479	GISQOWKBVPXHHF-CTNGQTDRSA-N	428.338	1.026	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(=O)n3[nH]nnc3n2)CC1	1827400214	IOJHGVRMAMUHLI-UKRRQHHQSA-N	435.916	1.063	50	20	IDGD	
O=C([C@@H](O)CCl)N1CCC([C@H]2CCCCN2C(=O)c2ccc3nc(CO)[nH]c3c2)CC1	1828097157	MSNQTGSITAYILA-MOPGFXCFSA-N	448.951	1.888	50	20	IDGD	
Cc1noc(C)c1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)CBr)CCO2	1830537461	ITHYMJLEABZPPA-XIKOKIGWSA-N	444.326	1.392	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3F)C2)C1	1830538831	RHIKZLXLPDOKQJ-ACJLOTCBSA-N	444.301	1.322	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccccc3F)C2)C1	1830542760	DBJVRJVOIMWVEA-LIRRHRJNSA-N	443.313	1.927	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)[C@H]2C[C@]2(F)Cl)CC1	1831957868	BGLKPFNAFJITLN-LVCYWYKZSA-N	436.720	1.524	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)COc3cccnc3)CCO2)C1	1832672061	NJIWRZXLSODEPA-PXNSSMCTSA-N	425.913	1.324	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CSc3ccncc3)CCO2)C1	1832709557	LAPQYYGBZHJJOO-LPHOPBHVSA-N	427.954	1.648	50	20	IDGD	
Cc1noc(C)c1CCC(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1833060693	SLUYLPOOWZVYCH-OAQYLSRUSA-N	441.956	1.945	50	20	IDGD	
Cc1c(F)cccc1C(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)CCl)CC2)CC1	1833306451	RSFQFFOIPLTFMP-IBGZPJMESA-N	425.932	1.919	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)/C=C/c3cccc(O)c3)CC2)CC1)[C@H](O)CCl	1833312380	SBYFRQSCWJCGCV-DPZZJQGRSA-N	435.952	1.577	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)Cc3c[nH]c4ccccc34)CC2)CC1)[C@@H](O)CCl	1833313527	JSABGXMJGZNLML-NRFANRHFSA-N	446.979	1.882	50	20	IDGD	
CCc1ncccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1	1833518988	IQIZMVVKFVQSBI-UXHICEINSA-N	444.359	1.950	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)c3cnn(C)c3)CC2)CC1	1834190402	CMYFDPUIPPYTBD-AWEZNQCLSA-N	440.386	1.636	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)c1cc2ccccn2n1	1835302424	SAVUQXAOFVZGPL-LJQANCHMSA-N	433.940	1.119	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](C)Nc3cnccn3)CC2)CC1	1835748208	TWFWJYNUPFMRCK-QAPCUYQASA-N	436.988	1.866	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1837715975	USAPWMZTUWIKJU-BBRMVZONSA-N	437.407	1.078	50	20	IDGD	
CCc1cnc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](Cl)COC)C3)C2)s1	1837726215	XXCOQMKRPCCLMM-KDOFPFPSSA-N	431.942	1.029	50	20	IDGD	
CC(C)(C)c1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)[nH]n1	1837993939	NIKBWFYOFGBRAQ-GOSISDBHSA-N	433.336	1.581	50	20	IDGD	
CCc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)no1	1838128299	KNYPVIOKPDQWKD-ROUUACIJSA-N	434.320	1.543	50	20	IDGD	
O=C(c1nc2ncccn2n1)N1CCC(OC2CCN(C(=O)C(Cl)Cl)CC2)CC1	1838227041	IVUYHVQRXFGRQT-UHFFFAOYSA-N	441.319	1.540	50	20	IDGD	
O=C(c1[nH]cc2c1CCC2)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1838454821	UPLSFZQSKVMHOG-MAUKXSAKSA-N	444.301	1.264	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc([N+](=O)[O-])[nH]3)CCO2)C1	1838825350	QHKVGSRBXUEDAC-FZKQIMNGSA-N	428.873	1.400	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(OC)ccc3F)C2)C1	1839148493	AKSIGCFUMGZMQW-OXQOHEQNSA-N	428.888	1.922	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(C4CC4)on3)C2)C1	1839149689	OIVGLBXFMHLAOG-MOPGFXCFSA-N	446.331	1.858	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C1(C(=O)OCC)CC1)CCO2	1839760036	ZESSHGFHBBGQNL-HNAYVOBHSA-N	430.929	1.194	50	20	IDGD	
C=CCC(F)(F)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1	1839889864	UDJRFIVNIFLKTH-HZPDHXFCSA-N	429.291	1.891	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccnc3Cl)C2)C1	1840029713	NEXANHYUGNMUQE-YVEFUNNKSA-N	446.729	1.588	50	20	IDGD	
CC(=O)C[C@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)CBr)C2)C1	1840126732	KFAFVZDAFUSTTG-IYOUNJFTSA-N	433.343	1.089	50	20	IDGD	
CCOc1ccsc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](Cl)COC)CCO2	1840149360	MPJSKQNVKJXBIB-IFXJQAMLSA-N	446.953	1.471	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CCc4ccoc4C3)C2)C1	1840150489	LTQGBIVQORDQIG-WWMYMODYSA-N	440.924	1.095	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3ccccc3F)C2)C1	1840156022	HKPAABPWRZERCT-DYESRHJHSA-N	442.915	1.469	50	20	IDGD	
CC(C)(C(=O)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1)c1ncc(Br)cn1	1841348147	LTQVQTDNNDETIK-LBPRGKRZSA-N	445.745	1.320	50	20	IDGD	
Cc1cc(C(=O)N2CCCC23CN(C(=O)C(C)(C)CCl)C3)n(-c2cccc(=O)n2C)n1	1843131604	XPPXDZRZRJIWOL-UHFFFAOYSA-N	445.951	1.961	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)/C=C/c2cc(F)c(F)c(F)c2)C1	1846275506	YBVHAZXQIXIMIL-GQCTYLIASA-N	438.450	1.694	50	20	IDGD	
C#CCCCC(=O)N1CCCC12CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2	1846374111	WBXCWZUQXSAJKL-UHFFFAOYSA-N	425.533	1.340	50	20	IDGD	
CC(C)(C)OC(=O)N1CCCC[C@@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](O)CCl)C1	1847568194	FJLWTEYMGITKIT-LTIDMASMSA-N	443.972	1.825	50	20	IDGD	
Cc1ccc(-c2nnc(SCC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)n2N)cc1	3542278	WZHPEVJLUAVWGG-UHFFFAOYSA-N	427.446	1.429	50	20	IDGD	
Cc1nnc(NNC(=O)c2ccc(Cl)c(S(=O)(=O)N3CCCCC3)c2)[nH]c1=O	11335160	HQESFIJHLWHDNW-UHFFFAOYSA-N	426.886	1.058	50	20	IDGD	
COc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)cc1	17159348	NJHMHQGXKRSIPA-JHMRYYBSSA-N	435.546	1.726	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(C(=O)NNC(=O)c2ccc3c(c2)OCCO3)ccc1Cl	105304247	CPHZPDSHSNQFQH-UHFFFAOYSA-N	439.877	1.436	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1O)c1cccc(CN2CCS(=O)(=O)CC2)c1	725888515	OWMJNKHXSRCLCA-UHFFFAOYSA-N	437.905	1.351	50	20	IDGD	
CCN1CCN(c2ccc(F)cc2[C@@H](C)NC(=O)NN[C@@]2(C)CCS(=O)(=O)C2)CC1	726279679	QTWBUAQRVYHBLQ-QRWLVFNGSA-N	441.573	1.410	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)/C=C\c1ccccc1)C(=O)NNC(=O)c1cccn1C	726538124	BIYOUSNWRIOYBC-QBOMHBFWSA-N	436.559	1.498	50	20	IDGD	
C[C@@H]1CN(C[C@@H](C)C(=O)NNC(=S)NCCc2ccc3c(c2)OCCO3)C[C@@H](C)O1	726748577	ZBIRWNZBJJVLOS-BZUAXINKSA-N	436.578	1.241	50	20	IDGD	
C[C@@H](CC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)NC(=O)C1CCCCC1	727293955	IHRMZGSRRMURNJ-IBGZPJMESA-N	443.592	1.821	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2c(Cl)nc3sccn23)c1	728504139	ADVCDCBRYRYHFH-UHFFFAOYSA-N	434.908	1.076	50	20	IDGD	
NC(=O)c1ccc(S(=O)(=O)NNC(=O)c2ccc(Br)cc2Cl)cc1	728854299	PTJAZQWTZVIWJM-UHFFFAOYSA-N	432.683	1.825	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)Nc2c[nH]ccc2=O)cc1	729367536	RWOBNXFEAZETAI-XNTDXEJSSA-N	432.440	1.668	50	20	IDGD	
CCOc1cc(C=NNC(=O)Cc2cc(O)nc(S)n2)ccc1O[C@@H](C)C(=O)N(C)C	730586366	GDOZHRQDEIDMGD-LBPRGKRZSA-N	447.517	1.418	50	20	IDGD	
CCOCC(=O)NN=Cc1cc(Br)c(OCC(=O)N(C)C)c(OCC)c1	731152704	QDQZXISUCOCOLY-UHFFFAOYSA-N	430.299	1.801	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)c2c(OC)ncnc2OC)c2ccccc2c1=O	732053468	CKIZWXITXXCGGB-UHFFFAOYSA-N	440.460	1.469	50	20	IDGD	
Cc1cc(C)c(N2C[C@@H](C(=O)NNC(=O)CCN3C[C@H](C)O[C@H](C)C3)CC2=O)c(C)c1	732261986	PYSIHTXDOUUQLM-OTWHNJEPSA-N	430.549	1.611	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)[C@@H](C)N2CCN(c3ccc(F)cc3)CC2)c1	732264971	KUIDQKQCMJZXAA-OAHLLOKOSA-N	430.480	1.815	50	20	IDGD	
N#Cc1ccc(CSCC(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1	732326899	ZACYBXRCXBFSGY-UHFFFAOYSA-N	428.426	1.704	50	20	IDGD	
O=C(CCCOc1ccc(Cl)cc1Cl)NNC(=O)Cn1ncn2nccc2c1=O	732726393	BUNMNYLLDNNEBD-UHFFFAOYSA-N	439.259	1.204	50	20	IDGD	
CCn1c(SCC(=O)N([C@@H]2CCS(=O)(=O)C2)N(C)C)nnc1-c1cccc(C)c1	733370915	QPGMFWWFQTZVNG-MRXNPFEDSA-N	437.591	1.858	50	20	IDGD	
O=C(NNc1cnnc2ccccc12)c1ccc2c(c1)SC1=NS(=O)(=O)CCN12	733813556	VIVZXBFXMFEUGE-UHFFFAOYSA-N	426.483	1.998	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)Cc1csc(-c2nc[nH]n2)n1	734252750	FYIHWEFUXLMWBR-UHFFFAOYSA-N	435.535	1.691	50	20	IDGD	
O=C(NNS(=O)(=O)N1CCCCC1)c1ccccc1NS(=O)(=O)c1cccs1	740706310	VUUMUPARXDDSKX-UHFFFAOYSA-N	444.560	1.514	50	20	IDGD	
CCc1nc(C(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)nn1-c1ccccc1	743830537	XGLSSSCLCOEKJG-UHFFFAOYSA-N	428.474	1.700	50	20	IDGD	
Cc1ccccc1-n1cc(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)cn1	744619633	UFFGXKSGHRNCKU-UHFFFAOYSA-N	441.513	1.959	50	20	IDGD	
O=C1CSc2ccc(C(=O)NNc3ccccc3S(=O)(=O)N3CCOCC3)cc2N1	744620889	ICKPDHUBSMFVSE-UHFFFAOYSA-N	448.526	1.509	50	20	IDGD	
O=C(COC(=O)[C@@H]1C[C@@H]1c1ccc2c(c1)OCCO2)NNC(=O)c1ccc([N+](=O)[O-])cc1	745285885	LVNALPGZFRTKGC-HZPDHXFCSA-N	441.396	1.474	50	20	IDGD	
C[C@H](CN1CCCC1=O)NC(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1	747979968	OCSWRCXLFQJWMF-XMSQKQJNSA-N	449.555	1.955	50	20	IDGD	
Cc1nn(C)c(C)c1S(=O)(=O)N[C@H](C)C(=O)NNc1ccc(Br)cc1F	748191332	KDKGIROESNSDBD-SECBINFHSA-N	448.318	1.749	50	20	IDGD	
COc1cccc(-c2nn(Cc3ccccc3)cc2C(=O)NNC(=O)C(=O)N2CCCC2)c1	748247693	UTOVZSXLWOHHIA-UHFFFAOYSA-N	447.495	1.990	50	20	IDGD	
O=C(CCN1C(=O)[C@H]2CCCC[C@@H]2C1=O)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1	748512675	SNOMOKHNXGGPFR-KBPBESRZSA-N	447.435	1.989	50	20	IDGD	
Cc1cc(Cl)ccc1OCCCC(=O)NNC(=O)CCc1nc(-c2nc[nH]n2)no1	748555257	NXPXZNBKEBCHFE-UHFFFAOYSA-N	433.856	1.756	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)Nc1cc(C)nn1-c1ccc(C(F)(F)F)cn1	748659978	FZMMYCGHUFLCCW-NSHDSACASA-N	430.387	1.799	50	20	IDGD	
Cc1c(NNC(=O)CSCCOc2ccc(S(N)(=O)=O)cc2)cccc1[N+](=O)[O-]	748671020	VZYMXXZYQULXMH-UHFFFAOYSA-N	440.503	1.806	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NC[C@H]2CCN(c3ccccc3OC)C2)cc1	750330487	FLDRLQPNWINXSE-MRXNPFEDSA-N	428.489	1.940	50	20	IDGD	
C[C@H](CCNC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)c1ccccc1	750336851	LCXFPHHRXZYGTJ-QGZVFWFLSA-N	446.577	1.838	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)c1ccc2c(c1)C(=O)N(C1CCCCC1)C2=O	751207390	XEZMPUOPNAQFQV-UHFFFAOYSA-N	438.440	1.399	50	20	IDGD	
CSc1ncc(C(=O)NNC(=O)CNC(=O)c2cccs2)n1-c1ccc(F)cc1	751210441	FLIYQSWEJUKZFL-UHFFFAOYSA-N	433.490	1.986	50	20	IDGD	
NC(=O)c1ccc(NNC(=O)c2ccc(=O)n(CCOc3ccccc3Cl)c2)nn1	752625310	GFERFYJKOROXFK-UHFFFAOYSA-N	428.836	1.227	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)NC[C@H]2CCN(S(C)(=O)=O)C2)cc1OC	753097318	ZIBVIDDFKNEHDJ-CQSZACIVSA-N	442.538	1.100	50	20	IDGD	
N#Cc1ccc(CN2CC[C@@H](NC(=O)NNC(=O)COc3ccc(F)cc3)C2=O)cc1	753736979	AJGBLXNZSZXOJB-GOSISDBHSA-N	425.420	1.208	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNS(=O)(=O)c1cc(C(=O)O)c(Cl)cc1Cl	755257686	KUJVKKTUTOJFFU-UHFFFAOYSA-N	426.278	1.306	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)Nc1ccc(N2CCCS2(=O)=O)cc1	755591992	FBUJNXOUKBWTAG-ZDUSSCGKSA-N	436.465	1.986	50	20	IDGD	
O=C(COc1cccc(NC(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)c1)Nc1ccccc1	756017750	ISLFLWNIELWVFL-AWEZNQCLSA-N	446.485	1.292	50	20	IDGD	
CN(C)Cc1ccsc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	756079917	JPSKLMKTGDGLQC-UHFFFAOYSA-N	436.559	1.669	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccn(CCOC)n2)c1	756312262	ZXVZLHOMBDLNQM-UHFFFAOYSA-N	438.510	1.027	50	20	IDGD	
Cc1c(NC(=O)NNC(=O)c2cccc(N(C)C)c2)cccc1S(=O)(=O)NC1CC1	756704273	FJYSPHXWPFJPAK-UHFFFAOYSA-N	431.518	1.968	50	20	IDGD	
CCOC(=O)[C@H](C)NC(=O)c1ccc(NC(=O)NNC(=O)c2cccc(C#N)c2)cc1F	756818788	PPMJEWPDNDNNGN-LBPRGKRZSA-N	441.419	1.845	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)Nc2cnn(CCN3CCOCC3)c2)c1	756827194	QAWPDOUWDZHANV-UHFFFAOYSA-N	444.536	1.879	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)CN2C(=O)N[C@]3(C[C@@H](C)C[C@@H](C)C3)C2=O)cn1	757649078	UQPVNDGQEVVLMZ-SLAYPKMVSA-N	434.522	1.155	50	20	IDGD	
Cc1ccc(C23C[C@H]4C[C@@H](CC(C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)(C4)C2)C3)cc1	758049175	YPFDZOUQSDSQQM-VQHMHIIYSA-N	433.574	1.918	50	20	IDGD	
CC[C@@H](Cc1ccccc1Br)C(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1	758156568	ATZYWTFSHCVTGW-WCQYABFASA-N	432.340	1.535	50	20	IDGD	
COC(=O)[C@H](C)Oc1ccc(C=NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1	758368607	YWSUKGWQPQQCAK-AWEZNQCLSA-N	433.486	1.641	50	20	IDGD	
Cc1nnc(-c2cccc(C(=O)OCC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)c2)o1	758984374	ZNXNWOKVVPWQKB-UHFFFAOYSA-N	425.357	1.571	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)[C@@H](CCSC)NS(=O)(=O)c2ccccc2)nc1	759726361	WOUHNHGTFWFDAU-OAHLLOKOSA-N	438.531	1.412	50	20	IDGD	
COc1ccc(NC(=O)c2ccc(NC(=O)C(=O)NNC(=O)c3ccncc3)cc2)cc1	763461724	AYEBSLRNVHOPMO-UHFFFAOYSA-N	433.424	1.742	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)c(Br)n1	763574376	ADKPYYUVYBSJIX-CYBMUJFWSA-N	435.234	1.078	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)Nc1ccc(F)c(Br)c1	763574632	HHWYZHBIDSPJKF-AWEZNQCLSA-N	438.209	1.514	50	20	IDGD	
Cc1nnnn1-c1cc(NC(=O)C(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)ccc1F	763736738	YNSXUPOJCULBBT-UHFFFAOYSA-N	441.467	1.412	50	20	IDGD	
CO[C@H](C)C(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCC3)c1	763782773	VEMLEXXHTDOZPW-LLVKDONJSA-N	430.486	1.610	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)C(=O)Nc2ccc(F)c(F)c2)c2ccccc2c1=O	763803985	IYEZODKXGBODMC-UHFFFAOYSA-N	443.410	1.875	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)C(=O)Nc1ccccc1CC(F)(F)F	763804642	VBQIQHNQUHCFKL-UHFFFAOYSA-N	440.334	1.865	50	20	IDGD	
C=CCN(CC=C)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)Cc2ccc(F)cc2)cc1	763932769	RIYVCIJLGJDEQF-UHFFFAOYSA-N	438.459	1.969	50	20	IDGD	
CCc1cc(NC(=O)C(=O)NNC(=O)C2=S=C3CC[C@H](C(C)(C)C)CC3=C2)n(C)n1	763941444	NJFKPUCNMTUVRJ-ZDUSSCGKSA-N	431.562	1.933	50	20	IDGD	
CN(C)C(=O)C[C@H]1CN(C(=O)C(=O)NNC(=O)Cc2ccsc2)c2ccc(Cl)cc21	764035199	OMFOYGCWEIQBTL-ZDUSSCGKSA-N	448.932	1.700	50	20	IDGD	
C[C@@H]1CC(C)(C)C[C@]2(C1)NC(=O)N(CC(=O)NNC(=O)CSc1ccccc1O)C2=O	764049307	YEVIJJAKJPHEND-ASSNKEHSSA-N	448.545	1.769	50	20	IDGD	
CCS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)Cc2ccc3ccccc3c2)cc1	764085812	UYISRDSOLSSPFL-UHFFFAOYSA-N	439.493	1.962	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccnc(OCC(F)(F)C(F)F)c2)c(O)c1	764105510	SSQYCWJTDRQLAY-UHFFFAOYSA-N	444.341	1.775	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2ccn(-c3ncccc3F)n2)cc1	764130703	CIZYBOQJARDWRJ-UHFFFAOYSA-N	426.408	1.134	50	20	IDGD	
CCOC(=O)C(C)(C)n1cc(NC(=O)C(=O)NNC(=O)[C@H](CC)c2ccccc2)cn1	764332432	TZDBKENAVKWJJD-MRXNPFEDSA-N	429.477	1.461	50	20	IDGD	
COC(=O)[C@H](C)Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)cc1	764349747	UPDDQTLWJMJYSS-LLVKDONJSA-N	433.848	1.797	50	20	IDGD	
CN(C(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccncc2)cc1)c1ccccc1	764353477	HYFAWPUFHOYHMM-UHFFFAOYSA-N	445.479	1.616	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)C(=O)Nc1cc(N2CCCC2=O)ccc1F	764401180	NLAKFIBQNIQHSA-UHFFFAOYSA-N	446.460	1.536	50	20	IDGD	
CNC(=O)c1cc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)ccc1Cl	764401842	SUDOFGOUZUEYCI-UHFFFAOYSA-N	436.877	1.283	50	20	IDGD	
CS(=O)(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2F)c1	764410256	CBHCFHWWECQRHN-UHFFFAOYSA-N	448.259	1.936	50	20	IDGD	
Cc1ccc(-c2n[nH]c(SCC(=O)NNC(=O)c3nnc(O)c4ccccc34)n2)cc1	764544168	BOEVWQFNDKMHMP-UHFFFAOYSA-N	435.469	1.982	50	20	IDGD	
CC(=NNC(=O)[C@H](C)CN1C[C@H](C)O[C@@H](C)C1)c1ccc(Cl)c(S(N)(=O)=O)c1	764667414	RUUCKSDNRFMTEK-AGIUHOORSA-N	430.958	1.573	50	20	IDGD	
CC(=NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1)c1cncc(F)c1	764819338	RPNSRMGTRRMSPZ-UHFFFAOYSA-N	433.509	1.376	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)CCc3ccc(N(C)C)cc3)CC2)cc1	766649532	QOFLYZQXULVWOM-UHFFFAOYSA-N	437.588	1.959	50	20	IDGD	
CC(=NNC(=O)c1ccc2c(c1)OCCO2)c1ccc(S(=O)(=O)N2CCOCC2)cc1	767488083	AFAHUGRQKBQPIN-UHFFFAOYSA-N	445.497	1.633	50	20	IDGD	
CCn1cc(S(=O)(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)nc1C	768048437	SAOBQOULPRQOGG-UHFFFAOYSA-N	430.531	1.103	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2cncc(Cl)c2)c1	768263019	OIAURSOZJSLTEH-UHFFFAOYSA-N	446.938	1.389	50	20	IDGD	
COc1cccc(NNC(=O)CCc2c(C)nn(-c3ccc(S(N)(=O)=O)cc3)c2C)n1	768412773	ZZIGIMZDYGTUCF-UHFFFAOYSA-N	444.517	1.616	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccnn2-c2cccc(F)c2)o1	770771883	PIPNHUIMFGZAOC-UHFFFAOYSA-N	442.451	1.846	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)Nc1ncccc1OCc1cccc(Cl)c1	771821656	LHCBJIPTRLXDSV-CYBMUJFWSA-N	438.893	1.901	50	20	IDGD	
Cc1ccc(S(=O)(=O)NC(C)(C)C)cc1C(=O)O[C@@H](C)C(=O)NNC(=O)CC(C)C	771932898	CISGCFWFDBMFPB-AWEZNQCLSA-N	441.550	1.811	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1cn(C)nc1-c1ccccc1	772566305	VVRNHFLGISRBCR-UHFFFAOYSA-N	426.502	1.763	50	20	IDGD	
Cc1cc(S(=O)(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)sc1C	773235209	YBEJRZJBFOCRHX-UHFFFAOYSA-N	443.572	1.773	50	20	IDGD	
CN(C)CCn1c(=O)oc2ccc(NC(=O)C(=O)NNc3cnc4ccccc4n3)cc21	773717651	AKRIVELWSSOLKI-UHFFFAOYSA-N	435.444	1.181	50	20	IDGD	
CCCc1nnc(S)n1CC(=O)NNC(=O)[C@H]1CCCN(C(=O)OC(C)(C)C)C1	774244303	HZJFJECPAMKRPV-LBPRGKRZSA-N	426.543	1.314	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)N[C@H](CS(C)(=O)=O)c2ccccc2)cc1	774285119	YUEMZAFYBXGVMV-HNAYVOBHSA-N	449.529	1.969	50	20	IDGD	
Cc1nn(-c2cncc3nnnn23)c(C)c1CC(=O)NNc1ncc(Cl)cc1Cl	775275751	JKXJGZGSGZSXMI-UHFFFAOYSA-N	433.263	1.709	50	20	IDGD	
CCOC(=O)NNS(=O)(=O)c1cc(C(=O)O)c(Br)cc1Br	775669094	FFTZGLPFPMCQFD-UHFFFAOYSA-N	446.073	1.849	50	20	IDGD	
CO[C@@H](c1ccccc1F)[C@H](C)NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1	775736138	NMILLDAQDOONEG-KBXCAEBGSA-N	430.484	1.939	50	20	IDGD	
Cc1nn(CCCl)c(C)c1C(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776202555	UMGBQGHOUDNXEL-UHFFFAOYSA-N	442.948	1.988	50	20	IDGD	
Cc1nc(S)sc1CC(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776202994	YMZIPMGLRLEABF-UHFFFAOYSA-N	429.568	1.918	50	20	IDGD	
Cc1cc(Br)c([N+](=O)[O-])cc1S(=O)(=O)NNC(=O)c1ccccc1O	777594085	OKKAKTGUWDKOPQ-UHFFFAOYSA-N	430.236	1.995	50	20	IDGD	
O=C1C[C@H](C(=O)N2CCN(S(=O)(=O)CBr)CC2)c2ccc(F)cc2N1	777778087	WITIJOKFBKROAL-LBPRGKRZSA-N	434.287	1.078	50	20	IDGD	
O=C(NNc1cnc2ccccc2n1)C(=O)Nc1ccc(C(=O)N2CCOCC2)c(F)c1	778723509	BCYLWODQOPOXLN-UHFFFAOYSA-N	438.419	1.323	50	20	IDGD	
Nc1nc(Cl)cc(NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)n1	779375549	XOIBZIKZDLDBMA-UHFFFAOYSA-N	432.893	1.948	50	20	IDGD	
O=C(NNC(=O)[C@H](O)[C@H](O)c1nc2ccccc2s1)c1cc(-c2ccc(F)cc2)[nH]n1	779540569	RXOLQTCUBQGZNP-SJORKVTESA-N	441.444	1.681	50	20	IDGD	
N#CC1=CCN(CC(=O)N2CCN(S(=O)(=O)c3ccc(F)c(Cl)c3)CC2)CC1	779587280	LSUCBFYVEJWEKX-UHFFFAOYSA-N	426.901	1.468	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](NC(=O)NNC(=O)[C@H]2COc3ccccc3O2)CC1	780668599	CKFVGFDHDDNNSQ-RHSMWYFYSA-N	434.493	1.946	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NC[C@H]2CC(=O)N(C3CC3)C2)cc1Br	780892317	KUNJTJVFYMEUGJ-SNVBAGLBSA-N	425.283	1.413	50	20	IDGD	
Cc1ccc(C(=O)N2CCC[C@H](C(=O)NNC(=O)CCNC(=O)OC(C)(C)C)C2)cc1	780971586	OOVZNPRNRIPJRA-KRWDZBQOSA-N	432.521	1.909	50	20	IDGD	
COc1ccc(CN(CC(=O)NNC(=O)c2cccs2)[C@H]2CCS(=O)(=O)C2)cc1	781349818	ZRNRXKBCHUNWJX-HNNXBMFYSA-N	437.543	1.207	50	20	IDGD	
CC(=O)N1CCN(Cc2ccccc2NC(=O)NNC(=O)Cc2ccc(F)cc2)CC1	782078680	NIFMGIUUASIPSO-UHFFFAOYSA-N	427.480	1.885	50	20	IDGD	
Cc1cc(C(=O)NCC(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)ccc1[N+](=O)[O-]	782754497	IZJZNBYKMGELSE-UHFFFAOYSA-N	447.398	1.947	50	20	IDGD	
N#Cc1cccnc1-n1cc(NC(=O)C(=O)NNc2ccc(Br)cc2)cn1	783009748	VVUMBUGAFLBSHL-UHFFFAOYSA-N	426.234	1.983	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ccc(Cl)cc2[N+](=O)[O-])cc1-n1cnnn1	783291951	UEABCDCBCORPOE-UHFFFAOYSA-N	432.784	1.314	50	20	IDGD	
O=C(NNc1ccc(-n2cccn2)nn1)C(=O)Nc1cccc(C(=O)c2ccccc2)c1	783437169	VHLIZXMUSVQGFS-UHFFFAOYSA-N	427.424	1.975	50	20	IDGD	
CS(=O)(=O)c1ccc(Cl)c(NC(=O)C(=O)NNc2ccc(Br)cn2)c1	784339600	NBXZWZUBROPKLM-UHFFFAOYSA-N	447.698	1.983	50	20	IDGD	
CCNC(=O)c1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)cc1	784835734	GRESEVCNVACKTA-UHFFFAOYSA-N	440.428	1.514	50	20	IDGD	
O=C(NNc1cc(Cl)ccn1)C(=O)Nc1cc(N2CCCS2(=O)=O)ccc1F	784861203	DYHXITBMYOBEHM-UHFFFAOYSA-N	427.845	1.496	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)C(=O)Nc1ccc(C(=O)NC2CCCC2)cc1	785061197	ULGCZBKENKUPRP-UHFFFAOYSA-N	448.483	1.335	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2cccc(C)c2C(=O)N2CCCC2)n1	785238693	ZHWDXDNTGBZRRU-UHFFFAOYSA-N	439.520	1.949	50	20	IDGD	
Cn1nccc1COCC(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1	786026310	BEMSNPCGBMTMRC-JOCHJYFZSA-N	433.512	1.711	50	20	IDGD	
CN1CCN(c2ccc(NC(=O)C(=O)NNC(=O)C3CCC3)cc2Br)CC1	787890162	WSJJSESINJKDFW-UHFFFAOYSA-N	438.326	1.087	50	20	IDGD	
N#Cc1ccc(S(=O)(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1Br	788476318	FLVKWDDHCGKNOM-HNNXBMFYSA-N	438.259	1.470	50	20	IDGD	
CC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)cc1Cl	789823138	WQGOIOJXKAYWBS-YJBOKZPZSA-N	444.875	1.957	50	20	IDGD	
CCS(=O)(=O)c1ccc([C@@H](C)NC(=O)NNC(=O)CNC(=O)OC(C)(C)C)cc1	790987788	HLXXHCBJJQRCQZ-GFCCVEGCSA-N	428.511	1.396	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)c2ccnc(N)c2[N+](=O)[O-])cc(OCC)c1OCC	791197155	OUYJXYSCLJRLSB-UHFFFAOYSA-N	433.421	1.843	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2O)cc(Cl)c1F	792268831	NPBXVNLQDHKAFF-UHFFFAOYSA-N	439.783	1.136	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cccc(C#N)c2)cc(N2CCN(C(C)C)CC2)c1	792269447	UTWKYFIXIUEWBR-UHFFFAOYSA-N	448.527	1.797	50	20	IDGD	
CC(C)(C)c1cc(NC(=O)C(=O)NNC(=O)c2cnccn2)n(-c2ccc(C#N)cc2)n1	793026094	OXOWHGBIYFDVIZ-UHFFFAOYSA-N	432.444	1.231	50	20	IDGD	
CC1=CC(NC(=O)c2ccco2)=S=C1C(=O)NNc1ccccc1S(=O)(=O)N(C)C	795167963	CMXQQLMXXGUHPT-UHFFFAOYSA-N	448.526	1.398	50	20	IDGD	
CCOC(=O)c1cc(Br)ccc1NC(=O)C(=O)NNC(=O)c1cccc(C)n1	797369600	ANHFRWNGKDXHON-UHFFFAOYSA-N	449.261	1.729	50	20	IDGD	
CC[C@@](O)(C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1)c1cccc(Cl)c1	800380166	KSJKKTKNECRQEH-KRWDZBQOSA-N	446.312	1.700	50	20	IDGD	
CCOC(=O)C(C)(C)c1csc(NC(=O)C(=O)NNC(=O)Cc2ccccc2C)n1	806980227	LRVSAOKTOGIRLO-UHFFFAOYSA-N	432.502	1.621	50	20	IDGD	
COC(=O)c1cc(C)c(NC(=O)C(=O)NNc2ccc(S(C)(=O)=O)cc2)c(Cl)c1	806995551	VRFSVPAHLOGNRJ-UHFFFAOYSA-N	439.877	1.920	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1cc(NC(=O)C(=O)NNc2cccc(F)n2)ccc1F	807392812	KMEYGYJTIHXPFB-UHFFFAOYSA-N	427.433	1.518	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@@H]2CCOC[C@H]2C)c1	807505413	KOPZJJPEBRXAGA-ZBFHGGJFSA-N	426.539	1.334	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNC(=O)NCc2ccccc2S(N)(=O)=O)cc1	807605745	WVEJKDWICZSZQT-UHFFFAOYSA-N	434.518	1.903	50	20	IDGD	
Cc1cc(=O)cc(C)n1CCCC(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	810462522	UYTXAEUYGOUJOO-UHFFFAOYSA-N	448.545	1.410	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(C(=O)NNC(=O)COc2ccc(C)c(C)c2)cc1	811257313	GCOOVQGLLDUHKY-UHFFFAOYSA-N	435.502	1.068	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccccc1F)NNc1cc([N+](=O)[O-])ccc1Br	811497330	WHWOVGUUOJJWSX-UHFFFAOYSA-N	447.242	1.918	50	20	IDGD	
COCCOCc1ccc(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1	812452499	UXIVPXFEXNDWKP-UHFFFAOYSA-N	441.893	1.225	50	20	IDGD	
CC1(C)NC(=O)N(c2cccc(NC(=O)NNC(=O)COc3ccccc3O)c2)C1=O	812972592	JTCNFBVACDSKJK-UHFFFAOYSA-N	427.417	1.459	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N2CCOCC2)cc1NC(=O)NNc1ncncc1F	814500988	PDYXEQYFNJGKEV-UHFFFAOYSA-N	440.457	1.184	50	20	IDGD	
COC(=O)c1n[nH]c2ccc(NC(=O)NNc3ccccc3S(=O)(=O)N(C)C)cc12	814637954	GNIDKJWFSSWJSE-UHFFFAOYSA-N	432.462	1.748	50	20	IDGD	
CC(=NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)c1cccc(O[C@@H](C)C(=O)O)c1	814725554	IZKRULKIECLBMH-AWEZNQCLSA-N	433.486	1.943	50	20	IDGD	
N#Cc1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2Cc2ccccc2)nc1	815565108	CQNOLROURKLNNF-UHFFFAOYSA-N	429.436	1.709	50	20	IDGD	
Cc1nc(Cn2nnc(NC(=O)C(=O)NNc3ccc(Br)cc3C)c2C)no1	815595960	HCDCUDPHUVOTPP-UHFFFAOYSA-N	449.269	1.479	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCc2nncn2C1)C(=O)Nc1ccc(F)cc1-c1ccc(F)cc1	815691374	OFQXMIWWRIXGKY-ZDUSSCGKSA-N	440.410	1.572	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)C1CCN([C@H]2CCSC2)CC1	816828764	OCQOCAHKSRSYNA-HNNXBMFYSA-N	439.607	1.267	50	20	IDGD	
O=C(NNc1ncncc1F)c1ccccc1NS(=O)(=O)c1ccc2c(c1)OCCO2	817078165	YZPBOXFJXMWLAP-UHFFFAOYSA-N	445.432	1.945	50	20	IDGD	
COc1ccc(C(=O)Nc2nc(CC(C)=NNC(=O)c3cnccn3)ns2)cc1OC	818287586	OTOOEJDEENRBRY-UHFFFAOYSA-N	441.473	1.946	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)NC2CCN(S(C)(=O)=O)CC2)c(C)n1C[C@@H]1CCCO1	913086882	DGJHHTVSLFTOOG-SQWSFHKJSA-N	434.562	1.731	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1)NNc1ccccc1[N+](=O)[O-]	913105394	VVVMRBUYPJOVNG-UHFFFAOYSA-N	434.352	1.915	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)COc2ccc(Br)cc2)ccc1F	915271330	BRDSLVXXCUXOLV-UHFFFAOYSA-N	446.254	1.076	50	20	IDGD	
NC(=O)c1cc(NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)ccc1Cl	916382011	GLDFPJRWNDPFHP-UHFFFAOYSA-N	444.923	1.804	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)NCc1ccc(NS(C)(=O)=O)cc1	916383239	POLUYAUHMRGLGG-UHFFFAOYSA-N	426.882	1.864	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)NCc2ccc(CN3C[C@H](C)O[C@H](C)C3)cc2)n1	916385807	GTUBNTAZHALYFA-HDICACEKSA-N	428.537	1.640	50	20	IDGD	
COCc1ccccc1CNC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	916426935	YYJNDODOMLTMSF-UHFFFAOYSA-N	446.529	1.762	50	20	IDGD	
C[C@@H]1CCCN(CCCCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)C1	916504000	PQZZUAMTXOMJBH-MRXNPFEDSA-N	439.582	1.393	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NCCN2CCN(c3ccc(F)cc3)CC2)cc1	916513962	XAZLNQURCYDHSM-UHFFFAOYSA-N	445.495	1.366	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)sc(C)c1C	916561821	HIQKAGQLEQHJQG-UHFFFAOYSA-N	434.430	1.850	50	20	IDGD	
COc1ccc(/C=C(/C#N)C(=O)OCC(=O)c2c(N)n(CC(C)C)c(=O)n(C)c2=O)cc1	916618208	HFMUXSKOWCBSOS-DHDCSXOGSA-N	440.456	1.127	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)c2ccc3c(c2)S(=O)(=O)N(C2CC2)C3=O)c1	916741286	UHRUUFCCEQMIFG-UHFFFAOYSA-N	443.481	1.450	50	20	IDGD	
C[C@@H](CN1CCCC1=O)NC(=O)NNC(=O)[C@H](C)Oc1cccc(Br)c1	918099846	BZBCKURQXFLOKX-RYUDHWBXSA-N	427.299	1.558	50	20	IDGD	
C[C@H](NC(=O)COC(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccccc1)C(=O)N(C)C	918805328	SPWRDWMHMDBBRC-JIHKLPAASA-N	448.483	1.507	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)N[C@H]3CCS(=O)(=O)C3)c3ccccc3n2)o1	919884382	FTVDTTRIVTYQJE-ZDUSSCGKSA-N	428.470	1.934	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)CCCNC(=O)c2ccccc2)CC1	1251911151	NIKCMWZHBOFBNT-UHFFFAOYSA-N	432.521	1.991	50	20	IDGD	
C=CCNC(=O)c1cccc(S(=O)(=O)NNC(=O)c2ccc(Br)cc2)c1	1317892852	BHKZRHCBHNNOJT-UHFFFAOYSA-N	438.303	1.988	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)c2cccc(CN3CCOCC3)c2)CC1	1318914293	FOQQHBNMZBHWJI-UHFFFAOYSA-N	446.548	1.927	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)cc(O)n1	1319864665	WJJWKCTVLLYJDY-UHFFFAOYSA-N	429.436	1.929	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2cc(Br)cc(C(N)=O)c2)cc1	1321218272	OVSYMKULJODVGJ-UHFFFAOYSA-N	428.264	1.180	50	20	IDGD	
Cc1cc(C)n2ncc(C(=O)N3CC[C@@]4(CN(C(=O)CO[Si](C)(C)C)CCO4)C3)c2n1	1777776861	NBFHTSJULBSLAU-OAQYLSRUSA-N	445.596	1.641	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc3c(c2)OCO3)C1	1778441486	FHDIVMBLWBCVPS-FQELHTAISA-N	438.908	1.797	50	20	IDGD	
O=C(c1c[nH]c2cnccc12)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1778753524	POHKYBACVSOYAX-RHSMWYFYSA-N	425.258	1.697	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccnc(Br)c3)C2)C1	1779401798	ADMUYVRVEARWQS-GUYCJALGSA-N	446.729	1.541	50	20	IDGD	
Cn1ccc2c(O)ncc(C(=O)N3CC[C@]4(C3)CN(C(=O)C(Cl)Cl)CCO4)c21	1779979857	WAYMTPOLZDFAHI-SFHVURJKSA-N	427.288	1.526	50	20	IDGD	
CCOC(=O)/C=C/C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Br)C1	1780771084	BOWULSWZGHDAKF-MBSGWTOESA-N	435.290	1.310	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)N1CCO[C@]2(CCN(C(=O)[C@](C)(Cl)CCl)C2)C1	1781231777	FHICZSDNDQPJPU-QZTJIDSGSA-N	438.352	1.577	50	20	IDGD	
O=C(CSc1ccncc1)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781326784	UMODYRWZLPEOAT-GDBMZVCRSA-N	432.315	1.694	50	20	IDGD	
O=C([C@H](F)Br)N1CC[C@]2(C1)CN(C(=O)[C@H]1Cc3ccccc3O1)CCO2	1781329993	PHBFGWIIZOJZRA-VKJFTORMSA-N	427.270	1.511	50	20	IDGD	
O=C(c1ccc2cccnc2n1)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781330543	YWDFPYZVCYOIGV-KSSFIOAISA-N	437.269	1.764	50	20	IDGD	
Cc1nc[nH]c1CSCC(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781331417	JWWAENQOIHSITH-ZBFHGGJFSA-N	449.346	1.472	50	20	IDGD	
CCOC(CC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](Cl)COC)C2)OCC	1782340769	NAPBWSRVBWLDQW-RZQQEMMASA-N	434.961	1.543	50	20	IDGD	
O=C(CCCn1ccnc1)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCBr)C2	1782484017	YYIDGQMQVZWYNK-VQIMIIECSA-N	441.370	1.962	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3n[nH]c4cccc(F)c34)C2)C1	1782485179	IQADFGUGYLGWJK-ADLMAVQZSA-N	439.285	1.929	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)c1ccc(F)nc1F	1783384475	UCENGGYONFNHNI-DJFWLOJKSA-N	436.228	1.644	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](C)Br)C3)C2)c1	1783538570	TZIBHVOAYUCXFD-ORAYPTAESA-N	438.322	1.872	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@H]1C(=O)N1CC[C@@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1783849445	OIPKLMRSLIMCDZ-WHSLLNHNSA-N	426.941	1.837	50	20	IDGD	
CC(C)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)COC(=O)C(F)(F)F)C[C@@H]21	1783852202	UCZLQEKNXSVXSA-SRVKXCTJSA-N	428.835	1.337	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3occc3Br)CCO2)C1	1783874341	CZSQORXZXWVDOX-LRDDRELGSA-N	435.702	1.739	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](N)c1cccc(Cl)c1)CCO2	1783875654	JTRRNFYXQKZXAU-FRQCXROJSA-N	430.332	1.424	50	20	IDGD	
Cc1nccn1CCCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1784409883	TXQRBMUDACJEIR-DOTOQJQBSA-N	431.306	1.492	50	20	IDGD	
Cc1cc(C)c(C(=O)N2CC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c(C)c1	1784988890	BFHLCOSTWZLFGI-QHCPKHFHSA-N	430.549	1.428	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(Cl)cnc3OC)C[C@@H]21	1791250846	NWWRTJGDAGIBEK-KSYCFECVSA-N	446.331	1.591	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3n[nH]c4ccc(F)cc34)C[C@@H]21	1791254396	RSCFLJJFQBLQJL-SIUGBPQLSA-N	438.887	1.549	50	20	IDGD	
Cc1cccc(C)c1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2C1	1791293706	CHISSPPEUSEKRY-FHWLQOOXSA-N	430.549	1.270	50	20	IDGD	
CC(C)CNC(=O)C(=O)NC1(c2ccc(NC(=O)CCC(=O)NN(C)C)cc2)CCC1	1791599199	CUQYCUPYRPQMMX-UHFFFAOYSA-N	431.537	1.266	50	20	IDGD	
C[C@@H](C(=O)NC1(c2ccc(NC(=O)CCC(=O)NN(C)C)cc2)CCC1)n1cncn1	1791603221	LIVYACBMRFNMTD-HNNXBMFYSA-N	427.509	1.346	50	20	IDGD	
Cc1nn(C)c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)CBr)c1F	1792869853	BVMZOVDVSDZDGJ-SGESHTKJSA-N	431.306	1.102	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H]1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](O)CCl)C2	1793332251	CHPJCEFKJAGRRW-DBWAAGBOSA-N	443.972	1.918	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1csc2c1CCCO2	1796096982	GGEZOZSKAFXTJQ-VZAMPYOESA-N	428.938	1.530	50	20	IDGD	
O=C(CCc1ccccc1Cl)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1	1796187225	RSJVUBBNVLOKRY-ACDBMABISA-N	440.736	1.904	50	20	IDGD	
COc1cc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Cl)ccc1[N+](=O)[O-]	1796367890	ZBLITCGJJSUFAU-LZDSYCOUSA-N	429.832	1.270	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Cl)C1	1796370951	PIWINMUVSVODMD-XRGAULLZSA-N	433.908	1.367	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1nnsc1C1CC1	1796641688	LMGDWFKNAIOYHA-FOUMNBMASA-N	443.367	1.650	50	20	IDGD	
CC[C@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)N(CC)CC	1796890723	HRDLVIUEJJWSHP-KNTBSYDBSA-N	444.580	1.879	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C[C@H]1CCCCO1)C2	1796890897	OJORACVVOBCHDJ-NDEFNWATSA-N	429.521	1.718	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H]1Cc3ccccc3O1)C2	1796892587	UDEKDYMCXLWEKR-KSQXUGCOSA-N	449.511	1.762	50	20	IDGD	
Cn1c(=O)n(C)c2cc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)CCBr)C4)ccc21	1797503255	RRIAQSWGIMHMJY-QDMKHBRRSA-N	449.349	1.914	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C=C1\C(=O)Nc2ccccc21	1797660320	FIILEXLLXGGBNA-UELPNOEYSA-N	448.317	1.395	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CCc3ccoc3C1)C2)[C@@H](F)Br	1799343147	OOCPYHKMACZWKG-PLPKTUSISA-N	429.286	1.665	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc(F)cc1F)C2)[C@@H](F)Br	1799346921	IYSYMNQTZFTQLG-OXUXUCFPSA-N	435.240	1.787	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc([N+](=O)[O-])cc1F	1799490201	IJMPSZADWSNULN-IVWMJMPLSA-N	439.516	1.789	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CCCN1C(=O)OC(C)(C)C	1800784576	WRTANDHWSBAAPB-ZHCJQAHYSA-N	443.972	1.993	50	20	IDGD	
O=C1C[C@@H](C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](Br)Cc2ccccc2)CN1	1801570785	WENVNWSITNWPHR-SFFUCWETSA-N	448.361	1.767	50	20	IDGD	
C[C@@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](CO)NC(=O)OC(C)(C)C)C2	1801961005	DAETYBFCNRRCRI-RGDJUOJXSA-N	448.358	1.294	50	20	IDGD	
Cc1nnc(CCC(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)s1	1804554656	GNZCJKWIKKYLQD-HDMKZQKVSA-N	437.953	1.480	50	20	IDGD	
CCS(=O)(=O)N[C@@H](C)C(=O)N1CCCC2(CCN(C(=O)C(Cl)Cl)CC2)C1	1805959425	FSQIYCJGRWQASL-LBPRGKRZSA-N	428.382	1.349	50	20	IDGD	
Cc1nc(C(=O)NC[C@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)cs1	1805966055	BGWUAQXQZJITIF-UZLBHIALSA-N	444.561	1.539	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H](CNC(=O)CNCP(=O)(O)O)[C@@H]1c1cccnc1	1807018789	QKCVTIYWBHKFQC-ZBFHGGJFSA-N	446.872	1.077	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)/C=C/c2ccoc2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807360513	BZRRWQMOXGNXQM-UTKZXYPPSA-N	445.284	1.387	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)CC(F)(F)F)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807365600	VWALQLLFNUBTMR-QAPCUYQASA-N	435.211	1.033	50	20	IDGD	
CC(=O)OC[C@H](OC(C)=O)C(=O)N1CC[C@H](CNC(=O)[C@@H](F)Cl)[C@@H]1c1cccnc1	1808313808	PUKHSXFNMQEATL-LTIDMASMSA-N	443.859	1.117	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)C(F)(F)c3ccco3)CC2)C1	1809973434	LKIKLYABTFIRNM-UHFFFAOYSA-N	446.259	1.596	50	20	IDGD	
CCn1nc(C)cc1C(=O)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1	1809977687	CMXPEAAUMOHKLK-UHFFFAOYSA-N	438.337	1.050	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)c1ccn2nccc2c1	1810045602	TZJYZBCFGYDZNQ-QXAKKESOSA-N	427.892	1.649	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2cc3n(n2)CCCO3)[C@H]1c1cccnc1	1813030424	JTDREXYQGSMEGP-GJYPPUQNSA-N	447.923	1.634	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)C(C)(C)CCl)[C@H]1c1cccnc1	1813068918	QUZGOSLGONORNB-APWZRJJASA-N	437.972	1.725	50	20	IDGD	
COC(C)(C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[nH]n1	1814513899	RSOFTIDZDCSUCC-CBFMJHRQSA-N	443.508	1.961	50	20	IDGD	
CN1CCN(CC(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@](C)(Cl)CCl)CC3)CC1	1818802925	OQYSVSCIUDCMDM-KPZWWZAWSA-N	448.420	1.539	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc4ncccn4n3)sc2C1	1819016045	OZWZLTBTLCLLBM-MNOVXSKESA-N	434.909	1.665	50	20	IDGD	
CCOC(=O)c1cc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)[C@@H](O)CCl)[nH]n2)ccn1	1820297263	MYXRITFZJAEMBX-CVEARBPZSA-N	449.895	1.887	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(CO)on2)n[nH]1	1820348877	KMLZBUYGNRRCIN-ZANVPECISA-N	426.271	1.979	50	20	IDGD	
CN[C@H](CC(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@](C)(Cl)CCl)n[nH]1)C(=O)O	1820865115	OHNBDPWXADUEKS-PEBVRCNWSA-N	434.324	1.701	50	20	IDGD	
Cc1c(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@H](F)Cl)CC3)cn2[nH]cnc(=O)c12	1821220547	CCFUOWIOIHHPPM-OQPBUACISA-N	438.872	1.548	50	20	IDGD	
Cc1ccn(C)c1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2	1821728189	VEDKGQGDTFNKQL-HNNXBMFYSA-N	438.318	1.009	50	20	IDGD	
O=C(CC(F)(F)C(=O)O)N[C@@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1	1823002425	DBHPCUCLJWCPCZ-MLUIRONXSA-N	444.229	1.856	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)Cn2cc(C)c(O)nc2=O)n[nH]1	1823368077	HGFUMGUUVMDYLM-JSGCOSHPSA-N	436.900	1.690	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3ccc4nn[nH]c4c3)sc2C1	1824416714	XWGGIGUSJAEXRF-QWRGUYRKSA-N	434.909	1.894	50	20	IDGD	
COC(=O)C1(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@H](F)Br)CC3)CC1	1825280759	PYMNYLMQUPHDGW-XCBNKYQSSA-N	434.287	1.699	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)c2coc(Cl)n2)CC1	1825535390	HWJRPISXGNHQAS-GOSISDBHSA-N	445.712	1.555	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)nn1C	1825899162	YGZZUHCTSZKUKG-IBGZPJMESA-N	432.569	1.335	50	20	IDGD	
CSCC[C@H](O)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCBr)CC2	1826125100	UGVIHGKHXJKOBK-ONGXEEELSA-N	436.397	1.954	50	20	IDGD	
O=C(C1CCOCC1)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827055241	VTHFYGVQTHMMJF-OAQYLSRUSA-N	428.338	1.026	50	20	IDGD	
O=C([C@H]1CCCS1)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827059663	FMGSSWVHCIIDMT-VQTJNVASSA-N	430.379	1.495	50	20	IDGD	
COCC(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)[C@@H](F)Cl)C2)C1	1828860710	AFDWOCYGZUZPRL-XLIONFOSSA-N	441.887	1.619	50	20	IDGD	
Cc1n[nH]c(C)c1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)CBr)CCO2	1830539098	AYFPIUUHLPHUJP-XIKOKIGWSA-N	443.342	1.128	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnn4c3OCCC4)C2)C1	1831653209	BWHVJEGBQIZXQG-JXFKEZNVSA-N	440.928	1.143	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H](COC)NC(C)=O)CC1	1831830354	AGEBFULAEVTKSL-KSZLIROESA-N	431.961	1.011	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccnc(F)c3)CCO2)C1	1831905041	OTHCXRVSAKASKV-QZTJIDSGSA-N	434.295	1.527	50	20	IDGD	
Cc1noc(C)c1CCC(=O)N1CCC(N2CCC(NC(=O)[C@H](O)CCl)CC2)CC1	1833308605	WREVQWPGNXSNFT-LJQANCHMSA-N	440.972	1.395	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)Cc3nnc(C)o3)CC2)CC1	1833532094	AMMJTCTUNSIHLU-QGZVFWFLSA-N	425.961	1.900	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)n(C)n1	1834165796	XYGPBNQQDMDWQZ-ROUUACIJSA-N	433.336	1.035	50	20	IDGD	
C[C@@H](C(=O)N1CCC(N2CCC(NC(=O)CCBr)CC2)CC1)n1cncn1	1834423471	KQGXCAGAKOCQSP-AWEZNQCLSA-N	441.374	1.196	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3sc(N)nc3C)CC2)CC1	1834755259	HLWGCGBPPGTUGU-HNNXBMFYSA-N	444.001	1.473	50	20	IDGD	
CCn1nc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCBr)CCO3)C2)cc1C	1834822973	BMHDADGOKRZVCT-GOSISDBHSA-N	443.342	1.066	50	20	IDGD	
O=C1Cc2cc(C(=O)NC3CCN(C4CCN(C(=O)[C@H](F)Cl)CC4)CC3)ccc2N1	1835517350	URTLBENSGSFGHB-IBGZPJMESA-N	436.915	1.901	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3cnc(O)[nH]3)CC2)CC1	1835966574	ARTADESOMNELLW-LLVKDONJSA-N	428.331	1.084	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCC(N2CCC(NC(=O)c3ccnnc3O)CC2)CC1	1836063284	PEWHNCYYQNFANP-IBGZPJMESA-N	444.363	1.604	50	20	IDGD	
Cn1nccc1C(=O)N1CCC(OC2CCN(C(=O)CCBr)CC2)CC1	1837484745	KFCNCIHQJPMDHK-UHFFFAOYSA-N	427.343	1.817	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)N1CCC(OC2CCN(C(=O)CO[Si](C)(C)C)CC2)CC1	1838106829	NLNHBKTXZQYCMV-MRXNPFEDSA-N	441.645	1.703	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3snnc3C3CC3)C2)C1	1839144919	OHXVYTGRIUEGAK-UGSOOPFHSA-N	428.942	1.503	50	20	IDGD	
Cc1cnc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)s1	1839198070	RPACUJIYJOJXLC-NHYWBVRUSA-N	436.303	1.212	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(C#N)ccc3F)CCO2)C1	1839422097	CGZRCOONLYACHS-JXFKEZNVSA-N	439.871	1.021	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3ccc(C)cn3)C2)C1	1840150382	KIWMGCYRXJAHPZ-NQIIRXRSSA-N	439.940	1.033	50	20	IDGD	
O=C1Cc2cccc(C(=O)N3CCOC[C@]4(C3)CN(C(=O)C(Cl)Cl)CCO4)c2N1	1840189937	UKSXCDBVTAELPW-IBGZPJMESA-N	442.299	1.055	50	20	IDGD	
O=C(c1ccc(-c2ncc[nH]2)cc1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1840747617	ZXGSOAZPKMCUGX-UZLBHIALSA-N	436.871	1.681	50	20	IDGD	
CCCCCc1ncc(C(=O)N2CC3(CCCN3C(=O)c3cccc(B(O)O)c3)C2)s1	1843014851	IWELKYFGRYXQAV-UHFFFAOYSA-N	441.362	1.686	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2ccc3scnc3c2)C1	1844097578	VTIADMATSHTENW-UHFFFAOYSA-N	436.497	1.426	50	20	IDGD	
CC[C@H](C)[C@H](N)C(=O)N1CC2(CCCN2C(=O)c2cc([N+](=O)[O-])ccc2OC(C)=O)C1	1844692304	JLHWPHMVXMOAKY-UGSOOPFHSA-N	432.477	1.711	50	20	IDGD	
O=C(CN1CCc2sccc2C1)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](F)Br	1848109064	XSAQLVMVIGHBCS-HEHGZKQESA-N	430.343	1.999	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)COc1ccc([N+](=O)[O-])cc1	9606999	MCPAUYQXGOGEMN-UHFFFAOYSA-N	437.792	1.640	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)NC2CC2)cc1)NNc1nc(-c2ccncc2)no1	110843184	XJGBQXFSOOVYGU-UHFFFAOYSA-N	428.474	1.648	50	20	IDGD	
O=C(Cc1csc(-c2cc(Br)cs2)n1)NNC(=O)C(=O)N1CCCC1	216351864	AVRIWMAFZJHYGK-UHFFFAOYSA-N	443.348	1.946	50	20	IDGD	
CCCCCn1nc(C(=O)NNS(=O)(=O)c2cnn(CC)c2)c2ccccc2c1=O	727352279	UUOMCHVWRGVIHU-UHFFFAOYSA-N	432.506	1.426	50	20	IDGD	
CC1=NN(c2ccc(C(=O)OCC(=O)NNC(=O)[C@H]3COc4ccccc4O3)cc2)CC1	728328953	ZUCUMTORFJVSQU-LJQANCHMSA-N	438.440	1.417	50	20	IDGD	
O=C(NCc1ccc(Cn2cccn2)cc1)NNC(=O)C1CCN(c2ncccn2)CC1	728945391	QTUWJBRPKNXMOF-UHFFFAOYSA-N	434.504	1.468	50	20	IDGD	
COCCCNC(=O)[C@H](C)N1CCN(C(=O)NNC(=O)c2ccc3ccccc3c2)CC1	728946040	WMQHVBDDLSOZTN-KRWDZBQOSA-N	441.532	1.353	50	20	IDGD	
C[C@H]1CC(=O)Nc2ccccc2N1C(=O)CN(C)C(=O)NNC(=O)c1cccc(C#N)c1	728954895	RQPDVFCDDLNQBD-AWEZNQCLSA-N	434.456	1.608	50	20	IDGD	
Cn1ccnc1[C@@](O)(CC(=O)NNc1ccc(S(=O)(=O)C(F)F)cc1)C(F)(F)F	728975775	SNYARZJHNHKWCQ-AWEZNQCLSA-N	442.366	1.700	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2ccc(NNC(=O)c3ccn(C)n3)c([N+](=O)[O-])c2)cc1	729294974	RONGEABQCAPMPG-UHFFFAOYSA-N	446.445	1.895	50	20	IDGD	
C[C@H](CCC(=O)NNC(=O)c1ccc(C#N)cc1)CC(=O)NNC(=O)c1ccc(C#N)cc1	729842958	SMSDJPHTOYBDGS-OAHLLOKOSA-N	446.467	1.459	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@@H]2CSCN2C(=O)C(C)(C)C)c2ccccc2c1=O	730073527	NIUGVRXJHIWZFQ-AWEZNQCLSA-N	431.518	1.125	50	20	IDGD	
Cc1c(C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)nnn1-c1ccc(F)c(Cl)c1	731165092	JCZUCFAELYRSPL-INIZCTEOSA-N	431.811	1.969	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C2(S(=O)(=O)c3ccccc3)CC2)c2ccccc2c1=O	731341980	ZWMYEBRBJCYHAQ-UHFFFAOYSA-N	440.481	1.184	50	20	IDGD	
O=C(CCN1CCN(C(=O)[C@@H]2CCCO2)CC1)NNC(=O)c1c(Cl)cccc1Cl	731986961	GPJRYNIXWQVXPY-HNNXBMFYSA-N	443.331	1.468	50	20	IDGD	
O=C(NNc1nc(-c2ccccc2)no1)[C@@H]1CCCC[C@H]1C(=O)N[C@@H]1CCS(=O)(=O)C1	732111534	AOTZMTGZDHFNQA-BZUAXINKSA-N	447.517	1.289	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)c1cc(NC(C)=O)ccc1NS(C)(=O)=O)c1ccccc1	732133319	WSIVXETVEDUJLW-MRXNPFEDSA-N	432.502	1.971	50	20	IDGD	
COc1ccc(CCC(=O)N2CCCN([C@H](C)C(=O)NNC(=O)CC(C)C)CC2)cc1	732200322	XMBVJVPJVYAPNR-GOSISDBHSA-N	432.565	1.744	50	20	IDGD	
COc1cc(OC)c2cc(C(=O)NNC(=O)CCN3C[C@@H](C)O[C@H](C)C3)[nH]c2c1OC	732260571	GGZMNDFCROQMGV-CHWSQXEVSA-N	434.493	1.454	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@@H](NC(=O)NNC(=O)C(=O)N1CCCC1)C1CCCCC1	732472999	OQPWFLWODMGWPA-OAHLLOKOSA-N	425.530	1.413	50	20	IDGD	
O=C(NNC(=O)[C@@H]1C[C@H]1c1ccc(OCc2ccccc2)cc1)N[C@@H]1CCS(=O)(=O)C1	732554150	ZGBVTCVQAOHCDB-YZGWKJHDSA-N	443.525	1.887	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)c2c(C)nn(C)c2OC)c2ccccc2c1=O	732750858	BJAXSSIHHYJCTG-UHFFFAOYSA-N	426.477	1.712	50	20	IDGD	
C[C@H](NC(=O)NN[C@@]1(C)CCS(=O)(=O)C1)c1ccc(NC(=O)c2ccncc2)cc1	733848757	SBFLMQLYACFTJV-XOBRGWDASA-N	431.518	1.776	50	20	IDGD	
Cc1cccc(N2C[C@@H](C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)CC2=O)c1C	734240929	WTTCOZHLPDTRDR-HNNXBMFYSA-N	433.509	1.511	50	20	IDGD	
CCS(=O)(=O)N1CCC(C(=O)NNc2ccccc2S(=O)(=O)NC(C)(C)C)CC1	734250088	POHMQPBIKMTSGL-UHFFFAOYSA-N	446.595	1.268	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)N[C@@H]2CCN(c3cnn(C)c3)C2=O)c(C)n1-c1ccccc1	735584342	SZBRIXQNYNXBIK-LJQANCHMSA-N	435.488	1.577	50	20	IDGD	
CC(C)n1nc(C(=O)NNS(=O)(=O)c2ccc(C(=O)O)c(F)c2)c2ccccc2c1=O	742231350	AMVCDXHYOGKWKW-UHFFFAOYSA-N	448.432	1.438	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)CSc2nnc(-c3cccc(Cl)c3)n2N)cc1	742445752	WFICIWKYAFABLF-UHFFFAOYSA-N	427.877	1.737	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2ccccc2Cn2cncn2)c2ccccc2c1=O	742474064	ANFCHVHILRPUOL-UHFFFAOYSA-N	431.456	1.521	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)N[C@@H]1CC(=O)N([C@@H]2C[C@@H]2c2ccccc2)C1	743609532	XXKRRZSQXQTVPP-HMXCVIKNSA-N	444.495	1.973	50	20	IDGD	
CCN1CCN(C[C@H](C)CNC(=O)NNC(=O)c2ccc(OC(C)C)c(OC)c2)CC1	745862731	NOTHZCJOBGCGFJ-QGZVFWFLSA-N	435.569	1.700	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)N[C@@H]1CC(=O)N([C@H]2C[C@@H]2c2ccccc2)C1	746774099	UYCRCXVXMISYFV-QRVBRYPASA-N	432.484	1.364	50	20	IDGD	
COC(=O)c1ccsc1N1CC[C@@H](NC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)C1=O	746780243	NCMHSPJFNSNMTQ-CYBMUJFWSA-N	447.429	1.192	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)CNS(=O)(=O)CCOC(C)C	747905484	COIPWICXKWUORA-UHFFFAOYSA-N	440.547	1.224	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccccc1)NNc1nc(-c2ccccn2)nc2c1CCC2	747982894	MWUDLXJJEACNCC-UHFFFAOYSA-N	438.513	1.839	50	20	IDGD	
CS(=O)(=O)CC[C@H](NC(=O)c1ccccc1Cl)C(=O)NNc1cccc(C#N)c1	748029609	KJIIWJOWJRFXCN-KRWDZBQOSA-N	434.905	1.888	50	20	IDGD	
CC(C)Oc1ccccc1CC(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	748697489	KWNQULDBJBRXAP-UHFFFAOYSA-N	425.894	1.778	50	20	IDGD	
Cc1ccc(N2CCN(C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)[C@H](C)C2)cc1C	749112084	UBMVAXLYWKAAEF-QGZVFWFLSA-N	434.504	1.844	50	20	IDGD	
CNS(=O)(=O)c1ccc(C(=O)NNc2nc(Br)cn3ccnc23)cc1	750248723	SRULFFXMBKHNFM-UHFFFAOYSA-N	425.268	1.157	50	20	IDGD	
C[C@@H]1C(=O)Nc2cc(C(=O)NNC(=O)Nc3ccc(S(C)(=O)=O)cc3)ccc2N1C	750305639	LQUZGUXXYWORSV-LLVKDONJSA-N	431.474	1.333	50	20	IDGD	
CCn1c(=O)c(C(=O)/C(C#N)=C/c2c[nH]c(C(=O)OC)c2)c(N)n(Cc2ccccc2)c1=O	753133343	OZSHQNCXNCVTOP-CXUHLZMHSA-N	447.451	1.565	50	20	IDGD	
CN(c1ccccc1)S(=O)(=O)c1cccc(NC(=O)NNC(=O)c2cnccn2)c1	755410639	XEOIDUOPNOKHIO-UHFFFAOYSA-N	426.458	1.768	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)Nc1ccc(NC(=O)[C@H]2CCCO2)cc1	755640638	KICWKGKSQBWTDG-QGZVFWFLSA-N	436.432	1.246	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)Nc2ccccc2CN2CCOCC2)c2ccccc2c1=O	756115481	QFLUWGKUGSRYSK-UHFFFAOYSA-N	436.472	1.232	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)c1	756204626	DGAHYPLWYPCFBO-UHFFFAOYSA-N	446.529	1.770	50	20	IDGD	
COC(=O)c1ccc(NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c(F)c1	756400750	DYHMTONMWKUFLC-UHFFFAOYSA-N	443.479	1.977	50	20	IDGD	
COc1c(Br)cc(Cl)cc1NC(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1	756430806	LFLCQBPEOQCCAX-SSDOTTSWSA-N	440.703	1.699	50	20	IDGD	
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)cc1	756816685	TUENOQINMMFHTD-JSGCOSHPSA-N	440.522	1.860	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N[C@H](C)[C@@H](C)CO)cc1	757090307	WSWHPAIWCHWPGT-HGHQNMJOSA-N	425.489	1.474	50	20	IDGD	
COC(=O)C12CCC(C(=O)NNC(=O)c3cccc(S(=O)(=O)N4CCCC4)c3)(CC1)C2	757765305	DLBVGTPLFUNDEJ-UHFFFAOYSA-N	449.529	1.356	50	20	IDGD	
CCOC(=O)Cn1cccc(NC(=O)NNC(=O)[C@H](C)Oc2ccc(C(C)=O)cc2)c1=O	757765578	SXRXTMAOWBWWIK-AWEZNQCLSA-N	444.444	1.234	50	20	IDGD	
CC(C)C[C@@H](Cc1cccc(Br)c1)C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O	758043060	DOINZSALRIGZEN-JSGCOSHPSA-N	448.383	1.739	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CCCCCC[C@@H]1C(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1	758184265	OLVZIZYIKDLFNV-QLFBSQMISA-N	446.570	1.368	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)N=c2cc[nH]cc2I)c1	760034177	LWLWBFPHASUKTB-UHFFFAOYSA-N	432.243	1.660	50	20	IDGD	
C[C@H](C[C@@H]1CCOC1)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	760194066	MYGOQUIUYNWUIS-CVEARBPZSA-N	438.550	1.620	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C(=O)Nc2ccnn2Cc2ccc(F)cc2)nc2ccccc21	760307751	RZQXOLXTBUNUCC-UHFFFAOYSA-N	449.446	1.286	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C[C@H]1CN(C(=O)OC(C)(C)C)CCO1	761626961	PPJZHRGBWHJOKF-AWEZNQCLSA-N	439.534	1.961	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)C3(S(C)(=O)=O)CCCC3)n[nH]2)cc1OC	763153190	YBNNTHRYEFHXPG-UHFFFAOYSA-N	436.490	1.212	50	20	IDGD	
Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)NNC(=O)CCCNC(=O)OC(C)(C)C	763438532	AIASEGFOMWWPJM-UHFFFAOYSA-N	430.483	1.826	50	20	IDGD	
CCCOC(=O)c1cc(Br)ccc1NC(=O)C(=O)NNC(=O)c1ccccn1	763466415	HYLCPEPQASQUAN-UHFFFAOYSA-N	449.261	1.811	50	20	IDGD	
COCCOc1ccccc1NC(=O)C(=O)NNC(=O)c1ccccc1Br	763483453	TUOIAAPGOSUIOT-UHFFFAOYSA-N	436.262	1.874	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2cc3ccccc3cc2O)cccc1-n1cnnn1	763521729	IRDKGFDIYDODBJ-UHFFFAOYSA-N	431.412	1.229	50	20	IDGD	
CCOC(=O)/C=C/c1ccc(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1	763572463	RKJSNSJNYHYQCP-ZPHJMFTNSA-N	439.424	1.189	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)cc1S(C)(=O)=O	763603952	DIZWBPXKSRIJHE-UHFFFAOYSA-N	441.469	1.188	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccc(Cl)c1-n1cccn1	763663293	QVLIPZQTRJWUEO-UHFFFAOYSA-N	443.847	1.699	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2cccc(N3CCOC3=O)c2C)c1	763665662	MPDFBUUDODCMLH-UHFFFAOYSA-N	440.456	1.733	50	20	IDGD	
CC(C)(C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)cc1	763680633	GAOJUYBNAOYUCU-UHFFFAOYSA-N	437.456	1.251	50	20	IDGD	
N#CCn1cc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccco3)nc3ccccc23)cn1	763762562	DBAGUXQOOUXEAB-UHFFFAOYSA-N	429.396	1.615	50	20	IDGD	
O=C(NNC(=O)c1cc2c(s1)CCC2)C(=O)Nc1cc(N2CCNC2=O)ccc1Cl	763784370	WGAIGIKSSNUALW-UHFFFAOYSA-N	447.904	1.820	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)C(=O)Nc1ccccc1-n1ccnn1	763854530	ROTDPQFVMNTEGE-OAHLLOKOSA-N	444.451	1.974	50	20	IDGD	
Cc1nc(C)n(-c2ccccc2NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)n1	763866308	VLDCRPSFDXAKML-LBPRGKRZSA-N	440.435	1.577	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(C)n([C@@H](C)C3CC3)n2)cc1OC	763912815	VNVYZEKNBOCAHF-ZDUSSCGKSA-N	429.477	1.970	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Br)s2)cc1F	763940532	SQFVTZMKRQHAHI-UHFFFAOYSA-N	444.238	1.836	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3ccn(Cc4ccccn4)n3)cc2C1	763941968	ZSIGLBPSEJFQAC-CYBMUJFWSA-N	438.513	1.912	50	20	IDGD	
O=C(NNC(=O)c1ccc[nH]1)C(=O)Nc1cccc(-c2cn(Cc3ccccc3)nn2)c1	763979915	OACYPKFEGVYJEP-UHFFFAOYSA-N	429.440	1.721	50	20	IDGD	
COCCn1nc(C)c(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(C)cc3)[nH]n2)c1C	764112326	JQLRHWYXIKJMGB-UHFFFAOYSA-N	439.476	1.245	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2cnc(Br)c(C)c2)cc1	764131809	OSGLTYXCWSPDFO-UHFFFAOYSA-N	435.278	1.880	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2cccc(C)c2C(=O)N2CCCC2)c1O	764132333	NEMMSYKDBMEMIN-UHFFFAOYSA-N	440.456	1.345	50	20	IDGD	
Cc1cc(C)n(-c2ccc(NC(=O)C(=O)NNC(=O)[C@H]3Cc4ccccc4O3)cc2F)n1	764164703	SGMRORMLKFJJKY-LJQANCHMSA-N	437.431	1.718	50	20	IDGD	
CC(=O)c1ccc(NC(=O)C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)cc1Cl	764204995	WXJMMJSXSUEHGT-UHFFFAOYSA-N	440.884	1.933	50	20	IDGD	
Cc1ccc(N2CCOC2=O)cc1NC(=O)C(=O)NNC(=O)Cn1ccc2ccccc21	764244411	IFBLVVQYSICPDR-UHFFFAOYSA-N	435.440	1.692	50	20	IDGD	
COC(=O)c1ccc(OC)cc1NC(=O)C(=O)NNC(=O)c1cccc(OC(F)F)c1	764251823	ZHBUJICRHASHDQ-UHFFFAOYSA-N	437.355	1.483	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1)C(=O)Nc1cccnc1OCC(F)F	764387383	KXZUTPQONNBDNL-UHFFFAOYSA-N	448.361	1.654	50	20	IDGD	
COC(=O)N(C)c1ccc(NC(=O)C(=O)NNC(=O)CSc2ccccc2OC)cc1	764392353	DTWGLESLAYVQFI-UHFFFAOYSA-N	446.485	1.776	50	20	IDGD	
O=C(NNC(=S)NCc1ccon1)c1cccc(S(=O)(=O)NCc2ccccc2)c1	764453188	PKESYYXZPHMXQW-UHFFFAOYSA-N	445.526	1.462	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@]2(CCN(CC(=O)NNC(=O)c3ccc(C#N)cc3)C2)C1	765028980	ZIDOGMZAAUGNHC-JOCHJYFZSA-N	427.505	1.652	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)[C@H](O)CCc1ccccc1	765176794	NTUWTXIFJFQZCU-OAQYLSRUSA-N	444.963	1.599	50	20	IDGD	
O=C(CNC(=O)c1c(Cl)cccc1[N+](=O)[O-])NNC(=O)CSc1ccccc1O	765253992	YGASNVYBVPEURG-UHFFFAOYSA-N	438.849	1.623	50	20	IDGD	
O=C(CNC(=O)c1ccc(Br)s1)NNC(=O)CSc1ccccc1O	765403669	RHNYZZWKXBSFAL-UHFFFAOYSA-N	444.332	1.886	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)c1ccc(OCC(F)(F)F)cn1	765481947	PGUABTCJPGCXTD-UHFFFAOYSA-N	430.770	1.754	50	20	IDGD	
Cc1nn2c(C=NNC(=O)c3cccc(S(=O)(=O)N4CCCC4)c3)c(C)nc2s1	765549439	VQDKEORJIRXXDV-UHFFFAOYSA-N	432.531	1.956	50	20	IDGD	
Cc1cc(N2CC[C@H](NC(=O)NNC(=O)c3cnn(C)c3)C2=O)ccc1Br	765918580	RZOHMLCKTSCEAI-AWEZNQCLSA-N	435.282	1.241	50	20	IDGD	
Cc1ccc(N2C[C@@H](C(=O)OCC(=O)NNC(=O)Cc3ccccc3C)CC2=O)cc1F	767258864	YNAWRFGALYGARR-KRWDZBQOSA-N	441.459	1.729	50	20	IDGD	
CCOc1ccc(-c2nnc(SCC(=O)NNC(=O)Cc3ccccc3C)n2N)cc1	768263748	YYWUMPPJMIBLBQ-UHFFFAOYSA-N	440.529	1.848	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)CCn3cc([N+](=O)[O-])nc3C)n[nH]2)cc1OC	768279429	ODGDDYFNLJSFKD-UHFFFAOYSA-N	443.420	1.358	50	20	IDGD	
CNC(=O)C1CN(C(=O)/C(C#N)=C/c2cn(CCC(N)=O)nc2-c2ccc(Cl)cc2)C1	768651180	KKADWQDOEFWBBZ-RIYZIHGNSA-N	440.891	1.190	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)N[C@H](C)CNC(=O)OC(C)(C)C)nc1	769538018	KESMILNLYJOKGC-CYBMUJFWSA-N	444.558	1.651	50	20	IDGD	
C[C@H](CN1CCOCC1)C(=O)NNC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1	769684681	LOEIKUDOMZPLBS-QGZVFWFLSA-N	434.500	1.664	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)CNC(=O)c3sc4ccccc4c3Cl)nc21	771020650	KXDIYUWPWJPWQJ-UHFFFAOYSA-N	431.865	1.810	50	20	IDGD	
Cc1cc(NC(=O)NNc2ccnc(Br)c2)n([C@@H]2CCS(=O)(=O)C2)n1	771098974	MNENYPUFYNEXLR-LLVKDONJSA-N	429.300	1.857	50	20	IDGD	
O=C(COC(=O)c1ncccc1C(F)(F)F)NNC(=O)[C@H]1COc2ccccc2O1	771115729	PUUNCRNJWINHOM-CYBMUJFWSA-N	425.319	1.245	50	20	IDGD	
COc1ccccc1[C@]1(C)NC(=O)N(CC(=O)NNC(=S)Nc2cccc(C)c2)C1=O	771253789	ZQHSSIKXFSNFJF-NRFANRHFSA-N	441.513	1.788	50	20	IDGD	
O=C(NNc1ccnc(Br)c1)c1ccc(S(=O)(=O)N2CCOCC2)cc1	771538103	VXPIMDZSFUTHSG-UHFFFAOYSA-N	441.307	1.622	50	20	IDGD	
CCn1c(=O)nc(O)c2c(C(=O)O[C@H](C)C(=O)NNC(=O)CC(C)C)cc(C(C)C)nc21	771995265	QPTSOBMJZOXCKN-GFCCVEGCSA-N	447.492	1.379	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)CSc1nc2ccccc2nc1N1CCCC1	772192718	WUPDCBTYAPWKAA-CYBMUJFWSA-N	431.518	1.811	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)c3cnn(CC(=O)NC4CCCC4)c3)n[nH]2)cc1	772477786	SKVOZCGBXNOGFR-UHFFFAOYSA-N	449.515	1.969	50	20	IDGD	
COc1cc(CC(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)cc(OC)c1OC	772889942	UJKVKORJRXGCOG-UHFFFAOYSA-N	435.864	1.372	50	20	IDGD	
O=C(NNc1ccccc1[N+](=O)[O-])C(=O)Nc1cccc(OCC(=O)N2CCCC2)c1	773654164	QZDOQCVAQZGWSD-UHFFFAOYSA-N	427.417	1.678	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)Nc2ccc(C[C@H]3NC(=O)NC3=O)cc2)c1	775704184	AEOAOOIPRGKDST-MRXNPFEDSA-N	425.445	1.286	50	20	IDGD	
O=C(CCNc1ccccc1[N+](=O)[O-])N1CCN(S(=O)(=O)CBr)CC1	777776960	ASKGEPJKYVSCEN-UHFFFAOYSA-N	435.300	1.223	50	20	IDGD	
CCCOc1ccc(OCC(=O)N2CCN(S(=O)(=O)CBr)CC2)cc1	777833182	VNBUETIJRYGQLC-UHFFFAOYSA-N	435.340	1.681	50	20	IDGD	
COCCN1C(=O)CCc2cc(NC(=O)C(=O)NNC(=O)c3ccc(C)c(F)c3)ccc21	778726661	RVEIDSNKZOEFQW-UHFFFAOYSA-N	442.447	1.459	50	20	IDGD	
C[C@H]1C(=O)CC[C@@H](C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)C1(C)C	780171137	IBPYOWAXRDJKHI-YOEHRIQHSA-N	435.546	1.874	50	20	IDGD	
CN(Cc1cccc(NC(=O)C(=O)NNc2cncc(Cl)n2)c1)C(=O)C(F)(F)F	783258381	GYXNZDSXANFWDP-UHFFFAOYSA-N	430.774	1.733	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2cccc(OCCF)c2)nc1	783265786	XSCMOWKOUAGXCY-UHFFFAOYSA-N	439.469	1.198	50	20	IDGD	
CCc1ncsc1NC(=O)C(=O)NNc1ccccc1S(=O)(=O)NC(C)(C)C	784833744	MTDSNAFEIAOOEL-UHFFFAOYSA-N	425.536	1.864	50	20	IDGD	
CS(=O)(=O)CCOc1cccc(NC(=O)C(=O)NNc2cccc(C(F)(F)F)n2)c1	784959178	SSLVONIULDXOEL-UHFFFAOYSA-N	446.407	1.606	50	20	IDGD	
COC(=O)CCNC(=O)c1ccc(NC(=O)C(=O)NNc2ccc(C#N)c(Cl)c2)cc1	785092152	TYUVLPKAJCJNAI-UHFFFAOYSA-N	443.847	1.586	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)N[C@H]2CCCN(C3CCCCC3)C2=O)cc1C	785921514	FBIBPSFAMTUTFO-SFHVURJKSA-N	429.521	1.896	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(C)c(N3CCNC3=O)c2)cc1C	787541149	MQWCDKNGWGVODV-UHFFFAOYSA-N	439.472	1.306	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cc(-c3ccsc3)nn2C)cc1C	787541216	OGKCTCDTHYNISI-UHFFFAOYSA-N	427.486	1.930	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(C)c(C(=O)N(C)C(C)C)c2)c1O	787541765	DICDBOFKHLGKIT-UHFFFAOYSA-N	442.472	1.589	50	20	IDGD	
CC(C)CN1C[C@H]2CN(C(=O)NNC(=O)c3cccc(OC(F)F)c3)CCN2C1=O	787857780	MRUIHVSZORDZAN-CQSZACIVSA-N	425.436	1.720	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccc(C(=O)NNc2ccccc2S(N)(=O)=O)cc1	788232800	YSPMJULICZKMIJ-UHFFFAOYSA-N	426.520	1.168	50	20	IDGD	
CC[C@H]1CCc2nc(NC(=O)C(=O)NNC(=O)[C@@H]3COc4ccccc4O3)sc2C1	789731202	BFKNKQWLDFUGPP-NHYWBVRUSA-N	430.486	1.584	50	20	IDGD	
CC[C@@H]1CCc2nc(NC(=O)C(=O)NNC(=O)c3nnc(O)c4ccccc34)sc2C1	789731309	BJQBMLQNKSHJFD-SNVBAGLBSA-N	440.485	1.707	50	20	IDGD	
COc1c(C(=O)N(C)C)cc(Cl)cc1S(=O)(=O)NNC(=O)c1ccc(Cl)nc1	790056013	ZSMGBMOBHYBTJO-UHFFFAOYSA-N	447.300	1.722	50	20	IDGD	
C=CCC1(C(=O)NNC(=O)CN2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)CCC1	790783404	BFHMCFZLMWKTKW-UHFFFAOYSA-N	434.562	1.195	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cnc(C(F)(F)F)cc2OC)cc1	792269102	VDASGDKXIXFZDK-UHFFFAOYSA-N	442.350	1.283	50	20	IDGD	
CC[C@H](C)n1ncc(NC(=O)C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)c1C	792270758	GCZDEEBQRXBMPJ-NSHDSACASA-N	449.537	1.164	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)COc2cc(C)ccc2C)cc(-n2cccn2)c1	792352714	HJTJBPKGTZHMNW-UHFFFAOYSA-N	437.456	1.663	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@H](C(=O)NNC(=O)c2ccc3ccccc3n2)[C@@H](C)O)cc1	792544172	YEZNNEFPRZCKCY-KUHUBIRLSA-N	442.497	1.032	50	20	IDGD	
CC1CCC(OCC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)CC1	792772503	IXAOGQODZPQAEJ-UHFFFAOYSA-N	439.534	1.064	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1	794077365	UBIYZUIULMGSOB-UHFFFAOYSA-N	441.444	1.882	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NN=C1CCOC[C@@H]1C)N(S(C)(=O)=O)CC2	794485840	LTHAHVUCJNXMFR-GUYCJALGSA-N	439.534	1.481	50	20	IDGD	
CNc1ccc(C(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)cn1	794765941	CLFFYHVVUNOYSP-UHFFFAOYSA-N	428.452	1.956	50	20	IDGD	
O=C(NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)C1=S=C(C(F)(F)F)C=C1	794773980	AMWIMIGGGZCNFA-UHFFFAOYSA-N	447.460	1.442	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNS(=O)(=O)c1cncc(Br)c1	795344335	GGBRCZGXNRVFHF-UHFFFAOYSA-N	437.316	1.459	50	20	IDGD	
CC(C)Oc1ccc(F)cc1NC(=O)C(=O)NNC(=O)CNC(=O)OCc1ccccc1	797369283	RWOXRTIBIWPURK-UHFFFAOYSA-N	446.435	1.625	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NN=C(C)c1ccc(Br)c(S(N)(=O)=O)c1	797402809	PMQPSDSBMCXQMY-UHFFFAOYSA-N	433.328	1.242	50	20	IDGD	
C[C@H](Oc1ccc(Br)cc1)C(=O)NNC(=O)CCN1C[C@@H](C)O[C@H](C)C1	799101129	LEEGCRVIVOLZMH-MCIONIFRSA-N	428.327	1.863	50	20	IDGD	
Cc1ccc(C2=NO[C@H](CNC(=O)NNC(=O)C3CCN(c4ncccn4)CC3)C2)cc1	800751322	VQWYDNJSPUNFJW-SFHVURJKSA-N	437.504	1.525	50	20	IDGD	
COc1cc(-n2cnnn2)c(Cl)cc1C(=O)NNC(=O)C(=O)Nc1ccc(C)cc1	801108657	FKCRERZKVJHFOU-UHFFFAOYSA-N	429.824	1.032	50	20	IDGD	
COc1ccc(S(=O)(=O)NC(C)(C)C)cc1NC(=O)C(=O)NNc1ncccc1F	807301072	TXHPQQCPSKPBSG-UHFFFAOYSA-N	439.469	1.388	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)c2cc(S(=O)(=O)NC3CC3)ccc2C)c1	811879482	VTAWHCMQYHXJSY-UHFFFAOYSA-N	433.486	1.528	50	20	IDGD	
CC(=NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1ccc2nc(O)[nH]c2c1	812376874	UMPIWKYXCMLPMA-UHFFFAOYSA-N	443.485	1.443	50	20	IDGD	
CCc1nnc(CNC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)s1	812599173	RLXUJTLVCOIVKI-UHFFFAOYSA-N	438.535	1.029	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)c1c(I)cnn1C	814103103	KOWQRPBILXGCOB-UHFFFAOYSA-N	444.229	1.263	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1ccc(Br)c(C#N)c1	815564341	GFYBTUVTMKZWLV-UHFFFAOYSA-N	441.245	1.677	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)N(C)C)c(C)c(OC)c1	815752563	XJAKFDMCVQFADF-UHFFFAOYSA-N	436.490	1.344	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)c2cc(S(=O)(=O)NC3CC3)ccc2C)c1	825810790	SBCLOPWSICMHJM-UHFFFAOYSA-N	432.502	1.317	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)O[C@H](C)C(=O)Nc2ncnc3[nH]cnc23)c1C	897563599	XKHNNQAKUYVWJH-MEFZMRIGSA-N	437.460	1.895	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)OCC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)cc(C#N)n1C	913287301	ZZSOEZMIRVHVMT-DXNYSGJVSA-N	437.368	1.931	50	20	IDGD	
O=C(CN1C(=O)N[C@@]2(CCc3ccccc32)C1=O)NNC(=O)c1cc(-c2ccccc2)[nH]n1	913422618	AWUHAUFMSPJTLV-HSZRJFAPSA-N	444.451	1.231	50	20	IDGD	
O=C(NNC(=O)c1cc(S(=O)(=O)N2CCOCC2)ccc1F)NC1CCCCC1	913449421	XPWLHHYIFZNECZ-UHFFFAOYSA-N	428.486	1.123	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCOc2ccccc2)c1	915895597	RYTJDPQTBSBILJ-UHFFFAOYSA-N	434.518	1.740	50	20	IDGD	
COc1ccc(OC)c(C(C)=NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c1	916258995	SHWQUPLWLSYOHH-UHFFFAOYSA-N	447.513	1.879	50	20	IDGD	
CCn1c(=O)c2ccccc2n(CC(=O)NNC(=O)Cc2ccc3ccccc3c2)c1=O	917195590	RVWNXMRPQGNAJN-UHFFFAOYSA-N	430.464	1.726	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)CNS(=O)(=O)c2ccc(C)c(C)c2)c2ccccc2n1	917365406	NGIYNKCRSCUCDS-UHFFFAOYSA-N	426.498	1.900	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2cc(OC)c(OC)c(C(=O)O)c2)cc1OC	917717620	LFCMBOQDDBOPGQ-UHFFFAOYSA-N	440.430	1.043	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2ccc(C#N)cc2C(F)(F)F)c1	917737063	FNPWJDXHQSUDGA-UHFFFAOYSA-N	447.416	1.604	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@@H](C)N2CCCCC2)c1	918121546	SVSBRRJWSHUFDO-MRXNPFEDSA-N	439.582	1.536	50	20	IDGD	
C[C@H](C(=O)NNC(=O)c1nn(-c2ccccc2)cc1O)S(=O)(=O)c1ccc(F)cc1	918300412	KVMJOIMPXAVZIQ-GFCCVEGCSA-N	432.433	1.340	50	20	IDGD	
COc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NNC(=O)c2ccc(Cl)cc2O)cc1	918358774	ZEYPENPSTWJTHG-JTQLQIEISA-N	427.866	1.182	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCCc1ccc([N+](=O)[O-])cc1	919780874	SNOXQTCSZYYFLV-UHFFFAOYSA-N	434.478	1.383	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)CCc2ccc3c(c2)CCO3)cc1	1116245311	NISTXBNIAZKLAF-UHFFFAOYSA-N	431.514	1.331	50	20	IDGD	
Cc1cc(C)n2ncc(C(=O)NN(C)C(=O)N3CCN(C(=O)OC(C)(C)C)CC3)c2n1	1320148698	SZXOBDBAXUWRDQ-UHFFFAOYSA-N	431.497	1.595	50	20	IDGD	
O=C(NNC(=O)c1n[nH]c2c1CCCC2)c1cccc(NS(=O)(=O)C(F)(F)F)c1	1320858506	YJPLDANLFSQQRQ-UHFFFAOYSA-N	431.396	1.625	50	20	IDGD	
O=C(NNC(=O)c1ccccc1Cl)Nc1cccc(S(=O)(=O)N2CCOCC2)c1	1321001926	GKLFUFIODNOTBH-UHFFFAOYSA-N	438.893	1.827	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)N[C@@H]2CCO[C@]3(CCOC3)C2)CC1	1337107888	CXOUZRGMMXREEP-FOIQADDNSA-N	426.514	1.302	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnc4ncccn34)C2)C1	1777930172	NCRVIICSPKVKQD-SCLBCKFNSA-N	436.310	1.204	50	20	IDGD	
O=C(c1ccc2nccnc2c1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1777978826	CUFLRIVMENDLDZ-CRAIPNDOSA-N	437.269	1.764	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cnc3ccccc3n1)CCO2	1779295411	NAUOJVAYHAFWJG-OAQYLSRUSA-N	428.565	1.925	50	20	IDGD	
Cn1c(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](F)Cl)CCO3)cc2c[nH]c3nccc-3c21	1780036966	LMBPKHIFSBFMAU-JXFKEZNVSA-N	433.871	1.984	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)c1ccccc1)C2)[C@@H](F)Br	1780771978	XNIFLVIWTHFVHI-YYAJDYIMSA-N	443.313	1.924	50	20	IDGD	
C[C@H](Nc1cccnc1)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@](C)(Cl)CCl)C2)C1	1781227187	IBBHIULKMGCCMD-JVPBZIDWSA-N	429.348	1.948	50	20	IDGD	
O=C(c1nnsc1C1CC1)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781329920	NSSTZRIYDCLQRS-SWLSCSKDSA-N	433.303	1.550	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(O)ccc3O)C2)C1	1782049519	VKSXKTFKSQSCAN-KSSFIOAISA-N	427.295	1.715	50	20	IDGD	
O=C(c1ccc2c(Cl)ccnc2c1)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1782201447	ADRNLRNELSEQGS-XLIONFOSSA-N	438.311	1.931	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@]2(C)CC=CCC2)C1	1782726349	MCWZYHCNBPILPV-YFXJRYMSSA-N	434.581	1.620	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@]2(C1)CN(C(=O)C1CC(O)C1)CCO2	1782862323	RWYMYJYOPUWBRE-ONIAKABXSA-N	431.439	1.473	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](C)n1ccccc1=O)CCO2	1783534311	SNIXXLMTDIFAQP-PMUMKWKESA-N	426.311	1.023	50	20	IDGD	
Cc1nccn1CCCC(=O)N1CCO[C@]2(CCN(C(=O)[C@H](C)Br)C2)C1	1783539808	OCODWOIVEKZACH-KBXCAEBGSA-N	427.343	1.585	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)COc3cccc(Cl)c3)CCO2)C1	1783869358	PBHJHNZRSVSWIU-LPHOPBHVSA-N	431.316	1.803	50	20	IDGD	
Cc1ccn2c(=O)c(C(=O)N3CCO[C@]4(CCN(C(=O)C(Cl)Cl)C4)C3)cnc2c1	1783947975	PJKTVLLTIXUCKF-IBGZPJMESA-N	439.299	1.250	50	20	IDGD	
Cc1nn(C)c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Br)C[C@@H]32)c1F	1785778759	FQOLGCPYWCIDEI-RMIALFOJSA-N	435.269	1.151	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]2C1	1787449334	JKJQNOMDXWNABA-QXKUPLGCSA-N	447.935	1.900	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4ncnn4c3)[C@H]2C1	1788451340	GOXHWBGANSPJSN-XLPNERPQSA-N	440.331	1.559	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC1(c2ccc(NC(=O)c3cn4ncccc4n3)cc2)CCC1	1789054731	PDOCHNDCFQASPN-UHFFFAOYSA-N	449.515	1.850	50	20	IDGD	
COC[C@H](Cl)C(=O)NC1(c2ccc(NC(=O)c3cnccc3C(=O)NN)cc2)CCC1	1789521750	IYAHFBXGDJOMIA-KRWDZBQOSA-N	445.907	1.687	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3CCC4(CC3)OCCO4)[C@H]2C1	1790737140	FWFZNERAYDXGLV-XSLAGTTESA-N	428.957	1.917	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4sccn4c3)C[C@@H]21	1791254809	SRNINRWIWAIXFS-HNKHHVNMSA-N	425.938	1.848	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4c(cnn4C)c3)C[C@@H]21	1791254957	XTKWRHPWJMPSND-RMRDIRSESA-N	434.924	1.420	50	20	IDGD	
COc1ccccc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)CBr	1792872462	JDMLJFOCQYQTGL-ZJOBFFGXSA-N	425.323	1.929	50	20	IDGD	
C[C@H](CBr)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc3n(n1)CCCO3)C2	1792987590	VFPDTSACBZJECU-YIYPIFLZSA-N	425.327	1.948	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/C(=O)NCc1ccccc1)C2	1793448015	VDALBIIUOZACMN-UKLJKRKFSA-N	447.963	1.856	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1n[nH]c3c(F)cccc13)C2	1795115610	BSHPNFHAPMYYKT-QHBPRCKVSA-N	439.285	1.690	50	20	IDGD	
COCCOCCOCCOCCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](F)Cl	1796812061	RGVHKRJRWPFLTN-DFGXFYAUSA-N	438.924	1.245	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C#CC1(O)CCCCC1	1797784570	KQGOVFXTKZRRSU-LORHWOILSA-N	431.360	1.511	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1nccc3occc13)C2	1798440224	HQWIRAHSVMVZKR-BTTYYORXSA-N	434.456	1.392	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(COC)c[nH]1	1798511648	ICLUYDBTPIHRTJ-FQLMCAECSA-N	428.327	1.538	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(Cl)cc2nn[nH]c12	1798619738	OOCHJFIUZGJAGL-YJKIEOBBSA-N	426.304	1.832	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(N(C)C)cc1	1798935154	DKUOZXGEYXYOPV-NYCLONFESA-N	438.366	1.987	50	20	IDGD	
C=C(CC(=O)OCC)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](Br)CC)C2	1799306805	MSASHMUCRIIXFP-HLPPOEQASA-N	431.327	1.259	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(C(F)(F)F)c[nH]1)C2)[C@@H](F)Br	1799347763	RIPDKQDBTIIESI-IWXIMVSXSA-N	442.207	1.927	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(F)cnc1Cl)C2)[C@H](F)Br	1799350139	RTCCGERVWRIWKJ-VVJJBPBLSA-N	438.656	1.768	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(C(C)C)[nH]n1	1799387973	NVRAEQZOKKKXKO-BDHJUDLHSA-N	439.520	1.919	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(F)ccc1Cl	1799580926	QJDSPNOKPKTYOL-DBWKPXFBSA-N	440.903	1.055	50	20	IDGD	
CCOC(=O)O[C@@H](C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](Br)CC)C2	1800233271	LXWAEQQRKQHEOQ-QNSTZXKLSA-N	435.315	1.311	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1n[nH]c2cccc(F)c12	1801128656	YXSSAFAIZHZGDK-BTTYYORXSA-N	430.484	1.327	50	20	IDGD	
CN1N=C(C(=O)N2CC[C@H](CNC(=O)C(C)(C)CCl)[C@@H]2c2cccnc2)CCC1=O	1802898767	ZHOYXMGCGMLFQT-QAPCUYQASA-N	433.940	1.961	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1CCN(C(=O)C(=O)N(C)C)[C@@H]1c1cccnc1	1803009513	WNKIYZUQRSWYRL-VHDGCEQUSA-N	425.327	1.207	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc2c(c1)CCCO2)c1cccc(B(O)O)c1	1803523925	AAQOEJIJJKXMLG-WKCHPHFGSA-N	434.301	1.257	50	20	IDGD	
COc1ccc(C(=O)N2CCC3(CCCN(C(=O)[C@H](O)CCl)C3)CC2)c(O)c1OC	1805525908	ATPRFXDEBLAYOX-OAHLLOKOSA-N	440.924	1.854	50	20	IDGD	
C[C@@H](NC(=O)c1ccccc1)C(=O)N1CCC2(CCCN(C(=O)[C@H](O)CCl)C2)CC1	1805529065	IJKVBKVCBWMBIS-SJLPKXTDSA-N	435.952	1.636	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2cscn2)[C@H]1c1cccnc1	1805748432	ODBIOZJKHWYTEI-DNVCBOLYSA-N	430.534	1.231	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H](CNC(=O)CN2CCCC2=O)[C@@H]1c1cccnc1	1806923722	DKFPOTYEKZAAJL-BPAFIMBUSA-N	441.359	1.946	50	20	IDGD	
N[C@H](CC(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)c1cccnc1	1807260438	OPHPYCQBEJUZQP-HLNWXESRSA-N	431.924	1.172	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)[C@H]2C[C@@H]2F)[C@H]1c1cccnc1	1808416190	GPBFKUXVZXGEPR-VMULSPLHSA-N	440.479	1.579	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC2(CCCN(C(=O)CNc3ccc(F)cc3)C2)CC1	1809703995	GJEQLIJEUCAVNV-UHFFFAOYSA-N	447.555	1.842	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@H]1CCN(C(=O)Cn2ccncc2=O)[C@H]1c1cccnc1	1810543562	BXYAXJHQVZWGTG-UTKZUKDTSA-N	443.580	1.196	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@H](CNC(=O)c2ccnnc2O)[C@@H]1c1cccnc1	1811228303	CPHJYFSNMTVRJT-YJBOKZPZSA-N	429.553	1.748	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2ccn(C)c2)[C@H]1c1cccnc1	1813070791	LXFFIUGCHFSGGY-UWJYYQICSA-N	426.521	1.113	50	20	IDGD	
O=C(Nc1cccnc1)C(=O)N1CC[C@H](CNC(=O)C(Cl)Cl)[C@H]1c1cccnc1	1813077369	HEWWXXIBPBGJGD-UKRRQHHQSA-N	436.299	1.925	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)N1CC[C@H](CNC(=O)C(Cl)Cl)[C@H]1c1cccnc1	1813078786	SFVCYLPCJCJIFS-MRVWCRGKSA-N	430.336	1.599	50	20	IDGD	
C[C@H](C(=O)NC[C@@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1)n1cnnn1	1813467851	JWZMGVYJRHBDNS-INWMFGNUSA-N	436.314	1.120	50	20	IDGD	
CC(C)(CCl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](O)N2CCOCC2)[nH]n1	1814697213	SGQDDXAIKRZSRJ-GOEBONIOSA-N	427.933	1.317	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)Cn3cc(Cl)cn3)sc2C1	1815413879	LRHPKQXOXWAXBF-GHMZBOCLSA-N	432.333	1.859	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1ccccc1O	1816263373	KJBNIAPBTBQLGI-SFHVURJKSA-N	434.261	1.415	50	20	IDGD	
O=C(CCBr)Nc1cc([C@@H]2CCCCN2C(=O)CN2CCOC2=O)[nH]n1	1816782255	RHWPVXBKDTUJAK-LBPRGKRZSA-N	428.287	1.639	50	20	IDGD	
O=C(Cc1ccccc1)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1816889526	ZENGMDHSMMYHRW-FQEVSTJZSA-N	432.289	1.638	50	20	IDGD	
CC(C)N[C@H](C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1)C(C)C	1817456590	UUTAHGVGDNAJIO-UTKZUKDTSA-N	449.600	1.797	50	20	IDGD	
Cc1cc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@H](O)CCl)CC3)nn1C(F)F	1821555551	QYCMSOQZWCKIPT-LDYMZIIASA-N	433.868	1.869	50	20	IDGD	
COC[C@H](NC(C)=O)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](C)Br)n[nH]1	1822189236	QNRGSJJHIWYDJF-LEWSCRJBSA-N	444.330	1.336	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CN2CCSCC2)[nH]n1	1822367131	NOKVGEKYPZMRJR-UKRRQHHQSA-N	429.974	1.704	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)CNC(=O)C(F)(F)F)[nH]n1)C(Cl)Cl	1822421342	JEHBGWHNGRMVTE-MRVPVSSYSA-N	430.214	1.884	50	20	IDGD	
O=C([C@@H](O)CCl)N1CCCC[C@H]1C1CCN(C(=O)C(F)(F)C(F)(F)C(=O)O)CC1	1824178027	BWNHARUAWDTUER-RYUDHWBXSA-N	446.825	1.561	50	20	IDGD	
O=C(c1cccn2c(O)nnc12)N1CCC([C@H]2CCCCN2C(=O)[C@@H](O)CCl)CC1	1824183323	UMRHICSNBVWPHU-CVEARBPZSA-N	435.912	1.268	50	20	IDGD	
C[C@H](CS(C)(=O)=O)C(=O)N[C@@H]1CCc2nc(NC(=O)C(Cl)Cl)sc2C1	1826093403	ZQGUHVFYDHGVRB-HTQZYQBOSA-N	428.363	1.540	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](C)n3cncn3)sc2C1	1826781727	HHSHVHALEXNJAH-MXWKQRLJSA-N	441.355	1.939	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1	1827428956	MNNRZBFUPIZSMU-HZPDHXFCSA-N	425.913	1.980	50	20	IDGD	
CC(C)O[C@H](C)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H](C)CBr)CCO2)C1	1830539436	GRYZZJKABZALIV-HDMKZQKVSA-N	435.359	1.287	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CCCS3)C2)C1	1830545423	IYHDEUOHVVEBQP-JKIFEVAISA-N	435.384	1.369	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnn4ncccc34)C2)C1	1831645382	AMELPKINLJDOHY-OXJNMPFZSA-N	435.912	1.207	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccccc2O)CC1	1831871852	HNPPHWFHQQZJEB-IBGZPJMESA-N	430.549	1.999	50	20	IDGD	
Cc1[nH]nc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)c1F	1833675422	SWSYSYBZQYHLTF-DLBZAZTESA-N	437.299	1.164	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@]3(CN(C(=O)CCBr)CCO3)C2)c(C)o1	1834819119	HOSHZMNAHJSGMC-SFHVURJKSA-N	429.311	1.751	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)c1c[nH]c2ncccc12	1835317232	OIGXFGCRVGXUCY-SFHVURJKSA-N	433.940	1.348	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccsc3)CCO2)C1	1836101731	DEEVNJZVRPOAMH-ROUUACIJSA-N	435.373	1.983	50	20	IDGD	
CCc1ccnc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)c1	1836359983	MXTLGKJCVIDHMW-VQTJNVASSA-N	444.359	1.950	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc4c(c3)CC(=O)N4)CCO2)C1	1836784489	KOEIYVFYQHXMLP-QFIPXVFZSA-N	449.935	1.516	50	20	IDGD	
CC(C)[C@@H](S)C(=O)N1CCC(OC2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1	1836882656	GPGSMQTVRMOIJD-HXUWFJFHSA-N	442.626	1.312	50	20	IDGD	
CC#CC[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1)c1ccccc1	1837611236	FOHUOEPBBNIWIP-MZKRTTBSSA-N	448.947	1.240	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)s1	1837712427	QCSHRQNBMOZHQC-LJQANCHMSA-N	426.611	1.978	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)[C@@H]3CCC(=O)N3)CC2)CC1	1837738271	BVOLPSUGTMFJSW-CVEARBPZSA-N	444.370	1.437	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccn(-c4ccccc4)n3)CCO2)C1	1838746689	JFVUKIILWYWRHE-GCJKJVERSA-N	446.935	1.960	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cccc(OC)n3)C2)C1	1839142125	FKEQBUUDRUUPML-OXJNMPFZSA-N	425.913	1.107	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3c4c(nn3C)CCC4)CCO2)C1	1839581106	DLWAGBZYGOOKAB-IERDGZPVSA-N	438.956	1.386	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(F)nc3F)C2)C1	1840029865	SWCLGZPRXUVRQS-APPDUMDISA-N	448.264	1.213	50	20	IDGD	
COc1ccsc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)Br)CCO2	1840034322	HWBKJDFMMZLGOY-YVEFUNNKSA-N	447.351	1.610	50	20	IDGD	
COC1(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)CCC1	1840036309	IPPPPBBNKIXITG-RDTXWAMCSA-N	433.343	1.185	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)Cc1cccnc1Cl)C2	1843415533	VYXIIECRBGAEBR-AFUMVMLFSA-N	442.907	1.615	50	20	IDGD	
Cc1oc2cc(O)ccc2c1C(=O)N1CC2(CCCN2C(=O)c2cnccc2C(=O)NN)C1	1844264337	IDYRNNKWNALXIZ-UHFFFAOYSA-N	449.467	1.576	50	20	IDGD	
COc1c(C)cc(C(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)cc1C	1844264968	DKVUAKHTZTUFIQ-UHFFFAOYSA-N	437.500	1.441	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC12CN(C(=O)CCS(=O)(=O)c1ccccc1)C2	1846176126	OAGZRSNMTNJZPG-CQSZACIVSA-N	443.363	1.837	50	20	IDGD	
COc1ccc2cc(C(=O)N3CC4(CCCN4C(=O)CCC(=O)NN(C)C)C3)[nH]c2c1	1846384775	GUQCRXFLELGTOJ-UHFFFAOYSA-N	427.505	1.367	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)c1cn3ccc(Cl)cc3n1)C2	1846385070	QSUQBWFJLBAGOT-UHFFFAOYSA-N	432.912	1.178	50	20	IDGD	
O=C([C@@H]1[C@@H](O)CCN1Cc1ccccc1)N1CC2(CCCN2C(=O)C(Cl)Cl)C1	1846388675	JNNLWEDGGDOVNT-HOTGVXAUSA-N	426.344	1.629	50	20	IDGD	
CCO/C=C/C(=O)N1CCCC12CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2	1846501718	DFJRSEJDIZZFOW-JLHYYAGUSA-N	429.521	1.086	50	20	IDGD	
CC(C)(C)OC(=O)NC1(C(=O)N2CCCC23CN(C(=O)[C@H](F)Br)C3)CC1	1847144613	NSYHLWWMJHLGLK-NSHDSACASA-N	434.306	1.938	50	20	IDGD	
CN(CC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H]1C[C@@H]1C1CC1)NC(=O)NCc1ccccc1	1847490621	UINLZLKETUQCKV-ANULTFPQSA-N	439.560	1.581	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CCNC(=O)c1ccc[nH]1	1847495947	QFPLAWVJAPJJNJ-QEJZJMRPSA-N	425.327	1.367	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)Cn1cccn1	1848098995	CHCLRZFONWBCSU-KKUMJFAQSA-N	425.917	1.217	50	20	IDGD	
Cc1nn(-c2ccc(F)cc2)c2sc(C(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)cc12	9930926	HJPXFWHWZRUJHA-LLVKDONJSA-N	436.490	1.730	50	20	IDGD	
O=C(CSc1nnc(N2CCOCC2)n1Cc1ccco1)NNC(=O)c1ccccc1	12216644	AVNPREHNDZNQDP-UHFFFAOYSA-N	442.501	1.309	50	20	IDGD	
Cc1cccc2c(=O)n(CCC(=O)NNC(=O)c3nn(-c4ccccc4)cc3O)cnc12	14337239	WFUJEBWFWSQNCG-UHFFFAOYSA-N	432.440	1.448	50	20	IDGD	
C[C@]1(NNC(=O)NC[C@@H](c2cccc(Cl)c2)N2CCOCC2)CCS(=O)(=O)C1	727034922	YAPWKZSYCGCBBE-WMZOPIPTSA-N	430.958	1.094	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)c2ccc(S(=O)(=O)NC3CC3)cc2)cc1F	727499171	INDYKLDOSOGWDR-UHFFFAOYSA-N	438.506	1.906	50	20	IDGD	
C[C@@H](C#N)Oc1ccc(C=NNC(=O)C(=O)NN=Cc2ccc(O[C@@H](C)C#N)cc2)cc1	727683253	DRYHDKJKBLZQPC-HOTGVXAUSA-N	432.440	1.869	50	20	IDGD	
O=C(CCC/N=C1/NS(=O)(=O)c2ccccc21)NNc1nc(-c2ccncc2)no1	728072413	IWJIHJZKAVOHMB-UHFFFAOYSA-N	427.446	1.094	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)Cn3ccc4ccccc43)cc2)CC1	728214624	CIZPYHVYWANUFJ-UHFFFAOYSA-N	427.530	1.721	50	20	IDGD	
CCS(=O)(=O)N[C@@H](CCSC)C(=O)NNC(=O)c1cccc(OC(F)F)c1	728487977	HKNTYMVTQAZAGR-LBPRGKRZSA-N	425.479	1.110	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)[C@H]2CCCCN2C(=O)c2ccccc2)n1	728719744	WCPLGYGFCZNCLB-MRXNPFEDSA-N	444.513	1.380	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)C2CCN(S(=O)(=O)c3cccnc3Cl)CC2)c1	728825399	ZBGSVLCDBSIMCB-UHFFFAOYSA-N	447.904	1.469	50	20	IDGD	
CC(=O)N1CCc2ccccc2[C@H]1CC(=O)NNC(=O)C1CCN(c2ncccn2)CC1	728847778	OUSKAVLIKUDDDG-HXUWFJFHSA-N	436.516	1.376	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)NC[C@H]3CCCO3)cc2)c1	728871726	BFHJQQQZBXHQOU-QGZVFWFLSA-N	428.470	1.090	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)c3ccccc3n2)cc1	729275089	KOQNXNHXLUWSEJ-ZDUSSCGKSA-N	442.497	1.609	50	20	IDGD	
CCN1CCCC[C@H]1C(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	729284053	QKRFIRXGTIZVHB-FQEVSTJZSA-N	444.557	1.801	50	20	IDGD	
COc1ccccc1CC(=O)N1CCC(NC(=O)NNC(=O)Cc2ccccc2F)CC1	731406258	SXTJHYSDPSYZDV-UHFFFAOYSA-N	442.491	1.941	50	20	IDGD	
CC(=O)N1C=Cc2ccccc2[C@H]1CC(=O)NNC(=O)c1csc(N2CCOCC2)n1	731689517	LZBQTWHXSHSUHH-GOSISDBHSA-N	441.513	1.705	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCc2ccc(F)cc2F)c1	732702894	BLLDPGJNBONDSJ-UHFFFAOYSA-N	426.445	1.402	50	20	IDGD	
N#Cc1ccc(N2C(=O)N[C@H](CCC(=O)NNC(=O)c3ccc(Cl)nc3)C2=O)cc1	733776301	OREPAYNOWBRJMV-CQSZACIVSA-N	426.820	1.273	50	20	IDGD	
COc1ccc(CN2CC[C@@H](NC(=O)NNC(=O)c3ccc(OC)c(OC)c3)C2=O)cc1	734521113	BWBKSXQEFLSRMS-QGZVFWFLSA-N	442.472	1.458	50	20	IDGD	
Nn1c(SCC(=O)NNC(=O)c2ccccc2)nnc1-c1cncc(Br)c1	736442169	XUSVINNYGXRKQA-UHFFFAOYSA-N	448.306	1.370	50	20	IDGD	
CN1CC[C@@H](NC(=O)/C(C#N)=C/c2cn(CCC(N)=O)nc2-c2ccc(Cl)cc2)C1=O	737993278	GRKGIJBGSOQVMT-IDKBZEPQSA-N	440.891	1.333	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2cc(F)ccc2O1)c1ccc(S(=O)(=O)N2CCCC2)cc1	740813394	GPKCYVLPRJRFMQ-GOSISDBHSA-N	433.461	1.375	50	20	IDGD	
CC(C)[C@@H](C(=O)OCC(=O)NNC(=O)c1cccc(C#N)c1)N1C(=O)c2ccccc2C1=O	741816527	PEKYGPWUCHADOR-IBGZPJMESA-N	448.435	1.183	50	20	IDGD	
CC(C)c1nn([C@H]2CCS(=O)(=O)C2)cc1C(=O)NNC(=O)c1ccc2c(c1)OCCO2	742502520	JZAYDPSQAVTVPI-AWEZNQCLSA-N	448.501	1.212	50	20	IDGD	
C[C@H]1Cc2ccccc2N1CCNC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	745785311	KJTDSGFFAOPFOM-AWEZNQCLSA-N	431.518	1.877	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN1C(=O)NCc1cccc(Br)c1)c1ccc[nH]1	746103291	NMSFSAXWYVTPGT-HNNXBMFYSA-N	434.294	1.912	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)c1ccc(S(=O)(=O)N2CCCCC2)cc1	746553972	TYTVSJPZVNIFQL-UHFFFAOYSA-N	441.513	1.513	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@H]2C(=O)NNC(=O)c2cccn2C)cc1	747599032	KIPCSLWDMJRUMN-SFHVURJKSA-N	432.502	1.232	50	20	IDGD	
O=C(CN1CCOC[C@@H]1C[C@H](O)c1ccccc1)NNC(=O)c1ccc([N+](=O)[O-])cc1	747661082	XWSXWGJILPNIKF-OALUTQOASA-N	428.445	1.180	50	20	IDGD	
CC(=O)N1CCCc2cc(S(=O)(=O)NNC(=O)C(=O)Nc3ccc(C)c(C)c3)ccc21	747848704	RGKPDIQYAVZIML-UHFFFAOYSA-N	444.513	1.551	50	20	IDGD	
CC(C)C(CCc1ccc(Cl)cc1)=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O	748250189	JMOCEFSRPXNWPN-UHFFFAOYSA-N	437.953	1.986	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)c1oc2ccccc2c1CSc1ncccn1	748614572	VRYNBMDKZWRMQY-LBPRGKRZSA-N	446.510	1.711	50	20	IDGD	
CCOc1ccc(C(=O)NNS(=O)(=O)c2ccc(OCC(=O)O)c(C)c2)cc1OC	748689603	NRGCVZDZKWYTBE-UHFFFAOYSA-N	438.458	1.489	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)c1	750568468	KEMIKLNHPJNHQO-UHFFFAOYSA-N	428.511	1.003	50	20	IDGD	
Cn1cc(NS(=O)(=O)c2ccsc2C(=O)NNC(=O)c2ccc3c(c2)OCO3)cn1	750715318	BOMNKFFKWZALMB-UHFFFAOYSA-N	449.470	1.086	50	20	IDGD	
COc1cccc2c1OCC(C(=O)NNC(=O)CCN1CCN(c3ccccc3)CC1)=C2	751042454	DGQYVXUDEKDASB-UHFFFAOYSA-N	436.512	1.831	50	20	IDGD	
CC(C)Cn1nc(C(=O)NNC(=O)CNC(=O)c2cccs2)c2ccccc2c1=O	751210251	BRKVCFAXKFKSLG-UHFFFAOYSA-N	427.486	1.305	50	20	IDGD	
Cc1ccc(C(=O)NNS(=O)(=O)c2cc3c(cc2Br)CCC(=O)N3)o1	753085335	LFRSWTBFQHUTQX-UHFFFAOYSA-N	428.264	1.859	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)Nc1ccc(N2C(=O)CCC2=O)c(C)c1	756551701	AHJBCNHNKKPTMC-UHFFFAOYSA-N	426.429	1.889	50	20	IDGD	
NC(=O)c1ccc(NNC(=O)CCC[S@](=O)c2ccc(Br)cc2)nn1	757400842	SFQUIJNZBMNQLP-VWLOTQADSA-N	426.296	1.369	50	20	IDGD	
CCn1cc([N+](=O)[O-])c(C(=O)NNc2ccc(S(=O)(=O)Nc3nccs3)cc2)n1	757662999	XBJXBBYIYQKQJJ-UHFFFAOYSA-N	437.463	1.825	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)c1ccc(C)cc1)C(=O)NNc1ncccc1[N+](=O)[O-]	759303375	JBRJXSWOTBFKDU-AWEZNQCLSA-N	439.519	1.842	50	20	IDGD	
CCS(=O)(=O)c1cccc(S(=O)(=O)NNC(=O)c2cccc(Br)c2)c1	760363144	SSYSCLMTTNKAGB-UHFFFAOYSA-N	447.332	1.866	50	20	IDGD	
CCCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccc3c(c2)OCO3)c1	760449228	BVBWPYBVFDWKSZ-UHFFFAOYSA-N	434.474	1.960	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)NCCNC(=O)Cc1cccc(F)c1	761675060	MRUHTBJHZIQBKA-UHFFFAOYSA-N	434.493	1.616	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(-c3noc(C)n3)c2)cc1OC	763550735	QZOUXQDZWJYABF-UHFFFAOYSA-N	425.401	1.462	50	20	IDGD	
COC(=O)c1cc(C(C)C)ccc1NC(=O)C(=O)NNC(=O)c1c(C)nc2ccccn12	763629833	ULSBRKWPSWTBAU-UHFFFAOYSA-N	437.456	1.952	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccnn2Cc2ccccc2F)cc1	763675713	ZQQMNQMJRZJYEC-UHFFFAOYSA-N	436.403	1.107	50	20	IDGD	
O=C(COc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1ccccc1O[C@H]1CCOC1	763686716	QNWOUTJEISKAHU-HNNXBMFYSA-N	433.848	1.673	50	20	IDGD	
COC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)cc1F	763734063	KYDVAKIPLBWCLS-UHFFFAOYSA-N	443.435	1.543	50	20	IDGD	
COC(=O)[C@H](C)Cc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(N(C)C)c2)cc1	763760207	HCVQVDARWQEZEY-CQSZACIVSA-N	426.473	1.504	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)C(=O)NCC3)cc1	763768903	WBNJASRQNNWHBO-UHFFFAOYSA-N	438.484	1.797	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cc(OC)cc(OC)c2)c(F)cc1F	763771457	ASOSYJLLCNVIDV-UHFFFAOYSA-N	437.355	1.168	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)C(=O)Nc1ccc(OC2CCC2)c(F)c1	763790681	MXXAHBIBYHMYCB-UHFFFAOYSA-N	439.403	1.806	50	20	IDGD	
Cc1cccc(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)c1C(=O)N1CCCC1	763808707	PORSTIGODJVONM-UHFFFAOYSA-N	449.467	1.268	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(F)cc2OCC(F)F)cc1	763812151	QFTDWPANZMEDAM-UHFFFAOYSA-N	425.363	1.943	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cc(S(C)(=O)=O)ccc2Cl)cc1	763821512	RJORXXXMKPGNEE-UHFFFAOYSA-N	439.877	1.217	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccc(-c2n[nH]c(C3CC3)n2)cc1	763840427	LHJQSHXNDPIUSB-UHFFFAOYSA-N	438.419	1.653	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cc(NC(C)=O)ccc2C)cc1	763859674	DTTQXJCMKVIQAE-CQSZACIVSA-N	442.472	1.906	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1cccnc1N1CCCCC1	763867242	ZDVOHTUYVPSRLH-AWEZNQCLSA-N	429.452	1.764	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(-n3nccn3)cc2)cc1	763879588	YXSLGZWDFVZZQF-CQSZACIVSA-N	436.428	1.023	50	20	IDGD	
CCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)CCSc2ccc(F)cc2)cc1	763902604	OSOYOJHCTCKEBL-UHFFFAOYSA-N	432.477	1.844	50	20	IDGD	
O=C(NNC(=O)c1ccc(Br)s1)C(=O)Nc1ccn(Cc2ccccn2)n1	763940636	LUPODPFKBPZWOD-UHFFFAOYSA-N	449.290	1.550	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)Cc2ccsc2)cc(OC)c1Br	764034426	PBDJPRGGBHZSCK-UHFFFAOYSA-N	442.291	1.856	50	20	IDGD	
CC(C)Cn1ncc(NC(=O)C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c1C(C)C	764078008	QBXTZSQJLUDBKJ-UHFFFAOYSA-N	449.533	1.466	50	20	IDGD	
CC[C@H](C)C(=O)NNC(=O)C(=O)Nc1cc(NC(=O)CN2CCCC[C@H]2C)ccc1F	764084651	VNDKKYAXANYIDP-UONOGXRCSA-N	435.500	1.771	50	20	IDGD	
Cc1ccc(N2CCOC2=O)cc1NC(=O)C(=O)NNC(=O)c1ccc(Cl)cc1O	764124617	MHPFZXIEYHKSCY-UHFFFAOYSA-N	432.820	1.710	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2ccc(OC)c(OC)c2OC)cc1	764124931	OYYURLSCPLRFAO-UHFFFAOYSA-N	431.445	1.440	50	20	IDGD	
CN1CCC/C1=N/S(=O)(=O)c1cccc(NC(=O)C(=O)NNC(=O)CC2CCCC2)c1	764183187	DIRGAEZBGRYSCW-ULJHMMPZSA-N	449.533	1.166	50	20	IDGD	
CC(C)N(C)S(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)CCc2ccccc2)cc1	764185106	HBBOTBVEZHINTG-UHFFFAOYSA-N	446.529	1.434	50	20	IDGD	
CCOC(=O)c1cnn(-c2cccc(NC(=O)C(=O)NNC(=O)CC(C)(C)C)c2)c1C	764199902	ZKXDJJNGBIRJPB-UHFFFAOYSA-N	429.477	1.880	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)cc1NS(C)(=O)=O	764242554	HGQLQWXTTHWFHP-UHFFFAOYSA-N	443.485	1.107	50	20	IDGD	
CN(C)C(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cccc(OC(F)F)c2)ccc1F	764260445	YZUYSHMCTMMBED-UHFFFAOYSA-N	438.362	1.529	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)C(=O)Nc1ccc(OCC(F)F)cc1	764350752	KKJHAUJABMCODS-UHFFFAOYSA-N	429.383	1.916	50	20	IDGD	
C[S@](=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)cc1F	764387236	GWSLVDWAXMKRCH-HKBQPEDESA-N	447.423	1.492	50	20	IDGD	
CC(=NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C)c1ccc2c3c(cccc13)CC2	764812431	KTZMTYHMRLVVGR-UHFFFAOYSA-N	430.468	1.226	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cc(-c3ccc(C)c(C)c3)[nH]n2)ccc1OCC(N)=O	765560609	VUAZEZHABDXZMB-UHFFFAOYSA-N	437.456	1.641	50	20	IDGD	
CCc1ccc(C(=O)NNS(=O)(=O)c2ccc(NS(=O)(=O)CC)c(F)c2)cc1	765642913	QJDBFNQVEIIFRN-UHFFFAOYSA-N	429.495	1.773	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@@H](C)Oc3ccccc3F)CC2)cc1	765753952	GSMJSLNBYSRHCF-GOSISDBHSA-N	428.508	1.867	50	20	IDGD	
O=C(CCn1ccc2ccccc21)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	766644972	XWXPJIXNGJJUIW-UHFFFAOYSA-N	433.512	1.637	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)c1cc(S(=O)(=O)N(C)C)ccc1O	766967510	OPGXIZXBOYTBIT-NSHDSACASA-N	425.438	1.010	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(OC[C@@H]2CCOC2)c(F)c1)c1cccc([N+](=O)[O-])c1	767440517	UNOVASIRSZVWNE-GFCCVEGCSA-N	439.421	1.773	50	20	IDGD	
CCOc1cc(/C=C\C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)ccc1O	768624002	KMEVQRXKMMEZGG-QIBOZCLASA-N	442.424	1.335	50	20	IDGD	
CC(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)c1	770207195	DHEOWOQLAMDZAN-UHFFFAOYSA-N	438.531	1.237	50	20	IDGD	
CCOC(=O)c1cnn(-c2ccc(C(=O)NNc3nc(O)c4cnn(C)c4n3)cc2)c1C	770969871	UWALPQHCFLYXAO-UHFFFAOYSA-N	436.432	1.497	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)[C@H](C)NS(=O)(=O)c3cccs3)n[nH]2)cc1	771044658	IAFQIJDQXZDVIY-LBPRGKRZSA-N	447.542	1.829	50	20	IDGD	
COc1ccccc1[C@]1(C)NC(=O)N(CC(=O)NNC(=O)Nc2ccccc2C)C1=O	771251922	QXEAKXAQEMNELO-NRFANRHFSA-N	425.445	1.624	50	20	IDGD	
CCOC(=O)N1CC[C@@H](NC(=O)NNC(=O)c2cc(OC)ccc2Br)C1	771381088	QEARLAKOQPRIIT-SNVBAGLBSA-N	429.271	1.633	50	20	IDGD	
Cc1c(C(=O)NNc2ccc(Br)c(F)c2)cnc2c1c(=O)n(C)c(=O)n2C	771690270	CTTSOBGGTHJDAY-UHFFFAOYSA-N	436.241	1.599	50	20	IDGD	
CC(C)(C)OC(=O)CCCCNC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	773760767	NEWKEFOLZSNYDP-UHFFFAOYSA-N	428.511	1.938	50	20	IDGD	
Cc1cccc(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1Cl	775669084	FBTCOMBTEFTZQV-UHFFFAOYSA-N	431.923	1.522	50	20	IDGD	
COc1ccc(Cn2cc(C(=O)NNC(=O)Cc3nc4ccccc4n3C)cn2)cc1OC	778294899	VVUAPYFFUDREKL-UHFFFAOYSA-N	448.483	1.839	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)N1CCC(n2ccc(C(F)(F)F)n2)CC1	778640284	KGUWKOCKULQLBL-UHFFFAOYSA-N	444.439	1.771	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)Nc2cccc(N3CCN(C(C)=O)CC3)c2)cc1	782081133	FKKIKWUXQKFQKV-UHFFFAOYSA-N	441.488	1.595	50	20	IDGD	
CN(C)C(=O)CNC(=O)c1ccc(NC(=O)C(=O)NNc2ccccc2F)cc1Cl	782705316	BAVXZVQYWPWABY-UHFFFAOYSA-N	435.843	1.379	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNc2ccc(Cl)nn2)c(Br)cc1F	784790404	ZMXWZANZMGSBMZ-UHFFFAOYSA-N	446.620	1.900	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2cc(Cl)ccn2)cc1S(=O)(=O)NC1CC1	784860638	KHFHWKOXLAXMQY-UHFFFAOYSA-N	439.881	1.266	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ccnc(N(C)C)n2)cc1I	784969103	HYVJQVJFOOOGOF-UHFFFAOYSA-N	440.245	1.537	50	20	IDGD	
C[C@@H](CNC(=O)C(=O)Nc1ccccc1S[C@H](Cl)C(F)(F)F)S(N)(=O)=O	785300589	VPUVHFYUADEZAO-MADCSZMMSA-N	433.861	1.638	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cccc3ncccc23)cc1N1CCNC1=O	787543439	WIRPHKHQLNMBAK-UHFFFAOYSA-N	432.440	1.473	50	20	IDGD	
CC(C)Oc1cc(NC(=O)C(=O)NNc2ccc(Br)cn2)ccc1C(N)=O	789760750	HBCPDASYLPAQQG-UHFFFAOYSA-N	436.266	1.812	50	20	IDGD	
COc1c(C)cnc(Cn2cnc(NC(=O)C(=O)NNc3ccc(Cl)nc3)n2)c1C	789762813	UKQRKYAJMMHZLD-UHFFFAOYSA-N	430.856	1.477	50	20	IDGD	
O=C(NNC(=O)[C@H]1OCC[C@H]1c1ccccc1)C(=O)Nc1ccc(Br)nc1	789809959	IJOHAYBIWDNXKV-ZFWWWQNUSA-N	433.262	1.503	50	20	IDGD	
O=C(NNC(=O)[C@H]1OCC[C@H]1c1ccccc1)C(=O)Nc1ccccc1OCC(F)F	789810209	LATTYLCZTJKEPY-KSSFIOAISA-N	433.411	1.989	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)[C@@H]1CC(=O)N(c2ccccc2Br)C1	790062936	DEWIYLPEBVYEAN-GFCCVEGCSA-N	442.310	1.739	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)CN1C(=O)N[C@]2(C[C@@H](C)CC(C)(C)C2)C1=O	790064272	ZQAWZDWXBXOERL-RBZFPXEDSA-N	426.514	1.060	50	20	IDGD	
C[C@@H]1CN(S(=O)(=O)c2cccc(C(=O)NNc3nc4ccccn4n3)c2)C[C@@H](C)O1	791242545	REMUADBGFKOFKX-ZIAGYGMSSA-N	430.490	1.284	50	20	IDGD	
CNC(=O)c1cc2cc(NC(=O)NNC(=O)COc3ccccc3[N+](=O)[O-])ccc2[nH]1	791917022	PJNSSQVGAZWLTC-UHFFFAOYSA-N	426.389	1.667	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@@H]2CCN(Cc3ccccc3)C2)c1	792228861	GDRZJCIUTURHRR-KRWDZBQOSA-N	430.530	1.556	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)NCc2ccc(S(=O)(=O)N3CCC[C@H](C)C3)cc2)n1	792813205	WABGYMFXGBWCIG-HNNXBMFYSA-N	445.545	1.955	50	20	IDGD	
COc1c(NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)cc(Cl)cc1C(N)=O	793024160	BTRMMPVJDRIDHX-UHFFFAOYSA-N	443.847	1.188	50	20	IDGD	
COC(=O)c1cc(OC)c(OC)cc1NC(=O)C(=O)NNc1ccc2c(=O)[nH]ccc2c1	793066700	XMQYXKSQCIWJSS-UHFFFAOYSA-N	440.412	1.414	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1ncccc1Br	793594118	UWDGRAFNESFNHR-UHFFFAOYSA-N	441.307	1.622	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2cc3ccccc3c(=O)n2C)c2ccccc2c1=O	794774352	FKXBONPCUDLCRC-UHFFFAOYSA-N	431.452	1.733	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1C	797535917	RRJNBYVNQUVIHD-UHFFFAOYSA-N	425.199	1.546	50	20	IDGD	
COc1cccnc1CC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	798154444	JFDHKAVXDTXRQG-UHFFFAOYSA-N	446.510	1.956	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2S(=O)(=O)CCN(C)C)cc1C	798309294	JWLYYFIQXPXTCP-UHFFFAOYSA-N	446.529	1.038	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2cc3c(cc2N2CCCCC2)n(C)c(=O)n3C)ncn1	800629149	MPIXNLXCKRBXIJ-UHFFFAOYSA-N	438.492	1.048	50	20	IDGD	
C[C@H](Sc1ccccc1C(=O)OCC(=O)NNC(=O)c1ccc(C#N)cc1)C(N)=O	801486960	NTIHVVDQNXLXSM-LBPRGKRZSA-N	426.454	1.142	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)NC[C@H]2CCn3ncc(C(=O)NC(C)C)c3C2)cc(C#N)n1C	803412686	LJVRIQWNNGFAFN-PKXKBNNOSA-N	433.516	1.826	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NC[C@@H]1CCCS(=O)(=O)C1	804880757	NDJBTSZACYNMFD-RYUDHWBXSA-N	448.339	1.372	50	20	IDGD	
COc1ccc(CN2CC[C@@H](NC(=O)NNC(=O)c3ccccc3F)C2=O)c(OC)c1	805388839	LDEUDRZKEYKYKJ-QGZVFWFLSA-N	430.436	1.588	50	20	IDGD	
CCC(C)(C)[C@@H]1CCc2nc(NC(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)sc2C1	806753103	OQLVVSNAWZOGFW-GHMZBOCLSA-N	431.584	1.775	50	20	IDGD	
O=C(NNC(=O)c1cc(F)ccc1Br)C(=O)Nc1cccc2c1CNC2=O	806978804	KYKVEGJAOWNTCR-UHFFFAOYSA-N	435.209	1.231	50	20	IDGD	
O=C1COC[C@H](C[C@@H]2CN(C(=O)C(=O)NNc3c(F)cccc3Cl)c3ccccc32)N1	806983325	ODTVQAVQVPZDPP-OLZOCXBDSA-N	446.866	1.958	50	20	IDGD	
C[S@@](=O)Cc1ccc(CNC(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)cc1	807558209	UVWGQZWMVKQIQD-SSEXGKCCSA-N	431.522	1.992	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1cc(C)c(F)cc1C(=O)NCC(F)(F)F	810389249	CPJZWLNIUCMRHI-UHFFFAOYSA-N	444.345	1.307	50	20	IDGD	
CN(C)c1ncc(C=NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)n1C	811631162	MUBSCQAKDZXKRP-UHFFFAOYSA-N	429.488	1.952	50	20	IDGD	
Cn1cc(C=NNC(=O)c2cc(S(=O)(=O)NCc3ccccc3)ccc2O)c(O)n1	814216984	LUJOVRKULHKUFU-UHFFFAOYSA-N	429.458	1.074	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)cc2cccnc12	815566622	ZJQDSYQXEWOCEC-GFCCVEGCSA-N	426.404	1.936	50	20	IDGD	
CCn1c(S)nc2cc(C(=O)NNC(=O)CNc3cccc(OC)c3)ccc2c1=O	825802181	YRKSRJMPIRGVGT-UHFFFAOYSA-N	427.486	1.587	50	20	IDGD	
O=C(COC(=O)Cn1cccc(C(F)(F)F)c1=O)NNC(=O)c1cccc(Cl)c1	907468745	NFWIUCJBLGUITO-UHFFFAOYSA-N	431.754	1.525	50	20	IDGD	
Cc1ccc(NC(=O)CS[C@H](C)C(=O)NNC(=O)CCN2C[C@H](C)O[C@H](C)C2)cc1	912920149	WCVMZUDXSMTXMS-IXDOHACOSA-N	436.578	1.702	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cc(-c3cccc(F)c3)no2)cc1	915638351	KQHRYORAQGJZAB-UHFFFAOYSA-N	446.460	1.871	50	20	IDGD	
Cc1ccc(OCCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1	915890847	GVVUIENKKXSYNO-UHFFFAOYSA-N	446.529	1.803	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)NC[C@H](c2ccc(F)cc2)N2CCOCC2)c1	915898129	RVZOKFPJDNORTO-HXUWFJFHSA-N	446.479	1.860	50	20	IDGD	
CO[C@H](CNC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)c1ccccc1	916271014	BHLOFBOOOVIYKN-OAQYLSRUSA-N	425.533	1.917	50	20	IDGD	
COc1ccc(C=NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)c(OC)c1OC	916276830	PPHKHYNVGZPPOU-UHFFFAOYSA-N	435.502	1.792	50	20	IDGD	
CC(=NNC(=O)[C@H](C)CN1CCOCC1)c1ccc(S(=O)(=O)N2CCCCC2)cc1	916364532	OVWFELDIKWSFQW-QGZVFWFLSA-N	436.578	1.670	50	20	IDGD	
COc1cc(CNC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)ccc1O	916369997	XYXNJRNDIYPCPJ-UHFFFAOYSA-N	427.505	1.444	50	20	IDGD	
CCN1CCN(Cc2ccc(CNC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)cc2)CC1	916418630	OJKGSNAGVVTVLJ-UHFFFAOYSA-N	440.504	1.877	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])[nH]1)c1cccc(S(=O)(=O)NCc2ccccc2)c1	917906781	NEDHEHGFPCJDNA-UHFFFAOYSA-N	443.441	1.476	50	20	IDGD	
O=C(CCNS(=O)(=O)c1cccc([N+](=O)[O-])c1)NNC(=O)c1cc2c(s1)CCC2	920340774	SWRCWUPGHBUVAH-UHFFFAOYSA-N	438.487	1.275	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)NCc2ccc(C(=O)N3C[C@@H](C)O[C@H](C)C3)cc2)n1	920348681	KFQLXBBDYNQMPJ-IAGOWNOFSA-N	442.520	1.280	50	20	IDGD	
CC(C)NC(=O)CNC(=O)/C(C#N)=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	920850002	WTUUGVWOASOSGL-OQLLNIDSSA-N	442.907	1.627	50	20	IDGD	
CCCCn1c(C)cc(/C=C(\C#N)C(=O)NCCN2CCN(S(C)(=O)=O)CC2)c1C	921165058	DVIBRTSFJQGOQM-HMMYKYKNSA-N	435.594	1.505	50	20	IDGD	
C[C@H](OC[C@H]1CCCCO1)C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	921166735	NRIQDDCWIYLEKL-DOTOQJQBSA-N	439.534	1.206	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@@H]2CCCN2C(=O)/C=C/c2ccc(C(N)=O)cc2)cc1	1115888307	HFPCZAHKRCIHTJ-HBYKMFCXSA-N	436.468	1.260	50	20	IDGD	
O=C(NNC(=O)c1cncn1-c1ccccc1)N[C@@H]1CC(=O)N([C@@H]2C[C@H]2c2ccccc2)C1	1116176455	YUCFZDHFZXVIKF-YZGWKJHDSA-N	444.495	1.973	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccccc2)C1)c1n[nH]c2c1CCCC2	1317862285	CEJUCUOYDWCEBQ-CQSZACIVSA-N	431.518	1.150	50	20	IDGD	
Cc1noc(-c2ccc(C(=O)NNC(=O)CN3CCN(C(=O)c4ccccc4)CC3)cc2)n1	1322668869	DFBBUFNQJQIHNX-UHFFFAOYSA-N	448.483	1.264	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCN1CCOC1=O)C2	1779543870	CTPCWRCQAFOOFC-OXQOHEQNSA-N	441.601	1.194	50	20	IDGD	
Cc1nccn1CC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Br)C1	1780777392	ZOBJEYJPQIBNKN-UKPHBRMFSA-N	431.306	1.396	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(N4C(=O)C=CC4=O)cc3)CCO2)C1	1781224749	ZYGDXEGMBDPWCJ-VGOFRKELSA-N	445.903	1.577	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)CSc3ncccn3)CCO2)C1	1781227216	IKEHNDXZBKLSKX-DLBZAZTESA-N	433.361	1.635	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)COc1ccc(O)cc1)C2	1782166379	DRSPYEIAINAJGP-WAOWUJCRSA-N	440.924	1.539	50	20	IDGD	
Cc1cc(C)nc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CCC(=O)NN(C)C)C2)c1	1782212076	SBUXPIWYZXMBQU-AUSIDOKSSA-N	445.564	1.199	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@]1(C)CC=CCC1)C2	1782213948	BPOYPHJWUNUOFS-SXSPYAJSSA-N	434.581	1.620	50	20	IDGD	
C[C@H](C(=O)N1CC[C@@]2(CN(C(=O)C(Cl)Cl)CCO2)C1)[S@@](=O)c1ccccc1	1782685226	FQCFITJGFGPRMO-SXBFAZIISA-N	433.357	1.816	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(CCN(C(=O)[C@H](O)Cc3ccccc3)C2)C1	1783334658	UZKKSZJOHWPDOO-APWZRJJASA-N	425.323	1.205	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)CCc3cnn(C)c3)CCO2)C1	1783342801	OREOYWJIVPRZCT-QAPCUYQASA-N	427.343	1.356	50	20	IDGD	
CCC[C@H](NC(C)=O)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](Br)CC)C2)C1	1783351819	BHYZNOIAIVQWIG-VKJFTORMSA-N	432.359	1.295	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(CCN(C(=O)Cc3ccc4c(c3)CCO4)C2)C1	1783418536	YZLFNFMXEXJYRW-FQEVSTJZSA-N	437.334	1.779	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]3C2)cc1Cl	1784095467	IPONFMCRNDNJIW-HPZZRFSDSA-N	431.316	1.542	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(CCN(C(=O)CCc3cccc(O)c3)C2)C1	1784122694	BYVRAPWWQLWKLD-IBGZPJMESA-N	425.323	1.940	50	20	IDGD	
CCO/C=C/C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2	1784223308	ASZFFMSQEJGGAA-WZGQVBGCSA-N	445.944	1.499	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)/C=C/c3ccccc3[N+](=O)[O-])C2)C1	1785551360	UULKVMMGUVKDPU-ZSUOFZKHSA-N	437.880	1.692	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]2C1	1787449327	JKJQNOMDXWNABA-ARKGTOAJSA-N	447.935	1.900	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)c3cccc(F)n3)CCC2)cc1)c1ccc(B(O)O)cc1	1788142461	YJXQJJGLPAKNFP-UHFFFAOYSA-N	433.248	1.962	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3=NO[C@@H](c4ccccc4)C3)[C@H]2C1	1788143298	UVVVECIOTPBSOQ-OIGVQNGMSA-N	449.935	1.738	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)c1ccn2cncc2c1	1788408059	JPMJGEVVVPQZPJ-QCEMKRCNSA-N	439.285	1.618	50	20	IDGD	
CCCC(=O)N[C@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21	1788738592	DEECFENACRJDSF-QPSCCSFWSA-N	432.359	1.056	50	20	IDGD	
C[C@@H](Nc1ccccn1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21	1788781966	QGQUEOGVGBJIDL-BLDNINTCSA-N	443.317	1.552	50	20	IDGD	
O=C(/C=N/N1CCCCC1)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1	1789514939	UQLGZJVSCAIPEL-YZSQISJMSA-N	448.332	1.586	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCSC(=N)N)C[C@@H]21	1789866798	YLNLKAJIHHZXFT-YWDSYVAPSA-N	425.382	1.219	50	20	IDGD	
COc1cc(F)c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](O)CCl)C[C@@H]32)c(F)c1	1790102060	RQIRLHCZWGDHKH-LVLWZLKYSA-N	432.851	1.166	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1ccc(C2(NC(=O)[C@@H](O)c3ccco3)CCC2)cc1	1791596206	YRMDXBKSRZGANN-FQEVSTJZSA-N	428.489	1.820	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c(c1)OCO3)C2	1792868207	RFLGSKAFMLPEBG-DPYKFYPSSA-N	439.306	1.650	50	20	IDGD	
CO[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)CBr)c1ccccc1	1792868513	ZQGREFVPJZKRFP-XEIOYGOASA-N	439.350	1.995	50	20	IDGD	
CCc1cnc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)CBr)s1	1792870962	NOGDDDMMKZCDSP-FMSGJZPZSA-N	430.368	1.940	50	20	IDGD	
CCOc1ccsc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1	1796185850	WWPCOICQLCZFEK-BJWYYQGGSA-N	428.319	1.392	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccn2cncc12	1797522976	NQCOWSALOKOUFM-AODNKKSCSA-N	425.316	1.774	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc2c(c1)CCCC2=O)c1cccc(B(O)O)c1	1797549003	YTFUNJYCXMBZNW-WKCHPHFGSA-N	446.312	1.451	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2)c1[nH]cnc1-c1cccnc1	1798492458	JEYNVWXJYWRSMK-MIFYACCESA-N	448.321	1.460	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2)[C@@H]1CC(c2ccccc2)=NN1	1800153936	VNFQINLJFNRPJY-HIRMHNASSA-N	449.349	1.127	50	20	IDGD	
C[C@H](Oc1ccccc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Br)C2	1800624994	XRISSRSVKLMCSO-LBKYZSNHSA-N	425.323	1.827	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nc3ccccn3n1)C2	1800639496	GFSFWOFRTGHSQI-XFMPKHEZSA-N	436.310	1.106	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](NC(C)C)C(C)C)C2	1800640159	WWHGUULTOYYYQI-QEOTZNIISA-N	432.403	1.772	50	20	IDGD	
Cc1cc(F)c(F)c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)c1	1800776913	SOMPHOMZEXKTOD-BTTYYORXSA-N	443.454	1.837	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(-c3ccccc3)no1)C2	1800976687	CEGUEZPUWSKAGU-RCJHGTSTSA-N	433.892	1.799	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/c1cc(F)c(F)c(F)c1)C2	1800982163	XWCXQEIOOKABJZ-WBXNVRACSA-N	446.853	1.961	50	20	IDGD	
CC[C@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](C)[C@@H]1SC(=N)NC1=O)C2	1801801981	QIRPFGXSZGZVJC-QPHKQPEJSA-N	445.383	1.601	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2noc3c2CCCC3)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803139784	VUWPMUMAOWDVBM-URLQWDBASA-N	432.908	1.868	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)C(C)(C)CNC(C)=O)[C@@H]1c1cccnc1	1803720279	MMGPEZPHCBCEBC-BZSNNMDCSA-N	438.956	1.504	50	20	IDGD	
C[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC2(CCN(C(=O)[C@@H](O)CCl)CC2)C1	1805222247	GMSWJKRMLQQWJB-GJZGRUSLSA-N	431.961	1.731	50	20	IDGD	
Cn1c(=O)n(CC(=O)N2CCC3(CCCN(C(=O)[C@H](O)CCl)C3)CC2)c2ccccc21	1805524241	MQNBWLXQDNROSB-GOSISDBHSA-N	448.951	1.171	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)C2=CCCC2)[C@H]1c1cccnc1	1806212091	BOZNIVCCCWJJIP-YLJYHZDGSA-N	434.500	1.510	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)N1CC[C@@H](CNC(=O)CCBr)[C@@H]1c1cccnc1	1806340671	JJOHRXDZJUDKIW-SKDZVZGDSA-N	439.354	1.739	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)c(C)o1	1807365052	WMEVQANMRGFLHS-SIKLNZKXSA-N	447.300	1.605	50	20	IDGD	
O=C(c1cncn1-c1ccncc1)N1CCCC2(CCN(C(=O)[C@H](O)CCl)CC2)C1	1807747878	DNOVDADXPBKOKR-GOSISDBHSA-N	431.924	1.712	50	20	IDGD	
Cc1nc(C)c(C(=O)N2CCCC3(CCN(C(=O)c4cccc(B(O)O)c4)CC3)C2)s1	1808231507	ABPFKCGZCVWOLJ-UHFFFAOYSA-N	441.362	1.598	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)c1ccn2nccc2c1	1810045606	TZJYZBCFGYDZNQ-WDSOQIARSA-N	427.892	1.649	50	20	IDGD	
C=C1CC(C(=O)N2CC[C@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)C1	1810295682	VFCYOHMMECWCBP-OXQOHEQNSA-N	434.500	1.366	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2cnn3ncccc23)[C@H]1c1cccnc1	1813031205	PDBPFBAMJPPGKP-IEZWGBDMSA-N	442.907	1.698	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2ccc(C(N)=O)cc2)[C@H]1c1cccnc1	1813033962	XVPQUDAFJPASFK-QYZOEREBSA-N	444.919	1.754	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)CCc2ccco2)[C@H]1c1cccnc1	1813070342	HYXYZWAEJJLTQG-JPYJTQIMSA-N	441.532	1.686	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](O)CCl)n[nH]1	1814871231	LFYGNVTVMFJYQV-VXWPIWARSA-N	449.899	1.136	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(=O)n4[nH]cnc4n3)sc2C1	1815323160	AUGXMKQSJPDZLO-NXEZZACHSA-N	449.924	1.507	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)CCCn2cccc2)[nH]n1)c1ccc(B(O)O)cc1	1817475268	NACKWLIXQZQUNZ-FQEVSTJZSA-N	449.320	1.677	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CS(=O)(=O)N2CCCC2)n[nH]1	1818108976	HVUPDICOEYUPJS-HIFRSBDPSA-N	445.973	1.845	50	20	IDGD	
CC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)n[nH]1	1818111382	HQEQGXWTUUGBQK-ZZQPOVDQSA-N	441.492	1.905	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCCC[C@H]1c1cc(NC(=O)C2=NNC(=O)C2)n[nH]1	1819344462	WSXKYELHYAUNRM-SKDRFNHKSA-N	425.287	1.451	50	20	IDGD	
COc1ccc(C(=O)N[C@@H]2CCc3nc(NC(=O)[C@H](F)Br)sc3C2)nn1	1823006490	GIJVZJSXINWBAD-KRTXAFLBSA-N	444.286	1.858	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](O)CCl)CC2)c1ccnc2ncccc12	1824087107	WHBBMXXVNBNHJF-HZMBPMFUSA-N	431.905	1.912	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)cnc1C	1825391657	ZNOMDYLEHCWNFO-QHCPKHFHSA-N	449.360	1.925	50	20	IDGD	
CC[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCNC(C)=O)CC2	1825452147	XWSMOQSGWPAVAP-WDEREUQCSA-N	431.356	1.755	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(O)nn1)CC2	1825637397	ZDYDGJIJDCWCQK-JGVFFNPUSA-N	426.296	1.648	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](C)N1C[C@H]3C[C@@H]3C1)CC2	1826000270	QHADCDKHQQGOII-MRTXSQPYSA-N	426.970	1.649	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(OC)nn1)CC2	1826003788	SUXXGAWTSKZGGE-VHSXEESVSA-N	425.898	1.421	50	20	IDGD	
O=C(c1cccs1)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827055672	BYASBRBNCFCLDD-LJQANCHMSA-N	426.347	1.975	50	20	IDGD	
Cc1ncccc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827056049	ONJPEOKHACDSKX-QFIPXVFZSA-N	435.333	1.617	50	20	IDGD	
Cc1ccnc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)c1	1827757341	GYVUWINQOLVPOZ-QFIPXVFZSA-N	435.333	1.617	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccon2)CC1	1828925993	WIMQWDDWADDJCO-SFHVURJKSA-N	426.477	1.220	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(O)nc2)CC1	1829724925	BSYPXMJDAFAXNN-GOSISDBHSA-N	431.537	1.394	50	20	IDGD	
C[C@@H]1C[C@@]1(C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1	1830218845	HOWVJTTUOGOVJB-BIFSNJIPSA-N	427.549	1.965	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3c(F)cncc3F)C2)C1	1830365315	WMYHIMUCKBJGTB-IBGZPJMESA-N	431.867	1.695	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)ccn1	1830539146	CMRBHGUSAJRBLU-LIRRHRJNSA-N	440.338	1.491	50	20	IDGD	
O=C(Cc1cc(F)ccc1Cl)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1830726578	QXMNIAJGPRPGDL-APWZRJJASA-N	449.306	1.078	50	20	IDGD	
Cc1ccc(CCC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)cc1F	1830726900	VVDLNUZGCSWONI-NQIIRXRSSA-N	442.915	1.123	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1sccc1F)CCO2	1831918858	XLTOSHBCYIRXNC-GOSISDBHSA-N	430.574	1.809	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2CCCS2)CC1	1832433909	LYABZFSCYQODAU-PMACEKPBSA-N	430.379	1.495	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(CN(C(=O)CCc3ccccn3)CCO2)C1	1833187858	ZMWADPWOGIPBMU-NRFANRHFSA-N	435.597	1.322	50	20	IDGD	
O=C(c1cnc(-c2ccccn2)nc1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1833292184	WURYRDPGRQGMPG-UZLBHIALSA-N	449.870	1.143	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cscn3)CCO2)C1	1834252508	GXYYGRHBHMVWQI-LRDDRELGSA-N	432.340	1.244	50	20	IDGD	
C=C[C@H](O)C(C)(C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1	1837400872	QGKPLMBSBRSMSR-ZOCIIQOWSA-N	437.364	1.252	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3[C@H]4SC=C[C@H]43)C2)C1	1837715795	JUKVOPLRBOMWAC-LKCYJCQHSA-N	426.611	1.169	50	20	IDGD	
C[C@]1(C(=O)N2CCC(OC3CCN(C(=O)[C@@H](F)Br)CC3)CC2)CCCN1	1838632439	XQLLIOAWSRVESP-CRAIPNDOSA-N	434.350	1.818	50	20	IDGD	
O=C([C@H]1[C@H]2SC=C[C@H]21)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1839699898	XJMRWGHEHXGKOU-CGOYYEKTSA-N	435.315	1.008	50	20	IDGD	
C=C[C@H](O)C(C)(C)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H](Br)CC)CCO2)C1	1839965003	KNPAKIMNHISJEI-YZVOILCLSA-N	447.370	1.189	50	20	IDGD	
Cc1ccsc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)Br)CCO2	1840031664	YXXCRFBUROJJPF-SUMWQHHRSA-N	431.352	1.910	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(F)cc3C)C2)C1	1840156913	XXQJGGONHXQUNG-YLJYHZDGSA-N	428.888	1.458	50	20	IDGD	
O=C([C@H](F)Cl)N1CCOC[C@@]2(C1)CN(C(=O)C1(c3ccccc3F)CC1)CCO2	1840858663	LEWKCYQJCDXGDD-QFBILLFUSA-N	428.863	1.848	50	20	IDGD	
CCOC(=O)N(CC(=O)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1)Cc1ccco1	1841354195	MHXIJFGCRWZGHL-OAHLLOKOSA-N	427.885	1.041	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)CCN2C(=O)c3ccccc3C2=O)C1	1841911355	YMXVIOUVZXUBQW-MRXNPFEDSA-N	433.892	1.130	50	20	IDGD	
Cc1cc(C(=O)N2CC3(CCCN3C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)n[nH]1	1841924578	CNJSMPRYAGOEPA-AWEZNQCLSA-N	425.917	1.667	50	20	IDGD	
CC(C)Oc1ccc(C(=O)N2CC3(CCCN3C(=O)c3ccc(B(O)O)cc3)C2)c(F)c1	1843012194	NCFSOOQYUBETKN-UHFFFAOYSA-N	440.280	1.424	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H]1CCC(=O)N1CCCC12CN(C(=O)[C@H](O)CCl)C2	1843949333	PCKZLIOHBHBNSC-JKSUJKDBSA-N	443.972	1.969	50	20	IDGD	
C[C@H](Sc1ccccc1)C(=O)N1CC2(CCCN2C(=O)c2cnccc2C(=O)NN)C1	1844263458	HGBJLUHHOJBAMR-HNNXBMFYSA-N	439.541	1.683	50	20	IDGD	
O=C(CCn1cncn1)N1CC2(CCCN2C(=O)[C@@H](Br)Cc2ccccc2)C1	1845942684	UHNVUCQRECBDPI-KRWDZBQOSA-N	446.349	1.878	50	20	IDGD	
COC(=O)N[C@@H](C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](F)Br)c1ccccc1	1847451505	XSVAGKZLLGXMRM-XQLPTFJDSA-N	442.285	1.976	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC[C@H]2[C@@H]1CCN2C(=O)C1CCN(c2ccccc2)CC1	1847525402	HUHFYSVERPYTPZ-GOTSBHOMSA-N	447.344	1.098	50	20	IDGD	
CC(C)CNC(=O)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1848100083	MMTJFTIGFQKAIM-KKUMJFAQSA-N	444.960	1.093	50	20	IDGD	
C[C@H]1CN(C(C)(C)CNC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)C[C@@H](C)O1	9732200	MASAZAQSYIRONU-GASCZTMLSA-N	430.509	1.410	50	20	IDGD	
CC(C)NS(=O)(=O)Cc1ccccc1CNC(=O)NNC(=O)Cc1ccc(F)cc1	10409042	UYAJOOSKIZSDEJ-UHFFFAOYSA-N	436.509	1.727	50	20	IDGD	
CSc1ccc([N+](=O)[O-])c(C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)c1	16203024	SMVZJVGNHUFMPM-UHFFFAOYSA-N	437.503	1.993	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)cc1	17407011	GHRSVRAUYVMCJP-UHFFFAOYSA-N	427.486	1.467	50	20	IDGD	
O=C(CNc1ccccc1)NNC(=S)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1	18920274	VWSWUXXVHSADJH-UHFFFAOYSA-N	449.558	1.137	50	20	IDGD	
Cc1nn(C)c2ncc(C(=O)NNC(=O)c3cccc(S(=O)(=O)N4CCCC4)c3)cc12	23735458	JGMNVARNOAVKOL-UHFFFAOYSA-N	442.501	1.136	50	20	IDGD	
C[C@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)C1=O	23743046	CUVVOSKUVJQKGA-KNBCDEMBSA-N	442.491	1.957	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)CN2C(=O)N[C@@](C)(c3ccc(F)cc3)C2=O)cc1	105569174	TVMYQRPEOIHEFD-NRFANRHFSA-N	427.436	1.161	50	20	IDGD	
CN(C)C(=O)Cn1ccc(NC(=O)CCC(=O)C(C#N)=C2N(C)c3ccccc3N2C)n1	725755208	NPCFLICCOBDTDQ-UHFFFAOYSA-N	435.488	1.580	50	20	IDGD	
O=C(NNC(=O)C(=O)N1CCCC1)NC1CCN(Cc2coc(-c3ccccc3)n2)CC1	726275284	LCXLOTPXMDHLBT-UHFFFAOYSA-N	440.504	1.259	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)NCc2ccc([C@@]3(C)NC(=O)NC3=O)cc2)cc1	726278272	DNYLPNGIEAOTIR-JOCHJYFZSA-N	439.472	1.213	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)N[C@H](c1ccccc1)[C@@H]1CCCO1	726711879	KTKZFVGGLBZJDD-DLBZAZTESA-N	431.518	1.844	50	20	IDGD	
CC[C@@H](OC(=O)/C(C#N)=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(N)=O	726988333	OQDNNBIODSCCIL-RCBBPTIPSA-N	429.864	1.793	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)c2ccc(CCNS(C)(=O)=O)cc2)cc1F	727498498	BSPUKZXPFKVDAH-UHFFFAOYSA-N	440.522	1.557	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNS(=O)(=O)c1ccc(OCC)c(C(=O)O)c1	727720394	LTGYKIBXTPOIDK-UHFFFAOYSA-N	438.458	1.571	50	20	IDGD	
O=C(COC(=O)c1cnc(-c2ccccn2)s1)NNC(=O)[C@H]1COc2ccccc2O1	728342020	DUYVWZCVEQRJKY-OAHLLOKOSA-N	440.437	1.349	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@H]2CCc3ccc(F)cc32)cc1	730132690	XGVKGAYSNQUFOJ-SFHVURJKSA-N	434.493	1.773	50	20	IDGD	
CCOc1cccc(N2CCN(C(=O)NNC(=O)c3cc(Br)c[nH]3)CC2)n1	730273759	WRWZDRXXVLPEMJ-UHFFFAOYSA-N	437.298	1.748	50	20	IDGD	
COC[C@@H](C)n1c(C)cc(/C=C(/C#N)C(=O)NCCC(=O)N2CCN(C(C)=O)CC2)c1C	730783432	NVXNIGBASAZERL-OJSPLJLUSA-N	443.548	1.416	50	20	IDGD	
CC(C)(C(=O)NNC(=O)c1cccc(S(=O)(=O)NC[C@@H]2CCCO2)c1)c1ccccc1	731231397	NQKWJKLPOJWYMR-SFHVURJKSA-N	445.541	1.883	50	20	IDGD	
Cc1cccc(-n2c(C)cc(/C=C(\C#N)C(=O)N3CCN(S(N)(=O)=O)CC3)c2C)c1	732067829	IBPSSKDOEHBDOT-CPNJWEJPSA-N	427.530	1.657	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)NCc2ccc(C(=O)NNC(=O)C3CCC3)cc2)cc1	732142883	LRPPSQYXZDNWQB-UHFFFAOYSA-N	429.498	1.929	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)NCc1ccc(N(C)S(C)(=O)=O)cc1	732236153	QYEGOZGEVQBQSD-UHFFFAOYSA-N	436.490	1.000	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NC[C@@H](O)c1ccc(Cl)cc1Cl	732244475	GXBWAGAYAXPYKH-GFCCVEGCSA-N	431.301	1.849	50	20	IDGD	
Cc1cc(S(=O)(=O)NNC(=O)c2cnn(-c3ccccc3)c2)ccc1OCC(=O)O	733123184	WPBSFPACVCFZEX-UHFFFAOYSA-N	430.442	1.267	50	20	IDGD	
CC(C)n1c(C(F)(F)F)nc2cc(C(=O)NNC(=O)N[C@H]3CCS(=O)(=O)C3)ccc21	734427883	FJWYQCPKIJYLMD-NSHDSACASA-N	447.439	1.767	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)[C@H]1CCCN(C(=O)c2ccc3n[nH]cc3c2)C1	737926408	GTNCKIDNLWDNJQ-SFHVURJKSA-N	435.484	1.779	50	20	IDGD	
COc1ccc(-c2nn(CCC#N)cc2/C=C(\C#N)C(=O)N[C@H]2CCN(C)C2=O)cc1OC	737992582	GOKXJYZFNLLDLP-FYXHJSOBSA-N	448.483	1.735	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)CNC(=O)c1cccs1)[C@@H]1CN(Cc2ccccc2)CCO1	741273158	GGVPNTOCSHQUDU-WBVHZDCISA-N	445.545	1.098	50	20	IDGD	
O=C(COC(=O)[C@H]1CN(Cc2ccccc2)CCO1)NNC(=O)c1cccc(Cl)c1	741382950	KFCHJHUYJALBMX-GOSISDBHSA-N	431.876	1.545	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)Nc2ncn(CC(=O)N(C)C)n2)c(C)n1C[C@H]1CCCO1	741971891	XDKQDCASEMIKKQ-ZTXRYZOMSA-N	425.493	1.509	50	20	IDGD	
CC(=O)N[C@H](Cc1c[nH]c2ccc(Br)cc12)C(=O)NNC(=O)c1ccccn1	742031172	BRGCYNFJJOVUAZ-QGZVFWFLSA-N	444.289	1.834	50	20	IDGD	
O=C(CCN1CCN(C(c2ccccc2)c2ccccc2)CC1)NNC(=O)Cc1cc[nH]n1	743286480	ZEWPZTHGWJUOTP-UHFFFAOYSA-N	446.555	1.897	50	20	IDGD	
O=C(NNC(=O)N1CCC(C(=O)N2CCOCC2)CC1)c1cccc(Br)c1	743685852	GSAILGGSJDLKEY-UHFFFAOYSA-N	439.310	1.374	50	20	IDGD	
COc1ccc(C(=O)NCC(=O)NNC(=O)c2cccc(Br)c2)cc1OC	743728749	WBJHNRSITOFLJH-UHFFFAOYSA-N	436.262	1.657	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)CCc2nnc(-c3ccccc3)o2)cc1	743829433	PUDSDGGTOPVHOS-UHFFFAOYSA-N	429.458	1.926	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)c1	743855994	PMOPIOXHVZYHEN-KRWDZBQOSA-N	433.505	1.902	50	20	IDGD	
CCCN(C(=O)[C@H](C)OC(=O)/C(C#N)=C\c1cccc(OC)c1)[C@H]1CCS(=O)(=O)C1	744568928	XZNPCENFVIUGIQ-ALTBLPFJSA-N	434.514	1.960	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1cnc(-c2ncccn2)s1	744621585	UNHZQHYEQLOGLQ-UHFFFAOYSA-N	446.514	1.378	50	20	IDGD	
C[C@H](CN1CCN(c2ccccc2)CC1)NC(=O)NNC(=O)COc1ccc(F)cc1	745840415	WHARNCONXRPPBU-QGZVFWFLSA-N	429.496	1.746	50	20	IDGD	
Cc1cc(=O)c(C(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)c[nH]1	746103135	LBPQKTXLSRUOBS-UHFFFAOYSA-N	432.483	1.620	50	20	IDGD	
O=C(CSc1nnc(NCC(F)(F)F)s1)NNC(=O)c1cccc([N+](=O)[O-])c1	747062830	RRSDCVYDKBQOIG-UHFFFAOYSA-N	436.397	1.974	50	20	IDGD	
C[C@]1(c2ccc(CNC(=O)NNC(=O)c3ccc(Cl)cc3F)cc2)NC(=O)NC1=O	747585764	KAUYEIXSXGPMEU-LJQANCHMSA-N	433.827	1.678	50	20	IDGD	
O=C(NCCCN1CCN(c2ccncc2)CC1)NNC(=O)c1ccc2c(c1)OCCO2	748343466	IMNIBGKXJPTSCC-UHFFFAOYSA-N	440.504	1.009	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)NCCC(=O)N1CCCCCC1	748463166	LIFCMUXVKBEQDY-UHFFFAOYSA-N	444.580	1.322	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)NCCC(=O)N2CCN(c3ccccc3)CC2)c2ccccc21	748466300	YCCRUVOVSALCFN-UHFFFAOYSA-N	448.527	1.861	50	20	IDGD	
C[C@@H](Sc1nnnn1C1CC1)C(=O)NNc1ccccc1S(=O)(=O)NC(C)(C)C	748593372	IFWHRCWEROHNSH-LLVKDONJSA-N	439.567	1.709	50	20	IDGD	
Cc1nnnn1[C@@H](Cc1ccccc1)C(=O)NNc1ccc(S(=O)(=O)C(F)F)cc1	748610063	AJSLRBGXLBAMTK-INIZCTEOSA-N	436.444	1.905	50	20	IDGD	
Cc1nn(C)c(C)c1S(=O)(=O)N[C@@H](C)C(=O)NNc1ccc(OCC(F)(F)F)cc1	748693572	CJXVFQPPCCMZBZ-NSHDSACASA-N	449.455	1.788	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)N[C@@H]1CCN(CCCc2ccccc2)C1=O	750660507	NFJMGESMSPMOOI-GOSISDBHSA-N	425.445	1.773	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2C[C@@H](CNC(=O)OC(C)(C)C)C[C@@H]2C)n1	752069512	PHTBOACFSQSSGJ-UONOGXRCSA-N	425.555	1.377	50	20	IDGD	
CC[C@H](CS(=O)(=O)c1ccccc1)NC(=O)NNC(=O)C(=O)Nc1ccc(C)c(C)c1	752703312	HOXVXYVQWPQYCO-MRXNPFEDSA-N	446.529	1.825	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)c1cc(S(=O)(=O)N(C)C)c(C)o1	753564292	DQTALSKFGXKVPO-UHFFFAOYSA-N	433.490	1.212	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)Nc2ccccc2C)c(C)c([N+](=O)[O-])c1	753853048	PCEQYSPUUGLYQR-UHFFFAOYSA-N	429.389	1.790	50	20	IDGD	
CC(C)C[C@H](C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)N1CCCCC1=O	755066957	YTOSBDKXYBCBIB-OAQYLSRUSA-N	443.592	1.773	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@@H](C(=O)NNC(=O)Cc3cc[nH]n3)C2)c2ccccc12	755284049	JFMYSFLSWYCTSP-OAHLLOKOSA-N	435.484	1.814	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2cc(C)nn2[C@H]2CCS(=O)(=O)C2)cc1OC	755530943	IDYFJITUJRELEV-ZDUSSCGKSA-N	437.478	1.035	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccc(-n3cccn3)cc2)c1	755608271	DRZULZUIRLSQBE-UHFFFAOYSA-N	428.474	1.589	50	20	IDGD	
COc1ccc(C(=O)NN=Cc2cc(OC)c(OCC(=O)O)cc2[N+](=O)[O-])c(OC)c1	755700871	VNYVLFIYHCRCCC-UHFFFAOYSA-N	433.373	1.848	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)N2CCN([C@H](C)C(=O)N3CCCC3)CC2)c1C	755727850	KYRUXUHKGKLQFW-SUNMQZQPSA-N	441.576	1.813	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)Nc2cc(N3CCCS3(=O)=O)ccc2F)cc1	756155695	VIEWDKZDIPDRFE-UHFFFAOYSA-N	436.465	1.906	50	20	IDGD	
CNC(=O)Cn1ccc2ccc(NC(=O)NNC(=O)c3ccc(OC)c(OC)c3)cc21	756760845	KGHMNSUNNUVIPU-UHFFFAOYSA-N	425.445	1.871	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2ccc(S(=O)(=O)NC3CC3)cc2)cc1OC	756777542	ZAKYWJRUZOAFIO-UHFFFAOYSA-N	434.474	1.611	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)[C@@](C)(O)CN1Cc2ccccc2C1=O	756795416	ALOYMBMERHNAMF-QHCPKHFHSA-N	435.484	1.153	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)N[C@H]2CCN(c3ccccc3OC)C2=O)cc1	757286699	OBTOBTAANBBWGI-INIZCTEOSA-N	428.445	1.219	50	20	IDGD	
CC(=O)N1CC[C@H](NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c2ccccc21	757797541	GBTFQVKDNNUJFR-KRWDZBQOSA-N	430.486	1.532	50	20	IDGD	
COc1ccc([C@@]2(C)NC(=O)N(CC(=O)NNc3nc(O)c4ccccc4n3)C2=O)cc1	758298259	CWZQNAHPJYYTCX-OAQYLSRUSA-N	436.428	1.254	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)C(=O)Nc1ccccn1)c1cc(F)ccc1N1CCN(C)CC1	758744840	CCYMCAKCTPMTPI-AWEZNQCLSA-N	443.483	1.003	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H](C#N)[C@H](NC(=O)NNC(=O)c2cccc(OC(F)F)c2)C1	758774862	VHGSLOJEVJHPOZ-GXTWGEPZSA-N	439.419	1.991	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	761794284	HOLBDCFRORMUPZ-INIZCTEOSA-N	441.444	1.495	50	20	IDGD	
COC[C@@H](C)n1c(C)cc(/C=C(/C#N)C(=O)NNc2nccc(N3CCOCC3)n2)c1C	762852067	QTDSVOIFVYYXPL-BKAYVGFPSA-N	439.520	1.989	50	20	IDGD	
CSCC[C@@H](NC(=O)c1ccccc1)C(=O)NNc1nccc(N2CCOCC2)n1	762855432	NWQRVQJRESPUAV-MRXNPFEDSA-N	430.534	1.308	50	20	IDGD	
COc1ccc(Cn2nccc2NC(=O)C(=O)NNC(=O)c2ccccc2O)c(OC)c1	763527821	LEJMBAXHDGQQSM-UHFFFAOYSA-N	439.428	1.054	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cc(F)cc(Cl)c2)cc(OC)c1OC	763540393	UMEWZBPEFCOVLX-UHFFFAOYSA-N	425.800	1.905	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(OCC(F)(F)C(F)F)nc2)c(C)o1	763587096	UBYTWRHLMLDMKL-UHFFFAOYSA-N	432.330	1.970	50	20	IDGD	
COc1c(NC(=O)C(=O)NNC(=O)CC23CC4CC(CC(C4)C2)C3)cccc1C(N)=O	763731372	AJWWQXSLZVNKLD-UHFFFAOYSA-N	428.489	1.487	50	20	IDGD	
COc1ccc(Cn2nccc2NC(=O)C(=O)NNC(=O)C2=S=C3CCCC3=C2)cc1	763784000	SLTBQANPKQWCEG-UHFFFAOYSA-N	439.497	1.228	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1C(F)(F)F	763789784	CXWRMYCCOHSYEO-UHFFFAOYSA-N	447.373	1.660	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)C(=O)Nc1ccccc1OCC(F)F	763804926	XQPMYKSASLBCKY-UHFFFAOYSA-N	438.343	1.404	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(C(N)=O)c(Cl)c2)cc1	763867190	SNWHCROLPLRDJY-NSHDSACASA-N	448.863	1.391	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(C(F)(F)F)nc2)cc1	763876499	FRTZBEOYVNDMDJ-LLVKDONJSA-N	438.362	1.856	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)CCO2	763882516	JPLMSRKAYDKYQC-LLVKDONJSA-N	448.273	1.937	50	20	IDGD	
CC(C)n1cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(Br)c2)cn1	763882860	MFAQQKZARIEPQO-NSHDSACASA-N	438.282	1.780	50	20	IDGD	
COc1ccc(NC(=O)c2cccc(NC(=O)C(=O)NNC(=O)C3CCCC3)c2)cn1	764068699	PVMBVITZMGFCON-UHFFFAOYSA-N	425.445	1.619	50	20	IDGD	
Cc1ccc(C(=O)NCC(F)(F)F)cc1NC(=O)C(=O)NNC(=O)CC(F)(F)F	764112301	JMEIXEKZGLGUGU-UHFFFAOYSA-N	428.289	1.325	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(Cl)c(C(=O)NC3CC3)c2)c1	764237042	ICWLZTZWCSHLDR-UHFFFAOYSA-N	425.832	1.504	50	20	IDGD	
N#Cc1cccc(COc2cccc(NC(=O)C(=O)NNC(=O)Cc3cccnc3)c2)c1	764265659	DPQSJBVXDZLONV-UHFFFAOYSA-N	429.436	1.861	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)C(=O)Nc1cccc(NC(=O)[C@@H](C)OC)c1)c1ccccc1	764327845	GHVMSIAXHDMOIW-RDTXWAMCSA-N	426.473	1.940	50	20	IDGD	
Cc1cc(S(C)(=O)=O)ccc1NC(=O)C(=O)NNC(=O)c1ccc(O)c(Cl)c1	764350134	YPRWLDZUVXSKOT-UHFFFAOYSA-N	425.850	1.157	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2cc(F)c(OC)c(F)c2)n[nH]1	764379268	UNMZXDJNYQVJGL-UHFFFAOYSA-N	445.382	1.772	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc4nc(C)cn4c3)n[nH]2)cc1	764385373	ZOPICLLCWZHDTE-UHFFFAOYSA-N	431.456	1.995	50	20	IDGD	
COC(=O)CCSCc1cccc(NC(=O)C(=O)NNC(=O)c2ncccc2C)c1	764389789	ZMLIWYYFWWQLDK-UHFFFAOYSA-N	430.486	1.586	50	20	IDGD	
CCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)CSc2ccccc2OC)c(C)c1	764398101	OHUYUQNLJWDCJY-UHFFFAOYSA-N	444.513	1.632	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NNC(=O)Cn2nnc(-c3ccccc3)n2)C1	767950717	ZKCNEFWZTXEABR-OAHLLOKOSA-N	429.481	1.135	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)ccc1OC(C)C	768237539	MJRLKDHICLKQIJ-UHFFFAOYSA-N	426.429	1.519	50	20	IDGD	
COc1cc2c(cc1NC(=O)C(=O)NNC(=O)COc1ccc(C)cc1)NC(=O)CC2	768238693	SPLQSIUXKRYXHC-UHFFFAOYSA-N	426.429	1.053	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cccn2C)n(-c2ccc(C(F)(F)F)cn2)n1	768240085	RPCZNIPLNQCARN-UHFFFAOYSA-N	435.366	1.333	50	20	IDGD	
COc1ccc(NNC(=O)c2ccc(S(=O)(=O)N3CCOCC3)cc2)c([N+](=O)[O-])c1	768335057	DLHJOVKIEJRSLV-UHFFFAOYSA-N	436.446	1.381	50	20	IDGD	
CC(=O)N1CCc2c(NC(=O)C(=O)NNC(=O)CSc3ccc(C)cc3)cccc21	769268432	ZYZYUCZGNXXEDE-UHFFFAOYSA-N	426.498	1.782	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)c1cc(NC(=O)OCC(F)(F)F)ccc1O	769913088	ZGIFFIUDFNPRTJ-UHFFFAOYSA-N	434.371	1.569	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)c1cnc2c(c1)NC(=O)CO2	770586475	GRPHVVYYMKGGNB-SECBINFHSA-N	435.234	1.404	50	20	IDGD	
C[C@H]1CN(c2ccnc(C(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)c2)C[C@H](C)O1	770829989	GIXTYVPQKCOQRV-KBPBESRZSA-N	432.502	1.174	50	20	IDGD	
O=C(NNc1ccc(Br)c(F)c1)N[C@H]1CCO[C@@]2(CCS(=O)(=O)C2)C1	771342542	PSQKTEGSWBVNFU-NHYWBVRUSA-N	436.303	1.951	50	20	IDGD	
COc1ccc([C@]2(C)NC(=O)N(CC(=O)NNc3ccnc(Br)c3)C2=O)cc1	771533498	SDSGBXAJWYSKBH-SFHVURJKSA-N	448.277	1.763	50	20	IDGD	
O=C(NNC(=O)N1CC[C@@H]2[C@H](CCCN2C2CC2)C1)C1CCN(c2ncccn2)CC1	773006471	UHJCOAVUNLFYPD-IEBWSBKVSA-N	427.553	1.383	50	20	IDGD	
O=C(CCc1ccccc1)NNC(=O)C(=O)Nc1ccc(I)cn1	773543357	SVAJCWDEINPTHE-UHFFFAOYSA-N	438.225	1.405	50	20	IDGD	
CCOC(=O)[C@@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNc2ccc3ccccc3n2)cc1	773655381	SGHOFAWRZGJEIW-CQSZACIVSA-N	449.467	1.998	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(NC(=O)C(=O)NNc2ccccc2[N+](=O)[O-])ccc1Cl	773655437	OXCFIPVYNBPQGF-UHFFFAOYSA-N	441.853	1.580	50	20	IDGD	
COc1nccnc1NNC(=O)c1cc(S(=O)(=O)N(C)C)ccc1N1CCCCC1	776226799	HTBFBAZSOLQUSS-UHFFFAOYSA-N	434.522	1.483	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)Cc1ccc(F)cc1Br	776976042	WEADGXZPUHHNSG-UHFFFAOYSA-N	433.278	1.986	50	20	IDGD	
COc1ccc2c(C)c(CCC(=O)NNC(=O)CNC(=O)OC(C)(C)C)c(=O)oc2c1	778437108	SWABIBPPFCWGNT-UHFFFAOYSA-N	433.461	1.715	50	20	IDGD	
O=C(CNS(=O)(=O)c1cccs1)NNc1ccc([N+](=O)[O-])cc1Br	779140361	IARSICXOVGDLAU-UHFFFAOYSA-N	435.281	1.840	50	20	IDGD	
COc1cc(OC)c(Cn2nccc2NC(=O)NNC(=O)Cc2cc[nH]n2)c(OC)c1	779484430	ZRYWZTBRKVGIAD-UHFFFAOYSA-N	429.437	1.076	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(O)cc([N+](=O)[O-])c2)c1	780321438	CQSPNJVRQLHJOK-UHFFFAOYSA-N	436.446	1.406	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNc1ncncc1Cl	781820709	ZCJWFLGYPIMOSF-UHFFFAOYSA-N	425.898	1.227	50	20	IDGD	
CNC(=O)c1cc(Oc2ccccc2NC(=O)C(=O)NNC(=O)c2ccc(O)cc2)ccn1	782835772	FAWBCSYSQBKJGU-UHFFFAOYSA-N	449.423	1.339	50	20	IDGD	
CCc1cccc2c1N(C(=O)C(=O)NNc1ccc(S(=O)(=O)NC(C)C)cn1)CC2	783262409	DBBYYXCEFAYKNW-UHFFFAOYSA-N	431.518	1.363	50	20	IDGD	
CC(C)(C)n1nc(-c2ccccc2)cc1NC(=O)C(=O)NN[C@@]1(C)CCS(=O)(=O)C1	783427893	SYMBZNYNXQEJGB-FQEVSTJZSA-N	433.534	1.442	50	20	IDGD	
O=C(NNC(=O)C(=O)N1CCCC1)C(=O)Nc1cccc(COCCc2ccccc2)c1	784000774	ZUBJQYOAAKEGNS-UHFFFAOYSA-N	438.484	1.154	50	20	IDGD	
COCCOc1cc(NC(=O)C(=O)NNc2ccc(C(F)(F)F)nn2)ccc1OC	784886480	RPIAYFAATHQCJT-UHFFFAOYSA-N	429.355	1.611	50	20	IDGD	
CCCCOc1ccc(OC)cc1NC(=O)C(=O)NNC(=O)Cc1cn2ccccc2n1	785066447	AJDFAICCGXVXGX-UHFFFAOYSA-N	439.472	1.850	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2ccc(-c3nnc4n3CCCC4)cc2)n1	785226141	QMFKQLOXMVPLMR-UHFFFAOYSA-N	449.519	1.999	50	20	IDGD	
CCOc1ccc(C#N)cc1NC(=O)C(=O)NNc1c(OC)cccc1S(C)(=O)=O	785331088	ODWKZSADYOFCQK-UHFFFAOYSA-N	432.458	1.451	50	20	IDGD	
O=C(CN1CCCN(c2nnc(C(F)(F)F)s2)CC1)NNC(=O)c1cccs1	786442604	FOVQAEBNEVWCAS-UHFFFAOYSA-N	434.469	1.592	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)C1CCC(NC(=O)C(C)(C)C)CC1	788752317	UQZACTNRACYDAH-UHFFFAOYSA-N	427.546	1.563	50	20	IDGD	
COC(=O)c1ccc(C=NNC(=O)Cc2cc(O)nc(S)n2)c(Br)c1	788975937	SAUSTWUEUPBKAI-UHFFFAOYSA-N	425.264	1.713	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)NC[C@@H](Cc2cccc(F)c2)C(=O)N2CCOCC2)n1	789308194	AGHLERQDTXELTE-QGZVFWFLSA-N	430.484	1.576	50	20	IDGD	
CCc1csc(NC(=O)C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)n1	789730646	VZVSTATYPMVEKO-UHFFFAOYSA-N	430.534	1.004	50	20	IDGD	
CS(=O)(=O)CC[C@H](C(=O)NNC(=O)c1cc(Br)c[nH]1)c1ccccc1	789875283	SRCFQOGNRSOKRV-ZDUSSCGKSA-N	428.308	1.757	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)NCc1nc(-c2cccc(Br)c2)no1	790898007	RBMDYZUIKWLUAM-SNVBAGLBSA-N	442.270	1.381	50	20	IDGD	
CN(C)N(C(=O)[C@@H]1CCCN(C(=O)Nc2ccccc2F)C1)[C@@H]1CCS(=O)(=O)C1	792855047	NMBQPPPYTNTOPI-HUUCEWRRSA-N	426.514	1.562	50	20	IDGD	
CNS(=O)(=O)c1cccc2c1CCN(CC(=O)NNC(=O)c1cccc(Cl)c1)C2	792921813	OFNUDLMONHQQDV-UHFFFAOYSA-N	436.921	1.067	50	20	IDGD	
COC(=O)[C@H]1CC[C@H](C(=O)NNC(=O)c2ccc(CSc3nncn3C)cc2)CC1	797789835	ZZQQEXUDINSIMZ-WKILWMFISA-N	431.518	1.848	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)C2=C(C)N(C)c3ncnn3[C@@H]2C)c1	798952508	IUJAXLKVTOOXPR-SNVBAGLBSA-N	435.282	1.795	50	20	IDGD	
C[C@@H]1CCNC(=O)[C@@H]1NC(=O)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1	799368057	RFASNZHPKRSWGW-TYCQWZJGSA-N	435.528	1.469	50	20	IDGD	
O=C(NCCNS(=O)(=O)c1ccc(Cl)cc1F)NNc1nc2ccccn2n1	799666183	ZTTLMCOKHZWBAT-UHFFFAOYSA-N	427.849	1.126	50	20	IDGD	
CNC(=O)CNC(=O)c1cccc(NC(=O)NNC(=O)c2ccc(Cl)cc2OC)c1	800597413	WEOCYCHWIDSFRZ-UHFFFAOYSA-N	433.852	1.291	50	20	IDGD	
CCc1csc(CC(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)n1	801171715	IXMXOZJVNCLXFX-UHFFFAOYSA-N	435.981	1.867	50	20	IDGD	
O=C(NNC(=O)c1cccc(OC(F)F)c1)N[C@H]1CCCN(C(=O)N2CCCC2)C1	805065875	PRHVQGXHDHLRJU-AWEZNQCLSA-N	425.436	1.912	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)[C@@H]1CCN(c2ccc(C#N)cc2F)C1	805588604	SRFNZIAZWNWPDJ-GOSISDBHSA-N	438.459	1.765	50	20	IDGD	
CN1CCC/C1=N/S(=O)(=O)c1cccc(NC(=O)C(=O)NNc2ncccc2F)c1	807300381	LBZBJXFTLIRBPW-IWIPYMOSSA-N	434.453	1.115	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)c1cc(NS(C)(=O)=O)cc(C(F)(F)F)c1	807369221	SMINHGSIFPRSOU-UHFFFAOYSA-N	441.428	1.627	50	20	IDGD	
CC1(C)CC[C@H]1NC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	807575877	SMTOABRXQJAKCC-QGZVFWFLSA-N	438.550	1.159	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccccc2-n2cnc(C#N)n2)c1C	810385988	IDJXLCLQJCTRHJ-HNNXBMFYSA-N	447.455	1.309	50	20	IDGD	
C[C@H]1C[C@H](NC(=O)NNC(=O)c2ccc3c(c2)OCCO3)c2ccsc2S1(=O)=O	812651380	SXDIYGDYQVITMA-GWCFXTLKSA-N	437.499	1.771	50	20	IDGD	
O=C1CN(Cc2cccc(NC(=O)C(=O)NNc3nc(C(F)(F)F)cs3)c2)CCN1	812987702	NYMIKPCIACKGLK-UHFFFAOYSA-N	442.423	1.176	50	20	IDGD	
COC(=O)c1cc(C(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)c[nH]1	814255593	VXBORLWAULTONL-UHFFFAOYSA-N	448.482	1.738	50	20	IDGD	
COc1ccc2c(c1OC)OCC2=NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	814879043	PPKINNBQNBVWJH-UHFFFAOYSA-N	438.484	1.375	50	20	IDGD	
Cc1nc(Cn2nnc(NC(=O)C(=O)NNc3c(Cl)cc(F)cc3Cl)c2C)no1	815603189	WLEVTLNYBDRZQR-UHFFFAOYSA-N	443.226	1.854	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCc2nncn2C1)C(=O)Nc1cccc(-c2cccc(Cl)c2)c1	815691925	FQCIJUBWYQATRO-HNNXBMFYSA-N	438.875	1.947	50	20	IDGD	
CCNC(=O)Nc1cccc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)N(C)C)c1	815751731	MBZXVSKHJUBOJP-UHFFFAOYSA-N	448.505	1.160	50	20	IDGD	
O=C(NNc1ncncc1F)c1ccc(Cl)c(S(=O)(=O)NC[C@H]2CCCO2)c1	817077789	QNARHAGPZQKTOW-LLVKDONJSA-N	429.861	1.483	50	20	IDGD	
O=C(NNc1ncncc1F)c1c[nH]c2ccc(I)cc2c1=O	817080012	DJVYBGPQAJJVSU-UHFFFAOYSA-N	425.161	1.819	50	20	IDGD	
Cc1ccc(-c2noc(CN3CCN(CC(=O)NNC(=O)c4cccs4)CC3)n2)cc1	841458798	NGGDLDRKILHYJC-UHFFFAOYSA-N	440.529	1.685	50	20	IDGD	
CC(C)NC(=O)C(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1ccc(Cl)cc1	843404487	IXKUFINIJGOAQG-UHFFFAOYSA-N	438.893	1.426	50	20	IDGD	
CCC1CCC2(CC1)NC(=O)N(CC(=O)NNC(=O)COc1cc(C)cc(C)c1)C2=O	863997268	ZRJDKQQZFGIHLO-UHFFFAOYSA-N	430.505	1.720	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)c1cc(C2CC2)nc2c1c(O)nc(=O)n2C	914333698	OKMVAAUSEABZCF-JTQLQIEISA-N	441.419	1.279	50	20	IDGD	
COc1nn(C)c2nc(C)c(CCC(=O)NNC(=O)c3ccc4c(c3)OCO4)c(C)c12	914747836	PJPBUYWTTXSIAY-UHFFFAOYSA-N	425.445	1.716	50	20	IDGD	
O=C(NNc1ncccn1)[C@H]1Cc2ccccc2CN1S(=O)(=O)c1ccc(F)cc1	914756860	CFNGUTXTSLAPLZ-GOSISDBHSA-N	427.461	1.875	50	20	IDGD	
Cc1nn(-c2ccccc2)c2sc(C(=O)NNC(=O)N[C@@H]3CCS(=O)(=O)C3)cc12	915880317	GTAZZRVNDHHHCC-GFCCVEGCSA-N	433.515	1.527	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCCCOc2ccccc2)cc1	916219460	RJIZCFCSEHPTHQ-UHFFFAOYSA-N	434.518	1.415	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)N[C@H](C)c2nnc3ccccn23)c2ccccc2c1=O	916222180	UZSGZHYRCZBUDX-CYBMUJFWSA-N	434.460	1.725	50	20	IDGD	
CO[C@@H](CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)c1ccccc1	916271391	OANHUAOAGKFULV-IBGZPJMESA-N	446.529	1.803	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCc2ccnc(-n3cccn3)c2)nc1	916394560	ZJRIENADWOVCAS-UHFFFAOYSA-N	430.494	1.175	50	20	IDGD	
COc1ccc(S[C@H](C)C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1	917328244	OGBDBNDSCXMSST-FZKQIMNGSA-N	446.481	1.706	50	20	IDGD	
O=C(NNC(=O)[C@H]1CC(c2ccc(Cl)cc2Cl)=NO1)c1ccc(-n2cnnn2)cc1	917924872	BBUFYJUCQIRSDD-MRXNPFEDSA-N	446.254	1.923	50	20	IDGD	
Cc1nc2c(C(N)=O)cnn2c(C)c1CCC(=O)NNC(=O)c1ccc2ccccc2c1	918110918	YTECGSVOYUVUBQ-UHFFFAOYSA-N	430.468	1.992	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@H](C(=O)NNC(=O)NCC(F)(F)F)C2)s1	918707162	ARAXIWHQMDVLAU-JTQLQIEISA-N	428.458	1.350	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)CCn1cc([N+](=O)[O-])cn1	919838860	PCQWAMWSPPOSRL-SNVBAGLBSA-N	426.227	1.559	50	20	IDGD	
CC(C)N(C)S(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1	920235217	JPYKRLYLPFXVFM-UHFFFAOYSA-N	449.489	1.768	50	20	IDGD	
Cc1nn(-c2ccc(C(=O)NNC(=O)CN3CCCC3=O)cc2)c(C)c1Br	920435690	MSHRIMIKUHCMIS-UHFFFAOYSA-N	434.294	1.635	50	20	IDGD	
CS(=O)(=O)c1ccc(OCCNC(=O)NNC(=O)c2cncn2-c2ccccc2)cc1	1116004007	WQQZUWIXSKKXBC-UHFFFAOYSA-N	443.485	1.299	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)NCCN2C(=O)COc3ccccc32)cc1OC	1116679617	TWVHCKROSIDIJW-UHFFFAOYSA-N	442.472	1.854	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)[C@@H]2CC(=O)N(c3ccc(C#N)cc3)C2)cc1	1318034333	VDJQPRXPTIMTOW-NVXWUHKLSA-N	436.468	1.925	50	20	IDGD	
O=C(CNC(=O)NCc1ccc(Cl)cc1)NNC(=O)c1cncn1-c1ccccc1	1318199760	QPMLISWPSJAIKJ-UHFFFAOYSA-N	426.864	1.786	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2ccc(OCCCC(=O)O)c(F)c2)cc1	1318278959	QAZLZKGPGQRAFV-UHFFFAOYSA-N	426.422	1.701	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCc2ccc(S(=O)(=O)NCC(C)C)cc2)cc1	1319748505	VGAADZSGCZBXKZ-UHFFFAOYSA-N	434.518	1.774	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cccc4c3NC(=O)C4=O)C2)C1	1778709038	WSGSANUIPVBAMA-BTYIYWSLSA-N	433.892	1.672	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@]2(C1)CN(C(=O)c1c(F)ccc(O)c1F)CCO2	1779298873	LFQVCEPUFMAALR-IBGZPJMESA-N	428.508	1.965	50	20	IDGD	
C=C[C@H](O)C(C)(C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Br)C2	1779337859	DVJDOMLSBCPBRW-MOROJQBDSA-N	435.334	1.764	50	20	IDGD	
CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CN(C)NC(=O)NCc2ccccc2)C1	1780559074	ZMMWXVOXDHZOKH-AUSIDOKSSA-N	445.564	1.257	50	20	IDGD	
CC(C)(C)OC(=O)C(C)(C)CC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1780886692	RNUUROMQRAGFQM-JLTOFOAXSA-N	432.945	1.174	50	20	IDGD	
COc1ccc([C@H](O)C(=O)N2CCO[C@]3(CCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)cc1	1781226133	VSJDGTDWADLCAK-FFZOFVMBSA-N	445.343	1.795	50	20	IDGD	
Cc1ccn2c(C(=O)N3CCO[C@@]4(CCN(C(=O)[C@H](F)Br)C4)C3)cnc2c1	1781331950	BNZVUCHWDBIPLV-MAUKXSAKSA-N	439.285	1.777	50	20	IDGD	
O=C([C@@H](F)Br)N1CC[C@@]2(C1)CN(C(=O)C1(Br)CC1)CCO2	1781332928	KOMSUEAZWCLYTQ-BXKDBHETSA-N	428.096	1.434	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)no1)C2	1781900658	AQTPQRBZNQNFAA-XTQGRXLLSA-N	430.299	1.681	50	20	IDGD	
Cn1cc(CC(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@](C)(Cl)CCl)C3)cn1	1782591423	UVRDOXJXVNEWNA-AYOQOUSVSA-N	431.364	1.713	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@]2(C1)CN(C(=O)c1cc[nH]n1)CCO2	1782861203	IEOXQOYPXCXCRX-NMQRCDEWSA-N	427.411	1.739	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2	1783130747	FQUGUYMRPRARPE-HGHGUNKESA-N	435.908	1.051	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)Cc3noc4ccccc34)CCO2)C1	1783532319	HCQWNEIQIUCRRC-ORAYPTAESA-N	436.306	1.984	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)CCc3cccc(O)c3)CCO2)C1	1783539469	JXUQPYYZMRSOER-IFXJQAMLSA-N	425.323	1.938	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cn4cc(Cl)ccc4n3)CCO2)C1	1783876434	XVJWFPZMGCXVIN-AUUYWEPGSA-N	441.315	1.685	50	20	IDGD	
O=C(Cn1ccc2c(F)cccc21)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21	1784040480	QFEPFRDIIYVQOV-JOQQVMPUSA-N	437.899	1.360	50	20	IDGD	
CC[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)N(CC)CC	1784623236	JODMPGORBXVTFJ-QAETUUGQSA-N	432.403	1.872	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(CO)c(F)c3)C2)C1	1785266074	IGKJQKISKBPXNP-KZULUSFZSA-N	429.286	1.545	50	20	IDGD	
Cc1c(C(=O)NC2(c3ccc(NC(=O)[C@H](O)CCl)cc3)CCC2)cn2[nH]cnc(=O)c12	1786136779	PLNFMRDSDGWRJG-MRXNPFEDSA-N	443.891	1.678	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3ccc[nH]3)[C@H]2C1	1787022559	KGVQHMRNPFWBTH-OTRWWLKZSA-N	426.355	1.958	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CC=CCC3)C[C@@H]21	1787507744	OIKVCRWEPLKFPP-HQBWOOTPSA-N	441.532	1.456	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc4cc(C)ccn4c3=O)[C@H]2C1	1788041580	CUCIRMALXNKJGR-OWLYRPNTSA-N	446.935	1.614	50	20	IDGD	
CCOc1cnc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]3C2)cn1	1788761156	KVNUKZIKWGWDRQ-ZOBUZTSGSA-N	436.585	1.320	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(O)c([N+](=O)[O-])c3)[C@H]2C1	1790022472	KCXXNLSTTIJCFF-WSMBLCCSSA-N	441.868	1.148	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](CN)c3ccccc3)C[C@@H]21	1791057946	LXKDIUDHHRDDGN-QSGXVVIFSA-N	438.366	1.492	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnn3c1CCC3)C2	1792873572	DLAFWMHNAZCCRN-NFFDBFGFSA-N	425.327	1.064	50	20	IDGD	
COC(=O)[C@@H]1CC[C@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)CBr)C3)C1	1792967099	XSDGJJUMUMKDMK-GTDBDLECSA-N	445.354	1.196	50	20	IDGD	
COC(=O)C12CCC(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)[C@H](O)CCl)(CC1)CC2	1793111541	NRGQXXQCXRLHTC-YFQBQFEZSA-N	426.941	1.738	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCl)c1ccc(N2CCCOC2=O)cc1	1793114452	GVYGEBIELNXDBM-RANZSIQMSA-N	435.908	1.885	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccnn1)C2	1794142228	DTFIYQKDQYOPTN-FQLMCAECSA-N	437.928	1.861	50	20	IDGD	
COc1cccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Br)C3)c1	1795241797	VLVLURVISMFECF-RMHZUWNSSA-N	429.286	1.518	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2cnccc2[nH]1	1797515279	DCDHSTSQCCGJKF-DPYKFYPSSA-N	435.322	1.797	50	20	IDGD	
O=C(C[C@H]1CNc2ccccc2O1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2	1797679710	ZHRMPKOMLWEGDN-LKQDWFRTSA-N	428.316	1.643	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H]1CCc3ccccc31)C2	1798443698	XRRGWSCUDYJMAM-SFNKJDCFSA-N	433.512	1.667	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccn3ccnc13)C2	1799277263	VJEBYXOZPSFUSN-FCIKYMEBSA-N	425.316	1.774	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnn3c1OCCC3)C2	1799279921	XQGBDUVBKPILOU-AZGFTEDZSA-N	431.320	1.105	50	20	IDGD	
C[C@@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1ccc(O)cc1	1799302225	KXKGOXZFYUCNFO-BCEUIYSSSA-N	429.286	1.776	50	20	IDGD	
O=C(COc1ccccc1F)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2	1800648534	SWCYXTVPFBSOEW-OXUXUCFPSA-N	433.249	1.485	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1snnc1C1CC1)C2	1800756633	BRCUIWXMZZPAOZ-KXGXSXBTSA-N	429.340	1.402	50	20	IDGD	
COc1cnc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)Br)c(F)c1	1800757630	HLPGUZHDORJTHW-DYNIEEOBSA-N	430.274	1.216	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2ncccc2[nH]1	1800885733	PQJPSJOPBJBOCV-CWNKPHDYSA-N	447.499	1.949	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCBr)C3)C1	1800961919	DVGGJRHIASEMGB-SVZOTFJBSA-N	445.354	1.340	50	20	IDGD	
CCOC(=O)N1CCC(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](Cl)CC)C3)CC1	1801991272	YLRHAJWFGCSGST-YYIAUSFCSA-N	429.945	1.462	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCc1c[nH]c2ncccc12	1802067863	QIYJCAWBYYJPBG-LORHWOILSA-N	434.924	1.339	50	20	IDGD	
CC(C)(CCl)C(=O)NC[C@@H]1CCN(C(=O)c2nccnc2C(N)=O)[C@@H]1c1cccnc1	1802905035	WXOJPIVKHPDKEV-WMLDXEAASA-N	444.923	1.555	50	20	IDGD	
CCOc1ccc(C(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)nn1	1803142058	WSIYDPXZXPWJKO-UWWQBHOKSA-N	433.896	1.190	50	20	IDGD	
CC(C)(C)OC(=O)N1CC=C(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](O)CCl)C3)CC1	1804031188	AGXOSJWWEYIURS-YVSFHVDLSA-N	441.956	1.792	50	20	IDGD	
CCOc1cnc(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](Cl)COC)[C@@H]2c2cccnc2)cn1	1804919636	MQQWEXFUULBKRL-TXPKVOOTSA-N	447.923	1.844	50	20	IDGD	
CSCC(C)(C)C(=O)N1CCCC2(CCN(C(=O)c3cnccc3C(=O)NN)CC2)C1	1806094896	YAFFENQTRYFAAW-UHFFFAOYSA-N	447.605	1.919	50	20	IDGD	
O=C(Cc1ccccc1)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1806512653	OTEJSLRONBJNEB-ZJSXRUAMSA-N	443.312	1.324	50	20	IDGD	
O=C(CCn1c(=O)oc2ccccc21)N1CCCC2(CCN(C(=O)[C@H](O)CCl)CC2)C1	1806898537	JKNBVLITLYNDJR-QGZVFWFLSA-N	449.935	1.816	50	20	IDGD	
C[C@]1(C(=O)NC[C@@H]2CCN(C(=O)[C@H](F)Br)[C@H]2c2cccnc2)CCCN1	1808088623	OMMWQHMFOCVETB-YRBFXIGRSA-N	427.318	1.920	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cnc(O)[nH]2)[C@H]1c1cccnc1)[C@@H](F)Br	1808668140	IZTBQIGETLLISS-WCFLWFBJSA-N	426.246	1.520	50	20	IDGD	
Cc1cccc(/C=C/C(=O)N2CCC3(CCCN(C(=O)c4ccc(B(O)O)cc4)C3)CC2)n1	1809967887	NOEPMUPMFOESDV-ZHACJKMWSA-N	447.344	1.628	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)[C@H]2CCc3nc[nH]c3C2)[C@H]1c1cccnc1	1813034048	ZPNZZMWQTKVLAK-VERUCKTNSA-N	445.951	1.869	50	20	IDGD	
CC1(C)CC(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)C1	1813125542	BDUVOQHNGYVDEJ-GHTZIAJQSA-N	435.333	1.517	50	20	IDGD	
O=C(CC(F)(F)F)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2	1814446095	ARPARLLZYDJRIR-LLVKDONJSA-N	427.213	1.001	50	20	IDGD	
N=C(N)SCCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](F)Br)CC2	1814950608	FBNFUBULHZWNRH-LDWIPMOCSA-N	438.348	1.762	50	20	IDGD	
Cc1c(F)ccc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@H](O)CCl)CC3)c1N	1815235124	RYRWNPXBOWDVQN-TVQRCGJNSA-N	426.901	1.998	50	20	IDGD	
CO[C@@H](C)C(=O)N[C@H]1CCc2nc(NC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)sc2C1	1817283022	QFEGUCPQFTWZED-MXZWCWCWSA-N	432.506	1.224	50	20	IDGD	
Cc1ccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)c(O)n1	1817472286	PWTNNJSEHZWQFC-SFHVURJKSA-N	449.276	1.118	50	20	IDGD	
CN1CCN(CC(=O)Nc2cc([C@@H]3CCCCN3C(=O)CCBr)[nH]n2)CC1	1818911803	IVLBOMPZAXDDSU-HNNXBMFYSA-N	441.374	1.434	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H]2CCCOC2)[nH]n1	1819404224	DVRHYSLZDLKGEK-GUYCJALGSA-N	441.492	1.141	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)/C=N/N3CCCCC3)sc2C1	1819780850	INWDJCWYFURTMB-RLXLQZHTSA-N	427.958	1.781	50	20	IDGD	
CCN(C)[C@@H](C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1821626435	HDNGDEVWSQHCBF-GUYCJALGSA-N	442.524	1.054	50	20	IDGD	
Cc1ccc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2ccc(B(O)O)cc2)CC3)c(C)c1	1822018199	IHGAHALFECFSNR-QGZVFWFLSA-N	449.341	1.979	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)Cc3ccc4ncnn4c3)sc2C1	1822501278	LUAFBBICHYZOPY-STQMWFEESA-N	448.936	1.594	50	20	IDGD	
O=C(CCn1cncn1)N[C@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1	1823013538	CZBFDKLNUGSFJX-UFBFGSQYSA-N	431.291	1.427	50	20	IDGD	
O=C(NCCC(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)CC1)c1ccc[nH]1	1824180693	LUVFEXVYRXUMJK-ROUUACIJSA-N	438.956	1.354	50	20	IDGD	
Cc1cnc2c(C(=O)N3CCC([C@@H]4CCCCN4C(=O)[C@H](O)CCl)CC3)cnn2c1	1824186518	NJJSLTLHMSABFG-ZWKOTPCHSA-N	433.940	1.871	50	20	IDGD	
O=C(NCCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H](O)CCl)CC1)c1ccc[nH]1	1825160221	YXCMTHURHOAVCD-MSOLQXFVSA-N	438.956	1.354	50	20	IDGD	
C=CCO[C@H](C)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827056075	RVHHASIFDVOLFZ-DYESRHJHSA-N	428.338	1.191	50	20	IDGD	
COC[C@@H](NC(C)=O)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CO[Si](C)(C)C)CC1	1829102853	OZNQNNKMVXYFOT-MOPGFXCFSA-N	441.645	1.609	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)ccn1	1829246435	ZLRPPGXLUDOGJZ-QFIPXVFZSA-N	435.333	1.617	50	20	IDGD	
CC(C)(C)c1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)cn1	1829566508	PNZKRLQAOPRUIG-HRAATJIYSA-N	439.940	1.049	50	20	IDGD	
C=CCOCCCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2	1830535317	MJADIQMBSDSPRO-LPHOPBHVSA-N	447.370	1.457	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cccnc3)C2)C1	1830538429	FSPKDFBIHXULHQ-HNAYVOBHSA-N	440.338	1.112	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@]3(C)CC3(F)F)C2)C1	1830545187	HQHPTIMDACNLSK-DAXOMENPSA-N	439.297	1.519	50	20	IDGD	
O=C(/C=C/c1cc2ccccc2o1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1830730896	GMUJISIVEDSQNB-KXJNKWKMSA-N	448.903	1.502	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccn4cncc34)C2)C1	1831650388	HENZZPHSZCBFRV-DYESRHJHSA-N	434.924	1.812	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H]2CCNC(=O)C2)CC1	1831942378	VRPPPPSGQKGWJH-BPUTZDHNSA-N	428.371	1.916	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCC([C@H]2CCCCN2C(=O)CN2C(=O)C=CC2=O)CC1	1831986427	RTXXVFAFOXTGCI-FOIQADDNSA-N	444.359	1.767	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)CC[C@H]2CCOC2)CC1	1832452805	NBXAWMXRJILIFQ-AVRDEDQJSA-N	442.365	1.416	50	20	IDGD	
O=Cc1ccc(C(=O)N2CCC(N3CCC(NC(=O)[C@@H](O)CCl)CC3)CC2)s1	1833310525	MALBNSVFAMRUIY-INIZCTEOSA-N	427.954	1.346	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ncc(OC)cc3F)CCO2)C1	1833634775	ZVTQGWOHEWLMBZ-IFXJQAMLSA-N	429.876	1.317	50	20	IDGD	
O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)c1ccccc1O)CCO2	1833753111	MLOPPLNTPFLGHL-SFHVURJKSA-N	427.295	1.247	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)c1n[nH]c(C2CC2)c1F	1834023747	GESKUTZBHRTMLZ-HNNXBMFYSA-N	441.935	1.211	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3nccs3)CCO2)C1	1834431306	KVUIWQUICCMHLT-LRDDRELGSA-N	432.340	1.244	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)Cn3cccn3)CC2)CC1)[C@@H](F)Br	1836412468	HRJLEAQVZMJULH-MRXNPFEDSA-N	430.322	1.145	50	20	IDGD	
N#CCc1ccc(C(=O)N2CCC(OC3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)cc1	1836717536	FSMJTRFQHRYFMS-FQEVSTJZSA-N	433.936	1.965	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)CS[C@H]3CCCCO3)CCO2)C1	1837501243	IHMGAWLPFOQJMD-PXNSSMCTSA-N	449.013	1.968	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc4c3OCC4)C2)C1	1837713324	WDGAWCMQSOYCII-JOCHJYFZSA-N	448.592	1.543	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(Cl)ncn3)CCO2)C1	1838254864	YCJYAKFHLGRKPU-SCLBCKFNSA-N	431.320	1.608	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(F)ccc3F)CCO2)C1	1838860405	FVYXNRYDIUNBBH-KZULUSFZSA-N	447.276	1.818	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3Cc4ccccc4CN3)C2)C1	1839144516	CVGBGZCWBKQZEL-CNNODRBYSA-N	435.952	1.175	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cc(F)ccc3OC)C2)C1	1839148761	JAJRWIRKXMMLAM-DYESRHJHSA-N	442.915	1.851	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)/C=C/c3ccoc3)C2)C1	1839962348	BMPLTEKKHAHZKO-YKTDSXCKSA-N	441.322	1.923	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccnc3Cl)C2)C1	1840029711	NEXANHYUGNMUQE-SJCJKPOMSA-N	446.729	1.588	50	20	IDGD	
O=C(OCc1ccccc1)N1CC(C(=O)N2CC3(CCCN3C(=O)[C@H](O)CCl)C2)C1	1841353945	ZDBKFZREEIXNDY-QGZVFWFLSA-N	435.908	1.058	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCCC12CN(C(=O)c1cc(O)n[nH]1)C2	1841924550	YUHVDQOZLJOSRR-LBPRGKRZSA-N	427.889	1.064	50	20	IDGD	
CCc1nn(C)c(C(=O)N2CCCC23CN(C(=O)[C@@H](O)CCl)C3)c1Br	1843147373	IBCVFJOAXRARQK-NSHDSACASA-N	433.734	1.162	50	20	IDGD	
C#CCCCCC(=O)N1CCCC12CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2	1846489460	YJXXYYMBGGKXFS-UHFFFAOYSA-N	439.560	1.730	50	20	IDGD	
C[C@H]1[C@@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](O)CCl)CCCN1C(=O)OC(C)(C)C	1847565562	URUQAWABLWQJOD-QUSNUVHPSA-N	443.972	1.824	50	20	IDGD	
CCC(=O)N[C@@H](C)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O	1847741533	UVYLYRXCLSUIOM-ZLIFDBKOSA-N	446.460	1.250	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CCN2C(=O)c3ccccc3C2=O)cc(OC)c1OC	3621272	LCIUWGUBIIYESN-UHFFFAOYSA-N	427.413	1.160	50	20	IDGD	
O=C(COC(=O)c1ccc(CS(=O)(=O)c2ccccc2)o1)NNC(=O)c1ccccc1	10067533	JGSOYDBURZCGHB-UHFFFAOYSA-N	442.449	1.872	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)n1	12667268	IOSDNBXMTFGTQL-UHFFFAOYSA-N	441.513	1.440	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)c1ccccc1F)C(=O)NNC(=S)NC(C)(C)C	14894998	NRGPTVGKEFJCGT-GFCCVEGCSA-N	436.600	1.520	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)Cn2c(=O)oc3ccccc32)c2ccccc2c1=O	17397686	CCQWIAGKMYTHEF-UHFFFAOYSA-N	449.467	1.956	50	20	IDGD	
O=C(CNC(=O)c1cnc2ccccc2c1O)NNC(=O)c1ccc(Br)s1	107920119	MIWXKLFXCGJPCH-UHFFFAOYSA-N	449.286	1.955	50	20	IDGD	
COc1cc(C=NNC(=O)CCN2CCN(c3ccccc3)CC2)cc([N+](=O)[O-])c1O	254704655	UCXWSCZIEBVUAI-UHFFFAOYSA-N	427.461	1.971	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCCC[C@@H]2[C@@H](C)NC(=O)OC(C)(C)C)n1	726598212	BPGZHFGLNFEXRL-HUUCEWRRSA-N	439.582	1.909	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)[C@@H]1CCCN(C(=O)N2CCCC2)C1	726862783	AOOZFBNVNLYNJF-OAHLLOKOSA-N	435.550	1.498	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NCc1cccc(C(=O)NCCN(C)C)c1	727604368	XTWKUKKQXYYBMW-HNNXBMFYSA-N	445.495	1.415	50	20	IDGD	
C[C@H](C(=O)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1)N1C(=O)CCC1=O	727733111	XJBVVJQEGMGKQS-UZLBHIALSA-N	434.496	1.298	50	20	IDGD	
O=C(NNc1nc(-c2cccnc2)no1)c1ccc(S(=O)(=O)NC[C@H]2CCCO2)cc1	728078845	YEPJZCZCBPQPMJ-OAHLLOKOSA-N	444.473	1.346	50	20	IDGD	
COc1ccc2[nH]cc(CC(=O)OCC(=O)NNC(=O)[C@H]3COc4ccccc4O3)c2c1	728328201	QLWSMBKQBZPYNG-LJQANCHMSA-N	439.424	1.250	50	20	IDGD	
CC(=O)c1ccc(OCCCC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1	728846317	XWKJNLJHJOEFBO-UHFFFAOYSA-N	425.489	1.902	50	20	IDGD	
CCCS(=O)(=O)Nc1cccc(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1	728889363	FCFPXGRPGJEACD-UHFFFAOYSA-N	446.533	1.306	50	20	IDGD	
Cc1nc(CN2CCN(C(=O)NNC(=O)c3cc(Br)c[nH]3)CC2)cs1	728942487	VTUZVUSSMURXML-UHFFFAOYSA-N	427.328	1.714	50	20	IDGD	
Cc1nnnn1/C(=C/c1ccccc1)C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	730077403	WSANVXIKVWLSQQ-CPNJWEJPSA-N	439.501	1.564	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)N2CCN([C@@H]3CCC[C@@H]3O)CC2)N(C)c2ccccc21	730083400	KPRQJVAHJAUNEK-IRLDBZIGSA-N	437.544	1.715	50	20	IDGD	
Cc1cc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)Cc3cc[nH]n3)cc2)ccc1F	730102417	BRXQBWONIDYPBH-UHFFFAOYSA-N	431.449	1.662	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)N[C@H]3CCc4ccc(F)cc43)nc2)CC1	730130106	AHYQDEVEAHTXLK-SFHVURJKSA-N	448.524	1.470	50	20	IDGD	
O=C(CNC(=O)c1c(Cl)cccc1[N+](=O)[O-])NNC(=O)c1cc(Cl)ccc1O	731050266	GLYAQFSKIPHBKZ-UHFFFAOYSA-N	427.200	1.798	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCN(C(=O)NNC(=O)c3ccccc3OC)CC2)cc1	731499851	LDQUDUHVNGVFJB-UHFFFAOYSA-N	448.501	1.065	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N2CCC[C@H](N3CCCC3=O)C2)cc1Br	732256247	ZXNJQYWWEGOSFA-ZDUSSCGKSA-N	439.310	1.899	50	20	IDGD	
O=C(COC(=O)c1cccnc1OCC(F)(F)F)NNC(=O)c1cccc([N+](=O)[O-])c1	732322675	DDNNXCHNBAXTMJ-UHFFFAOYSA-N	442.306	1.549	50	20	IDGD	
O=C(NNS(=O)(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)NC1CCCCC1	733121501	OHTRQUGCFLERDZ-UHFFFAOYSA-N	430.552	1.296	50	20	IDGD	
Cn1c(=O)nc(O)c2c(C(=O)NNC(=O)c3cnn(-c4ccccc4)c3)cc(C3CC3)nc21	733169943	IHONVFKMEDOELY-UHFFFAOYSA-N	445.439	1.172	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc2c(c1)OCCCO2)NNc1ccc(F)cc1F	733364578	MDCBCMOXUUTBHT-UHFFFAOYSA-N	427.429	1.938	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](NC(=O)NNC(=O)c2nnc(O)c3ccccc23)C1	734218546	JURULFQOCFFSNH-LBPRGKRZSA-N	430.465	1.679	50	20	IDGD	
CN1C(=O)C[C@H](C(=O)NNC(=O)CNC(=O)c2cccs2)[C@H]1c1cccc(Cl)c1	734391888	NRWDYSDHQVJDJN-SUMWQHHRSA-N	434.905	1.498	50	20	IDGD	
Cn1ncc(C(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)c1C(F)(F)F	734825289	YFIGCLHYTIYOCF-UHFFFAOYSA-N	434.419	1.782	50	20	IDGD	
O=C(COC(=O)[C@@H]1C[C@@H]1c1c(F)cccc1F)NNC(=O)[C@H]1COc2ccccc2O1	734924242	SKBUNXKAFYJWFZ-XWCIJXRUSA-N	432.379	1.599	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)[C@H]2CSCN2C(=O)C(C)(C)C)cc1C	736818872	MFTRMFWHWNXWLP-GFCCVEGCSA-N	441.575	1.871	50	20	IDGD	
COc1cccc(OCCCNC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)c1	738450415	MBWSCVOCDJQDBZ-UHFFFAOYSA-N	449.533	1.710	50	20	IDGD	
O=C(CN1C(=O)[C@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O)NNC(=O)c1cc2c(s1)CCCCCC2	742480712	NGTGUITWJBWNCY-OSLDLMBLSA-N	431.514	1.331	50	20	IDGD	
CC(C)=CC(=O)NCc1ccc(C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)cc1	742675581	BJNNEALFGHXZSY-UHFFFAOYSA-N	433.509	1.738	50	20	IDGD	
CCOc1ccc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)Cc3cc[nH]n3)cc2)cc1	743288558	CRTLECBRIXVYBA-UHFFFAOYSA-N	443.485	1.613	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CN2CCN(C(=O)c3cccc(Cl)c3)CC2)c1	744384994	GHLJDKPOSRIBOM-UHFFFAOYSA-N	425.876	1.431	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)CN2CCC[C@@H](C(=O)Nc3ccc(Cl)cn3)C2)cc1	744389566	VWKNOJMBQDDSIP-MRXNPFEDSA-N	440.891	1.718	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN(C)C[C@H]2CCN(Cc3ccccc3)C2)cc1OC	744425701	KKHOXWKRKSZWRM-LJQANCHMSA-N	440.544	1.919	50	20	IDGD	
C[C@]1(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)Cc2ccccc2C(=O)O1	744620313	IRECHSPDLSYAEC-OAQYLSRUSA-N	445.497	1.322	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNc1ccccc1S(=O)(=O)N1CCOCC1	744620872	PRXKTNFZKIHDGV-UHFFFAOYSA-N	436.446	1.138	50	20	IDGD	
COc1ccc(C)cc1-n1ccc(C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)n1	744877561	YPNSXDJGRUHKAK-UHFFFAOYSA-N	433.424	1.679	50	20	IDGD	
CC(C)(C)C(=O)NCc1ccc(C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)cc1	745138906	SIWNODJTYDLNTG-UHFFFAOYSA-N	436.468	1.839	50	20	IDGD	
Cc1ccc(C)n1-c1ccc(C(=O)NNC(=O)NCCCN2CCC[C@H](C(N)=O)C2)cc1	745830268	NLWVLKYQHVMIQA-IBGZPJMESA-N	440.548	1.626	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)N[C@@H]3C[C@@H]3C3CCCCC3)nc2)CC1	745858512	RFMPMNOIEKMQJH-QZTJIDSGSA-N	436.582	1.613	50	20	IDGD	
Cc1cc(N2CC[C@H](NC(=O)NNC(=O)Nc3ccc(OC(F)F)cc3)C2=O)n(C)n1	745906908	WXYOQVBMOLZGSV-ZDUSSCGKSA-N	437.407	1.471	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NC[C@H]2CCCN(CC(C)C)C2)c2ccccc2c1=O	746328632	ONOUONLEQDDBBJ-MRXNPFEDSA-N	428.537	1.728	50	20	IDGD	
O=C(CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)NNC(=O)Cc1cn2ccccc2n1	746547959	AHHYQROJZBOZST-UHFFFAOYSA-N	438.400	1.321	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)C2(NC(=O)OC(C)(C)C)CCCCC2)c2ccccc2c1=O	746818062	MYIGUVHSXNGHTA-UHFFFAOYSA-N	443.504	1.922	50	20	IDGD	
O=C(NNC(=O)[C@@H]1OCCc2ccccc21)c1cccc(S(=O)(=O)N2CCCC2)c1	749590548	OEMMGGXWCBKOAE-LJQANCHMSA-N	429.498	1.546	50	20	IDGD	
CCCOc1ccc(-c2nc(C(=O)NNC(=O)N[C@@H]3CCS(=O)(=O)C3)cs2)cc1	749847227	BKNCYJBWTZFMPI-CYBMUJFWSA-N	438.531	1.730	50	20	IDGD	
COc1ccccc1N1CC[C@H](CNC(=O)NNC(=O)Cc2nc3ccccc3n2C)C1	750330478	FJLCENYFFDFDTM-MRXNPFEDSA-N	436.516	1.981	50	20	IDGD	
O=C(CCc1nc(O)c2c3c(sc2n1)CCCC3)NNC(=O)CNC(=O)c1ccco1	751207312	VKWRZIWMKAMQFL-UHFFFAOYSA-N	443.485	1.379	50	20	IDGD	
CC[C@H](NC(=O)/C(C#N)=C/c1cc(C)n(C[C@@H]2CCCO2)c1C)C(=O)N1CCOCC1	752480871	BZHDDHUBVQVCMM-YBUCYZLGSA-N	428.533	1.945	50	20	IDGD	
COc1cc(OC)cc(N2C[C@H](C(=O)NNC(=O)CNc3ccccc3OC)CC2=O)c1	752791831	KDWMYLDQMIMGBS-CQSZACIVSA-N	442.472	1.325	50	20	IDGD	
COc1ncc(-c2noc(CCC(=O)C(C#N)=C3N(C)c4ccccc4N3C)n2)c(N)n1	752893491	LDVNCSJBOKMPJS-UHFFFAOYSA-N	432.444	1.940	50	20	IDGD	
CC(C)c1noc2ncc(C(=O)OCC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)cc12	752928369	CCEHAGQAGMTJFG-UHFFFAOYSA-N	427.373	1.872	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)OCc2noc(C)n2)cc1	753475233	DEAQLYDITHQUGF-OQLLNIDSSA-N	436.428	1.776	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)c1cccc(I)c1O	755223556	RKACHMCBRKHRCA-UHFFFAOYSA-N	445.238	1.249	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)c2cc(Br)c[nH]2)n([C@H]2CCS(=O)(=O)C2)n1	755531864	JXGYNABNSYPWFW-JTQLQIEISA-N	445.299	1.108	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2cccc(C#N)c2)cc1S(=O)(=O)NC1CC1	756681437	JHZWGHGDZPETHZ-UHFFFAOYSA-N	429.458	1.474	50	20	IDGD	
O=C(COC(=O)CCC(=O)c1ccc(F)c(F)c1)NNC(=O)c1cccc([N+](=O)[O-])c1	756690644	IVGHOCZSUJYWMC-UHFFFAOYSA-N	435.339	1.840	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2c(C)nc3ccccn23)cc1	756783627	GHSWMTQUESWOQQ-UHFFFAOYSA-N	446.489	1.034	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)CN2C(=O)COc3ccc([N+](=O)[O-])cc32)c(OC)c1	757198191	KBHXRBAOOKQCIA-UHFFFAOYSA-N	430.373	1.259	50	20	IDGD	
CO[C@@H]1Cc2ccc(NC(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)cc2C1	758053525	DXOOQOXDTKEDHP-QGZVFWFLSA-N	432.502	1.517	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12	758079510	MEXNQAANWLTVNO-UHFFFAOYSA-N	444.473	1.681	50	20	IDGD	
COC(=O)[C@H](C)Oc1ccc(/C=C(/C#N)C(=O)Nc2ccc(S(N)(=O)=O)cc2)cc1	758415518	ISQUVSLLOXNMLG-WZMONFQBSA-N	429.454	1.820	50	20	IDGD	
Cn1cc(-c2ccccc2CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)cn1	758652272	RICFCHMTEJIABE-UHFFFAOYSA-N	441.517	1.524	50	20	IDGD	
CCCCS(=O)(=O)NCC(=O)NNC(=O)c1ccc(Br)cc1Cl	761158053	WOJGSNDQFMQPDQ-UHFFFAOYSA-N	426.720	1.583	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)c1cnn(CC(=O)NC2CCCCC2)c1	762348475	BWHGUDKXDHIXTG-UHFFFAOYSA-N	445.545	1.894	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)N[C@@H]1CC[C@H]2SCCS[C@@H]12	762527528	KOUZKBFPDXHJGC-RTXFEEFZSA-N	429.593	1.303	50	20	IDGD	
O=C(NNC(=O)c1ccccc1)C(=O)Nc1cc(C(F)(F)F)ccc1N1CCOCC1	763425356	HJTFFEGAFBUUSQ-UHFFFAOYSA-N	436.390	1.942	50	20	IDGD	
O=C(NNC(=O)c1ccccc1O)C(=O)Nc1ccc(N2CCc3sccc3C2)nc1	763530096	OPJCYTAQURGSIC-UHFFFAOYSA-N	437.481	1.811	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(CCN3CCCC3)cc2)cc1OC	763544256	TWMGBGLEPCJHCC-UHFFFAOYSA-N	440.500	1.742	50	20	IDGD	
CCc1cc(O)nc(-c2cccc(NC(=O)C(=O)NNC(=O)c3ccc4c(c3)OCO4)c2)n1	763552268	YHIOFHCZKAWEDX-UHFFFAOYSA-N	449.423	1.540	50	20	IDGD	
COCCCOc1cccc(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1	763573154	XRBFCVYIVITDDJ-GOSISDBHSA-N	429.429	1.028	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)C(=O)Nc2ccc(CC(N)=O)cc2)c1	763597644	RBIAWEAXIDKVOU-UHFFFAOYSA-N	426.473	1.311	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(NC(=O)CN(C)C)cc2)c2ccccc2n1	763616387	LJKGFUNVTTYMHA-UHFFFAOYSA-N	448.483	1.443	50	20	IDGD	
COc1ccc(CN(C)C)cc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1cccc(C)c1C	763841772	SYAXAGFCCLASGE-MRXNPFEDSA-N	442.516	1.927	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)C(=O)Nc1ccn(-c2ccncc2)n1	763850997	SDHFHPSEJVBHAC-OAHLLOKOSA-N	444.451	1.974	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(C)c(C(=O)OC)c2)cc1	763860493	HVAYTCVBVCJURZ-AWEZNQCLSA-N	443.456	1.734	50	20	IDGD	
CC(=O)N1CCc2cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc3ccc(F)cc3)ccc21	763871942	IYGMHUSJNZGQTM-GFCCVEGCSA-N	428.420	1.288	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)cc1C(=O)NC(C)C	763872242	MRKHRLNIUAZKOG-CQSZACIVSA-N	444.463	1.826	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cncnc2N(C)C)cc1OC	763911142	DUIFYICENDDNBB-UHFFFAOYSA-N	430.465	1.130	50	20	IDGD	
CCn1cc(NC(=O)C(=O)NNC(=O)c2ccc(OCCC(C)C)c(OC)c2)ccc1=O	763913792	ARQWPASKPWTOSJ-UHFFFAOYSA-N	444.488	1.701	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2c(C)c(C)nn2C)ccc1OCCC(C)C	763915098	ZGNXHBVMNYLUFX-UHFFFAOYSA-N	431.493	1.870	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)C(=O)Nc1ccc(Br)cc1	763994890	JAVMYSDPQONEME-UHFFFAOYSA-N	430.056	1.939	50	20	IDGD	
Cc1ccc(Cn2nccc2NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)o1	764005284	WOSBDLYYTONPDV-UHFFFAOYSA-N	425.401	1.004	50	20	IDGD	
O=C(CCc1ccccc1)NNC(=O)C(=O)Nc1ccccc1CN1CCSCC1	764186085	VIFCEWKZWHXNJS-UHFFFAOYSA-N	426.542	1.954	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)n(-c2ccccc2)n1	764204382	NDOSHCCJDHXNSP-UHFFFAOYSA-N	444.492	1.572	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)CCCc2ccccc2)ccc1N1CCCC1=O	764223165	CGJUUEZTTXIMJC-UHFFFAOYSA-N	438.484	1.931	50	20	IDGD	
C=CCN(CC=C)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cccc(C#N)c2)cc1	764242508	UQOAWJGXLXYVLI-UHFFFAOYSA-N	431.452	1.772	50	20	IDGD	
CN1CCN(Cc2cccc(NC(=O)C(=O)NNC(=O)c3ccc(O)c(Cl)c3)c2)CC1	764349413	NLVJFLVGQHTCHN-UHFFFAOYSA-N	445.907	1.193	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)c1ccc(CN(C)S(=O)(=O)c2ccc(C)cc2)cc1)N(C)C	764519794	YEKAMCQHTZJSSU-HXUWFJFHSA-N	446.573	1.917	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)[C@H]2CN(C(C)=O)c3ccccc3O2)n[nH]1	765587508	CDNUKIOZAMBLAP-HXUWFJFHSA-N	435.440	1.660	50	20	IDGD	
COc1ccc(OCCC(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)cc1	765747042	ALHDMWLIJOWZSE-UHFFFAOYSA-N	440.544	1.738	50	20	IDGD	
COc1ccc(NC(=O)c2ccc(NC(=O)C(=O)NNc3nccnc3OC)cc2)cc1	766264581	MMFSEMUROPJWFE-UHFFFAOYSA-N	436.428	1.828	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)CS(=O)(=O)Cc1ccc(C#N)cc1	768629681	LGGNUTGZPYSMHP-UHFFFAOYSA-N	437.499	1.028	50	20	IDGD	
C[C@H](CBr)COC(=O)[C@H](NS(=O)(=O)c1ccc(Cl)cc1)[C@H](C)O	770304772	KZNSOUNPUJGNGW-GBIKHYSHSA-N	428.732	1.942	50	20	IDGD	
COCCOc1ccc(CNC(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)cn1	770340801	KNTCLAVRUMKDJA-UHFFFAOYSA-N	430.469	1.533	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)c3nn(-c4ccc(F)cc4)cc3Br)nc21	770981532	ADONSQPAXBOOQP-UHFFFAOYSA-N	447.228	1.913	50	20	IDGD	
COc1ccccc1[C@]1(C)NC(=O)N(CC(=O)NNC(=O)c2ccc(Cl)cc2O)C1=O	771253176	UTRBBFRPARWFAJ-FQEVSTJZSA-N	446.847	1.282	50	20	IDGD	
O=C(Cn1c(=O)ccn(Cc2ccccc2)c1=O)NNc1ccnc(Br)c1	771531054	JGAMWJLDVRMWQY-UHFFFAOYSA-N	430.262	1.359	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)CCC[S@](=O)c1ccc(Br)cc1	772135521	HKWYXKJFDNZYED-FTJNGKRUSA-N	433.324	1.826	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2ccc(C(=O)N3CCSCC3)cc2C)n1	773726080	HKBBFRBFXMGFHY-UHFFFAOYSA-N	430.490	1.064	50	20	IDGD	
COC(=O)CSCc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(C)c(F)c2)c1	773885626	LYMREYYAYLMVQM-UHFFFAOYSA-N	433.461	1.940	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccc(NC(=O)NNC(=O)COc2ccccc2F)nc1	776063386	UASBCZJMJBXGPP-UHFFFAOYSA-N	439.469	1.529	50	20	IDGD	
O=C(NNC(=O)C12CC3CC(CC(C3)C1)C2)N[C@@H]1CCO[C@@]2(CCS(=O)(=O)C2)C1	776073123	JCQJTXVMWUYNLP-YGXMUORHSA-N	425.551	1.270	50	20	IDGD	
C[C@@H](CC(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1)NC(=O)c1ccccc1	776210663	BYHWSJZTGYVCEY-INIZCTEOSA-N	447.536	1.831	50	20	IDGD	
CN(NC(=O)[C@@H]1CCCN1C(=O)C(C)(C)C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776213050	MVKGHAFIZBVLEO-HNNXBMFYSA-N	439.557	1.659	50	20	IDGD	
CC(=O)c1cc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)c(C)nc1C	777167156	OBTYKVDKPOASIW-UHFFFAOYSA-N	437.500	1.120	50	20	IDGD	
CC[C@H](C)Oc1cc(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)ccn1	777425621	DZCUSJNHIXVTLG-INIZCTEOSA-N	447.561	1.952	50	20	IDGD	
COc1cc(C(=O)N2CCN(S(=O)(=O)CBr)CC2)ccc1OC(F)F	777776949	ARMPICYRMBOPLA-UHFFFAOYSA-N	443.266	1.737	50	20	IDGD	
Cc1nc(-c2ccc(F)c(F)c2)sc1C(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1	777975116	GIQNVTKRIUGHRQ-JTQLQIEISA-N	430.458	1.528	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)NC[C@H]2CC(=O)N(C3CC3)C2)cc1Cl	780891023	MQHUDEQFUQVCGP-SNVBAGLBSA-N	425.873	1.704	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2ccc(C(=O)N3CCOCC3)c(Cl)c2)cc1	783039552	RIHCXBQWGYMIHT-UHFFFAOYSA-N	432.864	1.903	50	20	IDGD	
Cc1ccc(-n2nc(C(C)C)cc2NC(=O)C(=O)NN[C@]2(C)CCS(=O)(=O)C2)cc1	783424842	FYNJMVRPPZZAEF-HXUWFJFHSA-N	433.534	1.441	50	20	IDGD	
O=C(NNc1ccc(-n2cccn2)nn1)C(=O)Nc1ccc(OCc2ccncc2)cc1	783437347	YGSJDPDLHGWARC-UHFFFAOYSA-N	430.428	1.718	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2cccc(NC(=O)CN3CCCCCC3)c2)ncn1	783939869	MPHINBFLQFTHFU-UHFFFAOYSA-N	425.493	1.681	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2cc(F)c(I)c(F)c2)ncn1	783947799	KZXDWZMYPSAICU-UHFFFAOYSA-N	433.156	1.750	50	20	IDGD	
O=C(NNC(=O)C(=O)N1CCCC1)C(=O)Nc1cc(C(F)(F)F)ccc1N1CCCC1	784000249	SIHBCTLFLNQRMI-UHFFFAOYSA-N	441.410	1.014	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)C(=O)Nc1ccc(F)cc1-c1ccc(F)cc1	784002887	WJBALTXPNCLJRP-UHFFFAOYSA-N	442.378	1.741	50	20	IDGD	
N#CCOc1cccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)c1	784214776	DMNDQACWDLNPRY-UHFFFAOYSA-N	429.458	1.111	50	20	IDGD	
CCc1ccccc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	784231012	WEWISROTXFZDKR-UHFFFAOYSA-N	445.545	1.267	50	20	IDGD	
Cc1c(NNC(=O)C(=O)Nc2ccccc2S(=O)(=O)C(F)F)cccc1[N+](=O)[O-]	784358213	RUMCJXGIADRAOT-UHFFFAOYSA-N	428.373	1.981	50	20	IDGD	
CNC(=O)c1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)cc1	784835212	HZUMJUGYNFRAFD-UHFFFAOYSA-N	426.401	1.124	50	20	IDGD	
COc1cccc(NNC(=O)C(=O)Nc2cc(C(=O)N3CCSCC3)ccc2C)n1	784846423	SZOVFUUMNBZDDT-UHFFFAOYSA-N	429.502	1.669	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)C(=O)Nc2ccc(CN3C(=O)CSC3=O)cc2)c1	784851215	IZZPVHJUVOPSEF-UHFFFAOYSA-N	442.453	1.750	50	20	IDGD	
O=C(NNc1ccc(Cl)nc1)C(=O)Nc1ccccc1S(=O)(=O)N1CCCCC1	784875111	PYZRMWPTFBEYGY-UHFFFAOYSA-N	437.909	1.991	50	20	IDGD	
COCCCOc1cccc(NC(=O)C(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)c1	785024024	QRAVBNZXCCKRTM-UHFFFAOYSA-N	432.389	1.115	50	20	IDGD	
CS(=O)(=O)NCc1ccc(NC(=O)C(=O)NNc2nc(C(F)(F)F)cs2)cc1	785144951	ACUZRMRGPUKLSQ-UHFFFAOYSA-N	437.425	1.293	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)NNC(=O)c1cnc2c(c1)c(O)nc(=O)n2C1CC1	787431513	DFDMPKXYMWQMLO-UHFFFAOYSA-N	428.836	1.630	50	20	IDGD	
COC[C@@H](c1ccc(Cl)cc1)N(C)C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	787737166	GIXKKZXLOWZFOA-KRWDZBQOSA-N	429.868	1.990	50	20	IDGD	
CC1(C)Cc2cccc(NC(=O)C(=O)NNC(=O)COc3ccccc3[N+](=O)[O-])c2O1	789586036	JCHXYYKOGNQVHK-UHFFFAOYSA-N	428.401	1.473	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)c1ccccc1F)C(=O)NNc1nc2ccccn2n1	791240090	UZZFSRMFTRBSID-ZDUSSCGKSA-N	438.510	1.412	50	20	IDGD	
CC(C)(C(=O)NNC(=O)C(=O)Nc1cccc(N2C(=O)CCCC2=O)c1)c1ccccc1	792356972	WHCSWRPUDSVBTR-UHFFFAOYSA-N	436.468	1.794	50	20	IDGD	
CCOCC(=O)NNC(=O)C(=O)Nc1ccc2c(c1F)CCN(C(=O)OC(C)(C)C)C2	793026743	UMEHSFOWEPYVNI-UHFFFAOYSA-N	438.456	1.241	50	20	IDGD	
N#Cc1c(F)cccc1-n1ccc(NC(=O)C(=O)NNc2ccc3c(=O)[nH]ccc3c2)n1	793066906	ZRVMUVHSQAVMIM-UHFFFAOYSA-N	431.387	1.806	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNC(=O)N1CCC(n2ccc([N+](=O)[O-])n2)CC1	793228051	XSICOHCYEPSUGX-UHFFFAOYSA-N	445.436	1.095	50	20	IDGD	
CC(C)O[C@H](C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1)c1ccccc1	794180696	OIAXKFSIMSNIDF-INIZCTEOSA-N	425.894	1.915	50	20	IDGD	
CC(=O)N1CCCC[C@H]1C(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	794961466	UBAZAKRIRICVTH-FQEVSTJZSA-N	447.499	1.550	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)[C@@H]3CCS(=O)(=O)c4ccccc43)nc21	796367770	SAGWTMRSXZZEPW-GFCCVEGCSA-N	430.490	1.691	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)NCCNS(=O)(=O)c2ccc(Cl)cc2F)cc1	799367110	BICXOXNUHMTHMX-UHFFFAOYSA-N	439.856	1.273	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc(Cn3cc(Br)cn3)on2)cc1	801111216	NMUUNNICHUODIE-UHFFFAOYSA-N	447.249	1.390	50	20	IDGD	
C[C@@H](CCNS(=O)(=O)c1ccccc1)NC(=O)NNC(=O)c1cc2c(s1)CCC2	801796104	IVYHBTHIEVNFJS-ZDUSSCGKSA-N	436.559	1.938	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2ccc(OC(F)F)nc2)cc1	801952827	DWSCGNQLYJVEEN-UHFFFAOYSA-N	443.432	1.465	50	20	IDGD	
O=C(CN1CCN(c2ccccn2)CC1)NNC(=O)Nc1ccc(Br)cc1	801998403	XKVDBEZSXSNXEB-UHFFFAOYSA-N	433.310	1.819	50	20	IDGD	
CN(C(=O)C1CC1)c1ccccc1C(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	802067476	FJVGYPYLHYEJAD-UHFFFAOYSA-N	430.486	1.929	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)CN2C(=O)[C@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2=O)cc1Cl	802077624	WVFAJHWNOKZRAC-CVSRONHPSA-N	448.863	1.317	50	20	IDGD	
Cc1nn(-c2ccccn2)c(C)c1C=NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	802705495	IRQXZQPMZURIEB-UHFFFAOYSA-N	426.502	1.898	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)N2CCC[C@H](CN(C)S(C)(=O)=O)C2)c1C	804184827	FSBNAXQSXCAQKX-BAOGCXAUSA-N	436.578	1.788	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N[C@@H](C)c2n[nH]c(C)n2)cc1	804812658	RCOPJTLTDRLSQK-ATTDUZETSA-N	448.487	1.645	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(CNC(=O)NNc2ccc(-n3ccnc3)nn2)cc1	804870061	NXEGQTKRYGIAQD-UHFFFAOYSA-N	444.521	1.519	50	20	IDGD	
Cc1cc([N+](=O)[O-])ccc1NNC(=O)c1sccc1S(=O)(=O)N1CCOCC1	805380903	CAHYTKDSZWJQEL-UHFFFAOYSA-N	426.476	1.743	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)c1ccc(C(N)=O)c(Cl)n1	806863648	OSOZVHIBEKDYIE-UHFFFAOYSA-N	425.898	1.668	50	20	IDGD	
C[C@H]1CN(c2ccccc2NC(=O)C(=O)NNc2ccc(-n3ccnc3)nn2)C[C@H](C)O1	807429031	OFZBMWZMWDQXDB-GJZGRUSLSA-N	436.476	1.358	50	20	IDGD	
Cn1cncc1C(=O)NNC(=O)CCN1CCN(C(c2ccccc2)c2ccccc2)CC1	809543520	SMPJWCSWJXNRJZ-UHFFFAOYSA-N	446.555	1.978	50	20	IDGD	
COC(=O)c1cc(Br)cc(C(=O)NNC(=O)COc2ccc(C#N)cc2)c1	812531897	ALMKBQNODDLRQR-UHFFFAOYSA-N	432.230	1.947	50	20	IDGD	
Cc1cc2nc(C)c(CCC(=O)NNc3ccc(S(=O)(=O)N(C)C)cc3)c(C)n2n1	812729226	GZATYQZOCXJXGL-UHFFFAOYSA-N	430.534	1.981	50	20	IDGD	
Cc1nc2ccc(NC(=O)C(=O)NNc3ccc(S(=O)(=O)N(C)C)cc3)cc2s1	813034603	RJDBAWTZAFCMKI-UHFFFAOYSA-N	433.515	1.937	50	20	IDGD	
O=C(NNC(=O)C1(S(=O)(=O)c2ccc(F)cc2)CCCCC1)C(=O)Nc1ccccn1	813479894	NMRANCKOPKQBIR-UHFFFAOYSA-N	448.476	1.483	50	20	IDGD	
COC(=O)c1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)c[nH]1	814194010	IRXHTRKLEINLOD-UHFFFAOYSA-N	434.474	1.051	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C2CCC(OC[C@H]3CCCO3)CC2)c2ccccc2c1=O	814730577	QNCKFUTUABQWDA-OFLPRAFFSA-N	442.516	1.932	50	20	IDGD	
CO[C@H]1Cc2ccc(NC(=O)C(=O)NNc3ccccc3S(=O)(=O)N(C)C)cc2C1	815750617	GCSCUGPMFZPEGV-INIZCTEOSA-N	432.502	1.132	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)[C@H](c1ccccc1F)N1CCOCC1	817053694	CILBDYKLKVHGOU-IBGZPJMESA-N	436.509	1.593	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)CN2CCN(c3ccccn3)CC2)c1	818757547	ZMDWVXUIFBQRFQ-UHFFFAOYSA-N	448.321	1.896	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)CCn2c(S)nnc2-c2cccs2)cc1	825549065	IVXKQMQBVLBYEC-UHFFFAOYSA-N	432.531	1.954	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)CN1C(=O)N[C@@]2(C[C@@H](C)CC(C)(C)C2)C1=O	825615293	PXNFNJHHNMZNIH-RCDICMHDSA-N	445.520	1.391	50	20	IDGD	
CCc1cccc(C)c1NC(=S)NNC(=O)Cn1cc(Br)c(O)nc1=O	838294611	FJNCFTHMRHBHCW-UHFFFAOYSA-N	440.323	1.600	50	20	IDGD	
CSc1nc(O)c(C(=O)NNC(=O)COc2ccc(Br)cc2)cc1C#N	913627991	MLDHZNLEOAGCAP-UHFFFAOYSA-N	437.275	1.983	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C2CCN(C(=O)COc3ccccc3)CC2)c1	914837563	NFYWBJOMPZNJAU-UHFFFAOYSA-N	441.484	1.782	50	20	IDGD	
CCOC(=O)c1ccc(C(=O)OCC(=O)NNC(=O)c2cc(Cl)ccc2OC)nc1C	915042312	SFNAKRVTBCTMGD-UHFFFAOYSA-N	449.847	1.847	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NCC1(NS(C)(=O)=O)CCCCC1	916253762	KHJCWOAVYJHIGK-CYBMUJFWSA-N	430.502	1.176	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)N1CCc2sccc2C1	916620235	UNTITUZJIXWARS-ZDUSSCGKSA-N	440.529	1.386	50	20	IDGD	
CNC(=O)NNC(=O)CCN(c1ccc(OC)cc1)S(=O)(=O)c1ccc(C)c(C)c1	919879627	VTKYLLKHPMWWOK-UHFFFAOYSA-N	434.518	1.858	50	20	IDGD	
Cc1nn(C)c2nc(-c3ccccc3)cc(C(=O)NNC(=O)N[C@@H]3CCS(=O)(=O)C3)c12	919889830	VEEYPCPMBKOMRF-CQSZACIVSA-N	442.501	1.075	50	20	IDGD	
O=C(NC[C@H]1CCCCO1)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	920344686	ZROSWYBSZLVLIY-LJQANCHMSA-N	435.488	1.902	50	20	IDGD	
COc1ccc(/C=C(\C#N)C(=O)Nc2ccc(N3CCOCC3)cc2)cc1OCC(N)=O	1248407601	ZHPOEJATIKEBHF-SFQUDFHCSA-N	436.468	1.942	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)c1ccc(N2CCC[C@@H](C(N)=O)C2)cc1	1251217002	KKHZZXOIRWCCIW-GOEBONIOSA-N	428.464	1.756	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H]2CCCN(C(=O)c3ccccc3)C2)c1	1318203778	WVHQIENJOIACKJ-QGZVFWFLSA-N	444.513	1.339	50	20	IDGD	
CCS(=O)(=O)Nc1cccc(C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)c1	1318299657	AXUGYWRJUGQEIU-UHFFFAOYSA-N	438.531	1.646	50	20	IDGD	
Cn1ncc(C(=O)NNC(=O)c2cncn2-c2ccccc2)c1I	1324925118	QMKSPDVTASTBRP-UHFFFAOYSA-N	436.213	1.285	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4c(c3)CCN4C)C2)C1	1777921616	JQMAIYHSTKUOTC-JLTOFOAXSA-N	436.350	1.906	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cn4cccnc4n3)C2)C1	1778480782	RGQQMWBSKTZUFX-ACJLOTCBSA-N	436.310	1.346	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc4cn[nH]c4cn3)C2)C1	1778780333	BRPCNSNBZOQHPO-MSOLQXFVSA-N	426.304	1.638	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(CCN(C(=O)c3cc(-c4ccncc4)[nH]n3)C2)C1	1779591639	UBUWEZZACAHEDO-IBGZPJMESA-N	448.321	1.700	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnn(C)c3Cl)C2)C1	1779857219	ZGHXRMORZSGXIT-ZBEGNZNMSA-N	433.734	1.548	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(=O)nc3cccnn13)C2	1780705668	FGVVHJBVDMSCAS-IUSZMWJPSA-N	447.923	1.234	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cccc(N4CCOCC4)c3)CCO2)C1	1781217402	WEBUMFDNMQHWTN-SIKLNZKXSA-N	435.952	1.984	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(Cl)Cl)C2)c1cnn2c1OCCC2	1781265994	WGXVYIKQBJQROB-FZKQIMNGSA-N	431.320	1.597	50	20	IDGD	
COc1cccc(CC(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](F)Br)C3)C2)n1	1781326374	OCTWCFMQUXFTJF-RDJZCZTQSA-N	430.274	1.153	50	20	IDGD	
O=C(c1nccc2nc[nH]c12)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781331481	QWCHQCOIAYRHNJ-BBRMVZONSA-N	426.246	1.092	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C(=O)c2cccn2C)C1	1782617402	OWAHIKHOXNDXMV-ZXYWRSMDSA-N	440.338	1.505	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(-n4cnnc4)cc3)CCO2)C1	1783533385	UASPLNSKGGWYLO-LIRRHRJNSA-N	448.321	1.494	50	20	IDGD	
C=CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@@]2(CN(C(=O)[C@H](F)Cl)CCO2)C1	1783766660	NEVLFAOZSBIINH-TYILLQQXSA-N	433.908	1.820	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ncn(C)c3C(F)(F)F)CCO2)C1	1783876089	URVOHELUOFEIOR-ZBEGNZNMSA-N	438.834	1.136	50	20	IDGD	
CC#CC[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]2C1)c1ccccc1	1784091496	VXTKQAXIXBAZFZ-SSTJLMRISA-N	432.948	1.763	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc(N(C)C)o3)[C@H]2C1	1785881872	MIDSOBOZTCZMJA-RFGFWPKPSA-N	443.342	1.365	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)C(=O)c1ccccc1	1786342233	DKNDZBWJXHCARH-YXWQFLTLSA-N	427.270	1.540	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccnc(Br)c3)C[C@@H]21)[C@@H](F)Cl	1787446912	ZDBRYLJLQOEFOA-ZJQBRPOHSA-N	434.693	1.972	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(CO)o3)[C@H]2C1	1788905465	OCYSQXVSGJGBGH-ZIEJDFEHSA-N	429.311	1.539	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C3(Br)CC3)C[C@@H]21)[C@@H](F)Br	1789923563	UVDVCGDSQCZDAT-XWLWVQCSSA-N	442.123	1.584	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3CCC[C@H](C(=O)OC)C3)[C@H]2C1	1791247588	LPKHKTYUHMIZBN-PXOUGSPUSA-N	444.956	1.199	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(O)c([N+](=O)[O-])c3)C[C@@H]21	1791256957	MOWXHEXUCCPKLK-ZJOBFFGXSA-N	441.868	1.148	50	20	IDGD	
CC[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2C1)c1ccccc1	1791288820	WEEGENNOGQAKTR-TUFLPTIASA-N	444.576	1.533	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(S(C)(=O)=O)c1	1792695761	FKOUVJQLVPUMPC-FSDCSDTHSA-N	428.938	1.311	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCc1cccc(C#N)c1	1792833898	OIJLFHASLVDXSH-UEILYKACSA-N	434.334	1.864	50	20	IDGD	
CC(C)n1nccc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)CBr	1792870301	BOUNWPXBYJXGAN-AYDFFVQHSA-N	427.343	1.698	50	20	IDGD	
O=C(CN1CCc2sccc2C1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2	1793898195	POTURTQSISELOH-YWVIFJGQSA-N	432.373	1.500	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1nc(C)c(C)[nH]c1=O	1794614363	LKAUDGZESSURCV-XJFOESAGSA-N	425.327	1.812	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccnc1OC	1794728751	GWVZYENMLVYRBM-NEBZKDRISA-N	426.311	1.467	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCc1c[nH]c2ccccc12	1795835183	DVGJIEDXPWIAIK-HPNQWNLUSA-N	433.936	1.944	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(CO)o1	1798797457	ZBRNVXKUYPXDFD-NGYDUSEUSA-N	427.461	1.158	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)[C@@H]1CCCCN1Cc1ccccc1	1799035615	IKQWNPGTUSEZHV-LUYSREMJSA-N	449.979	1.230	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc(O)[nH]1)C2	1800333347	JALNVIHXTHPNMT-XSDCOXNMSA-N	443.410	1.204	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(F)F)C2)[C@@H](Br)Cc1ccccc1	1800436753	PEHZRPQDXCNUOS-XGUBFFRZSA-N	431.277	1.847	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CC(=O)OC(C)(C)C)C2	1800640464	ZEPNHLPNHPPHKZ-OQMKEHIESA-N	433.343	1.481	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C/N=C/c1ccco1)C2	1800641702	HZTAUAQLVGNLKL-ZYYYCMAYSA-N	426.311	1.462	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c(c1)CCN3C)C2	1800758414	ZAXZTMPEAWLHRI-GMLZMKKNSA-N	436.350	1.666	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cnn3cccc(F)c23)[C@H]1c1cccnc1)[C@@H](O)CCl	1803146881	CWFYMLCEXMDGBR-WBAXXEDZSA-N	445.882	1.788	50	20	IDGD	
COc1c(Cl)cccc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(B(O)O)cc1)C2	1803756884	LTALUESVFVSVAZ-BJWYYQGGSA-N	442.708	1.594	50	20	IDGD	
Cc1nocc1C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1	1805823312	CONNYGSRYDQZOD-DNVCBOLYSA-N	449.471	1.010	50	20	IDGD	
CC1=CC[C@H](C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)CC1	1809479245	WHDWOXQZQQQRND-QTGUNEKASA-N	447.344	1.827	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC2(CCCN(C(=O)c3cccc4c[nH]nc34)C2)CC1	1810624193	WLFFXPIAPFNWMS-UHFFFAOYSA-N	440.548	1.781	50	20	IDGD	
Cc1ccc(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)cc1	1811960112	SVQTWKMIBNYEOU-GGAORHGYSA-N	443.312	1.703	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)c2cccn3c(O)nnc23)[C@@H]1c1cccnc1)C(Cl)Cl	1813080619	URCSZQSZPLHLQZ-TZMCWYRMSA-N	449.298	1.953	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3nccc4nc[nH]c34)sc2C1	1816902214	RWWHOWDUJNTDGY-ZJUUUORDSA-N	434.909	1.894	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)Cc2cccnc2)n[nH]1	1817623880	ZXHFIXXMQWZCMB-KRWDZBQOSA-N	427.509	1.413	50	20	IDGD	
CNC(=S)NCCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](C)Br)CC2	1819810447	DWWXEMXRSHRHHD-BDAKNGLRSA-N	448.412	1.323	50	20	IDGD	
Cc1ccc(=O)n(C(C)(C)C(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@@H](F)Cl)CC3)n1	1820090138	XXMHZTDTUOKLMW-QMTHXVAHSA-N	441.916	1.890	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](C)O)[nH]n1	1820167067	WBJOBBPNZIMUPY-ZBEGNZNMSA-N	445.432	1.930	50	20	IDGD	
Cc1ccc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)CCC(=O)NN(C)C)CC3)c(C)n1	1821090537	OFROSCJWOLSTQX-CQSZACIVSA-N	444.561	1.754	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CN(C)C(=O)C(=O)O)n[nH]1	1821712978	IESJZTMYUGHPNG-DGCLKSJQSA-N	427.889	1.352	50	20	IDGD	
O=C(Cn1cccc([N+](=O)[O-])c1=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](F)Cl)[nH]n1	1821736970	HMUUNDXEBIYZOJ-XHDPSFHLSA-N	440.819	1.706	50	20	IDGD	
O=C(N[C@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1)c1ccnnc1O	1823006848	IWYFXHOQPZMDFU-WKEGUHRASA-N	430.259	1.555	50	20	IDGD	
C[C@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H]3CCC(=O)N3C)sc2C1	1823053913	DMNJPWCAXLTTLF-QXEWZRGKSA-N	429.340	1.459	50	20	IDGD	
O=C(c1cccn2c(O)nnc12)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)CC1	1824183324	UMRHICSNBVWPHU-HOTGVXAUSA-N	435.912	1.268	50	20	IDGD	
Cc1[nH]nc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)c1F	1825607095	YQDCSEXMLUSWSH-GOSISDBHSA-N	442.300	1.084	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1n[nH]cc1[N+](=O)[O-])CC2	1825642097	NZLQIONNMIINTN-BQBZGAKWSA-N	443.283	1.784	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@H]1CCc2nc(NC(=O)c3cc(F)c[nH]3)sc2C1	1825736350	CEGUSHJCNTXWOX-JTQLQIEISA-N	443.464	1.148	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)c2cnccc2F)CC1	1827321318	ZOLOYGMZMYPULP-NRFANRHFSA-N	439.296	1.448	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnc[nH]2)CC1	1827680748	GVHQWKJJEPWQDP-CRXVIZHGSA-N	439.520	1.777	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cncnc2)CC1	1828924994	AELFGVFSCKSKAJ-IBGZPJMESA-N	437.504	1.022	50	20	IDGD	
Cc1cc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)CC2)no1	1828925691	PFOFWWCQJMKDTB-LJQANCHMSA-N	440.504	1.529	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3Cc4ccccc4CN3)C2)C1	1830358806	ZVTDFEJXIILHBU-XXBNENTESA-N	449.979	1.422	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4cccnn4n3)C2)C1	1830365382	XACFXRZVJLDUOI-HXUWFJFHSA-N	435.912	1.064	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4cccnn4c3)C2)C1	1830366860	YAGXJHKNHLVFJI-NRFANRHFSA-N	434.924	1.669	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)C(C)=O)CCO2	1831130973	RMOKEWJFIWFYII-KBXCAEBGSA-N	433.343	1.232	50	20	IDGD	
C[C@@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)c3ccno3)CC2)CC1	1833262305	MYJOAJNKTFZIJM-ZDUSSCGKSA-N	427.343	1.891	50	20	IDGD	
N#CCc1ccc(C(=O)N2CCC(N3CCC(NC(=O)[C@H](O)CCl)CC3)CC2)cc1	1833313766	QDDWWWLPGBCIKD-HXUWFJFHSA-N	432.952	1.538	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3noc(C)c3C)CC2)CC1	1833605924	KAQPKQNYUMVXMA-KRWDZBQOSA-N	426.945	1.730	50	20	IDGD	
C[C@@H](C(=O)NC1CCN(C2CCN(C(=O)[C@@H](F)Cl)CC2)CC1)n1cccc1C=O	1834806933	VGKQYWFETAMBFI-KBXCAEBGSA-N	426.920	1.968	50	20	IDGD	
O=C(CCc1ccco1)N1CCOC[C@@]2(C1)CN(C(=O)CCBr)CCO2	1834819148	HXSFPMRZSFXUDV-GOSISDBHSA-N	429.311	1.454	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)COc3ccccc3)C2)C1	1834822513	RVYUKOIRBKIXDP-IBGZPJMESA-N	441.322	1.307	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CN(C)C(=O)OC(C)(C)C)CCO2)C1	1835210482	QGHHENMTAPCPJH-QRWLVFNGSA-N	447.960	1.327	50	20	IDGD	
C[C@@H](Nc1ccccn1)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1835846082	MYKAVIOGAYPJLQ-QAPCUYQASA-N	437.972	1.053	50	20	IDGD	
CC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)c3ccnn3CCOC)CC2)CC1	1836393934	CLHCRHNAIQQRSX-SFHVURJKSA-N	439.988	1.732	50	20	IDGD	
O=C(c1cn2ccsc2n1)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1837051770	ITSJYEDDIVKLBO-MRXNPFEDSA-N	433.317	1.270	50	20	IDGD	
CCc1nc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)co1	1838138773	IRCJUTBHJUMTFR-PXAZEXFGSA-N	430.299	1.090	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3nccnc3C)CCO2)C1	1838216088	BBLPHIKCEPAKOO-KDOFPFPSSA-N	441.326	1.029	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(C#N)c[nH]3)CCO2)C1	1838738917	GDNFPJVKDKXSTJ-QZTJIDSGSA-N	429.304	1.193	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(O)n3)C2)C1	1839151342	OKZRZRNTNYWMEF-ROUUACIJSA-N	432.304	1.094	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3[C@H]4C=CS[C@H]43)C2)C1	1839155146	KLUZMZQLCNTEKO-QVXTZCDOSA-N	435.373	1.554	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(F)cn3C)C2)C1	1839964620	XKHAIQHQUGWXDT-RDTXWAMCSA-N	446.317	1.408	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccoc3Cl)C2)C1	1840034470	MLJLBPGVPCBYAJ-ZBEGNZNMSA-N	435.702	1.786	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cccc(F)c3)C2)C1	1840151702	LRSOHWGVILLWNY-PXNSSMCTSA-N	428.888	1.078	50	20	IDGD	
O=C(C(Cl)Cl)N1CCO[C@]2(COCCN(C(=O)[C@]3(F)CCCC=C3F)C2)C1	1840190454	YHGWCKKGXMQSCT-SJORKVTESA-N	427.275	1.992	50	20	IDGD	
COC1(CC(=O)N2CCO[C@@]3(COCCN(C(=O)CCBr)C3)C2)CCC1	1840615038	PKPYQTXBMJQCQB-GOSISDBHSA-N	433.343	1.187	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CCCSC1)CCO2	1840865381	YSBUUYUYNHLMGE-LPHOPBHVSA-N	430.643	1.438	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)Cc2ccc(S(C)(=O)=O)cc2)C1	1842811536	RCIDHBBXIUJBGI-MRXNPFEDSA-N	428.938	1.090	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)Cc1c(F)cccc1F)C2	1843416565	YAOIGWNMYRTQDK-VULFUBBASA-N	443.454	1.845	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)c2cc(Cl)c(F)cc2F)C1	1845299418	KNCNMTGQDRDOAG-UHFFFAOYSA-N	434.635	1.429	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC12CN(C(=O)[C@@H](C)[C@H]1SC(=N)NC1=O)C2	1846070071	MYIBRVCVEWHIED-GARJFASQSA-N	431.356	1.166	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@H]1C[C@@H](F)CN1C(=O)OC(C)(C)C)C2	1846362709	SEYSIAVXGDWNFM-ILXRZTDVSA-N	447.935	1.791	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)c1cc(OC)c(OC)c([N+](=O)[O-])c1)C2	1846363865	INCKUMPQCRNMNB-CYBMUJFWSA-N	441.868	1.683	50	20	IDGD	
O=C(Cc1cc(F)ccc1Br)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl	1847556285	HBVRNSRMOQLQTI-SOUVJXGZSA-N	433.705	1.932	50	20	IDGD	
CSc1nc2nc(C)c(CC(=O)NNC(=O)[C@@H](C)Oc3ccccc3F)c(C)n2n1	25257586	DOIJJXXUUXVNDJ-GFCCVEGCSA-N	432.481	1.760	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)c2ccnc(OCc3ccccc3)c2)c2ccccc2c1=O	115703217	RHRMKEZQSYZEDE-UHFFFAOYSA-N	429.436	1.982	50	20	IDGD	
COCCCNC(=S)N(C)NC(=O)c1cccc(S(=O)(=O)N2CCCCCC2)c1	726076819	FIMOIKGIBSIWCK-UHFFFAOYSA-N	442.607	1.739	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)NCCSC)c1	726278022	AKESHIMHRKBGPN-UHFFFAOYSA-N	438.531	1.803	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NCc1ccc([C@@]2(C)NC(=O)NC2=O)cc1	726283126	WZSKBZPBPITBCO-LAJNKCICSA-N	443.435	1.178	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)c1	728214154	ZCVVVSXBMBYGBT-UHFFFAOYSA-N	434.518	1.397	50	20	IDGD	
C[C@H]1C[C@H](C)CN(S(=O)(=O)c2ccc(S(=O)(=O)NNC(=O)NCC3CC3)cc2)C1	728262276	BULXYGCUTBBNRI-KBPBESRZSA-N	444.579	1.256	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)CCc2nc(O)c3cnn(C)c3n2)c1	728527568	NFFQRQZGVBFEKC-UHFFFAOYSA-N	449.265	1.234	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)Cc2nc(-c3ccccc3)oc2C)n1	728721049	TZTSTMIRFNNADP-UHFFFAOYSA-N	428.470	1.891	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)NCCNC(=O)c2ccco2)c1	728742964	VQISCRMADIACAU-UHFFFAOYSA-N	425.239	1.425	50	20	IDGD	
CCc1ccccc1O[C@@H](C(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1)c1ccccc1	730535540	QHRQKHRACMSECI-PKOBYXMFSA-N	431.514	1.887	50	20	IDGD	
CC(=O)N1CCN(C(=O)CCNC(=O)NNc2ncc(C(F)(F)F)cc2Cl)CC1	730827094	GUAYMOCJTYQGRM-UHFFFAOYSA-N	436.822	1.461	50	20	IDGD	
O=C(CCCS(=O)(=O)c1ccc(Br)cc1)NNC(=O)c1ccccn1	730997300	PZUVBEDVKCUBFM-UHFFFAOYSA-N	426.292	1.859	50	20	IDGD	
O=C(NNC(=O)c1csc(-c2ccc3c(c2)OCCO3)n1)c1ccc(-n2cnnn2)cc1	731343074	DFDXBSPGYBPXCV-UHFFFAOYSA-N	449.452	1.632	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(CNC(=O)NNC(=O)Cc2ccccc2F)s1	731359430	UBDBSQTZWFOHTK-UHFFFAOYSA-N	442.538	1.991	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)N1CCN(CC(=O)NC2CCC(C)CC2)CC1	731499069	IVSJNMDXGNRVRW-UHFFFAOYSA-N	431.537	1.362	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)c1	731960015	WDHBQHDZWKFXAA-AWEZNQCLSA-N	431.474	1.788	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2c[nH]c3ncccc23)cc1Br	732048558	NXLVXVOTNMRODQ-UHFFFAOYSA-N	425.264	1.957	50	20	IDGD	
CNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2ccc(OC)c(Br)c2)o1	732173929	MSYJUCZREPIQGD-UHFFFAOYSA-N	432.252	1.034	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)N[C@@H](Cc1ccccc1)CN1CCOCC1	732476399	HPAPXQDJXLYQJB-NRFANRHFSA-N	435.528	1.915	50	20	IDGD	
COC(=O)c1ccc(Cl)cc1S(=O)(=O)NNC(=O)c1cnn(-c2ccccc2)c1	733122904	HNDQZJWSVIMZRZ-UHFFFAOYSA-N	434.861	1.936	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCCNC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1	733337009	FNACYHQSPUMJOP-UHFFFAOYSA-N	442.501	1.103	50	20	IDGD	
Cc1ccc([C@@H](CNC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)N2CCOCC2)o1	733642060	UTOKPWFHXZOAAR-LJQANCHMSA-N	438.488	1.791	50	20	IDGD	
C#CCOc1ccccc1CNC(=O)NNC(=O)c1sc(N2CCOCC2)nc1C	734162715	HNXIBMHAHJAVOL-UHFFFAOYSA-N	429.502	1.444	50	20	IDGD	
C[C@@H]1Cc2cc(S(=O)(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)cc(Cl)c2O1	736063926	OCUKVSQILKBEAZ-SNVBAGLBSA-N	434.865	1.262	50	20	IDGD	
O=C(NNc1cccc(C(F)(F)F)n1)c1cc(S(=O)(=O)N2CCSCC2)c[nH]1	740132250	DQCPKZCJZOLWJR-UHFFFAOYSA-N	435.453	1.923	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)nc2nc(O)nc(O)c12	740749169	ONDOTQHBLZTOOJ-UHFFFAOYSA-N	449.427	1.110	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNS(=O)(=O)c1c(OC)ccc2nc(Cl)ccc12	740812603	QQEHNCKQZCTRSG-UHFFFAOYSA-N	428.898	1.511	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)Cc1ccc(S(=O)(=O)CC(F)(F)F)cc1	740851253	WIRLXCUGATVHKY-UHFFFAOYSA-N	437.440	1.017	50	20	IDGD	
CCc1c(C(=O)NNC(=O)Cn2nc(C)cc2C)nnn1-c1ccc(OC(C)C)cc1	741207672	QBDDUUWWRLYDQR-UHFFFAOYSA-N	425.493	1.891	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNS(=O)(=O)c1cc(F)c(F)c(F)c1	741645640	BQHLZGHLVNGWII-UHFFFAOYSA-N	436.437	1.329	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)CSc2nnc(-c3ccc(Cl)cc3)n2N)cc1	742444584	HNGCQYKCGVLPDO-UHFFFAOYSA-N	427.877	1.737	50	20	IDGD	
COc1cccc(N2CC[C@H](NC(=O)NNC(=O)Nc3ccc(S(C)(=O)=O)cc3)C2)c1	743587084	LNMQYOYSOFPNPH-HNNXBMFYSA-N	447.517	1.713	50	20	IDGD	
C[C@@H]1C[C@H](NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)C(=O)N1c1ccccc1	743589403	UEWVWIDNGWWCOI-QAPCUYQASA-N	437.504	1.217	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccc(Cl)cc3F)CC2)cc1	744396820	RMPLNZQDCGPJOV-UHFFFAOYSA-N	443.866	1.570	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)CCc2nc(-c3cccs3)no2)cc1	744525663	GPGRXMBAKBKQEV-UHFFFAOYSA-N	425.426	1.607	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)c2ccc([N+](=O)[O-])cc2Br)c1	745071128	AKZOJMMNIXWWLS-UHFFFAOYSA-N	447.201	1.847	50	20	IDGD	
CO[C@@]1(C)C[C@@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)C1(C)C	745934876	CWKIUNFOUOAYSB-UZLBHIALSA-N	438.550	1.619	50	20	IDGD	
COc1ccc2c(c1)OC[C@@H](C(=O)NNC(=O)c1sc(N3CCOCC3)nc1C)C2	747412551	TVUUSQFGQKYEMU-AWEZNQCLSA-N	432.502	1.309	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2cc3c(s2)CC[C@H](C)C3)cnc2c1c(=O)n(C)c(=O)n2C	747725808	RXQXZQVRIHTOKQ-JTQLQIEISA-N	441.513	1.202	50	20	IDGD	
COc1ccc(S(=O)(=O)NCCC(=O)NNc2cc(Cl)nc(C)n2)cc1OC	747982814	DNXGQHLGFOWURQ-UHFFFAOYSA-N	429.886	1.267	50	20	IDGD	
COc1ccccc1OCCC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	748611968	VYQZIHVFDKHKLW-UHFFFAOYSA-N	448.545	1.544	50	20	IDGD	
CO[C@H](C)c1noc(CN2CCCN(CC(=O)NNC(=O)c3ccc(C)cc3)CC2)n1	750059241	FBWHEGICZNLPSN-MRXNPFEDSA-N	430.509	1.054	50	20	IDGD	
CCN(CC)C(=O)[C@H](NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)c1ccccc1	750737087	KAMQBIOOWQIZSK-LJQANCHMSA-N	432.546	1.781	50	20	IDGD	
O=C(CCSc1ccc(F)cc1)NNC(=O)C1CCN(c2ccc3nncn3n2)CC1	751292293	FANDCUGENMIYGU-UHFFFAOYSA-N	443.508	1.810	50	20	IDGD	
Cc1ccc(-c2nnc(S)n2CC(=O)NNC(=O)CCN2C[C@@H](C)O[C@H](C)C2)cc1	751426890	WRYYSRGWRGLNFX-HUUCEWRRSA-N	432.550	1.189	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCc2ccc([S@@](C)=O)cc2)nc1	753049573	HNNBDVBWTBLTSD-MUUNZHRXSA-N	439.563	1.676	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](n2cc(C(=O)NNc3ncnc4[nH]cnc34)cn2)C1	753415269	BQRCUHXGAKFVCV-ZDUSSCGKSA-N	427.469	1.878	50	20	IDGD	
CCOc1ccc(NC(=S)NNC(=O)c2cnn3c2C[C@@H](CNC(C)=O)CC3)cc1	754174652	SGWDDNWPIPZHKK-AWEZNQCLSA-N	430.534	1.612	50	20	IDGD	
Cc1oc(C(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)cc1S(=O)(=O)N(C)C	754176694	DXFVTRCOBZLVLY-UHFFFAOYSA-N	443.865	1.110	50	20	IDGD	
CC[C@H](C)C(=O)NNC(=O)Nc1ccc(S(=O)(=O)N2CCC[C@H](C(=O)OC)C2)cc1	755559293	SJBBNOFIWPCXCR-KBPBESRZSA-N	440.522	1.459	50	20	IDGD	
COc1ccc(Br)c(C(=O)NN=Cc2cnc(N3CCN(C)CC3)nc2)c1	755699711	UBYMPZILGDUENU-UHFFFAOYSA-N	433.310	1.763	50	20	IDGD	
C=CCN(C)S(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1	755934464	VGMRVOCXPHLCED-SFHVURJKSA-N	446.485	1.486	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)Nc1cc(OC)ccc1I	756278078	FKRCSNUILLGEOU-SECBINFHSA-N	437.234	1.504	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)Nc1cccc(C(=O)N2CCc3ccccc32)c1	756294151	MTIFDMVKPHTOPX-MRXNPFEDSA-N	442.497	1.477	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)Nc1ccc(OC)c(-n2nnnc2C)c1	756318465	IHXSNUUZENPDMY-UHFFFAOYSA-N	441.448	1.610	50	20	IDGD	
CCN(CC)C(=O)Cn1ccc2cc(NC(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)ccc21	756395136	HKEGHIOARGQRAJ-OAHLLOKOSA-N	449.533	1.097	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)Nc2ccc(OC)c(-n3cnnn3)c2)cc1OC	756744954	DVCVPBIDKSJEJL-UHFFFAOYSA-N	441.448	1.935	50	20	IDGD	
O=C(NNC(=O)N1CCOCC1)[C@@H]1CCC(=O)N1Cc1ccc(Br)cc1	756820696	VWCXVXBAZHZRMA-AWEZNQCLSA-N	425.283	1.013	50	20	IDGD	
NC(=O)c1ccc(NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c(F)c1	756822009	ZHYPNULPHRGZSR-UHFFFAOYSA-N	449.464	1.176	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)nc1)Nc1cc(C2CC2)nn1[C@@H]1CCS(=O)(=O)C1	756857345	VLIZVJMJXXHMJF-GFCCVEGCSA-N	438.897	1.635	50	20	IDGD	
CCOC(=O)c1cc(Br)cc(S(=O)(=O)NNC(=O)c2ccccc2O)c1	756927424	DGHOLCRMCGLIOH-UHFFFAOYSA-N	443.275	1.955	50	20	IDGD	
CCc1ccc(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1CC	756929706	LBXHZWRJPAHPKM-UHFFFAOYSA-N	439.559	1.685	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCc2ccc3c(c2)CCS3(=O)=O)cc(OC)c1OC	757724220	YMMSBQNKPISIQZ-UHFFFAOYSA-N	449.485	1.186	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1S(=O)(=O)NC1CC1	757864728	DDDAYPLKELUKQX-QGZVFWFLSA-N	446.485	1.428	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2ccc(NNC(=O)c3cn(C)cn3)c([N+](=O)[O-])c2)cc1	758034057	CDUFNJPSSJRNRW-UHFFFAOYSA-N	446.445	1.895	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)cc1NC(=O)Nc1ccccc1	758034292	FUUCVILWGYVWTB-CYBMUJFWSA-N	433.490	1.338	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CCCCCC[C@@H]1C(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1	758184272	OLVZIZYIKDLFNV-SOUVJXGZSA-N	446.570	1.368	50	20	IDGD	
O=C(c1cc(O)nc2cc(F)ccc12)N1CCN(S(=O)(=O)CBr)CC1	758535253	NMENKCBMJVSNEL-UHFFFAOYSA-N	432.271	1.520	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN1C(=O)c1ccc2ccccc2c1O)C(=O)Nc1ccccn1	759098440	GKTDGYVOYFRCQU-QGZVFWFLSA-N	447.451	1.331	50	20	IDGD	
COc1cccc(/C=C(\C#N)C(=O)OCC(=O)Nc2cc(S(N)(=O)=O)ccc2C)c1	759872556	VANUTRKOAZQHDP-OVCLIPMQSA-N	429.454	1.740	50	20	IDGD	
CCS(=O)(=O)c1ccc(C(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)c(N)c1	761248099	HUTHTXMVDKXEFX-UHFFFAOYSA-N	439.877	1.334	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCC2CN(C(=O)OC(C)(C)C)C2)cc(OC)c1OC	762530517	YOZDHLKILMDIQY-UHFFFAOYSA-N	438.481	1.523	50	20	IDGD	
CCOC(=O)c1cnn2c(C(=O)NNC(=O)c3ccc(Br)s3)ccnc12	763464742	CMANEXHFQIBBAK-UHFFFAOYSA-N	438.263	1.805	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)NC1CCN(CC(F)(F)F)CC1	763484040	DXJMKMZITCKXNJ-UHFFFAOYSA-N	425.452	1.648	50	20	IDGD	
O=C(NNC(=O)c1cccnc1)C(=O)Nc1ccc(NC(=O)C2CC2)cc1C(F)(F)F	763488963	SCXOYKOKCIXGDJ-UHFFFAOYSA-N	435.362	1.849	50	20	IDGD	
CC(=O)Nc1cc(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)ccc1Cl	763570913	HANFLEHFFRHDOR-INIZCTEOSA-N	432.820	1.224	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C(C)(C)C)cc2)c(N(C)C)n1	763594071	GHLOADUVFYPFDQ-UHFFFAOYSA-N	427.505	1.918	50	20	IDGD	
COC(=O)c1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)COc1cc(C)cc(C)c1	763648048	SMZKKXQIKAJTPI-UHFFFAOYSA-N	433.848	1.908	50	20	IDGD	
COC(=O)[C@H](C)Cc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C)c(C)c2)cc1	763679179	HUDHNCVTRIUJIQ-MRXNPFEDSA-N	441.484	1.820	50	20	IDGD	
CS(=O)(=O)Cc1ccccc1NC(=O)C(=O)NNC(=O)CC12CC3CC(CC(C3)C1)C2	763735421	NPIFVAAFEILJOE-UHFFFAOYSA-N	447.557	1.924	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)C(=O)Nc2cnn(-c3ccccc3Cl)c2)c1	763757627	IMOKUKDXCANFHF-UHFFFAOYSA-N	426.864	1.991	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)NC(=O)CS3)c1	763772329	LIGNQKXGTFMAGI-UHFFFAOYSA-N	430.442	1.148	50	20	IDGD	
COC(=O)[C@H](C)Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCC3)cc1	763782337	BLOMYBLMHVYRPI-GFCCVEGCSA-N	429.498	1.988	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccc(N2CCSCC2)cc1	763849530	JZXJNIXNLNWLKE-CQSZACIVSA-N	446.504	1.932	50	20	IDGD	
C#CCOc1ccc(F)cc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccc(OCC)cc1	763859779	FWMMEWGTJNFABU-AWEZNQCLSA-N	443.431	1.790	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(NC(C)=O)ccc2OC)cc1OC	763901889	KYYNEWHQIPYPRG-UHFFFAOYSA-N	444.444	1.461	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ccc(OCC)c(OC)c2)cn1C	763902088	NAICIXCGWGPDNZ-UHFFFAOYSA-N	432.433	1.009	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(S(C)(=O)=O)cc2C)cc1OC	763902793	XRIFJOJPJRDDOW-UHFFFAOYSA-N	449.485	1.206	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2c(F)cccc2-n2cccn2)cc1OC	763902866	YTCTZPFPTXQZML-UHFFFAOYSA-N	441.419	1.818	50	20	IDGD	
CN(c1ccccc1)S(=O)(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2ccc[nH]2)c1	763978765	DMHYSGWTAGAVQO-UHFFFAOYSA-N	441.469	1.240	50	20	IDGD	
COc1ccc(OC(F)F)c(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)c1	763994506	DPZGGJRVVPSOCG-UHFFFAOYSA-N	447.192	1.787	50	20	IDGD	
CC(C)(C)NC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)c1	764006270	NQORQEPBPLXJJC-UHFFFAOYSA-N	440.456	1.386	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)c1cncc(I)c1	764043804	WZURYTPDXKQRLF-UHFFFAOYSA-N	429.239	1.945	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccccc2OC2CCCC2)c1	764076702	FLLRBZVWZPBXLL-UHFFFAOYSA-N	445.497	1.811	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)C(=O)Nc1ccc(N2CCSCC2)cc1	764241858	MMDFIAABWZOFGS-UHFFFAOYSA-N	437.525	1.981	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2scnc2C)cc1OCC(F)(F)F	764246322	NOEROLOHTBISKX-UHFFFAOYSA-N	432.380	1.801	50	20	IDGD	
Cc1ncsc1C(=O)NNC(=O)C(=O)N1C[C@@H](CC(=O)N(C)C)c2cc(Cl)ccc21	764248076	YVBJPOGMXLRSTR-LLVKDONJSA-N	449.920	1.475	50	20	IDGD	
CC(C)[C@@H](C)N1Cc2cccc(NC(=O)C(=O)NNC(=O)COc3ccccc3O)c2C1	764275783	UUOMCUGHXNAFJH-OAHLLOKOSA-N	440.500	1.917	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)Cc2cc[nH]n2)sc2c1CC[C@H](C)C2	764285802	MIJKEQXYDHURPA-JTQLQIEISA-N	433.490	1.101	50	20	IDGD	
C[C@@H](NC(=O)c1n[nH]c2ccccc12)C(=O)NNc1c(F)cc(C(=O)NC2CC2)cc1F	764333594	WUAOIEQJLLCUGX-SNVBAGLBSA-N	442.426	1.995	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(C)o2)c(OCC(F)(F)F)c1	764368150	RYKSTZSGNUSGBL-UHFFFAOYSA-N	443.334	1.715	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccccc2-n2cc(Br)cn2)o1	764371864	NXAFPWAXMPADDQ-UHFFFAOYSA-N	432.234	1.936	50	20	IDGD	
Cc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NNC(=O)C(F)(F)Oc1ccccc1	764378084	JHCQLNZLZLTLPJ-UHFFFAOYSA-N	434.399	1.455	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1)C(=O)Nc1c[nH]nc1-c1ccccn1	764388289	QFDLVKUEVAEFBB-UHFFFAOYSA-N	434.391	1.401	50	20	IDGD	
CCOc1ccc(Cl)cc1C(C)=NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C	764819893	WZUIDPMKNUKRDM-UHFFFAOYSA-N	432.868	1.026	50	20	IDGD	
Cc1nc2[nH]n(C)c(=O)c2c(C)c1CCC(=O)NNC(=O)CCCNC(=O)OC(C)(C)C	765312848	DPPJKFZVUCJQDN-UHFFFAOYSA-N	448.524	1.263	50	20	IDGD	
CC(C)(C)OC(=O)N[C@]1(C)CCCC[C@@H]1C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	765542878	SPEUUIGSOIFFCQ-IIBYNOLFSA-N	443.508	1.897	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)CCc2nc(-c3ccncc3)no2)n[nH]1	765596710	XKNNHUYQXUSCIB-UHFFFAOYSA-N	433.428	1.924	50	20	IDGD	
O=C1CN(C(=O)c2ccc(CNC(=O)NNc3ncnc4ccsc34)cc2)CCN1	765674673	BCBFBFBLEXHOLM-UHFFFAOYSA-N	425.474	1.090	50	20	IDGD	
C[C@H](Cc1cccc(F)c1)C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765738331	JTDNOUDBTGIGIQ-QGZVFWFLSA-N	426.492	1.610	50	20	IDGD	
CC(CC(=O)NNC(=O)c1cccc(C#N)c1)CC(=O)NNC(=O)c1cccc(C#N)c1	766608915	MIVPJWNZOHSYTD-UHFFFAOYSA-N	432.440	1.068	50	20	IDGD	
O=C(CSc1nncs1)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	766661852	ZNWABEQYJUGIBO-UHFFFAOYSA-N	440.982	1.249	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H]2CCCc3c[nH]nc32)c1	767226249	FTTSTSUIPJVZBY-MRXNPFEDSA-N	434.522	1.462	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)C1	767778921	FPMNVXHSAWDPLI-PBHICJAKSA-N	435.477	1.390	50	20	IDGD	
CN(C)CC(=O)NNC(=O)CSc1nnc(COc2ccccc2)n1-c1ccccc1	767945889	DFYZTCZOALSMPZ-UHFFFAOYSA-N	440.529	1.647	50	20	IDGD	
O=C(NNC(=O)c1ccncc1)C(=O)Nc1ccc(Cc2nnc3n2CCCCC3)cc1	768233891	OXRYVBJIHGWLJV-UHFFFAOYSA-N	433.472	1.390	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)C(=O)c3cnn(C(C)(C)C)c3)n[nH]2)cc1OC	768280387	ZENXQZLZIJNILC-UHFFFAOYSA-N	440.460	1.689	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)Sc1nnc(-c2cc(-c3ccc(OC)cc3)[nH]n2)n1N	768451837	KIHFFRMAJBPRCG-SNVBAGLBSA-N	430.494	1.096	50	20	IDGD	
CCCCCCn1cc(S(=O)(=O)NNC(=O)c2cccc3cccnc23)c(O)nc1=O	769623004	DUUXRJZNDFNKMH-UHFFFAOYSA-N	445.501	1.701	50	20	IDGD	
CCCOc1cccc(CC(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)c1	770123653	XRYPSAQRZNOTQV-UHFFFAOYSA-N	425.894	1.780	50	20	IDGD	
COc1cc2c(c(OC)c1OC)CCN(CC(=O)NNC(=O)c1ccc(F)cc1)CC2	770250986	KQISNGLCLTXJTP-UHFFFAOYSA-N	431.464	1.713	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)N[C@H]1CC(=O)N(c2c(F)cccc2F)C1	770835117	LIYNOZAWPRAWOG-LBPRGKRZSA-N	432.383	1.486	50	20	IDGD	
COc1cc(C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)ccc1OC(C)=O	772007793	KULUWLFDQQGYPL-UHFFFAOYSA-N	431.357	1.147	50	20	IDGD	
NS(=O)(=O)c1cccc(N2C[C@H](C(=O)NNc3ncc(Cl)cc3Cl)CC2=O)c1	775269309	HIHXPYZGXCMIKN-SECBINFHSA-N	444.300	1.532	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)c2ccc3c(c2)C(=O)N(C[C@@H]2CCCO2)C3=O)c1	776533235	AOYJCEXXZIKGCC-HNNXBMFYSA-N	443.481	1.622	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NC[C@H]2COC3(CCCCCC3)O2)c2ccccc2c1=O	777764148	LLRKIHXPMNOFRM-AWEZNQCLSA-N	429.477	1.343	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)C2(OC)CCN(C(=O)OC(C)(C)C)CC2)nc1C	778421108	GHVZMAVFCPQWCX-UHFFFAOYSA-N	437.497	1.821	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)c1nn(-c2ccc(OC)cc2)cc1O	779490827	FFUHHWQJEFPNKL-UHFFFAOYSA-N	434.456	1.960	50	20	IDGD	
C[C@@H]1C(=O)CC[C@H](C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)C1(C)C	780154820	DLBMSFLCPVWWJK-RHSMWYFYSA-N	435.546	1.874	50	20	IDGD	
Cc1c(NC(=O)[C@H](C)SCC(=O)NN=c2cc[nH]cc2)c(=O)n(-c2ccccc2)n1C	780754777	AWKGYPCPZPSCIO-HNNXBMFYSA-N	440.529	1.505	50	20	IDGD	
Cc1cc(F)ccc1NNC(=O)C(=O)Nc1cccc(S(=O)(=O)N2CCOCC2)c1	783446254	NDDBAXNLJMYDRM-UHFFFAOYSA-N	436.465	1.237	50	20	IDGD	
NS(=O)(=O)c1cccc2c(C(=O)NNC(=O)CSc3ccccc3O)nccc12	783598238	RIJSPQUJJWCQBK-UHFFFAOYSA-N	432.483	1.141	50	20	IDGD	
O=C(NNC(=O)C(=O)N1CCCC1)C(=O)Nc1cccc(COc2cccc(F)c2)c1	783999846	LERXUFXMYMYMNJ-UHFFFAOYSA-N	428.420	1.113	50	20	IDGD	
CCc1cccc(Oc2ccc(NC(=O)C(=O)NNC(=O)C(=O)N3CCCC3)cn2)c1	784000184	PWJCSMBKIOIGPZ-UHFFFAOYSA-N	425.445	1.145	50	20	IDGD	
O=C(NNc1nccnc1Cl)C(=O)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1	784778367	WVKWDXRZGGCNMJ-UHFFFAOYSA-N	438.897	1.386	50	20	IDGD	
Cc1nn(-c2ccccc2)c(C)c1NC(=O)C(=O)NNc1cccc(S(C)(=O)=O)c1	784841048	ACQJNRUWBOXGLG-UHFFFAOYSA-N	427.486	1.974	50	20	IDGD	
COC(=O)CSCc1cccc(NC(=O)C(=O)NNc2ccc(C(F)(F)F)nn2)c1	784886314	NWESHTRIISQVSX-UHFFFAOYSA-N	443.407	1.983	50	20	IDGD	
COc1ncnc(N(C)C)c1NC(=O)C(=O)NNc1c(F)cc(F)cc1Br	785008400	NLFZAPFNTQRXHN-UHFFFAOYSA-N	445.224	1.674	50	20	IDGD	
CCc1c(C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)nnn1Cc1ccc(F)cc1	785108611	SXYSHOJMTQCCDH-UHFFFAOYSA-N	449.487	1.497	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(NC(=O)C(=O)NNc2nc(C(F)(F)F)cs2)c1	785148198	YLTFSNOJUQNEEQ-UHFFFAOYSA-N	437.425	1.494	50	20	IDGD	
COc1c(C)cnc(Cn2cnc(NC(=O)C(=O)NNc3ncccc3Cl)n2)c1C	789727120	SEBNXIHSPSOAIO-UHFFFAOYSA-N	430.856	1.477	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)Nc1nc(C2CCC2)cs1	789732778	XJNHJLHXEUSTAF-UHFFFAOYSA-N	426.296	1.911	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@@H](C#N)Cc3ccc(C#N)cc3)CC2)cc1	792237619	MUJTUYRQGOIIOU-HSZRJFAPSA-N	444.539	1.514	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccc(F)c(N2CCOC2=O)c1	796990686	VIAURTAPUNLUQX-LLVKDONJSA-N	448.382	1.475	50	20	IDGD	
CCc1cccc(C)c1NNC(=O)C(=O)Nc1cnn(CC(=O)N2C[C@H](C)O[C@H](C)C2)c1	799842718	VNTYLQJVRQSASB-IYBDPMFKSA-N	442.520	1.472	50	20	IDGD	
Cn1nnc2c(C(=O)NNC(=O)c3nc(-c4ccccc4)n(-c4ccccc4)n3)ccnc21	801103340	DPIMDXZZANFSQM-UHFFFAOYSA-N	439.439	1.686	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)CCCS(=O)(=O)N2CCCC2)cc1Cl	802073383	FDADFWFWQMSYDI-UHFFFAOYSA-N	448.929	1.716	50	20	IDGD	
COc1ccc(OC)c(C2=NO[C@H](C(=O)NNC(=O)Nc3ccc4c(c3)OCO4)C2)c1	802103563	UOXHRLMQJNPLAC-SFHVURJKSA-N	428.401	1.778	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)C[C@H]1COCCN1C(=O)OC(C)(C)C	803950415	ZCLOTQAZTLWETH-KRWDZBQOSA-N	449.504	1.254	50	20	IDGD	
C[C@@H](C#N)S(=O)(=O)c1ccc(NC(=O)NNC(=O)COc2ccccc2C#N)cc1	806456040	DLOADUJRNPAMLX-ZDUSSCGKSA-N	427.442	1.476	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)C1CCN(c2ncccn2)CC1)C1CN(C(=O)OC(C)(C)C)C1	806792451	NNOVCWGLIISAAV-CQSZACIVSA-N	432.525	1.343	50	20	IDGD	
CCN(C)C(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)on2)c1	806977175	YBWKBYZFLILACV-UHFFFAOYSA-N	435.440	1.833	50	20	IDGD	
Cn1c(=NNC(=O)C(=O)Nc2ccc(F)c(N3CCCNC3=O)c2)sc2ccccc21	806997763	VESBLEYCBFJHAS-UHFFFAOYSA-N	442.476	1.869	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NCCCn1cc(Br)cn1	807613953	VTEXAZWHBCIMJT-LLVKDONJSA-N	428.262	1.973	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)CNS(=O)(=O)c1cccc(C(F)(F)F)c1	810193310	GEOGELQQOLLALY-UHFFFAOYSA-N	445.419	1.382	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2nc3c(s2)CCCC3(C)C)cc1	810385516	VWLFGLSCLVNULT-UHFFFAOYSA-N	432.502	1.931	50	20	IDGD	
COc1cc(NNC(=O)CNS(=O)(=O)c2ccc(NC(C)=O)cc2)ccc1Cl	811473088	PIEGHYYIRQIVEL-UHFFFAOYSA-N	426.882	1.729	50	20	IDGD	
Cc1nc(-c2cccnc2)nc(NNC(=O)C(=O)N2CCN(c3ccccc3)CC2)c1C	812514922	NKWYJMUAOLJFNT-UHFFFAOYSA-N	431.500	1.947	50	20	IDGD	
CCOc1ccccc1C(=O)NCCCC(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	812732432	GKPVZPCVVWHILS-UHFFFAOYSA-N	448.545	1.989	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)c2cccnc12	813033124	FZXHTGGFCFQKLW-UHFFFAOYSA-N	443.485	1.576	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2nnn(-c3ccn(C)n3)c2C)cc1Br	814412135	XAAWHAJTLNZDKU-UHFFFAOYSA-N	434.254	1.155	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCc3c(nnn3-c3ccccc3)C2)cc1OC	814639572	VYDATGJZVOLDOW-UHFFFAOYSA-N	436.472	1.104	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)C(=O)Nc1nc(CC(F)(F)F)cs1	815566389	RZPPZVOEFIGJDG-UHFFFAOYSA-N	447.351	1.321	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)N=S2(=O)CCCC2)ccc1OCCC(C)C	821131999	HAMLHAIMNULODD-UHFFFAOYSA-N	433.552	1.861	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)c(C)c2)cc1	879331802	KNBMHYBFRANWFG-UHFFFAOYSA-N	432.502	1.018	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cccnc2-n2cccn2)c1	879394352	FCSGDHITRJBIKP-UHFFFAOYSA-N	442.501	1.373	50	20	IDGD	
COCCCNC(=S)N(C)NC(=O)CSc1nncn1-c1cccc(Cl)c1	899890029	DJDNXFPQNNMDNN-UHFFFAOYSA-N	428.971	1.887	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@H](C)C(=O)NNC(=O)CN1C(=O)NC2(CCCC2)C1=O	912864315	CYEYWYOOBNINSB-CYBMUJFWSA-N	436.896	1.736	50	20	IDGD	
CNS(=O)(=O)c1ccc(CNC(=O)/C(C#N)=C/c2cc(C)n(CCOC)c2C)s1	914755567	GQJLIRFBEJHPND-MHWRWJLKSA-N	436.559	1.944	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)c1nnn(-c2ccc(OC)cc2)c1C	915189617	UXBARFTWCHHXQR-UHFFFAOYSA-N	433.472	1.958	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)[C@H]2CCCCN2S(=O)(=O)c2cccs2)cc1	915689586	QLJKHHTWKDJVCS-MRXNPFEDSA-N	437.543	1.826	50	20	IDGD	
CC(=O)c1cccc(S(=O)(=O)NCC(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)c1	915787998	QMIFRYAVJMJMOL-INIZCTEOSA-N	447.513	1.399	50	20	IDGD	
CN(C)[C@@H](CNC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)c1ccccc1	915891091	FULRNCOLVJCZCN-QFIPXVFZSA-N	438.576	1.832	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCCc2ccc3c(c2)OCCO3)nc1	915891434	PGWRVBBDROTBOI-UHFFFAOYSA-N	435.506	1.408	50	20	IDGD	
CN(C)[C@H](CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)c1ccco1	915896552	FMIXILVYCFNOBP-QGZVFWFLSA-N	449.533	1.311	50	20	IDGD	
CC(=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O)c1ccc(Oc2ccccc2)cc1	915957705	RREQCJMMYAMMII-UHFFFAOYSA-N	439.497	1.904	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)NCCN2CCN(c3ccc(F)cc3)CC2)c1	916513538	BLDARBPDLGRAAC-UHFFFAOYSA-N	445.495	1.609	50	20	IDGD	
COc1ccc(-c2nnn(CC(=O)NNC(=O)c3cc(Cl)ccc3OC)n2)cc1OC	916611686	AULJYCCVQSVKEO-UHFFFAOYSA-N	446.851	1.481	50	20	IDGD	
CCN(CCCNC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)C(=O)OC(C)(C)C	916628927	KJXVHIKGSIIDRG-UHFFFAOYSA-N	442.538	1.681	50	20	IDGD	
Cc1cnn(-c2ccc(C(=O)OCC(=O)NNC(=O)[C@@H]3COc4ccccc4O3)cc2)c1	917286918	YLFSCZRRXZJVPV-IBGZPJMESA-N	436.424	1.325	50	20	IDGD	
Cc1cc(Cl)ccc1S(=O)(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	917725569	ORZJGXOKBQPLGR-UHFFFAOYSA-N	438.314	1.573	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2ccc(F)cc2Br)ccc1O	917754146	YJJXDMDHUPILOO-UHFFFAOYSA-N	447.238	1.704	50	20	IDGD	
C[C@H](Sc1cc(Cl)ccc1Cl)C(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1	919885052	JOKYVZQNSHBDQB-WCBMZHEXSA-N	426.347	1.992	50	20	IDGD	
C=CC(=O)NCc1ccc(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1	919969832	CMRFHXTZNLESGY-UHFFFAOYSA-N	435.528	1.462	50	20	IDGD	
Cc1nccn1-c1ccc(CNC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1F	920239632	MAMXNVXEDBLNTA-UHFFFAOYSA-N	435.423	1.440	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)COc2cccc(C(F)(F)F)c2)cn1	920930268	CNZQELOIOAVJCS-UHFFFAOYSA-N	432.380	1.736	50	20	IDGD	
CS(=O)(=O)CC[C@H](NS(=O)(=O)c1ccc(Cl)cc1)C(=O)N1CC=C(C#N)CC1	1319941024	WTCVASTYYCGBKM-INIZCTEOSA-N	445.950	1.104	50	20	IDGD	
COc1ccc(-c2cc(NC(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)ccc2OC)cc1	1320106083	MLOMLQZMRVWLOK-GFCCVEGCSA-N	436.490	1.461	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3n[nH]c4ccc(F)cc34)C2)C1	1778623196	UQNJYWBBKFXYJU-ZMZPIMSZSA-N	439.285	1.929	50	20	IDGD	
C[C@H](C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CO[Si](C)(C)C)C2)n1ccccc1=O	1779526803	GIDWRVLFAVYHFT-JBYIUTFZSA-N	449.624	1.775	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCN1CCCC1)C2	1779546277	FTBOQDISIUFXMJ-WIYYLYMNSA-N	425.646	1.838	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(CCN(C(=O)c3cnc4snnc4c3)C2)C1	1780069951	NKAPFEMUGOEAHS-INIZCTEOSA-N	440.323	1.315	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(-c4ccccc4)[nH]n3)C2)C1	1780291455	ZVFQATHHIRWBDQ-KKSFZXQISA-N	432.908	1.774	50	20	IDGD	
COc1cccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C3)c1	1780380366	WGBFJIBFFIWGGN-AUSIDOKSSA-N	446.548	1.196	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cccc(N4CCOCC4)c3)CCO2)C1	1781217404	WEBUMFDNMQHWTN-UGKGYDQZSA-N	435.952	1.984	50	20	IDGD	
O=C(c1cc2cccn2cn1)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781329476	GLKYTSKGQAPGJU-WMLDXEAASA-N	425.258	1.468	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(F)c(F)c3OC)C2)C1	1781846538	HCVHPJXAPKBPOH-DJJJIMSYSA-N	432.851	1.671	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](C)Br)C2)nn1C	1781996425	IVDVFDGXWRIXAZ-JCKWVBRZSA-N	427.343	1.639	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc3c[nH]nc3c1)C2	1782173086	WKIPNAICZPWVPF-YRISNDGFSA-N	434.924	1.944	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(C)nn1C(F)F)C2	1782173822	RDVOTEOTIBHULG-ZBQZNYHESA-N	448.898	1.968	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCn2ccnn2)C1	1782566534	QETBJYBKNBIODH-ZTFGCOKTSA-N	432.352	1.418	50	20	IDGD	
C[C@H](O)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](Br)Cc3ccccc3)C2)C1	1783023276	VXIRPFZGRXHSJN-ZSZQSSIHSA-N	425.323	1.203	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)COc3cccnc3)CCO2)C1	1783343761	PUUYQUHPQICMAQ-MAUKXSAKSA-N	426.311	1.464	50	20	IDGD	
COC(=O)[C@@H]1CC[C@H](C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]32)C1	1784088117	VOBAYOUBUBKFEB-ZGCMRJCUSA-N	449.375	1.792	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3n[nH]c4cc(Cl)ccc34)C[C@@H]21)[C@@H](O)CCl	1784091814	CWHAUSOKPSWGOT-NZBMOFRJSA-N	441.315	1.409	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)COCc3ccc(OC)cc3)C2)C1	1784098352	IZXPQGHNMKBUDN-RXVVDRJESA-N	440.924	1.296	50	20	IDGD	
O=C(CCc1cccc(O)c1)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1784125969	ZFJZMBUGMDCPFR-FUHWJXTLSA-N	429.286	1.845	50	20	IDGD	
COc1ncccc1CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21	1785313265	FJDFNJYZLOFQEB-KKUMJFAQSA-N	430.332	1.806	50	20	IDGD	
Cc1nn(C)c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]32)c1F	1785778803	HRGNLMZBRWXQPB-RSLFNQERSA-N	435.327	1.697	50	20	IDGD	
N[C@H](CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)c1cccnc1	1786928427	IPPYOFIRTJSYLW-KSXIZUIISA-N	443.317	1.142	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(F)c(C)c3N)[C@H]2C1	1786948835	VUEPZUYTMZHMTC-QEWYBTABSA-N	427.904	1.563	50	20	IDGD	
CCN1CCC(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]3C2)CC1	1789873265	YKMWXZAJHIIADK-OGNFBWPZSA-N	434.408	1.934	50	20	IDGD	
Cc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)C(C)(C)CCl)C[C@@H]32)nc2nccn12	1790408408	LYZGSQWZKMCNLJ-ZOBUZTSGSA-N	433.940	1.896	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)c1ccc2nn[nH]c2c1	1790535211	CTBBCGBSOLBKRK-XEZPLFJOSA-N	436.310	1.336	50	20	IDGD	
COC[C@@H](NC(C)=O)C(=O)NC1(c2ccc(NC(=O)[C@H](F)Br)cc2)CCC1	1790535795	FULFYTFMIQPBIA-CABCVRRESA-N	444.301	1.962	50	20	IDGD	
CCOC(=O)C1(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](Br)CC)C[C@@H]32)CC1	1790720577	CLPKXVWULCPUCI-AJNGGQMLSA-N	445.354	1.483	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccn(C)c3=O)C[C@@H]21	1790958224	MRMIKIUWNNNUJW-TUUVXOQKSA-N	440.338	1.152	50	20	IDGD	
COc1cccnc1CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]2C1	1791294243	OJLSZQXPSKXGRJ-XEZPLFJOSA-N	430.332	1.806	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc4c(c3)CCNCC4)C[C@@H]21)C(Cl)Cl	1791295834	DVKWKKHDIYRWFM-QRTARXTBSA-N	441.359	1.167	50	20	IDGD	
C[C@H](Oc1cccnc1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21	1791652248	JAZKTMFTANDKPH-OTRWWLKZSA-N	440.338	1.614	50	20	IDGD	
Cc1nccn1[C@@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)Br)C[C@@H]21	1791707141	AFQQIJVIBJGICE-OSZUESSQSA-N	427.343	1.516	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CCN1C(=O)OC(C)(C)C	1793632099	SJIVYDFBHVUNNH-YIDVYQOGSA-N	429.945	1.603	50	20	IDGD	
COc1cncc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@](C)(Cl)CCl)C3)c1	1794055934	RYVQYNHHUUWRSV-BAAGSCJXSA-N	444.359	1.849	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C\c1c[nH]c2ccccc12)c1cccc(B(O)O)c1	1794229873	IKLQMHMOPOPPNE-MXEOVQSZSA-N	443.312	1.813	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1nc(Cl)ccc1F	1794528442	DSNPAZFOURNGND-CLLJXQQHSA-N	425.892	1.499	50	20	IDGD	
COc1ccc([C@H](O)C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCBr)cc1	1795112844	FDEFUBSIDUPCJD-DACLVMHWSA-N	441.322	1.103	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccc(F)c(F)c1	1795296778	GUQJWSFBWUUCPJ-YVWYUNDQSA-N	426.536	1.948	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)c1cc2cccnc2s1	1796190941	GNQQKJLMEGWWDB-BCDXTJNWSA-N	435.314	1.542	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccn2ccnc12	1797455798	UAHHYJUIYQRBPD-XRGAULLZSA-N	435.322	1.711	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3cccnc3n1)C2	1797956748	BOENIVNQWRPABZ-HGKCTWBKSA-N	428.565	1.685	50	20	IDGD	
CC(C)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CC(c2ccccc2)=NN1	1800152756	DKSPHWCYVNDDED-UKBAYJJMSA-N	432.952	1.607	50	20	IDGD	
Cc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)/C(C#N)=C/c2ccc(F)cc2F)n[nH]1	1800333268	AXELUGTVKDEIOC-AHHPBITISA-N	441.438	1.807	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)Cc1ccccc1)C2	1800644477	VTEIWGWCXDOCEY-ADHGMGHFSA-N	439.350	1.353	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1ccc3c(c1)OCO3)C2	1800975269	KCCPCBOATREQSZ-QOIOWGMHSA-N	438.908	1.191	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1cnc3[nH]ccc3c1)C2	1800981801	RXRROOKSKFYSBV-SFNKJDCFSA-N	434.924	1.339	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)CNCP(=O)(O)O)[C@H]1c1cccnc1	1803688438	BOYXWJKIHRNKKW-VYDXJSESSA-N	446.872	1.220	50	20	IDGD	
Cc1cc(C(=O)NC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)on1	1805706027	JDUCLDTVXQTJKA-KXBFYZLASA-N	449.471	1.010	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC2(CCCN(C(=O)C3=NN(C)C(=O)CC3)C2)CC1	1806617239	WZEMAWYYANDBFC-AWEZNQCLSA-N	441.370	1.857	50	20	IDGD	
O=C(CN1CCCC1=O)NC[C@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1	1806921848	XUOBRFLNAJEANN-BEFAXECRSA-N	437.338	1.495	50	20	IDGD	
Cc1ccoc1C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1807364315	UBXJDGDQXLVSRR-UYAOXDASSA-N	433.273	1.296	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1CCN(C(=O)[C@H]2CCC(=O)NC2)[C@@H]1c1cccnc1	1808290806	YLRCWXAVIADTCF-COCVIAQXSA-N	441.359	1.850	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2nc[nH]c2[N+](=O)[O-])[C@@H]1c1cccnc1	1808371340	LZBUCZURYHYMOE-YDHLFZDLSA-N	436.856	1.286	50	20	IDGD	
CN(CC(=O)N1CCCC2(CCN(C(=O)[C@H](O)CCl)CC2)C1)C(=O)OC(C)(C)C	1809386493	OTWJBOIXQGGKJI-OAHLLOKOSA-N	431.961	1.684	50	20	IDGD	
O=C(CCN1CCCCC1)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1	1809967785	KLVQDKJYAUYYIT-UHFFFAOYSA-N	441.381	1.087	50	20	IDGD	
Cc1c(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](F)Cl)[C@@H]2c2cccnc2)cn2[nH]cnc(=O)c12	1811303739	UPKHOSVSEQLONT-IAOVAPTHSA-N	446.870	1.580	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)CSC(=N)N)[C@H]1c1cccnc1	1812775564	ACZXHPBDZNVACL-YDHLFZDLSA-N	442.383	1.888	50	20	IDGD	
COCCOCC(=O)N1CC[C@H](CNC(=O)[C@@H](C)Br)[C@H]1c1cccnc1	1812864273	LSZYCYYHBKDGMR-FRFSOERESA-N	428.327	1.534	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CN2CCSCC2)n[nH]1	1814416750	FCPHZJHLXHAOAX-HIFRSBDPSA-N	429.974	1.704	50	20	IDGD	
Cn1ccc2c(O)ncc(C(=O)N3CCCC[C@@H]3c3cc(NC(=O)[C@@H](O)CCl)n[nH]3)c21	1814873906	SQCANWBXPNSZBZ-CABCVRRESA-N	446.895	1.908	50	20	IDGD	
CC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[nH]n1	1816813035	WLRJLAHOIABUDF-ZZQPOVDQSA-N	441.492	1.905	50	20	IDGD	
CC1(C(=O)N[C@H]2CCc3nc(NC(=O)c4cnccc4C(=O)NN)sc3C2)CCC1	1819790063	DTXPWRBTIMDUJK-NSHDSACASA-N	428.518	1.558	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)C(=O)Nc3cccnc3)sc2C1	1820052617	UKYLSCDVPLHZAC-JQWIXIFHSA-N	437.909	1.343	50	20	IDGD	
CC(=O)N(C)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](F)Br)n[nH]1	1820930897	KEEOMEDDTSOVAW-SWLSCSKDSA-N	432.294	1.961	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(C#N)cc3)sc2C1	1822171421	LUDZRUOLSXPWLZ-OAHLLOKOSA-N	440.529	1.614	50	20	IDGD	
CCn1ccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)n1	1822412658	BSLHHILOBUHJPJ-MRXNPFEDSA-N	430.513	1.305	50	20	IDGD	
C[C@H](C(=O)N[C@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1)n1cncn1	1823014331	UGWXXKPIFRXNQL-FYBVGQRMSA-N	431.291	1.598	50	20	IDGD	
C[C@H](C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](F)Br)CC2)n1ccnn1	1824690754	JLVHIJJYJUYIEM-SOCHQFKDSA-N	431.291	1.598	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CN2CCS(=O)(=O)CC2)CC1	1824977568	XWYBNIYDORAPCT-ROUUACIJSA-N	448.029	1.354	50	20	IDGD	
O=C(c1cncs1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827050991	JLBYFLSJFGJTBE-SFHVURJKSA-N	427.335	1.370	50	20	IDGD	
O=C([C@H]1CCCS1)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827055169	QXFJTESARNVVRT-WOJBJXKFSA-N	430.379	1.495	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc[nH]c4nccc3-4)C2)C1	1830357848	MNFPCIXBXFBWPK-NRFANRHFSA-N	434.924	1.850	50	20	IDGD	
C=CCOCCCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)CBr)C2)C1	1831404397	MRPRUPRMCHKTKH-LPHOPBHVSA-N	447.370	1.457	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C(C)=O)[nH]n3)C2)C1	1831644405	WZYHEILSENZLDZ-KUHUBIRLSA-N	426.901	1.090	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3cccc(OC)n3)CCO2)C1	1832769208	LRDDNIWQOLOGON-UZLBHIALSA-N	425.913	1.107	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@H](CC)NC(C)=O)CC2)CC1	1833093874	OECIPCRYIVEIER-OALUTQOASA-N	429.005	1.880	50	20	IDGD	
CC(C)(CCl)C(=O)NC1CCN(C2CCN(C(=O)[C@@H]3CCCS3(=O)=O)CC2)CC1	1833215620	SIJQMCWAGPNQNU-KRWDZBQOSA-N	448.029	1.400	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)CSc3ccncc3)CC2)CC1)[C@@H](O)CCl	1833308112	JCQWZKGKQQHWBA-SFHVURJKSA-N	440.997	1.345	50	20	IDGD	
CN1CCCC[C@@H]1C(=O)NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1	1833317436	XGQZXJKTCFMBGH-GOSISDBHSA-N	443.430	1.827	50	20	IDGD	
CC(=O)NCC(C)(C)C(=O)NC1CCN(C2CCN(C(=O)C(C)(C)CCl)CC2)CC1	1833543469	WBMUTQFOZVCXTA-UHFFFAOYSA-N	443.032	1.985	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3c(F)c(C)nn3C)CCO2)C1	1833702866	OPIMPAICIISVSL-KUHUBIRLSA-N	430.908	1.345	50	20	IDGD	
Cc1cnc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](C)CBr)C3)C2)s1	1833796678	LLYRJOXGTBHPJH-YVEFUNNKSA-N	446.367	1.553	50	20	IDGD	
Cc1cc(C(=O)NC2CCN(C3CCN(C(=O)[C@H](C)Br)CC3)CC2)no1	1834253435	XFKYCCXPSYJMLQ-ZDUSSCGKSA-N	427.343	1.952	50	20	IDGD	
COC(=O)c1ccc(C(=O)N2CCC(N3CCC(NC(=O)[C@@H](F)Cl)CC3)CC2)cn1	1835079820	UWAOBICSJYLXCH-QGZVFWFLSA-N	440.903	1.588	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)[C@H]3CCCN(C)C3)CC2)CC1	1836352538	YUIJWACJFYEKFJ-CVEARBPZSA-N	443.430	1.683	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3c(F)cncc3F)CCO2)C1	1838161259	GVTBVUQERDUURY-BFUOFWGJSA-N	431.867	1.837	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(F)cc(F)c3)CCO2)C1	1839003386	FJNMPLMGCQGWHI-APWZRJJASA-N	432.851	1.289	50	20	IDGD	
CC1=CC[C@H](C(=O)N2CCOC[C@@]3(CN(C(=O)[C@@H](F)Br)CCO3)C2)CC1	1839201080	RACQMECEXGGAHR-DAYGRLMNSA-N	433.318	1.880	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)ccc1F	1839321230	PSOLUCBFUYWMQG-MAUKXSAKSA-N	447.276	1.895	50	20	IDGD	
O=C(c1cccc(F)c1Cl)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1	1839322690	VHHLAAFBJUZJAW-KBXCAEBGSA-N	435.279	1.149	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnoc3C)C2)C1	1839963891	ZQOPAGXUYDMBJX-WMLDXEAASA-N	430.299	1.227	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCN3CCCCC3)C2)C1	1840032076	NFOKCMINXMDTNK-VQIMIIECSA-N	446.386	1.102	50	20	IDGD	
O=C(c1cn2cc(C(F)(F)F)ccc2n1)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1	1841350901	AOPQBOPGNZNRFX-ZDUSSCGKSA-N	430.814	1.770	50	20	IDGD	
O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)CCBr)C1	1842638346	NPDUFJCAGXYFOG-UHFFFAOYSA-N	433.306	1.768	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)[C@@H](C)n1ccnc1C)C2	1843417325	WOZGYRUQVOOSOR-LZCVXGSNSA-N	425.493	1.090	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2ccc3ncccc3c2)C1	1843636469	BIVPPOQKEOYILS-UHFFFAOYSA-N	430.468	1.364	50	20	IDGD	
COC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)CO[Si](C)(C)C)C1	1844377974	PLWRITDNFGQQOI-OAHLLOKOSA-N	443.617	1.581	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)N1CC2(CCCN2C(=O)/C(C#N)=C/c2ccc(F)cc2F)C1	1845871338	PUMNGECZJAKLTJ-BRYYZUPOSA-N	445.470	1.783	50	20	IDGD	
CC(C)(C)OC(=O)NC12CC(C(=O)N3CC[C@H]4[C@@H]3CCN4C(=O)[C@H](O)CCl)(C1)C2	1847562285	AMXGELQBJXJYKD-MEWGLPTFSA-N	427.929	1.235	50	20	IDGD	
O=C(COc1ccc(C2SCCCS2)cc1)NNC(=O)[C@H]1CCS(=O)(=O)C1	9931067	IQOZSQHNPAVTLZ-ZDUSSCGKSA-N	430.573	1.516	50	20	IDGD	
COc1ccc(CC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1OC	14907912	SXIUYMWXEJPELR-UHFFFAOYSA-N	447.513	1.492	50	20	IDGD	
CC(=O)N[C@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1)C(C)C	15846608	IVQRGDQKWVRMLH-IBGZPJMESA-N	446.529	1.087	50	20	IDGD	
Nn1c(COc2ccc(F)cc2)nnc1SCC(=O)NNC(=O)c1ccc(F)cc1	16371172	BPFDVFPFLGUTSZ-UHFFFAOYSA-N	434.428	1.402	50	20	IDGD	
CC(C)N(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)COc2ccc(C#N)cc2)cc1	26694966	BPOORFOCGRHEHR-UHFFFAOYSA-N	430.486	1.427	50	20	IDGD	
O=C(CCNC(=O)c1ccco1)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	27231172	UGJNJNXKRALODW-UHFFFAOYSA-N	448.501	1.035	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)/C=C\c2ccc3c(c2)OCO3)cc1OC	97656089	GUACLRUEHPXHRA-YWEYNIOJSA-N	428.397	1.450	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)c1ccc(Cl)c(NS(C)(=O)=O)c1	109494326	SVHOZMUKNRVDAW-UHFFFAOYSA-N	441.893	1.950	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2cccc(N3CCCC3=O)c2)ccc1Cl	726152991	VIVZIVBCVSMYNL-UHFFFAOYSA-N	436.877	1.189	50	20	IDGD	
CCCC(=O)N1CSC[C@@H]1C(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12	727365074	KMBIARVQSFWYPQ-OAHLLOKOSA-N	431.518	1.440	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)Cn2cc(Br)cn2)c1	728525763	FKCTVLATZSREMI-UHFFFAOYSA-N	432.072	1.878	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)N1CCC(C(=O)Nc2ccc3c(c2)OCO3)CC1	728957522	XBRNBOKDHCLUSA-UHFFFAOYSA-N	425.445	1.444	50	20	IDGD	
CC(C)n1ncc2c(C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)cc(-c3ccccc3)nc21	729275256	MUNLJPKSNGJSEB-CYBMUJFWSA-N	444.517	1.378	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)N2CCC[C@@H](NS(=O)(=O)c3cccc(F)c3)C2)c1	729500703	XNQDUVPFPVEZCT-QGZVFWFLSA-N	445.476	1.495	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)N[C@@H](C)c2cc(F)ccc2N2CCC(O)CC2)n1	730683442	YBWILTMWEQNVGW-HNNXBMFYSA-N	432.500	1.692	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCCCC2)cc1C(=O)NNC(=O)COc1ccccc1O	730778086	BYDNZWSIHQDLGS-UHFFFAOYSA-N	447.513	1.715	50	20	IDGD	
O=C(CNC(=O)c1c(Cl)cccc1[N+](=O)[O-])NNC(=O)c1ccc2c(c1)OCCO2	731051400	ZRASLPANLMUUHB-UHFFFAOYSA-N	434.792	1.210	50	20	IDGD	
O=C(NCCOCC1CC1)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	731119149	OEUALONUMPQJKQ-UHFFFAOYSA-N	446.529	1.536	50	20	IDGD	
COc1ccccc1C(=O)NNS(=O)(=O)c1ccc(OCCCC(=O)O)c(F)c1	731493995	GCILRLGXKNSJKT-UHFFFAOYSA-N	426.422	1.701	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)N1CCN(CC(=O)N2CCCc3ccccc32)CC1	732204535	YINWOQVCZCGZRG-GOSISDBHSA-N	429.565	1.165	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)N[C@@H](Cc1ccccc1)CN1CCOCC1	732476851	ZMCQMINYOMOKSL-SFHVURJKSA-N	427.461	1.482	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)NCc2nnc(C)n2C)cc1	733151615	IWAVQCLPYRSUAL-YBEGLDIGSA-N	448.487	1.094	50	20	IDGD	
O=C(O)COc1cccc(C=NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1	733201604	WBEHBCBDWVPGLV-UHFFFAOYSA-N	431.470	1.698	50	20	IDGD	
Cn1cc(S(=O)(=O)N2CCCCC2)cc1C(=O)NNc1nc2ccccc2c(=O)n1C	733261753	KLAVMKZYPMKPSR-UHFFFAOYSA-N	444.517	1.204	50	20	IDGD	
CC[C@H](Cc1cccc(Br)c1)C(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1	735271382	BKXOVGYVKSKUIG-TZMCWYRMSA-N	432.340	1.535	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)C(C)(C)S(=O)(=O)c2ccc(Br)cc2)cn1	735444227	SWGLDDLIRBQNPR-UHFFFAOYSA-N	429.296	1.196	50	20	IDGD	
CC(C)(C)CNC(=O)c1ccc(C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)cc1	741694283	XOPYOJZHVIQQAA-UHFFFAOYSA-N	435.525	1.931	50	20	IDGD	
CCOc1ccc(-c2nnc(SCC(=O)NNC(=O)c3cccc(C#N)c3)n2N)cc1	741853987	SUZIIISSTMXXHB-UHFFFAOYSA-N	437.485	1.483	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C[C@@H]2CCCN2C(=O)OC(C)(C)C)c2ccccc2c1=O	742473543	COXHNXRIDUZHGG-AWEZNQCLSA-N	443.504	1.967	50	20	IDGD	
CC(C)c1nn([C@H]2CCS(=O)(=O)C2)cc1C(=O)NNC(=O)c1cccc(N(C)C)c1	742487282	NYIYKNDIKUUBLT-INIZCTEOSA-N	433.534	1.507	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)[C@H]2CCCN(c3ncnc4sccc34)C2)C[C@@H](C)O1	743291255	OUOJKAZSYHIGKF-XHSDSOJGSA-N	446.577	1.554	50	20	IDGD	
O=C1C[C@H](Cc2ccc(C(=O)NNc3ccc(S(=O)(=O)NC4CC4)cc3)cc2)C(=O)N1	743328427	NJGKCAZHGYKAKN-HNNXBMFYSA-N	442.497	1.089	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)Oc1cccc(Cl)c1	745883228	MPEPQMDSVRKEFC-LBPRGKRZSA-N	429.864	1.998	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)N[C@@H]1CC(=O)N([C@H]2C[C@H]2c2ccccc2)C1	745914061	HKSXBDWHJOVKCK-NEWSRXKRSA-N	426.448	1.692	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)[C@@H]1CN(Cc2nc(O)c3ccccc3n2)CCO1	746238730	QYNMQCWUXDCJOL-SFHVURJKSA-N	439.447	1.065	50	20	IDGD	
CCCS(=O)(=O)N1CCCC[C@@H]1C(=O)NNC(=O)c1ccc(CN(CC)CC)o1	746397177	NOMYKYCJVCZJDD-MRXNPFEDSA-N	428.555	1.477	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H](C)N2CCc3ccccc32)c1	746855226	GLMMFXJYONOTHV-MRXNPFEDSA-N	444.557	1.929	50	20	IDGD	
O=C(NCCC(=O)N1CCN(c2ccccn2)CC1)NNC(=O)c1ccc(Cl)cc1F	747584974	MWXXQKYJHHJYBA-UHFFFAOYSA-N	448.886	1.557	50	20	IDGD	
O=C(CNC(=O)c1cccc([N+](=O)[O-])c1)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1	749283919	JOKFQHQWFBQTNG-UHFFFAOYSA-N	446.363	1.761	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2c(F)cccc2Br)c1	749329786	FVZCWEVPKRTOCG-UHFFFAOYSA-N	444.282	1.913	50	20	IDGD	
COc1ccccc1NC(=O)CN1CCN(C(=O)NNC(=O)c2ccccc2OC)CC1	749823024	LIUGEMWDZLBJTL-UHFFFAOYSA-N	441.488	1.315	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C2=NN(c3ccccc3)[C@@H](C(C)=O)C2)c2ccccc2c1=O	750863278	ZUSSMVPVKFQIJN-LJQANCHMSA-N	446.467	1.401	50	20	IDGD	
CN(C)C(=O)CN1C(=O)C(=NNC(=O)c2ccc(O)cc2)c2cc(Br)ccc21	750916665	QCIWBHIPRVYCPM-UHFFFAOYSA-N	445.273	1.724	50	20	IDGD	
CCC(=O)NCc1cc(S(=O)(=O)NNC(=O)CCc2ccccc2O)ccc1OC	751547722	MIPTWTFUIPVYRG-UHFFFAOYSA-N	435.502	1.369	50	20	IDGD	
N#Cc1cc(Br)cc(S(=O)(=O)NNC(=O)c2nnc(-c3ccccc3)o2)c1	754259246	PZSNEROIJNLGHU-UHFFFAOYSA-N	448.258	1.994	50	20	IDGD	
CCCC[C@H](NC(=O)[C@@H](C)NC(=O)C(C)(C)C)C(=O)NNC(=O)NC1CCCCC1	755036549	VKTCSTIQILAYTO-ZBFHGGJFSA-N	425.574	1.875	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc(F)c(F)c1)NNc1ccc(C(F)(F)F)nn1	755182980	SOWAQAQVAZSWFI-UHFFFAOYSA-N	425.339	1.585	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1cnn(C)c1)C(=O)NNc1ccc(Br)cc1Cl	755776696	KRCWAXKJIOKAPU-MRVPVSSYSA-N	436.719	1.646	50	20	IDGD	
Cc1ccc(NC(=O)c2ccccc2)cc1NC(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1	755912599	GCUAPHDOOPQSCX-OAHLLOKOSA-N	430.486	1.835	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CN(CCO)Cc2cnn(Cc3ccccc3)c2)c1	756538547	MXXRALNUUWLSSD-UHFFFAOYSA-N	432.484	1.059	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)CN1CCN(CC(=O)Nc2ccccc2F)CC1	756642463	KAKCMDUBYCEVSM-UHFFFAOYSA-N	441.507	1.080	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)Nc1ccccc1OCC(=O)N1CCOCC1	756874014	MMTVILGZSWSSBO-UHFFFAOYSA-N	442.428	1.119	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)NCc2ccc3c(c2)CCS3(=O)=O)c1C	757750961	JINFABKCODDGAC-HNNXBMFYSA-N	431.514	1.931	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)CNC(=O)c1cccs1)c1nc(-c2ccccc2)no1	760313362	ZCNAXVGJBYQASI-GFCCVEGCSA-N	428.474	1.662	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NN=Cc1ccc(C)cn1)N(S(C)(=O)=O)CC2	761804665	DWACZYMTQCDLHT-GOSISDBHSA-N	446.529	1.806	50	20	IDGD	
Cc1ccc(C(=O)N[C@H](C(=O)OCC(=O)NNC(=O)Cc2nc(C)cs2)C(C)C)cc1	762235510	QBHYNQAHHMBBBF-IBGZPJMESA-N	446.529	1.448	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)c1ccc(S(=O)(=O)Nc2nccs2)cc1	763015254	XZIIQCHGSYXVRS-UHFFFAOYSA-N	446.466	1.747	50	20	IDGD	
CN(c1ccccc1NC(=O)C(=O)NNC(=O)c1ccc2ccccc2n1)S(C)(=O)=O	763450700	SNTLGBPPXCOZPB-UHFFFAOYSA-N	441.469	1.030	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(C)c(N3CCCS3(=O)=O)c2)c(C)o1	763578010	LOFPVZGHPYZHES-UHFFFAOYSA-N	434.474	1.144	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccn(Cc3ccncc3)n2)c2ccccc2n1	763616680	XOVAKTIJBDLLTP-UHFFFAOYSA-N	429.440	1.583	50	20	IDGD	
Cc1ccc(NC(=O)C(C)C)cc1NC(=O)C(=O)NNC(=O)c1c(C)nc2ccccn12	763629671	QMCJUWCLYNEKPI-UHFFFAOYSA-N	436.472	1.945	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)N1CCc2c1cccc2C(F)(F)F	763657511	OBVPOHSWBHRIOC-UHFFFAOYSA-N	437.374	1.830	50	20	IDGD	
O=C(CN1CCCc2ccccc21)NNC(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl	763745192	AMRGPKBTWPQTGA-UHFFFAOYSA-N	431.836	1.787	50	20	IDGD	
Cc1cnn(-c2ccc(NC(=O)C(=O)NNC(=O)COc3ccc(F)cc3)cc2F)c1	763837431	FRMZJAOMENQGSD-UHFFFAOYSA-N	429.383	1.624	50	20	IDGD	
CC(=O)Nc1ccc(Cl)c(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)c1	763848650	FHQHFZTWXFLOBK-JTQLQIEISA-N	436.827	1.991	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)n(-c2ccccc2)n1	763857832	PIXZETKJZRPANL-AWEZNQCLSA-N	425.420	1.873	50	20	IDGD	
C=CCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)cc1	763867331	ZWGOEDNLYDOSIS-ZDUSSCGKSA-N	428.420	1.295	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ncn(C3CCCCC3)n2)cc1	763879051	VWLPTGCIIVFMRT-CQSZACIVSA-N	442.476	1.539	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccccc2CC(=O)OC)cc1OC	763901232	IEBZVPHAZAOQLE-UHFFFAOYSA-N	429.429	1.209	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1C(F)(F)F	763917326	UTDDFKFTEMPHAU-UHFFFAOYSA-N	433.350	1.389	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cccn2C)c(Br)cc1F	763999599	VNVPCTDZZGIZKY-UHFFFAOYSA-N	441.213	1.113	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc(N2CCC(N(C)C)CC2)cc1	764042144	BUFWHHVYXRRVJA-UHFFFAOYSA-N	439.516	1.625	50	20	IDGD	
Cc1c(Cl)cc(F)c(NC(=O)C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c1F	764076656	DNTLOGJMFONHCS-UHFFFAOYSA-N	445.831	1.730	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccnn1-c1ccc(Cl)cc1	764132486	OXALJVJNZVIBOI-UHFFFAOYSA-N	427.848	1.863	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)ccc1N1CCOCC1	764245133	NGGARAGAOSABMI-UHFFFAOYSA-N	435.484	1.572	50	20	IDGD	
COCC(=O)NNC(=O)C(=O)Nc1ccc(Oc2ccc(C(F)(F)F)cn2)c(F)c1	764300341	YHPAIDMWOOEUFN-UHFFFAOYSA-N	430.314	1.764	50	20	IDGD	
CCOCC(=O)NNC(=O)C(=O)Nc1ccc(I)cc1Cl	764317867	SNZVXGWRBZGVGS-UHFFFAOYSA-N	425.610	1.067	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)Cc2ccccc2F)cc1C(F)F	764320372	ZOTMKKHSLZNKQV-UHFFFAOYSA-N	443.403	1.495	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)cnn1CC(C)C	764387840	NNWWOAXOEXLMGD-UHFFFAOYSA-N	427.440	1.776	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1cc(C2CCC2)nn1-c1ccccc1	764398251	QMUGYVHWRBBSJY-AWEZNQCLSA-N	429.477	1.277	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(Oc2ccc(C)c(C)c2)nc1	764398338	FRGBKPXDNDMJLX-HNNXBMFYSA-N	430.461	1.628	50	20	IDGD	
Cc1[nH]c(-c2ccncc2)nc(=O)c1CC(=O)NNC(=O)CSc1ccccc1O	765249665	NAGPUGSJGZGXAS-UHFFFAOYSA-N	425.470	1.328	50	20	IDGD	
CCOC(=O)c1cnn(-c2cccc(NC(=O)C(=O)NNC(=O)OC)c2)c1C(F)(F)F	765374201	SDUHGUDZWAUFKB-UHFFFAOYSA-N	443.338	1.394	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)CCc2nc(-c3ccccn3)no2)n[nH]1	765593326	WLLVJAYGPRYDNJ-UHFFFAOYSA-N	433.428	1.924	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3cnc4sccn4c3=O)n[nH]2)cc1OC	765598636	LXMYGJXODMVIBT-UHFFFAOYSA-N	440.441	1.238	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)CNC(=O)c2cc3ccccc3[nH]2)n[nH]1	765602278	XQDXQQXQLPMKHG-UHFFFAOYSA-N	432.440	1.758	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)NCCNS(=O)(=O)c1cccc(Cl)c1	765646110	RMDNDBQEKKBHAP-UHFFFAOYSA-N	446.938	1.348	50	20	IDGD	
C[C@@H](Cc1ccccc1F)C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765739577	YQQGCINEOMZNPK-KRWDZBQOSA-N	426.492	1.610	50	20	IDGD	
C[C@H]1CN(C(=O)NNC(=O)CNC(=O)c2cccs2)[C@@H](C)CN1Cc1ccccc1	766528470	JDUUGBJYAWGWNN-HOTGVXAUSA-N	429.546	1.814	50	20	IDGD	
O=C(CSc1ccc(O)cc1)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	766655559	WZYMZKISBLCCBY-UHFFFAOYSA-N	428.514	1.090	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)c2cc(S(=O)(=O)N(C)C)ccc2O)c1C	766969215	XBFPNQWTTDUVQU-CQSZACIVSA-N	435.502	1.488	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)[C@H](C)S(=O)(=O)c1ccc(F)cc1	767290370	GXYBZDCNDKHWBN-AWEZNQCLSA-N	436.461	1.230	50	20	IDGD	
Cc1ccc(F)c(OCC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)c1	767962253	NFFXWKNCTPIWFO-UHFFFAOYSA-N	436.509	1.592	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=S)Nc2ccccn2)c1	768582853	YNPUNGNNNQWIPF-UHFFFAOYSA-N	443.938	1.291	50	20	IDGD	
COC(=O)c1cccc(CCNC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)c1	769006340	ZFTJAFOMUJAUNK-UHFFFAOYSA-N	434.474	1.455	50	20	IDGD	
C=CCNc1ncc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)s1	770954452	JTIOZJACRDKMSG-UHFFFAOYSA-N	435.531	1.600	50	20	IDGD	
Cc1c(/C=C(\C#N)C(=O)N2CCO[C@@H](CN3C(=O)c4ccccc4C3=O)C2)cc(C#N)n1C	771790414	HDBPCALQGIIGOS-KFVRLDSISA-N	443.463	1.636	50	20	IDGD	
COc1nn(C)c2nc(C)c(CCC(=O)O[C@@H](C)C(=O)NNC(=O)CC(C)C)c(C)c12	771995825	GOSPNYVVXRFPRZ-AWEZNQCLSA-N	433.509	1.652	50	20	IDGD	
O=C(COC(=O)C1=NN(c2ccccc2)C(=O)CC1)NNC(=O)c1cccc([N+](=O)[O-])c1	772869163	DEXMJMSUXDCWST-UHFFFAOYSA-N	439.384	1.082	50	20	IDGD	
COc1ccc(/C=C\C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)cc1O	773458343	FMAOAKYMXVKCMY-WMZJFQQLSA-N	446.529	1.493	50	20	IDGD	
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	775686098	CPIGAVYBJHOYAQ-JXFKEZNVSA-N	425.489	1.856	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2ccc(C(C)(C)O)cc2)c1	776190290	KMOTXSKXZITLHE-UHFFFAOYSA-N	434.518	1.309	50	20	IDGD	
CC1(C)CC[C@H](C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)C1	781558913	BIAZTEOXVRAIQF-KRWDZBQOSA-N	437.562	1.614	50	20	IDGD	
CC(C)[C@@H]1C[C@@H](CC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)CCO1	782017454	ZARVOHAJEYZWMI-PXNSSMCTSA-N	438.594	1.907	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)C(=O)Nc1cc(F)c(F)cc1F	782897144	UUGHWNUIICXLKU-UHFFFAOYSA-N	443.407	1.105	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccc(-c3cc[nH]n3)cc2)nc1	783262469	DIOORQMVGKYVJB-UHFFFAOYSA-N	443.489	1.240	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)Nc2ccccc2C)ccc1S(=O)(=O)N(C)C	783411789	ZLCUQMBEZBENTL-UHFFFAOYSA-N	449.489	1.045	50	20	IDGD	
Cc1ccc(SCC(F)(F)F)c(NC(=O)C(=O)NN[C@@]2(C)CCS(=O)(=O)C2)c1	783425355	HTBFFNKVZLMAKF-HNNXBMFYSA-N	439.481	1.786	50	20	IDGD	
Cc1ccc(NNC(=O)C(=O)Nc2ccc(S(=O)(=O)N3C[C@H](C)C[C@@H](C)C3)cc2)nn1	783951469	HFOBNYCXCJASCI-ZIAGYGMSSA-N	446.533	1.533	50	20	IDGD	
CCOC(=O)[C@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNc2ncccc2Cl)cc1	784814727	JNOOKEDBGKFJGB-NSHDSACASA-N	433.852	1.498	50	20	IDGD	
O=C(CN1CCOCC1)Nc1ccc(NC(=O)C(=O)NNc2ncccc2Cl)cc1	784818682	AAIVYHNWSJNNKE-UHFFFAOYSA-N	432.868	1.088	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1ccnn1C(C)(C)C	784833550	NRVDVLFWTRUUEO-UHFFFAOYSA-N	436.538	1.797	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)F)cc1)C(=O)Nc1ccc(Br)nc1	784835876	YKEALAXCTQPDET-UHFFFAOYSA-N	449.233	1.922	50	20	IDGD	
O=C(NNc1ccnc(F)c1)C(=O)Nc1ccc(Cl)c(S(=O)(=O)N2CCCC2)c1	784847289	ZFOBDHGHEWCOSB-UHFFFAOYSA-N	441.872	1.740	50	20	IDGD	
CCCCN(C)S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2cccc(OC)n2)cc1	784847388	FMOXRCWRXCQWLU-UHFFFAOYSA-N	435.506	1.593	50	20	IDGD	
O=C(NNc1cc(Cl)ccn1)C(=O)Nc1ccc(CC(=O)N2CCSCC2)cc1	784856620	OYKRWNXTWTVWIQ-UHFFFAOYSA-N	433.921	1.935	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2ccc(C(=O)NC(C)(C)C)cc2)n1	785225967	MMVYAGYYNHPHSF-UHFFFAOYSA-N	427.509	1.933	50	20	IDGD	
Cc1ccc(C(=O)NCC2CC2)cc1NC(=O)C(=O)NNC(=O)Cc1cn2ccccc2n1	785994810	OZFLJKWOMDBRNO-UHFFFAOYSA-N	448.483	1.111	50	20	IDGD	
O=C(COC(=O)c1cc(O)c2ccsc2c1)NNC(=O)[C@H]1COc2ccccc2O1	786139175	YWCZOBUUHZOOIT-MRXNPFEDSA-N	428.422	1.751	50	20	IDGD	
O=C1CN(c2ccnc(C(=O)NNC(=O)c3ccc(COc4ccccc4)o3)c2)CCN1	786694964	DFLVOQLWTGIVLZ-UHFFFAOYSA-N	435.440	1.265	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)C(=O)Nc2cccc(N3CCNC3=O)c2C)cc1	787544381	QZVGYJVLVATOTI-UHFFFAOYSA-N	441.513	1.711	50	20	IDGD	
N#Cc1ccc(S(=O)(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1Br	788479040	WRLBMYKDTCOJCC-UHFFFAOYSA-N	425.220	1.852	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C1CCN(c2oc(C)nc2C#N)CC1	788530851	NLZNOVOKEKOAJC-UHFFFAOYSA-N	427.461	1.696	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2cc(-c3ccc(F)cc3F)nn2C)c1O	789733962	XSGMCQKVDONLSP-UHFFFAOYSA-N	445.382	1.479	50	20	IDGD	
CC(C)(C)OC(=O)N1CC2(C[C@@H]2C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)C1	789755372	ULWLQLOPZXAIHQ-MRXNPFEDSA-N	436.534	1.827	50	20	IDGD	
Cc1nc(S(=O)(=O)N2CCC(C(=O)NNc3cccc(F)c3[N+](=O)[O-])CC2)cn1C	790594529	JDSISIWSJIURRM-UHFFFAOYSA-N	440.457	1.320	50	20	IDGD	
COc1cc(NC(=O)NNc2nc3ccccn3n2)ccc1S(=O)(=O)N1CCCC1	792308263	JGXAGEISTXGLPZ-UHFFFAOYSA-N	431.478	1.671	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2nc3ccccn3n2)cc1OCc1cccnc1	792393848	IWLPDXUFYNINSU-UHFFFAOYSA-N	433.428	1.794	50	20	IDGD	
CCOc1cc(C(=O)NNS(=O)(=O)c2cnn(C)c2C)cc(OCC)c1OCC	793350936	SVMLJAFPWYKESB-UHFFFAOYSA-N	426.495	1.548	50	20	IDGD	
C[C@H](C(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1)N(C)CC(F)(F)F	793683751	UQBCVMKVVKDBRU-CQSZACIVSA-N	449.905	1.488	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNS(=O)(=O)c1cc(Cl)cc(C(N)=O)c1	799123574	CEWXQLFBRLBKNH-SECBINFHSA-N	432.285	1.869	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)c2cn3cc(Cl)cc(Cl)c3n2)c2ccccc2c1=O	799520430	YWKYJZUJKYMDPY-UHFFFAOYSA-N	431.239	1.963	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)NCc1cccc(CS(N)(=O)=O)c1	800717630	NTDWANSXAYGCCL-UHFFFAOYSA-N	438.531	1.106	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)c2nn(-c3ccc(F)cc3F)cc2O)cc1	801413252	ACBBOTBLGGNMHK-UHFFFAOYSA-N	430.367	1.783	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)C2CCCC2)c(C)cc1Br	806976662	UGYSUQPSNBTDIM-UHFFFAOYSA-N	426.267	1.820	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)[C@H]1CCCC12OCCO2	807092278	BSIOFLIJCSPHRF-GOSISDBHSA-N	436.940	1.148	50	20	IDGD	
CCN(c1ccccc1)S(=O)(=O)c1ccc(C(=O)NNC(=O)N2CCN(C)CC2)cc1	807382590	GWCYEAQORFDTLG-UHFFFAOYSA-N	445.545	1.504	50	20	IDGD	
Cc1cc(N2CCSCC2)ccc1NC(=O)C(=O)NNc1ccc(-n2ccnc2)nn1	807428402	CXWJRVHCHKONNI-UHFFFAOYSA-N	438.517	1.606	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)N[C@@H]1CCCN(C(=O)CCC(F)(F)F)C1	807575512	JMCMFFYJTVXKLC-CQSZACIVSA-N	441.410	1.601	50	20	IDGD	
Cc1nc2c3cccnc3nn2c(C)c1CCC(=O)N([C@H]1CCS(=O)(=O)C1)N(C)C	808024907	VEGFUAADHRWESQ-HNNXBMFYSA-N	430.534	1.319	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)Cc2ccc(C(=O)NNC(=O)c3cn(C)nn3)cc2)cc1	808373513	QEHFLALSERLLKD-UHFFFAOYSA-N	442.501	1.019	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2ccc(C(N)=O)cc2OCC(F)F)cc1OC	810305337	LFCSMYDLQAMSOG-UHFFFAOYSA-N	438.387	1.913	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@H](F)C[C@H]1CNC(=O)NNC(=O)c1cc([N+](=O)[O-])ccc1O	813812033	NCPWIYWSOQDTFQ-JQWIXIFHSA-N	441.416	1.592	50	20	IDGD	
O=C(CNC(=O)NNC(=O)Nc1ccc(OC(F)F)cc1)NCCN1CCCCCC1	814425085	YSNRHRGVXGOJGA-UHFFFAOYSA-N	442.467	1.616	50	20	IDGD	
CC[C@H](C)C(=O)NNC(=O)C(=O)Nc1ccc([N+](=O)[O-])c(I)c1	815567636	GFNJJFVHZGPPPN-ZETCQYMHSA-N	434.190	1.331	50	20	IDGD	
CCc1cccc(C)c1NNC(=O)C(=O)Nc1ccc(N2CCN(C(=O)OC)CC2)nc1	815634773	QGVYCFBPDNJFTM-UHFFFAOYSA-N	440.504	1.923	50	20	IDGD	
CCCN1CCN(c2ccc(NC(=O)C(=O)NNC(=O)[C@H]3CCCO3)cc2Cl)CC1	815779288	YUJLUTGRWVDTNX-QGZVFWFLSA-N	437.928	1.137	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3ccc(OC(C)(C)C)cn3)cc2)CC1	815854886	VHBXRUHLYTZYDP-UHFFFAOYSA-N	447.561	1.952	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(N2CCOCC2)c(C(=O)NNC(=O)CC2CC2)c1	819141514	ZUGCVYASCQZZSH-UHFFFAOYSA-N	438.550	1.115	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2c(C)nc(C(C)C)nc2O)c1	884607457	YAWRQBDNRHBZHG-UHFFFAOYSA-N	449.533	1.719	50	20	IDGD	
CNS(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)c2cc3c(s2)CCCCC3)cc1	906448218	MZCQQMPFEYNFGN-UHFFFAOYSA-N	443.572	1.548	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)CNS(=O)(=O)c2ccc(C)cc2)cc1OC	913069890	XYMFSZFZDHUSPK-UHFFFAOYSA-N	435.502	1.532	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)[C@@H]1CC(=O)N(C(C)(C)C)C1	914931326	RPMZRVIDBIOGSA-LLVKDONJSA-N	425.869	1.300	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1C	915185006	QZDBXDBXFGKKQB-UHFFFAOYSA-N	447.922	1.318	50	20	IDGD	
C[C@H]1C[C@H](C)CN(CCCCNC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)C1	916506049	UVPMIAWERXTVTH-HOTGVXAUSA-N	428.537	1.636	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2CC(=O)N(Cc3ccccc3Cl)C2)cc1	916830499	CKAQQEAHKCPILR-HNNXBMFYSA-N	428.876	1.783	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCC(=O)N(Cc2ccccc2)[C@H]1c1ccccc1)C(=O)NC1CC1	917622170	LORGOBAFDGNCAJ-FPOVZHCZSA-N	434.496	1.593	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NC[C@H](C)CN2CCCCC2)cc1	918104081	ITFJEYNTCGMDBQ-KRWDZBQOSA-N	439.582	1.068	50	20	IDGD	
O=C(NC[C@H]1CCCOC1)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	918123915	DUXRHWPBZMLGLI-QGZVFWFLSA-N	435.488	1.759	50	20	IDGD	
O=C(COC(=O)CCn1cc(Br)cn1)NNC(=O)c1cccc(Cl)c1	919572790	HQUBCWQGCUNDJN-UHFFFAOYSA-N	429.658	1.694	50	20	IDGD	
CC(C)(C)OC(=O)Nc1ccc(CC(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)cc1	919889632	QJNBZBZYFUQYHQ-CQSZACIVSA-N	426.495	1.094	50	20	IDGD	
CC(=O)N1c2ccc(S(=O)(=O)NNC(=O)c3nnc(-c4ccccc4)o3)cc2C[C@@H]1C	919961400	DWWQYCQNXVWVIH-LBPRGKRZSA-N	441.469	1.657	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)c1cc([N+](=O)[O-])cc(S(C)(=O)=O)c1	920275598	LVTLUIMTTICUKN-JTQLQIEISA-N	425.394	1.366	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CN2CCCC2=O)cc1S(=O)(=O)Nc1ccc(F)cc1	920827064	RESLPMJLVYWBLZ-UHFFFAOYSA-N	448.476	1.318	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)Nc1cccc(CN2CCC[C@H]2C(N)=O)c1	920934160	GWFKDYSMYSMMFB-KRWDZBQOSA-N	435.488	1.559	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)c1ccc(CN2CCCC2=O)cc1	921160667	BNSLUHWKZBLHAD-UHFFFAOYSA-N	429.502	1.177	50	20	IDGD	
O=C(CCCC[C@@H]1SC[C@H]2NC(=O)N[C@H]21)NNC(=O)c1cc(-c2ccccc2)on1	921304524	WQPOKXUKMUNLQH-UWWQBHOKSA-N	429.502	1.828	50	20	IDGD	
COC(=O)c1sc2ccccc2c1S(=O)(=O)NNC(=O)c1n[nH]c2c1CCCC2	1116020515	NLULLRAGUPOJNW-UHFFFAOYSA-N	434.499	1.913	50	20	IDGD	
N#C/C(=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)N1C[C@@H]2C[C@]2(CO)C1	1116724619	YSCYQCHZZNTGLL-VCEKFZHGSA-N	439.903	1.827	50	20	IDGD	
O=C(CSc1ccccc1O)NNS(=O)(=O)c1cc2c(cc1Cl)NC(=O)CO2	1253811346	GEJWMDDXJOCLPV-UHFFFAOYSA-N	443.890	1.478	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NC2CCN(S(=O)(=O)Cc3ccccc3)CC2)cc1	1318579350	USORBEHYPQYNSS-UHFFFAOYSA-N	446.529	1.634	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@@H](C)c2ccc(F)c(F)c2)cc1	1322124772	XQUHMMDYHOKQQK-ZDUSSCGKSA-N	425.457	1.845	50	20	IDGD	
C[C@@H](O)C(=O)NNC(=O)COc1c(I)cc(Cl)c2cccnc12	1326144576	HUQUKJKXEVIXPF-SSDOTTSWSA-N	449.632	1.400	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@@H]1CCCCN1Cc1cccnc1	1338792225	DMZLZQQDPIBFJY-KRWDZBQOSA-N	444.561	1.499	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc4n(n3)CCCO4)C2)C1	1778558900	WQWXPNGMAWTGLD-ACJLOTCBSA-N	441.326	1.283	50	20	IDGD	
CN(C)c1ccc(C(=O)N2CC[C@]3(CN(C(=O)CCBr)CCO3)C2)cn1	1779760433	HXYXWKXBZVTGOT-SFHVURJKSA-N	425.327	1.376	50	20	IDGD	
Cn1ncc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)CCBr)C3)c1Cl	1779924346	KMCAPHOSEWAGFJ-CXAGYDPISA-N	447.761	1.986	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc4cccnn4n3)C2)C1	1779961355	ARJQVLBUBPSSFU-KDOFPFPSSA-N	436.310	1.346	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cccnc3CS(C)(=O)=O)CCO2)C1	1781212901	AESYBMBWQXFFSE-DNVCBOLYSA-N	443.953	1.087	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)Cc3ccc(C)c([N+](=O)[O-])c3)C2)C1	1781306058	ACZPKMIPGZRTJO-OXJNMPFZSA-N	439.896	1.529	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H]2C[C@H]3CC[C@@H]2O3)C1	1782023646	JFXAPOQXCBZQHZ-UGRJFSIRSA-N	429.355	1.851	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)n1cccc1C=O)C2	1782170277	GNLBQZNKQYJQEI-NWUWZPLHSA-N	439.940	1.629	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc4cccnn4c3)C2)C1	1782387766	BATRZCJXVBEOBC-LPHOPBHVSA-N	435.322	1.951	50	20	IDGD	
Cc1ccn2c(C(=O)N3CC[C@@]4(C3)CN(C(=O)[C@@H](F)Br)CCO4)cnc2c1	1782487458	FONJJHQNBOJLSB-CRAIPNDOSA-N	439.285	1.777	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@@]2(C1)CN(C(=O)C1CC(=O)C1)CCO2	1782868094	TXTFPOICEGHHAK-QESPPMFYSA-N	429.423	1.681	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@H]2[C@H](C(=O)N3CC[C@@]4(C3)CN(C(=O)[C@H](F)Cl)CCO4)[C@@H]2C1	1783467322	MXPDOFWFPXGDLF-YJVQVXSTSA-N	445.919	1.464	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](C)Nc1ccccn1)CCO2	1783534336	SOIVLVHSNOXIGV-SUNYJGFJSA-N	425.327	1.495	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)Cc3ccc4c(c3)CCO4)CCO2)C1	1783540139	SFPZQDCSGGDDCJ-VLIAUNLRSA-N	437.334	1.777	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3c(C)cc(C(N)=O)cc3C)CCO2)C1	1783877699	NMRGVQOBHAGIPL-IIBYNOLFSA-N	437.924	1.100	50	20	IDGD	
Cc1nc(C)c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]3C2)o1	1783969612	IHNMJGKUXZOSIX-KJEVXHAQSA-N	428.327	1.916	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)c3cccc4c3CCCC4)C2)C1	1785095546	BRDNKTYSJOMTQG-XMMPIXPASA-N	442.560	1.382	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H](C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](F)Cl)CCO3)C[C@H]2C[C@H]21	1785593890	GFSKOOVBZPFDGC-KNHNZMBKSA-N	445.919	1.749	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CC#N)[C@H]2C1	1786363908	JBLOLGQGBFLTNZ-AJNGGQMLSA-N	428.917	1.012	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)c1cn2cc(Cl)ccc2n1	1787859562	HMTCKTPZQLLMAP-YUDUHTQSSA-N	441.315	1.181	50	20	IDGD	
Cc1cc(CC(=O)NC2(c3ccc(NC(=O)c4cccc(B(O)O)c4)cc3)CCC2)on1	1788145177	QZDURVFRFUUSGF-UHFFFAOYSA-N	433.273	1.653	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nccc(OC)c3OC)C[C@@H]21	1789862127	ZHWWUDBPFSOAHR-YXWQFLTLSA-N	425.913	1.710	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4c[nH]nc4c3)C[C@@H]21)[C@H](F)Br	1789922286	CMDSEGIEUUWJRV-SDADXPQNSA-N	439.285	1.847	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4ccnn4c3)[C@H]2C1	1790443354	DKYSAOIPQBVMID-WDSOQIARSA-N	430.581	1.779	50	20	IDGD	
O=C(CCc1cnc2[nH]ccc2c1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21	1791141044	SLTJONMBSQAXNE-FJIDUMEYSA-N	434.924	1.075	50	20	IDGD	
COC(=O)[C@H]1CC=CC[C@H]1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(C)(C)CCl)C[C@@H]21	1791230595	ZRIZGNXNUNNMNL-ADHGMGHFSA-N	440.968	1.987	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CS[C@H]3CCCCO3)C[C@@H]21	1791255402	QNZCVEGTTFBVRZ-DNCCFGNJSA-N	434.986	1.480	50	20	IDGD	
COc1ccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Br)C3)cc1O	1792730524	IEERZKIBAXVMPR-LZDSYCOUSA-N	445.285	1.223	50	20	IDGD	
CC(=O)N/C(=C\c1ccco1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(C)(C)CCl	1792784909	ZOTFOXHVHSBAKN-COSZLBEHSA-N	437.924	1.611	50	20	IDGD	
COc1ccnc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)CBr)c1	1792870238	AJBNBDNVLHVMOS-NFFDBFGFSA-N	426.311	1.324	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(Br)c1F)C2)[C@H](O)CCl	1792979713	BKNFVNAOIZDNAT-YJKIEOBBSA-N	449.704	1.391	50	20	IDGD	
C[C@H](CBr)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnncc1C(=O)O)C2	1792990370	LOLZHVBNMSYIRQ-WISYIIOYSA-N	425.283	1.458	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nnc3cc(C)nn3c1C)C2	1793449969	WCDBNGDTAWTPDP-BASYENTBSA-N	434.928	1.352	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)cc([N+](=O)[O-])c1)C2	1793451615	GKAOSXDGHBMTMZ-DLTLXFJOSA-N	425.869	1.911	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(Cl)cnc1O)C2	1795113652	IZJMVLGDQNNEQL-WDAIWFPHSA-N	432.702	1.429	50	20	IDGD	
CN(CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cocn1)NC(=O)NCc1ccccc1	1795315124	FTZCWHDOCJPNMP-BCDXTJNWSA-N	440.504	1.273	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2c[nH]nc2c1	1796175314	DIVDJANMDGAQBW-IVSAIRAKSA-N	435.322	1.940	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H]1CCCN(C)C1)C2	1796892800	UGENUSYODZOMQB-UONOVLGTSA-N	428.537	1.100	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)cc([N+](=O)[O-])c1)C2	1800759905	PDWIENCUQVWOPJ-ADGXKJENSA-N	442.266	1.287	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(OCC3CC3)cc1)C2	1800983208	RGGBDXPPONCNGX-PIKOESSRSA-N	436.936	1.932	50	20	IDGD	
Cc1cc(C)cc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCC(=O)NN(C)C)c1	1801012130	GVWONVCMMSJTNY-IRJINJETSA-N	444.576	1.199	50	20	IDGD	
CN1CCCn2nc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)CO[Si](C)(C)C)C4)cc2C1	1801183988	SOLCRECSOBEXRV-BJWYYQGGSA-N	433.629	1.822	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2nccc3[nH]ccc23)[C@H]1c1cccnc1)[C@@H](O)CCl	1803139240	MTOLNBKEQRRZMA-FNHZYXHNSA-N	427.892	1.877	50	20	IDGD	
COc1cccnc1CCC(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1	1804453367	ICXIFBREYAXUQR-DJPFJPOOSA-N	446.935	1.724	50	20	IDGD	
N[C@@H](Cc1cccnc1)C(=O)NC[C@H]1CCN(C(=O)C(Cl)Cl)[C@H]1c1cccnc1	1808365286	WRQOUMKFCCTMDV-IKGGRYGDSA-N	436.343	1.856	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCC2(CCCN(C(=O)CN(C)C)C2)CC1	1809164919	GCSZJBLDGCNBHP-UHFFFAOYSA-N	446.504	1.927	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)c3cnn4ccccc34)CC2)C1	1809971919	COTKVFUILYBMOY-UHFFFAOYSA-N	446.316	1.173	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)[C@H]3CCC(F)(F)C3)CC2)C1	1809977904	MADOERHTTKCKHB-KRWDZBQOSA-N	434.292	1.647	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2c(O)cc(O)cc2O)[C@@H]1c1cccnc1	1813034501	NXKZISLCDGVYHC-ZUEVXXBESA-N	449.891	1.772	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2ccc(C#N)cc2)[C@H]1c1cccnc1	1813072368	GQYIAPOQONTIEJ-REWPJTCUSA-N	448.527	1.646	50	20	IDGD	
COc1cc(C(=O)N2CC[C@@H](CNC(=O)C(Cl)Cl)[C@@H]2c2cccnc2)n(C)n1	1813077059	GFEFJBRKIWRSEH-WFASDCNBSA-N	426.304	1.947	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)Cc3ccccc3F)sc2C1	1813841775	HHOVIGBMHURTSY-AWEZNQCLSA-N	447.536	1.810	50	20	IDGD	
CC(C)[C@@H](S)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1815240153	KPAIWGGBSXNDTL-SJLPKXTDSA-N	430.339	1.350	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@H](F)Br)CC2)c1cc(O)nc(O)n1	1817103274	DWVAOEIFMVDWDS-FWOIEVBISA-N	446.258	1.261	50	20	IDGD	
CC(C)CNC(=O)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](F)Br)[nH]n1	1818134701	KNBGAEKTVQIPSU-YPMHNXCESA-N	432.294	1.865	50	20	IDGD	
Cn1ccc(=O)cc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CO[Si](C)(C)C)CC2	1821311672	MPZAHWYRXMVRQB-GFCCVEGCSA-N	434.594	1.919	50	20	IDGD	
O=C(Cn1ccccc1=O)N[C@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1	1823002372	DAGGVOIAYCXURJ-XPTSAGLGSA-N	443.298	1.608	50	20	IDGD	
COc1ccc([C@H](O)C(=O)N2CCC([C@@H]3CCCCN3C(=O)[C@H](O)CCl)CC2)cc1	1824176447	OENAZFDFMYNUET-ZCNNSNEGSA-N	438.952	1.948	50	20	IDGD	
CC[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CN1CCNC1=N)CC2	1825447255	UJUUPFFHHCAQKN-VHSXEESVSA-N	443.371	1.069	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H](N)CCC(N)=O)CC1	1826822479	MTCHOSBKVIIJJP-OWCLPIDISA-N	445.402	1.372	50	20	IDGD	
CN1CCCC[C@H]1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827049631	YQGTYYCCBLDEST-VXKWHMMOSA-N	441.381	1.084	50	20	IDGD	
O=C(c1cc(F)c[nH]1)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827060261	DOOGPCLACNQFJU-FQEVSTJZSA-N	427.285	1.381	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1C1CCN(C(=O)C2CC(O)C2)CC1	1827677378	RHKCZAOGYZYWDP-LRIMBYPUSA-N	443.548	1.511	50	20	IDGD	
CC[C@H](C)[C@@H](N)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1	1828925343	JWHLEAZSLJDQSU-CWFSZBLJSA-N	444.580	1.292	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)CN)CCN2C(=O)OCc2ccccc2)C1	1828961651	UWZAYNUFUCPYAX-DYESRHJHSA-N	436.940	1.415	50	20	IDGD	
COCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Cl)CCN2C(=O)OCc1ccccc1	1829052240	ITMMKGFEQVYZBZ-XLIONFOSSA-N	441.887	1.619	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)C3CCC(F)(F)CC3)CCO2)C1	1831010027	ZRJAXHVHACLDFM-QAPCUYQASA-N	438.899	1.522	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cccc(OC)n3)C2)C1	1831640520	NCLKGWWQPLWGPQ-UTKZUKDTSA-N	439.940	1.497	50	20	IDGD	
CO[C@@H](C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)CC1	1831906230	PBFLGSTVQKGSSQ-QPSSLLGDSA-N	431.537	1.775	50	20	IDGD	
C[C@@H](Cn1cccn1)C(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1833191610	OZSVUKUVNKQNRP-OXJNMPFZSA-N	426.945	1.241	50	20	IDGD	
CC(C)c1nc(C(=O)N2CCC(N3CCC(NC(=O)[C@@H](O)CCl)CC3)CC2)co1	1833308620	XWVOVUMTCPWUSX-KRWDZBQOSA-N	426.945	1.583	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)C[C@](C)(O)CC(=O)O)CC2)CC1	1833534679	GIXLKECUKYNZBQ-UTKZUKDTSA-N	445.988	1.581	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(C)no3)CCO2)C1	1834227460	GHUGTTIPURZMGI-CXAGYDPISA-N	430.299	1.227	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)c3nc[nH]n3)CC2)CC1	1834951262	MQVAPCUDPYXLCP-LBPRGKRZSA-N	427.347	1.021	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)C#Cc3ccccc3)CCO2)C1	1835103230	YULPODUHXNZRGE-RXVVDRJESA-N	449.345	1.668	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC1CCN(C2CCN(C(=O)[C@@H]3C[C@H]4CC[C@@H]3O4)CC2)CC1	1835837489	IYPADKQVSAUWNV-AQNXPRMDSA-N	437.657	1.977	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3ccsc3)CCO2)C1	1836008494	DHRDRKGLEZJCRJ-VQIMIIECSA-N	430.954	1.391	50	20	IDGD	
O=C(CCc1ccc(O)nn1)NC1CCN(C2CCN(C(=O)[C@@H](F)Cl)CC2)CC1	1836502325	DXDDNEMBRPMLDW-GOSISDBHSA-N	427.908	1.221	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)Nc1cnccn1)CCO2	1837477960	TZEHTRGTRSZGMI-GUXCAODWSA-N	439.944	1.141	50	20	IDGD	
COc1ccnc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@](C)(Cl)CCl)C3)C2)c1	1837956290	RSSUXIGDQOYYMB-RTBURBONSA-N	446.331	1.397	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(OC)cc3O)CCO2)C1	1838889581	XNVBTTAVWXMOHL-OXQOHEQNSA-N	426.897	1.488	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3CCC4(CC3)OCCO4)C2)C1	1839147840	DSVPHPCPWRNIOB-FXAWDEMLSA-N	444.956	1.394	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)c3ccco3)C2)C1	1839149350	CLYPOBXQQZMWOZ-WBAXXEDZSA-N	435.304	1.006	50	20	IDGD	
COc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)ccn1	1839153693	ONZWMGPNRFRYQZ-RTBURBONSA-N	446.331	1.397	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc(C)cn3)C2)C1	1839963434	KAAIXLXGCIMSLV-RDTXWAMCSA-N	441.326	1.029	50	20	IDGD	
CSCC(C)(C)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H](C)Br)CCO2)C1	1840030298	IDZJEMTVIFAGRO-DYVFJYSZSA-N	437.400	1.615	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)C[C@H]3CCCCO3)C2)C1	1840030670	SCPQSIXEUUVHRY-HDMKZQKVSA-N	433.343	1.185	50	20	IDGD	
COC1(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)CCC1	1840036308	IPPPPBBNKIXITG-KSSFIOAISA-N	433.343	1.185	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)C(Cl)Cl)CCO2)C1	1840187349	VAZAWNJCAXAFSH-HZMBPMFUSA-N	432.142	1.278	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840189567	YQHXLIVDWBBDHB-FQEVSTJZSA-N	440.327	1.971	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC12CN(C(=O)c1ccc3c(n1)NC(=O)CC3)C2	1841286663	RIGGAOUUEXABMX-LBPRGKRZSA-N	435.322	1.814	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@H](O)C(=O)N1CCCC12CN(C(=O)[C@@](C)(Cl)CCl)C2	1841300852	ZNSBFCHVGQOJKJ-SJCJKPOMSA-N	438.352	1.312	50	20	IDGD	
Cc1onc(-c2ccncn2)c1C(=O)N1CCCC12CN(C(=O)[C@@H](F)Br)C2	1844669593	QOWZNRIHUDHRNE-CQSZACIVSA-N	438.257	1.948	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)[C@H](C)n1cccn1)C2	1844693368	WLWBJRHFTXWDDX-AWEZNQCLSA-N	441.444	1.795	50	20	IDGD	
Cc1cccc(NC(=S)NNC(=O)CCNC2=NS(=O)(=O)c3ccccc32)c1C	15844284	WGIPJKMZGMXHQY-UHFFFAOYSA-N	431.543	1.750	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)Cn2cnc3c(C)cccc3c2=O)c2ccccc2c1=O	16231556	VMYXFDGWGRVESU-UHFFFAOYSA-N	446.467	1.286	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCN(CCOc2ccccc2)CC1	29054125	JYIJSFBSFHPXFS-UHFFFAOYSA-N	446.935	1.806	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNS(=O)(=O)c1ccc(Cl)c([N+](=O)[O-])c1	725891526	LIZUHFVJIWUEED-UHFFFAOYSA-N	436.874	1.863	50	20	IDGD	
COCCCNC(=S)N(C)NC(=O)c1ccc(Cl)c(S(=O)(=O)N(C)OC)c1	726077091	PBJCACVMBLJRAD-UHFFFAOYSA-N	438.959	1.010	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)N[C@@H](C)C(=O)N1CCCC[C@H]1C	726610894	MPOZUCGXULXHHJ-OCCSQVGLSA-N	438.554	1.022	50	20	IDGD	
CC(C)NC(=O)CNC(=S)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1	727278451	VNPLAHRTUSJOHF-FQEVSTJZSA-N	439.585	1.633	50	20	IDGD	
COC(=O)c1ccc(F)cc1S(=O)(=O)NNC(=O)c1cc(OC)c(OC)c(OC)c1	727349585	DYSXWHWNIXTSFZ-UHFFFAOYSA-N	442.421	1.261	50	20	IDGD	
CN1CCN(C[C@@H](NC(=O)NNC(=O)COc2ccccc2C#N)c2ccccc2)CC1	727945768	MLLXEXQCHDFFDX-HXUWFJFHSA-N	436.516	1.256	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)[C@@H]2CCCN2C(=O)/C=C/c2ccc(C(N)=O)cc2)cc1	728204286	CGTGWNSVMQOEPO-BNCSFYMNSA-N	449.511	1.358	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NNC(=O)c2cccc(OC(F)F)c2)cc1	728544802	LSGGBZFXUFERCI-LBPRGKRZSA-N	427.429	1.724	50	20	IDGD	
CCNS(=O)(=O)c1ccc(C)c(C(=O)NNC(=O)c2cccc(OC(F)F)c2)c1	728545566	PAEPENQNXKQVGL-UHFFFAOYSA-N	427.429	1.969	50	20	IDGD	
COCCN1CCC(NC(=O)NNC(=O)c2cc(OC)ccc2Br)CC1	728748561	ZPSPEOPTZJPZPV-UHFFFAOYSA-N	429.315	1.513	50	20	IDGD	
CN1CCN(c2ccccc2NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)CC1	728937871	APPOLLBCHYJFFW-UHFFFAOYSA-N	438.536	1.298	50	20	IDGD	
CN(CC(=O)N(C)C1CCCCC1)C(=O)NNC(=O)c1csc(N2CCOCC2)n1	728945088	SEWUFKHQELHZCT-UHFFFAOYSA-N	438.554	1.057	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)NNC(=O)C12CC3CC(CC(C3)C1)C2	728958872	GHDNTEGMQMOLNZ-UHFFFAOYSA-N	441.536	1.271	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Cc2c(C)[nH]c3ccnn3c2=O)ccc1OCCC(C)C	729282449	YFKOUEIIHLCAIN-UHFFFAOYSA-N	441.488	1.768	50	20	IDGD	
CN(C)c1ccc(NC(=S)NNC(=O)CC/N=C2/NS(=O)(=O)c3ccccc32)cc1	729690551	BXTHGTVBFYJSBG-UHFFFAOYSA-N	446.558	1.199	50	20	IDGD	
Cc1nc(N2CCOCC2)nc(O)c1CCC(=O)NNC(=O)C(C)(C)c1ccccc1	731174405	BDWWVWYVUPYXDC-UHFFFAOYSA-N	427.505	1.385	50	20	IDGD	
Cc1ccc(S(=O)(=O)n2ccc(C(=O)NNC(=O)c3ccc4c(c3)OCCO4)c2)cc1	731866783	YDNRKFYNXFPYIM-UHFFFAOYSA-N	441.465	1.880	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)ccc1=O	732050913	MCVOKFJNMKFDNQ-UHFFFAOYSA-N	444.451	1.096	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)c2nn(-c3ccccc3F)c3c2CCC3)C[C@@H](C)O1	732261637	OCEKQTGGHXLUCR-HUUCEWRRSA-N	429.496	1.760	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NCc1ccc(N(C)S(C)(=O)=O)cc1	732476036	WOVMYMKAAIRQJC-CYBMUJFWSA-N	438.481	1.519	50	20	IDGD	
CC(C)Oc1ccc(NC(=S)NNC(=O)c2cc(S(N)(=O)=O)ccc2F)cc1	733370454	BJTIYWVBBPPTGP-UHFFFAOYSA-N	426.495	1.892	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)NCc2ccc(C(=O)NNc3cnccn3)cc2)cc1	734245142	KLOCAWIGYNPXMC-UHFFFAOYSA-N	425.470	1.915	50	20	IDGD	
COc1ccc([C@H]2[C@@H](C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)CCC(=O)N2C)cc1	734419466	SAWFKSLYPUWXMX-ICSRJNTNSA-N	449.471	1.042	50	20	IDGD	
O=C(Cc1ccc2ccccc2c1)NNC(=O)N[C@@H]1CCN(CCN2CCOCC2)C1	734685797	HYJVLFPWUZAYPR-OAQYLSRUSA-N	425.533	1.119	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2cc(-c3ccccc3)[nH]n2)CC1	735117297	PLQGTFWYVIQJMR-UHFFFAOYSA-N	441.517	1.165	50	20	IDGD	
COc1cc(OC)cc(C(=O)Nc2ccc(O)c(C(=O)NNC(=O)c3cnn(C)c3)c2)c1	735520860	BDDFKPUVDBQOHY-UHFFFAOYSA-N	439.428	1.470	50	20	IDGD	
Cc1c(C(=O)NNC(=O)Cc2ccc(Cl)cc2)cc(S(N)(=O)=O)cc1[N+](=O)[O-]	735841142	SYNBDEGQDIGWCV-UHFFFAOYSA-N	426.838	1.208	50	20	IDGD	
COc1ccc(S(=O)(=O)CCC(=O)NNC(=O)c2cccc(N(C)C)c2)cc1OC	740774681	GQSWVVFHBVDMEQ-UHFFFAOYSA-N	435.502	1.395	50	20	IDGD	
COC(=O)c1ccc(Cl)cc1S(=O)(=O)NNC(=O)c1cc([N+](=O)[O-])ccc1O	743269161	YOBCLCZJSXDZOJ-UHFFFAOYSA-N	429.794	1.364	50	20	IDGD	
NC(=O)[C@H](NNC(=O)CNC(=O)c1cccs1)c1ccc(Br)cc1F	743473079	ANNXXQHHNFMUQK-CYBMUJFWSA-N	429.271	1.227	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)NCc2cccn2C)cc1	743791163	YEJXFRBDHTVUAV-SFQUDFHCSA-N	432.484	1.996	50	20	IDGD	
Cc1cc(C)n2nc(C)c(C(=O)NNc3ccccc3S(=O)(=O)N3CCOCC3)c2n1	744621941	JQLSSEBUWXWORV-UHFFFAOYSA-N	444.517	1.432	50	20	IDGD	
CC(=O)N[C@H](CC(=O)OCC(=O)NNC(=O)c1ccc(C#N)cc1)c1c(F)cccc1F	744941886	NZWMXSSGJKCTGY-QGZVFWFLSA-N	444.394	1.408	50	20	IDGD	
CC(C)(C)C(=O)Nc1nc(CC(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)cs1	745516234	SSPULIRLWSUKCV-UHFFFAOYSA-N	443.485	1.546	50	20	IDGD	
Cc1nccn1CCCCNC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	745842535	WOCGKECMNATOGT-UHFFFAOYSA-N	448.549	1.400	50	20	IDGD	
O=C(NNC(=O)N1CCOCC1)c1cccn1-c1cccc(I)c1	746520239	PRWVBLAQTMHSEC-UHFFFAOYSA-N	440.241	1.769	50	20	IDGD	
COC(=O)c1ccc(OC)c(S(=O)(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c1	747615748	IEJYDOJCWIKUKB-UHFFFAOYSA-N	430.442	1.291	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(C(=O)CCC(=O)NNc3ccccc3F)CC2)cc1	748050641	OQPOBRAQXXCSCI-UHFFFAOYSA-N	448.520	1.891	50	20	IDGD	
CCc1nc(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)nn1-c1ccccc1Cl	748212738	UABGZNAZJRRSBX-UHFFFAOYSA-N	437.851	1.534	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F	748614354	KKILUOMSEFJQTF-ZDUSSCGKSA-N	448.442	1.424	50	20	IDGD	
Cc1ccc(N2CCN(C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)[C@@H](C)C2)cc1C	749112083	UBMVAXLYWKAAEF-KRWDZBQOSA-N	434.504	1.844	50	20	IDGD	
O=C(COC(=O)c1ccn(-c2c(F)cccc2F)n1)NNC(=O)c1ccc([N+](=O)[O-])cc1	750384234	ZXHPNFTVSPUOHZ-UHFFFAOYSA-N	445.338	1.677	50	20	IDGD	
CC(=NNC(=O)CNC(=O)c1ccco1)c1ccc(S(=O)(=O)NCc2ccco2)cc1	750938513	GBEHHUASZLHTLV-UHFFFAOYSA-N	444.469	1.621	50	20	IDGD	
Cc1[nH]c2ccc(Br)cc2c1CC(=O)NNC(=O)CNC(=O)c1ccco1	751202349	RLXUNQZFZFGHQX-UHFFFAOYSA-N	433.262	1.952	50	20	IDGD	
CC(=O)[C@@H]1CC(C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)=NN1c1ccccc1	751325512	JVFRVRUGRAJKNB-SFHVURJKSA-N	428.470	1.075	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)C1	752489715	PJIYILFRSXTOMF-UHFFFAOYSA-N	440.522	1.018	50	20	IDGD	
CCOC(=O)NCCCC(=O)NNc1ccc(S(=O)(=O)Nc2nccs2)cc1	752624203	JZLWQHPMFAPQBC-UHFFFAOYSA-N	427.508	1.913	50	20	IDGD	
CCOC(=O)c1sc([C@H](C)NCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)nc1C	755030266	FLSBSVYBFUWUFH-NSHDSACASA-N	435.462	1.648	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2ccccc2OCCC(N)=O)c2ccccc2c1=O	756067399	RWEVZTDQDXJVSD-UHFFFAOYSA-N	438.444	1.137	50	20	IDGD	
COCC[S@](=O)Cc1cccc(NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c1	756613772	QUOOSOOKFSMFHF-HKBQPEDESA-N	443.489	1.024	50	20	IDGD	
Cn1cccc(NC(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)c1=O	756686036	QTWHNJGBXZIEHQ-UHFFFAOYSA-N	447.498	1.714	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)CN1C(=O)NC2(C[C@H](C)C[C@@H](C)C2)C1=O	756866538	DTYWZFWXQVIHIX-MCIONIFRSA-N	434.468	1.487	50	20	IDGD	
COC(=O)c1cc(NC(=O)NNC(=O)COc2ccccc2F)cc(S(C)(=O)=O)c1	757673734	IEEOMWYFYGAFIS-UHFFFAOYSA-N	439.421	1.248	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)CN2C(=O)NC3(C[C@H](C)C[C@@H](C)C3)C2=O)c1	757833763	CVWOAJUMAAVKNE-HUUCEWRRSA-N	444.488	1.046	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)Nc2ccc(NC(=O)CCN3C(=O)CNC3=O)cc2)n1	758028266	CVJKPIDAQHSNFU-UHFFFAOYSA-N	426.437	1.122	50	20	IDGD	
COCCCOc1cccc(C(=O)N2CCN(S(=O)(=O)CBr)CC2)c1	758513201	PSWHOSJVAURFHE-UHFFFAOYSA-N	435.340	1.542	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)N[C@H]1CN(C(=O)OC(C)(C)C)C[C@H]1C#N	758753529	PRUBFJKEEQAQGX-KGLIPLIRSA-N	449.533	1.877	50	20	IDGD	
O=C(NCCOc1ncc(C(F)(F)F)cc1Cl)NNC(=O)C(=O)Nc1ccccn1	758805718	WWUQWMRCLFLRHF-UHFFFAOYSA-N	446.773	1.497	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CN2CCNC(=O)[C@@H]2c2ccc(C(F)(F)F)cc2)cc1	759329949	SGOHXEIOTJPPMX-SFHVURJKSA-N	434.418	1.948	50	20	IDGD	
Cn1ccc(CCNC(=O)NNC(=O)[C@@H]2Cc3ccccc3CN2Cc2ccccc2)n1	760669279	MPLSXBVROFYKJL-QFIPXVFZSA-N	432.528	1.920	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)c1ccc(S(=O)(=O)NCCC#N)cc1	761620638	FEULCWKVNUMNLE-UHFFFAOYSA-N	448.526	1.440	50	20	IDGD	
C[C@H]1CCS(=O)(=O)CCN1C(=O)CCC(=O)C(C#N)=C1N(C)c2ccccc2N1C	762512696	LATDFMKZTQDPKF-HNNXBMFYSA-N	430.530	1.693	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNS(=O)(=O)c1cccc(C(=O)NC2CC2)c1	763439394	OAGJWWVLNLWQQQ-UHFFFAOYSA-N	440.522	1.193	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)C(=O)Nc1cc(F)c(F)c(F)c1	763530254	GTEBYFLSNGNXDK-UHFFFAOYSA-N	449.433	1.402	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2ccc(C(=O)NC(C)C)cc2C)c1	763644792	MSGHTZBUMBKVDZ-UHFFFAOYSA-N	440.500	1.915	50	20	IDGD	
COC(=O)NCc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C)c(C)c2)cc1	763680065	ONNZOQCBXOOQMD-UHFFFAOYSA-N	428.445	1.324	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc(-n2nccn2)cc1C(F)(F)F	763957723	HDUXIALYQQYGNG-UHFFFAOYSA-N	432.362	1.994	50	20	IDGD	
Cc1nccc(-c2cccc(NC(=O)C(=O)NNC(=O)c3cc(Br)c[nH]3)c2)n1	763997287	ILVFQIDXTULWLF-UHFFFAOYSA-N	443.261	1.942	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)OCCCO2	764004697	LMRWCEVTMXNOJW-UHFFFAOYSA-N	437.250	1.349	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)on1)C(=O)Nc1ccc(CN2CCOC2=O)cc1	764011479	HJVUZOJLGBGRSN-UHFFFAOYSA-N	449.423	1.694	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc([C@H](C)N2CCOCC2)cc1	764048309	OIOOCDUHKUDBGI-HNNXBMFYSA-N	426.473	1.488	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(F)ccc2OC[C@H]2CCCO2)c(O)c1	764104864	GLWKMFOLAMDSMK-CQSZACIVSA-N	431.420	1.797	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(CC(=O)OC(C)(C)C)c2)c(O)c1	764108553	ADNSQXBIMFBCJM-UHFFFAOYSA-N	427.457	1.985	50	20	IDGD	
COc1ccccc1NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)CC(F)(F)F)cc1	764115958	GXUWKAJIJHXONT-UHFFFAOYSA-N	438.362	1.986	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2cccc(C(=O)NC(C)(C)C)c2)c1O	764130863	ASAGXXFEFWUXSV-UHFFFAOYSA-N	428.445	1.329	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N(CC)CC)cc1NC(=O)C(=O)NNC(=O)CC1CC1	764145082	WUHNUFYBHONEPG-UHFFFAOYSA-N	440.522	1.002	50	20	IDGD	
COC(=O)c1ccc(OC(C)C)c(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)c1	764154063	OANKTITUGVOOOM-SFHVURJKSA-N	441.440	1.350	50	20	IDGD	
CN(C)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)cc1Cl	764165487	ZNFAAXVJZFILNX-INIZCTEOSA-N	430.848	1.131	50	20	IDGD	
COc1ccc(Cl)c(NC(=O)C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)c1	764204158	JVILRIJQYUHWNU-UHFFFAOYSA-N	428.873	1.739	50	20	IDGD	
CCOC(=O)Cn1ccc2cc(NC(=O)C(=O)NNC(=O)c3scnc3C)ccc21	764247297	QGKZCKSIYXECFS-UHFFFAOYSA-N	429.458	1.369	50	20	IDGD	
N#CCOc1cccc(NC(=O)C(=O)NNC(=O)c2cc(Br)ccc2O)c1	764279673	BJFHKHNTFPNQOM-UHFFFAOYSA-N	433.218	1.457	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)Cc2cc[nH]n2)nn1-c1ccc(Cl)c(Cl)c1	764294131	VPGZCNQHBNAFBS-UHFFFAOYSA-N	436.259	1.539	50	20	IDGD	
CC(C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)cc1	764377280	MRAJTKSUPWYCLV-UHFFFAOYSA-N	440.485	1.676	50	20	IDGD	
C[S@](=O)c1ccc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)cc1F	764379747	IXMBGEWPEULAJH-LJAQVGFWSA-N	429.376	1.321	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1ccc2c(c1)C[C@@H](OC)C2	764396741	BJGWAZRKFMSDKS-INIZCTEOSA-N	429.498	1.687	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1ccnn1Cc1cccc2ccccc12	764398986	IYSZQGKSCAVDRK-HNNXBMFYSA-N	439.472	1.222	50	20	IDGD	
COC(=O)c1cc(Cl)ccc1NC(=O)C(=O)NNC(=O)CSc1ccccc1O	764404809	OEXOGCJJSPFHSU-UHFFFAOYSA-N	437.861	1.710	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)OC2(CCCC2)O3)c1	764432666	IWSKEVSEQRFTCQ-UHFFFAOYSA-N	439.428	1.481	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)c2ccc(=O)n(-c3ccccc3F)n2)cc1	765529094	FJQXQNPJBLIEEZ-CQSZACIVSA-N	440.431	1.999	50	20	IDGD	
O=C(NNC(=O)c1cccc(-c2nc[nH]n2)c1)c1ccc(S(=O)(=O)N2CCCC2)cc1	767192257	VGVRYAWFGGZTHO-UHFFFAOYSA-N	440.485	1.331	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)[C@H](C)NC(=O)OC(C)(C)C)n[nH]2)cc1OC	768276252	JCNKKOTXQDFPLV-NSHDSACASA-N	433.465	1.768	50	20	IDGD	
CC(C)(C)OC(=O)N1Cc2ccc(C(=O)NNC(=O)CNC(=O)c3cccnc3)cc2C1	769003141	IVUVCRPDYVLMLG-UHFFFAOYSA-N	439.472	1.523	50	20	IDGD	
CCc1ccc(C(=O)O)cc1S(=O)(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	771604375	JPPHGWIDDSGVDL-UHFFFAOYSA-N	439.877	1.227	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)[C@H]1CSCN1C(=O)c1ccc(C(C)(C)C)cc1	772094483	DBSNJPYIXSVNLT-XJKSGUPXSA-N	435.546	1.988	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNS(=O)(=O)c1ccc(CS(C)(=O)=O)cc1	773250334	CPRKUPHQSTWLOV-LBPRGKRZSA-N	446.934	1.662	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)NCc2ccc(N3CCCS3(=O)=O)c(F)c2)cc1	773268690	JOXXKECJDWKWNF-UHFFFAOYSA-N	431.449	1.381	50	20	IDGD	
CCCC(=O)N1CSC[C@@H]1C(=O)NNC(=O)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	773420838	PNTPPEWXCPOXKN-ZIAGYGMSSA-N	428.555	1.483	50	20	IDGD	
Cc1cnn(-c2ccc(C(N)=O)cc2NC(=O)C(=O)NNC(=O)c2ccc(C)c(F)c2)c1	773890710	ZPCQCAIRYIJSKQ-UHFFFAOYSA-N	438.419	1.127	50	20	IDGD	
CCc1c(C(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)[nH]c(C)c1C(N)=O	776202058	PQZBJAVVDWICMN-UHFFFAOYSA-N	436.513	1.234	50	20	IDGD	
Cc1nc(C(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)nn1-c1ccccc1	776206622	WWPIYNUNQOFZCV-UHFFFAOYSA-N	443.508	1.825	50	20	IDGD	
O=C(NNC(=O)c1ccc(Br)cc1C(F)(F)F)N[C@H]1CCS(=O)(=O)C1	776704557	CWGGSYBAAJOQEM-QMMMGPOBSA-N	444.229	1.599	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)NNC(=O)CNC(=O)OC(C)(C)C)c2ccccc12	777940979	QAEHPORPUQWWFO-UHFFFAOYSA-N	436.490	1.632	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)CNC(=O)OC(C)(C)C)N1CCN(c2ccccc2)CC1	778605864	UFIIDJIQOXMSND-MRXNPFEDSA-N	434.541	1.052	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)c1cc([N+](=O)[O-])ccc1OC(F)F	778755860	HSGNHFIHHTYGEO-UHFFFAOYSA-N	433.368	1.665	50	20	IDGD	
Cc1onc(CC(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)c1C#N	779532194	FUJGHXPMDAROSZ-UHFFFAOYSA-N	430.896	1.016	50	20	IDGD	
CC(=O)N1CCN(C(=O)[C@H](OC(=O)/C(C#N)=C/c2cc(C#N)n(C)c2C)C(C)C)CC1	782627718	JRECOFGITNOQEJ-ACEGTKJHSA-N	425.489	1.371	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)cc1)C(=O)Nc1ccc(C(=O)NCc2ccccc2)cc1	782837763	TVMKSXJWCVNEKY-UHFFFAOYSA-N	432.436	1.722	50	20	IDGD	
CS(=O)(=O)c1ccc(F)c(NC(=O)C(=O)NNc2ccc(Cl)cc2[N+](=O)[O-])c1	783290982	IVFBWXFRERVSMZ-UHFFFAOYSA-N	430.801	1.873	50	20	IDGD	
Cc1cc(C)n(-c2ccc(NC(=O)C(=O)NNc3ccc(-n4cccn4)nn3)cc2F)n1	783435913	BYQIPKPFMFYMSO-UHFFFAOYSA-N	435.423	1.686	50	20	IDGD	
C=CCN(CC=C)C(=O)c1ccc(NC(=O)C(=O)NNc2ccc(-n3cccn3)nn2)cc1	783437042	QWXUTJPHZFFCDL-UHFFFAOYSA-N	446.471	1.558	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2nccc3sccc23)cc1S(=O)(=O)N(C)C	783438362	QVXHNAQQPFAYSW-UHFFFAOYSA-N	433.515	1.937	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)[C@@H]2CC=CC[C@H]2C(=O)N2CCOCC2)c1C	784293132	GHZQYFRUWVGWII-GUDVDZBRSA-N	429.517	1.659	50	20	IDGD	
CCn1c(NNC(=O)[C@@H]2CC=CC[C@H]2C(=O)N2CCOCC2)nc2ccccc2c1=O	784337216	NMRSQRKOOBZJMJ-HZPDHXFCSA-N	425.489	1.301	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cc(N3CCOCC3)ccn2)cc1Br	784407019	VASAZKOAHNMPCL-UHFFFAOYSA-N	435.278	1.764	50	20	IDGD	
O=C(NNc1ccnc(Br)c1)C(=O)Nc1cc(F)cc(N2CCOCC2)c1	784828121	FKODMSAHEZSMPJ-UHFFFAOYSA-N	438.257	1.902	50	20	IDGD	
O=C(NNc1c(F)cc(F)cc1Br)C(=O)Nc1ccc(-n2nccn2)nc1	785011078	OWDZIDKUTXTICV-UHFFFAOYSA-N	438.192	1.785	50	20	IDGD	
N#C/C(=C\c1ccccc1)C(=O)OCC(=O)N(C[C@@H]1CCCO1)[C@@H]1CCS(=O)(=O)C1	785378826	SXQWSQVSKZSJTB-BAUDQRHWSA-N	432.498	1.331	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)c(C)c1	789812283	JXLUZIJDBZCWRG-ICSRJNTNSA-N	441.484	1.679	50	20	IDGD	
CN1CCC(Oc2ccc(CNC(=O)NNC(=O)COc3ccccc3O)cc2)CC1	790927184	RNEZVSKGLLIIPX-UHFFFAOYSA-N	428.489	1.775	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H]2[C@@H]3[C@@H]4[C@H]5[C@H]6C[C@@H]4[C@H]2[C@@H]6C[C@H]53)c1	792774837	YCXGAZHAEAMWIQ-PIOCQINBSA-N	443.569	1.872	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)[C@](C)(O)CN3C(=O)NC4(CCCC4)C3=O)cc2C1	792828770	XOVVFONBBJJXFV-FKIZINRSSA-N	448.545	1.250	50	20	IDGD	
CCOC(=O)c1cc(COC)cc(S(=O)(=O)NNC(=O)c2ccc3c(c2)OCO3)c1	793350404	MQVFQBXIJAVUEB-UHFFFAOYSA-N	436.442	1.362	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)c2nn(CCC(C)C)c(=O)c3ccccc23)cn1	795282692	HRQBBUMFRGTVKL-UHFFFAOYSA-N	445.501	1.470	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)N[C@@H]1C[C@H]1c1ccccc1Br	797575790	MPDRXEVQXWNJSC-GOEBONIOSA-N	442.277	1.925	50	20	IDGD	
O=C(NNC(=O)c1cc2c(s1)CCC2)Nc1cc(S(=O)(=O)N2CCCC2)ccn1	797673540	FRDYBCCQGSZYCS-UHFFFAOYSA-N	435.531	1.883	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)NCc2ccncc2OCC(F)(F)F)nc2ccccc21	798525357	RQTKLZLMIADAKP-UHFFFAOYSA-N	436.394	1.983	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)N[C@@H]3CCC[C@@H]3CNS(C)(=O)=O)n[nH]2)cc1	800749095	RZDXYHBINFVXNR-HUUCEWRRSA-N	434.522	1.047	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2N2CCOCC2)cc1	801111531	PSFMIONNJMPENT-UHFFFAOYSA-N	427.417	1.140	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)CN2CCN(c3cc(C(F)(F)F)ccn3)CC2)cc1	801542594	WXTCKWDPULOZBO-UHFFFAOYSA-N	432.406	1.555	50	20	IDGD	
NC(=O)CC[C@H](NC(=O)CCC1CCCC1)C(=O)NNC(=O)Nc1cc(F)cc(F)c1	802006067	GYSYJNFGQNLNEV-INIZCTEOSA-N	439.463	1.838	50	20	IDGD	
C[C@@](O)(CN1Cc2ccccc2C1=O)C(=O)NNC(=O)Nc1ccc(OC(F)F)cc1	802045921	ULELIDMXXJPORU-HXUWFJFHSA-N	434.399	1.848	50	20	IDGD	
CCCN(NC(=O)CNS(=O)(=O)c1ccc(CNC(C)=O)s1)C(=O)OC(C)(C)C	804593074	QNFSKLJWONMDSK-UHFFFAOYSA-N	448.567	1.341	50	20	IDGD	
CC(C)CCn1nc(C(=O)NNC(=O)N=c2ccnc3n(C)[nH]cc2-3)c2ccccc2c1=O	806489733	BMSXWYUYARHUKZ-UHFFFAOYSA-N	448.487	1.564	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cccc(F)c2Cn2cccc(C)c2=O)c(C)o1	806973316	KKSBPMGVBZGJGD-UHFFFAOYSA-N	440.431	1.954	50	20	IDGD	
Cc1cc(F)c(Br)cc1NC(=O)C(=O)NNc1ccc(-n2ccnc2)nn1	807428858	IBNUDIGUAMFFIF-UHFFFAOYSA-N	434.229	1.954	50	20	IDGD	
COc1cc(C(=O)NN=Cc2c(N(C)C)n(C)c(=O)n(C)c2=O)ccc1OCCC(C)C	807956474	OGZPDRZQRFCPFU-UHFFFAOYSA-N	445.520	1.347	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)C(=O)OC3)cc1	808934957	ZGORDDGUBLKSAN-LBPRGKRZSA-N	427.413	1.309	50	20	IDGD	
CCc1ccc(S(C)(=O)=O)cc1C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	812727849	YLQMHMKLTZHJFA-UHFFFAOYSA-N	425.532	1.660	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)N2CCN([C@H](C)C(=O)NC3CC3)CC2)c1C	812757802	VICIGQGGGVEZAT-SQVRNEIYSA-N	427.549	1.470	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)c1ccc(CSc2nncn2C)cc1	860472688	CVOVDEPASFOBHP-UHFFFAOYSA-N	427.486	1.956	50	20	IDGD	
O=C(NNC(=O)c1ccc[nH]1)c1cccc(S(=O)(=O)N2CCc3sccc3C2)c1	913471265	ZUQJQZRLMARZTL-UHFFFAOYSA-N	430.511	1.898	50	20	IDGD	
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)NNC(=O)c1nn(-c2ccccc2)cc1O	914535935	YRBZMIIRLYFHLW-UHFFFAOYSA-N	448.483	1.958	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)CCc2c(C)c3c(C)nn(C)c3[nH]c2=O)cc1	914940476	HBFNNBTWMGMMSP-UHFFFAOYSA-N	439.472	1.124	50	20	IDGD	
COc1c(C)cc(S(=O)(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1C	915184863	CIDMVQTZYIRIRP-UHFFFAOYSA-N	426.520	1.228	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)[C@H](Cc2cccc(F)c2)n2nnnc2C)cc1OC	915690118	ISIILHCSCOAXHR-KRWDZBQOSA-N	442.451	1.773	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)NCc1nnc2ccc(C(F)(F)F)cn12	916222733	OEZKKRRVEDULSV-UHFFFAOYSA-N	433.350	1.529	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)NCCCN1CCN(c2ccccc2)CC1	916490287	ZSSQCOHILDQVAI-UHFFFAOYSA-N	429.496	1.747	50	20	IDGD	
C[C@H]1C[C@@H](C)CN(CCCCNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)C1	916506126	YKTLSZSCXCOUFL-IYBDPMFKSA-N	438.598	1.682	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)c3ccc(C)cc3C)CC2)cc1	916728414	JPHOQRIOZAYFEH-UHFFFAOYSA-N	444.557	1.379	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])[nH]1)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	918008110	HYHBGUCTCFFWIC-UHFFFAOYSA-N	432.400	1.700	50	20	IDGD	
Cc1nc2cc(C(=O)NNC(=O)N[C@H]3CCS(=O)(=O)C3)ccc2n1-c1ccccc1	919884935	LSCDIZYCLYSUJB-HNNXBMFYSA-N	427.486	1.465	50	20	IDGD	
O=C(NNC(=O)c1cc2c(F)cc(Br)cc2[nH]1)N[C@@H]1CCS(=O)(=O)C1	919885064	JQPDDAXSNDFPAF-MRVPVSSYSA-N	433.259	1.201	50	20	IDGD	
Nc1cnnc(NNC(=O)[C@@H]2CCN(c3cccc(Br)c3)C2=O)c1Cl	1319425649	VCIDTPDQNJPKMD-JTQLQIEISA-N	425.674	1.971	50	20	IDGD	
CC(C)[C@@H](C(=O)NNC(=O)c1cncn1-c1ccccc1)N1C(=O)c2ccccc2C1=O	1321994286	CWFAPDLRZYGBSH-IBGZPJMESA-N	431.452	1.954	50	20	IDGD	
CS(=O)(=O)c1cc(C(=O)NNC(=O)c2n[nH]c3c2CCCC3)ccc1Br	1322213135	HQSUQFKWZLGCCV-UHFFFAOYSA-N	441.307	1.529	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCCC(=O)N2CCC[C@H](C)C2)nc1	1351925098	SKEUAFPEQGUNDN-HNNXBMFYSA-N	440.570	1.387	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(O)nc4ccccc34)C2)C1	1777763718	RBQGOWLHTMPWMO-KKSFZXQISA-N	433.892	1.638	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Br)C2)c1ccnc(Cl)n1	1779682169	PBXKFLGQUYHFIW-BFQNTYOBSA-N	449.708	1.948	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)[C@H]1SC(=N)NC1=O)C2	1780702522	KBELBSVGVDIJFZ-GSMIOKPBSA-N	444.985	1.320	50	20	IDGD	
CCC(=O)N[C@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Br)C1	1780770198	HTLALQYLJWSFQD-ALYFQZSWSA-N	436.322	1.106	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc3n(n1)CCC3)C2	1781997825	LJDJNKQJKUIZQP-VVFCZOMOSA-N	439.354	1.740	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)n2cc(C)cn2)C1	1782515103	DNJLFXIEZFKKMP-WOCWXWTJSA-N	426.945	1.520	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(OC)cn3)CCO2)C1	1783347979	QZANVRKUCDKQJH-KBXCAEBGSA-N	426.311	1.707	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cnc4[nH]ncc4c3)CCO2)C1	1783348861	CNHTWYRXPZAECL-RDTXWAMCSA-N	436.310	1.575	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1CCc3nc[nH]c3C1)CCO2	1783355006	GVZQWZIHUIPECZ-TYILLQQXSA-N	439.354	1.518	50	20	IDGD	
C[C@H](O)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](Br)Cc1ccccc1)CCO2	1783525791	OAIUTVFVMQLQST-QOKNQOGYSA-N	425.323	1.203	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3n[nH]c4ccc(C#N)cc34)CCO2)C1	1783536270	ILBOUROGHIQHAQ-HXPMCKFVSA-N	446.305	1.661	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3ccc(C#N)cc3)[C@H]2C1	1783605195	IJGYMOJTERAJDS-UFYCRDLUSA-N	429.593	1.932	50	20	IDGD	
COC(=O)N[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Cl)C[C@@H]21)c1ccccc1	1783876481	NGUPBBWBWOJTDI-SMLCLMEVSA-N	441.887	1.598	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)C1CCC(F)(F)CC1)CCO2	1783933228	FBHFPAJDQCBXRI-IBGZPJMESA-N	430.496	1.015	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3C[C@H]4CC[C@@H]3O4)C[C@@H]21	1783973494	BPTPMKHLPXQMBU-KDNLLOOPSA-N	429.355	1.565	50	20	IDGD	
Cc1nccn1CCCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1784409890	TXQRBMUDACJEIR-NVXWUHKLSA-N	431.306	1.492	50	20	IDGD	
COc1ccc(CC(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)cc1F	1784704347	MAVYKLJCPVSQQT-YJYMSZOUSA-N	443.313	1.990	50	20	IDGD	
Cc1cccnc1CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21	1785206086	LPNDJBZWQJOHKE-ILXVDBEPSA-N	442.329	1.993	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(OC(F)F)cn3)[C@H]2C1	1785746195	CETTYPJYFVKETB-PCBIJLKTSA-N	447.866	1.530	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc(C#N)cc3)C[C@@H]21	1788762473	WDCFZZLTZLBIRO-UFYCRDLUSA-N	429.593	1.932	50	20	IDGD	
CCOC(=O)C(C)(C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]2C1	1791065052	PUVCXEOBQDANCU-RFGFWPKPSA-N	433.343	1.339	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccn(C(F)F)c3=O)C[C@@H]21	1791255440	RPSAZTQHZZDOHF-MHEUCROKSA-N	447.866	1.091	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCCC(F)(F)F)C[C@@H]21	1791288045	PLZCWUMJDHHWLR-KKUMJFAQSA-N	436.475	1.072	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(N2CCN(C)CC2)cc1	1792458657	WAKMAISEAXHJEN-KOUHRCEDSA-N	448.995	1.659	50	20	IDGD	
Cc1cccc(-c2ncccc2C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](O)CCl)c1	1792977365	ULYLMJQPUJKGHZ-HNJRGHQBSA-N	443.931	1.860	50	20	IDGD	
CC(C)(Cc1ccccc1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc(B(O)O)c1)C2	1792996028	BOVKPTQWLYAVEC-KOUNCHBCSA-N	434.345	1.887	50	20	IDGD	
CN(C)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@](C)(Cl)CCl)C2	1794472057	CAVXJYBELOWZQE-UESRRSCYSA-N	429.348	1.587	50	20	IDGD	
COc1ccc(OC)c(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Cl)C3)c1	1795368520	JOKDAAJLNOYCCD-FTUNRGFVSA-N	428.888	1.760	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccsc1	1795829729	NLLVCWVPJRXVPC-KHQZIQSYSA-N	443.529	1.014	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(C)nc(O)c1	1796819376	IQNOFWSBZAXDDL-FWKYCFCSSA-N	438.488	1.481	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnc2snnc2c1	1798505289	AQAPXHIPKGPRSP-WYFUGZQLSA-N	444.344	1.526	50	20	IDGD	
COc1ncc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@](C)(Cl)CCl)cc1F	1799277372	QGYHPHMIEPXDFM-JPVZDGGYSA-N	434.295	1.669	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](OC(C)=O)C(C)C)C2	1800642139	YGRHFQXNCBPXOF-YIDVYQOGSA-N	433.343	1.337	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)Oc1cccnc1)C2	1800762890	JITNZMGHSKIRTE-IPVBOJNNSA-N	426.311	1.222	50	20	IDGD	
CN1CCCn2nc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)[C@H](F)Br)C4)cc2C1	1801184838	CBHSQKXUDUFGHK-ZWUHOBOKSA-N	442.333	1.661	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2n(n1)CCCN(C)C2	1801186949	NERHVUNHBQLWMA-XQLPTFJDSA-N	438.370	1.754	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H]1CNC(=O)C1)C2	1801438455	OFEXMFGNSPKIEU-CWUQTXRHSA-N	428.439	1.646	50	20	IDGD	
COC[C@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc([N+](=O)[O-])c3c1OCO3)C2	1802278872	BRDSLOCZSYQJTL-OPDFLTKYSA-N	439.852	1.829	50	20	IDGD	
CN(C)C(=O)NCC(=O)NC[C@@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1	1802675689	SVWDGQVQQCAJSQ-YOEHRIQHSA-N	440.342	1.144	50	20	IDGD	
N=C(N)SCCC(=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@H]1c1cccnc1	1807128784	GWDBHNDOLAFKRE-FPMFFAJLSA-N	446.346	1.795	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)c1cc(C(F)F)no1	1807721226	YVKRSJSPLRJFRA-NJZAAPMLSA-N	428.823	1.927	50	20	IDGD	
O=C(CCN1CCCCC1)N1CCCC2(CCN(C(=O)c3ccc(B(O)O)cc3)CC2)C1	1809318113	HWLMZKNSJRHZDW-UHFFFAOYSA-N	441.381	1.087	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2ccc3ncnn3c2)[C@@H]1c1cccnc1	1810060028	NVJNRTJHKFIJEC-IEZWGBDMSA-N	442.907	1.698	50	20	IDGD	
Cn1ncc(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)c1Cl	1811165398	RSQLZFDMJADUPT-QEJZJMRPSA-N	426.304	1.388	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1ccc(O)cc1	1811933382	ZBSMVICZBCJANC-KNQAVFIVSA-N	445.284	1.100	50	20	IDGD	
O=C(/C=C/c1ccccc1)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2	1814033166	XBLNMMNBIFXEOM-ZPHJMFTNSA-N	447.325	1.762	50	20	IDGD	
C[C@H](CBr)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](C)n2cnnn2)[nH]n1	1814783437	OLQUREQKKNEZHY-NTZNESFSSA-N	439.318	1.681	50	20	IDGD	
COC(=O)NCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](C)CBr)n[nH]1	1814783963	YKTRBNDNMPZGSA-ZYHUDNBSSA-N	430.303	1.789	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)Cc2ccc3ncnn3c2)[nH]n1)[C@@H](O)CCl	1814871612	APETXZYORPZNCW-CABCVRRESA-N	431.884	1.287	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H]2CCC(=O)N2)n[nH]1	1816972721	FWWAXAHEBSLCQJ-NTZNESFSSA-N	426.315	1.854	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2coc(Cl)n2)[nH]n1)c1ccc(B(O)O)cc1	1817470879	KGKUNYDSTYXXAD-OAHLLOKOSA-N	443.656	1.351	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCC1CCC1)CC2	1819792784	AQFQTJURBHARMG-CYBMUJFWSA-N	442.545	1.948	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc[nH]1)CC2	1819797873	NXXVQYVYWCYHLW-JTQLQIEISA-N	425.474	1.009	50	20	IDGD	
Cc1ccn(CC(=O)N[C@@H]2CCc3nc(NC(=O)[C@H](F)Br)sc3C2)n1	1823002966	VTYSALPUTREHBE-RNCFNFMXSA-N	430.303	1.951	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2nc(C)c(C)[nH]c2=O)CC1	1825448524	JMAGCAWLWCHDOO-SJORKVTESA-N	438.956	1.874	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc3ncnn3c1)CC2	1825999626	AWNUZOQQARCJOJ-NEPJUHHUSA-N	434.909	1.665	50	20	IDGD	
O=C([C@H]1[C@H]2SC=C[C@H]21)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827060287	FSZSHMBBAYSHSP-BQJUDKOJSA-N	440.374	1.475	50	20	IDGD	
COCCn1nccc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H](O)CCl)CC1	1827809781	HUHVUMYUMJXFNH-WMZOPIPTSA-N	426.945	1.363	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CN2CCN(C)CC2)CC1	1828444735	YLBGBFFOUXWJPM-WMZOPIPTSA-N	443.430	1.637	50	20	IDGD	
C[C@H](O)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Cl)CCN2C(=O)OCc1ccccc1	1829057589	ZHCARNAQHJCYKS-UVFQYZLESA-N	441.887	1.354	50	20	IDGD	
CC(=O)N[C@@H](C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2)C(C)(C)C	1830353402	BHLTWXHSIICSHF-HRAATJIYSA-N	445.988	1.259	50	20	IDGD	
O=C([C@H](F)Cl)N1CCC([C@H]2CCCCN2C(=O)Cn2cccc([N+](=O)[O-])c2=O)CC1	1831186717	BXNRQCUSGYPXRV-PBHICJAKSA-N	442.875	1.911	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCn3nc(C)cc3C)C2)C1	1831656672	HEPRIYPNBIURRH-GHTZIAJQSA-N	440.972	1.754	50	20	IDGD	
CC[S@](=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1	1831873630	QTUUJOQBNOSQQF-JJCDCTGGSA-N	442.626	1.138	50	20	IDGD	
Cc1nccn1CC(=O)N1CCC([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1	1831874349	HHINUTLVMYHQBU-LJQANCHMSA-N	432.569	1.184	50	20	IDGD	
C[C@H](C(=O)NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1)C1(O)CCC1	1833070666	GXRBMOIQRLTWMY-CZUORRHYSA-N	448.377	1.800	50	20	IDGD	
CN1CCCC[C@@H]1C(=O)NC1CCN(C2CCN(C(=O)CO[Si](C)(C)C)CC2)CC1	1833317896	OMTHAZYAXXCXKF-HXUWFJFHSA-N	438.689	1.894	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)s1	1833959266	CBAWSVWIMKSLSC-BBRMVZONSA-N	435.315	1.817	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](C)CBr)C3)C2)no1	1834343562	LQOCHZOUJGUYQZ-SJCJKPOMSA-N	430.299	1.084	50	20	IDGD	
CC(=O)C[C@@H](C)C(=O)N1CCC(N2CCC(NC(=O)CCBr)CC2)CC1	1834423672	UAMWVLLMMLYXFM-CQSZACIVSA-N	430.387	1.958	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)c3ncccc3F)C2)C1	1834823047	GLYMYYGIMCLTTI-KRWDZBQOSA-N	430.274	1.076	50	20	IDGD	
CCc1ccnc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)c1	1836360462	YKCRRJANEBQGIN-QAPCUYQASA-N	444.301	1.405	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](CC)NC(N)=O)CC2)CC1	1836920169	YVEUPXLZEHVPMN-DLBZAZTESA-N	430.977	1.839	50	20	IDGD	
C[Si](C)(C)C#CCCCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1	1837426996	ISXNTUIYACRJQV-FXAWDEMLSA-N	445.032	1.094	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnc4snnc4c3)CCO2)C1	1838510048	VOCGNUWVQUDXJW-SCLBCKFNSA-N	439.925	1.174	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(O)cc3)CCO2)C1	1838971648	KGWJNPQBQHTUAR-UGSOOPFHSA-N	427.295	1.246	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccncc3)CCO2)C1	1839060220	VBQNIQRDBQBSHG-RTBURBONSA-N	430.332	1.317	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1C[C@H]1F)CCO2	1839099260	BPIFVCGKEKTVAO-BWXQDXLFSA-N	449.429	1.686	50	20	IDGD	
O=C(c1ccoc1Cl)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839201650	FBXIKBRJGOCQGQ-ABAIWWIYSA-N	439.665	1.694	50	20	IDGD	
C=C(C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)Br)C2)C1)C(F)(F)F	1839894578	GKMOVCAIFLGGFS-SMDDNHRTSA-N	429.233	1.345	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C)ccn3)C2)C1	1839964237	KUCBLPYEQJKEQS-BEFAXECRSA-N	440.338	1.634	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(F)c[nH]3)C2)C1	1839966409	CVDMICZMXYHCGN-CXAGYDPISA-N	432.290	1.397	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccccc3F)C2)C1	1840034501	NUONUKNSAIFJBH-SCLBCKFNSA-N	429.286	1.679	50	20	IDGD	
CCOc1ncccc1C(=O)N1CCCC12CN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2	1840979177	AEPYPHVCTMKDIF-MFKUBSTISA-N	438.488	1.431	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1O)C2	1841668920	COGBJKRDBRKFEG-JYJNAYRXSA-N	443.972	1.825	50	20	IDGD	
O=C([C@@H](F)Br)N1CC2(CCCN2C(=O)c2ncn(-c3cccc(F)c3)n2)C1	1842169480	BHLGULYPTRFUPL-CYBMUJFWSA-N	440.248	1.914	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2noc3c2CCCC3)C1	1843257637	FMARMMOXWVWSPZ-ZVHZXABRSA-N	438.488	1.504	50	20	IDGD	
O=C([C@H](O)CCl)N1CC2(CCCN2C(=O)c2cc(Br)cnc2Cl)C1	1844409216	VFVMTXYTHNZNPP-LLVKDONJSA-N	437.121	1.914	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC12CN(C(=O)[C@@H]1CCN1C(=O)OC(C)(C)C)C2	1846175826	UTJOMZKZMLVVQY-OLZOCXBDSA-N	430.343	1.983	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@](C)(O)C[C@H]1C(=O)N1CCCC12CN(C(=O)[C@@H](F)Cl)C2	1846230599	WKVQZDLEHUUDGN-VEVIJQCQSA-N	433.908	1.485	50	20	IDGD	
Cc1ccc(N2C(=O)C[C@H](C(=O)NNC(=O)C(=O)NC3CC3)[C@H]2c2cccs2)cc1	11684138	JHFAVOVRPURSTG-YJBOKZPZSA-N	426.498	1.577	50	20	IDGD	
Cc1sc2nc(CC(=O)NNC(=S)Nc3ccc4c(c3)OCCO4)[nH]c(=O)c2c1C	17450724	JAVWOIDNMUPKGO-UHFFFAOYSA-N	445.526	1.933	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CSc2nnc(-c3ccoc3C)n2C)cc1OC	21367761	KCHXVEBITMABKO-UHFFFAOYSA-N	431.474	1.954	50	20	IDGD	
Cc1ccc(C)c(S(=O)(=O)NCCC(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)c1	21967879	GWLWINWQMCDKBK-HNNXBMFYSA-N	437.493	1.726	50	20	IDGD	
COc1ccc([C@H](CNC(=O)NNC(=O)CNC(=O)c2ccco2)N2CCCC2)cc1	725871829	HHQFFCHQIZYHFU-KRWDZBQOSA-N	429.477	1.186	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cccn2C)cc1S(=O)(=O)N[C@@H]1CCCC[C@H]1C	726540517	GXDCLDGQUPFRHR-GDBMZVCRSA-N	448.545	1.966	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2cc([N+](=O)[O-])cc3c2OCCO3)c2ccccc2c1=O	727365328	PUMQHERBULBDJQ-UHFFFAOYSA-N	439.384	1.171	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)c2ccc(C)c(S(=O)(=O)NCC#N)c2)c1	728151175	VXFJZXMRGSRLTG-UHFFFAOYSA-N	430.486	1.254	50	20	IDGD	
COCCn1cc(C(=O)NNC(=O)c2ccc(Br)cc2Cl)ccc1=O	728829170	AKVDIHBKWQEKRS-UHFFFAOYSA-N	428.670	1.985	50	20	IDGD	
O=C(NNC(=O)N1CCC[C@@H](OCC(F)(F)F)C1)C1CCN(c2ncccn2)CC1	728958844	FWZAOVJTHOPHRZ-CQSZACIVSA-N	430.431	1.477	50	20	IDGD	
CN(C)[C@H](CNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)c1ccccc1Cl	729044647	MJCUWMGXYTVCGL-GOSISDBHSA-N	445.955	1.980	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Cc2c(C)nc3cc(O)nn3c2C)ccc1OC(C)C	729282260	OFUDMFHJWWWLKQ-UHFFFAOYSA-N	427.461	1.851	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@@H]2C(=O)NNC(=O)CNc2ccccc2)c(OC)c1	729513238	DUGMUNAWDFJCOM-GOSISDBHSA-N	426.473	1.568	50	20	IDGD	
CCOc1ccccc1N1C[C@@H](C(=O)NNC(=S)Nc2ccc(OC)nc2)CC1=O	729693089	HZSKSDIAPNFTQF-ZDUSSCGKSA-N	429.502	1.860	50	20	IDGD	
NC(=O)c1ncn2c(C(=O)NNc3c(F)c(F)nc(F)c3F)cc(-c3ccco3)nc12	729835266	BVVIOALQJPBDMO-UHFFFAOYSA-N	435.297	1.797	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)NC2CC2)cc1)NNC(=O)CCc1ccccc1O	730033718	PCIKWIZUJXSQGK-UHFFFAOYSA-N	431.514	1.546	50	20	IDGD	
Cc1nn(Cc2ccccc2)c(Cl)c1C=NNC(=O)CSc1nnc(O)nc1O	730557928	BFSXQCYFIHLHRQ-UHFFFAOYSA-N	433.881	1.732	50	20	IDGD	
CC(C)N(C)S(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)COc2ccccc2O)c1	730782467	OUIXVQSSTQQUPS-UHFFFAOYSA-N	439.465	1.400	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)Nc1ccc(CN2C(=O)CSC2=O)cc1	730904603	TVGNVHDRLBBASC-UHFFFAOYSA-N	430.442	1.819	50	20	IDGD	
O=C(COC(=O)c1ccccc1S(=O)(=O)CC(F)F)NNC(=O)c1ccccc1	731265051	ZYEAMFPGNHHORZ-UHFFFAOYSA-N	426.397	1.343	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)N1CCN(Cc2nc(O)c3ccccc3n2)CC1	731499894	OPRLOISFIWKRJJ-UHFFFAOYSA-N	436.472	1.516	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)N1CCN(CC(=O)N[C@@H]2CCC[C@@H](C)C2)CC1	731499959	SVUBDBGCQKYMEM-IAGOWNOFSA-N	431.537	1.362	50	20	IDGD	
CC(C)[C@@H](NC(=O)c1cccs1)C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C	734241212	IHXSNCRGEHTJDI-CYBMUJFWSA-N	427.527	1.358	50	20	IDGD	
CCc1cc(NNC(=O)[C@@H](CC)N=c2nn[nH]n2-c2ccccc2)nc(-c2ccccn2)n1	738538178	FXFMFVGNZCBMKT-QGZVFWFLSA-N	444.503	1.832	50	20	IDGD	
O=C(NNc1ncnc2[nH]cnc12)c1ccc(S(=O)(=O)NCc2cccs2)cc1	740746433	COYLZEHQDHUJOT-UHFFFAOYSA-N	429.487	1.650	50	20	IDGD	
CC(C)Cn1c(SCC(=O)NNC(=O)c2ccc(C#N)cc2)nnc1N1CCOCC1	742450836	HIUUUQNOOMXYSK-UHFFFAOYSA-N	443.533	1.196	50	20	IDGD	
Cc1nsc(N2CCCN(C(=O)NNC(=O)c3cc(Br)c[nH]3)CC2)n1	743508828	UZIASXSOQWKWMG-UHFFFAOYSA-N	428.316	1.504	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)c1c(Cl)cccc1Cl)N1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O	744362204	XNQFERFUVCDDEZ-BZUJLINESA-N	426.256	1.305	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2nc(C(C)C)ncc2Cl)cc1OC	744673006	CFFJRCSQSSOSJP-UHFFFAOYSA-N	436.852	1.889	50	20	IDGD	
O=C(NCc1noc(-c2cccs2)n1)NNC(=O)c1nn(-c2ccccc2)cc1O	745183149	NSCBREPMDOWASU-UHFFFAOYSA-N	425.430	1.834	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)NCCOc2ncc(C(F)(F)F)cc2Cl)n1	745850901	ZBVQROCHZBQEGO-UHFFFAOYSA-N	434.806	1.977	50	20	IDGD	
C[C@H](CCc1cccn1C)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	745876073	VTTLIRZOVWAZDA-MRXNPFEDSA-N	447.561	1.775	50	20	IDGD	
COc1ccccc1O[C@H](C)CNC(=O)NNc1ccc(S(=O)(=O)NC(C)C)cn1	745901487	KATHYGUJWWPAKY-CQSZACIVSA-N	437.522	1.871	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)N[C@@H]2CCN(c3cc(C)nn3C)C2=O)cc1OC	745906763	UMMCKPDAGITSMH-OAHLLOKOSA-N	444.492	1.275	50	20	IDGD	
CS(=O)(=O)CC[C@@H](NC(=O)c1ccccc1Cl)C(=O)NNc1ccc(C#N)cc1	748101900	PKFRTVGHGGSJNO-QGZVFWFLSA-N	434.905	1.888	50	20	IDGD	
O=C(CN1C(=O)[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1	748523604	XCSICYATNKUSNH-FCIDVOKBSA-N	443.403	1.230	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12	749404338	ZXBBMVJGXYYBNI-UHFFFAOYSA-N	430.446	1.752	50	20	IDGD	
C#CCNC(=O)COC(=O)/C(C#N)=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	749416663	QZJOWUMWXVBPNB-GDNBJRDFSA-N	439.859	1.278	50	20	IDGD	
Cn1ccnc1[C@](O)(CCNC(=O)NNC(=O)c1cc2ccccc2o1)C(F)(F)F	749548613	WYAIGMDXABUAEC-QGZVFWFLSA-N	425.367	1.951	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)[C@H]2CCCN(C(=O)C3CC3)C2)c2ccccc2c1=O	749562014	UOVMKYRNLNBMQS-HNNXBMFYSA-N	425.489	1.387	50	20	IDGD	
CN(C)c1ccnc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)c1	749715774	VVXMVFCVQKLSJN-UHFFFAOYSA-N	431.518	1.397	50	20	IDGD	
C[C@H](NC(=O)OCc1ccccc1)C(=O)OCC(=O)NNC(=O)c1cccc(Cl)c1	750293009	LQYNPTMGOSTNFE-ZDUSSCGKSA-N	433.848	1.959	50	20	IDGD	
Cn1c(C(=O)NNC(=O)c2cc(Br)c[nH]2)cc2c(=O)n3ccccc3nc21	750842442	QVADELOMOCPKDT-UHFFFAOYSA-N	429.234	1.352	50	20	IDGD	
CCOC(=O)[C@H]1Cc2cc(S(=O)(=O)NNC(=O)c3c(C)nc4ccccn34)ccc2O1	751538865	QGIDLQDYXUTOTO-MRXNPFEDSA-N	444.469	1.133	50	20	IDGD	
O=C(CCCCc1cnn[nH]1)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	753984763	HFLLHKXJAWIDJE-UHFFFAOYSA-N	448.530	1.841	50	20	IDGD	
O=C(CCSc1ccccn1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	755036457	DVOLBYUNMSXKFN-UHFFFAOYSA-N	434.543	1.810	50	20	IDGD	
O=C(Cc1ccc2c(c1)COC2)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	755517415	MMHAFGYZSSGHFD-UHFFFAOYSA-N	442.947	1.878	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)Nc1ccc(CC(=O)N2CCOCC2)cc1	755861230	CGCUYGSMHPJDEV-HNNXBMFYSA-N	444.463	1.847	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)Nc1nc2cc3c(cc2s1)OC(F)(F)O3	756505963	YXLHWCSHMNYXTK-LURJTMIESA-N	434.402	1.205	50	20	IDGD	
CC(C)(C)c1ccc(OCC(=O)NNC(=O)Nc2cnn(CC(=O)NC3CC3)c2)cc1	756795074	GNINKPIKBVEPFO-UHFFFAOYSA-N	428.493	1.691	50	20	IDGD	
COCCN(C)S(=O)(=O)NC(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccccc1	757334005	UQDHPIDUGLGVCI-GHRIWEEISA-N	442.501	1.310	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@H]2CCN(C(C)=O)c3ccccc32)c2ccccc2c1=O	757786091	GUFGAUPWNILEQY-SFHVURJKSA-N	448.483	1.858	50	20	IDGD	
Cc1noc(C[C@H](NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c2ccccc2)n1	758851995	DGVWSEIVPJIJBC-KRWDZBQOSA-N	433.432	1.282	50	20	IDGD	
CCNS(=O)(=O)c1ccc(CC(=O)NNC(=O)CCSc2ccc(F)cc2)cc1	759355286	CTHREDKYXAJVDB-UHFFFAOYSA-N	439.534	1.996	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H](C)c2nnc(C)s2)c1	760142441	PRTHSAADEMKPOH-NSHDSACASA-N	440.551	1.582	50	20	IDGD	
CCOC(=O)c1cnn2c(C(=O)NNC(=O)COc3ccccc3OCC)ccnc12	760186320	NGNHXWBVGRPXQV-UHFFFAOYSA-N	427.417	1.145	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccnn2[C@H](C)C2CC2)nc1	760308495	XRXHSMPNYFNMNQ-GFCCVEGCSA-N	435.510	1.018	50	20	IDGD	
COc1ccc2c(c1)[C@@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)N3CCCC3)c1)CC2	761393175	UJDUPVCIBZTUMY-IBGZPJMESA-N	443.525	1.971	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2ccccc2N2C[C@H](C)O[C@@H](C)C2)c1	763623793	NIIFABKYSCVYIC-IRXDYDNUSA-N	440.500	1.774	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(Cl)c2-n2cccn2)cc1	763661868	QAELSBHABTZKBS-UHFFFAOYSA-N	443.847	1.699	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c(C)c1	763718441	LTUJJHMAAMCIQQ-UHFFFAOYSA-N	448.501	1.044	50	20	IDGD	
Cc1noc(COc2ccc(NC(=O)C(=O)NNC(=O)c3cccc(N(C)C)c3)cc2)n1	763759569	YYUZFXMYCFKKLH-UHFFFAOYSA-N	438.444	1.423	50	20	IDGD	
COc1ncc(NC(=O)C(=O)NNC(=O)c2ccc(OCCC(C)C)cc2)cc1C(N)=O	763768526	SSIGZJTWEJABCA-UHFFFAOYSA-N	443.460	1.014	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)N2CCc3c(Cl)cccc32)c2ccccc2c1=O	763785119	FQSGDNJCYZFTKH-UHFFFAOYSA-N	439.859	1.420	50	20	IDGD	
CCOc1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])ccc1OC	763805691	VUWGBLGHSWVFOZ-UHFFFAOYSA-N	432.389	1.167	50	20	IDGD	
CON(C)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)cc1	763847314	ANFJLJJQAYLQMS-HNNXBMFYSA-N	442.472	1.490	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cnn(C)c2C(F)F)cc1	763861479	PVWZVRAHKVFJEO-SNVBAGLBSA-N	425.392	1.310	50	20	IDGD	
CO[C@@H](C)C(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)c1	763867020	YHXYVJMXYXMLFE-QWHCGFSZSA-N	446.435	1.353	50	20	IDGD	
CCOC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)cc1	763867312	ZQLPTLQOXMIFFF-GFCCVEGCSA-N	432.408	1.948	50	20	IDGD	
COC(=O)Cc1ccccc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccc(C(C)=O)cc1	763872579	OSIFNMVRGIASRW-AWEZNQCLSA-N	441.440	1.158	50	20	IDGD	
CC(=O)Nc1cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(C(C)=O)cc2)ccc1F	763873333	VYPMLYMPFJEXNK-LBPRGKRZSA-N	444.419	1.540	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1ccc(=O)n(Cc2ccccc2)c1	764004691	QZZFGQTZQRTCOO-UHFFFAOYSA-N	448.435	1.068	50	20	IDGD	
CCN(CC)C(=O)c1ccccc1NC(=O)C(=O)NNC(=O)c1cccc(OC)c1O	764133977	ZMJRIMOVUKSWLJ-UHFFFAOYSA-N	428.445	1.283	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1cccc(Cl)c1N1CCOCC1	764136412	QDFJQVCHRNQNBH-UHFFFAOYSA-N	446.891	1.514	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)OC(F)(F)O3)o1	764139676	YCHWGFUKTRAQPK-UHFFFAOYSA-N	438.387	1.843	50	20	IDGD	
CN(C)C(=O)c1cc(NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)ccc1Cl	764152759	VAFMLXHIFASUJM-MRXNPFEDSA-N	430.848	1.131	50	20	IDGD	
CS(=O)(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2c(Cl)cccc2Cl)c1	764221375	ORJQNKDJHXPMCK-UHFFFAOYSA-N	430.269	1.797	50	20	IDGD	
COc1ccc(NC(=O)c2cccc(NC(=O)C(=O)NNC(=O)Cc3ccccn3)c2)cn1	764263898	KUKSDYMIYILMQE-UHFFFAOYSA-N	448.439	1.066	50	20	IDGD	
C[C@H](C#N)Oc1ccccc1NC(=O)C(=O)NNC(=O)c1cc(Br)ccc1O	764280769	SPBJWVYJCZJFBD-SNVBAGLBSA-N	447.245	1.845	50	20	IDGD	
O=C(CCCc1cccs1)NNC(=O)C(=O)Nc1cccc(C(=O)N2CCOCC2)c1	764343105	OCWHUHQOJMGKBO-UHFFFAOYSA-N	444.513	1.329	50	20	IDGD	
COC(=O)c1c(F)cccc1NC(=O)C(=O)NNC(=O)C(F)(F)Oc1ccccc1	764380160	PZLWLZIIZASPAO-UHFFFAOYSA-N	425.319	1.370	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1ccc(-n2ccnc2C)nc1	764397150	GJCFFEXYYQLJJL-UHFFFAOYSA-N	440.485	1.463	50	20	IDGD	
C[C@H](CC(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1)C1CCN(C(=O)OC(C)(C)C)CC1	764617406	UJJIVTPWCBZQOW-UKRRQHHQSA-N	431.555	1.242	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)c1cc(F)ccc1Br)S(=O)(=O)C1CCOCC1	765407083	XTTKDTNHVPEMFI-VIFPVBQESA-N	437.287	1.332	50	20	IDGD	
O=C(CSc1nnc(-c2ccncc2)n1Cc1ccco1)NNC(=O)Cc1ccncc1	765489110	CBUUGJRLBXMYKW-UHFFFAOYSA-N	449.496	1.859	50	20	IDGD	
O=C(CCc1ccc(Cl)cc1)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765739196	QTMDUTDSHFBLAT-UHFFFAOYSA-N	428.920	1.878	50	20	IDGD	
C[C@H](NC(=O)OC(C)(C)C)[C@@H]1COCCC1=NNC(=O)Cc1cc(O)nc(S)n1	766016529	AZGHJYCUXPWANI-JQWIXIFHSA-N	425.511	1.435	50	20	IDGD	
CC1CCC2(CC1)NC(=O)N(NC(=O)COC(=O)[C@H](Br)C(C)(C)C)C2=O	766749829	FJJBKURNURQDKW-FBWYHRDQSA-N	432.315	1.871	50	20	IDGD	
COc1cc(OC)cc(S(=O)(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)c1	767736124	OXSGMJMTKLAWTA-UHFFFAOYSA-N	446.485	1.618	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)c2ccc(C[C@H]3CC(=O)NC3=O)cc2)n[nH]1	768274354	RLWZUXIGJJSEHE-HNNXBMFYSA-N	447.451	1.365	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)NC3CCN([C@H]4CCCC[C@H]4O)CC3)nc21	770411327	GDHMFFDOICVUTR-JKSUJKDBSA-N	446.556	1.681	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1cccc(C(F)(F)F)c1)C(=O)NNC(=O)c1ccccc1O	770951195	PQNSJZWUJJNIHG-SNVBAGLBSA-N	431.392	1.539	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)c1ccc(CCNS(C)(=O)=O)cc1	772991557	VBZOPGDFVWHOED-ZDUSSCGKSA-N	439.921	1.660	50	20	IDGD	
Cc1ccc(C(=O)N2CCOCC2)cc1NC(=O)C(=O)NNc1ccccc1[N+](=O)[O-]	773655966	WTPWOLCOCVBRKA-UHFFFAOYSA-N	427.417	1.457	50	20	IDGD	
CCc1ccnc(C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1	774807878	XZABIIMLFAQGNP-UHFFFAOYSA-N	446.529	1.059	50	20	IDGD	
O=C(NCCc1cnccn1)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	775453982	HFPDZNPCBROCGB-UHFFFAOYSA-N	443.471	1.365	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)N[C@H]2CCCOc3cc(F)ccc32)c2ccccc2c1=O	777750055	CTMCLUOZBPHUCW-INIZCTEOSA-N	425.420	1.931	50	20	IDGD	
COC(=O)c1cn(C2CN(C(=O)/C(C#N)=C\c3cc(C)n(C[C@H]4CCCO4)c3C)C2)nn1	779550258	UQNXBWVKCHIFII-OGHDXOPJSA-N	438.488	1.653	50	20	IDGD	
Cn1c(=NNC(=O)C(=O)Nc2ncn(Cc3ccc(C#N)cc3)n2)sc2ccccc21	783352556	YMWBAEJQDNZDAM-UHFFFAOYSA-N	432.469	1.322	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2ccc(Oc3ccc(Cl)cc3)nc2)CCS(=O)(=O)C1	783427908	UFBNBWHMENMTDB-SFHVURJKSA-N	438.893	1.664	50	20	IDGD	
Cc1cc(F)ccc1NNC(=O)C(=O)N1C[C@@H](C(=O)N2CCOCC2)Oc2ccccc21	783448048	VGWSFHNUHHMWHX-IBGZPJMESA-N	442.447	1.230	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)CCC(=O)Nc2nnc(C(C)C)s2)cc1	784196435	WGBZDMFQUICNJS-UHFFFAOYSA-N	433.490	1.693	50	20	IDGD	
Cc1ccc(-n2nccc2NC(=O)C(=O)NNc2ccc(C#N)c(C(F)(F)F)c2)nn1	784232155	QMTZIXZDDNIVDG-UHFFFAOYSA-N	430.350	1.943	50	20	IDGD	
CN(C)c1ccc(S(=O)(=O)N(C)C)cc1NC(=O)C(=O)NNc1cccnc1Cl	784843222	FPOXMVSAAUGYCL-UHFFFAOYSA-N	440.913	1.133	50	20	IDGD	
O=C(NNc1ccc(Cl)nc1)C(=O)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1	784870071	AQESCCWEVGLZBM-UHFFFAOYSA-N	437.909	1.991	50	20	IDGD	
Cn1ccnc1Sc1ccc(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)cc1	785067783	NNARONVQGIYMIH-UHFFFAOYSA-N	449.496	1.548	50	20	IDGD	
COc1nc(Br)ccc1NC(=O)C(=O)NNC(=O)c1cccc(N(C)C)c1	789586350	MEEIQGLEKDOBKA-UHFFFAOYSA-N	436.266	1.318	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)N2CCN(C(=O)NCCSSC)CC2)cc1	790880349	XUHAHUIYMSGDQU-UHFFFAOYSA-N	447.604	1.890	50	20	IDGD	
O=C(NNc1cccc(F)c1[N+](=O)[O-])C(=O)Nc1ccc(Cc2nnc3n2CCC3)cc1	790998259	FBKANFTZNPQTSU-UHFFFAOYSA-N	439.407	1.944	50	20	IDGD	
CN(CCC(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1)C1CCCCC1	791139560	KZRMFVOMXKWROM-UHFFFAOYSA-N	429.565	1.246	50	20	IDGD	
CNC(=O)c1cc2cc(NC(=O)C(=O)NNc3ccnc(Br)c3)ccc2[nH]1	792360889	GLRMGHRAGHQOKN-UHFFFAOYSA-N	431.250	1.767	50	20	IDGD	
CCOC(=O)c1ccn(-c2ccccc2NC(=O)C(=O)NNc2nc3ccccn3n2)n1	792391454	ACCKYFISWMXSRY-UHFFFAOYSA-N	434.416	1.174	50	20	IDGD	
CN(C(=O)[C@@H]1CCN(CC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)C1)c1ccccc1	797529623	AZOBYWJUHCZAGB-MRXNPFEDSA-N	425.445	1.341	50	20	IDGD	
CC(C)[C@@H](C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1)c1cccnc1	797949180	JOPCNPNRLATEMT-HXUWFJFHSA-N	431.562	1.901	50	20	IDGD	
CSC[C@@H](C)C(=O)N1CCC(C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)CC1	799416550	JQBHUWWYKJPEHM-CYBMUJFWSA-N	445.586	1.079	50	20	IDGD	
O=C(N=c1cc[nH]cc1)NNC(=O)[C@H]1CCC(=O)N1Cc1ccc(Br)cc1	802035147	BIIPUUCZMIZRNT-OAHLLOKOSA-N	432.278	1.610	50	20	IDGD	
COCCNS(=O)(=O)c1c[nH]c(C(=O)NNC(=O)Nc2cc(OC)ccc2Cl)c1	802115226	VLTLFMGHECICDU-UHFFFAOYSA-N	445.885	1.068	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)N[C@H]1CCCN(C(=O)Cc2ccccc2)C1	802478184	NWDUPOBSNAIILU-SFHVURJKSA-N	438.484	1.636	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2cccc(Br)c2Cl)n1	802566165	CBHJDPPBXYRHOB-UHFFFAOYSA-N	428.674	1.702	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)CCN(C)C(=O)OC(C)(C)C)CC2)cc1	802762331	BSDFQTAYVHHEFQ-UHFFFAOYSA-N	447.580	1.517	50	20	IDGD	
N#CCCn1cc(/C=C(/C#N)C(=O)N2CC[C@](O)(C(N)=O)C2)c(-c2ccc(Cl)cc2)n1	803163894	DTBWWBAKDDBXGH-PLTPHKKDSA-N	438.875	1.473	50	20	IDGD	
CN(CCc1ccccc1[N+](=O)[O-])C(=O)NNC(=O)c1csc(N2CCOCC2)n1	804868105	VSTHKIDBSYPLMW-UHFFFAOYSA-N	434.478	1.417	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)c1cc(S(C)(=O)=O)ccc1Br	807368254	DTJVKNNMQWIMMO-UHFFFAOYSA-N	437.312	1.403	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)c1cc(Cn2cc(Br)cn2)on1	807369297	UZRYPUPBTIGJFF-UHFFFAOYSA-N	430.259	1.232	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(C)cc2)C1	807370713	SOBDRPFOTKQWNG-INIZCTEOSA-N	441.550	1.332	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)cc1	812733127	ZEQHCPXUKILOMO-UHFFFAOYSA-N	430.446	1.788	50	20	IDGD	
Cn1c(NNC(=O)C2(S(=O)(=O)c3ccccc3)CCOCC2)nc2ccccc2c1=O	813451682	CJZHJXMOYOPGSQ-UHFFFAOYSA-N	442.497	1.400	50	20	IDGD	
O=C(NNC(=O)c1ccncc1)C(=O)Nc1cc(Cl)ccc1I	815563926	SASUNJCGWXXFMJ-UHFFFAOYSA-N	444.616	1.739	50	20	IDGD	
CNC(=O)c1cc(Oc2cccc(NC(=O)C(=O)NNc3ncncc3F)c2)ccn1	815764187	WBPRFLGCCTVKLI-UHFFFAOYSA-N	425.380	1.244	50	20	IDGD	
CC(C)[C@H](NC(=O)COc1ccccc1)C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	816781438	KKVMMUFBNWCPIK-FQEVSTJZSA-N	448.545	1.600	50	20	IDGD	
Cc1cc(C)c(S(=O)(=O)NCCC(=O)OCC(=O)NNC(=O)c2ccccc2)c(C)c1	818799525	ATKCCPMXLHOHKS-UHFFFAOYSA-N	447.513	1.285	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@@H](C(=O)Nc2cccc(NC(=O)NN(C)C)c2)[C@@H](C)O)cc1	819552595	YTUYEEHFBGIFSB-RDTXWAMCSA-N	449.533	1.260	50	20	IDGD	
CCC[C@@H](C(=O)OCC)S(=O)(=O)NNC(=O)c1nn(CCC)c(=O)c2ccccc12	821126932	AHRSJFCXQSCLKS-HNNXBMFYSA-N	438.506	1.103	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)NCc2ccc(C(=O)N3CC[C@@H](B(O)O)C3)cc2)cc1	864234740	UZYSJKPCYANXQT-GOSISDBHSA-N	430.291	1.057	50	20	IDGD	
CCOC(=O)Cc1csc(NC(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)n1	875393812	NCOUDZDRDPXMNV-UHFFFAOYSA-N	438.462	1.741	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)/C(=C/c2ccccc2)n2nnnc2C)cc1	912608306	ZQVUKDFNJLAHJJ-CPOQMQJTSA-N	436.472	1.993	50	20	IDGD	
Cc1nn2c(nc(N3CCCC3)c3ccccc32)c1C=NNC(=O)[C@@H]1CCS(=O)(=O)C1	912808705	PBBNFISAPWDFQB-OAHLLOKOSA-N	440.529	1.676	50	20	IDGD	
COc1cccc(C[C@H](C(=O)NNC(=O)c2ccc3c(c2)OCCO3)n2nnnc2C)c1	915695975	GGEYCGAQPRNBRX-QGZVFWFLSA-N	438.444	1.006	50	20	IDGD	
O=C(NCCCn1ccnc1)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	915880558	KXUQYWHAYAZGMO-UHFFFAOYSA-N	445.487	1.619	50	20	IDGD	
CN1CCN([C@@H](CNC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c2cccs2)CC1	915901222	FVUFEJHKJOIXRI-INIZCTEOSA-N	432.506	1.589	50	20	IDGD	
O=C(CN1CCCS1(=O)=O)NNC(=S)Nc1cc(C(F)(F)F)ccc1Cl	916163036	JYWAAQHWDRSJND-UHFFFAOYSA-N	430.861	1.712	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NCc1ccc(N2CCN(C)CC2)nc1	916245741	WEYDQOAGXMNZRK-OAHLLOKOSA-N	430.484	1.270	50	20	IDGD	
CCOc1ccc(CNC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1OC	916391480	MJBJRZHZZPNLNQ-UHFFFAOYSA-N	425.445	1.485	50	20	IDGD	
O=C(COC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1)NNC(=O)[C@@H]1COc2ccccc2O1	917331179	NBZSXTIKRFWLSD-INIZCTEOSA-N	440.368	1.220	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)[C@H](C)NS(=O)(=O)c1cccs1	917920516	ZQKHPBNIVKKMOR-LBPRGKRZSA-N	435.531	1.175	50	20	IDGD	
CS(=O)(=O)c1ccc(C=NNC(=O)CN2c3cccc4cccc(c34)S2(=O)=O)cc1	918152535	LRWNQZXMERFHGE-UHFFFAOYSA-N	443.506	1.902	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCc2cccc(OC)c2OC)nc1	918233566	GXNOHGHTBZVLTI-UHFFFAOYSA-N	437.522	1.956	50	20	IDGD	
O=C(NNC(=O)c1cn(-c2ccccc2)nc1-c1cccnc1)N[C@@H]1CCS(=O)(=O)C1	919885369	OVCNXIMNGLZGOL-OAHLLOKOSA-N	440.485	1.065	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)[C@@H]1CC(=O)N(c2ccccc2OC)C1	920497308	DUHWIIQJTNQJLI-OAHLLOKOSA-N	435.484	1.808	50	20	IDGD	
NC(=O)c1cc(Br)cc(S(=O)(=O)NNC(=O)c2ccccc2Cl)c1	1116908422	FKGMICVMPWIEPJ-UHFFFAOYSA-N	432.683	1.825	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)NCCOc2ncccc2F)CC1	1253374347	MDRQGORWKSQJQZ-UHFFFAOYSA-N	425.461	1.577	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CC(=O)N(c2ccccc2Br)C1)c1n[nH]c2c1CCCC2	1317814705	DVOZQRUSNRYREP-LLVKDONJSA-N	446.305	1.865	50	20	IDGD	
O=C(NNC(=O)[C@H]1CSCN1C(=O)c1ccc(Cl)cc1)c1n[nH]c2c1CCCC2	1318302429	OHHYXBNUCOOKHN-OAHLLOKOSA-N	433.921	1.918	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N[C@H](C)C(=O)NCC(F)(F)F)cc1Br	1318504792	SWPJBRMXLCZNCW-SSDOTTSWSA-N	441.204	1.469	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)[C@H]2CC23CCS(=O)(=O)CC3)c1	1322935858	VPJMQOOTLJBEAR-GFCCVEGCSA-N	431.308	1.434	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc4cn[nH]c4cn3)C2)C1	1778777149	PAFQBSWXXSKDBR-ACJLOTCBSA-N	436.310	1.575	50	20	IDGD	
COC(=O)[C@@H]1CC[C@H](C(=O)N2CCO[C@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)C1	1779295158	ZBPGXSYUAGMZIN-YRNRMSPPSA-N	426.586	1.257	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCC(=O)N1CCCC1)C2	1782171958	HYQINLVVXGBSKI-CBGDNZLLSA-N	443.972	1.157	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cccc4c3OCCO4)CCO2)C1	1783534114	FEHCLFNNZQHUBG-ORAYPTAESA-N	439.306	1.685	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccc4ncncc4c3)CCO2)C1	1783534849	ZWQPYTUCZADWSI-ORAYPTAESA-N	433.306	1.857	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3nnsc3C3CC3)CCO2)C1	1783534950	SOQXCQPMCPMWAO-QFYYESIMSA-N	429.340	1.642	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)Cc3ccc4ncccc4c3)CCO2)C1	1783870941	JWBNWLDSEJKFNN-PGRDOPGGSA-N	431.920	1.861	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3n[nH]c4cc(Cl)ccc34)CCO2)C1	1783876811	ATXALZNMPHITTI-IFXJQAMLSA-N	441.315	1.914	50	20	IDGD	
COc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]3C2)nn1C	1783969357	GMWHWMPMKFXGIJ-OSFYFWSMSA-N	443.342	1.053	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21	1783972796	QDEZUFFQFITXFZ-DGORSVRFSA-N	444.139	1.688	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ncc(Cl)cn3)[C@H]2C1	1785818177	PVLKUGNHPRJMKO-XWUBHJNHSA-N	445.745	1.754	50	20	IDGD	
CCS(=O)(=O)N[C@H](C)C(=O)Nc1ccc(C2(NC(=O)[C@@H](O)CCl)CCC2)cc1	1786335357	BFDDJGQLUGVIBG-DOMZBBRYSA-N	431.942	1.048	50	20	IDGD	
Cc1cc2nnc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)C(C)(C)CCl)C[C@@H]43)c(C)n2n1	1787910711	FZXXLMRRQOTJGT-JYJNAYRXSA-N	448.955	1.599	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccn4nccc34)C[C@@H]21	1788763658	OJYBWKQKFZWLOU-IEZWGBDMSA-N	430.581	1.779	50	20	IDGD	
C[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]2C1)c1ccccn1	1789926814	GGIOCSQAOQAJLI-FDICVXPISA-N	428.302	1.855	50	20	IDGD	
COC(=O)C12CC(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)[C@H](C)Br)[C@H]4C3)(C1)C2	1791063679	POEPLHDYOCBDMJ-MQGLGVLZSA-N	443.338	1.093	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(F)cc(F)c3F)[C@H]2C1	1791994997	ADENVFJKBHTODH-BWPSIRRCSA-N	434.842	1.951	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(C(N)=O)cc1)C2	1792873232	QEEWVQQKPPVRDS-BQDHKBFISA-N	438.322	1.020	50	20	IDGD	
CCOC(=O)c1c(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Cl)C3)c[nH]c1C	1793126554	JKBWLHNAZQVZCB-DACLVMHWSA-N	443.903	1.556	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CC[C@H](C(=O)OC)CC1	1793604802	VQBYHNDJQMXSTE-PDCGBLAGSA-N	428.957	1.963	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1Cc3[nH]nc(C(F)(F)F)c3C1)C2)[C@@H](F)Cl	1796370398	JENPTRNQESIVCC-VIWFTRRCSA-N	438.809	1.267	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1c(Cl)ccc2c1OCO2	1796939241	IBDZJLILSZIAEZ-DZJQYVJYSA-N	445.299	1.526	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2ncsc2[nH]1	1797983046	QVTDDHFYQLKJFX-ORXSELOVSA-N	427.324	1.611	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCc1cccc(O)c1)C2	1798443629	PLTNKMLBCNXLBF-BJWYYQGGSA-N	437.500	1.275	50	20	IDGD	
N#CCCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](Br)Cc1ccccc1	1800436390	XAVUMRJQBNIPQA-ZMMAXQRCSA-N	434.334	1.886	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](O)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@](C)(Cl)CCl)C2	1800600517	UVKBDHPZBFZAKX-WUILDGTKSA-N	438.352	1.704	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Nc1cccnc1)C2	1800756823	RYSRMVNEUCYNJE-AQDIXCGQSA-N	425.327	1.255	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/c1ccc(OC)cc1F)C2	1800981649	QARPSNAQWVEXCJ-DTRAHEBBSA-N	440.899	1.691	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CC(c3ccccc3)=NN1)C2)C(Cl)Cl	1801016503	GFYBPDOEMDQPLR-XRGAULLZSA-N	425.316	1.146	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2)C(Cl)Cl	1801020968	AHYOGCLMZZXGJP-RKOYIMIHSA-N	431.272	1.210	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1(c2ccccc2F)CC1)c1ccc(B(O)O)cc1	1804226275	GYNKZKPSADQIGC-REPLKXPHSA-N	436.292	1.489	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H](CNC(=O)c2cc(O)nc(O)n2)[C@H]1c1cccnc1	1808295523	KSRFDQJOYGVYCO-CZUORRHYSA-N	433.896	1.867	50	20	IDGD	
C[C@H](Nc1nccs1)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1	1808381828	VHDCIUHKQHVICB-QCEMKRCNSA-N	437.953	1.644	50	20	IDGD	
CN(CC(=O)N1CCCC2(CCN(C(=O)[C@@H](O)CCl)CC2)C1)C(=O)OC(C)(C)C	1809386492	OTWJBOIXQGGKJI-HNNXBMFYSA-N	431.961	1.684	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)c2cccnc2)[C@H]1c1cccnc1	1810298565	IVCTVOFLGOMOPE-JXFKEZNVSA-N	445.483	1.109	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)c1cc2ncccc2[nH]1	1812074177	SLHHXGREUWEAGD-ZOCIIQOWSA-N	427.892	1.877	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)[C@H]2CC=CCC2)[C@H]1c1cccnc1	1813073107	MJXGRSSFJUYNMK-KPLVRAHFSA-N	427.549	1.817	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)C1CC2(CCC2)C1	1813650694	ZMCQHAMKNNKQMQ-DENIHFKCSA-N	447.344	1.661	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H]2CCC(=O)NC2)n[nH]1	1814519038	YJBMBWOECMOFEH-BZPMIXESSA-N	440.342	1.959	50	20	IDGD	
COC(=O)c1ccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)[C@@H](O)CCl)n[nH]2)cn1	1814870888	DTOFZZNHXVTBLK-CABCVRRESA-N	435.868	1.497	50	20	IDGD	
COC[C@@H](C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[nH]n1	1815307037	YFSZOTIYGCMPLY-HKEVHVOCSA-N	443.508	1.818	50	20	IDGD	
O=C(C[C@H]1CCCCO1)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1815602010	FABGMDSYULDXND-IEBWSBKVSA-N	440.309	1.355	50	20	IDGD	
O=C(CCNC(=O)c1ccc[nH]1)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1	1815848682	NGFMRZHTNHQKRX-LSDHHAIUSA-N	436.900	1.150	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1)c1cncn1-c1ccncc1	1816220601	UWSNWUNNFBNOCD-NVXWUHKLSA-N	443.895	1.896	50	20	IDGD	
Cc1nscc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1	1816263665	NVWRDPNUHKDBOX-OAHLLOKOSA-N	433.538	1.854	50	20	IDGD	
CC(=O)N(C)[C@@H](C)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCBr)CC2	1817297066	VDLGOSCPRHVAQV-GXSJLCMTSA-N	431.356	1.707	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc(C3CC3)on2)[nH]n1)c1ccc(B(O)O)cc1	1817469666	CSNAJGBDWXWZFO-GOSISDBHSA-N	449.276	1.575	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)ccc1O	1817472178	AESIGSSLJRIJDY-LJQANCHMSA-N	448.288	1.723	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1)c1ccc2nc(CO)[nH]c2c1	1818538442	JIZIDWFZVVSZPV-CVEARBPZSA-N	446.895	1.684	50	20	IDGD	
C[C@H](C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](F)Br)n[nH]1)n1cncn1	1820936936	INZSMWQXIZZPPX-SUZMYJTESA-N	428.266	1.945	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H]1CCC(=O)N1)CC2	1825445253	QORJBGJQLPWDAA-QXEWZRGKSA-N	429.340	1.507	50	20	IDGD	
CC1(C)CC(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2ccc(B(O)O)cc2)CC3)C1	1826201291	RQWLRTWECRGQFT-HNNXBMFYSA-N	427.335	1.485	50	20	IDGD	
CC[C@H](O)C(=O)N1CCC([C@@H]2CCCCN2C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)CC1	1827677070	FDMBUVJVYGKWHL-XPVJKVDVSA-N	431.537	1.511	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)c2cccc(F)n2)CC1	1829224973	IFHOOYCXSSPOPH-HXUWFJFHSA-N	439.296	1.448	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cn3cnc4ccccc43)C2)C1	1831657324	MYNRJDBUNXTGQD-VGOFRKELSA-N	448.951	1.900	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)C(=O)Nc2cccnc2)CC1	1831831179	PWYUGTHBMRDXKW-ROUUACIJSA-N	436.940	1.894	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccnc(F)c3)CCO2)C1	1831907194	IWFDWWFXWUEHJG-RDTXWAMCSA-N	444.301	1.464	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC(N2CCC(NC(=O)[C@@H]3CCCCO3)CC2)CC1	1833112837	WXJONDSQOSTJAO-IBGZPJMESA-N	425.646	1.979	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)Cn1cccn1)CCO2	1833191690	RSXMRHLCWQXNLM-FUHIMQAGSA-N	426.945	1.383	50	20	IDGD	
C[C@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)Cc3cc[nH]n3)CC2)CC1	1833265139	WWBVQAAUXDJBBM-CQSZACIVSA-N	440.386	1.555	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC(N2CCC(NC(=O)CCc3cn[nH]c3)CC2)CC1	1833812855	FVMMIHHHBGNIOU-UHFFFAOYSA-N	435.645	1.765	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(O)n3)CCO2)C1	1834197707	VKASFADZOTZPPV-FZKQIMNGSA-N	442.310	1.031	50	20	IDGD	
O=C(CCBr)NC1CCN(C2CCN(C(=O)CCc3ncc[nH]3)CC2)CC1	1834423359	IGSWSKAXXPBGGV-UHFFFAOYSA-N	440.386	1.699	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(C(C)C)on3)CCO2)C1	1834500207	GJTQXVJXQHXPCF-IFXJQAMLSA-N	429.901	1.122	50	20	IDGD	
CC[C@H](NC)C(=O)NC1CCN(C2CCN(C(=O)[C@H](C)CBr)CC2)CC1	1834790410	FQUQIJUVUHWIQH-PBHICJAKSA-N	431.419	1.587	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)C[C@@H]3CCCCO3)C2)C1	1834818923	FIYYIEAIHSBELQ-MAUKXSAKSA-N	433.343	1.187	50	20	IDGD	
CO[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1)c1ccccc1	1835285675	QDZDNDZVRYHMND-HNAYVOBHSA-N	431.316	1.634	50	20	IDGD	
CNc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)cc1	1835606182	FCLPICSQQXQCIW-OAQYLSRUSA-N	435.597	1.650	50	20	IDGD	
Cn1cc(CC(=O)N2CCC(N3CCC(NC(=O)[C@H](F)Br)CC3)CC2)cn1	1836414498	NQIAQYUTIIKBEI-KRWDZBQOSA-N	444.349	1.225	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc4ncccn4n3)CCO2)C1	1836866214	BAIOKIVOOPFBRQ-FOIQADDNSA-N	435.912	1.207	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnc(Cl)s3)CCO2)C1	1838160912	CVDGFHNQBABXOZ-MEDUHNTESA-N	438.333	1.120	50	20	IDGD	
COc1ccccc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1838876802	IDTLEINSJZALPG-CRAIPNDOSA-N	445.285	1.456	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CC3CCOCC3)C2)C1	1839151931	IJZPDEVERHQBMQ-RTBURBONSA-N	437.364	1.496	50	20	IDGD	
O=C(/C=C/c1cccs1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839198762	ATRDKQAMUDJZBZ-PIXXYMSQSA-N	447.326	1.908	50	20	IDGD	
CC(F)(F)C(C)(C)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](F)Br)CCO2)C1	1839199383	VEYHDPQROMWVJO-MEDUHNTESA-N	445.276	1.815	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc3ccnn3c1)CCO2	1839570408	LGOIDLRTIZOJFC-NRFANRHFSA-N	446.580	1.256	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1C[C@]1(F)Cl)CCO2	1840242290	OJYHFYPOOMLCCH-AVRGHOLYSA-N	441.725	1.398	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)CCc2cnc3ccccc3c2)C1	1841251949	COKDFCNPHCNQJY-UHFFFAOYSA-N	443.312	1.364	50	20	IDGD	
C[C@H](Br)C(=O)N1CC2(CCCN2C(=O)CCN2C(=O)c3ccccc3C2=O)C1	1841911231	NDEXNIBZXSBWCD-ZDUSSCGKSA-N	448.317	1.660	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2ccnc(C(F)F)c2)C1	1842159033	CBZODCPXKKVIFF-LGJNPRDNSA-N	444.442	1.970	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1ccc(-n3cccn3)cc1)C2	1844264744	CHRWARZUGWKULA-UHFFFAOYSA-N	445.483	1.002	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)CCN(C)C(C)=O)C2	1844692041	ZRCFPGAHOGPCFD-UHFFFAOYSA-N	446.460	1.206	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)C2(c3ccc(F)c(F)c3)CC2)C1	1845016317	LBSKCGVTKGBUAA-UHFFFAOYSA-N	440.255	1.193	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H]1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl	1847558487	MNXFFBOUYNDFGK-QRJUGERDSA-N	429.945	1.481	50	20	IDGD	
CC(=O)C[C@H](C)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1848098677	POWFQPGNRPWWKS-TUUVXOQKSA-N	429.945	1.936	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H]1CCc2nc(O)nc(O)c2C1	1848217429	LBGJDBXDTFMMPM-VJOKAODUSA-N	443.331	1.431	50	20	IDGD	
O=C(CN1CCC(C(=O)Nc2ccccc2O)CC1)NNC(=O)c1ccc([N+](=O)[O-])cc1	15043045	DXOOQEKGQNOTKV-UHFFFAOYSA-N	441.444	1.412	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCOCC3)cc2)c1	15886356	RDHZFNRPYSAYNW-UHFFFAOYSA-N	447.513	1.164	50	20	IDGD	
CNS(=O)(=O)c1ccc(C(=O)NNC(=O)[C@H](C)Oc2ccc3ccccc3c2)cc1	18053703	DJXUPKZHCCCBSW-AWEZNQCLSA-N	427.482	1.976	50	20	IDGD	
Cc1c(C(=O)OCC(=O)NNC(=O)c2cccs2)sc2nc3n(c(=O)c12)CCC3	21608009	AQSXNHLAOFCAAJ-UHFFFAOYSA-N	432.483	1.392	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)[C@H]1COc2ccccc2O1	23297240	TZVATIKUGMFFGD-HXUWFJFHSA-N	444.919	1.445	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@H](CC(C)C)N2C(=O)[C@H]3CC=CC[C@@H]3C2=O)cc1OC	26960529	NFQFVVXGLMHCER-ULQDDVLXSA-N	443.500	1.831	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCCC(=O)NNC(=O)CNc2ccc(C)cc2)cc1	104748196	AZOCMNPZGONCAW-UHFFFAOYSA-N	434.518	1.322	50	20	IDGD	
CCNS(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)c1	108416018	MFXDVLOBPYFVBW-CQSZACIVSA-N	437.493	1.969	50	20	IDGD	
Cc1ncc(CO)c(C=NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)c1O	254796155	ZIWPQTNWNDCZHF-UHFFFAOYSA-N	432.502	1.526	50	20	IDGD	
O=C(CNC(=O)NNC(=O)c1cc(Br)c[nH]1)Nc1ccc(-n2cccn2)cc1	725859450	DEVKPLRFYBYARX-UHFFFAOYSA-N	446.265	1.546	50	20	IDGD	
CCOc1ccccc1N1CCN(C(=O)NNC(=O)CNC(=O)c2cccs2)CC1	725872528	DOAICRDJPWXXPF-UHFFFAOYSA-N	431.518	1.440	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)COc1ccc(OCc2ccccc2)cc1)N1CCN(C)CC1	725878654	ZNIPBXBADRJOIM-SFHVURJKSA-N	426.517	1.428	50	20	IDGD	
CNS(=O)(=O)c1cccc([C@H](C)NC(=O)NNC(=O)[C@H](C)Oc2ccccc2F)c1	727609324	JLWFXRBCJRBFQT-STQMWFEESA-N	438.481	1.593	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCOc2ccccc21)c1cccc(S(=O)(=O)N2CCOCC2)c1	728177284	YDWYTRJDELPSRJ-SFHVURJKSA-N	445.497	1.035	50	20	IDGD	
CN(C)N(C(=O)c1ccc2c(c1)C(=O)N(C1CCCCC1)C2=O)[C@H]1CCS(=O)(=O)C1	728178943	FPPVGYPYVWRRDA-INIZCTEOSA-N	433.530	1.721	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)[C@@H]2CCCN2C(=O)c2ccc3c(c2)OCO3)c(C)c1	728206018	QBUZTZUCKDRBAT-SFHVURJKSA-N	438.484	1.896	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)C[C@@H](c2ccccc2)N2CCOC2=O)cc1	728380495	OJWJZCNKOHUHQI-SFHVURJKSA-N	425.441	1.883	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(Br)cc1[N+](=O)[O-])c1ccc([N+](=O)[O-])cc1	728501227	HYEJYJNNCAFJGW-UHFFFAOYSA-N	445.207	1.889	50	20	IDGD	
Cc1cc2nc(C)c(CCC(=O)NNC(=O)C3CCN(c4ncccn4)CC3)c(C)n2n1	728847492	HTUKBHQDINPVFC-UHFFFAOYSA-N	436.520	1.441	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)NC[C@@H]3CCCO3)cc2)c1	728871724	BFHJQQQZBXHQOU-KRWDZBQOSA-N	428.470	1.090	50	20	IDGD	
CCN(CC)C(=O)CN1CCCN(C(=O)NNC(=O)Cn2ccc3ccccc32)CC1	729506662	IHPFAWHKTCFBFT-UHFFFAOYSA-N	428.537	1.258	50	20	IDGD	
Cc1ccccc1COc1cccc(CC(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)c1	729969092	UPAVXWNLCPSKQO-SFHVURJKSA-N	431.514	1.634	50	20	IDGD	
Cc1ccnc2nc(C(=O)NNc3nc4ccccc4c(=O)n3CCCOC(C)C)nn12	733265769	KJPGSQPWLXQLJQ-UHFFFAOYSA-N	436.476	1.715	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)c1ccc(N2CCC(O)CC2)cc1	733884989	OAWPZHQAOQOACJ-UHFFFAOYSA-N	431.518	1.016	50	20	IDGD	
CSCC[C@H](NC(=O)c1ccc2ccccc2n1)C(=O)NNC(=O)c1cnn(C)c1	735470566	CGKOKMXMTLYEHH-KRWDZBQOSA-N	426.502	1.281	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N2CCC(C(=O)NNc3ccnc(N(C)C)n3)CC2)cc1	740102081	ATXXYWTUCJZYKY-UHFFFAOYSA-N	448.549	1.485	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1	740851619	OJVBEAGDUFPDNR-IBGZPJMESA-N	428.455	1.893	50	20	IDGD	
CC(C)(C)NC(=O)Nc1ccc(Cl)c(C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)c1	741674365	XZNFAFCBORTUPC-NSHDSACASA-N	445.929	1.391	50	20	IDGD	
COc1cc(C(=O)NN=Cc2c(N3CCOCC3)nc3ccccn23)cc(OC)c1OC	741810012	HDJDFGASEYUCPE-UHFFFAOYSA-N	439.472	1.961	50	20	IDGD	
Cc1cc(-n2cncn2)ccc1C(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12	742035006	VHXXDBQPMOUUDR-UHFFFAOYSA-N	431.456	1.941	50	20	IDGD	
COc1ccc(OC)c(-n2nnnc2SCC(=O)NNC(=O)c2ccc(C#N)cc2)c1	742451770	CJEVTNRZQLIRON-UHFFFAOYSA-N	439.457	1.104	50	20	IDGD	
NC(=O)CS(=O)(=O)c1ccc(C(=O)NNC(=O)c2c(Cl)cccc2Cl)cc1	742628709	VRTQBOKKSXDNSB-UHFFFAOYSA-N	430.269	1.327	50	20	IDGD	
C[C@H](CC(=O)NNc1ccc(Br)nc1)/N=C1/NS(=O)(=O)c2ccccc21	743405991	JOPWSSPMHJLXTC-SNVBAGLBSA-N	438.307	1.805	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)CCNS(=O)(=O)c2ccccc2Cl)cc1	743828769	FQGXCFGGBJTKKC-UHFFFAOYSA-N	439.925	1.927	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1ccc(C(F)(F)F)cn1	744621140	RRFNMNFHTGVEDL-UHFFFAOYSA-N	430.408	1.878	50	20	IDGD	
O=C(NC[C@@H](c1ccc(F)cc1)N1CCOCC1)NNC(=O)c1cc([N+](=O)[O-])ccc1O	745289403	JURAWUMUONNBKF-KRWDZBQOSA-N	447.423	1.457	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)c1cc([N+](=O)[O-])ccc1O)N1CCN(c2ccccc2)CC1	745519312	QKUOYYSJMYNJLS-HNNXBMFYSA-N	442.476	1.455	50	20	IDGD	
CCc1cnc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)s1	745904684	NCANIQKCOMRRSG-UHFFFAOYSA-N	437.547	1.634	50	20	IDGD	
CSCC[C@H](C(=O)NNC(=O)c1cccc(N(C)C)c1)N1C(=O)[C@H]2CCCC[C@@H]2C1=O	746102677	GFHJVWFWRMBNNN-OKZBNKHCSA-N	446.573	1.811	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cc3c(N(C)C)ncnc3n2C)cc(OC)c1OC	747199769	WFDWOYLUJIZMDZ-UHFFFAOYSA-N	428.449	1.135	50	20	IDGD	
O=C(NCC(=O)N1CCN(c2ccccc2)CC1)NNC(=O)c1ccc(Cl)cc1F	747586419	YCHHXYDLBZIQDB-UHFFFAOYSA-N	433.871	1.772	50	20	IDGD	
O=C(O)c1ccc(S(=O)(=O)NNC(=O)c2ccc3c(c2)OCO3)c(Br)c1	747595825	HCFDGIYTZYEGLS-UHFFFAOYSA-N	443.231	1.499	50	20	IDGD	
O=C(CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)NNC(=O)[C@H]1Cc2ccccc2O1	748281548	ZODKKQXVJNOZIS-QGZVFWFLSA-N	426.385	1.434	50	20	IDGD	
CCc1c(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)cnn1C(C)(C)C	748618773	GRVVHPRFQKCIDE-UHFFFAOYSA-N	448.593	1.894	50	20	IDGD	
CCc1cc(N2CCC(NC(=O)NNC(=O)C(=O)Nc3ccc(C)c(C)c3)CC2)ncn1	748664559	ZAALBQWWVKKRCU-UHFFFAOYSA-N	439.520	1.594	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)N[C@H]1CCN(c2cccc(Cl)c2)C1=O	750670503	MECBCQSDVFQTBH-AWEZNQCLSA-N	447.835	1.763	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NN/C=C1/C(=O)N(c2ccccn2)C(=O)c2ccccc21	751260351	KNIZQVSTOYVMHH-FOWTUZBSSA-N	431.408	1.253	50	20	IDGD	
O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)NNC(=O)Cc1cc[nH]n1	755286452	KVQMPFWDLJWNIP-JLHYYAGUSA-N	435.556	1.843	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@H](C)C(=O)NNC(=O)c1cc(S(N)(=O)=O)c(C)o1	755622223	IPOYGAZDPCWOCT-LLVKDONJSA-N	429.882	1.734	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)Nc1ccc(-n2ccnn2)cc1	756313467	OWJKQKLTFZYCLS-UHFFFAOYSA-N	434.504	1.632	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1ccc(Cl)cc1OCC(F)(F)F	756575604	IDAVYNUZNWIHQQ-SSDOTTSWSA-N	432.808	1.372	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)Nc1ccc(S(=O)(=O)NC2CC2)cc1	756776390	OOMBNXGZVGGXKX-UHFFFAOYSA-N	427.486	1.935	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2C(=O)NC3(C[C@H](C)C[C@@H](C)C3)C2=O)cc1OC	756857884	SQKQFMWTILKHFH-CHWSQXEVSA-N	432.477	1.212	50	20	IDGD	
C[C@@](O)(CN1Cc2ccccc2C1=O)C(=O)NNc1c(F)cc(C(=O)NC2CC2)cc1F	756876048	OQIXZSYGCPFIKQ-JOCHJYFZSA-N	444.438	1.707	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N2CCO[C@H]([C@@H]3CCCO3)C2)cc1Br	756937543	YEOWSOOZLNYZAX-GJZGRUSLSA-N	428.283	1.692	50	20	IDGD	
Cc1nn([C@H]2CCS(=O)(=O)C2)c(C)c1NC(=O)NNC(=O)c1c[nH]c2ccccc12	757871238	FWMXKJOBVUKDDN-ZDUSSCGKSA-N	430.490	1.807	50	20	IDGD	
O=C(c1cc(O)nc2ccc(F)cc12)N1CCN(S(=O)(=O)CBr)CC1	758524896	YLMHYTYHLNZQAK-UHFFFAOYSA-N	432.271	1.520	50	20	IDGD	
Cc1ccc(CNC(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)c(O[C@H]2CCOC2)c1	758899537	INBJNRHHDBREBO-HNNXBMFYSA-N	430.417	1.921	50	20	IDGD	
NC(=O)[C@@H]1CC[C@H](CNC(=O)NNC(=O)Nc2ccc(Br)cc2Cl)O1	759771780	DECFSUXTOLMSMS-KCJUWKMLSA-N	434.678	1.471	50	20	IDGD	
COc1ccc2c(c1)OC[C@H]2CC(=O)NNC(=O)c1sc(N2CCOCC2)nc1C	760264479	UJXCBPNOPWRQMA-CYBMUJFWSA-N	432.502	1.624	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)c2ccc(=O)n(-c3cnn(C)c3)c2)cc1	760466147	NKUXCVCWNNBIBZ-AWEZNQCLSA-N	425.445	1.198	50	20	IDGD	
Cn1cc(-n2cc(C(=O)NNc3ccc(S(=O)(=O)C(F)(F)F)cc3)ccc2=O)cn1	760914888	HPCKGMHVOUJUKT-UHFFFAOYSA-N	441.391	1.621	50	20	IDGD	
Cc1nn(CC(F)(F)F)cc1C(=O)NNC(=O)c1sc(N2CCOCC2)nc1C	763138581	BQONJYNSJKHGJK-UHFFFAOYSA-N	432.428	1.430	50	20	IDGD	
COC(=O)c1ccc(Cl)cc1S(=O)(=O)NNC(=O)CCCNC(=O)OC(C)(C)C	763439425	OPZMYDVGLYWJKS-UHFFFAOYSA-N	449.913	1.741	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)C(=O)Nc1ccc(N2CCCC2=O)c(F)c1	763551253	LJJYPHGHUOYVKO-UHFFFAOYSA-N	428.376	1.081	50	20	IDGD	
Cc1ccc(-c2ccncc2)cc1NC(=O)C(=O)NNC(=O)[C@@H]1COc2ccccc2O1	763574643	HTKOZQXRUVZFCU-FQEVSTJZSA-N	432.436	1.983	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1cnn(CC(C)C)c1C(F)F	763630041	UYJDEBTWSMHPEZ-UHFFFAOYSA-N	433.419	1.833	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccccc1-c1noc(C)n1	763663562	VTJUGUCVAJPOKS-UHFFFAOYSA-N	425.401	1.219	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)COc2cc(C)ccc2C)c(C)c1	763664788	HCLOUVQXTWRTFA-UHFFFAOYSA-N	443.456	1.329	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)C(=O)Nc1cccc(-n2cnnn2)c1	763855267	VHYLMSXVAPBTOC-AWEZNQCLSA-N	445.439	1.369	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cc(C(N)=O)ccc2C)cc1	763860449	HDWWZAOCQMPSRA-ZDUSSCGKSA-N	428.445	1.046	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccc(OC[C@H]2CCCO2)cc1	763866902	RMYXHCPGHVVDBS-AUUYWEPGSA-N	445.447	1.937	50	20	IDGD	
COC(=O)c1sccc1NC(=O)C(=O)NNC(=O)CCSc1ccc(F)cc1	763895156	LRGSSLZVUXYHHL-UHFFFAOYSA-N	425.463	1.942	50	20	IDGD	
CSc1c(F)cc(NC(=O)C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1F	763916592	HHZGGJUDYKQKQA-UHFFFAOYSA-N	433.400	1.062	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)C(=O)Nc1cc(F)ccc1OC[C@@H]1CCCO1	763919799	VTZMTHPGHSIOIN-INIZCTEOSA-N	433.411	1.851	50	20	IDGD	
CNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2ccc(Br)s2)c1C	763942163	WKGCLXGIHMPJSB-UHFFFAOYSA-N	439.291	1.578	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)C(=O)Nc1ccnn1Cc1ccc(Cl)cc1Cl	763997751	BHBKYKHSQBVQHJ-UHFFFAOYSA-N	435.271	1.976	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)NC(C)(C)C)cc2)c1O	764132118	KCJWGBOSDFEHTI-UHFFFAOYSA-N	428.445	1.329	50	20	IDGD	
CCOc1cc2c(cc1NC(=O)C(=O)NNC(=O)[C@@H]1Cc3ccccc3O1)O[C@@H](C)C2	764151410	IMLKLFQYQYOPKC-BUXKBTBVSA-N	425.441	1.498	50	20	IDGD	
CN(C1CCCCC1)S(=O)(=O)c1ccccc1NC(=O)C(=O)NNC(=O)c1ccoc1	764158364	CRIJMYFGUWWFSK-UHFFFAOYSA-N	448.501	1.633	50	20	IDGD	
Cc1cc(Oc2ncccn2)ccc1NC(=O)C(=O)NNC(=O)[C@H]1Cc2ccccc2O1	764166296	AUQLOIMRYISQEL-GOSISDBHSA-N	433.424	1.667	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)C(=O)Nc2cc(C)n(CCC#N)n2)c1	764230574	BVMJCIZBNOXYHR-UHFFFAOYSA-N	449.265	1.276	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc3ccccc3o2)c(OCC(=O)N(C)C)c1	764332182	OJAAXLCCFNVVFW-UHFFFAOYSA-N	438.440	1.608	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(F)c(NC(=O)C(=O)NNC(=O)c2cc3ccccc3o2)c1	764342327	MWDMYACSZMFEMC-UHFFFAOYSA-N	448.432	1.222	50	20	IDGD	
COc1ccccc1COc1cccc(NC(=O)C(=O)NNC(=O)[C@H]2COCCO2)c1C	764431937	GYCMBIKUAFFYOO-LJQANCHMSA-N	443.456	1.084	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)N[C@@H]1CCN(c2ccc(Cl)c(F)c2)C1=O	764507614	KDADGGFGMIKQBM-OAHLLOKOSA-N	448.838	2.000	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)cc1	765126818	NJLMWDXFOYOHHX-UHFFFAOYSA-N	432.546	1.131	50	20	IDGD	
CCN1CCN(c2ccc(Cl)cc2NC(=O)C(=O)NNC(=O)OC(C)(C)C)CC1	765391282	QMKHMAKJCTZOMO-UHFFFAOYSA-N	425.917	1.976	50	20	IDGD	
CC(C)(C)OC(=O)N[C@]1(C)CCCC[C@H]1C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	765542865	SPEUUIGSOIFFCQ-HRAATJIYSA-N	443.508	1.897	50	20	IDGD	
C[C@@H](Oc1cccnc1)C(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	765758776	QGLCZEAZZYHSIY-MRXNPFEDSA-N	431.924	1.468	50	20	IDGD	
COCc1nc(C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)cs1	765760088	ZPXJZKKRLORLRJ-UHFFFAOYSA-N	437.953	1.522	50	20	IDGD	
Cc1nnc(O)c(C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)c1C	766659865	HCLTWENEUGUKCN-UHFFFAOYSA-N	432.912	1.031	50	20	IDGD	
CCOc1ncccc1C(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	766663329	KAYPIGFWNHIMCL-UHFFFAOYSA-N	431.924	1.713	50	20	IDGD	
O=C(CCC(=O)N1CCN(c2ncccn2)CC1)NNC(=O)Cc1ccc2ccccc2c1	767881975	PLZVEHCPOFNSFN-UHFFFAOYSA-N	446.511	1.449	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)c2ccc(N3C(=O)CCC3=O)c([N+](=O)[O-])c2)cn1	768205715	BUXTYKZZCPKVLM-UHFFFAOYSA-N	444.429	1.283	50	20	IDGD	
O=S(=O)(/C=C\c1cccc(Cl)c1)N1CCN(S(=O)(=O)CBr)CC1	768889484	BOVSFGTWUHGVDK-WTKPLQERSA-N	443.772	1.940	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)N[C@H]1CCO[C@@]2(CCSC2)C1	769229331	BRBQXDYZRQZULM-AVRDEDQJSA-N	447.605	1.584	50	20	IDGD	
CC(=O)N1CCc2c(NC(=O)C(=O)NNC(=O)CN3CCCc4ccccc43)cccc21	769268176	XGZIOEZTPMEJPK-UHFFFAOYSA-N	435.484	1.134	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)CSCc1cc(=O)n2ccsc2n1	771921922	NJUAAYRIFWTBTM-NSHDSACASA-N	426.520	1.114	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNS(=O)(=O)c1ccc(OC(C)C)cc1	773231534	DFLFBBDPEXWCGZ-UHFFFAOYSA-N	440.547	1.699	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(-c3cc(F)cc(F)c3)nn2C)c(O)c1	773542361	YCSAPPVZWJMVME-UHFFFAOYSA-N	429.383	1.779	50	20	IDGD	
CCOc1ccc2c(c1)[C@H](NC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)CCO2	773557719	GLHAGTFEJHAVBN-QGZVFWFLSA-N	433.486	1.957	50	20	IDGD	
O=C(NCCc1ccc(OCC(F)(F)F)nc1)NNC(=O)[C@@H]1COc2ccccc2O1	773613549	PFMKXPWFJKPWCQ-HNNXBMFYSA-N	440.378	1.736	50	20	IDGD	
CCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)cc1	774011395	YPOBHDVCOUQNDW-LBPRGKRZSA-N	432.864	1.643	50	20	IDGD	
COc1ccc([C@@H](NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)C(F)(F)F)cc1	775995544	HAYPLWJIAWWAPZ-OAHLLOKOSA-N	435.366	1.919	50	20	IDGD	
CCNS(=O)(=O)c1ccccc1S(=O)(=O)NNC(=O)c1cccc2ccccc12	777632841	MJWYNSFRGQOKST-UHFFFAOYSA-N	433.511	1.761	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CN(C)[C@H](C(N)=O)c2cccc(Br)c2)c1	777725192	RCIQNOVBRJQZOL-KRWDZBQOSA-N	433.306	1.677	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)Nc2nccs2)cc1)c1cc2c(O)ncnc2cn1	779381038	KSTPSBOHBDSTGM-UHFFFAOYSA-N	443.470	1.745	50	20	IDGD	
CC[C@H](C)[C@H](C)C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	779719194	LEJTXBHXBYBZLD-HOTGVXAUSA-N	425.551	1.470	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)[C@@H]2C[C@@]23CCN(C(=O)OC(C)(C)C)C3)c2ccccc2c1=O	780171343	LATFZZJJBKHYAE-OYHNWAKOSA-N	441.488	1.342	50	20	IDGD	
COc1ccc(NNC(=O)NCc2ccccc2OCC(=O)NC[C@H]2CCCO2)nc1	780974567	RUZJZYDVBSIBQV-QGZVFWFLSA-N	429.477	1.591	50	20	IDGD	
CC(=O)N1CCN(Cc2ccccc2NC(=O)C(=O)NNC(=O)c2ccccc2C)CC1	782120923	MJDMUBKGNSOSQW-UHFFFAOYSA-N	437.500	1.059	50	20	IDGD	
NC(=O)CNC(=O)c1cccc(NC(=O)C(=O)NN(Cc2ccccc2)c2ccccc2)c1	782821211	JNJPXKGYRJEEOK-UHFFFAOYSA-N	445.479	1.578	50	20	IDGD	
Cc1cnc(O)n1-c1ccccc1NC(=O)C(=O)NNc1ccc(S(C)(=O)=O)cc1	783072207	SOEKZSVLSAAMRV-UHFFFAOYSA-N	429.458	1.372	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2cncc(Cl)n2)c(C)c1S(=O)(=O)NC1CC1	783258255	FKKJSDLRDFBGFK-UHFFFAOYSA-N	438.897	1.269	50	20	IDGD	
O=C(NNc1ncnc2ccsc12)C(=O)Nc1cc(N2CCNC2=O)ccc1Cl	783263622	VSLUNZJXPPGIAW-UHFFFAOYSA-N	431.865	1.956	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C)c(C)c(NC(=O)C(=O)NNc2cc(C)nc(C)n2)c1	783327099	XPLITGODSQYNRB-UHFFFAOYSA-N	448.549	1.823	50	20	IDGD	
Cn1c(=NNC(=O)C(=O)Nc2ccc(C[C@@H]3CC(=O)NC3=O)cc2)sc2ccccc21	783351065	FYNVUMKVMKRHCO-CYBMUJFWSA-N	437.481	1.016	50	20	IDGD	
Cc1ccnc(NNC(=O)C(=O)Nc2ccc(C)c(S(=O)(=O)N3CCCCC3)c2)c1	783931759	YGMBRWQEPPBQQL-UHFFFAOYSA-N	431.518	1.955	50	20	IDGD	
Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	784213793	QABPPCRGAALIRS-UHFFFAOYSA-N	433.446	1.426	50	20	IDGD	
O=C(NNc1ccccc1Cl)C(=O)N1C[C@H](C(=O)N2CCOCC2)Oc2ccccc21	784775043	SNCXKGAMWYFGMM-GOSISDBHSA-N	444.875	1.436	50	20	IDGD	
CCCCN(C)S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2nccnc2Cl)cc1	784776661	QYBJAVTVHBCYFK-UHFFFAOYSA-N	440.913	1.632	50	20	IDGD	
O=C(Cn1cc(NC(=O)C(=O)NNc2ccc(F)cc2Br)cn1)NC1CC1	784802704	QAQMKECCMWCGHH-UHFFFAOYSA-N	439.245	1.145	50	20	IDGD	
COc1cccc(Cn2nccc2NC(=O)C(=O)NNc2cccc([N+](=O)[O-])c2)c1OC	784828021	DFHYXUZJLGAWJA-UHFFFAOYSA-N	440.416	1.939	50	20	IDGD	
O=C(NNc1ccc(Cl)nc1)C(=O)N1C[C@@H](C(=O)N2CCCCC2)Oc2ccccc21	784870387	QAGKPFQKEQBAOQ-KRWDZBQOSA-N	443.891	1.985	50	20	IDGD	
COC(=O)c1ccc(S(=O)(=O)NNC(=O)c2cccc(OC(F)F)c2)c(OC)c1	785490012	XHXFGSCCNZHZNS-UHFFFAOYSA-N	430.385	1.707	50	20	IDGD	
CN(NC(=O)Nc1ccc(C(N)=O)c(F)c1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	785850591	ZOCFLRAYJSBYKN-UHFFFAOYSA-N	438.460	1.566	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Cc2ccccc2S(C)(=O)=O)cc1Br	786149714	GIHORUQZDQJPMB-UHFFFAOYSA-N	441.303	1.865	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cccnc2-c2cnn(C)c2)cc1OC	786414676	PYLNQUGLPMZWIG-UHFFFAOYSA-N	438.444	1.289	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2ccc(NC(=O)COC(=O)/C(C#N)=C/C3CC3)cc2)C[C@@H](C)O1	786672199	ZWTJGDADCLJNDR-ABMJBYEESA-N	447.513	1.826	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)COc2ccc([N+](=O)[O-])c3cccnc23)c1	786783984	YNXXGXRIISVGJK-UHFFFAOYSA-N	438.396	1.835	50	20	IDGD	
COc1cccc([C@H]2[C@@H](C(=O)NNc3ccc(-n4ccnc4)nn3)CC(=O)N2C2CC2)c1	788178353	NMDSXBIUUKPGPP-UWJYYQICSA-N	433.472	1.866	50	20	IDGD	
CN(C)[C@H]1CCOc2c(NC(=O)C(=O)NNC(=O)c3ccc(O)c(Cl)c3)cccc21	789735222	VDMXCTQDZCZKDU-HNNXBMFYSA-N	432.864	1.831	50	20	IDGD	
Cc1c(C(=O)NNc2nc3ccccc3c(=O)n2C)nnn1Cc1ccc(F)cc1F	790634290	KRRRTDFTDRHLQU-UHFFFAOYSA-N	425.399	1.917	50	20	IDGD	
CNC(=O)c1cc2cc(NC(=O)C(=O)NNC(=O)CCc3ccc(OC)cc3)ccc2[nH]1	792354613	KMPQIKVLZFMEEC-UHFFFAOYSA-N	437.456	1.255	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)Cc1ccc(S(=O)(=O)N(C)C)cc1	793829116	FRGGAMZJWRHUNG-UHFFFAOYSA-N	441.531	1.035	50	20	IDGD	
Cc1cccc(C(=O)NNS(=O)(=O)c2cc(C(=O)O)cc(C)c2Br)n1	794599313	XYCKFRYKYLBLJO-UHFFFAOYSA-N	428.264	1.782	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](c2nnc(SCC(=O)NNC(=O)C3CC3)o2)C1	795262264	MCOZJGJOUIMKEV-GFCCVEGCSA-N	425.511	1.834	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(F)c(N3CCOC3=O)c2)cc1C	796992125	NEHQOUYNQZWXJO-UHFFFAOYSA-N	444.419	1.564	50	20	IDGD	
O=C(NNC(=O)N1CCC[C@H](CN2CCOCC2)C1)c1cccc(Br)c1	801025838	PSJFXIFWRPODEH-CQSZACIVSA-N	425.327	1.848	50	20	IDGD	
O=C(CN1CCCS1(=O)=O)NNc1c(Br)cccc1Br	801502262	GEMUVYASAGXXIC-UHFFFAOYSA-N	427.118	1.690	50	20	IDGD	
CNC(=O)COc1cccc(CC(=O)NNC(=O)Nc2ccc(Br)cc2)c1	801999081	SWAWPYXGKQBKBS-UHFFFAOYSA-N	435.278	1.969	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)N=c2cc[nH]cc2)ccc1OCC(=O)N1CCCCC1	802027411	GKHRCTQDTHBBFE-UHFFFAOYSA-N	441.488	1.760	50	20	IDGD	
O=C(NC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1)NNC(=O)c1cc([N+](=O)[O-])ccc1O	802337753	LAVUMKCLSYBNHS-AWEZNQCLSA-N	441.400	1.373	50	20	IDGD	
Cc1nc(C(F)(F)F)ccc1NC(=O)C(=O)NNC(=O)c1cc(Br)cn1C	802566492	RXKCMUZQWQVLPR-UHFFFAOYSA-N	448.199	1.910	50	20	IDGD	
CCOc1ccc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)[C@@](C)(O)C3CC3)cc2)cc1	804146806	GIRHMHZAUFHMPM-NRFANRHFSA-N	447.513	1.808	50	20	IDGD	
CN(C)S(=O)(=O)C[C@H](NC(=O)NNC(=O)c1ccc2ccccc2c1)C(F)(F)F	804926025	UGFYQZUIDPZDJI-AWEZNQCLSA-N	432.424	1.606	50	20	IDGD	
COCc1nc(Cl)cc(NNC(=O)Nc2ccc(CC(=O)NCC(=O)OC)cc2)n1	806206889	WHLMORLIGXZDMV-UHFFFAOYSA-N	436.856	1.257	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)C2CCN(CC(F)F)CC2)cc1	806375260	HXJVYNWRTKARQH-UHFFFAOYSA-N	438.504	1.846	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)C(=O)CC(C)(C)O3)c1	806974828	VDRIFWCCPVMHIZ-UHFFFAOYSA-N	441.440	1.847	50	20	IDGD	
O=C(CCOc1ccccc1)NNC(=O)C(=O)Nc1cc(F)c(N2CCOCC2)cc1F	806977778	YVHXDDUFBFDJLC-UHFFFAOYSA-N	448.426	1.356	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(NC(=O)C(=O)NNc2ccc(OC(F)F)cc2)ccc1F	807005667	LHMCRIPDLVZHMA-UHFFFAOYSA-N	446.407	1.759	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2C)cc1-n1nnnc1C	807456484	OBCVIXAAFMLLOT-UHFFFAOYSA-N	426.393	1.278	50	20	IDGD	
C[C@@H]1[C@@H](NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)CCN1Cc1ccccc1	807619827	BXFRRRLXMYOGII-BEFAXECRSA-N	434.500	1.541	50	20	IDGD	
CC(=O)c1cc(Br)ccc1OCC(=O)N([C@H]1CCS(=O)(=O)C1)N(C)C	808025013	ZFVYQXQOJDJUER-ZDUSSCGKSA-N	433.324	1.523	50	20	IDGD	
C#CC[C@@]1(C(=O)NNC(=O)CCN2C[C@H](C)O[C@H](C)C2)CCCN1C(=O)OC(C)(C)C	809556917	PERPMDAESFHYNJ-JKSBSHDWSA-N	436.553	1.426	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)[C@H](Cc3cnc[nH]3)NC(=O)CC(C)C)n[nH]2)cc1	810147335	JKPGTMKXRKGKJP-SFHVURJKSA-N	437.504	1.643	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)N1CCN(c2ccccc2)CC1	812560203	RLPYSKVIDKJUFE-OAHLLOKOSA-N	430.892	1.604	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)Nc2cccc(C(=O)N3CCOCC3)c2)cc1	812924235	ZIQLEKNNROYZIX-UHFFFAOYSA-N	447.517	1.558	50	20	IDGD	
O=C1CN(Cc2cccc(NC(=O)C(=O)NNc3ccccc3C(F)(F)F)c2)CCN1	812978252	IMVKNJOYVFGMFH-UHFFFAOYSA-N	435.406	1.719	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2cccnc2Br)cc1	813033752	JWJIHRRBMBSMGE-UHFFFAOYSA-N	442.295	1.176	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)Nc1ccc(NS(C)(=O)=O)cc1	814647009	JKRFQDLZQPMBOR-UHFFFAOYSA-N	427.508	1.457	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1ncn(C2CCCCC2)n1	815751793	OLZZKWDIYPNKLB-UHFFFAOYSA-N	435.510	1.115	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)c1c(I)cnn1C	815886032	JTRWZXDTCQNAHF-UHFFFAOYSA-N	446.270	1.587	50	20	IDGD	
O=C(CC1CC1)NNC(=O)CC12C[C@@H]3C[C@H](C1)CC(C(=O)NNC(=O)CC1CC1)(C3)C2	819131993	UHTBVFWTDLZCAL-WDXRGRCHSA-N	430.549	1.858	50	20	IDGD	
CC(C)C[C@H](C(=O)NNC(=O)COc1ccc(C#N)cc1)N1C(=O)[C@H]2CC=CC[C@H]2C1=O	864018078	QOAXGVSECGCQSN-CEXWTWQISA-N	438.484	1.450	50	20	IDGD	
Cc1ccc(S(=O)(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c(Br)c1	912979314	GQHYIRWDIPRICF-AWEZNQCLSA-N	427.276	1.907	50	20	IDGD	
CCOc1ccc(NC(=S)NNC(=O)CNS(=O)(=O)c2cc(C)ccc2C)cc1	913444431	RCKBTARZFPEUBG-UHFFFAOYSA-N	436.559	1.998	50	20	IDGD	
Cc1ccc(-n2cnnc2SCC(=O)N([C@@H]2CCS(=O)(=O)C2)N(C)C)cc1Cl	914838652	PGCGTOOVERAEQS-CQSZACIVSA-N	443.982	1.814	50	20	IDGD	
Cc1nnnn1[C@H](Cc1ccc(F)cc1)C(=O)NNC(=O)c1ccc2c(c1)OCCO2	915696364	ZSIJUFBBLKJJML-MRXNPFEDSA-N	426.408	1.137	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)CNC(=O)Cc2cccc(F)c2)c2ccccc2c1=O	916093015	WLWFZIXWAYLENM-UHFFFAOYSA-N	439.447	1.236	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)NCCN2CCN(c3ccc(F)cc3)CC2)c1	916513645	IXBFGTIRQWDQJT-UHFFFAOYSA-N	429.496	1.666	50	20	IDGD	
N#Cc1cccc(NNC(=O)NCc2ccc(S(=O)(=O)NC[C@H]3CCCO3)cc2)c1	916648818	CZAHTCISVFMNFL-GOSISDBHSA-N	429.502	1.842	50	20	IDGD	
CC(=O)N1CCc2cc(Br)c(S(=O)(=O)NNC(=O)C3CCCC3)cc21	917738641	DQGQZFFAQLEBDU-UHFFFAOYSA-N	430.324	1.858	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)COc1ccccc1F)c1ccc(S(=O)(=O)N(C)C)cc1	918105063	NQXPIICCMFDSJD-ZDUSSCGKSA-N	438.481	1.546	50	20	IDGD	
CCOCCO[C@@H](C)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	918689589	YWVNUGVUEOZWBG-HNNXBMFYSA-N	427.523	1.064	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)NCc2ccc(S(=O)(=O)N(C)C)cc2)cc1	919907414	UWBLVSZSWJIWTP-UHFFFAOYSA-N	434.518	1.409	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C2=NN(c3ccccc3)C(=O)[C@H](C)N2)o1	920248705	PEBICGXUVGPWFN-AWEZNQCLSA-N	426.477	1.221	50	20	IDGD	
COc1ccc(CN2C[C@@H](C(=O)NNC(=O)c3cncn3-c3ccccc3)CC2=O)cc1	1115956056	WOIFBEHRCLLQAD-KRWDZBQOSA-N	433.468	1.691	50	20	IDGD	
Cc1nn([C@@H]2CCS(=O)(=O)C2)c(C)c1C=NNC(=O)c1cccc(S(C)(=O)=O)c1	1317827629	LYIDQJWSBXPUOE-OAHLLOKOSA-N	438.531	1.027	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)CNC(=O)c2cc(Cl)ccn2)cc1C	1318663627	YMQRUOYGTHNZOM-UHFFFAOYSA-N	438.893	1.402	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cnn(C3CCCC3)c2C)cc1	1319824974	VFENBBFZUHFASC-UHFFFAOYSA-N	433.534	1.697	50	20	IDGD	
CC(C)N(C)S(=O)(=O)c1ccc(NC(=O)NNC(=O)c2n[nH]c3c2CCCC3)cc1	1320405570	LYFFOEWIYIKVCU-UHFFFAOYSA-N	434.522	1.784	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@@H](CCC(N)=O)C(=O)NNc2ccc(F)cc2C)cc1C	1321129661	SNOMLVNEAMEXPP-SFHVURJKSA-N	436.509	1.807	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2ccc(OC)cc2)s1	1323179650	IGKJWZYJBCGUPA-UHFFFAOYSA-N	440.547	1.931	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3c[nH]c(Br)c3)cc2)CC1	1339111113	LWWVYNFXPHVFHK-UHFFFAOYSA-N	442.339	1.470	50	20	IDGD	
O=C(c1n[nH]c2c(F)cccc12)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1778638208	FZQNXASDYSSHEZ-PBHICJAKSA-N	443.248	1.836	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)C#CC3(O)CCCCC3)C2)C1	1779062346	LTKKWRGNNLSLPQ-UZLBHIALSA-N	441.366	1.546	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)COc3cc(Cl)ccn3)C2)C1	1779231720	FFLRNZRNZBOLIG-KDOFPFPSSA-N	432.304	1.198	50	20	IDGD	
CC(C)NC(=O)OC(C)(C)C(=O)N1CC[C@@]2(CN(C(=O)[C@H](C)Br)CCO2)C1	1781023908	PUVRRUFPMJSGKR-SCLBCKFNSA-N	448.358	1.513	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)c3nc4ccc(F)cn4n3)CCO2)C1	1781232599	LRDTZMMYPJKJJO-QZTJIDSGSA-N	444.294	1.548	50	20	IDGD	
O=C(c1[nH]nc2ccncc12)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781332074	ZDLFKHOTSQIARF-BBRMVZONSA-N	426.246	1.092	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(C#N)cc3Cl)C2)C1	1781972408	BDMPBRGYDGFCGN-OAQYLSRUSA-N	447.923	1.028	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)Cn1cncn1)C2	1781997613	DSUORMDOOGYUOA-BASYENTBSA-N	442.358	1.212	50	20	IDGD	
CCC[C@@H](NC(C)=O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](Cl)COC)C1	1782177707	ABGANNVRCUZQKW-WOCWXWTJSA-N	431.961	1.059	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(Cl)o1)C2	1782211968	KWSJPHFKUOKOPI-FOIQADDNSA-N	440.928	1.434	50	20	IDGD	
Cc1ccccc1OCC(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](C)Br)C2)C1	1783532399	HPJKERUMIIAFSG-BEFAXECRSA-N	425.323	1.987	50	20	IDGD	
Cc1nnc(CCC(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](C)Br)C3)C2)s1	1783532536	PENGUMNDXJPYLP-BDJLRTHQSA-N	431.356	1.392	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)CS[C@@H]3CCCCO3)CCO2)C1	1783534661	XUUGASZSBPRNDG-LXZKKBNFSA-N	435.384	1.860	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)COc3ccccc3F)CCO2)C1	1783538207	AIYKRBYINMEPFA-UGSOOPFHSA-N	429.286	1.818	50	20	IDGD	
COc1ccc(F)cc1CC(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](C)Br)C2)C1	1783540329	UEFIWPYBPFPEPM-YJYMSZOUSA-N	443.313	1.990	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3CC(=O)N(C4CCCC4)C3)[C@H]2C1	1784967645	DAXRDROMQGOILL-JAQSECSASA-N	439.984	1.775	50	20	IDGD	
CC(=O)O[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)Br)C[C@@H]21)C(C)C	1788479115	CLOVVIUVSLKIIJ-DGVSKKNDSA-N	433.343	1.337	50	20	IDGD	
COc1nc(C)ccc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21	1789013059	XRORDUZDNWCMRL-BPUTZDHNSA-N	440.338	1.777	50	20	IDGD	
CO[C@@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)[C@H]2C1	1789221857	KXPPNJWTXIIHOK-YWKPPDPDSA-N	449.460	1.148	50	20	IDGD	
CCc1[nH]nc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](Cl)COC)[C@H]3C2)c1Cl	1791253959	GFGMCACGSFJSAN-MNXVOIDGSA-N	433.336	1.473	50	20	IDGD	
COC(=O)CCCCCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CO[Si](C)(C)C)C[C@@H]21	1791354003	WFYGOYCXPQRMGK-BZSNNMDCSA-N	442.629	1.941	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCc1cccc(C#N)c1	1792833897	OIJLFHASLVDXSH-KUZCPNRJSA-N	434.334	1.864	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)CBr	1792872079	LMKCRVBLOUTSLK-UJPOAAIJSA-N	440.176	1.781	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2c(c1C)OCCO2	1796251815	RYPBQDPCCJSROM-KPEUIFRASA-N	438.908	1.223	50	20	IDGD	
CC(C)(C)OC(=O)NCC(C)(C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Cl	1796369740	BWQOLAJMIPVDRY-CRWXNKLISA-N	435.924	1.661	50	20	IDGD	
CCOc1c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](O)CCl)C3)cnc2c1cnn2C	1796534182	GBIOCZMUJUWPOZ-OQMKEHIESA-N	435.912	1.219	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc2c(c1)n(C)c(=O)n2C	1797505534	XWJNUCDGEPHYCB-MHEUCROKSA-N	449.349	1.912	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C/N=C/c1ccco1	1797839724	ZZEWJICMDOGZNY-ZYYYCMAYSA-N	426.311	1.462	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccn2ccnc2c1	1798105673	MGRDRMGEKQFDLQ-MVUGMWCJSA-N	447.499	1.720	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc3cccnc3[nH]1)C2	1798440475	MHZBZTMZSUPCBN-QDMKHBRRSA-N	433.472	1.127	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc([N+](=O)[O-])cc3c1OCC3)C2	1799269346	XRYLRSHMZVMWDS-RMHZUWNSSA-N	437.880	1.750	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](COC)NC(=O)OC(C)(C)C)C2	1799269567	IFEHRAUQJCYXKP-NPJQDHAYSA-N	447.960	1.133	50	20	IDGD	
Cc1cnc2c(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@@](C)(Cl)CCl)cnn2c1	1799276359	JUCBMBTUPUKYCJ-QPWUGHHJSA-N	440.331	1.477	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(C(F)F)no1)C2)[C@H](F)Br	1799346395	PYULSKVBDZKNAC-SSDHTEECSA-N	426.189	1.506	50	20	IDGD	
COc1ccc(F)cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Br	1799352265	NEXVHUWDQOSDTF-ANGCBRKESA-N	433.249	1.728	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](F)Br	1800159042	LUMNFWUNKDDWLJ-UTUVCQNLSA-N	442.289	1.449	50	20	IDGD	
Cc1cc(F)c(F)c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)c1	1800776575	SJBXNZCAYJRIPS-BJWYYQGGSA-N	428.244	1.519	50	20	IDGD	
CC(=O)N[C@@H](C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1801677487	UUJTZGIBDLQQDC-SLZITWOASA-N	444.960	1.281	50	20	IDGD	
CCC(=O)N[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1	1803429944	GCVFCGGNBOYHQB-XUWXXGDYSA-N	439.354	1.787	50	20	IDGD	
CCOC(=O)N1CCC(C(=O)N2CCC3(CCCN(C(=O)[C@H](O)CCl)C3)CC2)CC1	1805528967	CCHPKKJJUPTZJO-QGZVFWFLSA-N	443.972	1.686	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)/C=C/c2ccco2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807365470	XUJWXXXFUHFEJU-WFXHXQAFSA-N	445.284	1.387	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)c1cc2n(n1)CCCC2	1809861472	RWCQIZYACFKCHR-ZYSHUDEJSA-N	431.924	1.534	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)c3ccc(F)s3)CC2)C1	1809975028	POSPGSWMAANYLX-UHFFFAOYSA-N	430.310	1.726	50	20	IDGD	
CC[C@H](NC(C)=O)C(=O)N1CC[C@H](CNC(=O)CO[Si](C)(C)C)[C@H]1c1cccnc1	1810537867	QHGUOQIJAPXYOY-WSTZPKSXSA-N	434.613	1.854	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)/C=C/c2cnccn2)[C@H]1c1cccnc1	1813486764	LZWWJNKJQAHMKH-BXZJJLIQSA-N	429.908	1.845	50	20	IDGD	
Cc1ccc(CC(=O)NC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)o1	1813515035	PZZCTINZKZYZPP-FDDCHVKYSA-N	441.532	1.605	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCN2CCCCC2)n[nH]1	1816977682	BJYWTXKBFDVPRG-GOSISDBHSA-N	447.584	1.651	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)C(C)(C)NCCC#N)n[nH]1	1817319843	MTRADLQPCKKYMO-MRXNPFEDSA-N	446.556	1.057	50	20	IDGD	
C[C@H](NC(=O)c1cnccn1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](F)Cl)n[nH]1	1818039844	JQOUPHOKXYTEEX-PSOPSSQASA-N	437.863	1.545	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](N)Cc2cccnc2)n[nH]1	1818073706	YNYVPIBWFSVFDM-HLLBOEOZSA-N	434.928	1.621	50	20	IDGD	
Cc1nocc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819402286	ZKDRKHNOKKWCBZ-MRXNPFEDSA-N	438.448	1.324	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@@H](O)CCl)CC3)o1	1819783466	XWCBNIUGDCGSQU-KOLCDFICSA-N	426.882	1.520	50	20	IDGD	
COc1nccnc1C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1	1823001519	HHUAMHAQASJQCU-RDDDGLTNSA-N	444.286	1.858	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](O)CCl)CC2	1825958923	OKVIHSWMBKKDRL-FMSGJZPZSA-N	441.937	1.410	50	20	IDGD	
Cc1cc(C(=O)NCC(=O)N[C@@H]2CCc3nc(NC(=O)C(Cl)Cl)sc3C2)no1	1826099729	NIRWIBAWTBYLCC-MRVPVSSYSA-N	446.316	1.585	50	20	IDGD	
CC(C)O[C@@H](C)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827052267	RREDLNMFKDYGSF-LAUBAEHRSA-N	430.354	1.413	50	20	IDGD	
O=C([C@@H]1CCCS1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827055165	QXFJTESARNVVRT-PMACEKPBSA-N	430.379	1.495	50	20	IDGD	
CC(C)(C)OCC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1	1828923435	KHAZNHXEBNYUFM-IBGZPJMESA-N	445.564	1.734	50	20	IDGD	
CC(C)(C)c1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)cn1	1830720120	TUTOCOQSEGRLTN-IIBYNOLFSA-N	439.940	1.049	50	20	IDGD	
COc1cc(Cl)cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)c1	1830738047	KWOKETCNUGAOHR-QFBILLFUSA-N	447.315	1.018	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3sc(N)nc3C)C2)C1	1831647187	SFYYJWNZWGJFKQ-ACJLOTCBSA-N	430.958	1.511	50	20	IDGD	
Cc1ccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)cn1	1833133534	IGHYADTZXRZFGR-HNAYVOBHSA-N	440.338	1.172	50	20	IDGD	
C[C@H](Cn1cccn1)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1	1833200512	BWYHYIRKDVFMES-AYOQOUSVSA-N	447.363	1.212	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H]3CCc4ccoc4C3)CC2)CC1)[C@H](O)CCl	1833305854	AFZSUAMKVFOOLL-QFBILLFUSA-N	437.968	1.556	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)CCOc3ccccc3)CC2)CC1)[C@@H](O)CCl	1833308930	DVBXHNLRZJRSSH-FQEVSTJZSA-N	437.968	1.627	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)nn1C	1834122565	VQONGTQZZPIYOQ-ZWKOTPCHSA-N	433.336	1.035	50	20	IDGD	
CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1	1834813746	MFHYHOJEQXEGIA-FQEVSTJZSA-N	435.433	1.000	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCN3CCCCC3)CCO2)C1	1835128429	CRABTHMTKHFGJT-OAQYLSRUSA-N	429.989	1.584	50	20	IDGD	
CC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](Br)Cc3ccccc3)C2)C1	1835204355	AZEOLDFPMRNWLU-PKOBYXMFSA-N	425.323	1.469	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cnn(C)c3Cl)CC2)CC1	1836043366	NSOGGLLCZHNWTM-INIZCTEOSA-N	446.379	1.513	50	20	IDGD	
CC(C)(C)n1cc(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](F)Cl)CC3)CC2)nn1	1836174654	HKBNFOHTWHXZHT-MRXNPFEDSA-N	428.940	1.753	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)c3cnncc3C(=O)O)CC2)CC1	1836396741	MYEGJUHLYZZHKY-QGZVFWFLSA-N	437.928	1.377	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC1CCN(C2CCN(C(=O)Cc3cnc[nH]3)CC2)CC1	1836398680	XLPFLRNNWYJCMA-IBGZPJMESA-N	430.380	1.760	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC(OC2CCN(C(=O)[C@@H]3CCC(=O)N3)CC2)CC1	1836670151	BBHXZUYJPBPIKI-CJNGLKHVSA-N	444.370	1.295	50	20	IDGD	
O=C([C@H](O)CCl)N1CCC(OC2CCN(C(=O)[C@@H]3Cc4ccccc4CN3)CC2)CC1	1836717496	DJGZCIZVUXTGBF-LEWJYISDSA-N	449.979	1.299	50	20	IDGD	
N[C@@H](Cc1cscn1)C(=O)N1CCC(OC2CCN(C(=O)[C@H](F)Cl)CC2)CC1	1838062596	TZDZNOUDXCMUFU-HOTGVXAUSA-N	432.949	1.546	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(C)n(C(F)F)n3)CCO2)C1	1838707971	CKJLAZIVOPNFHE-SCLBCKFNSA-N	434.871	1.674	50	20	IDGD	
CCc1ncsc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)Br)C2)C1	1838839116	PUXUKWKQHLPXNP-PXAZEXFGSA-N	446.367	1.559	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(F)c3)CCO2)C1	1838912809	VOMVPBHJZUPROO-UGSOOPFHSA-N	429.286	1.679	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3c[nH]c4ccccc34)CCO2)C1	1839071849	NTPAXQYJMAAOBK-PGRDOPGGSA-N	449.935	1.421	50	20	IDGD	
C[C@H](C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2)n1cccn1	1839155531	WKADZXCXJNWPOC-FHLIZLRMSA-N	433.336	1.137	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)ccc1F	1839201577	BDYPVHQDYICASK-YJBOKZPZSA-N	447.276	1.895	50	20	IDGD	
O=C([C@@H]1C[C@@]1(F)Cl)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839203047	XOZITHDACJFXMJ-NUZBWSBOSA-N	431.661	1.058	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)cc1O	1839267958	OKFPHDFPOSKRQN-KUHUBIRLSA-N	441.322	1.554	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc([N+](=O)[O-])cc3F)CCO2)C1	1839278384	ONNYJJYSYHTUOQ-HNAYVOBHSA-N	443.859	1.821	50	20	IDGD	
CC(C)Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)cc1	1839404010	ZTMHJAPUZXTDHG-KNQAVFIVSA-N	438.952	1.555	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3snnc3C)C2)C1	1839963991	BRXAVKVCXNMMBT-MLGOLLRUSA-N	447.355	1.090	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3ccoc3)C2)C1	1839967111	AVWPELXCVRCVDF-APWZRJJASA-N	443.338	1.842	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cncc(O)c3)CCO2)C1	1840063117	QCMPWNPUDOXXSX-QZTJIDSGSA-N	432.304	1.094	50	20	IDGD	
O=C([C@H](F)Cl)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CCc3ccccc3O1)CCO2	1840136647	HBAUEOOZXOFILF-FUHIMQAGSA-N	426.872	1.371	50	20	IDGD	
C[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1)n1cccc1	1840353648	PCVIFUJFBBXMQG-LZQZEXGQSA-N	432.348	1.742	50	20	IDGD	
Cc1ccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)CCBr)C3)C2)o1	1840506689	OWLTUCPYEYGLPG-SFHVURJKSA-N	429.311	1.372	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)C3Cc4ccccc4C3)CCO2)C1	1840944382	DOCACZVSMAFKIY-DENIHFKCSA-N	436.936	1.112	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC12CN(C(=O)[C@H]1ON=C(c3ccccc3)O1)C2	1841288034	VGAFOZPMMWFOAX-SCLBCKFNSA-N	436.306	1.956	50	20	IDGD	
O=C(c1ccc2[nH]nc(C(F)(F)F)c2c1)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1	1841353413	XJIUAHVCLDHVOK-ZDUSSCGKSA-N	430.814	1.998	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCCC12CN(C(=O)[C@H](O)c1ccco1)C2	1841924012	NFJYWYLUYHVLLG-DZGCQCFKSA-N	441.912	1.649	50	20	IDGD	
Cc1nnc(CC(=O)N2CC3(CCCN3C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)o1	1841924517	VLWDEZCQCKVQLF-ZDUSSCGKSA-N	441.916	1.256	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)Cc2ccc(F)cc2)C1	1842714732	SRQPSURPDISLSG-MFKUBSTISA-N	425.464	1.706	50	20	IDGD	
Cc1ccc2[nH]cc(CC(=O)N3CC4(CCCN4C(=O)c4ccc(B(O)O)cc4)C3)c2c1	1843010583	HBRDTQJAHXEKCO-UHFFFAOYSA-N	431.301	1.216	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1cnc(Cl)nc1)C2	1843415014	AZMGEALVOKLIAW-WYMPLXKRSA-N	429.868	1.081	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CCCC23CN(C(=O)[C@H](F)Br)C3)cc1O	1845556446	CPZAKHLCAAMQMU-AWEZNQCLSA-N	428.258	1.858	50	20	IDGD	
COc1cccc2[nH]cc(C(=O)N3CCCC34CN(C(=O)c3cnccc3C(=O)NN)C4)c12	1845649796	NQHRPLNVDGTGJH-UHFFFAOYSA-N	448.483	1.306	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)c1cc3cc(F)c(F)cc3[nH]1)C2	1846384948	CPRLYMKCVNLWES-UHFFFAOYSA-N	433.459	1.636	50	20	IDGD	
CCN1CCN(c2ccc(C(=O)N3CCCC34CN(C(=O)[C@@H](O)CCl)C4)cc2)CC1	1846898385	DBNQUZRKAQDTFB-IBGZPJMESA-N	434.968	1.245	50	20	IDGD	
N#Cc1ccc(CCC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2cnccc2C(=O)NN)cc1	1847211924	ZPPZZVOCABNFJO-PMACEKPBSA-N	432.484	1.005	50	20	IDGD	
O=C(COC(=O)C(O)(c1ccccc1)c1ccccc1)NNC(=O)c1ccc([N+](=O)[O-])cc1	9180474	FRTWOVHJEMYLAD-UHFFFAOYSA-N	449.419	1.835	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)CCN2C(=O)NC3(CCCC3)C2=O)cc1OC	21966880	QYHSVRTUJZBBOH-UHFFFAOYSA-N	446.504	1.890	50	20	IDGD	
Cc1nnc(SCc2c(C(=O)NNC(=O)C(=O)NC3CC3)oc3ccccc23)s1	109813570	BMZBXPXYSFNRGH-UHFFFAOYSA-N	431.499	1.925	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2Cc3ccccc3C[C@H]2c2nnc(C)o2)n1	303013390	XNGNIINHPSWZPB-INIZCTEOSA-N	426.502	1.632	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCC[C@@H](N(C)C(=O)OC(C)(C)C)C2)n1	725813965	SLGSEASKYYPZHO-CQSZACIVSA-N	425.555	1.473	50	20	IDGD	
Cc1c([C@@H](C)NC(=O)NNC(=O)CNC(=O)c2ccco2)cnn1-c1ccc(F)cc1	725871835	HLIPNDUWNTXXPZ-GFCCVEGCSA-N	428.424	1.734	50	20	IDGD	
COc1ccc(OC2CCN(C(=O)NNC(=O)CNC(=O)c3cccs3)CC2)cc1	725874406	ZYNUFPSUMNXGTB-UHFFFAOYSA-N	432.502	1.771	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@@H](C)NC(=O)c2n[nH]c3ccccc23)cc(OC)c1OC	726373268	WNPAZAXOFCDGNJ-LLVKDONJSA-N	441.444	1.168	50	20	IDGD	
CCOc1ccc(OCC)c(NC(=S)NNC(=O)CN2C(=O)N[C@](C)(C3CC3)C2=O)c1	727492395	PBYVVAKHIQWQHZ-HXUWFJFHSA-N	449.533	1.522	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)COc1ccc(F)cc1)c1cccc(S(=O)(=O)N(C)C)c1	727611227	XMEATCKHAPSJAX-ZDUSSCGKSA-N	438.481	1.546	50	20	IDGD	
O=C(NNc1nc(-c2cccnc2)no1)c1ccc2c(c1)C(=O)N(C[C@@H]1CCCO1)C2=O	728078335	ASFBRIWKOTWEKE-AWEZNQCLSA-N	434.412	1.664	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3cc(O)nc4ccccc34)cc2)CC1	728214114	YFFWHVUMSKBUOF-UHFFFAOYSA-N	441.513	1.633	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNS(=O)(=O)c2ccc3nc(O)oc3c2)c1	728508499	REBLRRKAHYLGQG-UHFFFAOYSA-N	442.247	1.928	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)CC(C)(C)C)CC2)cc1OC	728607806	CWTBUCWAQTZOHC-UHFFFAOYSA-N	441.550	1.688	50	20	IDGD	
Cc1nc(COc2ccc(Cl)cc2)sc1C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O	729274981	IMNQUPCASNXYII-SNVBAGLBSA-N	446.938	1.383	50	20	IDGD	
CC[C@H](N=c1nn[nH]n1-c1ccccc1)C(=O)NNC(=O)c1cc(-c2ccccc2)[nH]n1	729283778	LMVHXBWOKPRCMC-INIZCTEOSA-N	431.460	1.126	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN(S(=O)(=O)Cc2ccccc2)C1)c1ccc2c(c1)OCO2	730512732	PYIVDEWBGLGGKT-QGZVFWFLSA-N	445.497	1.418	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)c1ccc(S(=O)(=O)NC[C@@H]2CCCO2)cc1	731344250	CPOOZAOGCQIJNC-INIZCTEOSA-N	435.477	1.287	50	20	IDGD	
CCS(=O)(=O)N(C)C1CCN(C(=O)NNC(=O)c2cccc(OC(F)F)c2)CC1	731362880	MVXQTFDWQJFJTK-UHFFFAOYSA-N	434.465	1.388	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@H](NC(=O)NN[C@@]1(C)CCS(=O)(=O)C1)C1CCCCC1	732474369	BWTQTUINVDJZET-KXBFYZLASA-N	432.587	1.841	50	20	IDGD	
COc1cc(CNC(=O)NNC(=O)NCc2ccc(Cl)cc2)ccc1OCC(N)=O	733037462	ALJCKTLWGXIREK-UHFFFAOYSA-N	435.868	1.426	50	20	IDGD	
CN(C)CC(=O)NNC(=O)C1CCN(S(=O)(=O)c2c(Cl)cccc2Cl)CC1	733361220	VGOKIBJBHCEMJA-UHFFFAOYSA-N	437.349	1.103	50	20	IDGD	
COCCN(CCOC)S(=O)(=O)c1ccc(C(=O)NNc2nccnc2Cl)cc1	734260450	OSICVDWWBSGQSA-UHFFFAOYSA-N	443.913	1.170	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2cccc3cccnc23)c1	734740842	XWSPTXOOCLJHKM-UHFFFAOYSA-N	434.499	1.108	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNS(=O)(=O)CCOc1ccc(F)cc1	736419590	WENQEJMLHGHXQO-UHFFFAOYSA-N	444.510	1.070	50	20	IDGD	
C[C@@H]1CN(C[C@@H](C)C(=O)NN=Cc2c(N3CCOCC3)nc3ccccn23)C[C@@H](C)O1	741812002	JWFRTZJJENDFID-KZNAEPCWSA-N	428.537	1.366	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1cccs1)C(=O)NNC(=O)c1cccc(Br)c1	742773033	KNEOMNLZHODQPE-SECBINFHSA-N	432.321	1.639	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)N1CCCC1=O	743284343	BXJVTCLMXQUPIZ-QGZVFWFLSA-N	436.534	1.023	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)[C@H](CNC(=O)OC(C)(C)C)c2ccccc2)C[C@@H](C)O1	743292314	XLFMPJZIONGDMJ-ZIFCJYIRSA-N	448.564	1.942	50	20	IDGD	
Cc1nn(C)c(C)c1S(=O)(=O)N[C@@H](C)C(=O)NNc1ccc(Br)cc1	743299840	UOQXKPMISROUSA-JTQLQIEISA-N	430.328	1.610	50	20	IDGD	
O=C(CCN1C(=O)[C@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O)Oc1ccc([N+](=O)[O-])cc1Br	744168162	KCGHMCVSBVHZMK-UXOAXIEHSA-N	439.218	1.815	50	20	IDGD	
Cc1cc(N2CC[C@@H](NC(=O)NNC(=O)c3cc(C)n(-c4ccccc4)c3C)C2=O)n(C)n1	745906732	UAQUYLPGQSGRPZ-LJQANCHMSA-N	449.515	1.886	50	20	IDGD	
CC(=O)N[C@@H](CC(=O)NNC(=O)c1ccc(CSc2ccc(Cl)cc2)cc1)C(N)=O	746093111	KVRHUJAETJBRND-KRWDZBQOSA-N	448.932	1.773	50	20	IDGD	
Cc1ccc([C@H](CNC(=O)NNC(=O)Cc2cn3ccccc3n2)N2CCOCC2)cc1	746757885	RVLBGVAWAYEPGF-FQEVSTJZSA-N	436.516	1.589	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NNC(=O)c1ccc(C#N)cc1	747102256	JYWKHNOPKXSKBD-NSHDSACASA-N	446.261	1.763	50	20	IDGD	
CSC[C@H](C(=O)NNC(=O)CCOc1ccccc1)N1C(=O)[C@@H]2CCCC[C@H]2C1=O	747182575	OIVKILGBNZHZRQ-BRWVUGGUSA-N	433.530	1.510	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(Cl)c(NS(C)(=O)=O)c2)cc1	747243552	OOQVOTKTALTTGN-UHFFFAOYSA-N	439.877	1.638	50	20	IDGD	
Cc1nc(S(=O)(=O)N2CCC(C(=O)NN=c3sc4ccccc4n3C)CC2)cn1C	747622122	GVOOXNDIUDWEGX-UHFFFAOYSA-N	448.574	1.315	50	20	IDGD	
Cc1cc(C)c(C)c(S(=O)(=O)N2CCC(C(=O)NNc3nccn(C)c3=O)CC2)c1C	747946366	ZZVNXTHFIVQOSL-UHFFFAOYSA-N	447.561	1.558	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2nn(-c3ccc(F)cc3)cc2O)c2ccccc2c1=O	748008648	KCWAJLQCSOEFNC-UHFFFAOYSA-N	436.403	1.522	50	20	IDGD	
Cc1nccn1C[C@H](C)CNC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	749195474	BMMUAMUUNCLJJS-OAHLLOKOSA-N	448.549	1.256	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCn2cncc2C1)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	749568579	OGGJKGRYWVAYSG-LJQANCHMSA-N	442.483	1.609	50	20	IDGD	
C[C@@H](C(=O)OCC(=O)NNC(=O)c1ccc(Cl)cc1)N1C(=O)[C@H]2CCCC[C@H]2C1=O	750280455	PRUWPMQWSVLOKS-TUKIKUTGSA-N	435.864	1.208	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N[C@H]1CC(=O)N(C2CC2)C1	750654558	CVMAZADFKKSKCJ-PWSUYJOCSA-N	425.283	1.310	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2ccc(CS(C)(=O)=O)o2)c2ccccc2c1=O	751055216	QFUPOUWJKBOEAI-UHFFFAOYSA-N	432.458	1.019	50	20	IDGD	
CC(C)NC(=O)C(=O)NNC(=O)c1ccc2c(ccn2CCCNC(=O)OC(C)(C)C)c1	751310133	YUKACVKAEONRMV-UHFFFAOYSA-N	445.520	1.842	50	20	IDGD	
N#Cc1ccc(CN2CC[C@H](NC(=O)NNC(=O)c3cccc4ncccc34)C2=O)cc1	753289691	OQXAUIFKRKXNLQ-FQEVSTJZSA-N	428.452	1.852	50	20	IDGD	
O=C(NCc1cc(Cl)cc2c1OCC2)NNC(=O)c1csc(N2CCOCC2)n1	754133880	JYRVZLVMASHHDL-UHFFFAOYSA-N	437.909	1.712	50	20	IDGD	
CCCC[C@H](NC(=O)[C@@H](C)NC(=O)C(C)(C)C)C(=O)NNC(=O)c1ccc(C#N)cc1	755252571	BYKSBVBRPCSKPZ-PBHICJAKSA-N	429.521	1.545	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2ccccn2)cc1S(=O)(=O)N1CCCCC1	755412201	BWHFCTVHAGQTFT-UHFFFAOYSA-N	433.490	1.731	50	20	IDGD	
Cc1ccc(NC(=O)c2ccccc2)cc1NC(=O)NNC(=O)[C@H](C)NS(C)(=O)=O	755913118	OEEBGUDAUFGUIM-ZDUSSCGKSA-N	433.490	1.338	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)NCCN2C(=O)[C@@H]3[C@@H](C2=O)[C@H]2C=C[C@H]3C2)c2ccccc2n1	756099173	UVANELDOTIHDAV-LSOMNZGLSA-N	433.468	1.294	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)cc1-n1nnnc1C	756318418	HXCMKCAVSHRQLS-LLVKDONJSA-N	429.412	1.739	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)Nc2cc(-n3cnnn3)ccc2F)cc1	756335971	OLSJJMCEOZAUFQ-LBPRGKRZSA-N	427.396	1.624	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)Nc1cc(C(=O)OC)c(F)cc1Br	756741877	YDXPCGXKEMMRFC-QMMMGPOBSA-N	436.234	1.579	50	20	IDGD	
O=C(NNC(=O)c1ccc(Br)s1)Nc1cnn(CCN2CCOCC2)c1	756826138	AHWXULGJZUFCDO-UHFFFAOYSA-N	443.327	1.506	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1F	757631882	UHWPBRPDGLRONF-UHFFFAOYSA-N	440.453	1.560	50	20	IDGD	
COCc1cc(NC(=O)NNC(=O)c2nn(CCC(C)C)c(=O)c3ccccc23)ncn1	757720174	BYMDZAJTDBBPSR-UHFFFAOYSA-N	439.476	1.846	50	20	IDGD	
O=C(NNC(=O)c1cc(N2CCCC2=O)cc(C(F)(F)F)c1)C(=O)Nc1ccccn1	758841698	RDUISFGRIRLMFE-UHFFFAOYSA-N	435.362	1.627	50	20	IDGD	
O=C(NNc1ncccc1[N+](=O)[O-])c1ccc2c(c1)S(=O)(=O)N(C[C@H]1CCCO1)C2=O	759285831	QAZYOFWIJZJYLR-GFCCVEGCSA-N	447.429	1.070	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@@H](CCC(N)=O)C(=O)NNc2c(F)cccc2F)cc1C	760462756	HSABIEYUOIVCBE-INIZCTEOSA-N	440.472	1.637	50	20	IDGD	
CC(=O)N(CCc1ccccc1)CC(=O)OCC(=O)NNC(=O)c1ccc(Cl)cc1	761591460	ZKTMKQYPEJGXCV-UHFFFAOYSA-N	431.876	1.735	50	20	IDGD	
C=CCNS(=O)(=O)c1ccc(C(=O)NNC(=O)CSc2ccccc2OC)cc1	761632335	DKOWWDWPQPHMFP-UHFFFAOYSA-N	435.527	1.713	50	20	IDGD	
Cc1c(C(=O)NNc2nccc(N3CCOCC3)n2)nnn1-c1ccc2ncccc2c1	762852086	RCARMBBKTNNUPL-UHFFFAOYSA-N	431.460	1.507	50	20	IDGD	
O=C(NNC(=O)c1ccc(S(=O)(=O)Nc2nccs2)cc1)c1ccc([N+](=O)[O-])cc1	763013438	OROMQCABMDXWGO-UHFFFAOYSA-N	447.454	1.927	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C)c(C)c(NC(=O)C(=O)NNC(=O)c2ccccc2)c1	763429812	ALLFNBQVMPLCIG-UHFFFAOYSA-N	446.529	1.734	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1cccn(Cc2ccccc2)c1=O	763470886	PKQDVFVIXDXLMK-UHFFFAOYSA-N	435.396	1.205	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(O[C@H]3CCOC3)cc2)cc1OC	763551528	YAOSGGSHLITPQM-INIZCTEOSA-N	429.429	1.271	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cnc(Br)c(C)c2)cc1	763661537	NNVKNHLRBTZOMC-UHFFFAOYSA-N	437.250	1.326	50	20	IDGD	
COC(=O)N(C)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C)c(C)c2)cc1	763667270	SWAAROZLBYWRPO-UHFFFAOYSA-N	428.445	1.671	50	20	IDGD	
Cc1ccc(N2CCOC2=O)cc1NC(=O)C(=O)NNC(=O)COc1ccccc1F	763682343	MJABDTYKIVQOQO-UHFFFAOYSA-N	430.392	1.256	50	20	IDGD	
CCN(CC)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C)cc2)cc1	763808470	BMZKSZUDESMMLW-UHFFFAOYSA-N	426.473	1.642	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C)cc2)cc1N1CCOC1=O	763821041	QOIHLPAQQYVVOQ-UHFFFAOYSA-N	442.428	1.125	50	20	IDGD	
CC(=O)N(Cc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)cc1)C1CC1	763838881	WDAUWDXPZPRZHK-UHFFFAOYSA-N	442.447	1.502	50	20	IDGD	
CC(C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)cc1	763864711	GJTLUQSVRHMYGD-ZDUSSCGKSA-N	430.436	1.517	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(C(C)=O)cc2)cc1OC	763873706	XVWTXACBWUTKJR-ZDUSSCGKSA-N	429.429	1.460	50	20	IDGD	
Cc1ccn(-c2ccccc2NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)n1	763873771	WDZMEJIWTSXPEI-CQSZACIVSA-N	425.420	1.873	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)C(=O)Nc1cnc(C2CC2)nc1	763881360	CRTAFNKJFBIZIO-SNVBAGLBSA-N	448.277	1.670	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)C(=O)Nc1ccc(F)cc1I	763997063	UZKFBAYXJILOCJ-UHFFFAOYSA-N	430.177	1.169	50	20	IDGD	
N#Cc1ccc(-n2ccc(NC(=O)C(=O)NNC(=O)Cc3ccsc3)n2)c(Cl)c1	764034064	DFZNINGTCBKMRA-UHFFFAOYSA-N	428.861	1.787	50	20	IDGD	
CC[C@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(CCn2nnc(-c3ccccc3)n2)cc1	764087201	XSKIPWLOHHNBQE-HNNXBMFYSA-N	435.488	1.715	50	20	IDGD	
COc1cc(Br)c(NC(=O)C(=O)NNC(=O)CCc2ccco2)cc1OC	764176509	CKOONJHXLMKMNE-UHFFFAOYSA-N	440.250	1.778	50	20	IDGD	
CCCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)CCCc2ccccc2)cc1	764224302	OMLYAYKTHXGGOO-UHFFFAOYSA-N	446.529	1.947	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)C(=O)Nc2cnn(CC(C)C)c2)c1	764233245	VBLYUGNMWVDFRX-UHFFFAOYSA-N	438.282	1.710	50	20	IDGD	
Cc1ncsc1C(=O)NNC(=O)C(=O)Nc1cccc(N2CCN(C(C)C)CC2)c1	764247630	VGKUKXGLAFCEFK-UHFFFAOYSA-N	430.534	1.382	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)C(=O)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1	764267248	FTCFAPMQYQJYNO-IBGZPJMESA-N	447.499	1.054	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)C(=O)Nc1cccc(CN2CCOC2=O)c1	764278211	MVWPMUCYILWBLS-UHFFFAOYSA-N	426.429	1.063	50	20	IDGD	
CN1CCOc2ccc(NC(=O)C(=O)NNC(=O)c3cc(Br)ccc3O)cc21	764280412	OLZFZOGXAOVHJM-UHFFFAOYSA-N	449.261	1.383	50	20	IDGD	
CN(C(=O)c1ccccc1NC(=O)C(=O)NNC(=O)Cc1cc[nH]n1)C1CCCCC1	764286281	QWWMCDGGEYREJD-UHFFFAOYSA-N	426.477	1.143	50	20	IDGD	
COC(=O)Nc1cc(NC(=O)C(=O)NNC(=O)c2ccc(OC)cc2OC)ccc1F	764287271	YMBQLQHKXHPPQF-UHFFFAOYSA-N	434.380	1.421	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(N(C)C)cc2)cc1Br	764327371	YNDJWAAOFCYCER-UHFFFAOYSA-N	435.278	1.923	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(OCC#N)c2)cc1Br	764327388	ZDJTYFPUNVQLJF-UHFFFAOYSA-N	447.245	1.760	50	20	IDGD	
C[S@@](=O)Cc1ccccc1NC(=O)C(=O)NNC(=O)C(F)(F)Oc1ccccc1	764379284	VEMUOBYKHWNMRN-GDLZYMKVSA-N	425.413	1.323	50	20	IDGD	
CCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)cc1	764387315	JPINRSDCULFMLH-UHFFFAOYSA-N	438.419	1.365	50	20	IDGD	
O=C(NNC(=S)NCc1ccon1)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	764438905	RBOYLWRBCPAUIX-UHFFFAOYSA-N	434.485	1.686	50	20	IDGD	
CCn1c(SCC(=O)NN=C(C)CS(=O)(=O)CC)nnc1-c1ccc(OC)cc1	764745255	AUKXGFHGGCQKQU-UHFFFAOYSA-N	439.563	1.993	50	20	IDGD	
O=C(CSc1nnc(-c2cccnc2)n1Cc1ccco1)NNC(=O)NCC1CC1	765118355	BMZNUYFFHZSYAP-UHFFFAOYSA-N	427.490	1.814	50	20	IDGD	
C=CCNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)cc1	765619792	NEBUYNOQYMDTOA-UHFFFAOYSA-N	443.460	1.755	50	20	IDGD	
C[C@H](Oc1cccc(F)c1)C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765735352	KJSWCVGAMFYSHW-INIZCTEOSA-N	428.464	1.198	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)N[C@H]1CCN(CCCc2ccccc2)C1=O	765815706	BQIAKQYLCOLPFG-SFHVURJKSA-N	430.530	1.950	50	20	IDGD	
Cc1c(Br)cc(C(=O)NNC(=S)NCCc2cccs2)c(=O)n1C	768185883	DETBWTCQMVHQRU-UHFFFAOYSA-N	429.365	1.869	50	20	IDGD	
CCn1c(SCC(=O)NN=Cc2cn(CC(=O)O)nn2)nnc1-c1ccc(Cl)cc1	768482670	DZQKPOLLCNZRPM-UHFFFAOYSA-N	448.896	1.537	50	20	IDGD	
CS(=O)(=O)c1cc(C(=O)NNC(=S)Nc2ccccn2)ccc1Br	768585882	UWHVBRAOBISJJQ-UHFFFAOYSA-N	429.321	1.879	50	20	IDGD	
CCOc1cc(/C=C/C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)ccc1O	768631644	YDDRPYDHDODRGH-VQHVLOKHSA-N	429.385	1.717	50	20	IDGD	
CSCCNC(=S)NNC(=O)CN1C(=O)COc2cc(Br)ccc21	769766246	TZKIQECXKZKIOU-UHFFFAOYSA-N	433.353	1.033	50	20	IDGD	
COC(=O)C1(O)CCN(C(=O)/C(C#N)=C\c2cn(CCC#N)nc2-c2ccccc2)CC1	770249968	IVHYAFCCSOKTIZ-JXAWBTAJSA-N	433.468	1.897	50	20	IDGD	
CO[C@H](c1ccc(F)cc1)[C@H](C)NC(=O)NNC(=O)c1csc(N2CCOCC2)n1	770754935	YBAUPZXFXKLCDP-LRDDRELGSA-N	437.497	1.839	50	20	IDGD	
CN(CCNC(=O)NNC(=O)c1cnn(-c2ccccc2)c1)S(=O)(=O)c1cccs1	771993272	UTIDKWRSCXHSRJ-UHFFFAOYSA-N	448.530	1.199	50	20	IDGD	
O=C(COC(=O)C1=NN(c2ccccc2)C(=O)CC1)NNC(=O)c1cccc(Cl)c1	772857607	KVAQOCSXRLJTMQ-UHFFFAOYSA-N	428.832	1.827	50	20	IDGD	
Cc1ccc(CC(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)cc1O	772922091	WMCZXPXDUVSCSF-UHFFFAOYSA-N	430.936	1.862	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)CCc1ccc(S(N)(=O)=O)cc1	772998869	YLDKCOXDMQTPRS-GFCCVEGCSA-N	425.894	1.535	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNS(=O)(=O)c1cnn(CC(F)(F)F)c1	773252655	VXDCDWLXFUIKNI-SECBINFHSA-N	426.804	1.876	50	20	IDGD	
CC(C)COc1ccc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1	773645403	KGLLRNBIJFRMTG-IBGZPJMESA-N	428.441	1.866	50	20	IDGD	
CCCc1c(NC(=O)C(=O)NN[C@]2(C)CCS(=O)(=O)C2)cnn1-c1cccc(C)c1	773646201	STITYMNJGRHSOU-HXUWFJFHSA-N	433.534	1.270	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1cccc(NC(=O)C(=O)NNc2ccccc2[N+](=O)[O-])c1	773655480	RGLFJTCUWCJCOB-UHFFFAOYSA-N	435.462	1.753	50	20	IDGD	
C=CCN(C)S(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(C)c(F)c2)cc1	773890705	ZNLGTYPAOQABSV-UHFFFAOYSA-N	448.476	1.340	50	20	IDGD	
COc1cccc(-c2cc(NC(=O)C(=O)NNC(=O)c3ccc(C)c(F)c3)n(C)n2)c1	773891004	YBLYAJQUBIQEHX-UHFFFAOYSA-N	425.420	1.943	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)Nc2ccc(C[C@H]3NC(=O)NC3=O)cc2)c2ccccc2n1	775703876	SMPYSPOEBZVXPA-GOSISDBHSA-N	432.440	1.760	50	20	IDGD	
O=C(COc1ccc(Cl)cc1)NNC(=O)Nc1ccnn1[C@@H]1CCS(=O)(=O)C1	776052493	AADYHWJWVWSIGF-GFCCVEGCSA-N	427.870	1.128	50	20	IDGD	
O=C(Cc1ccc2ccccc2c1)NNC(=O)N[C@H]1CCO[C@]2(CCS(=O)(=O)C2)C1	776074103	WZNYOZLXVNMPCW-GHTZIAJQSA-N	431.514	1.449	50	20	IDGD	
COc1cccc2[nH]cc(CC(=O)NNC(=O)CN(C)S(=O)(=O)c3ccc(C)cc3)c12	778529477	FCHIQJIQOZGNDD-UHFFFAOYSA-N	444.513	1.496	50	20	IDGD	
CCCCN(CC(=O)NNC(=O)c1cc(Cl)ccc1OC)[C@@H]1CCS(=O)(=O)C1	779031937	CKDCBDUAXMUVIT-CQSZACIVSA-N	431.942	1.399	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNS(=O)(=O)c2cccc(C(F)F)c2)cc1	780365493	NCQBDIRQAZQXON-UHFFFAOYSA-N	447.485	1.563	50	20	IDGD	
O=C(NCc1ccccc1CN1CC[C@@H](O)C1)NNC(=O)c1cccc(OC(F)F)c1	781801134	NRFOXOOKYAESPF-QGZVFWFLSA-N	434.443	1.999	50	20	IDGD	
O=C(NNc1ncncc1Cl)[C@@H]1CCCCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1	781818674	FTLWHYWKCPEURK-AWEZNQCLSA-N	440.869	1.725	50	20	IDGD	
O=C(NNC(=O)c1ccc(Br)s1)C(=O)Nc1ccc(OC2COC2)cc1	782121344	VEJCYBRHRQRAOE-UHFFFAOYSA-N	440.275	1.688	50	20	IDGD	
Cn1c(=NNC(=O)C(=O)Nc2ccccc2CN2C(=O)CCC2=O)sc2ccccc21	783349981	SXFZGGNYGXAQLB-UHFFFAOYSA-N	437.481	1.459	50	20	IDGD	
NC(=O)c1cc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)ccc1F	783409246	QYHGQIRMRIRFQN-UHFFFAOYSA-N	448.354	1.300	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NN=C(C)[C@H]1CCCO1)N(S(C)(=O)=O)CC2	783809352	CBSYQIGJWQBLGS-DLBZAZTESA-N	439.534	1.624	50	20	IDGD	
Cc1c([N+](=O)[O-])cn(CC(=O)NNC(=O)c2cccc(C#N)c2)c(=O)c1Br	783928278	OSEVHSRGHMQRIO-UHFFFAOYSA-N	434.206	1.160	50	20	IDGD	
C[C@H](NC(=O)CNC(=O)COC(=O)/C(C#N)=C/c1ccc(O)cc1)c1ccc(F)cc1	784019390	FSRRVXAVUJQDHR-FBJMNJBLSA-N	425.416	1.975	50	20	IDGD	
Cc1cc(S(N)(=O)=O)cc(NC(=O)C(=O)NNc2ccc(OC(F)F)cc2)c1C	784307915	IRQKSFUTPMXMDF-UHFFFAOYSA-N	428.417	1.634	50	20	IDGD	
O=C(NNc1ccc(OC(F)F)cc1)C(=O)Nc1ccc(S(=O)(=O)NC2CC2)cc1	784310985	MMBLHVRWAFANMK-UHFFFAOYSA-N	440.428	1.811	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)C(=O)Nc1ccc(Cc2ccncc2)cc1	785068157	VCPMRASAQHJEMT-UHFFFAOYSA-N	428.452	1.649	50	20	IDGD	
CNC(=O)[C@@H]1CN(C(=O)C(=O)NNc2nc(C(F)(F)F)cs2)c2ccccc2O1	785145318	NWCAQLFWPWAZOW-JTQLQIEISA-N	429.380	1.145	50	20	IDGD	
COc1cc(F)c(NC(=O)C(=O)NNc2c(OC)cccc2S(C)(=O)=O)cc1OC	785330422	HCLSNZZFZQJZCK-UHFFFAOYSA-N	441.437	1.337	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CNC(=O)c2cccs2)cc(Br)c1OC	786054353	JKLVMCVDQHORAY-UHFFFAOYSA-N	442.291	1.719	50	20	IDGD	
Cn1nc(-c2ccsc2)cc1NC(=O)C(=O)NNC(=O)c1cc([N+](=O)[O-])ccc1O	787570984	QDQWYDAHRMDCHX-UHFFFAOYSA-N	430.402	1.162	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN(C)[C@H]2CCN(Cc3ccccc3)C2=O)cc1OC	789524613	AUTQOHWEBADLFH-SFHVURJKSA-N	440.500	1.198	50	20	IDGD	
COc1nc(Br)ccc1NC(=O)C(=O)NNC(=O)c1cccc2ncccc12	789584749	PPQVBVNYOJLPPG-UHFFFAOYSA-N	444.245	1.801	50	20	IDGD	
Cc1cc(-n2cccn2)ccc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccccc2)[nH]n1	789587402	XNFMPEOEWOQEQG-UHFFFAOYSA-N	429.440	1.971	50	20	IDGD	
CN(NC(=O)c1cc(O)nc2ccc(S(=O)(=O)N3CCOCC3)cc12)c1ccccc1	789828721	BJHMALSSXJLNRN-UHFFFAOYSA-N	442.497	1.743	50	20	IDGD	
Cc1cc(F)cc(-n2cc(C(=O)NNc3ccc(S(=O)(=O)NC4CC4)cc3)nn2)c1	789925188	WTSOUPNLMKXVRQ-UHFFFAOYSA-N	430.465	1.912	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])o1)[C@H]1OCC[C@H]1c1ccccc1	790319520	QKMDHSVXTJDNEC-MPGHIAIKSA-N	442.428	1.513	50	20	IDGD	
O=C(NNC(=O)c1cnccn1)C(=O)Nc1c2c(nn1-c1ccc(Cl)cc1)CCC2	792269884	YBJBJSUQWFUZEK-UHFFFAOYSA-N	425.836	1.204	50	20	IDGD	
Cc1nnnn1[C@@H](Cc1ccccc1)C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	794721010	OIGJKOKPKKRUAN-SFHVURJKSA-N	429.506	1.159	50	20	IDGD	
O=C(Cc1coc2ccccc12)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	794743108	WMTOSUIYHBQWOM-UHFFFAOYSA-N	443.481	1.457	50	20	IDGD	
C[C@@](O)(CSc1cccc(F)c1)C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	795194357	BJNOPIQIEFIIGR-GOSISDBHSA-N	426.491	1.534	50	20	IDGD	
CCNC(=O)N(C)c1cccc(NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)c1	797004174	HHNAPUQKMZIELO-UHFFFAOYSA-N	436.472	1.593	50	20	IDGD	
O=C(NNC(=O)c1cc2ccccc2o1)C(=O)Nc1ccc(F)c(N2CCOC2=O)c1	797005238	BWXINSAJBHAMSK-UHFFFAOYSA-N	426.360	1.928	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)c1nnn(CCOc2ccc(F)cc2)c1C	799915078	JVQRSEKIMHYQEU-UHFFFAOYSA-N	427.436	1.817	50	20	IDGD	
CNC(=O)CNC(=O)c1cccc(NC(=O)C(=O)NNc2ccc(C(F)(F)F)cc2)c1	800627956	TWAFQPREGVEYOJ-UHFFFAOYSA-N	437.378	1.263	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)CSc2nnnn2C2CC2)c(OC)cc1Cl	802086095	RJDDUKUPCIXRNQ-UHFFFAOYSA-N	427.874	1.624	50	20	IDGD	
CS(=O)(=O)NC1CC(NC(=O)NNC(=O)COc2ccccc2-c2ccccc2)C1	802419886	HEWCHWJCXMOPHJ-UHFFFAOYSA-N	432.502	1.143	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2ccc(C(F)(F)F)s2)CC1	806872766	NKEGQTFDSFQOFM-UHFFFAOYSA-N	449.480	1.855	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2cc(C)c(F)cc2Cl)c2ccccc2c1=O	806974386	IYNOEOBTMVEJNG-UHFFFAOYSA-N	445.838	1.917	50	20	IDGD	
O=C1COC[C@@H](C[C@H]2CN(C(=O)C(=O)NNc3c(F)cccc3Cl)c3ccccc32)N1	806983326	ODTVQAVQVPZDPP-QWHCGFSZSA-N	446.866	1.958	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)NC1C[C@@H]2CC[C@H](C1)N2CC(=O)N(C)C	807514690	MXBCGXNLRVYMDH-GOOCMWNKSA-N	437.928	1.376	50	20	IDGD	
N#Cc1cc(Oc2ccc(NC(=O)C(=O)NNc3ccc(-n4cccn4)nn3)cc2)ccn1	810393443	NNVTUUDNLUKRFR-UHFFFAOYSA-N	441.411	1.803	50	20	IDGD	
CCOc1ccc(OC)cc1NC(=O)C(=O)NNc1ccccc1S(=O)(=O)N(C)C	815752048	ZQAVDTPMZCKCBK-UHFFFAOYSA-N	436.490	1.426	50	20	IDGD	
C[C@@](O)(C(=O)N1CCN(S(=O)(=O)CBr)CC1)c1ccc(Cl)cc1	815965022	ZZOAKBGQBRKBAC-AWEZNQCLSA-N	425.732	1.374	50	20	IDGD	
COc1ccc([C@@]2(C)NC(=O)N(CC(=O)NN=c3sc4ccccc4n3C)C2=O)cc1	855569664	NEGMHOSIMDCDER-OAQYLSRUSA-N	439.497	1.648	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)CNS(=O)(=O)c2cccc(C(F)(F)F)c2)cc1	913431464	MLCMPZTWTVKGQI-UHFFFAOYSA-N	444.435	1.552	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNS(=O)(=O)c1cccc([N+](=O)[O-])c1C	914612241	ZENSOQIJUBQHCX-UHFFFAOYSA-N	441.491	1.128	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc2nc(O)cc(C(=O)NNC(=O)C3CCCC3)c2c1	914845056	KPFZXFUADHUKAO-UHFFFAOYSA-N	434.518	1.922	50	20	IDGD	
O=C(COC(=O)COc1ccccc1C(F)(F)F)NNC(=O)c1ccc([N+](=O)[O-])cc1	914981051	QPAMMPAUUIOKKY-UHFFFAOYSA-N	441.318	1.997	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)c1cc(S(=O)(=O)N(C)C)c[nH]1	915062049	VVIBFEZCRUNXBB-ZDUSSCGKSA-N	430.486	1.647	50	20	IDGD	
Cc1cccc([C@H](CNC(=O)NNC(=O)COc2ccccc2C#N)N2CCOCC2)c1	916435831	OAUBGULFFXYDTI-FQEVSTJZSA-N	437.500	1.649	50	20	IDGD	
Cc1cc(C)nc(SCc2ccc(C(=O)NNC(=O)Cn3ccc([N+](=O)[O-])n3)cc2)n1	916728352	CEDMOJAAACYOMN-UHFFFAOYSA-N	441.473	1.952	50	20	IDGD	
NS(=O)(=O)c1ccc(CCC(=O)NNC(=O)c2ccc(COc3ccccc3)o2)cc1	916831066	ANFMIJGJHJTDJR-UHFFFAOYSA-N	443.481	1.900	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)NCc2ccc(CS(C)(=O)=O)cc2)cc1	918101495	FAWGQRFUMYVKFG-OAHLLOKOSA-N	449.529	1.928	50	20	IDGD	
CCCCS(=O)(=O)N1CCC[C@@H]1C(=O)NNC(=O)c1ccc(OCC)c(OC)c1	918690306	WQGORIVZWNHAQU-OAHLLOKOSA-N	427.523	1.449	50	20	IDGD	
COc1ccc(OC)c(CCNC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c1	919790491	QOTZTVRAIYKNPR-UHFFFAOYSA-N	425.445	1.137	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NCc3ccc(F)c(F)c3)nc2)CC1	920343672	AFMVHRUJBGQBPY-UHFFFAOYSA-N	440.476	1.122	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)Nc1ccc(CN2C(=O)CNC2=O)cc1	920931464	UGUWGBDNPCENMK-UHFFFAOYSA-N	441.444	1.369	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@H]2CCCCN2Cc2cccnc2)c2ccccc2c1=O	1318393520	CZNXWQNSRLERAZ-LJQANCHMSA-N	434.500	1.627	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)N1CCC[C@H](C=NNC(=O)c2n[nH]c3c2CCCC3)C1	1321237553	XATGMSDOWGLLHZ-CQSZACIVSA-N	432.525	1.767	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCc2cccc(CN3CCC[C@H](C(N)=O)C3)c2)cc1	1321635314	WFNQQLAGOYNPHX-IBGZPJMESA-N	439.516	1.537	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2cnn(Cc3cccnc3)c2)c1	1323831496	YMCAGZHXIWYYOG-UHFFFAOYSA-N	443.489	1.043	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2ccc(C(=O)NNc3nncc(N)c3Cl)cc2)C[C@@H](C)O1	1324009519	RWCZZCKQRLHYAE-PHIMTYICSA-N	440.913	1.267	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCCC[C@@H]2c2nnc([C@H]3CCCO3)o2)n1	1346265150	UTVMNWRYPYITEI-ZIAGYGMSSA-N	434.522	1.603	50	20	IDGD	
O=C(c1c(Cl)ccc2c1OCO2)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1777798954	ZTZUJMQGFOAGQS-KZULUSFZSA-N	431.272	1.112	50	20	IDGD	
Cc1cc(C)cc(C(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1	1779032457	KOBPIFHFAHNRDJ-QHCPKHFHSA-N	437.500	1.059	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)N2C[C@@H]3C[C@H]3C2)C1	1779262886	JOVYVBJCRISDHU-JNPGCMDYSA-N	442.398	1.624	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccccc1-n1nccn1)CCO2	1779298788	JVUKXPGMKFSXKI-OAQYLSRUSA-N	443.580	1.562	50	20	IDGD	
CCOC(=O)c1cc(C(=O)N2CC[C@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)ccn1	1780322452	WGOAIBANJVEDOE-NRFANRHFSA-N	449.580	1.553	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)cc1OC	1780655745	LCBLVWIQSIDFFN-YJBOKZPZSA-N	445.285	1.838	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@]2(C1)CN(C(=O)C1(NC(=O)OC(C)(C)C)CC1)CCO2	1781225709	OOGHMKWBVOJGFF-IFXJQAMLSA-N	429.945	1.891	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)c3nc4ccccn4n3)CCO2)C1	1781227454	MBZZRTXKTMXFFG-ROUUACIJSA-N	426.304	1.409	50	20	IDGD	
Cc1cccnc1CCC(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781326343	NNFYIVYXGYQWJR-WMZOPIPTSA-N	428.302	1.843	50	20	IDGD	
O=C(c1cc2ccccn2n1)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781329653	IGRJAOBXINKLOG-YOEHRIQHSA-N	425.258	1.468	50	20	IDGD	
O=C(c1ccc2nonc2c1)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781330075	PSVZYZIASOVPOK-CJNGLKHVSA-N	427.230	1.357	50	20	IDGD	
Cc1nccn1CC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCBr)C2	1781553823	XKXQKCWWKPMPOQ-CRAIPNDOSA-N	427.343	1.490	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)n(C)n1)C2	1781901743	VAVMWTWEKAGTNY-WPKBUWHJSA-N	443.342	1.427	50	20	IDGD	
C/C(=C/C(=O)N1CCO[C@]2(CCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1)C(=O)O	1782867528	JTEZVAUZYKIQOL-NOHVTVLTSA-N	445.422	1.733	50	20	IDGD	
CC(C)N1CCC(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](C)Br)C3)C2)CC1	1783530136	SLWWXLIAIYQYTG-BEFAXECRSA-N	430.387	1.720	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3[nH]cnc3-c3cccnc3)CCO2)C1	1783535615	AOPPZRDFICWNQJ-ORAYPTAESA-N	448.321	1.699	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CC3CCOCC3)C[C@@H]21	1783967700	JOKLCQYUTWHOLN-HJWJTTGWSA-N	431.371	1.814	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](O)c3ccccc3Cl)C2)C1	1784251680	OQBZVURQUGTNPF-PNPHSEOMSA-N	445.741	1.987	50	20	IDGD	
O=C([C@H]1CCc2nc[nH]c2C1)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1784351705	NARYTIJZIJHXBG-PZSREKOKSA-N	429.290	1.035	50	20	IDGD	
CC(=O)c1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)CBr)C[C@@H]32)n[nH]1	1785838493	STLAKZIWKWXAML-SDPXSBNPSA-N	441.326	1.237	50	20	IDGD	
Nc1nc2cc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)[C@@H](O)CCl)C[C@@H]43)ccc2s1	1786908516	JGMKEIAYBVJOFD-JURCDPSOSA-N	438.937	1.072	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(C)o3)C[C@@H]21	1787506564	HCMRECUZGKIRFH-LVWMUPNFSA-N	441.488	1.315	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)c3cc[n+]([O-])cc3)CCC2)cc1)c1ccc(B(O)O)cc1	1788142193	JEYYKOLGMFWPKY-UHFFFAOYSA-N	431.257	1.061	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3Cc4ccccc4CN3)C[C@@H]21	1788765313	ZPQXKRCCCSOGBU-BURNTYAHSA-N	445.636	1.532	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3nccc(OC)c3OC)[C@H]2C1	1789412249	IQHICRBKLOCPQC-YXWQFLTLSA-N	425.913	1.710	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(F)(F)C(F)(F)C(=O)O)C[C@@H]21	1789858637	HCVTXIKXWBJBND-NAKRPEOUSA-N	432.798	1.339	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)c1cccc2ccnn12	1790344561	YWUSXPXCDNZLFW-MZGVZZPPSA-N	439.285	1.618	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc(F)c(F)c3)C[C@@H]21	1791251449	HRJJOWSOZRSRSG-XSWJXKHESA-N	430.879	1.741	50	20	IDGD	
CC(C)(C)OC(=O)N1CC=C(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](O)CCl)CC1	1793117782	DPYVACWAKOUDNT-YYIAUSFCSA-N	441.956	1.792	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCBr	1795117255	VNIHKPJEVOYJGF-YWVIFJGQSA-N	448.358	1.276	50	20	IDGD	
COc1cccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)Br)C3)c1	1795240710	AIHPZFCUTPYSRA-LJGDNWOOSA-N	425.323	1.611	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C[C@@H](N)c1cccnc1	1795677748	DLDVCZGKVRPIDA-AEWXESQOSA-N	439.354	1.092	50	20	IDGD	
Cc1c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)ccc(F)c1F	1796190592	ONPLJMWLHKVYPJ-BJWYYQGGSA-N	428.244	1.519	50	20	IDGD	
O=C(Cc1cc(F)ccc1F)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1	1796192742	PZBHGLHUBPKTLL-REPLKXPHSA-N	428.244	1.139	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc2cc[nH]c2c1	1797335027	IXEBWNGZQQSXQV-BJWYYQGGSA-N	432.484	1.732	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1CN(Cc2ccccc2)CCO1)[C@@H](O)CCl	1797853204	CSTAYJGXZDDHLK-LJDSDSDDSA-N	435.952	1.125	50	20	IDGD	
CCOc1cnc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@](C)(Cl)CCl)cn1	1799277745	XATHINVCGJHXBC-ABXQLRGKSA-N	431.320	1.315	50	20	IDGD	
C=CCC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2	1799321514	CYJQJDMUNLGFSR-QRJUGERDSA-N	447.935	1.970	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1n[nH]c2c(Cl)cccc12	1799902464	NOZCQPKKTLJNRY-BAESOJJISA-N	441.315	1.673	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1noc(C(C)C)n1)C2	1800639968	DJDORUWSDZSKHZ-ZWUHOBOKSA-N	443.342	1.499	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(Cl)cc(Cl)n1)C2	1800978852	MBTLZQYPQCTICE-KVQFHVITSA-N	436.723	1.845	50	20	IDGD	
Cc1cc(C)n2ccc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)c3ccc(B(O)O)cc3)C4)c2n1	1801193066	XKBMMMWICDYITP-ACDBMABISA-N	446.316	1.197	50	20	IDGD	
COc1ccc(CC(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)cc1O	1803136901	GCTMTHXYTYEHJQ-BLIXFSHQSA-N	447.919	1.644	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](C)c1ccccn1	1803147568	SYYGAKLNHLOZPI-FPKOZTFZSA-N	436.516	1.957	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CCC(=O)NN(C)C)C3)c1	1803727208	CIQBFLAYYFDPNN-REPLKXPHSA-N	429.521	1.270	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)N1CCC2(CCCN(C(=O)[C@@H](C)CBr)C2)CC1	1805384566	OZRTWXLIHOKNRK-KBPBESRZSA-N	431.375	1.696	50	20	IDGD	
COc1nccnc1C(=O)N1CC[C@@H](CNC(=O)CCBr)[C@@H]1c1cccnc1	1806339452	LZLIUMUPUBZPEO-YOEHRIQHSA-N	448.321	1.985	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)Cc2ccsc2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1	1807370369	CBOGJXCINCGFCB-DENIHFKCSA-N	449.341	1.385	50	20	IDGD	
Cc1c(C(=O)N2CC[C@H](CNC(=O)[C@H](F)Cl)[C@H]2c2cccnc2)cn2[nH]cnc(=O)c12	1808315451	NNJDWOLIWMALSE-XYPHTWIQSA-N	446.870	1.580	50	20	IDGD	
O=C(/C=C/C1CCCC1)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1808482437	WWQZIUVRWGLFTC-VXSCLSAESA-N	447.344	1.827	50	20	IDGD	
COC(=O)c1ccc(C(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)cn1	1808589327	NQVWVJILCACXJX-BMGDILEWSA-N	446.891	1.183	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cc(O)n[nH]2)[C@@H]1c1cccnc1)[C@H](F)Br	1808662412	ZZDSRWUAGSGFHJ-GDLCADMTSA-N	426.246	1.520	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)c1cn2ncccc2n1	1809349063	CTYPBIWCWWFUPR-LESCRADOSA-N	428.880	1.044	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)c1ccc2nncn2c1	1809911954	WIRZOBHNMIBFNJ-QILLFSRXSA-N	428.880	1.044	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC2(CCCN(C(=O)c3cc(=O)n4[nH]cnc4n3)C2)CC1	1809963886	ZQDCGWHIYXZIQF-AWEZNQCLSA-N	434.928	1.670	50	20	IDGD	
CC(C)(C)CC(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1	1810298397	IBYUFZJAJWEQCR-JXFKEZNVSA-N	438.532	1.836	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)N1CC[C@H](CNC(=O)[C@@H](Cl)COC)[C@@H]1c1cccnc1	1813030660	FFQRJRVTNLYAPA-SIXLDLHFSA-N	439.944	1.049	50	20	IDGD	
Cc1onc(C(=O)N2CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)c1C	1813067803	DSHQQDJASNVPNM-UTKZUKDTSA-N	442.520	1.379	50	20	IDGD	
Cc1ncccc1C(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1813070306	HBFGLRNWROGYTI-PGRDOPGGSA-N	438.532	1.478	50	20	IDGD	
COC(=O)c1ccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)[C@H](O)CCl)n[nH]2)cn1	1814870890	DTOFZZNHXVTBLK-HUUCEWRRSA-N	435.868	1.497	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2nn[nH]c2C(F)(F)F)[nH]n1)[C@H](O)CCl	1814873479	OMKKEOKZHAXAIL-DTWKUNHWSA-N	435.794	1.452	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)C2=NN(C)C(=O)CC2)n[nH]1	1815626268	XMSXLVGNZCHTCM-ZWNOBZJWSA-N	439.314	1.793	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)C[C@H]2NC(=O)NC2=O)n[nH]1	1815771487	SIKFIVZXTPRNPN-AGKHESDQSA-N	445.307	1.236	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](F)Br)CC2)c1cnc(O)nc1O	1817087675	VOVASPFVCXUKIM-CDUCUWFYSA-N	446.258	1.261	50	20	IDGD	
CNC(=S)NCCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](F)Br)[nH]n1	1819408038	VZIPLHPHQNYQBC-GXFFZTMASA-N	449.350	1.576	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](C)Br)CC2	1819694330	CUNDZNABQJBDIE-AEJSXWLSSA-N	446.371	1.546	50	20	IDGD	
C[Si](C)(C)OCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CN1CCOCC1)CC2	1820163134	ZJNXMOCZKBZINS-ZDUSSCGKSA-N	426.615	1.239	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)c3cccc(F)n3)sc2C1	1820449450	HFSLVFMLDYLXSM-NSHDSACASA-N	434.497	1.276	50	20	IDGD	
C[C@H](Br)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN2CCCC2=O)[nH]n1	1822184210	QEQDQPHQVYYXOQ-AAEUAGOBSA-N	426.315	1.808	50	20	IDGD	
C[C@H](Br)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2CCCS2(=O)=O)[nH]n1	1822188445	JOZKJODDYHCERF-DRZSPHRISA-N	447.355	1.762	50	20	IDGD	
C[C@H](C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1)n1cncn1	1823014333	UGWXXKPIFRXNQL-VHSKPIJISA-N	431.291	1.598	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CSc1ncccn1)CC2	1825998931	KFOJWYMXWXCCQV-WDEREUQCSA-N	441.966	1.891	50	20	IDGD	
CN1CCN(CC(=O)N2CCCC[C@H]2C2CCN(C(=O)[C@H](F)Br)CC2)CC1	1828442346	JUFGQIPPYVUUQZ-WMZOPIPTSA-N	447.393	1.544	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCCC[C@H]1C1CCN(C(=O)C[C@H]2NC(=O)NC2=O)CC1	1829097214	DDUHCHZROOMYLC-CVEARBPZSA-N	438.601	1.056	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CCC[C@H]3C)C2)C1	1830539424	GQDSOJUZEBQXGU-YKTARERQSA-N	431.371	1.910	50	20	IDGD	
C#CC(=O)N1CCCC[C@H]1C1CCN(C(=O)CN(C)NC(=O)NCc2ccccc2)CC1	1831325040	OGBKHJZJXQPTPR-NRFANRHFSA-N	439.560	1.586	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3sc(N)nc3C)C2)C1	1831647196	SFYYJWNZWGJFKQ-FZKQIMNGSA-N	430.958	1.511	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3noc(C(C)C)n3)CCO2)C1	1832792193	XNPYNUQQGCEOPW-KUHUBIRLSA-N	428.917	1.209	50	20	IDGD	
CC(C)[C@H](O)C(=O)N1CCC(N2CCC(NC(=O)[C@H](C)CBr)CC2)CC1	1833265459	XELASBUMDVPLPJ-PBHICJAKSA-N	432.403	1.606	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)CCc3ccc(F)cc3)CC2)CC1)[C@H](O)CCl	1833313011	QEHQXVQLRKAOKW-HXUWFJFHSA-N	439.959	1.930	50	20	IDGD	
CN(C)c1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)nc1	1833644308	NMIOWCOHSHZILT-NRFANRHFSA-N	438.956	1.483	50	20	IDGD	
COc1ccc(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)cc1	1834849341	BFOPJCCBIQAJON-FQEVSTJZSA-N	445.343	1.888	50	20	IDGD	
O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)Cc1ccc(F)cn1)CCO2	1836031531	ZWBKLJAVHDMFSO-SFHVURJKSA-N	444.301	1.005	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3noc4c3CCCC4)CCO2)C1	1836429529	HJERBPHQKLLMKZ-YWZLYKJASA-N	425.913	1.641	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)Nc1cnccn1)CCO2	1837477958	TZEHTRGTRSZGMI-FTRWYGJKSA-N	439.944	1.141	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3ccc(=O)oc3)CC2)CC1	1837589893	IZDRENVUJKQQHM-KRWDZBQOSA-N	426.897	1.506	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(-c4cccnc4)[nH]n3)C2)C1	1839145358	FISAZFRAEKNPQB-HRAATJIYSA-N	447.923	1.559	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)C3CCC(O)CC3)C2)C1	1839155297	QIAUABPQNDLKRG-BURPLHJFSA-N	437.364	1.230	50	20	IDGD	
CC1=CC[C@H](C(=O)N2CCOC[C@]3(CN(C(=O)[C@@H](F)Br)CCO3)C2)CC1	1839201082	RACQMECEXGGAHR-HDMKZQKVSA-N	433.318	1.880	50	20	IDGD	
CC(C)Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)cc1	1839404011	ZTMHJAPUZXTDHG-SIKLNZKXSA-N	438.952	1.555	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(F)(F)c1ccco1)CCO2	1839691932	UPLFVQHYBXPLEA-DYVFJYSZSA-N	436.839	1.082	50	20	IDGD	
CCC(=O)C(=O)N1CCOC[C@]2(C1)CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)CCO2	1839744204	UQPCLLYBYLXEMC-KYIYGJGQSA-N	447.438	1.307	50	20	IDGD	
COc1c(Cl)cccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1840739590	OABSBVUAPMWTLL-YJBOKZPZSA-N	435.279	1.953	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCCC12CN(C(=O)c1ccnnc1O)C2	1841924727	VOBHXBGBBIOCLT-ZDUSSCGKSA-N	439.900	1.131	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC2(CCCN2C(=O)c2ccc(O)cn2)C1	1842572155	RHNKUZZDHXKOQQ-HNNXBMFYSA-N	438.912	1.736	50	20	IDGD	
Cc1ccc(S(=O)(=O)CC(=O)N2CC3(CCCN3C(=O)CCBr)C2)cc1	1842637685	UHOBXEJWGLVROR-UHFFFAOYSA-N	443.363	1.757	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC12CN(C(=O)[C@H]1CC[C@H](C(F)(F)F)CC1)C2	1843012629	IXJXPHVVSOQFLD-KOMQPUFPSA-N	438.255	1.552	50	20	IDGD	
O=C(c1c[nH]c(-c2ccc(F)cc2)c1)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843013403	FSKLAUXXUAIMSD-UHFFFAOYSA-N	447.275	1.631	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)[C@@H]2C[C@H]2c2ccc(Cl)cc2)C1	1843873126	OSQSIWKCCNCXIM-VQTJNVASSA-N	438.720	1.641	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC2(CCCN2C(=O)c2cccc3c2NC(=O)C3=O)C1	1844127372	BGTSDTJMMJGHSQ-ZDUSSCGKSA-N	434.290	1.812	50	20	IDGD	
COc1cc(C)c(C(=O)N2CCCC23CN(C(=O)CCC(=O)NN(C)C)C3)cc1OC	1845454021	AGZHXCFOFNTZNU-UHFFFAOYSA-N	432.521	1.202	50	20	IDGD	
COCCOCC(=O)N1CC2(CCCN2C(=O)[C@H](Br)Cc2ccccc2)C1	1845940787	JMJHVBCNXSZPMJ-QGZVFWFLSA-N	439.350	1.859	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)c1ccc3c(c1)CCCC3=O)C2	1846384781	HPKSUUNWEKHACO-UHFFFAOYSA-N	426.517	1.396	50	20	IDGD	
O=C(c1nc2ccc(C(F)(F)F)cn2n1)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl	1847560538	VLQYCWXWKJKDOW-SRVKXCTJSA-N	431.802	1.163	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)c1ccc(Cl)c(S(=O)(=O)N(C)C)c1	15879667	MXKZXPAXBYJJLF-UHFFFAOYSA-N	441.893	1.439	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)[C@H]2CN(C(C)=O)c3ccccc3O2)cc1	18071423	USAFVYCJXRDNIL-VBKZILBWSA-N	427.457	1.814	50	20	IDGD	
CON(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(Br)c[nH]2)c1	24123721	ZMRGWFKGESQMPK-UHFFFAOYSA-N	431.268	1.034	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c2c(C)nn(C)c2n1	25433308	BANNNSHEXCWWBA-UHFFFAOYSA-N	435.532	1.558	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2ccc3ccccc3n2)cc1S(=O)(=O)NC1CC1	27687723	VFCXWYGPIYEZQT-UHFFFAOYSA-N	440.481	1.759	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)CCNC(=O)c2ccc(C)cc2O)c2ccccc2c1=O	726379177	GDYOBELFOFFFKC-UHFFFAOYSA-N	437.456	1.012	50	20	IDGD	
CN(C)N(C(=O)c1cc(-c2ccc(Br)cc2)[nH]n1)[C@H]1CCS(=O)(=O)C1	728177942	NVFIGWGMVCSLCZ-ZDUSSCGKSA-N	427.324	1.945	50	20	IDGD	
COc1cc(N2C[C@@H](C(=O)NNC(=O)c3cccc(C#N)c3)CC2=O)cc(OC)c1OC	728825332	VKKCENQDVHVYDY-HNNXBMFYSA-N	438.440	1.398	50	20	IDGD	
CCOC(=O)[C@H]1CCCN(C(=O)CN(C)C(=O)NNC(=O)c2ccc3ccccc3c2)C1	728946978	NYOQXCVMGRGBRE-IBGZPJMESA-N	440.500	1.928	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)N[C@@H]1CCCN(Cc2ccccc2)C1	728948153	GBFRCOYLZGGCSK-HXUWFJFHSA-N	437.548	1.688	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)Cn2ccc3ccccc32)c1	729450552	BFXWSRONIWMCJO-UHFFFAOYSA-N	432.477	1.928	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)NCCC(=O)NNC(=O)Cn2ccc3ccccc32)cc1	729540685	LFXCPSBOVUOTPA-UHFFFAOYSA-N	442.497	1.360	50	20	IDGD	
Cc1ccc2nc(-c3cccnc3)cc(C(=O)NNC(=O)N[C@@H]3CCS(=O)(=O)C3)c2c1	730533549	HUDKNWLNCVNRGG-OAHLLOKOSA-N	439.497	1.736	50	20	IDGD	
COCCOc1cn(-c2ccccc2)nc1C(=O)NNC(=O)COc1ccccc1O	730780690	RPURDMRGUKNAJZ-UHFFFAOYSA-N	426.429	1.443	50	20	IDGD	
CC(=NNC(=O)c1ccnc(N(C)C)c1)c1ccc(S(=O)(=O)NCCC(=O)O)cc1	731562256	SMTOZHDZYVYVOO-UHFFFAOYSA-N	433.490	1.055	50	20	IDGD	
O=C(CN1CCC(=O)NC1=O)NNC(=O)c1cn(-c2ccccc2)nc1-c1ccccc1	731867215	ZOLOPRKLARTKAF-UHFFFAOYSA-N	432.440	1.242	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Cc2c(C)nc3cc(O)nn3c2C)cc1Br	732033793	OADHDAJKADQKCL-UHFFFAOYSA-N	448.277	1.827	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCC[C@H]1C(=O)N1CCCC1)C1CCN(c2ncccn2)CC1	732761937	QMOLWYXRDQCJLU-QZTJIDSGSA-N	428.537	1.269	50	20	IDGD	
O=C(NNc1ccc(Cl)nn1)N[C@H]1CCCN(c2cc(N3CCOCC3)ncn2)C1	732913896	HCHATGCKTWLBNG-ZDUSSCGKSA-N	433.904	1.052	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)c1cc(=O)c2cc(Br)ccc2[nH]1	732949227	GYPHEDJONBFUGA-QGZVFWFLSA-N	444.241	1.892	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)Cn1c(S)nnc1-c1cccs1	734241901	MIYWNPDNOBFMNV-UHFFFAOYSA-N	441.539	1.150	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)CNc2ccccc2[N+](=O)[O-])CC1	734824582	DTVMPTZILLTBDB-UHFFFAOYSA-N	436.469	1.737	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)c2ccc(COc3ccc(Cl)cc3)cc2)c(=O)n(C)c1=O	734990150	ADFMFDXMCRADFP-UHFFFAOYSA-N	442.859	1.391	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2csc(C(C)(C)C)n2)CC1	735116753	DOIHAUDJDMUVRE-UHFFFAOYSA-N	438.579	1.529	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)N[C@@H](C)C(=O)N2CCCC[C@@H]2C)nc1	737047781	OFZAHANHXBEGRV-GJZGRUSLSA-N	440.570	1.528	50	20	IDGD	
C[C@H](CCC(C)(C)C)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	737062005	XSOMDMUPZUWHHE-OAHLLOKOSA-N	440.566	1.866	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCC(C)CC2)s1	740853212	YNLQQHJPABSWBC-UHFFFAOYSA-N	444.579	1.235	50	20	IDGD	
Cc1nn(C)c2sc(C(=O)N[C@@H](C)C(=O)NNC(=O)c3cccc(N(C)C)c3)cc12	742037397	SNVIGAFENRNZTJ-LBPRGKRZSA-N	428.518	1.589	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)[C@@H](C)n2nnc(-c3ccccc3)n2)c2ccccc2c1=O	742474060	AKWVKSHBTAXCNC-CQSZACIVSA-N	446.471	1.482	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C[C@H](C)/N=C1/NS(=O)(=O)c2ccccc21)c1ccccc1	742662220	ZEVTWYOFUVSSQW-HOCLYGCPSA-N	428.514	1.845	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)N[C@@H](C)COCC(F)(F)F)nc1	743340753	AUHFPKPOOSFRGG-NSHDSACASA-N	427.449	1.706	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)N[C@H]1CC(=O)N(CCOc2ccccc2)C1	743609240	ROPSMYOZPVBXMD-SFHVURJKSA-N	448.483	1.496	50	20	IDGD	
O=C(Cn1c(=O)nc(O)c2ccccc21)NNC(=O)c1cc(Br)ccc1O	743731816	ZYCLLJBEDFSRFQ-UHFFFAOYSA-N	433.218	1.031	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)CNC(=O)Cc2cccc3ccccc23)cc1	744504110	AGNUAQCREHDMOP-UHFFFAOYSA-N	444.447	1.375	50	20	IDGD	
COc1ccc(C2(C(=O)OCC(=O)NNC(=O)c3ccc(C#N)cc3)CCOCC2)cc1	744861015	GBPUWAKQXWOEAI-UHFFFAOYSA-N	437.452	1.619	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)N[C@H]2C[C@@H](C)N(c3cnn(C)c3)C2=O)cc1OC	745919723	WQYMHWQJLPDSDM-CJNGLKHVSA-N	444.492	1.356	50	20	IDGD	
O=C(COC(=O)CC[C@@H]1Cc2ccccc2NC1=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	746926277	RGAFBQZPWBIDCL-OAHLLOKOSA-N	440.412	1.490	50	20	IDGD	
O=C(NCCCN1C(=O)NC2(CCCC2)C1=O)NNC(=O)c1ccc(Cl)cc1F	747490915	OBMFAPQWKRWFSC-UHFFFAOYSA-N	425.848	1.678	50	20	IDGD	
O=C(NNC(=O)C1CCN(C(=O)c2ccc(C(F)(F)F)cc2)CC1)C(=O)N1CCCC1	748247114	KEWWZHPLFZCBOH-UHFFFAOYSA-N	440.422	1.327	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)N[C@H]2CC(=O)N(C(C)(C)C)C2)c1	750659197	BRLJNOICWSTPAP-JTQLQIEISA-N	427.299	1.801	50	20	IDGD	
O=C(Cc1csc(-c2cccc(C(F)(F)F)c2)n1)NNC(=O)[C@@H]1CCS(=O)(=O)C1	750716071	MNQLSFYOFBBLTE-LLVKDONJSA-N	447.460	1.954	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1	751204229	WOMKWLRZPFWIMH-IBGZPJMESA-N	438.406	1.611	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNS(=O)(=O)c2cc(C(=O)O)ccc2O)c1	751213128	POWVNMNHDZJUDX-UHFFFAOYSA-N	445.247	1.485	50	20	IDGD	
CC(C)C[C@H](C)NC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	752688957	LIWLGHJBOYHMDQ-INIZCTEOSA-N	440.566	1.405	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCc2ccc([S@@](C)=O)cc2)c2ccccc2c1=O	753036083	AEVTZMVMTYQSKQ-SSEXGKCCSA-N	427.486	1.298	50	20	IDGD	
COC(=O)c1cc2c(cc1NC(=O)C(=O)NNC(=O)CSc1ccc(C)cc1)OCO2	753841415	RPNFWBAMAXFKCV-UHFFFAOYSA-N	445.453	1.389	50	20	IDGD	
O=C(COC(=O)c1cc2cc(F)ccc2oc1=O)NNC(=O)c1cccc([N+](=O)[O-])c1	754593571	GUNXTONFCFEISR-UHFFFAOYSA-N	429.316	1.458	50	20	IDGD	
Cn1c(C(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)ccc1[N+](=O)[O-]	754787103	AVRYBKXMGWCDCV-UHFFFAOYSA-N	446.423	1.766	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(NC(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)c1	755368440	WXMXLOFKZNJZLY-UHFFFAOYSA-N	443.526	1.395	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCc2cn(-c3ccccc3)nn2)nc1	756071385	KPJHULWEQCGJOY-UHFFFAOYSA-N	444.521	1.519	50	20	IDGD	
O=C(NNC(=O)c1ccccc1F)Nc1ccc(N2CCN(C(=O)C3CC3)CC2)nc1	756294279	GHKHGVRZZOHCKG-UHFFFAOYSA-N	426.452	1.746	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Nc2cc(-n3cnnn3)ccc2F)cc(OC)c1OC	756335833	MXAWVDVEENLDET-UHFFFAOYSA-N	431.384	1.294	50	20	IDGD	
Cc1cn(-c2ccccc2)nc1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	756462709	ZGUHSJIVSMDWIF-UHFFFAOYSA-N	442.501	1.898	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)[C@](C)(O)CN2Cc3ccccc3C2=O)cc1OC	756796129	FBFXVQSCYNQMIL-HSZRJFAPSA-N	441.484	1.652	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2ccc(C(F)(F)F)cc2C#N)n1	758121719	XQNYDGLSZGRSGT-UHFFFAOYSA-N	426.376	1.889	50	20	IDGD	
COc1cc(OC)cc(N2CCCN(CC(=O)NNC(=O)c3ccc(C#N)cc3)CC2)c1	758741066	FARFSGLYWUZSIQ-UHFFFAOYSA-N	437.500	1.549	50	20	IDGD	
C[C@@H](CC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)NS(=O)(=O)c1cccnc1Cl	760210974	LGTKBKBIVCUJDK-JTQLQIEISA-N	441.853	1.161	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cccc(OCC(F)F)n2)c1	760222726	AZSOZRUULWHZIP-UHFFFAOYSA-N	428.417	1.051	50	20	IDGD	
CCN(CC(=O)NNC(=O)c1ccc(OC)c(OC)c1)Cc1nc(O)c2ccccc2n1	762527226	SWSWHLWQQASHMG-UHFFFAOYSA-N	439.472	1.636	50	20	IDGD	
O=C(Cn1cc(Br)c(=O)c([N+](=O)[O-])c1)NNC(=O)c1ccccc1Cl	763274720	JLTAWUILNUYMNG-UHFFFAOYSA-N	429.614	1.634	50	20	IDGD	
O=C(NNC(=O)c1ccccc1O)C(=O)Nc1cc(Cl)ccc1N1CCSCC1	763527124	NDSGPIITPJSKMS-UHFFFAOYSA-N	434.905	1.999	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)Nc1nc(-c2ccccc2F)cs1	763570357	DRQMGQJPBRYHKL-MRXNPFEDSA-N	442.428	1.875	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)COc2cc(C)cc(C)c2)cc1F	763646030	ALFVLGXNBMAQHU-UHFFFAOYSA-N	433.436	1.633	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)C(=O)Nc2cccc(C(C)C)c2)cc1	763738694	WNJVMLAOWVILSJ-UHFFFAOYSA-N	446.529	1.525	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)C(=O)Nc2cc(F)cc(F)c2)c2ccccc2c1=O	763801143	IARHIUFOVQWLHD-UHFFFAOYSA-N	443.410	1.875	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(Cl)c2-n2cccn2)cc1	763812877	WOPARSYYNZYKAZ-UHFFFAOYSA-N	427.848	1.999	50	20	IDGD	
COC(=O)c1cc(OC)ccc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1cccc(C)c1C	763850967	CGJXSMYNDLROSJ-CQSZACIVSA-N	443.456	1.652	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)C(=O)Nc1cnn(-c2ncccn2)c1	763852317	HTIKDCUYQUCMIE-AWEZNQCLSA-N	445.439	1.369	50	20	IDGD	
C#CCOc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(OCC)cc2)cc1	763861305	NPKNNMVUUXXUSP-OAHLLOKOSA-N	425.441	1.651	50	20	IDGD	
COc1c(F)cc(F)cc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccc(C(C)=O)cc1	763872976	QFSRZAADRAYBFC-NSHDSACASA-N	435.383	1.729	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(-c3nnco3)c2)cc1OC	763900150	BARDWGHUNARRGP-UHFFFAOYSA-N	425.401	1.544	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(C(=O)OC)ccc2F)cc1OC	763902930	RURYOYTYPOAHEJ-UHFFFAOYSA-N	433.392	1.419	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(Cn3cncn3)cc2)cc1OC	763904445	ZDOILCGVRNSAIW-UHFFFAOYSA-N	438.444	1.133	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ccc(OC(C)C)c(OC)c2)ccc1F	763921294	LROHJTZEGFKOPF-UHFFFAOYSA-N	447.419	1.808	50	20	IDGD	
Cc1cc(C)n(-c2ccc(NC(=O)C(=O)NNC(=O)c3ccc4c(c3)OCCO4)cn2)n1	764003296	BCRAKTSZPPFIQI-UHFFFAOYSA-N	436.428	1.055	50	20	IDGD	
CNC(=O)c1ccc(OC)c(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)on2)c1	764016145	HVFFJVOXOYIOLF-UHFFFAOYSA-N	437.412	1.110	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc([S@](C)=O)c(F)c2)o1	764139124	OQARHNVWEATKKQ-PMERELPUSA-N	438.481	1.398	50	20	IDGD	
CCCN1C(=O)CCc2cc(NC(=O)C(=O)NNC(=O)[C@@H]3Cc4ccccc4O3)ccc21	764167008	HCIWPYPJKRHJMZ-IBGZPJMESA-N	436.468	1.465	50	20	IDGD	
Cc1cn(-c2ccc(C#N)cn2)nc1NC(=O)C(=O)NNC(=O)CCCc1ccccc1	764227891	SLQJZLIPYIYIAN-UHFFFAOYSA-N	431.456	1.556	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)C(=O)Nc1cccc(OC(F)F)c1	764260862	SDPOXNJFULEMBM-UHFFFAOYSA-N	434.403	1.081	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2cccs2)[nH]n1)C(=O)Nc1ccnn1Cc1ccccc1	764383109	WDFUHEKSOJRABU-UHFFFAOYSA-N	435.469	1.783	50	20	IDGD	
CC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)cc1C	764389015	WDSXWAWOBNRCSI-UHFFFAOYSA-N	438.419	1.882	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1ccc2c(c1)NC(=O)CC2	764398945	YVZNNXRWMLAXPK-UHFFFAOYSA-N	428.470	1.458	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2c(-c3ccncc3)noc2C)cc1	764533226	JXMHBBUTAQDSEI-UHFFFAOYSA-N	443.485	1.435	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)COc3ccc(F)cc3F)CC2)cc1	765749320	WWVKRUBTCADTSW-UHFFFAOYSA-N	432.471	1.617	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)C(C)(C)NC(=O)OC(C)(C)C)CC2)cc1	766642493	ROKIEISKSNTKNQ-UHFFFAOYSA-N	447.580	1.563	50	20	IDGD	
Cc1nn(-c2ccc(S(N)(=O)=O)cc2)c(C)c1CCC(=O)NNC(=O)OC(C)(C)C	766950804	BEPWBPLOSBUBKC-UHFFFAOYSA-N	437.522	1.625	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)N[C@H]2CCc3n[nH]cc3C2)c2ccccc2c1=O	767109435	SWELRPIABYENBP-HNNXBMFYSA-N	437.504	1.811	50	20	IDGD	
Cc1cc(F)ccc1-n1cc(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)nn1	767192078	ODOPUFDCJXYMJB-UHFFFAOYSA-N	431.453	1.083	50	20	IDGD	
O=C(NNC(=O)N1CCO[C@@H](c2cccc(Cl)c2)C1)c1ccc(-n2cnnn2)cc1	767297113	OCOHEYHWOCVTIR-QGZVFWFLSA-N	427.852	1.744	50	20	IDGD	
CC(C)(Oc1ccc(C#N)cc1)C(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	767650635	JCAAHPMBEWIIID-UHFFFAOYSA-N	426.385	1.628	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)c2nccc3c(S(N)(=O)=O)cccc23)cc1OC	768459638	FFIDGISYYNCCSR-UHFFFAOYSA-N	444.469	1.364	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)C(C)C)c2)cc(OC)c1OC	769725791	FLMRZQIFHZNXQB-UHFFFAOYSA-N	436.486	1.969	50	20	IDGD	
CCOC(=O)NNC(=O)Nc1cc(S(=O)(=O)N2CCOCC2)ccc1N(CC)CC	769926035	UNJZSTMMQUZNGG-UHFFFAOYSA-N	443.526	1.336	50	20	IDGD	
COCCNC(=O)Cn1cc(NC(=O)NNc2ccc(F)cc2Br)cn1	770053437	TXMYJGYPYJYJCX-UHFFFAOYSA-N	429.250	1.696	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)NCc3ccc(N4CCOCC4)cc3)nc21	770357003	WBZSUXYEYZILAL-UHFFFAOYSA-N	440.508	1.950	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)NCCOc3ccc([N+](=O)[O-])cc3)nc21	770397234	VYSPUSONNOGSSX-UHFFFAOYSA-N	430.425	1.900	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNS(=O)(=O)c1c(Cl)nc2ccccn12	771607513	NHZIWYQKBOXMIM-UHFFFAOYSA-N	442.284	1.267	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)COc1ccc(I)cc1	771889771	DFNASTNBJRZAKK-LLVKDONJSA-N	448.257	1.795	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)CN1C(=O)N[C@@]2(C[C@@H](C)CC(C)(C)C2)C1=O	771971218	YFWDVPXYDUMRJQ-DGCWBMGLSA-N	438.525	1.248	50	20	IDGD	
Cc1cccc(N2C(=O)N[C@@H](CCC(=O)O[C@@H](C)C(=O)NNC(=O)CC(C)C)C2=O)c1	772095376	CFTIIZAPDLJJKT-HOCLYGCPSA-N	432.477	1.325	50	20	IDGD	
COc1cc(/C=C(/C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)c2ccccc2)ccc1O	772376423	UAEPAWGQFRIEGF-KTZOAPACSA-N	445.497	1.459	50	20	IDGD	
COc1ccc([C@@H](OC)[C@@H](C)NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1	772582978	QKVGKKUKAZMJMU-YJYMSZOUSA-N	439.472	1.662	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)c1ccc2c(c1)CCN2S(C)(=O)=O	772991953	YLTBSWYQBIBCAQ-GFCCVEGCSA-N	437.905	1.891	50	20	IDGD	
Cc1ccc(C)n1-c1ccc(C(=O)NNC(=O)NC[C@@H]2CC[C@@H](C(=O)N(C)C)O2)cc1	775460836	MJSUBTMCJDYWDL-OALUTQOASA-N	427.505	1.674	50	20	IDGD	
COc1ccccc1Cn1c(SCC(=O)NN(C)C(N)=O)nc2ccccc2c1=O	778418880	VBXPTQFUQJGQNG-UHFFFAOYSA-N	427.486	1.587	50	20	IDGD	
Cc1nn(C)c(C)c1S(=O)(=O)N[C@H](C)C(=O)NNc1ccccc1OC(F)(F)F	779208861	OCTPCCOUAZYGPE-SNVBAGLBSA-N	435.428	1.746	50	20	IDGD	
N#C[C@@H](c1ccc(F)cc1)N1CCN(CC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)CC1	780311579	HPCKLNKZCJNALO-IBGZPJMESA-N	440.435	1.377	50	20	IDGD	
COc1ccc(C(=O)OCC(=O)NNC(=O)Cc2nc(C)cs2)nc1Br	781753916	KILXKIKEQXGKDB-UHFFFAOYSA-N	443.279	1.165	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)cc1)C(=O)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1	782835570	AJFDJJLOXKVCMR-GOSISDBHSA-N	448.483	1.435	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2cc(Br)c(F)cc2Cl)CCS(=O)(=O)C1	783423809	ATTNCBWBKVAGND-CYBMUJFWSA-N	442.694	1.378	50	20	IDGD	
O=C(NNC(=O)[C@H]1CC=CC[C@H]1C(=O)N1CCOCC1)c1cccc(Br)c1	784429857	UUSCJNRVFGSVJY-JKSUJKDBSA-N	436.306	1.651	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNc2cccc(OC)n2)c(Br)cc1F	784845533	AWNOHWGJKWPCND-UHFFFAOYSA-N	441.213	1.860	50	20	IDGD	
CSc1nc2ccc(NC(=O)C(=O)NNC(=O)Cc3cn4ccccc4n3)cc2s1	785067120	HHDBDPFDNPBRTN-UHFFFAOYSA-N	440.510	1.995	50	20	IDGD	
CN(C)CCn1c(=O)oc2ccc(NC(=O)C(=O)NNc3ccc(C#N)c(Cl)c3)cc21	785095541	ZSDVBSXPQCZHBT-UHFFFAOYSA-N	442.863	1.763	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)c1C	785598003	MIMXMJINBDQVHO-UHFFFAOYSA-N	432.502	1.731	50	20	IDGD	
Cn1c(=NNC(=O)[C@@H](CC(N)=O)NC(=O)c2ccccc2Cl)sc2ccccc21	786015336	VDBBKZGNHCWEJO-CYBMUJFWSA-N	431.905	1.499	50	20	IDGD	
Cc1csc(C(=O)NNC(=O)CNC(=O)OC(C)(C)C)c1I	787245708	NKUIWGXFOBOKKP-UHFFFAOYSA-N	439.275	1.947	50	20	IDGD	
CCNC(=O)Nc1ccc(C)c(NC(=O)C(=O)NNC(=O)COc2ccc(C)cc2)c1	787541383	QILRLSHMXXFJAX-UHFFFAOYSA-N	427.461	1.610	50	20	IDGD	
CN1CCN(C(=O)NNC(=O)CCC[S@](=O)c2ccc(Br)cc2)CC1	788168879	GVEKTKITTDZXQX-VWLOTQADSA-N	431.356	1.325	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNc2ccccc2S(N)(=O)=O)c1	788230301	MDZGWRZSCXJMSP-UHFFFAOYSA-N	426.520	1.121	50	20	IDGD	
Cn1nc([C@H]2CCCO2)cc1NC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	788720940	SFCGPUMURUVLCW-LJQANCHMSA-N	441.536	1.637	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)CC(=O)N3C)o1	789733145	HEIDISUGTDENRE-UHFFFAOYSA-N	427.461	1.040	50	20	IDGD	
COc1cc(NNC(=O)[C@H]2CC(=O)N(c3cccc(S(N)(=O)=O)c3)C2)ccc1Cl	790180758	VKMQELIKLDKJIC-NSHDSACASA-N	438.893	1.492	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2cc([C@@H]3CCCOC3)nn2C)c2ccccc2c1=O	790544995	AVHBKYLSZAJPKW-CYBMUJFWSA-N	439.476	1.510	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)[C@@H]2CC(c3cccnc3)=NO2)CC1	790651485	QBJRGFZDGNJUCN-INIZCTEOSA-N	432.481	1.305	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)C(=O)Nc2cc([C@@H]3CCCOC3)nn2C)cc1	790952091	NVPZCVPBYDLMCE-CQSZACIVSA-N	431.518	1.501	50	20	IDGD	
CC[C@@H](C)CC(=O)NNC(=O)C[C@@H]1c2cc(OC)c(OC)cc2CCN1S(C)(=O)=O	791092507	WOVMEBDVOCDBCF-CZUORRHYSA-N	441.550	1.536	50	20	IDGD	
C=C(CBr)CN1CCN(S(=O)(=O)c2ccc3c(c2)NC(=O)CO3)CC1	791475431	OZUSKFIQYGJVSV-UHFFFAOYSA-N	430.324	1.275	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)CCc3ccccc3C(N)=O)n[nH]2)cc1OC	792284487	LYLUDHUTKOGIAW-UHFFFAOYSA-N	437.456	1.587	50	20	IDGD	
COC(=O)C[C@H]1CCC(=NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)[C@H]1C	794452730	BKIBUGDDWFAPCA-LSDHHAIUSA-N	437.518	1.403	50	20	IDGD	
COc1ccc(F)c2[nH]c(C(=O)OCC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)cc12	796200882	SOQLYSRQRRFKTF-UHFFFAOYSA-N	430.348	1.842	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)n1	797371159	PQZKEIRMFNIXGP-KBPBESRZSA-N	429.452	1.542	50	20	IDGD	
CN(C(=O)[C@H]1CCN(CC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)C1)c1ccccc1	797529622	AZOBYWJUHCZAGB-INIZCTEOSA-N	425.445	1.341	50	20	IDGD	
CCn1cc(C(=O)OCC(=O)NNC(=O)c2ccc(OC)c(OC)c2)c(C(F)(F)F)n1	797932778	KAJLQUHRMYDIOP-UHFFFAOYSA-N	444.366	1.557	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)NCCNS(=O)(=O)c1ccc(F)cc1F)c1ccccc1	799669426	QXWJRPTYNLBBHD-HNNXBMFYSA-N	440.472	1.767	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)nc1Br	802065575	GATISVZMSAALRR-UHFFFAOYSA-N	443.279	1.723	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)c2coc(S(=O)(=O)N(C)C)c2)c(OC)cc1Cl	802082224	PDWIGBDGAOJJPK-UHFFFAOYSA-N	446.869	1.667	50	20	IDGD	
O=C(NCc1ccco1)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	804031145	SYFKCPLJAAJPQM-UHFFFAOYSA-N	428.470	1.902	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)C(=O)Nc2csc(-c3ccccc3)n2)c2ccccc2c1=O	806974267	BVPUITDQHOMLBM-UHFFFAOYSA-N	448.464	1.457	50	20	IDGD	
COc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)C(=O)NNc1nccnc1C1CCC1	807461575	KMMMHWKIAZLMFL-UHFFFAOYSA-N	448.505	1.085	50	20	IDGD	
NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cccc(Cl)c2)c(OCC(F)F)c1	810386212	QGBAFWBKRJDCIR-UHFFFAOYSA-N	440.790	1.483	50	20	IDGD	
O=C(NCc1cccc(N2CCOCC2)c1)NNC(=O)c1nn(-c2ccccc2)cc1O	814465172	GSNLBIBTYAWYTE-UHFFFAOYSA-N	436.472	1.559	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NN=Cc3cccc4cc[nH]c34)CC2)cc1	814877611	SMBGGMNNEHSTRL-UHFFFAOYSA-N	439.541	1.933	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NNc2cccc(Cl)n2)o1	817007311	VSISNIYTONOTSC-NSHDSACASA-N	442.881	1.801	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)c2ccc(OC)c(S(=O)(=O)NC3CC3)c2)cc1	825554827	XIIHKJAUFIJYIQ-UHFFFAOYSA-N	448.501	1.018	50	20	IDGD	
Cc1ccc(S(=O)(=O)c2ccc(NNC(=O)CCC(=O)N3CCOCC3)cc2)cc1	830681571	SIMJQYLEJBUCRX-UHFFFAOYSA-N	431.514	1.910	50	20	IDGD	
C[C@@H]1CC(C)(C)C[C@]2(C1)NC(=O)N(CC(=O)NNC(=O)COc1ccc(C#N)cc1)C2=O	864017027	JZLVHKYRKCZKAA-PEBXRYMYSA-N	441.488	1.221	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)CCC(=O)N2CCC(c3ccccc3)=N2)C[C@@H](C)O1	912919127	KIYNCACAOWXAFJ-IAGOWNOFSA-N	429.521	1.050	50	20	IDGD	
CCOc1ccccc1N1C[C@@H](C(=O)NNC(=O)CCN2C[C@H](C)O[C@H](C)C2)CC1=O	912919859	RSOGCVHDKCPHEC-BBWFWOEESA-N	432.521	1.085	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)c1ccc(S(=O)(=O)N2CCCC2)o1	914830526	CUGLELGWPRQSSH-UHFFFAOYSA-N	445.457	1.030	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)[C@@H]2CCCN2C(=O)C(C)(C)C)cc1	914846533	OQVGSPDDKWPWRA-INIZCTEOSA-N	444.561	1.906	50	20	IDGD	
O=C(COC(=O)c1cn(-c2ccccc2Br)nn1)NNC(=O)c1ccccc1	914986694	GXPSBJODPQEQLW-UHFFFAOYSA-N	444.245	1.648	50	20	IDGD	
O=C(CCc1nc(-c2ccccn2)no1)NNC(=O)CCN1CCN(c2ccccc2)CC1	915133739	YXEMCKSELMFILV-UHFFFAOYSA-N	449.515	1.424	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1	916147686	JRPOBELHPHMXCX-UHFFFAOYSA-N	433.384	1.747	50	20	IDGD	
CCN(CC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)CC(=O)Nc1cccc(OC)c1	916148148	HJEWJMRKOPUCQU-UHFFFAOYSA-N	429.433	1.325	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)NCc1ccc(N2CCO[C@@H](C)C2)nc1	916392730	JHHFVODNVQSAPY-INIZCTEOSA-N	443.504	1.615	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)c1nnc(O)c2ccccc12)N1CCc2sccc2C1	916620248	VVJDHJNNFMACDC-LBPRGKRZSA-N	426.502	1.788	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)NC[C@@]2(N3CCOCC3)CCSC2)c2ccccc2n1	916637255	XAZHUAHKYSFKFS-NRFANRHFSA-N	429.546	1.695	50	20	IDGD	
Cc1ccc(C(=O)NNS(=O)(=O)c2ccc(Br)c(C(=O)O)c2)c(O)c1	917753771	PDJJYNGFOFVWGO-UHFFFAOYSA-N	429.248	1.785	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)CSCCOc2ccc(S(N)(=O)=O)cc2)c(C)o1	918552139	NCNZSSXMWOPEKC-UHFFFAOYSA-N	427.504	1.117	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCCc2ccc([N+](=O)[O-])cc2)nc1	919780496	DGCQXFZXDYJGOF-UHFFFAOYSA-N	436.494	1.889	50	20	IDGD	
O=C(NC[C@H]1CCCCO1)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	920343925	HHPRFOLXUYGBCL-GOSISDBHSA-N	446.529	1.678	50	20	IDGD	
O=C(CCNS(=O)(=O)c1cccc([N+](=O)[O-])c1)NNc1c(F)c(F)nc(F)c1F	920423784	RVKTXDXGXUTOJO-UHFFFAOYSA-N	437.331	1.358	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)c3nc(S(C)(=O)=O)n4ccccc34)n[nH]2)cc1	921203615	ODKXFOXHXWGOPP-UHFFFAOYSA-N	438.469	1.511	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@H](C)C(=O)NNC(=O)Cn1nc2n(c1=O)CCCCC2	1318364251	PVFDSWAZZAMVFE-CQSZACIVSA-N	435.912	1.656	50	20	IDGD	
Cc1c(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)cnn1C1CCOCC1	1320432309	TXAOVWQROSCINQ-UHFFFAOYSA-N	449.533	1.321	50	20	IDGD	
Cc1cc(C)n2ncc(C(=O)N3CC[C@@]4(C3)CN(C(=O)C(Cl)Cl)CCO4)c2n1	1777781234	XNTBIUKNCXMYQQ-GOSISDBHSA-N	426.304	1.593	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4c(c3)CC(=O)N4)C2)C1	1778394128	YALSXXGHNQQYBU-VQTJNVASSA-N	440.327	1.861	50	20	IDGD	
Cc1cnc2c(C(=O)N3CC[C@@]4(C3)CN(C(=O)[C@@H](F)Br)CCO4)cnn2c1	1778526045	IASJZIRRVGNEIW-CXAGYDPISA-N	440.273	1.172	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccnc(Cl)n3)C2)C1	1779500581	ZZPFUQSQQNULSS-ZBEGNZNMSA-N	431.718	1.605	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H]3C[C@H]3F)C2)C1	1781081912	RIAPJMYPLIXCCT-SSHHRWTQSA-N	433.908	1.306	50	20	IDGD	
O=C(c1cccn2cncc12)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781331155	DTPPENMMPCDIOR-RHSMWYFYSA-N	425.258	1.468	50	20	IDGD	
CSc1ncccc1C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781331249	HENYYVXAMUWEAW-MLGOLLRUSA-N	432.315	1.938	50	20	IDGD	
O=C(c1cc2cccnn2c1)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781332404	GZSBMDKOOGRLRC-RHSMWYFYSA-N	425.258	1.468	50	20	IDGD	
Cc1nccn1CC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)CBr)C2	1781553510	FFOKCMJFKZTLJC-ZSZQSSIHSA-N	441.370	1.736	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccnnc1O)C2	1781903592	XSZAVZISEPQPLV-PMUMKWKESA-N	441.326	1.483	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H]1CCc3nc[nH]c3C1)C2	1782179256	WDMTZWFLCDMKIR-PVMRSWARSA-N	438.956	1.282	50	20	IDGD	
Cn1cc(CC(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](F)Br)C3)cn1	1782591375	UFMCQTJOKDRUTA-UKPHBRMFSA-N	431.306	1.167	50	20	IDGD	
C[C@H](Oc1ccccc1)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1783321027	KATLOJPJSPDBCY-DHSIGJKJSA-N	429.286	1.974	50	20	IDGD	
C[C@@H](NC(=O)c1ccc(F)cc1)C(=O)N1CCO[C@@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783948263	GXFIARDPJKUKMZ-CWTRNNRKSA-N	446.306	1.578	50	20	IDGD	
CCOC(=O)C(C)(C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]2C1	1783975219	IBGPWIRRXMBPPR-QPSCCSFWSA-N	447.370	1.586	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](C)Sc3ccccn3)C2)C1	1784417381	GZQODMJZKLTIRB-VCBZYWHSSA-N	427.954	1.646	50	20	IDGD	
C[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)n1cccc1C=O	1786996293	DPHYTLKXTSSRED-MLEONAHRSA-N	444.301	1.532	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](N)Cc3cscn3)[C@H]2C1	1787397401	XCOVUSMWDBXIRK-SRQBIAJPSA-N	428.986	1.400	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3c[nH]c(C)c3)C[C@@H]21	1787509020	QDFGRCHMYKDCGE-IIYRHJEWSA-N	440.504	1.050	50	20	IDGD	
Cc1nc(F)ccc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)Br)C[C@@H]21	1789064271	ZYQHMFFGJILSAG-LVGORTOPSA-N	428.302	1.906	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3ccc4ncnn4c3)[C@H]2C1	1789716263	OOWDZXVJPKAKQU-BZSNNMDCSA-N	445.596	1.103	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc([N+](=O)[O-])[nH]3)C[C@@H]21)[C@H](F)Br	1789924881	ZVTDIJDNGSHBCV-PZEZNAACSA-N	433.234	1.207	50	20	IDGD	
C[C@@H](Cn1ccnc1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21	1791627018	WYVWWJJEJLNUIV-VGWMRTNUSA-N	427.343	1.284	50	20	IDGD	
Cc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)CBr)c(O)c1	1792873011	IOKRLRFQRQGWHH-ZJOBFFGXSA-N	425.323	1.935	50	20	IDGD	
CCC[C@H](NC(=O)c1ccccc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2	1793066201	AUTVOWFHHUBTBO-ADHGMGHFSA-N	439.915	1.709	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(N(C)C)cn1	1794462433	LRKQGJFLIRDSGS-JFILPPLUSA-N	425.327	1.134	50	20	IDGD	
Cc1ccc(OCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCBr)cc1	1795112419	GTULAUQZIZWXRD-CCWDJLKJSA-N	425.323	1.748	50	20	IDGD	
Cc1ccccc1OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCBr	1795112427	HKWCKETWXYFCAP-CCWDJLKJSA-N	425.323	1.748	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCS(=O)(=O)c1ccccc1)[C@H](O)CCl	1795716189	DDJPZCIVSJIWBE-JYYAWHABSA-N	428.938	1.088	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)c1occc1Br	1796189143	CBKJXXHQFRKILG-QDMKHBRRSA-N	447.094	1.288	50	20	IDGD	
C[C@H](Sc1ccccn1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1	1796190538	JSIUFUUAQRXRJC-FZDIXFNVSA-N	439.346	1.194	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Cl	1796365164	VADGSIWJHCSETC-AYCBFJCHSA-N	447.935	1.804	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2n(n1)CCC2	1797513642	OLULKOIDUDDCHV-LMWOUKEDSA-N	425.327	1.206	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C(F)(F)c1ccco1)C2	1798442746	BKTPNVUAYDERQD-CLLJXQQHSA-N	433.415	1.322	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1[C@@H]2Sc3ccccc3[C@H]21)c1cccc(B(O)O)c1	1798452668	JHJXVMOLFUBSJG-WXBORZKFSA-N	448.353	1.506	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)c1ccc(OC(F)F)cc1F	1798551847	OZKSVHYFZFMVPR-ANGCBRKESA-N	436.814	1.230	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](NC(C)=O)c1ccc(F)cc1	1799820469	DGSIDIBLQKXQKN-PJVZLEMVSA-N	439.915	1.895	50	20	IDGD	
CC(=O)N[C@@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](O)CCl)C2)c1ccc(F)cc1	1799821213	IRXPOEPYDDOUIB-CWQOZTLDSA-N	425.888	1.241	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCn1c(=O)oc3ccccc31)C2)C(Cl)Cl	1801015389	AGKZHTJPDNSPBB-DRXBFXEBSA-N	442.299	1.378	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCCn1ccnc1C	1801310495	BQEGYJXKBBWBCW-DFGXFYAUSA-N	441.370	1.735	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)Cn2cc([N+](=O)[O-])cn2)[C@@H]1c1cccnc1	1804421690	NVXPPJJAKYKJBE-ZVZYQTTQSA-N	434.884	1.910	50	20	IDGD	
COc1cccc(CCC(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)n1	1804430126	NFSJCAFTSJOCEP-MDKPJZGXSA-N	446.935	1.724	50	20	IDGD	
Cc1ccn(CC(=O)NC[C@@H]2CCN(C(=O)[C@H](F)Br)[C@H]2c2cccnc2)n1	1804623855	RBXOOJXXJSTNBY-XIRDDKMYSA-N	438.301	1.983	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2cc(OC)nn2C)[C@@H]1c1cccnc1	1804929088	PGOCRKRXYAKJFM-MPGHIAIKSA-N	435.912	1.397	50	20	IDGD	
CC[C@@H](NC(C)=O)C(=O)N1CC[C@@H](CNC(=O)CCBr)[C@H]1c1cccnc1	1806337428	HUVITGLUMAZQNB-LZLYRXPVSA-N	439.354	1.787	50	20	IDGD	
O=C(/C=C\C(=O)N1CC[C@@H](CNC(=O)CCBr)[C@H]1c1cccnc1)NC1CC1	1806344478	ZVASNPGSJNSWHD-PGHKVSDBSA-N	449.349	1.707	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)CC(F)(F)F)[C@H]1c1cccnc1	1806840526	GIKBCEBCBXWNEK-KBXCAEBGSA-N	429.443	1.413	50	20	IDGD	
CCc1ncccc1C(=O)N1CCCC2(CCN(C(=O)c3ccc(B(O)O)cc3)CC2)C1	1807590928	UPYSRPBGJCFDJD-UHFFFAOYSA-N	435.333	1.482	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)c1cnc2ncccn12	1809332732	QODVONMSUSBTJM-XIRDDKMYSA-N	428.880	1.044	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H](CNC(=O)[C@@H](O)N2CCOCC2)[C@@H]1c1cccnc1	1810350323	XXGCSRGVTQLZRA-ZIFCJYIRSA-N	438.956	1.003	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](CCN)C(=O)N1CCC2(CCCN(C(=O)[C@H](F)Cl)C2)CC1	1810901086	BWVACCKKXJHTSI-CABCVRRESA-N	448.967	1.994	50	20	IDGD	
Cc1ocnc1C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1	1811081017	VRIANOWELVZOID-BEFAXECRSA-N	449.471	1.010	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2c3c(nn2C)CCC3)[C@H]1c1cccnc1	1812227369	XGPZGHUUKIKXNM-VDZJLULYSA-N	445.951	1.877	50	20	IDGD	
Cc1ccoc1C(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1813070908	OBWPUROUPJOOME-FXAWDEMLSA-N	427.505	1.676	50	20	IDGD	
O=C(O)c1cc(C(=O)N2CC[C@H](CNC(=O)C(Cl)Cl)[C@@H]2c2cccnc2)ncn1	1813078222	RGRRCMKBJOUZDI-RISCZKNCSA-N	438.271	1.693	50	20	IDGD	
Cc1cnc2c(C(=O)N3CCCC[C@H]3c3cc(NC(=O)[C@H](O)CCl)n[nH]3)cnn2c1	1814873166	NSCUKEHRJVMINE-LSDHHAIUSA-N	431.884	1.666	50	20	IDGD	
C[C@@H](O)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)n[nH]1	1815705080	WKYXJBYWVSILSV-XBFCOCLRSA-N	443.932	1.915	50	20	IDGD	
COc1ncc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)[C@H](O)CCl)[nH]n2)cc1F	1816149777	FQKGOXFYGLBYNU-UONOGXRCSA-N	425.848	1.858	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCc2ccc[nH]2)n[nH]1	1817532297	GFADIEVYHYABQN-QGZVFWFLSA-N	429.525	1.736	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3c(C)nc4ncccn34)sc2C1	1818395840	MGBDMGKMYYZTDL-VXGBXAGGSA-N	448.936	1.974	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCBr)[nH]n1	1819350195	KFDFUECZPIHIRT-DGCLKSJQSA-N	443.346	1.894	50	20	IDGD	
Cc1ncc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cnccc3C(=O)NN)n[nH]2)[nH]1	1819401829	UNXPLFIBDSMETP-MRXNPFEDSA-N	437.464	1.059	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1ccc(F)nc1	1819692625	ZPNBYKMOHGACSO-QGZVFWFLSA-N	437.240	1.243	50	20	IDGD	
CC(C)c1cc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)n[nH]1	1820285472	RYFQOZMOVAAZIO-QGZVFWFLSA-N	444.540	1.935	50	20	IDGD	
Cc1c(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@@H](F)Cl)CC3)cn2[nH]cnc(=O)c12	1821220546	CCFUOWIOIHHPPM-ISVAXAHUSA-N	438.872	1.548	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](O)c2ccco2)[nH]n1	1822412201	NFPICZWPXSMNNX-KUHUBIRLSA-N	432.481	1.101	50	20	IDGD	
Cc1n[nH]c(C)c1CC(=O)N1CCCC[C@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1	1822415506	KATOPLJVYWAUGP-KRWDZBQOSA-N	444.540	1.357	50	20	IDGD	
Cc1noc(N)c1C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1	1823005296	ZBGVCTOXJHWRKH-LDWIPMOCSA-N	432.275	1.938	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CS(C)(=O)=O)CC2	1825445126	NZMXJFOBWVVMIZ-IUCAKERBSA-N	438.369	1.273	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(C)n3ccnc3n1)CC2	1826003852	ADHYPULAUVCDJQ-NWDGAFQWSA-N	448.936	1.974	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CS(C)(=O)=O)CC1	1826625427	IQJFCGHDQFGEJQ-HIFRSBDPSA-N	437.400	1.682	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3nccc4nc[nH]c34)C2)C1	1830358766	ZJHJQZJLZVGPEW-HXUWFJFHSA-N	435.912	1.293	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCN3CCCCC3)C2)C1	1830359877	XQWBAMYWEKKAFH-OAQYLSRUSA-N	429.989	1.584	50	20	IDGD	
CCCC(=O)N[C@H](C)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830364501	MLQXQSAHVQNLMM-QRWLVFNGSA-N	431.961	1.013	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)Cc2ccccc2O)CC1	1831472933	ANGAJUWITAXZAU-FQEVSTJZSA-N	444.576	1.927	50	20	IDGD	
CC[C@H](NC(C)=O)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1833096919	LJHUXCAYQFZJSH-JKSUJKDBSA-N	449.365	1.163	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)CCC(F)(F)F)CC2)CC1	1834594891	JQEZXZAKVMYCBK-UHFFFAOYSA-N	449.518	1.274	50	20	IDGD	
O=C(CCc1ccccn1)N1CCOC[C@@]2(C1)CN(C(=O)CCBr)CCO2	1834818966	GQYHFFOISQSSAE-LJQANCHMSA-N	440.338	1.256	50	20	IDGD	
CCc1ccnc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCBr)CCO3)C2)c1	1834822416	MEYLQCIXXOMRFD-LJQANCHMSA-N	440.338	1.499	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC1CCN(C2CCN(C(=O)c3cc(=O)cco3)CC2)CC1	1835833552	QDNGXHCVEXYYNO-UHFFFAOYSA-N	435.597	1.677	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)c3cnc(O)[nH]3)CC2)CC1	1835961589	LDXHBSXYHBBUQV-LBPRGKRZSA-N	442.358	1.332	50	20	IDGD	
COc1ccc(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)c(O)c1	1836243676	PDWOGFQYZWPQHK-IBGZPJMESA-N	439.940	1.186	50	20	IDGD	
Cc1c(F)ccc(C(=O)N2CCC(OC3CCN(C(=O)[C@H](O)CCl)CC3)CC2)c1N	1836716810	RLIGRSVMNJUZAK-GOSISDBHSA-N	441.931	1.928	50	20	IDGD	
O=C(c1cc2n(n1)CCCC2)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836717645	ZUJYBGYTSZBFFO-IBGZPJMESA-N	438.956	1.431	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)c3ncn(C)n3)CC2)CC1	1837383553	VCMQFYJYTNNAOA-HNNXBMFYSA-N	442.358	1.601	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(OC2CCN(C(=O)CC3CC3)CC2)CC1	1837761185	WRZMIVCCNOHSLA-PCLIKHOPSA-N	443.548	1.919	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(F)nc3)CCO2)C1	1837846891	SXGRBUUYNTYTRF-ROUUACIJSA-N	434.295	1.527	50	20	IDGD	
CC(=O)N[C@@H](C)C(=O)N1CCC(OC2CCN(C(=O)[C@H](F)Br)CC2)CC1	1838647994	DSCMSYNAYAHMLE-NHYWBVRUSA-N	436.322	1.200	50	20	IDGD	
CCOc1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)c1	1839020286	VCPDBJIQDDHWOQ-IBGZPJMESA-N	431.316	1.959	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccc4ncnn4c3)CCO2)C1	1839047536	UIIWNACHBLBXMI-UWJYYQICSA-N	449.939	1.136	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)C3CCN(C(C)C)CC3)C2)C1	1839142001	BDAZWDWPCSSJDX-NQIIRXRSSA-N	429.989	1.581	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccc(F)c(F)c3)C2)C1	1839143217	OTUUCVCNSMQVEG-YWZLYKJASA-N	430.879	1.981	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(CN(C(=O)/C=C/c3cccc(O)c3)CCO2)C1	1839925585	AEERFZZBWUHITR-VQKOGROQSA-N	448.592	1.713	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)COC(C)(C)C)C2)C1	1839962463	FYNFWGPQPBCWMX-KSSFIOAISA-N	435.359	1.431	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CCOC[C@]2(CN(C(=O)C(Cl)Cl)CCO2)C1	1840190725	KCZDNBPJMMRPOA-IQUTYRLHSA-N	449.331	1.002	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H]3CCCS3)CCO2)C1	1840580006	ZONIPLZGBDMHKA-XOKHGSTOSA-N	425.378	1.575	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC=C(C(=O)N2CC3(CCCN3C(=O)[C@@H](O)CCl)C2)C1	1841350283	SWSLKAYBLMUBPI-HNNXBMFYSA-N	427.929	1.357	50	20	IDGD	
C[C@H](C(=O)N1CCCC12CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)n1ccnc1	1841464337	DVVCQXPZKSCCHC-CABCVRRESA-N	439.944	1.780	50	20	IDGD	
C[C@H](Br)C(=O)N1CC2(CCCN2C(=O)CCn2c(=O)oc3ccccc32)C1	1841988587	RDMZFLUARDFEEJ-ZDUSSCGKSA-N	436.306	1.971	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1ccc3cnccc3n1)C2	1843416067	VDWSXQCGPLHXCO-JFLMPSFJSA-N	445.483	1.581	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](O)[C@H](C(=O)N2CCCC23CN(C(=O)[C@H](F)Cl)C3)C1	1843822624	DSNBWBPIUGFXNW-RDBSUJKOSA-N	433.908	1.342	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)c2ncccc2C(F)(F)F)C1	1844531685	HECSRFBBOFIXCW-UHFFFAOYSA-N	427.427	1.290	50	20	IDGD	
CCOC(=O)N(CC(=O)N1CCCC12CN(C(=O)[C@H](Cl)COC)C2)Cc1ccco1	1846531212	OWCDQUDIHFWUBL-MRXNPFEDSA-N	441.912	1.695	50	20	IDGD	
CN(C)C(=O)NCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)/C(C#N)=C/c1ccc(F)cc1F	1847346179	ROOWPEBFIFNBSK-UMYNOAJGSA-N	431.443	1.345	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CN(C)C(=O)c1ccccc1	1847494307	OLSNLQUXRWNSQD-XIRDDKMYSA-N	436.350	1.991	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Cn2cnc3sc(C)c(C)c3c2=O)cc(OC)c1OC	16230007	IZIAATDPHCMSJB-UHFFFAOYSA-N	446.485	1.562	50	20	IDGD	
COc1ccc(-c2nc(C(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)cs2)cc1OC	18949586	FUQVXDNCLBKVAK-NSHDSACASA-N	425.488	1.023	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)c1ccc2c(c1)S(=O)(=O)N(C(C)C)C2=O	108058373	HEODBYBTZPTHSS-UHFFFAOYSA-N	445.497	1.642	50	20	IDGD	
O=C(NNC(=O)N1CCN(C(=O)c2cccc(O)c2)CC1)c1cc(Br)c[nH]1	725860463	PLWOSYUTSBAMPN-UHFFFAOYSA-N	436.266	1.295	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)NC1CCN(c2nc3ccccc3s2)CC1	726247696	HEBVRTZAOYCZEY-UHFFFAOYSA-N	442.501	1.619	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(CNC(=O)C3CCCC3)cc2)c1	727788857	QXZVVNQNPYHVMA-UHFFFAOYSA-N	443.525	1.971	50	20	IDGD	
COc1cc2ncn(CCCC(=O)NNC(=S)NCC3CCC3)c(=O)c2cc1OC	727866940	HQWNVZABGWCYSV-UHFFFAOYSA-N	433.534	1.489	50	20	IDGD	
CN1CCN(C[C@@H](NC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c2ccccc2)CC1	727945140	IYYUZCQUCBBKMB-WIYYLYMNSA-N	439.516	1.146	50	20	IDGD	
Cc1cc(C)c2c(n1)=S=C(C(=O)NNc1nc(-c3ccncc3)no1)C=2n1cccc1	728072444	KXGZWGORLJKBJW-UHFFFAOYSA-N	431.481	1.915	50	20	IDGD	
CS(=O)(=O)Cc1cccc(CNC(=O)NNC(=O)c2cccc(OC(F)F)c2)c1	728597588	UVDMDWAHIQKWAI-UHFFFAOYSA-N	427.429	1.977	50	20	IDGD	
CN(CC(=O)N(C)C1CCCCC1)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	728959616	NZUZWHDKMOZVND-UHFFFAOYSA-N	431.541	1.157	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)NCCCCN2CCN(c3ncccn3)CC2)cc(C#N)n1C	729378421	RKIBRMOHSZNEOM-ZHZULCJRSA-N	432.532	1.621	50	20	IDGD	
CC/C=C(/C)C(=O)N1CSC[C@H]1C(=O)OCC(=O)NNC(=O)c1ccc(Cl)cc1	730321739	BQJKPZVZHANEDD-VPRWNFCTSA-N	439.921	1.902	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)[C@H]1CCCN(S(=O)(=O)Cc2ccccc2)C1	730483633	DOKCUTIQNSXUQM-IBGZPJMESA-N	445.541	1.627	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C1CCN(C(=O)OCc2ccccc2)CC1	730780021	NGHVBQDATLTBCG-UHFFFAOYSA-N	427.457	1.967	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H](c2ccccc2)N2CCCCC2=O)c1	731223573	HCVDDLPTMZGUHL-IBGZPJMESA-N	429.498	1.605	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)NNC(=O)C2CCC2)cc1	732141335	HERVBKQMXXSUPH-LFIBNONCSA-N	436.472	1.289	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)c1ccccc1	732246083	MGANRNILTFFSSV-QGZVFWFLSA-N	425.493	1.248	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)CNC(=O)c1ccc(Cl)c(Cl)c1	734241311	MJKHMNUMTWPFKP-UHFFFAOYSA-N	448.307	1.578	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)CC(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)cc1F	734808830	GIWIDVYKGGOMGJ-GFCCVEGCSA-N	440.424	1.556	50	20	IDGD	
O=C(NC[C@@H]1COCCO1)NNc1ccc(S(=O)(=O)NC2CCCCCCC2)cn1	735582525	PKSYRMDHCOTVMF-MRXNPFEDSA-N	441.554	1.514	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)CN2CCN(C(=O)OC(C)(C)C)CC2=O)c1C	741207175	JOLHEHSBBGCMPB-INIZCTEOSA-N	448.520	1.297	50	20	IDGD	
CS(=O)(=O)[C@@H]1CCCCC1=NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	741458917	YZZWPVWVRVOSNS-QGZVFWFLSA-N	427.548	1.544	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NN=C(C)[C@H]1CCOC1)N(S(C)(=O)=O)CC2	741756620	LCBFYFIEMOGYCA-RDJZCZTQSA-N	439.534	1.481	50	20	IDGD	
Cc1ccc(C(=O)N[C@H](C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)C(C)C)cc1	741818711	XRIJQEQZTHKZHW-FQEVSTJZSA-N	436.468	1.626	50	20	IDGD	
O=C(NCc1cccc(C(F)(F)F)c1)NNC(=O)[C@@H]1CC(=O)N(CC(F)(F)F)C1	742453853	ZZRTZBABLQUSTH-SNVBAGLBSA-N	426.317	1.947	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N2CCc3n[nH]cc3C2)cc1	743901528	NUVOTACENAWYGG-MHWRWJLKSA-N	445.483	1.649	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)[C@H](O)[C@H](C)c2ccc(C)cc2)cc1OC	745756331	MNGZAEMVORCJRM-JLTOFOAXSA-N	430.457	1.481	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)[C@@H]1CCCN1c1ncccn1	747347791	GQYMLQMCJQOKIZ-DOMZBBRYSA-N	434.294	1.823	50	20	IDGD	
Cn1ccnc(NNC(=O)c2ccc3c(=O)n(-c4ccccc4F)c(S)nc3c2)c1=O	747937406	FJWGLCHKXKUSCU-UHFFFAOYSA-N	438.444	1.664	50	20	IDGD	
Cc1cc(F)ccc1S(=O)(=O)Nc1ccccc1C(=O)NNC(=O)C(=O)N1CCCC1	748247551	RMYSWKYBRMEJBI-UHFFFAOYSA-N	448.476	1.318	50	20	IDGD	
O=C(NNS(=O)(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)c1cc2ccccc2o1	749866530	CAQNMLVWBCNQDS-UHFFFAOYSA-N	449.510	1.841	50	20	IDGD	
CO[C@@H](C)c1noc(CN2CCCN(C(=O)NNC(=O)c3ccc(C#N)cc3)CC2)n1	750277494	XHIYOTQMZGTWLH-AWEZNQCLSA-N	427.465	1.211	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C1CCN(C(=O)CCc2ccccc2)CC1	751209148	MHODZKYIGVZULF-UHFFFAOYSA-N	442.541	1.497	50	20	IDGD	
CCN(CCS(C)(=O)=O)C(=O)NNC(=O)[C@H](C)Oc1cccc(Br)c1	753002103	BPVINONPSJMNIK-NSHDSACASA-N	436.328	1.324	50	20	IDGD	
CC(=O)NC[C@H]1CCn2ncc(C(=O)NNC(=O)c3cc(-c4cc(C)ccc4C)[nH]n3)c2C1	753258837	MUAWKOUQPNBFMK-INIZCTEOSA-N	449.515	1.663	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)Cc2cc[nH]n2)cc1S(=O)(=O)N1CCCCCC1	755394788	UWSUJMVCBDQWSD-UHFFFAOYSA-N	434.522	1.678	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)n(-c2cccc(C(F)(F)F)c2)n1	755595280	RYWFSDLXTGRRBZ-JTQLQIEISA-N	448.427	1.290	50	20	IDGD	
CNC(=O)c1ccc(OC)c(NC(=O)NNC(=O)[C@@H](C)Oc2ccc(C(C)=O)cc2)c1	755918677	HWWKOKXWZMGAKU-CYBMUJFWSA-N	428.445	1.878	50	20	IDGD	
CCOC(=O)c1sc(NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1C	756286623	IDJALEXEGKJRGT-UHFFFAOYSA-N	429.458	1.947	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)CNC(=O)c2ccccc2C(F)(F)F)c1	756728713	WQIWIUHVHDSQJF-UHFFFAOYSA-N	437.374	1.748	50	20	IDGD	
CNC(=O)c1cc(Oc2cc(NC(=O)NNC(=O)[C@H](C)OCCOC)ccc2C)ccn1	756860360	UUJSHCGBUFNFJB-AWEZNQCLSA-N	445.476	1.746	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1ccccc1Oc1cc(F)cc(F)c1	757689803	QTNZAZMFHJMDDG-SNVBAGLBSA-N	428.417	1.848	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N[C@@H]1CCCS(=O)(=O)C1	758661099	XSMCINQGKRLHTF-CMPLNLGQSA-N	434.312	1.124	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccccn2)nn1-c1ccc(Br)cc1	758839435	NHFLLDLZRYXRDH-UHFFFAOYSA-N	443.261	1.738	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1cn(C)c(=O)c2ccccc12	759108017	XCMYUTOMPTZMNU-UHFFFAOYSA-N	443.843	1.819	50	20	IDGD	
CC(C)(C)OC(=O)N(CC(=O)NNc1nccc(N2CCOCC2)n1)C[C@@H]1CCCO1	762860721	HUDUYOBSHJVUTK-HNNXBMFYSA-N	436.513	1.172	50	20	IDGD	
CN1CC[C@@H](CNC(=O)NNC(=O)C(=O)N2CCCC2)[C@@H]1c1ccc(Cl)c(F)c1	763090260	BCSQQZRRESIGGW-BBRMVZONSA-N	425.892	1.425	50	20	IDGD	
Nc1c(Br)cc(Br)cc1C=NNC(=O)Cc1cc(O)nc(O)n1	763406043	JKWZMYJUWZOJSU-UHFFFAOYSA-N	445.071	1.688	50	20	IDGD	
CCN(CC)C(=O)Cn1ccc2cc(NC(=O)C(=O)NNC(=O)c3ccncc3)ccc21	763465370	XNRCWTXWTVNUAV-UHFFFAOYSA-N	436.472	1.304	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1cccc(-c2noc(C3CC3)n2)c1	763468571	NAAOHABOVMINEX-UHFFFAOYSA-N	436.384	1.922	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)cc2)C[C@H](C)O1	763472527	WMVWBSPELYICJX-KBPBESRZSA-N	441.444	1.608	50	20	IDGD	
Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)C(=O)NNC(=O)c1cccnc1	763491805	OSJFTYQFYHPRMT-LJQANCHMSA-N	447.499	1.433	50	20	IDGD	
O=C(NNC(=O)c1c[nH]c2ccccc12)C(=O)Nc1ccc(S(=O)(=O)C(F)F)cc1	763541604	YDHJWVBOLZFISL-UHFFFAOYSA-N	436.396	1.564	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)C(=O)Nc2cccnc2C)cc(OCC)c1OCC	763543768	OTBOWKZUEVGRMQ-UHFFFAOYSA-N	430.461	1.986	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(C(=O)NC(C)C)cc2)cc1C	763664775	GNNOZLOITPWEOX-UHFFFAOYSA-N	426.473	1.607	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccccc1O[C@H]1CCOC1	763682994	YSLNJSNIZWRWDB-HNNXBMFYSA-N	443.456	1.418	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(C(=O)N(C)C)ccc1OC	763711341	HQSOJGHRWCMRPF-UHFFFAOYSA-N	442.472	1.124	50	20	IDGD	
CCN1CCC(n2nccc2NC(=O)C(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)CC1	763733934	IMSVZAQFCLNVBA-UHFFFAOYSA-N	442.564	1.842	50	20	IDGD	
CN(C)C(=O)c1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)c1cccc(N(C)C)c1	763760381	LKKMSCWAFRDWTJ-UHFFFAOYSA-N	431.880	1.508	50	20	IDGD	
CNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)cc1Cl	763848431	HNPCSRYVVVIGKK-CYBMUJFWSA-N	446.891	1.870	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2c(F)cc(Br)cc2F)n1	763892760	KDVGNGUDQYYTLG-UHFFFAOYSA-N	430.209	1.327	50	20	IDGD	
O=C(CCSc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccc(-n2ccnc2)nc1	763904087	WHMVJYSPFKMXFP-UHFFFAOYSA-N	428.449	1.675	50	20	IDGD	
Cc1ccc(Oc2ccc(NC(=O)C(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)cc2)cc1	763998257	NXKBGSJHGGSCBQ-AWEZNQCLSA-N	431.470	1.308	50	20	IDGD	
CCCOC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1	764006181	LTXYCSSFFMUMRE-UHFFFAOYSA-N	427.413	1.424	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)[C@@H]1CS[C@H](Cc2ccccc2F)C(=O)N1	764049608	KQWGDWDJHMSLOP-WMLDXEAASA-N	449.529	1.614	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2ccccc2N2CCN(C)CC2)cc1	764124126	CNKBBJHCRDETDU-UHFFFAOYSA-N	439.516	1.166	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2ccc(CN3CCCC3=O)cc2)cc1	764126811	JRUAWULPRAHJHJ-UHFFFAOYSA-N	438.484	1.536	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccc(Sc2nccn2C)cc1	764131504	HZIHZEIEICWDSZ-UHFFFAOYSA-N	439.497	1.909	50	20	IDGD	
COc1ccc(C(=O)N([C@@H]2CCS(=O)(=O)C2)N(C)C)cc1I	764230097	NHFOXFBZENAXOH-LLVKDONJSA-N	438.287	1.406	50	20	IDGD	
Cc1cc(Oc2ncccn2)ccc1NC(=O)C(=O)NNC(=O)COCc1ccccc1	764365829	DHTHSRJGSMUTOK-UHFFFAOYSA-N	435.440	1.880	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2ccccc2O[C@@H](C)C#N)n[nH]1	764378275	XNUDCVJODLRGLU-ZDUSSCGKSA-N	448.439	1.776	50	20	IDGD	
CCS(=O)(=O)c1cc(F)ccc1NC(=O)C(=O)NNC(=O)c1ccc(Cl)cc1F	764413961	XPDFUIKXTPXYHC-UHFFFAOYSA-N	445.831	1.812	50	20	IDGD	
CCOc1ccc(Oc2ccccc2NC(=O)C(=O)NNC(=O)[C@@H]2COCCO2)cc1	764435443	VDLWPWDSVLNWMQ-SFHVURJKSA-N	429.429	1.379	50	20	IDGD	
O=C(CSc1nnc(-c2ccco2)n1-c1ccccc1)NNC(=O)C(=O)N1CCCC1	765348366	JYPXQIJTXVGHOE-UHFFFAOYSA-N	440.485	1.389	50	20	IDGD	
O=C(CN1CCN(CCOC(c2ccccc2)c2ccccc2)CC1)NNC(=O)C1CC1	767038409	NHYRNTHSZDWBJK-UHFFFAOYSA-N	436.556	1.968	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1ccc(C(=O)NC(C)C)cc1	767192014	MHZAJVOTPQEBLQ-UHFFFAOYSA-N	431.518	1.501	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)Cn1nc(-c2ccccc2)ccc1=O	767290628	HVQDAXGFZCQWPC-UHFFFAOYSA-N	434.452	1.152	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)CCc3nc(O)c4cnn(C)c4n3)n[nH]2)c1	768264533	KWKFIVOVWORTQK-UHFFFAOYSA-N	434.460	1.470	50	20	IDGD	
CC1(C)CCC[C@]2(C1)NC(=O)N(CC(=O)NNC(=S)NCCc1cccs1)C2=O	768571118	MXIJOGHGXDGHHC-LJQANCHMSA-N	437.591	1.677	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCCC2)cc1)NNC(=S)Nc1ccccn1	768579797	ZEFMVEYIPVQQPH-UHFFFAOYSA-N	433.559	1.817	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)NCCNC(=O)Cc1cccc(F)c1	770449740	WILNJMWFXLKVEB-ZDUSSCGKSA-N	436.871	1.936	50	20	IDGD	
Cc1cc2c(N3CCC[C@H]3C(=O)NNC(=O)COc3ccccc3O)ncnc2s1	770953445	BCKUVSBPLCBYQB-AWEZNQCLSA-N	427.486	1.901	50	20	IDGD	
O=C(NNc1ccc(Br)c(F)c1)N[C@@H]1CCN(CCN2CCOCC2)C1	771322439	CXIYYTQUEZHRTF-CQSZACIVSA-N	430.322	1.621	50	20	IDGD	
Cc1ccc(I)cc1NC(=O)C(=O)NNC(=O)c1c[nH]nc1C	773496625	LMAOLYNURAQNHA-UHFFFAOYSA-N	427.202	1.031	50	20	IDGD	
O=C(Cc1ccc([N+](=O)[O-])cc1Cl)N1CCN(S(=O)(=O)CBr)CC1	777835695	CEZYRHVBHCSQOF-UHFFFAOYSA-N	440.703	1.617	50	20	IDGD	
O=C(COC(=O)COc1ccc2c(c1)CCC2)NNC(=O)[C@@H]1COc2ccccc2O1	778246797	LJKKYGZWPXPDEM-IBGZPJMESA-N	426.425	1.085	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1cc2c(cc1F)NC(=O)CC2	778706684	BNNVCIQTTQCKFA-JTQLQIEISA-N	432.383	1.403	50	20	IDGD	
C[C@@H](NC(=O)OC(C)(C)C)[C@H]1CCN(CC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)C1	778980947	ZPLXDMFWFGYRCE-HIFRSBDPSA-N	435.481	1.591	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1S(=O)(=O)NNC(=O)C(C)(C)c1ccccc1	780387716	UAFDQELTUWCOAI-UHFFFAOYSA-N	425.532	1.224	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)c2c(F)ccc(S(=O)(=O)NC3CC3)c2F)c1	781035011	VYZWAQVRLMQKDS-UHFFFAOYSA-N	425.413	1.949	50	20	IDGD	
CCN1CCN(S(=O)(=O)c2ccc(Cl)c(C(=O)NNc3ccnc(F)c3)c2)CC1	781363818	LNBCBKUIHCEGAN-UHFFFAOYSA-N	441.916	1.957	50	20	IDGD	
O=S(=O)(CBr)N1CCN(S(=O)(=O)c2ccc(F)c(F)c2F)CC1	782398883	OOYDBLKEYQISAU-UHFFFAOYSA-N	437.259	1.092	50	20	IDGD	
Cc1nn(-c2ccccc2)c(C)c1NC(=O)C(=O)NNC(=O)Cc1nc2ccccc2n1C	782892754	GJKHLDZGENCHEI-UHFFFAOYSA-N	445.483	1.704	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)C(=O)Nc1ccc(Cl)cc1F	782898076	YLIYRQLRDFCTQG-UHFFFAOYSA-N	427.845	1.172	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2cccc(NC(=O)c3cccs3)c2)CCS(=O)(=O)C1	783424588	FQXXECGOWPUGDA-GOSISDBHSA-N	436.515	1.137	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2cccc(S(=O)(=O)N(C)c3ccccc3)c2)ncn1	783944109	DWNQCMQJVCUCDT-UHFFFAOYSA-N	440.485	1.692	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(NC(=O)C(=O)NNc2ccc(Br)cn2)c1	784342031	XGOGYDXZUFHIBX-UHFFFAOYSA-N	442.295	1.176	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)c1cc(N2CCOCC2)ccn1	784445865	CNUNHZPLXKBPJX-UHFFFAOYSA-N	433.534	1.752	50	20	IDGD	
Cn1ccnc(NNC(=O)C(=O)Nc2cc(Cl)ccc2OC[C@@H]2CCCCO2)c1=O	785089832	GUCXSNTXLFLNDW-ZDUSSCGKSA-N	435.868	1.463	50	20	IDGD	
CCc1c(NC(=O)C(=O)NNc2c(OC)cccc2S(C)(=O)=O)cnn1CC(C)C	785330756	LIJDNZAEHBDMFH-UHFFFAOYSA-N	437.522	1.595	50	20	IDGD	
COCCc1ccccc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)C(F)F)cc1	786412857	VADLYPBWBWAZMH-UHFFFAOYSA-N	427.429	1.954	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)C(=O)Nc2ccn(C3CCN(C)CC3)n2)cc1	787544518	SCLZDYLXTKCWCO-UHFFFAOYSA-N	430.534	1.336	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C(=O)Nc1ccc(C(N)=O)c(OC(C)C)c1)c1ccccc1	789734781	OSRQAEHMDQGFPZ-INIZCTEOSA-N	426.473	1.852	50	20	IDGD	
O=C(NNC(=O)[C@H]1OCC[C@H]1c1ccccc1)C(=O)N1C[C@H]2CCCN2c2ccccc21	789809983	JSVYKCRNHTULDF-LQWHRVPQSA-N	434.496	1.722	50	20	IDGD	
COc1cc(C)nc(NNC(=O)NCc2cccc(N3C(=O)N[C@](C)(C4CC4)C3=O)c2)n1	790892243	BNMYSSUGAQKXRV-OAQYLSRUSA-N	439.476	1.845	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(N2C[C@H](C(=O)NNc3ncccc3C)CC2=O)cc1	791224097	OXXYOOKPICCBDV-MRXNPFEDSA-N	445.545	1.917	50	20	IDGD	
CN(C)N(C(=O)[C@@H]1CCN(c2cc(Cl)ccc2Cl)C1=O)[C@@H]1CCS(=O)(=O)C1	792851928	YTNHDFUBJCRDDX-CHWSQXEVSA-N	434.345	1.839	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNC(=O)Nc1cccc(N2CCNC2=O)c1	794751115	IERQQDXOXWYEEZ-UHFFFAOYSA-N	426.433	1.295	50	20	IDGD	
COc1ccc(C(=O)NCCCC(=O)NNc2ccccc2S(=O)(=O)N(C)C)cc1	795169316	MSXRSBDQSIUKQY-UHFFFAOYSA-N	434.518	1.599	50	20	IDGD	
CCOC(=O)c1ccc(OC)c(S(=O)(=O)NNC(=O)c2ccc(Cl)cc2O)c1	795300717	RKRALCSKTKJWQO-UHFFFAOYSA-N	428.850	1.854	50	20	IDGD	
COC(=O)c1cc(F)c(Br)cc1NC(=O)C(=O)NNC(=O)c1cccn1C	797000442	RXOAUEIGKYBZDR-UHFFFAOYSA-N	441.213	1.113	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(C)n2)c2ccccc12	797370554	OULGWSQDAFLIGG-UHFFFAOYSA-N	436.424	1.495	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(Br)cc([N+](=O)[O-])c2C)o1	797536304	ZJKPGZFCSYYUGH-UHFFFAOYSA-N	425.195	1.967	50	20	IDGD	
CC(C)CC(=O)N[C@H](CC(N)=O)C(=O)NNC(=O)c1ccc(-c2ccc(F)cc2)s1	798154079	VDFHDVLENPYKEA-CQSZACIVSA-N	434.493	1.722	50	20	IDGD	
O=C(NCc1ccncc1OCC(F)(F)F)NNC(=O)c1nnc(O)c2ccccc12	798522879	ZPXIWNJEPNKABP-UHFFFAOYSA-N	436.350	1.816	50	20	IDGD	
Cc1c(C(=O)NNC(=O)COc2ccc(F)cc2)nnn1CCOc1ccc(F)cc1	800314171	BYJQKTSLYGSXSU-UHFFFAOYSA-N	431.399	1.784	50	20	IDGD	
C[C@H](Sc1ccccc1C(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)C(N)=O	802069216	YDONSADNBFJYFG-NSHDSACASA-N	436.515	1.523	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1ccc(OC(F)F)cc1F	802573224	VOGPTVXNUMHIIW-UHFFFAOYSA-N	447.391	1.921	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)N2CCC[C@@H](CN(C)S(C)(=O)=O)C2)c1C	804184831	FSBNAXQSXCAQKX-HRVJUDJTSA-N	436.578	1.788	50	20	IDGD	
O=C(CN1CCOCC1)Nc1ccc(NC(=O)NNc2ccc(-n3ccnc3)nn2)cc1	806183563	UOAQFUXGZVBCSH-UHFFFAOYSA-N	437.464	1.082	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(NC(=O)C(=O)NNc2nc3ccccc3s2)ccc1F	806991760	WEFPBVUQULABRF-UHFFFAOYSA-N	437.478	1.768	50	20	IDGD	
COc1ccc(C(=O)N[C@H](C(=O)NNC(=O)N2CCN(C)CC2)c2ccccc2)cc1	807379859	GUOBJILYJIXCAQ-IBGZPJMESA-N	425.489	1.155	50	20	IDGD	
O=C(NNc1cccc(F)n1)C(=O)N1C[C@@H](C(=O)N2CCCCC2)Oc2ccccc21	807390777	OPSDKIJDLSWQGQ-INIZCTEOSA-N	427.436	1.471	50	20	IDGD	
COc1ccc(Cn2nccc2NC(=O)C(=O)NNc2cccc(F)n2)c(OC)c1OC	807391179	IMSGGEAQDNOOJB-UHFFFAOYSA-N	444.423	1.573	50	20	IDGD	
CCOc1ccc(C(=O)NNS(=O)(=O)c2nc(C)n(C)c2Br)cc1OC	808069739	ILQWFYHVEZUSDW-UHFFFAOYSA-N	447.311	1.522	50	20	IDGD	
O=C(c1cncnc1-c1ccccc1)N1CCN(S(=O)(=O)CBr)CC1	810911485	ALIQMTPMMSRZDT-UHFFFAOYSA-N	425.308	1.584	50	20	IDGD	
CC(C)OCc1nc([C@@H](C)NC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)no1	811971871	HFCIQKPJZRFAKC-GFCCVEGCSA-N	429.437	1.591	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2ccc(C(F)(F)F)s2)c1	812269809	VEMRCYZDJGWQMK-UHFFFAOYSA-N	428.435	1.794	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)N[C@H]2C[C@H](C)S(=O)(=O)c3sccc32)cc1	812655635	RIOGZHZVKHUCSX-NHYWBVRUSA-N	439.515	1.773	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NN=C1COc2ccccc21	814709925	HRYAOPCENIDLDW-UHFFFAOYSA-N	429.498	1.553	50	20	IDGD	
Cc1nn(C)c(N)c1C=NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	814710449	QSPQSVGFNCFDEA-UHFFFAOYSA-N	426.502	1.553	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C)cc2)cc1)[C@H]1C[C@@H]1C	815565925	FDNCCHQMZYMQAM-YWZLYKJASA-N	438.484	1.921	50	20	IDGD	
CCOCCCn1c(NNC(=O)C[C@@H]2CCCS(=O)(=O)C2)nc2ccccc2c1=O	815604150	FYWSQCXLSASLLF-HNNXBMFYSA-N	436.534	1.481	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@@H]2CCc3nncn3C2)ccc1Oc1cccnc1	815692859	DLPYCDAGSLZGRA-CQSZACIVSA-N	435.444	1.122	50	20	IDGD	
O=C(CCCCCNS(=O)(=O)c1ccc2c(c1)OCCO2)NNc1ncncc1F	817083758	RZUREKRJGUJUAU-UHFFFAOYSA-N	439.469	1.369	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)c1ccc2ccccc2c1)C(=O)N1CC[C@H](B(O)O)C1	864232338	ZZYDKACUWOBFHN-FUHWJXTLSA-N	436.364	1.315	50	20	IDGD	
O=C(COC(=O)c1sccc1-n1cccc1)NNC(=O)[C@@H]1COc2ccccc2O1	878482476	RSOKFEQUUPJBRY-INIZCTEOSA-N	427.438	1.683	50	20	IDGD	
CC(C)(C)OC(=O)NNC(=O)c1ccc(Cl)c(S(=O)(=O)NC[C@@H]2CCCO2)c1	913176342	QWRZLNGJNRTOLZ-LBPRGKRZSA-N	433.914	1.967	50	20	IDGD	
Cc1noc(CCC(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)n1	914839167	NPEJWLLJBPDKPF-UHFFFAOYSA-N	432.440	1.530	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2cc(C)nc3c2c(O)nn3C)c2ccccc2c1=O	915190923	SPODJQWFZLTOSL-UHFFFAOYSA-N	435.444	1.177	50	20	IDGD	
Cn1ccnc1[C@H](NC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)c1cccc(F)c1	916223923	GXMBGADVWKSQAU-QGZVFWFLSA-N	445.476	1.696	50	20	IDGD	
COc1ccc(OC)c([C@@H](O)CNC(=O)NNC(=O)c2cc(Br)c[nH]2)c1	916473413	GYNSCKLMMUXIQF-ZDUSSCGKSA-N	427.255	1.472	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)NCCCN1CCN(Cc2ccccc2)CC1	916485857	JQJUNIYOHWAZKA-UHFFFAOYSA-N	443.523	1.743	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)N[C@H](C)c2nncn2C)c2ccccc2c1=O	916580615	LFFOLGFWUSACJR-CYBMUJFWSA-N	426.481	1.420	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCCOc1ccc2c(c1)OCO2	916647003	BIMNFPLCXDMVEE-UHFFFAOYSA-N	449.489	1.040	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)Cn2nc(-c3ccccc3)ccc2=O)cc1	916743011	BMNBRVKWKFMKNQ-INIZCTEOSA-N	436.468	1.924	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNS(=O)(=O)c1cc2c(cc1F)NC(=O)CC2	917720641	KSKPWULWABLANV-UHFFFAOYSA-N	437.449	1.498	50	20	IDGD	
CCN(CCCNC(=O)NNC(=O)c1sc(-c2ccccc2)nc1C)S(C)(=O)=O	918118830	FYTXMLTXMPMPIT-UHFFFAOYSA-N	439.563	1.734	50	20	IDGD	
O=C(CN1C(=O)[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)NNC(=O)c1ccc(F)cc1Br	918339970	YDNKZRUFQJLNLU-PVFTVIPPSA-N	436.237	1.156	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)c1ccc(C)c(S(=O)(=O)N2CCOCC2)c1	919822511	YKUHQBNVDSYYEM-UHFFFAOYSA-N	447.513	1.028	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)NCc2cccc(NC(=O)[C@H]3CCCO3)c2)cc1	920237341	IOVRIUREJLDWBI-LJQANCHMSA-N	437.456	1.585	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCC[C@@H](CNC(=O)OC(C)(C)C)C2)n1	920421568	HCBVXYSQUFRNBO-AWEZNQCLSA-N	425.555	1.378	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2cccc(CN3CCC[C@@H]3C(N)=O)c2)cc1OC	920929266	FMRPJCPTLFEAPE-QGZVFWFLSA-N	441.488	1.620	50	20	IDGD	
CCCNC(=O)NNC(=O)c1ccc(OC)c(S(=O)(=O)N2C[C@@H](C)C[C@H](C)C2)c1	921042603	CXUKODHPQCQVKS-KBPBESRZSA-N	426.539	1.716	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2cc(Br)c(C=O)n2C)c2ccccc2c1=O	1318911848	IFBGCLUJIOPDAA-UHFFFAOYSA-N	446.261	1.405	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)c2ccc(F)cc2n1	1322643736	SUPKMNURQPBYIP-UHFFFAOYSA-N	449.486	1.901	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)(C)O	1325041013	BCABZIUBXSIWDX-CQSZACIVSA-N	430.527	1.044	50	20	IDGD	
Cc1cc(O[C@H]2CCN(C)C2=O)ccc1NC(=O)NNC(=O)c1n[nH]c2c1CCCC2	1325142145	AQPRQBBHWYLCBQ-KRWDZBQOSA-N	426.477	1.673	50	20	IDGD	
CNS(=O)(=O)c1ccc(Br)c(C(=O)NNC(=O)Cc2ccccc2F)c1	1338742235	JDMSGXPPAIYPJU-UHFFFAOYSA-N	444.282	1.500	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@@H]2CCOC3(CCOCC3)C2)c2ccccc2c1=O	1349004263	IWALWNRSMGHLAD-CQSZACIVSA-N	429.477	1.089	50	20	IDGD	
CC(C)CNC(=O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)Br)C2	1778117203	WXHNXUJFSUWYRP-HBUWYVDXSA-N	432.359	1.056	50	20	IDGD	
O=C(c1cn2ccsc2n1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1778628497	HNDUZAOEROVTNW-IAQYHMDHSA-N	431.287	1.530	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](F)Cl)CCO3)cc1NC(C)=O	1780211851	UTBJOXZDKWSOFB-QFBILLFUSA-N	427.860	1.632	50	20	IDGD	
COc1ccc(C2(C(=O)N3CC[C@]4(CN(C(=O)[C@H](O)CCl)CCO4)C3)CCC2)cc1	1781204193	HBKWJUAAHLISFQ-NQIIRXRSSA-N	436.936	1.547	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc4c(c3)CNC4=O)CCO2)C1	1781229492	DVHDVXGKNKPASA-WOJBJXKFSA-N	440.327	1.610	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)[C@@H]3CC[C@@H]4CCC(=O)N4C3)CCO2)C1	1781231064	GBUXOOMTVBSODF-IPZZXCBHSA-N	446.375	1.454	50	20	IDGD	
O=C(c1ccn(C(F)F)n1)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781330957	BIKMGJAGWUPIOA-IINYFYTJSA-N	425.205	1.412	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnccc1N(C)C)C2	1782171188	RYESWKZCSLQUDS-YRISNDGFSA-N	438.956	1.529	50	20	IDGD	
C[C@@H](C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)Br)C2)n1cncn1	1782534312	XYFAADIOXKWUAM-UMPJEAMMSA-N	428.331	1.136	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)Cn2ccnc2)C1	1782547344	NFVVGYRQFXTXQE-YYAJDYIMSA-N	441.370	1.817	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)Cn2ccnc2)C1	1782549990	ZXDOQGMFNHMIEE-TVKQPGBESA-N	426.945	1.287	50	20	IDGD	
O=C(C1CCN(c2ccc(F)cn2)CC1)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Cl)CCO2	1782797924	SEOGUCAUKUCSDO-PXNSSMCTSA-N	442.894	1.801	50	20	IDGD	
COc1cccc2c1C[C@H](C(=O)N1CC[C@]3(CN(C(=O)[C@H](O)CCl)CCO3)C1)CC2	1782986382	ZDGDKCBISZAOFT-RADWXHQJSA-N	436.936	1.230	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1CC(c3ccccc3)=NO1)CCO2	1783871042	MDVAWQMEZQAFOU-MDKPJZGXSA-N	435.908	1.263	50	20	IDGD	
Cc1cccc(C(=O)N2CCO[C@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)c1Cl	1783937357	GTFGOQLHDBJMKM-NRFANRHFSA-N	436.940	1.465	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CC[C@H]3CNc4ccccc4C3)C[C@@H]21)[C@@H](O)CCl	1784090237	VFAZPHIOPHESIP-SVZPGXKISA-N	449.979	1.630	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CCc4nc[nH]c4C3)C[C@@H]21	1786407720	NTHFYUCKSNZIMU-FHIRATQRSA-N	439.354	1.279	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3ccc(F)c(F)c3)[C@H]2C1	1786582323	ALSXFTQQBAAIIL-XSWJXKHESA-N	430.879	1.741	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC1(c2ccc(NC(=O)COc3cccnc3)cc2)CCC1	1786758939	JVSBINMWYPQBSP-UHFFFAOYSA-N	439.516	1.968	50	20	IDGD	
Cn1ncc(Br)c1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]2C1	1787446785	CLDPGPKSLUCJGB-LKAMGYQZSA-N	437.697	1.310	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC1(c2ccc(NC(=O)c3n[nH]cc3[N+](=O)[O-])cc2)CCC1	1789691664	LBIJKPRLSQHNJU-UHFFFAOYSA-N	443.464	1.439	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnn4ccccc34)C[C@@H]21)[C@@H](F)Br	1789922700	LMAOYKSCPOUXRE-DLKVLKDVSA-N	439.285	1.618	50	20	IDGD	
Cc1cnn([C@H](C)C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]3C2)c1	1789926981	MXXWUJGMHHUDBO-CAEXGNQWSA-N	431.306	1.423	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnn4c3CCC4)[C@H]2C1	1790388452	UOCBQJRMJUYRKG-RMRKRWHISA-N	439.354	1.454	50	20	IDGD	
Cc1nccn1[C@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]21	1791705261	UPYAPDGUKIICKN-NVTBQPJSSA-N	431.364	1.969	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(Cl)nc1	1792363821	UMIWFXWWQLESGL-DNVSUFBTSA-N	430.730	1.969	50	20	IDGD	
Cc1cc(Cl)ccc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc(B(O)O)c1)C2	1792737776	OCQCCFOTWIOKFB-REPLKXPHSA-N	426.709	1.894	50	20	IDGD	
COCCOCCOCCOCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C(C)(C)CCl	1792887308	KOVCPCNKOYFIGG-BCDXTJNWSA-N	448.988	1.586	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CSC(=N)N	1795949312	OFWGPFOOZGUHNY-CLLJXQQHSA-N	449.489	1.399	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1[nH]nc2ncccc12	1796213421	BIBDHGUCXUTUTA-NRWUCQMLSA-N	436.310	1.192	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(F)c(C)n1)C2	1796889737	DYVKAGDPRSJNFX-LCFLCXBCSA-N	440.479	1.915	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(F)nc1C)C2	1796891616	AFXWUKIGZOHFDH-LCFLCXBCSA-N	440.479	1.915	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc2c1OCC2	1797314398	ANFJXGDHMXTTDM-MUJYYYPQSA-N	435.484	1.186	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnn2cccnc12	1797369101	ZIDUKKOGTQZCLB-JPVZDGGYSA-N	426.304	1.169	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1cn2cc(F)ccc2n1	1797429720	MEQFXDWOKUKUTE-ANGCBRKESA-N	443.248	1.367	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CSCc1[nH]cnc1C	1797662748	JDXVAQKFQGPBOE-KRXQYRFLSA-N	428.986	1.948	50	20	IDGD	
CC[C@H]1CC[C@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)CC1	1797753884	JMPFJKUBLDVSBB-SMOZFGAISA-N	443.548	1.105	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1nccc(OC)c1OC	1798765042	OMGBEYRCHIOBID-HLPPOEQASA-N	425.913	1.710	50	20	IDGD	
CC1(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)CCCC1	1802620640	RPFSFYRZCCXGML-FPOVZHCZSA-N	435.333	1.661	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc3c[nH]nc3c2)[C@H]1c1cccnc1)[C@H](O)CCl	1803139710	UFJCQQQMZAIWJV-UHOSZYNNSA-N	427.892	1.877	50	20	IDGD	
CCOc1cnc(C(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]2c2cccnc2)cn1	1803139986	AICZUQFOGULKKT-QGPMSJSTSA-N	433.896	1.190	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)nc2nccn12	1803148022	NJSXSDYSCKVGQH-BPQIPLTHSA-N	442.907	1.352	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1)c1ccc[n+]([O-])c1	1804778719	AECZIWWKZSFWQS-YJBOKZPZSA-N	433.306	1.820	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2cc(OC)nn2C)[C@H]1c1cccnc1	1804929091	PGOCRKRXYAKJFM-RVKKMQEKSA-N	435.912	1.397	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc(O)cc2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807368110	YLNDGWFIHPCIBG-UGKGYDQZSA-N	445.284	1.100	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)CN2CCN(C(C)=O)CC2)[C@H]1c1cccnc1	1808264734	BXIUZXIOTQGMEG-ZJOUEHCJSA-N	449.983	1.269	50	20	IDGD	
C[C@]1(C(=O)N2CC[C@H](CNC(=O)[C@@H](F)Br)[C@H]2c2cccnc2)CCCN1	1808675494	BWKNOWKAJYWJSG-ATNYBXOESA-N	427.318	1.920	50	20	IDGD	
Cc1ccc(C(=O)N2CCC3(CCCN(C(=O)c4ccc(B(O)O)cc4)C3)CC2)cc1O	1809970042	ZQACZEKNUVWIIC-UHFFFAOYSA-N	436.317	1.539	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)CC(F)(F)C(=O)O)[C@@H]1c1cccnc1	1813031096	OAQKRKSPNQDLAW-KCQAQPDRSA-N	433.839	1.451	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1cc(C2CC2)on1	1814624980	GKOIROMSZLYQBS-SFHVURJKSA-N	449.276	1.575	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)C1(F)CCCCC1)CC2)c1cccc(B(O)O)c1	1815356297	AXWPTUPISFVJKG-HNNXBMFYSA-N	445.325	1.721	50	20	IDGD	
Cc1cc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)ccn1	1819752051	GQJRVUXUKPORLN-LJQANCHMSA-N	433.277	1.413	50	20	IDGD	
CNc1nsnc1C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1	1822998868	JDGIVSPLUDQIIT-SSDLBLMSSA-N	449.331	1.953	50	20	IDGD	
CC[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H]1CCC(=O)N1)CC2	1825445249	QORJBGJQLPWDAA-FXPVBKGRSA-N	429.340	1.507	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnc(O)[nH]1)CC2	1825450755	VUANVYBLDGBMQO-SFYZADRCSA-N	428.312	1.971	50	20	IDGD	
CC(C)O[C@H](C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1	1828924102	ISSFLIFDDFPRAT-UZLBHIALSA-N	445.564	1.732	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)cn1	1831952981	PQKABZRLASENCY-OALUTQOASA-N	446.331	1.397	50	20	IDGD	
O=C([C@@H](F)Cl)N1CCC(N2CCC(NC(=O)C(F)(F)C(F)(F)C(=O)O)CC2)CC1	1833660776	LDBJAFUQWRHZOU-LLVKDONJSA-N	449.804	1.448	50	20	IDGD	
Cc1cc(CCC(=O)NC2CCN(C3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)ccn1	1833744117	ADBKXVNAJJDPJV-FQEVSTJZSA-N	436.984	1.494	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)c3ccc(F)nc3)C2)C1	1834823362	PZTJYIWWFJVIPC-QGZVFWFLSA-N	430.274	1.076	50	20	IDGD	
C[C@H](Cc1ccco1)C(=O)N1CCOC[C@]2(CN(C(=O)CCBr)CCO2)C1	1834826685	TWMJEDZTEHASSW-BEFAXECRSA-N	443.338	1.700	50	20	IDGD	
Cn1nc(C(=O)NC2CCN(C3CCN(C(=O)[C@H](F)Cl)CC3)CC2)c2c1CCC2	1835395762	MMGRGIVROXKJLF-SFHVURJKSA-N	425.936	1.628	50	20	IDGD	
CC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)[C@H](C)N3C[C@H]4C[C@H]4C3)CC2)CC1	1836397354	YCCOHKZSVMEMFZ-LJCCNALRSA-N	425.017	1.916	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cc(F)cc(F)c3)C2)C1	1839144314	VEVHLJLSCCMRPD-FXAWDEMLSA-N	430.879	1.981	50	20	IDGD	
COc1ncccc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2	1839151208	KVBJSPPDUNSYFU-MOPGFXCFSA-N	446.331	1.397	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccc(F)c(C#N)c3)CCO2)C1	1839187517	HPDYHAYOZIQZGG-DYESRHJHSA-N	437.899	1.714	50	20	IDGD	
Cc1cccnc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839198605	KGDSTTGPMQAOEJ-RHSMWYFYSA-N	430.274	1.151	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnc4ccc(F)cn34)CCO2)C1	1839592545	MHIBAJHAYPGYFB-MGPUTAFESA-N	438.887	1.561	50	20	IDGD	
Cc1nc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)ccc1F	1840031037	DNHRHVKAKPYXBC-KPZWWZAWSA-N	444.301	1.383	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CCc3ccccc3O1)CCO2	1840137994	FVTGPRWZVJBXQN-KPLVRAHFSA-N	436.936	1.854	50	20	IDGD	
CCc1ncsc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](Cl)COC)CCO2	1840154007	HVUHAZJJYCMKCE-SCLBCKFNSA-N	431.942	1.029	50	20	IDGD	
C[C@H](NNc1ccccc1)C(=O)N1CCOC[C@]2(CN(C(=O)C(Cl)Cl)CCO2)C1	1840186570	AXCMFNGIGYYSJS-IFXJQAMLSA-N	445.347	1.252	50	20	IDGD	
COc1ccc(C)c(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)c1	1840189474	SXUWQNDFYARDHP-LJQANCHMSA-N	431.316	1.877	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3cnccn3)CCO2)C1	1840458058	JAXDBODGROVGDH-RBUKOAKNSA-N	445.347	1.102	50	20	IDGD	
O=C(c1n[nH]c2ccc(Br)cc12)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1	1841350558	JYBBFWFKLKVWHH-ZDUSSCGKSA-N	441.713	1.742	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2n[nH]c3ccccc23)C1	1844055525	DIXMWBVPXDZLJL-ZVHZXABRSA-N	433.472	1.514	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)c2cccc(C(F)(F)F)c2)C1	1844918874	KMWLFEQIBUTDNG-UHFFFAOYSA-N	426.439	1.895	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@H]1CC(=O)N(Cc3cccs3)C1)C2	1846360985	RBTWFZZYFJOWKD-GOEBONIOSA-N	439.965	1.554	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H](C(=O)N2CC3(CCCN3C(=O)C(Cl)Cl)C2)[C@@H](O)C1	1846388513	PHRKEGZJLAKCMW-RYUDHWBXSA-N	436.336	1.221	50	20	IDGD	
CC(=O)N[C@H](Cc1cccc(F)c1)C(=O)N1CC2(CCCN2C(=O)C(Cl)Cl)C1	1846389512	WWJZEUGDIFEHOW-OAHLLOKOSA-N	430.307	1.880	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc(=O)cco1	1848095763	MYMLNXZDXIQHID-KKUMJFAQSA-N	439.896	1.587	50	20	IDGD	
Cc1nn(C)c(C)c1CC(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	10634599	ZXAFCBABCZQOSX-UHFFFAOYSA-N	444.499	1.742	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)CC[C@@H]2Cc3ccccc3NC2=O)c1	14260574	XXEJODFTBDGCBK-MRXNPFEDSA-N	444.513	1.289	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)CN2C(=O)c3cccc([N+](=O)[O-])c3C2=O)cc1C	15886637	LAMZTAKYRSTSGO-UHFFFAOYSA-N	426.385	1.034	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=O)c2ccc(OC)c(OC)c2)n(C)c1	16230097	USVMUYNLOFSKCY-UHFFFAOYSA-N	438.506	1.148	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)c1ccc(CNC(N)=O)cc1	23785715	IRELSBCPTGUNCD-LLVKDONJSA-N	435.278	1.846	50	20	IDGD	
COc1cccc(C=NNC(=O)CN2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)c1O	254866174	BATKFAOLYZTGFQ-UHFFFAOYSA-N	446.529	1.166	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)CN2C(=O)Cn3c(cc4ccccc43)C2=O)cc1	725890433	QMHFAIXLSGANDB-UHFFFAOYSA-N	434.452	1.413	50	20	IDGD	
CC1CCN([C@H](CNC(=O)NNC(=O)CNC(=O)c2ccco2)c2ccccc2)CC1	726236803	MSASZYIPAPPGJD-GOSISDBHSA-N	427.505	1.813	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC(C(=O)NNc3nc(-c4ccncc4)no3)CC2)cc1	726370721	JVRBHSJNGPHNPL-UHFFFAOYSA-N	442.501	1.984	50	20	IDGD	
Cc1nc2n(n1)C[C@H](NC(=O)NNC(=O)[C@@H](C)Oc1cccc(Br)c1)CC2	727230014	YLFVWGNHXRFMES-ZWNOBZJWSA-N	437.298	1.462	50	20	IDGD	
COc1nc(C)cc(C)c1CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	727605773	WPJKQRWCCNHVTD-UHFFFAOYSA-N	435.506	1.102	50	20	IDGD	
CC(=O)N1CCc2ccccc2[C@@H]1CC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	728000015	JOPCADDXPIJWEH-IBGZPJMESA-N	433.468	1.231	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)NCc2c[nH]nc2C)cc1	728191253	WAOCAFGFLNMQLZ-SXGWCWSVSA-N	433.472	1.689	50	20	IDGD	
COc1cccc(N2CC[C@@H](NC(=O)NNC(=O)c3csc(N4CCOCC4)n3)C2)c1	728221093	OEEMIPKAIFOXOR-CQSZACIVSA-N	446.533	1.211	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)N1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1	728951296	FZEXPIQYZKSGAV-RKDXNWHRSA-N	430.305	1.813	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)c2ccc(S(=O)(=O)N3CCCCC3)cc2)cn1	729692894	XIQUFSCGZRTSME-UHFFFAOYSA-N	449.558	1.896	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)c1ccc2c(=O)n3c(nc2c1)CCC3	730074378	CCROZJNZNMGKSF-UHFFFAOYSA-N	439.497	1.540	50	20	IDGD	
Cc1cc(S(C)(=O)=O)c(C)c(S(=O)(=O)NNC(=O)c2ccc3c(c2)OCCO3)c1	730203453	QVPZMZAGTRIWDA-UHFFFAOYSA-N	440.499	1.101	50	20	IDGD	
O=C(O)c1cc(Cl)c(Cl)c(S(=O)(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1	731338975	MQYRPWXCKDJARE-GFCCVEGCSA-N	447.252	1.841	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2ccc(S(=O)(=O)CCCC#N)cc2)C[C@H](C)O1	732263400	MAZNRGPEQFJPBL-HOTGVXAUSA-N	436.534	1.024	50	20	IDGD	
O=C(CNC(=O)N1CCc2ccccc2C1)NNc1ccc(S(=O)(=O)NC2CC2)cc1	732282421	OTZGTMHPEVGKIN-UHFFFAOYSA-N	443.529	1.338	50	20	IDGD	
N#Cc1ccc(N2C(=O)N[C@@H](CCC(=O)NNC(=O)COc3ccccc3F)C2=O)cc1	733774486	OTMHRWZAAXQHRF-INIZCTEOSA-N	439.403	1.129	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)CC(=O)NNC(=O)c2cccc(OC(F)F)c2)cc1F	734814727	XIEMLVQKALPSRG-UHFFFAOYSA-N	444.387	1.865	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)c1ccc2c(c1)CCN2C(=O)CNC(C)=O	735687959	VTHPJIMGBNGPCO-UHFFFAOYSA-N	438.484	1.114	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)N1CCCN(C(=O)c2ccc(F)cc2)CC1	738496739	WMKFUPWWMJAVLI-UHFFFAOYSA-N	428.464	1.931	50	20	IDGD	
Nc1c(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cccc1C(F)(F)F	741004545	WXNZSBDMAAMGHE-AWEZNQCLSA-N	439.346	1.432	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)NC1CCN(S(=O)(=O)c2cnn(C)c2)CC1)c1ccccc1	741279605	YZCRNGRXQAGRLQ-SFHVURJKSA-N	448.549	1.097	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NN=C2CCCC[C@@H]2S(C)(=O)=O)c1	741451132	CKTNLPCPZKCWGP-KRWDZBQOSA-N	429.564	1.790	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN(C(=O)c2ccncc2)C1)c1nn(-c2ccccc2)cc1O	743292681	ICVWPJPVUAZSMZ-MRXNPFEDSA-N	434.456	1.286	50	20	IDGD	
CCNC(=O)c1cccc(CNC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)c1	743558307	ZTSBXUYLASPIJK-UHFFFAOYSA-N	433.490	1.376	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)C1(c2ccccc2)CCOCC1	744621446	XGGUSZGDIQTNIJ-UHFFFAOYSA-N	445.541	1.899	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)c1	744734739	OMEXSTFKFAVYLT-UHFFFAOYSA-N	434.368	1.270	50	20	IDGD	
COc1cc(C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)c(N)cc1OC(F)F	744751167	CMAZWVLDUUGCCI-UHFFFAOYSA-N	434.355	1.368	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)CCC(=O)N2CCc3sccc3C2)c1	744837432	QFBOHYSACWJWPC-UHFFFAOYSA-N	440.481	1.289	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)[C@H](C)N2CCN(c3ccc(F)cc3)CC2)c1	745055245	NUAKXAAOVZDYHM-KRWDZBQOSA-N	442.491	1.649	50	20	IDGD	
Cc1ccc(F)c(NC(=S)NNC(=O)CN2C(=O)N[C@]3(CCc4ccccc43)C2=O)c1	745195375	CXBXDGVCFFOSGJ-NRFANRHFSA-N	441.488	1.845	50	20	IDGD	
Cc1ccc(CN2C(=O)CC[C@H]2C(=O)OCC(=O)NNC(=O)Cc2nc(C)cs2)cc1	745592187	JMTCBEDVHYBWTL-INIZCTEOSA-N	444.513	1.184	50	20	IDGD	
CN(C)C(=O)[C@@H]1CCC[C@H](NC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)C1	745824640	KNZXMFVJIHXWOK-OCCSQVGLSA-N	425.511	1.073	50	20	IDGD	
COc1cc(C)nc(NNC(=O)c2ccc(S(=O)(=O)N(C)C)c(Br)c2)n1	746633417	SWMAXFQHQTYAHR-UHFFFAOYSA-N	444.311	1.563	50	20	IDGD	
COc1cc(C)nc(NNC(=O)[C@@H](C)N2C(=O)c3ccc(Br)cc3C2=O)n1	746634412	DHAGFOIIQLIEMT-SECBINFHSA-N	434.250	1.684	50	20	IDGD	
Cc1ccc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1Br	747048965	XXRZPWHDHIAJCT-INIZCTEOSA-N	449.257	1.902	50	20	IDGD	
Cc1c(Br)cccc1S(=O)(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	747597409	VOAAULHBHOHVMA-UHFFFAOYSA-N	437.279	1.357	50	20	IDGD	
CC(=O)NCc1ccc(S(=O)(=O)NCC(=O)NNc2ccc(F)c(F)c2F)s1	748214999	QWAXSYFVQGRJJC-UHFFFAOYSA-N	436.437	1.223	50	20	IDGD	
Cc1cc(N2CCC(NC(=O)NNC(=O)COc3ccccc3[N+](=O)[O-])CC2)nc(C)n1	749619201	YTWXUAHYJUZJDY-UHFFFAOYSA-N	443.464	1.380	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)CNS(=O)(=O)c1ccc(Cl)s1	749838734	WGVIRXVAULFNJS-SECBINFHSA-N	435.886	1.434	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CC[C@H]3CC[C@@H](C2)N3C(=O)OC(C)(C)C)n1	750063557	VRYFFPUQCTTYCA-CABCVRRESA-N	437.566	1.615	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(/C#N)C(=O)NCCNS(=O)(=O)Cc2ccon2)c1C	750075216	AXTZLXROWKZYIR-PACYTGELSA-N	449.533	1.443	50	20	IDGD	
O=C(NNc1nc(Br)cn2ccnc12)c1cn(-c2cccc([N+](=O)[O-])c2)nn1	750247763	UAPUNVFZJZJWIT-UHFFFAOYSA-N	444.209	1.738	50	20	IDGD	
O=C(CCNC(=O)c1n[nH]c2ccccc12)NNc1nc(Br)cn2ccnc12	750249327	FKJWEGVCJZNARY-UHFFFAOYSA-N	443.265	1.631	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)[C@H]1CCCCN1C(=O)OCc1ccccc1	751204287	ZNCRATWRNGGNJI-MRXNPFEDSA-N	428.445	1.348	50	20	IDGD	
C[C@@H]1C[C@H](CNC(=O)OC(C)(C)C)CN1CC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	752071988	GHJCLGHIUFVAOA-ZIAGYGMSSA-N	435.481	1.591	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(Cl)c(C(=O)NNc2nc3ccccc3c(=O)n2C)c1	752909403	VQXZTIMZFYJQLW-UHFFFAOYSA-N	435.893	1.594	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)N[C@@H]1CCCN(c2cccnc2)C1=O	753355207	DAAAIJAIOKIDRG-MRXNPFEDSA-N	435.444	1.113	50	20	IDGD	
CS(=O)(=O)NCc1ccc(C(=O)NNC(=O)COc2ccccc2-c2ccccc2)o1	753563470	NSOUQCVQNNPCAY-UHFFFAOYSA-N	443.481	1.836	50	20	IDGD	
C[C@@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(NC(=O)NNC(=O)c3cnccn3)cc2)C1	755419419	CZYSFKPFGQJPGY-ZIAGYGMSSA-N	432.506	1.610	50	20	IDGD	
Cc1cccc(NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c1C(=O)N1CCCC1	755805286	WHQVKABWKHSMBO-UHFFFAOYSA-N	434.460	1.673	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)Nc2ccc(CC(=O)N3CCOCC3)cc2)cc1	755862556	SGFQDXMQYLSGNP-UHFFFAOYSA-N	426.473	1.628	50	20	IDGD	
CC(C)CNC(=O)c1ccc(NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1	756015186	RZOJZVUBLZTAHP-UHFFFAOYSA-N	439.520	1.932	50	20	IDGD	
CC(C)(C)OC(=O)Nc1ccc(CCNC(=O)NN[C@]2(C)CCS(=O)(=O)C2)cc1	756138916	ZLVFLKXLXSAVIU-LJQANCHMSA-N	426.539	1.957	50	20	IDGD	
O=C(COC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12)NNC(=O)[C@@H]1COc2ccccc2O1	756765292	GXUSAOOQYOYHRF-KRWDZBQOSA-N	440.368	1.220	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N[C@H]2CN(C(=O)OC(C)(C)C)C[C@H]2C#N)cc1OC	758753112	DHJAMTQBENIGEV-KGLIPLIRSA-N	433.465	1.407	50	20	IDGD	
CCNS(=O)(=O)c1ccc(CC(=O)NNC(=O)c2ccc(OCC)c(OC)c2)cc1	759357711	PZTRROJBBJTYMV-UHFFFAOYSA-N	435.502	1.396	50	20	IDGD	
CCNS(=O)(=O)c1ccc(CC(=O)NNC(=O)CSc2ccccc2OC)cc1	759389857	SVSYWPKAHVKUQM-UHFFFAOYSA-N	437.543	1.476	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)CCNS(=O)(=O)/C=C\c1ccccc1	761632845	DWZONGLFZAVQJZ-OWBHPGMISA-N	449.554	1.915	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)c1ccc(=O)n(-c2ccc(F)cc2)n1	762373347	MZXLWOBAPJEFTQ-UHFFFAOYSA-N	428.445	1.934	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)[C@@H]2Cc3ccccc3CN2C(C)=O)n[nH]1	763152479	HADGLUGTSGSPSY-FQEVSTJZSA-N	433.468	1.820	50	20	IDGD	
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)NNC(=O)CCCNC(=O)OC(C)(C)C	763439361	MPKQJIRNXNKMRX-UHFFFAOYSA-N	432.455	1.218	50	20	IDGD	
O=C(NNC(=O)c1ccccn1)C(=O)Nc1ccc(N2CCOCC2)cc1C(F)(F)F	763467877	UVOCJYMGGBYMNL-UHFFFAOYSA-N	437.378	1.337	50	20	IDGD	
O=C(NNC(=O)c1cccnc1)C(=O)Nc1cc(F)c(I)c(F)c1	763494759	IRPPCRCWJIALSK-UHFFFAOYSA-N	446.151	1.364	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(CN3CCCCC3=O)c2)cc1	763681686	MFALYUPBFZZZNJ-UHFFFAOYSA-N	449.467	1.236	50	20	IDGD	
CS(=O)(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)CC23CC4CC(CC(C4)C2)C3)cc1	763732258	DNZZVDJQNARGPJ-UHFFFAOYSA-N	447.557	1.924	50	20	IDGD	
CCOc1cc(C)ccc1NC(=O)C(=O)NNC(=O)c1nn(CC)c(=O)c2ccccc12	763785004	ABOVTFQGGJPRKC-UHFFFAOYSA-N	437.456	1.523	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)cnc1Cl	763791494	SXRGIYAEJSKBGT-UHFFFAOYSA-N	442.863	1.734	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccccc1CN1CCOCC1	763852403	XBOGOGULFKAKPK-HNNXBMFYSA-N	444.463	1.211	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(C(=O)OC)c2)cc1OC	763911857	OSDCLCZMDBFHDQ-UHFFFAOYSA-N	429.429	1.670	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(C)n([C@H](C)C3CC3)n2)cc1OC	763912814	VNVYZEKNBOCAHF-CYBMUJFWSA-N	429.477	1.970	50	20	IDGD	
CN(C)CCn1ccc(NC(=O)C(=O)NNC(=O)c2ccc(-c3ccc(F)cc3)s2)n1	763976180	UDMFBMCMBWHFPQ-UHFFFAOYSA-N	444.492	1.712	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccnn2Cc2ccccc2F)c1O	764130874	AVNDVGAEWVPLJP-UHFFFAOYSA-N	427.392	1.184	50	20	IDGD	
COc1cc(Br)cc(NC(=O)C(=O)NNC(=O)c2cccc(OC)c2O)c1	764133906	ZCLIWSLPFVCCDH-UHFFFAOYSA-N	438.234	1.572	50	20	IDGD	
Cc1ccc2cccc(NC(=O)C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)c2n1	764202446	CQRGTZSXUNTOJT-UHFFFAOYSA-N	429.477	1.934	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)C(=O)Nc1ccnc(OCC(F)(F)F)c1	764239805	VWLBRJZVXGHWOD-UHFFFAOYSA-N	435.362	1.764	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2O)n([C@@H]2C[C@H]3CC[C@H]2C3)n1	764276919	FEJVYSUGCUEYIA-SOUVJXGZSA-N	427.461	1.423	50	20	IDGD	
CCNC(=O)N1CCc2ccc(NC(=O)C(=O)NNC(=O)C(C)(C)c3ccccc3)cc21	764309090	LEBXRMCIPNJTPK-UHFFFAOYSA-N	437.500	1.842	50	20	IDGD	
CC(C)(C(=O)NNC(=O)C(=O)Nc1cc(F)c(S(C)(=O)=O)c(F)c1)c1ccccc1	764314633	WXZMOKADKPHJSC-UHFFFAOYSA-N	439.440	1.432	50	20	IDGD	
Cc1nc(-c2ccccc2NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)no1	764351240	PUVKHLGGEYMTAA-UHFFFAOYSA-N	431.412	1.630	50	20	IDGD	
C[C@@H](c1ccc(NC(=O)C(=O)NNC(=O)COCc2ccccc2)cc1)N1CCOCC1	764368351	VHPAXWXTDLSRHB-KRWDZBQOSA-N	440.500	1.383	50	20	IDGD	
COc1ccccc1CSc1ccccc1NC(=O)C(=O)NNC(=O)[C@@H]1COCCO1	764423542	BGMYGDOHIUXDGH-KRWDZBQOSA-N	445.497	1.489	50	20	IDGD	
COc1nccnc1NNC(=O)c1cc(S(=O)(=O)NC2CC2)ccc1Br	764463619	HYHPXTZOYSWGKR-UHFFFAOYSA-N	442.295	1.445	50	20	IDGD	
CN(CC(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1)[C@@H]1CCSC1	764753590	YUSVLDVNFBBMEK-QGZVFWFLSA-N	440.013	1.042	50	20	IDGD	
Cc1cc(S(=O)(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cc(C)c1F	765119143	QYBABRPBSMHNTM-UHFFFAOYSA-N	448.520	1.210	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)/C=C\c3ccc([N+](=O)[O-])cc3)CC2)cc1	765749820	UIDKERLFIGWTFF-FLIBITNWSA-N	437.500	1.882	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CN2CCNC(=O)[C@@H]2c2cccc(Br)c2)cc1	766251358	QKXXKSGUJSOIDZ-SFHVURJKSA-N	445.317	1.692	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1ccc(CC(=O)Nc2ccccc2F)cc1	766264055	DKZJCBDMXGTJGF-UHFFFAOYSA-N	438.419	1.887	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1cccnc1Br	766642906	OQGAPHFXAWNYNN-UHFFFAOYSA-N	446.305	1.063	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)c1cccc2c1OCO2	766668036	GPGICRQJMBFHGQ-UHFFFAOYSA-N	430.892	1.648	50	20	IDGD	
O=C(Cc1n[nH]c2ccccc12)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	766668073	HMIYIALMZQXYBG-UHFFFAOYSA-N	440.935	1.724	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)c2cc(S(=O)(=O)N(C)C)ccc2O)cc1OC	766969509	VQIKTZRPRDRLCH-UHFFFAOYSA-N	437.474	1.125	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)C[C@H](c1ccccc1)N1CCOC1=O	767329870	NXCNPSUMLNDSDN-LJQANCHMSA-N	439.468	1.812	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](OCC(=O)OCC(=O)NNC(=O)c2ccccc2)C1	768066390	VLQQAGWVVUNJMZ-INIZCTEOSA-N	435.477	1.407	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)[C@H](C)S(=O)(=O)C3CCOCC3)n[nH]2)c1	768265578	ZQKTXIXAVSNPJB-AWEZNQCLSA-N	434.518	1.437	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)c1cc(S(N)(=O)=O)cc(C)c1C	768629332	IVVDCBSNHKDLPK-UHFFFAOYSA-N	427.504	1.120	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)c3cccc([C@@]4(C)NC(=O)NC4=O)c3)n[nH]2)c1	769282680	YZZRYNSIARGIIV-HSZRJFAPSA-N	446.467	1.823	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)c3cccc([C@]4(C)NC(=O)NC4=O)c3)n[nH]2)c1	769282681	YZZRYNSIARGIIV-QHCPKHFHSA-N	446.467	1.823	50	20	IDGD	
CSCCNC(=S)NNC(=O)CSCc1nc(O)c2c3c(sc2n1)CCC3	769769412	LDHRYCYLFCBTPO-UHFFFAOYSA-N	443.645	1.977	50	20	IDGD	
CC(C)[C@H](CNC(=O)NNc1nc(O)c2cnn(C(C)(C)C)c2n1)N1CCN(C)CC1	770342905	WGSMOGWATQGHMB-HNNXBMFYSA-N	433.561	1.185	50	20	IDGD	
Cc1cc2c(N3CCC[C@H]3C(=O)NNC(=O)CCN3C[C@H](C)O[C@H](C)C3)ncnc2s1	770949219	CCXJDGAHOFATAL-VBQJREDUSA-N	446.577	1.615	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)CCNS(=O)(=O)c1c(Cl)cccc1Cl	771940060	NDNVQYUIMOZTOY-VIFPVBQESA-N	440.305	1.151	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2c[nH]c3ccc(I)cc3c2=O)n[nH]1	772837329	NEBWCMNZTSFKCE-UHFFFAOYSA-N	437.197	1.239	50	20	IDGD	
O=C(NNc1ncccn1)C(=O)Nc1ccc(NC(=O)[C@H]2CCCO2)cc1C(F)(F)F	773723502	AXIWLGXEMHMIDV-CYBMUJFWSA-N	438.366	1.695	50	20	IDGD	
CC(C)c1nccnc1NNC(=O)C(=O)Nc1ccc(I)cn1	773993659	ZTBINRVUUULZHN-UHFFFAOYSA-N	426.218	1.681	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)cc1C	774003243	WCBSNFNPEKLBOA-GFCCVEGCSA-N	433.848	1.988	50	20	IDGD	
Cc1cc(CNC(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)ccc1S(N)(=O)=O	775226118	QMFGJMKLNQJILX-HNNXBMFYSA-N	434.518	1.557	50	20	IDGD	
CCCOc1ccc(C(=O)NNS(=O)(=O)c2cnn(CC(F)(F)F)c2)cc1OC	775251912	FMEFFMAWDKHIPN-UHFFFAOYSA-N	436.412	1.866	50	20	IDGD	
O=C(Cc1ccc2ccccc2c1)NNC(=O)N[C@@H]1CCO[C@]2(CCS(=O)(=O)C2)C1	776074114	WZNYOZLXVNMPCW-WIYYLYMNSA-N	431.514	1.449	50	20	IDGD	
CCOC(=O)N1CCC(C(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)CC1	776201017	DLIACKSCPBBYJD-UHFFFAOYSA-N	441.529	1.491	50	20	IDGD	
COc1cc(C(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)cc(OC)c1O	776201561	JKXIWEOSPURRMI-UHFFFAOYSA-N	438.481	1.659	50	20	IDGD	
Cc1cc(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)c(C)o1	776271470	DPWFSKYEPSKLPC-UHFFFAOYSA-N	441.531	1.694	50	20	IDGD	
COCCO[C@@H]1COCC[C@H]1NC(=O)CCC(=O)C(C#N)=C1N(C)c2ccccc2N1C	777395175	UYJDELJKBYMWDQ-DYESRHJHSA-N	442.516	1.594	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NCC(=O)NNc2ccc3ccccc3n2)c1	777533557	WOTLZERRRKHSFK-UHFFFAOYSA-N	427.486	1.358	50	20	IDGD	
O=C(CN1CCCC[C@H]1C(=O)Nc1ccc2c(c1)CCO2)NNC(=O)c1cccs1	777618710	BZWRMWPCSFKZBV-INIZCTEOSA-N	428.514	1.937	50	20	IDGD	
CN(CC(=O)NNC(=O)c1cccs1)[C@@H](C(N)=O)c1cccc(Br)c1	777723256	GEVALISVPNWWMU-CQSZACIVSA-N	425.308	1.430	50	20	IDGD	
C[C@@H]1CCN(C(=O)OC(C)(C)C)[C@H](C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)C1	778298899	DBJQFNPCOPKJTI-CJNGLKHVSA-N	429.481	1.459	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)c2ccc(S(=O)(=O)N(CC)CC)cc2)nc1C	778435462	GZBHMNWANBJLLJ-UHFFFAOYSA-N	435.506	1.749	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccccc1S(=O)(=O)NC1CC1)c1cccc(Cl)c1	780366413	UEZICHZURZGODA-UHFFFAOYSA-N	429.907	1.404	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)NNC(=O)c2ccc(C#N)cc2)cc1Br	780383994	YPNIFUAOXVEFSY-UHFFFAOYSA-N	437.275	1.902	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H]2CC[C@@H](C1)N2CC(=O)NNC(=O)c1cccc(C#N)c1	782511644	CPOCAERFZYPWOU-MSOLQXFVSA-N	427.505	1.793	50	20	IDGD	
CCCc1nc(C)c(NC(=O)C(=O)NNC(=O)c2csc(N3CCOCC3)n2)s1	782895894	AMPHUZKXWFJSPL-UHFFFAOYSA-N	438.535	1.097	50	20	IDGD	
CCCOc1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)CNC(=O)c1cccs1	784004294	DVTUYLDLAKSFSZ-UHFFFAOYSA-N	438.893	1.706	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2ccc(OCC(F)(F)F)cc2)n(-c2ncccn2)n1	784368566	KHAJKDWPIVHZPL-UHFFFAOYSA-N	435.366	1.994	50	20	IDGD	
O=C(NNc1ccc(F)cc1Br)C(=O)Nc1cc(-n2cnnn2)ccc1F	784802489	HIISNMQRJGFQRO-UHFFFAOYSA-N	438.192	1.785	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNc2ccc(F)c(F)c2F)cc1C(=O)OC	784814547	YDAJPUOLMMEIRP-UHFFFAOYSA-N	425.319	1.759	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)[C@@H]1[C@H](C(F)(F)F)[C@H]2CC[C@H]1O2	785443417	XFBPBXYAXPRRJD-ZAWLATJESA-N	440.466	1.702	50	20	IDGD	
Cc1cccc(NS(=O)(=O)c2ccc(C)c(C(=O)NNC(=O)N3CCN(C)CC3)c2)c1	788169507	PXUHKOMETQXQBZ-UHFFFAOYSA-N	445.545	1.706	50	20	IDGD	
Cc1cc(-n2cccn2)ccc1NC(=O)C(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	789585120	XGLIPCSEGKVKDP-UHFFFAOYSA-N	445.439	1.472	50	20	IDGD	
O=C(CCOCC(F)F)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	790254681	SMBABEAMLPYVMR-UHFFFAOYSA-N	430.415	1.821	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)c(F)c1	790387848	VIEBABILXSQQKT-UHFFFAOYSA-N	434.449	1.748	50	20	IDGD	
O=C(NNc1nc2ccccn2n1)[C@@H]1CCCCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1	791243383	RLLBVGWUCOGOGB-HNNXBMFYSA-N	445.461	1.324	50	20	IDGD	
Cc1cccc(=O)n1C[C@](C)(O)C(=O)NNC(=O)c1ccc(F)cc1Br	792065858	CZPHEFTYMINEQH-KRWDZBQOSA-N	426.242	1.271	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)Cn2c(CS(C)(=O)=O)nc3ccccc32)c1	792167309	LOLYDJMOUCIWAM-UHFFFAOYSA-N	429.502	1.108	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNc2nc3ccccn3n2)cc(OC)c1Br	792394071	MMNIEOXTNFWDHJ-UHFFFAOYSA-N	435.238	1.591	50	20	IDGD	
COc1cc(C(F)(F)F)ncc1NC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	792511269	ANCKWRCYCJKZQO-UHFFFAOYSA-N	432.380	1.979	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)c1cccc(NN2C(=O)[C@@H]3CC=CC[C@H]3C2=O)c1	793553272	DBOZWVCVAQWKKP-IAGOWNOFSA-N	441.488	1.031	50	20	IDGD	
CCc1cccc(C)c1NNC(=O)C(=O)Nc1ccc(S(=O)(=O)N(C)C)c(OC)c1	799842679	UBTOJYVLZLCYPB-UHFFFAOYSA-N	434.518	1.898	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CN2CCN(c3cc(C(F)(F)F)ccn3)CC2)c1	801542723	ZVAKEAHZPPORCE-UHFFFAOYSA-N	432.406	1.555	50	20	IDGD	
Cn1ncc(C(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)c1Cc1ccccc1	802063866	RJNAYEMJWRJRNF-UHFFFAOYSA-N	427.486	1.881	50	20	IDGD	
COc1ccc(Cl)c(NC(=O)NNC(=O)c2cnc3c(c2)c(O)nc(=O)n3C2CC2)c1	802111836	RZLXBPZIGHZCEU-UHFFFAOYSA-N	444.835	1.961	50	20	IDGD	
O=C(NC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1)NNC(=O)c1cnn(-c2ccccc2)c1	802336032	UDWXDTWSGQDSMH-LJQANCHMSA-N	446.467	1.944	50	20	IDGD	
COc1ccc(C2=NO[C@@H](CNC(=O)NNC(=O)COc3ccccc3C#N)C2)cc1C	802354205	LUEPEHUAFRMFAQ-QGZVFWFLSA-N	437.456	1.778	50	20	IDGD	
NS(=O)(=O)N1CCC(C(=O)NNc2ccc(-c3cccc(C(F)(F)F)c3)nn2)CC1	804206142	FAYVXKPDPRQXRK-UHFFFAOYSA-N	444.439	1.521	50	20	IDGD	
N#Cc1ccc(OC2CCN(C(=O)NNC(=O)CNC(=O)c3ccco3)CC2)c(F)c1	805043284	HLIHGXLOXMMLFW-UHFFFAOYSA-N	429.408	1.304	50	20	IDGD	
O=C(NC[C@H](N1CCOCC1)C(F)(F)F)NNC(=O)c1cnn(-c2ccccc2)c1	805110501	WMELZEZDUFVEAK-HNNXBMFYSA-N	426.399	1.079	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)[C@@]2(C)CC(c3ccccc3Cl)=NO2)c2ccccc2c1=O	806272920	NBJGZSPCKFLDTL-OAQYLSRUSA-N	439.859	1.931	50	20	IDGD	
Cc1cc2ccc(C(=O)NNc3ccc(S(=O)(=O)N4CCN(C)CC4)cc3)cn2c1	806782774	WWJMGZSAINQCQF-UHFFFAOYSA-N	427.530	1.941	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)C(=O)N=c1ccnc2n(C)[nH]cc1-2	806975304	TUTXCTZCBCFZAP-ZDUSSCGKSA-N	432.440	1.048	50	20	IDGD	
COc1ccc(Cn2ncc(C)c2NC(=O)C(=O)NNc2cccc(F)n2)cc1OC	807392189	IRQPZZXSZJFZJJ-UHFFFAOYSA-N	428.424	1.873	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)NC[C@H](N1CCOCC1)C(F)(F)F	807540434	UTGCEBXRVZIKBY-AWEZNQCLSA-N	436.456	1.381	50	20	IDGD	
C[C@@H](CCOCc1ccccc1)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	807607756	RVHXDOXBACJTDO-INIZCTEOSA-N	448.545	1.876	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)[C@H]1C[C@@H](c2ccccc2)OC1=O	808589274	CVIPQEGFWAAKFV-WBVHZDCISA-N	446.843	1.957	50	20	IDGD	
C[C@@H](NC(=O)c1cccs1)C(=O)NNC(=O)COc1ccc(Br)cc1	813287961	MALGDASZXYXOTH-SNVBAGLBSA-N	426.292	1.855	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)c2cnn(C)c2I)c1C	814736560	RWVSBNFNKVUOLI-LLVKDONJSA-N	442.257	1.870	50	20	IDGD	
O=C(Cc1cc(O)nc(O)n1)NN=C1CC(C(=O)O)(c2cccc(Br)c2)C1	814859831	BVAHWKIRLHUMNU-UHFFFAOYSA-N	435.234	1.481	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)cc1)[C@@H]1C[C@@H]1C	815564422	IKSQBUUZOYZGOT-YVEFUNNKSA-N	438.440	1.576	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)nnn1Cc1ccccc1F	815567407	XDUOIEGOXFOMFQ-UHFFFAOYSA-N	446.826	1.533	50	20	IDGD	
Cc1ccc(NNC(=O)C(=O)Nc2ccc3c(c2)N(C(=O)Cc2ccccc2)CC3)nn1	815593788	XJTVCUOCBOUHDC-UHFFFAOYSA-N	430.468	1.999	50	20	IDGD	
CCOC(=O)c1nc(NC(=O)C(=O)NNc2cccc([N+](=O)[O-])c2C)sc1C(C)=O	815595929	GCAHBDSHLPTBCE-UHFFFAOYSA-N	435.418	1.821	50	20	IDGD	
CCOc1ccc(C#N)cc1NC(=O)C(=O)NNc1ccccc1S(=O)(=O)N(C)C	815751606	GOUDRJOYOIOBHH-UHFFFAOYSA-N	431.474	1.289	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1cccc(NC(=O)C2CC2)c1	815752419	QWLZWMOSELNCBE-UHFFFAOYSA-N	445.501	1.367	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)CN1C(=O)N[C@](C)(c2ccc(F)cc2)C1=O	818486743	HDPXNPAEUWDILB-JOCHJYFZSA-N	442.447	1.382	50	20	IDGD	
NC(=O)N[C@@H](CC(=O)NNC(=O)COc1ccc(Br)cc1)c1ccccc1	821903760	AZLQKULSMXXASJ-HNNXBMFYSA-N	435.278	1.775	50	20	IDGD	
NC(=O)CC[C@H](NS(=O)(=O)c1cccc(C(F)(F)F)c1)C(=O)NNc1ccccc1	825130947	LYASEKCPMLQAMO-HNNXBMFYSA-N	444.435	1.761	50	20	IDGD	
COc1cc(C(=O)NNC(=O)/C(=C/c2ccccc2)n2nnnc2C)cc(OC)c1OC	859244808	UWWPUHBZJAQBGG-YBEGLDIGSA-N	438.444	1.467	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCc3ccccc32)cc1C(=O)N1CC[C@H](B(O)O)C1	864234286	UHYQSRVBUJHMLP-HNNXBMFYSA-N	430.291	1.136	50	20	IDGD	
Cc1nc(N)sc1C(=O)NN=Cc1cccc(C=NNC(=O)c2sc(N)nc2C)c1	874105288	YNVRFMKOMXLFIW-UHFFFAOYSA-N	442.530	1.909	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(Cl)c(Cl)c1)NNC(=O)Cc1ccc(F)cc1	913155468	STYARABAYPTAMR-UHFFFAOYSA-N	434.276	1.801	50	20	IDGD	
CC(C)NC(=O)CSc1ccccc1C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	913155480	XKUYHKPPSUHBAQ-UHFFFAOYSA-N	439.501	1.354	50	20	IDGD	
CCn1c(=O)nc(O)c2c(C(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)cc(C(C)C)nc21	913962267	NBJOFEFPFFSKKM-UHFFFAOYSA-N	440.416	1.623	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)N2CCN(S(=O)(=O)N(C)C)CC2)c(C)n1C[C@@H]1CCCO1	914504006	IMKXNBOMDQYZEW-DTBYZMGXSA-N	449.577	1.142	50	20	IDGD	
CCn1c(NNC(=O)c2cc(C3CC3)nc3c2c(O)nc(=O)n3C)nc2ccccc2c1=O	914605177	ZLYLDPHCVHNSMH-UHFFFAOYSA-N	447.455	1.398	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2ccc(CSc3nncn3C)cc2)ccc1-n1cnnn1	914747657	CENXBWWNXGQKEM-UHFFFAOYSA-N	449.500	1.466	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(F)c(C(=O)OCC(=O)NNC(=O)c2cccs2)c1	914938634	PPOBBACJDZANDH-UHFFFAOYSA-N	443.478	1.192	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1ccc(N2CCOC2=O)cc1	915291807	SFQCWFBGVDTTOJ-UHFFFAOYSA-N	431.474	1.320	50	20	IDGD	
COC(=O)NNC(=O)Nc1cc(S(=O)(=O)N2CCOCC2)ccc1N1CCCCC1	915312199	WZAGEVVRTNTJLF-UHFFFAOYSA-N	441.510	1.090	50	20	IDGD	
Cn1cc(S(=O)(=O)NCC(=O)NNC(=O)c2ccc(-c3ccc(F)cc3)s2)cn1	915638517	ZCSYSXUTOKWKNI-UHFFFAOYSA-N	437.478	1.027	50	20	IDGD	
CSC[C@H](C(=O)NNC(=O)Cc1c[nH]c2ccccc12)N1C(=O)[C@H]2CCCC[C@@H]2C1=O	915787686	OEIMQFQBOOIGSY-XYJFISCASA-N	442.541	1.765	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)N[C@@H](c2ccccc2OC)c2nccn2C)cc1	916228322	LYXMUDIFXOSMCY-FQEVSTJZSA-N	439.472	1.936	50	20	IDGD	
CC(=NNC(=O)c1nn(C)c(=O)c2ccccc12)c1ccc(S(=O)(=O)N(C)C)cc1	916316513	DGUQCQXQNLLGRZ-UHFFFAOYSA-N	427.486	1.338	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)NCc2cccc(S(N)(=O)=O)c2)c(C)n1-c1ccccc1	916623911	CYUMGWFICHZIGF-UHFFFAOYSA-N	441.513	1.886	50	20	IDGD	
C[C@@H](NC(=O)c1ccc(Br)s1)C(=O)NNC(=O)COc1ccccc1F	916720192	NYABXYSYSJBYNW-SECBINFHSA-N	444.282	1.994	50	20	IDGD	
O=C(Cc1csc(N2CCOCC2)n1)NN=C1CCS(=O)(=O)c2ccc(F)cc21	917566419	MWVKHRNPEJHDCQ-UHFFFAOYSA-N	438.506	1.359	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(C)c(C(=O)NNC(=O)c2ccc(Cl)cc2O)c1	918358218	LCUJBCISMYFFTK-UHFFFAOYSA-N	441.893	1.354	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)CS(=O)(=O)c1cccc(Br)c1	920213247	PXEMBJPWISRBKR-UHFFFAOYSA-N	441.303	1.622	50	20	IDGD	
Cc1cc(CNC(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)no1	920235934	ZXDVCVDJOQHDSY-UHFFFAOYSA-N	432.440	1.885	50	20	IDGD	
COC(=O)c1cc(NC(=O)NNC(=O)c2c(C)nc3ccccn23)cc(C(=O)OC)c1	920934150	FWAVPAWTTQKWDD-UHFFFAOYSA-N	425.401	1.682	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)N2CCN([C@@H]3CCS(=O)(=O)C3)CC2)c(C)n1CC(C)C	921246065	YIQKTPCHKCJXJH-GUBQRQEFSA-N	432.590	1.999	50	20	IDGD	
CS(=O)(=O)Nc1cccc(F)c1CNC(=O)NNc1ccccc1S(C)(=O)=O	1116294179	TYVDXAMIVBSZBD-UHFFFAOYSA-N	430.483	1.427	50	20	IDGD	
COc1ccc(S(=O)(=O)CCC(=O)NNc2c(OC)cccc2S(C)(=O)=O)cc1	1116638895	IKUMMLAPOXLPJU-UHFFFAOYSA-N	442.515	1.414	50	20	IDGD	
CCCS(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)c2cncn2-c2ccccc2)cc1	1261129723	XLQIIHWTDJECEY-UHFFFAOYSA-N	448.526	1.679	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2cc(C(=O)N3CCN(C)CC3)ccc2OC)cc1	1320411847	VZKPJJFNWWHEDU-UHFFFAOYSA-N	441.488	1.558	50	20	IDGD	
COCCn1cc(C(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)c(=O)cc1C	1323202308	DAIOYNSCTAIHFL-UHFFFAOYSA-N	436.509	1.211	50	20	IDGD	
O=C(NNS(=O)(=O)c1cnc(Cl)cc1Cl)c1csc(N2CCOCC2)n1	1323520350	GKDYZDVZBTWTDQ-UHFFFAOYSA-N	438.318	1.305	50	20	IDGD	
C[C@H]1CN(Cc2csc(NC(=O)NNC(=O)c3n[nH]c4c3CCCC4)n2)C[C@H](C)O1	1337767353	SBOGFTNDAQPAJH-RYUDHWBXSA-N	433.538	1.821	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(CCN(C(=O)c3cccc4c3OCCO4)C2)C1	1777836668	ASZFOVRCHZHTCE-OAQYLSRUSA-N	434.565	1.753	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2snnc2C2CC2)C1	1778366070	IGOAAMNBDQMQTJ-IQUTYRLHSA-N	442.969	1.797	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccn3cncc3c2)C1	1779115062	LYRVDPSJWRUDLB-WAOWUJCRSA-N	434.924	1.716	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@]2(CN(C(=O)/C=N/O[C@@H]3CCCCO3)CCO2)C1	1779297253	YUVAXKQQCUKPJP-FRJAKYGPSA-N	427.574	1.197	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cncc3cnccc13)CCO2	1779297921	CAOPMNHFRCTJSW-OAQYLSRUSA-N	428.565	1.925	50	20	IDGD	
Cc1n[nH]c(C)c1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)Br)C2	1779611353	UMFASWCBQQDHCY-UCMVZMLTSA-N	427.343	1.937	50	20	IDGD	
CCOC(=O)/C=C/C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@](C)(Cl)CCl)C1	1780713204	MZASANJDVKSERB-GGOVZTQWSA-N	435.348	1.856	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1c[nH]c(=O)cn1)C2	1780715738	XYYOGQIGGZYIKK-JEBQAFNWSA-N	431.320	1.134	50	20	IDGD	
O=C(Cc1n[nH]c2cc(Cl)ccc12)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1780942432	SYVPBGXEUBSTDC-QFBILLFUSA-N	441.315	1.188	50	20	IDGD	
Cc1nnc(CCC(=O)N2CCO[C@@]3(CCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)s1	1781224091	HHRIHUCVIODSAZ-IRXDYDNUSA-N	435.377	1.845	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](F)Br)C3)C2)c(OC)c1	1781335230	VQKHFLHGDWEPGG-YJBOKZPZSA-N	445.285	1.838	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCN1CCCC1)C2	1782004242	JGVMEZLWDIDNPY-GPMSIDNRSA-N	430.387	1.770	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)Cc3ccc(Cl)cc3OC)C2)C1	1782904057	NJSISZVMEJYGFM-UZLBHIALSA-N	445.343	1.975	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccnc(Cl)n3)CCO2)C1	1783349354	KSTHOKXEJUPMJN-MEDUHNTESA-N	431.718	1.747	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cnn(C(C)(C)C)c3)CCO2)C1	1783532088	ITYFMLPDAPAWKG-UGSOOPFHSA-N	427.343	1.865	50	20	IDGD	
COc1ccc(/C=C/C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)c(F)c1	1783655950	PSNOOHGMOQLGHI-PKQKZSDRSA-N	426.872	1.277	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCN3CCCC3)C[C@@H]21	1783975173	HKDGHVVPPJWHRI-QZWWFDLISA-N	430.387	1.483	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)COc3cccc4ccccc34)C[C@@H]21)[C@H](O)CCl	1784085738	OOHQAEDNMQQORU-ROPHOZQPSA-N	446.931	1.798	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](O)c3ccccc3Cl)C2)C1	1784250564	HHAIEALTIIQGMT-FRQCXROJSA-N	431.316	1.457	50	20	IDGD	
Cc1cc(Cl)cc(C(=O)N2CC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c1	1785046910	FJNGNSUXZVDMON-NRFANRHFSA-N	436.940	1.465	50	20	IDGD	
O=C(c1ccc(CO)c(F)c1)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1785268718	VVMRMBDGARNZLR-WMLDXEAASA-N	433.249	1.452	50	20	IDGD	
Cc1cc(C)n(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)CBr)C[C@@H]32)n1	1785335987	ZZRSVMXMIGXCBO-ZCPGHIKRSA-N	441.370	1.511	50	20	IDGD	
CN1CCCC[C@@H]1C(=O)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1	1786146603	NDTJJVJDWQRKDZ-OAQYLSRUSA-N	435.333	1.598	50	20	IDGD	
NC(=O)c1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCBr)[C@H]3C2)cc1	1786407644	DRAGYYMURNBSGQ-JYJNAYRXSA-N	438.322	1.164	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(C)(C)NCCC#N)[C@H]2C1	1786857217	CKLFHSCAGHPIFU-VGWMRTNUSA-N	443.386	1.279	50	20	IDGD	
CCOC(=O)[C@@H]1CCC[C@H](C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]3C2)C1	1787443359	GODMLDSIXJPPRC-FHULIHMCSA-N	432.920	1.870	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C[C@H]3COc4ccccc4O3)C[C@@H]21)[C@@H](F)Cl	1787443393	IFWNKLFAUDATKT-DPSXKDBOSA-N	426.872	1.731	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnn4c(C)cc(C)nc34)[C@H]2C1	1787910161	SZLITKFTWPOVJZ-OWLYRPNTSA-N	433.940	1.957	50	20	IDGD	
Cc1noc(CC(=O)Nc2ccc(C3(NC(=O)c4ccc(B(O)O)cc4)CCC3)cc2)n1	1788219846	UZMYQURDKMGBBW-UHFFFAOYSA-N	434.261	1.048	50	20	IDGD	
C=CC[C@@H](C(=C)C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1	1788610970	CTBGIWAPWJXEKB-FVCZOJIISA-N	441.532	1.047	50	20	IDGD	
CCc1noc(C)c1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21	1788951306	WONTVVNQNPSXCT-UHXUCMFUSA-N	432.290	1.829	50	20	IDGD	
C[C@H](C(=O)NC1(c2ccc(NC(=O)CCC(=O)NN(C)C)cc2)CCC1)n1ccnc1	1791599473	ITZSXVZSONNNPB-MRXNPFEDSA-N	426.521	1.951	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1ccc(C2(NC(=O)c3cncc(O)c3)CCC2)cc1	1791602409	DOBJINNXXXTKQU-UHFFFAOYSA-N	425.489	1.908	50	20	IDGD	
CC(C)(C)OC(=O)N(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](O)CCl)C2)C1CC1	1792708910	RFFFCYBBWRSXGB-UKMLZYKCSA-N	429.945	1.624	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)CBr	1792872081	LMKCRVBLOUTSLK-YYHQMBLXSA-N	440.176	1.781	50	20	IDGD	
Cc1ccn2ncc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)CCBr)c2c1	1795112636	MSMGROZZRHGUFN-ZSBFGKGUSA-N	435.322	1.631	50	20	IDGD	
C[C@@H](Sc1cccs1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1	1796191344	AZWGXZZPMWCBDI-NKGKWGDASA-N	444.387	1.861	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2)[C@H]1CN(Cc2ccccc2)CCO1	1797245416	JSDMLONLDFXPQE-RHQZKXFESA-N	439.915	1.011	50	20	IDGD	
CC(C)c1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)no1	1798439106	BZMCXIFNVQEGOS-BTTYYORXSA-N	426.477	1.362	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CC[C@@H]3CCC(=O)N3C1)C2	1799277390	YQJFMWDDFWALAT-MSOBSMHVSA-N	446.375	1.213	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1(C(F)(F)F)CCC1)C2)[C@@H](F)Br	1799346681	WATYZCRRYUOFDT-LMLFDSFASA-N	431.224	1.999	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)cc([N+](=O)[O-])c1	1799728473	SEKOYTRLFAMZFL-DLTLXFJOSA-N	425.869	1.911	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](NC(C)=O)C(C)(C)C)C2	1800637587	DSBVBAUZSOZFHV-QRJUGERDSA-N	446.386	1.300	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COc1ccccc1)C2	1800639396	UAGZLECVDXLDFB-KPEUIFRASA-N	425.323	1.829	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(-c3ccco3)no1)C2	1800756066	FJDTWHQULJOKKR-OVZMXSCWSA-N	438.278	1.921	50	20	IDGD	
COc1ccc(F)c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)Br)c1	1800762462	BOTMMJYCFXKRRV-LSSIXWDNSA-N	429.286	1.821	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1cnc3[nH]ccc3c1)C2	1800981802	RXRROOKSKFYSBV-ZMMAXQRCSA-N	434.924	1.339	50	20	IDGD	
COc1ccc2[nH]cc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)C(Cl)Cl)c2n1	1801016390	HQNRZVYLINIBMT-WDAIWFPHSA-N	427.288	1.578	50	20	IDGD	
COc1cc(C)ccc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2	1801707337	MIBXZJIMMBIRAL-VZAMPYOESA-N	429.286	1.897	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2c[nH]c3nccc-3c2)[C@H]1c1cccnc1)[C@H](O)CCl	1803138420	AGWKWRCLYOJCDX-JQHSSLGASA-N	427.892	1.829	50	20	IDGD	
Cn1cc(C(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)c(C(F)F)n1	1803139359	ONEJDULBSIDNIZ-XPKDYRNWSA-N	441.866	1.672	50	20	IDGD	
O=C(CCBr)NC[C@H]1CCN(C(=O)CC(F)(F)C(=O)O)[C@H]1c1cccnc1	1806340808	NTZVVPHDAAYZJZ-DOMZBBRYSA-N	448.264	1.982	50	20	IDGD	
CC(C)c1nc(C(=O)N2CCCC3(CCN(C(=O)c4cccc(B(O)O)c4)CC3)C2)co1	1807410247	HOSGXKVURGEVML-UHFFFAOYSA-N	439.321	1.636	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2nccnc2C(N)=O)[C@H]1c1cccnc1	1808263767	POUFPSWDWGGQLX-ZQIUZPCESA-N	430.896	1.308	50	20	IDGD	
O=C(/C=C/C1CCCC1)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1808482466	XPMLEUPSBSWUOY-DSQTUEOOSA-N	447.344	1.827	50	20	IDGD	
Cc1c[nH]cc1C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1808581024	RMAHIIVMYWSTPI-GHTZIAJQSA-N	432.289	1.031	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC2(CCCN(C(=O)c3nccc4nc[nH]c34)C2)CC1	1810698614	CLFUDDGVEPHQCY-UHFFFAOYSA-N	441.536	1.176	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)[C@](C)(O)C(F)(F)F)[C@H]1c1cccnc1	1813028400	PWHBMALYDZPZAY-WSMBLCCSSA-N	437.846	1.655	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2ccc(C#N)cc2)[C@H]1c1cccnc1	1813072366	GQYIAPOQONTIEJ-OFNKIYASSA-N	448.527	1.646	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc3c(n2)OCCO3)[nH]n1)[C@@H](O)CCl	1814870544	WBPVCBZORGPWHP-KBPBESRZSA-N	435.868	1.482	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)C(C)(C)CNC(C)=O)n[nH]1	1815343049	VHJYGLBEJXAEPV-ZFWWWQNUSA-N	427.933	1.818	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)CCc3cccnc3)sc2C1	1815733309	LJORAUJOFNGEGN-HNNXBMFYSA-N	444.561	1.456	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2nccs2)n[nH]1	1816570660	ZBYRONKEVJIFPZ-CQSZACIVSA-N	440.489	1.484	50	20	IDGD	
C[C@H](Nc1nccs1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](O)CCl)CC2	1817216997	VKYUIRQYAOZESU-QXEWZRGKSA-N	429.955	1.612	50	20	IDGD	
Cc1ccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)c(O)n1	1817477023	WCMRTLBTXZYLKQ-GOSISDBHSA-N	449.276	1.118	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnc(O)nc2O)n[nH]1	1818021276	XHGKNDIRSSZMFM-ZDUSSCGKSA-N	434.529	1.768	50	20	IDGD	
Cn1cc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)[C@@H](O)CCl)[nH]n2)c(C(F)F)n1	1818368385	KLEGCROTTKVZJQ-RYUDHWBXSA-N	430.843	1.986	50	20	IDGD	
COc1ccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)nc1	1818402641	GXSWXEHTXZLABE-QGZVFWFLSA-N	443.508	1.492	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3nn(C)c4c3CCC4)sc2C1	1818476389	QVIIDBZKRXEVCX-PWSUYJOCSA-N	437.953	1.845	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3cn4cccnc4n3)sc2C1	1819030114	YGRHHOCXVDYZBS-QWRGUYRKSA-N	434.909	1.665	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)C/N=C/c2ccco2)n[nH]1	1819481661	YXWGEXGJVDUBQQ-NEIHUHTASA-N	443.508	1.487	50	20	IDGD	
CCOC(=O)c1cc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)[C@@H](O)CCl)[nH]n2)ccn1	1820297264	MYXRITFZJAEMBX-HOTGVXAUSA-N	449.895	1.887	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(CO)on3)sc2C1	1821693786	XTPIASDADRUNTB-RKDXNWHRSA-N	443.323	1.880	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccccc3)sc2C1	1821837441	RZMDHOBWCOFYQM-CYBMUJFWSA-N	436.497	1.681	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)CNC(=O)OC(C)(C)C)sc2C1	1825509617	NFPQBGKFAMAUGL-QWRGUYRKSA-N	446.957	1.834	50	20	IDGD	
COCCn1ccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)[C@H](O)CCl)CC2)n1	1827824112	OSHVNQLJHGICEX-QZTJIDSGSA-N	426.945	1.363	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc4ccccc4n3)C2)C1	1830361991	IBGCTDUASMVPTE-QFIPXVFZSA-N	446.935	1.965	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1C[C@@H]1C1CC1)CCO2	1830506336	YGQWIKVRBFQUKZ-OAFZBRQQSA-N	429.355	1.662	50	20	IDGD	
C[C@H](C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2)c1ccc(Cl)cc1	1830719875	NCOFDMGDMDNAMH-VHFSOBRXSA-N	445.343	1.500	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H](N)CCC(N)=O)CC1	1831549036	MGAQVRFNKUBDKX-HRCADAONSA-N	445.402	1.372	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(N(C)C)nc3)C2)C1	1831652026	VQAVIDJTNLSQML-LAUBAEHRSA-N	438.956	1.625	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccnc4c3OCO4)C2)C1	1831654109	IKOPRORINWFCPA-FOIQADDNSA-N	439.896	1.288	50	20	IDGD	
CC[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1)N(CC)CC	1831669356	GYUFUDCIDLUIMI-WIYYLYMNSA-N	443.661	1.415	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H](O)c2ccco2)CC1	1831869685	LWWDWUCEAZNXNK-DYESRHJHSA-N	434.537	1.306	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)CC3Cc4ccccc4C3)CC2)CC1)[C@@H](O)CCl	1833313753	PQRVQVSTDWIVCF-QFIPXVFZSA-N	448.007	1.963	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnc(OC)c(C)c3)CCO2)C1	1834579527	AKPQMVKYFQWWCN-OXJNMPFZSA-N	425.913	1.486	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)Cn3cccn3)CC2)CC1	1834884640	ICWGHJKWRQZGJE-CQSZACIVSA-N	426.359	1.238	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(CN(C(=O)COc3ccccc3)CCO2)C1	1834952298	CUTTVQHBWRBTLY-NRFANRHFSA-N	436.581	1.373	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)S)CC2)CC1	1835118088	OWVQTQZBUQLQLT-LZCVXGSNSA-N	448.593	1.010	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)CC(F)(F)F)CCO2)C1	1835327776	UXUJILHNHKLKFW-FZMZJTMJSA-N	431.249	1.426	50	20	IDGD	
COc1cc(C(=O)NC2CCN(C3CCN(C(=O)[C@H](O)CCl)CC3)CC2)ccc1O	1836302325	RFCZVGIFNNDYHI-GOSISDBHSA-N	439.940	1.186	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3nc4ccccn4n3)CCO2)C1	1836393606	WCYYJYDIYOGKIC-YWZLYKJASA-N	435.912	1.207	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC(OC2CCN(C(=O)[C@H]3CCC(=O)N3)CC2)CC1	1836670154	BBHXZUYJPBPIKI-XJKSGUPXSA-N	444.370	1.295	50	20	IDGD	
CCc1ncsc1C(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836718529	QZGGBKKNTXFPRL-MRXNPFEDSA-N	429.970	1.917	50	20	IDGD	
O=C(c1ccc(=O)oc1)N1CCC(OC2CCN(C(=O)[C@H](F)Br)CC2)CC1	1837589051	DOKSTSXVXFOOCU-INIZCTEOSA-N	445.285	1.943	50	20	IDGD	
C[C@H]1CCC[C@H]1C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1	1837919206	QDNYFOANKKRZCJ-HTAPYJJXSA-N	442.365	1.415	50	20	IDGD	
Cc1n[nH]c(C)c1CC(=O)N1CCO[C@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1	1839241343	KEDHXJGLXWGWBA-RTBURBONSA-N	447.363	1.262	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(C)c(F)c3F)C2)C1	1840156866	WWZXISPRVDYFRH-FOIQADDNSA-N	446.878	1.597	50	20	IDGD	
N#Cc1ccc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)cc1	1840187403	YFNFOLZHLJLHJN-IBGZPJMESA-N	426.300	1.361	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(C(N)=O)cc3)CCO2)C1	1840646076	BLXJADSCSOBQPF-UTKZUKDTSA-N	437.924	1.263	50	20	IDGD	
Cc1cc(F)ccc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1840778765	NNCPHBFCBPCKGX-MAUKXSAKSA-N	447.276	1.895	50	20	IDGD	
C#CCCC(=O)N1CCO[C@@]2(COCCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1	1840844326	PCJXYXPGRIRGKO-KUDIEGTJSA-N	443.450	1.742	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H]3CCCSC3)CCO2)C1	1840865640	UESCPIMZUMOTIB-JCGIZDLHSA-N	439.405	1.822	50	20	IDGD	
C[C@H](C(=O)N1CCCC12CN(C(=O)c1cnccc1C(=O)NN)C2)c1ccc(Cl)cc1	1841198277	TXXOXGJRYJQLRU-AWEZNQCLSA-N	441.919	1.959	50	20	IDGD	
O=C(c1csc(-c2ccccc2)n1)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843013779	MDEUIOIMLKFNIH-UHFFFAOYSA-N	447.325	1.621	50	20	IDGD	
Cc1cc(C(=O)N2CC3(CCCN3C(=O)c3cccc(B(O)O)c3)C2)nc2ccccc12	1843014094	WPOCUHTYSLZDLZ-UHFFFAOYSA-N	429.285	1.354	50	20	IDGD	
COc1ccc([N+](=O)[O-])c(C(=O)N2CCCC23CN(C(=O)[C@@H](C)CBr)C3)n1	1843585309	XGVXVCQMEGOHDT-NSHDSACASA-N	441.282	1.846	50	20	IDGD	
CC(C)(C)OC(=O)N1CC2(C[C@@H](C(=O)N3CCCC34CN(C(=O)[C@@H](F)Cl)C4)CO2)C1	1846120174	GQTMYCLAFAOCMW-ZIAGYGMSSA-N	445.919	1.750	50	20	IDGD	
Cc1nc2cccc(C(=O)N3CC4(CCCN4C(=O)CCC(=O)NN(C)C)C3)c2s1	1846384872	SZOMLHKNBIHYHJ-UHFFFAOYSA-N	429.546	1.795	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)C1CN(C(=O)c2ccccc2OC)C1	1847456631	RDUANGMGZZQGLH-SQNIBIBYSA-N	433.936	1.986	50	20	IDGD	
CC(C)(C)OC(=O)NCCOCCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)C(Cl)Cl	1847722505	OJAGSEILYYSZFX-STQMWFEESA-N	438.352	1.923	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)N1CCCN(S(=O)(=O)c2ccc(F)cc2)CC1	9797494	BIZBHTCWYSETGH-UHFFFAOYSA-N	434.493	1.885	50	20	IDGD	
O=C(CN1CCC(NC(=O)c2ccccc2)CC1)NNC(=O)c1cccc([N+](=O)[O-])c1	11097436	OAFJVPZGHAFHMC-UHFFFAOYSA-N	425.445	1.250	50	20	IDGD	
Cc1ccc(NC(=S)NNC(=O)Cn2c(=O)ccn(Cc3ccccc3)c2=O)c(C)c1	14807798	TUJALHSPLHCDFY-UHFFFAOYSA-N	437.525	1.693	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)CCNS(=O)(=O)c1ccc(F)c(F)c1	17583114	MQGBBJOHWCWSNR-UHFFFAOYSA-N	437.428	1.051	50	20	IDGD	
NC(=O)c1ccc(Oc2ccc(C(=O)NNC(=O)c3n[nH]c(=O)c4ccccc34)cc2)cc1	111066965	RHFUOCJFIILZDR-UHFFFAOYSA-N	443.419	1.889	50	20	IDGD	
CC(=O)N1CCC[C@H](C(=O)NNC(=O)c2nc(-c3ccccc3)n(-c3ccccc3)n2)C1	726094483	FTOBMHMOTVUCLG-SFHVURJKSA-N	432.484	1.954	50	20	IDGD	
COc1ccccc1N1CC[C@@H](CNC(=O)NNC(=O)CNC(=O)c2cccs2)C1	726252564	IRNMZCOXZVLYIT-AWEZNQCLSA-N	431.518	1.343	50	20	IDGD	
Cc1noc(C)c1S(=O)(=O)N1CCC(C(=O)NNC(=O)CCCc2ccccc2)CC1	727717341	LTMJIGNAXBFWNQ-UHFFFAOYSA-N	448.545	1.862	50	20	IDGD	
COC(=O)c1cc(C(=O)OC)cc(S(=O)(=O)NNC(=O)CCCc2ccccc2)c1	727721512	IRVJPQRYPVZVKN-UHFFFAOYSA-N	434.470	1.592	50	20	IDGD	
CCOc1ccc(/C=C(/C#N)C(=O)OCC(=O)NNC(=O)Cc2nc(C)cs2)cc1	728720918	OCMMABUAQLYRGQ-NVNXTCNLSA-N	428.470	1.691	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCN(c2ccc3c(c2)OCCO3)C1=O)c1cc(Br)c[nH]1	730519079	FXKNJUAVIUFXAV-LBPRGKRZSA-N	449.261	1.363	50	20	IDGD	
COc1cc(-c2nn(CCC#N)cc2/C=C(/C#N)C(=O)NCC(N)=O)ccc1OC(F)F	731473750	XTDKRMMNJBNSKQ-QPEQYQDCSA-N	444.398	1.582	50	20	IDGD	
CCNS(=O)(=O)CCNC(=O)NNC(=O)c1cc2c(s1)CC[C@@H](C(C)(C)C)C2	731760246	WQEFGWUGKQRPOQ-CYBMUJFWSA-N	430.596	1.782	50	20	IDGD	
O=C(NNc1ccc(Br)nc1)c1ccc(S(=O)(=O)N2CCOCC2)cc1	732835899	AUSWANOFXSAERP-UHFFFAOYSA-N	441.307	1.622	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NC2CCN(C(=O)OC(C)C)CC2)nc1	733045694	ZUTOOTWFERGKQM-UHFFFAOYSA-N	442.542	1.404	50	20	IDGD	
Cc1nnnn1/C(=C/c1ccc(F)cc1)C(=O)NNC(=O)c1cnn(-c2ccccc2)c1	733108197	LAMLZKMZLHMDQT-YBFXNURJSA-N	432.419	1.766	50	20	IDGD	
COC[C@@H](C)S(=O)(=O)NC(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccccc1	733715251	RFKHLZDWOMUXPC-QAEAHILHSA-N	427.486	1.852	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(C(=O)CNC(=O)NNc2cc(F)c(F)cc2F)CC1	734661994	UKUHXLPKSVJYPN-UHFFFAOYSA-N	431.415	1.809	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCCCOc2cccc(OC)c2)c2ccccc2c1=O	739039120	MJADQTRMHFRJKB-UHFFFAOYSA-N	439.472	1.838	50	20	IDGD	
Cc1noc(C)c1C[C@H](C)NC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	739047739	FDTUYTILRZBYAB-INIZCTEOSA-N	428.537	1.765	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)[C@H]1CC(=O)N(c2cccc(Br)c2)C1	740850157	WFIMDOCPZLKRQP-NSHDSACASA-N	439.310	1.254	50	20	IDGD	
COc1ccccc1-c1ccc(C=NNC(=O)CSc2nn(C)c(=O)n(C)c2=O)cc1	741457492	IETLOKLRQBYBNK-UHFFFAOYSA-N	439.497	1.397	50	20	IDGD	
C[C@@H](CN1C[C@@H](C)O[C@H](C)C1)C(=O)NN=Cc1c(N2CCOCC2)nc2ccccn12	741812004	JWFRTZJJENDFID-RCCFBDPRSA-N	428.537	1.366	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)c2cn([C@H]3CCS(=O)(=O)C3)nc2C(C)C)c1	742473025	ZMXIPPCVEJLFEG-INIZCTEOSA-N	448.545	1.823	50	20	IDGD	
Cc1c(C(=O)NNc2ncnc3[nH]cnc23)nnn1C1CCN(C(=O)OC(C)(C)C)CC1	743472638	AJDIITMVEFOWOZ-UHFFFAOYSA-N	442.484	1.582	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc2nc(O)[nH]c2cc1Br)c1ccccc1F	745997378	AAZHFGDBFUTCJL-UHFFFAOYSA-N	429.227	1.793	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(C)(C)NC(=O)Nc2ccccc2)c2ccccc2c1=O	746096969	SSYCEWSFOHTDFY-UHFFFAOYSA-N	436.472	1.778	50	20	IDGD	
CC[C@@](C)(CNC(=O)OC(C)(C)C)C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	747791212	SVZINTYEJWNBFI-IBGZPJMESA-N	427.523	1.792	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2cnc3c(cnn3CC(C)C)c2)c2ccccc2c1=O	748214138	KYXHNMTXTIDYQB-UHFFFAOYSA-N	433.472	1.892	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)F)cc1)c1cccc(CN2C(=O)CNC2=O)c1	748609931	FEJOLSKYWGEZII-UHFFFAOYSA-N	438.412	1.492	50	20	IDGD	
CCn1c(NNC(=O)C2CCC(NC(=O)COCCOC)CC2)nc2ccccc2c1=O	748707231	YMGGYLRBIMTUFR-UHFFFAOYSA-N	445.520	1.198	50	20	IDGD	
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	749581707	BNELUMJIIQWAJF-JXFKEZNVSA-N	448.527	1.788	50	20	IDGD	
CCOc1ccc(NC(=S)NNC(=O)c2ccc([C@]3(C)NC(=O)NC3=O)cc2)cc1	751059773	JAUFCKHJXWDAMJ-FQEVSTJZSA-N	427.486	1.771	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)c2ccc(=O)n(-c3cccc(F)c3)c2)c1	751778911	SKULACRXQPFMDA-UHFFFAOYSA-N	434.383	1.466	50	20	IDGD	
CCOC(=O)c1ccc(N2CC(NC(=O)NNC(=O)Cc3ccccc3OC)C2)nc1	753278272	DGAGDXZDKXOYPQ-UHFFFAOYSA-N	427.461	1.029	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)N[C@H]2C[C@H](C)N(C3CC3)C2)c2ccccc2c1=O	753944907	OPOSDGFCJDEVGP-GJZGRUSLSA-N	426.521	1.766	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)Nc1ccc(CN2C(=O)CCC2=O)cc1	755664604	XNXQLBGDPFSQMH-UHFFFAOYSA-N	432.440	1.988	50	20	IDGD	
COC(=O)CNC(=O)Cc1ccc(NC(=O)NNC(=O)c2cc3c(s2)CCC3)cc1	755863648	RGSODTBDVWBFPM-UHFFFAOYSA-N	430.486	1.535	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)Nc1ccc(S(=O)(=O)NCC(F)(F)F)cc1	756640592	OPXAFNUYYDXMBQ-UHFFFAOYSA-N	431.396	1.318	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)NNC(=O)c1cccc(C#N)c1	756673916	BSGLZQZBBXMCCG-UHFFFAOYSA-N	431.474	1.674	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2ccc(C)cc2O)cc1S(=O)(=O)NC1CC1	756682640	OKPVFBZNNMRZBC-UHFFFAOYSA-N	434.474	1.616	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)Nc2ccc(N3CCSCC3)cc2)c2ccccc2c1=O	756730361	OCZZKFUJTOKRFV-UHFFFAOYSA-N	438.513	1.953	50	20	IDGD	
C[C@H]1CN(C(=O)Cn2cc(NC(=O)NNC(=O)Cc3ccccc3F)cn2)C[C@H](C)O1	756840174	ULXXDJDELRVCDI-KBPBESRZSA-N	432.456	1.053	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)c(Cl)c1)Nc1ccccc1OCC(=O)N1CCOCC1	756874157	OWNJCUDTUUVHDZ-UHFFFAOYSA-N	448.863	1.750	50	20	IDGD	
COCCN(C)S(=O)(=O)NC(=O)/C(C#N)=C\c1cc(C)n(-c2ccc(OC)cc2)c1C	757322491	GQUIEPFHBQPRAG-AQTBWJFISA-N	446.529	1.949	50	20	IDGD	
Cn1cc(NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc(Br)c1=O	757678814	OOCIGYYIDOESGK-UHFFFAOYSA-N	443.279	1.018	50	20	IDGD	
COc1cc(C(=O)NNC(=O)N=c2cc[nH]cc2Br)cc(OC)c1OC	757805439	KQDZFTXRUQMBFC-UHFFFAOYSA-N	425.239	1.758	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)[C@H]2COc3ccc(Br)cc32)cc1	758664338	BIWOHXZPZCNPOP-HNNXBMFYSA-N	444.241	1.801	50	20	IDGD	
COc1cccc([C@H](CNC(=O)NNC(=O)C(=O)Nc2ccccn2)N2CCCC2)c1	758675922	RWLINDAYSWZDCA-KRWDZBQOSA-N	426.477	1.196	50	20	IDGD	
CC(C)CNS(=O)(=O)c1ccc(CNC(=O)NNC(=O)Cc2ccccc2F)cc1	759663755	NUFHBGKMGUPQEQ-UHFFFAOYSA-N	436.509	1.833	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@H](CCC(N)=O)C(=O)NNc2ccc(C#N)cc2)cc1C	760463127	ONCRKLALFFTENC-GOSISDBHSA-N	429.502	1.231	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2[nH]c3c(c2C)C(=O)CC(C)(C)C3)n1	761174387	CRAZIADRUWCQOP-UHFFFAOYSA-N	432.502	1.790	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc2c(c1)CCN2C(=O)C(=O)NNC(=O)c1ccccc1	763422595	FNJMUIWFGYWTDY-UHFFFAOYSA-N	444.513	1.067	50	20	IDGD	
CCC(=O)NNC(=O)C(=O)Nc1cc(OC)c(OC)cc1C(=O)N1[C@H](C)CCC[C@H]1C	763441793	ZYDQDTNJOYFJQU-CHWSQXEVSA-N	434.493	1.603	50	20	IDGD	
CN(C)C(=O)C[C@@H]1CN(C(=O)C(=O)NNC(=O)c2ccccn2)c2ccc(Cl)cc21	763467479	OZAWSNYRARJWKN-GFCCVEGCSA-N	429.864	1.105	50	20	IDGD	
O=C(COc1cccc(C(F)(F)F)c1)NNC(=O)C(=O)Nc1ccc2nccnc2c1	763639714	QTLVMQTWCBQRGG-UHFFFAOYSA-N	433.346	1.814	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(Oc3ccccn3)c2)cc1	763673236	BJMJXLPCAZABNY-UHFFFAOYSA-N	431.408	1.910	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(C)c(S(C)(=O)=O)c1	763710858	CSMOCWHTDDHJJL-UHFFFAOYSA-N	433.486	1.126	50	20	IDGD	
Cc1c(Br)cccc1NC(=O)C(=O)NNC(=O)c1nnc(O)c2ccccc12	763791695	XPALGYVKRXRESR-UHFFFAOYSA-N	444.245	1.806	50	20	IDGD	
CCc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1	763796777	HJDAZOCSZWGZBO-UHFFFAOYSA-N	444.513	1.433	50	20	IDGD	
CCN(CC)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])cn1	763804916	XHPKZKDDLHXMSW-UHFFFAOYSA-N	430.421	1.001	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(S(=O)(=O)NC(C)C)cc2)cc1	763830223	AFPRCQXSNJLWIG-UHFFFAOYSA-N	432.502	1.335	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1cnn(-c2ccccc2F)c1	763848275	BCEOJLUAYNQRIS-LBPRGKRZSA-N	429.383	1.704	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)C(=O)Nc1ccnn1-c1ccncc1	763853570	MEARJLIHBVBDDO-OAHLLOKOSA-N	444.451	1.974	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)CCC(=O)N3)ccc1OC(C)C	763916136	ITHOYHHUTJEJBU-UHFFFAOYSA-N	440.456	1.767	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCCCC3)ccc1-n1cnnn1	763962206	NMRRLQBWKIYAEU-UHFFFAOYSA-N	439.501	1.701	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1cccc(N2CCCCC2=O)c1	764005981	HMWHXXSVABBESI-UHFFFAOYSA-N	438.440	1.374	50	20	IDGD	
COc1cccc(-c2nsc(NC(=O)C(=O)NNC(=O)c3ccc(C)cc3O)n2)c1	764105223	NBIYVMXUYGIUAR-UHFFFAOYSA-N	427.442	1.627	50	20	IDGD	
CC[C@H](C)Oc1cccc(NC(=O)C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1	764260006	MLKYGLGGDFKQGE-HNNXBMFYSA-N	440.504	1.656	50	20	IDGD	
O=C(NNC(=O)c1cc(F)ccc1Br)C(=O)Nc1nc2c(s1)COCC2	764270711	RITGKFZJCNISME-UHFFFAOYSA-N	443.254	1.517	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1cccnc1OCc1ccccc1	764276038	XBPWAIFOYHBFLN-UHFFFAOYSA-N	436.424	1.531	50	20	IDGD	
O=C(Cn1c(=O)nc(O)c2ccccc21)NNc1c(F)cc(C(=O)NC2CC2)cc1F	764336236	ZSQSOJPIVUGVRL-UHFFFAOYSA-N	429.383	1.416	50	20	IDGD	
O=C(NNC(=O)C(F)(F)Oc1ccccc1)C(=O)Nc1ccc(C(=O)N2CCCC2)cc1	764370188	OLJJXEKWEDQVDJ-UHFFFAOYSA-N	446.410	1.680	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)c(OC)c1	764388303	QOCAIIDMGXSXEA-UHFFFAOYSA-N	427.392	1.633	50	20	IDGD	
CN(C)CC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2F)cc1	764411215	TVACJAQQTUPSPN-UHFFFAOYSA-N	435.843	1.379	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)N[C@H]1CCN(c2ccc(Cl)c(F)c2)C1=O	764507612	KDADGGFGMIKQBM-HNNXBMFYSA-N	448.838	2.000	50	20	IDGD	
CCOC(=O)c1cnn2c(C(=O)NNc3c(F)cc(C(=O)NC4CC4)cc3F)ccnc12	764663086	LDIZAUSYNDEOAW-UHFFFAOYSA-N	444.398	1.833	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cccc(C4OCCO4)c3)CC2)cc1	764753342	WSWFULSXSZYOQO-UHFFFAOYSA-N	438.528	1.619	50	20	IDGD	
CCCCS(=O)(=O)c1ccc(C(=O)NNC(=O)c2nnc(O)c3ccccc23)cc1	765185842	OUKLQBFASKSHQB-UHFFFAOYSA-N	428.470	1.984	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)c2cc(S(N)(=O)=O)ccc2Cl)n[nH]1	765600807	MZZVWZGEKGSMGC-UHFFFAOYSA-N	449.876	1.461	50	20	IDGD	
CCN(CC)C(=O)Cn1ccc2cc(NC(=O)C(=O)NNc3nccnc3OC)ccc21	766264283	HJDGOXJFIOUOQG-UHFFFAOYSA-N	439.476	1.390	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)N[C@@H]1CC(=O)N(c2ccc(Cl)c(F)c2)C1	766552371	IDUNZMNOTWIYFO-GFCCVEGCSA-N	448.838	2.000	50	20	IDGD	
CO[C@H](C(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1)c1ccccc1	766664909	XNXZFTKDEQXTJM-NRFANRHFSA-N	430.936	1.993	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)CO[C@H]2CCCN(C(=O)OC(C)(C)C)C2)c1	767853208	NZCLFNSMQJFDAX-KRWDZBQOSA-N	436.509	1.671	50	20	IDGD	
CCc1ccc(C(=O)NNc2ccc([N+](=O)[O-])cc2)cc1S(=O)(=O)N1CCOCC1	768246820	PYTNVDWEPRAFBT-UHFFFAOYSA-N	434.474	1.935	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)c2cc(N3CCNC3=O)ccc2F)n[nH]1	768275471	CGOSKGQFWFFOJK-UHFFFAOYSA-N	438.419	1.829	50	20	IDGD	
CSCCNC(=S)NNC(=O)[C@H]1CCCN(C(=O)N2CCc3sccc3C2)C1	769768194	GWVZNNRAOWLUTE-AWEZNQCLSA-N	441.648	1.797	50	20	IDGD	
Cc1nc(NC2CC2)sc1C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	770078509	MJSDUTOIAGNELS-CQSZACIVSA-N	432.458	1.170	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H](OC)C(C)C)c1	770209943	QNNKQBBUKRSATD-SFHVURJKSA-N	435.502	1.928	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)Nc1ccc(C[C@H]2NC(=O)NC2=O)cc1	770633228	XFFKCKIFSQMDJM-MEDUHNTESA-N	445.863	1.711	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)CCCC[C@@H]3SC[C@H]4NC(=O)N[C@@H]43)nc21	770967599	XYXUNBYFKGMDTN-DYEKYZERSA-N	448.553	1.456	50	20	IDGD	
C[C@@H]1CCCCN1S(=O)(=O)c1ccc(C(=O)NNc2nc(O)c3cnn(C)c3n2)cc1	770972890	KKXXTVNLNGGEGT-GFCCVEGCSA-N	445.505	1.389	50	20	IDGD	
CC[C@H](C)[C@@H](C(=O)O[C@H](C)C(=O)NNC(=O)CC(C)C)N1C(=O)c2ccccc2C1=O	771875328	RLHYVZJYTGFFJJ-IYOUNJFTSA-N	431.489	1.823	50	20	IDGD	
C[C@H]1CN(C(=O)c2ccc(NC(=O)C(=O)NNc3ccc([N+](=O)[O-])cc3)cc2)C[C@H](C)O1	773643698	FGKKGQGZBPTBRI-KBPBESRZSA-N	441.444	1.926	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C)c(NC(=O)CCN(C)C)c2)cc1F	773888946	NTWMJNTYTUVLCP-UHFFFAOYSA-N	443.479	1.732	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNS(=O)(=O)c1cc([N+](=O)[O-])c(F)cc1C	777907550	VPDHGEMZZPNYEQ-UHFFFAOYSA-N	427.410	1.830	50	20	IDGD	
O=C(CN1CCC(Oc2cncc(Cl)n2)CC1)NNC(=O)c1ccc([N+](=O)[O-])cc1	778186029	OALCSMFXQOEFFY-UHFFFAOYSA-N	434.840	1.343	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNS(=O)(=O)c1cc(C(=O)O)c(F)c(Cl)c1F	779829667	LZXULWBVCKLMBV-UHFFFAOYSA-N	444.803	1.896	50	20	IDGD	
O=C(COc1ccccc1Cc1ccccc1)NNC(=O)NC[C@@H]1CC(=O)N(C2CC2)C1	780885027	ACINHVOEDAJGQZ-SFHVURJKSA-N	436.512	1.998	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)c(Br)n1	782894826	WWQANMDVSPYWPF-UHFFFAOYSA-N	445.277	1.368	50	20	IDGD	
CN(C)CCOc1ccc(NC(=O)C(=O)NNc2ccc(-n3cccn3)nn2)cc1Cl	783432842	GAHOAHSITMTTQX-UHFFFAOYSA-N	444.883	1.338	50	20	IDGD	
NC(=O)CCSc1ccccc1NC(=O)C(=O)NNc1ccc(Br)cn1	784341658	QJAONPWNAQTGSW-UHFFFAOYSA-N	438.307	1.893	50	20	IDGD	
CCc1ccc(NC(=O)C(=O)NNc2ccc(OC(F)(F)F)cc2)cc1S(N)(=O)=O	784803666	IDHCYWMYKSGIGE-UHFFFAOYSA-N	446.407	1.877	50	20	IDGD	
CC(C)NC(=O)C(=O)NNC(=O)c1cc(I)c(Cl)cc1Cl	784833474	ZJZABYNSYXRDDU-UHFFFAOYSA-N	444.056	1.884	50	20	IDGD	
C[C@H]1CN(C(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)c2ccccc2O1	784835889	YUEZWYXLZPNGMN-NSHDSACASA-N	425.413	1.940	50	20	IDGD	
COCCNC(=O)c1ccc(NC(=O)C(=O)NNc2cccnc2Cl)cc1Cl	784838753	CJWZAYVAKQSQLL-UHFFFAOYSA-N	426.260	1.846	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2ncc(F)cn2)n([C@@H]2CCN(Cc3ccccc3)C2)n1	784957773	SEVZJABOPCIPNH-QGZVFWFLSA-N	438.467	1.649	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)C(=O)Nc1ccc2c(c1)nc1n2CCCCC1	785068065	SLNKBLVGEHAZMN-UHFFFAOYSA-N	445.483	1.739	50	20	IDGD	
Cc1cc(Br)cc(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)c1	785068634	YGVOCZNYDZOTEC-UHFFFAOYSA-N	430.262	1.734	50	20	IDGD	
NC(=O)c1ccc(F)c(NC(=O)C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)c1	785104419	JOWJUMLVUMUFMF-UHFFFAOYSA-N	435.362	1.177	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)cc1N1CCNC1=O	787544590	WFHBEFXAPOIHTK-UHFFFAOYSA-N	431.836	1.283	50	20	IDGD	
CC[C@H]1CCc2nc(NC(=O)C(=O)NNC(=O)COc3ccccc3C#N)sc2C1	789731301	AVXVNBFOENXOTQ-LBPRGKRZSA-N	427.486	1.695	50	20	IDGD	
COc1ccc(OC)c(C2=NO[C@H](C(=O)NNC(=O)c3nnc(O)c4ccccc34)C2)c1	792015542	CAXXEQONJSCAGO-KRWDZBQOSA-N	437.412	1.307	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CN2CCc3c(cccc3S(=O)(=O)N(C)C)C2)c1	792892840	RXZQNDPBYYJSLY-UHFFFAOYSA-N	430.530	1.065	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@H](OC(C)C)c2ccccc2)cc1	794181749	AJHUOKXFMCJLRY-HXUWFJFHSA-N	433.530	1.929	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)c2sccc2S(=O)(=O)C(F)F)cc1	794732752	YEXXZOPCVSAWKV-UHFFFAOYSA-N	439.487	1.752	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1cc(=O)c2ccc(F)cc2o1	794782232	WLSGJXMITKRZGV-UHFFFAOYSA-N	432.433	1.608	50	20	IDGD	
CCC[C@@H](NC(=O)Cc1ccccc1)C(=O)NNc1ccccc1S(=O)(=O)N(C)C	795176520	BSTGVZQTFORTCR-GOSISDBHSA-N	432.546	1.908	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(C)n2)cc1OCC(F)(F)F	797369908	AWFOKIQZEHJDET-UHFFFAOYSA-N	426.351	1.739	50	20	IDGD	
Cc1nnnn1-c1cc(NC(=O)NNC(=O)CNC(=O)OCc2ccccc2)ccc1F	797622067	CTHQKIMWQVSHDR-UHFFFAOYSA-N	442.411	1.189	50	20	IDGD	
Cc1ccc([C@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)cc1	797711353	JQLLDYZCDDFOMK-GJZGRUSLSA-N	440.522	1.078	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(NC(=O)CCn3ccnc3)c2)cc1C	798310979	ZHKRSSMAOLGGOB-UHFFFAOYSA-N	448.483	1.928	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@H]2C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1	798349028	RXCSGCNQGOEWLL-LPHOPBHVSA-N	425.441	1.287	50	20	IDGD	
COc1nccc(NC(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)n1	801725204	IGHWTWKVLGYQKG-UHFFFAOYSA-N	448.486	1.814	50	20	IDGD	
CN(NC(=O)c1cc([N+](=O)[O-])c(F)cc1N)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	801948464	BHVVFMCYUNIJKH-UHFFFAOYSA-N	440.432	1.565	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(C(=O)CCC(=O)NNc3cccc(F)n3)CC2)cc1	804764279	SHYZWBDUVZONTH-UHFFFAOYSA-N	449.508	1.286	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)CCCS(=O)(=O)c2ccc(Cl)cc2)C[C@@H](C)O1	806340192	OKQSYUXBHQGJOT-HUUCEWRRSA-N	445.969	1.541	50	20	IDGD	
COC(=O)c1cc(C)c(NC(=O)C(=O)NNC(=O)c2c(C)nc3ccccn23)c(Cl)c1	806973140	AXJWWOBZJGHIHL-UHFFFAOYSA-N	443.847	1.791	50	20	IDGD	
CC(C)Cn1ncc(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)c1C1CC1	806973482	CXDMRAORSJEQLC-UHFFFAOYSA-N	438.532	1.955	50	20	IDGD	
CCCCCn1nc(C(=O)NNS(=O)(=O)c2cn(C)nc2C)c2ccccc2c1=O	808069892	KGJFHZQHZSREPX-UHFFFAOYSA-N	432.506	1.252	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H]2C[C@H](c3ccccc3)OC2=O)c1	809541980	SGWRRIBEUQSSCZ-IAGOWNOFSA-N	431.470	1.002	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CC[C@]3(CCc4ccccc4O3)C2)cc1OC	810048078	VADONOCPMHWNSK-HSZRJFAPSA-N	425.485	1.935	50	20	IDGD	
COc1ccnc(NNC(=O)CNS(=O)(=O)c2ccc(Cl)c(C(F)(F)F)c2)n1	810090744	WQVLHAHXVDZFIS-UHFFFAOYSA-N	439.803	1.579	50	20	IDGD	
COC[C@@]1(C(=O)OCC(=O)NNC(=O)c2cccc(C)c2)CCN(C(=O)OC(C)(C)C)C1	811399197	HTZODHOORDHOJO-JOCHJYFZSA-N	449.504	1.573	50	20	IDGD	
COC(=O)Cc1cc(Br)ccc1S(=O)(=O)NNC(=O)Cc1cccnc1	811682695	DGYQIIHMMHEYBO-UHFFFAOYSA-N	442.291	1.112	50	20	IDGD	
CN(C)CCCOc1cnccc1CNC(=O)NNC(=O)c1cc([N+](=O)[O-])ccc1O	812396013	KJDZPVMRKDXEJS-UHFFFAOYSA-N	432.437	1.170	50	20	IDGD	
CCOCC(C)(C)CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(CC)CC)c1	812435303	DWKQPGIVJQHXFV-UHFFFAOYSA-N	428.555	1.724	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C2CCC(OC[C@@H]3CCCO3)CC2)c2ccccc2c1=O	814730575	QNCKFUTUABQWDA-JCYILVPMSA-N	442.516	1.932	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NN=C1CCS[C@H]1C)N(S(C)(=O)=O)CC2	814759090	QISWTLXMLUQSLC-LRDDRELGSA-N	441.575	1.950	50	20	IDGD	
Cc1ccnc(Oc2cc(NC(=O)C(=O)NNC(=O)[C@@H]3CCc4nncn4C3)ccc2C)c1	815691852	CWFWXNPNUIERQF-OAHLLOKOSA-N	449.471	1.431	50	20	IDGD	
COC(=O)c1cc(NNC(=O)C2CCN(S(=O)(=O)c3cccnc3)CC2)ccc1C	816687664	JMWFAYAEEAMZON-UHFFFAOYSA-N	432.502	1.721	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCc2ccccc2CN2CCCC2=O)cc1OC	913636204	SJBJYHKFJWVGNX-UHFFFAOYSA-N	426.473	1.970	50	20	IDGD	
CCn1c(=O)nc(O)c2c(C(=O)NNC(=O)c3cccc(N(C)C)c3)cc(C(C)C)nc21	914436900	DWACDTPNVSSUIE-UHFFFAOYSA-N	438.488	1.781	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)c1cccc(C(=O)NNC(=O)c2ccccc2C)n1	915062440	PWIATWMXCRJXDQ-UHFFFAOYSA-N	431.452	1.848	50	20	IDGD	
CNS(=O)(=O)c1ccc(CNC(=O)NNC(=O)Cc2cccc3ccccc23)s1	916233006	XPUGHGMIDCCSKH-UHFFFAOYSA-N	432.527	1.883	50	20	IDGD	
O=C(NCc1ccc(C(=O)N2CCOCC2)cc1)NNC(=O)c1cc2c(s1)CCC2	916247945	YAYFCUPNRHCZBU-UHFFFAOYSA-N	428.514	1.853	50	20	IDGD	
CNC(=O)c1cccc(CNC(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)c1	916603304	JIVVGBCWHXKRBS-UHFFFAOYSA-N	436.472	1.481	50	20	IDGD	
COc1cccc(OCC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1	916743075	GEWVFBSPFSAVLT-UHFFFAOYSA-N	433.486	1.320	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(C(=O)CNS(=O)(=O)c2ccc(CCCl)cc2)CC1	917929757	FUZCGHKPHOBUKW-UHFFFAOYSA-N	445.969	1.826	50	20	IDGD	
CCCn1c(CCC(=O)NNC(=O)NC)nc2cc(S(=O)(=O)N3CCCC3)ccc21	919879556	NVFNAVCGDUJKSG-UHFFFAOYSA-N	436.538	1.124	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)c1ccc([S@](C)=O)cc1	1116382644	BRBJBVBKSLOHPO-SSUCQYSQSA-N	427.486	1.376	50	20	IDGD	
O=C(NNC(=O)N1CCC(CC(=O)N2CCCC2)CC1)C1CCN(c2ncccn2)CC1	1251629475	MYGVTJLLENILFP-UHFFFAOYSA-N	443.552	1.158	50	20	IDGD	
CN(c1ccc(CNC(=O)NNC(=O)c2cncn2-c2ccccc2)cc1)S(C)(=O)=O	1318720179	WATWLLQVEWBOGA-UHFFFAOYSA-N	442.501	1.412	50	20	IDGD	
Cc1nn(C)cc1CCC(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	1319205256	CRZQWCSPWYNTMS-UHFFFAOYSA-N	432.956	1.280	50	20	IDGD	
Cc1n[nH]c(C)c1CC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Br)C1	1780776965	MROSIMGWAICYBB-QGPMSJSTSA-N	445.333	1.773	50	20	IDGD	
CN(C)c1cncc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](F)Br)C3)C2)c1	1781326323	NHPICTNSYMKVHT-WMLDXEAASA-N	429.290	1.282	50	20	IDGD	
O=C(c1ccc2c(c1)COC2)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781329828	KVXUIOAOQVBUMU-QAPCUYQASA-N	427.270	1.851	50	20	IDGD	
COc1cnc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](C)Br)C2)cn1	1781996124	BHHHLKFZJRIFMJ-RVZJWNSFSA-N	441.326	1.396	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)n1cccn1)C2	1782002893	WUEWBWRRKYLVQI-ATNYBXOESA-N	427.343	1.741	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H]3CC(c4ccccc4)=NN3)C2)C1	1782601021	GAIFJXDBTZYZKW-UGKGYDQZSA-N	444.608	1.434	50	20	IDGD	
O=C(c1cn[nH]c1)N1CCO[C@]2(CCN(C(=O)[C@H](Br)Cc3ccccc3)C2)C1	1783022567	JYVXPVGESFTHPT-XLIONFOSSA-N	447.333	1.859	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cnoc3COC)CCO2)C1	1783348302	XXJOXTFQHFZCBM-DYVFJYSZSA-N	430.299	1.438	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ncn(-c4ccccc4)n3)CCO2)C1	1783534202	GKCYTQKRIBYTSZ-LIRRHRJNSA-N	448.321	1.494	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cc(-c4ccncc4)[nH]n3)CCO2)C1	1783877462	JCKDUMHUWGYDIA-FOIQADDNSA-N	433.896	1.169	50	20	IDGD	
O=C(c1cccc(N2CCOCC2)n1)N1CCO[C@@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783945125	DJBKLNDCMYMCDG-LJQANCHMSA-N	443.331	1.165	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccn(C)c3=O)C[C@@H]21	1783970406	YVVKXRISXVDFNT-SDADXPQNSA-N	440.338	1.010	50	20	IDGD	
C[C@H](Oc1ccccn1)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2	1784489116	UWCYHUWMVPHLFA-GDIGMMSISA-N	430.332	1.915	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3cncnc3)[C@H]2C1	1785390401	QFPBYNOUTGBGAY-OEAJRASXSA-N	425.327	1.030	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3c(C)noc3N)[C@H]2C1	1786840778	RYRFSSIUNPYTMJ-RVMXOQNASA-N	429.315	1.332	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)c1cccn2cncc12	1788421262	IOBVXQBHDOBGQK-QRTARXTBSA-N	435.322	1.713	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(C(F)(F)F)n3)[C@H]2C1	1788879571	KRLNFDVFVOQLLG-XPCVCDNBSA-N	449.857	1.948	50	20	IDGD	
CCc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](Br)CC)C[C@@H]32)n(C)n1	1788946253	QEXZCVQXEIBNDH-FAYQHZLMSA-N	441.370	1.749	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)c1ccccc1C(F)(F)F	1789490853	WCDZCHVLCCUVDQ-YUDUHTQSSA-N	434.842	1.898	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C[C@@H](N)c3cccnc3)C[C@@H]21	1789866269	MUXFANMXDMEWEV-GHHWKCCRSA-N	443.375	1.688	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)Oc3ccccn3)[C@H]2C1	1791626278	AADNXVVTBYYAOO-QRJUGERDSA-N	440.338	1.612	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)Nc1ccccn1)C2	1792870682	IIVNRSPCDJWAGF-LBKYZSNHSA-N	439.354	1.503	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1CCN(c2ccccc2)CC1	1792907237	ZBNWVLHKSXVZCY-YHELAOLJSA-N	449.979	1.746	50	20	IDGD	
Cc1ccc(-c2ncccc2C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](O)CCl)cc1	1792976686	JMFABHOGCYLJOU-HNJRGHQBSA-N	443.931	1.860	50	20	IDGD	
CC[C@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2)N(CC)CC	1793689480	MRMAZEKETUWUDC-KNTBSYDBSA-N	444.580	1.879	50	20	IDGD	
CN[C@@H](CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C(C#N)=C/c1ccc(F)cc1F)C2)C(=O)O	1796095453	PKOXAKIOYKKDDM-OSCSVHATSA-N	446.454	1.573	50	20	IDGD	
Cc1ccc2cc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)c3ccc(B(O)O)cc3)C4)ccc2n1	1797534592	VAXHNMSIHSTERY-KOUNCHBCSA-N	443.312	1.789	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C=C1\C(=O)Nc2ccccc21	1797660317	FIILEXLLXGGBNA-BKDZVLTGSA-N	448.317	1.395	50	20	IDGD	
COc1ccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CO[Si](C)(C)C)cc1F	1797956750	XWYWHNFFINKUAC-VPTLXERWSA-N	438.572	1.818	50	20	IDGD	
COc1ccc2oc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)c3ccc(B(O)O)cc3)C4)cc2c1	1798001937	IXWXOGWJPMBXIP-REPLKXPHSA-N	448.284	1.687	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(Cl)ccn1	1798049458	GWAOHGBTCPLXRI-MCYUEQNJSA-N	430.730	1.969	50	20	IDGD	
C=CCC[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2	1799321516	CYJQJDMUNLGFSR-YIDVYQOGSA-N	447.935	1.970	50	20	IDGD	
COC(=O)CCCCCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Br	1799352054	JNWJTSYEGKVNJX-VZAMPYOESA-N	437.306	1.390	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CC(c2ccccc2)=NN1	1800158717	XTUVNQVWYZROKL-IVFVNLKQSA-N	449.349	1.126	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](Br)CC)C2	1800233270	LXWAEQQRKQHEOQ-PEBLQZBPSA-N	435.315	1.311	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccon1)C2	1800332441	LDFPWZCOVKVQII-ODLYAQKHSA-N	428.395	1.763	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(F)c(C)n1)C2	1800639108	IGSXEAOIVQHVQE-OQMKEHIESA-N	428.302	1.906	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cn1cnc2ccccc21	1800886519	PRVOYJCHNGIUQD-BKEDOTJMSA-N	449.349	1.657	50	20	IDGD	
CCOC(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@](C)(Cl)CCl)C2)OCC	1801149586	QMGYCINWHRKSFR-ZDFLXESQSA-N	425.353	1.602	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)n2ccnn2)[C@@H]1c1cccnc1	1803013828	AOALTCDYNDRERF-TXCZRRACSA-N	449.353	1.971	50	20	IDGD	
N#Cc1cc(CC(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)ccc1F	1803141944	WDQXDRKJOJTINF-LKUPVBHCSA-N	444.894	1.941	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H](CNC(=O)CN2CCOC2=O)[C@@H]1c1cccnc1	1803337166	NCBAPFLAKOHCQU-ALKREAHSSA-N	443.331	1.776	50	20	IDGD	
O=C(/C=C/C1CCCC1)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1808482436	WWQZIUVRWGLFTC-MEPGCTBYSA-N	447.344	1.827	50	20	IDGD	
Cc1[nH]ccc1C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1808750002	MMYLLYDCJUVNQO-WIYYLYMNSA-N	432.289	1.031	50	20	IDGD	
Nc1n[nH]c(CCC(=O)NC[C@@H]2CCN(C(=O)C(Cl)Cl)[C@H]2c2cccnc2)n1	1810156874	LCKQGYIEELYZLT-FZMZJTMJSA-N	426.308	1.224	50	20	IDGD	
CC(C)O[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1810434963	HSKYXXLEAMMZJW-PLMTUMEDSA-N	433.553	1.274	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCC2(CCCN(C(=O)c3cc(=O)n4[nH]nnc4n3)C2)CC1	1810489180	INZPVYHZIRLBOF-CYBMUJFWSA-N	435.916	1.065	50	20	IDGD	
Cc1cnoc1C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1	1811246330	MLBOLXKWJFUCKG-QAPCUYQASA-N	449.471	1.010	50	20	IDGD	
COCCn1ccc(C(=O)N2CC[C@H](CNC(=O)[C@H](Cl)COC)[C@H]2c2cccnc2)n1	1813030341	HXHCOCUHPLMCDH-ZHALLVOQSA-N	449.939	1.498	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)/C=N/N2CCCCC2)[C@H]1c1cccnc1	1813030701	FXNMKWKDFVURPX-LVPXVQOHSA-N	435.956	1.813	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)CCC(=O)N2CCCC2)[nH]n1)[C@H](O)CCl	1814867311	HUFXMPDTPRHAGL-HUUCEWRRSA-N	425.917	1.404	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)Cn2cc([N+](=O)[O-])cn2)n[nH]1	1815823818	WFURRDKOIJUYKD-GXTWGEPZSA-N	439.860	1.461	50	20	IDGD	
Cc1ccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)cn1	1817470792	HGDFVEDKGPTAKP-LJQANCHMSA-N	433.277	1.413	50	20	IDGD	
C=CC[C@H](C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819403846	ILXBJRJHOPRRNM-GUYCJALGSA-N	425.493	1.926	50	20	IDGD	
O=C(COC(=O)C(F)(F)F)Nc1nc2c(s1)C[C@@H](NC(=O)C(Cl)Cl)CC2	1819616792	YRCNLEBQJOXYCR-YFKPBYRVSA-N	434.223	1.964	50	20	IDGD	
C[Si](C)(C)OCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(C(=O)O)ncn1)CC2	1820160853	HIDGDSPZQFGJIC-SNVBAGLBSA-N	449.565	1.709	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](O)c2ccco2)[nH]n1	1822412199	NFPICZWPXSMNNX-AUUYWEPGSA-N	432.481	1.101	50	20	IDGD	
O=C(Cc1cncnc1)N[C@@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1	1823001761	LQMFQRVFRYVLEV-NOZJJQNGSA-N	428.287	1.778	50	20	IDGD	
C[C@]1(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)CC1(F)F	1823394194	QANXNJOFTDLGFD-DNVCBOLYSA-N	432.236	1.441	50	20	IDGD	
CCOC(=O)C1(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@H](Cl)COC)CC3)CC1	1824869635	YBNPZDGVRLQNGL-GHMZBOCLSA-N	429.926	1.652	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(O)ncn1)CC2	1825636509	WJUGCMSLDFAQLL-JGVFFNPUSA-N	426.296	1.648	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(O)ncn1)CC2	1825636511	WJUGCMSLDFAQLL-YUMQZZPRSA-N	426.296	1.648	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)c2cccs2)CC1	1825776736	JIENPTDVRHAYNJ-IBGZPJMESA-N	426.347	1.975	50	20	IDGD	
C[C@]1(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2cccc(B(O)O)c2)CC3)CC=CCC1	1827221481	OSSQJWHJFVBJTR-ZHRRBRCNSA-N	439.346	1.795	50	20	IDGD	
C#CCCCC(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1	1828925859	QIIGFKOTKJUMNA-HXUWFJFHSA-N	425.533	1.722	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)C1(O)CCC1)CCO2	1829746829	TZIULRBJDAKCNU-RVKKMQEKSA-N	447.370	1.167	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(C4CC4)on3)CCO2)C1	1830198523	AWQTZDPBSYSYCA-RTBURBONSA-N	446.331	1.858	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)Cn2cc(C)c(O)nc2=O)CC1	1830314156	BYJVPEHCJHCMSI-SJORKVTESA-N	438.956	1.894	50	20	IDGD	
O=C(C#Cc1ccc(Cl)cc1)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1830469804	HPOLFAPSEDZTDK-IBGZPJMESA-N	445.730	1.952	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccnc(F)c3)C2)C1	1830534592	CDFQIXFQLPXWEV-UGSOOPFHSA-N	444.301	1.322	50	20	IDGD	
O=C([C@H](F)Cl)N1CCOC[C@]2(C1)CN(C(=O)C1(c3ccc(O)cc3)CC1)CCO2	1830811723	YPDCALPTUYATKY-LPHOPBHVSA-N	426.872	1.415	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)/C=C/c3ccc([N+](=O)[O-])o3)CCO2)C1	1830910035	HSVWCMTVNNSIKP-GJWPRGSGSA-N	441.868	1.675	50	20	IDGD	
CC1CCN(CC(=O)N2CCO[C@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)CC1	1831104363	OZIIGHXADFLTBS-OAQYLSRUSA-N	441.645	1.026	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ncc(Cl)cn3)C2)C1	1831644080	NNMCJZRWKQUPRT-RDTXWAMCSA-N	431.320	1.608	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3c(C)n[nH]c3C)C2)C1	1831654488	UCOGSDRDQFTJGM-XLIONFOSSA-N	426.945	1.433	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cn(C)nc2OC)CC1	1831828745	TYQREBJRUZDYJZ-SJORKVTESA-N	426.945	1.916	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1)[C@H](O)c1ccco1	1833086617	MAQKQJOHLAFLEP-GOSISDBHSA-N	442.354	1.670	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cncc(F)c3)CCO2)C1	1834360032	RJPFHPHOLGFIFU-QZTJIDSGSA-N	434.295	1.527	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)c3[nH]cc4c3CCC4)C2)C1	1834823258	LQEUTEWONXVIJM-LJQANCHMSA-N	440.338	1.358	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cnc(O)nc3O)CC2)CC1	1835072160	GYOAVUBVBGTQQY-HNNXBMFYSA-N	425.917	1.090	50	20	IDGD	
O=C(C#Cc1ccccc1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1835102000	MNBCIZYBEXVEDS-PKOBYXMFSA-N	439.281	1.185	50	20	IDGD	
CNc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)cc1	1835608231	UNVTVHFZZVXVBX-MAUKXSAKSA-N	444.301	1.489	50	20	IDGD	
Cc1nnc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)s1	1836075503	RQKJXLLCANZFJL-SFHVURJKSA-N	430.958	1.110	50	20	IDGD	
CC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)[C@H](C)N3C[C@H]4C[C@@H]4C3)CC2)CC1	1836397356	YCCOHKZSVMEMFZ-XLSPSMHOSA-N	425.017	1.916	50	20	IDGD	
O=C(c1n[nH]c(C2CC2)c1F)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836715314	PIHVXHNOKKLNPI-OAHLLOKOSA-N	442.919	1.638	50	20	IDGD	
O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(Cl)ccn1)CCO2	1837863149	ZVJPZPVANMNTIN-QGZVFWFLSA-N	446.729	1.590	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cc(=O)ccn3C)CC2)CC1	1838529465	JOHBBZSMFMAFAV-GOSISDBHSA-N	439.940	1.251	50	20	IDGD	
COc1cccc(OC)c1C(=O)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1838883209	STVFJZLBSGBAJL-IBGZPJMESA-N	447.315	1.578	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1	1839020772	URYXWVFEPZMSIE-BEFAXECRSA-N	447.315	1.018	50	20	IDGD	
COC(=O)c1ccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)s1	1839035054	UICDRHHLPPLPMN-YJBOKZPZSA-N	448.900	1.068	50	20	IDGD	
Cc1cncc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)c1	1839197767	IBDPWZFUEHHHHR-YOEHRIQHSA-N	430.274	1.151	50	20	IDGD	
CCOC(=O)c1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)cc1	1839445530	XQIOHFKAOSRUCB-UZLBHIALSA-N	442.871	1.468	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)C[C@@H]3C[C@@H]4CC[C@H]3C4)CCO2)C1	1839915832	BIBHSQPLQKOLGE-DLUQJKKWSA-N	428.957	1.523	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CC(F)(F)F)C2)C1	1839963305	HLMMIPHVXBUBIM-BXUZGUMPSA-N	431.249	1.569	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3cccc(O)c3)CCO2)C1	1840268283	PJADOYUTFPAJOF-RXVVDRJESA-N	440.924	1.035	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3ccoc3)CCO2)C1	1840512560	DEASECYRXPYITI-DNVCBOLYSA-N	443.338	1.700	50	20	IDGD	
CC(C)N1CCC[C@H]1C(=O)N1CCO[C@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1	1840583281	FUTCFAWIMASGAF-RXVVDRJESA-N	441.645	1.167	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(F)c(OC)c3)CCO2)C1	1840683318	FBEPXYZXWBLPKM-QRWLVFNGSA-N	444.887	1.158	50	20	IDGD	
C[C@@H](C(=O)N1CCCC12CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)C2)n1ccnn1	1845815657	YTGHXAAYAUZEEA-FSEGOYHTSA-N	426.427	1.928	50	20	IDGD	
COC(OC)C(=O)N1CC2(CCCN2C(=O)[C@@H](Br)Cc2ccccc2)C1	1845940422	OXXCWQKQIRUOES-HNNXBMFYSA-N	425.323	1.815	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1ccc2nc(CO)[nH]c2c1	1847501770	XETJCJRSBVNZHA-UVBJJODRSA-N	435.322	1.902	50	20	IDGD	
CC(=O)N[C@H](CC(=O)NNC(=O)c1csc(N2CCOCC2)n1)c1ccc(C)cc1	10292313	CYXZIJRGQOGHFL-MRXNPFEDSA-N	431.518	1.317	50	20	IDGD	
O=C(COC(=O)CCCc1nc2ccccc2c(=O)[nH]1)NNC(=O)c1ccc(Cl)cc1	11039478	QLCNISLFXNRSSJ-UHFFFAOYSA-N	442.859	1.904	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])cc1	21290925	SZKWQDUCOUPMJZ-UHFFFAOYSA-N	442.457	1.856	50	20	IDGD	
CC(C)N(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)c2cc(Br)c[nH]2)cc1	26075100	HLPVCBZDVRKGEC-UHFFFAOYSA-N	443.323	1.881	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)Cc1c(C)nc2nc(SC)nn2c1C	26736578	RZJTYOPAMSBQFX-UHFFFAOYSA-N	444.517	1.631	50	20	IDGD	
O=C(CN1C(=O)c2cccc([N+](=O)[O-])c2C1=O)NNC(=O)c1cc(-c2ccccc2)on1	27258732	GMSXJSGYECTJKV-UHFFFAOYSA-N	435.352	1.307	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)c1cc(S(=O)(=O)N2CCCC2)c(C)o1	107928040	ZYPHMWHAWZEZIS-UHFFFAOYSA-N	436.490	1.254	50	20	IDGD	
O=C(NNC(=O)c1ccn(-c2ccccc2Cl)n1)c1csc(N2CCOCC2)n1	109593789	MVQKXPHEODKPEB-UHFFFAOYSA-N	432.893	1.894	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)CCNC2=NS(=O)(=O)c3ccccc32)c2ccccc2n1	115342127	QIQRKHYNPUPOKK-UHFFFAOYSA-N	437.481	1.433	50	20	IDGD	
CSCC[C@H](NC(=O)c1ccccc1)C(=O)NNC(=O)CNC(=O)c1cccs1	725740979	KGULERCDYNFWNY-AWEZNQCLSA-N	434.543	1.177	50	20	IDGD	
C#Cc1cccc(NC(=S)NNC(=O)CN2C(=O)N[C@](C)(c3ccc(C)cc3)C2=O)c1	727498644	XNEXYUBWAMFADB-JOCHJYFZSA-N	435.509	1.761	50	20	IDGD	
NC(=O)c1ccc(/C=C\C(=O)N2CCC[C@@H]2C(=O)NNC(=O)CCCc2ccccc2)cc1	727715505	RANLPHSMTMEKKJ-QTIWRUEGSA-N	448.523	1.960	50	20	IDGD	
Cc1nc(C(C)(C)C)sc1C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	728340456	XEGNZZSKWKTBIO-AWEZNQCLSA-N	433.486	1.893	50	20	IDGD	
CCOc1ccc(C(=O)CCC(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)cc1OCC	728382548	YCSCRDJWKQPTBB-AWEZNQCLSA-N	426.491	1.029	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN1S(=O)(=O)c1cccs1)c1cccc(OC(F)F)c1	728486432	YVXADMLGVPDFPK-ZDUSSCGKSA-N	445.469	1.964	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)Cn2c(=O)nc(O)c3ccccc32)c1	728609322	YWAMRJJQYFJZKC-UHFFFAOYSA-N	447.245	1.334	50	20	IDGD	
C[C@H]1C[C@@H](C)CN(C(C)(C)CNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)C1	728949873	WMSRWXFSRNLXFO-CALCHBBNSA-N	431.585	1.780	50	20	IDGD	
CN(CC(=O)N1CCCC1)C(=O)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1	729226798	DFPZAAYLZQBPQC-QFIPXVFZSA-N	449.555	1.909	50	20	IDGD	
Cc1nnc(NNC(=O)CC[C@@H]2NC(=O)N(c3ccc(Cl)c(Cl)c3)C2=O)nc1O	730585860	QYSAZJRTVNGTDF-NSHDSACASA-N	440.247	1.541	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)[C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])o2)cc1C	731874751	SQFQRXFHPNYEFM-OAHLLOKOSA-N	430.417	1.636	50	20	IDGD	
O=C(NCCCNC(=O)c1ccc(F)cc1)NNC(=O)c1cc(Br)c[nH]1	732236098	OWIRNQGQONBKTQ-UHFFFAOYSA-N	426.246	1.680	50	20	IDGD	
CSCC[C@H](NC(=O)Cc1ccccc1)C(=O)NNC(=O)c1c(C)nc2ccccn12	732751052	JALANOSQKPSEFF-KRWDZBQOSA-N	439.541	1.884	50	20	IDGD	
CCOCCCN1CC[C@@H](NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)[C@@H](C)C1	734544343	QZCBNBMLOKMPSH-MAUKXSAKSA-N	440.566	1.171	50	20	IDGD	
C[C@@H](NC(=O)C1CCCC1)C(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	734826005	SQKXCTOHVACVOW-CYBMUJFWSA-N	425.530	1.411	50	20	IDGD	
Cc1ccc(CCNC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc1	734946962	PZKCDFHLYQLDJC-UHFFFAOYSA-N	430.530	1.966	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H]2C[C@@H]2c2c(F)cccc2F)c1	734947726	YWJXLXXSTPVHSA-BBRMVZONSA-N	438.456	1.715	50	20	IDGD	
Cn1cc(N2CC[C@@H](NC(=O)NNC(=O)c3ccc(F)cc3Br)C2=O)cn1	735584762	YVSMFZPCHDLIIB-CYBMUJFWSA-N	439.245	1.071	50	20	IDGD	
CC(=O)NCC(=O)N1CCc2cc(C(=O)NNC(=O)[C@@H](C)Oc3ccc(F)cc3)ccc21	735647134	HTLDPHZFTONXLU-CYBMUJFWSA-N	442.447	1.079	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)C1(S(=O)(=O)c2cc(C)ccc2C)CCCC1	740851447	FRKNCZNHNRHPBI-UHFFFAOYSA-N	437.562	1.842	50	20	IDGD	
C[C@@H](CC(=O)NNc1nc(-c2ccccc2)no1)/N=C1/NS(=O)(=O)c2ccccc21	742658463	UBCGMNOHFMTFCB-LBPRGKRZSA-N	426.458	1.697	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)N1CCCC1=O	743284342	BXJVTCLMXQUPIZ-KRWDZBQOSA-N	436.534	1.023	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(N3CCCS3(=O)=O)cc2C)cc1C	743821750	ZBLFBHBRUBSQAL-UHFFFAOYSA-N	444.513	1.551	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)c2ccc3c(c2)CCCN3S(C)(=O)=O)cc1	743828502	PCGIXNBSSRRIFO-UHFFFAOYSA-N	431.518	1.931	50	20	IDGD	
C[S@](=O)CCNC(=O)NNc1ccc(S(=O)(=O)NC2CCCCCCC2)cn1	745848440	NECLWFLJCYWFRZ-MHZLTWQESA-N	431.584	1.477	50	20	IDGD	
O=C(NCCc1cccs1)NNC(=O)[C@@H]1C[C@@H](O)CN1C(=O)OCc1ccccc1	746166902	KEYHICWWKURRMY-WBVHZDCISA-N	432.502	1.393	50	20	IDGD	
COCCNS(=O)(=O)c1c[nH]c(C(=O)NNC(=O)c2c(Cl)cccc2Cl)c1	746210631	RDCKWXCUIXOKHX-UHFFFAOYSA-N	435.289	1.321	50	20	IDGD	
CCn1c(NNC(=O)CCOc2ccc(S(C)(=O)=O)cc2)nc2ccccc2c1=O	746516794	ASOXOWVIYDWQSM-UHFFFAOYSA-N	430.486	1.732	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)Cc1cn2ccccc2n1)c1cccc(S(=O)(=O)N(C)C)c1	746760625	FFGCFYFLTBLSLR-CQSZACIVSA-N	444.517	1.219	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)CN2C(=O)c3cccc([N+](=O)[O-])c3C2=O)o1	747714988	BJBZNOINBBWCID-UHFFFAOYSA-N	443.416	1.087	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)NCCC(=O)N1CCN(c2ccccc2)CC1	748465605	PBKRDTVCBBHQSN-UHFFFAOYSA-N	443.479	1.274	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2ccc(CC(=O)O)cc2)cc1Br	748642563	GRILKFXXUZPTCI-UHFFFAOYSA-N	443.275	1.708	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)[C@H]2CCCN2S(=O)(=O)c2cccs2)cc1	749262671	YERPSWDSRPKTPW-OAHLLOKOSA-N	438.531	1.169	50	20	IDGD	
CC[C@@H](Oc1ccccc1C)C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	749332526	BABIQSCVODBJMQ-CQSZACIVSA-N	425.894	1.914	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)CNS(=O)(=O)c2ccc(Cl)s2)c1C	749838083	OCBUMRUMQQOTNE-LBPRGKRZSA-N	445.950	1.912	50	20	IDGD	
CC(C)(C)NC(=O)CN1CCC(CNC(=O)NNC(=O)COc2ccccc2F)CC1	751111480	MKDLFNXKQIVLRB-UHFFFAOYSA-N	437.516	1.162	50	20	IDGD	
O=C(NNC(=O)c1cc(Cn2cc(Br)cn2)on1)c1ccc2c(c1)OCO2	751541397	WFOLRBZBMBUYEF-UHFFFAOYSA-N	434.206	1.485	50	20	IDGD	
COc1cc(OC)cc(N2C[C@@H](C(=O)NNC(=O)[C@H](C)Oc3ccc(F)cc3)CC2=O)c1	752400861	WEOXGOVQMBTBIA-KBPBESRZSA-N	445.447	1.811	50	20	IDGD	
COC(=O)c1c(Br)ccc(NC(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)c1C	753211175	KPDQZIHHKFXMMJ-SECBINFHSA-N	448.295	1.132	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)c2cccnc2Oc2ccccc2C(N)=O)cc1	753514570	HHGWCSHVLYWZDZ-UHFFFAOYSA-N	448.435	1.899	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)NC[C@H]1CCN(S(C)(=O)=O)C1	753660550	MEPFEYOIRQNGLJ-HUUCEWRRSA-N	434.518	1.219	50	20	IDGD	
C[C@@H](Sc1ccccn1)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	754217658	GGXPMZJPNQJHFR-CQSZACIVSA-N	434.543	1.808	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccc(O)cc3)CC2)cc1C	754640014	PXLTVKZMQYNHIR-UHFFFAOYSA-N	430.530	1.544	50	20	IDGD	
CN(C)c1ccc(S(=O)(=O)N2CCCCC2)cc1NC(=O)NNC(=O)c1ccncc1	755436876	WPFNFYJFATXFCO-UHFFFAOYSA-N	446.533	1.789	50	20	IDGD	
COc1cc(CN2CC[C@@H](NC(=O)NNC(=O)Cc3ccc(F)cc3)C2)cc(OC)c1	756104999	XNKONKVCORTWIP-GOSISDBHSA-N	430.480	1.990	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)Nc1cc(Cl)ccc1N1CCSCC1	756281346	SADPYSAJUDUDHC-LLVKDONJSA-N	432.955	1.481	50	20	IDGD	
CNC(=O)Cn1ccc2ccc(NC(=O)NNC(=O)COc3ccccc3[N+](=O)[O-])cc21	756761222	MGYNQBKEFZLTHC-UHFFFAOYSA-N	440.416	1.527	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)Nc2ccc(OC)c(NS(C)(=O)=O)c2)cc1	756781380	CCHCJQBJHFJPIL-UHFFFAOYSA-N	436.490	1.861	50	20	IDGD	
CSCC[C@H](NC(=O)OC(C)(C)C)C(=O)NNc1nccc(N2CCOCC2)n1	756787667	SHHVMHCBRNTZEG-ZDUSSCGKSA-N	426.543	1.403	50	20	IDGD	
NC(=O)c1ccc(NNC(=O)c2cccc(NC(=O)c3ccc(Br)o3)c2)nn1	757392019	JMHLOSZIKSGDTG-UHFFFAOYSA-N	445.233	1.940	50	20	IDGD	
COc1ncc(NC(=O)NNC(=O)c2ccc(COc3ccccc3)o2)cc1C(N)=O	757691080	CBARIYTVZGRDML-UHFFFAOYSA-N	425.401	1.828	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)Nc1ccc2nc(N3CCOCC3)oc2c1	757776196	BUQVLWVVNUFENV-UHFFFAOYSA-N	449.431	1.107	50	20	IDGD	
Cc1cc([N+](=O)[O-])c(C)c(S(=O)(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c1	758147256	IZVUABOISPRVDK-UHFFFAOYSA-N	427.460	1.238	50	20	IDGD	
Cc1c(C(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)cnn1-c1ccccn1	758786246	KNPVFEYYRWXIKP-UHFFFAOYSA-N	443.508	1.825	50	20	IDGD	
Cc1ccc(C)c(-n2c(C)nnc2SCC(=O)NNC(=O)C(=O)Nc2ccccn2)c1	758838086	AOOBFKKUCSPKOX-UHFFFAOYSA-N	439.501	1.466	50	20	IDGD	
O=C(COC(=O)c1cn(Cc2cccc(F)c2)nn1)NNC(=O)c1cccc(Cl)c1	759444677	MPYQULJQVCLLGF-UHFFFAOYSA-N	431.811	1.737	50	20	IDGD	
CC(=O)N(C)c1ccccc1NC(=O)C(=O)NNC(=O)c1ccccc1Br	763484114	XUVXMUKDPXYVHO-UHFFFAOYSA-N	433.262	1.832	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)N[C@@H]1CC(=O)N(CCOc2ccccc2)C1	763507402	AUQBLHSCQRZHQP-OAHLLOKOSA-N	444.513	1.495	50	20	IDGD	
CCC(=O)Nc1ccc(C)c(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1	763570781	HVFHNOXRZOCSQN-KRWDZBQOSA-N	426.429	1.269	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)[nH]n1)C(=O)Nc1ccc(OCC(F)(F)F)nc1	763601443	QWOZIFWPNDUHOT-UHFFFAOYSA-N	448.361	1.813	50	20	IDGD	
CCOC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2OC)cc1	763658070	URKOXQXXXYEJMD-UHFFFAOYSA-N	430.417	1.429	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)cc1Br	763675490	XNOKWCTXFGWWFD-UHFFFAOYSA-N	447.245	1.494	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(F)c(Cl)c2)c1	763717908	CMWWVRDHTYDVLZ-UHFFFAOYSA-N	442.856	1.129	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)CC(C)(C)O3)c2ccccc2c1=O	763791540	VISOAVATEGEFKZ-UHFFFAOYSA-N	435.440	1.047	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)CNC(=O)c2cccnc2)c2ccccc2c1=O	763818757	OKGVRJQQEPNZQC-UHFFFAOYSA-N	436.472	1.173	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)CC(=O)N3)cc1	763862516	XWGLUVYEKCJVSW-GFCCVEGCSA-N	426.429	1.133	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)NNC(=O)C(=O)Nc1ccc(CCN2CCOCC2)cc1	763865492	QTYYZVUSIHVBSN-UHFFFAOYSA-N	449.511	1.371	50	20	IDGD	
COCCn1cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2c(C)cc(Cl)cc2C)cn1	763880817	BUDSXHCLBODZDE-ZDUSSCGKSA-N	437.884	1.353	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@H](C)C(=O)NNC(=O)C(=O)Nc1cnn(CC(F)F)c1	763882278	IHKHKOABXWUPPF-LLVKDONJSA-N	443.838	1.972	50	20	IDGD	
O=C(NNC(=O)c1cc2c(s1)CCCCCC2)C(=O)Nc1ccc(-n2cnnn2)cc1	763910633	BPJYZFGQTXCMOY-UHFFFAOYSA-N	439.501	1.783	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl	763944034	KMOIBRHXADQVQM-UHFFFAOYSA-N	444.791	1.539	50	20	IDGD	
O=C(NNC(=O)c1ccc(COc2ccccc2)o1)C(=O)Nc1ccnn1-c1ccncc1	763954931	ACBMFTZVSYJDHZ-UHFFFAOYSA-N	446.423	1.839	50	20	IDGD	
COc1ccc(C(=O)N2CCCC2)cc1NC(=O)C(=O)NNC(=O)c1ccccc1OC	764042120	BFUJOAORJKYJEV-UHFFFAOYSA-N	440.456	1.340	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2O1)C(=O)Nc1ccc(Cl)c(C(=O)NC2CC2)c1	764153622	MPAHRYIBNRDSPM-QGZVFWFLSA-N	442.859	1.322	50	20	IDGD	
Cc1ncsc1C(=O)NNC(=O)C(=O)Nc1cccc(CN2C[C@H](C)O[C@H](C)C2)c1	764247199	ORVFYSSXGHZYRH-BETUJISGSA-N	431.518	1.460	50	20	IDGD	
COCCn1ncc2ccc(NC(=O)C(=O)NNC(=O)CCc3ccccc3O)cc21	764280746	GBJAEBALRJLEFI-UHFFFAOYSA-N	425.445	1.107	50	20	IDGD	
COC(=O)CSCc1cccc(NC(=O)C(=O)NNC(=O)Cc2ccccc2F)c1	764320559	JZFODHLITGHYBA-UHFFFAOYSA-N	433.461	1.561	50	20	IDGD	
CC[C@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)COCc2ccccc2)cc1	764367612	YPBSMTWSYZNWIT-HNNXBMFYSA-N	426.473	1.518	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)cc1C(=O)NC(C)C	764379019	OTCZWMRMBTWYIM-UHFFFAOYSA-N	448.426	1.891	50	20	IDGD	
O=C(NNC(=O)C(F)(F)Oc1ccccc1)C(=O)Nc1cccc(CN2CCCC2=O)c1	764379838	MDNAYYZMSQJSNS-UHFFFAOYSA-N	446.410	1.567	50	20	IDGD	
Cc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NNC(=O)c1cc(-c2cccs2)[nH]n1	764385379	ZWOPCTMVPIJPSZ-UHFFFAOYSA-N	440.485	1.548	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1)C(=O)Nc1cccnc1Br	764386864	DSZFSJGTLSDZNQ-UHFFFAOYSA-N	447.224	1.773	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1ccccc1O[C@@H]1CCOC1	764393515	PQQFAFNWZLCADE-CQSZACIVSA-N	445.497	1.741	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2F)cc1NS(C)(=O)=O	764410389	NOFWRFDBEYFOPH-UHFFFAOYSA-N	442.856	1.559	50	20	IDGD	
O=C(NNC(=O)[C@H]1COCCO1)C(=O)Nc1cccc(CSCc2ccccc2)c1	764426681	VUJDIOJTYYIGOC-GOSISDBHSA-N	429.498	1.621	50	20	IDGD	
Cc1c(C(=O)O)oc2c1C(=NNC(=O)CN1CCN(C(=O)c3ccccc3)CC1)CCC2	764829970	JDXAHJBGFXSYNZ-UHFFFAOYSA-N	438.484	1.901	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)[C@H](O)c1ccccc1Cl	765125123	ACZMKAYJWUUYFJ-QGZVFWFLSA-N	425.894	1.538	50	20	IDGD	
Cc1[nH]c(-c2ccncc2)nc(=O)c1CCC(=O)NNC(=O)CSc1ccccc1O	765248969	MWHJVAFDDOHKHL-UHFFFAOYSA-N	439.497	1.718	50	20	IDGD	
COc1ccc(N2C[C@@H](C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)CC2=O)cc1	765314353	XUSRZBKKERNGBF-AWEZNQCLSA-N	434.493	1.500	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)CNC(=O)CC3CCCCC3)n[nH]2)cc1OC	765597480	GXCHKPAAJJVXBH-UHFFFAOYSA-N	443.504	1.942	50	20	IDGD	
O=C(NNC(=O)N1CCC([C@@H](O)C(F)(F)F)CC1)C1CCN(c2ncccn2)CC1	765751560	NFYWLLNCVYFQMT-CQSZACIVSA-N	430.431	1.069	50	20	IDGD	
O=C(NNC(=O)C(F)(F)Oc1ccccc1)c1ccc(N2C(=O)CCC2=O)c([N+](=O)[O-])c1	766739430	AWQBZDJDHXNDNY-UHFFFAOYSA-N	448.338	1.681	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)CN1CCCN(S(=O)(=O)c2ccccc2)CC1	766859399	FNUOGCDHVROWQE-UHFFFAOYSA-N	444.557	1.082	50	20	IDGD	
CCN(CC)C(=O)N1CCC(C(=O)OCC(=O)NNC(=O)Cc2ccccc2C)CC1	767284767	MOVXUNUOIBDREH-UHFFFAOYSA-N	432.521	1.402	50	20	IDGD	
CCOCCCn1c(NNC(=O)C2=NN(CC(C)C)C(=O)CC2)nc2ccccc2c1=O	768137856	CBAYCNJEPDRXAY-UHFFFAOYSA-N	442.520	1.901	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(OC(C)C)c(OC)c2)cc1OC	768234644	WYMOBQVPNLDSBF-UHFFFAOYSA-N	431.445	1.899	50	20	IDGD	
CC[C@H](C)[C@H](NC(=O)N1CCCC1)C(=O)NNc1c(OC)cccc1S(C)(=O)=O	768611905	JTXSXBADKWEBQR-BBRMVZONSA-N	426.539	1.762	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)c1c(Cl)cccc1S(C)(=O)=O	768638401	JVNUSNYBYJOKNB-UHFFFAOYSA-N	432.907	1.913	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)NC2CCN([C@@H]3CCCC[C@@H]3O)CC2)cc1OC	769164260	ABUGMHZAELSFPK-MSOLQXFVSA-N	434.537	1.806	50	20	IDGD	
O=C(NCc1ccco1)NNC(=O)c1ccc(NS(=O)(=O)c2cccs2)cc1O	769733204	SZAZFSZXXAWCOP-UHFFFAOYSA-N	436.471	1.992	50	20	IDGD	
CCCN(CCC)S(=O)(=O)c1ccc(C(=O)NNC(=S)NCCSC)cc1	769767505	NGFODUXCADUELW-UHFFFAOYSA-N	432.637	1.969	50	20	IDGD	
Cc1nn([C@H]2CCS(=O)(=O)C2)c(C)c1NC(=O)C(=O)NNc1c(F)cccc1Cl	770805757	FMDFJBFNFMGISH-NSHDSACASA-N	443.888	1.734	50	20	IDGD	
O=C(Cc1ccccc1I)NNC(=O)[C@@H]1COc2ccccc2O1	771219832	JXYXYDYVOXEKPY-HNNXBMFYSA-N	438.221	1.821	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)Cc1cc(F)ccc1Br	771269447	RPSMABSSZRYDCF-UHFFFAOYSA-N	433.278	1.986	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)N[C@@H]2CC(=O)N(c3c(F)cccc3F)C2)nc2ccccc21	771436077	UGUYUIXFDMTDMK-GFCCVEGCSA-N	442.426	1.530	50	20	IDGD	
O=C(CCN1CCN(C(c2ccccc2)c2ccccc2)CC1)NNC(=O)C1(O)CCC1	771865723	CGAPTABZCXUHHL-UHFFFAOYSA-N	436.556	1.846	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1c(Cl)ccc(S(=O)(=O)CC)c1Cl	772114045	KIIFIDIBMHUPDL-QMMMGPOBSA-N	425.290	1.890	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)CCC[C@]1(C)NC(=O)NC1=O	772710128	ZTGTXNRAORUZQQ-BTDLBPIBSA-N	441.282	1.132	50	20	IDGD	
Cc1cnccc1N1CCC(C(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)CC1	772902640	APFKEXBDRIRDMF-UHFFFAOYSA-N	429.908	1.724	50	20	IDGD	
CNC(=O)c1ccc(OC)c(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)c1	774002068	LYMXMLNZKWMASR-NSHDSACASA-N	448.863	1.262	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccc(N2CCOC2=O)cc1	774003548	XGWNHCGEQJQRAN-GFCCVEGCSA-N	446.847	1.850	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccc(CCN(C)C)cc1	774009369	OMOWCKTXLPCEBC-AWEZNQCLSA-N	432.908	1.998	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccc(NC(=O)NNC(=O)COc2ccc(C#N)cc2)nc1	776063670	WDEURLVYFRJOFP-UHFFFAOYSA-N	446.489	1.262	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)N[C@@H]1CCCOc2cc(F)ccc21	776885382	HZUJJMRERCOCFB-CQSZACIVSA-N	435.481	1.977	50	20	IDGD	
CC[C@@H](C)Oc1cc(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)ccn1	777274696	NUIPVPYGTBBRBS-SNVBAGLBSA-N	426.882	1.635	50	20	IDGD	
C[C@H](Oc1ccccc1Cl)C(=O)N1CCN(S(=O)(=O)CBr)CC1	777777130	FXUFTLZWQZHHTD-NSHDSACASA-N	425.732	1.934	50	20	IDGD	
CC(C)(C)C(=O)N1CCC[C@H](C(=O)N2CCN(S(=O)(=O)CBr)CC2)C1	777777975	VHLDFBXCSHQXDA-ZDUSSCGKSA-N	438.388	1.098	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc2c(cc1F)NC(=O)CC2	778707070	KHDYLKIJQBFEDV-UHFFFAOYSA-N	444.419	1.274	50	20	IDGD	
O=C(NNc1ncncc1Cl)C1CCN(c2ccc3nnc(C(F)(F)F)n3n2)CC1	781833675	MQMWWSWCOTZEAV-UHFFFAOYSA-N	441.805	1.946	50	20	IDGD	
COC(=O)[C@@H](c1ccc(Cl)cc1)N1CCN(S(=O)(=O)CBr)CC1	782415596	RMLOBEPPLGIRLY-CYBMUJFWSA-N	425.732	1.854	50	20	IDGD	
N#C/C(=C/c1cn(CCC(N)=O)nc1-c1cccc(Br)c1)C(=O)OCC(N)=O	783111565	GORKNDVYSDNICQ-SDQBBNPISA-N	446.261	1.123	50	20	IDGD	
CN(NC(=O)c1ccccc1-n1ccnn1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	783705664	ZUIDLNOALDFXJN-UHFFFAOYSA-N	429.481	1.517	50	20	IDGD	
O=C1CCC(=NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c2ccccc2N1	783775998	FARSXPSZMVGZGN-UHFFFAOYSA-N	442.497	1.574	50	20	IDGD	
Cc1ccc(NNC(=O)C(=O)Nc2cccc(S(=O)(=O)N(C)C3CCCCC3)c2)nn1	783952030	ZIMSMOJVSSFKFY-UHFFFAOYSA-N	446.533	1.820	50	20	IDGD	
Cc1c(Br)cccc1NC(=O)C(=O)NNC(=O)CNC(=O)c1cccs1	784004293	DVRTZCPKJRRSRW-UHFFFAOYSA-N	439.291	1.335	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2ccc(C#N)c(C(F)(F)F)c2)ccc1-n1cnnn1	784232183	RTNMVEWASYBPLQ-UHFFFAOYSA-N	430.350	1.943	50	20	IDGD	
O=C(NNc1ncccc1Cl)C(=O)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1	784820934	DEUCCNTWUFJNGD-UHFFFAOYSA-N	437.909	1.991	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)F)cc1)C(=O)N1CCc2cc(F)c(F)cc21	784835265	LAQGJKKGOPTVPG-UHFFFAOYSA-N	431.367	1.994	50	20	IDGD	
CCN(CC)C(=O)c1ccccc1NC(=O)C(=O)NNC(=O)Cc1cn2ccccc2n1	785068127	UIUZUYDYGLHHSS-UHFFFAOYSA-N	436.472	1.145	50	20	IDGD	
CCc1c(C(=O)NNC(=O)CNc2ccccc2OC)nnn1Cc1ccc(F)cc1	787866410	NOXFLYSRZQBPOH-UHFFFAOYSA-N	426.452	1.910	50	20	IDGD	
CC(C)(C)c1ccc(C(=O)N[C@@H](CCS(C)(=O)=O)C(=O)NNC(=O)c2ccc[nH]2)cc1	787930243	ZTENTYRHUKLCGM-KRWDZBQOSA-N	448.545	1.307	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCCC[C@H]2C)cc1C(=O)NNC(=O)N1CCN(C)CC1	788165886	KRQKMSVNUHBXJN-MRXNPFEDSA-N	437.566	1.160	50	20	IDGD	
CCC[C@H]1CCc2nc(NC(=O)C(=O)NNC(=O)CNC(=O)c3ccco3)sc2C1	789756486	FVKGVXVTLUMDTQ-NSHDSACASA-N	433.490	1.157	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@H]2C(=O)NNc2nc3ccccn3n2)cc1	791257238	BHHNEBBSPGMZRK-KRWDZBQOSA-N	442.501	1.618	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H]2Cc3cc(Br)ccc3O2)c1	791511913	BQKNPCAWHIWDQJ-OAHLLOKOSA-N	439.287	1.617	50	20	IDGD	
COc1cccc(C2=NO[C@@H](C(=O)NNC(=O)c3sc(N4CCOCC4)nc3C)C2)c1	792021267	IFONGMLONSJFPF-MRXNPFEDSA-N	445.501	1.251	50	20	IDGD	
CCCc1c(NC(=O)C(=O)NNc2nc3ccccn3n2)cnn1-c1cccc(C#N)c1	792393144	DJDSKFUWPZNPMX-UHFFFAOYSA-N	429.444	1.821	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)NCc2ncccc2O)cc1	792612566	MCIBHZRSMCBWOB-WJDWOHSUSA-N	446.467	1.758	50	20	IDGD	
Cc1cc(C)c(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1C=O	792774410	SQSZVXPPGGDULL-UHFFFAOYSA-N	429.498	1.975	50	20	IDGD	
COc1ccc(N2C[C@H](C(=O)NNC(=O)C(=O)Nc3ccc(C)cc3)CC2=O)c(OC)c1	793212982	NTIQAUSCULPHIR-CQSZACIVSA-N	440.456	1.151	50	20	IDGD	
COCc1cc(C(=O)OC)cc(S(=O)(=O)NNC(=O)Cn2ccc3ccccc32)c1	793391767	BSIQBUJUPAKVRO-UHFFFAOYSA-N	431.470	1.584	50	20	IDGD	
CCOC(=O)c1oc2ccc(S(=O)(=O)NNC(=O)[C@@H]3CCc4nncn4C3)cc2c1C	793449350	ASKCXZFHIVWGDB-GFCCVEGCSA-N	447.473	1.082	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)[C@@H]1C[C@H]2C[C@H]2N1C(=O)OC(C)(C)C	796038290	VNEYWUVULLXTKG-ZACQAIPSSA-N	431.489	1.626	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc(Cl)c([N+](=O)[O-])cc1F)c1ccc2c(c1)OCCO2	798246918	ITVIXDOZEQJVJY-UHFFFAOYSA-N	431.785	1.782	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc(C(F)(F)F)ccc1Br)N1CCOCC1	799122513	QOIZMWZLXSEUKI-UHFFFAOYSA-N	432.218	1.703	50	20	IDGD	
CC[C@@](O)(C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)c1cccc(Cl)c1	800379787	WNEIVKLJYRJAPT-IBGZPJMESA-N	439.921	1.649	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)CN2CCN(c3ccccn3)CC2)c(OC)cc1Cl	802080886	SKQKAIIOLZFJKS-UHFFFAOYSA-N	448.911	1.727	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)N[C@H]2CCCN(C(=O)Cc3ccccc3)C2)nc2ccccc21	802475520	DHZCCTIUOPKOBL-SFHVURJKSA-N	448.527	1.680	50	20	IDGD	
COc1ccc(S(C)(=O)=O)cc1S(=O)(=O)NNC(=O)c1ccc2ccccc2c1	802721815	HEDYBDIYJUYFCP-UHFFFAOYSA-N	434.495	1.875	50	20	IDGD	
CCCN(NC(=O)Cn1cnc2c(c(Br)nn2C)c1=O)C(=O)OC(C)(C)C	804592093	XHNFOIFTBZMUPB-UHFFFAOYSA-N	443.302	1.571	50	20	IDGD	
CS(=O)(=O)c1ccc(OCCCCC(=O)NNc2ccc(-n3ccnc3)nn2)cc1	804952571	OXEFXYHPPGIMEC-UHFFFAOYSA-N	430.490	1.758	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)c2ccccc21)c1cc(Br)ccc1O	806947444	IAYKVLKVCABRIL-LBPRGKRZSA-N	439.287	1.877	50	20	IDGD	
O=C1COC[C@H](C[C@H]2CN(C(=O)C(=O)NNc3ccc(Cl)c(F)c3)c3ccccc32)N1	807022985	XFQPPFVUXZFPLW-JSGCOSHPSA-N	446.866	1.958	50	20	IDGD	
O=C(NNc1cccc(F)n1)C(=O)Nc1ccc(Cl)c(S(=O)(=O)N2CCCC2)c1	807392009	PHOWDIMPJAGVON-UHFFFAOYSA-N	441.872	1.740	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)[C@H]1CSCN1C(=O)c1ccc(Cl)cc1	808045143	DDVILMBAHLNFBQ-CQSZACIVSA-N	429.926	1.792	50	20	IDGD	
CCOC(=O)c1cccc(NC(=O)c2cccc(NC(=O)NNC(=O)CN(C)C)c2)c1	810326398	RGSZXKHDBTXTDA-UHFFFAOYSA-N	427.461	1.830	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccccc1C(F)(F)F)NNc1nc(-c2cccnc2)no1	810339465	JVWJKEQEEAFBPK-UHFFFAOYSA-N	442.379	1.572	50	20	IDGD	
CC(C)Nc1ccc(S(=O)(=O)NCC(=O)NNc2ccc(Cl)nc2)cc1[N+](=O)[O-]	810461279	WXYBLAROSIXZNI-UHFFFAOYSA-N	442.885	1.885	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(Cl)cc1)NNC(=O)c1cc(-c2cccs2)[nH]n1	810585158	MKAUWOSILWXHIY-UHFFFAOYSA-N	439.906	1.531	50	20	IDGD	
CC(C)(C)n1cnc(C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)n1	812535452	WOHKVPFUOHJSCQ-UHFFFAOYSA-N	433.944	1.265	50	20	IDGD	
CS(=O)(=O)C1(C(=O)NNC(=O)COc2ccccc2-c2ccccc2)CCOCC1	814102141	KZQAWSZXFLKAEJ-UHFFFAOYSA-N	432.498	1.474	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cc(Cl)c(F)cc2N)cc1OC	815260054	ZTACGMUUHPYZSZ-UHFFFAOYSA-N	425.800	1.697	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)COc2cccc(C)c2)cc1)[C@H]1C[C@H]1C	815564860	VNJFTYZXMBNGSK-QRWLVFNGSA-N	438.484	1.921	50	20	IDGD	
O=C(CNC(=O)c1ccc(F)cc1F)NNC(=O)COc1ccc(Br)cc1	821904335	MMAICVXIBIZYDM-UHFFFAOYSA-N	442.216	1.684	50	20	IDGD	
COc1ccccc1NC(=S)NNC(=O)c1ccc(OC)c(S(=O)(=O)N(C)C)c1	913441054	RSRMIZMFMJXIMU-UHFFFAOYSA-N	438.531	1.586	50	20	IDGD	
Cc1cc(C)nc(SCc2ccc(C(=O)NNC(=O)c3cn(C)c(=O)nc3O)cc2)n1	915054463	LTPPKQGUGKGKLJ-UHFFFAOYSA-N	440.485	1.260	50	20	IDGD	
O=C(NNC(=O)c1ccccc1F)c1cncc(C(=O)NNC(=O)c2ccccc2F)c1	915806218	JHDOBNCPHSQYAS-UHFFFAOYSA-N	439.378	1.509	50	20	IDGD	
CC(=O)Nc1cccc(C(C)=NNC(=O)C(=O)NN=C(C)c2cccc(NC(C)=O)c2)c1	916266214	KIUWBYNMHJXKKE-UHFFFAOYSA-N	436.472	1.984	50	20	IDGD	
CC(=NNC(=O)C1=S=C2CCCC2=C1)c1ccc(S(=O)(=O)N2CCOCC2)cc1	916315459	UCSDFJYRINTKMO-UHFFFAOYSA-N	433.555	1.750	50	20	IDGD	
COc1cc(C=NNC(=O)[C@H](C)CN2CCCCC2)ccc1OCC(=O)N1CCOCC1	916361251	UNBMGYSPPJFCPS-GOSISDBHSA-N	446.548	1.505	50	20	IDGD	
CNS(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(F)cc2Br)c1	918340326	KCVXYAQEEOTENH-UHFFFAOYSA-N	430.255	1.571	50	20	IDGD	
C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)C1	919786589	XIBXYZYVQHUFBX-MAUKXSAKSA-N	430.530	1.870	50	20	IDGD	
COc1ccc(C)cc1C1(CNC(=O)NN[C@@]2(C)CCS(=O)(=O)C2)CCOCC1	919923775	LJEQIAPWMFWECD-IBGZPJMESA-N	425.551	1.433	50	20	IDGD	
O=C(COC(=O)c1ccc(N2NC(=O)CCC2=O)cc1)NNC(=O)c1cccc(Cl)c1	920696848	HCNQBBIWBQRJTQ-UHFFFAOYSA-N	444.831	1.116	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)NNC(=O)c1cc(S(=O)(=O)N2CCSCC2)c[nH]1	921023005	STNMDVSZZUHFQW-UHFFFAOYSA-N	447.542	1.237	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)NNC(=O)C(C)(C)c2ccccc2)CC1	1116083838	MCFJDMWPJJEYEG-UHFFFAOYSA-N	447.536	1.973	50	20	IDGD	
CCOc1ccc(OCc2ccc(C(=O)NNC(=O)CN3C(=O)CCC3=O)cc2)cc1	1317697111	TYYMFTWXARQNMI-UHFFFAOYSA-N	425.441	1.574	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)N[C@@H]2CCN(c3cnn(C)c3)C2)cc1OC	1318623936	SXFZUDRGPBRXGL-MRXNPFEDSA-N	430.509	1.831	50	20	IDGD	
C[C@@H]1CN(C(=O)c2ccc(CNC(=O)NNc3nncc(N)c3Cl)cc2)C[C@@H](C)O1	1319308722	DHZUDKOUIZKRGH-VXGBXAGGSA-N	433.900	1.788	50	20	IDGD	
C[C@H]1CN(C(=O)Cn2cc(NC(=O)NNC(=O)c3ccccc3Cl)cn2)C[C@H](C)O1	1320132704	LAIZJPKNWBVAEU-STQMWFEESA-N	434.884	1.639	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)N[C@@H]1C=CCCC1	1322503318	VFSKEVIOTLHMMB-QGZVFWFLSA-N	436.534	1.079	50	20	IDGD	
C[Si](C)(C)c1cc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)co1	1779004015	VFGFFLTVCXHRLK-YOEHRIQHSA-N	447.377	1.959	50	20	IDGD	
O=C(/C=N/N1CCCCC1)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCBr)C2	1779359349	JIPOELUSIOPOIW-QIIMOFAKSA-N	443.386	1.757	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccnc(Cl)n3)C2)C1	1779500575	ZZPFUQSQQNULSS-BZNIZROVSA-N	431.718	1.605	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CNC(=O)C(F)(F)F)C2	1780709667	REFRZANZNVWGCZ-HWWQOWPSSA-N	427.851	1.196	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(OC)c(N(C)C)c3)C2)C1	1781129043	ZSASMHQTLGIPJY-IERDGZPVSA-N	439.940	1.459	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccccc3C(N)=O)C2)C1	1781754859	ATQDHFOUTRRZPP-DJJJIMSYSA-N	438.322	1.260	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CN1CCCC1=O)C2	1781900376	OGQKMAXUPLOMJO-SPYBWZPUSA-N	444.370	1.296	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cncc(N(C)C)c1)C2	1782170932	HIVZFRDUSXIKPG-WAOWUJCRSA-N	438.956	1.529	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)COc1ccccc1F)C2	1782178679	CSPQFHOAYVKDQX-RRMPHLOHSA-N	442.915	1.972	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCN2CCCC2)C1	1783319809	GEZONKJTOBBAKF-GPMSIDNRSA-N	430.387	1.770	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc4c(n3)OCCO4)CCO2)C1	1783534170	FWDZGLUIHYCKHN-XIKOKIGWSA-N	440.294	1.080	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)/C=N/O[C@H]3CCCCO3)CCO2)C1	1783534415	UGSOMRAPAITVHG-KBGIYDCGSA-N	432.315	1.129	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)Cc3cc(Cl)ccc3OC)CCO2)C1	1783880851	HUNDDBUNVKIDQM-OXJNMPFZSA-N	445.343	1.975	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)C(Cl)Cl)C3)C2)c(O)c1OC	1783946564	COYCQRIHXQKAFZ-GOSISDBHSA-N	433.288	1.657	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21	1783972797	QDEZUFFQFITXFZ-HTFCKZLJSA-N	444.139	1.688	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](C)Oc3ccccn3)C2)C1	1784490824	DOGYUUQUSDVWFY-DEYYWGMASA-N	426.311	1.462	50	20	IDGD	
CCc1ccnc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Br)C[C@@H]32)c1	1787231039	MXZRDFZWOVDHBI-SDADXPQNSA-N	428.302	1.928	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)c3ccc(F)cn3)CCC2)cc1)c1cccc(B(O)O)c1	1788145986	OCOGBZMYCKDWIR-UHFFFAOYSA-N	433.248	1.962	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)[C@@H]3[C@@H]4C=CS[C@@H]34)CCC2)cc1)c1cccc(B(O)O)c1	1788150333	CXRKKODKMXNPKR-XUVXKRRUSA-N	434.326	1.989	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1ccc(C2(NC(=O)c3ccc(CO)o3)CCC2)cc1	1789521018	JTJGAUDLEMSEIM-UHFFFAOYSA-N	449.467	1.832	50	20	IDGD	
C[C@@H](Nc1cnccn1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]2C1	1789870780	VOAVUEFOJSEQTD-QWHKOUAISA-N	444.363	1.493	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)n3ccnc3)C[C@@H]21	1790958164	KTMUWCFNZYKPMH-GVRJEKJASA-N	427.343	1.597	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(-n4cncn4)c3)C[C@@H]21	1791257243	TZLJOHAVHHNOFX-WNHJNPCNSA-N	447.923	1.114	50	20	IDGD	
CSCC[C@@H](O)C(=O)Nc1ccc(C2(NC(=O)CCC(=O)NN(C)C)CCC2)cc1	1791618976	UVLUIRHDADCWRW-QGZVFWFLSA-N	436.578	1.608	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CC1CCN(C)CC1	1792602613	GUGIMSUYEDDJAJ-SCNOPHJPSA-N	430.387	1.339	50	20	IDGD	
COc1ccc([C@@H](O)C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@](C)(Cl)CCl)C3)cc1	1792715644	JIFSDVOTALNITD-QUYZETPZSA-N	445.343	1.555	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(-n2cnnc2)cc1	1795494145	JLPPTHUAUBSCDN-FAYQHZLMSA-N	448.321	1.254	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1noc2c1CCCC2	1796150881	YUTFFYJYUMCOOY-NFFDBFGFSA-N	440.338	1.788	50	20	IDGD	
Cc1cc(F)c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)cc1F	1796192782	RSYKWKRZZXDVCU-BJWYYQGGSA-N	428.244	1.519	50	20	IDGD	
Cc1cc(C)n2ccc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3cccc(B(O)O)c3)c2n1	1796192979	GJNGDCNEAUIELV-ACDBMABISA-N	446.316	1.197	50	20	IDGD	
Cc1nc(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)c(C)s1	1798440822	WRVWZVCMVWJXHP-QDMKHBRRSA-N	442.545	1.253	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccccc1C(=O)OCCO	1799267292	DPBJUUIHNAZRIC-BJWYYQGGSA-N	448.592	1.939	50	20	IDGD	
CCc1[nH]nc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Br)c1Cl	1799346161	GETUYDLZVBGSLU-XXEYQXHCSA-N	437.697	1.519	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccn3nccc3c1)C2)[C@@H](F)Br	1799350178	UKKFYAKQMSOGLV-AYRXBEOTSA-N	425.258	1.228	50	20	IDGD	
CO[C@@H](C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN(C)NC(=O)NCc1ccccc1	1799869679	WJYWHZVPUBQMMC-KANFNMMFSA-N	431.537	1.006	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C[C@@H](O)CNC(=O)OC(C)(C)C	1800180029	OGUYDYDQAWPQQR-JKJDWNRSSA-N	431.961	1.918	50	20	IDGD	
CCN(CC)C[C@@H](C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)CBr)C2	1800218285	NQUKZWYHCWRCOB-OVYGPGRDSA-N	432.403	1.585	50	20	IDGD	
Cc1ccc([C@H](C)C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCC(=O)NN(C)C)C3)cc1	1800620891	BRXIPZZFXAUBJK-UYZIEWPDSA-N	430.549	1.061	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COc1ccc(O)cc1)C2	1800638090	PTYKFRBCYGTLSC-ZDFLXESQSA-N	441.322	1.534	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CCc3ccoc3C1)C2	1800754514	QEURBBHWWKOILC-NOSJPKONSA-N	425.323	1.758	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)Br)C3)C1	1800967350	OVRXOXZURVEIBV-SDSMMKDESA-N	445.354	1.339	50	20	IDGD	
C[C@@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](O)CNC(=O)OC(C)(C)C)C2	1801959434	TVTFBPVYHQVLJD-RKQHYHRCSA-N	448.358	1.294	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(C(F)(F)F)n1C)C2	1802336098	GNKNXQRSVNCFBJ-BTTYYORXSA-N	443.470	1.669	50	20	IDGD	
COc1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CCC(=O)NN(C)C)cc(OC)c1C	1802344185	QCPBHRMGKQXDCK-BCDXTJNWSA-N	446.548	1.637	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)C(C)(C)CCl)[C@H]1c1cccnc1	1802902635	RQBNVHFLFCZIKH-VQIMIIECSA-N	437.972	1.725	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H](CNC(=O)[C@@H]2CNC(=O)O2)[C@@H]1c1cccnc1	1803647957	JDKBDAMBEVEONT-COJSNBRMSA-N	429.304	1.432	50	20	IDGD	
Cc1nc(O)c(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)nc1C	1804870563	NYEVMMLUOSLTFQ-ZOBUZTSGSA-N	433.896	1.113	50	20	IDGD	
Cn1cnc(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](F)Br)[C@H]2c2cccnc2)n1	1805327275	WIUVHRXXHNLGCG-RWMBFGLXSA-N	425.262	1.220	50	20	IDGD	
CN[C@H](CC(=O)NC[C@H]1CCN(C(=O)CO[Si](C)(C)C)[C@H]1c1cccnc1)C(=O)O	1807204664	NMHQHZAODIJORL-MDZRGWNJSA-N	436.585	1.002	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CCC2CCC2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1	1807367031	WVMQDSDPQRGMAG-REWPJTCUSA-N	435.333	1.661	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc(O)nn2)[C@H]1c1cccnc1)[C@@H](F)Br	1808651203	KGYXOMMAMPWUFR-TUKIKUTGSA-N	438.257	1.587	50	20	IDGD	
CN1CCN(CCC(=O)N2CC[C@@H](CNC(=O)C(Cl)Cl)[C@H]2c2cccnc2)CC1	1813075578	FOWZTLIWLFFOOE-FUHWJXTLSA-N	442.391	1.529	50	20	IDGD	
O=C1Cc2cc(C(=O)N3CCCC[C@@H]3c3cc(NC(=O)[C@@H](O)CCl)n[nH]3)ccc2N1	1814873673	SZVPHUDHXZUGQP-CVEARBPZSA-N	431.880	1.810	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@H]1CCCSC1)CC2)c1ccc(B(O)O)cc1	1815347961	ZUNSHKBXQLOFBG-ZFWWWQNUSA-N	445.375	1.192	50	20	IDGD	
CCc1nc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)co1	1817476597	LSZXQHRVKWINPP-KRWDZBQOSA-N	437.265	1.260	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cnccc3C(=O)NN)n[nH]2)c[nH]1	1819402916	NPKCBJPYXIKIHY-QGZVFWFLSA-N	436.476	1.664	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](F)Br)[nH]n1	1819583214	GLPXFSSFNUECJI-UDZFHETQSA-N	430.278	1.783	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)COC(=O)C(F)(F)F)sc2C1	1819616472	QYFVIHHSLUKXME-HTQZYQBOSA-N	443.831	1.414	50	20	IDGD	
CCNC(=S)NCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)CO[Si](C)(C)C)[nH]n1	1821645529	PMMNBVANJCOPRZ-AWEZNQCLSA-N	440.646	1.737	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)CCl)CC2)c1cc(-n2ccnc2)ccn1	1821683923	ORKZTGSWXGQLKG-ABAIWWIYSA-N	446.920	1.549	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN2CCOC2=O)[nH]n1	1822183382	BVWCJPKSXGWJTL-PWSUYJOCSA-N	428.287	1.637	50	20	IDGD	
O=C(N[C@@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1)c1cc(CO)on1	1823006409	FGBFNMMIQUAGHD-KBUNVGBDSA-N	433.259	1.540	50	20	IDGD	
C[C@H](NC(=O)c1ccccc1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1	1823503638	WASFVFRNVZYTFW-IAOVAPTHSA-N	447.923	1.820	50	20	IDGD	
CC(C)(C)[C@H](O)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1	1824133024	JHWMXNKJEXQKQJ-WOJBJXKFSA-N	430.354	1.007	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cn(C(C)(C)C)nn1)CC2	1826004128	XILYXOJOWCNEGY-GHMZBOCLSA-N	440.957	1.969	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)Cc1ccccn1)CC2	1826085530	ZITCTEPVGJNQPK-CQSZACIVSA-N	430.534	1.066	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H]1CCCS1)CC2	1826092077	KTVFRLNYTFAFIS-DGCLKSJQSA-N	425.580	1.324	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@H]1CCc2nc(NC(=O)CCn3cncn3)sc2C1	1826601961	STRRXAJCXAQPJJ-MNOVXSKESA-N	441.355	1.768	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)[C@H](N)c2ccccn2)CC1	1826917976	VKPCNJDXILBRGF-DENIHFKCSA-N	444.580	1.074	50	20	IDGD	
CC(C)=NO[C@H](C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827056853	YXMKSBHDQNUWRI-UTKZUKDTSA-N	443.353	1.401	50	20	IDGD	
CC(C)O[C@H](C)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827057592	KQADPMAUJJAVFH-DYESRHJHSA-N	430.354	1.413	50	20	IDGD	
O=C([C@H](F)Br)N1CCC([C@@H]2CCCCN2C(=O)c2cnc(O)nc2O)CC1	1827590775	SIERAMRINWBZMU-STQMWFEESA-N	445.289	1.812	50	20	IDGD	
C[C@@H](C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2)c1ccccc1	1828230755	SBCZCFMFSDZWHX-KDOFPFPSSA-N	449.341	1.852	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3C[C@@H]3C3CC3)C2)C1	1830533131	GIUJBXIJZVPWQP-NVQRDWNXSA-N	429.355	1.520	50	20	IDGD	
CC(=O)C(C)(C)C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](C)CBr)CCO2)C1	1830533300	JZVHSURJKPVVLM-ACJLOTCBSA-N	433.343	1.089	50	20	IDGD	
Cc1[nH]ccc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)CBr)CCO2	1830538360	DAUMJWANWNJZOL-FZKQIMNGSA-N	428.327	1.424	50	20	IDGD	
Cc1cccc2cc(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)[C@H](O)CCl)CCO4)[nH]c12	1830732128	VFMYKZFOMQYPJA-DYESRHJHSA-N	435.908	1.146	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)/C=C/c3ccc([N+](=O)[O-])o3)CCO2)C1	1830910033	HSVWCMTVNNSIKP-CGGVFNQDSA-N	441.868	1.675	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3cc(C)n(C)n3)CCO2)C1	1830945616	OGJLPYUNYVLGPI-FXAWDEMLSA-N	426.945	1.135	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CC[C@H](C(=O)OC)C3)C2)C1	1831638637	FKXLCNTXIQMOHJ-JJDSTIRJSA-N	444.956	1.440	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3c(F)cncc3F)C2)C1	1831651994	VOPPWKZHYDTMAV-BFUOFWGJSA-N	431.867	1.837	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H](O)N2CCOCC2)CC1	1831654883	IFEUSCGKRYNDCL-GMBSWORKSA-N	446.386	1.040	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(=O)c3cccn3C)C2)C1	1831657915	CEOOLMUXVSAQRY-YWZLYKJASA-N	425.913	1.072	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)C(=O)Nc2cccnc2)CC1	1831831180	PWYUGTHBMRDXKW-ZWKOTPCHSA-N	436.940	1.894	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@H]3CCCCN3C)CC2)CC1	1833319081	PYBLMGJRGFQRSD-RTBURBONSA-N	429.005	1.296	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3n[nH]c(C)c3F)CCO2)C1	1833674142	QIMTWFRDGIPWMK-SJCJKPOMSA-N	447.305	1.101	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC(N2CCC(NC(=O)c3ccc(O)nn3)CC2)CC1	1834070177	JVCGCMYSRHTAKA-UHFFFAOYSA-N	435.601	1.219	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cncc(F)c3)CCO2)C1	1834358811	FOURGWFVZUBOQO-MAUKXSAKSA-N	444.301	1.464	50	20	IDGD	
O=C(CCBr)NC1CCN(C2CCN(C(=O)[C@@H]3[C@H]4COC[C@H]43)CC2)CC1	1834423283	CHSQFKSKONJBNA-VQFNDLOPSA-N	428.371	1.235	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(C)cnc3Cl)CCO2)C1	1834559338	HMDKVXCKGJCMTP-KXBFYZLASA-N	446.331	1.367	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCBr)CCO2)C1	1834819489	PKZHJOCGZBADCW-BBRMVZONSA-N	425.751	1.635	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)Cc3ccccc3O)C2)C1	1834824700	HYEREIXPQBEKHP-IBGZPJMESA-N	441.322	1.176	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccccc3F)CCO2)C1	1835007997	KFNMGNNQTVNDOE-UZLBHIALSA-N	428.888	1.078	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC1CCN(C2CCN(C(=O)c3cc(O)no3)CC2)CC1	1836399638	HMEKMPMUTRAHLU-GOSISDBHSA-N	433.336	1.802	50	20	IDGD	
CN1CCC(CC(=O)N2CCOC[C@@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)CC1	1837708866	QQWBHSAPIYNRIU-NRFANRHFSA-N	441.645	1.026	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)C#Cc3ccccc3)C2)C1	1837712485	UWDRTSIDPYFZEK-QFIPXVFZSA-N	430.577	1.346	50	20	IDGD	
O=C(c1cccc(C(F)(F)F)n1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1837931968	AQUKGTSANNKFBB-CJNGLKHVSA-N	439.793	1.705	50	20	IDGD	
CCc1nc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@](C)(Cl)CCl)C3)C2)co1	1838138635	CPVWPNQXGFKUAC-QZTJIDSGSA-N	434.320	1.543	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(O)nc3)CCO2)C1	1838651572	XLJNNXDMPVDOBL-ROUUACIJSA-N	432.304	1.094	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3cccc(C#N)c3)C2)C1	1839141935	YJZHDYHNJGFJSQ-UGKGYDQZSA-N	433.936	1.965	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3ccc(F)nc3)C2)C1	1839142497	QHSAGNXFRZNWHJ-UZLBHIALSA-N	427.904	1.627	50	20	IDGD	
O=C(c1ccc(OC(F)F)cc1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1839331090	RZNXSGXQGJNZGY-KDOFPFPSSA-N	436.814	1.892	50	20	IDGD	
COc1ccc(F)cc1CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840190649	GLEWHPBBRVVEOU-LJQANCHMSA-N	449.306	1.637	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)C3CCC(O)CC3)CCO2)C1	1840274282	BYYVEAUCLLZRGR-FUICEZJUSA-N	437.364	1.230	50	20	IDGD	
COc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)cc(OC)c1C	1840756867	SRJLYHYEOOFZBJ-PXNSSMCTSA-N	444.887	1.617	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)C1CCSCC1)CCO2	1840924723	CRGYWWXFQMUEDQ-IBGZPJMESA-N	430.643	1.438	50	20	IDGD	
O=C(Cc1cccc(Br)c1F)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1	1841348492	UKSPDVGIQFNZPB-ZDUSSCGKSA-N	433.705	1.934	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@H]1C[C@@H](O)CN1C(=O)OC(C)(C)C)C2	1841671030	YZSGFAMIZBWNNU-OAGGEKHMSA-N	443.972	1.968	50	20	IDGD	
CCc1nn(C)c(C(=O)N2CCCC23CN(C(=O)[C@@H](Cl)COC)C3)c1Br	1843148944	ZMCLVGKJTHDSKC-NSHDSACASA-N	447.761	1.816	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC2(CCCN2C(=O)c2ccccc2C(=O)OCCO)C1	1844719785	DGGIVAHRDHFMRJ-CYBMUJFWSA-N	439.306	1.436	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2ccc3occc3c2O)C1	1845657973	OAIFHIOAUXDTIB-UHFFFAOYSA-N	435.440	1.268	50	20	IDGD	
CC#C[C@H](CC(=O)N1CC2(CCCN2C(=O)CCC(=O)NN(C)C)C1)c1ccc(O)cc1	1846386087	AORQETMREJXRTR-LJQANCHMSA-N	440.544	1.466	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)CCn2nc(C)cc2C)C1	1846536986	QWACTJOIWHHTDR-JJIBRWJFSA-N	439.520	1.227	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)c2c(F)ccc(Cl)c2F)C1	1846865964	KREOHPJKVRQOCW-UHFFFAOYSA-N	428.867	1.808	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCO)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CCBr	1847639216	GJDNTDRNVVQENN-IHRRRGAJSA-N	448.358	1.249	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=S)Nc1ccc2c(c1)OCCO2	17451190	KMLMVISUCQYJIH-UHFFFAOYSA-N	435.531	1.691	50	20	IDGD	
COc1ccc(C(=O)NCC(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)cc1[N+](=O)[O-]	25376560	GLVIFNVNZLRCRY-LLVKDONJSA-N	434.380	1.087	50	20	IDGD	
C#CCNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2ccc(OC(C)C)c(OC)c2)cc1	27238677	YKRLCMWOYRCORD-UHFFFAOYSA-N	445.497	1.469	50	20	IDGD	
C[C@H]1CN(Cc2ccc(CNC(=O)NNC(=O)CNC(=O)c3ccco3)cc2)C[C@H](C)O1	725870578	KWEZQHRBPHLLHO-HOTGVXAUSA-N	443.504	1.149	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@@H](C)C(=O)NNC(=O)CS[C@H]1CCS(=O)(=O)C1	726198700	PNOUPPNRZNDASJ-JSGCOSHPSA-N	434.967	1.792	50	20	IDGD	
Cc1ccc(Cl)cc1N1CC[C@@H](CNC(=O)NNC(=O)CNC(=O)c2ccco2)C1	726616147	KCDIRKUXBUKIBT-AWEZNQCLSA-N	433.896	1.828	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)CSC[C@H]2CCCCO2)c1	727364000	FAWCSDUFOJETSP-MRXNPFEDSA-N	443.591	1.780	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)CCNC(=O)c2n[nH]c3ccccc23)o1	728071548	SVYVSDSONVHZLN-UHFFFAOYSA-N	426.477	1.579	50	20	IDGD	
CC/C=C(/C)C(=O)N1CSC[C@H]1C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	728211926	MGOVJXMMASQGIM-GWYPZCSZSA-N	438.575	1.828	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)COc3ccc(F)cc3F)cc2)CC1	728214511	QJPBBZKSTOWYAU-UHFFFAOYSA-N	440.472	1.423	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(C(=O)N(C)C)cc2)cc1OC	728353050	ZMUPWHLYCKIPNM-UHFFFAOYSA-N	429.429	1.024	50	20	IDGD	
O=C(NNC(=O)N1CCN(CCc2ccccc2)CC1)C1CCN(c2ncccn2)CC1	728958858	GDMIBNYQDFZTOV-UHFFFAOYSA-N	437.548	1.294	50	20	IDGD	
C[C@@H]([C@@H](C)NC(=O)NNC(=O)COc1ccc(Br)cc1)N1CCOCC1	729624503	XIWHDWIANWLHMP-OLZOCXBDSA-N	429.315	1.268	50	20	IDGD	
O=C(NN=Cc1cc(Br)cc(Br)c1O)[C@H]1CCS(=O)(=O)C1	730578314	PLMTVZZRWZUEBJ-ZETCQYMHSA-N	440.113	1.802	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)CNC(=O)c2c(F)cccc2Cl)c1	730587135	LXIAGOKSZLYETR-UHFFFAOYSA-N	427.841	1.074	50	20	IDGD	
Cc1cccc(N2C(=O)N[C@@H](CCC(=O)NNC(=O)[C@H](C)Oc3ccc(F)cc3)C2=O)c1	730769360	SVFIRIGRZDVRFE-KSSFIOAISA-N	442.447	1.954	50	20	IDGD	
NC(=O)[C@H]1CCCN(Cc2cccc(CNC(=O)NNC(=O)c3ccccc3F)c2)C1	731118086	NEOWTLCMPPYGHG-KRWDZBQOSA-N	427.480	1.667	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCCC(=O)NNC(=O)C(C)(C)c2ccccc2)cc1	731200156	CCUFLPJQIZJLHQ-UHFFFAOYSA-N	433.530	1.879	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1	732086519	YDGWJQZDWRYJEH-LLVKDONJSA-N	434.430	1.193	50	20	IDGD	
N#CCCn1cc(/C=C(/C#N)C(=O)N2CCO[C@H](c3nn[nH]n3)C2)c(-c2ccccc2)n1	732089827	NGRNTVSSWFBKCL-QMJOVRGKSA-N	429.444	1.484	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)[C@@H]1CCCN(S(=O)(=O)c2c(C)n[nH]c2C)C1)c1ccccc1	732132908	KLRBXNDEFOVRTM-MSOLQXFVSA-N	447.561	1.768	50	20	IDGD	
O=C(NNc1cnnc2ccccc12)c1cccc(S(=O)(=O)NC[C@@H]2CCCO2)c1	733810510	NLTYWYBSUUFMDS-HNNXBMFYSA-N	427.486	1.844	50	20	IDGD	
CC(CS(=O)(=O)c1ccc(C)cc1)=NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	734297356	JTTIPRPBEIEXPG-UHFFFAOYSA-N	437.543	1.825	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)C2(S(C)(=O)=O)CCCC2)CC1	734826100	WZFJAEDEUIXNBJ-UHFFFAOYSA-N	432.543	1.074	50	20	IDGD	
O=C(COC(=O)c1cc(N2CCNC2=O)ccc1F)NNC(=O)c1cccc(Cl)c1	738687894	AUVFVTIMTJDOEE-UHFFFAOYSA-N	434.811	1.627	50	20	IDGD	
Cc1cccc2c(CC(=O)NNc3ncccc3S(=O)(=O)N3CCN(C)CC3)c[nH]c12	741287632	WWWSJCLHYZFOAU-UHFFFAOYSA-N	442.545	1.493	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)C(=O)NCc2ccc(F)cc2)c2ccccc2c1=O	742035078	XSSWXMCGQDTLIX-UHFFFAOYSA-N	425.420	1.023	50	20	IDGD	
CC1CCN(CCCCNC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)CC1	743549783	UBLKXQFILUAKNW-UHFFFAOYSA-N	425.555	1.938	50	20	IDGD	
COc1cccc(-c2noc([C@@H](C)NC(=O)NNC(=O)CNC(=O)c3cccs3)n2)c1	743577648	FQQBJGFFZLKNAP-LLVKDONJSA-N	444.473	1.628	50	20	IDGD	
CS(=O)(=O)Nc1cccc(CC(=O)NNC(=O)c2cc(Br)ccc2O)c1	743731919	CYADPMQVBHHWSP-UHFFFAOYSA-N	442.291	1.530	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCCN2c3ccccc3C[C@H]2C)nc1	744885835	ITLXCAKSWMBMCC-OAHLLOKOSA-N	432.550	1.846	50	20	IDGD	
Cn1ccnc1[C@@H](NC(=O)NNC(=O)c1cc([N+](=O)[O-])ccc1O)c1ccc(F)cc1	745387908	DBPQTEUKYIYPHS-INIZCTEOSA-N	428.380	1.907	50	20	IDGD	
Cc1ccc(N2CC[C@H](NC(=O)NNC(=O)Nc3ccc(S(C)(=O)=O)cc3)C2=O)cc1	745851177	DBBUPAUIPAXPCB-KRWDZBQOSA-N	445.501	1.540	50	20	IDGD	
C[C@H]1C[C@H](NC(=O)NNC(=O)c2ccc(Cl)cc2Cl)C(=O)N1c1cnn(C)c1	745916558	CSFJBVKLRBIZBN-XPTSAGLGSA-N	425.276	1.865	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)c1ccc(CN2CCN(C)CC2)cc1	746095745	AFSUWFDKANDFIB-UHFFFAOYSA-N	434.544	1.807	50	20	IDGD	
CC(C)NS(=O)(=O)c1cc(C(=O)NNC(=O)Cc2cn3ccccc3n2)ccc1F	746555885	IQHMJJMLNPPAMY-UHFFFAOYSA-N	433.465	1.164	50	20	IDGD	
NC(=O)CC[C@@H](C(=O)NNC(=O)c1ccc(Cl)cc1F)N1C(=O)c2ccccc2C1=O	747431258	HUIZKUZJFGVXFA-HNNXBMFYSA-N	446.822	1.170	50	20	IDGD	
NC(=O)C[C@H]1CCCN(C(=O)NNC(=O)[C@@H]2Cc3ccccc3CN2Cc2ccccc2)C1	747497827	BMHXIIXQJWEDGM-KNQAVFIVSA-N	449.555	1.942	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2ccc[nH]2)cc1S(=O)(=O)N[C@H]1CCCC[C@@H]1C	747662311	KEKZINZOFYVEHD-ZFWWWQNUSA-N	434.518	1.955	50	20	IDGD	
O=C(Cc1ccc(Cl)cc1)NNC(=O)NCCCN1CCN(c2ccncc2)CC1	748342956	FHHMIKFSJPLMGT-UHFFFAOYSA-N	430.940	1.820	50	20	IDGD	
O=C(NNC(=S)NC[C@H]1CCOC1)c1nn(Cc2ccccc2)c(=O)c2ccccc12	749639185	NKOATIODPHBGQK-MRXNPFEDSA-N	437.525	1.590	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cnn(CCC(C)C)c2C)cc1	749884117	IFMNVHTZSOBWLU-UHFFFAOYSA-N	435.550	1.628	50	20	IDGD	
O=C(NNC(=O)[C@H]1OCCc2ccccc21)c1cccc(S(=O)(=O)N2CCCCC2)c1	749889587	ZHORDLSVDBQWOD-FQEVSTJZSA-N	443.525	1.936	50	20	IDGD	
CS(=O)(=O)Cc1ccc(C(=O)NNC(=O)COc2ccc(Br)cc2)o1	751049680	NHJGDFHKFSIQMP-UHFFFAOYSA-N	431.264	1.427	50	20	IDGD	
CN(C(=O)CSCC(=O)NNC(=O)CNC(=O)c1cccs1)C1CCCCC1	751210401	DQSZQJIJNKQKMZ-UHFFFAOYSA-N	426.564	1.150	50	20	IDGD	
COC(=O)c1ccc(Cl)cc1S(=O)(=O)NNC(=O)c1ccc2c(c1)OCCO2	751270169	OBLQUMUCANNTRL-UHFFFAOYSA-N	426.834	1.521	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)[C@@H]2CC(=O)N(CCOc3ccccc3Cl)C2)n1	751555574	KKLBOPTWIWVYAK-OAHLLOKOSA-N	433.896	1.228	50	20	IDGD	
Cn1c(NNC(=O)[C@H]2CCCCN2S(=O)(=O)c2ccccc2)nc2ccccc2c1=O	752908724	RNJFKPDVUGRECS-GOSISDBHSA-N	441.513	1.620	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)NC[C@@H]2CCC[C@@]23NC(=O)N(C)C3=O)c1	753023301	MWSWDNFYNNGJFD-OYHNWAKOSA-N	445.520	1.548	50	20	IDGD	
N#Cc1cc(Br)cc(S(=O)(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)c1	754261251	VYLQBYZYJRLRGV-UHFFFAOYSA-N	441.219	1.558	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)Nc1cccc(I)c1	755388595	JFYNZFLLAIZERI-UHFFFAOYSA-N	449.212	1.733	50	20	IDGD	
CNS(=O)(=O)c1cc(NC(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)ccc1C	755516556	SIHQJKFDZWOWCS-UHFFFAOYSA-N	446.464	1.899	50	20	IDGD	
C[C@@H](CN1CCOCC1)N(CC(=O)NNC(=O)c1cccc(C#N)c1)Cc1ccccc1	756522500	RKVYPZXJSDTNLS-IBGZPJMESA-N	435.528	1.542	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)COCc2ccccc2)cc1N1CCCS1(=O)=O	756704314	LKIRVBRFLCZNRI-UHFFFAOYSA-N	432.502	1.904	50	20	IDGD	
O=C1C[C@@H](Cc2ccc(NC(=O)NNC(=O)c3nn(-c4ccccc4)cc3O)cc2)C(=O)N1	756814547	FZPIENHESVCKFF-CQSZACIVSA-N	448.439	1.250	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)Nc1cccn(CC(F)(F)F)c1=O	757655598	FORWBXWNVQHNKW-UHFFFAOYSA-N	429.311	1.551	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2cc3c(cc2C)OCO3)cc1	757977918	AXVQKNRFSZRBQT-UHFFFAOYSA-N	434.474	1.506	50	20	IDGD	
O=C(/C=C\c1ccc(Cl)nc1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	758044698	XZIZFQRODOGDBT-CLFYSBASSA-N	434.905	1.994	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1ccccc1	758693693	WSCYOPOYHHTNQF-KRWDZBQOSA-N	434.474	1.893	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1Br)C(=O)NNC(=O)C(=O)Nc1ccccn1	758837419	BFVZKSHEDOLRLA-SECBINFHSA-N	425.214	1.537	50	20	IDGD	
Cc1ccc(CNC(=O)NNC(=O)C(=O)Nc2ccccn2)c(OC[C@H]2CCOC2)c1	758847534	VKWHQMYTBSELPR-HNNXBMFYSA-N	427.461	1.274	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)NC[C@@]3(Cc4ccc(F)cc4)CCC[C@H]3O)nc21	759650349	OBCZMQBVUAJTRF-QRWLVFNGSA-N	429.456	1.608	50	20	IDGD	
COc1ccc(COCCCC(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1	760262249	BURIVCSDFFPPRX-UHFFFAOYSA-N	434.518	1.746	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)CCc2nnc(C3CCCC3)o2)cc1	760265284	RFRWACYKYGCVOB-UHFFFAOYSA-N	449.533	1.436	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)N2CCC(N3CCS(=O)(=O)CC3)CC2)c1C	760436980	XGQQCHVRCLLLAN-HKWRFOASSA-N	448.589	1.380	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)[C@@H]1CC(=O)N(Cc2ccccc2Cl)C1	760439826	RYLXSAXAWXVLBV-CQSZACIVSA-N	438.912	1.751	50	20	IDGD	
C[C@H](NC(=S)NNC(=O)CCNC(=O)[C@@H]1CCCN1C(=O)OC(C)(C)C)C1CC1	760826781	XYISEFLZLPQDON-JSGCOSHPSA-N	427.571	1.186	50	20	IDGD	
O=C(NN=Cc1cnc(C2OCCO2)s1)c1ccc(S(=O)(=O)N2CCCC2)cc1	761760803	VLKFQNGAKGGUMX-UHFFFAOYSA-N	436.515	1.737	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)NC[C@H]1[C@H](C)OC(C)(C)N1C(=O)OC(C)(C)C	762332030	UOFLXURSHVEUEI-MJBXVCDLSA-N	432.518	1.129	50	20	IDGD	
CCOC(=O)C(C)(C)C(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	762937217	LKUSZGNBSOSCCO-UHFFFAOYSA-N	439.515	1.899	50	20	IDGD	
CN(NC(=O)c1ccc(OCC(F)F)nc1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	763280577	CZTVEIBEDDOIFW-UHFFFAOYSA-N	443.451	1.975	50	20	IDGD	
O=C(NNC(=O)c1ccc2ccccc2n1)C(=O)Nc1ccc(-n2cncn2)c(Cl)c1	763451042	UQHWHGSSKQALJX-UHFFFAOYSA-N	435.831	1.869	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(C#Cc3ccccn3)c2)cc1OC	763542685	IXWOBEXJUHVMJL-UHFFFAOYSA-N	444.447	1.898	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(CC(N)=O)cc2)c(C)n1-c1ccccc1	763601609	GXVCHEJZLAADLG-UHFFFAOYSA-N	433.468	1.522	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)NCc1ccc(N2CCCS2(=O)=O)cc1	763664469	BMGHMADOUZZGOV-UHFFFAOYSA-N	432.502	1.274	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)C(=O)Nc1cccnc1OCc1ccccc1	763680507	JKYCAVWRYVPSJU-UHFFFAOYSA-N	438.415	1.965	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)C(=O)Nc1c(F)cccc1-n1cccn1	763802377	DCXPVTMMJDQGSS-UHFFFAOYSA-N	442.363	1.085	50	20	IDGD	
Cc1ccccc1C(=O)N[C@H](CC(C)C)C(=O)NNC(=O)CNC(=O)c1cccnc1	763818913	PYUHUZBZJHBPGJ-GOSISDBHSA-N	425.489	1.112	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)C(=O)Nc1ccn(-c2ccncc2)n1	763850996	SDHFHPSEJVBHAC-HNNXBMFYSA-N	444.451	1.974	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccc(N2CCOCC2)c(F)c1	763872272	MZXUGPYCIYPANJ-CYBMUJFWSA-N	448.426	1.355	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@H](C)C(=O)NNC(=O)C(=O)Nc1cncnc1N(C)C	763882783	LWXZMPMJRAYIAU-GFCCVEGCSA-N	434.884	1.366	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)CSc2ccc(C)cc2)ccc1NC(C)=O	763890728	FOVOTYXUSNNFPH-UHFFFAOYSA-N	430.486	1.840	50	20	IDGD	
CC(=O)N(C)c1cccc(NC(=O)C(=O)NNC(=O)c2cc(Br)cn2C)c1	764004325	CWFKJLZVRWUPAC-UHFFFAOYSA-N	436.266	1.170	50	20	IDGD	
O=C1CCc2cc(F)c(NC(=O)C(=O)NNC(=O)c3cc(-c4ccccc4)on3)cc2N1	764017434	XXPNFYIDMPYALB-UHFFFAOYSA-N	437.387	1.765	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(Cl)c2N2CCOCC2)cc1	764183528	ZSEKNNQQUOPVNA-UHFFFAOYSA-N	427.848	1.448	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)C(=O)Nc1nc(C(C)(C)C)ns1	764204276	JYUGPTXRVGFGFU-UHFFFAOYSA-N	428.515	1.226	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)C(=O)Nc1ccc(NC(=O)[C@@H]2CCCO2)cc1	764242519	VGLZQWDCGDTUKK-IBGZPJMESA-N	449.467	1.545	50	20	IDGD	
Cc1ccc(C(=O)Nc2ccccc2)cc1NC(=O)C(=O)NNC(=O)Cc1cccnc1	764268566	MKYDXTMGFLOBSN-UHFFFAOYSA-N	431.452	1.971	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cc(Br)ccc2O)cnc1Cl	764276496	FDMAWRYIEAIOJW-UHFFFAOYSA-N	427.642	1.911	50	20	IDGD	
CCOCC(=O)NNC(=O)C(=O)Nc1ccc(NC(=O)CN2CCCCCCC2)cc1	764316962	HOMJZQMEKFTALT-UHFFFAOYSA-N	433.509	1.014	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccccc2F)cc1Cl	764321291	UKTHGHDYTLWMIN-UHFFFAOYSA-N	437.811	1.360	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C(=O)Nc1cccc(S(=O)(=O)NC2CC2)c1)c1ccccc1	764327833	GDLUCTRTKJYZRV-SFHVURJKSA-N	444.513	1.407	50	20	IDGD	
CCCN(C(=O)c1ccccc1NC(=O)C(=O)NNC(=O)Cc1ccncc1)C(C)C	764352763	DGJSDQRQOCCCMT-UHFFFAOYSA-N	425.489	1.671	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)C(=O)Nc1ccc(F)cc1OCC(F)F	764365882	GWDZVXAVSALERI-UHFFFAOYSA-N	425.363	1.772	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(OCc3noc(C4CC4)n3)cc2)o1	764370539	DQMMPJZWXLKZIJ-UHFFFAOYSA-N	425.401	1.827	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc4c(c3)CC(=O)N4)n[nH]2)cc1C	764386823	CRRONNGYSFQMSO-UHFFFAOYSA-N	432.440	1.588	50	20	IDGD	
CC[C@@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)cc1	764400653	FYJPEPGFKUNYDR-CYBMUJFWSA-N	444.513	1.799	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)[C@@H]2CN(C(=O)OC(C)(C)C)CCO2)n[nH]1	765592556	OOXKDKRGVHTPGG-KRWDZBQOSA-N	445.476	1.482	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)Cn3c(O)nc4ccccc43)n[nH]2)cc1OC	765597539	JAPLMHBXHLIYHH-UHFFFAOYSA-N	436.428	1.610	50	20	IDGD	
COC(=O)NNC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(Br)s1	765846495	JOVWUNBHMYPXKZ-QMMMGPOBSA-N	426.314	1.441	50	20	IDGD	
CC(=O)Nc1ccc(Cl)c(C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)c1	767822420	KOUCGYCDAXAHDQ-UHFFFAOYSA-N	437.909	1.975	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)[C@@H]2CC(=O)N(CC(F)(F)F)C2)n[nH]1	768282065	VMKZLUBFJBFCNR-SNVBAGLBSA-N	425.367	1.257	50	20	IDGD	
NS(=O)(=O)c1cccc2c(C(=O)NNC(=O)c3cnn(-c4ccccc4)c3)nccc12	768478187	IQWQJOMAZASFCO-UHFFFAOYSA-N	436.453	1.143	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCN(C(=O)OCc2ccccc2)C1)c1ccc2c(c1)OCCO2	770132740	VRMRFFRSKZFCIG-QGZVFWFLSA-N	425.441	1.878	50	20	IDGD	
C[C@@H]1CN(c2ccnc(C(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)c2)C[C@@H](C)O1	770831105	GIXTYVPQKCOQRV-ZIAGYGMSSA-N	432.502	1.174	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2cc(Br)cc([N+](=O)[O-])c2)C[C@@H](C)O1	770949677	DJXPGGUTPJSHHM-PHIMTYICSA-N	429.271	1.618	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)[C@H]3CC(=O)N(c4ccccc4Br)C3)nc21	770973629	NWJBRPMGMUEFPH-VIFPVBQESA-N	446.265	1.328	50	20	IDGD	
CCOC(=O)CNC(=O)C1CCN(C(=O)NNC(=O)c2cccc(OC(F)F)c2)CC1	771980397	QCGKIUILZLDFJF-UHFFFAOYSA-N	442.419	1.034	50	20	IDGD	
C[C@H]1Oc2ccccc2N(CCC(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)C1=O	772187791	FKFBESBORAAJKX-CYBMUJFWSA-N	444.875	1.308	50	20	IDGD	
O=C(NCCc1ccc(OCC(F)(F)F)nc1)NNC(=O)c1ccc2c(c1)OCCO2	773613553	PKZWATZWSUIOKI-UHFFFAOYSA-N	440.378	1.981	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2ccc(C(=O)NCc3ccc(F)cc3)cc2)n1	773724156	MZWNSQMKAVYZGS-UHFFFAOYSA-N	438.419	1.636	50	20	IDGD	
COc1cc(C)nc(NNC(=O)[C@@H]2CC(C)C[C@H]2C(=O)NNc2nc(C)cc(OC)n2)n1	775867865	OQJULLVOAFCOLH-ZIAGYGMSSA-N	444.496	1.149	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)Nc1nnc(-c2c(F)cccc2Cl)s1	775904304	XUEOBUCJLMOGOD-SSDOTTSWSA-N	433.874	1.585	50	20	IDGD	
C#C[C@@H](NC(=O)NNC(=O)c1nn(CCCCC)c(=O)c2ccccc12)[C@H]1CCCO1	776226215	DWYNFOIKBONMLT-QZTJIDSGSA-N	425.489	1.712	50	20	IDGD	
CC(C)NC(=O)C(=O)NNC(=O)[C@H]1CC(=O)N(C(C)C)[C@@H]1c1ccc(Cl)c(F)c1	776703495	XGJKAVMWURRPGP-BLLLJJGKSA-N	426.876	1.449	50	20	IDGD	
O=C(NNC(=O)c1cc(I)ccc1N1CCOCC1)c1ccc[nH]1	778319738	RCPDYWQJAMPVMD-UHFFFAOYSA-N	440.241	1.531	50	20	IDGD	
COc1ccc(N2CCN(C(=O)/C=C/C(=O)NNc3ccc([N+](=O)[O-])cc3)CC2)cc1	778391712	POXMTYZTJWXTNY-ZHACJKMWSA-N	425.445	1.952	50	20	IDGD	
COCCN1C(=O)CCc2cc(NC(=O)C(=O)NNc3cccc([N+](=O)[O-])c3)ccc21	778697079	HXIZYEDQVXEDEW-UHFFFAOYSA-N	427.417	1.602	50	20	IDGD	
CN(C)C(=O)Cn1ccc(NC(=O)NNc2ccc([N+](=O)[O-])cc2Br)n1	779418291	FSSFXLQHGNXQOM-UHFFFAOYSA-N	426.231	1.791	50	20	IDGD	
CCNC(=O)N(C)NC(=O)C1CCN(S(=O)(=O)c2ccccc2C(F)(F)F)CC1	780712775	YJUVPEVUOLWDIM-UHFFFAOYSA-N	436.456	1.799	50	20	IDGD	
N#Cc1ccc(N2CCC[C@H](NC(=O)NNC(=O)CSc3ccccc3O)C2=O)cc1	780896200	LIBAQHXXBZMCMJ-INIZCTEOSA-N	439.497	1.882	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CN2CCNC(=O)[C@H]2c2ccccc2C(F)(F)F)c1	782102905	XMFBPIAQYQYRCX-GOSISDBHSA-N	434.418	1.948	50	20	IDGD	
COC(=O)c1scc(C)c1NC(=O)C(=O)NNC(=O)COc1ccc(Cl)cc1	782121075	RFRFMRIVGKZXRH-UHFFFAOYSA-N	425.850	1.661	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2ccc(NC(=O)NC[C@@H]3CCCO3)cc2)nc1	782145091	AYBBHCNYSYWRMI-INIZCTEOSA-N	428.449	1.473	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)Cc2ccc(C)c(Br)c2)n1	782465469	IZLVMYQRKDQALU-UHFFFAOYSA-N	440.319	1.998	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)CCS(=O)(=O)C1	783425879	JKLCKPFAYFVDFS-HXUWFJFHSA-N	428.470	1.487	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)C(=O)Nc1cnc2c(c1)CCCC2	784210163	GBODAWPYEXUJIC-UHFFFAOYSA-N	429.502	1.483	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)c2cnn([C@@H]3CCCN(C(=O)OC(C)(C)C)C3)c2)n1	784587798	HVNCWFWSVHWUCB-QGZVFWFLSA-N	445.524	1.730	50	20	IDGD	
O=C(NC[C@@H](C(=O)OCc1ccccc1)c1ccccc1)NNC(=O)C(=O)N1CCCC1	786890725	LXYUQQPEIMQNGZ-LJQANCHMSA-N	438.484	1.466	50	20	IDGD	
CCNC(=O)Nc1ccc(C)c(NC(=O)C(=O)NNC(=O)COCc2ccccc2)c1	787549569	NAWZRCNZKRVBBJ-UHFFFAOYSA-N	427.461	1.439	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)c(C)cc1C	788330053	BKSUGQAZNAJAMD-QGZVFWFLSA-N	427.413	1.016	50	20	IDGD	
COC(=O)c1cncc(S(=O)(=O)NNC(=O)c2cc(OC)ccc2Br)c1	788492860	SGQAIEGIBOZUGI-UHFFFAOYSA-N	444.263	1.263	50	20	IDGD	
O=C(CN1C(=O)COc2ccc([N+](=O)[O-])cc21)NNC(=O)[C@H]1OCC[C@H]1c1ccccc1	788870702	VFAHGWWQAMPJDA-YWZLYKJASA-N	440.412	1.040	50	20	IDGD	
Cc1cccc(F)c1S(=O)(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	788917849	WSJCEAPHONBLOV-UHFFFAOYSA-N	430.502	1.932	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2cc(Br)cn2C)ccc1Cl	789732827	YNUOJVWDADAEEF-UHFFFAOYSA-N	429.658	1.849	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)[C@@H]1CC12CN(C(=O)OC(C)(C)C)C2	789848447	UIACWOXZBYSTAP-LBPRGKRZSA-N	425.507	1.799	50	20	IDGD	
CCN(CC)C(=O)CN1CCN(C(=O)/C(C#N)=C/c2cc(C)n(CCOC)c2C)CC1	790533200	QUQVLEJYGWSYAC-RCCKNPSSSA-N	429.565	1.671	50	20	IDGD	
Cn1nc([C@H]2CCCOC2)cc1NC(=O)C(=O)NNC(=O)c1cccc(C(F)(F)F)c1	790951894	MKQCAFNZOOYIBV-LBPRGKRZSA-N	439.394	1.733	50	20	IDGD	
CCCC[C@@H](/N=C1/NS(=O)(=O)c2ccccc21)C(=O)NNc1nc2ccccn2n1	791239375	GADHIIDTIKTFJG-CQSZACIVSA-N	427.490	1.470	50	20	IDGD	
Cn1ccc2ccc(NC(=O)C(=O)NNC(=O)[C@H]3OCC[C@H]3c3ccccc3)cc2c1=O	793069786	STAGAEMAXOWVPM-HKUYNNGSSA-N	434.452	1.197	50	20	IDGD	
COC(=O)[C@@]1(c2ccccc2)CCN(CC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)C1	794802885	ICZRQAKYKPTOJM-NRFANRHFSA-N	426.429	1.173	50	20	IDGD	
Cc1c(NC(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)cc(Br)cc1[N+](=O)[O-]	797684786	JIQZWFVXYSNGSE-QMMMGPOBSA-N	435.256	1.253	50	20	IDGD	
Cn1c(=NNC(=O)c2ccc(S(=O)(=O)NC[C@@H]3CCCO3)cc2)sc2ccccc21	798304041	BYQTUOAWDZYDSW-HNNXBMFYSA-N	446.554	1.943	50	20	IDGD	
CC(=NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)c1cn(C)c(C)n1	800804577	CVLAUTGKELWNDO-UHFFFAOYSA-N	433.534	1.222	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2nnn(-c3ccc(OC(F)F)cc3)c2C)cc1	801110282	WCNOWSBIILLNCJ-UHFFFAOYSA-N	444.398	1.885	50	20	IDGD	
CC(C)[C@@H](NS(=O)(=O)c1ccc2c(c1)OCCCO2)C(=O)NNc1cccc(F)n1	804770446	BTABXBSFYNNKKT-GOSISDBHSA-N	438.481	1.828	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)C[C@H]1COCCN1C(=O)OC(C)(C)C	807211287	MMKKLYOATZLKOL-ZDUSSCGKSA-N	430.502	1.075	50	20	IDGD	
N#Cc1ncn(-c2ccccc2NC(=O)C(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)n1	810385258	PMZYSRZQHKVZHC-UHFFFAOYSA-N	433.472	1.441	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3nc(C)nn3c2)cc1OC	810386426	ZKEKNFLDKZPKOA-UHFFFAOYSA-N	440.460	1.625	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(C)c(F)cc2C(=O)NCC(F)(F)F)o1	810387536	ZVHYINIAYLVOQY-UHFFFAOYSA-N	444.341	1.727	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2cc(C)c(F)cc2C(=O)NCC(F)(F)F)n1	810388505	XZTBZQYCMGNIRV-UHFFFAOYSA-N	444.345	1.307	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(S(=O)(=O)N(C)C(C)C)cc2)cc1C	811305914	XWZZYXGAXOZNOL-UHFFFAOYSA-N	446.529	1.732	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCc1ccc(CC(N)=O)cc1	811852991	KHYQWBVBLUGQAP-LBPRGKRZSA-N	449.305	1.775	50	20	IDGD	
COc1ccc(NC(=O)NNc2ccccc2S(=O)(=O)N(C)C)cc1-n1nnnc1C	814628733	CSUUACPMHYTUHM-UHFFFAOYSA-N	446.493	1.378	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCc2nncn2C1)Nc1ccc(Cl)c(-n2nnnc2C2CC2)c1	814655274	UFWJFTBOXXLOGY-LLVKDONJSA-N	442.871	1.200	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NN=C2CCN(CCN3CCOCC3)CC2)C1	814972687	IJURODVVDUZMHM-GOSISDBHSA-N	437.585	1.534	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NN=Cc2ccc(F)c(S(N)(=O)=O)c2)C1	814974635	XPZQOMHUGQCOAC-CYBMUJFWSA-N	428.486	1.570	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)nnn1Cc1ccccc1F	815569707	DUCWDEXZWNTCAG-UHFFFAOYSA-N	446.826	1.533	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)c2coc(S(=O)(=O)N(C)C)c2)c1	818757399	VFSFUGAITDRKMI-UHFFFAOYSA-N	446.279	1.836	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)CCNS(=O)(=O)c2cccc(Cl)c2)c1	825805782	QCYGHFYPRZOLQX-UHFFFAOYSA-N	440.909	1.277	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=O)COc2ccccc2F)c1	864019630	KLFGIUVRJRRFMM-UHFFFAOYSA-N	429.857	1.569	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCOCC3)cc2)c(C)c1	913164384	NRCWRFQZMWTWIQ-UHFFFAOYSA-N	446.529	1.197	50	20	IDGD	
Cc1cc(OCc2ccc(C(=O)NNC(=O)CC[C@H]3NC(=O)NC3=O)cc2)ccc1Cl	913419341	HUVGHAUNKYVZQE-QGZVFWFLSA-N	444.875	1.977	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)NC2CC2)cc1)NNC(=O)COc1ccc(F)cc1	913623881	MRJRNOQCYIZGOV-UHFFFAOYSA-N	435.477	1.425	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(N2C[C@@H](C(=O)O)CC2=O)cc1)c1ccc(Cl)cc1	914746183	DYKZEYXPPJXRDO-LBPRGKRZSA-N	437.861	1.401	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NN=Cc2cnc(N3CCCC3)nc2)c1	914772154	LNDINRWKEUYFQW-UHFFFAOYSA-N	430.534	1.871	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)CNS(=O)(=O)c1ccccc1F	915787923	NIXWWABSINMNHW-CQSZACIVSA-N	445.472	1.872	50	20	IDGD	
CC(C)CCC[C@H](C)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	915884120	MSMAUOBKJXHCLX-INIZCTEOSA-N	440.566	1.866	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NC[C@H](c2ccc(F)cc2)N2CCOCC2)cc1OC	915897987	NKDYGFUYFPQPDL-GOSISDBHSA-N	446.479	1.860	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccccc1F)c1cccc(S(=O)(=O)N2CCCCC2)c1	916107829	MPQDAAYNXYKGKG-UHFFFAOYSA-N	441.506	1.624	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCc2ccnc(N3CCCCC3)c2)c2ccccc2c1=O	916254605	JEDWZCJFYURMLK-UHFFFAOYSA-N	449.515	1.946	50	20	IDGD	
O=C(COc1ccccc1Cc1ccccc1)NNC(=O)NC[C@H]1CCS(=O)(=O)C1	916375178	MDLYFAMNQXSEHI-QGZVFWFLSA-N	431.514	1.421	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCC(NC(=O)Nc3ccc(F)cc3)CC2)n1	917112425	NTUOBIUVWXMFOC-UHFFFAOYSA-N	448.524	1.567	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)N[C@H](c1ccc2c(c1)OCCO2)C1CC1	918139947	NKAUORNQMUIODT-IBGZPJMESA-N	435.444	1.529	50	20	IDGD	
O=C(NCCc1cccs1)NNC(=O)[C@H]1CS[C@H](Cc2ccccc2F)C(=O)N1	920859306	BLHRQFXNDLJHLS-HZPDHXFCSA-N	436.534	1.603	50	20	IDGD	
CCC(=O)N[C@H](CCSC)C(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1	1318623029	UGJJFXVKWZQWFP-CQSZACIVSA-N	430.571	1.429	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)CNC(=O)c2cc3ccccc3[nH]2)CC1	1319123295	PBZCSWQAEWJJKR-UHFFFAOYSA-N	443.504	1.692	50	20	IDGD	
O=C(CN1C(=O)Cn2c(cc3ccccc32)C1=O)NNc1cncc(Br)c1	1319649207	PMPSWHMMIOGRAR-UHFFFAOYSA-N	428.246	1.925	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@H](c2ccccc2)c2cnn(C)c2)c2ccccc2c1=O	1320206228	WZYUTNLFEGHFCY-LJQANCHMSA-N	445.483	1.884	50	20	IDGD	
CNS(=O)(=O)c1ccc(CC(=O)NNC(=O)c2ccc(COc3ccccc3)o2)cc1	1323861927	RGOFDJSUHFTQRG-UHFFFAOYSA-N	443.481	1.770	50	20	IDGD	
O=C(c1n[nH]c2c(F)cccc12)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1778638209	FZQNXASDYSSHEZ-RHSMWYFYSA-N	443.248	1.836	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnc3ncccn23)C1	1778654204	KRJATSNKYZMHOD-AKCHCHLHSA-N	435.912	1.111	50	20	IDGD	
Cc1cc2nnc(C(=O)N3CCO[C@@]4(CCN(C(=O)CO[Si](C)(C)C)C4)C3)c(C)n2n1	1779295343	JLMCDERBPAKQRX-HXUWFJFHSA-N	446.584	1.036	50	20	IDGD	
CCSc1cccnc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2	1780260520	WYGOIUDVFNUDPM-AKCHCHLHSA-N	441.981	1.921	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CSC(=N)N)C2	1780713326	QVIOVHGZDWPMGN-HFBAOOFYSA-N	425.382	1.363	50	20	IDGD	
COc1cnc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](F)Br)C2)cn1	1780771970	XKSLIDGCYCLEGP-SUYBPPKGSA-N	445.289	1.303	50	20	IDGD	
O=C(c1snnc1C1CC1)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781330174	SEICGLRFBUBAOV-DOMZBBRYSA-N	433.303	1.550	50	20	IDGD	
O=C(c1cccc2nc[nH]c12)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781331763	VWSHCMJMWXLZQB-RHSMWYFYSA-N	425.258	1.697	50	20	IDGD	
O=C(c1nc2ccccc2o1)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781331967	BRYAQQJYLUGJCW-GUYCJALGSA-N	426.242	1.962	50	20	IDGD	
COc1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](F)Br)C3)C2)ccc1O	1781334407	NLANWXAUPDQAHA-WMLDXEAASA-N	431.258	1.535	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(CCN(C(=O)c3c(O)cc(O)cc3O)C2)C1	1781812791	RTYRJQSGQXANKK-QGZVFWFLSA-N	429.267	1.032	50	20	IDGD	
O=C1Cc2cccc(C(=O)N3CC[C@]4(CN(C(=O)CCBr)CCO4)C3)c2N1	1782406236	CPFBNRHMKADSIG-IBGZPJMESA-N	436.306	1.410	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1783399848	JCIKXMSPWMRFEN-LRDDRELGSA-N	438.294	1.032	50	20	IDGD	
CC(C)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CNC(=O)c3ccco3)C[C@@H]21	1783850841	UYPBSXWRLQVZJN-DZKIICNBSA-N	425.913	1.254	50	20	IDGD	
CC(C)[C@H]1CC[C@H](C(=O)N2CCO[C@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)CC1	1783936121	DKOKFDNZHBNCFP-YDHSSHFGSA-N	436.597	1.652	50	20	IDGD	
COc1ccc(COCC(=O)N2CCO[C@]3(CCN(C(=O)C(Cl)Cl)C3)C2)cc1	1783950455	NMABXTXBJSFBNQ-LJQANCHMSA-N	431.316	1.845	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CC(=O)OC(C)(C)C)C[C@@H]21	1783970355	XQSWGQQLIQORAP-QPSCCSFWSA-N	447.370	1.729	50	20	IDGD	
O=C(Cc1cc(F)ccc1Cl)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21	1784925344	QMWHDTZVZIZUKD-GQGQLFGLSA-N	433.307	1.601	50	20	IDGD	
C[C@H](NC(=O)c1ccccn1)C(=O)NC1(c2ccc(NC(=O)[C@H](O)CCl)cc2)CCC1	1786135547	JBQIABVAVYLQNZ-KBXCAEBGSA-N	444.919	1.934	50	20	IDGD	
CCC(=O)N[C@H](C)C(=O)Nc1ccc(C2(NC(=O)CCC(=O)NN(C)C)CCC2)cc1	1786295008	AZGMSWQXZHGEKK-OAHLLOKOSA-N	431.537	1.408	50	20	IDGD	
CC(=O)NC(C)(C)C(=O)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1	1786386196	ACPSQEQSNICFMW-UHFFFAOYSA-N	437.305	1.029	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3noc4c3CCCC4)[C@H]2C1	1787305974	RCZWEFZEKWVQGN-DSPQJCBJSA-N	440.338	1.930	50	20	IDGD	
COc1ccc([N+](=O)[O-])c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)C(Cl)Cl)C[C@@H]32)n1	1787751997	ZQQMBFUKTYJNGX-NHCYSSNCSA-N	447.275	1.395	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cn3c(=O)n(C)c4ccccc43)C[C@@H]21	1789859600	GZMIWMKKNDXGSM-GGXPGOJBSA-N	448.951	1.337	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3csc4c3CCCO4)C[C@@H]21	1791254086	KZTWMFDLZMJIFR-CSFVBSKPSA-N	442.965	1.920	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3cnn(C)c3)[C@H]2C1	1791670405	LQFMFEABJOFLHN-JONQDZQNSA-N	427.343	1.116	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c3ccccc3n3ccsc13)C2)[C@@H](O)CCl	1792980835	NKLQHTMOHXDLJC-VLWCASSMSA-N	447.944	1.957	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C#CC1CC1	1793261910	IUXWQIQSIZYUFI-BDCURPAKSA-N	425.435	1.875	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cc1cn3c(nc1=O)SCC3)C2	1793682554	ZPYJDJSVWFBILY-QKPAOTATSA-N	438.981	1.937	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCc1ccc(F)nc1	1794022180	FIMQHJLBYURNQY-DPYKFYPSSA-N	428.302	1.526	50	20	IDGD	
CC(C)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2c(n1)NC(=O)CC2	1796104009	LWACRFAQHYOVHV-XOIINTDNSA-N	434.924	1.435	50	20	IDGD	
Cc1cccc2cc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3ccc(B(O)O)cc3)[nH]c12	1796189037	OQFYVZQDCQQASC-ACDBMABISA-N	431.301	1.722	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)c1cccc2cnccc12	1796191431	KQVNFWUYHBUXEH-ACDBMABISA-N	429.285	1.480	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1c[nH]c2ncccc12	1796880363	YDNPFKQKORHHIA-NOXHYTERSA-N	435.322	1.940	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc3nn[nH]c3c1)C2	1796893483	ACJMEGPUOTXKSW-XMOXNHLCSA-N	448.487	1.344	50	20	IDGD	
COc1cc(C)ccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnccc1C(=O)NN	1798443482	AMDJJWRFEJUXOM-MUJYYYPQSA-N	437.500	1.568	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cn3ncccc3n1)C2	1799275490	SNPWADGHUQGKIY-ABXQLRGKSA-N	426.304	1.169	50	20	IDGD	
C[C@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@](C)(Cl)CCl)[C@@H]1SC(=N)NC1=O	1800078719	JSZYYLZRPXROQY-JJFBLWEHSA-N	435.377	1.663	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Nc1nccs1)C2	1800757809	QNYBQQWVQMFUDE-OFTGVCEQSA-N	431.356	1.317	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CC(c3ccccc3)=NN1)C2	1800762734	ZMPUSSRDPAGJMC-UIVXMWCNSA-N	449.349	1.126	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1ccc(C)c(F)c1)C2	1800970875	LVXHIRFJQWAPHW-AXVVYFOYSA-N	426.916	1.910	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(-c3ccccc3)on1)C2	1800973267	FKINZYZILZHZCK-YYAJDYIMSA-N	433.892	1.799	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CCCO1	1801915457	PDPMOLMDVIAXSE-QRJUGERDSA-N	429.945	1.936	50	20	IDGD	
Cc1nc(CC(=O)NC[C@H]2CCN(C(=O)CO[Si](C)(C)C)[C@@H]2c2cccnc2)no1	1804496199	LCWZHNMZLGVIRA-OXQOHEQNSA-N	431.569	1.873	50	20	IDGD	
Cn1nc(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](F)Br)[C@H]2c2cccnc2)cc1O	1804898894	VSDMNTLNQJTFPP-TUKIKUTGSA-N	440.273	1.531	50	20	IDGD	
Cc1ccc(=O)n(C(C)(C)C(=O)N2CCC3(CCCN(C(=O)[C@H](O)CCl)C3)CC2)n1	1805522453	JDPAKOFYEDONMU-MRXNPFEDSA-N	438.956	1.118	50	20	IDGD	
CCc1oncc1C(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1806033302	QZFQRUSLVBRWPS-IERDGZPVSA-N	442.520	1.325	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1	1807998163	IZYXZOVVAJUSMA-DHSIGJKJSA-N	434.880	1.461	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)c2nc3ncccn3n2)[C@H]1c1cccnc1)C(Cl)Cl	1813078790	AFSCRPRQHQCNNB-OLZOCXBDSA-N	434.287	1.643	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H]2CCC(=O)NC2)n[nH]1	1814524772	ADEQFJALNSRTDV-GVXVVHGQSA-N	426.315	1.711	50	20	IDGD	
Cc1cccc(CC(=O)N[C@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)c1	1815355115	NFNMHKGZZVTPMU-SFHVURJKSA-N	449.341	1.600	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)cnc1C	1817474142	NLVWWEJEWNKQMF-HXUWFJFHSA-N	447.304	1.721	50	20	IDGD	
CC(=O)OC[C@H](OC(C)=O)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](F)Cl)[nH]n1	1819430715	BJTSJJCINAYBLD-IPYPFGDCSA-N	432.836	1.431	50	20	IDGD	
CCCC(=O)N[C@H](C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](Cl)COC)[nH]n1	1819565014	HODGCLDIUZRQCN-VNHYZAJKSA-N	427.933	1.960	50	20	IDGD	
C=CC[C@H](C(=C)C)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2	1819597804	MHZULFROAKOFRS-IAGOWNOFSA-N	439.346	1.817	50	20	IDGD	
C=C1CC(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cnccc4C(=O)NN)sc3C2)C1	1819791145	MKQLOKLYWSWEIS-GFCCVEGCSA-N	426.502	1.334	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CS(C)(=O)=O)[nH]n1	1820864157	RMPMFDGNKWMOTJ-XHDPSFHLSA-N	425.338	1.683	50	20	IDGD	
O=C(Cc1ccccc1O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1822010782	BHKQQVPVNISCMS-LJQANCHMSA-N	448.288	1.344	50	20	IDGD	
Cc1noc(C)c1C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1	1822412649	BCPRVRAEBMSPLW-HNNXBMFYSA-N	431.497	1.693	50	20	IDGD	
CCS(=O)(=O)CC(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H](C)Br)CC1	1824468653	FMHGZULQRRGGRM-UKRRQHHQSA-N	437.400	1.824	50	20	IDGD	
COC(=O)C1(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@H](F)Br)CC3)CC1	1825280760	PYMNYLMQUPHDGW-XVKPBYJWSA-N	434.287	1.699	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CN1CCCC1=O)CC2	1825446226	AAILLEMNGUCRHX-QWRGUYRKSA-N	443.367	1.851	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(CO)on1)CC2	1825645754	JETBXAMJZKBFTQ-YUMQZZPRSA-N	429.296	1.633	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)c2ccsc2)CC1	1825796185	XUCHFKCIIBPVQD-FQEVSTJZSA-N	426.347	1.975	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1sc(N)nc1C)CC2	1825998773	JULQGSPFKHORIZ-DTWKUNHWSA-N	429.955	1.970	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(O)cc1)CC2	1826088693	JVIFWEATGRSIRL-ZDUSSCGKSA-N	431.518	1.448	50	20	IDGD	
O=C(CCc1ccoc1)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827059440	BEAMYTOQNDXUKJ-QFIPXVFZSA-N	438.333	1.826	50	20	IDGD	
O=C1NCCCn2nc(C(=O)N3CCCC[C@@H]3C3CCN(C(=O)[C@H](F)Cl)CC3)cc21	1828500301	MZJUPOOXHIJUDF-WBVHZDCISA-N	439.919	1.784	50	20	IDGD	
CN1CCN(C2(C(=O)N3CCCC[C@H]3C3CCN(C(=O)[C@H](F)Cl)CC3)CC2)CC1	1830247858	ZSALMPCEUUBGBG-ROUUACIJSA-N	428.980	1.921	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(Cl)ncn3)C2)C1	1830364480	MGKRHDVWSCIXPQ-SFHVURJKSA-N	431.320	1.465	50	20	IDGD	
CCc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)n(C)n1	1830364703	QUNQXAOFGAEYIG-FQEVSTJZSA-N	426.945	1.318	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(N(C)C)cn3)C2)C1	1831644267	SQIFNAHPSJGZAS-UTKZUKDTSA-N	438.956	1.625	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CCN2CCOC2=O)CC1	1831831425	XXLKFVMKWBCZRL-IRXDYDNUSA-N	429.945	1.702	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCc2ccc(O)nn2)CC1	1831834969	LSVOFMLZXQRKNG-ZWKOTPCHSA-N	438.956	1.988	50	20	IDGD	
O=C1C[C@H](C(=O)N2CCCC[C@H]2C2CCN(C(=O)[C@H](F)Br)CC2)CCN1	1831942428	VUOJJRMLKLRXIO-YCPHGPKFSA-N	432.334	1.823	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3ncccc3C)CCO2)C1	1832781169	GILYKVBKFXOYAR-UWJYYQICSA-N	439.940	1.033	50	20	IDGD	
CC(=O)N(C)CCC(=O)NC1CCN(C2CCN(C(=O)CO[Si](C)(C)C)CC2)CC1	1833670325	NJTVVUBZZYMQEP-UHFFFAOYSA-N	440.661	1.278	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@H](NC(C)C)C(C)C)CC2)CC1	1834787865	OPUVQOVIEYTTPC-WOJBJXKFSA-N	445.048	1.834	50	20	IDGD	
CC[C@H](NC)C(=O)NC1CCN(C2CCN(C(=O)[C@H](Br)CC)CC2)CC1	1834794867	JFWPOWMOFOIHHS-SJORKVTESA-N	431.419	1.730	50	20	IDGD	
CCc1nc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCBr)CCO3)C2)co1	1834822994	CQCITURODRLDTG-QGZVFWFLSA-N	430.299	1.092	50	20	IDGD	
COC(=O)c1ccc(C(=O)N2CCC(N3CCC(NC(=O)[C@H](F)Cl)CC3)CC2)cn1	1835079819	UWAOBICSJYLXCH-KRWDZBQOSA-N	440.903	1.588	50	20	IDGD	
O=C(c1cc(Cl)ccn1)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836718628	XFYUCJRAGMCJCW-QGZVFWFLSA-N	430.332	1.947	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cn4cc(F)ccc4n3)CCO2)C1	1836961366	BWWYIPZUCBZXRO-QRWLVFNGSA-N	438.887	1.561	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)/C=C/c3ccco3)CC2)CC1	1837189913	DEZQEZDDYKMUPT-FNORWQNLSA-N	446.548	1.664	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(Cl)cn3)C2)C1	1837715602	ZVEATJHBJSKQKV-LJQANCHMSA-N	441.988	1.657	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2	1839150148	ZXMFZMBHBCLVHD-DLBZAZTESA-N	429.772	1.944	50	20	IDGD	
Cc1onc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)c1C	1839150340	JQZUFFXHEJQWCE-MSOLQXFVSA-N	434.320	1.598	50	20	IDGD	
CC(C)=NO[C@@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCBr)C2)C1	1839224399	RBHWNEITQLSOLV-WMLDXEAASA-N	434.331	1.029	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3c(C)cccc3Cl)CCO2)C1	1839341648	GEULRFMZZURZAN-OXJNMPFZSA-N	445.343	1.972	50	20	IDGD	
COc1ccc(C)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)c1	1839360714	VNFRFTSEIDBBMM-IBGZPJMESA-N	431.316	1.877	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnn4c3CCC4)CCO2)C1	1839532952	KDYHYHPOAWVFLO-RBUKOAKNSA-N	445.347	1.136	50	20	IDGD	
C=CCC(F)(F)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)CBr)C2)C1	1839886642	HFCHQENSYHMGHP-CZUORRHYSA-N	439.297	1.685	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)C3(O)CCC3)C2)C1	1839961770	ICDALWUSBIEILW-VKJFTORMSA-N	447.370	1.167	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(C)cc3O)C2)C1	1840156636	RHPGGVDWOMIONI-OXJNMPFZSA-N	426.897	1.024	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(NC(C)=O)c3)CCO2)C1	1840730115	CKQDCCDAHFWPBK-NQIIRXRSSA-N	437.924	1.732	50	20	IDGD	
COC(=O)c1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)c(C)c1	1840787169	SGKNPSIRRVAKEX-OXJNMPFZSA-N	442.871	1.386	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)C3Cc4ccccc4C3)CCO2)C1	1840944384	DOCACZVSMAFKIY-SIKLNZKXSA-N	436.936	1.112	50	20	IDGD	
COc1cc(N2CCC(C(=O)N3CCCC34CN(C(=O)[C@H](F)Cl)C4)CC2)ncn1	1841460136	VTDDQPGCOBQAFU-INIZCTEOSA-N	425.892	1.439	50	20	IDGD	
O=C(c1nc(-c2ccccc2)ns1)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843013509	RRCRZIONBHFAFB-UHFFFAOYSA-N	448.313	1.016	50	20	IDGD	
Cc1cc2nnc(C(=O)N3CCCC34CN(C(=O)[C@H](C)CBr)C4)c(C)n2n1	1843696943	WJQOKLRZHWYZHR-LLVKDONJSA-N	435.326	1.589	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC2(CCCN2C(=O)c2ccncc2O)C1	1844418737	LLQUCVIWMGZAJJ-AWEZNQCLSA-N	438.912	1.736	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@H](O)c2cccc(Br)c2)C1	1845042159	BEGBTPWBUVCSHN-CABCVRRESA-N	445.741	1.940	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@@H](O)CC(=O)N1CCCC12CN(C(=O)C(C)(C)CCl)C2	1845228838	OJQPWSITUROPDS-AWEZNQCLSA-N	431.961	1.731	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC12CN(C(=O)c1ccc(S(C)(=O)=O)c(F)c1)C2	1846179891	CLPGFLGKLRAMKW-LLVKDONJSA-N	447.326	1.830	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)c1cccnc1-c1ccccc1)C2	1846384891	WEUJDRFIVISIFI-UHFFFAOYSA-N	435.528	1.939	50	20	IDGD	
CCOC(=O)N(CC(=O)N1CCCC12CN(C(=O)[C@H](O)CCl)C2)Cc1ccco1	1846529755	DUTZLCAFBDBLIC-OAHLLOKOSA-N	427.885	1.041	50	20	IDGD	
C#CCO[C@@H](C)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1847800353	NFLYOFFLIHLGGW-VGWMRTNUSA-N	427.929	1.359	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc([N+](=O)[O-])cc1[N+](=O)[O-]	12803636	BOITYZJSMWPONV-UHFFFAOYSA-N	436.406	1.179	50	20	IDGD	
CCc1ccccc1N1C[C@@H](C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)CC1=O	13082431	LLLUINHVMZWENO-INIZCTEOSA-N	433.468	1.954	50	20	IDGD	
C[C@H](NS(=O)(=O)c1ccc(Cl)cc1)C(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	17394870	MNJPSDASAYBWOD-JTQLQIEISA-N	426.838	1.376	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)/C=C/c1ccccc1)C(=O)NNc1nnc(C)c(O)n1	23309540	AGFFDPLQIUFMCH-MARXPDLDSA-N	438.535	1.041	50	20	IDGD	
Cc1ccc(-n2cnnc2SCC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1	115576557	BUAXBVVRKGUQIF-UHFFFAOYSA-N	449.496	1.376	50	20	IDGD	
COCCCNC(=S)N(C)NC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	726075812	NXZOUUKEFDYGTF-UHFFFAOYSA-N	439.541	1.932	50	20	IDGD	
CCc1nc(CCNC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cs1	726717141	LPBASEHQKCOEMW-UHFFFAOYSA-N	430.578	1.791	50	20	IDGD	
CN(C)CCNC(=O)c1cccc(CNC(=O)NNC(=O)c2cccc(N(C)C)c2)c1	727479389	HMFDNMUZZDUSGK-UHFFFAOYSA-N	426.521	1.188	50	20	IDGD	
CSCC[C@@H](C(=O)NNc1nc(-c2ccncc2)no1)N1C(=O)c2ccccc2C1=O	728073338	GJAXTISHKMRMPM-HNNXBMFYSA-N	438.469	1.993	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCCC2)cc1)NNc1nc(-c2cccnc2)no1	728075514	FYKGHBXBEXHXNQ-UHFFFAOYSA-N	442.501	1.992	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@H](C)C(=O)NNC(=O)c1ccc(CS(N)(=O)=O)cc1	728204093	SYVPMKKAHAHBEQ-CYBMUJFWSA-N	439.921	1.974	50	20	IDGD	
O=C(NCCS(=O)(=O)NCc1ccccc1)NNC(=O)c1cccc(OC(F)F)c1	728596461	JIAUGVHMNKDTHH-UHFFFAOYSA-N	442.444	1.352	50	20	IDGD	
CC(C)(C)OC(=O)N1CSC[C@@H]1C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	728889928	ITUCVRIRCQMZQO-CQSZACIVSA-N	436.538	1.150	50	20	IDGD	
N#CCn1c(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc2ccccc21	729301125	ZSCBPDAFICXOPO-UHFFFAOYSA-N	431.861	1.540	50	20	IDGD	
O=C(CCS(=O)(=O)c1ccc2c(c1)OCCO2)NNC(=O)Cn1ccc2ccccc21	729450407	SQKXXJAYKXVPBU-UHFFFAOYSA-N	443.481	1.424	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)N1CCN(CC(=O)NC2CCCCC2)CC1	729507511	VKEVOLCOPCKHPW-UHFFFAOYSA-N	440.548	1.449	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)CNC(=O)c2cccc(Br)c2)cn1	729692754	PKHRNOOQSAKJJN-UHFFFAOYSA-N	438.307	1.600	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)CN2Cc3ccccc3C2=O)c1	729965150	OQXLNIPBCYPOIY-UHFFFAOYSA-N	444.513	1.134	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCN(c2ccc3c(c2)OCCO3)C1=O)c1ccc2c(c1)OCO2	730513378	ZVUNIUGMPXPXQO-AWEZNQCLSA-N	425.397	1.001	50	20	IDGD	
CCOC(=O)C1=NN(c2ccccc2)[C@@H](C(=O)NNC(=O)COc2ccc(F)cc2)C1	731185436	ISRZVOASVMUCMJ-GOSISDBHSA-N	428.420	1.550	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2cccc3c2COC3=O)cc1Br	732048108	ADTHNKRRVHYTGC-UHFFFAOYSA-N	441.259	1.751	50	20	IDGD	
O=C(CCS(=O)(=O)c1ccc2c(c1)OCCCO2)NNC(=O)c1cccc([N+](=O)[O-])c1	741169266	GHUZUVTXHBXHJN-UHFFFAOYSA-N	449.441	1.381	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@H]2CN(Cc3ccccc3)CCO2)c2ccccc2c1=O	741207651	PMUYLBAWHIJSSV-LJQANCHMSA-N	435.484	1.078	50	20	IDGD	
CC(=O)N[C@@H](CC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)c1ccc(F)cc1F	741559511	WBTYBYGSHNCXQA-SFHVURJKSA-N	446.458	1.386	50	20	IDGD	
CN1CCN(c2ccc(CNC(=O)NNC(=O)Nc3ccc(N(C)C)cc3)cn2)CC1	743528161	FXSRDRDSUAALPW-UHFFFAOYSA-N	426.525	1.435	50	20	IDGD	
CCS(=O)(=O)N1CCC(NC(=O)NNC(=O)c2cccc(Br)c2)CC1	743530916	WPKJNYQSMMGJOP-UHFFFAOYSA-N	433.328	1.207	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)CNC(=O)COc2ccccc2)cc1Cl	743834875	XOFSBFHDDLVFNA-UHFFFAOYSA-N	436.852	1.705	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)[C@@H]2CC(=O)N(c3ccc(Cl)cc3)C2)c1	744822705	WOHUVXSHACFGBA-OAHLLOKOSA-N	440.843	1.569	50	20	IDGD	
Cc1cc(C)cc(N2CC[C@@H](C(=O)OCC(=O)NNC(=O)c3cccc(C#N)c3)C2=O)c1	744848433	BZPXBZYQASJHER-LJQANCHMSA-N	434.452	1.532	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2ccc(CN(C)C(=O)C(C)C)cc2)n1	745173928	MIBUWLPVWXSNRI-UHFFFAOYSA-N	446.529	1.613	50	20	IDGD	
COc1cc(C=NNC(=O)c2nn(-c3ccccc3)cc2O)cc(Cl)c1OCC(N)=O	745986484	ILAGADWCICVOCG-UHFFFAOYSA-N	443.847	1.868	50	20	IDGD	
O=C(NNC(=O)c1ccc2nc(S)oc2c1)c1cccc(S(=O)(=O)N2CCCC2)c1	746093012	JPRXHJHSZFVEGO-UHFFFAOYSA-N	446.510	1.976	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)C[C@@H]1CN(Cc2ccccc2)CCO1	746270432	XPTLLFLYHYHRPN-QGZVFWFLSA-N	435.525	1.133	50	20	IDGD	
Cc1nnc(-c2ccc(C(=O)NNc3ccccc3S(=O)(=O)N3CCOCC3)cc2)o1	746331875	KXDVPSJWCDQNGN-UHFFFAOYSA-N	443.485	1.823	50	20	IDGD	
Cc1c(C(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)cnn1-c1ccc(O)nn1	748519189	WIKPFXBKYMBSCA-UHFFFAOYSA-N	442.379	1.727	50	20	IDGD	
Cc1nc([N+](=O)[O-])cn1CCC(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12	748697731	RVQBDKCEAKYOHV-UHFFFAOYSA-N	427.421	1.242	50	20	IDGD	
NS(=O)(=O)c1ccc(N2CCOCC2)c(C(=O)NNc2cc(F)c(F)cc2F)c1	748800124	MUHAFQABTKHBLJ-UHFFFAOYSA-N	430.408	1.345	50	20	IDGD	
O=C(NNC(=O)c1cc2ccccc2o1)c1cccc(S(=O)(=O)NC[C@H]2CCCO2)c1	749546065	SYKPWJAEYOIMHE-MRXNPFEDSA-N	443.481	1.965	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)NCC2CCN(CC(=O)NC(C)(C)C)CC2)c1	751111048	LHJYENKTCIZUBK-UHFFFAOYSA-N	447.580	1.639	50	20	IDGD	
CC(C)c1noc2ncc(C(=O)OCC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)cc12	752935411	PAIITDYUBITWNC-UHFFFAOYSA-N	427.373	1.872	50	20	IDGD	
CCc1cc(Br)ccc1NNC(=O)NCCC(=O)N1CCN(C(C)=O)CC1	753190203	PEYYQYQIMVZRDU-UHFFFAOYSA-N	440.342	1.718	50	20	IDGD	
N#Cc1cc(Br)cc(S(=O)(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1	754261614	WMGVADMMNBSATH-HNNXBMFYSA-N	438.259	1.470	50	20	IDGD	
C=CCN(C)S(=O)(=O)c1ccc(NC(=O)NNC(=O)COc2ccc(C#N)cc2)cc1	755934628	WIGAZTAACKRDQK-UHFFFAOYSA-N	443.485	1.596	50	20	IDGD	
CCCc1cnc(NC(=O)C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)s1	756174611	RGYMBAHQUAIQKB-UHFFFAOYSA-N	438.535	1.097	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)COc2cc(C)ccc2C)cc1-n1nnnc1C	756319702	LAOWMTBCJNHNLK-UHFFFAOYSA-N	425.449	1.828	50	20	IDGD	
CS(=O)(=O)NCc1ccc(NC(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)cc1	756624478	FYDQBVMQLNNQQW-UHFFFAOYSA-N	434.503	1.654	50	20	IDGD	
C[C@@H]1CN(c2ccc(NC(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)cc2)CCO1	756684420	JJSLRJRUYUGIQX-CQSZACIVSA-N	432.502	1.782	50	20	IDGD	
COC(=O)c1ccc(NC(=O)NNC(=O)COc2ccc(OC)cc2)cc1C(=O)OC	756818155	LETUAQFAOQHBQW-UHFFFAOYSA-N	431.401	1.500	50	20	IDGD	
CCOC(=O)Cn1cccc(NC(=O)NNC(=O)c2cc(-c3ccccc3)on2)c1=O	757764020	OPQKTWMHUKNLDG-UHFFFAOYSA-N	425.401	1.533	50	20	IDGD	
Cc1ccc(-n2nc(-c3ccco3)cc2NC(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)cc1	757892362	DRJUDKCPKKNQGN-ZDUSSCGKSA-N	446.489	1.531	50	20	IDGD	
Cn1cc(C(=O)N2CCN(S(=O)(=O)CBr)CC2)c(-c2ccccc2)n1	758523262	NEQUREMWMNPILA-UHFFFAOYSA-N	427.324	1.527	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2ccc(C(=O)NNc3ncccc3[N+](=O)[O-])cc2)C[C@H](C)O1	759298324	WXBBTECBIDZAHZ-STQMWFEESA-N	435.462	1.545	50	20	IDGD	
CS(=O)(=O)c1ccc(N2CCN(CCI)CC2)c([N+](=O)[O-])c1	759324713	YDBCNVYZBBJQMZ-UHFFFAOYSA-N	439.275	1.555	50	20	IDGD	
CC(C)Oc1cc(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)ccn1	760122454	BCXRAMUISUVCLH-UHFFFAOYSA-N	433.534	1.562	50	20	IDGD	
COc1cc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc2c1O[C@@H](C)C2	761073356	ZCTNUSAXGJYDRM-KPZWWZAWSA-N	442.424	1.163	50	20	IDGD	
CCOc1ccccc1C(=O)NCCCC(=O)NNc1nccc(N2CCOCC2)n1	762864402	BESKYXJLZZENOG-UHFFFAOYSA-N	428.493	1.365	50	20	IDGD	
Cc1cc(C)nc(SCc2ccc(C(=O)NNC(=O)Cn3cc([C@H](C)O)nn3)cc2)n1	762963213	ABVUNWJBDAFBBN-AWEZNQCLSA-N	441.517	1.492	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2)cc1S(=O)(=O)N1CCCCC1	763420686	VZJQJBKBEQSEQQ-UHFFFAOYSA-N	444.513	1.569	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)ccc1N1CCOCC1	763471718	XFZMCIPZHZSEKQ-UHFFFAOYSA-N	427.417	1.140	50	20	IDGD	
COc1cccc(N2CC[C@@H](NC(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)C2)c1	763498558	QOMRCYXMRTXKPD-OAHLLOKOSA-N	435.525	1.909	50	20	IDGD	
C[C@H](c1ccc(NC(=O)C(=O)NNC(=O)c2c[nH]c3ccccc23)cc1)N1CCOCC1	763540391	GOPKSDLSCKAMNB-OAHLLOKOSA-N	435.484	1.961	50	20	IDGD	
COCCc1cc(NC(=O)C(=O)NNC(=O)c2cc(C)n(-c3ccccc3)c2C)n(C)n1	763603063	VQHFZAKAUIUQKC-UHFFFAOYSA-N	438.488	1.416	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2cc(S(C)(=O)=O)ccc2F)c1	763643662	ILPBKJCLFHTGSD-UHFFFAOYSA-N	437.449	1.011	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(Cl)c2-n2cncn2)cc1C	763679196	IHQGGXGQCJGIRR-UHFFFAOYSA-N	442.863	1.702	50	20	IDGD	
Cc1cc(C(=O)N2CCCC2)ccc1NC(=O)C(=O)NNC(=O)COc1ccccc1F	763679721	BXVXBZZQOZQFKR-UHFFFAOYSA-N	442.447	1.535	50	20	IDGD	
O=C(COc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1ccn(CCc2ccncc2)n1	763694480	KKNDKDRUZZZTNS-UHFFFAOYSA-N	442.863	1.339	50	20	IDGD	
O=C(NNC(=O)C12CC3CC(CC(C3)C1)C2)C(=O)Nc1ccc2c(c1)S(=O)(=O)CC2	763728379	MRQVBUZHMHHCEB-UHFFFAOYSA-N	431.514	1.319	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)C(=O)Nc2ccc(C)cc2C)cc1	763732045	CTRWXKNDYFZHEU-UHFFFAOYSA-N	432.502	1.018	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2nnc(O)c3ccccc23)cc1OC(F)F	763789792	DGABGMBHQWJCJP-UHFFFAOYSA-N	431.355	1.645	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccc(OCC(F)(F)F)nc1	763850680	PVPIQNPOPRAIAU-JTQLQIEISA-N	444.341	1.715	50	20	IDGD	
CCS(=O)(=O)c1cc(F)ccc1NC(=O)C(=O)NNC(=O)Cc1c[nH]c2ccccc12	763857710	ONKUQJSKUDYFNE-UHFFFAOYSA-N	446.460	1.429	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1cc(N2CCCC2=O)ccc1F	763865189	JHIBUXGBJYIZEE-LBPRGKRZSA-N	446.410	1.645	50	20	IDGD	
CC(C)CC(=O)NNC(=O)C(=O)Nc1ccc(NC(=O)[C@H]2CCCO2)cc1C(F)(F)F	763881509	GMABFMAJKNHUHW-CQSZACIVSA-N	444.410	1.955	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cccn(C)c2=O)ccc1OCCC(C)C	763913837	BOWYSFJATYTUFT-UHFFFAOYSA-N	430.461	1.219	50	20	IDGD	
CC(C)(C)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1	763922276	UNWJSZSEULRTHQ-UHFFFAOYSA-N	435.444	1.291	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)C(=O)N1CCc2c(Cl)cccc21	763947888	DFNWWZHOTMRTEQ-UHFFFAOYSA-N	425.832	1.582	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)c1cccc(S(=O)(=O)NCC2CC2)c1	764046628	IJWIWNKWDBVHAJ-UHFFFAOYSA-N	435.527	1.634	50	20	IDGD	
CS(=O)(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2cccc(Br)c2)c1	764063363	OKRUHWVSVFZDLU-UHFFFAOYSA-N	440.275	1.252	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)c(OC[C@H]2CCCO2)c1	764163802	MLJPMUSXCBUHKQ-UZLBHIALSA-N	439.468	1.642	50	20	IDGD	
O=C(CCc1ccco1)NNC(=O)C(=O)Nc1ccc(CN2C(=O)CSC2=O)cc1	764168869	HUVQGOBTWOKJCF-UHFFFAOYSA-N	430.442	1.194	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(OCc3noc(C4CC4)n3)cc2)cc1	764177916	YIEWOLRBVDDZQC-UHFFFAOYSA-N	446.423	1.797	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)c1ccccc1OCCOc1ccccc1	764342223	DSUPRJYQVMLPKO-UHFFFAOYSA-N	434.452	1.730	50	20	IDGD	
CC(C)(C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)cc1	764349257	HEWNAIRARVLANQ-UHFFFAOYSA-N	432.864	1.974	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(C(=O)N2CCCC[C@H]2C)cc1C	764399934	NYIDUTQUISMGSX-CVEARBPZSA-N	448.520	1.147	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)[C@@H](C)NS(=O)(=O)c2cccc(C#N)c2)cc1	764565254	BDLSGJJVHFFMOI-CQSZACIVSA-N	432.527	1.473	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)CN1C(=O)COc2ccc(Cl)cc21	765313774	OWEUWLIHQFIPSN-UHFFFAOYSA-N	440.884	1.518	50	20	IDGD	
Cc1ccc2c(c1)C(=O)N([C@@H](C)C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)C2=O	765323369	NNXUZLUIHPKYII-ZDUSSCGKSA-N	432.477	1.432	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cc(F)cc([N+](=O)[O-])c3)CC2)cc1	765748410	CYJXSDOHXCYTGE-UHFFFAOYSA-N	429.452	1.621	50	20	IDGD	
C[C@@H](NC(=O)OC(C)(C)C)[C@H]1COCCC1=NNC(=O)Cn1nnc(-c2ccccc2)n1	766009143	LMIGEYTZJOMHMC-GDBMZVCRSA-N	443.508	1.762	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)c1cccc2c[nH]nc12	766662749	FCQPLJBYJFDKKU-UHFFFAOYSA-N	426.908	1.795	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)CN1CCN(CC(=O)N(C)C2CCCCC2)CC1	766872339	BJCRUMWOAWCZEG-UHFFFAOYSA-N	443.592	1.094	50	20	IDGD	
COCc1c(C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cnn1-c1ccccc1	767294030	AHFXWWXTMLZJHN-UHFFFAOYSA-N	432.440	1.340	50	20	IDGD	
COC(=O)[C@H](NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)c1ccccc1C	767562074	ZTEVAACEDQWOGV-LJQANCHMSA-N	431.514	1.928	50	20	IDGD	
COc1ccccc1NC(=S)NNC(=O)c1cc(OC)c(OCC(N)=O)c(OC)c1	768276171	JPQIHSUZTWCRFP-UHFFFAOYSA-N	434.474	1.208	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@H]2C[C@@H](OC(C)C)C2(C)C)cc1	768431184	PQXBTGNBBLVLKD-DLBZAZTESA-N	440.566	1.538	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](OCC(=O)NNC(=O)COc2ccc(C#N)cc2)C1	769043492	ZRFOOURZSOZDQC-KRWDZBQOSA-N	432.477	1.501	50	20	IDGD	
O=C(CCc1cccc2c1OCO2)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	769725530	CLQWXNQLXAQDAG-UHFFFAOYSA-N	445.497	1.594	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1ccc(O)c(C(=O)NNC(=O)c2ccoc2)c1	769740628	FJXGRVANYOGMTP-UHFFFAOYSA-N	431.426	1.869	50	20	IDGD	
Cc1cccc(NC(=S)NNC(=O)[C@@H](C)NS(=O)(=O)c2ccc(C(N)=O)cc2)c1C	770955879	RWYXDLQMUFGBOF-CYBMUJFWSA-N	449.558	1.087	50	20	IDGD	
C[C@H](CC(=O)NNc1ccnc(Br)c1)/N=C1/NS(=O)(=O)c2ccccc21	771530428	CFALOKQUBRGHOU-SNVBAGLBSA-N	438.307	1.805	50	20	IDGD	
C[C@@H]1C[C@H](NC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)CCN1C(=O)OC(C)(C)C	772466242	XZLIMVLEUKSCKS-CPUCHLNUSA-N	434.493	1.945	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@H]2CCO[C@@H](C(C)C)C2)cc1	772616080	CAVQKGJEBAUGDQ-DOTOQJQBSA-N	426.539	1.150	50	20	IDGD	
C[C@H](C(=O)NNC(=O)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1)n1nnc(-c2ccccc2)n1	773412241	USAHRBMNLOFAQB-GDBMZVCRSA-N	443.508	1.696	50	20	IDGD	
Cc1nc(NC(=O)C(=O)NNC(=O)c2c(C)nc3ccccn23)ccc1Br	773519823	KLSHWSSZEOVANX-UHFFFAOYSA-N	431.250	1.508	50	20	IDGD	
O=C(NNc1c(F)cccc1F)C(=O)Nc1ccc(F)c(S(=O)(=O)NC2CC2)c1	773706109	VFPWVFLWWNPRPJ-UHFFFAOYSA-N	428.392	1.626	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2ccccc2CS(=O)(=O)c2ccccc2)n1	773723849	GATPABQKQKFRLA-UHFFFAOYSA-N	441.469	1.541	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2cccc(CN(C)Cc3cscn3)c2)n1	773724735	WDYXCINYCSDXFS-UHFFFAOYSA-N	427.490	1.656	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)n(-c2ncccn2)n1	774010727	YWPAVOLAGAYBJJ-GFCCVEGCSA-N	443.851	1.178	50	20	IDGD	
O=C(NNC(=O)[C@@]1(F)CCN(C(=O)OCc2ccccc2)C1)[C@@H]1COc2ccccc2O1	776739513	SEJZKZRCNPNFCJ-PGRDOPGGSA-N	443.431	1.725	50	20	IDGD	
COC(=O)c1ccccc1NNC(=O)CCNS(=O)(=O)c1ccc(OC)c(OC)c1	777772612	FUEUAGSCQXBHLN-UHFFFAOYSA-N	437.474	1.302	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNS(=O)(=O)c1cc(Br)c(F)cc1F	777940008	TZTBQXZJCDTOAN-UHFFFAOYSA-N	444.254	1.562	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)c1cc(=O)c2cc(Br)ccc2[nH]1	778433329	LFQNQBHCCUVRSQ-UHFFFAOYSA-N	439.266	1.576	50	20	IDGD	
COCCNS(=O)(=O)c1c[nH]c(C(=O)NNc2nc3ccc(OC)cc3cc2C)c1	778476418	HAWFBFSINXJRRO-UHFFFAOYSA-N	433.490	1.562	50	20	IDGD	
COc1cccc(-c2noc([C@H](C)NC(=O)NNC(=O)CNC(=O)OC(C)(C)C)n2)c1	778683190	PBCSJVCMCMHEFI-NSHDSACASA-N	434.453	1.661	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)N[C@H]1CCN(CCCc2ccccc2)C1=O	778686929	MRBRYMPFSCEZSW-INIZCTEOSA-N	433.509	1.075	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)n(C)c1	778933835	MAJOOJTWGOZUIB-UHFFFAOYSA-N	441.460	1.203	50	20	IDGD	
O=S(=O)(CCCCCl)NC[C@H](O)COc1ccc(I)cc1	780795534	YSBYCCKFOWVONG-LBPRGKRZSA-N	447.722	1.969	50	20	IDGD	
COc1ccc(C(=O)c2ccccc2C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)cc1	781306242	QOOHOCDCFHMVJQ-CQSZACIVSA-N	431.470	1.057	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3ccc(O)cc3)cc2F)C[C@H](C)O1	782833050	BQGBDHUVYHIUJI-STQMWFEESA-N	430.436	1.545	50	20	IDGD	
Cc1ccc(COc2cccc(NC(=O)C(=O)NN[C@]3(C)CCS(=O)(=O)C3)c2)cc1	783426504	MFALSQSCUTUDBI-OAQYLSRUSA-N	431.514	1.711	50	20	IDGD	
CN1CCC/C1=N\S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccc(F)cc2)cc1	784784015	IPDSMHBBTNXFFA-JJIBRWJFSA-N	433.465	1.720	50	20	IDGD	
CN(C)CC(=O)Nc1ccc(NC(=O)C(=O)NNc2ccc(Br)nc2)cc1	784806060	BMGZLITWWBUUIX-UHFFFAOYSA-N	435.282	1.426	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1ccc(Cl)cc1-n1cccn1	788330365	GEBDFUGUXCELKZ-UHFFFAOYSA-N	437.847	1.882	50	20	IDGD	
CN(C)[C@H]1CCOc2c(NC(=O)C(=O)NNC(=O)CCOc3ccccc3)cccc21	789735112	KGCJLQYWKQCVTO-SFHVURJKSA-N	426.473	1.627	50	20	IDGD	
CN1CCC(Oc2ccc(CNC(=O)NNC(=O)Cc3cn4ccccc4n3)cc2)CC1	790922108	SFOMSRKOFMUIPL-UHFFFAOYSA-N	436.516	1.880	50	20	IDGD	
CC(C)Oc1ccc(NC(=O)C(=O)NNC(=O)c2cc(F)ccc2Br)nn1	793024948	IJJGBRDNXPJHDK-UHFFFAOYSA-N	440.229	1.565	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2cccc(C)n2)c(F)cc1Br	794599533	IVFRKWFCQSSGIN-UHFFFAOYSA-N	446.254	1.702	50	20	IDGD	
CC(=NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1)c1ccccc1-n1ccnn1	794871162	FNCCAVIEZCPVBC-UHFFFAOYSA-N	426.502	1.737	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)C(=O)Nc2ccc(OC(C)C)c(C(N)=O)c2)cc1	797000410	ROGRGRBNQYMPCR-UHFFFAOYSA-N	444.513	1.759	50	20	IDGD	
O=C(Cc1cccnc1)NNS(=O)(=O)c1c(Cl)nc2ccc(Br)cn12	799920123	BTUQPJQEGLJQEM-UHFFFAOYSA-N	444.698	1.697	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)C1(c2ccc(I)cc2)CC1	800318863	RJGREMPZJGRTRV-SNVBAGLBSA-N	430.242	1.812	50	20	IDGD	
Cc1c(C(=O)NNC(=O)CNC(=O)OC(C)(C)C)nnn1CCOc1ccc(F)cc1	800530132	LCUBMZLYSLMGRC-UHFFFAOYSA-N	436.444	1.090	50	20	IDGD	
Cc1ccc(C2=NO[C@@H](CNC(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)C2)cc1	800754206	QEYRVXFOJZKTSK-MRXNPFEDSA-N	430.486	1.536	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)N[C@H](Cn1ccccc1=O)c1ccccc1	800762358	HHCSXVAGPFFVQS-QGZVFWFLSA-N	437.412	1.848	50	20	IDGD	
C[C@@](O)(Cn1cc(C(F)(F)F)ccc1=O)C(=O)NNC(=O)Nc1cc(F)cc(F)c1	802005859	ZIEZGLBXZTZMNJ-MRXNPFEDSA-N	434.321	1.749	50	20	IDGD	
O=C(COC(=O)[C@H]1CCCN(C(=O)c2ccncc2)C1)NNC(=O)c1cccc(Cl)c1	803488663	AXTGMQVUQXPNBY-INIZCTEOSA-N	444.875	1.592	50	20	IDGD	
Nc1nc(C2CC2)ncc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	806305872	AMOSFMWASNZRNI-UHFFFAOYSA-N	444.517	1.186	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(NC(=O)NNC(=O)COc2ccccc2F)ccc1F	806543118	JZLCVGLBSPJFGJ-UHFFFAOYSA-N	428.417	1.447	50	20	IDGD	
C[C@]1(C2CC2)NC(=O)N(c2cccc(CNC(=O)NNC(=O)CC(F)(F)F)c2)C1=O	807236326	ILMWCNCWHSDBKQ-QGZVFWFLSA-N	427.383	1.694	50	20	IDGD	
Cc1cc([N+](=O)[O-])ccc1NNC(=O)C(=O)Nc1ccc(CN2C(=O)CCC2=O)cc1	807456572	DEEUJBKRIBOENB-UHFFFAOYSA-N	425.401	1.634	50	20	IDGD	
N#Cc1ncn(CCNC(=O)NNC(=O)c2cn(-c3ccccc3)nc2-c2ccccc2)n1	807510751	PCKOABGVJQDBLX-UHFFFAOYSA-N	441.455	1.647	50	20	IDGD	
Cn1c(=O)c2c(ncn2CC(=O)NN=C2[C@H]3CCC[C@@H]2Cc2ccccc2C3)n(C)c1=O	807976100	LZRZOZCWTVWRIA-CALCHBBNSA-N	434.500	1.121	50	20	IDGD	
Cc1ccc(S(=O)(=O)NNC(=O)CNC(=O)c2cccs2)cc1C(=O)OC(C)C	808086769	HJLYNNZRKWVZAE-UHFFFAOYSA-N	439.515	1.361	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@@H]2COc3ccccc32)c1	812442476	DFJVJXWYLZHUHI-MRXNPFEDSA-N	446.529	1.837	50	20	IDGD	
O=C(NCCc1cn[nH]c1)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	812522371	IWAUDVISKITXJI-UHFFFAOYSA-N	431.460	1.298	50	20	IDGD	
Cc1cnc(Br)c(NC(=O)C(=O)NNC(=O)Cc2c[nH]c3ccccc23)c1	812978951	GDXOHTLDYSMMEC-UHFFFAOYSA-N	430.262	1.962	50	20	IDGD	
Cc1cnn(C)c1S(=O)(=O)NC(=O)/C(C#N)=C/c1cc(C)n(C[C@H]2CCCO2)c1C	813992119	UFQZPUKCXQADCD-JIARHERNSA-N	431.518	1.738	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCO1)C(=O)Nc1ccc(Oc2ncc(Cl)cn2)c(Cl)c1	815778788	GCAQVBPQIQBXGP-CYBMUJFWSA-N	440.243	1.841	50	20	IDGD	
Cn1c(NNC(=O)C2CCN(S(=O)(=O)c3ccc(C#N)cc3)CC2)nc2ccccc21	816580073	QYSYQZSIKAYXGI-UHFFFAOYSA-N	438.513	1.989	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)C2CCN(S(=O)(=O)c3ccc(F)c(F)c3)CC2)n1	837301407	YBEBJOCFTZZYPN-UHFFFAOYSA-N	425.461	1.916	50	20	IDGD	
CN(c1ccc(F)cc1)S(=O)(=O)c1ccc(Cl)c(C(=O)N2CC[C@@H](B(O)O)C2)c1	864233461	JYYUYOFETJJMKX-GFCCVEGCSA-N	440.689	1.993	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)CSc1nnnn1C1CCCC1	906485942	CFMVFYDJBQVQRK-UHFFFAOYSA-N	428.522	1.640	50	20	IDGD	
O=C(COC(=O)[C@@H]1CCCN1C(=O)c1ccccc1)NNC(=O)c1ccc([N+](=O)[O-])cc1	912682371	VBHMVCYVMWRYMK-KRWDZBQOSA-N	440.412	1.204	50	20	IDGD	
NS(=O)(=O)c1ccc(Br)c(C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c1	912770474	KRFKEYHYMOEPGB-UHFFFAOYSA-N	443.235	1.080	50	20	IDGD	
CCn1c(=O)nc(O)c2c(C(=O)NNC(=O)c3cn(C)c4ccccc34)cc(C3CC3)nc21	914446347	XJQAVONNJOEKFE-UHFFFAOYSA-N	446.467	1.961	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)[C@@H]2CC(=O)N(C3CCCCC3)C2)cc1OC	914934491	YFRRIQGQGVEOPT-OAHLLOKOSA-N	447.488	1.189	50	20	IDGD	
O=C(NCc1csc(Br)c1)NNC(=O)c1csc(N2CCOCC2)n1	915259842	DRLUIVPNTKEUJF-UHFFFAOYSA-N	446.352	1.948	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)N1CCc2ccccc21	916622798	LXIDYDZUPUIVCF-HNNXBMFYSA-N	445.545	1.332	50	20	IDGD	
CC[C@H](C)NS(=O)(=O)c1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C)cc2)cc1	916830789	XKIGXRZBBTZITR-AWEZNQCLSA-N	432.502	1.472	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)CCc2ccccc2)c1	917718371	XAEUGHBFXPRMEF-UHFFFAOYSA-N	439.559	1.524	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(/C#N)C(=O)OCC(=O)N2CCC[C@@H](NC(C)=O)C2)c1C	918818771	YVJCMGKINFELPJ-XZSDIMDZSA-N	444.532	1.890	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(C(=O)NNC(=O)CCc2ccc(OC)cc2)cc1	919835593	JTBFAXSBSCJZFF-UHFFFAOYSA-N	435.502	1.014	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)c1nc2ncc(Br)cn2n1	919838891	RENOLEPEYDKJEH-UHFFFAOYSA-N	443.265	1.260	50	20	IDGD	
NC(=O)c1ccc(/C=C\C(=O)N2CCC[C@H]2C(=O)NNC(=O)c2ccc(Cl)cc2)cc1	920020397	UZQNFVLXXNNQRU-KYDJUPTOSA-N	440.887	1.904	50	20	IDGD	
COCCOc1ccc(NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cn1	920213188	TYBBITUNPHMBCC-UHFFFAOYSA-N	442.520	1.472	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)NCCN2CCN(S(C)(=O)=O)CC2)c(C)n1CCC(C)C	921164965	BRDXYLVUIIXXQU-QNGOZBTKSA-N	449.621	1.751	50	20	IDGD	
C[S@@](=O)Cc1ccc(CNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1	1117359331	IPXKJYVHNVBVQJ-SSEXGKCCSA-N	430.534	1.102	50	20	IDGD	
COCCNS(=O)(=O)c1cccc(C(=O)NNc2cncc(Br)c2)c1	1253718438	KDCJGHQBVTXFLZ-UHFFFAOYSA-N	429.296	1.526	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@@H]1CCCCN1Cc1ccncc1	1318358763	DVMMKQISRZAWPR-KRWDZBQOSA-N	444.561	1.499	50	20	IDGD	
COC[C@]1(CNC(=O)NNC(=O)c2cncn2-c2ccccc2)OCCc2ccccc21	1324690717	OUZHRSQTXRTNQH-QHCPKHFHSA-N	435.484	1.931	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)c2ccc(F)c(S(C)(=O)=O)c2)CC1	1327379303	PNKKOZQLGWDGJL-UHFFFAOYSA-N	443.497	1.637	50	20	IDGD	
O=C(c1ccc2cnccc2n1)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1777737228	UZCOSDUAOGJZGE-MAUKXSAKSA-N	437.269	1.764	50	20	IDGD	
O=C(c1ccc2nccn2c1)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1778014405	DSOGBADOVHPPSD-YOEHRIQHSA-N	425.258	1.468	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(-n3ccnc3)ccn1)C2)[C@H](F)Cl	1778025032	JPMMXTBPEJCPQN-FUHIMQAGSA-N	435.887	1.929	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)o1	1779027947	TWFXWDAJTYDUMX-XJKSGUPXSA-N	432.246	1.372	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H]3[C@H]4c5ccccc5S[C@H]43)C2)C1	1779049039	MPZHKZBUNIWQFN-OTXHSEFHSA-N	436.961	1.958	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(CCN(C(=O)CS[C@@H]3CCCCO3)C2)C1	1779078211	NTYXEVJYTHTANE-IAGOWNOFSA-N	435.384	1.861	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@]2(CN(C(=O)COc3ccccc3C#N)CCO2)C1	1779299981	LLKWWDKJWSWDCO-NRFANRHFSA-N	431.565	1.618	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CO[Si](C)(C)C)C1)N1C[C@@H]2C[C@H]2C1	1779545538	VUFJJVNYQLNTHV-GPUAKUCWSA-N	437.657	1.692	50	20	IDGD	
C[C@@H](Cn1ccnc1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCBr)C2	1782542824	AFAVFZUPTSMMGR-FRQCXROJSA-N	441.370	1.818	50	20	IDGD	
CN1CC(C(=O)N2CCO[C@]3(CCN(C(=O)/C(C#N)=C/c4ccc(F)cc4F)C3)C2)C1	1782867461	ITCPNPAZNGCHQX-AGBQBWRISA-N	430.455	1.263	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(CCN(C(=O)C3CCC4(CC3)OCCO4)C2)C1	1782938152	GUMPMJDISQYYQP-SFHVURJKSA-N	445.354	1.535	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc4c(c3)CCN4C)CCO2)C1	1783534799	ZITYZQZQIIJQKA-VLIAUNLRSA-N	436.350	1.906	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)/C=C/c3ccc([N+](=O)[O-])o3)CCO2)C1	1783870680	FLRMBEIEBKPBOU-OMJDURBCSA-N	427.841	1.285	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cc(OC)cc(OC)c3)CCO2)C1	1783882115	OCTRMACACZYCTH-FXAWDEMLSA-N	426.897	1.401	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]3C2)cn1C	1783965927	XDYVJFZZJDIRII-QCPWZWHMSA-N	426.355	1.958	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cn(C)nc3C)[C@H]2C1	1784727694	ALIUAKFSCJMDRO-TUUVXOQKSA-N	427.343	1.495	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC1(c2ccc(NC(=O)C[C@H]3NC(=O)NC3=O)cc2)CCC1	1786761597	AQTKVAGZOSPUNO-OAHLLOKOSA-N	432.553	1.570	50	20	IDGD	
Cc1cnc(C(=O)Nc2ccc(C3(NC(=O)c4cccc(B(O)O)c4)CCC3)cc2)cn1	1787336500	DTUKCAUXVHINAV-UHFFFAOYSA-N	430.273	1.526	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cn(C)nc3C(F)F)[C@H]2C1	1787736112	PUEQBZMYFZLJJW-ZPFDUUQYSA-N	449.296	1.734	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21)c1ccc2c(c1)OCCO2	1787813465	BYUBRGHFEKJKDI-XEZPLFJOSA-N	429.300	1.855	50	20	IDGD	
CCCC(=O)N[C@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CO[Si](C)(C)C)C[C@@H]21	1788743266	MWBNNMJJTRMZLL-QZWWFDLISA-N	427.618	1.122	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](OC(C)=O)C(C)C)C[C@@H]21	1790960465	IINMRZDNLGPNEM-ZOFXXKQRSA-N	447.370	1.727	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ncc(Cl)cn3)C[C@@H]21	1791057912	ZNZZDQOQWBANLP-UKJIMTQDSA-N	431.718	1.507	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3CCc4ccccc43)[C@H]2C1	1791392626	NYELMFXTPMBZLL-VMXMFDLUSA-N	442.560	1.069	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(CO)c(F)c3)[C@H]2C1	1792092574	KEEBLRHASXHGDI-ZUFFMMDNSA-N	443.313	1.695	50	20	IDGD	
COC(=O)[C@H]1CC=CC[C@@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(C)(C)CCl	1792785520	BHTBDNPMDWWHQM-QEOTZNIISA-N	426.941	1.596	50	20	IDGD	
CC[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)CBr)N(CC)CC	1792868902	VMLUNVRTRKUPNZ-SIRPWMCASA-N	432.403	1.727	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccncc1-c1ccccc1)C2)[C@H](O)CCl	1792981109	QEWYHFCWJCTLFU-WOUAJJJCSA-N	429.904	1.552	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCl)[C@@H]1Cc2[nH]nc(C(F)(F)F)c2C1	1793113017	YOFZLTMRKJKYRE-GRZGAGJTSA-N	434.846	1.381	50	20	IDGD	
COc1ccc(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](O)CCl)c([N+](=O)[O-])c1	1793115672	SCCSCSQWMIZQIV-LOUJCGABSA-N	425.869	1.384	50	20	IDGD	
COc1ccc([C@H]2C[C@@H]2C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)cc1	1793521732	ZYKICHAMQMWIRD-PMNYKWLYSA-N	448.328	1.431	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1ccc2c(c1)CCC2)c1cccc(B(O)O)c1	1794100640	UTHOQWZQFVLVKH-NUNAXRQHSA-N	432.329	1.350	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCc1c(C)noc1C	1794139470	CIOGJWUUZZQZKW-KPEUIFRASA-N	442.354	1.987	50	20	IDGD	
O=C(NCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](F)Br)C2)c1cccs1	1794394387	UKQFXRQHSZESEG-MIJXAVMKSA-N	432.315	1.807	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(F)c(C)n1	1794663450	WDKOGGQKJYJMSD-LCFLCXBCSA-N	440.479	1.915	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2sc(N)nc2c1	1795657189	XKNMVBPPHKCHTQ-ZSBFGKGUSA-N	448.621	1.933	50	20	IDGD	
COc1cc(F)c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)c(F)c1	1796189348	BBAITGOJGGIKNJ-MUJYYYPQSA-N	444.243	1.219	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(CO)o1)C2	1796892100	ZROBDVFIGHPLDS-NGYDUSEUSA-N	427.461	1.158	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1oc(C)nc1C	1798819962	XMLMRXLPNRZACT-XMOXNHLCSA-N	426.477	1.677	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cn3c(F)cccc3n1)C2	1799279375	LKPMFOHXTLEUFW-FIXGWNCBSA-N	443.306	1.913	50	20	IDGD	
CN(C)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Br	1799347961	VRUMMCDEVQOITO-JLUCKKNBSA-N	429.290	1.041	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@]1(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](F)Cl)C3)CCOC1	1800139865	DKNNLAVJNRJSJP-UUUMGPIQSA-N	433.908	1.843	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Cl)C3)C1	1802060070	ICHKJRAMARTYBO-OCVGTWLNSA-N	433.908	1.367	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCCC2(CCN(C(=O)CS(=O)(=O)N3CCCC3)CC2)C1	1805260112	VDDUGJPGSSEWBM-UHFFFAOYSA-N	448.029	1.908	50	20	IDGD	
O=C(Cn1ccccc1=O)NC[C@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1	1807438366	WOSYXATZFCXPON-UZLBHIALSA-N	447.333	1.734	50	20	IDGD	
O=C(CC(F)(F)C(=O)O)NC[C@@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1	1808286967	FTUVIROLNMHOIO-SWLSCSKDSA-N	448.264	1.982	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CN2CCOCC2)[C@@H]1c1cccnc1)[C@H](F)Br	1808661215	HAYNBYLXKCUMTG-UAGQMJEPSA-N	443.317	1.110	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)Cc2ccn(C)n2)[C@@H]1c1cccnc1	1812864558	PZNMGRGCPJTNQF-DHSIGJKJSA-N	434.338	1.847	50	20	IDGD	
Cc1cccc(C(=O)N2CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)n1	1813070296	GXDKGGMRDOCUIO-AVRDEDQJSA-N	438.532	1.478	50	20	IDGD	
Cc1ccncc1C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1813071705	VLGALLKXDNQNOE-XMSQKQJNSA-N	438.532	1.478	50	20	IDGD	
C[C@H]1CC[C@H](C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)CC1	1813546005	JYISFVPPAUJAHM-SVVKQXANSA-N	449.360	1.907	50	20	IDGD	
C[C@H](CBr)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)C2=NNC(=O)C2)[nH]n1	1814782498	VOHTZOHPCUPNBU-SKDRFNHKSA-N	425.287	1.309	50	20	IDGD	
CC[C@@H](NC)C(=O)N[C@@H]1CCc2nc(NC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)sc2C1	1817280238	QUDBCFHQLADLJH-MLZXSMIQSA-N	445.549	1.187	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)CC[C@H]2CCOC2)[nH]n1)c1ccc(B(O)O)cc1	1817475501	PPFARMUZOKPHLO-KXBFYZLASA-N	440.309	1.212	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@H](O)CCl)CC2)c1cn2cc(F)ccc2n1	1819102950	VBDCRNWTPQJLJA-ZWNOBZJWSA-N	437.884	1.755	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)C2CCCC2)[nH]n1	1819402049	KOOISJUSUPADEB-KRWDZBQOSA-N	425.493	1.904	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)/C=C/c2cnc[nH]2)[nH]n1	1819404158	BMZUIQVJCLVWLK-LAQIPUCWSA-N	449.475	1.151	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)C(Cl)Cl)[nH]n1	1819404640	RRQBTIHBAIKXHZ-GFCCVEGCSA-N	440.291	1.518	50	20	IDGD	
COc1cc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)ccn1	1819782291	CQKPOUDCXLLBGG-SFHVURJKSA-N	449.276	1.113	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc3n(n2)CCCO3)[nH]n1	1822369806	IUJIULVSWLWHQL-DOMZBBRYSA-N	436.900	1.948	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc3n(n2)CCC3)[nH]n1	1822415547	AVRYJGZKGZIJME-QGZVFWFLSA-N	442.524	1.231	50	20	IDGD	
C[C@@H](C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1)n1cccc1	1822416979	UONYMPSELNIJEF-RDJZCZTQSA-N	429.525	1.838	50	20	IDGD	
CCC(C)(C)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnccc1C(=O)NN)CC2	1825153572	NPMCMICCBZQMTK-LLVKDONJSA-N	430.534	1.804	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1nc(C)c(C)[nH]c1=O)CC2	1825992991	BUNYFXXEMZELJW-GHMZBOCLSA-N	439.925	1.323	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cccnc1C(N)=O)CC2	1825993032	DKMLAACGOIBSKW-KOLCDFICSA-N	437.909	1.117	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1[nH]nc3ccncc13)CC2	1825998614	KLPWQLGQMVDHOS-GXSJLCMTSA-N	434.909	1.894	50	20	IDGD	
Cc1cc(C(=O)N[C@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)c(C)n1C	1826087963	MFICPEJOYLXELK-AWEZNQCLSA-N	446.577	1.697	50	20	IDGD	
CC1(C)CC(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2cnccc2C(=O)NN)CC3)C1	1826202556	PNGJUZKZZVRJGW-GFCCVEGCSA-N	442.545	1.804	50	20	IDGD	
Cc1cnc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)cn1	1827051361	VDUVXPZBFXUYCO-OAQYLSRUSA-N	436.321	1.012	50	20	IDGD	
O=C(C1CCC(O)CC1)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827054706	KAMLDCQZNKPJGQ-FQUBMZHMSA-N	442.365	1.151	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)Cc2cccnc2)CC1	1827202552	ZQPILGQYBQMNFJ-QFIPXVFZSA-N	435.333	1.237	50	20	IDGD	
Cc1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)c1F	1830103851	MHMOJFWVEHOFDR-IFXJQAMLSA-N	443.313	1.988	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)COC(C)(C)C)C2)C1	1830535637	ROQGDIXVNUBHKS-KBXCAEBGSA-N	435.359	1.289	50	20	IDGD	
Cc1cc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)on1	1830535648	RPQITNWKGJDDDY-SCLBCKFNSA-N	444.326	1.013	50	20	IDGD	
O=C(Cc1c(F)cccc1Cl)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1830720003	QQOUPWCRBRSVHV-VQIMIIECSA-N	449.306	1.078	50	20	IDGD	
Cc1csc(CCC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)c1	1830726832	UEVDOCQKHKVBCQ-LPHOPBHVSA-N	430.954	1.045	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)C3=CCCS3)CCO2)C1	1831544015	GGPSHRNZMQTWDE-GUYCJALGSA-N	433.368	1.495	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc4ncccn34)C2)C1	1831647814	YRPIDEZLVILKSD-QRWLVFNGSA-N	435.912	1.207	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3c(C)nn(C)c3C)CCO2)C1	1831803295	BAWISBWLCCSMHQ-UZLBHIALSA-N	426.945	1.514	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)C2CCC(O)CC2)CC1	1832001389	ZEVAMAFTQOYLEB-FQUBMZHMSA-N	442.365	1.151	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cccc4cc[nH]c34)CC2)CC1)[C@H](O)CCl	1833310112	IVEQZOWZDYYWHT-LJQANCHMSA-N	432.952	1.953	50	20	IDGD	
CCc1noc(C)c1C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)CCl)CC2)CC1	1833312508	PRACTRCNASKVDW-QGZVFWFLSA-N	426.945	1.330	50	20	IDGD	
C#CCO[C@H](C)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1833466514	GXZCUVYMERDGLX-CZUORRHYSA-N	432.334	1.287	50	20	IDGD	
CC[C@@H](C)[C@@H](N)C(=O)NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1	1834684786	SEMLZSPUAANUPT-RDTXWAMCSA-N	431.419	1.716	50	20	IDGD	
CCn1nc(C)cc1C(=O)NC1CCN(C2CCN(C(=O)[C@@H](Cl)COC)CC2)CC1	1834985157	FMANFHOVLUKHQS-SFHVURJKSA-N	439.988	1.650	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1)[C@H]1CC1(F)F	1835450665	PJIYSEKIETTXKU-CHWSQXEVSA-N	426.277	1.904	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccc(F)cn3)CCO2)C1	1836035778	HOSJXKAPAKLUSL-FZKQIMNGSA-N	444.301	1.003	50	20	IDGD	
Cn1cnc(C(=O)N2CCC(OC3CCN(C(=O)[C@](C)(Cl)CCl)CC3)CC2)n1	1837383150	NHVUQSUNWADRNQ-GOSISDBHSA-N	432.352	1.664	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(F)nc3)CCO2)C1	1837851459	KMTLEOOUCMJWGS-KBXCAEBGSA-N	444.301	1.464	50	20	IDGD	
COc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)ccn1	1837979307	JJBSTRUYWVQZKL-OALUTQOASA-N	446.331	1.397	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccccc3OC)CCO2)C1	1838877767	XYVURPPEGIEHLO-JXFKEZNVSA-N	426.897	1.019	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3ccccn3)C2)C1	1839150803	XUZDGDPDCRJAAK-WOJBJXKFSA-N	444.359	1.707	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(O)ccc3O)C2)C1	1839154245	IEXGALUDQOJDJQ-RTBURBONSA-N	447.315	1.404	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)cc1O	1839202275	YYOXLRPEAKQEBS-MAUKXSAKSA-N	445.285	1.461	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)ccc1F	1839321232	PSOLUCBFUYWMQG-YJBOKZPZSA-N	447.276	1.895	50	20	IDGD	
COc1c(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)ccc(F)c1F	1839381704	IIDSSWQVHBFVIF-MAUKXSAKSA-N	436.814	1.578	50	20	IDGD	
O=C(c1cn2c(F)cccc2n1)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1839556186	JIYKSKNVGPCOKR-GOSISDBHSA-N	445.278	1.347	50	20	IDGD	
CO[C@H](C)C(=O)N1CCOC[C@@]2(CN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)CCO2)C1	1839744228	VWCUWBJUEBVLQI-SEVXFQSKSA-N	449.454	1.363	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)C3=COCCC3)C2)C1	1839966496	HFHPOLKINCUPCP-YJBOKZPZSA-N	431.327	1.311	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)C(=O)c3cccn3C)CCO2)C1	1840481139	FGUFHCUPRWHNJT-YWZLYKJASA-N	425.913	1.072	50	20	IDGD	
C[C@@H](CNC(=O)OCc1ccccc1)C(=O)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1	1841352824	OSDYTBQKMPJKPN-DOTOQJQBSA-N	437.924	1.352	50	20	IDGD	
CC(C)n1nc(C(=O)N2CCCC23CN(C(=O)[C@H](C)Br)C3)cc1C(=O)O	1842261168	DORXQJPWSBUEBW-NSHDSACASA-N	427.299	1.763	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)c1cc(C)nn1-c1cccc(=O)n1C)C2	1845164565	NODKMKUWFRFFGX-OAHLLOKOSA-N	431.924	1.714	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H](F)C[C@H]1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl	1847558385	CNESKWNUTDGBCZ-QTVXIADOSA-N	433.908	1.135	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](C)n1ccnc1	1847677039	XKCLFLFKABYHNA-KKXDTOCCSA-N	441.444	1.793	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cnc(O)[nH]1	1848099582	WLERGRHWAPLTCZ-DRZSPHRISA-N	427.889	1.063	50	20	IDGD	
C=CCNC(=S)NNC(=O)[C@@H](NS(=O)(=O)c1ccc(Br)cc1)C(C)C	725908752	RKKXKDIEEFDJTI-ZDUSSCGKSA-N	449.396	1.433	50	20	IDGD	
COCCCNC(=S)N(C)NC(=O)CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21	726078278	HPUUWWHSKMUIJP-UHFFFAOYSA-N	425.467	1.157	50	20	IDGD	
O=C(CCCc1ccccc1)NNC(=O)CNS(=O)(=O)c1ccc2c(c1)OCCCO2	727860907	SGMSEZCOCQCLFC-UHFFFAOYSA-N	447.513	1.297	50	20	IDGD	
COC(=O)c1ccc(S(=O)(=O)NNC(=O)c2cccc(OC(F)F)c2)c([N+](=O)[O-])c1	728510582	PFBCKVRCHZCGEQ-UHFFFAOYSA-N	445.356	1.606	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)[C@H]2CC[C@H](C(F)(F)F)NC2=O)c1	728527772	RZRZVPKRPMTKPA-GZMMTYOYSA-N	438.200	1.676	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2cc(C)n(-c3ccccn3)c2C)n1	728723736	UFRJHSNJOWKELR-UHFFFAOYSA-N	427.486	1.801	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)c2ccc3c(c2)C(=O)N(Cc2ccncc2)C3=O)c1	728827390	NSPXGSGXASZVPY-UHFFFAOYSA-N	425.404	1.824	50	20	IDGD	
C[C@H]1CC(C)(C)C[C@]2(C1)NC(=O)N(CC(=O)NNC(=O)CCc1ccccc1O)C2=O	730033961	HHEWWKUJHDIZEM-FPTDNZKUSA-N	430.505	1.609	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)[C@H]1CCN(c2ccc3c(c2)OCCO3)C1=O	730515420	SPMMTPQVHBMZEV-MRXNPFEDSA-N	429.404	1.176	50	20	IDGD	
O=C(COC(=O)c1c(Cl)cccc1[N+](=O)[O-])NNC(=O)[C@H]1COc2ccccc2O1	730646317	BMZMELHFHMZYIL-CQSZACIVSA-N	435.776	1.392	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)Nc1ccc(C(=O)NCC(F)(F)F)cc1	730897271	ISUQFCLOFRBIOZ-UHFFFAOYSA-N	426.351	1.916	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NC[C@H]1CCOc2ccccc21	731218811	IMIPQPCCTMTTHO-CQSZACIVSA-N	431.518	1.798	50	20	IDGD	
CC(=O)Nc1ccc(NS(C)(=O)=O)c(C(=O)NNC(=O)c2ccc(Cl)nc2)c1	731435521	TXHPJJRAEGYGCI-UHFFFAOYSA-N	425.854	1.140	50	20	IDGD	
COc1ccc(Br)c(C(=O)NCCCNC(=O)NNC(=O)c2ccc[nH]2)c1	731760729	XQHLKHXAFOCTRM-UHFFFAOYSA-N	438.282	1.550	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C1CCN(S(=O)(=O)c2cccnc2)CC1)c1ccccc1	731998948	IPBQNWQXMOPQEV-IBGZPJMESA-N	430.530	1.824	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)NCCN2CCN(C(=O)C3CCCCC3)CC2)c1	733346529	SQZZVUFDHKQQII-UHFFFAOYSA-N	426.521	1.227	50	20	IDGD	
CCN1CCC[C@H]1CNC(=S)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	734766061	AFISZMAAFUFVGR-HNNXBMFYSA-N	428.603	1.549	50	20	IDGD	
CC(C)[C@@H](C(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1)N1CCCC1=O	734825007	QFTCUPHJHVPKST-INIZCTEOSA-N	425.530	1.363	50	20	IDGD	
CN(C)C(=O)CS(=O)(=O)c1ccc(C(=O)NNC(=O)CCCc2ccccc2)cc1	741922881	LAJSCDNYSLFBBD-UHFFFAOYSA-N	431.514	1.332	50	20	IDGD	
CC(C)NC(=O)C(=O)NNC(=O)c1ccccc1Sc1ccc(S(C)(=O)=O)cc1	742490219	ZUUYYDYOGLMKPR-UHFFFAOYSA-N	435.527	1.527	50	20	IDGD	
COc1cc(C(=O)NN=c2sc3ccccc3n2C)cc(NS(C)(=O)=O)c1OC	742516625	FIPSMKZXFRBBBL-UHFFFAOYSA-N	436.515	1.874	50	20	IDGD	
O=C(Cn1cc(Br)ccc1=O)NNC(=O)c1cccc(Br)c1	742769521	PAVINRAAJVYAIX-UHFFFAOYSA-N	429.068	1.835	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)cc1Br	743268822	MLLWWOBXKQOBLQ-UHFFFAOYSA-N	446.235	1.695	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NCC(=O)N2CCc3ccccc3C2)cc1	743581119	MXXTXYWIAHBAGA-UHFFFAOYSA-N	445.501	1.011	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNC(=O)[C@H](C)N2C(=O)[C@@H]3[C@H]4CC[C@@H](O4)[C@@H]3C2=O)cc1	744352684	NTXFFODPQQFSIG-QHWILLEASA-N	443.500	1.423	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)CN2CCC(C(=O)NCc3ccc(F)cc3)CC2)cc1	744387808	YAZKOAIONKKLFZ-UHFFFAOYSA-N	437.475	1.487	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)c2sccc2S(=O)(=O)C(F)F)c1	744983989	KFFNGFLFGLEUQX-UHFFFAOYSA-N	443.409	1.234	50	20	IDGD	
CC(C)[C@H](CNC(=O)NNC(=O)Nc1ccc(OC(F)F)cc1)N1CCN(C)CC1	745431594	DUNPFSCRWSZACH-INIZCTEOSA-N	428.484	1.896	50	20	IDGD	
Cc1ccc(O[C@@H](C)CNC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1	745888835	UZQGBKWNVACVOY-KRWDZBQOSA-N	448.545	1.722	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)CC[S@](=O)c2ccc3c(c2)OCCO3)cc1	746094456	KHDKYHCEXNTFCZ-PMERELPUSA-N	429.454	1.054	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)N[C@@H]1CCN(c2ccccc2Cl)C1=O	746765622	RWYRLABUGCTYNL-OAHLLOKOSA-N	426.864	1.666	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(S(=O)(=O)NNC(=O)c2ccc(Cl)cc2F)c1	747618763	UOGFIHBQASCCIK-UHFFFAOYSA-N	435.886	1.353	50	20	IDGD	
CC(C)C[C@@H](NC(=O)c1ccc(Cl)cc1Cl)C(=O)NNC(=O)C(=O)N1CCCC1	748342437	HHDSKMJAUXKVKX-OAHLLOKOSA-N	443.331	1.908	50	20	IDGD	
CS(=O)(=O)Cc1ccccc1CNC(=O)NNC(=O)COc1ccccc1[N+](=O)[O-]	749586037	LEPDUOBHDUBQIY-UHFFFAOYSA-N	436.446	1.049	50	20	IDGD	
CC[C@H](Oc1ccccc1C)C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	750460657	BPEFNAXWWYAACY-HNAYVOBHSA-N	428.441	1.683	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)o1	751295435	YPBVPVCNYAKZNG-UHFFFAOYSA-N	428.898	1.497	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCc1ccc(C(N)=O)o1	752002499	NDIGMTQRLVUBJO-VIFPVBQESA-N	425.239	1.439	50	20	IDGD	
Cc1nc(-c2cccnc2)nc(O)c1CC(=O)NNC(=S)NCCc1cccs1	753015610	OMQSDRSRNUHAEC-UHFFFAOYSA-N	428.543	1.895	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N2CC(=O)N(CC(F)(F)F)C2)cc1Br	753139708	XZMNQYRCRWBWCP-UHFFFAOYSA-N	439.188	1.476	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cc(C)n(-c3ccccc3)c2C)sc1S(N)(=O)=O	754182427	OEVCQZVHRJXGLL-UHFFFAOYSA-N	448.526	1.886	50	20	IDGD	
CN(C)c1ccccc1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	755636629	FEPGUFLOPHVHIF-UHFFFAOYSA-N	447.517	1.240	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)Nc1ccc(CC(=O)N2CCOCC2)cc1	755861949	JWHQRMHLUUDZHT-IBGZPJMESA-N	440.456	1.081	50	20	IDGD	
CC(C)(C)OC(=O)Nc1ccc(CCNC(=O)NN[C@@]2(C)CCS(=O)(=O)C2)cc1	756138915	ZLVFLKXLXSAVIU-IBGZPJMESA-N	426.539	1.957	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)Nc1nnc(Cc2ccc(F)cc2)s1	756452957	BOOBWIBWUPXSDV-UHFFFAOYSA-N	439.436	1.710	50	20	IDGD	
COCCS(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1	756548718	CWPCISVPIZTLBG-QGZVFWFLSA-N	435.458	1.099	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)N[C@H]2CN(C(=O)OC(C)(C)C)C[C@@H]2C#N)cc1C	758751656	KIJGGLCJWWDFPD-RDJZCZTQSA-N	431.493	1.772	50	20	IDGD	
C[C@@H](CC(=O)c1cccc(Br)c1)C(=O)NNC(=O)C(=O)Nc1ccccn1	758832124	TUYNBJKTADWDNC-NSHDSACASA-N	433.262	1.839	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2cccc(OCC(F)F)n2)ccc1Cl	760262101	BJDSDTUEYNFDKL-UHFFFAOYSA-N	434.808	1.101	50	20	IDGD	
COCCC1(CNC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)CCCC1	760716613	TZTGITUFKZPHNW-UHFFFAOYSA-N	425.555	1.829	50	20	IDGD	
O=C(NNC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1)c1cc2n(n1)CCCO2	761402081	RYKRFXKTNBRZNA-UHFFFAOYSA-N	429.440	1.988	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2cn(CC(F)(F)F)nc2C)c2ccccc2c1=O	763123835	BWMKRMKEGWTUDM-UHFFFAOYSA-N	436.394	1.949	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(S(=O)(=O)CBr)CC2)cc1Cl	763206620	QAVJCLHKLKZWTH-UHFFFAOYSA-N	431.761	1.637	50	20	IDGD	
CCc1ncc(S(=O)(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)s1	763374348	PEIHAXBWUCHKFE-UHFFFAOYSA-N	437.591	1.141	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)CSc2ccccc2O)cc1C(=O)N(C)C	763411641	VSYFPHVWTYZCER-UHFFFAOYSA-N	439.515	1.204	50	20	IDGD	
CC(=O)N[C@@H](C)c1ccc(S(=O)(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)s1	763439931	YPRVTAPVLZGYHD-NSHDSACASA-N	448.567	1.560	50	20	IDGD	
CCS(=O)(=O)c1ccccc1Oc1ccc(NC(=O)C(=O)NNC(=O)C2CC2)cc1	763558120	NMTOIZXXWPOJHF-UHFFFAOYSA-N	431.470	1.768	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)[nH]n1)C(=O)Nc1cccc(Cn2cccn2)c1	763612286	GINGJAAGEMGHJC-UHFFFAOYSA-N	429.440	1.721	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(OC(F)(F)F)cc1	763663663	XJJUALCHQWRPKN-UHFFFAOYSA-N	427.335	1.759	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(C(=O)c3ccccc3)c2)cc1	763673248	BMFITQKMEHGARF-UHFFFAOYSA-N	442.431	1.954	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(OC[C@H]3CCCO3)cc2)c1	763753056	DLLUOYZTEZGTFI-LJQANCHMSA-N	426.473	1.710	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccnn2-c2cccc(Cl)c2)c1	763759136	VTVRIVJCRUVRCG-UHFFFAOYSA-N	426.864	1.991	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccc([C@H](C)N3CCOCC3)c2)cc1	763810083	ZOWXQZNUVYJFLN-KRWDZBQOSA-N	440.500	1.553	50	20	IDGD	
CCOC(=O)c1cc(F)c(F)cc1NC(=O)C(=O)NNC(=O)COc1ccccc1C#N	763812607	HJPVHUBTCNQJNA-UHFFFAOYSA-N	446.366	1.178	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(C(=O)N(C)C)c(Cl)c2)cc1	763821356	OOZDCTGMIZBPDA-UHFFFAOYSA-N	432.864	1.515	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccc(C(=O)NC(C)(C)C)cc1	763871543	HJNRDRPFMNEALG-CYBMUJFWSA-N	444.463	1.907	50	20	IDGD	
COC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2ccc(OC(C)C)c(OC)c2)c1	763916654	QXIIPKSJABPKHZ-UHFFFAOYSA-N	429.429	1.669	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2OC)c(C)c1	764019231	JINLAESRGPPELE-UHFFFAOYSA-N	449.847	1.609	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)Cc2cccc3ccccc23)cc1-n1cnnn1	764034254	BCHYGCFXKADYBK-UHFFFAOYSA-N	445.439	1.153	50	20	IDGD	
CCC(C)(C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)Cc2ccccc2OC)cc1	764130438	HWZVBCXYWGHNCQ-UHFFFAOYSA-N	440.500	1.942	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(F)cc2OCC(F)(F)F)c1O	764133554	WPODVYMRUQBKFP-UHFFFAOYSA-N	445.325	1.881	50	20	IDGD	
N#Cc1cccc(Oc2ccc(NC(=O)C(=O)NNC(=O)[C@@H]3Cc4ccccc4O3)cn2)c1	764154732	UGYCBYLMGFJEMO-IBGZPJMESA-N	443.419	1.835	50	20	IDGD	
Cc1noc(COc2ccc(NC(=O)C(=O)NNC(=O)CCOc3ccccc3)cc2)n1	764160804	IRSXHGRNWMGTQQ-UHFFFAOYSA-N	439.428	1.512	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(-n3cnc4ccccc43)nc2)cc1	764177452	OGLHZMVPNHXCNF-UHFFFAOYSA-N	425.408	1.692	50	20	IDGD	
O=C(Cc1ccccn1)NNC(=O)C(=O)Nc1ccc(N2CCc3sccc3C2)nc1	764266325	AYCYWJQUPOCXND-UHFFFAOYSA-N	436.497	1.429	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C(=O)Nc1ccc(N2C[C@H](C)O[C@@H](C)C2)nc1)c1ccccc1	764328311	OTPOMOSQBORMBJ-BXWFABGCSA-N	439.516	1.975	50	20	IDGD	
CCNC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)[C@H](CC)c2ccccc2)cc1	764332142	MRLZWUSMPQHALX-GOSISDBHSA-N	426.473	1.481	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)C(=O)Nc1cc2c(cc1Cl)OCO2	764342647	HVIOSZDTTHCUEO-UHFFFAOYSA-N	427.804	1.654	50	20	IDGD	
CNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)cc1Cl	764349759	UYOPIQYQUYGJLW-UHFFFAOYSA-N	425.228	1.458	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)CCN3C(=O)c2cccnc2)o1	764370769	CVHHMMXNBSLWDI-UHFFFAOYSA-N	433.424	1.586	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2cccs2)[nH]n1)C(=O)Nc1cccc(N2CCOC2=O)c1	764381858	BBEOEJSUNBHCAW-UHFFFAOYSA-N	440.441	1.495	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1cc(C(F)(F)F)ccc1-n1cccn1	764401314	VPMSVDAEZSUXQE-LLVKDONJSA-N	443.382	1.029	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NN=Cc3ccc(F)cc3F)CC2)cc1	764818333	UKINCOXRKNDVBP-UHFFFAOYSA-N	436.484	1.730	50	20	IDGD	
CC(CS(=O)(=O)c1ccccc1)=NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	764826753	AHDJGIPRNQVWKO-UHFFFAOYSA-N	442.541	1.410	50	20	IDGD	
CN1CCC[C@H](N(C)C(=O)c2ccc(NC(=O)C(=O)NNC(=O)OC(C)(C)C)cc2)C1	765398007	BQFOMTTWMGPTOB-INIZCTEOSA-N	433.509	1.347	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)CNC(=O)c1ccc(Br)o1	765417452	HSRFIEDORMBMBN-UHFFFAOYSA-N	447.286	1.224	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)[C@@H]3Cc4ccccc4N3C(C)=O)n[nH]2)cc1OC	765597721	WUGZODGSNKOVMP-IBGZPJMESA-N	449.467	1.833	50	20	IDGD	
O=C(NC[C@H]1CCCCN1C1CC1)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	765665143	ZJZKONRDMNVBFR-GOSISDBHSA-N	449.577	1.432	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)/C=C/c3ccc([N+](=O)[O-])cc3)CC2)cc1	765749817	UIDKERLFIGWTFF-DHZHZOJOSA-N	437.500	1.882	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(OC)c(Cl)n2)c1	766956490	XITWVDHEAZGOOJ-UHFFFAOYSA-N	440.909	1.849	50	20	IDGD	
O=C(NCc1ccc(O)c(Br)c1)NNC(=O)c1nnc(O)c2ccccc12	767231800	MGJMEKOMADRLQI-UHFFFAOYSA-N	432.234	1.948	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)[C@@H](C)NS(=O)(=O)c2cccc(C#N)c2)c(C)c1	767852060	BKBANUIXZDPIDS-OAHLLOKOSA-N	429.502	1.101	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NC[C@@H]1[C@H]2Cc3ccccc3[C@H]21	767926170	BHNLMRJZWQZBQH-BRWVUGGUSA-N	427.530	1.818	50	20	IDGD	
CC[C@@H](C(=O)NN(C)C(=S)NCCCOC)n1nnc(-c2ccc(Cl)cc2)n1	768735404	LDIZJEXNOQCTMV-AWEZNQCLSA-N	425.946	1.819	50	20	IDGD	
O=C(NNS(=O)(=O)/C=C\c1cccc(Cl)c1)c1csc(N2CCOCC2)n1	768867449	RCBZKLSWPXYLSB-WTKPLQERSA-N	428.923	1.868	50	20	IDGD	
CSCCNC(=S)NNC(=O)CS(=O)(=O)Cc1cccc(Br)c1	769767886	AELBWSCKEITFQS-UHFFFAOYSA-N	440.410	1.222	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)N1CCn2c(nnc2C(F)(F)F)C1	770648374	GJJGEAFIZPOUFN-SECBINFHSA-N	432.790	1.974	50	20	IDGD	
CCCn1nc(C(=O)NNS(=O)(=O)c2ccc3c(c2)CCCO3)c2ccccc2c1=O	771589121	HWKYDRUQGNZIBT-UHFFFAOYSA-N	442.497	1.755	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NNC(=O)[C@@H]2CC(=O)N(CC(F)(F)F)C2)C1	773412887	XSHJZGVTUUVQJA-VXGBXAGGSA-N	436.431	1.192	50	20	IDGD	
CN(C)C(=O)COc1cccc(NC(=O)C(=O)NNc2ncc(Cl)cc2Cl)c1	773673971	VJKUMHIZKVKPJK-UHFFFAOYSA-N	426.260	1.937	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNc2ccc(C#N)cc2)c(C(=O)N2CCCC2)cc1OC	773708468	DJPDTLCCPVELTK-UHFFFAOYSA-N	437.456	1.893	50	20	IDGD	
CCO[C@@H](CNC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1)c1ccccc1	775202866	YNMAAEPSDLAPKK-IBGZPJMESA-N	448.545	1.724	50	20	IDGD	
C[C@@H]1CN(CCOc2ccc(CCNC(=O)NNC(=O)C(=O)N3CCCC3)cc2)C[C@H]1C	775455969	VKLRSWQBCZVMJX-QZTJIDSGSA-N	445.564	1.149	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)Nc2ccnn2[C@H]2CCS(=O)(=O)C2)c1C	776059708	QYDAYALYGKAOSR-CABCVRRESA-N	435.506	1.480	50	20	IDGD	
CC1CCC2(CC1)OC[C@@H](CNC(=O)NNC(=O)c1nn(-c3ccccc3)cc1O)O2	776952551	RGNFUWCXSMWLNJ-JERHATOGSA-N	429.477	1.844	50	20	IDGD	
COCc1ccccc1S(=O)(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	778566432	OMGBJEVSJJTQLH-UHFFFAOYSA-N	442.538	1.725	50	20	IDGD	
COc1ccc(NNC(=O)[C@@H](NS(=O)(=O)c2ccc(C)cc2)[C@@H](C)O)c([N+](=O)[O-])c1	779535621	KAKRWUGQMPNILG-PXAZEXFGSA-N	438.462	1.083	50	20	IDGD	
COC(=O)c1ccccc1NNC(=O)CN1CCN(C(=O)OCc2ccccc2)CC1	780730200	RBUNDGORQXEMAZ-UHFFFAOYSA-N	426.473	1.871	50	20	IDGD	
O=C(NN=c1cc[nH]cc1)c1cc(S(=O)(=O)N2CCCCC2)ccc1N1CCOCC1	781018995	CJDHREFSOXFCJU-UHFFFAOYSA-N	445.545	1.272	50	20	IDGD	
O=C(CCCCCNS(=O)(=O)c1ccc2c(c1)OCCO2)NNc1ccnc(F)c1	781360685	HUDJYLVRHIWWBE-UHFFFAOYSA-N	438.481	1.974	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)CCCCNC(=O)OC(C)(C)C	781669694	PRQNMAKGWKFHOC-UHFFFAOYSA-N	441.554	1.744	50	20	IDGD	
CN(C)CCc1ccccc1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	782904483	FSNNTVQVACYPMJ-UHFFFAOYSA-N	433.534	1.508	50	20	IDGD	
COc1ccc(Oc2ccc(Cl)cc2NC(=O)C(=O)NNC(=O)C(=O)NC2CC2)cc1	782965581	GXDXOKCTNMPVDZ-UHFFFAOYSA-N	446.847	1.505	50	20	IDGD	
CNS(=O)(=O)c1cccc(NC(=O)C(=O)NNc2ccc(Cl)cc2[N+](=O)[O-])c1C	783290050	YQVRSVDOFUHAEX-UHFFFAOYSA-N	441.853	1.547	50	20	IDGD	
Cc1cnn(-c2ccc(C(N)=O)cc2NC(=O)C(=O)NNc2cc(F)c(F)cc2F)c1	784893221	NFGVSUYAYCQPHW-UHFFFAOYSA-N	432.362	1.779	50	20	IDGD	
CCCNS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2cc(F)c(F)c(F)c2)cc1	785088498	OIDUFSUGMFPVRW-UHFFFAOYSA-N	430.408	1.874	50	20	IDGD	
CCCc1c(NC(=O)C(=O)NNC(=O)Cn2nc(C)cc2C)cnn1-c1cccc(C#N)c1	785989925	AJQHQABZCJBGNZ-UHFFFAOYSA-N	448.487	1.296	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN1C1CC1)c1ccccc1NS(=O)(=O)c1cccs1	786735936	OMLZTHUWVORKCP-INIZCTEOSA-N	434.543	1.937	50	20	IDGD	
CCCc1csc(NC(=O)C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)n1	789731811	IBNJAOFRAMXIIF-UHFFFAOYSA-N	442.501	1.786	50	20	IDGD	
COc1ccc2cc(NC(=O)C(=O)NNC(=O)[C@H]3OCC[C@H]3c3ccccc3)ccc2n1	789815210	BTBOFFFERCCPHE-PXNSSMCTSA-N	434.452	1.902	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1cnc(Br)c(Cl)c1	790449581	HIOWQIMAJSPDDL-UHFFFAOYSA-N	439.701	1.965	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1)NNc1nc2ccccn2n1	791239563	KIODWXLFQBFYPK-UHFFFAOYSA-N	430.368	1.050	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cc3c[nH]nc3cc2C)cc1	792268238	FYPZXYIPSSKBDO-ZDUSSCGKSA-N	425.445	1.823	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1O)C(=O)Nc1cccc(N2C(=O)CCCC2=O)c1	792352743	INRFHQLOLBTMAV-UHFFFAOYSA-N	444.831	1.489	50	20	IDGD	
COCCCNC(=S)N(C)NC(=O)[C@@H]1CS[C@@]2(c3ccc(F)cc3)CCC(=O)N12	793274195	VAIADSPUJKWSOS-HNAYVOBHSA-N	440.566	1.590	50	20	IDGD	
Cc1ccccc1[C@@H](CC(=O)NNC(=O)CNC(=O)OCc1ccccc1)NC(N)=O	794060674	NDOQMJGGVVNRRB-QGZVFWFLSA-N	427.461	1.168	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)[C@@H](NC(C)=O)[C@@H](C)CC)c2ccccc2c1=O	794776641	UFJYVBKCRWEYSM-KSSFIOAISA-N	429.521	1.899	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=S)NCCCCC(F)(F)F	794986752	VNUYUQDYAFYDEA-UHFFFAOYSA-N	445.511	1.672	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H]2CN(CC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)CC[C@@H]21	795098638	DXUWYJKSHNYLBC-RDJZCZTQSA-N	447.492	1.687	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNC(=O)C(=O)Nc1ccc2c(c1)CCCO2	797368945	JQJYHNRFDDDKAS-UHFFFAOYSA-N	426.429	1.024	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2cccc(C(=O)NCc3ccccc3)c2)n1	797371167	PWMJXKJSUXZZTJ-UHFFFAOYSA-N	431.452	1.720	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)c1ccoc1C1(O)CCOCC1	798150937	PDMLTMTVXVXZEA-UHFFFAOYSA-N	439.262	1.880	50	20	IDGD	
CCOc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NNC(=O)c1ccc(OCC)c(OC)c1	799259031	RKSDACLBEUIEFD-UHFFFAOYSA-N	446.416	1.801	50	20	IDGD	
O=C(NNC(=O)c1ccccc1S(=O)(=O)N1CCOCC1)Nc1ccc(Cl)cc1	802014406	MZWVXLJNLDWGQU-UHFFFAOYSA-N	438.893	1.827	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCC(=O)NNC(=O)Nc1ccc2c(c1)OCO2	802107296	PMIRJJDCHYNSAU-ZDUSSCGKSA-N	449.464	1.084	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)NC2CCC3(CC2)NC(=O)NC3=O)c(C)n1C[C@@H]1CCCO1	804730832	DOTOBHOHPCJZDM-LAPWNKQUSA-N	439.516	1.828	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)c1cn(-c2ccccc2Br)nn1	804959044	XCTRDXJLGLEADF-UHFFFAOYSA-N	426.238	1.762	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1cc(C)cc(I)c1	806981046	HUCJXJGVAWEIKR-UHFFFAOYSA-N	427.202	1.480	50	20	IDGD	
COc1cc(C)c(Br)cc1NC(=O)C(=O)NNc1ccc(-n2ccnc2)nn1	807430006	XNJPHBRYDMTPMX-UHFFFAOYSA-N	446.265	1.824	50	20	IDGD	
COc1cc(C(=O)NNC(=O)N[C@@H]2CCC[C@H]3CN(C(C)=O)C[C@@H]32)cc(OC)c1OC	808185627	BMIGYRQMIBIMBT-CWRNSKLLSA-N	434.493	1.303	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(C)n(C2CCCCC2)n1	810385661	XXVHPZPQIDNJPH-UHFFFAOYSA-N	429.477	1.870	50	20	IDGD	
Cn1nnc2c1C[C@H](C(=O)NNc1ccc(S(=O)(=O)Nc3nccs3)cc1)CC2	810468598	BVPFRHWNOBHHDF-LLVKDONJSA-N	433.519	1.321	50	20	IDGD	
CN(C)c1cccnc1CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	812534346	KQHONKYLEBXHOJ-UHFFFAOYSA-N	446.533	1.076	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)c2cc(S(C)(=O)=O)ccc2Cl)cc1	812730890	DVXFUVRYVPVVHX-UHFFFAOYSA-N	431.923	1.751	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc4c(C)nn(C)c4c3)n[nH]2)cc1	812979115	JMHACJALGUZAEG-UHFFFAOYSA-N	431.456	1.980	50	20	IDGD	
Cc1ccc(-n2cccn2)cc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	813033479	VOSRBUCOOXXTQH-UHFFFAOYSA-N	442.501	1.513	50	20	IDGD	
CCCc1nc(C)c(CNC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)o1	813862408	OAIOAHYITSNVRH-UHFFFAOYSA-N	449.533	1.864	50	20	IDGD	
COCc1cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)cc(C(=O)OC)c1	815566052	HOPODMQOQWMFQK-LBPRGKRZSA-N	447.419	1.312	50	20	IDGD	
CC(C)COc1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2CCc3nncn3C2)cc1Cl	815692681	YHXVYQAZQCLBGU-GFCCVEGCSA-N	434.884	1.315	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CNc2ccccc2)cc1S(=O)(=O)N1CCCC1	823327739	COMKYMYXQZBIQB-UHFFFAOYSA-N	432.502	1.353	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)c2ccc(-n3cncn3)nc2)c2ccccc2c1=O	828967399	YFNGGDCPNLNODW-UHFFFAOYSA-N	446.471	1.637	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@@H](B(O)O)C2)cc1S(=O)(=O)N1CCCc2ccccc21	864232563	AEZJKZWWKWAWKS-QGZVFWFLSA-N	444.318	1.526	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)C3=COCCO3)c2)c(C)c1	913169479	XMGNCYQSOKJQSK-UHFFFAOYSA-N	431.470	1.753	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)[C@H](CC(C)C)N2C(=O)[C@@H]3CC=CC[C@H]3C2=O)cc1	913429579	JPGKMFFGFIGOPB-QRVBRYPASA-N	442.516	1.620	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCCNC(=O)c2ccc(C)c(F)c2)cc(OC)c1OC	914536051	GAMXHEKBJXHDLJ-UHFFFAOYSA-N	448.451	1.534	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)c2sc(-c3c(C)c(C)nn(C)c3=O)nc2C)c1	915188133	VBFIDJIKYNAVIG-UHFFFAOYSA-N	441.513	1.977	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)NC[C@H]3CCCO3)c2)cc1	915879553	UUYWMQCNXAKWEU-QGZVFWFLSA-N	448.501	1.619	50	20	IDGD	
CCOCCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	915888719	RGCHBHHSZUDJDH-UHFFFAOYSA-N	434.518	1.536	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)NC[C@H]1CN(Cc2ccccc2)CCO1	915895274	ZUWMQRKCSJDGMO-KRWDZBQOSA-N	443.460	1.205	50	20	IDGD	
CC[C@@H](C)NC(=O)c1cccc(CNC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c1	916476807	MPFJUWKKTUADPQ-CQSZACIVSA-N	446.529	1.763	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)[C@H](CC(C)C)N1C(=O)[C@H]2CC=CC[C@H]2C1=O	917360309	GISVQLHLVNJLPP-BBWFWOEESA-N	437.500	1.770	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)NCCNC(=O)c2ccc(OC)cc2)cc1OC	918221862	PIFMKUJHFOGILD-UHFFFAOYSA-N	430.461	1.477	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3C[C@H](C)O[C@H](C)C3)c2)c(O)c1	918341291	RJXOGDUSAMMBMG-GASCZTMLSA-N	447.513	1.573	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)CCOc2ccccc2[N+](=O)[O-])c2ccccc2c1=O	918675553	GPHQWLOQILDYLF-UHFFFAOYSA-N	425.401	1.555	50	20	IDGD	
COCCOc1cccc(C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)c1	919684367	QIPBPHPAKJWLDH-UHFFFAOYSA-N	435.502	1.102	50	20	IDGD	
CNC(=O)NNC(=O)c1ccc(Br)c(S(=O)(=O)N(C)c2ccccc2)c1	919877977	WIDWQRQGPSMKGB-UHFFFAOYSA-N	441.307	1.848	50	20	IDGD	
O=C(NNC(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1)N[C@H]1CCS(=O)(=O)C1	919889629	QGIOEXIUTSACJF-AWEZNQCLSA-N	433.446	1.470	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)NC[C@@H]2CN(Cc3ccccc3)CCO2)cc1	919898113	YAACZABUEZBSKR-OAQYLSRUSA-N	426.517	1.859	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(=O)n3c(nc2c1)CCCCC3)c1ccc(-n2cnnn2)cc1	920252395	VAHNATKWZPTKKW-UHFFFAOYSA-N	444.455	1.173	50	20	IDGD	
O=C(NC[C@H]1CCN(c2ccc(Cl)cc2)C1)NNC(=O)c1ccc(-n2cnnn2)cc1	921244747	NZTOCKJLDZDHCQ-CQSZACIVSA-N	440.895	1.786	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NCc1cccc(CN2CCN(C)CC2)c1	1318284672	YXPFEYYNJISHEL-QGZVFWFLSA-N	443.523	1.871	50	20	IDGD	
COc1ccccc1N1CC[C@@H](NC(=O)NNC(=O)c2cncn2-c2ccccc2)C1=O	1319571060	CFBXNEAHYHTOFD-MRXNPFEDSA-N	434.456	1.630	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2cccc(S(=O)(=O)CC)c2)c2ccccc2c1=O	1320244553	DUNPVTIMCUXWCT-UHFFFAOYSA-N	443.485	1.677	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)c3cc(S(=O)(=O)C4CCCC4)ccc3F)nc21	1321144468	HLRKAWOXDPVOBU-UHFFFAOYSA-N	434.453	1.681	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](CC)NC(N)=O)C1	1777982198	WUWMQQPDCJKTCH-HNSFDTNUSA-N	447.374	1.121	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H]2Cc3ccccc3CN2)C1	1778035778	CKKUJUBILPQNAT-GLHSZLCASA-N	449.979	1.469	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cccn3cncc23)C1	1779134401	QLBMCOAWQGMAMJ-HGHGUNKESA-N	434.924	1.716	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(C(F)(F)F)ccn3)C2)C1	1779663609	CYDJNGJQFGUZIL-GUYCJALGSA-N	435.830	1.798	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(OC)nn3)C2)C1	1779902435	QZFNRRZPIGLRLT-SJKOYZFVSA-N	427.299	1.102	50	20	IDGD	
CO/C=C(\C)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1	1780097884	QBQKNYYCRLZDHI-KVDXNUTJSA-N	447.444	1.514	50	20	IDGD	
COc1cc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@](C)(Cl)CCl)C2)n(C)n1	1780710482	XBNYFQXIESXFNO-MDASCCDHSA-N	447.363	1.793	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CCO[C@@]2(CCN(C(=O)[C@](C)(Cl)CCl)C2)C1	1781231897	GQFJDYYPAUOBEJ-BWMZKYQQSA-N	447.359	1.808	50	20	IDGD	
O=C1CCc2ccc(C(=O)N3CCO[C@]4(CCN(C(=O)[C@H](F)Br)C4)C3)cc21	1781332541	IBQCYBDHYUHSEW-LPHOPBHVSA-N	439.281	1.950	50	20	IDGD	
Cc1cnn(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](C)Br)C2)c1	1781998306	RGBMPEVDZGIGKM-IIDMSEBBSA-N	427.343	1.489	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCn2cncn2)C1	1782452845	TTWUVPLXPAKRND-FHLIZLRMSA-N	432.352	1.418	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCn2cncn2)C1	1782453874	DYHZBYIWTVOEOA-HDMKZQKVSA-N	442.358	1.356	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1783351547	BTBWSPPOUUJCNR-KWBADKCTSA-N	430.112	1.680	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)CNC(=O)OC(C)(C)C)CCO2)C1	1783354812	GBWDTQWHVGNXJX-SCLBCKFNSA-N	448.358	1.515	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cc(-c4ccccn4)[nH]n3)CCO2)C1	1783538058	SKGNYTQVBAZYSO-BFUOFWGJSA-N	448.321	1.699	50	20	IDGD	
C[C@H](NNc1ccccc1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21	1783554543	NURRYTZPPXFWBB-SDADXPQNSA-N	429.348	1.775	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3coc([Si](C)(C)C)c3)CCO2)C1	1783877407	IRJNUKLMFWFCAN-BEFAXECRSA-N	428.989	1.522	50	20	IDGD	
Cn1c(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](O)CCl)C[C@@H]32)cc2ccccc21	1783894333	CATRTKVBVAYOHQ-UHMOLFJZSA-N	433.936	1.300	50	20	IDGD	
CC[C@H](C(=O)N1CCO[C@@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1)c1ccccc1	1783936362	MGBOGWRWOUXSCL-WMZHIEFXSA-N	430.549	1.383	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccnc(Br)c3)C[C@@H]21)[C@H](O)CCl	1784091562	XLELKNVVRSTKPN-FQUUOJAGSA-N	446.729	1.037	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3CCN(C(C)C)CC3)[C@H]2C1	1784996556	MBDAUVMIVXONNV-OKYOBFRVSA-N	429.989	1.340	50	20	IDGD	
CC(=O)Nc1ccccc1C(=O)N1CC[C@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1785099848	KJALYQLUIQEEHB-NRFANRHFSA-N	433.581	1.940	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21)c1cnn(-c2cccnc2)c1	1785731139	IAJPJNWJUXPTPU-RCBQFDQVSA-N	438.315	1.664	50	20	IDGD	
CCN1CCC(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCBr)[C@H]3C2)CC1	1786408048	AIIXCDMYOJOJJC-ULQDDVLXSA-N	430.387	1.483	50	20	IDGD	
CCOc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]32)nn1	1789397150	OVOJIDDAWXOVGZ-VODUFIJXSA-N	445.347	1.705	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)N(C)C(C)=O)C[C@@H]21	1790961846	RQDNADPLYQIUMS-DGVSKKNDSA-N	432.359	1.006	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/c3ccc([N+](=O)[O-])o3)C[C@@H]21)C(Cl)Cl	1791292543	JEAKWWGLIATDJP-PRPBNIASSA-N	432.260	1.984	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3cc(F)ccc3s1)C2)[C@@H](O)CCl	1792981240	HLYITCQQMWOJRO-IFOZYUSPSA-N	426.897	1.843	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](CC1CC1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCl	1793116405	MKLBVDDRXQUWOP-ZHCJQAHYSA-N	443.972	1.918	50	20	IDGD	
CNC(=O)CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](Br)Cc1ccccc1)C2	1793503288	LMPITEYVCKIVNR-YYIAUSFCSA-N	436.350	1.767	50	20	IDGD	
NC[C@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1ccccc1	1795675588	MGLXJXHEPOVPTD-QRJUGERDSA-N	428.302	1.009	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1cccc2nc[nH]c12	1796145331	ZFJDURAPAYXPPM-FJHTZYQYSA-N	425.258	1.457	50	20	IDGD	
Cc1ncc(Br)cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Cl	1796362034	WYTANPNIJFAULK-RDBQEKCUSA-N	434.693	1.890	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1c(F)c(C)nn1C)C2	1796889917	NUMICTPIRGJGQW-JWBKOJIWSA-N	443.483	1.253	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnc2ncccn12	1797029839	NMXURBDYNQFKAR-XFMPKHEZSA-N	436.310	1.106	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2cc(OC)ccc2o1	1797351178	YLKIVNYDTYGTJE-QHHYFVSCSA-N	436.892	1.898	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(C3CC3)cc1)C2	1797753958	MKWWDNAFRDNCTA-RMFSNUHRSA-N	449.511	1.080	50	20	IDGD	
COc1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)s1	1798440756	OLLJWVJYZOGMNY-CLLJXQQHSA-N	429.502	1.321	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1cccc2ccnn12	1799904538	WTGZIGMZTCROMU-BAESOJJISA-N	425.258	1.228	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](O)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@](C)(Cl)CCl	1800081672	AQJDLWKYPSVARN-FYMKNAMNSA-N	438.352	1.704	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(=O)c1ccc(Cl)cc1)C2	1800970820	LKSJTSHZOJIZBA-OCVGTWLNSA-N	429.300	1.366	50	20	IDGD	
Cc1cc(C)n(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@](C)(Cl)CCl)C3)n1	1801247344	BGJOZIVPXFKZPM-HIRMHNASSA-N	431.364	1.716	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cn3ncccc3n2)[C@H]1c1cccnc1)[C@@H](O)CCl	1803142277	CPGSUPDVJOMXTN-ZVZYQTTQSA-N	428.880	1.044	50	20	IDGD	
Cn1c(=O)n(CC(=O)N2CCC3(CCCN(C(=O)[C@@H](O)CCl)C3)CC2)c2ccccc21	1805524242	MQNBWLXQDNROSB-SFHVURJKSA-N	448.951	1.171	50	20	IDGD	
C=CCO[C@@H](C)C(=O)N1CCCC2(CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CC2)C1	1806026425	RLFVOLGYIRLHND-WLXKGNRNSA-N	443.548	1.943	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CC2CCCC2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807366219	XSEHLZUMQWNTCP-REWPJTCUSA-N	435.333	1.661	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2cc3n(n2)CCNC3=O)[C@@H]1c1cccnc1	1808249336	DYXOJHXYULHKFU-RVKKMQEKSA-N	444.923	1.359	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1CCN(C(=O)C2=NNC(=O)C2)[C@H]1c1cccnc1	1808305760	AFHAUSWOLFYLPZ-QITLCBANSA-N	426.304	1.200	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)[C@@H]2CCC(=O)N2C)[C@H]1c1cccnc1	1808777008	AKBAMUHTQNIESK-PWXKEOIMSA-N	437.338	1.492	50	20	IDGD	
CN1CCc2cc(C(=O)NC[C@@H]3CCN(C(=O)[C@H](O)CCl)[C@@H]3c3cccnc3)ccc21	1809317869	ZJENGHJOFUPCLV-CEWLAPEOSA-N	442.947	1.993	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC2(CCCN(C(=O)CN3CCOCC3)C2)CC1	1809540029	JFOGPWQKIHQOCO-INIZCTEOSA-N	430.387	1.581	50	20	IDGD	
Cc1cc(C)nc(C(=O)N2CCC3(CCCN(C(=O)c4ccc(B(O)O)cc4)C3)CC2)c1	1809967117	WDFBKUGZXCCDFR-UHFFFAOYSA-N	435.333	1.537	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2cc(=O)ccn2C)[C@H]1c1cccnc1	1811367005	QURABDPMTTYYTM-VDZJLULYSA-N	432.908	1.354	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CSc2nc[nH]n2)[C@@H]1c1cccnc1)C(Cl)Cl	1813081882	FGEVREHSFVTQGJ-WCQYABFASA-N	429.333	1.802	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)C1(F)CCCCC1)CC2)c1cccc(B(O)O)c1	1815356298	AXWPTUPISFVJKG-OAHLLOKOSA-N	445.325	1.721	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc[nH]1)CC2	1817281733	OEWDXQBLZWCRKY-BUGPSZFBSA-N	439.501	1.831	50	20	IDGD	
C#CCCCCC(=O)N[C@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1	1819801917	VLDPFKAWSWYHJC-ZDUSSCGKSA-N	440.529	1.561	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](C)Br)CC2	1820149948	WAUQVDSHPFQNJB-OPRDCNLKSA-N	429.340	1.529	50	20	IDGD	
CCN(C)[C@@H](C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1821626436	HDNGDEVWSQHCBF-SUMWQHHRSA-N	442.524	1.054	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCC([C@H]2CCCCN2C(=O)C(O)O)CC1	1824022045	CSNGFYNJNQEIFS-LSDHHAIUSA-N	447.960	1.049	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)C(=O)c2ccco2)CC1	1825062842	SPPHKPXGSCMDIO-QGZVFWFLSA-N	432.521	1.455	50	20	IDGD	
CCOc1ccc(C(=O)N[C@@H]2CCc3nc(NC(=O)[C@H](Cl)COC)sc3C2)nn1	1826003278	JVRFYUHIFALTHO-GHMZBOCLSA-N	439.925	1.811	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccccc1O)CC2	1826080690	UKYQOKXRXDFVOK-LBPRGKRZSA-N	431.518	1.448	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(Cl)cc3C)CCO2)C1	1830124573	MFAJKLNFMHZXHL-YLJYHZDGSA-N	445.343	1.972	50	20	IDGD	
Cc1c(F)cccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1830161276	VAFSOYGRYVANGQ-YJBOKZPZSA-N	447.276	1.895	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccsc3)C2)C1	1830537424	HQEBASMUFJPWLM-GUYCJALGSA-N	431.352	1.849	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3CCc4nc[nH]c4C3)C2)C1	1831657964	RTVWJBSTSJZLEA-VWKPWSFCSA-N	438.956	1.379	50	20	IDGD	
CNC(=S)NCCC(=O)N1CCC([C@H]2CCCCN2C(=O)[C@H](Cl)COC)CC1	1831830479	CYEFATFVODUMLO-HZPDHXFCSA-N	433.018	1.344	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cnc(O)nc2O)CC1	1831832785	IPPVMIMUYMGCPQ-HUUCEWRRSA-N	426.901	1.375	50	20	IDGD	
O=C(/C=C/c1ccc(F)cc1F)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1	1832132461	UARKCOLOVBEAEC-YJVPDANMSA-N	444.862	1.034	50	20	IDGD	
Cc1ccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)cn1	1833132871	OCFGVJFYCXPTMY-AEFFLSMTSA-N	444.301	1.079	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)CSc3ccncc3)CC2)CC1)[C@H](O)CCl	1833308110	JCQWZKGKQQHWBA-GOSISDBHSA-N	440.997	1.345	50	20	IDGD	
C[C@@H](C(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)CCl)CC2)CC1)c1ccc(O)cc1	1833313888	ROPVINDOTMJHRK-QRWLVFNGSA-N	437.968	1.667	50	20	IDGD	
CC(C)(C)c1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)ccn1	1833369136	PFKYVOQOLSOVHT-OXQOHEQNSA-N	427.904	1.984	50	20	IDGD	
O=C(CSc1ccccc1)NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1834515505	VBQRNVJYSRVEGA-LJQANCHMSA-N	440.009	1.950	50	20	IDGD	
COCCn1nccc1C(=O)NC1CCN(C2CCN(C(=O)[C@@H](F)Cl)CC2)CC1	1835179810	VYMRTTLDTZIPBE-QGZVFWFLSA-N	429.924	1.249	50	20	IDGD	
C[C@@H]1CC[C@H](C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](C)CBr)C3)C2)O1	1836601900	UBLBISDUZKYHKG-BORJPKMPSA-N	433.343	1.041	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4cnccc4[nH]3)C2)C1	1837713084	GJQTUXYHKRDPBS-NRFANRHFSA-N	446.580	1.484	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCC(OC2CCN(C(=O)CN3CCNC3=N)CC2)CC1	1837862107	WXXJOEZASZOVBT-LJQANCHMSA-N	448.395	1.061	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(-n4cnnc4)cc3)C2)C1	1839144283	UIIAILVGZNKOPC-NQIIRXRSSA-N	447.923	1.355	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(C(C)C)on3)C2)C1	1840150415	KPPSMOCUUGAPEV-AUUYWEPGSA-N	429.901	1.122	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(F)c(F)c3)C2)C1	1840154311	RWMDDWXCKVGGGZ-KUHUBIRLSA-N	432.851	1.289	50	20	IDGD	
C[C@@H](Sc1ccccn1)C(=O)N1CCOC[C@]2(CN(C(=O)C(Cl)Cl)CCO2)C1	1840190732	KHYFUOOWTUSWTM-FZKQIMNGSA-N	448.372	1.822	50	20	IDGD	
O=C(C(Cl)Cl)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CCc3ccccc31)CCO2	1840260316	KQGXXRBLGDTIKW-JXFKEZNVSA-N	427.328	1.977	50	20	IDGD	
C[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1)c1ccccc1	1840892999	OVJZBYYEXCPPLS-ZSZQSSIHSA-N	443.313	1.937	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1ccc(F)cc1F)C2	1843416423	ILJFNIUNVIZMSW-DHRITJCHSA-N	429.427	1.916	50	20	IDGD	
C[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1C(=O)N1CCCC12CN(C(=O)[C@H](O)CCl)C2	1843970873	BOUDOYAFGCCVKA-SOUVJXGZSA-N	429.945	1.293	50	20	IDGD	
Cc1cn2c(=O)c(C(=O)N3CC4(CCCN4C(=O)[C@H](F)Br)C3)cnc2s1	1845217666	ODCHCTVWZIDVIB-NSHDSACASA-N	443.298	1.572	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC12CN(C(=O)c1ccc(S(C)(=O)=O)cn1)C2	1846175915	BMWPMOHNFGPPRU-LLVKDONJSA-N	430.324	1.086	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)CCS(=O)(=O)c1ccccc1)C2	1846361488	XRHCKTZVACFCGG-INIZCTEOSA-N	428.938	1.308	50	20	IDGD	
Cc1cccc(C)c1N1C[C@@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](O)CCl)CC1=O	1847556252	FVLHEYRICTYPEM-XSLAGTTESA-N	433.936	1.458	50	20	IDGD	
O=C(c1cc(Br)c(O)cc1F)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl	1847566118	KSWYQJJBJAGRGL-SGMGOOAPSA-N	435.677	1.709	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)NCc2ccc(CS(=O)(=O)NC(C)C)cc2)c1	9864939	DRISIWWZCOGYOZ-UHFFFAOYSA-N	448.545	1.732	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CCc2c(C)nc(SC)[nH]c2=O)ccc1OC(C)C	14390567	VTJBLTHCSMRMAS-UHFFFAOYSA-N	434.518	1.990	50	20	IDGD	
Cc1cccc2c(=O)n(CC(=O)NNC(=O)CCN3CCN(c4ccccc4)CC3)cnc12	18184213	ACKNJFKQNITDNW-UHFFFAOYSA-N	448.527	1.065	50	20	IDGD	
CS(=O)(=O)CC[C@@H](NC(=O)c1ccc(Cl)cc1)C(=O)NNC(=O)c1ccccc1	24332439	KVIJPVNQWBBFJH-MRXNPFEDSA-N	437.905	1.334	50	20	IDGD	
C[C@H]1CCCCN1Cc1ccccc1CNC(=O)NNC(=O)CNC(=O)c1ccco1	725870221	DJIASPJVFTVEFK-INIZCTEOSA-N	427.505	1.914	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(CNC(=O)NNC(=O)c2nnc(O)c3ccccc23)CC1	726265687	KCWZCIOUNWRYPE-UHFFFAOYSA-N	444.492	1.927	50	20	IDGD	
Cc1cc(C(=O)N2CCC[C@@H]2C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)ccc1[N+](=O)[O-]	726520711	KDNNUOBYTHPLJY-QGZVFWFLSA-N	441.400	1.877	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)[C@H](c2ccccc2)N2CCN(C)CC2)cc1	727766272	OONODDYEHICFFG-GCJKJVERSA-N	440.544	1.989	50	20	IDGD	
CC(C)(C)CC(=O)NNC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1	728606787	PVTCEBLGUMCWLY-CYBMUJFWSA-N	426.495	1.579	50	20	IDGD	
C[C@@H](NC(=O)CCC(=O)C(C#N)=C1N(C)c2ccccc2N1C)[C@@H](C)N1CCOCC1	729447757	ZYLHGHODTFVHRF-IAGOWNOFSA-N	425.533	1.882	50	20	IDGD	
CSCC[C@H](C(=O)NNC(=O)COc1ccccc1O)N1C(=O)[C@@H]2CCCC[C@H]2C1=O	730780196	KATISDOBYWZSRS-RBSFLKMASA-N	449.529	1.215	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)c2ccc(S(N)(=O)=O)c(C)c2)c1	730842179	AOBBPFBAEAQESJ-UHFFFAOYSA-N	442.291	1.488	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)c2nnn(-c3cccc4c3CCN(C)C4)c2C)c1O	731811343	QGKVZEHTZNYOTL-UHFFFAOYSA-N	436.472	1.353	50	20	IDGD	
Cc1nn(-c2ccccc2)c2nc(C(=O)NNC(=O)CCN3C[C@H](C)O[C@@H](C)C3)ccc12	732261164	BBZLHEAFYLUMLN-HOTGVXAUSA-N	436.516	1.989	50	20	IDGD	
CN(CC(=O)NNc1ccccc1S(C)(=O)=O)S(=O)(=O)c1ccc(Cl)cc1	732303794	LMBOMVSIYGZJSI-UHFFFAOYSA-N	431.923	1.507	50	20	IDGD	
CC(C)(C)CC(=O)N1CCC[C@H]1C(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	732332215	HNQATIWYCQZNJG-HNNXBMFYSA-N	434.449	1.326	50	20	IDGD	
COCCOc1ccc(-n2nc(C)c(C(=O)NNc3nc(-c4ccncc4)no3)n2)cc1	735041497	WMZNRFNWEBFKEL-UHFFFAOYSA-N	436.432	1.803	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)c1nnn(-c2cccc(Br)c2)c1C	740850909	FJVLQZRPPDWRAF-UHFFFAOYSA-N	437.298	1.404	50	20	IDGD	
O=C(COC(=O)[C@@H]1CCCCN1Cc1ccccc1)NNC(=O)c1ccc([N+](=O)[O-])cc1	741354458	RJZAEELRUDMMER-IBGZPJMESA-N	440.456	1.954	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@@H]2C[C@H]2c2cccc(F)c2F)cc1	741660781	OAHOYGQCHGMRSR-JKSUJKDBSA-N	437.468	1.845	50	20	IDGD	
O=C(COC(=O)Cc1ccc(OC(F)F)cc1)NNC(=O)[C@H]1COc2ccccc2O1	742389150	FNTBOGSHSAPBQA-MRXNPFEDSA-N	436.367	1.361	50	20	IDGD	
CC(C)(C)C(=O)NNC(=O)CSc1nnc(-c2cncc(Br)c2)n1N	742454929	WCLQSNMYAXOIPB-UHFFFAOYSA-N	428.316	1.102	50	20	IDGD	
O=C(CCN1C(=O)NC2(CCCC2)C1=O)NNC(=O)NCc1cccc(C(F)(F)F)c1	742458156	WAFOJFOHSFTCSD-UHFFFAOYSA-N	441.410	1.791	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNC(=O)CCN2C(=O)[C@H]3[C@H]4CC[C@@H](O4)[C@@H]3C2=O)cc1	742473859	OUGZKYDOYSYXOB-JYBIWHBTSA-N	443.500	1.425	50	20	IDGD	
COCc1cc(C(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)no1	742488838	FQZPOCXFIGFSTJ-UHFFFAOYSA-N	436.471	1.758	50	20	IDGD	
NC(=O)[C@@H]1CC(C(=O)NNC(=O)c2cccc(Br)c2)=NN1c1ccccc1	742771449	VFKFEDSSGGTCCI-HNNXBMFYSA-N	430.262	1.330	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)[C@@H](Cc1ccccc1)NC(=O)c1cccnc1	742774967	XUGFWBIVYSPZSP-LJQANCHMSA-N	448.479	1.658	50	20	IDGD	
O=C(O)COc1ccc(C=NNC(=O)c2ccc(-n3cnnn3)cc2)cc1Br	743428817	MVGGYJPRRYKVCS-UHFFFAOYSA-N	445.233	1.652	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)N[C@@H](C)CN2CCN(c3ccccc3)CC2)c1	743631452	BITNLMVLNRQLPI-KRWDZBQOSA-N	441.532	1.859	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCn2c(nnc2-c2ccccc2)C1	744426532	JHECAZQTAGNPAZ-UHFFFAOYSA-N	440.891	1.884	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)NCc1ccccc1OCCN1CCOCC1	744868995	OTRJNSAXHITMPT-UHFFFAOYSA-N	446.479	1.446	50	20	IDGD	
CC(C)CNC(=O)N1CCC[C@@H](CC(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)C1	745112589	VMCPLMQRPHJZLF-KRWDZBQOSA-N	443.504	1.330	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)Cc1c(C)nc2nc(SC)nn2c1C	747474477	MLMOXHYOBLKMHR-UHFFFAOYSA-N	428.518	1.794	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2ccc[nH]2)cc1S(=O)(=O)N[C@@H]1CCCC[C@@H]1C	747662305	KEKZINZOFYVEHD-DZGCQCFKSA-N	434.518	1.955	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNS(=O)(=O)c2ccc(C(=O)OC)cc2C)cc1	747693203	REMSEFFZUVTTIT-CQSZACIVSA-N	436.486	1.957	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1)NNc1ccc([N+](=O)[O-])cc1	747981142	FHGUUYNQLYMBKO-UHFFFAOYSA-N	434.352	1.915	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)[C@@H]1CCn2ccnc2C1	749258812	PVKLKOHGKRPSOB-QGZVFWFLSA-N	430.940	1.064	50	20	IDGD	
CC(C)(CCC(=O)NNC(=O)c1ccccc1F)C(=O)NNC(=O)c1ccccc1F	749307718	DKYIUBPTMOAZCP-UHFFFAOYSA-N	432.427	1.993	50	20	IDGD	
C[C@H](Cc1ccncc1)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	749620525	NSPZKJVBXYLLEY-OAHLLOKOSA-N	431.518	1.441	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1cccc(Cl)c1[N+](=O)[O-]	749866674	QPQRCBAITFBZCZ-UHFFFAOYSA-N	425.854	1.925	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)c1ccccc1F)C(=O)NNC(=O)c1ccc(C)o1	752781162	PVOICAONVRENMD-ZDUSSCGKSA-N	429.495	1.588	50	20	IDGD	
O=Cc1ccc(OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c(Br)c1	755108137	GVYPBOMBUIHURB-INIZCTEOSA-N	435.230	1.628	50	20	IDGD	
O=C(NCCN1C(=O)[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)NNC(=O)c1cccc(OC(F)F)c1	755151562	YOHYVXKMPDCJNO-UOVKNHIHSA-N	434.399	1.039	50	20	IDGD	
CN(C)C(=O)CS(=O)(=O)c1ccc(C(=O)NNc2nc(C(F)(F)F)cs2)cc1	755853148	VBZAKDMSNNWIPU-UHFFFAOYSA-N	436.437	1.781	50	20	IDGD	
CNS(=O)(=O)c1ccc(C)c(NC(=O)NNC(=O)COc2ccc(Cl)cc2)c1	756529352	YYTRQPHAJIEXRU-UHFFFAOYSA-N	426.882	1.788	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2cnn(C[C@H]3CCCO3)c2)c2ccccc2c1=O	756739069	LJQHDUSACGWGNE-CQSZACIVSA-N	425.449	1.258	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)Nc2ccc(S(=O)(=O)NC3CC3)cc2)cc1	756775930	NHVNUKVPCPOEJK-UHFFFAOYSA-N	432.502	1.921	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N(C)CC[C@@H](C)O)cc1	756959836	UWEDYTOSINSMBD-YHZJOHHESA-N	425.489	1.570	50	20	IDGD	
CNC(=O)Cn1nc(NC(=O)NNC(=O)c2ccc(F)cc2Br)cc1C	757823600	SETJDDMIHQZVPM-UHFFFAOYSA-N	427.234	1.306	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)CC[C@@H]2CCCN2C(=O)OC(C)(C)C)c2ccccc2c1=O	758070330	AXCIOSFRJLMXAR-AWEZNQCLSA-N	443.504	1.874	50	20	IDGD	
COc1ccc2c(c1)OC[C@@H]2CC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1	760264478	PZUXCFCDQKESDD-HNNXBMFYSA-N	447.513	1.338	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)C(=O)Nc1cnccc1-c1ccccc1	760280811	XQKDSVJQHXFZBQ-UHFFFAOYSA-N	435.396	1.822	50	20	IDGD	
Cc1cc(C)nc(-n2nccc2NC(=O)C(=O)NNC(=O)CCCc2cccs2)n1	760289570	DYWSXDZLVPWVPV-UHFFFAOYSA-N	427.490	1.449	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)Cc1cccc(I)c1	760491351	FXHMQNWIBVXXAL-UHFFFAOYSA-N	427.198	1.004	50	20	IDGD	
C[C@H](CC(=O)NNC(=O)CNC(=O)c1ccco1)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	763325234	YXDMSGOQBRZCTB-HUUCEWRRSA-N	436.509	1.830	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)cc2)CCO1	763442862	UJDPHSUBVHMKAD-ZDUSSCGKSA-N	427.417	1.220	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)n(-c2ccc(F)cc2)n1	763454954	KZOKGOVBMOEFPO-UHFFFAOYSA-N	426.364	1.628	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2ccccn2)ccc1NC(=O)OC(C)(C)C	763466606	KIDQSMMPGYCPMV-UHFFFAOYSA-N	429.433	1.837	50	20	IDGD	
O=C(Cc1ccccc1)Nc1cc(NC(=O)C(=O)NNC(=O)c2cccnc2)ccc1F	763491834	PQPIORNGJLNGLG-UHFFFAOYSA-N	435.415	1.802	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cccc(Cl)c2F)cc(OC)c1OC	763539383	LGPLSTPDZLSEJD-UHFFFAOYSA-N	425.800	1.905	50	20	IDGD	
CCN1CCC(n2nccc2NC(=O)C(=O)NNC(=O)COc2cc(C)cc(C)c2)CC1	763651242	YSPQPQJXHOUVJZ-UHFFFAOYSA-N	442.520	1.322	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(NC(=O)C3CC3)cc2)cc1	763658766	BLARZQBABVMJLI-UHFFFAOYSA-N	426.429	1.209	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2cc(C(F)(F)F)cnc2O)c1	763668086	HZFWGBQJDDOBQM-UHFFFAOYSA-N	426.351	1.588	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2cccc(CSC)c2)c2ccccc2c1=O	763785034	BHAHEQROQXKFDT-UHFFFAOYSA-N	439.497	1.679	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)C(=O)Nc1cc2c(cc1[N+](=O)[O-])OCCCO2	763838013	LBFRUVZUNHQIQV-UHFFFAOYSA-N	448.363	1.060	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccn(Cc2ccncc2)n1	763864435	JEXXXYALMINDDW-ZDUSSCGKSA-N	426.408	1.019	50	20	IDGD	
Cc1nn(C)c(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(Br)c2)c1C	763881313	CEKKCBVEQCDTFS-LLVKDONJSA-N	438.282	1.353	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)C(=O)Nc2cc3c(cc2F)CCC(=O)N3)cc1	763896680	RGOZSLWAQZJVKP-UHFFFAOYSA-N	430.461	1.897	50	20	IDGD	
CN1C(=O)COc2ccc(NC(=O)C(=O)NNC(=O)c3cc(-c4ccccc4)on3)cc21	764003781	OCZIVKOLICVBKC-UHFFFAOYSA-N	435.396	1.097	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1ccc(OCCN(C)C)cc1	764012581	SOWHGFMHKVPJLZ-UHFFFAOYSA-N	434.880	1.689	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)on1)C(=O)Nc1cccc(Cn2cccn2)c1	764016877	PGIXWQOZCPOCLS-UHFFFAOYSA-N	430.424	1.986	50	20	IDGD	
O=C(CN1CCCCCC1)Nc1cccc(NC(=O)C(=O)NNC(=O)C2CCCC2)c1	764064687	OAZOCTXBYLEDEW-UHFFFAOYSA-N	429.521	1.777	50	20	IDGD	
CN(C)CC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccc3ccccc3c2)cc1	764092479	VSFCHXZCDZIJRR-UHFFFAOYSA-N	447.495	1.669	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)nc1)C(=O)Nc1cccn(Cc2ccccc2)c1=O	764098493	OQQDRFITISHGCN-UHFFFAOYSA-N	425.832	1.345	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2scc(C(=O)OC)c2C)o1	764138148	DCEVNMQUZQSOSS-UHFFFAOYSA-N	436.490	1.678	50	20	IDGD	
O=C(NNC(=O)c1ccoc1)C(=O)Nc1cc(Br)ccc1N1CCOCC1	764163649	LJBUYZKCBDHDHN-UHFFFAOYSA-N	437.250	1.278	50	20	IDGD	
COc1cc(Br)cc(NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)c1	764167598	LCPPEWULENKYSH-OAHLLOKOSA-N	434.246	1.547	50	20	IDGD	
CC(C)CCC(=O)NNC(=O)C(=O)Nc1cccc(S(=O)(=O)/N=C2/CCCN2C)c1	764203243	REEAJLNOTZHJPD-KQWNVCNZSA-N	437.522	1.022	50	20	IDGD	
N#CCCSc1ccc(C(F)(F)F)cc1NC(=O)C(=O)NNC(=O)Cc1cc[nH]n1	764292952	JDKHAJFKGXSIMU-UHFFFAOYSA-N	440.407	1.763	50	20	IDGD	
O=C(NNC(=O)c1cc2ccccc2o1)C(=O)Nc1ccc(F)c(-n2nnnc2C2CC2)c1	764331130	NDZBUABALIAMMX-UHFFFAOYSA-N	449.402	1.825	50	20	IDGD	
COC(=O)c1c(F)cccc1NC(=O)C(=O)NNC(=O)c1cnn(-c2ccccc2)c1	764351653	UCIBGTACDUQMIL-UHFFFAOYSA-N	425.376	1.198	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)C(=O)Nc1cccc(NC(=O)c2ccncc2)c1	764365990	ISRIOAQBSZQTDK-UHFFFAOYSA-N	447.451	1.637	50	20	IDGD	
COC(=O)c1c(NC(=O)C(=O)NNC(=O)COCc2ccccc2)sc2c1CCCC2	764368065	UMAVICAWWDAKCX-UHFFFAOYSA-N	445.497	1.716	50	20	IDGD	
CO[C@H]1Cc2ccc(NC(=O)C(=O)NNC(=O)c3cc(-c4ccc(F)cc4)[nH]n3)cc2C1	764389056	XOETXOFAVMWUSK-KRWDZBQOSA-N	437.431	1.729	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1	764398171	DTUDXJHVNKTHSD-AWEZNQCLSA-N	426.429	1.488	50	20	IDGD	
O=C(Cc1ccccc1[N+](=O)[O-])NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	765757320	CBWXZKBOSYYYMI-UHFFFAOYSA-N	445.907	1.756	50	20	IDGD	
Cc1cc(N2CC[C@@H](NC(=O)NNC(=O)Cc3ccncc3)C2=O)ccc1Br	765914735	DUYYVHYPYXFZEL-MRXNPFEDSA-N	446.305	1.831	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1ncoc1-c1ccccc1	766640969	CNHFURSERQCBHP-UHFFFAOYSA-N	433.468	1.561	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)cc1C1CC1	766668529	KNUGYLUMZGQPOO-UHFFFAOYSA-N	430.940	1.530	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)CN1CCCN(C(=O)c2ccccc2F)CC1	766848913	OLDCTOTVAKTKJS-UHFFFAOYSA-N	426.492	1.672	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)[C@@H](NC(=O)c1ccco1)c1ccccc1	767267636	OMLYZIHAMLVSQI-QFIPXVFZSA-N	449.463	1.992	50	20	IDGD	
C[C@](O)(C1CCN(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)CC1)C(F)(F)F	767299794	XSOLPPXZNPDTLL-INIZCTEOSA-N	427.387	1.042	50	20	IDGD	
COc1ccc(C(C)(C)C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1	767634918	WCRAJLLWGLKNRB-GOSISDBHSA-N	428.441	1.503	50	20	IDGD	
CCc1nn(C)c(Cl)c1C(=O)NNC(=O)CN1CCN(Cc2ccc(C)cc2)CC1	767739243	HOMFKYGLMYWIGX-UHFFFAOYSA-N	432.956	1.523	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N2CCN(S(=O)(=O)CBr)CC2)c(C)c1	767851239	POELPLMLMBRYCH-UHFFFAOYSA-N	441.369	1.382	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3cc4c(cc3O)OCO4)n[nH]2)cc1OC	768278347	ZRLVNZCAZCNXMN-UHFFFAOYSA-N	426.385	1.603	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)Cc1ccc(S(=O)(=O)C(C)C)cc1	768639750	VNDAREYDKWQXSG-UHFFFAOYSA-N	440.543	1.967	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)[C@H](C(C)C)N1C(=O)c2ccccc2C1=O	768640771	NIYDOPNMLFQMJG-SFHVURJKSA-N	445.497	1.863	50	20	IDGD	
COc1ccc(Br)c(CC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c1	768897771	DJWPKSAGKBAGLK-UHFFFAOYSA-N	445.273	1.708	50	20	IDGD	
O=C(NNC(=O)[C@H]1CC(=O)N(c2cccc3ccccc23)C1)c1ccc(-n2cnnn2)cc1	769596764	JXTAZPJEHUDYHU-KRWDZBQOSA-N	441.451	1.630	50	20	IDGD	
Cc1cc2c(N3CCC[C@@H]3C(=O)OCC(=O)NNC(=O)c3ccccc3)ncnc2s1	770184070	OXWSDDNINYBFOV-MRXNPFEDSA-N	439.497	1.973	50	20	IDGD	
COc1cccc(NC(=O)C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c1F	770774702	RQDAVRGMKWZTAF-UHFFFAOYSA-N	443.479	1.133	50	20	IDGD	
N#C/C(=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)N[C@@H](CO)C1CC1	771046480	PAJHOYQOXBJZAF-YHTSIIMFSA-N	427.892	1.873	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)CN2C(=O)N[C@](C)(c3ccc(Br)cc3)C2=O)n1	771244997	LJIGEOUGFAVEQZ-GOSISDBHSA-N	447.293	1.766	50	20	IDGD	
COc1ccc(C)cc1[C@]1(C)NC(=O)N(CC(=O)NNC(=O)c2ccc(C#N)cc2)C1=O	771258646	XWWDBOXKQULLNT-QFIPXVFZSA-N	435.440	1.104	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)N[C@@H]1CC(=O)N(c2c(F)cccc2F)C1	771436200	UWFVBHGHZXYFTR-CYBMUJFWSA-N	448.426	1.878	50	20	IDGD	
CC(=O)c1ccc(Cl)c(S(=O)(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)c1	771606908	ZEGXFLVBEVLXID-UHFFFAOYSA-N	444.296	1.822	50	20	IDGD	
CC[C@H](C)NS(=O)(=O)c1ccc(C(=O)O[C@@H](C)C(=O)NNC(=O)CC(C)C)cc1	771933656	XEBTUXRRPBLJQA-KBPBESRZSA-N	427.523	1.502	50	20	IDGD	
CCS(=O)(=O)N[C@H](CCSC)C(=O)NNC(=O)[C@@H](C)Oc1cccc(Cl)c1	772964964	AEDWJVZMMXESQY-BXUZGUMPSA-N	437.971	1.316	50	20	IDGD	
O=C(NNc1ccccc1[N+](=O)[O-])C(=O)Nc1ccc(S(=O)(=O)C[C@@H]2CCCO2)cc1	773651023	MOFQCDHMTUJHIG-AWEZNQCLSA-N	448.457	1.629	50	20	IDGD	
Cc1oc2ncn(C)c(=O)c2c1C(=O)NNC(=O)[C@H]1CCCN(C(=O)OC(C)(C)C)C1	774271001	KRCMJAHYARYJBQ-LBPRGKRZSA-N	433.465	1.243	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)NCc3ccc(S(N)(=O)=O)c(C)c3)n[nH]2)cc1	775226673	UHBMEQIZYAUHBC-UHFFFAOYSA-N	442.501	1.485	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)Nc2nccs2)cc1)[C@H]1CCCCS1(=O)=O	776166311	XAUXLOJCCXAJKX-CYBMUJFWSA-N	430.533	1.354	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)Nc2nccs2)cc1)[C@@H]1CCCCS1(=O)=O	776166312	XAUXLOJCCXAJKX-ZDUSSCGKSA-N	430.533	1.354	50	20	IDGD	
Cc1ccc(S(=O)(=O)C[C@H](C)NC(=O)NNc2cccc(S(C)(=O)=O)c2)cc1	776196852	VOWBWAWPNCBCKJ-AWEZNQCLSA-N	425.532	1.887	50	20	IDGD	
CCC(=O)N[C@H](CCSC)C(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776202003	OQJBZEDEKAPYMC-CQSZACIVSA-N	445.586	1.270	50	20	IDGD	
CCOC(=O)[C@@H](C)NC(=O)c1ccc(NC(=O)NNc2cccc(S(C)(=O)=O)c2)cc1	776473197	GSPFZBUZKAEFAZ-CYBMUJFWSA-N	448.501	1.920	50	20	IDGD	
COc1cccc([C@H]2[C@H](C(=O)NNc3nc(O)c4cnn(C)c4n3)CC(=O)N2C2CC2)c1	776475201	DEUPFRBMPBLREL-PBHICJAKSA-N	437.460	1.273	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)N1CCN(S(=O)(=O)CBr)CC1	777777856	QGPLVBRNMQMZOR-NSHDSACASA-N	425.732	1.934	50	20	IDGD	
CN(NC(=O)c1cc(S(=O)(=O)NCc2ccccn2)c(Cl)cc1Cl)C(N)=O	778417136	NPKAPONKXFPTOI-UHFFFAOYSA-N	432.289	1.522	50	20	IDGD	
O=C(NNC(=O)N1CCC2(CC1)OCCc1ccsc12)c1ccc(-n2cnnn2)cc1	778589804	VGUOVVSSUAIJOE-UHFFFAOYSA-N	439.501	1.642	50	20	IDGD	
COc1ccc(Cn2ccc(NC(=O)C(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)n2)cc1	778705487	CESSUBMTKAEEST-UHFFFAOYSA-N	438.400	1.248	50	20	IDGD	
O=C(C[C@@H](O)c1ccc(OCc2ccccc2)cc1)NNC(=O)C(=O)Nc1ccccn1	780966327	CIQUIVUSIVLNBD-LJQANCHMSA-N	434.452	1.870	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)[C@@H]2C[C@@]23CCN(C(=O)OC(C)(C)C)C3)cc1	781285851	RSTBFSBHPKQRSM-KSFYIVLOSA-N	431.489	1.946	50	20	IDGD	
COC(=O)c1cc(Cl)ccc1NC(=O)C(=O)NNC(=O)Cc1nc2ccccc2n1C	782895237	XXGBRLXCVMAAER-UHFFFAOYSA-N	443.847	1.342	50	20	IDGD	
CCN1CCN(c2cccc(NC(=O)C(=O)NN=c3sc4ccccc4n3C)c2)CC1	783352007	SKHJDQJTNIRXOW-UHFFFAOYSA-N	438.557	1.952	50	20	IDGD	
COC[C@H](C)n1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)n1	783409764	VFRGJFCHVQSUFM-JTQLQIEISA-N	449.411	1.466	50	20	IDGD	
COc1ccc(OC(C)C)c(NC(=O)C(=O)NNC(=O)CNC(=O)c2cccs2)c1	784003986	RZRAYMMEBRMDHP-UHFFFAOYSA-N	434.474	1.060	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)CCC(=O)Nc2nnc(C(C)C)s2)c1	784189437	SWXYLVHWTNNITR-UHFFFAOYSA-N	433.490	1.693	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)cnn1CC(C)C	784210136	DVAACHVGUIGFAP-UHFFFAOYSA-N	434.522	1.370	50	20	IDGD	
CN(C)c1nccc(NNC(=O)C(=O)Nc2cccc(CNC(=O)OC(C)(C)C)c2)n1	784970479	HZWCLGMYLCKWQM-UHFFFAOYSA-N	429.481	1.649	50	20	IDGD	
COC(=O)[C@@H](C)Cc1ccc(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)cc1	785067286	JMZLWVJFGNXBNW-AWEZNQCLSA-N	437.456	1.015	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NN(C)c2ccccc2)cc1S(=O)(=O)N1CCCC1	787560120	KZQUIQVJBARZPE-UHFFFAOYSA-N	432.502	1.586	50	20	IDGD	
CC1CCN(S(=O)(=O)c2ccc(C(=O)NNc3ccc(-n4ccnc4)nn3)cc2)CC1	788177608	HLYYAXGOMVUOLA-UHFFFAOYSA-N	441.517	1.840	50	20	IDGD	
COc1ccc(OC)c([C@@H]2C[C@@H]2C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c1	788203408	XRJSKJPNQIVAOI-RDJZCZTQSA-N	443.412	1.720	50	20	IDGD	
O=C(CCS(=O)(=O)c1ccc2c(c1)OCCO2)NNc1nnc(-c2ccccn2)s1	788558647	SHMGMNDVHMUONJ-UHFFFAOYSA-N	447.498	1.678	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)N[C@@H]1CCCN(c2ccc(Cl)cc2Cl)C1=O	788917287	UVCSPXHELSERCM-SMDDNHRTSA-N	447.319	1.871	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cc([C@H]3CCCO3)nn2C)cc1	789741671	YJHPCAATWFYVGZ-CXAGYDPISA-N	445.476	1.224	50	20	IDGD	
O=C(NNC(=O)N1CCC[C@@H](N2CCCS2(=O)=O)C1)c1cccc(OC(F)F)c1	789840057	RFPLNJQKQYKBPV-CYBMUJFWSA-N	432.449	1.142	50	20	IDGD	
COC(=O)[C@]1(c2ccccc2)CCN(CC(=O)NNC(=O)c2cc(Cl)ccc2OC)C1	794806828	GUTOWHZZYPKDSI-JOCHJYFZSA-N	445.903	1.926	50	20	IDGD	
CCOC(=O)c1ccc(OC)c(S(=O)(=O)NNC(=O)c2cc(OC)cc(OC)c2)c1	795281027	WYOUNIHSTLLHDJ-UHFFFAOYSA-N	438.458	1.512	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)c1	796386612	XNRJQLYSTIHEAO-HSZRJFAPSA-N	446.555	1.211	50	20	IDGD	
CCNC(=O)N(C)c1cccc(NC(=O)C(=O)NNC(=O)c2cccc3cccnc23)c1	797000336	BRCJKCIBPXVSID-UHFFFAOYSA-N	434.456	1.800	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1)Nc1ccc2c(c1)OCO2	802096500	SJPOKOFNKJCKQJ-LLVKDONJSA-N	447.429	1.843	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccc(F)c(N2CCCNC2=O)c1	806975196	QLDYEGAUBMSTHX-UHFFFAOYSA-N	447.398	1.049	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)C(=O)Nc1nc2c(s1)CSCC2	806979575	AISBRSKRQMFWFO-UHFFFAOYSA-N	428.499	1.518	50	20	IDGD	
O=C1COC[C@H](C[C@H]2CN(C(=O)C(=O)NNc3cnc4ccccc4n3)c3ccccc32)N1	806984062	LLZRIFVEPCOLDH-GJZGRUSLSA-N	446.467	1.108	50	20	IDGD	
COc1cc(OC)c(OC)cc1CNC(=O)NNC(=O)Cc1nc2ccccc2n1C	807118563	IHPYMXPHCDFFQD-UHFFFAOYSA-N	427.461	1.672	50	20	IDGD	
NC(=O)c1ccc(NC(=O)C(=O)NNc2cnc3ccccc3n2)c(OCC(F)F)c1	810388282	UEINWHPMOJHQMJ-UHFFFAOYSA-N	430.371	1.454	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)NCC(=O)NNc2ncccc2C(F)(F)F)cc1	810426382	IZQVBBDNHLBKQN-UHFFFAOYSA-N	446.407	1.699	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cn(C)nc2C2CC2)cc1OC	812978683	ATFRRSUHNYUUAI-UHFFFAOYSA-N	429.477	1.885	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)N[C@@H]1CC(=O)N(c2ccccc2F)C1	813236766	QPEIEOLCIFOETH-GFCCVEGCSA-N	431.380	1.249	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2ccc(OC(F)F)c(F)c2)ccc1Cl	814736775	RZERCCCSOGWQGD-UHFFFAOYSA-N	437.783	1.803	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1cc(OC)c(C)c(OC)c1	815571171	WZKWSNSGAHSJAS-UHFFFAOYSA-N	433.486	1.899	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1nc(C(C)(C)C)ns1	815750653	GXDLLHRMUWCAIE-UHFFFAOYSA-N	426.524	1.168	50	20	IDGD	
N#CSCCCNC(=O)C1CCN(S(=O)(=O)c2ccc3c(c2)OCCCO3)CC1	816539542	KNFSPELEORPFAO-UHFFFAOYSA-N	439.559	1.969	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)c1cc([N+](=O)[O-])ncc1Br	817050943	DCJYPADQRQBIGW-UHFFFAOYSA-N	444.267	1.760	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCCC3)cc2)c1	825786267	MVWPGNXEKWECOO-UHFFFAOYSA-N	446.529	1.743	50	20	IDGD	
O=C(c1ccc(NS(=O)(=O)c2ccc(F)c(Cl)c2)cc1)N1CC[C@@H](B(O)O)C1	864234204	OHZMDDMEIWGCKH-GFCCVEGCSA-N	426.662	1.969	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)/C=C\c2ccc3c(c2)OCO3)c1	912643029	IGVYXCGCBYNLTF-LUAWRHEFSA-N	445.497	1.920	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CNS(=O)(=O)c2ccc(C#N)cc2)ccc1OC(C)C	913153620	JNWBKPNJRVQSMU-UHFFFAOYSA-N	446.485	1.094	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)CCNS(=O)(=O)c1cccnc1	914612731	MNKRESAKSVPEGE-OAHLLOKOSA-N	442.497	1.518	50	20	IDGD	
COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)cc1	915141155	HKYPKZJFCVTACX-GFCCVEGCSA-N	449.441	1.591	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)c2cc(S(N)(=O)=O)ccc2Br)cc1	915782987	GLGZXFNKBPGLSR-UHFFFAOYSA-N	426.292	1.734	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2ccc(S(=O)(=O)C(C)C)cc2)c2ccccc2c1=O	916092134	ZGAPVBBOPDIZKX-UHFFFAOYSA-N	442.497	1.673	50	20	IDGD	
Cc1ccc([C@H](CNC(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)N2CCOCC2)o1	916228449	BYCXQGZSRAYYCP-SFHVURJKSA-N	443.504	1.547	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCN(C(=O)c3ccc(C)c(F)c3)CC2)n1	917154955	COXVAKBTTMHHPO-UHFFFAOYSA-N	433.509	1.047	50	20	IDGD	
Cc1ccc(-n2nnc(C(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)c2C)cc1	917574529	MUDDBUPMFLFVPE-UHFFFAOYSA-N	442.501	1.209	50	20	IDGD	
C[C@H](COc1ccccc1)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	918090086	ZRAVXUNIGGTPGJ-MRXNPFEDSA-N	446.529	1.883	50	20	IDGD	
CCN(CCCNC(=O)NNC(=O)c1ccc(COc2ccccc2)o1)S(C)(=O)=O	918118865	IWWKVUHEYNLBJW-UHFFFAOYSA-N	438.506	1.474	50	20	IDGD	
COc1cc(N2C[C@@H](C(=O)NNC(=O)c3ccc(C)cc3O)CC2=O)cc(OC)c1OC	918339395	NDLAKDCRCKUYSF-ZDUSSCGKSA-N	443.456	1.541	50	20	IDGD	
COc1ccc(-n2cnnc2SCC(=O)NNC(=O)Cc2ccccc2OC)cc1	920006220	BOJGHCAVPDTPLN-UHFFFAOYSA-N	427.486	1.767	50	20	IDGD	
CCCCC(=O)NNC(=O)C[C@H]1c2cc(OC)c(OC)cc2CCN1S(C)(=O)=O	920596068	DVTVPIWBTHIEPI-HNNXBMFYSA-N	427.523	1.290	50	20	IDGD	
Cc1ccc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)CN3CCCC3=O)cc2)cc1C	920826327	LFXDXSXVOJXTFJ-UHFFFAOYSA-N	444.513	1.488	50	20	IDGD	
COC(=O)c1ccc(Br)c(S(=O)(=O)NNC(=O)NCc2ccco2)c1	920832152	CQPBHXLQRGKYKL-UHFFFAOYSA-N	432.252	1.521	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2ccc(C(=O)NNC(=O)NCc3ccco3)cc2)C[C@@H](C)O1	920857421	JVPQZIAZRMSEBK-OKILXGFUSA-N	436.490	1.222	50	20	IDGD	
CC(C)CNS(=O)(=O)c1ccc(Br)c(C(=O)NNC(=O)NCC2CC2)c1	920860142	DMUVTWNCAUDFOH-UHFFFAOYSA-N	447.355	1.737	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2cc(C)nn2C(C)(C)C)cc1	920931098	BOOLBBDWYPWAQT-UHFFFAOYSA-N	436.538	1.728	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)Nc2cccc(CN3C(=O)CNC3=O)c2)cc1	920931813	DIRFNSKQLYJELG-UHFFFAOYSA-N	427.486	1.992	50	20	IDGD	
O=C1CCc2cc(-c3csc(NC(=O)NNC(=O)[C@@H]4CCS(=O)(=O)C4)n3)ccc2N1	920933174	RJTCJVBFJXUKAO-GFCCVEGCSA-N	449.514	1.282	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cn4ncccc4n3)C2)C1	1777950962	RISZPWITUDKLLD-SCLBCKFNSA-N	436.310	1.204	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cccn3c(O)nnc23)C1	1777958702	NFMOQZXBMNJPKX-STXHMFSFSA-N	435.912	1.580	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Cl)C1	1778027198	DQVRVSUORLANMP-ZXYWRSMDSA-N	435.924	1.950	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CN2CCN(C)CC2)C1	1778846643	ZTESTPDOMWOOPR-DBXWQHBBSA-N	429.005	1.155	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)/C=C3\C(=O)Nc4ccccc43)C2)C1	1778910079	ZUKQCIDMWDXDEF-MQWXRXCUSA-N	433.892	1.106	50	20	IDGD	
O=C(c1cnc(Cl)s1)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1779727801	HQCYZWIBDVOISC-ZANVPECISA-N	426.695	1.931	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Cl)C2)c1cnc2snnc2c1	1780042755	KSNMUAOWXOQZMM-IIYDPXPESA-N	427.889	1.748	50	20	IDGD	
COc1ccnc(C(=O)N2CC[C@@]3(CN(C(=O)CCBr)CCO3)C2)c1OC	1780447003	ZZXQIIIEXXTSIL-GOSISDBHSA-N	442.310	1.327	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)Cc3ccc(C(=O)OC)s3)C2)C1	1780900279	OIKHCZTXXWDSNB-KUHUBIRLSA-N	428.938	1.925	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)Cc3cn4nc(C)sc4n3)CCO2)C1	1781214657	BALIQTVOQABNDJ-RDTXWAMCSA-N	425.942	1.489	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(Cl)c4nncn4c3)CCO2)C1	1781222149	WYNHBYFPCVOQCW-ACJLOTCBSA-N	426.304	1.844	50	20	IDGD	
O=C(Cc1cccc([N+](=O)[O-])c1)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781324644	BHEDMOINGISWJK-RDJZCZTQSA-N	444.257	1.658	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H]1CCCN(C)C1)C2	1782003948	ZCUYCIBBPXXEAQ-YYAJDYIMSA-N	430.387	1.626	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnnc(Cl)c1)C2	1782171134	PIOZWYPQDRFYHN-HBUWYVDXSA-N	431.320	1.511	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C13CCC(CC1)CC3)C2	1782214236	MFJUWKQPCSQDJH-BLWHJXEHSA-N	448.608	1.844	50	20	IDGD	
Cc1c(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)nc2ccc(Cl)cn12	1782493691	VHSYSLFLGUROEU-AUUYWEPGSA-N	441.315	1.339	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cnc(Cl)nc3)CCO2)C1	1783338302	GFCOCDGPHLMOOS-MLGOLLRUSA-N	431.718	1.747	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cnn4ccccc34)CCO2)C1	1783347562	LBUSNFQMGUXOTI-BEFAXECRSA-N	435.322	1.951	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccn(C(C)(C)C)n3)CCO2)C1	1783531715	BURJPVKHFHQNMP-UGSOOPFHSA-N	427.343	1.865	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)[C@@H](C)CNC(=O)OC(C)(C)C)CCO2)C1	1783870457	CGXFPGIMTPMYLG-AUSJPIAWSA-N	447.960	1.231	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)C1(NC(=O)OC(C)(C)C)CC1)CCO2	1783884002	NIWLHXOSZXUPFZ-LIRRHRJNSA-N	445.944	1.127	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H]1C(=O)N1CCO[C@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783941527	DUBBYPXFNLUOBE-XIKOKIGWSA-N	436.336	1.629	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3c(F)cncc3F)C[C@@H]21	1783969345	GMPLAJLGBJYLHA-YXMPFFBPSA-N	446.292	1.984	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ncccc3F)C[C@@H]21	1783969700	JOPYTXGIVCMOSA-OSFYFWSMSA-N	428.302	1.845	50	20	IDGD	
O=C(Cc1ccc(Br)cn1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21	1785384136	FNJKIOVOAHUZQF-CFMVVWHZSA-N	448.720	1.901	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnnc(Cl)c3)[C@H]2C1	1785446892	PNHKVUKJEYZYKS-IMIFBBOLSA-N	445.745	1.754	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC1(c2ccc(NC(=O)[C@H]3CCCCN3C)cc2)CCC1	1786147873	HBZUDKQATUUKHO-LJQANCHMSA-N	429.565	1.978	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)c1cnn2cccnc12	1788293974	TYFHPSSJOBSKSD-DOERSZECSA-N	440.273	1.013	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4ncncc4c3)[C@H]2C1	1788379845	WIMCHHXVVVYQFA-RMRDIRSESA-N	432.908	1.477	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3c(C)n[nH]c3C)[C@H]2C1	1788820024	TVAXZHQCLWYQGB-XQLPTFJDSA-N	427.343	1.793	50	20	IDGD	
Cc1cc(C)cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]32)c1	1789569630	KTLJYBJLFGNFRJ-IHPCNDPISA-N	430.549	1.270	50	20	IDGD	
C=C(CC(=O)OCC)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)Br)C[C@@H]21	1789891906	WKWSIHCSUPYFOH-AJNGGQMLSA-N	431.327	1.259	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]3C2)ccc1O	1789923565	UXXLUXJGBGXPLP-SDADXPQNSA-N	429.286	1.984	50	20	IDGD	
C[C@H](O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](Br)Cc3ccccc3)C[C@@H]21	1791053856	UWSTVIHTIHMTRD-HILJTLORSA-N	439.350	1.353	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc4c3cnn4C)C[C@@H]21	1791055697	FCAIWHICCBMZMD-IHHFWDAISA-N	449.349	1.950	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3cc(F)ccc3OC)[C@H]2C1	1791378620	QQTJCXUFVKXIJW-UHEFJODHSA-N	442.915	1.610	50	20	IDGD	
Cc1nc(CC(=O)NC2(c3ccc(NC(=O)CCC(=O)NN(C)C)cc3)CCC2)no1	1791600119	ZOHRBSOBHLQVFC-UHFFFAOYSA-N	428.493	1.428	50	20	IDGD	
O=C(CCc1cnccn1)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1	1791895870	HIDSTYDOFAIBNF-UHFFFAOYSA-N	444.300	1.537	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC1(c2ccc(NC(=O)/C=C/c3cnccn3)cc2)CCC1	1791927043	OVQLCFUROHXPJZ-CMDGGOBGSA-N	436.516	1.997	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C#Cc1ccc(Cl)cc1	1792837341	HLDYUUAUXMTBBM-HIRMHNASSA-N	425.312	1.535	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1[C@@H]3CCC[C@H]1c1ccccc1N3)C2)[C@H](O)CCl	1792976321	CCVIDQFGBAZKHV-XJAUGPLOSA-N	447.963	1.554	50	20	IDGD	
COc1ccc(-c2cc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)[C@H](O)CCl)n[nH]2)cc1	1793112654	SXZUGHNORQSQNE-NXEZDXNNSA-N	432.908	1.937	50	20	IDGD	
CCC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Cl	1796370714	LCUIHWZIYRMKHT-KHMAMNHCSA-N	435.924	1.804	50	20	IDGD	
COc1ccc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Cl)c(OC)c1	1796370948	RWYYUHYIFIEDAQ-FTUNRGFVSA-N	428.888	1.760	50	20	IDGD	
Cc1nc2ncccn2c1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)Br)C2	1797006274	NRIBXQMFMUNHBA-DEQVHRJGSA-N	436.310	1.024	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnc2cc(C)ccn2c1=O	1797068059	SPNKGSPFZXBCEI-CXHZTBPHSA-N	432.908	1.224	50	20	IDGD	
CC(C)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1ON=C(c2ccccc2)O1	1797640591	VRIKOYMITMQSIL-YYAJDYIMSA-N	435.908	1.576	50	20	IDGD	
CCCCC[C@@H](C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnccc1C(=O)NN	1797753608	ACDHBRGOOMYVGW-OAFZBRQQSA-N	431.537	1.105	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cc1ccccc1Cl)C2	1798439173	LCRPEXGMTDCLQR-MUJYYYPQSA-N	441.919	1.833	50	20	IDGD	
CCc1ncsc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnccc1C(=O)NN	1798439735	ATSNRGBGIWUNBZ-CLLJXQQHSA-N	428.518	1.270	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc3ncsc3[nH]1)C2	1798440045	WABDNAUWBSUGMF-ZSBIGDGJSA-N	439.501	1.189	50	20	IDGD	
C=CCC[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2	1799321513	CYJQJDMUNLGFSR-JKJDWNRSSA-N	447.935	1.970	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)Br)C2	1800644142	KBAGCEZIDCMTSH-HGCLJGPKSA-N	426.149	1.533	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3nccnc3c1)C2	1800756863	FKOUPPWMHPVDJZ-DPYKFYPSSA-N	433.306	1.616	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(Cl)c1OC)C2	1800982805	LRKAMTDUHGKKFR-VZAMPYOESA-N	431.316	1.806	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)Br)C3)cc1	1801785086	MCDMIUKGBZZBBD-RMIITELYSA-N	438.322	1.632	50	20	IDGD	
COc1ccc(COCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CCC(=O)NN(C)C)cc1	1802339635	CWZJREFBAMUVDM-REPLKXPHSA-N	446.548	1.223	50	20	IDGD	
CCNC(=S)NCC(=O)N1CC[C@H](CNC(=O)C(C)(C)CCl)[C@@H]1c1cccnc1	1802904907	PANOGQPYJHOJGG-WBVHZDCISA-N	440.013	1.836	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H](CNC(=O)[C@H](C)CC(N)=O)[C@@H]1c1cccnc1	1803671845	NNIVUEYMJVNNBQ-UTXMOHQDSA-N	439.354	1.772	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1803694360	HWTXZFQOVNAJKE-UWVAXJGDSA-N	437.972	1.868	50	20	IDGD	
Cc1nocc1C(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1805828788	QWLNRFYHZAEGJG-OXQOHEQNSA-N	428.493	1.071	50	20	IDGD	
CSCC(C)(C)C(=O)N1CCCC2(CCN(C(=O)CCC(=O)NN(C)C)CC2)C1	1806098006	DDVSKLZVCRBIAA-UHFFFAOYSA-N	426.627	1.980	50	20	IDGD	
COCCOCC(=O)N1CC[C@@H](CNC(=O)CCBr)[C@H]1c1cccnc1	1806340649	ITFDOAAVNKXTGE-MAUKXSAKSA-N	428.327	1.535	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)c2ccc(O)cc2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1	1807374429	HIBLKQCHFHQICM-DENIHFKCSA-N	445.284	1.100	50	20	IDGD	
O=C(CCBr)N1CCC2(CCCN(C(=O)CCN3CCOCC3)C2)CC1	1809583670	WVDIDOCYJHQTQZ-UHFFFAOYSA-N	430.387	1.725	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)c1cnc2snnc2c1	1811342565	NEJORTNJPJNRFB-APHBMKBZSA-N	446.920	1.401	50	20	IDGD	
CCS(=O)(=O)CC(=O)N1CC[C@H](CNC(=O)[C@H](C)Br)[C@H]1c1cccnc1	1812863941	FCKOBMIJGFAYEE-JGGQBBKZSA-N	446.367	1.306	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)c2cc(O)ncn2)[C@@H]1c1cccnc1	1812865229	NAKZAEBRWMWEEO-DETPVDSQSA-N	434.294	1.680	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2cccs2)[C@H]1c1cccnc1	1813070300	GZSVGNQYVGQFAX-JXFKEZNVSA-N	429.546	1.836	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1CCc2nc(NC(=O)CS(C)(=O)=O)sc2C1	1814314722	JAJPZITZCKJGCK-DTWKUNHWSA-N	438.369	1.131	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2nc3ccc(F)cn3n2)[nH]n1)[C@@H](O)CCl	1814875044	MSNSECWPSZSMBJ-OLZOCXBDSA-N	435.847	1.497	50	20	IDGD	
C=CC(=O)N[C@@H](C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCBr)n[nH]1	1816782571	VGJZHBMAOXICLF-AAEUAGOBSA-N	426.315	1.878	50	20	IDGD	
C[Si](C)(C)OCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)CN1CCSCC1)CC2	1820158158	HGYTWUIGTJCTRH-CYBMUJFWSA-N	442.683	1.955	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3nccnc3C(N)=O)sc2C1	1821032479	MJSRPAMWJNZUJX-UWVGGRQHSA-N	436.925	1.665	50	20	IDGD	
Cn1ccc(=O)cc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](F)Br)CC2	1821314027	PSTJOBWFKTXGQG-SDBXPKJASA-N	443.298	1.758	50	20	IDGD	
O=C(COc1ccccc1F)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](O)CCl)CC2	1825455213	QAKURUUWNZFYAI-GXFFZTMASA-N	427.885	1.873	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(C(=O)O)ncn1)CC2	1825993026	DEWDTEMLXHFHKC-RKDXNWHRSA-N	439.881	1.111	50	20	IDGD	
Nc1n[nH]c(CCC(=O)N2CCC([C@@H]3CCCCN3C(=O)CCBr)CC2)n1	1826359307	XGKRKKHBVJELDD-AWEZNQCLSA-N	441.374	1.724	50	20	IDGD	
CC(C)(C)NCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1	1826858226	GHKMIMDEDHPAQY-IBGZPJMESA-N	444.580	1.307	50	20	IDGD	
CCc1[nH]nc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)c1Cl	1830357947	NPPFGZOMEZNERM-IBGZPJMESA-N	447.363	1.961	50	20	IDGD	
Cc1onc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)c1C	1830535565	QEYHSXBOUQGOML-SGTLLEGYSA-N	444.326	1.392	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)C(=O)c3ccc(Cl)cc3)CCO2)C1	1830688202	QUMQJPKDENIBGL-UZLBHIALSA-N	443.327	1.997	50	20	IDGD	
CC1CCN(CC(=O)N2CCO[C@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)CC1	1831093600	MLUXQAZBMLKFJT-OAQYLSRUSA-N	429.989	1.440	50	20	IDGD	
CC(C)[C@H](S)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1	1831494199	YWKYDRAELKKDQG-JQFCIGGWSA-N	427.394	1.634	50	20	IDGD	
CC(C)NCCC(=O)NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1	1834780680	PBYMCOSZDRFZMB-UHFFFAOYSA-N	431.419	1.731	50	20	IDGD	
CC(C)=NO[C@@H](C)C(=O)N1CCOC[C@@]2(CN(C(=O)CCBr)CCO2)C1	1834823629	ACWMXMJIHCVUHZ-WMLDXEAASA-N	434.331	1.029	50	20	IDGD	
COCc1c[nH]c(C(=O)N2CCOC[C@@]3(CN(C(=O)CCBr)CCO3)C2)c1	1834823962	ONTVNOJMTOVGMM-GOSISDBHSA-N	444.326	1.016	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cc4n(n3)CCCC4)CC2)CC1)[C@@H](F)Cl	1835080471	LRKVRZCGFCEBNJ-GOSISDBHSA-N	425.936	1.939	50	20	IDGD	
Cc1nc(N)sc1C(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836716531	AGTAIAFSKOVKLJ-CQSZACIVSA-N	430.958	1.246	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)[C@@H]3CCCN3C)CC2)CC1	1837003997	OLHNFCDCBIHMCK-PBHICJAKSA-N	430.387	1.863	50	20	IDGD	
CC[C@H](C(=O)N1CCOC[C@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1)N(CC)CC	1837710156	LNMKUTVNQRTQMN-NQIIRXRSSA-N	443.661	1.415	50	20	IDGD	
CCc1oncc1C(=O)N1CCOC[C@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1837712420	PVPGOOFUJNQAJD-IBGZPJMESA-N	425.558	1.159	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)ccc1O	1837714475	IAPKEEHTEZDFLV-NRFANRHFSA-N	436.581	1.622	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(OC2CCN(C(=O)C(C)(C)F)CC2)CC1	1837821816	AWPQSNFENOZYLZ-MFKUBSTISA-N	449.527	1.867	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccnc4c3OCO4)CCO2)C1	1838474816	PHRYDUPLURXFQJ-HXUWFJFHSA-N	439.896	1.145	50	20	IDGD	
CC(C)n1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)n1	1838787277	NGQHYMCYRFBFRZ-FQEVSTJZSA-N	438.601	1.386	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(O)c([N+](=O)[O-])c3)C2)C1	1839147508	SWLNDFGXORXMTG-KUHUBIRLSA-N	441.868	1.388	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3ncc[nH]3)C2)C1	1839154903	BEKCDAXUMAGJOM-QZTJIDSGSA-N	433.336	1.035	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(O)c(F)c1)CCO2	1839304777	ZWXUWOUIUHFVTO-HXUWFJFHSA-N	440.544	1.453	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(F)(F)c1ccco1)CCO2	1839691933	UPLFVQHYBXPLEA-GUYCJALGSA-N	436.839	1.082	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ncc(F)cc3F)C2)C1	1840030548	PAIZBZZFVZSKAI-PIGZYNQJSA-N	448.264	1.213	50	20	IDGD	
Cc1noc(C)c1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2	1840031654	YHKHAGRLIQOIMR-DIFFPNOSSA-N	430.299	1.145	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(Cl)ccn3)C2)C1	1840153323	KDYJSVBTWHNYHY-KSSFIOAISA-N	432.304	1.059	50	20	IDGD	
CN(C)c1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)cc1	1840189405	PMDKSRYKJSSGSD-IBGZPJMESA-N	430.332	1.626	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)c1	1840190149	HMQIGLXELGHMKR-IBGZPJMESA-N	444.315	1.519	50	20	IDGD	
COc1cc(Cl)cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)c1	1840740265	BXNLFPSXBRMLTR-QFBILLFUSA-N	447.315	1.018	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2c(F)ccnc2Cl)C1	1842139315	WDXLAZRJJJFZOD-UHFFFAOYSA-N	432.843	1.003	50	20	IDGD	
O=C(c1cccc(-c2ccccc2)n1)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843013738	HKKOQSWZJSLAFT-UHFFFAOYSA-N	441.296	1.559	50	20	IDGD	
O=C([C@H]1C[C@H]1c1ccc(Cl)cc1)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843013945	HGEJYTXQGPOQNX-PMACEKPBSA-N	438.720	1.641	50	20	IDGD	
O=C(c1n[nH]c2c(Cl)cccc12)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843014580	BEHUMKKSIKNPDS-UHFFFAOYSA-N	438.680	1.027	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H](F)C[C@H]1C(=O)N1CCCC12CN(C(=O)[C@@H](O)CCl)C2	1843818786	VIFOMEQJZWRUBJ-RDBSUJKOSA-N	433.908	1.137	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)[C@H]2C[C@H]2c2ccc(Cl)cc2)C1	1843872764	BBBKMFUCACVWKU-PMACEKPBSA-N	438.720	1.641	50	20	IDGD	
C[C@H](C(=O)N1CC2(CCCN2C(=O)/C(C#N)=C/c2ccc(F)cc2F)C1)n1cncn1	1845871934	GRQYIQFXTJVXGH-OUAKBRRNSA-N	426.427	1.928	50	20	IDGD	
O=C(c1cccc(I)c1)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl	1847565302	LLXWYZAFRCEYCS-IHRRRGAJSA-N	448.688	1.706	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)CNC(=O)NCc2ccc(F)cc2)cc1	105497514	IMVQHYSSDXIXCS-CQSZACIVSA-N	432.452	1.639	50	20	IDGD	
COCCCNC(=S)N(C)NC(=O)c1ccc(C)c(S(=O)(=O)N2CCCCC2)c1	726075758	FPCYVJZFAJBHPT-UHFFFAOYSA-N	442.607	1.657	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)c2ccc(-n3ncc(C#N)c3N)cc2)cc1	727241308	SIIKRDJRJFDIMU-CQSZACIVSA-N	434.456	1.953	50	20	IDGD	
CCOc1ccc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)c3ccn(C)n3)cc2)cc1	727363968	CTPWFLPONDEZLT-UHFFFAOYSA-N	443.485	1.694	50	20	IDGD	
CC(=NNC(=O)[C@@H](C)NS(C)(=O)=O)c1ccc(OCC(=O)Nc2ccccc2C)cc1	728436448	GGDHVVMWWBOAGE-MRXNPFEDSA-N	446.529	1.790	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Cc2cccnc2)cc1S(=O)(=O)NC1CCCC1	728856079	NIQXXUNYBYLJAY-UHFFFAOYSA-N	432.502	1.315	50	20	IDGD	
Cc1cc(-c2cc(C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)c3c(C)noc3n2)c(C)o1	729275680	QFXZWGNYNULSRI-SNVBAGLBSA-N	435.462	1.107	50	20	IDGD	
CC[C@@H](N=c1nn[nH]n1-c1ccccc1)C(=O)NNC(=O)CSc1ccc(Cl)cc1	729508751	LYRGSLHABBMLOQ-MRXNPFEDSA-N	445.936	1.868	50	20	IDGD	
CCc1ccc(-n2nc(C(=O)NNC(=O)N[C@@H]3CCS(=O)(=O)C3)c3c2CCC3)cc1	730774254	TZUOESIIFOCXRX-CQSZACIVSA-N	431.518	1.055	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)c2nn(-c3ccc(F)c(F)c3)c3c2CCC3)C[C@@H](C)O1	732259759	JSLWEGKZSWQQJU-ZIAGYGMSSA-N	447.486	1.900	50	20	IDGD	
COc1cc(C(=O)NCC(=O)NNc2ccccc2S(C)(=O)=O)ccc1OC(F)F	732303613	JDBJXHSIEWJVBJ-UHFFFAOYSA-N	443.428	1.573	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)NCCN1CCN(C(=O)C2CCCCC2)CC1	733349333	XYKLDADTFVCCOP-UHFFFAOYSA-N	431.537	1.364	50	20	IDGD	
CC(=O)[C@@H]1CC(C(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)=NN1c1ccccc1	733533048	GMAJKMJBGISQIF-SFHVURJKSA-N	442.859	1.868	50	20	IDGD	
CNc1snc(C)c1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	733785327	WCAXUVOZBQSZAN-UHFFFAOYSA-N	437.547	1.743	50	20	IDGD	
O=C(NNc1cnccn1)c1cccc(NS(=O)(=O)c2ccc3c(c2)OCCO3)c1	734245457	DVLYTDKHBGEYSB-UHFFFAOYSA-N	427.442	1.806	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)c2cnc3sccn3c2=O)CC1	734825844	OVPSLKVAJUAIGK-UHFFFAOYSA-N	436.494	1.100	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)Nc2ccn(CC(=O)N3CCOCC3)n2)c1C	735257332	QBYARHFRIBEZLC-CPNJWEJPSA-N	440.504	1.352	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)NC[C@@H](C)CN2CCOCC2)c1	739050278	WSDNMFUULDSGGG-GFCCVEGCSA-N	429.315	1.370	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(N2CCOC2=O)cc1)c1cc(Br)c[nH]1	740809625	FIJKBICKHDWEHQ-UHFFFAOYSA-N	429.252	1.357	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)CCNC(=O)c1cc(F)ccc1Br	740851287	XSFBJNPYEALQCM-UHFFFAOYSA-N	445.289	1.160	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCc2c[nH]nc2C1)c1nn(Cc2ccccc2)c(=O)c2ccccc12	742473390	CYHDMOPDLCPJKQ-MRXNPFEDSA-N	442.479	1.734	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNC(=O)CN2C(=O)[C@H]3[C@H](C2=O)[C@H]2CC[C@H]3O2)cc1	742474373	WUXROGWJADCOSS-PSBWJHGTSA-N	429.473	1.035	50	20	IDGD	
C[C@@H](CN1CCOCC1)C(=O)NN=Cc1ccc(OCC(=O)O)c(Br)c1	743431634	YCIAKFKRBWSTKP-LBPRGKRZSA-N	428.283	1.331	50	20	IDGD	
O=C(CN1C(=O)NC2(CCCCC2)C1=O)NNC(=O)Nc1ccc(OC(F)F)cc1	743833202	JYISXTGCOBVEOC-UHFFFAOYSA-N	425.392	1.695	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)COc2cccc(N3CCCC3=O)c2)c1	744525333	VQILIMBWHPMUIH-UHFFFAOYSA-N	425.441	1.505	50	20	IDGD	
CCc1ccccc1N1C[C@@H](C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)CC1=O	744546469	KZFWGPUCJIBPFH-SFHVURJKSA-N	434.452	1.478	50	20	IDGD	
C[C@H]1Oc2ccccc2O[C@@H]1C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	744620377	CITMHDRZUDNWQO-KUHUBIRLSA-N	433.486	1.379	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)N[C@H]2CCN(Cc3ccccc3)C2=O)cc1	744878515	ZCHMUIRNKMLRLB-UZLBHIALSA-N	440.500	1.984	50	20	IDGD	
C[C@H](CN1CCN(c2ccccc2)CC1)NC(=O)NNC(=O)c1cc([N+](=O)[O-])ccc1O	745837445	HZBCCDGPUBUGQZ-OAHLLOKOSA-N	442.476	1.455	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NC[C@H](C)Oc2ccc(F)cc2)c2ccccc2c1=O	745892468	ZIAMAKSZZGGTHY-ZDUSSCGKSA-N	427.436	1.967	50	20	IDGD	
COC(=O)[C@H]1CCC[C@@H](C(=O)NNC(=O)c2ccc(CSc3nncn3C)cc2)C1	746093367	PEBQYELRWOYBQN-CVEARBPZSA-N	431.518	1.848	50	20	IDGD	
CN1CCN(C[C@@H](NC(=O)NNC(=O)Cc2cn3ccccc3n2)c2ccccc2)CC1	746761280	KYAJNXAMFGDTPW-HXUWFJFHSA-N	435.532	1.196	50	20	IDGD	
N#Cc1ccc(-c2ccc(OCC(=O)NNC(=O)C[C@@H]3CCS(=O)(=O)C3)cc2)cc1	747471349	PUMZKYBCEXFRSD-INIZCTEOSA-N	427.482	1.576	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@](F)(C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)C1	748210924	STZGZJPULRMPNC-HXUWFJFHSA-N	434.424	1.212	50	20	IDGD	
CC(=NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)c1cnn(-c2ccccn2)c1C	748245032	UYXFDCPEYJHRCU-UHFFFAOYSA-N	426.502	1.980	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)[C@@H](C(C)C)N2CCCC2=O)c2ccccc2c1=O	748546739	OMRRZPXRMBRFFY-HXUWFJFHSA-N	441.532	1.995	50	20	IDGD	
C[C@@]1(NNC(=O)NCCCOC2CCN(Cc3ccccc3)CC2)CCS(=O)(=O)C1	748970336	MQWVHXDFUOQDRI-OAQYLSRUSA-N	438.594	1.439	50	20	IDGD	
CCc1cc(NNC(=O)c2cnc3c(c2C)c(=O)n(C)c(=O)n3C)nc(-c2ccccn2)n1	749246139	GJSLGCXIMOFJDP-UHFFFAOYSA-N	446.471	1.112	50	20	IDGD	
C[C@@H]1CN(S(=O)(=O)N2CCN(/C(=C\C#N)c3cccc([N+](=O)[O-])c3)CC2)C[C@@H](C)O1	750037019	UHNUTMDOKXJLQF-DHXASHTNSA-N	435.506	1.431	50	20	IDGD	
CCc1cc(Br)ccc1NNC(=O)C1=CN2CCS(=O)(=O)N=C2C=C1	753173784	NDCCELMYCXCASA-UHFFFAOYSA-N	425.308	1.952	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)Cc1c[nH]c2cccc(Br)c12	754236878	HKVKYWHDBSQSSI-UHFFFAOYSA-N	430.262	1.445	50	20	IDGD	
COC[C@](C)(O)C(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccc(C)cc2C)c1	754974899	UFOORZQBEVEDLC-FQEVSTJZSA-N	435.502	1.263	50	20	IDGD	
COC(=O)CNC(=O)c1ccc(NC(=O)NNC(=O)CCc2ccc(OC)cc2)cc1	755542755	ANPAFYQYINASAU-UHFFFAOYSA-N	428.445	1.384	50	20	IDGD	
COC(=O)[C@@H]1Cc2ccccc2CN1CC(=O)NNC(=O)c1cc(Cl)ccc1OC	755864637	WBLAKTSCAWVFAU-KRWDZBQOSA-N	431.876	1.710	50	20	IDGD	
COCC(=O)NNC(=O)Nc1cccc(-c2c(C(=O)OC)c(C(=O)OC)c3n2CCC3)c1	756071550	NEHDGVFEIPQJRU-UHFFFAOYSA-N	444.444	1.474	50	20	IDGD	
CCc1noc(CC)c1CNC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	756079437	UDQCBXZUQNDOQN-UHFFFAOYSA-N	428.537	1.842	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)Nc2nnc(-c3ccsc3)s2)c2ccccc2c1=O	756182984	TTYAKZRXKUJUOZ-UHFFFAOYSA-N	427.471	1.980	50	20	IDGD	
CC(C)CSCCNC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	756749736	WXIUDUYBNSYHLL-UHFFFAOYSA-N	428.580	1.804	50	20	IDGD	
COc1cccc(OC)c1CC(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	756954595	KAZKJIRIEFGXSJ-UHFFFAOYSA-N	435.502	1.411	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)c3cnn(C)c3N)c2)c(C)c1	757709722	VSLFZFCMPRIHCY-UHFFFAOYSA-N	442.501	1.495	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2cnc(Cl)cc2C)cc1	757720862	MZJFHSDKIALCEJ-UHFFFAOYSA-N	425.898	1.825	50	20	IDGD	
Cn1nc(Br)cc1C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	757758736	DBVIRRWMWVQGFF-UHFFFAOYSA-N	435.326	1.156	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H]2CN(C3CC3)C[C@H]2C)c1	757790159	ALRYUYXZLOPLNU-KDOFPFPSSA-N	437.566	1.144	50	20	IDGD	
O=C(NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)NNC(=O)c1cccc2ncccc12	758691957	ABLNBZNGXYVSAQ-UHFFFAOYSA-N	443.441	1.561	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)c1ccccc1F)C(=O)NNc1ncccc1[N+](=O)[O-]	759290477	NJDARCYZLSUQBR-GFCCVEGCSA-N	443.482	1.672	50	20	IDGD	
CCS(=O)(=O)c1cccc(S(=O)(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)c1	760339954	PLCXPDFKKCMUHH-UHFFFAOYSA-N	439.515	1.045	50	20	IDGD	
CCOc1cc(C(=O)N(C)C)ccc1NC(=O)C(=O)NNC(=O)COc1cccc(C)c1	763622879	HKXJRYRCXMYIPR-UHFFFAOYSA-N	442.472	1.260	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccccc2OCC(F)(F)F)cc1	763660949	IXSJOWNCVHAEGX-UHFFFAOYSA-N	441.362	1.801	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(Cl)c(C(=O)N(C)C)c2)cc1	763663615	LEHCPNFUWCGPEA-UHFFFAOYSA-N	448.863	1.215	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)cccc1N1CCOC1=O	763864383	CHLGPPROUNUTHS-ZDUSSCGKSA-N	444.419	1.644	50	20	IDGD	
CNC(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)CSc2ccc(C)cc2)c1	763890550	BRDKBBYXKWLBMR-UHFFFAOYSA-N	434.905	1.886	50	20	IDGD	
O=C(CCSc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccc(NC(=O)C2CC2)nc1	763896109	YJVIGBDSAYPWCK-UHFFFAOYSA-N	445.476	1.838	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(-n3cccn3)c(F)c2)cc1OC	763899996	FPYFFTPUMMLELH-UHFFFAOYSA-N	441.419	1.818	50	20	IDGD	
CCOC(=O)c1c(F)cccc1NC(=O)C(=O)NNC(=O)c1ccc2c(c1)OCCO2	764003350	GEWZUCQTFNTMFC-UHFFFAOYSA-N	431.376	1.173	50	20	IDGD	
O=C(Cc1ccsc1)NNC(=O)C(=O)Nc1ccc2nc(N3CCOCC3)sc2c1	764034161	GOQQUWCXAYAYKI-UHFFFAOYSA-N	445.526	1.523	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc(F)cc2Br)nn1CCC#N	764085603	NBEUZSMSVXRJDS-UHFFFAOYSA-N	437.229	1.407	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccnn2Cc2ccccc2Br)n[nH]1	764106801	UAKCQAVKUQYMFY-UHFFFAOYSA-N	446.265	1.125	50	20	IDGD	
C=CCNC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)CCc2ccc(OC)cc2)cc1	764125324	UFBVVRNBMRWZLV-UHFFFAOYSA-N	439.472	1.721	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2ccc(N3CCCC3=O)c(F)c2)cc1	764127986	WRYISNZBXGBIMD-UHFFFAOYSA-N	442.447	1.680	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)CCC(C)C)ccc1NC(=O)c1cccnc1	764199676	PTIZMXWPCINWQT-UHFFFAOYSA-N	427.461	1.865	50	20	IDGD	
CN(C)C(=O)c1cc(NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)ccc1Cl	764241831	LGOSXHGMWWWBQO-UHFFFAOYSA-N	441.875	1.783	50	20	IDGD	
Cc1ncsc1C(=O)NNC(=O)C(=O)Nc1ccnc(OCC(F)(F)C(F)F)c1	764247661	WRXSBJJRCIJGNF-UHFFFAOYSA-N	435.359	1.525	50	20	IDGD	
Cc1ccc(-c2ncco2)cc1NC(=O)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	764261148	ZSYDJRDDBUABKD-UHFFFAOYSA-N	449.471	1.443	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1cccc(C#Cc2ccccn2)c1	764280773	SVUAKPXSDTUVMN-UHFFFAOYSA-N	430.420	1.352	50	20	IDGD	
O=C(Cc1cc[nH]n1)NNC(=O)C(=O)Nc1ccc(OCc2ccccn2)c(Cl)c1	764285373	CBECAXPVHLVJIZ-UHFFFAOYSA-N	428.836	1.366	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C(=O)Nc1ccc(F)c(-n2nnnc2C)c1)c1ccccc1	764328112	LGQSAVCBGPOEDY-HNNXBMFYSA-N	425.424	1.390	50	20	IDGD	
CN(C)c1nnc(-c2ccc(NC(=O)C(=O)NNC(=O)c3cc4ccccc4o3)cc2)o1	764331061	NRRWGBHWUYJDNV-UHFFFAOYSA-N	434.412	1.949	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)C(=O)Nc1cc(Br)ccc1N1CCCC1	764355591	FFAGTXZVJNFRFX-UHFFFAOYSA-N	446.305	1.773	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)COCc2ccccc2)cc1C	764366399	LEAZWCQWDUNXMQ-UHFFFAOYSA-N	448.501	1.059	50	20	IDGD	
COC(=O)N(C)c1ccc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)cc1	764400006	DGUIYOYJDXJBLO-UHFFFAOYSA-N	432.458	1.473	50	20	IDGD	
Cc1ccc(-c2nc3ccc(F)cc3n2C(C)C)cc1NC(=O)C(=O)NNC(=O)CO	764429786	ZBNKKKZBDANVPR-UHFFFAOYSA-N	427.436	1.810	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Cc2csc3nccn23)c1	764464476	NDDJTFRCIVITBJ-UHFFFAOYSA-N	435.531	1.430	50	20	IDGD	
O=C(CSCc1ccccn1)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	766660373	LJPWFUYGCAANHJ-UHFFFAOYSA-N	447.992	1.933	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)CN1CCN(Cc2nc(N)c3ccccc3n2)CC1	766846573	QSXHUYDMMVXDQN-UHFFFAOYSA-N	447.543	1.028	50	20	IDGD	
O=C(COC(=O)c1cc2c(cc1F)NC(=O)CC2)NNC(=O)c1cccc([N+](=O)[O-])c1	768109367	PDGBTHLLXMSMJM-UHFFFAOYSA-N	430.348	1.237	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)c(O)c1	768290285	GFWWHFHPEGBVQQ-UHFFFAOYSA-N	432.908	1.633	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)CN1C(=O)N[C@]2(CCCC(C)(C)C2)C1=O	768571143	OEOUOUSMDIDQCX-NRFANRHFSA-N	426.477	1.295	50	20	IDGD	
CCc1ccc(CS(=O)(=O)N2CCN(S(=O)(=O)CBr)CC2)cc1	768890128	GPOWFZWIKCZBLI-UHFFFAOYSA-N	425.370	1.379	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)N[C@@H]1[C@H]2[C@H]3CC[C@@H](C3)[C@H]21	769200308	OMXDYJOZDKWLGJ-CJBAZIHXSA-N	432.546	1.850	50	20	IDGD	
CC(=O)N1CCc2c(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc3ccccc3F)cccc21	769268351	ZDKHFKAIMZYTGU-GFCCVEGCSA-N	428.420	1.288	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)c1ccc(S(C)(=O)=O)c(Br)c1	769743275	WEGLFKJTRQORBJ-UHFFFAOYSA-N	441.303	1.865	50	20	IDGD	
CC(=O)N[C@H](CC(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)c1ccccc1	770283313	YAEWRVFWPUMKSA-QGZVFWFLSA-N	428.401	1.167	50	20	IDGD	
C[C@@]1(CCC(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)CCC(=O)N1	770549406	NVGWXOCVQULRKT-QHCPKHFHSA-N	447.499	1.598	50	20	IDGD	
Cc1nn(C)c(C)c1S(=O)(=O)N[C@H](C)C(=O)NNc1ccc(Br)c(F)c1	771691411	TWEDZFFWFSHREE-SECBINFHSA-N	448.318	1.749	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)[C@H](C)NS(=O)(=O)c1ccc(Cl)cc1	771931585	JBFVTQYPNDKFQN-NWDGAFQWSA-N	433.914	1.132	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)[C@H]1CC(=O)N(c2ccc(F)c([N+](=O)[O-])c2)C1	771973272	IYMXXBJHGHTGCN-NEPJUHHUSA-N	438.412	1.212	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1cc(C2CC2)nc2c1c(O)nc(=O)n2CC(C)C	771992312	DRAQBWQVEWFBFO-LLVKDONJSA-N	445.476	1.133	50	20	IDGD	
CC(C)[C@H](NC(=O)c1cccs1)C(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772188141	HFRMRWUCVYZTIR-HNNXBMFYSA-N	436.921	1.620	50	20	IDGD	
O=C(NCC1CCN(c2ccncc2)CC1)NNC(=O)c1nn(-c2ccccc2)cc1O	772610829	DNSZRCLTOZDXBJ-UHFFFAOYSA-N	435.488	1.834	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)NC[C@@H]2CC[C@@H](C(=O)N(C)C)O2)c1	775454855	NWJYLSDCDRWSOB-FZMZJTMJSA-N	443.298	1.038	50	20	IDGD	
CN(NC(=O)c1ccc(Cn2cncn2)cc1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776206598	VVZJKNWTPFGKMG-UHFFFAOYSA-N	443.508	1.576	50	20	IDGD	
Cc1cc2ccccc2nc1NNC(=O)c1cccc(S(=O)(=O)N2CCNC(=O)C2)c1	777481550	LXTNXQOEZLLQND-UHFFFAOYSA-N	439.497	1.421	50	20	IDGD	
COC(=O)Nc1ccc(S(=O)(=O)NNC(=O)c2cccc3ncccc23)cc1[N+](=O)[O-]	777625557	KFCYNGMUASONJQ-UHFFFAOYSA-N	445.413	1.945	50	20	IDGD	
CCOc1ccc(C(=O)N2CCN(S(=O)(=O)CBr)CC2)cc1OCC	777779964	UWCWIYYHNFDWHI-UHFFFAOYSA-N	435.340	1.924	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)C1(NC(=O)OC(C)(C)C)Cc2ccccc2C1	778443641	VJDOVRSLOIKJQL-UHFFFAOYSA-N	448.520	1.721	50	20	IDGD	
CC(C)[C@H]1C[C@H](CC(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)CCO1	781996793	WQCMNKGZRWJSJY-SJLPKXTDSA-N	425.551	1.992	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)cc1)C(=O)Nc1cnn(-c2ccc(C(F)(F)F)cc2)c1	782831945	JAFWLYCPSSGMSQ-UHFFFAOYSA-N	433.346	1.996	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2cc(S(=O)(=O)N(C)C)ccc2N(C)C)cc1	783039175	HVANYJXKLNPUPZ-UHFFFAOYSA-N	435.506	1.093	50	20	IDGD	
O=C(NNc1ncnc2ccsc12)C(=O)Nc1ccc2nc(N3CCOCC3)oc2c1	783254371	OTAPEILUXJGMPM-UHFFFAOYSA-N	439.457	1.751	50	20	IDGD	
CC(=O)N1CCN(Cc2ccc(NC(=O)C(=O)NNc3ccc(F)cc3F)cc2)CC1	783342578	ICGLHHOMBZIMGD-UHFFFAOYSA-N	431.443	1.711	50	20	IDGD	
Cc1ccccc1NC(=O)NNC(=O)C(=O)Nc1cnn(-c2cnc3ccccc3n2)c1	783411040	NHTQVUJHJFZZRP-UHFFFAOYSA-N	430.428	1.915	50	20	IDGD	
O=C(NN=Cc1ncc(Br)cc1Br)N[C@@H]1CCS(=O)(=O)C1	783831575	LWPGOTFWKPGLOI-MRVPVSSYSA-N	440.117	1.427	50	20	IDGD	
COC(=O)c1cc(Br)c(F)cc1NC(=O)C(=O)NNc1ncc(F)cn1	784950470	QFJSSKQIVUNCJC-UHFFFAOYSA-N	430.165	1.386	50	20	IDGD	
CNC(=O)CCCCC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	788625642	QKIGPBYHAVKNDE-UHFFFAOYSA-N	446.529	1.233	50	20	IDGD	
COc1nc(Br)ccc1NC(=O)C(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	789586340	LNNABHLFGWBVNJ-UHFFFAOYSA-N	438.194	1.161	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNS(=O)(=O)c2cc(Cl)ccc2F)cc1	790044574	BWFAZRVCVYPJNO-UHFFFAOYSA-N	449.913	1.418	50	20	IDGD	
COc1cc(C(F)(F)F)ncc1NC(=O)C(=O)NNC(=O)COc1ccc(Cl)cc1	792267963	JKGLKMSEIJTPDJ-UHFFFAOYSA-N	446.769	1.927	50	20	IDGD	
Cc1cccc(=O)n1C[C@](C)(O)C(=O)NNc1ccc([N+](=O)[O-])cc1Br	792336035	AVXHYNAPQQKZHG-INIZCTEOSA-N	425.239	1.722	50	20	IDGD	
CN(NC(=O)[C@H]1COCCN1C1CCCC1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	793815847	ZKNZAKHQTBBIAN-QGZVFWFLSA-N	439.557	1.266	50	20	IDGD	
C[C@@H]1CCN(C(=O)OC(C)(C)C)[C@H](C)[C@@H]1NCC(=O)NNC(=O)c1ccc(C#N)cc1	796658524	MWRZIPJMNDPKJT-SPYBWZPUSA-N	429.521	1.943	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)Nc2ccc(NS(=O)(=O)Cc3ccccc3)cn2)cn1	797653443	TTYDWIAEMOBXLC-UHFFFAOYSA-N	429.462	1.224	50	20	IDGD	
C=C(C)[C@@H]1OCC[C@H]1CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(CC)CC)c1	798117513	CFOQELCWNUCMNW-WMZOPIPTSA-N	438.550	1.642	50	20	IDGD	
CC(=O)NC1(c2noc(CCC(=O)NNC(=O)NCC(F)(F)F)n2)CCCCCC1	798314690	XAMDNJLWCRWMSD-UHFFFAOYSA-N	434.419	1.581	50	20	IDGD	
CN(C)C(=O)c1ccc(S(=O)(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)cc1	799538216	YXPWXQSZUSYMIB-UHFFFAOYSA-N	428.511	1.003	50	20	IDGD	
Cn1c(N)c(C(=O)/C(C#N)=C\c2c(F)ccc(Br)c2F)c(=O)n(C)c1=O	800721415	MLWYWLRMSKBXMT-ALCCZGGFSA-N	425.189	1.497	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(S(=O)(=O)NNC(=O)c2ccc(C)cc2O)c1	800833485	AYKDPQQNVAHOJF-UHFFFAOYSA-N	441.531	1.354	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)Nc2ccc(Br)cc2)cn1	801994787	KLSMAFSZNXXBHM-UHFFFAOYSA-N	442.295	1.561	50	20	IDGD	
O=C(CCC(=O)N1CCN(c2ncccn2)CC1)NNC(=O)Nc1cc(F)cc(F)c1	802006061	BBUNRTYDLLGDKG-UHFFFAOYSA-N	433.419	1.037	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)N(C)CC(=O)NNc2ccc3c(=O)[nH]ccc3c2)cc1	803438016	ZEVSEKJUONAQEH-UHFFFAOYSA-N	443.485	1.250	50	20	IDGD	
Cc1cc(-c2csc(NC(=O)C(=O)NNC(=O)[C@@H]3COc4ccccc4O3)n2)c(C)o1	806972480	AXDUHZUAJFFFDK-INIZCTEOSA-N	442.453	1.946	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(NC(=O)C(=O)NNc2cc(F)c(F)cc2F)ccc1F	807015143	XAOVBMXVLWPQNK-UHFFFAOYSA-N	434.371	1.575	50	20	IDGD	
CN(Cc1ccc(Br)cc1)C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	807136242	YFYFVEATRCXPJU-UHFFFAOYSA-N	430.266	1.911	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)[C@@](N)(c1cccc(F)c1)C(F)(F)F	807175908	XASFCWGHWDOREX-KRWDZBQOSA-N	436.406	1.994	50	20	IDGD	
CCn1c(SCC(=O)NNC(=O)N2CCN(C)CC2)nnc1-c1ccc(Cl)cc1	807379851	GFCWVHNNUNZLMM-UHFFFAOYSA-N	437.957	1.699	50	20	IDGD	
CN1CCN(C(=O)NNC(=O)[C@H]2CCCN(C(=O)c3ccccc3OC(F)F)C2)CC1	807380686	MFHOBECWMGAXLO-AWEZNQCLSA-N	439.463	1.128	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)[C@@H](Cc3cnc[nH]3)NC(=O)CC(C)C)n[nH]2)cc1	810147333	JKPGTMKXRKGKJP-GOSISDBHSA-N	437.504	1.643	50	20	IDGD	
CCCCn1nc(C(=O)NN=Cc2ccc(S(N)(=O)=O)cc2)c2ccccc2c1=O	811633057	JBOSJORGPBJHLU-UHFFFAOYSA-N	427.486	1.608	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)Nc2cccc(CS(C)(=O)=O)c2)cc1	812928022	JAUFUNQAQSLNHP-UHFFFAOYSA-N	426.520	1.630	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)[C@H]1OCCc2sccc21	813866261	NFXPUWPHKWETKX-PIGZYNQJSA-N	427.486	1.642	50	20	IDGD	
O=C(NN=C1COc2c(Cl)cccc21)c1cccc(S(=O)(=O)N2CCOCC2)c1	814688734	KJGLCXIWYUNKGI-UHFFFAOYSA-N	435.889	1.887	50	20	IDGD	
Cc1cc(C)c(C(=O)O)cc1C=NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	814689233	XIXDTTXCUHWLPD-UHFFFAOYSA-N	445.497	1.786	50	20	IDGD	
Cn1c(N)nc(Cl)c1C=NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	814709804	HCUFADQWKCVKDJ-UHFFFAOYSA-N	446.920	1.898	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)c2cnn(C)c2I)cc1C	814720367	NQNOHVGHPOCCRZ-UHFFFAOYSA-N	428.230	1.482	50	20	IDGD	
COC(=O)C(C)(C)c1csc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCC3)n1	815565954	FPKJSLRLNNGEBO-UHFFFAOYSA-N	436.515	1.544	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)c1c(I)cnn1C	816505184	PCWDQRKYPAKKCA-MRVPVSSYSA-N	448.648	1.907	50	20	IDGD	
O=C(C[C@@H]1SC(N2CCCCC2)=NC1=O)Nc1cccc(C(=O)NNc2nc[nH]n2)c1	816632048	QXQHDOJBZFVDGY-AWEZNQCLSA-N	442.505	1.374	50	20	IDGD	
COc1ccc(C(=O)NNc2ccccc2S(=O)(=O)N(C)C)nc1Br	817055110	MMYRKKRZQSHPLD-UHFFFAOYSA-N	429.296	1.860	50	20	IDGD	
Cn1c(=NNC(=O)CN2C(=O)N[C@@](C)(c3ccc(F)cc3)C2=O)sc2ccccc21	818419161	ZPUBVIAFJNWAFT-FQEVSTJZSA-N	427.461	1.778	50	20	IDGD	
O=C(CNC(=O)c1ccccc1OC(F)F)NNC(=S)NCCc1cccs1	849366530	IDHDOQKFUIWRKQ-UHFFFAOYSA-N	428.486	1.817	50	20	IDGD	
CC(=O)N1CCN(S(=O)(=O)c2cccc(C(=O)NNc3cc(C)ccc3C)c2)CC1	857830729	CHRXNIVACNLRTQ-UHFFFAOYSA-N	430.530	1.913	50	20	IDGD	
C[C@@H]1CC(C)(C)C[C@@]2(C1)NC(=O)N(CC(=O)NNC(=O)COc1ccccc1F)C2=O	864019975	WUAFJPMHFPHIQW-LRTDBIEQSA-N	434.468	1.489	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)c2nn(-c3ccc(Cl)cc3)cc2O)c2ccccc2c1=O	913088687	YVXTWULCRAKQMF-UHFFFAOYSA-N	438.831	1.553	50	20	IDGD	
N#Cc1cccc(S(=O)(=O)NCC(=O)NNC(=O)CSc2ccc(Cl)cc2)c1	913496577	WXOXEVSEBSGIQG-UHFFFAOYSA-N	438.918	1.430	50	20	IDGD	
CCOCCCNC(=S)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	916115631	FFUOEMIIUOWVEA-UHFFFAOYSA-N	428.580	1.397	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)c2cccc(CS(=O)(=O)c3ccccc3)c2)n1	916139898	AKFPFWFPFYIQGE-UHFFFAOYSA-N	426.498	1.935	50	20	IDGD	
COC(=O)c1ccc(Br)c(S(=O)(=O)NNC(=O)c2ccccc2F)c1	917716985	ICLNGOZEKMTPKC-UHFFFAOYSA-N	431.239	1.998	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)CN1CCCC1	918220702	KOYVYSHFZLFRLC-MRXNPFEDSA-N	437.566	1.147	50	20	IDGD	
CC(=O)Nc1ccc(F)c(C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)c1	919689961	INXNEIOKWJMAOP-UHFFFAOYSA-N	436.465	1.174	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1)N[C@@H]1CCS(=O)(=O)C1	919961160	VLGBJYIMTOFSLV-SSDOTTSWSA-N	435.833	1.038	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)C1(c2cccc(F)c2)CCOCC1	919972349	BDJZAWBDYGFWGA-UHFFFAOYSA-N	448.520	1.937	50	20	IDGD	
CCCNC(=O)NNC(=O)c1ccc(Cl)c(S(=O)(=O)N2C[C@@H](C)O[C@H](C)C2)c1	921042969	XAIYACJDVDGUJB-VXGBXAGGSA-N	432.930	1.492	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)N[C@H]2CC(=O)N(c3ccccc3)C2)cc1	921125703	VGVHHMFBMGWHBL-HOTGVXAUSA-N	426.473	1.989	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(Br)c(F)c2)c1	921301598	FMSZLDFOWYUKKJ-UHFFFAOYSA-N	444.282	1.913	50	20	IDGD	
CN(C)c1ccc(CCNC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1	1318156778	QTUROVFCAZQSNV-UHFFFAOYSA-N	438.576	1.838	50	20	IDGD	
Cc1ccc(CCC(=O)NCC(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1	1318568856	JMMDVHWLYHYEQM-UHFFFAOYSA-N	446.548	1.838	50	20	IDGD	
COc1cccc(C[C@@H](O)C(=O)NNC(=O)c2cc(-c3ccc(OC)c(OC)c3)[nH]n2)c1	1320739943	OFULFFFVEZEQNM-GOSISDBHSA-N	440.456	1.467	50	20	IDGD	
CC(C)(C)OC(=O)NCCCCNC(=O)NNC(=O)c1csc(N2CCOCC2)n1	1323622241	XFJWVCQKLBQAIJ-UHFFFAOYSA-N	442.542	1.229	50	20	IDGD	
COC[C@@H](C)Oc1ccc(Cl)cc1S(=O)(=O)NNC(=O)c1n[nH]c2c1CCCC2	1338749463	GTMCDARFYUSEID-LLVKDONJSA-N	442.925	1.979	50	20	IDGD	
Cc1cc2nnc(C(=O)N3CC[C@@]4(C3)CN(C(=O)C(C)(C)CCl)CCO4)c(C)n2n1	1777779064	JCRRBJDZUMHTNO-HXUWFJFHSA-N	434.928	1.450	50	20	IDGD	
O=C(c1cn2ccc(Cl)cc2n1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1778057628	KZTLHMYMKFJANC-KBXCAEBGSA-N	427.288	1.031	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C=N/O[C@@H]2CCCCO2)C1	1779428534	MURYFLLOXVJZBU-PDFMVGRJSA-N	445.944	1.283	50	20	IDGD	
CN1CCCC[C@H]1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CO[Si](C)(C)C)C1	1779538754	GZDVLQUZXRWYQQ-WAOWUJCRSA-N	425.646	1.836	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(OC)n(C)n3)C2)C1	1780436342	PCQGOEKALZUABZ-YVEFUNNKSA-N	429.315	1.046	50	20	IDGD	
Cn1ccc(=O)cc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Br)C1	1780773650	KSBSBJFLNVFDMV-RVKKMQEKSA-N	444.301	1.203	50	20	IDGD	
Cn1nc2c(c1C(=O)N1CCO[C@]3(CCN(C(=O)[C@@](C)(Cl)CCl)C3)C1)CCC2	1781233639	VRXMOJNJPCRCSM-RBUKOAKNSA-N	429.348	1.589	50	20	IDGD	
O=C(c1cc2ncsc2[nH]1)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781332456	YYPKSFWLPMVZOR-ABAIWWIYSA-N	431.287	1.758	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(Cl)c(O)cc3O)C2)C1	1781473417	ZHGZQZHXZPLGLT-QGHHPUGFSA-N	447.713	1.978	50	20	IDGD	
CC(=O)N(C)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)Br)C1	1781997335	RFHPPDHSRNPWDT-JCKWVBRZSA-N	432.359	1.152	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@@H](C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](O)CCl)C3)C1	1782161087	BMPJVGFZCBYUEZ-WUKWMOGPSA-N	444.956	1.079	50	20	IDGD	
Cc1ccn2c(C(=O)N3CC[C@@]4(C3)CN(C(=O)[C@H](C)Br)CCO4)cnc2c1	1782491973	GUPVDFITCWSACH-IFXJQAMLSA-N	435.322	1.870	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)Cc3ccc(NC(C)=O)cc3)CCO2)C1	1783875818	UEQZFQDPNDRNSA-NQIIRXRSSA-N	437.924	1.271	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cc(Cl)cc4nn[nH]c34)CCO2)C1	1783880966	HHFGJAAUBJUNAE-FZKQIMNGSA-N	442.303	1.309	50	20	IDGD	
CCN1CCC(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]3C2)CC1	1783975007	CZMQDMLQBXJCMS-DKIMLUQUSA-N	444.414	1.729	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Cl)C[C@@H]21)c1cc(Cl)nc2n[nH]cc12	1787236706	YQUDZTYGLCPCHF-NVPWMLRNSA-N	430.267	1.739	50	20	IDGD	
COc1nn(C)cc1C(=O)Nc1ccc(C2(NC(=O)CCC(=O)NN(C)C)CCC2)cc1	1787243850	WNVOHACARURXTF-UHFFFAOYSA-N	442.520	1.549	50	20	IDGD	
Cc1ccc(C(=O)NCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]3C2)cc1	1787451447	QJOGHISYDNQAIN-NBOOPKSLSA-N	425.888	1.239	50	20	IDGD	
Cc1cnn(CC(=O)Nc2ccc(C3(NC(=O)c4ccc(B(O)O)cc4)CCC3)cc2)c1	1788286223	SBZVQHVCGKGCPK-UHFFFAOYSA-N	432.289	1.319	50	20	IDGD	
C[C@@]1(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)CC=CCC1	1788610933	FNJNWOYBPVWZCT-HTIQSUCMSA-N	441.532	1.025	50	20	IDGD	
C[C@@H](Cn1cncn1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]21	1788725975	DIQIUIYNDGVVRF-PQKJENKHSA-N	432.352	1.130	50	20	IDGD	
C[C@H](C(=O)NC1(c2ccc(NC(=O)c3cnccc3C(=O)NN)cc2)CCC1)n1cccn1	1789523707	OJOIZHOTHMVHOG-OAHLLOKOSA-N	447.499	1.891	50	20	IDGD	
O=C(NC1(c2ccc(NC(=O)[C@H](O)N3CCOCC3)cc2)CCC1)[C@@H](F)Br	1789554696	HAAVHAGEDVGGFS-PBHICJAKSA-N	444.301	1.462	50	20	IDGD	
CC(=O)O[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]2C1)C(C)C	1789868109	NLZZKXQVGIGBRC-ZAHIEGGZSA-N	437.364	1.790	50	20	IDGD	
Cc1ccc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]3C2)cn1	1789922945	YVEUUFBXTOYNAQ-JKQORVJESA-N	428.302	1.603	50	20	IDGD	
O=C1CSc2ncc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)[C@H](F)Cl)C[C@@H]43)cc2N1	1790454555	CUASAHAYUCMEQV-PBLBJHRBSA-N	442.900	1.254	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)[C@@H]1CCc2cccc(Cl)c21	1790688348	DAWAQQFTGQDHPW-CRCOGDFISA-N	441.355	1.949	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)N3C[C@H]4C[C@@H]4C3)C[C@@H]21	1791056390	WKLVBHVIQMUFQI-CLKXDBTJSA-N	428.371	1.090	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)Cn3ccnc3)C[C@@H]21	1791064706	FCUJWWWSCUSCSF-QXKUPLGCSA-N	427.343	1.282	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CSCc3[nH]cnc3C)C[C@@H]21	1791255542	UANZOUIHRUCPBB-JKQORVJESA-N	444.985	1.185	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](O)CCl)C2	1794141284	DMIBRHITXBQXID-ZUWCUPBKSA-N	438.352	1.356	50	20	IDGD	
CCCc1onc(C)c1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2	1796615686	GJPSDZCMRCRMOT-BAESOJJISA-N	432.290	1.829	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](C)[C@@H]1SC(=N)NC1=O	1796874268	NNVUCDIAPZKJFZ-HKLHZYFVSA-N	445.383	1.458	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2cn[nH]c2cn1	1797580750	PNMFQMIFNCKPJD-TYYYEBLRSA-N	426.304	1.397	50	20	IDGD	
COc1cc(OC)cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCBr)C3)c1	1798897354	ICAQNSWAIPVPKP-ZSBFGKGUSA-N	441.322	1.692	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c(c1)NC(=O)[C@@H](C)O3)C2	1799268652	BHMWAVBFDWIDBW-UDUPSFLGSA-N	435.908	1.627	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccn2c(C)cc(C)nc12	1800138340	PUHHYOZPHYXAJB-MVJTYMMSSA-N	434.924	1.408	50	20	IDGD	
CCC[C@H](NC(C)=O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](Br)CC	1800645204	VSPNBSIINNMJNI-QRJUGERDSA-N	432.359	1.054	50	20	IDGD	
CC[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCC(=O)NN(C)C)c1ccccc1	1801013024	KQRDUCFGZYKUGR-WEMPKCCASA-N	430.549	1.143	50	20	IDGD	
C[C@@H](NC(=O)c1ccccc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CO[Si](C)(C)C)C2	1802114585	PBUYBXNKPAVMQW-PHXBYCTMSA-N	447.608	1.246	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)[C@@H]2C[C@@H]2C2CC2)[C@H]1c1cccnc1	1802989171	OGGHDAJSBYMRQL-XLBJILASSA-N	448.527	1.446	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2ccccc2O)[C@H]1c1cccnc1	1805205732	FASZSKXYJBWLLK-VGOFRKELSA-N	439.516	1.480	50	20	IDGD	
O=C(C(O)O)N1CCCC2(CCN(C(=O)[C@@H](Br)Cc3ccccc3)CC2)C1	1805284055	ZZXXATXMKYRBSL-INIZCTEOSA-N	439.350	1.535	50	20	IDGD	
Cc1onc(C(=O)N2CCCC3(CCN(C(=O)c4cccc(B(O)O)c4)CC3)C2)c1C	1806348033	NRRFTGUCIRMFLR-UHFFFAOYSA-N	425.294	1.130	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)c2cc(CO)on2)[C@@H]1c1cccnc1	1812866385	FHUMUGUISPZOAG-DETPVDSQSA-N	437.294	1.665	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CCN2CCOCC2)[C@H]1c1cccnc1)C(Cl)Cl	1813076398	PSCSUIAWAGKLNA-RDJZCZTQSA-N	429.348	1.613	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)N1CC[C@@H](CNC(=O)C(Cl)Cl)[C@@H]1c1cccnc1	1813078788	SFVCYLPCJCJIFS-XBFCOCLRSA-N	430.336	1.599	50	20	IDGD	
Cc1occc1C(=O)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1	1815355112	NDMNANINKMZOOF-AWEZNQCLSA-N	425.275	1.264	50	20	IDGD	
C=CCSCC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1815654279	QVHZDPPXCRJGRZ-QGZVFWFLSA-N	428.323	1.315	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)CC(F)(F)C(=O)O)sc2C1	1817095791	NWDXFCPPRANBHJ-RQJHMYQMSA-N	440.266	1.949	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CN2CCOCC2)n[nH]1	1817151862	QWZIACLLNISHPG-HIFRSBDPSA-N	442.358	1.908	50	20	IDGD	
N=C1NCCN1CC(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCBr)[nH]n1	1817292533	MUTIXCLJEABQCA-LBPRGKRZSA-N	426.319	1.027	50	20	IDGD	
COCCn1nccc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](Cl)COC)CC2	1817594538	GASFLSKNGNFCOO-NEPJUHHUSA-N	441.941	1.466	50	20	IDGD	
Cc1cnc2c(C(=O)Nc3cc([C@@H]4CCCCN4C(=O)[C@@H](O)CCl)[nH]n3)cnn2c1	1819070968	JNZAYPZQRUIAEP-GJZGRUSLSA-N	431.884	1.666	50	20	IDGD	
CC[S@](=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](F)Br)CC2	1819517781	XCUDULBLUPDUKT-MYUSKNPXSA-N	440.360	1.904	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H]1CC1(F)F)CC2	1819797333	SQHRBSSAMPWZPX-KWQFWETISA-N	436.444	1.023	50	20	IDGD	
O=C(Cc1ccncc1)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1820715825	KTSHHCCHUUCTDY-LJQANCHMSA-N	433.277	1.033	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CNC(=O)OC)[nH]n1	1822092754	VKLUCXMODNYSSF-JQWIXIFHSA-N	430.303	1.931	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC([C@H]2CCCCN2C(=O)CNC(=O)N(C)C)CC1	1823881403	AVCRCGMICUVWKG-DZGCQCFKSA-N	431.375	1.661	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)CCNC(C)=O)sc2C1	1825246958	VRWZQXISJLAHIE-QWRGUYRKSA-N	431.356	1.755	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)no1	1826048566	CPMZQUBORQXRDQ-FQEVSTJZSA-N	425.294	1.210	50	20	IDGD	
Cc1ccc(CC(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)cn1	1827050754	XOCNRZCNSBCUGM-QHCPKHFHSA-N	449.360	1.546	50	20	IDGD	
CC(=O)N1CCN(CC(=O)N2CCC([C@@H]3CCCCN3C(=O)[C@H](F)Cl)CC2)CC1	1827607906	BOPMUZGTCBNKAZ-HKUYNNGSSA-N	430.952	1.305	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc[nH]n2)CC1	1827677098	HSIJTGDBHSJTRZ-KWXFCVSUSA-N	439.520	1.777	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3C[C@]3(F)Cl)C2)C1	1830543817	DSUARFABGFSCRP-CZPYZCIJSA-N	441.725	1.398	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cnc4ccccn34)C2)C1	1831639346	QPGSIODWARSYFR-PGRDOPGGSA-N	448.951	1.741	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CC(=O)OC(C)(C)C)C2)C1	1831639588	CPAGKLUIWOGMPT-YWZLYKJASA-N	432.945	1.582	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)C(C)(F)F)CCO2	1831686480	GVAIPAHUAPTBOM-UGSOOPFHSA-N	426.888	1.378	50	20	IDGD	
CCn1ccc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)n1	1831872427	WFIZFEZDTCDXBP-IBGZPJMESA-N	432.569	1.509	50	20	IDGD	
O=C(CCN1C(=O)C=CC1=O)N1CCC([C@@H]2CCCCN2C(=O)C(Cl)Cl)CC1	1831874208	DBOHTJJGRVOOJV-AWEZNQCLSA-N	430.332	1.725	50	20	IDGD	
Cc1noc(C)c1CC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)Br)C2)C1	1832561050	KJWQAJVCRPHHGM-SGTLLEGYSA-N	444.326	1.074	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3coc(Cl)n3)CCO2)C1	1833560017	MMFZGADJBBZDRE-ZUZCIYMTSA-N	436.690	1.181	50	20	IDGD	
Cc1cccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](C)CBr)C3)C2)n1	1834047077	VZZCBHWZXGRHEO-LIRRHRJNSA-N	440.338	1.491	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)c3ccon3)CC2)CC1	1834298143	IABSQLRAWPFGPG-CYBMUJFWSA-N	427.343	1.891	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)C3CCC(CO)CC3)C2)C1	1834819460	OHWSIRXYKXZYIZ-LADRWXRNSA-N	447.370	1.027	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)c3cccc(F)n3)C2)C1	1834822990	CHVKKWONVGPWSG-QGZVFWFLSA-N	430.274	1.076	50	20	IDGD	
Cn1ccc(CC(=O)NC2CCN(C3CCN(C(=O)[C@](C)(Cl)CCl)CC3)CC2)n1	1834848704	FHNCETSBHMNBGL-HXUWFJFHSA-N	444.407	1.771	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3ccc4c(n3)OCCO4)CC2)CC1)[C@@H](F)Cl	1835079742	PFKLIAWUHYGFTL-QGZVFWFLSA-N	440.903	1.572	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)c1cccn2ccnc12	1835576296	BFOKJPBNZWYWGZ-GOSISDBHSA-N	433.940	1.119	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)CCNC(=S)NC)CC2)CC1	1835740312	QGCZOPPUMPGOFT-KRWDZBQOSA-N	446.061	1.450	50	20	IDGD	
CC(=O)N[C@H](C)C(=O)N1CCC(OC2CCN(C(=O)[C@H](C)CBr)CC2)CC1	1836674754	ZFFJZNLRFQFKTC-ZIAGYGMSSA-N	446.386	1.541	50	20	IDGD	
CN(C)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836715106	JAIMMUCTMJQHOE-LJQANCHMSA-N	438.956	1.360	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)c3ccccc3)C2)C1	1837712610	ZUCSUNWKONQHSK-CTNGQTDRSA-N	436.581	1.028	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3Cc4ccccc4O3)C2)C1	1837713340	XZMAYZNJAKMHKG-DENIHFKCSA-N	448.592	1.298	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3[nH]cc4c3CCC4)CCO2)C1	1838454842	VDAVQAXYBMMYGW-VQTJNVASSA-N	444.359	1.810	50	20	IDGD	
CCc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)cn1	1839151447	RRLORGRXNFPHSF-WOJBJXKFSA-N	444.359	1.950	50	20	IDGD	
O=C([C@H](F)Br)N1CCO[C@@]2(COCCN(C(=O)C3(F)CCCCC3)C2)C1	1839201482	ZDABASDWLKDTKT-BBRMVZONSA-N	439.297	1.806	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)c(F)c1	1839201552	ASEOLSQZMDZHTQ-QAPCUYQASA-N	447.276	1.895	50	20	IDGD	
CC(C)Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)cc1	1839404009	ZTMHJAPUZXTDHG-DENIHFKCSA-N	438.952	1.555	50	20	IDGD	
COc1ccc(CCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)cn1	1840186303	GCFFFDKFZGJSNF-LJQANCHMSA-N	446.331	1.283	50	20	IDGD	
O=C(c1cn2c(Br)cccc2n1)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1	1841351179	IJGBFAWKLRNVFY-GFCCVEGCSA-N	441.713	1.514	50	20	IDGD	
CC[C@H](C)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1	1841352941	VSZXRIUBOZKWIW-SOUVJXGZSA-N	431.961	1.729	50	20	IDGD	
CO[C@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)C(Cl)Cl)C2	1841750094	IEEQUNIJMXBTOR-NEPJUHHUSA-N	438.352	1.922	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC2(CCCN2C(=O)c2cncc(S(C)(=O)=O)c2)C1	1842189756	MUUCSZMTYCTAQL-CQSZACIVSA-N	444.351	1.476	50	20	IDGD	
COc1ccc(F)c(C(=O)N2CC3(CCCN3C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)c1	1843417309	VJOYVQQHCHCELI-AFUMVMLFSA-N	441.463	1.785	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCCC12CN(C(=O)[C@@H]1CN(Cc3ccccc3)CCO1)C2	1844378186	PPFCIQXLZMTKKD-FQEVSTJZSA-N	445.636	1.942	50	20	IDGD	
C=CCC(F)(F)C(=O)N1CC2(CCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)C1	1845039383	JTTPUJVXIFLUSP-UHFFFAOYSA-N	449.502	1.747	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1[C@@H](C(=O)N1CCCC13CN(C(=O)[C@H](O)CCl)C3)C2	1847091059	LYPZXMPBUVPAOW-YHUYYLMFSA-N	441.956	1.578	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1S(=O)(=O)NC(C)C	17330383	GGMLVHSIVGNGLY-UHFFFAOYSA-N	436.446	1.365	50	20	IDGD	
NS(=O)(=O)c1cccc(S(=O)(=O)NNC(=O)c2cc3c(s2)CCCCC3)c1	22410752	FRFMVYPNWUJBDE-UHFFFAOYSA-N	429.545	1.288	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2N2CCOCC2)c(C)c1	726100299	BQLSVGZWVSDXES-UHFFFAOYSA-N	427.461	1.921	50	20	IDGD	
COc1ccc(N2CCC(NC(=O)NNC(=O)c3nnc(O)c4ccccc34)CC2)cc1	726715135	IVHJRZMICAWIPE-UHFFFAOYSA-N	436.472	1.957	50	20	IDGD	
CCOc1ccc(OCC)c(NC(=S)NNC(=O)c2ccc(S(N)(=O)=O)cc2)c1	727492271	MYLKLKLNUICFHP-UHFFFAOYSA-N	438.531	1.763	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)c2cccc(S(=O)(=O)NC3CC3)c2)cc1F	727499341	YQIHZYZAKWYHSH-UHFFFAOYSA-N	438.506	1.906	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN1C(=O)OCC(F)(F)F)c1nnc(O)c2ccccc12	727798861	DVXDEEOKTDYKKP-LLVKDONJSA-N	427.339	1.260	50	20	IDGD	
CSCC[C@H](C(=O)NNc1nc(-c2ccncc2)no1)N1C(=O)c2ccccc2C1=O	728073339	GJAXTISHKMRMPM-OAHLLOKOSA-N	438.469	1.993	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccccc1)NNC(=O)c1cc(F)ccc1Br	728550842	KDLLWSKNYLFWPO-UHFFFAOYSA-N	444.282	1.718	50	20	IDGD	
CN(C)c1ccc(NC(=S)NNC(=O)c2cccc(CN3C(=O)CNC3=O)c2)cc1	729689616	OSRPVPJQOCVRGT-UHFFFAOYSA-N	426.502	1.436	50	20	IDGD	
CC(C)NS(=O)(=O)Cc1ccc(CNC(=O)NNC(=O)Cc2ccccc2F)cc1	731361677	SSSSJPAQEZWXRB-UHFFFAOYSA-N	436.509	1.727	50	20	IDGD	
Cc1c(C(=O)NNC(=O)Cc2nc3ccccc3n2C)nnn1-c1ccc2c(c1)OCCO2	731454177	VJRSTATVQAZSQJ-UHFFFAOYSA-N	447.455	1.237	50	20	IDGD	
Cn1nc(C(=O)NN=Cc2ccc(OCC(=O)O)c([N+](=O)[O-])c2)c2ccccc2c1=O	731557695	WQLWVIVLVVGUEI-UHFFFAOYSA-N	425.357	1.069	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cc3c(nc2O)CCCC3)cc1	731597802	SCQDUWJYUVAALV-UHFFFAOYSA-N	432.502	1.056	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)c1sccc1S(=O)(=O)NCc1cccs1	732082399	FYOMMRUHWGFDGB-UHFFFAOYSA-N	425.517	1.394	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2nnc3ccccc3c2O)c1	732258422	OCTLTUAYWWFCRN-UHFFFAOYSA-N	443.485	1.441	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2csc(-c3ccc4c(c3)OCO4)n2)C[C@@H](C)O1	732262801	WHFWGUOFTDXRSA-BETUJISGSA-N	432.502	1.799	50	20	IDGD	
NC(=O)c1cc(C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)nn1-c1ccccc1	732282075	JRNDCWCKRAZDNT-UHFFFAOYSA-N	440.485	1.169	50	20	IDGD	
O=C(COC(=O)Cc1ccccc1Br)NNC(=O)c1cccc([N+](=O)[O-])c1	732339050	IVMRYPXZAOBYGX-UHFFFAOYSA-N	436.218	1.904	50	20	IDGD	
O=C(NNc1ccccc1[N+](=O)[O-])[C@@H]1CCCN1S(=O)(=O)c1cccc([N+](=O)[O-])c1	732951534	NTZBRHAJPXMOFV-INIZCTEOSA-N	435.418	1.799	50	20	IDGD	
CC[C@@H](C#N)Oc1cccc(CNC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c1	733805692	UOLZZQAUYFVYPE-INIZCTEOSA-N	430.486	1.915	50	20	IDGD	
COCCN1C(=O)c2ccc(C(=O)NNc3cnnc4ccccc34)cc2S1(=O)=O	733811669	KERHYSTWVNMLNU-UHFFFAOYSA-N	427.442	1.178	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)CCc1nc(-c2ncccn2)no1	734252082	BVYIRWYKBGZDRP-UHFFFAOYSA-N	445.505	1.679	50	20	IDGD	
COc1cc2cc(C(=O)OCC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)[nH]c2cc1OC	735726741	XCYIZNAVPQIKLT-UHFFFAOYSA-N	442.384	1.711	50	20	IDGD	
NC(=O)c1ncn2c(C(=O)NNC(=O)COCc3ccccc3)cc(-c3ccco3)nc12	737923727	WEGSKLRRUVZBNW-UHFFFAOYSA-N	434.412	1.066	50	20	IDGD	
O=C(COC(=O)c1cc2c(nc1O)CCCCC2)NNC(=O)[C@H]1COc2ccccc2O1	738760094	WQLGMSDDACDHKN-GOSISDBHSA-N	441.440	1.200	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)C[C@H]2CCCN(C(=O)NCC(C)C)C2)cc1C	741302118	RHRVVMZJTJJVQW-QGZVFWFLSA-N	431.537	1.857	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N[C@@H](C)c2cnn(C)c2)cc1	741700043	DUJXNCYDJCAFFX-ADFUCPMPSA-N	447.499	1.952	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)c1ncoc1-c1ccc2c(c1)OCCO2	742033978	IIYHEYRCARMCES-UHFFFAOYSA-N	433.380	1.836	50	20	IDGD	
CC(C)(C)OC(=O)N(CC(=O)NNC(=O)Cn1cnc2ccccc21)C[C@H]1CCCO1	742034017	UKDZJJAMADOTSU-OAHLLOKOSA-N	431.493	1.600	50	20	IDGD	
CC(C)Oc1cc(Br)cc(NC(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)c1	744450185	OJBICAFWSKLYGV-SNVBAGLBSA-N	434.312	1.824	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(/C#N)C(=O)OCCNS(=O)(=O)c2cnn(C)c2)c1C	744459967	HISGBUOHGDKFOI-QJVAEYLJSA-N	449.533	1.475	50	20	IDGD	
CCc1ccccc1N1C[C@H](C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)CC1=O	744545579	BXWAQIMNMHCXKU-GOSISDBHSA-N	434.452	1.478	50	20	IDGD	
Cc1cc(C)c(N2C[C@H](C(=O)OCC(=O)NNC(=O)c3ccc(C#N)cc3)CC2=O)c(C)c1	744698061	LWKZDGDACOKWCZ-LJQANCHMSA-N	448.479	1.841	50	20	IDGD	
CC/C=C(/C)C(=O)N1CSC[C@H]1C(=O)OCC(=O)NNC(=O)c1ccc(C#N)cc1	744972265	LFZNRAUEZNNBER-BOCDPNTGSA-N	430.486	1.120	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NC[C@H](C)Oc2cccc(OC)c2)c2ccccc2c1=O	745883293	RPNWLRGDOXGWAK-AWEZNQCLSA-N	439.472	1.837	50	20	IDGD	
CCOc1ccccc1C(=O)N1CCC[C@H]1C(=O)NNC(=O)Cc1cn2ccccc2n1	746550488	NWUVWBGWMCLVGL-SFHVURJKSA-N	435.484	1.728	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F)[C@H]1COc2ccccc2O1	746590583	AXTXEJNNEABRDW-CYBMUJFWSA-N	447.347	1.763	50	20	IDGD	
CCCn1c(CCC(=O)NNc2nc(C)cc(OC)n2)nc2cc(S(N)(=O)=O)ccc21	746624034	UUBURKVGJLLATH-UHFFFAOYSA-N	447.521	1.277	50	20	IDGD	
COC1(C(=O)NNC(=O)Cc2cn3ccccc3n2)CCN(C(=O)OC(C)(C)C)CC1	746640370	BNQXXPFBWFXDIJ-UHFFFAOYSA-N	431.493	1.440	50	20	IDGD	
O=C1CN(S(=O)(=O)c2ccc(C(=O)NNc3ccc(C(F)(F)F)cc3)cc2)CCN1	747609162	MQFWYYJWWYNBSI-UHFFFAOYSA-N	442.419	1.583	50	20	IDGD	
Cn1c(=O)n(C)c2nc(NC(=O)CCC(=O)NNc3ccc([N+](=O)[O-])cc3Cl)ccc21	748722400	UDVGRKUSWSVBFU-UHFFFAOYSA-N	447.839	1.696	50	20	IDGD	
O=C(NNC(=O)C1CCC(NC(=O)C2CCCC2)CC1)c1ccc(-n2cnnn2)cc1	751295208	MBYFRCCFSYEBHS-UHFFFAOYSA-N	425.493	1.289	50	20	IDGD	
CC[C@H](NC(=O)NNC(=O)c1sc(-c2ccccc2)nc1C)C(=O)N1CCOCC1	753047276	QRXQTWRFSHJUMH-HNNXBMFYSA-N	431.518	1.700	50	20	IDGD	
CC[C@H](NC(=O)NNC(=O)c1ccc(Br)cc1Cl)C(=O)N1CCOCC1	753055311	CXPZFDZMWINCCG-ZDUSSCGKSA-N	447.717	1.684	50	20	IDGD	
COCCN(CCOC)S(=O)(=O)c1ccc(C(=O)NNc2cccnc2Cl)cc1	754485771	YCZAMMQNADLNIR-UHFFFAOYSA-N	442.925	1.775	50	20	IDGD	
CC(CN1C(=O)CCC1=O)=NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	754910911	UTWIQAYXTHQUIS-UHFFFAOYSA-N	431.456	1.643	50	20	IDGD	
COc1cc([N+](=O)[O-])ccc1C(=O)NNC(=O)CN1CCN(Cc2ccc(C)cc2)CC1	755377567	WEXKFYJTILXOFB-UHFFFAOYSA-N	441.488	1.491	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2ccc(NC(=O)NNC(=O)c3ccncc3)cc2)C[C@H](C)O1	755425148	ZFDQNQISOKODRV-KBPBESRZSA-N	433.490	1.346	50	20	IDGD	
CCOc1ccc(NC(=O)NNC(=O)c2cccnc2)cc1S(=O)(=O)N(CC)CC	755451217	QVGSDNMNJDZPHF-UHFFFAOYSA-N	435.506	1.977	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)Nc2ccc(S(=O)(=O)NC(C)C)cc2)c1	755512978	SIBNABKXPNCBAJ-UHFFFAOYSA-N	434.478	1.193	50	20	IDGD	
COc1cccc(-c2nc(C)c(C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)[nH]2)c1	755898009	LMSDPNHUIPYQBC-UHFFFAOYSA-N	432.481	1.862	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)Nc1ccc(C(=O)NCc2ccccc2F)cc1	755956550	QGDNHVOZFIRQEZ-CQSZACIVSA-N	432.452	1.960	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1ccc(N2CCc3sccc3C2)cc1	756277157	PUOWXNHDFSIWPV-GFCCVEGCSA-N	437.547	1.401	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)Nc1ccc(S(=O)(=O)NC2CC2)cc1	756775042	GTFWOWZCFNWIOB-QGZVFWFLSA-N	432.458	1.120	50	20	IDGD	
O=C(Cc1c[nH]c2ncccc12)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	756901577	NRPYVFNJGLRMPC-UHFFFAOYSA-N	441.513	1.741	50	20	IDGD	
Cn1cc(NC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc(Br)c1=O	757677382	GUAXISCMTVXUCF-UHFFFAOYSA-N	447.249	1.506	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)C23CCC(C(=O)OC)(CC2)C3)c2ccccc2c1=O	757816760	NDKMOKSHXRRJNT-UHFFFAOYSA-N	426.473	1.691	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)Nc1cnn(C(F)F)c1	757867785	VRIPMNBLYVWTLI-UHFFFAOYSA-N	428.421	1.529	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)COc1ccc(-c2ccccc2)cc1Cl	758035281	KMASGYBJUUZZCA-LBPRGKRZSA-N	425.894	1.471	50	20	IDGD	
C[C@H](C1CC1)n1nccc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)C(F)F)cc1	760279548	CBYCCIFTHQGYDB-SNVBAGLBSA-N	427.433	1.932	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNS(=O)(=O)c1ccc(C(=O)O)cc1Cl	763439885	XFHJNVWJJGAGDK-UHFFFAOYSA-N	435.886	1.653	50	20	IDGD	
Cc1ccnc(Oc2ccc(NC(=O)C(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)cc2)n1	763441412	CUQNJHWFQNHVJN-UHFFFAOYSA-N	436.384	1.885	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3n2)cccc1N1CCOC1=O	763451183	WALNWKWWHPGPCN-UHFFFAOYSA-N	433.424	1.900	50	20	IDGD	
CC(=O)N1CCc2cc(NC(=O)C(=O)NNC(=O)c3ccccc3Br)ccc21	763482947	PKMHOYDGTAZCPI-UHFFFAOYSA-N	445.273	1.758	50	20	IDGD	
Cc1cccc(Cn2nccc2NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1	763571578	MZQALPQTUPGYOW-SFHVURJKSA-N	435.440	1.166	50	20	IDGD	
O=C(NNC(=O)c1ccccc1F)C(=O)Nc1ccc(C(=O)N2CCOCC2)c(Cl)c1	763574981	NHNOHTAFSUEFSC-UHFFFAOYSA-N	448.838	1.351	50	20	IDGD	
CNS(=O)(=O)c1ccc(C)c(NC(=O)C(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)c1	763728535	VSHQFEWGVOTGQF-UHFFFAOYSA-N	448.545	1.205	50	20	IDGD	
COc1cccc(-c2nsc(NC(=O)C(=O)NNC(=O)c3cccc(N(C)C)c3)n2)c1	763760261	JMWCAOGRYNMNFP-UHFFFAOYSA-N	440.485	1.679	50	20	IDGD	
Cc1cccc(NC(=O)C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)c1F	763791474	SICRWUIDGKVQTA-UHFFFAOYSA-N	425.420	1.825	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)C(=O)Nc1ccc(-c2ncco2)cc1	763804308	LEMXESXURVYJOC-UHFFFAOYSA-N	425.357	1.415	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccccc1OCC(F)(F)F	763806869	GFYYRGYFZSTFFY-UHFFFAOYSA-N	436.346	1.664	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(N3C[C@H](C)O[C@@H](C)C3)nc2)cc1	763820494	IIZHFHYAKZVLTE-HOTGVXAUSA-N	441.488	1.169	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cc(C)n(CCC#N)n2)cc1	763860461	HGQNJNJTTGYSQI-CQSZACIVSA-N	428.449	1.057	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2nn(-c3ccccc3)cc2C)cc1	763878592	RPOOJKIHPPGQOD-INIZCTEOSA-N	449.467	1.937	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccccc2OC[C@@H]2CCCCO2)n1	763885382	KSXDWRUIWSSIQB-INIZCTEOSA-N	429.477	1.234	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)Cc2ccc(F)cc2)cc1C(F)F	763920065	DMOUQJPMRGRXQP-UHFFFAOYSA-N	443.403	1.495	50	20	IDGD	
CCn1nnnc1-c1cccc(NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)c1	763973588	BXLFGBBIUKACKE-UHFFFAOYSA-N	429.824	1.119	50	20	IDGD	
Cc1nc(N2CCOCC2)ccc1NC(=O)C(=O)NNC(=O)c1cccc2ccccc12	764052203	SNWICYMCQHZECK-UHFFFAOYSA-N	433.468	1.780	50	20	IDGD	
CN1CCOc2ccc(NC(=O)C(=O)NNC(=O)c3cccc(Br)c3)cc21	764062985	IHWJVYQVSPQRGM-UHFFFAOYSA-N	433.262	1.677	50	20	IDGD	
CSc1cc2c(cc1NC(=O)C(=O)NNC(=O)[C@H]1Cc3ccccc3O1)OCCO2	764152438	DNGNWBJBQSZFLL-MRXNPFEDSA-N	429.454	1.269	50	20	IDGD	
CC1CCN(C(=O)c2ccccc2NC(=O)C(=O)NNC(=O)c2ccc(C#N)cc2)CC1	764177798	RGLNJCMGUBOOPA-UHFFFAOYSA-N	433.468	1.830	50	20	IDGD	
COC(=O)c1csc(NC(=O)C(=O)NNC(=O)c2cc(Br)ccc2O)c1	764280359	MZWDVVCGHMJQNK-UHFFFAOYSA-N	442.247	1.403	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)CCc2ccccc2O)ccc1C(=O)NC(C)C	764280743	GAAZEQOJMKKZTK-UHFFFAOYSA-N	426.473	1.558	50	20	IDGD	
C[C@@H](c1cccc(NC(=O)C(=O)NNC(=O)Cc2ccccc2F)c1)N1CCOCC1	764320406	FWNSLZLULXXRMR-HNNXBMFYSA-N	428.464	1.548	50	20	IDGD	
CCS(=O)(=O)c1cc(F)ccc1NC(=O)C(=O)NNC(=O)CCCc1cccs1	764338708	CJTOCNYKOVKKAF-UHFFFAOYSA-N	441.506	1.790	50	20	IDGD	
Cc1ccc(-c2nc3cc(F)ccc3n2C)cc1NC(=O)C(=O)NNC(=O)c1cnn(C)c1	764360020	RUIBFAPBEZAYGX-UHFFFAOYSA-N	449.446	1.821	50	20	IDGD	
COCCc1noc(-c2cc(Cl)ccc2NC(=O)C(=O)NNC(=O)c2ccc(C)o2)n1	764372272	SBPYFRNBAWOUEX-UHFFFAOYSA-N	447.835	1.880	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1ccc(-n2cccn2)cc1	764396685	AJEIHVUKQWBDEU-UHFFFAOYSA-N	425.470	1.759	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)NC[C@]2(OC)CCOC2)c2ccccc2c1=O	764808732	GXWIGTHRIKEVRO-OAQYLSRUSA-N	431.493	1.336	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C[C@@H]2CN(C(=O)OC(C)(C)C)CCO2)o1	765099605	WFMPVNPVVFYKDP-MRXNPFEDSA-N	438.525	1.908	50	20	IDGD	
O=C(CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)NNC(=O)CSc1ccccc1O	765248349	HEZGPAIZLAVPIP-UHFFFAOYSA-N	446.441	1.928	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)Nc2ccc(S(N)(=O)=O)cc2)n[nH]1	765308138	XIIWGEFMQDRHNO-UHFFFAOYSA-N	430.446	1.199	50	20	IDGD	
Cc1cccc(C)c1NC(=O)C(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	765567880	SZWZZDNNFVZFHB-UHFFFAOYSA-N	433.509	1.972	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCO[C@@H](c3ccc(OC(F)F)cc3)C2)n1	766266249	IHPQSDFLXLEZDC-OAHLLOKOSA-N	440.472	1.816	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@@H]3CC(=O)N(C4CCCC4)C3)CC2)cc1	766648726	KLEPQZDCORTMNQ-HXUWFJFHSA-N	441.576	1.051	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)[C@H]1CC(=O)N(c2ccc(Cl)cc2)C1	767285364	AEOPTIOJPUXKHP-INIZCTEOSA-N	443.887	1.935	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNS(=O)(=O)c1ccc(OC[C@H]2CCOC2)c(F)c1	767473156	KKPFKVBNXNLMPD-LBPRGKRZSA-N	447.485	1.075	50	20	IDGD	
CCCn1nc(C(=O)NNS(=O)(=O)c2cc(OC)cc(OC)c2)c2ccccc2c1=O	767734526	FRXVLDZLPMUVMO-UHFFFAOYSA-N	446.485	1.447	50	20	IDGD	
CN(NC(=O)c1coc(C2CCOCC2)n1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	768207064	NYNCDCBPTZSAFX-UHFFFAOYSA-N	437.497	1.818	50	20	IDGD	
CC(C)(C)OC(=O)NNC(=O)C(=O)Nc1ccccc1OCC(=O)Nc1cccnc1	768242155	PJFZTOOKUKPGLR-UHFFFAOYSA-N	429.433	1.594	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3cnn(C)c3-n3cccc3)n[nH]2)cc1OC	768279481	PNEPWBDZJILSHJ-UHFFFAOYSA-N	435.444	1.693	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNS(=O)(=O)c2c[nH]c3cccc(F)c23)ccc1Cl	769858983	IWILGLQBEKHMFD-UHFFFAOYSA-N	446.869	1.231	50	20	IDGD	
COC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(NC(=O)NNC(=O)C(C)(C)C)cc2)C1	769943980	XZDCPHKUBJYSCY-ZDUSSCGKSA-N	440.522	1.459	50	20	IDGD	
CS(=O)(=O)CCn1ccc(NC(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)n1	770038726	ILTYNQIJHSQIMY-UHFFFAOYSA-N	437.450	1.073	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc(S(=O)(=O)N(C)C)c1C	770418054	SQDVVTDJQUPQSS-UHFFFAOYSA-N	433.486	1.400	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)N1CCN(c2nccnc2C#N)C[C@H]1C	770647522	MQVGAXDLVMJRMC-ZIAGYGMSSA-N	443.895	1.720	50	20	IDGD	
C[C@]1(c2ccc(F)c(Cl)c2)NC(=O)N(CC(=O)NN=c2cc[nH]cc2Cl)C1=O	771477670	FJRBYEJEBCSHAI-QGZVFWFLSA-N	426.235	1.860	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)CCNS(=O)(=O)c1cccnc1	772973128	ZVFMTXSXMNNMNX-LBPRGKRZSA-N	426.882	1.018	50	20	IDGD	
COc1ccc(C(=O)N2CCOCC2)cc1NC(=O)C(=O)NNc1ccccc1[N+](=O)[O-]	773648194	OCJUQEVVMXMRER-UHFFFAOYSA-N	443.416	1.158	50	20	IDGD	
COC(=O)c1ccccc1CC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	775781532	DQSNDMDRWQECRV-UHFFFAOYSA-N	446.529	1.095	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H]2[C@@H](C)[C@H](OC)C2(C)C)c1	776065828	CYSQVJUDXLWPMW-XYPHTWIQSA-N	440.566	1.721	50	20	IDGD	
Cc1ccc(S(=O)(=O)C[C@@H](C)NC(=O)NNC(=O)Cc2cn3ccccc3n2)cc1	776193285	GYVQECLLGMFKLO-OAHLLOKOSA-N	429.502	1.378	50	20	IDGD	
C[C@H]1[C@@H](C)N(C(=O)OC(C)(C)C)CCN1C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	776316029	DZAGIVWRAPPSGW-UONOGXRCSA-N	444.496	1.346	50	20	IDGD	
CC(=NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1ccc(C#N)c(F)c1	776757884	BUQMORZEYSTFBM-UHFFFAOYSA-N	430.461	1.872	50	20	IDGD	
CCOC(=O)CN(CC(=O)NNC(=O)C1CC1)[C@@H](C)c1cccc(Br)c1	777713791	WUUGOWSELSLDCJ-LBPRGKRZSA-N	426.311	1.933	50	20	IDGD	
COC(=O)c1ccccc1S(=O)(=O)N1CCC(C(=O)NNc2ccc(OC)cn2)CC1	781533486	FDRSRLSIDDCMFK-UHFFFAOYSA-N	448.501	1.421	50	20	IDGD	
COC(=O)c1scc(C)c1NC(=O)C(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	782119992	CSGSOWDIXOKEJC-UHFFFAOYSA-N	443.441	1.134	50	20	IDGD	
O=C(NNC(=O)C1CCC1)Nc1ccc(CC(=O)N2CCN(c3ncccn3)CC2)cc1	782549057	OHAJMASVIAZSHJ-UHFFFAOYSA-N	437.504	1.321	50	20	IDGD	
Cc1nc(Br)ccc1NC(=O)C(=O)NNC(=O)Cc1nc2ccccc2n1C	782892389	CAZUWDLZVCAYKE-UHFFFAOYSA-N	445.277	1.368	50	20	IDGD	
Cc1ccc(NC(=O)OC(C)(C)C)cc1NC(=O)C(=O)NN[C@]1(C)CCS(=O)(=O)C1	783425897	JWQGKUUYEMCVEB-LJQANCHMSA-N	440.522	1.479	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNc2nccnc2Cl)cc(OC)c1Br	784776533	KMYRCMLQVQSYAY-UHFFFAOYSA-N	430.646	1.992	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2nccnc2Cl)cc1NC(=O)CN1CCCCC1	784780859	QTVKCDASPUVKJN-UHFFFAOYSA-N	445.911	1.945	50	20	IDGD	
COCCOC(=O)c1c(NC(=O)C(=O)NNc2ccc(F)cc2)sc(C(N)=O)c1C	784786468	WMJKGRUUYXBADZ-UHFFFAOYSA-N	438.437	1.180	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)cc1[N+](=O)[O-]	785099469	GKVASVXOGYZQBA-UHFFFAOYSA-N	449.370	1.856	50	20	IDGD	
C[C@H](CNC(=O)C(=O)Nc1ccccc1S[C@@H](Cl)C(F)(F)F)S(N)(=O)=O	785300586	VPUVHFYUADEZAO-JMCQJSRRSA-N	433.861	1.638	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)[C@H]2CCN(C(=O)OC(C)(C)C)[C@@H]2C)n1	786374748	ATNJCILRRJMOKN-OLZOCXBDSA-N	440.522	1.330	50	20	IDGD	
N#C/C(=C\C1CC1)C(=O)OCC(=O)N1CCN(S(=O)(=O)c2ccc(Cl)s2)CC1	786673457	HDFKVMLFTMEDMR-UKTHLTGXSA-N	443.934	1.638	50	20	IDGD	
CSCC[C@H](NC(=O)c1ccc([N+](=O)[O-])o1)C(=O)NNC(=O)NCc1ccccc1	787374960	UFJSBOFCQUTYRU-ZDUSSCGKSA-N	435.462	1.570	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NC[C@H](c1ccnn1C)C(C)C	788092771	QSLZPWXUOYHQPQ-AWEZNQCLSA-N	435.554	1.405	50	20	IDGD	
O=C(CCn1cnc2sc3c(c2c1=O)CCCC3)NNc1ccc(-n2ccnc2)nn1	788181875	ZNLWWNGEGGHHIC-UHFFFAOYSA-N	436.501	1.846	50	20	IDGD	
COC(=O)c1cc(Cl)cc(S(=O)(=O)NNC(=O)c2ccc(Cl)nc2)c1OC	790054354	LHPLCMWGRGWSLT-UHFFFAOYSA-N	434.257	1.807	50	20	IDGD	
CO[C@H]1CCOc2c(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc3ccc(F)cc3)cccc21	790952891	XLDDZMLDAJJOAA-PXAZEXFGSA-N	431.420	1.849	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2C[C@@H]3CN(Cc4ccccc4)C[C@@H]3C2)cc1OC	791621044	KSPUCKNKDWOVSN-BGYRXZFFSA-N	438.528	1.529	50	20	IDGD	
CN1CCC/C1=N\S(=O)(=O)c1ccc(NC(=O)NNc2nc3ccccn3n2)cc1	792248813	MXFHSMNXPHWMME-LFVJCYFKSA-N	428.478	1.691	50	20	IDGD	
CNC(=O)c1cc2cc(NC(=O)C(=O)NNC(=O)CN3CCCc4ccccc43)ccc2[nH]1	792355296	RYYBKOQYWGDPCR-UHFFFAOYSA-N	448.483	1.066	50	20	IDGD	
COc1ccc2cc(C(=O)OCC(=O)NNC(=O)Cc3nc(C)cs3)c(C)nc2c1	792712167	LEEBBQKKOHZJDK-UHFFFAOYSA-N	428.470	1.864	50	20	IDGD	
CO[C@@H]1CCC[C@@H](CC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)C1	792773422	RHFRCRXJYHBOIL-NVXWUHKLSA-N	439.534	1.064	50	20	IDGD	
Cc1nc2cc(F)c(F)cc2n1CC(=O)NNC(=O)C1CCN(c2ncccn2)CC1	793428615	ZSBGRAZYLCDARF-UHFFFAOYSA-N	429.431	1.477	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CS(=O)(=O)Cc2cccc(Br)c2)n1	794089804	JZZIRUFBCIUFLZ-UHFFFAOYSA-N	426.292	1.529	50	20	IDGD	
CC(C)(O)[C@H](Oc1ccccc1)C(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	795763553	LOWGBHWKPFZMAM-QGZVFWFLSA-N	431.401	1.118	50	20	IDGD	
O=C(COC(=O)C1CC(c2ccc(F)cc2)C1)NNC(=O)[C@@H]1COc2ccccc2O1	796111981	PQWJAIVZBJNMTL-ZOJXTTQQSA-N	428.416	1.850	50	20	IDGD	
C[C@H](C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1)[C@H]1OCCc2sccc21	796495633	RCYCKHVVVTVUOH-JOKNJTHLSA-N	446.481	1.529	50	20	IDGD	
Cc1c(/C=C(\C#N)C(=O)NCCN(C)S(=O)(=O)c2ccc(F)cc2)cc(C#N)n1C	798044970	DOQIUIIOVJRNJY-MHWRWJLKSA-N	429.477	1.688	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2cnn(-c3ccccc3OC)c2C)c2ccccc2c1=O	798829459	FSIHARWQSZSJOP-UHFFFAOYSA-N	446.467	1.994	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@@H]2C(=O)NNC(=O)c2cc(Br)c[nH]2)cc1	798845501	MDDLONFEFAJJDK-OAHLLOKOSA-N	435.278	1.852	50	20	IDGD	
O=C(NNC(=O)c1cccn1-c1c(Cl)cccc1Cl)N[C@H]1CCS(=O)(=O)C1	798929031	JXJZOBWSUSMRPZ-JTQLQIEISA-N	431.301	1.915	50	20	IDGD	
CN1CCN(CCNC(=O)NNC(=O)COc2ccc(Br)cc2)CC1(C)C	799397188	UMWXJLZTGSDIJM-UHFFFAOYSA-N	442.358	1.184	50	20	IDGD	
C[C@H](CCNS(=O)(=O)c1ccccc1)NC(=O)NNC(=O)c1cccc2ncccc12	801797785	MPTVOAUZSXZOES-OAHLLOKOSA-N	441.513	1.936	50	20	IDGD	
COCCNC(=O)[C@H](C)OC(=O)c1ccc(NC(=O)NNc2nc3ccccn3n2)cc1	806752356	ZRILAIIOMWHHLK-ZDUSSCGKSA-N	441.448	1.186	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2ccc(Br)cc2Cl)ccn1	806976895	YZPIRKGJAVKDJD-UHFFFAOYSA-N	427.642	1.906	50	20	IDGD	
CNS(=O)(=O)c1cc(NC(=O)C(=O)NNc2ccc(Cl)cc2[N+](=O)[O-])ccc1F	806997769	MHPYWWITNRQLOA-UHFFFAOYSA-N	445.816	1.377	50	20	IDGD	
CCn1nc(C(=O)NN=Cc2ccc(S(N)(=O)=O)c(Cl)c2)c2ccccc2c1=O	807953660	XMZSDKIXPANSCL-UHFFFAOYSA-N	433.877	1.481	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2n[nH]c3c(OC)cccc23)c1	809145220	OGBOEWNBEFHMCO-UHFFFAOYSA-N	445.501	1.677	50	20	IDGD	
O=C(CNc1ccccc1)NNC(=O)CNS(=O)(=O)c1cccc(C(F)(F)F)c1	809992280	LOCIOVDBILGXNS-UHFFFAOYSA-N	430.408	1.243	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)N(C[C@@H]2CCCO2)[C@H]2CCS(=O)(=O)C2)c1C	811966825	FUOKATWBUGYKPQ-YABWQAOZSA-N	449.573	1.853	50	20	IDGD	
Cc1cc(N2CCCC[C@@H]2C)ccc1NC(=O)C(=O)NNC(=O)[C@@H]1CCc2nncn2C1	815692407	QGSPOAJKENFVMZ-JKSUJKDBSA-N	439.520	1.314	50	20	IDGD	
C[C@@H](C(=O)NNc1ccccc1S(=O)(=O)N(C)C)C1CN(C(=O)OC(C)(C)C)C1	817053363	OCPSWIMNJLEKAU-CYBMUJFWSA-N	426.539	1.883	50	20	IDGD	
COc1cc(/C=C\C(=O)NNC(=O)N2CCN(C)CC2)ccc1OCc1c(C)noc1C	819721034	KYOJGOLDUJHMFT-VURMDHGXSA-N	443.504	1.880	50	20	IDGD	
CCn1c(SCC(=O)NNC(=O)COc2ccc(C#N)cc2)nnc1-c1ccco1	864017004	IIWJXJVJEPICRM-UHFFFAOYSA-N	426.458	1.748	50	20	IDGD	
CCOC(=O)Cc1csc(NC(=O)NNC(=O)c2nn(CC)c(=O)c3ccccc23)n1	875383819	MTUCLVDIFAOWDH-UHFFFAOYSA-N	444.473	1.445	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@@H]2C(=O)NNC(=O)Cn2cnc3ccccc32)s1	896463964	BABUITGNCJDXKM-MRXNPFEDSA-N	447.542	1.407	50	20	IDGD	
COCCN1C[C@H](C(=O)NNc2ccc(S(=O)(=O)c3ccc(C)cc3)cc2)CC1=O	914466465	DEICPMBHMRZMMU-MRXNPFEDSA-N	431.514	1.766	50	20	IDGD	
CCOc1ccccc1C(=O)N1CCC[C@@H]1C(=O)NNC(=O)Cn1cnc2ccccc21	914780641	ZVIPAQAPTXIXPQ-LJQANCHMSA-N	435.484	1.887	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)[C@H]2CCCN(S(=O)(=O)c3ccccc3)C2)cc1	915064727	LCCAUDYZJZVKEP-INIZCTEOSA-N	446.529	1.355	50	20	IDGD	
Cc1ccc2nc(COc3ccccc3C(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)cn2c1	915831984	DZAGGSCUHRFZGR-HNNXBMFYSA-N	442.497	1.417	50	20	IDGD	
CCN1CCC(NC(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)CC1	915903382	KOLXAFWTHDHTBI-UHFFFAOYSA-N	448.527	1.873	50	20	IDGD	
CN(C)CCOc1cccc(CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)c1	916387157	DNWQKYMENHKASL-UHFFFAOYSA-N	448.549	1.064	50	20	IDGD	
C[C@@]1(NNC(=O)NC[C@@H](c2ccccc2Cl)N2CCOCC2)CCS(=O)(=O)C1	916437932	RCAJVGUDAQLVTM-FUHWJXTLSA-N	430.958	1.094	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCCCN2C[C@H](C)C[C@@H](C)C2)nc1	916460616	OEJHLJIGIJSDAW-HZPDHXFCSA-N	426.587	1.762	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCCCNc2ccc(C)cn2)cc1	916521809	NTCPGBQRSDAMIZ-UHFFFAOYSA-N	448.549	1.152	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)c1	916733786	MXEHLCUCYCJZTO-UHFFFAOYSA-N	431.430	1.401	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)C2=NO[C@H](c3ccccc3)C2)c1	917495863	CCPJZBYPAVSMNE-IBGZPJMESA-N	444.513	1.996	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc(OC(F)(F)F)cc1)NNC(=O)CC(F)(F)F	918363961	FQPPOGDHRPHIHJ-UHFFFAOYSA-N	437.318	1.353	50	20	IDGD	
C[C@@H](Sc1nnnn1C1CC1)C(=O)NNC(=O)COc1ccc(Br)cc1	918403236	XDCRKCZLPPSANF-SECBINFHSA-N	441.311	1.478	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@H](C)C(=O)NNC(=O)CN(C)C(=O)[C@@H](C)n1cccn1	918688775	DRPIRJGYMUVLBT-HUUCEWRRSA-N	435.912	1.788	50	20	IDGD	
C[C@H](COc1ccc(F)cc1F)NC(=O)NNC(=O)c1csc(N2CCOCC2)n1	919922382	VVDOWGGSMBIESL-LLVKDONJSA-N	441.460	1.669	50	20	IDGD	
NC(=O)[C@H]1CCCN1Cc1cccc(NC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c1	920929730	LRYSIGOIWLBVFP-QGZVFWFLSA-N	426.433	1.511	50	20	IDGD	
CNS(=O)(=O)c1ccc(Br)c(C(=O)NNC(=O)c2cccc(C#N)c2)c1	1251623946	OXLZLOOZOMRZGK-UHFFFAOYSA-N	437.275	1.304	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCCCN2CCN(Cc3ccccc3)CC2)cc1	1317870290	RUZLAKAEAYZBFF-UHFFFAOYSA-N	425.533	1.847	50	20	IDGD	
COC(=O)c1ccsc1N1CC[C@H](NC(=O)NNC(=O)c2ccccc2Cl)C1=O	1318877350	QDYNQTFTAIZBJM-ZDUSSCGKSA-N	436.877	1.938	50	20	IDGD	
CCOC(=O)c1cnn(-c2ccc(NC(=O)NNC(=O)CCO)cc2)c1C(F)(F)F	1320227930	HYQKEAKXFGMMQX-UHFFFAOYSA-N	429.355	1.603	50	20	IDGD	
COc1cc(Cl)c(Br)cc1C(=O)NNC(=O)CNC(=O)c1ccco1	1326334691	DSQXOOKMZWORDQ-UHFFFAOYSA-N	430.642	1.895	50	20	IDGD	
CS(=O)(=O)Nc1ccccc1CNC(=O)NNC(=O)c1cnn(-c2ccccc2)c1	1328196199	ZFWAARXXWFCFFP-UHFFFAOYSA-N	428.474	1.388	50	20	IDGD	
COCCn1cc(NC(=O)NNc2ccccc2S(=O)(=O)NC(C)(C)C)ccc1=O	1337057482	LCYAYOKUJDCHNA-UHFFFAOYSA-N	437.522	1.720	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3c[nH]c4ccc(OC)cc34)C2)C1	1778509539	MCZUQOZHXNFVPT-LAUBAEHRSA-N	435.908	1.874	50	20	IDGD	
COC(=O)[C@@H]1CC[C@@H](C(=O)N2CCO[C@@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)C1	1779295153	ZBPGXSYUAGMZIN-JXXFODFXSA-N	426.586	1.257	50	20	IDGD	
CC(=O)Nc1cc(C(=O)N2CCO[C@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)ccn1	1779295690	WFXDCEKHWLXHHA-FQEVSTJZSA-N	434.569	1.335	50	20	IDGD	
CC(C)c1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C3)n[nH]1	1780155803	SGECPPNTGHRQRF-XMSQKQJNSA-N	448.568	1.034	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(CCN(C(=O)c3nn[nH]c3C(F)(F)F)C2)C1	1780361854	AQBVHNKENYCZNA-HNNXBMFYSA-N	435.479	1.119	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3nn[nH]c3C(F)(F)F)C2)C1	1780365872	SQISZOVVWKHYPV-OQPBUACISA-N	440.220	1.050	50	20	IDGD	
COc1cc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@](C)(Cl)CCl)C2)nn1C	1780714616	FQJGKTSBRAALRU-NIKGAXFTSA-N	447.363	1.793	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCc1cn[nH]c1)C2)[C@@H](F)Br	1780771162	UJUREQJUQHDRPD-FRFSOERESA-N	431.306	1.547	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(O)nc1)C2)[C@H](F)Br	1780773971	QNVQQBWHFRWXPH-HACGYAERSA-N	430.274	1.605	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)N2CC[C@@]3(CN(C(=O)[C@@H](F)Cl)CCO3)C2)C1	1781162622	RPYXYAXVYRSOBL-MDOVXXIYSA-N	447.935	1.998	50	20	IDGD	
COc1cccc(CC(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](O)CCl)C3)c1C	1782051930	FDHZTIZJULRSCZ-SFGWALBWSA-N	438.952	1.660	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCCn2ccnc2)C1	1782485661	YILLMRDWRVBQNZ-FRQCXROJSA-N	441.370	1.961	50	20	IDGD	
CCSc1cccnc1C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](Cl)COC)C2)C1	1783880400	BNQHTSILTMKKPQ-AUUYWEPGSA-N	427.954	1.891	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc(C(F)(F)F)cc3)C[C@@H]21)[C@H](O)CCl	1784090256	VYVATDICGADCSI-LLLHUVSDSA-N	448.869	1.827	50	20	IDGD	
C[C@H](C(=O)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1)C1(O)CCC1	1785830530	YWSZKMQLOXAQJD-MRXNPFEDSA-N	436.317	1.665	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(F)F)[C@H]2C1	1786457056	KYEHVBYJHRUPOF-CYDGBPFRSA-N	439.887	1.363	50	20	IDGD	
O=C(Cc1cscn1)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1	1788143892	SKGRRTBRISYTBN-UHFFFAOYSA-N	435.314	1.813	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]3C2)n1	1788765993	ZJPCPVVGFWJKRH-BQFCYCMXSA-N	448.596	1.485	50	20	IDGD	
CCOc1ncccc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]2C1	1789920895	FKUJIRNGGUQNDG-MXAVVETBSA-N	444.301	1.764	50	20	IDGD	
Cc1nn(C)c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]3C2)c1F	1789922354	KULFIAULMKMIAD-RMIALFOJSA-N	435.269	1.151	50	20	IDGD	
Nc1ccccc1/C=C/C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]2C1	1789922773	QETVQDAEDRRWEY-NJWIJXLQSA-N	440.313	1.952	50	20	IDGD	
CCN(C)[C@@H](C)C(=O)Nc1ccc(C2(NC(=O)c3cnccc3C(=O)NN)CCC2)cc1	1791018112	ZGNYNIWOWRKQJG-HNNXBMFYSA-N	438.532	1.773	50	20	IDGD	
CN(CC(=O)Nc1ccc(C2(NC(=O)[C@@H](F)Br)CCC2)cc1)C(=O)C(=O)O	1791097902	IHLNOYPDIGHQOY-CYBMUJFWSA-N	444.257	1.354	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccnc4c(O)cccc34)C[C@@H]21	1791256637	FQUGRHVTBKHOOH-KUZCPNRJSA-N	447.919	1.788	50	20	IDGD	
COC(=O)C1(C(=O)Nc2ccc(C3(NC(=O)c4cccc(B(O)O)c4)CCC3)cc2)CC1	1791309877	UNXJKYXRPNALPT-UHFFFAOYSA-N	436.273	1.067	50	20	IDGD	
Cc1cc(C)n(CCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Br)C[C@@H]32)n1	1791509085	YKGUJSGHUBNJGV-QBYUYEEZSA-N	445.333	1.560	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(Cl)cnc1O	1792390275	RIVOELNYPLWPSD-YDXZUZSKSA-N	436.723	1.880	50	20	IDGD	
O=C(Cn1ccc2ccc([N+](=O)[O-])cc21)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCl	1793106754	IXEZSUSOYKITJH-KRXQYRFLSA-N	434.880	1.787	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cccc2ncccc12	1793327878	BNERTCFYBMMJMN-HPNQWNLUSA-N	431.920	1.621	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C[C@H]1OCCc2ccccc21)c1ccc(B(O)O)cc1	1793487493	AYBXSRVHYDOMPL-ADYITMSISA-N	448.328	1.322	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1(F)CCCCC1	1797201284	DXNWYUSEISFKEM-MRRJVURZSA-N	447.511	1.382	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc2cc[nH]c12	1797644218	QLDCQCDWVMKGTB-MUJYYYPQSA-N	432.484	1.732	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1(F)CCC1)C2	1798522966	JHJPVPZXZWBBJZ-ZSBFGKGUSA-N	449.435	1.616	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@]1(C)C[C@@H]1C	1799165589	WPYCTHJDBHBBMP-DWDJSLCVSA-N	445.472	1.769	50	20	IDGD	
Cc1c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Br)nc2ccccn12	1799347475	NPQLFWQTTNXLCN-NOXHYTERSA-N	439.285	1.536	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN1C(=O)CSC1=S)C2	1800085185	VTYYZDIHIALRGN-ZAQLIGFBSA-N	438.402	1.721	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Cn1ccnc1)C2	1800644195	MUVNWBDRGFWCKT-RBZJEDDUSA-N	427.343	1.282	50	20	IDGD	
COC(=O)[C@H]1CCC[C@@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCBr)C3)C1	1800961917	DVGGJRHIASEMGB-LBKYZSNHSA-N	445.354	1.340	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3cc(O)ccc3n1)C2	1800978041	KCBSUVIFSFLLSA-MVWRLGRASA-N	433.892	1.397	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1C[C@H](NC(=O)OC(C)(C)C)C1	1802085060	LZZRJYGWRFMZHQ-WBAHDQRJSA-N	443.972	1.897	50	20	IDGD	
CC[C@H](NC(C)=O)C(=O)NC[C@@H]1CCN(C(=O)CO[Si](C)(C)C)[C@@H]1c1cccnc1	1802547621	HHSXBRODLKQMMF-CMKODMSKSA-N	434.613	1.854	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)COCc2ccccc2)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803139112	STFAXJKFVWYDLY-IRFCIJBXSA-N	431.920	1.904	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC2(CCCN(C(=O)c3ccc(Cl)nc3)C2)CC1	1804668853	IZMBGVRSVFJSAH-UHFFFAOYSA-N	435.956	1.953	50	20	IDGD	
Cc1ccc(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)cn1	1805455570	UTVIGRXQXPQRLZ-DENIHFKCSA-N	444.300	1.098	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)C2(N3CCN(C)CC3)CC2)[C@@H]1c1cccnc1	1807950288	GBYWIJXKKWJYRO-AABGKKOBSA-N	448.011	1.885	50	20	IDGD	
O=C(CCCn1cccc1)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1	1809980269	SXXTWVUFTOKVSC-UHFFFAOYSA-N	437.349	1.493	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1CCc2nc(NC(=O)CN3CCOCC3)sc2C1	1814568718	DZAQACIBQLUHRL-PIGZYNQJSA-N	435.377	1.624	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)Cc3nnc(C)s3)sc2C1	1815583610	MHEGOTPWZNAQET-VHSXEESVSA-N	429.955	1.712	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(O)nc(O)n3)sc2C1	1817099604	YQFXWDAOIPBXBV-BDAKNGLRSA-N	425.898	1.978	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)C[C@@H](NC)C(=O)O)n[nH]1	1817368074	GWACFLNQPCOARC-CYZMBNFOSA-N	444.330	1.638	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)c(C)n1C	1817477069	YBDACDPCOAKWLB-FQEVSTJZSA-N	449.320	1.665	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@H](O)CCl)CC3)o1	1819783450	XWCBNIUGDCGSQU-GXSJLCMTSA-N	426.882	1.520	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)CN2CCCC2=O)[nH]n1)[C@H](F)Br	1820932327	GEUQRAYYCLKFSR-ABAIWWIYSA-N	430.278	1.715	50	20	IDGD	
C=CCNC(=O)/C=C\C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](F)Br)n[nH]1	1820933747	CRRPVRPYMAUQOO-GORHOLETSA-N	442.289	1.951	50	20	IDGD	
CCS(=O)(=O)N[C@@H](C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)C(Cl)Cl)n[nH]1	1822419366	WWKFWYLZRUWEIF-ONGXEEELSA-N	440.353	1.533	50	20	IDGD	
CN1CCN(C2(C(=O)Nc3nc4c(s3)C[C@H](NC(=O)C(Cl)Cl)CC4)CC2)CC1	1822721725	QRGFWLJZTDBISX-LLVKDONJSA-N	446.404	1.639	50	20	IDGD	
O=C(CSc1nc[nH]n1)N[C@@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1	1823014079	NXFUUVIRSLACKV-LDWIPMOCSA-N	449.331	1.656	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CN1CCSCC1)CC2	1825632296	RDTABKNNUNNDMD-GHMZBOCLSA-N	447.424	1.887	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@H]1CCc2nc(NC(=O)CCn3cncn3)sc2C1	1826601962	STRRXAJCXAQPJJ-QWRGUYRKSA-N	441.355	1.768	50	20	IDGD	
C[C@H](C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](F)Br)CC2)n1cncn1	1826799834	VZWJGJRKEUGQLA-XLDPMVHQSA-N	431.291	1.598	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H]2C[C@@H](O)C2)CC1	1828366323	MCSRQNIXSNGLCJ-WBJNETPZSA-N	443.548	1.511	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC([C@@H]2CCCCN2C(=O)C2=NNC(=O)C2)CC1	1828863082	HLCNIUUZKQJLNV-HIFRSBDPSA-N	427.343	1.656	50	20	IDGD	
CN(CC(=O)N1CCC([C@H]2CCCCN2C(=O)CO[Si](C)(C)C)CC1)C(=O)C(=O)O	1829104219	UFGHMUSDYNYLCT-MRXNPFEDSA-N	441.601	1.001	50	20	IDGD	
CC(=O)O[C@@H](C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2)C(C)C	1830361734	BBDWOGXUOATKLS-UZLBHIALSA-N	432.945	1.296	50	20	IDGD	
Cc1ccc2[nH]cc(CC(=O)N3CCOC[C@]4(C3)CN(C(=O)[C@@H](O)CCl)CCO4)c2c1	1830726208	PJBUHTYQTBHIQY-UGKGYDQZSA-N	449.935	1.075	50	20	IDGD	
Cc1ccc(SCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)cc1	1830731464	LRNPRRKQBDYDNY-FXAWDEMLSA-N	442.965	1.143	50	20	IDGD	
CCC1(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)COC1	1831274876	HIVROYYPLAWJCY-FQEVSTJZSA-N	428.338	1.026	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cnc(C)s3)C2)C1	1831656730	IQJUIOFYAKWOOL-VQIMIIECSA-N	429.970	1.858	50	20	IDGD	
C[C@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1)n1cccc1	1832107259	DXXHSCPJULLGNB-XMSQKQJNSA-N	437.349	1.662	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)C3CCN(C(C)C)CC3)CCO2)C1	1832415015	GUZKJFQTHIPRQK-WIYYLYMNSA-N	429.989	1.581	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@H](C)n3ccnc3)CC2)CC1	1833378885	WLPJVTHJVHTIQR-MAUKXSAKSA-N	425.961	1.270	50	20	IDGD	
Cn1nc(C(=O)NC2CCN(C3CCN(C(=O)[C@H](F)Br)CC3)CC2)cc1O	1833944816	SIUBBZOMTWEUHO-HNNXBMFYSA-N	446.321	1.001	50	20	IDGD	
O=C(O)c1cc(C(=O)NC2CCN(C3CCN(C(=O)C(Cl)Cl)CC3)CC2)ncn1	1833968097	HFWIHTHKVYDDBY-UHFFFAOYSA-N	444.319	1.164	50	20	IDGD	
Cn1nc(C(=O)N2CCC(N3CCC(NC(=O)[C@H](F)Cl)CC3)CC2)c2c1CCC2	1835080554	NRHBCLPAJJWFJN-SFHVURJKSA-N	425.936	1.628	50	20	IDGD	
O=C(CCC(F)(F)F)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1835325027	BLRQXTXFLGQNCM-WCQYABFASA-N	435.212	1.476	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc4nccn4c3)CCO2)C1	1836574322	QYXJTWQZXAYWJO-LAUBAEHRSA-N	434.924	1.812	50	20	IDGD	
Cc1cc(C(=O)N2CCC(OC3CCN(C(=O)[C@H](O)CCl)CC3)CC2)nc2nccn12	1836719355	QEQQXJQASLYMEJ-GOSISDBHSA-N	449.939	1.250	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3nccc(OC)c3OC)CCO2)C1	1838841201	KGDXMIOXAGUFKO-VBKZILBWSA-N	441.912	1.186	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)cc1	1839201899	NAPKYINEEANYFD-MAUKXSAKSA-N	429.286	1.756	50	20	IDGD	
O=C(c1ccc(OC(F)F)cc1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1839331089	RZNXSGXQGJNZGY-KBXCAEBGSA-N	436.814	1.892	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3ccc(C#N)cc3)C2)C1	1840149662	WPKZULSFOCTGQT-UGKGYDQZSA-N	449.935	1.201	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4c(C)cccc4[nH]3)C2)C1	1840153360	LWALBFFTHNMBPT-VGSWGCGISA-N	449.935	1.800	50	20	IDGD	
O=C(C(Cl)Cl)N1CCO[C@@]2(COCCN(C(=O)C3(C(F)(F)F)CCC3)C2)C1	1840188065	MARMZRZAJWUCOT-AWEZNQCLSA-N	433.254	1.979	50	20	IDGD	
Cc1ccc(OCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)cc1	1840188230	YBIKKDVDFFYULQ-LJQANCHMSA-N	431.316	1.634	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)n1cccc1)CCO2	1840348337	KHOFLNCIZGHQEG-MDZRGWNJSA-N	442.354	1.537	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CCN3CCCC3)CCO2)C1	1840940952	NEHDWJWJRFRPFO-QFBILLFUSA-N	446.386	1.102	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1[C@H](C(=O)N1CC3(CCCN3C(=O)[C@H](O)CCl)C1)C2	1841354663	NDYZHUSLLIQMLK-XUWVNRHRSA-N	441.956	1.578	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)c2c[nH]c3cccc(Cl)c23)C1	1844144969	HYOCQXCAYSNHSK-UHFFFAOYSA-N	437.692	1.632	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC2(CCCN2C(=O)c2nc(O)n3c2CCCC3)C1	1844397862	SHLZUZWYXBVCAG-LBPRGKRZSA-N	425.327	1.916	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC2(CCCN2C(=O)c2cc(=O)nc3sccn23)C1	1844625638	JZGMBKIHZAFKLR-NSHDSACASA-N	439.335	1.747	50	20	IDGD	
COc1cc(/C=C/C(=O)N2CCCC23CN(C(=O)[C@@H](O)CCl)C3)cc(OC)c1OC	1845948999	IMJDWGCWIPWTHC-NFAHFFEMSA-N	438.908	1.529	50	20	IDGD	
Cc1snc2sc(C(=O)N3CC4(CCCN4C(=O)CCC(=O)NN(C)C)C3)cc12	1846384634	PIDAMYPIKFLIGY-UHFFFAOYSA-N	435.575	1.856	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)COc1ccc(Cl)c(F)c1	1847772303	SMGYLSVWQPDVAM-IRXDYDNUSA-N	440.903	1.433	50	20	IDGD	
CCOC(=O)Nc1ccc(C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1	10702442	HWISQGXYONAEMO-UHFFFAOYSA-N	430.373	1.781	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1C	15886674	FKRAQYKAGYQVDG-UHFFFAOYSA-N	431.514	1.928	50	20	IDGD	
COc1ccc(-c2n[nH]c(=S)n2CC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1	17330256	RWXXLGPUCIMVKQ-UHFFFAOYSA-N	428.430	1.986	50	20	IDGD	
CCOC(=O)/C(C#N)=C/NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2OC)c1	18988597	WBXQOJTYAQNXHF-FYWRMAATSA-N	444.469	1.701	50	20	IDGD	
CCOc1cc([N+](=O)[O-])c(C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1OC	27147439	MPHQQYJLMBLJCN-UHFFFAOYSA-N	437.430	1.480	50	20	IDGD	
CNS(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=O)c2cc(-c3ccccc3)on2)c1	27261190	WEUSHLUGCKFCRH-UHFFFAOYSA-N	434.861	1.978	50	20	IDGD	
CS(=O)(=O)N1CCC[C@H]1C(=O)NNC(=O)CCCOc1ccc(Cl)cc1Cl	105113745	BKPZBEUNSGPWFQ-ZDUSSCGKSA-N	438.333	1.724	50	20	IDGD	
CCOC(=O)C1=NN(c2ccccc2)[C@H](C(=O)NNC(=O)[C@H]2COc3ccccc3O2)C1	110673695	FVJBHVGDODNWLT-QFBILLFUSA-N	438.440	1.172	50	20	IDGD	
COCCCNC(=S)N(C)NC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccccc1	726075747	FIHVLHMIFXFLMS-IBGZPJMESA-N	428.558	1.902	50	20	IDGD	
C[C@]1(c2ccc(CNC(=O)NNC(=O)C34CC5CC(CC(C5)C3)C4)cc2)NC(=O)NC1=O	726281595	AEPFDRLILADGAL-ACBHSLRGSA-N	439.516	1.788	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)CS(=O)(=O)NC2CCC(C)CC2)cc1	726869000	LWKKSLPLPDKNCB-PCKAHOCUSA-N	441.550	1.498	50	20	IDGD	
O=C(NCCc1cccc(O)c1)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	727239464	HYYOFDXNBIKYAB-UHFFFAOYSA-N	432.502	1.363	50	20	IDGD	
CSC[C@H](C(=O)NNc1nc(-c2cccnc2)no1)N1C(=O)[C@H]2CCCC[C@H]2C1=O	728079577	YHRWNTLJWXRJEO-HZSPNIEDSA-N	430.490	1.482	50	20	IDGD	
CCOc1ccccc1[C@H](CC(=O)NNC(=O)c1ccc2c(c1)OCCO2)NC(C)=O	728234242	GCPAJJLUVYTYRZ-KRWDZBQOSA-N	427.457	1.885	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)CCC(=O)c2ccc(F)cc2F)n1	728733618	YWGXKBXCDLUSFU-UHFFFAOYSA-N	425.413	1.626	50	20	IDGD	
O=C(CCCNC(=O)NC1CCCCC1)NNC(=O)C1CCN(c2ncccn2)CC1	728889380	GBQXXMANQWIMPC-UHFFFAOYSA-N	431.541	1.253	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@@H](c2ccccc2)N2CCC(O)CC2)cc(OC)c1OC	729282812	JMYFLZUPCMBDPD-HXUWFJFHSA-N	443.500	1.671	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)nc2c1cnn2Cc1ccco1)c1cnn[nH]1	729456803	IPUKAHYJINTYPZ-UHFFFAOYSA-N	428.412	1.933	50	20	IDGD	
O=C(O)COc1ccc(S(=O)(=O)NNC(=O)c2cccc3ncccc23)cc1Cl	730203477	AJUOOHZVKBAHJX-UHFFFAOYSA-N	435.845	1.975	50	20	IDGD	
O=C(NNC(=O)[C@H]1CC(=O)N(c2ccc3c(c2)OCCO3)C1)c1cccc2ncccc12	730227807	NRBYKKHRTLBLLE-AWEZNQCLSA-N	432.436	1.820	50	20	IDGD	
O=C(NN=Cc1cc(Br)c(O)c(Br)c1)[C@@H]1CCS(=O)(=O)C1	730576532	RQCZTIGOJDCUHY-MRVPVSSYSA-N	440.113	1.802	50	20	IDGD	
COC(=O)c1ccc(S(=O)(=O)NNC(=O)c2cc(OC)ccc2Br)o1	730767430	UHYAPQSYVIHGJJ-UHFFFAOYSA-N	433.236	1.461	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)COc1ccccc1O)N1CCN(c2ccccc2)CC1	730820669	SIYLBDLPCSCMLM-QGZVFWFLSA-N	427.505	1.312	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)NC1CCN(S(=O)(=O)c2ccc(C)cc2)CC1	731542774	PXAARFNZRBRCEX-UHFFFAOYSA-N	446.529	1.801	50	20	IDGD	
COc1ccc(-c2noc(CCC(=O)NNC(=O)CCN3C[C@H](C)O[C@H](C)C3)n2)cc1	732260222	QJKPPIPDVYBQLQ-GASCZTMLSA-N	431.493	1.325	50	20	IDGD	
C=CCOc1ccccc1CNC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1	732473463	PYEUVXJIMNNUGV-UHFFFAOYSA-N	446.529	1.711	50	20	IDGD	
CC(C)n1ccc(CNC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)n1	739052047	ODKJCRSSQGDOGE-UHFFFAOYSA-N	434.522	1.393	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)c2ccc(C[C@@H]3CC(=O)NC3=O)cc2)cc1OC	741144562	VPPLDLQAPGHJNK-MRXNPFEDSA-N	425.441	1.374	50	20	IDGD	
O=C(NNc1ncnc2[nH]cnc12)c1ccc(S(=O)(=O)NCCc2cccs2)cc1	743469773	VJLDGWJJDRNZTB-UHFFFAOYSA-N	443.514	1.692	50	20	IDGD	
NS(=O)(=O)c1ccc(CCNC(=O)NNC(=O)c2cccc(Br)c2)cc1	743686440	CEHYZEJLOCJFDU-UHFFFAOYSA-N	441.307	1.283	50	20	IDGD	
O=C(CCN1C(=O)COc2ccccc21)NNC(=O)c1cc(Br)ccc1O	743730747	FEHGBVGWRWBVAG-UHFFFAOYSA-N	434.246	1.731	50	20	IDGD	
O=C(NNc1ccc(Cl)nc1)c1ccc2c(c1)S(=O)(=O)N(C[C@H]1CCCO1)C2=O	743816960	OKAKGUTYKUHQBY-CYBMUJFWSA-N	436.877	1.815	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)CS(=O)(=O)Cc2ccc(Cl)s2)c1	744504813	VKLHJHHYTFCNDK-UHFFFAOYSA-N	444.918	1.629	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)CNC(=O)c2ccc(Br)o2)c1	744568824	WVAMDKACHQYIIP-UHFFFAOYSA-N	438.234	1.085	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)N[C@H]1CCN(Cc2ccccc2)C1=O	744877864	JXWWGPGKSRAHCY-KRWDZBQOSA-N	426.473	1.596	50	20	IDGD	
CCC(=NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)C1CCOCC1	745192792	RSOMGMDUBBOYGB-UHFFFAOYSA-N	437.562	1.949	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CCOc2ccc(S(C)(=O)=O)cc2)cc1C	746516361	LYQUPCVTZHOMPN-UHFFFAOYSA-N	433.486	1.262	50	20	IDGD	
N#Cc1ccc(C(=O)NNS(=O)(=O)c2ccc([N+](=O)[O-])cc2Br)cc1	746591457	LVBSWHSQOJGOQT-UHFFFAOYSA-N	425.220	1.852	50	20	IDGD	
O=C(NN=Cc1c(N2CCOCC2)nc2ccccn2c1=O)c1cccc2cccnc12	747356111	MXZBBGOAHGHNIW-UHFFFAOYSA-N	428.452	1.843	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)C1CCN(S(=O)(=O)c2ccc(F)c(Cl)c2)CC1	747598030	OZNWLTKYJGMARV-UHFFFAOYSA-N	442.900	1.680	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)NCCc1ccc(I)s1	748626674	DXUYERYFEGMBOX-VIFPVBQESA-N	441.291	1.277	50	20	IDGD	
CCN1CCN(c2ccc(F)cc2[C@H](C)NC(=O)NNC(=O)[C@@H](C)OCCOC)CC1	748628026	PCJPZICSFJSFQU-JKSUJKDBSA-N	439.532	1.411	50	20	IDGD	
O=C(Cn1nc(Br)nc1Br)NNC(=O)c1ccccc1Cl	748634490	XINGCYZTROMZJX-UHFFFAOYSA-N	437.479	1.918	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)CNC(=O)c1cc(-c2ccccc2)on1	749400386	ILASRSUJBDJJPN-UHFFFAOYSA-N	438.440	1.697	50	20	IDGD	
Cc1ccccc1CC(=O)N1CCN(CC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)CC1	749908152	RWWQFZDSJQJLPZ-UHFFFAOYSA-N	439.472	1.051	50	20	IDGD	
C[C@@H]1CN(S(=O)(=O)N2CCN(/C(=C\C#N)c3ccc([N+](=O)[O-])cc3)CC2)C[C@@H](C)O1	750035592	GJIHTYAZCFUNSU-HQMBXYIKSA-N	435.506	1.431	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)Nc1ccc(C(=O)NCc2ccc(F)cc2)cc1	756060524	COIJHHHFQGXGLQ-HNNXBMFYSA-N	448.476	1.343	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)Nc2ccc(OC)c(NS(C)(=O)=O)c2)cc1	756781638	HPZAFYOSCNFVDT-UHFFFAOYSA-N	438.462	1.307	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)CN2C(=O)NC3(C[C@@H](C)C[C@H](C)C3)C2=O)c1	757733121	KTJJLRQXZMYUSK-KBPBESRZSA-N	431.493	1.001	50	20	IDGD	
CC(=O)N1CCc2cc(C(=O)NN(C)C(=O)N3CCN(C(=O)OC(C)(C)C)CC3)ccc21	758781404	BINLRLWCAPPSPM-UHFFFAOYSA-N	445.520	1.845	50	20	IDGD	
CO[C@](C)(C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1)c1ccccc1F	759294932	QLQMLOXNJWNJMU-UWJYYQICSA-N	432.404	1.218	50	20	IDGD	
CNc1nnc(CC(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)s1	759407711	HOVVRIBBSGDZDK-UHFFFAOYSA-N	449.500	1.285	50	20	IDGD	
CCOc1ccccc1N1C[C@@H](C(=O)NNc2nccc(N3CCOCC3)n2)CC1=O	762853082	QAQSSIRIIRFXAD-HNNXBMFYSA-N	426.477	1.208	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(C)(C)S(=O)(=O)c2ccc(Br)cc2)n[nH]1	763117962	ARRRSFNBWFZBRF-UHFFFAOYSA-N	429.296	1.494	50	20	IDGD	
O=C(NNC(=O)c1ccccc1)C(=O)N1C[C@@H](C(=O)N2CCCCC2)Oc2ccccc21	763424465	ABWBIOVYCJNYBM-IBGZPJMESA-N	436.468	1.254	50	20	IDGD	
Cc1cc(C(=O)NCC(C)C)ccc1NC(=O)C(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	763468955	ZBBPAKNWQVRXPQ-UHFFFAOYSA-N	441.444	1.689	50	20	IDGD	
N#Cc1cccc(-c2csc(NC(=O)C(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)n2)c1	763472232	UIUNTBGJFXIWLX-UHFFFAOYSA-N	436.409	1.990	50	20	IDGD	
O=C(NNC(=O)c1cc2ccccc2cc1O)C(=O)Nc1ccn(Cc2ccncc2)n1	763521637	HJMYHQOAMYWADE-UHFFFAOYSA-N	430.424	1.585	50	20	IDGD	
O=C(NNC(=O)c1ccccc1F)C(=O)Nc1ccc2c(c1)CCN2C(=O)c1cccnc1	763567692	AKITXAZILGQPQR-UHFFFAOYSA-N	447.426	1.823	50	20	IDGD	
COC(=O)[C@@H]1CN(C(=O)C(=O)NNC(=O)c2cc(C)nc3ccccc23)c2ccccc2O1	763616456	UQSKNVMDBMPJEP-IBGZPJMESA-N	448.435	1.271	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2c(C)nc3ccccn23)n(Cc2ccccc2)n1	763628637	KYQVVVMQWMYOMR-UHFFFAOYSA-N	431.456	1.596	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(C)n(-c2cccc(F)c2)n1	763663541	VBWONZRWFYXHTP-UHFFFAOYSA-N	441.419	1.493	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccccc2N2CCN(C)CC2)cc1C	763664759	FVOJNQJYMOAEOW-UHFFFAOYSA-N	439.516	1.220	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2cc3c(cc2F)CCC(=O)N3)c1	763669654	YGGPCINVGRXNKA-UHFFFAOYSA-N	428.420	1.492	50	20	IDGD	
CCOc1cc2c(cc1NC(=O)C(=O)NNC(=O)COc1ccc(C#N)cc1)O[C@@H](C)C2	763673586	HDAYDYYWOLWKFD-ZDUSSCGKSA-N	438.440	1.445	50	20	IDGD	
CC[C@@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cccc(N(C)C)c2)cc1	763759610	ZWNOOSIOCPNWKN-CQSZACIVSA-N	425.489	1.681	50	20	IDGD	
Cc1cc(Oc2ncccn2)ccc1NC(=O)C(=O)NNC(=O)COc1ccccc1C#N	763806246	ABRTZAWLVBCPSC-UHFFFAOYSA-N	446.423	1.614	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)OCCCO3)cc1	763861847	RBLMSRKZFBFWKU-CQSZACIVSA-N	443.456	1.800	50	20	IDGD	
CN(C)C(=O)c1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)Cc1c[nH]c2ccccc12	763865117	JKUODQPJWHSNMS-UHFFFAOYSA-N	441.875	1.852	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccc3c(c2)ncn3-c2ccccc2)n1	763892367	ZOGOIZGPYQUKLJ-UHFFFAOYSA-N	431.456	1.625	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)C(=O)Nc1cccc(N2CCCC2)c1	763943339	FXQMHSHSANYSPO-UHFFFAOYSA-N	434.456	1.578	50	20	IDGD	
Cn1nc(C2CCCC2)cc1NC(=O)C(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	763947536	BWCQTBPVNGRGSQ-UHFFFAOYSA-N	437.460	1.369	50	20	IDGD	
CCCCOc1ccc(OC)cc1NC(=O)C(=O)NNC(=O)[C@@H]1Cc2ccccc2O1	764154125	OGIQHYWRMMNNBJ-IBGZPJMESA-N	427.457	1.964	50	20	IDGD	
CC(C)NC(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)c2ccc(C#N)cc2)c1	764183311	WRDFDBBRCRTYJB-UHFFFAOYSA-N	427.848	1.750	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)C(=O)Nc2cc(C)cnc2OC)c1	764230697	JQRMGFASTUHIMA-UHFFFAOYSA-N	437.250	1.569	50	20	IDGD	
Cn1c(C(C)(C)C)nc2cc(NC(=O)C(=O)NNC(=O)COc3ccccc3O)ccc21	764276689	ARZRQABBMMSKGX-UHFFFAOYSA-N	439.472	1.741	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)C(=O)Nc1ccc(F)cc1OCC(F)F	764281078	KFFXXQPHBZZOMY-UHFFFAOYSA-N	425.363	1.894	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)n(-c2ccccc2)n1	764346369	YGYATQQGNUYXCF-UHFFFAOYSA-N	429.440	1.766	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2ccnn2C(C)(C)C)n[nH]1	764376330	BQCZSJZGKMMECN-UHFFFAOYSA-N	425.449	1.437	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc(C(=O)N(C)C)cc3)n[nH]2)cc1	764385172	UTGZALJSYZHMMS-UHFFFAOYSA-N	448.483	1.741	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1cccc(Cn2cccn2)c1	764394998	YCCWGIPPSHMDLI-UHFFFAOYSA-N	439.497	1.818	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)C[C@@H]3COC(=O)C3)c2)c(C)c1	764464036	LWJBCLHCFIAJCV-HNNXBMFYSA-N	445.497	1.818	50	20	IDGD	
CCn1cc(NC(=S)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)cn1	764519768	XOBZCMQHKGESPK-UHFFFAOYSA-N	435.985	1.692	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)CCNC(=O)c3ccco3)n[nH]2)cc1OC	765597751	WVYVLVGYMOBKKY-UHFFFAOYSA-N	427.417	1.268	50	20	IDGD	
COc1ccc(CC(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)cc1	765753075	UZQXUYWWARPCLI-UHFFFAOYSA-N	430.936	1.856	50	20	IDGD	
Cc1c(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cnn1C(C)(C)C	766652464	PNPXSENVURGHMO-UHFFFAOYSA-N	426.521	1.166	50	20	IDGD	
COc1cccc(OCCN2CCN(CC(=O)NNC(=O)c3cccc(C)c3)CC2)c1	767041260	FTIAGVGDYFALHT-UHFFFAOYSA-N	426.517	1.461	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2c[nH]nc2-c2c(F)cccc2F)c1	767733868	HBFKEBLBYRLOFR-UHFFFAOYSA-N	449.439	1.680	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](OCC(=O)NNC(=O)c2ccc3c(c2)OCCO3)C1	767830652	KOFKGBAAXIZXEX-OAHLLOKOSA-N	435.477	1.635	50	20	IDGD	
Cc1cccc(NNC(=O)CCC(=O)N2CCN(S(=O)(=O)c3ccc(F)cc3)CC2)c1	767862193	JIHUDDAZVDNRJB-UHFFFAOYSA-N	448.520	1.891	50	20	IDGD	
CC(C)c1ccnc(N2CCN(CC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)CC2)n1	767889373	GCGQYPCIPSWHTH-UHFFFAOYSA-N	427.465	1.091	50	20	IDGD	
O=C(CCC(=O)N1CCN(c2ncccn2)CC1)NNc1ccc(Br)nc1	768029244	LEROXEPBMOKJAV-UHFFFAOYSA-N	434.298	1.206	50	20	IDGD	
CCn1cc(S(=O)(=O)NNC(=O)c2nn(CCC(C)C)c(=O)c3ccccc23)nc1C	768036352	PITLKJHMZPFNSG-UHFFFAOYSA-N	446.533	1.591	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(F)cc1C(=O)N(C)C	768236968	IEKSMLOQTOBLEL-UHFFFAOYSA-N	430.436	1.255	50	20	IDGD	
COc1ccc(NNC(=O)CN2C(=O)N[C@@](C)(c3ccc(C)cc3)C2=O)c([N+](=O)[O-])c1	768331518	BHFNCBXJZCMCNO-FQEVSTJZSA-N	427.417	1.822	50	20	IDGD	
CCOC(=O)c1[nH]c(C)c(S(=O)(=O)NNC(=O)c2ccc(OC)c(OC)c2)c1C	768497818	SCUCXWIYIBLEFC-UHFFFAOYSA-N	425.463	1.449	50	20	IDGD	
O=C(NCc1nc2c(s1)C[C@H](c1ccccc1)CC2)NNC(=O)C(=O)N1CCCC1	768516738	DEWCWHQYAAMQSP-OAHLLOKOSA-N	427.530	1.868	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)c1c[nH]n2c1nc(=O)c1ccccc12	768639438	QNGMXXWHDSYRSY-UHFFFAOYSA-N	427.442	1.345	50	20	IDGD	
C[C@@]1(c2cccc(C(=O)NNC(=O)Cc3nc(-c4ccccc4)cs3)c2)NC(=O)NC1=O	768929813	SQZSFLMFMMZLPT-QFIPXVFZSA-N	449.492	1.868	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc3nnc(C(C)(C)C)n3c2)c1	769539850	ZAYNACVFOCEEDV-UHFFFAOYSA-N	444.517	1.352	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)NNC(=O)CSc1ccccc1O	770650500	VPUJBWODNRWDFW-NSHDSACASA-N	438.893	1.967	50	20	IDGD	
CCOC(=O)N1CC[C@H](NC(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)C1	771380664	WVRWHNCOMPSPMZ-ZDUSSCGKSA-N	430.465	1.152	50	20	IDGD	
Cc1cnc2c(S(=O)(=O)NNC(=O)C(=O)NCc3ccc(Cl)cc3)cccc2c1	771609250	YCRMUGFNKIASEW-UHFFFAOYSA-N	432.889	1.823	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)CCNS(=O)(=O)c1ccccc1	772953975	NWJQEGAWDABHIO-ZDUSSCGKSA-N	425.894	1.623	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@H](O)Cc3ccccc3Cl)CC2)cc1	773390964	CKFDQHVNOCSIHS-OAQYLSRUSA-N	444.963	1.517	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1nc(-c2nccn2C)cs1	774008026	DRRGGVYAKJURRX-JTQLQIEISA-N	448.892	1.750	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNS(=O)(=O)c2ccc3ncsc3c2)ccc1Cl	775251865	BRAHYLIJKOWOMN-UHFFFAOYSA-N	446.919	1.220	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NCC(=O)NNc2ccc(C(F)(F)F)cn2)c1	775257469	LRBYCHPRYLZGPR-UHFFFAOYSA-N	445.423	1.224	50	20	IDGD	
CC(C)c1cc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc(O)n1	775521473	PTIOLAKTTWRNFW-UHFFFAOYSA-N	432.502	1.770	50	20	IDGD	
Cc1ccc(-n2cc(C(=O)NN(C)C(=O)N3CCN(C(=O)OC(C)(C)C)CC3)nn2)cc1	776206160	QAINEXWFSFLNKR-UHFFFAOYSA-N	443.508	1.825	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccc(NC(=O)/C(C#N)=C/c3ccc(O)cc3)c2)CC1	776636664	VCWFYPAJXSGVSH-GHRIWEEISA-N	426.498	1.874	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)nn1-c1ccc(Cl)cc1Cl	776707445	ZAMOCKQRUAFUHY-LLVKDONJSA-N	446.316	1.619	50	20	IDGD	
CCOc1ccc(-n2c(SCC(=O)NN(C)C(N)=O)nnc2-c2cccnc2)cc1	778416510	AKIZUAVUQNTJCI-UHFFFAOYSA-N	427.490	1.862	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cnn([C@H](C)C3CC3)c2)cc(OC)c1OC	778706493	SKNMFVDFSJQGCR-LLVKDONJSA-N	431.449	1.280	50	20	IDGD	
O=C(NNc1ccc2ccccc2n1)C(=O)Nc1ccc(C(=O)N2CCOCC2)c(F)c1	778723623	GHPSFRQWTXNLLW-UHFFFAOYSA-N	437.431	1.928	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1ccnn1Cc1ccc(C(C)(C)C)cc1	779462647	WCUPEGOYVHLQPK-ZDUSSCGKSA-N	436.538	1.319	50	20	IDGD	
COc1ccc(-n2cc(O)c(C(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)n2)cc1	779495669	GMPXGOYQXGKQGA-UHFFFAOYSA-N	430.442	1.065	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNS(=O)(=O)c2cn3c(n2)CCCC3)cc1	779830742	ZTXMCUBVPOOWJO-UHFFFAOYSA-N	447.546	1.264	50	20	IDGD	
COC(=O)c1ccccc1S(=O)(=O)N1CCC(C(=O)NNc2cccc(OC)n2)CC1	780770431	CGDDJLUXADRTBK-UHFFFAOYSA-N	448.501	1.421	50	20	IDGD	
O=C(NNc1ccnc(F)c1)c1cc(I)ccc1-n1cnnn1	781363381	ACEYAZFBZGUXSQ-UHFFFAOYSA-N	425.165	1.558	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)[C@H]1CCCN(C2CCC2)C1	781402610	HFEFQHWQLOFXGV-GJZGRUSLSA-N	426.521	1.531	50	20	IDGD	
CC(=O)N1CCN(Cc2ccccc2NC(=O)NNC(=O)Cc2ccccc2F)CC1	782077438	DKUVIHBOQXTWRL-UHFFFAOYSA-N	427.480	1.885	50	20	IDGD	
CCNC(=O)COc1cccc(NC(=O)C(=O)NNc2ncccc2C(F)(F)F)c1	783120528	TTWSWEYQTSSMTG-UHFFFAOYSA-N	425.367	1.697	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2ccc(N3CCCCC3)c(Cl)c2)CCS(=O)(=O)C1	783428667	YFVQUGZFSRIVMR-GOSISDBHSA-N	428.942	1.467	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2cccc([N+](=O)[O-])c2C)cc1S(=O)(=O)NC1CC1	784351879	GIZJHUWBZOKMHG-UHFFFAOYSA-N	447.473	1.734	50	20	IDGD	
Cc1c(NNC(=O)C(=O)Nc2ccc(S(=O)(=O)NC(C)C)cc2)cccc1[N+](=O)[O-]	784353599	HCRUWZRPLNMBAW-UHFFFAOYSA-N	435.462	1.672	50	20	IDGD	
COc1cc(OC)c(NC(=O)C(=O)NNc2nccnc2Cl)cc1Br	784776437	IJWCPEHSFAOQGP-UHFFFAOYSA-N	430.646	1.992	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2cccc(S(C)(=O)=O)c2)cc1C(=O)NC(C)C	784841500	TVGGVECOCKBPRA-UHFFFAOYSA-N	432.502	1.619	50	20	IDGD	
C[C@H]1CN(Cc2cccc(NC(=O)C(=O)NNc3ccnc(N(C)C)n3)c2)C[C@H](C)O1	784969505	NCLWLWPEYOTGCK-GJZGRUSLSA-N	427.509	1.234	50	20	IDGD	
Cc1ccc(-n2cc(NC(=O)C(=O)NNC(=O)c3ccc4c(c3)OCCO4)cn2)c(C)c1	786415092	WMFGAPMNPIYDLG-UHFFFAOYSA-N	435.440	1.660	50	20	IDGD	
O=C(CCNS(=O)(=O)c1cccc([N+](=O)[O-])c1)NNc1nnc(-c2ccccn2)s1	788558192	JXOMERTUHSJZTR-UHFFFAOYSA-N	449.474	1.320	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)N[C@@H](COC)[C@@H]2CCCO2)c2ccccc2c1=O	789332462	PELAXRYOOOABFC-IRXDYDNUSA-N	431.493	1.335	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)[C@H]3CC(=O)c4ccccc43)cc2)CC1	789818015	AROSBACOHGIXKH-IBGZPJMESA-N	428.514	1.436	50	20	IDGD	
COc1cc(Cl)c(S(=O)(=O)NNC(=O)COCc2ccccc2)cc1C(=O)O	790390425	QEBZOFGCNGSHPM-UHFFFAOYSA-N	428.850	1.573	50	20	IDGD	
O=C(NNc1cccc(F)c1[N+](=O)[O-])C(=O)Nc1ccc(N2CCCS2(=O)=O)cc1	790999917	ZIPCCOZFHYFVQM-UHFFFAOYSA-N	437.409	1.356	50	20	IDGD	
C[C@](O)(Cn1cc(C(F)(F)F)ccc1=O)C(=O)NNc1cccc(S(C)(=O)=O)c1	792299612	FVPHYDSUETWXIM-INIZCTEOSA-N	433.408	1.165	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)N(CC(F)F)C(=O)CS3)n1	793067881	MKURPSHHCDGRCN-UHFFFAOYSA-N	449.439	1.494	50	20	IDGD	
COc1ccc(F)c2[nH]c(C(=O)N3CCN(S(=O)(=O)CBr)CC3)cc12	793775532	QSNHULYGEAVFFW-UHFFFAOYSA-N	434.287	1.756	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NN=Cc1ccc(OC(F)(F)F)c(Br)c1	794508121	LASLVZSFRMLKLS-SSDOTTSWSA-N	432.218	1.736	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(CCN3CCSCC3)cc2)n1	797369759	IKEXQIYQFWLSNS-UHFFFAOYSA-N	427.530	1.381	50	20	IDGD	
CC[C@@H](Nc1c([N+](=O)[O-])c(C)nn1C)C(=O)NNC(=O)C(=O)Nc1ccc(C)c(C)c1	798309606	IYZPTMAZAQPRMJ-CQSZACIVSA-N	431.453	1.230	50	20	IDGD	
O=C(NNC(=O)c1ccccc1O)Nc1cnc(N2CCOCC2)c(Br)c1	799248854	DXHBXKVYGKNWSH-UHFFFAOYSA-N	436.266	1.853	50	20	IDGD	
CC(C)(C)Nc1ccccc1NC(=O)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	799258681	GANDLCUXKDTNLV-UHFFFAOYSA-N	439.520	1.690	50	20	IDGD	
CCOc1cccc(S(=O)(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)c1	799921294	KBRQNSXKSYLWNL-UHFFFAOYSA-N	442.538	1.977	50	20	IDGD	
CCOC(=O)Oc1ccc(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1	800314589	ITAQSBGHDOSARY-UHFFFAOYSA-N	441.849	1.598	50	20	IDGD	
Cn1c(=O)n(C)c2cc(N3CCCCC3)c(NC(=O)C(=O)NNc3ccc(C#N)cc3)cc21	800627966	UEUXOWONMKUXCK-UHFFFAOYSA-N	447.499	1.821	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)CC[C@H]2NC(=O)N(c3ccc(C#N)cc3)C2=O)cc1	802051652	YGZLNYKQQFYYMZ-QGZVFWFLSA-N	436.428	1.625	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)NC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1	802334075	SKPSOWOERIUIRN-QGZVFWFLSA-N	435.440	1.396	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NC[C@@H]2CC(c3ccc(OC)c(C)c3)=NO2)cc1	802352386	IHHTXKGGKIAJBH-SFHVURJKSA-N	442.472	1.915	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)c3cc[nH]c3C(C)C)CC2)cc1	802762443	GZTSSZGQVXYJNS-UHFFFAOYSA-N	447.561	1.214	50	20	IDGD	
COc1cc(N)c(C(=O)OCC(=O)NNC(=O)c2cccc(C)c2)cc1Br	803952521	KTORXZWGOZABRH-UHFFFAOYSA-N	436.262	1.966	50	20	IDGD	
CCCN(NC(=O)CCNS(=O)(=O)c1cccc([N+](=O)[O-])c1)C(=O)OC(C)(C)C	804592019	SZBQRNUKNLLGCM-UHFFFAOYSA-N	430.483	1.942	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)Nc1cccc(Cn2nc3ccccn3c2=O)c1	806210356	NSYJBBSPYHJHPF-UHFFFAOYSA-N	442.443	1.669	50	20	IDGD	
Cn1[nH]cc2c(=NC(=O)C(=O)NNC(=O)c3cc4c(s3)CCCCCC4)ccnc1-2	806975781	OLFUMLGKGVHODF-UHFFFAOYSA-N	426.502	1.462	50	20	IDGD	
CCOC(=O)Cn1ccc2cc(NC(=O)C(=O)NNc3ccc(-n4ccnc4)nn3)ccc21	807429815	YCZRXTPYJRDBTF-UHFFFAOYSA-N	448.443	1.262	50	20	IDGD	
Cc1cc([N+](=O)[O-])ccc1NNC(=O)C(=O)Nc1ccc(N2CCCS2(=O)=O)cc1	807458015	QSBNLCJHKHEQJN-UHFFFAOYSA-N	433.446	1.525	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)C(=O)Nc1cccc2c1OCC(=O)N2	810386405	XSPBOTBSAUAICJ-CYBMUJFWSA-N	448.435	1.724	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)c2c(Br)nnn2C)cc1C	811451213	BWMWAXJIDFDSJV-UHFFFAOYSA-N	430.284	1.128	50	20	IDGD	
CC(C)c1nccnc1NNC(=O)CNS(=O)(=O)c1cccc(Br)c1	811461817	HRJNRIPIPZTGCW-UHFFFAOYSA-N	428.312	1.784	50	20	IDGD	
CCCc1nnc(SCC(=O)NNC(=O)Nc2ccc(Br)cc2)n1N	813573346	DJIQBMFXADMRLS-UHFFFAOYSA-N	428.316	1.652	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NN=CC1(C)COC1)N(S(C)(=O)=O)CC2	814758834	JFYKRYSMLVVEJE-OAHLLOKOSA-N	425.507	1.091	50	20	IDGD	
Cc1cc(C=NNC(=O)Nc2ccc(S(N)(=O)=O)cc2)c(C)n1CCN1CCOCC1	814965046	GKHBNKORZQHMHD-UHFFFAOYSA-N	448.549	1.240	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)C(=O)Nc2cc(OC)n(C)n2)c1	815866706	LHJUJZKRENSQOA-UHFFFAOYSA-N	426.227	1.060	50	20	IDGD	
CC(=O)N1CCN(S(=O)(=O)c2cccc(C(=O)NNc3cccc(Cl)n3)c2)CC1	817007922	VWCPIHHANGBLLW-UHFFFAOYSA-N	437.909	1.345	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)Cn1c(S)nnc1-c1cccs1	817053918	LKZYIVXLFJKUEM-UHFFFAOYSA-N	438.560	1.689	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2ccccc2OCc2noc(C)n2)n1	825354783	LRKOQNTUUHJLSC-UHFFFAOYSA-N	445.457	1.269	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)N[C@@H](CN1CCOCC1)c1ccccc1	914598226	OLUYBDJSAGNKAI-INIZCTEOSA-N	436.310	1.795	50	20	IDGD	
COc1ccnc(NNC(=O)C2CCN(S(=O)(=O)c3cccc(C(C)=O)c3)CC2)n1	914763165	UWJNIOBQVIVNEW-UHFFFAOYSA-N	433.490	1.232	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@H]2C(=O)NNC(=O)COc2ccc(C)cc2)c(OC)c1	915060458	GHYYECBNSOZLRX-IBGZPJMESA-N	441.484	1.843	50	20	IDGD	
Cc1cccc([C@@H](CNC(=O)NNC(=O)c2c(C)nc3ccccn23)N2CCOCC2)c1	915259898	JZUSWLRQDNHKLH-LJQANCHMSA-N	436.516	1.969	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)c2nn(-c3ccccc3F)c3c2CCC3)c2ccccc2c1=O	915286280	MIAJAGXNKOJAMY-UHFFFAOYSA-N	446.442	1.822	50	20	IDGD	
COc1ccc(CCNC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1	915883485	MVFHWHREOIIPDI-UHFFFAOYSA-N	425.533	1.780	50	20	IDGD	
CN1CCN([C@@H](CNC(=O)NNC(=O)COc2ccc(F)cc2)c2cccs2)CC1	915902632	XSFBDZQOLWFOLZ-KRWDZBQOSA-N	435.525	1.585	50	20	IDGD	
CCc1ccccc1OCC(=O)NN=C(C)c1ccc(S(=O)(=O)NCC(=O)O)cc1	916303740	PJBQCQNCBYPQEC-UHFFFAOYSA-N	433.486	1.531	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(C(=O)CNC(=O)NNC(=O)c2c[nH]c3ccccc23)CC1	918138632	VLFVIDYLPHCHQD-UHFFFAOYSA-N	444.492	1.191	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)c1cc(-c2ccco2)nc2c(C(N)=O)ncn12	919822961	XHTVBOVTJUKGDI-UHFFFAOYSA-N	434.412	1.101	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)NCC[C@@](O)(c1nccn1C)C(F)(F)F	920045180	VNEWKDPEEISDSR-QGZVFWFLSA-N	429.399	1.142	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCc2ccc(C(=O)N3CCN(C)CC3)cc2)cc1	1319025289	KKYUIRDZQVWCAU-UHFFFAOYSA-N	425.489	1.227	50	20	IDGD	
Cc1scc(C(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1C	1779031209	NOHPSSSIAFCQOC-OAQYLSRUSA-N	443.529	1.121	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1c(F)ccc(O)c1F)CCO2	1779298878	LFQVCEPUFMAALR-LJQANCHMSA-N	428.508	1.965	50	20	IDGD	
CSc1cccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](O)CCl)C3)c1O	1780076239	YJYOXSYBPZDWSD-AKCHCHLHSA-N	442.965	1.841	50	20	IDGD	
COc1ccnc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](F)Br)C2)c1	1780774965	RFVDQFGFBWKKBR-IIDMSEBBSA-N	444.301	1.908	50	20	IDGD	
C=CCC(F)(F)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)C2	1781803214	UIPBVOWBDLJPEH-DNVCBOLYSA-N	430.496	1.085	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@]2(C1)CN(C(=O)c1cnc(O)[nH]1)CCO2	1782868075	YCWWNXCCAYMXPO-MYHKYFONSA-N	443.410	1.444	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(Cl)cnc3O)[C@H]2C1	1783403333	VFAIDQFYUMKECJ-OAACRXHESA-N	446.729	1.817	50	20	IDGD	
COC(=O)[C@H]1CC[C@H](C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](C)Br)C3)C2)CC1	1783529198	GEHJOQVAEAZSEA-XLPNERPQSA-N	445.354	1.579	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H]1CCc3ccccc3[C@H]1O)CCO2	1783870530	CSWPBVXDYMNELM-VWNVYAMZSA-N	436.936	1.366	50	20	IDGD	
COc1cc(CCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)C(Cl)Cl)C[C@@H]32)ccn1	1785104823	FAQCVJKIMBXEAF-KKUMJFAQSA-N	430.332	1.806	50	20	IDGD	
O=C(Cn1cccc([N+](=O)[O-])c1=O)NC1(c2ccc(NC(=O)[C@H](O)CCl)cc2)CCC1	1786135762	PYFHQPKJRYAOJC-MRXNPFEDSA-N	448.863	1.490	50	20	IDGD	
CSCC[C@H](O)C(=O)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1	1788149355	LNQYAMGXPGVASZ-IBGZPJMESA-N	442.346	1.228	50	20	IDGD	
C[C@H](Cn1ccnc1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]2C1	1789926898	KMNBCSBRFIVLSY-CAEXGNQWSA-N	431.306	1.189	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4occc4c3O)[C@H]2C1	1790439082	FMMPOWDHHOCFBJ-PTOXDTDZSA-N	436.892	1.986	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc4c3OCC4)C[C@@H]21	1791057142	DXJOGKILQDDROM-CSFVBSKPSA-N	437.334	1.998	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(C)cnc3Cl)C[C@@H]21	1791251565	NGPQOHOKAJYEPY-HNKHHVNMSA-N	430.332	1.891	50	20	IDGD	
Cc1nn2cc(CC(=O)N3CC[C@H]4CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]4C3)nc2s1	1791292801	PUBNUVCBBRTCQU-DRZSPHRISA-N	446.360	1.425	50	20	IDGD	
CCCC(=O)N[C@H](C)C(=O)NC1(c2ccc(NC(=O)CCC(=O)NN(C)C)cc2)CCC1	1791601006	DHKXMRRGPBCGPX-MRXNPFEDSA-N	445.564	1.798	50	20	IDGD	
COc1cnc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@](C)(Cl)CCl)C3)c(F)c1	1794452161	CAJHCGANNVDAHX-WZTYKQCMSA-N	434.295	1.669	50	20	IDGD	
Cc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCBr)cc2c[nH]nc12	1795115058	CUSLGVSUMYKMTJ-JLVBRIDZSA-N	435.322	1.860	50	20	IDGD	
Cn1nccc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1795148367	JXLJYVLOAQIZHY-XGUBFFRZSA-N	439.944	1.804	50	20	IDGD	
C=CCC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Cl	1796367429	INJCBULANIZVML-YIDVYQOGSA-N	447.935	1.970	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/c1ccoc1)C2	1796439731	ZGTPQQWYJLVHRD-KHBBLPJUSA-N	439.472	1.016	50	20	IDGD	
CC1=CC[C@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)CC1	1796441901	FLBMQJGFGLIIKN-WLYJJTDJSA-N	441.532	1.456	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc3nc[nH]c13)C2)[C@@H](F)Br	1799346273	OAQUXLWLNVJAEI-YJKIEOBBSA-N	425.258	1.457	50	20	IDGD	
CN(C)c1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Br)cn1	1799349327	WMWXELBUDBWOFG-NEBZKDRISA-N	429.290	1.041	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnc2c(c1)NC(=O)CS2	1801079325	LAJNNUPJGNNIOJ-CRWXNKLISA-N	438.937	1.631	50	20	IDGD	
CCOCCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)C2	1801499219	WYKWSNSXHKUMPV-JFABSOQWSA-N	433.455	1.888	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cc(F)ccc1F	1801977275	HKYZHULMSHVNMV-AKENFEQQSA-N	431.277	1.880	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C=C1\C(=O)Nc3ccccc31)C2	1802337979	ZIEPFIOLQRWSRM-KXBHIGINSA-N	439.516	1.033	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc3nncn3c2)[C@@H]1c1cccnc1)[C@H](O)CCl	1803142850	KWDLOQYUUWYPRL-YXJHDRRASA-N	428.880	1.044	50	20	IDGD	
CSCC(C)(C)C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1803631075	JXNIDLLDQFNXHR-FXAWDEMLSA-N	449.621	1.850	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)C[C@H]2CCCCO2)[C@H]1c1cccnc1	1804105224	YHCZGCWTUFRQKV-DNVFCKCGSA-N	445.564	1.420	50	20	IDGD	
O=C1CCc2ccc(C(=O)N3CCC4(CCCN(C(=O)[C@@H](O)CCl)C4)CC3)nc2N1	1805523758	UWLUYBFAZHBODU-INIZCTEOSA-N	434.924	1.411	50	20	IDGD	
Cn1nc(C(=O)N2CC[C@@H](CNC(=O)CCBr)[C@H]2c2cccnc2)cc1O	1806338476	AIBVTOQROKIKRS-SUMWQHHRSA-N	436.310	1.625	50	20	IDGD	
O=C(CN1CCc2sccc2C1)N1CCCC2(CCN(C(=O)[C@@H](O)CCl)CC2)C1	1806781940	DDYMAUAOKALOFY-KRWDZBQOSA-N	440.009	1.937	50	20	IDGD	
O=C(NCCC(=O)N1CC[C@H](CNC(=O)[C@@H](F)Cl)[C@H]1c1cccnc1)c1ccc[nH]1	1808308511	KPHUXTAVDJGYMI-ZTFGCOKTSA-N	435.887	1.770	50	20	IDGD	
Cc1occc1C(=O)N1CCCC2(CCN(C(=O)c3cnccc3C(=O)NN)CC2)C1	1808316546	QZFXWLZRHHVZBD-UHFFFAOYSA-N	425.489	1.745	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)[C@@H]3Cc4ccccc4N3)CC2)C1	1809973343	IJLLPGNLIGIHBM-QFIPXVFZSA-N	447.344	1.248	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)c3cccn4nccc34)CC2)C1	1809980172	NRJJRBPSFSXSIT-UHFFFAOYSA-N	446.316	1.173	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2ccccc2C(N)=O)[C@@H]1c1cccnc1	1811289061	FRMKQTANOLQCCB-MNEFBYGVSA-N	444.919	1.754	50	20	IDGD	
Cc1ccccc1C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1811776916	QBGYZYWRSUCTBQ-OFNKIYASSA-N	443.312	1.703	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)CCc3cnn(C)c3)sc2C1	1815438073	WUKCBKULRIZWRB-STQMWFEESA-N	425.942	1.675	50	20	IDGD	
CN[C@H](CC(=O)Nc1cc([C@H]2CCCCN2C(=O)CCBr)[nH]n1)C(=O)O	1817362852	CFPSFXFMONAQPB-VXGBXAGGSA-N	430.303	1.250	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H]2CC2(F)F)n[nH]1	1818839071	WJECDCHCVOMIRN-TZMCWYRMSA-N	433.419	1.369	50	20	IDGD	
Cc1ocnc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1819943551	FXBUZBYGZNPPET-HNNXBMFYSA-N	438.448	1.324	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H]2C[C@@H]2F)n[nH]1	1821814982	WECNMUMNUGJOBS-PKIILGJSSA-N	429.456	1.894	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)Cc3c(C)n[nH]c3C)sc2C1	1823131838	CIISPYVKJVBNGZ-YPMHNXCESA-N	425.942	1.892	50	20	IDGD	
O=C(COc1cccnn1)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](F)Br)CC2	1826762997	VMKMPIBDPCHONB-OQPBUACISA-N	444.286	1.615	50	20	IDGD	
O=C(C1CC(F)(F)C1)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827048920	CQLWDUAWQYRHSX-LJQANCHMSA-N	434.292	1.645	50	20	IDGD	
COC1(CC(=O)Nc2nc3c(s2)C[C@@H](NC(=O)CCC(=O)NN(C)C)CC3)CCC1	1827410656	AFKNTUHLAPRDCX-ZDUSSCGKSA-N	437.566	1.387	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3cc(F)ccn3)C2)C1	1830358165	MNQHOAVIHMAEPY-NRFANRHFSA-N	441.931	1.875	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4cncn4c3)C2)C1	1830362426	WXRLXYQAVMUCKH-NRFANRHFSA-N	434.924	1.669	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)C[C@@H]3CCCCO3)C2)C1	1830535529	QCLSQFIETJIWFN-JTDSTZFVSA-N	447.370	1.433	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccncc3)C2)C1	1830537800	OYAYVMXCKORBQD-KDOFPFPSSA-N	426.311	1.183	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ncc(OC)cc3F)C2)C1	1831644207	RKFDVQHJLNKPSW-QRWLVFNGSA-N	443.903	1.707	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H](C)n2cnnn2)CC1	1832290571	PQLGSOYBXBROFV-GZBFAFLISA-N	427.347	1.637	50	20	IDGD	
Cc1ccc2[nH]cc(CC(=O)N3CCO[C@@]4(COCCN(C(=O)[C@@H](O)CCl)C4)C3)c2c1	1832741337	QIOCVGBXLDLBJF-UGKGYDQZSA-N	449.935	1.075	50	20	IDGD	
C/C(=C/C(=O)N1CCC(N2CCC(NC(=O)[C@@H](C)CBr)CC2)CC1)C(=O)O	1833265920	CORXEEBGHHTQSQ-FZDNWWAKSA-N	444.370	1.620	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cc(C(C)=O)[nH]n3)CC2)CC1	1834068831	HAWCQDGUUPWLBS-MRXNPFEDSA-N	439.944	1.051	50	20	IDGD	
CC(C)(C)CC(=O)NC1CCN(C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1	1834409578	AEHARDULETYHAH-UHFFFAOYSA-N	444.580	1.307	50	20	IDGD	
Cc1cc(CC(=O)N2CCC(N3CCC(NC(=O)CCBr)CC3)CC2)n[nH]1	1834423919	OUGVBUYASMERSV-UHFFFAOYSA-N	440.386	1.617	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCOc3ccccc3)CCO2)C1	1834833350	MURCYBAZSYEMQA-RXVVDRJESA-N	440.924	1.166	50	20	IDGD	
CCOCC(=O)N1CCO[C@@]2(COCCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1	1834989628	ZPUJORWDDYZXHX-IXNCKXOBSA-N	449.454	1.365	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCC(OC2CCN(C(=O)CN3CCOC3=O)CC2)CC1	1836621542	CEMDQNZSVRUWEN-UHFFFAOYSA-N	429.945	1.702	50	20	IDGD	
Cc1nscc1C(=O)N1CCOC[C@@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1837712446	RKPMNGBCQWTIST-GOSISDBHSA-N	427.599	1.373	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(OC)ccn3)CCO2)C1	1837952390	UAJXOCMCJVXTSJ-UZLBHIALSA-N	425.913	1.568	50	20	IDGD	
COc1cc(OC)cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)c1	1838933761	GHBTTZCIAOYGAR-LPHOPBHVSA-N	430.860	1.308	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cn(C)c4ncccc34)C2)C1	1839146243	WVXASCTUFLUTAF-UWJYYQICSA-N	434.924	1.661	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)cnc1C	1839197931	MZGMUVODYLNQKQ-YJBOKZPZSA-N	444.301	1.459	50	20	IDGD	
O=C(c1ccc(Cl)c(F)c1)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1	1839269671	QSMKIKOIIVVREY-MAUKXSAKSA-N	435.279	1.149	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc4ccsc4[nH]3)CCO2)C1	1839521635	AORIAPVADAVBDA-KUHUBIRLSA-N	441.937	1.553	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(F)(F)C(F)F)C2)C1	1839962924	VKEIQRABLGVZEW-YGRLFVJLSA-N	449.239	1.517	50	20	IDGD	
CC(C)c1ccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)cc1	1839999972	CTPNGJFMJBIEQR-UGKGYDQZSA-N	438.952	1.409	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccccc3O)C2)C1	1840031470	RIPQQAYREIOMHA-FZKQIMNGSA-N	427.295	1.246	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(Cl)ccc3F)C2)C1	1840149009	APFFPQNEYPWEBB-BEFAXECRSA-N	449.306	1.803	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc4ccncc34)C2)C1	1840154711	DDVNICQIVVKWNA-DENIHFKCSA-N	447.919	1.559	50	20	IDGD	
C[C@H](Oc1cccnc1)C(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1840450211	VRHNMZBEZNRBCJ-HRAATJIYSA-N	439.940	1.570	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H](C(=O)N2CC3(CCCN3C(=O)[C@@H](O)CCl)C2)C[C@@H]2C[C@@H]21	1841348715	ZNABXKCAYSTELK-AJNGGQMLSA-N	427.929	1.187	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2nc(Cl)ccc2F)C1	1842136474	CXXNPVIQCOXMDC-UHFFFAOYSA-N	432.843	1.003	50	20	IDGD	
O=C([C@H](O)CCl)N1CC2(CCCN2C(=O)c2cnc3ccc(C(F)(F)F)cn23)C1	1844069360	DQUYRYYHXMOGMT-CYBMUJFWSA-N	430.814	1.770	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)Cc1cc(C)on1)C2	1844693226	KVTSZEZZHAJMEU-UHFFFAOYSA-N	442.428	1.876	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)c1cnn(C(C)(C)C)c1Cl)C2	1846384429	RTLZRGAFPOFLJF-UHFFFAOYSA-N	438.960	1.482	50	20	IDGD	
CCOC(=O)c1ncn2c1CC[C@@H](C(=O)N1CC3(CCCN3C(=O)C(Cl)Cl)C1)C2	1846388718	OJYSHXXAMJFYSL-GFCCVEGCSA-N	443.331	1.629	50	20	IDGD	
Cc1cc(Cl)cc(C(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)c1	1846814741	JWLBBHZFAUAESV-UHFFFAOYSA-N	427.892	1.778	50	20	IDGD	
Cc1ncoc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1848095803	PTBYOWSWQWHPIV-IHRRRGAJSA-N	426.901	1.931	50	20	IDGD	
O=C(COC(=O)c1ccc2c(c1)NC(=O)CS2)NNC(=O)c1cccc([N+](=O)[O-])c1	9074616	KXYVRHSZNRFLBU-UHFFFAOYSA-N	430.398	1.257	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)c2ccc(S(=O)(=O)N3C[C@H](C)C[C@@H](C)C3)cc2)n1	15462373	RZIUVXYVWCQSJO-HUUCEWRRSA-N	447.561	1.628	50	20	IDGD	
CC(C)n1ncc2c(C(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)cc(-c3ccccc3)nc21	15639626	XUXRTTMNFGDRPD-OAHLLOKOSA-N	441.513	1.875	50	20	IDGD	
COc1ccc(N2C[C@@H](C(=O)NNC(=O)COc3ccc(C)c(C)c3)CC2=O)c(OC)c1	17203647	DOZGPALTTLMPMJ-INIZCTEOSA-N	441.484	1.900	50	20	IDGD	
O=C(CCNC(=O)c1ccc(Br)cc1)NNC(=O)c1ccc2c(c1)OCCO2	17822200	GDEDBLZWEHNSPA-UHFFFAOYSA-N	448.273	1.801	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(-n3cccn3)cc2)c1	22594143	XBOGQTHLRSXLEI-UHFFFAOYSA-N	441.513	1.978	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CSc2nc3sccc3c(=O)n2C)cc1OC	28628915	UFJQHEKPVAYXNP-UHFFFAOYSA-N	434.499	1.566	50	20	IDGD	
CCOc1ccc(NC(=S)NNC(=O)c2ccc(CCNS(C)(=O)=O)cc2)cc1	28633706	UWXDTMXHAGSBMG-UHFFFAOYSA-N	436.559	1.808	50	20	IDGD	
CC(=O)N1CCc2ccccc2[C@H]1CC(=O)NNC(=O)c1csc(N2CCOCC2)n1	105106225	CCABMSYSVHIIFQ-GOSISDBHSA-N	443.529	1.277	50	20	IDGD	
C[C@H](NS(=O)(=O)c1ccc(Cl)cc1)C(=O)NNC(=O)c1ccc2c(c1)OCCO2	108490649	IWKZXBOSKCDNLM-NSHDSACASA-N	439.877	1.239	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)[C@H]1CCCN1S(=O)(=O)c1cccs1	109845814	QPSWGKFJSPXSQL-CQSZACIVSA-N	438.531	1.169	50	20	IDGD	
O=C(Cn1cnc2c(oc3ccccc32)c1=O)NNC(=O)c1cc(Br)c[nH]1	302682730	AYLRPZWGWHJQDQ-UHFFFAOYSA-N	430.218	1.695	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)[C@@H](Cc2ccccc2)n2nnnc2C)o1	303693909	MRUZAMNXPDROGQ-GOSISDBHSA-N	425.493	1.661	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)[C@@H]2CC(=O)N(Cc3ccc(OC)cc3)C2)o1	726527886	LJNALGGPMWKNFE-QGZVFWFLSA-N	442.516	1.940	50	20	IDGD	
C[C@H]1CCCC[C@@]12NC(=O)N(CC(=O)NNc1ccc(S(=O)(=O)NC3CC3)cc1)C2=O	726867219	BCVPDIFQXYAYPV-RNODOKPDSA-N	449.533	1.071	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)NNC(=S)Nc2ccc(OC)c(F)c2)ccc1OC	727498314	IRVVGFIQZNCPCR-UHFFFAOYSA-N	442.494	1.382	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CCCc2ccccc2)cc1S(=O)(=O)N1CCOCC1	727717052	RMHYXRQIWAOYAK-UHFFFAOYSA-N	445.541	1.800	50	20	IDGD	
O=C(COC(=O)c1cnn(-c2ccccc2F)c1)NNC(=O)[C@H]1COc2ccccc2O1	728339356	LMSTXVQFWYQGAH-GOSISDBHSA-N	440.387	1.156	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCCN1C(=O)c1ccccc1)C1CCN(c2ncccn2)CC1	728847789	PHXKTDKVYODWBC-IBGZPJMESA-N	436.516	1.535	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)c1ccc(NC2=NS(=O)(=O)c3ccccc32)cc1	728891657	CHSOADNWVLQIGW-UHFFFAOYSA-N	435.465	1.646	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)N1CCc2ccccc2C1	728943954	FMAANXHTBSQFAD-QGZVFWFLSA-N	437.548	1.470	50	20	IDGD	
O=C(NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12)C(=O)Nc1ccccc1	729298641	PTAPFKRYFGQDDX-UHFFFAOYSA-N	441.447	1.845	50	20	IDGD	
C[C@@H]([C@@H](C)NC(=O)CCC(=O)C(C#N)=C1N(C)c2ccccc2N1C)N1CCOCC1	729447759	ZYLHGHODTFVHRF-SJORKVTESA-N	425.533	1.882	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2sccc2OC(F)F)cc1OC	729776307	UGPGHHUUUHIARY-UHFFFAOYSA-N	430.385	1.985	50	20	IDGD	
CN(c1ccc(OCC(=O)NNC(=O)Cc2cc[nH]n2)cc1)S(=O)(=O)c1cccs1	730090917	RMSBXEXFSMZCLI-UHFFFAOYSA-N	449.514	1.065	50	20	IDGD	
O=C(NC[C@H](O)c1ccc2ccccc2c1)NNC(=O)c1csc(N2CCOCC2)n1	731496426	BOYUAAYQCQWZGX-SFHVURJKSA-N	441.513	1.811	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2ccc(=O)n(Cc3ccccc3Cl)c2)C[C@H](C)O1	732261130	KOMORWZDNIJSSH-HOTGVXAUSA-N	446.935	1.810	50	20	IDGD	
COc1nn(C)c2nc(C)c(CCC(=O)NNC(=O)CCN3C[C@H](C)O[C@H](C)C3)c(C)c12	732264911	XYXILZWRJCQELF-OKILXGFUSA-N	446.552	1.173	50	20	IDGD	
Cn1c(NNC(=O)[C@H]2CS[C@@H](Cc3ccccc3F)C(=O)N2)nc2ccccc2c1=O	733261492	CNYKYSZCULRAQF-SJORKVTESA-N	441.488	1.359	50	20	IDGD	
COc1ccc(CN2CC[C@@H](NC(=O)NNC(=O)COc3ccc(C#N)cc3)C2=O)cc1	734682471	APFRNGLKXRHTPF-LJQANCHMSA-N	437.456	1.077	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@@H](C)Cc2c(C)noc2C)cc1	739051099	XHHQWIIQFBCDSL-ZDUSSCGKSA-N	437.522	1.182	50	20	IDGD	
C[C@@H]1C[C@@H](C)CN(S(=O)(=O)c2cccc(C(=O)NNc3ncnc4[nH]cnc34)c2)C1	740746922	YXJXSRALCRUIEN-CHWSQXEVSA-N	429.506	1.776	50	20	IDGD	
O=C(NCc1cccc(C(F)(F)F)c1)NNC(=O)C1=CN2CCS(=O)(=O)N=C2C=C1	742459549	MCJVFKKKSMKWSW-UHFFFAOYSA-N	443.407	1.033	50	20	IDGD	
CC(=O)N[C@@H](C)c1ccc(S(=O)(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)s1	743268579	ZEZYTMQLSYKMGO-QMMMGPOBSA-N	428.448	1.182	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)N[C@H]2CC(=O)N(CCOc3ccccc3)C2)c1	743635345	CBDLHPUZGAXFFU-INIZCTEOSA-N	442.472	1.328	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)[C@@H]1CC(=O)N(c2ccccc2)C1	744622343	SLXSXSQESUFXDY-MRXNPFEDSA-N	444.513	1.204	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)c2cc(Br)cc(F)c2N)cc1	745011003	DFCDIJDAENUQCD-UHFFFAOYSA-N	435.209	1.660	50	20	IDGD	
C[C@@H](CS(C)(=O)=O)NC(=O)NNC(=O)Nc1ccc(Br)cc1Cl	745822146	XVMDTXYZTGTPMY-ZETCQYMHSA-N	427.708	1.871	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2coc(-c3ccccc3)n2)c1	745848312	YXSPNXNKWPYENM-UHFFFAOYSA-N	443.485	1.736	50	20	IDGD	
Cc1c(C(=O)O)cc(Br)cc1S(=O)(=O)NNC(=O)c1ccccc1O	747594954	GBFVGOZEAVUVTF-UHFFFAOYSA-N	429.248	1.785	50	20	IDGD	
CC[C@H](CNC(=O)NNC(=O)c1csc(N2CCOCC2)n1)Oc1ccccc1F	748976040	CXPVXZDKPYZBBY-CYBMUJFWSA-N	437.497	1.920	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)[C@H]1CCn2cncc2C1	750914637	MIJPKDAKWIYHEK-KRWDZBQOSA-N	430.940	1.064	50	20	IDGD	
Cc1cc(S(N)(=O)=O)cc(C(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)c1C	751838872	LBUUDVMRQWQNOG-UHFFFAOYSA-N	439.877	1.222	50	20	IDGD	
CN(C)C(=O)c1ccc(C=NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)[nH]1	752154458	FYPUHMQXUPSKII-UHFFFAOYSA-N	431.518	1.655	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)N[C@@H]2CCN(Cc3ccc(C#N)cc3)C2=O)cc1	753738132	NXHHQGILRNHXDT-LJQANCHMSA-N	437.456	1.077	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)c2ccc(CNS(C)(=O)=O)o2)cc1Cl	754204914	OFOGPBBPGUSGIK-UHFFFAOYSA-N	446.869	1.466	50	20	IDGD	
C#CCOCCC(=O)NNC(=O)c1ccc(CN(C)S(=O)(=O)c2ccc(C)cc2)cc1	755393428	IJHWFPIROQTFAI-UHFFFAOYSA-N	443.525	1.617	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)Nc2ccc(S(=O)(=O)N3C[C@H](C)C[C@@H](C)C3)cc2)n[nH]1	755419451	DMOKAJZJQTWRNC-CHWSQXEVSA-N	434.522	1.851	50	20	IDGD	
CCOCC(=O)NNC(=O)Nc1ccc(CC(=O)N2CCN(c3ccccc3)CC2)cc1	755691237	HYCUUQBNEIJLDA-UHFFFAOYSA-N	439.516	1.767	50	20	IDGD	
Cc1nn(C)c2ncc(NC(=O)NNC(=O)CCN3CCN(c4ccccc4)CC3)cc12	755848662	ZIQSUTTXBTTWFM-UHFFFAOYSA-N	436.520	1.642	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)cc2)CCO1	756671874	LBVWAYYISFQQQC-AWEZNQCLSA-N	436.472	1.625	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)Nc3ccn(CCS(C)(=O)=O)n3)cc2C1	756758772	GOAHMGOAJZINNH-LLVKDONJSA-N	425.536	1.581	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)Nc1cc(F)c(F)cc1I	756820498	XLLRVBACRHXOQX-ZETCQYMHSA-N	443.188	1.774	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)Nc1cnn(CCN2CCOCC2)c1	756827389	SRSJRDWTKSWPQZ-UHFFFAOYSA-N	434.522	1.169	50	20	IDGD	
COc1cc(C(=O)N(C)C)ccc1NC(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	756868209	IRPPUAZJOKWRCN-UHFFFAOYSA-N	438.444	1.755	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)Nc2c(C)nn([C@@H]3CCS(=O)(=O)C3)c2C)c1	757871755	LTCKCSNBMZFWRA-MRXNPFEDSA-N	449.533	1.708	50	20	IDGD	
CC(C)OCCCn1c(NNC(=O)c2cc([N+](=O)[O-])cnc2N)nc2ccccc2c1=O	758052259	QRKXERSHRVMIMV-UHFFFAOYSA-N	441.448	1.854	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(n2cc(NC(=O)NNC(=O)Cc3cc[nH]n3)cn2)CC1	758204355	HWRRSYJQSHRHTJ-UHFFFAOYSA-N	432.485	1.574	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NC[C@@H](C)CC2(C)OCCO2)nc1	758856501	YHZYMUKHZKSEPI-AWEZNQCLSA-N	429.543	1.527	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)N1CCN(Cc2cccc(Cl)c2)C(=O)C1	758859852	CPYDYAXQHXSDPN-UHFFFAOYSA-N	449.920	1.217	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)Cc2nnc(NC)s2)c2ccccc2c1=O	759378390	PUYQQCFFGHIJHI-UHFFFAOYSA-N	429.506	1.484	50	20	IDGD	
N#C/C(=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)N1CC[C@@H](CO)C1	759703565	OMQIJXBKFFXZGF-BRYYZUPOSA-N	427.892	1.827	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(CNC(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)C1	763042191	QHQBMTQHXPCQKC-UHFFFAOYSA-N	434.501	1.780	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(OCc2ccncc2)cc1	763455363	QRQLECKAHTUPQT-UHFFFAOYSA-N	435.396	1.969	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cccc(CN(C)C)c2)cc(OC)c1OC	763540129	RMUCTAHAZNTPFP-UHFFFAOYSA-N	430.461	1.174	50	20	IDGD	
COCCOc1ccc(F)cc1NC(=O)C(=O)NNC(=O)c1ccc(OC)c(OC)c1	763542646	IJRVMCWEJZETDW-UHFFFAOYSA-N	435.408	1.268	50	20	IDGD	
CCc1nnc(-c2cccc(NC(=O)C(=O)NNC(=O)c3c(C)nc4ccccn34)c2)o1	763628616	CSFSDAFCPROUTA-UHFFFAOYSA-N	433.428	1.655	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cc(-c3ccccc3)ns2)cc1	763665597	KOXXQEJRQNKJTK-UHFFFAOYSA-N	426.454	1.984	50	20	IDGD	
CNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)cc1Cl	763686593	ONJYJEOGWWOOHS-UHFFFAOYSA-N	439.255	1.518	50	20	IDGD	
O=C(CN1CCCc2ccccc21)NNC(=O)C(=O)Nc1ccc(O[C@@H]2CCOC2)cc1	763728430	PXEOLSHMJQLLEH-LJQANCHMSA-N	438.484	1.393	50	20	IDGD	
CC(=O)Nc1cc(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)ccc1F	763728699	QPCUMHVKGDZKKR-UHFFFAOYSA-N	427.436	1.323	50	20	IDGD	
O=C(CN1CCCc2ccccc21)NNC(=O)C(=O)Nc1ccc2c(c1)CCCC(=O)N2	763745378	DGDCNUCUFAULMJ-UHFFFAOYSA-N	435.484	1.500	50	20	IDGD	
O=C(CN1CCCc2ccccc21)NNC(=O)C(=O)Nc1ccc2c(c1)NC(=O)CS2	763745955	LBAIOUKMADXZOY-UHFFFAOYSA-N	439.497	1.270	50	20	IDGD	
NC(=O)CCOc1ccccc1NC(=O)C(=O)NNC(=O)CC12CC3CC(CC(C3)C1)C2	763752048	BQONFYUWEHGFRD-UHFFFAOYSA-N	442.516	1.633	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(CS(=O)(=O)C(C)C)c2)cc1	763821992	UJUDSDLBKJAVPX-UHFFFAOYSA-N	447.513	1.483	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)C(=O)Nc1cnn(-c2ccncc2)c1	763849857	LHYZSPXMFVZCBJ-HNNXBMFYSA-N	444.451	1.974	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccc(NC(=O)C2CC2)cc1	763867358	UZDNOHYVFTWQSG-LBPRGKRZSA-N	428.420	1.728	50	20	IDGD	
C=CCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(OCC)c(OC)c2)cc1	763902740	PVKXXHYDSJVKLA-UHFFFAOYSA-N	440.456	1.409	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3cc(-n4cnnn4)ccc3F)cc2C1	763939322	CYLGBTAXKWUHCZ-SNVBAGLBSA-N	443.464	1.387	50	20	IDGD	
CN(C)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)cc1Cl	763994973	KPAKKOGARHLOCZ-UHFFFAOYSA-N	428.674	1.896	50	20	IDGD	
CC[C@@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1	764007051	YHTMXVSEOZUHQO-CYBMUJFWSA-N	440.456	1.386	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1ccccc1-n1nc(C)nc1C	764011942	LXEPEBNKGNVZCC-UHFFFAOYSA-N	442.863	1.946	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)Cc2cccc3ccccc23)cc1	764019500	NXZBZPXESCFSSX-UHFFFAOYSA-N	435.436	1.720	50	20	IDGD	
COc1ccc(COc2cccc(F)c2)cc1NC(=O)C(=O)NNC(=O)c1cnccn1	764025054	QWFMRSUMCPZCQV-UHFFFAOYSA-N	439.403	1.603	50	20	IDGD	
C[S@@](=O)Cc1ccccc1NC(=O)C(=O)NNC(=O)c1cccc(C(F)(F)F)c1	764037091	HYWHYWGGONPJCO-GDLZYMKVSA-N	427.404	1.984	50	20	IDGD	
CN1CCN(c2ccccc2NC(=O)C(=O)NNC(=O)c2ccc3ccccc3c2)CC1	764062362	XYZXDURRNXWKHP-UHFFFAOYSA-N	431.496	1.991	50	20	IDGD	
COC(=O)CCc1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(C)cc3)[nH]n2)cc1	764112255	ZFBUFZHBVGGABN-UHFFFAOYSA-N	449.467	1.890	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2cccnc2OCc2ccccc2)c1O	764132517	XWBLOUHMOIMTMU-UHFFFAOYSA-N	436.424	1.775	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)ccc1Cl	764245352	QULBJIDTTKPYSJ-UHFFFAOYSA-N	428.832	1.867	50	20	IDGD	
O=C(Cc1ccccn1)NNC(=O)C(=O)Nc1cnn(-c2ccc(C(F)(F)F)cc2)c1	764267843	VTDDQWFZNJJTEU-UHFFFAOYSA-N	432.362	1.615	50	20	IDGD	
CCOCC(=O)NNC(=O)C(=O)Nc1ccc(Cl)cc1C(=O)N1[C@H](C)CCC[C@H]1C	764317076	IMQHZXAXPSJTCU-CHWSQXEVSA-N	438.912	1.866	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(S(=O)(=O)c3ccc(F)cc3)cc2)o1	764368225	SSZKIVFHIFWDGZ-UHFFFAOYSA-N	445.428	1.960	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)OC(C)(C)C)cccc1S(=O)(=O)NC(C)(C)C	765391929	IVZZEFVGVQWYKF-UHFFFAOYSA-N	428.511	1.566	50	20	IDGD	
COc1cccc([C@H](C)CC(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)c1	765737657	HVRPVNJDCIZVBA-GOSISDBHSA-N	438.528	1.794	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)CN1CCN(Cc2ccc(C)cc2)CC1	765748432	DKIAVRXROQZYLY-UHFFFAOYSA-N	448.571	1.872	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cc(-n4cccn4)ccn3)CC2)cc1	765756672	YVMNUGBIZONPKY-UHFFFAOYSA-N	433.516	1.155	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCC[C@H](c2n[nH]c(C3CC3)n2)C1	766256120	IYSJZNJAPJDLJA-ZDUSSCGKSA-N	432.912	1.985	50	20	IDGD	
C[C@H](NC(=O)C1CCCC1)C(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	766664854	WEFFQLWNLFONEJ-INIZCTEOSA-N	449.983	1.300	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)C[C@H]1CCCN(C(=O)NCC(C)C)C1	767343086	BUXYSXOEOBEIJJ-GOSISDBHSA-N	446.548	1.696	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)CO[C@H]2CCCN(C(=O)OC(C)(C)C)C2)C[C@@H](C)O1	767822661	MOIYRKYGBBINPI-ZACQAIPSSA-N	442.557	1.049	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)CSc2ccc(Cl)cc2)n(-c2ncccn2)n1	768239238	XDQQTTQPWKFKTC-UHFFFAOYSA-N	445.892	1.502	50	20	IDGD	
C[C@H](C(=O)NNc1ncnc2[nH]cnc12)N1C(=O)c2ccc(Br)cc2C1=O	769650180	HSRSQNWJYYBLAZ-SSDOTTSWSA-N	430.222	1.243	50	20	IDGD	
CCOc1ccc(C2(CNC(=O)NNc3nc(O)c4cnn(C)c4n3)CCOCC2)cc1	770357000	WAXDOADRYPBMBI-UHFFFAOYSA-N	441.492	1.842	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)c1ccc(OC[C@H]2CCCO2)cc1	772194628	BGNZPSJSEORRNM-GOSISDBHSA-N	431.876	1.975	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)c1cc(NS(C)(=O)=O)ccc1O	772992223	ZFWWPRASMOEQRJ-SNVBAGLBSA-N	427.866	1.646	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(Br)cn2)cc1OC	773533999	XHBZZXSBEBCRBN-UHFFFAOYSA-N	437.250	1.651	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)NCCc1ccc(OCC(F)(F)F)nc1	773611759	AIMGZSGREJEPII-UHFFFAOYSA-N	428.367	1.680	50	20	IDGD	
Cc1c(Cl)cccc1NNC(=O)C(=O)Nc1cccc(N2CCS(=O)(=O)CC2)c1	773766885	XEKMEGGYGNEWCV-UHFFFAOYSA-N	436.921	1.965	50	20	IDGD	
COc1ccc(Cn2nccc2NC(=O)C(=O)NNC(=O)c2ccc(C)c(F)c2)cc1	773885837	QZLWMFGQXFFOND-UHFFFAOYSA-N	425.420	1.787	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)C2(C)COC(C)(C)OC2)c1	775136660	OBPQGQKCLKOJSJ-UHFFFAOYSA-N	427.523	1.267	50	20	IDGD	
CCN=c1nc(NCC)n2c(SCC(=O)NNc3ccc4ccccc4n3)n[nH]c2n1	777464869	KDTKVXYCHMSESN-UHFFFAOYSA-N	438.521	1.588	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)CN2C(=O)N[C@]3(CCCC(C)(C)C3)C2=O)nc1C	778421482	BRHIIPIOMNDFHK-FQEVSTJZSA-N	432.481	1.296	50	20	IDGD	
Nc1nc(Cl)cc(NNC(=O)CCCCC/N=C2/NS(=O)(=O)c3ccccc32)n1	779374804	GHBZAKHBCMGODZ-UHFFFAOYSA-N	437.913	1.454	50	20	IDGD	
N#Cc1ccc(N2CCC[C@H](NC(=O)NNC(=O)c3nnc(O)c4ccccc34)C2=O)cc1	780894312	LVGRWDCDTIJJKJ-KRWDZBQOSA-N	445.439	1.347	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)c(C)c1	782895279	ZBMWKXKQRPMAJR-UHFFFAOYSA-N	439.472	1.236	50	20	IDGD	
O=C(NNc1ccc(Br)cc1)C(=O)Nc1ccn(CCN2CCOCC2)n1	783005939	IRYWMFDIMXFENB-UHFFFAOYSA-N	437.298	1.060	50	20	IDGD	
Cc1ccccc1NC(=O)NNC(=O)C(=O)Nc1cc(C(=O)N2CCOCC2)ccc1C	783415946	LWMJYJKUQGCAQL-UHFFFAOYSA-N	439.472	1.567	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2cc(Cl)ccc2N2CCSCC2)CCS(=O)(=O)C1	783429056	ZIJYERVBJHIZEK-QGZVFWFLSA-N	446.982	1.030	50	20	IDGD	
O=C(NNc1ccc(-n2cccn2)nn1)C(=O)Nc1cc(C2CC2)nn1-c1ccccc1	783433821	ZQBVALRVSKHGSF-UHFFFAOYSA-N	429.444	1.807	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)C12CCC(CC1)C2	783701012	GXFLEOUQRGTRAV-UHFFFAOYSA-N	435.546	1.368	50	20	IDGD	
Cc1c(NNC(=O)C(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)cccc1[N+](=O)[O-]	784351940	OCJJYIHLJJSOFW-UHFFFAOYSA-N	447.473	1.220	50	20	IDGD	
O=C(COc1cccc(I)c1)NNC(=O)c1ccc2c(c1)OCO2	784695698	JMROQZUDBXSYSX-UHFFFAOYSA-N	440.193	1.860	50	20	IDGD	
O=C(NNc1ncc(F)cn1)C(=O)Nc1cc(F)c(I)c(F)c1	784957740	QTRSEZHIXJRHDT-UHFFFAOYSA-N	437.119	1.580	50	20	IDGD	
Cc1nc(Cn2nnc(C(=O)NNC(=O)c3cc(F)ccc3Br)c2C)no1	785017429	CTLUZGQWVADLAG-UHFFFAOYSA-N	438.217	1.303	50	20	IDGD	
COC(=O)CNC(=O)c1ccc(NC(=O)C(=O)NNc2ccc(OC)c(Cl)c2)cc1	785117433	PTZPTVIUXAYYBU-UHFFFAOYSA-N	434.836	1.333	50	20	IDGD	
COc1cc(C)c(NC(=O)C(=O)NNc2c(OC)cccc2S(C)(=O)=O)cc1OC	785331288	SEHNZYDORJJLRJ-UHFFFAOYSA-N	437.474	1.506	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN1C1CC1)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	786825355	CSTDUDMKRPJNPJ-FQEVSTJZSA-N	431.500	1.776	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)NCc2ccc(S(C)(=O)=O)s2)cc1	786880694	OOJZQULQDRQJAX-LBPRGKRZSA-N	441.531	1.848	50	20	IDGD	
O=C(CN1C(=O)COc2cc(Br)ccc21)NNc1ccc(-n2ccnc2)nn1	788179631	YIBZOXMFHQLWEY-UHFFFAOYSA-N	444.249	1.294	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1)c1ncnn1C	788888649	DKTWWPHTUPHFJG-CQSZACIVSA-N	446.475	1.222	50	20	IDGD	
Cc1onc(-c2ccc(C(F)(F)F)cc2)c1C(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1	790218123	GUBNJHKFJSJCJU-NSHDSACASA-N	431.392	1.865	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2ccc(C(=O)NNc3nc4ccccn4n3)cc2)C[C@@H](C)O1	791259884	YTKAAIXHJKJAGW-OKILXGFUSA-N	430.490	1.284	50	20	IDGD	
Cc1cccc(=O)n1C[C@](C)(O)C(=O)NNC(=O)c1ccc(Br)cc1Cl	792140973	HFRYKJKJKGRNHM-KRWDZBQOSA-N	442.697	1.785	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(OC)cc(-n2cccn2)c1	792355181	RAJRBILFXPMZKO-UHFFFAOYSA-N	437.456	1.608	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCC1(S(C)(=O)=O)CC1	792779839	KQJZCGWJWONZRG-SNVBAGLBSA-N	434.312	1.124	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)c2cc(S(=O)(=O)N(C)C)ccc2N2CCCCC2)n1	794090688	XRUVRLRFBMBDDV-UHFFFAOYSA-N	445.545	1.705	50	20	IDGD	
CCC(=NNC(=O)c1nn(C)c(=O)c2ccccc12)c1ccc(Cl)c(S(N)(=O)=O)c1	794472075	XNKWMLOPHHIJFO-UHFFFAOYSA-N	447.904	1.778	50	20	IDGD	
O=C(CN1CCCC[C@@H]1COC(=O)N[C@@H]1CCOC1)NNC(=O)c1cccc(Cl)c1	796548537	NGMVNYUIASKPMA-IAGOWNOFSA-N	438.912	1.471	50	20	IDGD	
Nc1c(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)ccnc1-c1ccccc1	797485347	PVKZXUKKSLPICM-GOSISDBHSA-N	448.435	1.475	50	20	IDGD	
COC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)c1C	798042433	RODZJFXQHQSFFA-UHFFFAOYSA-N	436.371	1.931	50	20	IDGD	
COc1ccccc1CCNC(=O)CNC(=O)NNC(=O)[C@@H](C)Oc1cccc(Cl)c1	798078754	ZYTKVDWTARRFTB-CQSZACIVSA-N	448.907	1.805	50	20	IDGD	
COc1ccc([C@@H]2[C@H](C(=O)NNC(=O)C(=O)Nc3ccc(C)c(C)c3)CC(=O)N2C)cc1	798309006	SUUBIQKBPVNFNY-UYAOXDASSA-N	438.484	1.618	50	20	IDGD	
Cc1c(C(=O)NNC(=O)[C@H]2COc3ccccc3O2)nnn1CCOc1ccc(F)cc1	799856439	FCVBSMKCCLYXHD-GOSISDBHSA-N	441.419	1.406	50	20	IDGD	
COc1ccc(Cl)c(NC(=O)NNC(=O)c2cc(S(=O)(=O)N(C)C)cn2C)c1	802108364	MNLXZQKVACNAEW-UHFFFAOYSA-N	429.886	1.404	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)C(=O)Nc1cccc(Br)c1Cl	802571267	SHIKCKLNNYKVOU-UHFFFAOYSA-N	443.641	1.211	50	20	IDGD	
CS(=O)(=O)CC[C@@H](NC(=O)c1ccccc1Cl)C(=O)NNc1cccc(F)n1	804767202	ZGJWBMXFKOCJBA-CYBMUJFWSA-N	428.873	1.551	50	20	IDGD	
CCN(C)C(=O)c1cccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)c1	806974804	HAGIJCPBHCYONM-CYBMUJFWSA-N	430.436	1.471	50	20	IDGD	
CC(C)(O)c1cccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)c1	806979500	XNKUJQQSIPQPDT-UHFFFAOYSA-N	425.420	1.843	50	20	IDGD	
CC(C)(C)OC(=O)N1CCCc2c(CNC(=O)NNC(=O)C(=O)NC3CC3)cccc21	807601224	VCZOZMHMRVWISD-UHFFFAOYSA-N	431.493	1.483	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCN(c2ccccc2Cl)C1)c1csc(N2CCOCC2)n1	809980823	WMCGDYLNESOREW-CYBMUJFWSA-N	435.937	1.921	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNS(=O)(=O)c1cnc2onc(-c3ccccc3)c2c1	811684261	CIVVMBXRTAJCMX-UHFFFAOYSA-N	431.474	1.504	50	20	IDGD	
C[C@H]1Oc2ccccc2N(CC(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)C1=O	811789097	RAMPTCDHKZYCCD-GFCCVEGCSA-N	431.832	1.458	50	20	IDGD	
COC[C@]1(CNC(=O)NNC(=O)c2ccc(OC)cc2OC)OCCc2ccccc21	811875926	GYMRIKCVZUUTDF-QFIPXVFZSA-N	429.473	1.762	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@](C)(O)C2CCC2)c1	813363818	UVWMOZXXCUPFKW-OAQYLSRUSA-N	447.513	1.808	50	20	IDGD	
CCn1ccnc1C(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccc(OC)cc2)c1	813363923	YRCOJICIMQAZOK-UHFFFAOYSA-N	443.485	1.787	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)/C=C/CN(C)CC(F)(F)F)c2ccccc2c1=O	814364432	BYYDGMZGTGMLKB-RMKNXTFCSA-N	425.411	1.618	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CNc2ccc(C)cc2C)cc(Cl)c1OCC(N)=O	825763928	FMHHHNMMOFBUHK-UHFFFAOYSA-N	434.880	1.703	50	20	IDGD	
CC[C@H](C)NS(=O)(=O)c1ccc(C(=O)NNC(=O)CNc2cccc(OC)c2)cc1	825805710	NPQCGMRFRWLIDC-AWEZNQCLSA-N	434.518	1.645	50	20	IDGD	
O=C(CN1C(=O)N[C@]2(CCc3ccccc32)C1=O)NNC(=S)NCCc1cccs1	838822203	MNSDFYZYGNXEKL-FQEVSTJZSA-N	443.554	1.179	50	20	IDGD	
C[C@]1(c2ccccc2)NC(=O)N(CC(=O)NNC(=S)NCCc2cccs2)C1=O	838849834	GLIVNNYKRBLHPU-LJQANCHMSA-N	431.543	1.253	50	20	IDGD	
O=C(c1ccc(Br)c(F)c1)N1CCC[C@H](C(=O)N2CC[C@H](B(O)O)C2)C1	864231076	IRSCBWYUPJKHQM-STQMWFEESA-N	427.079	1.516	50	20	IDGD	
O=C(NNC(=O)c1ccccc1NS(=O)(=O)c1ccc2c(c1)OCCO2)c1ccc[nH]1	871595981	JBUFDXOARYYWIT-UHFFFAOYSA-N	442.453	1.662	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)[C@@H]1CC(=O)N(c2ccc3c(c2)OCCO3)C1	871626767	UMNURLIMGGJLPI-MRXNPFEDSA-N	439.468	1.600	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)OCC(=O)NCC(=O)N2CCCC2)c(C)n1C[C@@H]1CCCO1	912619752	QHGXLRMQQGLSNX-FJZBCQJGSA-N	442.516	1.473	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)CN2C(=O)N[C@@]3(CCCC[C@@H]3C)C2=O)cc1OC	913069835	PWABYKRSSIDCSL-RCDICMHDSA-N	446.504	1.746	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)CCNS(=O)(=O)c2ccccc2Cl)c(C)c1	913164465	JTUXSAXKTQKCJE-UHFFFAOYSA-N	438.937	1.885	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CCCNS(=O)(=O)c2ccc(C)c(C)c2)cc1OC	913415641	CCZMITKUULXLRH-UHFFFAOYSA-N	449.529	1.840	50	20	IDGD	
O=C(CN1C(=O)COc2cc(Br)ccc21)NNC(=O)NC1CCCCC1	915286263	KAOMIKGVEYZZQC-UHFFFAOYSA-N	425.283	1.838	50	20	IDGD	
O=C(NCCCn1ccnc1)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	915880573	NOKJSFGLCPBLLH-UHFFFAOYSA-N	434.522	1.092	50	20	IDGD	
Cn1ccnc1[C@](O)(CCNC(=O)NNC(=O)Cc1c[nH]c2ccccc12)C(F)(F)F	916377956	HPWQNGFBQROTSR-GOSISDBHSA-N	438.410	1.615	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NC[C@@H](C2CCCCC2)N(C)C)nc1	916448668	MISMFKPNPPAXLE-KRWDZBQOSA-N	426.587	1.905	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)N[C@@H]2CCN3CCCC[C@@H]23)c2ccccc2c1=O	916638925	NLJUDMLBALLKOR-MSOLQXFVSA-N	426.521	1.767	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)c2cc3c(cc2O)OCO3)cc1	917021238	GQTZXFJHCZEAML-UHFFFAOYSA-N	427.442	1.617	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)CS(=O)(=O)Cc3ccc(C#N)cc3)n[nH]2)cc1	917176993	LZIZBIZAOMKHRX-UHFFFAOYSA-N	437.481	1.633	50	20	IDGD	
CNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2ccc(F)cc2Br)cc1	918341614	RNPMOPHXQJSHGE-UHFFFAOYSA-N	430.255	1.571	50	20	IDGD	
CN(C)C(=O)C[C@@H](NC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)c1ccccc1	920046785	NURBBIPCERSJMJ-QGZVFWFLSA-N	432.502	1.254	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)NCc2cccc(NC(=O)[C@@H]3CCCO3)c2)c1	920238104	QUGMXHLJBBYEMW-IBGZPJMESA-N	442.472	1.966	50	20	IDGD	
CC[C@@]1(C(=O)NNC(=O)CCN2C[C@H](C)O[C@H](C)C2)CCN(C(=O)OC(C)(C)C)C1	1116344174	IEWWYBGOMHRTOF-VWKPWSFCSA-N	426.558	1.670	50	20	IDGD	
CC(C)[C@@H](CNC(=O)NNC(=O)c1ccc(Br)cc1)N1CCN(C)CC1	1317888303	AMPAXHXHAAOAJL-MRXNPFEDSA-N	426.359	1.665	50	20	IDGD	
Cc1nnnn1/C(=C\c1ccc(F)cc1)C(=O)NNC(=O)c1cncn1-c1ccccc1	1317995294	HDLIAXWCHVNSKS-WQRHYEAKSA-N	432.419	1.766	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)N[C@H]2CCN(c3cnn(C)c3)C2)N(C)c2ccccc21	1318620777	KAQQPCXINJIQQC-INIZCTEOSA-N	433.516	1.786	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N2CC[C@](O)(C3CC3)C2)cc1	1321375939	NGFHOHGGBQVFQQ-SKELBMGJSA-N	449.511	1.714	50	20	IDGD	
O=C(NCCN1CCN(Cc2ccccc2)CC1)NNC(=O)c1cncn1-c1ccccc1	1337447120	UZGMTOFTZMYZEW-UHFFFAOYSA-N	447.543	1.634	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4cc(OC)ccc4n3)C2)C1	1777900355	RRAPQCQSIDJDPK-VGOFRKELSA-N	447.919	1.941	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Cl)C2)c1ccc2nc(CO)[nH]c2c1	1778515929	KYFXNNKVFQSEGW-OXFYSEKESA-N	438.887	1.717	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)/C=C/C(=O)NCc3ccco3)C2)C1	1779207755	YKJMZKKYKOUYAB-PYIGHKJLSA-N	437.924	1.689	50	20	IDGD	
COc1nc(C)ccc1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2	1779743595	OSDZONDZEHDYEA-ACJLOTCBSA-N	426.311	1.626	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Cl)C2)c1nn[nH]c1C(F)(F)F	1780194216	QBJCRRFZABLMNO-XPLICSAQSA-N	427.786	1.485	50	20	IDGD	
Cn1ccc(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](F)Br)C2)n1	1780771916	SVFHYSAZYNIJJQ-UKPHBRMFSA-N	431.306	1.167	50	20	IDGD	
O=C(c1cc2cccnn2c1)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781332403	GZSBMDKOOGRLRC-PBHICJAKSA-N	425.258	1.468	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CC13CCCN1CCC3)C2	1782178637	MOPXOIBXEVJOTA-WAOWUJCRSA-N	442.000	1.773	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3c(C)nc4ccc(F)cn34)CCO2)C1	1783881969	OQMNVCUPBMTTRJ-FOIQADDNSA-N	438.887	1.479	50	20	IDGD	
C[C@@H](NC(=O)c1ccccc1)C(=O)N1CCO[C@@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783952635	UTMIFAMJOSFYEF-BFUOFWGJSA-N	428.316	1.439	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4cc(O)ccc4n3)C[C@@H]21)[C@H](O)CCl	1784090359	AZTAYTZNRDVSMH-JOQQVMPUSA-N	433.892	1.133	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3c(Cl)ccc4c3OCO4)C[C@@H]21)[C@H](O)CCl	1784090688	KXDBVMUDZKVDRQ-MEDZGJRSSA-N	445.299	1.262	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]2C1	1784092822	MPUOLFPKPDOTCR-RMIITELYSA-N	431.316	1.542	50	20	IDGD	
COc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]32)cn1	1784763807	SKFLGQGHTXAWHN-XMDUPGNXSA-N	430.332	1.920	50	20	IDGD	
CCOc1cnc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCBr)C[C@@H]32)cn1	1785606183	RERPQILYOPNUBW-YDHLFZDLSA-N	441.326	1.254	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC1(c2ccc(NC(=O)[C@@H](N)CCC(N)=O)cc2)CCC1	1787979965	QZDBWYCKGNDLOU-KBXCAEBGSA-N	429.348	1.950	50	20	IDGD	
Cc1nn(C)c(C)c1CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]2C1	1788766189	VDZHVNDWRSFLPL-WDSOQIARSA-N	436.629	1.411	50	20	IDGD	
CCc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Br)C[C@@H]32)nn1C	1789067679	SPHUHCXKNJIAIO-LVGORTOPSA-N	431.306	1.266	50	20	IDGD	
CCn1nc(C(C)C)cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](Cl)COC)C[C@@H]21	1789382456	FVDYCANDOWRLMI-FPXQBCRKSA-N	440.972	1.874	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3n[nH]c4ccccc34)C[C@@H]21)[C@@H](F)Br	1789926370	VIVJHMSWCYTDFO-YLUJIRGKSA-N	439.285	1.847	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1ccc2ccoc2c1	1790395316	DAPYVCBDPPRZPP-VCOUNFBDSA-N	448.284	1.020	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)[C@@H](O)N3CCOCC3)CCC2)cc1)[C@H](F)Br	1790536630	VOUZJIJGFYQMDH-WMLDXEAASA-N	444.301	1.462	50	20	IDGD	
COC(=O)C12CC(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)C(C)(C)CCl)C[C@@H]43)(C1)C2	1791013317	RNUOEOJZSGQDCY-DYDXAHRQSA-N	426.941	1.574	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCN3CCCCC3)C[C@@H]21	1791058123	PXGLPWQWDANLFE-QZWWFDLISA-N	430.387	1.626	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3ccc(C#N)cc3)C[C@@H]21	1791251056	SYVCCXMFGJGKAG-HAGHYFMRSA-N	433.936	1.724	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccnc(OC)c3F)C[C@@H]21	1791253608	CADMAXXRKYEDHK-MHEUCROKSA-N	429.876	1.076	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(CC(C)C)nn3C)C[C@@H]21	1791254791	RZYOMXVSIGDLMI-RMRDIRSESA-N	440.972	1.466	50	20	IDGD	
C[C@@H](NNc1ccccc1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]2C1	1791292582	XEQNQYIDIGUNHO-VRKREXBASA-N	429.348	1.775	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCCn3ccnc3)[C@H]2C1	1791567897	ZHODNLLIFJNVDK-FPXQBCRKSA-N	431.364	1.879	50	20	IDGD	
Cc1nn(C)c(C)c1CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)CBr	1792873452	YCTVUSHDJJYKTC-MKXCTONWSA-N	441.370	1.200	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1CC(=O)N(Cc2cccs2)C1)[C@@H](O)CCl	1794239445	GXPUQWDRVXUYQK-JBXGNFEISA-N	439.965	1.335	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1cnc[nH]1	1796768981	AOGSIUNRCGEORD-UKMLZYKCSA-N	439.944	1.723	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnn3c1CCC3)C2	1796893843	ZCIFFCHSORHCJW-MVRRYPJTSA-N	437.504	1.215	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(=O)c3ccccc3o1)C2	1797953942	VNSPCMNIGYKSGK-USGNIVHTSA-N	444.560	1.848	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cc(F)ccc1F)C2	1797959376	OETJRERJYJABHL-YVWYUNDQSA-N	426.536	1.948	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/C(=O)NCc1ccco1	1798570927	CISNRXVNLLDJNS-RFVJJRFUSA-N	433.581	1.942	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc(Br)cn1)C2	1799264742	TWGSHDNPVNXYSK-DJZPMSPPSA-N	444.757	1.994	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1C[C@H](NC(=O)OC(C)(C)C)C1)C2	1799270911	CBKAOMPQZPQRPA-XJTKPRQNSA-N	443.972	1.897	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3ncsc3[nH]1)C2)[C@@H](F)Br	1799349655	JRBICUSXMBCRCI-IWXIMVSXSA-N	431.287	1.518	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)c1c(Cl)ccc(Cl)c1O	1799733889	IWGMWVUTVXOPTC-XSPYEYLBSA-N	437.707	1.502	50	20	IDGD	
CO[C@H](C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](Br)Cc1ccccc1	1800435948	GEOCVFQNNAOUBA-FWEDZOCSSA-N	439.350	1.617	50	20	IDGD	
CCc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](Br)CC)nn1C	1800641881	LPRUDRLSIATRAI-FAXLKDOZSA-N	427.343	1.359	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc3ccccc3n1)C2	1800758278	VQDHLRVOSGXWOI-JRATXPSKSA-N	433.306	1.616	50	20	IDGD	
C[C@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc3c1NC(=O)C3=O)C2	1801962369	HPLZSDSBJSDMSW-YFKTTZPYSA-N	434.290	1.857	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@H](CNC(=O)Cc2cnccn2)[C@@H]1c1cccnc1	1803300237	IUNISJKBVNZPRR-UWJYYQICSA-N	427.581	1.972	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@H](CNC(=O)CN2CCNC2=N)[C@H]1c1cccnc1	1807119726	ZVTVHIIQXDFWCX-GMBSWORKSA-N	441.363	1.164	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1807360313	QWSFBYURAFLRAB-YZGWKJHDSA-N	443.740	1.489	50	20	IDGD	
Cc1ccc(CC(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)o1	1807373957	GVHMWWOZVKJANY-CVDCTZTESA-N	447.300	1.225	50	20	IDGD	
Cc1cnn(CC(=O)NC[C@@H]2CCN(C(=O)[C@H](F)Br)[C@H]2c2cccnc2)c1	1807668584	NJTNLGSTQMGBBD-XIRDDKMYSA-N	438.301	1.983	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)NC[C@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1	1808225370	BILNVEAPSMBVDZ-IJEWVQPXSA-N	440.342	1.319	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)CCN2C(=O)C=CC2=O)[C@H]1c1cccnc1	1808249821	DMSUJZNTTNUEBG-FTRWYGJKSA-N	432.908	1.420	50	20	IDGD	
CN(C)C(=O)NCC(=O)N1CC[C@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]1c1cccnc1	1808290191	QLPPHZDJTSVLCW-OGWOLHLISA-N	444.363	1.595	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1CCN(C(=O)[C@@H]2CNC(=O)O2)[C@H]1c1cccnc1	1808290352	SOLINDJLVHMVDG-NUXNZHGMSA-N	429.304	1.432	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)C(C)(C)C#N)[C@@H]1c1cccnc1	1808410615	VFDOFGSUXDQXTQ-WXBYGLBUSA-N	449.515	1.771	50	20	IDGD	
Cc1ccc(C(=O)N2CCC3(CCCN(C(=O)c4ccc(B(O)O)cc4)C3)CC2)c(C)n1	1809971251	NGDRHOZBGRFUJI-UHFFFAOYSA-N	435.333	1.537	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2ccccc2F)[C@H]1c1cccnc1	1811679930	AHBPUMFEZBQPDN-HTAPYJJXSA-N	441.507	1.913	50	20	IDGD	
CN1CCCn2nc(C(=O)NC[C@@H]3CCN(C(=O)[C@@H](F)Cl)[C@H]3c3cccnc3)cc2C1	1812286546	ZLDQDZDYCWXBKV-ZYSHUDEJSA-N	448.930	1.968	50	20	IDGD	
O=C(Cn1cnc2ccccc21)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1	1812966198	KQVJVXWLWGXVGI-NBHGPNQESA-N	441.919	1.737	50	20	IDGD	
Cc1nc(C(=O)N2CC[C@H](CNC(=O)C(Cl)Cl)[C@@H]2c2cccnc2)c(=O)[nH]c1C	1813077862	OOSDEQVRVLHTIG-HIFRSBDPSA-N	438.315	1.905	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)[C@H]1C[C@]1(F)Cl	1813151410	CIFMHQSFKRVSPK-NWUWZPLHSA-N	445.687	1.006	50	20	IDGD	
C[C@@H](CBr)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H]2CNC(=O)O2)[nH]n1	1814778338	GHGBXUMODGJPCQ-WCQGTBRESA-N	428.287	1.541	50	20	IDGD	
C[C@H](CC(N)=O)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](C)CBr)[nH]n1	1815291554	OOLUMCPDWHVSJZ-NTZNESFSSA-N	428.331	1.944	50	20	IDGD	
Cc1cc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)cnc1C	1816069874	JEWGJBKSRRTUCW-HXUWFJFHSA-N	447.304	1.721	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](C)CBr)CC2	1817010545	JXORKYZHEITJHQ-UTLUCORTSA-N	446.371	1.533	50	20	IDGD	
COCCn1ccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)[C@@H](Cl)COC)[nH]n2)n1	1818261681	CHTBEZMTLIYIEF-XJKSGUPXSA-N	438.916	1.812	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@H](O)CCl)CC2)c1ccc2nccnc2c1	1818488429	RUHAJQUBUMZYFP-IAQYHMDHSA-N	431.905	1.912	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)Cc3ccc4ncnn4c3)sc2C1	1822501265	LUAFBBICHYZOPY-OLZOCXBDSA-N	448.936	1.594	50	20	IDGD	
CC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CS(=O)(=O)N1CCCC1)CC2	1822846429	ZEJHLILYOCTFEG-NEPJUHHUSA-N	448.998	1.498	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@H](C)CS(C)(=O)=O)CC1	1824529068	YZFDYNJHWQTSLX-HYVNUMGLSA-N	437.002	1.541	50	20	IDGD	
COCC(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)[C@H](F)Cl)C2)C1	1828860706	AFDWOCYGZUZPRL-FXAWDEMLSA-N	441.887	1.619	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4ncsc4[nH]3)C2)C1	1830365257	WAZWIIHRKNRDTJ-IBGZPJMESA-N	440.953	1.959	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)C[C@@](C)(O)CC(=O)O)CC1	1831835156	OZOKUTHGYZBTFN-TWOQFEAHSA-N	432.945	1.476	50	20	IDGD	
C[C@@H](C(=O)NC1CCN(C2CCN(C(=O)CO[Si](C)(C)C)CC2)CC1)C1(O)CCC1	1833068596	UTVGVPDFLHPGAK-KRWDZBQOSA-N	439.673	1.961	50	20	IDGD	
C[C@@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)C3CC(O)C3)CC2)CC1	1833264507	DDSYYWZCJVTREZ-CBCUQQMYSA-N	430.387	1.360	50	20	IDGD	
Cc1cnc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](C)CBr)C3)C2)s1	1833796676	LLYRJOXGTBHPJH-SJCJKPOMSA-N	446.367	1.553	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)c3coc(Cl)n3)C2)C1	1834819744	ZOKISKNMWLSYKV-HNNXBMFYSA-N	436.690	1.183	50	20	IDGD	
N#Cc1cccc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCBr)CCO3)C2)c1	1834824141	SBYNQDHLOJPFMA-LJQANCHMSA-N	436.306	1.413	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3ccc4ncnn4c3)CC2)CC1	1835633093	SMNZRZJCODVEEG-SFHVURJKSA-N	432.956	1.932	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)n1cccc1C=O)CCO2	1835957193	BJCJUMKHDJRXQD-KNBMTAEXSA-N	425.913	1.335	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)[C@@]3(C)CCCN3)CC2)CC1	1836384712	IKTMQLPLLUWHPU-YLJYHZDGSA-N	443.430	1.874	50	20	IDGD	
Cn1nncc1C(=O)N1CCC(OC2CCN(C(=O)CCBr)CC2)CC1	1837228584	FIIWVHAWRYTDII-UHFFFAOYSA-N	428.331	1.212	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)c3ccn(C)n3)CC2)CC1	1837490983	NJWOYGJSOQGVAM-ZDUSSCGKSA-N	427.343	1.816	50	20	IDGD	
O=C(/C=C/c1ccsc1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839198398	ZFFFBUYFCBBCCV-CYJXPKQYSA-N	447.326	1.908	50	20	IDGD	
CCc1ccnc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)c1	1839199691	RWXGWQGPDXQVTG-YJBOKZPZSA-N	444.301	1.405	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3c(O)cc(O)cc3O)CCO2)C1	1839371770	OGPBOCXOYOJOOV-FQEVSTJZSA-N	442.896	1.138	50	20	IDGD	
Cc1ccn(C)c1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2	1840034152	BRLXSFUOBWMWSV-KDOFPFPSSA-N	428.327	1.187	50	20	IDGD	
C[C@@H](Nc1ccccc1)C(=O)N1CCOC[C@@]2(CN(C(=O)C(Cl)Cl)CCO2)C1	1840188350	FPFMVTOJAKKGQL-KUHUBIRLSA-N	430.332	1.747	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)o1	1840188677	WZLKLEXJAGUQCC-KRWDZBQOSA-N	434.276	1.112	50	20	IDGD	
CN(CC(=O)N1CC2(CCCN2C(=O)[C@H]2CCCCO2)C1)NC(=O)NCc1ccccc1	1841104369	PMAKDCJNKMPPFE-LJQANCHMSA-N	443.548	1.105	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC2(CCCN2C(=O)Cc2cnc[nH]2)C1	1843343764	FAIIFSAHGZDHSY-AWEZNQCLSA-N	425.917	1.288	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1ccc(N(C)C)cc1)C2	1843416562	XWNYPJCWYBSRKM-PCLIKHOPSA-N	436.516	1.704	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC2(CCCN2C(=O)c2cc(=O)nc3cccnn23)C1	1844674222	GUBJLSHPALTSPU-LBPRGKRZSA-N	434.294	1.080	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)c2c(Cl)cccc2Cl)C1	1844865207	NIPWVYJUWNDWRD-UHFFFAOYSA-N	433.100	1.804	50	20	IDGD	
CCOC(=O)N1CCC(C(=O)N2CC3(CCCN3C(=O)[C@@H](C)Br)C2)CC1	1846180206	SXPZBPPQGZWHTC-CYBMUJFWSA-N	430.343	1.842	50	20	IDGD	
CC(=O)C[C@H](C)C(=O)N1CCCC12CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2	1846328320	CCDAYOATJKEVMP-KRWDZBQOSA-N	443.548	1.151	50	20	IDGD	
CC(C)Oc1ccc(C(=O)N2CC3(CCCN3C(=O)CCC(=O)NN(C)C)C2)cc1C#N	1846386447	NBLGIWGJVFLELN-UHFFFAOYSA-N	441.532	1.535	50	20	IDGD	
O=C1CC[C@@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](Br)Cc2ccccc2)CN1	1847323867	BPFPJRCKIVSBQD-OWSLCNJRSA-N	448.361	1.721	50	20	IDGD	
C[C@@H](O)[C@H](NC(=O)c1ccccc1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)C(Cl)Cl	1847437050	NGBOXCQSSKHHGL-UNQGMJICSA-N	428.316	1.171	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1ccc(CS(C)(=O)=O)nc1	1847438233	PZYLNQCYXMTTQD-HOTGVXAUSA-N	427.954	1.707	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](CNC(=O)NNC(=O)c2nnc(O)c3ccccc23)C1	726265238	DCRBIOPEXAVIKU-ZDUSSCGKSA-N	444.492	1.927	50	20	IDGD	
CN1C[C@@H](NC(=O)/C(C#N)=C\c2cn(CCC(N)=O)nc2-c2ccc(Cl)cc2)CC1=O	726538109	XGAWUPVWMIJQGT-QHIITQONSA-N	440.891	1.333	50	20	IDGD	
COC(=O)CCCN1CCC(=NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)CC1	727058748	FIRMCXISUWDJSU-UHFFFAOYSA-N	430.914	1.122	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNS(=O)(=O)c2ccc3c(c2)COC3)cc1	727720770	XCUYFCMVEAKBCY-UHFFFAOYSA-N	445.526	1.761	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)c1ccc(I)cc1Cl	727984973	BOHJQVBTKYFPFY-ZETCQYMHSA-N	442.662	1.140	50	20	IDGD	
O=C(NNc1nc(-c2cccnc2)no1)c1ccc2c(c1)S(=O)(=O)N(C1CC1)C2=O	728079210	PTZGOBPOQVTGFE-UHFFFAOYSA-N	426.414	1.195	50	20	IDGD	
CCO[C@@H](C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1)c1ccccc1	728216156	SYKJLMXKCMWAQN-HXUWFJFHSA-N	432.546	1.844	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)OCC(=O)NC(=O)NCC(F)(F)F)c1C	729408103	OAINQXFHQPNFBR-AUWJEWJLSA-N	430.383	1.590	50	20	IDGD	
N#C/C(=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)N1CCO[C@H](C#N)C1	729979279	DDWIRQOERWIVNH-IKFRKZOMSA-N	438.875	1.737	50	20	IDGD	
COc1cc(C)cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1O	730272015	HPBONWNIFDNTGA-UHFFFAOYSA-N	433.486	1.569	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)NC[C@@H](c1cccc(Cl)c1)N1CCOCC1	730827519	QRTQRMZNZQBUGX-KRWDZBQOSA-N	448.907	1.828	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(\C#N)C(=O)NC2CCN(CC(=O)N(C)C)CC2)c1C	731655698	ZLSUNYHRFFWMQJ-RONKMWSCSA-N	429.565	1.888	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@@H](C)N2CCN(c3ccc(F)cc3)CC2)cc1OC	732259015	XVHVYIKYCDCCLS-OAHLLOKOSA-N	430.480	1.815	50	20	IDGD	
CSc1nc(C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c2ccccn12	732332745	PTXGWXDEBTZJOO-UHFFFAOYSA-N	429.414	1.582	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)N[C@H]1CCN(c2ccccc2C(N)=O)C1	732594763	IHNLVYGKLLYOMG-HNNXBMFYSA-N	441.488	1.172	50	20	IDGD	
CCC[C@@H](NC(=O)Cc1ccccc1)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	732639230	MDFAAKGTYLWIBE-LJQANCHMSA-N	438.532	1.368	50	20	IDGD	
COc1ccc(C(=O)NNc2ccc(Br)nc2)cc1S(=O)(=O)N(C)C	732837038	SASXAQBIDICPLD-UHFFFAOYSA-N	429.296	1.860	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)[C@H]1CCCN1S(=O)(=O)c1cccc([N+](=O)[O-])c1	732951610	AGODGVXPOFQDHQ-QGZVFWFLSA-N	432.458	1.518	50	20	IDGD	
O=C(NCC1CCN(S(=O)(=O)C(F)F)CC1)NNC(=O)c1c[nH]c2ccccc12	733042750	WBEMAFJRMQHEFJ-UHFFFAOYSA-N	429.449	1.376	50	20	IDGD	
CCC[C@@H](C)C(=O)NNC(=O)C[C@@H]1c2cc(OC)c(OC)cc2CCN1S(C)(=O)=O	733358191	QDQASAKTUYKPHI-CZUORRHYSA-N	441.550	1.536	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)ccc1-n1cnnn1	734821954	PTURWEKWVBCAGX-UHFFFAOYSA-N	444.496	1.314	50	20	IDGD	
CN1CC[C@@H](OC(=O)/C(C#N)=C\c2cn(CCC(N)=O)nc2-c2ccc(Cl)cc2)C1=O	734880377	DNEHJOZFVNBJLX-OOXMNIKJSA-N	441.875	1.760	50	20	IDGD	
CCc1nc(C(=O)NNC(=O)c2nn(CC)c(=O)c3ccccc23)nn1-c1ccccc1	735461517	GJANBDUKKMHKGN-UHFFFAOYSA-N	431.456	1.634	50	20	IDGD	
C[C@H](CN1CCN(c2ccccn2)CC1)NC(=O)NNC(=O)COc1ccccc1F	735587868	YENQFBDHPIWVCW-MRXNPFEDSA-N	430.484	1.141	50	20	IDGD	
Cc1nc(-c2cccnc2)nc(NNC(=O)CCc2c(C)nc3nc(N)nn3c2C)c1C	736694066	XLWARLOCTPJLQC-UHFFFAOYSA-N	432.492	1.868	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)Cn2cnc3c(C)cccc3c2=O)cc1C	736769553	RUEJOYSHMMLBTI-UHFFFAOYSA-N	442.497	1.642	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)COCc1ccccc1)[C@@H]1CN(Cc2ccccc2)CCO1	741276923	BZGHQYYHPMLVMU-RXVVDRJESA-N	426.517	1.823	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNS(=O)(=O)c2cccc(-c3nnnn3C)c2)cc1	742026213	OXMJUQDKZNOJDP-CYBMUJFWSA-N	446.489	1.053	50	20	IDGD	
CC(C)CN1C(=O)/C(=C\NNC(=O)c2cccc(Br)c2)C(=O)NC1=S	742216148	SSTMTEXEFLCEFR-GHXNOFRVSA-N	425.308	1.467	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@@H](C(=O)NNC(=O)CNC(=O)c1ccco1)c1ccccc1	742611512	ACLDUHWOMSIWHJ-OAHLLOKOSA-N	430.461	1.465	50	20	IDGD	
COc1cc(CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)c2ccccc2n1	743509635	IUYONWSXXLBIDO-UHFFFAOYSA-N	442.501	1.681	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)CCc2nc(-c3ccsc3)no2)cc1	744523911	XGZYVLKAKMQKGT-UHFFFAOYSA-N	425.426	1.607	50	20	IDGD	
O=C(COc1cccc([N+](=O)[O-])c1)NNc1ccccc1S(=O)(=O)N1CCOCC1	744621758	FWLYMDZZSIZCDO-UHFFFAOYSA-N	436.446	1.138	50	20	IDGD	
COC(=O)COc1ccc(C(C)=NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1	744996527	BIPJHZNGEQCISU-UHFFFAOYSA-N	433.486	1.643	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)N[C@@H]2CC(=O)N([C@H]3C[C@H]3c3ccccc3)C2)nc2ccccc21	745914125	IZYUBECAFITKOA-UWVAXJGDSA-N	446.511	1.603	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)c1ccc(C[C@@H]2CC(=O)NC2=O)cc1	746096439	UUKHNRMTPLXRMU-MRXNPFEDSA-N	433.468	1.265	50	20	IDGD	
C[C@H](C(=O)NNC(=O)c1ccc(Cl)cc1Cl)N1C(=O)[C@H]2[C@H](C1=O)[C@H]1CC[C@H]2O1	746100307	JIWKZWCYHDYYLK-ODTJPNJJSA-N	426.256	1.305	50	20	IDGD	
Cc1cc(=O)n(CC(=O)NC(C)C)c(C)c1C(=O)NNC(=O)NCCc1cccs1	746167737	XZGDTXPZTRAGAF-UHFFFAOYSA-N	433.534	1.238	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1[N+](=O)[O-]	746576868	JIVGOUWWSLUQRX-UHFFFAOYSA-N	426.838	1.533	50	20	IDGD	
COC(=O)c1ccsc1N1CC[C@@H](NC(=O)NNC(=O)COCc2ccccc2)C1=O	746779836	LEAOTTVJJWOWLD-OAHLLOKOSA-N	446.485	1.187	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)[C@]2(C)CCN(C(C)=O)C2)c2ccccc2c1=O	746820624	CLIRKUZFXNABDK-JOCHJYFZSA-N	427.505	1.606	50	20	IDGD	
CC(C)C(=O)NNS(=O)(=O)c1c(Br)cc(C(=O)O)cc1Br	747595326	AWWHJNKRTQXNJR-UHFFFAOYSA-N	444.101	1.875	50	20	IDGD	
O=C(NNS(=O)(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)c1ccc(Cl)nc1	747607076	QNAHFKVMRLSGGS-UHFFFAOYSA-N	444.922	1.143	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@H](C)C(=O)NNC(=O)CNS(=O)(=O)CCOC(C)C	747905525	DELQVUYCZVOJCD-CQSZACIVSA-N	449.957	1.216	50	20	IDGD	
CCCCN1C(=O)CC[C@H](C(=O)NNC(=O)C(=O)N2CCCC2)[C@H]1c1ccc(OC)cc1	748240256	DFGNYLCEDLJQNZ-AZUAARDMSA-N	444.532	1.545	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)NCC(=O)NNc2ccc(OC(F)F)cc2)cc1	748643773	PNJPEPJNJPDUEX-UHFFFAOYSA-N	443.428	1.886	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNS(=O)(=O)c2cc(OC)c(C(=O)O)cc2Cl)c1	749143760	ZPJPCOMPIYOIRY-UHFFFAOYSA-N	444.849	1.687	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)[C@@H]1CCCN1C(=O)c1ccc2c(c1)OCO2	749561943	STAFSVFLPUISKN-INIZCTEOSA-N	429.404	1.385	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)NCc1ccccc1CN1CCC(O)CC1	749588017	CJTITUKWRQPDTQ-UHFFFAOYSA-N	442.516	1.561	50	20	IDGD	
CCOC(=O)c1sc(CNC(=O)NNC(=O)Cc2nc3ccccc3n2C)nc1C	750672342	QCHKAYILMRVCBA-UHFFFAOYSA-N	430.490	1.588	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)CCNC(=O)C2CCCCC2)c2ccccc2c1=O	751052803	ABTAWLKGIPCHLC-UHFFFAOYSA-N	427.505	1.654	50	20	IDGD	
C[C@H](NC(=S)NNC(=O)c1cccc(S(=O)(=O)NC[C@H]2CCCO2)c1)C1CC1	751620969	NDOPJNRAPKKHPU-SWLSCSKDSA-N	426.564	1.051	50	20	IDGD	
NC(=O)c1ccccc1Oc1ncccc1C(=O)OCC(=O)NNC(=O)c1ccccc1	753511749	IGBQJHFIUVMELM-UHFFFAOYSA-N	434.408	1.591	50	20	IDGD	
COC(=O)c1cc2c(cc1NC(=O)C(=O)NNC(=O)C(C)(C)c1ccccc1)OCO2	753841861	UZNASYMCWWSQTR-UHFFFAOYSA-N	427.413	1.266	50	20	IDGD	
CC(=O)Nc1ccccc1C=NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	755467667	SEUUFTWKZGVNAW-UHFFFAOYSA-N	430.486	1.430	50	20	IDGD	
CCOCC(=O)NNC(=O)Nc1ccc(C)c(S(=O)(=O)Nc2ccccc2OC)c1	755494998	IIHJRJVZMVZUPQ-UHFFFAOYSA-N	436.490	1.994	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)c2ccc(Cl)cc2O)n([C@H]2CCS(=O)(=O)C2)n1	755537428	VDZYMJIVNXCWFY-NSHDSACASA-N	427.870	1.377	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)Nc2ccc(C(=O)NC3CCOCC3)cc2)cc1	757618613	COUNHRQLSLFRSY-UHFFFAOYSA-N	437.456	1.699	50	20	IDGD	
CCN(CC)CCNC(=O)c1cc(NC(=O)NNC(=O)c2cnccn2)ccc1Cl	757757954	NZFMGSAVRLANEG-UHFFFAOYSA-N	433.900	1.668	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)Nc1cccc2c1CCN2S(C)(=O)=O	758297117	YPTBMTNLQXBVCD-UHFFFAOYSA-N	434.474	1.249	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)NC[C@H]2CN(Cc3ccccc3)CCCO2)c1	759214733	RJENJTAUTRVNOV-NRFANRHFSA-N	425.533	1.988	50	20	IDGD	
CCCn1c(=O)nc(O)c2c(C(=O)NNc3ccc(C(=O)OC)cn3)cc(C(C)C)nc21	759738369	GJWODMBGUVAPEU-UHFFFAOYSA-N	440.460	1.969	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)C(=O)Nc1cc2ccccc2nc1Br	760289565	DUYQLFWNKZMETI-UHFFFAOYSA-N	428.246	1.721	50	20	IDGD	
COC(=O)c1cn([C@H]2CCN(C(=O)NNC(=O)c3cc4c(s3)CC[C@H](C)C4)C2)nn1	760656124	LQJKDQZJNRIEJQ-AAEUAGOBSA-N	432.506	1.552	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)[C@@H](NC(C)=O)C3CCCC3)n[nH]2)cc1OC	763151827	GMHWWBVUHIFWOZ-IBGZPJMESA-N	429.477	1.550	50	20	IDGD	
O=C(NNC(=O)c1ccccc1Br)C(=O)Nc1cccnc1-n1cccn1	763484364	XSBUJKOOUBJQQD-UHFFFAOYSA-N	429.234	1.430	50	20	IDGD	
Cn1ccnc1-c1csc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)n1	763603958	DTIUEUGBQAJFDR-UHFFFAOYSA-N	436.457	1.333	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)NC(=O)[C@H](C)O3)c2ccccc2n1	763615943	JKVDPZHYADWNMB-LBPRGKRZSA-N	433.424	1.662	50	20	IDGD	
Cc1ccnc(-c2cccc(NC(=O)C(=O)NNC(=O)CN3CCCc4ccccc43)c2)n1	763736425	TXZLRAXLGPOYGO-UHFFFAOYSA-N	444.495	1.991	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2ccc(C)c(NC(C)=O)c2C)c1	763771386	HASBQPKSGOZYJB-UHFFFAOYSA-N	428.445	1.679	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)C(=O)Nc1cc(C(F)(F)F)ccc1F	763803988	QHXSLOBGHIEOSZ-UHFFFAOYSA-N	444.297	1.918	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)C(=O)Nc2ccc(C#N)cc2)c2ccccc2c1=O	763805101	RVEOSXJEJUJJHQ-UHFFFAOYSA-N	432.440	1.468	50	20	IDGD	
CCOC(=O)c1ccsc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccc(C(C)=O)cc1	763873015	RHDSUPKBDSQQKX-GFCCVEGCSA-N	447.469	1.681	50	20	IDGD	
CC(C)CC(=O)NNC(=O)C(=O)Nc1ccc(S(=O)(=O)N(C)Cc2ccccc2)cc1	763880918	BLZBUKYNXIDCKV-UHFFFAOYSA-N	446.529	1.639	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cnc3c(c2)COCC3)cc1OC	763912033	LBSARZSHDOEHJJ-UHFFFAOYSA-N	442.472	1.742	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)C2=S=C3CC[C@@H](C)CC3=C2)cc1C	763940952	JWONPIIYVSOYJB-LLVKDONJSA-N	429.498	1.706	50	20	IDGD	
O=C(NNC(=O)c1ccc[nH]1)C(=O)Nc1cc(F)c(F)cc1I	763980284	YHBCCSSMLMAYIY-UHFFFAOYSA-N	434.140	1.297	50	20	IDGD	
CNC(=O)c1ccc(OC)c(NC(=O)C(=O)NNC(=O)c2cccc(C(F)(F)F)c2)c1	764037988	XVWJHJABNWEGCR-UHFFFAOYSA-N	438.362	1.473	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)C2CCCC2)cc(OC)c(OC)c1OC	764076871	JAQYKCXATCOMBW-UHFFFAOYSA-N	437.449	1.165	50	20	IDGD	
CCOc1cc(Cl)ccc1NC(=O)C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	764085759	NYGRSCMNUSBLIB-UHFFFAOYSA-N	439.877	1.542	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(F)c(Br)c2)c1O	764131222	ICVUBJGMSMWBQM-UHFFFAOYSA-N	426.198	1.702	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccc(OCc2ccncc2)cc1	764139578	VVMUFOVBUDSAIK-UHFFFAOYSA-N	434.452	1.998	50	20	IDGD	
COC(=O)N(C)Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)cc1	764348928	DJMRKYRNLVRLFH-UHFFFAOYSA-N	434.836	1.644	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2cccs2)[nH]n1)C(=O)Nc1cccnc1Br	764378259	XJATXPBSPBDTOY-UHFFFAOYSA-N	435.263	1.695	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)C(=O)Nc1ccc(NC(=O)C2CC2)cc1	764393194	DOMXXIBTCQBKBP-UHFFFAOYSA-N	428.470	1.619	50	20	IDGD	
CC(C)(C)CC(=O)N1CSC[C@H]1C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C	765322075	GMPCGCCLMMFFTH-ZDUSSCGKSA-N	430.571	1.776	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)[C@H]2CN(C(=O)OC(C)(C)C)CCO2)cc1F	765439353	YDRDRSUYASBQLX-CQSZACIVSA-N	428.486	1.788	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3c4ccccc4C[C@@H]3C)c2)n[nH]1	765587010	NHNCYEAKTLJPRC-AWEZNQCLSA-N	439.497	1.933	50	20	IDGD	
O=C(NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)o1)c1cc(-c2ccc(F)cc2)[nH]n1	765620623	YGGLYFSSFWBVQS-UHFFFAOYSA-N	447.448	1.668	50	20	IDGD	
CC(C)(C)c1ncsc1C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	766637145	YODHBAWBLKQJGG-UHFFFAOYSA-N	429.546	1.660	50	20	IDGD	
O=C(CCOC[C@H]1CCCO1)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	766661606	XONCCYWGSGFGAY-GOSISDBHSA-N	438.956	1.191	50	20	IDGD	
Cc1cccc(S(=O)(=O)N2CCN(S(=O)(=O)CBr)CC2)c1Cl	767851803	VFSNNVPHLOOZBG-UHFFFAOYSA-N	431.761	1.637	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)CSc1ccc(S(=O)(=O)N2CCCC2)cn1	768288823	DHTIOOSYHMRNRZ-UHFFFAOYSA-N	448.570	1.657	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)c2ncn(-c3ccccc3)n2)CC1	768483575	KRQZIJIMIGNWGX-UHFFFAOYSA-N	429.481	1.611	50	20	IDGD	
CC1(C)CCC[C@]2(C1)NC(=O)N(CC(=O)NNC(=O)c1cc(Br)c[nH]1)C2=O	768571070	METVRRDHEPFRPS-QGZVFWFLSA-N	440.298	1.429	50	20	IDGD	
COc1ccc(NNC(=O)c2ccc(Br)c(S(N)(=O)=O)c2)c([N+](=O)[O-])c1	768582862	YOZFKLFBNLSOGM-UHFFFAOYSA-N	445.251	1.770	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)c1nn(-c2ccc(F)cc2)ccc1=O	768635846	JYEXHUNGQUQHRT-UHFFFAOYSA-N	432.433	1.541	50	20	IDGD	
Cc1cccc(N2CCN(S(=O)(=O)CC(=O)NNc3cc(C#N)cc(Cl)n3)CC2)c1	768695096	MBUKVQSQLJZCDG-UHFFFAOYSA-N	448.936	1.510	50	20	IDGD	
Cc1ccc(C(=O)NNc2cc(C#N)cc(Cl)n2)cc1S(=O)(=O)N1CCOCC1	768712927	ZHSNNHKJYMCEJJ-UHFFFAOYSA-N	435.893	1.693	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)Nc1cnn(-c2ncccc2C#N)c1	769247447	CRNOSXOSZOESAZ-UHFFFAOYSA-N	427.446	1.700	50	20	IDGD	
CN(C)C(=O)COc1ccc(C(F)(F)C(=O)NNC(=O)COCc2ccccc2)cc1	769475317	KEFLUXHRUHUNHY-UHFFFAOYSA-N	435.427	1.610	50	20	IDGD	
C[C@@]1(c2ccc(F)c(Cl)c2)NC(=O)N(CC(=O)NNC(=O)c2ccc(C#N)cc2)C1=O	770229863	XUNBQOUUVNRBRA-FQEVSTJZSA-N	443.822	1.579	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)[C@@H]3CCCN(C(=O)c4ccncc4)C3)nc21	770968231	JLDCOKLBQFOWEJ-CQSZACIVSA-N	438.492	1.677	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)c3cccc(-c4cnc5nc(O)n(C)c5c4)c3)nc21	771826276	NCRBUKILTGYTDJ-UHFFFAOYSA-N	431.416	1.480	50	20	IDGD	
CS(=O)(=O)c1ccc(CNC(=O)NNC(=O)Cc2cccnc2)cc1C(F)(F)F	772355737	KAKVDHAZIGHEHC-UHFFFAOYSA-N	430.408	1.577	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)C(=O)Nc2ccc(NC(=O)CN3CCCCCC3)cc2)n1	773478123	HEDFBQZJXZRRQT-UHFFFAOYSA-N	439.520	1.990	50	20	IDGD	
Cc1noc(-c2ccccc2)c1NC(=O)C(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	773494301	QJIYMIGLTZQFFI-UHFFFAOYSA-N	446.423	1.297	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2cc3c(cc2Br)CCC3)CCS(=O)(=O)C1	773642881	AMNIZHVVBJJJLG-MRXNPFEDSA-N	430.324	1.074	50	20	IDGD	
CCN(c1ccccc1)S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ncccn2)cc1	773715913	AHWLLDMZQTTZPN-UHFFFAOYSA-N	440.485	1.774	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)Nc1ccc(C[C@H]2NC(=O)NC2=O)cc1	775706883	JJMRYMPAONUXNI-OAHLLOKOSA-N	441.444	1.068	50	20	IDGD	
CC(C)CS(=O)(=O)N1CCC(NC(=O)NNC(=O)Cc2ccc(Cl)cc2)CC1	777765473	TWILYRQWQVIFGC-UHFFFAOYSA-N	430.958	1.663	50	20	IDGD	
COc1ccc(N2CCN(C(=O)/C=C/C(=O)NNc3nc(-c4ccncc4)no3)CC2)cc1	778255423	VUDWYFIRONEEJI-VOTSOKGWSA-N	449.471	1.488	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1cnc(C(F)(F)F)nc1	778940325	BYMONLGZUUCARH-UHFFFAOYSA-N	431.396	1.273	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)[C@@H](c2c(F)cccc2Cl)N(C)C)n1	780114138	FLEJXNYHGDQROB-QGZVFWFLSA-N	442.900	1.780	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)[C@@H]1CC(c2ccccc2[N+](=O)[O-])=NO1	781559650	PDTCAWGELDEMAQ-SFHVURJKSA-N	428.401	1.713	50	20	IDGD	
COC(=O)CCSCc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(O)cc2)c1	782834446	WKPSWGIEVZZYFX-UHFFFAOYSA-N	431.470	1.588	50	20	IDGD	
CN(C)CC(=O)Nc1ccc(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2Cl)cc1	784382076	RMGFOIUZSXLTND-UHFFFAOYSA-N	434.840	1.830	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CCC[C@H]2CN(CC(=O)NNC(=O)c3ccc(C#N)cc3)C[C@@H]21	784503832	FRQUIWDNWHWIHW-GBESFXJTSA-N	441.532	1.944	50	20	IDGD	
COc1ccc(NC(=O)c2cccc(NC(=O)C(=O)NNc3cccc(OC)n3)c2)cn1	784846073	MAHTZCHGIIPXIU-UHFFFAOYSA-N	436.428	1.828	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)Nc1cccc(CC(F)(F)F)c1	785022233	DTLKRUNYBPBZBN-UHFFFAOYSA-N	426.307	1.805	50	20	IDGD	
COc1ccccc1Oc1ccc(NC(=O)C(=O)NNc2nccn(C)c2=O)cc1F	785085873	GUHIPVALDVIUTE-UHFFFAOYSA-N	427.392	1.802	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)Cc2cccc(N3CCCC3=O)c2)n1	785216321	ZARQVNMYURYRAH-UHFFFAOYSA-N	430.486	1.054	50	20	IDGD	
CC(=O)N1CCCN(c2ccc(F)cc2NC(=O)C(=O)NNc2ccc(C)cn2)CC1	790959167	VUAWAEIENQIJFT-UHFFFAOYSA-N	428.468	1.670	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2ccc(Cc3nnc4n3CCC4)cc2)n1	792292089	FIQRUCSNRLAEIZ-UHFFFAOYSA-N	449.519	1.533	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)C(=O)Nc1cc(-c2ccccc2)ccc1Cl	792355598	UTKKLAPDEXWLEU-CQSZACIVSA-N	435.889	1.528	50	20	IDGD	
CC(C)(C)OC(=O)N1CCc2c(ccc(NC(=O)C(=O)NNc3cnccn3)c2F)C1	793018923	YQXRFMKNGKSVEK-UHFFFAOYSA-N	430.440	1.991	50	20	IDGD	
CC(=NNC(=O)C(=O)NCc1ccc(Cl)cc1)c1cc(S(N)(=O)=O)c(C)cc1C	794526532	RZHMVLLHVIMELG-UHFFFAOYSA-N	436.921	1.761	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2ccc3nccc(C)c3c2)cc1	794768231	XHJHBYWHEANFHD-UHFFFAOYSA-N	426.498	1.933	50	20	IDGD	
CN(CCNC(=O)NNC(=O)Cc1ccc(Cl)cc1)S(=O)(=O)c1ccc(F)cc1	798098020	LCRCMBJGFIOGDX-UHFFFAOYSA-N	442.900	1.673	50	20	IDGD	
CSc1cccc(F)c1C(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1	798826360	JBJWEOFJNFHGRN-UHFFFAOYSA-N	425.507	1.938	50	20	IDGD	
CCn1ncc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)on2)c1C(F)(F)F	799258641	IZTQQXDYDZEHFU-UHFFFAOYSA-N	436.350	1.977	50	20	IDGD	
CCc1cccc(C)c1NNC(=O)C(=O)Nc1ncn(CC(=O)N2CCCCCC2)n1	799844919	UDXHCHHRKDCZNL-UHFFFAOYSA-N	427.509	1.633	50	20	IDGD	
CCC1CCC2(CC1)NC(=O)N(CC(=O)NNC(=O)Nc1ccc3c(c1)OCO3)C2=O	802105585	WWCWTFFMUXEKKS-UHFFFAOYSA-N	431.449	1.459	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)N[C@@H](C)CCNS(=O)(=O)c2ccccc2)cc(C#N)n1C	802323694	LTTOBSTXPZVJDM-GZQZNAIASA-N	425.514	1.985	50	20	IDGD	
CC(C)(C)OC(=O)NNS(=O)(=O)c1ccc(S(C)(=O)=O)cc1Br	802720668	KGCFTHRCTLYPKF-UHFFFAOYSA-N	429.314	1.571	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1cc(F)c(N2CCOCC2)cc1F	806977281	CHHCMOCUXXEVOF-UHFFFAOYSA-N	448.426	1.139	50	20	IDGD	
COCCN1C(=O)CCc2cc(NC(=O)C(=O)NNc3nccnc3C3CCC3)ccc21	807461377	AKVQSCIOKWQLOR-UHFFFAOYSA-N	438.488	1.752	50	20	IDGD	
C[C@H]1CSC[C@@H]1NC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	807475608	IBEJPHFXSXAXCA-KSSFIOAISA-N	448.570	1.861	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NCc2ccncc2OC[C@@H]2CCOC2)cc1	807615796	XLHUWAKQPNADOK-OAHLLOKOSA-N	430.461	1.415	50	20	IDGD	
Cc1ccc2c(c1)C(=O)N(CC(=O)NNC(=O)[C@H]1CCCN(C(=O)OC(C)(C)C)C1)C2=O	808010667	HKHSZKXIBONMAL-AWEZNQCLSA-N	444.488	1.386	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNS(=O)(=O)c1nc(C)n(C)c1Br	808069345	UUNIVRGKGQXJDX-UHFFFAOYSA-N	427.284	1.070	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)c2cc(O)nc3ccc([N+](=O)[O-])cc23)cc1	812729799	VBRQNKLZNRAMNT-UHFFFAOYSA-N	431.430	1.856	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1csc(N2CCOCC2)n1)[C@@H]1OCCc2sccc21	813867741	UHLMVTXIYIRRDA-ABAIWWIYSA-N	437.547	1.688	50	20	IDGD	
CC(C)(C)[C@@H]1CCc2nc(NC(=O)C(=O)NNC(=O)[C@H]3CCc4nncn4C3)sc2C1	815692493	SBGQSGHKSBIQAF-NWDGAFQWSA-N	445.549	1.234	50	20	IDGD	
CCN1CCN(C(=O)c2ccc(NC(=O)C(=O)NNc3cccc(Cl)n3)cc2)CC1	815726174	RRMLDICJDJNPAH-UHFFFAOYSA-N	430.896	1.595	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCO1)C(=O)Nc1ccc(OC(F)(F)F)cc1Br	815778563	XKRDTLBYJZRYPV-SNVBAGLBSA-N	440.172	1.613	50	20	IDGD	
O=C(NNc1nc[nH]n1)c1ccc(NS(=O)(=O)c2ccc3c(c2)OCCCO3)cc1	816631783	FCQKUTBKFTXYHW-UHFFFAOYSA-N	430.446	1.524	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2cccc(OC[C@@H]3CCCO3)c2)n1	844484022	BRTSDSNQAKIZEX-INIZCTEOSA-N	433.486	1.556	50	20	IDGD	
O=C(COC(=O)C1(c2ccc(F)cc2)CCC1)NNC(=O)[C@H]1COc2ccccc2O1	875612893	CTRHQTZKQVVPAL-GOSISDBHSA-N	428.416	1.778	50	20	IDGD	
O=C(NNC(=O)c1ccc2nccnc2c1)c1cccc(S(=O)(=O)N2CCCCC2)c1	912643154	DCNIQFLVJZDCCD-UHFFFAOYSA-N	439.497	1.879	50	20	IDGD	
CCNC(=O)CN1CCN(C(=O)/C(C#N)=C/c2cc(C)n(C[C@@H]3CCCO3)c2C)CC1	913010180	UNABPIHXKQJSPP-OABJIQBASA-N	427.549	1.471	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1)c1ccc(-n2cnnn2)cc1	913155975	MLDBTKPRTTWFHB-UHFFFAOYSA-N	436.432	1.248	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCCCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1C	913416546	KGJXJJFQZMUMKI-IBGZPJMESA-N	447.513	1.349	50	20	IDGD	
Cn1cc(C(=O)NNS(=O)(=O)c2cc(S(C)(=O)=O)ccc2Cl)c2ccccc21	914563275	ZJAVBGKBIKYNDA-UHFFFAOYSA-N	441.918	1.859	50	20	IDGD	
COc1ccnc(NNC(=O)COc2ccc(N(C)S(=O)(=O)c3cccs3)cc2)n1	914762708	CGESUVHEJIKVNN-UHFFFAOYSA-N	449.514	1.894	50	20	IDGD	
Cc1oc(C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)cc1S(=O)(=O)N1CCCC1	915813945	OIBSWCSLZWRHJS-ZDUSSCGKSA-N	439.465	1.740	50	20	IDGD	
Cc1oc(C(=O)NNC(=O)c2ccc3ccccc3n2)cc1S(=O)(=O)N1CCCC1	916091577	URFWGFYMUMGKOT-UHFFFAOYSA-N	428.470	1.996	50	20	IDGD	
CCCCS(=O)(=O)N1CCC(C(=O)NNC(=O)COc2cc(C)ccc2C)CC1	916107851	VQXPAPQKYQTECM-UHFFFAOYSA-N	425.551	1.672	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)Nc2cccc(OCC(N)=O)c2)c2ccccc2c1=O	916254706	KFNXMOQBBYEASA-UHFFFAOYSA-N	438.444	1.308	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(C)nn2C)c1	917521082	QASCPMNKGAJUGO-UHFFFAOYSA-N	443.485	1.613	50	20	IDGD	
CCc1ccccc1OCC(=O)NNS(=O)(=O)c1cc(CNC(C)=O)ccc1OC	917719676	LBOTXZYPBALWMT-UHFFFAOYSA-N	435.502	1.282	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNS(=O)(=O)c2cc(C)ccc2F)cc1	917721462	UXIVVCBCFSVVFL-UHFFFAOYSA-N	429.495	1.073	50	20	IDGD	
Cc1ccc([C@H](C)NC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)cc1	918233611	IYUYZHKDWORYAM-INIZCTEOSA-N	432.550	1.713	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCc2ccc(OC)cc2OC)c2ccccc2c1=O	918234574	FTVBMRNRHFWGBV-UHFFFAOYSA-N	425.445	1.578	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)c3n[nH]c(O)n3)c2)c(C)c1	918281066	CXCOQDDJSVZZQE-UHFFFAOYSA-N	430.446	1.003	50	20	IDGD	
Cc1cccc(OC[C@H](C)NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1	919781333	LACQUPYXMFWHKV-HNNXBMFYSA-N	434.518	1.657	50	20	IDGD	
CC(C)[C@@H](NC(=O)Cc1ccc2ccccc2c1)C(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1	919884813	QKXFUTKNDFCIOV-UYAOXDASSA-N	445.541	1.105	50	20	IDGD	
Cc1csc(SCc2ccccc2C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)n1	919889986	XVWCSGJUQXCJRT-ZDUSSCGKSA-N	440.572	1.875	50	20	IDGD	
O=C(NNC(=O)c1c(-n2cccc2)sc2c1CCSC2)N[C@@H]1CCS(=O)(=O)C1	919890023	YLPGJZRQCGPOER-LLVKDONJSA-N	440.572	1.459	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)NC[C@@H](C)N1CCN(c2ccccc2)CC1	919905465	BTHMHNCXKUFNAD-GOSISDBHSA-N	425.533	1.779	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)N[C@H](C)c2ccc(S(=O)(=O)N(C)C)cc2)cc1	919909004	PWNIXBDCPRKFFJ-OAHLLOKOSA-N	448.545	1.970	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)c1cccc(NC(=O)c2ccc3nc[nH]c3c2)c1	920288680	YHMQZKWDKXZDNM-AWEZNQCLSA-N	441.469	1.011	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)c2ccccc2CSc2nc[nH]n2)c2ccccc2c1=O	920461400	VNBJNLVJGIWUEZ-UHFFFAOYSA-N	435.469	1.419	50	20	IDGD	
CC(=O)N1CCc2cc(Br)c(S(=O)(=O)NNC(=O)NCC3CC3)cc21	920833948	ISQQJZZWGAACOS-UHFFFAOYSA-N	431.312	1.261	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)NCCc2cnn(C)c2)cc1	920851421	LHILPVUCARTSJX-WQRHYEAKSA-N	447.499	1.433	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CNS(=O)(=O)c2ccc(OC(F)(F)F)cc2)cc1	1117671084	WNFGTIZNRAVWNR-UHFFFAOYSA-N	447.391	1.333	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)COc2ccc3c(c2)CCC(=O)N3)CC1	1251911799	YIQVBTCOWJEIBH-UHFFFAOYSA-N	446.504	1.745	50	20	IDGD	
CN(C)C(=O)c1ccc(CNC(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1	1251919707	RKHKPUHTBMJJKJ-UHFFFAOYSA-N	447.536	1.866	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)CNS(=O)(=O)c2ccccc2)cc1OC	1317705736	OUHDZOTUZGQHCO-UHFFFAOYSA-N	435.502	1.614	50	20	IDGD	
O=C(NCCNS(=O)(=O)c1ccc(Cl)s1)NNC(=O)c1ccccc1Cl	1324364781	IGLQOOJZFHHAAZ-UHFFFAOYSA-N	437.330	1.977	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)c3nnn(-c4ccc(F)cc4)c3C(F)(F)F)nc21	1340732207	LSJBRAGNIDZMIZ-UHFFFAOYSA-N	437.317	1.564	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(CCN(C(=O)c3cccc4c3OCCO4)C2)C1	1777834128	ARQJMRPBNPDJGK-IBGZPJMESA-N	439.306	1.686	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccncn2)C1	1778157357	BZTBHQNDQHSLBK-DDUZABMNSA-N	425.327	1.778	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)c3cccc4ncsc34)C2)C1	1778650197	APMUPSMLOZSGDO-OAQYLSRUSA-N	445.545	1.113	50	20	IDGD	
Cc1nc[nH]c1CSCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Cl)C2	1779287899	UCMJUARLMVSNDA-UWWQBHOKSA-N	432.949	2.000	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2)c1cc(Cl)c(O)cc1O	1780843312	JUHJSEHXZQVNQJ-FRQCXROJSA-N	447.315	1.478	50	20	IDGD	
CCCc1ccc(C(=O)N2CC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)cc1	1780848327	XIDYYDZKTJWHGF-HSZRJFAPSA-N	430.549	1.456	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3nc4ccccc4n(C)c3=O)CCO2)C1	1781219394	OWIHQEDWFQQYSE-SPLOXXLWSA-N	432.908	1.394	50	20	IDGD	
O=C(CS[C@@H]1CCCCO1)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781331480	LJHQRYTUPZXQAX-IJEWVQPXSA-N	439.347	1.767	50	20	IDGD	
Cc1ccn2c(C(=O)N3CCO[C@@]4(CCN(C(=O)[C@@H](F)Br)C4)C3)cnc2c1	1781331948	BNZVUCHWDBIPLV-CRAIPNDOSA-N	439.285	1.777	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(C)c(C(=O)O)c(C)c3)C2)C1	1782174861	XRTBRDYSWUQZOC-HRAATJIYSA-N	438.908	1.699	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H]1CCc3nc[nH]c3C1)C2)C(Cl)Cl	1782220107	XJYPPDWODAYOOA-KPAZRMRSSA-N	429.348	1.832	50	20	IDGD	
C[C@H](C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCBr)C2)n1cccn1	1782556252	PRZBSJACWLZFHL-IIDMSEBBSA-N	427.343	1.743	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4nn[nH]c4c3)C2)C1	1782581498	PWVUYQQLMYPOTN-SGTLLEGYSA-N	436.310	1.432	50	20	IDGD	
CCC[C@@H](NC(C)=O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]2C1	1783975404	OCTZEDQTCCLDEO-DWBZUHSKSA-N	446.386	1.302	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3occc3Br)C[C@@H]21)[C@H](O)CCl	1784091122	VWJYMMRDCXAGNV-DJIHRAIXSA-N	435.702	1.235	50	20	IDGD	
Cc1nn2cc(CC(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)C(Cl)Cl)C[C@@H]43)nc2s1	1784853171	ZSZDYQFHUBRMJL-DRZSPHRISA-N	446.360	1.425	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nccc4[nH]ccc34)C[C@@H]21	1786406058	PDOOBAGHLCMBIB-NOLJZWGESA-N	435.322	1.941	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CSc3ncccn3)[C@H]2C1	1787072956	YLXXEQGZPIOEKS-VGWMRTNUSA-N	426.970	1.956	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(Cl)c4nncn4c3)C[C@@H]21)[C@@H](F)Cl	1787446304	CBFMTEFZAIQWTL-DTCNJJKHSA-N	430.267	1.510	50	20	IDGD	
C#CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]2C1	1787451278	FLQDALDSHWPUEE-UVPYHEFZSA-N	445.919	1.417	50	20	IDGD	
O=C(/C=N/N1CCCCC1)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21	1788601549	AYLJSDUSKHHRKH-UZPFABOCSA-N	429.359	1.223	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]2C1	1788764733	ZKZDLHUUTOFOOL-AJNGGQMLSA-N	435.435	1.991	50	20	IDGD	
CC(C)c1nc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]3C2)no1	1788765172	IVYYQKZXRURXOJ-JYJNAYRXSA-N	438.601	1.567	50	20	IDGD	
CC(C)(C)OC(=O)C(C)(C)CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21	1789685070	SPLYWKRZVAVNGG-JONQDZQNSA-N	446.972	1.324	50	20	IDGD	
CN(C)c1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21	1790267802	HXZRNSCMPVHHKJ-GQGQLFGLSA-N	442.875	1.789	50	20	IDGD	
CCOC(=O)O[C@@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)Br)[C@H]2C1	1791063976	ZJLZWJBLBSTIIZ-PEDHHIEDSA-N	435.315	1.311	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCOc3ccc(C)cc3)C[C@@H]21	1791251209	ZHPAAMBWTRDYNT-LEAZDLGRSA-N	438.952	1.997	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc(F)c(F)c3)C[C@@H]21	1791251448	HRJJOWSOZRSRSG-AFIMGQEJSA-N	430.879	1.741	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3Cc4ccccc4CN3C)C[C@@H]21	1791252630	QGAMEARATBELKB-WHZJULEDSA-N	449.979	1.277	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3c[nH]c(C(C)(C)C)c3)C[C@@H]21	1791288568	FWMCAGOBFGKCGO-SZMVWBNQSA-N	447.580	1.279	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3CCC(O)CC3)[C@H]2C1	1791410295	PZSWYQXHNKGDHX-SGQZPCGUSA-N	431.371	1.691	50	20	IDGD	
O=C(Cc1cccc([N+](=O)[O-])c1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2	1792421256	ZURDREBDQWAWMQ-NOXHYTERSA-N	444.257	1.417	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)c1ccccc1)C2	1792867731	KERLBMAFPDCIIT-USACIQFYSA-N	425.323	1.341	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3nccnc3c1)C2	1792867768	HBLPQCGDJSTBQZ-FRQROOTJSA-N	447.333	1.864	50	20	IDGD	
CC(=O)O[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)CBr)C(C)C	1792870294	BFECNWZPQUDHAG-YMILTQATSA-N	433.343	1.195	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C[C@@H]1OCCc2ccccc21	1793274993	VBGKHOMWIRGNPE-KHWKGDQTSA-N	436.936	1.534	50	20	IDGD	
O=C(CSc1ccncc1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2	1793950311	CRBMUPDIRHWMCQ-JLUCKKNBSA-N	432.315	1.454	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1(c3ccc(O)cc3)CC1)C2	1796187756	CFRCBESQPGLGPU-ACDBMABISA-N	434.301	1.056	50	20	IDGD	
COc1cccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)c1F	1796190639	UGCWJPOTGDSWIR-BJWYYQGGSA-N	426.253	1.080	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc2c1cnn2C	1797090187	YFSBICREYYRZRY-VLWCASSMSA-N	449.349	1.950	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2cccnc2[nH]1	1798118560	ITKVJZHDWCSJBU-QDMKHBRRSA-N	433.472	1.127	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccn(C(F)F)n1	1798163912	TVRAXJOLSJOZNQ-FXZYXXQUSA-N	425.263	1.718	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cc1cnc[nH]1)C2	1799219675	FSWWOZXLDHOSLQ-RBVVOMGSSA-N	441.444	1.738	50	20	IDGD	
CC[C@@H](O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](Br)Cc1ccccc1	1800433388	IVUPHIMRJJZLGZ-RZFLPCETSA-N	439.350	1.353	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Oc1cccnc1)C2	1800762889	JITNZMGHSKIRTE-AQDIXCGQSA-N	426.311	1.222	50	20	IDGD	
CCOC(=O)C(C)(C)C(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1	1803148924	QZPDUTUBJBIOIF-PMPSAXMXSA-N	425.913	1.276	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)[C@H]2CCC(=O)N2)[C@H]1c1cccnc1	1806823325	BLOMHALAVBYELF-LJIGWXMPSA-N	437.338	1.540	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)CC2CCOCC2)[C@H]1c1cccnc1	1806935686	HLRXJDRZULTJKQ-AUSIDOKSSA-N	445.564	1.277	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H](CNC(=O)CCN2CCOCC2)[C@H]1c1cccnc1	1806951889	ISRJOEOCCAJQBK-DENIHFKCSA-N	448.640	1.661	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)C(C)(C)NCCC#N)[C@H]1c1cccnc1	1807149134	CZNZBZKMQGRBFD-OKZBNKHCSA-N	435.956	1.623	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2nccnc2C(N)=O)[C@H]1c1cccnc1	1808263766	POUFPSWDWGGQLX-KEYYUXOJSA-N	430.896	1.308	50	20	IDGD	
O=C(/C=C/c1cccs1)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1	1809966558	DIBXSPQJSWVPPT-CMDGGOBGSA-N	438.358	1.986	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)[C@H]3CCC(F)(F)C3)CC2)C1	1809968426	XMGLQOGFQHDDSK-KRWDZBQOSA-N	434.292	1.647	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)CO[Si](C)(C)C)[C@H]1c1cccnc1	1810526840	HGMTVCDXUXOJDR-SYNHAJSKSA-N	432.597	1.630	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2n[nH]cc2[N+](=O)[O-])[C@@H]1c1cccnc1	1813032212	VQHHOEWDYGUKLS-HEHGZKQESA-N	436.856	1.286	50	20	IDGD	
Cc1ccc(CC(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)o1	1813509453	KOXTVCZACMMGRU-AUSIDOKSSA-N	447.300	1.225	50	20	IDGD	
Cc1cccc(C)c1C(=O)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1	1815360520	RXSVZZSHCAJZCI-QGZVFWFLSA-N	449.341	1.979	50	20	IDGD	
O=C(C[C@H]1CCCCO1)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1815603286	NUUSJEPCLQHECC-IEBWSBKVSA-N	440.309	1.355	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)C(=O)c2ccccc2)[nH]n1)c1cccc(B(O)O)c1	1817473105	GBNQFVDOLUUPBV-LJQANCHMSA-N	446.272	1.278	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CN2CCOCC2)[nH]n1	1820864224	SQQLCWOCWIUZKL-RDTXWAMCSA-N	432.352	1.970	50	20	IDGD	
CCc1cc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)CCC(=O)NN(C)C)CC3)nn1C	1820971759	IGQQSTHBUUYVAP-LBPRGKRZSA-N	447.565	1.038	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1	1822353221	KWDJSEUWLDURKW-XNISGKROSA-N	438.912	1.757	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC([C@@H]2CCCCN2C(=O)C2CC(O)C2)CC1	1824113383	MCSRQNIXSNGLCJ-LRIMBYPUSA-N	443.548	1.511	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](Cl)COC)CC2	1824613349	VZDKUWYPYSWVMS-GMTAPVOTSA-N	433.914	1.871	50	20	IDGD	
CCc1ccnc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)c1	1827052730	BWZBOSDGDRAYFL-QHCPKHFHSA-N	449.360	1.871	50	20	IDGD	
O=C1COc2ccc(C(=O)N3CCCC[C@@H]3C3CCN(C(=O)[C@H](O)CCl)CC3)cc2N1	1828624270	BEPGGPZNPRSNQJ-QZTJIDSGSA-N	449.935	1.851	50	20	IDGD	
C=CCC(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)[C@H](O)CCl)C2)C1	1829350040	YISXMNLAAHDPRG-XMSQKQJNSA-N	449.935	1.614	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(F)c[nH]3)C2)C1	1830544385	XBVVZNGFQUANCP-PXAZEXFGSA-N	432.290	1.255	50	20	IDGD	
O=C(CSC1CCCC1)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1831363593	IXVVUCZHUQQDBL-QGZVFWFLSA-N	425.378	1.922	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3nc4ccccn4n3)C2)C1	1831647846	ZJKOKCFPUVPQAL-FOIQADDNSA-N	435.912	1.207	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)C2=COCC2)CC1	1832413475	OJQLBMKRMSEIFW-IBGZPJMESA-N	427.505	1.223	50	20	IDGD	
COC1(CC(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CCC1	1832496101	HZQLKLRUWYLCOO-NRFANRHFSA-N	442.365	1.559	50	20	IDGD	
COC(OC)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](C)CBr)CC2)CC1	1833265317	UAMUTKAFBQOOMU-ZDUSSCGKSA-N	434.375	1.208	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@]3(F)CCCC=C3F)CC2)CC1)[C@H](O)CCl	1833313620	NCUGNEDMVRKSDZ-OXQOHEQNSA-N	433.927	1.903	50	20	IDGD	
COCC1(C(=O)NC2CCN(C3CCN(C(=O)[C@H](C)Br)CC3)CC2)CC1	1833463152	LOFKCLDBVQCIQF-AWEZNQCLSA-N	430.387	1.768	50	20	IDGD	
Cc1[nH]nc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@](C)(Cl)CCl)C3)C2)c1F	1833675423	SWSYSYBZQYHLTF-IAGOWNOFSA-N	437.299	1.164	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)c3ccon3)CC2)CC1	1834298144	IABSQLRAWPFGPG-ZDUSSCGKSA-N	427.343	1.891	50	20	IDGD	
Cc1ccc(F)c(C(=O)N2CCOC[C@@]3(CN(C(=O)CCBr)CCO3)C2)c1	1834823684	CJZZRTPZVVWTJF-LJQANCHMSA-N	443.313	1.989	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)Cn3ccnn3)CC2)CC1	1834898079	GGPWNUSFCBFOKI-INIZCTEOSA-N	441.374	1.023	50	20	IDGD	
O=Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)s1	1835946087	FAKQDVDEUXHLJM-XJKSGUPXSA-N	449.298	1.321	50	20	IDGD	
CC(=O)NCC(=O)N1CCC(OC2CCN(C(=O)[C@@H](C)CBr)CC2)CC1	1836673108	BAGSNDHKOTXAOI-ZDUSSCGKSA-N	432.359	1.152	50	20	IDGD	
O=C(c1noc2c1CCCC2)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836717415	APNNUNJNOJRFIY-KRWDZBQOSA-N	439.940	1.765	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccncc3O)CCO2)C1	1837820835	DHOLYJJTPCNYFW-KBXCAEBGSA-N	442.310	1.031	50	20	IDGD	
COc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)ccn1	1837979309	JJBSTRUYWVQZKL-RBUKOAKNSA-N	446.331	1.397	50	20	IDGD	
O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)c1c(F)cccc1F)CCO2	1838861839	HTTWVNWHSRPWPW-GOSISDBHSA-N	447.276	1.820	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3c(C)n[nH]c3C)CCO2)C1	1839238313	GMPFMQIBGOGBKL-FXAWDEMLSA-N	426.945	1.433	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1onc3ccccc13)CCO2	1839546334	QMSMUOYQJAZLME-OAQYLSRUSA-N	447.564	1.749	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CC3CCOCC3)C2)C1	1839963560	OHFCKWRIPJBNGC-LPHOPBHVSA-N	447.370	1.433	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3C[C@H]4CC[C@@H]3O4)C2)C1	1839966710	NVMYMEQBFNCHPP-GMKVZWAMSA-N	445.354	1.184	50	20	IDGD	
Cc1cncc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)c1	1840031548	UARVJTCGVLLYEY-RDTXWAMCSA-N	426.311	1.243	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccccc3F)C2)C1	1840034499	NUONUKNSAIFJBH-ACJLOTCBSA-N	429.286	1.679	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3ccnc(C)c3)C2)C1	1840149899	AQLXEFYUFKUUFG-GHTZIAJQSA-N	439.940	1.033	50	20	IDGD	
COc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)c(F)c1	1840189154	ADSBDVMCIMPXDE-SFHVURJKSA-N	435.279	1.708	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)cc1Cl	1840732039	GVWSUTRWWYBNLF-MAUKXSAKSA-N	435.279	1.953	50	20	IDGD	
Cc1cc(C(=O)N2CCCC23CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C3)n(C)n1	1842440256	LKDBQGJVZZMHAZ-AWEZNQCLSA-N	439.944	1.678	50	20	IDGD	
CN(CC(=O)N1CC2(CCCN2C(=O)c2nccs2)C1)NC(=O)NCc1ccccc1	1842524881	SQJTXZZTZUGZGV-UHFFFAOYSA-N	442.545	1.306	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)Cc1noc(C(C)C)n1)C2	1843415468	RKFSENGLQQFFCC-ZVHZXABRSA-N	441.492	1.073	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC2(CCCN2C(=O)c2nc3ccccc3n(C)c2=O)C1	1843744589	AYRRWCGGPFMWMG-GFCCVEGCSA-N	433.306	1.534	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1c(F)cccc1Cl)C2	1844264779	HGLPNTOJKPFXEU-UHFFFAOYSA-N	431.855	1.608	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC2(CCCN2C(=O)c2ccc(CO)o2)C1	1844467595	SMAQJNHMDMVHLA-AWEZNQCLSA-N	441.912	1.721	50	20	IDGD	
Cc1ocnc1C(=O)N1CCCC12CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1844553893	XPERROVBMCNBAW-ZDUSSCGKSA-N	426.901	1.932	50	20	IDGD	
CN1C(=O)CC[C@H]1C(=O)N1CC2(CCCN2C(=O)[C@@H](Br)Cc2ccccc2)C1	1845941932	AKGRXFHOFRPMDE-IRXDYDNUSA-N	448.361	1.817	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H]1CC(=O)N(C2CCCC2)C1	1848045876	ZISSQANEECTVCQ-VRKREXBASA-N	426.355	1.763	50	20	IDGD	
Cc1cc(C)c(NC(=O)CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)c(C)c1	9790446	LPGZNRQDYIRYGK-UHFFFAOYSA-N	446.533	1.488	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)c1ccc(Cn2cncn2)cc1	11611018	OPVFKFCZBINVSH-UHFFFAOYSA-N	433.516	1.300	50	20	IDGD	
COc1cc(C(=O)N/N=C2/C(=O)Nc3cc4c(cc32)OCCCO4)cc(OC)c1OC	17413871	PAJRJUDWLRIYSK-UHFFFAOYSA-N	427.413	1.960	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)c2ccc3c(c2)OCC(=O)N3)c2ccccc2c1=O	25174032	QQIVTEMOMLFBHU-UHFFFAOYSA-N	449.467	1.992	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(Cl)cc2)cc1OC	28776538	FMENBIBRTYNLDM-UHFFFAOYSA-N	441.893	1.439	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2c[nH]c3ccccc3c2=O)c1	105954674	OVQWMRXJBHYOMN-UHFFFAOYSA-N	442.497	1.633	50	20	IDGD	
CN1CCN(C[C@@H](NC(=O)NNC(=O)c2cc(Br)c[nH]2)c2ccccc2)CC1	727841089	PAQOPNRRMYZCNK-QGZVFWFLSA-N	449.353	1.710	50	20	IDGD	
C[C@H](Oc1ccc2c(c1)CCC2)C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	728326004	ATRQOUBBYBHJPE-VBKZILBWSA-N	440.452	1.473	50	20	IDGD	
COC(=O)CSCCNC(=O)NNC(=O)[C@@H](C)Oc1cccc(Br)c1	729856418	OMYPCJQFUWNVTK-SNVBAGLBSA-N	434.312	1.453	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ncccc2Cl)c1C(F)(F)Cl)C(=O)N1CCCC1	731004469	BIPCMZSSLVUXOU-UHFFFAOYSA-N	447.229	1.592	50	20	IDGD	
NC(=O)[C@@H]1CCCN(Cc2cccc(CNC(=O)NNc3ccc(-n4cccn4)nn3)c2)C1	731119199	ZETZGYDLVQTWQX-GOSISDBHSA-N	449.519	1.186	50	20	IDGD	
Cc1noc(C)c1S(=O)(=O)N1CCN(C(=O)NNC(=O)C(C)(C)c2ccccc2)CC1	731221228	HDBMYZNQQYNGDX-UHFFFAOYSA-N	449.533	1.316	50	20	IDGD	
CS(=O)(=O)c1ccc(OCCC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1	733110307	HKVGFURKAVUUBU-UHFFFAOYSA-N	428.470	1.506	50	20	IDGD	
COc1ccc(C(=O)NNc2cc(F)c(F)cc2F)cc1S(=O)(=O)N1CCOCC1	734552052	JQXBGZJGBGXVOI-UHFFFAOYSA-N	445.419	1.890	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2cc(C(=O)NNc3cccnn3)ccc2Cl)C[C@H](C)O1	736701761	DEPVJRJNKYATRX-RYUDHWBXSA-N	425.898	1.685	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)[C@H]2CCCN(C(=O)COc3ccccc3)C2)cc1	741206956	HFTVAWYBETWJAV-SFHVURJKSA-N	425.485	1.839	50	20	IDGD	
CC(=NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)c1ccc(S(=O)(=O)N(C)C)cc1	741772535	ZBTIJNOPMUSONZ-UHFFFAOYSA-N	438.531	1.886	50	20	IDGD	
COc1cc(C(=O)NNc2nc(-c3cccnc3)no2)cc(NS(C)(=O)=O)c1OC	742658493	VAPAZEGMBMYBLM-UHFFFAOYSA-N	434.434	1.277	50	20	IDGD	
C[C@H](CN1CCN(c2ccccc2)CC1)NC(=O)NNC(=O)COc1ccccc1F	743509366	CGGNSHOCOWQFMG-QGZVFWFLSA-N	429.496	1.746	50	20	IDGD	
O=C(CN1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O)Oc1ccc([N+](=O)[O-])cc1Br	744168127	IZLTUABMXVCFPK-OXHZDVMGSA-N	425.191	1.425	50	20	IDGD	
CC(=NNC(=O)C(=O)NC1CC1)c1ccc(S(=O)(=O)Nc2ccc(C(=O)O)cc2)cc1	744827988	SJSKJOMTWPZMSE-UHFFFAOYSA-N	444.469	1.304	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)c1cccc(CN2CCN(C)CC2)c1	746095863	FXFNSSCTRWBNFD-UHFFFAOYSA-N	434.544	1.807	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](CC(=O)NNC(=O)CNC(=O)c1cccnc1)c1ccccc1	746302157	YUNCETIIULRCKU-QGZVFWFLSA-N	441.488	1.615	50	20	IDGD	
Cc1nc(S(=O)(=O)NCCC(=O)NNc2ccc(C#N)c(C(F)(F)F)c2)cn1C	746890552	ZQJBBUUFPRVFEF-UHFFFAOYSA-N	430.412	1.431	50	20	IDGD	
O=C(CCCC[C@@H]1SC[C@H]2NC(=O)N[C@H]21)NNc1ccc(S(=O)(=O)C(F)F)cc1	748611285	IKFGQFSIJMIQKV-VNHYZAJKSA-N	448.517	1.852	50	20	IDGD	
Cc1cc(C(=O)NNc2ccc(OCC(F)(F)F)cc2)nc2c1c(=O)n(C)c(=O)n2C	748704308	HSPZHXNODXXVKT-UHFFFAOYSA-N	437.378	1.639	50	20	IDGD	
O=C(COc1ccc(OCc2ccccc2)cc1)NNC(=O)[C@@H]1CC(=O)N(c2cn[nH]c2)C1	748837284	BYZLLAIPKCLGKL-QGZVFWFLSA-N	449.467	1.568	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)c2ccc3ncc(I)n3c2)cc1	749363615	IRQHOSXPUJJQAQ-UHFFFAOYSA-N	431.193	1.885	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)N2CCN(c3cnn(C)c3)C(=O)C2)c(C)n1C[C@H]1CCCO1	750072694	RPGPCWACFJWQIN-IDQDRXHYSA-N	436.516	1.800	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CNC(=O)c2ccco2)c1I	751201851	MEAGKAGQMUOPKI-UHFFFAOYSA-N	427.198	1.384	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2cc(Cl)c(Cl)cc2Cl)cc1O)C(=O)NC1CC1	752789167	KQQANOCZGOJBJJ-UHFFFAOYSA-N	432.651	1.578	50	20	IDGD	
C[C@H]1Cc2cc(S(N)(=O)=O)ccc2N1C(=O)COC(=O)/C(C#N)=C\c1ccc(O)cc1	754538098	CFSLISBMJITONO-LWLPBDFMSA-N	441.465	1.468	50	20	IDGD	
CC(=NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1)c1ccc2c(c1)CCC(=O)N2C	754710786	GLWWXKWNBZWMLS-UHFFFAOYSA-N	447.539	1.894	50	20	IDGD	
O=C(NNC(=O)c1cnccn1)Nc1ccc(Cl)c(S(=O)(=O)N2CCCCC2)c1	755435151	PNYOJJFIKWXTAA-UHFFFAOYSA-N	438.897	1.771	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)Nc2ccccc2C(=O)N2CCN(C)CC2)c1	755623253	PXMJRZMSHKFLLR-UHFFFAOYSA-N	439.516	1.923	50	20	IDGD	
CC(C)C[C@H](C)OCCC(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	755809279	JSAUWQLDOVLPIU-INIZCTEOSA-N	427.571	1.302	50	20	IDGD	
CNC(=O)c1ccc(OC)c(NC(=O)NNC(=O)[C@H](C)Oc2ccc(C(C)=O)cc2)c1	755918678	HWWKOKXWZMGAKU-ZDUSSCGKSA-N	428.445	1.878	50	20	IDGD	
CC[C@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)[C@H]1CCCO1	756736226	DFCIXMJUHROHAG-ZWKOTPCHSA-N	438.550	1.763	50	20	IDGD	
CCOC(=O)[C@H](C)NC(=O)c1ccc(NC(=O)NNC(=O)c2ccccc2OC)cc1	756789987	KLHFHZZJLHNMGW-ZDUSSCGKSA-N	428.445	1.843	50	20	IDGD	
NC(=O)c1ccc(NNC(=O)CCCS(=O)(=O)c2ccc(Br)cc2)nn1	757405430	MSRRQSBNURGNAN-UHFFFAOYSA-N	442.295	1.035	50	20	IDGD	
C[C@H](NC(=O)OC(C)(C)C)[C@H]1CCCN(CC(=O)NNC(=O)c2ccc(C#N)cc2)C1	758797564	IJAHZOIJYBKXSQ-YJBOKZPZSA-N	429.521	1.944	50	20	IDGD	
COc1cc2c(cc1C=NNC(=O)c1ccc(S(=O)(=O)N3CCCC3)cc1)OCO2	758886014	NHPBGBXFVIPWPF-UHFFFAOYSA-N	431.470	1.972	50	20	IDGD	
COCCn1c(N)c(N(CCI)Cc2ccccc2)c(O)nc1=O	759396118	GIWVVNPBOCHKEP-UHFFFAOYSA-N	444.273	1.619	50	20	IDGD	
O=C(NCc1nnc(-c2ccccc2)s1)NNC(=O)c1csc(N2CCOCC2)n1	760193095	SCVXWTDNLHYHOL-UHFFFAOYSA-N	445.530	1.642	50	20	IDGD	
Cn1c(C=NNC(=O)CSc2nnc(O)nc2O)nc2cc(C(F)(F)F)ccc21	760239038	GLMDYFNMIYBAIQ-UHFFFAOYSA-N	427.368	1.431	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)[C@H]1CC(=O)N(Cc2ccccc2Cl)C1	760439825	RYLXSAXAWXVLBV-AWEZNQCLSA-N	438.912	1.751	50	20	IDGD	
COc1cc(C)nc(NNC(=O)c2cc(S(=O)(=O)NCCCN(C)C)ccc2C)n1	762233230	SITIATVQKMLBJL-UHFFFAOYSA-N	436.538	1.089	50	20	IDGD	
CCC[C@H](C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)C(C)C	763285867	ZYLXKXMVHBTBCP-IBGZPJMESA-N	439.578	1.860	50	20	IDGD	
COc1ccc2c(c1)[C@@H](C(=O)OCC(=O)NNC(=O)[C@H]1COc3ccccc3O1)CC2	763450852	KUCQOCFWGNBRRL-HNAYVOBHSA-N	426.425	1.256	50	20	IDGD	
CN1CCCN(c2ccc(NC(=O)C(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)cc2)CC1	763471221	SYANJMVSGQGVHM-UHFFFAOYSA-N	440.460	1.136	50	20	IDGD	
O=C(NNC(=O)c1cc2ccccc2cc1O)C(=O)Nc1ccc(N2CCOC2=O)cc1	763518229	RPYVJCAOFLYHCE-UHFFFAOYSA-N	434.408	1.902	50	20	IDGD	
CN(C)C(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cc3ccccc3cc2O)ccc1F	763518391	VAHOHSCMFKGRGA-UHFFFAOYSA-N	438.415	1.786	50	20	IDGD	
CCOC(=O)c1cc(F)c(F)cc1NC(=O)C(=O)NNC(=O)COc1cc(C)ccc1C	763668476	MUAAILKVUDENKM-UHFFFAOYSA-N	449.410	1.923	50	20	IDGD	
CC(C)(C)OC(=O)Cc1ccccc1NC(=O)C(=O)NNC(=O)COc1ccccc1F	763683355	ZPQFRAJNYXVAJS-UHFFFAOYSA-N	445.447	1.875	50	20	IDGD	
CCNC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)c1	763695114	OXBSCIDOPNMGFH-UHFFFAOYSA-N	433.852	1.646	50	20	IDGD	
COC(=O)c1cc(C(C)C)ccc1NC(=O)C(=O)NNC(=O)COc1ccc(F)cc1	763839264	IDZQSACFVZFDLJ-UHFFFAOYSA-N	431.420	1.901	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)n(-c2ccccc2F)n1	763840298	QGKWTPCEQNQNQZ-UHFFFAOYSA-N	429.383	1.624	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)C(=O)Nc1ccn(CC(F)F)n1	763851021	SWNBWCYGJXRHHL-GFCCVEGCSA-N	431.399	1.855	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)N2C[C@H]3CCCN3c3ccccc32)cc1OC	763903708	SKHFFHKQZFSONU-MRXNPFEDSA-N	438.484	1.871	50	20	IDGD	
CC(C)NC(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)Cc2ccc(F)cc2)c1	763933412	XMLFXHQEUMNLTL-UHFFFAOYSA-N	434.855	1.946	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)C(=O)Nc1cnc(Br)c(Br)c1	763999056	MTAVHKKPCSLOHJ-UHFFFAOYSA-N	445.071	1.345	50	20	IDGD	
COc1ccc(Cn2ncc(C)c2NC(=O)C(=O)NNC(=O)CC(F)(F)F)cc1OC	764114936	HZDPIJJHAYTBDW-UHFFFAOYSA-N	443.382	1.295	50	20	IDGD	
COc1cc(Br)cc(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)c1	764167593	LCPPEWULENKYSH-HNNXBMFYSA-N	434.246	1.547	50	20	IDGD	
CC(C)(C)OC(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)c1	764168546	QRXAIABCOCEKEI-GOSISDBHSA-N	439.468	1.660	50	20	IDGD	
CC(C)CCC(=O)NNC(=O)C(=O)N1C[C@H](C(=O)N2CCCCC2)Oc2ccccc21	764198846	IDRXQKLPANASBM-GOSISDBHSA-N	430.505	1.377	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)C(=O)Nc1ccc(C(=O)c2nccn2C)cc1)c1ccccc1	764330130	RIHCIWUUJCQMRB-GOSISDBHSA-N	433.468	1.931	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)C(=O)Nc1cccc(N2CCCC2=O)c1	764350762	LASIRKYZJUVMRC-UHFFFAOYSA-N	432.440	1.399	50	20	IDGD	
C=CCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)cc1	764402119	XZPFJTZNWHKOSX-UHFFFAOYSA-N	428.470	1.186	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=S)NCCc1cccs1	764519615	SHPYPNQDFNDSFM-UHFFFAOYSA-N	431.587	1.244	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNc2ccc(C)nn2)cc(Br)c1F	764673857	USQIPKHPJRXGQK-UHFFFAOYSA-N	426.202	1.555	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)CCN2C(=O)[C@H]3CCCC[C@H]3C2=O)n[nH]1	765596205	SMFWDPXKZKKEGT-OKILXGFUSA-N	439.472	1.412	50	20	IDGD	
Cc1oc(S(=O)(=O)N(C)C)cc1C(=O)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	765617302	FYZBAIDAVHXZFB-UHFFFAOYSA-N	435.437	1.442	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1ccccc1C(=O)N1C[C@@H](C)C[C@@H](C)C1	766264467	LBVOBOZBRVPSEM-OKILXGFUSA-N	426.477	1.685	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)CN1CCC(NC(=O)c2ccc(F)cc2)CC1	766848853	MIKTVYKEHDMSRA-UHFFFAOYSA-N	426.492	1.718	50	20	IDGD	
N#C/C(=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)O[C@@H]1CCCNC1=O	767234387	BVHLNFVXSZEUGZ-OOXMNIKJSA-N	441.875	1.808	50	20	IDGD	
CC(C)(C)OC(=O)N1CCc2ccccc2[C@@H]1C(=O)NNC(=O)CNC(=O)c1ccco1	769163522	BGQAOKQLFRDKKA-GOSISDBHSA-N	442.472	1.691	50	20	IDGD	
CCc1[nH]c(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)c(C)c1C(=O)OC	769253970	VEVCTTIQTQSYQU-UHFFFAOYSA-N	442.881	1.048	50	20	IDGD	
CC(=O)N1CCc2c(NC(=O)C(=O)NNC(=O)c3cc(Br)cn3C)cccc21	769264167	BVFNIZOIYSIDCN-UHFFFAOYSA-N	448.277	1.096	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)NCc1cccnc1N1CCOCC1	770145592	LMTDHCNILLSHGC-CQSZACIVSA-N	433.896	1.870	50	20	IDGD	
CC(C)(C)[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)c1ccc(Br)cc1Cl	770541557	FNOBENAUMFFLHW-NSHDSACASA-N	440.747	1.827	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCOC[C@H]2CC(=O)c2ccccc2)cc1OC	770664943	NJQISKJCHITBBD-GOSISDBHSA-N	441.484	1.439	50	20	IDGD	
CC(=O)NC[C@H]1CCn2ncc(C(=O)NNC(=O)[C@H](C)Oc3cccc(Cl)c3)c2C1	772994308	KCMBWYAPLGUVPU-JSGCOSHPSA-N	433.896	1.464	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)CCCCCNC(=O)NC2CCCCC2)c1	773082714	ZZYDWKATHSAYRU-UHFFFAOYSA-N	432.525	1.993	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)ncc1Br	773527815	NSWIPUIGDIOXJA-UHFFFAOYSA-N	425.214	1.457	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)C(=O)Nc1ccc(Br)cn1	773550399	PEIAKGRYXVMQLO-UHFFFAOYSA-N	429.234	1.430	50	20	IDGD	
O=C(NNc1ncc(Cl)cc1Cl)C(=O)Nc1cccc(C(=O)N2CCOCC2)c1	773680530	SKPICIJRAGDRGX-UHFFFAOYSA-N	438.271	1.943	50	20	IDGD	
CCOC(=O)[C@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNc2cccc(C#N)c2)cc1F	773688554	LIFWOLNBJHHLHJ-LBPRGKRZSA-N	441.419	1.461	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)C(=O)Nc3cn(C)nc3C(F)(F)F)n[nH]2)c1	773701957	XXNOZCGVTQJZPS-UHFFFAOYSA-N	449.393	1.846	50	20	IDGD	
O=C(NNc1ncccn1)C(=O)Nc1ccc(NC(=O)[C@@H]2CCCO2)cc1C(F)(F)F	773723504	AXIWLGXEMHMIDV-ZDUSSCGKSA-N	438.366	1.695	50	20	IDGD	
C[C@H](NCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)c1ccc(N2CCOC2=O)cc1	775262730	RMSRLIJUXCAPBX-ZDUSSCGKSA-N	427.417	1.663	50	20	IDGD	
Cn1cc(S(=O)(=O)NNC(=O)C(C)(C)c2ccccc2)cc1C(=O)NCC(F)(F)F	775672356	QVHSSCGMDPBLPX-UHFFFAOYSA-N	446.451	1.605	50	20	IDGD	
O=C(CCSc1ccc(F)cc1)NNC(=O)Nc1ccnn1[C@H]1CCS(=O)(=O)C1	776054396	FVJDUPNGVTWUHW-ZDUSSCGKSA-N	441.510	1.717	50	20	IDGD	
C[C@@H]1CN(Cc2cccc(CNC(=O)NNC(=O)CNC(=O)OC(C)(C)C)c2)CCO1	778627932	QEONLJJETVOOLK-OAHLLOKOSA-N	435.525	1.262	50	20	IDGD	
CC(=NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1)c1ccc(N2CCNC2=O)cc1	782142162	DWGRAFVCIRTNIU-UHFFFAOYSA-N	443.529	1.686	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2ccc3nc(N4CCOCC4)sc3c2)nc1	782145206	MYVQQXQPNHJPES-UHFFFAOYSA-N	428.474	1.618	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)CCCOc2ccc3c(c2)NC(=O)CC3)c1	782541983	QIJRHUKMEPCCAJ-UHFFFAOYSA-N	445.497	1.595	50	20	IDGD	
CCOC(=O)[C@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNc2ccccc2F)cc1F	782708476	OQGIREDSIDMAJC-NSHDSACASA-N	434.399	1.728	50	20	IDGD	
CS(=O)(=O)NCc1ccc(NC(=O)C(=O)NNc2ccc(Br)cc2)cc1	783008934	DAUYTKXDTZXJTH-UHFFFAOYSA-N	441.307	1.580	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2cnc3c(c2)CCCC3)nc1	783263051	HBMKCBXGPFTSQO-UHFFFAOYSA-N	432.506	1.124	50	20	IDGD	
CCCCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNc2cncc(Cl)n2)cc1	783265689	JVYBQJCECZSPQX-UHFFFAOYSA-N	426.886	1.754	50	20	IDGD	
Cc1cc(C)cc(NNC(=O)C(=O)Nc2cnn(CC(=O)N3C[C@H](C)O[C@H](C)C3)c2)c1	783356440	IYSNVULHMAHGTK-IYBDPMFKSA-N	428.493	1.218	50	20	IDGD	
COc1ccc(C#N)cc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1	783408506	LAXJNKVZGJNNLP-UHFFFAOYSA-N	442.375	1.942	50	20	IDGD	
Cc1ccnc(Oc2cc(NC(=O)C(=O)NN[C@]3(C)CCS(=O)(=O)C3)ccc2C)c1	783423911	BKZBRSPMKNLERI-HXUWFJFHSA-N	432.502	1.627	50	20	IDGD	
C[C@H](Oc1ccccc1NC(=O)C(=O)NN[C@]1(C)CCS(=O)(=O)C1)c1ccccc1	783426007	LANKPRXJHMUGLW-YCRPNKLZSA-N	431.514	1.963	50	20	IDGD	
COc1c(Cl)cccc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	784213398	LSUKZJGGHNECHV-UHFFFAOYSA-N	438.893	1.871	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNc2cccnc2Cl)ccc1S(=O)(=O)N(C)C	784839279	UBYIDJMIAZMCEP-UHFFFAOYSA-N	427.870	1.076	50	20	IDGD	
CCOC(=O)c1ccc(NC(=O)C(=O)NNc2c(OC)cccc2S(C)(=O)=O)cc1	785331428	UVMVDBNOYZPSHB-UHFFFAOYSA-N	435.458	1.357	50	20	IDGD	
C[C@@H]1[C@@H](C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)CCN1C(=O)OC(C)(C)C	786368511	LYIZIPRSMAOVFR-CJNGLKHVSA-N	430.461	1.508	50	20	IDGD	
CCS(=O)(=O)Nc1cc(OC)ccc1S(=O)(=O)NNC(=O)NCc1ccccc1	786731761	FUFRJOHJYKDOPK-UHFFFAOYSA-N	442.519	1.150	50	20	IDGD	
CCN(CC)Cc1ccc(NC(=O)C(=O)NNC(=O)CNC(=O)c2cccs2)cc1	787898548	MEUHEUPSESXCKY-UHFFFAOYSA-N	431.518	1.106	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@H]1CC(C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)=NO1	788626382	XROLFDNHJGJHMO-CYBMUJFWSA-N	428.449	1.507	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)nnn1CC1CCCC1	788719888	JBLODLWFXCNSRJ-UHFFFAOYSA-N	434.522	1.102	50	20	IDGD	
Cc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NNC(=O)[C@H]1OCC[C@H]1c1ccccc1	789811531	CVRDZKLRQHQPHV-HKUYNNGSSA-N	438.484	1.355	50	20	IDGD	
O=C(NNC(=O)[C@H]1OCC[C@H]1c1ccccc1)C(=O)Nc1ccnn1-c1cccc(F)c1	789819799	QUYUYMSWDIHFTL-HKUYNNGSSA-N	437.431	1.670	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)[C@@H](C)[C@@H](C)C(=O)NNC(=O)c1ccccc1OC	790615988	JOHNRQGMQWGPQM-OKILXGFUSA-N	442.472	1.198	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@H](C(=O)NNc2cccc(F)c2[N+](=O)[O-])[C@@H](C)O)cc1	791148250	UWUGHUXUHCRLPI-ABAIWWIYSA-N	426.426	1.213	50	20	IDGD	
CNS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2ccc(F)cc2Br)nc1	792400201	LFRVOTZZILYDEL-UHFFFAOYSA-N	446.258	1.358	50	20	IDGD	
CC(=O)N1CCC(N(CC(=O)NNC(=O)c2ccc(C)cc2)Cc2cncs2)CC1	795579332	ZFNYONRSZXCIDH-UHFFFAOYSA-N	429.546	1.726	50	20	IDGD	
COc1ccccc1O[C@H]1CCCN(CC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)C1	796567199	QNZCIZCVHWXLDR-KRWDZBQOSA-N	428.445	1.908	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)NCc1ccncc1OCC(F)(F)F	798509290	KAEOLQWUDSADMS-UHFFFAOYSA-N	428.367	1.941	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NCCN2CCC3(CCCCC3)CC2)c2ccccc2c1=O	799679181	ZXFASAFTKDHAEW-UHFFFAOYSA-N	440.548	1.924	50	20	IDGD	
COc1ccc(C2=NO[C@@H](CNC(=O)NNC(=O)COc3ccccc3O)C2)cc1F	802339424	KIGMFDIWUPQUDW-CYBMUJFWSA-N	432.408	1.442	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)N[C@@H]1CCN(C(=O)COc2ccccc2)C1	802467327	RNRFPZFQJDCYFL-OAHLLOKOSA-N	427.417	1.219	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2ccc(-c3ccc(Cl)s3)nc2)CCS(=O)(=O)C1	802569187	CCOVCFNXEPGMGH-MRXNPFEDSA-N	428.923	1.600	50	20	IDGD	
CCc1nnc(NC(=O)[C@H](C)[C@H](C)NC(=O)NNC(=O)Cc2cn3ccccc3n2)s1	805878301	IATIWQCWXYAFDF-NEPJUHHUSA-N	444.521	1.284	50	20	IDGD	
C[C@H](C(=O)NNC(=O)c1nn(-c2ccccc2)cc1O)C1CN(C(=O)OC(C)(C)C)C1	806345841	BPRYCYBKELQIBP-ZDUSSCGKSA-N	429.477	1.842	50	20	IDGD	
O=C1COC[C@@H](C[C@H]2CN(C(=O)C(=O)NNc3cnc4ccccc4n3)c3ccccc32)N1	806984067	LLZRIFVEPCOLDH-LSDHHAIUSA-N	446.467	1.108	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NN=Cc1cc(F)ncc1F	807946573	XOJLBYBJWULWIH-UHFFFAOYSA-N	438.456	1.464	50	20	IDGD	
Cc1nn(C)cc1S(=O)(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1	808084570	AOIMRQHZTDCJKY-HXUWFJFHSA-N	439.541	1.665	50	20	IDGD	
CCOC(=O)c1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(CC)CC)c2)cc1	809956564	ARAPHCBBXJJEIG-UHFFFAOYSA-N	447.513	1.969	50	20	IDGD	
O=C(NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)Nc1ccn2ccnc2c1	810229808	KUDGCKJDRCSMOQ-UHFFFAOYSA-N	428.474	1.585	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)CNS(=O)(=O)c2ccc3ccccc3c2)c1	810915813	UGIDCNLVJSTDNC-UHFFFAOYSA-N	433.511	1.665	50	20	IDGD	
O=C(CN(CC(=O)NNc1ccnc(F)c1)c1ccccc1)NNc1ccnc(F)c1	812545826	FSAXWKOTUOOUBG-UHFFFAOYSA-N	427.415	1.848	50	20	IDGD	
CCOCc1nc([C@@H](C)NC(=O)NNC(=O)COc2ccc(Br)cc2)no1	812569189	YNLZXBQFCUZYMX-SNVBAGLBSA-N	442.270	1.839	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)CNC(=O)N2CCc3ccccc3C2)cc1	812733189	JFLPPEXJIOFQJZ-UHFFFAOYSA-N	431.518	1.148	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@H](F)C[C@H]1CNC(=O)NNC(=O)COc1ccccc1F	813815486	ORNVFVLIRKJSLA-STQMWFEESA-N	428.436	1.882	50	20	IDGD	
CN(CCOc1ccc(S(N)(=O)=O)cc1)C(=O)NNC(=O)c1cccc2cccnc12	814291707	VUNOZSNSACBYTC-UHFFFAOYSA-N	443.485	1.247	50	20	IDGD	
CS(=O)(=O)C[C@H]1CCN(C(=O)NNC(=O)c2ccc(Br)cc2Cl)C1	814296423	XHVVBZBNIWLJHL-VIFPVBQESA-N	438.731	1.823	50	20	IDGD	
CN(c1ccccc1NC(=O)NNc1ccccc1S(=O)(=O)N(C)C)S(C)(=O)=O	814667285	MJMNOHHFSCGZKL-UHFFFAOYSA-N	441.535	1.481	50	20	IDGD	
Cc1cc(Cl)c(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1[N+](=O)[O-]	815405048	HOAAMHBWRIXVBD-MRXNPFEDSA-N	449.803	1.701	50	20	IDGD	
COCCOC(=O)c1c(C)[nH]c(C(=O)NNc2ccccc2S(=O)(=O)N(C)C)c1C	817053730	DPMHQBVVFZGICD-UHFFFAOYSA-N	438.506	1.442	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cccnc2N2CCCCC2)cc1OC	915556616	OUDUELFSAGTLND-UHFFFAOYSA-N	442.472	1.707	50	20	IDGD	
CC(C)NS(=O)(=O)c1cccc(CNC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1	916486468	UFTGXJPZHIODOA-SFHVURJKSA-N	448.501	1.044	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CCC(=O)N2CC(=O)Nc3ccccc32)cc1C	916561736	BHJBDSSLMJWGCD-UHFFFAOYSA-N	437.456	1.155	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)N[C@@H](C)c1ccc(S(=O)(=O)N(C)C)cc1	918104369	IOVLPLAUHIDKAQ-HNNXBMFYSA-N	448.545	1.970	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)CCCOc2ccccc2F)ccc1Cl	918419473	GCCCLYAOSOAEKE-UHFFFAOYSA-N	429.857	1.747	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)NCCN2CCN(c3ccc(F)cc3)CC2)cc1	919906308	WEZYKQDCVCWOMH-UHFFFAOYSA-N	443.523	1.920	50	20	IDGD	
Cc1nn([C@@H]2CCS(=O)(=O)C2)c(Cl)c1C=NNC(=O)CCN1CCC(C)CC1	1317698386	OMENYSPLQXJBOP-OAHLLOKOSA-N	429.974	1.777	50	20	IDGD	
C[C@H](CCNC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)N(C)C(=O)OC(C)(C)C	1318488850	JOXLZMWWCLIKAO-CYBMUJFWSA-N	442.538	1.680	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2ccc(S(=O)(=O)/N=C3\CCCN3C)cc2)cc1	1320118170	GMNOLWQOVUNMDP-HKOYGPOVSA-N	445.501	1.975	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)N[C@@H]1COc2c(F)cc(F)cc2C1	1339889523	KDJPIXIVEIRHNA-HNNXBMFYSA-N	432.431	1.305	50	20	IDGD	
O=C([C@@H]1CN(Cc2ccccc2)CCO1)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Cl)CCO2	1778277413	YVUYNUZBMVHCGO-WFXMLNOXSA-N	439.915	1.252	50	20	IDGD	
N#Cc1c[nH]c(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](F)Br)C3)c1	1780180950	LUWJOHKLLGKNLZ-CKEIUWERSA-N	427.274	1.704	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H]3CC[C@@H]4CCC(=O)N4C3)C2)C1	1781057377	OIESUHIQHDSWLU-VZJWBNGJSA-N	446.375	1.454	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)C3CN(C(=O)OC(C)(C)C)C3)CCO2)C1	1781218706	JOGGIYVMVPYZPD-FOIQADDNSA-N	429.945	1.701	50	20	IDGD	
CCc1[nH]nc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](F)Br)C3)C2)c1Cl	1781330865	IHBXHHFKOLOSCL-WFASDCNBSA-N	437.697	1.760	50	20	IDGD	
COc1cc(C#N)cc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](F)Br)C3)C2)c1	1781334441	NWKYDDQAWUXKDL-YJBOKZPZSA-N	440.269	1.701	50	20	IDGD	
O=C([C@@H](F)Br)N1CC[C@@]2(C1)CN(C(=O)C(F)(F)c1ccco1)CCO2	1781334655	QIXXSSRTQZCARP-BXUZGUMPSA-N	425.201	1.892	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](N)c1ccccn1)C2	1781997763	GBXLEKMKLRVPLX-GKDNMFGBSA-N	439.354	1.379	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc3cnccc3[nH]1)C2	1782175345	HUKHDSMKJVZRRD-FQELHTAISA-N	434.924	1.944	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C1(C(F)(F)F)CC1)C2	1782214595	LPLIOSXTDQGDDE-RDTXWAMCSA-N	448.486	1.216	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnn4cccc(F)c34)C2)C1	1782552335	WOKLAIRIDOFNNQ-SGTLLEGYSA-N	439.285	1.700	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnc4c(c3)CCNCC4)C2)C1	1782727865	SCXIQNDAEFTATE-JOCHJYFZSA-N	434.968	1.478	50	20	IDGD	
COCCC(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](Br)Cc3ccccc3)C2)C1	1783022621	KULQVEPFJSZYFA-FXAWDEMLSA-N	439.350	1.859	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(OC)nn3C)CCO2)C1	1783345045	WOELKBGYYIQWEE-PXAZEXFGSA-N	429.315	1.046	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cnn4ccncc34)CCO2)C1	1783347994	RBDBWYKUCAACKE-RDTXWAMCSA-N	436.310	1.346	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1CC[C@@H]3CCC(=O)N3C1)CCO2	1783538064	SPMDRLBUHUTJTM-HRLGVUPISA-N	442.354	1.001	50	20	IDGD	
CC(C)n1nc(C(=O)N2CCO[C@]3(CCN(C(=O)C(Cl)Cl)C3)C2)cc1C(=O)O	1783944353	XWMUUMIXIMYMFV-KRWDZBQOSA-N	433.292	1.409	50	20	IDGD	
C[C@H](Oc1ccccn1)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2	1784489122	UWCYHUWMVPHLFA-ZOCIIQOWSA-N	430.332	1.915	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(O)n3)[C@H]2C1	1786046941	XQZKNCCEZXVZKR-XPCVCDNBSA-N	426.311	1.554	50	20	IDGD	
Cc1nc(CC(=O)Nc2ccc(C3(NC(=O)c4ccc(B(O)O)cc4)CCC3)cc2)no1	1786844591	RBYJZGOCVJDPRY-UHFFFAOYSA-N	434.261	1.048	50	20	IDGD	
CC[C@@H](C)[C@H](N)C(=O)Nc1ccc(C2(NC(=O)c3cnccc3C(=O)NN)CCC2)cc1	1787990306	PESPAKAMJOMDDX-KUHUBIRLSA-N	438.532	1.806	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)c3ccncc3O)CCC2)cc1)c1ccc(B(O)O)cc1	1788142250	MNKXNYIFUJLYPS-UHFFFAOYSA-N	431.257	1.529	50	20	IDGD	
O=C(Cc1ccncc1)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1	1788144392	KIVUCQSDNJZTJQ-UHFFFAOYSA-N	429.285	1.752	50	20	IDGD	
O=C(Cc1ccc2c(c1)CCCO2)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21	1788194679	HABCMOFSHPMPQL-GNBUJSLZSA-N	436.936	1.134	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nccc4nc[nH]c34)C[C@@H]21	1788764102	LHSPZACNVSRLKZ-DZKIICNBSA-N	431.569	1.403	50	20	IDGD	
CO[C@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C(C#N)=C/c3ccc(F)cc3F)[C@H]2C1	1790695057	AJYFHPNMBYGGRA-STGGQVBHSA-N	433.455	1.886	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3ccc(F)cc3)C[C@@H]21	1791257444	GZUCBBRLTKQDNW-WNHJNPCNSA-N	426.916	1.992	50	20	IDGD	
Cc1cccc(F)c1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]21	1791901281	RZPGFFWFEQCLRZ-BQFCYCMXSA-N	434.512	1.100	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cn3ccccc3n1)C2	1792867442	BKBSQDLUVUHQRE-ZJOBFFGXSA-N	435.322	1.569	50	20	IDGD	
COC(=O)[C@@H]1CC[C@@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)CBr)C3)C1	1792967097	XSDGJJUMUMKDMK-FBRBKTQXSA-N	445.354	1.196	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCl)C1CCN(c2ccc(F)cn2)CC1	1793112415	HXOBJOUBPPJIRL-XMTFNYHQSA-N	438.931	1.675	50	20	IDGD	
COc1cccnc1CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2	1794031682	QOWFYDLYXMJBAU-LZDSYCOUSA-N	444.301	1.303	50	20	IDGD	
CN(C)c1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@](C)(Cl)CCl)C3)nc1	1794460958	CQFGLQQQDBCILN-AODNKKSCSA-N	429.348	1.587	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCc1cncnc1	1795803667	IDZXNSUTVDRFHV-JJAZEVLHSA-N	425.327	1.030	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1nnc(C)s1	1796258709	IPGKPHDVNWRMLB-NHDOHCAUSA-N	443.533	1.161	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Cl	1796365199	VYKXGDPTNQQSAH-PPCPHDFISA-N	442.315	1.243	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CC[C@@H]2CCC(=O)N2C1	1799149893	QVLBJWOOZQPWGF-XIRVDMFSSA-N	446.375	1.213	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CC12CCCN1CCC2	1799213766	LBFDVTIPEFXLNM-KYHPRHEASA-N	442.398	1.768	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(Cl)c3nncn3c1)C2	1799268826	CPXSAXXPIAWRHJ-QVHKTLOISA-N	426.304	1.603	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@]1(C)CCCN1	1800000969	CZFGSKCJBJVXIJ-QKQGURCUSA-N	442.988	1.899	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cnc(C)s1)C2	1800644067	GTQHNYOUVKBQQP-LMWOUKEDSA-N	430.368	1.757	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)Br)cc1	1800763507	CFASAWDMSAZFHJ-FIUQPQMISA-N	438.322	1.632	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(C(F)(F)F)n1C)C2	1800978067	KYMRIAIGQCNWFO-NWJSVONSSA-N	437.846	1.501	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnc3cc(C)ccn3c1=O)C2	1802272493	AHTJFSXJCJAQAY-JYYAWHABSA-N	432.908	1.509	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(-c3ccccn3)[nH]n1)C2	1802337992	ZRANNCJRCQNQKR-MUJYYYPQSA-N	439.520	1.097	50	20	IDGD	
O=C1CC[C@H](C(=O)NC[C@H]2CCN(C(=O)CCBr)[C@@H]2c2cccnc2)CN1	1802609303	JAULJHVHPINOOY-RVKKMQEKSA-N	437.338	1.399	50	20	IDGD	
C#CC(=O)N1CC[C@H](CNC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)[C@H]1c1cccnc1	1804240885	KXGHYVHQYIZRIO-SOLBZPMBSA-N	434.924	1.853	50	20	IDGD	
COC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)Br)[C@H]1c1cccnc1	1806380896	PSQFZRVGCDCUTR-IFIJOSMWSA-N	426.311	1.824	50	20	IDGD	
O=C(/C=C/c1cccnc1)N1CCCC2(CCN(C(=O)c3cccc(B(O)O)c3)CC2)C1	1807163188	OFZRKKPLHADAFD-BQYQJAHWSA-N	433.317	1.320	50	20	IDGD	
Cc1[nH]ccc1C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1807364036	RVEJVLZJPVWTKR-RXVVDRJESA-N	432.289	1.031	50	20	IDGD	
C=C(C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)C(F)(F)F	1807368154	PQQVZLJTHMRTIS-FUHWJXTLSA-N	447.222	1.200	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cccc(F)c2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1	1807375267	NOVUSCBNDLKMFX-UGKGYDQZSA-N	447.275	1.534	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)c1cccc2c[nH]nc12	1808056025	XHLLCIWKENYTFC-WDYCEAGBSA-N	427.892	1.877	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)c2ccno2)[C@@H]1c1cccnc1	1808415013	RFQOQAJRSWPZSA-RUVVGEKZSA-N	449.471	1.523	50	20	IDGD	
CCC1(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)CCC1	1809644606	GSAVHRMPRKOBAB-CTNGQTDRSA-N	435.333	1.661	50	20	IDGD	
COc1ccc(C(=O)N2CCC3(CCCN(C(=O)c4ccc(B(O)O)cc4)C3)CC2)s1	1809969332	QKEKZODDZXUIJW-UHFFFAOYSA-N	442.346	1.595	50	20	IDGD	
C[C@@H]1C[C@]1(C)C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1	1810305319	KBSHRZREMXGMRM-LZOXNYCHSA-N	436.516	1.446	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1CCN(C(=O)CCSC(=N)N)[C@H]1c1cccnc1	1810542546	ZPRZJGNIXAMUGJ-YJBOKZPZSA-N	437.642	1.956	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)c1cc2ncsc2[nH]1	1810577383	HOEQCPJMYIOKFZ-APHBMKBZSA-N	433.921	1.939	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2ccnc3c2OCO3)[C@H]1c1cccnc1	1811316058	QJCMLZGRMWQRQM-HYVNUMGLSA-N	446.891	1.779	50	20	IDGD	
Cc1ccn(C)c1C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1811607591	UJPGOOVNIKOLNW-DENIHFKCSA-N	446.316	1.042	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1ccccc1F	1811673526	PFOIPAQGIYJATK-GCJKJVERSA-N	447.275	1.534	50	20	IDGD	
Cc1ccn2c(C(=O)NC[C@@H]3CCN(C(=O)[C@@H](O)CCl)[C@@H]3c3cccnc3)cnc2c1	1812252654	OPAGWPHBWAYWOE-XKGZKEIXSA-N	441.919	1.957	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)[C@H](C)n2ccnn2)[C@@H]1c1cccnc1	1812400181	YLZVXZHNDLRJBV-UGQVUOCMSA-N	435.326	1.724	50	20	IDGD	
CN1CCN(CCC(=O)N2CC[C@@H](CNC(=O)C(Cl)Cl)[C@@H]2c2cccnc2)CC1	1813075580	FOWZTLIWLFFOOE-WMZOPIPTSA-N	442.391	1.529	50	20	IDGD	
Cc1ccc(CC(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cccc(B(O)O)c2)CC3)cc1	1813978618	MNVFFVUCTNWANR-SFHVURJKSA-N	449.341	1.600	50	20	IDGD	
C=C(C(=O)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1)C(F)(F)F	1815360061	KPNXPUOCTCZYMA-LBPRGKRZSA-N	439.224	1.167	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)Cc3ccn(C)n3)sc2C1	1815553515	QPRCZQXARAOWOX-NXEZZACHSA-N	426.340	1.815	50	20	IDGD	
O=C1CC[C@H](C(=O)N2CCCC[C@@H]2c2cc(NC(=O)CCBr)n[nH]2)CN1	1816779313	FXPODBIIEQYOGO-WCQYABFASA-N	426.315	1.713	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)CN3CCN(C(C)=O)CC3)sc2C1	1818896876	KYAWXRKVLRCKAC-KBPBESRZSA-N	441.985	1.237	50	20	IDGD	
CN1CCN(CC(=O)Nc2cc([C@H]3CCCCN3C(=O)[C@@](C)(Cl)CCl)[nH]n2)CC1	1818913788	MOEKLOLULQLKMM-BEFAXECRSA-N	445.395	1.886	50	20	IDGD	
C[Si](C)(C)OCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnncc1C(=O)O)CC2	1820165680	LVTCFJFWWISJMZ-JTQLQIEISA-N	449.565	1.709	50	20	IDGD	
COc1ccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)cc1	1820570268	RKCLQESDPOQZQZ-FQEVSTJZSA-N	448.288	1.718	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnn3c2OCCC3)[nH]n1	1822375454	DBINIHPPZXAPKK-ZFWWWQNUSA-N	436.900	1.948	50	20	IDGD	
CC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnccc1C(=O)NN)CC2	1822850186	PTLJQHYIFDJXTD-SKDRFNHKSA-N	436.925	1.385	50	20	IDGD	
CN1C(=O)CC[C@H]1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@](C)(Cl)CCl)CC2	1823051898	TXZJILQGMZGCAH-NSTVUXKKSA-N	433.361	1.912	50	20	IDGD	
CCCNC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)[C@H](Cl)COC)sc2C1	1825994680	NETZZNDOAXDRBE-NWDGAFQWSA-N	430.958	1.615	50	20	IDGD	
CCC[C@H](NC(C)=O)C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](Cl)COC)sc2C1	1826009579	VAHYTKXZBDDFLJ-OBJOEFQTSA-N	430.958	1.614	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccccc1O)CC2	1826080688	UKYQOKXRXDFVOK-GFCCVEGCSA-N	431.518	1.448	50	20	IDGD	
O=C(Cc1cscn1)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827053203	XTXJGOBHYNQSSS-HXUWFJFHSA-N	441.362	1.299	50	20	IDGD	
CCOC(=O)N[C@@H](O)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CO[Si](C)(C)C)CC1	1828760542	CPMYDQXQWGRGAW-AEFFLSMTSA-N	443.617	1.522	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1C[C@H]1C1CC1)CCO2	1830506332	YGQWIKVRBFQUKZ-IUVQAAGXSA-N	429.355	1.662	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccnc3S)C2)C1	1831638664	GBMDGGFDBIVFCQ-HNAYVOBHSA-N	427.954	1.848	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc(OC)c(F)c3)C2)C1	1831644217	RNXCNPVJWYLWLZ-FOIQADDNSA-N	443.903	1.707	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccnc(OC)c3F)C2)C1	1831645633	DWAQCJDBKWOZDQ-QRWLVFNGSA-N	443.903	1.707	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cnc(C)s3)C2)C1	1831656727	IQJUIOFYAKWOOL-LPHOPBHVSA-N	429.970	1.858	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@@H]3CCC(=O)NC3)CC2)CC1	1833117848	BTDVCCCDKNGDOG-QAPCUYQASA-N	426.989	1.492	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)C(C)(C)C)CC2)CC1	1833286883	IZJLMVIKCMCKIT-CJNGLKHVSA-N	432.403	1.748	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H]3CNc4ccccc43)CC2)CC1)[C@@H](O)CCl	1833308859	AZXYLOQTRPOMDH-QUCCMNQESA-N	434.968	1.367	50	20	IDGD	
Cc1c(C(=O)N2CCC(N3CCC(NC(=O)[C@H](O)CCl)CC3)CC2)nc2ccccn12	1833310547	RLEXKKZCSRGZLJ-GOSISDBHSA-N	447.967	1.428	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3ccc[n+]([O-])c3)CC2)CC1	1833912543	NKDGIYHGRJBNIN-CQSZACIVSA-N	439.354	1.289	50	20	IDGD	
Cc1nc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)cs1	1834460344	ZZCPLAXZRZUYLD-BDJLRTHQSA-N	432.340	1.305	50	20	IDGD	
C/C(=C/C(=O)N1CCC(N2CCC(NC(=O)CO[Si](C)(C)C)CC2)CC1)C(=O)O	1835837524	JUGBSNXVWHXFIW-SQFISAMPSA-N	425.602	1.440	50	20	IDGD	
CCc1cnc(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)s1	1835838191	FKZKDPDIZGRTSD-INIZCTEOSA-N	428.986	1.490	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(C=O)s3)CCO2)C1	1835946754	UAWUMSQSOBLGME-ROUUACIJSA-N	449.356	1.867	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)[C@@]3(C)CCCN3)CC2)CC1	1836382256	VYQXFQXVKIOJPW-FOIQADDNSA-N	443.430	1.731	50	20	IDGD	
O=C(Cc1ccc(F)cc1)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836716732	MMPJKMLGPXDUOX-IBGZPJMESA-N	426.916	1.967	50	20	IDGD	
O=C(c1ccn(C(F)F)n1)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836718667	YQOJJROBNQRCPX-HNNXBMFYSA-N	434.871	1.490	50	20	IDGD	
COc1cscc1C(=O)N1CCOC[C@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1837713238	QKSPGNKPUWESMN-IBGZPJMESA-N	442.610	1.678	50	20	IDGD	
C[C@@H](C(=O)N1CCOC[C@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1)c1ccccn1	1837717955	SQFPMMXNTKHDEC-UTKZUKDTSA-N	435.597	1.493	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnccc3Cl)CCO2)C1	1837780380	FFZCUTBGTFJUMT-PXAZEXFGSA-N	446.729	1.588	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCC(OC2CCN(C(=O)c3cc(O)n[nH]3)CC2)CC1	1837902656	DQDYMZXGXDDIKU-GOSISDBHSA-N	433.336	1.964	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3nccc4nc[nH]c34)CC2)CC1	1838053938	QKYLWDFBMWBXCD-INIZCTEOSA-N	449.939	1.824	50	20	IDGD	
COC(=O)c1ccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)s1	1839035051	UICDRHHLPPLPMN-CRAIPNDOSA-N	448.900	1.068	50	20	IDGD	
CC(C)[C@H](S)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2	1839150636	RVKPOBPLKJXIIP-IAOVAPTHSA-N	427.394	1.634	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2	1839155382	RXHQLKZWPUPSLY-TUKIKUTGSA-N	446.169	1.463	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4[nH]ccc4s3)C2)C1	1840152549	LYRNIGLAXZKUIV-ORAYPTAESA-N	441.937	1.553	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)/C=C/C3CCCCC3)C2)C1	1840154888	JFFVSBLFOAHSGV-MVRCGGMCSA-N	428.957	1.833	50	20	IDGD	
O=C(c1cn2cc(F)ccc2n1)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840188404	HUYJBPXWLIVMDP-SFHVURJKSA-N	445.278	1.347	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)Cc2ccc(C(F)(F)F)cc2)C1	1842723488	ABEKLESRZLMEAG-UHFFFAOYSA-N	440.466	1.824	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)/C=C/C(=O)c1cccs1)C2	1844264120	HDXGRNBLTZIQGG-SNAWJCMRSA-N	439.497	1.003	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1cc3cc(F)ccc3[nH]1)C2	1844264325	GIOVFCQPXZDTEG-UHFFFAOYSA-N	436.447	1.436	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)c1ocnc1C)C2	1844692212	VAPSYBHRZPJLBU-UHFFFAOYSA-N	428.401	1.947	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2cc3cc[nH]c3cc2F)C1	1844721421	KSSZXKOLNGELTD-UHFFFAOYSA-N	436.447	1.436	50	20	IDGD	
O=C([C@@H](F)Cl)N1CC2(CCCN2C(=O)COCCOCCOCc2ccccc2)C1	1846258427	YRLIYWARNVALTQ-LJQANCHMSA-N	442.915	1.974	50	20	IDGD	
C=CCn1c(=O)c2ccccc2n2c(SCC(=O)NNC(=O)c3ccccc3)nnc12	3599453	SFUIXGHRQWIIPX-UHFFFAOYSA-N	434.481	1.784	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@@H]1CC(=O)Nc2cc(F)ccc21	10292118	OYOUHRYUEBWKQF-CYBMUJFWSA-N	433.465	1.314	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc2c(c1)nc(CCC(=O)NNC(=S)NC(C)(C)C)n2C	14895250	WDRKFLLAZBVTEY-UHFFFAOYSA-N	440.595	1.050	50	20	IDGD	
CC[C@@H](C)NS(=O)(=O)c1ccc(C(=O)OCC(=O)NNC(=O)c2ccc(C)cc2)cc1	26013635	KJUORKXXPXSFBW-OAHLLOKOSA-N	447.513	1.690	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)[C@@H]2CC(=O)N(Cc3ccco3)C2)c2ccccc2c1=O	28580718	ZFAQECVPHZXHRH-CQSZACIVSA-N	437.456	1.380	50	20	IDGD	
O=C(C[C@H]1CCS(=O)(=O)C1)NNC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1	46775086	YKMSZBYVLDFRHU-OAHLLOKOSA-N	439.497	1.520	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1I)c1ccccc1O	72075526	OZRNPKVVKCPFGO-UHFFFAOYSA-N	427.154	1.980	50	20	IDGD	
COc1ccc(C(=O)NNc2nc(-c3ccncc3)no2)cc1S(=O)(=O)N1CCCC1	726376806	CVMAORRVJLCAMH-UHFFFAOYSA-N	444.473	1.682	50	20	IDGD	
Cn1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)Nc3ccccc3Cl)c2)n1	727364432	NQLMSEOZOWDNPA-UHFFFAOYSA-N	433.877	1.949	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)N[C@@H](C)c2cccc(S(=O)(=O)N(C)C)c2)cc1	727610419	QMLBQNICLZXVHQ-HNNXBMFYSA-N	448.545	1.970	50	20	IDGD	
O=C(COC(=O)CCc1nc(-c2ncccn2)no1)NNC(=O)c1ccc(Cl)cc1	727902796	CDFCQHVAJBCCGM-UHFFFAOYSA-N	430.808	1.117	50	20	IDGD	
CCOC(=O)c1cc(S(=O)(=O)NNC(=O)c2cc(Br)c[nH]2)ccc1F	728503544	VBEVEXJQZNGOBW-UHFFFAOYSA-N	434.243	1.716	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)C(=O)NCCCc1ccccc1	729509489	QXZHNVYSLSQETB-UHFFFAOYSA-N	437.544	1.095	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)NCc1cccc(C(=O)NC[C@@H]2CCCO2)c1	731543710	OSUOMAYITZAVDF-KRWDZBQOSA-N	426.473	1.748	50	20	IDGD	
C[C@@H](CC(=O)NN=c1sc2ccccc2n1C)NS(=O)(=O)c1cccnc1Cl	731894866	BXDUNJCFCQVRLO-NSHDSACASA-N	439.950	1.977	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])o2)c(OC)c1	731989914	ALHRTDIJVWQVKV-ZDUSSCGKSA-N	432.389	1.271	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)c2csc(-c3ccc4c(c3)OCO4)n2)C[C@@H](C)O1	732262802	WHFWGUOFTDXRSA-CHWSQXEVSA-N	432.502	1.799	50	20	IDGD	
CCc1c(C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cnn1-c1ccccc1	732322219	FPWAZQSDCHGFRF-UHFFFAOYSA-N	437.412	1.961	50	20	IDGD	
CC(=O)N[C@@H](C)c1ccc(S(=O)(=O)NNC(=O)c2cnn(-c3ccccc3)c2)s1	733122807	ARKBYKRKAQLELX-LBPRGKRZSA-N	433.515	1.754	50	20	IDGD	
CCN1CCC[C@H]1CN1C[C@H](C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)CC1=O	733362609	TYGCLUUOYDGONA-HIFRSBDPSA-N	444.504	1.459	50	20	IDGD	
CCc1cc(NNC(=O)c2cc(S(N)(=O)=O)ccc2OC)nc(-c2ccccn2)n1	734357108	QCIKDYKMZVRFMG-UHFFFAOYSA-N	428.474	1.514	50	20	IDGD	
CN(CC(=O)NNC(=O)c1c[nH]c2ccccc12)S(=O)(=O)c1cccc([N+](=O)[O-])c1	737773731	RHRRVMSTPPVHEM-UHFFFAOYSA-N	431.430	1.158	50	20	IDGD	
COc1ccc(S(=O)(=O)CCC(=O)NNc2nc(-c3ccncc3)no2)cc1OC	740822125	SVUBBGCAALEWQX-UHFFFAOYSA-N	433.446	1.456	50	20	IDGD	
O=C(COC(=O)[C@H]1CCCN(C(=O)COc2ccccc2)C1)NNC(=O)c1ccccc1	741372311	SGJJXROVHIKJEP-SFHVURJKSA-N	439.468	1.308	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)[C@@H](C)NC(=O)c2cc3c(C)nn(C)c3s2)cc1C	742033928	SSXZUMAEMZWKNS-CQSZACIVSA-N	443.529	1.905	50	20	IDGD	
COCCCOc1cccc(C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)c1	742034799	WLGWXSDWZBZCJQ-UHFFFAOYSA-N	449.529	1.492	50	20	IDGD	
CC1CCN(c2nnc(SCC(=O)NNC(=O)C(C)(C)C)n2C[C@@H]2CCCO2)CC1	742452458	SGDPMQYNRUSYHB-HNNXBMFYSA-N	438.598	1.979	50	20	IDGD	
C[C@H]1CCCC[C@]12NC(=O)N(CC(=O)NNC(=O)c1cccc(Br)c1)C2=O	742768798	AGJONRXHFBMQFG-VOJFVSQTSA-N	437.294	1.711	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)[C@]2(C)CCCN(C(=O)c3ccccc3)C2)C[C@@H](C)O1	743289191	PMCWUTOBZMFCHA-IEGUWTFLSA-N	430.549	1.576	50	20	IDGD	
CS(=O)(=O)CCCNC(=O)NNC(=O)Nc1ccc(Br)cc1Cl	743572243	XYJJFBVDELPAEU-UHFFFAOYSA-N	427.708	1.873	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)CCc2nc(-c3ncccn3)no2)cc1Cl	743834902	YLKADSZOYWMXGW-UHFFFAOYSA-N	447.839	1.983	50	20	IDGD	
CN(C[C@@H]1CCCN(CC(=O)NNC(=O)c2ccc(C#N)cc2)C1)C(=O)OC(C)(C)C	744393013	INZINMNSBNBFKR-KRWDZBQOSA-N	429.521	1.898	50	20	IDGD	
COc1cc(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)cc2c1O[C@H](C)C2	744620210	HCXXVFZESXQYMV-CQSZACIVSA-N	447.513	1.796	50	20	IDGD	
O=C(C[C@@H]1OCCc2ccccc21)NNc1ccccc1S(=O)(=O)N1CCOCC1	744622224	XKJCXZCTOXJVMU-IBGZPJMESA-N	431.514	1.855	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCc2cccc3cccnc23)cc1	745286176	KSGJQWFEBHMWQZ-UHFFFAOYSA-N	441.513	1.694	50	20	IDGD	
Cc1ccccc1C(=O)NNS(=O)(=O)c1cc2nc(O)[nH]c2cc1Br	745998978	RTTHZPCRTWNYKX-UHFFFAOYSA-N	425.264	1.963	50	20	IDGD	
O=C(CCN/C(O)=C1/N=CC=CC1=O)NNC(=O)NCc1cccc(C(F)(F)F)c1	746173227	RUSNQXKCPDEYAZ-NXVVXOECSA-N	425.367	1.452	50	20	IDGD	
COc1ccc([C@H](CNC(=O)NNC(=O)Cc2cn3ccccc3n2)N(C)C)cc1OC	746741940	DOSYBVULBIXCSG-KRWDZBQOSA-N	440.504	1.527	50	20	IDGD	
O=C(O)c1ccc(S(=O)(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c(Br)c1	747595463	ODIFZBXSZRKFDT-UHFFFAOYSA-N	444.219	1.679	50	20	IDGD	
Cc1c(C(=O)NNc2nc(-c3ccc(Cl)cc3)no2)cnc2c1c(=O)n(C)c(=O)n2C	747888935	OQYOPZRBYFYQSD-UHFFFAOYSA-N	441.835	1.401	50	20	IDGD	
CS(=O)(=O)CC[C@@H](NS(=O)(=O)c1ccccc1)C(=O)NNc1ccccc1F	748055850	SCGPPLNNEGSNOW-MRXNPFEDSA-N	429.495	1.051	50	20	IDGD	
O=C(NNC(=O)[C@H]1CC(=O)N(c2ccc3c(c2)Cc2ccccc2-3)C1)C(=O)N1CCCC1	748240817	YFDYEZAUNPGRHX-KRWDZBQOSA-N	432.480	1.381	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)c2cc(S(=O)(=O)N3CCC3)ccc2Cl)c1O	748843975	APXANTIZUAFIAX-UHFFFAOYSA-N	439.877	1.523	50	20	IDGD	
O=C(NNC(=O)[C@H]1CC(=O)N(c2cn[nH]c2)C1)c1ccc(Br)cc1Cl	748849860	YBEBRPGXSAYJAJ-QMMMGPOBSA-N	426.658	1.640	50	20	IDGD	
COc1cc(CNC(=O)NNC(=O)Cn2nc(C)cc2C)cc(Br)c1OC	749188617	OCHYSCLGVVAMKI-UHFFFAOYSA-N	440.298	1.810	50	20	IDGD	
CCOC(=O)[C@H]1Cc2cc(S(=O)(=O)NNC(=O)c3c[nH]c4ccccc34)ccc2O1	751538750	ONDBLWHPWDVVPI-GOSISDBHSA-N	429.454	1.658	50	20	IDGD	
CCOC(=O)C(F)(F)[C@@H]1CCC(=NNC(=O)Cc2csc(N3CCOCC3)n2)C1	752720182	GNXOPMYFTYKHKZ-GFCCVEGCSA-N	430.477	1.993	50	20	IDGD	
O=C(CO)NNC(=O)c1ccc(NS(=O)(=O)c2ccc(Br)s2)cc1	753451717	HZONKCHUKFGPAQ-UHFFFAOYSA-N	434.293	1.065	50	20	IDGD	
C[C@@H](CS(=O)(=O)c1ccc(F)cc1)C(=O)NNC(=O)c1nnc(O)c2ccccc12	755044869	BMXYTNPPRBZGNB-NSHDSACASA-N	432.433	1.346	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)Nc1ccc(S(=O)(=O)N(C)OC)cc1	755533080	GWIXSLRVMJWDQX-UHFFFAOYSA-N	442.881	1.997	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2cccc(C(=O)N3CCOCC3)c2)cc1OC	755927244	SUNHVQQGGGGOCF-UHFFFAOYSA-N	428.445	1.643	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)Nc2cccc(OCC(=O)N(C)C)c2)cc1	755960287	JUNZXZCJAZALOH-OAHLLOKOSA-N	442.472	1.976	50	20	IDGD	
CCc1ccc(NC(=O)NNC(=O)c2ccc(CN(CC)CC)o2)cc1S(N)(=O)=O	756525241	NJPYAJKWDOIADN-UHFFFAOYSA-N	437.522	1.798	50	20	IDGD	
NC(=O)c1ccc(NNC(=O)c2cccc(S(=O)(=O)Nc3ccc(F)cc3)c2)nn1	757407818	LQPZDVWAUFTXEJ-UHFFFAOYSA-N	430.421	1.272	50	20	IDGD	
CN(C)C(=O)c1cc(NC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)ccc1F	757610323	JMEQEZOARWNBCR-UHFFFAOYSA-N	426.408	1.885	50	20	IDGD	
O=C(NNC(=O)c1cccnc1I)c1cc(Br)c[nH]1	757704211	RSFBMEBEMVPFLA-UHFFFAOYSA-N	435.019	1.852	50	20	IDGD	
C[C@H](C(=O)NNC(=O)c1ccc(CSc2nncn2C)cc1)n1nnnc1C(C)(C)C	757747850	MXZAYDDSRKTLLG-GFCCVEGCSA-N	443.537	1.414	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)Nc1c(C)nn([C@@H]2CCS(=O)(=O)C2)c1C	757871309	JGTHXUIRANPFPD-MRXNPFEDSA-N	449.533	1.654	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccc(Br)cc21)C1CCN(c2ncccn2)CC1	759021018	UOGNLBZVKAIGQX-OAHLLOKOSA-N	446.305	1.779	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)c3cncnc3)c2)cc1	760802204	XDGGXWHKMBIBSE-UHFFFAOYSA-N	427.442	1.361	50	20	IDGD	
COc1ccc(N2C[C@H](C(=O)NNC(=O)CSc3ccccc3OC)CC2=O)cc1	761624951	NBFSVJPGJDNDSW-CQSZACIVSA-N	429.498	1.996	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)N[C@@H](C)c1cccc(S(N)(=O)=O)c1	761648926	OYOOFDMMORUGMH-LBPRGKRZSA-N	438.531	1.526	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)NCCOc1ccc(C(F)(F)F)cn1	761779248	PDXVDAWLBNAEPE-UHFFFAOYSA-N	443.338	1.797	50	20	IDGD	
CCC(=O)NNC(=O)C(=O)Nc1cc(OC)c(OC)cc1C(=O)N1[C@@H](C)CCC[C@@H]1C	763441798	ZYDQDTNJOYFJQU-STQMWFEESA-N	434.493	1.603	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1N1CCOC1=O	763455410	RPMOXELTCHAFLG-UHFFFAOYSA-N	427.373	1.260	50	20	IDGD	
COC(=O)C(C)(C)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)cc1	763605677	QBSDVHGWIYAGHB-UHFFFAOYSA-N	449.467	1.927	50	20	IDGD	
CCNS(=O)(=O)c1ccc(CNC(=O)NNC(=O)Cn2ccc3ccccc32)cc1	763659398	KPWMOUYDWFJXFJ-UHFFFAOYSA-N	429.502	1.470	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cc(OC)c(Cl)cc2OC)cc1	763662708	ZHXOEAPGYFKKMS-UHFFFAOYSA-N	437.836	1.531	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccccc1C[S@@](C)=O	763684288	IXRSYMBOODBIPT-SSEXGKCCSA-N	433.486	1.129	50	20	IDGD	
O=C(CN1CCCc2ccccc21)NNC(=O)C(=O)Nc1ccccc1Br	763736423	TXLVDZHOQWUODM-UHFFFAOYSA-N	431.290	1.988	50	20	IDGD	
COCCn1nc(C)c(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)c1C	763855157	UWSAKKGAFOLMHW-INIZCTEOSA-N	431.493	1.317	50	20	IDGD	
C[C@@H]1COCCN1c1ccc(NC(=O)C(=O)NNC(=O)Cc2c[nH]c3ccccc23)cc1	763860950	MATKUGQRCCXDHQ-OAHLLOKOSA-N	435.484	1.722	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)NNC(=O)C(=O)Nc1ccnn1CCc1ccccc1	763865756	UUSLDCZVABHZEO-UHFFFAOYSA-N	430.468	1.936	50	20	IDGD	
COC(=O)c1ccc(F)c(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(C(C)=O)cc2)c1	763878622	SCDBNROEUKBKJB-GFCCVEGCSA-N	445.403	1.368	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2cccc(COCc3ccco3)c2)n1	763893767	ZLIRNQMEJBURFX-UHFFFAOYSA-N	425.445	1.596	50	20	IDGD	
CC[C@@H](C)n1ncc(NC(=O)C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c1C1CC1	763916956	LLQPERAIEJNIJG-GFCCVEGCSA-N	437.464	1.107	50	20	IDGD	
CS(=O)(=O)c1c(Cl)cccc1NC(=O)C(=O)NNC(=O)Cc1ccc(Cl)cc1	763939695	HAJFGGMIZZGNHN-UHFFFAOYSA-N	444.296	1.726	50	20	IDGD	
CN(C)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Br)s2)cc1	763940625	LIPXCASUNFLPCL-UHFFFAOYSA-N	439.291	1.612	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)C(=O)Nc1cnc(-c2ccccc2)nc1	763944091	LZHHLNMNIGKMTG-UHFFFAOYSA-N	443.423	1.435	50	20	IDGD	
C[S@](=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)on2)cc1F	764004181	UAYHMKNEDGGYQP-PMERELPUSA-N	430.417	1.618	50	20	IDGD	
CCCCOC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1	764004185	MFODRLMCASMNKR-UHFFFAOYSA-N	441.440	1.814	50	20	IDGD	
CN(C)C(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(C(F)(F)F)c2)cc1	764036844	BRIVTFXFJWAAKN-UHFFFAOYSA-N	436.390	1.736	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N(CC)CC)cc1NC(=O)C(=O)NNC(=O)[C@H](C)CC	764083083	OYEZNOIRHLLUOY-CYBMUJFWSA-N	442.538	1.248	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)c1ccnc(Cl)c1I	764100890	FTUWEBZJOMCSTG-UHFFFAOYSA-N	448.604	1.124	50	20	IDGD	
O=C(NNC(=O)c1cccc2ncccc12)C(=O)Nc1cccn(Cc2ccccc2)c1=O	764260985	VVWDYAIDEPXBHT-UHFFFAOYSA-N	441.447	1.845	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)Cc2ccccn2)n(-c2ccccc2C(F)(F)F)n1	764265078	YHPDYEVZBMDYRP-UHFFFAOYSA-N	446.389	1.923	50	20	IDGD	
O=C(Cc1ccccn1)NNC(=O)C(=O)Nc1ccc(C(=O)NCc2ccc(F)cc2)cc1	764266422	DMUXLJHFXWELGF-UHFFFAOYSA-N	449.442	1.479	50	20	IDGD	
Cc1cc(C)cc(-n2nc(NC(=O)C(=O)NNC(=O)COc3ccccc3O)cc2C)c1	764275607	OWSAFCRAGDMVOA-UHFFFAOYSA-N	437.456	1.668	50	20	IDGD	
CCc1nnc(-c2cccc(NC(=O)C(=O)NNC(=O)c3ccc(OC)cc3OC)c2)o1	764286896	PMRUFBIBZRABBN-UHFFFAOYSA-N	439.428	1.716	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)C(=O)Nc1ccc(F)c(-n2nnnc2C2CC2)c1	764318248	FDOKCYWPVXRVPI-UHFFFAOYSA-N	441.398	1.147	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2cc3ccccc3o2)cc1N1CCOC1=O	764341030	DDKJYFWTMYDMCH-UHFFFAOYSA-N	438.396	1.798	50	20	IDGD	
CC(C)(C)OC(=O)Nc1ccc(F)c(NC(=O)C(=O)NNC(=O)Cc2ccncc2)c1	764355008	XURUIGIEMUAWIY-UHFFFAOYSA-N	431.424	1.896	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2cnn(CC(C)C)c2)n[nH]1	764377222	LRUBQGHXHOJXOV-UHFFFAOYSA-N	425.449	1.338	50	20	IDGD	
CCCn1nccc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccc(OC)c(OC)c2)[nH]n1	764379060	PNZDLLNZUMULPL-UHFFFAOYSA-N	441.448	1.100	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1cccc(Cn2cncn2)c1	764394636	UWXWCSYVSVSCDH-UHFFFAOYSA-N	440.485	1.213	50	20	IDGD	
COc1cc(C)nc(NNC(=O)c2ccc(C(=O)NNc3nc(C)cc(OC)n3)o2)n1	765752156	DMSQXKBMYICEDO-UHFFFAOYSA-N	428.409	1.007	50	20	IDGD	
CC[C@H](Oc1ccccc1C)C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	766653665	SNYVBWZSCAEOOF-FQEVSTJZSA-N	438.528	1.758	50	20	IDGD	
Cc1[nH]nc2ncc(C(=O)NNC(=O)CN3CCN(Cc4ccc(Cl)cc4)CC3)cc12	766664323	PIHDBZPBFUSRPM-UHFFFAOYSA-N	441.923	1.499	50	20	IDGD	
CC(=O)Nc1ccc(Cl)c(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1	768098006	SAZJRQGMFHXLJZ-QGZVFWFLSA-N	447.831	1.443	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)CS(=O)(=O)NC3CCC(C)CC3)n[nH]2)c1	768265522	WNTYQQLGDLCBSU-UHFFFAOYSA-N	447.561	1.953	50	20	IDGD	
O=C(CNC(=O)c1cc(-c2ccccc2)on1)NNC(=O)c1cc(-c2cccs2)[nH]n1	768267795	CREBZDKLTWBFCQ-UHFFFAOYSA-N	436.453	1.984	50	20	IDGD	
CC[C@H]1CCCC[C@@H]1OCC(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	768712313	PNQQEQAVFFHEMG-IRXDYDNUSA-N	439.582	1.446	50	20	IDGD	
CC(C)(C)OC(=O)N1CCO[C@@H](C(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)C1	770966736	XKQKGCCDGIXTEO-GFCCVEGCSA-N	435.485	1.366	50	20	IDGD	
Cc1cc(S(C)(=O)=O)cc(C(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)c1C	772187663	ADOGFGNDSFATJP-UHFFFAOYSA-N	437.905	1.438	50	20	IDGD	
O=C(C[C@@H](c1ccccc1)N1CCOC1=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772196341	YEFJOCDMYSXVCP-KRWDZBQOSA-N	444.875	1.687	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNS(=O)(=O)c1ccc2nc(Cl)sc2c1	772855571	LNMJVGZJTLXMIK-UHFFFAOYSA-N	430.920	1.751	50	20	IDGD	
COC(=O)c1ccc(S(=O)(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)cc1F	773248974	AHZRRAMKDQMBLT-UHFFFAOYSA-N	442.421	1.261	50	20	IDGD	
CCN1CCN(c2ccc(Cl)cc2NC(=O)C(=O)NNc2nccc(OC)n2)CC1	773726569	NHNGLSOVJRSOBX-UHFFFAOYSA-N	433.900	1.362	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)NCC2CCN(C3CC3)CC2)c2ccccc2c1=O	775203018	AIFMPJMAZWZYNK-UHFFFAOYSA-N	426.521	1.796	50	20	IDGD	
Cc1cc(S(N)(=O)=O)ccc1CNC(=O)NNC(=O)c1cc2c(s1)CC[C@@H](C)C2	775210506	BVTHBTNHPOWHGG-LLVKDONJSA-N	436.559	1.973	50	20	IDGD	
COc1ccc(CC(=O)NNc2cc(Cl)ccn2)cc1S(=O)(=O)N1CCOCC1	778453934	VTTHXNQBCUKMHS-UHFFFAOYSA-N	440.909	1.450	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccccc2CCN(C)C)ccc1OC(C)C	782701546	GNVJNWNPGGBJOQ-UHFFFAOYSA-N	442.516	1.986	50	20	IDGD	
Cc1cn(-c2ccc(C#N)cn2)nc1NC(=O)C(=O)NN=c1sc2ccccc2n1C	783349773	PZNPXSJZWBPBCY-UHFFFAOYSA-N	432.469	1.571	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)[C@H]3CC=CC[C@H]3C(=O)N3CCOCC3)n[nH]2)cc1	784345479	BGZMENPMIYMEON-ZWKOTPCHSA-N	437.500	1.587	50	20	IDGD	
Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)C(=O)NNc1ncc(F)cn1	784957207	OCCRPNFACMTDEQ-QGZVFWFLSA-N	438.467	1.649	50	20	IDGD	
Cn1nccc1COCC(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	785687453	VLFPPBCZIDIEKV-UHFFFAOYSA-N	446.467	1.156	50	20	IDGD	
C[C@H]1[C@@H](C(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)CCN1C(=O)OC(C)(C)C	786250215	OHDAORQBMFELHR-WFASDCNBSA-N	440.522	1.888	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN1c1ccccc1)c1ccc(S(=O)(=O)N2CCCC2)cc1	786654666	PZABVFUDUGXUIB-HXUWFJFHSA-N	442.541	1.901	50	20	IDGD	
CC(C)OCCCn1c(NNC(=O)[C@H]2CCC[C@@H](C(N)=O)C2)nc2ccccc2c1=O	786979243	KNAFUCVKSGZTEP-CVEARBPZSA-N	429.521	1.946	50	20	IDGD	
Cc1nc(Cn2nnc(C(=O)OCC(=O)C(C#N)=C3N(C)c4ccccc4N3C)c2C)no1	787147464	JWJZVFDEKYSJCR-UHFFFAOYSA-N	448.443	1.374	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)CCC(=O)Nc3nnc(C4CCCCC4)s3)nc21	787358871	NJCHMFMNYZYRAM-UHFFFAOYSA-N	445.509	1.830	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)CC2CCC3(CC2)OCCO3)c2ccccc2c1=O	788150540	UJSIQJICGWPCQZ-UHFFFAOYSA-N	428.489	1.891	50	20	IDGD	
O=C(NCCOCC(F)F)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	788322760	YISVXIBFMDMULG-UHFFFAOYSA-N	434.465	1.087	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Cn2c(S)nc3ccccc3c2=O)ccc1OC(C)C	789043243	ZFQLDPMOSKXDQZ-UHFFFAOYSA-N	442.497	1.942	50	20	IDGD	
Cc1ccc(-n2cccn2)cc1NC(=O)C(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	789584549	MUNLDEMZHYAJOG-UHFFFAOYSA-N	445.439	1.472	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc(C)s1	790064129	UGNDNOJZXQERHR-ZDUSSCGKSA-N	433.552	1.146	50	20	IDGD	
Cc1c(S(N)(=O)=O)sc(C(=O)NNC(=O)c2ccc3c(c2)OCCO3)c1Cl	791196973	YOHBLZYDQYQFQO-UHFFFAOYSA-N	431.879	1.203	50	20	IDGD	
CS(=O)(=O)Nc1cc(C(=O)NNC(=O)COc2ccccc2O)cc(C(F)(F)F)c1	792146333	CUDIHFZARULBON-UHFFFAOYSA-N	447.391	1.623	50	20	IDGD	
CC(C)(C)c1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1[N+](=O)[O-]	793023111	HOVSOQFUIMXVNF-KRWDZBQOSA-N	442.428	1.818	50	20	IDGD	
Cc1nc2cc(F)c(F)cc2n1CC(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	794894339	GIRAPOCQQPQDAZ-UHFFFAOYSA-N	426.383	1.975	50	20	IDGD	
Cc1nc(O)c(Br)cc1C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	796144158	RWMRKERGXLEGEU-UHFFFAOYSA-N	435.282	1.326	50	20	IDGD	
CN(NC(=O)c1[nH]nnc1-c1ccccc1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	797751970	QHSJPUVIGSQMQW-UHFFFAOYSA-N	429.481	1.721	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2ccccc2)cc1S(=O)(=O)N1CCOCC1	801992678	XSLRJLDLXQILLB-UHFFFAOYSA-N	434.474	1.183	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)NC[C@@H]2CCn3ncc(C(=O)NC(C)C)c3C2)cc(C#N)n1C	803412687	LJVRIQWNNGFAFN-SHZLZMIXSA-N	433.516	1.826	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)c1ccc2c(=O)n(-c3ccccc3)c(O)nc2c1	804951620	VNIDOPRCVKJFQS-UHFFFAOYSA-N	440.423	1.824	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)N1CCC[C@@H](CN(C)S(C)(=O)=O)C1	805369221	PTBNHMRGVARFGU-KGLIPLIRSA-N	446.957	1.452	50	20	IDGD	
Cc1c(C(F)(F)F)nn(C)c1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	806420812	HVQVBSDQFVUQEL-UHFFFAOYSA-N	448.427	1.464	50	20	IDGD	
Cc1cc(F)ccc1S(=O)(=O)Nc1ccc(C(=O)NNC(=O)N2CCN(C)CC2)cc1	807380495	WJTBCBSHRGQXFG-UHFFFAOYSA-N	449.508	1.537	50	20	IDGD	
COC(=O)c1c(F)ccc(NC(=O)C(=O)NNC(=O)COc2cc(C)ccc2C)c1C	810385672	YLFBIYQXLUVIKH-UHFFFAOYSA-N	431.420	1.702	50	20	IDGD	
CCOCc1nc([C@@H](C)NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)no1	812563265	FGXHRIMECRRHNQ-MRXNPFEDSA-N	445.524	1.210	50	20	IDGD	
Cc1cc(=O)c(C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)nn1-c1ccccc1	812733604	YLHBOXCVIDDGGE-UHFFFAOYSA-N	427.486	1.548	50	20	IDGD	
CC1(C)NC(=O)N(c2cccc(NC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)c2)C1=O	812973915	MIOXAGVKPOJCJW-UHFFFAOYSA-N	426.389	1.896	50	20	IDGD	
CCOC(=O)c1ccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)nc1	814731761	IEFMLZWZCAPWKL-UHFFFAOYSA-N	446.485	1.118	50	20	IDGD	
N#C[C@@H](c1ccccc1)c1ccc(NC(=O)C(=O)NNC(=O)[C@H]2CCc3nncn3C2)cc1	815691396	OXLCYHWFJPYLNI-HKUYNNGSSA-N	443.467	1.282	50	20	IDGD	
C[C@@](O)(C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1)c1ccc(Cl)cc1	815734478	ISBZIZDJBBBIDD-IBGZPJMESA-N	439.921	1.712	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)C(=O)Nc2cnn(CC3CC3)c2)c1	815866964	WGJDXIABJTWZNW-UHFFFAOYSA-N	436.266	1.924	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)CCNS(=O)(=O)c1ccc(C(C)=O)cc1	871635513	FRIDTLKNBQMXJB-UHFFFAOYSA-N	447.513	1.346	50	20	IDGD	
Cn1ccc(C(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)cc1=O	912895665	IWJRYMGBRVIPSN-UHFFFAOYSA-N	429.436	1.218	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)C1=NN(c2ccccc2)[C@@H](c2ccccc2)C1	912995523	CJAKLVWTGNRHGC-VQIMIIECSA-N	426.498	1.576	50	20	IDGD	
CCOc1ccccc1C(=O)N1CCC[C@H]1C(=O)NNC(=O)[C@@H]1COc2ccccc2O1	914774742	IOAYOMHWHQMTJM-JXFKEZNVSA-N	439.468	1.677	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)NCCNS(=O)(=O)Cc2ccccc2)c1C	915182168	VSVIYQZNUYLHLC-STZFKDTASA-N	444.557	1.894	50	20	IDGD	
Cc1nn(-c2ccccc2)c2sc(C(=O)NNC(=O)N[C@H]3CCS(=O)(=O)C3)cc12	915880328	GTAZZRVNDHHHCC-LBPRGKRZSA-N	433.515	1.527	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)NC[C@@H](c2ccc(F)cc2)N2CCOCC2)c1	915898128	RVZOKFPJDNORTO-FQEVSTJZSA-N	446.479	1.860	50	20	IDGD	
COc1ccc([C@@H](CNC(=O)NNC(=O)COc2ccc(C#N)cc2)N(C)C)cc1OC	915898476	XUKMNAOKJDVTOS-GOSISDBHSA-N	441.488	1.588	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)cc1OC(F)F	916134310	JXNJGOKRJVLSLN-UHFFFAOYSA-N	442.444	1.973	50	20	IDGD	
CN(C)CCOc1ccc(CNC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1	916386464	VBJXJKTTZAZATN-UHFFFAOYSA-N	434.518	1.175	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)NCc2ccnc(N3CCN(C)CC3)c2)c1	916390201	NTCTYUOEQODDMK-UHFFFAOYSA-N	426.521	1.360	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)NCc2cccc(CN3CCCC3=O)c2)cc1C	916415029	IGQXZZUDEKYLLZ-UHFFFAOYSA-N	437.500	1.895	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(/C#N)C(=O)NS(=O)(=O)c2cc(C(N)=O)n(C)c2)c1C	916789271	RKOQHNFHRALDGY-BWADBZPLSA-N	447.517	1.162	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)NCC(=O)N(C)Cc2ccccc2)cc1	918090695	RRQZHZIXTGHEFA-MRXNPFEDSA-N	428.489	1.842	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)N(C)CC(=O)N[C@H]2CCS(=O)(=O)C2)c(C)n1CC(C)C	919747027	XJIORFAEZVYEGU-XSORJCKLSA-N	434.562	1.430	50	20	IDGD	
COc1ccc(OC)c(CCNC(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)c1	919790478	QBXSZOMJMRALFK-UHFFFAOYSA-N	437.522	1.654	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2N2CCOCC2)cc1	920011636	XACXHHNCRZBCTK-UHFFFAOYSA-N	428.445	1.834	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)N[C@H]1CCCN(S(C)(=O)=O)C1	920240204	MWBNZKHRKSVWBJ-AWEZNQCLSA-N	437.547	1.487	50	20	IDGD	
CN1C(=O)c2ccc(C(=O)OCC(=O)C(C#N)=C3N(C)c4ccccc4N3C)cc2C1=O	923524196	WSKPHMLGXBSKII-UHFFFAOYSA-N	430.420	1.960	50	20	IDGD	
CN(C)C(=O)c1cccc(CNC(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)c1	1116092833	ISVRKXMXHGXVIJ-UHFFFAOYSA-N	447.536	1.866	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)[C@@H]2CCCN2Cc2ccccn2)CC1	1318925522	XRAPSBFBFACRIQ-SFHVURJKSA-N	431.537	1.841	50	20	IDGD	
O=C(NNC(=O)c1n[nH]c2c1CCCC2)Nc1cc(N2CCCS2(=O)=O)ccc1F	1320411704	RNWRUICNEOSEBN-UHFFFAOYSA-N	436.469	1.434	50	20	IDGD	
CN(NC(=O)CCc1nc2cccnc2[nH]1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	1320430654	CFQRLNXCKVZJDY-UHFFFAOYSA-N	431.497	1.526	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)c1ccn(-c2ccccc2C(F)(F)F)n1	1321039160	FFWFNOUWLGVOAA-UHFFFAOYSA-N	432.362	1.477	50	20	IDGD	
Cn1ncc2cc(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)[C@H](O)CCl)C4)ccc21	1778703946	NCTXDEYQIKDWSD-DBXWQHBBSA-N	434.924	1.301	50	20	IDGD	
CC(C)/C=C/C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1	1779375378	MFNWUZMCPLGNOI-WREJSRDGSA-N	429.521	1.025	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(-c4cccnc4)[nH]n3)C2)C1	1779611858	WCPXRZRBXRVVLV-QRWLVFNGSA-N	433.896	1.169	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(Cl)ncn3)C2)C1	1779815729	HKCZIADPLTYDCY-ZBEGNZNMSA-N	431.718	1.605	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)CC34CCCN3CCC4)C2)C1	1781130562	BGCDSAHTUBTCND-UZLBHIALSA-N	442.398	1.866	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H]1Cc3[nH]nc(C(F)(F)F)c3C1)CCO2	1781220397	ZPUAWUBFZMFFCA-SUFBMKPHSA-N	448.873	1.991	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)C3(Br)CC3)C2)C1	1781347896	NLYFKZHSTWDMQJ-SMDDNHRTSA-N	438.160	1.917	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3c(F)ccc(OC)c3OC)C2)C1	1781820812	DYZCDYVTVWUTGP-ZUOKHONESA-N	444.887	1.540	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccnc(OC)c1)C2	1782175364	JKTVHOKBWIRJIF-RZQQEMMASA-N	425.913	1.472	50	20	IDGD	
O=C(O)c1cc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)C(Cl)Cl)C2)ncn1	1782216537	YPSXGIKDVOIESK-SJKOYZFVSA-N	431.276	1.106	50	20	IDGD	
C[C@H](C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Br)C2)n1cccn1	1782557919	MYDMHMPWWCCYJQ-VWPFQQQWSA-N	431.306	1.649	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)[C@@H](O)c3ccccc3)CCO2)C1	1783343932	XAOARCIYVPGEQF-JTDSTZFVSA-N	425.323	1.723	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](C)Oc1cccnc1)CCO2	1783353998	LAAZJBDDSZLTOE-URLQWDBASA-N	440.338	1.852	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)c(Cl)c1	1783938136	VOICBFLIRLDCOJ-NRFANRHFSA-N	436.940	1.465	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CCc4cccc(Cl)c43)C[C@@H]21)[C@@H](O)CCl	1784094764	RBJVKSTYLCLTEI-OIDVLUPKSA-N	441.355	1.949	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)CCCn3ccnc3)C2)C1	1784397675	VLNNNKSXBBFPIS-QAPCUYQASA-N	427.343	1.524	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3cccnc3OC)[C@H]2C1	1785313203	BBRWHFHCQHFLGC-XSLAGTTESA-N	439.940	1.256	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C[C@@H]3CNc4ccccc4O3)C[C@@H]21)[C@@H](F)Cl	1787446651	VDRCLOCQHIWJDR-HIQFYHPCSA-N	425.888	1.764	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Cl)C[C@@H]21)[C@@H]1ON=C(c2ccccc2)O1	1788519807	AGIPOJCPIHFNDP-CYBJUQQLSA-N	425.844	1.235	50	20	IDGD	
CCCC(=O)N[C@@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CO[Si](C)(C)C)C[C@@H]21	1788743265	MWBNNMJJTRMZLL-QAETUUGQSA-N	427.618	1.122	50	20	IDGD	
COc1ccccc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21	1789464537	UOGJYJQGUFHXER-MZGVZZPPSA-N	429.286	1.979	50	20	IDGD	
COc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Cl)C[C@@H]32)cc1N(C)C	1789817344	RQJMFLAFGGOEDC-DFEHZGFQSA-N	427.904	1.889	50	20	IDGD	
Cc1cc(F)cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]32)c1	1790038456	GPUCWQBRDZOWCQ-SNRMKQJTSA-N	434.512	1.100	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ncc(Cl)cn3)C[C@@H]21	1790961589	QNCSKIUXGQGQJZ-PYJNHQTQSA-N	445.745	1.897	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CSc3ccncc3)C[C@@H]21	1791057847	YJEPVPGCZGYTQB-SDADXPQNSA-N	442.379	1.937	50	20	IDGD	
CC(C)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/C(=O)NCc1ccco1)C2	1792783354	UWDAECVBINNYBW-RKLKBWSTSA-N	437.924	1.307	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnnc3ccccc13)C2	1792868097	PPEPTBYXJHUEGL-FLTUCWPJSA-N	447.333	1.864	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cccnc1Cl)C2	1792868649	IQYBIZOCRDOWFT-ZIEJDFEHSA-N	444.757	1.898	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C/N=C/c1ccco1)C2	1792870882	LYPNTIPUDMWWCK-UEDKOZLFSA-N	426.311	1.319	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ncn(-c3ccccc3)n1)C2	1793449691	JVNULVOXXIDXHJ-CYGHRXIMSA-N	431.924	1.878	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CC(=O)N(C2CCCC2)C1	1793775395	GKBRQTZSVASSEU-XYKCEAJKSA-N	439.984	1.775	50	20	IDGD	
Cc1cc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)CBr)C3)ccn1	1793910779	VOJKBCDTKXQSQQ-KUZCPNRJSA-N	438.366	1.943	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnn(C(C)(C)C)c1	1794348328	WRWNNFKSELREJF-DMRZNYOFSA-N	441.370	1.872	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](Br)Cc1ccccc1)C2)c1ncc[nH]1	1794503428	YKYWJCTUGKZLTO-YYIAUSFCSA-N	447.333	1.619	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](Br)Cc1ccccc1)C2)c1ccno1	1794741247	NGCGGTQKLJXXCN-KYHPRHEASA-N	448.317	1.884	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)c1ncccc1C(F)(F)F	1796188837	TYNIGFRXQOJFMB-MUJYYYPQSA-N	447.222	1.346	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnoc1COC	1796688701	WGWLCJJVHQPLOT-WJNVRWDZSA-N	430.299	1.198	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@](C)(O)C[C@H]1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](F)Cl	1796810228	KHFFJSZLIJKPEU-KNJMQODFSA-N	447.935	1.919	50	20	IDGD	
C[C@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CO[Si](C)(C)C)C2)N1CSCSC1	1797844566	CTSQNDVDFQAWLZ-PNBKFKSVSA-N	447.699	1.471	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)c1cnc(-c2ccccc2)s1	1798253472	AVTQUSPYFSJBEX-IVSAIRAKSA-N	435.933	1.613	50	20	IDGD	
CCOc1ncccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnccc1C(=O)NN	1798439719	CGZPFGAURNQADQ-QDMKHBRRSA-N	438.488	1.044	50	20	IDGD	
COc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCBr)C3)ccc1C	1798970417	YNXYBOYTUDDTTM-JLVBRIDZSA-N	425.323	1.992	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3ccccn3n1)C2	1799274975	FUWWOJHRNBSELE-AODNKKSCSA-N	425.316	1.774	50	20	IDGD	
Cc1cccc(C)c1NC(=O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2	1799283485	GPDWZTBSKGLILE-AGGWBTHJSA-N	428.316	1.635	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(Cl)c(O)cc1O	1799445125	CYKHHDXUHWHSSB-SKILGCBUSA-N	433.288	1.208	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(CC#N)cc1	1799639160	KOQTWZJOUZCYJG-NKGKWGDASA-N	434.334	1.987	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc3ccnn13)C2	1800643353	QYPISQYRXIVOEZ-IARIHHJXSA-N	435.322	1.711	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2	1800760046	YNOYRKWIQRYWQN-GCDPNZCJSA-N	447.713	1.738	50	20	IDGD	
COc1nc(C)ccc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)Br	1800760394	MWFAODXMHINGHJ-XPCVCDNBSA-N	426.311	1.385	50	20	IDGD	
COC(=O)c1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C(Cl)Cl)c(C)c1	1801021063	HGJNHDMYUFKBIO-AGGWBTHJSA-N	429.300	1.789	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCc1ccc(N(C)C)cc1	1801194590	CKSVFQVIRNKIAG-NZGUISNBSA-N	437.968	1.529	50	20	IDGD	
O=C(Cn1ccnn1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](Br)Cc1ccccc1	1801567898	OWFATPWHJBOPQN-MHORFTMASA-N	446.349	1.923	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1n[nH]c3cccc(F)c13)C2	1802338585	PVRKCNRPTNTARY-BTTYYORXSA-N	430.484	1.327	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)CCN2C(=O)C=CC2=O)[C@@H]1c1cccnc1	1803920188	UOQYACXLSWIXIM-GUXCAODWSA-N	432.908	1.420	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H](CNC(=O)Cc2cncnc2)[C@H]1c1cccnc1	1804649269	QJIOGLHIRFXRDV-WIYYLYMNSA-N	427.581	1.972	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)c2cccnc2)[C@@H]1c1cccnc1	1805465950	YTGBTEALMMHPPJ-JXFKEZNVSA-N	445.483	1.109	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@H](CNC(=O)CN)[C@@H]1c1cccnc1	1807036917	OJJMEZGFPKWMMW-YWZLYKJASA-N	441.444	1.193	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)CC(F)(F)C(=O)O)[C@@H]1c1cccnc1	1808295129	RODQEOLEWPQEJK-SUHUHFCYSA-N	448.264	1.981	50	20	IDGD	
Nc1c(C(=O)N2CCCC3(CCN(C(=O)[C@@H](O)CCl)CC3)C2)sc2nccnc12	1809924295	RNYVDNZIRWMOJV-LBPRGKRZSA-N	437.953	1.718	50	20	IDGD	
Cc1c(F)cccc1C(=O)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1	1809978283	YVJTUBCMZLMEOI-UHFFFAOYSA-N	438.308	1.973	50	20	IDGD	
CCc1cc(C(=O)NC[C@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)no1	1811002622	UVYNKKPFWIQUOK-IERDGZPVSA-N	442.520	1.325	50	20	IDGD	
CCC(C)(C)C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1	1812611542	VDDLGFDAJKKGTG-QFBILLFUSA-N	438.532	1.836	50	20	IDGD	
CN(CC(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](O)CCl)n[nH]1)C(=O)c1ccccc1	1814865001	VKEOMYASIRQVBN-DLBZAZTESA-N	447.923	1.774	50	20	IDGD	
Cc1nc(CC(=O)Nc2cc([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)cs1	1815893106	SPDQBZQCUGYSKI-INIZCTEOSA-N	447.565	1.782	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnc[nH]2)n[nH]1	1816419471	WOTJKXAOERRTSR-YEEYNWEUSA-N	437.464	1.573	50	20	IDGD	
Cc1ccc(CC(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)cc1	1816943546	GLHSISCGCFLDAN-NRFANRHFSA-N	446.316	1.947	50	20	IDGD	
C[Si](C)(C)OCC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnc(O)nc2O)[nH]n1	1819593969	UMFMDILTULYJBM-CYBMUJFWSA-N	434.529	1.768	50	20	IDGD	
O=C(/C=C1\C(=O)Nc2ccccc21)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)CCl)CC2	1819617513	FVHHVVDBLJBOCE-QHOAREFQSA-N	446.916	1.691	50	20	IDGD	
CCNC(=O)N[C@@H](C)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCBr)CC2	1819684619	JDLAICIOKQJAPX-VHSXEESVSA-N	446.371	1.548	50	20	IDGD	
CCCC(=O)N[C@H](C)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](Cl)COC)CC2	1820120353	WUUPCAKQCWWUPO-IJLUTSLNSA-N	430.958	1.614	50	20	IDGD	
Cc1ccc(O)c(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)CCC(=O)NN(C)C)CC3)c1	1821990872	OWTVTQNKHSJZAV-CYBMUJFWSA-N	445.545	1.756	50	20	IDGD	
CNC(=S)NCCC(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](C)Br)n[nH]1	1822188943	LVVVAVYYWXUSDH-JQWIXIFHSA-N	445.387	1.669	50	20	IDGD	
CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](F)Cl)[nH]n1	1822701321	FPYPANYDWVWQPU-IJEWVQPXSA-N	439.879	1.407	50	20	IDGD	
Cn1c(C(=O)N[C@@H]2CCc3nc(NC(=O)[C@H](F)Br)sc3C2)cccc1=O	1823001335	CUKHVAJBMAKUQM-OQPBUACISA-N	443.298	1.758	50	20	IDGD	
CN1C(=O)CC[C@H]1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](F)Br)CC2	1823051224	GSSYQHAILQDLTO-DXBFQKDVSA-N	433.303	1.366	50	20	IDGD	
CC[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H]1CCC(=O)N1)CC2	1825445250	QORJBGJQLPWDAA-IQJOONFLSA-N	429.340	1.507	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)C1CC(F)(F)C1)CC2	1826081026	MKCSNMNGXLIKJC-LLVKDONJSA-N	429.493	1.473	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)C2=COCC2)CC1	1828926084	YCOHALUVRSXDBQ-LJQANCHMSA-N	427.505	1.223	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(F)nc2)CC1	1829193727	FUTBXDFTWQIABE-GOSISDBHSA-N	433.528	1.827	50	20	IDGD	
COc1cccc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)c1	1830358362	AWHLDZPYLDZOSH-QFIPXVFZSA-N	438.952	1.959	50	20	IDGD	
Cc1noc(C)c1CC(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830358461	ODVZGPUWICWSAA-FQEVSTJZSA-N	427.929	1.555	50	20	IDGD	
CCn1nccc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2	1830537601	KZUXFEZYAVAXAD-KSSFIOAISA-N	443.342	1.004	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ncccc3F)C2)C1	1830542680	BIVJBEZCASPIDL-UGSOOPFHSA-N	444.301	1.322	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)Cn3ccnc3)C2)C1	1831660178	ZLDZYAUXKQUARA-FUHIMQAGSA-N	426.945	1.383	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2n[nH]cc2[N+](=O)[O-])CC1	1831830982	KYMURTWCUIBKOV-KGLIPLIRSA-N	427.889	1.805	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)CC[C@H]2CCOC2)CC1	1831876933	NCEGAILXHOJYKK-ICSRJNTNSA-N	436.597	1.796	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)CCCc3ccncc3)CC2)CC1)[C@H](O)CCl	1833308299	QFZLHNZTHOHFFU-HXUWFJFHSA-N	436.984	1.576	50	20	IDGD	
COC[C@@H](C)C(=O)NC1CCN(C2CCN(C(=O)[C@H](C)CBr)CC2)CC1	1833522981	IKLPRZBQXSUTDZ-HUUCEWRRSA-N	432.403	1.872	50	20	IDGD	
Cc1noc(C)c1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1	1834069048	REKILENUKOCBDE-ROUUACIJSA-N	434.320	1.598	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(C=O)s3)CCO2)C1	1835947705	OSZCMRSAZLDBKS-SJCJKPOMSA-N	445.335	1.414	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3cc(F)cc(F)c3)CCO2)C1	1836123458	UXRKKWJRGTXNGN-FXAWDEMLSA-N	446.878	1.218	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCC(N2CCC(NC(=O)c3cc(CO)on3)CC2)CC1	1836186381	KKVQDABOKKKSAS-UHFFFAOYSA-N	426.945	1.617	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC(OC2CCN(C(=O)CN3CCOC3=O)CC2)CC1	1836786478	NWMLFLIMPHWPOK-UHFFFAOYSA-N	441.601	1.289	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3ccc(O)cn3)CC2)CC1	1837586578	FVGXCLFQSGPVFA-QGZVFWFLSA-N	425.913	1.653	50	20	IDGD	
CCn1nc(C(=O)N2CCOC[C@@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)cc1C	1837715234	DHJUGSDTNMENSI-HXUWFJFHSA-N	438.601	1.133	50	20	IDGD	
Cc1nnc(CC(=O)N2CCC(OC3CCN(C(=O)[C@@H](F)Br)CC3)CC2)o1	1837939400	DNSYWSBIBZJSFC-MRXNPFEDSA-N	447.305	1.610	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)c(C)n1C	1838385184	DUPBKNCRHHPIJA-NRFANRHFSA-N	437.613	1.563	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)N1CCC(OC2CCN(C(=O)[C@@](C)(Cl)CCl)CC2)CC1	1838427817	IISGEAJRCGVZNW-VLIAUNLRSA-N	448.391	1.912	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)[C@@]3(C)CCCN3)CC2)CC1	1838632597	FCNYHJBBAKMEFP-AUUYWEPGSA-N	430.387	1.911	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CC[C@H](O)CC3)C2)C1	1839155301	QIAUABPQNDLKRG-OHDICMOHSA-N	437.364	1.230	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccccc3C(N)=O)CCO2)C1	1839349613	GTCBXKFFFAWNEO-LAUBAEHRSA-N	437.924	1.263	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3F)C2)C1	1839964684	YZUOXBPTKSBDEB-RDTXWAMCSA-N	444.301	1.464	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cncnc3C)C2)C1	1839965994	RCTPQANGLUXJEQ-MAUKXSAKSA-N	441.326	1.029	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C(C)=C/c3cccs3)C2)C1	1840149773	ZQCHULTVZUGTFF-NNFIISAESA-N	442.965	1.862	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(C)cnc3Cl)C2)C1	1840151263	ZCNMCXSVGBTUQV-KXBFYZLASA-N	446.331	1.367	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)c3cccs3)C2)C1	1840156535	USCVGRJKGOPNEU-ZRGWGRIASA-N	430.954	1.562	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1C[C@@]1(F)Cl)CCO2	1840242293	OJYHFYPOOMLCCH-MPTQWLOMSA-N	441.725	1.398	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)Oc1ccccn1)CCO2	1840422717	IBRBGUVURWSQOQ-LLGFUMIMSA-N	439.940	1.713	50	20	IDGD	
O=C(c1c(C(F)(F)F)nc2ccc(F)cn12)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1	1841353474	ZWYMMECAEJTWGT-LLVKDONJSA-N	448.804	1.909	50	20	IDGD	
CC[C@H](C)[C@@H](O)C(=O)N1CCCC12CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2	1841635277	MPJRQAVOHWTERB-SCLBCKFNSA-N	433.461	1.744	50	20	IDGD	
CC[C@H](C)[C@@H](N)C(=O)N1CCCC12CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2	1842894243	LGCXIHPBKVXXFS-SCLBCKFNSA-N	432.477	1.711	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)c2nn(-c3ccccc3)c3c2COC3)C1	1843228750	WDRBBWUBPDZTBO-KRWDZBQOSA-N	444.919	1.973	50	20	IDGD	
Cc1snc2sc(C(=O)N3CCCC34CN(C(=O)CCC(=O)NN(C)C)C4)cc12	1843243206	KTFHJXOSYDVVGG-UHFFFAOYSA-N	435.575	1.856	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)c2ccncc2C(F)(F)F)C1	1843532697	ZZYINNIIEANKSQ-UHFFFAOYSA-N	427.427	1.290	50	20	IDGD	
O=C([C@H](Br)Cc1ccccc1)N1CC2(CCCN2C(=O)c2cnc(O)[nH]2)C1	1844505128	WAWNJXTYHIKZBM-CQSZACIVSA-N	433.306	1.939	50	20	IDGD	
CCN(C)[C@@H](C)C(=O)N1CC2(CCCN2C(=O)c2cc([N+](=O)[O-])ccc2OC(C)=O)C1	1844693311	QODVKGZTDBZTML-AWEZNQCLSA-N	432.477	1.677	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)c1c(Cl)ccc3c1OCO3)C2	1846384828	OGKGWBYOPQWZQK-UHFFFAOYSA-N	436.896	1.259	50	20	IDGD	
Cc1cc2nc(C(=O)N3CC4(CCCN4C(=O)CCC(=O)NN(C)C)C3)[nH]c2cc1C	1846385004	KBAKHRBPMKRGOU-UHFFFAOYSA-N	426.521	1.370	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(Cn3cccn3)cc2)c1	14326339	TUMJIPKLKAWWJL-UHFFFAOYSA-N	427.486	1.257	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1F)c1cccc(S(=O)(=O)N2CCOCC2)c1	15424948	WUNKUMVICNSSFS-UHFFFAOYSA-N	441.868	1.575	50	20	IDGD	
COc1ccc(/C=C/C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1OC	15902094	JJIPJWIDQCAFLE-XYOKQWHBSA-N	447.513	1.494	50	20	IDGD	
COc1cc(NC(C)=O)c(C(=O)OCC(=O)NNC(=O)c2ccc(C)cc2)cc1OC	23937871	HQOSODXNEOKYLS-UHFFFAOYSA-N	429.429	1.589	50	20	IDGD	
O=C(NC[C@H](O)c1ccc(Cl)cc1)NNC(=O)c1csc(N2CCOCC2)n1	29334806	XQYNDJOJCWTCIL-AWEZNQCLSA-N	425.898	1.311	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)CNC(=O)c2ccco2)ccc1OCc1cccnc1	725741042	MEFARDAXJCIOEM-UHFFFAOYSA-N	438.440	1.843	50	20	IDGD	
CC(C)COC(=O)N1CCC(C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)CC1	726157592	UIJITTWPSDDIOV-UHFFFAOYSA-N	429.477	1.199	50	20	IDGD	
O=C(NNC(=S)NC1CCOCC1)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	727780487	MROAUHVAXCSHFD-UHFFFAOYSA-N	437.529	1.676	50	20	IDGD	
Cc1c(C(=O)N([C@H]2CCS(=O)(=O)C2)N(C)C)sc2nc3n(c(=O)c12)CCCCC3	728180139	PFRJCXSYVNDYEN-ZDUSSCGKSA-N	438.575	1.599	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1ccc(OC[C@@H]2CCCO2)cc1	728848287	KPHLFXBWOALFRH-IBGZPJMESA-N	425.489	1.712	50	20	IDGD	
O=C(NCC(=O)N1CCCc2ccccc21)NNC(=O)C1CCN(c2ncccn2)CC1	728950440	OSRGNQCGYQBSKB-UHFFFAOYSA-N	437.504	1.003	50	20	IDGD	
COc1cc(C)c(CN(C)C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1OC	728958577	AGEDEXQJZSUHJO-UHFFFAOYSA-N	442.520	1.891	50	20	IDGD	
CC[C@H](N=c1nn[nH]n1-c1ccccc1)C(=O)NNC(=O)[C@@H](C)Oc1ccc(F)cc1	729281787	DNOZWHVEDSOCKQ-DYVFJYSZSA-N	427.440	1.029	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)c2ccc(F)c(S(=O)(=O)NC3CC3)c2)cn1	729692783	QNBZGOIMRKMSLA-UHFFFAOYSA-N	439.494	1.301	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)c1ccc(N2C(=O)CCC2=O)cc1	730075355	MLFQIAGIMMVHEU-UHFFFAOYSA-N	428.470	1.538	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)N(C)CC(=O)N1c2ccccc2NC(=O)C[C@@H]1C	731500027	XINXWIFJEUASPZ-AWEZNQCLSA-N	439.472	1.745	50	20	IDGD	
O=C(CCS(=O)(=O)c1ccc2c(c1)OCCO2)NNc1nc(-c2ccncc2)no1	732067651	GRANTTQLIJWCJT-UHFFFAOYSA-N	431.430	1.210	50	20	IDGD	
C[C@@]1(NNC(=O)N[C@@H]2CCN(c3ccccc3Br)C2)CCS(=O)(=O)C1	732476174	AFLHVGLNIMNBDX-MLGOLLRUSA-N	431.356	1.409	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)NNC(=O)N[C@H](Cc1ccccc1)CN1CCOCC1	732476198	AMLVQHHTRCBTBC-HXUWFJFHSA-N	435.528	1.984	50	20	IDGD	
NC(=O)c1ccccc1N1CC[C@H](NC(=O)NNC(=O)c2cccc(OC(F)F)c2)C1	732573730	XVIWDGJHQBPMJP-ZDUSSCGKSA-N	433.415	1.610	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2ccccc2OC(F)F)CC1	735117948	JWJOAKNBKXBASU-UHFFFAOYSA-N	441.460	1.376	50	20	IDGD	
O=C(CCSc1ccc2c(c1)OCCO2)NNC(=O)c1ccc(-n2cnnn2)cc1	737767715	FFSMSWMTNCCDEG-UHFFFAOYSA-N	426.458	1.377	50	20	IDGD	
CN(C)c1nccc(NNC(=O)C2CCN(S(=O)(=O)c3cc(F)ccc3F)CC2)n1	740104420	KMUKMXSJTFJHLU-UHFFFAOYSA-N	440.476	1.365	50	20	IDGD	
CC(C)(C)OC(=O)N(CC(=O)NNC(=O)[C@@H]1COc2ccccc2O1)C[C@H]1CCCO1	741882702	KPQOHWFPOFIVTL-PBHICJAKSA-N	435.477	1.390	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)c2cn([C@@H]3CCS(=O)(=O)C3)nc2C(C)C)c1	742473028	ZMXIPPCVEJLFEG-MRXNPFEDSA-N	448.545	1.823	50	20	IDGD	
Cc1ccc(CN2C(=O)CC[C@@H]2C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc1	743292195	AWZXUPFWYMLYIV-GOSISDBHSA-N	433.468	1.839	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2ccc(Cl)cc2O)cc(NS(C)(=O)=O)c1OC	743318044	WDKJEFGDBJVDMU-UHFFFAOYSA-N	443.865	1.509	50	20	IDGD	
CC(C)(C)OC(=O)NCCOCC(=O)NNC(=O)c1cc(Br)ccc1O	743733720	QENYOKOPAODRMH-UHFFFAOYSA-N	432.271	1.457	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2ccc(CN3C(=O)CCC3=O)cc2)cc1	743830619	IIYGBCYXSILUJW-UHFFFAOYSA-N	444.469	1.206	50	20	IDGD	
CCn1c(=O)c(=O)[nH]c2cc(C(=O)NNC(=O)Nc3ccc(OC(F)F)cc3)ccc21	743832613	OWDBKJUVBKEBFY-UHFFFAOYSA-N	433.371	1.778	50	20	IDGD	
Cc1ccc(/C=C(/C#N)C(=O)O[C@@H](C)C(=O)NCCc2ccc(S(N)(=O)=O)cc2)cc1	744502059	MQCYUBVEVOMBIQ-UEIJICEPSA-N	441.509	1.840	50	20	IDGD	
Cc1cccc(F)c1CNC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	745889106	DCINUMVDGULORS-UHFFFAOYSA-N	436.513	1.292	50	20	IDGD	
CC(=NNC(=O)C(=O)NN=C(C)c1ccc([S@](C)=O)cc1)c1ccc([S@](C)=O)cc1	746365696	AWBBRAJYYTXZQN-KYJUHHDHSA-N	446.554	1.542	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(N2CCCCC2)c(C(=O)NNC(=O)c2cccn2C)c1	747598408	RGMBVNPWZNSUKG-UHFFFAOYSA-N	433.534	1.341	50	20	IDGD	
COCCCN1C(=O)C(=NNC(=O)[C@@H](C)OCCOC)c2cc(Br)ccc21	748259971	ZZGFWQKGGYAIKZ-GFCCVEGCSA-N	442.310	1.704	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(OCC(=O)NNC(=O)c2ccc(F)cc2Br)C1	748524654	OFBXBILABOEKDZ-UHFFFAOYSA-N	446.273	1.985	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)NCCCNC(=O)C2CCC2)cc1Cl	749115738	KBWRDSPKRGGOIM-UHFFFAOYSA-N	427.889	1.999	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2N)c1	749323997	NAVABZWVURDWGL-UHFFFAOYSA-N	435.462	1.282	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)[C@@H]2CCCN(C(=O)[C@@H](C)CC)C2)c2ccccc2c1=O	751052903	BLTZADCSOINDNH-JKSUJKDBSA-N	441.532	1.852	50	20	IDGD	
O=C(CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])NNC(=O)CNC(=O)c1ccco1	751204171	FEGHEYRVCDIBOI-UHFFFAOYSA-N	443.338	1.586	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2ccc(OCCCOC)nc2)c2ccccc2c1=O	751295431	ZGICJWPXJZTDFJ-UHFFFAOYSA-N	425.445	1.302	50	20	IDGD	
C/C(=C\C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1)c1ccc([N+](=O)[O-])cc1	752351757	RGMSDWRPZWDTCH-LVMGUKCRSA-N	441.396	1.529	50	20	IDGD	
C[C@H]1CCN(c2cc(C(=O)OCC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)ccn2)C1	752600786	AFMWRCAPXGVRAF-ZDUSSCGKSA-N	427.417	1.454	50	20	IDGD	
C[C@@H]1Cc2cc(C(=O)NNc3nc4ccccc4c(=O)n3C)ccc2N1S(C)(=O)=O	752902069	IDKJKDFNFXUNDE-GFCCVEGCSA-N	427.486	1.401	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)N[C@@H]3CCC[C@H]4CN(Cc5ccccc5)C[C@@H]43)nc21	753317649	XAHDRTYCKQDGBH-RYQLBKOJSA-N	436.520	1.996	50	20	IDGD	
O=C(CCNS(=O)(=O)c1cccc([N+](=O)[O-])c1)NNc1ccc(-c2ccccc2)nn1	754472675	YOVGXAAOAKUQFB-UHFFFAOYSA-N	442.457	1.864	50	20	IDGD	
O=C(Nc1ccccc1S[C@H](Cl)C(F)(F)F)C(=O)N1CCN(CCO)CC1	755311178	ZAWGGQIYNGXXOX-HNNXBMFYSA-N	425.860	1.981	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2cc(C(=O)NC)ccc2OC)c2ccccc2c1=O	755918679	HWXRHGBTXQRULK-UHFFFAOYSA-N	438.444	1.251	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1cccc(C(=O)Nc2cccc(F)c2)c1	756090112	ZINJQCPVPYQRJK-NSHDSACASA-N	437.453	1.168	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)cc1-n1nnnc1C	756318440	HXCMKCAVSHRQLS-NSHDSACASA-N	429.412	1.739	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)Nc1ccc(F)c(N2CCCS2(=O)=O)c1	756493957	BPZWWWOUJAAGNL-UHFFFAOYSA-N	447.448	1.469	50	20	IDGD	
CS(=O)(=O)CCn1ccc(NC(=O)NNC(=O)c2cc(F)ccc2Br)n1	756760790	NZGGCFBSVLPRBK-UHFFFAOYSA-N	448.274	1.296	50	20	IDGD	
Cc1nccc(NCc2cccc(C(=O)NNC(=O)CCN3C[C@H](C)O[C@H](C)C3)c2)n1	757716255	TXBUHXXYYSAEBH-IYBDPMFKSA-N	426.521	1.657	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2nnc(O)c3ccccc23)cnn1CCO[C@@H]1CCCCO1	758072331	RRGNUGQTWIMSBC-QGZVFWFLSA-N	440.460	1.458	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)C(C)(C)C)n([C@@H]2CCN(Cc3ccccc3)C2)n1	761063169	CDSPWIGCHJUDQV-QGZVFWFLSA-N	426.521	1.771	50	20	IDGD	
COc1cc(F)c(S(=O)(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)cc1OC	763439437	PBPYWNKRLKRHPG-UHFFFAOYSA-N	435.474	1.457	50	20	IDGD	
O=C1CSc2ccc(NC(=O)C(=O)NNC(=O)c3cc4ccccc4cc3O)cc2N1	763526877	KYPHUVWOUVSDIY-UHFFFAOYSA-N	436.449	1.989	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2c[nH]c3ccccc23)cc1	763539204	KALDUXQBGFSOMS-UHFFFAOYSA-N	429.458	1.329	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2ccnn2-c2cccc(Cl)c2)c1	763623358	KESBAJJNUQBKKH-UHFFFAOYSA-N	427.848	1.999	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(N3C[C@@H](C)O[C@H](C)C3)nc2)c1	763629687	GKFDGTQTUZQQSO-HZPDHXFCSA-N	441.488	1.169	50	20	IDGD	
COCCOc1ccc(F)cc1NC(=O)C(=O)NNC(=O)COc1cc(C)cc(C)c1	763644908	OQINUUKJEWTFGL-UHFFFAOYSA-N	433.436	1.633	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2ccc(O[C@@H]3CCOC3)cc2)c1	763665089	DLUIQNAJFWLZLN-GOSISDBHSA-N	427.457	1.636	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccc(NC(C)=O)c1C	763680881	CCKWKXJGKXSZOE-UHFFFAOYSA-N	428.445	1.517	50	20	IDGD	
CCc1nnc(-c2cccc(NC(=O)C(=O)NNC(=O)COc3ccc(C#N)cc3)c2)o1	763681625	WPHVKIFNKKQXQP-UHFFFAOYSA-N	434.412	1.336	50	20	IDGD	
O=C(NNC(=O)c1cc2c(s1)CCC2)C(=O)Nc1cc2c(cc1[N+](=O)[O-])OCCCO2	763782179	PPLDGAZFPVPERC-UHFFFAOYSA-N	446.441	1.706	50	20	IDGD	
COc1ccc(Br)c(NC(=O)C(=O)NNC(=O)COc2ccc(C)cc2)c1	763808785	FVZYQJXBAFLKBN-UHFFFAOYSA-N	436.262	1.931	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cccc(-n3cnnn3)c2C)c1C	763839412	GPWZJCDPBUWHGI-HNNXBMFYSA-N	437.460	1.141	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)C(=O)Nc1cc(C(N)=O)ccc1F	763851607	DVDSYHYCBFFOQX-LBPRGKRZSA-N	438.415	1.631	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccnn1CCc1ccccc1	763864409	IMVRHNLNTNJTMC-OAHLLOKOSA-N	439.447	1.818	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(OC)c(OC)cc2F)cc1OC	763902672	OJASFKOEGRCRES-UHFFFAOYSA-N	435.408	1.650	50	20	IDGD	
O=C(NNC(=O)c1cc(Cl)ccc1O)C(=O)Nc1cccc(CN2CCCC2=O)c1	763973501	AJJSPFIBSHVRHE-UHFFFAOYSA-N	430.848	1.568	50	20	IDGD	
CCS(=O)(=O)c1cc(F)ccc1NC(=O)C(=O)NNC(=O)c1cc(Cl)ccc1O	763979283	SQCXSVSFTVCWFE-UHFFFAOYSA-N	443.840	1.378	50	20	IDGD	
CCCN1Cc2cccc(NC(=O)C(=O)NNC(=O)c3cc(Br)cn3C)c2C1	764005144	VOQVFKBVZGGMSV-UHFFFAOYSA-N	448.321	1.913	50	20	IDGD	
O=C(NNC(=O)c1cccc(Br)c1)C(=O)Nc1ccc(C(=O)NC2CC2)cc1	764058550	KEUASJLEZHJLSR-UHFFFAOYSA-N	445.273	1.741	50	20	IDGD	
O=C1CSc2ccc(NC(=O)C(=O)NNC(=O)c3cccc(Br)c3)cc2N1	764062998	IPFDEQGAUYZJON-UHFFFAOYSA-N	449.286	1.893	50	20	IDGD	
O=C(NNC(=O)C1CCCC1)C(=O)Nc1ccnn1Cc1cccc(Br)c1	764069586	YEUMUUAXVRLFMJ-UHFFFAOYSA-N	434.294	1.970	50	20	IDGD	
CC(C)(C)n1cc(NC(=O)C(=O)NNC(=O)c2ccc(F)cc2Br)cn1	764086283	QCGAFLKJJORBAR-UHFFFAOYSA-N	426.246	1.939	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ncn(C4CCCCC4)n3)n[nH]2)cc1	764110465	KCMCUKQQBRWZNO-UHFFFAOYSA-N	436.476	1.882	50	20	IDGD	
CCn1nnnc1-c1cccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)c1	764126270	GQYOAXMOSXBKHF-UHFFFAOYSA-N	429.824	1.119	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1cccc(-c2noc(C3CC3)n2)c1	764135577	IWZOGLRUWAAZPV-UHFFFAOYSA-N	435.440	1.951	50	20	IDGD	
COCc1c(Br)cccc1NC(=O)C(=O)NNC(=O)[C@H]1Cc2ccccc2O1	764155303	XXZBRBAWWRWSST-MRXNPFEDSA-N	448.273	1.685	50	20	IDGD	
CN(C)CCn1c(=O)oc2ccc(NC(=O)C(=O)NNC(=O)CCC3CCCCC3)cc21	764215578	ZNWVSOFRYKMNAH-UHFFFAOYSA-N	445.520	1.603	50	20	IDGD	
Cc1cccc(NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)c1C(=O)N1CCCC1	764243319	SPWCNKDEHLLGMV-UHFFFAOYSA-N	447.495	1.972	50	20	IDGD	
CC(C)(C(=O)NNC(=O)C(=O)Nc1cccc(N2CCCS2(=O)=O)c1)c1ccccc1	764302565	NPFKTCOYFBAYHS-UHFFFAOYSA-N	444.513	1.290	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)C[C@@H](C)O1	764319421	DYLHBJLKBXRSNL-LMMKCTJWSA-N	432.521	1.434	50	20	IDGD	
CCOC(=O)c1cc(F)c(F)cc1NC(=O)C(=O)NNC(=O)c1ccc(O)c(Cl)c1	764349978	VVHHWVSNNMINKH-UHFFFAOYSA-N	441.774	1.900	50	20	IDGD	
Cc1cc(C)n(-c2ccc(NC(=O)C(=O)NNC(=O)c3cnn(-c4ccccc4)c3)cn2)n1	764350718	IWXCDCHHTBVXPJ-UHFFFAOYSA-N	444.455	1.470	50	20	IDGD	
Cc1cc(C)n(-c2ccc(NC(=O)C(=O)NNC(=O)COCc3ccccc3)cc2F)n1	764366344	AEVJFSKTNYBXEO-UHFFFAOYSA-N	439.447	1.931	50	20	IDGD	
C[C@@](O)(CNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)c1ccccc1Cl	765242555	FEKLFJGDHBBENB-HXUWFJFHSA-N	432.912	1.585	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)C1CCN(C(=O)c2cccnc2)CC1	765322307	IRUBPWFGIQRIII-UHFFFAOYSA-N	433.509	1.386	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)C3C(C)(C)C3(C)C)CC2)cc1	765730798	XMAGXIPCZJKVMA-UHFFFAOYSA-N	436.578	1.131	50	20	IDGD	
COc1ccc(Cl)cc1CC(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765734018	UOMYDHFZDNAPPD-UHFFFAOYSA-N	444.919	1.497	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3ccc(OC(C)C)nc3)CC2)cc1	765754783	NHSDEYMIFHQTKC-UHFFFAOYSA-N	425.533	1.756	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1cnc2c(c1)CN(C(=O)OC(C)(C)C)CC2	766261414	YGJZBYITGAICMB-UHFFFAOYSA-N	443.464	1.255	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1ccc(C(=O)N2CCCC[C@@H]2C)cc1C	766264052	DKQYKWLYEIYCPV-AWEZNQCLSA-N	426.477	1.890	50	20	IDGD	
Cc1cc(C)n([C@H](C)CC(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)n1	766642860	NRAFUUUTYUEMPQ-GOSISDBHSA-N	426.521	1.056	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NN=C(C)CCCCO)N(S(C)(=O)=O)CC2	766688851	BAIPMSYICDYSND-KRWDZBQOSA-N	441.550	1.607	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1	766880085	JGTYHWXDAOYJEL-INIZCTEOSA-N	445.545	1.618	50	20	IDGD	
CSCCNC(=S)NNC(=O)[C@H]1CC(=O)N(c2ccccc2Br)C1	769770837	ZHXQAAXQPOGJGT-JTQLQIEISA-N	431.381	1.660	50	20	IDGD	
CCN(C(=O)[C@H](C)OC(=O)[C@@]12CC[C@@H](C[C@@H]1Br)C2)[C@@H]1CCS(=O)(=O)C1	769983210	UGBLUTRROCVUAU-JEJJNBGPSA-N	436.368	1.907	50	20	IDGD	
COc1cccc(NC(=O)C(=O)NNC(=O)COc2ccc(Br)cc2)c1F	770774516	OYDMQFCEBZEKFJ-UHFFFAOYSA-N	440.225	1.762	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)/C(=C\c3ccco3)n3nnnc3-c3ccccc3)nc21	770981747	BPHQLRMTEFKJKM-XNTDXEJSSA-N	444.415	1.457	50	20	IDGD	
CCC(CC)n1nccc1C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	771011732	JGFAFDOCTLISNE-UHFFFAOYSA-N	434.566	1.937	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)N2CCC3(CC2)CC(C(=O)OC)=NO3)c1C	771458034	CHDHNSALQCWROH-LDADJPATSA-N	428.489	1.969	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)c2cnn(CC(=O)NC3CCCC3)c2)cc1	772042440	MNBIPKXAQRPCCK-HNNXBMFYSA-N	443.504	1.569	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1ccc(C)c(S(=O)(=O)NC2CCCC2)c1	772181392	MCLIJNHZVDTMNQ-ZDUSSCGKSA-N	425.507	1.319	50	20	IDGD	
COc1cc2c(cc1CNC(=O)NNC(=O)C1CCN(c3ncccn3)CC1)O[C@H](C)C2	773003369	CDFVTDBKHPVQCP-CQSZACIVSA-N	440.504	1.556	50	20	IDGD	
Cn1nc(CCNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)c2ccccc21	773131333	LAKCLURHDISBNQ-UHFFFAOYSA-N	429.506	1.053	50	20	IDGD	
O=C(COC(=O)c1cnc(Oc2ccccc2)cn1)NNC(=O)c1cccc([N+](=O)[O-])c1	773681388	LZRBDBSIUWVEQY-UHFFFAOYSA-N	437.368	1.795	50	20	IDGD	
CC(C)CS(=O)(=O)N1CCC(NC(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)CC1	777765434	QQYKKACPJCXDFE-AWEZNQCLSA-N	444.529	1.374	50	20	IDGD	
COc1ccc2nc(NNC(=O)C3=NN([C@H]4CCS(=O)(=O)C4)C(=O)CC3)c(C)cc2c1	778482200	SINMHFOWLSWBHJ-AWEZNQCLSA-N	445.501	1.160	50	20	IDGD	
Cn1cnn(CC(=O)NNC(=O)c2ccc(CSc3nc4ccccc4[nH]3)cc2)c1=O	778523458	CCGWVDDRUQJYSP-UHFFFAOYSA-N	437.485	1.212	50	20	IDGD	
O=C(NNc1ccc([N+](=O)[O-])cc1Br)C(=O)Nc1cnc2c(c1)COCC2	778759532	HJFKDUHQTOIRQI-UHFFFAOYSA-N	436.222	1.907	50	20	IDGD	
O=C(Nc1ccn(CC(=O)N2CCOCC2)n1)C(=O)NN(c1ccccc1)c1ccccc1	782820340	BJODVLCYUZXODG-UHFFFAOYSA-N	448.483	1.550	50	20	IDGD	
O=C(NNc1cncc(Cl)n1)C(=O)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1	783266126	OWUJXONBFVMEDE-HNNXBMFYSA-N	440.895	1.855	50	20	IDGD	
Cc1ccccc1NC(=O)NNC(=O)C(=O)Nc1ccc(S(=O)(=O)N(C)C2CC2)cc1	783414748	VBQBDXDOJGGBEI-UHFFFAOYSA-N	445.501	1.569	50	20	IDGD	
CCCOc1ccc(C(F)(F)F)cc1NC(=O)C(=O)NNC(=O)C(=O)N1CCCC1	784000438	ZABFEQOHXPESPA-UHFFFAOYSA-N	430.383	1.203	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1cccnc1Oc1ccccc1	784005002	NZVDAJCUOBQMEY-UHFFFAOYSA-N	439.453	1.451	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)c2c(Cl)cccc2S(C)(=O)=O)c1	784051411	NCWKXDAYTQRCQM-UHFFFAOYSA-N	430.891	1.222	50	20	IDGD	
C#CCOc1cc(F)ccc1NC(=O)C(=O)NNc1c(OC)cccc1S(C)(=O)=O	785331238	QSYYSNDARKJRQB-UHFFFAOYSA-N	435.433	1.332	50	20	IDGD	
Cc1cc(NC(=O)COC(=O)/C(C#N)=C\c2ccccc2)n([C@H]2CCS(=O)(=O)C2)n1	785343402	FFQJUZBAGCKWNX-RNIVLKNTSA-N	428.470	1.640	50	20	IDGD	
CCCc1c(NC(=O)C(=O)NNc2ccnc(N(C)C)n2)cnn1-c1cccc(C#N)c1	785994841	PLBKUCLCEBQOCG-UHFFFAOYSA-N	433.476	1.634	50	20	IDGD	
CC1(C)COc2c(C(=O)NNC(=O)CN3CCN(C(=O)c4ccccc4)CC3)cccc21	788760593	BLGVNYBNESUOMM-UHFFFAOYSA-N	436.512	1.576	50	20	IDGD	
CCc1ccc(NC(=O)C(=O)NNC(=O)CNC(=O)OCc2ccccc2)cc1CC	797368806	HAAHQQMVMQYKAE-UHFFFAOYSA-N	426.473	1.824	50	20	IDGD	
CC(=O)N[C@@](C)(C(=O)NNc1oc(C(C)C)nc1C#N)c1ccc(S(C)(=O)=O)cc1	797716174	MOIDPUXRMHVQLU-LJQANCHMSA-N	433.490	1.568	50	20	IDGD	
CNC(=O)CNC(=O)c1cccc(NC(=O)C(=O)NNc2ccc(C(C)(C)C)cc2)c1	800624209	MNYRANWWTWAMEQ-UHFFFAOYSA-N	425.489	1.542	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(S(=O)(=O)NCC3CC3)c2)cc1	801106767	GQUJZKQXIWIBTL-UHFFFAOYSA-N	430.486	1.083	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)[C@](C)(O)CN2C(=O)NC3(CCCC3)C2=O)c(Cl)c1	802047860	IJGWYSDAZURXKC-GOSISDBHSA-N	437.884	1.417	50	20	IDGD	
COC[C@H](O)CNC(=O)/C(C#N)=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	802218202	AIVGUQFBEFWVNW-XMCSSRMMSA-N	431.880	1.109	50	20	IDGD	
CN(C)S(=O)(=O)C[C@H](NC(=O)NNC(=O)c1ccc2ccccc2n1)C(F)(F)F	805769742	TWCWMYAMUFMYDE-ZDUSSCGKSA-N	433.412	1.001	50	20	IDGD	
Cc1cc(I)cc(NC(=O)C(=O)NNC(=O)Cc2ccccn2)c1	806978988	OUWXSXDLVMIIPZ-UHFFFAOYSA-N	438.225	1.323	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)ccc1O)C(=O)Nc1nc(C2CC2)cs1	806979037	QDDAHNZJOOMFNT-UHFFFAOYSA-N	425.264	1.888	50	20	IDGD	
CCN1CCN(C(=O)Cc2ccc(NC(=O)C(=O)NNc3ncccc3F)cc2)CC1	807301531	BTSKZNOJQIHQDZ-UHFFFAOYSA-N	428.468	1.009	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)NCCCN1C(=O)c2ccccc2C1=O	807494812	NSWYDRWEWWVLKY-ZDUSSCGKSA-N	428.420	1.610	50	20	IDGD	
O=C(CNS(=O)(=O)c1cccc(F)c1)NNc1nc(-c2ccc(Cl)cc2)no1	810397703	YGTUGABNUOPTKX-UHFFFAOYSA-N	425.829	1.951	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NN=Cc2ccc(Cl)cc2-n2cncn2)ccc1Cl	814746817	NMBOMBYTGYFFLV-UHFFFAOYSA-N	439.284	1.985	50	20	IDGD	
COc1cccc(-c2n[nH]cc2C=NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)c1	814879012	ORJYZEBZUFZUSX-UHFFFAOYSA-N	446.511	1.993	50	20	IDGD	
O=C(NNC(=O)c1cccnc1)C(=O)Nc1cccc(S(=O)(=O)C2CCCCC2)c1	815564145	ZEFFZBHGINVOKN-UHFFFAOYSA-N	430.486	1.588	50	20	IDGD	
COCc1cc(NC(=O)C(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)cc(C(=O)OC)c1	815565485	PYDZTUFLGGBHKV-UHFFFAOYSA-N	443.500	1.922	50	20	IDGD	
CC(C)(C(=O)N1CCN(S(=O)(=O)CBr)CC1)c1ccccc1[N+](=O)[O-]	815964454	JCGXGZFLMCNKMN-UHFFFAOYSA-N	434.312	1.699	50	20	IDGD	
O=C1CC[C@](C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)(c2ccccc2)CN1	816915436	ABUNJUOVQYTKBB-OAQYLSRUSA-N	428.514	1.418	50	20	IDGD	
O=C(COc1ccc2ccccc2c1Br)NNC(=O)[C@@H]1CCS(=O)(=O)C1	818583625	FVMNZSMRWJQQEQ-GFCCVEGCSA-N	441.303	1.563	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)CCNS(=O)(=O)/C=C\c2ccccc2)cc1OC	913068393	WRPFYIBRCIGVIH-OWBHPGMISA-N	447.513	1.835	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CNS(=O)(=O)c2cccc(F)c2)ccc1OC(C)C	913153582	CEYNYRBMPSPWKR-UHFFFAOYSA-N	439.465	1.361	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)CCNS(=O)(=O)/C=C\c2ccccc2)c1	913534449	DRXYYCSCBISDIH-LUAWRHEFSA-N	433.486	1.445	50	20	IDGD	
C[C@@H]1NC(C(=O)NNC(=O)c2ccc(Br)s2)=NN(c2ccccc2)C1=O	915189065	ZZAJILCKFKAFJV-VIFPVBQESA-N	436.291	1.610	50	20	IDGD	
O=C(NCCOc1ccccc1)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	915895715	UNYJWLPCCCKYTL-UHFFFAOYSA-N	432.502	1.494	50	20	IDGD	
Cc1ccccc1CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	915910253	XTCLIEPIZDFDJL-UHFFFAOYSA-N	432.502	1.160	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCc2ccc(N3CCO[C@@H](C)C3)nc2)cc1OC	916393226	VENUBJQPZOROGS-AWEZNQCLSA-N	429.477	1.468	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)N[C@@H]2CCN3CCC[C@H]3C2)c2ccccc2c1=O	916573077	HJWDPCWEHMJZDU-CVEARBPZSA-N	426.521	1.767	50	20	IDGD	
O=C(NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)N[C@H]1CCN2CCC[C@H]2C1	916574195	WZFAHGVQHJDICX-IRXDYDNUSA-N	435.550	1.042	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)CN2CCCCCCC2=O)cc1	917021654	MTIYNBJLZCUJSG-UHFFFAOYSA-N	430.534	1.661	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)NCCc1ccc(OCC(=O)NC2CC2)cc1	918020195	LVYMDSBAAOOYLG-UHFFFAOYSA-N	428.464	1.599	50	20	IDGD	
O=C(NCc1ccc(-n2cncn2)nc1)NNC(=O)c1ccc(F)cc1Br	918204486	HBLDJPYDRXJRNQ-UHFFFAOYSA-N	434.229	1.708	50	20	IDGD	
O=C(COc1ccccc1CNC(=O)NNc1cncc(Cl)n1)NC[C@H]1CCCO1	918216683	AHUMZDGYWVQTTQ-CQSZACIVSA-N	434.884	1.630	50	20	IDGD	
COCC(=O)NC1CCN(C(=O)CCC(=O)C(C#N)=C2N(C)c3ccccc3N2C)CC1	919843264	DNJYTEFJSIWJIK-UHFFFAOYSA-N	439.516	1.411	50	20	IDGD	
O=C(CCCc1nc(-c2ccc(Cl)cc2)no1)NNC(=O)N[C@H]1CCS(=O)(=O)C1	919885766	NQMOMYGMRBOPOP-ZDUSSCGKSA-N	441.897	1.230	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)NC[C@@H](c1ccc(OC)c(OC)c1)N(C)C	919897887	PAPNUCBYGPYREB-KRWDZBQOSA-N	430.505	1.888	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)NCc2ccc(Cn3ccccc3=O)cc2)cc1C	919916487	NAIMMTBMZCQHJG-UHFFFAOYSA-N	447.495	1.983	50	20	IDGD	
C[C@H]1CN(C[C@@H](C)C(=O)NNC(=S)NC2CCN(Cc3ccccc3)CC2)C[C@@H](C)O1	920307918	QDRKLXDIWGBHLK-QRVBRYPASA-N	447.649	1.892	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N2CCSCC2)cc1	920851473	MIUHKQPESDNMEV-VBKFSLOCSA-N	425.514	1.916	50	20	IDGD	
Cn1c(=O)cc(C(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)c2ccccc21	1318643361	PNIBTQFJKMHHHZ-UHFFFAOYSA-N	443.504	1.882	50	20	IDGD	
CC(C)OCCCn1c(NNC(=O)[C@H](C)N2C(=O)CCC2=O)nc2ccccc2c1=O	1321793776	ONKNSFGMETUFEI-AWEZNQCLSA-N	429.477	1.192	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)c2ccc(S(=O)(=O)NC[C@@H](C)O)cc2)cc1	1353486883	VLWZPSCOLAYJFD-CQSZACIVSA-N	437.543	1.207	50	20	IDGD	
CC[S@@](=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)Br)C2	1779223839	HLJPIELZOXROJP-RXWAYUDJSA-N	437.400	1.442	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H]3CCN3C(=O)OC(C)(C)C)C2)C1	1781014948	FBUFLCARGBZTQN-STXHMFSFSA-N	445.944	1.080	50	20	IDGD	
C[C@H](Oc1cccnc1)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@](C)(Cl)CCl)C2)C1	1781233221	KDJZIZCAELSIKI-ZOCIIQOWSA-N	430.332	1.915	50	20	IDGD	
O=C([C@@H](F)Br)N1CC[C@@]2(C1)CN(C(=O)C1(c3ccc(O)cc3)CC1)CCO2	1781326428	XRUPHUODWKEIME-CRAIPNDOSA-N	441.297	1.944	50	20	IDGD	
O=C(c1cc2cccnc2[nH]1)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781330979	BOZVYBIRJIRKSK-DYVFJYSZSA-N	425.258	1.697	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)CCc3ccc(O)nn3)C2)C1	1782641798	XLPLVCUGKBCQKO-KSSFIOAISA-N	441.326	1.118	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)Cn3cc(Cl)cn3)CCO2)C1	1783342203	JKMWXLVPQQVVPH-XJKSGUPXSA-N	433.734	1.540	50	20	IDGD	
CCOC(CC(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](Br)CC)C2)C1)OCC	1783355919	ZWKOQZQUPSLPFO-KDOFPFPSSA-N	435.359	1.779	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](C)N1CSCSC1)CCO2	1783877557	KMXSLOPIPPIHNO-JKIFEVAISA-N	438.015	1.113	50	20	IDGD	
C=C1C[C@@H](C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](F)Cl)CCO3)N(C(=O)OC(C)(C)C)C1	1784089345	BNZIBRDCMVLUOC-AVYPCKFXSA-N	445.919	1.916	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(OC(F)F)cc3)C[C@@H]21)[C@@H](O)CCl	1784092619	RHSQEJONTMILDI-TUUVXOQKSA-N	432.851	1.481	50	20	IDGD	
CCS(=O)(=O)N[C@H](C)C(=O)Nc1ccc(C2(NC(=O)[C@H](Cl)COC)CCC2)cc1	1786338603	CXEGKRLEFVOBTA-CZUORRHYSA-N	445.969	1.702	50	20	IDGD	
N[C@H](CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCBr)[C@H]2C1)c1cccnc1	1786406173	XGYKLEFYQVBKNF-NXOAAHMSSA-N	439.354	1.236	50	20	IDGD	
COCc1oncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)Br)C[C@@H]21	1787723115	ATEAINHLDJGMRD-XWUBHJNHSA-N	430.299	1.198	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)c1nc2ccccc2[nH]1	1787837853	LBAAKEUPVYEUJA-GVARAGBVSA-N	439.285	1.847	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc4n(n3)CCCO4)[C@H]2C1	1788351806	MMSMGVXNDHFPNC-OSFYFWSMSA-N	441.326	1.042	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](OC(C)=O)C(C)C)C[C@@H]21	1790960463	IINMRZDNLGPNEM-QUSNUVHPSA-N	447.370	1.727	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3[nH]nc4ccncc34)C[C@@H]21	1791057187	GYKJVUUTNOZLCG-MPXAEWJHSA-N	436.310	1.335	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](C)Br)[C@H]3C2)n(C(F)F)n1	1791059178	QIHKFWOTNDBIOG-MNXVOIDGSA-N	449.296	1.963	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cncc(O)c3)[C@H]2C1	1791113345	VSOQVIBTZJFUNC-KSYCFECVSA-N	426.311	1.554	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C34CC(C(F)(F)F)(C3)C4)C[C@@H]21	1791249192	FSALRPRIQYJZMN-VJUSUEHQSA-N	438.874	1.953	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CC(c4ccccc4)=NO3)C[C@@H]21	1791249805	QJROEWDLJSDWEE-CAVMOMJPSA-N	449.935	1.413	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3cnccn3)[C@H]2C1	1791656204	GXYBIUNMXAQZFF-OTRWWLKZSA-N	439.354	1.420	50	20	IDGD	
Cc1nccn1[C@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)CBr)C[C@@H]21	1791700689	MQQLMCPAHWPWOP-KUHBDSFDSA-N	441.370	1.763	50	20	IDGD	
COc1cccc(N2C[C@@H](C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)[C@@H](O)CCl)C4)CC2=O)c1	1792483467	HJIBKVCCIIEZMD-ZFSSFNRBSA-N	449.935	1.286	50	20	IDGD	
COc1ccc2nc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@@H](O)CCl)ccc2c1	1792978053	BERFFNOJTSUKJC-FTUNRGFVSA-N	433.892	1.046	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1cc(C)n(C)n1	1793298271	XYHBHUKVFQDZID-MIXIEYOXSA-N	439.520	1.043	50	20	IDGD	
CC(C)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(F)(F)C(F)(F)C(=O)O	1793728380	JKBFLVLSODDQHT-ILWJIGKKSA-N	432.798	1.196	50	20	IDGD	
COc1ccc(OCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCBr)cc1	1795113186	MRRBZZCYUGTBJK-HBCWATKFSA-N	441.322	1.449	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)c1ccc2c(c1)CCCC2=O	1796189101	WTSOCOOSFTVXOD-WKCHPHFGSA-N	446.312	1.451	50	20	IDGD	
Cn1c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Cl)cc2c[nH]c3nccc-3c21	1796365930	GYPKSJYCLSMVGB-RBNVPPIJSA-N	433.871	1.744	50	20	IDGD	
Cc1nc(Br)sc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2	1796742368	OQLXBFCWQZGWRE-DKIAZLNASA-N	440.722	1.952	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@]1(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](F)Cl)CCOC1	1796812188	YKICAYNXPPKZOP-UUUMGPIQSA-N	433.908	1.843	50	20	IDGD	
C=C(Oc1ccccc1O)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCC(=O)NN(C)C)C2	1796884101	IWCIHXIOIGQLNH-BJWYYQGGSA-N	430.505	1.296	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc2c1cnn2C	1797086788	KKYJDIYLSZSVCI-FLTUCWPJSA-N	449.349	1.808	50	20	IDGD	
Cn1ccc2c(O)ncc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)CO[Si](C)(C)C)c21	1797957235	BJXOZEWHIANJIR-ZSBFGKGUSA-N	446.580	1.334	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccnc2c1OCO2	1798469026	FMCNQVKNMLDXMH-NRWUCQMLSA-N	440.294	1.045	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(O)c([N+](=O)[O-])c1	1799483152	LDBLIPOQNPOTTQ-ZSBFGKGUSA-N	437.525	1.355	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccn2nccc12	1799972400	BIPMZLYDORCOBS-VWPFQQQWSA-N	435.322	1.569	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2	1800639382	SSXIHBDTEPFRTE-NOHGZBONSA-N	426.149	1.535	50	20	IDGD	
CCOc1cccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](Cl)COC)c1O	1800977477	REBDHYBQQBAWSL-IARIHHJXSA-N	426.897	1.248	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1cc[nH]n1	1801362932	HIIDLVBUINSHLV-MUJYYYPQSA-N	441.444	1.738	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(-c3cc[nH]n3)cc1)C2	1802337934	IEHUSROLGXEVGT-REPLKXPHSA-N	438.532	1.702	50	20	IDGD	
CNC(=O)CC(=O)NC[C@@H]1CCN(C(=O)[C@H](C)CBr)[C@H]1c1cccnc1	1803473273	NHUCCXZSSWNEAP-IFIJOSMWSA-N	425.327	1.255	50	20	IDGD	
CN1CCCn2nc(C(=O)N3CCC4(CCCN(C(=O)[C@H](O)CCl)C4)CC3)cc2C1	1805525883	IDTCXHWHRTXLGP-GOSISDBHSA-N	437.972	1.163	50	20	IDGD	
CN1C(=O)CC[C@H]1C(=O)N1CC[C@@H](CNC(=O)CCBr)[C@@H]1c1cccnc1	1806343924	LKHFKDBYGZNXSS-MPGHIAIKSA-N	437.338	1.493	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H](CNC(=O)CSC(=N)N)[C@H]1c1cccnc1	1807005992	NIEKYHXHPSLRRN-MRRJBJDNSA-N	432.377	1.950	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)[C@H](C)Br)[C@@H]1c1cccnc1	1808435849	ZQFSUPHKJGASFK-UWWPHRKUSA-N	439.354	1.738	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)c3c[nH]c4cnccc34)CC2)C1	1809972358	MZSYWLXRJZHAHU-UHFFFAOYSA-N	446.316	1.401	50	20	IDGD	
Cc1ncc(C(=O)N2CCC3(CCCN(C(=O)c4cccc(B(O)O)c4)C3)CC2)s1	1809978217	PDEVXMKFRZVODC-UHFFFAOYSA-N	427.335	1.290	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)C2(F)CC2)[C@@H]1c1cccnc1	1812457018	ORJSXEIJJOKBLS-QRTPEGJISA-N	440.479	1.724	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1ccccc1F)CC2)c1ccc(B(O)O)cc1	1815343779	OYRAQJFSAKSRCQ-CQSZACIVSA-N	439.277	1.502	50	20	IDGD	
Cc1ccc(CC(=O)N[C@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)cc1	1815355129	NTJPGUIGPQWHNC-SFHVURJKSA-N	449.341	1.600	50	20	IDGD	
O=C(/C=C/c1ccoc1)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1815749035	FYFKIYGDNQSXPG-QFXLTXBMSA-N	434.261	1.702	50	20	IDGD	
Cc1cccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)[nH]n2)n1	1816395961	FXKXVYBJADSCFM-SFHVURJKSA-N	448.487	1.731	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc3n(n2)CCNC3=O)n[nH]1	1816622941	VAIYHJQNXNAKTH-CQSZACIVSA-N	447.927	1.921	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@H]1CCc2nc(NC(=O)C(=O)Nc3cccnc3)sc2C1	1820048515	UMEMSPLZCCJZQZ-LBPRGKRZSA-N	447.593	1.940	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1)c1cnc2snnc2c1	1820150770	PSGFQAPCCCNZMA-CHWSQXEVSA-N	435.897	1.715	50	20	IDGD	
C[Si](C)(C)OCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cccnc1C(N)=O)CC2	1820161147	SEXXOOMKDATZKO-LLVKDONJSA-N	447.593	1.714	50	20	IDGD	
COc1cccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)c1	1820515057	XWHBKOSUZGUWAB-FQEVSTJZSA-N	448.288	1.718	50	20	IDGD	
CN(C)C(=O)NCC(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@](C)(Cl)CCl)n[nH]1	1820863505	ZZDAYFJZEADKTL-SJCJKPOMSA-N	433.340	1.909	50	20	IDGD	
C[C@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](F)Br)n[nH]1)n1ccnn1	1820936399	BQWFWSWKCIEROY-IRUJWGPZSA-N	428.266	1.945	50	20	IDGD	
CCNC(=S)NCC(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](F)Br)[nH]n1	1821644521	OMZRUSWGZPCDDP-MFKMUULPSA-N	449.350	1.576	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(Cl)nn2)[nH]n1	1822414738	LFZRBXRTYNIVCY-AWEZNQCLSA-N	448.915	1.532	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CSc2nc[nH]n2)n[nH]1	1822713609	JEODBJCUGQVPKU-CMPLNLGQSA-N	427.918	1.566	50	20	IDGD	
O=C(Cn1ccncc1=O)N[C@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1	1823009646	RWPSGGZWJDYXQN-ISVAXAHUSA-N	444.286	1.003	50	20	IDGD	
Cc1n[nH]c(C)c1CC(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCC(=O)NN(C)C)CC2	1823132052	GRJAMBCSLBBBSC-CYBMUJFWSA-N	447.565	1.011	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)[C@H]1CCCSC1	1823452380	GCUFBVRFAWSEDC-YJBOKZPZSA-N	442.350	1.539	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)[C@@H](O)CCl)CC2)n1	1824180231	FGAKXGPTQTZTGC-MSOLQXFVSA-N	436.940	1.873	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)CNC(=O)OC)sc2C1	1826506999	VPQVVOROMBYZSH-RKDXNWHRSA-N	433.328	1.585	50	20	IDGD	
O=C(Cc1c(F)cccc1Cl)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1	1830283930	WXAZZTQSLYQWNJ-QFBILLFUSA-N	449.306	1.078	50	20	IDGD	
Cc1cccnc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2	1830535436	NVPLEFZHDGXRQJ-HNAYVOBHSA-N	440.338	1.491	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C1(c3ccc(O)cc3)CC1)CCO2	1830811755	XFZVBTGBJJXHCT-WIYYLYMNSA-N	436.936	1.898	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cnc(O)nc2O)CC1	1831652714	INPFDQSLTPYYCQ-BXUZGUMPSA-N	441.326	1.905	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H]3CCCCC3(F)F)CC2)CC1)[C@H](O)CCl	1833305888	BYPCIDFRMDYPDR-DLBZAZTESA-N	435.943	1.983	50	20	IDGD	
Cc1[nH]nc(C(=O)NC2CCN(C3CCN(C(=O)[C@H](C)Br)CC3)CC2)c1F	1834020289	AOMGZURUIHNFJP-NSHDSACASA-N	444.349	1.826	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3cnn(C)c3)CC2)CC1	1834192906	NJMXBXBJBBGLEE-KRWDZBQOSA-N	440.386	1.779	50	20	IDGD	
O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)c1cncc(F)c1)CCO2	1834354577	NRRIGWPKHBSUMG-KRWDZBQOSA-N	430.274	1.076	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)CN3CCCCC3)CC2)CC1	1834613670	RIKYOADDDUUXMZ-INIZCTEOSA-N	443.430	1.827	50	20	IDGD	
Cn1nc(C(=O)N2CCC(N3CCC(NC(=O)[C@@H](F)Cl)CC3)CC2)c2c1CCC2	1835080553	NRHBCLPAJJWFJN-GOSISDBHSA-N	425.936	1.628	50	20	IDGD	
Cc1nccc(C(=O)NC2CCN(C3CCN(C(=O)[C@H](C)Br)CC3)CC2)n1	1835219933	XGMNMVNQMZHQCM-ZDUSSCGKSA-N	438.370	1.754	50	20	IDGD	
O=C(Cc1noc2ccccc12)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1835980394	NQLIQPUVNITYNG-IEBWSBKVSA-N	425.844	1.361	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnccc3F)CCO2)C1	1836317799	BUFJQIXVQAEKAQ-ZWKOTPCHSA-N	434.295	1.527	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCC(OC2CCN(C(=O)Cn3ccnn3)CC2)CC1	1837981995	JIWPILKWCLGYHW-SFHVURJKSA-N	432.352	1.513	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(C(C)(C)C)n[nH]3)CCO2)C1	1837991424	KSAJFGMBIQICLJ-JLTOFOAXSA-N	426.945	1.795	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)Cn3nccn3)CC2)CC1	1838655613	QRUDIMKOQQYQFH-CYBMUJFWSA-N	428.331	1.060	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(O)cc3)CCO2)C1	1838968730	SOSPZEIWRACYHU-AUUYWEPGSA-N	441.322	1.493	50	20	IDGD	
N#Cc1cc(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)ccc1F	1839187164	NPCBXOUZWHZBAF-PKOBYXMFSA-N	427.835	1.231	50	20	IDGD	
Cc1nc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)ccc1F	1839197633	CMZCHYQJMQBSIS-RHSMWYFYSA-N	448.264	1.290	50	20	IDGD	
CNc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)cc1	1839198891	FHLMZORBKHYOPC-YJBOKZPZSA-N	444.301	1.489	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(F)nc3F)C2)C1	1840029868	SWCLGZPRXUVRQS-PIGZYNQJSA-N	448.264	1.213	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(Cl)cc3F)C2)C1	1840149515	RNRLISYWEHBPNB-BEFAXECRSA-N	449.306	1.803	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3C[C@@H]3c3ccccc3)C2)C1	1840156557	VEUQFDQICRPXDQ-IWQHBPENSA-N	436.936	1.500	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(F)c(F)c3C)C2)C1	1840156872	XCSGETACDOLBSV-QRWLVFNGSA-N	446.878	1.597	50	20	IDGD	
O=C(c1ccc2c(c1)CCCO2)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1840659763	KVVQFNWRDJNKTR-XLIONFOSSA-N	426.872	1.616	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC2(CCCN2C(=O)CCn2c(=O)oc3ccccc32)C1	1841988586	RDMZFLUARDFEEJ-CYBMUJFWSA-N	436.306	1.971	50	20	IDGD	
C[C@H](Sc1cccs1)C(=O)N1CC2(CCCN2C(=O)c2cnccc2C(=O)NN)C1	1844264383	MOTITXCDZWCHCT-ZDUSSCGKSA-N	445.570	1.744	50	20	IDGD	
O=C(Cn1nccn1)N1CC2(CCCN2C(=O)[C@H](Br)Cc2ccccc2)C1	1845942131	MQCBEMZWDXTMPR-MRXNPFEDSA-N	432.322	1.488	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)C2(c3ccccc3)CCC2)C1	1846310015	QQBXSEBJHBQQIP-UHFFFAOYSA-N	433.512	1.624	50	20	IDGD	
C=CC[C@@H](CC(=O)N1CCCC12CN(C(=O)[C@H](O)CCl)C2)NC(=O)OC(C)(C)C	1846931445	CCQDAZGUNKVXIE-LSDHHAIUSA-N	429.945	1.649	50	20	IDGD	
O=C(Cc1ccc(Br)cc1F)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl	1847563788	QFIAVZCFUVYAPZ-KKUMJFAQSA-N	433.705	1.932	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)C[C@@H](NC(N)=O)c2ccccc2)c2ccccc2c1=O	14044651	VWIHWRDVYURDNJ-QGZVFWFLSA-N	436.472	1.538	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)CNC(=O)c2ccc(F)cc2F)c2ccccc2c1=O	14044664	GXHFASZUHXPHAD-UHFFFAOYSA-N	443.410	1.447	50	20	IDGD	
Cc1ccc(C)c(NC(=S)NNC(=O)CCc2c(C)nc(N3CCOCC3)[nH]c2=O)c1	14307885	CVMDDRMYBIRWGO-UHFFFAOYSA-N	444.561	1.482	50	20	IDGD	
O=C(NNC(=O)c1n[nH]c(=O)c2ccccc12)c1nn(-c2ccc(F)cc2)c2c1CCC2	14346889	AYPQAGOKLRJCLZ-UHFFFAOYSA-N	432.415	1.811	50	20	IDGD	
O=C(COc1ccccc1)NCC(=O)NNC(=S)Nc1cccc(Br)c1	16107915	YJLIFGOLQMBNIT-UHFFFAOYSA-N	437.319	1.962	50	20	IDGD	
O=C(CNC(=O)c1cccc(Br)c1)NNC(=S)NCCc1cccs1	21124824	SMVTYDUMYUPJBD-UHFFFAOYSA-N	441.376	1.978	50	20	IDGD	
Cn1ccnc1[C@](O)(CC(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1)C(F)(F)F	726867790	USTKICPCQGCGLS-MRXNPFEDSA-N	447.439	1.144	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)C[C@@H](C)NC(=O)C2CCCC2)c2ccccc2c1=O	727098804	GBOYDDDRHFDYAM-CQSZACIVSA-N	427.505	1.823	50	20	IDGD	
CC/C=C(\C)C(=O)N1CSC[C@H]1C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	727986743	DHWGKIRIGZBGMU-MFMIUCCHSA-N	425.532	1.109	50	20	IDGD	
O=C(COC(=O)c1cc(Br)cs1)NNC(=O)[C@@H]1COc2ccccc2O1	728332165	HMKIWDFWQZWUKA-LBPRGKRZSA-N	441.259	1.655	50	20	IDGD	
O=C(CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@H]12)NNC(=O)c1cccc(OC(F)F)c1	728543923	NYIRNHWCTGYUFX-YDHLFZDLSA-N	428.461	1.775	50	20	IDGD	
N#Cc1cccc(OC2CCN(C(=O)NNC(=O)CNC(=O)c3cccs3)CC2)c1	729228461	CTWYYSGOYAXCEI-UHFFFAOYSA-N	427.486	1.634	50	20	IDGD	
O=C(CCCNC(=O)C1CC1)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	729298877	XFXHGSGTXUQSPS-UHFFFAOYSA-N	447.495	1.512	50	20	IDGD	
C[C@H]1CCCCN1C(=O)CN1CCN(C(=O)NNC(=O)Cn2ccc3ccccc32)CC1	729511067	QRCCRXPSFFSLKA-SFHVURJKSA-N	440.548	1.401	50	20	IDGD	
O=C(CCNS(=O)(=O)/C=C/c1ccccc1)NNC(=O)Cn1ccc2ccccc21	729540411	BWSHDQJVRSTIRH-NTCAYCPXSA-N	426.498	1.769	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)[C@@H]2CC(=O)N(C[C@@H]3CCCN3CC)C2)cc1OC	729628460	UVUVGOQYTIKOLP-SJORKVTESA-N	432.521	1.188	50	20	IDGD	
O=C(COC(=O)c1ccc(OCC(F)(F)C(F)F)nc1)NNC(=O)c1ccccc1	729736095	YKODLQRLYSLDAH-UHFFFAOYSA-N	429.326	1.979	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)[C@@H]1CCN(c2ccc3c(c2)OCCO3)C1=O	730519065	FMDAXLXUAXMHTM-HNNXBMFYSA-N	435.440	1.228	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCN(c2ccc3c(c2)OCCO3)C1=O)c1ccc(Cl)cc1O	730590898	WFRWKZJSYBSZFT-AWEZNQCLSA-N	431.832	1.631	50	20	IDGD	
O=C(CC[C@H]1NC(=O)N(c2ccc(Cl)cc2)C1=O)NNC(=O)c1ccc2c(c1)OCO2	730768675	FZCVHMZYJWKDGL-CQSZACIVSA-N	444.831	1.735	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)[C@H]1CCCN(C(=O)c2ccc3n[nH]cc3c2)C1	730778201	DHIQBWPZBFYBND-HNNXBMFYSA-N	437.456	1.347	50	20	IDGD	
Cc1c(C(=O)OCC(=O)NNC(=O)c2cccs2)nnn1-c1ccc2c(c1)OCCO2	731525871	PZWPQRTZEHGMGB-UHFFFAOYSA-N	443.441	1.026	50	20	IDGD	
O=C(NN=C1CCCS(=O)(=O)C1)c1cccc(S(=O)(=O)NCc2ccccc2)c1	731923397	JILLEMLHFSVDMR-UHFFFAOYSA-N	435.527	1.460	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)N[C@H](Cc2ccccc2)CN2CCOCC2)c1	732476210	APKQDINIWWGCAO-OAQYLSRUSA-N	440.544	1.956	50	20	IDGD	
CCOC(=O)c1cc(S(=O)(=O)NNC(=O)c2cnn(-c3ccccc3)c2)ccc1F	733123291	YAUPELUFLPVZEJ-UHFFFAOYSA-N	432.433	1.811	50	20	IDGD	
CCOCCCn1c(NNC(=O)Cn2c(=O)cnc3ccccc32)nc2ccccc2c1=O	733267463	XMTRWWBVNMIFDE-UHFFFAOYSA-N	448.483	1.676	50	20	IDGD	
N#Cc1ccc(CN2CCN(C(=O)NNC(=O)c3cnn(-c4ccccc4)c3)CC2)cc1	733350141	OYWRKKCPQHOSDK-UHFFFAOYSA-N	429.484	1.916	50	20	IDGD	
N#Cc1ccc(N2C(=O)N[C@H](CCC(=O)NNC(=O)COc3ccccc3F)C2=O)cc1	733774488	OTMHRWZAAXQHRF-MRXNPFEDSA-N	439.403	1.129	50	20	IDGD	
COCCCn1c(S)nc2cc(C(=O)NNC(=O)c3ccccc3F)ccc2c1=O	733788490	QAJITALUZULVQA-UHFFFAOYSA-N	430.461	1.936	50	20	IDGD	
O=C(NNc1cnccn1)c1ccccc1NS(=O)(=O)c1ccc2nc(O)[nH]c2c1	734245341	VTUJDECMIYZTJD-UHFFFAOYSA-N	425.430	1.616	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)c1cccnc1N1CCOCC1	734251736	LOFLFARVGITODI-UHFFFAOYSA-N	433.534	1.752	50	20	IDGD	
CC(=O)N1CCN(C(=O)CCNC(=O)NNC(=O)c2ccc(OCCC(C)C)cc2)CC1	737064349	FDBVMGFKMGZLRT-UHFFFAOYSA-N	447.536	1.136	50	20	IDGD	
CCc1cc(NNC(=O)c2cc(C)c3c(=O)n(C)c(=O)n(C)c3n2)nc(-c2ccccn2)n1	738531668	KUXTVPQZNFWOEL-UHFFFAOYSA-N	446.471	1.112	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)NCCNc1nccc(C(F)(F)F)n1	739045472	MQRXLKFAVTVLGF-SNVBAGLBSA-N	430.362	1.844	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NCC(=O)NNc2ncccc2C(F)(F)F)c1	740101108	YBOLVSZHTURERS-UHFFFAOYSA-N	445.423	1.224	50	20	IDGD	
CS(=O)(=O)c1ccc(Cl)c(C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)c1	740821379	LLMSJPZITLINDE-UHFFFAOYSA-N	443.934	1.941	50	20	IDGD	
CN(CCCC(=O)NNC(=O)Cc1ccc(Cl)cc1)C1=NS(=O)(=O)c2ccccc21	742035400	KFWKHUROYAGSOI-UHFFFAOYSA-N	448.932	1.891	50	20	IDGD	
Cn1c(=O)c2ccccc2n2c(SCC(=O)NNC(=O)c3ccc(C#N)cc3)nnc12	742451695	XQUUZIKROIYWDD-UHFFFAOYSA-N	433.453	1.006	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H]1CC(=O)NNC(=O)C1CCN(c2ncccn2)CC1	742635732	XFXNXJOUSNNEBW-INIZCTEOSA-N	432.525	1.630	50	20	IDGD	
CC(=O)N1CCc2cc(Br)c(S(=O)(=O)NNC(=O)NC3CCCC3)cc21	743729345	HTZWEIWKSCUJQR-UHFFFAOYSA-N	445.339	1.793	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)N[C@H]1CC(=O)N(CCOc2ccccc2)C1	745846661	IRSCNDJXTUFXSU-HNNXBMFYSA-N	427.417	1.219	50	20	IDGD	
Cc1cc(=O)n(CC(=O)NC(C)C)c(C)c1C(=O)NNC(=O)c1ccc2ccccc2n1	746090626	HZYNTNQDWJOJND-UHFFFAOYSA-N	435.484	1.613	50	20	IDGD	
Cn1ccnc1[C@@](O)(CCNC(=O)NNC(=O)CCOc1ccccc1)C(F)(F)F	747105051	YBBXCQBADLOCCR-KRWDZBQOSA-N	429.399	1.360	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)CCn2nc(O)c3ccccc3c2=O)o1	747715871	RVFNYHUGDDLNNG-UHFFFAOYSA-N	427.461	1.388	50	20	IDGD	
O=C(NNC(=O)c1ccc(NC(=O)c2ccc(Br)o2)cc1)C(=O)N1CCCC1	748238794	AEJYCJKHEJDEFL-UHFFFAOYSA-N	449.261	1.678	50	20	IDGD	
COc1cc(C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)sc1S(N)(=O)=O	748826671	AGFIQNKGHGPPLU-UHFFFAOYSA-N	446.457	1.331	50	20	IDGD	
Cc1ccc(NNC(=O)CCC(=O)N2CCN(S(=O)(=O)c3ccc(F)cc3)CC2)cc1	749200725	RKOZMGATRSOQRA-UHFFFAOYSA-N	448.520	1.891	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN(C)[C@@H]2CS(=O)(=O)c3ccc(Cl)cc32)n1	750176535	AFSABIIKKBNCGK-CYBMUJFWSA-N	442.950	1.255	50	20	IDGD	
COc1ccccc1NC(=O)CN1CCN(C(=O)/C(C#N)=C\c2cc(C#N)n(C)c2C)CC1	750518287	QMNSIYORXQIPCG-UNOMPAQXSA-N	446.511	1.904	50	20	IDGD	
CN(C)C(=O)CN1C(=O)C(=NNC(=O)c2ccc(N)cc2)c2cc(Br)ccc21	750916001	FUZGTHPIJAJHJN-UHFFFAOYSA-N	444.289	1.600	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(=O)n(CC(=O)Oc2ccc([N+](=O)[O-])cc2OC)c1	751168032	FBVDTZMFXJFHCR-UHFFFAOYSA-N	439.446	1.401	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCC(OC[C@@H]2CCCO2)CC1	751494846	RIGBHNIKAFQWBQ-INIZCTEOSA-N	425.913	1.770	50	20	IDGD	
COc1cc(OC)cc(N2C[C@@H](C(=O)NNC(=O)COc3ccccc3F)CC2=O)c1	752399030	DYIDGHHVDKLDQZ-ZDUSSCGKSA-N	431.420	1.422	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN2CC[S@@](=O)C[C@H]2c2cnn(CC)c2)cc1C	753814268	WUJKOUSINYIDEW-PEGYKEAPSA-N	437.591	1.402	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCC3)c(C)c([N+](=O)[O-])c1	753840388	JMZPRFQIAGACOO-UHFFFAOYSA-N	446.441	1.640	50	20	IDGD	
O=C(NNc1cnnc2ccccc12)[C@@H]1CN(Cc2nc(O)c3ccccc3n2)CCO1	754421536	XAEHZFJIHGYOMW-IBGZPJMESA-N	431.456	1.623	50	20	IDGD	
CCCN(CCC)S(=O)(=O)N1CCN(C(=O)c2c(C)nn(CCCl)c2C)CC1	754451740	ADSGSAUKFNNKIV-UHFFFAOYSA-N	434.006	1.863	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=O)c2cc(C)nc3ccccc23)n(C)c1	754777334	CRIRSQSNGYTXNV-UHFFFAOYSA-N	443.529	1.987	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Nc2ccc3c(c2)NC(=O)[C@@H](C)O3)cc(OC)c1OC	755559660	WAHUNMFOVHQKGV-SNVBAGLBSA-N	430.417	1.898	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)NC2CCN(S(=O)(=O)C(C)(C)C)CC2)c1	755900551	YWROMSKFFSRUFM-UHFFFAOYSA-N	442.538	1.241	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c(Cl)cc1F	755957103	LLMXEGAQYRLKAC-AWEZNQCLSA-N	444.824	1.415	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)N[C@@H]2CCN(c3ncccc3F)C2)cc1	756156519	SLQAOBCUFHCUNW-LSDHHAIUSA-N	431.468	1.996	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ncc(Cc2ccccc2)s1	756163871	KCVZMECWNQMMIG-UHFFFAOYSA-N	440.481	1.907	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2cccc(N(C)C)c2)cc1S(=O)(=O)NC1CC1	756684463	YGMQJIXMJBXNPU-UHFFFAOYSA-N	447.517	1.668	50	20	IDGD	
O=C(NNC(=O)c1cc(Cl)ccc1O)Nc1ccccc1OCC(=O)N1CCOCC1	756876271	ZTDJQTGWGZHKRP-UHFFFAOYSA-N	448.863	1.750	50	20	IDGD	
C[C@H]1C[C@H](C)CC2(C1)NC(=O)N(CC(=O)NNC(=O)c1cnn(-c3ccccc3)c1)C2=O	756995937	MTEKYYMIOIDDKX-GJZGRUSLSA-N	438.488	1.380	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NN=Cc3nc(Cl)cs3)CC2)cc1	758118751	PLHAGKZOFPJWOA-UHFFFAOYSA-N	441.966	1.562	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)[C@@H](C)n3nnnc3C(C)(C)C)n[nH]2)cc1OC	758371788	QSJXSVLXNWWPBJ-LLVKDONJSA-N	442.480	1.400	50	20	IDGD	
Cc1nc2ccc(C(=O)N3CCN(S(=O)(=O)CBr)CC3)cc2nc1C	758524632	XAEVEKVYCFWEAO-UHFFFAOYSA-N	427.324	1.687	50	20	IDGD	
CCO[C@@H]1COCC[C@H]1NC(=O)NNC(=O)[C@@H](C)Oc1cccc(Br)c1	759217828	XKMDUCUBJUNQES-KCPJHIHWSA-N	430.299	1.741	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)c3cnn(-c4ccccc4)c3Br)nc21	760275587	KRJPWYGLSAAEGZ-UHFFFAOYSA-N	429.238	1.774	50	20	IDGD	
COCCC1(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)CCC1	761780597	NSYCUHMMCGGYAZ-UHFFFAOYSA-N	438.550	1.622	50	20	IDGD	
COc1ccccc1OC[C@H](C)CNC(=O)NNC(=O)c1csc(N2CCOCC2)n1	763459974	CMVKTJUTHBJFFW-CQSZACIVSA-N	449.533	1.647	50	20	IDGD	
Cc1nc(-c2cccc(NC(=O)C(=O)NNC(=O)c3ccccc3Br)c2)n[nH]1	763482643	IGRSQCJTIDCIEC-UHFFFAOYSA-N	443.261	1.942	50	20	IDGD	
O=C(NNC(=O)C12CC3CC(CC(C3)C1)C2)C(=O)Nc1cc(F)cc(N2CCOCC2)c1	763735885	UEFUJOXCMCYJDR-UHFFFAOYSA-N	444.507	1.965	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(F)cc2OCC#N)c1C	763849225	KBAAWCMMFJUUDJ-CQSZACIVSA-N	428.420	1.898	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@@H](C)C(=O)NNC(=O)C(=O)Nc1cnn(CC(F)F)c1	763882281	IHKHKOABXWUPPF-NSHDSACASA-N	443.838	1.972	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2cc(C(F)(F)F)ccc2N(C)C)n1	763885010	IQELTXWOHYWFFN-UHFFFAOYSA-N	426.399	1.371	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)Nc1ccc(Br)nc1	764003117	YUPDAXRTJFRQHC-UHFFFAOYSA-N	445.071	1.345	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2ccccc2C(=O)NC(C)(C)C)cc1	764126931	MMTPILSVRRZERI-UHFFFAOYSA-N	440.500	1.942	50	20	IDGD	
O=C(CCCc1ccccc1)NNC(=O)C(=O)Nc1cnn(-c2cnc3ccccc3n2)c1	764224005	OFAVXYZJDDNLGG-UHFFFAOYSA-N	443.467	1.924	50	20	IDGD	
COCCS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)C(C)(C)c2ccccc2)cc1	764314259	SRJJRZVCRYWZPI-UHFFFAOYSA-N	447.513	1.170	50	20	IDGD	
C[C@@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3ccc(O)c(Cl)c3)cn2)C[C@@H](C)O1	764349745	UPBRTXILBJYBTE-VXGBXAGGSA-N	447.879	1.454	50	20	IDGD	
Cc1nnc(-c2cccc(NC(=O)C(=O)NNC(=O)c3cc(-c4cccs4)[nH]n3)c2)o1	764381889	BLUBUVOJQBXALI-UHFFFAOYSA-N	437.441	1.896	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COCCO1)C(=O)Nc1ccc(C23CC4CC(CC(C4)C2)C3)cc1	764428450	IAXDFFNPKNPALJ-HAVBXNNZSA-N	427.501	1.656	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=S)NCC(C)(C)CN(C)C)CC2)cc1	764518895	JTVNDZLWYXSENS-UHFFFAOYSA-N	434.654	1.196	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)[C@@H](C)NS(=O)(=O)c2ccc(C#N)cc2)c1C	764553993	UOMFJCAXJGRQOU-HZPDHXFCSA-N	444.513	1.457	50	20	IDGD	
COc1cc(C=NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)c([N+](=O)[O-])cc1O	764826774	AYOICEAEPUCSEC-UHFFFAOYSA-N	441.444	1.217	50	20	IDGD	
O=C(CCNS(=O)(=O)/C=C/c1ccccc1)NNC(=O)c1cc(-c2cccs2)[nH]n1	765569418	IODNHOINSQUUQL-FMIVXFBMSA-N	445.526	1.880	50	20	IDGD	
C[C@@H]1Cc2cc(C(=O)NNC(=O)c3cc(-c4cccs4)[nH]n3)ccc2N1S(C)(=O)=O	765570130	SGEZTQPOTXTXFR-LLVKDONJSA-N	445.526	1.924	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)c3ccc(S(=O)(=O)NC)cc3)n[nH]2)cc1	765572492	ZPPNNTYILFYCNE-UHFFFAOYSA-N	427.486	1.622	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)c3cc(C)ccc3C)CC2)cc1	765732554	PIXCQTDZRRJHIN-UHFFFAOYSA-N	444.557	1.379	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1ccc(C(F)(F)F)nc1	765738549	LWDBJQRXLKFCPT-UHFFFAOYSA-N	435.406	1.319	50	20	IDGD	
Cc1noc(-c2ccccc2C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)n1	766643472	QJCLDMVRNKPXSS-UHFFFAOYSA-N	448.483	1.264	50	20	IDGD	
CCOc1ncccc1C(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	766660359	KTQSQWXPLAGJSZ-UHFFFAOYSA-N	431.924	1.713	50	20	IDGD	
CC(C)(C)N1C[C@@H](C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)CC1=O	766660642	QJYTZJJPCPPVRG-KRWDZBQOSA-N	449.983	1.252	50	20	IDGD	
Cc1nnc(O)c(C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)c1C	766662911	HGMVWDBYSOSTCT-UHFFFAOYSA-N	432.912	1.031	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)Nc1ccccc1CN1C(=O)CNC1=O	767221133	OXARWJYISADVST-UHFFFAOYSA-N	447.473	1.299	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)c1ccc(Sc2ccc([N+](=O)[O-])cc2)cc1	767820514	SSWRKQYOHFDPDJ-ZDUSSCGKSA-N	435.483	1.942	50	20	IDGD	
CCOC1CC(CNC(=O)NNC(=O)Cc2ccc3ccccc3c2)(N2CCOCC2)C1	767895581	HVPMWQYGOILLBI-UHFFFAOYSA-N	440.544	1.983	50	20	IDGD	
CC1(C)CCC[C@]2(C1)NC(=O)N(CC(=O)NNC(=O)c1cccc(OC(F)F)c1)C2=O	768570693	IMKDBZBHPVLRBE-HXUWFJFHSA-N	438.431	1.940	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)CCC(=O)c2ccc(Cl)cn2)ccc1Cl	768965404	DSOSJYDGJMWTLT-UHFFFAOYSA-N	445.284	1.460	50	20	IDGD	
Cc1nc(C(C)(C)c2ccccc2)sc1C(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1	769719387	HWSJFXCLGVWIPE-CQSZACIVSA-N	436.559	1.909	50	20	IDGD	
C[C@@H]1CCCN(c2ccc(C(=O)NNc3nc(O)c4cnn(C)c4n3)cc2[N+](=O)[O-])C1	770972273	GZKZGYCFKVPBCF-LLVKDONJSA-N	426.437	1.970	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2ccc(C(=O)OC(C)(C)C)cc2)n1	771123271	BEGMMLUNNAVSON-UHFFFAOYSA-N	433.486	1.954	50	20	IDGD	
O=C(NNc1ccc(Br)c(F)c1)N[C@H]1CCO[C@]2(CCS(=O)(=O)C2)C1	771342545	PSQKTEGSWBVNFU-XHDPSFHLSA-N	436.303	1.951	50	20	IDGD	
CC(=O)N[C@H](CC(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1)c1ccc(C)cc1	772193216	QWOHHPARKQWVBP-GOSISDBHSA-N	430.892	1.680	50	20	IDGD	
COc1ccc(F)cc1CC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	772905664	ZYVBTGAVJFTDRN-UHFFFAOYSA-N	435.477	1.623	50	20	IDGD	
CC(=NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)c1ccc(C(=O)O)o1	772999951	VOYXWCSRIOKBTL-UHFFFAOYSA-N	449.485	1.472	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)C(=O)Nc1cccc2cncc(Br)c12	773546409	MYVCTGMFGZICHP-UHFFFAOYSA-N	428.246	1.721	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccc(NC(=O)C2CC2)nc1	774010767	ZITPSJIZCNGRRC-NSHDSACASA-N	445.863	1.637	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)Nc2ccc(C[C@H]3NC(=O)NC3=O)cc2)c1C	775706852	JAIQBSJRHWXTGT-WMLDXEAASA-N	439.472	1.674	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2ccnc(OCCOC)c2)c2ccccc2c1=O	776740965	AVABGPBIPHEYIR-UHFFFAOYSA-N	425.445	1.302	50	20	IDGD	
COc1cc(C(=O)CCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc(OC)c1OC	776966090	IUWQHBHERADLAN-IBGZPJMESA-N	444.440	1.663	50	20	IDGD	
COc1nc(C)ccc1C(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	777419971	POLSINVVGJFVDA-UHFFFAOYSA-N	431.924	1.631	50	20	IDGD	
O=C(c1ccn(-c2cccc(F)c2)n1)N1CCN(S(=O)(=O)CBr)CC1	777780232	YVTHTVOZKWWZGW-UHFFFAOYSA-N	431.287	1.451	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)N1CCC2(CC1)OCCc1ccsc12	778641766	SOSQUKUPEDPYLQ-UHFFFAOYSA-N	434.543	1.844	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNS(=O)(=O)c1ccc(S(F)(F)(F)(F)F)cc1	782910920	OROSEGKPTFHXFN-SSDOTTSWSA-N	447.429	1.591	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNc2ccc(OC)cc2)cc(S(C)(=O)=O)c1	783021783	HNPRIBAFQPWBQU-UHFFFAOYSA-N	435.458	1.357	50	20	IDGD	
Cc1ccc(C)c(NNC(=O)C(=O)Nc2cccc(S(=O)(=O)N3CCOCC3)c2)c1	783366519	JNRNTLZWNYJCQA-UHFFFAOYSA-N	432.502	1.406	50	20	IDGD	
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)NNC(=O)c1ccc(Cl)cc1F	783838046	UFYFWIDABVNVHV-UHFFFAOYSA-N	431.785	1.797	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2ccccc2CS(=O)(=O)c2ccccc2)ncn1	783944883	DZSDWSCGECIXSN-UHFFFAOYSA-N	425.470	1.841	50	20	IDGD	
Cc1nc(-c2ccc(NC(=O)C(=O)NNC(=O)CNC(=O)c3ccco3)cc2)cs1	784004216	LAGAFKNVHPPLNI-UHFFFAOYSA-N	427.442	1.227	50	20	IDGD	
CS(=O)(=O)CCOc1ccc(Cl)cc1NC(=O)C(=O)NNc1ccnc(F)c1	784847296	ZMKPFEQHSNKAOQ-UHFFFAOYSA-N	430.845	1.379	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccc(C(F)(F)F)nn2)cc1	784886038	JXFCBNDMCDDRSE-UHFFFAOYSA-N	446.411	1.264	50	20	IDGD	
Cc1cc(C)nc(Sc2ccc(NC(=O)C(=O)NNc3nccn(C)c3=O)cc2)n1	785086388	NFYDBFFCZPTASQ-UHFFFAOYSA-N	425.474	1.420	50	20	IDGD	
COCCc1ccccc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccc(C(C)=O)cc1	786413559	BWQSYAFQPWKHEL-OAHLLOKOSA-N	427.457	1.632	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)[C@H]3CC(c4cccnc4)=NO3)n[nH]2)cc1OC	790829956	JPSVVTWQXRDZKR-LJQANCHMSA-N	436.428	1.443	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)[C@@](C)(O)Cn2c(C)cccc2=O)cc1OC	792031711	ZWKAETODQJSMPX-QFIPXVFZSA-N	431.489	1.556	50	20	IDGD	
Cc1cccc(CCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)n1	792236868	UIKWCSGHDDAPHO-UHFFFAOYSA-N	431.518	1.361	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)cccc1NC(=O)N(C)C	792356463	RIRFBRLKEBQMAQ-UHFFFAOYSA-N	436.472	1.829	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)c1cccc(NN2C(=O)[C@H]3CC=CC[C@H]3C2=O)c1	792790644	ZSYBXRHUOZQQGL-CALCHBBNSA-N	448.435	1.768	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NCCc1cccc(OCC(F)(F)F)c1	792882282	LHECPIJGYPQZKD-UHFFFAOYSA-N	444.435	1.992	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(CC(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)cc1	793481262	ZYOXZRIETSRNOF-UHFFFAOYSA-N	447.521	1.223	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)[C@H]2CCCCN2S(=O)(=O)c2ccc([N+](=O)[O-])cc2)n1	794078073	VFZPVYMIABLLHS-QGZVFWFLSA-N	447.473	1.303	50	20	IDGD	
CNC(=O)COc1ccc(NC(=O)C(=O)NNc2ccccc2Br)c(C)c1	797029246	BUCSDNSSRINJCB-UHFFFAOYSA-N	435.278	1.964	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)Cc2cccnc2)cc(Br)cc1[N+](=O)[O-]	797535282	KWEXGLRYUHFCHR-UHFFFAOYSA-N	436.222	1.389	50	20	IDGD	
CNc1nc(C)cc(C(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)n1	798154394	GPVYHDRUUNGSPH-UHFFFAOYSA-N	446.514	1.764	50	20	IDGD	
CN(C)Cc1cc(NC(=O)C(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)ccc1Cl	799261477	FVYIJZXZHNPCMP-UHFFFAOYSA-N	435.824	1.415	50	20	IDGD	
CC(C)(C)OC(=O)NCC[C@H]1CCCN(C(=O)NNC(=O)CNC(=O)c2ccco2)C1	799367312	BKDXLIMJHLGZGY-CQSZACIVSA-N	437.497	1.377	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2ccccc2S[C@H](C)C(N)=O)c2ccccc2c1=O	801103505	IBCWDUZTBSLWHV-GFCCVEGCSA-N	439.497	1.457	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2CS[C@@H](Cc3ccccc3F)C(=O)N2)cc1	801105229	BTGBYRAVGTYDOF-SJORKVTESA-N	444.488	1.063	50	20	IDGD	
COc1cc(N2CCN(CC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)CC2)ccc1F	801963867	KSJXQPCUECKAJT-UHFFFAOYSA-N	431.424	1.326	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)[C@H]2CC(=O)N(CC(F)(F)F)C2)cc1Cl	802075756	JSNHPUSEWJKMFH-QMMMGPOBSA-N	438.790	1.921	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccccc1)Nc1ccc2c(c1)OCO2	802099165	DUBUUODWBRAUQH-MRXNPFEDSA-N	446.485	1.811	50	20	IDGD	
COc1ccc(CS(C)(=O)=O)cc1NC(=O)NNC(=O)COc1ccccc1OC	806637361	DXVALBVZPQYFCK-UHFFFAOYSA-N	437.474	1.480	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)c1ccc2ncc(I)n2c1	807369326	VSDWQFWGLIYPIK-UHFFFAOYSA-N	446.245	1.489	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)[C@@H]1CC(=O)N(C)[C@@H]1c1ccc(Cl)c(F)c1	807372118	YTHRVDTWCZNEQM-MLGOLLRUSA-N	429.876	1.935	50	20	IDGD	
Cc1cc(NS(=O)(=O)c2cccc(C(=O)NNc3ccc(-n4ccnc4)nn3)c2)no1	807412316	WBVPCDLZWZUAHQ-UHFFFAOYSA-N	440.445	1.516	50	20	IDGD	
Cc1cc([N+](=O)[O-])ccc1NNC(=O)C(=O)Nc1ccc(S(=O)(=O)C(F)F)cc1	807456996	MFOQLYHIDCIDAX-UHFFFAOYSA-N	428.373	1.981	50	20	IDGD	
CCOC(=O)c1cccc(NC(=O)c2cccc(NC(=O)C(=O)NNc3cccnn3)c2)c1	810397670	WUYDWDZXWXLEOR-UHFFFAOYSA-N	448.439	1.987	50	20	IDGD	
C[C@@H]1SCCC1=NNC(=O)C[C@H](C(=O)NN=C1CCS[C@@H]1C)N1CCOCC1	814855814	UJWYZPPXVPEKHW-WOSRLPQWSA-N	427.596	1.073	50	20	IDGD	
CNC(=O)c1cc(Oc2cccc(NC(=O)C(=O)NNC(=O)CC(F)(F)F)c2)ccn1	815568378	FSIWDLRUUYISHB-UHFFFAOYSA-N	439.350	1.272	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)C(=O)Nc1cc(F)cc(F)c1F	815582346	CTNCVXCFEAIARO-UHFFFAOYSA-N	443.407	1.105	50	20	IDGD	
COC(=O)N1CCN(c2ccc(NC(=O)C(=O)NNc3cc(Cl)ccn3)cn2)CC1	815602181	RBHXNGWCGFACGK-UHFFFAOYSA-N	433.856	1.100	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)CN1C(=O)[C@H]2CC=CC[C@H]2C1=O	815854478	DPSPBZRHIUFFFA-OKILXGFUSA-N	434.518	1.158	50	20	IDGD	
O=C(NNc1nc[nH]n1)c1cc(O)nc2ccc(S(=O)(=O)Nc3ccc(F)cc3)cc12	816633988	UTDOWJIVXDJONY-UHFFFAOYSA-N	443.420	1.755	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)[C@@H](CS(C)(=O)=O)c2ccccc2)cc1	816817430	BQXOALJOYNFPGQ-BEFAXECRSA-N	434.514	1.828	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)C2(S(C)(=O)=O)CCOCC2)c1	818746550	SOIBBHIEDBWIOT-UHFFFAOYSA-N	435.296	1.273	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)c2ccc(S(=O)(=O)N(C)C)o2)c1	818757013	PHWDWDHPARDAAF-UHFFFAOYSA-N	446.279	1.836	50	20	IDGD	
CNC(=O)CN1CCC(NC(=O)/C(C#N)=C/c2cn(CCC#N)nc2-c2ccccc2)CC1	914782323	QOPFKNHOZDQXDH-XMHGGMMESA-N	445.527	1.697	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)c1ccc(=O)n(-c2ccc(F)cc2)n1	914846543	MOSKCJAOVLJYCI-UHFFFAOYSA-N	434.431	1.745	50	20	IDGD	
COCC(=O)NNC(=O)Cc1csc(=NCc2ccco2)n1-c1cccc(OC)c1	915775884	VBBQLNURXSTQDR-UHFFFAOYSA-N	430.486	1.578	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)nn1-c1ccccc1)N[C@H]1CCS(=O)(=O)C1	915880689	WCXSJWDFBLNQKN-INIZCTEOSA-N	439.497	1.670	50	20	IDGD	
COc1cc(C=NNC(=O)COc2ccc(C)cc2)ccc1OCC(=O)N1CCOCC1	916326686	JRFYTTZMEADVMI-UHFFFAOYSA-N	441.484	1.770	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2cccc(C(=O)N(C)C)c2)ccc1OC(C)C	917727918	SRFZLEWATLTHJP-UHFFFAOYSA-N	435.502	1.808	50	20	IDGD	
N#Cc1ccc(CSCC(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1	919208199	XFGPPUSCSSPQRM-UHFFFAOYSA-N	428.426	1.704	50	20	IDGD	
COc1ccc(-n2ccc(CNC(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)n2)cc1	919916521	KPXXMCIIZRJIMW-UHFFFAOYSA-N	443.485	1.429	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)c3ccc(N4NC(=O)CCC4=O)cc3)n[nH]2)cc1	920299769	PEHIOPMIQIANBD-UHFFFAOYSA-N	432.440	1.618	50	20	IDGD	
O=C(COC(=O)[C@@H]1CCCN1C(=O)Cc1ccccc1)NNC(=O)c1cccc(Cl)c1	920684149	YNODGBWAROAJGO-SFHVURJKSA-N	443.887	1.878	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N(C)Cc2cnn(C)c2)cc1	920854755	POHVSLOVOPIQSN-VCHYOVAHSA-N	447.499	1.733	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H](C)OC[C@@H]2CCCCO2)c1	921165049	HIQPPKHVBKQPAT-RDJZCZTQSA-N	441.550	1.452	50	20	IDGD	
CC(=O)NCC(=O)NCC(=O)NNC(=O)c1ccc(CSc2ccc(Cl)cc2)cc1	921165347	KWJDKCLZIKGPED-UHFFFAOYSA-N	448.932	1.646	50	20	IDGD	
COc1ccc(SCC(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1	921175527	HPJGWWABFNYTKA-KRWDZBQOSA-N	432.454	1.318	50	20	IDGD	
NC(=O)[C@@H]1CCCN(c2ccc(C(=O)NNC(=O)c3cc(Br)c[nH]3)cc2)C1	1115885117	QBTLKVCVHQKORG-GFCCVEGCSA-N	434.294	1.554	50	20	IDGD	
Cc1nc(C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)ccc1C#N	1116288505	GBLKVJWBAXQVRX-UHFFFAOYSA-N	426.908	1.494	50	20	IDGD	
O=C(N[C@@H](Cc1ccccc1)C(=O)NNC(=O)c1n[nH]c2c1CCCC2)c1cccnc1	1318018207	YVLQRBFPVBIEBE-IBGZPJMESA-N	432.484	1.486	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCc2cc(OCC(F)F)ccn2)c2ccccc2c1=O	1319912080	BSKITNLMPVAMJS-UHFFFAOYSA-N	446.414	1.600	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)Nc1cc(N2CCOC2=O)ccc1F	1320122051	HGKSEPWKPHISLM-UHFFFAOYSA-N	443.439	1.642	50	20	IDGD	
N#C/C(=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)NCCN1CC=CC1	1322269454	GMPGNXTUNGOHDW-LGMDPLHJSA-N	438.919	1.974	50	20	IDGD	
CNS(=O)(=O)c1ccc(CC(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)cc1	1337842288	LLJYUYBRPWGPAX-UHFFFAOYSA-N	431.449	1.128	50	20	IDGD	
O=C1COc2ccc(C(=O)N3CC[C@H]4OCCC[C@@]4(CNC(=O)[C@@H](F)Cl)C3)cc2N1	1778026386	UBGBVXCGGYEGQP-WRWLIDTKSA-N	439.871	1.679	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(OC)cc(OC)c3F)C2)C1	1780132516	JDQDEAXFWBVXTR-YWZLYKJASA-N	444.887	1.540	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)nn1C(F)F	1780305770	BTBWRJVVBZDIDH-NHYWBVRUSA-N	439.232	1.721	50	20	IDGD	
O=C(CS[C@@H]1CCCCO1)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781331478	LJHQRYTUPZXQAX-IIAWOOMASA-N	439.347	1.767	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CSc1ncccn1)C2	1782170816	ZIXBQOAPFNCMTG-SPYBWZPUSA-N	442.969	1.336	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccccc1C(N)=O)C2	1782179820	VEDMUIQVGWLZMV-CBGDNZLLSA-N	437.924	1.167	50	20	IDGD	
Cc1ccccc1CCC(=O)N1CC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1	1783305558	DULTWAXWIBXAAT-HSZRJFAPSA-N	430.549	1.131	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3nccc4nc[nH]c34)CCO2)C1	1783347500	JWFXKLNCZGLKGS-SGTLLEGYSA-N	436.310	1.575	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)C/N=C/c3ccco3)CCO2)C1	1783349235	KJWMFVKAJJPRAK-ZCTOSJTPSA-N	426.311	1.702	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(O)nc4ccccc34)CCO2)C1	1783875170	OIISYECQWLQRMK-KKSFZXQISA-N	433.892	1.638	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cncnc3)C[C@@H]21	1783969312	KVAXPEIMVULACL-TUUVXOQKSA-N	425.327	1.030	50	20	IDGD	
O=C(CSc1ccncc1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21	1785160685	QGKYKKORILCTSX-ATVPRXPUSA-N	446.342	1.844	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21)c1ccc(N2CCOCC2)cn1	1785722892	KYEBAOAMVKLENT-IKICRFKJSA-N	440.903	1.046	50	20	IDGD	
CCC(=O)N[C@@H](C)C(=O)Nc1ccc(C2(NC(=O)CCC(=O)NN(C)C)CCC2)cc1	1786295005	AZGMSWQXZHGEKK-HNNXBMFYSA-N	431.537	1.408	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC1(c2ccc(NC(=O)CCc3cnc[nH]3)cc2)CCC1	1786809791	OHQVEHBQRQFGCX-UHFFFAOYSA-N	426.521	1.849	50	20	IDGD	
CCCCC[C@@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2C1	1786984941	BWKVNDYFDLHVHU-LGYWMIHWSA-N	430.354	1.176	50	20	IDGD	
O=C(CN1CCCCC1)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1	1788140688	KBMIKKSHAXEOAP-UHFFFAOYSA-N	435.333	1.600	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccccc3-n3nccn3)[C@H]2C1	1790166551	XJBUHFGHGDWHRW-XPYUAMARSA-N	431.924	1.878	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnn4cccc(F)c34)[C@H]2C1	1790520632	QQBXSSBPMXUURF-QEWYBTABSA-N	438.887	1.321	50	20	IDGD	
C[C@@H](Cc1ccncc1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21	1790579544	ZRPGNTSJWNSSMY-SRQBIAJPSA-N	442.329	1.930	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCCC(=O)OC(C)(C)C)C[C@@H]21	1791249001	DEBVWYHGWAAJKZ-NXOAAHMSSA-N	446.972	1.732	50	20	IDGD	
N#Cc1ccc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Br)C3)cc1	1792425693	WNXCSRBRYCZVFS-MVJTYMMSSA-N	438.297	1.771	50	20	IDGD	
CC(C)N[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)CBr)C(C)C	1792867785	KVHSHGIEOHTLBO-UHDSXZAQSA-N	432.403	1.630	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CCc2ccccc2[C@H]1O	1793039072	ZXVBRWLNUQUWKO-IZHZWAPYSA-N	446.620	1.724	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1cccc(C)n1	1793278926	XYDWRAYKPCGIDK-INZAXJFKSA-N	436.516	1.705	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@](C)(O)C(F)(F)F	1793693894	AWFRQWMSVFVSQB-KKSJPVRNSA-N	431.249	1.063	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1CCN(c3ccc(F)cn3)CC1)C2)[C@H](F)Cl	1796370606	NJJIEDPRPQMVCZ-DACLVMHWSA-N	442.894	1.561	50	20	IDGD	
CC(C)(CCl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1CCN(S(C)(=O)=O)CC1	1797703107	OOOGRSGLKFHMOY-MUJYYYPQSA-N	434.002	1.561	50	20	IDGD	
CC(=O)Nc1ccccc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CO[Si](C)(C)C	1797959293	LOPMARXLDBVXGU-CWPLJXCYSA-N	433.581	1.700	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H]1CNc3ccccc31)C2	1798439256	SQAPOBZKPUAMAH-KRXQYRFLSA-N	434.500	1.146	50	20	IDGD	
Cc1nc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)ccc1F	1798440644	GEPJCOYOEMOICX-BTTYYORXSA-N	426.452	1.093	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c(n1)OCCO3)C2	1799274940	FEZOEZFBCHVHQR-CVGJEZRXSA-N	444.315	1.292	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2)c1ccc(Br)c(O)c1	1799584236	FQTCILGUEQPTCM-RDBQEKCUSA-N	435.677	1.892	50	20	IDGD	
CC[C@H](CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](O)CCl)C2)NC(=O)OC(C)(C)C	1800184308	VHZIFSAJJXBXQX-IBEHDNSVSA-N	431.961	1.918	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnoc1)C2)[C@@H](Br)Cc1ccccc1	1800434790	AVIKXGLYKARALJ-MHORFTMASA-N	448.317	1.884	50	20	IDGD	
O=C(/C=C/c1cccc(O)c1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2	1800591393	GZRQCUFMGQOUFG-CYYRZDKHSA-N	427.270	1.686	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Br)C2	1800644144	KBAGCEZIDCMTSH-RMPHRYRLSA-N	426.149	1.533	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3cc(O)ccc3n1)C2	1800758364	XTNDBAWRZQNIAP-GNTLTTKYSA-N	448.317	1.927	50	20	IDGD	
COc1cc(F)c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)Br)c(F)c1	1800759943	SNHLKGWFXHRZIE-DJQAVVSRSA-N	447.276	1.960	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CCCN1C(=O)OC(C)(C)C	1800784574	WRTANDHWSBAAPB-QEOTZNIISA-N	443.972	1.993	50	20	IDGD	
CC[C@H](NC(C)=O)C(=O)NC[C@H]1CCN(C(=O)CO[Si](C)(C)C)[C@H]1c1cccnc1	1802547624	HHSXBRODLKQMMF-HBFSDRIKSA-N	434.613	1.854	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2nccc3nc[nH]c23)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803138852	GHDTVYUBTALCBL-DHSIGJKJSA-N	428.880	1.272	50	20	IDGD	
Cn1cc(C(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)c(C(F)F)n1	1803139353	ONEJDULBSIDNIZ-INWMFGNUSA-N	441.866	1.672	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)C1=CCCS1	1803634866	UHWJMZIXMSEFSW-XLIONFOSSA-N	437.330	1.102	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](COC)NC(C)=O)[C@H]1c1cccnc1	1803692711	XBOPGZYQUGIRNA-OKYOBFRVSA-N	438.956	1.646	50	20	IDGD	
Cc1onc(C(=O)NC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)c1C	1803891613	LLHAADINRDQAHN-LAUBAEHRSA-N	442.520	1.379	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@H](F)C[C@H]1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](O)CCl)C2	1804553567	ALMCLAASMFHBFU-IATJYDTKSA-N	447.935	1.572	50	20	IDGD	
O=C(CCN1CCOCC1)NC[C@@H]1CCN(C(=O)C(Cl)Cl)[C@@H]1c1cccnc1	1806957191	RJRYLNCBUFAKAA-DOTOQJQBSA-N	429.348	1.613	50	20	IDGD	
COC(=O)CCC(=O)N1CC[C@H](CNC(=O)[C@H](F)Br)[C@@H]1c1cccnc1	1808661540	LTBGNLFRMZEBCX-KCXAZCMYSA-N	430.274	1.731	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2cc3ncccn3n2)[C@@H]1c1cccnc1	1809766986	DDPSCQWHKAWLCM-GJYPPUQNSA-N	442.907	1.698	50	20	IDGD	
O=C(c1ccc2cncn2c1)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1	1809972563	QKLPZTKSEVJYTI-UHFFFAOYSA-N	446.316	1.173	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@H](CNC(=O)C2=NNC(=O)C2)[C@H]1c1cccnc1	1810221057	FUBCJLCVXSEZQV-PNPHSEOMSA-N	426.304	1.200	50	20	IDGD	
CC[C@H](NC(C)=O)C(=O)N1CC[C@H](CNC(=O)[C@H](C)Br)[C@@H]1c1cccnc1	1812864548	WBLWXELPJCVNQA-IEAZIUSSSA-N	439.354	1.786	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1CCc2nc(NC(=O)CN3CCCC3=O)sc2C1	1814598228	ZTJLCHBZCWGVIB-QGHHPUGFSA-N	433.361	1.914	50	20	IDGD	
C[C@H](C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1)n1ccnc1	1815006648	GHUJKJUVDMQTQR-GDBMZVCRSA-N	430.513	1.233	50	20	IDGD	
CC(=O)C(C)(C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1815077386	POKUSVSIJXPKOV-KRWDZBQOSA-N	426.282	1.011	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)Cc3cscn3)sc2C1	1815522599	CRCYCDLNVIHEQX-NSHDSACASA-N	436.563	1.127	50	20	IDGD	
Cc1c[nH]cc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnccc1C(=O)NN)CC2	1817527290	BPSSQZLSJOEAKL-LLVKDONJSA-N	439.501	1.318	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1ccncc1F	1818394058	QWUVWWNGWVLCMR-SFHVURJKSA-N	437.240	1.243	50	20	IDGD	
CN1CCN(CC(=O)Nc2cc([C@H]3CCCCN3C(=O)CO[Si](C)(C)C)[nH]n2)CC1	1818912879	LDQUKFWZYYICEI-QGZVFWFLSA-N	436.633	1.501	50	20	IDGD	
CC(C)O[C@H](C)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnccc1C(=O)NN)CC2	1820009877	HWVCOHCGMGBHRU-NEPJUHHUSA-N	446.533	1.181	50	20	IDGD	
Cc1c(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)[C@@H](F)Cl)[nH]n2)cn2[nH]cnc(=O)c12	1820117496	HWORVRXRNHIBTQ-SWLSCSKDSA-N	435.847	1.894	50	20	IDGD	
C[C@H](Br)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H]2CCC(=O)N2C)[nH]n1	1822190678	UQOAVRAZCQJCAJ-UHTWSYAYSA-N	426.315	1.806	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CSCC(=O)OC)[nH]n1	1822371394	RQAVFXBHJVEQQK-AAEUAGOBSA-N	432.930	1.562	50	20	IDGD	
CC(=O)C(C)(C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1	1824373939	WPBXAQUBELFNQE-HXUWFJFHSA-N	428.338	1.215	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](C)n1cnnn1)CC2	1825453154	PXMLFUSSJKFYFI-BBBLOLIVSA-N	442.343	1.476	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(C(=O)O)ncn2)CC1	1825508345	RAAXWMGRYFVPGL-PBHICJAKSA-N	438.912	1.662	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(CO)on1)CC2	1825645751	JETBXAMJZKBFTQ-HTQZYQBOSA-N	429.296	1.633	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)C(C)(C)NCCC#N)CC2	1825999660	SVPFZYJLJJSQAU-NEPJUHHUSA-N	427.958	1.591	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc3cccnn3n1)CC2	1826003185	HPJAMFXZZPLSJJ-CMPLNLGQSA-N	434.909	1.665	50	20	IDGD	
C/C=C/C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCN2C(=O)OCc1ccccc1	1828551311	MOAASXBKTIZFLO-AKBBZARKSA-N	449.935	1.614	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)CN2CCCC2)CC1	1828922327	SJFJYKXXPMMDHM-FQEVSTJZSA-N	442.564	1.014	50	20	IDGD	
C#CC(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)[C@@H](Cl)COC)C2)C1	1829267654	XCHOFVFMRZFCDB-PGRDOPGGSA-N	447.919	1.326	50	20	IDGD	
O=C(c1cc(C2CC2)on1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1830198839	UCVQJRLJRJUPRC-YOEHRIQHSA-N	446.273	1.313	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCC(=O)N3CCCC3)C2)C1	1831639768	DRRQBLSMAHIOED-UWJYYQICSA-N	443.972	1.253	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3snnc3C3CC3)C2)C1	1831647090	QDGUHRNZFRXIIE-AUUYWEPGSA-N	442.969	1.893	50	20	IDGD	
CN1CCC(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](F)Br)CC3)CC2)CC1	1833104755	AUVQVJIWNGTHIB-QGZVFWFLSA-N	447.393	1.590	50	20	IDGD	
CC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)[C@H](C)CBr)CC2)CC1	1833262200	JNROIMMLOAYOAQ-CQSZACIVSA-N	430.387	1.958	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC(N2CCC(NC(=O)CCc3cnc[nH]3)CC2)CC1	1833789258	TVWXBXDYLVKYMJ-UHFFFAOYSA-N	435.645	1.765	50	20	IDGD	
O=C(CCc1ccc2c(c1)OCO2)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1835180501	JDKFEXIRIYNQGB-AZUAARDMSA-N	442.871	1.339	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCC(N2CCC(NC(=O)c3c[nH]c(=O)cn3)CC2)CC1	1836140277	LKCZZMDDZDEWGQ-LJQANCHMSA-N	444.363	1.191	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4cccn4cn3)C2)C1	1837713299	UROUJEDJZICAMM-OAQYLSRUSA-N	446.580	1.256	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccnc(Cl)n3)CCO2)C1	1837919885	SKUVBCJKGCEGMH-SCLBCKFNSA-N	431.320	1.608	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)Cn3cccn3)CC2)CC1	1837973179	FYOWHQKJMOXVAQ-AWEZNQCLSA-N	427.343	1.665	50	20	IDGD	
CCc1nc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](C)CBr)C3)C2)co1	1838131659	LCFPMSGUWZWBFP-ACJLOTCBSA-N	444.326	1.338	50	20	IDGD	
COC(=O)C1(C(=O)N2CCC(OC3CCN(C(=O)CO[Si](C)(C)C)CC3)CC2)CC1	1838432109	UQJXRLYJXRGMRX-UHFFFAOYSA-N	440.613	1.790	50	20	IDGD	
Cc1cc(F)cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)c1	1839284654	FMAMCISKJMVCTJ-CRAIPNDOSA-N	447.276	1.895	50	20	IDGD	
Cc1cccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)n1	1840030937	AVHGORJFPNGAKU-KBXCAEBGSA-N	426.311	1.243	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(C)c(Cl)c3)C2)C1	1840149651	WNIQEJWGCNMCFY-FXAWDEMLSA-N	445.343	1.972	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4cc(C)ccc4[nH]3)C2)C1	1840152813	UVKDOCNTXIFQRB-HTAPYJJXSA-N	449.935	1.800	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(N(C)C)c3)C2)C1	1840154412	WPKGMKYNOPXQQL-WIYYLYMNSA-N	439.940	1.076	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3cccc(O)c3)C2)C1	1840155529	DWUFMDDTUXRGSB-RXVVDRJESA-N	440.924	1.035	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3C[C@H]3c3ccccc3)C2)C1	1840156559	VEUQFDQICRPXDQ-JZJXAQOMSA-N	436.936	1.500	50	20	IDGD	
O=C(c1cnc2ccccc2n1)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840187709	RKCFQLHTQJKQNS-IBGZPJMESA-N	439.299	1.504	50	20	IDGD	
Cc1ccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)o1	1840508665	DLCUVUMYRNIYGY-DOTOQJQBSA-N	433.274	1.277	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC12CN(C(=O)[C@H]1CC[C@@H]3CCC(=O)N3C1)C2	1841288268	KGPIQHAGLXSBTR-QLFBSQMISA-N	426.355	1.622	50	20	IDGD	
COC(OC)C(=O)N1CCCC12CN(C(=O)[C@@H](Br)Cc1ccccc1)C2	1841488155	XXRBIYLDNXULCC-HNNXBMFYSA-N	425.323	1.815	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(O)(C(=O)N2CCCC23CN(C(=O)[C@@H](F)Cl)C3)CC1	1841788768	VKBOXZNRXGKBJE-CYBMUJFWSA-N	433.908	1.486	50	20	IDGD	
Cc1nc(C(=O)N2CCCC23CN(C(=O)CN(C)NC(=O)NCc2ccccc2)C3)co1	1842456165	PCUYJFIJEKAAQX-UHFFFAOYSA-N	440.504	1.146	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)N1CCCC12CN(C(=O)[C@@H](Br)Cc1ccccc1)C2	1844372630	UDEHPRAHPNTGGS-WBVHZDCISA-N	448.361	1.887	50	20	IDGD	
O=C(OCCO)c1ccccc1C(=O)N1CCCC12CN(C(=O)CCBr)C2	1844718841	XGYARVZDCIQDET-UHFFFAOYSA-N	439.306	1.438	50	20	IDGD	
C#CCCCC(=O)N1CC2(CCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)C1	1845039506	WHOUXUUXZBQOKM-UHFFFAOYSA-N	425.533	1.340	50	20	IDGD	
CN(CC(=O)N1CC2(CCCN2C(=O)[C@H](F)Br)C1)C(=O)c1ccccc1	1845215775	DOINFWSQWIZTMB-HNNXBMFYSA-N	426.286	1.653	50	20	IDGD	
CCOC(=O)c1cc(C(=O)N2CC3(CCCN3C(=O)[C@H](F)Br)C2)ccn1	1845218500	ISRKFUGPAYPHES-ZDUSSCGKSA-N	428.258	1.766	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@@H](C)C(=O)N2CC3(CCCN3C(=O)C(Cl)Cl)C2)cc1	1846386781	XDBCLHMXQYOJDK-ZDUSSCGKSA-N	448.372	1.669	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](CC(=O)N2CCCC23CN(C(=O)[C@@H](O)CCl)C3)C1	1846471799	MYVVURHDDYTPOA-CABCVRRESA-N	429.945	1.437	50	20	IDGD	
O=C(NNC(=O)c1cncn1-c1ccccc1)c1ccc(S(=O)(=O)N2CCCC2)cc1	22663222	MYZKKRYVQOCAGX-UHFFFAOYSA-N	439.497	1.732	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1N1CCOCC1)c1cc(Br)c[nH]1	23914377	OYJNSJHGGGHWBL-UHFFFAOYSA-N	438.238	1.597	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)NCc1ccc(NC(=O)c2cccnc2)cc1	725872602	ZLHCBLCPCWIDID-UHFFFAOYSA-N	436.428	1.187	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1cccc(N(C)C)c1)c1cccc(S(=O)(=O)N(C)C)c1	727610097	PYVCLPOJYYPPKR-CQSZACIVSA-N	433.534	1.708	50	20	IDGD	
Cc1cc(C)c(S(=O)(=O)NCCC(=O)NNc2nc(-c3cccnc3)no2)c(C)c1	728078356	BMSLZRLFYVOZFD-UHFFFAOYSA-N	430.490	1.869	50	20	IDGD	
O=C(COC(=O)c1csc(-c2ccccn2)n1)NNC(=O)[C@@H]1COc2ccccc2O1	728341508	ZSBDYFAMLFTPQP-INIZCTEOSA-N	440.437	1.349	50	20	IDGD	
Cc1nn(-c2ccc(Br)cc2)c(C)c1C=NNC(=O)[C@H](C)NS(C)(=O)=O	728435303	XKZHATDNRDIVNB-NSHDSACASA-N	442.339	1.639	50	20	IDGD	
Cc1ccc(C(=O)NNS(=O)(=O)c2ccc(Br)cc2[N+](=O)[O-])c(O)c1	728503943	GCNFUGFTVBSNKM-UHFFFAOYSA-N	430.236	1.995	50	20	IDGD	
CNS(=O)(=O)c1cccc(NC(=O)CNC(=O)NNC(=O)CCC2CCCCC2)c1	729229107	QPLYLCLUPLKDJT-UHFFFAOYSA-N	439.538	1.224	50	20	IDGD	
Cc1nn(C(C)(C)C)c2nc(C(C)C)cc(C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)c12	729274006	FRXOWCHNMQKWNR-GFCCVEGCSA-N	438.554	1.317	50	20	IDGD	
CCOc1ccc(/C=C(\C#N)C(=O)NCC(=O)Nc2cccc(S(=O)(=O)NC)c2)cc1	729418014	RPARZULYSOAWFW-LFIBNONCSA-N	442.497	1.655	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)[C@@H]2CC(=O)N(C[C@H]3CCCN3CC)C2)cc1OC	729628453	UVUVGOQYTIKOLP-IAGOWNOFSA-N	432.521	1.188	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)c2nn(-c3ccccc3F)c(C)cc2=O)cn1	729692483	ISGWSDCFJGYHJM-UHFFFAOYSA-N	428.449	1.715	50	20	IDGD	
Cc1cc(C)n2nc(SCc3ccccc3C(=O)NNC(=O)Cc3cc[nH]n3)nc2n1	730091571	LHJMHKWVTUDDRD-UHFFFAOYSA-N	436.501	1.760	50	20	IDGD	
O=C(NN=Cc1cc(Br)cc(Br)c1O)[C@@H]1CCS(=O)(=O)C1	730578313	PLMTVZZRWZUEBJ-SSDOTTSWSA-N	440.113	1.802	50	20	IDGD	
C[C@H]1CN(Cc2ccc(CNC(=O)NNC(=O)COc3ccccc3O)cc2)C[C@H](C)O1	730823872	ZFOYDICHKXJMIC-IRXDYDNUSA-N	442.516	1.911	50	20	IDGD	
O=C(CCCS(=O)(=O)c1ccc(Br)cc1)NNC(=O)Cc1cccnc1	730969515	IIWXZTAJFVRMDK-UHFFFAOYSA-N	440.319	1.788	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)CNC(=O)c1c(Cl)cccc1[N+](=O)[O-]	731051253	XUIQUVISJKSJEP-SNVBAGLBSA-N	438.799	1.732	50	20	IDGD	
O=C(CN1C(=O)COc2ccc(Cl)cc21)NNC(=O)c1cnn(-c2ccccc2)c1	733110437	MEVAZLVPLSZHKM-UHFFFAOYSA-N	425.832	1.712	50	20	IDGD	
CC(C)CNS(=O)(=O)c1cc(C(=O)NNC(=O)c2cnn(C)c2)c(Cl)cc1Cl	735473537	ZWZJVINEBOLKNS-UHFFFAOYSA-N	448.332	1.736	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)N[C@@H]1CCN(c2cnn(C)c2)C1=O	735512505	NDJBELCFFRKACQ-OAHLLOKOSA-N	439.501	1.602	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)c2cc(S(C)(=O)=O)ccc2F)cc1C	736798022	ZWZLJLHIMQKCER-UHFFFAOYSA-N	442.490	1.780	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)c2ccc(CS(C)(=O)=O)o2)cc1C	736806376	HJZCLGNLUQJPBK-UHFFFAOYSA-N	428.488	1.375	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cc(C)c3c(O)nc(O)nc3n2)ccc1OC(C)C	740748843	ALJPWIWMKZBYLE-UHFFFAOYSA-N	427.417	1.615	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)[C@H](NC(=O)Cc1ccc2ccccc2c1)C(C)C	740850878	CRNPOTJNIUGVBL-OAQYLSRUSA-N	440.544	1.975	50	20	IDGD	
COc1cc(C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)c([N+](=O)[O-])cc1OC	741821455	VAWGQTLHXLYTTA-UHFFFAOYSA-N	428.357	1.102	50	20	IDGD	
CC(C)NC(=O)C(=O)NNC(=O)CCSCc1nc(O)c2c3c(sc2n1)CCC3	744447842	PTUAKLRWSOCERJ-UHFFFAOYSA-N	437.547	1.181	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)[C@@H]1CCCN(C(=O)NC2CCCC2)C1	746201227	UMWFBDWQMZVBRO-OAHLLOKOSA-N	449.577	1.935	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)c1ccc(CS(N)(=O)=O)cc1	746343422	DPHOLAHDGNEAJF-CQSZACIVSA-N	427.482	1.857	50	20	IDGD	
CS(=O)(=O)Nc1cc(C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)ccc1Cl	747206700	MOGBCBXKDSYJDL-UHFFFAOYSA-N	449.876	1.678	50	20	IDGD	
COc1ccc(CN2C(=O)c3ccccc3C2=O)cc1C(=O)NNC(=O)Cc1ccncc1	747326005	GBNUPYVPLRYHCH-UHFFFAOYSA-N	444.447	1.890	50	20	IDGD	
O=C(C/N=C1/NS(=O)(=O)c2ccccc21)NNc1ccc(Br)cc1F	748203254	AVZUZSWYXXHXTH-UHFFFAOYSA-N	427.255	1.770	50	20	IDGD	
Cc1ccc(C)n1-c1ccc(C(=O)NNC(=O)NCC2CCN(S(C)(=O)=O)CC2)cc1	749017823	VNXFKTLFPKXCPX-UHFFFAOYSA-N	447.561	1.710	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN2CCN(c3nccn4cnnc34)[C@H](C)C2)cc1C	749450088	PRBKWLRZSRSSCH-CQSZACIVSA-N	442.549	1.028	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)CNS(=O)(=O)c2ccc(Cl)s2)c1	749838852	WLKCRQIWBBKGNG-UHFFFAOYSA-N	431.923	1.523	50	20	IDGD	
O=C(O)CCCOc1ccc(S(=O)(=O)NNC(=O)c2ccccc2O)cc1Cl	751266487	FEVPNLGZZNSINK-UHFFFAOYSA-N	428.850	1.913	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)ccc1[N+](=O)[O-]	751292906	DAYFKKZVZBMKIM-UHFFFAOYSA-N	448.457	1.463	50	20	IDGD	
Cc1ccc([C@@]2(C)NC(=O)N(CC(=O)NNc3nc4ccccc4c(=O)n3C)C2=O)cc1	752907968	QICQFWSQDUIHLQ-JOCHJYFZSA-N	434.456	1.152	50	20	IDGD	
CON(C)S(=O)(=O)c1ccc(NC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1	755531136	AEWWTVWDFSHZAH-UHFFFAOYSA-N	444.473	1.521	50	20	IDGD	
CN1CCN(C(=O)c2ccccc2NC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)CC1	755622965	LPHPOLURVDQVFN-IBGZPJMESA-N	439.472	1.067	50	20	IDGD	
CCc1cnc(NC(=O)C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)s1	756165519	XRJNNJLRXGAXMG-UHFFFAOYSA-N	430.534	1.004	50	20	IDGD	
NC(=O)CN(Cc1ccccc1)c1cccc(NC(=O)NNC(=O)Cc2ccncc2)c1	756392750	JIIYOPLZCVWYLW-UHFFFAOYSA-N	432.484	1.969	50	20	IDGD	
CCNC(=O)N1CCc2ccc(NC(=O)NNC(=O)COc3ccccc3[N+](=O)[O-])cc21	756730799	SLXABFVNDCLTLD-UHFFFAOYSA-N	442.432	1.919	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)NNC(=O)COc2ccc(C)cc2)cc(S(C)(=O)=O)c1	757608820	IOMZQBODJMRJMJ-UHFFFAOYSA-N	449.485	1.807	50	20	IDGD	
Cn1cc(NC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc(Br)c1=O	757677248	GMCCQMMJEMNDAP-UHFFFAOYSA-N	431.250	1.800	50	20	IDGD	
Cc1csc([C@H](C)CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)n1	758688701	OXFBJMIHYSTZFO-LLVKDONJSA-N	425.536	1.450	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)N2CC[C@@H](n3cc(C(=O)OC)nn3)C2)c1C	760675988	IXIDQYUUNVPBMQ-DAIOKFOQSA-N	426.477	1.510	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)NCCc2ccn(C)n2)c2ccccc2c1=O	761013452	PWCBSROKBKLWOK-UHFFFAOYSA-N	425.493	1.507	50	20	IDGD	
COC1(C=NNC(=O)c2cc(S(=O)(=O)NCc3ccccc3)ccc2O)CCOCC1	761786542	QSUJARXBTIEHJI-UHFFFAOYSA-N	447.513	1.782	50	20	IDGD	
COc1ccccc1C(=O)NNS(=O)(=O)c1cc(Br)cc(C(=O)O)c1	762474134	AOMKZJTWNBPTJV-UHFFFAOYSA-N	429.248	1.779	50	20	IDGD	
CN(C)C(=O)c1cc(NC(=O)C(=O)NNC(=O)c2c[nH]c3ccccc23)ccc1Cl	763534490	GWAWYVNQFVQXHF-UHFFFAOYSA-N	427.848	1.923	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccccc2-n2nc(C)nc2C)cc1OC	763550352	KPBCOBQVBGUHAY-UHFFFAOYSA-N	438.444	1.301	50	20	IDGD	
CCOC(=O)/C=C\c1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)cc1	763551471	ONLBBCAZOGTTHD-YHYXMXQVSA-N	425.397	1.391	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(C(=O)NCC(C)C)cc2C)c1	763629845	IXBBUAKYFZNLTC-UHFFFAOYSA-N	440.500	1.854	50	20	IDGD	
CCc1nnc(-c2cccc(NC(=O)C(=O)NNC(=O)COc3ccc(OC)cc3)c2)o1	763660639	FFNYFHZSEDLAOJ-UHFFFAOYSA-N	439.428	1.473	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(Br)c2C)cc1	763660693	FTVFMINBQJRLGJ-UHFFFAOYSA-N	436.262	1.931	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)NC3CC3)cc2)c1C	763840522	MJTQIWUNIAAOCF-HNNXBMFYSA-N	438.484	1.749	50	20	IDGD	
Cc1ccc(-c2nnco2)cc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccccc1F	763863778	CDZWZGKYZOIFQZ-GFCCVEGCSA-N	427.392	1.738	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1csc(-c2ccccn2)n1	763864262	HQXCNCSYYNFYGM-LLVKDONJSA-N	429.433	1.898	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cccc3c2OCCC3=O)ccc1OC(C)C	763916896	XLONAQWGVRESJH-UHFFFAOYSA-N	441.440	1.847	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3cnn(-c4ncccn4)c3)cc2C1	763943117	RFYWKDYWAVLUPD-LLVKDONJSA-N	425.474	1.248	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1cccc(-n2cnnn2)c1C	764012162	NXQSDZCLTBFDPL-UHFFFAOYSA-N	429.824	1.032	50	20	IDGD	
COCCOc1ccccc1NC(=O)C(=O)NNC(=O)c1cccc(Br)c1	764063311	NOQXYJFQPCPCJB-UHFFFAOYSA-N	436.262	1.874	50	20	IDGD	
CC(C)Oc1cc(F)ccc1NC(=O)C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	764078420	UERFJUSPWAZNSI-UHFFFAOYSA-N	437.449	1.416	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)nc1)C(=O)Nc1cc(N2CCCC2=O)ccc1Cl	764091364	JKDSRTIYSLBSBO-UHFFFAOYSA-N	436.255	1.915	50	20	IDGD	
COC(=O)c1sccc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccc(C)cc2)[nH]n1	764111824	ULMKYBCCHNDGNQ-UHFFFAOYSA-N	427.442	1.633	50	20	IDGD	
COCCc1noc(-c2cc(Cl)ccc2NC(=O)C(=O)NNC(=O)c2ccoc2)n1	764164588	VRGUSQKEYWDTNN-UHFFFAOYSA-N	433.808	1.572	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2O1)C(=O)Nc1cccnc1OCc1ccccc1	764164884	USPZILSYQJRMMJ-LJQANCHMSA-N	432.436	1.750	50	20	IDGD	
O=C(CCC1CCCCC1)NNC(=O)C(=O)Nc1cccc(Cn2cccnc2=O)c1	764210574	KEKPUQAXNXADBJ-UHFFFAOYSA-N	425.489	1.738	50	20	IDGD	
Cc1cn(-c2ccc(C#N)cn2)nc1NC(=O)C(=O)NNC(=O)Cn1ccc2ccccc21	764245337	QIOFNAVLDUPGQT-UHFFFAOYSA-N	442.439	1.188	50	20	IDGD	
Cc1cc2c(cc1NC(=O)C(=O)NNC(=O)c1cc(Br)ccc1O)OCO2	764280595	QEAJYOFPXXNILC-UHFFFAOYSA-N	436.218	1.592	50	20	IDGD	
Cc1cc(C(=O)N2CCC(C)CC2)ccc1NC(=O)C(=O)NNC(=O)c1cnn(C)c1	764360235	VMWCHACGDJRNMT-UHFFFAOYSA-N	426.477	1.000	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ncn(Cc3cccc(Br)c3)n2)o1	764371024	GCWAIROYWYKHKI-UHFFFAOYSA-N	447.249	1.390	50	20	IDGD	
CCN1CCC(n2nccc2NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2F)CC1	764411518	ZODLPHSZDCVPNN-UHFFFAOYSA-N	436.875	1.732	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COCCO1)C(=O)Nc1ccc2nc(-c3ccc(F)cc3)oc2c1	764430403	WNTAJPRNYUQXJT-INIZCTEOSA-N	428.376	1.135	50	20	IDGD	
CC(=O)Nc1cc(S(=O)(=O)NNC(=O)c2ccc(F)cc2Br)ccc1O	765054954	NVPKGZHYUZKMAD-UHFFFAOYSA-N	446.254	1.876	50	20	IDGD	
Cc1nc(-c2ccc(S(=O)(=O)NNC(=O)CNC(=O)c3cccs3)s2)cs1	765082014	VODZFEQPMFCIAC-UHFFFAOYSA-N	442.569	1.981	50	20	IDGD	
O=C(CNC(=O)c1ccccc1OC(F)F)NNC(=O)c1cc(-c2cccs2)[nH]n1	765566078	RNZQNKWHFFXJLY-UHFFFAOYSA-N	435.412	1.931	50	20	IDGD	
CCc1ccc(C(=O)NNc2cnc3ccccc3n2)cc1S(=O)(=O)N1CCOCC1	765989442	JWIOITLVKFOZSL-UHFFFAOYSA-N	441.513	1.970	50	20	IDGD	
COC(=O)c1nccc2c(S(=O)(=O)NNC(=O)Cn3ccc4ccccc43)cccc12	766322664	RZNPTCSODPZRBL-UHFFFAOYSA-N	438.465	1.986	50	20	IDGD	
CC(C(=O)NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1)=C1CCCC1	766636561	QCWCFPDRDLCEFU-UHFFFAOYSA-N	434.562	1.339	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@](C)(O)[C@@H](C)c3ccccc3)CC2)cc1	766644040	OCIDGJVNBISBIX-NBGIEHNGSA-N	438.572	1.815	50	20	IDGD	
COc1c(F)ccc(F)c1C(=O)NNC(=O)CN1CCN(Cc2ccc(C)cc2)CC1	766647346	DNOHPTYAWQGWFU-UHFFFAOYSA-N	432.471	1.861	50	20	IDGD	
C[C@@H](NC(=O)C1CCCC1)C(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	766664855	WEFFQLWNLFONEJ-MRXNPFEDSA-N	449.983	1.300	50	20	IDGD	
C[C@H]1Cc2cc(S(N)(=O)=O)ccc2N1C(=O)COC(=O)[C@H](Br)C(C)(C)C	766750498	RLFVTBUHIFCVGW-BONVTDFDSA-N	447.351	1.964	50	20	IDGD	
O=C(CCC(=O)N1CCN(c2ccccn2)CC1)NNC(=O)c1ccc(Cl)cc1O	767891373	PCXWPSLNDXACSA-UHFFFAOYSA-N	431.880	1.331	50	20	IDGD	
Cc1nn(-c2ccc(S(N)(=O)=O)cc2)c(C)c1CCC(=O)NNc1ncc(F)cn1	768324911	YMDLJTILAKXFSH-UHFFFAOYSA-N	433.469	1.142	50	20	IDGD	
Cc1cc(Cl)cc2c1OCCCC2=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O	768483857	VEILRXQACYQQPB-UHFFFAOYSA-N	437.909	1.226	50	20	IDGD	
CCOc1ccc(NC(=S)NNC(=O)c2cc(S(=O)(=O)N(C)C)ccc2O)cc1	768691466	TWNWOLVASDPKSE-UHFFFAOYSA-N	438.531	1.673	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)c2cnc(O)c([N+](=O)[O-])c2)cc1	770143915	FKWKMXJAZIQWQH-UHFFFAOYSA-N	429.418	1.191	50	20	IDGD	
CC[C@@H]1Oc2cc([C@@H](C)NC(=O)NNc3nc(O)c4cnn(C)c4n3)ccc2NC1=O	770402034	NWFMTKSMFFSREN-RNCFNFMXSA-N	426.437	1.566	50	20	IDGD	
C[C@@]1(c2ccc(Br)cc2)NC(=O)N(CC(=O)NNC(=O)c2ccccn2)C1=O	771216784	RXGVKTOGXMIINI-SFHVURJKSA-N	446.261	1.072	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)COc1ccc(C=O)cc1Br	772168555	YUTAMAPOHUQRGN-NSHDSACASA-N	429.267	1.766	50	20	IDGD	
O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772197092	VJWTYIUZSNIJIC-UHFFFAOYSA-N	429.820	1.736	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)C1CCC(NC(=O)C2CCCC2)CC1	772902486	ACBMBXSFTZSKMM-UHFFFAOYSA-N	448.951	1.969	50	20	IDGD	
CC(=O)N(CCc1ccccc1)CC(=O)NNC(=O)[C@H]1CCCN(C(=O)OC(C)(C)C)C1	773411521	NJPSBBUASMUCEK-IBGZPJMESA-N	446.548	1.872	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)[C@H]2CSCN2C(=O)C(C)(C)C)C1	773418365	TYAJXJMQOUIJEX-UONOGXRCSA-N	442.582	1.729	50	20	IDGD	
CN(C)CCn1c(=O)oc2ccc(NC(=O)C(=O)NNc3ccc4ccccc4n3)cc21	773654260	ANGGLVPCORFDGX-UHFFFAOYSA-N	434.456	1.786	50	20	IDGD	
COc1ccc(S(=O)(=O)NC2CC2)cc1NC(=O)C(=O)NNc1ccc([N+](=O)[O-])cc1	773655551	BWIYBKCVKGESCG-UHFFFAOYSA-N	449.445	1.126	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2ccccc2C(=O)N2C[C@@H](C)C[C@H](C)C2)n1	773726858	SIFUMDDYBDLNLX-KBPBESRZSA-N	426.477	1.685	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(S(=O)(=O)N(C)C3CC3)cc2)cc1F	773903308	XHIJHTNPGCJMJS-UHFFFAOYSA-N	448.476	1.317	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCc1ccc(OC(F)F)cn1	775214560	SMXOMBWABRIQNN-UHFFFAOYSA-N	442.448	1.429	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1)c1ccc(OC)cc1	775639676	YRTPXZZGEYLJFZ-LJQANCHMSA-N	433.530	1.965	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)N[C@@H]1CCO[C@H](CC(C)C)C1	776885649	OEBRQFVZTSWDQN-HUUCEWRRSA-N	425.555	1.826	50	20	IDGD	
COCCN1C(=O)CCc2cc(NC(=O)C(=O)NNc3cnc4ccccc4n3)ccc21	778723525	BVXACEPJGHDQFW-UHFFFAOYSA-N	434.456	1.637	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)CNC(=O)Cc1cccc2ccccc12	780970410	BEPYEIPGZYXNGR-UHFFFAOYSA-N	428.489	1.561	50	20	IDGD	
CSc1c(F)cc(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)cc1F	782889226	XQTVSQITXKTJNC-UHFFFAOYSA-N	433.440	1.902	50	20	IDGD	
N#Cc1ccc(Cl)c(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)c1	784210606	XWBHFCYMVXWWRM-UHFFFAOYSA-N	433.877	1.734	50	20	IDGD	
Cn1cc(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2Cl)cc(Br)c1=O	784383884	IZPXBTRHZAFKJC-UHFFFAOYSA-N	444.629	1.791	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2cccc([N+](=O)[O-])c2)cc1N1CCCS1(=O)=O	784834346	XLAPNZJMPTYKON-UHFFFAOYSA-N	433.446	1.525	50	20	IDGD	
Cc1ccccc1-c1cc(NC(=O)C(=O)NNc2cccc(S(C)(=O)=O)c2)n(C)n1	784841245	OJYWJKJFNFVMEN-UHFFFAOYSA-N	427.486	1.881	50	20	IDGD	
COc1cccc(NNC(=O)C(=O)N2C[C@@H](C(=O)N3CCCCC3)Oc3ccccc32)n1	784843303	LNBIUFFAQGLBCU-KRWDZBQOSA-N	439.472	1.340	50	20	IDGD	
COC[C@H](C)NS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2cc(Cl)ccn2)cc1	784862048	VJTNDNHQRNNXJD-NSHDSACASA-N	441.897	1.130	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2cccc(S(=O)(=O)NC3CC3)c2)cc1Cl	785116384	JMCAULGLEQLKME-UHFFFAOYSA-N	438.893	1.871	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2cccc(C(=O)NC(C)(C)C)c2)n1	785226064	NRZLXKZIXZOYOT-UHFFFAOYSA-N	427.509	1.933	50	20	IDGD	
CCOC(=O)N1CCC(NC(=O)CCCNC(=O)/C(C#N)=C\c2ccc(O)cc2)CC1	786986278	TUXWEMKWNLOCTN-VKAVYKQESA-N	428.489	1.933	50	20	IDGD	
CCNC(=O)Nc1ccc(C)c(NC(=O)C(=O)NNc2nccc(N(CC)CC)n2)c1	787574877	DNHHSXNRODEJGS-UHFFFAOYSA-N	428.497	1.854	50	20	IDGD	
O=C(COC(=O)[C@@H]1CCCc2c(O)cccc21)NNC(=O)[C@@H]1COc2ccccc2O1	789254161	VAJSQYAVULJFIK-BEFAXECRSA-N	426.425	1.343	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cc([C@@H]3CCCO3)nn2C)c1C	789741515	WUVTZZCRROVDID-PBHICJAKSA-N	429.477	1.442	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CN2CCCC2=O)cc(OC)c1OCc1ccccc1	789858334	UZXDEBDHOKRQPL-UHFFFAOYSA-N	427.457	1.666	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)NNC(=O)c2nnc(O)c3ccccc23)c1C	790063506	OMEBCOVHUYPOLB-WJDWOHSUSA-N	434.456	1.768	50	20	IDGD	
O=C(NCC(=O)N1CCN(c2ccc(Cl)cc2)CC1)NNc1nc2ccccn2n1	790272753	QJBRBVMCJSEDRE-UHFFFAOYSA-N	428.884	1.358	50	20	IDGD	
Cn1ccnc1C(=O)c1ccc(NC(=O)C(=O)NNc2cccc(F)c2[N+](=O)[O-])cc1	791000525	NGLONFLEUVCIDT-UHFFFAOYSA-N	426.364	1.780	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)N(C)CC(F)(F)F	792774808	XJMUIWJRUKSGGG-LBPRGKRZSA-N	436.456	1.115	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1	794062185	YHUSALKBSAYIBQ-UHFFFAOYSA-N	438.400	1.468	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)[C@@H]1N(C(=O)OC(C)(C)C)CC1(C)C	796218544	OLYBRHPZFONLEB-SFHVURJKSA-N	433.505	1.874	50	20	IDGD	
CCc1cc(Br)ccc1NNC(=O)C(=O)Nc1cnn(CC(=O)OC)c1C	796986945	WNXWAGKODRTHPF-UHFFFAOYSA-N	438.282	1.771	50	20	IDGD	
CC(C)(C)Cc1csc(NC(=O)C(=O)NNC(=O)CNC(=O)OCc2ccccc2)n1	797369044	MQYSAHKEMUSQPD-UHFFFAOYSA-N	447.517	1.744	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cc(Br)cc([N+](=O)[O-])c2C)n[nH]1	797536162	WCYNEIAZSYKLEE-UHFFFAOYSA-N	425.199	1.097	50	20	IDGD	
C[S@@](=O)c1ccc(CC(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)cc1	797877592	XRHYIGYPSQIDRT-SSEXGKCCSA-N	438.550	1.696	50	20	IDGD	
COC(OC)c1ccc(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)o1	806973474	CTRHNZHXFWZPIB-UHFFFAOYSA-N	425.463	1.349	50	20	IDGD	
O=C1COC[C@@H](C[C@@H]2CN(C(=O)C(=O)NNc3c(F)cccc3F)c3ccccc32)N1	806984285	POCOWCAIMVNHMK-CHWSQXEVSA-N	430.411	1.443	50	20	IDGD	
CC(C)c1nccnc1NNC(=O)C(=O)N1C[C@H](C[C@@H]2COCC(=O)N2)c2ccccc21	807065069	CNBVNFXGPTUZNJ-LSDHHAIUSA-N	438.488	1.079	50	20	IDGD	
O=C(NCc1ccc(CN2CCCCC2)cc1)NNC(=O)c1ccc(-n2cnnn2)cc1	807134813	HCQUGTKAPVZHJP-UHFFFAOYSA-N	434.504	1.792	50	20	IDGD	
COC(=O)[C@@H]1CCCCN1C(=O)c1cccc(NC(=O)C(=O)NNc2cccc(F)n2)c1	807392864	LXJJPGOIVLATEH-HNNXBMFYSA-N	443.435	1.470	50	20	IDGD	
CC(=O)Nc1ncc(S(=O)(=O)NNC(=O)c2ccc(F)cc2Br)s1	808079007	KYCOVTONMHMKEV-UHFFFAOYSA-N	437.272	1.626	50	20	IDGD	
COC(=O)c1ccc(Cl)c(C(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)c1	810627386	DWLDIFQZLGCSAR-UHFFFAOYSA-N	425.850	1.997	50	20	IDGD	
CC(C)n1cc2cc(NC(=O)C(=O)NNc3ccc(S(=O)(=O)N(C)C)cc3)ccc2n1	813033619	BXHFVPOYVHGTPW-UHFFFAOYSA-N	444.517	1.949	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2cnn(Cc3ccccc3)c2)cc1	813033855	OFSOZOIERMWWOJ-UHFFFAOYSA-N	442.501	1.264	50	20	IDGD	
CCn1cnc2c1c(=O)n(CC(=O)NN=C1CCOC1(C)C)c(=O)n2Cc1ccccc1	814746339	VKKCOYJBNUYUAU-UHFFFAOYSA-N	438.488	1.099	50	20	IDGD	
COCC(=NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1)c1cccc([N+](=O)[O-])c1	814746527	IVHIUCBMRRYHQR-UHFFFAOYSA-N	426.838	1.676	50	20	IDGD	
CS(=O)(=O)CC1CCC(=NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)CC1	814879357	UDNGLNRZYMIVNH-UHFFFAOYSA-N	434.562	1.151	50	20	IDGD	
CCOc1ccc(NNC(=O)C(=O)Nc2cccc(C(=O)N3CCOCC3)c2C)cc1	815816979	WRKAMBUDZLRTLF-UHFFFAOYSA-N	426.473	1.948	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)Cn2nnc3ccccc3c2=O)c1	816716270	FKAMHCJYCDVUAG-UHFFFAOYSA-N	432.234	1.484	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)c2sccc2S(=O)(=O)N2CCCC2)cc1	822443136	OXKLYXDXINKLFP-UHFFFAOYSA-N	434.499	1.244	50	20	IDGD	
CCN1CCC[C@H]1CNC(=S)NNC(=O)CN1c2cccc3cccc(c23)S1(=O)=O	884367101	QOWQRQBAYLTIMN-HNNXBMFYSA-N	447.586	1.328	50	20	IDGD	
Cc1c(C=NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c(=O)n(-c2ccccc2)n1C	912787404	OVGASKIUCLPNKW-UHFFFAOYSA-N	441.513	1.499	50	20	IDGD	
O=C(NCc1ccc(S(=O)(=O)N2CCCCC2)cc1)NNC(=O)c1ccccc1O	915927563	YEDZADISCUNYRO-UHFFFAOYSA-N	432.502	1.711	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NCc2ccc(N3CCN(C)CC3)nc2)cc1C	916247454	WLPDBTVTHBMPGT-UHFFFAOYSA-N	426.521	1.360	50	20	IDGD	
O=C(CSc1ccc(Cl)cc1)NNC(=O)NCCNS(=O)(=O)c1ccccc1	916294537	BHLSTZTWXZYOQO-UHFFFAOYSA-N	442.950	1.741	50	20	IDGD	
C[C@H]1C[C@H](C)CN(CCCNC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)C1	916461203	YEROPTIMIQQRGJ-SFTDATJTSA-N	444.624	1.897	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)N1CCN(c2ccccc2)CC1	916514856	QICHPDMBYSLIMD-INIZCTEOSA-N	426.477	1.750	50	20	IDGD	
COc1cc(CNC(=O)NNC(=O)COc2ccc(C)c(C)c2)ccc1OCC(N)=O	916640793	LXQMLCGFCVTEDE-UHFFFAOYSA-N	430.461	1.086	50	20	IDGD	
CC(C)(C)C(=O)NNC(=O)CCCCCNS(=O)(=O)c1ccc2c(c1)OCCO2	917181443	IDHIMXJJAPDIQK-UHFFFAOYSA-N	427.523	1.490	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc2c(c1)C(=O)OC2)c1ccc(F)cc1Br	917754887	MTZCTLNPHSYDTK-UHFFFAOYSA-N	429.223	1.882	50	20	IDGD	
O=C(CCN1C(=O)[C@@H]2CCCC[C@H]2C1=O)NNC(=O)c1ccc(F)cc1Br	918340338	KXKMAQYITQMGIH-VXGBXAGGSA-N	440.269	1.915	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)NCCNC(=O)c1ccc(Br)cc1	919909913	GWVZVZCGKOFMHC-UHFFFAOYSA-N	449.305	1.761	50	20	IDGD	
O=C(Cc1n[nH]c2ccccc12)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	920275241	QGSJQRSCSFOJDJ-UHFFFAOYSA-N	427.486	1.351	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)Nc2nc(CN3CCOCC3)cs2)cc1	920933200	KUGNCZFRWKBGIV-CQSZACIVSA-N	449.533	1.994	50	20	IDGD	
CCN(CC)C[C@@H](C)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	921121992	RTSKUFBAVMEVDA-MRXNPFEDSA-N	439.582	1.536	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)N[C@H]2CC(=O)N(c3ccccc3)C2)cc1	921125702	VGVHHMFBMGWHBL-CVEARBPZSA-N	426.473	1.989	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CNS(=O)(=O)c2ccccc2)ccc1OCCC(C)C	1317668643	UQRKGGQCRPAHLJ-UHFFFAOYSA-N	449.529	1.860	50	20	IDGD	
CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)NNC(=O)c1n[nH]c2c1CCCC2	1339945330	GGLVGZFKRKOPEO-SFHVURJKSA-N	426.452	1.417	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3n[nH]cc3Br)n[nH]2)cc1OC	1349193451	NMFZIDIWTYXQGE-UHFFFAOYSA-N	435.238	1.654	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)ncc1[N+](=O)[O-]	1779295226	AZILODVUFZZZLI-IBGZPJMESA-N	436.541	1.593	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)CCN3Cc4ccccc4C3=O)CCO2)C1	1781220255	ZXXVBEKQSHTEBP-GCJKJVERSA-N	433.936	1.880	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1cnc3ccccn13)C2	1782171808	GNXLAVBSXFVLFG-NJNPRVFISA-N	448.951	1.645	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cc4cccnc4nc3O)CCO2)C1	1783538514	XSKIIOOXAFQPSJ-CWTRNNRKSA-N	449.305	1.562	50	20	IDGD	
CC(C)NC(=O)OC(C)(C)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](C)Br)C2)C1	1783538901	YSHAESGCDMKVOG-ACJLOTCBSA-N	448.358	1.513	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)COCc3ccc(C)c(C)c3)CCO2)C1	1783874548	DRBOULNKYWRUEV-UGKGYDQZSA-N	438.952	1.904	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)CCc3ccc4c(c3)OCO4)CCO2)C1	1783876065	LRXLDKAPVADEJT-IIBYNOLFSA-N	438.908	1.432	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc4sc(N)nc4c3)CCO2)C1	1783876289	NSPPMAWUZBZVMQ-ORAYPTAESA-N	438.937	1.576	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(C#N)cc3Cl)CCO2)C1	1783882527	ZYELIWBJAUUSMH-APWZRJJASA-N	426.300	1.909	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccc3occc3c1)CCO2	1783935139	PKQFHZKUNIGHDG-JOCHJYFZSA-N	428.489	1.249	50	20	IDGD	
Cc1nccn1CCCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2	1784405836	GJJQSQMYBOLJPE-KXBFYZLASA-N	441.370	1.833	50	20	IDGD	
COc1ccc(CC(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)cc1F	1784704245	MAVYKLJCPVSQQT-DJJJIMSYSA-N	443.313	1.990	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ncc(OC)cc3F)[C@H]2C1	1785738640	CULXUTXONVLONH-ZIEJDFEHSA-N	429.876	1.076	50	20	IDGD	
O=C(CNc1ccc(F)cc1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21	1786812367	WEYBUGIMYVAKCO-SIUGBPQLSA-N	446.292	1.908	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc4c3cnn4C)[C@H]2C1	1788067194	DWGYSBIWSUBCIR-YFPWBOGZSA-N	449.349	1.950	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21)c1cc(Cl)c2nncn2c1	1788559817	GYQRXPMUZYHFGS-GAFUQQFSSA-N	446.722	1.780	50	20	IDGD	
COc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]3C2)ccn1	1789870440	HARJFWXLWAJSFS-XMDUPGNXSA-N	430.332	1.920	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4nc[nH]c4c3)C[C@@H]21)[C@@H](F)Br	1789925304	DPORLVIISKECBF-GVAFMPQTSA-N	439.285	1.847	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4nn(C)cc4c3)[C@H]2C1	1790354237	SOKAQGCRJSVPLL-RMRDIRSESA-N	434.924	1.420	50	20	IDGD	
CCCNC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](Br)CC)[C@H]2C1	1790958552	UNTDMAMMDFPPNB-VGWMRTNUSA-N	446.386	1.446	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=N/N3CCCCC3)C[C@@H]21	1790960356	CNPIDGQMLRSHPA-CKCGSTQVSA-N	443.386	1.611	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C/N=C/c3ccco3)C[C@@H]21	1790961072	WEIIOJCQADONDJ-XFCHMZBFSA-N	440.338	1.852	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)n3ccnc3C)C[C@@H]21	1790963974	QIZLIYXYEHVNJK-VFTHGPRRSA-N	441.370	1.906	50	20	IDGD	
CCOC(=O)C(C)(C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)Br)[C@H]2C1	1791065053	PUVCXEOBQDANCU-XUXIUFHCSA-N	433.343	1.339	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(C2CC2)on1	1792703046	ICTCTJUHPMLYCG-VFFTVRQLSA-N	426.311	1.786	50	20	IDGD	
CC(C)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1ON=C(c3ccccc3)O1)C2	1792782998	LKKPPOBAVICERA-YYAJDYIMSA-N	435.908	1.576	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c[nH]c3nccc-3c1)C2	1792867674	FWZIOSQGEGBSGU-KSYCFECVSA-N	435.322	1.749	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Cl)C3)C[C@H]2C[C@H]21	1792996538	FAJFJHNLERGVGG-WXUBNNCZSA-N	445.919	1.508	50	20	IDGD	
Cc1nn(C)c(C)c1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)CBr)C2	1793519998	XCQPBCGBBPGVOM-HPAJIGNASA-N	427.343	1.271	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)[C@H]1CCCN(Cc2ccccc2)C1	1793750799	NWOWOJFHUQSCLJ-WHZJULEDSA-N	449.979	1.088	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1c(F)ccc(F)c1F	1793879960	OYIAYKDYZQKFCM-BTTYYORXSA-N	440.466	1.658	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cc(Br)ccc1O)C2)[C@@H](F)Cl	1796367630	KSOWEVADPCEJQE-OXUXUCFPSA-N	449.704	1.821	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1csc2c1CCCC2)c1ccc(B(O)O)cc1	1798046766	YZTPZDLMAKSMJV-BCDXTJNWSA-N	438.358	1.872	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2cccnn2n1	1798422213	DMBXXPYRLTVPIG-LMWOUKEDSA-N	436.310	1.106	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H]1CCCCC1(F)F)C2	1798439690	XFYZPKBKSAZZQE-LOUJCGABSA-N	435.475	1.762	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(Cl)ncn1)C2	1800641977	PBRMYEGVXWYOJF-MIJXAVMKSA-N	431.718	1.507	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CCc3ccccc3[C@@H]1O)C2)C(Cl)Cl	1801015808	VQSQCJDBILTJIN-KUHBDSFDSA-N	427.328	1.676	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@]1(C)CC=CCC1	1801537095	TZWQZTIYAOZNOO-UWOXXUHBSA-N	441.532	1.456	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]2c2cccnc2)nc2nccn12	1803148026	NJSXSDYSCKVGQH-KBAYOESNSA-N	442.907	1.352	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2cnc(N(C)C)o2)[C@@H]1c1cccnc1	1805345686	IUGHZHCTAGBKEC-ZOBUZTSGSA-N	435.912	1.709	50	20	IDGD	
O=C(c1cc(-c2ccccn2)[nH]n1)N1CCC2(CCCN(C(=O)[C@@H](O)CCl)C2)CC1	1805522351	GZERREOJOICKRL-SFHVURJKSA-N	431.924	1.916	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)c2ccc(O)cc2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807368107	YLNDGWFIHPCIBG-KNQAVFIVSA-N	445.284	1.100	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)Cc2ccc3ncnn3c2)[C@@H]1c1cccnc1)[C@@H](F)Cl	1808314971	LOOVFASBQLLAKP-KFKAGJAMSA-N	430.871	1.907	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)[C@@]3(F)CCCC=C3F)CC2)C1	1809977577	DGEKQGUKLQVXLB-HSZRJFAPSA-N	446.303	1.957	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1	1809980164	MIRSRMNQIMTORR-LJQANCHMSA-N	441.164	1.448	50	20	IDGD	
C=C[C@H](O)C(C)(C)C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1810254151	VPALOSHXRMBWFW-WFXMLNOXSA-N	445.564	1.034	50	20	IDGD	
COc1nn(C)cc1C(=O)N1CC[C@H](CNC(=O)CO[Si](C)(C)C)[C@H]1c1cccnc1	1810540985	NYANZZGXBTWDET-VQIMIIECSA-N	445.596	1.995	50	20	IDGD	
COC1(CC(=O)N2CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)CCC1	1813072625	BZYIJKXNCCWBCZ-XMSQKQJNSA-N	445.564	1.420	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)c2cnc(O)nc2O)[C@H]1c1cccnc1)C(Cl)Cl	1813079786	JEMBJBFHEUIRPS-PWSUYJOCSA-N	426.260	1.406	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)Cc2c(C)nn(C)c2C)[C@H]1c1cccnc1	1813421930	SVCBFMYZTITXIE-HFSMHLIXSA-N	447.967	1.934	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1ccccc1O)CC2)c1ccc(B(O)O)cc1	1815336749	BTHARUOLHCBPSE-AWEZNQCLSA-N	437.286	1.068	50	20	IDGD	
O=C(N[C@@H]1CCc2nc(NC(=O)[C@H](F)Cl)sc2C1)c1cnc2c(c1)CCNCC2	1817134472	NVJDYAZYURJXPR-WBMJQRKESA-N	437.928	1.987	50	20	IDGD	
CC(C)CNC(=O)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](C)Br)[nH]n1	1818135847	NXMUKLWPLRSOOJ-WCQYABFASA-N	428.331	1.957	50	20	IDGD	
Cn1ccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cnccc3C(=O)NN)n[nH]2)c1	1819402014	IQLLLWGBQWYNNX-QGZVFWFLSA-N	436.476	1.366	50	20	IDGD	
Cc1cnc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)s1	1822412648	AXOUNZQTMRWUIS-CQSZACIVSA-N	433.538	1.854	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc3n(n2)CCC3)[nH]n1	1822415546	AVRYJGZKGZIJME-KRWDZBQOSA-N	442.524	1.231	50	20	IDGD	
CC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(=O)n3[nH]cnc3n1)CC2	1822843041	JTDNNPVZOGCOHL-DTWKUNHWSA-N	435.897	1.117	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CN1CCCC1=O)CC2	1822863537	MYPDHOGAPPLXIO-QGHHPUGFSA-N	433.361	1.914	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)CN2CCSCC2)CC1	1823725033	XVWONAYJCZMGFK-QZTJIDSGSA-N	432.030	1.909	50	20	IDGD	
C=CCOCCCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1	1824500853	OBPMSDLEKBPLHY-HXUWFJFHSA-N	436.597	1.962	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CN1CCOCC1)CC2	1825642859	WFVOQGAYBCGZFO-MNOVXSKESA-N	431.356	1.171	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccncc2F)CC1	1827958666	LWQFNKAMGGINKZ-IBGZPJMESA-N	433.528	1.827	50	20	IDGD	
CCO/C=C/C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1	1828925839	POBKCGMMRQAVJN-CECLQJIQSA-N	429.521	1.469	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)C(O)O)CC1	1829637028	JFQYWUFTUJZRSR-KRWDZBQOSA-N	449.460	1.064	50	20	IDGD	
O=C(c1cc(C2CC2)on1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1830198836	UCVQJRLJRJUPRC-PBHICJAKSA-N	446.273	1.313	50	20	IDGD	
CCC1(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)COC1	1831274851	GYJXOHPQERTXEN-FQEVSTJZSA-N	428.338	1.026	50	20	IDGD	
Cc1ccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)cn1	1833131871	VOCQIHJTIQAPHP-NRFANRHFSA-N	435.597	1.240	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)cnc1C	1833298576	NEMLHAZBWJNJGE-NRFANRHFSA-N	435.597	1.620	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)CCCC(F)(F)F)CC2)CC1)[C@H](O)CCl	1833308673	ZUXRDAMGQCUKGI-OAHLLOKOSA-N	427.895	1.890	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccsc3)CCO2)C1	1836101807	OKVUFIAILVCHJA-CXAGYDPISA-N	431.352	1.530	50	20	IDGD	
Cc1nccn1CCCC(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836720359	RFBHAYQWYOCUHJ-IBGZPJMESA-N	440.972	1.570	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3CCC(F)(F)C3)C2)C1	1837708512	ITLLPDZVFYPNGR-QAPCUYQASA-N	434.556	1.730	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cnc4ncccn34)CC2)CC1	1838242027	DUXAQWVWPJVKQR-KRWDZBQOSA-N	449.939	1.595	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CC[C@@H](C(=O)OC)C3)C2)C1	1839141462	JKNMJTMSTXHJEX-DICRZQGBSA-N	430.929	1.050	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cn3cnc4ccccc43)C2)C1	1839148728	HXGVWMXFTQIVST-KKSFZXQISA-N	434.924	1.510	50	20	IDGD	
C=CCSCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839199022	QIDDWOJQOBEJHE-UKRRQHHQSA-N	425.320	1.053	50	20	IDGD	
C[C@H](C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H](F)Br)CCO2)C1)c1cccs1	1839203111	AIRDUYPLLLFTEM-DXCKQFNASA-N	449.342	1.999	50	20	IDGD	
CCc1oncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](Br)CC)CCO2	1839963612	QFUBUSYVBCVIHL-KDOFPFPSSA-N	444.326	1.481	50	20	IDGD	
COc1ccc(F)cc1C(=O)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1840690902	JPUWILWOXXRVQD-GOSISDBHSA-N	435.279	1.708	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2cc(C(C)C)on2)C1	1842542260	CXUQLGGCCLQGEJ-OEAKJJBVSA-N	426.477	1.749	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@](C)(C(=O)N2CC3(CCCN3C(=O)[C@@H](F)Cl)C2)[C@@H](O)C1	1843363892	FGMFTDDSMSLONH-KSMMKXTCSA-N	447.935	1.732	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@]2(C(=O)N3CC4(CCCN4C(=O)[C@H](F)Cl)C3)C[C@H]1CO2	1843365336	KEIGAFCQXUFNES-JMERFSKESA-N	431.892	1.503	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)c2snnc2C)C1	1843512450	VNMOSLICDNTLOQ-UHFFFAOYSA-N	445.457	1.811	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@]2(F)CCN(C(=O)OC(C)(C)C)C2)C1	1843955026	NMJJUYAVBBDWGQ-VLIAUNLRSA-N	447.935	1.793	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)N2CCCC23CN(C(=O)[C@@H](O)CCl)C3)C1	1845128611	SNUFKSHXOAVUDD-GJZGRUSLSA-N	429.945	1.437	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)C1CCN(c3ccccc3)CC1)C2	1846384039	WYWPDHPTDNKGOF-UHFFFAOYSA-N	441.576	1.479	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)c1ccc(OC(F)F)cc1F)C2	1846385287	MOYYPRFEMUTFKI-UHFFFAOYSA-N	442.438	1.617	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)Cc1ccc(F)cc1Cl	1848018374	WYHSFSAZPWZYTQ-ROUUACIJSA-N	445.882	1.536	50	20	IDGD	
Cc1cc(F)ccc1S(=O)(=O)Nc1ccc(C(=O)NNc2nnc(C)c(=O)[nH]2)cc1	10899375	UMJCYWLWUJLETP-UHFFFAOYSA-N	432.437	1.479	50	20	IDGD	
C[C@@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)NNC(=O)Cc2ccc(Cl)cc2)C1=O	27247038	PYRZCSCPPHTHFO-FQEVSTJZSA-N	432.839	1.636	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)c1cnc2c(c1)c(=O)n(C)c(=O)n2C	29329595	BOGYBPWJDODZQG-ZDUSSCGKSA-N	447.451	1.014	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)CSc2nc(C)cc(C)n2)c2ccccc2c1=O	36280398	PEPPUOWGNDEQDG-UHFFFAOYSA-N	426.502	1.767	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)CNC(=O)Cc2cccc3ccccc23)C[C@@H](C)O1	38688499	FZHCFRNGXQWXLP-IAGOWNOFSA-N	426.517	1.145	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)[C@H]1CCCN1S(=O)(=O)c1cccs1	109846829	VZHIYASMORFPIP-OAHLLOKOSA-N	437.543	1.690	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)[C@@H]1CCCN(C(=O)Nc2ccccc2F)C1	725739495	HTRSYIAGITYQDH-CYBMUJFWSA-N	447.492	1.709	50	20	IDGD	
C[C@@H]1CCCCN1Cc1ccccc1CNC(=O)NNC(=O)CNC(=O)c1ccco1	725870222	DJIASPJVFTVEFK-MRXNPFEDSA-N	427.505	1.914	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cn(-c3ccc(C(F)(F)F)cn3)nn2)cc1C	725907626	NUVLIAMWHSSRCE-UHFFFAOYSA-N	447.377	1.698	50	20	IDGD	
O=C(NNC(=O)N1CCN(C(=O)C(=O)N2CCCC2)CC1)c1c(Cl)cccc1Cl	727846306	PCFUUZITAQEWOZ-UHFFFAOYSA-N	442.303	1.114	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)Cc2nnc(-c3ccccc3)n2C)c2ccccc2c1=O	728162989	LULOCUFXISYJMY-UHFFFAOYSA-N	445.483	1.606	50	20	IDGD	
CNS(=O)(=O)c1ccc(C)c(C(=O)NNC(=O)c2cc(F)ccc2Br)c1	728548905	VBQDWFPIQHOXRA-UHFFFAOYSA-N	444.282	1.880	50	20	IDGD	
CCn1c(CCC(=O)NNC(=O)CC(C)(C)C)nc2cc(S(=O)(=O)N(C)C)ccc21	728608279	XXWHOGDNNATOCQ-UHFFFAOYSA-N	437.566	1.823	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1ccc(NC2CC2)c([N+](=O)[O-])c1	728845626	NOUAOZNQLQVHOG-UHFFFAOYSA-N	425.449	1.637	50	20	IDGD	
CC(=O)CCc1ccc(O[C@@H](C)C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1	728846133	SFTWHMVPZCDZKE-KRWDZBQOSA-N	439.516	1.830	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CCCNS(=O)(=O)c2ccc3c(c2)CCCC3)c1	728985223	BVZJQUPYBIKLFC-UHFFFAOYSA-N	440.525	1.957	50	20	IDGD	
COc1cccc(/C=C(\C#N)C(=O)O[C@@H](C)C(=O)Nc2cccc(S(N)(=O)=O)c2)c1	729272099	RHYNJQGQAROXTM-NCPSJORJSA-N	429.454	1.820	50	20	IDGD	
CC[C@H](N=c1nn[nH]n1-c1ccccc1)C(=O)NNC(=O)c1ccc(Cl)cc1OC	729512552	JVVUHUVOOPZTPO-HNNXBMFYSA-N	429.868	1.398	50	20	IDGD	
CC[C@H](NC(=O)NNC(=O)COc1cc(C)cc(C)c1)c1cccc(S(N)(=O)=O)c1	729612201	BLOSFUDUVHNAOL-SFHVURJKSA-N	434.518	1.811	50	20	IDGD	
Cc1cc(S(C)(=O)=O)c(C)c(S(=O)(=O)NNC(=O)c2ccc3c(c2)OCO3)c1	730202967	CSGZQBQGMQLBLB-UHFFFAOYSA-N	426.472	1.059	50	20	IDGD	
COc1ccccc1[C@@H](CNC(=O)NNC(=O)COc1ccccc1O)N1CCCC1	730904701	OVNZSUHOBBNLGW-QGZVFWFLSA-N	428.489	1.947	50	20	IDGD	
COc1ccc(S(=O)(=O)NCCC(=O)NNC(=O)C(C)(C)c2ccccc2)cc1OC	731200591	TUQHQCUGNDBIFS-UHFFFAOYSA-N	449.529	1.497	50	20	IDGD	
CSC[C@H](C(=O)NNc1ccccc1S(C)(=O)=O)N1C(=O)[C@H]2CCCC[C@H]2C1=O	732304543	ZNQMUKYSBCGMEM-VNHYZAJKSA-N	439.559	1.440	50	20	IDGD	
C[C@@H](Oc1ccccc1Br)C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	732751449	PSDOZZGKUWFLKA-LLVKDONJSA-N	431.250	1.653	50	20	IDGD	
O=C(NCC1CCSCC1)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	733654838	WSDMJNHQCJXMEW-UHFFFAOYSA-N	440.591	1.948	50	20	IDGD	
Cn1c(=O)nc(O)c2c(C(=O)NNC(=O)c3ccoc3)cc(-c3ccc4c(c3)OCO4)nc21	733952409	GIXHKORNHDHXBV-UHFFFAOYSA-N	449.379	1.098	50	20	IDGD	
COc1ccc(C(=O)NNc2ncccc2Cl)cc1S(=O)(=O)N1CCOCC1	734247743	ZHCBEZIFYMJFHA-UHFFFAOYSA-N	426.882	1.521	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)N[C@@H]1CCN(c2ccccc2OC(F)F)C1	735112738	IKAVREGUMHDNPS-CYBMUJFWSA-N	436.415	1.982	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)c1ccc([N+](=O)[O-])cc1Br	739547737	YUGZKYIUDLRXNQ-UHFFFAOYSA-N	427.236	1.610	50	20	IDGD	
Cc1ccc(NCCCNC(=O)NNC(=O)c2nnc(O)c3ccccc23)c([N+](=O)[O-])c1	740490228	OWQNMQNLJOTPBS-UHFFFAOYSA-N	439.432	1.998	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)N2CCN(CC[S@](C)=O)CC2)c(C)n1C[C@@H]1CCCO1	741297469	SUNSCSHTZGDNFF-JQBKOJOFSA-N	432.590	1.714	50	20	IDGD	
COc1ccc(-c2n[nH]c(CNC(=O)NNC(=O)[C@H](C)Oc3ccccc3F)n2)cc1	741420367	ZKWRGXIPGSNLBJ-LBPRGKRZSA-N	428.424	1.917	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)CCNC(=O)CC(C)C)c1	741660414	VXKXNILNPUJMHI-UHFFFAOYSA-N	426.539	1.031	50	20	IDGD	
Cc1cc(Br)c(S(=O)(=O)NNC(=O)[C@@H]2COc3ccccc3O2)s1	742025285	LNXBMHBDWAFVPX-LBPRGKRZSA-N	433.305	1.969	50	20	IDGD	
CC[C@](C)(O)CNC(=O)/C(C#N)=C/c1cn(CCC(N)=O)nc1-c1ccc(OC)cc1	743760932	QSJRTYJPFYAPTC-GSTVHYHFSA-N	425.489	1.618	50	20	IDGD	
CC(=O)N1CCN(S(=O)(=O)c2ccc(C(=O)NNc3ccc(Cl)nc3)cc2)CC1	743816930	XFMQWAZDTJXVEX-UHFFFAOYSA-N	437.909	1.345	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)C[C@H](c2ccccc2)N2CCOC2=O)c1	744949963	GCGXRQQJKKIORU-GOSISDBHSA-N	425.441	1.883	50	20	IDGD	
COc1cccc([C@H](CNC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)N(C)C)c1	745295204	CUCYEOWQMRLBEL-SFHVURJKSA-N	449.533	1.737	50	20	IDGD	
O=C(COC(=O)Cc1ccc(NC(=O)C2CC2)cc1)NNC(=O)c1ccc([N+](=O)[O-])cc1	745494442	XCFPACGZLVITLC-UHFFFAOYSA-N	440.412	1.490	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1)[C@@H]1CCOC1	745860855	FGKJHGYFIWZORS-DNVCBOLYSA-N	435.488	1.757	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)CC[S@@](=O)c1ccc2c(c1)OCCO2	746094207	FLOQTGNZXPISPA-SSEXGKCCSA-N	434.470	1.191	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)c2cnn(CC(=O)NC3CCCCC3)c2)o1	746594116	JFXOREMFNAFUQQ-UHFFFAOYSA-N	444.536	1.842	50	20	IDGD	
C[C@H]1CCCN(S(=O)(=O)c2cc(C(=O)NNc3nccn(C)c3=O)ccc2Cl)C1	747946016	RWFCTLAFOXJCMI-LBPRGKRZSA-N	439.925	1.611	50	20	IDGD	
CCS[C@@H]1CCCC[C@@H]1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	750675213	IMNASTWCTSLRKL-JKSUJKDBSA-N	428.580	1.945	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)c1cn(-c2ccc(C(F)(F)F)cn2)nn1	751046412	DOGGYDNPFMRAPM-AWEZNQCLSA-N	434.334	1.282	50	20	IDGD	
CS(=O)(=O)CC1(CNC(=O)NNC(=O)COc2ccccc2Cc2ccccc2)CC1	753023574	OBECQFAIGBPYHM-UHFFFAOYSA-N	445.541	1.811	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)Cc2ccc(I)cc2)C[C@@H](C)O1	754174816	XZIHKXZUQNUEHJ-CHWSQXEVSA-N	445.301	1.480	50	20	IDGD	
CCCn1nc(C(=O)NNS(=O)(=O)c2cc(C(=O)OC)oc2C)c2ccccc2c1=O	754744198	HQVNHHRVJOJXSG-UHFFFAOYSA-N	448.457	1.118	50	20	IDGD	
Cn1cc(S(=O)(=O)N2CCCCC2)cc1C(=O)NNc1ccc(C(F)(F)F)nn1	755197528	ORVLKHVYGGJWIU-UHFFFAOYSA-N	432.428	1.765	50	20	IDGD	
Cc1cccc(NS(=O)(=O)c2ccc(C(=O)NNC(=O)Cc3cc[nH]n3)cc2)c1C	755283794	AKMQJKCXHZHNKI-UHFFFAOYSA-N	427.486	1.831	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2ccc(F)c(NC(C)=O)c2)c2ccccc2c1=O	755613863	JPGZHLRRMYFWCM-UHFFFAOYSA-N	426.408	1.980	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)NCCC(=O)NNC(=O)NCCc2cccs2)cc1	756810992	AYSYBPXUTVMQML-UHFFFAOYSA-N	438.531	1.192	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)Nc1ccc2c(c1)S(=O)(=O)CC2	757710195	UNABYUVTTJIKIT-UHFFFAOYSA-N	427.442	1.374	50	20	IDGD	
Cc1nn(-c2ccc(Cl)cc2)c(C)c1CC(=O)NNC(=O)C(=O)Nc1ccccn1	758820437	IFDYIFDAIMVYAH-UHFFFAOYSA-N	426.864	1.866	50	20	IDGD	
COc1cc(F)cc(NNC(=O)c2ccc3c(c2)S(=O)(=O)N(C[C@@H]2CCCO2)C3=O)c1	759310534	ABTJYEPDQMBAML-HNNXBMFYSA-N	449.460	1.915	50	20	IDGD	
CNc1nnc(CC(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)s1	759375308	PHHQMGNEYUYHCR-UHFFFAOYSA-N	449.496	1.342	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)c2cnn(CCO[C@H]3CCCCO3)c2C)cn1	759781855	MHTCAQMSDMCDHI-KRWDZBQOSA-N	434.522	1.770	50	20	IDGD	
O=C(CNC(=O)[C@@H]1c2ccccc2C(=O)N1Cc1ccccc1)NNc1ncc(F)cn1	760906139	ICQUNAALHZCHTB-IBGZPJMESA-N	434.431	1.572	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1)c1cccc([N+](=O)[O-])c1	761401190	PJVSNMQKPKQGKU-SECBINFHSA-N	426.838	1.460	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)NC1CCN(S(=O)(=O)C2CC2)CC1	761736776	LEMYHBULHUQSMS-UHFFFAOYSA-N	442.563	1.074	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)c1cc(S(=O)(=O)NCCCN(C)C)ccc1C	762210107	NEPYXANHGUWEJU-UHFFFAOYSA-N	448.545	1.308	50	20	IDGD	
Cc1csc([C@](O)(CC(=O)NNc2nccc(N3CCOCC3)n2)C(F)(F)F)n1	762856001	KXSKCVSLBWCFCU-OAHLLOKOSA-N	432.428	1.361	50	20	IDGD	
CCOC(=O)CCc1ccc(NC(=O)C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1	763442894	USGOKMLYCQIAJM-UHFFFAOYSA-N	428.401	1.490	50	20	IDGD	
CCN(CC)Cc1cccc(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1	763572039	LBSVAULLYKMBBB-IBGZPJMESA-N	426.473	1.454	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)[nH]n1)C(=O)Nc1csc(-c2ccccn2)n1	763604224	IZYHAAAXSFRSAM-UHFFFAOYSA-N	433.453	1.995	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)C(=O)Nc1ccc(=O)n(Cc2ccccc2)c1	763678346	DMBGTRJGNLYUQJ-UHFFFAOYSA-N	438.415	1.201	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(-c2csnn2)cc1	763716889	OOHUMFNLBNXQFY-UHFFFAOYSA-N	425.470	1.932	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3cc4c(s3)CCC4)cn2)C[C@@H](C)O1	763781347	JRQBDOSCLPMVDN-BETUJISGSA-N	443.529	1.645	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)C(=O)Nc1ccc(N2CCCCC2)cc1	763802338	BHCMOTJDZGUUAM-UHFFFAOYSA-N	441.444	1.750	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)[C@H]1CC(=O)N(c2cccc3ccccc23)C1	763821919	ZTOUZCOFUFWZCT-KRWDZBQOSA-N	431.452	1.165	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(C(=O)N3CCCC3)c2C)cc1	763822326	YNULWMRDOPAXFV-UHFFFAOYSA-N	438.484	1.704	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(S(=O)(=O)NC(C)(C)C)c2)cc1	763830426	OXBJLEDJHLSQLL-UHFFFAOYSA-N	446.529	1.726	50	20	IDGD	
CCCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)cc1	763848951	FLWKHEBXWGVITP-ZDUSSCGKSA-N	430.436	1.519	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccccc2S(C)(=O)=O)cc1	763861001	LOSXTQOVKXXEDT-ZDUSSCGKSA-N	449.485	1.042	50	20	IDGD	
CNC(=O)c1ccc(C)c(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(C(C)=O)cc2)c1	763870671	BOYFJOJXPQZGKH-AWEZNQCLSA-N	440.456	1.111	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)C(=O)Nc1cnc(N(C)C)nc1	763899865	DAYUDEHRDKDYAG-UHFFFAOYSA-N	425.474	1.374	50	20	IDGD	
Cn1ccnc1-c1cccc(NC(=O)C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)c1	763945385	XFWVSSPSGQZZHT-UHFFFAOYSA-N	445.439	1.378	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)Nc1ccccc1Br	764005288	XGYAVSDCTHFJIN-UHFFFAOYSA-N	444.083	1.950	50	20	IDGD	
CC(C)N(C)S(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)Cc2ccsc2)cc1	764035102	TUSYDQPTBULDHZ-UHFFFAOYSA-N	438.531	1.106	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2cc(Cl)cc(Cl)c2)c1	764077203	JDZOBLVYKKQRJK-UHFFFAOYSA-N	430.269	1.797	50	20	IDGD	
CCN1CCN(c2ccc(NC(=O)C(=O)NNC(=O)c3ccc(Cl)nc3)cc2)CC1	764101087	OGCDSLZGYTWHMP-UHFFFAOYSA-N	430.896	1.277	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccccc2CC(=O)OC(C)(C)C)c1O	764131193	OGPBMKBQHIKMLH-UHFFFAOYSA-N	443.456	1.685	50	20	IDGD	
O=C(CC1CC1)NNC(=O)C(=O)Nc1ccnn1Cc1ccc(OC(F)(F)F)cc1	764144735	PKKKTGSFJYDAMC-UHFFFAOYSA-N	425.367	1.716	50	20	IDGD	
NC(=O)CCSc1ccccc1NC(=O)C(=O)NNC(=O)c1cccc2cccnc12	764149733	ZWYYPKVZCLBKJB-UHFFFAOYSA-N	437.481	1.602	50	20	IDGD	
C[C@H]1CCCCN1C(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(C#N)cc2)cc1	764181431	CQPIFTLGTAGXLG-HNNXBMFYSA-N	433.468	1.973	50	20	IDGD	
O=C(CCC1CCCCC1)NNC(=O)C(=O)Nc1ccc2nc3n(c(=O)c2c1)CCC3	764217329	DUQRRZBBRSVZQI-UHFFFAOYSA-N	425.489	1.789	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)C(=O)Nc1ccc(C(=O)NCCc2ccccc2)cc1	764268896	XTWOKWGLVYCIKI-UHFFFAOYSA-N	445.479	1.383	50	20	IDGD	
CCOCC(=O)NNC(=O)C(=O)Nc1cc2c(cc1Sc1ccccc1)OCCO2	764318700	DTMTYZYUEHIHFX-UHFFFAOYSA-N	431.470	1.731	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)COCc2ccccc2)c(OC[C@H]2CCCO2)c1	764367789	MFCIGNUBECDKQQ-GOSISDBHSA-N	441.484	1.856	50	20	IDGD	
CCCn1cc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(OC)c(OC)c3)[nH]n2)cn1	764378831	OLGSVISOAGMTMH-UHFFFAOYSA-N	441.448	1.100	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)CN2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)cc1	765314038	ZRFQSHYAUAFFBJ-UHFFFAOYSA-N	445.545	1.463	50	20	IDGD	
O=C(CCC(=O)N1CCN(c2ccccn2)CC1)NNC(=O)Cn1ccc2ccccc21	765427066	LVBAXIMADOBAIL-UHFFFAOYSA-N	434.500	1.313	50	20	IDGD	
C[C@@H](CC(=O)NNC(=O)C(=O)Nc1ccccn1)C1CCN(C(=O)OC(C)(C)C)CC1	765507301	UVLQPJOFDIFMBU-AWEZNQCLSA-N	433.509	1.841	50	20	IDGD	
Cc1cc2ccccc2n1CC(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765737216	XNRNNJOUAKWCTL-UHFFFAOYSA-N	433.512	1.555	50	20	IDGD	
CC(C)(C)OC(=O)NCc1cc(C(=O)NNC(=O)CNC(=O)c2cccs2)ccn1	766156547	QBUIHCDQDZLIJB-UHFFFAOYSA-N	433.490	1.359	50	20	IDGD	
CCCn1nc(C)c(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)c1C	766653369	QORNHVMGZQEHHM-UHFFFAOYSA-N	426.521	1.129	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)N1CCC[C@H](c2nc3c(s2)CCCC3)C1	768527560	YOEPBVFGCIZOFC-ZDUSSCGKSA-N	431.518	1.965	50	20	IDGD	
COc1cc(N[C@@H]2CCCN(CC(=O)NNC(=O)c3ccc(C#N)cc3)C2)cc(OC)c1	768555122	HTDPIFWCTZACLI-GOSISDBHSA-N	437.500	1.913	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)c1cnc2c(c1)c(O)nc(=O)n2C1CC1	768636668	XPTKBCADJUBKTK-UHFFFAOYSA-N	445.457	1.001	50	20	IDGD	
C[C@]1(c2cccc(C(=O)NNC(=O)CCSc3ccc(F)cc3)c2)NC(=O)NC1=O	768929879	JHLKNRBAIIFVEE-HXUWFJFHSA-N	430.461	1.824	50	20	IDGD	
CCCCCCn1cc(S(=O)(=O)NNC(=O)c2cc3c(s2)CCC3)c(O)nc1=O	769621408	PBVQPMSVHUXIBN-UHFFFAOYSA-N	440.547	1.703	50	20	IDGD	
COc1ccnc(NNC(=O)c2cc(S(=O)(=O)Nc3ccccc3OC)ccc2O)n1	769693759	JOKSFONGTHXKHT-UHFFFAOYSA-N	445.457	1.757	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)NCCc3ccc4c(c3)OCCO4)nc21	770336747	QVWOIIDUJURKKH-UHFFFAOYSA-N	427.465	1.927	50	20	IDGD	
Cc1cccc(F)c1NNC(=O)NCCS(=O)(=O)N1CCN(c2ccccn2)CC1	771291946	ZQGBBVGHYZOCRH-UHFFFAOYSA-N	436.513	1.307	50	20	IDGD	
CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O[C@H](C)C(=O)NNC(=O)CC(C)C	772166854	HBGZOQJQTGXNTE-KZULUSFZSA-N	434.468	1.479	50	20	IDGD	
CCc1nn(C)c(OC)c1CNC(=O)NNC(=O)c1cc(OC)ccc1Br	772609564	NJNGZDOKICXZHL-UHFFFAOYSA-N	440.298	1.906	50	20	IDGD	
CC(=O)N1Cc2ccccc2C[C@H]1C(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772897740	LNQFFHMCMLUPGI-SFHVURJKSA-N	428.876	1.077	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@H]1CN(C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)CCO1	773292232	JQGNJGXCBIHRCB-KRWDZBQOSA-N	444.492	1.452	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@H](C(=O)NNc2cccc(S(C)(=O)=O)c2)C(C)C)cc1	776535119	ZVYQTTBOKONLAW-SFHVURJKSA-N	439.559	1.845	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2cc(F)c(OC)c([N+](=O)[O-])c2)cc1OC	777596671	YUZRDPUQDTXZQR-UHFFFAOYSA-N	429.382	1.383	50	20	IDGD	
Nc1ccc(C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1OC(F)(F)F	778357715	OVNVYDXGDXJKFO-UHFFFAOYSA-N	442.306	1.694	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)c2ccc3c(c2)C[C@H](C)N3S(C)(=O)=O)nc1C	778429749	SYXSSWDRFUYWBL-NSHDSACASA-N	433.490	1.429	50	20	IDGD	
CC(C)(C)OC(=O)NCc1ccc(NC(=O)C(=O)NNC(=O)Cc2cccnc2)cc1	778711916	XYCRROJFASJSEG-UHFFFAOYSA-N	427.461	1.435	50	20	IDGD	
Nc1nc(Cl)cc(NNC(=O)[C@@H]2CC(=O)N(c3ccccc3Br)C2)n1	779373348	HFRYPHLLSDDEEG-MRVPVSSYSA-N	425.674	1.971	50	20	IDGD	
C[C@@H]1CN(S(=O)(=O)c2ccc(C(=O)NNc3cc(Cl)nc(N)n3)cc2)C[C@@H](C)O1	779375207	MRTZWYQHYUUQAD-GHMZBOCLSA-N	440.913	1.267	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H]2CCC[C@@H]2CCO)c1	779710296	CATAUVXMQBUZCF-PBHICJAKSA-N	426.539	1.212	50	20	IDGD	
COC1(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)CCC1	780859393	CZQDTHFQIWHOKF-UHFFFAOYSA-N	446.529	1.678	50	20	IDGD	
N#CCCn1cc(/C=C(\C#N)C(=O)NS(=O)(=O)C[C@@H]2CCCO2)c(-c2ccccc2)n1	781512990	WYUUEMFGPUMWJI-WPNIOXTASA-N	439.497	1.996	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2ccc(COc3ccccc3)o2)cc1-n1cnnn1	781571451	JEEBTRJRYLMEQB-UHFFFAOYSA-N	434.412	1.918	50	20	IDGD	
COC(=O)c1scc(C)c1NC(=O)C(=O)NNC(=O)CN1CCCc2ccccc21	782121370	WFFXUAWQNNXFCE-UHFFFAOYSA-N	430.486	1.382	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)[C@@H]1CCCN(S(=O)(=O)CBr)C1	782434342	VOYUOVYFHVQCOB-LLVKDONJSA-N	428.349	1.022	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C(=O)Nc2ccnn2-c2cccc(F)c2)nc2ccccc21	782893849	NFFDROXRMDZLTR-UHFFFAOYSA-N	435.419	1.227	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccccc2OCC2CC2)nc1	783264861	SIHLNQDRUWUFLG-UHFFFAOYSA-N	447.517	1.639	50	20	IDGD	
Cn1c(=NNC(=O)C(=O)Nc2ccc(S(=O)(=O)C(F)F)cc2)sc2ccccc21	783349395	IENWBCOVCXAKHD-UHFFFAOYSA-N	440.453	1.807	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2cc(Cl)ccc2OC[C@H]2CCCO2)CCS(=O)(=O)C1	783427614	PFRJVSSPAPAZHZ-FZKQIMNGSA-N	445.925	1.034	50	20	IDGD	
CN(NC(=O)[C@H]1CCCN1Cc1ccccn1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	783703940	JBQGVYDJIDQDBQ-GOSISDBHSA-N	446.552	1.682	50	20	IDGD	
CN(NC(=O)c1cc2c(nc1O)CCCC2=O)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	783705061	USLXMOJLHRRUJG-UHFFFAOYSA-N	447.492	1.556	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NN=Cc2c[nH]ccc2=NC(=O)C(C)(C)C)c1	783800775	YNSSEDXVOYLIPX-UHFFFAOYSA-N	431.518	1.502	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)C(=O)Nc1ccc(C(F)(F)C(F)(F)F)cc1	784002548	SDBHIMPTVLCRRD-UHFFFAOYSA-N	448.304	1.450	50	20	IDGD	
CC(C)[C@@H](C)N1Cc2cccc(NC(=O)C(=O)NNC(=O)CNC(=O)c3ccco3)c2C1	784004441	NDPTUCJGJISPPI-CQSZACIVSA-N	441.488	1.156	50	20	IDGD	
O=C(NNc1nc(-c2ccc(Cl)cc2)no1)C(=O)Nc1cccc(-n2cnnn2)c1	784796076	ZNENSWOFYLHTOQ-UHFFFAOYSA-N	425.796	1.448	50	20	IDGD	
CCC(CC)NC(=O)[C@@H]1CN(C(=O)C(=O)NNc2cccc(OC)n2)c2ccccc2O1	784842292	LKOQQGQYPZHQHF-KRWDZBQOSA-N	441.488	1.632	50	20	IDGD	
CCCNC(=O)[C@@H]1CN(C(=O)C(=O)NNc2cc(F)c(F)cc2F)c2ccccc2O1	784886614	PMRQJOLYCLWYGU-KRWDZBQOSA-N	436.390	1.867	50	20	IDGD	
CCC(CC)NC(=O)[C@@H]1CN(C(=O)C(=O)NNc2ncc(F)cn2)c2ccccc2O1	784950659	WVAHOFWAXRLCPX-INIZCTEOSA-N	430.440	1.158	50	20	IDGD	
Cc1cc(C)n(-c2cccc(NC(=O)C(=O)NNC(=O)Cc3cn4ccccc4n3)c2)n1	785060879	RGZSWSJVSFTVRA-UHFFFAOYSA-N	431.456	1.465	50	20	IDGD	
O=C(NNc1c(F)cc(C(=O)NC2CC2)cc1F)C(=O)Nc1cccc2c1OCCC2=O	785099501	HFYWFECSLVXAAT-UHFFFAOYSA-N	444.394	1.904	50	20	IDGD	
O=C(NNc1c(F)cc(C(=O)NC2CC2)cc1F)C(=O)Nc1cnn(-c2ccncc2)c1	785099766	KCZLCYUXXNZHPA-UHFFFAOYSA-N	441.398	1.520	50	20	IDGD	
COc1ccc2nc(NNC(=O)C(=O)Nc3ccc(N4CCNC(=O)C4)cc3)c(C)cc2c1	785166180	GSFYAPDDUHJGBA-UHFFFAOYSA-N	448.483	1.570	50	20	IDGD	
O=C([C@@H]1[C@H](C(F)(F)F)[C@H]2CC[C@H]1O2)N1CCN(S(=O)(=O)CBr)CC1	785626680	XJBIHTIDNCSVDH-CHWFTXMASA-N	435.262	1.169	50	20	IDGD	
CC[C@H](O[C@@H]1CCC[C@H](C)C1)C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	786352666	SAWJXDYYIABDDN-CYJAXWMASA-N	434.489	1.891	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)Cc2c[nH]c3ccccc23)cc1N1CCNC1=O	787543597	JWTNKKCPQWTGTO-UHFFFAOYSA-N	434.456	1.335	50	20	IDGD	
COC(=O)c1cncc(S(=O)(=O)NNC(=O)c2ccc(F)cc2Br)c1	788479487	CCTRRSSHSHSORI-UHFFFAOYSA-N	432.227	1.393	50	20	IDGD	
CN(C)[C@@H]1CCOc2c(NC(=O)C(=O)NNC(=O)c3ccc4c(c3)OCCO4)cccc21	789731442	HUHXIKBMNFTEBY-MRXNPFEDSA-N	440.456	1.243	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1cccc2c1OCC[C@@H]2N(C)C	789733042	GFKTVGSHAVMOMV-KRWDZBQOSA-N	426.473	1.409	50	20	IDGD	
O=C(NNC(=O)[C@H]1OCC[C@H]1c1ccccc1)C(=O)Nc1cccc(C(=O)NC2CC2)c1	789822275	VQTKLNFCIKNHKX-OALUTQOASA-N	436.468	1.237	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNc3cccc(F)c3[N+](=O)[O-])cn2)C[C@@H](C)O1	790998651	QMKCUWBLJGSRKU-TXEJJXNPSA-N	432.412	1.824	50	20	IDGD	
CC1=C(C(=O)OCC(=O)C(C#N)=C2N(C)c3ccccc3N2C)[C@@H](C)n2ncnc2N1C	791463653	ASMYWZHKDPASPU-CQSZACIVSA-N	433.472	1.997	50	20	IDGD	
Cc1ccn(-c2ccc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc3ccccc3)cc2)n1	793025453	LCNGJCSIJIQTIA-UHFFFAOYSA-N	429.383	1.938	50	20	IDGD	
O=C(NNc1ccc2c(=O)[nH]ccc2c1)C(=O)Nc1cccc(OCC(=O)N2CCCC2)c1	793065149	JFZOXPSPAPEOAC-UHFFFAOYSA-N	449.467	1.611	50	20	IDGD	
Cc1cccc(C(=O)NNS(=O)(=O)c2ccc(C)c(I)c2)n1	793431860	PDFSPSXBVVLBIH-UHFFFAOYSA-N	431.255	1.926	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)N1CC=C(CCN2C(=O)c3ccccc3C2=O)CC1	796462415	CHKYQWBPCDMRMI-INIZCTEOSA-N	426.517	1.887	50	20	IDGD	
N#Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2F)ccc1OC(F)(F)F	799833825	DTFBRGFVTWVVBU-UHFFFAOYSA-N	440.309	1.761	50	20	IDGD	
C[C@@H](c1ccc(S(N)(=O)=O)cc1)N(C)C(=O)NNC(=O)c1cccc(OC(F)F)c1	799917632	ZGWZSJGABDBNCY-NSHDSACASA-N	442.444	1.983	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1c(F)ccc([N+](=O)[O-])c1C	800622961	WZBNVSJJVJZCKN-UHFFFAOYSA-N	434.380	1.606	50	20	IDGD	
COc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NNC(=O)Nc2ccc(Cl)cc2)cc1	802023023	KXVVVCQBTFMEOH-NSHDSACASA-N	426.882	1.868	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N1CCOC[C@@H]1[C@@H]1CCCO1	804881927	ZLVIFFLOBPZZFO-MAZHCROVSA-N	442.310	1.837	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)Nc1ccc(F)c(S(=O)(=O)N(C)C)c1	806543858	KWNWENKUSAEBNW-LLVKDONJSA-N	442.444	1.835	50	20	IDGD	
CN1CCN(C(=O)NNC(=O)[C@H]2CC(=O)N(C)[C@@H]2c2ccc(Cl)c(Cl)c2)CC1	807382311	AGVWLYLSDHYMGV-BLLLJJGKSA-N	428.320	1.501	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNc2cccc(F)n2)cc(OC)c(OC)c1OC	807391909	APOKCZAPLLPPAA-UHFFFAOYSA-N	436.396	1.505	50	20	IDGD	
Cc1cc([N+](=O)[O-])ccc1NNC(=O)C(=O)Nc1ccc(C(=O)N2CCOCC2)cc1	807456365	JAXZCOCIZASWKZ-UHFFFAOYSA-N	427.417	1.457	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)N[C@@H]2CCCN(C(=O)N3CCCC3)C2)cc1OC	807459037	PBVBWZBTAZQWCD-MRXNPFEDSA-N	433.509	1.718	50	20	IDGD	
C[C@H]1[C@H](NC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])CCN1Cc1ccccc1	807621773	JYAYMDWBJKTBOS-DOTOQJQBSA-N	427.461	1.967	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)COc2ccc(C)c(C)c2)cc2[nH]ccc12	808934920	XQAMBLQOENVWEF-UHFFFAOYSA-N	438.440	1.736	50	20	IDGD	
COc1ccc(-c2ocnc2C(=O)N2CCN(S(=O)(=O)CBr)CC2)cc1	809749672	IZDKUFCMLTWACM-UHFFFAOYSA-N	444.307	1.790	50	20	IDGD	
N#Cc1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2c(Cl)cccc2Cl)cc1	810338430	WBNRZGSZMCRJGY-UHFFFAOYSA-N	427.269	1.605	50	20	IDGD	
CC(C)CCn1nc(C(=O)NN=Cc2ccc(S(N)(=O)=O)cc2)c2ccccc2c1=O	811633901	VWXJTYNFRBTCSV-UHFFFAOYSA-N	441.513	1.854	50	20	IDGD	
Cc1coc(-c2cccc(NC(=O)C(=O)NNc3ccc(S(=O)(=O)N(C)C)cc3)c2)n1	813033338	OHESCRZFJLNUHG-UHFFFAOYSA-N	443.485	1.982	50	20	IDGD	
Cc1cnn(C)c1S(=O)(=O)NC(=O)/C(C#N)=C\c1cc(C)n(C[C@H]2CCCO2)c1C	813992121	UFQZPUKCXQADCD-ZTXRYZOMSA-N	431.518	1.738	50	20	IDGD	
N#Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)ccc1Br	815566044	HMEGQVJBVKFCER-UHFFFAOYSA-N	442.229	1.357	50	20	IDGD	
CCCOC(=O)c1ccc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)N(C)C)cc1	815751898	TYGMWACQZYWKID-UHFFFAOYSA-N	448.501	1.586	50	20	IDGD	
CCOc1ccc(NNC(=O)c2cccc(S(=O)(=O)N3CCN(C(C)=O)CC3)c2)cc1	817899061	HBANSNDESXNQEN-UHFFFAOYSA-N	446.529	1.695	50	20	IDGD	
Cn1cc(C(=O)NNS(=O)(=O)c2cccc(S(=O)(=O)NC3CC3)c2)c2ccccc21	844255321	LAYKTYXZMSTDTD-UHFFFAOYSA-N	448.526	1.242	50	20	IDGD	
Cc1c(C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cnn1-c1ccccc1F	844534524	KXBJSEFHIIRUBL-UHFFFAOYSA-N	441.375	1.846	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)NCCCN1C(=O)NC2(CCCC2)C1=O	915906149	MTCNEWHDQJKDCG-CYBMUJFWSA-N	435.456	1.178	50	20	IDGD	
CC(=NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)c1cccc(-n2cnnn2)c1	916260879	MPOKUBRTAUUKIE-UHFFFAOYSA-N	439.501	1.601	50	20	IDGD	
NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NNc3ccc(-n4cccn4)nn3)cc2)C1	918121152	DQPHVTISJSYOCF-MRXNPFEDSA-N	435.492	1.190	50	20	IDGD	
CC[C@H](NC(=O)NNC(=O)COc1ccc(F)cc1)c1ccccc1OCC(=O)NC	918222554	XRNOKUZXHQDQLE-KRWDZBQOSA-N	432.452	1.811	50	20	IDGD	
Cc1c(CC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)nnn1-c1ccccc1	919973947	PEWOGRLEWRNHSL-UHFFFAOYSA-N	447.543	1.478	50	20	IDGD	
CCOc1c(Br)cc(C=NNC(=O)N[C@@H]2CCS(=O)(=O)C2)cc1OC	920381781	UHWWDZIQDVUPOJ-LLVKDONJSA-N	434.312	1.677	50	20	IDGD	
CN1C(=C(C#N)C(=O)COC(=O)CN2C(=O)N[C@@](C)(C3CC3)C2=O)N(C)c2ccccc21	924226551	ZOYASPIEBBMPKH-QFIPXVFZSA-N	437.456	1.141	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N2CCc3nc[nH]c3C2)cc1	929081106	PHRLKONOVJAAMD-MHWRWJLKSA-N	445.483	1.649	50	20	IDGD	
C[C@@H](NC(=O)CCC(=O)C(C#N)=C1N(C)c2ccccc2N1C)C(=O)NCC(F)(F)F	1115887904	RWROSYJHOCRUPL-GFCCVEGCSA-N	437.422	1.840	50	20	IDGD	
CN(C)N(C(=O)COc1ccc(Cl)cc1Br)[C@H]1CCS(=O)(=O)C1	1317713024	LRHAKBMWUNEUAL-NSHDSACASA-N	425.732	1.974	50	20	IDGD	
CS(=O)(=O)Nc1ccccc1CC(=O)OCC(=O)NNC(=O)c1cccc(Cl)c1	1321748589	XTXBIZJOOAIFSY-UHFFFAOYSA-N	439.877	1.258	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)CC1(CC(=O)N2CCOCC2)CCCC1	1322110987	SARPRARIKNBJND-MRXNPFEDSA-N	435.496	1.940	50	20	IDGD	
O=C(COCc1ccncc1)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	1326651982	OTNQGMMMMBPRNQ-UHFFFAOYSA-N	443.467	1.761	50	20	IDGD	
Cc1c(C(=O)N2CC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)oc2ccccc12	1777746887	DAIGDMBOYSJSLQ-DEOSSOPVSA-N	448.284	1.178	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)[C@]3(F)CCCCC3(F)F)C2)C1	1778222691	JOXJQNFYWJGYKE-RBUKOAKNSA-N	448.486	1.107	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](C(=O)N2CC[C@@]3(CN(C(=O)[C@@H](F)Cl)CCO3)C2)C1	1778237822	LIRUTLGZCCKLBH-KSMMKXTCSA-N	433.908	1.608	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C/N=C/c2ccco2)C1	1779446387	JYQOSYLCVNIUQG-FDAVPHJGSA-N	440.338	1.996	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1nn[nH]c1C(F)(F)F)C2	1780706136	PVFQUMAIGUXVAV-GLKRBJQHSA-N	437.850	1.968	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)COc1ccc(O)nn1)C2	1780707795	LZQPONJYYUHPJM-PJIJBLCYSA-N	426.901	1.092	50	20	IDGD	
O=C(Cc1[nH]nc2c(Cl)cccc12)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1780937097	BEUQJVHCFBSZME-KXBFYZLASA-N	441.315	1.188	50	20	IDGD	
O=C(c1cc(O)nc(Cl)c1)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781326719	RQHSTXFEUXDYRU-WFASDCNBSA-N	436.665	1.575	50	20	IDGD	
C[C@H](C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@](C)(Cl)CCl)C2)n1ccnn1	1781548339	CXDGFCLBKVRBMB-KJWYOANISA-N	432.352	1.589	50	20	IDGD	
CC1(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cccc(B(O)O)c2)C3)CCCCC1	1782132873	ZBDRFGPSVDTZST-HYBUGGRVSA-N	442.365	1.464	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(C#N)cc(OC)c1)C2	1782173474	DOZUGNFKTGJKFE-WOIUINJBSA-N	449.935	1.948	50	20	IDGD	
O=C(c1cc[nH]n1)N1CCO[C@@]2(CCN(C(=O)[C@@H](Br)Cc3ccccc3)C2)C1	1783018200	IYFPZSIFBXHETF-OXJNMPFZSA-N	447.333	1.859	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3n[nH]c4ccc(F)cc34)CCO2)C1	1783534270	RWFSGMVHQPYKPK-BBATYDOGSA-N	439.285	1.929	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H]3C[C@@]34C(=O)Nc3ccccc34)C2)C1	1783548088	XNYYESGUNWTTNM-KFVVBQDRSA-N	431.920	1.744	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H]3CCc4ccccc4O3)C2)C1	1783848413	LQOMJOBVFWPZDR-NQYLQCIDSA-N	437.334	1.994	50	20	IDGD	
C/C(=C\c1ccc(C)o1)C(=O)N1CCO[C@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1	1783935008	MYZHMQKUALTMLE-ANCZKMTESA-N	432.521	1.194	50	20	IDGD	
O=C(C[C@H]1NC(=O)NC1=O)Nc1ccc(C2(NC(=O)CCBr)CCC2)cc1	1786765020	RDHNALCXEFYUNJ-CYBMUJFWSA-N	437.294	1.504	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)nc(Cl)c3)C[C@@H]21	1788761133	KDJIBZKRUGUGHL-QEJZJMRPSA-N	441.988	1.885	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]2C1	1788763505	GUFLLACHCKJQQA-JYJNAYRXSA-N	443.617	1.342	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)c1ccnc(Br)c1	1788819664	LMVGLNMTSRUURO-XUXIUFHCSA-N	446.729	1.037	50	20	IDGD	
COc1ccc(COCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]3C2)cc1	1791298523	XWNGNEQUJBVAQE-XIRDDKMYSA-N	445.343	1.995	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CNC(=O)c3ccc(C)cc3)[C@H]2C1	1792252261	SQCIZXPRZIXFMY-OKYOBFRVSA-N	435.952	1.722	50	20	IDGD	
Cc1cccc(C)c1N1C[C@@H](C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](O)CCl)CC1=O	1793110965	SYWVOZVOEMBYEK-OYSTVDSJSA-N	447.963	1.894	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(C=O)s1	1795745060	RCZJSJPOFYNBIL-NDPMZMCLSA-N	429.336	1.937	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(CCN3CCCC3)nc1)C2)[C@@H](F)Cl	1796363682	XCTCVPUMSKTQNN-UKBAYJJMSA-N	438.931	1.458	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1n[nH]c2ccccc12	1797415721	XFBHLUMFTOSNEV-LMWOUKEDSA-N	435.322	1.940	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccnn1C(C)C	1798155717	PRFQRHZVMZPEEL-HLPPOEQASA-N	427.343	1.841	50	20	IDGD	
CCc1noc(C)c1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)CBr)C2	1798174147	XKBXUOWHBANVOW-VFFTVRQLSA-N	428.327	1.780	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(F)nc1	1798720499	HTCWKQMQWOTZIF-TWXBYECESA-N	426.452	1.607	50	20	IDGD	
CC(=O)N[C@@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2)c1cccc(Cl)c1	1799070268	TYVULZNATUAXPM-IEHFGQBSSA-N	446.306	1.641	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cn3ccccc3n1)C2	1799275016	GSNOYNMOWAZFLC-UESRRSCYSA-N	425.316	1.774	50	20	IDGD	
COC(=O)[C@H]1CC[C@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Br)CC1	1799344780	VOLLINZORMHODV-PLJUSGQGSA-N	449.317	1.246	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cn3ncccc3n1)C2	1800640618	BZWBCRNTZYHFEX-OQMKEHIESA-N	436.310	1.106	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cc1cc([N+](=O)[O-])ccc1F)C2	1802333226	NHQDMZNAQRVZBY-MUJYYYPQSA-N	449.483	1.288	50	20	IDGD	
COC(OC)C(=O)N1CC[C@H](CNC(=O)[C@H](C)CBr)[C@H]1c1cccnc1	1803010669	IQGBRBZLBIOSJD-BPLDGKMQSA-N	428.327	1.737	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cnc3snnc3c2)[C@H]1c1cccnc1)[C@H](O)CCl	1803140901	IXYWTGVAAWVZIE-MAZHCROVSA-N	446.920	1.401	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cc3cccnc3[nH]2)[C@@H]1c1cccnc1)[C@H](O)CCl	1803143096	TZZROOWEVFPYLS-CGTJXYLNSA-N	427.892	1.877	50	20	IDGD	
CC(C)(F)C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1	1806982133	MCMRRUHNODIROC-PBHICJAKSA-N	428.468	1.148	50	20	IDGD	
NC[C@H](C(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)c1ccccc1	1807248411	QBUZOQKQZSGPKI-LWYYNNOASA-N	430.936	1.430	50	20	IDGD	
Cc1cncc(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)c1	1807363855	OVPKBMVACKSWJG-SIKLNZKXSA-N	444.300	1.098	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)[C@@H]2CC=CCC2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1	1807367110	XGUFMDRFYGLXLO-ZNLUXHQJSA-N	433.317	1.437	50	20	IDGD	
Cc1ccnc(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)c1	1807374203	FGIFOXJHBRHESK-DENIHFKCSA-N	444.300	1.098	50	20	IDGD	
Cn1ccc(CC(=O)NC[C@H]2CCN(C(=O)CO[Si](C)(C)C)[C@H]2c2cccnc2)n1	1807511096	AERDQBXDODZYOP-UTKZUKDTSA-N	429.597	1.915	50	20	IDGD	
COC(=O)CCC(=O)N1CC[C@H](CNC(=O)[C@@H](F)Br)[C@H]1c1cccnc1	1808661517	LTBGNLFRMZEBCX-DAXOMENPSA-N	430.274	1.731	50	20	IDGD	
O=C(CC[C@H]1CCOC1)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1	1809977703	HTORPRFYPZGRMF-SFHVURJKSA-N	428.338	1.028	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)C2CCSCC2)[C@H]1c1cccnc1	1814238965	ORBBCHKCCHMQIA-GHTZIAJQSA-N	447.605	1.604	50	20	IDGD	
C[C@H](CBr)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](C)n2cnnn2)[nH]n1	1814783439	OLQUREQKKNEZHY-WZRBSPASSA-N	439.318	1.681	50	20	IDGD	
O=C(/C=C/C1CCCC1)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1	1815343750	NATKVMQBXPFHLE-QJXUFPCYSA-N	439.346	1.795	50	20	IDGD	
CN[C@H](CC(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](C)Br)[nH]n1)C(=O)O	1817368301	IBFPZGNRYISCBW-JLLWLGSASA-N	430.303	1.248	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](O)CCl)CC2)c1ccc(-n2cccn2)nc1	1820732565	PVOURVITFSOLQI-GXTWGEPZSA-N	446.920	1.549	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CN2CCOC2=O)[nH]n1	1822183384	BVWCJPKSXGWJTL-ZYHUDNBSSA-N	428.287	1.637	50	20	IDGD	
O=C(N[C@@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1)c1cccc(=O)n1O	1823002453	RBZZSKSTJUQIBH-JMCQJSRRSA-N	445.270	1.458	50	20	IDGD	
CC(=O)N(C)CCC(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1	1823003333	YJFDIRZFJMDTAB-RNCFNFMXSA-N	435.319	1.614	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)COc3ccc(O)nn3)sc2C1	1824561473	SDODDDAGVCPVTG-VHSXEESVSA-N	425.898	1.647	50	20	IDGD	
CCOC(=O)C1(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@@H](Cl)COC)CC3)CC1	1824869648	YBNPZDGVRLQNGL-QWRGUYRKSA-N	429.926	1.652	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)CCC(F)(F)F)CC1	1826668879	URUKNGZGVHZRDD-GOSISDBHSA-N	440.271	1.942	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cn4cccnc4n3)C2)C1	1830362302	QSSUFQQYIBXZQN-HXUWFJFHSA-N	435.912	1.064	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3[C@H]4SC=C[C@H]43)C2)C1	1830544197	QHZYFYSGOGJODQ-FQRJBHLQSA-N	445.379	1.349	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)c(Cl)c1	1830736917	BWUYIWWJXQAVON-APWZRJJASA-N	431.316	1.318	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc3n(n2)CCC3)CC1	1831873300	OYBHPJKDXSTNRV-HXUWFJFHSA-N	444.580	1.436	50	20	IDGD	
C[C@@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)c3cnoc3)CC2)CC1	1833263125	BEVGZYOTDVMRBM-ZDUSSCGKSA-N	427.343	1.891	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cnc(Cl)s3)CC2)CC1)[C@@H](O)CCl	1833312153	GRINVMYYTHWNHZ-ZDUSSCGKSA-N	435.377	1.581	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)C(C)C)CC2)CC1	1833350184	TUJBJZQDYSCJHM-IRXDYDNUSA-N	432.403	1.748	50	20	IDGD	
Cc1cnc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@](C)(Cl)CCl)C3)C2)s1	1833804505	ZNCVMQYZDWQTCX-SJORKVTESA-N	436.361	1.758	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cncs3)CCO2)C1	1834470218	DLEIGODEEIXAOW-BLLLJJGKSA-N	432.340	1.387	50	20	IDGD	
N[C@H](CC(=O)NC1CCN(C2CCN(C(=O)[C@@H](F)Cl)CC2)CC1)c1cccnc1	1834762168	BLISBNWUJXRBBW-IEBWSBKVSA-N	425.936	1.578	50	20	IDGD	
CC(=O)Nc1cc(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](F)Cl)CC3)CC2)ccn1	1835262395	SHCQYOJTYFPQOS-GOSISDBHSA-N	439.919	1.760	50	20	IDGD	
O=C(c1cccn2cncc12)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836717572	YIXJLTIBPQOYPO-LJQANCHMSA-N	434.924	1.546	50	20	IDGD	
Cn1cc(C(=O)N2CCC(OC3CCN(C(=O)[C@H](O)CCl)CC3)CC2)c(C(F)F)n1	1836718329	VMKYDARZSCBVQI-OAHLLOKOSA-N	448.898	1.570	50	20	IDGD	
O=C(CCBr)N1CCC(OC2CCN(C(=O)Cn3cncn3)CC2)CC1	1837653526	KFGMIEFHDZMSKB-UHFFFAOYSA-N	428.331	1.062	50	20	IDGD	
C[C@H]1CCC[C@@H]1C(=O)N1CCC(OC2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1	1838298156	SXFQUGKPGZBGCA-PXNSSMCTSA-N	436.597	1.794	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(C)nc3O)CCO2)C1	1838667383	DEVJEXJGLXFCPX-UZLBHIALSA-N	425.913	1.573	50	20	IDGD	
O=C(c1c(F)cccc1Cl)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1	1838868013	FEFHBIWTIIIIDV-RDTXWAMCSA-N	435.279	1.149	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3Cc4ccccc4CN3)C2)C1	1839144518	CVGBGZCWBKQZEL-IPJJNNNSSA-N	435.952	1.175	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)Oc3cccnc3)C2)C1	1839148454	ADXCZNQEDADCBK-SYNHAJSKSA-N	425.913	1.323	50	20	IDGD	
Cc1nccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)n1	1839152588	FAPHAXCKVLBWBT-ROUUACIJSA-N	431.320	1.091	50	20	IDGD	
COc1ccnc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)c1	1839153352	HGIIXLWBONMVOH-RBUKOAKNSA-N	446.331	1.397	50	20	IDGD	
O=C(c1cccc(F)c1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839201591	BTLIQOJAPOFOAA-RHSMWYFYSA-N	433.249	1.586	50	20	IDGD	
O=C(CCc1ccoc1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839203554	ONELWAZMYOWAFI-WBVHZDCISA-N	433.274	1.359	50	20	IDGD	
C[C@H](C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2)c1ccccn1	1839203795	WOYDXFVWTXRSBC-DHSIGJKJSA-N	444.301	1.332	50	20	IDGD	
COc1cccc2[nH]cc(C(=O)N3CCO[C@@]4(COCCN(C(=O)[C@H](F)Cl)C4)C3)c12	1839557863	ZFPRXLYGKIYCNF-PXNSSMCTSA-N	439.871	1.781	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C1(CC)COC1)CCO2	1839778731	OHAJDVRVTIFFLP-RDTXWAMCSA-N	433.343	1.043	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3CCCCO3)C2)C1	1839962047	RTEAGBIFZPEIJX-MPGHIAIKSA-N	433.343	1.185	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccnc(C)n3)C2)C1	1839964015	CORLMJUJDLIHJJ-KSSFIOAISA-N	441.326	1.029	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)c(C)n1	1840034710	UYKJBZSTXUXCHY-LIRRHRJNSA-N	440.338	1.552	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@H]2CCN(C(=O)OC(C)(C)C)C[C@@H]2O)C1	1841028064	SDJVOMDNUNRSOC-JYJNAYRXSA-N	443.972	1.825	50	20	IDGD	
N#C/C(=C\c1ccc(Br)cc1)C(=O)N1CCCC12CN(C(=O)CNC(=N)N)C2	1845872723	RRRIAHQVJBFLIZ-RIYZIHGNSA-N	445.321	1.043	50	20	IDGD	
O=C(Nc1ccc(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](O)CCl)cc1)c1ccco1	1847561865	JOTWKRHEQQVPEI-ULQDDVLXSA-N	431.876	1.947	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCc2ccc(S(N)(=O)=O)s2)ccc1OC(C)C	10464588	IGQSHHSNCMBHPP-UHFFFAOYSA-N	442.519	1.336	50	20	IDGD	
Cc1cc(C)c(C)c(S(=O)(=O)N2CCC(C(=O)NNc3nnc(C)c(=O)[nH]3)CC2)c1C	11334810	ZXUABDZDFKLUKE-UHFFFAOYSA-N	448.549	1.251	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)CCn2cnc3sccc3c2=O)cc1	14369109	VRWKFYZFSNXQJP-ZDUSSCGKSA-N	430.486	1.862	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2	16177465	PWJCLFGMGNYQEE-UHFFFAOYSA-N	449.445	1.042	50	20	IDGD	
O=C(Cn1ccc(=O)[nH]c1=O)NNC(=O)c1ccc(COc2ccc(Cl)cc2)cc1	16644788	TZJYHUMPRBUMMB-UHFFFAOYSA-N	428.832	1.230	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccccc1)NNC(=O)c1ccc(COc2ccccc2)o1	26632308	YJAMYUNCSKXOBP-UHFFFAOYSA-N	443.481	1.988	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)CN2C(=O)c3ccccc3N3C(=O)CC[C@@]23C)c2ccccc21	105858169	MKMIWPBVLVBHMT-DEOSSOPVSA-N	445.479	1.938	50	20	IDGD	
C[C@H](NC(=O)c1cccc(Cl)c1Cl)C(=O)NNC(=O)CNC(=O)c1ccco1	725740013	BEXGPPXLRWFRFK-VIFPVBQESA-N	427.244	1.282	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NCc1ccc(OCC(F)(F)F)nc1	725873093	KAEJQTXKYYMWAK-UHFFFAOYSA-N	431.396	1.345	50	20	IDGD	
COC(=O)[C@H](C)CNC(=O)/C(C#N)=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	726177867	XMGSAXXGHUHMKK-GULXKOIASA-N	443.891	1.911	50	20	IDGD	
CC(=O)N1CCN(c2ccccc2CNC(=O)NNC(=O)COc2cccc(C)c2)CC1	726274435	QMEMHQQDAHUFRO-UHFFFAOYSA-N	439.516	1.573	50	20	IDGD	
CN(C)C(=O)[C@H]1CCCN1CCCNC(=O)NNC(=O)c1ccc(Cl)cc1Cl	726278001	UJKFBDJIGDREGO-OAHLLOKOSA-N	430.336	1.880	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)[C@@H](C)N2C(=O)NC3(CCCC3)C2=O)cc1OC	726522594	PPWRZWFDTJWUAN-CYBMUJFWSA-N	432.477	1.498	50	20	IDGD	
O=C(CN1C(=O)COc2cc(Br)ccc21)NNC(=S)NCC1CCC1	727865843	BPMRPTVHVVWFDV-UHFFFAOYSA-N	427.324	1.470	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)N(C)CC(=O)NNc2nc(-c3ccccc3)no2)cc1	728080434	GBSFWCTZZHVIOB-UHFFFAOYSA-N	444.473	1.459	50	20	IDGD	
CCc1c(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)[nH]c(C)c1C(C)=O	728330373	IXBNJELRNWEFLZ-MRXNPFEDSA-N	429.429	1.232	50	20	IDGD	
CCOc1cn(-c2ccccc2)nc1C(=O)OCC(=O)NNC(=O)Cc1nc(C)cs1	728732867	SNSBZPQHGHXALD-UHFFFAOYSA-N	443.485	1.583	50	20	IDGD	
C[C@H]1C[C@H](C)CN(S(=O)(=O)c2cccc(C(=O)NNC(=O)Cc3cccnc3)c2)C1	728852228	UVUIXZHKSGTTRU-HOTGVXAUSA-N	430.530	1.752	50	20	IDGD	
CN(C)N(C(=O)c1ccc(I)c(F)c1)[C@@H]1CCS(=O)(=O)C1	729170804	JHHLZFAOOYGTJI-SNVBAGLBSA-N	426.251	1.536	50	20	IDGD	
CC(=NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1)c1cccc(NS(C)(=O)=O)c1	729816647	NDCUEAURPDDQEJ-UHFFFAOYSA-N	444.922	1.513	50	20	IDGD	
CN(C)C(=O)CCN1CCC(NC(=O)NNC(=O)c2c(Cl)cccc2Cl)CC1	731501671	RDVLYNPYBQIPJD-UHFFFAOYSA-N	430.336	1.880	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N2CCN(c3cnccn3)CC2)cc1Br	732255841	OXFREGFFAFMTRG-UHFFFAOYSA-N	435.282	1.424	50	20	IDGD	
COc1cc(OC)c2cc(C(=O)NNC(=O)CCN3C[C@H](C)O[C@@H](C)C3)[nH]c2c1OC	732260572	GGZMNDFCROQMGV-STQMWFEESA-N	434.493	1.454	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)N2CCN([C@H]3CCN(c4ccccc4)C3=O)CC2)c1	732995987	VVLPPDOMRYWUPP-FQEVSTJZSA-N	432.484	1.336	50	20	IDGD	
CC(=O)N1CCC[C@H](C(=O)NNc2nc3ccccc3c(=O)n2CCCOC(C)C)C1	733266158	RTGZDUANYAAQJJ-KRWDZBQOSA-N	429.521	1.913	50	20	IDGD	
CC1CCC(N2C[C@H](C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)CC2=O)CC1	734239463	PIQFMOMMUURACP-SHARSMKWSA-N	425.530	1.269	50	20	IDGD	
O=C(NCCNS(=O)(=O)c1ccccc1[N+](=O)[O-])NNC(=O)c1ccc(Cl)cc1	735189527	BXNCUUXVIDPAQK-UHFFFAOYSA-N	441.853	1.171	50	20	IDGD	
COc1cc(I)c(C(=O)NNC(=O)c2cnn(C)c2)cc1OC	735444792	YXVYNSLUYGNUMA-UHFFFAOYSA-N	430.202	1.117	50	20	IDGD	
CC(C)[C@@H](NC1CCOCC1)C(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12	740748857	BEYJLYXXYGHSPJ-GOSISDBHSA-N	429.521	1.532	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NCCOc2ccc3c(c2)OCO3)cc1	743558299	RJGKVLRELYPISS-UHFFFAOYSA-N	436.446	1.234	50	20	IDGD	
CCOC(=O)N1CCC(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)CC1	744620616	LOABUMTWZDLYHA-UHFFFAOYSA-N	440.522	1.019	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1ccc(-n2ccnc2)cc1	744621618	VTSMSRKJRNOANC-UHFFFAOYSA-N	427.486	1.650	50	20	IDGD	
CSC[C@@H](C(=O)NNC(=O)CCOc1ccccc1)N1C(=O)[C@H]2CCCC[C@H]2C1=O	747182574	OIVKILGBNZHZRQ-BBWFWOEESA-N	433.530	1.510	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)/C=C\c1ccccc1)C(=O)NNC(=O)Cc1ccncc1	747428732	UUHXARHXBCIXMG-BLSFAOBESA-N	448.570	1.484	50	20	IDGD	
C[C@H](c1ccc([S@](C)=O)cc1)N(C)C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	747491356	UAKGIYVPGATPST-OSXTUODASA-N	427.490	1.447	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCOC[C@@H]2C[C@@H](O)c2ccccc2)cc1OC	747656385	IRCYNTVKYPGDAH-RBUKOAKNSA-N	443.500	1.289	50	20	IDGD	
Cn1ccc(CNC(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)c1	747954212	KIZMAWFAHUCIMG-UHFFFAOYSA-N	430.468	1.928	50	20	IDGD	
C[C@@]1(c2ccc(C(=O)NNC(=O)CSc3ccc(Cl)cc3)cc2)NC(=O)NC1=O	748516708	JOKPTFYWQQIHNX-IBGZPJMESA-N	432.889	1.948	50	20	IDGD	
Cn1nc(Br)c2c(=O)n(CC(=O)NNc3cccc4c3CCCC4)cnc21	748581176	YLDRNNZKSYTRIH-UHFFFAOYSA-N	431.294	1.915	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)C1(S(C)(=O)=O)CCCC1	749838092	OGHFAQVZVWQJQX-LLVKDONJSA-N	433.324	1.721	50	20	IDGD	
CC(C)Cn1[nH]c(CC(=O)NNC(=O)COc2ccc(Br)cc2)cc1=O	751199483	BKNNYWDPFWMOLM-UHFFFAOYSA-N	425.283	1.364	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(=O)n(-c3cccc(F)c3)c2)cc1	751771147	CIHZDUYCSYLKBU-UHFFFAOYSA-N	434.383	1.466	50	20	IDGD	
CCCc1c(C(=O)NNC(=O)C(=O)N2CCCC2)cnn1-c1cc(F)c(OC)cc1F	751781919	SJCLBSSYXUOZCQ-UHFFFAOYSA-N	435.431	1.495	50	20	IDGD	
O=C(NCCNS(=O)(=O)c1ccc(Cl)s1)NNC(=O)c1c[nH]c2ccccc12	752689173	OTHRPITUGRCUCG-UHFFFAOYSA-N	441.922	1.805	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)Nc1cccc(S(=O)(=O)N2CCOCC2)c1	755354529	OZEJYDVPKIYMOO-UHFFFAOYSA-N	436.465	1.242	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)c(Br)n1	755411813	UXKUBAGAUREXMX-UHFFFAOYSA-N	440.323	1.829	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)c1cc(Br)cc(C(F)(F)F)c1	755424719	GSNBIOSPIZBJDC-ZETCQYMHSA-N	429.214	1.664	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)Nc1cccc(NC(=O)Nc2ccccc2)c1	755597979	CYYKAEQQKPMIPA-CYBMUJFWSA-N	431.474	1.918	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)Nc1ccc(NC(=O)CN2CCOCC2)cc1	755599688	OIHPYKZFMDJEBW-UHFFFAOYSA-N	445.451	1.328	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)Nc1cccc(C(=O)NCCC(N)=O)c1	756388987	ADEYARXRLLZAHI-UHFFFAOYSA-N	433.852	1.420	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2C[C@H](C)C(=O)N(C)c3ccccc32)cc1OC	756602761	XMYQKJZBBKUTHT-AWEZNQCLSA-N	426.473	1.584	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)Nc3ccn(CC(=O)N4CCOCC4)n3)cc2C1	756652925	COBXIBBFAFXBTK-CYBMUJFWSA-N	446.533	1.395	50	20	IDGD	
C[C@@H]1C[C@H](NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)CN1Cc1ccccc1	757762105	JMSYPDHJVNIXKU-WBVHZDCISA-N	434.500	1.541	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)Nc1ccc2nc(N3CCOCC3)oc2c1	757776875	IIBXBVWDUOBTCM-UHFFFAOYSA-N	449.427	1.780	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)Nc2ccc3nc(N4CCOCC4)oc3c2)cc1	757777821	RGMLNQFZWDTYAH-UHFFFAOYSA-N	436.428	1.768	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H]2COc3c(Cl)cccc32)c1	757793573	FNONTPRBZLXTRU-OAHLLOKOSA-N	438.893	1.668	50	20	IDGD	
O=C(NNc1ncccc1[N+](=O)[O-])C1CCN(S(=O)(=O)c2cc(F)ccc2F)CC1	759293747	DHWGMGPXSYYAMZ-UHFFFAOYSA-N	441.416	1.812	50	20	IDGD	
C[C@@H](CC(=O)NNC(=O)c1ccc2ccccc2n1)NS(=O)(=O)c1cccnc1Cl	760210161	CDCIMFQKVVLKIX-LBPRGKRZSA-N	447.904	1.801	50	20	IDGD	
CO[C@@](C)(C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1)c1ccccc1F	760449530	QFKIZRDOFJSMQT-HSZRJFAPSA-N	442.491	1.293	50	20	IDGD	
CC[C@@H](NC(=O)NNC(=O)CNC(=O)c1ccco1)[C@@H]1CN(Cc2ccccc2)CCO1	760751411	NASAPIYQDHAYKV-MJGOQNOKSA-N	443.504	1.019	50	20	IDGD	
CC(=O)N(CCc1ccccc1)CC(=O)NNc1nc(O)c2cnn(C(C)(C)C)c2n1	761722996	XGORDQSACWOVTJ-UHFFFAOYSA-N	425.493	1.821	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cn1)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	761852043	HDGLJIKUINBPQR-UHFFFAOYSA-N	444.411	1.766	50	20	IDGD	
O=C(NNS(=O)(=O)c1c(Br)cc2nc(O)oc2c1Cl)c1ccc[nH]1	763417363	RSGQDFNQAPCEOI-UHFFFAOYSA-N	435.643	1.901	50	20	IDGD	
COc1cccc(-c2nsc(NC(=O)C(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)n2)c1	763442370	OIYGCKNZFVUEAA-UHFFFAOYSA-N	442.413	1.522	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(-c3ccccc3C)nn2C)cc1OC	763551087	LDLFKBQTXXGWNI-UHFFFAOYSA-N	437.456	1.812	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)Nc1ccnn1-c1cccc(Cl)c1	763574485	ZVWNOQOKYXWCAI-INIZCTEOSA-N	441.831	1.452	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(N3CCO[C@H](C)C3)cc2)c1	763630936	RYIOXHCYIYSVNH-MRXNPFEDSA-N	426.473	1.385	50	20	IDGD	
O=C(COc1cccc(C(F)(F)F)c1)NNC(=O)C(=O)Nc1cccc2c1OCCO2	763641858	YFKWTHGGGWVZPT-UHFFFAOYSA-N	439.346	1.642	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)C(=O)Nc1cccc(N2CCCCC2=O)c1	763678326	CQNLJTCRFHJOEU-UHFFFAOYSA-N	428.420	1.508	50	20	IDGD	
O=C(COc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1ccn(-c2ncccc2F)n1	763693926	CSUXASOQUDQGIN-UHFFFAOYSA-N	432.799	1.225	50	20	IDGD	
COCCOc1ccc(F)cc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccccc1F	763851017	SUOZSABQALLEOE-LBPRGKRZSA-N	437.399	1.543	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)ccc1C(=O)NC(C)C	763872810	PABFIZTYSOXZMV-CQSZACIVSA-N	444.463	1.826	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccccc1C(=O)NC(C)(C)C	763873439	SXAUBDIBKJGPDV-ZDUSSCGKSA-N	444.463	1.907	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@H](C)C(=O)NNC(=O)C(=O)Nc1cnc2c(c1)COCC2	763884927	ZEWCJYYEACVQFM-CYBMUJFWSA-N	446.891	1.978	50	20	IDGD	
C[S@@](=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Br)s2)cc1F	763940643	MFUJQTQHJOJKBI-RUZDIDTESA-N	448.295	1.787	50	20	IDGD	
COc1cc(F)c(NC(=O)C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc1OC	763944766	PKGCIEYOMGBHCU-UHFFFAOYSA-N	443.391	1.134	50	20	IDGD	
O=C(NNC(=O)c1cnccn1)C(=O)Nc1ccnn1Cc1ccc(Cl)cc1Cl	764030121	BPMRNHLOJDBGFO-UHFFFAOYSA-N	434.243	1.428	50	20	IDGD	
CS(=O)(=O)c1ccccc1NC(=O)C(=O)NNC(=O)Cc1ccc2ccccc2c1	764085084	YEPMSDQNAQEFLJ-UHFFFAOYSA-N	425.466	1.572	50	20	IDGD	
CCCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)nc2)cc1Cl	764093264	QPKNBBOJWYGSKP-UHFFFAOYSA-N	438.271	1.928	50	20	IDGD	
Cc1cc(C(=O)N2CCSCC2)ccc1NC(=O)C(=O)NNC(=O)CCc1ccco1	764170408	XPOYECYTFLHJEZ-UHFFFAOYSA-N	444.513	1.496	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc2c(c1)CCN2C(=O)C(=O)NNC(=O)CC(C)(C)C	764198422	FXRFVRDUMJQCEC-UHFFFAOYSA-N	438.550	1.190	50	20	IDGD	
CN(C)CC(=O)NNC(=O)C(=O)Nc1ccc(C(=O)N2CCC[C@@H]2c2ccccc2)cc1	764203963	GPWUARJVKSDWDB-LJQANCHMSA-N	437.500	1.311	50	20	IDGD	
CC(=O)N(C)c1ccc(NC(=O)C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)cc1	764204066	RSZDJBYNXMCVNT-UHFFFAOYSA-N	435.481	1.060	50	20	IDGD	
O=C(CCC1CCCCC1)NNC(=O)C(=O)Nc1cccc(N2CCCS2(=O)=O)c1	764217741	HMDQDPAYXWYUQI-UHFFFAOYSA-N	436.534	1.673	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cccc(OC(F)F)c2)cc1	764250172	KSEDRPDOQJLTNO-UHFFFAOYSA-N	427.385	1.091	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)C(=O)Nc1ccnn1Cc1c(Cl)cccc1Cl	764268351	IZOOWOBDAUCAMG-UHFFFAOYSA-N	447.282	1.962	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc3ccccc3o2)cc1NS(C)(=O)=O	764331719	YKOYRGYOYNHNFN-UHFFFAOYSA-N	430.442	1.512	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)C(=O)Nc1ccn(CCc2ccncc2)n1	764350895	MOSQGPKENVTHMR-UHFFFAOYSA-N	444.455	1.106	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)C(=O)Nc1cccc(F)c1I	764355064	YNPJOHZXSFMPQV-UHFFFAOYSA-N	442.188	1.154	50	20	IDGD	
O=C(NNC(=O)[C@H]1COCCO1)C(=O)Nc1ccc(Cl)c(C(=O)Nc2ccccc2)c1	764425278	OIYOJQWMGJSNMT-MRXNPFEDSA-N	446.847	1.094	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COCCO1)C(=O)Nc1ccccc1OCc1cccc(Cl)c1	764427564	AFBPZYAIYORASS-KRWDZBQOSA-N	433.848	1.420	50	20	IDGD	
CC[C@@H](C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1)c1ccc(F)cc1	764462706	PKESWPZCZGOIAT-QGZVFWFLSA-N	435.525	1.794	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ccc[nH]2)cc(Br)c1F	764662778	KYIFQBBFQZTQHR-UHFFFAOYSA-N	427.186	1.103	50	20	IDGD	
CCCc1c(NC(=O)C(=O)NN[C@@]2(C)CCS(=O)(=O)C2)cnn1-c1ccc(C)cc1	764674162	VNQJYGQESSOZMK-FQEVSTJZSA-N	433.534	1.270	50	20	IDGD	
Cn1c(=O)c2c(ncn2CC(=O)NN=Cc2ccccc2OCc2ccccc2)n(C)c1=O	764812972	TVQYXXRMZZYUSU-UHFFFAOYSA-N	446.467	1.163	50	20	IDGD	
Cc1cc(S(C)(=O)=O)cc(C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)c1C	765319577	GSAMSFQTEQIOIG-UHFFFAOYSA-N	427.523	1.773	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)[C@@H]1C[C@]12CCc1ccccc12	765738668	MJPFHMOSMWMUML-OFVILXPXSA-N	432.524	1.496	50	20	IDGD	
Cc1nn(C)c(C)c1CCC(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	765758324	JBNUABJSRXFVPU-UHFFFAOYSA-N	446.983	1.588	50	20	IDGD	
COc1ccc(CN2CC[C@H](NC(=O)NNc3ccccc3S(C)(=O)=O)C2=O)cc1	765783782	NNQPSCZLTHBMPB-KRWDZBQOSA-N	432.502	1.526	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1ccc(C)c(I)c1	766270531	JDIGGKKEFCGILD-UHFFFAOYSA-N	427.202	1.480	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)CCc1c(C)nc2c(C#N)cnn2c1C	767281704	DSMLULHSWOVCNQ-UHFFFAOYSA-N	448.483	1.392	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3cnc4c(c3)c(C)nn4C)n[nH]2)cc1OC	768279766	RTFAKPBNZYEOMM-UHFFFAOYSA-N	435.444	1.759	50	20	IDGD	
COc1ccccc1C(C)(C)C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	769104573	FLUZUBKCUZYFOO-UHFFFAOYSA-N	447.561	1.447	50	20	IDGD	
C[C@H](C(=O)NNC(=O)c1ccccc1O)N1C(=O)c2ccc(Br)cc2C1=O	769647649	KIXUHZAXVHYBPS-SECBINFHSA-N	432.230	1.600	50	20	IDGD	
N#C/C(=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)O[C@H]1CCNC1=O	769952076	VCVBFPAHWSBIQN-OVHOFWQVSA-N	427.848	1.418	50	20	IDGD	
C[C@@H]1CN(Cc2ccc(CNC(=O)NNc3nc(O)c4cnn(C)c4n3)cc2)C[C@@H](C)O1	770341304	MFSXKAIHFXMKSP-ZIAGYGMSSA-N	440.508	1.504	50	20	IDGD	
CC(C)CC(=O)N1CCC(NC(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)CC1	770367301	JVHVLJOLNJYZDS-UHFFFAOYSA-N	432.529	1.950	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)NC[C@@H](c3cccc(Cl)c3)N3CCOCC3)nc21	770373126	SMSLVCPETZXUQS-HNNXBMFYSA-N	446.899	1.422	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)CN1C(=O)N[C@](C)(c2ccc(Br)cc2)C1=O	771235314	NPUGJFDTHSUDGM-GOSISDBHSA-N	448.277	1.016	50	20	IDGD	
CCn1c(=O)c(=O)[nH]c2cc(C(=O)NNC(=O)[C@H](C)Oc3cccc(Cl)c3)ccc21	772964041	OESZLFWSACDREV-NSHDSACASA-N	430.848	1.592	50	20	IDGD	
Cn1cc(NC(=O)C(=O)NNC(=O)c2ccccc2Br)c(C(F)(F)F)n1	773515026	IUAYMZQGMGRMRR-UHFFFAOYSA-N	434.172	1.601	50	20	IDGD	
COC(=O)c1cc(OC)c(OC)c(OC)c1NC(=O)C(=O)NNc1c(F)cccc1F	773706205	XLIPLABVHWJCQN-UHFFFAOYSA-N	439.371	1.859	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2ccnn2Cc2ccc(C(F)(F)F)cc2)n1	773730834	NGDSNPRPAFDBEF-UHFFFAOYSA-N	435.366	1.831	50	20	IDGD	
Cn1cc([C@H](NCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c2ccc(F)cc2)cn1	774352898	QVMJMIKCIQMDQO-LJQANCHMSA-N	426.408	1.608	50	20	IDGD	
O=C(COC(=O)c1ccccc1OC(F)(F)F)NNC(=O)[C@H]1COc2ccccc2O1	775110649	UZJFEWAXVAXOAL-OAHLLOKOSA-N	440.330	1.729	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)Nc2ccnn2[C@H]2CCS(=O)(=O)C2)cc1	776059966	STDBTCGDECYKNQ-HIFRSBDPSA-N	449.489	1.066	50	20	IDGD	
COC(=O)Cn1cccc1C=NNC(=O)CN1c2cccc3cccc(c23)S1(=O)=O	776185828	PQXXUZYGBVIKHL-UHFFFAOYSA-N	426.454	1.473	50	20	IDGD	
C[C@@H](CN1CCN(c2ccccn2)CC1)NC(=O)NNc1cccc(S(C)(=O)=O)c1	776620938	CEBTYCNOURAITM-INIZCTEOSA-N	432.550	1.322	50	20	IDGD	
COCCO[C@H]1COCC[C@@H]1NC(=O)NNC(=O)COc1ccccc1-c1ccccc1	777277773	DCFCDBQMPVFGSV-FPOVZHCZSA-N	443.500	1.883	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)c2cccc([N+](=O)[O-])c2N2CCOCC2)nc1C	778427844	GFJBJWFUHIKHSH-UHFFFAOYSA-N	430.421	1.463	50	20	IDGD	
COc1cccc(C(=O)NNS(=O)(=O)c2ccc(NC(=O)c3ccncc3)cc2)c1O	779833252	DMRNMCVUYHWAAZ-UHFFFAOYSA-N	442.453	1.671	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)[C@H]2C[C@]23CCN(C(=O)OC(C)(C)C)C3)nc2ccccc21	780171908	UNLLLISMIBENAR-PEBXRYMYSA-N	427.505	1.910	50	20	IDGD	
COc1cc(S(=O)(=O)NNC(=O)NCc2ccco2)c(OC)cc1Br	780384286	QHRWJMIQGVJKNQ-UHFFFAOYSA-N	434.268	1.752	50	20	IDGD	
COCC[C@H](NC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1)c1ccco1	780884016	ZCKBJZQQBYRRKO-INIZCTEOSA-N	438.506	1.317	50	20	IDGD	
N#C/C(=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)O[C@@H]1CCOC1=O	782180077	CSSXNRSMNSIUSM-RCBBPTIPSA-N	428.832	1.845	50	20	IDGD	
O=C(NNc1cc(Cl)ccc1Cl)C(=O)Nc1cnn(CCN2CCOCC2)c1	783368462	WPZKLUFJSKYUMQ-UHFFFAOYSA-N	427.292	1.604	50	20	IDGD	
Cc1ccccc1NC(=O)NNC(=O)C(=O)Nc1ccc(C)c(S(=O)(=O)NC2CC2)c1	783416842	CKIVDDKUMYMFGL-UHFFFAOYSA-N	445.501	1.536	50	20	IDGD	
Cc1ccccc1NC(=O)NNC(=O)C(=O)Nc1ccc(S(=O)(=O)NC(C)C)cc1	783417286	PEQGAYLHZAVOQT-UHFFFAOYSA-N	433.490	1.473	50	20	IDGD	
CS(=O)(=O)N1CCc2c(NC(=O)C(=O)NNc3nccc4sccc34)cccc21	783445100	NUDLJZUFNVWPLV-UHFFFAOYSA-N	431.499	1.700	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)CSc1ccc(Cl)cc1[N+](=O)[O-]	783953835	KFYFEPINOSDELY-UHFFFAOYSA-N	428.879	1.979	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1cccc(CN2CCCCC2)c1	784003723	MXDCDYYURIKMFI-UHFFFAOYSA-N	443.529	1.250	50	20	IDGD	
CNS(=O)(=O)c1cc(NC(=O)C(=O)NNc2ccc(OC(F)F)cc2)ccc1C	784309904	JJCPQIFTKDYMEO-UHFFFAOYSA-N	428.417	1.586	50	20	IDGD	
Cc1c(NNC(=O)C(=O)Nc2ccc(S(=O)(=O)N(C)C3CC3)cc2)cccc1[N+](=O)[O-]	784351193	LKRGBSMCCPPUEN-UHFFFAOYSA-N	447.473	1.768	50	20	IDGD	
CS(=O)(=O)Cc1ccccc1NC(=O)C(=O)NNc1ccc([N+](=O)[O-])cc1Cl	784384977	XEFSCVRXQOHXDW-UHFFFAOYSA-N	426.838	1.875	50	20	IDGD	
COC(=O)COc1ccc(N(C)CC(=O)NNC(=O)c2cc(Cl)ccc2OC)cc1	784558920	OVCPOYIQDYACNA-UHFFFAOYSA-N	435.864	1.798	50	20	IDGD	
COCCOc1ccc(F)cc1S(=O)(=O)NNC(=O)c1ccc(OC)c(OC)c1	786714627	WOWGKIASMRWMLL-UHFFFAOYSA-N	428.438	1.491	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2cccc(C(F)(F)F)c2)cccc1N1CCNC1=O	787544830	YKKWHFGSIIQAAS-UHFFFAOYSA-N	449.389	1.943	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@H]2CC23CN(C(=O)OC(C)(C)C)C3)cc(OC)c1OC	788672423	USUSEPFSJBKWGA-CYBMUJFWSA-N	435.477	1.730	50	20	IDGD	
COc1cc(NNC(=O)C(=O)Nc2ccc3oc(=O)n(CCN(C)C)c3c2)ccc1Cl	789804715	MGCDVFISPUGACW-UHFFFAOYSA-N	447.879	1.900	50	20	IDGD	
Cn1ncc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)c1C(F)(F)F	789813373	ROUFIHHHVFVFAY-AAEUAGOBSA-N	425.367	1.098	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)[C@@](C)(O)Cn1cc(C(F)(F)F)ccc1=O	792032844	CYWOGKGIWWOZEO-KRWDZBQOSA-N	447.797	1.741	50	20	IDGD	
C[C@H]1C(=O)CC[C@H]1CC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	792789625	LWNOWWJOZWNVKB-WBVHZDCISA-N	443.525	1.931	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1cccc(Br)n1	793021577	FOUBDYNKZALBSR-SECBINFHSA-N	425.214	1.537	50	20	IDGD	
Cc1cc(N2C[C@@H](C(=O)NNc3ccccc3S(=O)(=O)N(C)C)CC2=O)ccc1F	795160665	IBKTTXXEDMMDQT-AWEZNQCLSA-N	434.493	1.881	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NC[C@@]2(C)CCN(Cc3ccccc3)C2)c2ccccc2c1=O	798483735	LIHAFBWOWRRVCB-XMMPIXPASA-N	448.527	1.790	50	20	IDGD	
COCC1(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)CCC1	800730311	KTXYKXFSZHWIJD-UHFFFAOYSA-N	438.550	1.622	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@H](C(=O)NNC(=O)Nc2ccc(Cl)cc2)[C@H](C)O)cc1	802017836	BKBQPFCIOVCZLB-LRDDRELGSA-N	440.909	1.529	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)N[C@H]1CCCN(C(=O)Cc2ccccc2)C1	802475713	GWGZHVBOPWNTHJ-SFHVURJKSA-N	434.500	1.441	50	20	IDGD	
COc1ccc(CS(C)(=O)=O)cc1NC(=O)NNC(=O)c1cc(Br)c[nH]1	806637270	AUASSSKYOSHTCI-UHFFFAOYSA-N	445.295	1.797	50	20	IDGD	
COCCNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2cccc3ncccc23)c1	806978532	FOSWWSCFOPYKRP-UHFFFAOYSA-N	435.440	1.011	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)c1c(F)cncc1F	807554163	CRTUJNJXIDIDNX-HNNXBMFYSA-N	432.475	1.964	50	20	IDGD	
CCc1nnc(NC(=O)[C@@H](C)[C@@H](C)NC(=O)NNC(=O)COc2ccc(C#N)cc2)s1	807566654	ZPJCFAMGWUBWSP-NWDGAFQWSA-N	445.505	1.345	50	20	IDGD	
CC1(C)CCCc2sc(NC(=O)C(=O)NNC(=O)c3ccc4c(c3)OCCO4)nc21	810384999	TYQPVFBKSQNKEU-UHFFFAOYSA-N	430.486	1.928	50	20	IDGD	
O=C(NC[C@@H]1COc2ccccc21)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	812440766	IJBGAVIHHYRODO-MRXNPFEDSA-N	444.513	1.591	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1)NOC/C=C/Cl	812704891	NJOFIJCTPWJZAI-BJMVGYQFSA-N	438.893	1.793	50	20	IDGD	
O=C(CN1c2cccc3cccc(c23)S1(=O)=O)NNC(=O)Nc1ccc2c(c1)OCO2	813470583	MVESMONUMBPDTL-UHFFFAOYSA-N	440.437	1.930	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1)[C@H]1CCc2nncn2C1	815157091	IFKRAQDMTZKRDK-SFTDATJTSA-N	430.512	1.615	50	20	IDGD	
COCc1cc(NC(=O)C(=O)NNC(=O)COc2cc(C)cc(C)c2)cc(C(=O)OC)c1	815564727	QMRUDNXRBIJFMH-UHFFFAOYSA-N	443.456	1.401	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1cc(C2(C)CCCC2)on1	815752156	GJLYMESZBMNLSN-UHFFFAOYSA-N	435.506	1.838	50	20	IDGD	
Cc1nccc(CCC(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)n1	815827068	KVUKWOJIRFQTAM-UHFFFAOYSA-N	430.940	1.336	50	20	IDGD	
O=C(NNc1cccc(Cl)n1)[C@H]1CCCN1S(=O)(=O)c1cccc([N+](=O)[O-])c1	817004916	WBSUBLWPSMNLQY-CYBMUJFWSA-N	425.854	1.940	50	20	IDGD	
Cn1c(=NNC(=O)c2cccc(S(=O)(=O)NC[C@@H]3CCCO3)c2)sc2ccccc21	848949199	NFLPDSVMLWWJMK-HNNXBMFYSA-N	446.554	1.943	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2cccc(C(=O)OC)c2)c1	861708739	IOFOPIXKNJTCFP-UHFFFAOYSA-N	448.501	1.970	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NCCCCOc2ccc(F)cc2)c2ccccc2c1=O	916222536	AAAUKSBSYUAENV-UHFFFAOYSA-N	427.436	1.876	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCc2ccc(OC(C)C)cc2)cc1	916374332	TYTHIISSANHJOK-UHFFFAOYSA-N	448.545	1.933	50	20	IDGD	
O=C(NCCCn1cncn1)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	916376126	CUJWSZXJCBHVKF-UHFFFAOYSA-N	446.471	1.071	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)C[C@H]2Oc3ccccc3NC2=O)c2ccccc2c1=O	916852310	ZTWRFTYEWNYBAZ-QGZVFWFLSA-N	435.440	1.528	50	20	IDGD	
Cc1ccc(C(=O)N2CCN(CC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)CC2)cc1	917108727	TYEVNACXWPZSAF-UHFFFAOYSA-N	425.445	1.122	50	20	IDGD	
CS(=O)(=O)CC(=O)NNC(=O)c1ccc(CN2C(=O)c3cccc4cccc2c34)cc1	919690127	KOGORQTUPVCDGM-UHFFFAOYSA-N	437.477	1.806	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)[C@H]2CC(=O)N(c3ccccc3Br)C2)c1O	919756011	NZHOWTWOVVYXAL-NSHDSACASA-N	448.273	1.977	50	20	IDGD	
CNS(=O)(=O)c1ccc([C@@H](C)NC(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1	919778734	JRMUGFGQARPGMJ-GFCCVEGCSA-N	434.474	1.071	50	20	IDGD	
C[C@@H](CC(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1)n1ccnc1	920426041	CEFKLUUNVPXGCX-INIZCTEOSA-N	430.472	1.997	50	20	IDGD	
COCCN1CCC(NC(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)CC1	920814263	MEWVFSJOOASKFF-UHFFFAOYSA-N	430.509	1.032	50	20	IDGD	
COCCCNC(=O)NNC(=O)c1ccc(S(=O)(=O)N2C[C@H](C)C[C@@H](C)C2)cc1	920862498	LTRZWZDORRYSCV-HUUCEWRRSA-N	426.539	1.334	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)c1ccc(N2CCC[C@H](C(N)=O)C2)cc1	1251217003	KKHZZXOIRWCCIW-HOCLYGCPSA-N	428.464	1.756	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCC(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)cc1	1317745610	BIWIQCNWBLHNEY-CYBMUJFWSA-N	439.465	1.118	50	20	IDGD	
CCCN1CCCC[C@@H]1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	1318054855	VGAHBSKFZNJOAS-LJQANCHMSA-N	436.578	1.887	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)NCc1ccccc1N1CCN(C)CC1	1318262000	GCRTZYNUAFIHNR-INIZCTEOSA-N	429.496	1.875	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)c2cn(-c3ccc(Br)cc3)nn2)c1	1322437008	RAKDBRQWYXMHLH-UHFFFAOYSA-N	445.277	1.912	50	20	IDGD	
CN(C)N(C(=O)CC[C@@H]1NC(=O)N(c2ccc(Cl)cc2)C1=O)[C@@H]1CCS(=O)(=O)C1	1343773143	CIOGIUWTRCSTKO-CABCVRRESA-N	442.925	1.037	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)c2cc3c(c(S(N)(=O)=O)c2)CCC3)cc1F	1348946080	DLIKOIKCTHXJTI-UHFFFAOYSA-N	438.506	1.602	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cn4ccc(Cl)cc4n3)C2)C1	1778063124	XFDPFBDJWTUXBQ-AUUYWEPGSA-N	441.315	1.685	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H]3CCC[C@@H]3C)C2)C1	1778337296	FMEZPRHIWQHCLV-CFFURFNMSA-N	429.521	1.387	50	20	IDGD	
Cc1cc(C(N)=O)cc(C)c1C(=O)N1CC[C@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1779006867	AXSBYZJGIWFONV-QFIPXVFZSA-N	447.608	1.697	50	20	IDGD	
C[C@H](C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CO[Si](C)(C)C)C2)N1C[C@@H]2C[C@H]2C1	1779249919	ILCLUICHKUIAFM-GPUAKUCWSA-N	437.657	1.692	50	20	IDGD	
COc1ccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](O)CCl)C3)c(OC)c1	1780305928	JAKASMFGUVZWSS-HGHGUNKESA-N	440.924	1.431	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cn(C(C)(C)C)nn3)C2)C1	1780357545	NBPHYCCKRODGBN-FZKQIMNGSA-N	442.358	1.650	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cc(OC)c(O)cc3[N+](=O)[O-])CCO2)C1	1781216918	CFWGXTSCXKJQMW-BFUOFWGJSA-N	441.868	1.770	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(OC)c(O)cc3[N+](=O)[O-])CCO2)C1	1781216921	CFWGXTSCXKJQMW-YJYMSZOUSA-N	441.868	1.770	50	20	IDGD	
CC(C)c1nc(CC(=O)N2CCO[C@]3(CCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)no1	1781225051	SNZZTQHDAGTBHH-ZWKOTPCHSA-N	433.336	1.802	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2)c1cc2ccsc2[nH]1	1781265033	DSZBWYKLYYJEAJ-QMTMVMCOSA-N	425.938	1.957	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](O)Cc2ccccc2)C1	1781894279	UUYGAESBMRLJRB-MIZPHKNDSA-N	448.636	1.955	50	20	IDGD	
O=C(Cc1cccc(F)c1F)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2	1781923020	AKSKQBWDQUHUII-RZQQEMMASA-N	430.879	1.621	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C=C\C(=O)NC1CC1)C2	1781997898	NNZKPLXZLZNJMF-QECQGUJISA-N	442.354	1.119	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc[nH]c3nccc1-3)C2	1782173179	ZIZGVGHXWJLBEP-CSODHUTKSA-N	434.924	1.896	50	20	IDGD	
CCN(CC)C[C@@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](Cl)COC)C1	1782179374	JNUFLKGRMGDZQF-BMQTXXJKSA-N	432.005	1.732	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)CN3CCc4sccc4C3)CCO2)C1	1783874191	ZQWCSNODDIDWOB-OXJNMPFZSA-N	441.981	1.190	50	20	IDGD	
Cc1cc(C)n2ncc(C(=O)N3CCO[C@@]4(CCN(C(=O)C(Cl)Cl)C4)C3)c2n1	1783947848	KBNYBBRUMFFZDH-GOSISDBHSA-N	426.304	1.593	50	20	IDGD	
O=C(OCCO)c1ccccc1C(=O)N1CCO[C@@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783948095	BJOFVYZRWGIEOI-LJQANCHMSA-N	445.299	1.083	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(F)(C(=O)N2CC[C@]3(CN(C(=O)[C@@H](F)Cl)CCO3)C2)C1	1785685788	OLFSHWYCIUNTPF-PXAZEXFGSA-N	437.871	1.310	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)c1ccnc(C(F)(F)F)c1	1785822535	VBKRCYYTUUYSNA-FQUUOJAGSA-N	435.830	1.293	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3cnn(C)c3)[C@H]2C1	1787008881	FBWNBOZISSBDKA-IWCQGFGOSA-N	441.370	1.363	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc4cnccc4[nH]3)[C@H]2C1	1788421310	BMXUNUIBQGDNOY-NVNVUAJTSA-N	435.322	1.940	50	20	IDGD	
COC(=O)[C@@H]1CC[C@H](C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]3C2)C1	1789867584	GFUCWRLRAGYMAD-RMMITJNHSA-N	449.375	1.792	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnn4c3CCC4)C[C@@H]21	1789872462	WXIYYGVBTDCEKK-HAHWVIBASA-N	429.348	1.659	50	20	IDGD	
CCOc1cccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](Cl)COC)C[C@@H]32)c1O	1790236160	TVPBENYRJSDMOF-MBGYTDRXSA-N	440.924	1.638	50	20	IDGD	
O=C(Cc1cccc(C(F)(F)F)c1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21	1790759482	ZWATZVBOWPATKO-LLLHUVSDSA-N	448.869	1.827	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC1(c2ccc(NC(=O)[C@H]3CCCS3(=O)=O)cc2)CCC1	1791177368	CDNYZPMWKBUFQL-HZPDHXFCSA-N	428.938	1.952	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COc1cccnc1)C2	1792868625	GTEXXPGJTKSCDA-ZJOBFFGXSA-N	426.311	1.081	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(C#N)ccc1F	1799745033	OJZBLMFCUIFXSS-DPYKFYPSSA-N	438.297	1.932	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc2nccn12	1799994790	CXDOAXVQKWYZAD-UESRRSCYSA-N	425.316	1.774	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(C=O)s1)C2	1800640134	VTWMLZUVHNXUSM-NDPMZMCLSA-N	429.336	1.937	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2nc3ccc(F)cn3n2)[C@@H]1c1cccnc1)[C@H](O)CCl	1803147582	ISPOTOFAMRSUSM-YSVLISHTSA-N	446.870	1.183	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)c2cccc(=O)n2O)[C@H]1c1cccnc1	1804952391	QZANHNQMTYOHFJ-DXCKQFNASA-N	449.305	1.584	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCCC2(CCN(C(=O)c3cc(=O)n4[nH]cnc4n3)CC2)C1	1806156887	LGQQCCCRZSZRFE-AWEZNQCLSA-N	434.928	1.670	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@H]1CCN(C(=O)CN2CCNC2=N)[C@H]1c1cccnc1	1808295844	MTFOMMLMLLDWFJ-ALKREAHSSA-N	441.363	1.164	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC2(CCCN(C(=O)[C@@H]3CNc4ccccc43)C2)CC1	1809809281	MDGFVPGHDTWINP-LJQANCHMSA-N	441.576	1.800	50	20	IDGD	
Cc1nc(C)c(C(=O)N2CCC3(CCCN(C(=O)c4ccc(B(O)O)cc4)C3)CC2)o1	1809970920	DSCYXBQNRXMDSM-UHFFFAOYSA-N	425.294	1.130	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2ccc3ncnn3c2)[C@H]1c1cccnc1	1810060029	NVJNRTJHKFIJEC-VDZJLULYSA-N	442.907	1.698	50	20	IDGD	
CC(C)/C=C/C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1	1810309351	QLHMAZVCUOKPAH-QNIGJGFBSA-N	436.516	1.612	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@H]1CCN(C(=O)CCN2CCOCC2)[C@@H]1c1cccnc1	1810539611	DOAXSCCCIQGPFD-DENIHFKCSA-N	448.640	1.661	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)c1cc2ncsc2[nH]1	1810577386	HOEQCPJMYIOKFZ-VBNZEHGJSA-N	433.921	1.939	50	20	IDGD	
CCC(C)(C)C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1	1812611540	VDDLGFDAJKKGTG-LPHOPBHVSA-N	438.532	1.836	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2cnc(OC)cn2)[C@H]1c1cccnc1	1813029126	CBVVARPNRFGJKA-VKJFTORMSA-N	433.896	1.454	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)CN2CCCCC2=O)[C@H]1c1cccnc1)C(Cl)Cl	1813081766	ZZXHTNYUKCNGOX-PBHICJAKSA-N	427.332	1.904	50	20	IDGD	
C#CCCC(=O)NC[C@@H]1CCN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@@H]1c1cccnc1	1814103234	IFTXLMILMMZIBG-ULUZWJCLSA-N	434.500	1.635	50	20	IDGD	
C[C@H](CBr)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CN2CCOCC2)[nH]n1	1814780801	TUPCNWMVYSPCQQ-UKRRQHHQSA-N	442.358	1.765	50	20	IDGD	
C[C@H](Nc1nccs1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](O)CCl)n[nH]1	1814871518	RJSNJTLLZUZHAX-UHTWSYAYSA-N	426.930	1.959	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(O)n[nH]3)sc2C1	1815203398	BGUGNRSWFIEIFP-JGVFFNPUSA-N	428.312	1.829	50	20	IDGD	
Cc1cscc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2	1817568215	JGXIUCWUUGCONG-AWEZNQCLSA-N	441.343	1.732	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](C)CBr)CC2	1820134002	CQFJSVYMUOUXAU-AXFHLTTASA-N	443.367	1.777	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](C)O)[nH]n1	1820167065	WBJOBBPNZIMUPY-MEDUHNTESA-N	445.432	1.930	50	20	IDGD	
Cc1n[nH]c(C)c1CC(=O)Nc1cc([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1	1820995969	OZIOLWGVOWOSFL-QGZVFWFLSA-N	444.540	1.357	50	20	IDGD	
CCN1CCC(C(=O)N2CCCC[C@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)CC1	1822417850	QPYWFWMOQIKTRG-SFHVURJKSA-N	447.584	1.507	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(OC)n(C)n1)CC2	1826002693	AZVYPESTERTNEE-UWVGGRQHSA-N	427.914	1.365	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(OC)nn1)CC2	1826003785	SUXXGAWTSKZGGE-UWVGGRQHSA-N	425.898	1.421	50	20	IDGD	
CC(=O)N1CCN(CC(=O)N[C@H]2CCc3nc(NC(=O)C(Cl)Cl)sc3C2)CC1	1826097148	IBCHRLPVFGZQHT-NSHDSACASA-N	448.376	1.023	50	20	IDGD	
C=C[C@H](O)C(C)(C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1	1828881415	CXQJPIFAXDQSLK-SFTDATJTSA-N	442.365	1.173	50	20	IDGD	
CC(C)N(C)CC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1	1828925393	JKKNTUKDSMZRFO-FQEVSTJZSA-N	444.580	1.259	50	20	IDGD	
Cc1cc[nH]c1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)CBr)CCO2	1830535505	PHAUCYSTQPRYTP-RDTXWAMCSA-N	428.327	1.424	50	20	IDGD	
O=C(Cc1ccc(F)cc1Cl)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1830726669	SOAGHUKZXKUCEJ-VQIMIIECSA-N	449.306	1.078	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(O)nc(Cl)c3)C2)C1	1831643929	LSISIWLNJRUVHH-AUUYWEPGSA-N	446.331	1.918	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4n(n3)CCCO4)C2)C1	1831651069	NKFBPSHWMLAWPE-QRWLVFNGSA-N	440.928	1.143	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](C)CC(N)=O)CC2)CC1	1833523249	DROUVGFVJTUOOR-BBRMVZONSA-N	445.402	1.243	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cccc(OC)n3)CC2)CC1	1834052241	XPXDNKOQGGRLFM-KRWDZBQOSA-N	438.956	1.529	50	20	IDGD	
CC(C)c1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)no1	1834499830	GAFMRTVWKHYMSG-FZKQIMNGSA-N	444.326	1.651	50	20	IDGD	
O=C(C(=O)N1CCOC[C@@]2(CN(C(=O)CCBr)CCO2)C1)c1ccccc1	1834818932	FYZOHVUEKKAALT-LJQANCHMSA-N	439.306	1.111	50	20	IDGD	
Cc1ncccc1C(=O)N1CCOC[C@@]2(CN(C(=O)CCBr)CCO2)C1	1834819521	UEGIJHJKKNFMGP-GOSISDBHSA-N	426.311	1.245	50	20	IDGD	
CC1=CC[C@H](C(=O)NC2CCN(C3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)CC1	1835437177	AZJNHSPJQINPJU-IBGZPJMESA-N	447.624	1.677	50	20	IDGD	
O=C1Cc2cccc(C(=O)N3CCC(OC4CCN(C(=O)[C@H](O)CCl)CC4)CC3)c2N1	1836719597	ZXRWJYLTBDKFPF-GOSISDBHSA-N	449.935	1.393	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ncccc3F)CCO2)C1	1838250803	UZJINYJENTWSBP-QZTJIDSGSA-N	434.295	1.527	50	20	IDGD	
N#Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)cc1	1838953324	YPYFEGKBRLUBDI-YJBOKZPZSA-N	440.269	1.319	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)CBr)C2)C1	1839141348	GBFASUPYKPBMBR-DVOMOZLQSA-N	425.751	1.491	50	20	IDGD	
Cc1nn(C)c(C)c1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2	1839150344	JUVXLWQCUXDXIE-MOPGFXCFSA-N	447.363	1.343	50	20	IDGD	
O=C(CCc1ccsc1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839199744	STONRKDUUDICFJ-DOTOQJQBSA-N	449.342	1.828	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(OC)ccc3C)CCO2)C1	1839360359	CGJHXILXYOSTJV-RXVVDRJESA-N	440.924	1.327	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CCCSC1)CCO2	1840859850	AOBVXDGUPSTVLP-RKVPGOIHSA-N	449.411	1.617	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](O)[C@@](C)(C(=O)N2CCCC23CN(C(=O)[C@@H](F)Cl)C3)C1	1841030576	KOWJTCOTHZOTPO-KSMMKXTCSA-N	447.935	1.732	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)Cc2c(F)cccc2Cl)C1	1841206507	GTCJQHQYBSIKNI-UHFFFAOYSA-N	445.882	1.537	50	20	IDGD	
COc1ccc([C@H](C)C(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)cc1	1841255948	JODGXEFENAKGTR-HNNXBMFYSA-N	437.500	1.314	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)N3CCCC34CN(C(=O)c3cccc(B(O)O)c3)C4)c[nH]2)cc1	1842171002	UYQPMAGEEZRPTL-UHFFFAOYSA-N	443.312	1.801	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1cc3sccn3c1)C2	1843415756	JNGPBBSTPQQOKZ-OEAKJJBVSA-N	438.513	1.952	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2cn(C)c3ncccc23)C1	1844151643	VAPUGJBEUWYBCN-CVKSISIWSA-N	447.499	1.524	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@]2(NC(=O)OC(C)(C)C)CCOC2)C1	1845208866	CYJBKVXHZRUJBG-VBKZILBWSA-N	445.944	1.127	50	20	IDGD	
C[C@H](C(=O)N1CCCC12CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)C2)n1ccnn1	1845815656	YTGHXAAYAUZEEA-BRYYZUPOSA-N	426.427	1.928	50	20	IDGD	
CC(=O)NCC(=O)N1CC2(CCCN2C(=O)/C(C#N)=C/c2ccc(Br)cc2)C1	1845873038	BYTBBHQPPWHCGB-CXUHLZMHSA-N	445.317	1.696	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)c1cc3ccc(Cl)cc3nn1)C2	1846384817	MOFFBRBUHDIHEE-UHFFFAOYSA-N	444.923	1.473	50	20	IDGD	
Cc1oc(-c2ccccc2)nc1C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	9717675	OYJANOWQTHNMQW-KRWDZBQOSA-N	437.408	1.794	50	20	IDGD	
O=C(CCN1C(=O)NC2(CCCC2)C1=O)NNC(=O)c1ccc(COc2ccccc2)o1	21970006	VAQSQELTLMXESL-UHFFFAOYSA-N	440.456	1.874	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)c2ccccc2c1=O	25599338	XUULSGNHFNPLLG-HNNXBMFYSA-N	439.497	1.451	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCN(c2ccccc2[N+](=O)[O-])CC1	28932231	MFGYOENKXAJFGJ-UHFFFAOYSA-N	447.879	1.840	50	20	IDGD	
O=C(CCc1nc2ccccc2c(=O)[nH]1)NNc1ccc(S(=O)(=O)NC2CC2)cc1	110436318	UQZHRJJWYYEUTD-UHFFFAOYSA-N	427.486	1.440	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)c2cccc(CN3CCS(=O)(=O)CC3)c2)cc1	725890775	ZVPLIRXRODQQBO-UHFFFAOYSA-N	445.541	1.319	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)CNC(=O)c1cccs1)c1cccc(N2CCOC2=O)c1	726243757	JKLCMOISPLJSOO-GFCCVEGCSA-N	431.474	1.526	50	20	IDGD	
COc1cccc(N2C[C@H](NC(=O)NNC(=O)C(=O)Nc3ccc(C)c(C)c3)CC2=O)c1	726274282	BOBDHDQHWPAWCU-MRXNPFEDSA-N	439.472	1.386	50	20	IDGD	
CCOc1ccccc1C(=O)NCC(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	726867242	BTSWTSODYKDUQM-UHFFFAOYSA-N	432.502	1.399	50	20	IDGD	
Cn1nc(SCC(=O)NN=Cc2ccc(Cl)c(C(F)(F)F)c2)c(=O)n(C)c1=O	727256280	UGAFSIDJDQJNKG-UHFFFAOYSA-N	435.815	1.394	50	20	IDGD	
Cc1ccccc1[C@H](CC(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1)NC(N)=O	728209494	FVAGKMXDHGTHNZ-SFHVURJKSA-N	431.518	1.679	50	20	IDGD	
O=C(COC(=O)c1cccnc1N1CCCCC1)NNC(=O)[C@@H]1COc2ccccc2O1	728329555	ZIGBHRRIDNBINS-SFHVURJKSA-N	440.456	1.216	50	20	IDGD	
N#CCCNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cccc(OC(F)F)c2)cc1	728485434	ZBYGCDZROGYMOT-UHFFFAOYSA-N	438.412	1.555	50	20	IDGD	
CCC1CCC2(CC1)NC(=O)N(CC(=O)NNC(=O)c1cccc(OC(F)F)c1)C2=O	728487902	DCYKJOMWXUCYBI-UHFFFAOYSA-N	438.431	1.940	50	20	IDGD	
C[C@@]1(NNC(=O)N[C@@H]2CCN(c3ccc(Br)cc3)C2)CCS(=O)(=O)C1	728755391	LWWZAGYSLAVUIM-CZUORRHYSA-N	431.356	1.409	50	20	IDGD	
C[C@H](C(=O)NNc1ccc(S(=O)(=O)C(F)F)cc1)N1C(=O)NC2(CCCC2)C1=O	728972321	RSLSYCUVBYLKLB-SNVBAGLBSA-N	430.433	1.379	50	20	IDGD	
CC(=NNC(=O)CCc1ccccc1O)c1ccc(S(=O)(=O)NCCC(=O)O)cc1	729935431	YOTGYWGFNTUVLG-UHFFFAOYSA-N	433.486	1.618	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)c1ccc(S(=O)(=O)N=c2cc[nH]cc2)cc1	730033516	AXUFOQUOSQOEPH-UHFFFAOYSA-N	440.481	1.404	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)NCCOc2ccc(S(C)(=O)=O)cc2)c1	730066598	MZEACKWRLLVZCY-UHFFFAOYSA-N	435.502	1.495	50	20	IDGD	
COc1cc(C(=O)NNC(=O)N[C@H]2CCN(CC(F)(F)F)C2=O)ccc1OC(C)C	732590325	NWRUDSAGKVNBDI-LBPRGKRZSA-N	432.399	1.590	50	20	IDGD	
O=C(NCC1CCN(S(=O)(=O)C(F)(F)F)CC1)NNC(=O)c1ccccc1F	732673327	CIYUFUYBIKTYPP-UHFFFAOYSA-N	426.392	1.331	50	20	IDGD	
CSCC[C@@H](NC(=O)Cc1ccccc1)C(=O)NNC(=O)c1ccc2c(c1)OCO2	732749601	CFAPUQHIKWWLEL-MRXNPFEDSA-N	429.498	1.657	50	20	IDGD	
CS(=O)(=O)N(CC(F)(F)F)C1CCN(C(=O)NNC(=O)c2ccc(C#N)cc2)CC1	732995088	MLATZFWDVNLFLZ-UHFFFAOYSA-N	447.439	1.201	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCN(c2ccc3c(c2)OCCO3)C1=O)c1cnn(-c2ccccc2)c1	733169860	CUJZCWOMOJVFDY-SFHVURJKSA-N	447.451	1.458	50	20	IDGD	
Cc1ccc(-n2c(NNC(=O)CN(C)S(C)(=O)=O)nc3ccccc3c2=O)c(C)c1	733265470	RSYLXSXKAMQFBU-UHFFFAOYSA-N	429.502	1.337	50	20	IDGD	
Cc1cc(C=NNC(=O)N[C@@H]2CCS(=O)(=O)C2)c(C)n1-c1ccc2c(c1)OCCO2	734296476	SWLKSESHKIUPPN-MRXNPFEDSA-N	432.502	1.686	50	20	IDGD	
C[C@H]1CN(C[C@@H](C)C(=O)NN=Cc2ccccc2OCC(=O)NCC2CC2)C[C@@H](C)O1	734746571	ZUIUPJVPCMDNOK-KURKYZTESA-N	430.549	1.787	50	20	IDGD	
CC(=O)NCC(=O)N1CCc2cc(C(=O)NNC(=O)c3ccc4ccccc4c3)ccc21	735649578	HECGMOLVDDBYPO-UHFFFAOYSA-N	430.464	1.940	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)c1	739678946	NLUDXDPCCSLWRN-UHFFFAOYSA-N	434.474	1.584	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Cc2cc(F)ccc2F)c1	742465567	PAPVNIJNLUCXGW-UHFFFAOYSA-N	425.457	1.999	50	20	IDGD	
C[C@@H](NC(=O)OC(C)(C)C)C1CCN(CC(=O)NNC(=O)c2cccc(C#N)c2)CC1	744398296	NPKRACDETLXDAY-OAHLLOKOSA-N	429.521	1.944	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)c2ccc3c(c2)C[C@H](C)N3S(C)(=O)=O)c1	744617611	CIPKDMTUOQRQTQ-AWEZNQCLSA-N	445.497	1.324	50	20	IDGD	
CCOC(=O)c1c(C)[nH]c(C=NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)c1C	744742158	CFHDFSJLTVTBLJ-UHFFFAOYSA-N	426.882	1.873	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)N[C@@H]1CCN(Cc2ccccc2)C1=O	744878238	SYFMVAYRZVPXCG-OAHLLOKOSA-N	427.417	1.105	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(N3CCCS3(=O)=O)cc2C)cc1	745210397	VGDRGGWAGXDVJS-UHFFFAOYSA-N	445.497	1.461	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)N[C@H]3C[C@H]3C3CCCCC3)nc2)CC1	745858514	RFMPMNOIEKMQJH-ROUUACIJSA-N	436.582	1.613	50	20	IDGD	
Cc1ccc(N2CCC[C@@H](NC(=O)NNC(=O)COc3ccccc3[N+](=O)[O-])C2=O)cc1	745879498	SSBBLEOSAYVVKK-MRXNPFEDSA-N	441.444	1.808	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CN(Cc2nc(O)c3ccccc3n2)CCO1)c1ccccc1F	746013502	FAGYMAFGMYBLDF-KRWDZBQOSA-N	425.420	1.137	50	20	IDGD	
CN(C)[C@@H](C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)c1c(F)cccc1Cl	746123967	VPPZZLOWKMAHOC-MRXNPFEDSA-N	427.885	1.947	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)N[C@H]3CCCN(CC(F)(F)F)C3=O)n[nH]2)cc1	746338690	GLCNHHZROFCEIY-ZDUSSCGKSA-N	438.410	1.882	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCN([C@@H](C#N)c3ccccc3)CC2)cc1OC	746448482	AWDRKONDPFGKGN-IBGZPJMESA-N	437.500	1.347	50	20	IDGD	
O=C(NCCNS(=O)(=O)c1cccs1)NNC(=O)Nc1ccc(OC(F)F)cc1	747437529	KPGNMZICDVWKNS-UHFFFAOYSA-N	449.461	1.664	50	20	IDGD	
C[C@@H](NC(=O)c1ccoc1)C(=O)NNc1ccc(S(=O)(=O)Nc2nccs2)cc1	747943993	PQCLWCUFKHXKSD-LLVKDONJSA-N	435.487	1.799	50	20	IDGD	
O=C(CCCNS(=O)(=O)c1ccc2c(c1)OCCO2)NNc1cccc([N+](=O)[O-])c1	748004346	FWBBMLUHZHYKNU-UHFFFAOYSA-N	436.446	1.568	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)CNC(=O)NCc2ccc([N+](=O)[O-])cc2)c1C	748211964	ARBHQELILNYESE-HNNXBMFYSA-N	443.460	1.626	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)[C@]1(F)CCN(C(=O)OC(C)(C)C)C1	748285076	HEUBWZQGCSLROT-FQEVSTJZSA-N	425.457	1.961	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(-c3n[nH]c(C4CC4)n3)cc2)c1	748839970	KOKAXICTQCSPKR-UHFFFAOYSA-N	425.470	1.827	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)[C@H]2CCCN2S(=O)(=O)c2cccs2)c2ccccc21	749160031	QZVWMLJWTZLBQG-MRXNPFEDSA-N	432.527	1.854	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(Br)cc2[N+](=O)[O-])cc1	750962918	ARYRUPVVMCAYKO-UHFFFAOYSA-N	447.201	1.847	50	20	IDGD	
CCOC(=O)[C@H]1Cc2cc(S(=O)(=O)NNC(=O)c3ccc4ccccc4n3)ccc2O1	751538859	QADDLRZJABWQPJ-LJQANCHMSA-N	441.465	1.725	50	20	IDGD	
C[C@H](CC(=O)OCc1ccccc1)NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1	753059347	XDWHBQRVECLZDZ-MRXNPFEDSA-N	440.504	1.545	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)N[C@H]2CCCN(Cc3ccccn3)C2=O)c1	753290281	PGHCPSBSRSTVNF-SFHVURJKSA-N	425.489	1.599	50	20	IDGD	
CN(CCN1C(=O)c2ccccc2C1=O)C(=O)NNC(=O)c1cnn(-c2ccccc2)c1	754108536	YUKOYJTZGAVNOW-UHFFFAOYSA-N	432.440	1.455	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)COCc2ccccc2)c(Cl)cc1F	755973133	MUQDNOWINHMZSI-UHFFFAOYSA-N	430.841	1.792	50	20	IDGD	
Cc1c(NC(=O)NNC(=O)COc2ccc(F)cc2)cccc1C(=O)N1CCOCC1	756184945	UBCGTDWSXQTJEO-UHFFFAOYSA-N	430.436	1.838	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)c2ccc(Br)s2)cc1S(N)(=O)=O	756639562	ZSYXOUNWPYOXSS-UHFFFAOYSA-N	433.309	1.933	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c(OCCN(C)C)c1	756673946	DHPLDFHDKXASNI-UHFFFAOYSA-N	441.536	1.795	50	20	IDGD	
CN(CC(=O)NNc1nc(O)c2cnn(C(C)(C)C)c2n1)C(=O)OCc1ccccc1	756832264	PWDHAXAIEHNMMT-UHFFFAOYSA-N	427.465	1.999	50	20	IDGD	
CC[C@@H](C)NS(=O)(=O)c1cccc(NC(=O)NNC(=O)COc2ccc(C#N)cc2)c1	757707914	CKNHIGIPFGRUMT-CQSZACIVSA-N	445.501	1.867	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)c1csc(-c2cccc(C(F)(F)F)c2)n1	758038075	BZGWHDGBEKHZFQ-MRVPVSSYSA-N	436.437	1.528	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1ccccc1-c1ncc(-c2ccccc2F)o1	758039154	IATVFUQUHRHIBL-LBPRGKRZSA-N	446.460	1.846	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccnn2[C@@H](C)C2CC2)cc(OC)c1OC	760279834	QQRURSOFMQDHGA-NSHDSACASA-N	431.449	1.280	50	20	IDGD	
C[C@@H](CC(=O)NNc1nc(-c2cccnc2)no1)NS(=O)(=O)c1cccnc1Cl	760568994	XMCAPFBWDVHMOI-JTQLQIEISA-N	437.869	1.380	50	20	IDGD	
O=C(NCC1(c2ccc(F)cc2F)CC1)NNC(=O)c1csc(N2CCOCC2)n1	761820437	ZZZPWBYFNYUWID-UHFFFAOYSA-N	437.472	1.934	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)Cn1c(S)nc2ccccc2c1=O	762370010	BZXJACPCAPAOJK-UHFFFAOYSA-N	430.511	1.634	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NN=C(C)[C@H](C)OC)N(S(C)(=O)=O)CC2	763143062	YZUGYHSJEZEZRQ-XJKSGUPXSA-N	427.523	1.480	50	20	IDGD	
CO[C@@H](C)C(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3n2)c1	763450620	OKXONYLUSMOTAK-ZDUSSCGKSA-N	435.440	1.608	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)Nc1ccc(Oc2ccccn2)cc1	763570003	CZWWUXXEUXCKOM-GOSISDBHSA-N	434.408	1.800	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2ccc3c(c2)NC(=O)[C@@H](C)O3)c1	763667553	BGKSWTXVSXBCEP-CYBMUJFWSA-N	426.429	1.188	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)C(=O)Nc1ccn(CC(F)F)n1	763695572	PDYHUFYADYPSEV-UHFFFAOYSA-N	446.208	1.076	50	20	IDGD	
CCOc1ncccc1NC(=O)C(=O)NNC(=O)COc1ccc(Br)cc1	763695603	QIFICBLDMBZHGJ-UHFFFAOYSA-N	437.250	1.408	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)c1cnn(-c2cccc(Br)c2)c1	763818291	FVCWYQNXOKTEAX-UHFFFAOYSA-N	443.261	1.221	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)c1ccc2c(c1)C[C@H](c1ccccc1)OC2=O	763818387	KOPVLVIVKUVUBJ-HXUWFJFHSA-N	444.447	1.727	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)cc1	763840159	JBFPVMOHBJBPND-INIZCTEOSA-N	429.473	1.882	50	20	IDGD	
COCCn1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc3ccccc3c2)n1	763852277	HASFZABFXFBXEY-AWEZNQCLSA-N	425.445	1.236	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)CCC(=O)N3)cc1	763859655	DOJIKNOWVDXGRH-CYBMUJFWSA-N	440.456	1.523	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccc([S@@](C)=O)c(F)c1	763863869	DRHJPBTYJUQIHC-XGCHSQQGSA-N	425.413	1.256	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccccc2Oc2ncccc2C#N)n1	763884211	DCBZIJURIVKRNJ-UHFFFAOYSA-N	433.428	1.345	50	20	IDGD	
O=C1C[C@@H](c2cccc(NC(=O)C(=O)NNC(=O)CCSc3ccc(F)cc3)c2)CN1	763895250	MVRVMXSFPLFFGD-CQSZACIVSA-N	444.488	1.698	50	20	IDGD	
Cc1cc(=O)n(C)cc1NC(=O)C(=O)NNC(=O)c1sc(-c2ccccc2)nc1C	763902296	UXWHIEUFBMJCQF-UHFFFAOYSA-N	425.470	1.525	50	20	IDGD	
Cc1cc(C)cc(Oc2ccc(NC(=O)C(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)cc2)c1	763997320	JOBKQFLKSAKVEM-HNNXBMFYSA-N	445.497	1.616	50	20	IDGD	
C[C@H]1C[C@H](C)CN(C(=O)c2ccccc2NC(=O)C(=O)NNC(=O)c2cccn2C)C1	763999569	VAVGVDPVEBWQQF-GJZGRUSLSA-N	425.489	1.543	50	20	IDGD	
CCN(CC)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(Br)cn2C)cn1	764004787	MDTGIPILNMGEBP-UHFFFAOYSA-N	437.298	1.429	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)Nc1ccnn1Cc1ccccc1	764004793	MQAAUKAODIQGDA-UHFFFAOYSA-N	445.277	1.432	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)Cc2ccsc2)cccc1C(=O)N1CCSCC1	764034206	LRZARLGEYBOCGA-UHFFFAOYSA-N	446.554	1.574	50	20	IDGD	
Cn1ncc(NC(=O)C(=O)NNC(=O)c2ccc(F)cc2Br)c1C(F)F	764083798	BBDHDXTXFCBHBB-UHFFFAOYSA-N	434.172	1.659	50	20	IDGD	
CCCCOC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)cc1	764152321	QWIVLCQNANOALB-GOSISDBHSA-N	425.441	1.733	50	20	IDGD	
CC(C)OCc1cccc(NC(=O)C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1	764261112	YVPMUFDPLQNONU-UHFFFAOYSA-N	440.504	1.404	50	20	IDGD	
Cc1ccc(NC(=O)c2ccccc2)cc1NC(=O)C(=O)NNC(=O)Cc1cccnc1	764266564	NXYBYBUERZJRSU-UHFFFAOYSA-N	431.452	1.971	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)ccc1O)C(=O)Nc1ccccc1-n1ccnn1	764277746	NHJUOYVHOVGYSH-UHFFFAOYSA-N	445.233	1.135	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2O)cc(OC)c1C(C)C	764278133	RUTAIHBFFCOYAT-UHFFFAOYSA-N	431.445	1.698	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2cccs2)[nH]n1)C(=O)Nc1ccc(C(=O)NC2CC2)cc1	764377326	NJNNWMOJHDOYFS-UHFFFAOYSA-N	438.469	1.430	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cccc(-n4ccnn4)c3)n[nH]2)cc1C	764386925	FCZAONIIIAVINZ-UHFFFAOYSA-N	444.455	1.674	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)COc2ccc3c(c2)CCCC3)cc1	764533300	KVPIPOQWQSWUQM-UHFFFAOYSA-N	445.541	1.721	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cccc(C[S@@](C)=O)c3)CC2)cc1	765749369	XGKMSQAVOWWCAF-WJOKGBTCSA-N	442.585	1.452	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3ccc(-c4nnc(C)o4)cc3)CC2)cc1	766649073	MXZYVPQEYOJJFI-UHFFFAOYSA-N	448.527	1.932	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)[C@@H]1CCC[C@@H]1NC(=O)OC(C)(C)C	767343576	BIOAHBKUGAIOAS-SJORKVTESA-N	433.505	1.922	50	20	IDGD	
C=CCNS(=O)(=O)c1cccc(C(=O)NNc2c(OC)cccc2S(C)(=O)=O)c1	768642093	YRFREQXHNNYATJ-UHFFFAOYSA-N	439.515	1.320	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)[C@@H]2CCN(C(=O)OCc3ccccc3)C2)cc1	770133339	FAHNYPZHTSAEFL-QGZVFWFLSA-N	426.473	1.913	50	20	IDGD	
N#C/C(=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)N[C@H](CO)C1CC1	771046472	PAJHOYQOXBJZAF-IKFRKZOMSA-N	427.892	1.873	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)c1ccc2c(c1)C(=O)N(C[C@@H]1CCCO1)C2=O	771933361	GKJVFPWXEHRDKA-HIFRSBDPSA-N	445.472	1.200	50	20	IDGD	
COc1ccc([C@@H](OC)[C@H](C)NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1	771966290	WVRYPFYAOPGECS-KXBFYZLASA-N	442.520	1.808	50	20	IDGD	
O=C(NNC(=O)N1CCC(C(=O)C(F)(F)F)CC1)C1CCN(c2ncccn2)CC1	773272936	LINBPSDVKGJPKK-UHFFFAOYSA-N	428.415	1.277	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(C(=O)N3CCSCC3)c2)cc1F	773889022	PBHSADSDWDFYEY-UHFFFAOYSA-N	444.488	1.723	50	20	IDGD	
C[C@H]1OC(C)(C)N(C(=O)OC(C)(C)C)[C@@H]1C(=O)NNC(=O)CNC(=O)OC(C)(C)C	778445937	XDUCAYCSAFAQKV-YPMHNXCESA-N	430.502	1.419	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)NCc1cccc(NC(=O)[C@@H]2CCCO2)c1	778628410	YQYYHTGZIKQYOB-HNNXBMFYSA-N	435.481	1.159	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(C(=O)NNC(=O)c2cccc(Br)c2)n(C)c1	778684377	XYQYBOJPRKDJEI-UHFFFAOYSA-N	429.296	1.113	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@H](C)CCNC(=O)OC(C)(C)C)c2ccccc2c1=O	779388594	ULXHIPFBAWPVLS-CYBMUJFWSA-N	446.508	1.664	50	20	IDGD	
NS(=O)(=O)c1ccc(NCC(=O)OCCCI)c([N+](=O)[O-])c1	781226473	RFOYUIOQRQGZKE-UHFFFAOYSA-N	443.219	1.022	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(N2C[C@H](C(=O)NNc3ccnc(F)c3)CC2=O)cc1	781366407	DISVPFAWEXEUSX-CQSZACIVSA-N	449.508	1.747	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)on2)c(OC)c1	782121373	WHXGMDFZGGEJBV-UHFFFAOYSA-N	438.396	1.537	50	20	IDGD	
CCOc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NNc1nccc(N(CC)CC)n1	785225786	LEMCCULDJCVQFF-UHFFFAOYSA-N	443.508	1.505	50	20	IDGD	
CCOc1ccc(C(=O)NNS(=O)(=O)c2c(C)csc2C(=O)OC)cc1OC	785482983	YTZPHLSVEAJJKR-UHFFFAOYSA-N	428.488	1.874	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)Nc2ccn(C3CCN(C)CC3)n2)cc1	786678744	GUFKWMMUZPTZBU-OAHLLOKOSA-N	428.493	1.973	50	20	IDGD	
C[C@@]1(NNC(=O)N[C@@H]2CCN(c3cccc(Br)c3)C2)CCS(=O)(=O)C1	787372192	YYYCQJCKSDZDPE-CZUORRHYSA-N	431.356	1.409	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ccc(F)c(F)c2F)cc1C(=O)N1CCOCC1	787540550	MEUYQXAYBVHBEX-UHFFFAOYSA-N	436.390	1.967	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)Nc1ccc(CC(=O)N2CCSCC2)cc1	788002816	XOWNUNRPVMNIQY-UHFFFAOYSA-N	438.550	1.746	50	20	IDGD	
CCOc1cc(Br)c(CC(=O)NNC(=O)N2CCN(C)CC2)cc1OCC	788168842	FPGCHXQGDIYSIP-UHFFFAOYSA-N	443.342	1.777	50	20	IDGD	
CCNC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2cccc(N(C)C)c2)c1C	789732407	PILUGVPCFFVXMY-UHFFFAOYSA-N	426.477	1.602	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)[C@H]1CCCc2c(O)cccc21	789807691	WREBEGBUYWCPBJ-KRWDZBQOSA-N	431.514	1.976	50	20	IDGD	
O=C(NNC(=O)[C@H]1OCC[C@H]1c1ccccc1)C(=O)Nc1ncn(C2CCCCC2)n1	789810972	AZALUEHSCUWCGL-IRXDYDNUSA-N	426.477	1.442	50	20	IDGD	
Cn1ncc(C(=O)NNC(=O)c2cc(-c3ccco3)nc3ccccc23)c1-n1cnnc1	789940004	VEPPAOFBKDTSEH-UHFFFAOYSA-N	428.412	1.884	50	20	IDGD	
Cc1cccnc1NNC(=O)Nc1ccc(S(=O)(=O)N[C@@H]2CCS(=O)(=O)C2)cc1	792219325	XRHQDKQTZBWHMN-CQSZACIVSA-N	439.519	1.004	50	20	IDGD	
CN(C)N(C(=O)c1ccnc(Cl)c1I)[C@H]1CCS(=O)(=O)C1	792849482	IWGRQTTVKLMXOP-QMMMGPOBSA-N	443.694	1.446	50	20	IDGD	
CCN1CCN(c2ccc(NC(=O)C(=O)NNc3ccc4c(=O)[nH]ccc4c3)cc2)CC1	793070170	XUUWVUVJJIVMFA-UHFFFAOYSA-N	434.500	1.752	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)Cc3c(C)nn(C(C)C)c3C)CC2)cc1	794393953	VKYGZEAUKNLGMQ-UHFFFAOYSA-N	440.592	1.897	50	20	IDGD	
COc1ccc(F)c2[nH]c(C(=O)OCC(=O)NNC(=O)[C@H]3COc4ccccc4O3)cc12	796201871	VNILGYGVGMHLDN-QGZVFWFLSA-N	443.387	1.460	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(OC)cc(OC)c1C	800621819	ALGYEHYWDYNETO-UHFFFAOYSA-N	431.445	1.576	50	20	IDGD	
Cc1c([N+](=O)[O-])ccc(F)c1NC(=O)C(=O)NNC(=O)C(F)(F)Oc1ccccc1	800625548	QNVGQCDCRVCJIM-UHFFFAOYSA-N	426.307	1.800	50	20	IDGD	
Cc1ccc(S(N)(=O)=O)c(C(=O)NNC(=O)Nc2ccc(Br)cc2)c1	801999285	ZWTQGJDWYLHYQI-UHFFFAOYSA-N	427.280	1.871	50	20	IDGD	
COc1ccc(S(C)(=O)=O)cc1S(=O)(=O)NNC(=O)CCCc1ccccc1	802721721	BKTFDSGDLZUJMF-UHFFFAOYSA-N	426.516	1.431	50	20	IDGD	
COCc1cnc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc3ccccc3c2)s1	806975465	ZRRHMAZFQMGRQW-LBPRGKRZSA-N	428.470	1.996	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1cc(Cl)cc2c1OCC(=O)N2	806977734	WXMQQUMYNSMKHG-UHFFFAOYSA-N	432.820	1.008	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)C(=O)Nc2cc3n(n2)CCCC3)c1	806978045	JWHUFVNJMKRLEN-UHFFFAOYSA-N	436.266	1.390	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)NC[C@H](c1ccc(F)cc1)N1CCOCC1	806999820	AHUHZFFXOLUSCP-GOSISDBHSA-N	446.479	1.617	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2nccnc2C2CCC2)cc1	807460012	KDSOXCPZMRPDEF-UHFFFAOYSA-N	446.533	1.856	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)NCc2ccncc2OC[C@@H]2CCOC2)nc2ccccc21	807616288	RJIGPDDZDFFGFZ-OAHLLOKOSA-N	438.488	1.457	50	20	IDGD	
CNC(=O)c1cc(Oc2ccc(NC(=O)NNC(=O)Cc3cc[nH]n3)cc2F)ccn1	810312701	QSYJOCNXZZQTCQ-UHFFFAOYSA-N	427.396	1.491	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)c2cccc([N+](=O)[O-])c2N2CCOCC2)cc1	812728309	JUILHKWUNLXPDK-UHFFFAOYSA-N	449.489	1.439	50	20	IDGD	
CC(C)CNC(=O)N1CCC[C@@H](C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)C1	812731893	ZFARYLBIBKZPDN-OAHLLOKOSA-N	425.555	1.458	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccc(N3CCCC3)c(F)c2)cc1	813033719	IJQCPQPLACJQHK-UHFFFAOYSA-N	449.508	1.758	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NN=C3COc4ccccc43)CC2)cc1	814879072	QIZUWSTYFKXBTH-UHFFFAOYSA-N	428.514	1.214	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNc2ncncc2Cl)nnn1CCOc1ccc(F)cc1	815579798	VHJMRDLKTQXPFI-UHFFFAOYSA-N	434.819	1.330	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2CCCO2)cc1NC(=O)c1cccc(F)c1	815778490	TYVXOHSFVRMVKB-QGZVFWFLSA-N	444.419	1.352	50	20	IDGD	
CC(C)(C(=O)N1CCN(S(=O)(=O)CBr)CC1)c1ccc2c(c1)OCO2	815964234	BTXWQDMEJWHWMP-UHFFFAOYSA-N	433.324	1.519	50	20	IDGD	
C[C@@H](C(=O)NNc1ccccc1S(=O)(=O)N(C)C)N1CCN(c2ccc(F)cc2)CC1	817053400	PUKSYDSRZKZIMV-INIZCTEOSA-N	449.552	1.730	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)Cn2cc([N+](=O)[O-])ccc2=O)c1	818756710	IUJOCUZPXQISBV-UHFFFAOYSA-N	425.195	1.449	50	20	IDGD	
Cc1ccc(NC(=S)NNC(=O)Cn2cc(Br)c(O)nc2=O)c(C)c1	836447170	PKLRBNAPLZLWQC-UHFFFAOYSA-N	426.296	1.346	50	20	IDGD	
O=C(Cn1cc(Br)c(O)nc1=O)NNC(=S)Nc1cccc(Cl)c1	836714387	ZSERNMREQQPXKD-UHFFFAOYSA-N	432.687	1.383	50	20	IDGD	
COc1cc(Cl)ccc1S(=O)(=O)NNC(=O)c1cc(OC)c(OC)c(OC)c1	844254072	LXKXBEURSXRVLC-UHFFFAOYSA-N	430.866	1.998	50	20	IDGD	
CCOC(=O)c1ccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1	861728761	OCEKSDPANNHTTN-UHFFFAOYSA-N	434.474	1.580	50	20	IDGD	
O=C(CN1CCN(c2ncnc3sccc23)CC1)NNC(=O)c1cccc(Cl)c1	913041535	VMRSBMYLEBKNLY-UHFFFAOYSA-N	430.921	1.928	50	20	IDGD	
CS(=O)(=O)Nc1ccccc1C(=O)NNC(=O)COc1ccc(Br)cc1	913457478	HUIFXNXZPIDPDL-UHFFFAOYSA-N	442.291	1.661	50	20	IDGD	
CCN(Cc1ccc2c(c1)OCO2)C(=O)NNC(=O)c1csc(N2CCOCC2)n1	913628107	WGSSCOHXYSACES-UHFFFAOYSA-N	433.490	1.585	50	20	IDGD	
COc1cc(I)c(Cl)cc1C(=O)NNc1nnc(C)c(O)n1	914832121	NRYOOTPRYCCDJB-UHFFFAOYSA-N	435.609	1.909	50	20	IDGD	
COc1cccc(C[C@@H](C(=O)NNC(=O)COc2ccc(F)cc2)n2nnnc2C)c1	915694911	JVRAFYOBPSXVCI-SFHVURJKSA-N	428.424	1.139	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)c1cccc(N2CCOC2=O)c1	915804624	MBHQYSLFJZTWOW-UHFFFAOYSA-N	437.500	1.617	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@@H](C)CCc2ccccc2)cc1	915884283	VQZKCHIQZZEFBY-KRWDZBQOSA-N	432.546	1.967	50	20	IDGD	
CNS(=O)(=O)c1ccc(CNC(=O)NNC(=O)CSc2ccc(Cl)cc2)s1	916232380	JBXMRTYFWVPGTH-UHFFFAOYSA-N	448.979	1.932	50	20	IDGD	
CC(=NNC(=O)c1ccccn1)c1ccc(S(=O)(=O)N2CCCC[C@H]2C(=O)O)cc1	916247088	YWUIBHVIXPYVCZ-SFHVURJKSA-N	430.486	1.863	50	20	IDGD	
CCOc1cc(C=NNC(=O)C(N)=O)ccc1OCC(=O)N1C[C@@]2(C)C[C@H]1CC(C)(C)C2	916274321	LZFJSBYMWWKZFY-MWTRTKDXSA-N	444.532	1.827	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)NCc3cccnc3N3CCOCC3)n[nH]2)cc1	916400823	VVLDFQAQRZCMTI-UHFFFAOYSA-N	435.488	1.761	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)NCc2ccc(S(=O)(=O)N(C)C)cc2)cc1	916646877	SWLBQFDPAUHTSJ-UHFFFAOYSA-N	436.559	1.868	50	20	IDGD	
COc1ccc(/C=C(\C#N)C(=O)OCC(=O)N2CCN(CC(=O)NC(C)(C)C)CC2)cc1	917219188	FGSPVXRODTUCTA-QGOAFFKASA-N	442.516	1.204	50	20	IDGD	
Cc1c(C(=O)N([C@@H]2CCS(=O)(=O)C2)N(C)C)nnn1-c1cccc(Br)c1	917622214	OYKYQTAOOLHHQL-CQSZACIVSA-N	442.339	1.444	50	20	IDGD	
CCN(CC)c1ccc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1	918229822	UFMZTNMUEDKTJK-UHFFFAOYSA-N	447.561	1.927	50	20	IDGD	
CCOc1ccc(OCc2ccc(C(=O)NNC(=O)Cn3cnc([N+](=O)[O-])n3)cc2)cc1	918551298	BILYJBMERNXJDP-UHFFFAOYSA-N	440.416	1.625	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)c1cc(S(=O)(=O)N(C)C)ccc1Cl	919820375	YMSIFEYEVSCACW-UHFFFAOYSA-N	425.894	1.603	50	20	IDGD	
CCOc1ccc(-c2nc(C)c(C(=O)NNC(=O)N[C@@H]3CCS(=O)(=O)C3)s2)cc1	919885985	OQWCMSBFSMZEKU-CYBMUJFWSA-N	438.531	1.648	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)C[C@@H](c1ccccc1)OC2=O)N[C@@H]1CCS(=O)(=O)C1	919886343	VSTQHXXTBNQREI-AEFFLSMTSA-N	443.481	1.272	50	20	IDGD	
CN(C)N(C(=O)[C@H]1CC(=O)N(c2cc(Cl)cc(Cl)c2)C1)[C@H]1CCS(=O)(=O)C1	919988104	LETGBHXMCYJOMB-FZMZJTMJSA-N	434.345	1.839	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)OCC(=O)N2CCC(C(N)=O)CC2)c(C)n1C[C@H]1CCCO1	1115811383	AIJBYSVBIHYCSL-DEWISIQVSA-N	442.516	1.458	50	20	IDGD	
Cc1oc(-c2cnn(C)c2)nc1C(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1	1252690552	CVONORRKBXBXAX-UHFFFAOYSA-N	432.481	1.792	50	20	IDGD	
O=C(COC(=O)c1csc(-c2ccco2)n1)NNC(=O)[C@@H]1COc2ccccc2O1	1318298670	FQSTVNKSYWDRRV-HNNXBMFYSA-N	429.410	1.547	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)Cc2ccccc2NS(C)(=O)=O)cc1OC	1318370746	LIUPRNYESJGNSW-UHFFFAOYSA-N	435.502	1.859	50	20	IDGD	
O=C(NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)o1)c1ccc(Br)cc1	1322656805	QGNFLXLCZZZFHC-UHFFFAOYSA-N	442.291	1.901	50	20	IDGD	
CN(C)C(=O)c1cccc(CNC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)c1	1339685992	PEZOLZZLVNSKLM-UHFFFAOYSA-N	433.490	1.328	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2nc3ccccn3n2)C1	1777814415	CRNMORXLSSDBMX-IIBYNOLFSA-N	445.596	1.708	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cn4cccnc4n3)C2)C1	1778480784	RGQQMWBSKTZUFX-FZKQIMNGSA-N	436.310	1.346	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)c3ccc4ccoc4c3)CCO2)C1	1779037098	NSSCRQPYLCPWDP-HSZRJFAPSA-N	449.467	1.189	50	20	IDGD	
Cc1nc[nH]c1CSCC(=O)N1CCO[C@@]2(CCN(C(=O)CO[Si](C)(C)C)C2)C1	1779297074	QCVSDRDSQJKHDQ-LJQANCHMSA-N	440.642	1.633	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)Nc2ccccn2)C1	1779566719	KXLUFUPQCHEHMQ-BZLDKRAPSA-N	438.956	1.650	50	20	IDGD	
CO/C=C(\C)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1	1780097885	QBQKNYYCRLZDHI-QGFLDLQWSA-N	447.444	1.514	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H]2CCCN(C)C2)C1	1780575881	CHJFMQFUJRLQHB-YKTARERQSA-N	430.387	1.626	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H]2CCCS2(=O)=O)C1	1781649709	ITYRROCVYHZQSM-WFXMFSGNSA-N	434.986	1.485	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(C)c(C(=O)O)c(C)c3)C2)C1	1782174862	XRTBRDYSWUQZOC-IERDGZPVSA-N	438.908	1.699	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc3cccn3cn1)C2	1782175371	JUPJNLJQVUKEDO-HGHGUNKESA-N	434.924	1.716	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3n[nH]c4cccc(F)c34)C2)C1	1782485195	IQADFGUGYLGWJK-ZMZPIMSZSA-N	439.285	1.929	50	20	IDGD	
C[C@@H](Sc1ccccn1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2	1782495771	RMXLELDFKVAXLQ-AXHMDWHKSA-N	441.981	1.676	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cccnc3S)CCO2)C1	1783338643	JQVUHZJCXIOEMX-SUMWQHHRSA-N	428.352	1.987	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)Cc3cc(C)n(C)n3)CCO2)C1	1783344120	QOXKTAAVEZGYNP-QAPCUYQASA-N	427.343	1.274	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)CCNC(=O)OC(C)(C)C)CCO2)C1	1783537238	JREKRZGKPZNQNM-UGSOOPFHSA-N	448.358	1.515	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(C1)CN(C(=O)C(C)(C)NC(=O)OC(C)(C)C)CCO2	1783871818	WBCZIRHYPRKTMX-VBKZILBWSA-N	447.960	1.373	50	20	IDGD	
CC(C)(C)OC(=O)NC1(C(=O)N2CCO[C@]3(CCN(C(=O)C(Cl)Cl)C3)C2)CC1	1783951597	CRSIIGJWJGJGQL-KRWDZBQOSA-N	436.336	1.677	50	20	IDGD	
COc1cc(C)c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]3C2)cc1OC	1784092156	HXBFBXIVQQYGKY-FJXLLPKBSA-N	440.924	1.205	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)[C@H]1C[C@H]1c1ccc(F)c(F)c1	1784155058	MPRSOQDJWMIHTK-QTUVYZQZSA-N	442.890	1.648	50	20	IDGD	
CC(C)(C)OC(=O)CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCBr)[C@H]2C1	1786400911	FMGFXHJHQWJVBQ-IHRRRGAJSA-N	433.343	1.483	50	20	IDGD	
CCOCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C[C@@H]21	1786500921	JMYBUQFXGCXGPF-VGWMRTNUSA-N	447.960	1.135	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3c[nH]c4cnccc34)[C@H]2C1	1788457019	NIAQJSHYEXPOOF-HJXMPXNTSA-N	435.322	1.940	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(F)nc3)[C@H]2C1	1788838141	JLYRDRXMTPOQLN-UNQGMJICSA-N	428.302	1.845	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3[nH]cnc3-c3cccnc3)[C@H]2C1	1789194861	IZUJJLBRBIWCID-NXOAAHMSSA-N	447.923	1.319	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)c1ccc(O)c(F)c1	1790066492	DSFXYSIJINRWRG-XEZPLFJOSA-N	429.286	1.910	50	20	IDGD	
NC(=O)CC[C@H](N)C(=O)NC1(c2ccc(NC(=O)[C@H](F)Br)cc2)CCC1	1790534789	RTMMIPUVIOPFLB-JSGCOSHPSA-N	429.290	1.404	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3CCC(CO)CC3)C[C@@H]21	1791055155	LKVSBYNDGWTCAH-OEFHRGAISA-N	431.371	1.548	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc(N(C)C)o3)C[C@@H]21	1791057379	UDDXDZADZRKVMT-VOAKCMCISA-N	429.315	1.117	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4c[nH]nc4c3)C[C@@H]21	1791058144	ZSLINUIVGRYSAG-SIUGBPQLSA-N	435.322	1.940	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3CCc4nc[nH]c4C3)[C@H]2C1	1791531440	UWXNEUKQSFDOQF-WNFKFRIASA-N	443.375	1.731	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)Cn3ccnc3)[C@H]2C1	1791631272	ZTOVGPOZQHBMMF-WOYTXXSLSA-N	441.370	1.672	50	20	IDGD	
C#CCCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C[C@@H]21	1792170521	BQASDWIAQMVICU-QAETUUGQSA-N	441.956	1.512	50	20	IDGD	
CCC[C@@H](NC(C)=O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CO[Si](C)(C)C)C[C@@H]21	1792186557	QAYAIMXHPDALRK-FJIDUMEYSA-N	427.618	1.122	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CNC(=O)OC(C)(C)C)C2	1792872282	WFZHVEWNGBPMGD-GUIRCDHDSA-N	448.358	1.132	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1COc2ccccc2O1	1793840038	CCPXJFZAHOMRKG-ZDUSMZPESA-N	434.565	1.268	50	20	IDGD	
Cc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCBr)ncc1[N+](=O)[O-]	1795114471	NAUHTSPJAALAIO-DRXBFXEBSA-N	441.282	1.286	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)c1c[nH]c2cc(Cl)ccc12	1796925709	ZUNPWWQNWPYVJL-ZWUPXRALSA-N	426.300	1.624	50	20	IDGD	
COc1ccc2cc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)c3ccc(B(O)O)cc3)C4)[nH]c2c1	1797430640	YDXFHJKDQAWJQO-REPLKXPHSA-N	447.300	1.422	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccn(C(F)F)n1	1798163911	TVRAXJOLSJOZNQ-DXCMXYRUSA-N	425.263	1.718	50	20	IDGD	
COc1nc(C)ccc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)CBr)C2	1798244849	QULAJJQXGCVUHY-ZIEJDFEHSA-N	440.338	1.633	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cccc(C(F)(F)F)n1)C2	1800973977	JQDSNPGYPWDGBK-DMVWFOPNSA-N	449.857	1.486	50	20	IDGD	
C[C@H](Oc1ccccn1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2	1801366576	JLCGSZDWAZGCLI-ZZVJUGKHSA-N	430.274	1.129	50	20	IDGD	
COc1cc(C)ccc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2	1801706223	SWRLIOBWVNQWBI-ZSBFGKGUSA-N	425.323	1.992	50	20	IDGD	
COC[C@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cc1ccc(C(=O)OC)s1)C2	1802283598	PKCBIWPMINAOTM-XFMPKHEZSA-N	428.938	1.969	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1CCN(C(=O)Cn2ccnn2)[C@@H]1c1cccnc1	1803008631	MKCRXYUQYDZIRO-UKPHBRMFSA-N	435.326	1.410	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2nccc3nc[nH]c23)[C@H]1c1cccnc1)[C@@H](O)CCl	1803138859	GHDTVYUBTALCBL-YEWWUXTCSA-N	428.880	1.272	50	20	IDGD	
N[C@H](CC(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)c1cccnc1	1803139381	XRIKOORMKHUOSS-XSYGEPLQSA-N	431.924	1.172	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H](CNC(=O)CCN2C(=O)C=CC2=O)[C@@H]1c1cccnc1	1803911617	BUBXJKBFQRNALT-UZLBHIALSA-N	446.935	1.668	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1)c1ccc(O)nn1	1805267426	IRFMBNMSHKSDTL-CXAGYDPISA-N	434.294	1.682	50	20	IDGD	
O=C(c1ccc(OCCCO)cc1)N1CCC2(CCCN(C(=O)[C@@H](O)CCl)C2)CC1	1805523448	VTXHXOJPCFQRPK-IBGZPJMESA-N	438.952	1.892	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)C2CCCC2)[C@H]1c1cccnc1	1806180584	KAXODGXHGNOQNN-YLJYHZDGSA-N	436.516	1.590	50	20	IDGD	
O=C1CC[C@H](C(=O)N2CC[C@@H](CNC(=O)CCBr)[C@@H]2c2cccnc2)CN1	1806338193	RTFOCEXSLWDBCB-MPGHIAIKSA-N	437.338	1.399	50	20	IDGD	
CN1Cc2ccccc2C[C@H]1C(=O)N1CCCC2(CCN(C(=O)[C@H](O)CCl)CC2)C1	1806680048	LRXCENNTORHDIY-VQTJNVASSA-N	433.980	1.874	50	20	IDGD	
CN[C@H](CC(=O)NC[C@H]1CCN(C(=O)CO[Si](C)(C)C)[C@@H]1c1cccnc1)C(=O)O	1807204659	NMHQHZAODIJORL-GPMSIDNRSA-N	436.585	1.002	50	20	IDGD	
Cc1cncc(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)c1	1807369302	FNEVNSZVNAHYAR-DENIHFKCSA-N	444.300	1.098	50	20	IDGD	
CCOC(=O)N[C@H](O)C(=O)N1CC[C@H](CNC(=O)[C@@H](Cl)CC)[C@H]1c1cccnc1	1808264523	YSMGNRWTWGOEHC-JYYAWHABSA-N	426.901	1.169	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2nc[nH]c2[N+](=O)[O-])[C@H]1c1cccnc1	1808371339	LZBUCZURYHYMOE-VNHYZAJKSA-N	436.856	1.286	50	20	IDGD	
Cc1ccncc1CCC(=O)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1	1809969309	PFTZQKYNIXFMPN-UHFFFAOYSA-N	449.360	1.547	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)c2cc(=O)ccn2C)[C@H]1c1cccnc1	1811368076	YDDFGIWSOGCJOD-JCKWVBRZSA-N	447.333	1.883	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2nccnc2OC)[C@@H]1c1cccnc1	1813029849	ZKCTYGBZXNLOGJ-YQQAZPJKSA-N	433.896	1.454	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2cncs2)[C@@H]1c1cccnc1	1813069729	BBBCGNBDNPPAQA-DNVCBOLYSA-N	430.534	1.231	50	20	IDGD	
CC(=O)N/C(=C\c1ccco1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](O)CCl)n[nH]1	1814873145	STLNZETUCPRWQI-DNQJIUQOSA-N	449.895	1.772	50	20	IDGD	
Cc1cccc(CC(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)c1	1816922439	VSYNROUVYWVASR-NRFANRHFSA-N	446.316	1.947	50	20	IDGD	
Cc1ccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)c(C)n1	1817471989	AMDNROUXSVKRAR-HXUWFJFHSA-N	447.304	1.721	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CN2CCN(C(C)=O)CC2)n[nH]1	1818966419	FRVZLCCCNNXHOF-WBVHZDCISA-N	438.960	1.583	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCc2nc(N)n[nH]2)n[nH]1	1819286235	PALGJGYUVMUTCP-GTNSWQLSSA-N	443.339	1.971	50	20	IDGD	
C[Si](C)(C)OCC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2nccnc2C(N)=O)[nH]n1	1819595656	UTFHMQJHMUQDSP-CYBMUJFWSA-N	445.556	1.456	50	20	IDGD	
C[Si](C)(C)OCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H]2CCCS2(=O)=O)[nH]n1	1819596687	OOKBELUDUGKIRT-LSDHHAIUSA-N	442.614	1.831	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](F)Br)CC2	1820148869	XBKKUOGGSLIFHT-LWINAJNOSA-N	433.303	1.436	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)CCn2ccnn2)[nH]n1)[C@H](F)Br	1820937116	KWIAHETZJQLNFN-RISCZKNCSA-N	428.266	1.774	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)[C@@H]1[C@H]2C=CS[C@@H]21	1821707110	KIJXAQXVOAPUKZ-HYEGPXJVSA-N	438.318	1.271	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)/C=C/c2cccnc2)[nH]n1	1822410592	MEFFRBYFGZOJMB-VEGGFIAOSA-N	439.520	1.883	50	20	IDGD	
COCCn1nccc1C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H](O)CCl)CC1	1824183547	YYCIPGABVMTSRZ-AEFFLSMTSA-N	426.945	1.363	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)C(F)(F)C(F)F)CC1	1824844087	WKGMJCFGYHNIFE-MRXNPFEDSA-N	444.234	1.500	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1CCc2nc(NC(=O)CCn3cncn3)sc2C1	1826601963	STRRXAJCXAQPJJ-WDEREUQCSA-N	441.355	1.768	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H](C)CN)CC1	1826792415	MUOJCUGUNIGLLG-DGMXVEBPSA-N	430.553	1.335	50	20	IDGD	
Cc1cnoc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827052176	BQRJVZYWFGTCFR-IBGZPJMESA-N	425.294	1.210	50	20	IDGD	
COC1(CC(=O)N2CCC([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)CCC1	1827060321	XJQQRCDIUPBWDY-OAQYLSRUSA-N	442.365	1.559	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(OC)c(F)c3)CCO2)C1	1830151115	JGPSGPSZZVPKTL-FOIQADDNSA-N	428.888	1.922	50	20	IDGD	
COc1ccc([C@H](C)C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)cc1	1830450894	USCSGMVPYFYEHT-GZRFBZBPSA-N	428.888	1.790	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnn4cccnc34)C2)C1	1831651237	OEUZFLCSKCTMKN-JXFKEZNVSA-N	435.912	1.207	50	20	IDGD	
O=C(Cc1ccc(F)cc1Cl)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1	1832273896	GUHVMEVGNCJRNC-VQIMIIECSA-N	449.306	1.078	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)C[C@@H]3CCCCO3)CCO2)C1	1832350418	HJONAKIBMVRBQF-MPGHIAIKSA-N	433.343	1.185	50	20	IDGD	
O=C(CCc1cccs1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1833158894	KTJBABZCLXMROW-NVXWUHKLSA-N	449.342	1.828	50	20	IDGD	
C[C@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)CN3CCCC3)CC2)CC1	1833261645	SSAXBFWVCUXZDI-MRXNPFEDSA-N	443.430	1.685	50	20	IDGD	
Cc1nc(C(=O)N2CCC(N3CCC(NC(=O)[C@H](O)CCl)CC3)CC2)ccc1F	1833308294	QEFXKRZPTXCVGZ-GOSISDBHSA-N	426.920	1.314	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)s1	1833425753	NLIOJYHREYGFQA-YVEFUNNKSA-N	447.351	1.610	50	20	IDGD	
Cc1nscc1C(=O)N1CCO[C@@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1	1833746393	YWKHRINDVHTAJP-GOSISDBHSA-N	427.599	1.373	50	20	IDGD	
Cn1nc(C(=O)NC2CCN(C3CCN(C(=O)C(C)(C)CCl)CC3)CC2)cc1O	1833942940	XRSGCKKCLQAUQF-UHFFFAOYSA-N	425.961	1.576	50	20	IDGD	
Cc1nnsc1C(=O)N1CCC(N2CCC(NC(=O)CCBr)CC2)CC1	1834421951	ZGMHCZPFGLCTOO-UHFFFAOYSA-N	444.399	1.817	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)c1ccc2c[nH]nc2c1	1835003868	ZREGOYCNTFYHSR-IBGZPJMESA-N	433.940	1.348	50	20	IDGD	
O=C(/C=C/c1ccccc1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1835109606	BZFJJNVWLQXEJD-WAQVGJNASA-N	441.297	1.847	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cnn4cccnc34)CC2)CC1	1835535581	GGEFKXCOSHFTIJ-GOSISDBHSA-N	432.956	1.932	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1837715977	USAPWMZTUWIKJU-CZUORRHYSA-N	437.407	1.078	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3c(C)n[nH]c3C)CCO2)C1	1837808802	XUMOXASTSWXOSH-RDTXWAMCSA-N	443.342	1.270	50	20	IDGD	
O=C(c1cc(-c2ccccc2)no1)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1	1837994521	QFOPLIPUXGENAC-UTKZUKDTSA-N	449.891	1.011	50	20	IDGD	
CCc1noc(C)c1C(=O)N1CCO[C@]2(COCCN(C(=O)CCBr)C2)C1	1838054650	XPPHUZXDXXZGJR-SFHVURJKSA-N	444.326	1.400	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cn(C(C)(C)C)nn3)CCO2)C1	1838757733	FEDUNOMUCCCJRJ-LIRRHRJNSA-N	427.933	1.121	50	20	IDGD	
Cc1ccccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1838900170	OWCVUOCWWPQUQT-YJBOKZPZSA-N	429.286	1.756	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc3ccnn3c1)CCO2	1839570409	LGOIDLRTIZOJFC-OAQYLSRUSA-N	446.580	1.256	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)C3(F)CCCCC3)C2)C1	1840033497	HSPMZLDXBOFLKA-WMLDXEAASA-N	435.334	1.899	50	20	IDGD	
O=C(CS[C@@H]1CCCCO1)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840188592	RYQPWOXXQJUAMS-RHSMWYFYSA-N	441.377	1.506	50	20	IDGD	
CC(C)N1CCC[C@H]1C(=O)N1CCO[C@@]2(COCCN(C(=O)CCBr)C2)C1	1840582279	XFVZIMJOOVGMJY-QFBILLFUSA-N	446.386	1.101	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC=C(C(=O)N2CC3(CCCN3C(=O)[C@H](O)CCl)C2)C1	1841350284	SWSLKAYBLMUBPI-OAHLLOKOSA-N	427.929	1.357	50	20	IDGD	
O=C(c1cc(-c2ccccc2)no1)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843014297	VLSCRWCALPHHJU-UHFFFAOYSA-N	431.257	1.152	50	20	IDGD	
Cn1c(C(=O)N2CCCC23CN(C(=O)[C@H](O)CCl)C3)cc2c1-c1ncccc1OC2	1843134185	JBZCEFDHPZYCJA-OAHLLOKOSA-N	430.892	1.396	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1cccn3nccc13)C2	1843416586	BPUOAFBUEZWNEL-MFKUBSTISA-N	433.472	1.285	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)c2cc3c(F)cc(F)cc3[nH]2)C1	1843705082	QKMUNTNDBFESRQ-UHFFFAOYSA-N	433.459	1.636	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)c2cn3ccc(Cl)cc3n2)C1	1843811619	LBJSXHVPNFRTRE-UHFFFAOYSA-N	432.912	1.178	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)c1oncc1C)C2	1844692798	LTQWNHBHIDFPMU-UHFFFAOYSA-N	428.401	1.947	50	20	IDGD	
Cn1nncc1C(=O)N1CC2(CCCN2C(=O)[C@H](Br)Cc2ccccc2)C1	1845940265	GMAYLCBVGVUIKG-OAHLLOKOSA-N	432.322	1.638	50	20	IDGD	
CCOC(=O)N1CCC(C(=O)N2CCCC23CN(C(=O)[C@@H](F)Br)C3)CC1	1846978814	XIEGCRQALICQLG-CYBMUJFWSA-N	434.306	1.749	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CN(C)C(=O)c1ccccc1	1847494306	OLSNLQUXRWNSQD-PVAVHDDUSA-N	436.350	1.991	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CCN1C(=O)Cc2ccccc2C1=O	1847612382	ODQDPYNYOHGNRZ-SQNIBIBYSA-N	447.919	1.057	50	20	IDGD	
O=C(NNC(=O)c1cc(Cl)ccc1O)c1ccc2c(c1)C(=O)N(C[C@@H]1CCCO1)C2=O	10600914	LWUVLLOSNBPTHL-ZDUSSCGKSA-N	443.843	1.895	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1nn(C)c(=O)c2ccccc12	15089557	DXWNNRMLTGNAMZ-UHFFFAOYSA-N	444.831	1.214	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)CN1C(=O)COc2ccc([N+](=O)[O-])cc21	24298178	XTBSMWCBMWHBGH-LLVKDONJSA-N	432.364	1.074	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)c2ccc(S(=O)(=O)NCc3cccs3)cc2)n1	60166150	DNIOMYMKFYAKPO-UHFFFAOYSA-N	447.542	1.501	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NCc1cccnc1OCC(F)(F)F	725873077	JVLZAQPEPXVMKM-UHFFFAOYSA-N	431.396	1.345	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=S)NCc3ccc(S(N)(=O)=O)cc3)cc2C1	726442349	ZLBHBCHRXVHPEK-NSHDSACASA-N	438.600	1.829	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)NC[C@@H](c2cccc(Cl)c2)N2CCOCC2)n1	727034040	FQIMFDVHHVBECZ-SFHVURJKSA-N	434.928	1.557	50	20	IDGD	
C[C@H](Oc1ccc(F)c(F)c1)C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	728336310	JTXMZCDWCCZNCM-GTNSWQLSSA-N	436.367	1.263	50	20	IDGD	
CNS(=O)(=O)c1ccc(CCC(=O)NNC(=O)c2cccc(OC(F)F)c2)cc1	728488315	VOUHEOPTWKBQHM-UHFFFAOYSA-N	427.429	1.590	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1cnnn1-c1ccccc1Cl	728846874	UWKVTUWIDGQUFC-UHFFFAOYSA-N	426.868	1.388	50	20	IDGD	
COC(=O)c1cc(Br)ccc1S(=O)(=O)NNC(=O)c1cccc(C#N)c1	728853307	CGHHFXUSIUGRJH-UHFFFAOYSA-N	438.259	1.731	50	20	IDGD	
CCOC(=O)c1sc2ncc(S(=O)(=O)NNC(=O)Cc3cccnc3)cc2c1C	728856210	JPJXWUUIFKEJNN-UHFFFAOYSA-N	434.499	1.729	50	20	IDGD	
Cc1c(C)c(C)c(S(=O)(=O)NCCC(=O)NNC(=O)Cc2cccnc2)c(C)c1C	728893473	OCOCINOAVMOUPQ-UHFFFAOYSA-N	432.546	1.682	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)c1ccc2c(c1)C(=O)N(C[C@H]1CCCO1)C2=O	730034388	PCCGOYKITKLJOH-MRXNPFEDSA-N	437.452	1.561	50	20	IDGD	
O=C(NNC(=O)c1c[nH]nc1-c1cccnc1)c1cccc(S(=O)(=O)N2CCCC2)c1	730420473	HPPXFZNYVSQNNZ-UHFFFAOYSA-N	440.485	1.331	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)CC[C@H]1NC(=O)N(c2cccc(C)c2)C1=O	730829817	LETJASFOOFTUOS-QGZVFWFLSA-N	439.472	1.468	50	20	IDGD	
CCCCOc1ccc(C(=O)NNS(=O)(=O)c2ccc3c(c2)C(=O)NC3=O)cc1OC	731595840	ZGLSRWBSAZIJIO-UHFFFAOYSA-N	447.469	1.381	50	20	IDGD	
O=C(NCc1cccc(C(F)(F)F)c1)NNS(=O)(=O)c1ccc2c(c1)C(=O)NC2=O	731596667	VWKKEJLIDLSUBY-UHFFFAOYSA-N	442.375	1.282	50	20	IDGD	
CCCNC(=O)CCC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	731865925	WYCNFPMFIRLMJG-UHFFFAOYSA-N	446.529	1.233	50	20	IDGD	
O=C(NNC(=O)c1cnn2ccccc12)c1cccc(S(=O)(=O)NCc2ccccc2)c1	731865936	XKFGZAWEMMTUCE-UHFFFAOYSA-N	449.492	1.888	50	20	IDGD	
CC(=O)Nc1ccc(NS(C)(=O)=O)c(C(=O)NNc2nc(-c3ccncc3)no2)c1	732065576	PRFJCPYXSSWSAW-UHFFFAOYSA-N	431.434	1.218	50	20	IDGD	
CC(C)(C)c1ccc(C(=O)N[C@H](CCS(C)(=O)=O)C(=O)NNC(=O)C2CCC2)cc1	732141733	PCXCRIWLTCATHI-QGZVFWFLSA-N	437.562	1.465	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)N1CCN(C(=O)c2ccc(Br)cc2)CC1	732198817	GGUPQJWPDAWXHN-AWEZNQCLSA-N	439.354	1.789	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)NCc1ccc(C(=O)N2CCNC(=O)C2)cc1)c1ccccc1	732240793	LEUYVUHUWJNWJB-LJQANCHMSA-N	437.500	1.283	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)c2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C[C@@H](C)O1	732265075	YSRJZVPTMSYKEU-ZIAGYGMSSA-N	430.465	1.256	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(C(=O)NNc2ccccc2S(C)(=O)=O)cc1	732302260	FJLOAWMNOKVHLA-UHFFFAOYSA-N	425.532	1.878	50	20	IDGD	
CC(C)NS(=O)(=O)c1cc(C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)ccc1F	733110503	NFSVVGFASAPNMX-UHFFFAOYSA-N	445.476	1.773	50	20	IDGD	
COc1ccc(C(=O)N2CCN(C(=O)NNC(=O)c3cnn(-c4ccccc4)c3)CC2)cc1	733349961	LSOSSWHJCQKDMB-UHFFFAOYSA-N	448.483	1.693	50	20	IDGD	
CCN1CCC[C@@H]1CN1C[C@H](C(=O)NNC(=O)c2cc(-c3ccc(C)cc3)[nH]n2)CC1=O	733358591	BHXGOXFTZJPLPX-QZTJIDSGSA-N	438.532	1.479	50	20	IDGD	
CCCCn1c(=O)nc(O)c2c1nc(CCC(=O)NNc1cnccn1)n2CC(C)C	734244338	HUAYMZWDPIMRTK-UHFFFAOYSA-N	428.497	1.621	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)CCCS(=O)(=O)c2ccc(Br)cc2)cn1	735445940	JZHQUUPSDYJZQL-UHFFFAOYSA-N	429.296	1.198	50	20	IDGD	
CCc1ccc(C(=O)NNc2ccc(Cl)nn2)cc1S(=O)(=O)N1CCOCC1	735688606	CCAMUDBJVGCHHQ-UHFFFAOYSA-N	425.898	1.470	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)[C@@H](NC(=O)N1CCCC1)[C@H](C)CC	736066845	VUQDDCUOXHPUJX-QRWLVFNGSA-N	428.537	1.966	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)CCN1C(=O)CCc2ccccc21	737765270	CYZCZEVEEMWJFN-UHFFFAOYSA-N	443.529	1.419	50	20	IDGD	
CN(CCN1CCN(c2ccccc2)CC1)CC(=O)NNC(=O)c1cccc(Cl)c1	738338507	DIDGJGYJHUWGTJ-UHFFFAOYSA-N	429.952	1.855	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(CC(=O)NNC(=O)c2cc3ccccc3cc2O)C(=O)C1	741283379	GAZOCSXLZYJLFE-UHFFFAOYSA-N	442.472	1.386	50	20	IDGD	
COCC(=NNC(=O)C[C@H]1c2cc(OC)c(OC)cc2CCN1S(C)(=O)=O)C(C)C	741455665	NHXWIXQUZCUZOD-KRWDZBQOSA-N	441.550	1.727	50	20	IDGD	
CN(C)c1cc(CNC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c2ccccc2n1	743511059	HAYUSALGGBNVPP-UHFFFAOYSA-N	431.460	1.421	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)[C@H]2CC(=O)N(c3ccccc3Cl)C2)cc1	744564585	NQCHRVUSZLCTLN-HNNXBMFYSA-N	440.843	1.569	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)c2cn(-c3ccc(C(F)(F)F)cn3)nn2)c1	744920044	AOGQQPPPBULEHC-UHFFFAOYSA-N	448.361	1.608	50	20	IDGD	
O=C(NNC(=O)c1sccc1S(=O)(=O)N1CCC(CO)CC1)c1ccccc1F	745475620	GEIIOLAMPNVCMQ-UHFFFAOYSA-N	441.506	1.355	50	20	IDGD	
C[C@@H]1C[C@@H](NC(=O)NNC(=O)CSc2ccc(Cl)cc2)C(=O)N1c1cnn(C)c1	745919022	QDERVKWVPURPHH-IAQYHMDHSA-N	436.925	1.690	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@](C)(O)Cc2ccccc2)c1	746093669	SDRYUKAHODZXHP-NRFANRHFSA-N	433.530	1.472	50	20	IDGD	
COc1cccc(C(=O)N2CCN(CC(=O)NNC(=O)c3ccc(F)cc3)CC2)c1OC	746854528	WREANQATTOOYQG-UHFFFAOYSA-N	444.463	1.062	50	20	IDGD	
Cc1nn(C)c(C)c1S(=O)(=O)N[C@@H](C)C(=O)NNc1ccc(F)cc1Br	748074532	CSFUVBWVOSTGBZ-VIFPVBQESA-N	448.318	1.749	50	20	IDGD	
CC(C)(C)C(=O)c1ccc(S(=O)(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1	749142876	RLFBABHYWQMDAG-UHFFFAOYSA-N	438.527	1.942	50	20	IDGD	
Cc1oc(C(=O)NNC(=O)[C@H](C)Oc2cccc(Br)c2)cc1S(N)(=O)=O	755625176	GSPUZTHAOHNKCR-VIFPVBQESA-N	446.279	1.226	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1	755794816	JZHDDQDCYYYKKA-UHFFFAOYSA-N	428.449	1.098	50	20	IDGD	
N#Cc1cccc(COc2ccc(NC(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)cc2F)c1	756355888	UIXDZKAXTFZSDR-OAHLLOKOSA-N	446.460	1.864	50	20	IDGD	
O=C(Cc1cccc2ccccc12)NNC(=O)Nc1ccn(CC(=O)N2CCOCC2)n1	756654157	HRGSSLNNNQTGQD-UHFFFAOYSA-N	436.472	1.291	50	20	IDGD	
COCCCn1ccc(NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)n1	756657271	CNBZTICELDWOAM-UHFFFAOYSA-N	429.525	1.285	50	20	IDGD	
O=C1C[C@H](Cc2ccc(NC(=O)NNC(=O)c3nn(-c4ccccc4)cc3O)cc2)C(=O)N1	756814534	FZPIENHESVCKFF-AWEZNQCLSA-N	448.439	1.250	50	20	IDGD	
Cc1cc(COc2ccc(C(=O)NNc3ccc(C(N)=O)nn3)cc2Br)no1	757400655	RTEZNPJLHRVNBG-UHFFFAOYSA-N	447.249	1.970	50	20	IDGD	
CCS(=O)(=O)N1CCC(CNC(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)CC1	758745318	SHKWRPIDCVAGLK-UHFFFAOYSA-N	426.583	1.595	50	20	IDGD	
Cc1ccc(Cn2nc(C)c(C(=O)NNC(=O)C(=O)Nc3ccccn3)c2Cl)cc1	758833534	NLCQHKHAZOIZCF-UHFFFAOYSA-N	426.864	1.996	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)NCCCN1C(=O)COc2ccccc21	761722121	RUSSCFZMGUSANF-UHFFFAOYSA-N	444.513	1.933	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)c2ccccn2)sc2c1CCCS2	763468306	WXCMQQMIWHALGK-UHFFFAOYSA-N	434.499	1.758	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cc(F)c(OC)c(F)c2)cc(OC)c1OC	763538432	BQHSTLGCAPZZIH-UHFFFAOYSA-N	439.371	1.399	50	20	IDGD	
COc1cc2nc(C)sc2cc1NC(=O)C(=O)NNC(=O)c1ccc2c(c1)OCO2	763547970	GWYAWEWHJFCAAO-UHFFFAOYSA-N	428.426	1.742	50	20	IDGD	
CC(C)(C)OC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)c(F)c1	763558914	NHINTUVOXXPYPS-UHFFFAOYSA-N	445.403	1.909	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)N1CCc2c1cccc2C(F)(F)F	763570606	GVYIXOUGGIFFIL-MRXNPFEDSA-N	435.358	1.582	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2ccc(-n3nc(C)cc3C)nc2)c1	763665887	QLSIRARIBVSSHK-UHFFFAOYSA-N	436.472	1.666	50	20	IDGD	
Cc1c(C#N)cccc1NC(=O)C(=O)NNC(=O)COc1ccc(Br)cc1	763694715	LAUHJUUVNGVSIR-UHFFFAOYSA-N	431.246	1.794	50	20	IDGD	
CCCOc1cccc(NC(=O)C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1	763718801	MWDXQWJUZZWBOR-UHFFFAOYSA-N	448.501	1.125	50	20	IDGD	
O=C(CSc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1cnn(Cc2ccccn2)c1	763732915	FYTTVEJEWJDAMB-UHFFFAOYSA-N	444.904	1.858	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(F)ccc1N1CCCCC1	763814144	QJDFRHYYOMCZEZ-UHFFFAOYSA-N	439.447	1.853	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccccc2-n2cncn2)cc1	763862643	YUYFMIDMBNZZHL-AWEZNQCLSA-N	438.444	1.219	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)N1C[C@@H]2CCCN2c2ccccc21	763865434	PWYKTKKOOZCGKU-CABCVRRESA-N	426.448	1.756	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cn(-c3ccccc3)nc2C)cc1	763878626	SCEFYQBMGKBENU-INIZCTEOSA-N	449.467	1.937	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(-c3n[nH]c(C)n3)c2)cc1OC	763900428	JGXSYGAJQPADGC-UHFFFAOYSA-N	438.444	1.587	50	20	IDGD	
Cc1nc(-c2cccc(NC(=O)C(=O)NNC(=O)c3nn(-c4ccccc4)cc3O)c2)n[nH]1	763950257	WBFGLMPICAJXFH-UHFFFAOYSA-N	446.427	1.071	50	20	IDGD	
Cc1ccccc1COc1cccc(NC(=O)C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)c1	763996152	CDEXDASWLDGEOH-INIZCTEOSA-N	445.497	1.095	50	20	IDGD	
CN1C(=O)CCc2cc(NC(=O)C(=O)NNC(=O)c3cc(Br)cn3C)ccc21	764001947	HJTJVHMENDDAGZ-UHFFFAOYSA-N	448.277	1.096	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2sc3c(c2C(=O)OC(C)C)CCCC3)n[nH]1	764106678	PCRRPHGMIFTGFE-UHFFFAOYSA-N	433.490	1.623	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1)C(=O)Nc1cccnc1	764180214	ZCISBDPMIKZJCD-NRFANRHFSA-N	429.480	1.795	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)C(=O)Nc1cc(Br)ccc1N1CCCC1	764268348	IRAHHUKOBPJTFE-UHFFFAOYSA-N	446.305	1.773	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COCc2ccccc2)n([C@H]2C[C@H]3CC[C@H]2C3)n1	764366562	NJHJKMORGBHRCE-BZSNNMDCSA-N	425.489	1.855	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1c(C)cnn1[C@H]1CCCc2ccccc21	764400251	OXFNIHJGBBHLBN-QAPCUYQASA-N	443.504	1.255	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1c(C)cnn1[C@H]1CCCc2ccccc21	764400252	OXFNIHJGBBHLBN-YJBOKZPZSA-N	443.504	1.255	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=S)Nc1ccc2c(c1)CCC2	764516386	SUVBPPYSEGBOAR-UHFFFAOYSA-N	437.569	1.951	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNS(=O)(=O)c2cccc3nonc23)CC1	765088526	AJYPBHITCNOWFQ-UHFFFAOYSA-N	440.482	1.115	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N[C@H](C)[C@@H]2CCOC2)cc1	765097661	MTKLCKDLGFLQNI-BMQZRQAQSA-N	437.500	1.882	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	765750606	AHZNVJBFQHGHBX-UHFFFAOYSA-N	441.919	1.556	50	20	IDGD	
COc1cc(C#N)ccc1NC(=O)C(=O)NNC(=O)c1ccc(OC(C)C)c(OC)c1	766258904	OXKHBKXVIUGRML-UHFFFAOYSA-N	426.429	1.762	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)C2=NN(CC(C)C)C(=O)CC2)c2ccccc2c1=O	766338125	VDKBTRMXFMRUPF-UHFFFAOYSA-N	426.477	1.202	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)NCCN2CCN(c3cccc(Cl)c3)CC2)n1	767198107	RDPWFLYMBSUGTP-UHFFFAOYSA-N	433.944	1.306	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3ccnc(-n4cncn4)c3)n[nH]2)cc1OC	768277709	RKMMALUHWHUNSA-UHFFFAOYSA-N	434.416	1.144	50	20	IDGD	
COc1cc(N2C[C@@H](C(=O)NNC(=S)Nc3ccccn3)CC2=O)cc(OC)c1OC	768578028	KAZYYXJUFGJWJP-LBPRGKRZSA-N	445.501	1.478	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)c1sccc1S(=O)(=O)C(F)F	768627851	HFNSROBVRYBSPX-UHFFFAOYSA-N	440.471	1.913	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)c1ccc(-n2ncc(C#N)c2N)cc1	768640439	JSPCBWPMHXDZIV-UHFFFAOYSA-N	426.458	1.495	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)NC2CCN([C@H]3CCCC[C@H]3O)CC2)nc2ccccc21	769158986	CHZAMNNJMDNSBM-RBUKOAKNSA-N	428.537	1.214	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@](C)(O)C(C)C)c1	770210230	UYMRHYDRXICYSK-HXUWFJFHSA-N	435.502	1.664	50	20	IDGD	
COc1cc(CNC(=O)NNc2nc(O)c3cnn(C)c3n2)ccc1OCC(F)(F)F	770339280	DOZQIRUHCYBGPN-UHFFFAOYSA-N	441.370	1.845	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCc2sccc21)c1cccc(S(=O)(=O)N2CCOCC2)c1	771216697	MMBCCLIWSUEYGT-KRWDZBQOSA-N	449.554	1.650	50	20	IDGD	
Cn1ccnc1[C@H](O)C1CCN(C(=O)NNC(=O)c2cccc(Br)c2)CC1	771993753	OGCHYMGHZVNPOK-OAHLLOKOSA-N	436.310	1.983	50	20	IDGD	
CC(C)COC(=O)N1CCC(C(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)CC1	772193645	YATWZNNTXISKOI-UHFFFAOYSA-N	438.912	1.608	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)N[C@H](c1ccc(F)c(Cl)c1)C(F)(F)F	772628211	LACZFEOTJIMOAY-GZMMTYOYSA-N	431.795	1.848	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2O1)C(=O)Nc1ccc(OC(F)F)c2cccnc12	773495417	BAIFYAIWYFHYOY-MRXNPFEDSA-N	442.378	1.926	50	20	IDGD	
COc1cc(SC)ccc1NC(=O)C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	773536017	YQDYYZNJLXJBBV-UHFFFAOYSA-N	437.499	1.220	50	20	IDGD	
NC(=O)C1CCN(c2ccccc2NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2)CC1	773643517	AHAYAEHIVZIBAP-UHFFFAOYSA-N	426.433	1.378	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2cccc(-c3nnc4n3CCCCC4)c2C)n1	773730672	KHXBPOMHNGQVKJ-UHFFFAOYSA-N	436.476	1.860	50	20	IDGD	
COc1ncc(/C=C/C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)cn1	773860014	TYUQYYOONZXWGF-VOTSOKGWSA-N	444.923	1.117	50	20	IDGD	
COC(=O)[C@H]1C[C@@H](OC)CCN1C(=O)CCC(=O)C(C#N)=C1N(C)c2ccccc2N1C	778456014	IBXGIPHNBVTKMY-HNAYVOBHSA-N	440.500	1.836	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@@H](C(=O)NNc2ccc(Cl)cc2[N+](=O)[O-])[C@H](C)O)cc1	779501925	TXCWXMBONCGXMK-MEDUHNTESA-N	442.881	1.728	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2cnc(-c3ccccc3)nc2)c1	780376233	DQGYBXFLPLFJBE-UHFFFAOYSA-N	432.483	1.170	50	20	IDGD	
CSc1ccccc1S(=O)(=O)N1CCN(S(=O)(=O)CBr)CC1	780838966	UZBQTVZBNILKOU-UHFFFAOYSA-N	429.383	1.397	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)c3ccc(OC)c(-n4cnnn4)c3)n[nH]2)cc1	781709855	LAZQZSNWAZRBJB-UHFFFAOYSA-N	432.444	1.698	50	20	IDGD	
O=C(NNc1cccc([N+](=O)[O-])c1)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(Cl)cc1	782016925	MGMBJGPESSDLGD-ZBFHGGJFSA-N	440.865	1.515	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc(OC4COC4)cc3)n[nH]2)cc1	782124516	PONDXNQOBNQETA-UHFFFAOYSA-N	449.467	1.816	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)C(=O)Nc1ccc(Cl)c(F)c1	782895928	AVPSGCFUEXHLIQ-UHFFFAOYSA-N	441.872	1.480	50	20	IDGD	
CSc1ccc(C)c(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)c1	783264917	SSQCTOPDZWPHBC-UHFFFAOYSA-N	437.547	1.880	50	20	IDGD	
CNS(=O)(=O)c1cccc(NC(=O)C(=O)NNc2ccc(OC(F)F)cc2)c1C	784320462	ZCNDWEDBLFGBNW-UHFFFAOYSA-N	428.417	1.586	50	20	IDGD	
C[C@@H](C(=O)Nc1ccc(NC(=O)C(=O)NNc2cc(F)c(F)cc2F)cc1)n1cncn1	784891518	UWAXKFLVADZWLB-JTQLQIEISA-N	447.377	1.977	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)c1nn(-c2cccc(F)c2)cc1O	786521789	JWAYRZAEHZWNAL-UHFFFAOYSA-N	431.811	1.448	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NN=C2CCOC[C@H]2CN2CCCCC2)ccc1Cl	787151694	QEFJMQVYSBXSTO-CQSZACIVSA-N	428.942	1.596	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1cc(-c2ccsc2)nn1C	787543166	GVUSKEIDUVPKHH-LLVKDONJSA-N	431.449	1.841	50	20	IDGD	
O=C(NNC(=O)[C@H]1CC(=O)c2ccccc21)c1cccc(S(=O)(=O)N2CCCCC2)c1	789726667	DIOMKOWVPNIDNW-IBGZPJMESA-N	441.509	1.992	50	20	IDGD	
CC(C)n1nc(-c2ccco2)cc1NC(=O)C(=O)NNC(=O)c1ccc2c(c1)OCO2	789729771	IDHSMFRMYZGFGZ-UHFFFAOYSA-N	425.401	1.852	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2nc(C)c(C)s2)cc1Br	789735133	SZMBFVHTMCYMEW-UHFFFAOYSA-N	427.280	1.931	50	20	IDGD	
CN(C)[C@@H]1CCOc2c(NC(=O)C(=O)NNC(=O)c3cnn(-c4ccccc4)c3)cccc21	789735484	YRHGZEQHGDGWRK-LJQANCHMSA-N	448.483	1.657	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNc2cccc(F)c2[N+](=O)[O-])ccc1Br	790585292	NJBVAHUKMORPDO-UHFFFAOYSA-N	433.215	1.901	50	20	IDGD	
CNS(=O)(=O)c1cccc2c1CCN(C(=O)NNC(=O)C(C)(C)c1ccccc1)C2	790715134	SPALXCZOKXDJMN-UHFFFAOYSA-N	430.530	1.671	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)CCc3cccc(N(C)C)c3)cc2)CC1	792267040	DWPJDHHVDQYHAJ-UHFFFAOYSA-N	445.589	1.765	50	20	IDGD	
CNS(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@H](C)Oc2ccc3ccccc3c2)nc1	792392299	ZJFHVULQUIRYLQ-ZDUSSCGKSA-N	443.485	1.763	50	20	IDGD	
CN(Cc1cccc(NC(=O)C(=O)NNc2nc3ccccn3n2)c1)Cc1cscn1	792395835	VJKGBYWJQOEOCV-UHFFFAOYSA-N	436.501	1.900	50	20	IDGD	
O=C(NNc1ccc2c(=O)[nH]ccc2c1)C(=O)Nc1cccc(-c2nnnn2C2CC2)c1	793064813	FVPLOXQCTJLQOP-UHFFFAOYSA-N	430.428	1.598	50	20	IDGD	
NS(=O)(=O)c1ccc(C(=O)NNc2nc(-c3ccncc3)no2)cc1Br	798322498	CEAYUHFZNNJXFT-UHFFFAOYSA-N	439.251	1.298	50	20	IDGD	
COC(=O)c1cccc(NC(=O)C(=O)NNC(=O)Cc2ccccc2F)c1OC(C)C	799258698	GUTWPZDCFJVLRP-UHFFFAOYSA-N	431.420	1.728	50	20	IDGD	
CN(C1CCCCC1)S(=O)(=O)c1ccc(C(=O)NNC(=O)N=c2cc[nH]cc2)cc1	802025546	BGXXWLUUCZDWEW-UHFFFAOYSA-N	431.518	1.923	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@@H]2CCCN2C(=O)Cc2ccccc2)cc1	802063482	GXBSTKODVNLLHH-SFHVURJKSA-N	444.513	1.477	50	20	IDGD	
CCc1nc(-c2ccc(C(=O)NNC(=O)Nc3ccc(S(C)(=O)=O)cc3)cc2)n[nH]1	802065759	BBLRFLMBLIXJJI-UHFFFAOYSA-N	428.474	1.904	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)NC[C@H](c2cccs2)N2CCOCC2)nc2ccccc21	806994417	VURIOQQQLMKBBS-QGZVFWFLSA-N	442.545	1.581	50	20	IDGD	
O=C(NCC1(N2CCCCC2)CCCCC1)NNC(=O)c1ccc(-n2cnnn2)cc1	806994491	AGJCJLSTBWWANW-UHFFFAOYSA-N	426.525	1.795	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)CCN2CCN(C(c3ccccc3)c3ccccc3)CC2)nn1	807944638	IWGMBVMOSDQQQC-UHFFFAOYSA-N	447.543	1.373	50	20	IDGD	
COc1cc(NC(C)=O)c(Cl)cc1S(=O)(=O)NNC(=O)CCc1ccccc1O	808089284	PYTGOPAABBXCSS-UHFFFAOYSA-N	441.893	1.955	50	20	IDGD	
C#CC[C@]1(C(=O)NNc2nccc(N3CCOCC3)n2)CCCN1C(=O)OC(C)(C)C	809722477	YURZGOINJDLLPT-OAQYLSRUSA-N	430.509	1.549	50	20	IDGD	
O=C(Cc1cccc(Cl)c1F)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	810592124	KPYPGVPRDYWTNP-UHFFFAOYSA-N	432.883	1.627	50	20	IDGD	
CC(C)CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)NNC(=O)[C@H](C)Oc1cccc(Cl)c1	811461421	ARAHKJMOVWAORF-SUMWQHHRSA-N	435.912	1.751	50	20	IDGD	
O=C(NNC(=O)N1CCCN2c3ccccc3C[C@@H]2C1)C1CCN(c2ncccn2)CC1	811874256	JXWNEZKMXYFABQ-LJQANCHMSA-N	435.532	1.571	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)COC2CN(C(=O)OC(C)(C)C)C2)cc1	812726982	BNGYQLKGUFPENG-UHFFFAOYSA-N	428.511	1.016	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)Nc2cccc(N3C(=O)N[C@](C)(C4CC4)C3=O)c2)n1	812987009	IXKQXBMFOAVPDM-OAQYLSRUSA-N	439.476	1.578	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1csc(N2CCOCC2)n1)[C@H]1OCCc2sccc21	813867743	UHLMVTXIYIRRDA-IAQYHMDHSA-N	437.547	1.688	50	20	IDGD	
CC(=NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1)c1cn(-c2ccccc2)nn1	814879777	XRQXEAPQBQJEJC-UHFFFAOYSA-N	431.500	1.566	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cn(Cc3ccccc3)nn2)c1C	815565999	GGTXWMKSEHRELV-INIZCTEOSA-N	436.472	1.497	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cn(Cc3ccccc3)nn2)cc1OC	815567128	PMKXYYHFHWBXHH-UHFFFAOYSA-N	438.444	1.133	50	20	IDGD	
CNC(=O)Oc1cccc(NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)c1	815569943	MASSOKTWSZQZNL-UHFFFAOYSA-N	428.430	1.256	50	20	IDGD	
Cn1cc(Br)c(C(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)n1	815634236	GSFGNAYCAKGKCW-UHFFFAOYSA-N	445.318	1.526	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@H]2CCc3nncn3C2)ccc1Oc1cccnc1	815692858	DLPYCDAGSLZGRA-AWEZNQCLSA-N	435.444	1.122	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccc(Br)c(C(=O)N2CC[C@H](B(O)O)C2)c1	864234938	ZWJNROZOHYASPX-JTQLQIEISA-N	433.133	1.215	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)[C@H]2CS[C@H](Cc3ccccc3F)C(=O)N2)c1	896299564	FQUDAGPMRYHZSX-QZTJIDSGSA-N	430.505	1.496	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)cc1	913500127	VJKSEVTXZLFQNM-UHFFFAOYSA-N	440.865	1.638	50	20	IDGD	
C[C@H](CNC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)c1ccccc1	915904214	ROPRFHBAFNIUBZ-MRXNPFEDSA-N	432.550	1.448	50	20	IDGD	
COc1ccccc1NCC(=O)NN=C(C)c1ccc(S(=O)(=O)NCC(=O)O)cc1	915920749	WRBMLCVUBAMJBV-UHFFFAOYSA-N	434.474	1.010	50	20	IDGD	
CS(=O)(=O)N1CCC(NC(=O)NNC(=O)c2cc3c(s2)CCCCCC3)CC1	916237667	AEDRUQBNCFZCIM-UHFFFAOYSA-N	428.580	1.775	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCCNC(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)cc1	916276693	HHRCIAODXHUBTG-KRWDZBQOSA-N	448.545	1.688	50	20	IDGD	
CC(=NNC(=O)COc1cc(C)cc(C)c1)c1ccc(S(=O)(=O)N2CCNCC2)cc1	916295747	BUHGNPLXUHPEMT-UHFFFAOYSA-N	444.557	1.817	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NC[C@@]1(N2CCOCC2)CCSC1	916636880	NWAOBLGYMAEWGX-KUHUBIRLSA-N	426.514	1.131	50	20	IDGD	
O=C(NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)N[C@@H]1CCN2CCCC[C@@H]12	916638344	FFFTUYGAXKJYER-MSOLQXFVSA-N	435.550	1.042	50	20	IDGD	
O=C(COC(=O)c1cc2cc([N+](=O)[O-])ccc2[nH]1)NNC(=O)[C@H]1COc2ccccc2O1	917329846	ZNXUZVZZKJKKMB-QGZVFWFLSA-N	440.368	1.220	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)NCCC(=O)NC1CCCCC1	918125669	MJZCVFMERVWYKH-UHFFFAOYSA-N	444.580	1.368	50	20	IDGD	
NC(=O)COc1cccc(NC(=O)NNC(=O)c2ccc(F)cc2Br)c1	918202884	PMUIVHRFOKLIHF-UHFFFAOYSA-N	425.214	1.919	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NN=Cc1cscn1)N(S(C)(=O)=O)CC2	918711693	WWLUNEAZTIFARK-HNNXBMFYSA-N	438.531	1.560	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)[C@@H]2CCCN2S(=O)(=O)c2ccc(C)s2)c1O	919756161	YWYPRIWIFCDIHB-ZDUSSCGKSA-N	439.515	1.385	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)N[C@H](C)CN2C[C@H](C)C[C@@H](C)C2)nc1	919923914	BKLKGUHUNGXAFU-BZUAXINKSA-N	426.587	1.761	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)Nc2cccc(CN3C(=O)CNC3=O)c2)cc1C	920930891	UVCGBUTYACXQHT-UHFFFAOYSA-N	425.445	1.587	50	20	IDGD	
CS(=O)(=O)c1ccc(OCCC(=O)NNC(=O)c2cncn2-c2ccccc2)cc1	1251356351	VRUAOLNZQHKOBL-UHFFFAOYSA-N	428.470	1.506	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)NCCCN2CCCCCC2=O)CC1	1318561910	GMGWHIGITLETIS-UHFFFAOYSA-N	439.557	1.757	50	20	IDGD	
CC[C@]1(C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)CCN(C(=O)OC(C)(C)C)C1	1319364874	CUODAKVUTGLYNY-FQEVSTJZSA-N	443.545	1.879	50	20	IDGD	
COc1ccccc1N1CC[C@H](NC(=O)NNC(=O)c2cncn2-c2ccccc2)C1=O	1319571059	CFBXNEAHYHTOFD-INIZCTEOSA-N	434.456	1.630	50	20	IDGD	
C[C@H]1CN(c2ccc(CNC(=O)NNC(=O)c3cncn3-c3ccccc3)cn2)CCO1	1321725332	RSNBAXKLLKUBFA-INIZCTEOSA-N	435.488	1.637	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)c(-c2cccnc2)n1	1321905384	JCUALVQZCBVYGW-UHFFFAOYSA-N	428.493	1.890	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2cc(C(=O)N3CCOCC3)ccc2OC)cc1	1325340354	OHPSRUZZLZKGLY-UHFFFAOYSA-N	428.445	1.643	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NNC(=O)Cn2cc(C(F)(F)F)ccc2=O)C1	1350948554	WEZYBINTDSOJKD-GFCCVEGCSA-N	446.426	1.662	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc3cccnc3[nH]2)C1	1779063832	RUEKHGMMVQQTGL-QLVMHMETSA-N	434.924	1.944	50	20	IDGD	
CCOc1ncc(Cl)cc1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](Cl)COC)CCO2	1779686777	CRYQMKUEWBJELH-DNVCBOLYSA-N	446.331	1.831	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(N(C)C)nc3)C2)C1	1779764576	JRUKNZFDIJIFRW-ACJLOTCBSA-N	425.327	1.375	50	20	IDGD	
CC(C)CC(=O)N1CCO[C@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1	1780970077	RHIULXFEALJEBR-QHCPKHFHSA-N	445.564	1.209	50	20	IDGD	
CCOc1c(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](Cl)CC)C3)C2)cnc2c1cnn2C	1781217447	IPBGAYNGXJYOIH-KKSFZXQISA-N	449.939	1.828	50	20	IDGD	
COC(=O)[C@@H]1CC[C@H](C(=O)N2CCO[C@]3(CCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)C1	1781225580	MZIYVJBTXVDSFO-QABNGEJJSA-N	435.348	1.642	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)C3CCC4(CC3)OCCO4)CCO2)C1	1781231862	GMFZHKDMBKGGCT-OALUTQOASA-N	449.375	1.986	50	20	IDGD	
O=C(c1cnc2ccccc2n1)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781329965	OSWWUDLEQNFCCQ-YJBOKZPZSA-N	437.269	1.764	50	20	IDGD	
O=C(c1cc2ncsc2[nH]1)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781332458	YYPKSFWLPMVZOR-NHYWBVRUSA-N	431.287	1.758	50	20	IDGD	
CC(C)n1cnc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](C)Br)C2)n1	1781999406	XWXVBXIVWNHMDG-PMUMKWKESA-N	442.358	1.770	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cccnc3S)CCO2)C1	1783338638	JQVUHZJCXIOEMX-CXAGYDPISA-N	428.352	1.987	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)/C=N/O[C@H]3CCCCO3)CCO2)C1	1783534418	UGSOMRAPAITVHG-UUVPFUHKSA-N	432.315	1.129	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccnc4ncccc34)CCO2)C1	1783535480	DNSMMHWTZQMMCU-DJJJIMSYSA-N	433.306	1.857	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cccc(F)c3[N+](=O)[O-])CCO2)C1	1783882450	YZYLOYBYMREKQY-ACJLOTCBSA-N	429.832	1.431	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cc3c(s1)CCC3)CCO2	1783936138	GZRAQKWVBVOUOT-NRFANRHFSA-N	434.562	1.053	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnn(C)c3Cl)C[C@@H]21	1783969114	DLWXVXWJKBVXMJ-XWUBHJNHSA-N	447.761	1.698	50	20	IDGD	
Cc1c(C(=O)N2CC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)ccc(F)c1F	1785060853	JEMZHOMARKPOTE-NRFANRHFSA-N	438.475	1.090	50	20	IDGD	
O=C(CCNC(=O)c1ccc[nH]1)NC1(c2ccc(NC(=O)[C@H](O)CCl)cc2)CCC1	1786128993	CNVHKMYLEHCAHW-QGZVFWFLSA-N	432.908	1.868	50	20	IDGD	
CC(C)[C@@H](O)C(=O)Nc1ccc(C2(NC(=O)c3cnccc3C(=O)NN)CCC2)cc1	1786191707	MBPGYLZPYQFIFC-GOSISDBHSA-N	425.489	1.450	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3nc4ccccc4n(C)c3=O)[C@H]2C1	1787975530	LONFNENEYWCQMG-AFIMGQEJSA-N	446.935	1.544	50	20	IDGD	
Cc1cc(C(=O)NC2(c3ccc(NC(=O)c4cnccc4C(=O)NN)cc3)CCC2)n[nH]1	1789520961	BUDWVZLYVPFEKF-UHFFFAOYSA-N	433.472	1.778	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3scnc3C3CC3)C[C@@H]21	1791252079	BJHKPUHLYGEDQK-XQLPTFJDSA-N	427.954	1.868	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccccc3C3CC3)C[C@@H]21	1791293241	PTPHJQBIRMBBBN-YYWHXJBOSA-N	442.560	1.530	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1ccc(C2(NC(=O)c3cc(O)n(C)n3)CCC2)cc1	1791599236	FALDLOIIAANRPK-UHFFFAOYSA-N	428.493	1.246	50	20	IDGD	
CC(C)Oc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](O)CCl)c(F)c1	1792980053	KJVFBAPLDXWDCH-JGTCGTHISA-N	428.888	1.416	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1ON=C(c3ccccc3)O1)C2	1793448295	ADEVEWRPTOTDDU-AHZRMZFZSA-N	435.908	1.718	50	20	IDGD	
O=C([C@@H](F)Br)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C12CC(C(F)(F)F)(C1)C2	1793480612	XLBLEWRZKZPNHC-SLRJVEKRSA-N	443.235	1.999	50	20	IDGD	
CC(C)N1CCC(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCBr)CC1	1795111282	APSXTAVNPOPXFC-ALXJQNPVSA-N	430.387	1.481	50	20	IDGD	
CCc1nn(C)c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCBr)c1Cl	1795111635	ZEVUJHFFEHHHAA-QHBPRCKVSA-N	447.761	1.624	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](NC(C)C)C(C)C	1795718642	KGQLHUQBJZUMMX-QEOTZNIISA-N	432.403	1.772	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1c[nH]c2nccc-2c1Cl	1796224463	HWFXGJGANYEZLE-VAECKANCSA-N	441.315	1.625	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(N2CCOCC2)n1	1797092389	WZQQHJYPYGJYDW-YYIAUSFCSA-N	436.940	1.424	50	20	IDGD	
C[C@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnccc1C(=O)NN)c1cccs1	1798443652	SDPSJTJXOXMTFU-XQLPTFJDSA-N	427.530	1.802	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3ncnn3c1)C2	1799277077	QLZFLVXEFIOGFH-ZFHGCVPZSA-N	426.304	1.169	50	20	IDGD	
Cc1ccccc1NCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Br	1799346472	RKSISNNUUKOAAY-RMHZUWNSSA-N	428.302	1.687	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc([N+](=O)[O-])c(O)cc1C	1799831426	RGZPUXDAQVVXPS-DMVWFOPNSA-N	425.869	1.829	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1c(C)noc1C)C2	1800640466	ZJEKURXOFGPFQE-IARIHHJXSA-N	428.327	1.597	50	20	IDGD	
O=C1CSc2ncc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)C(Cl)Cl)cc2N1	1801016830	VEKCFICWFFRGMP-DDFAGTSDSA-N	445.328	1.133	50	20	IDGD	
O=C(Cn1ccnn1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](Br)Cc1ccccc1	1801567900	OWFATPWHJBOPQN-XMTFNYHQSA-N	446.349	1.923	50	20	IDGD	
CC[C@@H](NC(C)=O)C(=O)NC[C@@H]1CCN(C(=O)[C@H](C)Br)[C@H]1c1cccnc1	1802884889	UNELEOQSWABRPI-SJWGOKEGSA-N	439.354	1.786	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC2(CCN(C(=O)c3cc(O)nc(O)n3)CC2)C1	1805384512	ODYPRLOPYUVWPO-LBPRGKRZSA-N	441.326	1.764	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC2(CCCN(C(=O)CN3CCOC3=O)C2)CC1	1805760278	RYZMIBIZCLYCIJ-AWEZNQCLSA-N	430.343	1.701	50	20	IDGD	
Cc1ccsc1C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1807365549	YLZWZKNHSBRUMD-QUCCMNQESA-N	449.341	1.765	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)CCC2CCC2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1	1807367023	WVMQDSDPQRGMAG-NFBKMPQASA-N	435.333	1.661	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)cc1	1807374954	LPLZKUMXMBPXNT-GGAORHGYSA-N	443.312	1.703	50	20	IDGD	
Cn1ccc(CC(=O)NC[C@H]2CCN(C(=O)CCBr)[C@@H]2c2cccnc2)n1	1807512043	BXIBCCNXNZEJCJ-DNVCBOLYSA-N	434.338	1.849	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2[nH]nc3ccncc23)[C@@H]1c1cccnc1	1808101546	NMXNXVFGCWVKEE-QOKNQOGYSA-N	442.907	1.926	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2cc(C(=O)O)ncn2)[C@@H]1c1cccnc1	1808249948	HPEBRXXLLXIXTE-GRDNDAEWSA-N	431.880	1.907	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2ccncc2F)[C@H]1c1cccnc1	1808887106	UMMOXWPIUCJTNW-IIBYNOLFSA-N	442.495	1.308	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)[C@@H]3[C@H]4C=CS[C@@H]43)CC2)C1	1809980633	YMDAWMHKOJBOKW-QRVBRYPASA-N	426.347	1.086	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)[C@@H]1Cc2ccccc2N1	1812430711	CCIZBOPSYDTFCF-IJXRJRJASA-N	428.920	1.724	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1813067567	AQSCVEQFLKCDBC-ZWOKBUDYSA-N	437.972	1.868	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H](CNC(=O)CSc2nc[nH]n2)[C@H]1c1cccnc1	1813346205	CKVVGIGWYXWATK-CRAIPNDOSA-N	448.625	1.849	50	20	IDGD	
Cn1cc(CC(=O)NC[C@@H]2CCN(C(=O)CCBr)[C@H]2c2cccnc2)cn1	1813455572	GBPPWMIZBPKWAJ-LPHOPBHVSA-N	434.338	1.849	50	20	IDGD	
C[C@@H](CBr)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2c[nH]c(=O)cn2)[nH]n1	1814782296	QRUQNESCJOMMES-GWCFXTLKSA-N	437.298	1.830	50	20	IDGD	
N[C@@H](Cc1cscn1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](O)CCl)n[nH]1	1814869829	CPWKTDWQRSTWTL-UBHSHLNASA-N	426.930	1.028	50	20	IDGD	
CCc1ccnc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)CCC(=O)NN(C)C)CC3)c1	1816055697	CWBBGWUXCFASSW-CQSZACIVSA-N	444.561	1.699	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(O)n(C)n2)n[nH]1	1816125186	VPVIEXMXDRZDHS-JOYOIKCWSA-N	425.287	1.938	50	20	IDGD	
COCCn1nccc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](Cl)COC)[nH]n1	1818251514	OMFZRAKYFYXGEZ-HIFRSBDPSA-N	438.916	1.812	50	20	IDGD	
Cc1cc(/C=C/C(=O)Nc2cc([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)no1	1819473650	CWFLVOHLUZFSRU-IWAYRVGRSA-N	443.508	1.785	50	20	IDGD	
CCc1cc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)no1	1819887556	YBYXGARMEWVRLT-SFHVURJKSA-N	437.265	1.260	50	20	IDGD	
C=CCC(F)(F)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1821986421	UMFFCONUTYIPDG-MRXNPFEDSA-N	432.236	1.607	50	20	IDGD	
Cc1cccc(CC(=O)N2CCCC[C@@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)n1	1824286558	PPRKQWUAQPKMJJ-OAQYLSRUSA-N	443.592	1.925	50	20	IDGD	
CC(C)[C@H](S)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1	1824537658	LTYDZJJWXAZEEL-PMACEKPBSA-N	432.395	1.554	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)[C@H](O)CCl)CC2)n1	1825409095	QQGSDYYNUTYHBF-QZTJIDSGSA-N	436.940	1.873	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCN1CCOC1=O)CC2	1825640029	CUJXBSISNQEJRO-VHSXEESVSA-N	445.339	1.681	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)Cc1cnn(C)c1)CC2	1825646870	FMTPICPOORFFNV-GXSJLCMTSA-N	426.340	1.815	50	20	IDGD	
CCNC(=S)NCC(=O)N[C@H]1CCc2nc(NC(=O)[C@H](C)Br)sc2C1	1825647653	UKWSIKMCDLZKRX-IUCAKERBSA-N	448.412	1.323	50	20	IDGD	
N#CCC(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)[C@@H](F)Cl)C2)C1	1828807461	BHIUPXOZIICKKU-XLIONFOSSA-N	436.871	1.887	50	20	IDGD	
Cc1ccc(F)cc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)Br)C2)C1	1830079605	NLXBFOXOEIRJGY-KUHUBIRLSA-N	443.313	1.988	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2C[C@H](O)CN2)CC1	1830204464	XHUQUYINLDPNPV-YVSFHVDLSA-N	430.387	1.502	50	20	IDGD	
Cn1ncc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)c1Cl	1830364163	AMQACYIPUSPMOV-GOSISDBHSA-N	433.336	1.409	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)C(F)(F)Cl)C2)C1	1830544248	RIXPDWNHTSXLIT-ZWNOBZJWSA-N	433.677	1.305	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3Cc4ccccc4CN3)C2)C1	1831647692	YBHBPFWUXWHXEK-TXTKFYIRSA-N	449.979	1.565	50	20	IDGD	
O=C(CCc1cccc([N+](=O)[O-])c1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1832173524	QIFJECVJZZWVBM-MJGOQNOKSA-N	443.859	1.518	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)Cc3ccc(C#N)cc3)CC2)CC1	1833107950	BNBCJBCAYVBFQI-NRFANRHFSA-N	446.979	1.926	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(N2CCC(NC(=O)C(C)(C)F)CC2)CC1	1834647047	NYUULPXDZRIGBO-CVKSISIWSA-N	448.543	1.440	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCC(N2CCC(NC(=O)c3ccncn3)CC2)CC1	1835146716	ZEUYGCXWRGKNGP-LJQANCHMSA-N	428.364	1.898	50	20	IDGD	
O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)CCc1ccsc1)CCO2	1836004708	NKLDSLKRVURCEF-GOSISDBHSA-N	445.379	1.922	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3cccnc3)CCO2)C1	1836162718	XVIXWZYNEQMILE-APWZRJJASA-N	440.338	1.254	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)/C=N/N3CCCCC3)CCO2)C1	1837445321	PNELIUCGLKYBDU-RCTBGBINSA-N	449.379	1.151	50	20	IDGD	
CCn1nccc1C(=O)N1CCC(OC2CCN(C(=O)[C@H](Cl)COC)CC2)CC1	1837543952	UEKJDUSNDZWSBH-QGZVFWFLSA-N	426.945	1.769	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(Cl)ccn1)CCO2	1837864596	WCYJXSONYDSIHY-LJQANCHMSA-N	441.988	1.657	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3sccc3OC)CCO2)C1	1838299325	HDMGKIAUMRUTCL-ACJLOTCBSA-N	432.926	1.081	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(OC)cc3OC)C2)C1	1839146649	RJWQGGSXYBLMAD-UWJYYQICSA-N	440.924	1.791	50	20	IDGD	
O=C(C#Cc1ccccc1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839199520	PIWRDYACWGAUGX-HKUYNNGSSA-N	439.281	1.185	50	20	IDGD	
C=CCC(F)(F)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H](F)Br)CCO2)C1	1839202669	MLSSTLQMCZDYRN-BXUZGUMPSA-N	429.233	1.345	50	20	IDGD	
C[C@H](Cc1ccncc1)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1839661483	ZBQOPKHCNDMWPL-KUHUBIRLSA-N	430.332	1.520	50	20	IDGD	
CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](Br)Cc1ccccc1)CCO2	1839802426	WXTPHQWNPILQOA-FXAWDEMLSA-N	439.350	1.859	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3CCC=CO3)C2)C1	1839964982	KGLLOZHONLMQNX-HDMKZQKVSA-N	431.327	1.309	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cccc(F)c3)C2)C1	1840032373	WVEGVWDCCOMVTH-AUUYWEPGSA-N	443.313	1.608	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CC(OCC)OCC)CCO2)C1	1840279763	AOSYMRGJXVNUNU-OXQOHEQNSA-N	434.961	1.640	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@]1(F)CCCC=C1F)CCO2	1840950767	AVHAIOXKDGOQCT-GDIGMMSISA-N	436.883	1.442	50	20	IDGD	
O=C(Cc1cccc(Br)c1F)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1	1841348491	UKSPDVGIQFNZPB-CYBMUJFWSA-N	433.705	1.934	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)CCc2c(C)c[nH]c2C)C1	1841441095	BCZLULJUBYUXPH-YZSQISJMSA-N	438.532	1.902	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)[C@@H](CN)c2ccccc2)C1	1842970641	DGJLTDBGKDWEBD-PMFZIYJTSA-N	436.516	1.066	50	20	IDGD	
C[C@@H](C(=O)N1CCCC12CN(C(=O)[C@@H](F)Br)C2)N1CSCSC1	1844318701	DNBJSFZFAKGVOT-WDEREUQCSA-N	426.377	1.923	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)OC)C2	1846360539	RVYNJKDAHPRZHW-KFWWJZLASA-N	447.960	1.372	50	20	IDGD	
CN(CC(=O)N1CC2(CCCN2C(=O)C23CC(C2)C3)C1)NC(=O)NCc1ccccc1	1846736105	KMCLORJUQYTYTJ-UHFFFAOYSA-N	425.533	1.336	50	20	IDGD	
C[C@@H]1[C@H](C(=O)N2CCCC23CN(C(=O)[C@@H](O)CCl)C3)CCN1C(=O)OC(C)(C)C	1847162113	ZQUBUSVONHKKHB-KFWWJZLASA-N	429.945	1.435	50	20	IDGD	
O=C(COC(=O)CSc1ccc([N+](=O)[O-])cc1)NNC(=O)[C@H]1COc2ccccc2O1	9352074	LWZNIZFLASLBIO-MRXNPFEDSA-N	447.425	1.218	50	20	IDGD	
COc1ccc(OC)c(-c2nn(-c3ccccc3)cc2C(=O)NNC(=O)C(=O)NC2CC2)c1	9889384	ZEUYSAMXZIRYQO-UHFFFAOYSA-N	449.467	1.596	50	20	IDGD	
COc1ccc(Cl)cc1N1C[C@@H](C(=O)NNC(=O)COc2ccc(C#N)cc2)CC1=O	15706142	CCRCPQXIZJZNLS-AWEZNQCLSA-N	442.859	1.800	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)Cn2cnc3c(oc4ccccc43)c2=O)cc1	17152239	QNJSNDGLCLRUPP-UHFFFAOYSA-N	434.408	1.456	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)C[C@@](O)(c2nccn2C)C(F)(F)F)c1C	105569938	FMGVDCGCYWSLKP-SCLBCKFNSA-N	428.411	1.792	50	20	IDGD	
CN(CCCc1cc(-c2ccccc2)no1)C(=O)NNC(=O)CNC(=O)c1ccco1	725871275	JCOVDFUYSHDAOR-UHFFFAOYSA-N	425.445	1.970	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)c2cc(S(=O)(=O)N3CCCCC3)cn2C)cc1	728204647	DIRJZIXABUWGCN-UHFFFAOYSA-N	433.534	1.381	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)c2ccccc2NS(C)(=O)=O)c1	728528437	IMVZNPIORYCIFU-UHFFFAOYSA-N	442.291	1.904	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CCNS(=O)(=O)c2c(Cl)cccc2Cl)c1	728869858	GKFUWDJHLXRPRY-UHFFFAOYSA-N	441.296	1.995	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc(F)c(F)c1)NNC(=O)Cn1ccc2ccccc21	729449825	DPVMXQIRRTZFDC-UHFFFAOYSA-N	436.440	1.436	50	20	IDGD	
CCN(CC)[C@@H](C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1)c1ccccc1	729511489	IYBAZQFFHLWJIW-QGZVFWFLSA-N	438.937	1.832	50	20	IDGD	
COCCN(Cc1ccc(F)cc1Cl)C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	730577934	FZMJGRVEWOTTQN-UHFFFAOYSA-N	447.858	1.958	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C1(NC(=O)NCc2ccccc2)CCCC1	730781929	CKYKKBRUPCCEPX-UHFFFAOYSA-N	426.473	1.731	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)CCC(=O)N(CCC#N)c2ccccc2)nc2ccccc21	731223007	CMYSOJYJZYYAAM-UHFFFAOYSA-N	432.484	1.990	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)CCNS(=O)(=O)c1cccc(Cl)c1	732304092	HUXNFXMTGMPDOV-UHFFFAOYSA-N	431.923	1.555	50	20	IDGD	
CS(=O)(=O)NCCc1ccc(C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1	733106446	DINUACKOCZCVOD-UHFFFAOYSA-N	427.486	1.039	50	20	IDGD	
CCCC(=O)N1CCC[C@@H]1C(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	734825222	WDHSPPJOJVAYRQ-OAHLLOKOSA-N	425.530	1.507	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2ccc3ccccc3n2)CC1	735117340	RNTBHAIZUWZQTK-UHFFFAOYSA-N	426.502	1.323	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCC(NC(=O)NNC(=O)CC(C)C)CC2)cc1OC	735517333	CEVVWBAEXGBZJF-UHFFFAOYSA-N	442.538	1.233	50	20	IDGD	
CC(=O)NCC(=O)N1CCc2cc(C(=O)NNC(=S)Nc3ccc(C)c(C)c3)ccc21	735704257	VMXQUEFFNDXDEP-UHFFFAOYSA-N	439.541	1.960	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)CC23CC4CC(CC(C4)C2)C3)nc2c1c(=O)n(C)c(=O)n2C	737469228	GHZJPEQBYRDYKS-UHFFFAOYSA-N	439.516	1.308	50	20	IDGD	
O=C(COC(=O)Cc1csc(-c2ccoc2)n1)NNC(=O)c1cccc([N+](=O)[O-])c1	738847633	XHBZASCADSDXAN-UHFFFAOYSA-N	430.398	1.858	50	20	IDGD	
C[C@@H](C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1)c1cccc(Cl)c1	743419558	MHMMQXBEQQIVFB-CQSZACIVSA-N	437.953	1.918	50	20	IDGD	
C[C@H](Oc1ccc(F)c(F)c1)C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	743737942	LTBGQVVMZWXFSV-NSHDSACASA-N	427.429	1.444	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)COc2ccc3c(c2)CCC(=O)N3)cc1	743829758	DFAGUNBWYGGRPO-UHFFFAOYSA-N	432.458	1.207	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)COc1ccc(Br)cc1)CN1CCN(C)CC1	745860333	PLQCPTWDJYJVEF-AWEZNQCLSA-N	442.358	1.042	50	20	IDGD	
COc1cccc(O[C@@H](C)CNC(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)c1	745882470	ODZOFZQYAYXMRO-AWEZNQCLSA-N	437.522	1.871	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)N[C@@H]2CC(=O)N([C@H]3C[C@@H]3c3ccccc3)C2)cc1	745914359	NBYPHGLRAJTMIO-AHRSYUTCSA-N	438.484	1.561	50	20	IDGD	
COc1ccc(CC(=O)NCc2ccc(C(=O)NNC(=O)N3CCOCC3)cc2)cc1	745996358	UOHFLYKLBWTSOV-UHFFFAOYSA-N	426.473	1.241	50	20	IDGD	
Cc1noc(C)c1S(=O)(=O)NC1(C(=O)NNc2nc(-c3ccncc3)no2)CCCC1	746201921	QPPBCYPNIIBJFZ-UHFFFAOYSA-N	447.477	1.471	50	20	IDGD	
Cc1c(C(=O)NNC(=O)Nc2ccc(OC(F)F)cc2)cnc2c1c(=O)n(C)c(=O)n2C	748085085	MEBNPQULMVCFRL-UHFFFAOYSA-N	448.386	1.009	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)NCCCN1CCN(c2ccncc2)CC1	748466068	UUMCFYINGBRXFO-KRWDZBQOSA-N	444.511	1.531	50	20	IDGD	
COc1ccccc1N1C[C@H](C(=O)NNc2nc(Br)cn3ccnc23)CC1=O	750246971	KGGPZEPPKCVPJB-LLVKDONJSA-N	445.277	1.997	50	20	IDGD	
C[C@H]1C[C@@H](CNC(=O)OC(C)(C)C)CN1C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	752126301	GTZPMMBGRKNTRZ-KBPBESRZSA-N	444.496	1.252	50	20	IDGD	
COCCCOc1cccc(CNC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c1	752208811	MAMQTFBTQPIYGL-UHFFFAOYSA-N	435.502	1.650	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)N[C@H]1CCCN(Cc2ccccn2)C1=O	753290845	RUSSNJYKXNJMLN-KRWDZBQOSA-N	449.471	1.108	50	20	IDGD	
Cc1c(C(=O)NNc2cc(C(F)(F)F)ccc2F)cnc2c1c(=O)n(C)c(=O)n2C	754154115	WIBWEQNIAMLEIV-UHFFFAOYSA-N	425.342	1.855	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)Nc2ccc(S(=O)(=O)N(C)OC)cc2)cc1	755537251	YJPQWHYXOGJYCX-UHFFFAOYSA-N	436.490	1.663	50	20	IDGD	
CN1CCN(C(=O)c2ccccc2NC(=O)NNC(=O)c2cc(Br)c[nH]2)CC1	755622254	IJHRSNPKFCZGNV-UHFFFAOYSA-N	449.309	1.631	50	20	IDGD	
CN(CC(=O)O)c1ccc(C(F)(F)F)cc1C=NNC(=O)CNC(=O)c1cccnc1	755774000	NZBADRCMIRSMSJ-UHFFFAOYSA-N	437.378	1.501	50	20	IDGD	
CCCOC(=O)c1ccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1	755841864	ONBMBMPYKKSUAL-UHFFFAOYSA-N	448.501	1.970	50	20	IDGD	
O=C1CN(c2ccc(NC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)cc2Cl)CCN1	755938583	VECLAQRVAOXKHL-UHFFFAOYSA-N	432.824	1.651	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)Nc2ccc(N3CCN(C(=O)C4CC4)CC3)nc2)cc1	756294299	GLYYCTFXQJXPDN-UHFFFAOYSA-N	433.472	1.478	50	20	IDGD	
NS(=O)(=O)c1cc(F)cc(NC(=O)NNC(=O)c2cc(F)ccc2Br)c1	756517784	ZPFMULXZAZYWHX-UHFFFAOYSA-N	449.233	1.841	50	20	IDGD	
CCOC(=O)[C@H](C)NC(=O)c1ccc(NC(=O)NNC(=O)Cc2cccnc2)cc1F	756817405	HGPZPIQHPJHRLH-LBPRGKRZSA-N	431.424	1.298	50	20	IDGD	
COC(=O)c1cc(NC(=O)NNC(=O)CCc2ccccc2O)cc(S(C)(=O)=O)c1	757674021	NSICGGQETCSCSN-UHFFFAOYSA-N	435.458	1.368	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)c(Cl)n1	757690299	KOABDUQRANGUOY-UHFFFAOYSA-N	441.897	1.525	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)CCC(=O)c2ccc3c(c2)OCCO3)n1	760147789	BUSFEAGCJMONJJ-UHFFFAOYSA-N	447.469	1.119	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2ccnn2Cc2ccc(F)cc2)cc1	760278003	UAJSTNKXMHJIFU-UHFFFAOYSA-N	439.447	1.798	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)NCCc2ccnn2C)cc1	762709413	GYHIGJJPYWIIQL-LGMDPLHJSA-N	447.499	1.433	50	20	IDGD	
CN(C)C1(C(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)CCC1	762965438	XWVLTZBEQVJNPP-UHFFFAOYSA-N	430.530	1.410	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NC2Cc3ccccc3C2)c1	763152793	RZOORUZFWPZKHP-UHFFFAOYSA-N	430.530	1.829	50	20	IDGD	
Cn1nccc1CCNC(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	763170963	ZLTCHQAKOLUAEQ-UHFFFAOYSA-N	445.487	1.309	50	20	IDGD	
CN(C)C(=O)c1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	763441797	JVVSNOKNHGJDFJ-UHFFFAOYSA-N	433.808	1.350	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3ccccc3F)cc2F)C[C@@H](C)O1	763568241	HPGRYIFRLACUQI-BETUJISGSA-N	432.427	1.978	50	20	IDGD	
N#Cc1ccc(OC(F)F)c(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1	763572492	RRFKVEJFANAHKG-OAHLLOKOSA-N	432.339	1.086	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3cc(-c4ccccc4)[nH]n3)cc2)CCO1	763605523	UXSWPVAIPMLQGH-HNNXBMFYSA-N	448.483	1.702	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)N[C@@H]2CCCC[C@@H]2N2CCOCC2)cc1	763656600	OQHQOIQGNFCRQL-SJORKVTESA-N	439.538	1.069	50	20	IDGD	
C[S@](=O)Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)ccc1Cl	763682733	YZLCJALAHDWGKH-PMERELPUSA-N	448.888	1.255	50	20	IDGD	
COC(=O)c1csc(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)c1C	763685490	CBMPOBHFXKVRMT-UHFFFAOYSA-N	425.850	1.661	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(O[C@@H]2CCOC2)cc1	763711414	JKWDBIBRRYUUNZ-GOSISDBHSA-N	427.457	1.582	50	20	IDGD	
COC(=O)[C@@H]1CN(C(=O)C(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)c2ccccc2O1	763726823	BEZKHKMFMQHCHC-KGASDJBWSA-N	441.484	1.317	50	20	IDGD	
Cc1ccccc1NC(=O)C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	763797001	VLZZHQPZFGGQOJ-UHFFFAOYSA-N	430.486	1.179	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(C(N)=O)ccc2-n2cc(C)cn2)cc1	763835376	ZVLFHMVKSVGCIE-UHFFFAOYSA-N	434.456	1.242	50	20	IDGD	
COC(=O)N(C)Cc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)cc1	763839056	YFFIQQNRAMOMIE-UHFFFAOYSA-N	432.408	1.189	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)CCC(=O)N3)cc1	763859657	DOJIKNOWVDXGRH-ZDUSSCGKSA-N	440.456	1.523	50	20	IDGD	
CCOc1cc(F)ccc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccc(C(C)=O)cc1	763877430	JIAGWDZAACDQHO-CYBMUJFWSA-N	431.420	1.980	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2cnc(Cl)c(Br)c2C)n1	763893210	PIZCJKNWGRQLSI-UHFFFAOYSA-N	443.689	1.405	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(F)c(C(N)=O)c2)cc1OC	763912758	SFXIEMDXLYYHTH-UHFFFAOYSA-N	446.435	1.512	50	20	IDGD	
C#CCOc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(OC(C)C)c(OC)c2)cc1	763916667	RCVPNZJHPXWZJJ-UHFFFAOYSA-N	425.441	1.894	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccc(F)cc2)cc1N1CCCCC1=O	763931673	KCCNSDYXLZLDCU-UHFFFAOYSA-N	442.447	1.680	50	20	IDGD	
CC[C@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)cc1	763973923	HKSUOAURDXKCNI-NSHDSACASA-N	432.864	1.974	50	20	IDGD	
CS(=O)(=O)c1ccc(F)c(NC(=O)C(=O)NNC(=O)Cc2cccc3ccccc23)c1	764018844	DBOLHYVTNBMEDX-UHFFFAOYSA-N	443.456	1.711	50	20	IDGD	
O=C(Cc1cccc2ccccc12)NNC(=O)C(=O)Nc1ccc(NC(=O)C2CC2)nc1	764037527	YPISZSYYQJFNGG-UHFFFAOYSA-N	431.452	1.912	50	20	IDGD	
O=C(NNC(=O)c1cccc(Br)c1)C(=O)Nc1ccnn1Cc1ccccn1	764058437	HKMRAKAUKQWOOH-UHFFFAOYSA-N	443.261	1.489	50	20	IDGD	
CN1CCc2ccc(NC(=O)C(=O)NNC(=O)c3cccc(Br)c3)cc2C1=O	764063873	ZIRQCEJCJNJVHP-UHFFFAOYSA-N	445.273	1.477	50	20	IDGD	
O=C(CC(F)(F)F)NNC(=O)C(=O)Nc1ccc(C(=O)NCc2ccccc2F)cc1	764115698	FLQQUKSWDPIGDL-UHFFFAOYSA-N	440.353	1.794	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2ccc(C(=O)N(C)C)c(Cl)c2)cc1	764132719	WPEQPBUZLGLNCN-UHFFFAOYSA-N	446.891	1.769	50	20	IDGD	
C[C@@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)Cc3ccccn3)cc2F)C[C@@H](C)O1	764266795	LLLPAJBRYGPLCI-ZIAGYGMSSA-N	429.452	1.163	50	20	IDGD	
CC(C)(C)c1nc2cc(NC(=O)C(=O)NNC(=O)COc3ccccc3O)ccc2o1	764277140	IIDSAGVBIPPRKP-UHFFFAOYSA-N	426.429	1.996	50	20	IDGD	
COCCNS(=O)(=O)c1c[nH]c(C(=O)NNc2ccc(C#N)c(C(F)(F)F)c2)c1	764324040	HRSQJDTXCDIREU-UHFFFAOYSA-N	431.396	1.587	50	20	IDGD	
CO[C@H](C)C(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)c1	764348996	BLKZKIUJPXPBLS-SNVBAGLBSA-N	434.836	1.419	50	20	IDGD	
CC(C)(C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1	764350313	CEVUKDBYNGYSMD-UHFFFAOYSA-N	448.483	1.800	50	20	IDGD	
COc1nccnc1NNC(=O)CCNS(=O)(=O)c1cccc(Br)c1	764485668	WFUFRUMACNUOBF-UHFFFAOYSA-N	430.284	1.059	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=S)NC1CCOCC1	764519309	PXYAXBCIUKNZKX-UHFFFAOYSA-N	425.986	1.132	50	20	IDGD	
COc1cc(OC)c(C=NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)c(OC)c1	764826990	DYNCJXXMGKCWFC-UHFFFAOYSA-N	440.500	1.621	50	20	IDGD	
CCOC(=O)NNC(=O)C(=O)Nc1cc(Br)cnc1OCC(F)(F)F	765408511	UQYOKPABNIJUDH-UHFFFAOYSA-N	429.149	1.501	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)c3cccc(CN4C(=O)CNC4=O)c3)n[nH]2)c1	765574845	ALQWEQQJWBNZBN-UHFFFAOYSA-N	446.467	1.820	50	20	IDGD	
COc1cc(C(=O)NNC(=O)N[C@H]2CCN(C3CCCCC3)C2=O)cc(OC)c1OC	765631592	SQUUARSANYDQMU-HNNXBMFYSA-N	434.493	1.590	50	20	IDGD	
COc1cccc(CC(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)c1	765759778	WXKMTKSNEFMNGM-UHFFFAOYSA-N	430.936	1.856	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)N[C@H]2CCN(C3CCCCC3)C2=O)cc1	765882385	CJTSNIPQOPLCRZ-INIZCTEOSA-N	437.522	1.359	50	20	IDGD	
CC(C)(C)OC(=O)NCc1cc(C(=O)OCC(=O)NNC(=O)c2ccccc2)ccn1	766227904	YKEBUUFITPTRDN-UHFFFAOYSA-N	428.445	1.724	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1cc(=O)c2ccccc2o1	766644336	UTYRXKVAFTYEDU-UHFFFAOYSA-N	434.452	1.012	50	20	IDGD	
CN(C)Cc1ccc(C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)cc1	766659858	GUEGZEFYHYRAJU-UHFFFAOYSA-N	443.979	1.980	50	20	IDGD	
NC(=O)c1cccc(C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)c1	766661633	YCCFUNDTGHJYMG-UHFFFAOYSA-N	429.908	1.018	50	20	IDGD	
CN(C)CCS(=O)(=O)c1ccccc1C(=O)NNC(=O)c1ccc2ccccc2n1	767163405	LBXMGHVWCTZWTR-UHFFFAOYSA-N	426.498	1.645	50	20	IDGD	
CO[C@@H](CNC(=O)OC(C)(C)C)CC(=O)NNc1nc(O)c2cnn(C(C)(C)C)c2n1	767918641	YBJDNXZSODGRPL-LLVKDONJSA-N	437.501	1.660	50	20	IDGD	
O=C(COc1ccccc1NC(=O)C(=O)NNc1ccc(Cl)nn1)Nc1cccnc1	768224704	ABBUVVBHGFWCFY-UHFFFAOYSA-N	441.835	1.624	50	20	IDGD	
Cn1c(COc2ccccc2)nnc1SCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	768413583	GHYUTFBYDVWNPX-UHFFFAOYSA-N	442.457	1.856	50	20	IDGD	
CCCn1nc(C(=O)NNS(=O)(=O)c2cc(Cl)cnc2N)c2ccccc2c1=O	768846780	BAHLFJYLPIJZCO-UHFFFAOYSA-N	436.881	1.060	50	20	IDGD	
CNS(=O)(=O)c1ccc(NC(=O)NNc2c(OC)cccc2S(C)(=O)=O)cc1	769242201	TUAQLAWJOSFNBL-UHFFFAOYSA-N	428.492	1.155	50	20	IDGD	
Cc1nc(C(C)(C)c2ccccc2)sc1C(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1	769719385	HWSJFXCLGVWIPE-AWEZNQCLSA-N	436.559	1.909	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@H]2CCO[C@H](C)C2)c1	771434703	QUEAPNLFYXVSDV-CABCVRRESA-N	426.539	1.476	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	771888287	LOGFBJNYCCJVRJ-CQSZACIVSA-N	425.507	1.210	50	20	IDGD	
C[C@H]1C[C@H](NC(=O)NNC(=O)Cc2cn3ccccc3n2)CCN1C(=O)OC(C)(C)C	772465589	WIYZIWKHQOQQAX-LSDHHAIUSA-N	430.509	1.995	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H]2[C@@H]3c4ccccc4CC[C@H]32)c1	772631117	QZCKUFJJBYINIQ-GUDVDZBRSA-N	428.514	1.609	50	20	IDGD	
CC(C)[C@@H](C(=O)NNC(=O)NCc1cccc(C(F)(F)F)c1)N1CCCS1(=O)=O	772693092	WAXVEURERGKHAN-AWEZNQCLSA-N	436.456	1.596	50	20	IDGD	
O=C(NNC(=O)c1cccc(OC(F)F)c1)Nc1ccc(C[C@@H]2NC(=O)NC2=O)cc1	775708596	PKYVRMSUAYZHOF-AWEZNQCLSA-N	433.371	1.505	50	20	IDGD	
COCCO[C@@H]1COCC[C@H]1NC(=O)NNC(=O)c1ccc(OC)c(Br)c1	776876173	AQCMATHRQYQAEV-UKRRQHHQSA-N	446.298	1.222	50	20	IDGD	
CC(=O)c1ccc(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)c(F)c1	777426045	SONQCQFXAMUOKN-UHFFFAOYSA-N	434.493	1.721	50	20	IDGD	
CCCCn1c(N)c(N(CC(=O)NNC(=O)c2cccs2)CC(C)C)c(O)nc1=O	777604239	DUCDHNYOTMQJRC-UHFFFAOYSA-N	436.538	1.316	50	20	IDGD	
O=C(c1sccc1Br)N1CCN(S(=O)(=O)CBr)CC1	777777889	RMOPYWCKPZAIDM-UHFFFAOYSA-N	432.159	1.951	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(OCC(F)(F)F)nc1)c1cc([N+](=O)[O-])ccc1O	777934963	APNUIFOFNNECBQ-UHFFFAOYSA-N	436.324	1.260	50	20	IDGD	
Cc1cc(S(=O)(=O)NNC(=O)CNC(=O)OC(C)(C)C)c(C)cc1Br	777938891	HWGVNGCXGBBEMG-UHFFFAOYSA-N	436.328	1.900	50	20	IDGD	
CCC(CC)[C@@H]1C[C@H](NC(=O)NNC(=O)c2csc(N3CCOCC3)n2)CCO1	778587670	BDGPDBJJVZTLRD-ZBFHGGJFSA-N	425.555	1.908	50	20	IDGD	
COCCN1C(=O)CCc2cc(NC(=O)C(=O)NNc3ccccc3[N+](=O)[O-])ccc21	778724069	MNSNCPTWSCJMLI-UHFFFAOYSA-N	427.417	1.602	50	20	IDGD	
C=CC[C@@H](C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1)c1ccccc1	779380612	XESBPDTUAVCYDV-GOSISDBHSA-N	429.546	1.821	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)[C@H]2C[C@]23CCN(C(=O)OC(C)(C)C)C3)c1	781288688	XFDOULZPDHRJJL-ZHRRBRCNSA-N	431.489	1.946	50	20	IDGD	
Cn1ncc(NC(=O)C(=O)NNC(=O)c2ccccc2Br)c1C(F)(F)F	782121499	PAYFMTKLMLPCTR-UHFFFAOYSA-N	434.172	1.601	50	20	IDGD	
O=C(CN1CCC[C@@H](n2ccc(C(F)(F)F)n2)C1)NNC(=O)c1cccc([N+](=O)[O-])c1	782535040	CJVQNJKQDVHOAZ-CQSZACIVSA-N	440.382	1.908	50	20	IDGD	
Cn1ccc(CC(=O)NNC(=O)c2cccc(S(=O)(=O)Nc3ccccc3Cl)c2)n1	782548602	HLNNGMAOWYYUOC-UHFFFAOYSA-N	447.904	1.878	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(NC(=O)C(=O)NNc2ccc(Br)cc2)c1	783010161	YHHKDVHCWBWKAJ-UHFFFAOYSA-N	441.307	1.781	50	20	IDGD	
O=C(NNc1ncccc1C(F)(F)F)C(=O)Nc1ccc(N2CCCS2(=O)=O)cc1	783118669	SKDIJBBHDAXYHK-UHFFFAOYSA-N	443.407	1.722	50	20	IDGD	
CCOC(=O)[C@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNc2ccc(C)cc2)cc1F	783348460	JFVZYEWUBRYSGT-ZDUSSCGKSA-N	430.436	1.897	50	20	IDGD	
CNS(=O)(=O)c1ccc2c(c1)N(C(=O)C(=O)NNc1cc(Cl)ccc1Cl)CC2	783368027	ODYFAMBNJRHKEU-UHFFFAOYSA-N	443.312	1.934	50	20	IDGD	
Cn1nc(C2CCCC2)cc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	784210587	WWXOVMDYZPPBGS-UHFFFAOYSA-N	446.533	1.600	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NC[C@@H]2CCCCS2(=O)=O)cc1Br	784319672	MPGQQZLSLREJBX-NSHDSACASA-N	434.312	1.369	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2nccnc2Cl)cc1S(=O)(=O)NC(C)(C)C	784776644	PWSQONZLFOMYCH-UHFFFAOYSA-N	440.913	1.597	50	20	IDGD	
CS(=O)(=O)c1ccc(Cl)c(NC(=O)C(=O)NNc2ccc(Br)nc2)c1	784807345	ZZRAFFYARLYZMV-UHFFFAOYSA-N	447.698	1.983	50	20	IDGD	
COCCS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccc(F)c(F)c2F)cc1	784814527	XVSLCTMVUSWUOK-UHFFFAOYSA-N	431.392	1.606	50	20	IDGD	
O=C(NNc1ccnc(F)c1)C(=O)Nc1ccc(S(=O)(=O)NC2=NCCCCC2)cc1	784846706	GLNANVMZXVENSO-UHFFFAOYSA-N	448.480	1.553	50	20	IDGD	
CN(C1CC1)S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2cc(F)c(F)cc2F)cc1	784891223	JNFVNRUQIYRZGY-UHFFFAOYSA-N	442.419	1.969	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(F)c(NC(=O)C(=O)NNc2cc(F)c(F)cc2F)c1	784891786	DHPGIKKGOPXXDU-UHFFFAOYSA-N	434.371	1.575	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2cccc(N3CCNC3=O)c2C)c2ccccc2c1=O	786336662	IALQUWSIIINJPK-UHFFFAOYSA-N	449.471	1.721	50	20	IDGD	
Cn1cc(-c2ncccc2NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)on2)cn1	786417144	MHWHVKXQYCCTHN-UHFFFAOYSA-N	431.412	1.537	50	20	IDGD	
NC(=O)c1ncn2c(C(=O)NNc3nnc(-c4ccccn4)s3)cc(-c3ccco3)nc12	788561435	GAGYZPHIEJLZJT-UHFFFAOYSA-N	447.440	1.759	50	20	IDGD	
O=C(CCCc1cccs1)NNC(=O)C(=O)Nc1cccc(N2C(=O)CCCC2=O)c1	792356420	PEQLNXHSECQYLE-UHFFFAOYSA-N	442.497	1.900	50	20	IDGD	
CCS(=O)(=O)c1ccc([C@H](C)NCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1	792950193	PIBSKACGLMJVKQ-ZDUSSCGKSA-N	434.474	1.500	50	20	IDGD	
CC(C)(C)OC(=O)NCCc1nc(C(=O)NNC(=O)COc2ccccc2O)cs1	793462411	VRSXDCHWYHTJSJ-UHFFFAOYSA-N	436.490	1.756	50	20	IDGD	
Cc1nn(Cc2ccccc2)c(N)c1C(=O)NNC(=O)c1csc(N2CCOCC2)n1	794782623	ZFQSWIRUYQVKGW-UHFFFAOYSA-N	441.517	1.190	50	20	IDGD	
CCNC(=O)N(C)c1cccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)c1	796989928	MLLHVSKIIUNLHU-ZDUSSCGKSA-N	445.451	1.545	50	20	IDGD	
N#Cc1ccc(S(=O)(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)s1	797815743	XOHQVSNBSAUPHH-UHFFFAOYSA-N	440.528	1.028	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CCNC(=O)N2CCc3ccccc3C2)cc1C	798309038	UJKBQLZRSNBNGU-UHFFFAOYSA-N	437.500	1.547	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)cc1N1CCNC1=O	798310750	VHNREWYJLJOCOT-UHFFFAOYSA-N	425.445	1.241	50	20	IDGD	
CCc1cccc(C)c1NNC(=O)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C)COC)cc1	799844019	HXUAWAUOPMSGTN-OAHLLOKOSA-N	448.545	1.952	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)N[C@@H](Cn1ccccc1=O)c1ccccc1	800762109	BIOZNBLJFZGICK-SFHVURJKSA-N	444.451	1.883	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@@H]2CCN(c3ccc(F)cc3)C2=O)cc1	802066831	BAJCJXMCSPMTGR-INIZCTEOSA-N	434.449	1.435	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)CCCc2ccc3nc(O)[nH]c3c2)cc1	802067210	PSTUNLDNCOWCAV-UHFFFAOYSA-N	431.474	1.848	50	20	IDGD	
O=C(CNC(=O)c1cccc(Br)c1)NNC(=O)Nc1ccc2c(c1)OCO2	802097148	OMQOPFBMSQFGBK-UHFFFAOYSA-N	435.234	1.761	50	20	IDGD	
COc1ccc(C2=NO[C@H](CNC(=O)NNC(=O)CNC(=O)c3cccs3)C2)cc1C	802356458	PESRADBRCFBMHJ-AWEZNQCLSA-N	445.501	1.319	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)NCCNS(=O)(=O)c1cccc(Cl)c1Cl	805070937	KXJAFNRXNXWPBY-UHFFFAOYSA-N	446.316	1.240	50	20	IDGD	
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC[C@@H](C(=O)NNc2nccnc2C2CCC2)C1	805468897	JDWSCAYOVDWBAL-OAHLLOKOSA-N	433.538	1.628	50	20	IDGD	
N#CCCn1cc(/C=C(\C#N)C(=O)OCCn2cc(C(N)=O)nn2)c(-c2ccccc2)n1	805943403	XDGQKQIHKCQRCO-LFIBNONCSA-N	430.428	1.305	50	20	IDGD	
CCOC(=O)C(C)(C)c1csc(NC(=O)NNC(=O)c2cncc(NC(C)=O)c2)n1	806821712	PMPDZISGJWXJJB-UHFFFAOYSA-N	434.478	1.804	50	20	IDGD	
Cc1ccc([C@@H](CNC(=O)NNC(=O)c2cc(Br)c[nH]2)N2CCOCC2)o1	807023777	SXBKGERZXOVLNB-CQSZACIVSA-N	440.298	1.696	50	20	IDGD	
CCN(C)C(=O)c1cccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)c1	807065653	NOJIEKOORRGAJY-ZDUSSCGKSA-N	446.891	1.985	50	20	IDGD	
CN(C)C(=O)CN1[C@H]2CC[C@H]1CC(NC(=O)NNC(=O)c1ccc(Cl)cc1F)C2	807513535	ARYKCSACIYQUIB-KBPBESRZSA-N	425.892	1.507	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)NCc2ccncc2OC[C@H]2CCOC2)cc1C	807616189	PMAUFXLKLLIXHX-INIZCTEOSA-N	441.488	1.583	50	20	IDGD	
CCS(=O)(=O)N1CCC([C@@H](C)N(C)CC(=O)NNC(=O)c2ccccc2Cl)CC1	808776119	QAUDIKVPBPSONF-CQSZACIVSA-N	444.985	1.483	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)OCC(=O)Nc2cccc(S(C)(=O)=O)c2)cc(C#N)n1C	809303298	KYLKPSHFDBKDHA-CHHVJCJISA-N	426.454	1.698	50	20	IDGD	
COC(=O)C(C)(C)c1csc(NC(=O)C(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)n1	815565685	XBPNDXHFSPLPFH-UHFFFAOYSA-N	448.545	1.896	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2ccc3c(c2)N(C(=O)Cc2ccccc2)CC3)ncn1	815593283	HXVAPFGWIUHXQM-UHFFFAOYSA-N	430.468	1.999	50	20	IDGD	
COc1ccc(Cl)cc1NC(=O)C(=O)NNc1ccccc1S(=O)(=O)N(C)C	815752061	ALBAKIWBKWHSJZ-UHFFFAOYSA-N	426.882	1.681	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)[C@@H](CS(C)(=O)=O)c2ccccc2)cc1	816817433	BQXOALJOYNFPGQ-KXBFYZLASA-N	434.514	1.828	50	20	IDGD	
CSC[C@@H](C(=O)NNC(=O)COc1cc(C)ccc1C)N1C(=O)[C@H]2CCCC[C@H]2C1=O	864002813	QLMJSTMGQRHUML-BBWFWOEESA-N	447.557	1.736	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)[C@H]2CS[C@H](Cc3ccccc3F)C(=O)N2)c1	888346192	BFHTVWMUABJAKU-RTBURBONSA-N	445.516	1.812	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(C)on2)c1	913125547	RACKXUFFRJJTOJ-UHFFFAOYSA-N	430.442	1.867	50	20	IDGD	
CC(C)c1ccc(-n2cnnc2SCC(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)cc1	913181174	FDVDRWHOEDKICX-AWEZNQCLSA-N	437.547	1.065	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)[C@@H](Cc2cccc(F)c2)n2nnnc2C)cc1OC	915690121	ISIILHCSCOAXHR-QGZVFWFLSA-N	442.451	1.773	50	20	IDGD	
O=C(NC[C@H]1CC1(Cl)Cl)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	915907640	AYGLKPLDSOELMQ-GFCCVEGCSA-N	435.333	1.609	50	20	IDGD	
COC(=O)CCOc1ccc(S(=O)(=O)NNC(=O)c2ccc(OC)c(OC)c2)cc1	917717363	DRCAGNLTPJBMKQ-UHFFFAOYSA-N	438.458	1.269	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)NCc2cccc(CN3CCOCC3)c2)cc1C	918224297	REIHRRYWXDUQBQ-UHFFFAOYSA-N	439.516	1.605	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)CS(=O)(=O)Cc2cccc(Br)c2)n1	919838846	NQBNUBAOYVVVSE-UHFFFAOYSA-N	443.323	1.025	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCc2ccccc2-n2ccnc2)nc1	919920558	AHEZNSWRQBZIOH-UHFFFAOYSA-N	429.506	1.780	50	20	IDGD	
C[C@@H](NC(=O)OCc1ccccc1)C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	920213942	SWGBYWGNOZLQQA-CQSZACIVSA-N	448.501	1.013	50	20	IDGD	
C[C@H]1CN(Cc2cccc(CNC(=O)NNC(=O)COc3ccc(C#N)cc3)c2)CCO1	920238369	WBOIZVOQTUFABR-KRWDZBQOSA-N	437.500	1.688	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)c2cccn(Cc3ccccc3)c2=O)c2ccccc2c1=O	920425003	OIHNTNRUUQMDLK-UHFFFAOYSA-N	429.436	1.218	50	20	IDGD	
CCOC(=O)c1ccc(N2CC(NC(=O)NNC(=O)c3cncn3-c3ccccc3)C2)nc1	1116550835	JDWPJMNPLAEWMW-UHFFFAOYSA-N	449.471	1.277	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCc2nc([C@H]3CCS(=O)(=O)C3)no2)N(C)c2ccccc21	1116606976	XTRLNYUCBLVREF-ZDUSSCGKSA-N	427.486	1.795	50	20	IDGD	
COC(=O)c1cc(C(=O)NNc2ccccc2S(=O)(=O)N(C)C)n(-c2ccccc2)n1	1324392210	BKCQULLXEQTDNI-UHFFFAOYSA-N	443.485	1.666	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@]2(CN(C(=O)COc3ccccc3C#N)CCO2)C1	1779299984	LLKWWDKJWSWDCO-OAQYLSRUSA-N	431.565	1.618	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2)c1cc2cccnc2nc1O	1781249722	QFHNTRNHDSDXSP-GCKMJXCFSA-N	448.907	1.063	50	20	IDGD	
CCOc1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](F)Br)C3)C2)nn1	1781333250	FIBXVDAUDQMQIS-XJKSGUPXSA-N	431.262	1.009	50	20	IDGD	
CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Cl)CCO2	1782049620	MRXNXHVVKAYESY-CRAIPNDOSA-N	428.848	1.639	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4ccnn4c3)C2)C1	1782405824	GUSPOTXFCBMAAA-IFXJQAMLSA-N	435.322	1.809	50	20	IDGD	
CCC[C@@H](NC(C)=O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)Br)C2	1783190867	UKLSADRRZRXOAL-NVQRDWNXSA-N	446.386	1.589	50	20	IDGD	
C[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CC[C@@]2(CN(C(=O)[C@H](F)Cl)CCO2)C1	1783508691	CKGKNFPXTDAYCS-IIMJZQEZSA-N	441.887	1.666	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)C3CCN(c4ccccc4)CC3)CCO2)C1	1783870897	JFSLOZWISKQZSB-REWPJTCUSA-N	449.979	1.987	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)C#Cc3ccc(Cl)cc3)CCO2)C1	1783871796	VVONZZVAKNVSMW-XLIONFOSSA-N	425.312	1.775	50	20	IDGD	
CCc1nc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]3C2)co1	1783970145	NTVZPQLZVXXTQW-OSFYFWSMSA-N	428.327	1.861	50	20	IDGD	
C=CCOCCCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)CBr)C[C@@H]21	1784486705	JOCFDBHEDXOTBU-QZWWFDLISA-N	431.371	1.980	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3ncccc3OC)[C@H]2C1	1785247671	GWBURCJYYJYELO-GGXPGOJBSA-N	439.940	1.256	50	20	IDGD	
CC(C)(C)OC(=O)N1CC=C(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](F)Cl)CCO3)CC1	1785319330	UKPXZQIBCSRQSQ-MGPUTAFESA-N	445.919	1.918	50	20	IDGD	
Cc1cc(/C=C/C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCBr)[C@H]3C2)no1	1786406141	KQIFZXSCAFVZLX-PFUQRVJESA-N	426.311	1.761	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)c1ccc2c(c1)OCO2	1787807668	ZCNLUEJZUUDIEH-GVAFMPQTSA-N	443.269	1.699	50	20	IDGD	
CC(=O)O[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)CBr)C[C@@H]21)C(C)C	1788477288	QQSZIQFDQCDPLB-SRQBIAJPSA-N	447.370	1.585	50	20	IDGD	
CC#CC[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)c1ccccc1	1788704976	KVIHSPXQDWYBDK-SXYSDOLCSA-N	432.948	1.763	50	20	IDGD	
C[C@H](Nc1cccnc1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]2C1	1789923106	YJTQBRSPZXHLSH-YERCRUGSSA-N	443.317	1.552	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3C[C@@H]3F)[C@H]2C1	1790728938	YCYRXAVQSFOAMP-QNILMXGZSA-N	447.935	1.456	50	20	IDGD	
CCCC(=O)N[C@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](Br)CC)[C@H]2C1	1790961122	WZRNCNNFAXXFLK-YXMSTPNBSA-N	446.386	1.444	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cc(F)ccc3OC)C[C@@H]21	1791257379	CCXDBHALPOJVIP-UHEFJODHSA-N	442.915	1.610	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1ccc(C2(NC(=O)/C=C\C(=O)NC3CC3)CCC2)cc1	1791601201	VGVLNFKXDGUUSQ-BENRWUELSA-N	441.532	1.328	50	20	IDGD	
COc1ccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)Br)C3)cc1O	1792730316	MSHCEKKGERVSAL-NASWQRNTSA-N	441.322	1.316	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1(c3ccc(F)c(F)c3)CC1)C2)[C@@H](O)CCl	1792979102	UKSOFPPWACQGMD-LZDSYCOUSA-N	428.863	1.186	50	20	IDGD	
CC(=O)N[C@@](C)(C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCl)c1ccccc1F	1793115144	AHWCJKAXBDROCP-ZLFLNXGQSA-N	439.915	1.415	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCc1nnc(C)s1	1794109779	FYQYPIPVBWSIIO-ZWUHOBOKSA-N	445.383	1.542	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1CCC(=O)N1	1795821276	LAQHWSPTYBCCKK-KHMAMNHCSA-N	442.944	1.035	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1	1796439474	GWBDJQQZKFVDFZ-BCMCZCDPSA-N	437.928	1.118	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2)c1nnc(-c2ccccc2)o1	1797819946	HGEPNOLAGREZTD-MIFYACCESA-N	449.305	1.725	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(C)(C)n1nc(C)ccc1=O	1797910944	HNJVCYFSMDTYQG-KYHPRHEASA-N	438.956	1.284	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1c(F)cccc1F	1798985162	AAHYJLDRMGNDDY-YXPOGWMNSA-N	431.277	1.880	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1(c3ccc(O)cc3)CC1)C2)[C@H](F)Br	1799343096	MVEGSAGNCTYVJK-VZAMPYOESA-N	441.297	1.704	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1n[nH]c3ccc(F)cc13)C2)[C@H](F)Br	1799349516	HSCUSGSCUVARRS-YPSFTXJRSA-N	443.248	1.596	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2cccnn2c1	1800010097	IAMANRVSDQYUCL-FSDCSDTHSA-N	435.322	1.711	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1CCOCC1)C2	1800332558	OUTMSPIDLYNBCM-QKWTUQEISA-N	445.466	1.888	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc[nH]c3nccc1-3)C2	1800639810	NPDYJWZLQOGIFD-NOXHYTERSA-N	435.322	1.891	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c(C)nc3sccn13)C2	1800976730	FTJGOWARAAXUIK-XJFOESAGSA-N	426.926	1.161	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCS(=O)(=O)c1ccccc1)C2)C(Cl)Cl	1801016116	RVHCMECMQFXFIW-YWVIFJGQSA-N	449.356	1.244	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2)c1ccc(CO)c(F)c1	1801899118	BDSSAMFUIDJJJS-XOIINTDNSA-N	429.286	1.306	50	20	IDGD	
C[C@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnc3c(c1)CCNCC3)C2	1801967156	ZUCWCVPGKKXEGG-SJWGOKEGSA-N	435.366	1.805	50	20	IDGD	
CN(C)C(=O)NCC(=O)NC[C@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1	1802675680	SVWDGQVQQCAJSQ-RHSMWYFYSA-N	440.342	1.144	50	20	IDGD	
CC(=O)NCC(=O)N1CC[C@H](CNC(=O)[C@H](C)CBr)[C@H]1c1cccnc1	1803014542	FXAUYSWBXGSMNV-SRCQZFHVSA-N	425.327	1.255	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCC2(CCCN(C(=O)CCN3C(=O)C=CC3=O)C2)CC1	1806385838	VQAWTMLUSSJRIL-IBGZPJMESA-N	444.359	1.769	50	20	IDGD	
Cc1cccnc1CCC(=O)N1CCCC2(CCN(C(=O)CCC(=O)NN(C)C)CC2)C1	1806920786	ZNMJADYTAUQUOT-UHFFFAOYSA-N	443.592	1.927	50	20	IDGD	
N[C@H](C(=O)NC[C@@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1)c1ccccn1	1807161520	GARITWYLNWZPGZ-ZYSHUDEJSA-N	446.349	1.967	50	20	IDGD	
Cc1nc(C(=O)N2CCCC3(CCN(C(=O)c4cccc(B(O)O)c4)CC3)C2)ccc1F	1807542774	HSHRIMOCTSMPRV-UHFFFAOYSA-N	439.296	1.368	50	20	IDGD	
O=C(Cc1ccsc1)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1807559799	QOUMKQYOEYINNG-UGKGYDQZSA-N	449.341	1.385	50	20	IDGD	
O=C(NCC(=O)N1CC[C@H](CNC(=O)[C@@H](F)Cl)[C@@H]1c1cccnc1)c1cccnc1	1808308325	JCQVUIHVAJRLFD-FHLIZLRMSA-N	433.871	1.447	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)c1ccc2nc[nH]c2c1	1809815732	FVDOHDGNRHNTIY-SNRMKQJTSA-N	427.892	1.877	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)c1cc2cccnc2[nH]1	1809895319	FTVQPOPHDNGZAV-RYQLBKOJSA-N	427.892	1.877	50	20	IDGD	
O=C(CC[C@@H]1CCOC1)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1	1809977699	HTORPRFYPZGRMF-GOSISDBHSA-N	428.338	1.028	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)C(Cl)Cl)[C@@H]1c1cccnc1)C(=O)Nc1cccnc1	1810465604	ORWLSMZSFFQKAU-UKRRQHHQSA-N	436.299	1.925	50	20	IDGD	
Cc1cccc(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)c1	1811862395	MGJQLRFOOZBHNC-GMAHTHKFSA-N	443.312	1.703	50	20	IDGD	
CCNC(=S)NCC(=O)NC[C@H]1CCN(C(=O)C(C)(C)CCl)[C@@H]1c1cccnc1	1812327986	CIJJUEHUOHCGMX-NVXWUHKLSA-N	440.013	1.836	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)[C@@H](C)S)[C@H]1c1cccnc1	1813036924	MYINBRJVXADFRM-JGJDIOJQSA-N	442.545	1.540	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)CNC(=O)C(F)(F)F)[C@@H]1c1cccnc1	1813099825	IWPBAKVLYYJNIL-YDHLFZDLSA-N	434.846	1.783	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)COc2cccnn2)[C@H]1c1cccnc1	1813391433	MPGMTBSNIXSQRM-JCKWVBRZSA-N	448.321	1.740	50	20	IDGD	
O=C(NCC(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](O)CCl)n[nH]1)c1cccs1	1814867442	LDFPDOOIZMXJPC-QWHCGFSZSA-N	439.925	1.493	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@H]1c1cc(NC(=O)C2=NN(C)C(=O)CC2)n[nH]1	1815626265	XMSXLVGNZCHTCM-GWCFXTLKSA-N	439.314	1.793	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)Cn3ccnn3)sc2C1	1815783019	NTQIVQKXSTWABN-NXEZZACHSA-N	427.328	1.520	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)C2(C#N)CC2)n[nH]1	1817109081	DZSQZXGVXDFQLS-WJNWYLSZSA-N	436.476	1.840	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)COC(C)C)[nH]n1	1818110334	AHPJEHISDNHZTD-ZZQPOVDQSA-N	443.508	1.961	50	20	IDGD	
COC[C@@H](NC(C)=O)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CO[Si](C)(C)C)[nH]n1	1819611081	VAPLWPAWTTWNDU-CVEARBPZSA-N	439.589	1.404	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CNC(=O)c2ccco2)[nH]n1	1822368524	JBTJKVHMEHEFJJ-JSGCOSHPSA-N	437.884	1.679	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)C(F)(F)C(F)F)[nH]n1	1822410989	UYAPQYSAQIOHBR-NSHDSACASA-N	436.410	1.675	50	20	IDGD	
CC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](C)[C@@H]1SC(=N)NC1=O)CC2	1822846031	VQMXDOFAZDATRD-XBWDGYHZSA-N	443.982	1.875	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC([C@@H]2CCCCN2C(=O)CN2CC(=O)NC2=O)CC1	1824972042	MNEIUQOPOKDEKK-INIZCTEOSA-N	438.601	1.009	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)CCc2ccco2)CC1	1825247128	ZJQHZHKGVXWUQX-QFIPXVFZSA-N	438.333	1.826	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(F)cn2)CC1	1826138444	IGVPDRKGAHFIFX-NRFANRHFSA-N	439.296	1.448	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)CNCP(=O)(O)O)CC1	1826800745	IOQWWYXUZSMWAL-HZPDHXFCSA-N	437.905	1.738	50	20	IDGD	
O=C([C@@H](O)CCl)N1CCC([C@H]2CCCCN2C(=O)c2ccc3c(n2)OCCO3)CC1	1827531922	STBALJNLQDBGJQ-SJORKVTESA-N	437.924	1.686	50	20	IDGD	
Cc1cccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)c1F	1830101951	YYGFLUKHSJXUJS-CRAIPNDOSA-N	447.276	1.895	50	20	IDGD	
C=CCOCCCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)CBr)C2)C1	1831404401	MRPRUPRMCHKTKH-VQIMIIECSA-N	447.370	1.457	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)C3=CCCS3)CCO2)C1	1831544021	GGPSHRNZMQTWDE-SUMWQHHRSA-N	433.368	1.495	50	20	IDGD	
COc1cnc(C(=O)N2CCC([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)cn1	1831871388	CJUJLOBDCDJIBS-GOSISDBHSA-N	446.552	1.092	50	20	IDGD	
COc1cccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)n1	1832759223	JTIXCFUNXVTSPJ-NRFANRHFSA-N	439.940	1.354	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)C(C)(C)C)CC2)CC1	1833286885	IZJLMVIKCMCKIT-XJKSGUPXSA-N	432.403	1.748	50	20	IDGD	
Cc1nc(C(=O)N2CCC(N3CCC(NC(=O)[C@@H](O)CCl)CC3)CC2)ccc1F	1833308295	QEFXKRZPTXCVGZ-SFHVURJKSA-N	426.920	1.314	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)[C@H]1CCc2ccoc2C1	1833362383	MVRCTZYMNQWUQP-LPHOPBHVSA-N	437.968	1.556	50	20	IDGD	
Nc1nc(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](F)Br)CC3)CC2)cs1	1834751538	SQAUSXPGEUGOKJ-CYBMUJFWSA-N	448.362	1.601	50	20	IDGD	
O=C(/C=C/c1cccs1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1835966215	MPGOLCKDGNRPFW-PIXXYMSQSA-N	447.326	1.908	50	20	IDGD	
COc1ccc(C(=O)N2CCC(OC3CCN(C(=O)[C@H](O)CCl)CC3)CC2)cn1	1836713875	NAZXYFSSXLEFEC-QGZVFWFLSA-N	425.913	1.302	50	20	IDGD	
O=C([C@H](O)CCl)N1CCC(OC2CCN(C(=O)[C@@H]3CCc4nc[nH]c4C3)CC2)CC1	1836720352	RDNLHOGXSLHNBV-AUUYWEPGSA-N	438.956	1.113	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)Cc3ncccn3)CC2)CC1	1837212638	YHZKUFFUWVBLKJ-AWEZNQCLSA-N	439.354	1.801	50	20	IDGD	
C=C[C@H](O)C(C)(C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](Br)CC)C2)C1	1837403394	SIFBBNPXLGWOKL-VCBZYWHSSA-N	447.370	1.189	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1837714841	PRVGPLHZKLPKGF-IRXDYDNUSA-N	441.428	1.531	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3Cc4ccccc4N3)C2)C1	1837715731	GWEGKQSZEHXOJC-SIKLNZKXSA-N	447.608	1.331	50	20	IDGD	
C[C@]1(C(=O)N2CCC(OC3CCN(C(=O)CO[Si](C)(C)C)CC3)CC2)CCCN1	1838430454	CUKXNEABOSUTQN-OAQYLSRUSA-N	425.646	1.979	50	20	IDGD	
COc1ccc(C(=O)N2CCC(OC3CCN(C(=O)C(Cl)Cl)CC3)CC2)nn1	1838512958	UUZHYSZDUJKPKJ-UHFFFAOYSA-N	431.320	1.901	50	20	IDGD	
CC(C)n1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)n1	1838780594	JWJKRVVOPUUGSZ-HXUWFJFHSA-N	426.945	1.799	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccccc3)CCO2)C1	1838849090	ROXKRWWIWGTURJ-BEFAXECRSA-N	425.323	1.788	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(Cl)nc(OC)c3)C2)C1	1839145928	ICGSKBJEOMCFEA-KUHUBIRLSA-N	446.331	1.831	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)ccc1O	1839310251	FPLABBSEURCVHD-MAUKXSAKSA-N	445.285	1.461	50	20	IDGD	
N#CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)CCO2	1839743468	SMRROZMLXFJCKX-JUALLIRVSA-N	430.411	1.242	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CN3CCCCC3)C2)C1	1839963201	DEHBTMKFRDLVGF-APWZRJJASA-N	446.386	1.102	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3C[C@]3(F)Cl)C2)C1	1839966540	IKKWXRFWMNQUFZ-GUYJKWIASA-N	441.725	1.541	50	20	IDGD	
CC(C)c1ccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)cc1	1839999969	CTPNGJFMJBIEQR-DENIHFKCSA-N	438.952	1.409	50	20	IDGD	
Cc1noc(C)c1CC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)Br)CCO2	1840030335	IVXVZOLGLVZPSF-SGTLLEGYSA-N	444.326	1.074	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc4cccnc34)C2)C1	1840152735	RJPIXWGEANIDHS-PGRDOPGGSA-N	447.919	1.559	50	20	IDGD	
O=C([C@@H](O)CCl)N1CC2(CCCN2C(=O)Cc2cccc(Br)c2F)C1	1841426023	PGOULLKDZZSTRP-ZDUSSCGKSA-N	433.705	1.934	50	20	IDGD	
C=CCO[C@@H](C)C(=O)N1CCCC12CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2	1841610594	QSNUURHUNOGRGU-SFHVURJKSA-N	443.548	1.127	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC2(CCCN2C(=O)C(F)(F)C(F)(F)C(=O)O)C1	1841828008	UBQWUJGHADIUOZ-QMMMGPOBSA-N	433.196	1.719	50	20	IDGD	
CCc1c(Br)c(C(=O)N2CCCC23CN(C(=O)[C@@H](O)CCl)C3)nn1C	1843143278	XWDRVAZMKHNETA-NSHDSACASA-N	433.734	1.162	50	20	IDGD	
C[C@@H]1OCCN(C(=O)OC(C)(C)C)[C@H]1C(=O)N1CC2(CCCN2C(=O)[C@H](F)Cl)C1	1843362215	HNSHRLSGQYAJAP-MJBXVCDLSA-N	433.908	1.749	50	20	IDGD	
Cc1ccc(OCCC(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)cc1	1844263379	YVTVVHLMQUXJRK-UHFFFAOYSA-N	437.500	1.280	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)[C@@H]2[C@@H]3Sc4ccccc4[C@H]32)C1	1844271243	VUGKYTNPQYLNDL-SLFFLAALSA-N	434.326	1.071	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H](O)C[C@H]1C(=O)N1CCCC12CN(C(=O)C(Cl)Cl)C2	1846217823	QVEIGFDVAKOMAH-NEPJUHHUSA-N	436.336	1.364	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)n1ccnc1	1847673831	CEPQCVYMIVMJPY-UGUYLWEFSA-N	439.944	1.778	50	20	IDGD	
O=C(COC(=O)CCNS(=O)(=O)c1cccc(Cl)c1)NNC(=O)c1ccccc1	9361415	UAIVLBGWHMHRCH-UHFFFAOYSA-N	439.877	1.013	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N(C)OC)cc2)cc1OC	12693942	OPZTVQFMIWSPBE-UHFFFAOYSA-N	437.474	1.351	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c(C)c1	15948192	UAVJRTRXOVEMLU-UHFFFAOYSA-N	431.514	1.928	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)OCC(=O)c2c(N)n(C)c(=O)n(C)c2=O)c(C)n1CC(C)C	22678666	LGCJOADLEWFUQU-LZYBPNLTSA-N	441.488	1.074	50	20	IDGD	
CS(=O)(=O)c1ccccc1C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	23684168	OFNYCJASUSHRBM-UHFFFAOYSA-N	430.530	1.063	50	20	IDGD	
CC(C)[C@@H](C(=O)NNC(=O)c1cc(Br)c[nH]1)N1C(=O)c2ccccc2C1=O	23914133	QSWBHXLELQRYDX-AWEZNQCLSA-N	433.262	1.859	50	20	IDGD	
CC(=O)N1c2ccc(S(=O)(=O)NNC(=O)c3ccc4c(c3)OCCO4)cc2C[C@@H]1C	105452644	BEQJWDFBNNMEFR-LBPRGKRZSA-N	431.470	1.379	50	20	IDGD	
Cc1nnc(SCC(=O)NNC(=O)CNC(=O)c2cccs2)n1Cc1ccccc1	725740494	FFBOLSSVGFFCRE-UHFFFAOYSA-N	444.542	1.366	50	20	IDGD	
C#Cc1cccc(NC(=S)NNC(=O)CN2C(=O)COc3ccc([N+](=O)[O-])cc32)c1	727500853	JNQMEMXMXDQRRG-UHFFFAOYSA-N	425.426	1.319	50	20	IDGD	
CN(C)C(=O)[C@H]1CCCN1CCCNC(=O)NNC(=O)c1c(Cl)cccc1Cl	727942412	SWWKMYQEJZWYEF-CQSZACIVSA-N	430.336	1.880	50	20	IDGD	
CC(=O)N(c1nc(C=NNC(=O)[C@@H](C)NS(C)(=O)=O)cs1)c1ccc(F)cc1F	728435601	FOUUHKJLEDZJFS-SECBINFHSA-N	445.473	1.494	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NN=Cc1cccnc1C)N(S(C)(=O)=O)CC2	728779624	PDMDAHFKQVWRCP-SFHVURJKSA-N	446.529	1.806	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)N2CCN(Cc3nc(O)c4ccccc4n3)CC2)c1	728954575	JKHWHGBEIXWXEW-UHFFFAOYSA-N	431.456	1.379	50	20	IDGD	
O=C(CCNS(=O)(=O)/C=C\c1ccccc1)NNC(=O)Cn1ccc2ccccc21	729540412	BWSHDQJVRSTIRH-QINSGFPZSA-N	426.498	1.769	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](CCNC(=O)NNC(=O)COc2ccc(C#N)cc2)C1	730139202	MQEJMKMSGHBIHA-INIZCTEOSA-N	431.493	1.915	50	20	IDGD	
CCCS(=O)(=O)c1ccccc1S[C@@H](C)C(=O)NNC(=O)C(=O)N1CCCC1	730539431	DXOIPMIUKQNKQK-ZDUSSCGKSA-N	427.548	1.121	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)C1CCN(S(=O)(=O)c2ccc3ccccc3c2)CC1	731853151	RZAWEBGYUIJGPI-UHFFFAOYSA-N	441.513	1.733	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])C[C@@H](C)O1	732264211	REDZSVCTQMCGPU-VXGBXAGGSA-N	448.398	1.796	50	20	IDGD	
CSCC[C@H](NC(=O)Cc1ccccc1)C(=O)NNC(=O)c1ccc2c(c1)OCCO2	732752177	BZYYZASTZIHGKI-KRWDZBQOSA-N	443.525	1.699	50	20	IDGD	
Cc1cccc(-n2c(NNC(=O)Cn3ccc(=O)n(C)c3=O)nc3ccccc3c2=O)c1C	733263776	CMHMHMRVSARPNM-UHFFFAOYSA-N	446.467	1.006	50	20	IDGD	
CNS(=O)(=O)[C@@H]1CCCN(C(=O)/C(C#N)=C/c2cc(C)n(C[C@@H]3CCCO3)c2C)C1	733279214	RIAVNNXZKCGMCB-FPZBBQJASA-N	434.562	1.731	50	20	IDGD	
CC[C@@H](C#N)Oc1cccc(CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)c1	733800016	QNMNYTYLDFAHNT-HNNXBMFYSA-N	444.517	1.805	50	20	IDGD	
Cc1cc(NNC(=O)[C@@H]2CC(=O)N([C@@H]3CCS(=O)(=O)C3)C2)ccc1Br	734254950	RJMTWYXQNWLJDP-DGCLKSJQSA-N	430.324	1.236	50	20	IDGD	
O=C(NCc1cccc(S(=O)(=O)NCc2cccc(F)c2)c1)NNc1cccnn1	736379066	RKBMXOVIYNLQNM-UHFFFAOYSA-N	430.465	1.921	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)c2nn(C)c(=O)c3ccccc23)cc1C	736734410	IGWYGMWPLUNCBD-UHFFFAOYSA-N	428.470	1.484	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)N[C@H]1CCN(c2ccc(Cl)cc2)C1=O	740025649	MEMYRYFULPRZPI-HNNXBMFYSA-N	432.864	1.863	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNS(=O)(=O)c1cc(C(F)(F)F)ccc1C(=O)OC	740812675	USLJRBCIGASEFU-UHFFFAOYSA-N	439.412	1.106	50	20	IDGD	
O=C(CN1C(=O)[C@H]2[C@H](C1=O)[C@H]1CC[C@H]2O1)NNC(=O)c1ccc(-c2ccc(F)cc2)s1	742485230	BZYORERPBDZGBH-XHSVMWQWSA-N	443.456	1.478	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)N[C@H]1CCCN(c2ccccc2Cl)C1=O	743577150	MOWBOEHBQNONDO-ZDUSSCGKSA-N	433.852	1.189	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NC[C@@H](C)Oc2ccccc2C)cc1	745887148	LGTCIZCOUNMNGV-QGZVFWFLSA-N	448.545	1.722	50	20	IDGD	
Cc1nc(SCC(=O)NNC(=O)[C@H]2Cc3ccccc3CN2Cc2ccccc2)n[nH]1	746185490	MPIYNYGVJJLKLZ-LJQANCHMSA-N	436.541	1.980	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)NC2CCN(C)CC2)cc1	746581959	ISFJLCHOXXBBHL-LGMDPLHJSA-N	436.516	1.551	50	20	IDGD	
C[C@@H](c1ccccc1)[C@@H](C)NC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	747589841	UIWGQROBHOAQMQ-IAGOWNOFSA-N	446.577	1.836	50	20	IDGD	
COC(=O)c1ccc(OC)c(S(=O)(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)c1	747595317	AMULXZGTMDVOAP-UHFFFAOYSA-N	435.458	1.047	50	20	IDGD	
C[C@@H]1CCCN(S(=O)(=O)c2cc(C(=O)NNc3nccn(C)c3=O)ccc2Cl)C1	747946015	RWFCTLAFOXJCMI-GFCCVEGCSA-N	439.925	1.611	50	20	IDGD	
COc1cc(OC)cc(N2CC[C@@H](NC(=O)NNC(=O)c3ccccc3OC)C2=O)c1	747954794	MBJATGPXAKYQBE-QGZVFWFLSA-N	428.445	1.462	50	20	IDGD	
NC(=O)CS(=O)(=O)c1ccc(C(=O)NNc2ccc(F)cc2Br)cc1	748074193	UFNPYPOBCPLGNL-UHFFFAOYSA-N	430.255	1.604	50	20	IDGD	
NS(=O)(=O)c1ccc(C(=O)NNC(=O)COCc2ccccc2)cc1Br	748080142	KVDOPSURELWVRC-UHFFFAOYSA-N	442.291	1.074	50	20	IDGD	
COC(=O)c1sc(S(=O)(=O)NNC(=O)CCc2ccco2)c(C(=O)OC)c1C	748213054	GZIMUHBEAYUZNV-UHFFFAOYSA-N	430.460	1.165	50	20	IDGD	
COc1cc(S(=O)(=O)NNC(=O)CCc2ccccc2O)c(Cl)cc1C(=O)O	749142289	JEAJBAYJSJENPP-UHFFFAOYSA-N	428.850	1.695	50	20	IDGD	
CCO[C@@H]1C[C@@H](NC(=O)NNC(=O)c2csc(N3CCOCC3)n2)C1(CC)CC	749619581	WTPPAMOVTJQPFW-HUUCEWRRSA-N	425.555	1.908	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NNC(=O)c2cc3ccccc3cc2O)cc1	751025213	JVWKEOAJBZSINE-AWEZNQCLSA-N	427.482	1.982	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN(C)CC(C)(C)CN1CCOCC1	752087018	BRWJLGRHPJDQBF-UHFFFAOYSA-N	426.945	1.400	50	20	IDGD	
N#Cc1ccc(CN2CC[C@@H](NC(=O)NNC(=O)Cc3ccc(Cl)cc3)C2=O)cc1	753292964	WBUUQBKLWLVZPD-GOSISDBHSA-N	425.876	1.886	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)c1nn(-c2ccccc2)cc1O)c1ccc(S(C)(=O)=O)cc1	753330368	LQMHRGAAKUZZSN-CYBMUJFWSA-N	428.470	1.546	50	20	IDGD	
O=C(Cc1ccc2c(c1)COC2)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	754347694	YGTCQZOCMFPYOR-UHFFFAOYSA-N	443.525	1.895	50	20	IDGD	
COCCNS(=O)(=O)c1cccc(C(=O)NNc2ccc(-c3ccccc3)nn2)c1	754467440	KZWIIJNHYLYNLR-UHFFFAOYSA-N	427.486	1.825	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Nc2ccc3c(c2)NC(=O)[C@H](C)O3)cc(OC)c1OC	755559652	WAHUNMFOVHQKGV-JTQLQIEISA-N	430.417	1.898	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)Nc2cc(C(N)=O)ccc2F)c2ccccc2c1=O	756067781	VJEPYGHDJPYHGS-UHFFFAOYSA-N	426.408	1.682	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)Nc1cccc(CN2CCCCC2=O)c1	756294896	VASCLRZNOWWJRK-UHFFFAOYSA-N	434.460	1.641	50	20	IDGD	
COc1ccc(S(=O)(=O)C(F)(F)F)cc1NC(=O)NNC(=O)Cc1cccnc1	756298007	QHEYVTNHOQAFBC-UHFFFAOYSA-N	432.380	1.779	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)Nc1ccc(C[C@H]2CC(=O)NC2=O)cc1	756815160	IUNUIJYGPAYEHN-HNNXBMFYSA-N	440.456	1.522	50	20	IDGD	
COc1ccccc1N1CC[C@@H](NC(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)C1	757290492	FPGBFXNRRPARRK-QGZVFWFLSA-N	425.489	1.860	50	20	IDGD	
Cc1cc(F)cc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c1	757739843	UJEIJCWBXBTKOY-UHFFFAOYSA-N	436.465	1.622	50	20	IDGD	
CC(=O)N1CC[C@@H](NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c2ccccc21	757797544	GBTFQVKDNNUJFR-QGZVFWFLSA-N	430.486	1.532	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)CCc1nc2ccccc2n1-c1ccccc1	758036391	RJBPHCATPNCWBL-AWEZNQCLSA-N	429.502	1.043	50	20	IDGD	
CN1C(=O)C[C@H](C(=O)NNC(=O)COc2ccccc2O)[C@@H]1c1ccc(Cl)c(F)c1	759009913	CZLUPKPOXWVJOU-BUXKBTBVSA-N	435.839	1.931	50	20	IDGD	
C[C@H](C1CC1)n1nccc1NC(=O)C(=O)NNC(=O)c1cc(Br)ccc1O	760277447	LKGIJUTZABLTQD-SECBINFHSA-N	436.266	1.722	50	20	IDGD	
CCS(=O)(=O)c1cccc(S(=O)(=O)NNC(=O)c2cc(OC)cc(OC)c2)c1	760334036	FMQGKXPYZMBGSS-UHFFFAOYSA-N	428.488	1.121	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)N[C@H]2CCN(C(=O)C3CCCC3)C2)cc1	762377930	GZIFQWLVQDACJE-RDJZCZTQSA-N	432.521	1.974	50	20	IDGD	
CCCCS(=O)(=O)N1CCC[C@H]1C(=O)NNC(=O)c1cc(-c2cccs2)[nH]n1	763162158	JJXQXXTZQHVRIB-AWEZNQCLSA-N	425.536	1.494	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)cc(OC)c1O	763281840	HVYLDWQBKMPRLN-UHFFFAOYSA-N	426.429	1.775	50	20	IDGD	
CC(C)(C)NS(=O)(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)c2ccccc2)c1	763422869	FVWVEFCYCPGDAW-UHFFFAOYSA-N	432.502	1.304	50	20	IDGD	
CC1CCN(S(=O)(=O)c2ccc(NC(=O)C(=O)NNC(=O)c3ccccc3)cc2)CC1	763426410	WUYPFCDYUMJVNE-UHFFFAOYSA-N	444.513	1.507	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccccn2)n(-c2cccc(Br)c2)n1	763467545	QDCFAXUWOOSURB-UHFFFAOYSA-N	443.261	1.738	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)nn1-c1cccc(F)c1	763468747	SWXPYFXPXYQHGD-UHFFFAOYSA-N	426.364	1.628	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(C)nc1Br	763712474	HVJQYCHWQSYXMA-UHFFFAOYSA-N	435.278	1.880	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2ccc(F)c(Cl)c2)c2ccccc2c1=O	763786623	QRUSSXXZITTXTR-UHFFFAOYSA-N	431.811	1.609	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)C(=O)Nc2ccc(F)cc2F)c2ccccc2c1=O	763805618	SQIWTDDCYOWOOK-UHFFFAOYSA-N	443.410	1.875	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)c(Br)n1	763850583	OECQDNXIMHWKKY-JTQLQIEISA-N	439.241	1.845	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cccc(N3CCOC3=O)c2)c1C	763852140	VGWXLEHYTNXYCW-OAHLLOKOSA-N	440.456	1.813	50	20	IDGD	
COCCOc1ccc(C#N)cc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccccc1F	763858798	XLCMZMZOBPFBDP-CYBMUJFWSA-N	444.419	1.276	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)CC(=O)N3)cc1	763862520	XWGLUVYEKCJVSW-LBPRGKRZSA-N	426.429	1.133	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)cc1NC(C)=O	763864376	CCFSSSICTFZYMR-LLVKDONJSA-N	432.408	1.346	50	20	IDGD	
Cc1ccc(S(C)(=O)=O)cc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccccc1F	763865038	NEJMASSNPOOAQI-GFCCVEGCSA-N	437.449	1.091	50	20	IDGD	
CCNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(C(C)=O)cc2)c1	763871639	GRMQLKIRFCJSOB-AWEZNQCLSA-N	440.456	1.192	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)N(C)C)cc2)ccc1OC(C)C	763915652	BYTBVFJOGZCULW-UHFFFAOYSA-N	442.472	1.584	50	20	IDGD	
CN1CCN(c2ccccc2NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)CC1	763978480	JQVZTEGTTVZUTQ-UHFFFAOYSA-N	431.880	1.197	50	20	IDGD	
O=C(NNC(=O)c1ccc[nH]1)C(=O)Nc1cc(F)c(I)c(F)c1	763980064	STDGNZUGLXFKSC-UHFFFAOYSA-N	434.140	1.297	50	20	IDGD	
CS(=O)(=O)c1ccccc1NC(=O)C(=O)NNC(=O)Cc1cccc2ccccc12	764018720	BFYWOXFIVYQAKU-UHFFFAOYSA-N	425.466	1.572	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)C2CCCC2)c(C(=O)N2CCCCC2)cc1OC	764066286	JCJFSRMFZJEDPX-UHFFFAOYSA-N	446.504	1.606	50	20	IDGD	
CCCn1ccc2cc(NC(=O)C(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)ccc21	764084766	HJUNNVMUGKVKCD-UHFFFAOYSA-N	442.497	1.855	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2cc(C)[nH]n2)cc1NC(=O)OC(C)(C)C	764107082	YBCQPLWXDDCKAP-UHFFFAOYSA-N	432.437	1.473	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)c2c(Cl)cccc2Cl)cc1	764222304	XRPBUTDIINVJGE-UHFFFAOYSA-N	440.239	1.945	50	20	IDGD	
CCOc1cc(C)ccc1NC(=O)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	764265574	BDZCDVFLGXYRFI-UHFFFAOYSA-N	426.477	1.186	50	20	IDGD	
CN(Cc1cccc(NC(=O)C(=O)NNC(=O)Cc2ccccn2)c1)Cc1cscn1	764270242	JFBBSGBJHVRCBV-UHFFFAOYSA-N	438.513	1.499	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2O)c(C(F)(F)F)c1	764278474	ZCQRSRBFXYXYQP-UHFFFAOYSA-N	441.362	1.975	50	20	IDGD	
CCn1cc(NC(=O)C(=O)NNC(=O)c2cc(F)ccc2Br)ccc1=O	764279148	YYGODADIFQGPJB-UHFFFAOYSA-N	425.214	1.170	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2O)cc1NC(=O)C(C)(C)C	764281057	WMVLWNHWXMAEGU-UHFFFAOYSA-N	442.472	1.850	50	20	IDGD	
CC(C)(C(=O)NNC(=O)C(=O)Nc1ccc(CCN2CCOCC2)cc1)c1ccccc1	764310143	ZPIFVSAWMWOUNO-UHFFFAOYSA-N	438.528	1.625	50	20	IDGD	
CCOc1cc(C(=O)N(C)C)ccc1NC(=O)C(=O)NNC(=O)Cc1ccccc1F	764318614	GEKVKWPWPBLFLT-UHFFFAOYSA-N	430.436	1.255	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2cc3ccccc3o2)cc1	764343360	UWUGWAWBNRBSKD-UHFFFAOYSA-N	430.442	1.594	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)C(=O)Nc1ccc(-c2nnc3n2CCCCC3)cc1	764386249	UQVFIJRPBWRBGZ-UHFFFAOYSA-N	433.472	1.775	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(Oc2ccccc2C#N)cc1	764398618	HWOFAXZTZRMEGI-AWEZNQCLSA-N	426.429	1.488	50	20	IDGD	
O=C(CSc1nnc(-c2ccncc2)n1-c1ccccc1)NNC(=O)N1CCOCC1	765327658	AWUQTWYFHXERLB-UHFFFAOYSA-N	439.501	1.494	50	20	IDGD	
O=C(Cc1c[nH]c2ccc(F)cc12)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765738948	QCZNLUNSSKZQGI-UHFFFAOYSA-N	437.475	1.455	50	20	IDGD	
CCCn1ncc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1C1CC1	766177657	PUVHUDMQKBHPBT-KRWDZBQOSA-N	428.445	1.315	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NCCc2csc(C(C)(C)C)n2)c2ccccc2c1=O	766265842	CTYPFAQPODTUMS-UHFFFAOYSA-N	428.518	1.874	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2cnn(-c3ccccc3)c2COC)c2ccccc2c1=O	767294019	AFVNGQBQZVGAKU-UHFFFAOYSA-N	446.467	1.823	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNS(=O)(=O)c1ccc(OC[C@H]2CCOC2)c(F)c1	767438666	XDBKDSSFEQAPPE-AWEZNQCLSA-N	448.476	1.820	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)c2ccc([C@]3(C)NC(=O)NC3=O)cc2)n[nH]1	768274179	PQRUURANFYRRQV-QFIPXVFZSA-N	448.439	1.215	50	20	IDGD	
CC(C)C[C@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)c1csc(N2CCOCC2)n1	769050697	AFLJOGBBOOVIJL-ZDUSSCGKSA-N	441.554	1.680	50	20	IDGD	
CCCCn1cc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)c(C)n1	770243106	DLDATPGRJGBJPR-UHFFFAOYSA-N	426.521	1.211	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)NC3CCN(Cc4ccccn4)CC3)nc21	770339997	GSVGHMQJZXFMHV-UHFFFAOYSA-N	439.524	1.973	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)Cc2ccccc2I)C[C@@H](C)O1	771534944	FNMVIRVCHOBVLH-BETUJISGSA-N	445.301	1.480	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccccc1	771848552	BTUFBXLGPKOCPO-RDJZCZTQSA-N	439.534	1.355	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)c1cccc(OC[C@H]2CCCO2)c1	772188144	HJICIWVELXTSRF-GOSISDBHSA-N	431.876	1.975	50	20	IDGD	
Cc1ccc(-n2nc(C)cc2NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)nn1	773496632	LVASXHLVZJCOQE-UHFFFAOYSA-N	429.824	1.038	50	20	IDGD	
O=C(NNc1cnc2ccccc2n1)C(=O)Nc1ccc(F)c(S(=O)(=O)NC2CC2)c1	773722544	HIHGCFKVESLDGJ-UHFFFAOYSA-N	444.448	1.291	50	20	IDGD	
C=CCN(C)S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2cnc3ccccc3n2)cc1	773722844	LZKBIYSLZAJMJY-UHFFFAOYSA-N	440.485	1.518	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)OCC(=O)N2	774002258	PAKVUMJNKOVZPN-SNVBAGLBSA-N	432.820	1.224	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1cccnc1N1CCOCC1	774009047	NIDOAKCKIPJMKM-CYBMUJFWSA-N	447.879	1.125	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@@H]2CCCO[C@@H]2CC(C)C)cc1	776259900	SYWUZKSLEXZPFP-QZTJIDSGSA-N	440.566	1.540	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2c(C)nn(C)c2-n2cc(C)cn2)c2ccccc2c1=O	777756550	JDZDHMSWEQSNCZ-UHFFFAOYSA-N	434.460	1.027	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H](O)Cc2cccc(C(F)(F)F)c2)c1	778460363	WWMYLQUGMKWGPN-HNNXBMFYSA-N	430.404	1.474	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)N[C@H](CO)c1ccc(Br)cc1	778587966	CLGWSBUTCDOQLN-OAHLLOKOSA-N	446.265	1.102	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1ccnn1Cc1c(Cl)cccc1Cl	779471023	DTQKACHPVWZGGL-VIFPVBQESA-N	449.320	1.329	50	20	IDGD	
CSc1ccccc1S(=O)(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	780365271	AJPOIEORBAIIGC-UHFFFAOYSA-N	435.936	1.333	50	20	IDGD	
CCc1ccc(NC(=O)C(=O)NN=c2sc3ccccc3n2C)cc1S(N)(=O)=O	783351317	BYLYFFRDXILLOV-UHFFFAOYSA-N	433.515	1.020	50	20	IDGD	
CC(C)Cc1cc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)n(C)n1	784210546	UNYCKPKZGXWAKY-UHFFFAOYSA-N	434.522	1.141	50	20	IDGD	
O=C(NNc1ccc(Br)cn1)C(=O)Nc1ccc(CCN2CCOCC2)cc1	784341427	LZVYSEJXVCLDMO-UHFFFAOYSA-N	448.321	1.801	50	20	IDGD	
C[C@H]1CN(C(=O)Cn2cc(NC(=O)C(=O)NNc3ccccc3Cl)cn2)C[C@@H](C)O1	784780122	YZWDHPBBVFJLFN-BETUJISGSA-N	434.884	1.254	50	20	IDGD	
COCCOc1ccc(Br)cc1NC(=O)C(=O)NNc1ncc(F)cn1	784950549	UHAAWRGUGBKXSC-UHFFFAOYSA-N	428.218	1.485	50	20	IDGD	
CON(C)S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2cccc(C(F)(F)F)n2)cc1	784951065	BGIQWNDFRNQRKB-UHFFFAOYSA-N	447.395	1.364	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1ccc(-c2n[nH]c(C)n2)cc1	785330123	FEGCLAURJYUGNY-UHFFFAOYSA-N	444.473	1.274	50	20	IDGD	
Cc1cc(F)cc(-n2cc(C(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)nn2)c1	788721655	VXPNSPISEJFFRH-UHFFFAOYSA-N	446.464	1.040	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)Nc1cccc(N2CCC2=O)c1	790582244	FSBDOHCPZYQPFU-UHFFFAOYSA-N	436.516	1.788	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)Cn1ccc2ccccc2c1=O	790721664	OONGHJJNJPKKBO-UHFFFAOYSA-N	443.843	1.668	50	20	IDGD	
CCc1c(NC(=O)C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cnn1C(CC)CC	792268498	JHIUPAFHECFRLJ-UHFFFAOYSA-N	449.533	1.610	50	20	IDGD	
O=C(Cc1ccc2n[nH]cc2c1)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	792806282	RTWHUUWVGLFHGE-UHFFFAOYSA-N	427.486	1.351	50	20	IDGD	
CNS(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)c2ccc(Cl)cc2OC)cc1C	794581212	RCWTZPUGEIJCMZ-UHFFFAOYSA-N	447.922	1.188	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)CCOc1ccc(S(C)(=O)=O)cc1	795169019	YFJOADOICRWGSQ-UHFFFAOYSA-N	441.531	1.253	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2csc3ccccc23)c1	795280447	HTSUHFAIINFHTC-UHFFFAOYSA-N	439.540	1.775	50	20	IDGD	
O=C(COC(=O)CCSCc1ccccc1)NNC(=O)[C@H]1COc2ccccc2O1	795847193	ADGBCRCYVLQOIO-GOSISDBHSA-N	430.482	1.841	50	20	IDGD	
CC(C)(C)c1ccc(NC(=O)C(=O)NNC(=O)CNC(=O)OCc2ccccc2)cc1	797368929	JHVKSNLXYGWXBX-UHFFFAOYSA-N	426.473	1.996	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cc3ccccc3c(=O)o2)cc1OC	797479854	KWVHLNWYQZZLSR-UHFFFAOYSA-N	426.381	1.428	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)NCCNS(=O)(=O)c2ccc(F)cc2F)cc(C#N)n1C	799740781	CGBSZVGSFSCTBZ-AUWJEWJLSA-N	433.440	1.485	50	20	IDGD	
CC(=NNC(=O)Cc1cc(O)nc(O)n1)c1c[nH]c2ccc(Br)cc2c1=O	799880900	FNNLYDYTPJUXBK-UHFFFAOYSA-N	432.234	1.575	50	20	IDGD	
CC(C)(C)[C@H](NC(N)=O)C(=O)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1	800328112	HFZRFYBUFYSBQF-VQTJNVASSA-N	437.544	1.844	50	20	IDGD	
Cc1c([N+](=O)[O-])ccc(F)c1NC(=O)C(=O)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	800625248	LJSUMSQVJIFFQQ-UHFFFAOYSA-N	444.354	1.971	50	20	IDGD	
CSCC[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)NNC(=O)N=c1cc[nH]cc1	802032442	RPPSPMVOBJQNAD-HNNXBMFYSA-N	432.462	1.116	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)CNS(=O)(=O)c2cccc(C(F)(F)F)c2)cc1	802056098	ZOLSHZHVLGRKCD-UHFFFAOYSA-N	446.407	1.845	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])o1)Nc1ccc2c(c1)OCO2	802102922	GHVXCBRWUJTKLQ-LLVKDONJSA-N	431.361	1.374	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)c1sccc1S(=O)(=O)NCc1ccco1	804958017	ZJOHINZZJXULKC-UHFFFAOYSA-N	445.486	1.552	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)CCCC(=O)c2ccc3c(c2)OCCO3)C[C@@H](C)O1	806339920	LKVWYWCAYASHMB-HZPDHXFCSA-N	433.505	1.458	50	20	IDGD	
CC(=O)c1cc(Br)ccc1OCC(=O)NNC(=O)CNC(=O)c1cccnc1	807081952	JSCJHUFUACFOAA-UHFFFAOYSA-N	449.261	1.003	50	20	IDGD	
COC(=O)c1cc(Br)c(F)cc1NC(=O)C(=O)NNc1ncccc1F	807301307	FHWBJCYJEMSXGS-UHFFFAOYSA-N	429.177	1.991	50	20	IDGD	
CN1CCN(C(=O)NNC(=O)CCc2nc(-c3cc(Br)cs3)no2)CC1	807380087	BHUKLVLWZVVXBG-UHFFFAOYSA-N	443.327	1.481	50	20	IDGD	
CC[C@H](C)N[C@H](CNC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)c1ccco1	807439988	JJRQOBDXAYHGLB-XJKSGUPXSA-N	426.477	1.600	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)NCC2(S(C)(=O)=O)CCCC2)cc1	807537348	IOZQTLLVDFEGRC-AWEZNQCLSA-N	427.523	1.540	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)c1c(F)cncc1F	807554164	CRTUJNJXIDIDNX-OAHLLOKOSA-N	432.475	1.964	50	20	IDGD	
O=C(CNS(=O)(=O)c1c(Cl)cccc1Cl)NNC(=O)COc1ccccc1O	810365869	YQHZGOOMDICOHF-UHFFFAOYSA-N	448.284	1.204	50	20	IDGD	
Cc1cc(C(C)(C)C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)ccc1Br	813420248	HPSNXAXXDLENIP-GFCCVEGCSA-N	432.340	1.553	50	20	IDGD	
NS(=O)(=O)c1ccc(NC(=O)NN=C2C(=O)Nc3ccc(Br)cc32)cc1	814965033	FWLYPNWBTCDQLZ-UHFFFAOYSA-N	438.263	1.574	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N2C[C@@H]3[C@@H](CO)[C@@H]3C2)cc1	816860445	LVTGSDRUSBNUGQ-HXPALMLGSA-N	435.484	1.038	50	20	IDGD	
Cc1c(C(=O)NNC(=O)[C@H]2CCCN(C(=O)OC(C)(C)C)C2)nnn1-c1ccccc1	819658049	HLAHDDMFRYRXEK-HNNXBMFYSA-N	428.493	1.984	50	20	IDGD	
Cc1cc(C)nc(SCC(=O)NN=Cc2c(Cl)nc(N)nc2N2CCOCC2)n1	873940031	LVXKDLHVVYPTKJ-UHFFFAOYSA-N	436.929	1.198	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)c2cc(-c3ccco3)nc3c(C(N)=O)ncn23)c1	913081376	MKAUHRVGHJNTLI-UHFFFAOYSA-N	448.439	1.545	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CC(=O)N(c2ccccc2Br)C1)c1ccc2c(c1)OCO2	913632672	NIELWDMUHURODL-GFCCVEGCSA-N	446.257	1.992	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(\C#N)C(=O)N2CCN(S(=O)(=O)N(C)C)CC2)c1C	914504183	QTAWIFHCUHPVIV-QUYZQLMHSA-N	437.566	1.170	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)CNS(=O)(=O)c2c(C)c(C)cc(C)c2C)cc1	915772374	XBPUYIZAWLPDGT-UHFFFAOYSA-N	433.530	1.733	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NC[C@@H](c2ccco2)N2CCCC2)nc1	915896188	DFZKIGVBXOHPEY-INIZCTEOSA-N	436.538	1.825	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCc2ccccc2Cn2cccn2)nc1	916227853	NOTGWIMMPNKYDM-UHFFFAOYSA-N	443.533	1.839	50	20	IDGD	
O=C(NCCCN1CCN(c2ncccn2)CC1)NNC(=O)c1cc2c(s1)CCC2	916266723	BDWPEFUYJZXMGC-UHFFFAOYSA-N	429.550	1.183	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CNS(=O)(=O)c2ccc(Cl)cc2)cc1C	916561718	AJFLPUXCGSGRQQ-UHFFFAOYSA-N	438.893	1.021	50	20	IDGD	
Cn1ncc2c1CCC[C@@H]2NC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	916604742	OGQHPNCIQPLWMW-KRWDZBQOSA-N	446.533	1.226	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)N[C@@H]2CCN3CCCC[C@H]23)c2ccccc2c1=O	916638926	NLJUDMLBALLKOR-QZTJIDSGSA-N	426.521	1.767	50	20	IDGD	
C=CCNC(=O)c1cccc(S(=O)(=O)NNC(=O)[C@H](C)Oc2ccc(OCC)cc2)c1	917725672	SFCBPXXTCWGFEC-HNNXBMFYSA-N	447.513	1.778	50	20	IDGD	
CCCC(=O)N1CCC[C@@H](C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)C1	917903980	LWHDKECQGBEFFZ-LJQANCHMSA-N	429.565	1.385	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)CCCOCCc2ccccc2)ccc1Cl	917918743	CQMSJKQRBLJCHD-UHFFFAOYSA-N	439.921	1.788	50	20	IDGD	
O=C(COc1ccccc1CNC(=O)NNC(=O)CC(F)(F)F)NC[C@H]1CCCO1	918081352	OMVLXQKMJXBOSJ-CYBMUJFWSA-N	432.399	1.143	50	20	IDGD	
CCOCCO[C@@H](C)C(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	918142139	DVHBNAMBHJIUHS-INIZCTEOSA-N	438.484	1.647	50	20	IDGD	
C[C@H](C(=O)NNC(=O)c1ccc(F)cc1Br)N1C(=O)[C@H]2CCCC[C@@H]2C1=O	920456516	WDTSJKQDVNZFOA-USWWRNFRSA-N	440.269	1.913	50	20	IDGD	
COC(=O)c1ccccc1S(=O)(=O)N1CCC(C(=O)NNC(=O)CC(C)C)CC1	920813998	DWVJXUMMJWEUDU-UHFFFAOYSA-N	425.507	1.067	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)Nc2nc(CN3C[C@@H](C)O[C@H](C)C3)cs2)cc1	920930245	BMQFMXIJHSFSIJ-ZIAGYGMSSA-N	449.533	1.993	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCC[C@@H]1CN1C[C@H](C)O[C@@H](C)C1	921192856	COJONGHEEUVDHL-YQQAZPJKSA-N	438.956	1.683	50	20	IDGD	
CC(C)c1noc2ncc(C(=O)OCC(=O)NNC(=O)[C@@H]3COc4ccccc4O3)cc12	928713103	AELUJFQYKINGHG-INIZCTEOSA-N	440.412	1.490	50	20	IDGD	
Cc1cc(C)nc(SCc2ccc(C(=O)NNC(=O)[C@@H](C)N3C(=O)CCC3=O)cc2)n1	1115967640	UWVPLZVHUMTXBZ-CQSZACIVSA-N	441.513	1.684	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCCCN2CCN(C(=O)OC(C)(C)C)CC2)cc1	1317916297	OGDPSOZDCSKQBB-UHFFFAOYSA-N	435.525	1.582	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1	1318021046	MCIKPRTURTWIGW-GOSISDBHSA-N	438.484	1.315	50	20	IDGD	
COC(=O)C(=O)NNC(=O)NCCOc1c(Cl)cc(Br)cc1Cl	1337288706	GZXBBIJITRVBRS-UHFFFAOYSA-N	429.054	1.638	50	20	IDGD	
O=C(CN1CCCC1=O)NNC(=O)c1cc(Br)cc(Br)c1O	1337488092	DJNZCEGUKFXLDM-UHFFFAOYSA-N	435.072	1.301	50	20	IDGD	
O=C(c1c(Cl)ccc2c1OCO2)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1777798952	ZTZUJMQGFOAGQS-KPZWWZAWSA-N	431.272	1.112	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)Br)C2	1778107209	DAAWYTPFUYYOQK-HOPMXRPOSA-N	432.359	1.151	50	20	IDGD	
O=C(c1ccn2ccnc2c1)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1778566673	BLGGWFGSWRZHAK-WMLDXEAASA-N	425.258	1.468	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1Cc3ccccc3CN1)CCO2	1779295261	CLKCPEWSZMKHMB-UGKGYDQZSA-N	431.609	1.382	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](C)Nc3ccccn3)C2)C1	1779332355	VGHUPXJMVBCXNN-ZRGWGRIASA-N	439.354	1.885	50	20	IDGD	
CC(C)(C)c1cc(C(=O)N2CC[C@]3(CN(C(=O)CCBr)CCO3)C2)[nH]n1	1779571731	AHTVAWIWJZKSBK-SFHVURJKSA-N	427.343	1.936	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)CS(=O)(=O)c3ccc(C)cc3)CCO2)C1	1781213143	MIBQZGZLGJAJPE-PXNSSMCTSA-N	442.965	1.616	50	20	IDGD	
CC(=O)NCCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)CBr)C2	1781790441	FOANNPJXLZTNBJ-JCKWVBRZSA-N	432.359	1.058	50	20	IDGD	
COc1cc(C)c(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)cc1OC	1781889673	VXZOLIPNKAYTSD-MGPUTAFESA-N	426.897	1.055	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(CO)o1)C2	1781997751	HCMOORMOCVHXIN-WBHUJUFNSA-N	429.311	1.683	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc3cn[nH]c3cn1)C2	1782175746	QJRILDDMSVXUIC-WIBUTAKZSA-N	435.912	1.339	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCCCCC(=O)OC)C2	1782179793	MUBJZALGPCZQQV-CBGDNZLLSA-N	446.972	1.878	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C(=O)c2cccn2C)C1	1782617400	OWAHIKHOXNDXMV-ZBQZNYHESA-N	440.338	1.505	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cccn4ccnc34)CCO2)C1	1783349220	KCADEYGJYJXISA-BEFAXECRSA-N	435.322	1.951	50	20	IDGD	
CC(=O)Nc1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](C)Br)C3)C2)ccn1	1783535037	WAOMRVICTLJHKY-KZULUSFZSA-N	439.310	1.267	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](C)Sc1ccccn1)CCO2	1783879941	ZXQYTYKZYLMHJA-ZRGWGRIASA-N	427.954	1.646	50	20	IDGD	
CCOC(=O)N(CC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Cl)CCO2)Cc1ccco1	1784302903	MHFOKYJVUHEIFC-LPHOPBHVSA-N	445.875	1.602	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@](C)(O)C(F)(F)F)[C@H]2C1	1784872408	UMHTTWWRYSVMKK-VSBZFQJLSA-N	445.276	1.310	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C[C@H]3CCCCO3)[C@H]2C1	1784957192	KBFYGNPVUVDLKC-ALYAQQCSSA-N	431.371	1.956	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)c1cn2c(Cl)cccc2n1	1787861155	ADZCKYLHOHDXIT-JURCDPSOSA-N	441.315	1.181	50	20	IDGD	
N[C@H](C(=O)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1)c1ccccn1	1788143912	VKTHXJUTCRAEJT-NRFANRHFSA-N	444.300	1.209	50	20	IDGD	
O=C(C/N=C/c1ccco1)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1	1788147920	OUBZJQYAMGSORS-CVKSISIWSA-N	445.284	1.826	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)N3CCN(C)CC3)[C@H]2C1	1789795179	QLTYMYUBEZZCHJ-VMXHOPILSA-N	429.005	1.010	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]3C2)cc(O)n1	1789922725	LSQNYKCNGPPWEG-GZCFXPHUSA-N	430.274	1.379	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4nccn4c3)C[C@@H]21)[C@@H](F)Br	1789925719	IBHCMXKAPZRMTM-RZLSGREXSA-N	439.285	1.618	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cn3cnc4ccccc43)[C@H]2C1	1791176633	QQPGEBJNOGVYBV-ZWOKBUDYSA-N	444.608	1.868	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCn3nc(C)cc3C)C[C@@H]21	1791256830	YCGQVBXEWOFRPC-FJIDUMEYSA-N	426.945	1.124	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)n3cccn3)[C@H]2C1	1791640556	VQZNVMOMOOJIML-OWYFMNJBSA-N	427.343	1.455	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H](C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](O)CCl)C[C@H]2C[C@H]21	1793117667	XDXDPANEWCGADG-YRXKBASHSA-N	441.956	1.622	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nnc3cc(C)nn3c1C)C2	1793449970	WCDBNGDTAWTPDP-KRXQYRFLSA-N	434.928	1.352	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)cc([N+](=O)[O-])c1)C2	1793451618	GKAOSXDGHBMTMZ-RMHZUWNSSA-N	425.869	1.911	50	20	IDGD	
Cc1cnc(Cl)c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Br)C3)c1	1794968010	QZBWEYOZVXATRF-LFSVMHDDSA-N	434.693	1.937	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C=C/c1ccccc1	1795279876	DSRUCJSSHCIAAW-ZISJOHAUSA-N	449.511	1.423	50	20	IDGD	
O=C(CC[C@@H]1CNc2ccccc2C1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2	1795647820	VIMOESIBVKSVJE-RCJOQXLUSA-N	435.952	1.240	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2)[C@@H]1ON=C(c2ccccc2)O1	1797642516	BMDIKWOCRDQPDH-YFQWEKLQSA-N	428.272	1.114	50	20	IDGD	
COc1ccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CO[Si](C)(C)C)cc1C	1797952994	XWMICUCSEBVIJL-OPMZPASUSA-N	434.609	1.987	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)Nc1ccccn1	1797976386	MLPACWIUUKFCON-LFYQSXPISA-N	439.354	1.645	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)N(C)C(=O)OC(C)(C)C	1799135595	RFRVDBSAMQNZNC-IBEHDNSVSA-N	431.961	1.849	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1CCCN(C)C1	1799892753	BREQVCPQROYSEK-DXFUESDRSA-N	428.537	1.100	50	20	IDGD	
CC(=O)N[C@@](C)(C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](O)CCl)C2)c1ccccc1F	1800239269	WPTIIPMMOWZRPP-ZLFLNXGQSA-N	439.915	1.415	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(OC)c(OC)c1O	1800573030	PZPITUGOQCXQCZ-XFMPKHEZSA-N	426.897	1.915	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3cn[nH]c3cn1)C2	1800641384	ADVURIHQAWKGEB-OQMKEHIESA-N	436.310	1.335	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(N(C)C)nc1)C2	1800760164	FNJMEFBCAXNMIG-ZIEJDFEHSA-N	425.327	1.134	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](N)c1cccc(Cl)c1)C2	1800975946	YSVLZUOIKMPGOB-GWCDLVAZSA-N	430.332	1.183	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc([N+](=O)[O-])c(O)cc1C)C2	1800979683	UPKACEKJWTYRTR-IFOZYUSPSA-N	441.868	1.066	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](CCO)NC(=O)OC(C)(C)C)C2	1802271191	ZBLOZVCJRDBFKE-YIDVYQOGSA-N	447.960	1.154	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(Cl)c(O)cc1O)C2	1802338858	WSLLKDKHBMIETI-CLLJXQQHSA-N	438.912	1.376	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1CCN(C(=O)CCn2ccnn2)[C@@H]1c1cccnc1	1803017639	MZCRHFBFBPTDQI-UWWQBHOKSA-N	449.353	1.800	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cc3n(n2)CCCC3)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803143183	WFXFMGROVGQVQW-ZYSHUDEJSA-N	431.924	1.534	50	20	IDGD	
O=C(CCc1ccc(F)nc1)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1	1804436319	DOZSXDVIESOOEQ-ZWOKBUDYSA-N	434.899	1.854	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)C(F)(F)C(F)(F)C(=O)O)[C@H]1c1cccnc1)[C@@H](F)Cl	1808308393	JYGBMNHZHPXVAL-GARJFASQSA-N	443.756	1.977	50	20	IDGD	
O=C(/C=C/C1CCCC1)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1808482434	WWQZIUVRWGLFTC-AHIKMHNJSA-N	447.344	1.827	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)CO[Si](C)(C)C)[C@@H]1c1cccnc1	1810526839	HGMTVCDXUXOJDR-OXFYSEKESA-N	432.597	1.630	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)[C@H](C)Cn2cncn2)[C@@H]1c1cccnc1	1813030513	CWWAEQGEVPJESM-LAVFITLUSA-N	434.928	1.269	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@@H](CNC(=O)CCn2ccnn2)[C@@H]1c1cccnc1	1813428357	YPYNUVREWZXMCA-HFTRVMKXSA-N	449.353	1.800	50	20	IDGD	
CC(=O)N[C@H](C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](C)CBr)n[nH]1	1814783269	MLVJITOCAYCVPG-WDMOLILDSA-N	428.331	1.957	50	20	IDGD	
Cc1cc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)ccn1	1819757614	SMRHHRHCICWHIM-KRWDZBQOSA-N	427.509	1.792	50	20	IDGD	
C#CC(=O)N[C@H]1CCc2nc(NC(=O)CN(C)NC(=O)NCc3ccccc3)sc2C1	1822518920	XVSPGNQHDFIALE-HNNXBMFYSA-N	440.529	1.035	50	20	IDGD	
CCn1ccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)n1	1826091859	SHXHWTPSFUNEST-OAQYLSRUSA-N	438.337	1.130	50	20	IDGD	
O=C(/C=C/c1ccoc1)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827056067	OQNRNPVFSZYJJU-VQKOGROQSA-N	436.317	1.906	50	20	IDGD	
CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H](F)Cl)CC1	1827615726	GWEMBIYHFRSWEN-SQNIBIBYSA-N	441.935	1.611	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccnc3OCC)CCO2)C1	1829535779	BAHZYWWGUHVWEQ-LAUBAEHRSA-N	439.940	1.958	50	20	IDGD	
Cc1ccc(OCCC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)cc1	1830206146	VTFQTNDBPSZMNQ-QUCCMNQESA-N	428.888	1.755	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccn(C(C)(C)C)n3)C2)C1	1830357581	AHNRNNUOASFYBY-OAQYLSRUSA-N	440.972	1.973	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cncc4cnccc34)C2)C1	1830364689	PTNDCHMXCNOLSF-JOCHJYFZSA-N	446.935	1.965	50	20	IDGD	
O=C(Cc1ccc(Cl)c(F)c1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1830719933	PDOBWTZRSASTPY-LPHOPBHVSA-N	449.306	1.078	50	20	IDGD	
C=CCOCCCC(=O)N1CCO[C@@]2(COCCN(C(=O)CCBr)C2)C1	1831406378	KFZIMEBBKBUOOX-GOSISDBHSA-N	433.343	1.211	50	20	IDGD	
CN1CCC[C@H](C(=O)N2CCC([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)C1	1831873881	DIPXVKRSWRBUJV-VQTJNVASSA-N	435.613	1.321	50	20	IDGD	
CCOc1ccccc1C(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)CCl)CC2)CC1	1833313755	PTUNQXMUYXVUJP-IBGZPJMESA-N	437.968	1.870	50	20	IDGD	
Cn1ncc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)c1C(F)(F)F	1833327178	XSSFDQHYQCVANG-SWLSCSKDSA-N	442.797	1.043	50	20	IDGD	
CC(C)CNC(=O)C(=O)N1CCC(N2CCC(NC(=O)CCBr)CC2)CC1	1834421935	WUIIVSLWUULTOT-UHFFFAOYSA-N	445.402	1.115	50	20	IDGD	
C=C[C@@H](O)C(C)(C)C(=O)NC1CCN(C2CCN(C(=O)CO[Si](C)(C)C)CC2)CC1	1835713013	GKPGFFMROFBBNE-LJQANCHMSA-N	439.673	1.983	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1)c1cnc(O)[nH]1	1835961785	HBOQAPYIZPFDPA-UHFFFAOYSA-N	428.331	1.086	50	20	IDGD	
C/C(=C/C(=O)N1CCC(N2CCC(NC(=O)[C@](C)(Cl)CCl)CC2)CC1)C(=O)O	1836400224	AARCJDNXVCAVDW-NJBZPOFQSA-N	434.364	1.825	50	20	IDGD	
CC[C@@H](NC(C)=O)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](C)Br)CC2)CC1	1836618951	LJXFQPGIRFRSON-CXAGYDPISA-N	446.386	1.683	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC(OC2CCN(C(=O)c3nc[nH]n3)CC2)CC1	1836670889	KZPAWLXTCMZLQR-LBPRGKRZSA-N	428.331	1.448	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC(OC2CCN(C(=O)[C@@H]3CC=CCC3)CC2)CC1	1836677214	HQPSEGSPYSQCKC-GOSISDBHSA-N	440.349	1.335	50	20	IDGD	
Cc1nc(CC(=O)N2CCC(OC3CCN(C(=O)[C@H](F)Br)CC3)CC2)no1	1837155723	OHGQXLOJZDMUTI-INIZCTEOSA-N	447.305	1.610	50	20	IDGD	
O=C(c1ccnnc1)N1CCC(OC2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1837427828	IDUZULMLPWLIBS-OAHLLOKOSA-N	429.290	1.779	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccnc(F)c3)C2)C1	1837710275	SCJQLIGRNRCKHG-IBGZPJMESA-N	425.533	1.142	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc4ccoc4c3)C2)C1	1837711237	AEDYKKSVCQBBDD-NRFANRHFSA-N	447.564	1.749	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4nonc4c3)C2)C1	1837712964	BNFBFRUCFMTXQS-FQEVSTJZSA-N	448.552	1.144	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc4ncsc4[nH]3)CCO2)C1	1837752757	FEKHROILYQBXLM-KPZWWZAWSA-N	426.926	1.712	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)[C@@H]3CC3(F)F)CC2)CC1	1838273917	APUGJBSHUDCTQT-INIZCTEOSA-N	430.496	1.013	50	20	IDGD	
CC(C)c1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)n[nH]1	1838698695	UXLCZHVJIFRYET-PBHICJAKSA-N	447.305	1.294	50	20	IDGD	
COc1ccccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1838876804	IDTLEINSJZALPG-QAPCUYQASA-N	445.285	1.456	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cccc([N+](=O)[O-])c3)C2)C1	1839141959	ZFJSMNSEYYCDJO-YLJYHZDGSA-N	439.896	1.611	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3cncc(OC)c3)C2)C1	1839142417	NVHVHPZJFPTDCA-WIYYLYMNSA-N	439.940	1.497	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4cccnc4nc3O)C2)C1	1839148447	YNSXOFBBAKHRRS-HRAATJIYSA-N	448.907	1.423	50	20	IDGD	
O=C(c1cc2cccn2cn1)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840188538	OMVXACCLYAMZOQ-SFHVURJKSA-N	427.288	1.208	50	20	IDGD	
Cn1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)c2cccnc21	1840188596	RZPYCORBWXWXBP-LJQANCHMSA-N	441.315	1.447	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCO)C(=O)N1CCCC12CN(C(=O)CO[Si](C)(C)C)C2	1841430768	HTGQSNDKJFKODA-HNNXBMFYSA-N	443.617	1.317	50	20	IDGD	
CC(C)(C)c1ncccc1C(=O)N1CC2(CCCN2C(=O)c2cnccc2C(=O)NN)C1	1844264036	XAIWXIYKPIJIRM-UHFFFAOYSA-N	436.516	1.508	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC2(CCCN2C(=O)[C@@H]2CC[C@H]3CCC(=O)N3C2)C1	1845074778	FIYIKMBBUAVRKV-ILXRZTDVSA-N	426.355	1.764	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)CCCC(=O)Nc1ccccc1)C2	1846383844	BBVHUOOHBRLROU-UHFFFAOYSA-N	443.548	1.372	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)Cn1ccc2c(F)cccc21	1847536886	GSDFPBDHAWHQQS-OALUTQOASA-N	429.496	1.355	50	20	IDGD	
O=C(CCC(=O)c1ccc2c(c1)CCC2)NNC(=O)c1csc(N2CCOCC2)n1	21967822	HNMWFSYQLYILSB-UHFFFAOYSA-N	428.514	1.893	50	20	IDGD	
CN(c1ccc(OCC(=O)NNC(=O)c2cccnc2)cc1)S(=O)(=O)c1cccs1	27634529	PBICVQKLPNSXAB-UHFFFAOYSA-N	446.510	1.808	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@H]2CC(=O)N(c3cc(C)ccc3OC)C2)cc1OC	28776797	RKKXITGWNRNSJG-HNNXBMFYSA-N	427.457	1.835	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)c1ccccc1F)C(=O)NNc1nc(C)cc(C)n1	29065841	JTVOZQUKUYOBFB-CQSZACIVSA-N	427.527	1.776	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NCc1ccc([C@]2(C)NC(=O)NC2=O)cc1	726283125	WZSKBZPBPITBCO-GTJPDFRWSA-N	443.435	1.178	50	20	IDGD	
C[C@@H](NC(=O)c1n[nH]c2ccccc12)C(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	726381887	JKLWRICJPCSMBG-GFCCVEGCSA-N	433.428	1.034	50	20	IDGD	
COCCOc1ccccc1C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	728216217	UYOVUUPYTRKCHZ-UHFFFAOYSA-N	448.545	1.405	50	20	IDGD	
O=C(O)c1cc(S(=O)(=O)NNC(=O)C2CCN(c3ncccn3)CC2)ccc1Cl	728855938	FHMMAQTVELQFMD-UHFFFAOYSA-N	439.881	1.054	50	20	IDGD	
Cc1nc2[nH]n(C)c(=O)c2c(C)c1CCC(=O)NNC(=O)c1cccc(OC(F)F)c1	729533429	JRLBMIHVZDPTHW-UHFFFAOYSA-N	433.415	1.874	50	20	IDGD	
CCCCC(=O)N1CSC[C@@H]1C(=O)OCC(=O)NNC(=O)c1cccc(Cl)c1	730329719	MQEGCLOSNOPHBI-CQSZACIVSA-N	427.910	1.736	50	20	IDGD	
O=C(CN1CCC([C@@H](O)c2ccc(F)cc2)CC1)NNC(=O)c1ccc([N+](=O)[O-])cc1	731035009	OJKNFSUORSHDHE-FQEVSTJZSA-N	430.436	1.941	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)c1ccccc1)C(=O)NNC(=O)Cc1ccccc1F	731345185	FGDXGGTWBVDHPN-KRWDZBQOSA-N	439.534	1.616	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNS(=O)(=O)c2ccc3c(c2)C(=O)NC3=O)cc1	731593999	AOQLABXVSLNQGL-UHFFFAOYSA-N	431.470	1.618	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)Sc1ccc(S(=O)(=O)N2CCCCC2)cn1	731904701	PKGQQUOYYRJWAG-AWEZNQCLSA-N	428.580	1.930	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2cc(OC)cc(OC)c2)c(F)cc1F	732045172	DXHICCNJRLLVGX-UHFFFAOYSA-N	430.385	1.392	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2cccc(OC(F)F)c2)c(F)cc1F	732047165	IBLZOFUABKIQMA-UHFFFAOYSA-N	436.339	1.976	50	20	IDGD	
COC[C@@H](C)n1c(SCC(=O)NNC(=O)c2c[nH]nc2C)nnc1-c1ccccc1	732084710	YOXYOYJKTMXKRC-GFCCVEGCSA-N	429.506	1.737	50	20	IDGD	
CCc1nc(C(=O)NNC(=O)CCN2C[C@H](C)O[C@H](C)C2)nn1-c1ccccc1Cl	732263442	MPUKIBHKRQWWKH-OKILXGFUSA-N	434.928	1.743	50	20	IDGD	
CCN1CCC[C@H]1CN1C[C@H](C(=O)NNc2nc3ccccc3c(=O)n2CC)CC1=O	733127761	GEZYESSJIVFSNM-CVEARBPZSA-N	426.521	1.192	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NC[C@@H]1OCCc2ccccc21	733335854	FMFIQSXECZDWLX-INIZCTEOSA-N	431.518	1.546	50	20	IDGD	
CC[C@H](C#N)Oc1cc(CNC(=O)NNC(=O)CNC(=O)c2cccs2)ccc1OC	733656023	GDGBUIXKMAJCRG-CQSZACIVSA-N	445.501	1.698	50	20	IDGD	
CCC(=O)N[C@@H](CCSC)C(=O)NNc1ccccc1S(=O)(=O)NC(C)(C)C	734251121	ZXNVCAQWPGJNQS-AWEZNQCLSA-N	430.596	1.854	50	20	IDGD	
O=C(NNc1nccnc1Cl)c1ccc2c(c1)S(=O)(=O)N(C[C@H]1CCCO1)C2=O	734261507	GUNRVVCKZWQJNN-LLVKDONJSA-N	437.865	1.210	50	20	IDGD	
CCOCCCN1CC[C@H](NC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)[C@@H](C)C1	734542041	KGHONLLIUPSIQJ-WMZOPIPTSA-N	444.536	1.659	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)[C@@H]2CS[C@]3(C)CCC(=O)N23)CC1	734826106	XDYRAQJYMBWPBD-ORAYPTAESA-N	441.554	1.170	50	20	IDGD	
O=C(NNC(=O)[C@H]1CSc2ccccc21)c1cccc(S(=O)(=O)N2CCOCC2)c1	735632115	XTRLHPFGLTVWRT-KRWDZBQOSA-N	447.538	1.358	50	20	IDGD	
CN(CC(=O)NN=c1sc2ccccc2n1C)S(=O)(=O)c1cccc([N+](=O)[O-])c1	737467085	FRVJQDUTMJELIQ-UHFFFAOYSA-N	435.487	1.401	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)NCc2cc(F)ccc2N2CCOCC2)c1	740921686	ZFRJSBOVWADJHZ-UHFFFAOYSA-N	432.452	1.824	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(CC(=O)NNC(=O)c2cccc3ncccc23)C(=O)C1	741218179	KZPFTHDGYHRNTR-UHFFFAOYSA-N	427.461	1.075	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)c2nn(-c3cccc(Br)c3)c3c2CCC3)cn1	741568607	PRPUIRVMOGYVSX-UHFFFAOYSA-N	429.278	1.932	50	20	IDGD	
COc1ccc(OCCS(=O)(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)cc1	742025155	JIWAOOTXESKNNY-UHFFFAOYSA-N	440.474	1.364	50	20	IDGD	
Cc1ccc(S(=O)(=O)NNC(=O)c2ccc[nH]2)cc1S(=O)(=O)N1CCCCC1	743251888	XHEOKXWWQZEMCJ-UHFFFAOYSA-N	426.520	1.121	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NC[C@@H](C)N2CCC(C)CC2)nc1	743341161	UHJCUDZKVHGTFB-MRXNPFEDSA-N	426.587	1.859	50	20	IDGD	
O=C(CCN1C(=O)[C@H]2CCCC[C@H]2C1=O)NNC(=O)c1cc(Br)ccc1O	743732042	IPNIHJKAXYMMOJ-TXEJJXNPSA-N	438.278	1.481	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)NCc1ccccc1OCCN1CCOCC1	744292058	NLDVHHCJYZLRFT-UHFFFAOYSA-N	430.480	1.610	50	20	IDGD	
C[C@H](NC(=O)C1CCCCC1)C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	744621706	ZGXBMTFVTDNAIC-HNNXBMFYSA-N	438.550	1.236	50	20	IDGD	
CCc1nc(C(=O)OCC(=O)NNC(=O)c2cccc(C)c2)nn1-c1ccccc1F	745239058	JWESWBCKGWSMOP-UHFFFAOYSA-N	425.420	1.895	50	20	IDGD	
C[C@H](CCOc1ccccc1)C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	745765078	NRSCYAPFYUQTPG-BEFAXECRSA-N	428.441	1.622	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)N[C@H]3C[C@@]3(C)c3ccccc3)nc2)CC1	745859461	YZUSOTKCISYERJ-RXVVDRJESA-N	444.561	1.374	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2cc(C(=O)NNC(=O)N3CCOCC3)ccc2C)cc1	745992819	LDGRREUDLVYFGO-UHFFFAOYSA-N	432.502	1.791	50	20	IDGD	
O=C(NCCNS(=O)(=O)c1cccs1)NNC(=O)c1c(Cl)cccc1Cl	746721935	OBQIBBQHCOTBOJ-UHFFFAOYSA-N	437.330	1.977	50	20	IDGD	
COC[C@H](Cc1ccccc1)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	746781865	KQDCNUQRNSMKHA-KRWDZBQOSA-N	434.518	1.139	50	20	IDGD	
O=C(NCCNS(=O)(=O)c1cccs1)NNC(=O)c1ccc(Cl)cc1Cl	747437368	IUFKJFJWVKSCKW-UHFFFAOYSA-N	437.330	1.977	50	20	IDGD	
NC(=O)NCCCCCC(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1	747787832	XIOSXVCSBAIKOL-OAQYLSRUSA-N	437.544	1.990	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1)c1nncn1C	747979002	AMODHWJTXUBCLS-UZLBHIALSA-N	433.516	1.834	50	20	IDGD	
COCCOCC(=O)NC1CCC(C(=O)NNC(=O)Cc2ccc(Cl)cc2)CC1	748700618	SIQZDJCKACYNGU-UHFFFAOYSA-N	425.913	1.368	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)c3cccc(Cl)n3)CC2)cc1	749563475	MISCZMMWSJKMRH-UHFFFAOYSA-N	436.921	1.905	50	20	IDGD	
N#CCNC(=O)/C(C#N)=C/c1cn(CCC(N)=O)nc1-c1ccc(Br)cc1	749603842	MZLSBKMFFMRLIT-UKTHLTGXSA-N	427.262	1.735	50	20	IDGD	
C[C@H]1C(=O)Nc2cc(C(=O)OCC(=O)NNC(=O)c3ccc(Cl)cc3)ccc2N1C	750564697	CXAOIPQXZFXSPU-NSHDSACASA-N	430.848	1.735	50	20	IDGD	
O=C(O)CCC(=O)c1ccc(S(=O)(=O)NNC(=O)NCCc2cccs2)cc1	751213078	PLCMZIFDLFJSLZ-UHFFFAOYSA-N	425.488	1.531	50	20	IDGD	
O=C(NCCOc1ccccc1Cl)NNC(=O)c1csc(N2CCOCC2)n1	752126320	GWKBXRSRFDIJTH-UHFFFAOYSA-N	425.898	1.656	50	20	IDGD	
O=C(NNC(=O)N1CC[C@@H](Oc2ccccc2Cl)C1)c1ccc(-n2cnnn2)cc1	752126857	LTFHVLHTRZXFNB-OAHLLOKOSA-N	427.852	1.823	50	20	IDGD	
CO[C@H](C)c1nc(CNC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cs1	753059033	WGJNWONENBDCIZ-MRXNPFEDSA-N	446.577	1.893	50	20	IDGD	
C[C@H](C(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)c1ccc(S(C)(=O)=O)cc1	753427266	DGFDUOFORGVTSK-LBPRGKRZSA-N	439.515	1.450	50	20	IDGD	
Cn1cc(NS(=O)(=O)c2ccsc2C(=O)NNc2cc(Cl)nc(N)n2)cn1	753452895	WWXCJNFFZMBJGC-UHFFFAOYSA-N	428.887	1.065	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)c1csc([C@H]2CCCO2)n1	755387367	XVECWUJOAPZJJS-GOSISDBHSA-N	429.546	1.968	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)Nc1ccc(C)c(S(=O)(=O)N(C)C)c1	755392531	HWIYNWHNKGSEHA-UHFFFAOYSA-N	436.490	1.486	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)Nc2cc(C3CC3)nn2[C@@H]2CCS(=O)(=O)C2)c(O)c1	756856426	PMLJQTPLTPOPJB-CYBMUJFWSA-N	433.490	1.601	50	20	IDGD	
Cc1cc(C(=O)N2CCOCC2)ccc1NC(=O)NNC(=O)COc1ccc(F)cc1	757829032	BMFPJXOUCQPDJW-UHFFFAOYSA-N	430.436	1.838	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2cnn(C(F)F)c2)c1	757865980	IMZVIXFGFHFYLN-UHFFFAOYSA-N	430.437	1.775	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)CCc1nc2cc(Br)ccc2s1	758047533	YAAYDYULSLNOOH-QMMMGPOBSA-N	449.352	1.077	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)c1cnn(CCO[C@@H]2CCCCO2)c1C	758060940	PYAWWBLKFMMCEX-HXUWFJFHSA-N	432.477	1.583	50	20	IDGD	
CSCC[C@H](NC(=O)c1ccc([N+](=O)[O-])o1)C(=O)NNc1nc(O)c2ccccc2n1	758300394	WUDHXCNXKHQULQ-LBPRGKRZSA-N	446.445	1.831	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)N[C@@H]2CN(C(=O)OC(C)(C)C)C[C@@H]2C#N)c1	758770512	LIGLZYWUXUHYBO-DOTOQJQBSA-N	431.493	1.772	50	20	IDGD	
N#C/C(=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)NC[C@@H](O)C1CC1	759644246	QLTHTKGTMIXSCO-IKFRKZOMSA-N	427.892	1.873	50	20	IDGD	
CCC(CC)[C@H](C)C(=O)NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1	761486551	ARTYMHOJRBVTLH-KRWDZBQOSA-N	438.594	1.521	50	20	IDGD	
CCc1ccc(C(=O)O)cc1S(=O)(=O)NNC(=O)CCCNC(=O)OC(C)(C)C	763439749	QRTGQRKKCFWZPU-UHFFFAOYSA-N	429.495	1.562	50	20	IDGD	
C[C@@H]1COCCN1c1ccc(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3n2)cc1	763450572	QDXIDNKTQDRMQJ-OAHLLOKOSA-N	433.468	1.860	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@H](C)C(=O)NNC(=O)c1ccnc2c(C(N)=O)cnn12	763457441	AQLQOJFDXKEBMW-LLVKDONJSA-N	430.852	1.327	50	20	IDGD	
Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)C(=O)NNC(=O)c1ccccn1	763468272	VXSFQJSDGGVYIC-GOSISDBHSA-N	447.499	1.433	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2ccccc2Br)cccc1-n1cnnn1	763483564	RDJWZRLTBOBOJR-UHFFFAOYSA-N	444.249	1.133	50	20	IDGD	
Cc1c(C#N)cccc1NC(=O)C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	763531765	QXPWWCXYTIRWRK-UHFFFAOYSA-N	434.500	1.165	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cccc3c2OCCC3=O)cc(OC)c1OC	763540127	RMEZBKCJHXETKA-UHFFFAOYSA-N	443.412	1.077	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)cc(OC)c1C(C)C	763548519	MFBPUCCIZMBJSU-UHFFFAOYSA-N	429.429	1.956	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)Nc1ccc2nc(C(F)F)[nH]c2c1	763574855	KJPOQUZEVVPUBX-AWEZNQCLSA-N	431.355	1.426	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(Cl)c(NC(C)=O)c2)cc1	763660371	AWEKMHHDLUAGLJ-UHFFFAOYSA-N	434.836	1.472	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)c(OC)c1OC	763685554	XPGSRORGKLGYAD-UHFFFAOYSA-N	437.836	1.531	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)CCN3C(C)=O)c1	763772985	RMUQTLFHXBMMMI-UHFFFAOYSA-N	426.429	1.013	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(C(C)(C)C)cc2)cc1OCC(N)=O	763801552	XEGBAAOQDJPXNL-UHFFFAOYSA-N	442.472	1.257	50	20	IDGD	
CN(C)c1c(Cl)cccc1NC(=O)C(=O)NNC(=O)COc1ccccc1[N+](=O)[O-]	763804983	PUYCPUPGICZWIA-UHFFFAOYSA-N	435.824	1.479	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc([S@@](C)=O)c(F)c2)c1C	763847554	DCVCIOBGTZSOSU-GNDSEDMPSA-N	435.477	1.733	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2c[nH]nc2-c2ccccn2)cc1	763861839	QZJMJYJQOWVSQT-ZDUSSCGKSA-N	438.444	1.424	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)NC(=O)CC3)cc1	763862729	ZXDJVICOXQKBNM-CYBMUJFWSA-N	440.456	1.523	50	20	IDGD	
C=CCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)cc1	763871631	IBZBVBLPEYHCHY-ZDUSSCGKSA-N	428.420	1.295	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)ccc1C(=O)NC(C)C	763872806	PABFIZTYSOXZMV-AWEZNQCLSA-N	444.463	1.826	50	20	IDGD	
CN1CC(=O)N(c2cccc(NC(=O)C(=O)NNC(=O)Cc3ccc(Cl)cc3)c2)C1=O	763933062	WKGPMEYUEJMZGX-UHFFFAOYSA-N	443.847	1.067	50	20	IDGD	
O=C(NNC(=O)c1cc(Cl)ccc1O)C(=O)Nc1cccc(N2CCCNC2=O)c1	763974849	ZRJYCEWSTNWYJJ-UHFFFAOYSA-N	431.836	1.365	50	20	IDGD	
O=C(NNC(=O)c1cc(Cl)ccc1O)C(=O)Nc1cc(N2CCCC2=O)ccc1F	763978555	LINBUQUNXJUVRX-UHFFFAOYSA-N	434.811	1.711	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)C(=O)Nc1ccccc1OCC(F)F	763995887	RQCQOZXQMYJMFI-UHFFFAOYSA-N	431.193	1.821	50	20	IDGD	
COC(=O)c1ccc(OCc2ccccc2)c(NC(=O)C(=O)NNC(=O)c2cnccn2)c1	764031189	HZFLKAQFTNMKNE-UHFFFAOYSA-N	449.423	1.242	50	20	IDGD	
Cc1cc(C(=O)N2CCCC2)ccc1NC(=O)C(=O)NNC(=O)c1ccc(Cl)nc1	764099479	ARRCXZBSTKGQON-UHFFFAOYSA-N	429.864	1.679	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2cccc(NC(=O)[C@@H](C)OC)c2)cc1	764128114	ZPPIQPQJEKXKOP-CQSZACIVSA-N	442.472	1.387	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)CCCC(=O)N3)o1	764138968	MRTNDTXCRTWOLY-UHFFFAOYSA-N	441.488	1.796	50	20	IDGD	
C[C@H](C(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2cccc(C#N)c2)c1)n1cccn1	764233255	VMWNJJZGEDWECI-CQSZACIVSA-N	445.439	1.354	50	20	IDGD	
CCN1CCN(Cc2ccc(NC(=O)C(=O)NNC(=O)c3cccc(C#N)c3)cc2)CC1	764233517	ADRFUACFJAJJKT-UHFFFAOYSA-N	434.500	1.095	50	20	IDGD	
CNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cccc(OC(F)F)c2)cc1Cl	764251624	WHJOCGWHVZIBAO-UHFFFAOYSA-N	440.790	1.701	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccccn2)cc1I	764268275	PEKXERCZNOSNMD-UHFFFAOYSA-N	438.225	1.323	50	20	IDGD	
O=C(Cc1ccccn1)NNC(=O)C(=O)Nc1cccc(F)c1I	764270252	JJSGCLFBTFQXPO-UHFFFAOYSA-N	442.188	1.154	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(N3CCN(CC4CC4)CC3)c2)o1	764370930	IVLSVKYEDSDPSC-UHFFFAOYSA-N	425.489	1.520	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2cccs2)[nH]n1)C(=O)Nc1cccc2c1OCCC2=O	764376386	CKTKNWOHOXFIJZ-UHFFFAOYSA-N	425.426	1.503	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1ccnn1-c1ccncc1	764392702	KEUAQXPDBOLNRS-UHFFFAOYSA-N	426.458	1.154	50	20	IDGD	
COCCOc1ccc(F)cc1NC(=O)C(=O)NNC(=O)CSc1ccccc1O	764393205	DSBZNDVBDDFOMU-UHFFFAOYSA-N	437.449	1.435	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COCCO1)C(=O)Nc1ccc(Sc2ccccc2Cl)cc1	764427580	AGHNXTZXOPICTE-HNNXBMFYSA-N	435.889	1.993	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NN=Cc3cn4ccccc4n3)CC2)cc1	764816365	JGLRRZBJVASMBJ-UHFFFAOYSA-N	440.529	1.099	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NN=Cc1cc(Cl)c2c(c1)OCO2	764829013	VDGMPPWLDMTHKD-UHFFFAOYSA-N	428.876	1.977	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)cc1N1CCNC1=O	765321482	BVFSUWDUAUSFRL-UHFFFAOYSA-N	435.481	1.291	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)c1ccc([N+](=O)[O-])s1	765759047	STRNBRLGWAZVAY-UHFFFAOYSA-N	437.909	1.889	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](OCC(=O)NNC(=O)c2cc(Br)c[nH]2)C1	767816332	ZZZNVOPAJYUEAG-GFCCVEGCSA-N	445.314	1.954	50	20	IDGD	
NS(=O)(=O)c1ccc(C(=O)NNC(=O)c2ccccc2OCc2ccc(F)cc2)nc1	769738927	QAPRGABATQTNHL-UHFFFAOYSA-N	444.444	1.522	50	20	IDGD	
CSCCNC(=S)NNC(=O)[C@@H]1CCCN(C(=O)c2ccccc2OC(F)F)C1	769770348	VBXVMEKOQRHAOM-GFCCVEGCSA-N	446.545	1.999	50	20	IDGD	
COc1ccccc1[C@@]1(C)NC(=O)N(CC(=O)NNC(=O)c2cccc(Cl)c2)C1=O	771221246	FMBCBKWHZMIRSV-HXUWFJFHSA-N	430.848	1.577	50	20	IDGD	
Cc1cn2c(=O)c(C(=O)NNC(=O)COc3ccc(Br)cc3)cnc2s1	771597071	GPNLKKNGQYUYMK-UHFFFAOYSA-N	437.275	1.667	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1cc(S(=O)(=O)N(C)C(C)C)ccc1Cl	771873533	HHVGAMJAHKNXQH-LLVKDONJSA-N	433.914	1.472	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1ccc2c(c1)S(=O)(=O)c1ccccc1C2=O	771888716	DSVITPUMPJICSH-LLVKDONJSA-N	430.438	1.167	50	20	IDGD	
CC(C)CNC(=O)N1CCC[C@H](C(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)C1	772884003	HAWHWRLSBHYTGR-HNNXBMFYSA-N	437.928	1.181	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNS(=O)(=O)c1cnn(CC(F)(F)F)c1	773252659	VXDCDWLXFUIKNI-VIFPVBQESA-N	426.804	1.876	50	20	IDGD	
Cc1ccc(-n2nccc2NC(=O)C(=O)NNC(=O)c2ccccc2Br)nn1	773493275	XZMFMFRZMURBIB-UHFFFAOYSA-N	444.249	1.133	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2ccc(F)c(NC(=O)Cc3ccccc3)c2)n1	773732408	YILTVMMJAMQOLM-UHFFFAOYSA-N	438.419	1.887	50	20	IDGD	
O=C(COC(=O)c1ccc(-c2cncnc2)cc1F)NNC(=O)c1ccc([N+](=O)[O-])cc1	775097071	VUJMHKUZJCMPJD-UHFFFAOYSA-N	439.359	1.809	50	20	IDGD	
O=C1CN(S(=O)(=O)c2cccc(C(=O)NNc3ncc(Cl)cc3Cl)c2)CCN1	775264548	FKKCACVIKRIJME-UHFFFAOYSA-N	444.300	1.266	50	20	IDGD	
CC[C@@H](C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1)c1ccc(OC)cc1	775946221	UJHXGKBSPNDKJK-VQIMIIECSA-N	428.441	1.719	50	20	IDGD	
CC(=O)N1c2ccccc2C[C@H]1C(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776204805	GXDJSDBTYDGJFG-SFHVURJKSA-N	445.520	1.600	50	20	IDGD	
CC(=O)N1CCN(c2cccc(NC(=O)NNC(=O)COc3ccc(C)cc3)c2)CC1	782080429	TWPBKAJVSQGEHK-UHFFFAOYSA-N	425.489	1.895	50	20	IDGD	
Cc1ccc2cccc(NC(=O)C(=O)NNc3ccc(S(=O)(=O)NC(C)C)cn3)c2n1	783263917	MSONKFOILWKMEK-UHFFFAOYSA-N	442.501	1.707	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2Cl)cc1-n1cnnn1	784384210	TZCALZPZQLGWRW-UHFFFAOYSA-N	432.784	1.314	50	20	IDGD	
CN(C)c1nccc(NNC(=O)C(=O)Nc2ccn(-c3cccc(C(F)(F)F)c3)n2)n1	784970802	NKVWQSXJRRKBNM-UHFFFAOYSA-N	434.382	1.829	50	20	IDGD	
CCN(Cc1ccccc1NC(=O)C(=O)NNc1nccc(N(CC)CC)n1)C(C)=O	785225584	IGWNYQATXJANEE-UHFFFAOYSA-N	427.509	1.773	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1ccc(OC)c2ncccc12	785331446	VFSOQHFVCJYSPG-UHFFFAOYSA-N	444.469	1.737	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(C(=O)[C@H](C)OC(=O)/C(C#N)=C\C3CC3)CC2)cc1	786677387	HIKIXHMWQQPEOT-CQUHBBLWSA-N	431.514	1.620	50	20	IDGD	
COc1cc(F)ccc1NNC(=O)c1ccc(OC)c(S(=O)(=O)N2CCOCC2)c1	788183827	CLDVATYZLKMMPI-UHFFFAOYSA-N	439.465	1.621	50	20	IDGD	
CC(C)(C)C(=O)NC1CCC(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)CC1	788733802	ABONGFFQNTXARW-UHFFFAOYSA-N	437.566	1.462	50	20	IDGD	
COc1c(C)cnc(Cn2cnc(NC(=O)C(=O)NNc3cc(F)c(F)cc3F)n2)c1C	789762832	VODVSMHBOODWND-UHFFFAOYSA-N	449.393	1.846	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)NC[C@@H]2CC[C@H](O)C2)cc1	789856762	BRYMGRHRTBZYOX-KEWDKPQNSA-N	437.500	1.618	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccccc1N1C[C@H]2CC[C@H]1C2	790952224	PUJHPPZTQPTWPP-HOCLYGCPSA-N	426.448	1.979	50	20	IDGD	
CN1CCN(C(=O)c2ccccc2NC(=O)C(=O)NNc2cccc(F)c2[N+](=O)[O-])CC1	790994367	VPLIDYJQDJDZSZ-UHFFFAOYSA-N	444.423	1.203	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)/C=C/c1ccccc1)C(=O)NNc1nc2ccccn2n1	791253198	QZGCYFCPDGKJLU-UKYUDJEDSA-N	446.558	1.884	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)cc(-n2cccn2)c1	792355049	NWEHKWFIWWGCPM-UHFFFAOYSA-N	447.249	1.371	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2cccc(CS(=O)(=O)NC(C)(C)C)c2)n1	797370153	HCBZHEDKJHWRPN-UHFFFAOYSA-N	447.517	1.008	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)Cc3ccc([S@](C)=O)cc3)n[nH]2)cc1OC	797964517	JXMYBYXBTZRGRO-HKBQPEDESA-N	442.497	1.835	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1ccn(-c2cccc(C#N)c2)n1	798833198	CNJWWAYPPSHOTF-UHFFFAOYSA-N	437.485	1.420	50	20	IDGD	
COc1ccc(S(N)(=O)=O)cc1C(=O)NNc1cc([N+](=O)[O-])ccc1Br	800620598	WAKPYKWWTSFNHG-UHFFFAOYSA-N	445.251	1.770	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)NCC2(OCCO)CCOCC2)c(C)n1C[C@@H]1CCCO1	800670037	YUDGQCCYJHKXQC-OABJIQBASA-N	431.533	1.865	50	20	IDGD	
Cc1cc(Cl)ccc1Cc1cnc(NC(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)s1	806792933	QLUPYSOLSMEMSF-JTQLQIEISA-N	445.954	1.786	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2cc(F)c(Br)c(Cl)c2)CCS(=O)(=O)C1	807001434	ZZNQAGYIRUHHHI-ZDUSSCGKSA-N	442.694	1.378	50	20	IDGD	
COCC1(CNC(=O)NNC(=O)CC(F)(F)F)CCN(C(=O)OC(C)(C)C)CC1	807268226	NIQCOUOYJQEPOU-UHFFFAOYSA-N	426.436	1.933	50	20	IDGD	
CCC(=O)Nc1ccc(Cl)c(NC(=O)C(=O)NNc2ccc(-n3ccnc3)nn2)c1	807428984	NNMFMVXGPRDGAS-UHFFFAOYSA-N	428.840	1.746	50	20	IDGD	
COc1cc(Br)cc(NC(=O)C(=O)NNc2ccc(-n3ccnc3)nn2)c1	807429876	ZSEKTFDIHJADRC-UHFFFAOYSA-N	432.238	1.515	50	20	IDGD	
CC[C@@H]1[C@@H](C(=O)NNC(=O)CCN2C[C@H](C)O[C@H](C)C2)CCN1C(=O)OC(C)(C)C	809981609	QWHVOKKYEGDAET-VVLHAWIVSA-N	426.558	1.669	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)c2cc(S(=O)(=O)NC)ccc2C)cc1OC	811890020	FYBLDPYEYPGVQB-UHFFFAOYSA-N	435.502	1.775	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)N[C@H](C)c2noc(COC(C)C)n2)nc1	812645024	ZRVLBSOKFWNVOZ-GFCCVEGCSA-N	441.514	1.464	50	20	IDGD	
CCCc1nnc(SCC(=O)NNC(=O)c2cc(-c3cc(C)ccc3C)[nH]n2)n1N	813502417	RVIBWPHFTMPNHQ-UHFFFAOYSA-N	428.522	1.505	50	20	IDGD	
CC(=NNC(=O)c1csc(N2CCOCC2)n1)c1ccc(N2C(=O)CCC2=O)cc1	814214489	CSKKETZIFXTGTI-UHFFFAOYSA-N	427.486	1.787	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)c2cnn(C)c2I)cc1OC	814757478	CYYOMCHKYWWDDC-UHFFFAOYSA-N	444.229	1.507	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2nc(C(C)(C)C(=O)OC)cs2)n1	815611435	LATVYKIXKNVHMV-UHFFFAOYSA-N	435.510	1.312	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)NCc2ccco2)c1)c1ccc([N+](=O)[O-])cc1	912764955	MPEZKUUFMJWNPH-UHFFFAOYSA-N	444.425	1.741	50	20	IDGD	
CSC[C@H](C(=O)NNC(=O)c1ccc2ccccc2n1)N1C(=O)[C@H]2CCCC[C@@H]2C1=O	912766815	PUEXULZPJTYIPT-RLFYNMQTSA-N	440.525	1.903	50	20	IDGD	
Cc1ccc(-c2nc(CC(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)cs2)o1	914748307	UOWSEMKKUQGQQL-UHFFFAOYSA-N	448.526	1.966	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)NC[C@@]1(N2CCOCC2)CCSC1	915257869	MSUDSCBGBGZNJE-SFHVURJKSA-N	428.942	1.501	50	20	IDGD	
CCO[C@@H]1C[C@@H]1C(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccc(OC)cc2)c1	916095742	QPEDUSWQZKCDJL-ZWKOTPCHSA-N	433.486	1.682	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)N[C@@H](CN1CCCC1=O)c1ccccc1	916459795	MLIPSSGEMBOHME-SFHVURJKSA-N	448.483	1.886	50	20	IDGD	
CCOC(=O)c1c(S(=O)(=O)NNC(=O)c2cc(C)n(-c3ccccc3)c2C)n[nH]c1C	917717029	LGDXBEOIXSUFCD-UHFFFAOYSA-N	445.501	1.926	50	20	IDGD	
CC(C)n1nc(C(=O)NNS(=O)(=O)c2cc(F)ccc2[N+](=O)[O-])c2ccccc2c1=O	917722434	UXEROVWBYXEHIL-UHFFFAOYSA-N	449.420	1.648	50	20	IDGD	
CN(C)C(=O)c1cccc(S(=O)(=O)NNC(=O)c2ccc(Br)s2)c1	917728293	VJDBLVPPNONQTQ-UHFFFAOYSA-N	432.321	1.836	50	20	IDGD	
Cc1nc2nc(N)nn2c(C)c1CC(=O)NNC(=O)c1ccc(F)cc1Br	918340357	LWKAYTVPFGTJJG-UHFFFAOYSA-N	436.245	1.229	50	20	IDGD	
Cc1nnc(NNC(=O)CCc2nc(-c3cc(Br)cs3)no2)nc1O	919744706	WRWNQVSWJUFXLK-UHFFFAOYSA-N	426.256	1.836	50	20	IDGD	
CN(C)C(=O)CNC(=O)/C(C#N)=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	920851977	MBDCMHYCFDQQCG-NTEUORMPSA-N	428.880	1.190	50	20	IDGD	
CCOC(=O)C1CCC(NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)CC1	921118384	RFSWXXYKSWTPFC-UHFFFAOYSA-N	445.564	1.651	50	20	IDGD	
CC(=O)N1C[C@@H]2CCC[C@H](NC(=O)NNC(=O)Nc3ccc(S(C)(=O)=O)cc3)[C@H]2C1	1117497568	UQTSMIKDQWALFV-JQFCIGGWSA-N	437.522	1.073	50	20	IDGD	
CC(C)c1noc(CCNC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)n1	1251743002	BUARPVUPWSCOIT-UHFFFAOYSA-N	429.525	1.278	50	20	IDGD	
Cc1ccc2c(c1)S[C@@H](C(=O)OCC(=O)NNC(=O)[C@@H]1COc3ccccc3O1)C2	1317766410	SPXHTNIYVFQBOM-FUHWJXTLSA-N	428.466	1.542	50	20	IDGD	
COC(=O)C(=O)NNC(=O)N[C@@H](c1ccc(Cl)cc1)c1cccc(S(C)(=O)=O)c1	1318941280	IFCYOIXIOZRKMA-HNNXBMFYSA-N	439.877	1.336	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)CC2(CC(=O)N3CCOCC3)CCCC2)nc1C	1320004383	AGMRGGDTIPJXDJ-UHFFFAOYSA-N	433.509	1.604	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)NCCN1C(=O)COc2ccccc21	1322149836	OZICDJHSLKKRRY-CYBMUJFWSA-N	432.864	1.863	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)(F)F)cc1)[C@@H]1CC12CCS(=O)(=O)CC2	1323279683	REYGHDNYXUGZCQ-LBPRGKRZSA-N	426.438	1.638	50	20	IDGD	
O=C(NNC(=O)c1cncn1-c1ccccc1)NC1CCN([C@H]2CCCC[C@H]2O)CC1	1324087205	KAQCANIFWHLUAQ-AZUAARDMSA-N	426.521	1.584	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NN=C[C@H](C)CNC(=O)OC(C)(C)C)cc1	1327707735	XVRKGXQIRJNVJU-OAHLLOKOSA-N	426.539	1.878	50	20	IDGD	
COc1ccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@](C)(Cl)CCl)C3)nn1	1779952540	MSALGNQDWPXSLO-NIKGAXFTSA-N	445.347	1.849	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4c(c3)NC(=O)[C@H](C)O4)C2)C1	1780179598	SGKZVMISCCJRBH-YHQOMNDMSA-N	435.908	1.867	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C2(N3CCN(C)CC3)CC2)C1	1780652302	UHBLNGBBCHVSCJ-DBXWQHBBSA-N	441.016	1.298	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](Cl)COC)C2	1781904656	AAHFJVKLNGKTEU-SZOQZIPDSA-N	439.778	1.928	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnn4c3OCCC4)C2)C1	1782281633	HWFWRKMLOYCARP-RDTXWAMCSA-N	441.326	1.283	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3c[nH]c4cccc(OC)c34)C2)C1	1782375542	KKJSJJSNPGPFEJ-YCRPNKLZSA-N	435.908	1.874	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cnc(OCF)cn3)CCO2)C1	1783343903	KVBZPYUGEPAKMD-YVEFUNNKSA-N	445.289	1.399	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccn(C(F)F)n3)CCO2)C1	1783349517	MPORLPPJRRSTPQ-BZNIZROVSA-N	435.269	1.895	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](C)Oc1ccccn1)CCO2	1783354014	LXSCTNONCCTIPI-VCBZYWHSSA-N	440.338	1.852	50	20	IDGD	
COc1nccc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](C)Br)C3)C2)c1F	1783532035	CAWPUDIIKPLZTF-GTNSWQLSSA-N	430.274	1.456	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(Cl)c4nncn4c3)CCO2)C1	1783877651	MQDSQTIZPKLYOJ-KDOFPFPSSA-N	442.303	1.080	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H]1CCCN1Cc1ccccc1)CCO2	1783878624	IFYRHFSONWTVSQ-SXWKCWPCSA-N	449.979	1.735	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3c(OC)cccc3OC)CCO2)C1	1783882630	QYTBQIBZVODCOT-XOBRGWDASA-N	426.897	1.401	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(C(=O)OC)nc3)C[C@@H]21	1784618543	QWEQEUPCPLQKOW-OVWQWFNUSA-N	437.924	1.869	50	20	IDGD	
O=C(C(Cl)Cl)N1CC[C@H]2CO[C@@H](CNC(=O)C(F)(F)C(F)(F)C(=O)O)[C@H]2C1	1784918116	DHTAZWSQPSSJOW-FXQIFTODSA-N	439.189	1.125	50	20	IDGD	
C[C@@H](C(=O)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1)C1(O)CCC1	1785830526	YWSZKMQLOXAQJD-INIZCTEOSA-N	436.317	1.665	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](CN)c3ccccc3)[C@H]2C1	1786922780	DJXRJMMTXOEZSE-MUGJNUQGSA-N	433.625	1.560	50	20	IDGD	
O=C(CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]2C1)Nc1ccc(F)cc1	1787449012	LGNDPZKHESXRPT-HEWDHTHVSA-N	429.851	1.668	50	20	IDGD	
Cn1nc2c(c1C(=O)NC[C@@H]1OC[C@@H]3CCN(C(=O)CO[Si](C)(C)C)C[C@@H]31)CCC2	1790460949	HKWGKMWINGPSGE-ZVZYQTTQSA-N	434.613	1.354	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnnc(Cl)c3)C[C@@H]21	1790960705	BRIYVGJUZTUGFT-DEQVHRJGSA-N	445.745	1.897	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C=C/c3cnc[nH]3)[C@H]2C1	1791501980	SDCPOCMJQUSKEQ-JKMKLXDYSA-N	425.327	1.434	50	20	IDGD	
Cc1cc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)CBr)C[C@@H]32)no1	1791530829	GMHLEESQYYUFTC-XTBFLFJDSA-N	428.327	1.536	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1ccc(C2(NC(=O)[C@@H](COC)NC(C)=O)CCC2)cc1	1791569382	TWRNOLANSYFGBG-IAGOWNOFSA-N	425.913	1.525	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1ccc(C2(NC(=O)c3nccnc3C(N)=O)CCC2)cc1	1791569558	XMJYAIRPGCIKAC-CQSZACIVSA-N	431.880	1.577	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)Sc3ccccn3)[C@H]2C1	1791580775	QWWVVPUIXANGFK-VIQHNZTISA-N	441.981	1.796	50	20	IDGD	
O=C([C@@H](F)Br)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1(c2ccccc2)CC1	1792525396	FYIQOXHJAQAZKI-OCVGTWLNSA-N	425.298	1.998	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)C(=O)c1ccc(Cl)cc1	1792949211	DCUAXRONSVHMTN-NDPMZMCLSA-N	447.688	1.803	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCl)[C@@H]1CC(=O)N(Cc2ccccc2)C1	1793107082	NDRFCMUYPJDFFG-FQBWVUSXSA-N	433.936	1.273	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCl)C1CN(C(=O)OCc2ccccc2)C1	1793112347	FDUBFGIKJVPISD-FCGDIQPGSA-N	449.935	1.493	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H]1CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2	1793649711	IRKQKCHMVHKEMH-AEKWLRTRSA-N	447.935	1.900	50	20	IDGD	
COc1cccnc1CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Br)C2	1794032928	ZURATKFXPWTQFA-ZUMXRPEOSA-N	440.338	1.396	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C[C@@H](N)c1cccnc1	1795681500	FEDBICNJDUCBML-WXQHOCMDSA-N	439.354	1.235	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccnc(C(F)F)c1)C2	1798440687	KNGWOIFCLSNGOM-BTTYYORXSA-N	444.442	1.583	50	20	IDGD	
CC(=O)OC[C@H](OC(C)=O)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](C)CBr)C2	1798470258	MUUMVIYZRROBAD-URXAQBOPSA-N	447.326	1.150	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1(c2ccc(F)c(F)c2)CC1	1799067932	KHBUESUVDVCTDH-HRJSJKBJSA-N	442.890	1.840	50	20	IDGD	
O=C(Cc1n[nH]c2cc(Cl)ccc12)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2	1799078764	JQNYDZOROZJGGU-HPQBHAKGSA-N	429.279	1.883	50	20	IDGD	
O=C([C@@H](O)CCl)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1(c2ccc(Cl)cc2)CC1	1800395807	RICFJZAUNVKYAI-RMHZUWNSSA-N	427.328	1.561	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](O)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](F)Br)C2	1800599652	ARCRZRMMSOTYRB-VGDATSSVSA-N	438.294	1.158	50	20	IDGD	
COc1cccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)Br)n1	1800757326	PFMRSTMBSZLGGH-JRATXPSKSA-N	426.311	1.006	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CC(c3ccccc3)=NO1)C2)C(Cl)Cl	1801015899	WWZYYRCRNBBQSM-XRGAULLZSA-N	426.300	1.573	50	20	IDGD	
CC(C)(CCl)C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1802899414	ARQZMXHPQGGYTD-PKOBYXMFSA-N	443.740	1.346	50	20	IDGD	
Cc1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)c(Cl)c1	1803624380	FOFFZYOGMYKLDL-BCDXTJNWSA-N	426.709	1.894	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)Cc2cccc(OC)n2)[C@H]1c1cccnc1	1804395362	HRLZBBYOFYKWTQ-DJPFJPOOSA-N	446.935	1.988	50	20	IDGD	
COc1ncccc1CCC(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1	1804540521	KJVMBHDXSKGXGO-NLWGTHIKSA-N	446.935	1.724	50	20	IDGD	
O=C(c1cc(Cl)c2nncn2c1)N1CCC2(CCCN(C(=O)[C@@H](O)CCl)C2)CC1	1805523521	WZCSHCJIBMZIHG-HNNXBMFYSA-N	440.331	1.827	50	20	IDGD	
CCC1(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)CCC1	1807374708	HVOLBDCHSFFUKH-FPOVZHCZSA-N	435.333	1.661	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)Cn2ccccc2=O)[C@H]1c1cccnc1	1807441177	FJEILYUBPISCEG-URLQWDBASA-N	447.333	1.733	50	20	IDGD	
CC(C)=CCCC(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1807971924	BXNMPMRSSJZWPG-NZQKXSOJSA-N	435.333	1.827	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)c1noc2c1CCCC2	1808021599	PTVNZNOVQYUGRX-ZSZQSSIHSA-N	432.908	1.868	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)c3cc4ccoc4cn3)CC2)C1	1809974638	XTNMMCCPOBIKKC-UHFFFAOYSA-N	447.300	1.666	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1CCN(C(=O)CCS(C)(=O)=O)[C@H]1c1cccnc1	1810548111	NMTJTLNCZHOHJQ-LPHOPBHVSA-N	441.626	1.374	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)[C@H]2CCCS2(=O)=O)[C@@H]1c1cccnc1	1812497461	KTUANUFPBAUYGQ-TWMKSMIVSA-N	427.954	1.682	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H](CNC(=O)CCn2ccnn2)[C@H]1c1cccnc1	1813435977	MEVVARSBPALMBK-SOLBZPMBSA-N	449.353	1.943	50	20	IDGD	
COC(=O)[C@@H]1CC[C@H](C(=O)Nc2cc([C@H]3CCCCN3C(=O)[C@H](O)CCl)[nH]n2)C1	1814859505	WMPUTYSSXQNASX-CTHBEMJXSA-N	426.901	1.591	50	20	IDGD	
COc1ccc(CC(=O)N2CCCC[C@@H]2c2cc(NC(=O)[C@H](O)CCl)n[nH]2)cc1O	1814864681	RQITZGMLMJFSCT-GDBMZVCRSA-N	436.896	1.958	50	20	IDGD	
Cc1ccn(C)c1C(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1	1815343652	HFZKINAGFVVPMY-HNNXBMFYSA-N	438.318	1.009	50	20	IDGD	
CN1N=C(C(=O)Nc2cc([C@H]3CCCCN3C(=O)CO[Si](C)(C)C)[nH]n2)CCC1=O	1815621371	AQAXGNPQAYXZEX-OAHLLOKOSA-N	434.573	1.862	50	20	IDGD	
CC(=O)OC[C@H](OC(C)=O)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](F)Cl)n[nH]1	1818039999	NSICFMWGTKGJSI-YDHLFZDLSA-N	432.836	1.431	50	20	IDGD	
CC1=CC[C@@H](C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2ccc(B(O)O)cc2)CC3)CC1	1818623114	YCSYAFKUMJVIKO-RHSMWYFYSA-N	439.346	1.795	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)N[C@H]1CCc2nc(NC(=O)CO[Si](C)(C)C)sc2C1	1820164728	GFURLKFEYHYXPV-YPMHNXCESA-N	426.615	1.773	50	20	IDGD	
CC[C@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](C)NS(=O)(=O)CC)[nH]n1	1820855773	WXVPJMJHMZXSPR-OBJOEFQTSA-N	433.962	1.747	50	20	IDGD	
CC(C)CNC(=O)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](F)Br)n[nH]1	1820931845	AHGVUQPSLYOOIM-WCQYABFASA-N	432.294	1.865	50	20	IDGD	
CC(=O)C[C@H](C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1822335409	JEOSXPSHJXBVHY-SCLBCKFNSA-N	426.282	1.011	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](C)CS(C)(=O)=O)[nH]n1	1822369482	GUQDSJZQCKSVFI-OBJOEFQTSA-N	434.946	1.336	50	20	IDGD	
C[C@@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1)c1ccccn1	1822417098	ZTTJACAILHAEKY-CRAIPNDOSA-N	441.536	1.974	50	20	IDGD	
CC(C)(C)[C@H](O)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1	1824134802	NWEPYRHMTVSSKY-RTBURBONSA-N	445.564	1.325	50	20	IDGD	
C#CC(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CC2	1825011417	DNUNZGOWGNCACZ-PWSUYJOCSA-N	426.926	1.820	50	20	IDGD	
CCOC(=O)C1(C(=O)N[C@@H]2CCc3nc(NC(=O)[C@H](Cl)COC)sc3C2)CC1	1826004635	PPMKEDZEUQQOKY-GHMZBOCLSA-N	429.926	1.652	50	20	IDGD	
O=C(Cc1ccncc1)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827052675	WZYYUGJHBBOZPV-JOCHJYFZSA-N	435.333	1.237	50	20	IDGD	
C=CCSCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)CBr)CCO2	1830535889	VXXOJRKBYVYGKN-PBHICJAKSA-N	435.384	1.393	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)C(F)(F)Cl)C2)C1	1830544246	RIXPDWNHTSXLIT-GXFFZTMASA-N	433.677	1.305	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)C(=O)c3ccco3)CCO2)C1	1832663952	IWEUFSBBPHWTKZ-QZTJIDSGSA-N	433.288	1.155	50	20	IDGD	
CC(=O)N(C)CCC(=O)N1CCC(N2CCC(NC(=O)C(C)(C)CCl)CC2)CC1	1833213411	OUYXQZDQDAESMY-UHFFFAOYSA-N	429.005	1.691	50	20	IDGD	
C[C@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)c3ccnn3C)CC2)CC1	1833262599	XXFXWYCBBJUVQJ-CQSZACIVSA-N	440.386	1.636	50	20	IDGD	
CC[C@H](C)[C@H](O)C(=O)NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1	1833499724	SKVVEDPYYRNNCN-RCBQFDQVSA-N	436.366	1.656	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3ccn(C)c3)CC2)CC1	1834079830	WMRFEDSHQAXLIT-AWEZNQCLSA-N	425.371	1.994	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCBr)CCO2)C1	1834819491	PKZHJOCGZBADCW-CZUORRHYSA-N	425.751	1.635	50	20	IDGD	
O=C(Nc1cccnc1)C(=O)NC1CCN(C2CCN(C(=O)[C@H](F)Cl)CC2)CC1	1835802802	KCCAAZSMYOTWLW-INIZCTEOSA-N	425.892	1.126	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3cc(O)no3)CC2)CC1	1835977420	RGGWGZDWRSAPIG-NSHDSACASA-N	429.315	1.349	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3cscn3)CCO2)C1	1836037487	MMYDCOYNHLOMGX-CXAGYDPISA-N	446.367	1.173	50	20	IDGD	
COC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)[C@H](C)CBr)CC2)CC1	1836670162	BBTNBBDJDCAQKN-CQSZACIVSA-N	447.370	1.969	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)CCc3nc(N)n[nH]3)CC2)CC1	1836922251	GBNHERQZWQAWEF-MRXNPFEDSA-N	440.976	1.726	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)COC3CCCCC3)C2)C1	1837709401	ZVVRJKDDUIVKST-NRFANRHFSA-N	442.629	1.644	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4cccnn4c3)C2)C1	1837715949	SVJHXHUBNPDYFK-NRFANRHFSA-N	446.580	1.256	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(Cl)nn3)CCO2)C1	1837833121	RUUUXWCTSZPDNP-FZKQIMNGSA-N	431.320	1.608	50	20	IDGD	
Cn1cc(CC(=O)N2CCC(OC3CCN(C(=O)[C@@H](F)Br)CC3)CC2)cn1	1838648534	XTZPUFQRLHHFNP-QGZVFWFLSA-N	445.333	1.652	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)CCBr)C3)C2)cc1F	1838914092	PTDQFZMNYPKMQJ-IBGZPJMESA-N	443.313	1.989	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CC34CCCN3CCC4)CCO2)C1	1839116882	POICXSJTLVRRBE-GCJKJVERSA-N	442.000	1.869	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)Nc3nccs3)C2)C1	1839144845	MFRGGULKXZOHSP-GLJUWKHASA-N	430.958	1.417	50	20	IDGD	
O=C(/C=C/c1ccoc1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839199662	ZIKPFFXVAFKHTC-XGERFZHZSA-N	431.258	1.440	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(Cl)c(O)cc3O)CCO2)C1	1839251707	GSMYYCCINXFFSM-DJJJIMSYSA-N	447.315	1.839	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc4nn[nH]c4c3)CCO2)C1	1839628174	SQOVQRRSQXIEJK-YWZLYKJASA-N	435.912	1.435	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3c(C)noc3C)C2)C1	1839963116	ACYZADQWDYZUKQ-RDTXWAMCSA-N	444.326	1.535	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCC(F)(F)F)C2)C1	1840032329	VNCBPTQENYDKIM-BXUZGUMPSA-N	431.249	1.569	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)/C=C/c3ccsc3)C2)C1	1840150267	IJOSKJYNFRCXKJ-IOWAXEIUSA-N	428.938	1.472	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(F)c3F)C2)C1	1840154072	KLBUHOSBANLVLP-LIRRHRJNSA-N	432.851	1.289	50	20	IDGD	
COc1cccnc1CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840186167	FIQAHKAZOCINHV-IBGZPJMESA-N	446.331	1.283	50	20	IDGD	
O=C(c1ccc2ncoc2c1)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840188337	DPJWFCFRIUGWMM-GOSISDBHSA-N	428.272	1.702	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)c1ccccc1Cl)CCO2	1840318092	NWCRUFVJFOYZEL-WRWLIDTKSA-N	445.343	1.847	50	20	IDGD	
CC(C)[C@H](CC(=O)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1)NC(=O)OC(C)(C)C	1841354145	JXLTVFANYPWICB-LSDHHAIUSA-N	431.961	1.729	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)C1CCN(C(C)C)CC1)C2	1843415326	LXHJEGAWXNZVSG-KOEQRZSOSA-N	442.564	1.444	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1n[nH]c3c1CC[C@@H]3C)C2	1843415931	FAQJTLHGWCEXAL-NYATXJBFSA-N	437.504	1.410	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2ccc3[nH]ccc3n2)C1	1844045467	UUEFWYHHUGAKSR-VULFUBBASA-N	433.472	1.514	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCCC12CN(C(=O)c1ccc(N3CCOCC3)cn1)C2	1844377557	RENGWWQAVPMIHB-UHFFFAOYSA-N	432.597	1.587	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)CCc2ncc[nH]2)C1	1846515090	VKRKTZGJVILLTH-UHFFFAOYSA-N	441.444	1.693	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)[C@@H](C)Oc2cccnc2)C1	1846626615	WODHGSLCHKUDNJ-FYHAJLKWSA-N	438.488	1.186	50	20	IDGD	
O=C(NCCC(=O)N1CCCC12CN(C(=O)[C@@H](F)Br)C2)c1ccccc1	1846959025	DLXZJOYZUHQNRN-OAHLLOKOSA-N	426.286	1.700	50	20	IDGD	
COc1cc(Br)ccc1CC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl	1847564077	QDKSCAUOCLNAIL-SOUVJXGZSA-N	445.741	1.802	50	20	IDGD	
CC(C)(C)OC(=O)NC1CCC(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](O)CCl)CC1	1847568587	YVJGFBGKJZRLGX-YOTSKQKMSA-N	443.972	1.871	50	20	IDGD	
CC[C@@H](C)[C@H](O)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O	1847831225	DHEWTGDEFKOFFF-HFYSXDIOSA-N	433.461	1.743	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2ccc(C(=O)NNc3nnc(C)c(=O)[nH]3)cc2)cc1	10899304	IITYJRUXOMBMGK-UHFFFAOYSA-N	430.446	1.040	50	20	IDGD	
C=CCNS(=O)(=O)c1ccc(C(=O)NNC(=O)[C@@H](C)Oc2ccc(OCC)cc2)cc1	18071978	APKXBLHTLNEDEM-OAHLLOKOSA-N	447.513	1.778	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)CCc3ccccc3O)CC2)cc1	24303881	REHPKEYGOWNEEY-UHFFFAOYSA-N	445.541	1.882	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2	26791870	GSXUXMSCHWNKBM-UHFFFAOYSA-N	425.401	1.739	50	20	IDGD	
O=C(CCCn1cccn1)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	109388721	XMEMXIMJVFHPPU-UHFFFAOYSA-N	433.515	1.987	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)c1cc2c(cc1[N+](=O)[O-])OCCO2	110884067	HPIFRMHWUYETLB-UHFFFAOYSA-N	434.430	1.564	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NCCc1cc(Cl)c2c(c1)OCCO2	725873579	OTFXYQSXYTUFGE-UHFFFAOYSA-N	438.893	1.476	50	20	IDGD	
O=C(NCc1ccc2c(c1)CCO2)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	726272852	SXRQQPQANBADPO-UHFFFAOYSA-N	444.513	1.550	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=S)NCc2ccc(S(N)(=O)=O)cc2)c1C	726445285	VBENBRHWDDDRJX-AWEZNQCLSA-N	436.559	1.414	50	20	IDGD	
CC/C=C(\C)C(=O)N1CSC[C@@H]1C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	727986741	DHWGKIRIGZBGMU-KXCGHJCSSA-N	425.532	1.109	50	20	IDGD	
CCCS(=O)(=O)Nc1ccc(C(=O)OCC(=O)NNC(=O)c2ccc(C)cc2)cc1	728110617	PMUOQICPRCKXQS-UHFFFAOYSA-N	433.486	1.765	50	20	IDGD	
Cc1nc2cc(O)nn2c(C)c1CC(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12	729281568	HQFOLPRQAUAUOE-UHFFFAOYSA-N	449.471	1.346	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NN=C1CCS(=O)(=O)c2ccc(Br)cc21	729819385	IWLVMOPJZWHEOI-UHFFFAOYSA-N	440.275	1.470	50	20	IDGD	
C=CCN1CCC(NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)CC1	730125117	NUXCJGDATTUFKH-UHFFFAOYSA-N	435.550	1.066	50	20	IDGD	
O=C(COC(=O)c1ccc(Cl)c(Cl)c1O)NNC(=O)[C@@H]1COc2ccccc2O1	730362569	QXSJNQFMFKEYDL-ZDUSSCGKSA-N	441.223	1.843	50	20	IDGD	
CC(=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O)C(c1ccccc1)c1ccccc1	730569211	RGEGUJGNUDXBQN-UHFFFAOYSA-N	437.525	1.895	50	20	IDGD	
Cc1cccc(N2C(=O)N[C@H](CCC(=O)OCC(=O)NNC(=O)c3cccs3)C2=O)c1	730864099	ICCBWJXTDVJMFT-CQSZACIVSA-N	444.469	1.266	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc(Br)cc([N+](=O)[O-])c1)c1cccc([N+](=O)[O-])c1	731181120	MCTXWCRMEOBMEQ-UHFFFAOYSA-N	445.207	1.889	50	20	IDGD	
COC(=O)c1ccc(OCCNC(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)cc1	731283924	NHIYAYZEHHOLSB-UHFFFAOYSA-N	428.445	1.438	50	20	IDGD	
Cc1nc(CN2CCC(CNC(=O)NNC(=O)[C@H]3COc4ccccc4O3)CC2)oc1C	732257038	BZESRKUPLJOWLE-LJQANCHMSA-N	443.504	1.674	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2ccc(CNC(=O)c3cccs3)cc2)C[C@@H](C)O1	732264535	VBFDOSORWVANQW-IYBDPMFKSA-N	444.557	1.938	50	20	IDGD	
CCn1nc(C(=O)NNc2nc3ccccc3c(=O)n2CCCOC(C)C)ccc1=O	733263711	AYWJQMLPJRGIQA-UHFFFAOYSA-N	426.477	1.545	50	20	IDGD	
Cc1cc(C(=O)N2CCN(C(=O)NNC(=O)c3cnn(-c4ccccc4)c3)CC2)c(C)o1	733351254	WEKXECQHBIRFIK-UHFFFAOYSA-N	436.472	1.895	50	20	IDGD	
Cc1noc(C)c1[C@H](C)NC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	733849961	OYDIAYOJDISWSU-LBPRGKRZSA-N	437.526	1.010	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)COc1cccc(N2CCCC2=O)c1	734241375	CPMYRCVNHPVNNR-UHFFFAOYSA-N	435.481	1.047	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(\C#N)C(=O)N[C@H]2CCN(CCN3CCOCC3)C2)c1C	734468290	QHJJXRDNZXGDSN-ULHYFDKDSA-N	443.592	1.742	50	20	IDGD	
Cc1ccc2cc(C(=O)NNc3ncccc3S(=O)(=O)N3CCN(C)CC3)[nH]c2c1	735118557	WNXMRMBTTAIISF-UHFFFAOYSA-N	428.518	1.564	50	20	IDGD	
COc1ccccc1[C@@H]1CCN(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)C1	738449516	CYQNNSGCBOWPML-CQSZACIVSA-N	431.518	1.832	50	20	IDGD	
Cc1ccsc1S(=O)(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	741646993	MXYWHMGNPWSGAX-UHFFFAOYSA-N	429.545	1.464	50	20	IDGD	
O=C(NNC(=O)c1cc2cccc(F)c2o1)c1cccc(S(=O)(=O)N2CCOCC2)c1	741878151	BUZQWQLKAPSQSE-UHFFFAOYSA-N	447.444	1.668	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)Cc2csc(NC(=O)C(C)(C)C)n2)C[C@@H](C)O1	743290119	BICFDZNZPDHVPE-BETUJISGSA-N	425.555	1.317	50	20	IDGD	
Cc1ccc(CN2C[C@H](C(=O)NNC(=O)Nc3ccc(S(C)(=O)=O)cc3)CC2=O)cc1	743829792	DJGUKPWGEFIXAI-MRXNPFEDSA-N	444.513	1.600	50	20	IDGD	
CC(C)Oc1cc(Br)cc(NC(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)c1	744450183	OJBICAFWSKLYGV-JTQLQIEISA-N	434.312	1.824	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H]2CCC[C@H](C(=O)OC)C2)c1	746093720	SOBZQWUBRFTBIF-HOCLYGCPSA-N	439.534	1.458	50	20	IDGD	
COC(=O)c1ccsc1N1CC[C@H](NC(=O)NNC(=O)c2ccc(C#N)cc2)C1=O	746778716	DFGQBHPFABUTPB-AWEZNQCLSA-N	427.442	1.156	50	20	IDGD	
COC(=O)c1ccsc1N1CC[C@H](NC(=O)NNC(=O)c2cccc(N(C)C)c2)C1=O	746781313	RWUIOCMIWXOGFH-HNNXBMFYSA-N	445.501	1.350	50	20	IDGD	
Cc1c(NNC(=O)[C@@H](CCC(N)=O)N2C(=O)c3ccccc3C2=O)cccc1[N+](=O)[O-]	748669266	AOTIECSACTXWNK-MRXNPFEDSA-N	425.401	1.277	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cc(Br)cn2)nn1)c1cccc([N+](=O)[O-])c1	749311572	WRVCVGCMPAPXKA-UHFFFAOYSA-N	432.194	1.408	50	20	IDGD	
Cc1ncsc1C(=O)NNC(=O)CCC(C)(C)C(=O)NNC(=O)c1scnc1C	749381040	OIGKFOUKIAMTMW-UHFFFAOYSA-N	438.535	1.245	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2c[nH]nc2-c2ccc3c(c2)OCO3)n1	752151086	RQAFCDIFIUIPNL-UHFFFAOYSA-N	443.441	1.117	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCc2ccc([S@@](C)=O)cc2)nc1	753049118	FBKHIOBUTLGVFS-HHHXNRCGSA-N	425.536	1.332	50	20	IDGD	
Cc1cc(C(=O)O)cc(S(=O)(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1Cl	753772252	ZHYPFLAYACHHEK-CYBMUJFWSA-N	426.834	1.496	50	20	IDGD	
COCCN(C)S(=O)(=O)[C@H]1CCCN(C(=O)NNC(=O)c2cccc3ccccc23)C1	755260377	PLAXLVJUBBVKNZ-KRWDZBQOSA-N	448.545	1.567	50	20	IDGD	
CCS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1	755597433	DVITVGSDAYKDTM-UHFFFAOYSA-N	425.488	1.350	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)Nc1ccc(CC(=O)N2CCOCC2)cc1	755862102	MTDZLKNDXOJVRP-HNNXBMFYSA-N	444.463	1.847	50	20	IDGD	
CCCCOc1ccc(C(=O)NNS(=O)(=O)c2csnc2C(=O)OC)cc1OC	755958889	RWXXQAMJTCUSKX-UHFFFAOYSA-N	443.503	1.741	50	20	IDGD	
CCc1c(NC(=O)C(=O)NNC(=O)c2nnc(O)c3ccccc23)cnn1CCC(C)C	756164146	MRKJFXADMZJPBC-UHFFFAOYSA-N	439.476	1.540	50	20	IDGD	
CC[C@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(CC)CC)c1)[C@@H]1CCCO1	756730517	UJUOTQYTAHCAJW-IRXDYDNUSA-N	426.539	1.619	50	20	IDGD	
CCn1c(NNC(=O)CN2C(=O)NC3(C[C@H](C)C[C@@H](C)C3)C2=O)nc2ccccc2c1=O	756909534	YKFUNJAGGTWUGV-ZIAGYGMSSA-N	440.504	1.606	50	20	IDGD	
NC(=O)c1ccc(NNC(=O)c2ccccc2NS(=O)(=O)c2ccc(F)cc2)nn1	757398279	FOQYJNYEWOOVFY-UHFFFAOYSA-N	430.421	1.272	50	20	IDGD	
NC(=O)c1cnn2c(C(=O)NNC(=O)COc3ccccc3-c3ccccc3)ccnc12	757988235	KLNWTKAIHCQYFW-UHFFFAOYSA-N	430.424	1.335	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCCC(=O)NNc2nc(O)c3ccccc3n2)cc1	758310434	DHVWFAAGBBREGF-UHFFFAOYSA-N	431.474	1.546	50	20	IDGD	
COc1cc(C#N)ccc1OCC(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758785207	CPZYCWRLUYKVDU-UHFFFAOYSA-N	447.492	1.581	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NC[C@H](C)CC1(C)OCCO1	758856126	WJXKBCLTKPVUKP-GFCCVEGCSA-N	427.527	1.021	50	20	IDGD	
CC1(C)C(=O)N(C[C@](C)(O)C(=O)OCC(=O)NNC(=O)c2cccs2)c2ccccc21	758885693	XWBGJTQVJHPOGM-NRFANRHFSA-N	445.497	1.128	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN(C(=O)c2cccc3ccccc23)C1)C(=O)Nc1ccccn1	759098438	GJJCHZGFAPJWNJ-QGZVFWFLSA-N	445.479	1.873	50	20	IDGD	
CC(C)NS(=O)(=O)NCCNC(=O)NNC(=O)c1cc2c(s1)CCCCCC2	759571735	CRHFMYUAOXNBRY-UHFFFAOYSA-N	431.584	1.184	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)c2cnn(CCO[C@@H]3CCCCO3)c2C)cc1	760123085	HPLDYANILJAKRE-HXUWFJFHSA-N	431.493	1.616	50	20	IDGD	
CCOc1ccc(OCc2ccc(C(=O)NNC(=O)[C@H]3CN4CCCN3CC4)cc2)cc1	763337117	DSZCLVBIEDCHFG-JOCHJYFZSA-N	438.528	1.815	50	20	IDGD	
CNC(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2Br)cc1	763484261	ZDFCUYQVVXRBRO-UHFFFAOYSA-N	433.262	1.137	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)n(-c2ccccc2F)n1	763570867	GEUMDKNEBBJRKH-KRWDZBQOSA-N	439.403	1.246	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1cccc(C(=O)N2CCCCC2)c1	763623769	HCCVTAKAXIFOAA-UHFFFAOYSA-N	448.483	1.669	50	20	IDGD	
COC(=O)[C@@H](C)Cc1ccc(NC(=O)C(=O)NNC(=O)COc2cccc(C)c2)cc1	763630402	KVFRHHUSUFAMCT-HNNXBMFYSA-N	427.457	1.512	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)C(=O)Nc1ccc(N2C(=O)CCCC2=O)cc1	763679587	OIGKDEGRWAPTTI-UHFFFAOYSA-N	442.403	1.034	50	20	IDGD	
CSCC[C@@H](NC(=O)c1ccc([N+](=O)[O-])o1)C(=O)NNC(=O)Cc1ccccc1C	763689623	YQWYLMXHNSJSSI-CQSZACIVSA-N	434.474	1.738	50	20	IDGD	
O=C(NNC(=O)C12CC3CC(CC(C3)C1)C2)C(=O)Nc1cccc(N2CCOC2=O)c1	763727190	GVIDBUCZGNYNKO-UHFFFAOYSA-N	426.473	1.946	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)C(=O)Nc1ccc(N2CCCC2)c(F)c1	763803886	OUCAHKNZKXEXQW-UHFFFAOYSA-N	445.407	1.499	50	20	IDGD	
CC(C)(C)NC(=O)c1cccc(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)c1	763837994	KQMAEXDDWXJSOA-UHFFFAOYSA-N	430.436	1.519	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)C(=O)Nc1cccc(Cl)c1-n1cccn1	763838071	MWBBMKNFMZBVFR-UHFFFAOYSA-N	431.811	1.830	50	20	IDGD	
COc1ccc(NC(C)=O)cc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccccc1F	763857289	MNFHWDFZOFOKSN-NSHDSACASA-N	432.408	1.346	50	20	IDGD	
CCN(Cc1ccccc1NC(=O)C(=O)NNC(=O)Cc1c[nH]c2ccccc12)C(C)=O	763865429	PQPNOXRTQUKWKN-UHFFFAOYSA-N	435.484	1.865	50	20	IDGD	
CCOC(=O)c1c(F)cccc1NC(=O)C(=O)NNC(=O)Cc1c[nH]c2ccccc12	763865749	UKYLHKFLUPWBIW-UHFFFAOYSA-N	426.404	1.812	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cnn(CC(C)C)c2C)cc1	763872954	PTWIIHLGOBSHOK-HNNXBMFYSA-N	429.477	1.604	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)NC)cc2)cc1OC	763912613	QBROSGDPUUXWQQ-UHFFFAOYSA-N	442.472	1.633	50	20	IDGD	
COC(=O)[C@@H]1CN(C(=O)C(=O)NNC(=O)c2cccc3ccccc23)c2ccccc2O1	764049096	SPMYPBAOJLAXBK-IBGZPJMESA-N	433.420	1.568	50	20	IDGD	
O=C(NNC(=O)C1CCCC1)C(=O)Nc1ccc(N2CCOCC2)cc1C(F)(F)F	764070644	NTMYRXKFBIMPEY-UHFFFAOYSA-N	428.411	1.818	50	20	IDGD	
COC(=O)c1cc(C(C)C)ccc1NC(=O)C(=O)NNC(=O)[C@H]1Cc2ccccc2O1	764169591	WZRPIYKKORWFFU-GOSISDBHSA-N	425.441	1.686	50	20	IDGD	
C[C@H]1CCCN(S(=O)(=O)c2ccc(NC(=O)C(=O)NNC(=O)CC(C)(C)C)cc2)C1	764197757	GZJUIZOUSSYEOE-AWEZNQCLSA-N	438.550	1.629	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)C(=O)Nc1cccc(C(=O)N2CCSCC2)c1	764312902	CHEFOTBDMDHYKD-UHFFFAOYSA-N	444.488	1.343	50	20	IDGD	
CCOc1cc(C(=O)N(C)C)ccc1NC(=O)C(=O)NNC(=O)C(C)(C)c1ccccc1	764313583	MBESBOCPLLOYSF-UHFFFAOYSA-N	440.500	1.851	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(Cl)c(-n3nnnc3C3CC3)c2)o1	764367528	IZNNCAZUBXZXBG-UHFFFAOYSA-N	429.824	1.494	50	20	IDGD	
COCCOCc1cccc(NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)c1	764378306	YDFBAGJXUQFRKQ-UHFFFAOYSA-N	443.485	1.701	50	20	IDGD	
CON(C)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)cc1	764383236	YWZNMPVEJYLCTH-UHFFFAOYSA-N	442.457	1.171	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)cccc1[N+](=O)[O-]	764389022	WIFPHRAYPNHTFV-UHFFFAOYSA-N	426.364	1.832	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)[C@@H](C)NS(=O)(=O)c3ccc(C#N)cc3)cc2C1	764569988	AGRGJLMUZPEIDD-QWHCGFSZSA-N	446.554	1.873	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)c3ccc(C)c(S(N)(=O)=O)c3)n[nH]2)cc1C	765557574	BESCMMHJMDKOIM-UHFFFAOYSA-N	427.486	1.724	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)ccc1F	765607270	NCILAWMHAAGQMV-UHFFFAOYSA-N	449.439	1.680	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)c1ccc2c(c1)CCO2	765753439	YPKQTGSVZNPEEM-UHFFFAOYSA-N	428.920	1.854	50	20	IDGD	
Cc1cc(Br)cc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1	766798973	QYOBUCSEQMTBPT-MRXNPFEDSA-N	449.257	1.902	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)nc1Cl	766954528	ZWVLGXZNLSYQAK-UHFFFAOYSA-N	426.882	1.134	50	20	IDGD	
N#C/C(=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)O[C@@H]1CCCNC1=O	767234381	BVHLNFVXSZEUGZ-IDKBZEPQSA-N	441.875	1.808	50	20	IDGD	
COc1cc2c(cc1NC(=O)C(=O)NNC(=O)CSc1ccc(C)cc1)NC(=O)CC2	768236377	BEQPVJBOQZTCOA-UHFFFAOYSA-N	442.497	1.767	50	20	IDGD	
Cn1ccnc1[C@@](O)(CC(=O)NNC(=O)c1cc(-c2cccs2)[nH]n1)C(F)(F)F	768262658	LQHUYGBANRUNIT-HNNXBMFYSA-N	428.396	1.473	50	20	IDGD	
O=C(NNc1nc2ccccc2[nH]1)[C@@H]1CCCN1S(=O)(=O)c1cccc([N+](=O)[O-])c1	768499369	FIPVTOGTAQIFHG-INIZCTEOSA-N	430.446	1.768	50	20	IDGD	
CCN(C(=O)[C@H](C)OC(=O)[C@@]12CC[C@@H](C[C@H]1Br)C2)[C@@H]1CCS(=O)(=O)C1	769983206	UGBLUTRROCVUAU-CNUKPYSBSA-N	436.368	1.907	50	20	IDGD	
CNC(=O)COc1cccc(CNC(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)c1	770347043	DYWHIGTUEVTBHO-UHFFFAOYSA-N	442.480	1.238	50	20	IDGD	
O=C(NNc1ccc(Br)c(F)c1)[C@@H]1CC(=O)N([C@H]2CCS(=O)(=O)C2)C1	771682140	HXLZGILTQKJGIK-KOLCDFICSA-N	434.287	1.067	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)C[C@@H](NC(C)=O)c1ccc(Br)cc1	771900547	DYHZQUKUMPSXAD-QMTHXVAHSA-N	428.283	1.506	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)c1nc2ncc(Br)cn2n1	772998364	XIEWQBMQUGGBQT-QMMMGPOBSA-N	439.657	1.769	50	20	IDGD	
CS(=O)(=O)c1cccc(Cl)c1C=NNC(=O)c1csc(N2CCOCC2)n1	773194071	TUUZFRODNYOQQG-UHFFFAOYSA-N	428.923	1.801	50	20	IDGD	
O=C(COC(=O)Cc1ccnc(O)c1Br)NNC(=O)c1ccc(Cl)cc1	773641702	YUDWPYWFXJBDNN-UHFFFAOYSA-N	442.653	1.750	50	20	IDGD	
O=C(NNc1ccccc1[N+](=O)[O-])C(=O)Nc1ccc(C(=O)NCC(F)(F)F)cc1	773655451	PSWVIJDMTZLXLP-UHFFFAOYSA-N	425.323	1.969	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2ccc(CC(=O)N3CCc4ccccc43)cc2)n1	773732428	ZGVIFJQDHQCDIQ-UHFFFAOYSA-N	446.467	1.699	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCN(CC(F)(F)F)CC2(C)C)cc1OC	775563654	FQZKBFXZHUNFOK-UHFFFAOYSA-N	432.443	1.423	50	20	IDGD	
CN(NC(=O)CNC(=O)C1CCCCC1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776202211	RMLAVHVSINAUNF-UHFFFAOYSA-N	425.530	1.319	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)c2cc(S(=O)(=O)N3CCCC3)ccc2O)c1	776527697	YCTZBQZDGMJNJW-UHFFFAOYSA-N	439.515	1.337	50	20	IDGD	
C[C@H]1CC(C)(C)C[C@]2(C1)NC(=O)N(CC(=O)NNc1cccc(S(C)(=O)=O)c1)C2=O	776528788	XBTZVCQMGBHCRW-RBZFPXEDSA-N	436.534	1.670	50	20	IDGD	
O=C([C@H]1CCCN(Cc2ccccc2)C1)N1CCN(S(=O)(=O)CBr)CC1	777780217	YJODCZQLGLPGMN-KRWDZBQOSA-N	444.395	1.725	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NN=C1C(=O)Nc2c(I)cccc21	777900228	JBOKMSCHYYCNQC-UHFFFAOYSA-N	444.229	1.588	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1cc(OCC(F)F)ccn1	778295629	VDCWMCNQMCSZFY-UHFFFAOYSA-N	442.444	1.503	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)C(C)(C)C)ccc1I	778557340	ITRKBWBDTLPOKS-UHFFFAOYSA-N	440.259	1.433	50	20	IDGD	
COCC(=O)N1CCc2cc(NC(=O)C(=O)NNC(=O)c3cc4ccccc4o3)ccc21	778712646	GRBMYEUCHLUBMH-UHFFFAOYSA-N	436.424	1.368	50	20	IDGD	
COc1cc(OC)c(NC(=O)C(=O)NNC(=O)c2ccc(C#N)cc2)cc1Br	778714064	RFNWZYFZYXYDHQ-UHFFFAOYSA-N	447.245	1.738	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NN=Cc1cnn(Cc2ccc(F)cc2)c1	780234717	GULCXIXJKCNJCV-UHFFFAOYSA-N	448.502	1.979	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)CC1	780696255	JERKRDMAIPUZJE-OAHLLOKOSA-N	444.496	1.396	50	20	IDGD	
C[C@H]1C(=O)CC[C@H](C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)C1(C)C	780926473	LJQLISLCIWQIFS-FUHWJXTLSA-N	428.533	1.233	50	20	IDGD	
COC(=O)c1scc(C)c1NC(=O)C(=O)NNC(=O)CSc1ccccc1OC	782123216	DLCBKISNGXFYIH-UHFFFAOYSA-N	437.499	1.730	50	20	IDGD	
COc1ccc(I)c(NC(=O)C(=O)NNc2cc(C)ncn2)c1	783939255	HGDNDJQMTOUMFX-UHFFFAOYSA-N	427.202	1.480	50	20	IDGD	
O=C(NNC(=O)C(=O)N1CCCC1)C(=O)Nc1cnccc1-c1ccc(C(F)(F)F)cc1	783999379	NJGPDHCYKCIZMB-UHFFFAOYSA-N	449.389	1.476	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)N[C@@H]1CCCN(Cc2ccccn2)C1=O	784172290	ALTXXZXCUREHLV-CYBMUJFWSA-N	435.282	1.307	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)C(=O)Nc1cnn(-c2ccccc2)c1	784210292	MCVXVBDGWFIAOW-UHFFFAOYSA-N	440.485	1.395	50	20	IDGD	
O=C(NNc1ccc([N+](=O)[O-])cc1Cl)C(=O)Nc1ccc2nc3n(c(=O)c2c1)CCC3	784379586	AFUIWBBPAUNXDE-UHFFFAOYSA-N	442.819	1.986	50	20	IDGD	
O=C(NNc1nc(-c2ccccn2)nc2c1CCC2)[C@@H]1CC=CC[C@H]1C(=O)N1CCOCC1	784784001	LQVJBTABOGSOHA-IAGOWNOFSA-N	448.527	1.912	50	20	IDGD	
COC(=O)CCOc1ccc(NC(=O)C(=O)NNc2ccnc(Br)c2)cc1	784828557	KDRZKSBLYWQUFR-UHFFFAOYSA-N	437.250	1.868	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)C(=O)Nc2cccc(S(=O)(=O)NC3CC3)c2C)c1	784853664	KOKAAYXJXLJQLD-UHFFFAOYSA-N	446.485	1.304	50	20	IDGD	
CCNC(=O)c1cccc(NC(=O)C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)c1	785100663	WWCCCFPJMMKSCM-UHFFFAOYSA-N	445.426	1.689	50	20	IDGD	
CNS(=O)(=O)c1cc(NC(=O)C(=O)NNc2nc3ccccc3cc2C)ccc1C	785160544	ZTAFEPWKPVOGOV-UHFFFAOYSA-N	427.486	1.842	50	20	IDGD	
O=C(NNC(=O)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-])C(=O)Nc1ccccn1	785181507	WAGXVNUTIOUEAI-UHFFFAOYSA-N	435.396	1.969	50	20	IDGD	
CCOC(=O)c1cnn(C)c1NC(=O)C(=O)NNC(=O)COc1cc(C)ccc1C(C)C	786413639	DOZJYXZPRBZULF-UHFFFAOYSA-N	445.476	1.194	50	20	IDGD	
COc1ccc(C(=O)NCCN2CCN(C(=O)/C(C#N)=C/c3ccc(O)cc3)CC2)cc1	787343052	XTGHAJULYOSQDV-CAPFRKAQSA-N	434.496	1.882	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NC[C@H](c2ccnn2C)C(C)C)c2ccccc2c1=O	788322058	UHSOBHBQDHPNRO-INIZCTEOSA-N	425.493	1.534	50	20	IDGD	
CC(C)(C)OC(=O)N1CC2(C[C@H]2C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)C1	789290314	TUTFYKDKPRTENP-HNNXBMFYSA-N	428.445	1.119	50	20	IDGD	
CN(C)[C@@H]1CCOc2c(NC(=O)C(=O)NNC(=O)CSc3ccccc3O)cccc21	789740584	WVCVVPXLAXKKKS-OAHLLOKOSA-N	444.513	1.656	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccc(OC)cc2)c1)C(=O)OC	790104247	QJTYXNYGJCWNQX-KRWDZBQOSA-N	449.485	1.456	50	20	IDGD	
CCOC(=O)c1csc([C@@H]2CCCN2C(=O)NNC(=O)CNC(=O)c2ccco2)n1	791021921	CUTQPERAFILRIL-LBPRGKRZSA-N	435.462	1.221	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)NCCCn2c(=O)ccn(C)c2=O)c(C)n1C[C@H]1CCCO1	791263294	VJRWKORIDLFRAF-UMSHPIDHSA-N	439.516	1.258	50	20	IDGD	
COc1cccc(C2=NO[C@@H](C(=O)NNC(=O)c3cc(OC)c(OC)c(OC)c3)C2)c1	791445926	BIEAWFWBALVMAB-GOSISDBHSA-N	429.429	1.675	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)cccc1NC(=O)N(C)C	792350420	JQEZRWCDFAIQRC-QGZVFWFLSA-N	441.444	1.014	50	20	IDGD	
COC(=O)COc1c(C)cc(C(=O)NNc2ccccc2S(=O)(=O)N(C)C)cc1C	795160142	DHUJBJFVXMQHDS-UHFFFAOYSA-N	435.502	1.862	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)C(=O)Nc2ccn(C(C)C)n2)c2ccccc2c1=O	796989260	CGAPQJCYGMUKSG-UHFFFAOYSA-N	439.476	1.374	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2ccc(F)cc2OCCC(F)(F)F)CCS(=O)(=O)C1	800627869	QBLVMEIRDHGSDK-OAHLLOKOSA-N	441.403	1.293	50	20	IDGD	
CN(C)c1ccc(S(=O)(=O)N(C)C)cc1NC(=O)NNc1ccc(-n2ccnc2)nn1	806170536	VORBCVIQUMEAEY-UHFFFAOYSA-N	445.509	1.127	50	20	IDGD	
Cc1nn(C)c(C)c1CCC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	806708876	AJIJWLYAEXHHIC-UHFFFAOYSA-N	447.561	1.605	50	20	IDGD	
COCCNC(=O)c1cccc(NC(=O)C(=O)NNc2nc(C(F)(F)F)cs2)c1	807021294	DOEXVUKFCBOCOK-UHFFFAOYSA-N	431.396	1.620	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1csc(N2CCOCC2)n1)[C@@H](c1ccccc1)N(C)C	807402260	FASMUSAYINOBOF-PBHICJAKSA-N	432.550	1.615	50	20	IDGD	
O=C(NCc1ccncc1OC[C@H]1CCOC1)NNC(=O)c1cc([N+](=O)[O-])ccc1O	807616727	WKXRSAGLXHNAIO-LBPRGKRZSA-N	431.405	1.255	50	20	IDGD	
CN(N=Cc1ccc(F)c(S(N)(=O)=O)c1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	807982705	KDTWSBPHTPAPGY-UHFFFAOYSA-N	443.501	1.412	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2cccc(OC(F)F)c2)cc1C	810344601	YTZIZCZGMAZMJU-UHFFFAOYSA-N	427.429	1.644	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)CNS(=O)(=O)c2ccccc2C(F)(F)F)c1	810976168	QPBKXWMYYYCFFC-UHFFFAOYSA-N	431.392	1.914	50	20	IDGD	
CCOc1ccc(C#N)cc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	813033316	NGDQVTPQUNGKEK-UHFFFAOYSA-N	431.474	1.289	50	20	IDGD	
CCOc1ccc(OCC)c(NC(=S)NNC(=O)c2nnn(-c3ccn(C)n3)c2C)c1	814407553	HXLDTZZUJGNLEM-UHFFFAOYSA-N	444.521	1.738	50	20	IDGD	
CC(=NNC(=O)C1=S=C2CCCCCC2=C1)c1ccc(S(=O)(=O)CC(N)=O)cc1	814767594	MONZHOXINDEYDN-UHFFFAOYSA-N	433.555	1.768	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1ccc(O)c(C(=O)NNC(=O)c2ccccn2)c1	825123292	NJIJLSZRCSQCQQ-UHFFFAOYSA-N	442.453	1.671	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)N2CCC(C(=O)N3CCOCC3)CC2)c1C	842684152	IIMJOUFSJFDTFA-QNGOZBTKSA-N	428.533	1.756	50	20	IDGD	
O=C(CCN1CCCCCC1)NN=Cc1c(N2CCOCC2)nc2ccccn2c1=O	874087021	QDRLZWFCSPFGKU-UHFFFAOYSA-N	426.521	1.247	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NN=Cc2c(N3CCOCC3)nc3ccccn3c2=O)cc1C	874093164	MXDBJPDYPPKJCU-UHFFFAOYSA-N	448.483	1.237	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Cc2ccc(-n3cccc3)cc2)cc1	914748265	RKTKZFXBMJMZKK-UHFFFAOYSA-N	440.525	1.796	50	20	IDGD	
COc1ccnc(NNC(=O)C2CCN(c3ccc4nnc(C(F)(F)F)n4n3)CC2)n1	914762634	YVPFJCBWJUONHD-UHFFFAOYSA-N	437.386	1.301	50	20	IDGD	
COc1cccc(C2CC(=O)C(=CNNC(=O)c3cccc(S(C)(=O)=O)c3)C(=O)C2)c1	915185256	JHGSBUUTASRWBI-UHFFFAOYSA-N	442.493	1.933	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)[C@@H]1CCCN(C(=O)N2CCCC2)C1	916132679	HWXVOAQMHGWGKC-MRXNPFEDSA-N	426.521	1.674	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)CS(=O)(=O)Cc2ccc(C#N)cc2)cc1OC	916142243	XTCKYGBPWCVMNS-UHFFFAOYSA-N	445.497	1.732	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NCc2ccc(OC3CCCC3)nc2)c2ccccc2c1=O	916396622	XDDLDPYOEOSKMS-UHFFFAOYSA-N	436.472	1.794	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])CC1	916519467	AAVUNLGEFYJRNW-UHFFFAOYSA-N	437.453	1.704	50	20	IDGD	
C[C@H](NC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)c1ccc(C#N)cc1	916627798	WZLNOJGFQSJXHY-HNNXBMFYSA-N	443.533	1.277	50	20	IDGD	
CCCCn1c(=O)nc(O)c2c1nc(CCC(=O)NNC(=O)C(C)(C)C)n2CC(C)C	917180160	HKZLYKQFWDYDRZ-UHFFFAOYSA-N	434.541	1.881	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@@H](C)Cc2ccccc2C)cc1	918222856	LAQKMZTXJZUOAY-KRWDZBQOSA-N	432.546	1.886	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)c3c[nH]n4c3nc(=O)c3ccccc34)n[nH]2)cc1	919748144	YJUCIBHVHAKECG-UHFFFAOYSA-N	427.424	1.949	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)[C@@H]2Nc3ccccc3S(=O)(=O)N2)c1	1252607620	YUYPSUOOAQQHGD-LJQANCHMSA-N	432.502	1.375	50	20	IDGD	
O=C(NNC(=O)N1CCO[C@@H](c2ccc(Cl)s2)C1)c1ccc(-n2cnnn2)cc1	1323381024	YMKIUXRJRZIRIP-CYBMUJFWSA-N	433.881	1.805	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)c1cc(Br)c(C=O)n1C	1330271752	VEHSZZJSYSMWRI-UHFFFAOYSA-N	432.278	1.973	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc4ccccc4o3)C2)C1	1777842019	AVJWTCZBJAEFNH-HSZRJFAPSA-N	449.467	1.189	50	20	IDGD	
CCCCC[C@@H](C)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1	1779033820	FGECGMVKWVPJDP-OPAMFIHVSA-N	431.537	1.345	50	20	IDGD	
COc1cc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](F)Br)C2)nn1C	1780773692	LZVSQUVULCADTO-SUYBPPKGSA-N	447.305	1.247	50	20	IDGD	
Cc1nnc(CCC(=O)N2CCO[C@]3(CCN(C(=O)[C@](C)(Cl)CCl)C3)C2)s1	1781224089	HHRIHUCVIODSAZ-IAGOWNOFSA-N	435.377	1.845	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)c3cnc(OCF)cn3)CCO2)C1	1781228587	VGOBTKYKXVVAMB-SJORKVTESA-N	435.283	1.462	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)c3cn4cccnc4n3)CCO2)C1	1781230703	YBHTZMVTWVSMPT-QZTJIDSGSA-N	426.304	1.409	50	20	IDGD	
O=C(c1cc(C(F)F)no1)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781330838	HLSAVWOTWTUVNL-HZMBPMFUSA-N	426.189	1.746	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(Cl)c(O)cc3O)C2)C1	1781473414	ZHGZQZHXZPLGLT-BMLIUANNSA-N	447.713	1.978	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(CCN(C(=O)c3cccc(-n4cncn4)c3)C2)C1	1782017310	UREKSEZQVGUBCZ-OAQYLSRUSA-N	443.580	1.562	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc3nccn3c1)C2	1782175648	OKELMGGPUQZPIT-CBGDNZLLSA-N	434.924	1.716	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCn2cncn2)C1	1782453875	DYHZBYIWTVOEOA-IIDMSEBBSA-N	442.358	1.356	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cn(C(C)(C)C)nn3)CCO2)C1	1783351874	MQTRGIWZMSXUJV-SCLBCKFNSA-N	442.358	1.650	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)CS[C@@H]3CCCCO3)CCO2)C1	1783534666	XUUGASZSBPRNDG-YSVLISHTSA-N	435.384	1.860	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3n[nH]c4ccc(C#N)cc34)CCO2)C1	1783536266	ILBOUROGHIQHAQ-CWTRNNRKSA-N	446.305	1.661	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cnn4cccc(F)c34)CCO2)C1	1783537965	VBXLWFIHECOWSQ-KZULUSFZSA-N	439.285	1.700	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](C)Br)C3)C2)c(OC)c1	1783539170	YLEYQKMTYVSRMZ-BFUOFWGJSA-N	441.322	1.931	50	20	IDGD	
N#Cc1ccc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCBr)C[C@@H]32)cc1	1783603519	YAQJADFWMAHLGX-BZSNNMDCSA-N	434.334	1.865	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)C[C@H]3OCCc4ccccc43)CCO2)C1	1783871532	SSIUQZHWLVXGPQ-JQVVWYNYSA-N	436.936	1.774	50	20	IDGD	
Cc1ccc(COCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]3C2)cc1C	1784091294	YXFYWZSHALIWGX-MUGJNUQGSA-N	438.952	1.399	50	20	IDGD	
O=C(COc1ccc(Cl)c(F)c1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21	1784422085	YTSQTBKRBZCOFM-BHADISHBSA-N	449.306	1.437	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C34CC(C(=O)OC)(C3)C4)C[C@@H]21	1784622685	QMCUWOKKKRZYKB-AIGROLTGSA-N	426.941	1.717	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=N/N3CCCCC3)C[C@@H]21	1786405985	BOWHFXUDQIETRE-UZPFABOCSA-N	429.359	1.223	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)c1cc2cccnc2[nH]1	1788373004	ZQKNMZKRLDAKQI-JURCDPSOSA-N	439.285	1.847	50	20	IDGD	
C=C[C@H](O)C(C)(C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)CBr)C[C@@H]21	1788570270	PRJXMRDJZRVWLW-QXKUPLGCSA-N	431.371	1.570	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CC(c4ccccc4)=NN3)C[C@@H]21	1789865276	OVZFOJYNHLMZNA-OIGVQNGMSA-N	432.952	1.750	50	20	IDGD	
CSCC[C@@H](O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]2C1	1789872284	FVWIXYZUIFPWQF-JEJJNBGPSA-N	427.394	1.316	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ncn(-c4ccccc4)n3)C[C@@H]21	1791254000	HKLITBDWVHOBDJ-DKIMLUQUSA-N	447.923	1.114	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4sccc4[nH]3)C[C@@H]21	1791291172	PACOMXYHKWVPIM-ZQIUZPCESA-N	447.561	1.196	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1ccc(C2(NC(=O)CC[C@@H](N)C(N)=O)CCC2)cc1	1791361100	QGGOVMJUBYYUOP-LSDHHAIUSA-N	439.354	1.887	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)c1ccc(-c2ncc[nH]2)cc1	1792032994	AKRQWWKJZSSTRA-FJIDUMEYSA-N	432.908	1.270	50	20	IDGD	
Cc1nn2cc(CC(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)C(C)(C)CCl)nc2s1	1792782139	FZJVONDKWIUXCD-YWVIFJGQSA-N	439.969	1.496	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(N(C)C)cn1)C2	1792870797	VAZGZNHVPPDIAH-ZJOBFFGXSA-N	439.354	1.382	50	20	IDGD	
O=C(Cc1[nH]nc2c(Cl)cccc12)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCl	1793115411	MUURPUVQSKCNGX-AZKPJATDSA-N	425.316	1.997	50	20	IDGD	
CC(C)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1sc2nccnc2c1N	1795704409	DBUNTPVSXDTCSR-PTEHBNRSSA-N	437.953	1.742	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](C)Cn1cccn1)C2	1796890960	QMKFDPYKGYJYAZ-HEZDOATESA-N	439.520	1.291	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(Cl)c2nncn2c1	1797689977	TXEKUCJVFWFKKF-XFMPKHEZSA-N	426.304	1.603	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3nccnc3c1)C2	1797955931	QBPICEVQJPKWOI-CWPLJXCYSA-N	428.565	1.685	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(Cl)ccn1	1798049460	GWAOHGBTCPLXRI-OHTBPHCPSA-N	430.730	1.969	50	20	IDGD	
Cc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@](C)(Cl)CCl)ncc1[N+](=O)[O-]	1799275394	QVBRBKJWUZMYGX-ABXQLRGKSA-N	445.303	1.738	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3cccn3cn1)C2	1799277554	XQRYIWRWEQMWHL-UESRRSCYSA-N	425.316	1.774	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1(N2CCN(C)CC2)CC1	1799978023	ZCRNKKBOZMJRDT-LVQVYYBASA-N	427.387	1.188	50	20	IDGD	
Cc1nn2cc(CC(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)[C@@H](F)Br)nc2s1	1800157232	RFPUYJMFDNCZOV-RFVSLCSESA-N	444.330	1.970	50	20	IDGD	
CCCCCc1ncc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](O)CCl)C3)s1	1800233927	GPXUEFHBUGXQQJ-LOUJCGABSA-N	429.970	1.679	50	20	IDGD	
Cc1cc(F)c(F)c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)c1	1800776625	XQECRRYGVVLNMQ-BJWYYQGGSA-N	428.244	1.519	50	20	IDGD	
O=C1CC(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](Br)Cc2ccccc2)=NN1	1801569389	GDJOPFPHDCCRGD-QKPAOTATSA-N	447.333	1.507	50	20	IDGD	
CC[C@@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(=O)nc3cccnn13)C2	1801803604	FVEFMYCIPSEMAU-XJFOESAGSA-N	448.321	1.515	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)C(C)(C)CCl)[C@@H]1c1cccnc1	1802902631	RQBNVHFLFCZIKH-LPHOPBHVSA-N	437.972	1.725	50	20	IDGD	
COc1ccc(Cl)c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CCC(=O)NN(C)C)C3)c1	1803510471	BAIYCJQUBYJKAR-QDMKHBRRSA-N	436.940	1.973	50	20	IDGD	
O=C([C@H](F)Cl)N1CC[C@H](CNC(=O)C(F)(F)C(F)(F)C(=O)O)[C@H]1c1cccnc1	1804042152	GZZSLZPHXALDFQ-MXWKQRLJSA-N	443.756	1.977	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)CSC1=S	1804335969	IRQIFDCAKIHFGD-CHWFTXMASA-N	434.381	1.268	50	20	IDGD	
CN(C)c1cccc(OCC(=O)N2CCCC3(CCN(C(=O)[C@@H](O)CCl)CC3)C2)c1	1806733519	ZLSKAXCFMMGRKV-IBGZPJMESA-N	437.968	1.962	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)Cn2cc(C)c(O)nc2=O)[C@H]1c1cccnc1	1808285714	SNOCZMHTKXJFDH-BQFCYCMXSA-N	447.923	1.376	50	20	IDGD	
COc1ncccc1C(=O)N1CCCC2(CCN(C(=O)CCC(=O)NN(C)C)CC2)C1	1808301808	OPECLEADJSVRKW-UHFFFAOYSA-N	431.537	1.308	50	20	IDGD	
C[C@H](NC(=O)c1ccccn1)C(=O)N1CC[C@H](CNC(=O)[C@@H](F)Cl)[C@@H]1c1cccnc1	1808322774	XHNFEELEPTXDFO-UNQWWWNPSA-N	447.898	1.835	50	20	IDGD	
CC(=O)N[C@H](C)C(=O)N1CC[C@H](CNC(=O)[C@@H](F)Br)[C@@H]1c1cccnc1	1808678904	PFWHOAJBLFCQQC-QPKOPYBWSA-N	429.290	1.303	50	20	IDGD	
CC(F)(F)C(C)(C)C(=O)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1	1809969202	MHOYOIOKZOOOND-UHFFFAOYSA-N	436.308	1.893	50	20	IDGD	
CC(C)(C)CC(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1	1810298401	IBYUFZJAJWEQCR-OXJNMPFZSA-N	438.532	1.836	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)c2ccnnc2O)[C@@H]1c1cccnc1	1812866445	GBVVNZXRCWRVBH-CORIIIEPSA-N	434.294	1.680	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2[nH]nc3ncccc23)[C@H]1c1cccnc1	1813029902	BALQJQNSUUZNNH-ZVZYQTTQSA-N	442.907	1.926	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@H](CNC(=O)CSCC(=O)O)[C@@H]1c1cccnc1	1813086106	GPDJTOIYOPCVOS-KXBFYZLASA-N	439.610	1.757	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@H](O)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](F)Cl)[nH]n1	1814795639	GTQDSGYUQMVHHQ-MBNYWOFBSA-N	447.895	1.822	50	20	IDGD	
Cc1ccc(C)c(C(=O)N[C@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)c1	1815361965	WMPSZYLJAQSVEN-KRWDZBQOSA-N	449.341	1.979	50	20	IDGD	
O=C(CCBr)N[C@@H]1CCc2nc(NC(=O)c3cc(O)nc(O)n3)sc2C1	1817100671	HNLGNOGASYCNGI-SSDOTTSWSA-N	442.295	1.355	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](N)CCC(N)=O)n[nH]1	1817249015	BVUIPDUWZGOHMR-GVXVVHGQSA-N	443.346	1.168	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccnc(F)c2)[nH]n1)c1ccc(B(O)O)cc1	1817470102	IZPJAOIRGYRFJX-KRWDZBQOSA-N	437.240	1.243	50	20	IDGD	
CC[C@@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(=O)n3[nH]cnc3n2)[nH]n1	1820853085	GPBMEDDIFTZKFR-ZWNOBZJWSA-N	432.872	1.464	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CS(C)(=O)=O)[nH]n1	1822087811	NXGBPLRURURMCZ-JQWIXIFHSA-N	435.344	1.620	50	20	IDGD	
CCNC(=S)NCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](C)Br)n[nH]1	1822188884	PFWHKMUMGCYPRS-ZYHUDNBSSA-N	445.387	1.669	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(O)c(F)c3)sc2C1	1823317897	VOHZKRWFGCHGAP-LBPRGKRZSA-N	449.508	1.587	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3cnn4c3OCCC4)sc2C1	1824001935	ZXBXENIODZEEFJ-JQWIXIFHSA-N	439.925	1.602	50	20	IDGD	
Cc1ccc(O)c(C(=O)N[C@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)c1	1826088284	CTJYPVKYZRLGFP-ZDUSSCGKSA-N	445.545	1.756	50	20	IDGD	
N#Cc1ccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)cc1	1829907254	CZHZDJVGHZLTHV-LJQANCHMSA-N	426.300	1.361	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CC3CCN(C)CC3)CCO2)C1	1829996055	GRAQNUKKEBZRKU-RXVVDRJESA-N	429.989	1.582	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)no1	1830537665	MEPNOXODCAGEPM-SJCJKPOMSA-N	430.299	1.084	50	20	IDGD	
Cc1nc(C)c(C(=O)N2CCC([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)o1	1831873375	IHWUJHREJPVKNR-SFHVURJKSA-N	433.553	1.898	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@](C)(O)C(F)(F)F)CCO2	1832149601	APPZMHGBYBICOY-APHBMKBZSA-N	430.851	1.164	50	20	IDGD	
Cc1oncc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)CBr)C2)C1	1834310571	AQWBXDXYFWYGNU-PXAZEXFGSA-N	430.299	1.084	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H]3CCc4nc[nH]c4C3)CC2)CC1)[C@H](F)Cl	1835083700	QQYWHZBDGDFQDO-UGSOOPFHSA-N	425.936	1.621	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC1CCN(C2CCN(C(=O)CN3CCCCC3)CC2)CC1	1835833602	WWAQOGKRAFSBCA-UHFFFAOYSA-N	438.689	1.895	50	20	IDGD	
CC[C@H](Br)C(=O)NC1CCN(C2CCN(C(=O)[C@H]3CCCO3)CC2)CC1	1836541968	PIGNAPZKWHPRRL-DLBZAZTESA-N	430.387	1.911	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC(OC2CCN(C(=O)COCCO)CC2)CC1	1836672891	FOAIEIHZMDVGCN-AWEZNQCLSA-N	435.359	1.025	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C1(C(F)(F)F)CC1)CCO2	1836723485	OHKPETUSKLTMAN-SWLSCSKDSA-N	428.835	1.039	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)C(C)(C)CNC(C)=O)CC2)CC1	1836932728	YPFGZUPPUOKWSV-GOSISDBHSA-N	445.988	1.401	50	20	IDGD	
O=C(c1ccc(O)nn1)N1CCC(OC2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1837368683	GTOMYFGCQUFOLI-OAHLLOKOSA-N	445.289	1.485	50	20	IDGD	
C=C[C@H](O)C(C)(C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)CBr)C2)C1	1837391334	LDRXRBBFJINYOJ-DOXZYTNZSA-N	447.370	1.047	50	20	IDGD	
COC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)CO[Si](C)(C)C)CC2)CC1	1837663201	OAEWRKDXRUCZNR-UHFFFAOYSA-N	428.602	1.790	50	20	IDGD	
CCc1ncccc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2	1839150888	AWOUHZKJCAIVGP-PMACEKPBSA-N	444.359	1.950	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)CN3CCCCC3)C2)C1	1839151824	FCMHKEBRXOPQLR-MOPGFXCFSA-N	436.380	1.165	50	20	IDGD	
N#CCc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)cc1	1839364152	PDNICTOMNFJRPN-LJQANCHMSA-N	426.300	1.626	50	20	IDGD	
CC(C)N1CCC[C@H]1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)Br)C2)C1	1840584945	OHXINJRQBBOANK-JTDSTZFVSA-N	446.386	1.099	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)C3CC4(CCC4)C3)CCO2)C1	1840604860	BPGMESTVNKMTPC-AUUYWEPGSA-N	429.355	1.807	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(F)c(OC)c3)CCO2)C1	1840683319	FBEPXYZXWBLPKM-YWZLYKJASA-N	444.887	1.158	50	20	IDGD	
COc1ccc([C@@H]2C[C@@H]2C(=O)N2CCCC23CN(C(=O)CCC(=O)NN(C)C)C3)cc1	1841576235	OUQLPFKCFWVTNZ-OALUTQOASA-N	428.533	1.375	50	20	IDGD	
CC(C)(Cc1ccccc1)C(=O)N1CC2(CCCN2C(=O)c2cnccc2C(=O)NN)C1	1844263245	JRGPFBHWXKIOEL-UHFFFAOYSA-N	435.528	1.771	50	20	IDGD	
Cn1c(=O)c(C(=O)N2CC3(CCCN3C(=O)CO[Si](C)(C)C)C2)nc2ccccc21	1844378107	GNZPXYNWDRWCGZ-UHFFFAOYSA-N	428.565	1.602	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)c1cccc(N3CCCNC(=O)C3)n1)C2	1845163808	VCYPEORYDBONEB-HNNXBMFYSA-N	433.940	1.242	50	20	IDGD	
O=C1NC[C@@H](C(=O)N2CC3(CCCN3C(=O)[C@@H](Br)Cc3ccccc3)C2)O1	1845940215	CZEBFLOJLGWQET-GJZGRUSLSA-N	436.306	1.304	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CCc1ccc(F)c(F)c1	1847412318	CPSHXUFEJJZPMP-OALUTQOASA-N	443.454	1.412	50	20	IDGD	
COC(=O)N[C@@H](C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](F)Br)c1ccccc1	1847451498	XSVAGKZLLGXMRM-BYNSBNAKSA-N	442.285	1.976	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CCc1ccc(F)nc1	1848172677	RRFITMKUWDLVGD-SWERZJPOSA-N	440.479	1.489	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N(C)C)cc2)cc1OC	12696585	SXPZQPGKDXCPEO-UHFFFAOYSA-N	435.502	1.809	50	20	IDGD	
Cc1ccc(-c2nnn(CC(=O)OCC(=O)NNC(=O)c3ccc(Cl)cc3)n2)cc1	18826205	ORRLYKVYNRYUOC-UHFFFAOYSA-N	428.836	1.306	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)[C@H]2CC(=O)N(Cc3ccccc3Cl)C2)cc1	26694317	VTKKGPFWOWSXGB-INIZCTEOSA-N	426.860	1.787	50	20	IDGD	
CCCCCS(=O)(=O)CC(=O)NNC(=O)[C@H](C)Oc1cccc(Br)c1	110817140	JXOOYGCUDOERRD-LBPRGKRZSA-N	435.340	1.969	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)Nc2nc3nc(C)cc(C)n3n2)nc1	725852816	GQTIICHQGATFHW-UHFFFAOYSA-N	433.498	1.315	50	20	IDGD	
COc1cccc(N2C[C@@H](NC(=O)NNC(=O)C(=O)Nc3ccc(C)c(C)c3)CC2=O)c1	726274280	BOBDHDQHWPAWCU-INIZCTEOSA-N	439.472	1.386	50	20	IDGD	
CC[C@@H](OC(=O)/C(C#N)=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(N)=O	726988331	OQDNNBIODSCCIL-LRFDDAOPSA-N	429.864	1.793	50	20	IDGD	
CCn1c(=O)c(=O)[nH]c2cc(C(=O)NNC(=O)c3cc(F)ccc3Br)ccc21	728551090	YPFZMORXBSWGBS-UHFFFAOYSA-N	449.236	1.686	50	20	IDGD	
CS(=O)(=O)N1CCCC[C@@H]1C(=O)NNC(=O)c1ccc(Br)cc1Cl	728829357	JDCIHCZQHJXGFV-GFCCVEGCSA-N	438.731	1.678	50	20	IDGD	
C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	728845614	NHVKXAZRDDHFFB-ZDUSSCGKSA-N	430.490	1.929	50	20	IDGD	
CCN(CCNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)c1ccccc1C	728946168	CDJMQJKIMJGMTO-UHFFFAOYSA-N	425.537	1.858	50	20	IDGD	
O=C(COC(=O)[C@@H]1COc2ccc(Cl)cc2C1)NNC(=O)[C@H]1COc2ccccc2O1	729236718	KQHXNPBTUDFUPF-SCLBCKFNSA-N	446.843	1.422	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1cccc2c1O[C@@H](C)C(=O)N2	729746740	PGCHAVBCSLJUKI-JTQLQIEISA-N	447.831	1.686	50	20	IDGD	
CC(C)(C)CC(=O)N1CSC[C@H]1C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	730077169	MHUIJHUXBCUUBH-INIZCTEOSA-N	440.591	1.908	50	20	IDGD	
CCOc1cc2c(cc1[C@@H]1C[C@H]1C(=O)NNC(=O)c1ccc(-n3cnnn3)cc1)O[C@H](C)C2	730515568	PUJOCTHEDMZQIO-XVGQJIODSA-N	448.483	1.949	50	20	IDGD	
CCCCc1oc2ccccc2c1C=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O	730570881	MRNBPWSWCBEVJE-UHFFFAOYSA-N	429.502	1.810	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)CC[C@@H]1NC(=O)N(c2cccc(C)c2)C1=O	730829816	LETJASFOOFTUOS-KRWDZBQOSA-N	439.472	1.468	50	20	IDGD	
O=C(NNC(=O)c1ccsc1NC(=O)c1ccco1)c1csc(N2CCOCC2)n1	731471400	SJGBXGUXGJNGHS-UHFFFAOYSA-N	447.498	1.961	50	20	IDGD	
NS(=O)(=O)N1CCC(C(=O)NNc2ccc(Br)cc2C(F)(F)F)CC1	731479244	QWPIUWKPIGOYET-UHFFFAOYSA-N	445.261	1.827	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)CNS(=O)(=O)c1ccc(Br)s1	731493952	KFAIBYAIVAFCIG-UHFFFAOYSA-N	448.320	1.259	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)CCNS(=O)(=O)c1ccc2ccccc2c1	731494553	UBHJNEDWYRCPMC-UHFFFAOYSA-N	427.482	1.978	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)NCC2CCN(S(=O)(=O)C(F)(F)F)CC2)cc1	732703023	JRTNPLWGCKWRRN-UHFFFAOYSA-N	433.412	1.064	50	20	IDGD	
C[C@@H](CC(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)c1ccccc1	732861806	QMDIOKKANQPMML-KSSFIOAISA-N	426.425	1.426	50	20	IDGD	
CC(C)CNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1	733170284	WKAAOAMCALILER-UHFFFAOYSA-N	441.513	1.881	50	20	IDGD	
COc1ccc(C(=O)CNC(=O)CCC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1	733170333	XRAMPPHGVRRFFT-UHFFFAOYSA-N	449.467	1.421	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(C(=O)NCC(=O)NNc2nccnc2Cl)cc1	734261107	SGGVFHZGSIWMFW-UHFFFAOYSA-N	440.913	1.034	50	20	IDGD	
O=C(NCCn1cccn1)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	734279364	DXPULZVOZNRQFU-UHFFFAOYSA-N	442.501	1.006	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)c1cc(N2CCNC2=O)ccc1F	737830308	HTEDHEIKXOYSKO-UHFFFAOYSA-N	433.465	1.553	50	20	IDGD	
CC(C)[C@H](C(=O)OCC(=O)NNC(=O)c1cccc(Cl)c1)N1C[C@@H](C)O[C@H](C)C1	741019270	DTOUGWZVOINLDF-HBUWYVDXSA-N	425.913	1.778	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)[C@@H]1CCCN(C(=O)COc2ccccc2)C1	741207909	MOEBUCVDGKTSEA-QGZVFWFLSA-N	435.484	1.721	50	20	IDGD	
CCn1nc(C)c(S(=O)(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)c1C	741645784	FEVGMSDUHBPQRY-UHFFFAOYSA-N	432.506	1.434	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)c2ccc(S(=O)(=O)C(F)F)cc2)c1	741830556	JOJXYVKKNKUDKA-UHFFFAOYSA-N	437.380	1.173	50	20	IDGD	
C[C@H](C(=O)N(C)CC(=O)NNC(=O)NCc1cccc(C(F)(F)F)c1)n1cccn1	742448228	ITBBHRLDMQCSAR-GFCCVEGCSA-N	426.399	1.452	50	20	IDGD	
O=C(CN1C(=O)[C@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O)NNc1ccc(C(F)(F)F)cc1[N+](=O)[O-]	743297736	WBWSGXNSJIKFGO-RFHZTLPTSA-N	428.323	1.219	50	20	IDGD	
COc1ccccc1C[C@@H](C)N(C)C(=O)NNC(=O)c1csc(N2CCOCC2)n1	743510172	QZGOATGCHQQOJQ-CQSZACIVSA-N	433.534	1.906	50	20	IDGD	
CCS(=O)(=O)c1ccc(C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)cc1	745835500	LOAJUYNSSKILSC-UHFFFAOYSA-N	442.497	1.846	50	20	IDGD	
C[C@H]1C[C@H](NC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)C(=O)N1c1ccccc1	745883034	RHVSKZIYWHIFEA-GUYCJALGSA-N	445.501	1.620	50	20	IDGD	
Cc1ccc(N2CCC[C@H](NC(=O)NNC(=O)c3cc([N+](=O)[O-])ccc3O)C2=O)cc1	745885739	WHGGHCZGEMBIRG-INIZCTEOSA-N	427.417	1.748	50	20	IDGD	
CCC1(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)CCOCC1	745930457	FOHDJTHDXRGQNN-UHFFFAOYSA-N	438.550	1.622	50	20	IDGD	
COc1cc(C=NNC(=O)[C@H](C)CN2C[C@H](C)O[C@H](C)C2)cc(Cl)c1OCC(N)=O	745986564	LHQIKEKCTVVOHU-MCIONIFRSA-N	440.928	1.408	50	20	IDGD	
O=C(NNC(=O)N1CCC(OCCN2CCCC2)CC1)C1CCN(c2ncccn2)CC1	745998267	IJNOGBOSHYYNLL-UHFFFAOYSA-N	445.568	1.011	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)[C@@H](C)S(=O)(=O)c2ccc(F)cc2)o1	746396761	CPFCGVLQVLPGJY-CYBMUJFWSA-N	425.482	1.884	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)NCCCCN1CCN(c2ccccc2)CC1	746756221	KEAGYLUBTFUMML-UHFFFAOYSA-N	449.559	1.810	50	20	IDGD	
C[C@H](C(=O)NNC(=O)c1ccc(C#N)cc1)N1C(=O)c2ccc(Br)cc2C1=O	747176184	PBIRURWEDWKJEH-SNVBAGLBSA-N	441.241	1.766	50	20	IDGD	
O=C(COCc1ccccc1)NNS(=O)(=O)c1ccc(C(=O)O)c(Br)c1	747618902	PGXDPJLEPGZRDC-UHFFFAOYSA-N	443.275	1.674	50	20	IDGD	
CSCC[C@H](NC(=O)c1ccc2ccccc2n1)C(=O)NNc1nnc(C)c(O)n1	747863964	PQZCOBUTVFWPAH-HNNXBMFYSA-N	427.490	1.429	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)c1nn(-c2ccc(F)cc2)cc1O	748039242	WIEMIKFYLDDVTO-UHFFFAOYSA-N	431.449	1.915	50	20	IDGD	
CS(=O)(=O)Nc1ccc(O)c(C(=O)NNc2nc(-c3ccccn3)nc3c2CCC3)c1	748340485	HAQQJJIKYZQHTO-UHFFFAOYSA-N	440.485	1.861	50	20	IDGD	
O=C(COC(=O)CNC(=O)c1cc(-c2ccccc2)on1)NNC(=O)c1cccs1	749320189	HBSPMTFBGWZYIO-UHFFFAOYSA-N	428.426	1.137	50	20	IDGD	
O=C(NCc1ccc(Oc2ccccc2)nc1)NNC(=O)c1ccc(-n2cnnn2)cc1	749421747	YTHBJUQMZHRBBF-UHFFFAOYSA-N	430.428	1.994	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)N[C@H]2CCN(c3cccc(Cl)c3)C2=O)cc1	750670507	MFEQEDHXHQLCGQ-KRWDZBQOSA-N	427.848	1.726	50	20	IDGD	
O=C(NNS(=O)(=O)c1scc(Br)c1Br)c1cnccn1	751209237	ZTXCDTQOUYZHNL-UHFFFAOYSA-N	442.114	1.686	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)CCOc2cccc(C(N)=O)c2)CC1	751386676	ZNULOHXXFWOUIX-UHFFFAOYSA-N	449.508	1.284	50	20	IDGD	
N#CCCn1cc(/C=C(/C#N)C(=O)NCCOCC(N)=O)c(-c2ccc(Cl)cc2)n1	752082775	HSNHRKJGRPHPBL-GDNBJRDFSA-N	426.864	1.642	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)c1ccc(C(=O)NNC(=O)c2ncccc2C)cc1	752629974	HGHBTEHQBDSZGB-UHFFFAOYSA-N	432.440	1.243	50	20	IDGD	
O=C(NNS(=O)(=O)c1cnc2ccsc2c1)c1csc(N2CCOCC2)n1	753068733	NXFHFAXYWHSRCQ-UHFFFAOYSA-N	425.517	1.213	50	20	IDGD	
COc1cccc([C@H](C)CC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)c1	753275999	BMFMZYVXBFRQJD-MRXNPFEDSA-N	433.530	1.965	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)n([C@@H]2CCS(=O)(=O)C2)n1	755530193	FUKZFISQUSBSGV-TZMCWYRMSA-N	439.469	1.310	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)Nc1cccc(C(=O)OCc2ccccc2)c1	756450852	UHKSAJITSDBWNS-INIZCTEOSA-N	431.470	1.631	50	20	IDGD	
COC(=O)c1cc(NC(=O)NNC(=O)c2c(C)nc3ccccn23)cc(S(C)(=O)=O)c1	757673840	LOEQVOFZVXILFL-UHFFFAOYSA-N	445.457	1.299	50	20	IDGD	
Cc1cc(S(C)(=O)=O)cc(C(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)c1C	758946826	NJVRGBUFVOGHCU-UHFFFAOYSA-N	438.889	1.978	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)N2CCC(n3cc(C(=O)OC)nn3)CC2)c1C	760105493	UPIGTTFNGIFLEI-PDGQHHTCSA-N	440.504	1.900	50	20	IDGD	
Cc1ccnc(-n2nccc2NC(=O)C(=O)NNC(=O)C2=S=C3CC[C@@H](C)CC3=C2)c1	760277714	PYKGUDBJBBGWSN-GFCCVEGCSA-N	438.513	1.500	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)c1cn(-c2cccc(Cl)c2F)nn1	760439393	FFGVAUJDIMLNAM-UHFFFAOYSA-N	426.836	1.736	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)CNC(=O)c1c[nH]c2ccccc2c1=O	762373331	MRUWTYRYWFKAGY-UHFFFAOYSA-N	440.481	1.206	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNS(=O)(=O)c2cnc3onc(CC)c3c2)cc1	762436745	FLTLHSMEDWIZJI-LBPRGKRZSA-N	434.474	1.961	50	20	IDGD	
CCCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)cc1	763601202	QDTORIFQJKQEAL-UHFFFAOYSA-N	434.456	1.616	50	20	IDGD	
CCS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(C)nc3ccccc23)cc1	763615276	CXXCYIUJLGJIJA-UHFFFAOYSA-N	440.481	1.737	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N1CCC[C@H](S(C)(=O)=O)C1	763642352	QKBZNVNEBVTFMT-RISCZKNCSA-N	448.339	1.466	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)NCc1ccc(N2CCCS2(=O)=O)cc1	763702170	SCQLDEVJFXGILI-UHFFFAOYSA-N	438.531	1.456	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(NC(=O)CCN(C)C)cc2)cc1	763831501	YPTJCBNGQPULFY-UHFFFAOYSA-N	425.489	1.539	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)C(=O)Nc1cnn(-c2ccccc2)n1	763849308	IHGFLRTWUSMBDQ-OAHLLOKOSA-N	444.451	1.974	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cccc3c2OCCC3=O)cc1	763872268	MZTBUFMNLXLPOX-CYBMUJFWSA-N	439.424	1.408	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)C(=O)Nc1cccc(Cl)c1SC(F)F	764003031	WUJIWXVTGYIPQA-SSDOTTSWSA-N	441.865	1.175	50	20	IDGD	
CC(C)N(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)CSc2ccccc2O)c1	764047449	JRFYKPGJONMUEV-UHFFFAOYSA-N	437.543	1.974	50	20	IDGD	
COC(=O)CCSc1cccc(NC(=O)C(=O)NNC(=O)c2cccc(OC)c2O)c1	764131338	FCDRCVKWGRDJAX-UHFFFAOYSA-N	447.469	1.456	50	20	IDGD	
COC(=O)c1ccc(-n2cc(C)cn2)c(NC(=O)C(=O)NNC(=O)c2ccc(C#N)cc2)c1	764177520	QHPKDYBBVSPFCA-UHFFFAOYSA-N	446.423	1.239	50	20	IDGD	
O=C(CCCc1ccccc1)NNC(=O)C(=O)Nc1ccc(N2C(=O)CCCC2=O)cc1	764226742	RDICXLHJVQTANX-UHFFFAOYSA-N	436.468	1.839	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)C(=O)Nc1cccc(OC[C@H]2CCCO2)c1	764243365	VLVOPZGSLCTIGE-LJQANCHMSA-N	436.468	1.985	50	20	IDGD	
Cc1ncsc1C(=O)NNC(=O)C(=O)Nc1ccc(CCN2CCSCC2)cc1	764244146	AWAKVDLNVNLXKC-UHFFFAOYSA-N	433.559	1.443	50	20	IDGD	
COC(=O)c1sccc1NC(=O)C(=O)NNC(=O)c1cc(F)ccc1Br	764271179	WTBUFHNROUQVKE-UHFFFAOYSA-N	444.238	1.836	50	20	IDGD	
CN(C)c1nnc(-c2ccc(NC(=O)C(=O)NNC(=O)Cc3ccccc3F)cc2)o1	764312932	DPOZIISPOLCCGC-UHFFFAOYSA-N	426.408	1.270	50	20	IDGD	
C[C@H]1CN(Cc2cccc(NC(=O)C(=O)NNC(=O)Cc3ccncc3)c2)C[C@H](C)O1	764354450	RINVCYKWGHHHMA-HOTGVXAUSA-N	425.489	1.019	50	20	IDGD	
CCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)c(C)c1	764393976	MCJPKFIDFYEDAF-UHFFFAOYSA-N	430.486	1.329	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1F)C(=O)Nc1cc(F)cc(N2CCOCC2)c1	764410459	HQYSUUUNWRIXJV-UHFFFAOYSA-N	438.818	1.855	50	20	IDGD	
COc1ccc(Oc2ccc(Cl)cc2NC(=O)C(=O)NNC(=O)[C@H]2COCCO2)cc1	764434866	SGLQYXSXRDWTCE-QGZVFWFLSA-N	449.847	1.642	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCCCCC2)cc1C(=O)NNc1nccnc1OC	764471557	YFRJCJQFQVFBKQ-UHFFFAOYSA-N	435.506	1.815	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NN=Cc1cnn(Cc2ccccc2)c1	764817799	INRSUXGIXYRNCI-UHFFFAOYSA-N	430.512	1.840	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1cnn(-c2ccccc2Br)c1	766260470	FZQMBISKKSTQSD-UHFFFAOYSA-N	432.238	1.515	50	20	IDGD	
CCCn1nc(C)c(C(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)c1C	766641656	KHIIZEXADCLTEK-UHFFFAOYSA-N	426.565	1.797	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)CCNS(=O)(=O)c1ccc(F)cc1	768635513	CXYUOIUIFUQJPO-UHFFFAOYSA-N	445.494	1.050	50	20	IDGD	
C[C@@H](CBr)COC(=O)c1cc(S(=O)(=O)N(C)C)ccc1N1CCOCC1	770333895	YIAYAFLLEKUQKQ-ZDUSSCGKSA-N	449.367	1.961	50	20	IDGD	
O=C(COC(=O)c1ccn(Cc2ccccc2)n1)NNC(=O)[C@H]1COc2ccccc2O1	772470934	NEQHYKGFIPSYNO-LJQANCHMSA-N	436.424	1.076	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)c1ccc([C@]2(C)NC(=O)NC2=O)cc1	772962487	BWOWWJHWFXFLOR-YBTHPKLGSA-N	430.848	1.623	50	20	IDGD	
Cc1ccc(-n2nc(C)cc2NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)nn1	773496470	MSDDRGWLTRXEIF-UHFFFAOYSA-N	432.444	1.020	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)c1cn(-c2ccccc2Br)nn1	778447614	AUCQZZGJLUCWEF-UHFFFAOYSA-N	439.270	1.316	50	20	IDGD	
C[C@@H]1C(=O)CC[C@H](C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)C1(C)C	780171135	IBPYOWAXRDJKHI-RHSMWYFYSA-N	435.546	1.874	50	20	IDGD	
COc1cccc(NNC(=O)Nc2ccc(F)c(S(=O)(=O)N3CCOCC3)c2)n1	780502743	XLPYMGBCVCIGCJ-UHFFFAOYSA-N	425.442	1.399	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)c1ccc(Cl)c(N2CCNC2=O)c1	780973794	GXOQRUXSKHHFBH-UHFFFAOYSA-N	425.873	1.545	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)NCc1ccccc1CN1CC[C@H](O)C1	781824799	LXROGDTWTSSJRL-KRWDZBQOSA-N	430.530	1.582	50	20	IDGD	
O=C(CC(F)(F)F)NNC(=O)C(=O)Nc1ccc2c(c1)CCC(=O)N2CC(F)(F)F	782118451	XFGBSOHHVXNLEB-UHFFFAOYSA-N	440.300	1.566	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C(=O)Nc2ccc(Oc3cccnc3)nc2)nc2ccccc21	782885773	IIQTZXVIKOYCOL-UHFFFAOYSA-N	445.439	1.484	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2cccc(S(=O)(=O)NC3=NCCC3)c2)cc1	783022318	MFCGQYZAIREZJI-UHFFFAOYSA-N	431.474	1.248	50	20	IDGD	
CNS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccc(Br)cc2F)cc1	783081083	MYIBJRXDEASGDJ-UHFFFAOYSA-N	445.270	1.578	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2ccc(N3CCc4sccc4C3)cc2)CCS(=O)(=O)C1	783425291	HRJJPXVFAFNGCU-HXUWFJFHSA-N	448.570	1.447	50	20	IDGD	
CC1CCN(CCc2cccc(NC(=O)C(=O)NN[C@]3(C)CCS(=O)(=O)C3)c2)CC1	783427246	NPUSIGKAYWODCC-OAQYLSRUSA-N	436.578	1.098	50	20	IDGD	
Cc1nn(-c2ccc(C#N)cc2)c(NC(=O)C(=O)NNc2ccc(-n3cccn3)nn2)c1C	783433026	KECUXXAXPIAVAM-UHFFFAOYSA-N	442.443	1.418	50	20	IDGD	
CC(C)(C)Cc1nc2cc(NC(=O)C(=O)NNC(=O)CNC(=O)c3ccco3)ccc2o1	784002862	VGCJRPXVRCZCKV-UHFFFAOYSA-N	441.444	1.525	50	20	IDGD	
O=C(NNc1ccc(OC(F)(F)F)cc1)C(=O)Nc1cc(-n2cnnn2)ccc1F	784802083	PMYKBMWAAWDKKF-UHFFFAOYSA-N	425.302	1.782	50	20	IDGD	
COCCCS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccc(F)c(F)c2F)cc1	784820325	NYNPICQVDNZCIQ-UHFFFAOYSA-N	445.419	1.996	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1ccc2c(c1)C[C@@H](OC)C2	785330759	LJTJWHNVMXXKGW-HNNXBMFYSA-N	433.486	1.294	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CCc2c(C)nc3nc(N)nn3c2C)ccc1OC(C)C	789042938	XUWXFSZSMSLMQD-UHFFFAOYSA-N	441.492	1.513	50	20	IDGD	
CSC1(CNC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)CCC1	789289592	OKLDFWIIBCJDML-UHFFFAOYSA-N	426.564	1.701	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1nc2c(s1)C[C@H](C(C)(C)C)CC2	789739494	OWKJCXKDRAVUBE-VXGBXAGGSA-N	426.539	1.432	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)[C@@H]1CC(=O)c2ccccc21	789813947	KXAUTRMLQUCTBV-HXUWFJFHSA-N	440.931	1.975	50	20	IDGD	
C[C@H](c1cccc(N2CCOC2=O)c1)N(C)C(=O)NNC(=O)CNC(=O)c1ccco1	789839757	NDTBOAGEKUDOMN-CYBMUJFWSA-N	429.433	1.400	50	20	IDGD	
CCc1[nH]nc(C(=O)NNC(=O)c2nn(CC)c(=O)c3ccccc23)c1Br	789868963	NXNWWOJTBNFZKT-UHFFFAOYSA-N	433.266	1.539	50	20	IDGD	
CNS(=O)(=O)c1cccc2c1CCN(C(=O)NNC(=O)c1cc3ccccc3o1)C2	790759233	GGDMVSHNWNPJBB-UHFFFAOYSA-N	428.470	1.754	50	20	IDGD	
Cc1ccc(CN2CC[C@@H](NC(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)C2=O)cc1	791076514	VOGQJCVYPAQJKU-QGZVFWFLSA-N	447.536	1.731	50	20	IDGD	
O=C(Cc1ccc(I)cc1)NNC(=O)Cc1cn2ccccc2n1	792601493	FOBVDVJTOYXHKC-UHFFFAOYSA-N	434.237	1.872	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCc2ccc(NC(=O)N(C)C)cc2)cc(OC)c1OC	792776102	FOVQILKBBNZQQS-UHFFFAOYSA-N	445.476	1.950	50	20	IDGD	
CCOC(=O)c1ccc(NNC(=O)[C@H](NS(=O)(=O)c2ccc(C)cc2)[C@@H](C)O)cc1C	794657977	MGHJDFCECPOPGG-DNVCBOLYSA-N	449.529	1.651	50	20	IDGD	
COC(=O)Cn1ncc(NC(=O)C(=O)NNc2nc(-c3ccc(Cl)cc3)no2)c1C	797078824	XRJAGJVAPPFDLJ-UHFFFAOYSA-N	433.812	1.150	50	20	IDGD	
CC(C)(C)Oc1ccccc1NC(=O)C(=O)NNC(=O)CNC(=O)OCc1ccccc1	797368451	AZXIBLKBHGHENR-UHFFFAOYSA-N	442.472	1.876	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccco2)c1	798325583	OWZCRAKWOPOJJQ-UHFFFAOYSA-N	445.453	1.304	50	20	IDGD	
Cn1ncc2c1C[C@H](C(=O)NNC(=O)CN1CCN(Cc3ccc(Cl)cc3)CC1)CC2	798980347	MNRBVBCHRYDDSM-QGZVFWFLSA-N	444.967	1.144	50	20	IDGD	
COCCCNC(=O)NNC(=O)c1cc([N+](=O)[O-])cc(I)c1C	801140257	HCDYVCCANOLWQH-UHFFFAOYSA-N	436.206	1.488	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)[C@](C)(O)CCc3ccccc3)cc2)CC1	801176247	SZPJQKOCGFKNQL-JOCHJYFZSA-N	446.573	1.450	50	20	IDGD	
COC(=O)c1c(F)cc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)cc1F	802567615	RLCBXERFJIHAHF-UHFFFAOYSA-N	439.396	1.335	50	20	IDGD	
CC(C)(C)CC(=O)NNS(=O)(=O)c1ccc(S(C)(=O)=O)cc1Br	802722379	YHEDHIXDKFMLJE-UHFFFAOYSA-N	427.342	1.598	50	20	IDGD	
C[S@@](=O)Cc1ccc(CNC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc1	805867967	VQKLKOZPEOMWIW-SSEXGKCCSA-N	427.486	1.601	50	20	IDGD	
CCc1ccc(NC(=O)C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1Cl	806979256	XCBNGOUFMVVDAA-UHFFFAOYSA-N	430.896	1.695	50	20	IDGD	
CN(C)CCn1ncc(C(=O)NNC(=O)Cc2cn3ccccc3n2)c1-c1ccccc1	806988768	RCFOHEJMAXQKOM-UHFFFAOYSA-N	431.500	1.763	50	20	IDGD	
COc1cc(C)c(NC(=O)C(=O)NNC(=O)CNC(=O)OCc2ccccc2)c(C)c1C	807069980	IEZHDRYBDPBMHM-UHFFFAOYSA-N	442.472	1.633	50	20	IDGD	
CCc1nnc(NC(=O)[C@H](C)[C@@H](C)NC(=O)NNc2ccc(-n3cccn3)nn2)s1	807565167	HTTJTROGFHZGFN-GHMZBOCLSA-N	430.498	1.366	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)NCc1ccncc1OC[C@@H]1CCOC1	807614861	ALFQTNCHFKMOHP-LSDHHAIUSA-N	432.452	1.934	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)OCc2cc(=O)n(C)c(=O)n2C)c(C)n1C[C@@H]1CCCO1	808423545	QIRGRHULQKBVHR-VZZQTLFRSA-N	426.473	1.332	50	20	IDGD	
Cc1cc(C(F)(F)F)nn1CC(=O)N1CCN(S(=O)(=O)CBr)CC1	810909897	SNCZLLLURGDFES-UHFFFAOYSA-N	433.250	1.037	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)CNC(=O)c2c(F)cccc2Cl)cc1	812732522	KHFVPVLRLQNRPG-UHFFFAOYSA-N	428.873	1.603	50	20	IDGD	
COC(=O)c1cn(-c2cccc(NC(=O)C(=O)NNc3ccc4ccccc4n3)c2)nn1	812981346	WESKTCDLFGZFNF-UHFFFAOYSA-N	431.412	1.684	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NC[C@@H]2C[C@H](F)CN2C(=O)OC(C)(C)C)cc1OC	813813720	BYUKDHWJWNIPSY-KBPBESRZSA-N	440.472	1.995	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(/C#N)C(=O)NS(=O)(=O)c2cncc(C#N)c2)c1C	813982491	LAJPNMYDTRIRKH-YCTMVFBPSA-N	427.486	1.991	50	20	IDGD	
COC(=O)CCc1csc(NC(=O)NNc2ccccc2S(=O)(=O)N(C)C)n1	814672895	RAVCKCWWOOYONW-UHFFFAOYSA-N	427.508	1.648	50	20	IDGD	
CCOc1ccc(NNC(=O)C(=O)Nc2ccc(S(=O)(=O)NCCOC)cc2)cc1	815816696	JEONLYDRHBBXAN-UHFFFAOYSA-N	436.490	1.092	50	20	IDGD	
Cc1nc(C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)c(Br)s1	816828205	WDMVTGRVODPFIN-UHFFFAOYSA-N	446.352	1.890	50	20	IDGD	
COc1ccc(C(=O)NNc2cccc(Cl)n2)cc1S(=O)(=O)N1CCOCC1	817011213	KHIMFEGODRXPLP-UHFFFAOYSA-N	426.882	1.521	50	20	IDGD	
O=C(CCCNS(=O)(=O)c1ccc2c(c1)OCCCO2)NNC(=O)C1CCCC1	914849337	WTXZZVDEBHMQRR-UHFFFAOYSA-N	425.507	1.244	50	20	IDGD	
Cc1ccc([C@@](O)(CC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)C(F)(F)F)o1	915077163	GVARNGUKYJHACE-INIZCTEOSA-N	434.392	1.593	50	20	IDGD	
COC(=O)c1cc(CNC(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)ccc1OC	915891963	ZYYIXBHDVDIJDI-UHFFFAOYSA-N	428.445	1.568	50	20	IDGD	
CNS(=O)(=O)Cc1ccc(CNC(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)cc1	916228871	NJCNBTJXEBRJDH-MRXNPFEDSA-N	448.545	1.651	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)NCCS(=O)(=O)Cc1ccccc1	916636398	AWWKLLCXHJJDPR-UHFFFAOYSA-N	425.894	1.908	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NCc3cc4ccccc4o3)nc2)CC1	916646182	COJWQQLJHDNDRH-UHFFFAOYSA-N	444.517	1.590	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)c2cc3c(=O)n4ccccc4nc3n2C)cc1	917059707	GPPFJBBFFUZWAW-CQSZACIVSA-N	449.467	1.813	50	20	IDGD	
Cc1nn(-c2ccccc2)c(N2CCCC2)c1C=NNC(=O)N[C@H]1CCS(=O)(=O)C1	920381119	OFTSHDAIEFMZLR-INIZCTEOSA-N	430.534	1.601	50	20	IDGD	
O=C(NCc1ccco1)NNC(=O)c1cccc(S(=O)(=O)NCc2cccs2)c1	920856418	HIAQKEOKSVDJHK-UHFFFAOYSA-N	434.499	1.964	50	20	IDGD	
COc1ccc([C@H](CC(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)NC(C)=O)cc1	921183532	AXGHUUVVQFPBNQ-IBGZPJMESA-N	426.473	1.665	50	20	IDGD	
O=C(CC1(CC(=O)N2CCOCC2)CCCC1)NNC(=O)c1ccc2c(c1)OCCO2	1317737537	CYPZITJOKLGISZ-UHFFFAOYSA-N	431.489	1.418	50	20	IDGD	
CC/C=C(\C)C(=O)N1CSC[C@H]1C(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	1322746276	JWMAZYSCDFUYDY-LYOQKUPSSA-N	440.547	1.501	50	20	IDGD	
O=C(CNC(=O)c1cc2ccccc2[nH]1)NNc1nc(Br)cn2ccnc12	1323566334	HJBFTDFRWGTUDS-UHFFFAOYSA-N	428.250	1.846	50	20	IDGD	
CCN1CCN(C(=O)c2ccc(NC(=O)NNC(=O)c3ccc(OC)cc3)cc2)CC1	1342388862	DWWITCBPMNGSSX-UHFFFAOYSA-N	425.489	1.939	50	20	IDGD	
COc1ccc(CCC(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)c(F)c1	1778289310	YAHKFACUXYVQSS-FXAWDEMLSA-N	428.888	1.197	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCc2nc(N)n[nH]2)C1	1779241483	PEYBQUBWIZPACH-NXOUGTEYSA-N	447.367	1.070	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H]1CCc3nc[nH]c3C1)C2	1779545612	CGGJMYHJFMTYKU-DKZVUGQWSA-N	448.640	1.880	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cn4[nH]cnc(=O)c4c3C)C2)C1	1780016170	FMOCINYRNVTXEX-FOIQADDNSA-N	435.912	1.182	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccccc3C(=O)OCCO)C2)C1	1780156733	VNDDGWLTZVEFQT-LAUBAEHRSA-N	438.908	1.297	50	20	IDGD	
COc1ccc([C@H](O)C(=O)N2CCO[C@]3(CCN(C(=O)[C@](C)(Cl)CCl)C3)C2)cc1	1781226135	VSJDGTDWADLCAK-PWIZWCRZSA-N	445.343	1.795	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)c3cnc4snnc4c3)CCO2)C1	1781231087	GHKNRBLLOCSWGQ-IAGOWNOFSA-N	444.344	1.766	50	20	IDGD	
O=C(Cc1cccc(F)c1F)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2	1781923019	AKSKQBWDQUHUII-JXXFODFXSA-N	430.879	1.621	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(OC)cn1)C2	1782172379	APSMMPDFOZWCRP-XAUMDUMWSA-N	425.913	1.472	50	20	IDGD	
Cn1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)/C(C#N)=C/c4ccc(F)cc4F)C3)C2)cn1	1782864330	SYFQMVQZHYIDGG-XXFFJTNUSA-N	441.438	1.749	50	20	IDGD	
CCOC(=O)[C@@H]1CCC[C@H](C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](Cl)COC)C3)C2)C1	1783870410	BLOJWGSNQHEECV-DLRJPAPCSA-N	444.956	1.440	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3c(F)cc(OC)cc3F)CCO2)C1	1783881531	RWVTWJRPKNLCDN-YJYMSZOUSA-N	432.851	1.671	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3CCN(C)CC3)C[C@@H]21	1783964080	JJJBQPMSFPSJTF-IWCQGFGOSA-N	430.387	1.339	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)cc1	1785107894	RYHLBHBUCCRJHY-DJJJIMSYSA-N	438.322	1.872	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)c1	1785111971	VJFDSVYEEHTAQF-QAPCUYQASA-N	442.285	1.779	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3cccc(OC)n3)[C@H]2C1	1785227906	HJILVKOGEHYGLR-DKIMLUQUSA-N	439.940	1.256	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc(Cl)nc3)C[C@@H]21	1786404851	WMRQCXVDVJIMQZ-DRZSPHRISA-N	431.718	1.508	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=N/O[C@@H]3CCCCO3)C[C@@H]21	1786406454	UAIUQXVYRZDVBS-ONDITIQCSA-N	446.342	1.280	50	20	IDGD	
COc1ccc(CCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]3C2)cn1	1788765650	NEAIJCCHEXZFTP-FHWLQOOXSA-N	449.624	1.854	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CC(=O)Nc3cc(C)on3)C[C@@H]21	1789860296	OEWLBPNFGIHWAI-XQLPTFJDSA-N	426.901	1.309	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4cnccc4[nH]3)C[C@@H]21)[C@@H](F)Br	1789925736	IIPISMQAURIZOS-UDNPPVAFSA-N	439.285	1.847	50	20	IDGD	
Cc1nccn1[C@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]2C1	1789927288	SYZVUAIMMGKVPZ-QPGZIWCOSA-N	431.306	1.423	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4n(n3)CCC4)C[C@@H]21	1791056073	NBDRYLHJWMPHTN-DUPGQFARSA-N	425.327	1.206	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]3C2)n(C(F)F)n1	1791059179	QIHKFWOTNDBIOG-UHXUPSOCSA-N	449.296	1.963	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cc(F)cc(F)c3)C[C@@H]21	1791253943	FUZPETPKEZVWEA-RUGDWHBFSA-N	430.879	1.741	50	20	IDGD	
Cc1ccc(C)c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]3C2)c1	1791292246	KLBVVPZLDVWCLZ-IHPCNDPISA-N	430.549	1.270	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1ccc(C2(NC(=O)C[C@@H]3NC(=O)NC3=O)CCC2)cc1	1791432332	VUWUZEPGZJZIGY-MFKMUULPSA-N	437.294	1.502	50	20	IDGD	
CCOc1c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](O)CCl)cnc2c1cnn2C	1793109596	BNHHGAKVZHSDMO-OQMKEHIESA-N	435.912	1.219	50	20	IDGD	
Cc1ccncc1CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)CBr)C2	1794100298	VCNRFDLSQIWTEI-VYCZESIESA-N	438.366	1.943	50	20	IDGD	
COc1ncc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCBr)C3)cc1F	1794363271	LSCUIPGGGBGZFY-JJLQDPRZSA-N	430.274	1.218	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(-n3ccnc3)ccn1)C2	1795114848	DMKDPYVGEZVVRZ-ZSBFGKGUSA-N	448.321	1.256	50	20	IDGD	
O=C(CC[C@H]1CNc2ccccc2C1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2	1795647818	VIMOESIBVKSVJE-OWQBGRFZSA-N	435.952	1.240	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cncc(F)c1)C2	1796890076	YLFRIJWZLDRVTB-FQKKEUPESA-N	426.452	1.607	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Cl)C3)C1	1797222086	ZJMWLVFNNVWZHH-RMEBNNNOSA-N	433.908	1.367	50	20	IDGD	
O=C1Cc2cc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@@H](F)Br)C4)ccc2N1	1797332652	CQWHWEWFGRYTQK-NOXHYTERSA-N	440.269	1.075	50	20	IDGD	
Cc1ccc(OC(C)(C)C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CCC(=O)NN(C)C)C3)nc1	1799867790	PIYVKKDXEGJUIP-BCDXTJNWSA-N	445.564	1.559	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1C[C@H]1F)C2)[C@H](Br)Cc1ccccc1	1800436719	NBPIQLWGOQLARJ-ZKZVPCBQSA-N	439.325	1.940	50	20	IDGD	
COc1ccccc1CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)CBr)C2	1800628261	XCIQOEWFBHIIBK-JNNRSPCRSA-N	439.350	1.858	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cccc([N+](=O)[O-])c1)C2	1800754206	JCNKIQXMVCPEQY-MBMVNNNZSA-N	440.294	1.510	50	20	IDGD	
CN(C)C(=O)c1cccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)C(Cl)Cl)C3)c1	1801916574	VYRZUDUURLHNRL-QDMKHBRRSA-N	428.316	1.395	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H]2[C@@H](C1)[C@@H]2C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](O)CCl)C2	1801929470	UHCNPKPDMHQHNB-DKGRAKJVSA-N	441.956	1.337	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCNC(=O)c1ccccc1	1801948457	PZSQKJGABXGOIZ-DMUMMCEESA-N	435.952	1.804	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc3cc[nH]c3cc1F)C2	1802337126	RTDQYVMCQTUSBY-MUJYYYPQSA-N	429.496	1.932	50	20	IDGD	
Cc1ccc(CCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CCC(=O)NN(C)C)C3)c(C)n1	1802747618	FBUMSTUWUONXEL-ACDBMABISA-N	429.565	1.642	50	20	IDGD	
O=C(C[C@@H]1CCCCO1)N1CCCC2(CCN(C(=O)c3ccc(B(O)O)cc3)CC2)C1	1806592538	VLEMUBSPYMTJJR-FQEVSTJZSA-N	428.338	1.170	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)[C@H]2CCC(=O)N2)[C@@H]1c1cccnc1	1806823327	BLOMHALAVBYELF-MPTYRVRUSA-N	437.338	1.540	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2cnncc2C(=O)O)[C@H]1c1cccnc1	1808264418	YCTHZXJKRJKEOM-JQFCIGGWSA-N	431.880	1.907	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)C2(F)CC2)[C@H]1c1cccnc1	1808416202	GVLCRSNEXUEXOV-RMEHUUNGSA-N	440.479	1.724	50	20	IDGD	
O=C1CC[C@H](C(=O)N2CC[C@H](CNC(=O)[C@H](F)Br)[C@@H]2c2cccnc2)CN1	1808648740	BDLWFRYOYVDJGG-VRKREXBASA-N	441.301	1.304	50	20	IDGD	
O=C(/C=C\C(=O)N1CCC2(CCCN(C(=O)CCBr)C2)CC1)NC1CC1	1809067177	NMTWWQCIZUYTKZ-PLNGDYQASA-N	426.355	1.837	50	20	IDGD	
Cc1nc(F)ccc1C(=O)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1	1809977474	ACKUQAAMQYQIMS-UHFFFAOYSA-N	439.296	1.368	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)[C@H]2CC=CCC2)[C@H]1c1cccnc1	1810305366	KNUMLXOKZKGGIZ-CDXJDZJCSA-N	448.527	1.756	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@H]1CCN(C(=O)COc2cccnn2)[C@H]1c1cccnc1	1810547814	IYWUCZHLNFALEV-UTKZUKDTSA-N	443.580	1.808	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)c2ccc[nH]2)[C@H]1c1cccnc1	1810624926	YWJNKOWPGAWFPO-HNAYVOBHSA-N	433.472	1.042	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@H](CNC(=O)[C@@H](C)Br)[C@H]2c2cccnc2)nn1	1812866867	MJMJQEYUEGUBTK-SUYBPPKGSA-N	448.321	1.983	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)CN2CCCCC2=O)[C@@H]1c1cccnc1	1813033975	YKZYHWUDPXOLGG-ABSDTBQOSA-N	436.940	1.354	50	20	IDGD	
Cc1nnc(CCC(=O)N2CCCC[C@@H]2c2cc(NC(=O)[C@@H](O)CCl)n[nH]2)s1	1814868370	YYOURQYZFFCHKG-OLZOCXBDSA-N	426.930	1.794	50	20	IDGD	
O=C(Cc1ccsc1)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1817584298	SLOKUAGDZFSAGF-SFHVURJKSA-N	438.318	1.700	50	20	IDGD	
CO[C@H](C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)n[nH]1	1818113125	CJSFKHANECDKTI-QHOZVMDTSA-N	429.481	1.571	50	20	IDGD	
CCC1(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2ccc(B(O)O)cc2)CC3)CCC1	1818861494	ZJJVKGNPGONMNQ-HNNXBMFYSA-N	427.335	1.629	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)C2CC(F)(F)C2)[nH]n1	1819400625	OYXYTPFPAGIUGF-OAHLLOKOSA-N	447.446	1.759	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(=O)n2O)[nH]n1	1822186701	PPXSAPQDGDIUEG-PWSUYJOCSA-N	438.282	1.898	50	20	IDGD	
Cc1n[nH]c(C)c1C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1	1822415254	XKDNBHLMFOCGEG-HNNXBMFYSA-N	430.513	1.429	50	20	IDGD	
Cc1cccc(CC(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)n1	1824282388	GQLUDEIHYMNLOQ-QHCPKHFHSA-N	449.360	1.546	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)CCl)CC2	1825958922	OKVIHSWMBKKDRL-CZXHOFHRSA-N	441.937	1.410	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)Cc1ccccc1O)CC2	1826089766	NYWGOKMKNLLXNH-CQSZACIVSA-N	445.545	1.376	50	20	IDGD	
O=C([C@H]1CCCOC1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827054481	GISQOWKBVPXHHF-FPOVZHCZSA-N	428.338	1.026	50	20	IDGD	
O=C([C@@H](O)CCl)N1CCC([C@H]2CCCCN2C(=O)c2nc(O)n3c2CCCC3)CC1	1829134128	BLZMQBDQWZTIMO-WBVHZDCISA-N	438.956	1.758	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C#CC3(O)CCCCC3)C2)C1	1830365347	WVMPGMGSWZOVJJ-JOCHJYFZSA-N	440.968	1.406	50	20	IDGD	
O=C(C(=O)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1)c1ccc(Cl)cc1	1830689475	IYAKNJSDQFEUDD-GOSISDBHSA-N	449.718	1.783	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](NC(C)=O)C(C)(C)C)CCO2	1831095070	FZNMAMVMIQBVOJ-RZQQEMMASA-N	431.961	1.011	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ncn(C(C)C)n3)C2)C1	1831647374	UNOJHQLUJKRVAR-KXBFYZLASA-N	427.933	1.337	50	20	IDGD	
Cc1csc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)c1	1831782013	ICCIEEIJSGBNJZ-SUMWQHHRSA-N	431.352	1.910	50	20	IDGD	
Cc1cccc(CCC(=O)N2CCO[C@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)n1	1832618790	QGPSHUSHQRAWTQ-LJQANCHMSA-N	430.332	1.583	50	20	IDGD	
COC(=O)[C@@H]1CC[C@H](C(=O)NC2CCN(C3CCN(C(=O)[C@H](F)Cl)CC3)CC2)C1	1833309748	JDLGIOWTZUGIRF-VBQJREDUSA-N	431.936	1.682	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)C(C)(C)NC(C)=O)CC2)CC1	1833529704	GXJLTWNADKYCDJ-SFHVURJKSA-N	429.005	1.880	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3[nH]ccc3C)CCO2)C1	1833547414	BAXJTYXHSQLVGQ-KSSFIOAISA-N	428.327	1.567	50	20	IDGD	
CN(C)c1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)nc1	1833649577	UZBAXKNYIZGNPX-GOSISDBHSA-N	431.320	1.021	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(F)cn3)CCO2)C1	1834480910	VCZPBNUFMCAPAM-SJCJKPOMSA-N	430.274	1.074	50	20	IDGD	
CC[C@H](C)[C@@H](N)C(=O)NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1	1834686343	CQLQJNXBGOGPRR-MAZHCROVSA-N	435.382	1.622	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(=O)c1ccccc1)CCO2	1834705707	ZJZOKLYKPJUHPA-OAQYLSRUSA-N	434.565	1.177	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3ccc4nonc4c3)CC2)CC1	1835322808	XFGDTWXZMQRWER-QGZVFWFLSA-N	449.939	1.662	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)c1ccn2nccc2c1	1835626962	DFTVFUMHTZNMED-LJQANCHMSA-N	433.940	1.119	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](F)Cl)CC2)CC1)c1cc(-n2ccnc2)ccn1	1836185893	IJOGPIZLYZFJTM-LJQANCHMSA-N	448.930	1.987	50	20	IDGD	
Cc1ccc2oc(C(=O)N3CCO[C@@]4(COCCN(C(=O)[C@H](F)Cl)C4)C3)cc2n1	1836264914	MTEVOTPZPDGKTN-LPHOPBHVSA-N	425.844	1.741	50	20	IDGD	
O=C(c1ccc2nn[nH]c2c1)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836718912	IPCHSIDHDYWZIG-GOSISDBHSA-N	435.912	1.170	50	20	IDGD	
Cc1cc(C#N)cc(C(=O)N2CCOC[C@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)c1	1837715864	OJWXRAWFSNHMNF-QFIPXVFZSA-N	445.592	1.788	50	20	IDGD	
Cc1nccn1CC(=O)N1CCC(OC2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1838647973	COSKJISKVBMRCJ-QGZVFWFLSA-N	445.333	1.881	50	20	IDGD	
C[C@H](C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2)C1(O)CCC1	1839149922	WGSSVPBPMPGLEG-OLMNPRSZSA-N	437.364	1.230	50	20	IDGD	
Cn1cc(F)cc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2	1839153057	UASJGKYJIQCONZ-ZWKOTPCHSA-N	436.311	1.471	50	20	IDGD	
O=C(COc1ccccc1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839199248	LACGIQLFGNSANR-SJLPKXTDSA-N	445.285	1.212	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)C#Cc3ccccc3)C2)C1	1840032066	MYPXMVKYMXUEPS-OXJNMPFZSA-N	435.318	1.278	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(C)cc(C)n3)C2)C1	1840151426	BAXCWQIMJVTRJN-OXJNMPFZSA-N	425.913	1.022	50	20	IDGD	
Cc1cccc(F)c1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1840651521	CCOYVUHWUGLUSV-MAUKXSAKSA-N	447.276	1.895	50	20	IDGD	
CCOC(=O)c1c(CCC(=O)N2CC3(CCCN3C(=O)[C@H](O)CCl)C2)c[nH]c1C	1841347705	BXIONFITMKADGC-OAHLLOKOSA-N	425.913	1.236	50	20	IDGD	
CC(=O)N[C@@H](C(=O)N1CC2(CCCN2C(=O)CCBr)C1)c1ccc(F)cc1	1842638972	QTYHRUDFCAVSTL-QGZVFWFLSA-N	440.313	1.991	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2cc3sccn3c2)C1	1843236953	BEQKMVBLOSGVLH-OEAKJJBVSA-N	438.513	1.952	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1cc(O)nc3ccccc13)C2	1844264197	RQRUYISMVDJWGK-UHFFFAOYSA-N	446.467	1.070	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NN[C@H](C(=O)NC2CC2)c2ccc(F)cc2)c1	10833832	JDJKBMPIMXQDQL-SFHVURJKSA-N	434.493	1.330	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNS(=O)(=O)c1ccc(F)c(F)c1F	16098509	RHTCSKMJXVQPHY-UHFFFAOYSA-N	436.437	1.329	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)[C@H]2CC(=O)N(c3ccccc3Cl)C2)nc2ccccc21	16179059	VOZNJQCCPIJLNQ-ZDUSSCGKSA-N	425.876	1.970	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)Cc2n[nH]c(=O)c3ccccc23)c2ccccc2c1=O	17196403	BDJBDPKEMKMYSG-UHFFFAOYSA-N	432.440	1.218	50	20	IDGD	
Cc1cc(NC(=O)[C@H](C)SCC(=O)NNC(=O)c2cc(Br)c[nH]2)no1	28717795	OEYZQGYAEBGKNI-QMMMGPOBSA-N	430.284	1.595	50	20	IDGD	
CC(C)COC[C@H](NC(=O)NNC(=O)c1csc(N2CCOCC2)n1)c1ccco1	725868446	UVPPXONZTUWQBD-AWEZNQCLSA-N	437.522	1.931	50	20	IDGD	
C[C@H](NS(=O)(=O)c1ccc(Cl)cc1)C(=O)NNC(=O)[C@@H](C)Oc1ccc(F)cc1	726238467	UBURKRVDZLKVRG-NWDGAFQWSA-N	443.884	1.761	50	20	IDGD	
CCOC(=O)C1CCN(C(=O)CN(C)C(=O)/C(C#N)=C\c2cc(C#N)n(C)c2C)CC1	726539733	LJXIVRQPHYXKDM-ZDLGFXPLSA-N	425.489	1.372	50	20	IDGD	
O=C(CS(=O)(=O)Cc1ccc(Br)cc1)NNC(=S)NCC1CCC1	727865900	FLCMPRWKVQTLLM-UHFFFAOYSA-N	434.381	1.659	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)[C@@H](C)Sc2nnnn2C2CC2)c1	728525492	AYEULVYTSACGAH-MRVPVSSYSA-N	441.311	1.721	50	20	IDGD	
O=C(NCCN1CCCS1(=O)=O)NNC(=O)c1ccc(Br)cc1Cl	728952288	LJJJSCAHRAAMIU-UHFFFAOYSA-N	439.719	1.082	50	20	IDGD	
O=C(NCCNC(=O)c1cccnc1)NNC(=O)c1ccc(Br)cc1Cl	728956521	VDUSTPKYRFYYMW-UHFFFAOYSA-N	440.685	1.872	50	20	IDGD	
CC[C@@H](NC(=O)NNC(=O)c1ccc(OC)c(OC)c1)c1cccc(S(N)(=O)=O)c1	729222922	ZCTRXEIKTIFZRR-OAHLLOKOSA-N	436.490	1.447	50	20	IDGD	
Cc1ccccc1-c1nn(-c2ccccc2)cc1C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O	729277152	SPZQMDOTZSROCD-OAHLLOKOSA-N	441.513	1.546	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)N[C@H](CC)c1cccc(S(N)(=O)=O)c1	729612156	ABAHKFVMBKTNFA-QGZVFWFLSA-N	434.518	1.757	50	20	IDGD	
CCN1CCC[C@@H]1CN1C[C@H](C(=O)NNC(=O)CSc2ccc(Cl)cc2)CC1=O	729626326	CBPOSYSLUFOULP-GDBMZVCRSA-N	438.981	1.912	50	20	IDGD	
O=C(COC(=O)Cc1ccccc1Br)NNC(=O)[C@@H]1COc2ccccc2O1	729731364	URPSYJWGIWJHBM-INIZCTEOSA-N	449.257	1.522	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@H]2CC(=O)N(c3ccc(F)c([N+](=O)[O-])c3)C2)c(OC)c1	729950216	OPCLSNMRDDWXAB-NSHDSACASA-N	446.391	1.565	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2ccc(Br)cc2)c1	730130860	HKETXFQJKOOVQF-UHFFFAOYSA-N	426.292	1.997	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)c2nnn(-c3cccc4c3CCN(C)C4)c2C)cc1	731461351	QETVURVSSHLXKZ-UHFFFAOYSA-N	448.527	1.966	50	20	IDGD	
Cc1nc(CN2CCC(CNC(=O)NNC(=O)[C@@H]3COc4ccccc4O3)CC2)oc1C	732257037	BZESRKUPLJOWLE-IBGZPJMESA-N	443.504	1.674	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@H](C)N2CCN(c3ccc(F)cc3)CC2)cc1OC	732259014	XVHVYIKYCDCCLS-HNNXBMFYSA-N	430.480	1.815	50	20	IDGD	
O=C(C[C@H]1SC(N2CCCC2)=NC1=O)Nc1ccc(C(=O)NNc2cnccn2)cc1	734242530	JNIVEBWVURJYBB-OAHLLOKOSA-N	439.501	1.656	50	20	IDGD	
Cc1sc(=O)n(CC(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)c1C	734826083	WJFPUVSVKYYMCH-UHFFFAOYSA-N	427.527	1.257	50	20	IDGD	
CC[C@H](C)[C@H](NC(=O)N1CCCC1)C(=O)OCC(=O)NNC(=O)c1ccc(Cl)cc1	736837661	XXAKMVGFANOFIP-GUYCJALGSA-N	438.912	1.864	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)CCC[S@](=O)c1ccc(Br)cc1	740851584	MUHBCKHOCFQETA-SANMLTNESA-N	446.367	1.789	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)N[C@H](CNC(=O)OC(C)(C)C)C2CC2)nc2ccccc21	741435996	SRHATIBYIGBCIG-OAHLLOKOSA-N	430.509	1.750	50	20	IDGD	
O=C(NNC(=O)c1ncoc1-c1ccc2c(c1)OCCO2)c1ccc(-n2cnnn2)cc1	742035667	VLGRUSVLJRVKEQ-UHFFFAOYSA-N	433.384	1.163	50	20	IDGD	
CC(C)(C)OC(=O)NCc1ccc(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)o1	742481345	VDDKDTFLPDTAPX-UHFFFAOYSA-N	427.421	1.355	50	20	IDGD	
CNS(=O)(=O)c1ccc(C)c(C(=O)NNC(=O)c2cccc(Br)c2)c1	742769754	OZNDJDGJOFPFRH-UHFFFAOYSA-N	426.292	1.740	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2ccc(-c3ccco3)nc2O)ccc1Cl	743742392	SIJNSLILGMHMQR-UHFFFAOYSA-N	436.833	1.423	50	20	IDGD	
CC(C)(C)c1nc(CN2CCN(CC(=O)NNC(=O)c3ccc(C#N)cc3)CC2)cs1	744387933	ZKXIESUSLBOCMM-UHFFFAOYSA-N	440.573	1.891	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CN2CCCN(C(=O)c3cccc(Cl)c3)CC2)c1	744390155	DEFADDSEFWLOSO-UHFFFAOYSA-N	439.903	1.821	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CN2CCN(Cc3cn4cc(Cl)ccc4n3)CC2)c1	744390178	ABQMVDVDSFQQAI-UHFFFAOYSA-N	440.935	1.875	50	20	IDGD	
CN(C[C@H]1CCCN(CC(=O)NNC(=O)c2ccc(C#N)cc2)C1)C(=O)OC(C)(C)C	744393014	INZINMNSBNBFKR-QGZVFWFLSA-N	429.521	1.898	50	20	IDGD	
C[C@H](NC(=O)OC(C)(C)C)C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	744620620	IVVIFWVTVKRIOV-ZDUSSCGKSA-N	428.511	1.064	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)NCCCN1CCC[C@@H](C(N)=O)C1	745828907	AWHLMNDKRHQFSZ-QFBILLFUSA-N	441.532	1.525	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)[C@@H]1CC(=O)N(c2cccc(S(N)(=O)=O)c2)C1)c1ccccc1	746247359	MKZZFUMUXALZLM-CRAIPNDOSA-N	444.513	1.028	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1ccc2nc(S)oc2c1	746333619	WHWWWIGHSRTVSU-UHFFFAOYSA-N	434.499	1.894	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)/C=C\c1ccccc1)C(=O)NNC(=O)Cc1ccncc1	747428736	UUHXARHXBCIXMG-RXEWJAMOSA-N	448.570	1.484	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1F)c1cc(S(=O)(=O)N2CCSCC2)c[nH]1	747432193	YDKMNZNEEPLQPH-UHFFFAOYSA-N	446.913	1.620	50	20	IDGD	
O=C(NCCNC(=O)C1CC1)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1	747866643	RXIDSLVWYFSDCH-OAQYLSRUSA-N	435.528	1.470	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2c(C)cc([N+](=O)[O-])cc2C)cc(OC)c1OC	748639136	AXDHLNAIHKJINX-UHFFFAOYSA-N	439.446	1.861	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)ccc1F	748829247	PLMPHIKBHPGVBE-UHFFFAOYSA-N	428.392	1.400	50	20	IDGD	
Cc1cc(F)ccc1-n1cc(O)c(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)n1	751375983	BLOQXJPKSXZCJE-UHFFFAOYSA-N	439.451	1.493	50	20	IDGD	
CCOC(=O)[C@H]1Cc2cc(S(=O)(=O)NNC(=O)CCc3ccccc3O)ccc2O1	751549003	TZQXHZOEEPRYQF-GOSISDBHSA-N	434.470	1.201	50	20	IDGD	
CN(C)c1ncc(CNC(=O)NNC(=O)COc2ccccc2Cc2ccccc2)n1C	751806438	HMZKRHZFQODTNF-UHFFFAOYSA-N	436.516	1.986	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)CCc2ccccc2)c(C)c([N+](=O)[O-])c1	753839580	BJPWKPXFWUYSHC-UHFFFAOYSA-N	428.401	1.409	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(C(=O)O)c(C(F)(F)F)c1)c1ccc2c(c1)OCO2	754742109	YHMMHFAECKLNSZ-UHFFFAOYSA-N	432.332	1.756	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c(C(F)F)n1	754825560	BVJZHYZYNPJPMB-UHFFFAOYSA-N	427.433	1.217	50	20	IDGD	
CCOCCOc1cc(C)ccc1CNC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	755237095	IMQBSTFBRMKLPX-UHFFFAOYSA-N	449.529	1.958	50	20	IDGD	
C[C@H](NC(=O)OC(C)(C)C)[C@H](C)C(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	755381301	FFFGEQXQHBBOMW-RYUDHWBXSA-N	426.901	1.653	50	20	IDGD	
CNC(=O)Cc1ccc(NC(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)cc1	755658297	MYKBYUQYWIEIPP-UHFFFAOYSA-N	436.472	1.732	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)CNC(=O)c2ccccc2C(F)(F)F)C[C@H](C)O1	755681926	HFDOLFBTQMCRGC-STQMWFEESA-N	430.427	1.082	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)c1	756206113	JWYOAIGMEDTYBZ-UHFFFAOYSA-N	448.501	1.405	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)Nc2ccc3c(ccn3CC(=O)N3CCOCC3)c2)o1	756294903	VIMCRGZVFIHUOO-UHFFFAOYSA-N	425.445	1.868	50	20	IDGD	
CSc1cc2c(cc1NC(=O)NNC(=O)c1ccc(-n3cnnn3)cc1)OCCO2	756300741	NNXKCBHDQKWQOS-UHFFFAOYSA-N	427.446	1.622	50	20	IDGD	
CC(C)CC1(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)CC1	757251388	DTLONTNSMSJEKK-UHFFFAOYSA-N	438.550	1.478	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)c1cncc(I)c1	757724169	BLAIJAVOEAPMCX-UHFFFAOYSA-N	449.208	1.652	50	20	IDGD	
Nc1ncc([N+](=O)[O-])cc1C(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1	757939676	VJFYMJYSGDHCSN-HXUWFJFHSA-N	446.467	1.960	50	20	IDGD	
O=C(COC(=O)c1ccccc1CN1CCOCC1)NNC(=O)c1cccc(Cl)c1	758484039	ZNJUDXIIXOTDPL-UHFFFAOYSA-N	431.876	1.790	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)N[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1C#N	758780117	YCTFVPXMLCMENV-HZPDHXFCSA-N	431.493	1.717	50	20	IDGD	
CN(C)C(=O)N1CCC(C(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)CC1	758782670	VZQRJEBYQLOUED-UHFFFAOYSA-N	440.545	1.016	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NC[C@@H]1CC(=O)N(Cc2ccccc2)C1	759684639	VQHHYDJTBFXAAL-WBVHZDCISA-N	428.464	1.972	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)c2ccc(Cl)c(S(=O)(=O)N(C)OC)c2)nc1	759738768	PUZAPYRHGNFXSB-UHFFFAOYSA-N	428.854	1.460	50	20	IDGD	
CC[C@H]1CN(CC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)CCN1Cc1ccccc1	759892273	WXLHIWUJPXPCAJ-IBGZPJMESA-N	425.489	1.952	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)Nc1nc2ccccn2n1	760030748	GGCOFBJKYYKBHO-UHFFFAOYSA-N	443.489	1.370	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)[C@H]1CCCN(C(=O)NC2CCCC2)C1	760440118	RBYKMFUXKUWYJG-AWEZNQCLSA-N	425.530	1.413	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)c2ccc(=O)n(-c3cnn(C)c3)c2)cc1	760466150	NKUXCVCWNNBIBZ-CQSZACIVSA-N	425.445	1.198	50	20	IDGD	
COc1cc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc2c1O[C@H](C)C2	761073357	ZCTNUSAXGJYDRM-KZULUSFZSA-N	442.424	1.163	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)CN[C@H](c2ccccc2)C(F)(F)F)cc1	761452757	TYMAAKCRZUFNPJ-GOSISDBHSA-N	434.374	1.756	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)n(C)c1	761687410	ONBWKGXLPRJWQZ-UHFFFAOYSA-N	449.533	1.072	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2ccnc(Br)c2)cc1OC	762935539	QNBDIDQRGDJLDU-UHFFFAOYSA-N	438.234	1.479	50	20	IDGD	
COC(=O)c1ccc(Cl)cc1S(=O)(=O)NNC(=O)CSc1ccccc1O	763411500	GSIKTQMTYXKTAA-UHFFFAOYSA-N	430.891	1.934	50	20	IDGD	
O=C(NNC(=O)c1ccccc1)C(=O)Nc1cc(Br)cnc1-n1cccn1	763423406	PWZVDJNRBIWYDQ-UHFFFAOYSA-N	429.234	1.430	50	20	IDGD	
CC(C)(C)OC(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c1	763445181	FQEUOARZFAMUAM-UHFFFAOYSA-N	442.428	1.879	50	20	IDGD	
CC(C)CC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1	763455042	MQRHXJMNILVYOC-UHFFFAOYSA-N	427.417	1.979	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)Nc1cc2c(cc1Cl)OCCO2	763570607	FLFDCFMHOFGVPN-INIZCTEOSA-N	433.804	1.037	50	20	IDGD	
CC(=O)N1CCCc2cc(NC(=O)C(=O)NNC(=O)COc3cc(C)cc(C)c3)ccc21	763644804	MYFSKAUHGDNHFW-UHFFFAOYSA-N	438.484	1.767	50	20	IDGD	
CCn1cnnc1-c1ccccc1NC(=O)C(=O)NNC(=O)COc1ccccc1OC	763662951	ODEUETYAXGLBFK-UHFFFAOYSA-N	438.444	1.139	50	20	IDGD	
CCc1cccc2c1N(C(=O)C(=O)NNC(=O)c1nn(CC)c(=O)c3ccccc13)CC2	763787336	XPHZGAMDQSSNNF-UHFFFAOYSA-N	433.468	1.329	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccccc2N2C[C@@H](C)O[C@H](C)C2)cc1	763811735	LJORYZDQKBQUPJ-IAGOWNOFSA-N	440.500	1.774	50	20	IDGD	
CNC(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)c1	763842220	XJHNQKMNIIZECD-CYBMUJFWSA-N	446.891	1.870	50	20	IDGD	
Cc1ncc(NC(=O)C(=O)NNC(=O)c2nn(CCC(C)C)c(=O)c3ccccc23)s1	763843141	PAJSUDKXFQHIHF-UHFFFAOYSA-N	442.501	1.607	50	20	IDGD	
CNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc3ccccc3c2)c1	763851456	CUKFBJQPCZEIKP-AWEZNQCLSA-N	434.452	1.753	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1cccc(CN2CCCC2=O)c1	763873822	WWFSJAODHJBWMS-CQSZACIVSA-N	442.447	1.502	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1	763879554	XYFDQHLMVIJJHU-ZDUSSCGKSA-N	428.401	1.659	50	20	IDGD	
COC(=O)c1c(NC(=O)C(=O)NNC(=O)Cn2nc(C)cc2C)sc2c1CCCC2	763892216	BMMQEONWCASWNJ-UHFFFAOYSA-N	433.490	1.013	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)C(=O)Nc1ccccc1Sc1ccccc1	764002741	RILLIYKZEGQVRT-CYBMUJFWSA-N	433.511	1.358	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1ccc(N2CCCC2=O)c(F)c1	764006169	LOBUZJFQXYTPLO-UHFFFAOYSA-N	442.403	1.123	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cnccn2)n(-c2cccc(C(F)(F)F)c2)n1	764030757	GPFHVIPSSBVOPV-UHFFFAOYSA-N	433.350	1.389	50	20	IDGD	
O=C(NNC(=O)c1cccc(Br)c1)C(=O)Nc1cnn(CC(F)(F)F)c1	764059767	YXUDERHKQINXJV-UHFFFAOYSA-N	434.172	1.608	50	20	IDGD	
C[C@@H]1CCCN(S(=O)(=O)c2ccc(NC(=O)C(=O)NNC(=O)C3CCCC3)cc2)C1	764070996	PATXSASOABAOHX-CQSZACIVSA-N	436.534	1.383	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc(CCN(C)C)cc3)n[nH]2)cc1	764111638	PROZZNBGHYLHDG-UHFFFAOYSA-N	434.500	1.889	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1O)C(=O)Nc1cccc(N2CCCCC2=O)c1	764117774	RRYMBHDDFPDUPM-UHFFFAOYSA-N	430.848	1.962	50	20	IDGD	
O=C(CC1CCCC1)NNC(=O)C(=O)Nc1ccc2c(ccn2CCN2CCOCC2)c1	764178518	CCMWXCAMYSGCPA-UHFFFAOYSA-N	441.532	1.640	50	20	IDGD	
CNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(OC)ccc2Br)cc1	764233262	VVUGDZFVOMTPBG-UHFFFAOYSA-N	449.261	1.217	50	20	IDGD	
CC(=O)N1CCc2cc(NC(=O)C(=O)NNC(=O)c3cccc(OC(F)F)c3)ccc21	764251714	XPTDHCWLJUCMAK-UHFFFAOYSA-N	432.383	1.597	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)CCc2ccccc2O)c(Br)c1	764289503	VLDIAUFNJUPCDI-UHFFFAOYSA-N	436.262	1.882	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)C(=O)Nc1ccnn1Cc1ccc(Br)cc1	764297974	KDJDOVOOUNUZGO-UHFFFAOYSA-N	446.265	1.125	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)C(=O)Nc1ccc(OCC(=O)N(C)C)cc1)c1ccccc1	764325964	CMDRVJICZHLOKH-GOSISDBHSA-N	426.473	1.433	50	20	IDGD	
CCOCC(=O)NNC(=O)C(=O)Nc1ccnn1Cc1ccc(SC(F)(F)F)cc1	764326491	KLUYBZOXCDEPNJ-UHFFFAOYSA-N	445.423	1.666	50	20	IDGD	
Cc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NNC(=O)c1cnn(-c2ccccc2)c1	764346390	ZNJNSWPKYPMRCC-UHFFFAOYSA-N	434.456	1.282	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)cc1N1CCOC1=O	764349991	WSFRQVJWHWSSKU-UHFFFAOYSA-N	448.819	1.411	50	20	IDGD	
COCCn1ncc2ccc(NC(=O)C(=O)NNC(=O)c3cnn(-c4ccccc4)c3)cc21	764352087	ZZKMDQWYHHEBDM-UHFFFAOYSA-N	447.455	1.268	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)C(=O)Nc2cccc(C#Cc3ccccn3)c2)c1	764433136	KKFZUYXSJVAWFW-UHFFFAOYSA-N	442.435	1.235	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)C[C@@H]3COC(=O)C3)c2)cc1	764458198	SWTIWRLYEPFRDJ-ZDUSSCGKSA-N	447.469	1.210	50	20	IDGD	
COc1cc(C=NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cc(OC)c1OC	764818553	MTQRUSAGZAAWRI-UHFFFAOYSA-N	440.500	1.621	50	20	IDGD	
CC(C)NS(=O)(=O)c1cccc(C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)c1	765313372	LIHXQCFNHRQGON-UHFFFAOYSA-N	442.538	1.439	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)Nc1ccc(OC)cc1I	765412494	LJVDYZNNPYQMJO-VIFPVBQESA-N	437.234	1.504	50	20	IDGD	
O=C(NNC(=O)[C@@]1(O)CCSC1)c1ccccc1NS(=O)(=O)c1cccs1	765543792	OCRIZVZKNDBDKE-MRXNPFEDSA-N	427.529	1.178	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)c3cc(S(=O)(=O)N(C)C)c(C)o3)n[nH]2)c1	765580406	DMYFSDNCZLNCLO-UHFFFAOYSA-N	445.501	1.920	50	20	IDGD	
COCCNS(=O)(=O)c1cccc(CNC(=O)NNc2ncnc3ccsc23)c1	765779239	IGCALIVGPQFNEN-UHFFFAOYSA-N	436.519	1.442	50	20	IDGD	
CC(C)CN1N=C(C(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)CCC1=O	766646606	BINGRSLPQCNLCS-UHFFFAOYSA-N	438.529	1.351	50	20	IDGD	
COC(=O)Nc1ccccc1C(=O)NNC(=O)CN1CCN(Cc2ccc(C)cc2)CC1	766650608	XHONATWOXYTZHU-UHFFFAOYSA-N	439.516	1.752	50	20	IDGD	
COc1ccc([C@]2(C)NC(=O)N(CC(=O)NNc3ccc(OC)cc3[N+](=O)[O-])C2=O)cc1	768329053	NGMQAUFOIZBCHF-FQEVSTJZSA-N	443.416	1.522	50	20	IDGD	
C[C@H]1CCCN(S(=O)(=O)c2cc(C(=O)NNC(=S)Nc3ccccn3)n(C)c2)C1	768579449	NUERDPSOQRJRSY-ZDUSSCGKSA-N	436.563	1.472	50	20	IDGD	
O=C(NNC(=S)Nc1ccccn1)[C@@H]1CCCN(S(=O)(=O)Cc2ccccc2)C1	768584129	KNGUSRYEUQZILE-MRXNPFEDSA-N	433.559	1.641	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccnn1-c1cccc(F)c1	770773885	MGFZGLVSGMCXIK-LBPRGKRZSA-N	429.383	1.704	50	20	IDGD	
CCCC[C@@H](NC(=O)NCC)C(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	771271132	YZDYJHBFSTYOLC-OAHLLOKOSA-N	442.561	1.594	50	20	IDGD	
C[C@@]1(c2ccc(F)c(Cl)c2)NC(=O)N(CC(=O)NNc2ncccc2[N+](=O)[O-])C1=O	771738808	NYGAYYNDRTVRJV-KRWDZBQOSA-N	436.787	1.693	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)[C@@H]1CC(=O)N(c2ccc(Br)c(C)c2)C1	771995288	QWLHFKSLZJWKHP-NWDGAFQWSA-N	440.294	1.600	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)c1cccc(I)c1O	772315594	KQDDKPPVJJCJKR-SECBINFHSA-N	434.230	1.736	50	20	IDGD	
COC(=O)N1CCC[C@H]([C@H](C)NC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)C1	773567217	MALPBVWOGWKNCO-STQMWFEESA-N	441.510	1.293	50	20	IDGD	
CCN1CCN(c2cccc(NC(=O)C(=O)NNC(=O)c3ccc(C)c(F)c3)c2)CC1	773886536	YOEHPWXWFFNAJG-UHFFFAOYSA-N	427.480	1.676	50	20	IDGD	
Cc1sc2ncc(C(=O)OCC(=O)NNC(=O)c3ccc(Cl)cc3)c(=O)n2c1C	775954924	RFOIAPORSCWVBG-UHFFFAOYSA-N	434.861	1.644	50	20	IDGD	
COc1ccc(Cn2cc(C(=O)NNC(=O)COc3ccccc3F)cn2)cc1OC	778290479	QCHWWVGGOSIZJB-UHFFFAOYSA-N	428.420	1.928	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)c2ccc(C(=O)c3cccc(O)c3)cc2)c2ccccc2c1=O	780171693	OVVKHMYATAZASB-UHFFFAOYSA-N	442.431	1.945	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@]2(C[C@H]2C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)C1	780173016	BHWYOMCFFXHKCB-MGPUTAFESA-N	427.465	1.070	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)C(=O)Nc1cccc2ccccc12	782898025	WQCYMSPGXQFTMB-UHFFFAOYSA-N	425.470	1.533	50	20	IDGD	
Cc1ccc(NNC(=O)C(=O)Nc2cccc(S(=O)(=O)/N=C3/CCCN3C)c2)cc1	783342894	CQQMQGHRVYURIB-MOHJPFBDSA-N	429.502	1.890	50	20	IDGD	
O=C(NNC(=O)C(=O)N1CCCC1)C(=O)Nc1cccc(Oc2ccnc3ccccc23)c1	784000163	XDGZWIYIIOOVFD-UHFFFAOYSA-N	447.451	1.735	50	20	IDGD	
COc1cc(C(=O)N(C)C)ccc1NC(=O)C(=O)NNc1ccnc(Br)c1	784828942	RVUWSCHZXFOZAR-UHFFFAOYSA-N	436.266	1.636	50	20	IDGD	
CNC(=O)c1cccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)c1	784834999	GAWWBKVVFBWHIH-UHFFFAOYSA-N	426.401	1.124	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc4c(c3)N(C)CCO4)n[nH]2)c1	785129053	OOWYMIFRMARSGU-UHFFFAOYSA-N	448.483	1.922	50	20	IDGD	
CN(C)C(=O)COc1cccc(NC(=O)C(=O)NNc2nc(C(F)(F)F)cs2)c1	785146590	WWNFQNISBLSIAI-UHFFFAOYSA-N	431.396	1.711	50	20	IDGD	
CCc1c(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)nnn1Cc1ccc(F)cc1	786682084	ZKJQEPNYPBQWNC-UHFFFAOYSA-N	435.423	1.078	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@H](C(=O)NNc3ccc(-n4ccnc4)nn3)C2)s1	788177088	IBWGNISHOLWSBN-AWEZNQCLSA-N	447.546	1.576	50	20	IDGD	
CCCOC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)cc1	789809908	GERMKQCECHERBB-OALUTQOASA-N	439.468	1.912	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)Cn1c(S)nnc1-c1ccc(Cl)cc1	790064144	UPKFLXMVMMGDES-UHFFFAOYSA-N	427.914	1.824	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cc(OC)c(C)c([N+](=O)[O-])c2)cc1OC	791689071	NYTGLCRNZPKOTH-UHFFFAOYSA-N	447.400	1.547	50	20	IDGD	
Cc1ccn(-c2ccc(NC(=O)C(=O)NNC(=O)c3cc(Br)cn3C)cc2)n1	793022264	SIJXYPCPQMDIBO-UHFFFAOYSA-N	445.277	1.681	50	20	IDGD	
CCOC(=O)c1cc(Cl)cc(S(=O)(=O)NNC(=O)c2ccc3c(c2)OCCO3)c1	793353887	SFLDLWRGCTYERM-UHFFFAOYSA-N	440.861	1.911	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@H](C)CNC(=O)OC(C)(C)C	794780503	LMNOCFKZVOADSW-LLVKDONJSA-N	427.527	1.210	50	20	IDGD	
CC(C)O[C@@H](C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1)c1ccccc1	796416344	JHRSZKDSCIYGBN-UYAOXDASSA-N	428.441	1.683	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CN2CCC[C@H]2COC(=O)NC2CCCCC2)c1	796681458	FOWCFAYEYBUHPF-IBGZPJMESA-N	427.505	1.843	50	20	IDGD	
COC(=O)Cn1ncc(NC(=O)C(=O)NNC(=O)c2c(Cl)cccc2Cl)c1C	797003486	BCPCBDWYMNXIFO-UHFFFAOYSA-N	428.232	1.071	50	20	IDGD	
Cc1ccc(S(C)(=O)=O)cc1NC(=O)NNC(=O)CNC(=O)OCc1ccccc1	797610474	BPOVMJUBNJUULK-UHFFFAOYSA-N	434.474	1.478	50	20	IDGD	
CC(C)Oc1ccc(NC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc1C(N)=O	797677493	QTZOFFQLUGUKAE-UHFFFAOYSA-N	438.444	1.931	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@@H]2C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)cc1	798966180	KINPTGPSJKLGRC-MRXNPFEDSA-N	449.508	1.155	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(F)c(C(=O)OC)c(F)c1	802566116	AAPJEQDXILTLQI-UHFFFAOYSA-N	435.383	1.479	50	20	IDGD	
CCN(C)C(=O)c1cccc(NC(=O)NNC(=O)c2nn(CC)c(=O)c3ccccc23)c1	806776084	OAUDBMLJIONKTE-UHFFFAOYSA-N	436.472	1.975	50	20	IDGD	
Cc1cc(CNC(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)n(C)n1	807224642	SWJSKWGGHPTWCT-UHFFFAOYSA-N	448.530	1.735	50	20	IDGD	
O=C(NNc1ccc2c(=O)[nH]ccc2c1)c1cccc(S(=O)(=O)NC[C@H]2CCCO2)c1	807505197	IHEXNWIODHUVII-QGZVFWFLSA-N	442.497	1.742	50	20	IDGD	
C[C@@H]1C(=O)Nc2cc(C(=O)NNC(=O)[C@H]3CCCN(C(=O)OC(C)(C)C)C3)ccc2N1C	808011260	RNRNBWMWJQPNAW-HIFRSBDPSA-N	445.520	1.872	50	20	IDGD	
COC[C@@]1(CNC(=O)NNC(=O)c2cc(Br)c[nH]2)OCCc2ccccc21	811851995	ANQZNOARJBKURH-GOSISDBHSA-N	437.294	1.836	50	20	IDGD	
CN(C)c1noc(CNC(=O)NNC(=O)c2ccccc2OCc2ccc(F)cc2)n1	812220795	WHZDHAPHCCPHKA-UHFFFAOYSA-N	428.424	1.998	50	20	IDGD	
Cn1ncc(I)c1C(=O)NNC(=O)CSc1ccccc1O	814122152	NCMWEVPIERTMHS-UHFFFAOYSA-N	432.243	1.284	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)C(C)(C)c1ccccc1[N+](=O)[O-]	814226046	ZSSQAUOKXLRNGB-UHFFFAOYSA-N	433.490	1.935	50	20	IDGD	
CC(=NNC(=O)Nc1ccc(S(N)(=O)=O)cc1)c1ccc(N2CCOCC2)c(F)c1	814967968	ILDUZXXSCGLUHZ-UHFFFAOYSA-N	435.481	1.855	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNC(=O)C(=O)Nc1ccc([C@H]2CCOC2)cc1	815630592	OUQBONLZDUPTIQ-KRWDZBQOSA-N	440.456	1.203	50	20	IDGD	
C[C@@H]1CN(S(=O)(=O)c2cc(C(=O)NNc3cnnn3C)ccc2Cl)C[C@@H](C)O1	816771761	ZTTVOHSWIHLWDR-GHMZBOCLSA-N	428.902	1.023	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)c(C)c2)cc1C	879427567	GNKOHTRCHKPCEY-UHFFFAOYSA-N	446.529	1.327	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)CNS(=O)(=O)c2c(F)cccc2F)cc1	913031426	IXMDOBNTKZDOIC-UHFFFAOYSA-N	429.470	1.491	50	20	IDGD	
O=C(CCCc1nc(-c2ccc(Cl)cc2)no1)NNC(=O)[C@H]1CCS(=O)(=O)C1	915141083	BNEGRAISEFOWQX-LBPRGKRZSA-N	426.882	1.295	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCCN1S(=O)(=O)c1cccs1)c1cccc([N+](=O)[O-])c1	915800443	TYIXOEGPNQDUTM-CQSZACIVSA-N	438.487	1.661	50	20	IDGD	
COc1ccc(C[C@@H](NC(=O)NNC(=O)C(=O)NC2CC2)c2ccc(OC)cc2)cc1	915923408	PXDQUYBZPGWJCO-LJQANCHMSA-N	426.473	1.597	50	20	IDGD	
CC(=NNC(=O)c1cccc([N+](=O)[O-])c1)c1ccc(S(=O)(=O)NCCCC(=O)O)cc1	916245731	VKHMIHCGBAMKRY-UHFFFAOYSA-N	448.457	1.892	50	20	IDGD	
CC(=NNC(=O)Cn1c(C)nc2ccccc21)c1ccc(S(=O)(=O)NCC(=O)O)cc1	916275833	VRBLMIRRJPNIBH-UHFFFAOYSA-N	443.485	1.248	50	20	IDGD	
CCC(=O)Nc1cccc(CNC(=O)NNC(=O)c2nn(CC)c(=O)c3ccccc23)c1	916381726	QHDMKFPKXQXUCQ-UHFFFAOYSA-N	436.472	1.909	50	20	IDGD	
O=C(NCCCN1CCN(c2ccccc2)CC1)NNC(=O)c1ccc2c(c1)OCCO2	916484676	FMPCBFLDZAXJLX-UHFFFAOYSA-N	439.516	1.614	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)c1ccc(NC(=O)C2CC2)cc1	916497650	QKBOHRQEAPEKIR-ZDUSSCGKSA-N	448.483	1.987	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCCCCN1CCC[C@H](C)C1	916503883	JISNWFGRMYKKSQ-HNNXBMFYSA-N	438.598	1.744	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCc2ccc(-n3ccnc3C)nc2)cc(OC)c1OC	918001662	SMVYXAPSSAJSEK-UHFFFAOYSA-N	440.460	1.746	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2ccc(-c3ccccn3)nc2O)c2ccccc2c1=O	920276288	UATCOHKMXIZFGZ-UHFFFAOYSA-N	430.424	1.654	50	20	IDGD	
O=C(NCc1cccc(C(=O)N2CCOCC2)c1)NNC(=O)c1ccc([N+](=O)[O-])cc1	920811420	HXEBZNNJNVBWTI-UHFFFAOYSA-N	427.417	1.211	50	20	IDGD	
COc1ccc([C@]2(C)NC(=O)N(CC(=O)NNC(=O)NCCc3cccs3)C2=O)cc1	920860261	PFUKKNLMWOFYEH-FQEVSTJZSA-N	445.501	1.097	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)NC[C@H](c2cccc(F)c2)N2CCOCC2)c1	921201435	NTFUGDBFWDSKAL-HXUWFJFHSA-N	430.480	1.917	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)NCCn2c(O)nc3ccccc32)CC1	1116227654	PBGXEKCWEGTUDB-UHFFFAOYSA-N	446.508	1.719	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cccn3c(O)nnc23)C1	1777955313	BWGXVRNLPRHKGX-QVKFZJNVSA-N	449.939	1.827	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc4cccn4cn3)C2)C1	1778042870	KJXORRLQNQYYSN-KUHUBIRLSA-N	435.322	1.809	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C1(C)CC1)C2	1778091571	VRAXMYJDBBXKFJ-JBQOLUAXSA-N	429.521	1.434	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cn4cccnc4n3)C2)C1	1778480789	RGQQMWBSKTZUFX-UGSOOPFHSA-N	436.310	1.346	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(Cl)c4nncn4c3)C2)C1	1778947004	SHPIDRHANMEAGD-ACJLOTCBSA-N	426.304	1.844	50	20	IDGD	
COC(=O)[C@H]1CC[C@H](C(=O)N2CCO[C@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)CC1	1779294611	VDWHTSHLRGEBGN-FIKGOQFSSA-N	440.613	1.647	50	20	IDGD	
COc1cc(OC)cc(C(=O)N2CCO[C@@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)c1	1779299919	HBYDCZXKNADRNW-OAQYLSRUSA-N	436.581	1.999	50	20	IDGD	
Cc1cc(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](F)Br)C2)no1	1780777510	UWNBADCMALNDBX-FRFSOERESA-N	432.290	1.730	50	20	IDGD	
CCOc1cccc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)c1O	1781334063	UULAZENRRZNUPW-QAPCUYQASA-N	445.285	1.925	50	20	IDGD	
O=C(c1cnn2cccc(F)c12)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781335057	VEWZAWKFHBIFIA-WMLDXEAASA-N	443.248	1.607	50	20	IDGD	
Cc1ncc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](C)Br)C2)cn1	1781996317	GEVCDGNUJRLKKW-CDHAZOANSA-N	425.327	1.696	50	20	IDGD	
O=C(O)CSCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Br)C2	1782224041	YKAVMDOZRBKSJV-WDBKCZKBSA-N	441.319	1.009	50	20	IDGD	
COc1ccc(Cl)cc1CC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1782976547	RMXKDUVITWDQHP-DNVCBOLYSA-N	431.316	1.321	50	20	IDGD	
CCC[C@H](NC(C)=O)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](Br)CC)C2)C1	1783351817	BHYZNOIAIVQWIG-RVKKMQEKSA-N	432.359	1.295	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3c(F)ccc(O)c3F)CCO2)C1	1783535236	AYKXGVPHXBAYNQ-DYZYQPBXSA-N	433.249	1.897	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)C1(c3cccc(F)c3)CC1)CCO2	1783933820	ZLIUTEWFYVNTGD-QFIPXVFZSA-N	446.523	1.060	50	20	IDGD	
CC[S@](=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]2C1	1783966295	DMAVUYXXCGIYKM-DHFVLPRBSA-N	437.400	1.156	50	20	IDGD	
COc1ccc(F)cc1CC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2	1784087851	ROVPZCOKDUMHLI-BFUOFWGJSA-N	443.313	1.990	50	20	IDGD	
C[C@@H](NC(=O)c1ccc(F)cc1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]2C1	1787449175	NNNZSDKPOYPMBC-DIMBHLCBSA-N	443.878	1.458	50	20	IDGD	
O=C(CCN1CCCCC1)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1	1788140603	AMGQUCRSZFGOAA-UHFFFAOYSA-N	449.360	1.990	50	20	IDGD	
Cc1cc(C(=O)NC2(c3ccc(NC(=O)c4cccc(B(O)O)c4)cc3)CCC2)nn1C	1788145980	NLIKUGFYOCHHJT-UHFFFAOYSA-N	432.289	1.470	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(Cl)nn3)[C@H]2C1	1788836627	IQAKMSRSKBBCRZ-YDHLFZDLSA-N	426.977	1.575	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Cl)C[C@@H]21)c1ccc([N+](=O)[O-])c2c1OCO2	1789288167	JPHMHLURQXXQDT-DFGBYOQWSA-N	443.815	1.451	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3n[nH]c4cccc(F)c34)[C@H]2C1	1790485024	WXLUEMCPCZHOJE-QCQGSNGOSA-N	438.887	1.549	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(OC)cn3)C[C@@H]21	1790961767	QDPNDHQJNZFQLU-FAYQHZLMSA-N	440.338	1.857	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3C[C@@H]3c3ccccc3)[C@H]2C1	1791211073	VAMBNHVLSJRNFF-SSTJLMRISA-N	442.560	1.143	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)Oc3ccccn3)C[C@@H]21	1791256589	QYMBUUOZAJFHDE-WOYTXXSLSA-N	425.913	1.082	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ncn(-c2cccc(F)c2)n1	1794587447	GQLOGEHWUAAVJM-XLNGHYISSA-N	435.887	1.912	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCC(F)(F)F	1795399432	XHYIWBARJHZLGG-OQLCOEBBSA-N	443.426	1.053	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)[C@H]1C[C@H]1c1ccc(F)cc1	1796187922	LVACUJWDKSFNBC-WIYBCGNWSA-N	436.292	1.561	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)c1ccnn1-c1ccccc1	1796189130	ZKXFKHBCKUKEMN-NUZGMZIFSA-N	444.300	1.118	50	20	IDGD	
CC1=CC[C@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C3)CC1	1797128467	MJRNPOPCQKMHFZ-WLYJJTDJSA-N	441.532	1.456	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2[nH]ccc2n1	1797394027	ZJUOQYKMWCWXCJ-JRATXPSKSA-N	435.322	1.797	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2)[C@H]1ON=C(c2ccccc2)O1	1797642515	BMDIKWOCRDQPDH-SJBDTSRBSA-N	428.272	1.114	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(-c3ccncc3)[nH]n1)C2	1797956941	PZUBHZPQUNGNKU-CWPLJXCYSA-N	443.580	1.526	50	20	IDGD	
N#Cc1cc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCBr)C3)ccc1F	1799324759	VQAGBDJKBDSLHV-CCWDJLKJSA-N	438.297	1.614	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COc1ccc(O)cc1)C2)[C@@H](F)Br	1799343514	ZGPDHHSIZSDLQZ-OXUXUCFPSA-N	431.258	1.051	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1noc3c1CCCC3)C2)[C@H](F)Br	1799346128	CZZFLPWMRRKNLN-FJHTZYQYSA-N	430.274	1.447	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnccc1C(=O)NN)C2	1800080872	RUBSOMDFVXGHHB-QPSSLKIMSA-N	428.320	1.173	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)NNc1ccccc1)C2	1800754881	YJMYKSUQPVPPAW-JGFGOLAASA-N	439.354	1.365	50	20	IDGD	
COc1nccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)Br)c1F	1800756192	GYKOMEUYOKDLKW-NJBDSQKTSA-N	430.274	1.216	50	20	IDGD	
COc1cc(C)cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)Br)c1	1800759708	DBJQCYCWUSPRAJ-FAYQHZLMSA-N	425.323	1.990	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CC(c3ccccc3)=NN1)C2	1800762732	ZMPUSSRDPAGJMC-QMQAMEMWSA-N	449.349	1.126	50	20	IDGD	
CC[C@@H](NC(C)=O)C(=O)NC[C@@H]1CCN(C(=O)[C@H](C)Br)[C@@H]1c1cccnc1	1802884886	UNELEOQSWABRPI-KKBVYLPWSA-N	439.354	1.786	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc3nccnc3c2)[C@@H]1c1cccnc1)[C@H](O)CCl	1803142914	MSLKSCXBGBKPMB-PWIZWCRZSA-N	439.903	1.944	50	20	IDGD	
CC[C@H](C)CC(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1	1803365052	JORLCCWYWOGEAB-LUQKVYGDSA-N	438.532	1.836	50	20	IDGD	
C[C@H](Cn1cncn1)C(=O)N1CC[C@H](CNC(=O)CCBr)[C@H]1c1cccnc1	1806342791	LIITYMLUVIVSDD-QGPMSJSTSA-N	449.353	1.800	50	20	IDGD	
N=C(N)SCC(=O)NC[C@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1	1807003728	DJGPDASZEMMDGG-DOMZBBRYSA-N	428.356	1.499	50	20	IDGD	
C=CCC(CC=C)C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1807359318	HQHVXSLZTMHETD-JTHBVZDNSA-N	447.344	1.849	50	20	IDGD	
Cc1ccnc(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)c1	1807362591	MFXXBXYWEZXJLB-SIKLNZKXSA-N	444.300	1.098	50	20	IDGD	
Cc1cscc1C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1807373854	CSQAYVJYEMFZCI-RXVVDRJESA-N	449.341	1.765	50	20	IDGD	
CCC1(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)CCC1	1807374709	HVOLBDCHSFFUKH-PZJWPPBQSA-N	435.333	1.661	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)ccn1	1807374792	JJTHAWZNEKOWLD-IFMALSPDSA-N	444.300	1.098	50	20	IDGD	
Cc1c[nH]cc1C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1807375528	PVRYLPUYXRCQHX-RXVVDRJESA-N	432.289	1.031	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cc(O)ncn2)[C@@H]1c1cccnc1)[C@H](F)Br	1808648875	DROJTHCJUQAUSN-GLQYFDAESA-N	438.257	1.587	50	20	IDGD	
O=C(Cn1nccn1)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@H]1c1cccnc1	1808959300	BYDXXMSYUKRSEZ-AEGPPILISA-N	425.262	1.070	50	20	IDGD	
Cc1nc(C(=O)N2CC[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)co1	1810298437	IMAUQPOHUPQFQQ-KXBFYZLASA-N	449.471	1.010	50	20	IDGD	
Cc1oncc1C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1	1810299576	SMXTVCFYQACSGA-KXBFYZLASA-N	449.471	1.010	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC2(CCCN(C(=O)c3[nH]nnc3C)C2)CC1	1810318170	PNEGCJNDDMZJLO-HZHRSRAPSA-N	440.508	1.092	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1CCN(C(=O)/C=C\C(=O)NC2CC2)[C@H]1c1cccnc1	1810546336	TYSWENNFJWVOPF-IHANMSTJSA-N	444.608	1.774	50	20	IDGD	
Cc1ncoc1C(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1813070417	IVFBSJNMTIKVCL-LPHOPBHVSA-N	428.493	1.071	50	20	IDGD	
O=C(Cc1ccccc1)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2	1813805543	YPMCDWGZDRHTMK-KRWDZBQOSA-N	435.314	1.291	50	20	IDGD	
O=C(CN1CCOCC1)Nc1nc2c(s1)C[C@@H](NC(=O)CCBr)CC2	1814561614	QLJIRYQHJSOBKT-NSHDSACASA-N	431.356	1.172	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1cc(C2CC2)on1	1814625381	ZXNPUAUNOQTVCQ-GOSISDBHSA-N	449.276	1.575	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H]2C[C@H]2C2CC2)n[nH]1	1814759187	JISIZAMHORACBT-RLFYNMQTSA-N	437.504	1.760	50	20	IDGD	
CCC[C@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN(CCO)CCO)[nH]n1	1815323075	YSALMPHUNDAILI-HOCLYGCPSA-N	429.949	1.096	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)COc2cccnc2)n[nH]1	1815763811	NUOKMIVNVSEFMA-QGZVFWFLSA-N	443.508	1.249	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccccc2O)n[nH]1	1816266751	GZLLZXMLAKARKJ-MRXNPFEDSA-N	428.493	1.794	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](C)S)CC2	1817282306	BRWNZJOOXWNISG-MDCUWKKUSA-N	434.547	1.507	50	20	IDGD	
COC1(CC(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)CCC1	1817474670	FROUXRIKOXBGCK-GOSISDBHSA-N	440.309	1.355	50	20	IDGD	
N[C@@H](Cc1cscn1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1	1817976137	MDCDTGSGRRMAGU-UBHSHLNASA-N	426.930	1.028	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)CCc3nc(N)n[nH]3)sc2C1	1819552162	QOWAOISNZUJYDJ-UWVGGRQHSA-N	425.946	1.796	50	20	IDGD	
CN1CCN(CC(=O)N2CCCC[C@H]2c2cc(NC(=O)[C@H](F)Br)n[nH]2)CC1	1820933818	NYGCKGNEVSOCEL-BBRMVZONSA-N	445.337	1.340	50	20	IDGD	
CC(C)=NO[C@H](C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1820968899	HXIBTQXSGDPUSD-KDOFPFPSSA-N	441.297	1.196	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H]2CCCS2(=O)=O)n[nH]1	1821834145	IBRZULGEORQOLU-HUUCEWRRSA-N	442.614	1.831	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](C)Br)n[nH]1	1822189034	NAOANJWWIHQRND-LOWVWBTDSA-N	443.346	1.893	50	20	IDGD	
Cc1cnn([C@H](C)C(=O)N[C@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)c1	1826092065	KKDYJRZNQUEEEL-KGLIPLIRSA-N	447.565	1.194	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CCN2CCOCC2)CC1	1826749089	FWHPXEFRTDNUBA-MOPGFXCFSA-N	429.989	1.582	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H]3CCOC3)sc2C1	1827168674	DTNZWRUOYBFDIU-ZXWLHBBBSA-N	444.517	1.226	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H]3CCCSC3)sc2C1	1828160808	NJMBRZQYQZUHJJ-CHWSQXEVSA-N	439.607	1.571	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)[C@@H]3CCCSC3)sc2C1	1828160809	NJMBRZQYQZUHJJ-OLZOCXBDSA-N	439.607	1.571	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc3n(n2)CCNC3=O)CC1	1830305471	QRTWBGHFDAFBNC-WBVHZDCISA-N	435.956	1.877	50	20	IDGD	
O=C(c1cnc(O)nc1O)N1CCC([C@H]2CCCCN2C(=O)[C@H](F)Br)CC1	1830378403	MDXJRNIVWMIOLD-OLZOCXBDSA-N	445.289	1.812	50	20	IDGD	
Cc1ccc2nc(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)[C@@H](O)CCl)CCO4)ccc2c1	1830727832	HQMDHOZZCJRCEC-SIKLNZKXSA-N	447.919	1.213	50	20	IDGD	
COc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)cc1Cl	1830738751	UQEWXEANNPAZLD-BEFAXECRSA-N	447.315	1.018	50	20	IDGD	
Cc1c[nH]c(C)c1CCC(=O)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1830904058	PGQQUISNYAPHNH-IBGZPJMESA-N	432.348	1.824	50	20	IDGD	
CNc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)cc1	1835608232	UNVTVHFZZVXVBX-QAPCUYQASA-N	444.301	1.489	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(CC(C)C)nn3C)CCO2)C1	1836338214	PSNMIWRFKHULFZ-UWJYYQICSA-N	440.972	1.706	50	20	IDGD	
C[C@H](Nc1ccccn1)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1837747209	JOXLJQWRZWHEIY-UGSOOPFHSA-N	431.320	1.142	50	20	IDGD	
O=C(c1cc2n(n1)CCCO2)N1CCC(OC2CCN(C(=O)[C@H](F)Cl)CC2)CC1	1838082873	RIKDZYHNZVTYSN-KRWDZBQOSA-N	428.892	1.812	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)N1CCC(OC2CCN(C(=O)CO[Si](C)(C)C)CC2)CC1	1838429213	JGGXRTZDYNZSJG-MRXNPFEDSA-N	439.629	1.527	50	20	IDGD	
CCOc1ccccc1C(=O)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1838886099	FEMYLJGATMISAN-LJQANCHMSA-N	431.316	1.959	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)cc1	1838984319	QGGDERKFCCCELL-MAUKXSAKSA-N	429.286	1.756	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(O)cc3)C2)C1	1839154275	IVQPSUFFSWEPEW-OALUTQOASA-N	431.316	1.699	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ncccc3C)C2)C1	1839962319	AMYCOAWMDDZSGI-HNAYVOBHSA-N	440.338	1.634	50	20	IDGD	
Cc1ncccc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2	1840031242	JOUHYNJTBHLLRI-FZKQIMNGSA-N	426.311	1.243	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3C[C@@]3(F)Cl)C2)C1	1840036000	BYYYTGGBZMHHRX-DRABBMOASA-N	427.698	1.151	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3csc(C)c3C)C2)C1	1840150704	PLCWAUAHWXDDKB-APWZRJJASA-N	430.954	1.689	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCn3nc(C)cc3C)CCO2)C1	1840347822	ZDJWIAQLUHEFPM-FXAWDEMLSA-N	426.945	1.364	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)c1ccccn1)CCO2	1840504054	FBAGJCPKBKNSMF-DOXZYTNZSA-N	440.338	1.425	50	20	IDGD	
Cc1cc(Cl)cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)c1	1840696469	SFCILCGDUKWDGF-LPHOPBHVSA-N	431.316	1.318	50	20	IDGD	
CCOc1c(C(=O)N2CCCC23CN(C(=O)[C@@H](Cl)COC)C3)cnc2c1cnn2C	1843214840	HVCTYKIGZVMLNM-HNNXBMFYSA-N	435.912	1.438	50	20	IDGD	
O=C(c1nccn(Cc2ccc(F)cc2)c1=O)N1CC2(CCCN2C(=O)[C@H](F)Cl)C1	1843363239	VXQQHYMNYBSAHD-INIZCTEOSA-N	436.846	1.782	50	20	IDGD	
CC(C)CNC(=O)C(=O)N1CCCC12CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)C2	1843433613	DJATXUVSPZOYOI-LZYBPNLTSA-N	430.455	1.847	50	20	IDGD	
Cc1cc(F)cc(CC(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)c1	1844265359	UVAPTUZRDGTOHQ-UHFFFAOYSA-N	425.464	1.192	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@H]1C[C@@H](O)CN1C(=O)OC(C)(C)C)C2	1845167856	YAVDDTRRANHLGI-ILXRZTDVSA-N	429.945	1.578	50	20	IDGD	
C=CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)[C@H](Cl)COC)C1	1846360550	SNPPXWAUIDEQSN-HUUCEWRRSA-N	429.945	1.913	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)CCCN1C(=O)c3ccccc3C1=O)C2	1846361009	RTVPUHYRDZADQF-QGZVFWFLSA-N	447.919	1.520	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)n1ccnn1	1848098454	CINDYCOVJFPRSX-QPSCCSFWSA-N	440.932	1.173	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)c2cc(S(=O)(=O)N(C)C)ccc2Cl)c1	17198579	FLPQJLXQIAJVNL-UHFFFAOYSA-N	425.894	1.739	50	20	IDGD	
CN(C(=O)c1cccs1)c1ccccc1C(=O)NNC(=O)CNC(=O)c1ccco1	725740880	JPLPRVIGDJOHJK-UHFFFAOYSA-N	426.454	1.809	50	20	IDGD	
CC(C)(C)NC(=S)NNC(=O)CCCCC/N=C1/NS(=O)(=O)c2ccccc21	726136895	XDMRBTJXNVFVOD-UHFFFAOYSA-N	425.580	1.579	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)[C@H]1CSCN1C(=O)OC(C)(C)C	727114622	YCHJPQZJPFVPPR-CYBMUJFWSA-N	425.507	1.922	50	20	IDGD	
CCOc1ccc(OCC)c(NC(=S)NNC(=O)c2ccc(OCC(N)=O)cc2)c1	727492649	WCHBWEKMVGRMRT-UHFFFAOYSA-N	432.502	1.980	50	20	IDGD	
CC(C)Oc1ccc(NC(=S)NNC(=O)CNC(=O)c2ccc3c(c2)OCO3)cc1	727500638	XHYGNJSOPUDFLY-UHFFFAOYSA-N	430.486	1.950	50	20	IDGD	
CC(C)c1noc2nc(-c3ccco3)cc(C(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)c12	727707852	NHMAZKCTGBFQDW-NSHDSACASA-N	432.458	1.802	50	20	IDGD	
CC(=NNC(=O)[C@H](C)NS(C)(=O)=O)c1ccc(OCC(=O)Nc2ccccc2C)cc1	728436444	GGDHVVMWWBOAGE-INIZCTEOSA-N	446.529	1.790	50	20	IDGD	
CC(C)[C@H](C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)S(=O)(=O)C1CCCCC1	728463872	KCBVNKWMJMJWJV-QGZVFWFLSA-N	444.575	1.623	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNc3ccc(F)c(F)c3F)CC2)cc1	728715725	XUIKQXBYDPXYFZ-UHFFFAOYSA-N	442.463	1.862	50	20	IDGD	
Cn1nc(SCC(=O)NN=C2CCc3c2ccc(Cl)c3Cl)c(=O)n(C)c1=O	729143142	JANZMHMGPOESMR-UHFFFAOYSA-N	428.301	1.345	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2ccc(NNC(=O)c3cc[nH]n3)c([N+](=O)[O-])c2)cc1	729294572	LGORDUDFZNRXCZ-UHFFFAOYSA-N	432.418	1.884	50	20	IDGD	
O=C(NCc1ccc(CN2CCC(O)CC2)cc1)NNC(=O)c1ccc2c(c1)OCCO2	729621340	HHEQFWPQDCRMBH-UHFFFAOYSA-N	440.500	1.559	50	20	IDGD	
O=C(CC12CC3CC(CC(C3)C1)C2)NNC(=O)NCCS(=O)(=O)N1CCSCC1	730582444	AVIUVPRRHBDSAT-UHFFFAOYSA-N	444.623	1.302	50	20	IDGD	
Cn1ccnc1[C@](O)(CCNC(=O)NNC(=O)C(C)(C)c1ccccc1)C(F)(F)F	731221110	BYBLYDZIIDEMDY-GOSISDBHSA-N	427.427	1.868	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)[C@@H](NS(=O)(=O)c1ccc2ccccc2c1)C(C)C	732083301	ZKBNAZVIEIUWOY-SFHVURJKSA-N	429.502	1.635	50	20	IDGD	
C[C@@H]1C[C@H]1C(=O)Nc1ccc(C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1	732328498	ZTHGMJBJIWCGID-SJKOYZFVSA-N	440.412	1.807	50	20	IDGD	
CC(C)NS(=O)(=O)c1cc(C(=O)NNc2nc3ccccc3c(=O)n2C)ccc1F	733261131	YOELUFJJRCMVDI-UHFFFAOYSA-N	433.465	1.516	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)N[C@@H]2CCN(C(C)C)C2=O)c2ccccc2c1=O	734218031	HFKKPOBTUTYJOQ-QGZVFWFLSA-N	442.520	1.540	50	20	IDGD	
COc1ccc(CN2CC[C@@H](NC(=O)NNC(=O)c3cccc4ncccc34)C2=O)cc1	734543754	OZGCCWCWMKEERL-HXUWFJFHSA-N	433.468	1.989	50	20	IDGD	
O=C(CSc1nnnn1-c1ccc2c(c1)OCCO2)NNC(=O)c1ccc(Cl)cc1	734980755	JGHCSTJHVIAFAK-UHFFFAOYSA-N	446.876	1.640	50	20	IDGD	
O=C(CCOc1ccc(Cl)cc1[N+](=O)[O-])NNC(=O)C1CCN(c2ncccn2)CC1	735010145	BIKGVLMGGSDZTM-UHFFFAOYSA-N	448.867	1.871	50	20	IDGD	
Cc1ccc(S(=O)(=O)Nc2ccc(F)cc2)cc1C(=O)NNC(=O)c1cnn(C)c1	735471087	NBBZINQJZWURMO-UHFFFAOYSA-N	431.449	1.743	50	20	IDGD	
COCCN1C(=O)c2ccc(C(=O)NNc3ncccc3C(F)(F)F)cc2S1(=O)=O	740096111	AYCGXBDMKCHILR-UHFFFAOYSA-N	444.391	1.648	50	20	IDGD	
COC(=O)c1cc(Cl)cc(S(=O)(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)c1	741647876	RWXFSYNGFAPIQZ-UHFFFAOYSA-N	439.877	1.692	50	20	IDGD	
O=C(NNS(=O)(=O)c1cnn(-c2ccccc2F)c1)c1cc(Br)c[nH]1	742026264	QHCAQAFASMWLJA-UHFFFAOYSA-N	428.243	1.725	50	20	IDGD	
CC(C)c1nn([C@@H]2CCS(=O)(=O)C2)cc1C(=O)NNC(=O)c1ccc2c(c1)OCO2	742472455	OCBFASOMRPJWSQ-CYBMUJFWSA-N	434.474	1.170	50	20	IDGD	
COc1ccc2c(c1)OCC[C@@H]2NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1	743589208	QQWLDLSTTXMIDY-KRWDZBQOSA-N	426.477	1.556	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)c2ccccc2c1=O	743805056	CPAJCLSIWGYZKB-UHFFFAOYSA-N	443.485	1.847	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)CSc2nnc(-c3ccco3)o2)c1	744547453	DJASRTULJZUYKF-UHFFFAOYSA-N	427.398	1.298	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)CSc2nnc(-c3ccco3)o2)cc1	744547521	GGBYNLXKQLBBRG-UHFFFAOYSA-N	427.398	1.298	50	20	IDGD	
O=C1C[C@H](C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)c2ccc(F)cc2N1	744622283	ZJYDZXAPDWKCDD-HNNXBMFYSA-N	448.476	1.416	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1cc2ccccc2c(O)n1	744622545	YFJOSFQVFFAZCW-UHFFFAOYSA-N	428.470	1.718	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2sc(C)nc2C)c1	745860670	AVHPETIEZLKVKB-UHFFFAOYSA-N	439.563	1.935	50	20	IDGD	
CCS(=O)(=O)c1ccc(F)c(C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)c1	746200634	OGLISZQULHECLG-UHFFFAOYSA-N	441.506	1.817	50	20	IDGD	
C=CCOc1cn(-c2ccccc2)nc1C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	746578359	UQXKHUZPLDRBOD-UHFFFAOYSA-N	430.428	1.488	50	20	IDGD	
CSc1nnc(CCCNC(=O)NNC(=O)Cc2cn3ccccc3n2)n1CC(C)C	746766558	GBZLZGIVCYLJQP-UHFFFAOYSA-N	444.565	1.809	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)c1ccc(S(=O)(=O)NCc2cccs2)cc1	747428084	CJLAOJFVGMXPAA-UHFFFAOYSA-N	430.511	1.625	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)NCC(=O)NNc2cccc([N+](=O)[O-])c2C)cc1	748665578	FHLHAOOQLLGWBX-UHFFFAOYSA-N	436.446	1.502	50	20	IDGD	
O=C(NNS(=O)(=O)c1cnn(C2CCOCC2)c1)c1ccc(F)cc1Br	749756666	YQOZMJHDOCJJDM-UHFFFAOYSA-N	447.286	1.760	50	20	IDGD	
O=C(NCc1cc(Br)ccc1OC(F)F)NNC(=O)C(=O)N1CCCC1	750335324	MYLAIONISHRQCB-UHFFFAOYSA-N	435.225	1.503	50	20	IDGD	
Cc1ncc([N+](=O)[O-])cc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	750542034	RCVQEJGDKWSQPX-UHFFFAOYSA-N	433.446	1.158	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)CN2CCN(C(=O)OCc3ccccc3)CC2)c1O	751063804	RWAOLNTYCNKUJL-UHFFFAOYSA-N	442.472	1.116	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNS(=O)(=O)c1ccccc1OC(F)F	751261843	AQZIVJZDNSNALZ-UHFFFAOYSA-N	448.473	1.513	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)Cc1ccc(Br)c(F)c1	751970924	IWNJFTNQWLRQLY-UHFFFAOYSA-N	433.278	1.986	50	20	IDGD	
CCCn1c(CCC(=O)NNC(=O)c2ccc(C)o2)nc2cc(S(N)(=O)=O)ccc21	752523630	ZZJMWUJLETUXME-UHFFFAOYSA-N	433.490	1.389	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)ccc1F	752586045	QGSPHIQIHGMWMY-UHFFFAOYSA-N	443.840	1.005	50	20	IDGD	
Cn1c(NNC(=O)CSc2ccc(C(N)=O)cc2[N+](=O)[O-])nc2ccccc2c1=O	752907459	KSJAYKMRKWRQEQ-UHFFFAOYSA-N	428.430	1.176	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)c2cccc(I)c2O)cc1	754833306	SLHBQOQEKKHBLF-UHFFFAOYSA-N	437.193	1.708	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)CCc3cccc([N+](=O)[O-])c3)cc2)CC1	755775779	IPCHQKILZNXDMB-UHFFFAOYSA-N	447.517	1.607	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1nnc(C23CC4CC(CC(C4)C2)C3)s1	756019144	CPZMBYCXKORYPR-DPTRXVFKSA-N	442.567	1.096	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)Nc1cccc(N2CCS(=O)(=O)CC2)c1	756208250	WTWUZXWMOCXSAE-UHFFFAOYSA-N	433.446	1.296	50	20	IDGD	
CCN1CCN(C(=O)c2ccc(NC(=O)NNC(=O)Cc3ccccc3F)cc2)CC1	756253098	OOEZUOPOSFAJLP-UHFFFAOYSA-N	427.480	1.999	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)Nc2ccc(CNS(C)(=O)=O)cc2)c1C	756625831	NAUPPRRXZBMRMP-OAHLLOKOSA-N	434.518	1.973	50	20	IDGD	
CCNC(=O)N1CCc2ccc(NC(=O)NNC(=O)[C@H]3COc4ccccc4O3)cc21	756731062	WNAFMVMSHJFIIS-GOSISDBHSA-N	425.445	1.771	50	20	IDGD	
COc1cc(C(=O)N(C)C)ccc1NC(=O)NNC(=O)CCCNC(=O)OC(C)(C)C	756869363	UJLVXGRZYRNHCH-UHFFFAOYSA-N	437.497	1.855	50	20	IDGD	
CNS(=O)(=O)c1cccc(NC(=O)NNC(=O)c2cccc(OC(F)F)c2)c1C	757725983	GKUGPHKHYFGSBZ-UHFFFAOYSA-N	428.417	1.971	50	20	IDGD	
CC1(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)CCCCC1	757742492	PYNUBCDAAJVILA-UHFFFAOYSA-N	438.550	1.622	50	20	IDGD	
Cc1cc(C(=O)N2CCOCC2)ccc1NC(=O)NNC(=O)CCc1ccccc1O	757831032	PMDDUAPHEPUVLQ-UHFFFAOYSA-N	426.473	1.959	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NN=C3CCC4(CC3)NC(=O)NC4=O)n[nH]2)cc1OC	758119901	VRJRMROXOQMRLS-UHFFFAOYSA-N	426.433	1.332	50	20	IDGD	
COc1ccc2c(c1)OC[C@@H](C(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1)C2	758785190	CCBCJOKFHXAECE-INIZCTEOSA-N	448.520	1.882	50	20	IDGD	
CC(C)C[C@H](CCC(=O)NNC(=O)c1ccccn1)C(=O)NNC(=O)c1ccccn1	759108835	IIIALJHIEDQEJB-HNNXBMFYSA-N	426.477	1.141	50	20	IDGD	
Cc1c(C(=O)NNC(=O)Cc2cn3ccccc3n2)cnn1CCO[C@H]1CCCCO1	759252098	VHTPMEWHIRBTLI-FQEVSTJZSA-N	426.477	1.386	50	20	IDGD	
Cn1ccc(CCNC(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)n1	761020796	XDKIXYKHQNQDPD-UHFFFAOYSA-N	448.530	1.469	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)c2ccc(I)c(O)c2)c1	761040571	JEMUIKOOENRWRS-UHFFFAOYSA-N	441.225	1.879	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)[C@H](C(C)C)N3CCCS3(=O)=O)n[nH]2)cc1	763173550	PBTVKMXXEPIVCP-SFHVURJKSA-N	433.534	1.460	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NN=C1C(=O)Nc2cc(N3CCOCC3)ccc21	763378212	CMZDJMRORANSTM-UHFFFAOYSA-N	431.493	1.601	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)cc1Cl	763434630	RMEVESVZWYIOCP-UHFFFAOYSA-N	448.929	1.913	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCc2cnn(CC(F)(F)F)c2)cc(OC)c1OC	763536383	OWUGHKMHJLILKD-UHFFFAOYSA-N	431.371	1.615	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)Nc1ccc(F)cc1OC(F)F	763572503	RVHSDWPLIKKYRV-AWEZNQCLSA-N	425.319	1.353	50	20	IDGD	
CCOC(=O)c1ccn(-c2ccccc2NC(=O)C(=O)NNC(=O)c2ccccc2F)n1	763574456	BJAXOWCZXBSTRC-UHFFFAOYSA-N	439.403	1.588	50	20	IDGD	
COc1ccc(Cn2nccc2NC(=O)C(=O)NNC(=O)c2cc(C)oc2C)c(OC)c1	763582231	GDXXYZUEWNMMJT-UHFFFAOYSA-N	441.444	1.558	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1sc(C)c(C)c1C(=O)OC	763682256	PWRGPNDBRDFRIS-UHFFFAOYSA-N	449.485	1.715	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(N3CCOC[C@H]3C)cc2)cc1	763809748	OSATWJALQSDLRL-MRXNPFEDSA-N	426.473	1.385	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)C(C)C)c(C(=O)N2[C@@H](C)CCC[C@@H]2C)cc1OC	763820110	GFKICBRRLQNQJZ-KBPBESRZSA-N	448.520	1.849	50	20	IDGD	
Cc1ccc(-n2nc(C(=O)NNC(=O)CNC(=O)c3cccnc3)c3c2CCCC3)cc1	763824383	IMJFCDHMPQNREN-UHFFFAOYSA-N	432.484	1.646	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cnn(-c3ncccc3C#N)c2)c1C	763852027	UDWXJFULTGLUNJ-HNNXBMFYSA-N	447.455	1.309	50	20	IDGD	
CSc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1Cl	763917163	QHBRVPIAOKLQCY-UHFFFAOYSA-N	431.865	1.437	50	20	IDGD	
CC(=O)N1CCCc2cc(NC(=O)C(=O)NNC(=O)Cc3ccc(Cl)cc3)ccc21	763932811	SGSOVVVMPBBAEK-UHFFFAOYSA-N	428.876	1.968	50	20	IDGD	
Cn1cc(Br)cc(NC(=O)C(=O)NNC(=O)Cc2ccc(Cl)cc2)c1=O	763933116	XNJJYIOTZMKXTL-UHFFFAOYSA-N	441.669	1.130	50	20	IDGD	
Cc1nc(-c2ccccc2NC(=O)C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)no1	763945331	WPSHYZPLHJJVBD-UHFFFAOYSA-N	447.411	1.336	50	20	IDGD	
C[C@@H]1Oc2ccc(NC(=O)C(=O)NNC(=O)c3cccc(C(F)(F)F)c3)cc2NC1=O	764039903	CHNQIHMEAMCVPJ-VIFPVBQESA-N	436.346	1.825	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc(N2CCCC2=O)c(OC)c1	764047704	KUHNHDMIKNHLJB-UHFFFAOYSA-N	426.429	1.230	50	20	IDGD	
CSc1nnnn1-c1cccc(NC(=O)C(=O)NNC(=O)c2cccc3ccccc23)c1	764052779	XBDISLVGPMGEGK-UHFFFAOYSA-N	447.480	1.937	50	20	IDGD	
CCN(CC)C(=O)COc1ccc(NC(=O)C(=O)NNC(=O)C2CCCC2)cc1Cl	764067098	XPXWJQILDYCAIQ-UHFFFAOYSA-N	438.912	1.863	50	20	IDGD	
COc1ccc2cc(NC(=O)C(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)ccc2n1	764078566	WQPRVTVNOGRQRA-UHFFFAOYSA-N	442.453	1.047	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)c(Br)c1	764164426	PEXOCNUESHJKPK-OAHLLOKOSA-N	434.246	1.547	50	20	IDGD	
O=C(CCc1ccco1)NNC(=O)C(=O)Nc1cc(Br)ccc1-n1cccn1	764177272	MKOICSGYTAXXIJ-UHFFFAOYSA-N	446.261	1.947	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(S(=O)(=O)C3CCCC3)cc2)cc1	764177540	QPAOQMYPYMDEFV-UHFFFAOYSA-N	440.481	1.674	50	20	IDGD	
N#Cc1cccnc1Oc1ccccc1NC(=O)C(=O)NNC(=O)COc1ccccc1O	764280349	MVYNNUSUHPHGDZ-UHFFFAOYSA-N	447.407	1.616	50	20	IDGD	
COc1ccc(NC(=O)c2cccc(NC(=O)C(=O)NNC(=O)Cc3ccncc3)c2)cn1	764353885	LHPLAXBFZOUHEJ-UHFFFAOYSA-N	448.439	1.066	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)C(=O)Nc2ccnn2Cc2ccc(C(F)(F)F)cc2)cn1	764358461	FGYLFDZKWPNZGP-UHFFFAOYSA-N	435.366	1.083	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)C(=O)Nc1ccc(OC[C@H]2CCCO2)cc1	764363238	MEEACGXMIZKZBT-LJQANCHMSA-N	427.457	1.547	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3OC)[nH]n2)c(OC)c1	764376847	JQIDFLYBFKYLHX-UHFFFAOYSA-N	439.428	1.502	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2cccc(OCCF)c2)n[nH]1	764378236	WPOWESKRIPNWEQ-UHFFFAOYSA-N	441.419	1.833	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)ccc1NC(C)=O	764394215	PUXYMCQSAHLLHS-UHFFFAOYSA-N	432.458	1.237	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)[C@@H](C)S(=O)(=O)C2CCOCC2)c1	765406334	VCIANFYPTAPVQY-SNVBAGLBSA-N	449.323	1.201	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)CCN3C(=O)NC4(CCCC4)C3=O)n[nH]2)c1	765574867	BAJHXRVOGPDHQQ-UHFFFAOYSA-N	438.488	1.709	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)[C@H]3CC(=O)N(c4ccccc4)C3)n[nH]2)cc1OC	765598573	LNBQIKRNWBMGML-HNNXBMFYSA-N	449.467	1.908	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)c2cn(-c3cccc([N+](=O)[O-])c3)nn2)n[nH]1	765598710	CZGAGJDVRYOMRU-UHFFFAOYSA-N	448.399	1.649	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)CCn2cnc3ccccc3c2=O)n[nH]1	765600919	PWNZKCMWIAQQFI-UHFFFAOYSA-N	432.440	1.647	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1cc(-c2ccccc2)[nH]n1	765734221	XFMLVGAOAZJUQG-UHFFFAOYSA-N	432.484	1.296	50	20	IDGD	
C[C@H](Cc1ccc(F)cc1)C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765736739	ABLUOUYAVXVRFJ-QGZVFWFLSA-N	426.492	1.610	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)N(C)CC(=O)NNc2ncnc3ccsc23)cc1	766673425	CRPKGIMMCKPWBH-UHFFFAOYSA-N	434.503	1.414	50	20	IDGD	
Cn1ncc([N+](=O)[O-])c1C(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1	766838760	BCXJVLAUGPGUNE-GOSISDBHSA-N	434.456	1.716	50	20	IDGD	
Cn1nc(SCC(=O)NN=Cc2ccc(SC(F)(F)F)cc2)c(=O)n(C)c1=O	767299486	DRAKKJXQCSGMKT-UHFFFAOYSA-N	433.437	1.333	50	20	IDGD	
O=S(=O)(CBr)N1CCN(S(=O)(=O)c2ccc3c(c2)CCCO3)CC1	767850494	KVMCJSVLTYOCOC-UHFFFAOYSA-N	439.353	1.000	50	20	IDGD	
O=C(NNC(=O)c1cn2ccccc2n1)c1cccc(S(=O)(=O)NCc2ccccc2)c1	768163962	IHUXEOZBSDQCDA-UHFFFAOYSA-N	449.492	1.888	50	20	IDGD	
CC(=O)N1CCN(S(=O)(=O)c2cccc(C(=O)NNc3ccc([N+](=O)[O-])cc3)c2)CC1	768246060	ITHILWGRYJIJHU-UHFFFAOYSA-N	447.473	1.205	50	20	IDGD	
CSCCNC(=S)NNC(=O)Cc1ccc(S(=O)(=O)N2CCCCC2)cc1	769766261	UTLJKHITKCHSIP-UHFFFAOYSA-N	430.621	1.262	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)N1CCC(N(C)S(C)(=O)=O)CC1	770647540	MVGRKWOMORNPOD-LBPRGKRZSA-N	432.930	1.204	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)N1CCN(c2ccc(C(N)=O)cc2)CC1	770649045	VJVZSGGETPQJOP-AWEZNQCLSA-N	445.907	1.769	50	20	IDGD	
O=C(NNC(=O)N1CCO[C@@H](CN2C(=O)c3ccccc3C2=O)C1)c1cc2ccccc2o1	771219993	POXBQWMWZCBJFQ-OAHLLOKOSA-N	448.435	1.784	50	20	IDGD	
CCCCn1nc(C(=O)NN=C(C)c2cn(CC(=O)OC)nn2)c2ccccc2c1=O	772837053	MCNGJWLMYXFPFK-UHFFFAOYSA-N	425.449	1.115	50	20	IDGD	
CN1CCN([C@H](C(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)c2ccccc2)CC1	772885084	UZOFDPPSLUNUSF-IBGZPJMESA-N	443.935	1.092	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(Br)c(C)n2)cc1	773526074	SQNJAVBPVAIMTC-UHFFFAOYSA-N	437.250	1.326	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1cccc(-c2ncc3n2CCCC3)c1	773544866	FPSUWZPCAVMBSD-AWEZNQCLSA-N	429.477	1.024	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1cnn(-c2ccccn2)c1	774009976	SOIXVFBFOOZOMO-LBPRGKRZSA-N	428.836	1.474	50	20	IDGD	
COc1cccc([C@@H]2[C@@H](C(=O)NNC(=O)Cc3cn4ccccc4n3)CC(=O)N2C2CC2)c1	776335076	XHZKDGMXZAGWDJ-WMZHIEFXSA-N	447.495	1.785	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)CN2C(=O)N[C@](C)(c3ccc(F)cc3)C2=O)nc1C	778429302	JTMTWBLCAJOPFA-HXUWFJFHSA-N	444.423	1.011	50	20	IDGD	
Cc1cc2c(N3CCC[C@H]3C(=O)NNC(=O)CNC(=O)OC(C)(C)C)ncnc2s1	778438287	SRGJBPUPWZCRGA-ZDUSSCGKSA-N	434.522	1.641	50	20	IDGD	
COC(=O)CNC(=O)NNS(=O)(=O)c1ccc(Br)c(Cl)c1Cl	780402961	YPOJVQDORVGXHK-UHFFFAOYSA-N	435.083	1.421	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1)c1ncn(C)n1	780700677	PHVPAQMDICKIGJ-CQSZACIVSA-N	446.475	1.222	50	20	IDGD	
O=C(COc1ccccc1CNC(=O)NNc1ncncc1Cl)NC[C@H]1CCCO1	780974296	QJCRSVUJYVWKOM-CQSZACIVSA-N	434.884	1.630	50	20	IDGD	
Cc1nn(-c2ccc(S(N)(=O)=O)cc2)c(C)c1CCC(=O)NNc1ccc(Cl)nn1	781932971	BMGZKZNBQZTNHQ-UHFFFAOYSA-N	449.924	1.656	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NN=C[C@H]1CCSC1)N(S(C)(=O)=O)CC2	782168342	CSSTZCIOPBHPRC-CJNGLKHVSA-N	441.575	1.808	50	20	IDGD	
CCOC(=O)Cn1cccc(NC(=O)C(=O)NNc2cc(Cl)ccc2Cl)c1=O	783368557	YKAMDPBYWAORMS-UHFFFAOYSA-N	427.244	1.800	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2cc(Br)cnc2OCC(F)(F)F)ncn1	783947704	HOYBSCJPEPBGSH-UHFFFAOYSA-N	449.187	1.965	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1cc(Cl)cc(C(F)(F)F)c1	784003886	QXIZUNSBHRRIJS-UHFFFAOYSA-N	448.810	1.936	50	20	IDGD	
Cc1c(NNC(=O)C(=O)Nc2ccc(CN3C(=O)CNC3=O)cc2)cccc1[N+](=O)[O-]	784352346	MTUDDAXNFWEIEG-UHFFFAOYSA-N	426.389	1.037	50	20	IDGD	
CCc1ccc(NC(=O)C(=O)NNc2ccc(Br)nc2)cc1S(N)(=O)=O	784807282	YFQLCEVVXAVRQJ-UHFFFAOYSA-N	442.295	1.136	50	20	IDGD	
C[C@H]1CN(C(=O)c2ccc(NC(=O)C(=O)NNc3cccc([N+](=O)[O-])c3)cc2)C[C@H](C)O1	784827349	AYGJCDGUKPQKEY-KBPBESRZSA-N	441.444	1.926	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)C(=O)Nc2cc(C(=O)N3CCOCC3)ccc2C)c1	784852747	OFMZEXYXIMHQPP-UHFFFAOYSA-N	440.456	1.336	50	20	IDGD	
Cc1cn(C2CCCCC2)nc1NC(=O)C(=O)NNC(=O)c1cc([N+](=O)[O-])ccc1O	785024719	YYOMIGGTZQLBOU-UHFFFAOYSA-N	430.421	1.710	50	20	IDGD	
CCOC(=O)[C@](C)(CNC(=O)NNC(=O)CNC(=O)c1cccs1)c1ccccc1	787263467	VTLMHSBQCDNHFI-HXUWFJFHSA-N	432.502	1.329	50	20	IDGD	
N#C/C(=C/c1ccc(O)cc1)C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	787404615	UNIGXXPFXBTXMK-SSZFMOIBSA-N	428.470	1.463	50	20	IDGD	
CCO[C@@H]1C[C@](NC(=O)OC(C)(C)C)(C(=O)NNC(=O)N2CCN(C)CC2)C1(C)C	788165594	CXAWCDOZNGSJQP-VLIAUNLRSA-N	427.546	1.073	50	20	IDGD	
CC(C)N(C)S(=O)(=O)c1ccc(C(=O)NNc2ccccc2S(N)(=O)=O)cc1	788227295	BIYUNPKXOMWYEJ-UHFFFAOYSA-N	426.520	1.120	50	20	IDGD	
CS(=O)(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)ccc1Cl	788330956	NTZHKQCLGSRYJE-UHFFFAOYSA-N	440.821	1.051	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2cnc(Br)c(OC)c2)c2ccccc2c1=O	788492763	OWWBHGXDCRVQTL-UHFFFAOYSA-N	446.261	1.657	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)c1ccc(O[C@@H]2CCOC2)cc1	788720789	QLYVPEMMLDQDAP-JOCHJYFZSA-N	438.528	1.828	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1cc([C@@H]2CCCO2)nn1C	789783641	WNZFZBIBPZJIFY-ABAIWWIYSA-N	435.868	1.478	50	20	IDGD	
CCOc1c(Cl)cccc1CC(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	791502435	PWEFBVLFKFDUOX-QGZVFWFLSA-N	448.859	1.812	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cnc(CC(C)C)nc2)cc1	792356046	YFOMEBXTPUMGAV-CQSZACIVSA-N	429.477	1.627	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)[C@H]1Cc2cc(Br)ccc2O1	792659380	OLIITQZXZAFEOR-CYBMUJFWSA-N	428.283	1.815	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)NCCC3=CCN(C(=O)OC(C)(C)C)CC3)nc21	793407619	AXDKKGVHMDHPMK-UHFFFAOYSA-N	432.485	1.652	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)CN1C(=O)C(F)(F)Oc2ccccc21	794186142	UNDZYHKCFDQJOO-UHFFFAOYSA-N	435.383	1.630	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)c2nnn(Cc3cc(C)no3)c2C)cc1OC	794199234	CPWAIDUTAMQOFF-UHFFFAOYSA-N	428.449	1.803	50	20	IDGD	
Cc1nc(C(C)C)oc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	794199295	DBPIPEZOLMBKSF-UHFFFAOYSA-N	436.490	1.202	50	20	IDGD	
CN(C)S(=O)(=O)/C(C#N)=C/c1ccc(OCCn2cc(C(=O)O)nn2)c(Cl)c1	794956982	MDPKFLPYINWIJQ-KPKJPENVSA-N	425.854	1.465	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)c(OC)c(C)c1OC	796992122	NBDFTMMCJBIHKZ-UHFFFAOYSA-N	431.401	1.149	50	20	IDGD	
CN(C)N(C(=O)c1cc(S(=O)(=O)C2CCCC2)ccc1F)[C@@H]1CCS(=O)(=O)C1	797422498	ZHHNYQBNORMWGT-CYBMUJFWSA-N	432.539	1.648	50	20	IDGD	
C=CCNC(=S)NNC(=O)c1ccc(NC(=O)c2cc(OC)cc(OC)c2)cc1O	798304767	AOMHYUADXYJPPJ-UHFFFAOYSA-N	430.486	1.957	50	20	IDGD	
Cn1ncc2c1C[C@H](C(=O)NNC(=O)CN1CCN(Cc3ccccc3Cl)CC1)CC2	798980133	FJRSHKCPNNDQGV-MRXNPFEDSA-N	444.967	1.144	50	20	IDGD	
C[C@@H]1C[C@H](N2CCOCC2)CN1C(=O)CCC(=O)C(C#N)=C1N(C)c2ccccc2N1C	804440053	RDVXNGKIWLBXAI-MSOLQXFVSA-N	437.544	1.979	50	20	IDGD	
O=C1COC[C@H](C[C@@H]2CN(C(=O)C(=O)NNc3ncccc3Cl)c3ccccc32)N1	806967354	DPCXJDRDTYANQJ-OLZOCXBDSA-N	429.864	1.214	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2nc(C3CCOCC3)cs2)c1	806973972	ZDBZQWLULNJDAT-UHFFFAOYSA-N	432.502	1.819	50	20	IDGD	
CS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNc2nccnc2C2CCC2)cc1Cl	807462392	YDXIEKHIMWJTIG-UHFFFAOYSA-N	438.897	1.851	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NC1C[C@@H]2CC[C@H](C1)N2CC(=O)N(C)C	807514487	VIDWPOHBYPQZDF-LNRIEFBSSA-N	435.500	1.007	50	20	IDGD	
Cc1ccccc1-n1cc(C=NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)nn1	807975591	BYJJDKIFKLIOAG-UHFFFAOYSA-N	431.500	1.484	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1)NNc1ccc(Cl)nn1	810420087	ZZDJIWJPIHRAKF-UHFFFAOYSA-N	425.776	1.450	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc2ccccc2c1)NNC(=O)CSc1ccccc1O	810807641	YUQPAPFSXXBJFP-UHFFFAOYSA-N	445.522	1.763	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)c1c(O)cnc2c(Br)cccc12	810944841	VLNMXUKGCQFJAN-UHFFFAOYSA-N	439.266	1.989	50	20	IDGD	
Cc1ccc(S(=O)(=O)NC2CC2)cc1C(=O)NNC(=O)c1cc(Br)c[nH]1	811916337	UAYFTTAPNSEWQT-UHFFFAOYSA-N	441.307	1.601	50	20	IDGD	
CC(=NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1)c1cccc(N2CCOCC2)c1	812434322	RJHFCOXKJOLDCZ-UHFFFAOYSA-N	436.921	1.978	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)c1ccc(N2CCCNC2=O)cc1	812868632	XEGJNOPYBJTINW-CQSZACIVSA-N	449.475	1.287	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H](O)c2ccc(Cl)cc2)c1	813363126	CSTMKBKHMZPZEC-QGZVFWFLSA-N	439.921	1.865	50	20	IDGD	
O=C(CSc1nnc(O)nc1O)NN=C1COc2cc(F)c(Br)cc21	814784228	HBAAPQZCDHNTKZ-UHFFFAOYSA-N	430.215	1.189	50	20	IDGD	
CC(=NNC(=O)Nc1ccc(S(N)(=O)=O)cc1)[C@@H]1CN(Cc2ccccc2)CCO1	814968289	XIHVQLJUUGAONC-IBGZPJMESA-N	431.518	1.732	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)CCn2c(S)nc3ccccc3c2=O)c(C)c1	825760530	IFUAVZKMLHSZJW-UHFFFAOYSA-N	425.514	1.952	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)c2ccc3c(c2)CCCN3S(C)(=O)=O)c1	825791421	KEQKLSDABZUTIR-UHFFFAOYSA-N	432.502	1.281	50	20	IDGD	
C[C@H]1CC(C)(C)C[C@]2(C1)NC(=O)N(CC(=O)NNC(=O)COc1ccc(F)cc1)C2=O	910813575	VYWGCFVUGPARIK-ZSEKCTLFSA-N	434.468	1.489	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)[C@H]2COc3ccc(OC)cc3C2)c2ccccc2c1=O	914775800	NAVSTNUQAZEBAP-OAHLLOKOSA-N	436.468	1.827	50	20	IDGD	
C[C@@H]1CN(c2ccc(C(=O)OCC(=O)NNC(=O)c3ccc(Cl)cc3)cn2)C[C@@H](C)O1	915038222	SNKHINRJNXJUEH-ZIAGYGMSSA-N	446.891	1.967	50	20	IDGD	
CCN(CC)CCN1C(=O)C(=NNC(=O)c2cccc(S(C)(=O)=O)c2)c2ccccc21	915052030	CHTCMLOTGQSUSX-UHFFFAOYSA-N	442.541	1.913	50	20	IDGD	
Cc1nc(C#N)c(N2CCN(C(=O)COC(=O)/C(C#N)=C\c3cc(C#N)n(C)c3C)CC2)o1	915384632	DPHLDFLIPBLMGP-IUXPMGMMSA-N	447.455	1.172	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NN=Cc1ccccc1C(=O)O	915915129	PJIQOVHXOZFDPV-UHFFFAOYSA-N	445.497	1.489	50	20	IDGD	
COc1ccc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)cn1	916234004	TXIBKCRGSBBLKV-UHFFFAOYSA-N	447.517	1.409	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)NCC[C@@](O)(c1nccn1C)C(F)(F)F	916377574	DDRLYIRVSTUOPN-APPDUMDISA-N	447.389	1.497	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)NC[C@@H](C)N1CCN(c2ccccc2)CC1	916515010	XHRAMXLCENOFMP-QGZVFWFLSA-N	435.532	1.797	50	20	IDGD	
CCn1cnnc1CNC(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	916580595	KUKKTMWPWFXGIQ-UHFFFAOYSA-N	446.471	1.200	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNS(=O)(=O)c1ccc([N+](=O)[O-])cc1OC	917721375	WDUWDWNIIAJUCL-UHFFFAOYSA-N	425.419	1.391	50	20	IDGD	
CC[C@H](NC(=O)NNC(=O)c1ccc2c(c1)OCCO2)c1ccccc1OCC(=O)NC	918222017	SDISWXBEEQRTGP-INIZCTEOSA-N	442.472	1.678	50	20	IDGD	
CC(=O)N1C[C@@H](C(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)Oc2ccccc21	920057609	LMKKHIVFWJJIAL-KRWDZBQOSA-N	431.832	1.458	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccc3oc(=O)ccc3c2)c1	920258451	PSEXNLNRGRGZAC-UHFFFAOYSA-N	430.442	1.510	50	20	IDGD	
COc1cc(C=NNC(=O)N[C@H]2CCS(=O)(=O)C2)ccc1OC(=O)c1ccc(F)cc1	920381138	ORUCOFYFELTGCZ-INIZCTEOSA-N	449.460	1.874	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	920426059	DOHVYQYLEATYEU-UHFFFAOYSA-N	444.451	1.934	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)[C@@H]1CS[C@]2(C)CCC(=O)N12	920768396	MFWGETYMZJWKJM-SIMVJXQJSA-N	442.335	1.818	50	20	IDGD	
C[C@H]1CN(Cc2csc(NC(=O)NNC(=O)c3ccc4c(c3)OCO4)n2)C[C@H](C)O1	920932545	NSJOOCLJKCBMJE-RYUDHWBXSA-N	433.490	1.948	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NCc1cccnc1N1CCN(C)CC1	921248069	QRRINLDOXMHPKJ-OAHLLOKOSA-N	430.484	1.270	50	20	IDGD	
COc1c(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cnn1-c1ccccc1	1116654127	OMZFAJWWIXIBFI-UHFFFAOYSA-N	443.485	1.206	50	20	IDGD	
CNC(=O)COc1ccc(NC(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1	1321022316	DZRLDMDQXXCHOU-UHFFFAOYSA-N	449.508	1.611	50	20	IDGD	
CNS(=O)(=O)c1ccc(CC(=O)NNC(=S)Nc2ccc(OC)c(F)c2)cc1	1332453375	DQIZIKSOTNSVBJ-UHFFFAOYSA-N	426.495	1.303	50	20	IDGD	
CN(C)C(=O)[C@H]1CCC[C@@H](NC(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)C1	1339221083	OTOMEKGYMHHCLE-JKSUJKDBSA-N	439.557	1.611	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4ncnn4c3)C2)C1	1778744343	XZQYNMAEYMXMCM-RDTXWAMCSA-N	436.310	1.346	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cn(C)c4ncccc34)C2)C1	1778770939	ZFQOMCKQRLHWEC-ORAYPTAESA-N	435.322	1.800	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnc3[nH]ncc3c2)C1	1778941805	UCCHIROWWQFXEC-JXXFODFXSA-N	435.912	1.339	50	20	IDGD	
O=C(/C=N/O[C@@H]1CCCCO1)N1CC[C@]2(C1)CN(C(=O)CCBr)CCO2	1779101145	KHCCEJFXVDVQOK-SGNWVPJISA-N	432.315	1.130	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2)c1ccn(-c2ccccc2)n1	1780182609	SVOXKBIJKDYNHZ-WOIUINJBSA-N	446.935	1.600	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H]2CCCN(C)C2)C1	1780575883	CHJFMQFUJRLQHB-YYAJDYIMSA-N	430.387	1.626	50	20	IDGD	
CSCC[C@@H](O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Br)C1	1780777465	SQEMDZYGBZXYCF-BRXULGCHSA-N	441.363	1.305	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCc1ncc[nH]1)C2)[C@@H](F)Br	1780777636	VTFFPBWJCGUFEY-SRCQZFHVSA-N	431.306	1.547	50	20	IDGD	
O=C(Cc1ccc2c(c1)OCO2)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781327913	DLCCKTVWYXRFNJ-SJLPKXTDSA-N	443.269	1.478	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)c(F)c1	1781600319	VAVNBBXCUZTZGS-YOEHRIQHSA-N	433.249	1.968	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(F)c(F)c3OC)C2)C1	1781846537	HCVHPJXAPKBPOH-BFUOFWGJSA-N	432.851	1.671	50	20	IDGD	
Cc1nn(C)cc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)Br)C1	1781997165	HWKNNKSVHAIIKA-WBHUJUFNSA-N	427.343	1.639	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnn3ccncc13)C2	1782172473	CKLXPNQCUCZIBB-XAUMDUMWSA-N	435.912	1.111	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)Br)C2	1782180113	SFABIHYYQDNTGM-BCUIYNNISA-N	425.751	1.538	50	20	IDGD	
O=C(c1cccc2ccnn12)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1782228481	AESPQZWNNOCHRJ-WMLDXEAASA-N	425.258	1.468	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)C1(Br)CC1)CCO2	1783354206	WNAYVMTZGIQTRF-SMDDNHRTSA-N	438.160	1.917	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3n[nH]c4cccc(F)c34)CCO2)C1	1783538493	XRRLZPODKLZCSI-VOJFVSQTSA-N	439.285	1.929	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H]1CCc3ccccc3O1)CCO2	1783539239	GYVZSZIPBAMJQA-GZRFBZBPSA-N	437.334	1.994	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)Cc3c(F)ccc(F)c3F)CCO2)C1	1783871032	LVSMFHRSRUQAGL-YJYMSZOUSA-N	434.842	1.730	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)Cc3cc(F)ccc3[N+](=O)[O-])CCO2)C1	1783884119	QMJSJFQKRUXDBR-DNVCBOLYSA-N	443.859	1.360	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cncc(C(F)(F)F)c3)C[C@@H]21)[C@@H](O)CCl	1784091160	KKUXKSVQTZGVIC-HJPIBITLSA-N	435.830	1.293	50	20	IDGD	
CCC(=O)N[C@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](Br)CC)C[C@@H]21	1784369275	BQISKJLZZKKMBE-QTVXIADOSA-N	432.359	1.054	50	20	IDGD	
CCOC(=O)N[C@H](O)C(=O)Nc1ccc(C2(NC(=O)[C@H](C)Br)CCC2)cc1	1789409784	UJEKNMLXSKUUQU-MEDUHNTESA-N	442.310	1.968	50	20	IDGD	
CC(=O)N/C(C)=C/C(=O)NC1(c2ccc(NC(=O)CCC(=O)NN(C)C)cc2)CCC1	1791602412	DQFKFNFUHZYVQI-CCEZHUSRSA-N	429.521	1.533	50	20	IDGD	
CC(C)OCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN(C)NC(=O)NCc1ccccc1)C2	1792690225	ZBURLTHTCWPVMH-ACDBMABISA-N	445.564	1.396	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1CCC(=O)N1	1795826815	IRUHOWVSTAQCPR-HDAOGJMZSA-N	428.439	1.789	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(C(C)C)[nH]n1)C2	1796891964	RHPOTTIVKPOJDD-BDHJUDLHSA-N	439.520	1.919	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccn(C(F)F)c1=O	1797993250	NCNDOSWFHCDZBU-NEBZKDRISA-N	431.867	1.854	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1c(F)ccnc1Cl)C2	1798440773	QOSLNGXSMHSEAF-ZSBIGDGJSA-N	446.870	1.438	50	20	IDGD	
COc1cccc(/C=C/C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)c1	1798442723	ARPPZXAYKFBTBQ-KXXXJKOBSA-N	449.511	1.659	50	20	IDGD	
Cc1ccc(CCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)cc1	1798442836	IUCMNPHUPJFSFN-REPLKXPHSA-N	435.528	1.878	50	20	IDGD	
C[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Br)c1ccc(O)cc1	1799348220	DNMUBBNFRXRGRW-MIGXYKPQSA-N	429.286	1.776	50	20	IDGD	
Cc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Br)cc2c[nH]nc12	1799349283	SGTSTBYYEDVBRH-XRGAULLZSA-N	439.285	1.765	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](C)NC(=O)c1ccc(F)cc1	1799815096	AGGJUMPXODWBPX-SOGIYBJLSA-N	439.915	1.836	50	20	IDGD	
O=C([C@H](F)Br)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(F)(F)c1ccco1	1800240472	GAIUFGSYQYGPLP-QCMRWSPLSA-N	425.201	1.652	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cc[nH]n1)C2	1800334215	IKXXDGRNIPBATL-YJMBJCRISA-N	441.438	1.427	50	20	IDGD	
CCCC(=O)N[C@H](C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](Br)CC	1800641866	KWMZTRIHRQQVPR-USRAEIGSSA-N	432.359	1.054	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(O)c(F)c1)C2	1800642866	AAEJEEAIBOJKGQ-ZWUHOBOKSA-N	429.286	1.908	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cnc3ccccn13)C2	1800754626	SLWFJWVEIPIRPP-ZUMXRPEOSA-N	435.322	1.250	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(=O)c1ccc(Cl)cc1)C2	1800970821	LKSJTSHZOJIZBA-XRGAULLZSA-N	429.300	1.366	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1csc3c1CCCC3)C2	1801011662	VBFASCNPDLTVCT-USGNIVHTSA-N	448.589	1.203	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccnc2c(O)cccc12)c1ccc(B(O)O)cc1	1801143024	CHMRYUPIVSLYSO-BCDXTJNWSA-N	445.284	1.186	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H]1CCc3ccccc3[C@@H]1O)C2	1802334467	LETSYBJHSUOVFK-KXDCAWOKSA-N	442.560	1.294	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCCn1ccnc1	1802869210	UFIVDTZCPKFSLF-ADDUXVCJSA-N	439.520	1.436	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1CCN(C(=O)c2cc(O)n[nH]2)[C@H]1c1cccnc1	1803010076	ZLPKFVRQBHUORV-FFSVYQOJSA-N	436.310	1.861	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H]2Cc3ccccc3CN2)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803138585	CRPRJQVFHHXKCZ-JSXRDJHFSA-N	442.947	1.402	50	20	IDGD	
Cc1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)c(F)c1F	1803644177	SRECQSXUCWCHIA-BTTYYORXSA-N	443.454	1.837	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)CS(=O)(=O)CC)[C@H]1c1cccnc1	1803685826	CVKPPBBAOQFYKM-BQFCYCMXSA-N	429.970	1.930	50	20	IDGD	
C=CCSCC(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1804176770	SLQHJSAQNNMZLY-DYESRHJHSA-N	433.578	1.380	50	20	IDGD	
COC(=O)c1ccc(CC(=O)N2CCC3(CCCN(C(=O)[C@H](O)CCl)C3)CC2)cc1	1805528666	XFFAPIYHFQLULY-GOSISDBHSA-N	436.936	1.847	50	20	IDGD	
Cn1nncc1C(=O)N1CC[C@H](CNC(=O)[C@H](F)Br)[C@@H]1c1cccnc1	1808651713	PHQFSDGSIPPNPZ-XBFCOCLRSA-N	425.262	1.220	50	20	IDGD	
CC(F)(F)C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1	1810303984	YTBCWOICDHGPEE-BBRMVZONSA-N	432.431	1.055	50	20	IDGD	
C/C=C/C=C\C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1	1810305957	RKNBXDMIHQWVMO-CYEZIGSKSA-N	434.500	1.532	50	20	IDGD	
Cc1cccc(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)c1	1811862396	MGJQLRFOOZBHNC-JTHBVZDNSA-N	443.312	1.703	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)NC=O)[C@H]1c1cccnc1	1812776767	IDLVSQIHINGJKK-OEAJRASXSA-N	425.327	1.395	50	20	IDGD	
COc1nccnc1C(=O)N1CC[C@H](CNC(=O)[C@H](C)Br)[C@H]1c1cccnc1	1812864739	KJJPAVKVHHQBLF-JGGQBBKZSA-N	448.321	1.983	50	20	IDGD	
Cc1nc(CC(=O)N2CC[C@H](CNC(=O)[C@H](C)Br)[C@@H]2c2cccnc2)no1	1812865214	MVTIVHDLRXJTEX-KHIZAZIESA-N	436.310	1.805	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H](CNC(=O)CNC(=O)OC)[C@H]1c1cccnc1	1813270089	YYVIDIMPQUUIEQ-IJEWVQPXSA-N	441.326	1.617	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)C23CC(C2)C3)[C@@H]1c1cccnc1	1813644443	KFYSQYVFGJGFIL-WOWQTKCMSA-N	434.500	1.200	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1ccccc1F)CC2)c1ccc(B(O)O)cc1	1815343778	OYRAQJFSAKSRCQ-AWEZNQCLSA-N	439.277	1.502	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)C[C@@H]2CCCCO2)n[nH]1	1815608379	FDMPDAKWTSRPKY-DOTOQJQBSA-N	434.541	1.734	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H]1C[C@H]1F)CC2	1817281958	ULTRZHXYZMOCGU-RZLFWIPMSA-N	432.481	1.547	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1	1817475908	ZNHPIXZPSBCRDG-INIZCTEOSA-N	432.717	1.660	50	20	IDGD	
Cc1cc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)CCC(=O)NN(C)C)CC3)cn1C	1817700980	GXQXWKMUWOWNQT-CQSZACIVSA-N	432.550	1.389	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1ccc(Cl)o1	1818425406	KAIAEMFLCPBFOA-HNNXBMFYSA-N	442.668	1.956	50	20	IDGD	
CCc1cc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)CCC(=O)NN(C)C)CC3)n(C)n1	1820637244	JQDHYSKFFBAUEX-ZDUSSCGKSA-N	447.565	1.038	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc([N+](=O)[O-])[nH]3)sc2C1	1821746606	BXDOMQCQVLFUAL-RKDXNWHRSA-N	427.870	1.859	50	20	IDGD	
O=C(N[C@H]1CCc2nc(NC(=O)c3ccoc3Cl)sc2C1)c1ccc(B(O)O)cc1	1821809129	DFCQTFPEXBHNMZ-LBPRGKRZSA-N	445.693	1.609	50	20	IDGD	
COc1ccc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@H](O)CCl)CC3)c(O)c1	1821962597	CAZQZLFAPDLKBV-LKFCYVNXSA-N	425.894	1.683	50	20	IDGD	
CN[C@H](CC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](C)Br)n[nH]1)C(=O)O	1822183864	NRVVNNZGDGZTLL-YUSALJHKSA-N	430.303	1.248	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2nc(C)c(C)[nH]c2=O)[nH]n1	1822367254	JWUCKDZFUVOFAW-GXTWGEPZSA-N	436.900	1.670	50	20	IDGD	
CN(C)C(=O)NCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)CO[Si](C)(C)C)CC1	1823879756	JIGXSRIJPOUMEX-QGZVFWFLSA-N	426.634	1.729	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H]1CCC(=O)NC1)CC2	1825440291	OCQAHBKUQYEJQX-DCAQKATOSA-N	443.367	1.755	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)CO[Si](C)(C)C)CC1	1829104380	XPDKBKJBSYHAEV-GOSISDBHSA-N	440.661	1.831	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)C3(C#N)CCC3)C2)C1	1830546992	YXWWBFPVWXBZRT-KBXCAEBGSA-N	428.327	1.168	50	20	IDGD	
CN(CC(=O)N1CCCC[C@H]1C1CCN(C(=O)CO[Si](C)(C)C)CC1)C(=O)C(=O)O	1831165399	MYPZEPKGEIAFGY-INIZCTEOSA-N	441.601	1.001	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C=N/O[C@@H]3CCCCO3)C2)C1	1831650140	DPLHWZZDNSLMSC-DJBOWYRTSA-N	445.944	1.379	50	20	IDGD	
O=C(Cc1cnc2ccccn12)NC1CCN(C2CCN(C(=O)[C@@H](F)Cl)CC2)CC1	1833293847	QXGPUQDIDNDHIC-HXUWFJFHSA-N	435.931	1.983	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccns3)CCO2)C1	1833779018	PQINPVFPHZFSHV-LRDDRELGSA-N	432.340	1.387	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ncc(C)s3)CCO2)C1	1833805223	LBQZNVFVSCIICY-GUYCJALGSA-N	446.367	1.695	50	20	IDGD	
Cc1nc(CC(=O)NC2CCN(C3CCN(C(=O)C(C)(C)CCl)CC3)CC2)no1	1833808938	UHZGYIXDVSKUGH-UHFFFAOYSA-N	425.961	1.757	50	20	IDGD	
CCc1oncc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1	1834521005	RTONUGOCTFZFKW-ZWKOTPCHSA-N	434.320	1.543	50	20	IDGD	
Cc1cccc(C(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)c1	1834801139	NHSJXEHEVYEBQL-UHFFFAOYSA-N	449.360	1.174	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](F)Cl)CC2)CC1)c1ncn(-c2ccccc2)n1	1835155872	RSNODHCCDUMVIM-SFHVURJKSA-N	448.930	1.987	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCC(N2CCC(NC(=O)c3cc(CO)on3)CC2)CC1	1836188966	NUPTVLABUADXIR-IBGZPJMESA-N	447.363	1.588	50	20	IDGD	
C[C@H]1CCC[C@H]1C(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1	1837920170	GCYNFIHHIBCFKT-HTAPYJJXSA-N	442.365	1.415	50	20	IDGD	
CCn1nc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)cc1C	1838152053	BVBMVNLADLFVLT-RBUKOAKNSA-N	447.363	1.518	50	20	IDGD	
Cn1ncc(C(=O)N2CCO[C@@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)c1Cl	1838305733	QBQZXNFZYRWUCU-SFHVURJKSA-N	433.336	1.409	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)Nc3nccs3)C2)C1	1839144847	MFRGGULKXZOHSP-SUNYJGFJSA-N	430.958	1.417	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(O)nc3)C2)C1	1839153832	SWLTYLABVWPYAE-ROUUACIJSA-N	432.304	1.094	50	20	IDGD	
Cc1ncccc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)Br)CCO2	1840031244	JOUHYNJTBHLLRI-UGSOOPFHSA-N	426.311	1.243	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCCC(F)(F)F)C2)C1	1840151185	XCFSDSKTHXDOAJ-CJNGLKHVSA-N	430.851	1.429	50	20	IDGD	
CC(C)(C)n1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)cn1	1840186385	LMZKHGWGJQHMEQ-SFHVURJKSA-N	433.336	1.512	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)C3CCC(O)CC3)CCO2)C1	1840272115	GWKWGZUMURFQSP-YHRBYZFPSA-N	447.370	1.025	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCNC(=O)OC(C)(C)C)CCO2)C1	1840802576	UNRWAMYQQOJPEP-MGPUTAFESA-N	447.960	1.375	50	20	IDGD	
C[C@@H]1CC[C@@H](C(=O)N2CC3(CCCN3C(=O)[C@@H](O)CCl)C2)CN1C(=O)OC(C)(C)C	1841348957	WRPOVLPVYRIEFA-OAGGEKHMSA-N	443.972	1.825	50	20	IDGD	
C[C@@H]1Oc2ccc(C(=O)N3CCCC34CN(C(=O)[C@@H](F)Br)C4)cc2NC1=O	1844730161	BMYFCHVQMKFKRH-IINYFYTJSA-N	440.269	1.914	50	20	IDGD	
CC(=O)N[C@@H](C(=O)N1CCCC12CN(C(=O)CCBr)C2)c1ccc(F)cc1	1845009214	HEQWHMOGADVPPD-QGZVFWFLSA-N	440.313	1.991	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)Cc1c(F)ccc(F)c1F	1847965718	PCKXBGGMWGOCFG-HOTGVXAUSA-N	426.439	1.221	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)Cc1cc(OC)c(OC)c(OC)c1	1847975794	PCXXIAABYVWCAP-PMPSAXMXSA-N	440.924	1.711	50	20	IDGD	
Cc1ccc(S(=O)(=O)NC(C)(C)C)cc1C(=O)NNC(=O)COc1ccc(C#N)cc1	15888785	LHJMPJIRXCDURW-UHFFFAOYSA-N	444.513	1.784	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc3c(c2)NC(=O)CS3)c1	16593672	VQEHXSWDHFGVMA-UHFFFAOYSA-N	434.499	1.056	50	20	IDGD	
O=C(CSCc1nc2sc3c(c2c(=O)[nH]1)CCC3)NNC(=O)c1ccccc1O	17526411	NXXWEMAQQOXLKF-UHFFFAOYSA-N	430.511	1.873	50	20	IDGD	
CCn1c(NNC(=O)c2nnn(-c3cccc([N+](=O)[O-])c3)c2C)nc2ccccc2c1=O	105552440	PKJXWXIEKNJXOA-UHFFFAOYSA-N	434.416	1.971	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)c1cc(-c2ccc(Br)cc2)[nH]n1	725740954	LGLYAHMLOLBPNT-UHFFFAOYSA-N	432.234	1.623	50	20	IDGD	
COCCCNC(=S)N(C)NC(=O)c1ccc2c(c1)C(=O)N(Cc1ccccc1)C2=O	726077276	UPFCNTJYNLPDOS-UHFFFAOYSA-N	440.525	1.970	50	20	IDGD	
C#Cc1cccc(NC(=S)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c1	726434740	FHHTUTJLCURVNE-UHFFFAOYSA-N	444.538	1.320	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)CN2C(=O)N[C@@](C)(c3ccccc3)C2=O)cc1F	727499182	OCTBTRHVDGEPBB-FQEVSTJZSA-N	445.476	1.619	50	20	IDGD	
CC(C)[C@H](NS(=O)(=O)c1ccc2c(c1)OCCCO2)C(=O)NNC(=O)CC(C)(C)C	728607584	COGWOXPFRVTNAW-SFHVURJKSA-N	441.550	1.734	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cccc(C#N)c2)cc1S(=O)(=O)NC1CCCC1	728827653	USWQCNFSEJKJET-UHFFFAOYSA-N	442.497	1.863	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1cn(-c2ccccc2Cl)nn1	728844972	BSUHZSVJIOQDSO-UHFFFAOYSA-N	426.868	1.388	50	20	IDGD	
COc1ccccc1OCCN(C)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	728958596	BDSSOEXETUNDSV-UHFFFAOYSA-N	428.493	1.453	50	20	IDGD	
CCn1c(NNC(=O)CCc2c(C)nc3[nH]n(C)c(=O)c3c2C)nc2ccccc2c1=O	729260737	XIYOLQBIZIQXHK-UHFFFAOYSA-N	435.488	1.684	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)c1csc(I)c1	730740831	MCPUOFHUNKYIFS-LLVKDONJSA-N	430.223	1.954	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)N2CCN(CCNC(=O)c3ccccc3F)CC2)cc(C#N)n1C	731201619	BRUZKIYRHDOGDG-UYRXBGFRSA-N	448.502	1.825	50	20	IDGD	
COc1ccc([C@H](CNC(=O)NNC(=O)Cc2ccccc2F)N2CCOCC2)cc1	731401906	OEPJREILRQBFGX-FQEVSTJZSA-N	430.480	1.781	50	20	IDGD	
Cc1nc(CN2CCC(CNC(=O)NNC(=O)COc3ccccc3C#N)CC2)oc1C	732475554	IUWDPIRCCRHZHD-UHFFFAOYSA-N	440.504	1.785	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)[C@H]2CCCN2S(=O)(=O)c2cccc([N+](=O)[O-])c2)c1	732936381	LPRVHTRDPTYUKO-QGZVFWFLSA-N	443.441	1.081	50	20	IDGD	
CCN1C(=O)c2ccc(C(=O)NNC(=O)c3cnn(-c4ccccc4)c3)cc2S1(=O)=O	733110680	NQQSRNKUTRJQDC-UHFFFAOYSA-N	439.453	1.112	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1NC(C)=O	733123188	WUKOAEACYPIMEL-UHFFFAOYSA-N	429.458	1.463	50	20	IDGD	
COc1ccc(CC(=O)NNc2ncccc2Cl)cc1S(=O)(=O)N1CCOCC1	734247589	QUCTZTBQNVIMMZ-UHFFFAOYSA-N	440.909	1.450	50	20	IDGD	
CC(=O)N(c1nc(/C=C(/C#N)C(=O)Nc2ccc(S(N)(=O)=O)cc2)cs1)C1CC1	734306803	SWLHHOLFQGKWBF-WQLSENKSSA-N	431.499	1.851	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)N[C@H]1CCN(c2cnn(C)c2)C1=O	735512502	NDJBELCFFRKACQ-HNNXBMFYSA-N	439.501	1.602	50	20	IDGD	
O=C(N[C@@H](C(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1ccccc1)OCc1ccccc1	737778108	GSCBJAFXIPBVFA-QZTJIDSGSA-N	445.497	1.236	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)[C@@H]2CCCCN2C(=O)c2ccc(O)nn2)c1	742242361	ZFQCPNGNRZTTTL-INIZCTEOSA-N	427.461	1.020	50	20	IDGD	
O=C(NCc1cccc(C(F)(F)F)c1)NNC(=O)c1cccc(CN2C(=O)CNC2=O)c1	742453844	NHFRMWWFCCYRRM-UHFFFAOYSA-N	449.389	1.901	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)NCc2cccn2C)cc1	743791161	YEJXFRBDHTVUAV-ATVHPVEESA-N	432.484	1.996	50	20	IDGD	
COc1cc(/C=C\C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc(OC)c1O	745510264	DRQOYVHOCFYWMO-BAQGIRSFSA-N	445.384	1.335	50	20	IDGD	
C[C@@H]1CCC[C@](CNC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)(N(C)C)C1	745720155	KKTYTJGAOJYQSV-KUHUBIRLSA-N	425.555	1.936	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)Oc1ccc(F)cc1	745892105	MIUDIKLNIAQRBO-CYBMUJFWSA-N	438.481	1.488	50	20	IDGD	
CN(C)C(=O)NNC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(Br)cc2)C1	746006249	ZRUPAGHAPSHOHS-LLVKDONJSA-N	433.328	1.152	50	20	IDGD	
COCCNS(=O)(=O)c1c[nH]c(C(=O)NNC(=O)Cc2cccc3ccccc23)c1	746108739	FXDRSFJLNNBAFT-UHFFFAOYSA-N	430.486	1.096	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NN=Cc2c(Cl)nc(N)nc2N2CCOCC2)o1	746494293	MQOCPECIDDDHJM-UHFFFAOYSA-N	435.916	1.748	50	20	IDGD	
COc1cc(C)nc(NNC(=O)c2ccc(OC)c(S(=O)(=O)Cc3cc(C)no3)c2)n1	746624076	VZYCTNWYAGDYMZ-UHFFFAOYSA-N	447.473	1.829	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCC[C@@H](C)[C@@H]2CNC(=O)OC(C)(C)C)n1	747971088	XVRJKPJILXDAKG-HIFRSBDPSA-N	439.582	1.767	50	20	IDGD	
CCS(=O)(=O)N1CCC[C@@H](C(=O)NNc2nc(-c3ccccn3)nc3c2CCC3)C1	748337170	ACZDNGFOJDJYJH-CQSZACIVSA-N	430.534	1.532	50	20	IDGD	
COc1cc(OC)cc(N2CC[C@@H](NC(=O)NNC(=O)c3ccc4c(c3)OCCO4)C2)c1	748662462	SAIFPZUSYPSUPV-OAHLLOKOSA-N	442.472	1.698	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)c2cc(S(=O)(=O)N3CCC3)ccc2Cl)cc1	748839043	YOIZHIQPEJTJER-UHFFFAOYSA-N	436.921	1.916	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(-c3n[nH]c(C4CC4)n3)cc2)cc1	748899659	XHODQSKDEPHWEE-UHFFFAOYSA-N	430.424	1.839	50	20	IDGD	
CCN(CC)C(=O)[C@@H](NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1)c1ccccc1	750227734	JKPHXMYEVBIKSP-NRFANRHFSA-N	446.573	1.846	50	20	IDGD	
O=C(NNC(=O)c1cc(Cn2cc(Br)cn2)on1)c1ccc([N+](=O)[O-])cc1	751522532	FTFNJXWBUZHPNY-UHFFFAOYSA-N	435.194	1.665	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N2CCC3(CC2)CNC(=O)C3)cc1Br	752012965	MHASIUURGJSQNN-UHFFFAOYSA-N	425.283	1.414	50	20	IDGD	
O=C(CN1CCOC[C@@H]1C[C@H](O)c1cccs1)NNC(=O)c1cccc([N+](=O)[O-])c1	753858771	JAIPILLQJRLQLM-HOTGVXAUSA-N	434.474	1.242	50	20	IDGD	
CC[C@]1(c2ccccc2)NC(=O)N(NC(=O)COC(=O)/C(C#N)=C/c2ccc(O)cc2)C1=O	754538570	UWUCEGJZHSLQLR-GTUDIADOSA-N	448.435	1.731	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1c[nH]nc1-c1ccccc1F	755428025	KUTGVCFURLEWBD-UHFFFAOYSA-N	445.476	1.994	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2cccc(-n3cnnn3)c2C)c2ccccc2c1=O	755443364	GGVYZBSGEMJTDE-UHFFFAOYSA-N	433.432	1.167	50	20	IDGD	
CC(C)N(C)S(=O)(=O)c1ccc(NC(=O)NNC(=O)COc2ccccc2C#N)cc1	755452328	NZVRQJZDYSOPJT-UHFFFAOYSA-N	445.501	1.819	50	20	IDGD	
CCNC(=O)COc1ccc(NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1	755644884	BHPFKUSZGOXIDI-UHFFFAOYSA-N	434.474	1.072	50	20	IDGD	
COCc1ccccc1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	755806236	CZPCAUXTNOFFAS-UHFFFAOYSA-N	448.501	1.320	50	20	IDGD	
CCOc1ccc(C(=O)NNS(=O)(=O)c2ccc3c(c2)C(C)(C)C(=O)N3)cc1OC	755957992	OWKZXCIDVRGOQX-UHFFFAOYSA-N	433.486	1.947	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NC[C@H]2CSCCS2)c2ccccc2c1=O	756058491	AQNPZQUEJOEIJS-ZDUSSCGKSA-N	435.575	1.989	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)Nc1ccc(C(=O)NCc2ccc(F)cc2)cc1	756061438	IDLTVSRYXHACCR-CQSZACIVSA-N	432.452	1.960	50	20	IDGD	
COc1ccc(C(=O)N(C)C)cc1NC(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	756119740	FBZCKMJHYPKNHW-UHFFFAOYSA-N	438.444	1.755	50	20	IDGD	
COCCOC(=O)Nc1cccc(NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c1	756221676	PDJBZPKMWCSIDR-UHFFFAOYSA-N	440.420	1.324	50	20	IDGD	
Cc1cc(N2CCSCC2)ccc1NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	756274151	GVLOMOYBHOZRQR-UHFFFAOYSA-N	438.517	1.990	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(F)c(NC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c1	756684159	MXGHMMFPWVICIG-UHFFFAOYSA-N	425.398	1.451	50	20	IDGD	
COc1ccccc1N1CC[C@H](NC(=O)NNC(=O)c2cc(Br)c[nH]2)C1=O	756914834	SRKUKWDTQYDKIE-NSHDSACASA-N	436.266	1.535	50	20	IDGD	
O=C(NCCc1nc(-c2ccc(Cl)cc2)no1)NNC(=O)C(=O)Nc1ccccn1	758756466	VBDBSLIZIXSPHJ-UHFFFAOYSA-N	429.824	1.297	50	20	IDGD	
COC(=O)c1cn(C2CCN(C(=O)NNC(=O)c3cccc(OC(F)F)c3)CC2)nn1	759252979	DXCQOYCROQWRMP-UHFFFAOYSA-N	438.391	1.358	50	20	IDGD	
COCCS(=O)(=O)c1ccc(CNC(=O)NN=c2sc3ccccc3n2C)cc1	759263421	ZALGRMGSZZZMEU-UHFFFAOYSA-N	434.543	1.975	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)c2ccc(F)c(S(=O)(=O)N3CCCCC3)c2)nc1	759729185	FLIZQNPQNFMCOU-UHFFFAOYSA-N	436.465	1.939	50	20	IDGD	
CCc1ccc(C(=O)NNc2ccc(C(=O)OC)cn2)cc1S(=O)(=O)N1CCOCC1	759730502	ITDCSKZHEPMUBF-UHFFFAOYSA-N	448.501	1.208	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)Cc2cccc(I)c2)cc1	760264787	ODSZHLDNZQDLEJ-UHFFFAOYSA-N	435.221	1.932	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1)C(=O)Nc1cnns1	760277807	SNNVISWFTWOFSU-KRWDZBQOSA-N	436.497	1.251	50	20	IDGD	
Cc1nc(Cl)cc(NNC(=O)CCNC(=O)[C@@H]2CCCN2C(=O)OC(C)(C)C)n1	761095094	ULLUHKOYHMPVNP-LBPRGKRZSA-N	426.905	1.787	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)[C@H](Cc1cccc(F)c1)n1nnnc1C	762409157	NZLLXKWRGSAONE-INIZCTEOSA-N	444.492	1.853	50	20	IDGD	
O=C(NNC(=O)c1ccccn1)C(=O)Nc1cc(C(=O)N2CCCCC2)ccc1Cl	763462765	BIYWVTXBIUWPBT-UHFFFAOYSA-N	429.864	1.761	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2c[nH]nc2-c2ccccc2)cc(OC)c1OC	763538589	DPEGJSDEKOOMEL-UHFFFAOYSA-N	439.428	1.502	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(-n3nc(C)cc3C)c2)cc1OC	763550387	LJFXPVGBGZWPIT-UHFFFAOYSA-N	437.456	1.906	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)C(=O)Nc1cc(F)ccc1N1CCCCC1	763552361	YVIXJYQXEQYRMX-UHFFFAOYSA-N	428.420	1.944	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(Cl)c(C(=O)NC3CC3)c2)c1	763624675	YXDWVGNNGCIAOA-UHFFFAOYSA-N	444.875	1.706	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2nn(-c3ccc(C#N)cn3)cc2C)c1	763664878	LHJKZWKFEYZEMC-UHFFFAOYSA-N	447.455	1.229	50	20	IDGD	
Cc1ccc(-n2cc(C)cn2)c(NC(=O)C(=O)NNC(=O)COc2ccccc2F)c1	763682858	PREHMEDZFUZFJC-UHFFFAOYSA-N	425.420	1.793	50	20	IDGD	
CCc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1F	763717887	BULQKGJVSKOJHD-UHFFFAOYSA-N	436.465	1.038	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cccnc2-n2cncn2)cc1	763766832	FAFZSDOWTGDJPA-UHFFFAOYSA-N	437.460	1.487	50	20	IDGD	
CCc1nnc(-c2cccc(NC(=O)C(=O)NNC(=O)COc3ccccc3C#N)c2)o1	763814410	TVVMPCOUAMSEMF-UHFFFAOYSA-N	434.412	1.336	50	20	IDGD	
CCOC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)cc1	763868052	ZXHIDOBHLRAVII-LBPRGKRZSA-N	432.408	1.948	50	20	IDGD	
NC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2ccc(Br)cc2Cl)c1	764059081	OZBHLEAPHHYMCV-UHFFFAOYSA-N	439.653	1.601	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2c(C)cnn2Cc2cc(F)ccc2F)c(O)c1	764111754	ZMRTXRCVLCHHRU-UHFFFAOYSA-N	443.410	1.932	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2O1)C(=O)Nc1cc(CC2CC2)nn1-c1ccccc1	764165423	YTFMWLCNLOQYRU-FQEVSTJZSA-N	445.479	1.914	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccn(-c3ncccc3C(F)(F)F)n2)cc1	764176295	FELKYZCKFZWQMM-UHFFFAOYSA-N	443.345	1.557	50	20	IDGD	
CN1CCC(N(C)c2ccc(NC(=O)C(=O)NNC(=O)CCc3ccccc3)cc2)CC1	764202787	ZLPDKKQICOQPHB-UHFFFAOYSA-N	437.544	1.936	50	20	IDGD	
CSc1ccc(C)c(NC(=O)C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1	764266524	LTIHOJPOWSTNBX-UHFFFAOYSA-N	428.518	1.509	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)CCc2ccccc2O)cccc1N1CCOC1=O	764278176	LMHOOTVTGNBDKU-UHFFFAOYSA-N	426.429	1.376	50	20	IDGD	
COC(=O)Cc1ccccc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	764386953	FSHWYTURIGHGAV-UHFFFAOYSA-N	439.403	1.331	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1	764398159	PAZNNTIWRINRCF-CQSZACIVSA-N	426.429	1.488	50	20	IDGD	
COC(=O)c1cccc(NC(=O)C(=O)NNC(=O)CSc2ccccc2OC)c1C	764398255	QQQJJSMOBDLFKE-UHFFFAOYSA-N	431.470	1.668	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=S)Nc1ccc2c(c1)OCO2	764512502	CWJVKOQJIZXORE-UHFFFAOYSA-N	441.513	1.191	50	20	IDGD	
Cc1ccc2c(c1)C(=O)N([C@H](C)C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)C2=O	765323368	NNXUZLUIHPKYII-CYBMUJFWSA-N	432.477	1.432	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)NCC2(N3CCOCC3)CC2)c1	765642751	SOGFIXZHVUCWQD-UHFFFAOYSA-N	427.299	1.267	50	20	IDGD	
CNC(=O)[C@H]1CCC[C@@H]1NC(=O)NNC(=O)COc1ccc(OCc2ccccc2)cc1	766277088	CTEGAIVIZMKPLK-PMACEKPBSA-N	440.500	1.890	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)/C=C3\CC[C@H](C)C3)CC2)cc1	766636080	JAJIGBIKZDZFEY-AATZCTEQSA-N	434.562	1.195	50	20	IDGD	
COc1ccc([C@@H](CNC(=O)NNc2ccccc2S(C)(=O)=O)N2CCOCC2)cc1	766838465	VDXVUAAAKMCALV-LJQANCHMSA-N	448.545	1.798	50	20	IDGD	
O=C(NNC(=S)NCCc1cccs1)c1ccc(N2C(=O)CCC2=O)c([N+](=O)[O-])c1	768187476	OWORPECKFKFTDQ-UHFFFAOYSA-N	447.498	1.661	50	20	IDGD	
CCOC(=O)c1[nH]c(C)c(S(=O)(=O)NNC(=O)c2nnc(-c3ccccc3)o2)c1C	768506339	OPZYGKWUYSKPLV-UHFFFAOYSA-N	433.446	1.482	50	20	IDGD	
CSCCNC(=S)NNC(=O)c1ccc(S(=O)(=O)NCc2cccs2)cc1	769767489	NABZAXDZFWKIBX-UHFFFAOYSA-N	444.629	1.699	50	20	IDGD	
COC(=O)c1cn([C@H]2CCN(C(=O)NNC(=O)[C@@H](C)Oc3cccc(Cl)c3)C2)nn1	770648495	RNHMJZYKLCCDGD-YPMHNXCESA-N	436.856	1.173	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1Br)C(=O)NNc1nc(O)c2cnn(C)c2n1	770972021	ORVXJPSNGAYSMD-SSDOTTSWSA-N	425.218	1.881	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)[C@H]3CC(=O)N(Cc4cccc(C(F)(F)F)c4)C3)nc21	770972296	HAHYQFHKIITXNC-NSHDSACASA-N	449.393	1.580	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)[C@]12CCC(=O)N1c1ccccc1C(=O)N2CC(C)C	771970005	QQHISKWBYNKYTM-PEBXRYMYSA-N	444.488	1.111	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)C[C@@H](NC(=O)c1ccc(O)cc1)c1ccccc1	772001130	AVKYCLVYCVOVBZ-RDTXWAMCSA-N	427.457	1.743	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NNC(=O)c2ccc(CS(C)(=O)=O)cc2)C1	773411984	SPDHFPWJODFVBF-MRXNPFEDSA-N	439.534	1.639	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)C(=O)Nc2ccnn2[C@H]2CCN(Cc3ccccc3)C2)n1	773475495	XMQGEFHGWWHBQI-SFHVURJKSA-N	434.504	1.819	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)C(=O)Nc2cccc(C(=O)N3CCSCC3)c2C)n1	773480551	FZKDBGRMTYCSAJ-UHFFFAOYSA-N	428.518	1.673	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2O1)C(=O)Nc1cccc(-c2ncc3n2CCCC3)c1	773540085	HXUQORSIXIWSKD-HXUWFJFHSA-N	445.479	1.976	50	20	IDGD	
CCOc1ccc(C(=O)N2CCCCC2)cc1NC(=O)C(=O)NNc1nccc(OC)n1	773726087	HXALMZGSGOBJHG-UHFFFAOYSA-N	442.476	1.592	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)c1cc(F)ccc1N1CCOCC1	776106197	FIOGOPDWBUTHRA-UHFFFAOYSA-N	425.420	1.628	50	20	IDGD	
COc1ccccc1[C@](N)(C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)C(F)(F)F	776117607	SUVLALBDIHBCNV-KRWDZBQOSA-N	445.419	1.276	50	20	IDGD	
CC(C)CS(=O)(=O)N1CCC(NC(=O)NNC(=O)Cn2ccc3ccccc32)CC1	776907359	IHVVPAYBEASCBH-UHFFFAOYSA-N	435.550	1.422	50	20	IDGD	
CN(NC(=O)c1ccc(Br)c(S(=O)(=O)N(C)c2ccccc2)c1)C(N)=O	778417489	VCGWJITUJSMECU-UHFFFAOYSA-N	441.307	1.930	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2ccc[nH]2)ccc1I	778557779	SQWFMUAKHFGPRF-UHFFFAOYSA-N	449.226	1.029	50	20	IDGD	
COc1cc(OC)c(NC(=O)C(=O)NNC(=O)Cc2ccsc2)cc1Br	778709656	JTESRUIKNSPHOY-UHFFFAOYSA-N	442.291	1.856	50	20	IDGD	
COc1ccc(NNC(=O)NCc2ccc(S(=O)(=O)NC[C@@H]3CCCO3)cc2)nc1	780964718	UMUCLFKJGQLIOI-INIZCTEOSA-N	435.506	1.374	50	20	IDGD	
Cc1ccc(C(=O)N2CCC[C@@H](C(=O)NNC(=O)CCNC(=O)OC(C)(C)C)C2)cc1	780971587	OOVZNPRNRIPJRA-QGZVFWFLSA-N	432.521	1.909	50	20	IDGD	
O=S(=O)(CBr)N1CCN(S(=O)(=O)c2ccc(F)c(Cl)c2)CC1	782402587	RQZVZZOLUVCYNT-UHFFFAOYSA-N	435.724	1.468	50	20	IDGD	
NS(=O)(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2Cl)c1	782927507	TUPODEXVNGFSAD-UHFFFAOYSA-N	431.257	1.041	50	20	IDGD	
O=C(NN=c1cc[nH]cc1)C(=O)Nc1ccc(CN2CCN(c3ccccn3)CC2)cc1	783370410	QGIPKUGFKUQAPT-UHFFFAOYSA-N	431.500	1.303	50	20	IDGD	
Cc1ccccc1NC(=O)NNC(=O)C(=O)Nc1ccc(N2CCC(C(N)=O)CC2)cc1	783416309	QVTKWBPZSDRLSL-UHFFFAOYSA-N	438.488	1.488	50	20	IDGD	
CN(NC(=O)CNC(=O)Nc1ccccc1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	783704139	JXQWFLRSVBNKLV-UHFFFAOYSA-N	434.497	1.444	50	20	IDGD	
Cc1cccc(Oc2ccc(NC(=O)C(=O)NNC(=O)CNC(=O)c3ccco3)cc2)c1	784002955	XTDRERBIWZDEFS-UHFFFAOYSA-N	436.424	1.896	50	20	IDGD	
COc1ccccc1Oc1ccc(NC(=O)C(=O)NNC(=O)C(=O)N2CCCC2)cc1F	784003392	VZNMKCYAHPBOIM-UHFFFAOYSA-N	444.419	1.335	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)c2cc3c(=O)n4ccccc4nc3n2C)cc1OC	784294633	ANHOTZMGEYMVDB-UHFFFAOYSA-N	435.440	1.668	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ccc(OC(F)F)cc2)cc1NS(C)(=O)=O	784318977	QADIGPKILVIVKM-UHFFFAOYSA-N	444.416	1.750	50	20	IDGD	
CNS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccc(F)cc2Br)cc1	784802253	CXUGWRXVPSYAEZ-UHFFFAOYSA-N	445.270	1.578	50	20	IDGD	
CNC(=O)Cc1ccc(NC(=O)C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)cc1	785102236	FKTPWCHZKPCOKY-UHFFFAOYSA-N	445.426	1.227	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NN=C2CCOC[C@@H]2CN2CCCCC2)ccc1Cl	787151693	QEFJMQVYSBXSTO-AWEZNQCLSA-N	428.942	1.596	50	20	IDGD	
COC(=O)CS(=O)(=O)Cc1ccc(CNC(=O)/C(C#N)=C/c2ccc(O)cc2)cc1	787429324	WLQHEYGPHMYNPY-VCHYOVAHSA-N	428.466	1.703	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2nn(-c3c(F)cccc3F)cc2C)n1	787828896	KXQHNWAUHLGFDX-UHFFFAOYSA-N	449.439	1.771	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)[C@H]1CCCCN1S(=O)(=O)c1ccccc1	788175627	WUPABMBNAMKOIG-MRXNPFEDSA-N	427.490	1.349	50	20	IDGD	
O=C(CCC(=O)Nc1ccc2nc(O)[nH]c2n1)NNc1nnc(-c2ccccn2)s1	788560333	MRKXBEXBSJNHKJ-UHFFFAOYSA-N	425.434	1.439	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NN=Cc1ccc(Cl)c(I)c1O	788713612	BZPVZYUPAOAPKM-LURJTMIESA-N	445.666	1.038	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2nc3c(s2)CCC3)n[nH]1	789740102	SXQGVFRMHZXPES-UHFFFAOYSA-N	426.458	1.430	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)C2CCC(NC(=O)C3CC3)CC2)c2ccccc2c1=O	792805197	CWBGFODECVPOOU-UHFFFAOYSA-N	439.516	1.653	50	20	IDGD	
Cc1ccc(S(=O)(=O)n2ccc(C(=O)N([C@H]3CCS(=O)(=O)C3)N(C)C)c2)cc1	792850799	QSRUVXNGKUNLSQ-INIZCTEOSA-N	425.532	1.139	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(Br)cc([N+](=O)[O-])c2)c(O)c1	793026420	QWSNPIYPIZOOTA-UHFFFAOYSA-N	437.206	1.771	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)c2cc(Br)cc(S(C)(=O)=O)c2F)n1	794084382	DQJHCSZREVTKHT-UHFFFAOYSA-N	430.255	1.770	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)c2ccc(F)c(S(=O)(=O)N(C)C)c2)cc1	794710768	JFBHJIARPUYLSC-UHFFFAOYSA-N	444.510	1.083	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)c1ccc(CN2C(=O)CCC2=O)cc1	795162478	ZPBXMZXWASEGQL-UHFFFAOYSA-N	430.486	1.343	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)c2nnc3ccccc3n2)c2ccccc2c1=O	798154137	YKEABPQPODMKTO-UHFFFAOYSA-N	431.456	2.000	50	20	IDGD	
C=CCNC(=S)NNC(=O)CC[C@@H]1NC(=O)N(c2ccc(Cl)c(Cl)c2)C1=O	798306543	LGZJIJUIWFIFBG-LBPRGKRZSA-N	430.317	1.880	50	20	IDGD	
CCCS(=O)(=O)Nc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc(C)c(C)c1	798307180	JYYRXBHOWQQTHS-UHFFFAOYSA-N	432.502	1.855	50	20	IDGD	
Cc1c([N+](=O)[O-])ccc(F)c1NC(=O)C(=O)NNC(=O)c1cc(Br)cn1C	800623201	ISTMDWOUPLSXFF-UHFFFAOYSA-N	442.201	1.543	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)C(=O)Nc2cc(F)c(N3CCOCC3)cc2F)c1	806969041	WJQAXRMSGMEOEN-UHFFFAOYSA-N	434.399	1.670	50	20	IDGD	
CN(C)CC(=O)NNC(=O)C(=O)Nc1nc(Cc2ccccc2Br)cs1	806978236	RZLQMJXUKVKOMW-UHFFFAOYSA-N	440.323	1.144	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1cccc(C(=O)NNC(=O)N2CCN(C)CC2)c1)c1ccccc1	807381222	JGCRLTHVQDAVHK-MRXNPFEDSA-N	445.545	1.328	50	20	IDGD	
CCS(=O)(=O)N1CCC([C@H](C)N(C)CC(=O)NNC(=O)c2cccc(Cl)c2)CC1	808775876	MKJSQHHKKMOBJO-AWEZNQCLSA-N	444.985	1.483	50	20	IDGD	
COC(=O)c1c(F)ccc(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)c1C	810390614	IDSPKMFVAJMUKO-UHFFFAOYSA-N	441.419	1.136	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2cc(C)c(F)cc2C(=O)NCC(F)(F)F)nc1	810390824	XTJMAUMYOBLEGK-UHFFFAOYSA-N	443.357	1.912	50	20	IDGD	
Cc1cc(Cl)ccc1OCCCC(=O)NNC(=O)c1ccc2c(c1)NC(=O)CNC2=O	814193118	JUASDGMTXMEXGG-UHFFFAOYSA-N	444.875	1.951	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2ccnc(NC(=O)C(C)C)c2)cc1	814724357	WESUIEFQMKPOSM-UHFFFAOYSA-N	447.517	1.066	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCC(=O)NNc2cccc(Cl)n2)cc1OCC	817005175	IETMNMCAYBSDFJ-UHFFFAOYSA-N	428.898	1.954	50	20	IDGD	
O=C(NCc1ccc(OCC(F)(F)F)cc1)NNC(=O)c1ccc(-n2cnnn2)cc1	817966067	FPEUAQDNTAVZRX-UHFFFAOYSA-N	435.366	1.748	50	20	IDGD	
COc1cccc(/C=C(/C(=O)NNC(=O)COc2ccc(C)c(C)c2)n2nnnc2C)c1	818023338	GBXZBKORKIIXDO-NDENLUEZSA-N	436.472	1.831	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)CCc2ncc(-c3ccccc3)o2)n1	829292029	RXAIGWPUCYGQAJ-UHFFFAOYSA-N	428.470	1.972	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1cnn(-c2ccc(F)cc2)c1C(F)(F)F	893186054	CVQPWJQODFQRJS-SECBINFHSA-N	434.371	1.226	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)c2ccc(CS(=O)(=O)c3ccccc3)o2)C[C@@H](C)O1	912918858	FNCLLVBFFDXYHN-HZPDHXFCSA-N	449.529	1.514	50	20	IDGD	
COCCN1C[C@@H](C(=O)NNC(=O)c2cc3c(C)nn(-c4ccccc4)c3s2)CC1=O	914459402	FRVCGFFGPRCHRC-AWEZNQCLSA-N	441.513	1.651	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)N1CCN(S(=O)(=O)N(C)C2CCCCC2)CC1	914826253	ZUNKFPHCAAGMBQ-UHFFFAOYSA-N	437.566	1.476	50	20	IDGD	
CS(=O)(=O)CC[C@H](NC(=O)c1ccccc1Cl)C(=O)NNC(=O)C1CCCC1	914848950	LBGVPAJRRXMDPW-HNNXBMFYSA-N	429.926	1.211	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCCC(=O)N2CCCCC2)nc1	916437021	BBQXGTRWRRZHAC-UHFFFAOYSA-N	426.543	1.141	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NC[C@H](C)N2CCCC[C@H]2C)cc1	916446932	DTJLFPZZZAOPON-SJORKVTESA-N	439.582	1.209	50	20	IDGD	
Cc1ccc(C(=O)NNS(=O)(=O)c2ccc([N+](=O)[O-])c(Br)c2)c(O)c1	918162029	SETWETBWVXRJTP-UHFFFAOYSA-N	430.236	1.995	50	20	IDGD	
CC(C)Oc1cccc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1	918224856	CHJUJLMPKMNSBN-UHFFFAOYSA-N	434.518	1.868	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2ccc(C)cc2O)cc1S(=O)(=O)NC(C)(C)C	918341031	JLWNMMDASNKQOJ-UHFFFAOYSA-N	435.502	1.861	50	20	IDGD	
CC(C)[C@@H](NC(=O)Cc1ccc2ccccc2c1)C(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1	919884807	QKXFUTKNDFCIOV-AZUAARDMSA-N	445.541	1.105	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)[C@H]2CCCN2C(=O)/C=C/c2ccc(C(N)=O)cc2)c1	920020002	FSEQHZRXKIVAAG-XEDBTPMOSA-N	449.511	1.317	50	20	IDGD	
O=C(CN1CCCC1=O)NNC(=O)[C@H]1CCCN1C(=O)c1cc(Cl)cc(Cl)c1	920435950	QPDBPPWIAWNRBU-CQSZACIVSA-N	427.288	1.368	50	20	IDGD	
N#Cc1ccc(CSc2ccccc2C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)cc1	920744393	CEYSFAYTKCHOGG-MRXNPFEDSA-N	444.538	1.982	50	20	IDGD	
O=C(CSc1nnc(-c2ccc(F)cc2)n1C[C@H]1CCCO1)NNC(=O)NC1CC1	920766391	CPLLDGXQYLUAOO-OAHLLOKOSA-N	434.497	1.848	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)c3ccccc3SCC(=O)N3CCCC3)nc21	1319381037	BDGRPTLRKRPPFA-UHFFFAOYSA-N	427.490	1.540	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)[C@@H](c1cnn(C)c1)N(C)C(=O)OC(C)(C)C	1323517845	MIBUBJBCQGNRDX-GOSISDBHSA-N	447.492	1.563	50	20	IDGD	
CCOC(=O)[C@H](C)NC(=O)c1ccc(NC(=O)NNC(=O)c2ccc(OC)cc2)cc1	1323831124	VALKYFFCZGUMBV-ZDUSSCGKSA-N	428.445	1.843	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)N[C@H]1COc2c(F)cc(F)cc2C1	1339889524	KDJPIXIVEIRHNA-OAHLLOKOSA-N	432.431	1.305	50	20	IDGD	
Cc1nc2sccn2c1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2	1778721614	KCWVJBPDBIVNKT-DIFFPNOSSA-N	441.351	1.931	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cn3cccnc3n2)C1	1778991652	RPMPYHYQFXALFB-DYESRHJHSA-N	445.596	1.708	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc[nH]3)C2)C1	1779369989	XAFAJETVDXIDPM-MGPUTAFESA-N	440.928	1.590	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(Cl)Cl)C2)C(=O)Nc1cccnc1	1779489213	RTUFZWWFDQQRFK-FZKQIMNGSA-N	429.304	1.338	50	20	IDGD	
O=C(c1snnc1C1CC1)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781330176	SEICGLRFBUBAOV-SWLSCSKDSA-N	433.303	1.550	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1c[nH]c(=O)cn1)C2	1781902498	ACPWYVCDOHNXCD-RVZJWNSFSA-N	441.326	1.071	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCc1c(C)noc1C)C2	1782170878	DKMCSXWXBYJZQS-WAOWUJCRSA-N	441.956	1.992	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCS(C)(=O)=O)C1	1782716889	DSJOFRVPSZTVNF-XOKHGSTOSA-N	443.393	1.171	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2)c1ccc(CO)c(F)c1	1783072958	RPOFGUOBPDPGJA-SQGPQFPESA-N	428.888	1.045	50	20	IDGD	
Cc1ccc([C@@H](C)C(=O)N2CCO[C@@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc1	1783936051	BJAASIUDRRNBLT-WZONZLPQSA-N	430.549	1.301	50	20	IDGD	
C[C@H](C(=O)N1CCO[C@@]2(CCN(C(=O)C(Cl)Cl)C2)C1)[S@@](=O)c1ccccc1	1783949490	KRLPDUDDDCHFEQ-PFTQGLRFSA-N	433.357	1.816	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]3C2)c(O)n1	1783970101	NAJCUKFONCORIG-XTBFLFJDSA-N	440.338	1.720	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3ccccc3OC)[C@H]2C1	1784265731	GCSZUUGWFXLAPO-GNBUJSLZSA-N	438.952	1.861	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CC(=O)OC(C)(C)C)[C@H]2C1	1784781424	KHIYVDLAQXZHSH-RFGFWPKPSA-N	433.343	1.481	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnoc3C3CC3)C[C@@H]21	1786404485	VIKQFUZFDDWDPL-QEJZJMRPSA-N	426.311	1.930	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3c[nH]cc3C)C[C@@H]21	1787508961	OBQLNPZZOLUBTP-IIYRHJEWSA-N	440.504	1.050	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(CO)o3)[C@H]2C1	1788905463	OCYSQXVSGJGBGH-PCBIJLKTSA-N	429.311	1.539	50	20	IDGD	
CC(C)n1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)Br)C[C@@H]32)n1	1789373291	YVJKVGALHNBREC-YXWQFLTLSA-N	427.343	1.841	50	20	IDGD	
CC[C@H](C)[C@H](N)C(=O)NC1(c2ccc(NC(=O)c3cnccc3C(=O)NN)cc2)CCC1	1789522890	SNYJLZOIUBQSOW-LIRRHRJNSA-N	438.532	1.806	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nccc(OC)c3OC)C[C@@H]21	1789862124	ZHWWUDBPFSOAHR-AYDFFVQHSA-N	425.913	1.710	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nccc4nc[nH]c34)C[C@@H]21	1789865861	HKTOYOHWWWRLEB-VIOOABJFSA-N	440.331	1.788	50	20	IDGD	
CCC(=O)N[C@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](Br)CC)[C@H]2C1	1790958213	MMHLBOUPZRWANZ-FQKPHLNHSA-N	432.359	1.054	50	20	IDGD	
C=C1CC(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C3)C1	1792437546	YYMJIDKOLACEDS-YVSFHVDLSA-N	441.956	1.674	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c(c1)COC3)C2	1792867410	AXUWSKZJRNDCST-GQAVTEOGSA-N	437.334	1.951	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3n(n1)CCCN(C)C3)C2	1793453662	OWGOANNDHPFTIG-LORHWOILSA-N	437.972	1.329	50	20	IDGD	
COc1cnc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@](C)(Cl)CCl)c(F)c1	1799277703	VXMZUHHELKXUIA-WZTYKQCMSA-N	434.295	1.669	50	20	IDGD	
C[C@H](Cc1ccccn1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Br	1799351839	COVZHDATHUZRDH-CNRIWFPOSA-N	428.302	1.540	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@H]2[C@H](C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@@H](F)Cl)C4)[C@@H]2C1	1800717997	IJBYHZBQEJNCGQ-OAFXHQAOSA-N	445.919	1.223	50	20	IDGD	
O=C1CC[C@H](C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](Br)Cc2ccccc2)N1	1801568197	UOYLMKSIMLFESC-CWQOZTLDSA-N	448.361	1.909	50	20	IDGD	
C[C@@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1(N3CCN(C)CC3)CC1)C2	1801968108	NNIOPMNYOQJTRW-LVQVYYBASA-N	427.387	1.188	50	20	IDGD	
COc1ccc([C@H](O)C(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)cc1	1803137903	VMPQMLQKJFETSL-MDNKFWRPSA-N	447.919	1.429	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H](CNC(=O)c2cccc(=O)n2O)[C@H]1c1cccnc1	1804949044	DRVXCNXHURBEBX-OXQOHEQNSA-N	444.564	1.652	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1)c1cccc(=O)n1O	1804954702	ZPCZOGZGQXLUEZ-RDTXWAMCSA-N	449.305	1.585	50	20	IDGD	
O=C(NCC(=O)N1CCCC2(CCN(C(=O)[C@H](O)CCl)CC2)C1)c1cccs1	1807093606	UXSYUMBQHDJHDB-CQSZACIVSA-N	427.954	1.309	50	20	IDGD	
C=CC[C@H](C(=C)C)C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1807362488	VQLKMMZNKOBGFP-YMPZKCBVSA-N	447.344	1.849	50	20	IDGD	
Cc1ccnc(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)c1	1807374205	FGIFOXJHBRHESK-SIKLNZKXSA-N	444.300	1.098	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)C2(N3CCN(C)CC3)CC2)[C@H]1c1cccnc1	1808275578	SKNBIZOTNATFOE-UFYCRDLUSA-N	448.011	1.885	50	20	IDGD	
CN1CCCn2nc(C(=O)N3CC[C@H](CNC(=O)[C@H](F)Cl)[C@@H]3c3cccnc3)cc2C1	1808322956	ZIVAQLDZFXJHDA-MNEFBYGVSA-N	448.930	1.968	50	20	IDGD	
CC[C@@H](NC(C)=O)C(=O)N1CC[C@H](CNC(=O)[C@@H](F)Br)[C@@H]1c1cccnc1	1808649493	SIAMPOJQHKGDSD-LVQVYYBASA-N	443.317	1.693	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H](CNC(=O)[C@H](F)Br)[C@H]1c1cccnc1)n1ccnn1	1808679347	WKSSZMJLMKZYSZ-NGFQHRJXSA-N	439.289	1.631	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)c3c[nH]c4ncccc34)CC2)C1	1809972360	NANGRCLQZYAXQS-UHFFFAOYSA-N	446.316	1.401	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)c3cc(Cl)ccn3)CC2)C1	1809978029	OKCMXNPWRHOZPC-UHFFFAOYSA-N	441.724	1.573	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1CCN(C(=O)c2cc(CO)on2)[C@H]1c1cccnc1	1810543504	CVDGTULWSHKNEA-KXBFYZLASA-N	432.553	1.733	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H](CNC(=O)CO[Si](C)(C)C)[C@H]1c1cccnc1)n1ccnn1	1810543915	GQVFSWNFGJQIDO-SZVBFZGTSA-N	430.585	1.792	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)C2=NNC(=O)C2)[C@H]1c1cccnc1	1812776632	TYPYVJOFKFSCCO-WWGRRREGSA-N	436.310	1.137	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2cc(F)c[nH]2)[C@@H]1c1cccnc1	1812922369	WJVFATSIMIBXHT-YWZLYKJASA-N	430.484	1.241	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2cc3n(n2)CCCO3)[C@@H]1c1cccnc1	1813030426	JTDREXYQGSMEGP-TXPKVOOTSA-N	447.923	1.634	50	20	IDGD	
Cc1ccc(CC(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)o1	1813509952	OKGRCIHSTCCPDG-XXBNENTESA-N	447.300	1.225	50	20	IDGD	
O=C(CC(F)(F)F)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2	1814446096	ARPARLLZYDJRIR-NSHDSACASA-N	427.213	1.001	50	20	IDGD	
COC(=O)[C@@H]1CC[C@H](C(=O)N2CCCC[C@@H]2c2cc(NC(=O)[C@H](O)CCl)n[nH]2)C1	1814863979	DZZNMRODXHUJEF-CTHBEMJXSA-N	426.901	1.591	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)CCc3ccc[nH]3)sc2C1	1815477867	ALNWBWRZBHROFX-AWEZNQCLSA-N	432.550	1.389	50	20	IDGD	
Cc1nnc(CC(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@@H](F)Br)CC3)o1	1815491163	HNIQEPKVLVFMPV-JVXZTZIISA-N	432.275	1.680	50	20	IDGD	
Cc1noc(CC(=O)Nc2nc3c(s2)C[C@@H](NC(=O)CCBr)CC3)n1	1815560614	MJOURGBPDITIGI-VIFPVBQESA-N	428.312	1.774	50	20	IDGD	
Cc1noc(C)c1CC(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1	1815709876	VEBYAUXFEVEUGW-KRWDZBQOSA-N	445.524	1.622	50	20	IDGD	
Cc1ccc(CC(=O)Nc2cc([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)cn1	1815976357	DYEKVFVNTFPXDJ-HXUWFJFHSA-N	447.304	1.342	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)C(=O)c2ccccc2)n[nH]1	1816715454	WOPZDNXIVSTXRA-QGZVFWFLSA-N	440.504	1.658	50	20	IDGD	
CC[C@@H](NC(N)=O)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CO[Si](C)(C)C)CC2	1817018102	VPVPFQCZMNVPDW-WDEREUQCSA-N	427.603	1.354	50	20	IDGD	
O=C(N[C@H]1CCc2nc(NC(=O)[C@H](F)Cl)sc2C1)c1n[nH]c2c1CS(=O)(=O)C2	1817121551	MZINKFKRPXCUTN-QTTZVWFDSA-N	447.901	1.055	50	20	IDGD	
Cc1cc2nnc(C(=O)Nc3nc4c(s3)C[C@H](NC(=O)[C@@H](O)CCl)CC4)c(C)n2n1	1818244754	JNYMHJGXBCSJHN-PWSUYJOCSA-N	449.924	1.023	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2coc(Cl)n2)[nH]n1	1822410937	STBSMNOFNGBVTB-CYBMUJFWSA-N	437.888	1.730	50	20	IDGD	
COc1ncccc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1	1822413211	OFSRFGCNGQMYIK-MRXNPFEDSA-N	443.508	1.492	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)C2=CCCS2)CC1	1824563930	NTCXAXARZDWTKZ-LJQANCHMSA-N	428.363	1.621	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](Br)CC)sc2C1	1825445893	LDYNCKRXGDDCDL-VWYCJHECSA-N	443.367	1.919	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)c2ccsc2)CC1	1825795500	KJJJXDHDXQDYRN-FQEVSTJZSA-N	426.347	1.975	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(O)cc1F)CC2	1826088746	MVGYFTMGRGJOGB-NSHDSACASA-N	449.508	1.587	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H]3CCNC(=O)C3)sc2C1	1826222410	XESLVYLDMJEELF-GBNMTWHSSA-N	433.361	1.818	50	20	IDGD	
C[C@H](C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCC(=O)NN(C)C)CC2)n1cccc1	1826599747	PEBUXZHBJGQIQC-ZIAGYGMSSA-N	432.550	1.491	50	20	IDGD	
CC(C)O[C@@H](C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827052269	RREDLNMFKDYGSF-UWJYYQICSA-N	430.354	1.413	50	20	IDGD	
Cc1cc(C(=O)NCC(=O)N2CCC([C@@H]3CCCCN3C(=O)[C@H](F)Cl)CC2)no1	1827608959	MUCNLQVXEXHAPO-RDJZCZTQSA-N	428.892	1.867	50	20	IDGD	
Cc1nc2ncccn2c1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H](O)CCl)CC1	1828229148	RNTDYANSJRWYGK-IAGOWNOFSA-N	433.940	1.871	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(F)nc1F)CCO2	1829532754	XMFKCUMHKSZDRQ-LJQANCHMSA-N	443.523	1.281	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(F)nc3F)CCO2)C1	1829533732	OIIYEPNERYKPHL-GTNSWQLSSA-N	448.264	1.213	50	20	IDGD	
Cc1ccn(C)c1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1	1829825764	JJMIBFUYENTTLD-NRFANRHFSA-N	437.349	1.560	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(C)c(Cl)c3)CCO2)C1	1830114848	KUBJIJKHOLIKCO-YLJYHZDGSA-N	445.343	1.972	50	20	IDGD	
Cc1cnoc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)CBr)CCO2	1830543145	KMQXMZILFARFIZ-SJKOYZFVSA-N	430.299	1.084	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3CCCS3)C2)C1	1830545424	IYHDEUOHVVEBQP-KEYYUXOJSA-N	435.384	1.369	50	20	IDGD	
CCCC(=O)N[C@H](C)C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](Cl)CCC)CCO2)C1	1831651591	RPLCBFGREMDIHH-JXXFODFXSA-N	431.961	1.155	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H]2C[C@H]3CC[C@@H]2O3)CC1	1831874107	BDKVASMRVMMZJW-ZRNYENFQSA-N	434.581	1.547	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3sccc3F)CCO2)C1	1831922824	OZYYFKZPIKYUGT-ZBEGNZNMSA-N	435.315	1.741	50	20	IDGD	
O=C(CCc1ccco1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1833051289	REZSRZONASUNSE-NVXWUHKLSA-N	433.274	1.359	50	20	IDGD	
C[C@@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)c3cnsn3)CC2)CC1	1833262105	INCAGDFMJVEMSL-LBPRGKRZSA-N	444.399	1.754	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cc(O)nc(Cl)c3)CC2)CC1)[C@H](O)CCl	1833308625	YAQYAMDILFTTNH-OAHLLOKOSA-N	445.347	1.226	50	20	IDGD	
COc1cccc(CC(=O)N2CCC(N3CCC(NC(=O)[C@@H](O)CCl)CC3)CC2)c1	1833309502	ZXGMMVNAKAVVGI-FQEVSTJZSA-N	437.968	1.409	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3ccn4nccc4c3)CC2)CC1)[C@@H](O)CCl	1833310133	KHGMALVYBZAIDR-IBGZPJMESA-N	433.940	1.119	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3ccc4cncn4c3)CC2)CC1)[C@@H](O)CCl	1833310153	LFXAVPWIHOMFOC-IBGZPJMESA-N	433.940	1.119	50	20	IDGD	
Cc1cccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)c1	1835042273	DUVLAHNEHIPIFY-OXJNMPFZSA-N	439.350	1.777	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)C(Cl)Cl)CC2)CC1)c1cn2cccnc2n1	1835547368	COFLEQOIVBNTOT-UHFFFAOYSA-N	439.347	1.718	50	20	IDGD	
CCn1nccc1C(=O)N1CCC(N2CCC(NC(=O)CO[Si](C)(C)C)CC2)CC1	1835833470	HKRMILMZAOXXBR-UHFFFAOYSA-N	435.645	1.940	50	20	IDGD	
CC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)CS(C)(=O)=O)CC2)CC1	1836394743	FHUXLTDHUGSVGO-YOEHRIQHSA-N	436.018	1.256	50	20	IDGD	
Cc1cc2nc(C(=O)N3CCO[C@]4(COCCN(C(=O)[C@H](F)Cl)C4)C3)[nH]c2cc1C	1837345927	QQKJCLHEESSTQM-JXFKEZNVSA-N	438.887	1.784	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)c3cncc(F)c3)CC2)CC1	1837525499	IUABWFFYGQKBKN-UHFFFAOYSA-N	449.527	1.206	50	20	IDGD	
Cc1ccc(CCC(=O)N2CCOC[C@]3(C2)CN(C(=O)CO[Si](C)(C)C)CCO3)cn1	1837710084	HLGPDPLLLNGQOS-QFIPXVFZSA-N	449.624	1.631	50	20	IDGD	
Cc1ncsc1C(=O)N1CCOC[C@@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1837712036	BYQXQMZRAVPMOQ-GOSISDBHSA-N	427.599	1.373	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cn4ccccc4n3)C2)C1	1837713146	JOOCNJBFSPLCOE-NRFANRHFSA-N	446.580	1.256	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccn(C(F)F)c3=O)CCO2)C1	1837772114	LJXADDYIPZHNGZ-KUHUBIRLSA-N	447.866	1.331	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(F)n3)CCO2)C1	1837908042	PFTLBAAJKXJMQF-QZTJIDSGSA-N	434.295	1.527	50	20	IDGD	
Cn1ccc(=O)cc1C(=O)N1CCC(OC2CCN(C(=O)CO[Si](C)(C)C)CC2)CC1	1838429634	JDRCVJQIBMEXBF-UHFFFAOYSA-N	449.624	1.849	50	20	IDGD	
CSCC[C@H](O)C(=O)N1CCC(OC2CCN(C(=O)CO[Si](C)(C)C)CC2)CC1	1838431974	HHOABLUMIXDWHY-SFHVURJKSA-N	446.686	1.951	50	20	IDGD	
O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)c1ccoc1Cl)CCO2	1838843068	KZTCNCCLYDSRCY-MRXNPFEDSA-N	435.702	1.788	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(Cl)cnc3O)C2)C1	1839141893	WOKLVWMVVNATPJ-KDOFPFPSSA-N	432.304	1.528	50	20	IDGD	
O=C(C[C@@H]1CCCCO1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839198990	PSNRINWWYJHEQC-QRTARXTBSA-N	437.306	1.093	50	20	IDGD	
O=C(c1n[nH]c2cccc(F)c12)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1839598365	FZELCICECXXUOK-MAUKXSAKSA-N	428.823	1.306	50	20	IDGD	
COc1ccc(/C=C/C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)c(F)c1	1840074896	CSBQKORTYIESQV-BEBWJMSYSA-N	444.862	1.838	50	20	IDGD	
COc1cc(F)cc(/C=C/C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)c1	1840084796	HDERDVJLVUXGQN-SSRQLLPTSA-N	444.862	1.838	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3ccc(C)s3)C2)C1	1840151300	YCUHOJITBCOXLB-PXNSSMCTSA-N	444.981	1.699	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)Oc3ccccc3)C2)C1	1840155628	FVFMTFWVLURMQY-MDKPJZGXSA-N	440.924	1.164	50	20	IDGD	
O=C(c1c[nH]c2nccc-2c1)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840187750	UMECYDRTCUMLKM-SFHVURJKSA-N	427.288	1.388	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC2(CCCN2C(=O)c2cccc(S(C)(=O)=O)c2)C1	1841171148	RLAKVNXFMBDTQD-ZDUSSCGKSA-N	443.363	1.938	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2ccn(C(C)(C)C)n2)C1	1842250198	BOAXQXPQIGFTPM-BUVRLJJBSA-N	439.520	1.589	50	20	IDGD	
CCOC(=O)c1ncn2c1CC[C@H](C(=O)N1CC3(CCCN3C(=O)[C@@H](Cl)CC)C1)C2	1845167108	JATODEMPTGAVDF-GJZGRUSLSA-N	436.940	1.843	50	20	IDGD	
COc1c(C)cc(C(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)cc1C	1845445547	RTZOWBMGHBVEKX-UHFFFAOYSA-N	437.500	1.441	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2cccc3ccnn23)C1	1845593488	SVXOPEYHNPQQMP-MFKUBSTISA-N	433.472	1.285	50	20	IDGD	
CC(C)(Cc1ccccc1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cnccc1C(=O)NN	1847502902	HQQHWUPDADENJO-PMACEKPBSA-N	435.528	1.769	50	20	IDGD	
Cc1nocc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1848095840	URIUGWIVZHAMFU-KKUMJFAQSA-N	426.901	1.931	50	20	IDGD	
Cc1cnoc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1848099141	CMIJBZLCWCXLKV-IHRRRGAJSA-N	426.901	1.931	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cccc1[N+](=O)[O-]	15948356	UBVWRCNNTPEUIH-UHFFFAOYSA-N	432.458	1.763	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNS(=O)(=O)c3cccc(S(N)(=O)=O)c3)cc2C1	22410655	IBFGZKWXWBLBBW-SNVBAGLBSA-N	429.545	1.144	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	96988965	QSTLFIJOAMXVMN-UHFFFAOYSA-N	434.338	1.761	50	20	IDGD	
CC(C)OCCCNC(=O)C1CCN(CC(=O)NNC(=O)c2ccccc2Cl)CC1	110914837	LYNKTJQUJCMGTH-UHFFFAOYSA-N	438.956	1.744	50	20	IDGD	
CCCn1c(C)cc(/C=C(/C#N)C(=O)OCCn2cnc3c2c(=O)n(C)c(=O)n3C)c1C	301635365	NSBXGBHHQIMXFM-BOPFTXTBSA-N	438.488	1.412	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)NCc1cccc(COCc2ccco2)c1	725872197	VLKOXZJHQDOKDP-UHFFFAOYSA-N	426.429	1.850	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@H](C)C(=O)NNC(=O)c1cccc(CS(N)(=O)=O)c1	726522353	HQSWDVOJSVTBGX-CYBMUJFWSA-N	439.921	1.974	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=S)NCCc1ccc2c(c1)OCCO2	726745257	CNZDHPZXDFNQCK-UHFFFAOYSA-N	432.458	1.483	50	20	IDGD	
CC(=O)c1cccc(S(=O)(=O)NCCC(=O)NNc2nc(-c3ccncc3)no2)c1	728072738	YXIGXLXXHWKQFH-UHFFFAOYSA-N	430.446	1.146	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)CNC(=O)c2ccccc2OC)c1	728612288	PMSJQSXWUBYITI-UHFFFAOYSA-N	436.262	1.657	50	20	IDGD	
O=C(Cc1cc[nH]n1)NNC(=O)c1ccccc1NS(=O)(=O)c1ccc(Cl)cc1	730102853	RPHOJVYEXQHWPG-UHFFFAOYSA-N	433.877	1.868	50	20	IDGD	
Cn1nc(SCC(=O)NN=Cc2c(-c3ccccc3)nc3ccccn23)c(=O)n(C)c1=O	730570306	GWVVQHFOGOSITI-UHFFFAOYSA-N	449.496	1.036	50	20	IDGD	
CC(=NNC(=O)[C@H]1CCS(=O)(=O)C1)c1ccc(S(=O)(=O)N2CCCCC2)cc1	730576391	QOPRVAKDNARMPF-INIZCTEOSA-N	427.548	1.136	50	20	IDGD	
COc1ccnc(NNC(=O)NCCCC(=O)N2CCc3cc(OC)c(OC)cc3C2)n1	731119462	SHOQZOOCUVVLCX-UHFFFAOYSA-N	444.492	1.494	50	20	IDGD	
O=C(NNS(=O)(=O)C[C@H]1CCCO1)c1ccccc1NS(=O)(=O)c1cccs1	731902360	NSPDHKGRCYMOQY-GFCCVEGCSA-N	445.544	1.292	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)[C@H]2CC(=O)N(c3cccc4ccccc34)C2)C[C@@H](C)O1	732259428	DLQROHBCTHQMMX-LMMKCTJWSA-N	438.528	1.839	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)CNC(=O)c1ccc(Br)s1	732303284	GDKMGYWFFIYTSF-UHFFFAOYSA-N	432.321	1.787	50	20	IDGD	
O=C(CNC(=O)NCc1ccc(Cl)cc1)NNC(=O)c1cnn(-c2ccccc2)c1	733169984	LOWAEIVPFWGMTG-UHFFFAOYSA-N	426.864	1.786	50	20	IDGD	
O=C(NNC(=O)N1CCC(C(=O)NCC(F)(F)F)CC1)c1cnn(-c2ccccc2)c1	733347857	CHTLPICCKYMMFP-UHFFFAOYSA-N	438.410	1.617	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)CN2CC(=O)Nc3ccccc32)cc1C	736825482	MGDQOSNYZOYYRI-UHFFFAOYSA-N	430.486	1.382	50	20	IDGD	
CN(C)[C@@H](C(=O)NNC(=O)c1csc(N2CCOCC2)n1)c1c(F)cccc1Cl	740740092	OAPOJHGYLIKKJI-OAHLLOKOSA-N	441.916	1.836	50	20	IDGD	
COc1ccccc1-c1nn(C)cc1C(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	740813700	RDNXZPYLCFGTMG-UHFFFAOYSA-N	432.440	1.417	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)c2ccc(S(=O)(=O)CC(=O)N(C)C)cc2)cc1C	742034019	ULORTOVSAPKSPN-UHFFFAOYSA-N	447.513	1.005	50	20	IDGD	
O=C(NNC(=O)[C@H](c1ccccc1F)N1CCOCC1)C1CCN(c2ncccn2)CC1	742635390	NCELTTACCCQHHA-IBGZPJMESA-N	442.495	1.053	50	20	IDGD	
C[C@@H]1C[C@@H](NC(=O)NNC(=O)c2cccc(Br)c2)C(=O)N1c1cnn(C)c1	743686526	JIBXYIAZLAYUQU-QMTHXVAHSA-N	435.282	1.321	50	20	IDGD	
COc1ccc(C(=O)Oc2ccc(C=NNC(=O)C(=O)NC(C)C)cc2OC)cc1OC	744812890	WEVVBLMABDQBEZ-UHFFFAOYSA-N	443.456	1.906	50	20	IDGD	
Cc1cc(N2CCCS2(=O)=O)ccc1C(=O)OCC(=O)NNC(=O)c1cccs1	745214352	SIWHOHRGENSQFW-UHFFFAOYSA-N	437.499	1.214	50	20	IDGD	
O=C(Cn1cc(C(=O)NNC(=O)c2cc(Br)c[nH]2)cn1)NC1CCCCC1	746581975	KOPRIVLHCQTWHQ-UHFFFAOYSA-N	437.298	1.497	50	20	IDGD	
NC(=O)N1CCC[C@H](C(=O)NNC(=O)[C@@H]2Cc3ccccc3CN2Cc2ccccc2)C1	747787460	QMDZORYZEDGMQU-SFTDATJTSA-N	435.528	1.552	50	20	IDGD	
Cc1nc2[nH]n(C)c(=O)c2c(C)c1CC(=O)NNc1nc(-c2ccccn2)nc2c1CCC2	748337956	AFKGGZFKSVENAX-UHFFFAOYSA-N	444.499	1.905	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)c2cc(S(=O)(=O)NC)cs2)cc1C	748914964	LSWCWZSNNIWKBX-UHFFFAOYSA-N	445.544	1.207	50	20	IDGD	
C[C@H]1CN(Cc2ccc(C(=O)NNC(=O)CNC(=O)c3cccs3)cc2)C[C@@H](C)O1	751208845	IFZMSQMTHHHAJC-GASCZTMLSA-N	430.530	1.548	50	20	IDGD	
O=C(O)CCC(=O)c1ccc(S(=O)(=O)NNC(=O)c2cccc3ncccc23)cc1	751213610	YXEDESGKZHEZTQ-UHFFFAOYSA-N	427.438	1.906	50	20	IDGD	
CC(C)OC1CCC(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)CC1	752699325	ZCSFSLBTXODOIL-UHFFFAOYSA-N	426.539	1.617	50	20	IDGD	
CN1C(=O)N[C@]2(CCC[C@@H]2CNC(=O)NNC(=O)c2ccc(Cl)cc2Cl)C1=O	753020268	PWCJMWMAYQJQOJ-XLFHBGCDSA-N	428.276	1.658	50	20	IDGD	
Cc1cc(F)ccc1S(=O)(=O)Nc1ccc(C(=O)NNC(=O)Cc2cc[nH]n2)cc1	755285014	KUCHLGRXNLFZAJ-UHFFFAOYSA-N	431.449	1.662	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)Nc2cccc(S(=O)(=O)N(C)C)c2)o1	755367119	MNZMRHYKEVAXAY-UHFFFAOYSA-N	437.522	1.838	50	20	IDGD	
COc1ccc(NC(C)=O)cc1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	755500468	IDWVOXBJUSVQNH-UHFFFAOYSA-N	449.489	1.370	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)Nc1cccc(CN2CCCC2=O)c1	755688137	ZXYHDJDNSIKSMU-UHFFFAOYSA-N	427.417	1.949	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)NNC(=O)Cn2nc(C)cc2C)cc(C(=O)OCC)c1	755842046	PVPQEFIBPHSCCN-UHFFFAOYSA-N	431.449	1.706	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)NC1CCN(S(=O)(=O)C(C)(C)C)CC1	755884429	BFRCCIKDOOOQNH-CYBMUJFWSA-N	444.529	1.516	50	20	IDGD	
CCc1c(NC(=O)C(=O)NNC(=O)c2cc(OC)cc(OC)c2)cnn1CCC(C)C	756164983	RSNMQYCSKFMRSD-UHFFFAOYSA-N	431.493	1.909	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)cc1-n1nnnc1C	756321300	SLLRBFLXTGOHPV-LLVKDONJSA-N	429.412	1.739	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN(CCCO)[C@@H]2CCc3ccccc32)cc1OC	756542393	LVHPTLKOMVWXTG-LJQANCHMSA-N	427.501	1.837	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)Nc1ccc(S(=O)(=O)NCc2ccccc2)cc1	756865950	VFQJREFJHWDNDV-UHFFFAOYSA-N	439.497	1.956	50	20	IDGD	
CCOc1ccc(C(=O)N(C)C)cc1NC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	756882744	PEVBRQOHYUBSMM-UHFFFAOYSA-N	448.501	1.657	50	20	IDGD	
CCOC(=O)C(C)(C)n1cc(NC(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)cn1	757721748	ZCDIQYBWYBEANT-UHFFFAOYSA-N	449.464	1.674	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)Nc2ccc(C)c(S(=O)(=O)NC3CC3)c2)cc1	757865529	MYBQHOAPJQEPFK-UHFFFAOYSA-N	432.502	1.976	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)c1nccs1	758724953	RUXCZRSJKGNXME-CYBMUJFWSA-N	437.547	1.675	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)N[C@H]2CN(C(=O)OC(C)(C)C)C[C@@H]2C#N)cc1	758756312	XXFJGBGINPROLO-BBRMVZONSA-N	431.497	1.847	50	20	IDGD	
C[C@H](NC(=O)OC(C)(C)C)[C@H]1CCCN(C(=O)NNC(=O)CNC(=O)c2ccco2)C1	758861791	OCKQJDOUNGMDOX-KBPBESRZSA-N	437.497	1.375	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)[C@@H]2CC(=O)N(CCOc3ccccc3Cl)C2)nc1	759738131	MVDIFFKNZGRULR-CQSZACIVSA-N	432.864	1.892	50	20	IDGD	
NC(=O)[C@@H]1CC[C@@H](CNC(=O)NNC(=O)Nc2ccc(Br)cc2Cl)O1	759771782	DECFSUXTOLMSMS-KWQFWETISA-N	434.678	1.471	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc2c(c1)COC2)NNC(=O)c1cccc2ncccc12	759783081	HEBNTXHGSHQNLU-UHFFFAOYSA-N	426.454	1.005	50	20	IDGD	
Cc1cc(C)cc(C(=O)NCC(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)c1	763283892	UCOUXRWWCHORAJ-UHFFFAOYSA-N	447.536	1.669	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccccc2S(=O)(=O)C(C)C)cc1OC	763543899	SXJCNRMRJLWWRV-UHFFFAOYSA-N	449.485	1.286	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(N3CCCC3)c(Cl)c2)cc1	763681059	IJBBHXLALLKEQY-UHFFFAOYSA-N	441.875	1.977	50	20	IDGD	
CC(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(Br)cc2)cc1	763696675	YFSYKOSSKIWEPE-UHFFFAOYSA-N	434.246	1.817	50	20	IDGD	
C=CCNC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)cc1	763808660	OBJUOKPJALACMY-UHFFFAOYSA-N	436.428	1.031	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(Cl)c(C[S@@](C)=O)c2)cc1	763820815	JEZSODKOOZPSPD-GDLZYMKVSA-N	437.905	1.692	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccc(OC[C@@H]2CCCO2)cc1	763839230	GTHTWZKYNQODGG-SFHVURJKSA-N	431.420	1.548	50	20	IDGD	
CCN(CC)C(=O)c1ccccc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccccc1F	763849885	LVGJQJPSXHWVIK-CQSZACIVSA-N	444.463	1.861	50	20	IDGD	
CN1CCCN(c2ccc(NC(=O)C(=O)NNC(=O)Cc3c[nH]c4ccccc34)cc2)CC1	763865420	PMXUEKCONSPEMO-UHFFFAOYSA-N	448.527	1.638	50	20	IDGD	
CCOC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)Cc2c[nH]c3ccccc23)cc1	763865965	YGNSKNYKUBMNKJ-UHFFFAOYSA-N	438.440	1.438	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2c(C)cnn2[C@@H]2CCCc3ccccc32)n1	763883155	YMAFTQKQJFFCOH-LJQANCHMSA-N	449.515	1.717	50	20	IDGD	
Cc1noc(C)c1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1cccc(Br)c1	763884728	XHKAGUTZASUCGW-SNVBAGLBSA-N	425.239	1.607	50	20	IDGD	
O=C(NNC(=O)c1ccc(Br)s1)C(=O)Nc1cccnc1-n1cccn1	763939824	OHSNCXYQCFSKRR-UHFFFAOYSA-N	435.263	1.491	50	20	IDGD	
O=C(Cc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1ccc(S(=O)(=O)C(F)F)cc1	763942933	VUORRIDPIYFPCZ-UHFFFAOYSA-N	445.831	1.665	50	20	IDGD	
O=C(NNC(=O)c1cc(Cl)ccc1O)C(=O)Nc1ccc(C(=O)N2CCCC2)cc1	763978196	GAIFEIWROFTFBT-UHFFFAOYSA-N	430.848	1.681	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)nc1)C(=O)Nc1ccc(N2CCCC2=O)c(Cl)c1	764099607	BIBQSUBDNKJMTR-UHFFFAOYSA-N	436.255	1.915	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1cc(N2CCCC2=O)ccc1Cl	764132380	VHOFCMWPEXPTNS-UHFFFAOYSA-N	444.875	1.804	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1cccc(CC(=O)OC(C)(C)C)c1	764135237	DJDSUHAXFYTKMN-UHFFFAOYSA-N	441.484	1.908	50	20	IDGD	
CC(C)OCc1ccc(NC(=O)C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1	764260991	VYUZOBQJIRPQHF-UHFFFAOYSA-N	440.504	1.404	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc(Br)ccc2O)cc1[N+](=O)[O-]	764278754	XASHLFKGFNMPLV-UHFFFAOYSA-N	437.206	1.771	50	20	IDGD	
CN(C)CCc1ccc(NC(=O)C(=O)NNC(=O)c2cc(Br)ccc2O)cc1	764280712	RTMQFYAKXCWTHC-UHFFFAOYSA-N	449.305	1.659	50	20	IDGD	
COCCOC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)C(C)(C)c2ccccc2)c1	764302914	PRKZUXGNSXBUIG-UHFFFAOYSA-N	442.472	1.945	50	20	IDGD	
Cc1nc2cc(O)nn2c(C)c1CC(=O)NNc1c(F)cc(C(=O)NC2CC2)cc1F	764335606	XHIBWPPYTYRVLQ-UHFFFAOYSA-N	430.415	1.908	50	20	IDGD	
Cn1ccnc(NNC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)OC(C)(C)C)c1=O	764494737	QFKZYOXYGIIBHW-INIZCTEOSA-N	426.477	1.841	50	20	IDGD	
CCn1cc(C(C)=NNC(=O)CN2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)cn1	764817829	IXRVVJUMTRHNOS-UHFFFAOYSA-N	432.550	1.058	50	20	IDGD	
CC(=NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C)c1cccc(-c2ccncc2)c1	764818778	VJSQQLISAXELPZ-UHFFFAOYSA-N	431.456	1.036	50	20	IDGD	
COc1ccc(S(=O)(=O)C(F)(F)F)cc1NC(=O)C(=O)NNC(=O)OC(C)(C)C	765389435	LVMYSFJXXMWZPK-UHFFFAOYSA-N	441.384	1.483	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)cc1	765566477	XKSGTVPCUZJWCG-UHFFFAOYSA-N	433.515	1.900	50	20	IDGD	
CN1CCO[C@H]([C@@H](NC(=O)NNC(=O)C(=O)Nc2ccccn2)c2ccc(Cl)cc2)C1	766319556	MZCLISPKCFEKBY-RDJZCZTQSA-N	446.895	1.076	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)cc1N1CCNC1=O	768288716	BWWIVTXOVYCVRM-UHFFFAOYSA-N	438.419	1.829	50	20	IDGD	
Cc1cc(Cl)cc2c1OCCCC2=NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C	768484705	PTVCCOROCQWPPG-UHFFFAOYSA-N	444.879	1.089	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)CCC(=O)N1CCC(c2ccccc2)=N1	768645544	QQGFUGNRCICZEO-UHFFFAOYSA-N	444.513	1.959	50	20	IDGD	
COc1cccc(C[C@H](C(=O)NNc2ccc(OC)cc2[N+](=O)[O-])n2nnnc2C)c1	769313505	ZDEYDNWVOWBERT-GOSISDBHSA-N	427.421	1.834	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2ccc(O)c(C(=O)NNC(=O)c3ccoc3)c2)cc1	769741750	MALKOLVAHOMSGS-UHFFFAOYSA-N	431.426	1.869	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)[C@@H]1CCN(C(=O)OCc2ccccc2)C1	770080796	RCTJQUHGGVDSHW-VQIMIIECSA-N	425.441	1.633	50	20	IDGD	
CCN1CCN(c2cccc(NC(=O)C(=O)NNC(=O)c3ccc(C)cc3O)c2)CC1	770771115	HVAGWQJSVYXQSE-UHFFFAOYSA-N	425.489	1.242	50	20	IDGD	
CCOc1ccccc1C(=O)N1CCC[C@@H]1C(=O)NNc1nc(O)c2cnn(C)c2n1	770981509	ZDSCYCFSUVHNAD-CQSZACIVSA-N	425.449	1.216	50	20	IDGD	
C[C@@H](CCN1CCN(C)CC1)NC(=O)CCC(=O)C(C#N)=C1N(C)c2ccccc2N1C	771656669	FSDHZLQAIQWJLO-SFHVURJKSA-N	438.576	1.799	50	20	IDGD	
COCCOc1cccc(CC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)c1	772047961	SOHQMEGBMJXKNQ-UHFFFAOYSA-N	449.529	1.031	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)[C@@H]3CCCCO3)c2)cc1	772220744	ZPJCKIPGTFKOQW-SFHVURJKSA-N	433.486	1.826	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)CNC(=O)NCc1ccc([N+](=O)[O-])cc1	772966046	GLIRRIOGTBTPAX-LBPRGKRZSA-N	449.851	1.662	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)N[C@@H](C)CS(=O)(=O)c1ccc(C)cc1	773131311	KQSPQIZSYYKGJA-HNNXBMFYSA-N	435.502	1.575	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)COc2ccc3ccc(=O)oc3c2)C1	773411807	RQFNRJFNJWMUHJ-HNNXBMFYSA-N	445.472	1.966	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)[nH]n1)C(=O)Nc1ccc(Br)cn1	773522367	XWZFOZBJQGMPQL-UHFFFAOYSA-N	429.234	1.634	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2cc(C)n(CCCOc3ccc(F)cc3)n2)n1	773725940	CBIXBLBIFMQZMN-UHFFFAOYSA-N	443.439	1.680	50	20	IDGD	
COc1ccc(C(=O)N2CCOCC2)cc1NC(=O)C(=O)NNc1cccc(Cl)c1	773736647	PQKWKHPIFDCHFZ-UHFFFAOYSA-N	432.864	1.903	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NNC(=O)CNC(=O)c2cccc(Cl)c2)C1	774245307	KZXUTTGMZRWQJB-CQSZACIVSA-N	438.912	1.864	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)NC[C@@H]2CC[C@H](C(=O)N(C)C)O2)c(C)n1C[C@H]1CCCO1	775213553	VKLNAOOHMQIJRZ-NNQJHPCXSA-N	428.533	1.943	50	20	IDGD	
Cc1cc(CNC(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)ccc1S(N)(=O)=O	775226123	QMFGJMKLNQJILX-OAHLLOKOSA-N	434.518	1.557	50	20	IDGD	
CC(C)(C)C(=O)N1CCC[C@@H](C(=O)N2CCN(S(=O)(=O)CBr)CC2)C1	777777974	VHLDFBXCSHQXDA-CYBMUJFWSA-N	438.388	1.098	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)c1cccc(F)c1I	778436164	DDFWUGHZZGYRTC-UHFFFAOYSA-N	437.209	1.716	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1ccnn1Cc1cccc(Cl)c1Cl	779462752	SBQCMXBZELHVSM-VIFPVBQESA-N	449.320	1.329	50	20	IDGD	
COC(=O)c1ccccc1NNC(=O)[C@H]1CCCN1S(=O)(=O)c1cccc([N+](=O)[O-])c1	780729314	CXTIVHAXTWCJAU-QGZVFWFLSA-N	448.457	1.678	50	20	IDGD	
Cc1c(NC(=O)CSCC(=O)NN=c2cc[nH]cc2)c(=O)n(-c2ccccc2)n1C	780761360	VTNMYECIIZNEAH-UHFFFAOYSA-N	426.502	1.116	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ncnc3ccsc23)cc1S(=O)(=O)N(C)C	783262801	PUCWJSABMSDOMI-UHFFFAOYSA-N	434.503	1.332	50	20	IDGD	
CS(=O)(=O)N1CCc2c(NC(=O)C(=O)NNc3ccc(OC(F)F)cc3)cccc21	784318948	OZWJRVIABJRJGJ-UHFFFAOYSA-N	440.428	1.692	50	20	IDGD	
CC(C)N1CCN(c2cccc(NC(=O)C(=O)NNc3ccnc(N(C)C)n3)c2)CC1	784969975	DPRHFJQGTUIPTL-UHFFFAOYSA-N	426.525	1.155	50	20	IDGD	
COCCOc1ccc(C(F)(F)F)cc1NC(=O)C(=O)NNc1ccnc(N(C)C)n1	784970319	UVTGCIHNFYXEOO-UHFFFAOYSA-N	442.398	1.668	50	20	IDGD	
O=C(NNc1cc(F)c(F)c(F)c1)C(=O)Nc1ccc(S(=O)(=O)N2CCCC2)cc1	785088205	IIFZHSZVFGMYJE-UHFFFAOYSA-N	442.419	1.970	50	20	IDGD	
O=C(NNc1c(F)cc(C(=O)NC2CC2)cc1F)C(=O)Nc1ccc(-n2cccn2)nc1	785100658	WUYIZOAPWVZWFA-UHFFFAOYSA-N	441.398	1.520	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1ccnc(Cl)c1I	786891080	PRMIZGDABTWRTC-ZCFIWIBFSA-N	425.610	1.442	50	20	IDGD	
COc1cc(C(=O)NNc2ccccc2S(N)(=O)=O)cc(OC)c1Br	788230468	NDQFIXNBSFRREF-UHFFFAOYSA-N	430.280	1.871	50	20	IDGD	
O=C(NNc1cccc(F)c1[N+](=O)[O-])C(=O)Nc1ccc(C(=O)NC2CCOCC2)cc1	790993595	HQRWJCZBOIMZJG-UHFFFAOYSA-N	445.407	1.725	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C1=NOC2(CCN(C(=O)OC(C)(C)C)CC2)C1	792799036	UYQRVVQGHMAAEN-UHFFFAOYSA-N	446.504	1.931	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNC(=O)C(=O)Nc1nc(C(F)(F)F)cs1	793067886	MRYMNANCMUEODN-UHFFFAOYSA-N	445.379	1.174	50	20	IDGD	
CCOC(=O)c1cc(COC)cc(S(=O)(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c1	793349307	OBBKLBQXFIYUKR-UHFFFAOYSA-N	437.430	1.541	50	20	IDGD	
COc1ccc([C@@H]2C[C@H]2NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1	793378972	QQPGXNFTEBXAPE-ZWKOTPCHSA-N	432.502	1.446	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)c3ccoc3C(C)C)CC2)cc1	795179624	FMYHVMZMSSYWMY-UHFFFAOYSA-N	448.545	1.479	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)[C@@H]1CN(Cc2ccccc2)CCC1(F)F	795956860	HRDAGXAABGYASB-HNNXBMFYSA-N	436.484	1.783	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(OC(C)C)c(C(N)=O)c2)cc1	796989238	BHHQTNONXJZNNP-UHFFFAOYSA-N	428.445	1.046	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1OC	797005690	GVLDRNBRBRSPMW-UHFFFAOYSA-N	437.412	1.067	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2cccc(-c3nnc4n3CCCCC4)c2)n1	797371059	OPOQKQVZTIPEKV-UHFFFAOYSA-N	433.472	1.775	50	20	IDGD	
Cc1ccc(N2CCOCC2)cc1NC(=O)C(=O)NNC(=O)Cc1ccc(Cl)cc1	797535590	OUHMEHNSSUOIKW-UHFFFAOYSA-N	430.892	1.814	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)Cc1ccc([Si](C)(C)C)cc1	798154112	XCHHMTOHFUIIMP-UHFFFAOYSA-N	432.622	1.837	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@H]2C(=O)NNc2c(OC)cccc2S(C)(=O)=O)cc1	798992552	JNYPEOWQLJUDHL-INIZCTEOSA-N	447.513	1.855	50	20	IDGD	
Cc1cc(O[C@H]2CCN(C)C2=O)ccc1NC(=O)C(=O)NNC(=O)c1ccc(Cl)nc1	799259396	ZVRXBKZYDNWTIO-HNNXBMFYSA-N	445.863	1.053	50	20	IDGD	
CCc1ccccc1OCCC(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	802762441	GQJMLTAUBXNQPU-UHFFFAOYSA-N	438.528	1.623	50	20	IDGD	
CCc1nnc(NC(=O)[C@H](C)[C@@H](C)NC(=O)NNC(=O)COc2ccccc2F)s1	804867409	AOFIGNQKBSJDFJ-GHMZBOCLSA-N	438.485	1.612	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)[C@H]1CS[C@H](Cc2ccccc2F)C(=O)N1	804951429	ROGGUNISLSFJAM-HUUCEWRRSA-N	427.465	1.087	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H](c2cc(C(=O)NNc3ccc(-n4ccnc4)nn3)n[nH]2)C1	804955643	UEIWXZJEOXSIKE-CYBMUJFWSA-N	439.480	1.867	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)c1ccccc1S(=O)(=O)N1CCCCC1	804957581	LVELCPMUVQFAIC-UHFFFAOYSA-N	427.490	1.594	50	20	IDGD	
Cc1cc(Cl)ccc1S(=O)(=O)NCCNC(=O)NNC(=O)c1cccc(C#N)c1	805066900	CQSJREPTHPBZMM-UHFFFAOYSA-N	435.893	1.443	50	20	IDGD	
CCOC(=O)CC(C)(C)CC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	806781766	GBKTYEJKSPOQGE-UHFFFAOYSA-N	440.566	1.435	50	20	IDGD	
Cc1cc(I)cc(NC(=O)C(=O)NNC(=O)c2c[nH]nc2C)c1	806980092	ODJHNHXVZIJSGE-UHFFFAOYSA-N	427.202	1.031	50	20	IDGD	
COC[C@@]1(C(=O)NNC(=O)Cn2cnc3ccccc32)CCN(C(=O)OC(C)(C)C)C1	809983365	HXOVNZMEFZNFMM-OAQYLSRUSA-N	431.493	1.457	50	20	IDGD	
COC[C@@]1(C(=O)NNc2ccccc2S(C)(=O)=O)CCN(C(=O)OC(C)(C)C)C1	810385558	UDZRFDXMEUKKPC-LJQANCHMSA-N	427.523	1.807	50	20	IDGD	
COC[C@]1(C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)CCN(C(=O)OC(C)(C)C)C1	810398734	OJHJVLCDNXXSQC-QFIPXVFZSA-N	443.504	1.907	50	20	IDGD	
CC(C)(C)OC(=O)NC/C=C/CNC(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	812470856	XPLFZLIFTIJQFN-BQYQJAHWSA-N	430.465	1.603	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)[C@@H]2CCCN2C(=O)Cc2ccccc2)cc1	812730613	OTZMUQXZVFXOEY-IBGZPJMESA-N	430.530	1.614	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)COc1ccccc1O)c1ccc(N2CCCNC2=O)cc1	812945104	RUAOZDDJWYVPTJ-AWEZNQCLSA-N	427.461	1.782	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)N[C@@H]2CC(=O)N(c3ccccc3F)C2)cc1C	813235906	CEZALVGOBMGFJC-OAHLLOKOSA-N	427.436	1.517	50	20	IDGD	
COC(=O)C(C)(C)c1csc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2F)n1	815570566	GWVJUJQTSRQJSA-UHFFFAOYSA-N	442.856	1.786	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)N(C)C)cc1-c1ncco1	815752586	YINVUSNWOOMCEM-UHFFFAOYSA-N	443.485	1.982	50	20	IDGD	
Cc1nc(COc2ccc(F)cc2)sc1C(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1	818028307	FDCREYAWIRJCHT-LLVKDONJSA-N	427.479	1.365	50	20	IDGD	
CCS(=O)(=O)N[C@@H](CCSC)C(=O)NNC(=O)CC12CC3CC(CC(C3)C1)C2	818823838	FFCADIHHUXAHDW-DZPQGLOJSA-N	431.624	1.801	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)NCc2ccc(C(=O)N3CC[C@H](B(O)O)C3)cc2)cc1	864234741	UZYSJKPCYANXQT-SFHVURJKSA-N	430.291	1.057	50	20	IDGD	
O=C(NNc1ncccn1)c1ccc(NS(=O)(=O)c2ccc3nc(O)[nH]c3c2)cc1	913044059	ROLDVZMXWZWYEG-UHFFFAOYSA-N	425.430	1.616	50	20	IDGD	
COC(=O)c1ccc(Cl)c(S(=O)(=O)NNC(=O)c2ccc3c(c2)OCCO3)c1	914563849	MOXNOXJSGNQUGS-UHFFFAOYSA-N	426.834	1.521	50	20	IDGD	
COc1ccc2c(c1)C[C@H](C(=O)OCC(=O)NNC(=O)c1ccc(OC)c(OC)c1)CO2	915011162	APVZXJVJPWCOOK-HNNXBMFYSA-N	444.440	1.268	50	20	IDGD	
COc1ccc2c(ccn2CC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)c1	915594157	ILVLEEBDJAMWIM-UHFFFAOYSA-N	444.513	1.426	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)[C@@H]1CCCCN1S(=O)(=O)c1cccs1	915697629	URLMBOUYEVLECL-HNNXBMFYSA-N	441.506	1.657	50	20	IDGD	
COc1cc(-n2cnnn2)c(Cl)cc1C(=O)NNC(=O)COc1ccc(C#N)cc1	916108299	RHWPOZGUGIFUSC-UHFFFAOYSA-N	427.808	1.036	50	20	IDGD	
CC(C)CN1CCC(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)CC1	916250834	ZGJMTNIUNBUMPE-UHFFFAOYSA-N	425.555	1.001	50	20	IDGD	
O=C(NN=Cc1cc2ccccc2nc1N1CCOCC1)c1ccc(-n2cnnn2)cc1	916351797	KWMMCYHBGKXWFQ-UHFFFAOYSA-N	428.456	1.811	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNS(=O)(=O)c2cc(C)c(C(=O)O)s2)cc1	917723822	NKPCGIQDOSKPKI-LLVKDONJSA-N	428.488	1.930	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)NCc1cccc(NC(=O)[C@H]2CCCO2)c1	920238734	ZSZPPGDYWHEYID-LJQANCHMSA-N	442.472	1.722	50	20	IDGD	
C[C@@H]1CN(Cc2csc(NC(=O)NNC(=O)c3ccc4c(c3)OCCO4)n2)C[C@@H](C)O1	920933454	ZZKUVVUZJWZNLV-CHWSQXEVSA-N	447.517	1.990	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)/C(=C\c2ccccc2)n2nnnc2C)c2ccccc2c1=O	933448793	KGJFDVIYTUCITN-QGOAFFKASA-N	444.455	1.171	50	20	IDGD	
COc1ccc(Cl)cc1CCNC(=O)NNC(=O)c1csc(N2CCOCC2)n1	1116047876	YZBITWVBHOHYFK-UHFFFAOYSA-N	439.925	1.828	50	20	IDGD	
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)NNC(=O)c1nnc(O)c2ccccc12	1324480130	LXKDHWKEILIUIU-UHFFFAOYSA-N	434.456	1.716	50	20	IDGD	
CC(C)C[C@H](C(=O)NNC(=O)c1n[nH]c2c1CCCC2)N1C(=O)[C@@H]2CC=CC[C@H]2C1=O	1337139588	GQSZNCSTEMPIBI-CKEIUWERSA-N	427.505	1.415	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCCCCN2CCN(c3ncccn3)CC2)cc1	1338639749	WQBVYIRPXGIIAK-UHFFFAOYSA-N	427.509	1.032	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C13CC(C1)C3)C2	1778094334	GDPIIUGMSMHEBV-HXCOPDDYSA-N	441.532	1.434	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2)C1=NO[C@@H](c2ccccc2)C1	1778788035	VKVWNVHKIPGLQU-JZJXAQOMSA-N	449.935	1.618	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)c3nc(O)n4c3CCCC4)C2)C1	1779346959	AZDUQRSGTPWLDH-MOPGFXCFSA-N	445.347	1.605	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Br)C2)c1cc(O)ccc1O	1781144362	UEQWHTCFPASLQE-IIDMSEBBSA-N	445.285	1.916	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cccc(F)c3[N+](=O)[O-])C2)C1	1781772043	ITIXOTSPTITYIX-UGSOOPFHSA-N	429.832	1.431	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)n[nH]1)C2	1781900839	ULHXUKANQBXWOT-XTQGRXLLSA-N	429.315	1.416	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc3cccn3cn1)C2	1782175372	JUPJNLJQVUKEDO-YRISNDGFSA-N	434.924	1.716	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1nccc3nc[nH]c13)C2)C(Cl)Cl	1782217684	YLCCJTQMPPDLRD-KZULUSFZSA-N	426.304	1.889	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3nsnc3NC)CCO2)C1	1783339268	QRKXVSKTRUSQAT-BONVTDFDSA-N	432.344	1.197	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cc(C)n(CC)n3)CCO2)C1	1783352761	SMLSKRCNHVYRKC-KBXCAEBGSA-N	427.343	1.828	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc(Cl)nc3)[C@H]2C1	1783380475	BEAUAZRWMBQIOC-PYJNHQTQSA-N	445.745	1.897	50	20	IDGD	
COc1c(Cl)ccnc1C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](C)Br)C2)C1	1783535576	AKGUBBLSVMRVEU-GTNSWQLSSA-N	446.729	1.971	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cccn(C(F)F)c3=O)CCO2)C1	1783539156	XXWGGALVCOWYEY-DIFFPNOSSA-N	448.264	1.470	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(C#N)cc3Cl)CCO2)C1	1783882544	ZYELIWBJAUUSMH-LPHOPBHVSA-N	426.300	1.909	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccc3cnccc3c1)CCO2	1783934573	HWDOLFRWPUTXCU-HSZRJFAPSA-N	439.516	1.051	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cccc(C#N)c1Cl)CCO2	1783934908	KUQJOHFQUYIPBR-OAQYLSRUSA-N	447.923	1.028	50	20	IDGD	
CN1Cc2ccccc2C[C@H]1C(=O)N1CCO[C@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783942384	NMVUMZVGCKTYAC-JXFKEZNVSA-N	426.344	1.677	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccn4cncc34)C[C@@H]21	1783966496	FXBZPGJMJSOCIR-DNUAJFIVSA-N	449.349	1.959	50	20	IDGD	
Cc1ccc(CCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]3C2)cc1F	1784084977	ADWFAKHXAJQDNS-DKKFBQAASA-N	426.916	1.646	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)n3ccnc3)[C@H]2C1	1784258115	SZJZRDBPOPOTJZ-YXMSTPNBSA-N	427.343	1.597	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cccc(C(=O)N(C)C)c3)C2)C1	1785285193	NLTORKOKZCIQKC-UTKZUKDTSA-N	437.924	1.086	50	20	IDGD	
Cn1ncc2c(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)CCBr)[C@H]4C3)cccc21	1786407211	QTSZYABXQAMCCZ-OWQGQXMQSA-N	449.349	1.952	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)c1snnc1C1CC1	1787737398	ZRFQAORECDSVFN-AVGNSLFASA-N	443.367	1.794	50	20	IDGD	
COC(=O)C1(C(=O)NC2(c3ccc(NC(=O)c4cccc(B(O)O)c4)cc3)CCC2)CC1	1788149320	JIVKJECBSUELLO-UHFFFAOYSA-N	436.273	1.067	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CS[C@H]3CCCCO3)[C@H]2C1	1788646311	FRARFEFRNCFENV-DNCCFGNJSA-N	434.986	1.480	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CSCc3[nH]cnc3C)C[C@@H]21	1791255543	UANZOUIHRUCPBB-MPTYRVRUSA-N	444.985	1.185	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CSCC(=O)O)[C@H]2C1	1791301244	XSXNCUKUGKNHJE-CENBSLRLSA-N	427.350	1.020	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(NC(C)=O)c3)[C@H]2C1	1792008688	JTNMEDMHQKJIOZ-WNHJNPCNSA-N	437.924	1.492	50	20	IDGD	
CCCNC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](Br)CC)C2	1793259150	BBRAJCVLAXNRAV-UMPJEAMMSA-N	432.359	1.056	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)[C@@H]1COc2ccccc2O1	1793842469	LXUYWUMKXYZFDE-DCIASYOESA-N	443.269	1.107	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Cl)C[C@H]2C[C@H]21	1796370694	KZFMWZDHUWULNS-VUFNAHJJSA-N	445.919	1.508	50	20	IDGD	
C[C@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CO[Si](C)(C)C)C2)[C@@H]1SC(=N)NC1=O	1796878549	HNAURSNUHBKNQS-AIUMHDJVSA-N	426.615	1.279	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)COc1ccccc1)C2	1796889750	FZFLOJXQWRPACK-ADDUXVCJSA-N	437.500	1.838	50	20	IDGD	
C[C@@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CO[Si](C)(C)C	1797956588	NYQILAXPNONRAT-PNBKFKSVSA-N	443.617	1.341	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COc1cccc(Cl)c1)C2)[C@@H](F)Br	1799341906	ACOOSYBARWRKGM-OXUXUCFPSA-N	449.704	1.999	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)c1cccc(C(F)(F)F)c1F	1799538211	VJWKUFOMPFBNEC-FJHTZYQYSA-N	438.805	1.647	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)NC(=O)OC(C)(C)C	1800596948	JZTZQURYVKWIAD-HNRZYHPDSA-N	434.331	1.251	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)Cn1ccnc1)C2	1800644192	MUVNWBDRGFWCKT-IBEHDNSVSA-N	427.343	1.282	50	20	IDGD	
CCSc1cccnc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](Cl)COC	1800978812	KXYHZGSJRQQFFQ-HLPPOEQASA-N	427.954	1.651	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C)=C/c1ccc(OC)cc1)C2	1800979700	VJEIKLLBJYVFTH-DPVLJBQWSA-N	436.936	1.942	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](O)CCNC(=O)OC(C)(C)C)C2	1802282532	FPKVRUVNSQCAAF-YIDVYQOGSA-N	447.960	1.154	50	20	IDGD	
COc1ncc(C(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]2c2cccnc2)cc1C	1803140331	CJVOCTNMZKJNDV-KBAYOESNSA-N	432.908	1.713	50	20	IDGD	
Cc1nc(CC(=O)NC[C@@H]2CCN(C(=O)[C@@H](C)Br)[C@H]2c2cccnc2)no1	1804496589	QIDJGANLZQWEMC-WHCBVINPSA-N	436.310	1.805	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1ccsc1	1805418970	AOHTZUSXEMGMBA-YLJYHZDGSA-N	435.314	1.456	50	20	IDGD	
O=C(CCCC(F)(F)F)N1CCCC2(CCN(C(=O)c3ccc(B(O)O)cc3)CC2)C1	1806539609	POWPJWUOSBDYOZ-UHFFFAOYSA-N	440.271	1.944	50	20	IDGD	
Cn1ccc(CC(=O)N2CC[C@H](CNC(=O)[C@@H](F)Br)[C@H]2c2cccnc2)n1	1808661246	HMIKUPPYTUCDKG-KBRIMQKVSA-N	438.301	1.754	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)c1cn2ccccc2n1	1809048459	PRRHGCDSMCMRPL-KVSKMBFKSA-N	427.892	1.649	50	20	IDGD	
CC[C@@H](C(=O)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1)N(CC)CC	1809968907	HHRNHFAFQXHWRV-NRFANRHFSA-N	443.397	1.332	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](Cl)COC)[C@H]1c1cccnc1	1810238757	ILFGTOLCDVMLOK-IWCQGFGOSA-N	439.944	1.049	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)/C=N/N2CCCCC2)[C@@H]1c1cccnc1	1813030699	FXNMKWKDFVURPX-BXXXKRRVSA-N	435.956	1.813	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1CCc2nc(NC(=O)C(C)(F)F)sc2C1	1814653394	LKUNSWVUVZZOSH-RYLVXRGGSA-N	438.460	1.844	50	20	IDGD	
Cc1noc(N)c1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](F)Br)CC2	1814910008	FPDRMPBIDXXKSX-QUBYGPBYSA-N	432.275	1.938	50	20	IDGD	
C#CCCCCC(=O)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1	1815362011	YLQPWDBGNWDBMJ-INIZCTEOSA-N	425.319	1.242	50	20	IDGD	
CNc1ccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)cc1	1817471477	OXQNJIMOPPRFGR-FQEVSTJZSA-N	447.304	1.751	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)cn1C	1817475110	KMMHNXMIZWTJCQ-LJQANCHMSA-N	435.293	1.356	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3nc4ncccn4n3)sc2C1	1818310384	NDOAZNOONUGNFV-UWVGGRQHSA-N	435.897	1.060	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](O)CCl)CC2)c1cn2ccsc2n1	1819214861	WOHZYSYEGODAIP-KWQFWETISA-N	425.923	1.678	50	20	IDGD	
C[C@@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)C(Cl)Cl)[nH]n1)N1CCN(C)CC1	1820790151	XUGHJEZTTLCWOD-JSGCOSHPSA-N	431.368	1.841	50	20	IDGD	
CS(=O)(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](F)Br)n[nH]1	1820936520	BGZICBFMDKPWGU-GXFFZTMASA-N	439.307	1.527	50	20	IDGD	
C[C@H](Br)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CN2CCNC2=N)[nH]n1	1822182872	DWMNLHSXMOUHLE-CMPLNLGQSA-N	426.319	1.025	50	20	IDGD	
CCOC(=O)N[C@H](O)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](C)Br)n[nH]1	1822188703	HVKKXDGMMWEVJB-OLUVUFQESA-N	446.302	1.250	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CN2CCCCC2=O)n[nH]1	1822303384	HCTSSKWRZOTOSZ-DZGCQCFKSA-N	425.917	1.668	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)/C=C/c2cnc[nH]2)n[nH]1	1822659712	AMZSDEJDGBDLTI-LAQIPUCWSA-N	449.475	1.151	50	20	IDGD	
O=C(N[C@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1)c1cc(O)ncn1	1822999474	SCTVDJSJMCDTAG-KGFZYKRKSA-N	430.259	1.555	50	20	IDGD	
Cc1ccn(CC(=O)N[C@@H]2CCc3nc(NC(=O)[C@@H](F)Br)sc3C2)n1	1823002964	VTYSALPUTREHBE-NOZJJQNGSA-N	430.303	1.951	50	20	IDGD	
CN1CCC(CC(=O)N2CCCC[C@@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1	1823862875	SFYAROAHGJYCSG-OAQYLSRUSA-N	449.640	1.711	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)c2coc(Cl)n2)CC1	1825536804	IWJPUJUWJYSKRD-MRXNPFEDSA-N	439.944	1.934	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCCn1ccnc1)CC2	1826008720	GCRBNELMOXQTTO-STQMWFEESA-N	425.942	1.986	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)C3CC(F)(F)C3)CCO2)C1	1829990415	CQCYJHZGERABFH-HZPDHXFCSA-N	429.291	1.724	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H](F)Br)CC1	1830378046	HPSVENLOCJBORM-IHRRRGAJSA-N	435.338	1.744	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3nc4ccccn4n3)C2)C1	1831647850	ZJKOKCFPUVPQAL-QRWLVFNGSA-N	435.912	1.207	50	20	IDGD	
Cc1csc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)c1	1831778721	GBHVKFJHEVYIER-XJKSGUPXSA-N	435.315	1.817	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1)[C@H](O)c1ccco1	1833088715	XBGHRPAPBFGZQG-CVEARBPZSA-N	446.317	1.575	50	20	IDGD	
CC(C)(C)n1ccc(C(=O)N2CCC(N3CCC(NC(=O)[C@H](O)CCl)CC3)CC2)n1	1833308067	HBLIKOUYSXOUIR-GOSISDBHSA-N	439.988	1.423	50	20	IDGD	
COc1ncc(C(=O)N2CCC(N3CCC(NC(=O)[C@H](O)CCl)CC3)CC2)cc1F	1833308651	ZIBBDEGIRJYEKN-QGZVFWFLSA-N	442.919	1.014	50	20	IDGD	
Cc1cccn2ncc(C(=O)N3CCC(N4CCC(NC(=O)[C@H](O)CCl)CC4)CC3)c12	1833312593	ZCVSEUUMJNBSQK-LJQANCHMSA-N	447.967	1.428	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)Cc3nc(C)no3)CC2)CC1	1833532416	OBNTXJQZAVATON-QGZVFWFLSA-N	425.961	1.900	50	20	IDGD	
O=C(Cc1ccc2c(c1)CCC2)NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1833717373	UYUAGRVVKGAFDV-QFIPXVFZSA-N	448.007	1.889	50	20	IDGD	
O=C(Cc1ccccc1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1834997469	CPDLIXMNVIKFBJ-WMZOPIPTSA-N	429.286	1.376	50	20	IDGD	
O=C(C#Cc1ccccc1)N1CCO[C@]2(COCCN(C(=O)CCBr)C2)C1	1835097167	TZIOYTOCIZBVOQ-FQEVSTJZSA-N	435.318	1.280	50	20	IDGD	
O=C(c1cccn2nccc12)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836719529	VUMSGOJXIIIXCA-IBGZPJMESA-N	434.924	1.546	50	20	IDGD	
C#CCO[C@H](C)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1836860746	DDLFVXLCVWOARO-CZUORRHYSA-N	433.318	1.714	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ncccc3F)C2)C1	1837715514	UVAJDRNOMLUTBL-LJQANCHMSA-N	425.533	1.142	50	20	IDGD	
Cc1ccoc1C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1	1837919451	SZKGDYJMSGABOT-UHFFFAOYSA-N	440.305	1.194	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)Cn3ccccc3=O)CC2)CC1	1837934410	IXHAQPMCSZDVDI-SFHVURJKSA-N	439.940	1.101	50	20	IDGD	
CC(C)/C=C/C(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1	1838395468	UWPOQFPNJJIZDN-ONEGZZNKSA-N	443.548	1.510	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccc(O)cn3)C2)C1	1839156205	HQKXIIDEESMADN-MOPGFXCFSA-N	446.331	1.022	50	20	IDGD	
O=C(Cc1ccsc1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839199862	XHKPRZORNXRWKS-GDBMZVCRSA-N	435.315	1.438	50	20	IDGD	
CCOC(=O)O[C@@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1839680501	JNSBRPJCWNUNKL-IFXJQAMLSA-N	434.917	1.269	50	20	IDGD	
Cc1cc(F)cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)c1	1840034830	YKKMDHKHBZFSNO-IFXJQAMLSA-N	443.313	1.988	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(Cl)c(F)c3)C2)C1	1840155069	OUVLXCYKIIDPPE-HNAYVOBHSA-N	449.306	1.803	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(F)(F)c3ccco3)C2)C1	1840156038	MLMZFOPFCMFGQL-DYVFJYSZSA-N	436.839	1.082	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(C)cc3OC)C2)C1	1840156644	ROUYMEKEMWVUFD-LAUBAEHRSA-N	440.924	1.327	50	20	IDGD	
O=C(c1cc[nH]c2nccc1-2)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840187588	LEMYBWLXLZFZMU-SFHVURJKSA-N	427.288	1.388	50	20	IDGD	
CCOC(CC(=O)N1CCO[C@@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1)OCC	1840281888	UQQWOVUAROBTFQ-FQEVSTJZSA-N	446.617	1.084	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)n1cc(C)cn1)CCO2	1840402499	FYXJDMLSLGUDPM-FUHIMQAGSA-N	426.945	1.616	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)c(O)c1	1840668975	RJCMWCPMURPZIF-OAQYLSRUSA-N	436.581	1.622	50	20	IDGD	
O=C(c1ccccc1OC(F)F)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1840744744	VDTBGDHVLNJLCZ-RDTXWAMCSA-N	436.814	1.892	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)c2csnn2)C1	1841696373	KQPPWODYBVPDNZ-UHFFFAOYSA-N	431.430	1.502	50	20	IDGD	
N#C/C(=C\c1ccc(Br)cc1)C(=O)N1CC2(CCCN2C(=O)c2nc[nH]n2)C1	1843190752	ZKEBRXSJTXJOLG-RIYZIHGNSA-N	441.289	1.991	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2ccc3c(cnn3C)c2)C1	1843796848	FBESRPDCUUTQHZ-CVKSISIWSA-N	447.499	1.524	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC2(CCCN2C(=O)/C=C/C(=O)NCc2ccco2)C1	1844344618	OAPXKEHDHNWVOU-DUMMIQTOSA-N	428.316	1.892	50	20	IDGD	
C[C@@H](C(=O)N1CC2(CCCN2C(=O)[C@H](F)Br)C1)N1CSCSC1	1845217915	CBYSKCJDTASHJL-QWRGUYRKSA-N	426.377	1.923	50	20	IDGD	
COc1cccc2c1C[C@H](C(=O)N1CCCC13CN(C(=O)CCC(=O)NN(C)C)C3)CC2	1845927518	VMVJEQZYWTVEFA-GOSISDBHSA-N	442.560	1.377	50	20	IDGD	
C=CCO[C@@H](C)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1847815108	WKVUBNGXSUQUIB-VGWMRTNUSA-N	429.945	1.911	50	20	IDGD	
O=C(NCc1ccc(NC(=O)c2ccco2)cc1)NNC(=O)c1n[nH]c(=O)c2ccccc12	11551901	VPUBWTZEUIQRSK-UHFFFAOYSA-N	446.423	1.913	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2ccc(C(=O)NNC(=O)Cc3ccc(F)cc3)cc2)C[C@H](C)O1	15528895	DISUHPAGOQWASB-GJZGRUSLSA-N	449.504	1.627	50	20	IDGD	
O=C1COc2ccc(S(=O)(=O)NNC(=O)c3ccc(Br)s3)cc2N1	24260559	GRIYXZFKHLOYJZ-UHFFFAOYSA-N	432.277	1.465	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)NNC(=O)CN1C(=O)N[C@@]2(CCc3ccccc32)C1=O	138683631	UORQUQFZNJGDKW-HSZRJFAPSA-N	431.452	1.251	50	20	IDGD	
Cc1nn(-c2ccccc2)c(C)c1CNC(=O)NNC(=O)CNC(=O)c1cccs1	725873056	JJGAGXQKBBNBMM-UHFFFAOYSA-N	426.502	1.811	50	20	IDGD	
CC(=O)N1CCN(c2ccccc2CNC(=O)NNC(=O)c2c[nH]c3ccccc23)CC1	726273286	ACTCZJASAFIWDM-UHFFFAOYSA-N	434.500	1.981	50	20	IDGD	
O=C(CCc1nc(-c2ncccn2)no1)NNC(=O)c1ccc(F)cc1Br	727730510	FYOODNPCSZPDCX-UHFFFAOYSA-N	435.213	1.822	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN1C(=O)OCC(F)(F)F)c1nn(-c2ccccc2)cc1O	727848921	PCVJDQASCBNMAC-GFCCVEGCSA-N	441.366	1.502	50	20	IDGD	
CCOc1c(Br)cc(C(=O)N([C@H]2CCS(=O)(=O)C2)N(C)C)cc1OC	728179405	KMHPRAIOWSWVHT-LBPRGKRZSA-N	435.340	1.962	50	20	IDGD	
O=C(COC(=O)c1ccc(F)c(C(F)(F)F)c1)NNC(=O)[C@@H]1COc2ccccc2O1	728332956	NXJXWYBEESKDST-HNNXBMFYSA-N	442.321	1.989	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)CN2C(=O)c3ccccc3C2=O)c1	728528793	MRDJWLNENVZSJP-UHFFFAOYSA-N	432.230	1.515	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)NNC(=O)CCc2ccccc2O)cc1OC	730020968	VDFPTVSCUDBDSA-UHFFFAOYSA-N	436.490	1.948	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)c1c(F)ccc(S(=O)(=O)NC2CC2)c1F	731344711	DBJKJXAZEGHWLO-UHFFFAOYSA-N	427.404	1.548	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1)c1cccc([N+](=O)[O-])c1	731952911	FHYLBWKULMILAT-LBPRGKRZSA-N	433.402	1.630	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)C2CCN(C(=O)CCc3ccccc3)CC2)C[C@@H](C)O1	732263852	PITSYZZCBRUZNE-KDURUIRLSA-N	444.576	1.505	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2ncoc2-c2ccccc2)cc1OC	732578562	USAHZLMFBCAVPW-UHFFFAOYSA-N	425.397	1.977	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)NCc1ccnc(OC2CCOCC2)c1	733336613	XHEFHCKSJVZFOE-UHFFFAOYSA-N	430.461	1.557	50	20	IDGD	
CCc1cc(N2CCC[C@@H](NC(=O)NNC(=O)c3cnn(-c4ccccc4)c3)C2)ncn1	733348204	IUQSOGYDIRAUMG-GOSISDBHSA-N	434.504	1.838	50	20	IDGD	
CCOc1ccc(N(C)S(=O)(=O)c2ccc(C)c(C(=O)NNC(=O)CN(C)C)c2)cc1	733359576	KDEAVHUVNQMSPV-UHFFFAOYSA-N	448.545	1.541	50	20	IDGD	
CC(C)C(=O)Nc1cccc(F)c1C(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	734038631	OEMWCNVQDWCUKR-UHFFFAOYSA-N	446.391	1.946	50	20	IDGD	
COC(=O)COc1cccc(CNC(=O)NNC(=O)c2cc(Br)c[nH]2)c1	734518153	BPXYIHCJXXPGKU-UHFFFAOYSA-N	425.239	1.473	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1Cl)N[C@@H]1CCN(CCN2CCOCC2)C1	734686616	RHHSVDUZLGOGMD-CQSZACIVSA-N	430.336	1.344	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)CCc2nc(-c3ccco3)no2)CC1	734824564	CYCUHYIYTLOERQ-UHFFFAOYSA-N	448.480	1.992	50	20	IDGD	
C[C@H](CN1CCN(c2ccccn2)CC1)NC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	735588061	ZFSQERJCAMSUJV-OAHLLOKOSA-N	427.465	1.145	50	20	IDGD	
CC(C)(C)[C@H]1OCCC[C@@H]1CNC(=O)NNC(=O)c1csc(N2CCOCC2)n1	735677369	DZCHZMSIWRIMEA-HIFRSBDPSA-N	425.555	1.765	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)c2ccc(S(=O)(=O)NC)cc2)cc1C	736748391	ZBWVVSLUBHLDMZ-UHFFFAOYSA-N	439.515	1.145	50	20	IDGD	
O=C(CCSCc1nc(O)c2ccccc2n1)NNC(=O)[C@H]1COc2ccccc2O1	739676000	KYPKXIQMAJJYLX-QGZVFWFLSA-N	440.481	1.946	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)c1ccnc(OCC(F)(F)F)c1	741662532	RMMPOCICVWTEOO-UHFFFAOYSA-N	431.396	1.391	50	20	IDGD	
Cc1ccc([N+](=O)[O-])c(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)c1	743334389	ICDWTSWNXVOODK-UHFFFAOYSA-N	433.490	1.596	50	20	IDGD	
CCOc1c(Br)cc(C=NNC(=O)Cc2cc(O)nc(O)n2)cc1OC	743447410	HYSMPSOIBRGJTB-UHFFFAOYSA-N	425.239	1.750	50	20	IDGD	
CC(C)[C@H](C(=O)OCC(=O)NNC(=O)c1ccc(C#N)cc1)n1nnc(-c2ccccc2)n1	744847664	YISALFUMMMHOCR-LJQANCHMSA-N	447.455	1.413	50	20	IDGD	
O=C(COC(=O)[C@H](c1cccc(F)c1)N1CCOCC1)NNC(=O)c1cccc(Cl)c1	745425983	ZXXWEKWXMGQFLD-IBGZPJMESA-N	449.866	1.857	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNC(=O)N[C@@H]2CCCN(c3ccn(C)n3)C2=O)cc1	745884645	ZPJLSFITBIKGBV-GOSISDBHSA-N	442.520	1.985	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@H](C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)C1	746096976	STHMVAJNLPHOEC-JKSUJKDBSA-N	437.518	1.212	50	20	IDGD	
O=C(COc1cccc(NC(=O)c2ccco2)c1)NNC(=O)Cc1cn2ccccc2n1	746549591	BCSSNUPFKVQSFU-UHFFFAOYSA-N	433.424	1.949	50	20	IDGD	
O=C(COC(=O)c1cc(-c2ccccc2)ns1)NNC(=O)[C@H]1COc2ccccc2O1	747102864	KGKXOPWUNHQLDD-QGZVFWFLSA-N	439.449	1.954	50	20	IDGD	
CCC[C@H](C)NC(=O)[C@@H]1CCCN(CC(=O)NNC(=O)c2ccc(OC)c(OC)c2)C1	747835320	NOVXRPOSZUXAIR-DOTOQJQBSA-N	434.537	1.482	50	20	IDGD	
C[C@H](C(=O)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1)S(=O)(=O)C1CCOCC1	748521412	QLNHOTCSZKJOHJ-SNVBAGLBSA-N	444.453	1.406	50	20	IDGD	
O=C(Cn1nc(-c2ccccc2)oc1=O)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1	748521483	TZJPLNOFORNVSS-UHFFFAOYSA-N	442.375	1.940	50	20	IDGD	
CN(C)C(=O)CS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cc3ccccc3o2)cc1	749473276	CDCHGFYQTDYCID-UHFFFAOYSA-N	429.454	1.370	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(S(=O)(=O)NC2CC2)cc1)c1cc2ccccc2o1	749867440	XFIDWHLLHGRMMR-UHFFFAOYSA-N	435.483	1.497	50	20	IDGD	
CC1CCC2(CC1)NC(=O)N(NC(=O)COC(=O)/C(C#N)=C/c1ccc(O)cc1)C2=O	750660121	AGGVHTDNSZJLQM-XNTDXEJSSA-N	426.429	1.374	50	20	IDGD	
CCOCCC1(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)CC1	752687126	PMYLLKYWZLAVCA-UHFFFAOYSA-N	438.550	1.622	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)N[C@H]1CCN(Cc2ccc(C#N)cc2)C1=O	753733485	QNJOFHADIDOXQQ-KSSFIOAISA-N	439.447	1.596	50	20	IDGD	
Cc1cnccc1CCNC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	755089710	NXIZVJMZKIJJEP-UHFFFAOYSA-N	431.518	1.361	50	20	IDGD	
COc1cc(CN2CC[C@H](NC(=O)NNC(=O)COCc3ccccc3)C2)cc(OC)c1	755174499	MSADMWNGSLSRFC-IBGZPJMESA-N	442.516	1.825	50	20	IDGD	
CCN(CC)C(=O)COc1cccc(NC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1	755658494	YUVXLFBGACIGRL-IBGZPJMESA-N	442.472	1.927	50	20	IDGD	
Cc1nn([C@H]2CCS(=O)(=O)C2)c(C)c1NC(=O)NNC(=O)c1ccc(Cl)cc1O	757871890	QSVDAKIEBNEOFT-LBPRGKRZSA-N	441.897	1.685	50	20	IDGD	
Cc1ccc(-n2cc(C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)c(-c3ccccc3)n2)cc1	758046537	TZISLODFAQHNJE-OAHLLOKOSA-N	441.513	1.546	50	20	IDGD	
CC(C)COc1cccc(OCC(=O)N2CCN(S(=O)(=O)CBr)CC2)c1	758536386	UXXXQPGTTQNHNQ-UHFFFAOYSA-N	449.367	1.927	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)NCc2ccc(S(C)(=O)=O)c(Cl)c2)c1	758855476	PLIZRHPTNZKPBL-UHFFFAOYSA-N	425.894	1.961	50	20	IDGD	
CC(=O)[C@@H]1C[C@H](CC(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)C1(C)C	759956595	RNEWORFOXXEWOT-MOPGFXCFSA-N	428.533	1.233	50	20	IDGD	
O=C(Cc1cccc(I)c1)NNC(=O)c1ccc(-n2cnnn2)cc1	760295333	HAEXFBVNQSCBTQ-UHFFFAOYSA-N	448.224	1.271	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@@H](CCC(N)=O)C(=O)NNc2ccc(C#N)cc2)cc1C	760463128	ONCRKLALFFTENC-SFHVURJKSA-N	429.502	1.231	50	20	IDGD	
CC(C)(C)OC(=O)NC1(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)CC1	760689116	DXNVMPPOAREHMW-UHFFFAOYSA-N	440.522	1.208	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)N[C@H]2CCCN(c3ccccc3F)C2=O)c1	761822414	ZIOVLDMDAHATTI-KRWDZBQOSA-N	430.436	1.983	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C1=NN(c2ccc(F)cc2)[C@H](C(N)=O)C1	762360552	FODQOASWWIMMDX-HNNXBMFYSA-N	445.476	1.194	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)[C@H](C)c2cccc([N+](=O)[O-])c2)cc1OC	763406012	VCZUVQUJLHOSBR-GFCCVEGCSA-N	431.401	1.720	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1OC	763406015	VCZUVQUJLHOSBR-LBPRGKRZSA-N	431.401	1.720	50	20	IDGD	
Cc1nn(CC(F)(F)F)c(C)c1CC(=O)NNC(=O)c1csc(N2CCOCC2)n1	763458186	OAJQHGFXLMWCIV-UHFFFAOYSA-N	446.455	1.359	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)c1ccn(-c2ccccc2[N+](=O)[O-])n1	763478262	PXUGWCVCZXRBHJ-UHFFFAOYSA-N	433.384	1.747	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)Nc1c(F)cccc1Br	763572969	OXWDYQRVSWPURF-CYBMUJFWSA-N	438.209	1.514	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)Nc1ccc(F)c(Br)c1	763574633	HHWYZHBIDSPJKF-CQSZACIVSA-N	438.209	1.514	50	20	IDGD	
CCCC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)c1C	763675235	UGZPHCKZQVUQOE-UHFFFAOYSA-N	437.456	1.770	50	20	IDGD	
CCC(=O)Nc1ccc(Cl)c(NC(=O)C(=O)NNC(=O)COc2ccccc2F)c1	763678321	COVATTUSCMATKR-UHFFFAOYSA-N	436.827	1.993	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cnc(Br)c(C)c2)cc1C	763679106	GNEQDYSCPHSMCA-UHFFFAOYSA-N	435.278	1.934	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(N(C)C(C)=O)cc1	763682324	QVGDVMLTUJXAQD-UHFFFAOYSA-N	428.445	1.233	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(C(=O)N2CCCC2)cc1	763712506	TZWHZZBYXBQQJI-UHFFFAOYSA-N	438.484	1.650	50	20	IDGD	
C[C@H]1CN(c2ccccc2NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)C[C@@H](C)O1	763840340	SSMVMKDDMXWKKV-GASCZTMLSA-N	444.463	1.604	50	20	IDGD	
COC(=O)c1ccc(F)c(NC(=O)C(=O)NNC(=O)c2ccc(OC(C)C)c(OC)c2)c1	763920774	DAEGCPJIMJABNT-UHFFFAOYSA-N	447.419	1.808	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)C(=O)Nc1cccc(CC(F)(F)F)c1	763921261	KXNQYXVCICLPRT-UHFFFAOYSA-N	433.350	1.167	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(CCN(C)C)cc2)ccc1OC(C)C	763922131	SJKRGVWKTXRGSS-UHFFFAOYSA-N	442.516	1.986	50	20	IDGD	
Cc1ccc(C(=O)NC2CC2)cc1NC(=O)C(=O)NNC(=O)Cc1ccc(Cl)cc1	763932031	NQCGCONQRYXUKW-UHFFFAOYSA-N	428.876	1.869	50	20	IDGD	
CNC(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CC[C@@H](C)C3)cc1	763943790	UPGRUBSOXOUZEP-GFCCVEGCSA-N	428.514	1.561	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)C(=O)Nc1ccc(N2CCCC2=O)cc1	763943992	JLEZJYQCAMAJSH-UHFFFAOYSA-N	448.439	1.104	50	20	IDGD	
Cc1nnnn1-c1cccc(NC(=O)C(=O)NNC(=O)c2cccc(Br)c2)c1	764059300	RFQNENPBIUMPIV-UHFFFAOYSA-N	444.249	1.133	50	20	IDGD	
Cc1cnn(Cc2cc(F)ccc2F)c1NC(=O)C(=O)NNC(=O)Cc1cccnc1	764268392	LNRUEVPEZVZRHN-UHFFFAOYSA-N	428.399	1.242	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C(=O)Nc1nn(-c2ccc(C#N)cn2)cc1C)c1ccccc1	764331417	CTZWXTJWARLJIM-KRWDZBQOSA-N	431.456	1.727	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)CCCc3cccs3)cn2)C[C@@H](C)O1	764342520	ZPZLXZWRHDIOTQ-GASCZTMLSA-N	445.545	1.866	50	20	IDGD	
CCOC(=O)N1[C@@H](C(=O)NNC(=O)CNC(=O)c2cccnc2)CC[C@@H]1c1ccc(C)o1	764345176	OQWJUWRVAJFWDL-HZPDHXFCSA-N	443.460	1.222	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)C(=O)Nc1ccnn1Cc1ccccc1	764350732	JRELMTMJDRCDDT-UHFFFAOYSA-N	429.440	1.517	50	20	IDGD	
Cc1ccccc1-n1nccc1NC(=O)C(=O)NNC(=O)c1cnn(-c2ccccc2)c1	764351077	OLAVIKRINOFKHS-UHFFFAOYSA-N	429.440	1.766	50	20	IDGD	
COCCOc1ccc(C#N)cc1NC(=O)C(=O)NNC(=O)c1cnn(-c2ccccc2)c1	764351228	POJPMAHTGNVKMW-UHFFFAOYSA-N	448.439	1.169	50	20	IDGD	
CCCN1C(=O)CCc2cc(NC(=O)C(=O)NNC(=O)COCc3ccccc3)ccc21	764366699	PCNWKWWFYOLTAP-UHFFFAOYSA-N	438.484	1.679	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)C(=O)Nc1ccnn1Cc1ccccc1F	764400014	DMWDEWZNNIIMKL-UHFFFAOYSA-N	443.460	1.654	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3ccc4c(c3)CCCC(=O)N4)CC2)cc1	766649730	STCBZNIHEMIJCQ-UHFFFAOYSA-N	449.555	1.849	50	20	IDGD	
CCCC(=O)N1CCC[C@@H]1C(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	766660636	QCLMHVFENJBBHQ-LJQANCHMSA-N	449.983	1.396	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)c1cc(N2CCNC2=O)ccc1Cl	767377663	VNYPQZXHZNERHU-UHFFFAOYSA-N	444.875	1.725	50	20	IDGD	
CC(C)[C@H](NC(=O)OC(C)(C)C)C(=O)NCC(=O)NNC(=O)c1cccc(Cl)c1	768269943	YUSMQRCQCJKKPW-HNNXBMFYSA-N	426.901	1.767	50	20	IDGD	
CS(=O)(=O)Nc1ccc(O)c(C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)c1	768289174	QTFIMKADVALVOU-UHFFFAOYSA-N	433.421	1.368	50	20	IDGD	
CCn1c(SCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)nnc1-c1cccnc1	768408027	XCXDEZHZHVSHGR-UHFFFAOYSA-N	427.446	1.822	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)CCC(=O)N1CC(=O)Nc2ccccc21	768646040	XJPLQLCRYPSEMT-UHFFFAOYSA-N	446.485	1.307	50	20	IDGD	
CC(C)Cn1ncc(C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c1C1CC1	768649682	VOAUHLBAFULZKM-UHFFFAOYSA-N	429.433	1.943	50	20	IDGD	
CC(C)c1nccnc1NNC(=O)Nc1ccc(NC(=O)CCN2C(=O)CNC2=O)cc1	770725411	YYNXMSBORCYJQU-UHFFFAOYSA-N	440.464	1.629	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)c3csc(O)n3)c2)cc1	771605614	KWNFKXOWXZQULN-UHFFFAOYSA-N	448.482	1.733	50	20	IDGD	
Cc1noc(C)c1S(=O)(=O)NCC(=O)NNC(=O)c1cc2c(s1)CCCCC2	771789052	OMIZXEJPCHICJW-UHFFFAOYSA-N	426.520	1.361	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)Cn1cnc2scc(-c3cccs3)c2c1=O	771902941	OHAYIKZHJBDCSZ-JTQLQIEISA-N	434.499	1.676	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1cc(Br)cc(Br)c1N	771967222	RQLLXWVFJWQVOK-LURJTMIESA-N	437.088	1.897	50	20	IDGD	
COC(=O)c1ccc(C(=O)OCC(=O)NNC(=O)c2ccc(OC)c(OC)c2)c(F)c1	772552205	XMFQAYAIVLOVJZ-UHFFFAOYSA-N	434.376	1.248	50	20	IDGD	
CON(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)c1	772965139	BXMBXWWOTMHSDE-LBPRGKRZSA-N	441.893	1.750	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2cnc(Oc3ccccc3)cn2)ccc1Cl	773189842	ZOBAODFOGPKKEA-UHFFFAOYSA-N	447.860	1.645	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)NNC(=O)[C@H]2CCCN(C(=O)OC(C)(C)C)C2)cc(C#N)n1C	773412478	WBKGGCCMTIRRAO-MBBOSUJBSA-N	440.504	1.907	50	20	IDGD	
NC(=O)C1CCN(c2ccc(NC(=O)C(=O)NNc3ccccc3[N+](=O)[O-])cc2)CC1	773648879	VTKQQHIKBWAEFH-UHFFFAOYSA-N	426.433	1.378	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1N1CCOCC1	776193310	HMQBKZVREGYEQV-UHFFFAOYSA-N	437.453	1.107	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)[C@H]1CCCN(c2ncnc3sccc23)C1	778433231	GTOKVUZGZLDEFY-LBPRGKRZSA-N	434.522	1.580	50	20	IDGD	
COc1ccccc1C(=O)NNS(=O)(=O)c1ccc(S(=O)(=O)C(F)(F)F)cc1	780390093	OTIWSMPGNBPIBO-UHFFFAOYSA-N	438.405	1.612	50	20	IDGD	
CC(C)(C)OC(=O)NCCCCC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	781689850	QQGWRQMQUCPJCO-UHFFFAOYSA-N	428.511	1.938	50	20	IDGD	
O=C(NNc1ncncc1Cl)c1ccc(Cl)c(S(=O)(=O)NC[C@H]2CCCO2)c1	781824493	SLNVPCXUCDIQFU-LLVKDONJSA-N	446.316	1.998	50	20	IDGD	
COCCCOc1cccc(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)c1	782887320	SMCYGEPPTSHFKJ-UHFFFAOYSA-N	439.472	1.317	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1cnccc1-c1cccc(F)c1	784004314	WAAJORYZAAJAJX-UHFFFAOYSA-N	441.444	1.465	50	20	IDGD	
CCNC(=O)N(C)NC(=O)C(=O)Nc1cc(C)nn1[C@H]1CCN(Cc2ccccc2)C1	784915926	JWYCIOIFCGCRQZ-KRWDZBQOSA-N	427.509	1.270	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2ccc(Cl)c(C[S@@](C)=O)c2)n1	785225105	CXUJBJNCENJJOU-GDLZYMKVSA-N	438.941	1.937	50	20	IDGD	
Cc1nc(-c2ncccn2)nc(O)c1CC(=O)NNC(=O)NCc1ccc(Cl)cc1	787426580	OUYVDXBUZMISHA-UHFFFAOYSA-N	427.852	1.674	50	20	IDGD	
COc1ccc2c(C)c(CCC(=O)NNc3ccccc3S(N)(=O)=O)c(=O)oc2c1	788223795	NRTRBRGVTQQGOD-UHFFFAOYSA-N	431.470	1.833	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)C(=O)Nc2cccc3ccn(C)c23)c2ccccc2c1=O	788330573	JBUCXXPNBAXCOB-UHFFFAOYSA-N	446.467	1.869	50	20	IDGD	
COc1cc(NNC(=O)C(=O)Nc2ccc(C(=O)N3CCOCC3)cc2)ccc1Cl	789798804	RUXITWBJAAOIAY-UHFFFAOYSA-N	432.864	1.903	50	20	IDGD	
Cn1ccnc1-c1csc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)n1	789810902	SVOQQBJRYITNFD-ZFWWWQNUSA-N	440.485	1.202	50	20	IDGD	
COC(=O)CCc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)cc1	789814088	ZYBGQCWSPDMFJC-ICSRJNTNSA-N	439.468	1.451	50	20	IDGD	
CCOC(=O)C1(CC(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)CCC1	789850820	XHDDHTWZSMUFAY-UHFFFAOYSA-N	426.514	1.746	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)[C@@H]2CC(c3cccnc3)=NO2)c2ccccc2c1=O	790119664	SZRQXCFTEHLMIE-IBGZPJMESA-N	448.483	1.936	50	20	IDGD	
Cc1ccc(CN2CC[C@H](NC(=O)NNC(=O)COc3ccccc3[N+](=O)[O-])C2=O)cc1	790696374	IDGBENJQGJAREF-INIZCTEOSA-N	441.444	1.414	50	20	IDGD	
O=C(NCCCCn1cc(Br)cn1)NNC(=O)c1nnc(O)c2ccccc12	792223752	FLFNXDJYZGRSMT-UHFFFAOYSA-N	448.281	1.719	50	20	IDGD	
CC(=NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1)c1ccc(C(=O)N(C)C)cc1	792917938	SUXWQRLDZCDZDY-UHFFFAOYSA-N	430.530	1.858	50	20	IDGD	
CC(C)Oc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(COc3ccccc3)o2)nn1	793022066	OKPDVEMOYPWRIA-UHFFFAOYSA-N	439.428	1.836	50	20	IDGD	
C[C@@H](C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1)c1ccc2c(c1)OCO2	795922702	PAFRZQJFFKPEQN-XIKOKIGWSA-N	428.397	1.049	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc([N+](=O)[O-])cc(Cl)c1F)c1ccc2c(c1)OCCO2	798247545	RNTFROVKRHWQNK-UHFFFAOYSA-N	431.785	1.782	50	20	IDGD	
Cc1cc(CNC(=O)NN[C@@]2(C)CCS(=O)(=O)C2)ccc1I	798476876	BSYJIPFZVOWQLB-AWEZNQCLSA-N	437.303	1.481	50	20	IDGD	
CCn1ncc(NC(=O)C(=O)NNC(=O)c2cc(OC)cc(OC)c2)c1C(F)(F)F	799258016	YBKZSTCQDRNSRP-UHFFFAOYSA-N	429.355	1.339	50	20	IDGD	
CNC(=O)CNC(=O)c1cccc(NC(=O)C(=O)NNc2ccccc2C(F)(F)F)c1	800623853	CIGZYLOYEVCJQQ-UHFFFAOYSA-N	437.378	1.263	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N=c2cc[nH]cc2)cc1S(=O)(=O)Cc1cc(C)no1	802029027	KHXAHOGJUQPYPQ-UHFFFAOYSA-N	445.457	1.249	50	20	IDGD	
C[C@H](C(=O)NNC(=O)Nc1ccc(OC(F)F)cc1)N1C(=O)NC2(CCCC2)C1=O	802044587	VZAKZRQXVSZUID-SNVBAGLBSA-N	425.392	1.694	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)CCS(=O)(=O)c2ccc(OC)c(OC)c2)cc1	802056574	UGJINNWAUPUCDJ-UHFFFAOYSA-N	437.474	1.729	50	20	IDGD	
CCC(C)(C)[C@@H]1CCc2nc(NC(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)sc2C1	806753109	OQLVVSNAWZOGFW-WDEREUQCSA-N	431.584	1.775	50	20	IDGD	
CCOc1cc(Br)c(F)cc1NC(=O)C(=O)NNC(=O)c1cnccn1	810384228	HKPBRYSLVAFBHK-UHFFFAOYSA-N	426.202	1.177	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)CCCn1c(C)cc(=O)cc1C	811355993	WPHCLBIJJSYKBS-UHFFFAOYSA-N	449.891	1.912	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)c2c[nH]nc2-c2ccc3c(c2)OCO3)cc1	812730538	MKHUPVJXYGOVEW-UHFFFAOYSA-N	429.458	1.813	50	20	IDGD	
CCCc1nnc(SCC(=O)NNC(=O)NCc2cccc(C(F)(F)F)c2)n1N	813425701	QBRPXDANNITMOM-UHFFFAOYSA-N	431.444	1.586	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)C(C)(C)c2ccc3c(c2)OCO3)cc1	814100144	DLXWNQNRPUKYMU-UHFFFAOYSA-N	447.513	1.469	50	20	IDGD	
CCNC(=O)NNC(=O)c1cn(C)nc1[C@@H]1CCCN(C(=O)OCc2ccccc2)C1	814627228	WXMPDQIRRRWYSH-MRXNPFEDSA-N	428.493	1.900	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)cc1)[C@H]1C[C@H]1C	815565940	FINJGSSHDWENKK-YJYMSZOUSA-N	442.447	1.752	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2ccoc2)nnn1Cc1ccc(C(F)(F)F)cc1	815568734	RVSKRBUYUJELES-UHFFFAOYSA-N	436.350	1.646	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1cn(Cc2ccccc2)nn1	815626218	YXSODEMRTARIQU-ZDUSSCGKSA-N	442.863	1.533	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCc2nncn2C1)C(=O)Nc1ccc(N2CCCCC2)c(Cl)c1	815692346	OXIYLGWPKWWGRR-ZDUSSCGKSA-N	445.911	1.270	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1ccnc(-c2ncc[nH]2)c1	815734433	GAFYWHAYLUZJIX-UHFFFAOYSA-N	428.474	1.250	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1ccc(C(F)(F)F)cn1	815752433	RXCLKVVIIMLFCK-UHFFFAOYSA-N	431.396	1.433	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)CN1C(=O)COc2ccc(Cl)cc21	818029683	CAXGFJSQCUQLGW-UHFFFAOYSA-N	441.875	1.825	50	20	IDGD	
Cc1ccc(NC(=S)NNC(=O)Cn2cc(Br)c(O)nc2=O)cc1C	836475100	RIVAIGZRHYREON-UHFFFAOYSA-N	426.296	1.346	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)[C@H]2CCCCN2S(=O)(=O)c2ccccc2)cc1	864017034	KCNOWXIVGNOWIH-LJQANCHMSA-N	442.497	1.328	50	20	IDGD	
O=S(=O)(c1ccc(N2CC[C@H](B(O)O)C2)nc1)N1CCC(Cc2ccccc2)CC1	864233948	NNEWTFITMMGFFB-IBGZPJMESA-N	429.351	1.778	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)[C@H]2CS[C@@H](Cc3ccccc3F)C(=O)N2)c1	888346185	BFHTVWMUABJAKU-MOPGFXCFSA-N	445.516	1.812	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@H]2CC(=O)N(c3ccc(F)c([N+](=O)[O-])c3)C2)cc1OC	913120937	SFVVXWZGCGAHQV-LBPRGKRZSA-N	446.391	1.565	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1cccnc1N1CCOCC1	913278043	ZFBMQNGBSDIPMT-UHFFFAOYSA-N	448.863	1.198	50	20	IDGD	
Cc1cc(C)cc(C(=O)NCC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c1	913392076	VEBKSKWRRZZCQH-UHFFFAOYSA-N	437.544	1.393	50	20	IDGD	
COc1ccc2c(c1)C[C@H](C(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)CO2	915014947	PTVCMGPDISOUHD-AWEZNQCLSA-N	429.385	1.159	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)c1	915165836	PZUXYQYGIVJADC-HNNXBMFYSA-N	435.527	1.608	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NC[C@@H](c2ccccc2)N2CCCC2)c2ccccc2c1=O	915878678	USNIOXRCESYFHE-IBGZPJMESA-N	434.500	1.715	50	20	IDGD	
Cc1csc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)n1	916232449	HPDHEIWLPCRKJT-UHFFFAOYSA-N	437.547	1.770	50	20	IDGD	
O=C(NNC(=O)c1cc2c(cc1O)OCO2)c1cccc(S(=O)(=O)N2CCCCC2)c1	916726653	RUHNPECASXKWKU-UHFFFAOYSA-N	447.469	1.370	50	20	IDGD	
O=C(Cc1ccc(Cl)cc1)NNC(=O)c1ccc2c(c1)S(=O)(=O)N(C1CC1)C2=O	916746715	YYOBMMFZVOORLF-UHFFFAOYSA-N	433.873	1.651	50	20	IDGD	
C[C@@H](C(=O)Nc1cccc(F)c1)N1CCN(CC(=O)NNC(=O)c2ccc(F)cc2)CC1	917124115	GMMQQQFWAFPOGV-HNNXBMFYSA-N	445.470	1.371	50	20	IDGD	
Cc1ccc(S(=O)(=O)Oc2ccc(S(=O)(=O)NNC(=O)c3ccc[nH]3)cc2)cc1	917730675	NEXRIDCNMINGHE-UHFFFAOYSA-N	435.483	1.714	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)CN2C(=O)COc3ccc([N+](=O)[O-])cc32)cc1	919834160	QJYCOFXDWLYRTH-UHFFFAOYSA-N	428.401	1.109	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)Nc1nc(CN2C[C@H](C)O[C@@H](C)C2)cs1	920930482	KEUJNNFAPHQPCI-KBPBESRZSA-N	449.533	1.993	50	20	IDGD	
C[C@@H](CNC(=O)OC(C)(C)C)NC(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1	1343642857	FDXGEMNEKWHIGT-ZDUSSCGKSA-N	443.545	1.877	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2cc(-c3ccco3)nn2C)c1	1343884085	HDRNQVYTDWJOMB-UHFFFAOYSA-N	432.462	1.397	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc3n[nH]cc3c2)C1	1777863706	JCUCCANFLCYNJX-YRISNDGFSA-N	434.924	1.944	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(Cl)Cl)C2)c1cccn2c(O)nnc12	1777959822	TUFVSXKMUGLTET-KZULUSFZSA-N	442.303	1.366	50	20	IDGD	
Cc1cnc2c(C(=O)N3CC[C@]4(C3)CN(C(=O)[C@H](F)Br)CCO4)cnn2c1	1778526049	IASJZIRRVGNEIW-GUYCJALGSA-N	440.273	1.172	50	20	IDGD	
O=C(c1ccn2cncc2c1)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1778658529	QIJAMMKYDSEJID-WMLDXEAASA-N	425.258	1.468	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)C#CC3(O)CCCCC3)C2)C1	1779067685	XGSCGERIIPPEAC-BEFAXECRSA-N	427.339	1.298	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)C(C)(C)n3nc(C)ccc3=O)C2)C1	1779232074	BDTZMDXGSCTKFE-KKSFZXQISA-N	438.956	1.524	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(-n4cccn4)nc3)C2)C1	1779686989	YDNSWNABEGNVFA-NRFANRHFSA-N	431.924	1.976	50	20	IDGD	
COc1cc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)ccc1O	1780745472	CBIRZZYRNAYXDB-ORAYPTAESA-N	441.322	1.875	50	20	IDGD	
O=C(Cc1cc2cccnc2cc1F)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1781176938	DHCPPSUPYOXCBQ-WIYYLYMNSA-N	435.883	1.346	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)c3cc4cccnn4n3)CCO2)C1	1781231257	IWODCEHKQNLAOQ-MSOLQXFVSA-N	426.304	1.409	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781335493	ZXNAUAWCQHEMTL-LRDDRELGSA-N	438.294	1.032	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2)c1ccc2occc2c1O	1781336778	RHKWZBROXPCTBK-QLVMHMETSA-N	436.892	1.866	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)Br)C2	1781516992	YSYRIVVSNZBBOB-UHQDVWGKSA-N	449.342	1.845	50	20	IDGD	
CC(C)Cc1ccc(C(=O)N2CC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)cc1	1781920200	QOURAJURNNETHR-DEOSSOPVSA-N	444.576	1.702	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Br)C2	1782003849	WUGHNKPHEVXPPI-ZHSDAYTOSA-N	444.139	1.974	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cn4c(F)cccc4n3)C2)C1	1782373938	ZYYPZEKDEISVBV-SGTLLEGYSA-N	439.285	1.700	50	20	IDGD	
COc1cc(F)ccc1CC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2	1783305997	LQNPJNYRWFPHTR-YRISNDGFSA-N	442.915	1.490	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cnnc(Cl)c3)CCO2)C1	1783345201	YGZKAYZGZLKAPF-WBMJQRKESA-N	431.718	1.747	50	20	IDGD	
CCc1[nH]nc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](Br)CC)C3)C2)c1F	1783345269	YRNJCRAONJFQMR-APPDUMDISA-N	431.306	1.728	50	20	IDGD	
CCc1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](Br)CC)C3)C2)n(C)n1	1783349216	KAQQBQLGTNPLEJ-KBXCAEBGSA-N	427.343	1.600	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3c4c(nn3C)CCC4)CCO2)C1	1783353499	PCNZHCQXCAIZJB-IFXJQAMLSA-N	439.354	1.526	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)Cn3cnc4ccccc43)C2)C1	1783744488	SQAGAFWDAKBTFP-FOIQADDNSA-N	449.349	1.897	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)Cc3ccc4c(c3)CCCO4)CCO2)C1	1783876181	WJPPZNROINXQMI-XMSQKQJNSA-N	436.936	1.638	50	20	IDGD	
Cc1cc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]3C2)nn1C	1783964310	PUQOFJLAUPNACM-QCPWZWHMSA-N	441.370	1.282	50	20	IDGD	
O=C(CCC(=O)N1CCCC1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21	1785000752	DGMMBYNQEDJMIG-AYMQEEERSA-N	448.333	1.059	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3CCC(CO)CC3)[C@H]2C1	1785058735	YXFZSQXQFXWQJR-OEFHRGAISA-N	431.371	1.548	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)COc3ccccc3C#N)C2)C1	1785383674	WFJGTPYOXKHBLG-LIRRHRJNSA-N	436.306	1.550	50	20	IDGD	
O=C1CN(CC(=O)Nc2ccc(C3(NC(=O)[C@H](F)Br)CCC3)cc2)C(=O)N1	1786686428	FCBUULFSLVRRJI-AWEZNQCLSA-N	441.257	1.363	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(N4CCOCC4)cn3)C[C@@H]21)[C@H](F)Cl	1787444408	ZTEVLYPFEHDJFX-IKICRFKJSA-N	440.903	1.046	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC1(c2ccc(NC(=O)Cn3ccccc3=O)cc2)CCC1	1788183685	OVWPWZIBHQHUTJ-UHFFFAOYSA-N	439.516	1.355	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]2C1	1789925837	WEUSSOZZMKATKO-UHFZAUJKSA-N	444.139	1.830	50	20	IDGD	
CCOC(=O)O[C@@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21	1790611713	MCNPARGJWMPPFC-PJSNJIKXSA-N	439.278	1.218	50	20	IDGD	
CCOC(=O)C1(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]32)CC1	1790722130	BIBWLKXDRNNSNY-WZTLGTBRSA-N	435.348	1.546	50	20	IDGD	
C=C[C@H](O)C(C)(C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](Br)CC)[C@H]2C1	1790960677	PVAKXMIWMUPIOJ-QMHWVQJVSA-N	431.371	1.713	50	20	IDGD	
Cc1nccn1[C@@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]2C1	1791064600	APRAENZAEJHMIM-MLEONAHRSA-N	427.343	1.516	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1ccc(C2(NC(=O)[C@H](COC)NC(C)=O)CCC2)cc1	1791569385	TWRNOLANSYFGBG-IRXDYDNUSA-N	425.913	1.525	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1cnccc1C(F)(F)F)C2)[C@H](O)CCl	1792975615	RVRXRHOMGUMNPD-IARIHHJXSA-N	449.857	1.222	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CSc1ccncc1	1793949994	FEJYURKRJDDORQ-IARIHHJXSA-N	442.379	1.937	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1CCC(CO)CC1	1794109686	CCLBGFGYWOXTGD-PLKZFXCCSA-N	443.548	1.557	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cscc1C	1796577179	GXOLUTCUXMIHBZ-SNOXVSQISA-N	443.529	1.394	50	20	IDGD	
CCc1nc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)co1	1796892072	XWFCZJPMHRAFHY-JWBKOJIWSA-N	426.477	1.623	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1n[nH]c2c1CC[C@H]2C	1796973959	QTWQAWWRSBNGIT-APLFDDQLSA-N	439.354	1.836	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2)c1ccc2ncncc2c1	1797466402	OQUDULSJAMWXCB-JLVBRIDZSA-N	433.306	1.618	50	20	IDGD	
Cn1c(=O)n(C)c2cc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)C(Cl)Cl)C4)ccc21	1797504790	FVOFDLFZVGYFDZ-CLLJXQQHSA-N	425.316	1.933	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc3ccoc13)C2	1798443077	QDBPYJGFFPVKHB-MUJYYYPQSA-N	433.468	1.997	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc([N+](=O)[O-])c(OC)c1)C2	1799268184	MFJFYIJAYPMUJX-YGTYGHESSA-N	439.896	1.753	50	20	IDGD	
COc1nc(C)ccc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@](C)(Cl)CCl	1799276816	LYOBBKJPOQCBSH-FCIKYMEBSA-N	430.332	1.838	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnn2cccc(F)c12	1800125488	KDCDTGZQADZXAE-MCYUEQNJSA-N	439.285	1.460	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnn3c1CCC3)C2	1800643387	RWOHBFGXAUOMJE-LMWOUKEDSA-N	425.327	1.206	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cccc3ncccc13)C2	1800970264	ALEJSQCWAHOQCH-VWFIUDSGSA-N	431.920	1.621	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCCCCC(=O)OC	1801075002	NXBUZYKGODPEPL-BASYENTBSA-N	447.370	1.873	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)C1CC(F)(F)C1	1802633187	SFAVXNQQULYVGY-LPHOPBHVSA-N	443.259	1.126	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cccc3c[nH]nc23)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803138828	FQELDGUTMGEHPC-VDZJLULYSA-N	427.892	1.877	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccn3cncc3c2)[C@@H]1c1cccnc1)[C@H](O)CCl	1803142776	IZGXAUMNKKEIKC-QXAKKESOSA-N	427.892	1.649	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H](CNC(=O)c2ncn(C)n2)[C@H]1c1cccnc1	1805328572	JSWFTKGZNMYCIC-QLFBSQMISA-N	435.326	1.703	50	20	IDGD	
O=C(c1cnc(-c2ccccn2)nc1)N1CCC2(CCCN(C(=O)[C@@H](O)CCl)C2)CC1	1805518171	NDDNPSGRBQASCD-SFHVURJKSA-N	443.935	1.983	50	20	IDGD	
O=C(CCBr)NC[C@@H]1CCN(C(=O)c2c[nH]c(=O)cn2)[C@H]1c1cccnc1	1806344219	YIEDRQNUPCAMML-GUYCJALGSA-N	434.294	1.270	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC2(CCCN(C(=O)CCc3ccccn3)C2)CC1	1807261085	KEDNUXGVLKMPCT-UHFFFAOYSA-N	429.565	1.618	50	20	IDGD	
C=C(CC(=O)OCC)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](Cl)COC)[C@@H]1c1cccnc1	1808463153	CFPKOYNGXRXHMM-JENIJYKNSA-N	437.924	1.851	50	20	IDGD	
CC(C)=NO[C@@H](C)C(=O)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1	1809970005	YNAATGUAHWDXTC-KRWDZBQOSA-N	429.326	1.012	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H](CNC(=O)C2=NNC(=O)C2)[C@@H]1c1cccnc1	1810224176	CBHYYZMKRJUPCF-WWGRRREGSA-N	436.310	1.137	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2cc(=O)ccn2C)[C@H]1c1cccnc1	1811367002	QURABDPMTTYYTM-HHXXYDBFSA-N	432.908	1.354	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)c2ccc(O)nn2)[C@@H]1c1cccnc1	1812865620	XKVBTQOXAAZOJE-DETPVDSQSA-N	434.294	1.680	50	20	IDGD	
COC(=O)[C@@H]1CC[C@H](C(=O)Nc2cc([C@@H]3CCCCN3C(=O)[C@@H](O)CCl)[nH]n2)C1	1814859510	WMPUTYSSXQNASX-NEBZKDRISA-N	426.901	1.591	50	20	IDGD	
O=C1Nc2c(cccc2C(=O)N2CCCC[C@H]2c2cc(NC(=O)[C@@H](O)CCl)n[nH]2)C1=O	1814872297	GWJGTASMOFAKGC-KBPBESRZSA-N	445.863	1.450	50	20	IDGD	
Cc1cc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)cn1C	1815354875	WGZZCFFPGURYMC-INIZCTEOSA-N	438.318	1.009	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccoc2Cl)[nH]n1)c1ccc(B(O)O)cc1	1817472657	QEIFOAFZHHHTKG-INIZCTEOSA-N	442.668	1.956	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(F)s2)[nH]n1)c1cccc(B(O)O)c1	1817473892	FPNCGOOQEIORTM-HNNXBMFYSA-N	442.281	1.910	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1cccc(F)n1	1819735029	OCAYTOZUFBQENI-KRWDZBQOSA-N	437.240	1.243	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CC1CCC1)CC2	1819801509	MXSMZDHOGIMXLW-GFCCVEGCSA-N	428.518	1.558	50	20	IDGD	
CC[C@@H](Br)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CS(C)(=O)=O)[nH]n1	1822087813	NXGBPLRURURMCZ-ZYHUDNBSSA-N	435.344	1.620	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CC[C@H](N)C(N)=O)[nH]n1	1822088404	UPOCINVNOHUFEG-GVXVVHGQSA-N	443.346	1.168	50	20	IDGD	
O=C(CCN1CCOCC1)N[C@@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1	1823002801	GJFOZCMPDUMOBG-QMTHXVAHSA-N	449.346	1.468	50	20	IDGD	
C#CC(=O)Nc1nc2c(s1)C[C@H](NC(=O)CN(C)NC(=O)NCc1ccccc1)CC2	1825022841	UQMXJDYTDVZPHW-OAHLLOKOSA-N	440.529	1.035	50	20	IDGD	
CC[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CN1CCOC1=O)CC2	1825441017	ISKNUJLFZQGCRO-VHSXEESVSA-N	445.339	1.681	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](C)Cn1cccn1)CC2	1825994034	OLZMQQSOTJCGLA-UPJWGTAASA-N	425.942	1.842	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(F)n1)CC2	1826088082	RJILGBWICONICE-NSHDSACASA-N	434.497	1.276	50	20	IDGD	
CCO/C=C/C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1	1828925841	POBKCGMMRQAVJN-JNMQVBFRSA-N	429.521	1.469	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)c(O)n1	1830364223	CRCSIGHNHPURQX-FQEVSTJZSA-N	425.913	1.431	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccn(CCOC)n3)C2)C1	1831647877	ZTYFFZQZOVRQSW-OXQOHEQNSA-N	442.944	1.007	50	20	IDGD	
C=C(CC(=O)OCC)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](Cl)CCC)CCO2	1831653533	HNYFQALXOYSYLL-JXFKEZNVSA-N	430.929	1.360	50	20	IDGD	
COC1(CC(=O)N2CCC([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)CCC1	1831876243	BLXVNUVVIOVHJI-IBGZPJMESA-N	436.597	1.938	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H](C)n2cnnn2)CC1	1832287917	SYNFMGYZVDWUSF-YCPHGPKFSA-N	441.374	1.885	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)C3CCN(C(C)C)CC3)CCO2)C1	1832407192	AMCOQXVUSYUKBV-KNQAVFIVSA-N	444.016	1.971	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)C3CCN(C(C)C)CC3)CCO2)C1	1832407194	AMCOQXVUSYUKBV-SIKLNZKXSA-N	444.016	1.971	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnc(C)c(C)c3)CCO2)C1	1833300652	IBKICPUVXIVRFP-XLIONFOSSA-N	425.913	1.022	50	20	IDGD	
Cn1cnc(C(=O)NC2CCN(C3CCN(C(=O)CCBr)CC3)CC2)c1	1834286475	CFFABQOXWZFLAT-UHFFFAOYSA-N	426.359	1.390	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)CCN3CCOC3=O)CC2)CC1	1835455160	PRSXTXLJVFRTHK-KRWDZBQOSA-N	428.961	1.418	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)c1cc2n(n1)CCCC2	1835569799	POYGMWTWNACPOU-LJQANCHMSA-N	437.972	1.004	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cc(=O)ccn3C)CC2)CC1	1836107279	DUWPTTZKSJYZGO-IBGZPJMESA-N	436.984	1.978	50	20	IDGD	
CC(C)(C)n1cc(C(=O)N2CCC(OC3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)cn1	1836715143	KFRJWQMFTQLCKH-SFHVURJKSA-N	440.972	1.850	50	20	IDGD	
O=C(c1ncccn1)N1CCC(OC2CCN(C(=O)[C@H](F)Br)CC2)CC1	1837504010	IRBRGUBWKDMDAS-AWEZNQCLSA-N	429.290	1.779	50	20	IDGD	
CC(=O)N(C)[C@@H](C)C(=O)N1CCC(OC2CCN(C(=O)CCBr)CC2)CC1	1837653485	GBWMGYJWYCODRQ-AWEZNQCLSA-N	446.386	1.637	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3F)C2)C1	1837711357	FJTMTQBPVWSPQR-LJQANCHMSA-N	425.533	1.142	50	20	IDGD	
C=C[C@@H](O)C(C)(C)C(=O)N1CCC(OC2CCN(C(=O)[C@H](Cl)COC)CC2)CC1	1838386194	BVKCERHUDYTCQG-QZTJIDSGSA-N	430.973	1.812	50	20	IDGD	
N#Cc1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)c1Cl	1838596396	XBXJBTLSBQMMRB-YJBOKZPZSA-N	430.263	1.816	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3ccoc3)C2)C1	1839156621	WCDCKPRKHNLWBZ-MOPGFXCFSA-N	433.332	1.905	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)Cn3cnc4ccccc43)CCO2)C1	1840101140	ZCDIQXFWDFXGKL-QFIPXVFZSA-N	448.951	1.758	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(C)cnc3Cl)C2)C1	1840151259	ZCNMCXSVGBTUQV-BEFAXECRSA-N	446.331	1.367	50	20	IDGD	
CC(C)(C)OC(=O)N1CCCC[C@H]1C(=O)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1	1841351870	JTMIJNBRJKOJCV-LSDHHAIUSA-N	429.945	1.579	50	20	IDGD	
Cn1cnc(C(=O)N2CC3(CCCN3C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)c1	1841924258	PIAGWWACVOPJJE-ZDUSSCGKSA-N	425.917	1.369	50	20	IDGD	
COc1ccc(C(=O)N2CC3(CCCN3C(=O)c3ccc(B(O)O)cc3)C2)c(Cl)c1	1843012651	LIOGGHKZZBHVAP-UHFFFAOYSA-N	428.681	1.159	50	20	IDGD	
O=C([C@@H]1C[C@H]1c1ccc(F)c(F)c1)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843012749	LDDWCDYJFDNNAN-ZWKOTPCHSA-N	440.255	1.265	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@H](CC(=O)OC)NC(=O)OC(C)(C)C)C2	1845167444	COBIIULMOBSGSU-KGLIPLIRSA-N	445.944	1.664	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)c1ccncc1C(F)(F)F)C2	1846384859	RZSQKCDJZHWQTG-UHFFFAOYSA-N	427.427	1.290	50	20	IDGD	
O=C(c1n[nH]cc1I)N1CC2(CCCN2C(=O)C(Cl)Cl)C1	1846387949	CJTHDOLAKFVPBR-UHFFFAOYSA-N	443.072	1.635	50	20	IDGD	
O=C(COC(=O)CCc1nc2ccccc2c(=O)[nH]1)NNC(=O)c1ccc(Cl)cc1	8953627	CCTPTDXEBJRQNA-UHFFFAOYSA-N	428.832	1.514	50	20	IDGD	
CCCC[C@@H](NC1=NS(=O)(=O)c2ccccc21)C(=O)NNC(=O)Cc1ccc(F)cc1	14392858	RXIBLSXAIWZPID-QGZVFWFLSA-N	446.504	1.813	50	20	IDGD	
COC(=O)c1c(C)[nH]c(C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)c1C	17196386	PGSQSTSJISTQAT-UHFFFAOYSA-N	425.445	1.784	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)c2sc3nc4n(c(=O)c3c2C)CCC4)cc1	21608003	ALLJYLZYARHSTI-UHFFFAOYSA-N	440.481	1.639	50	20	IDGD	
Cc1nn(C)c2nc(C3CC3)cc(C(=O)NNC(=O)c3csc(N4CCOCC4)n3)c12	22976319	SGQRTRLNQQKWMB-UHFFFAOYSA-N	441.517	1.522	50	20	IDGD	
COC[C@H](C)NC(=O)NC(=O)COC(=O)/C(C#N)=C/c1cc(C)n(C[C@@H]2CCCO2)c1C	23581527	LRIXLLIRZKDIDA-YAEHRJIASA-N	446.504	1.595	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCc2cccnc2N2CCOCC2)cc(OC)c1OC	26386372	QYDZBLORSJRCAZ-UHFFFAOYSA-N	445.476	1.088	50	20	IDGD	
CCOc1ccccc1C(=O)NCCCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	26977217	SBXJAHZRSBOCOP-IBGZPJMESA-N	427.457	1.583	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)c3cccc(CN4C(=O)CNC4=O)c3)cc2C1	27331929	RVXIITCXXMWFFS-LBPRGKRZSA-N	426.498	2.000	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)NC1CCN(Cc2ccc(Cl)cc2)CC1	725872420	ORCXLEYHVUAXGA-UHFFFAOYSA-N	433.896	1.658	50	20	IDGD	
C[C@H](NC(=O)c1n[nH]c2ccccc12)C(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	726381888	JKLWRICJPCSMBG-LBPRGKRZSA-N	433.428	1.034	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)N2CCC(N3CCC[C@@H]3C(N)=O)CC2)c1C	726800143	GZDGJKHHWLUKIC-LUDQZLGDSA-N	427.549	1.599	50	20	IDGD	
Cc1ncc(S(=O)(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)[nH]1	727350798	VTAXREIZIBIFKP-UHFFFAOYSA-N	438.473	1.043	50	20	IDGD	
CCOc1ccc(C(=O)NCC(=O)NNc2nc(-c3cccnc3)no2)cc1OCC	728075435	BPSGYRKOECTAFT-UHFFFAOYSA-N	426.433	1.802	50	20	IDGD	
C[C@H](NC(=O)c1n[nH]c2ccccc12)C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	728211142	IEHAPPWOPPJXLI-LBPRGKRZSA-N	442.501	1.265	50	20	IDGD	
CCNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cc(F)ccc2Br)cc1	728550943	PRVPAGYDPFGPLZ-UHFFFAOYSA-N	444.282	1.961	50	20	IDGD	
CNS(=O)(=O)c1cccc([C@H](C)NC(=O)NNC(=O)c2cccc(OC(F)F)c2)c1	728755463	OEHDVSHZTHGCFD-NSHDSACASA-N	442.444	1.901	50	20	IDGD	
C#Cc1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)cn1	728855858	WASOWPYFLSWVKV-UHFFFAOYSA-N	434.477	1.616	50	20	IDGD	
CC(C)[C@H](NS(=O)(=O)c1ccc2ccccc2c1)C(=O)NNC(=O)Cc1cccnc1	728892199	QKENMCSRWUNLNA-NRFANRHFSA-N	440.525	1.928	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)NCc2ccc(CN3CCC(O)CC3)cc2)cc1	729621577	OXOAFPANMPXWRS-UHFFFAOYSA-N	437.500	1.424	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)[C@H](C(C)C)N(C)C)c2)cc1	730103891	KQVGHYDDFARCES-IBGZPJMESA-N	448.545	1.843	50	20	IDGD	
C[C@@H]1CCCN(S(=O)(=O)c2cc(C(=O)NNc3nc(-c4cccnc4)no3)n(C)c2)C1	730283997	BCQRALNMBOULQZ-CYBMUJFWSA-N	445.505	1.648	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)NCCc2c(OC)cc(OC)cc2OC)c1	731045313	BIWLOQFGSPDHEE-UHFFFAOYSA-N	433.461	1.916	50	20	IDGD	
CC(C)(C(=O)NNC(=O)c1ccc(S(=O)(=O)NC[C@H]2CCCO2)cc1)c1ccccc1	731201063	FSEAMVCPHPYJMJ-GOSISDBHSA-N	445.541	1.883	50	20	IDGD	
O=C(NCc1cccc(C(F)(F)F)c1)NNC(=O)C1CCC2(CC1)NC(=O)NC2=O	731472757	JYADZKKKOWBTFD-UHFFFAOYSA-N	427.383	1.304	50	20	IDGD	
CC(=O)N1C=Cc2ccccc2[C@@H]1CC(=O)NNC(=O)c1csc(N2CCOCC2)n1	731689518	LZBQTWHXSHSUHH-SFHVURJKSA-N	441.513	1.705	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1)c1cncc(O)c1	731865880	VRDAJFDHUFKPBB-UHFFFAOYSA-N	426.454	1.341	50	20	IDGD	
COCCN1CCC(NC(=O)NNC(=O)c2ccc(OC)c(Br)c2)CC1	732456363	OVRWTDHYWQXLGE-UHFFFAOYSA-N	429.315	1.513	50	20	IDGD	
CCN1CCC[C@@H]1CN1C[C@H](C(=O)NNc2nc3ccccc3c(=O)n2CC)CC1=O	733127767	GEZYESSJIVFSNM-HZPDHXFCSA-N	426.521	1.192	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)c2ccc3ccccc3n2)cc1C(=O)N(C)C	734414940	QUOOPXLDLJEMGK-UHFFFAOYSA-N	428.470	1.569	50	20	IDGD	
COC(=O)c1cc(Br)cc(S(=O)(=O)NNC(=O)c2ccccc2O)c1	736062523	VEWPOESAHFCYGY-UHFFFAOYSA-N	429.248	1.565	50	20	IDGD	
CCOC(=O)C(=O)N1CCN(C(=O)/C(C#N)=C/c2cc(C)n(C[C@@H]3CCCO3)c2C)CC1	736132091	RYKYGKQDYCDRMM-ACSPXDACSA-N	442.516	1.425	50	20	IDGD	
Cn1c(=O)c2ccc(C(=O)Oc3ccc([N+](=O)[O-])cc3Br)nc2n(C)c1=O	739310860	IIHLNSZACURWCJ-UHFFFAOYSA-N	435.190	1.522	50	20	IDGD	
COc1ccc(S(=O)(=O)CCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1OC	740773777	ARPPFEHAXDUEBR-UHFFFAOYSA-N	437.430	1.237	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)[C@H]2CCCN(C(=O)COc3ccccc3)C2)nc2ccccc21	741206973	HTUXFXKRSWNTHM-KRWDZBQOSA-N	449.511	1.581	50	20	IDGD	
O=C(NCc1nc(-c2ccc(F)cc2)n[nH]1)NNC(=O)C1CCN(c2ncccn2)CC1	741418214	YFDKMPQPZNHYQV-UHFFFAOYSA-N	439.455	1.148	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(CC(=O)NNC(=O)c2cccc3ccccc23)C(=O)C1	741572909	PAZSCEFVHGXZFY-UHFFFAOYSA-N	426.473	1.680	50	20	IDGD	
CC(C)(C)c1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)no1	741879980	PKOHPVTVCUDCRK-UHFFFAOYSA-N	436.490	1.068	50	20	IDGD	
Cc1nn(C)c2sc(C(=O)N[C@H](C)C(=O)NNC(=O)[C@H](C)Oc3ccc(F)cc3)cc12	742036122	FNZUVSADRXBEAT-NEPJUHHUSA-N	447.492	1.816	50	20	IDGD	
CC(C)(C)OC(=O)N(CC(=O)NNC(=O)c1cc(Br)c[nH]1)C[C@H]1CCCO1	742036501	LOSSIIYZJKNPQM-GFCCVEGCSA-N	445.314	1.954	50	20	IDGD	
O=C(CN1CCN(Cc2cn3cc(Cl)ccc3n2)CC1)NNC(=O)c1cccs1	742598070	VRDGHZAGXKDHPX-UHFFFAOYSA-N	432.937	1.628	50	20	IDGD	
Cc1nn(C)c2sc(C(=O)NNc3ncccc3S(=O)(=O)N3CCN(C)CC3)cc12	743418952	IXUSHTSCRGSMNZ-UHFFFAOYSA-N	449.562	1.031	50	20	IDGD	
O=C(NCCS(=O)(=O)NCc1ccccc1)NNC(=O)c1cccc2ccccc12	743630610	WYLPQYMGYYHQGZ-UHFFFAOYSA-N	426.498	1.903	50	20	IDGD	
C[C@H]1CN(c2ccc(C(=O)NNC(=O)Nc3ccc(S(C)(=O)=O)cc3)cn2)C[C@@H](C)O1	743830970	NUINUDCLMOTJEK-OKILXGFUSA-N	447.517	1.565	50	20	IDGD	
Cc1nn(CC(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)c(C)c1Cl	744621299	OHPYTVRLNDJGPZ-UHFFFAOYSA-N	427.914	1.318	50	20	IDGD	
C[C@]1(NNC(=O)NC[C@H](c2ccc(Cl)cc2)N2CCOCC2)CCS(=O)(=O)C1	744866701	WUFIXPCGBHIHKW-AEFFLSMTSA-N	430.958	1.094	50	20	IDGD	
CN(C)C(=O)NNC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(Br)s2)C1	746006122	OZPFZTIHCUULLJ-VIFPVBQESA-N	439.357	1.214	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2nc(C)n(-c3ccc(F)cc3)n2)cc(OC)c1OC	746074952	AMMRDWFKKXJJBR-UHFFFAOYSA-N	429.408	1.815	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN(C)[C@H]1CCCC[C@@H]1S(C)(=O)=O	746469924	FDCRXWNNPHDGKP-HOCLYGCPSA-N	431.942	1.397	50	20	IDGD	
O=C(Cn1nnc(-c2ccc(Cl)cc2)n1)NNc1ccc(S(=O)(=O)NC2CC2)cc1	747379800	XNPXIAZHBQJYPJ-UHFFFAOYSA-N	447.908	1.578	50	20	IDGD	
Cc1noc(C(F)F)c1C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	748618761	FWUUPNJXZAMZCV-UHFFFAOYSA-N	429.449	1.614	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NC[C@@]1(N(C)C)CCSC1	748647561	PNWRLEOBIXWRFT-PXAZEXFGSA-N	445.383	1.984	50	20	IDGD	
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC(C(=O)NNc2cccc([N+](=O)[O-])c2C)CC1	748670122	DOIQDNNOWDZWME-UHFFFAOYSA-N	436.494	1.787	50	20	IDGD	
Cc1ccc(S(=O)(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1C(F)(F)F	748690317	XFXRAXYXWNIBTB-UHFFFAOYSA-N	426.380	1.613	50	20	IDGD	
Cc1c(NNC(=O)c2cc(S(=O)(=O)N3CCOCC3)ccc2F)cccc1[N+](=O)[O-]	748693767	RIKHDIRWNXWJQX-UHFFFAOYSA-N	438.437	1.820	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(C(=O)NNc2ccc([N+](=O)[O-])cc2Cl)cc1	748718350	VHWYYGOSJAVJJI-UHFFFAOYSA-N	428.854	1.930	50	20	IDGD	
O=C(O)c1cc([N+](=O)[O-])cc(S(=O)(=O)NNC(=O)c2ccccc2Br)c1	751142186	LEIGBASGASWVLW-UHFFFAOYSA-N	444.219	1.679	50	20	IDGD	
Cc1cc(S(N)(=O)=O)sc1C(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12	751293616	KHVNGNJHHPHKQC-UHFFFAOYSA-N	449.514	1.070	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)NC[C@@H]1CCN(S(C)(=O)=O)C1	753660546	MEPFEYOIRQNGLJ-CABCVRRESA-N	434.518	1.219	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)C(C)(C)c2ccccc2)c(C)c([N+](=O)[O-])c1	753841459	SGVWZXCQOLPANE-UHFFFAOYSA-N	442.428	1.754	50	20	IDGD	
COC(=O)CNC(=O)Cc1ccc(NC(=O)NNC(=O)c2cccc(N(C)C)c2)cc1	755863432	JNXWZLJBCDTHLW-UHFFFAOYSA-N	427.461	1.051	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)Nc1cc(Cl)ccc1OC[C@H]1CCCO1	756207352	QUKRYZOKRXNQGO-WCQYABFASA-N	431.898	1.485	50	20	IDGD	
CCOC(=O)Cn1cccc(NC(=O)NNC(=O)c2cccc(Br)c2)c1=O	757762812	HRHSQTQOYZHCAW-UHFFFAOYSA-N	437.250	1.640	50	20	IDGD	
CN(NC(=O)[C@@H]1CC(=O)N(C2CCCC2)C1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758786475	MTDMPOHFMVGFEC-OAHLLOKOSA-N	437.541	1.413	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)Cc2ccc(S(=O)(=O)N3CCCCC3)s2)nc1	759724732	FNJJPQSPNBBNTN-UHFFFAOYSA-N	438.531	1.790	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)c2cc(S(=O)(=O)N3CCC[C@@H](C)C3)cn2C)nc1	759739930	ZKMWFCOVFQTHNX-CYBMUJFWSA-N	435.506	1.384	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)[C@@H]1CCCN1C(=O)OCC(F)(F)F	760442683	NSCPEEZYBSXNLJ-JTQLQIEISA-N	426.392	1.212	50	20	IDGD	
CCCS(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)c2ccccc2C)c(OC)c1	761274383	UMLUSKSMFUEHAJ-UHFFFAOYSA-N	441.531	1.779	50	20	IDGD	
C[C@@H]1Sc2ccc(C(=O)OCC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)cc2NC1=O	761623282	YCCONCGETWZUCQ-JTQLQIEISA-N	444.425	1.646	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C1CCN(c2ccc3nncn3n2)CC1	762361703	SCOYYLOBUDIOHV-UHFFFAOYSA-N	441.517	1.289	50	20	IDGD	
C[C@H](C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1)c1cccc([N+](=O)[O-])c1	762870502	HUNIJEWUBOVEAI-AWEZNQCLSA-N	448.505	1.173	50	20	IDGD	
CC(C)(C)NC(=O)c1ccccc1NC(=O)C(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	763471804	LETLBHYNVBAMTN-UHFFFAOYSA-N	427.417	1.523	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)C(=O)Nc1cc(F)cc(F)c1	763531296	MFEGMOJEGTUPPS-UHFFFAOYSA-N	431.443	1.263	50	20	IDGD	
CNC(=O)Cn1ccc2ccc(NC(=O)C(=O)NNC(=O)c3c[nH]c4ccccc34)cc21	763540833	JZVDJSBOTKRORN-UHFFFAOYSA-N	432.440	1.268	50	20	IDGD	
Cn1cnnc1-c1cccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)c1	763604110	FPQWMXPQHISAGS-UHFFFAOYSA-N	430.428	1.272	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(C(=O)N(C)C)c(C)c1	763714364	UPAKJNOWPWQRMB-UHFFFAOYSA-N	426.473	1.424	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2Cc2ccccc2)cn1	763718916	SJGJOSVAHVGHNV-UHFFFAOYSA-N	434.452	1.846	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)COc1ccccc1OCc1ccccc1	763814359	OFCFALOJQQJUMU-UHFFFAOYSA-N	434.452	1.617	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2nn(CCC(C)C)c(=O)c3ccccc23)cn1	763842045	AGYOOOPUAKUMRW-UHFFFAOYSA-N	436.472	1.546	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)C(=O)Nc1ccc(C(N)=O)c(F)c1	763848996	GUBACVJIOQYRHP-LBPRGKRZSA-N	438.415	1.631	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2nc(-c3nccn3C)cs2)c1C	763853298	YGCIZPZPFNQBQT-CYBMUJFWSA-N	442.501	1.714	50	20	IDGD	
CO[C@H](C)C(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)c1	763871492	HBZBXGCUKDQVIB-OLZOCXBDSA-N	446.435	1.353	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)ccc1Cl	763872266	MZQSOTYFJZYDCU-JTQLQIEISA-N	437.811	1.819	50	20	IDGD	
Cc1ccn(-c2ccccc2NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)n1	763873770	WDZMEJIWTSXPEI-AWEZNQCLSA-N	425.420	1.873	50	20	IDGD	
O=C(CCSc1ccc(F)cc1)NNC(=O)C(=O)Nc1cnn(CC(F)(F)F)c1	763894506	BZNFAHMCQPPLKI-UHFFFAOYSA-N	433.387	1.853	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(NC(=O)C3CC3)c2)cc1OC	763901125	LIAPFMIEHRNUSU-UHFFFAOYSA-N	440.456	1.842	50	20	IDGD	
N#Cc1cccc(COc2ccc(NC(=O)C(=O)NNC(=O)c3cnccn3)cc2F)c1	764031788	MRVATMXRBZUMKQ-UHFFFAOYSA-N	434.387	1.466	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(OCC(F)F)cc2)c1	764078017	QEBMRKOIVFAZCX-UHFFFAOYSA-N	441.412	1.134	50	20	IDGD	
CCN(Cc1cccc(NC(=O)C(=O)NNC(=O)c2cc(C)[nH]n2)c1)C(=O)OC(C)(C)C	764109159	PNRIRAPZEKMFBB-UHFFFAOYSA-N	444.492	1.875	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1O)C(=O)Nc1cccc(-c2nnnn2C2CC2)c1	764127057	RVPUPDWRMINIBJ-UHFFFAOYSA-N	441.835	1.434	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2O1)C(=O)Nc1ccc(OCc2ccncc2)cc1	764163527	KMWKYTNUZPRSQH-HXUWFJFHSA-N	432.436	1.750	50	20	IDGD	
O=C(COC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1)NNC(=O)c1ccccc1	764173623	VXUXXAUTFNJDNL-SFHVURJKSA-N	425.441	1.792	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(NC(C)=O)ccc2OC)c(OC)c1	764285953	FJZJMWXWHXWQAD-UHFFFAOYSA-N	430.417	1.071	50	20	IDGD	
Cc1ccnn1-c1ccccc1NC(=O)C(=O)NNC(=O)C(F)(F)Oc1ccccc1	764370537	SBGOJQQNCCYHFS-UHFFFAOYSA-N	429.383	1.938	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3c(C)cccc3F)n[nH]2)cc1OC	764377994	FUIAJAVRFDAKMM-UHFFFAOYSA-N	441.419	1.941	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)cn1C	764382895	SCFPBDFVJPPTRB-UHFFFAOYSA-N	430.446	1.053	50	20	IDGD	
CCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)CSc2ccccc2OC)cc1	764392942	MVQINDARWMYQOD-UHFFFAOYSA-N	430.486	1.323	50	20	IDGD	
COC(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)CSc2ccccc2OC)c1	764397364	HJZZLEFUOOALTK-UHFFFAOYSA-N	431.470	1.289	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COCCO1)C(=O)Nc1ccc(Cl)c(C(=O)Nc2ccccc2)c1	764425277	OIYOJQWMGJSNMT-INIZCTEOSA-N	446.847	1.094	50	20	IDGD	
COc1ccccc1SCC(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	764462528	BXLUCLAHIGKZLT-UHFFFAOYSA-N	437.543	1.952	50	20	IDGD	
Cc1ccc(CN2C(=O)CC[C@@H]2C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)cc1	765312823	CBUIUISCZVCJAN-QGZVFWFLSA-N	432.521	1.938	50	20	IDGD	
CC(C)(C)OC(=O)NNC(=O)C(=O)Nc1cccc(Cn2nc3ccccn3c2=O)c1	765392631	YRBDTDTWEFEDQP-UHFFFAOYSA-N	426.433	1.039	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)[C@H](C)n2nnc(-c3ccccc3)n2)n[nH]1	765591929	DYTXRBLNWBBIOI-ZDUSSCGKSA-N	432.444	1.761	50	20	IDGD	
C[C@H](CC(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1)C(=O)c1ccccc1	765738550	LXYHTTYKPQSXFJ-GOSISDBHSA-N	436.512	1.501	50	20	IDGD	
CCN(c1ccccc1)S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2cnccn2)cc1	766256490	LDMLLXBGJKEVFF-UHFFFAOYSA-N	440.485	1.774	50	20	IDGD	
O=C(CCOC[C@@H]1CCCO1)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	766664822	VJYKEFRFTLVZGU-IBGZPJMESA-N	438.956	1.191	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)c(C)nn1	767191456	AGUKROOLENUUHK-UHFFFAOYSA-N	428.452	1.926	50	20	IDGD	
O=C(COC(=O)CCC(=O)N1CCN(c2ccccc2)CC1)NNC(=O)c1ccccc1	767544086	JNTXRCCEKOSAAO-UHFFFAOYSA-N	438.484	1.120	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(O)c(C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)c1	768368419	QUXHWBFAXCWGNB-UHFFFAOYSA-N	447.448	1.247	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)/C=C/c2cccc(Cl)c2)c1	768867500	RXDALZOQJUVWTN-MDZDMXLPSA-N	443.934	1.825	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)[C@H](c3ccccc3F)N3CCOCC3)nc21	770957608	CBJXZDQSLLUBOO-INIZCTEOSA-N	443.483	1.943	50	20	IDGD	
CC(=O)N1C[C@H](C(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)Oc2ccccc21	770965617	FBUHIXRCKCGNKU-OAHLLOKOSA-N	425.449	1.544	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)c3c[nH]n4c3nc(=O)c3ccccc34)nc21	770965702	NBXUVOTUAVTXAS-UHFFFAOYSA-N	433.432	1.533	50	20	IDGD	
CN(CC(=O)NNc1nc(O)c2cnn(C(C)(C)C)c2n1)S(=O)(=O)c1ccccc1	770966135	SBXGJMBSMDICFQ-UHFFFAOYSA-N	433.494	1.051	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)Cc1ccccc1I	771469017	GGEKFYAQMGVZKC-UHFFFAOYSA-N	426.210	1.766	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)CCc1nc(-c2cc(Br)cs2)no1	772044106	SLYSVGSCCKQDKH-MRVPVSSYSA-N	445.295	1.982	50	20	IDGD	
CN(C)C(=O)Nc1ccc(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c(Cl)c1	772631382	QSCPYBCUROGJSL-UHFFFAOYSA-N	428.840	1.484	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](CC(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1ccccc1	773263741	ZTLGHNMCYSFGEM-HUUCEWRRSA-N	425.507	1.225	50	20	IDGD	
C[C@@H]1Oc2ccccc2N(CC(=O)NNC(=O)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)C1=O	773416527	BUQDVZZANCXDAV-LSDHHAIUSA-N	446.504	1.595	50	20	IDGD	
CCS(=O)(=O)c1ccccc1C(=O)NNC(=O)[C@H]1CCCN(C(=O)OC(C)(C)C)C1	773418149	SHYKHNITQKAYHC-AWEZNQCLSA-N	439.534	1.888	50	20	IDGD	
CN1CCCCC/C1=N\S(=O)(=O)c1cccc(NC(=O)C(=O)NNc2ncccn2)c1	773723799	FIHMNKIXTZMOKG-PCLIKHOPSA-N	445.505	1.151	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2nccnc2C(C)C)cc1S(=O)(=O)NC1CC1	773992757	LEEPKFMARSRHFB-UHFFFAOYSA-N	432.506	1.431	50	20	IDGD	
NS(=O)(=O)c1ccc2c(c1)oc(=O)n2CC(=O)NNc1ncc(Cl)cc1Cl	775265448	OUXIMTRRXWRGFB-UHFFFAOYSA-N	432.245	1.087	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)Nc1ccnn1[C@@H]1CCS(=O)(=O)C1	776053575	DCZQUXXRSDNPDJ-WCQYABFASA-N	425.442	1.002	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)nn1-c1ccc(Cl)c(Cl)c1	776751725	DNDGYOIJJXPLQF-SNVBAGLBSA-N	431.301	1.683	50	20	IDGD	
COC(=O)N1CCC([C@@H](C)NC(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)CC1	777258695	SBXUJZOVFRNDNP-LLVKDONJSA-N	434.501	1.780	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)Nc1cc(C(F)(F)F)ccc1N1CCOCC1	779352026	ZYQMCZIDWYPALG-LBPRGKRZSA-N	434.415	1.746	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNS(=O)(=O)c1cccc(C(F)F)c1	780366442	LPDIYSCXMMBZKP-UHFFFAOYSA-N	432.474	1.849	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2cccc(C(=O)N3CCSCC3)c2C)nc1	782144853	FIQJMAYYHUVPNN-UHFFFAOYSA-N	429.502	1.669	50	20	IDGD	
CC(=O)N1CCN(Cc2ccc(NC(=O)C(=O)NNc3ccc(F)cc3C)cc2)CC1	783444486	IWDUSVQEUUHKLB-UHFFFAOYSA-N	427.480	1.880	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1cc(Br)ccc1F	784004450	XIQNONHVILCFFZ-UHFFFAOYSA-N	443.254	1.166	50	20	IDGD	
CC(C)C[C@H](C(=O)OCC(=O)NNC(=O)c1ccccc1)N1C(=O)[C@@H]2CC=CC[C@H]2C1=O	784473564	XGPPYANLUWOCMO-KZNAEPCWSA-N	441.484	1.357	50	20	IDGD	
CC[C@@H](C)NS(=O)(=O)Cc1cccc(NC(=O)C(=O)NNc2nccnc2Cl)c1	784778029	PPEUWRUQKVGMCD-LLVKDONJSA-N	440.913	1.430	50	20	IDGD	
Cn1ccnc1C(=O)c1ccc(NC(=O)C(=O)NNc2ccnc(Br)c2)cc1	784828048	AVIQHVMZDSKRQC-UHFFFAOYSA-N	443.261	1.890	50	20	IDGD	
Cc1ccc(F)c(NNC(=O)C(=O)Nc2ccccc2OCC(=O)N2CCOCC2)c1	784888425	VODLAOSJACPVRR-UHFFFAOYSA-N	430.436	1.454	50	20	IDGD	
CC(C)(C)OC(=O)N1CCc2c(cccc2NC(=O)C(=O)NNc2ncc(F)cn2)C1	784949292	KDICVHLKLXWCKH-UHFFFAOYSA-N	430.440	1.991	50	20	IDGD	
Cn1c(C2CC2)nc2cc(NC(=O)C(=O)NNC(=O)c3cc([N+](=O)[O-])ccc3O)ccc21	785023398	HKECBBOXXPFPOR-UHFFFAOYSA-N	438.400	1.464	50	20	IDGD	
COC(=O)c1csc(NC(=O)C(=O)NNC(=O)c2cc(-c3cc(C)ccc3C)[nH]n2)c1	785127986	LJWNPELHZLTQCZ-UHFFFAOYSA-N	441.469	1.941	50	20	IDGD	
Cn1c(=O)c(C(=O)COC(=O)/C(C#N)=C\c2ccccc2)c(N)n(Cc2ccccc2)c1=O	785364507	PDXWQGPBRLYMAP-PDGQHHTCSA-N	444.447	1.511	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C(F)(F)F)c1	785444577	JNPHNWWTSYILBR-SYQHCUMBSA-N	435.424	1.054	50	20	IDGD	
NS(=O)(=O)c1ccccc1NNC(=O)C1CCN(C(=O)/C=C\c2ccccc2)CC1	788228744	OYFFVTWAIBTBHG-KHPPLWFESA-N	428.514	1.729	50	20	IDGD	
CCN(CC)c1ccc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)cn1	789817665	ISDUXOGHVYKEQE-HKUYNNGSSA-N	425.489	1.586	50	20	IDGD	
CN(C)C(=O)C[C@@H]1CN(C(=O)C(=O)NNc2nc3ccccn3n2)c2ccc(Cl)cc21	792393967	JIBFZOHBKDRBCW-GFCCVEGCSA-N	441.879	1.435	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)[C@H]1CCS(=O)(=O)c2ccccc21	792815326	BDKWLMYZLVPMDF-KRWDZBQOSA-N	430.482	1.189	50	20	IDGD	
COc1ccc(Cn2cc(NC(=O)C(=O)NNC(=O)Cc3ccccc3F)cn2)cc1	793025525	MEZPZMLRAFIJAW-UHFFFAOYSA-N	425.420	1.408	50	20	IDGD	
CCc1ccc(C(=O)O)cc1S(=O)(=O)NNC(=O)CNC(=O)OCc1ccccc1	794598243	DLPCFJDGRJRLPD-UHFFFAOYSA-N	435.458	1.183	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)CN[C@@H](CO)c1ccc(Br)c(F)c1	795336745	SVPACNCNQYOXPZ-KRWDZBQOSA-N	438.297	1.910	50	20	IDGD	
CCc1nc2cc(NC(=O)C(=O)NNC(=O)CNC(=O)OCc3ccccc3)ccc2o1	797369055	MYMWJFQMFQDCMH-UHFFFAOYSA-N	439.428	1.403	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H]2C[C@H](c3cccc(F)c3)C2)c1	798116795	VMFWMKXBZCETMB-JCNLHEQBSA-N	434.493	1.966	50	20	IDGD	
Cc1cc(O[C@@H]2CCN(C)C2=O)ccc1NC(=O)NNC(=O)COc1ccccc1C#N	799238716	KXBZYBGZFDECFM-LJQANCHMSA-N	437.456	1.708	50	20	IDGD	
CCc1cccc(C)c1NNC(=O)C(=O)Nc1ccc(NC(=O)CN2CCOCC2)cc1	799842447	HNGZNCDNXSGHSF-UHFFFAOYSA-N	439.516	1.910	50	20	IDGD	
CCOc1ccccc1C(=O)N1CCC[C@H]1C(=O)NNC(=O)C(=O)Nc1ccc(C)cc1	801108248	JOIGHWHQXWEBLF-SFHVURJKSA-N	438.484	1.784	50	20	IDGD	
CC(=O)N1CCN(S(=O)(=O)c2cc(C(=O)NNc3cccc(F)c3)ccc2F)CC1	801176254	CZQMBRSYTVMDHW-UHFFFAOYSA-N	438.456	1.575	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)c2cn(Cc3ccccn3)nn2)c(OC)cc1Cl	802080091	NOEBUSZWCMBYFK-UHFFFAOYSA-N	431.840	1.859	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)Cn2ncc3ccccc3c2=O)c(OC)cc1Cl	802081117	BXDWXZPMJICFGO-UHFFFAOYSA-N	431.836	1.920	50	20	IDGD	
CCc1ccccc1OCCC(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	803965384	SUZGCCODGDWFNC-LJQANCHMSA-N	428.441	1.549	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)c2cc(Br)ncc2Cl)c1	805623705	CXJNRPDMPXMJAP-UHFFFAOYSA-N	437.637	1.987	50	20	IDGD	
COc1ccc(CS(C)(=O)=O)cc1NC(=O)NNC(=O)c1ccc2c(c1)OCCO2	806634552	JWJNQPOKUHESQQ-UHFFFAOYSA-N	435.458	1.478	50	20	IDGD	
COCc1cnc(NC(=O)C(=O)NNC(=O)COc2ccc(Br)cc2)s1	806974115	VCFBKHDZOPRPRV-UHFFFAOYSA-N	443.279	1.217	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1cnn(C)c1-c1ccccc1	807026990	KDLSKECFEBDFOS-UHFFFAOYSA-N	443.485	1.581	50	20	IDGD	
Cc1cc([N+](=O)[O-])ccc1NNC(=O)C(=O)Nc1ccc(NC(=O)CCN(C)C)cc1	807458136	UBRBDEXCESLDQO-UHFFFAOYSA-N	428.449	1.875	50	20	IDGD	
CSCc1cccnc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	809957788	YXBRUJMDUPNCJU-UHFFFAOYSA-N	434.543	1.804	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2cc(C)c(F)cc2C(=O)NCC(F)(F)F)ncn1	810394472	ZNKZJVPLSBCTBH-UHFFFAOYSA-N	428.346	1.606	50	20	IDGD	
C[C@@H]1Oc2ccccc2N(CCC(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)C1=O	812727463	RJPIMMXUEHXVCB-AWEZNQCLSA-N	432.502	1.584	50	20	IDGD	
CC(=O)Nc1cc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)ccc1F	813033148	GZEHXIJQXUKZGD-UHFFFAOYSA-N	437.453	1.116	50	20	IDGD	
Cn1c(=O)c(CNC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc2ccccc21	813837707	UDJVKDYTTWXAFA-UHFFFAOYSA-N	432.440	1.574	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NN=Cc1ccc2oncc2c1	814710445	ODKWTLSZKXXWEQ-UHFFFAOYSA-N	442.497	1.932	50	20	IDGD	
CCOC(=O)c1cc(COC)cc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)nc2)c1	815568130	WBIUKAKLWHDQEP-UHFFFAOYSA-N	434.836	1.458	50	20	IDGD	
CCOc1ccc(NNC(=O)C(=O)Nc2cc(S(=O)(=O)N3CCCC3)ccn2)cc1	815816314	QSQUJGPZRCOGDQ-UHFFFAOYSA-N	433.490	1.347	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)c2cc(S(N)(=O)=O)ccc2F)c1	818756702	IPXQPWXJQIQTGJ-UHFFFAOYSA-N	446.254	1.779	50	20	IDGD	
CCCn1nc(C(=O)NNS(=O)(=O)c2c[nH]nc2C(F)(F)F)c2ccccc2c1=O	821126999	DLYGBBDUSOCKDU-UHFFFAOYSA-N	444.395	1.172	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)CNc3ccccc3)CC2)c(C)c1	823327889	MQWNSBBPGRLZCE-UHFFFAOYSA-N	444.557	1.964	50	20	IDGD	
O=C(c1cc(S(=O)(=O)N2CCCCC2)ccc1N1CCCC1)N1CC[C@@H](B(O)O)C1	864234672	ZJSVLYPQTLDGIE-MRXNPFEDSA-N	435.355	1.150	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)c1cc(S(=O)(=O)N(C)C)ccc1F	912604687	VASXBCUNHGPCQX-NSHDSACASA-N	427.429	1.444	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@@H]2C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c(OC)c1	915063910	RCOMWOUGSCDEMZ-QGZVFWFLSA-N	442.428	1.678	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)[C@H](C)N1C(=O)[C@@H]2CCCC[C@H]2C1=O	915775738	NWXYBBZXCSKOPJ-RRFJBIMHSA-N	425.489	1.310	50	20	IDGD	
Cc1nc2c(c(C)nn2C)c(C)c1CC(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	916147743	NLGDOZWEVRRMNY-UHFFFAOYSA-N	433.472	1.789	50	20	IDGD	
CCn1c(NNC(=O)c2cc(Cl)c(-n3cnnn3)cc2OC)nc2ccccc2c1=O	916158878	WGOQAYWXYZBHSW-UHFFFAOYSA-N	440.851	1.811	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)sc(C)c1C	916561939	HXZDRJDCOGOMQP-UHFFFAOYSA-N	434.430	1.850	50	20	IDGD	
O=C(NCc1ncc(-c2ccccc2)o1)NNC(=O)c1csc(N2CCOCC2)n1	916626356	ZLDXTKFVNXNXQW-UHFFFAOYSA-N	428.474	1.779	50	20	IDGD	
COc1c(F)cc(CC(=O)NNc2ccc(Cl)cc2[N+](=O)[O-])cc1S(N)(=O)=O	917216128	VMZBHRAYUJPKGB-UHFFFAOYSA-N	432.817	1.729	50	20	IDGD	
CCCOc1ccc(C(=O)NNS(=O)(=O)c2ccc(O)c(C(=O)OC)c2)cc1OC	917727749	ONWCECJJHVAYKY-UHFFFAOYSA-N	438.458	1.600	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)N2CCN(c3ncccn3)CC2)N(C)c2ccccc21	919685935	GIAMXAFWISQUCT-UHFFFAOYSA-N	431.500	1.796	50	20	IDGD	
O=C(NNC(=O)c1c[nH]c2ncccc12)c1cccc(S(=O)(=O)N2CCCCC2)c1	919687376	WIPADNQRTWZGQU-UHFFFAOYSA-N	427.486	1.812	50	20	IDGD	
Cc1cc(CC(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)c(C)n1-c1ccc(Cl)cc1	919883169	BFFVUTONJCOFBH-MRXNPFEDSA-N	438.937	1.808	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccncc2)nc2ccccc12)N[C@H]1CCS(=O)(=O)C1	919884711	KQQKHNKKWYMYTE-AWEZNQCLSA-N	425.470	1.428	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1C(F)(F)F)N[C@H]1CCS(=O)(=O)C1	919889957	XMYAMDFNRWOZHJ-JTQLQIEISA-N	431.396	1.022	50	20	IDGD	
COc1cccc(-c2nn(-c3ccccc3)cc2C(=O)NNC(=O)CN2CCCC2=O)c1	920826690	ODTDESPAEPOJMO-UHFFFAOYSA-N	433.468	1.931	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2ccc3ccccc3n2)cc1	1248468069	XFNQDZGBOHIGJQ-UHFFFAOYSA-N	428.470	1.373	50	20	IDGD	
CN1CCN(Cc2cccc(CNC(=O)NNC(=O)[C@H]3COc4ccccc4O3)c2)CC1	1318232868	MZTIBSHJTPYPJO-OAQYLSRUSA-N	439.516	1.104	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)c2ccc(N3CCOCC3)cc2)CC1	1321908625	BOJUCUIXPBKQLP-UHFFFAOYSA-N	432.521	1.931	50	20	IDGD	
COc1cccc(C[C@H](O)C(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)c1	1326124321	LJAVDVOHGSGAPO-KRWDZBQOSA-N	436.509	1.234	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)NCCCOC[C@H]2CCOC2)CC1	1329253747	SQWXKHUHVCKYCD-OAHLLOKOSA-N	428.530	1.407	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cccn3ccnc23)C1	1779057445	LPWJRBAWNXQXIR-CSODHUTKSA-N	434.924	1.716	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc[nH]3)C2)C1	1779374383	HVZCDWNGLKJOOO-NRFANRHFSA-N	442.428	1.606	50	20	IDGD	
Cc1cc(C)cc(C(=O)N2CC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c1	1780690326	SSRAILAYDAPPKA-HSZRJFAPSA-N	437.500	1.059	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Br)C2)c1cc(O)ccc1O	1781144363	UEQWHTCFPASLQE-RVKKMQEKSA-N	445.285	1.916	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cccc(N4CCOCC4)c3)CCO2)C1	1781217399	WEBUMFDNMQHWTN-KNQAVFIVSA-N	435.952	1.984	50	20	IDGD	
Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1781983874	RUAIHEHIVAHTKK-KSSFIOAISA-N	429.832	1.086	50	20	IDGD	
O=C(c1ccnc2ncccc12)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1782343187	BFCBJCBQWFTBOJ-KSSFIOAISA-N	437.269	1.764	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc4nncn4c3)CCO2)C1	1783349538	MXQLPAWFAXLAEL-KSSFIOAISA-N	436.310	1.346	50	20	IDGD	
C[C@@H](Sc1ccccc1)C(=O)N1CCO[C@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1	1783933298	GLIPKMVBCDRYPX-VGSWGCGISA-N	448.589	1.370	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1ccnc3ccccc13)CCO2	1783934413	FUKPKKASOBRUQL-QHCPKHFHSA-N	439.516	1.051	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3C[C@H]3c3ccc(F)c(F)c3)C[C@@H]21)[C@H](O)CCl	1784084461	SRRPSNJGWRAGDK-KHSMQWPDSA-N	442.890	1.648	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](C)n3cc(C)cn3)C2)C1	1784451822	NRNYQZAGOIVRQJ-MPGHIAIKSA-N	427.343	1.756	50	20	IDGD	
Cc1ccc(C(=O)NCC(=O)N2CC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)cc1	1785566685	PAKZISVUHRJQDR-LJQANCHMSA-N	428.316	1.358	50	20	IDGD	
CC(C)(C)OC(=O)NCC(C)(C)C(=O)N1CC[C@@]2(CN(C(=O)[C@H](F)Cl)CCO2)C1	1785737316	ZEFOEMFNMSKPDU-ORAYPTAESA-N	435.924	1.902	50	20	IDGD	
Cc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Br)C[C@@H]32)nc1C	1785771178	GBMAMUYZVFYXBN-DARAHFNDSA-N	428.302	1.982	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)CSc3ncccn3)C[C@@H]21	1786406177	XNQBXYJBJSXNCE-IHRRRGAJSA-N	443.367	1.333	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)C1=NO[C@H](c2ccccc2)C1	1788141520	KORFJGMLYGQIPN-FQQAFBJJSA-N	435.908	1.083	50	20	IDGD	
CCCC(=O)N[C@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)Br)C[C@@H]21	1788743584	DNMGDDSBUYKOPI-MRLBHPIUSA-N	432.359	1.054	50	20	IDGD	
C[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)n1ccccc1=O	1788747079	GWFPVCAHCUYFQW-VGWMRTNUSA-N	440.338	1.174	50	20	IDGD	
Cc1nn(C)c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]3C2)c1F	1789868731	KTDHGZKXFCNYNN-PAKFGRKTSA-N	435.327	1.697	50	20	IDGD	
N[C@@H](CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]2C1)c1cccnc1	1789922742	PDFLZMIWZPPNJI-WNZSCWOMSA-N	443.317	1.142	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(O)cc([N+](=O)[O-])c3)[C@H]2C1	1790216907	VBBGEEATTZQDSJ-UQCMEYCASA-N	441.868	1.148	50	20	IDGD	
O=C(Cc1ccc([N+](=O)[O-])cc1F)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Cl)C[C@@H]21	1790754663	BXHKZNZLZCBDEF-MOWSHJCCSA-N	431.823	1.791	50	20	IDGD	
COC(=O)C12CC(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)[C@@H](C)Br)C[C@@H]43)(C1)C2	1791019376	FDKJJNHMLYGHFU-ZYJNRPTESA-N	443.338	1.093	50	20	IDGD	
COC(=O)[C@@H]1CC[C@@H](C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](C)Br)[C@H]3C2)C1	1791055198	NMZRHUMLJXYEAQ-XFHWEBQZSA-N	445.354	1.339	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(=O)c3ccc(Cl)cc3)C[C@@H]21	1791250039	XGZDZXQCTSGFGR-HJWJTTGWSA-N	443.327	1.756	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccccc3NC(C)=O)[C@H]2C1	1792002993	DTAJPEYRAZAUTC-RMRDIRSESA-N	437.924	1.492	50	20	IDGD	
COc1ccc([C@@H](O)C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@](C)(Cl)CCl)C3)cc1	1792715641	JIFSDVOTALNITD-AENLNBOZSA-N	445.343	1.555	50	20	IDGD	
C[C@@H](O)[C@H](NC(=O)c1ccccc1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C(Cl)Cl)C2	1792880489	ANUUPIWHZDIDQV-JZYAIQKZSA-N	442.343	1.608	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCN1C(=O)C=CC1=O	1793854511	AVGWJCSNOOZKJH-CRWXNKLISA-N	426.311	1.113	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccnc1OCC1CC1)c1ccc(B(O)O)cc1	1794773787	KUJHYPXROMGOBI-ACDBMABISA-N	449.316	1.116	50	20	IDGD	
C=CCCc1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CCC(=O)NN(C)C)C3)c(O)n1	1794826835	IPDBERGMYZDQQZ-BCDXTJNWSA-N	443.548	1.531	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCOc1ccc(F)cc1)C2	1795113215	OITABVCLQWNSTF-HBCWATKFSA-N	443.313	1.969	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(F)cc([N+](=O)[O-])c1)C2	1795115075	FWTBOXKBLFYWTD-DRXBFXEBSA-N	444.257	1.722	50	20	IDGD	
O=C(COCc1ccccc1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2	1795423332	PIAHYEGOEACBRT-HGKCTWBKSA-N	425.323	1.578	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc2c1OC(C)(C)C2	1796262593	NAPJPGDDYGMSRN-MVJTYMMSSA-N	436.936	1.857	50	20	IDGD	
N#Cc1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](O)CCl)C3)c(C(F)(F)F)n1	1796459266	IHYPIQZCOKTXHJ-OPDFLTKYSA-N	430.814	1.824	50	20	IDGD	
CC(C)(C)OC(=O)N1CCOC[C@@H]1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](F)Cl	1796804589	MJAJVHBZRVMBIL-KHMAMNHCSA-N	433.908	1.795	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnnc2ccccc12	1796885953	APTRCBDCJVXKAH-FLTUCWPJSA-N	447.333	1.864	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnccc1C(=O)NN	1798442103	WTRPIIPYFZQOGK-QPSSLKIMSA-N	428.320	1.173	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](C)NC(=O)c1ccc(F)cc1	1799815094	AGGJUMPXODWBPX-LKIBZCMFSA-N	439.915	1.836	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c(C)nn(C)c1C)C2	1800640380	UYVWMZBZRHABSQ-FQLMCAECSA-N	427.343	1.414	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3ncccc3[nH]1)C2	1800642932	CQQZSULICIOERR-LKQDWFRTSA-N	435.322	1.940	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1COc3ccccc3O1)C2	1800757971	YWDDWZUWTWGXET-PMUIAIRXSA-N	439.306	1.199	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1n[nH]c3c(F)cccc13)C2	1800759592	XBLVPQPMTJETQM-NJBDSQKTSA-N	439.285	1.689	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Br)C3)cc1	1801783840	CUBSMOXLXWQKLW-XRGAULLZSA-N	442.285	1.539	50	20	IDGD	
N#Cc1ccc(CC(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)cc1	1803137461	PXZYDCIBKASCSY-SVFBPWRDSA-N	426.904	1.801	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cc3ncccn3n2)[C@H]1c1cccnc1)[C@H](O)CCl	1803142840	KQPVHAKFACRJED-LESCRADOSA-N	428.880	1.044	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cc3cccnc3[nH]2)[C@H]1c1cccnc1)[C@H](O)CCl	1803143097	TZZROOWEVFPYLS-JQHSSLGASA-N	427.892	1.877	50	20	IDGD	
CC(C)(C(=O)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1)c1ccccn1	1809973200	ZTWCAIOVZNJUQO-UHFFFAOYSA-N	449.360	1.584	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H](CNC(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)on1	1810300383	YDGHUJCXMYBISS-BEFAXECRSA-N	449.471	1.010	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)C(Cl)Cl)[C@@H]1c1cccnc1)[C@@H]1CCCS1(=O)=O	1812497861	CAJSRVQOOITSIH-MELADBBJSA-N	434.345	1.468	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2cncs2)[C@H]1c1cccnc1	1813069728	BBBCGNBDNPPAQA-BEFAXECRSA-N	430.534	1.231	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)C1CC2(CCC2)C1	1813650098	UXGBXHCVLFBEQY-KNQAVFIVSA-N	447.344	1.661	50	20	IDGD	
C[C@H](CBr)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2CCNC(=O)C2)[nH]n1	1814783689	SXJJIUUTNRPAOP-BZPMIXESSA-N	440.342	1.959	50	20	IDGD	
C=CCOCCCC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1815207199	WSRSWVRBSPVQQT-LJQANCHMSA-N	440.309	1.378	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnco2)n[nH]1	1815433159	BJXUMHQCBNNQJK-ZWGXDWAISA-N	438.448	1.838	50	20	IDGD	
Cc1ccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)cn1	1816372203	QVZVXVJVUHUHGH-KRWDZBQOSA-N	427.509	1.792	50	20	IDGD	
Cc1ccnc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)CCC(=O)NN(C)C)CC3)c1	1817478231	ZXWDDMYVRFPGNR-CYBMUJFWSA-N	430.534	1.445	50	20	IDGD	
C=CC(=O)N[C@@H](C)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCBr)CC2	1820141344	UADCVPQZCCHOSK-UWVGGRQHSA-N	429.340	1.531	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@H](F)Cl)[nH]n1)c1cc(=O)nc2cccnn12	1820144598	KPPSPJYFBPXNLB-BZNIZROVSA-N	433.831	1.653	50	20	IDGD	
C=CC[C@@H](C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1821920935	AEKJBFHPAUQHFB-CXAGYDPISA-N	425.493	1.926	50	20	IDGD	
COC[C@H](NC(C)=O)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](C)Br)n[nH]1	1822189238	QNRGSJJHIWYDJF-SWHYSGLUSA-N	444.330	1.336	50	20	IDGD	
COC1(CC(=O)Nc2cc([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)CCC1	1823072913	NXEYGSOJQCSDOD-INIZCTEOSA-N	434.541	1.734	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H]2CCCSC2)n[nH]1	1823458182	GZEKLVDZYMPQLB-GOEBONIOSA-N	436.582	1.918	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)CCc3ccc(O)nn3)sc2C1	1824491766	OJWUKFPTDRNUHK-NWDGAFQWSA-N	439.925	1.437	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CCCCO1)CCO2	1829926868	UDIVGOGYWKKPKC-DAYGRLMNSA-N	433.343	1.185	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccnc3S)C2)C1	1830353648	IWNAZGXPKVAOHP-IBGZPJMESA-N	427.954	1.705	50	20	IDGD	
CC(C)[C@@H](S)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](C)CBr)CCO2)C1	1830535688	SBCLPKCALXVJLW-CKEIUWERSA-N	437.400	1.428	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccnn3C(C)C)C2)C1	1831649709	ANDOJFGZUCEPEF-OXJNMPFZSA-N	426.945	1.942	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4n(n3)CCCO4)C2)C1	1831651068	NKFBPSHWMLAWPE-MGPUTAFESA-N	440.928	1.143	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3Cc4ccccc4N3)C2)C1	1831657917	RODZYNDLMINNAC-LQBOVUBWSA-N	435.952	1.887	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(OC)n(C)n2)CC1	1831831653	GGSNLDCHHWRJBK-RDJZCZTQSA-N	426.945	1.916	50	20	IDGD	
O=C(/C=C/c1ccc(F)cc1F)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1832136990	IFDCHRUTUAMGPD-CSGFNCJESA-N	432.826	1.969	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3ccco3)CCO2)C1	1833044689	RGQQMEGNLNINPI-KXBFYZLASA-N	443.338	1.700	50	20	IDGD	
CC[C@H](C)[C@@H](O)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)Br)CC2)CC1	1833503752	ZGRFDBQIZNFRBH-JJRVBVJISA-N	432.403	1.748	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3n[nH]c(CC)c3F)CCO2)C1	1833734541	VVXMZEHEWATURO-DJJJIMSYSA-N	430.908	1.589	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3nccs3)CCO2)C1	1834437684	HONJKWPWLNLCJX-WBMJQRKESA-N	432.340	1.387	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)c3ncc(F)cc3F)C2)C1	1834819362	NCXXCEJWVHXQKI-KRWDZBQOSA-N	448.264	1.215	50	20	IDGD	
O=C(CCC(F)(F)F)N1CCOC[C@@]2(C1)CN(C(=O)CCBr)CCO2	1834822518	SHYQCXRHIAMOEY-CQSZACIVSA-N	431.249	1.570	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H](O)c3ccccc3)CCO2)C1	1835291060	BMNVOAKSRGCUHN-FFZOFVMBSA-N	445.343	1.413	50	20	IDGD	
O=C(Cc1cccs1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1836091619	RHTOPSPHWRQJDA-ZBFHGGJFSA-N	435.315	1.438	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)C(C)(C)NC(C)=O)CC2)CC1	1836878993	JRHZPBCHIRKPRS-KRWDZBQOSA-N	431.961	1.154	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc4ccnn34)CCO2)C1	1839497208	ZNHNHMXTVUAKJD-OAQYLSRUSA-N	434.924	1.669	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)/C=C/c3ccco3)C2)C1	1839962831	RZAWHCKWZUYEHA-KOBPNJQFSA-N	441.322	1.923	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(C)o3)C2)C1	1839962927	VLCUFWGUCZILML-KSSFIOAISA-N	429.311	1.832	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3C[C@@]3(F)Cl)C2)C1	1839966539	IKKWXRFWMNQUFZ-APYUEPQZSA-N	441.725	1.541	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CC[C@@H]3CCOC3)C2)C1	1839967702	VGJGLLBYXDYSPX-JTDSTZFVSA-N	447.370	1.433	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CCN3CCCCC3)C2)C1	1840032074	NFOKCMINXMDTNK-LPHOPBHVSA-N	446.386	1.102	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(Cl)cc3)C2)C1	1840153781	ASKBRPHBZJOYDP-VQIMIIECSA-N	431.316	1.664	50	20	IDGD	
Cc1nccn1[C@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1	1840494062	OQRSERKZLVXOCF-ZMYBRWDISA-N	447.363	1.445	50	20	IDGD	
O=C(c1ccc([N+](=O)[O-])c2c1OCO2)N1CC2(CCCN2C(=O)CCBr)C1	1842638847	RRZZFUTZVYLNSG-UHFFFAOYSA-N	440.250	1.926	50	20	IDGD	
CCc1cc(C(=O)N2CCCC23CN(C(=O)c2cc([N+](=O)[O-])ccc2OC(C)=O)C3)n[nH]1	1843145485	HDWPWEXGPWJCKD-UHFFFAOYSA-N	441.444	1.936	50	20	IDGD	
Cc1c(C(=O)N2CCCC23CN(C(=O)[C@](C)(Cl)CCl)C3)cn2[nH]cnc(=O)c12	1844656622	MILGJHMGGFQYGE-QGZVFWFLSA-N	426.304	1.384	50	20	IDGD	
C[C@H](C(=O)N1CC2(CCCN2C(=O)[C@@H](F)Br)C1)N1CSCSC1	1845217913	CBYSKCJDTASHJL-GHMZBOCLSA-N	426.377	1.923	50	20	IDGD	
Cc1ccc(C(=O)NCC(=O)N2CCCC23CN(C(=O)[C@@H](C)CBr)C3)cc1	1847065062	BLMZRXIHKMJNTQ-HNNXBMFYSA-N	436.350	1.959	50	20	IDGD	
CCCC[C@@H](NC1=NS(=O)(=O)c2ccccc21)C(=O)NNC(=O)c1ccccc1O	10125700	ATOVOOIWRTVZOR-OAHLLOKOSA-N	430.486	1.451	50	20	IDGD	
Cc1ccc(C)c(S(=O)(=O)Nc2ccc(C(=O)NNc3nnc(C)c(=O)[nH]3)cc2)c1	11266161	YAUWSRZUPRMHRR-UHFFFAOYSA-N	428.474	1.648	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)CCNC3=NS(=O)(=O)c4ccccc43)cc2C1	15557121	GCDBCCMZMKDIGU-GFCCVEGCSA-N	446.554	1.763	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)COc2ccc3ccc(=O)oc3c2)c2ccccc2c1=O	17161786	BVFKZYBVQHTYTI-UHFFFAOYSA-N	448.435	1.753	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)c1ccc(CCNS(C)(=O)=O)s1	27199971	OJQFZCZNEOKARW-NSHDSACASA-N	429.495	1.207	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)CCc2nc3c(cnn3C)c(=O)[nH]2)c1	29511437	VXBJLCLJGDRZFP-UHFFFAOYSA-N	426.477	1.247	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)NCc1ccc(COCC(F)(F)F)cc1	725873153	VZLZMVIFLLVAFY-UHFFFAOYSA-N	428.367	1.619	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2cccc3cccnc23)c(C(=O)OC)s1	726520622	IWHFJIBJSXOFCC-UHFFFAOYSA-N	449.466	1.493	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)c1oc2ccccc2c1CS(C)(=O)=O	726619877	DNHYUFJAFOZBML-UHFFFAOYSA-N	432.454	1.826	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)CCc2nc(-c3ncccn3)no2)cc1	727706028	IBFAGAMKYHZBDA-ZDUSSCGKSA-N	426.433	1.473	50	20	IDGD	
CC(C)c1noc2nc(-c3ccco3)cc(C(=O)NNC(=O)N[C@H]3CCS(=O)(=O)C3)c12	727732186	NMSHBSQWMBCUBH-NSHDSACASA-N	447.473	1.737	50	20	IDGD	
COc1cccc(CCC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)c1	728213675	FVGVNGXGMKNTQW-UHFFFAOYSA-N	432.546	1.707	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)C1CCN(c2ccc3nnc(C(F)(F)F)n3n2)CC1	728851311	XVSHVYXOOUVPTC-UHFFFAOYSA-N	448.409	1.145	50	20	IDGD	
CS(=O)(=O)c1cc(C(=O)NNC(=O)Cc2ccccc2F)ccc1Br	731328683	SUPXSVOAJIJURJ-UHFFFAOYSA-N	429.267	1.995	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCCCCN2C(=O)c3ccccc3C2=O)cc1OC	732238732	ZPDVBOXRRSEVBE-UHFFFAOYSA-N	440.456	1.724	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCN([C@H](C)c3cccnc3)CC2)cc1OC	735871836	YAHSYXDFGCFFJQ-MRXNPFEDSA-N	427.505	1.239	50	20	IDGD	
O=C(COC(=O)Cc1c[nH]c2ccc(Cl)cc12)NNC(=O)[C@@H]1COc2ccccc2O1	740303703	ZXXFZJUKWYVSBZ-SFHVURJKSA-N	443.843	1.894	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(Br)c(F)c1)[C@H]1COc2ccccc2O1	743252272	UERIVIJMYKKQTN-CQSZACIVSA-N	431.239	1.738	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)N[C@H]1CC(=O)N(CCOc2ccccc2)C1	743509569	HACGBVZJFCFNBY-HNNXBMFYSA-N	430.436	1.215	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(C#N)c(Cl)c2)cc(OC)c1OC	743734548	YGTFRYNKJSLORY-UHFFFAOYSA-N	432.820	1.637	50	20	IDGD	
COc1cc(CN(C)CC(=O)NNC(=O)Cc2nc(C)cs2)ccc1OC(F)F	743756277	GANXTRYWQGVYGL-UHFFFAOYSA-N	428.461	1.883	50	20	IDGD	
COc1ccc(CN2C[C@@H](C(=O)OCC(=O)NNC(=O)c3cccc(C)c3)CC2=O)cc1	744926817	MNJDLUKAAJWZDU-SFHVURJKSA-N	439.468	1.357	50	20	IDGD	
Cc1c(C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)nnn1-c1ccccc1Cl	744955691	HTYGGLACXHPHJD-UHFFFAOYSA-N	438.831	1.719	50	20	IDGD	
C[C@H](CC(=O)c1ccccc1F)C(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	745491525	WPQXEYAIAMEXRA-GFCCVEGCSA-N	431.376	1.947	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CC(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1)c1ccccc1	746139320	OXLHJMWLJNOSML-CABCVRRESA-N	440.522	1.160	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCCCC(=O)NNC(=O)CCOc2ccccc2)cc1C	747180993	BJWOMJNOPRSYBC-UHFFFAOYSA-N	433.530	1.978	50	20	IDGD	
Cn1ccnc(NNC(=O)c2nn(-c3cccc(Br)c3)c3c2CCC3)c1=O	747938837	QVSRMDSRSALHIN-UHFFFAOYSA-N	429.278	1.974	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2nn(-c3ccc(OC)cc3)cc2O)c2ccccc2c1=O	748009506	RBWHNKNOCBOZSQ-UHFFFAOYSA-N	448.439	1.391	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)N[C@H]1CCN(c2ccc(Br)cc2)C1	748629741	DOTGFEQDENDTGV-JSGCOSHPSA-N	429.315	1.410	50	20	IDGD	
COCCNS(=O)(=O)c1cccc(C(=O)NNc2ccc([N+](=O)[O-])cc2Cl)c1	748710800	ZMJZNIUWFSINRN-UHFFFAOYSA-N	428.854	1.930	50	20	IDGD	
O=C(Cc1ccc(Cl)cc1)NNC(=O)[C@H]1CCCN1S(=O)(=O)c1cccs1	749162085	WDZKYMDALRVOGA-CQSZACIVSA-N	427.935	1.945	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCCCc2nc(C(C)C)no2)nc1	749356380	KSUBSARRFQZTCN-UHFFFAOYSA-N	425.515	1.534	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)[C@@H]1CCCN1C(=O)c1ccc2c(c1)OCO2	749563806	QUOZDCWWFOUDMS-HNNXBMFYSA-N	435.440	1.437	50	20	IDGD	
CN(C)[C@H]1CCC[C@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)C1	749592859	WXYRKPFPKJMBFF-IRXDYDNUSA-N	437.566	1.288	50	20	IDGD	
CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)OCC(=O)NNC(=O)c1cccs1	750410598	SOCRQEBTYHRFFB-MRXNPFEDSA-N	446.460	1.420	50	20	IDGD	
CCCCc1ccc(N2C[C@H](C(=O)NNC(=O)CNC(=O)c3ccco3)CC2=O)cc1	751201058	FLAKWHINXWTFAC-MRXNPFEDSA-N	426.473	1.553	50	20	IDGD	
COc1cc(NC(=O)CNC(=O)NNC(=O)Cn2ccc3ccccc32)cc(OC)c1	752009854	IEXPYHTVMGIQRX-UHFFFAOYSA-N	425.445	1.628	50	20	IDGD	
CCOc1ccc(/C=C(\C#N)C(=O)N2CCC[C@H](S(=O)(=O)N(C)CCOC)C2)cc1	754707763	FWADIJWNSVZMFP-GJPUVDBCSA-N	435.546	1.891	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)Nc1cccc(S(=O)(=O)NC2=NCCCCC2)c1	755494413	GDXICVZKYAKKQO-UHFFFAOYSA-N	433.494	1.435	50	20	IDGD	
CCCCNC(=O)[C@@H]1CC[C@@H](C)N(CC(=O)NNC(=O)c2ccc(OC)c(OC)c2)C1	756499710	CFZQLGKRROFJQV-NVXWUHKLSA-N	434.537	1.482	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1N1CCOC1=O	756816879	CCLKGPDLDVEMOT-QGZVFWFLSA-N	428.401	1.645	50	20	IDGD	
CCOC(=O)C(C)(C)n1cc(NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cn1	757721289	VFUZAIQGEUHBIJ-UHFFFAOYSA-N	444.496	1.041	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)c(C)n1C1CCCCC1	758039133	HTTSLWUYQKIYJY-FMNVXAMXSA-N	435.550	1.602	50	20	IDGD	
CCOCCCn1c(NNC(=O)[C@H](C)n2nnnc2C(C)(C)C)nc2ccccc2c1=O	758167908	IFTHRSFKTYSCGE-AWEZNQCLSA-N	442.524	1.811	50	20	IDGD	
O=C(Cc1nn2c(C3CCCCC3)nnc2s1)NNC(=S)NC[C@@H]1CCCCO1	758177931	ZMZLZJYFJXGZFJ-ZDUSSCGKSA-N	437.595	1.840	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)N[C@@H]1CCc2c[nH]nc2C1	758905516	DVHMESJHESMOEA-MRXNPFEDSA-N	446.533	1.086	50	20	IDGD	
Cc1cc(S(C)(=O)=O)cc(C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c1C	758941255	AZOISFNLXOOQTM-UHFFFAOYSA-N	449.441	1.233	50	20	IDGD	
O=C(NNc1ncccc1[N+](=O)[O-])C1CCN(C2=NS(=O)(=O)c3ccccc32)CC1	759292820	YWZALUXMUASUFJ-UHFFFAOYSA-N	430.446	1.294	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)c1ccccc1)C(=O)NNc1ncccc1[N+](=O)[O-]	759302444	RONUBHWFPUEZIJ-ZDUSSCGKSA-N	425.492	1.533	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)c1cc(S(=O)(=O)N(C)C)oc1C	761626187	UIOMAHVCRGTIAU-UHFFFAOYSA-N	427.504	1.400	50	20	IDGD	
CC(=O)N1C=Cc2ccccc2[C@@H]1CC(=O)OCC(=O)NNC(=O)Cc1nc(C)cs1	762421424	LXCFNLRNSBYEOL-KRWDZBQOSA-N	442.497	1.649	50	20	IDGD	
N#C/C(=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)NCC1(CO)CC1	762688519	NKJZBTVABNMFQN-DHDCSXOGSA-N	427.892	1.875	50	20	IDGD	
CC(=NNC(=O)[C@H](C)CN1CCCCCC1)c1c(C)nn(CCS(C)(=O)=O)c1C	763153231	AJRAIPFQGPRCDE-OAHLLOKOSA-N	425.599	1.897	50	20	IDGD	
COC(=O)c1c(C)oc(C)c1S(=O)(=O)NNC(=O)CCCNC(=O)OC(C)(C)C	763439786	SLDHPFLUNWHTMV-UHFFFAOYSA-N	433.483	1.297	50	20	IDGD	
CCOC(=O)c1cnn(-c2cccc(NC(=O)C(=O)NNC(=O)c3cccnc3)c2)c1C	763494550	HJRMKBIBJDFKBN-UHFFFAOYSA-N	436.428	1.152	50	20	IDGD	
CC(C)(C)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1	763573416	RZYVIQXYEZCQEF-KRWDZBQOSA-N	425.441	1.841	50	20	IDGD	
Cc1ccc(Oc2ccc(NC(=O)C(=O)NNC(=O)[C@@H]3COc4ccccc4O3)cc2)nn1	763574446	BGJPWVYZPOTDDW-SFHVURJKSA-N	449.423	1.503	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccc(NC(=O)C(C)C)c1	763679655	BWYFGZHRRFXGAX-UHFFFAOYSA-N	442.472	1.845	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccn(-c2ncccc2F)n1	763716756	LWLYGFVZYOLWTH-UHFFFAOYSA-N	426.408	1.134	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)c2cc([N+](=O)[O-])ccc2SCCO)cc1	763746658	KDXQDSBCJCCEMG-UHFFFAOYSA-N	433.442	1.606	50	20	IDGD	
CN(C)CCCOc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(N(C)C)c2)cc1	763757086	AZSVGABURHONPQ-UHFFFAOYSA-N	427.505	1.483	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)Nc3ccccc3OC)c2)on1	763835048	VBTKVZCYXUGTCL-UHFFFAOYSA-N	446.441	1.567	50	20	IDGD	
Cc1cc(S(C)(=O)=O)ccc1NC(=O)C(=O)NNC(=O)Cc1c[nH]c2ccccc12	763861420	QRRDGASZCXPKLU-UHFFFAOYSA-N	428.470	1.208	50	20	IDGD	
Cc1ccc(Br)cc1NC(=O)C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	763917023	NUXLAZZFBRDVLG-UHFFFAOYSA-N	444.249	1.133	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)C(=O)Nc1ccnn1Cc1ccc(Br)cc1	763993251	MWPBWTHREDKDLL-UHFFFAOYSA-N	445.277	1.432	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)ccc1C(=O)NC(C)C	764005687	FFMKCYIKYGESBB-UHFFFAOYSA-N	440.456	1.304	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)n([C@@H]2C[C@H]3CC[C@H]2C3)n1	764006351	PLCMVDPPMGAXER-OFQRWUPVSA-N	439.472	1.724	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc(CNC(=O)OC(C)C)cc1	764042776	MHKHUQWEJVJDIN-UHFFFAOYSA-N	428.445	1.730	50	20	IDGD	
C#CCOc1cc(F)ccc1NC(=O)C(=O)NNC(=O)c1cccc(Br)c1	764059062	OJWGETCMWCOMLJ-UHFFFAOYSA-N	434.221	2.000	50	20	IDGD	
CNC(=O)c1ccc(OC)c(NC(=O)C(=O)NNC(=O)Cc2ccc3ccccc3c2)c1	764092525	WUIQOQMWBKZOIS-UHFFFAOYSA-N	434.452	1.537	50	20	IDGD	
CCC(C)(C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(C)[nH]n2)cc1Cl	764100099	VKRUKLVHDCADPV-UHFFFAOYSA-N	434.884	1.690	50	20	IDGD	
CN(C)CC1CCN(c2ccc(NC(=O)C(=O)NNC(=O)c3cccc(C#N)c3)cc2)CC1	764236723	FLYVTRWZSKGHDW-UHFFFAOYSA-N	448.527	1.736	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(OCCc3ccccc3)nc2)c1	764238240	RKIABMPUIFFCLI-UHFFFAOYSA-N	429.436	1.974	50	20	IDGD	
CCOC(=O)c1cc2cc(NC(=O)C(=O)NNC(=O)Cc3cccnc3)ccc2s1	764267171	AHOZRZXDFUIBOU-UHFFFAOYSA-N	426.454	1.802	50	20	IDGD	
CN(C)c1nnc(-c2ccc(NC(=O)C(=O)NNC(=O)C(C)(C)c3ccccc3)cc2)o1	764309559	QHMXCHREZUUMGJ-UHFFFAOYSA-N	436.472	1.866	50	20	IDGD	
CCNS(=O)(=O)c1ccc(CNC(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)cc1	764372899	DYPKRBBGDYPINN-ZDUSSCGKSA-N	438.481	1.422	50	20	IDGD	
CCC(=O)Nc1ccc(C)c(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)c1	764404783	NTWKJWQUCQQCOM-UHFFFAOYSA-N	430.486	1.927	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NN=Cc3ccc(S(C)(=O)=O)cc3)CC2)cc1	764828925	CRGIRISWCOZIMI-UHFFFAOYSA-N	428.558	1.666	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNS(=O)(=O)c1cc2ccccc2o1	765117499	GZYMLWFJARDMDK-UHFFFAOYSA-N	442.497	1.200	50	20	IDGD	
Cc1cccc(N2C(=O)N[C@@H](CCC(=O)NNC(=O)CSc3ccccc3O)C2=O)c1	765250404	RUBXKFLYVZXYQQ-HNNXBMFYSA-N	442.497	1.845	50	20	IDGD	
CN(C)C(=O)NNC(=O)CSc1nnc(COc2ccccc2)n1Cc1ccco1	765328418	FQWNJKABLXKTPG-UHFFFAOYSA-N	430.490	1.893	50	20	IDGD	
CC(C)n1cc2c(n1)[C@@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)CCC2	765917967	PUVNKIFKFKTIJD-KRWDZBQOSA-N	448.549	1.736	50	20	IDGD	
N#CCn1c(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cc2ccccc21	766635682	CLWBZLIPNDTZBP-UHFFFAOYSA-N	444.495	1.384	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCC[C@H]1C[C@H](O)c1cnn(C)c1	766945452	KNDGPDGJPLJVKS-RDJZCZTQSA-N	435.912	1.431	50	20	IDGD	
Cc1cc(OCC(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc(C)c1Cl	767526453	ANPXTKDUMQAWNT-QGZVFWFLSA-N	448.859	1.866	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)CSc2nnnn2C2CCCC2)n[nH]1	768273615	HTUBVGKVBSBSQC-UHFFFAOYSA-N	442.505	1.740	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)c1ccc2nc[nH]c2c1	768292299	XYZRLYDGXAJSCY-UHFFFAOYSA-N	426.908	1.795	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)CN2C(=O)N[C@]3(CCCC(C)(C)C3)C2=O)cn1	768571910	YCGXBXDCLQTCDR-IBGZPJMESA-N	434.522	1.299	50	20	IDGD	
Cn1cc(NS(=O)(=O)c2ccsc2C(=O)NNc2cc(C#N)cc(Cl)n2)cn1	768712771	WDUIYTISQJOSFQ-UHFFFAOYSA-N	437.894	1.959	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2ccc3c(c2)COC3)c1	770419316	QJHAHLJWWZRPAZ-UHFFFAOYSA-N	446.529	1.892	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)cc1-n1cnnn1	770507498	BGHKGDVXWPODSR-NSHDSACASA-N	431.840	1.945	50	20	IDGD	
CCOC(=O)N1CC[C@@H](NC(=O)NNC(=O)Nc2cc(Cl)c(OC)cc2OC)C1	770530743	IJKVJPNCMJKBFD-SNVBAGLBSA-N	429.861	1.924	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)c1	770649200	NBUWKQSVXRTLKT-NSHDSACASA-N	436.852	1.800	50	20	IDGD	
CCOC(=O)CON=C(C(=O)NNC(=O)c1cc2c(s1)CC[C@@H](C)C2)c1cc[nH]n1	770823284	MHRDFCVNXMIGLN-LLVKDONJSA-N	433.490	1.341	50	20	IDGD	
C[C@H]1CN(C(=O)NNC(=O)c2cccc3ccccc23)CCN1c1nccn2cnnc12	771211430	FWWGJMKBIOMFHP-HNNXBMFYSA-N	430.472	1.843	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1ccc2ncc(I)n2c1	772167203	JHEFRKFMRWDMCP-MRVPVSSYSA-N	430.202	1.042	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CN(C)[C@H](C(N)=O)c2cccc(Br)c2)cc1	772399336	MMHKUZHWXKPFGK-KRWDZBQOSA-N	433.306	1.677	50	20	IDGD	
CC[C@@H](N=c1nn[nH]n1-c1ccccc1)C(=O)NNC(=O)[C@H](C)Oc1cccc(Cl)c1	772966834	KYMQBIGSXBPWFY-SUMWQHHRSA-N	443.895	1.543	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNS(=O)(=O)c1ccc(Br)cc1F	775278039	WAVPQEMYPOZYCD-UHFFFAOYSA-N	436.284	1.389	50	20	IDGD	
O=C(NNC(=O)c1c(Cl)cccc1Cl)N[C@@H]1CCO[C@@]2(CCS(=O)(=O)C2)C1	776075766	DVFGOKXYJSLEFB-HWPZZCPQSA-N	436.317	1.674	50	20	IDGD	
O=C1C[C@@H](C(=O)N2CCN(S(=O)(=O)CBr)CC2)c2ccc(F)cc2N1	777778086	WITIJOKFBKROAL-GFCCVEGCSA-N	434.287	1.078	50	20	IDGD	
O=C([C@H]1SCCc2sccc21)N1CCN(S(=O)(=O)CBr)CC1	777779631	OZGRKJMUAPOKQL-LBPRGKRZSA-N	425.395	1.905	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)[C@@H]1CCCN(c2ncnc3sccc23)C1	778433230	GTOKVUZGZLDEFY-GFCCVEGCSA-N	434.522	1.580	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)c2cccc(NS(=O)(=O)C(F)(F)F)c2)cc1	782537456	LGNUYBAXDFGFJQ-UHFFFAOYSA-N	442.375	1.660	50	20	IDGD	
CC(C)(C)OC(=O)N1CCc2[nH]nc(C(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)c2C1	782659632	QZFBIKJDICSTEQ-UHFFFAOYSA-N	430.421	1.686	50	20	IDGD	
CNS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccccc2Br)cc1	782989236	UUZXZEVEYRTAEI-UHFFFAOYSA-N	427.280	1.439	50	20	IDGD	
CCOC(=O)[C@@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNc2ccc(F)cc2C)cc1	783450173	ZSIQKXRWILQGPW-CYBMUJFWSA-N	430.436	1.897	50	20	IDGD	
O=C(NNc1ccnc(F)c1)C(=O)Nc1cc(N2CCCS2(=O)=O)ccc1Cl	784846607	DAOVRMSARSNNMA-UHFFFAOYSA-N	427.845	1.496	50	20	IDGD	
CC(=O)N1CCN(Cc2ccccc2NC(=O)C(=O)NNc2cc(C)ccc2F)CC1	784884287	PWLUBHGWLNPCKQ-UHFFFAOYSA-N	427.480	1.880	50	20	IDGD	
O=C(NNc1ccc(C(F)(F)F)nn1)C(=O)Nc1ccc(N2CCOCC2)c(F)c1	784891705	ZKTOMWNLAZUUDH-UHFFFAOYSA-N	428.346	1.553	50	20	IDGD	
Cn1ncc(C(=O)NNC(=O)CCN2CCN(C(c3ccccc3)c3ccccc3)CC2)n1	785686140	GHRBVMJPENKRAK-UHFFFAOYSA-N	447.543	1.373	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)[C@H]2CN(C)C(=O)c3ccccc32)cc1C	787098278	YYCAFUXIQJSWDM-HNNXBMFYSA-N	429.498	1.793	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)cc1N1CCNC1=O	787542542	NEYBHSZSZSTHLW-UHFFFAOYSA-N	431.836	1.283	50	20	IDGD	
CN1CCN(C(=O)NNC(=O)[C@@H]2CCCN2C(=O)c2cc(Cl)cc(Cl)c2)CC1	788167248	ZOXDQEOJYBWKRZ-HNNXBMFYSA-N	428.320	1.586	50	20	IDGD	
CCN(C)C(=O)[C@@H](C)NC(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1	788896894	RSAAVWUGPYKQAE-DYESRHJHSA-N	437.544	1.811	50	20	IDGD	
Cc1ccc(-n2cccn2)cc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccccc1F	789584105	CZACODFXMHGBLX-CQSZACIVSA-N	425.420	1.873	50	20	IDGD	
COc1nc(Br)ccc1NC(=O)C(=O)NNC(=O)COCc1ccccc1	789585853	JCZQRXCHEFKMDB-UHFFFAOYSA-N	437.250	1.155	50	20	IDGD	
Cn1nc([C@@H]2CCCO2)cc1NC(=O)C(=O)NNC(=O)c1c(Cl)cccc1Cl	789735515	QRPPSGISTOTACX-LBPRGKRZSA-N	426.260	1.978	50	20	IDGD	
Cn1nc([C@@H]2CCCO2)cc1NC(=O)C(=O)NNc1c(F)cc(C(=O)NC2CC2)cc1F	789772607	BMGYYMRJKKBLBV-HNNXBMFYSA-N	448.430	1.524	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(=O)n(CC(=O)NNc2ccc(Cl)c(OC)c2)c1	790186794	JJKNQAVCFDIKTD-UHFFFAOYSA-N	442.925	1.684	50	20	IDGD	
C[C@]1(C2CC2)NC(=O)N(c2ccc(CNC(=O)NNC(=O)c3cccc(C#N)c3)cc2)C1=O	790709821	RWNMVOXFNAWBKR-HSZRJFAPSA-N	446.467	1.927	50	20	IDGD	
C[C@]1(C2CC2)NC(=O)N(c2cccc(CNC(=O)NNC(=O)Cc3cccnc3)c2)C1=O	790710637	WRVJOZGXWHCHMZ-JOCHJYFZSA-N	436.472	1.380	50	20	IDGD	
NC(=O)c1ccc(/C=C/C(=O)N2CCC[C@@H]2C(=O)NNc2cccc(F)c2[N+](=O)[O-])cc1	791067397	SJGAIRIRVQZUFS-VGMNTSGFSA-N	441.419	1.980	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)c1cc(NS(C)(=O)=O)cc(C(F)(F)F)c1	792196886	ZPBMXDSFYREDEF-UHFFFAOYSA-N	438.428	1.143	50	20	IDGD	
COC1(CNC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)CCC(C)CC1	792772395	IJHRTLVWXMBJQZ-UHFFFAOYSA-N	425.555	1.827	50	20	IDGD	
CCOC(=O)c1cc(COC)cc(S(=O)(=O)NNC(=O)c2ccc(Cl)nc2)c1	793363532	MEHDAMIVFKMHNZ-UHFFFAOYSA-N	427.866	1.681	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1cc(N2CCOCC2)ccc1C	797535958	TUOGEUBJCNYZKB-UHFFFAOYSA-N	426.473	1.169	50	20	IDGD	
CSc1c(F)cccc1C(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1	797789195	COTMNTZJYIFSCR-UHFFFAOYSA-N	425.507	1.938	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2CCCN2C(=O)OCC(F)(F)F)cc1C	798307921	JBGWTRAOKVGCJJ-CYBMUJFWSA-N	430.383	1.553	50	20	IDGD	
COc1ccccc1-n1ncc(C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c1C	798829796	JZRCLKPCPZCLEY-UHFFFAOYSA-N	432.440	1.511	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCCc1ccc2[nH]ccc2c1	799353399	NQIUENGOUQREBU-UHFFFAOYSA-N	428.518	1.956	50	20	IDGD	
CNS(=O)(=O)c1ccccc1S(=O)(=O)NNC(=O)c1cc(C)nc2ccccc12	799518209	AEYAJBYISPELTR-UHFFFAOYSA-N	434.499	1.075	50	20	IDGD	
COCCn1cc(CNC(=O)NNC(=O)[C@H](C)Oc2cccc(Br)c2)cn1	799859313	GDOOAOZFJWQRNB-LBPRGKRZSA-N	440.298	1.590	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)NS(=O)(=O)c2cnc3n2CCC3)c(C)n1C[C@H]1CCCO1	802206984	PMZNAKKMZOAVAQ-WAFWZSCLSA-N	443.529	1.839	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)CNC(=O)c2ccc(Br)o2)cc1	802265396	SRVBMOFDWKRKTQ-UHFFFAOYSA-N	438.234	1.085	50	20	IDGD	
Cc1noc(C)c1S(=O)(=O)N1CCC(C(=O)NNc2ccc3c(=O)[nH]ccc3c2)CC1	803435280	SGEYOLGHXCXGPH-UHFFFAOYSA-N	445.501	1.677	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)NC[C@H](N2CCOCC2)C(F)(F)F)cc1OC	805844872	OJDLJDJXUCFSPT-INIZCTEOSA-N	448.442	1.691	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2c(C)c(C(F)(F)F)nn2C)c1	806974695	ROYMIAMUPJBNIB-UHFFFAOYSA-N	429.355	1.164	50	20	IDGD	
COCCNC(=O)c1cccc(NC(=O)C(=O)NNc2ccc(Cl)cc2[N+](=O)[O-])c1	806997510	IAHZZCYIARKCGJ-UHFFFAOYSA-N	435.824	1.706	50	20	IDGD	
COc1cc(Br)cc(C)c1NC(=O)C(=O)NNc1ccc(-n2ccnc2)nn1	807428484	FNYUALWWEHDAKE-UHFFFAOYSA-N	446.265	1.824	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)NCc2ccccc2S(N)(=O)=O)cc1	807604922	GLQJVYRAVPWVHS-ZDUSSCGKSA-N	436.490	1.031	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)NCc1ccncc1OC[C@@H]1CCOC1	807616736	WMXHYRRRSXAWJH-CQSZACIVSA-N	432.502	1.825	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CN2CCCC[C@@H]2COC(=O)NC2CCCC2)c1	810035279	NKABSYCYDZKDTJ-LJQANCHMSA-N	427.505	1.843	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)C(=O)Nc1ccc(-n2ccc(C(F)(F)F)n2)cc1	810387084	DXYWBWJXVLYZQS-UHFFFAOYSA-N	432.362	1.615	50	20	IDGD	
Cn1ncc(COC(=O)/C(C#N)=C\c2cn(CCC(N)=O)nc2-c2ccc(Cl)cc2)n1	811031427	RDNUXNHPCWZFDS-ZSOIEALJSA-N	439.863	1.858	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(C(=O)NNC(=S)Nc2ccc(C)c(C)c2)cc1	811256384	IFPGVWPOKVJGRC-UHFFFAOYSA-N	436.559	1.860	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(C(F)(F)F)s1)c1csc(N2CCOCC2)n1	812269787	VFTUTBLIDNFGPW-UHFFFAOYSA-N	442.466	1.683	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NC/C=C/CNC(=O)OC(C)(C)C)nc1	812469513	OXKSRZONWSACSX-VOTSOKGWSA-N	442.542	1.475	50	20	IDGD	
CN(C/C=C\C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)CC(F)(F)F	814361301	UFYBWEABNAYYDV-YVMONPNESA-N	448.467	1.282	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)CN1C(=O)N[C@]2(C[C@H](C)CC(C)(C)C2)C1=O	825615292	PXNFNJHHNMZNIH-PEBXRYMYSA-N	445.520	1.391	50	20	IDGD	
COCc1c(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)oc2ccccc12	849206867	BBOTYROCLCTDOJ-GOSISDBHSA-N	440.408	1.723	50	20	IDGD	
CC(C)(C)c1ccc(C(=O)NCCC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1	913155414	HKWPEJMVSJBWNS-UHFFFAOYSA-N	435.488	1.541	50	20	IDGD	
Cc1ccc(NC(=S)NNC(=O)CNS(=O)(=O)c2c(F)cccc2F)c(C)c1	913425996	RECXCJWNQWYFHD-UHFFFAOYSA-N	428.486	1.878	50	20	IDGD	
C[C@@]12CCC(=O)N1c1ccccc1C(=O)N2CC(=O)NNC(=O)Cc1c[nH]c2ccccc12	913557500	BVAIXDPBNZESEY-DEOSSOPVSA-N	445.479	1.857	50	20	IDGD	
COc1nn(C)c2nc(C)c(CCC(=O)NNC(=O)c3nnc(O)c4ccccc34)c(C)c12	914750561	MVSZUZHKZAYHMG-UHFFFAOYSA-N	449.471	1.636	50	20	IDGD	
O=C(COC(=O)c1cc(-c2ccc(F)cc2)[nH]n1)NNC(=O)c1ccc([N+](=O)[O-])cc1	915000162	GCSQUKICQBUOSN-UHFFFAOYSA-N	427.348	1.742	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2ccc(Cn3ccnc3)cc2)cc1	915058654	TZXPITKUWAAMRO-UHFFFAOYSA-N	441.513	1.322	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)cc(OCC)c1OCC	915880343	ITQSYAYIMJBATK-CYBMUJFWSA-N	429.495	1.014	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)COc1ccc(F)cc1)c1ccc(S(=O)(=O)N(C)C)cc1	918105649	SZHNMJIIGSXDTD-ZDUSSCGKSA-N	438.481	1.546	50	20	IDGD	
O=C(COc1ccc(CCNC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1)NC1CC1	918106383	YKNIXRPZUJFVCE-UHFFFAOYSA-N	441.444	1.439	50	20	IDGD	
CCN1CCN(CCCCNC(=O)NNC(=O)c2ccc(F)cc2Br)CC1	918209854	WEDDBUFSPOBOKO-UHFFFAOYSA-N	444.349	1.950	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCc2cccc(N3CCOC3=O)c2)nc1	919657784	JYZIJKIIMQXKPN-UHFFFAOYSA-N	448.505	1.551	50	20	IDGD	
CNC(=O)NNC(=O)[C@H](CCSC)NS(=O)(=O)c1cc(Cl)ccc1Cl	919877913	MCECZQYFXNEYGZ-JTQLQIEISA-N	429.351	1.354	50	20	IDGD	
CCOCCOc1ccc(S(=O)(=O)NNC(=O)c2nnc(-c3ccccc3)o2)cc1	920395048	KQKCLEPPLDHTKL-UHFFFAOYSA-N	432.458	1.775	50	20	IDGD	
O=Cc1cccc(OCc2cccc(C(=O)NNC(=O)N[C@H]3CCS(=O)(=O)C3)c2)c1	1251736880	GLRMKZTVDFDHSS-KRWDZBQOSA-N	431.470	1.209	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)c2ccnc(NC(=O)C3CC3)c2)CC1	1257438231	RTQFSNMNQSLPPR-UHFFFAOYSA-N	431.493	1.838	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@@H]2CCCCN2Cc2ccncc2)cc(OC)c1OC	1318313811	RUCORNFARJULCT-KRWDZBQOSA-N	428.489	1.923	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)Cn1cc(C(F)(F)F)ccc1=O	1319229635	JSWJBIDGVWDRNX-UHFFFAOYSA-N	425.363	1.109	50	20	IDGD	
CN(CC(=O)NNc1nncc(N)c1Cl)S(=O)(=O)c1ccc(Br)cc1	1333586258	DPGJDSJMQQKGEP-UHFFFAOYSA-N	449.718	1.239	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc4cnccc4nc3C)C2)C1	1778441479	RRSQDNRQTMPWJF-DYESRHJHSA-N	432.908	1.636	50	20	IDGD	
CCCC(=O)N[C@H](C)C(=O)N1CC[C@@]2(CN(C(=O)[C@@H](Br)CC)CCO2)C1	1779259076	XFPPUNXQZUQURV-GLJUWKHASA-N	432.359	1.295	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)CS(=O)(=O)c3ccc(C)cc3)CCO2)C1	1781213145	MIBQZGZLGJAJPE-XLIONFOSSA-N	442.965	1.616	50	20	IDGD	
Cn1ncc2c(C(=O)N3CCO[C@@]4(CCN(C(=O)[C@H](F)Br)C4)C3)cccc21	1781329481	GNHPBRLZKADJMR-MAUKXSAKSA-N	439.285	1.707	50	20	IDGD	
Cc1nccn1CC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@](C)(Cl)CCl)C2	1781558408	RVFALYSTIACZAC-AYOQOUSVSA-N	431.364	1.942	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)Cc2cc[nH]n2)C1	1781563550	FXZRHFQLPLJMCW-DDUZABMNSA-N	427.343	1.497	50	20	IDGD	
O=C(c1onc2ccccc12)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1782348758	BNCJQRYZHPEFRJ-WMLDXEAASA-N	426.242	1.962	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](C)CN(CC)CC)C2)C1	1782701719	HIXYBLUMEYIKIG-GJYPPUQNSA-N	432.403	1.968	50	20	IDGD	
CC(=O)N[C@H](C)C(=O)N1CC[C@@]2(CN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)CCO2)C1	1783180583	BKXFQSHTVIZQNK-JPIHKZNQSA-N	446.454	1.226	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)CCc3cncnc3)CCO2)C1	1783342909	QHMBDTUYZLFMDO-CRAIPNDOSA-N	425.327	1.413	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccnc4c(O)cccc34)CCO2)C1	1783881851	NDUGDNOGMGTWIC-IERDGZPVSA-N	433.892	1.638	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc(Cl)c(F)c3)C[C@@H]21)[C@@H](O)CCl	1784084028	KGTMVWPIGNBMND-PYTWLRIVSA-N	433.307	1.601	50	20	IDGD	
CCOC(CC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2)OCC	1784161285	WZHDRXOHFBNFFS-KSSFIOAISA-N	435.359	1.637	50	20	IDGD	
C[C@H](CN)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C[C@@H]21	1786785848	FKABUDWUJWVACZ-CAVRUCQQSA-N	432.471	1.446	50	20	IDGD	
CC(=O)NC(C)(C)C(=O)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1	1788140459	SBQCWSNKCOMMLG-UHFFFAOYSA-N	437.305	1.029	50	20	IDGD	
Cn1cc(CCC(=O)Nc2ccc(C3(NC(=O)c4ccc(B(O)O)cc4)CCC3)cc2)cn1	1788175949	XYMMFOXPDOBXML-UHFFFAOYSA-N	446.316	1.480	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1ccc(C2CC2)cc1	1790251643	BCYVJCANAFKFME-PMVMPFDFSA-N	448.328	1.151	50	20	IDGD	
CCOC(=O)O[C@@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21	1790607994	URWVRJHVMRPXBR-XUXIUFHCSA-N	435.315	1.313	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]3C2)nc2nccn12	1791295879	KAZSFDMKIWCKEL-OBJOEFQTSA-N	426.304	1.435	50	20	IDGD	
C[C@@H](Cc1ccccc1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]21	1791449687	KDBHSNZGODSZMD-VMXMFDLUSA-N	444.576	1.218	50	20	IDGD	
Cc1nn(-c2ccccc2)c(O)c1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2	1794327890	XHNITWAKWYNOMW-RMHZUWNSSA-N	436.871	1.624	50	20	IDGD	
O=C(CCBr)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C(F)(F)C(F)(F)C(=O)O)C2	1795491101	MLJSYIWHVWSYPZ-AYMMMOKOSA-N	433.196	1.765	50	20	IDGD	
CC(C)c1nn2ccccc2c1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2	1796080421	UTZKTRMNUAGRDE-MVWRLGRASA-N	434.924	1.261	50	20	IDGD	
Cc1c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](O)CCl)C3)[nH]c2c(Cl)cccc12	1796264490	DWAYDXHCHYRWSW-DJZPMSPPSA-N	440.327	1.933	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1nn(-c2ccccc2)c2c1COC2)[C@H](O)CCl	1796559397	MTIKCHOMLXMPKM-PSFFPDNBSA-N	444.919	1.754	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc2c[nH]nc2c1	1796634981	SVADOURQYGFNLL-DIWZVOJHSA-N	447.499	1.949	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2)C1=C2c3ccccc3C(=O)N2CC1	1798449993	RMOJFZAVTSYUOD-XBCDXLOZSA-N	433.867	1.381	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc(OC)cc1[N+](=O)[O-])C2	1799267953	GVNNIFBTYJPYKY-MVWRLGRASA-N	439.896	1.753	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1n[nH]c2cc(Cl)ccc12)[C@@H](O)CCl	1799847521	ZCSPHLXFGYUORU-LKQDWFRTSA-N	425.316	1.997	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnc2c(c1)NC(=O)CS2	1800037983	ZDUREFUEWKEUCI-OQMKEHIESA-N	438.937	1.346	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)Br)C1	1800762851	HHDOQUULAYPDJF-FBRBKTQXSA-N	445.354	1.339	50	20	IDGD	
CCOC(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@](C)(Cl)CCl)C2)OCC	1801149585	QMGYCINWHRKSFR-VLWCASSMSA-N	425.353	1.602	50	20	IDGD	
C[C@@H](C#N)c1cccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)c1	1803680211	AAGAPFHGZMJRJE-FZDIXFNVSA-N	446.511	1.878	50	20	IDGD	
Cc1csc(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)c1	1803770639	KOHAKORTWFDHIX-WIYYLYMNSA-N	449.341	1.765	50	20	IDGD	
Cn1cccc(C(=O)NC[C@H]2CCN(C(=O)CCBr)[C@@H]2c2cccnc2)c1=O	1803829048	DPSJTLKSVDTURC-CRAIPNDOSA-N	447.333	1.885	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC2(CCCN(C(=O)[C@@H]3CCC(F)(F)C3)C2)CC1	1804770238	ZFPIQDMZNSPHCK-OAHLLOKOSA-N	449.502	1.965	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)[C@H](C)N2CCN(C)CC2)[C@H]1c1cccnc1	1808273590	DKFBCSYVUCFNNY-RNQOJCNYSA-N	436.000	1.741	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H](CNC(=O)c2cc(O)nc(O)n2)[C@@H]1c1cccnc1	1808304108	USBAPAVSBAJSKG-KDOFPFPSSA-N	445.552	1.454	50	20	IDGD	
CN1C(=O)CC[C@H]1C(=O)N1CC[C@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]1c1cccnc1	1808306117	ZBCMFELKYCWCJA-MJEZEWASSA-N	441.359	1.945	50	20	IDGD	
Cc1nc(CC(=O)N2CC[C@H](CNC(=O)CO[Si](C)(C)C)[C@H]2c2cccnc2)no1	1810540404	MYJYYFACSGLDLU-OXQOHEQNSA-N	431.569	1.873	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H]1CCN(C(=O)CN)[C@@H]1c1cccnc1	1811357935	CMSKEDWEJXDNPB-FOIQADDNSA-N	441.444	1.193	50	20	IDGD	
O=C(COc1ccc(O)nn1)NC[C@H]1CCN(C(=O)C(Cl)Cl)[C@@H]1c1cccnc1	1812353461	QBGRREZDYFXNDK-MLGOLLRUSA-N	440.287	1.466	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2cnncc2C(=O)O)[C@H]1c1cccnc1	1813031978	STWIBAHKFNEQMR-JQFCIGGWSA-N	447.879	1.143	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)C2CCC(O)CC2)[C@@H]1c1cccnc1	1813075043	WXQVZHQUXOOEAW-REMCXBOUSA-N	445.564	1.012	50	20	IDGD	
Cc1nnc(CCC(=O)N2CCCC[C@H]2c2cc(NC(=O)[C@@H](O)CCl)n[nH]2)s1	1814868375	YYOURQYZFFCHKG-STQMWFEESA-N	426.930	1.794	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](O)C(C)C)n[nH]1	1814944914	VEKPHDDMHVMAPP-BZEWVUQVSA-N	443.508	1.553	50	20	IDGD	
Cc1ccoc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnccc1C(=O)NN)CC2	1817420841	SUPUGMQFHOFWMG-LLVKDONJSA-N	440.485	1.583	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)CCc2ccco2)[nH]n1)c1ccc(B(O)O)cc1	1817471056	QMJYIYYMZRLTGI-IBGZPJMESA-N	436.277	1.621	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2[C@@H]3C=CS[C@@H]23)[nH]n1)c1cccc(B(O)O)c1	1817476843	FDJOGIIDTGGBFN-IAAVTCLWSA-N	438.318	1.271	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](N)Cc2cscn2)[nH]n1	1822368490	GBSXFEVUIJSOTH-IPYPFGDCSA-N	440.957	1.682	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCc1ccc(O)nn1)CC2	1826004853	SMNWQDYXESBWJL-NWDGAFQWSA-N	439.925	1.437	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](C)Cn1ccnc1)CC2	1826008712	GAKSCWBCYZECDH-XQQFMLRXSA-N	425.942	1.842	50	20	IDGD	
CSCC(C)(C)C(=O)N[C@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1	1826083838	SVMPAYPIQAJBEX-LBPRGKRZSA-N	441.623	1.817	50	20	IDGD	
COCc1c[nH]c(C(=O)N[C@@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)c1	1826088658	ZQFOADMZCNYVRU-CYBMUJFWSA-N	448.549	1.216	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CCBr)CC1	1826357341	WWPOFVLJJAMDNM-GJZGRUSLSA-N	431.375	1.838	50	20	IDGD	
C=C1CC(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)CC2)C1	1828921749	AITCXBXKRJJAMM-HXUWFJFHSA-N	425.533	1.885	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnc(Cl)nc3)CCO2)C1	1829514232	RYZXNZAMWVXBML-GOSISDBHSA-N	431.320	1.465	50	20	IDGD	
Cc1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)c1F	1830101954	YYGFLUKHSJXUJS-YJBOKZPZSA-N	447.276	1.895	50	20	IDGD	
C[C@H](Nc1nccs1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830358047	OSHWZHNNCVDCEH-IFXJQAMLSA-N	444.985	1.665	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4n(n3)CCCO4)C2)C1	1830362288	PWNNBMPLZFXCHW-HXUWFJFHSA-N	440.928	1.001	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3ccc[nH]3)C2)C1	1830538714	NOCMTNSRBAUNIG-KXBFYZLASA-N	442.354	1.435	50	20	IDGD	
Cc1n[nH]c(C)c1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2	1830539097	AYFPIUUHLPHUJP-SGTLLEGYSA-N	443.342	1.128	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4ccccn4n3)C2)C1	1831647444	VBJSDVGEEYFZTH-UTKZUKDTSA-N	434.924	1.812	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3ccn4ccnc4c3)CC2)CC1)[C@H](O)CCl	1833310574	SAXRARDSUBGDTQ-GOSISDBHSA-N	433.940	1.119	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)cn1	1833998960	AWEKONXAFWAFRA-RBUKOAKNSA-N	430.332	1.696	50	20	IDGD	
O=C(C1CCC(CO)CC1)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836715058	IDQQCHFTDFVITL-RJYAGPCLSA-N	430.973	1.383	50	20	IDGD	
Cn1cc(C(=O)N2CCC(OC3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)c2cccnc21	1836717631	ZNQMQBKABGUPME-IBGZPJMESA-N	448.951	1.785	50	20	IDGD	
COc1ccc(C(=O)N2CCC(OC3CCN(C(=O)[C@H](O)CCl)CC3)CC2)c(O)c1	1836718230	LUFPMYYDVPEICW-LJQANCHMSA-N	440.924	1.613	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)Nc1ccccc1)CCO2	1837341742	LAEKNSGLVSMCSP-PLMTUMEDSA-N	439.940	1.197	50	20	IDGD	
C[C@@H](Cn1cncn1)C(=O)N1CCC(OC2CCN(C(=O)C(Cl)Cl)CC2)CC1	1838421399	QCZPEJLWYUTNGA-ZDUSSCGKSA-N	432.352	1.717	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3[nH]cc4c3CCC4)CCO2)C1	1838454840	VDAVQAXYBMMYGW-PMACEKPBSA-N	444.359	1.810	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)ccn1	1839153900	VQPDJNKFGQMHHE-RBUKOAKNSA-N	430.332	1.696	50	20	IDGD	
Cc1nccn1[C@H](C)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2	1839156528	RYQWXBKEYMBCFY-ZMYBRWDISA-N	447.363	1.445	50	20	IDGD	
O=C(c1cc(O)c(O)c(Cl)c1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1839434023	JFHXWXMUTHLHLJ-YOEHRIQHSA-N	437.251	1.356	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3c(C)ccn3C)C2)C1	1839965757	JTTCGWAVEDBUGQ-BEFAXECRSA-N	442.354	1.577	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cc(F)cc(F)c3)C2)C1	1840152132	XYWURGVGKXFCBD-PXNSSMCTSA-N	446.878	1.218	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc4cc(C)[nH]c34)C2)C1	1840152881	XPDOEIVSHGCQLI-AVRDEDQJSA-N	449.935	1.800	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCCc3cccnc3)C2)C1	1840156184	JMZALXNPGKJBBD-RXVVDRJESA-N	439.940	1.115	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(OC)ccc3F)CCO2)C1	1840687088	VWQZEYODORXZCE-OXJNMPFZSA-N	444.887	1.158	50	20	IDGD	
O=C(/C=C\c1c[nH]c2ccccc12)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843010606	KIANKWXOYKAADN-FLIBITNWSA-N	429.285	1.378	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H]2C[C@@H](C[C@@H]2O)[C@H]1C(=O)N1CC2(CCCN2C(=O)[C@H](F)Cl)C1	1843366576	GPWQDKCZZNEOGQ-YTFOTSKYSA-N	445.919	1.483	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1ccc3nonc3c1)C2	1843416044	RXIFYOWHYGJXGO-YDZHTSKRSA-N	435.444	1.174	50	20	IDGD	
Cc1cccc(C)c1SCC(=O)N1CCCC12CN(C(=O)CCC(=O)NN(C)C)C2	1844375638	LWDNOUDSXPNQRN-UHFFFAOYSA-N	432.590	1.972	50	20	IDGD	
O=C(CCBr)N1CC2(CCCN2C(=O)c2cc(=O)nc3sccn23)C1	1844624328	OFAHACAKDAZSJV-UHFFFAOYSA-N	425.308	1.358	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCCC12CN(C(=O)c1cncc(S(C)(=O)=O)c1)C2	1845169358	DTBJXHAADJENAY-MRXNPFEDSA-N	434.345	1.538	50	20	IDGD	
CC(=O)N/C(=C\c1ccco1)C(=O)N1CC2(CCCN2C(=O)[C@H](F)Br)C1	1845219343	JPNQTHIAEHWHBJ-MQJVFOOVSA-N	428.258	1.651	50	20	IDGD	
COc1c(C(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)ccc(F)c1F	1845432939	OECQQMQLPZZITQ-UHFFFAOYSA-N	445.426	1.103	50	20	IDGD	
CS(=O)(=O)c1ccc(F)c(C(=O)N2CCCC23CN(C(=O)CCBr)C3)c1	1845566493	XAEYNAKISAHAHG-UHFFFAOYSA-N	447.326	1.831	50	20	IDGD	
O=C(c1ccc(-n2c(O)nnc2O)cc1)N1CC2(CCCN2C(=O)C(Cl)Cl)C1	1846388193	DWZRVZXGEDMFIY-UHFFFAOYSA-N	426.260	1.299	50	20	IDGD	
C[C@H](C#N)c1cccc(C(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)c1	1846828366	DBBFUJCNFUBWSB-OAHLLOKOSA-N	432.484	1.443	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)cc2c1OCCO2	12702099	LMRFSXBVJFHOPB-UHFFFAOYSA-N	434.474	1.143	50	20	IDGD	
CN(CC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)Cc1ccccc1N1CCOCC1	15038548	FNDLPKZZFCCWDY-UHFFFAOYSA-N	427.461	1.324	50	20	IDGD	
COc1ccc(N2C[C@H](C(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)CC2=O)c(OC)c1	17363967	GQNCXEPUWHTKCL-CYBMUJFWSA-N	428.401	1.426	50	20	IDGD	
O=C(Cc1csc(N2CCOCC2)n1)NNC(=S)Nc1ccc2c(c1)OCCO2	17449920	MJQHMDCYBQUGIG-UHFFFAOYSA-N	435.531	1.311	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)NCCC(=O)N2CCN(C)CC2)c(C)n1C[C@@H]1CCCO1	195592027	GRMUWBPGNAYKLF-UKQGIEBLSA-N	427.549	1.471	50	20	IDGD	
CC(C)(C(=O)NNC(=O)c1cccnc1)S(=O)(=O)c1ccc(Br)cc1	726155977	AOFZGEWMWGGUQY-UHFFFAOYSA-N	426.292	1.858	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)NCCOc1ccc(Br)cc1	726249666	ZFKDWPHMYORNSH-UHFFFAOYSA-N	425.239	1.181	50	20	IDGD	
O=C(NNC(=O)c1nccnc1C(=O)NCc1ccc(F)cc1)c1ccc(Cl)nc1	726524483	HICNEDYFCPJAJR-UHFFFAOYSA-N	428.811	1.669	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)CSc2nnc(-c3cccs3)n2C)cc1	726825665	FESAIOUWLBGIBQ-UHFFFAOYSA-N	445.526	1.949	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@H]2CSCN2C(=O)OC(C)(C)C)cc(OC)c1OC	727114871	DCUKMJYGIHXDNV-GFCCVEGCSA-N	441.506	1.783	50	20	IDGD	
O=C(NNc1nc(-c2cccnc2)no1)c1ccc2c(c1)SC1=NS(=O)(=O)CCN12	728075409	APXYGIBIZWYQQQ-UHFFFAOYSA-N	443.470	1.500	50	20	IDGD	
O=C(CCNC(=O)c1ccc([N+](=O)[O-])cc1)NNc1ccc(S(=O)(=O)C(F)F)cc1	728976521	SQWZWDKOWWZMGL-UHFFFAOYSA-N	442.400	1.854	50	20	IDGD	
CC[C@H]1Nc2ccc(C(=O)OCC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)cc2NC1=O	729717918	JXOWVWPPBQXMTD-CQSZACIVSA-N	441.400	1.355	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(F)cc2)C1	730034000	KKPPGAJPCUZYQK-MRXNPFEDSA-N	449.504	1.712	50	20	IDGD	
CN(CCc1ccc(Br)cc1)C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	730272544	JEOPDIIKNBMNPB-UHFFFAOYSA-N	444.293	1.954	50	20	IDGD	
CC(=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O)c1ccccc1OC(F)(F)F	730947720	FLEOHZBEUYDDKZ-UHFFFAOYSA-N	431.396	1.010	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NC[C@@H](C)N(C)Cc2ccccc2)nc1	732469415	DRKXWBKJMCSWTI-MRXNPFEDSA-N	434.566	1.915	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)NCC2CCN(S(=O)(=O)C(F)F)CC2)cc(C#N)n1C	732971548	RHZGIWHKQQJBKX-CHHVJCJISA-N	425.461	1.493	50	20	IDGD	
CC(C)(C(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1)S(C)(=O)=O	733124942	RJOBHYGRZPCNLC-UHFFFAOYSA-N	445.544	1.133	50	20	IDGD	
Cc1nc(COc2ccccc2C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)no1	734239835	XBZCGYIKZNMECP-UHFFFAOYSA-N	434.453	1.426	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NNc2nccnc2Cl)o1	734260674	CYMOIXZPULUPFI-JTQLQIEISA-N	443.869	1.196	50	20	IDGD	
COc1ccc(CN2CC[C@@H](NC(=O)NNC(=O)c3cnn(-c4ccccc4)c3)C2=O)cc1	734531588	NJGGNTMIDNPYKA-HXUWFJFHSA-N	448.483	1.626	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)CS(=O)(=O)c1ccc(C(C)=O)c(F)c1	734808683	RTPMSBSSBHABEE-UHFFFAOYSA-N	442.852	1.925	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)CCCn2ccccc2=O)c2ccccc2c1=O	735029323	UPDOXBQSBSJFFA-UHFFFAOYSA-N	437.500	1.990	50	20	IDGD	
COc1cc(C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)cc(OC)c1C	735117782	HUSQOJWUHFLHHT-UHFFFAOYSA-N	449.533	1.100	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)[C@H]1CCCN(C(=O)CCOc2ccccc2)C1	740851919	BBKVGGIVIYTGAL-INIZCTEOSA-N	432.521	1.146	50	20	IDGD	
CC(=NNC(=O)C[C@@H](C(=O)NN=C(C)c1nccs1)N1CCOCC1)c1nccs1	741765801	DZODVFIKRSTMMM-AWEZNQCLSA-N	449.562	1.071	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNS(=O)(=O)c2csc(C(=O)OC)c2)cc1	743251052	NLJRNDZVHIVHGQ-NSHDSACASA-N	428.488	1.710	50	20	IDGD	
Cc1ccc(OC[C@@H](C)NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1	743352653	WQSRECILEGRLST-OAHLLOKOSA-N	434.518	1.657	50	20	IDGD	
Cc1cc(N2CC[C@@H](NC(=O)NNC(=O)c3cc4c(s3)CC[C@@H](C)C4)C2=O)n(C)n1	743511687	OKBQSSNHUXYZAK-BXUZGUMPSA-N	430.534	1.664	50	20	IDGD	
CC[C@@](C)(O)CNC(=O)/C(C#N)=C\c1cn(CCC(N)=O)nc1-c1ccc(OC)cc1	743760935	QSJRTYJPFYAPTC-PNLXHIIUSA-N	425.489	1.618	50	20	IDGD	
COC[C@@](C)(O)CNC(=O)/C(C#N)=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	743771289	FOYNXRPNMWQASC-NMQRCDEWSA-N	445.907	1.499	50	20	IDGD	
COC(=O)COc1ccc(C(C)=NNC(=O)Cc2csc(N3CCOCC3)n2)cc1	744998754	BNJPENHIXFEHFM-UHFFFAOYSA-N	432.502	1.614	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)[C@H](c2ccccc2F)N2CCOCC2)c1	745495842	JRHHPCCTRJYOGU-FQEVSTJZSA-N	440.431	1.075	50	20	IDGD	
Cc1nc(-c2ccc(C(=O)NNc3ccccc3S(=O)(=O)N3CCOCC3)cc2)n[nH]1	746331736	HWHUBHNMKACLNU-UHFFFAOYSA-N	442.501	1.558	50	20	IDGD	
CC(=NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1ccc([S@](C)=O)cc1	746365712	BEEMPSDLKSRAKG-LJAQVGFWSA-N	449.554	1.599	50	20	IDGD	
CC(C)(CO)[C@@H](CNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)c1ccccc1	747464224	SQZBIIYDXXJJAF-IBGZPJMESA-N	440.548	1.826	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc2c(c1)nc(CCC(=O)NNc1cccc([N+](=O)[O-])c1)n2C	748005778	NXVAMGHPONNLKA-UHFFFAOYSA-N	446.489	1.808	50	20	IDGD	
CSCC[C@H](NC(=O)c1ccc([N+](=O)[O-])o1)C(=O)NNc1cc(Cl)nc(C)n1	748336500	WTVGOOLLKVJLOQ-VIFPVBQESA-N	428.858	1.934	50	20	IDGD	
CCCCN1CCC(NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)CC1	749212905	UPNBISJIPOQYIN-UHFFFAOYSA-N	439.582	1.210	50	20	IDGD	
O=C(NNC(=O)N1CCc2c(Br)cccc2C1)c1ccc(-n2cnnn2)cc1	749703595	SDGKDYNBVWUUST-UHFFFAOYSA-N	442.277	1.838	50	20	IDGD	
O=C(/C=C/c1ccc(I)o1)NNC(=O)CNC(=O)c1ccco1	751211096	BTHHORWKALHCJE-GQCTYLIASA-N	429.170	1.068	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)c2cc(S(=O)(=O)NC(C)(C)C)ccc2Cl)n1	751299166	HBOCUXXOQMTASC-UHFFFAOYSA-N	441.941	1.691	50	20	IDGD	
O=C(NNC(=O)C(=O)Nc1ccccn1)N[C@@H]1CCC[C@@H]2CN(Cc3ccccc3)C[C@@H]21	753314973	CUKAZVKKKTZVNX-CEXWTWQISA-N	436.516	1.651	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)N[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1	754135989	SVPUVQKWOSKMQJ-NVXWUHKLSA-N	449.508	1.983	50	20	IDGD	
CC(CN1C(=O)CCC1=O)=NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	754894714	AHGRGNXONZWSOM-UHFFFAOYSA-N	434.499	1.804	50	20	IDGD	
CC(C)C[C@H](C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1)N1CCCCC1=O	755050424	YZNMKQISFWQEKS-CQSZACIVSA-N	444.941	1.176	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)Nc3cnns3)c2)cc1	755366500	ZEWUJJJLOOQEHO-UHFFFAOYSA-N	448.486	1.814	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)Nc1ccc(S(=O)(=O)C(F)F)cc1	755443110	CYQPGIGOHYBLJR-AWEZNQCLSA-N	427.385	1.676	50	20	IDGD	
C[C@@H]1CN(c2ccc(NC(=O)NNC(=O)c3ccc4c(c3)OCCO4)cn2)C[C@@H](C)O1	755866144	RXVMBPDWMKVOFO-ZIAGYGMSSA-N	427.461	1.933	50	20	IDGD	
COc1ccc(C(=O)N2CCOCC2)cc1NC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	756258995	WUTUBQXKABTDBG-UHFFFAOYSA-N	443.416	1.542	50	20	IDGD	
COc1ccc(C(F)(F)C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1	756344509	JQRJSHJFOMBMMT-MRXNPFEDSA-N	436.367	1.318	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)Nc1ccc(S(=O)(=O)NCC2CC2)cc1	756782377	BEAHDZHLDCMIMG-UHFFFAOYSA-N	433.446	1.750	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NCCCO[C@@H]2CCOC2)c2ccccc2c1=O	757251319	BZGPANVCYVNEHZ-OAHLLOKOSA-N	431.493	1.336	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)Nc1cc(Br)c(=O)n(C)c1	757689689	NHIKOXFYXRBANJ-VIFPVBQESA-N	427.230	1.907	50	20	IDGD	
O=C(NNC(=O)C(=O)Nc1ccccn1)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1	758815470	QLQUIDMQJMWMQG-ZDUSSCGKSA-N	448.430	1.621	50	20	IDGD	
COc1cc(N2CCN(CC(=O)NNC(=O)c3ccccc3)CC2)cc(OC)c1OC	759879401	UXZIYDPPTQMXRR-UHFFFAOYSA-N	428.489	1.296	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)C[C@@H]1CSCCN1C(=O)OC(C)(C)C	760443306	WJCKVPACCZHJDU-CYBMUJFWSA-N	446.570	1.791	50	20	IDGD	
CC(C)(C)C(=O)NNC(=O)C(=O)Nc1ccc(-c2csc(N3CCOCC3)n2)cc1	761063183	CMKQFPIGHGMOBQ-UHFFFAOYSA-N	431.518	1.779	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)N[C@H]1CCCN(Cc2ccccc2)C1=O	761793377	GSWDHHNNIVCKGU-KRWDZBQOSA-N	434.456	1.471	50	20	IDGD	
CCOC(=O)c1cnn(-c2cccc(NC(=O)C(=O)NNC(=O)c3ccccc3)c2)c1C	763431433	QWGKMEUKXMMFRU-UHFFFAOYSA-N	435.440	1.757	50	20	IDGD	
C[S@@](=O)Cc1ccccc1NC(=O)C(=O)NNC(=O)c1ccccc1Br	763483486	UXVFZQZEMPMYBO-AREMUKBSSA-N	438.303	1.727	50	20	IDGD	
O=C(NNC(=O)c1cccnc1)C(=O)Nc1ccc(-c2nnc3n2CCCCCC3)cc1	763488603	MMSBGJHIHFPRGX-UHFFFAOYSA-N	433.472	1.856	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(C)c([N+](=O)[O-])c2)cc(OC)c1OC	763540642	XPPVOVQIGGXLJP-UHFFFAOYSA-N	432.389	1.329	50	20	IDGD	
CC(C)(C)NC(=O)c1ccccc1NC(=O)C(=O)NNC(=O)c1ccc2c(c1)OCO2	763548136	KHDFSLFTSDMWRP-UHFFFAOYSA-N	426.429	1.343	50	20	IDGD	
Cc1ccc(Cn2nccc2NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)s1	763577035	GDUHTTPTRFSSBX-MRXNPFEDSA-N	441.469	1.227	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2ccc(C(=O)NC(C)C)c(C)c2)c1	763646021	AHUHCGNBDVNHPS-UHFFFAOYSA-N	440.500	1.915	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccnc(OCC(F)(F)F)c1	763716760	LYFTYRXXALMDSW-UHFFFAOYSA-N	440.378	1.750	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1Cl	763718322	JVVPTEPHSWBIMQ-UHFFFAOYSA-N	438.893	1.298	50	20	IDGD	
CN1CC(=O)N(c2cccc(NC(=O)C(=O)NNC(=O)c3cc4c(s3)CCC4)c2)C1=O	763780693	DJAKTJRDRVNIAS-UHFFFAOYSA-N	441.469	1.035	50	20	IDGD	
CCn1nnnc1-c1cccc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCC3)c1	763781743	MCVOMWNRFZPQLM-UHFFFAOYSA-N	425.474	1.310	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)C(=O)Nc1c(F)cc(Cl)cc1F	763802942	CWSRNFKWHWTHRI-UHFFFAOYSA-N	428.735	1.691	50	20	IDGD	
CNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)cc1Cl	763872868	PNGMGQKNIXARIO-SNVBAGLBSA-N	436.827	1.392	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)C(=O)Nc2ccc(-n3cnnn3)c(C)c2)cc1	763890928	INHKGHUHBSCKMB-UHFFFAOYSA-N	425.474	1.157	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ncn(Cc3ccccc3)n2)cc1OC	763900260	CCSMQBVUOQTEEQ-UHFFFAOYSA-N	438.444	1.133	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(C(=O)NC)c2C)cc1OC	763901076	KWBSJUNYZCVBJP-UHFFFAOYSA-N	428.445	1.162	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccccc2C[S@](C)=O)cc1OC	763911279	IFHMPNONCUSIGW-HKBQPEDESA-N	447.513	1.762	50	20	IDGD	
CCOC(=O)/C=C\c1ccc(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)cc1	763996931	HBWDPWMZNUKNGT-YVMONPNESA-N	449.261	1.753	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1ccn(Cc2ccccn2)n1	764013497	YNUVAWQNRGFIFB-UHFFFAOYSA-N	428.836	1.388	50	20	IDGD	
CS(=O)(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)Cc2cccc3ccccc23)c1	764019427	LHGYHPRVABBEII-UHFFFAOYSA-N	439.493	1.713	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)c(OCCN(C)C)c1	764163774	MGRIXYLZSKJZBV-LJQANCHMSA-N	426.473	1.025	50	20	IDGD	
C[C@H]1CN(Cc2ccccc2NC(=O)C(=O)NNC(=O)c2ccc(C#N)cc2)C[C@H](C)O1	764182699	PKBIJYNCBGRKAJ-HOTGVXAUSA-N	435.484	1.567	50	20	IDGD	
NC(=O)C1CCN(c2ccccc2NC(=O)C(=O)NNC(=O)CCc2ccccc2)CC1	764192481	JZLOUIINGOVOHT-UHFFFAOYSA-N	437.500	1.107	50	20	IDGD	
C=CCN(C)S(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)CCc2ccccc2)cc1	764193252	SYQRQOZBVOWWNH-UHFFFAOYSA-N	444.513	1.212	50	20	IDGD	
CC(C)CCC(=O)NNC(=O)C(=O)Nc1ccc(Cl)c(S(=O)(=O)N2CCCC2)c1	764202698	HXBZPTZCSHONAH-UHFFFAOYSA-N	444.941	1.647	50	20	IDGD	
Cc1cc(C(=O)N2CCC[C@H](C)C2)ccc1NC(=O)C(=O)NNC(=O)Cc1cccnc1	764265897	HBNZJZWOUWNYET-HNNXBMFYSA-N	437.500	1.591	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)Cc2cc[nH]n2)sc2c1CC[C@H](CC)C2	764292654	FWWIOEKQZRAZHZ-NSHDSACASA-N	447.517	1.491	50	20	IDGD	
C[C@@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3cc4ccccc4o3)cn2)C[C@@H](C)O1	764331647	YZYCCDWZSCSUAT-ZIAGYGMSSA-N	437.456	1.841	50	20	IDGD	
CC(=O)N(C)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)cc1	764383065	VLLIVWKXQKRMGB-UHFFFAOYSA-N	426.458	1.521	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cn(C)nc3-c3ccncc3)CC2)cc1	766648229	IUWJRZTXFOKFKL-UHFFFAOYSA-N	447.543	1.369	50	20	IDGD	
COc1ccc(-c2nnc(SCC(=O)NNC(=O)Cc3ccccc3C)n2N)cc1	768094182	OVNIMGJNBZWZLT-UHFFFAOYSA-N	426.502	1.458	50	20	IDGD	
CC[C@H]1CCCC[C@H]1OCC(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	768276092	OMHSBSKINHKWOX-AZUAARDMSA-N	430.549	1.577	50	20	IDGD	
COc1cccc(-c2nnc(SCC(=O)NNC(=O)c3cccc(Cl)c3)n2N)c1	768434874	MBWYHYBHAMASJA-UHFFFAOYSA-N	432.893	1.874	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNc1nc2ccccc2[nH]1	768502796	AYFRLZVYMGCAIB-UHFFFAOYSA-N	429.502	1.660	50	20	IDGD	
CCCn1c(CCC(=O)NN(C)C(N)=O)nc2cc(S(=O)(=O)N3CCCC3)ccc21	770531518	BSRXDIACEJQVBX-UHFFFAOYSA-N	436.538	1.205	50	20	IDGD	
CON(C)C(=O)[C@H](CCSC)NC(=O)NNC(=O)[C@H](C)Oc1cccc(Cl)c1	770543077	FJQBRABEFKRKMC-FZMZJTMJSA-N	432.930	1.579	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)Nc1cnn(-c2ccccc2)c1C(F)(F)F	771193680	GIWPIARHFYSBBA-SNVBAGLBSA-N	431.396	1.479	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)cc1Cl	771607509	NHZIHBRIDXVQTL-UHFFFAOYSA-N	432.285	1.628	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@@H]12	772969210	KQGLFKGHSBNNQV-JIRONKKISA-N	440.953	1.981	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)CCNC(=O)c1n[nH]c2ccccc12	772969249	KVESAMKJYHKLIY-GFCCVEGCSA-N	429.864	1.951	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)ccc1OC	772991217	SVWQITBIJLHSSE-LLVKDONJSA-N	441.893	1.485	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)c2cn(Cc3cccs3)nn2)C1	773421684	SPOFSNDRWIOFCC-ZDUSSCGKSA-N	434.522	1.796	50	20	IDGD	
COC(=O)c1cn(CCOC(=O)/C(C#N)=C\c2cc(C)n(C[C@H]3CCCO3)c2C)nn1	774595109	VAEZCBAUJOSFET-DAIOKFOQSA-N	427.461	1.812	50	20	IDGD	
COc1ccc(O)c(S(=O)(=O)NNC(=O)c2nc(Cl)c(Cl)c(N)c2Cl)c1	775669800	PDCXSSMRMDOSEA-UHFFFAOYSA-N	441.680	1.962	50	20	IDGD	
Cc1cc(S(=O)(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)c(C)o1	776280348	GFFRDPHMFQKCCG-UHFFFAOYSA-N	440.953	1.677	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCc2cc(COC(C)(C)C)on2)nc1	777270796	TYUSLCGKLMVNTL-UHFFFAOYSA-N	440.526	1.898	50	20	IDGD	
CCOC(=O)c1cc(F)cc(S(=O)(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c1	778557251	GZDILOWIBXGJKI-UHFFFAOYSA-N	444.462	1.029	50	20	IDGD	
CC(C)Oc1cc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)ccn1	778697040	FXPACWVZFZENGD-UHFFFAOYSA-N	428.417	1.947	50	20	IDGD	
O=C(CCn1nnc2ccccc2c1=O)NNc1ccc([N+](=O)[O-])cc1Br	779140362	IBHOJUKYLHKNHZ-UHFFFAOYSA-N	433.222	1.996	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2ccnn2CCC(C)C)cc1	779469315	NJCXRNODJIDBEV-UHFFFAOYSA-N	436.538	1.711	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)NCc2cc(C(N)=O)co2)c2ccccc2c1=O	779670395	NTOHEMQOPLQPFY-UHFFFAOYSA-N	440.460	1.423	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNc2ccc(OC)cn2)c(Br)cc1F	782145807	QJZGRHVPHSKIAR-UHFFFAOYSA-N	441.213	1.860	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2cccc(NC(=O)CN3CCCCCC3)c2)nc1	782148292	IHVPLPJTQWDGER-UHFFFAOYSA-N	440.504	1.987	50	20	IDGD	
CCS(=O)(=O)c1ccc(N2CCC(NS(=O)(=O)CBr)CC2)cc1	782430268	FMGAXQDXNFXZQC-UHFFFAOYSA-N	425.370	1.721	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N2CCOCC2)cc1NC(=O)NNC(=O)C1CCC1	782542282	USDMRJLVDVWRPH-UHFFFAOYSA-N	426.495	1.059	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2cccc(CS(=O)(=O)NC(C)(C)C)c2)nc(C)n1	783323994	BYQSERDNXSSTRP-UHFFFAOYSA-N	434.522	1.393	50	20	IDGD	
CCOC(=O)c1c(CC(C)C)csc1NC(=O)C(=O)NN[C@@]1(C)CCS(=O)(=O)C1	783427057	PQAZORYCBXVQRU-SFHVURJKSA-N	445.563	1.260	50	20	IDGD	
O=C(NNc1ccc(-n2cccn2)nn1)C(=O)Nc1ccc(OCc2ccccn2)c(F)c1	783433346	QGQFVXGCHFVXJG-UHFFFAOYSA-N	448.418	1.857	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ccc(C#N)c(C(F)(F)F)c2)cc1-n1cnnn1	784236860	LTIZXZMKKFMDFR-UHFFFAOYSA-N	446.349	1.643	50	20	IDGD	
CC(C)N(C)S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccc(Cl)nn2)cc1	784792205	HPGQUDYIRILCGA-UHFFFAOYSA-N	426.886	1.241	50	20	IDGD	
Cn1cc(Br)cc(NC(=O)C(=O)NNc2cccc(C(F)(F)F)n2)c1=O	784951085	BNWRPIGATXNPJX-UHFFFAOYSA-N	434.172	1.643	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc(C(N)=O)cc3F)n[nH]2)c1	785125077	AOOOCUNHJKFDGN-UHFFFAOYSA-N	438.419	1.331	50	20	IDGD	
CC[C@@]1(C)Oc2ccc(NC(=O)C(=O)NNC(=O)c3ccc4c(c3)OCCO4)cc2O1	785990595	JYABEYONOUPMTI-NRFANRHFSA-N	427.413	1.755	50	20	IDGD	
Cc1ccc(C)c(S(=O)(=O)Nc2cccc(C(=O)NNC(=O)N3CCN(C)CC3)c2)c1	788166192	JSRBFSVZALLDEO-UHFFFAOYSA-N	445.545	1.706	50	20	IDGD	
CN1C(=O)C[C@H](C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)[C@@H]1c1ccc(Cl)c(Cl)c1	790218965	YJENGPQCCNCTKL-ZETOZRRWSA-N	448.328	1.095	50	20	IDGD	
CNS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2ccc(COc3ccccc3)o2)nc1	792400753	TTWCYECEIJLORB-UHFFFAOYSA-N	445.457	1.628	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)Cc2ccc(C(=O)NNC(=O)COC(F)F)cc2)cc1	794759368	JLIJAWKMAZOYPV-UHFFFAOYSA-N	441.456	1.816	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)Cn2c(S)nnc2-c2cccs2)cc1C	798310365	WMHUNDBUXDFQRJ-UHFFFAOYSA-N	430.515	1.698	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)C2(c3cccc(Cl)c3)CC(=O)C2)c1	798685709	DIVCFOPMGGZQRS-UHFFFAOYSA-N	425.828	1.817	50	20	IDGD	
O=C(NCCNS(=O)(=O)c1ccc(F)cc1F)NNC(=O)c1cc2ccccc2o1	799374541	DPAMSIQRSBIJEF-UHFFFAOYSA-N	438.412	1.634	50	20	IDGD	
C[C@H](c1ccccc1)N(C)C(=O)CN(C)CC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	800500682	UENMGZJJJBOCOR-OAHLLOKOSA-N	427.461	1.507	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2csc(CNC(=O)OC(C)(C)C)n2)cc1	801106794	HLWRKVIEYWQJBJ-UHFFFAOYSA-N	433.490	1.876	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H](Cc2cccnc2)NC(=O)c2ccccc2)cc1	801111598	TZRJRAGLJDGRNP-FQEVSTJZSA-N	445.479	1.517	50	20	IDGD	
CC(C)[C@@H](NC(=O)c1ccc(Cl)s1)C(=O)NNC(=O)CCN1C[C@H](C)O[C@@H](C)C1	801599932	IFTGXRHADNHDJO-GDZNZVCISA-N	444.985	1.803	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=O)N=c2cc[nH]cc2)c1	802024442	FFZKICJZJSRCFW-UHFFFAOYSA-N	425.898	1.654	50	20	IDGD	
COc1ccc(C2=NO[C@H](CNC(=O)NNC(=O)CNC(=O)c3cccs3)C2)cc1	802366280	HCZDTBLRDDUGNB-AWEZNQCLSA-N	431.474	1.010	50	20	IDGD	
CN(NC(=O)c1cc2ccccc2c(=O)n1C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	803101220	FBBSPNHIMIQKPS-UHFFFAOYSA-N	443.504	1.788	50	20	IDGD	
CCOC(=O)C1(S(C)(=O)=O)CCN(C(=O)NNC(=O)C(C)(C)c2ccccc2)CC1	805095622	WEKWVMORJXKTLR-UHFFFAOYSA-N	439.534	1.147	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)NC[C@@H](N2CCOCC2)C(F)(F)F)cc1OC	805844875	OJDLJDJXUCFSPT-MRXNPFEDSA-N	448.442	1.691	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2nccnc2C2CCC2)cc1N1CCOC1=O	807461613	LPTJWELCFDGTKE-UHFFFAOYSA-N	426.433	1.791	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)nn1C1CCCCC1	810385981	HSGNONFKHGUXIC-UHFFFAOYSA-N	437.464	1.072	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)C(=O)Nc1ccc(-n2ccc(C(F)(F)F)n2)cc1	810387402	UXORFFBWHCHUKK-UHFFFAOYSA-N	432.362	1.994	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1ccc2c(c1)CCCCC2=O	810593409	ZXJFWJMMXCKKCY-UHFFFAOYSA-N	448.523	1.815	50	20	IDGD	
CC(C)c1nnc(NC(=O)CCC(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)s1	812727079	OBXOUOLGKMIXKO-UHFFFAOYSA-N	440.551	1.774	50	20	IDGD	
CCCCn1c(C)cc(/C=C(/C#N)C(=O)NS(=O)(=O)N2CCN(C(C)=O)CC2)c1C	813950122	KEIPTPBTBFDDOG-UYRXBGFRSA-N	435.550	1.337	50	20	IDGD	
CN(C)c1ncc(C=NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)cn1	814710462	REQJOSOIIUEROD-UHFFFAOYSA-N	438.513	1.785	50	20	IDGD	
COC(=O)N1CCN(c2ccc(NC(=O)C(=O)NNc3cccc(Cl)n3)cn2)CC1	815725964	HZUWWEOYPKXECZ-UHFFFAOYSA-N	433.856	1.100	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)N(C)C)cc1	815751764	NNXYQXGOWWAKFO-UHFFFAOYSA-N	436.490	1.044	50	20	IDGD	
COc1cc2ncn(CCCC(=O)NNC(=O)CNc3ccccc3)c(=O)c2cc1OC	823328678	YIRFLJVSWWWZIE-UHFFFAOYSA-N	439.472	1.453	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccc([N+](=O)[O-])c1	871595844	UBFVOVQCQNSKRR-UHFFFAOYSA-N	443.441	1.809	50	20	IDGD	
O=C(CSCc1cc(=O)n2ccsc2n1)NNC(=O)c1ccc2ccccc2n1	884427436	VVGMLXIDMFRBMJ-UHFFFAOYSA-N	425.495	1.999	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1ccc(Cl)cc1)C(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	912766685	MNJPSDASAYBWOD-SNVBAGLBSA-N	426.838	1.376	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)[C@@H]2CCCN(C(=O)Cc3ccccc3)C2)nc2ccccc21	914750532	KWFPMSVWCXUWAT-GOSISDBHSA-N	433.512	1.745	50	20	IDGD	
CC(C)(C)c1noc(CCC(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)n1	915188757	PEMSVGVTLKSPIW-UHFFFAOYSA-N	429.886	1.062	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)NCc2ccc(S(N)(=O)=O)s2)c1C	915906224	SUKDOFFWSSLQCI-GFCCVEGCSA-N	426.520	1.310	50	20	IDGD	
O=C(NCc1cn(-c2ccccc2)nc1-c1ccc(F)cc1)NNC(=O)C(=O)NC1CC1	916221597	RASOJSRILIMTGI-UHFFFAOYSA-N	436.447	1.787	50	20	IDGD	
C[C@H]1CN(CCCNC(=O)NNC(=O)COc2ccc(Br)cc2)C[C@H](C)O1	916249828	MVTXRPSHSHZEFH-KBPBESRZSA-N	443.342	1.658	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCCNC(=O)NNC(=O)COc2cc(C)cc(C)c2)cc1	916278466	PZYQWKCDFQANBT-UHFFFAOYSA-N	434.518	1.300	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)N[C@H](CN2CCCC2=O)c2ccccc2)cc1C	916459993	UPBFSNNVWGWPGB-LJQANCHMSA-N	437.500	1.936	50	20	IDGD	
O=C(NC[C@H]1CCN(CC(F)(F)F)C1)NNC(=O)c1nn(-c2ccccc2)cc1O	916577900	KVMVGPGOCACCJO-GFCCVEGCSA-N	426.399	1.406	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)NCc2cccc(S(N)(=O)=O)c2)c1	916624176	YKPZUIBJZAPQRO-UHFFFAOYSA-N	434.518	1.675	50	20	IDGD	
O=C(NCCCn1nc2n(c1=O)CCCC2)NNC(=O)c1ccc(Br)s1	916649407	BOPKLGRSDNCXGC-UHFFFAOYSA-N	443.327	1.239	50	20	IDGD	
O=C(NCCSC(F)(F)F)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	918219811	VMRPDEVZWZXIKP-UHFFFAOYSA-N	440.469	1.668	50	20	IDGD	
O=C(NC[C@@H]1CCN(c2ccc(F)c(F)c2)C1)NNC(=O)[C@H]1COc2ccccc2O1	921076717	IXMRMBMDIGUSHF-ORAYPTAESA-N	432.427	1.962	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CNc2ccc(C)cc2C)cc1S(=O)(=O)NC1CC1	921161287	IWICVAHKHDSKJX-UHFFFAOYSA-N	446.529	1.626	50	20	IDGD	
O=C(COC(=O)c1ccc(CN2C(=O)CCC2=O)cc1)NNC(=O)c1cccc(Cl)c1	921181124	GTKRINSLODKNJZ-UHFFFAOYSA-N	443.843	1.607	50	20	IDGD	
CS(=O)(=O)Nc1cc2ccccc2cc1C(=O)NNC(=O)c1n[nH]c2c1CCCC2	1317982665	NOUUEIKSHFFCGU-UHFFFAOYSA-N	427.486	1.888	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)c2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1	1317984775	DAQYJKNGXOJVMY-MRXNPFEDSA-N	425.489	1.270	50	20	IDGD	
N#Cc1cccc(C2(C(=O)NNC(=O)c3cccc(S(=O)(=O)N4CCCC4)c3)CC2)c1	1319915218	GFQQUMKPPGEYDN-UHFFFAOYSA-N	438.509	1.836	50	20	IDGD	
CC(C)n1nccc1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2	1779599795	IGVKREZEHAIRSP-KSSFIOAISA-N	427.343	1.939	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](N)c1ccccn1)C2	1780713576	ZAIWCJOAZCJUOQ-GIYDNNGJSA-N	443.375	1.832	50	20	IDGD	
Cc1noc(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](F)Br)C2)n1	1780771935	VNOUWDYVBNLYKL-DIOULYMOSA-N	433.278	1.125	50	20	IDGD	
O=C(/C=C/c1ccc([N+](=O)[O-])o1)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781325782	QVZAKVYUJYTCQP-RJVMEPDQSA-N	446.229	1.721	50	20	IDGD	
O=C(c1ccc2c[nH]nc2c1)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781332127	ZXJAPVZSMDQMIZ-PBHICJAKSA-N	425.258	1.697	50	20	IDGD	
CCOC(=O)C1(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](C)Br)C3)CC1	1781627388	YWWDMZWLUFLYCX-PMUMKWKESA-N	445.354	1.627	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCc1cn[nH]c1)C2	1781997191	JOQFIBOKGDRWCS-JCKWVBRZSA-N	427.343	1.640	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3n[nH]c4ccc(C#N)cc34)C2)C1	1782197813	DHWJDLJMHWLKQU-YWZLYKJASA-N	431.880	1.132	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)C13CC(C(=O)OC)(C1)C3)CCO2	1783354965	GKIWKBWXQZVVBQ-CYBNEDPLSA-N	443.338	1.333	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](C)CBr)CCO2	1783529647	WDMHELQBLDWATC-UHIISALHSA-N	426.149	1.631	50	20	IDGD	
Cc1nc2ncccn2c1C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](C)Br)C2)C1	1783533639	CNJRXWKILGWENZ-KZULUSFZSA-N	436.310	1.265	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cccc4c3NC(=O)C4)CCO2)C1	1783538072	VUGJEPQFYFKXHN-BLVKFPJESA-N	436.306	1.408	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)COc3ccc(O)cc3)[C@H]2C1	1783843274	ZSTYQZFEPVQSRK-OQUILHJVSA-N	441.322	1.534	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(O)c(O)c(Cl)c3)CCO2)C1	1783882222	WTXMLJCVGWNNGN-ACJLOTCBSA-N	433.288	1.449	50	20	IDGD	
O=C(C1=NN(c2ccccc2)C(=O)C1)N1CCO[C@@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783946002	VZSSOLRPYJMIQR-LJQANCHMSA-N	439.299	1.413	50	20	IDGD	
Cn1ccc2c(O)ncc(C(=O)N3CCO[C@@]4(CCN(C(=O)C(Cl)Cl)C4)C3)c21	1783948321	JWHWGLKESSCCAZ-GOSISDBHSA-N	427.288	1.526	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21)[C@H]1CC(c2ccccc2)=NO1	1784406867	BBMCFYZILXVDSI-DIECFANBSA-N	440.327	1.963	50	20	IDGD	
NC[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)c1ccccc1	1786924244	GWGQIXNRYHCBNJ-QEOTZNIISA-N	442.329	1.399	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(C(F)F)no3)[C@H]2C1	1787142875	ZDWIYCFQKKFROZ-QYTUQVAYSA-N	436.253	1.989	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)c1cccc2c[nH]nc12	1787324364	LXCPILNZYJTTJX-PCBIJLKTSA-N	439.285	1.847	50	20	IDGD	
O=C([C@H](O)CCl)N1CC[C@H]2CO[C@@H](CNC(=O)[C@]3(F)CCCCC3(F)F)[C@H]2C1	1788172112	SPXLVHNRQWSKDA-JEJJNBGPSA-N	426.863	1.483	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)Nc1ccc(C2(NC(=O)CN(CCO)CCO)CCC2)cc1	1790493694	GADVIPLFIDPEKH-LJQANCHMSA-N	446.375	1.643	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3c[nH]c4ncccc34)C[C@@H]21	1791058063	XSIPGVCRFNTZRA-KNPMLCFXSA-N	435.322	1.940	50	20	IDGD	
Cc1nc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)CBr)sc1C	1792872354	AVRUQXIDBNAHSX-WTDIUWLJSA-N	430.368	1.994	50	20	IDGD	
Cc1nccn1[C@H](C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)CBr	1792873276	RLJFZXFPMNBSJP-LKAFINOVSA-N	427.343	1.373	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3c(F)cc(F)cc3[nH]1)C2)[C@@H](O)CCl	1792978549	ZYYXEYDFFOJADC-HPQBHAKGSA-N	427.835	1.249	50	20	IDGD	
C[C@@H](CBr)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN1C(=O)CSC1=S)C2	1792992368	VGHJCXYYLVRRBX-YFKTTZPYSA-N	448.408	1.516	50	20	IDGD	
Cc1cccc(Cl)c1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1	1796189474	RBMPIPCURFPZOK-BCDXTJNWSA-N	426.709	1.894	50	20	IDGD	
CCC1(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)CCC1	1796441900	FIWVOKYIIDVRBH-XLYDMXJNSA-N	429.521	1.290	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnoc1	1796525146	WCXJVLQLTCUIQP-XGUBFFRZSA-N	442.900	1.010	50	20	IDGD	
Cn1c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)ccc1C(F)(F)F	1797200143	MQQXXKKOVIMTOE-MUJYYYPQSA-N	449.238	1.289	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1cc2n(n1)CCCC2	1797442399	CQITYYBITABJTG-BAESOJJISA-N	429.290	1.113	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/c1ccc([N+](=O)[O-])o1)C2)[C@@H](F)Br	1799343507	YVDBNCZXGVXFHB-PNKBIWGBSA-N	446.229	1.481	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(F)c1[N+](=O)[O-]	1799634783	RMVLEGUEBZIHBS-DYNIEEOBSA-N	444.257	1.721	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3cncn3c1)C2	1800642068	UZDJCOVEDYPLSC-FSDCSDTHSA-N	435.322	1.711	50	20	IDGD	
COc1cccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)Br)c1	1800756217	HWIZYYXMLBQUIY-FRQROOTJSA-N	425.323	1.611	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccn(C(C)(C)C)n1)C2	1800757685	IJONCTNLKGRVQQ-XPCVCDNBSA-N	427.343	1.625	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(-n3cncn3)c1)C2	1800759846	LDYSZVLYGZIPDT-JJAZEVLHSA-N	448.321	1.254	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)Sc1ccccn1)C2	1800763127	PCQYIRBXPVAJSM-IPVBOJNNSA-N	442.379	1.935	50	20	IDGD	
CCOC(=O)[C@@H]1CCC[C@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](Cl)COC)C1	1800970738	ILIZIHMJOHBBAL-ZKZVPCBQSA-N	444.956	1.199	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H]1CCC(=O)N1)C2	1801437732	XFYHQBCJVCZEOQ-ZPLALWFASA-N	428.439	1.789	50	20	IDGD	
Cc1ccc(OC(C)(C)C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CCC(=O)NN(C)C)nc1	1802337453	XVGHAPGQNPNPRB-BCDXTJNWSA-N	445.564	1.559	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)c1cnc(OCF)cn1	1805024724	AYYKKGOXLAWGFG-JLJPHGGASA-N	437.859	1.097	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)N1CC[C@@H](CNC(=O)CCBr)[C@@H]1c1cccnc1	1806340584	GRSPDHBFUNMART-DZKIICNBSA-N	440.342	1.319	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H]2C[C@@H]2C2CC2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1	1807366001	RFPGTCXHNVPACL-PDGJWGCVSA-N	433.317	1.127	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CCC(F)(F)F)[C@H]1c1cccnc1)c1cccc(B(O)O)c1	1807370551	GSAZJZOQLDVHMZ-LPHOPBHVSA-N	449.238	1.424	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@H]1c1cccnc1)[C@@H](F)Cl	1808319010	KLQHOWXAOZWWOE-TUKIKUTGSA-N	444.941	1.482	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)c1cccc2c1OCC2	1808998503	PCAFYDFYRVDRGJ-UHOSZYNNSA-N	429.904	1.936	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)c3ccc(O)cc3F)CC2)C1	1809969963	WYIYWANAGFKWIA-UHFFFAOYSA-N	440.280	1.370	50	20	IDGD	
CN(C)C(=O)NCC(=O)N1CC[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]1c1cccnc1	1810537374	DJZBGFHEIGRKSQ-QFBILLFUSA-N	435.601	1.210	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCC2(CCCN(C(=O)c3cnc(O)nc3O)C2)CC1	1810869906	IGSWSRPWGYQBPA-QGZVFWFLSA-N	431.320	1.969	50	20	IDGD	
CC(=O)N[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@H]1c1cccnc1	1812657033	DKGJNAHSLFFGCN-KJEVXHAQSA-N	429.290	1.303	50	20	IDGD	
COC(=O)C1(C(=O)NC[C@@H]2CCN(C(=O)[C@H](F)Br)[C@H]2c2cccnc2)CC1	1812691160	DVSGRNQDJZFJBW-IHRRRGAJSA-N	442.285	1.731	50	20	IDGD	
COCCn1nccc1C(=O)N1CC[C@H](CNC(=O)[C@H](Cl)COC)[C@H]1c1cccnc1	1813031448	VHPYWVCDGZKGSY-ZHALLVOQSA-N	449.939	1.498	50	20	IDGD	
C[C@](O)(CC(=O)O)CC(=O)N1CC[C@@H](CNC(=O)C(Cl)Cl)[C@H]1c1cccnc1	1813081950	HSROTBFHUWDHIH-WBHUJUFNSA-N	432.304	1.507	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@H]1CCc2nc(NC(=O)CCN3CCOCC3)sc2C1	1814643666	CVOIFJHWIQMTFJ-AWEZNQCLSA-N	440.642	1.629	50	20	IDGD	
Cn1cc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)[C@@H](O)CCl)n[nH]2)c(C(F)F)n1	1814871020	HZBMMDQUPHPJIY-NEPJUHHUSA-N	430.843	1.986	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CN2C(=O)CNC2=O)n[nH]1	1815599832	SYCAKELBNPOECM-DIFFPNOSSA-N	445.307	1.190	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)COc2ccccc2)n[nH]1	1816861754	AHZJNTJMJDNORD-SFHVURJKSA-N	442.520	1.854	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](C)Br)[nH]n1	1817996422	PVTAMFKVFCFTIB-SCVCMEIPSA-N	429.319	1.632	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccnnc2)[nH]n1	1818111402	JGWDMVAEDWLETP-ROCQKPIASA-N	449.475	1.640	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CN)CC2	1821304450	KYMDKHYVWDNGQZ-SNVBAGLBSA-N	433.446	1.161	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)C[C@H]2CCCCO2)[nH]n1	1822410689	PKWKZMOKCRZOSD-WBVHZDCISA-N	434.541	1.734	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(C#N)cc1)CC2	1826088747	NDCJQIVZEFHIMI-HNNXBMFYSA-N	440.529	1.614	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)CSCC(=O)O)sc2C1	1826119364	WIDPJUDARZLYOG-HTQZYQBOSA-N	436.353	1.656	50	20	IDGD	
CCn1ccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)n1	1827056001	NHOILABKBFYEHJ-OAQYLSRUSA-N	438.337	1.130	50	20	IDGD	
CC1(C)CCC(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)CC1	1830733391	KZPIDOZHLBVDCR-LAUBAEHRSA-N	430.973	1.649	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3n[nH]c(C4CC4)c3F)C2)C1	1831643424	BNQHNGMJYHLKNI-XOBRGWDASA-N	442.919	1.904	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(COC)c[nH]3)C2)C1	1831653873	FYCGEXPNGFDRHA-OXJNMPFZSA-N	427.929	1.639	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)C[C@@H]3CCCCO3)CCO2)C1	1832347281	TYKFVGWOLLHOGH-ZYSHUDEJSA-N	437.364	1.638	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)c1ccc(F)nc1F	1833016085	UCSNRDFQBOBDEI-OAHLLOKOSA-N	430.883	1.145	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)/C=C/c3ccsc3)CCO2)C1	1833142815	QJIOZMFXJBDWLY-AKWDPIGTSA-N	428.938	1.472	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(C)no3)CCO2)C1	1834227462	GHUGTTIPURZMGI-GUYCJALGSA-N	430.299	1.227	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(O)cn3)CCO2)C1	1834589194	KUPZCWFQEZNZNL-KBXCAEBGSA-N	442.310	1.031	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)C[C@H](N)c3cccnc3)CCO2)C1	1835824019	HDZXYZSHIIVHRF-BBTUJRGHSA-N	438.956	1.335	50	20	IDGD	
Cc1noc(C)c1CCC(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836715320	PLXVGCRLSNANTM-IBGZPJMESA-N	441.956	1.822	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C#N)cc(OC)c3)C2)C1	1839146674	RZXDLSQUALIPCE-GHTZIAJQSA-N	435.908	1.654	50	20	IDGD	
CC(C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2	1839150021	AEQFMFOSELQNLT-MSOLQXFVSA-N	425.353	1.494	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)COc3cccnc3)C2)C1	1839150515	OFWFEWWPQIGLBV-RTBURBONSA-N	446.331	1.153	50	20	IDGD	
Cc1ccc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)o1	1839156359	NKPJQTGGTOEOOP-MOPGFXCFSA-N	433.332	1.823	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)nc1C	1839197573	BGQHBJPZLBLGFL-MAUKXSAKSA-N	444.301	1.459	50	20	IDGD	
COCCC(=O)N1CCOC[C@]2(C1)CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)CCO2	1839743388	NGMPGPKXSHVSMW-BPNKPRMTSA-N	449.454	1.365	50	20	IDGD	
C=C(C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1)C(F)(F)F	1839894057	GUDSHVZWNVCMAR-LSDHHAIUSA-N	433.254	1.798	50	20	IDGD	
C=CCC(CC=C)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2	1840030490	NYIOGMWKIMZOQG-DNVCBOLYSA-N	429.355	1.995	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC12CN(C(=O)[C@@H]1CC[C@H]3CCC(=O)N3C1)C2	1841288267	KGPIQHAGLXSBTR-KFWWJZLASA-N	426.355	1.622	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2nc(Cl)ccc2F)C1	1842136100	JWCVFMVENFEOJX-BRJLIKDPSA-N	446.870	1.825	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)[C@@H](CN)c1ccccc1)C2	1843415835	SDIMRAONBSWUTO-PMFZIYJTSA-N	436.516	1.066	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1cnccc1Cl)C2	1843416170	HWWGINLZAUSVKI-ZMOGYAJESA-N	428.880	1.686	50	20	IDGD	
O=C([C@H](O)CCl)N1CC2(CCCN2C(=O)c2cn3cc(Br)ccc3n2)C1	1844097220	RRPYBYNNVSIUGF-CYBMUJFWSA-N	441.713	1.514	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCCC12CN(C(=O)c1ccc(N3C(=O)C=CC3=O)cc1)C2	1844379712	CSGUPDCSRFFDGX-UHFFFAOYSA-N	441.560	1.785	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCCC12CN(C(=O)c1cc(=O)nc3sccn13)C2	1845171809	XRTZFIHNODZFHO-INIZCTEOSA-N	429.329	1.809	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCCC12CN(C(=O)Cn1c(=O)n(C)c3ccccc31)C2	1846070499	MNHAZUIDTCZIPS-CQSZACIVSA-N	449.349	1.717	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@@H](C)C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](F)Cl)cc1	1847582276	SCOPUOWLIAESFF-TUUVXOQKSA-N	431.917	1.398	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1c(F)ccnc1Cl	1848283532	UKOOHNWNYHZHBM-IBSSICKUSA-N	446.870	1.824	50	20	IDGD	
O=C(COC(=O)[C@@H]1CCCN(C(=O)c2ccc(F)cc2)C1)NNC(=O)c1ccccc1	11060262	FORUVNFHLNIZAQ-QGZVFWFLSA-N	427.432	1.682	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)c2cccnc2N2CCOCC2)c2ccccc2c1=O	14347366	NZBAWJKMNGITAF-UHFFFAOYSA-N	436.472	1.284	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)c2ccc(N3CCOCC3)nc2)c2ccccc2c1=O	14347384	MILGGDHALRAOGU-UHFFFAOYSA-N	436.472	1.284	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)Cc2ccc3c(c2)OCCO3)cc1	26752241	GKGAXQJTUZCQBU-UHFFFAOYSA-N	439.497	1.882	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)c2ccc3c(=O)n(CC)c(=O)[nH]c3c2)cc1OC	108045806	CJORTMFSPPPELF-UHFFFAOYSA-N	440.456	1.582	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)CNC(=O)c1cc(-c2ccccc2)on1	109865938	ZLCACSPHDFVLBO-ZDUSSCGKSA-N	426.404	1.825	50	20	IDGD	
CCOc1cc2c(cc1OCC)CN(C(=O)NNC(=O)CNC(=O)c1ccco1)CC2	725870971	DQUZEYDUCRZNBQ-UHFFFAOYSA-N	430.461	1.606	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](CNC(=O)NNC(=O)CNC(=O)c2cccs2)C1	725873890	UGCQAPYSMBRBMU-ZDUSSCGKSA-N	439.538	1.455	50	20	IDGD	
O=C(CN1C(=O)Cn2c(cc3ccccc32)C1=O)NNC(=O)c1ccc(Cl)cc1O	725888691	RTNNPACNERHUBN-UHFFFAOYSA-N	426.816	1.444	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)[C@H](C)N2C(=O)NC3(CCCC3)C2=O)c1	726496655	DUNYBSRACVPHBS-HNNXBMFYSA-N	430.505	1.898	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2ccc(C(=O)NNC(=S)NCC3CCC3)cc2)C[C@H](C)O1	727867177	UGOOEEQPCMJEPD-KBPBESRZSA-N	440.591	1.394	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)NCCCN1CCN(c2ccncc2)CC1	729500028	QTWFWLAAELSTQF-UHFFFAOYSA-N	435.532	1.579	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N2CCO[C@@H](C#N)C2)cc1	729979590	LVUFDEMMDWDOEG-XLCPLWEUSA-N	434.456	1.092	50	20	IDGD	
COc1ccc(C(=O)Oc2ccc(C=NNC(=O)[C@@H]3CCS(=O)(=O)C3)cc2OC)cc1	730575416	CSQLHUSJGJBACN-MRXNPFEDSA-N	446.481	1.808	50	20	IDGD	
CSCC[C@@H](C(=O)NNC(=O)COc1ccccc1O)N1C(=O)[C@H]2CCCC[C@H]2C1=O	730780198	KATISDOBYWZSRS-ZNMIVQPWSA-N	449.529	1.215	50	20	IDGD	
CCN1CCN(Cc2ccccc2CNC(=O)NNC(=O)COc2ccccc2O)CC1	730821993	BYWKHSXHHYOODM-UHFFFAOYSA-N	441.532	1.439	50	20	IDGD	
NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NNC(=O)COc3ccccc3O)cc2)C1	730901410	CNZKJSHBAZHTFT-MRXNPFEDSA-N	441.488	1.003	50	20	IDGD	
Cc1cc(=O)c(C(=O)NNC(=O)Cc2ccccc2F)nn1-c1ccccc1[N+](=O)[O-]	731330073	MPBWOLARDWYDQK-UHFFFAOYSA-N	425.376	1.592	50	20	IDGD	
CCCC[C@@H](/N=C1/NS(=O)(=O)c2ccccc21)C(=O)NNC(=O)Cc1ccccc1F	731344389	IPVZTNFVJLLSFB-QGZVFWFLSA-N	446.504	1.813	50	20	IDGD	
CC(C)NS(=O)(=O)Cc1ccccc1CNC(=O)NNC(=O)Cc1ccccc1F	731358437	UDOYJWGLOATENO-UHFFFAOYSA-N	436.509	1.727	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)N[C@@H]2CCN(c3ccccc3C(N)=O)C2)c1C	732595412	QQIDMQFQHOZRMU-IAGOWNOFSA-N	439.516	1.779	50	20	IDGD	
Cc1ccccc1-n1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cn1	732653591	CGNQKPIAFKBRMP-UHFFFAOYSA-N	427.486	1.506	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)NCC2CCN(S(=O)(=O)C(F)(F)F)CC2)c1	732673422	HGBDOYRPYXXWBY-UHFFFAOYSA-N	433.412	1.064	50	20	IDGD	
CN(C)c1nccc(NNC(=O)c2cn(C3CCN(C(=O)OC(C)(C)C)CC3)nn2)n1	740104046	BEEGXXNCQYLUAD-UHFFFAOYSA-N	431.501	1.463	50	20	IDGD	
C[C@H]1CN(C[C@@H](C)C(=O)NN=Cc2c(N3CCOCC3)nc3ccccn23)C[C@@H](C)O1	741812001	JWFRTZJJENDFID-KURKYZTESA-N	428.537	1.366	50	20	IDGD	
Cc1nc(-c2ncccn2)nc(O)c1CC(=O)NNC(=O)c1cccc(Br)c1	742769785	SWDJMPBMWVPGME-UHFFFAOYSA-N	443.261	1.714	50	20	IDGD	
Cc1ccc(S(=O)(=O)NNC(=O)C2CCCC2)cc1S(=O)(=O)N1CCCCC1	743254064	WWFXEYNMNSYALH-UHFFFAOYSA-N	429.564	1.669	50	20	IDGD	
CCC[C@H](C)N1C[C@H](C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)CC1=O	744619045	FWRNIFQGAWZVNE-JKSUJKDBSA-N	438.550	1.188	50	20	IDGD	
CC(=O)N1CCc2cc(C(=O)NNc3ccccc3S(=O)(=O)N3CCOCC3)ccc21	744620421	DZKRCSIWBPFPOD-UHFFFAOYSA-N	444.513	1.373	50	20	IDGD	
Cc1c(C(=O)NNC(=O)Cc2cn3ccccc3n2)nnn1-c1cccc2cccnc12	746549691	UNFQGXWUWYTADT-UHFFFAOYSA-N	426.440	1.775	50	20	IDGD	
COc1ccc(NNC(=O)c2cccc(S(=O)(=O)N3CCN(C(C)=O)CC3)c2)cc1	746885932	MNLOCHYRIISFPZ-UHFFFAOYSA-N	432.502	1.305	50	20	IDGD	
O=C(CCOc1ccccc1)NNC(=O)CS(=O)(=O)c1cccc(Br)c1	747177821	TXDMXVDRHQEMOD-UHFFFAOYSA-N	441.303	1.839	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)CS(=O)(=O)Cc1ccc(Br)cc1	747326684	SGWFQAIXOKVHBG-UHFFFAOYSA-N	426.292	1.149	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCn2ccnc2C1)c1ccccc1NS(=O)(=O)c1cccs1	747649001	PKJHSHPETFOQHP-ZDUSSCGKSA-N	445.526	1.769	50	20	IDGD	
O=C(CCN1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O)NNc1ccc(Br)cc1F	748204006	YTGAGDPGMYBAKK-GBOPCIDUSA-N	426.242	1.584	50	20	IDGD	
O=C(CNC(=O)OCC1c2ccccc2-c2ccccc21)NNC(=O)C(=O)N1CCCC1	748247334	YGPWYHCXDXZBJE-UHFFFAOYSA-N	436.468	1.295	50	20	IDGD	
O=C(CCC(=O)Nc1nnc(C2CC2)o1)NNc1ccc(S(=O)(=O)C(F)F)cc1	748611859	UEJYALSNHFRNRD-UHFFFAOYSA-N	429.405	1.805	50	20	IDGD	
O=C(CN1CCC[C@@H](CNC(=O)c2ccccc2)C1)NNC(=O)c1cccc([N+](=O)[O-])c1	748834631	FCJJDPUWHSAJPZ-INIZCTEOSA-N	439.472	1.498	50	20	IDGD	
O=C(NNC(=O)N1CCC(OC[C@H]2CCCCO2)CC1)C1CCN(c2ncccn2)CC1	750274639	CRBAHELELDBBGG-LJQANCHMSA-N	446.552	1.484	50	20	IDGD	
COc1cc(OC)cc(N2C[C@H](C(=O)NNC(=O)c3c(C)nc4ccccn34)CC2=O)c1	752505597	WMURKXUFZNRYBG-CQSZACIVSA-N	437.456	1.474	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNC(=O)NC[C@H]2CCCN2S(C)(=O)=O)cc1	753691775	AVBMNLBFCOGSGG-MRXNPFEDSA-N	426.539	1.480	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N2CCOC[C@H](C)C2)cc1	754230861	WUCOMTUOPPENMI-YCPFAOKUSA-N	437.500	1.836	50	20	IDGD	
O=C(NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)N[C@@H]1[C@@H]2CCO[C@H]2C12CCC2	754675458	OBJHVMVXPFAJCA-RCCFBDPRSA-N	448.545	1.373	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)n([C@H]2CCS(=O)(=O)C2)n1	755530612	GSXHETXQDIAHCG-AWEZNQCLSA-N	443.489	1.408	50	20	IDGD	
Cc1ccc(S(C)(=O)=O)cc1NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	755537464	UQVDVAXKJLKFLQ-UHFFFAOYSA-N	429.458	1.112	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)Nc2cccc(-n3nnnc3C)c2)cc1	755757422	VBUMMVHKAAFCKQ-ZDUSSCGKSA-N	425.449	1.990	50	20	IDGD	
COc1cc(CN2CC[C@@H](NC(=O)NNC(=O)Cc3ccccc3F)C2)cc(OC)c1	756095172	MYMLHKPERSLOHD-QGZVFWFLSA-N	430.480	1.990	50	20	IDGD	
COC(=O)CCOc1ccc(NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1	756278515	KFUCEEVXIUOONO-UHFFFAOYSA-N	442.476	1.488	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)Nc1cc(S(N)(=O)=O)cc(C)c1C	756632910	DURKNURJHMPCCT-UHFFFAOYSA-N	438.531	1.904	50	20	IDGD	
CCOC(=O)[C@@H](C)NC(=O)c1ccc(NC(=O)NNC(=O)c2ccc(Cl)nc2)cc1	756791855	XWYPLQDORJAXKC-LLVKDONJSA-N	433.852	1.883	50	20	IDGD	
CCN(CC(=O)NNC(=O)c1cccs1)CC(=O)Nc1ccc(N2CCOCC2)cc1	756997937	VLPNXUGAYUDPQH-UHFFFAOYSA-N	445.545	1.306	50	20	IDGD	
CCn1c(SCC(=O)NNC(=O)C(=O)Nc2ccccn2)nnc1-c1cccc(C)c1	758830976	LKXROCZPSAHCRO-UHFFFAOYSA-N	439.501	1.547	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)c1cn(-c2cccc(C(F)(F)F)c2)nn1	760439227	HRDWLMJAQPRAGX-UHFFFAOYSA-N	442.398	1.962	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2ccc(Br)c(N)c2)n1	760546783	XAKISDAVJFSDDR-UHFFFAOYSA-N	427.280	1.343	50	20	IDGD	
Cn1ccc([C@@H](NC(=O)NNc2nc(O)c3cnn(C)c3n2)c2ccc(Cl)cc2)n1	763165181	QTUMZJNOMVPUDL-AWEZNQCLSA-N	427.856	1.872	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccnc(Cl)c2F)c1	763378161	BLBMGPRTURAMEI-UHFFFAOYSA-N	428.873	1.979	50	20	IDGD	
CCOC(=O)c1cc(F)c(F)cc1NC(=O)C(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	763468756	UBSDRFICGZJFPX-UHFFFAOYSA-N	436.327	1.449	50	20	IDGD	
C[C@@H](c1cccc(NC(=O)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c1)N1CCOCC1	763471180	FAYDXAVPXKKKLI-AWEZNQCLSA-N	441.444	1.388	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)Nc1ccc2c(cnn2C(F)F)c1	763570497	FKOJCTCIILGHHA-HNNXBMFYSA-N	431.355	1.357	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)COc2cccc(C)c2)cc1Br	763624171	SNGIKEMXVPQZRP-UHFFFAOYSA-N	436.262	1.931	50	20	IDGD	
COC(=O)c1cc(C(C)C)ccc1NC(=O)C(=O)NNC(=O)COc1ccccc1OC	763657736	QSPHACSNJFMLTD-UHFFFAOYSA-N	443.456	1.770	50	20	IDGD	
Cc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1	763797220	YZZPIPJSMSBQEE-UHFFFAOYSA-N	430.486	1.179	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])cc1Cl	763802384	DMMBEAAOJXROAY-UHFFFAOYSA-N	436.808	1.812	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)NC3CCOCC3)cc2)cc1	763830395	NMTXSCFZQCULMH-UHFFFAOYSA-N	438.484	1.558	50	20	IDGD	
Cc1cc(N2CCOCC2)ccc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccc(F)cc1	763865528	LEWXWYMBVNUXAD-OAHLLOKOSA-N	444.463	1.524	50	20	IDGD	
C#CCOc1cc(F)ccc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccc(C(C)=O)cc1	763870718	BUAARHVYDACFEE-AWEZNQCLSA-N	441.415	1.594	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)C(=O)Nc1cccc(Cn2cccn2)c1	763997307	JIMGYEDAXQYQDH-UHFFFAOYSA-N	431.250	1.422	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1cnn(-c2ccccc2Cl)c1	764138177	ABQIOXFFGRROLJ-UHFFFAOYSA-N	427.848	1.863	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(C(=O)NC)ccc2C)o1	764139585	VZTAGQFXWOGNBH-UHFFFAOYSA-N	429.477	1.189	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2O1)C(=O)Nc1ccc(N2CCSCC2)cc1	764152999	YWIFYZSFKHFBGP-GOSISDBHSA-N	426.498	1.329	50	20	IDGD	
CC(C)(C)[S@@](=O)Cc1cccc(NC(=O)C(=O)NNC(=O)COc2ccccc2O)c1	764275716	RNFNSBUORLSXRZ-HKBQPEDESA-N	447.513	1.604	50	20	IDGD	
CC(C)(C(=O)NNC(=O)C(=O)Nc1ncn(Cc2ccc(C#N)cc2)n1)c1ccccc1	764303157	SCYQOYGQCMTRIJ-UHFFFAOYSA-N	431.456	1.262	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)C(=O)Nc1ccccc1I	764318160	BSOOVLKOUAJAJU-UHFFFAOYSA-N	441.200	1.759	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1cc(C(C)(C)C)nn1-c1ccccc1C	764399121	ZNPLRYWPILRXII-HNNXBMFYSA-N	445.520	1.616	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COCCO1)C(=O)Nc1ccc(Oc2ccnc3ccccc23)cc1	764435338	UNNRKHYSWJNKJK-IBGZPJMESA-N	436.424	1.528	50	20	IDGD	
Cc1ccc(S(=O)(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)s1	765119460	RGTNSXRNKUDWCR-UHFFFAOYSA-N	442.994	1.837	50	20	IDGD	
COC(=O)NNC(=O)C(=O)Nc1ccc(CN2CCN(Cc3ccccc3)CC2)cc1	765377254	WQTCESSHCNAELQ-UHFFFAOYSA-N	425.489	1.330	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)CN2CCO[C@@H](c3ccc(OC(F)F)cc3)C2)cc1	766266364	AIAKGDKNOAUZOY-GOSISDBHSA-N	430.411	1.994	50	20	IDGD	
CN1CCO[C@@H]([C@H](NC(=O)NNC(=O)C(=O)Nc2ccccn2)c2ccc(Cl)cc2)C1	766319553	MZCLISPKCFEKBY-NVXWUHKLSA-N	446.895	1.076	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)[C@@H]2CC(=O)N(c3ccc(Cl)c(F)c3)C2)cc1	766320653	NKJWZBBXSZOYTH-CYBMUJFWSA-N	430.823	1.930	50	20	IDGD	
C[C@@H]1C(=NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)CC(=O)N1C(=O)OC(C)(C)C	766432296	JTJFHYMRONICSO-SECBINFHSA-N	444.897	1.629	50	20	IDGD	
Cc1c(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)c(=O)oc2ccccc12	766645176	YVFUQZMNLMHRQG-UHFFFAOYSA-N	448.479	1.320	50	20	IDGD	
Cc1nn(C)c(C)c1[C@@H](C)C(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	766659523	BVCBGXZHSPFLSM-OAHLLOKOSA-N	446.983	1.759	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2ccc(O)c(Br)c2)c1	767235543	AGOCTAPDVABYTJ-UHFFFAOYSA-N	442.291	1.702	50	20	IDGD	
COc1cc(C(=O)OCC(=O)NNC(=O)Cc2ccccc2C)c(N)c(OC)c1OC	767304555	ARUAROPQWUFFCQ-UHFFFAOYSA-N	431.445	1.150	50	20	IDGD	
CC[C@@H](C)[C@H](NC(=O)N1CCCC1)C(=O)OCC(=O)NNC(=O)Cc1ccccc1C	767348260	WJSOBWVXCDYAJW-QRWLVFNGSA-N	432.521	1.448	50	20	IDGD	
O=C(NNC(=O)c1cc(Cl)cc(Br)c1F)N[C@@H]1CCS(=O)(=O)C1	767681786	AZXHDRGBWOUXBS-SSDOTTSWSA-N	428.667	1.373	50	20	IDGD	
Cn1c(NNC(=O)CO[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)nc2ccccc2c1=O	768052484	YNMLIQATBALRHG-CQSZACIVSA-N	431.493	1.793	50	20	IDGD	
CSc1nnc(CCCNC(=O)NNc2nc(O)c3cnn(C)c3n2)n1CC(C)C	770396712	JHHKKQYZRIYSMV-UHFFFAOYSA-N	434.530	1.297	50	20	IDGD	
O=C(NNC(=O)c1cccn2c(O)nnc12)c1nc(-c2ccccc2)n(-c2ccccc2)n1	770465492	CYSIVFGKCHDPHT-UHFFFAOYSA-N	440.423	1.757	50	20	IDGD	
CC(C)c1nccnc1NNC(=O)C1CCN(C2=NS(=O)(=O)c3ccccc32)CC1	772834449	SVGWICFRBVKJBY-UHFFFAOYSA-N	428.518	1.904	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)c1ccc(N2NC(=O)CCC2=O)cc1	772956624	YBSGRVVEEJQIQA-LBPRGKRZSA-N	430.848	1.727	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)CN1C(=O)N[C@]2(CCCC[C@@H]2C)C1=O	772967062	LXJFKHPDTQPXQO-QAJFTPDKSA-N	436.896	1.755	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)c2csc(CNC(=O)OC(C)(C)C)n2)c1	773073839	ILGBEUOLKDGOOZ-UHFFFAOYSA-N	434.478	1.596	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)ccc1OC	773253089	XJYCHFMJVMPBAK-NSHDSACASA-N	442.877	1.912	50	20	IDGD	
O=C(NNC(=O)N1CCS(=O)(=O)c2ccccc2C1)c1cnn(-c2ccccc2)c1	773291025	HWWXEXNETBQWFJ-UHFFFAOYSA-N	425.470	1.516	50	20	IDGD	
C[C@@H]1Oc2ccccc2N(CC(=O)NNC(=O)[C@H]2CCCN(C(=O)OC(C)(C)C)C2)C1=O	773416522	BUQDVZZANCXDAV-GJZGRUSLSA-N	446.504	1.595	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2nccnc2C(C)C)cc1OCC(=O)NC1CC1	773993065	RGSCAVFLINVQED-UHFFFAOYSA-N	442.476	1.348	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)c1cccc(NS(=O)(=O)c2ccccc2)c1	778440480	HHLWVIPMKZMSHO-UHFFFAOYSA-N	448.501	1.773	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)c1sccc1S(=O)(=O)N1CCCCC1	778445500	OSZVHFGJDVXNSV-UHFFFAOYSA-N	446.551	1.208	50	20	IDGD	
COc1ccc(Cn2ccc(NC(=O)C(=O)NNC(=O)Cc3ccc(Cl)cc3)n2)cc1	778708905	AXUGPKVLFQYFAS-UHFFFAOYSA-N	441.875	1.922	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2cccc(C(=O)NNc3cc(Cl)nc(N)n3)c2)C[C@H](C)O1	779373325	FMPOIEKVLIBBEC-QWRGUYRKSA-N	440.913	1.267	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccccc1S(=O)(=O)NC1CC1)c1cc2ccccc2o1	780395151	FDICJIZONUPVKN-UHFFFAOYSA-N	435.483	1.497	50	20	IDGD	
CCOc1ccc(/C=C(/C#N)C(=O)O[C@H](C(=O)N[C@H]2CCS(=O)(=O)C2)C(C)C)cc1	782452180	ZXTIAPHVJPXDPF-DOJHIJEOSA-N	434.514	1.863	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2c(F)cc(F)cc2F)nc1	783264841	SDLAPRJQMUFNBL-UHFFFAOYSA-N	431.396	1.267	50	20	IDGD	
Cc1cc2cc[nH]c2cc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)NC(C)C)cn1	783265907	ZVIMHRBJEJIKQX-UHFFFAOYSA-N	430.490	1.640	50	20	IDGD	
Cn1c(=NNC(=O)C(=O)Nc2cccc3c2CCN3S(C)(=O)=O)sc2ccccc21	783352082	MPXJMIPHECCHIS-UHFFFAOYSA-N	445.526	1.133	50	20	IDGD	
O=C(NNc1cc(Cl)ccc1Cl)C(=O)Nc1ccnn1[C@H]1CCS(=O)(=O)C1	783369853	SHYKJRNVQOIIMP-JTQLQIEISA-N	432.289	1.631	50	20	IDGD	
O=C(NNc1nccnc1Cl)C(=O)N1C[C@H](C(=O)N2CCCCC2)Oc2ccccc21	784777616	BEESWUYQNSJURP-OAHLLOKOSA-N	444.879	1.380	50	20	IDGD	
COC(=O)c1ccc(-n2cc(C)cn2)c(NC(=O)C(=O)NNc2ccc(Cl)nn2)c1	784786108	DUELBUOFTACDMB-UHFFFAOYSA-N	429.824	1.493	50	20	IDGD	
O=C(NNc1ccnc(Br)c1)C(=O)Nc1ccccc1S(=O)(=O)C(F)F	784838262	UQGJBSDKNSESGW-UHFFFAOYSA-N	449.233	1.922	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNc2ccc(Cl)nc2)cc1S(=O)(=O)N(C)C	784870302	MIBVKCMYVHSYMY-UHFFFAOYSA-N	441.897	1.466	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNc2ccc(C(F)(F)F)nn2)ccc1N1CCCC1=O	784885872	GLHXVYAUOJXCGF-UHFFFAOYSA-N	438.366	1.713	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ncc(F)cn2)cc1S(=O)(=O)N1CCCCC1	784950324	XYRDIMXJTAVVJB-UHFFFAOYSA-N	436.469	1.181	50	20	IDGD	
CCc1ccc(NC(=O)C(=O)NNc2cccc(C(F)(F)F)n2)cc1S(N)(=O)=O	784951129	CYMKWVDPJXYDLI-UHFFFAOYSA-N	431.396	1.392	50	20	IDGD	
Cc1cc(Br)ccc1NC(=O)C(=O)NNC(=O)Cc1cn2ccccc2n1	785068198	VWMNSLZEBNDLLA-UHFFFAOYSA-N	430.262	1.734	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)c1ccc2c(c1)C(=O)N(C[C@H]1CCCO1)C2=O	790065428	NPTRYACUONAJEG-CQSZACIVSA-N	433.461	1.012	50	20	IDGD	
C[C@@]1(C2CC2)NC(=O)N(c2cccc(CNC(=O)NNC(=O)Cc3cccnc3)c2)C1=O	790710640	WRVJOZGXWHCHMZ-QFIPXVFZSA-N	436.472	1.380	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)/C=C\c1ccccc1)C(=O)NNc1nc2ccccn2n1	791253192	QZGCYFCPDGKJLU-QBOMHBFWSA-N	446.558	1.884	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)[C@@](C)(O)Cn1cc(C(F)(F)F)ccc1=O	792632898	GKSZZUZKJBFZQF-SFHVURJKSA-N	427.379	1.017	50	20	IDGD	
COCc1cc(C(=O)OC)cc(S(=O)(=O)NNC(=O)c2ccc3ccccc3n2)c1	793349079	KTILZDPMANWRBP-UHFFFAOYSA-N	429.454	1.791	50	20	IDGD	
O=C(NCCc1cccc(OCC(F)(F)F)c1)NNC(=O)C(=O)Nc1ccccn1	793483416	MPSZTKORZNKJLS-UHFFFAOYSA-N	425.367	1.534	50	20	IDGD	
COc1cc(N2C[C@H](C(=O)NNC(=O)c3cccc(C)n3)CC2=O)cc(OC)c1OC	794089770	JSNWESSWBMGOJX-CYBMUJFWSA-N	428.445	1.230	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)C[C@@H](CC#N)c2ccccc2)CC1	795108539	JOBJQNSSLUBWKQ-GOSISDBHSA-N	442.545	1.548	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)c(OC)c(C)c1OC	796990758	XBSMLLZIFHXYSM-UHFFFAOYSA-N	435.408	1.325	50	20	IDGD	
CNC(=O)C[C@H](NC(=O)NNc1ccc(S(=O)(=O)NC(C)C)cn1)c1ccccc1	797546249	VZNLCCIUGFNDAK-INIZCTEOSA-N	434.522	1.272	50	20	IDGD	
COC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)c1C	798042642	XAAJCBMEYZWCPN-UHFFFAOYSA-N	425.401	1.210	50	20	IDGD	
CCOc1cccc(S(=O)(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)c1	799922531	JUJPYSOQYQUITK-UHFFFAOYSA-N	446.573	1.521	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(C(=O)NNc2cc([N+](=O)[O-])ccc2Br)cn1	800616217	GIIHNCGQKFPXFW-UHFFFAOYSA-N	444.267	1.760	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)C2CCN(S(C)(=O)=O)CC2)c(OC)cc1Cl	802080477	XAEGQCBZBGGGDD-UHFFFAOYSA-N	434.902	1.182	50	20	IDGD	
CCn1c(=O)nc(O)c2c(C(=O)NNc3ccc(-n4ccnc4)nn3)cc(C3CC3)nc21	804953608	WTKNBLCZICDUAD-UHFFFAOYSA-N	433.432	1.127	50	20	IDGD	
COCc1csc(NC(=O)C(=O)NNC(=O)c2cc(F)ccc2Br)n1	806978447	BVRWNMNSNMNZGE-UHFFFAOYSA-N	431.243	1.591	50	20	IDGD	
O=C(NC[C@H](c1cccs1)N1CCOCC1)NNC(=O)c1cc(Br)c[nH]1	806994330	TULFZOBVXZQPHX-CYBMUJFWSA-N	442.339	1.856	50	20	IDGD	
CC[C@@H]1[C@H](C(=O)NNC(=O)CCN2C[C@H](C)O[C@@H](C)C2)CCN1C(=O)OC(C)(C)C	809981607	QWHVOKKYEGDAET-MWDXBVQZSA-N	426.558	1.669	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CNS(=O)(=O)c2cc(C(F)(F)F)ccc2Cl)o1	810490446	QFVFPCQTXRCDNY-UHFFFAOYSA-N	439.799	2.000	50	20	IDGD	
COC(=O)c1ccc(Cl)c(C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c1	811292362	WYEXNLVYCQLMSB-UHFFFAOYSA-N	435.776	1.653	50	20	IDGD	
O=C(COC(=O)Cc1cncn1Cc1ccccc1)NNC(=O)c1ccc([N+](=O)[O-])cc1	811328896	YEYCFGQWVWCGSY-UHFFFAOYSA-N	437.412	1.387	50	20	IDGD	
CCOCc1nc([C@@H](C)NC(=O)NNc2ccc(S(=O)(=O)N(CC)CC)cn2)no1	812564113	NCLOSXQAPCTMHV-GFCCVEGCSA-N	441.514	1.419	50	20	IDGD	
Cc1c(C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)nnn1-c1cccc([N+](=O)[O-])c1	812732280	ZDKLPEBNVPZXKF-UHFFFAOYSA-N	445.461	1.491	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)c1cnn(-c2ccccn2)c1N	815854770	PSFYGFYAZBJENF-UHFFFAOYSA-N	429.506	1.683	50	20	IDGD	
Cc1ccc(N2C[C@H](C(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)CC2=O)cc1F	844256014	YYHCWFWOWQNPSV-CYBMUJFWSA-N	437.431	1.195	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)[C@@H]2C[C@H](O)CN2S(=O)(=O)c2ccc(Cl)cc2)n1	877457682	QYMRHBBYKOFFLD-ZFWWWQNUSA-N	425.898	1.014	50	20	IDGD	
COc1ccc(-c2nn(CCC#N)cc2/C=C(\C#N)C(=O)NCC(=O)NC2CC2)cc1OC	914464802	WXVXZDNQLXPWTR-MHWRWJLKSA-N	448.483	1.783	50	20	IDGD	
Cc1cc(C)nc(-n2nc(C)c(CC(=O)NNC(=O)C(=O)Nc3ccc(C)c(C)c3)c2C)n1	914595098	UJORJGJJJCHXDP-UHFFFAOYSA-N	449.515	1.841	50	20	IDGD	
Cc1cc(C)c(N2C[C@H](C(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)CC2=O)c(C)c1	914750520	JNOFSHTYORIGEL-MRXNPFEDSA-N	447.495	1.673	50	20	IDGD	
CCn1c(NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)o2)nc2ccccc2c1=O	914755940	BOOCTOKKTHFDKY-UHFFFAOYSA-N	431.474	1.551	50	20	IDGD	
C=CCn1c(=O)c2ccccc2n2c(SCC(=O)NNc3nccc(OC)n3)nnc12	914848508	AETHUWMXGNMLBQ-UHFFFAOYSA-N	438.473	1.264	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)C[C@H](C)n2nc(C)cc2C)c1	915685616	HSIAOKCBJBXATA-INIZCTEOSA-N	435.550	1.943	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cccc(C(=O)OC)c2)c1	916096151	ITTUKQRVVZJSJO-UHFFFAOYSA-N	433.486	1.579	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)NCCCOC[C@@H]2CCCO2)c2ccccc2c1=O	916210181	XWBXELDWMZOZGX-HNNXBMFYSA-N	431.493	1.507	50	20	IDGD	
Cc1ccc([C@@H](CNC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])N2CCOCC2)o1	916229028	LGONCAJFPCWENP-MRXNPFEDSA-N	447.448	1.279	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1CNC(=O)NNC(=O)Cc1c[nH]c2ccccc12	916237621	JBTBDOHAUSNLOW-UHFFFAOYSA-N	429.502	1.491	50	20	IDGD	
CC(=NNC(=O)[C@H]1COc2ccccc2O1)c1ccc(S(=O)(=O)NCCC(=O)O)cc1	916291761	GNZKQQSJFKDIGW-GOSISDBHSA-N	447.469	1.120	50	20	IDGD	
CCN(CCO)c1ccc(C=NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)c(C)c1	916338050	LVJBPNQHMKGWPK-UHFFFAOYSA-N	438.937	1.878	50	20	IDGD	
NC(=O)c1cc(NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)ccc1F	916376573	RVEIRVNCNPVYLE-UHFFFAOYSA-N	449.464	1.176	50	20	IDGD	
COc1ccc(N2CCCN(CC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)CC2)cc1	917207933	QFAAODXFHMGFNR-UHFFFAOYSA-N	427.461	1.577	50	20	IDGD	
Cc1ccc(C(=O)NNS(=O)(=O)c2cc(C(=O)O)ccc2Br)c(O)c1	917753743	OJQPAYWVPIRXEI-UHFFFAOYSA-N	429.248	1.785	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(C(=O)N2CCOCC2)cc1)c1ccc(Cl)cc1O	917757858	CMUNHXGGBDGJTD-UHFFFAOYSA-N	439.877	1.141	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)NCc2cccc(NC(=O)CCN3CCOCC3)c2)n1	918092028	HNMHJPYMWURYGQ-UHFFFAOYSA-N	427.509	1.581	50	20	IDGD	
O=C(NCc1ccc(N2CCOCC2)c(F)c1)NNC(=O)c1cc(Br)c[nH]1	918223717	IMXDYFQGGQPCPT-UHFFFAOYSA-N	440.273	1.897	50	20	IDGD	
Cc1nccn1CCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	918223968	NCEICWBPTAUOHL-UHFFFAOYSA-N	434.522	1.010	50	20	IDGD	
O=C(NNC(=O)N1CCN(C(=O)Cc2ccccc2)CC1)c1cc(Br)c[nH]1	918778775	OMEZTYMSROTXCH-UHFFFAOYSA-N	434.294	1.519	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)NCCn2ccnc2)cc1	920855056	VZIXRJCLSOPCCT-ATVHPVEESA-N	433.472	1.354	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)N2CCN([C@H]3CCS(=O)(=O)C3)CC2)c(C)n1CC(C)C	921246066	YIQKTPCHKCJXJH-HNLWVNFGSA-N	432.590	1.999	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)N[C@@H](c2ccccc2)c2cnn(C)c2)nc1	1320964907	SZOBAZJZGBSATL-IBGZPJMESA-N	443.533	1.918	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2cccc(C(=O)NCC(F)(F)F)c2)cc1	1323443876	XGPGGDLZIRHCAA-UHFFFAOYSA-N	431.392	1.611	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)COc1ccc(O)nn1)C2	1780707787	LZQPONJYYUHPJM-IQUTYRLHSA-N	426.901	1.092	50	20	IDGD	
C[C@H](NC(=O)c1ccc(F)cc1)C(=O)N1CC[C@@]2(CN(C(=O)C(Cl)Cl)CCO2)C1	1780907411	YJIIKPAGYLRVQE-BUXKBTBVSA-N	446.306	1.578	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3c(-c4ccncn4)noc3C)CCO2)C1	1781221092	JKWLGHHDDVWPIE-VLIAUNLRSA-N	433.896	1.901	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)C#CC3(O)CCCCC3)CCO2)C1	1781230716	YDLJYNHNDHYKRQ-UYAOXDASSA-N	431.360	1.751	50	20	IDGD	
CCOc1ncccc1C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781327254	XSZBNKBWPCRNLT-GUYCJALGSA-N	430.274	1.614	50	20	IDGD	
Cc1cnc2c(C(=O)N3CCO[C@]4(CCN(C(=O)[C@@H](F)Br)C4)C3)cnn2c1	1781331179	FZGICEINNUKRJH-DYVFJYSZSA-N	440.273	1.172	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](Cl)COC)C2	1781516467	NHQAJRHJERSGPG-DEXNDLTESA-N	434.917	1.316	50	20	IDGD	
C#CC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1781690684	GUARBAXGYKDPDE-BXTJHSDWSA-N	427.929	1.266	50	20	IDGD	
CC[C@H](NC(C)=O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](Br)CC)C1	1781897910	UQBHRNGTXBBXPB-YYAJDYIMSA-N	446.386	1.589	50	20	IDGD	
O=C(c1nc2ccc(F)cn2n1)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1782569927	VJPQUNYUZVELKJ-WBMJQRKESA-N	444.236	1.002	50	20	IDGD	
CCOC(=O)C1(C(=O)N2CC[C@@]3(CN(C(=O)[C@H](Br)CC)CCO3)C2)CC1	1782923709	YNXNEPQYAJXDKX-CXAGYDPISA-N	431.327	1.333	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](O)c1ccccc1Cl)CCO2	1783539454	JHATWVIGELCQHS-PNPHSEOMSA-N	445.741	1.987	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H]1Cc3ccccc3CN1C)CCO2	1783873676	SFWWFJYOOOSJPJ-CNNODRBYSA-N	435.952	1.127	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cccc(SC)c3O)CCO2)C1	1783883178	VTZKYJHAQBXUQO-AUUYWEPGSA-N	428.938	1.811	50	20	IDGD	
O=C(CCn1c(=O)oc2ccccc21)N1CCO[C@@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783943439	IUUXYJDWZWLBJZ-IBGZPJMESA-N	442.299	1.618	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]2C1	1783973853	DLXOCFJYDGBGFL-MRLBHPIUSA-N	449.342	1.559	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(Cl)c4nncn4c3)C[C@@H]21	1789863461	SBOBCULXGHHPLW-ZIEJDFEHSA-N	440.331	1.993	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3C[C@@]34C(=O)Nc3ccccc34)C[C@@H]21	1789864912	KDWBQPPSDSCXRE-MSRFIVAGSA-N	445.947	1.894	50	20	IDGD	
O=C(CN1C(=O)CNC1=O)NC1(c2ccc(NC(=O)[C@H](F)Br)cc2)CCC1	1790531974	KGQDYFKKVJJSIS-AWEZNQCLSA-N	441.257	1.363	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3noc4c3CCCC4)C[C@@H]21	1791253649	DNYLWIMAKJNCIB-QEWYBTABSA-N	425.913	1.401	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(F)(F)c1ccco1)C2	1792872216	RDTZWMBWEQRYQR-FMSGJZPZSA-N	435.265	1.992	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccc(Br)cn1	1794157535	USFDHGRRVFHAMK-RBNVPPIJSA-N	444.757	1.994	50	20	IDGD	
Cc1ccncc1CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnccc1C(=O)NN)C2	1794373581	IJRGTXVDTQVVLB-BCDXTJNWSA-N	436.516	1.273	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(N(C)C)cn1	1794462550	QSTUJERWBSYOQG-IARIHHJXSA-N	439.354	1.524	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccc(F)c(F)c1	1795298468	OFIWGGONXWGVKA-MMPOEDRJSA-N	431.277	1.880	50	20	IDGD	
O=C(Cc1ccc(Cl)c(F)c1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1	1796189776	YWQJESVURVBAHG-BCDXTJNWSA-N	444.699	1.653	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](C)[C@@H]1SC(=N)NC1=O	1796876784	FIBNOYCRTNHFKI-QPHKQPEJSA-N	445.383	1.601	50	20	IDGD	
CCOc1ncc(Cl)cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](Cl)COC)C2	1798209384	YBPWTUBHWNDNIG-NOXHYTERSA-N	446.331	1.591	50	20	IDGD	
CC(C)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1[nH]cnc1-c1cccnc1	1798491347	RHYJYCPFMWHHOJ-MUJYYYPQSA-N	431.924	1.940	50	20	IDGD	
CCOc1ccccc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2	1798831894	RYKMFGNCWRREED-VZAMPYOESA-N	429.286	1.979	50	20	IDGD	
COc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Br)C3)ccc1O	1798952744	FMPDAIFGZOODRM-JLUCKKNBSA-N	431.258	1.295	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cn3nc(C)sc3n1)C2	1799263741	VCJRJGNINYEALE-FAXLKDOZSA-N	425.942	1.249	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc3c(c1)OCO3)C2	1799275097	NGPOGGZTJIPBBC-VLBMKZOESA-N	443.327	1.784	50	20	IDGD	
COc1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](O)CCl)C3)c([N+](=O)[O-])cc1O	1799307190	HITHVSAQQHZSGZ-JNIYBQFBSA-N	427.841	1.161	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc(F)cc1F)C2)[C@H](F)Br	1799346917	IYSYMNQTZFTQLG-OJXGSEEGSA-N	435.240	1.787	50	20	IDGD	
CC(C)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnc2c(c1)CCNCC2	1800244237	YUGKJWMZFPKTEG-IZZQQSIFSA-N	434.968	1.238	50	20	IDGD	
CN(C)[C@@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)c1ccc(Cl)cc1	1800303988	LUWXTHXCXDOJKY-QJESEZNXSA-N	444.359	1.132	50	20	IDGD	
COc1c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)ccc(F)c1F	1800584766	FQCSLFAYCNWXDR-MUJYYYPQSA-N	444.243	1.219	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc(OC)c(F)c1)C2	1800638831	AJJVSKRREUDGAA-XFMPKHEZSA-N	444.301	1.606	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CC(=O)OC(C)(C)C)C2	1800640465	ZEPNHLPNHPPHKZ-ZWUHOBOKSA-N	433.343	1.481	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3[nH]ccc3n1)C2	1800641322	YOPJNBNRRXGMOU-IPJQOSJUSA-N	435.322	1.940	50	20	IDGD	
COc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)Br)ccc1C	1800760584	UXUUZZXIJKKFAJ-FAYQHZLMSA-N	425.323	1.990	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CC=CC[C@H]1C(=O)OC	1800951392	CWKWLKAYGBNMOJ-RFSXOUPVSA-N	426.941	1.739	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](CC1CC1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](O)CCl)C2	1802173263	VCJCLUCQRWOCMZ-JJTUDDRGSA-N	443.972	1.918	50	20	IDGD	
COC(=O)NCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C(C#N)=C/c1ccc(F)cc1F)C2	1802702791	IBEVJKMFAPERHJ-RMWXTBGQSA-N	432.427	1.866	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc3nc[nH]c3c2)[C@@H]1c1cccnc1)[C@H](O)CCl	1803143117	UKIDLCJRNSPFMP-KFKAGJAMSA-N	427.892	1.877	50	20	IDGD	
COc1cc(F)ccc1CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCC(=O)NN(C)C)C2	1804514621	NGXCEAHUPDUSGR-BCDXTJNWSA-N	434.512	1.388	50	20	IDGD	
COc1ccc(C(=O)N2CCC3(CCCN(C(=O)[C@@H](O)CCl)C3)CC2)c(O)c1OC	1805525907	ATPRFXDEBLAYOX-HNNXBMFYSA-N	440.924	1.854	50	20	IDGD	
Cc1nc(C(=O)NC[C@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)cs1	1805966054	BGWUAQXQZJITIF-OXQOHEQNSA-N	444.561	1.539	50	20	IDGD	
COCCn1ccc(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](Cl)COC)[C@H]2c2cccnc2)n1	1808659041	GARWDFMFJHBRQI-LNLFQRSKSA-N	449.939	1.498	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)CO[Si](C)(C)C)[C@@H]1c1cccnc1	1810548664	RZGBMBUFNQTIPP-UTKZUKDTSA-N	449.628	1.312	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)CC(=O)NC)[C@@H]1c1cccnc1	1812773555	HCINBMCFWIXQAB-GRDNDAEWSA-N	425.327	1.397	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)[C@H](O)Cc2ccccc2)[C@@H]1c1cccnc1	1812773565	UNUJJDDHCFEJBK-MHTWAQMVSA-N	445.947	1.945	50	20	IDGD	
C[C@H](C(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1)C1(O)CCC1	1813067722	BONORVANHBKKIC-PLMTUMEDSA-N	445.564	1.012	50	20	IDGD	
CN1CCN(CC(=O)N2CC[C@H](CNC(=O)C(Cl)Cl)[C@@H]2c2cccnc2)CC1	1813077202	DVPLPULXAVTGHJ-WBVHZDCISA-N	428.364	1.139	50	20	IDGD	
C[C@H](CBr)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H]2CNC(=O)O2)[nH]n1	1814778334	GHGBXUMODGJPCQ-JLLWLGSASA-N	428.287	1.541	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc3nc(CO)[nH]c3c2)[nH]n1)[C@H](O)CCl	1814871247	LLPSAQYSJFFNGV-JKSUJKDBSA-N	446.895	1.684	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1ccoc1Cl)CC2)c1ccc(B(O)O)cc1	1815343955	YUDYNLXMJRYJDW-LBPRGKRZSA-N	445.693	1.609	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(O)nc(O)n3)sc2C1	1817104119	VPRKOBJDADQQTJ-QZTNRIJFSA-N	446.316	1.806	50	20	IDGD	
O=C(N[C@H]1CCc2nc(NC(=O)[C@H](F)Cl)sc2C1)c1cc(=O)nc2sccn12	1817125444	OJZIMZGABNYHDL-MADCSZMMSA-N	441.897	1.973	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)C[C@H]2CCCCO2)[nH]n1)c1cccc(B(O)O)c1	1817473804	AQIMRPKTQIVQTN-MJGOQNOKSA-N	440.309	1.355	50	20	IDGD	
COCc1c[nH]c(C(=O)Nc2cc([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)c1	1820158084	AQFOZRCUXOOANV-QGZVFWFLSA-N	445.524	1.563	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccnc(Cl)n2)[nH]n1	1822414288	AAIKUUMICCQKMC-AWEZNQCLSA-N	448.915	1.532	50	20	IDGD	
CC(C)[C@H](S)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1	1824540158	HANKGCVPLPVHSH-OALUTQOASA-N	447.605	1.873	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](N)c1ccccn1)CC2	1825640609	BSUFLFOUVPMGCN-BHDSKKPTSA-N	438.351	1.934	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnc(N(C)C)o1)CC2	1825994739	YRFPJZMJODEGAD-NXEZZACHSA-N	427.914	1.677	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CN2CCNC2=N)CC1	1826873925	PCVWBANAJOHOJT-ZFWWWQNUSA-N	428.375	1.229	50	20	IDGD	
CC(=O)C[C@H](C)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2	1830543908	HGRYUNIDXHYTNG-DEYYWGMASA-N	433.343	1.089	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(CC)n(C)n3)C2)C1	1831653712	CXNVYJCKEMYQQD-UZLBHIALSA-N	426.945	1.460	50	20	IDGD	
Cc1cc(C(=O)N2CCC(N3CCC(NC(=O)[C@H](O)CCl)CC3)CC2)ccc1F	1833313235	AZKNHKNPRGBINO-LJQANCHMSA-N	425.932	1.919	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)C#Cc3ccccc3)CC2)CC1	1834518710	VXORTJBQYOXWPZ-OAQYLSRUSA-N	431.964	1.864	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)c3ccc(F)cc3)C2)C1	1834824217	XPZASIOUDCLAJY-SFHVURJKSA-N	429.286	1.681	50	20	IDGD	
C[C@@H](C(=O)N1CCOC[C@]2(CN(C(=O)CCBr)CCO2)C1)c1ccccn1	1834826456	QLWOSIJKNYNPST-BEFAXECRSA-N	440.338	1.427	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCC(N2CCC(NC(=O)Cn3cncn3)CC2)CC1	1834872452	CUQJQDYZNLDGGP-SFHVURJKSA-N	431.368	1.086	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccc(F)c(F)c3)CCO2)C1	1835140422	GUJLZQWDLYKDDC-QRWLVFNGSA-N	430.879	1.981	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)C[C@](C)(O)CC(=O)O)CC2)CC1	1836397318	DIRFOQOVGBAKFD-UZLBHIALSA-N	431.961	1.191	50	20	IDGD	
O=C(NCCC(=O)N1CCC(OC2CCN(C(=O)[C@H](F)Cl)CC2)CC1)c1ccc[nH]1	1837148094	WJZWEUGUFKGLKD-SFHVURJKSA-N	442.919	1.668	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccn4nccc4c3)CCO2)C1	1837155593	KPVZMCQQOGDCNY-GHTZIAJQSA-N	434.924	1.812	50	20	IDGD	
C[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1)N1C[C@H]2C[C@@H]2C1	1837279261	SUNZTDICENZATA-BZLDKRAPSA-N	427.973	1.048	50	20	IDGD	
O=C(c1ccc(C(F)(F)F)[nH]1)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1837766925	VXTQAEMWQQVDAN-HNNXBMFYSA-N	444.237	1.907	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4c(c3)OCCO4)C2)C1	1839144601	FWRHNCADNSAKQB-IERDGZPVSA-N	438.908	1.545	50	20	IDGD	
O=C([C@H](F)Br)N1CCO[C@]2(COCCN(C(=O)[C@H]3C[C@]3(F)Cl)C2)C1	1839203050	XOZITHDACJFXMJ-XXSPCDMZSA-N	431.661	1.058	50	20	IDGD	
C#CCCCCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](Br)CC)CCO2	1839967761	XXNYVCWSKRDVBL-VQIMIIECSA-N	429.355	1.810	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2	1840030407	KQHLGQJNOPOGMG-WWGRRREGSA-N	425.751	1.634	50	20	IDGD	
CC(C)c1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)n[nH]1	1840034459	MFFCJILDHMIHGI-ACJLOTCBSA-N	443.342	1.387	50	20	IDGD	
COc1ccc(/C=C/C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)c(F)c1	1840074897	CSBQKORTYIESQV-FWZQBEMLSA-N	444.862	1.838	50	20	IDGD	
Cc1cccc(F)c1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1840651522	CCOYVUHWUGLUSV-QAPCUYQASA-N	447.276	1.895	50	20	IDGD	
CCOc1c(C(=O)N2CCCC23CN(C(=O)C(Cl)Cl)C3)cnc2c1cnn2C	1843215000	WDWGQPWLGJSXSG-UHFFFAOYSA-N	426.304	1.988	50	20	IDGD	
CCOC(CC(=O)N1CC2(CCCN2C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C1)OCC	1843416810	DOOVUMBKXKBXGQ-HZHRSRAPSA-N	433.509	1.113	50	20	IDGD	
Cn1ccc2c(O)ncc(C(=O)N3CC4(CCCN4C(=O)[C@@H](F)Br)C3)c21	1845218587	OIBIZJRGVNNMQH-CYBMUJFWSA-N	425.258	1.786	50	20	IDGD	
O=C([C@H](O)CCl)N1CC2(CCCN2C(=O)c2ccc(Br)c([N+](=O)[O-])c2)C1	1845335495	ZFBPGPZBHSTZOC-CYBMUJFWSA-N	446.685	1.774	50	20	IDGD	
Cc1cc2cc(C(=O)N3CCCC34CN(C(=O)c3cnccc3C(=O)NN)C4)ccc2[nH]1	1845715464	PMDYTLCIMFTKIR-UHFFFAOYSA-N	432.484	1.606	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)Cc1noc(C(C)C)n1	1848161572	IYNABUBRHYXPRJ-LISPERENSA-N	441.492	1.071	50	20	IDGD	
Cc1cccc(NS(=O)(=O)c2cc(C(=O)NNC(=O)C(=O)NC3CC3)ccc2C)c1	9889985	VVVBJLDGEFEILG-UHFFFAOYSA-N	430.486	1.144	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)[C@@H]2CC(=O)N(c3ccccc3OC)C2)cc1OC	12691701	DCKQYNDQOALQRK-OAHLLOKOSA-N	427.457	1.917	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)[C@H]1CC(=O)N(c2cc(Cl)ccc2OC)C1	15668575	GJCGZMFBBJILEO-ZDUSSCGKSA-N	447.875	1.937	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(C)c(C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1	15795075	FNAFHXSXDBEKIY-IBGZPJMESA-N	447.513	1.627	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc[n+]([O-])c2)c1	23710436	GBOOVNINTLHPPM-UHFFFAOYSA-N	442.453	1.204	50	20	IDGD	
CN(CC(=O)NNC(=O)c1cc(-c2ccccc2)on1)C1=NS(=O)(=O)c2ccccc21	27262278	IDSNCFGXJZMXQO-UHFFFAOYSA-N	439.453	1.184	50	20	IDGD	
CNS(=O)(=O)Cc1ccc(CNC(=O)NNC(=O)c2cn(C)c3ccccc23)cc1	46918694	PRFXWWJABWBWKI-UHFFFAOYSA-N	429.502	1.372	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CS[C@@H]2CCS(=O)(=O)C2)ccc1OCCC(C)C	105007682	ALOXQCJFZFGZCD-OAHLLOKOSA-N	444.575	1.801	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)NCc2cccc(C(=O)NCCN(C)C)c2)c1	727480164	WIVDFFPPVJNQQC-UHFFFAOYSA-N	427.505	1.196	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3cc(F)cc4nccnc34)cc2)CC1	728216328	WIQRMGHFMSARAO-UHFFFAOYSA-N	444.492	1.462	50	20	IDGD	
COc1ccccc1/C(C)=C\C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	728344605	XLQOAMZAHMIIFW-KWRJMZDGSA-N	426.425	1.629	50	20	IDGD	
COc1ccc(Nc2nc(Cl)c(C=NNC(=O)[C@@H](C)NS(C)(=O)=O)s2)cc1	728437255	OHNWKHWYOCMXHM-SECBINFHSA-N	431.927	1.937	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)[C@@H]2CC(=O)N(Cc3ccco3)C2)c1	728527238	DJFSJBRCBHVOFZ-LLVKDONJSA-N	436.262	1.860	50	20	IDGD	
Cc1ccc([C@@H](CNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)N2CCCC2)o1	728951112	BOVGWECJXAGMHZ-GOSISDBHSA-N	441.536	1.762	50	20	IDGD	
CC(C)N(CCCNC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)C(=O)OC(C)(C)C	729054913	QBSZRGANUAKFEY-UHFFFAOYSA-N	446.512	1.642	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(-c3ncon3)cc2)cc1OC	730626351	QPGAGLATUZXZPI-UHFFFAOYSA-N	426.385	1.372	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])o1	732052506	MMZXNVMTRIOFQA-GFCCVEGCSA-N	426.389	1.210	50	20	IDGD	
CCc1cc(N2CCC[C@@H](NC(=O)NNC(=O)c3cc(OC)cc(OC)c3)C2)ncn1	732915069	YRTPTAKDHPBXGA-MRXNPFEDSA-N	428.493	1.669	50	20	IDGD	
CN(C)C(=O)[C@H]1CCC[C@@H](NC(=O)NNC(=O)COc2ccc(Br)cc2)C1	734221197	MBMOXUAWRUGQHY-GXTWGEPZSA-N	441.326	1.805	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@@H]2CCC[C@@H](C(=O)N(C)C)C2)c2ccccc2c1=O	734222787	WNPNLQRWAMXJPY-ZIAGYGMSSA-N	428.493	1.007	50	20	IDGD	
O=C(NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12)N[C@@H]1CCN(C2CC2)C1	734285311	IVPDHUAGLRIBBG-QGZVFWFLSA-N	446.511	1.626	50	20	IDGD	
C[C@H](CC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1cccc(F)c1	734767705	BSTCCXUNAKQYGW-OAHLLOKOSA-N	449.504	1.801	50	20	IDGD	
O=C(NCc1cccc(C(F)(F)F)c1)NNS(=O)(=O)c1ccc2c(c1)C(=O)NCC2	734806995	FFLHOKAEZBPZQZ-UHFFFAOYSA-N	442.419	1.684	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CSc2nnc(O)n2C[C@@H]2CCCO2)cc1C	735979352	JMYAJYQQJPRREA-NSHDSACASA-N	425.536	1.648	50	20	IDGD	
CCCCS(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)Cc2cccnc2)cc1	737757212	NUVFYHBVYCUCNO-UHFFFAOYSA-N	426.520	1.176	50	20	IDGD	
COc1ccc(-c2nn(CCC#N)cc2/C=C(/C#N)C(=O)N[C@@H]2CCN(C)C2=O)cc1OC	737992586	GOKXJYZFNLLDLP-MUMAZLPKSA-N	448.483	1.735	50	20	IDGD	
CS(=O)(=O)[C@@H]1CCC[C@H](NC(=O)NNC(=O)c2cc(F)ccc2Br)C1	741093368	QDTVDNQNOKNGTR-WDEREUQCSA-N	436.303	1.888	50	20	IDGD	
O=C(NNC(=O)c1cccc2ccccc12)c1ccc(S(=O)(=O)N2CCOCC2)o1	741576524	VJAAQBWMZOFMOK-UHFFFAOYSA-N	429.454	1.529	50	20	IDGD	
CC(C)c1nc(C#N)c(NNC(=O)CCCN(C)C2=NS(=O)(=O)c3ccccc32)o1	742058083	MLJNRZWSHOBSLF-UHFFFAOYSA-N	430.490	1.974	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C[C@@H](C)/N=C2/NS(=O)(=O)c3ccccc32)c1	742472362	PPYXNGAZVPBEAI-OAHLLOKOSA-N	444.513	1.347	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNS(=O)(=O)c1ccc(C(=O)O)c(Cl)c1	743249480	DAJWZTXGHYNWRN-UHFFFAOYSA-N	428.850	1.825	50	20	IDGD	
CN1CCN([C@@H](C(=O)NNC(=O)c2cc(Br)ccc2O)c2ccccc2)CC1	743730204	RUOCNDONBSUMOA-GOSISDBHSA-N	447.333	1.904	50	20	IDGD	
Cc1cc(C)n(-c2ccc(C(=O)NNC(=O)Nc3ccc(S(C)(=O)=O)cc3)cn2)n1	743831260	UMOWUKIZDBFEQU-UHFFFAOYSA-N	428.474	1.754	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CN2CCN(Cc3nc(-c4cccs4)no3)CC2)c1	744386028	WSIOXWIIKZLKCT-UHFFFAOYSA-N	440.529	1.685	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1cc2ccccc2nc1O	744619765	XTTAKSIMVUZQGS-UHFFFAOYSA-N	428.470	1.718	50	20	IDGD	
COc1ccc([C@@H](CNC(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)N(C)C)cc1OC	745289037	DPJYGGRZTUSGRJ-OAHLLOKOSA-N	447.448	1.565	50	20	IDGD	
COc1ccccc1[C@@H](NC(=O)NNC(=O)c1cc([N+](=O)[O-])ccc1O)c1nccn1C	745400140	LMSXHLNBSUPBGT-QGZVFWFLSA-N	440.416	1.776	50	20	IDGD	
O=C(NCCc1ccc(S(=O)(=O)N2CCCCC2)s1)NNC(=O)C1CCCC1	745890290	QSNGVUWXAVSFBM-UHFFFAOYSA-N	428.580	1.986	50	20	IDGD	
COCc1nc(OC)c2c(C)c(C(=O)NNC(=O)c3cncc(NC(C)=O)c3)sc2n1	746300112	POZHLWFHEYXBDY-UHFFFAOYSA-N	444.473	1.583	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)[C@H]1CCCN(C(=O)N2CCc3sccc3C2)C1	747322979	VRZWKDRYCKITQJ-KRWDZBQOSA-N	427.530	1.723	50	20	IDGD	
O=C(CN1C(=O)N[C@]2(CCc3ccccc32)C1=O)NNC(=O)c1ccc(Cl)cc1F	747330393	UFPRZTUFZXBWDV-FQEVSTJZSA-N	430.823	1.634	50	20	IDGD	
Cc1nc(Cl)cc(NNC(=O)CNS(=O)(=O)c2ccc3c(c2)OCCCO3)n1	748333200	BZFVVLRUIJJJLZ-UHFFFAOYSA-N	427.870	1.021	50	20	IDGD	
CN(CC(=O)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1)c1ncnc2[nH]cnc12	748518874	QMEQUIJTLXOGPP-UHFFFAOYSA-N	429.384	1.226	50	20	IDGD	
O=C(CCCC(=O)c1ccc(Cl)c(Cl)c1)NNC(=O)N[C@H]1CCS(=O)(=O)C1	753959067	RUMDOGVQGGVTAF-NSHDSACASA-N	436.317	1.864	50	20	IDGD	
C[C@H](NCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	754310243	BVSKBMQVDXLOOS-GOEBONIOSA-N	449.508	1.981	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)Nc2cccc(S(=O)(=O)NC3=NCCCCC3)c2)n[nH]1	755496154	RDRLMXQQIUFMFI-UHFFFAOYSA-N	433.494	1.435	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])ccc1N1CCCC1=O	755592269	JGCXMXVNXYXVHD-UHFFFAOYSA-N	443.416	1.962	50	20	IDGD	
COC(=O)Nc1ccc(NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1	755964481	PLURVYMFARVNQF-UHFFFAOYSA-N	449.489	1.647	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N[C@H](C)[C@H](C)CO)cc1	757090308	WSWHPAIWCHWPGT-IGIWSDCRSA-N	425.489	1.474	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)NC2CC2)cc1)NNc1nc(O)c2ccccc2n1	758309510	UBQNYBFLONYEEU-UHFFFAOYSA-N	427.486	1.852	50	20	IDGD	
CC(C)(C)c1nnc(CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)s1	758832968	BKPHMSYQGDOWGK-UHFFFAOYSA-N	425.540	1.273	50	20	IDGD	
COc1ccc(Br)c2[nH]c(C(=O)NNC(=O)C(=O)Nc3ccccn3)cc12	758839458	NSRXWLDISSWOIL-UHFFFAOYSA-N	432.234	1.734	50	20	IDGD	
O=C(NNC(=O)c1ccc2sccc2c1)c1cccc(S(=O)(=O)N2CCOCC2)c1	760226144	ZZGGFCBHCWTEKS-UHFFFAOYSA-N	445.522	1.997	50	20	IDGD	
Cc1ccnc(-n2nccc2NC(=O)C(=O)NNC(=O)c2cc3ccccc3cc2O)c1	760280758	XORWOMXLQGHHFI-UHFFFAOYSA-N	430.424	1.834	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=S)NCC2CCN(C)CC2)c1	760465606	JURJMUKDKNGGMK-UHFFFAOYSA-N	441.623	1.168	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)c2c(C)oc(C)c2S(N)(=O)=O)n[nH]1	763152860	JKWAORNSQWLADV-UHFFFAOYSA-N	433.446	1.017	50	20	IDGD	
O=C(COc1cccc(NC(=O)C(=O)NNC(=O)c2ccccn2)c1)Nc1ccccc1	763463949	OJCLNVAXOJVRBC-UHFFFAOYSA-N	433.424	1.499	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)Nc1ccc2c(c1)nc1n2CCCCC1	763571325	MABMGTJTFNMARC-LJQANCHMSA-N	449.467	1.689	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)Nc1cccc(Oc2ccccn2)c1	763574449	BGOULQCZNUJLTK-SFHVURJKSA-N	434.408	1.800	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(N3CCC(C(N)=O)CC3)cc2)cc1	763829747	FZYTUMBZNMPMJU-UHFFFAOYSA-N	437.500	1.350	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)C[C@H](OC)C3)cc1	763859788	FWQUFAMEQQSDGF-JLTOFOAXSA-N	441.484	1.752	50	20	IDGD	
COC(=O)c1cc2cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc3ccc(F)cc3)ccc2o1	763865133	IVWSDBSWHIOBKF-LLVKDONJSA-N	443.387	1.912	50	20	IDGD	
CCOC(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)c1	763867579	XDHQSMKOVUDBSB-CYBMUJFWSA-N	431.420	1.485	50	20	IDGD	
CS(=O)(=O)c1ccc(Oc2ccc(NC(=O)C(=O)NNC(=O)c3ccc[nH]3)cc2)cc1	763978695	AGUVXNLKVJWASD-UHFFFAOYSA-N	442.453	1.610	50	20	IDGD	
COC(=O)Nc1cc(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)ccc1F	763994178	AWQGXZINDMZGLH-UHFFFAOYSA-N	442.201	1.494	50	20	IDGD	
CCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)c(C)c1	763994215	BJPYHYNKTVKQKF-UHFFFAOYSA-N	436.266	1.235	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)cnc1Br	763998626	REQHLPKSYCIVQY-UHFFFAOYSA-N	445.071	1.643	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)Nc1ccc(F)cc1OCC#N	764004801	NBVAXAZNCCFYLK-UHFFFAOYSA-N	438.213	1.229	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)on1)C(=O)Nc1ccccc1CN1CCNC1=O	764016693	LKULIQKXSXBBQL-UHFFFAOYSA-N	448.439	1.267	50	20	IDGD	
O=C(NNC(=O)c1cccc2ccccc12)C(=O)Nc1cccc(Cn2cccnc2=O)c1	764052911	ZCHWWJYYVAPQBL-UHFFFAOYSA-N	441.447	1.845	50	20	IDGD	
CCOc1ncccc1NC(=O)C(=O)NNC(=O)c1ccc(F)cc1Br	764085818	OWJCZMPHJKJBNK-UHFFFAOYSA-N	425.214	1.782	50	20	IDGD	
CC(C)Sc1ccccc1NC(=O)C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	764086457	UKCOCVQTCBILEI-UHFFFAOYSA-N	435.527	1.990	50	20	IDGD	
COC(=O)CCSc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(C)cc2O)c1	764109181	IBAWQKFTFMNBQI-UHFFFAOYSA-N	431.470	1.756	50	20	IDGD	
CCOc1cc(NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)ccc1OC	764378384	YZYOXYOSQYRVLP-UHFFFAOYSA-N	429.458	1.945	50	20	IDGD	
CC(CC12CC3CC(CC(C3)C1)C2)=NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C	764813281	YINONNRXJFFLRO-UHFFFAOYSA-N	426.521	1.532	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NN=Cc3ccc(C#N)cc3)CC2)cc1	764818367	KDFSZOXDSRQOOL-UHFFFAOYSA-N	425.514	1.323	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)c2cc(Br)c(C)n(C)c2=O)o1	765251575	KJTCOFKIAXXJBT-UHFFFAOYSA-N	439.310	1.966	50	20	IDGD	
C[C@H](NC(=O)OC(C)(C)C)[C@H]1COCCC1=NNC(=O)c1nn(C)c(=O)c2ccccc12	766007138	JYJZCIJEAIPZTN-XJKSGUPXSA-N	443.504	1.969	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)NCCC(=O)N1CCN(c2ccccc2)CC1	766913317	JPIUASMIIMWEHX-UHFFFAOYSA-N	445.545	1.455	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)[C@H]1CCN(c2cccc(Cl)c2)C1=O	767352292	DGQTUARWIIZTRG-SFHVURJKSA-N	443.887	1.935	50	20	IDGD	
CC(C)NC(=O)c1ccc(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)cc1	767640266	BRYULTYMPVNIKI-UHFFFAOYSA-N	446.529	1.603	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1C	767804468	SWDXDJUBRQGHJW-UHFFFAOYSA-N	447.513	1.628	50	20	IDGD	
C[C@H](NS(=O)(=O)c1cccc(C#N)c1)C(=O)NNC(=O)Cc1ccc2ccccc2c1	767879483	CYQOGOOEXADBSR-HNNXBMFYSA-N	436.493	1.768	50	20	IDGD	
Cn1c(NNC(=O)CO[C@H]2CCCN(C(=O)OC(C)(C)C)C2)nc2ccccc2c1=O	768052483	YNMLIQATBALRHG-AWEZNQCLSA-N	431.493	1.793	50	20	IDGD	
COc1cc2c(cc1NC(=O)C(=O)NNC(=O)c1cc(-c3ccccc3)on1)NC(=O)CC2	768240058	RLISZGOKXUKWLY-UHFFFAOYSA-N	449.423	1.635	50	20	IDGD	
COc1ccc(NNC(=O)c2cc(S(=O)(=O)N3CCCC3)ccc2O)c([N+](=O)[O-])c1	768332950	ZOQQUUFJMGVSOJ-UHFFFAOYSA-N	436.446	1.850	50	20	IDGD	
O=C(NNc1nc2ccccc2[nH]1)c1cc(S(=O)(=O)N2CCOCC2)ccc1Cl	768492355	OTNZQFFTCDGANF-UHFFFAOYSA-N	435.893	1.994	50	20	IDGD	
N#Cc1cc(Cl)nc(NNC(=O)[C@H]2CCCN2C(=O)/C=C\c2ccc(C(N)=O)cc2)c1	768707255	KTQUOMSSKYXNCX-KQQSKNTNSA-N	438.875	1.853	50	20	IDGD	
CS(=O)(=O)NCc1ccc(NC(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)cc1	770035623	RYXQNFPKXSGNAB-UHFFFAOYSA-N	448.473	1.881	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccnn2-c2cccc(F)c2)cc1OC	770775273	ZWEGFSBWQBYEDA-UHFFFAOYSA-N	441.419	1.818	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)c3cc(F)ccc3NS(C)(=O)=O)nc21	770968716	ZLEDGARFHZFIRG-UHFFFAOYSA-N	437.457	1.554	50	20	IDGD	
CCNc1ncc(C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)s1	771043848	CBXNDJCJBVJQRT-UHFFFAOYSA-N	436.969	1.807	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)N[C@H]1CC(=O)N(c2c(F)cccc2F)C1	771436270	VGCLJECTFDXJFK-ZDUSSCGKSA-N	429.383	1.351	50	20	IDGD	
O=C(NNc1ccnc(Br)c1)c1cccc(S(=O)(=O)N2CCOCC2)c1	771553709	NSFONPXLSYKEGD-UHFFFAOYSA-N	441.307	1.622	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)c1ccccc1S(=O)(=O)N1CCCCC1	771862069	ORXKRNBGBHVVTH-HNNXBMFYSA-N	439.534	1.600	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1cc(COc2ccc(Cl)cc2Cl)on1	772036464	NSJHGZMGRDKYKG-SECBINFHSA-N	448.284	1.756	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2cc(-c3cc(F)cc(F)c3)nn2C)c1O	773540002	DLVDXNIBSBSZPI-UHFFFAOYSA-N	445.382	1.479	50	20	IDGD	
Cc1c(Cl)cccc1NNC(=O)C(=O)Nc1cnn(Cc2nnc3n2CCCC3)c1	773581559	RCQJTWJCNOJIHP-UHFFFAOYSA-N	428.884	1.903	50	20	IDGD	
CS(=O)(=O)c1ccc(Oc2ccc(NC(=O)C(=O)NNc3ncccn3)cc2)cc1	773720036	SLFONHDTOSRIAH-UHFFFAOYSA-N	427.442	1.754	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)[C@@H]3C[C@@]3(C)C(C)C)CC2)cc1	773857788	NZDKREKQXUSLQI-RXVVDRJESA-N	436.578	1.131	50	20	IDGD	
C[C@@]1(NNC(=O)NCc2cnn(-c3ccc(Br)cc3)c2)CCS(=O)(=O)C1	775205819	ISFISTVVVUXIJH-MRXNPFEDSA-N	442.339	1.516	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)N[C@H](c1ccccc1OC(F)F)C(F)(F)F	776001644	QFOCDTLOKNRZNM-GZMMTYOYSA-N	445.366	1.657	50	20	IDGD	
CCCCN(CC(=O)NNC(=O)c1cccc(C)c1)c1c(O)nc(=O)n(CC(C)C)c1N	777606418	QNTPULLVFGEQAQ-UHFFFAOYSA-N	444.536	1.563	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)c2ccc3c(c2)S(=O)(=O)N(C2CC2)C3=O)nc1C	778429183	ISWSRNCUWORNKJ-UHFFFAOYSA-N	445.457	1.026	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)Cn2c(S)nnc2-c2cccc(C)c2)nc1C	778430642	WSSMBQJPHRSJAF-UHFFFAOYSA-N	427.490	1.961	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(F)(F)c1ccccc1OCC(=O)N(C)C	778549645	BVMOMBIWVJKMNE-UHFFFAOYSA-N	445.426	1.663	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNS(=O)(=O)c1cc(C(=O)OC)oc1CC	778557143	SVTHZPZRZBULBE-UHFFFAOYSA-N	426.447	1.416	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccn([C@H](C)COC)n3)n[nH]2)cc1	778713386	JODSUAVUQVSOKN-CYBMUJFWSA-N	439.476	1.443	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)N[C@H]1CCN(c2ccc(Cl)c(Cl)c2)C1=O	779379348	APQUIODDSGILDA-HZMBPMFUSA-N	433.292	1.481	50	20	IDGD	
Cc1c(/C=C(\C#N)C(=O)N2CCC[C@H](S(=O)(=O)NC3CCCC3)C2)cc(C#N)n1C	781524251	SAWMQALAQPNNAY-YZILGEIOSA-N	429.546	1.965	50	20	IDGD	
Cc1ccc([C@H](CN2CCOCC2)NCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1	782350214	WPHVFNITJDGBDO-FQEVSTJZSA-N	441.488	1.327	50	20	IDGD	
CN(C)C(=O)Cn1ccc(NC(=O)C(=O)NNc2ncc(C(F)(F)F)cc2Cl)n1	782850067	VSNKJQFLDCZXAX-UHFFFAOYSA-N	433.778	1.120	50	20	IDGD	
CC(C)(C)Oc1ccccc1NC(=O)C(=O)NNC(=O)c1csc(N2CCOCC2)n1	782898269	YXIJZWHJFSVNJP-UHFFFAOYSA-N	447.517	1.557	50	20	IDGD	
CC(C)(C)OC(=O)Nc1cnc(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)cn1	783036878	DPNCUUZSJXTWPA-UHFFFAOYSA-N	449.493	1.192	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)C(=O)Nc1ccc(C(=O)Nc2ccccc2)cc1	784002313	NRZINKCCNIHHLN-UHFFFAOYSA-N	449.423	1.048	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NN[C@@H](Cc2ccc(F)cc2)C(N)=O)c1	784061298	OFURKGKAJHSTDK-SFHVURJKSA-N	436.509	1.187	50	20	IDGD	
COc1ccc2nc(NNC(=O)C(=O)Nc3cc(-n4cnnn4)ccc3F)c(C)cc2c1	785163736	IKGQQFRNMAMDQR-UHFFFAOYSA-N	436.407	1.748	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)[C@H]2COc3cc(C)c(C)cc32)cc1OC	786966031	KEBJYQHHQKKTID-INIZCTEOSA-N	428.441	1.801	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccc(C)c(C(=O)N3CCCCC3)c2)n1	787543983	OBWOSZVKAYDPMS-UHFFFAOYSA-N	440.504	1.221	50	20	IDGD	
COc1ccc(OC)c([C@@H]2C[C@@H]2C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c1	788196372	DSITVJAHMMXKST-RDJZCZTQSA-N	443.412	1.720	50	20	IDGD	
CC(=O)NC[C@H]1CCn2ncc(C(=O)NNC(=O)c3cc4c(s3)CC[C@H](C)C4)c2C1	792736191	LMOWEIGKQCMIAM-JSGCOSHPSA-N	429.546	1.843	50	20	IDGD	
O=C(CSCCOCCN1C(=O)c2ccccc2C1=O)NNC(=O)c1ccc(F)cc1	795245401	NKENKBKRZOAMJH-UHFFFAOYSA-N	445.472	1.633	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)[C@@H]2[C@H]3[C@H]4C[C@@H]5[C@H]6[C@@H](C[C@H]53)[C@@H]2[C@@H]64)cc1OC	796324189	NQZMUVZTWVZCSY-CMSFYCFSSA-N	426.469	1.402	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1)C(=O)Nc1cncc(F)c1	799258673	FPYQFUZRYLTXJG-NRFANRHFSA-N	447.470	1.934	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)N[C@H]1CCN(C(=O)Nc2ccccc2)C1	801077462	DEPIPTMRGMBSKS-INIZCTEOSA-N	448.524	1.928	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2nnn(Cc3ccc(F)cc3F)c2C)cc1	801109805	DDRAVKGGXVCITF-UHFFFAOYSA-N	428.399	1.621	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)CCS(=O)(=O)c2ccc3c(c2)OCCO3)cc1	802058760	PTYPSHPOJVKYHZ-UHFFFAOYSA-N	435.458	1.483	50	20	IDGD	
CCOC(=O)CON=C(C(=O)NNC(=O)Nc1cc(OC)ccc1Cl)c1cc[nH]n1	802109378	SVECYKUSCNPPBN-UHFFFAOYSA-N	438.828	1.208	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)C(=O)Nc1ccc(OC(F)F)cc1F	802566508	STJVUXIJNIUAFH-UHFFFAOYSA-N	435.156	1.917	50	20	IDGD	
COC(=O)c1c(F)cc(NC(=O)C(=O)NNC(=O)c2cccc(OC(F)F)c2)cc1F	802566666	AOBABEULKKADBB-UHFFFAOYSA-N	443.309	1.753	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2cc(Cl)cc3c2OCC(=O)N3)n1	807024575	IHEOGSAFWCXFBL-UHFFFAOYSA-N	433.856	1.389	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)NC[C@H](N2CCOCC2)C(F)(F)F)c2ccccc2n1	807541525	NXGDQWJKTBSIAG-INIZCTEOSA-N	425.411	1.750	50	20	IDGD	
O=C(NNC(=O)N1CCC[C@@H](CNS(=O)(=O)C2CC2)C1)c1cccc(OC(F)F)c1	808264423	BPVKDERLUAYXQB-LBPRGKRZSA-N	446.476	1.436	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccc(-n3ccc(C(F)(F)F)n3)cc2)n1	810386035	JVYLKCLWGZUQMG-UHFFFAOYSA-N	449.393	1.491	50	20	IDGD	
CCS(=O)(=O)c1cccc(CC(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)c1	812728598	QZBYGECSHBGUKI-UHFFFAOYSA-N	425.532	1.416	50	20	IDGD	
CO[C@@](C)(CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)C1CC1	813203309	GSPBDTJVTUDRCZ-FQEVSTJZSA-N	438.550	1.620	50	20	IDGD	
CC[C@H]1[C@@H](C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)CCN1C(=O)OC(C)(C)C	813367944	PZZSJRAXNXWDPN-HOTGVXAUSA-N	429.481	1.459	50	20	IDGD	
COC[C@@H](C)n1c(C)cc(/C=C(\C#N)C(=O)NS(=O)(=O)c2cncc(C#N)c2)c1C	813982490	LAJPNMYDTRIRKH-LLVIWDJBSA-N	427.486	1.991	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2c(I)cnn2C)cc1OC	814101370	UOQXCELDELNNAQ-UHFFFAOYSA-N	430.202	1.117	50	20	IDGD	
CNS(=O)(=O)c1cccc(NC(=O)NNc2ccccc2S(=O)(=O)N(C)C)c1C	814671168	UBXCVKDWLBETMU-UHFFFAOYSA-N	441.535	1.302	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@H]1CSC(c2ccccc2O)=N1	816827838	HHMOOWVTZHTMSQ-CYBMUJFWSA-N	447.542	1.317	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)c2ccnc(S(N)(=O)=O)c2)c1	818746944	XAZNJZZVHYXWRG-UHFFFAOYSA-N	429.252	1.035	50	20	IDGD	
O=C(NN=Cc1c[nH]nc1-c1cccnc1)c1cccc(S(=O)(=O)N2CCOCC2)c1	839383817	PSWQZYVKNWYFEZ-UHFFFAOYSA-N	440.485	1.257	50	20	IDGD	
O=C(NN=Cc1c(N2CCOCC2)nc2ccccn2c1=O)c1cc(Cl)ccc1O	874098960	XADOFALVXWYFKN-UHFFFAOYSA-N	427.848	1.654	50	20	IDGD	
O=C(NNC(=O)[C@@]12CCC(=O)N1CCS2)c1nc(-c2ccccc2)n(-c2ccccc2)n1	892014773	SMGVQFMLAKTAQK-QFIPXVFZSA-N	448.508	1.761	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)[C@H]1CCCCN1S(C)(=O)=O	896317293	RUGJVVYYODYEEN-BXUZGUMPSA-N	448.339	1.178	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)c2cccc(I)c2)C[C@@H](C)O1	912920815	DPRMBHURCLIMCP-VXGBXAGGSA-N	431.274	1.552	50	20	IDGD	
CCOC(=O)NNC(=O)CS[C@H](C)C(=O)Nc1c(C)n(C)n(-c2ccccc2)c1=O	913180644	TYMRNUJHYPAKHR-CYBMUJFWSA-N	435.506	1.322	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNC(=O)NCc2ccc(S(N)(=O)=O)s2)cc1	915906158	NOHQJYHGZONUBF-UHFFFAOYSA-N	440.547	1.965	50	20	IDGD	
O=C(NCc1ccccc1CN1CCOCC1)NNC(=O)c1ccc2c(c1)OCCO2	915927389	KNCOLBFFIXSUEP-UHFFFAOYSA-N	426.473	1.434	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NN=C(C)CCN(C)C)N(S(C)(=O)=O)CC2	915951724	NODKIIBOYNAQHR-KRWDZBQOSA-N	440.566	1.397	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)NCc1ccc(C(=O)N2CCN(C)CC2)cc1	916390297	IHTLLGXVBUTTJW-UHFFFAOYSA-N	449.515	1.175	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)C(=O)NC1CC1)c1cccc(NC(=O)Cc2ccccc2F)c1	916491969	OHXNFJQZSNEZDV-ZDUSSCGKSA-N	441.463	1.677	50	20	IDGD	
O=C(NCCS(=O)(=O)NCc1ccccc1)NNC(=O)c1ccc2ccccc2n1	916645259	LCBNPZPKPQLORY-UHFFFAOYSA-N	427.486	1.298	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc2nc(O)[nH]c2c1)c1ccc(F)cc1Br	917754988	PMNWRGDTTGUQSB-UHFFFAOYSA-N	429.227	1.793	50	20	IDGD	
COc1ccc(CNC(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)cc1[N+](=O)[O-]	918128556	VQKYATHLXWSXQZ-UHFFFAOYSA-N	438.466	1.511	50	20	IDGD	
C[C@H](c1ccccc1)N1CC[C@H](NC(=O)NNC(=O)c2csc(N3CCOCC3)n2)C1	919786011	OKYXGMMIVYFVAT-WBVHZDCISA-N	444.561	1.759	50	20	IDGD	
CC(C)c1c(C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)cnn1-c1cccc(Cl)c1	919886581	SMZGRYWDYXKZFX-ZDUSSCGKSA-N	439.925	1.780	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)Nc2cccc(N3C(=O)CNC3=O)c2)cc1OC	920931856	GIMVVTLJDPULPU-UHFFFAOYSA-N	427.417	1.617	50	20	IDGD	
CCCNC(=O)NNC(=O)C1CCN(S(=O)(=O)c2ccccc2C(F)(F)F)CC1	921041609	DUKXBRDQIDBFIZ-UHFFFAOYSA-N	436.456	1.847	50	20	IDGD	
CCOC(=O)c1ncc(C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)s1	1116955989	YDEDPRWWUVOQDM-UHFFFAOYSA-N	429.458	1.685	50	20	IDGD	
Cn1c(=O)n(C)c2nc(NC(=O)CCC(=O)NNc3cncc(Br)c3)ccc21	1319543644	BQLOCXQPKUKANP-UHFFFAOYSA-N	448.281	1.292	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2ccccc2S(=O)(=O)N2CCCC2)cc1	1320402958	AEOWRXJXZZJOEQ-UHFFFAOYSA-N	439.515	1.103	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@@H]2CC(=O)N(c3ccc(C#N)cc3)C2)c2ccccc2c1=O	1320611799	NTMCLMFSKTXTAL-OAHLLOKOSA-N	444.451	1.102	50	20	IDGD	
CC1=C(C(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)[C@H](C)n2ncnc2N1C	1344531731	GHXVEEAMHZODFW-ZDUSSCGKSA-N	433.513	1.357	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4nc(CO)[nH]c4c3)C2)C1	1777702394	FEWYHVFATKEWJQ-YCRPNKLZSA-N	434.924	1.906	50	20	IDGD	
O=C(O)c1cnncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(Cl)Cl)C2	1779697159	QBCSADPQKGPOAL-SJKOYZFVSA-N	431.276	1.106	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc4cccnn4n3)C2)C1	1779961172	NJQCEJRYEDHJIQ-QZTJIDSGSA-N	426.304	1.409	50	20	IDGD	
COc1ccc2[nH]cc(C(=O)N3CC[C@]4(C3)CN(C(=O)C(Cl)Cl)CCO4)c2n1	1780047175	ZGGHMYWXPBEYTR-SFHVURJKSA-N	427.288	1.819	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(CCN(C(=O)c3[nH]cnc3-c3cccnc3)C2)C1	1780051771	FFDILHCMRYAWDP-OAQYLSRUSA-N	443.580	1.767	50	20	IDGD	
CC(C)c1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C3)on1	1780205265	RJFYOFLWDUBNRJ-XMSQKQJNSA-N	449.552	1.299	50	20	IDGD	
COc1ccnc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)c1OC	1780451549	SNSZMSNZJDZSMA-KZULUSFZSA-N	442.310	1.326	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)Cc3ccc(OC)cc3C#N)C2)C1	1781176324	IVDBRHUVUBADDH-WIYYLYMNSA-N	435.908	1.193	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](NC(C)=O)c1ccc(F)cc1)CCO2	1781218943	UHZNXOJRPOJWSH-UEXGIBASSA-N	439.915	1.850	50	20	IDGD	
C[C@@H](Oc1ccccc1)C(=O)N1CC[C@@]2(CN(C(=O)[C@@H](F)Br)CCO2)C1	1781378590	KATLOJPJSPDBCY-SIIHOXLZSA-N	429.286	1.974	50	20	IDGD	
Cc1cccn2ncc(C(=O)N3CC[C@]4(C3)CN(C(=O)[C@H](F)Br)CCO4)c12	1782522167	UUPODZOWAGSLOW-YJBOKZPZSA-N	439.285	1.777	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1CC[C@H](C(=O)OC)C1)CCO2	1783343687	OQUQYJWSZUEGSJ-QZNHQWIBSA-N	445.354	1.579	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)COc3ccccc3F)C2)C1	1783360719	NVYJPHZGTZSBHV-ACJLOTCBSA-N	429.286	1.818	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)Cc3cccc([N+](=O)[O-])c3)CCO2)C1	1783527236	ALKQUCAKCBSILG-SCLBCKFNSA-N	440.294	1.751	50	20	IDGD	
Cc1nc(CC(=O)N2CCO[C@]3(CCN(C(=O)[C@H](C)Br)C3)C2)c(C)s1	1783532177	JUOSBULNACWRHU-APPDUMDISA-N	430.368	1.916	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccnc(C(F)(F)F)c3)CCO2)C1	1783873050	JCWLSKPGZKGROP-GUYCJALGSA-N	435.830	1.798	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]3C2)cn1	1783970227	UCGMLALTEYDARV-OEAJRASXSA-N	440.338	1.715	50	20	IDGD	
CCOc1cnc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Br)C[C@@H]32)cn1	1785609389	ITVYUTOHSSVLRK-TZQJONAQSA-N	445.289	1.159	50	20	IDGD	
CC(C)N[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)C(C)C	1786959548	CLVOIVJIPUPHAT-NBOOPKSLSA-N	432.403	1.774	50	20	IDGD	
CO[C@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)[C@H]2C1	1789221856	KXPPNJWTXIIHOK-DTPILHQWSA-N	449.460	1.148	50	20	IDGD	
CN(CC(=O)Nc1ccc(C2(NC(=O)[C@H](F)Br)CCC2)cc1)C(=O)C(=O)O	1791097903	IHLNOYPDIGHQOY-ZDUSSCGKSA-N	444.257	1.354	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(F)c(C(F)(F)F)c1)C2)[C@@H](O)CCl	1792983596	QGRICTLZZLUPCH-JLUCKKNBSA-N	438.805	1.647	50	20	IDGD	
CCC[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCl	1793117449	MCUONQPNMMWDSO-JKJDWNRSSA-N	431.961	1.918	50	20	IDGD	
O=C(C#CC1CC1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](Br)Cc1ccccc1)C2	1793261272	FSGUMSPSRIOEBH-JTJHWIPRSA-N	445.357	1.996	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1ccc(Cl)nc1F	1794247310	OHENBRPUYLFFOI-VVJJBPBLSA-N	438.656	1.768	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(-c3ccccn3)[nH]n1)C2	1795115968	XSCFYXWXLFUEJR-IVWMJMPLSA-N	448.321	1.460	50	20	IDGD	
O=C(CCOc1ccccc1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2	1795116799	VSDPWVNGZHSJMB-CCWDJLKJSA-N	425.323	1.830	50	20	IDGD	
O=C(/C=C/C(=O)c1cccs1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1	1796189243	PGCKOULRXNTPEU-UUUZMKTPSA-N	438.314	1.119	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2cc(O)ccc2n1	1796864784	HGFRINBMORDLHY-NASWQRNTSA-N	448.317	1.927	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1ON=C(c2ccccc2)O1	1797643020	GWQXWKWURGEDBO-VWFIUDSGSA-N	447.564	1.162	50	20	IDGD	
COc1ccc([C@H](O)C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CO[Si](C)(C)C)cc1	1797953891	OZQPNGBQFULXPR-JSJNYSNDSA-N	436.581	1.170	50	20	IDGD	
COc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Br)C3)cc1OC	1798896367	STDMNQZRKVLVEH-VZAMPYOESA-N	445.285	1.598	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(=O)c1ccc(Cl)cc1)C2	1800754363	MREOMNKDXRCBHU-DNVSUFBTSA-N	443.725	1.896	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(-n3cccn3)nc1)C2	1800760134	CNHZDTFWPBIHQJ-JJAZEVLHSA-N	448.321	1.254	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(C(N)=O)cc1	1801653393	HFJWDEVXFQHIJH-KSYCFECVSA-N	438.322	1.020	50	20	IDGD	
CC(=O)Nc1ccccc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2	1801781456	WGBILKOPPVDPBX-VZAMPYOESA-N	442.285	1.539	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)CS(=O)(=O)CC)[C@@H]1c1cccnc1	1803510078	PPFILHMYWVJVAE-RYRKJORJSA-N	429.970	1.930	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@@H](CNC(=O)[C@@H]2CNC(=O)O2)[C@H]1c1cccnc1	1803642875	NYDQKNOYANMQPC-UQOMUDLDSA-N	439.310	1.227	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)CCS(C)(=O)=O)[C@@H]1c1cccnc1	1803693863	AFHUFMLTYWIPNL-SOLBZPMBSA-N	429.970	1.930	50	20	IDGD	
CC(C)NC(=O)OC(C)(C)C(=O)N1CCC2(CCCN(C(=O)[C@H](O)CCl)C2)CC1	1805525286	MNQLAVIVKPXYEV-OAHLLOKOSA-N	431.961	1.731	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@H]1CCN(C(=O)[C@@H]2CNC(=O)O2)[C@H]1c1cccnc1	1808290340	SOLINDJLVHMVDG-COJSNBRMSA-N	429.304	1.432	50	20	IDGD	
Cc1nccn1CC(=O)N1CC[C@H](CNC(=O)[C@H](F)Br)[C@H]1c1cccnc1	1808679385	XCVQZAOFHKZFGP-OIISXLGYSA-N	438.301	1.983	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)c1ccn2cncc2c1	1809965794	FIZTWSMWJFBPEI-WDSOQIARSA-N	427.892	1.649	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)[C@@H]2CC2(F)F)[C@@H]1c1cccnc1	1810302590	LWSXZNYXRBZSMR-RRQGHBQHSA-N	444.442	1.055	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2ccc([N+](=O)[O-])[nH]2)[C@@H]1c1cccnc1	1811619362	PNNVKDMEGSFMGV-KEYYUXOJSA-N	435.868	1.891	50	20	IDGD	
Cc1ccncc1C(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1813071695	VLGALLKXDNQNOE-AVRDEDQJSA-N	438.532	1.478	50	20	IDGD	
C[C@](O)(CC(=O)O)CC(=O)N1CC[C@H](CNC(=O)C(Cl)Cl)[C@H]1c1cccnc1	1813081948	HSROTBFHUWDHIH-CDHAZOANSA-N	432.304	1.507	50	20	IDGD	
COC1(CC(=O)NC[C@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)CCC1	1813676711	XXDHCRVYBMWCBC-GCJKJVERSA-N	445.564	1.420	50	20	IDGD	
O=C(CN1CCCC1=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](F)Br)CC2	1814597297	AFZIEUBTCSDGJX-OQPBUACISA-N	433.303	1.368	50	20	IDGD	
CC[C@H](O)C(=O)Nc1cc([C@H]2CCCCN2C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[nH]n1	1814770865	XSQSTMLZOAYSMA-MKDRCZBFSA-N	429.481	1.307	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)Cc2cnc3ccccn23)[nH]n1)[C@H](O)CCl	1814863744	BDULPYUNQNRBAZ-HZPDHXFCSA-N	430.896	1.892	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc(-n3cnnc3)cc2)[nH]n1)[C@H](O)CCl	1814869836	CVZOSWGUYRGFHG-IAGOWNOFSA-N	443.895	1.896	50	20	IDGD	
Cc1cc(C)n2ncc(C(=O)N3CCCC[C@H]3c3cc(NC(=O)[C@H](O)CCl)n[nH]3)c2n1	1814871696	VQIODEKZBONMQI-JKSUJKDBSA-N	445.911	1.975	50	20	IDGD	
O=C(CCc1ccc[nH]1)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2	1815468657	FPBHYFSCQSGLAC-MRXNPFEDSA-N	438.318	1.010	50	20	IDGD	
Cc1cc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)c(C)n1C	1820059256	LTLZMNXVYATWIP-HXUWFJFHSA-N	449.320	1.665	50	20	IDGD	
CC(=O)NC(C)(C)C(=O)N[C@@H]1CCc2nc(NC(=O)CO[Si](C)(C)C)sc2C1	1820159977	CZWMWTQFHLGHTO-GFCCVEGCSA-N	426.615	1.821	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CNC(=O)N(C)C)CC1	1824090280	ZYEXKAMXMACLPK-GDBMZVCRSA-N	445.402	1.908	50	20	IDGD	
CN1CCCC[C@H]1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1	1824203724	HLNZYFCHIXTHPP-YADHBBJMSA-N	441.381	1.084	50	20	IDGD	
C[C@H](C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](F)Br)CC2)n1ccnn1	1824690751	JLVHIJJYJUYIEM-FYBVGQRMSA-N	431.291	1.598	50	20	IDGD	
Cc1nc(C)c(C(=O)N[C@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)o1	1826087641	HBJJTODSKVHLFC-LBPRGKRZSA-N	434.522	1.347	50	20	IDGD	
C[C@@H]1CC[C@H](C(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)O1	1827051744	CQZYHHHAUXMWFS-MAODMQOUSA-N	428.338	1.167	50	20	IDGD	
O=C1CCc2ccc(C(=O)N3CCCC[C@H]3C3CCN(C(=O)[C@H](O)CCl)CC3)nc2N1	1827394687	TUGHXXPEYONVCB-ZWKOTPCHSA-N	448.951	1.799	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2nc[nH]n2)CC1	1827680933	YNVLKUANWKJKAJ-NFXIUMSZSA-N	440.508	1.172	50	20	IDGD	
Cc1nccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)n1	1827888501	RVEHGKZLDFDZSU-LJQANCHMSA-N	430.553	1.391	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1	1828923853	CPJOFMAJAJKZBW-ROUUACIJSA-N	435.956	1.936	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(F)nc3)C2)C1	1830539172	DNPJLJOISFSSQI-FZKQIMNGSA-N	444.301	1.322	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(O)nc(O)n2)CC1	1831833903	QIMBBWBIEJMQOG-HIFRSBDPSA-N	426.901	1.375	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H]2C[C@]2(F)Cl)CC1	1831875576	ZHOJRYJQPKNLKR-JXXFODFXSA-N	430.952	1.904	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)C3CCN(C(C)C)CC3)CCO2)C1	1832407196	AMCOQXVUSYUKBV-UGKGYDQZSA-N	444.016	1.971	50	20	IDGD	
O=C(Cc1cncnc1)NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1	1833860552	INOKYXJDYKEPPM-UHFFFAOYSA-N	438.370	1.376	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@H](C)n3ccccc3=O)CC2)CC1	1835824674	AKBXECRZQSVQRI-LPHOPBHVSA-N	436.984	1.998	50	20	IDGD	
CCN(C)[C@H](C)C(=O)N1CCC(N2CCC(NC(=O)CO[Si](C)(C)C)CC2)CC1	1835837565	MSTXBERITZQHPU-QGZVFWFLSA-N	426.678	1.750	50	20	IDGD	
Cc1ncncc1C(=O)NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1	1835970553	UFNJYHKGRMWSDI-UHFFFAOYSA-N	438.370	1.755	50	20	IDGD	
CC(=O)NCCC(=O)N1CCC(OC2CCN(C(=O)[C@H](C)CBr)CC2)CC1	1836673645	INJZOMOPUHRITI-CQSZACIVSA-N	446.386	1.542	50	20	IDGD	
Cc1cc(CCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)CO[Si](C)(C)C)CCO3)ccn1	1837710109	INDHCOGHEFZPOZ-JOCHJYFZSA-N	449.624	1.631	50	20	IDGD	
CC(C)N[C@@H](C(=O)N1CCOC[C@@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1)C(C)C	1837711890	VZCZUAMCJAIIFK-TZIWHRDSSA-N	443.661	1.317	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3ccc(F)nc3)C2)C1	1839142494	QHSAGNXFRZNWHJ-JXFKEZNVSA-N	427.904	1.627	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc(OC)c(F)c3)C2)C1	1839143308	SIOHWIMHRPYJMH-KUHUBIRLSA-N	429.876	1.317	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CN(C)C(=O)OC(C)(C)C)C2)C1	1839143976	NFOKSEKXFUWWJH-FOIQADDNSA-N	447.960	1.327	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)c3ccccc3Cl)C2)C1	1839148462	AFAVNHFKRRCIDW-VPWXQRGCSA-N	445.343	1.847	50	20	IDGD	
Cc1nnsc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2	1839152538	CLSVCQISGIZPKV-CVEARBPZSA-N	437.349	1.153	50	20	IDGD	
CC(C)[C@H](S)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839199679	ZKAGUINLIBAFFW-SLEUVZQESA-N	427.336	1.088	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)OC(=O)OCC)CCO2	1839681620	UXXYLCLPZJIVBP-DOXZYTNZSA-N	434.917	1.412	50	20	IDGD	
C=C[C@H](O)C(C)(C)C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](Br)CC)CCO2)C1	1839965002	KNPAKIMNHISJEI-VCBZYWHSSA-N	447.370	1.189	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3c(F)cccc3Cl)C2)C1	1840153770	ARBVNSHGQTYVFB-IFXJQAMLSA-N	449.306	1.803	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(C)nc3C)C2)C1	1840153932	GDMGUZSCEJHRRJ-YLJYHZDGSA-N	425.913	1.022	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3sccc3OC)C2)C1	1840153982	HCTDHIKWFOIOJE-FZKQIMNGSA-N	432.926	1.081	50	20	IDGD	
COc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)cc(OC)c1C	1840756869	SRJLYHYEOOFZBJ-XLIONFOSSA-N	444.887	1.617	50	20	IDGD	
O=C(c1cn2ccc(C(F)(F)F)cc2n1)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1	1841353112	DEVVKFZXFQDVFZ-CYBMUJFWSA-N	430.814	1.770	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1ccc(F)c(F)c1)C2	1843416430	JNIBQAIHAMAPJM-DHRITJCHSA-N	429.427	1.916	50	20	IDGD	
CSc1ncccc1C(=O)N1CC2(CCCN2C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C1	1843416544	WCHSPPKWYBSVJC-ZVHZXABRSA-N	440.529	1.755	50	20	IDGD	
CN(CC(=O)N1CC2(CCCN2C(=O)c2cc(F)c[nH]2)C1)NC(=O)NCc1ccccc1	1846222834	OAJALWBRCCETQW-UHFFFAOYSA-N	442.495	1.317	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)C1=CCN(C(=O)OC(C)(C)C)C1)C2	1846360262	DEFFGPJAHUCOII-HNNXBMFYSA-N	427.929	1.621	50	20	IDGD	
COc1ccc(CCC(=O)N2CC3(CCCN3C(=O)CCC(=O)NN(C)C)C2)c(OC)c1	1846385854	DEGBJJHNNHQOLA-UHFFFAOYSA-N	446.548	1.213	50	20	IDGD	
CC[C@H](C)[C@@H](O)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1847838652	WUWSBNHOGDFCFB-UVPYHEFZSA-N	431.961	1.727	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1cn(Cc2ccccc2)nc1-c1cccnc1	9930724	FHVOMTQAWHSWDL-QGZVFWFLSA-N	439.497	1.189	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)c1cccc(N2CCCS2(=O)=O)c1	10099201	UBLNQRHNDYQRIM-UHFFFAOYSA-N	441.513	1.600	50	20	IDGD	
Cc1cc(=O)c(C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)nn1-c1ccccc1F	15856987	FWAHYYGXKRFAET-UHFFFAOYSA-N	448.414	1.002	50	20	IDGD	
C[C@H](Oc1ccc(Br)cc1)C(=O)NNC(=O)c1n[nH]c(=O)c2ccccc12	17194396	VFZDQNCGEPLVFW-JTQLQIEISA-N	431.246	1.914	50	20	IDGD	
C[C@@]12CCC(=O)N1c1ccccc1C(=O)N2CC(=O)NNC(=O)c1ccc2c(c1)OCO2	105969285	YRBQXMOLSWHFNF-QFIPXVFZSA-N	436.424	1.175	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)[C@H]2CCCN2C(=O)c2ccc(Br)cc2)n1	303086078	GOWBYILAGPNLHH-MRXNPFEDSA-N	448.321	1.715	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C1(NC(=O)NCc2ccccc2)CCCC1	725742012	XOUIIIAXMKXZPU-UHFFFAOYSA-N	443.529	1.438	50	20	IDGD	
Cn1ccnc1[C@H](NC(=O)NNC(=O)CNC(=O)c1cccs1)c1ccc(F)cc1	725872645	RGHONHBKRAWSPO-MRXNPFEDSA-N	430.465	1.471	50	20	IDGD	
O=C(CC(F)(F)F)NNC(=O)NCCCNC(=O)c1cccc(Br)c1	726260799	PHEUYRWBNXODAM-UHFFFAOYSA-N	425.205	1.852	50	20	IDGD	
COc1ccc(CCNC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1F	728400101	QRXHSTJXLWGQCF-UHFFFAOYSA-N	443.523	1.920	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)[C@H]1CCCN1c1ncnc2sccc12	728602575	HJPPNYOAPSLGEQ-CQSZACIVSA-N	427.486	1.895	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)n1	728731689	VXBHQIRJKBORNB-UHFFFAOYSA-N	444.429	1.092	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)c1cccc(S(=O)(=O)NCc2cccs2)c1	728891710	DNZDRDTYEHFCJU-UHFFFAOYSA-N	430.511	1.625	50	20	IDGD	
O=C(NNC(=O)N1CCN(c2ccc(F)cc2)CC1)C1CCN(c2ncccn2)CC1	728958240	YJYFFPYOPOQUMO-UHFFFAOYSA-N	427.484	1.395	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)[C@H]2CCCN(C(=O)Cc3ccccc3)C2)cn1	729692648	YEELCXDPXHHYEE-INIZCTEOSA-N	427.530	1.889	50	20	IDGD	
COc1ccc2[nH]cc(C=NNC(=O)c3cccc(S(=O)(=O)N4CCOCC4)c3)c2c1	730144242	IQFUVYQTUJEEQR-UHFFFAOYSA-N	442.497	1.961	50	20	IDGD	
COC(=O)c1ccc2c(c1)CN(C(=O)NNC(=O)c1csc(N3CCOCC3)n1)C2	730272307	INCLNILTGABMKV-UHFFFAOYSA-N	431.474	1.137	50	20	IDGD	
CCCc1ccc(N2C[C@H](C(=O)NNC(=O)CCN3C[C@H](C)O[C@@H](C)C3)CC2=O)cc1	732264677	WGQMYZARKDEADY-JENIJYKNSA-N	430.549	1.639	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NCCCC(=O)N2Cc3ccccc3C2)c2ccccc2c1=O	732473822	BVGUKANHAJCSGZ-UHFFFAOYSA-N	448.483	1.200	50	20	IDGD	
O=C(Cn1c(=O)ccn(Cc2ccccc2)c1=O)NNC(=O)NCc1ccc(Cl)cc1	733003893	RGXJFWMCYVSLFL-UHFFFAOYSA-N	441.875	1.242	50	20	IDGD	
O=C(CCS(=O)(=O)c1ccc2c(c1)CCC2)NNC(=O)c1cnn(-c2ccccc2)c1	733107084	UYVQOAAOYIHVAD-UHFFFAOYSA-N	438.509	1.986	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1C(=O)O	733123304	YLLIXMFAADEMGL-UHFFFAOYSA-N	430.442	1.593	50	20	IDGD	
COC(=O)Nc1ccccc1C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	733123918	KIHYKDKFFJQLDN-UHFFFAOYSA-N	425.489	1.838	50	20	IDGD	
CC[C@@H](C#N)Oc1cc(CNC(=O)NNC(=O)COc2ccccc2O)ccc1OC	733652685	FWMARKJSJLNKKR-HNNXBMFYSA-N	428.445	1.991	50	20	IDGD	
CCN(CC)[C@@H](C(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1cccc(C(F)(F)F)c1	733915909	ZNVIGOVJYWVHDG-UKRRQHHQSA-N	435.468	1.670	50	20	IDGD	
CN1CCC(N2CC[C@@H](NC(=O)NNC(=O)c3ccc(COc4ccccc4)o3)C2)CC1	734284134	SOOJGDLRHWNPPV-QGZVFWFLSA-N	441.532	1.971	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)NCc2cc(S(N)(=O)=O)ccc2F)c2ccccc2n1	734673248	IZHLYICGDHBJHA-UHFFFAOYSA-N	431.449	1.474	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)CNC(=O)OCC(F)(F)F)CC1	734825467	GSNVYZQZSIQSCU-UHFFFAOYSA-N	441.407	1.005	50	20	IDGD	
Cc1cc(S(=O)(=O)Nc2ccccc2C(=O)NNC(=O)c2cnn(C)c2)ccc1F	735473463	WHANSPXGHXXWSA-UHFFFAOYSA-N	431.449	1.743	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)CCN2C(=O)COc3ccccc32)cc1C	736762753	DEIZDFFDWVOZSO-UHFFFAOYSA-N	445.497	1.739	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@@H](Cc2ccccc2)C2CC2)cc1	737065699	CJXPTXKJBFSLLA-FQEVSTJZSA-N	444.557	1.967	50	20	IDGD	
CC(C)N1C(=O)c2ccc(C(=O)NNC(=O)COCc3ccccc3)cc2S1(=O)=O	737637092	MNQDTNGJYBXWPM-UHFFFAOYSA-N	431.470	1.217	50	20	IDGD	
CCN1CCN(Cc2ccccc2CNC(=O)NNC(=O)COCc2ccccc2)CC1	738456446	IPGATAALKBKZRR-UHFFFAOYSA-N	439.560	1.871	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)N1CCN(Cc2ccc(Cl)cc2)C(=O)C1	738497634	ZPGUDJFQSJSYRW-UHFFFAOYSA-N	430.892	1.942	50	20	IDGD	
O=C(NNc1ncnc2[nH]cnc12)C1CCN(S(=O)(=O)c2cc(F)ccc2F)CC1	740746514	LHNQYYUDXWIIKN-UHFFFAOYSA-N	437.432	1.175	50	20	IDGD	
C[C@H]1CN(CC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)CC[C@H]1NC(=O)OC(C)(C)C	740880351	XASIQKHIOGJSDN-XJKSGUPXSA-N	435.481	1.591	50	20	IDGD	
C[C@@]1(C(=O)NNC(=O)CNC(=O)c2cccs2)CCCN(C(=O)c2ccccc2)C1	741918753	IOLLZIRVPRHULS-OAQYLSRUSA-N	428.514	1.568	50	20	IDGD	
CC(C)c1nn([C@H]2CCS(=O)(=O)C2)cc1C(=O)NNC(=O)COc1ccc(F)cc1	742478954	XUVIIDVAHKXPEO-AWEZNQCLSA-N	438.481	1.345	50	20	IDGD	
CCOc1ccc(C(=O)NNS(=O)(=O)c2cc3oc(=O)[nH]c3cc2Cl)cc1OC	743251903	YRYRVEOOAMWUCW-UHFFFAOYSA-N	441.849	1.805	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(S(=O)(=O)N2CCCCC2)cc1)NC1CCCC1	743730056	XNAQKAMXLNTFEU-UHFFFAOYSA-N	430.552	1.296	50	20	IDGD	
COc1ccc(CN2C[C@H](C(=O)NNC(=O)Nc3ccc(N(C)C)cc3)CC2=O)cc1	743826800	PEOBWGZUMGLEPB-MRXNPFEDSA-N	425.489	1.963	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)CN2C(=O)N[C@@]3(CCc4ccccc43)C2=O)cc1	743828460	MNMIFRNEJOVDAZ-JOCHJYFZSA-N	436.472	1.299	50	20	IDGD	
O=C(CCSCc1ccccn1)NNc1ccccc1S(=O)(=O)N1CCOCC1	744621952	KDSNFCUYSKLFTC-UHFFFAOYSA-N	436.559	1.869	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)O[C@@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)cc(C#N)n1C	744632669	MTJLSZSAOWBBCJ-PBTLCFMXSA-N	441.469	1.330	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)CCNC(=O)N2CCc3ccccc3C2)cc1	745056546	ABPILESWEWOZQM-UHFFFAOYSA-N	438.484	1.457	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)N[C@@H]1CC(=O)N(CCOc2ccccc2)C1	745845797	AIJZUVSKASOCJG-NVXWUHKLSA-N	444.463	1.603	50	20	IDGD	
COC(=O)c1ccsc1N1CC[C@H](NC(=O)NNC(=O)c2cccc(C#N)c2)C1=O	746779138	HIXPXYMBFKHAGB-AWEZNQCLSA-N	427.442	1.156	50	20	IDGD	
N#C/C(=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)OCC(=O)N1CCC1	746899127	HYAFMKAWKMXVSN-GDNBJRDFSA-N	441.875	1.761	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)c2cnn(CC(=O)NC3CCCCC3)c2)c1	747017110	GHWZZGUOSLHYKX-UHFFFAOYSA-N	441.488	1.258	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)N2CCC[C@H](CN3CCN(c4ccccn4)CC3)C2)cc1	748330108	UEMGVZRVSWVBPQ-HXUWFJFHSA-N	447.543	1.842	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)NCCCN2CCN(c3ccncc3)CC2)c2ccccc21	748342589	BGJZVUWVXAHYRU-UHFFFAOYSA-N	435.532	1.730	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)NC[C@@H](c1ccc(Cl)cc1)N1CCOCC1	748624827	OXBKVXHFEYSCOK-YOEHRIQHSA-N	428.917	1.095	50	20	IDGD	
CNS(=O)(=O)C1=CC(C(=O)NNC(=O)c2ccc(OCCC(C)C)cc2)=S=C1	748689683	SELWDSVZNCAMDC-UHFFFAOYSA-N	425.532	1.027	50	20	IDGD	
O=C(NCCCOC1CCN(Cc2ccccc2)CC1)NNC(=O)C(=O)N1CCCC1	748968722	HSESQIGZMCNAPE-UHFFFAOYSA-N	431.537	1.011	50	20	IDGD	
C[C@H](C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1)c1ccc(Cl)s1	750243301	ZANNAXYFSYTEQW-LBPRGKRZSA-N	443.982	1.979	50	20	IDGD	
CCCn1nc(C(=O)NNS(=O)(=O)c2cnc3onc(C)c3c2)c2ccccc2c1=O	750838366	VQFSTSOOIHAYTQ-UHFFFAOYSA-N	442.457	1.274	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(OC)c(C(=O)NNC(=S)N[C@@H](C)C2CC2)c1	751616580	FQJQMWGHWVBZKC-LBPRGKRZSA-N	428.580	1.633	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)c2cc(Cn3cc(Br)cn3)on2)c1	752316923	WDJSITGEOXWJLF-UHFFFAOYSA-N	448.237	1.110	50	20	IDGD	
O=C(Cc1ccc(I)cc1)NNc1nccc(N2CCOCC2)n1	754251534	DCXUWUVZLSUVRW-UHFFFAOYSA-N	439.257	1.604	50	20	IDGD	
COc1ccc(-c2nn(CCC#N)cc2/C=C(/C#N)C(=O)NCc2cnn[nH]2)cc1OC	754862996	IAZGQPAGLWDXOS-NVNXTCNLSA-N	432.444	1.822	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCCCC2)cc1NC(=O)NNC(=O)c1cnccn1	755413838	ZKESGDSYSBHDOW-UHFFFAOYSA-N	434.478	1.126	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(C(=O)NNC(=O)c2cc(F)ccc2Br)co1	755860668	YZVZKMUMXYOHES-UHFFFAOYSA-N	434.243	1.506	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H]1COC(=O)c1ccc(NC(=O)NNC(=O)CO)cc1	756294332	GXKJUZUUBSUDAX-HNNXBMFYSA-N	436.465	1.388	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc1NS(C)(=O)=O	756516651	MQPRPJSAXFIIHL-UHFFFAOYSA-N	444.473	1.724	50	20	IDGD	
CN(Cc1ccccc1NC(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1)C(=O)OC(C)(C)C	756617305	HOKFJVGXLRVRIF-AWEZNQCLSA-N	440.522	1.641	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)Nc2ccn(CCN3CCOCC3)n2)o1	756648113	YLMKOAIRWILMSP-UHFFFAOYSA-N	433.513	1.117	50	20	IDGD	
CCCNS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1	756783699	HOBBUSAPDQOMDF-UHFFFAOYSA-N	434.474	1.613	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)Nc2ccc(S(=O)(=O)NCc3ccccc3)cc2)n[nH]1	756862232	CWQZQRFCBMCSOZ-UHFFFAOYSA-N	428.474	1.663	50	20	IDGD	
CCOc1ccc(C(=O)N(C)C)cc1NC(=O)NNC(=O)COc1ccc(C#N)cc1	756879717	JCUNOUHMUQCVFR-UHFFFAOYSA-N	425.445	1.890	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N2CC[C@]3(CCOC3)C2)cc1	757006983	SNOQTUNVIJXUTC-VHFIJRQBSA-N	449.511	1.980	50	20	IDGD	
COCc1nnc(-c2cccc(C(=O)NNC(=O)c3nn(-c4ccccc4)cc3O)c2)o1	757720573	UQYCIGRBLAPWOH-UHFFFAOYSA-N	434.412	1.849	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)N[C@@H]2CCc3nc(COC)nn3C2)cc1OC	757773518	CRNUHTRHLCCRIQ-OAHLLOKOSA-N	446.508	1.571	50	20	IDGD	
CS(=O)(=O)c1ccc(CNC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1Cl	759296084	AJBORYLSOXLNOF-OAHLLOKOSA-N	439.877	1.414	50	20	IDGD	
Cc1onc(-c2ccncc2)c1C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	759571530	PASGPAIAIZFGEM-MRXNPFEDSA-N	438.396	1.189	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NCc2ccc(S(=O)(=O)NCC(C)C)cc2)cc1	759666980	ZPZLSELHJFCGOS-UHFFFAOYSA-N	448.545	1.839	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCOc2ccc(Cl)cn2)c1	761780132	ZMVKRYWFDYDRGB-UHFFFAOYSA-N	441.897	1.008	50	20	IDGD	
CN1CC[C@@H](CNC(=O)NNC(=O)C(=O)Nc2ccccn2)[C@H]1c1ccc(Cl)c(F)c1	763093310	VIYRHBVIQNSAGT-SUMWQHHRSA-N	448.886	1.836	50	20	IDGD	
COCCOc1c(Cl)cccc1NC(=O)C(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	763442028	KJMRUHHVICGTMA-UHFFFAOYSA-N	436.808	1.673	50	20	IDGD	
O=C(NNC(=O)c1ccc2ccccc2n1)C(=O)Nc1ccc(CN2CCCC2=O)cc1	763449902	JLXSZPRYBQXKSB-UHFFFAOYSA-N	431.452	1.757	50	20	IDGD	
COc1ccc(Cn2nccc2NC(=O)C(=O)NNC(=O)c2ccc3ccccc3n2)cc1	763466301	LNHOILPORUCNCI-UHFFFAOYSA-N	444.451	1.888	50	20	IDGD	
CC(=O)N(Cc1ccc(NC(=O)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1)C(C)C	763471542	VBPNMMFFDHELSY-UHFFFAOYSA-N	441.444	1.751	50	20	IDGD	
C[C@@H]1COCCN1c1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)cc1	763547568	FAKLPMLXLQKWJQ-CYBMUJFWSA-N	426.429	1.040	50	20	IDGD	
N#Cc1ccc(OC(F)F)c(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1	763572490	RRFKVEJFANAHKG-HNNXBMFYSA-N	432.339	1.086	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)Nc1ccc(Cl)cc1OC(F)F	763572744	OLLVMFJKQDPVFT-AWEZNQCLSA-N	441.774	1.867	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(C(=O)NC(C)C)c(C)c2)c1	763622913	HVGDFFPMKWYKPJ-UHFFFAOYSA-N	426.473	1.607	50	20	IDGD	
COc1cc(C(=O)N(C)C)ccc1NC(=O)C(=O)NNC(=O)COc1cc(C)cc(C)c1	763649943	NIHRIUFAAGQOQD-UHFFFAOYSA-N	442.472	1.179	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cc(F)ccc2N2CCCCC2)cc1	763662686	YWSSUPISBABCOM-UHFFFAOYSA-N	444.463	1.990	50	20	IDGD	
COC(=O)c1c(NC(=O)C(=O)NNC(=O)COc2ccccc2OC)sc(C)c1C	763663706	YFNBWOKHWFITKJ-UHFFFAOYSA-N	435.458	1.325	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)C(=O)Nc1ncn(Cc2ccc(Cl)cc2)n1	763681619	HCUJPUUCTZVQQF-UHFFFAOYSA-N	446.826	1.284	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2ccccc2C(=O)NC(C)(C)C)c1	763772975	RICYZGIXNFVDIY-UHFFFAOYSA-N	442.472	1.632	50	20	IDGD	
Cc1cc(OC(C)C)ccc1NC(=O)C(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	763787106	VZUGBPHYJAVZDS-UHFFFAOYSA-N	437.456	1.429	50	20	IDGD	
CCOc1cc2c(cc1NC(=O)C(=O)NNC(=O)COc1ccccc1C#N)O[C@H](C)C2	763808768	QNNBUUYIBUVOTL-CYBMUJFWSA-N	438.440	1.445	50	20	IDGD	
CC(C)CCn1nc(C(=O)NNC(=O)C(=O)Nc2ccsc2)c2ccccc2c1=O	763844216	XRMTUBSIYOZKRX-UHFFFAOYSA-N	427.486	1.904	50	20	IDGD	
COC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)cc1F	763870997	CIBRDNPBYHRYJN-JTQLQIEISA-N	436.371	1.697	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccccc1Cn1cncn1	763873071	QGKYKMCQDNNNFC-ZDUSSCGKSA-N	426.408	1.019	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccccc2SCC(F)(F)F)n1	763892237	CHXMDXUQHBVIGO-UHFFFAOYSA-N	429.424	1.940	50	20	IDGD	
C=CCN(C)S(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2C)cc1	763957762	JENIRKVZAWEIKK-UHFFFAOYSA-N	430.486	1.201	50	20	IDGD	
Cc1nn(-c2ccccc2)cc1NC(=O)C(=O)NNC(=O)c1cc(Br)c[nH]1	763997346	JXZHHOQDRUKBEO-UHFFFAOYSA-N	431.250	1.671	50	20	IDGD	
CC(C)Sc1c(Cl)cccc1NC(=O)C(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1	763998282	OHFVLKOHDBOIKH-JTQLQIEISA-N	433.939	1.361	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2cc(OC)c(OC)cc2OC)cc1	764126193	GYGFNOSYOCDQMP-UHFFFAOYSA-N	431.445	1.440	50	20	IDGD	
COC(=O)c1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)c1ccc(Cl)cc1O	764126404	JWGJSNQXCWKYDD-UHFFFAOYSA-N	426.212	1.885	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(NC(=O)C3CC3)nc2)o1	764138173	DRKZUXKPJWDYEN-UHFFFAOYSA-N	442.476	1.265	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(-c3n[nH]c(C)n3)cc2)o1	764138259	FVBNHPPJMWUZNO-UHFFFAOYSA-N	439.476	1.615	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)ccc1N1CCSCC1	764166894	FYSTXHQPOQERQN-IBGZPJMESA-N	440.525	1.638	50	20	IDGD	
CCCS(=O)(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(C#N)cc2)c1C	764181743	GIHAVGFBDYVERA-UHFFFAOYSA-N	443.485	1.418	50	20	IDGD	
O=C(CCCc1ccccc1)NNC(=O)C(=O)Nc1ccc(NC(=O)[C@@H]2CCCO2)cc1	764226790	RVHNGYLOQSITEU-IBGZPJMESA-N	438.484	1.913	50	20	IDGD	
COC(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)c1	764241828	LBJCLEBOWHXSIV-UHFFFAOYSA-N	428.832	1.867	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)C(=O)Nc1ccc(NC(=O)[C@@H]2CCCO2)cc1	764277834	IKAIKGSYTBVAIF-SFHVURJKSA-N	440.456	1.228	50	20	IDGD	
CCOc1c(Br)cc(Cl)cc1NC(=O)C(=O)NNC(=O)Cc1cc[nH]n1	764285515	FLELHDXOFPFJPH-UHFFFAOYSA-N	444.673	1.553	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)CCCN2C(=O)OC(C)(C)C	764297640	GQXOIVWVWFRWQU-UHFFFAOYSA-N	442.476	1.806	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)Cc2ccccc2F)ccc1N1CCCC1=O	764314570	ZSEIDHUOJCBWNZ-UHFFFAOYSA-N	428.420	1.290	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C(=O)Nc1cccc(C(=O)N2CCOCC2)c1)c1ccccc1	764331798	HJBCIRLKGWNEEY-IBGZPJMESA-N	438.484	1.439	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1cc(C(C)(C)C)nn1-c1cccc(C)c1	764399985	OOMYBDKOACZJEF-OAHLLOKOSA-N	445.520	1.616	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(N(C)C2CCCCC2)c(F)c1	764400969	RSYZIEDHAWKEKE-AWEZNQCLSA-N	438.500	1.732	50	20	IDGD	
O=C(NNC(=O)[C@H]1COCCO1)C(=O)Nc1ccc2nc(-c3ccc(F)cc3)oc2c1	764430404	WNTAJPRNYUQXJT-MRXNPFEDSA-N	428.376	1.135	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N(C)C)o2)n[nH]1	765598523	AYXDGEFLTXNKGP-UHFFFAOYSA-N	433.446	1.003	50	20	IDGD	
O=C(NNc1cnccn1)C(=O)Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1	766260957	YTDDGUWHLGWJLH-UHFFFAOYSA-N	445.527	1.923	50	20	IDGD	
CC(C)NC(=O)c1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1	767191919	MUVSCNXAZRFFAJ-UHFFFAOYSA-N	432.502	1.150	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](OCC(=O)NNc2ccccc2S(C)(=O)=O)C1	768007188	MYJUIZWSDLNMKL-CQSZACIVSA-N	427.523	1.949	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)[C@H](C)OC[C@@H]3CCCCO3)n[nH]2)cc1OC	768275718	DUOHVHWGDHIGPX-ZFWWWQNUSA-N	432.477	1.829	50	20	IDGD	
CNS(=O)(=O)c1cc(NC(=O)NNc2c(OC)cccc2S(C)(=O)=O)ccc1C	769225051	HXHLVZBHCDKSQB-UHFFFAOYSA-N	442.519	1.464	50	20	IDGD	
CSCCNC(=S)NNC(=O)c1ccc(S(=O)(=O)N(C)c2ccccc2)cc1	769769119	JWCUQZBJQADMPK-UHFFFAOYSA-N	438.600	1.984	50	20	IDGD	
Cc1cc2c(N3CCC[C@@H]3C(=O)NNc3nc(O)c4cnn(C)c4n3)ncnc2s1	770983664	OPYDJWJTWARVHT-GFCCVEGCSA-N	425.478	1.494	50	20	IDGD	
C#CCOc1ccccc1NC(=O)C(=O)NNC(=O)c1cc(OC)c(OC)c(OC)c1	773492674	QNAMKIZIVGGFJH-UHFFFAOYSA-N	427.413	1.124	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)C(=O)Nc1ccc(C(F)(F)F)cn1	773525268	OFYGOXPKHBDBLA-UHFFFAOYSA-N	427.295	1.174	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(S(=O)(=O)NC(C)C)cc2)cc1F	773890284	ZKVPLKJHRQRGKJ-UHFFFAOYSA-N	436.465	1.221	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccccc1C[S@](C)=O	774003576	XRHLJNFJNDGCLP-ZNNHIBJESA-N	437.905	1.772	50	20	IDGD	
CN(C)C(=O)[C@H]1CC[C@H](CNC(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)O1	775461518	QZUFSTKRBCSOQV-DGCLKSJQSA-N	438.428	1.242	50	20	IDGD	
COc1ccc(C(C)=NNC(=O)CSc2nnc(O)nc2O)c(Br)c1	776185281	FZSOSWBWNJCZFF-UHFFFAOYSA-N	428.268	1.686	50	20	IDGD	
CN(NC(=O)c1cn(C)nc1C(F)(F)F)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776206371	TVDGNDBJGNNEIB-UHFFFAOYSA-N	434.419	1.688	50	20	IDGD	
CCC(CC)n1nc(C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)cc1C	776477396	VWQPPJOCOHOXHB-UHFFFAOYSA-N	449.581	1.641	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)NC[C@H]1COC2(CCOCC2)O1	776943447	IKQFZXVRJUSSSM-AWEZNQCLSA-N	444.282	1.080	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)nn1[C@H](C)C1CC1	777275124	RFRWISGXZCQWFL-SNVBAGLBSA-N	425.898	1.538	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)N[C@H](CO)Cc1c[nH]c2ccccc12	778649665	KMYCGHUKRUDBIF-KRWDZBQOSA-N	437.504	1.108	50	20	IDGD	
O=C1CCc2cc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc3ccccc3)c(F)cc2N1	778710919	BCLOTRVZLKPDSI-UHFFFAOYSA-N	436.346	1.468	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N2CC[C@H](O)[C@H](C)C2)cc1	779270028	RWJDKDNFIHTCEC-YZIKGUJTSA-N	437.500	1.570	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)Nc1ccnn1Cc1ccccc1Br	779465296	DFXDMBBIOORHGC-GFCCVEGCSA-N	440.298	1.898	50	20	IDGD	
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC(=NNC(=O)CCNC(=O)OC(C)(C)C)CC1	779806931	MOAZYKRCEACHSP-UHFFFAOYSA-N	442.542	1.198	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1S(=O)(=O)NNC(=O)c1cccc2ccccc12	780388505	BNFGTEQBCYPKCF-UHFFFAOYSA-N	433.511	1.713	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)[C@H]2CCCN2C(=O)/C=C/c2ccc(C(N)=O)cc2)c1	780793525	YTMJYIWYIQNOMD-VSRDTVRMSA-N	436.468	1.720	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2Cl)cc1	782927489	SEUATFLDEVRSRE-UHFFFAOYSA-N	430.269	1.797	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2ccn(-c3ccc(F)cc3C)n2)n1	783275698	OMPXBFAZXAWFQW-UHFFFAOYSA-N	431.449	1.632	50	20	IDGD	
CCCC(=O)Nc1ccc(Cl)c(NC(=O)C(=O)NN[C@]2(C)CCS(=O)(=O)C2)c1	783424488	FALIHHWAQFWFDG-QGZVFWFLSA-N	430.914	1.215	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)C(=O)Nc1cc(C(F)(F)F)ccc1Cl	784003867	CVFJLSSHEYDSFG-UHFFFAOYSA-N	432.742	1.468	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1ccn(-c2ccccc2Cl)n1	784005348	WSZAKXCEMFGUTQ-UHFFFAOYSA-N	446.876	1.103	50	20	IDGD	
CO[C@@H]1Cc2ccc(NC(=O)C(=O)NNc3ccc(S(=O)(=O)NC4CC4)cc3)cc2C1	784214434	XDZYZNKJFVRIFC-GOSISDBHSA-N	444.513	1.323	50	20	IDGD	
CS(=O)(=O)c1c(Cl)cccc1NC(=O)C(=O)NNc1ccc(Br)nc1	784806073	BWRVMUHHCMOKGR-UHFFFAOYSA-N	447.698	1.983	50	20	IDGD	
CN1C[C@H](C(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)c2ccccc2C1=O	785104653	BUOXUUZKNNHVSW-KRWDZBQOSA-N	445.520	1.586	50	20	IDGD	
N#C/C(=C/c1ccccc1)C(=O)OCC(=O)N(C[C@@H]1CCCO1)[C@@H]1CCS(=O)(=O)C1	785378829	SXQWSQVSKZSJTB-JAHOTQIWSA-N	432.498	1.331	50	20	IDGD	
COCCc1ccccc1NC(=O)C(=O)NNC(=O)c1cc(Br)ccc1O	786416582	GJJBAKXYBCHGMT-UHFFFAOYSA-N	436.262	1.743	50	20	IDGD	
CCO[C@@H]1C[C@@](NC(=O)OC(C)(C)C)(C(=O)NNC(=O)N2CCN(C)CC2)C1(C)C	788165591	CXAWCDOZNGSJQP-JLTOFOAXSA-N	427.546	1.073	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)CNS(=O)(=O)c1cc(C)ccc1C	789909926	RZQWAKBUBJGXLM-UHFFFAOYSA-N	425.894	1.705	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)[C@@H]1CC(=O)N(Cc2cccc(C(F)(F)F)c2)C1	790063570	MLRKJAFKABRFLT-CQSZACIVSA-N	445.438	1.991	50	20	IDGD	
Cn1nc([C@@H]2CCCOC2)cc1NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	790553914	JRYHJBUEOZIGNV-GFCCVEGCSA-N	425.449	1.028	50	20	IDGD	
COc1cc(C(F)(F)F)ncc1NC(=O)C(=O)NNC(=O)COCc1ccccc1	792266754	VIDXWNXEMVLRMU-UHFFFAOYSA-N	426.351	1.412	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CCCNS(=O)(=O)c2cccc(C(F)(F)F)c2)n1	794090024	NQZPGQHVFAIOOC-UHFFFAOYSA-N	444.435	1.929	50	20	IDGD	
C[C@H]1CCC(=NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)[C@H](n2cncn2)C1	794453051	IDQQODVGVBJZDR-HNAYVOBHSA-N	446.533	1.446	50	20	IDGD	
CCn1c(NNC(=O)C[C@@H]2COCCN2C(=O)OC(C)(C)C)nc2ccccc2c1=O	795020648	PIFJCJONGIKSES-CQSZACIVSA-N	431.493	1.886	50	20	IDGD	
CSc1cccc(C)c1NC(=O)C(=O)NNC(=O)CNC(=O)OCc1ccccc1	797368021	GQJJIHFGTLXUTQ-UHFFFAOYSA-N	430.486	1.729	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNC(=O)C(=O)Nc1cccc(OC(F)F)c1	797368832	HRCRAEUVJFFBIZ-UHFFFAOYSA-N	436.371	1.300	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(N3CCc4sccc4C3)nc2)n1	797369664	DAOUKVYBNZQFEJ-UHFFFAOYSA-N	436.497	1.809	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)[C@@H](CC(N)=O)NC(=O)CC(C)C)c(C)n1-c1ccccc1	798272682	HFRRDGOFBKBVBK-GOSISDBHSA-N	427.505	1.261	50	20	IDGD	
C[C@@]1(CNC(=O)NNC(=O)CNC(=O)c2cccs2)CCN(Cc2ccccc2)C1	798484113	GHYVQERVSQIVJT-NRFANRHFSA-N	429.546	1.721	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)NC1CCN(c2nccs2)CC1	798508332	BXPCCLPRJOKHCZ-UHFFFAOYSA-N	427.490	1.647	50	20	IDGD	
O=C(NNC(=O)N1CCC(CNC(=O)C(F)(F)F)CC1)c1cnn(-c2ccccc2)c1	798532975	IDZWGJRXOPRASY-UHFFFAOYSA-N	438.410	1.617	50	20	IDGD	
NC(=O)c1cc(Br)cc(S(=O)(=O)NNC(=O)CCc2ccccc2O)c1	799529025	ARDIPQWNNJAEGD-UHFFFAOYSA-N	442.291	1.196	50	20	IDGD	
CC(C)(C)C(=O)N1CSC[C@@H]1C(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	802065599	GMXQHYZMFXCOGS-CYBMUJFWSA-N	428.536	1.190	50	20	IDGD	
COC(=O)c1scc(-c2ccc(C)cc2)c1NC(=O)C(=O)NNC(=O)c1cnn(C)c1	806978672	CONYHGFUSUZKPH-UHFFFAOYSA-N	441.469	1.643	50	20	IDGD	
O=C1COC[C@H](C[C@H]2CN(C(=O)C(=O)NNc3ccc(Cl)nc3)c3ccccc32)N1	807014304	UNTSJDXUEGCJAR-JSGCOSHPSA-N	429.864	1.214	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2ccnc(OC(F)F)c2)c1	807257015	DUXCMOUFFSNAQX-UHFFFAOYSA-N	443.432	1.078	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)[C@@H]1CCCCN1S(=O)(=O)c1cccs1	807372097	ZYYCIXDQEHSLCA-ZDUSSCGKSA-N	433.552	1.228	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)C(=O)Nc1c(F)cc(Br)cc1F	807428480	FNTWXOPLFFZVGG-UHFFFAOYSA-N	438.192	1.785	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)cc2[nH]ccc12	808934855	WLSASNJPFVJLQA-UHFFFAOYSA-N	448.233	1.445	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)C(=O)Nc1cccc(C2CCC2)c1	812982448	LPJRVPQVKWJREY-UHFFFAOYSA-N	443.529	1.955	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)C[C@@H]2CCCS(=O)(=O)C2)c2ccccc2c1=O	814733683	NWCJBMAZSJIRAP-HNNXBMFYSA-N	448.545	1.563	50	20	IDGD	
CC(=NNC(=O)Nc1ccc2c(c1)OCO2)c1ccc(S(=O)(=O)N2CCNCC2)cc1	814992340	KFQGXIVHNARMMQ-UHFFFAOYSA-N	445.501	1.555	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H]2[C@@H](C1)[C@@H]2C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	815259002	VVWAYVSKSHNGLJ-FVQHAEBGSA-N	436.534	1.683	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)ccc1-c1ccncc1	815567276	SOZDJJSPVUEDKP-UHFFFAOYSA-N	442.439	1.432	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(N(C(C)=O)[C@H]3C[C@@H]3C)cc2)c1O	815568633	OYFLCUWRQQRATM-SJCJKPOMSA-N	440.456	1.562	50	20	IDGD	
COCc1csc(NC(=O)C(=O)NNc2cc(C(=O)OC)ccc2Br)n1	815865619	AEKNEMBPQRECFL-UHFFFAOYSA-N	443.279	1.920	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C[C@](O)(c2nccn2C)C(F)(F)F)ccc1OC(C)C	818653478	YTYPBGBKNIGHEW-SFHVURJKSA-N	444.410	1.817	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)c1cccc(S(=O)(=O)NC2CCCC2)c1	913465180	PZGCIFITHRZDRE-UHFFFAOYSA-N	447.513	1.756	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)c1ccc(S(=O)(=O)N=c2cc[nH]cc2)cc1	914749622	HSMHHOYMWJYCHR-UHFFFAOYSA-N	444.444	1.283	50	20	IDGD	
COc1ccc([C@@H](CNC(=O)NNC(=O)c2ccccc2O)N2CCOCC2)cc1OC	915895802	YKNRVJAGRUMZRA-QGZVFWFLSA-N	444.488	1.427	50	20	IDGD	
CCOc1ccc(OCc2ccc(C(=O)NNC(=O)[C@H](C)N3C(=O)CCC3=O)cc2)cc1	916034363	FLFVUJGKJZDDKF-HNNXBMFYSA-N	439.468	1.963	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)C1CCN(C(=O)N(C)C)CC1	916144050	VCADBRJNKCYBTB-GFCCVEGCSA-N	441.326	1.757	50	20	IDGD	
CC(=NNC(=O)COc1ccccc1F)c1ccc(OCC(=O)N2CCOCC2)cc1	916300606	NXZCTZLXCMTZOS-UHFFFAOYSA-N	429.448	1.983	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)NCCNC(=O)c2cccs2)c2ccccc2c1=O	916568779	XIHYTYQOKILYEE-UHFFFAOYSA-N	442.501	1.413	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)c1ccc(F)c(S(=O)(=O)N(C)C)c1	918688653	MOKSTMDCMOKWND-UHFFFAOYSA-N	429.857	1.813	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1ccc(-n2c(C)cnc2O)cc1	918759265	QPBYNKKTJBEKLN-UHFFFAOYSA-N	442.501	1.563	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2ccccc2O)cc1S(=O)(=O)Cc1cc(C)no1	919809455	XJMWPRVBHBQWPB-UHFFFAOYSA-N	445.453	1.746	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)CCNS(=O)(=O)c1ccc2c(c1)CCCC2	919820206	NDGBEAVICQEZQQ-UHFFFAOYSA-N	445.541	1.633	50	20	IDGD	
C#CCN1CCC(C(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)CC1	919964467	MYMXIEPFLFWPDO-UHFFFAOYSA-N	446.554	1.655	50	20	IDGD	
O=C(NCCNS(=O)(=O)c1cccc([N+](=O)[O-])c1)NNC(=O)c1ccc(Cl)cc1	921248272	UEXIWGNPQZFQNJ-UHFFFAOYSA-N	441.853	1.171	50	20	IDGD	
O=C(NNC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1)c1csc(N2CCOCC2)n1	921302422	VMNAUPHJSORUPU-UHFFFAOYSA-N	443.445	1.148	50	20	IDGD	
NC(=O)c1ccc(/C=C/C(=O)N2CCC[C@H]2C(=O)NNC(=O)c2ccccc2Cl)cc1	1317965716	XONLAZDFNJQGBE-PEKVBPLLSA-N	440.887	1.904	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCCN1Cc1ccncc1)c1csc(N2CCOCC2)n1	1318332984	HGZGXKAAEWSQNI-KRWDZBQOSA-N	430.534	1.190	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)CSc2nnc(S)s2)CC1	1318891032	QPVBDJZBWNLLFN-UHFFFAOYSA-N	433.581	1.713	50	20	IDGD	
O=C(NCc1nc(COc2ccccc2)n[nH]1)NNC(=O)c1cncn1-c1ccccc1	1321316291	NEKZHOXUXABIPW-UHFFFAOYSA-N	432.444	1.714	50	20	IDGD	
O=C(NC[C@H]1CN(Cc2ccccc2)CCO1)NNC(=O)c1cncn1-c1ccccc1	1323086084	WZFAWJQXLBZECQ-FQEVSTJZSA-N	434.500	1.717	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2ccnc(OC3CCC3)c2)cc1OC	1339379521	VPINSDYAHULRMA-UHFFFAOYSA-N	429.429	1.648	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(O)c([N+](=O)[O-])c1)C2)[C@H](F)Cl	1778028776	PIMOWIWOAIVMJS-RVKKMQEKSA-N	429.832	1.962	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](F)Cl)CCO3)C1	1778237820	LIRUTLGZCCKLBH-CKFHNAJUSA-N	433.908	1.608	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)c3cc4cc(F)ccc4[nH]3)C2)C1	1778410573	VCSJMRGKXPNPSS-QFIPXVFZSA-N	445.495	1.124	50	20	IDGD	
COc1cccnc1CCC(=O)N1CCO[C@]2(CCN(C(=O)CO[Si](C)(C)C)C2)C1	1779294311	NBABGYGAGDXHBO-NRFANRHFSA-N	435.597	1.704	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@]3(CN(C(=O)CCBr)CCO3)C2)n(C(F)F)n1	1780309059	DUABWFNSTHUYPN-INIZCTEOSA-N	435.269	1.815	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H]2CC[C@H]3CCC(=O)N3C2)C1	1780609505	IFGOZXAMWLCJSL-UDDBWUTJSA-N	439.984	1.919	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCC(=O)N1CCCC1)C2	1780700756	WGPMPPYBERRFLQ-CBGDNZLLSA-N	427.973	1.920	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1cnccn1)C2	1781897807	QCLGTNZWOFDGQF-GPMSIDNRSA-N	439.354	1.707	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H]2CCNC(=O)C2)C1	1782267564	HGYYIGDLEBTBSL-DEXNDLTESA-N	444.370	1.058	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](C)Nc1nccs1)CCO2	1783347775	ONOCVDRWGWLFKX-IGCXYCKISA-N	445.383	1.947	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)COc3cc(Cl)ccn3)CCO2)C1	1783878420	YHNCXGXAEBZZGL-KBXCAEBGSA-N	432.304	1.198	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CO[Si](C)(C)C)C[C@@H]21	1783967237	QLXONZXIQIITJO-QPSCCSFWSA-N	435.435	1.849	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C[C@H]3CCCCO3)C[C@@H]21	1783969409	MAEKSFZAXOHBHL-KSWRQPAISA-N	431.371	1.956	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)C1CCN(c2ccccc2)CC1	1784017140	VFUJLGYROLWTIH-VMXMFDLUSA-N	449.979	1.482	50	20	IDGD	
C[C@H]1[C@@H](C(=O)N2CC[C@@]3(CN(C(=O)[C@@H](F)Cl)CCO3)C2)CCN1C(=O)OC(C)(C)C	1785739422	WOLIQFUCQKOMKV-CJXDPKRBSA-N	447.935	1.996	50	20	IDGD	
CN1CCC(CC(=O)Nc2ccc(C3(NC(=O)c4ccc(B(O)O)cc4)CCC3)cc2)CC1	1785913410	DLFUZDXIYAWHSZ-UHFFFAOYSA-N	449.360	1.846	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(O)cn3)[C@H]2C1	1786277951	WAIKJGRWAIPRNW-PCBIJLKTSA-N	426.311	1.554	50	20	IDGD	
C=C[C@@H](O)C(C)(C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](Br)CC)C[C@@H]21	1788575734	BTUPOGGDIACZNY-ARKGTOAJSA-N	431.371	1.713	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3coc([Si](C)(C)C)c3)[C@H]2C1	1788592484	ZQYOLGROBJUAJB-LLLHUVSDSA-N	443.016	1.672	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C[C@@H]21	1789860177	KOGZGVGDPZXWIC-HHWFLTMWSA-N	437.928	1.118	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccn4nccc34)[C@H]2C1	1790400347	PRMTWMYBEYFGFZ-HPZZRFSDSA-N	435.322	1.711	50	20	IDGD	
O=C(NC1(c2ccc(NC(=O)[C@H](F)Br)cc2)CCC1)[C@H](O)N1CCOCC1	1790536632	VOUZJIJGFYQMDH-YOEHRIQHSA-N	444.301	1.462	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@](C)(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Cl)C1	1796365430	SAMLBXUGWJEXPQ-UPYQZRRNSA-N	447.935	1.758	50	20	IDGD	
C[C@@H](Nc1nccs1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@](C)(Cl)CCl)C2	1796414932	HCADKCMSWSAQIX-KCRLFOLJSA-N	435.377	1.769	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCN1CCCC1)C2	1796893294	YMGHWIYDZLKJNF-DPEPCVEMSA-N	428.537	1.245	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(-n3cnnc3)cc1)C2	1797954902	QWMJSOKQIPPALX-XEMDLRDOSA-N	443.580	1.322	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1n[nH]cc1I)[C@H](F)Cl	1798790998	UNYHFTSAJALQHK-PJFCORBGSA-N	440.644	1.801	50	20	IDGD	
O=C([C@@H](O)CCl)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1(c2ccc(F)c(F)c2)CC1	1799063589	SZIPDHGRHZBKJC-LZDSYCOUSA-N	428.863	1.186	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](O)C(C)C)C2	1799219547	PNPRTRAPJTZYKB-YGTYGHESSA-N	433.461	1.789	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3cccnn3c1)C2	1799279363	LCXUGYAQKBWMIL-MVWRLGRASA-N	425.316	1.774	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1cc(F)c(F)cc1F	1799515131	QWKVUGFUGWJBDN-NVIQENEESA-N	439.203	1.998	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)c1cccc(Br)c1)[C@H](O)CCl	1799870235	GLBYJAVTKLCEJI-YIDVYQOGSA-N	445.741	1.720	50	20	IDGD	
C[C@@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2)[S@@](=O)c1ccccc1	1800217481	WCJMOFXZSPPKGI-MVKLEHQWSA-N	433.357	1.576	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(F)c1[N+](=O)[O-]	1800530302	ITLUDROZXPNMKC-BTTYYORXSA-N	435.456	1.359	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3cc(F)c(F)cc3[nH]1)C2	1800977222	UWVIDXXGUVMWPR-SJBDTSRBSA-N	441.862	1.903	50	20	IDGD	
C[C@H](NC(=O)c1ccccn1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](C)Br	1801966892	UEHQDOZKSYVYHP-QKGCVVFFSA-N	437.338	1.622	50	20	IDGD	
COc1ccc(/C=C/C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CCC(=O)NN(C)C)C3)c(F)c1	1802080516	DEMUFKFSKDZFOI-HKXQJBQNSA-N	446.523	1.859	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1CCN(C(=O)c2cnc(O)[nH]2)[C@H]1c1cccnc1	1803013217	BDSYFSFNIKEPGY-ZLDLUXBVSA-N	436.310	1.861	50	20	IDGD	
C[C@H](Nc1cccnc1)C(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1	1803138325	JOTLUOFRZIIVFD-FXECBMLZSA-N	431.924	1.583	50	20	IDGD	
CN(C)c1cncc(C(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)c1	1803142057	VNWUPLQWGMNODH-LZQZEXGQSA-N	431.924	1.462	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC2(CCN(C(=O)[C@H](C)n3cnnn3)CC2)C1	1805388878	DGAFWEPWIYGHGO-KGLIPLIRSA-N	427.347	1.496	50	20	IDGD	
COc1nn(C)cc1C(=O)N1CCCC2(CCN(C(=O)[C@@H](F)Br)CC2)C1	1807977216	NOPJXZNISXEAKB-CYBMUJFWSA-N	431.306	1.964	50	20	IDGD	
Cc1ccnc(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)c1	1808533358	NJAJJIXZDBWGJX-DENIHFKCSA-N	444.300	1.098	50	20	IDGD	
O=C(COC(=O)C(F)(F)F)NC[C@H]1CCN(C(=O)C(Cl)Cl)[C@@H]1c1cccnc1	1810190894	ZNDZONVIPGIODV-ZYHUDNBSSA-N	442.221	1.997	50	20	IDGD	
CC[C@H](NC(C)=O)C(=O)N1CC[C@H](CNC(=O)[C@@H](C)Br)[C@H]1c1cccnc1	1812864550	WBLWXELPJCVNQA-VDNDLQMASA-N	439.354	1.786	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)Cc2ccccc2)[C@H]1c1cccnc1	1813034761	WVVHLBKCYJDJSP-TUFLPTIASA-N	445.947	1.945	50	20	IDGD	
C=CCO[C@H](C)C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1813069066	UESUUICGLHVCGP-HGHGUNKESA-N	431.537	1.052	50	20	IDGD	
Cc1cccc(C(=O)N2CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)n1	1813070299	GXDKGGMRDOCUIO-XMSQKQJNSA-N	438.532	1.478	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2cccc(F)c2)[C@H]1c1cccnc1	1813072832	KYLAYHKZRVAMMY-AVRDEDQJSA-N	441.507	1.913	50	20	IDGD	
COCCOCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](C)CBr)CC2	1814299772	IWVABRSCUWXZGR-WDEREUQCSA-N	434.356	1.749	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1CCc2nc(NC(=O)CS(C)(=O)=O)sc2C1	1814325498	QQEUBICSJKTMRY-XLKFXECMSA-N	428.363	1.336	50	20	IDGD	
C[C@@H](CBr)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CNC(=O)N(C)C)[nH]n1	1814776156	JLHKZETYMHRWFE-WCQYABFASA-N	443.346	1.704	50	20	IDGD	
CC(C)O[C@@H](C)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnccc1C(=O)NN)CC2	1820009880	HWVCOHCGMGBHRU-NWDGAFQWSA-N	446.533	1.181	50	20	IDGD	
C[C@H](O)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)[nH]n1	1822172586	KXYYSVPBUQHWCZ-FPMFFAJLSA-N	443.932	1.915	50	20	IDGD	
O=C(N[C@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1)c1c[nH]c(=O)cn1	1823006832	IWSSAPDGXIBVEP-KGFZYKRKSA-N	430.259	1.143	50	20	IDGD	
C[C@H](C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1)n1ccnn1	1823009124	JXWGBTRQUKDSIH-XLDPMVHQSA-N	431.291	1.598	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@H]2CNC(=O)C2)CC1	1824095902	JOAQUDIIYIPYDY-BMFZPTHFSA-N	428.371	1.773	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ncn(C(C)C)n1)CC2	1825997847	CYGUFSZFPWMONG-WDEREUQCSA-N	426.930	1.795	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(OC)n(C)n1)CC2	1826002695	AZVYPESTERTNEE-ZJUUUORDSA-N	427.914	1.365	50	20	IDGD	
C#CCCCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnccc1C(=O)NN)CC2	1826038898	AMYMGTGTWAEHAE-LBPRGKRZSA-N	426.502	1.171	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)no1	1826052649	VCKNZBBQZLJDQV-LJQANCHMSA-N	440.504	1.529	50	20	IDGD	
CCc1noc(C)c1C(=O)N[C@@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1	1826088019	NOCYVTYUJSZBBL-GFCCVEGCSA-N	448.549	1.601	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)C2CCOCC2)CC1	1826582576	LVCCDYQXLCKNHY-FQEVSTJZSA-N	443.548	1.345	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)CSc3nc[nH]n3)sc2C1	1826676038	XJCJLBSTSSGKOP-DTWKUNHWSA-N	430.943	1.219	50	20	IDGD	
Cc1cccc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)n1	1827050638	BGAISVWABZAIQQ-QFIPXVFZSA-N	435.333	1.617	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)C3CC(F)(F)C3)CCO2)C1	1829983510	QZFYUMZOPIXXAC-LRDDRELGSA-N	439.297	1.519	50	20	IDGD	
Cc1noc(C)c1CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830358177	MNRTWOJUJQPZGR-OAQYLSRUSA-N	441.956	1.945	50	20	IDGD	
Cc1nc(C)c(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)o1	1830540836	TZKANPCUUVUTHZ-SGTLLEGYSA-N	444.326	1.392	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)COC(=O)C(F)(F)F)CC1	1831831462	ZEYWOHBNURACRG-ZIAGYGMSSA-N	442.862	1.965	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CC(=O)OC(C)(C)C)CCO2)C1	1831987351	YLEBALJAFDHEAR-MGPUTAFESA-N	432.945	1.582	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3noc(C(C)C)n3)CCO2)C1	1832792150	XNPYNUQQGCEOPW-IFXJQAMLSA-N	428.917	1.209	50	20	IDGD	
C[C@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)c3cn[nH]c3)CC2)CC1	1833263120	BBJFBMKDONMNEC-CYBMUJFWSA-N	426.359	1.626	50	20	IDGD	
C=CCC(CC=C)C(=O)NC1CCN(C2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1	1833291931	ZCPNRBKWNDJROM-UHFFFAOYSA-N	447.624	1.699	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3n[nH]c(C4CC4)c3F)CCO2)C1	1833677766	STRRIGYDGPEIKQ-JLTOFOAXSA-N	442.919	1.904	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)CSc3ncccn3)CC2)CC1)[C@@H](F)Cl	1835080626	ZYNWKOWEFWBPEG-MRXNPFEDSA-N	429.949	1.675	50	20	IDGD	
CN1CCN(CC(=O)NC2CCN(C3CCN(C(=O)C(C)(C)CCl)CC3)CC2)CC1	1835479776	NBUHXPLLABGZDP-UHFFFAOYSA-N	442.048	1.070	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC(OC2CCN(C(=O)C(=O)C3CC3)CC2)CC1	1836670021	KPABUGQOKYPJTP-CYBMUJFWSA-N	429.355	1.995	50	20	IDGD	
Cc1nccn1CCCC(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836720361	RFBHAYQWYOCUHJ-LJQANCHMSA-N	440.972	1.570	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)OC(C)C)CCO2	1837604043	SFFZWHZJDZJNEW-MPGHIAIKSA-N	435.359	1.430	50	20	IDGD	
CC(C)O[C@H](C)C(=O)N1CCC(OC2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1	1838416068	HTICUMSARCENOT-QGZVFWFLSA-N	440.585	1.172	50	20	IDGD	
C[C@@H](C(=O)N1CCC(OC2CCN(C(=O)[C@@H](F)Br)CC2)CC1)n1cncn1	1838647948	ARCYJTRHKWQEJX-SWLSCSKDSA-N	446.321	1.528	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CC34CCCN3CCC4)CCO2)C1	1839116885	POICXSJTLVRRBE-XMSQKQJNSA-N	442.000	1.869	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3CC=CC[C@H]3C(=O)OC)C2)C1	1839148562	BTWGYNHBYAQWAX-DLRJPAPCSA-N	442.940	1.216	50	20	IDGD	
COc1cccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)n1	1839151657	ZNSNBZUVRDQELS-OALUTQOASA-N	446.331	1.397	50	20	IDGD	
Cc1cnn([C@H](C)C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)c1	1839155194	NLPZHMVSKNNYRU-AYOQOUSVSA-N	447.363	1.445	50	20	IDGD	
Cc1cc(F)cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)c1	1839284424	CWWPSHRXDKGBFS-KUHUBIRLSA-N	443.313	1.988	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)/C=C/c3cccc(O)c3)CCO2)C1	1839926508	XFCYBFWBZLDYPC-ABGJEJFVSA-N	438.908	1.116	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3coc(Cl)n3)C2)C1	1840031025	DGLJGGWPHMBGGO-BMIGLBTASA-N	436.690	1.181	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)/C(C)=C/c3cccs3)C2)C1	1840149774	ZQCHULTVZUGTFF-UNTOAVRTSA-N	442.965	1.862	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3ccc(C)nc3)C2)C1	1840149936	CDINNEUEUKLCNP-NQIIRXRSSA-N	439.940	1.033	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3nc(C)sc3C)C2)C1	1840150864	SIHWPYUJULJDBK-BEFAXECRSA-N	445.969	1.013	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3c(F)cccc3F)C2)C1	1840154243	QIRPUYFRRITPFG-ORAYPTAESA-N	432.851	1.289	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC12CN(C(=O)[C@@H]1CC(c3ccccc3)=NN1)C2	1841289385	XWIKDNAWKPEMQZ-YOEHRIQHSA-N	433.350	1.987	50	20	IDGD	
C[C@H](Sc1cccs1)C(=O)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843014332	YHBGBTKWCDIFNR-AWEZNQCLSA-N	430.360	1.426	50	20	IDGD	
Cc1nnc(CC(=O)N2CCCC23CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C3)o1	1843044126	UHZITOWQSSYPKM-ZDUSSCGKSA-N	441.916	1.256	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)Cc1ccc3c(c1)CCO3)C2	1843417029	PPIZUNWYUVEICN-WGOQTCKBSA-N	449.511	1.501	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@](C)(C(=O)N2CCCC23CN(C(=O)[C@@H](F)Cl)C3)[C@H](O)C1	1843982864	XEYVQPJRMDLXRG-LPMFXHHGSA-N	447.935	1.732	50	20	IDGD	
Cc1nn2cc(CC(=O)N3CC4(CCCN4C(=O)[C@H](F)Br)C3)nc2s1	1845216246	FCLDDXFHPDTOAL-LBPRGKRZSA-N	430.303	1.536	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)[C@H](c2ccccc2Cl)N(C)C)C1	1845851093	HDYBPKONUIDRSV-FQEVSTJZSA-N	449.983	1.519	50	20	IDGD	
O=C1C[C@@H](C(=O)N2CC3(CCCN3C(=O)[C@@H](Br)Cc3ccccc3)C2)CN1	1845942382	CRZXEQVBRJKOJZ-CVEARBPZSA-N	434.334	1.332	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)CS(=O)(=O)c1ccc(C)cc1)C2	1846361146	BCGGIBVPJGPMEV-INIZCTEOSA-N	428.938	1.226	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@H]1CCC(=O)N1C(=O)OC(C)(C)C)C2	1846365260	JKODSQJRJZDBOZ-KGLIPLIRSA-N	443.928	1.370	50	20	IDGD	
CCn1c(NNC(=O)CN2C(=O)N[C@@]3(CCCC[C@H]3C)C2=O)nc2ccccc2c1=O	10681440	OBOBGUGMVNKDRU-LRTDBIEQSA-N	426.477	1.360	50	20	IDGD	
O=C(COC(=O)Cn1nnc2ccccc2c1=O)NN=C(c1ccccc1)c1ccccc1	16258398	CWQYLEMLOYDEDE-UHFFFAOYSA-N	441.447	1.904	50	20	IDGD	
O=C(COC(=O)[C@@H]1COc2ccc(Cl)cc2C1)NNC(=O)c1ccc([N+](=O)[O-])cc1	16796754	UTSMNHGTUJJTSB-ZDUSSCGKSA-N	433.804	1.804	50	20	IDGD	
COC[C@H](C)NC(=O)NC(=O)COC(=O)/C(C#N)=C/c1cc(C)n(C[C@H]2CCCO2)c1C	23581530	LRIXLLIRZKDIDA-VLZIOHSXSA-N	446.504	1.595	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCN(c3cccc(C)c3C)CC2)cc1OC	105170394	GYSRNZIWKDIIGM-UHFFFAOYSA-N	426.517	1.904	50	20	IDGD	
CCCS(=O)(=O)N1CCCC[C@H]1C(=O)NNC(=O)[C@@H](C)Oc1cccc(C)c1C	108753708	SJIQMCAUVNXQNG-SJORKVTESA-N	425.551	1.812	50	20	IDGD	
COc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NNC(=O)CNc2ccc(C)cc2C)cc1	726102140	SXMBLFWISVZJKY-HNNXBMFYSA-N	434.518	1.238	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)C[C@H](C)NC(=O)C1CCCCC1	727365557	HUFMYFIAONORTN-ZDUSSCGKSA-N	437.566	1.524	50	20	IDGD	
CCCc1c(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)[nH]c(C)c1C(C)=O	728329523	BMKIAFIRKGEJAQ-QGZVFWFLSA-N	443.456	1.622	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2ccccc2)n1	728719743	WCPLGYGFCZNCLB-INIZCTEOSA-N	444.513	1.380	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)C1CCN(S(=O)(=O)/C=C\c2ccccc2)CC1	728852163	POVUGARHFKGHBZ-UVTDQMKNSA-N	428.514	1.484	50	20	IDGD	
Cc1cc(COc2ccc(C=NNC(=O)N[C@@H]3CCS(=O)(=O)C3)cc2)oc1C(=O)O	729932925	OGLFGMQUMVRMJE-CQSZACIVSA-N	435.458	1.685	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2ccc(C(=O)NNC(=O)Cc3cc[nH]n3)cc2)cc1C	730102808	NHCQOYWLDVIPAA-UHFFFAOYSA-N	427.486	1.831	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)NCc2cccc(C(F)(F)F)c2)ccc1S(N)(=O)=O	730842870	SKLVRBORDNDCSX-UHFFFAOYSA-N	430.408	1.805	50	20	IDGD	
COc1ccccc1[C@H](NC(=O)NNC(=O)COc1ccccc1O)c1nccn1C	730905841	VKYHZRUVDAFQSX-IBGZPJMESA-N	425.445	1.633	50	20	IDGD	
CC(=O)N1CCCCC[C@H]1C1CCN(CC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)CC1	731665837	GDDLOCUKMAKSKT-FQEVSTJZSA-N	445.520	1.859	50	20	IDGD	
CC(C)Oc1ccc(NS(=O)(=O)CC(=O)NNc2nc(-c3ccncc3)no2)cc1	732067258	FUQJKTAUQMOBMO-UHFFFAOYSA-N	432.462	1.804	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1ccc(F)c(F)c1	732087290	YVFUQJVWEXGQGO-UHFFFAOYSA-N	435.412	1.872	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2cc(Br)c3c(c2)OCCO3)C[C@@H](C)O1	732260203	PTVYRHKMUZPAOK-TXEJJXNPSA-N	442.310	1.481	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(C(=O)CCC(=O)NNc3ccccc3)CC2)cc1	732266341	YMMFQXLBRNRWAN-UHFFFAOYSA-N	430.530	1.751	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NCCCCN2C(=O)c3ccccc3C2=O)cc1	732472127	PQJWFBKRLXUYHE-UHFFFAOYSA-N	440.456	1.481	50	20	IDGD	
CCn1cc(C=NNC(=O)C[C@H]2c3cc(OC)c(OC)cc3CCN2S(C)(=O)=O)cn1	732527656	DVIHQCWRPCXBIU-KRWDZBQOSA-N	449.533	1.319	50	20	IDGD	
O=C(NNC(=O)c1ccc(COc2ccccc2)o1)N[C@@H]1CCN(CC(F)(F)F)C1=O	732573428	QZXVKXBSDWJUCO-CQSZACIVSA-N	440.378	1.966	50	20	IDGD	
CC(C)NC(=O)CCCC(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	732749461	ABDHNKHESNRQJM-UHFFFAOYSA-N	449.511	1.901	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)Cc1c(C)nc(-c2ncccn2)nc1O	732752000	ZELQYWMNMPZWIS-UHFFFAOYSA-N	446.471	1.250	50	20	IDGD	
O=C(NNC(=O)N1CCCN(Cc2cscn2)CC1)c1cnn(-c2ccccc2)c1	733349234	YWMPJNCXUOVZJP-UHFFFAOYSA-N	425.518	1.891	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cnn(C)c2)cc1S(=O)(=O)N[C@@H]1CCCC[C@H]1C	735446112	WYNZSFQAVHDDKC-CZUORRHYSA-N	449.533	1.361	50	20	IDGD	
COc1cc(S(=O)(=O)NNC(=O)C(F)(F)Oc2ccccc2)cc(C(=O)O)c1OC	741653175	WFBBSDSMAQUMAT-UHFFFAOYSA-N	446.384	1.383	50	20	IDGD	
COc1cc(C(=O)NNC(=O)COc2ccc(F)cc2)cc(NS(C)(=O)=O)c1OC	742479129	ZRWUILMVHYYDTH-UHFFFAOYSA-N	441.437	1.054	50	20	IDGD	
Cc1cc(F)cc(C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1	742486816	ACHUHYPSSXYFMH-UHFFFAOYSA-N	449.504	1.549	50	20	IDGD	
C[C@@H](CC(=O)NNC(=O)c1cccc(N(C)C)c1)/N=C1/NS(=O)(=O)c2ccccc21	742487166	LHZRQWXABGFTBH-ZDUSSCGKSA-N	429.502	1.031	50	20	IDGD	
O=C1C[C@@H](Cc2ccc(C(=O)NNc3ccc(S(=O)(=O)NC4CC4)cc3)cc2)C(=O)N1	743328428	NJGKCAZHGYKAKN-OAHLLOKOSA-N	442.497	1.089	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)N[C@@H]3C[C@@H]3c3cccc(F)c3)nc2)CC1	743357073	VPQBNWHHPCPFDG-QZTJIDSGSA-N	448.524	1.339	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)/C=C\c1ccccc1)C(=O)NNC(=O)NC1CCCC1	744052478	FDZYLEZNRPISGQ-AINHQSCGSA-N	440.591	1.971	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1cc(O)nc2ccc(F)cc12	744619581	SRDSHTIHJBFFFX-UHFFFAOYSA-N	446.460	1.857	50	20	IDGD	
CCCNC(=O)Nc1ccc(CC(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)cc1	744919609	WLUHWDMMPOEQKB-UHFFFAOYSA-N	437.456	1.637	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)c1cn(-c2ccccc2Br)nn1	746548651	LLLOJQCNDJHQOA-UHFFFAOYSA-N	440.261	1.681	50	20	IDGD	
CN(C)N(C(=O)CCNC(=O)c1ccc(Br)cc1)[C@@H]1CCS(=O)(=O)C1	746950306	TXCCZHZSZODJCA-CQSZACIVSA-N	432.340	1.061	50	20	IDGD	
O=C(NNC(=O)[C@@H]1C[C@H]1c1cccc(Br)c1)c1ccc(-n2cnnn2)cc1	747411590	CMUMRPDRCXSAES-JKSUJKDBSA-N	427.262	1.990	50	20	IDGD	
O=C(CCNS(=O)(=O)c1cccc([N+](=O)[O-])c1)NNC(=O)c1ccc(Cl)cc1F	747430725	CPHSDLKBZWCHJX-UHFFFAOYSA-N	444.828	1.517	50	20	IDGD	
COc1cc(S(=O)(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)ccc1Br	747618591	YLSUSITUINWHFF-UHFFFAOYSA-N	446.235	1.695	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)[C@@H](Cc2cccc(F)c2)n2nnnc2C)o1	747713281	RDUVSGGFDZKJPX-GOSISDBHSA-N	443.483	1.800	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NCC(=O)NNc2cccc(C#N)c2)c1	748046296	ZRQGPDLVOSTPAS-UHFFFAOYSA-N	429.502	1.462	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccc(F)cc2Cl)CC1)NNC(=O)c1ccc(F)cc1	748084293	SLXRJSNPTGYUSR-UHFFFAOYSA-N	436.846	1.837	50	20	IDGD	
CCCn1nc(C(=O)NNS(=O)(=O)c2ccc(CC(=O)O)cc2)c2ccccc2c1=O	748639730	LOPVAPYUVIGAOI-UHFFFAOYSA-N	444.469	1.057	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN1C(=O)c1ccc2c(c1)OCO2)c1cccc([N+](=O)[O-])c1	749463712	XNNMDDVMHDWZOK-OAHLLOKOSA-N	426.385	1.389	50	20	IDGD	
O=C(NNC(=S)NC[C@H]1CCOC1)c1ccccc1NS(=O)(=O)c1cccs1	749643281	AJLSVVYTWIMTRK-GFCCVEGCSA-N	440.572	1.694	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)c2ccc(-n3ccnc3)nn2)c2ccccc2c1=O	750663060	LAZUXDWLOQJYDU-UHFFFAOYSA-N	446.471	1.637	50	20	IDGD	
CCOCCCn1c(NNC(=O)[C@H]2CCc3nnc(C)n3C2)nc2ccccc2c1=O	750776138	LVSUSLJPTTYXKM-HNNXBMFYSA-N	425.493	1.429	50	20	IDGD	
COCCCN1C(=O)C(=NNC(=O)Cc2cc(C)[nH]n2)c2cc(Br)ccc21	750933029	WCEZKMVWAGJTAO-UHFFFAOYSA-N	434.294	1.927	50	20	IDGD	
Cc1ccc(C)c(N2N=C(C(=O)NNC(=O)CNC(=O)c3cccs3)CCC2=O)c1	751210971	MJZFFKOJCSOSDH-UHFFFAOYSA-N	427.486	1.425	50	20	IDGD	
Cc1ccc(C)c(S(=O)(=O)Nc2cccc(C(=O)NNC(=O)CN3CCCC3=O)c2)c1	751617704	MRBQRIMWEIBIAE-UHFFFAOYSA-N	444.513	1.488	50	20	IDGD	
COC(=O)C[C@H](NC(=O)NNC(=O)CNC(=O)c1cccs1)c1ccc(Cl)cc1	752010186	RAMIVJDEFAGHIQ-ZDUSSCGKSA-N	438.893	1.766	50	20	IDGD	
CC(C)(C)OC(=O)NC1(CNC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)CCC1	753333167	FFGSUDRDFBPBGC-UHFFFAOYSA-N	444.492	1.969	50	20	IDGD	
Cc1ncc(S(=O)(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)s1	754754016	IWDGWZICUBBCOX-UHFFFAOYSA-N	443.982	1.232	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)Nc1cccc(C(=O)N2CCOCC2)c1	755926787	OOAZYCALYWKQKJ-SFHVURJKSA-N	426.429	1.152	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)Nc1ccc(N2CCNC(=O)C2)c(Cl)c1	755939014	ZUQJBHNABLBSSU-UHFFFAOYSA-N	441.879	1.699	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NC(=O)NNC(=O)COc1ccc(C#N)cc1	756525555	QIWSFOKQENSPIV-UHFFFAOYSA-N	445.501	1.867	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)Nc1ccc(CNS(C)(=O)=O)cc1	756626463	PTARNKXXOYIWOK-UHFFFAOYSA-N	436.490	1.366	50	20	IDGD	
CCCNS(=O)(=O)c1ccc(NC(=O)NNC(=O)COc2ccccc2OC)cc1	756775603	JMKOJPREWDFFAB-UHFFFAOYSA-N	436.490	1.615	50	20	IDGD	
C[C@@H]1C[C@@H](C)CC2(C1)NC(=O)N(CC(=O)NNC(=O)c1cc(Br)c[nH]1)C2=O	756871033	NVNADIGXZXFKKM-NXEZZACHSA-N	440.298	1.285	50	20	IDGD	
CN(c1ccccc1NC(=O)NNC(=O)c1nn(-c2ccccc2)cc1O)S(C)(=O)=O	757662369	ZCLBOHGEYLMCBW-UHFFFAOYSA-N	444.473	1.440	50	20	IDGD	
Cc1ccc(Cn2cccc(NC(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)c2=O)cc1	757771128	USQOUKUFMJAYAO-UHFFFAOYSA-N	444.455	1.647	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)c1ccc(-c2noc(-c3ccc(F)cc3)n2)cc1	758025484	MHZVZYCHRLIPHQ-LLVKDONJSA-N	447.448	1.241	50	20	IDGD	
C[C@@H]1CC(C)(C)C[C@@]2(C1)NC(=O)N(CC(=O)NNc1nc(O)c3ccccc3n1)C2=O	758296290	XJGASYDWQQVWGX-XUSGNXJCSA-N	426.477	1.915	50	20	IDGD	
O=C(COc1ccccc1Cc1ccccc1)NNC(=O)N[C@@H]1CCCS(=O)(=O)C1	758647578	CGIPNRHPANHHFP-GOSISDBHSA-N	431.514	1.564	50	20	IDGD	
CCCc1noc(CCCC(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)n1	758785952	HGUGGCXRKHXMMT-UHFFFAOYSA-N	438.529	1.981	50	20	IDGD	
CO[C@](C)(C(=O)NNC(=O)CN1CCN(Cc2ccc(C)cc2)CC1)c1ccccc1F	760447834	HYASSRSNGQSJRX-DEOSSOPVSA-N	442.535	1.961	50	20	IDGD	
Cc1c(C(=O)NNc2nccc(N3CCOCC3)n2)nnn1-c1cccc2cccnc12	762862629	XDEOEQGHUMATHJ-UHFFFAOYSA-N	431.460	1.507	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(C(N)=O)c(F)c2)c(C)n1-c1ccccc1	763599877	ASSAIMHZWQOMGT-UHFFFAOYSA-N	437.431	1.732	50	20	IDGD	
CC(C)(C)c1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(OCC(N)=O)c2)cc1	763601267	WRNSZXIPPDCBTB-UHFFFAOYSA-N	442.472	1.013	50	20	IDGD	
COc1ccc(Br)c(NC(=O)C(=O)NNC(=O)c2c(C)nc3ccccn23)c1	763629830	UJUUSUVGGKXNID-UHFFFAOYSA-N	446.261	1.814	50	20	IDGD	
CN(C)c1ncc(NC(=O)C(=O)NNC(=O)COc2ccccc2-c2ccccc2)cn1	763644318	UBKOAYREYZSPBU-UHFFFAOYSA-N	434.456	1.375	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cc(OC)ccc2OC(C)C)cc1	763661806	PFLKMYIWHQNJLR-UHFFFAOYSA-N	431.445	1.656	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(Br)c(F)c1	763661880	DTPIFLKYVITYQN-UHFFFAOYSA-N	440.225	1.762	50	20	IDGD	
COc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NNC(=O)COc1ccc(C)c(C)c1	763667871	WDPHZNMAVPKPBQ-UHFFFAOYSA-N	442.472	1.179	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(Oc3ccncc3)c2)cc1	763680010	BCSZBMIDZGSBFD-UHFFFAOYSA-N	431.408	1.910	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccn(CC(F)(F)F)c1=O	763712464	RMXNJKQIZQICAG-UHFFFAOYSA-N	440.378	1.138	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1cccc(-c2nncn2C)c1	763850428	NEBDRTSCPJZZJE-LBPRGKRZSA-N	426.408	1.175	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccccc2O[C@@H](C)C#N)cc1	763862453	XMAUCUNIMNBDEQ-GJZGRUSLSA-N	440.456	1.930	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1nc(-c2nccn2C)cs1	763872109	KEXRYHGBMNQBCQ-JTQLQIEISA-N	432.437	1.236	50	20	IDGD	
Cc1nc(-c2ccc(NC(=O)C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)cc2)cs1	763920634	AWMIYKJACVULTJ-UHFFFAOYSA-N	448.468	1.494	50	20	IDGD	
CN(C)c1ccc(NC(=O)C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc1Cl	763950131	TTXOHBIWBVNSAR-UHFFFAOYSA-N	442.863	1.697	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)CSc2ccccc2O)cc1-n1nnnc1C	763956895	SMDCBZNLUWCFNE-UHFFFAOYSA-N	429.462	1.630	50	20	IDGD	
COc1ccc(C(=O)N2CCCCCC2)cc1NC(=O)C(=O)NNC(=O)c1ccc[nH]1	763978757	CRCKINLRFHWYNH-UHFFFAOYSA-N	427.461	1.439	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)C(=O)Nc2ncn(Cc3ccc(C#N)cc3)n2)c2ccccc21	763982001	VFUHYHIQAJRMTR-UHFFFAOYSA-N	442.439	1.089	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)C(=O)Nc1ccccc1O[C@H]1CCOC1	763994266	BUBXBZPSNPKRKB-NSHDSACASA-N	437.250	1.345	50	20	IDGD	
CCCCn1ncc(NC(=O)C(=O)NNC(=O)c2cc(Br)cn2C)c1C	764002133	JJDZMFKQHZGMFW-UHFFFAOYSA-N	425.287	1.492	50	20	IDGD	
Cc1cc(N2CCOCC2)ccc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccccc2)on1	764004582	YTUHFAQZECEOHQ-UHFFFAOYSA-N	449.467	1.886	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1ccc(N2CCCC2=O)cc1	764010502	AJFQYWWOYUWKPA-UHFFFAOYSA-N	430.848	1.875	50	20	IDGD	
CCCCN(C)S(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)CC(F)(F)F)cc1	764111036	CSBNEYHYYCXKNP-UHFFFAOYSA-N	438.428	1.146	50	20	IDGD	
CCCCNS(=O)(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2cccc(C#N)c2)c1	764234810	KEWQRZDQIIZJEM-UHFFFAOYSA-N	443.485	1.036	50	20	IDGD	
C[C@@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)Cn3ccc4ccccc43)cc2)CCO1	764239292	KGSAHLBVKYGERG-MRXNPFEDSA-N	435.484	1.653	50	20	IDGD	
CCN(CC)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)cc1	764242537	GJQYKKWKQZTGOM-UHFFFAOYSA-N	435.484	1.909	50	20	IDGD	
C[C@H]1Cc2ccccc2N1Cc1occc1C(=O)NNC(=O)CNC(=O)c1cccnc1	764344647	GVSAWSUUPHYDBD-HNNXBMFYSA-N	433.468	1.817	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1F	764352068	ZDCWQTHGTSOITI-UHFFFAOYSA-N	425.376	1.198	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2cccs2)[nH]n1)C(=O)Nc1ccc2c(c1)OCCCO2	764382403	JHZJJALTSPWUOK-UHFFFAOYSA-N	427.442	1.699	50	20	IDGD	
CC(=O)N(C)c1cccc(NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)c1	764382466	LFLGWRVRICJTMP-UHFFFAOYSA-N	426.458	1.521	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)CCC(=O)N1CCN(c2ccccc2)CC1	764564831	XMWNROFFEJUAFB-QGZVFWFLSA-N	442.491	1.869	50	20	IDGD	
Cc1ccc(Br)c(C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)c1N	764591492	FLAYOLXQRUFCSH-UHFFFAOYSA-N	431.246	1.829	50	20	IDGD	
N#Cc1ccccc1S(=O)(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	765118418	DFGVCFRCRHZEOX-UHFFFAOYSA-N	447.948	1.339	50	20	IDGD	
O=C(CNC(=O)c1ccc(Br)o1)NNC(=O)CSc1ccccc1O	765403522	OJYZUJPHPPLMNT-UHFFFAOYSA-N	428.264	1.417	50	20	IDGD	
Cc1ccc(S(=O)(=O)NC2CC2)cc1C(=O)NNC(=O)c1cc(-c2cccs2)[nH]n1	765565325	NSOKKEHSKNCIMF-UHFFFAOYSA-N	445.526	1.962	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)C1=NO[C@@H](c2ccccc2)C1	766635866	HJDSBFDHDBWDOF-HXUWFJFHSA-N	435.484	1.109	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cnc4c(c3)c(C)nn4C)CC2)cc1	766651145	ZROOVSNJCTWNLJ-UHFFFAOYSA-N	435.532	1.164	50	20	IDGD	
O=C(NNC(=O)c1cccc(OC(F)F)c1)NC1CCN([C@H]2CCCC[C@@H]2O)CC1	767943479	NXSQVFQSAQNUGO-IRXDYDNUSA-N	426.464	2.000	50	20	IDGD	
COCCOC(=O)c1c(C)[nH]c(C(=O)NNc2c(OC)cccc2S(C)(=O)=O)c1C	768640264	ZGIJPLDHUVVUEF-UHFFFAOYSA-N	439.490	1.604	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NC[C@@H]2[C@@H]3Cc4ccccc4[C@@H]23)cc1	769151449	QYPBYWCFIZHORP-QKNQBKEWSA-N	442.541	1.532	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@@H]2CCO[C@@H](C)C2)c1	771434706	QUEAPNLFYXVSDV-LSDHHAIUSA-N	426.539	1.476	50	20	IDGD	
Cc1cc(S(=O)(=O)NCCNC(=O)NNC(=O)Cc2ccccc2F)c(C)s1	772623652	HOJURJXCGQLRTC-UHFFFAOYSA-N	428.511	1.355	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)c1cc(S(=O)(=O)N(C)C)cn1C	772963334	ISJAOYOIVWTWQL-LLVKDONJSA-N	428.898	1.157	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)ccc1OC	772991218	SVWQITBIJLHSSE-NSHDSACASA-N	441.893	1.485	50	20	IDGD	
Cn1c(CNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)nc2cccc(Cl)c21	773274352	UNCRFEMGRHAXKN-UHFFFAOYSA-N	442.911	1.764	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)NCc1ccc(N2CCCS2(=O)=O)c(F)c1	773283380	BWZUNNZUZRGIRE-UHFFFAOYSA-N	436.465	1.518	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2cccc(Br)n2)ccc1Cl	775604184	HFIVPENPIBLZMF-UHFFFAOYSA-N	433.671	1.220	50	20	IDGD	
Cc1ccc(-n2nc(C(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)cc2C)cc1	777273402	CMNHYVJGSZDUEA-UHFFFAOYSA-N	441.513	1.814	50	20	IDGD	
CCOC(=O)c1c(C)[nH]c(C(=O)N2CCN(S(=O)(=O)CBr)CC2)c1C	777777925	TVSDGWFIFHWPMD-UHFFFAOYSA-N	436.328	1.248	50	20	IDGD	
O=C(Cc1ccc(-n2cccn2)cc1)N1CCN(S(=O)(=O)CBr)CC1	777779602	PKPYSTXGXRVDRZ-UHFFFAOYSA-N	427.324	1.241	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)[C@@H](Cc2ccccc2)NC(=O)c2cccnc2)nc1C	778427442	XZKMVRKXGOJJLO-LJQANCHMSA-N	448.483	1.841	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@H](C(=O)NNC(=O)C(C)(C)c2ccccc2)[C@H](C)O)cc1	779514891	OXUJRUNQWYAXGH-YJBOKZPZSA-N	433.530	1.148	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)N[C@@H]1CCc2nnc(-c3ccc(F)cc3)n2C1	780909223	MHVYOFXFXYMVKB-OAHLLOKOSA-N	439.407	1.951	50	20	IDGD	
O=C(NNc1ncncc1Cl)C(=O)Nc1cccc(N2CCN(CC3CC3)CC2)c1	782158466	FEMVDUBSRPOWJG-UHFFFAOYSA-N	429.912	1.744	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccc(-c3ccc[nH]3)cc2)nc1	783258261	FSIWGTMKZSVDQT-UHFFFAOYSA-N	442.501	1.845	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccc3c(c2)OC(C)(C)O3)nc1	783264914	SNBZWHZTACOFQN-UHFFFAOYSA-N	449.489	1.357	50	20	IDGD	
COc1ccc(I)c(NC(=O)C(=O)NNc2cc(C)nc(C)n2)c1	783326143	SYTNWCSNXBVAGU-UHFFFAOYSA-N	441.229	1.788	50	20	IDGD	
CCCOc1ccc(NC(=O)C(=O)NN[C@@]2(C)CCS(=O)(=O)C2)cc1OCCC	783424921	GMWSZFXDEBXYNA-IBGZPJMESA-N	427.523	1.401	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ccc(Br)cn2)cc1S(C)(=O)=O	784338574	BLEBDEOYDRNDFJ-UHFFFAOYSA-N	427.280	1.638	50	20	IDGD	
NC(=O)C1CCN(Cc2cccc(NC(=O)C(=O)NNc3ccc(F)c(F)c3F)c2)CC1	784806793	LQUPEKRLRVSVSJ-UHFFFAOYSA-N	449.433	1.883	50	20	IDGD	
Cc1cc(S(C)(=O)=O)ccc1NC(=O)C(=O)NNc1ccc(Br)nc1	784809143	MOJYYCCUQVIWHP-UHFFFAOYSA-N	427.280	1.638	50	20	IDGD	
Cc1cnn(Cc2cc(F)ccc2F)c1NC(=O)C(=O)NNc1ccnc(N(C)C)n1	784968745	DGVIEMVLQMLWRO-UHFFFAOYSA-N	430.419	1.456	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)Nc1ccccc1OC(F)(F)F	785024014	QFDDKOAVIWYTPI-UHFFFAOYSA-N	428.279	1.599	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)C(=O)Nc1ccc(-c2n[nH]c(C3CC3)n2)cc1	785060805	MZCNDAVTVJFIRQ-UHFFFAOYSA-N	444.455	1.325	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)C(C)(C)S(=O)(=O)C2CC2)c2ccccc2c1=O	785689103	KEVSTYPGDTXMAZ-UHFFFAOYSA-N	448.545	1.704	50	20	IDGD	
CCOC(=O)[C@@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)NCc1ccc(Cl)cc1	787430600	DSOYIFOVYVGETR-ZDUSSCGKSA-N	428.873	1.627	50	20	IDGD	
COC(=O)c1cncc(S(=O)(=O)NNC(=O)[C@@H](C)Oc2ccc3ccccc3c2)c1	788478691	UJLNTOCHCVDACH-CYBMUJFWSA-N	429.454	1.798	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)N2CCN(C(=O)C(=O)NC(C)C)CC2)c(C)n1CC(C)C	790898823	BYOAIIPFXJPRPG-UDWIEESQSA-N	427.549	1.863	50	20	IDGD	
CO[C@@H]1CCOc2c(NC(=O)C(=O)NNC(=O)[C@H](C)Oc3ccc(F)cc3)cccc21	790952899	XLDDZMLDAJJOAA-YVEFUNNKSA-N	431.420	1.849	50	20	IDGD	
O=C(CCCS(=O)(=O)c1ccc(Cl)cc1)NNC(=O)[C@H]1COc2ccccc2O1	794759221	HBSRVUAWYSBSRA-QGZVFWFLSA-N	438.889	1.881	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NN=C[C@H]1CCCSC1	794859970	KTVJWDCKCBBVBU-QGZVFWFLSA-N	425.576	1.885	50	20	IDGD	
CN(C)N(C(=O)c1cc(S(=O)(=O)C2CCCC2)ccc1F)[C@H]1CCS(=O)(=O)C1	797422500	ZHHNYQBNORMWGT-ZDUSSCGKSA-N	432.539	1.648	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)NCCCNS(=O)(=O)c2ccccc2Cl)cc1	798493617	YKGBBFAKJLVUDL-UHFFFAOYSA-N	435.893	1.524	50	20	IDGD	
Cc1nnnn1[C@@H](Cc1ccc(F)cc1)C(=O)NNC(=O)Nc1ccc2c(c1)OCO2	802100851	AJHZBLPQYQWOIT-HNNXBMFYSA-N	427.396	1.486	50	20	IDGD	
C[C@@](O)(CSc1cccc(F)c1)C(=O)OCC(=O)NNC(=O)c1ccc(C#N)cc1	803801420	IXNAFMMPEHQLOV-HXUWFJFHSA-N	431.445	1.545	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2c(C)c(C(F)(F)F)nn2C)c1C	806975047	LLVUUBANQDCPHJ-LBPRGKRZSA-N	441.410	1.918	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)N[C@H]2CCCN(C(=O)N3CCCC3)C2)cc1	807461235	UTWRAXJTZJBUJT-IRXDYDNUSA-N	447.536	1.863	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NC1C[C@@H]2CC[C@H](C1)N2CC(=O)N(C)C	807514486	VIDWPOHBYPQZDF-HZTRTUMWSA-N	435.500	1.007	50	20	IDGD	
CCS(=O)(=O)N1CCC([C@@H](C)N(C)C(=O)NNC(=O)Cn2ccc3ccccc32)CC1	808267234	ZCRSCLTVACTCQG-MRXNPFEDSA-N	449.577	1.764	50	20	IDGD	
CC[C@@H]1[C@H](C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)CCN1C(=O)OC(C)(C)C	810107066	VLFPHHMFDLIOFN-HZPDHXFCSA-N	439.534	1.887	50	20	IDGD	
Cc1ccc(Sc2nsc(NC(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)n2)cc1	810247677	WBVGSUWVZOXESV-JTQLQIEISA-N	427.533	1.585	50	20	IDGD	
O=C(Cc1cc[nH]n1)NNC(=O)Cc1sc(N2CCOCC2)nc1-c1ccccc1	810357850	YZGLWEANBQVECL-UHFFFAOYSA-N	426.502	1.302	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)cc1	812728166	IIBWHRSCNXJENV-UHFFFAOYSA-N	440.547	1.381	50	20	IDGD	
Cc1ncc(-c2ccc(NC(=O)C(=O)NNc3ccc(S(=O)(=O)N(C)C)cc3)cc2)o1	813033085	DWDQLXRVRNTJIF-UHFFFAOYSA-N	443.485	1.982	50	20	IDGD	
C[C@](O)(C(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1)C1CCC1	813363960	AIMGAZZDMRXWTB-OAQYLSRUSA-N	431.514	1.477	50	20	IDGD	
CCOc1ccc(NS(=O)(=O)c2cc(C(=O)N3CC[C@@H](B(O)O)C3)ccc2C)cc1	864233646	JJIWRVKHKVNXNX-MRXNPFEDSA-N	432.307	1.883	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=S)NC[C@@H]2CCCN2CC)c2ccccc2c1=O	884169144	XBRKMMOFKCRMHX-HNNXBMFYSA-N	430.578	1.790	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)[C@@H](C)N2C(=O)[C@H]3CCCC[C@H]3C2=O)cc1OC	913069808	NGQOCJFYNXHLHT-BMFZPTHFSA-N	431.489	1.809	50	20	IDGD	
COc1ccc([C@@H](CNC(=O)NNc2ccc(Cl)nn2)N2CCOCC2)cc1OC	915894497	BNUWJKSHLSMGKO-CQSZACIVSA-N	436.900	1.847	50	20	IDGD	
CN(C)N(C(=O)CCNC(=O)Nc1ccc(Br)cc1)[C@H]1CCS(=O)(=O)C1	916041159	RFTCVTBFVNORMW-AWEZNQCLSA-N	447.355	1.453	50	20	IDGD	
O=C(CN1CCC[C@H]1c1ccc2c(c1)OCCO2)NNC(=O)c1cccc([N+](=O)[O-])c1	916150252	YNFGDSMHDJXMSW-KRWDZBQOSA-N	426.429	1.964	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCCOc2ccccc2F)c1	916222944	QLLDQKONOOBUTC-UHFFFAOYSA-N	438.481	1.489	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2ccnc(OC)c2)c1	916255565	LBMFMRXIRCVGCR-UHFFFAOYSA-N	435.506	1.265	50	20	IDGD	
CCS(=O)(=O)N1CCC(NC(=O)NNC(=O)[C@@H](C)Oc2ccc3ccccc3c2)CC1	916260189	RQYWUQIQLUYRDA-OAHLLOKOSA-N	448.545	1.752	50	20	IDGD	
COCCOc1ccc(CNC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc1	916514467	PGCYPZOIJNCVFG-UHFFFAOYSA-N	425.445	1.747	50	20	IDGD	
CSCC[C@@H](NC(=O)c1cccc(C)c1)C(=O)NNC(=O)C(=O)Nc1ccc(C)cc1	916830474	BATBTRPUDIFYBI-GOSISDBHSA-N	442.541	1.941	50	20	IDGD	
Cc1nccn1-c1ccc(CNC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cn1	918113395	YYKNIOVTJZTSDG-UHFFFAOYSA-N	432.444	1.611	50	20	IDGD	
O=C(CCCc1nc(-c2ccc(F)cc2)no1)NNC(=O)c1ccc(-n2cnnn2)cc1	918204947	VXTCLXRUSFIZGX-UHFFFAOYSA-N	436.407	1.635	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1csc(-c2cnn(C)c2)n1	919429147	MVEFDJXSUNSPQJ-UHFFFAOYSA-N	449.876	1.824	50	20	IDGD	
Cc1c(CC(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)nnn1-c1ccccc1	919610442	ZBXHJVSHXAFELA-UHFFFAOYSA-N	438.400	1.031	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)n(-c2ccccc2)n1)N[C@H]1CCS(=O)(=O)C1	919884894	ICDWQVCRTGPOSR-INIZCTEOSA-N	439.497	1.670	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)[C@H]2CCCN2C(=O)/C=C/c2ccc(C(N)=O)cc2)c(O)c1	920037428	PAUWOSQZDCPYKC-JGZYNSJSSA-N	436.468	1.265	50	20	IDGD	
C=CCNS(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(CN(CC)CC)o2)c1	920248912	VXHBVWMURVFGRP-UHFFFAOYSA-N	434.518	1.661	50	20	IDGD	
CNS(=O)(=O)c1ccc(Br)c(C(=O)NNc2cc(Cl)nc(N)n2)c1	1320077374	NTZQFRMDMLLEBL-UHFFFAOYSA-N	435.691	1.140	50	20	IDGD	
CCOC(=O)c1ncc(C(=O)OCC(=O)NNC(=O)c2cc(Cl)ccc2OC)s1	1321274854	UQCZDYABQCTRNT-UHFFFAOYSA-N	441.849	1.600	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)c3cc4ccccc4o3)C2)C1	1777844416	FNUVSLZVFPKFBH-JOCHJYFZSA-N	428.489	1.249	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnn3cc(C)cnc23)C1	1779023197	KJKGBABJICYFCN-CSODHUTKSA-N	449.939	1.419	50	20	IDGD	
O=C1Nc2c(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)[C@@H](F)Cl)C4)cccc2C1=O	1779150249	GYMYXDQJOSIOKP-OWDMVUQNSA-N	437.855	1.483	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@]2(CN(C(=O)/C=C/c3ccc([N+](=O)[O-])o3)CCO2)C1	1779294138	CHAGNNPGXIYXTF-OQBYNLHGSA-N	437.525	1.882	50	20	IDGD	
COc1ccnc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](F)Br)C3)c1	1779701846	IKJADQDQMJPRRU-IIDMSEBBSA-N	444.301	1.908	50	20	IDGD	
COc1nn(C)cc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@](C)(Cl)CCl)C1	1780710314	OXSCEZNUMDXQSO-MDASCCDHSA-N	447.363	1.793	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)C[C@@H](O)CNC(=O)OC(C)(C)C)CCO2)C1	1781216489	JLGUECSZPNNOQU-SIFCLUCFSA-N	447.960	1.109	50	20	IDGD	
Cn1cc2cc(C(=O)N3CCO[C@]4(CCN(C(=O)[C@H](F)Br)C4)C3)ccc2n1	1781333227	MLWBSHIIILNOPQ-YJBOKZPZSA-N	439.285	1.707	50	20	IDGD	
CCOC(=O)O[C@@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCBr)C2	1781511566	VFWMNEGSJHPBKL-PMUMKWKESA-N	449.342	1.847	50	20	IDGD	
O=C(Cn1cnc2ccccc21)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2	1782096489	UYGZBLNNFTZNJS-WAOWUJCRSA-N	434.924	1.150	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc4cccnc4nc3O)C2)C1	1782267339	HNAUMHVSQBAOMK-HXPMCKFVSA-N	449.305	1.562	50	20	IDGD	
C[C@]1(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2ccc(B(O)O)cc2)C3)CC=CCC1	1782722076	VSYWIXILNBETNW-FGCOXFRFSA-N	440.349	1.240	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(CCN(C(=O)[C@@H](O)Cc3ccccc3)C2)C1	1783334662	UZKKSZJOHWPDOO-QFBILLFUSA-N	425.323	1.205	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)COc3ccc(O)cc3)CCO2)C1	1783338053	CXFOFRKVUZVHMY-LPHOPBHVSA-N	441.322	1.774	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](N)c1ccccn1)CCO2	1783343333	TVJQQURPGIUHHP-DHSIGJKJSA-N	425.327	1.085	50	20	IDGD	
COC(=O)[C@@H]1CC[C@H](C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)C(C)(C)CCl)[C@H]3C2)C1	1783847457	OGOODZNEMIFTCO-QEOTZNIISA-N	428.957	1.820	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)C3CC(C)(C)C3)C2)C1	1784025573	SCZXQJSMPUWURW-VCOZGABYSA-N	429.521	1.387	50	20	IDGD	
O=C([C@H](F)Br)N1CCO[C@]2(CCN(C(=O)[C@H](O)c3ccccc3Cl)C2)C1	1784253975	VQERYDMRBIQVCE-KEYYUXOJSA-N	449.704	1.894	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ncc(F)cc3F)[C@H]2C1	1784771403	LLLKIARSBNLBNH-IHOMSZDFSA-N	432.265	1.737	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3cnc[nH]3)[C@H]2C1	1785220226	MJOVHSLRGSVMTQ-SDADXPQNSA-N	427.343	1.353	50	20	IDGD	
CC[C@@H](NC(C)=O)C(=O)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1	1785865070	HBBBABALNARLGW-HXUWFJFHSA-N	437.305	1.029	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)ccc3F)C[C@@H]21	1786409097	ZUQDGVWAZVTDQP-PJODQICGSA-N	429.286	1.910	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC1(c2ccc(NC(=O)C(=O)c3ccco3)cc2)CCC1	1786754894	CUPFWVUQKYHTKX-UHFFFAOYSA-N	426.473	1.969	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)c1c[nH]c2nccc-2c1Cl	1787346924	UXZXIRKHLSOUGC-HJPIBITLSA-N	441.315	1.361	50	20	IDGD	
Cc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]32)cc(O)n1	1787458230	NLUANBKQBKIRKF-VFSPDHHESA-N	430.332	1.925	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnn4ccccc34)[C@H]2C1	1787853226	ZYUMLBLVSPIQFH-IEZWGBDMSA-N	430.581	1.779	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)[C@@H](O)c3ccco3)CCC2)cc1)c1cccc(B(O)O)c1	1788145204	KDHCWCPDNDLCIS-FQEVSTJZSA-N	434.257	1.441	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1)c1cc[n+]([O-])cc1	1789951479	DIXRDDCBDJEJBY-UHFFFAOYSA-N	431.257	1.061	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)c1ccc(CO)c(F)c1	1792091305	BFQQLVVNAFXPKB-DARAHFNDSA-N	447.276	1.602	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C#Cc1ccc(Cl)cc1)c1cccc(B(O)O)c1	1792942378	IAGLAEDRWPYGSE-WKCHPHFGSA-N	436.704	1.323	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc2nc[nH]c12	1796145606	MOWUYHWBVGWKJN-FAXLKDOZSA-N	435.322	1.940	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc[nH]c2nccc1-2	1796186377	HNSKCNZGXKUOBY-NOXHYTERSA-N	435.322	1.891	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1cc[nH]c2nccc1-2	1796187511	NYTLNUIRUSELSG-DJBIQUGXSA-N	425.258	1.408	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)c1cc(Cl)c(F)cc1F	1796191783	WVDIHUNUCCTPSL-QDMKHBRRSA-N	448.662	1.864	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](C)[C@H]1SC(=N)NC1=O	1796876777	FIBNOYCRTNHFKI-DIURFFJMSA-N	445.383	1.601	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cn2cccnc2n1	1797388802	IXFXOKKZXSYPMH-QVHKTLOISA-N	436.310	1.106	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccccc1C(=O)OCCO)C2	1799268705	FULLONBNUZJRNI-LTCOOKNTSA-N	438.908	1.056	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c(Br)cnn1C)C2	1799269462	GMFKCGFJDADEJM-LFSVMHDDSA-N	433.734	1.403	50	20	IDGD	
COc1c(Cl)ccnc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCC(=O)NN(C)C)C2	1799419140	FYWVVDLNAYRAGW-BTTYYORXSA-N	437.928	1.368	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(C#N)cc1Cl	1799752401	RDVAAJCPMLLMDE-DLTLXFJOSA-N	426.300	1.669	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1(C(=O)Nc3ccccc3)CC1)C2	1800971376	WYXJHPYADAFYSV-CYGHRXIMSA-N	449.935	1.249	50	20	IDGD	
COc1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CCC(=O)NN(C)C)cc1Cl	1802343776	KFSYXIJNAVSJBL-MUJYYYPQSA-N	436.940	1.973	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2nn[nH]c2C(F)(F)F)[C@@H]1c1cccnc1)[C@H](O)CCl	1803140544	GUOFNTAOWADTIM-DMDPSCGWSA-N	446.817	1.138	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)/C=C/C2CC2)[C@@H]1c1cccnc1	1803189652	AXKWJMGPZYGAGO-RAIXIZIVSA-N	434.500	1.366	50	20	IDGD	
CC(=O)NC(C)(C)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@@H]1c1cccnc1	1803597170	YRZXSYLYOHVTRN-RRFJBIMHSA-N	443.317	1.693	50	20	IDGD	
O=C(CCN1C(=O)C=CC1=O)NC[C@@H]1CCN(C(=O)C(Cl)Cl)[C@H]1c1cccnc1	1803916691	JHHNHHWSTRLTIH-GUYCJALGSA-N	439.299	1.206	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H]2C[C@H]2C[C@@H]1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](O)CCl)C2	1804392593	KCPJBXKFWXFARO-OPCFMFSHSA-N	441.956	1.622	50	20	IDGD	
Cn1ncnc1C(=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@@H]1c1cccnc1	1805280416	ZEGYDTYAXAHBKK-YNEHKIRRSA-N	425.262	1.220	50	20	IDGD	
CN[C@H](CC(=O)NC[C@@H]1CCN(C(=O)[C@](C)(Cl)CCl)[C@H]1c1cccnc1)C(=O)O	1807206274	SPJQXYTYZQIFIZ-QMYADUOMSA-N	445.347	1.386	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)Cc2ccccc2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1	1807371475	VLYGAKIGGCCTIZ-ZJSXRUAMSA-N	443.312	1.324	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)N1CC[C@H](CNC(=O)CO[Si](C)(C)C)[C@@H]1c1cccnc1	1810541632	LIHSPVOKJXNDIX-RYRKJORJSA-N	435.601	1.386	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@H]1CCN(C(=O)CCSC(=N)N)[C@H]1c1cccnc1	1810542542	ZPRZJGNIXAMUGJ-QAPCUYQASA-N	437.642	1.956	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)c2cc(O)n(C)n2)[C@@H]1c1cccnc1	1812864439	HYBFXZQEQANGKO-DETPVDSQSA-N	436.310	1.624	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)C(C)(C)CNC(C)=O)[C@H]1c1cccnc1	1813027951	HEHWIMAHKJYFKP-BZSNNMDCSA-N	438.956	1.504	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)CCN2CCOCC2)[C@H]1c1cccnc1	1813030232	FNKPXUFRAUMEIR-BJLQDIEVSA-N	438.956	1.064	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2cn3ncccc3n2)[C@@H]1c1cccnc1	1813031289	SBEOMUDUMFDUDH-TXPKVOOTSA-N	442.907	1.698	50	20	IDGD	
C[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](O)CCl)n[nH]1	1814864779	SUQPDZOUJFDKIU-FPMFFAJLSA-N	443.932	1.915	50	20	IDGD	
C[C@H](NC(=O)c1ccccc1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](O)CCl)n[nH]1	1814875563	DASVESDJOVIZCX-IAOVAPTHSA-N	447.923	1.820	50	20	IDGD	
Cc1ccc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)c(C)c1	1815343661	IDENGBTWQHUKTN-QGZVFWFLSA-N	449.341	1.979	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(F)cc1)CC2)c1cccc(B(O)O)c1	1815360215	BTSOVAQOKJLLGL-MRXNPFEDSA-N	439.277	1.502	50	20	IDGD	
O=C(CCc1ccccn1)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1816008257	ZWWOITBZJZSELZ-HXUWFJFHSA-N	447.304	1.423	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCN2CCOCC2)n[nH]1	1817181993	LOWDTELNVXPMNK-GOEBONIOSA-N	427.933	1.378	50	20	IDGD	
Cc1ocnc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819403241	AOOHXLISRQGYJM-OAHLLOKOSA-N	438.448	1.324	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H]2CCCS2)[nH]n1	1819404426	KEIDTDYONKNHGU-JKSUJKDBSA-N	443.533	1.610	50	20	IDGD	
C=CC[C@H](C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1821920939	AEKJBFHPAUQHFB-GUYCJALGSA-N	425.493	1.926	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1	1822117000	FMRRJERNRSKNFP-CHWSQXEVSA-N	429.905	1.526	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1822182928	GJRXNGTUULOLLC-IAQYHMDHSA-N	449.114	1.179	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)CC[C@@H]2CCOC2)[nH]n1	1822417677	LJNKJXOOZLDKMD-WBVHZDCISA-N	434.541	1.592	50	20	IDGD	
O=C(c1cnc(OCF)cn1)N1CCC([C@H]2CCCCN2C(=O)[C@H](O)CCl)CC1	1824180403	HJNBSAXELAKNPV-HZPDHXFCSA-N	428.892	1.615	50	20	IDGD	
O=C(c1ccc2nc(CO)[nH]c2c1)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)CC1	1824182804	LEQNICCHJGEIHR-OALUTQOASA-N	448.951	1.888	50	20	IDGD	
O=C(c1nc2ccc(F)cn2n1)N1CCC([C@H]2CCCCN2C(=O)[C@@H](O)CCl)CC1	1824187993	MCOYQJISWBHNHA-CVEARBPZSA-N	437.903	1.701	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CN(CCO)CCO)CC1	1824619215	UUNFYJWROMAZEI-MOPGFXCFSA-N	432.005	1.300	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCC([C@H]2CCCCN2C(=O)CN2CC(=O)NC2=O)CC1	1824973491	STBPQMAQXMHMOS-AUUYWEPGSA-N	447.363	1.394	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)C[C@@H]2NC(=O)NC2=O)CC1	1825069815	ATNULYLPPYDEIR-HRCADAONSA-N	426.945	1.612	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCn1ccnn1)CC2	1825647626	RVUBSJHOAFTYOH-UWVGGRQHSA-N	427.328	1.520	50	20	IDGD	
Cc1ncccc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1	1825845332	QZZDYXNVUSRPLY-FQEVSTJZSA-N	429.565	1.996	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)CNC(=O)C(F)(F)F)sc2C1	1826144956	ZILIMYAPJZFWKX-JGVFFNPUSA-N	426.848	1.751	50	20	IDGD	
Cc1ncoc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1	1828925040	CCYWWPKEULRWQC-SFHVURJKSA-N	440.504	1.529	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1CCC(F)(F)C1)CCO2	1829653684	DWXVALHROPVXBB-CRAIPNDOSA-N	434.556	1.730	50	20	IDGD	
Cn1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)c(C(F)F)n1	1830357987	OADFXNFPIINNKJ-LJQANCHMSA-N	448.898	1.693	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccns3)C2)C1	1830535353	MXXKNLJNMQEIOU-WBMJQRKESA-N	432.340	1.244	50	20	IDGD	
CC[C@H](C)[C@H](O)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1	1831517005	LJWKFOZMVXVBEF-DFEHZGFQSA-N	425.353	1.086	50	20	IDGD	
Cc1cccnc1CCC(=O)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1832780790	BFFXXNOOFSYQAU-LJQANCHMSA-N	430.332	1.583	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)/C=C/c3ccco3)CCO2)C1	1833078569	JDUSIXQQOPMSLH-WWAPKCSDSA-N	431.316	1.986	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3n[nH]c4ccccc34)CC2)CC1)[C@H](O)CCl	1833309839	AYGGQRMGOPQOAY-GOSISDBHSA-N	433.940	1.348	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cn4ccccc4n3)CC2)CC1)[C@@H](O)CCl	1833310636	WDYBJONKPRNBPO-SFHVURJKSA-N	433.940	1.119	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cc(F)ccc3F)CC2)CC1)[C@@H](O)CCl	1833313261	CRFBJWHRUOIMNO-SFHVURJKSA-N	429.895	1.750	50	20	IDGD	
C[C@@H](CC(N)=O)C(=O)NC1CCN(C2CCN(C(=O)[C@H](C)CBr)CC2)CC1	1833518002	VRABNFDCJCYWPS-UONOGXRCSA-N	445.402	1.101	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(C)c(C)n3)CCO2)C1	1833694924	FDPMNXAHABQHPX-JXFKEZNVSA-N	425.913	1.022	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3csnc3C)CCO2)C1	1833749787	VWOFTSIHXNCCNN-WMLDXEAASA-N	446.367	1.695	50	20	IDGD	
Cn1c(C(=O)NC2CCN(C3CCN(C(=O)CO[Si](C)(C)C)CC3)CC2)cccc1=O	1834085809	UCQVNEBKRXGEHG-UHFFFAOYSA-N	448.640	1.422	50	20	IDGD	
Cc1nocc1C(=O)NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1	1834248430	MCGHLJYQMYFRJI-HNNXBMFYSA-N	431.306	1.859	50	20	IDGD	
O=C(CCBr)NC1CCN(C2CCN(C(=O)C3CCOCC3)CC2)CC1	1834421163	MHJVXOHGMCVONF-UHFFFAOYSA-N	430.387	1.770	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(C(C)C)on3)CCO2)C1	1834500208	GJTQXVJXQHXPCF-KUHUBIRLSA-N	429.901	1.122	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)C(=O)c1ccccc1)CCO2	1834705706	ZJZOKLYKPJUHPA-NRFANRHFSA-N	434.565	1.177	50	20	IDGD	
Cc1ccccc1OCC(=O)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1835155347	NXDHFBVHVOSZGK-LJQANCHMSA-N	431.316	1.634	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](F)Cl)CC2)CC1)c1nc(O)n2c1CCCC2	1835852178	DFLJVGNMMKBAKF-KRWDZBQOSA-N	441.935	1.645	50	20	IDGD	
CC(C)N(C)CC(=O)N1CCC(N2CCC(NC(=O)[C@H](F)Br)CC2)CC1	1836414622	USJQMMNDTPFWFM-KRWDZBQOSA-N	435.382	1.589	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC(OC2CCN(C(=O)[C@H]3C[C@@H](O)C3)CC2)CC1	1836673673	SYBGCKGHHALHPL-KFWWJZLASA-N	431.371	1.787	50	20	IDGD	
O=C(c1ccn2ccnc2c1)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836717529	XSFURCHYQSURMT-GOSISDBHSA-N	434.924	1.546	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)cnc1C	1837710066	GPZQDBQZZBFFOB-OAQYLSRUSA-N	435.597	1.620	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(Cl)ccn3)CCO2)C1	1837867373	OSIOPQMYRKHZMC-RDTXWAMCSA-N	432.304	1.059	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnn(C)c3Cl)CCO2)C1	1838305624	OCMYXAPHAXIBFN-KDOFPFPSSA-N	433.336	1.551	50	20	IDGD	
C=C(C(=O)N1CCC(OC2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1)C(F)(F)F	1838757292	PPCODXUYWDTNGL-UHFFFAOYSA-N	448.486	1.477	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnoc3C)C2)C1	1839963890	ZQOPAGXUYDMBJX-RHSMWYFYSA-N	430.299	1.227	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CC3(OC)CCC3)C2)C1	1839967583	QXHWKOKFJZIDCF-BEFAXECRSA-N	447.370	1.576	50	20	IDGD	
CC(C)[C@H]1CC[C@H](C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)CC1	1839974495	OLJVCIPNEFVNKJ-NTLWEQJWSA-N	430.973	1.505	50	20	IDGD	
Cc1ccsc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)Br)CCO2	1840031663	YXXCRFBUROJJPF-GUYCJALGSA-N	431.352	1.910	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)COc3ccccc3C)C2)C1	1840152157	ZJKQKQVRBPZZKR-UTKZUKDTSA-N	440.924	1.084	50	20	IDGD	
O=C(C1CCN(c2ccccc2)CC1)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843012991	XLHONFDDAOXEFU-UHFFFAOYSA-N	447.344	1.100	50	20	IDGD	
O=C(c1ccc(OC(F)F)cc1)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843014718	UAIUTYWPBIWQPV-UHFFFAOYSA-N	430.216	1.099	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(C(=O)N2CCCC23CN(C(=O)[C@@H](F)Br)C3)C1	1843842221	DTIYBMJAQBJBIF-GFCCVEGCSA-N	434.306	1.747	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H]2C[C@H](C(=O)N3CCCC34CN(C(=O)[C@H](F)Cl)C4)O[C@H]2C1	1846149271	KUBHLINDFVZXMY-KBXIAJHMSA-N	445.919	1.749	50	20	IDGD	
C[C@@H]1[C@@H](C(=O)N2CCCC23CN(C(=O)[C@@H](O)CCl)C3)CCN1C(=O)OC(C)(C)C	1847162111	ZQUBUSVONHKKHB-ILXRZTDVSA-N	429.945	1.435	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CC1CCN(C)CC1	1847334900	SPDGBLQRZRNGCK-XPVJKVDVSA-N	428.537	1.054	50	20	IDGD	
O=C(NNC(=O)c1ccc(S(=O)(=O)Nc2ccc(Cl)cc2)cc1)C(=O)NC1CC1	10214667	HAVLRGZPHFACPT-UHFFFAOYSA-N	436.877	1.180	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)c1ccc(S(=O)(=O)N2C[C@H](C)O[C@H](C)C2)cc1	15692589	VCBHMPSJQACACN-IYBDPMFKSA-N	431.514	1.868	50	20	IDGD	
COc1ccc(-c2nc(C)c(C(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)s2)cc1OC	16786324	ODZNXYIBNHFVSA-GFCCVEGCSA-N	439.515	1.331	50	20	IDGD	
O=C(C[C@H]1Sc2ccc(Cl)cc2NC1=O)NNC(=O)c1n[nH]c(=O)c2ccccc12	21039421	SRLOGYHYNWIEPK-CQSZACIVSA-N	443.872	1.841	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2c(C)oc3ncn(C)c(=O)c23)c2ccccc2c1=O	24400716	YWSPFASMXGPEBQ-UHFFFAOYSA-N	436.428	1.030	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Cc2c[nH]c3ccccc23)cc(OC)c1OCC(N)=O	24501720	XVCMPERGUQRFMJ-UHFFFAOYSA-N	426.429	1.053	50	20	IDGD	
Cc1nn(CC(C)C)c(C)c1CCC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	25416759	MNJKYWGQSMUKST-UHFFFAOYSA-N	449.577	1.800	50	20	IDGD	
C[C@H]1CCCC[C@]12NC(=O)N(CC(=O)NNC(=O)c1cc(-c3ccccc3)on1)C2=O	28792814	BTSWNCMCQWLISQ-ZSEKCTLFSA-N	425.445	1.603	50	20	IDGD	
NS(=O)(=O)c1ccc(CNC(=S)NNC(=O)COc2ccc(Cl)cc2)cc1	726437656	IGYNULGTDGGDNV-UHFFFAOYSA-N	428.923	1.062	50	20	IDGD	
CN(C[C@@H]1CCCN(CC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)C1)C(=O)OC(C)(C)C	727135537	ZYPBDIYZIGRRSY-HNNXBMFYSA-N	449.508	1.935	50	20	IDGD	
COC(=O)c1ccc(S(=O)(=O)NNC(=O)c2cc(OC)ccc2Br)s1	728508380	OQONPDNLSWHRQT-UHFFFAOYSA-N	449.304	1.929	50	20	IDGD	
Cc1cc(N2C[C@H](C(=O)NNC(=O)Cc3cccnc3)CC2=O)ccc1Br	728851010	HQOFQRLBKVTJAC-CQSZACIVSA-N	431.290	1.896	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Cn2ccc3ccccc32)cc1S(=O)(=O)N(C)C	729450227	PTGMHXNPVBZGOG-UHFFFAOYSA-N	430.486	1.361	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NCc2cccnc2N2CCC(C(N)=O)CC2)cc1	729611944	ZVMWSUKYECHESN-UHFFFAOYSA-N	440.504	1.001	50	20	IDGD	
C[C@@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)NNC(=O)c2cccc3ncccc23)C1=O	730227012	YGIDEFMOQCZXFJ-QFIPXVFZSA-N	435.415	1.602	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)c1c(F)ccc(S(=O)(=O)NC2CC2)c1F	731494337	YMPMGZUMNJSZMR-UHFFFAOYSA-N	425.413	1.489	50	20	IDGD	
CC(=O)N1CCCCC[C@@H]1C1CCN(CC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)CC1	731665840	GDDLOCUKMAKSKT-HXUWFJFHSA-N	445.520	1.859	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)N[C@H](Cc1ccccc1)CN1CCOCC1	732476683	SDAQKSGTZPQWCF-GOSISDBHSA-N	428.489	1.045	50	20	IDGD	
C=CCn1c(S)nc2cc(C(=O)NNc3nc4ccccc4c(=O)n3C)ccc2c1=O	733261730	JNACTOXIKQZEJM-UHFFFAOYSA-N	434.481	1.875	50	20	IDGD	
O=C(COc1ccc(OCc2ccccc2)cc1)NNC(=O)NCCN1C(=O)CCC1=O	733849256	YSRMZWGXSRMAAH-UHFFFAOYSA-N	440.456	1.124	50	20	IDGD	
CC(C)[C@H](CNC(=O)NNC(=O)c1nnc(O)c2ccccc12)NC(=O)OC(C)(C)C	734690434	TVAGEIFZNHUTIQ-AWEZNQCLSA-N	432.481	1.829	50	20	IDGD	
COc1ccnc(C(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)c1	734810010	QXPRYBNZZFKIJL-UHFFFAOYSA-N	429.436	1.923	50	20	IDGD	
COCCOc1ccc(-n2nc(C)c(C(=O)NNC(=O)Cc3ccccc3OC)n2)cc1	735002975	KTEOOOMANPLSIY-UHFFFAOYSA-N	439.472	1.613	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)c2cccc(NS(=O)(=O)c3ccc(F)c(F)c3)c2)cn1	735470439	ABCXMWOFOAPHEJ-UHFFFAOYSA-N	435.412	1.574	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)NC[C@H](c2ccc(Cl)cc2)N2CCOC(C)(C)C2)cn1	735514444	ZMWLLEUZXOOHGL-QGZVFWFLSA-N	434.928	1.870	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)N[C@H]2CCC[C@H](S(C)(=O)=O)C2)c1	741094278	YKFJVMFXUJUNLV-JQWIXIFHSA-N	448.339	1.758	50	20	IDGD	
CC(C)Cn1c(CCC(N)=O)nnc1SCC(=O)NNC(=O)c1cccc(Cl)c1	742814862	KRXRLVYVBFRSLL-UHFFFAOYSA-N	438.941	1.559	50	20	IDGD	
CCO[C@@H]1C[C@@H](NC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)C12CCCC2	743510358	VRPAWUSVDBYBRL-HUUCEWRRSA-N	437.566	1.970	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@H]1CCCC[C@@H]1NC(=O)NNC(=O)CNC(=O)c1ccco1	743578251	WULCXZLVLGOXBN-KGLIPLIRSA-N	437.497	1.423	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNC(=O)N[C@H]2CCCN(c3ccn(C)n3)C2=O)cc1	745884646	ZPJLSFITBIKGBV-SFHVURJKSA-N	442.520	1.985	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H]2CCC[C@@H](C(=O)OC)C2)c1	746093717	SOBZQWUBRFTBIF-GOEBONIOSA-N	439.534	1.458	50	20	IDGD	
O=C(CCc1ccccc1)NNC(=O)c1ccc(F)c(S(=O)(=O)Cc2ncon2)c1	746194362	SGMOHVTVJPCUGL-UHFFFAOYSA-N	432.433	1.576	50	20	IDGD	
COc1ccc([C@H]2[C@@H](C(=O)NNC(=O)Cc3cn4ccccc4n3)CCC(=O)N2C)cc1	746549600	BMQBNCXOYDBZHU-AVRDEDQJSA-N	435.484	1.643	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)NCCNS(=O)(=O)c3cccs3)cc2C1	746701191	FOKZYUHTXBJIKZ-NSHDSACASA-N	442.588	1.857	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)c2cc(Br)cc(S(N)(=O)=O)c2C)c(O)c1	747524157	XSUMDKFFOLZRJO-UHFFFAOYSA-N	442.291	1.494	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN1C(=O)c1ccc2c(c1)OCO2)c1nnc(O)c2ccccc12	749560095	FMGBUNPALJJNGG-HNNXBMFYSA-N	449.423	1.130	50	20	IDGD	
CCC1CCC2(CC1)NC(=O)N(CC(=O)NNC(=O)Cc1nc3ccccc3n1C)C2=O	752987375	UKLVFGBHBVLCNN-UHFFFAOYSA-N	440.504	1.154	50	20	IDGD	
N#Cc1ccc(CN2CC[C@@H](NC(=O)NNC(=O)c3cccc(OC(F)F)c3)C2=O)cc1	753131330	RRLUBHQTOUKPEZ-QGZVFWFLSA-N	443.410	1.905	50	20	IDGD	
O=C(COc1ccccc1Cc1ccccc1)NNC(=O)NC[C@H]1CCCCS1(=O)=O	753275563	VDVINPAWLJCECX-LJQANCHMSA-N	445.541	1.954	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)N(C)CCCC(=O)NNc2cc(Cl)nc(N)n2)cc1	753464107	KLNFCUWPWMHMFD-UHFFFAOYSA-N	440.913	1.459	50	20	IDGD	
COC(=O)c1c(Br)ccc(NC(=O)C(=O)NNC(=O)c2ncccc2C)c1C	753840615	KPSGQUVFYMXRRH-UHFFFAOYSA-N	449.261	1.647	50	20	IDGD	
COc1cc(CN2CC[C@@H](NC(=O)NNC(=O)COc3cccc(C)c3)C2)cc(OC)c1	755088343	XBYDZVPGEMVNFG-GOSISDBHSA-N	442.516	1.996	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)CC(C)(C)C)cc1S(=O)(=O)N1CCOCC1	755414159	SBAZUUTVVZQKIT-UHFFFAOYSA-N	428.511	1.305	50	20	IDGD	
CCN1CCN(c2ccc(Cl)cc2NC(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)CC1	755446852	RGZFKYLQMPDHER-ZDUSSCGKSA-N	443.957	1.069	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)co1	756012478	NEGCGOBKSTUZMJ-UHFFFAOYSA-N	427.382	1.238	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN(CCO)[C@H]2CCCc3ccccc32)cc1OC	756593979	JSHANCDZIWJBRP-IBGZPJMESA-N	427.501	1.837	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)Nc1cc(C2CC2)nn1[C@H]1CCS(=O)(=O)C1	756856391	OZBATIIXHCYBDN-HNNXBMFYSA-N	447.517	1.611	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)CCc2c(C)nc3c(C(N)=O)cnn3c2C)c(OC)c1	757180549	RXWAVEYKVFUFOR-UHFFFAOYSA-N	440.460	1.316	50	20	IDGD	
C[C@H]1C[C@H](C)CC2(C1)NC(=O)N(CC(=O)NNC(=O)c1cc(-c3ccccc3)[nH]n1)C2=O	757634537	UDCZFMMWVSRHBD-KBPBESRZSA-N	438.488	1.584	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)nn1-c1ccc(Cl)cc1Cl	758045103	BMINADWTRGMCDB-SECBINFHSA-N	434.305	1.186	50	20	IDGD	
O=C(COCc1ccccc1)NNS(=O)(=O)c1cc(Br)cc2c1OCC2	758149726	DATSBTKVFHRYFP-UHFFFAOYSA-N	441.303	1.910	50	20	IDGD	
CS(=O)(=O)N1CCc2c(NC(=O)NNC(=O)[C@H]3COc4ccccc4O3)cccc21	758296806	SVHFLGFCYBVXKK-QGZVFWFLSA-N	432.458	1.001	50	20	IDGD	
N#CCCn1cc(/C=C(\C#N)C(=O)NCCC(=O)NC(N)=O)c(-c2ccc(Cl)cc2)n1	758589422	RWGXQNSJJYJBNO-GXDHUFHOSA-N	439.863	1.725	50	20	IDGD	
COc1cc(Br)cc(S(=O)(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)c1	760512978	JXNYMAJWQMKZBF-UHFFFAOYSA-N	446.235	1.695	50	20	IDGD	
C[C@H](CC(=O)NNC(=O)c1cc2ccccc2o1)NS(=O)(=O)c1cccnc1Cl	760707184	PMBOUHKNVHWTNK-LLVKDONJSA-N	436.877	1.999	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)c2cccc(S(=O)(=O)NC[C@@H]3CCCO3)c2)nc1	760784388	DBXLOFNDWCEHAA-HNNXBMFYSA-N	434.474	1.082	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)Nc2ccc(CN3C(=O)CCCC3=O)cc2)cc1	760959997	RIQRIECWOHQHEG-UHFFFAOYSA-N	440.456	1.966	50	20	IDGD	
Cc1nn(CC(F)(F)F)cc1C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	763114467	OMJWLXMLTHBPRZ-UHFFFAOYSA-N	438.454	1.727	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(S(=O)(=O)CBr)CC2)c2cccnc12	763206948	YVZGCWPVXCLCHI-UHFFFAOYSA-N	448.364	1.532	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)cc2)C[C@H](C)O1	763445827	LJFOARNGXNPLCS-KBPBESRZSA-N	441.444	1.608	50	20	IDGD	
O=C(NNC(=O)c1ccccn1)C(=O)Nc1cc(Cl)ccc1C(=O)N1CCCCC1	763463529	LCIYOZSWHWSDBS-UHFFFAOYSA-N	429.864	1.761	50	20	IDGD	
Cc1ccc(N2CCOC2=O)cc1NC(=O)C(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	763470155	GZRJQXRWGBKLTD-UHFFFAOYSA-N	427.373	1.260	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2Br)cc1C	763483618	SSEGCZNNKBBGBO-UHFFFAOYSA-N	434.246	1.944	50	20	IDGD	
CC1(C)CN(C(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)c2cccc(Cl)c21	763570904	GUURWICCXHBKCI-MRXNPFEDSA-N	429.860	1.952	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)[nH]n1)C(=O)Nc1ccc(-n2cccn2)c(F)c1	763600220	FQGNEQJBHTUPOD-UHFFFAOYSA-N	433.403	1.801	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1cc(N2CCCC2=O)ccc1F	763629692	QWCXMKKUUMDMBM-UHFFFAOYSA-N	438.419	1.308	50	20	IDGD	
COc1cc(Br)cc(NC(=O)C(=O)NNC(=O)COc2ccccc2F)c1	763678301	CHURBRWELIJIJK-UHFFFAOYSA-N	440.225	1.762	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc2c(c1)OC(C)(C)O2	763684502	MQIWLXWFIOXMSP-UHFFFAOYSA-N	429.429	1.758	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)cc1S(C)(=O)=O	763728308	RKVAWRXFHGAADD-UHFFFAOYSA-N	433.530	1.701	50	20	IDGD	
O=C(CN1CCCc2ccccc21)NNC(=O)C(=O)Nc1ccc(SC(F)F)nc1	763745236	AZDHYLPHPJLGEW-UHFFFAOYSA-N	435.456	1.935	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)cc1	763840165	JBFPVMOHBJBPND-MRXNPFEDSA-N	429.473	1.882	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)ccc1N1CCOCC1	763856357	HKEJISOOTHEZCC-OAHLLOKOSA-N	444.463	1.524	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(-n3nccn3)cc2)cc1	763864390	CQSVZKJSDLPROF-AWEZNQCLSA-N	438.444	1.219	50	20	IDGD	
CC(=O)NCc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(C(C)=O)cc2)cc1	763877575	LOWORRXIASXOKM-AWEZNQCLSA-N	440.456	1.079	50	20	IDGD	
CCCOc1cc(F)ccc1NC(=O)C(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	763948394	JNYHEMBGUGJPCZ-UHFFFAOYSA-N	441.419	1.906	50	20	IDGD	
CCCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)on2)cc1	764003168	ASPWWTAUBUBMGJ-UHFFFAOYSA-N	435.440	1.881	50	20	IDGD	
C[C@H]1CN(Cc2ccccc2NC(=O)C(=O)NNC(=O)Cc2ccsc2)C[C@@H](C)O1	764034669	TYZPKTMSCUCTJV-GASCZTMLSA-N	430.530	1.686	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc(Cl)c(C(=O)NC2CC2)c1	764042083	AEEMVEDEUOCVKO-UHFFFAOYSA-N	430.848	1.641	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cccc(C(=O)N(C)C)c3)n[nH]2)cc1	764109920	DLNQQQLPDGMTHQ-UHFFFAOYSA-N	434.456	1.487	50	20	IDGD	
CSc1cc2c(cc1NC(=O)C(=O)NNC(=O)c1ccc(Cl)cc1O)OCCO2	764117022	MPKRDXVVEPMXID-UHFFFAOYSA-N	437.861	1.938	50	20	IDGD	
COCCOc1ccc(C#N)cc1NC(=O)C(=O)NNC(=O)c1ccc(Cl)cc1O	764127710	YQTZOWGOXRZETP-UHFFFAOYSA-N	432.820	1.342	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3CN2Cc2ccccc2)n(C)n1	764178540	DEPFLABIOUUQMW-FQEVSTJZSA-N	446.511	1.442	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cn(CC(F)(F)F)nc2C)cc1OC	764188018	ODXSIQXXBXKBHN-UHFFFAOYSA-N	444.366	1.389	50	20	IDGD	
C[C@@H]1CN(Cc2ccccc2NC(=O)C(=O)NNC(=O)c2cccc(C#N)c2)C[C@@H](C)O1	764241872	MYKNKMXPBZIBNO-HZPDHXFCSA-N	435.484	1.567	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)ccc1O)C(=O)Nc1ccc(-n2cccn2)cc1	764278486	SNFRTIISGSDOMI-UHFFFAOYSA-N	444.245	1.740	50	20	IDGD	
O=C(Cc1cc[nH]n1)NNC(=O)C(=O)Nc1ccccc1OCc1cccc(Cl)c1	764285391	DCMAUPXCVISOEC-UHFFFAOYSA-N	427.848	1.971	50	20	IDGD	
CC[C@H](Cc1cccc(Br)c1)C(=O)NNC(=O)CNC(=O)c1cccnc1	764344877	KLQFDPHZAWPITL-CQSZACIVSA-N	433.306	1.990	50	20	IDGD	
CCOC(=O)c1cc(Br)ccc1NC(=O)C(=O)NNC(=O)Cc1ccncc1	764356266	SJOGFDQYQUCEOH-UHFFFAOYSA-N	449.261	1.349	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)C(=O)Nc2cc(Br)ccc2N2CCCC2)cn1	764357834	CHRSIIBMTAIIKQ-UHFFFAOYSA-N	435.282	1.183	50	20	IDGD	
CC(=O)NCc1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)cc1	764388288	QMZFTYPFLZFONA-UHFFFAOYSA-N	438.419	1.252	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(C(=O)N2CCC[C@H](C)C2)cc1C	764398607	HNEDDMAOWKXKEI-GOEBONIOSA-N	448.520	1.005	50	20	IDGD	
CS(=O)(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2F)c1	764411856	AJVABESZUABSHY-UHFFFAOYSA-N	427.841	1.423	50	20	IDGD	
COc1nccnc1NNC(=O)C1CCN(S(=O)(=O)c2c(C)cc(C)cc2C)CC1	764471181	OWXDOTWQGMGSSI-UHFFFAOYSA-N	433.534	1.954	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)C(C)(C)Oc2ccc(C#N)cc2)c1	764527454	FSAYUUQFZPTZOE-UHFFFAOYSA-N	430.486	1.427	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNS(=O)(=O)c1cccs1	765118343	AZIXVLYLMXPZMJ-UHFFFAOYSA-N	428.967	1.529	50	20	IDGD	
COc1cccc([C@H](O)C(=O)NNC(=O)c2cc(-c3ccc(OC)c(OC)c3)[nH]n2)c1	765228420	GLOKKCHSLOAQIS-IBGZPJMESA-N	426.429	1.597	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNC(=O)Nc2nc(CS(C)(=O)=O)no2)cc1	765253026	AAFKHVSVCBIFKP-UHFFFAOYSA-N	425.467	1.506	50	20	IDGD	
CNC(=O)COc1ccc(C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)cc1OC	765618686	FMWWKAFSLJYCPC-UHFFFAOYSA-N	441.419	1.424	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)CCC(=O)Nc1ccc2nc(O)[nH]c2n1	767162304	XLTUXHNRDWCPQM-SNVBAGLBSA-N	430.396	1.136	50	20	IDGD	
COCCC(=O)N1CCC(NC(=O)NNC(=O)c2ccc(OC(C)C)c(OC)c2)CC1	767959581	DOAXCSPBDNISBV-UHFFFAOYSA-N	436.509	1.454	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)Sc1nnc(-c2cnccn2)n1-c1ccc(OC)cc1	768412487	XSRLKYGUYTZZGU-GFCCVEGCSA-N	427.490	1.771	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)c2n[nH]c(C3CC3)c2Br)cc1	768630560	PDZWZYJIOCZNEG-UHFFFAOYSA-N	432.234	1.539	50	20	IDGD	
CC(C)(C)OC(=O)N1CCc2ccccc2[C@@H]1C(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1	769077641	LHTMGORCLOWPQU-GDBMZVCRSA-N	437.518	1.103	50	20	IDGD	
Cc1noc(C)c1S(=O)(=O)NCC(=O)NNC(=O)[C@H](C)Oc1ccc2ccccc2c1	769104921	JWYOUIDTWCVVSI-AWEZNQCLSA-N	446.485	1.338	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)N[C@H]2CCO[C@@]3(CCSC3)C2)nc1	769235046	CULFKFISEZUYDO-KSSFIOAISA-N	443.595	1.793	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)NCCS(=O)(=O)c3ccccc3)nc21	770355114	JPZJTYVMKIVNPP-UHFFFAOYSA-N	433.494	1.387	50	20	IDGD	
CNS(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)cc1	770484055	JOEKVGADYZAFLP-LLVKDONJSA-N	426.882	1.868	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)cc1OC	770485316	PNTMOJGCFGZMLP-LLVKDONJSA-N	436.852	1.800	50	20	IDGD	
COC1(C(=O)O[C@H](C)C(=O)NNC(=O)CC(C)C)CCN(C(=O)OC(C)(C)C)CC1	772038840	VHOGWVUMLNCVKX-CQSZACIVSA-N	429.514	1.528	50	20	IDGD	
Cc1cc(C(=O)NCC(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)ccc1[N+](=O)[O-]	772967880	BZTJRBGZKRPDFU-GFCCVEGCSA-N	434.836	1.901	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2cccc(C#N)c2)cc1S(=O)(=O)NC1CC1	773683249	TXUTWJXRIBLSLR-UHFFFAOYSA-N	429.458	1.089	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2ccc(NC(=O)CN3CCCCCC3)cc2)n1	773723643	CKPGXNNBMQCAEL-UHFFFAOYSA-N	441.492	1.382	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccccc1S(C)(=O)=O	774008621	JRZPFMQIQIYFKA-LLVKDONJSA-N	439.877	1.297	50	20	IDGD	
COC(=O)c1cn(CCOC(=O)/C(C#N)=C/c2cc(C)n(C[C@H]3CCCO3)c2C)nn1	774595115	VAEZCBAUJOSFET-WAFWZSCLSA-N	427.461	1.812	50	20	IDGD	
Cc1cc(N2CCC[C@H](NC(=O)NNC(=O)COc3ccccc3[N+](=O)[O-])C2)n(C)n1	775151234	ZCUCBWGZPCKIGY-AWEZNQCLSA-N	431.453	1.015	50	20	IDGD	
O=C(NCc1nc(C(F)(F)F)n[nH]1)NNC(=O)c1cc(F)ccc1Br	776253591	LJIJJCZVRPINRB-UHFFFAOYSA-N	425.140	1.869	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)NC2CCN(S(=O)(=O)CC(C)C)CC2)c1	777765437	QTLZOQYSJOKBMC-UHFFFAOYSA-N	442.538	1.098	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(C(F)(F)F)cc1F)C1CCN(c2ncccn2)CC1	780386731	HQYRHBKOTICUIR-UHFFFAOYSA-N	447.414	1.861	50	20	IDGD	
COCC[C@H](NC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)c1ccco1	780883862	XKOZAZHZKAVINN-IBGZPJMESA-N	429.521	1.900	50	20	IDGD	
CS(=O)(=O)Cc1ccc(NC(=O)C(=O)NNc2ccc(Cl)cc2[N+](=O)[O-])cc1	783291286	LDWCXULANONONM-UHFFFAOYSA-N	426.838	1.875	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CNC(=O)c2cccs2)cc1-c1ncco1	784003868	QRPMZSVLCSSARC-UHFFFAOYSA-N	427.442	1.227	50	20	IDGD	
NC(=O)c1n[nH]c2ccc(NC(=O)C(=O)NNc3ccc(OCC(F)(F)F)cc3)cc12	784370286	KVXHEIYBULVION-UHFFFAOYSA-N	436.350	1.685	50	20	IDGD	
CC(C)C[C@H](C(=O)OCC(=O)NNC(=O)c1cccs1)N1C(=O)[C@@H]2CC=CC[C@H]2C1=O	784474085	FGCJYQTZHKVNLK-RBSFLKMASA-N	447.513	1.418	50	20	IDGD	
CCCOC(=O)c1cc(Br)ccc1NC(=O)C(=O)NN(C)C(=O)NCC	784917748	UFRPQICGDAMRMM-UHFFFAOYSA-N	429.271	1.647	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2cccc(-c3nnnn3C3CC3)c2)n1	785226445	UPVIXJZPPWQWRU-UHFFFAOYSA-N	436.480	1.393	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2ccc(Cl)nc2C)cc1	788804591	NTKRFUOMPYHLSM-UHFFFAOYSA-N	425.898	1.825	50	20	IDGD	
COc1ccc(C(=O)CCCCCC(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)cc1	789173189	SWIFTXVJFYPFQN-HNNXBMFYSA-N	425.507	1.346	50	20	IDGD	
Cc1cc(-n2cccn2)ccc1NC(=O)C(=O)NNC(=O)COc1ccc(Cl)cc1	789586838	QTPSXRYWVPGKPU-UHFFFAOYSA-N	427.848	1.999	50	20	IDGD	
CC(C)(C)Cc1csc(NC(=O)C(=O)NNC(=O)c2nnc(O)c3ccccc23)n1	789732011	KLLGZYFZTHZXLJ-UHFFFAOYSA-N	428.474	1.780	50	20	IDGD	
O=C(NNC(=O)[C@H]1OCC[C@H]1c1ccccc1)C(=O)Nc1ccc(N2CCOCC2)cc1	789812740	NNUIZWPHWOHUDU-PMACEKPBSA-N	438.484	1.182	50	20	IDGD	
N#Cc1ccc(N2C(=O)N[C@H](CCC(=O)NNc3cccc(F)c3[N+](=O)[O-])C2=O)cc1	791076652	RQJYBWLHBOXEMH-OAHLLOKOSA-N	426.364	1.954	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1cccc(Br)n1	793021398	DKWCHXVJCGCPRE-SECBINFHSA-N	425.214	1.537	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)Nc1cccc(Br)n1	793021795	JWZKEFHCVAUDPU-UHFFFAOYSA-N	445.071	1.345	50	20	IDGD	
Cn1ccc2ccc(NC(=O)C(=O)NNC(=O)c3cc4ccccc4cc3O)cc2c1=O	793024130	ZYQMVOLOBGARRD-UHFFFAOYSA-N	430.420	1.797	50	20	IDGD	
CCC[C@@](C)(CC)C(=O)NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1	793673105	CXXOBAJTICUTCU-OAQYLSRUSA-N	438.594	1.665	50	20	IDGD	
C=CCNS(=O)(=O)c1ccc(C(=O)NNc2ccccc2S(=O)(=O)N(C)C)cc1	795168684	BTDFXKCNORIINK-UHFFFAOYSA-N	438.531	1.158	50	20	IDGD	
O=C(NNS(=O)(=O)C[C@@H]1CCCOC1)[C@H]1Cc2ccccc2CN1Cc1ccccc1	795305313	MBFDIWGZQOSSRR-DENIHFKCSA-N	443.569	1.991	50	20	IDGD	
COC(=O)c1cc(F)cc(NC(=O)C(=O)NNC(=O)c2ccc(OC)c(OC)c2)c1F	796992689	VSGQGXFVQZKHNE-UHFFFAOYSA-N	437.355	1.168	50	20	IDGD	
O=C(NNc1c(F)cccc1Cl)C(=O)Nc1cc(S(=O)(=O)N2CCCC2)ccn1	797018407	YKBHAKNKCBUCLB-UHFFFAOYSA-N	441.872	1.740	50	20	IDGD	
COC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2cccc(C)n2)c1Br	797371520	WTOMQNUKQQGNFS-UHFFFAOYSA-N	435.234	1.339	50	20	IDGD	
Cc1ccc([C@H](NCC(=O)NNC(=O)c2cccc(C#N)c2)[C@@H](C)S(C)(=O)=O)cc1	797997551	NAPKIRFEPSBBTG-FOIQADDNSA-N	428.514	1.392	50	20	IDGD	
C=C(C)[C@@H]1OCC[C@H]1CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	798117294	WXRGZZAHALYRIL-WMZOPIPTSA-N	436.534	1.396	50	20	IDGD	
CNC(=O)CNC(=O)c1cccc(NC(=O)NNC(=O)CSc2ccc(Cl)cc2)c1	800596353	WORVFEQJBFUMTB-UHFFFAOYSA-N	449.920	1.761	50	20	IDGD	
COc1cc(OC)cc(N2C[C@H](C(=O)NNC(=O)C(=O)Nc3ccc(C)cc3)CC2=O)c1	801110598	DKCDCLXCAMKMLB-CQSZACIVSA-N	440.456	1.151	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)[C@@H]2CC(=O)N(CC(F)(F)F)C2)c(OC)cc1Cl	802084389	UTXSAGKGQZLEED-MRVPVSSYSA-N	438.790	1.921	50	20	IDGD	
O=C(NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)Nc1cc2ccccn2n1	806649546	DPLFXYREGMQEEV-UHFFFAOYSA-N	428.474	1.585	50	20	IDGD	
COCCNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)Cc2ccc(Cl)cc2)c1	806976018	ZIMSJXRZHZWCSQ-UHFFFAOYSA-N	432.864	1.045	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)C(=O)Nc1ncc(C(F)(F)F)s1	812985296	PHVVLDVVFLSGNS-UHFFFAOYSA-N	449.436	1.684	50	20	IDGD	
COC(=O)c1cccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)c1C	813033083	DUDXACYSMROLOQ-UHFFFAOYSA-N	434.474	1.114	50	20	IDGD	
CCn1cnc2c1c(=O)n(CC(=O)NN=C1CCC[C@@H](C#N)C1)c(=O)n2Cc1ccccc1	814745932	KRVWQYOSOKHTAE-QGZVFWFLSA-N	447.499	1.614	50	20	IDGD	
N#C[C@H]1CCCC(=NNC(=O)[C@H](CC(=O)NN=C2CCC[C@@H](C#N)C2)N2CCOCC2)C1	814854997	COSKCZKSQYOZEC-UWVAXJGDSA-N	441.536	1.449	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)cc1)[C@@H]1C[C@@H]1C	815565939	FINJGSSHDWENKK-ORAYPTAESA-N	442.447	1.752	50	20	IDGD	
Cn1c(=NNC(=O)c2cccc(S(=O)(=O)NC[C@H]3CCCO3)c2)sc2ccccc21	848949200	NFLPDSVMLWWJMK-OAHLLOKOSA-N	446.554	1.943	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)c2ccc(C)c(NS(C)(=O)=O)c2)cc1	906471295	RUVXHXUFTLLMEA-AWEZNQCLSA-N	435.502	1.994	50	20	IDGD	
CCCCc1ccc(N2C[C@H](C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)CC2=O)cc1	914405963	DQIOOXMJEIINKQ-GOSISDBHSA-N	447.499	1.819	50	20	IDGD	
CN(C)N(C(=O)Cc1csc(NC(=O)c2ccccc2F)n1)[C@H]1CCS(=O)(=O)C1	915828411	JCTGJFXWPUZWJK-ZDUSSCGKSA-N	440.522	1.569	50	20	IDGD	
COc1ccc(NCC(=O)NN=Cc2c(C)nn([C@H]3CCS(=O)(=O)C3)c2Cl)cc1	915916273	CLZAUWMYWFUZCB-AWEZNQCLSA-N	439.925	1.775	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)c1ccc(CNC(=O)c2cccs2)cc1	916144474	ANVYMJXBWDSVMP-UHFFFAOYSA-N	447.480	1.729	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2ccc3c(=O)n4c(nc3c2)CCCCC4)C[C@@H](C)O1	917363127	SQSFSPWXOPQWHC-IYBDPMFKSA-N	441.532	1.383	50	20	IDGD	
COc1cc(C)c(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1C	917719279	CZPXMLSFDDKXPP-UHFFFAOYSA-N	441.531	1.186	50	20	IDGD	
COc1cc(C)c(S(=O)(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)cc1C	917723686	JBFGTJKTBGJBKM-UHFFFAOYSA-N	440.547	1.537	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCCC3)cc2)c(O)c1	918337579	PYZSZBFXTHFSJN-UHFFFAOYSA-N	431.514	1.879	50	20	IDGD	
C[C@@]12CCC(=O)N1c1ccccc1C(=O)N2CC(=O)NNC(=O)c1ccc(Cl)cc1O	918359200	POYRMGKJQXUHEU-NRFANRHFSA-N	442.859	1.806	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)c1c[nH]n2c1nc(=O)c1ccccc12	919689450	QBVYXVPDZREALH-UHFFFAOYSA-N	429.440	1.549	50	20	IDGD	
Cc1nn(Cc2ccccc2Cl)c(C)c1C(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1	919886547	XMPYMMDBEPHQIH-AWEZNQCLSA-N	439.925	1.333	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)CN1C(=O)c2cc(Cl)c(Cl)cc2C1=O	920006728	QUBWKFLCZMAHHY-UHFFFAOYSA-N	436.251	1.988	50	20	IDGD	
NC(=O)c1ccc(/C=C/C(=O)N2CCC[C@H]2C(=O)NNC(=O)c2ccc(Cl)cc2)cc1	920020400	UZQNFVLXXNNQRU-VRQAPCGNSA-N	440.887	1.904	50	20	IDGD	
CCNC(=O)NNC(=O)c1cccc(NC(=O)C[C@H]2SC(N3CCCCC3)=NC2=O)c1	920858516	AISBBLOGZWNVDK-OAHLLOKOSA-N	446.533	1.463	50	20	IDGD	
Cc1cc(N2CCN(C)CC2)ccc1NC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	920934895	HTNHBEGYTZVHNX-UHFFFAOYSA-N	445.545	1.617	50	20	IDGD	
CCNS(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)c2ccc(Br)cc2)c1	1115865459	PIJQTQPRDBEBOM-UHFFFAOYSA-N	444.282	1.961	50	20	IDGD	
O=C(CCO)NNC(=O)Nc1ccc(S(=O)(=O)c2ccc(Br)cc2)cc1	1116611197	WDFPKPLKRIMFMV-UHFFFAOYSA-N	442.291	1.817	50	20	IDGD	
CN(C)C(=O)CS(=O)(=O)c1ccc(C(=O)NNc2ccc3c(=O)[nH]ccc3c2)cc1	1257500284	DFXWDRHEYQXMGW-UHFFFAOYSA-N	428.470	1.147	50	20	IDGD	
COCc1oncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](Cl)COC)C2	1778344244	DRNLQXQUTCEZRK-IDHHARJASA-N	429.901	1.202	50	20	IDGD	
O=C(c1n[nH]c2cc(Cl)ccc12)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1778659905	JRSKWWUPFHZSDM-KBXCAEBGSA-N	427.288	1.260	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3nnc(-c4ccccc4)o3)C2)C1	1779113697	AXHIHSRBZRUKRJ-YWZLYKJASA-N	434.880	1.434	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCN1CCOCC1)C2	1779543767	PIOCOKJRHBRQAL-WIYYLYMNSA-N	441.645	1.074	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc3cccnn3n1)C2	1779545472	PSHJSLBTGMCQIZ-WIYYLYMNSA-N	445.596	1.708	50	20	IDGD	
Cn1ccc(=O)cc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CO[Si](C)(C)C)C2	1780057523	UWUIXZHJXQAUSL-WIYYLYMNSA-N	435.597	1.364	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4c(c3)NC(=O)[C@H](C)O4)C2)C1	1780179596	SGKZVMISCCJRBH-XLDJFRKUSA-N	435.908	1.867	50	20	IDGD	
O=C(c1ccc([N+](=O)[O-])c2c1OCO2)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Cl)CCO2	1780235073	NFLRPMPXMLIWAL-PBHICJAKSA-N	429.788	1.301	50	20	IDGD	
O=C(c1cc(Br)ccc1O)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1780556685	NPXVPNLKNKFOFH-RHSMWYFYSA-N	447.713	1.198	50	20	IDGD	
CCCc1ccc(C(=O)N2CC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)cc1	1780844588	LHVBSJSYTXPUPH-XMMPIXPASA-N	436.317	1.076	50	20	IDGD	
CC(=O)N[C@@H](C(=O)N1CC[C@]2(CN(C(=O)[C@H](F)Cl)CCO2)C1)c1ccc(F)cc1	1780914847	POZZXJHNLGDKHR-JTDSTZFVSA-N	429.851	1.367	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3nc4cc([N+](=O)[O-])ccc4[nH]3)CCO2)C1	1781220345	YRLLRZBOUFTMEO-ORAYPTAESA-N	435.868	1.932	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)c3nc4ccccn4n3)CCO2)C1	1781227452	MBZZRTXKTMXFFG-QZTJIDSGSA-N	426.304	1.409	50	20	IDGD	
CO[C@H](C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1)c1ccccc1	1781328588	TVXHLHHTTUHZTN-HDMKZQKVSA-N	429.286	1.895	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc3ccnn3c2)C1	1781350441	MKPRPUXVACLGLU-DBXWQHBBSA-N	434.924	1.716	50	20	IDGD	
CCOc1cccc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](Cl)COC)CCO3)c1O	1781982290	KFMHUCGLRUGREV-QRWLVFNGSA-N	426.897	1.488	50	20	IDGD	
O=C([C@H](O)CCl)N1CCO[C@]2(CCN(C(=O)[C@@H]3CCc4cccc(Cl)c43)C2)C1	1782852635	FBKOYUICQICUQM-KKVAFCGZSA-N	427.328	1.799	50	20	IDGD	
CNCCCC(=O)N1CCO[C@@]2(CCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1	1782863874	BGJSVTWHGICAJZ-BVZCLVNKSA-N	432.471	1.701	50	20	IDGD	
COCCn1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)C(C)(C)CCl)[C@H]3C2)n1	1783850221	RKZRGEMHKQGXKA-ZOBUZTSGSA-N	426.945	1.388	50	20	IDGD	
O=C1COc2ccc(C(=O)N3CCO[C@]4(CCN(C(=O)C(Cl)Cl)C4)C3)cc2N1	1783946805	TUELTSANEQFXLI-SFHVURJKSA-N	428.272	1.265	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3cnc4ccccn34)[C@H]2C1	1784049840	UQKUSULDMUURSL-OHFALNGGSA-N	449.349	1.640	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C[C@H]3OCCc4ccccc43)C[C@@H]21)[C@@H](O)CCl	1784085839	PQCANAROVOJUOT-XCZFOBESSA-N	436.936	1.270	50	20	IDGD	
C[C@H](Oc1cccnc1)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1784549165	YTEBPGGOCZLKLD-RVSPLBMKSA-N	430.274	1.369	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccnc(Br)c3)C[C@@H]21)[C@H](F)Cl	1787446910	ZDBRYLJLQOEFOA-MNXVOIDGSA-N	434.693	1.972	50	20	IDGD	
Cc1cc(CC(=O)NC2(c3ccc(NC(=O)c4ccc(B(O)O)cc4)cc3)CCC2)on1	1788140016	CIEKIVGAOUETIS-UHFFFAOYSA-N	433.273	1.653	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)COC(=O)C(F)(F)F)[C@H]2C1	1788528914	FNNKVBYNCOCRNQ-RVMXOQNASA-N	428.835	1.479	50	20	IDGD	
O=C(C/N=C/c1ccco1)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21	1788677004	HSYTXPHHZRBMNL-CPXQMSAISA-N	426.311	1.463	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(SC)c3O)[C@H]2C1	1789247393	OVXVLKGKAVOYKD-TUUVXOQKSA-N	442.965	1.961	50	20	IDGD	
Cc1nc(N)sc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]2C1	1789866604	UXYMDLWGOBZAMN-UWCDFFNFSA-N	435.377	1.863	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(O)cn3)C[C@@H]21	1790960983	HBVDQXUAWRVVFC-ZIEJDFEHSA-N	426.311	1.554	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnoc3C3CC3)C[C@@H]21	1791058310	WADRUJYZPGONBF-WCUVEOEZSA-N	426.311	1.929	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4occc4c3)C[C@@H]21	1791291454	VRLIWRNZGFRPHP-BJLQDIEVSA-N	442.516	1.399	50	20	IDGD	
CCOC(=O)N[C@H](O)C(=O)NC1(c2ccc(NC(=O)[C@@H](Cl)COC)cc2)CCC1	1791568846	KAPYRVLMVWJXCX-GOEBONIOSA-N	427.885	1.439	50	20	IDGD	
O=C(CCc1cnccn1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21	1791660565	URQQQISKXYAYFQ-PCBIJLKTSA-N	429.290	1.079	50	20	IDGD	
Cc1cc(CC(=O)Nc2ccc(C3(NC(=O)c4cccc(B(O)O)c4)CCC3)cc2)no1	1791805932	FSXKJHKFVUAMAA-UHFFFAOYSA-N	433.273	1.653	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(=O)c2ccccc2o1	1792766248	WDHUGAQCKMFRNG-ZIVKBKJYSA-N	449.301	1.780	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccnc1OC	1794728749	GWVZYENMLVYRBM-AYRXBEOTSA-N	426.311	1.467	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccc(F)cn1	1795797912	SVVUXZQHBPEVJX-RBNVPPIJSA-N	428.302	1.526	50	20	IDGD	
C[C@@H](Cc1ccc(F)cc1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1	1796190371	RXZUKHDBTIAXMA-RWXMBLCBSA-N	438.308	1.636	50	20	IDGD	
COc1cc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Cl)cc(OC)c1OC	1796364047	COZGCLMOVVPADC-JBYDNAENSA-N	444.887	1.379	50	20	IDGD	
C=CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Cl	1796365375	WIORLJIJJMBKGG-AIEDFZFUSA-N	433.908	1.580	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Cl	1796371440	YQEHHGAOKKUWRC-UKJYWXTOSA-N	427.810	1.996	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1ccc2nonc2c1	1796885033	SMNAHSYOMUUGJY-RDBQEKCUSA-N	427.230	1.117	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1CN(C(=O)OC(C)(C)C)C1	1797716047	KESYTJHOMNRSQU-FZKCQIBNSA-N	429.945	1.745	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1coc([Si](C)(C)C)c1	1797726163	BDCGWODTJQOALF-HGKCTWBKSA-N	438.673	1.880	50	20	IDGD	
Cc1cc(/C=C/C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)CBr)C3)no1	1797831140	HJXXMYFXVDOBGI-OTDOOETQSA-N	426.311	1.617	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3sc(N)nc3c1)C2	1797954889	PLXLGNFKJFOCJQ-ZSBFGKGUSA-N	448.621	1.933	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnc3ccccc3n1)C2	1798440405	MUNSXMMVCRODID-QDMKHBRRSA-N	445.483	1.194	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc3cnccc13)C2	1798440633	UNOQORPAWOHJDQ-BJWYYQGGSA-N	444.495	1.799	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnc(O)[nH]1	1798861723	NOIHXAUHRJNNPG-RNJOBUHISA-N	441.916	1.499	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c(n1)OCCO3)C2	1799274943	FEZOEZFBCHVHQR-RHQBZFHZSA-N	444.315	1.292	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(C)nc1O	1799371992	OMPVWGCGDXGRHZ-MVRRYPJTSA-N	438.488	1.481	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(F)c1[N+](=O)[O-]	1799634371	BIZVWCMEXDJXKS-WJNVRWDZSA-N	429.832	1.191	50	20	IDGD	
C[C@@H](Oc1cccnc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2	1801403927	GWSGYWYIAFCNOI-AMVBZWJASA-N	430.274	1.129	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](O)CCl)C3)C1	1804249188	DNVVLCKTUJLUBN-FZKCQIBNSA-N	429.945	1.481	50	20	IDGD	
COc1nccnc1C(=O)N1CC[C@H](CNC(=O)CCBr)[C@H]1c1cccnc1	1806339449	LZLIUMUPUBZPEO-RHSMWYFYSA-N	448.321	1.985	50	20	IDGD	
Cc1ccc(CCC(=O)N2CCCC3(CCN(C(=O)CCC(=O)NN(C)C)CC3)C2)nc1	1807059998	UIAHIUSHQZQULS-UHFFFAOYSA-N	443.592	1.927	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@H]1CCN(C(=O)CSC(=N)N)[C@H]1c1cccnc1	1808297381	ZDGWRRJUUABPAE-IFIJOSMWSA-N	432.377	1.950	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)c1c[nH]c2ncccc12	1809120814	XYXNIYCJUPGEGA-JCGIZDLHSA-N	427.892	1.877	50	20	IDGD	
C[C@@H]1CCC[C@@H]1C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1809662022	AWOJWBNGKDVTCY-PGVBMLAISA-N	429.565	1.897	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2cnc(N(C)C)o2)[C@H]1c1cccnc1	1813029508	ODVCXTRRGFPNOQ-VYDXJSESSA-N	435.912	1.709	50	20	IDGD	
CC(C)C1(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)CCC1	1813664589	JRRCAXITLGJPTD-IFMALSPDSA-N	449.360	1.907	50	20	IDGD	
CCC[C@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1815318306	SCENXCCZYGJLNT-RDJZCZTQSA-N	432.717	1.803	50	20	IDGD	
O=C(/C=C/c1cccnc1)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1	1815337232	PHEIKCVQXNSZBE-DFIVBLOKSA-N	448.313	1.157	50	20	IDGD	
CCC1(C(=O)N[C@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)CCC1	1815344364	VRNUJFFQHUKCSG-HNNXBMFYSA-N	427.335	1.629	50	20	IDGD	
Cc1nc2ncccn2c1C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1	1818667983	UBHVQNHEMNLRFI-KGLIPLIRSA-N	431.884	1.666	50	20	IDGD	
Cc1cc(C(=O)NCC(=O)Nc2cc([C@@H]3CCCCN3C(=O)[C@@H](F)Cl)[nH]n2)no1	1819466900	IAZSLTWSSSEVBR-SWLSCSKDSA-N	426.836	1.663	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](OC(C)=O)C(C)C)sc2C1	1819490280	WRMCAAWXNVSMEE-TYNCELHUSA-N	431.942	1.897	50	20	IDGD	
C=CC(=O)N[C@@H](C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCBr)[nH]n1	1819578787	LCBNAXJATDKEOP-WCQYABFASA-N	426.315	1.878	50	20	IDGD	
COC[C@H](NC(C)=O)C(=O)N[C@H]1CCc2nc(NC(=O)CO[Si](C)(C)C)sc2C1	1820165589	KNOXNEMDAFXRBB-JSGCOSHPSA-N	442.614	1.058	50	20	IDGD	
O=C(O)CSCC(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](F)Br)n[nH]1	1820936420	BZVKQWFGQLUEOP-TVQRCGJNSA-N	437.291	1.910	50	20	IDGD	
CCS(=O)(=O)CC(=O)N[C@H]1CCc2nc(NC(=O)[C@](C)(Cl)CCl)sc2C1	1822861122	WGOKOWMCTMFRAF-BJOHPYRUSA-N	442.390	1.726	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1c(O)cc(O)cc1O)CC2	1826007151	RZTJULLFMYKSAP-SCZZXKLOSA-N	441.893	1.740	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)CC2CCOCC2)CC1	1826733085	SSIGAVBLXMMNHF-JOCHJYFZSA-N	442.365	1.416	50	20	IDGD	
N=C1NCCN1CC(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H](F)Br)CC1	1826874368	NAEHVFUIEDZYHD-DZGCQCFKSA-N	432.338	1.137	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(Cl)nc1)CCO2	1829508297	LKARCJIQSLXZAS-LJQANCHMSA-N	441.988	1.657	50	20	IDGD	
C[C@@H](Oc1ccccn1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830370509	SHUQILIUXXXBDW-IERDGZPVSA-N	439.940	1.570	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3CCC(CO)CC3)C2)C1	1831641188	WPUNEJAWJHSXMS-YMPMHWPESA-N	430.973	1.649	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)C[C@@](C)(O)CC(=O)O)CC1	1831835154	OZOKUTHGYZBTFN-RZQQEMMASA-N	432.945	1.476	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)/C=C/c3ccco3)CCO2)C1	1833078127	JADDCTLUOLRTGC-FOSBAXRVSA-N	441.322	1.923	50	20	IDGD	
C[C@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](O)C(C)(C)C)CC2)CC1	1833264498	DCTHNMXBRMQTJP-RHSMWYFYSA-N	446.430	1.996	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cccn4ccnc34)CC2)CC1)[C@@H](O)CCl	1833310725	ZAIQAZGEDMFGOW-SFHVURJKSA-N	433.940	1.119	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)CCc3ccccn3)CC2)CC1	1833887188	KYMSGNVJHJTUOE-FQEVSTJZSA-N	436.984	1.840	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccn3C)CCO2)C1	1833911729	HUNIJAGLAUPUFK-RDTXWAMCSA-N	428.327	1.269	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC(N2CCC(NC(=O)c3cccc(O)n3)CC2)CC1	1834198750	BXOXGHUYYQEUSZ-UHFFFAOYSA-N	434.613	1.824	50	20	IDGD	
Cc1oncc1C(=O)NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1	1834240040	WZHJLBLHGRKEDX-UHFFFAOYSA-N	427.343	1.953	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)c1n[nH]c2c1CCCC2	1835001280	YQHDXVCHSBQUAW-GOSISDBHSA-N	437.972	1.073	50	20	IDGD	
Cc1nnsc1C(=O)NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1835182831	WVHKZXSWLDKLTL-CQSZACIVSA-N	448.362	1.722	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cn4ncccc4n3)CC2)CC1	1835394777	WUSJCNNLDBAMFZ-QGZVFWFLSA-N	448.955	1.168	50	20	IDGD	
CNc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](Cl)COC)C3)C2)cc1	1835610083	IOFFILIXTZTKFX-XLIONFOSSA-N	425.913	1.052	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3nccc4occc34)CCO2)C1	1836295362	JANLLKVWNYUHAX-QRWLVFNGSA-N	437.880	1.152	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836718740	CDBZIFSEKDXZTG-GJZGRUSLSA-N	439.778	1.758	50	20	IDGD	
O=C([C@@H](O)CCl)N1CCC(OC2CCN(C(=O)C(Cl)(Cl)Cl)CC2)CC1	1836719590	ZTYIBDASMBCKNW-LBPRGKRZSA-N	436.163	1.955	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CCC[C@@H]1C)CCO2	1836741045	IPZLUTNAPOSCSK-RCJHGTSTSA-N	431.371	1.910	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC(OC2CCN(C(=O)c3cc(O)ncn3)CC2)CC1	1836940861	TYLIKSDENVBIMO-UHFFFAOYSA-N	436.585	1.646	50	20	IDGD	
C[C@@H]1C[C@]1(C)C(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1	1838394795	YHYSRJOOVSJGLZ-CMJOXMDJSA-N	443.548	1.343	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)Cn3nccn3)CC2)CC1	1838655568	LKVKKUFPWKDLAE-MRXNPFEDSA-N	442.358	1.450	50	20	IDGD	
COc1ccccc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)Br)C2)C1	1838877765	XVPIGJDFUWTEMN-KUHUBIRLSA-N	441.322	1.549	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccncc3)CCO2)C1	1839061455	VHOSCRRDVGELNN-QFBILLFUSA-N	440.338	1.254	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc4c3OCCO4)C2)C1	1839145112	VEVBKFXJBBTKEB-IIBYNOLFSA-N	438.908	1.545	50	20	IDGD	
O=C(c1ccc(O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839201775	JCHVIULFKRGFTC-RHSMWYFYSA-N	431.258	1.153	50	20	IDGD	
N#Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)c(Cl)c1	1839423478	DGUFELOBTUJGLC-QAPCUYQASA-N	430.263	1.816	50	20	IDGD	
Cn1cc2cc(C(=O)N3CCO[C@@]4(COCCN(C(=O)C(C)(C)CCl)C4)C3)ccc2n1	1839503502	PSTRJKKCKGUYAI-QFIPXVFZSA-N	448.951	1.908	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3scnc3C)C2)C1	1839963697	SKEHIQQCESPDGN-GUYCJALGSA-N	446.367	1.695	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)C[C@@H]3CCCCO3)C2)C1	1840030672	SCPQSIXEUUVHRY-RLFYNMQTSA-N	433.343	1.185	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4ncccc4c3)C2)C1	1840152702	PXUZLWIFMRHUFI-GCJKJVERSA-N	447.919	1.559	50	20	IDGD	
O=C(c1nnsc1C1CC1)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840187834	ZNTLMEBOJSAYKG-MRXNPFEDSA-N	435.333	1.289	50	20	IDGD	
O=C(c1c[nH]c2cnccc12)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840188610	SUXMWZIUFFSSCI-SFHVURJKSA-N	427.288	1.437	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3cc(C)cc(F)c3)CCO2)C1	1840241688	RBUAOYKAPHLSRG-NQIIRXRSSA-N	442.915	1.387	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@]1(C)CC1(F)F)CCO2	1840823351	QFLIBCOCBHTJIJ-WQVCFCJDSA-N	439.297	1.519	50	20	IDGD	
CC[C@@H](NC(C)=O)C(=O)N1CCCC12CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)C2	1841089400	QRJKCYRPANHJIU-SCFJZMLDSA-N	430.455	1.990	50	20	IDGD	
O=C(c1cc(Cl)nc2ccccc12)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843014017	NTMWPNVLFDMNMT-UHFFFAOYSA-N	449.703	1.699	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)N1CC2(CCCN2C(=O)c2cnccc2C(=O)NN)C1	1844264872	STKSTGXMYNDXBI-UHFFFAOYSA-N	443.891	1.478	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H](F)C[C@H]1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl	1847558383	CNESKWNUTDGBCZ-CAEXGNQWSA-N	433.908	1.135	50	20	IDGD	
C=C[C@@H]1C[C@]1(NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl	1847568782	LEQLGEYNEOXPKC-BINAMKIQSA-N	427.929	1.257	50	20	IDGD	
CC(=O)NC(C)(C)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)/C(C#N)=C/c1ccc(F)cc1F	1847823971	FGBAZRBIZWGZQZ-AIEADPQKSA-N	430.455	1.988	50	20	IDGD	
COc1cc(C(=O)NCC(=O)NCCSSCCC(=O)O)cc(OC)c1OC	2088599463	XSLAMPKIEBSUIR-UHFFFAOYSA-N	432.520	1.415	50	20	IDGD	
CC(=O)c1ccc(N2CCN(CC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)CC2)c(F)c1	15041579	JDCFXPCPPHGZQU-UHFFFAOYSA-N	443.435	1.520	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCN(Cc3c(F)cccc3Cl)CC2)n1	23376408	KPCDZYQQGCQLNW-UHFFFAOYSA-N	439.944	1.752	50	20	IDGD	
Cc1nn(C)c2[nH]c(=O)c(CCC(=O)NNC(=O)c3ccc4c(c3)OCCO4)c(C)c12	105959948	HRJIDRIYEVQGLG-UHFFFAOYSA-N	425.445	1.043	50	20	IDGD	
COc1ccc(OC)c(NC(=S)NNC(=O)c2sc(N3CCOCC3)nc2C)c1	726444913	RJPUOKKXJRGCLJ-UHFFFAOYSA-N	437.547	1.937	50	20	IDGD	
CN(C)N(C(=O)c1ccc2c(c1)C(=O)N(C1CCCCC1)C2=O)[C@@H]1CCS(=O)(=O)C1	728178945	FPPVGYPYVWRRDA-MRXNPFEDSA-N	433.530	1.721	50	20	IDGD	
COc1cc(C=NNC(=O)[C@@H](C)NS(C)(=O)=O)ccc1OC(=O)c1ccc(F)cc1	728436904	UWKWNHKDLYVJQI-GFCCVEGCSA-N	437.449	1.441	50	20	IDGD	
Cc1ccc([C@H](CNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)N2CCCC2)o1	728951113	BOVGWECJXAGMHZ-SFHVURJKSA-N	441.536	1.762	50	20	IDGD	
Cc1cccc(C)c1NC(=O)CN(C)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	728958608	BIPJEPXNVRBPDO-UHFFFAOYSA-N	439.520	1.621	50	20	IDGD	
Cc1nc2c(c(O)nn2C)c(C)c1CC(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	729531654	NFAXNHJHWWKUKP-UHFFFAOYSA-N	444.517	1.417	50	20	IDGD	
O=C(NCCCN1C(=O)NC2(CCCCC2)C1=O)NNC(=O)c1cccc2ncccc12	730115629	WBGQBLHFURPJBH-UHFFFAOYSA-N	438.488	1.824	50	20	IDGD	
CCCOc1ccc(CNC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)cn1	730820795	HDKFDLKALSOESA-UHFFFAOYSA-N	434.522	1.616	50	20	IDGD	
CSCC[C@H](NC(=O)NNC(=O)COc1ccccc1O)c1nnc2ccccn12	730901345	BHCSKMAPYKYYIG-ZDUSSCGKSA-N	430.490	1.639	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2C(=O)c3ccccc3C2=O)cc1Br	732033340	CKJIANJULHCPLS-UHFFFAOYSA-N	432.230	1.515	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2C(=O)[C@@H]3[C@@H](C2=O)[C@H]2C=C[C@H]3C2)cc1Br	732034111	ZCPJLRHCKBMCOP-NXPNQGMMSA-N	448.273	1.026	50	20	IDGD	
N#CCCn1cc(/C=C(\C#N)C(=O)N2CCO[C@@H](c3nn[nH]n3)C2)c(-c2ccccc2)n1	732089824	NGRNTVSSWFBKCL-QIPHDZALSA-N	429.444	1.484	50	20	IDGD	
O=C(NCCN/C(O)=C1/N=CC=CC1=O)NNC(=O)c1ccc(COc2ccccc2)o1	732466813	RCIUFXGTCZEZRH-ZZEZOPTASA-N	439.428	1.329	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)NCCCC(=O)N1Cc2ccccc2C1	732473828	BYDKKFLMHQMBGZ-UHFFFAOYSA-N	441.444	1.627	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)N[C@H](Cc2ccccc2)CN2CCOCC2)cc1	732476691	SEYQKACWTMGTJW-HXUWFJFHSA-N	426.517	1.648	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)NCC1CCN(S(=O)(=O)C(F)F)CC1)c1ccccc1	733044907	ACTIRTOMGPFKSF-OAHLLOKOSA-N	432.493	1.775	50	20	IDGD	
O=C(CNC(=O)c1cc(-c2ccccc2)on1)NNC(=O)c1cnn(-c2ccccc2)c1	733171112	IIWYJZUGXZDJSS-UHFFFAOYSA-N	430.424	1.718	50	20	IDGD	
CCCC(=O)N1CSC[C@H]1C(=O)NNc1nc2ccccc2c(=O)n1CCCOCC	733267447	XEBUMNRJYDAJCM-KRWDZBQOSA-N	447.561	1.968	50	20	IDGD	
CN(C)CC(=O)NNC(=O)c1cnn(-c2ncc(Cl)cc2Cl)c1C(F)(F)F	733359663	WURHIXVBBICVJU-UHFFFAOYSA-N	425.198	1.916	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc2c(c1)nc(CCC(=O)NNc1cc(C)ncn1)n2C	734253968	CRRXAQLNZQBPOQ-UHFFFAOYSA-N	445.549	1.778	50	20	IDGD	
Cc1cc2ncc(C(=O)NNC(=O)NC3CCN(C(=O)OC(C)(C)C)CC3)c(C)n2n1	734821905	NYZGZDMBNRGRKA-UHFFFAOYSA-N	431.497	1.690	50	20	IDGD	
CCc1ccccc1OCC(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	735117480	URMDOISVIMEWBY-UHFFFAOYSA-N	433.534	1.102	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)cn1	735445930	JDYCXWDRLLVORH-MDWZMJQESA-N	435.556	1.924	50	20	IDGD	
COc1ccc(-c2nn(CCC#N)cc2C(=O)NNC(=O)c2cnn(C)c2)cc1[N+](=O)[O-]	735470742	HKAMKVVKJNJHBY-UHFFFAOYSA-N	438.404	1.189	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)CCSCc2nc(O)c3c4c(sc3n2)CCC4)cn1	735473064	MFPPAZKHOQPDOH-UHFFFAOYSA-N	432.531	1.704	50	20	IDGD	
Cc1cc(NNC(=O)c2cc(S(=O)(=O)N3CCOCC3)ccc2Cl)nc(C)n1	736718514	JBPNWHHEPNKAOD-UHFFFAOYSA-N	425.898	1.525	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(/C#N)C(=O)N2CCC[C@@H](CNS(N)(=O)=O)C2)c1C	739696508	IVYDUHRSUCTTJD-UXBMHOQCSA-N	437.566	1.251	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@H]2C[C@@H]2c2cccc(F)c2F)cc1	741660772	OAHOYGQCHGMRSR-CVEARBPZSA-N	437.468	1.845	50	20	IDGD	
Cc1ccc(C)c(N2N=C(C(=O)OCC(=O)NNC(=O)c3cccc(C#N)c3)CCC2=O)c1	741826922	BPLQQPJEHPVAOW-UHFFFAOYSA-N	447.451	1.662	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)CCCN(C)C2=NS(=O)(=O)c3ccccc32)c1O	743317302	QAWVNPDFPLBSEI-UHFFFAOYSA-N	446.485	1.023	50	20	IDGD	
CCN(CC1CCN(c2ccccn2)CC1)C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	743512226	SQAWAOHFZNCGHM-UHFFFAOYSA-N	449.519	1.650	50	20	IDGD	
C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)OCC(=O)NNC(=O)c1cccc(C#N)c1	744496845	IOBJWTTVRWZEOW-GFCCVEGCSA-N	428.426	1.951	50	20	IDGD	
O=C(COC(=O)[C@H]1CCCN(c2ncnc3sccc23)C1)NNC(=O)c1cccs1	745533090	HAOJGNRPKVLVDK-LBPRGKRZSA-N	445.526	1.974	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)NNC(=O)N[C@@H]1CC(=O)N(CCOc2ccccc2)C1	745848605	UNNHVUIIYQSELO-QGZVFWFLSA-N	435.484	1.721	50	20	IDGD	
O=C(N[C@@H](Cc1ccccc1)C(=O)NNC(=O)N1CCOCC1)OCc1ccccc1	745991986	PMZXJLTVPBUXAS-IBGZPJMESA-N	426.473	1.597	50	20	IDGD	
O=C(NNc1nc(-c2cccnc2)no1)[C@@H]1CN(Cc2nc(O)c3ccccc3n2)CCO1	746240949	DKIPTUVLKRZODN-INIZCTEOSA-N	448.443	1.125	50	20	IDGD	
CC(C)c1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)Cc3ccncc3)CC2)cc1	747326228	MBBPPTZVKDYIER-UHFFFAOYSA-N	444.557	1.996	50	20	IDGD	
CCCOc1c(Br)cc(C(=O)NNC(=O)C(=O)N2CCCC2)cc1OC	748247045	TUYGCQOSPOGINA-UHFFFAOYSA-N	428.283	1.630	50	20	IDGD	
CN(C)C(=O)CS(=O)(=O)c1ccc(C(=O)NNc2ccc([N+](=O)[O-])cc2Cl)cc1	748727056	ZWQDLIVOUJGKSS-UHFFFAOYSA-N	440.865	1.867	50	20	IDGD	
COc1ccccc1C1(C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)CC1	749160648	MROMMBUHAYARJJ-UHFFFAOYSA-N	431.514	1.503	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)[C@@H]3OCCc4ccccc43)cc2)CC1	750429510	VKWHFMPHPPRBKO-HXUWFJFHSA-N	430.530	1.380	50	20	IDGD	
CC[S@](=O)[C@@H]1CCC[C@H](NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)C1	750669832	DSSAMXYPFZMJRV-ADAUERFCSA-N	449.621	1.609	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNS(=O)(=O)c1cnn([C@H]2CCOC2)c1	751537917	DVMPTNOZGGQHQH-PBHICJAKSA-N	430.486	1.775	50	20	IDGD	
CC(C)[C@H]1OCCC[C@@H]1CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	753033261	BBZQUAYAJLCEPT-NVXWUHKLSA-N	426.539	1.332	50	20	IDGD	
Cc1c(Br)cc(C(=O)NNC(=O)CNC(=O)c2ccco2)cc1[N+](=O)[O-]	753130699	QZFDCZCAMVDVRY-UHFFFAOYSA-N	425.195	1.450	50	20	IDGD	
CS[C@H](CNC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)C(C)(C)C	753283591	HUVSKCLPSSFRFS-OAHLLOKOSA-N	444.627	1.422	50	20	IDGD	
CCn1c(NNC(=O)c2cc(S(N)(=O)=O)cc(Cl)c2F)nc2ccccc2c1=O	754400231	FWTCSQNZLYHPBK-UHFFFAOYSA-N	439.856	1.613	50	20	IDGD	
O=C(CCC(=O)NC1CCCC1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	755382510	UIXZRZICIMEEOV-UHFFFAOYSA-N	436.534	1.071	50	20	IDGD	
CCOC(=O)c1cc2cc(NC(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)ccc2s1	755862031	MFWGGYJWWXAWKX-SNVBAGLBSA-N	425.488	1.665	50	20	IDGD	
O=C(NNC(=O)c1cc(Cl)ccc1O)Nc1ccc(CC(=O)N2CCOCC2)cc1	755862413	PEUUPRGKIFZEAE-UHFFFAOYSA-N	432.864	1.913	50	20	IDGD	
CC(C)(C)S(=O)(=O)N1CCC(NC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)CC1	755871279	CHONWQKJIJYXNS-UHFFFAOYSA-N	448.549	1.409	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)Nc1ccc(C(=O)N2CCOCC2)cc1	755934255	PRZDKQDFAPORSM-UHFFFAOYSA-N	449.508	1.617	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)Nc1ccccc1CN1CCOCC1	756114164	IKDHDLPSNLHXPX-UHFFFAOYSA-N	435.525	1.976	50	20	IDGD	
NC(=O)c1ccc(NNC(=O)c2nn(-c3cccc(Br)c3)c3c2CCC3)nn1	757405260	JQBDGCDSXODDQT-UHFFFAOYSA-N	442.277	1.769	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)[C@H](Sc1ccc(F)cc1F)c1ccccc1	758028015	BFVUHNPURAUOIG-MEDUHNTESA-N	443.497	1.883	50	20	IDGD	
COc1ccc(C[C@H](C)C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1	758067158	HCPYTVBLEMEOOH-INIZCTEOSA-N	433.530	1.650	50	20	IDGD	
O=C([C@@H]1CCCCN1Cc1ccccc1)N1CCN(S(=O)(=O)CBr)CC1	758512275	KEKGJEAYKRQHON-KRWDZBQOSA-N	444.395	1.868	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(n2cc(NC(=O)C(=O)NNC(=O)C(C)(C)C)cn2)CC1	761062952	AAIJWRSRIJGQRR-UHFFFAOYSA-N	436.513	1.587	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)c2cccc(Cl)c2)c(OC)c1	761267130	OGFYQFAOSKEBFT-UHFFFAOYSA-N	447.922	1.734	50	20	IDGD	
COCCOc1ccc(Br)cc1NC(=O)C(=O)NNC(=O)c1ccncc1	763462330	NAAOYFNAFMFBGI-UHFFFAOYSA-N	437.250	1.269	50	20	IDGD	
Cc1cc(N2CCSCC2)ccc1NC(=O)C(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	763471249	FYAIDHFELWSOID-UHFFFAOYSA-N	443.485	1.856	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)C(=O)Nc1ccn(-c2ccccc2Cl)n1	763558946	OGVZUILQOYSWBQ-UHFFFAOYSA-N	427.804	1.654	50	20	IDGD	
COCCOc1ccc(C#N)cc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccccc2)[nH]n1	763614586	UHKMRXGIQBGTQL-UHFFFAOYSA-N	448.439	1.373	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(C#Cc3ccccn3)c2)c1	763619315	RWBVKLQGWNVQAM-UHFFFAOYSA-N	428.448	1.955	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccnn2CCc2ccccc2)cc1C	763681268	VOKLTLMPTFEAOQ-UHFFFAOYSA-N	435.484	1.908	50	20	IDGD	
CCCc1c(NC(=O)C(=O)NNC(=O)c2cccc(N(C)C)c2)cnn1-c1cc(C)ccn1	763759278	UTPZYSJMFKXKHV-UHFFFAOYSA-N	449.515	1.994	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2ccc(C)c([N+](=O)[O-])c2)c2ccccc2c1=O	763786948	SEXWJUSSRMAHQX-UHFFFAOYSA-N	438.400	1.033	50	20	IDGD	
CC(C)C(=O)NNC(=O)C(=O)Nc1ccc(NC(=O)[C@H]2CCCO2)cc1C(F)(F)F	763819716	BGPGCSOEFQCEEC-CYBMUJFWSA-N	430.383	1.565	50	20	IDGD	
Cc1nn(C)c2ncc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc3ccc4ccccc4c3)cc12	763851368	CKHPBJVKVWWPMJ-AWEZNQCLSA-N	446.467	1.983	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cccc(C(=O)NC)c2C)cc1	763859807	FXHWRIWIMCAYHS-CQSZACIVSA-N	442.472	1.307	50	20	IDGD	
Cc1coc(-c2cc(NC(=O)C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)ccc2C)n1	763916231	DRVAEERPQVBAPM-UHFFFAOYSA-N	446.427	1.334	50	20	IDGD	
COC(=O)CCOc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccc(Cl)cc2)cc1	763932258	OYLUDBKXJBJREA-UHFFFAOYSA-N	433.848	1.611	50	20	IDGD	
O=C(NNC(=O)c1cc(Cl)ccc1O)C(=O)Nc1ccc(-n2cncn2)c(Cl)c1	763973532	AWMGGXBLSQZRDW-UHFFFAOYSA-N	435.227	1.679	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)c1ccc(OC)c(I)n1	764000259	UAMSBWDAWZDVCQ-UHFFFAOYSA-N	441.225	1.707	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1ccccc1O[C@H]1CCOC1	764003787	JHAVZFAGBPNTHN-AWEZNQCLSA-N	427.413	1.025	50	20	IDGD	
CC(C)(C)OC(=O)N1CCO[C@@H](CC(=O)NNC(=O)CSc2ccccc2O)C1	764048495	YSTSDXSHCJICTM-ZDUSSCGKSA-N	425.507	1.658	50	20	IDGD	
CC(C)(C)c1nsc(NC(=O)C(=O)NNC(=O)c2cccc(Br)c2)n1	764063589	UCTBHXKBIAPJBG-UHFFFAOYSA-N	426.296	1.998	50	20	IDGD	
COC(=O)CCCOc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)nc2)cc1	764093341	UEKFQJPLUYARGX-UHFFFAOYSA-N	434.836	1.467	50	20	IDGD	
CCCN1CCN(c2ccc(NC(=O)C(=O)NNC(=O)CC(F)(F)F)cc2Cl)CC1	764117811	WTAVDSVSFMXZRD-UHFFFAOYSA-N	449.861	1.910	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccc(-c2nnc3n2CCCC3)cc1	764138817	KLCHBHWQNJZRBC-UHFFFAOYSA-N	448.483	1.619	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2O1)C(=O)Nc1cc(F)ccc1N1CCCCC1	764162803	GHWRHMZRBZXERH-LJQANCHMSA-N	426.448	1.906	50	20	IDGD	
O=C(CC1CCCC1)NNC(=O)C(=O)Nc1ccnn1Cc1cnn(-c2ccccc2)c1	764179295	QBNZTUPJOHNNBK-UHFFFAOYSA-N	435.488	1.783	50	20	IDGD	
CSc1nnnn1-c1cccc(NC(=O)C(=O)NNC(=O)CCc2ccccc2)c1	764193885	WKHRBSVEIUFFEV-UHFFFAOYSA-N	425.474	1.103	50	20	IDGD	
COCCOc1c(Cl)cc(NC(=O)C(=O)NNC(=O)Cc2cccnc2)cc1Cl	764268810	QMOADQYPHSJFTC-UHFFFAOYSA-N	441.271	1.742	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)C(C)(C)c2ccccc2)cc1N1CCOC1=O	764320774	KWCYQAMISCMUDU-UHFFFAOYSA-N	440.456	1.716	50	20	IDGD	
O=C(CN1C(=O)NC2(CCCCC2)C1=O)NNc1c(F)cc(C(=O)NC2CC2)cc1F	764329278	HMBOXOLZFILAPL-UHFFFAOYSA-N	435.431	1.555	50	20	IDGD	
O=C(NNC(=O)c1cc2ccccc2o1)C(=O)Nc1ccc(CN2C(=O)CCC2=O)cc1	764330844	KNTGXHSUMCSUTO-UHFFFAOYSA-N	434.408	1.482	50	20	IDGD	
COC(=O)[C@@H](C)Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)cc1	764349749	UPDDQTLWJMJYSS-NSHDSACASA-N	433.848	1.797	50	20	IDGD	
CCC(=O)Nc1ccc(C)c(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c1	764350725	JEGBROUFUWBUPN-UHFFFAOYSA-N	434.456	1.929	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)COCc2ccccc2)ccc1Br	764367806	MMXOWAMCTCDPHH-UHFFFAOYSA-N	436.262	1.760	50	20	IDGD	
CN1CCc2ccc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc3ccccc3)cc2C1=O	764380165	QEIMMOXJNZALGZ-UHFFFAOYSA-N	432.383	1.072	50	20	IDGD	
O=C(Cc1ccc(CC(=O)NNc2ccc(Cl)nn2)cc1)NNc1ccc(Cl)nn1	764460821	AFUPKRUXKQYIRV-UHFFFAOYSA-N	447.286	1.945	50	20	IDGD	
CNc1c(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cccc1[N+](=O)[O-]	765368268	MSGFSONVMIAQLW-UHFFFAOYSA-N	447.473	1.496	50	20	IDGD	
CC(=O)Nc1cc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)ccc1C	765737375	YQJZMVSMJLAPTP-UHFFFAOYSA-N	437.500	1.172	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1cc(Cl)ccc1[N+](=O)[O-]	765739604	ZNHIASCYYDUDAG-UHFFFAOYSA-N	445.863	1.467	50	20	IDGD	
COC(=O)c1ccc(C(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)s1	765753250	COTVIWLOGGALIX-UHFFFAOYSA-N	430.530	1.422	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3ccccc3-c3nnc(C)o3)CC2)cc1	766648743	KMTUMXVQIPGUSH-UHFFFAOYSA-N	448.527	1.932	50	20	IDGD	
C[C@@H]1Cc2cc(S(N)(=O)=O)ccc2N1C(=O)COC(=O)[C@H](Br)C(C)(C)C	766750497	RLFVTBUHIFCVGW-BMIGLBTASA-N	447.351	1.964	50	20	IDGD	
Cc1nn(-c2ccccc2)c2sc(C(=O)NNC(=O)NC[C@@H]3CCCS3(=O)=O)cc12	767172852	FABXDIQCJUKBFH-AWEZNQCLSA-N	447.542	1.917	50	20	IDGD	
CN(C)CCS(=O)(=O)c1ccccc1C(=O)NNC(=O)Cc1c[nH]c2ccccc12	767191784	JWERWEBKMKXQRX-UHFFFAOYSA-N	428.514	1.507	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNS(=O)(=O)c1cc([N+](=O)[O-])c(C)s1	767438021	MHLQUASHQZRESJ-UHFFFAOYSA-N	447.520	1.190	50	20	IDGD	
COc1cc(C)c(S(=O)(=O)N2CCN(S(=O)(=O)CBr)CC2)c(C)c1	767851827	VQAJJEPRZLDASC-UHFFFAOYSA-N	441.369	1.301	50	20	IDGD	
CNS(=O)(=O)c1cccc(NC(=O)[C@@H](C)NC(=O)[C@@H](Br)C(C)(C)C)c1	767977659	BXKLKTUKOYGJBO-ZWNOBZJWSA-N	434.356	1.848	50	20	IDGD	
COc1cc2c(cc1NC(=O)C(=O)NNC(=O)Cn1ccc3ccccc31)NC(=O)CC2	768238486	AMXROEHKUNPWGH-UHFFFAOYSA-N	435.440	1.321	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)NC1CCN([C@H]2CCCC[C@H]2O)CC1	769158858	ATVSKZBAPXFZLV-ZWKOTPCHSA-N	434.537	1.562	50	20	IDGD	
O=C(Cc1cccc(OCc2cccnc2)c1)NNC(=O)c1ccc(-n2cnnn2)cc1	770597273	CPRRTIMHZZRLFB-UHFFFAOYSA-N	429.440	1.640	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)c3nn(-c4ccccc4C(F)(F)F)cc3O)nc21	771021058	NXKJOMKMHRWKGV-UHFFFAOYSA-N	434.338	1.736	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1cccs1)C(=O)NNC(=O)[C@@H](C)Oc1cccc(Cl)c1	772965352	XIIUPETWPZBDOV-GHMZBOCLSA-N	431.923	1.683	50	20	IDGD	
CCC(=O)N1CC[C@H](C(=O)NNC(=O)c2nc(-c3ccccc3)n(-c3ccccc3)n2)C1	773061050	XYVMXIYIBKKVNJ-KRWDZBQOSA-N	432.484	1.954	50	20	IDGD	
COC(=O)c1ccc(-n2cc(C)cn2)c(NC(=O)C(=O)NNc2ccccc2[N+](=O)[O-])c1	773653633	DXCATVNRRLKETE-UHFFFAOYSA-N	438.400	1.957	50	20	IDGD	
CNC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)cc1	774009991	TUIDHQBPMZALRF-GFCCVEGCSA-N	448.863	1.018	50	20	IDGD	
CN(C)C(=O)[C@@H]1CC[C@@H](CNC(=O)NNC(=O)COc2ccccc2-c2ccccc2)O1	775455893	XTZDQXMYWJOAAK-PXNSSMCTSA-N	440.500	1.699	50	20	IDGD	
Cc1ccc(C)n1-c1ccc(C(=O)NNC(=O)NC[C@@H]2CC[C@H](C(=O)N(C)C)O2)cc1	775460838	MJSUBTMCJDYWDL-RBUKOAKNSA-N	427.505	1.674	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)N[C@H](c1ccc(C(C)(C)C)cc1)C(F)(F)F	775953847	BBWZTOOTPNXDTE-GXFFZTMASA-N	438.472	1.856	50	20	IDGD	
CN(NC(=O)c1c[nH]c(C(=O)N2CCCC2)c1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776202730	WLNANTYFWZZPSK-UHFFFAOYSA-N	448.524	1.500	50	20	IDGD	
Cc1cc(-n2c(C)cc(C(=O)N3CCN(S(=O)(=O)CBr)CC3)c2C)no1	777832267	LJRYDSJFFAYZNH-UHFFFAOYSA-N	445.339	1.831	50	20	IDGD	
CCCn1nc(C(=O)NNS(=O)(=O)c2ccc3c(c2)OCO3)c2ccccc2c1=O	777914070	WGQJSWGHZYCFQH-UHFFFAOYSA-N	430.442	1.159	50	20	IDGD	
CC(=O)Nc1ccc(C)c(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1	781426994	PVMMWIGNTNAKCP-SFHVURJKSA-N	427.413	1.098	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(CNC(=O)NNC(=O)c2ccc(Cl)cc2F)c1	782538651	GWRCHDLSADHBMH-UHFFFAOYSA-N	428.873	1.874	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)C(=O)Nc1cnc2ccccc2c1	782898031	WXJPCAVQXOXDAA-UHFFFAOYSA-N	440.485	1.236	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2c[nH]nc2-c2ccccc2)nc1	783265826	YHPLAUDIAXDWEP-UHFFFAOYSA-N	443.489	1.240	50	20	IDGD	
COC(=O)[C@@H](Cc1ccc(Cl)cc1)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	783575292	XOCYUMCEVIKQSB-QGZVFWFLSA-N	439.921	1.609	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)C(=O)Nc1cccc(-c2cnco2)c1	784210108	CLTFXFMFBYPENR-UHFFFAOYSA-N	441.469	1.864	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CCC[C@H]2CN(C(=O)NNC(=O)CNC(=O)c3ccco3)C[C@H]21	784263367	MHWZZYLZKYYXDU-RRFJBIMHSA-N	449.508	1.375	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)c3cc4c(=O)n5ccccc5nc4n3C)n[nH]2)cc1	784345805	CSNZQARLXKZUCN-UHFFFAOYSA-N	441.451	1.960	50	20	IDGD	
O=C(NNc1cc(Cl)ccn1)C(=O)Nc1ccccc1S(=O)(=O)N1CCCCC1	784860592	IYQGCBKIIGZEDP-UHFFFAOYSA-N	437.909	1.991	50	20	IDGD	
CCc1cc(Br)ccc1NNC(=O)C(=O)Nc1ccc(OCC(N)=O)cc1	785097494	OGIOQERRTUGHAS-UHFFFAOYSA-N	435.278	1.957	50	20	IDGD	
Cn1cc(-c2ncccc2NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)cn1	786417668	WEERNAGWKRWDBU-UHFFFAOYSA-N	448.418	1.411	50	20	IDGD	
CN1C[C@H](C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)c2ccccc2C1=O	787404232	PFGHSOBLVVAVIH-KRWDZBQOSA-N	444.513	1.020	50	20	IDGD	
Cc1ccc(N2CCNC2=O)cc1NC(=O)C(=O)NNC(=O)c1cccc(OC(F)F)c1	787542495	KTPPBDKLIVGGCS-UHFFFAOYSA-N	447.398	1.526	50	20	IDGD	
Cc1ccc(N2CCNC2=O)cc1NC(=O)C(=O)NNc1ccnc(Br)c1	787562296	OQICHPFIVPMRBP-UHFFFAOYSA-N	433.266	1.764	50	20	IDGD	
CN1CCN(C(=O)NNC(=O)c2ccc(NC(=O)c3cc(F)cc(F)c3)cc2O)CC1	788166662	QDYJGDBTUQITFY-UHFFFAOYSA-N	433.415	1.525	50	20	IDGD	
O=C(NNC(=O)c1n[nH]c2c1CCCCC2)c1cccc(S(=O)(=O)N2CCCCC2)c1	788756548	LUESCWJUMUSDMD-UHFFFAOYSA-N	445.545	1.928	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)Cn2ccc3ccccc3c2=O)cc1OC	790723814	RPVANTGQJCCIGT-UHFFFAOYSA-N	439.424	1.023	50	20	IDGD	
O=C(NNc1cccc(F)c1[N+](=O)[O-])C(=O)Nc1ccc2c(c1)C(=O)N(CC1CC1)C2=O	790996812	GCROWZHAGQDRAZ-UHFFFAOYSA-N	441.375	1.822	50	20	IDGD	
COc1cc(S(=O)(=O)N2CCOCC2)cc(C(=O)NNc2ncccc2C)c1OC	791210700	AWKNGNRJGQMBCW-UHFFFAOYSA-N	436.490	1.185	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc(Cl)c1F	792264213	LEJJLGIIYFCCLU-UHFFFAOYSA-N	438.755	1.574	50	20	IDGD	
CCCCn1ncc(NC(=O)C(=O)NNC(=O)c2cncc(NC(C)=O)c2)c1C(C)C	792265551	FFHBECCJEVZOSE-UHFFFAOYSA-N	429.481	1.560	50	20	IDGD	
O=C(NNc1nc2ccccn2n1)C(=O)Nc1ccc(C(=O)NCCc2ccccc2)cc1	792392056	PMWDAIVMAAFZFO-UHFFFAOYSA-N	443.467	1.784	50	20	IDGD	
Cc1ccc2cccc(NC(=O)C(=O)NNC(=O)CNC(=O)OCc3ccccc3)c2n1	797369300	SAXRQCFCEHPIAF-UHFFFAOYSA-N	435.440	1.556	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2cccc(CN3C[C@@H](C)O[C@H](C)C3)c2)n1	797371133	PJWVRDFVFZWLRP-HZPDHXFCSA-N	425.489	1.399	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](CCS(C)(=O)=O)c2ccccc2)cc1C	798308860	CDCGWXVJJMFLSC-SFHVURJKSA-N	431.514	1.608	50	20	IDGD	
Cn1c(=O)n(C)c2cc(N3CCCCC3)c(NC(=O)NNC(=O)Cc3cccnc3)cc21	800592499	HCCSSTXJAQVFQX-UHFFFAOYSA-N	437.504	1.658	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1c(F)ccc([N+](=O)[O-])c1C	800632607	NBVDXDDKWFZUKZ-UHFFFAOYSA-N	440.409	1.536	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1cccc(NN2C(=O)[C@H]3CC=CC[C@H]3C2=O)c1	801882252	XQRABDPAGFXXQM-WQVCFCJDSA-N	428.445	1.067	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3cnc(C(C)(C)C)nc3)cc2)CC1	806781722	DYHLVXYKANTCOV-UHFFFAOYSA-N	432.550	1.467	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(Br)c2)ccn1	806975203	QMJWQDMEBONNFO-SNVBAGLBSA-N	437.250	1.406	50	20	IDGD	
O=C1COC[C@H](C[C@@H]2CN(C(=O)C(=O)NNc3ccc(F)cc3F)c3ccccc32)N1	806997359	LHVMZAJXLVPWGO-OCCSQVGLSA-N	430.411	1.443	50	20	IDGD	
O=C(CNC(=O)NNC(=O)c1ccc[nH]1)Nc1ccc(I)cc1	807240858	WWVTZWGGPPSYKV-UHFFFAOYSA-N	427.202	1.202	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc(C)cc1	807368630	HVPMFKYBKKVCIB-INIZCTEOSA-N	427.523	1.085	50	20	IDGD	
CC(C)Oc1ccc([C@@H](CNC(=O)NNC(=O)C(=O)Nc2ccccn2)N(C)C)cc1	807588033	JPTXJFNMCNLJLB-QGZVFWFLSA-N	428.493	1.441	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNS(=O)(=O)c2nc(C)n(C)c2Br)c1	808068485	BBNPRRNTMNFEAP-UHFFFAOYSA-N	433.284	1.132	50	20	IDGD	
Cn1cnc(C(=O)NNC(=O)c2cccc(S(=O)(=O)Nc3ccccc3Cl)c2)n1	809979798	BSTNZRJDBBNFCC-UHFFFAOYSA-N	434.865	1.344	50	20	IDGD	
O=C(CNS(=O)(=O)c1c(Cl)cccc1Cl)NNC(=O)c1ccc(Cl)nc1	810154956	INXKPKCYFILJSY-UHFFFAOYSA-N	437.692	1.781	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3ccccc3-n3cnc(C#N)n3)cc2C1	810384442	KWMPJBFTKWGCTN-GFCCVEGCSA-N	449.496	1.725	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)nn1C1CCCCC1	810399092	RQBHRMJNHWWGFH-UHFFFAOYSA-N	430.421	1.710	50	20	IDGD	
CCCCn1nc(C(=O)NN=C(C)c2ccc3[nH]c(=O)c(=O)[nH]c3c2)c2ccccc2c1=O	811633274	MZKKKBBZDOLYQF-UHFFFAOYSA-N	446.467	1.880	50	20	IDGD	
Cc1c(C(=O)NNC(=O)COc2ccccc2Cc2ccccc2)nnn1-c1ccn(C)n1	814363887	RDQQPBANIGUACV-UHFFFAOYSA-N	445.483	1.740	50	20	IDGD	
CC(CCc1ccc(O[C@H](C)C(=O)O)cc1)=NNC(=O)CSc1nnc(O)nc1O	814785195	SSWJRXYIYMQEFY-LLVKDONJSA-N	435.462	1.352	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)c3ccn(-c4ccc(Br)cc4)n3)nc21	815607222	TVJVUPYEOFHMLQ-UHFFFAOYSA-N	429.238	1.774	50	20	IDGD	
O=C(COc1cccc(Br)c1)NNC(=O)c1csc(N2CCOCC2)n1	912852234	UWRWMKSGOYTITA-UHFFFAOYSA-N	441.307	1.582	50	20	IDGD	
CN(C)N(C(=O)c1cccc(S(=O)(=O)NC2CCCC2)c1)[C@H]1CCS(=O)(=O)C1	914436855	DDGRRWRNLWEQQH-INIZCTEOSA-N	429.564	1.013	50	20	IDGD	
CN(C)N(C(=O)[C@@H]1CC(=O)N(c2ccccc2Br)C1)[C@@H]1CCS(=O)(=O)C1	914438450	YYOZHMLKSNYNNU-CHWSQXEVSA-N	444.351	1.294	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1Cl)c1ccc(S(=O)(=O)N2CCOCC2)o1	914751739	AKNOKWOCCNMIMX-UHFFFAOYSA-N	448.284	1.682	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)C2CCN(C(=O)CCc3ccccc3)CC2)cc1	914846206	CPMYEPHVVXQUSM-UHFFFAOYSA-N	434.496	1.956	50	20	IDGD	
CC(=O)N1CCN(CCNC(=O)/C(C#N)=C/c2cc(C)n(C[C@H]3CCCO3)c2C)CC1	915624774	QHGBCIRKZLOFJL-QJUACMODSA-N	427.549	1.471	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)N[C@@H](C)c1nnc2ccccn12	916222326	ZCRSHCLDXDMXDP-LBPRGKRZSA-N	430.494	1.036	50	20	IDGD	
Cc1ccc([C@H](CNC(=O)NNC(=O)[C@H](C)Oc2ccccc2F)N2CCOCC2)o1	916227565	CLJUJUPLTRBSHL-RDJZCZTQSA-N	434.468	1.898	50	20	IDGD	
COc1cc(OC)cc(C(=O)NN=Cc2c(C)nn([C@@H]3CCS(=O)(=O)C3)c2Cl)c1	916312871	UBPYDWCLICQAEV-CYBMUJFWSA-N	440.909	1.986	50	20	IDGD	
O=C(NNC(=O)c1cc(S(=O)(=O)NC2CC2)c(Cl)cc1Cl)c1ccncc1	916551444	IKOCTYUQJGNCGW-UHFFFAOYSA-N	429.285	1.904	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NC[C@H](C)N2CCc3ccccc3C2)nc1	916603948	UGHWTDHDWBZYSG-INIZCTEOSA-N	446.577	1.841	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)COc2cccc(OC)c2)c1	916743053	DTOCBXKZCZTNIT-UHFFFAOYSA-N	435.502	1.566	50	20	IDGD	
O=C(COCC(=O)NNC(=O)c1ccc(Cl)cc1)NNC(=O)c1ccc(Cl)cc1	916826764	OSCKSXFGCOGUGH-UHFFFAOYSA-N	439.255	1.232	50	20	IDGD	
CCCC[C@H](/N=C1/NS(=O)(=O)c2ccccc21)C(=O)NNC(=O)c1ccc(Cl)nc1	917253483	NZVAWDCCRKHABM-AWEZNQCLSA-N	449.920	1.794	50	20	IDGD	
COc1ccc(N2CCCN(C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)CC2)cc1	918001654	DMZUUHGMJLEQQA-UHFFFAOYSA-N	436.476	1.238	50	20	IDGD	
C[C@H](Sc1nnnn1C1CC1)C(=O)NNC(=O)COc1ccc(Br)cc1	918403237	XDCRKCZLPPSANF-VIFPVBQESA-N	441.311	1.478	50	20	IDGD	
CCN(CCCNC(=O)CCC(=O)C(C#N)=C1N(C)c2ccccc2N1C)S(C)(=O)=O	919849775	FXZRWLCVYPAESJ-UHFFFAOYSA-N	447.561	1.445	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2ccn(-c3cccc(F)c3)n2)ccc1Cl	920287664	HUUHBCSWCWPDJR-UHFFFAOYSA-N	437.840	1.387	50	20	IDGD	
COCCCNC(=O)NN=C1CCN(S(=O)(=O)c2ccc(NC(C)=O)cc2)CC1	920831371	HATLEABUJWHDHX-UHFFFAOYSA-N	425.511	1.121	50	20	IDGD	
O=C(NNC(=O)c1n[nH]c2c1CCCC2)c1cn(-c2ccc(Br)cc2)nn1	1115839171	ZAZYPRPWJGPYBY-UHFFFAOYSA-N	430.266	1.707	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)c1ccc(N2CCC[C@H](C(N)=O)C2)cc1	1253774739	CLCVCPJWOAJSJR-INIZCTEOSA-N	442.541	1.950	50	20	IDGD	
CC(=O)N1CCN(Cc2ccccc2NC(=O)NNC(=O)c2n[nH]c3c2CCCC3)CC1	1255412490	KYSWWSLDTMHNPJ-UHFFFAOYSA-N	439.520	1.419	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNC(=O)[C@@H]2Nc3ccccc3S(=O)(=O)N2)cc1	1319089630	QOSMFGHASPPOMQ-GOSISDBHSA-N	432.502	1.603	50	20	IDGD	
COC(=O)c1ccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c(C)c1	1320112778	KPALBHDADOKVPU-UHFFFAOYSA-N	434.474	1.498	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CS(=O)(=O)Nc2ccc(N3CCCCC3)cc2)cc1	1322078138	XJSSKGRWBBVZEP-UHFFFAOYSA-N	446.529	1.888	50	20	IDGD	
CCOC(=O)c1ccc(OC)c(S(=O)(=O)NNC(=O)c2cncn2-c2ccccc2)c1	1323532641	JVKVSHMZVNLQGN-UHFFFAOYSA-N	444.469	1.681	50	20	IDGD	
CN(C)c1ccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)c2ccccc12	1777813464	FUBJMWMTZFZMOO-NFBKMPQASA-N	445.947	1.949	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(NC(C)=O)o3)C2)C1	1779030321	OBIKWIADDBEWOX-ACJLOTCBSA-N	442.310	1.855	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)Cn2cncn2)C1	1779501615	CZTZWKYIHKEMBM-ATNYBXOESA-N	442.358	1.212	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2nccnc2C(N)=O)C1	1779937046	MBCJZCWGIFLDLF-LRDNONRASA-N	437.928	1.111	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccnc4c3OCO4)C2)C1	1780022777	JKGNHAJPYXYIIY-KPZWWZAWSA-N	440.294	1.285	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H]1CCCO1)CCO2	1780097239	TXPOLGCUEMOQEJ-NQIIRXRSSA-N	447.444	1.143	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@@]3(CN(C(=O)CCBr)CCO3)C2)c(OC)c1	1780530168	ADDVDIFASFZRNE-LJQANCHMSA-N	441.322	1.932	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3c(Br)cnn3C)CCO2)C1	1781219598	VLFYPERUDBYJNB-LRDDRELGSA-N	433.734	1.644	50	20	IDGD	
O=C(COCc1ccccc1)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781327972	FUYNXEUBIVGLFK-FUHWJXTLSA-N	429.286	1.724	50	20	IDGD	
CO[C@@H](C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1)c1ccccc1	1781328591	TVXHLHHTTUHZTN-RKVPGOIHSA-N	429.286	1.895	50	20	IDGD	
C[C@H](Oc1cccnc1)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781335518	UIPAYIROHQJBQS-QEORTHHSSA-N	430.274	1.369	50	20	IDGD	
O=C(c1cc(F)cc(C(F)(F)F)c1)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1781607834	APTPNVQEDKRRSE-YOEHRIQHSA-N	438.805	1.888	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cnn4ccccc34)CCO2)C1	1783347564	LBUSNFQMGUXOTI-HNAYVOBHSA-N	435.322	1.951	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cc4cccn4cn3)CCO2)C1	1783349506	MNZZEVQPQULSJT-KXBFYZLASA-N	435.322	1.951	50	20	IDGD	
COc1cncc(CCC(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](C)Br)C3)C2)c1	1783529975	PZNCSHUZMOQJOV-LIRRHRJNSA-N	440.338	1.636	50	20	IDGD	
COC(=O)[C@H]1CC[C@H](C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)C(C)(C)CCl)[C@H]3C2)C1	1783847461	OGOODZNEMIFTCO-WOYTXXSLSA-N	428.957	1.820	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H]3CCC[C@H](C(=O)OC)C3)C2)C1	1783869882	XDHUXPBJDMBLHO-OLPIVMHESA-N	430.929	1.050	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CSc3ccc(F)cc3F)C[C@@H]21)[C@H](O)CCl	1784085595	LOEKSMABGVLTBF-YUDUHTQSSA-N	448.919	1.636	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)Cc3c(C)nn(C)c3C)C2)C1	1784515201	QENSJSDQBGDOEB-QFBILLFUSA-N	441.370	1.583	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(CCN(C(=O)c3cccc4c3CCCC4)C2)C1	1785092103	WFOJVZSSLHSFQK-RUZDIDTESA-N	448.328	1.003	50	20	IDGD	
CC[C@@H](NC(C)=O)C(=O)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1	1785864862	FXJRKLJQDJVTSO-HXUWFJFHSA-N	437.305	1.029	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc(OC)c(C)c3)[C@H]2C1	1786271166	FLHPQJPIVCIPIL-LLLHUVSDSA-N	425.913	1.246	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)[C@@H](O)c1ccccc1	1786664445	SDJGZKYRCYUZLI-OVWQWFNUSA-N	425.323	1.485	50	20	IDGD	
N#C/C(=C\c1ccc(Br)cc1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN)[C@H]2C1	1786797571	FELGAWVZGOQLLK-DCHBYBGLSA-N	447.333	1.294	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](N)c3ccccn3)[C@H]2C1	1786869656	CEKHEZOXHPDQHJ-FBVCHZJASA-N	429.348	1.297	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C[C@H]3COc4ccccc4O3)C[C@@H]21)[C@H](F)Cl	1787443395	IFWNKLFAUDATKT-SVZGUOJNSA-N	426.872	1.731	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4ncnn4c3)[C@H]2C1	1788452457	KNILLHMVBINSDN-MXAVVETBSA-N	436.310	1.106	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@]3(C)C[C@@H]3C)[C@H]2C1	1789778735	PKVKZDLXXVDOPY-TVFIILNASA-N	429.521	1.146	50	20	IDGD	
CC(=O)N/C(=C\c1ccco1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21	1790178139	JSJDROVKSPSVKB-BGJNKCOOSA-N	427.860	1.271	50	20	IDGD	
Cn1cc2cc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)C(Cl)Cl)C[C@@H]43)ccc2n1	1790354202	PRTYQORAGXMZJS-NOLJZWGESA-N	425.316	1.970	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Cl)C[C@@H]21)[C@H]1C[C@@]12C(=O)Nc1ccccc12	1791038043	QAEYQHMFJFXHBJ-CNVUXUMISA-N	435.883	1.411	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3cnn(C)c3)C[C@@H]21	1791058079	ORNLFMLOEQBEDZ-OEAJRASXSA-N	427.343	1.116	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c3ccccc3n3ccsc13)C2)[C@H](O)CCl	1792980845	NKLQHTMOHXDLJC-ZDFLXESQSA-N	447.944	1.957	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CNC(=O)OC(C)(C)C	1793011342	BNPQFUUBNCCYFO-RGDJUOJXSA-N	448.358	1.294	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc3c1NC(=O)C3=O)C2	1793449238	RIUIKERGBNJZCX-NOXHYTERSA-N	433.892	1.432	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ncn(-c2cccc(F)c2)n1	1794289794	OTGAJIFNZUFAQT-DLTLXFJOSA-N	435.887	1.627	50	20	IDGD	
COc1ncccc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)CBr)C2	1794727619	VTCKLDGZZYSOKQ-GUIRCDHDSA-N	426.311	1.324	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3nccnc3c1)C2	1795114421	HLQWUDQSXPOIOE-ZSBFGKGUSA-N	433.306	1.618	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@]2(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)[C@@H](F)Cl)C[C@H]1CO2	1796808672	RTBSKHGFOWYFME-KNJMQODFSA-N	445.919	1.937	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](F)Cl)CC1	1796811028	LHONDWXEQLHFPJ-JYYAWHABSA-N	446.951	1.712	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cncc(C(F)(F)F)c1	1798253152	VLXOCOQJNDVCTO-NEBZKDRISA-N	435.830	1.557	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(=O)nc2cccnn12	1799189325	OIARBTIUIUHIGD-JHXTVGTDSA-N	438.315	1.578	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1c(F)ccc([N+](=O)[O-])c1C	1799759364	QIXOFLTXCCXZBF-LKQDWFRTSA-N	443.859	1.499	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCCn1c(O)nc2ccccc21)[C@@H](O)CCl	1799827785	PBYHIYYOBHBWQY-KRXQYRFLSA-N	434.924	1.760	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ncn(-c3cccc(F)c3)n1)C2	1802273912	OUHYQTXBKZUARL-XLNGHYISSA-N	435.887	1.912	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H]2CC[C@@H]3CCC(=O)N3C2)[C@H]1c1cccnc1)[C@H](O)CCl	1803140201	BKZINIPXHDIJHK-ZIVNCQHPSA-N	448.951	1.088	50	20	IDGD	
COc1cc(CCC(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@H]2c2cccnc2)ccn1	1804273832	VDHRHGUSRJWFJF-UEXGIBASSA-N	446.935	1.724	50	20	IDGD	
Cc1occc1C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1805614872	IMIHHZAETVKDRI-NQIIRXRSSA-N	433.273	1.296	50	20	IDGD	
CC[C@H](C)[C@H](O)C(=O)N1CCCC2(CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CC2)C1	1806074282	OXFAJJLGBNKSSC-PLCRXTAGSA-N	445.564	1.759	50	20	IDGD	
CCOCC(=O)NC[C@@H]1CCN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@H]1c1cccnc1	1806502785	SAULLFQZRDQXKA-QGJUGNDFSA-N	440.504	1.258	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC2(CCCN(C(=O)[C@H](F)c3ccccc3)C2)CC1	1806515187	MHBDYGJJWXZEQT-OAQYLSRUSA-N	438.308	1.922	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)C(C)(F)F)[C@@H]1c1cccnc1	1806961708	MORFHRSPFFZUOX-KNRTUPFFSA-N	446.458	1.877	50	20	IDGD	
Cc1cccc(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)c1	1807366591	NGDUIYOFJYDXFN-GMAHTHKFSA-N	443.312	1.703	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)c1noc2c1CCCC2	1808021598	PTVNZNOVQYUGRX-URLQWDBASA-N	432.908	1.868	50	20	IDGD	
C[C@H](C(=O)NC[C@@H]1CCN(C(=O)[C@H](F)Cl)[C@H]1c1cccnc1)[C@H]1SC(=N)NC1=O	1808403495	WTYUBBAPJUEKLR-JDCLNJACSA-N	441.916	1.424	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)/C=C\C(=O)NC2CC2)[C@@H]1c1cccnc1	1810134947	SCNQTLZETLGGMK-MUFWYDAFSA-N	434.924	1.176	50	20	IDGD	
CC[C@H](C)CC(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1	1810295354	SGSOIQOOANZCAH-WJPUGNRLSA-N	438.532	1.836	50	20	IDGD	
C[C@H](Nc1ccccn1)C(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1	1810569695	QQDJRQFSUVIKDN-RMRDIRSESA-N	431.924	1.583	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2ccc3ncnn3c2)[C@@H]1c1cccnc1	1813030736	GDNQOWPENOXMLQ-VDZJLULYSA-N	442.907	1.698	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2ccnc3c2OCO3)[C@H]1c1cccnc1	1813031345	LUUDEGXCIUZGDK-XIRDDKMYSA-N	446.891	1.779	50	20	IDGD	
Cc1nc(C(=O)N2CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)co1	1813071801	XRSCNFVUIOBHAM-OXQOHEQNSA-N	428.493	1.071	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)Cc3nnc(C)s3)sc2C1	1815583609	MHEGOTPWZNAQET-UWVGGRQHSA-N	429.955	1.712	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccnc2C(N)=O)n[nH]1	1816077160	JSYSZIJLWCITFA-GWCFXTLKSA-N	449.309	1.993	50	20	IDGD	
CCc1[nH]nc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)c1F	1816258179	QMIMEXKDGKIHQE-AWEZNQCLSA-N	448.503	1.513	50	20	IDGD	
CN[C@H](CC(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@](C)(Cl)CCl)[nH]n1)C(=O)O	1817370503	FPWVCLBUMDJKJF-PEBVRCNWSA-N	434.324	1.701	50	20	IDGD	
Cc1cncc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)c1	1817470652	GDHZJVFGPWXBIL-IBGZPJMESA-N	433.277	1.413	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@@H]2CCC(F)(F)C2)[nH]n1)c1ccc(B(O)O)cc1	1817470817	ZDIAMWGYBNFKNV-RHSMWYFYSA-N	446.263	1.831	50	20	IDGD	
CS(=O)(=O)N1CCC(C(=O)N2CCCC[C@H]2c2cc(NC(=O)[C@H](F)Cl)n[nH]2)CC1	1818039063	JGNPLWPQJLCGBE-ZFWWWQNUSA-N	449.936	1.608	50	20	IDGD	
C[C@@H]1CCC[C@H]1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2	1818876485	MAMABNWNXHBPEY-DAXOMENPSA-N	427.335	1.485	50	20	IDGD	
Cc1nccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cnccc3C(=O)NN)n[nH]2)n1	1819403184	XBFYIKQOIBKDCD-QGZVFWFLSA-N	449.475	1.126	50	20	IDGD	
CCCC(=O)N[C@H](C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](Cl)COC)[nH]n1	1819565010	HODGCLDIUZRQCN-NFAWXSAZSA-N	427.933	1.960	50	20	IDGD	
C=CC[C@H](C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1821920941	AEKJBFHPAUQHFB-SUMWQHHRSA-N	425.493	1.926	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(CO)o2)[nH]n1	1822414997	QORMZPDOKRUYQK-OAHLLOKOSA-N	432.481	1.174	50	20	IDGD	
CCN(CC)C[C@@H](C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1	1822416533	GVYXVKUDFDUZGK-SJLPKXTDSA-N	449.600	1.753	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCS(C)(=O)=O)n[nH]1	1822967586	RRTFRITYLDPYBT-YPMHNXCESA-N	449.371	1.868	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc[n+]([O-])cc1)CC2	1825641030	HKTBBXAGVFJBSW-MWLCHTKSSA-N	425.308	1.786	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1CCc2nc(NC(=O)CCn3ccnn3)sc2C1	1826868958	MZNUARKUGBNZMD-WDEREUQCSA-N	441.355	1.768	50	20	IDGD	
O=C(Cc1cccnc1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827052841	JCBXJVVKHOQECY-QFIPXVFZSA-N	435.333	1.237	50	20	IDGD	
Cc1cncc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)c1	1827055981	MGEDDQTWMVHTTF-JOCHJYFZSA-N	435.333	1.617	50	20	IDGD	
C[C@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1)C1(O)CCC1	1827056156	UOWWWQUZDHTBLR-UTKZUKDTSA-N	442.365	1.151	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(F)nc3F)CCO2)C1	1829524361	GKIJDCZWALFLHO-KUHUBIRLSA-N	431.867	1.837	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(Cl)cnc3O)CCO2)C1	1829557982	YOVGJYZHIDESLR-IBGZPJMESA-N	446.331	1.776	50	20	IDGD	
COc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)ccc1O	1830363786	LBRYSNQLQMFJBI-NRFANRHFSA-N	440.924	1.736	50	20	IDGD	
O=C(c1c[nH]c(=O)cn1)N1CCC([C@@H]2CCCCN2C(=O)[C@H](F)Br)CC1	1830380522	PPYWKUANAKPMPV-ZFWWWQNUSA-N	429.290	1.694	50	20	IDGD	
Nc1n[nH]c(CCC(=O)N2CCC([C@H]3CCCCN3C(=O)[C@H](F)Br)CC2)n1	1830383014	VCJMZIRIEQWESW-DOMZBBRYSA-N	445.337	1.630	50	20	IDGD	
O=C([C@H](F)Cl)N1CCOC[C@]2(C1)CN(C(=O)C13CC(C(F)(F)F)(C1)C3)CCO2	1831701244	CTUAUYQPLPQMKA-UTMSUHPFSA-N	428.810	1.710	50	20	IDGD	
C[C@H](Cn1cncn1)C(=O)N1CCC(N2CCC(NC(=O)C(C)(C)CCl)CC2)CC1	1833214874	VJEJXIPUEPQYLJ-MRXNPFEDSA-N	439.004	1.751	50	20	IDGD	
CCC(=O)N[C@H](C)C(=O)NC1CCN(C2CCN(C(=O)CO[Si](C)(C)C)CC2)CC1	1833419925	JMLHIOJZEYUHCS-MRXNPFEDSA-N	440.661	1.324	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3scnc3C)CCO2)C1	1834269413	YKCVVYGCFPYFGE-DYVFJYSZSA-N	446.367	1.695	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1)c1ccc(=O)oc1	1834339939	FZTHXJVBKWXXSE-MRXNPFEDSA-N	444.301	1.516	50	20	IDGD	
O=C(c1cnoc1C1CC1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1834617411	PSQWUTPMDNKYGZ-RHSMWYFYSA-N	446.273	1.313	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1	1835121612	GXENMBJLZRQFQA-CQSZACIVSA-N	445.402	1.210	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cccn4ccnc34)CC2)CC1	1835578773	IUNHPNWIIAGAHG-LJQANCHMSA-N	447.967	1.773	50	20	IDGD	
O=C(c1cnc(C(F)(F)F)cn1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1836375637	OCLOWABPZHRVOE-DOMZBBRYSA-N	440.781	1.100	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)Cc3cnccn3)CC2)CC1	1836776074	YSRGYCXGNTYODV-CQSZACIVSA-N	439.354	1.801	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc4cn[nH]c4cn3)CCO2)C1	1837193565	SOOWMFCVGSCNRL-YWZLYKJASA-N	435.912	1.435	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cccnc3OC)CC2)CC1	1837455339	IJOVFDUJWYUBNY-GOSISDBHSA-N	439.940	1.956	50	20	IDGD	
C[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1)N1CSCSC1	1837573008	SRZSTHSYNGGZIX-WWGRRREGSA-N	441.978	1.020	50	20	IDGD	
Cc1nnc(CC(=O)N2CCC(OC3CCN(C(=O)[C@H](F)Br)CC3)CC2)o1	1837939399	DNSYWSBIBZJSFC-INIZCTEOSA-N	447.305	1.610	50	20	IDGD	
C[C@H](C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2)n1ccnc1	1839150848	ZFWRHTSGPZGWNT-FHLIZLRMSA-N	433.336	1.137	50	20	IDGD	
Cc1ncsc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2	1839151615	XXBPRAXCRSVHMX-SJORKVTESA-N	436.361	1.758	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc4ncccc4[nH]3)CCO2)C1	1839491415	NQMYIBLPHRIBTI-NRFANRHFSA-N	434.924	1.898	50	20	IDGD	
C[C@H](Oc1ccccc1)C(=O)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1839952024	IEPLCTNFSHKPJX-IFXJQAMLSA-N	431.316	1.714	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccccc3O)C2)C1	1839962887	UMMROGMTIUXJIP-HNAYVOBHSA-N	441.322	1.636	50	20	IDGD	
Cc1noc(C)c1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2	1840031656	YHKHAGRLIQOIMR-PIGZYNQJSA-N	430.299	1.145	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc4ccoc4c3)C2)C1	1840152328	FPJLTXDQLZGWCZ-MGPUTAFESA-N	437.880	1.152	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCCn3ccnc3C)CCO2)C1	1840386395	YMMLPBHQCLDZIU-GHTZIAJQSA-N	440.972	1.836	50	20	IDGD	
Cc1ncc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)s1	1840400707	FKAOSOULYPDNDO-SJCJKPOMSA-N	446.367	1.234	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CCCSC1)CCO2	1840865374	YSBUUYUYNHLMGE-APWZRJJASA-N	430.643	1.438	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H]1CC(=O)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1	1841350109	IPLNDSRCVFKQBE-HUUCEWRRSA-N	429.945	1.579	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)Cc2ccc(Br)cn2)C1	1842091348	BSDAQBIRQILLHH-AWEZNQCLSA-N	430.730	1.844	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)CCOc1ccc(F)cc1)C2	1844263182	BVOQATUUFBAGBS-UHFFFAOYSA-N	441.463	1.110	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC12CN(C(=O)c1cccnc1CS(C)(=O)=O)C2	1846176146	PBHJSQDXAVKOOI-LBPRGKRZSA-N	444.351	1.227	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@H](O)c1cccc(Br)c1)C2	1846363544	PBPDBOUZPYUQHF-GJZGRUSLSA-N	445.741	1.940	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@@H](O)CC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)C(C)(C)CCl	1847438419	PJPKAKLABCYOCA-KKUMJFAQSA-N	431.961	1.729	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)[C@@H]2CC(=O)Nc3cc(F)ccc32)c2ccccc2c1=O	14347670	PDUGJNGBBUABBE-MRXNPFEDSA-N	437.431	1.833	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CCCNS(=O)(=O)c2ccc(F)cc2)cc1OC	15793173	DPJUVQBYDXABQQ-UHFFFAOYSA-N	439.465	1.363	50	20	IDGD	
C[C@@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)NNC(=O)Cc2c[nH]c3ccccc23)C1=O	23750748	AETPPKYDBDQIDT-QFIPXVFZSA-N	437.431	1.464	50	20	IDGD	
Cc1cc(C(=O)NNS(=O)(=O)c2ccc3c(c2)NC(=O)CC(=O)N3)c2ccccc2n1	28679067	ZJFWXMZNUHTJMZ-UHFFFAOYSA-N	439.453	1.447	50	20	IDGD	
COc1cc(I)c(C(=O)NNC(=O)c2ccccn2)cc1OC	110169260	KWOHMGUXPQMMAW-UHFFFAOYSA-N	427.198	1.778	50	20	IDGD	
Cn1nccc1S(=O)(=O)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1	727360198	ZOXWYPDOBYIONN-IBGZPJMESA-N	425.514	1.357	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)[C@@H]1CCCN1C(=O)Cc1ccccc1	728211611	YZEYOYRSJSHYLC-FQEVSTJZSA-N	442.541	1.804	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)c1ccccc1F)C(=O)NNC(=O)Cc1cccnc1	728892663	BNAMIUXFSARQDJ-HNNXBMFYSA-N	440.522	1.011	50	20	IDGD	
O=C(NCc1ccc(OCC2CC2)nc1)NNC(=O)C1CCN(c2ncccn2)CC1	728951382	IPSZSAOPNQEPHM-UHFFFAOYSA-N	425.493	1.407	50	20	IDGD	
C[C@H]1C[C@H](C)CN(C(=O)CN2CCN(C(=O)NNC(=O)c3cccc(C#N)c3)CC2)C1	728954654	LNEYIICFPDDPIU-IRXDYDNUSA-N	426.521	1.035	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2ccc(NNC(=O)c3ccnn3C)c([N+](=O)[O-])c2)cc1	729295507	ZHDFTSYGBPFWNB-UHFFFAOYSA-N	446.445	1.895	50	20	IDGD	
CSCC[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)NNC(=O)c1scnc1C	729452975	SMGRQGISKQWJGN-CYBMUJFWSA-N	437.503	1.672	50	20	IDGD	
C=C(C)CN1CCC(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)CC1	730066812	PPSGXYLSDNWFLD-UHFFFAOYSA-N	449.577	1.456	50	20	IDGD	
Cc1ccc(C(=O)N2CCC(NC(=O)NNC(=O)COc3ccccc3O)CC2)cc1	730910426	HVNQIAWTTKGUJH-UHFFFAOYSA-N	426.473	1.715	50	20	IDGD	
CC(C)(CNC(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccccc1)NS(C)(=O)=O	731651320	DFAHYDCNWNQPSB-SFQUDFHCSA-N	440.529	1.815	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1)NNc1nc(-c2ccccc2)no1	732112881	IJOXYUIPGTULGM-UHFFFAOYSA-N	432.418	1.457	50	20	IDGD	
CCOc1ccc(-c2noc(CCC(=O)NNC(=O)CCN3C[C@@H](C)O[C@H](C)C3)n2)cc1	732261038	AFKFJXAVVZGESZ-HZPDHXFCSA-N	445.520	1.715	50	20	IDGD	
CCC1(CC)NC(=O)N(CC(=O)NNc2ccccc2S(=O)(=O)NC(C)(C)C)C1=O	734252362	PTVDLSMSBBDQMJ-UHFFFAOYSA-N	439.538	1.317	50	20	IDGD	
C=C1c2ccccc2C(=O)N1CC(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	734820923	AKCBENJYYCOIHG-UHFFFAOYSA-N	443.504	1.843	50	20	IDGD	
Cc1ccc(NC(=O)[C@@H]2CCCN(C(=O)NNC(=O)COCc3ccccc3)C2)nc1	738496930	FWKFQDVKRRCKKY-GOSISDBHSA-N	425.489	1.998	50	20	IDGD	
CN(CC(=O)Oc1ccc([N+](=O)[O-])cc1Br)S(=O)(=O)c1cccnc1	739301749	MWGLXMWGBBFSKO-UHFFFAOYSA-N	430.236	1.978	50	20	IDGD	
Cc1ccc(C(=O)NNc2ncnc3[nH]cnc23)cc1S(=O)(=O)NCc1ccccc1	740746755	KJZQCISASZOUFH-UHFFFAOYSA-N	437.485	1.897	50	20	IDGD	
CC(=O)Nc1cccc(-n2cnnc2SCC(=O)NNC(=O)c2ccc(C#N)cc2)c1	742451429	VZEUGEWWXJEOHB-UHFFFAOYSA-N	435.469	1.651	50	20	IDGD	
Cc1ccc(CN2C(=O)CC[C@H]2C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1	742535147	PAMGISMWTYMUQP-SFHVURJKSA-N	429.498	1.351	50	20	IDGD	
COc1cc(C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)cc(NC(C)=O)c1OC	742618125	GJZYHWXMFWGVIB-UHFFFAOYSA-N	448.501	1.860	50	20	IDGD	
CCOCCCn1c(NNC(=O)c2cn(Cc3ccccn3)nn2)nc2ccccc2c1=O	742673590	ZDAUGKJPXFXTSV-UHFFFAOYSA-N	448.487	1.615	50	20	IDGD	
COc1ccc(CC[C@H](C)NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1	743340853	CONPRLKMDSNXCV-HNNXBMFYSA-N	448.545	1.911	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCCc1ccccc1[N+](=O)[O-]	743509874	MNAHEFPUWUFIMC-UHFFFAOYSA-N	434.478	1.383	50	20	IDGD	
Cc1cc(N2CC[C@H](NC(=O)NNC(=O)c3cc4c(s3)CC[C@@H](C)C4)C2=O)n(C)n1	743511689	OKBQSSNHUXYZAK-RISCZKNCSA-N	430.534	1.664	50	20	IDGD	
CN(C[C@H]1CCN(Cc2ccccc2)C1)C(=O)NNC(=O)CNC(=O)c1cccs1	743577645	FPDKTZGFWJXEMT-QGZVFWFLSA-N	429.546	1.673	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CN2CCN(CC(=O)NC3CCC(C)CC3)CC2)c1	744394522	DDBGRFXXYLSWGI-UHFFFAOYSA-N	429.565	1.069	50	20	IDGD	
Cc1ccc(N2C(=O)C[C@H](C(=O)NNC(=O)C(=O)NC(C)C)[C@H]2c2cccs2)cc1	744446525	BVUXTRLXYSUPNA-YJBOKZPZSA-N	428.514	1.823	50	20	IDGD	
C[C@H](O)CC(C)(C)CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	745846230	FDDYPGLIOSWSHQ-HNNXBMFYSA-N	440.566	1.602	50	20	IDGD	
Cc1cc(S(=O)(=O)Nc2ccccc2C(=O)NNC(=O)N2CCOCC2)ccc1F	745992265	XYVFELAFGLCXTE-UHFFFAOYSA-N	436.465	1.622	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)C[C@@H]1C(=O)Nc2ccccc21	746618708	YLFDBTDGMQAKOH-ZDUSSCGKSA-N	431.832	1.779	50	20	IDGD	
Cc1cc(=O)c(C(=O)NNC(=O)Cc2ccncc2)nn1-c1cccc(C(F)(F)F)c1	747324110	ZHUSNXPSWVNSKZ-UHFFFAOYSA-N	431.374	1.958	50	20	IDGD	
COc1ccc(CN2C(=O)c3ccccc3C2=O)cc1C(=O)NNc1nccn(C)c1=O	747942901	LCDVQJAMUXOLRB-UHFFFAOYSA-N	433.424	1.342	50	20	IDGD	
O=C(CCN1C(=O)[C@H]2[C@H](C1=O)[C@H]1CC[C@H]2O1)NNc1ccc(F)cc1Br	748074134	PMUBGKUWHNSPHN-QHSBEEBCSA-N	426.242	1.584	50	20	IDGD	
CC[C@H](CNC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)Oc1ccccc1F	748977550	RDXPEVWDCADVQT-CYBMUJFWSA-N	427.436	1.874	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@@H]2CCCN(Cc3cccnc3)C2)c2ccccc2c1=O	749160749	OGPHTVMJEQYRDI-QGZVFWFLSA-N	434.500	1.485	50	20	IDGD	
O=C(NNc1nc(Br)cn2ccnc12)c1cc2c(cc1[N+](=O)[O-])OCCO2	750248167	XNBKEKBQSGRRMZ-UHFFFAOYSA-N	435.194	1.928	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)c1nc(-c2cccs2)n(-c2ccccc2)n1	751201847	LVYFOOJAGVFZEM-UHFFFAOYSA-N	436.453	1.780	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CNC(=O)c2cccs2)cc(OC)c1Br	751209521	RAZIFNKCBQPLGU-UHFFFAOYSA-N	442.291	1.719	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N1CCC2(CC1)CNC(=O)C2	752001472	BZOKJPJXRPRJKU-GFCCVEGCSA-N	439.310	1.559	50	20	IDGD	
CCc1cc(Br)ccc1NNC(=O)NCCN1CCN(S(C)(=O)=O)CC1	753149715	WFZZCOKQEPKISJ-UHFFFAOYSA-N	448.387	1.215	50	20	IDGD	
Cc1noc(C2CCC(NC(=O)NNC(=O)Nc3ccc(S(C)(=O)=O)cc3)CC2)n1	753345849	FYYDMQJZIPWBPX-UHFFFAOYSA-N	436.494	1.844	50	20	IDGD	
COc1cc2c(cc1OC)CN(C(=O)CCC(=O)NNc1cc(Cl)nc(N)n1)CC2	753454810	XJJOYCZYZSTCGR-UHFFFAOYSA-N	434.884	1.538	50	20	IDGD	
CC(C)OCCCn1c(NNC(=O)Cc2ccc(C(N)=O)cc2)nc2ccccc2c1=O	754214843	CGAZIIHECKULIU-UHFFFAOYSA-N	437.500	1.996	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)Nc1ccc(N2CCc3sccc3C2)cc1	756276959	OMGCHDGEQLNSQI-AWEZNQCLSA-N	434.543	1.898	50	20	IDGD	
CCc1ccc(NC(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)cc1S(N)(=O)=O	756523789	FNEIWMRCCJTRTH-UHFFFAOYSA-N	434.503	1.815	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CN2CCN(CC(=O)Nc3ccc(Cl)cc3)CC2)cc1	756649141	AVPGBJVMUFRDPD-UHFFFAOYSA-N	443.935	1.666	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)N[C@@H]1CCN(C(=O)CCc2ccccc2)C1	756981826	BTIPNNHMPKDBJJ-XLIONFOSSA-N	438.484	1.391	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)Nc2cccn(Cc3ccccc3)c2=O)c2ccccc2c1=O	757658005	OALDKZNBIYRIMQ-UHFFFAOYSA-N	444.451	1.610	50	20	IDGD	
Cc1ccc(NC(=O)OC(C)(C)C)cc1NC(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1	757770875	QKZKQIAHCFFMNI-LBPRGKRZSA-N	426.495	1.929	50	20	IDGD	
COc1ccc(C(C)(C)C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)cc1OC	758132185	BLDBKWMWRHYIAB-UHFFFAOYSA-N	425.441	1.857	50	20	IDGD	
CN1CCN(c2ncc(C=NN(C)C(=O)N3CCN(C(=O)OC(C)(C)C)CC3)cn2)CC1	758138457	KKTDELUMJUZPGC-UHFFFAOYSA-N	446.556	1.167	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)c1ccccc1CN1CCOCC1	758482329	PZEHRECJZSFHPS-UHFFFAOYSA-N	425.485	1.374	50	20	IDGD	
Cc1ccc(Cl)cc1N1CC[C@@H](CNC(=O)NNC(=O)C(=O)Nc2ccccn2)C1	758740227	MAIYLMGPUVCDST-AWEZNQCLSA-N	430.896	1.839	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H](C#N)[C@@H](NC(=O)NNC(=O)Cn2ccc3ccccc32)C1	758749469	BAKZINMITAAWIS-HOTGVXAUSA-N	426.477	1.731	50	20	IDGD	
O=C(NNC(=O)N1CCN(c2ncc(F)cn2)CC1)c1ccc(Br)s1	759216649	OVRDTERVXQEFEV-UHFFFAOYSA-N	429.275	1.616	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C2(CNC(=O)OC(C)(C)C)CC2)c2ccccc2c1=O	759380477	ZZQXXQFCYXUAGQ-UHFFFAOYSA-N	429.477	1.482	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1ccc(-c2nnc(S)o2)cc1	759380861	OZGLCGGTKWDFHI-UHFFFAOYSA-N	446.514	1.702	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2Br)C[C@@H](C)O1	760787889	MUYKMXXMZCGLJL-GHMZBOCLSA-N	429.271	1.618	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2ccc(=O)n(-c3cnn(C)c3)c2)ccc1OC(C)C	760802520	YRRJBFKVHOWLRO-UHFFFAOYSA-N	425.445	1.442	50	20	IDGD	
O=C(NN=c1cc[nH]c2ccccc12)c1cc(S(=O)(=O)N2CCOCC2)ccc1F	761565718	VWLJSITVAFPDLA-UHFFFAOYSA-N	430.461	1.574	50	20	IDGD	
O=C(NNC(=O)c1ccncc1)C(=O)Nc1cccc(C(=O)N2CCc3ccccc32)c1	763463067	VNNBIVLVRVVGPF-UHFFFAOYSA-N	429.436	1.684	50	20	IDGD	
CO[C@@H](CNC(=O)NNC(=O)c1csc(N2CCOCC2)n1)c1ccccc1Cl	763540184	YKZWVTHXPKRSHV-HNNXBMFYSA-N	439.925	1.965	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)C(=O)Nc2c(C)c(C)nn2C)cc(OCC)c1OCC	763542454	FUZHANSWAPLQPY-UHFFFAOYSA-N	447.492	1.633	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)NC[C@@H]1CC(=O)N(Cc2ccccc2)C1	763546028	MJIPEPSUAHUUCK-INIZCTEOSA-N	428.514	1.863	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2cc(S(C)(=O)=O)ccc2Cl)c1	763624775	NOUOZBOANFXJRQ-UHFFFAOYSA-N	439.877	1.217	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C)c(C)c2)c(C)c1	763666887	MCQIENAIPMBBOI-UHFFFAOYSA-N	429.473	1.802	50	20	IDGD	
CN(C)C(=O)c1ccccc1NC(=O)C(=O)NNC(=O)CSc1ccc(Cl)cc1	763736241	REVDXTWKYKOVSV-UHFFFAOYSA-N	434.905	1.920	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)C(=O)Nc1c2c(nn1-c1ccccc1)CCC2	763841502	RUJMDSLGKVWLGF-UHFFFAOYSA-N	437.431	1.665	50	20	IDGD	
CC(=O)N(C)c1cccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)c1	763851333	SFEHXLXQSVHLNU-HNNXBMFYSA-N	426.473	1.840	50	20	IDGD	
COc1cc(OC)c(OC)cc1NC(=O)C(=O)NNC(=O)Cc1c[nH]c2ccccc12	763865265	NGYBNEHKUKXCKH-UHFFFAOYSA-N	426.429	1.522	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccccc2O[C@H](C)C#N)cc1OC	763900114	ANUJKAKGSURBEJ-CYBMUJFWSA-N	426.429	1.784	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cccnc2Br)cc1OC	763900160	GQSWCBUPEAIPOK-UHFFFAOYSA-N	437.250	1.651	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3ccc(S(C)(=O)=O)nc3)cc2C1	763941990	LJDAIYQGAIIHRP-SNVBAGLBSA-N	436.515	1.071	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ccccc2C)ccc1C	763957917	OBXFWDZDDZGLFR-UHFFFAOYSA-N	446.529	1.734	50	20	IDGD	
Cc1ccc(Cn2nccc2NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)s1	764003204	CENCWDKZHPIDAA-UHFFFAOYSA-N	441.469	1.472	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cccc(Br)c2)cc1F	764062713	AXSWGIGTMKHHBL-UHFFFAOYSA-N	438.209	1.775	50	20	IDGD	
CC(C)N1CCN(c2cccc(NC(=O)C(=O)NNC(=O)c3ccc(Cl)nc3)c2)CC1	764092291	IVULENZKEKLDJK-UHFFFAOYSA-N	444.923	1.665	50	20	IDGD	
CCOC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)cc1C#N	764243138	NBUMWIBPJDTJBC-UHFFFAOYSA-N	448.439	1.867	50	20	IDGD	
COc1ccc(Cn2nccc2NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)cc1	764244186	CONPZTMWKKRSMI-UHFFFAOYSA-N	446.467	1.681	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2O)cc1Cl	764275996	VUESKQPRKZDXSV-UHFFFAOYSA-N	437.836	1.236	50	20	IDGD	
CCOC(=O)c1cc(F)c(F)cc1NC(=O)C(=O)NNC(=O)CCc1ccccc1O	764289454	UQWODCIKLDNHNY-UHFFFAOYSA-N	435.383	1.566	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1F)C(=O)Nc1ccc(NC(=O)[C@@H]2CCCO2)cc1	764412617	KNPLKODVCMGORA-INIZCTEOSA-N	448.838	1.996	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@]2(CCN(CC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)C2)C1	765028746	CYFWYMCCQRALJD-OAQYLSRUSA-N	447.492	1.689	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1	765323648	SIRBVMRFPYQFFJ-UHFFFAOYSA-N	432.437	1.846	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1cc(S(=O)(=O)N2CCCCC2)ccc1C	766265207	YUSGRIRAFQAEBJ-UHFFFAOYSA-N	448.505	1.050	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)c1cnn2ccccc12	766661800	ZFCFCHJAJRMPLV-UHFFFAOYSA-N	426.908	1.567	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1	767287661	VLPMTPUHHWINCG-UHFFFAOYSA-N	437.412	1.636	50	20	IDGD	
CC(C)(C)[C@H](Br)C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	768274062	CPWXLSLWFCZDOP-MRXNPFEDSA-N	439.354	1.401	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)CN2C(=O)N[C@@]3(CCCC(C)(C)C3)C2=O)c1	768571643	VAZNVWFAFBPDQT-JOCHJYFZSA-N	430.505	1.720	50	20	IDGD	
C[C@@H](CNC(=O)NNc1nc(O)c2cnn(C)c2n1)Oc1cccc(Br)c1	770397335	AHWUKIFMWZQMAV-VIFPVBQESA-N	436.270	1.925	50	20	IDGD	
CC1(C)NC(=O)N(CCCC(=O)NNC(=S)Nc2cccc(Br)c2)C1=O	770995945	KCBQHIQRBNGBLX-UHFFFAOYSA-N	442.339	1.877	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)c(F)c1	771608484	SSRPBXQVDMVJHZ-UHFFFAOYSA-N	442.856	1.063	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccc(Br)cn1	773529493	RPKYKQZPLMLBTL-SECBINFHSA-N	425.214	1.537	50	20	IDGD	
CC(=O)N1CCN(Cc2ccc(NC(=O)C(=O)NNc3ccc4ccccc4n3)cc2)CC1	773661007	CPWMTTQOZRTVQN-UHFFFAOYSA-N	446.511	1.981	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)C(=O)N(C)CC2	774009350	OGBIQJIZIBUNNI-GFCCVEGCSA-N	444.875	1.522	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)N[C@H]1CCN(c2ccc(F)c(Cl)c2)C1=O	777751403	DGXGCTOMVCBAGI-HNNXBMFYSA-N	448.838	2.000	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNS(=O)(=O)c1c(Cl)cc(Cl)cc1[N+](=O)[O-]	777939013	ILTUPQFBUZFSBP-UHFFFAOYSA-N	443.265	1.736	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3noc4c3CCCCC4)CC2)cc1	780925191	CDANTAXPMYTQIO-UHFFFAOYSA-N	425.533	1.831	50	20	IDGD	
COc1ccc(CN(CC(=O)NNC(=O)c2ccc(C)cc2)[C@H]2CCS(=O)(=O)C2)cc1	781348344	HEFSOCIVRWPYRJ-IBGZPJMESA-N	445.541	1.454	50	20	IDGD	
Cc1cc(C)c(NNC(=O)C(=O)Nc2c(C)nn([C@H]3CCS(=O)(=O)C3)c2C)c(C)c1	783369142	JQHBLIRGQXYXLM-INIZCTEOSA-N	433.534	1.867	50	20	IDGD	
CC(C)(C)OC(=O)c1ccccc1NC(=O)C(=O)NNC(=O)CNC(=O)c1cccs1	784003128	AEXDSDJSVLVVIY-UHFFFAOYSA-N	446.485	1.219	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CNC(=O)c2ccco2)c(OCC(F)(F)F)c1	784004051	HJCNXYRZPGEONL-UHFFFAOYSA-N	442.350	1.045	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1ccc(Br)c(F)c1	784004599	HQPRYWABDWQIDG-UHFFFAOYSA-N	443.254	1.166	50	20	IDGD	
O=C(NNc1ccc(Cl)nn1)C(=O)Nc1cc(N2CCCS2(=O)=O)ccc1Cl	784792120	GHHWJJMSHQZNJS-UHFFFAOYSA-N	445.288	1.405	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)C(=O)Nc2cccc(N3CCCS3(=O)=O)c2)c1	784853732	NKTHUIHATBBFAC-UHFFFAOYSA-N	432.458	1.095	50	20	IDGD	
C[C@H](OC(=O)/C(C#N)=C\c1ccccc1)C(=O)NCCc1ccc(S(N)(=O)=O)cc1	785364546	QGELDEKFZMNFJW-LUJRCDHRSA-N	427.482	1.532	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)C(=O)Nc1ccnc(Oc2ccc(F)cc2F)c1	789735233	VROQNEQIOYNLKY-UHFFFAOYSA-N	427.367	1.876	50	20	IDGD	
CCCCNC(=O)CN1CCN(C(=O)/C(C#N)=C\c2cc(C)n(CCOC)c2C)CC1	790222266	NTYSVTUJMRNSPU-QNGOZBTKSA-N	429.565	1.719	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1cccc(CCC(=O)OC(C)(C)C)c1	791909056	FVYXDKVIHAZEFJ-LBPRGKRZSA-N	428.511	1.051	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@H](C#N)Cc2ccc(C#N)cc2)cc1	792018328	VGKTZZREUOGCAR-SFHVURJKSA-N	439.497	1.017	50	20	IDGD	
CS(=O)(=O)Nc1ccc(/C=C\C(=O)NNC(=O)CNC(=O)OCc2ccccc2)cc1	794061828	MUKXTTHFRKYBIV-XFXZXTDPSA-N	446.485	1.145	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN[C@H](CO)c2ccc(Br)c(F)c2)n1	795351516	XLIBOCUZGMOTIF-CYBMUJFWSA-N	445.314	1.366	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)[C@@H]2C[C@H]3C[C@H]3N2C(=O)OC(C)(C)C)n1	796039077	ZDQINUFCPIJLNE-UPJWGTAASA-N	438.506	1.083	50	20	IDGD	
COc1ccc(F)c2[nH]c(C(=O)OCC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)cc12	796200651	PZTJSAPPZVTCOA-UHFFFAOYSA-N	430.348	1.842	50	20	IDGD	
Cc1nc([C@H]2CCCOC2)sc1C(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	796234933	STOJFPSGYXVKMQ-ZDUSSCGKSA-N	448.457	1.872	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2c(Cl)ccc3c2CCO3)c1	797667126	WMJKHOVHJBTNMK-UHFFFAOYSA-N	438.893	1.992	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)N(C)[C@H](C)c1ccc(S(N)(=O)=O)cc1	799856493	GKCQWUUVOQUYHA-CYBMUJFWSA-N	430.490	1.338	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)N=c3cc[nH]cc3)CC2)cc1C	802029247	KAOQHLXTZWYABJ-UHFFFAOYSA-N	431.518	1.374	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)[C@@H]2CC[C@@H](C(F)(F)F)NC2=O)cc1Cl	802074592	RYOUSZDZEWBIQZ-KRTXAFLBSA-N	438.790	1.967	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN([C@H](CNC(=O)NNc2ncccn2)C(F)(F)F)CC1	802465828	SOKSGSLFTHESBT-GFCCVEGCSA-N	433.435	1.586	50	20	IDGD	
CCn1c(=O)c(C(=O)/C(C#N)=C\c2cn(C(C)C)nn2)c(N)n(Cc2ccccc2)c1=O	806569638	FFUSWKDXEYEGFE-YBEGLDIGSA-N	433.472	1.623	50	20	IDGD	
O=C(NCCCn1ccc2ccccc21)NNC(=O)c1csc(N2CCOCC2)n1	807007492	IXORYYAHMWVYNI-UHFFFAOYSA-N	428.518	1.969	50	20	IDGD	
O=C(NNC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1)c1cc(Br)c[nH]1	807148311	BJPKHEVKGTULTP-UHFFFAOYSA-N	437.254	1.862	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)CNS(=O)(=O)c1cccc(Br)c1	810375160	SZDRHROEBCXKMV-UHFFFAOYSA-N	442.291	1.197	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(F)c(C(=O)OC)c2C)o1	810386838	UFTCTQUHAOOFLE-UHFFFAOYSA-N	448.451	1.755	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)Nc2cccc(N3C(=O)NC(C)(C)C3=O)c2)cc1	812972086	CIKGFIVNNOUKRF-UHFFFAOYSA-N	441.444	1.762	50	20	IDGD	
CCCc1nc(C)c(NC(=O)C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)s1	813033497	WHCHCXBWZYGTFR-UHFFFAOYSA-N	425.536	1.736	50	20	IDGD	
C[C@@H](Cc1cnc2ccccc2n1)C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	814736407	NOKLJOJOGVKLFN-NSHDSACASA-N	447.904	1.570	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)COc2ccc3c(c2)CCC(=O)N3)c2ccccc2c1=O	871267186	LUDSPSXQEXEDDZ-UHFFFAOYSA-N	449.467	1.702	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)CCNC(=O)c2ccc(C(C)(C)C)cc2)C[C@H](C)O1	912924587	AEEIXITUEVBWOJ-IRXDYDNUSA-N	432.565	1.751	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCC(=O)NNC(=O)COc2cc(C)ccc2C(C)C)cc1	913419363	MPEIYTIGFJMXTK-UHFFFAOYSA-N	433.530	1.932	50	20	IDGD	
Cc1cc([N+](=O)[O-])c(C)cc1OC(=O)c1ccc(S(=O)(=O)N2CCNC(=O)C2)cc1	914469904	KAUHCEDDEKWAFB-UHFFFAOYSA-N	433.442	1.551	50	20	IDGD	
CC(C)CNS(=O)(=O)c1ccc(C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1	914747985	ZESSDXUEKDPUPI-SFHVURJKSA-N	433.486	1.222	50	20	IDGD	
Cc1cc(C)c(N2C[C@H](C(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)CC2=O)c(C)c1	915076966	XLUHUCLVQXOVNI-QGZVFWFLSA-N	443.525	1.829	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)oc2c1C(=O)CCC2	916133298	DBLNNHJSIQUBDF-UHFFFAOYSA-N	425.850	1.483	50	20	IDGD	
COc1cc(OC)cc([C@H](NC(=O)NNc2ccc(-n3cccn3)nn2)c2nccn2C)c1	916229801	ZCKCNQWCCIBRFB-IBGZPJMESA-N	449.475	1.829	50	20	IDGD	
Cc1ncc2c(n1)CC[C@H](NC(=O)NNC(=O)CCN1CCN(c3ccccc3)CC1)C2	916320163	HIJGOJUUOCNUIT-IBGZPJMESA-N	437.548	1.185	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(S(=O)(=O)NC(C)C)cc2)cc1C	916562709	UCTNDIBCGNEFLW-UHFFFAOYSA-N	432.502	1.390	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@H]2CCN(C3CC3)C2)c1	916578061	SEGDKHQLJRMDRK-OAHLLOKOSA-N	437.566	1.145	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCOc2cccc(Cl)c2)c1	916646554	ZFRWYXFWJDGKPI-UHFFFAOYSA-N	440.909	1.613	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cn(C)nc2C(F)(F)F)c1	917360838	OFEWMCIJEMCJKG-UHFFFAOYSA-N	447.439	1.544	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)c2nc(N3CCCC3)ncc2Cl)c2ccccc2c1=O	917387460	SEWLDBNGBIHKJY-UHFFFAOYSA-N	427.852	1.052	50	20	IDGD	
Cc1nc(-c2cccnc2)nc(O)c1CC(=O)NNC(=O)c1cc(Br)c[nH]1	918209814	IMXWRGRVHHEHEV-UHFFFAOYSA-N	431.250	1.647	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NCCCCOCCc2ccccc2)c2ccccc2c1=O	918220410	FAQFBPRZZVESCA-UHFFFAOYSA-N	437.500	1.917	50	20	IDGD	
COc1ccc(C(=O)Nc2cccc(C=NNC(=O)N[C@H]3CCS(=O)(=O)C3)c2)cc1	920381779	UGMSQPPOGRZLHW-KRWDZBQOSA-N	430.486	1.768	50	20	IDGD	
Cc1ccn(-c2cccc(C(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)c2)n1	1115896540	CKJYEIFZCQAMRT-UHFFFAOYSA-N	427.486	1.506	50	20	IDGD	
COc1ccc(-c2nnc(SCC(=O)NNC(=O)c3n[nH]c4c3CCCC4)o2)cc1	1248564358	KBKHPWHKABIRLD-UHFFFAOYSA-N	428.474	1.900	50	20	IDGD	
CC1(C)NC(=O)N(CCCNC(=O)NNC(=O)CSc2ccc(Cl)cc2)C1=O	1263757896	JCAHHRUEMFOZKP-UHFFFAOYSA-N	427.914	1.483	50	20	IDGD	
Cc1cc(CN2CCCN(C(=O)NNC(=O)c3cc(Br)c[nH]3)CC2)no1	1318095923	QYUWEGQVQZQDSI-UHFFFAOYSA-N	425.287	1.636	50	20	IDGD	
COc1cc(Br)c(OC)c(C(=O)NNC(=O)CCN2C[C@H](C)O[C@@H](C)C2)c1	1318705405	ZXKNCVRPDNDICU-RYUDHWBXSA-N	444.326	1.727	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)c1ncoc1[C@H]1CCCO1	1319220890	WYZJQUAEMDATOU-QGZVFWFLSA-N	447.923	1.758	50	20	IDGD	
Cc1n[nH]c(C)c1C[C@H](C)C(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	1319303817	UTAKFSCXLCIFIV-HNNXBMFYSA-N	446.983	1.824	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Nc2ccccc2S(=O)(=O)N1)Nc1ccc(OC(F)F)cc1	1321789890	XDVSEMBOKVJJJF-CYBMUJFWSA-N	427.389	1.171	50	20	IDGD	
CC(=O)c1cc(S(=O)(=O)NNC(=O)c2n[nH]c3c2CCCC3)ccc1Br	1323445751	PVDAXBZYBXMQBM-UHFFFAOYSA-N	441.307	1.877	50	20	IDGD	
CC(C)c1nn([C@H]2CCS(=O)(=O)C2)cc1C(=O)NNC(=O)Cc1cn2ccccc2n1	1330403338	DEBKOJPQOJQBAM-HNNXBMFYSA-N	444.517	1.018	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc4cccn4cn3)C2)C1	1778042869	KJXORRLQNQYYSN-IFXJQAMLSA-N	435.322	1.809	50	20	IDGD	
O=C(c1nc(O)n2c1CCCC2)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1779348675	ZPQMMXYASDHOIW-DYVFJYSZSA-N	445.289	1.059	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cccn(C(F)F)c3=O)C2)C1	1779363731	YBQIIXIAXJPSAX-DIFFPNOSSA-N	448.264	1.470	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc([N+](=O)[O-])[nH]1)C2)[C@H](F)Br	1780773669	LKSTVOSNBTXLFP-PVXIVEMSSA-N	447.261	1.741	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)COC(=O)C(F)(F)F)CCO2)C1	1781230085	MVJXFAONHAAOGX-KBPBESRZSA-N	435.226	1.158	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)N1CCO[C@]2(CCN(C(=O)[C@](C)(Cl)CCl)C2)C1	1781233236	ROFXFONXCSGUKU-CSMYWGQOSA-N	425.309	1.614	50	20	IDGD	
O=C(c1cc2cn[nH]c2cn1)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781331518	MBZJRNCZYRVNFY-XJKSGUPXSA-N	426.246	1.092	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H]3CC(c4ccccc4)=NN3)C2)C1	1782606663	OASHWOPSYYBMNR-JNAXZKDPSA-N	449.349	1.366	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2	1782708893	YJVXGCWKJFLURZ-JLZZUVOBSA-N	425.309	1.614	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccnnc1)CCO2	1782863696	IZJDNRHGSPRPPO-CQTHNFAISA-N	439.422	1.805	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H]3CCCO3)C2)C1	1783480931	DPNOTOXSFWUAKF-GHTZIAJQSA-N	447.444	1.143	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(=O)c3ccc(Cl)cc3)[C@H]2C1	1784061000	HFTPZWDJHQJOQC-LLLHUVSDSA-N	443.327	1.756	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3ccc(F)c(F)c3)C[C@@H]21)[C@@H](O)CCl	1784084482	UTYUNQCIUXHTNY-USJZOSNVSA-N	430.879	1.477	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(F)(C(=O)N2CC[C@@]3(CN(C(=O)[C@@H](F)Cl)CCO3)C2)C1	1785685792	OLFSHWYCIUNTPF-SJKOYZFVSA-N	437.871	1.310	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](CN)c3ccccc3)[C@H]2C1	1786924893	UHCHYHOEHYFVJJ-SOADLSRISA-N	442.387	1.945	50	20	IDGD	
C[C@H](Nc1cnccn1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)Br)C[C@@H]21	1788630313	LRCHGRBTHWUALS-QTVXIADOSA-N	440.342	1.040	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(F)nc3F)C[C@@H]21	1788762385	UTKMHWYNZVVLND-QEJZJMRPSA-N	427.524	1.805	50	20	IDGD	
Cc1cc(CC(=O)NC2(c3ccc(NC(=O)c4cnccc4C(=O)NN)cc3)CCC2)no1	1789523561	JKALXONRWKEYER-UHFFFAOYSA-N	448.483	1.972	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CC[C@@H]3CCOC3)C[C@@H]21	1790964276	WGAQIEVIFUEKGX-HMDCTGQHSA-N	431.371	1.956	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)NNc3ccccc3)C[C@@H]21	1791250274	CLKOKRQXGHHTDE-JAQSECSASA-N	438.956	1.225	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3ccc(OC)cc3)C[C@@H]21	1791251426	GQLCXFQZKUIYLL-FFGOWVMKSA-N	438.952	1.861	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)n3cccc3C=O)C[C@@H]21	1791254888	VWECFUTZOUNUOU-SRIISGBFSA-N	425.913	1.095	50	20	IDGD	
CC/C=C(\C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C[C@@H]21	1791871230	KPYLJYCWNUBMFG-JSGDAKEHSA-N	429.521	1.456	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCc1ccc(F)c(F)c1	1792746683	JIEUSNBDKYBCFO-YGTYGHESSA-N	430.879	1.741	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C=C/C(=O)NCc1ccccc1	1792941248	HKHZARDQIWQTDI-FQZNYOGHSA-N	433.936	1.466	50	20	IDGD	
O=C(Cn1ccc2ccc([N+](=O)[O-])cc21)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2	1793212073	RREDWYQHRVNRDG-JGTCGTHISA-N	438.843	1.674	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCc1cccc([N+](=O)[O-])c1	1793701660	KOHZSIHZBOCQKB-LORHWOILSA-N	439.896	1.371	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1CCC(CO)CC1	1793854393	YHUMOFNLFAIGED-VONXPYPISA-N	431.371	1.548	50	20	IDGD	
COc1cncc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Br)C3)c1	1794056046	WVMGUZVJSIMVEO-DLTLXFJOSA-N	444.301	1.303	50	20	IDGD	
CC[C@@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCC(=O)NN(C)C)C2)c1ccccc1	1795079750	LYGZSHQVJOIDJK-VQQMMKBISA-N	430.549	1.143	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CO)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCBr)C2	1796739375	RUYRMYDLJMWWAL-CRWXNKLISA-N	448.358	1.295	50	20	IDGD	
O=C1Cc2cc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)CCBr)C4)ccc2N1	1797329083	TTWGERXGCBEVIA-ZSBFGKGUSA-N	436.306	1.169	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)CBr)C3)o1	1797743645	KCUDAIXEBNIILB-VFFTVRQLSA-N	442.310	1.472	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(F)cc(F)c1F)C2	1798443567	JAGIXWOXNPTSKS-CLLJXQQHSA-N	447.417	1.668	50	20	IDGD	
CC(=O)OC[C@@H](OC(C)=O)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@](C)(Cl)CCl)C2	1798475353	ZNAPAVJOGDQJNM-KQVLKZGSSA-N	437.320	1.356	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccn(C)n1)C2	1799219990	CYYGRIYLYBPGGW-QDMKHBRRSA-N	441.444	1.819	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1ccc(F)nc1)C2	1799274354	ZHLBFPSYXGFTSZ-QOIYZWAUSA-N	432.323	1.979	50	20	IDGD	
C[C@H](Sc1ccccn1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Br	1799352435	WTRRXUSIWOGXFM-QIRZIZBZSA-N	446.342	1.842	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)c1cc(F)cc(C(F)(F)F)c1	1799529558	DSQFMXCIEBWADT-BAESOJJISA-N	438.805	1.647	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(O)c(F)c1	1800420689	OELZAQLRTJRGGZ-BTTYYORXSA-N	427.436	1.095	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)CN(CC)CC)C2	1800643623	YISZRQHLRFUSTD-UHDSXZAQSA-N	432.403	1.727	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnccc1C(F)(F)F)C2	1800975615	NWUQJDPISOZKBB-JLUCKKNBSA-N	435.830	1.557	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](CC1CC1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](O)CCl)C2	1802173264	VCJCLUCQRWOCMZ-ZHCJQAHYSA-N	443.972	1.918	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)[C@H](O)N2CCOCC2)[C@@H]1c1cccnc1	1803691288	BMAAKIIJSVDTMB-GNBUJSLZSA-N	438.956	1.146	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@H]1c1cccnc1)c1ccc(O)nn1	1805274759	GTXATFRUDLMRNY-TUKIKUTGSA-N	438.257	1.587	50	20	IDGD	
Cc1ccncc1CCC(=O)N1CCCC2(CCN(C(=O)c3ccc(B(O)O)cc3)CC2)C1	1807070748	OBFDIGQBDZCWTA-UHFFFAOYSA-N	449.360	1.547	50	20	IDGD	
Cc1noc(CC(=O)NC[C@@H]2CCN(C(=O)[C@H](C)Br)[C@H]2c2cccnc2)n1	1807527712	GXIMNCHLRSCHSE-YLVFBTJISA-N	436.310	1.805	50	20	IDGD	
CC(C)CNC(=O)C(=O)N1CC[C@H](CNC(=O)[C@@H](F)Br)[C@H]1c1cccnc1	1808661731	CXTNOXAKMZYRCA-RBSFLKMASA-N	443.317	1.550	50	20	IDGD	
Cc1[nH]ccc1C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1808750322	OAPOTCWBILLWDH-NQIIRXRSSA-N	432.289	1.031	50	20	IDGD	
N[C@@H](Cc1cscn1)C(=O)N1CCCC2(CCN(C(=O)[C@H](F)Br)CC2)C1	1810799659	RNOKVHZNVJVNQA-KBPBESRZSA-N	447.374	1.935	50	20	IDGD	
CC(C)CCC(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1	1812601201	XAZCOUZUTOKHNW-LAUBAEHRSA-N	438.532	1.836	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)CSCC(=O)O)[C@H]1c1cccnc1	1812867141	FGRRPXAEFGSUNI-GHJWDPDVSA-N	444.351	1.689	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)[C@@H](O)CCl)n[nH]2)n1	1814868078	VALMOQFUUPBRLY-GJZGRUSLSA-N	434.884	1.669	50	20	IDGD	
Cc1nc[nH]c1CSCC(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](O)CCl)n[nH]1	1814873376	QFGIIVDRYUOCDG-GJZGRUSLSA-N	440.957	1.966	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)C(C)(F)F)CC2	1817279854	ITPWDWMOBOCRHT-RYLVXRGGSA-N	438.460	1.844	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@H]2C[C@]2(F)Cl)[nH]n1)c1ccc(B(O)O)cc1	1817475744	RIDGBQUIYAHHFC-FRIZHTMISA-N	434.664	1.320	50	20	IDGD	
Cc1nc2ncccn2c1C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1	1818667985	UBHVQNHEMNLRFI-ZIAGYGMSSA-N	431.884	1.666	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1CCc2nc(NC(=O)CCc3nc(N)n[nH]3)sc2C1	1819560219	UZHJCGJTWVVXIV-BCTVWOGZSA-N	446.364	1.625	50	20	IDGD	
COC[C@H](NC(C)=O)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](F)Br)n[nH]1	1820935345	KQQQPYYAHRLAQT-SGMGOOAPSA-N	448.293	1.243	50	20	IDGD	
CN1C(=O)CC[C@H]1C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](F)Br)[nH]n1	1820955333	LCBQONABUHXGTC-UHIISALHSA-N	430.278	1.713	50	20	IDGD	
CC(=O)NCCC(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](C)CBr)[nH]n1	1821978411	QGWDQRBEBUGQQE-SMDDNHRTSA-N	428.331	1.959	50	20	IDGD	
C[C@H](Br)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CN2CCN(C)CC2)[nH]n1	1822186775	JEQGJFGTXOGDBZ-DZGCQCFKSA-N	441.374	1.433	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)C[C@H](NC)C(=O)O)CC2	1825446941	LXUUXRHPZFRXCU-YWVKMMECSA-N	447.355	1.291	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)N[C@H]1CCc2nc(NC(=O)[C@H](C)Br)sc2C1	1825641363	NVLBLHWDZAWTGW-NGZCFLSTSA-N	431.356	1.705	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CN1CCOCC1)CC2	1825642857	WFVOQGAYBCGZFO-GHMZBOCLSA-N	431.356	1.171	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cnccn2)CC1	1825802048	CMSJCBLXJCLAEK-IBGZPJMESA-N	437.504	1.022	50	20	IDGD	
O=C(N[C@H]1CCc2nc(NC(=O)C(Cl)Cl)sc2C1)c1cc2n(n1)CCNC2=O	1826096384	RXRWAKVJPZIQNW-ZETCQYMHSA-N	443.316	1.113	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1CCc2nc(NC(=O)CSCC(=O)O)sc2C1	1826114699	VYWDWPBRJSXWFW-SNVBAGLBSA-N	431.612	1.724	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@H]2CCC(=O)N2)CC1	1826657455	JVHWTKPPYGRNNX-FVQBIDKESA-N	428.371	1.916	50	20	IDGD	
O=C(N[C@H]1CCc2nc(NC(=O)[C@H]3CCCSC3)sc2C1)c1ccc(B(O)O)cc1	1828153888	ZZZYRDYEHDXSME-ZFWWWQNUSA-N	445.375	1.192	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2nc3ncccn3n2)CC1	1828179567	BZZBFFBCIRSWNT-JKSUJKDBSA-N	434.928	1.611	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2csnn2)CC1	1828923376	GVIMNLJIXJNNQO-QGZVFWFLSA-N	443.533	1.084	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3CCC(CO)CC3)C2)C1	1830358707	RBIKOWMZUBDXCO-MYKUNDNFSA-N	430.973	1.507	50	20	IDGD	
O=C(c1c(F)cccc1Cl)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1830731200	HTXUFHGKFLIZBP-KBXCAEBGSA-N	435.279	1.149	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C1(COC)CC1)CCO2	1831383210	KPSZSJBLRCGINX-RDTXWAMCSA-N	433.343	1.043	50	20	IDGD	
CC[C@@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1)N(CC)CC	1831662168	NLTOGXNYFZXMHZ-UWJYYQICSA-N	432.005	1.828	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3nnsc3C3CC3)CC2)CC1)[C@@H](O)CCl	1833310928	YBBUHDNZCJDJCQ-HNNXBMFYSA-N	441.985	1.200	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@H](C)n3ccnc3)CC2)CC1	1833378889	WLPJVTHJVHTIQR-YJBOKZPZSA-N	425.961	1.270	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccsc3)CCO2)C1	1833968889	YWBLBNVDJYNSIY-YOEHRIQHSA-N	431.352	1.992	50	20	IDGD	
Cc1cnc(C(=O)NC2CCN(C3CCN(C(=O)[C@H](C)Br)CC3)CC2)cn1	1834162510	BJBMLDJSGAVZBQ-AWEZNQCLSA-N	438.370	1.754	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)c3cncn3C)CC2)CC1	1834242586	BUAJALLLDMNENH-CQSZACIVSA-N	440.386	1.636	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccc(Cl)cc3)CCO2)C1	1835062280	GNUGOTWFIWNTOQ-PXNSSMCTSA-N	445.343	1.593	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)c3cn[nH]c3)CC2)CC1	1835169474	VNFJDOKHYMUCET-CYBMUJFWSA-N	426.359	1.626	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC1CCN(C2CCN(C(=O)CSCC(=O)O)CC2)CC1	1835837451	HYPLGDVUGAEFAI-UHFFFAOYSA-N	445.658	1.227	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)n1cccc1C=O)CCO2	1835957196	BJCJUMKHDJRXQD-SYNHAJSKSA-N	425.913	1.335	50	20	IDGD	
Cc1cccc(C(=O)NC2CCN(C3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)c1	1836281341	VJQYFVRDGPITLQ-UHFFFAOYSA-N	443.592	1.553	50	20	IDGD	
O=C(Cc1ccc(F)cn1)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836716859	VQMVVUVBPSCGCK-SFHVURJKSA-N	427.904	1.362	50	20	IDGD	
CCc1ccc(C(=O)N2CCOC[C@@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)cn1	1837712514	WYNYHZGVEAOMDR-OAQYLSRUSA-N	435.597	1.566	50	20	IDGD	
CCc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)CBr)C3)C2)no1	1838121966	RLPSFNZSDWYRHD-FZKQIMNGSA-N	444.326	1.338	50	20	IDGD	
COc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)cc(Cl)n1	1838230402	BGQOYYZFOZNDPX-PBHICJAKSA-N	436.267	1.348	50	20	IDGD	
Cc1ccc(OC(C)(C)C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)nc1	1839052849	PYVXOYFIGXJZKG-JXFKEZNVSA-N	443.903	1.538	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)COc3ccccc3F)C2)C1	1839148117	NDRGRCXPWYKAMQ-MGPUTAFESA-N	428.888	1.678	50	20	IDGD	
Cn1cc(CCC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)cn1	1839152264	TWJJMXVRBSXQJZ-MOPGFXCFSA-N	447.363	1.045	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3cnccn3)C2)C1	1839155149	KTLNDKZCUFRTIN-MOPGFXCFSA-N	445.347	1.102	50	20	IDGD	
O=C(CCc1ccoc1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839203551	ONELWAZMYOWAFI-DOTOQJQBSA-N	433.274	1.359	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(C)o3)C2)C1	1839962928	VLCUFWGUCZILML-RDTXWAMCSA-N	429.311	1.832	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3CC(F)(F)C3)C2)C1	1840030853	YSKNLLLFYRMARG-ABAIWWIYSA-N	425.270	1.272	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)nc1C	1840031327	MKUDULJMCUANJQ-KUHUBIRLSA-N	440.338	1.552	50	20	IDGD	
O=C(CCOc1ccc(F)cc1)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840187308	RVHAXRMGZRYWBE-LJQANCHMSA-N	449.306	1.855	50	20	IDGD	
O=C(c1cc2cnccc2[nH]1)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840188735	ZRIUMQXKBGJDHW-GOSISDBHSA-N	427.288	1.437	50	20	IDGD	
Cc1ncc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)s1	1840400704	FKAOSOULYPDNDO-PXAZEXFGSA-N	446.367	1.234	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3c(C)nn(C)c3C)CCO2)C1	1840436833	AWKDTCRFGZFJOP-PXNSSMCTSA-N	426.945	1.053	50	20	IDGD	
Cc1ccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](C)CBr)C3)C2)o1	1840506852	SBSZHGPVORAXDY-LIRRHRJNSA-N	443.338	1.618	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCNC(=O)OC(C)(C)C)CCO2)C1	1840802577	UNRWAMYQQOJPEP-QRWLVFNGSA-N	447.960	1.375	50	20	IDGD	
O=C(Cc1cc(F)ccc1F)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1840811965	SKQMAYXXJXBESP-GOSISDBHSA-N	437.270	1.767	50	20	IDGD	
O=C(C(Cl)Cl)N1CCOC[C@]2(C1)CN(C(=O)[C@]1(F)CCCC=C1F)CCO2	1840951389	LJSHLRQCKIKJFM-IRXDYDNUSA-N	427.275	1.992	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@](C)(C(=O)N2CC3(CCCN3C(=O)[C@H](O)CCl)C2)C1	1841354508	FELDAEKBOJAJFP-QRWLVFNGSA-N	443.972	1.827	50	20	IDGD	
Cc1c(C(=O)N2CC3(CCCN3C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)cnn1C	1841924296	UEFUNMDVIKTUBT-HNNXBMFYSA-N	439.944	1.678	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2ccc3c(c2)CCN3C)C1	1843756718	CYAYDHYVLHTPST-WGOQTCKBSA-N	448.527	1.630	50	20	IDGD	
COc1ccc2oc(C(=O)N3CCCC34CN(C(=O)c3cnccc3C(=O)NN)C4)cc2c1	1844018987	UAPMFCQLRODSIK-UHFFFAOYSA-N	449.467	1.571	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2cc3n(n2)CCCC3)C1	1844074436	NYQIKSBDZKQQLE-BUVRLJJBSA-N	437.504	1.170	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)[C@@H]1CCCN1Cc1ccccc1)C2	1846386094	BGXKMXRJLMNJFE-FQEVSTJZSA-N	441.576	1.227	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)Cn2nnc(-c3ccc(OC)c(OC)c3)n2)cc1C	14323432	SBYMKIJTBOQFQV-UHFFFAOYSA-N	430.490	1.751	50	20	IDGD	
CON(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)cc1	14889959	XXPHTWIEFKPHTQ-LBPRGKRZSA-N	425.438	1.236	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)CSc2ccc3c(c2)OCCO3)c2ccccc2c1=O	17188917	VWUIUPHJRNFDAV-UHFFFAOYSA-N	440.481	1.741	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)CNC(=O)c2ccc(C(C)(C)C)cc2)c2ccccc2c1=O	17190349	VAUYMWPZMTXHBV-UHFFFAOYSA-N	449.511	1.905	50	20	IDGD	
O=C(Cn1nc(-c2ccccc2)oc1=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	728209497	CGUFSMVBLNVFEH-UHFFFAOYSA-N	429.458	1.087	50	20	IDGD	
CON(C)S(=O)(=O)c1cc(C(=O)NNC(=O)COc2ccccc2O)ccc1Cl	730778028	IFJLHYCRYIDNON-UHFFFAOYSA-N	443.865	1.068	50	20	IDGD	
O=C(CN1CCC(=O)NC1=O)NNC(=O)c1ccc(COc2ccc(Cl)cc2)cc1	731864239	RJERKSLHVAEKAO-UHFFFAOYSA-N	430.848	1.622	50	20	IDGD	
O=C(NCCNS(=O)(=O)Cc1ccccc1)NNC(=O)NCc1ccc(Cl)cc1	733037163	QFJONERNUJAUKV-UHFFFAOYSA-N	439.925	1.473	50	20	IDGD	
Cc1cc(C)c(C)c(OCCC(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1	733552647	VPBRFCLOZIPXIN-FQEVSTJZSA-N	442.468	1.911	50	20	IDGD	
Cc1ccc(CCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1	734946590	JYPZWFIDWWAFGA-UHFFFAOYSA-N	446.529	1.203	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(-n3cccn3)ccn2)c1	736064739	RJOQKAMMWPVFIL-UHFFFAOYSA-N	442.501	1.373	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)N[C@@H](C)[C@@H]2CN(Cc3ccccc3)CCO2)cc1	741425204	KSJNCFSEZFXXDS-UWJYYQICSA-N	442.516	1.694	50	20	IDGD	
Cc1nn(C)c(C)c1S(=O)(=O)N[C@@H](C)C(=O)NNC(=O)c1cccc2ccccc12	742081625	GSBFGVIRQOVEMW-ZDUSSCGKSA-N	429.502	1.318	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)NCC(C)(C)NS(C)(=O)=O)cc1Cl	743603149	XNEQHMLYBZARBO-UHFFFAOYSA-N	437.906	1.021	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN2CCCC[C@H]2CCNS(C)(=O)=O)cc1C	744389078	IIYAAFAXZRXADL-AWEZNQCLSA-N	430.596	1.174	50	20	IDGD	
CC(C)NC(=O)C(=O)NNC(=O)Cn1c(COc2ccc(Cl)cc2)nc2ccccc21	744446581	DSMVCYPTRVZJMK-UHFFFAOYSA-N	443.891	1.941	50	20	IDGD	
Cc1c(C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)nnn1-c1cccc(Cl)c1	744836266	ULOBDSPVZAVHQN-UHFFFAOYSA-N	438.831	1.719	50	20	IDGD	
COc1cc(/C=C\C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc(OC)c1O	745513035	PVAKQBIVJCUZKD-SREVYHEPSA-N	445.384	1.335	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3cccc4cnccc34)cc2)CC1	745992541	PONBPFJQIWGSEH-UHFFFAOYSA-N	425.514	1.928	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2cc(C(=O)O)oc2C)cc1Br	746055350	GIYQQRCDNFFSNE-UHFFFAOYSA-N	433.236	1.681	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)[C@H](CC)Nc1c([N+](=O)[O-])c(C)nn1C	746096386	TVONENYQFHALQB-ZDUSSCGKSA-N	442.480	1.587	50	20	IDGD	
O=C(Cn1nc(Br)nc1Br)NNC(=O)c1ccc([N+](=O)[O-])cc1	746137083	GRUXLMANKMEMOJ-UHFFFAOYSA-N	448.031	1.173	50	20	IDGD	
O=C(CCc1nnc(-c2ccc(Cl)cc2)o1)NNC(=O)CNC(=O)c1cccs1	746195592	CDJSBTYUIBGUHK-UHFFFAOYSA-N	433.877	1.962	50	20	IDGD	
O=C(CCCc1ccccc1)NNC(=O)c1ccc(F)c(S(=O)(=O)Cc2ncon2)c1	746209955	GUUMRFYELYCPIR-UHFFFAOYSA-N	446.460	1.967	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(C(=O)CNC(=O)NNc2cc(F)c(F)c(F)c2)CC1	746758501	WQJYHJBYIXVAMR-UHFFFAOYSA-N	431.415	1.809	50	20	IDGD	
COc1cc(C(C)=NNC(=O)c2csc(N3CCOCC3)n2)ccc1S(C)(=O)=O	747042211	LPNCCJKEAOITDS-UHFFFAOYSA-N	438.531	1.546	50	20	IDGD	
O=C(CCSc1ccc(F)cc1)NNC(=O)NCCNS(=O)(=O)c1cccs1	747438338	RVUPYYSQNNOXDK-UHFFFAOYSA-N	446.551	1.678	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NN=Cc1c[nH]c2ccc([N+](=O)[O-])cc12	747764427	WFCMWYUBELNCMF-UHFFFAOYSA-N	434.456	1.984	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2cc(C(=O)NNc3nccn(C)c3=O)ccc2C)cc1	747945537	LGZJRZJXYNPNHZ-UHFFFAOYSA-N	427.486	1.955	50	20	IDGD	
O=C(NCCCN1CCN(c2ccncc2)CC1)NNC(=O)c1cc2c(s1)CCC2	748344007	QWCOFGRCQPRCGH-UHFFFAOYSA-N	428.562	1.788	50	20	IDGD	
O=C(N[C@H](Cc1ccccc1)C(=O)NNC(=O)C(=O)N1CCCC1)OCc1ccccc1	748344090	URJYPMBFLPNMQJ-LJQANCHMSA-N	438.484	1.294	50	20	IDGD	
CS(=O)(=O)Cc1ccc(C(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)o1	748523041	MFLJOJSOKKIQRE-UHFFFAOYSA-N	426.394	1.875	50	20	IDGD	
CN(CCNC(=O)NNC(=O)c1csc(N2CCOCC2)n1)Cc1ccc(F)cc1	748977589	RLDOLEFFQGVNGZ-UHFFFAOYSA-N	436.513	1.195	50	20	IDGD	
CS(=O)(=O)c1cc(C(=O)NNC(=O)COc2ccc(F)cc2)ccc1Br	749161712	PEKSWKWWKKSREF-UHFFFAOYSA-N	445.266	1.832	50	20	IDGD	
Cn1cc(NS(=O)(=O)c2ccsc2C(=O)NNC(=O)NC2CCCCC2)cn1	751291304	SXUIJXKFZCRHAJ-UHFFFAOYSA-N	426.524	1.559	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NC[C@H]1CCCO[C@H]1C(C)C	752001265	ZDFICYCUDOQANW-CABCVRRESA-N	425.555	1.683	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NC[C@@H](C)c2c(C)noc2C)cc1	752699990	KYMZLDLZLCERCH-CYBMUJFWSA-N	437.522	1.354	50	20	IDGD	
COC(=O)CNC(=O)COC(=O)/C(C#N)=C\c1cc(C)n(-c2ccc(OC)cc2)c1C	753899582	VFHDNIFCCJBOGV-YVLHZVERSA-N	425.441	1.842	50	20	IDGD	
Cc1cc(NC(=O)COC(=O)/C(C#N)=C\c2ccc(O)cc2)n([C@@H]2CCS(=O)(=O)C2)n1	754552011	ZOBBVOQVVVHBJZ-QOBZYLRHSA-N	444.469	1.346	50	20	IDGD	
Cc1cnccc1CCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	755091054	XAWKQGAKHQBCPU-UHFFFAOYSA-N	445.545	1.751	50	20	IDGD	
COc1ccc(Cn2ncc3cc(C(=O)NNC(=O)Cc4cc[nH]n4)cnc32)c(OC)c1	755269535	SAGLJSQZFQRHPA-UHFFFAOYSA-N	435.444	1.224	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1cc(C(C)(C)C)nn1-c1ccc(F)cc1	755744423	BRIQUZMHORKJLZ-LLVKDONJSA-N	440.501	1.399	50	20	IDGD	
CCCNC(=O)c1ccc(NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1	756127350	UBBJABHSNSDSAA-UHFFFAOYSA-N	425.493	1.686	50	20	IDGD	
CC[C@H](c1ccccc1)c1nnc(NC(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)s1	756461850	WLKAGKYAUOZSJG-ZYHUDNBSSA-N	426.524	1.170	50	20	IDGD	
O=C(COC(=O)c1cc(F)cc(C(F)(F)F)c1)NNC(=O)[C@H]1COc2ccccc2O1	756637442	PFWAURQELOTJMY-OAHLLOKOSA-N	442.321	1.989	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)Nc1ccn(CCN2CCOCC2)n1	756647874	WLLYBMCSEGDAIS-UHFFFAOYSA-N	434.522	1.169	50	20	IDGD	
COC(=O)CCCc1nnc(NC(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)s1	756687373	VTXXORRAXJCGTD-UHFFFAOYSA-N	429.462	1.890	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)N[C@H]1CCN(c2ccccc2OC)C1=O	756917264	VDCQRWIOGCZKEZ-AWEZNQCLSA-N	428.445	1.219	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)N[C@H]2CN(C3CC3)C[C@@H]2C)c2ccccc2c1=O	757789634	IUMJWCLYYOQVMY-KSSFIOAISA-N	426.521	1.623	50	20	IDGD	
COC(=O)c1cccc(CC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1	758044343	VKHVSNKMRVSUIU-UHFFFAOYSA-N	445.497	1.261	50	20	IDGD	
N#Cc1cc(C(F)(F)F)ccc1C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	758125030	GWWDEHZJLBJZHK-INIZCTEOSA-N	449.341	1.721	50	20	IDGD	
O=C(Cc1cc(F)cc2c1OCOC2)N1CCN(S(=O)(=O)CBr)CC1	758534859	KQHMAFUAJRASCF-UHFFFAOYSA-N	437.287	1.061	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)Nc1ccccc1CN1C(=O)CNC1=O	761223438	PLTHKINJCFPGSK-UHFFFAOYSA-N	443.485	1.692	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)CCc2nc(C3CCCC3)no2)ccc1Cl	761805139	NMXYNGUERGUCLC-UHFFFAOYSA-N	441.897	1.422	50	20	IDGD	
Cc1nnnn1[C@H](Cc1ccc(F)cc1)C(=O)NNC(=O)c1cc(-c2ccccc2)[nH]n1	762937313	IXXLVCYGFYIHJX-LJQANCHMSA-N	434.435	1.756	50	20	IDGD	
COc1ccccc1-n1cc(S(=O)(=O)NNC(=O)CSc2ccccc2O)cn1	763412968	ZMFBTFPTWCRQAD-UHFFFAOYSA-N	434.499	1.688	50	20	IDGD	
COC(=O)c1ccc(C)c(S(=O)(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)c1	763439807	UOBRMAIAVRRMIB-UHFFFAOYSA-N	429.495	1.396	50	20	IDGD	
CCOC(=O)c1cc(CC)sc1NC(=O)C(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	763471796	LCBCNSLVRGVCQF-UHFFFAOYSA-N	434.430	1.795	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)C(=O)Nc1cccc(Cl)c1	763532318	UVCGDDQXRMYGRF-UHFFFAOYSA-N	429.908	1.638	50	20	IDGD	
Cc1ccc(Cn2nccc2NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)s1	763558079	HXNFUOZMRYAGJY-UHFFFAOYSA-N	427.442	1.430	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(I)cc2)c(C)o1	763575937	ALXFTBOTUZSVQB-UHFFFAOYSA-N	427.198	1.901	50	20	IDGD	
COc1cc(OC)cc(OCCNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1	763607728	IBTQFDLZWKJUIU-UHFFFAOYSA-N	444.492	1.120	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc2c(c1)CCCN2C(C)=O	763647944	SVWGVLSXAONEEK-UHFFFAOYSA-N	440.456	1.159	50	20	IDGD	
CC(=O)N(Cc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)cc1)C1CC1	763680164	CYKVUPUHWBRBHC-UHFFFAOYSA-N	449.467	1.234	50	20	IDGD	
O=C(COc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1cccc(N2CCCC2=O)c1	763686554	NYXXLDCIPWLEQX-UHFFFAOYSA-N	430.848	1.632	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(N(C)C)c2)cc1Br	763757192	GAXJCDUDVKLYDU-UHFFFAOYSA-N	435.278	1.923	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(S(=O)(=O)C(F)F)cc2)c1	763759904	GENSCOJEARVPQL-UHFFFAOYSA-N	440.428	1.149	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNC(=O)c2cc(OC)cc(OC)c2)cc1OCC	763773715	ZWENMTDYSCWGHF-UHFFFAOYSA-N	431.445	1.901	50	20	IDGD	
CC[C@@H](C)Oc1cccc(NC(=O)C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c1	763787080	VPKXPPQBMTXSTO-CYBMUJFWSA-N	437.456	1.511	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)C(=O)Nc2ccnn2CCC)c2ccccc2c1=O	763801473	SBDHXQSRIZJTMT-UHFFFAOYSA-N	439.476	1.203	50	20	IDGD	
CC(C)n1ncc2cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc3ccccc3F)cnc21	763849327	IOJGKMWHKGJKQD-GFCCVEGCSA-N	428.424	1.705	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)cnc1Br	763873202	SDJIRWWNUBBOFI-SNVBAGLBSA-N	439.241	1.845	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)c(Br)n1	763995083	LXMPNJKPNZWCHG-UHFFFAOYSA-N	445.071	1.643	50	20	IDGD	
Cc1ccc(Br)cc1NC(=O)C(=O)NNC(=O)c1ccc2c(c1)OCCO2	764004157	SVSKNNPFKJADOJ-UHFFFAOYSA-N	434.246	1.928	50	20	IDGD	
CCOC(=O)c1ccccc1NC(=O)C(=O)NNC(=O)c1cc(Br)cn1C	764004255	AMQREROUKOSFHX-UHFFFAOYSA-N	437.250	1.364	50	20	IDGD	
COCCCOc1ccccc1NC(=O)C(=O)NNC(=O)c1ccc2c(c1)OCCO2	764004723	SIPZUNDEAOUFTE-UHFFFAOYSA-N	429.429	1.273	50	20	IDGD	
COC(=O)c1cc(C)ccc1NC(=O)C(=O)NNC(=O)c1cc(Br)cn1C	764004800	NAOFOYNXSOSBEM-UHFFFAOYSA-N	437.250	1.282	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3c2)cc1S(N)(=O)=O	764066433	GVXOAKWVPSDABI-UHFFFAOYSA-N	426.454	1.195	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc(F)cc2Br)n(CCC#N)n1	764083805	BDHYRWREWZFUQH-UHFFFAOYSA-N	437.229	1.407	50	20	IDGD	
CN(C1CCCCC1)S(=O)(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2ccoc2)c1	764160844	ZKWRWGFNKPNPCD-UHFFFAOYSA-N	448.501	1.633	50	20	IDGD	
CC(C)(C)c1cc(NC(=O)C(=O)NNC(=O)c2ccc(C#N)cc2)n(-c2ccccn2)n1	764183389	XRRIWLBTZMFJRH-UHFFFAOYSA-N	431.456	1.836	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)CCc3ccccc3)cn2)C[C@@H](C)O1	764193370	VHVWNKUGCCVHMH-IYBDPMFKSA-N	425.489	1.414	50	20	IDGD	
Cc1ccc(-c2nnco2)cc1NC(=O)C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C	764204372	MYWQSGBCOQBFMG-UHFFFAOYSA-N	446.464	1.436	50	20	IDGD	
Cc1cc(S(C)(=O)=O)ccc1NC(=O)C(=O)NNC(=O)Cn1ccc2ccccc21	764242362	FCPCFSRUWHFISU-UHFFFAOYSA-N	428.470	1.139	50	20	IDGD	
CC(C)OC(=O)c1c(NC(=O)C(=O)NNC(=O)Cc2ccccn2)sc2c1CCCC2	764266333	BCRGGWBMFWGQNH-UHFFFAOYSA-N	444.513	1.916	50	20	IDGD	
O=C(NNC(=O)c1cc2ccccc2o1)C(=O)Nc1cccc(S(=O)(=O)NC2CC2)c1	764331196	QAXAIAGNMQNVDH-UHFFFAOYSA-N	442.453	1.273	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc(OC)nc3OC)n[nH]2)cc1	764385094	QYCXVFBCLGKYPZ-UHFFFAOYSA-N	438.444	1.451	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)C(=O)Nc1cc2c(cc1Br)OCCO2	764388160	ATQCJSCRYYLXAY-UHFFFAOYSA-N	435.234	1.323	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)C(=O)Nc1cc2c(cc1Cl)OCCO2	764394904	WPOPXLWXRVNSST-UHFFFAOYSA-N	437.861	1.695	50	20	IDGD	
Cc1csc(Sc2ccc(NC(=O)C(=O)NNC(=O)[C@@H]3COCCO3)c(C)c2)n1	764423990	FGSQNXMKMWXIBJ-AWEZNQCLSA-N	436.515	1.412	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)C(=O)Nc2ccccc2C(=O)OC(C)(C)C)c1	764432527	FCCHFTCVQFACSL-UHFFFAOYSA-N	441.444	1.395	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NN=C(Cc1ccc(Br)cc1)C(F)(F)F	764685819	FQWVLNGUNBSOEA-MRVPVSSYSA-N	430.246	1.964	50	20	IDGD	
CC(Cc1ccc(C(F)(F)F)cc1)=NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C	764819276	USCXIEMPEMPILE-UHFFFAOYSA-N	436.394	1.187	50	20	IDGD	
O=C(CSc1nnc(-c2cccnc2)n1Cc1ccco1)NNC(=O)Cc1ccncc1	765491917	XXJQKSTXKSAAHG-UHFFFAOYSA-N	449.496	1.859	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cccc(N4CCCC4=O)c3)CC2)cc1	765748820	QYNXYFZBQDAWAT-UHFFFAOYSA-N	449.555	1.701	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1cccc(-n2cccn2)c1	766635801	FOCDCFUVTLMBAR-UHFFFAOYSA-N	432.484	1.091	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)c1cnc2ccccc2n1	766663730	MQYWXGLYFUCFQH-UHFFFAOYSA-N	438.919	1.862	50	20	IDGD	
CC(=NNC(=O)CN1c2cccc3cccc(c23)S1(=O)=O)c1cc(C(N)=O)n(C)c1	767179667	GMNNRYRIJVIKBM-UHFFFAOYSA-N	425.470	1.326	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1ccc(C#N)cc1)C(=O)NNC(=O)c1cc2ccccc2cc1O	767828378	RVBSFBMURNJIPO-CYBMUJFWSA-N	438.465	1.545	50	20	IDGD	
O=C(Cc1cc(F)c(F)cc1F)NNc1ccccc1S(=O)(=O)N1CCOCC1	768174381	NRISLJWJNPCISE-UHFFFAOYSA-N	429.420	1.811	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)CNC(=O)c1cc(-c2ccccc2)on1	768638388	IJNVGFLZQMILGX-UHFFFAOYSA-N	444.469	1.627	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)NC2CCN([C@H]3CCC[C@H]3O)CC2)cc1OC	769157435	VGLFIYNRWTZQII-ZWKOTPCHSA-N	434.537	1.806	50	20	IDGD	
CS(=O)(=O)N1CCN(c2ccc(NC(=O)NNc3ccc(F)c(F)c3F)cn2)CC1	770027389	OMEMNIUKQPQYNI-UHFFFAOYSA-N	444.439	1.729	50	20	IDGD	
C[C@@H](NC(=O)NNc1nc(O)c2cnn(C)c2n1)[C@H]1CCCN(C(=O)OC(C)(C)C)C1	770369667	PPLTXGHUEPQSJY-NEPJUHHUSA-N	434.501	1.731	50	20	IDGD	
CC[C@@H](C)NS(=O)(=O)c1ccc(C(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1	770426858	JUXBNIFSKYSSDH-CYBMUJFWSA-N	433.486	1.609	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)c3cccc([C@@]4(C)NC(=O)NC4=O)c3)nc21	770964870	FZUQMAKMXZOXOQ-HXUWFJFHSA-N	438.448	1.098	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)[C@@H]3CC(=O)N(c4ccc(F)cc4)C3)nc21	770966958	CKKDELASNUJCMC-LLVKDONJSA-N	427.440	1.922	50	20	IDGD	
CC(C)CC(=O)NNC(=O)CN1C(=O)N[C@](C)(c2ccc(Br)cc2)C1=O	771243345	AQSXJWBSYWGYLL-QGZVFWFLSA-N	425.283	1.410	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@H]2C(=O)O[C@H](C)C(=O)NNC(=O)CC(C)C)c(OC)c1	771989678	VJRUSJLZMBDLRV-PBHICJAKSA-N	449.504	1.434	50	20	IDGD	
CCN(CC)C(=O)COc1cccc(NC(=O)C(=O)NNc2ccccc2[N+](=O)[O-])c1	773647997	IKQDVGMFIGMGMM-UHFFFAOYSA-N	429.433	1.924	50	20	IDGD	
O=C(COC(=O)c1ccc(-c2cncnc2)cc1F)NNC(=O)c1cccc([N+](=O)[O-])c1	775101733	PRPIXVLVIFRNHB-UHFFFAOYSA-N	439.359	1.809	50	20	IDGD	
O=C(NNC(=O)[C@@H](O)Cc1cccc(C(F)(F)F)c1)c1csc(N2CCOCC2)n1	778291541	GZNONTUMMSRKBG-AWEZNQCLSA-N	444.435	1.363	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N[C@H]2CCCN(c3ccc(C#N)cc3)C2=O)cc1OC	779975395	UZPJARVEXYHBRF-KRWDZBQOSA-N	437.456	1.715	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN(Cc2ccccc2)C[C@@H](O)C(F)(F)F)n1	781343893	JPFCOECQDVXYKG-CQSZACIVSA-N	430.452	1.567	50	20	IDGD	
O=C(NNc1c(F)cccc1F)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(Cl)cc1	782017167	QTYOQVVLZXUNLR-ABAIWWIYSA-N	431.848	1.885	50	20	IDGD	
CCN1CC[C@@H](NC(=O)NNC(=O)C(=O)N2CCCC2)[C@@H]1c1cc(F)c(F)c(F)c1	782760067	OKOZRTVQPRQZTC-ZBFHGGJFSA-N	427.427	1.192	50	20	IDGD	
C[C@H]1C[C@H](C)CN(C(=O)c2ccccc2NC(=O)C(=O)NNC(=O)c2ccc(O)cc2)C1	782830078	FMLRWEOVKJKGAF-GJZGRUSLSA-N	438.484	1.910	50	20	IDGD	
CC(C)S(=O)(=O)c1ccccc1NC(=O)C(=O)NN=c1sc2ccccc2n1C	783350212	XAOJRAUGKXMQCP-UHFFFAOYSA-N	432.527	1.993	50	20	IDGD	
Cc1cccn2cc(-c3ccc(NC(=O)C(=O)NN[C@@]4(C)CCS(=O)(=O)C4)cc3)nc12	783424255	CXVMPYXBYUZHRD-NRFANRHFSA-N	441.513	1.446	50	20	IDGD	
O=C(NNC(=O)C(=O)N1CCCC1)C(=O)Nc1cc(C2CCCC2)nn1-c1ccccc1	783998544	AVFFUCKBCISYFP-UHFFFAOYSA-N	438.488	1.238	50	20	IDGD	
CNS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2Cl)cc1	784383018	XWJMZDMIPHCREA-UHFFFAOYSA-N	427.826	1.238	50	20	IDGD	
COc1ccc(/C=C(/C#N)C(=O)OCC(=O)N2CCc3cc(S(N)(=O)=O)ccc32)cc1	784444840	VMTQALKXGFPEHF-YBEGLDIGSA-N	441.465	1.382	50	20	IDGD	
O=C(NNc1nccnc1Cl)C(=O)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1	784776607	OMTVRYJFFTZEBU-HNNXBMFYSA-N	440.895	1.855	50	20	IDGD	
CCNC(=O)N(C)NC(=O)C(=O)Nc1ccc(OC)c(NC(=O)c2cccc(F)c2)c1	784916568	QSUQAWWBSXLEPE-UHFFFAOYSA-N	431.424	1.718	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ncc(F)cn2)cc1NC(=O)CN1CCCCC1	784950552	UJIMLTXTDWSYCO-UHFFFAOYSA-N	429.456	1.430	50	20	IDGD	
COc1ccc2cc(NC(=O)C(=O)NNc3c(OC)cccc3S(C)(=O)=O)ccc2n1	785330533	JTABBYQMXRBQJX-UHFFFAOYSA-N	444.469	1.737	50	20	IDGD	
CN(NC(=O)Nc1ccc(C(N)=O)cc1F)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	785857754	NNORTZJVUBPMPJ-UHFFFAOYSA-N	438.460	1.566	50	20	IDGD	
CCS(=O)(=O)CCn1cc(C)c(NC(=O)NNC(=O)c2ccc(Cl)cc2O)n1	786741699	YKXRBWZKGAABPN-UHFFFAOYSA-N	429.886	1.452	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2cc(N3CCNC3=O)ccc2C)n1	787574322	BULNGBPRNJLTTG-UHFFFAOYSA-N	426.481	1.243	50	20	IDGD	
O=C(CCCNS(=O)(=O)c1ccc(F)cc1)NNc1nnc(-c2ccccn2)s1	788556779	RTHSJCWIQCLCIZ-UHFFFAOYSA-N	436.494	1.941	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2cccc3c2OCC[C@H]3N(C)C)n1	789772099	ZIPBEFZTHNFUHZ-MRXNPFEDSA-N	427.509	1.790	50	20	IDGD	
CCOc1nc(C)ccc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N(CC)CC)c1	790104308	RMOSBIMZJHIPRZ-UHFFFAOYSA-N	434.518	1.894	50	20	IDGD	
COc1cc(C(F)(F)F)ncc1NC(=O)C(=O)NNC(=O)COc1ccccc1OC	792269365	YCMAPQJQCSNNPL-UHFFFAOYSA-N	442.350	1.283	50	20	IDGD	
O=C(NNc1nc2ccccn2n1)C(=O)Nc1cccc(N2CCN(CC3CC3)CC2)c1	792395914	WHKWGCUKSLKICV-UHFFFAOYSA-N	434.504	1.343	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNS(=O)(=O)c3ccc(S(C)(=O)=O)nc3)cc2C1	794576211	HBJKUZCRNPRIFR-SNVBAGLBSA-N	429.545	1.295	50	20	IDGD	
CCCS(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)c2cccc(C)n2)cc1F	794598994	REWZVUPNGBPVOA-UHFFFAOYSA-N	430.483	1.304	50	20	IDGD	
CC[C@H](C)[C@H](NC(C)=O)C(=O)NNC(=O)c1cccc(S(=O)(=O)N(CC)CC)c1	794740757	HWFQMUAFKPAJQL-GUYCJALGSA-N	426.539	1.029	50	20	IDGD	
Cc1c(Cl)cc(S(=O)(=O)NNC(=O)CNC(=O)c2cccs2)cc1C(=O)O	794860114	DIEBZOMYBHITDF-UHFFFAOYSA-N	431.879	1.148	50	20	IDGD	
O=C(CN1CC=C(CCN2C(=O)c3ccccc3C2=O)CC1)NNC(=O)c1cccs1	796465446	YQXDGHSMMDMIGD-UHFFFAOYSA-N	438.509	1.828	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNC(=O)C(=O)Nc1cccc(-n2cccc2)c1	797368612	FNUCECZHIAEEBK-UHFFFAOYSA-N	435.440	1.490	50	20	IDGD	
O=C(NNC(=O)c1cnccn1)Nc1ccc(NS(=O)(=O)Cc2ccccc2)cn1	797653661	FZPGJWXJKKQYES-UHFFFAOYSA-N	427.446	1.280	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)N2CCN(c3cnc(O)nc3N)CC2)c1C	797995542	GCWPWJKGWJKDSH-GZTJUZNOSA-N	425.493	1.085	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2CCc3cnn(C)c3C2)c1	798823058	GGBHVGNHDBKLKS-OAHLLOKOSA-N	433.534	1.017	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)C[C@H]2CSCCN2C(=O)OC(C)(C)C)cc1	801107999	CSBQNIUDPDMEDY-HNNXBMFYSA-N	436.534	1.824	50	20	IDGD	
O=C(Cc1ccc(NS(=O)(=O)c2ccc(F)cc2)cc1)NNC(=O)N=c1cc[nH]cc1	802031026	CXEVSUMSWZBPFK-UHFFFAOYSA-N	443.460	1.839	50	20	IDGD	
COc1ccc(C2=NO[C@H](CNC(=O)NNC(=O)COc3ccc(F)cc3)C2)cc1F	802348309	ULCQZOFCTBSXJF-HNNXBMFYSA-N	434.399	1.876	50	20	IDGD	
O=C(NNC(=O)c1ccc(COc2ccccc2)o1)NC1CCC2(CC1)NC(=O)NC2=O	804869177	VIPOGZLGEPSQJA-UHFFFAOYSA-N	441.444	1.323	50	20	IDGD	
O=C(COCc1ccccn1)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	805191444	FHYLALBMIPWNRU-UHFFFAOYSA-N	431.924	1.217	50	20	IDGD	
CCc1cc(NC(=O)C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)ccc1F	806972967	UIWXXZHAISTFCY-UHFFFAOYSA-N	441.507	1.686	50	20	IDGD	
COC(=O)c1cc(C)c(NC(=O)C(=O)NNC(=O)COc2ccc(C)cc2)c(Cl)c1	806974369	HUKMEKZPGSJMQY-UHFFFAOYSA-N	433.848	1.908	50	20	IDGD	
Cc1nnc(COCC(=O)NNc2ccc(S(=O)(=O)Nc3nccs3)cc2)s1	806998754	RENUFNSUAHYUMI-UHFFFAOYSA-N	440.532	1.764	50	20	IDGD	
CCCCNS(=O)(=O)c1cccc(NC(=O)C(=O)NNc2nccnc2C2CCC2)c1	807461659	NYEBEUYPTRPRIA-UHFFFAOYSA-N	446.533	1.904	50	20	IDGD	
CN(C)c1c(C=NNC(=O)c2ccc(COc3ccccc3)o2)c(=O)n(C)c(=O)n1C	807957161	HBXLCVWPSQISHW-UHFFFAOYSA-N	425.445	1.086	50	20	IDGD	
O=C(NNC(=O)c1sc2ccccc2c1Br)N[C@H]1CCS(=O)(=O)C1	810580852	IJCXQOROJBUUSV-QMMMGPOBSA-N	432.321	1.795	50	20	IDGD	
O=C(NNc1c(F)cc(C(=O)NC2CC2)cc1F)C(=O)N1CCN(c2ccccc2)CC1	812532901	KVYUGRCDKRWAFQ-UHFFFAOYSA-N	443.454	1.649	50	20	IDGD	
COC(=O)c1cn(-c2cccc(NC(=O)C(=O)NNc3c(F)cccc3Cl)c2)nn1	812981365	WXDQKRVJERHFEM-UHFFFAOYSA-N	432.799	1.928	50	20	IDGD	
CC(C)Sc1c(Cl)cccc1NC(=O)C(=O)NNC(=O)[C@@H]1CCc2nncn2C1	815692987	IILNJUUDRNLHAL-LLVKDONJSA-N	436.925	1.781	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1ccc2c(c1)OCCCO2	815751725	LRXPSEYADZLQDN-UHFFFAOYSA-N	434.474	1.180	50	20	IDGD	
Cc1nnnn1/C(=C\c1ccc(F)cc1)C(=O)NNC(=O)[C@H](C)Oc1ccccc1F	818029941	RQDJIPZOHODQME-UEMWTREESA-N	428.399	1.873	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)CCn1cnc2sc(C)c(C)c2c1=O	818054063	LRCFNJJAMCUMES-UHFFFAOYSA-N	429.502	1.733	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)CNC(=O)c1ccc(F)cc1F	821892440	GVFQHJFHOVACPL-UHFFFAOYSA-N	445.470	1.054	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)CNC(=O)CC23CC4CC(CC(C4)C2)C3)C[C@@H](C)O1	912920140	VWUCACFVJFRCDP-KEEFIYKFSA-N	434.581	1.356	50	20	IDGD	
Cc1c(/C=C(\C#N)C(=O)OCC(=O)N2CCN(Cc3ccccc3)CC2)cc(C#N)n1C	913287133	UNXMNJUWSQCWOW-CIAFOILYSA-N	431.496	2.000	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)N[C@@H]1CCN2CCC[C@H]2C1	916573903	SJAWTPOYGCKQIE-MSOLQXFVSA-N	449.577	1.432	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cc(S(C)(=O)=O)ccc2F)cc(OC)c1OC	918143064	QYMVSUMYWMURPX-UHFFFAOYSA-N	426.422	1.330	50	20	IDGD	
COc1ccc(-c2nn(-c3ccccc3)cc2C(=O)NNC(=O)CN2CCCC2=O)cc1	920825673	DZFQGYIHOXKICO-UHFFFAOYSA-N	433.468	1.931	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)[C@@H]1COc2ccccc2O1)c1ccc(N2CCOC2=O)cc1	920972477	WHIZYFPTECGLMY-UGSOOPFHSA-N	426.429	1.875	50	20	IDGD	
CN1C(=O)COc2cc(NC(=O)NNC(=O)C3CCN(C(=O)OC(C)(C)C)CC3)ccc21	1116916378	ALAJAWNNZKWTJJ-UHFFFAOYSA-N	447.492	1.842	50	20	IDGD	
CN(Cc1ccc([S@@](C)=O)cc1)C(=O)NNC(=O)c1csc(N2CCOCC2)n1	1252628458	JYQXUTLLJCITDJ-GDLZYMKVSA-N	437.547	1.204	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NN=C[C@@H](C#N)C(C)C)N(S(C)(=O)=O)CC2	1319380780	LIMRYOLRQXPCMY-NVXWUHKLSA-N	436.534	1.850	50	20	IDGD	
COc1cccc([C@H]2[C@H](C(=O)NNC(=O)c3n[nH]c4c3CCCC4)CC(=O)N2C2CC2)c1	1323487167	KNZNZFJHMOGKAC-UTKZUKDTSA-N	437.500	1.810	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(-n3cnnc3)cc1)C2)[C@H](F)Cl	1778022378	GMSVSCQVSNUOBA-FUHIMQAGSA-N	435.887	1.929	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3c(C)cc(C(N)=O)cc3C)C2)C1	1779012540	YJSKKVYJRICHFL-IERDGZPVSA-N	437.924	1.100	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H]1CC=CCC1)C2	1779374108	ABYFKVGCEVTGDP-XKDCRVNJSA-N	441.532	1.169	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cn1cc(Cl)cn1)C2	1779543605	LAWUNOUSAOYONY-VQIMIIECSA-N	443.020	1.902	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(-c4cccnc4)[nH]n3)C2)C1	1779611872	XIZDUCXADYFPRI-BFUOFWGJSA-N	448.321	1.699	50	20	IDGD	
COc1cc(OC)cc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)c1	1781332915	CKIKRBAUQLUNOF-QAPCUYQASA-N	445.285	1.838	50	20	IDGD	
CCCCC[C@@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2	1781817618	KYJBPMXQXDMEMZ-MEKIYTOJSA-N	444.381	1.710	50	20	IDGD	
Cc1nc2ncccn2c1C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](C)Br)C2)C1	1783533641	CNJRXWKILGWENZ-XIKOKIGWSA-N	436.310	1.265	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3C[C@H]3C3CC3)[C@H]2C1	1783942431	QSZPYPRIDCAJDN-BIMVRYHLSA-N	441.532	1.146	50	20	IDGD	
C=CC[C@H](NC(=O)OC(C)(C)C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Cl)C[C@@H]21	1784786015	QFTKDSIYWOSKEP-UVPYHEFZSA-N	447.935	1.970	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)c1	1785111969	VJFDSVYEEHTAQF-CRAIPNDOSA-N	442.285	1.779	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnnc(Cl)c3)[C@H]2C1	1785454988	SAWJNGICJLNEQY-URBCHYCLSA-N	431.718	1.507	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21)c1cnc(-c2ccccn2)nc1	1785504791	WLHGNTRTQZPTDC-CSFVBSKPSA-N	433.871	1.666	50	20	IDGD	
CN1CCC[C@H]1C(=O)Nc1ccc(C2(NC(=O)c3cnccc3C(=O)NN)CCC2)cc1	1786567703	WQGVQFGSQVRHPS-IBGZPJMESA-N	436.516	1.527	50	20	IDGD	
O=C(CCc1cn[nH]c1)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1	1786850316	WBBWOEUBVDWQAZ-UHFFFAOYSA-N	432.289	1.470	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3cncnc3)[C@H]2C1	1787045822	ODSWSKLDGGUNKK-TUUVXOQKSA-N	425.327	1.172	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)c1ccc2cc(O)ccc2n1	1787867029	YRQSDRDPSDOJPR-BMIPRAEKSA-N	433.892	1.133	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)c3ccc(=O)oc3)CCC2)cc1)c1ccc(B(O)O)cc1	1788140802	YRQWWQDGXISYKJ-UHFFFAOYSA-N	432.241	1.381	50	20	IDGD	
C[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]21)N1C[C@H]2C[C@@H]2C1	1788513606	ZGEUMQHCUPKMCR-MDYYIRAXSA-N	432.392	1.543	50	20	IDGD	
COC(=O)CCCCCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]2C1	1788764269	PLSAFFYSWCRWEH-BZSNNMDCSA-N	442.629	1.941	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3n[nH]cc3[N+](=O)[O-])[C@H]2C1	1788816032	KRQSLFSTNZSEGM-LGXCGXJNSA-N	434.280	1.148	50	20	IDGD	
CCN(CC)C[C@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)CBr)C[C@@H]21	1790595693	VJHAAOUMLJXAPD-FPSMNIFISA-N	446.430	1.975	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CC[C@H]3CCOC3)C[C@@H]21	1790964278	WGAQIEVIFUEKGX-VIQHNZTISA-N	431.371	1.956	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc(OC)c(O)c3)C[C@@H]21	1791249392	KJCMGUODFVYLOI-FPXQBCRKSA-N	440.924	1.177	50	20	IDGD	
COc1ccc(/C=C/C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](O)CCl)c(F)c1	1792982825	QSULHJTURMLABK-FTBITFSUSA-N	426.872	1.037	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cc(F)cc(F)c1	1795843091	XWRLDTDWBUZPGH-AKENFEQQSA-N	431.277	1.880	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(Br)nc1F)C2)[C@@H](F)Cl	1796361938	RURCJVGWXZDGRS-IWXIMVSXSA-N	438.656	1.721	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(C)nc(O)c1	1796379055	HJVNZBJQEZCUTM-FQLMCAECSA-N	426.311	1.472	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnc(C(F)(F)F)cn1	1796533492	WSBIFIZNYMDFCW-CLLJXQQHSA-N	442.442	1.120	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccn2nccc2c1	1797554783	UHSGQXGWBAZNQV-MVWRLGRASA-N	425.316	1.774	50	20	IDGD	
Cc1ccc(SCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)cc1	1797684039	CIHAAYAUDFEPHB-ACDBMABISA-N	438.358	1.719	50	20	IDGD	
C[C@@H](Nc1ccccn1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2	1797977567	HSPLLXQYDLBWRA-GGUBGCTKSA-N	429.290	1.162	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CSc1ccncc1)C2	1798440784	RTNFRFPTOZARJT-QDMKHBRRSA-N	440.529	1.124	50	20	IDGD	
Cc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)CBr)C3)c(O)n1	1798651981	XDHWHMHHYAMNEG-DNVSUFBTSA-N	426.311	1.330	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(OC)c(N(C)C)c1	1799208955	KOQCUCOVWPQBJT-RCJHGTSTSA-N	439.940	1.218	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(OC)c(OC)c1O)C2	1799267898	FCCAKBWBEDJARB-FAXLKDOZSA-N	426.897	1.630	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CCCN1C(=O)OC(C)(C)C)C2	1799270208	LAQCHFHOEPWEJA-BPKGMFCQSA-N	443.972	1.993	50	20	IDGD	
CC(C)(C)n1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@](C)(Cl)CCl)nn1	1799277861	SKLAXRGIPILWDK-JPVZDGGYSA-N	432.352	1.473	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3cncn3c1)C2)[C@H](F)Br	1799349915	OFSCXQJCEUXNCR-NEBZKDRISA-N	425.258	1.228	50	20	IDGD	
O=C(CCc1cnc2[nH]ccc2c1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2	1800845107	NQOQHNBBZUQXIQ-HGKCTWBKSA-N	449.349	1.870	50	20	IDGD	
CC[C@H](C)CC(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1	1803365055	JORLCCWYWOGEAB-WJPUGNRLSA-N	438.532	1.836	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)c2cccn(C)c2=O)[C@H]1c1cccnc1	1803835046	HDKCEXGPVRHKIR-JLJPHGGASA-N	447.333	1.883	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC2(CCCN(C(=O)[C@@H]3CCC(=O)NC3)C2)CC1	1804970607	CNZGJKKRGPBXED-HUUCEWRRSA-N	428.371	1.775	50	20	IDGD	
CN(C)c1ccc(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)nc1	1805090562	HMSCZXGIYRTYEQ-ZYSHUDEJSA-N	431.924	1.462	50	20	IDGD	
Cn1ncnc1C(=O)NC[C@@H]1CCN(C(=O)[C@@](C)(Cl)CCl)[C@H]1c1cccnc1	1805279073	IUMOVYGRLHCZJM-DEYYWGMASA-N	425.320	1.766	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)C1CCCCC1	1806225255	KVWZKZPNTHHVIV-IFMALSPDSA-N	435.333	1.661	50	20	IDGD	
Cc1noc(CC(=O)N2CC[C@H](CNC(=O)CCBr)[C@H]2c2cccnc2)n1	1806340775	MZFKBDLNKWLCGG-RDTXWAMCSA-N	436.310	1.807	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@@H](CNC(=O)c2cc(O)n[nH]2)[C@@H]1c1cccnc1	1807284011	ONSOZJLXPHCFRF-FFSVYQOJSA-N	436.310	1.861	50	20	IDGD	
COc1ccc(C(=O)N2CCCC3(CCN(C(=O)c4cccc(B(O)O)c4)CC3)C2)s1	1807499611	WRKXEVQEJSBGDJ-UHFFFAOYSA-N	442.346	1.595	50	20	IDGD	
Cc1ccsc1C(=O)N1CCCC2(CCN(C(=O)c3cccc(B(O)O)c3)CC2)C1	1808078743	GKROTUNIEABINO-UHFFFAOYSA-N	426.347	1.895	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)Cn2nccn2)[C@@H]1c1cccnc1)[C@@H](F)Br	1808676540	UFKNVKHXIWCNID-NWANDNLSSA-N	425.262	1.070	50	20	IDGD	
CC(=O)N[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)Br)[C@H]1c1cccnc1	1812652131	LABJQBNWPAYPLQ-MPTQWLOMSA-N	425.327	1.395	50	20	IDGD	
CNc1nsnc1C(=O)N1CC[C@H](CNC(=O)[C@H](Cl)COC)[C@H]1c1cccnc1	1813028868	WFZKEYQOMKKQSQ-UMVBOHGHSA-N	438.941	1.548	50	20	IDGD	
O=C(/C=C/c1cccnc1)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1	1815350228	LAVWENMNNCJTOJ-RCMYXZNBSA-N	448.313	1.157	50	20	IDGD	
Cc1occc1C(=O)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1	1815355113	NDMNANINKMZOOF-CQSZACIVSA-N	425.275	1.264	50	20	IDGD	
COCC1(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cnccc3C(=O)NN)n[nH]2)CC1	1819401536	GRICTVGMMGFRLV-MRXNPFEDSA-N	441.492	1.141	50	20	IDGD	
Cc1cc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)ccc1O	1821096946	SLQGKXFJOQTQAE-LJQANCHMSA-N	448.288	1.723	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnc(Cl)nc2)[nH]n1	1822412184	LYGKUPGBGSUUGD-CQSZACIVSA-N	448.915	1.532	50	20	IDGD	
O=C(Cn1ccccc1=O)N[C@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1	1823002366	DAGGVOIAYCXURJ-LKFCYVNXSA-N	443.298	1.608	50	20	IDGD	
O=C(N[C@@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1)c1ccnnc1O	1823006840	IWYFXHOQPZMDFU-LDWIPMOCSA-N	430.259	1.555	50	20	IDGD	
O=C(CC[C@@H]1CCOC1)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1823028985	WASPHTXBCDVISH-DNVCBOLYSA-N	440.309	1.212	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCC([C@H]2CCCCN2C(=O)C(O)O)CC1	1824026971	AWHBIEFXEXSMAV-KZIRBZLESA-N	433.455	1.802	50	20	IDGD	
O=C1C[C@H](C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@@H](F)Br)CC3)CCN1	1826222516	ZYKNZBCHMVLTNW-RGNHYFCHSA-N	433.303	1.272	50	20	IDGD	
CCn1nccc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827056017	ODBUFNXIFKHRHV-HXUWFJFHSA-N	438.337	1.130	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(Cl)nc3)CCO2)C1	1829513002	SUMJILJMUDWDHR-KSSFIOAISA-N	432.304	1.059	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(C3CC3)on1)CCO2	1830197626	VKRBULKKKCMKJD-HXUWFJFHSA-N	437.569	1.474	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3ccc(F)nc3)C2)C1	1830358543	OLWJBMXWFYQYPS-OAQYLSRUSA-N	441.931	1.875	50	20	IDGD	
Cc1cccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)n1	1830537454	IQJBTHUOROESIY-AUUYWEPGSA-N	440.338	1.491	50	20	IDGD	
O=C(C[C@@H]1OCCc2ccccc21)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1831246753	YYZKPJDZSNUFSE-CUWPLCDZSA-N	440.899	1.681	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CSCC(=O)OC)CC1	1831828969	WGICANJPAHVKKU-JKSUJKDBSA-N	434.986	1.766	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)C(C)(C)C)CC2)CC1	1833286882	IZJLMVIKCMCKIT-BBRMVZONSA-N	432.403	1.748	50	20	IDGD	
Cc1ncncc1C(=O)NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1835972584	AFBNEVPJULALOM-MRXNPFEDSA-N	442.333	1.661	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@H]3CCCN(C)C3)CC2)CC1	1836351653	GIHMDTYPKONXOP-LPHOPBHVSA-N	429.005	1.154	50	20	IDGD	
CCc1cc(C(=O)N2CCC(OC3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)nn1C	1836718262	MMDYZILLRMNCDH-SFHVURJKSA-N	426.945	1.194	50	20	IDGD	
C[C@H](Nc1ccccn1)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836718480	PMZUCQUOQTZSAZ-YJBOKZPZSA-N	438.956	1.480	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)Cn3ccnc3)CC2)CC1	1837534821	GPDXCZYXPLIPBQ-AWEZNQCLSA-N	427.343	1.665	50	20	IDGD	
O=C(CN1CCCC1=O)N1CCC(OC2CCN(C(=O)[C@H](F)Br)CC2)CC1	1837809691	SMZRPGZWMOUEAL-KRWDZBQOSA-N	448.333	1.298	50	20	IDGD	
COc1ccnc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)c1	1837955275	ZGUSLBQSMMTRGY-HXUWFJFHSA-N	437.569	1.012	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(N(C)C)nc3)CCO2)C1	1838192488	LENKLJSWIFRNKC-UWJYYQICSA-N	438.956	1.625	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@@H]3CCCN(C)C3)CC2)CC1	1838617698	ZTYYVUVRGDULHA-APWZRJJASA-N	429.989	1.581	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3n[nH]c4ccc(F)cc34)C2)C1	1839145954	RWIDMAOMIFOTFD-FOIQADDNSA-N	438.887	1.789	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCN3CCCC3)C2)C1	1839156131	CJDHHGRXBVUALY-MOPGFXCFSA-N	436.380	1.165	50	20	IDGD	
O=C(c1ccccc1F)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839202257	YQZWSIDXJUGFRZ-YOEHRIQHSA-N	433.249	1.586	50	20	IDGD	
N#Cc1ccc2[nH]nc(C(=O)N3CCO[C@@]4(COCCN(C(=O)[C@@H](F)Cl)C4)C3)c2c1	1839487865	JSKPARRUTUVKFM-APWZRJJASA-N	435.843	1.039	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3c(C)noc3C)C2)C1	1839963115	ACYZADQWDYZUKQ-KSSFIOAISA-N	444.326	1.535	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3ccc[nH]3)C2)C1	1840031770	BVHRHTWYRZMYAS-KDOFPFPSSA-N	428.327	1.187	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cccs3)C2)C1	1840032116	OAPQASVKQRCLAD-SUMWQHHRSA-N	431.352	1.530	50	20	IDGD	
O=C(c1cc(F)c(F)cc1F)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840189359	NFQGDONEJOLASN-KRWDZBQOSA-N	441.233	1.978	50	20	IDGD	
O=C([C@@H](F)Br)N1CC2(CCCN2C(=O)c2ccc3nc(CO)[nH]c3c2)C1	1843670931	LUYMKBKVKCBKAI-CQSZACIVSA-N	425.258	1.563	50	20	IDGD	
COCc1c[nH]c(C(=O)N2CCCC23CN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C3)c1	1844679499	NLVADUJOTJPGGC-ZVHZXABRSA-N	426.477	1.112	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)[C@H]1CCCCO1)C2	1844691961	SLBNYHMOHHJICE-GOSISDBHSA-N	431.445	1.906	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCCC12CN(C(=O)CCn1cncn1)C2	1845872049	UFSHDYSCPJQBNN-LZYBPNLTSA-N	426.427	1.757	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)c1ccc(C(F)(F)F)n1C)C2	1846384723	ARTXNQGZQWYLKB-UHFFFAOYSA-N	429.443	1.234	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)[C@@H](C)Cc2ccccn2)C1	1846522237	ASXXHMIXIWFXOS-MQISTKKBSA-N	436.516	1.598	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1nc(O)n2c1CCCC2	1847498336	BWYFEOIHWJHWTO-AGIUHOORSA-N	425.327	1.771	50	20	IDGD	
O=C(Cn1cnc2ccccc21)NNC(=O)c1ccc2c(c1)C(=O)N(C[C@@H]1CCCO1)C2=O	17403653	RJDWXVBXMUQWGC-HNNXBMFYSA-N	447.451	1.273	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)[C@H](C)SCc2nc3sc(C)c(C)c3c(=O)[nH]2)n1	17639457	NSPYYKCPRNOIPZ-ZDUSSCGKSA-N	448.574	1.884	50	20	IDGD	
Cn1ccnc1[C@@H](NC(=O)NNC(=O)CNC(=O)c1cccs1)c1ccccc1F	725872989	IMFDOERUPDJSEC-INIZCTEOSA-N	430.465	1.471	50	20	IDGD	
COc1ccc(CN2C[C@@H](C(=O)NNC(=O)[C@@H](C)Oc3ccc(F)cc3)CC2=O)cc1	726522863	YXHVGLXQLVUUAX-ZBFHGGJFSA-N	429.448	1.798	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)CS(=O)(=O)NC2CCC(C)CC2)c1C	726869025	MEIHACABNBPIHH-PWZRNIHTSA-N	425.551	1.716	50	20	IDGD	
CNS(=O)(=O)c1cccc([C@@H](C)NC(=O)NNC(=O)c2c(C)nc3ccccn23)c1	727609157	HYVDYQFVFHXLTF-GFCCVEGCSA-N	430.490	1.256	50	20	IDGD	
O=C(CCCc1ccccc1)NNS(=O)(=O)c1cccc(S(=O)(=O)NC2CC2)c1	727719719	MKRRLAKWSLKNDQ-UHFFFAOYSA-N	437.543	1.460	50	20	IDGD	
CC(C)[C@@H](C(=O)NNC(=O)c1nnc(O)c2ccccc12)S(=O)(=O)C1CCCCC1	728512642	VWLZMZQAOIBAOJ-KRWDZBQOSA-N	434.518	1.869	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)c2ccncc2)cc1Br	729296550	ZEFKGYGFRDALLJ-UHFFFAOYSA-N	427.280	1.169	50	20	IDGD	
Cc1cc(S(C)(=O)=O)c(C)c(S(=O)(=O)NNC(=O)c2ccc3ccccc3n2)c1	730203051	HANPFBFRYBCAFR-UHFFFAOYSA-N	433.511	1.878	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2ccc3c(c2)OCCO3)nnn1-c1cccc2cnccc12	731163961	BLICUUZBPGZPTH-UHFFFAOYSA-N	430.424	1.970	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(OC)c(C(=O)NNC(=O)c2ccccc2OC)c1	731491353	RARQKCPMZHUXDD-UHFFFAOYSA-N	435.502	1.809	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@@H](C)N1CCc2ccccc2C1	731866684	YJBXKERFMRUYFP-OAHLLOKOSA-N	429.546	1.496	50	20	IDGD	
CN(CC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)[C@@H]1CCN(c2ccccc2Cl)C1=O	732206962	IAAWAOLFIBSDQM-QGZVFWFLSA-N	445.863	1.747	50	20	IDGD	
Cc1cccc(N2C(=O)N[C@@H](CCC(=O)NNc3ccccc3S(C)(=O)=O)C2=O)c1	732304686	YFKFULPCELLYKU-INIZCTEOSA-N	430.486	1.747	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N(C)[C@H](C)CS(C)(=O)=O	732677043	RFABYPFZEPANFT-MNOVXSKESA-N	436.328	1.322	50	20	IDGD	
COc1ccc(C(=O)NCC(=O)NNC(=O)NCc2ccc(Cl)cc2)cc1[N+](=O)[O-]	733004236	ACHZRQCLSNRHKV-UHFFFAOYSA-N	435.824	1.517	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	734239379	NTGLAYATXBMZMF-ZDUSSCGKSA-N	439.538	1.598	50	20	IDGD	
CC(=O)N1C=Cc2ccccc2[C@@H]1CC(=O)NNC(=O)NCCNC(=O)OC(C)(C)C	734239430	OZFYMZJOAIFXMX-KRWDZBQOSA-N	431.493	1.806	50	20	IDGD	
CN1C(=O)c2ccc(C(=O)NNC(=O)NC3CCN(C(=O)OC(C)(C)C)CC3)cc2C1=O	734826062	VNYSVRFRFYZYII-UHFFFAOYSA-N	445.476	1.256	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)c2ccc3c(c2)NC(=O)CCN3)cc1C	736817954	RUUKFIAZFAATGB-UHFFFAOYSA-N	430.486	1.991	50	20	IDGD	
N#Cc1cc(C(F)(F)F)ccc1S(=O)(=O)NNC(=O)CNC(=O)c1cccs1	737757555	SLHWXHAMJOVNJK-UHFFFAOYSA-N	432.405	1.378	50	20	IDGD	
CN(C)CCOc1ccccc1N1CCN(C(=O)NNC(=O)c2cccc(C#N)c2)CC1	738474698	GTNQHERYUDMBRC-UHFFFAOYSA-N	436.516	1.675	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C[C@@H]1CN(Cc2ccccc2)CCO1	740699552	VGVPWTAAQSMLDH-LJQANCHMSA-N	427.501	1.903	50	20	IDGD	
CC(C)(C)OC(=O)N(CC(=O)NNC(=O)c1ccc2c(c1)OCCO2)C[C@H]1CCCO1	741891838	OZDWPHVFCRAQST-OAHLLOKOSA-N	435.477	1.635	50	20	IDGD	
O=C(NNC(=O)[C@H](c1ccccc1F)N1CCOCC1)c1cc(Br)c[nH]1	742490217	ZUDSGLAWBMSCSI-HNNXBMFYSA-N	425.258	1.751	50	20	IDGD	
O=C(NNC(=O)C1CCN(C(=O)N2CCCC2)CC1)c1cc(Br)ccc1O	743733716	QATZMOQAKHJOGS-UHFFFAOYSA-N	439.310	1.844	50	20	IDGD	
CN(CCCOc1ccc(S(C)(=O)=O)cc1)CC(=O)NNC(=O)c1cccc(C#N)c1	744390453	HFDVMKDTUFQLCE-UHFFFAOYSA-N	444.513	1.124	50	20	IDGD	
CC(C)(C)C(=O)NNC(=O)CN1CCCN(S(=O)(=O)c2ccc(Cl)s2)CC1	744392725	BRWLROOSGNFBJV-UHFFFAOYSA-N	436.987	1.291	50	20	IDGD	
C[C@]1(NNC(=O)NC[C@@H](c2ccc(Cl)cc2)N2CCOCC2)CCS(=O)(=O)C1	744866711	WUFIXPCGBHIHKW-WMZOPIPTSA-N	430.958	1.094	50	20	IDGD	
Cc1nc(-c2cccnc2)nc(O)c1CCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	745414139	YXWJYUMGHFDQCY-GOSISDBHSA-N	435.440	1.473	50	20	IDGD	
C[C@H](CS(C)(=O)=O)NC(=O)NNC(=O)Nc1ccc(Br)cc1Cl	745822143	XVMDTXYZTGTPMY-SSDOTTSWSA-N	427.708	1.871	50	20	IDGD	
O=C(CC[S@@](=O)c1ccc2c(c1)OCCO2)NNC(=O)Cc1c[nH]c2ccccc12	746097246	DKVVWBXSPRSZFZ-SSEXGKCCSA-N	427.482	1.827	50	20	IDGD	
N#Cc1ccc(C(=O)NNS(=O)(=O)c2ccc([N+](=O)[O-])c(Br)c2)cc1	747072913	UOAVCFKTROJWQO-UHFFFAOYSA-N	425.220	1.852	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCOC[C@H]2C[C@H](O)c2ccccc2)cc1OC	747656382	IRCYNTVKYPGDAH-MOPGFXCFSA-N	443.500	1.289	50	20	IDGD	
COc1ccccc1C(=O)N[C@H](CCS(C)(=O)=O)C(=O)NNc1ccc(C#N)cc1	748104883	LOTBJQZWUPCFJB-QGZVFWFLSA-N	430.486	1.243	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)C2(c3ccccc3OC)CC2)cc1OC	749296469	MSVVKFKCRASDFZ-UHFFFAOYSA-N	428.441	1.748	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)N[C@H]1CCN(CCCc2ccccc2)C1=O	750274213	BTGKZDPLUGLBEL-INIZCTEOSA-N	443.529	1.042	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@@H](C)c2ncc(C)s2)cc1	750662258	KVROEPXWGNIIDH-ZDUSSCGKSA-N	425.536	1.472	50	20	IDGD	
O=C(COCCNC(=O)c1ccccc1)NNc1ccc(S(=O)(=O)C(F)F)cc1	752634393	ONCNSYWAIUJMNA-UHFFFAOYSA-N	427.429	1.573	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCC(C(=O)NNc3cc(Cl)nc(N)n3)CC2)cc1	753454801	LLAUBJUQQAYTDE-UHFFFAOYSA-N	440.913	1.265	50	20	IDGD	
CN(C)c1ccc(S(=O)(=O)N(C)C)cc1NC(=O)NNC(=O)c1ccc2c(c1)OCO2	755531993	LCRBUNXYPYYYME-UHFFFAOYSA-N	449.489	1.198	50	20	IDGD	
CCc1c(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cnn1CC(C)C	756003836	YCANDTFKABEITC-UHFFFAOYSA-N	440.548	1.321	50	20	IDGD	
CC(=O)N1CCCc2cc(NC(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)ccc21	756282277	ZQENWCHNTONKPW-UHFFFAOYSA-N	430.486	1.856	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1-n1nnnc1C	756318828	JPEREAHNHBBQSX-UHFFFAOYSA-N	425.405	1.217	50	20	IDGD	
O=C(NNC(=O)c1ccc(Br)s1)Nc1ccn(CCN2CCOCC2)n1	756647843	VYVUTKTYPFEKCG-UHFFFAOYSA-N	443.327	1.506	50	20	IDGD	
O=C(CN1CCN(CC(=O)Nc2ccc(Cl)cc2)CC1)NNC(=O)c1ccc(F)cc1	756652348	VYYPFQCHQCJYEQ-UHFFFAOYSA-N	447.898	1.496	50	20	IDGD	
COc1ccccc1N1CC[C@@H](NC(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)C1=O	757284070	BYKPCUKQZXYTSC-UKRRQHHQSA-N	430.436	1.738	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)NNC(=O)c2cccc(C#N)c2)cc(S(C)(=O)=O)c1	757609522	WXYBQGUASXRZKO-UHFFFAOYSA-N	430.442	1.605	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)Nc1ccsc1	757654344	AKXSTNKBQMFOLT-UHFFFAOYSA-N	438.531	1.555	50	20	IDGD	
CN1Cc2ccccc2[C@H](NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)C1	757736073	MNICMPAUIXPWJX-JOCHJYFZSA-N	436.560	1.716	50	20	IDGD	
O=C(COC(=O)c1ccc(C(=O)NC2CC2)cc1)NNC(=O)c1cccc([N+](=O)[O-])c1	757840244	CKUAAGCQZGCKMJ-UHFFFAOYSA-N	426.385	1.105	50	20	IDGD	
CCOc1nc(C(F)(F)F)ccc1C(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	760064629	AJXAPWUECCRQBO-UHFFFAOYSA-N	435.362	1.821	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)Cc2ccc(C(=O)NNC(=O)c3cncnc3)cc2)cc1	760801903	WNYJXYXXDYMZAB-UHFFFAOYSA-N	439.497	1.681	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCCC(=O)NNc1cnnc2ccccc12	761079602	YVPHRTVHFQXNCM-KRWDZBQOSA-N	428.493	1.979	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)c1noc(-c2ccccc2)n1	761802143	WUSGQXQUHUDGSV-CQSZACIVSA-N	436.476	1.835	50	20	IDGD	
Cc1nn([C@H]2CCS(=O)(=O)C2)c(C)c1C=NNC(=O)CCCNC(=O)OC(C)(C)C	763376993	XIDXTRRNMSHUEN-HNNXBMFYSA-N	441.554	1.615	50	20	IDGD	
COC(=O)[C@@H](C)Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3n2)cc1	763449745	HLOUHCRWUCCENN-AWEZNQCLSA-N	434.452	1.986	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)C(=O)Nc1cc(N2CCCC2=O)ccc1F	763547442	BNAKFWQDKHKRIQ-UHFFFAOYSA-N	428.376	1.081	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)ccc1OC1CCOCC1	763550567	FFPBQAGMULYEAE-UHFFFAOYSA-N	441.440	1.681	50	20	IDGD	
CCOc1cc2c(cc1NC(=O)C(=O)NNC(=O)[C@@H]1COc3ccccc3O1)O[C@H](C)C2	763574875	LEYYMAQNFGDWGA-BLVKFPJESA-N	441.440	1.335	50	20	IDGD	
CCOc1cc2c(cc1NC(=O)C(=O)NNC(=O)[C@H]1COc3ccccc3O1)O[C@H](C)C2	763574877	LEYYMAQNFGDWGA-CWTRNNRKSA-N	441.440	1.335	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2ccnn2CCc2ccccc2)c1	763668786	PFZVSXDKSBTKDL-UHFFFAOYSA-N	435.484	1.908	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(OC)c(OC)cc1F	763679584	ANXYKWMVLKIURZ-UHFFFAOYSA-N	435.408	1.407	50	20	IDGD	
CCNC(=O)COc1cccc(NC(=O)C(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)c1	763735316	QDMMFFHFZCKXKK-UHFFFAOYSA-N	442.516	1.504	50	20	IDGD	
COC(=O)c1c(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)sc(C)c1C	763746019	ONWCVQLZPXYYLS-UHFFFAOYSA-N	444.513	1.690	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)COc2ccc(C)cc2)ccc1Br	763820708	NHEFXXVTAXSGJD-UHFFFAOYSA-N	436.262	1.931	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cccc3c2oc(=O)n3C)c1C	763848521	IRCJNEDYZMYSCG-CYBMUJFWSA-N	426.429	1.302	50	20	IDGD	
C[C@H]1COCCN1c1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)cc1	763852345	WRLOELAUXZYGJX-LSDHHAIUSA-N	444.463	1.604	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)NC(=O)CC3)cc1	763862730	ZXDJVICOXQKBNM-ZDUSSCGKSA-N	440.456	1.523	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)NC(=O)[C@@H](C)O2	763863873	DUOGSQPTSKASRB-GHMZBOCLSA-N	430.392	1.099	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)Cc2c[nH]c3ccccc23)cc1	763864986	GDRFELPCXOKQJR-UHFFFAOYSA-N	443.485	1.258	50	20	IDGD	
COCCn1ncc2ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc3ccccc3F)cc21	763865819	QRYFSAMFQRNPEY-CYBMUJFWSA-N	443.435	1.375	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(OC)c([N+](=O)[O-])c2)cc1OC	763912790	UGDVJLGFGVUOOM-UHFFFAOYSA-N	432.389	1.410	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)C(=O)Nc1cccc(NC(=O)c2ccncc2)c1	763919778	UUOQGUWIZSCRHF-UHFFFAOYSA-N	435.415	1.802	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)[C@@H](C)n1c(C)cc(O)cc1=O	764021735	VEIATXNIVPUGIM-LLVKDONJSA-N	437.836	1.090	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1O)C(=O)Nc1ccc(C(=O)N2CCCC2)cc1	764117044	NMFXOAVHTHTTPE-UHFFFAOYSA-N	430.848	1.681	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2ccncc2Br)cc1OC	764146405	UEICOEOAFAOWGB-UHFFFAOYSA-N	438.234	1.479	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)C(=O)Nc1cc(C(F)(F)F)cnc1O	764204061	IGKVXSPPILCNTR-UHFFFAOYSA-N	449.386	1.197	50	20	IDGD	
O=C(CCCc1ccccc1)NNC(=O)C(=O)Nc1cc(N2CCNC2=O)ccc1Cl	764223586	JUKHKQXIELHWNH-UHFFFAOYSA-N	443.891	1.978	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)C(=O)Nc1ccc(CN2CCCC2=O)cc1	764243712	WWKQZAYUIFTDCC-UHFFFAOYSA-N	433.468	1.550	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)Cc2cccnc2)cc1OCc1ccncc1	764267020	QURUFHYNARUCNQ-UHFFFAOYSA-N	435.440	1.393	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)C(=O)Nc1ccc(F)cc1CS(C)(=O)=O)c1ccccc1	764327583	BYTBTKVGAABGBB-MRXNPFEDSA-N	435.477	1.650	50	20	IDGD	
CCc1nnc(-c2ccc(NC(=O)C(=O)NNC(=O)c3cnn(-c4ccccc4)c3)cc2)o1	764345930	MLNCBXVFNPUSOJ-UHFFFAOYSA-N	445.439	1.884	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1F)C(=O)Nc1ccc(NC(=O)[C@H]2CCCO2)cc1	764412619	KNPLKODVCMGORA-MRXNPFEDSA-N	448.838	1.996	50	20	IDGD	
CC/C=C(/C)C(=O)N1CSC[C@@H]1C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C	765320100	LAPHHANXDSFIQG-YLHGKKIISA-N	428.555	1.697	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)CCN3C(=O)[C@H]4CCCC[C@@H]4C3=O)n[nH]2)cc1	765576966	WEVFYVJUAVLPFB-IRXDYDNUSA-N	437.500	1.965	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)c2ccc(N3C(=O)CCC3=O)c([N+](=O)[O-])c2)c(OC)c1	768109528	LQADXBVHXBVPOQ-UHFFFAOYSA-N	442.384	1.800	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)[C@H](O)[C@H](O)c1nc2ccccc2s1	768639434	QNCATICDEMAXSI-CVEARBPZSA-N	437.499	1.246	50	20	IDGD	
C[C@@H](O)CNC(=O)/C(C#N)=C/c1cn(CCC(N)=O)nc1-c1cccc(Br)c1	769106872	PRZVHJADNUIIQH-CWZJEYLYSA-N	446.305	1.592	50	20	IDGD	
COCCCn1c(S)nc2cc(C(=O)NNC(=S)NCCSC)ccc2c1=O	770248909	WYDPAGWTKQHSNN-UHFFFAOYSA-N	441.604	1.194	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)NCc1ccc2c(c1)CCS2(=O)=O	770545983	OUERUXHNINPILI-LBPRGKRZSA-N	437.905	1.968	50	20	IDGD	
CN1CCN(C(=O)c2ccc(NC(=O)C(=O)NNc3c(F)cccc3Cl)cc2)CC1	770811829	XCMWBSNGANONRN-UHFFFAOYSA-N	433.871	1.949	50	20	IDGD	
CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCN(S(=O)(=O)CBr)CC1	771446180	FBAWFHGNNMJTSA-LLVKDONJSA-N	428.349	1.116	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2cnc3ccccc3n2)cc1S(=O)(=O)N(C)C	773722498	GMNGNJHVVMTLFG-UHFFFAOYSA-N	428.474	1.270	50	20	IDGD	
CC[C@@H](C)NS(=O)(=O)Cc1cccc(NC(=O)C(=O)NNc2nccnc2C(C)C)c1	773992294	HWJNUFRMUCLDJR-CQSZACIVSA-N	448.549	1.900	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NC[C@@H]2CC[C@@H](C(=O)N(C)C)O2)cc1Br	774715428	FQKRDRLJZBNVEM-FZMZJTMJSA-N	443.298	1.038	50	20	IDGD	
CCOC(=O)c1cnc(C)c(C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c1	775054340	UAYIEOZNZIUPNV-UHFFFAOYSA-N	430.373	1.093	50	20	IDGD	
COc1cccc(OC)c1S(=O)(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12	775252046	APRLKHLTOLQQLO-UHFFFAOYSA-N	446.485	1.618	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)CCCNS(=O)(=O)c2ccc(F)cc2)c1	776534549	SEKCPICUBYGOKK-UHFFFAOYSA-N	429.495	1.431	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)CNC(=O)OC(C)(C)C)[C@@H]1CN(Cc2ccccc2)CCO1	778673621	BKRRTCYFQAJGOM-WBVHZDCISA-N	435.525	1.131	50	20	IDGD	
CC(C)(C)c1ccc(NNC(=O)c2cccc(S(=O)(=O)N3CCNC(=O)C3)c2)cc1	780803944	SISQPNXDBWNHMA-UHFFFAOYSA-N	430.530	1.862	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)nc1Br	781615202	REFZEHOANWXCFI-UHFFFAOYSA-N	428.264	1.331	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)NCc2ccccc2CN2CC[C@H](O)C2)cc1	781835992	WAHRJRQVVHFZLY-FQEVSTJZSA-N	426.517	1.725	50	20	IDGD	
COC(=O)COc1ccc(C=NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1	782222872	FTOXGQJXBRSCRM-UHFFFAOYSA-N	425.850	1.303	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)nc2ccccc21	782894997	UXVCKUOIZFYEAB-UHFFFAOYSA-N	430.808	1.464	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2cccc(C[S@](=O)c3ccccc3)c2)CCS(=O)(=O)C1	783426045	FOQMANKMKALNSD-OLILMLBXSA-N	449.554	1.131	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2ccc(CCCc3ccccc3)cc2)CCS(=O)(=O)C1	783428542	XAXBTVBSSHWSCR-QFIPXVFZSA-N	429.542	1.998	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2ccc(-n3cccn3)nn2)nn1-c1ccccc1Cl	783436191	HGUMLFLXEDCRQC-UHFFFAOYSA-N	437.851	1.892	50	20	IDGD	
CC(C)(C)OC(=O)Cc1cccc(NC(=O)C(=O)NNc2ccc(-n3cccn3)nn2)c1	783437310	WWMZTMUNRSEGBH-UHFFFAOYSA-N	437.460	1.628	50	20	IDGD	
O=C(NN=Cc1ncc(Br)cc1Br)N[C@H]1CCS(=O)(=O)C1	783831582	LWPGOTFWKPGLOI-QMMMGPOBSA-N	440.117	1.427	50	20	IDGD	
Cc1nnc(Sc2ccc(NC(=O)C(=O)NNC(=O)C(=O)N3CCCC3)c(C)c2)s1	783998610	FCKHPNAQVNROBH-UHFFFAOYSA-N	448.530	1.014	50	20	IDGD	
Cc1ccc(-n2nccc2NC(=O)C(=O)NNc2nc(-c3ccc(Cl)cc3)no2)nn1	784796039	YCQSQDURSDDINL-UHFFFAOYSA-N	439.823	1.756	50	20	IDGD	
COC(=O)[C@H]1CN(C(=O)C(=O)NNc2ccc(Br)nc2)c2ccccc2O1	784806263	DXTDSNMFFSXQNV-CYBMUJFWSA-N	435.234	1.254	50	20	IDGD	
COc1cccc(NNC(=O)C(=O)Nc2ccnn2Cc2cccc(OC)c2OC)n1	784842165	IQAZDLIFFDVUGY-UHFFFAOYSA-N	426.433	1.434	50	20	IDGD	
O=C(CN1CCCCCC1)Nc1cccc(NC(=O)C(=O)NNc2ncc(F)cn2)c1	784950080	LWRRHVHZVGWCNZ-UHFFFAOYSA-N	429.456	1.512	50	20	IDGD	
O=C(Cc1csc(Cc2cccc(Cl)c2)n1)NNC(=O)N[C@H]1CCS(=O)(=O)C1	787164646	MQYWGUBIDVZMHV-ZDUSSCGKSA-N	442.950	1.447	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)NNC(=O)[C@@H]1CCN(c2ccc3c(c2)OCCO3)C1=O	787435821	BMEZHCWHOLMBBY-INIZCTEOSA-N	444.875	1.995	50	20	IDGD	
COc1ccc(OC)c([C@@H]2C[C@@H]2C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1	788091934	UZXBJOGRYBYWQL-WMZOPIPTSA-N	425.489	1.661	50	20	IDGD	
COCCOc1cc(OC)ccc1C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	788447057	SVDYJRZUKUREGV-UHFFFAOYSA-N	429.477	1.188	50	20	IDGD	
O=C(NNC(=O)C(=O)Nc1ccccn1)N[C@@H]1CCN(c2ccc(Cl)cc2Cl)C1	788905644	KIANWFMDROVECG-GFCCVEGCSA-N	437.287	1.936	50	20	IDGD	
CC(=O)Nc1cc(NC(C)=O)cc(C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)c1	789852780	JJLRMXYVNIXNHI-UHFFFAOYSA-N	436.428	1.570	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@H](C(=O)NNC(=O)C(=O)Nc1ccccn1)c1ccc(F)cc1	792222392	RUFUOUDBHFZIEG-HNNXBMFYSA-N	445.451	1.615	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)cccc1NC(=O)N(C)C	792351170	QEACYTKTSSKRIN-UHFFFAOYSA-N	449.471	1.878	50	20	IDGD	
COC(=O)c1ccc(-n2cc(C)cn2)c(NC(=O)C(=O)NNc2nc3ccccn3n2)c1	792396132	XTGGYHJGGWKAHZ-UHFFFAOYSA-N	434.416	1.092	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)[C@](C)(O)CN2C(=O)C(C)(C)c3ccccc32)cc1	792801925	DEZMVOPYDOOFEF-XMMPIXPASA-N	439.512	1.851	50	20	IDGD	
CCCS(=O)(=O)Nc1ccc(C(=O)NNC(=O)CNC(=O)OCc2ccccc2)cc1	794074902	DNQRSJMTMQZXOW-UHFFFAOYSA-N	448.501	1.526	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccoc1)c1ccccc1NS(=O)(=O)c1cccs1	795281165	RKMHCIHJGNHCEW-UHFFFAOYSA-N	427.485	1.765	50	20	IDGD	
CC(C)(C)OC(=O)N1CCOC[C@H]1CC(=O)NNc1nc(O)c2cnn(C(C)(C)C)c2n1	796365899	JDHWOKAVRUAUOQ-GFCCVEGCSA-N	449.512	1.756	50	20	IDGD	
CCc1ccc(CC)c(NC(=O)C(=O)NNC(=O)CNC(=O)OCc2ccccc2)c1	797369459	YAHYAXYYYFBPAW-UHFFFAOYSA-N	426.473	1.824	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(C)n2)cc1OCc1ccncc1	797370197	HXSWIQGPPPFOOS-UHFFFAOYSA-N	435.440	1.772	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)N2C[C@H](CC(=O)N(C)C)c3cc(Cl)ccc32)n1	797371249	RTBUEQMFOJMMLZ-ZDUSSCGKSA-N	443.891	1.413	50	20	IDGD	
Cc1ccc([C@H](NCC(=O)NNC(=O)Cc2nc(C)cs2)[C@H](C)S(C)(=O)=O)cc1	797996932	FXFWSRZMMKVUKO-IFXJQAMLSA-N	438.575	1.214	50	20	IDGD	
C=CCNC(=S)NNC(=O)c1cc(I)ccc1N1CCOCC1	798305293	WTDVAPBGACWRAC-UHFFFAOYSA-N	446.314	1.423	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)[C@H]2CCCN2C(=O)c2ccc(OC)cc2)nc1C	798989652	LVGYYXGZWHKGPK-QGZVFWFLSA-N	427.461	1.718	50	20	IDGD	
CCOc1ccc(C(=O)NNS(=O)(=O)c2ccc(C(=O)OC)c(OC)c2)cc1OC	799120386	MJFIKTIJEYRHBM-UHFFFAOYSA-N	438.458	1.512	50	20	IDGD	
O=C(Cn1c(=O)nc(O)c2ccccc21)NNc1cc([N+](=O)[O-])ccc1Br	800697328	VGPOLKXFPMXEMQ-UHFFFAOYSA-N	434.206	1.916	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1)NNC(=O)Nc1ccccc1	801991320	MPVRSWVZXZRXGB-UHFFFAOYSA-N	432.380	1.716	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cccn2C)c(C)cc1Br	806976787	MFJZDYFJPNTPBU-UHFFFAOYSA-N	437.250	1.282	50	20	IDGD	
CCN(CC)CC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2cccc(C#N)c2)c1	806979350	ZLYKRZCLVQKCJB-UHFFFAOYSA-N	436.472	1.238	50	20	IDGD	
Cc1cc(-c2csc(NC(=O)C(=O)NNC(=O)Cc3cn4ccccc4n3)n2)c(C)o1	807019502	DDBBQSZYFCQVDO-UHFFFAOYSA-N	438.469	1.996	50	20	IDGD	
CNS(=O)(=O)c1cc(NC(=O)C(=O)NNc2ccc(Cl)c(OC)c2)ccc1F	807068592	MGIXLMYJYGGOPF-UHFFFAOYSA-N	430.845	1.478	50	20	IDGD	
O=S(=O)(CBr)N1CCN(S(=O)(=O)Cc2cccc(Cl)c2)CC1	808305984	JRKNPJMIIADSTH-UHFFFAOYSA-N	431.761	1.470	50	20	IDGD	
Cc1cc(O)nc2cc(C(=O)OCC(=O)NNC(=O)[C@H]3COc4ccccc4O3)ccc12	808658668	IONBUEODBIJDLF-GOSISDBHSA-N	437.408	1.393	50	20	IDGD	
CNC(=O)c1cc(Oc2ccc(NC(=O)C(=O)NNc3cnccn3)cc2F)ccn1	810382783	MZUAATCIVSLIQR-UHFFFAOYSA-N	425.380	1.244	50	20	IDGD	
CC1(C)CCCc2sc(NC(=O)C(=O)NNC(=O)[C@H]3COc4ccccc4O3)nc21	810385683	YUXUWRVHKOVBBQ-CYBMUJFWSA-N	430.486	1.683	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2ncccc2N(C)C)c1	812536404	ALGHDJUBZIUJTB-UHFFFAOYSA-N	448.549	1.322	50	20	IDGD	
Cc1cnc(Br)c(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)c1	812980090	KCYNZJSDPCBHAD-UHFFFAOYSA-N	439.291	1.736	50	20	IDGD	
CCOc1ccc(OCc2ccc(C(=O)NNC(=O)C(=O)Nc3cn(C)nn3)cc2)cc1	815565009	ZZKLFULTBYLZET-UHFFFAOYSA-N	438.444	1.193	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)CN2C(=O)N[C@](C)(C3CC3)C2=O)c1	816717600	JDTDVXNTBAODDT-QGZVFWFLSA-N	439.266	1.399	50	20	IDGD	
CNS(=O)(=O)NC1CCN(C(=O)/C(C#N)=C/c2cc(C)n(C[C@@H]3CCCO3)c2C)CC1	819579692	GYWHHEYNUCKNKD-YWFITGJYSA-N	449.577	1.236	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NCC(=O)NNc2ccccc2C(F)(F)F)c1	825282576	SEBVAFVRUUYSFQ-UHFFFAOYSA-N	444.435	1.829	50	20	IDGD	
CCN1CCC[C@@H]1CNC(=S)NNC(=O)c1cccc(S(=O)(=O)N(CC)CC)c1	884004365	VROIOFXGBCBPKI-MRXNPFEDSA-N	441.623	1.310	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2cnc3ccc(C)cn3c2=O)c2ccccc2c1=O	912896179	PYDCOIZYQRKVDV-UHFFFAOYSA-N	432.440	1.198	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H]2CC(c3ccccc3)=NO2)c1	916096285	MKOGQBUIRIVAFP-LJQANCHMSA-N	444.513	1.671	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2cccc(N3CCOC3=O)c2)ccc1Cl	916133304	DQSGCBFKJGYDEV-UHFFFAOYSA-N	438.849	1.019	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)CNC(=O)c1ccc(Br)s1	916727837	OKMPUZOQSMIIEO-VIFPVBQESA-N	444.282	1.994	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)NCc2ccc(CN3CCCC3=O)cc2)nc2ccccc21	918124932	IZVFTWZCLWSFLC-UHFFFAOYSA-N	434.500	1.769	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)N1CCC(C(=O)NCC(F)(F)F)CC1	918776044	GTYKQKMKMMUAOW-UHFFFAOYSA-N	426.399	1.388	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)N[C@@H]1CCCN(S(C)(=O)=O)C1	920240205	MWBNZKHRKSVWBJ-CQSZACIVSA-N	437.547	1.487	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)NCCCS(=O)(=O)c2ccccc2)nc2ccccc21	921248005	PGTXISYUZLQCIO-UHFFFAOYSA-N	429.502	1.310	50	20	IDGD	
CCS(=O)(=O)Nc1cccc(C(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)c1	1115831511	CYSWPCRVMNLXIT-UHFFFAOYSA-N	439.877	1.720	50	20	IDGD	
CCCNS(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)c2ccc(OC)cc2)cc1	1117532178	YZTYRSYORXLMEF-UHFFFAOYSA-N	427.504	1.007	50	20	IDGD	
O=C(NNC(=O)c1n[nH]c2c1CCCC2)Nc1cccc(C(=O)N2CCSCC2)c1	1323831636	XIHRNKOBSPRHMI-UHFFFAOYSA-N	428.518	1.944	50	20	IDGD	
O=C(c1ccc2cnccc2n1)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1777737230	UZCOSDUAOGJZGE-QAPCUYQASA-N	437.269	1.764	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4ncncc4c3)C2)C1	1778602401	UCAPDBZPHFQARC-OAQYLSRUSA-N	428.565	1.925	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cccn(C(F)F)c1=O)CCO2	1779298966	RLLOJVDANRVQRB-LJQANCHMSA-N	443.523	1.538	50	20	IDGD	
C[C@@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@](C)(Cl)CCl)C1)n1cncn1	1780715199	MDXORIJVYYVADL-MJSCVDMRSA-N	432.352	1.589	50	20	IDGD	
COc1ccccc1OCC(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781324934	FVENLHHBYQIWQI-AEFFLSMTSA-N	445.285	1.594	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccccc3C(N)=O)C2)C1	1781761176	YZAKYCMTSYEBBR-RBUKOAKNSA-N	428.316	1.465	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1noc(C)n1)C2	1781901434	MUMVLQCWGGWYSF-HBUWYVDXSA-N	443.342	1.608	50	20	IDGD	
O=C(CCc1ccc(F)cc1)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2	1782028077	BOVOMLNXMVUURG-WAOWUJCRSA-N	426.916	1.872	50	20	IDGD	
N#Cc1cc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)cc(C(F)(F)F)c1	1782031021	QOEWCNAVVDOHRP-CRAIPNDOSA-N	445.825	1.620	50	20	IDGD	
C[C@H](Sc1ccccn1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2	1782495774	RMXLELDFKVAXLQ-ZFCANOHDSA-N	441.981	1.676	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(CCN(C(=O)c3nc4ccc(F)cn4n3)C2)C1	1782567978	STPVPAAQAKRNBG-LJQANCHMSA-N	435.532	1.163	50	20	IDGD	
CC(C)N(C)CC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)CBr)C2	1782733177	BOCBDTAUBSNECJ-FRQCXROJSA-N	432.403	1.872	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3c(F)cncc3F)CCO2)C1	1783351316	JLPIQLMSUTZYFC-PIGZYNQJSA-N	432.265	1.977	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccnc(C(F)(F)F)c3)CCO2)C1	1783873049	JCWLSKPGZKGROP-DYVFJYSZSA-N	435.830	1.798	50	20	IDGD	
CC(C)n1nc(C(=O)N2CCO[C@@]3(CCN(C(=O)C(Cl)Cl)C3)C2)cc1C(=O)O	1783944357	XWMUUMIXIMYMFV-QGZVFWFLSA-N	433.292	1.409	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(C)cnc3Cl)[C@H]2C1	1786257904	XLQAHOAZPPOGBT-HNKHHVNMSA-N	430.332	1.891	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnoc3C3CC3)[C@H]2C1	1786289890	YKPHRAAZWASHKQ-WCUVEOEZSA-N	426.311	1.929	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)c1cnc2c(Cl)cccn12	1787241652	XAHPCEKIWXDSHX-APYUEPQZSA-N	441.315	1.181	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)Nc3nccs3)[C@H]2C1	1787490057	XXDVYBADQRNNKN-QTVXIADOSA-N	430.958	1.177	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc4cccn4cn3)[C@H]2C1	1788074329	JAMMEVOBIHGNLX-DNUAJFIVSA-N	449.349	1.959	50	20	IDGD	
CC[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]2C1)N(CC)CC	1788765938	WOUXGWKMZBEISY-OKYOBFRVSA-N	427.662	1.938	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3CCC(O)CC3)C[C@@H]21	1790963912	OEDKQQIHLHODIK-SGQZPCGUSA-N	431.371	1.691	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)Oc3ccccn3)[C@H]2C1	1791627521	XIJHIGODXPIURK-HMDCTGQHSA-N	425.913	1.082	50	20	IDGD	
Cc1nccn1[C@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21	1791704987	QNUNHYHYCSVIHA-BFYSQQLMSA-N	431.306	1.423	50	20	IDGD	
COc1ncc(Cl)cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CO[Si](C)(C)C)C2	1792400873	CMPBDMJWYSAMNC-FVCICTRLSA-N	441.988	1.798	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1C[C@@H]1c1ccc(OC)cc1	1793301266	ILVRBQMRWCPLFU-YSWVRCCISA-N	436.936	1.642	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cccc(Cl)n1	1794195818	YYWULTJFTODJDD-LSSIXWDNSA-N	430.730	1.651	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1c(F)ccnc1Cl	1794237547	BYMMTKAPIXMWSK-VVJJBPBLSA-N	438.656	1.768	50	20	IDGD	
CCOc1cccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCBr)c1O	1795115328	YSTDXLOVVUICSA-FVCICTRLSA-N	441.322	1.779	50	20	IDGD	
COc1cccc2[nH]cc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3ccc(B(O)O)cc3)c12	1796189471	QSMBOGQBHNZYPY-BCDXTJNWSA-N	447.300	1.422	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)c1cccc2ncsc12	1796191463	OSVVUSHRJBUDEI-BJWYYQGGSA-N	435.314	1.542	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CSc1ccccc1[N+](=O)[O-])C2)[C@@H](F)Cl	1796369442	YCKQDJMJAZXFOD-OXUXUCFPSA-N	431.873	1.811	50	20	IDGD	
CC(C)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(N2CCOCC2)cc1	1796489145	BDIBNCABKJBKGF-OPVJXMOQSA-N	449.979	1.991	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1csc2c1CCCO2)c1ccc(B(O)O)cc1	1796554982	KSCZAUVENZNMKB-BJWYYQGGSA-N	440.330	1.319	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2)c1csc(Br)n1	1796691889	MXNVQUISWLEIQY-SRSLHRDFSA-N	443.150	1.913	50	20	IDGD	
COc1ccc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CO[Si](C)(C)C)cn1	1797952901	QEDZFMOMAZLGBK-UPHUGPLXSA-N	435.597	1.464	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)Nc1ccccn1	1797976111	JATBGUBHMNZAFZ-QKDZRIPBSA-N	425.327	1.255	50	20	IDGD	
COc1c(Cl)ccnc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)Br)C2	1798690265	WMYAATVAGRLDQE-KQXIARHKSA-N	446.729	1.730	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnn3c1OCCC3)C2	1799279922	XQGBDUVBKPILOU-JPVZDGGYSA-N	431.320	1.105	50	20	IDGD	
COc1ccc(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](O)CCl)C3)c([N+](=O)[O-])c1	1800235198	KBVWWSHFOBEFCK-LOUJCGABSA-N	425.869	1.384	50	20	IDGD	
COc1cc(Cl)ccc1CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2	1800353025	JZCCOCOEXWMMOW-HRJSJKBJSA-N	431.316	1.080	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1noc3c1CCCC3)C2	1800639876	PSUOEKGYYXWOMV-LMWOUKEDSA-N	440.338	1.930	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Nc1nccs1)C2	1800757803	QNYBQQWVQMFUDE-NJMOYASZSA-N	431.356	1.317	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2	1800760045	YNOYRKWIQRYWQN-CBRVECNMSA-N	447.713	1.738	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C[C@@H]1COc3ccccc3O1)C2	1800971399	YLFOQXDXHIENJG-YTMVRGIBSA-N	438.908	1.060	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(C)(C)Cc1ccccc1)C2	1801008849	FAWUSQNOYHJGDM-HATOLVCRSA-N	444.576	1.218	50	20	IDGD	
O=C1C[C@@H](C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](Br)Cc2ccccc2)C3)CN1	1801678847	IWSUVERGOXPDBH-SFFUCWETSA-N	448.361	1.767	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)c2cc[nH]n2)[C@@H]1c1cccnc1	1803760847	JVHIHFPIESLBPT-VQMZYRHSSA-N	448.487	1.258	50	20	IDGD	
CN1CCC[C@H]1C(=O)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@H]1c1cccnc1	1803944287	YKMBMHODPSFYDR-VGWMRTNUSA-N	427.318	1.872	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1(F)CN(C(=O)OC(C)(C)C)C1	1804552972	AHMZELKOQVIKGE-XGUBFFRZSA-N	447.935	1.837	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)Cc2cncnc2)[C@H]1c1cccnc1	1804654784	VBIAGSSDBVDQLL-FDQGKXFDSA-N	432.322	1.904	50	20	IDGD	
Cc1occc1C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1805614873	IMIHHZAETVKDRI-RXVVDRJESA-N	433.273	1.296	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)Cc2c(C)n[nH]c2C)[C@H]1c1cccnc1	1810414770	UQYLMTWRCGPEMY-IMFGXOCKSA-N	433.940	1.924	50	20	IDGD	
Cc1ccc(=O)n(C(C)(C)C(=O)NC[C@@H]2CCN(C(=O)[C@@H](F)Cl)[C@@H]2c2cccnc2)n1	1810492561	YMOQDEQWYPBHPQ-CGTJXYLNSA-N	449.914	1.922	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)[C@@H]2CCC(=O)N2)[C@H]1c1cccnc1	1812774694	CWWLAUBMLLZFIH-JKQORVJESA-N	437.338	1.540	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)CN2CCCCC2=O)[C@@H]1c1cccnc1	1813033976	YKZYHWUDPXOLGG-FUHIMQAGSA-N	436.940	1.354	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H]2CCC(=O)NC2)n[nH]1	1814519042	YJBMBWOECMOFEH-MBNYWOFBSA-N	440.342	1.959	50	20	IDGD	
Cc1nc[nH]c1CSCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](O)CCl)n[nH]1	1814873375	QFGIIVDRYUOCDG-CABCVRRESA-N	440.957	1.966	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)COC(=O)C(F)(F)F)[nH]n1)[C@H](O)CCl	1814873757	UCMRCHSNEPCTQF-VHSXEESVSA-N	426.779	1.107	50	20	IDGD	
CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N[C@H]1CCc2nc(NC(=O)[C@H](F)Cl)sc2C1	1817133946	PLFJRJAVHUENEN-BHYNMZESSA-N	442.904	1.060	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](C)Br)CC2	1817310184	OBAYBSZINDPZCC-FXPVBKGRSA-N	431.356	1.705	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)COc2ccccc2)[nH]n1)c1ccc(B(O)O)cc1	1817471646	UPUPKJXCZSOMPF-FQEVSTJZSA-N	448.288	1.474	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)Cc2ccccn2)n[nH]1	1817639685	URRVCEDZNJDLET-GOSISDBHSA-N	448.487	1.352	50	20	IDGD	
C[C@H](CS(C)(=O)=O)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CO[Si](C)(C)C)n[nH]1	1819592001	SRDQRWAANSHQPF-UKRRQHHQSA-N	444.630	1.934	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(F)nc3)sc2C1	1820371675	RBPMCMRCDHZKIB-LBPRGKRZSA-N	434.497	1.276	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3cnncc3C(=O)O)sc2C1	1820502145	FBQRNHICBXVCOT-GZMMTYOYSA-N	439.881	1.111	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)CCBr)[nH]n1)[C@@H]1CCCS1(=O)=O	1821830762	AVJXRNIISZMNHT-OLZOCXBDSA-N	447.355	1.764	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](C)Nc2cnccn2)[nH]n1	1822370150	LFCMNIQZGSWPKN-VNHYZAJKSA-N	435.916	1.946	50	20	IDGD	
O=C(N[C@@H]1CCc2nc(NC(=O)[C@H]3CC=CCC3)sc2C1)c1cccc(B(O)O)c1	1822787375	ZXLAZNZICIZVBM-XJKSGUPXSA-N	425.319	1.405	50	20	IDGD	
CNc1nsnc1C(=O)N[C@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1	1822998864	JDGIVSPLUDQIIT-CDUCUWFYSA-N	449.331	1.953	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H]2CCC(=O)N2)CC1	1824094679	XUWGCYFLWBBGRZ-KBMXLJTQSA-N	428.371	1.916	50	20	IDGD	
CC1(C)CC(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cccc(B(O)O)c2)CC3)C1	1826201255	PRNSBFDBNLTZPB-HNNXBMFYSA-N	427.335	1.485	50	20	IDGD	
N=C1NCCN1CC(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H](F)Br)CC1	1826874369	NAEHVFUIEDZYHD-HIFRSBDPSA-N	432.338	1.137	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)Cc2ccsc2)CC1	1827161703	RBICRQOHZUJKHV-NRFANRHFSA-N	440.374	1.904	50	20	IDGD	
C[C@]1(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2ccc(B(O)O)cc2)CC3)CC1(F)F	1828047744	UMRCVUSJXPITTR-KPZWWZAWSA-N	435.261	1.094	50	20	IDGD	
CC1=C(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)CC2)CCO1	1828926253	CBHFKMFQSITCIO-HXUWFJFHSA-N	441.532	1.613	50	20	IDGD	
CC(C)(C)NCC(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1	1828926968	VFLGYKIIFXNTQF-LJQANCHMSA-N	444.580	1.307	50	20	IDGD	
Cc1ccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)c(C)n1	1829530074	MSBHBNHUWBJDQX-HSZRJFAPSA-N	449.360	1.925	50	20	IDGD	
CCCNC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](Cl)CCC)CCO2	1831640718	QMTCYJDAWJUMFV-OXJNMPFZSA-N	431.961	1.157	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccnn3C(C)C)C2)C1	1831649708	ANDOJFGZUCEPEF-JXFKEZNVSA-N	426.945	1.942	50	20	IDGD	
CC[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1)N(CC)CC	1831662165	NLTOGXNYFZXMHZ-DYESRHJHSA-N	432.005	1.828	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H]2C[C@]2(F)Cl)CC1	1831963632	KNBWTHCFIDFNGA-GQIGUUNPSA-N	430.952	1.904	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3csc(C)n3)CCO2)C1	1832963817	GJCUSUVMELNCCL-APWZRJJASA-N	429.970	1.858	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1coc(Cl)n1)CCO2	1833557007	XTGNPWJBSGGOSS-QGZVFWFLSA-N	431.949	1.250	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)[C@@H](F)c1ccccc1	1833652228	BKGONECAXPULJJ-MOPGFXCFSA-N	425.932	1.869	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3n[nH]c(C4CC4)c3F)CCO2)C1	1833685218	WKZKHSQLHZFYCP-BFUOFWGJSA-N	428.892	1.514	50	20	IDGD	
O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)CCN1CCCCC1)CCO2	1835132438	ZOAUUMMNRKOBMM-IBGZPJMESA-N	446.386	1.104	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@H]3Cc4ccccc4O3)CC2)CC1	1835478660	CJJUZAYYLGHOCV-TZIWHRDSSA-N	449.979	1.816	50	20	IDGD	
O=C([C@H](O)CCl)N1CCC(N2CCC(NC(=O)C3(C(F)(F)F)CC3)CC2)CC1	1835492358	LYGBKGAJJYQBQB-CQSZACIVSA-N	425.879	1.500	50	20	IDGD	
CC(C)CNC(=O)C(=O)N1CCC(N2CCC(NC(=O)[C@](C)(Cl)CCl)CC2)CC1	1836398367	OONZMBKMEPBGJE-HXUWFJFHSA-N	449.423	1.567	50	20	IDGD	
Cc1cc(/C=C/C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)no1	1837558596	RISKQGXWLXQFHY-MDEMMKGOSA-N	442.310	1.236	50	20	IDGD	
O=C(CCBr)N1CCC(OC2CCN(C(=O)c3cc(O)no3)CC2)CC1	1837654405	IPNWQEVQBNBOHN-UHFFFAOYSA-N	430.299	1.777	50	20	IDGD	
C=CCOCCCC(=O)N1CCOC[C@]2(C1)CN(C(=O)CO[Si](C)(C)C)CCO2	1837710269	RQWBEGVEMVPLPW-FQEVSTJZSA-N	428.602	1.277	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc4c[nH]nc34)C2)C1	1837711680	NOMRAITYJJHNJM-OAQYLSRUSA-N	446.580	1.484	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(O)ccc3O)C2)C1	1837716022	XTGHCURRDPBDTM-HXUWFJFHSA-N	438.553	1.019	50	20	IDGD	
CC(C)(C(=O)N1CCOC[C@@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1)c1ccccn1	1837717620	JJSRXLRUZCOGJN-JOCHJYFZSA-N	449.624	1.667	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3csc(N)n3)CC2)CC1	1837893209	CYDNVVSRGVMQFB-AWEZNQCLSA-N	430.958	1.591	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cn4cccnc4n3)CC2)CC1	1838315135	GXJUFOMYOQMJIR-QGZVFWFLSA-N	449.939	1.595	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(O)nc3)CCO2)C1	1838655278	WEQMVEMLZVFGGD-RDTXWAMCSA-N	442.310	1.031	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cn(C(C)(C)C)nn3)CCO2)C1	1838756224	ZHKNWCVZTGMQRD-QRWLVFNGSA-N	441.960	1.511	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3c(C)nc4sccn34)C2)C1	1839146226	WUMZKROSVYGIPH-LIRRHRJNSA-N	440.953	1.792	50	20	IDGD	
Cc1nc(F)ccc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2	1839153784	SGXIVCDMMQJETP-RBUKOAKNSA-N	448.322	1.835	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)ccn1	1839153901	VQPDJNKFGQMHHE-RTBURBONSA-N	430.332	1.696	50	20	IDGD	
C=C(C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2)C(F)(F)F	1839155254	PNFJCJOCFDYKQT-GJZGRUSLSA-N	433.254	1.798	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc4ccsc4[nH]3)CCO2)C1	1839521634	AORIAPVADAVBDA-IFXJQAMLSA-N	441.937	1.553	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(O)cc3)C2)C1	1839966103	VEPISTLWYXAUJU-QFBILLFUSA-N	441.322	1.636	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CSC3CCCC3)C2)C1	1840150088	FJZQSKXIHLDKHM-APWZRJJASA-N	434.986	1.372	50	20	IDGD	
O=C([C@H](F)Cl)N1CC2(CCCN2C(=O)c2nccn(Cc3ccc(F)cc3)c2=O)C1	1842242474	PCGZPKPSTQOEJE-INIZCTEOSA-N	436.846	1.782	50	20	IDGD	
Cn1cncc1C(=O)N1CCCC12CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1842490121	VGYOUEQJEHKGBU-ZDUSSCGKSA-N	425.917	1.369	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC2(CCCN2C(=O)Cn2ccnc2)C1	1842507880	UATODYSBDVWALF-AWEZNQCLSA-N	425.917	1.219	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)CCc1ncccc1C)C2	1843415585	ZEOSTHJEKHBLTL-YZSQISJMSA-N	436.516	1.660	50	20	IDGD	
O=C([C@H](O)CCl)N1CC2(CCCN2C(=O)c2cc3cc(Br)ccn3n2)C1	1844147903	GSZOCBXXXAYMFA-CQSZACIVSA-N	441.713	1.514	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@H](O)CC(=O)N1CCCC12CN(C(=O)C(C)(C)CCl)C2	1845228839	OJQPWSITUROPDS-CQSZACIVSA-N	431.961	1.731	50	20	IDGD	
CC(C)(C)OC(=O)N1CCCC[C@@H]1C(=O)N1CCCC12CN(C(=O)[C@H](O)CCl)C2	1846197587	ASMJTCNWMLVUCU-HUUCEWRRSA-N	429.945	1.579	50	20	IDGD	
[N-]=[N+]=NCCOCCOCCOCCSSCCC(=O)ON1C(=O)CCC1=O	1857523725	GULGJNLQJQCHEW-UHFFFAOYSA-N	436.512	1.725	50	20	IDGD	
C[S@@](=O)Cc1cccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1	11771814	VPOKBWNINORCNV-LJAQVGFWSA-N	449.554	1.424	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2ccc(N3CCOCC3)nc2)c2ccccc2c1=O	14347682	WLFZBUKURTYUBR-UHFFFAOYSA-N	436.472	1.113	50	20	IDGD	
Cc1nc2nc(N)nn2c(C)c1CC(=O)NNC(=O)COc1ccccc1-c1ccccc1	17202155	MXUBJOWLBSKANH-UHFFFAOYSA-N	445.483	1.759	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)NNC(=S)NCCc2cccs2)ccc1OC	21126251	LEVGWGKSSAYQDR-UHFFFAOYSA-N	428.561	1.016	50	20	IDGD	
CN(C)N(C(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12)[C@H]1CCS(=O)(=O)C1	104950228	RSKAHLCTLCILTM-KRWDZBQOSA-N	440.525	1.551	50	20	IDGD	
C[C@H]1CCCN(Cc2ccc(CNC(=O)NNC(=O)CNC(=O)c3ccco3)cc2)C1	725872770	RSHKSOSGESLQFV-INIZCTEOSA-N	427.505	1.772	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NCc1ccc(N2CCC(CO)CC2)cc1	725873128	KOPJSZQLGYLDFO-UHFFFAOYSA-N	445.545	1.217	50	20	IDGD	
CCN(CCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)C1CC1	726281132	AUEGOFXWKOXERV-UHFFFAOYSA-N	437.566	1.290	50	20	IDGD	
Cn1cc(C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c(C2CCCCC2)n1	726836339	LZXONOZRCDRPDT-UHFFFAOYSA-N	429.433	1.994	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCOc2ccccc21)c1cccc(S(=O)(=O)N2CCOCC2)c1	728177283	YDWYTRJDELPSRJ-GOSISDBHSA-N	445.497	1.035	50	20	IDGD	
CN(C)S(=O)(=O)c1c[nH]c(C(=O)NNC(=O)c2ccc(Br)cc2Cl)c1	728869886	HRBKYFGZUXMMKQ-UHFFFAOYSA-N	449.714	1.756	50	20	IDGD	
COc1cccc(N2CCN(C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)CC2)c1	728958272	ZYDXGLKOCCQDDF-UHFFFAOYSA-N	439.520	1.265	50	20	IDGD	
CCn1c(NNC(=O)Cc2c(C)nc(-c3ncccn3)nc2O)nc2ccccc2c1=O	729259876	KOIPZIMHAUYPQD-UHFFFAOYSA-N	432.444	1.363	50	20	IDGD	
O=C(NNC(=O)N1CCN(c2ccccc2[N+](=O)[O-])CC1)c1cnn(-c2ccccc2)c1	733349736	GJPDNNAEYUABJN-UHFFFAOYSA-N	435.444	1.957	50	20	IDGD	
O=C(NCc1ccnc(OC2CCOCC2)c1)NNC(=O)c1cnn(-c2ccccc2)c1	733349753	HATLPYATGGTKDE-UHFFFAOYSA-N	436.472	1.969	50	20	IDGD	
CCCS(=O)(=O)Nc1ccccc1C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C	734240087	JDSZCBXOWABCCG-UHFFFAOYSA-N	443.526	1.307	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)c1ccc(Cl)c(NS(C)(=O)=O)c1	734240509	PBZFXNJPWBYDNK-UHFFFAOYSA-N	449.917	1.180	50	20	IDGD	
C[C@H](C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)C(C)(C)C	734387789	UEYVUTPJQWIRPU-OAHLLOKOSA-N	425.551	1.470	50	20	IDGD	
C[C@H]1CCCN(S(=O)(=O)c2cc(C(=O)NNC(=O)c3cnn(C)c3)ccc2Cl)C1	735446350	QYFJZIYNCLWERL-LBPRGKRZSA-N	439.925	1.569	50	20	IDGD	
C=CCn1c(=O)c2ccccc2n2c(SCC(=O)NNc3ccc(Cl)nn3)nnc12	735688882	DEXMBMOJTCXJID-UHFFFAOYSA-N	442.892	1.909	50	20	IDGD	
CN(CC1CC1)S(=O)(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1	737757293	OVMZDCHECKJOIV-OAQYLSRUSA-N	428.558	1.821	50	20	IDGD	
N#Cc1ccc(S(=O)(=O)NNC(=O)c2ccc(F)cc2Br)c([N+](=O)[O-])c1	741205431	YPHARKBZSNAFSC-UHFFFAOYSA-N	443.210	1.991	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2cccc(Br)c2)c2c1CCC2)C(=O)N1CCCC1	741681896	IMARUQCMVQYKHB-UHFFFAOYSA-N	446.305	1.507	50	20	IDGD	
Cc1ccc(CN2C[C@@H](C(=O)OCC(=O)NNC(=O)c3cccc(C#N)c3)CC2=O)cc1	741832038	OXLVXQDVXJJQAI-IBGZPJMESA-N	434.452	1.220	50	20	IDGD	
COc1ccc(OC)c(NC(=S)NNC(=O)Nc2ccc(S(N)(=O)=O)cc2)c1	741869902	JIBSNQYYOAHEKF-UHFFFAOYSA-N	425.492	1.374	50	20	IDGD	
C#CCNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cccc(Br)c2)cc1	742773121	NNCOYVIAQHURGD-UHFFFAOYSA-N	436.287	1.435	50	20	IDGD	
CN1CCN(c2ncccc2CNC(=O)NNC(=O)c2cccc(Br)c2)CC1	743566983	LXRAPWKSJKVICU-UHFFFAOYSA-N	447.337	1.740	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)c2ccc(C)c(S(N)(=O)=O)c2)cc1Cl	743834287	YMEVUTURXSUZJL-UHFFFAOYSA-N	442.881	1.780	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CN2CCC(NC(=O)Nc3ccc(F)cc3)CC2)c1	744388842	WZTSSMIVDLUJHB-UHFFFAOYSA-N	438.463	1.744	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1ccc(N2CCOCC2)cc1	744619875	BJOGSAUPDJTXQD-UHFFFAOYSA-N	446.529	1.301	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2c(F)cccc2[N+](=O)[O-])cc(OC)c1OC	745821552	AQCMKZPYBCMAEF-UHFFFAOYSA-N	429.382	1.383	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)N[C@@H]2CCCN(c3ccn(C)n3)C2=O)c1C	745882565	HQICZYRVXULAEU-HZPDHXFCSA-N	428.493	1.330	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NC[C@@H](C)Oc2cccc(OC)c2)c2ccccc2c1=O	745883295	RPNWLRGDOXGWAK-CQSZACIVSA-N	439.472	1.837	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NC[C@@H](C)C(=O)OC(C)C)c2ccccc2c1=O	745905769	NFIHHRJOHUQBLS-CQSZACIVSA-N	431.493	1.728	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)c1nc(C(C)(C)C)no1	745917624	NHAVRWHXVRXMJJ-MRXNPFEDSA-N	443.552	1.971	50	20	IDGD	
COc1cc([N+](=O)[O-])ccc1OC(=O)[C@H]1CC(=O)N(c2cccc(S(N)(=O)=O)c2)C1	746194317	NNFQWWXJHLERBT-NSHDSACASA-N	435.414	1.209	50	20	IDGD	
Cc1occc1C(=O)Nc1nc(CC(=O)NNC(=O)Cc2cn3ccccc3n2)cs1	746550437	MUYTUWJWTJEXLO-UHFFFAOYSA-N	438.469	1.877	50	20	IDGD	
COc1cccc(/C=C(/C(=O)NNC(=O)Cc2cn3ccccc3n2)n2nnnc2C)c1	746550574	PCYUNPNGLVRHFL-WQRHYEAKSA-N	432.444	1.026	50	20	IDGD	
Cc1ccc(C(=O)NNc2nccn(C)c2=O)cc1S(=O)(=O)NCc1ccccc1	747938365	UADIJNPBJULAHX-UHFFFAOYSA-N	427.486	1.324	50	20	IDGD	
C[C@@H]1CCCC[C@@]12NC(=O)N(CC(=O)NNc1nc(-c3ccccn3)nc3c1CCC3)C2=O	747983142	RGJYDDUDEDNCRV-QKFKETGDSA-N	449.515	1.971	50	20	IDGD	
NS(=O)(=O)c1cccc(N2C[C@@H](C(=O)NNc3ccc(OC(F)F)cc3)CC2=O)c1	748661736	ZCTPSNASABAZOM-NSHDSACASA-N	440.428	1.432	50	20	IDGD	
CNS(=O)(=O)c1csc(C(=O)NNC(=O)c2ccc(OC)c(Br)c2)c1	748710632	CUKKOXCCPQFAGF-UHFFFAOYSA-N	448.320	1.502	50	20	IDGD	
C[C@@H](C(=O)NNc1nc(Br)cn2ccnc12)S(=O)(=O)c1ccc(F)cc1	750247313	OXTJLJZDULOYGB-VIFPVBQESA-N	442.270	1.936	50	20	IDGD	
Cn1cc(C(=O)NNS(=O)(=O)c2scc(Br)c2Br)cn1	751214091	HZGKXHFKTCEPFW-UHFFFAOYSA-N	444.130	1.630	50	20	IDGD	
Cc1c(Cl)cc(S(=O)(=O)NNC(=O)CNC(=O)c2cccs2)cc1[N+](=O)[O-]	751278889	FLYRXMFVVUTFEY-UHFFFAOYSA-N	432.867	1.358	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)c2cc(Cn3cc(Br)cn3)on2)c1	752610980	IULJPBDMKRGXCY-UHFFFAOYSA-N	449.265	1.564	50	20	IDGD	
Cc1ccc([C@H](C)NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1[N+](=O)[O-]	753042921	ZNNMOWTXBAKUCA-ZDUSSCGKSA-N	449.489	1.859	50	20	IDGD	
N#Cc1ccc(NNC(=O)CNS(=O)(=O)c2ccc3c(c2)OCCCO3)cc1Cl	753523991	RVRPNHRZDWQOGP-UHFFFAOYSA-N	436.877	1.795	50	20	IDGD	
COC(=O)c1c(Br)ccc(NC(=O)C(=O)NNC(=O)c2ccc(C)o2)c1C	753842184	ZJTHAFAGAHFYLN-UHFFFAOYSA-N	438.234	1.845	50	20	IDGD	
O=C(Cc1ccc2c(c1)COC2)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	754842460	LXMUFYSARUEUCQ-UHFFFAOYSA-N	429.498	1.505	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCCCC2)cc1NC(=O)NNC(=O)Cc1cccnc1	755412571	QBWHTCGTWCJMEN-UHFFFAOYSA-N	447.517	1.660	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccccc2Cn2cncn2)c1	756151656	CRHBWFWTJHXZOX-UHFFFAOYSA-N	443.489	1.043	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)Nc1cccc(OCCS(C)(=O)=O)c1	756296899	DOGRHPSMBRYYJI-UHFFFAOYSA-N	437.474	1.350	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2ccn(Cc3ccccn3)n2)c2ccccc2c1=O	756646241	KDPZZZHKNVNYKT-UHFFFAOYSA-N	432.444	1.523	50	20	IDGD	
CCCNS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2c(C)nc3ccccn23)cc1	756777553	ZPILMTURCHJTKV-UHFFFAOYSA-N	430.490	1.798	50	20	IDGD	
O=C1C[C@H](Cc2ccc(NC(=O)NNC(=O)c3cnn(-c4ccccc4)c3)cc2)C(=O)N1	756817518	XLOWSOOYDWDVGG-HNNXBMFYSA-N	432.440	1.544	50	20	IDGD	
COC(=O)c1cc(NC(=O)NNC(=O)COc2ccc(C)c(C)c2)cc(S(C)(=O)=O)c1	757674027	NWNFMXMLPZULEO-UHFFFAOYSA-N	449.485	1.725	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1ccc(-c2ccc(Br)cc2)s1	758039129	HQNQGFXUKZFWKP-VIFPVBQESA-N	446.348	1.876	50	20	IDGD	
Cc1cc(C(=O)NNS(=O)(=O)c2ccc(S(C)(=O)=O)c(F)c2)c2ccccc2n1	760334959	NTSJLLUOXSJHGO-UHFFFAOYSA-N	437.474	1.709	50	20	IDGD	
Cn1cc(-n2cc(C(=O)NNc3c(F)cc(C(=O)NC4CC4)cc3F)ccc2=O)cn1	760924702	MKLNFAPTIAEVMI-UHFFFAOYSA-N	428.399	1.498	50	20	IDGD	
O=C(NNc1nccc(N2CCOCC2)n1)c1cnc(-c2ccc3c(c2)OCO3)s1	762857209	VTIYBRXMEQMWMS-UHFFFAOYSA-N	426.458	1.922	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)CCn3nc(O)c4ccccc4c3=O)n[nH]2)c1	763173890	FLWSYWFKAZTDMX-UHFFFAOYSA-N	446.467	1.960	50	20	IDGD	
CN(C)CCOc1cccc(NC(=O)C(=O)NNC(=O)c2ccccc2Br)c1	763482593	HMKNOTQJRMVXDQ-UHFFFAOYSA-N	449.305	1.789	50	20	IDGD	
CC(=O)N1CCc2cc(NC(=O)C(=O)NNC(=O)c3cc(-c4ccccc4)[nH]n3)ccc21	763604834	NCHTVQFCXBKDMN-UHFFFAOYSA-N	432.440	1.385	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)N1C[C@H]2CCCN2c2ccccc21	763682251	PUBJQMMPBZQVSE-MRXNPFEDSA-N	438.484	1.627	50	20	IDGD	
CNC(=O)c1ccc(C)c(NC(=O)C(=O)NNC(=O)CSc2ccc(Cl)cc2)c1	763734002	KDIOWSSWGALTDQ-UHFFFAOYSA-N	434.905	1.886	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cnn(-c3ccccc3Cl)c2)cc1	763821687	WHPBFIFWUPXZCA-UHFFFAOYSA-N	427.848	1.999	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cccc(F)c2C(=O)OC)cc1	763860499	HWNAYWXYSXUJFA-GFCCVEGCSA-N	447.419	1.564	50	20	IDGD	
Cc1ccc(N2CCOC2=O)cc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccc(F)cc1	763871677	HBNZVLBOVGKMCA-CYBMUJFWSA-N	444.419	1.644	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1cccc(N2CCCNC2=O)c1	763872883	PSJGJORYTBITSJ-CYBMUJFWSA-N	443.435	1.299	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNC(=O)c2cc(Br)cn2C)cc1OC	764004844	OWTVVFAJRKOJJW-UHFFFAOYSA-N	439.266	1.595	50	20	IDGD	
O=C1Cc2cc(NC(=O)C(=O)NNC(=O)c3ccc(F)cc3Br)ccc2N1	764086931	XIIRAPDFBVTNCC-UHFFFAOYSA-N	435.209	1.483	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccccc2OC)cc1Br	764133799	ZKORZYYEHUAKAH-UHFFFAOYSA-N	436.262	1.795	50	20	IDGD	
C[C@@H]1COCCN1c1ccc(NC(=O)C(=O)NNC(=O)CCc2ccccc2O)cc1	764277413	DIAPBGRRAXSBLJ-OAHLLOKOSA-N	426.473	1.336	50	20	IDGD	
CCCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)CCc2ccccc2O)cc1	764281368	UYYOLOVHIUGSIF-UHFFFAOYSA-N	448.501	1.263	50	20	IDGD	
CCOCC(=O)NNC(=O)C(=O)Nc1ccc(OCC(F)(F)F)c(C(F)(F)F)c1	764325827	TVEVMVHUAYYOAK-UHFFFAOYSA-N	431.289	1.769	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(Cl)s1)NNC(=O)CSc1ccccc1O	765249158	KKBMMZJEBUNKHR-UHFFFAOYSA-N	435.936	1.325	50	20	IDGD	
O=C(CCC(=O)N1CCN(c2ccccc2)CC1)NNC(=O)Cn1ccc2ccccc21	765427975	OGWADCKOXCOFKF-UHFFFAOYSA-N	433.512	1.918	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)c2cc(C)[nH]n2)ccc1OCC(=O)N1CCCCC1	765583649	QCEWMJHWDQMCSI-UHFFFAOYSA-N	429.477	1.583	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3cn(Cc4ccccn4)nn3)n[nH]2)cc1OC	765602161	WJUCDYFUKDFVET-UHFFFAOYSA-N	448.443	1.204	50	20	IDGD	
O=C(COC(=O)c1ccn(-c2ccc(F)cc2F)n1)NNC(=O)c1ccc([N+](=O)[O-])cc1	766824042	RPBQQACWQMUFFW-UHFFFAOYSA-N	445.338	1.677	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)nc1Cl	766967147	OGFICGKZBSJMDB-UHFFFAOYSA-N	438.893	1.603	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)N[C@H]1CC(=O)N(Cc2ccccc2C(F)(F)F)C1	768519494	VADMYALOXBCGAK-JSGCOSHPSA-N	446.426	1.188	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)[C@@H](C)NC(=O)c1n[nH]c2ccccc12	768609876	BLFKXQQTXZDASS-LLVKDONJSA-N	431.474	1.237	50	20	IDGD	
CCOC(=O)c1nn(C)cc1C=NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	769762178	GANCMBNGLCMOBG-UHFFFAOYSA-N	433.490	1.145	50	20	IDGD	
CCC(CC)n1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)n1	770447110	XBVJPOIABBIORI-UHFFFAOYSA-N	449.533	1.340	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)C(=O)Nc2cccc(C)n2)c2ccccc2c1=O	773525891	VEMUXKPPTZLKNU-UHFFFAOYSA-N	436.472	1.690	50	20	IDGD	
COC(=O)c1cc(OC)c(OC)c(OC)c1NC(=O)C(=O)NNc1ccc([N+](=O)[O-])cc1	773637832	AVJGLVKPJFCQKU-UHFFFAOYSA-N	448.388	1.489	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)ccc1C	774010256	XCGWRRLBLZHWTH-GFCCVEGCSA-N	433.848	1.988	50	20	IDGD	
O=C(NNc1cnccn1)[C@@H]1Cc2ccccc2CN1S(=O)(=O)c1ccc(F)cc1	775279063	RUXBOHZDANVAEC-SFHVURJKSA-N	427.461	1.875	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCCC(=O)NNc2cccc(S(C)(=O)=O)c2)cc1	776533968	UOMYMQNLTHRNDH-UHFFFAOYSA-N	441.531	1.301	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)[C@@H]2CS[C@@H](Cc3ccccc3F)C(=O)N2)nc1C	778423063	ZPSWNUQULUUFCV-HOTGVXAUSA-N	447.492	1.387	50	20	IDGD	
COCCN1C(=O)CCc2cc(NC(=O)C(=O)NNC(=O)CCc3ccccc3)ccc21	778710008	LNVLELBEWOHDHR-UHFFFAOYSA-N	438.484	1.331	50	20	IDGD	
CCOC(=O)c1cc(C)sc1NC(=O)C(=O)NNC(=O)Cc1nc2ccccc2n1C	782893611	JYSHAYZEPJAOKW-UHFFFAOYSA-N	443.485	1.449	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2ccc(C(=O)N(C)[C@H]3CCCN(C)C3)cc2)cc1	783036074	MEXZSYQZTHXJNG-IBGZPJMESA-N	439.516	1.943	50	20	IDGD	
O=C(NNc1ccc(Cl)cc1)C(=O)N1C[C@@H](C(=O)N2CCOCC2)Oc2ccccc21	783339826	ORCNVSVUMFRTSA-SFHVURJKSA-N	444.875	1.436	50	20	IDGD	
Cc1ccc(NNC(=O)C(=O)Nc2ccc(F)c(S(=O)(=O)N3CCOCC3)c2)cc1	783346541	QTVAFOAPGWQCHF-UHFFFAOYSA-N	436.465	1.237	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1cccc(-c2cccs2)c1	784005148	QXRJFSVTFBSBRD-UHFFFAOYSA-N	428.495	1.993	50	20	IDGD	
Cn1cc(Br)cc(NC(=O)C(=O)NNc2ccc(OC(F)F)cc2)c1=O	784306636	AMQOQJOPWGUYOT-UHFFFAOYSA-N	431.193	1.831	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2cccc(S(C)(=O)=O)c2)cnc1Br	784841381	GZZDRRRKZQDQHW-UHFFFAOYSA-N	427.280	1.638	50	20	IDGD	
COC[C@H](C)n1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3cc(C)ccc3C)[nH]n2)n1	785131390	YWPDOVQGUMVGMJ-AWEZNQCLSA-N	439.476	1.497	50	20	IDGD	
CCCNC(=O)c1ccc(NC(=O)C(=O)NNc2c(OC)cccc2S(C)(=O)=O)cc1	785338353	LAHLAHMAFGSTCW-UHFFFAOYSA-N	448.501	1.320	50	20	IDGD	
N#C/C(=C/c1ccccc1)C(=O)OCC(=O)N(C[C@@H]1CCCO1)[C@H]1CCS(=O)(=O)C1	785378830	SXQWSQVSKZSJTB-XLTVWXTISA-N	432.498	1.331	50	20	IDGD	
CCn1c(COC(=O)/C(C#N)=C\C2CC2)nc2cc(S(=O)(=O)N3CCOCC3)ccc21	786678540	DVICZSWEXBBDOH-WJDWOHSUSA-N	444.513	1.980	50	20	IDGD	
CCNC(=O)Nc1ccc(C)c(NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)c1	787542533	MOFMQXGVLUXXJK-QGZVFWFLSA-N	425.445	1.226	50	20	IDGD	
O=C(NNC(=O)c1cncc(Cl)n1)c1cccc(S(=O)(=O)NCc2ccccc2)c1	788625008	ORBPKZXOGSUZEH-UHFFFAOYSA-N	445.888	1.683	50	20	IDGD	
COc1nc(Br)ccc1NC(=O)NNC(=O)c1nnc(O)c2ccccc12	789385281	YZPRNFXPUPRLQW-UHFFFAOYSA-N	433.222	1.968	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)Nc1nc(C(C)(C)C)cs1	789731423	HHVIHFKUYKWXES-UHFFFAOYSA-N	428.312	1.941	50	20	IDGD	
CC(C)(C)c1cnc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)s1	789756243	DJKJPMJPKPOQSH-UHFFFAOYSA-N	437.547	1.963	50	20	IDGD	
COc1cc2ncn(CCCC(=O)NNC(=O)Cc3ccc(F)cc3)c(=O)c2cc1OC	789884511	XVLUJSGEYNZPJX-UHFFFAOYSA-N	442.447	1.723	50	20	IDGD	
Cc1onc(-c2ccc(C(F)(F)F)cc2)c1C(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1	790492459	UZEVWHGPVHGZJE-GFCCVEGCSA-N	446.407	1.800	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)c3ccccc32)c2ccccc2c1=O	791002772	JJLILXPOYYYQNC-OAHLLOKOSA-N	440.481	1.139	50	20	IDGD	
CC(C)Oc1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)nn1	793017458	FOYHZMVZHBXDPG-UHFFFAOYSA-N	429.405	1.342	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cccc(Br)n3)n[nH]2)cc1	793026252	PFPJYWBFSQOGEZ-UHFFFAOYSA-N	443.261	1.942	50	20	IDGD	
N#CCC1(O)CN(C(=O)/C(C#N)=C/c2cn(CCC(N)=O)nc2-c2ccc(Cl)cc2)C1	793867222	AAEBASOWVBJLAC-OQLLNIDSSA-N	438.875	1.473	50	20	IDGD	
COC(=O)c1cc(F)c(Br)cc1NC(=O)C(=O)NNc1cc(C)ncn1	797060104	HGRILTSVNGXCHO-UHFFFAOYSA-N	426.202	1.555	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)c1ccccc1Sc1ccccc1[N+](=O)[O-]	799299713	BRTFUYOWBYWSCR-LBPRGKRZSA-N	435.483	1.942	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(OC(F)F)nc2)cc1OC	802566127	AMPHHSQIMUEXDV-UHFFFAOYSA-N	438.387	1.880	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)C(=O)N2CCc3cc(F)ccc32)c1	802567586	ZTPOVKWJMAUPRA-UHFFFAOYSA-N	436.237	1.947	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)ccn1	806666332	VLBZUPYMGSQSMU-UHFFFAOYSA-N	433.490	1.731	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(NC(=O)C(=O)NNc2cnc3ccccc3n2)ccc1F	806983872	IQHKIDXJDSJTNO-UHFFFAOYSA-N	432.437	1.101	50	20	IDGD	
O=C(NC[C@H]1CCCSC1)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	807595032	LXMMRWZDBYHPLB-CQSZACIVSA-N	426.564	1.558	50	20	IDGD	
CCn1cc(-c2noc(CCC(=O)C(C#N)=C3N(C)c4ccccc4N3C)n2)c(O)nc1=O	809504688	QMGLSNLPGFBKPF-UHFFFAOYSA-N	447.455	1.842	50	20	IDGD	
O=C(Cn1nnc(-c2ccccc2)n1)NN=C1C(=O)Nc2cc(Br)ccc21	812383322	LIFSLOVIACCQDZ-UHFFFAOYSA-N	426.234	1.575	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C(=O)N3CCN(c4ccccc4)CC3)n[nH]2)cc1	812534210	KNFOVCYYUUSKEF-UHFFFAOYSA-N	446.511	1.749	50	20	IDGD	
CCNS(=O)(=O)c1ccc(C)c(C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)c1	812727347	PUFGWGZNGQFEJX-UHFFFAOYSA-N	440.547	1.300	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2cccc(Br)n2)cc1	813033066	CTAOKQIZYIXECR-UHFFFAOYSA-N	442.295	1.176	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)NS(=O)(=O)c2cncc(C#N)c2)c(C)n1C[C@H]1CCCO1	813984905	GEFAXHTTXFNWDO-JSAJWXMXSA-N	439.497	1.963	50	20	IDGD	
Cc1cc(C)c(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)s1	814210563	QZQJMFUDXYSVPB-UHFFFAOYSA-N	443.572	1.773	50	20	IDGD	
N#Cc1cc(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cnc1C(F)(F)F	814735643	COZNFFRKZNLADO-UHFFFAOYSA-N	447.782	1.348	50	20	IDGD	
CC(=NNC(=O)c1cccc(Br)c1)c1ccc(S(=O)(=O)CC(N)=O)cc1	814857496	MHPCVMYGWPTCHZ-UHFFFAOYSA-N	438.303	1.862	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1cccc(Br)n1	815752297	MOCLMWWLWPLEQL-UHFFFAOYSA-N	442.295	1.176	50	20	IDGD	
O=C(NNC(=O)c1ccccc1NS(=O)(=O)c1ccc(Cl)cc1)C(=O)NC1CC1	843405180	UEJGVNPLGHJRGW-UHFFFAOYSA-N	436.877	1.180	50	20	IDGD	
Cc1c(C(=O)NNC(=O)COc2ccc(Br)cc2)cnn1-c1ccc(O)nn1	888914214	VKVFUETVLJHKEF-UHFFFAOYSA-N	447.249	1.279	50	20	IDGD	
CCc1ccccc1-n1cnnc1SCC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	894391237	ODQJVPZKHCAYSS-UHFFFAOYSA-N	449.500	1.359	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)[C@H]2CC(=O)N(c3ccc(F)c([N+](=O)[O-])c3)C2)c1	913123490	OCUYLNAZQALQPS-LBPRGKRZSA-N	446.391	1.565	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)NCC(=O)NNC(=S)Nc2cccc(C)c2C)cc1	913425010	STMSUWYNFLWRAJ-UHFFFAOYSA-N	434.543	1.802	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=S)Nc1cccc(S(=O)(=O)N(C)C)c1	913445716	BKTCQSHDZWSDRB-UHFFFAOYSA-N	438.531	1.342	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)cc1S(C)(=O)=O	916092747	DMJZLVZNRZXVTR-UHFFFAOYSA-N	442.497	1.764	50	20	IDGD	
CCN(CC)c1ccc(CNC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)cn1	916390471	SDJDUPRCKMOQHO-UHFFFAOYSA-N	447.565	1.674	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCCCN1C[C@@H](C)C[C@@H](C)C1	916460402	KEELNCWNLCFLLF-GASCZTMLSA-N	438.598	1.600	50	20	IDGD	
CNS(=O)(=O)c1cccc(CNC(=O)NNC(=O)Cc2ccc3ccccc3c2)c1	916486028	UAWSOHISNREMAO-UHFFFAOYSA-N	426.498	1.821	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)nc1)c1ccc(S(=O)(=O)NCc2ccco2)cc1	917253378	HKANINBFDQYGBK-UHFFFAOYSA-N	434.861	1.881	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2cccc(C(=O)NC3CC3)c2)cc(OC)c1OC	917718150	XJDZXSKTVOGYJX-UHFFFAOYSA-N	449.485	1.228	50	20	IDGD	
COc1ccc(CNC(C)=O)cc1S(=O)(=O)NNC(=O)c1cn(C)c2ccccc12	917730672	NEHGDUDXAFHXLN-UHFFFAOYSA-N	430.486	1.446	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNS(=O)(=O)c2cc(C(=O)O)ccc2F)cc1	918063221	JHNINTDVAHITRE-LLVKDONJSA-N	426.422	1.700	50	20	IDGD	
O=C(NCCSC(F)(F)F)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	918219260	ILHACJDATNHARK-UHFFFAOYSA-N	440.469	1.668	50	20	IDGD	
O=C(CC(F)(F)F)NNC(=O)c1ccc(Cl)c(S(=O)(=O)NC[C@@H]2CCCO2)c1	918363852	DPKMTCLPEXSIOT-JTQLQIEISA-N	443.831	1.511	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ccc3nncn3n2)CC1)c1cc2ccccc2cc1O	918781190	LRCXPZIJBZBRMK-UHFFFAOYSA-N	431.456	1.661	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)NCCS(=O)(=O)c1ccc(Cl)cc1	919785626	FOZFJHWWCBVABQ-UHFFFAOYSA-N	429.857	1.662	50	20	IDGD	
O=C(NNC(=O)c1sccc1NC(=O)c1ccncc1)c1ccc(-n2cnnn2)cc1	920427791	MMJAEEUQUSFLGC-UHFFFAOYSA-N	434.441	1.446	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)C(O)(c2ccccc2)c2ccccc2)c2ccccc2c1=O	920460735	PAQHDRFGOZUYMP-UHFFFAOYSA-N	428.448	1.631	50	20	IDGD	
COc1cc(C(=O)NCC(=O)NNC(=O)NCCc2cccs2)ccc1OC(F)F	920889457	ZDEZZAUTBFQNDZ-UHFFFAOYSA-N	442.444	1.661	50	20	IDGD	
C[C@@H](NC(=O)c1ccc(Cl)cc1)C(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	933650375	PLNSWLOATLOMJO-LLVKDONJSA-N	427.848	1.166	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)NCCCOC[C@@H]2CCCO2)CC1	1318625613	FFRPXLPWYNWWPC-INIZCTEOSA-N	428.530	1.550	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NCc1ccc(-n2cnc3ccccc32)nc1	1338272301	WDOAKRBYJDPAED-UHFFFAOYSA-N	449.496	1.742	50	20	IDGD	
COc1ccc(C=NNC(=O)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1OCC(N)=O	1347634760	VYALTWLTDOCLSI-OAHLLOKOSA-N	434.493	1.657	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccc3c(c1)CC(=O)N3)CCO2	1779297177	UKPNUKGEKFBCBZ-OAQYLSRUSA-N	431.565	1.476	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CO[Si](C)(C)C)C2	1779322247	CSQKEMDVXFTLPJ-JXXFODFXSA-N	442.633	1.059	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C[C@@H](N)c1cccnc1)C2	1779543548	GJRCDVVPGYKHDB-WOIUINJBSA-N	448.640	1.837	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(C(F)(F)F)ccn3)C2)C1	1779663611	CYDJNGJQFGUZIL-SUMWQHHRSA-N	435.830	1.798	50	20	IDGD	
CCOc1ccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](Br)CC)CCO3)nn1	1780429097	BLAOIGRGRLXJMO-FZKQIMNGSA-N	441.326	1.492	50	20	IDGD	
COc1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](O)CCl)C3)ccc1O	1780442347	QSWJAUJTZJOGCA-XAUMDUMWSA-N	426.897	1.128	50	20	IDGD	
O=C(CCc1ccc(F)nc1)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781325571	FODQDLSJPFHBBL-RDJZCZTQSA-N	432.265	1.674	50	20	IDGD	
COc1ccc([C@H](O)C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)cc1	1781325824	RSJWMKUAWWHTIT-HDMKZQKVSA-N	445.285	1.249	50	20	IDGD	
CCOc1ncccc1C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781327259	XSZBNKBWPCRNLT-SUMWQHHRSA-N	430.274	1.614	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)Nc1cnccn1)C2	1782176025	URUPTVSLWHMHGO-UIVXKWKOSA-N	439.944	1.045	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Br)C2	1782177949	BLKYUMIHCZSFFQ-MCYUEQNJSA-N	429.714	1.445	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)Cc3noc(C(C)C)n3)CCO2)C1	1783345058	YNGAAPDRLKUWKI-ACJLOTCBSA-N	443.342	1.739	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)Cn3nnc4ccccc43)CCO2)C1	1783529747	MHPIKERXRAUKTF-FZKQIMNGSA-N	436.310	1.045	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cnc4snnc4c3)CCO2)C1	1783537284	NIDGXLFLTZRYAJ-MGPLVRAMSA-N	440.323	1.313	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)Cc3cccc4ncccc34)CCO2)C1	1783871805	VWFDQRQRNPNAMN-XMSQKQJNSA-N	431.920	1.861	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cnn4c(C)cc(C)nc34)CCO2)C1	1783874305	GNQFYJVFXRVSBR-UZLBHIALSA-N	435.912	1.043	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3scnc3C(F)(F)F)CCO2)C1	1783875087	CSSUTZAHJIRBMV-BMIGLBTASA-N	441.859	1.859	50	20	IDGD	
O=C(CCc1ccc2c(c1)OCO2)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Cl)C[C@@H]21	1786604374	OCRCNZRRDLBCLE-AGGDQXJMSA-N	426.872	1.862	50	20	IDGD	
CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]2C1	1787451577	WWSRYJQKBJVOLO-SBJFKYEJSA-N	435.924	1.804	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(F)cn3C)[C@H]2C1	1787744429	VCJBMIRRHFCOIH-DUPGQFARSA-N	430.318	1.789	50	20	IDGD	
Cc1cc(C)n(CC(=O)NC2(c3ccc(NC(=O)c4ccc(B(O)O)cc4)cc3)CCC2)n1	1788140160	LIWOEYKPFNBRBW-UHFFFAOYSA-N	446.316	1.628	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(-c4ccccc4)[nH]n3)[C@H]2C1	1789320478	WSEDGTLJLAJLOM-BOSXTWCSSA-N	446.935	1.924	50	20	IDGD	
Cc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)Br)C[C@@H]32)nn1C(F)F	1789330018	HQDXBCAEARNFMR-MNXVOIDGSA-N	449.296	1.963	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3ccccn3)C[C@@H]21)[C@H](F)Br	1789922815	VARLZVKCUZDJDU-QEWYBTABSA-N	428.302	1.684	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C/N=C/c3ccco3)C[C@@H]21	1791056418	XSSFKPLOEQTHBJ-GGEPFGHSSA-N	426.311	1.462	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nnc(-c4ccccc4)o3)C[C@@H]21	1791255397	QNCXIRLBHKOJTR-NXOAAHMSSA-N	448.907	1.584	50	20	IDGD	
Cc1nccn1CCCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21	1791572995	FTDFHLLLCMQBFH-JKQORVJESA-N	445.333	1.642	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)Oc3cccnc3)[C@H]2C1	1791654367	PYUQSOUEIKOTPD-JBJRXJHCSA-N	440.338	1.612	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc(C(F)(F)F)cc1)C2)[C@@H](O)CCl	1792976035	KAPQFIFDJVUUKJ-YXPYIKCWSA-N	434.842	1.437	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1csc(-c3ccccc3)n1)C2)[C@@H](O)CCl	1792978396	SYZGHLVFOFIHOH-FSDCSDTHSA-N	435.933	1.613	50	20	IDGD	
Cn1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCBr)c2cccnc21	1795115861	ORGOPQCJCFKYRW-FVCICTRLSA-N	435.322	1.562	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cc(Br)ccc1O)C2)[C@H](F)Cl	1796367629	KSOWEVADPCEJQE-OJXGSEEGSA-N	449.704	1.821	50	20	IDGD	
C#CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Cl	1796369780	DLOKNDPMNVTGQH-KHMAMNHCSA-N	431.892	1.027	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccccc1F)C2	1796441697	RYXACECASZLHGI-DHMDNZFNSA-N	441.463	1.163	50	20	IDGD	
CC(C)N1CCC(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Br)CC1	1799344926	XZFAISIMUAAQQK-FZKCQIBNSA-N	434.350	1.387	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1scnc1C1CC1)C2)[C@@H](F)Br	1799347408	JYHKIYZHMDDWKD-FBKDDSFISA-N	432.315	1.914	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(F)cc(F)c1	1799745755	FNTHEFQXMYVITG-MUJYYYPQSA-N	429.427	1.529	50	20	IDGD	
CN(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C13CC(C1)C3)C2)NC(=O)NCc1ccccc1	1799869376	NSXBSGBRGZBMSA-SWCZIZIJSA-N	439.560	1.771	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1cccn2nccc12	1799973707	FDARYIUQCOEDKT-JLUCKKNBSA-N	425.258	1.228	50	20	IDGD	
COC(=O)[C@H]1CC=CC[C@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2	1800950293	HSJHKMAMMSXTHY-LBKYZSNHSA-N	443.338	1.116	50	20	IDGD	
COc1cc(F)ccc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnccc1C(=O)NN)C2	1803472693	OKKSPYZEGHIPLO-QDMKHBRRSA-N	441.463	1.398	50	20	IDGD	
O=C(c1cccc(N2CCOCC2)c1)N1CCC2(CCCN(C(=O)[C@@H](O)CCl)C2)CC1	1805527229	WIICYGKMRRSYAQ-FQEVSTJZSA-N	449.979	1.968	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC2(CCCN(C(=O)C3=CCCS3)C2)CC1	1806101580	XJKFZZPBHKBOQR-UHFFFAOYSA-N	429.546	1.551	50	20	IDGD	
O=C(CCBr)NC[C@@H]1CCN(C(=O)CC(F)(F)C(=O)O)[C@H]1c1cccnc1	1806340811	NTZVVPHDAAYZJZ-WFASDCNBSA-N	448.264	1.982	50	20	IDGD	
N=C(N)SCCC(=O)N1CC[C@@H](CNC(=O)CCBr)[C@H]1c1cccnc1	1806340867	PASPNQFYUXXSIY-XJKSGUPXSA-N	442.383	1.889	50	20	IDGD	
Cc1nn2cc(CC(=O)N3CCCC4(CCN(C(=O)[C@@H](O)CCl)CC4)C3)nc2s1	1806445811	XEJOQCIJSVMUFS-HNNXBMFYSA-N	439.969	1.473	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H](CNC(=O)c2cnc(O)nc2O)[C@@H]1c1cccnc1	1808280221	JULOTVLCUXLZNW-PBHICJAKSA-N	445.552	1.454	50	20	IDGD	
CC[S@](=O)CCC(=O)N1CC[C@H](CNC(=O)[C@@H](F)Br)[C@@H]1c1cccnc1	1808668145	JEENIZKEFXRTEG-AMAKMLAGSA-N	448.358	1.937	50	20	IDGD	
Cc1cc(C(=O)N2CCC3(CCCN(C(=O)c4cccc(B(O)O)c4)C3)CC2)cnc1C	1809975004	MTRJPAILPCXSCO-UHFFFAOYSA-N	435.333	1.537	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@H]1CCc2nc(NC(=O)CN3CCOCC3)sc2C1	1814568715	DZAQACIBQLUHRL-APPDUMDISA-N	435.377	1.624	50	20	IDGD	
O=C1NCc2cc(C(=O)N3CCCC[C@H]3c3cc(NC(=O)[C@H](O)CCl)n[nH]3)ccc21	1814872380	HINBJRRQMHFOMC-JKSUJKDBSA-N	431.880	1.559	50	20	IDGD	
Cn1cc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)[C@@H](O)CCl)[nH]n2)c(C(F)F)n1	1818368383	KLEGCROTTKVZJQ-NEPJUHHUSA-N	430.843	1.986	50	20	IDGD	
CN1CCN(CC(=O)Nc2cc([C@@H]3CCCCN3C(=O)CO[Si](C)(C)C)[nH]n2)CC1	1818912878	LDQUKFWZYYICEI-KRWDZBQOSA-N	436.633	1.501	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](C)Nc2cnccn2)n[nH]1	1819422775	BWURLINAIDDGBE-VNHYZAJKSA-N	435.916	1.946	50	20	IDGD	
CC1=C(C(=O)N[C@H]2CCc3nc(NC(=O)c4cnccc4C(=O)NN)sc3C2)CCO1	1819797665	WQKGTJSBFPXIAE-NSHDSACASA-N	442.501	1.062	50	20	IDGD	
COc1ccnc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)CCC(=O)NN(C)C)CC3)c1	1820515737	AHIGGMZADAVJRP-GFCCVEGCSA-N	446.533	1.146	50	20	IDGD	
O=C(Cc1ccccc1O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1822011415	KWWXWEBPMRFPNJ-IBGZPJMESA-N	448.288	1.344	50	20	IDGD	
Cc1ccn(CC(=O)N[C@H]2CCc3nc(NC(=O)[C@H](F)Br)sc3C2)n1	1823002969	VTYSALPUTREHBE-ZANVPECISA-N	430.303	1.951	50	20	IDGD	
O=C(CCNC(=O)c1ccccc1)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1	1823352838	MSPPZRVVCMNGHG-SJORKVTESA-N	447.923	1.822	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)C(F)(F)C(F)F)CC1	1824848230	ZAHZWEMCAIYWFM-CQSZACIVSA-N	438.466	1.880	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CN1CCOC1=O)CC2	1825441019	ISKNUJLFZQGCRO-ZJUUUORDSA-N	445.339	1.681	50	20	IDGD	
CC[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ncn(C)n1)CC2	1825445263	QUBICBANUOFYQS-RKDXNWHRSA-N	427.328	1.671	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](C)Cn1cncn1)CC2	1825640581	CYMNJGVFXBVNEG-OUAUKWLOSA-N	441.355	1.766	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cncc(F)c1)CC2	1826080551	QGHPSDUJEGIIJA-ZDUSSCGKSA-N	434.497	1.276	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1	1826083632	PGSJCGSRTVFFBJ-VXGBXAGGSA-N	429.974	1.836	50	20	IDGD	
CC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1	1826386893	BVQRCKLYJGNJHG-LJQANCHMSA-N	429.521	1.288	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@H]2CCC(=O)N2)CC1	1826664166	JVHWTKPPYGRNNX-NUEKZKHPSA-N	428.371	1.916	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)CCn3ccnn3)sc2C1	1826879860	VZNUEGMSJXFENM-MNOVXSKESA-N	441.355	1.910	50	20	IDGD	
Cc1[nH]nc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)c1F	1827050731	WBVSVGFGCURJRT-GOSISDBHSA-N	442.300	1.084	50	20	IDGD	
O=C(CC[C@@H]1CCOC1)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827054409	DKUWGIKIHZCGLB-XMSQKQJNSA-N	442.365	1.416	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)cn1C	1827865818	VQYRZAXLRHYVNN-QFIPXVFZSA-N	437.349	1.560	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC([C@H]2CCCCN2C(=O)C2=NNC(=O)C2)CC1	1828858430	GLESMMOXQBWFTR-SWLSCSKDSA-N	427.343	1.513	50	20	IDGD	
CCc1cc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)nn1C	1829478653	FAEPAWHWFRCLJC-FQEVSTJZSA-N	446.596	1.589	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CCC(F)(F)C1)CCO2	1829653685	DWXVALHROPVXBB-MAUKXSAKSA-N	434.556	1.730	50	20	IDGD	
C[C@@H](NNc1ccccc1)C(=O)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1829814900	URVVZLZLVGXBRZ-AUUYWEPGSA-N	445.347	1.252	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)Cc2ccncc2)CC1	1830172936	FAIGQIUMQVRFBF-JOCHJYFZSA-N	435.333	1.237	50	20	IDGD	
CC(C)[C@H](S)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](C)CBr)CCO2)C1	1830535691	SBCLPKCALXVJLW-JKIFEVAISA-N	437.400	1.428	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3c(C)nn(C)c3C)CCO2)C1	1831803290	BAWISBWLCCSMHQ-OXQOHEQNSA-N	426.945	1.514	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC([C@@H]2CCCCN2C(=O)C2CC(=O)C2)CC1	1832810548	XXFLFAVVIVAPER-RASHHNMQSA-N	441.532	1.719	50	20	IDGD	
C[C@@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)CNC(C)(C)C)CC2)CC1	1833262190	IWTUGAOLIQQRQI-HNNXBMFYSA-N	445.446	1.977	50	20	IDGD	
Cn1cc2cc(C(=O)N3CCC(N4CCC(NC(=O)[C@@H](O)CCl)CC4)CC3)ccc2n1	1833311659	BSNGIFQCFUNION-FQEVSTJZSA-N	447.967	1.358	50	20	IDGD	
CCc1ncccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1	1833516239	LHXCSXLMHVHJKN-OAQYLSRUSA-N	435.597	1.566	50	20	IDGD	
CCc1ncccc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1	1833518993	IQIZMVVKFVQSBI-WOJBJXKFSA-N	444.359	1.950	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)Cn3ccccc3=O)CC2)CC1	1833532456	PRTMMTRWWNMPQB-LJQANCHMSA-N	436.984	1.827	50	20	IDGD	
O=C(COC(=O)C(F)(F)F)NC1CCN(C2CCN(C(=O)[C@H](F)Cl)CC2)CC1	1835687296	MFNHHJGKALKJMC-ZDUSSCGKSA-N	431.814	1.198	50	20	IDGD	
Cc1cc(CC(=O)NC2CCN(C3CCN(C(=O)CCBr)CC3)CC2)n[nH]1	1835787411	MNTFTUPEIGRKRO-UHFFFAOYSA-N	440.386	1.617	50	20	IDGD	
C[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1)n1cccc1C=O	1835957655	CSRCRLNBWOHPAG-ACJLOTCBSA-N	432.304	1.122	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(N2CCC(NC(=O)[C@H]3C[C@H]3F)CC2)CC1	1836369183	QUEKKIVALUJTGR-CYNFWEFXSA-N	446.527	1.050	50	20	IDGD	
Cc1cc(C(N)=O)cc(C)c1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1837435834	DTKXXADZCXQGDV-UZLBHIALSA-N	441.887	1.007	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cccn4cncc34)C2)C1	1837713133	JFXCKRDVTMAWFG-OAQYLSRUSA-N	446.580	1.256	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)COc3ccc(O)nn3)CC2)CC1	1838636856	AZLOGJGNCVMOAS-MRXNPFEDSA-N	440.928	1.577	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CC=CCC1)CCO2	1839126531	IUILNONXIJMKET-GJYPPUQNSA-N	429.355	1.830	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3cn[nH]c3)C2)C1	1839150486	NUKXSTXUNAGSRP-ROUUACIJSA-N	433.336	1.035	50	20	IDGD	
Cn1cc(F)cc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2	1839153055	UASJGKYJIQCONZ-QZTJIDSGSA-N	436.311	1.471	50	20	IDGD	
Cc1ccc(F)c(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)c1	1839312928	AGKJENNWKDGSTR-MAUKXSAKSA-N	447.276	1.895	50	20	IDGD	
CCc1oncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2	1840032159	PBIGTHRBCAPZPK-SJKOYZFVSA-N	430.299	1.090	50	20	IDGD	
Cc1ccc(/C=C/C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)s1	1840394583	UEPOBAAQYJAYEP-BSCWQEJHSA-N	428.938	1.126	50	20	IDGD	
CCc1nn(C)c(C(=O)N2CC3(CCCN3C(=O)[C@@H](O)CCl)C2)c1Br	1841350488	GANDTJYDOKYUDC-NSHDSACASA-N	433.734	1.162	50	20	IDGD	
CS(=O)(=O)c1cncc(C(=O)N2CC3(CCCN3C(=O)CCBr)C2)c1	1842637336	CAGLLYUBSRINSZ-UHFFFAOYSA-N	430.324	1.087	50	20	IDGD	
CN(CC(=O)N1CCCC12CN(C(=O)[C@H]1C[C@@H]1C1CC1)C2)NC(=O)NCc1ccccc1	1845038211	FFWYCIROJRBULO-UXHICEINSA-N	439.560	1.582	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@H](O)c2cccc(Br)c2)C1	1845042161	BEGBTPWBUVCSHN-HUUCEWRRSA-N	445.741	1.940	50	20	IDGD	
COc1ccc([C@@H]2C[C@@H]2C(=O)N2CC3(CCCN3C(=O)CCC(=O)NN(C)C)C2)cc1	1846383870	DDHWCVNZWMXJAJ-OALUTQOASA-N	428.533	1.375	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H]1CCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl	1847559041	IYNUBWZMRQICKF-LUKYLMHMSA-N	443.972	1.968	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)[C@@H]1CC(=O)N(Cc2ccco2)C1	13629353	UJDDMRVOGPDUFV-GFCCVEGCSA-N	436.262	1.617	50	20	IDGD	
CC(C)CC(=O)NNC(=O)c1ccc(Cl)c(S(=O)(=O)N2C[C@@H](C)O[C@H](C)C2)c1	22699054	QTQKMJNONYVHJJ-CHWSQXEVSA-N	431.942	1.945	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCCCn2nc3n(c2=O)CCCC3)ccc1OC(C)C	117325396	QEVMMPOOPZVWDM-UHFFFAOYSA-N	446.508	1.211	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)N(C)CC(=O)NN=c2sc3ccccc3n2C)cc1	254398728	QFTOZGJPXIQASH-UHFFFAOYSA-N	447.542	1.451	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)CCCc2ccccc2)c(C(=O)OC)s1	727720054	QOZXLFPKVRLDPR-UHFFFAOYSA-N	440.499	1.654	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2CCCN2c2ccc(C#N)cc2)c1	728171147	YLVGYDCOWSLHOM-IBGZPJMESA-N	441.513	1.239	50	20	IDGD	
Cn1c(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c(Cl)c2ccccc21	728328493	VKQRGUCGRRTPQP-INIZCTEOSA-N	443.843	1.976	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2ccccc2S(=O)(=O)C(C)C)n1	728721610	CWSJEOFBQAYFOL-UHFFFAOYSA-N	439.515	1.181	50	20	IDGD	
O=C(Cn1cc(Br)ccc1=O)NNc1ccc(S(=O)(=O)C(F)F)cc1	728976068	YEIGUESPFYAMGK-UHFFFAOYSA-N	436.234	1.750	50	20	IDGD	
COc1ccc(NNC(=O)CCc2nc3cc(S(=O)(=O)N(C)C)ccc3n2C)cc1	729271858	HCEPWSHNZVEGBJ-UHFFFAOYSA-N	431.518	1.908	50	20	IDGD	
Cc1cc(=O)c(C(=O)NNC(=O)Cn2ccc3ccccc32)nn1-c1ccccc1[N+](=O)[O-]	729449810	GECQSMOJHNTGIQ-UHFFFAOYSA-N	446.423	1.865	50	20	IDGD	
O=C(Cc1csc(-c2nc[nH]n2)n1)NNC(=O)c1cc(F)ccc1Br	729863190	OTMBCVDDWIIAJA-UHFFFAOYSA-N	425.243	1.834	50	20	IDGD	
O=C(O)CCCOc1ccc(S(=O)(=O)NNC(=O)CCc2ccccc2O)cc1F	729962566	AOKMCTLYDRSBBE-UHFFFAOYSA-N	440.449	1.717	50	20	IDGD	
C[C@@H]1CC(C)(C)C[C@@]2(C1)NC(=O)N(CC(=O)NNC(=O)COc1ccccc1O)C2=O	730782174	JDHVHCSOECSFMG-LRTDBIEQSA-N	432.477	1.055	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)NCc1cccc(C(=O)NC[C@H]2CCCO2)c1	730902460	GJEQEXXUEIVGPB-QGZVFWFLSA-N	442.472	1.210	50	20	IDGD	
CCOC(=O)/C(C#N)=C\NNC(=O)c1cccc(S(=O)(=O)Nc2ccc(OC)cc2)c1	730940690	HHDSSHSHMQKYBN-SQFISAMPSA-N	444.469	1.701	50	20	IDGD	
CCNC(=O)CCC(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccc(C)cc2C)c1	732049544	RVGMSDIRDXKFSQ-UHFFFAOYSA-N	446.529	1.782	50	20	IDGD	
O=C(NNc1nc(-c2ccncc2)no1)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1	732069179	WJOPWAFYPAWGRK-LLVKDONJSA-N	429.418	1.849	50	20	IDGD	
COc1cc([N+](=O)[O-])c(C(=O)NNC(=O)CCN2C[C@@H](C)O[C@H](C)C2)cc1SC	732258517	DUANFSNGKSMBFR-VXGBXAGGSA-N	426.495	1.586	50	20	IDGD	
CC[C@@H](C)NS(=O)(=O)c1ccc(C(=O)NNC(=O)CCN2C[C@H](C)O[C@H](C)C2)cc1	732260553	FWOSLUKRANMPRP-OAGGEKHMSA-N	440.566	1.024	50	20	IDGD	
O=C(COC(=O)c1ccc(N2CCCCCC2)nc1)NNC(=O)c1cccc([N+](=O)[O-])c1	732323040	IOEIRROCMXTEMO-UHFFFAOYSA-N	441.444	1.988	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)NCCN/C(O)=C1/N=CC=CC1=O	732467895	YNDJANGPWBQSAJ-DIGCTUSJSA-N	437.456	1.464	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)N[C@H]1CCN(c2ccccc2Cl)C1=O	732470168	UBCWXNJIDWJGBW-HNNXBMFYSA-N	427.848	1.726	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNS(=O)(=O)N2CCc3ccccc3C2)c1	732747661	YHAALKBZZKFWNB-UHFFFAOYSA-N	440.319	1.995	50	20	IDGD	
O=C(NCCCN1C(=O)NC2(CCCC2)C1=O)NNC(=O)NCc1ccc(Cl)cc1	732990771	SBLFTZMDFYZLJA-UHFFFAOYSA-N	436.900	1.608	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)NCc1cc2c(nc1O)CCC2	733651042	CWBPFBJYEPAKSW-UHFFFAOYSA-N	435.278	1.948	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)C1(S(=O)(=O)c2ccc(Cl)cc2)CCCC1	740851418	DNFSGTXVIRORCS-UHFFFAOYSA-N	443.953	1.879	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)[C@H]1CCCN(C(=O)COc2ccccc2)C1	741206340	ALPKVLKBTVGTHM-INIZCTEOSA-N	429.448	1.670	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)NCc1nc(-c2ccc(OC)cc2)n[nH]1	741417650	LWHMLYDPTJBEFQ-UHFFFAOYSA-N	440.460	1.788	50	20	IDGD	
Cc1cc(C)nc(-n2[nH]c(C(=O)NNC(=O)c3cc4c(s3)CC[C@@H](C)C4)cc2=O)n1	741740944	JBEADRAXUSMXIF-SNVBAGLBSA-N	426.502	1.834	50	20	IDGD	
O=C(C/N=C1/NS(=O)(=O)c2ccccc21)NNc1c(F)cc(F)cc1Br	741980668	PKWWXCBTZAILPH-UHFFFAOYSA-N	445.245	1.909	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)C[C@@H](C)/N=C2/NS(=O)(=O)c3ccccc32)cc1	742480236	HWNWIUMQIGEHAJ-CQSZACIVSA-N	446.554	1.752	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)N2CCC[C@H]2CN2CCOCC2)N(C)c2ccccc21	742762603	QOUKSWUPGQLWFE-SFHVURJKSA-N	437.544	1.980	50	20	IDGD	
C[C@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)N1CCCCCC1	743286345	YIWHTBJRJTVAGZ-QGZVFWFLSA-N	436.578	1.887	50	20	IDGD	
CC(C)[C@H](NC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)c1nnc2ccccn12	743583419	PGAFWGSYXLKZGJ-INIZCTEOSA-N	445.505	1.866	50	20	IDGD	
CC(=O)Nc1cc(NC(C)=O)cc(C(=O)OCC(=O)NNC(=O)c2cccc(C)c2)c1	744612368	BYHHAHDZOXKDHD-UHFFFAOYSA-N	426.429	1.530	50	20	IDGD	
CCCN1CCC(NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)CC1	745865981	XFLNTMKJBXTXRB-UHFFFAOYSA-N	437.566	1.290	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)Cc3ccncc3)CC2)cc1C	747322580	CAGCQRORVMNINS-UHFFFAOYSA-N	430.530	1.489	50	20	IDGD	
Cc1c(Cl)cc(C(=O)O)cc1S(=O)(=O)NNC(=O)[C@H]1COc2ccccc2O1	747595871	IMSSYKSANHGTQB-CQSZACIVSA-N	426.834	1.496	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(C(=O)O)c(Br)c1)c1ccc(Cl)nc1	747607136	SSLCQKMZABRGDR-UHFFFAOYSA-N	434.655	1.819	50	20	IDGD	
COc1cc(OC)cc(N2CC[C@@H](NC(=O)NNC(=O)COCc3ccccc3)C2=O)c1	747957352	ZQTNRDSIJJHXML-LJQANCHMSA-N	442.472	1.356	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1)c1nncn1C	747978998	AMODHWJTXUBCLS-JXFKEZNVSA-N	433.516	1.834	50	20	IDGD	
COc1cc(C(=O)NNc2nc(-c3ccccn3)nc3c2CCC3)ccc1OCC(N)=O	748340355	XRYLSDXOLCUUFX-UHFFFAOYSA-N	434.456	1.657	50	20	IDGD	
COC(=O)c1csc(S(=O)(=O)NNC(=O)c2ccc(OC(C)C)c(OC)c2)c1	749151929	LXSWIVKSQBALQY-UHFFFAOYSA-N	428.488	1.954	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)NNC(=O)c2ccc(COc3ccccc3)o2)c(C)o1	751299500	YEEHLHYSEBZWQK-UHFFFAOYSA-N	433.442	1.743	50	20	IDGD	
NS(=O)(=O)c1cc(Cl)c(F)c(C(=O)NNC(=S)NCCc2cccs2)c1	752268366	MLEBGXKLVNXHTF-UHFFFAOYSA-N	436.943	1.540	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(C)c(C(=O)NNc2ccc(C(F)(F)F)nn2)c1	755182915	GBLMEQXKWYZXML-UHFFFAOYSA-N	433.412	1.485	50	20	IDGD	
C=CCN(C)S(=O)(=O)c1ccc(NC(=O)NNC(=O)COc2ccccc2C#N)cc1	755934530	VZENWFQNCHQDCA-UHFFFAOYSA-N	443.485	1.596	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)Nc1cccc(C(=O)N2CCSCC2)c1	756273492	DYZMSJUZAUWUHL-UHFFFAOYSA-N	439.497	1.979	50	20	IDGD	
CC(C)(C)OC(=O)N1CCc2c(NC(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)cccc21	757619685	AVZQOCFJQHQTIM-LBPRGKRZSA-N	438.506	1.572	50	20	IDGD	
CC(C)Oc1ccc(Br)cc1NC(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O	757739266	KOCSDBHBDDAYFX-SECBINFHSA-N	437.316	1.327	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)Nc2ccn(-c3cccc(F)c3C#N)n2)c2ccccc2c1=O	757978187	CWDICTJHGKJGMI-UHFFFAOYSA-N	446.402	1.596	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1cnc(-c2ccc(C(F)(F)F)cc2)s1	758050827	CSIKSMGCNZQYMU-QMMMGPOBSA-N	436.437	1.528	50	20	IDGD	
C[C@H](O)C[C@H](CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)c1ccccc1	759608861	FHZDEZGZPYIVSQ-MAUKXSAKSA-N	448.545	1.436	50	20	IDGD	
Cc1cc(C)n(-c2ccccc2CNC(=O)NNC(=O)CNC(=O)c2cccs2)n1	760749070	GHTWYXCIEPKIQR-UHFFFAOYSA-N	426.502	1.811	50	20	IDGD	
COC(=O)[C@@H](C)NC(=O)/C(C#N)=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	761108965	HCLZEYNOYAYJQZ-ZMTLZGASSA-N	429.864	1.664	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)N[C@H]2CCN(C(=O)CC)C2)c2ccccc2c1=O	762380571	XPTYHYJQPVMHCB-AWEZNQCLSA-N	428.493	1.152	50	20	IDGD	
CCOC(=O)c1cc(S(=O)(=O)NNC(=O)CSc2ccccc2O)ccc1F	763408125	CKISGJYWQXEVMB-UHFFFAOYSA-N	428.463	1.810	50	20	IDGD	
Cn1ccnc1[C@@](O)(CCNC(=O)NNC(=O)CSc1ccccc1O)C(F)(F)F	763477522	RXAXRUQXWWTIFJ-INIZCTEOSA-N	447.439	1.388	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(C)ccc2-n2cc(C)cn2)cc1OC	763550242	BHGDDLWCAUDIAE-UHFFFAOYSA-N	437.456	1.906	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2ccc(OCC(F)(F)F)nc2)c1	763645722	YBADHDAKEVFJEC-UHFFFAOYSA-N	440.378	1.804	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccc(-c2nncn2C)c1	763681822	NUWVSCSNWSWAKI-UHFFFAOYSA-N	438.444	1.046	50	20	IDGD	
COC(=O)c1ccc(F)c(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)c1	763852257	GQHSJGRGXSQAMA-CYBMUJFWSA-N	431.420	1.783	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)cc1S(C)(=O)=O	763864175	GNRFQVNVNGYODP-LBPRGKRZSA-N	437.449	1.091	50	20	IDGD	
C[C@@H]1Oc2ccc(NC(=O)C(=O)NNC(=O)CCSc3ccc(F)cc3)cc2NC1=O	763895026	JXRGUDDTEJJZOH-NSHDSACASA-N	446.460	1.813	50	20	IDGD	
Cc1cc(N2CCCC2)ccc1NC(=O)C(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	763951131	ZEEKKSLFKFKFHS-UHFFFAOYSA-N	448.483	1.886	50	20	IDGD	
CNC(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCCCC3)cc1	763961640	ISIXGHQNMZDYRZ-UHFFFAOYSA-N	428.514	1.705	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)c(OC)c1OC	763996476	RKUWSYTWBRIYQF-UHFFFAOYSA-N	441.238	1.203	50	20	IDGD	
COC(=O)[C@H]1CCCCN1C(=O)c1cccc(NC(=O)C(=O)NNC(=O)CCC(C)C)c1	764202372	BPNLYUHNJOLEIK-QGZVFWFLSA-N	446.504	1.376	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)C(=O)Nc1ccc(F)cc1S(=O)(=O)CC)c1ccccc1	764328191	CFGVHWQQWYHLEQ-OAHLLOKOSA-N	435.477	1.899	50	20	IDGD	
C=CCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1	764350644	HEUAHTJJIXQAEE-UHFFFAOYSA-N	432.440	1.188	50	20	IDGD	
COC(=O)c1cc(F)ccc1NC(=O)C(=O)NNC(=O)c1cnn(-c2ccccc2)c1	764352086	ZYRYRITUXCEDDS-UHFFFAOYSA-N	425.376	1.198	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2ccc(C)o2)ccc1NC(=O)c1cccnc1	764371543	PABZEPBMZLDXDP-UHFFFAOYSA-N	437.412	1.644	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccccc3-n3cncn3)n[nH]2)cc1	764384633	HNFUCELHAYFQRE-UHFFFAOYSA-N	444.455	1.620	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)C(=O)Nc1cccc(CS(=O)(=O)NC(C)(C)C)c1	764385761	IBIWXUDZAXXQJZ-UHFFFAOYSA-N	447.517	1.008	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCc2cccnc2OCC(F)F)nc1	764516429	YGGNFDVXCZJTRF-UHFFFAOYSA-N	444.464	1.634	50	20	IDGD	
COC(=O)NNC(=O)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C)[C@@H]2C[C@H]3CC[C@H]2C3)cc1	765375740	IOQBRTUFOHRYFE-DVZHBHJUSA-N	438.506	1.115	50	20	IDGD	
COC(=O)NNC(=O)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C)[C@H]2C[C@H]3CC[C@H]2C3)cc1	765375742	IOQBRTUFOHRYFE-LMOYCYGVSA-N	438.506	1.115	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cc1F	765736939	CFHYBDIKFSYSNA-UHFFFAOYSA-N	442.491	1.372	50	20	IDGD	
O=C(Cc1ccc2c(c1)OCO2)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	765751031	GYEVGVMHVSLLSU-UHFFFAOYSA-N	444.919	1.576	50	20	IDGD	
CN(C)[C@H](C(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1)c1ccccc1	766664453	QRMPXQSYZITDAK-QFIPXVFZSA-N	443.979	1.908	50	20	IDGD	
CO[C@H](C(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1)c1ccccc1	766670308	WXJOZWLCSHVSMF-NRFANRHFSA-N	430.936	1.993	50	20	IDGD	
COCCN1C(=O)c2ccc(C(=O)NNc3ncnc4ccsc34)cc2S1(=O)=O	766676477	NTMXYCOVUIHPAZ-UHFFFAOYSA-N	433.471	1.239	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1cc(C(C)C)nn1-c1ncccn1	768230449	FVAWJRMLKOJBQT-UHFFFAOYSA-N	447.459	1.142	50	20	IDGD	
N#Cc1ccc(C(=O)NNS(=O)(=O)c2sc(C(=O)O)cc2Br)cc1	769627395	ZXCZLJGUSBHJLT-UHFFFAOYSA-N	430.261	1.704	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)cc1	770958317	LNFBZTQCUPHYOF-LBPRGKRZSA-N	447.521	1.405	50	20	IDGD	
Cc1ccc(S(C)(=O)=O)cc1S(=O)(=O)NNC(=O)[C@@H](C)Oc1cccc(Cl)c1	773268445	ZWOLEZFBHDQCCC-GFCCVEGCSA-N	446.934	1.829	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)c2ccc(N3CCOCC3)cc2)C1	773421679	SPETYOQKQZBNLH-KRWDZBQOSA-N	432.521	1.931	50	20	IDGD	
COCCNC(=O)Cn1cc(NC(=O)C(=O)NNc2c(Cl)cccc2Cl)cn1	773691791	OTPQAXPMKAFFBB-UHFFFAOYSA-N	429.264	1.034	50	20	IDGD	
CCCNC(=O)[C@@H]1CN(C(=O)C(=O)NNc2cnc3ccccc3n2)c2ccccc2O1	773722888	ONTOCHIZZWFUFL-SFHVURJKSA-N	434.456	1.393	50	20	IDGD	
CO[C@@](C)(C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1)c1ccccc1	776149884	YVRCNAZQCRJCNA-HXUWFJFHSA-N	433.534	1.023	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)c1cnc(C(F)(F)F)nc1	777403123	TVCCFZYEOOKNBC-UHFFFAOYSA-N	443.407	1.355	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNS(=O)(=O)c2ccc(OCC(F)(F)F)nc2)c1	777912504	AFEDUTXDPYSXFL-UHFFFAOYSA-N	435.380	1.663	50	20	IDGD	
O=C1CCc2cc(NC(=O)C(=O)NNC(=O)c3cccc(OC(F)F)c3)c(F)cc2N1	778710704	QHJHHIOZOAXYQI-UHFFFAOYSA-N	436.346	1.712	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@@H](C(=O)NNc2ccc(OC(F)F)cc2)[C@@H](C)O)cc1	779535360	SIPOXDCBLSFBGC-MLGOLLRUSA-N	429.445	1.767	50	20	IDGD	
CSc1ccccc1S(=O)(=O)NNC(=O)c1sc(N2CCOCC2)nc1C	780365412	BTUIAVKRXXQBMR-UHFFFAOYSA-N	428.561	1.633	50	20	IDGD	
O=C(NCCNC(=O)c1cc[nH]n1)NNC(=O)c1cc(-c2ccccc2)nc2ccccc12	780879907	WEHRDXUECKDGMQ-UHFFFAOYSA-N	443.467	1.999	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NCc2ccccc2CN2CC[C@@H](O)C2)cc1C	781949295	AVDWZEJYAQVEOA-HXUWFJFHSA-N	426.517	1.779	50	20	IDGD	
CCOc1ccc(/C=C(\C#N)C(=O)O[C@H](C(=O)N[C@@H]2CCS(=O)(=O)C2)C(C)C)cc1	782452184	ZXTIAPHVJPXDPF-YGOMYWGWSA-N	434.514	1.863	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2cccc(Cn3nc4ccccn4c3=O)c2)cc1	783021967	IQFVCQKEEUUQMQ-UHFFFAOYSA-N	432.440	1.635	50	20	IDGD	
CN1CCN(Cc2cccc(NC(=O)C(=O)NNc3ncnc4ccsc34)c2)CC1	783254556	DUFRXCCQZSYYCT-UHFFFAOYSA-N	425.518	1.521	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2ccc(-c3ncc4n3CCCC4)cc2)CCS(=O)(=O)C1	783428413	VGMFHYMBUZLFCO-FQEVSTJZSA-N	431.518	1.023	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)C(=O)Nc1ccc(CCCc2ccccc2)cc1	784002869	VTRSZMBGBUNBCS-UHFFFAOYSA-N	448.479	1.971	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNc2ccc(OCC(F)(F)F)cc2)cccc1-n1cnnn1	784369274	XQMCJNICMHEALX-UHFFFAOYSA-N	435.366	1.994	50	20	IDGD	
CC(C)(C)c1ccc(NNC(=O)C(=O)Nc2cnn(CC(=O)N3CCOCC3)c2)cc1	784805731	RWUGUFCEJLVDNP-UHFFFAOYSA-N	428.493	1.121	50	20	IDGD	
O=C(NNc1cccc([N+](=O)[O-])c1)C(=O)Nc1cccc(OCC(=O)N2CCCC2)c1	784827891	AMSAFTQOYYOARK-UHFFFAOYSA-N	427.417	1.678	50	20	IDGD	
COC(=O)Cc1cccc(NC(=O)C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)c1	785099297	DBIQYCOOXRJUQH-UHFFFAOYSA-N	446.410	1.654	50	20	IDGD	
CNC(=O)Cn1nc(NC(=O)C(=O)NNc2nc3cc(Cl)ccc3cc2C)cc1C	785164640	HNPHYQXLGLRHGM-UHFFFAOYSA-N	429.868	1.529	50	20	IDGD	
O=C1CN(c2ccnc(C(=O)NNc3c(F)cc(F)cc3Br)c2)CCN1	787062033	RQZHIGBJVLFAKM-UHFFFAOYSA-N	426.221	1.815	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)CN2CCN(C(=O)c3cc4ccccc4s3)CC2)cc1	789370702	SGZTZQWKLGVCOK-UHFFFAOYSA-N	447.520	1.992	50	20	IDGD	
O=C(NNC(=O)[C@H]1OCC[C@H]1c1ccccc1)C(=O)Nc1ccn(CCc2ccncc2)n1	789810246	LNWKJVGQZJXAIJ-ICSRJNTNSA-N	448.483	1.179	50	20	IDGD	
COc1ccc(CC(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)nc1	789869925	WLHQFNBRIMYFDR-UHFFFAOYSA-N	443.463	1.852	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cccc(N3CCC3=O)c2)cc1	790952317	QUYUUTIVKLWFIL-AWEZNQCLSA-N	438.440	1.179	50	20	IDGD	
CC(C)Cc1ncc(NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cn1	791949984	XZFQQJNMBUGIOU-UHFFFAOYSA-N	446.533	1.926	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@@](C)(O)Cn2c(C)cccc2=O)ccc1OCCC(C)C	792031486	XFMOZZWXVCPPNA-QHCPKHFHSA-N	445.516	1.802	50	20	IDGD	
COCCn1c(SCC(=O)NNC(=O)c2ccc(C)cc2)nnc1-c1ccncc1	792734113	DWIPTYWYQWATTH-UHFFFAOYSA-N	426.502	1.848	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NN=Cc1ccnn1-c1ccc(F)cc1	794523436	BRGRFHJMNAZQAL-UHFFFAOYSA-N	434.475	1.920	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)N[C@@H]1C[C@H]1c1ccc(Br)cc1	798048817	RXZVQUQDNFGYNI-JKSUJKDBSA-N	442.277	1.925	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@H]2C(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1	798349029	RXCSGCNQGOEWLL-QFBILLFUSA-N	425.441	1.287	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(C(C)=O)cc2)c(C)c(OC)c1	800622564	OBKFAMTUNBIJCA-AWEZNQCLSA-N	443.456	1.768	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(C(C)=O)cc2)c(C)c(OC)c1	800622565	OBKFAMTUNBIJCA-CQSZACIVSA-N	443.456	1.768	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@@H]2CCCC23CCOCC3)cc1	800741618	YAVQZNABCMXNTQ-QGZVFWFLSA-N	438.550	1.295	50	20	IDGD	
CCOc1ccccc1[C@@H](CC(=O)NNC(=O)C(=O)Nc1ccc(C)cc1)NC(C)=O	801110034	LXRSJZYSCXADJD-GOSISDBHSA-N	426.473	1.747	50	20	IDGD	
C#CCNS(=O)(=O)c1ccc(C(=O)NNC(=O)Nc2cc(OC)ccc2Cl)cc1	802113439	QXHGJKBWPNIGMD-UHFFFAOYSA-N	436.877	1.727	50	20	IDGD	
C[C@H](NS(=O)(=O)c1ccc(Cl)cc1)C(=O)NNC(=O)Nc1ccc(N(C)C)cc1	802119276	DROGGNZLTXAYOB-LBPRGKRZSA-N	439.925	1.926	50	20	IDGD	
COC(=O)N(C)NC(=O)CC[C@H](Cc1ccc(Cl)cc1)C(=O)NN(C)C(=O)OC	804123698	PDNRCYIAZANNAZ-CYBMUJFWSA-N	428.873	1.738	50	20	IDGD	
CCc1nnc(NC(=O)[C@H](C)[C@@H](C)NC(=O)NNC(=O)COc2ccc(C#N)cc2)s1	807566656	ZPJCFAMGWUBWSP-VXGBXAGGSA-N	445.505	1.345	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CNS(=O)(=O)c2ccc(Br)s2)c(O)c1	810172865	RRBQDZJGSZMMIR-UHFFFAOYSA-N	448.320	1.264	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1)NN=c1cc[nH]c2ccccc12	810361475	NPMGQTVASVWKKG-UHFFFAOYSA-N	440.403	1.977	50	20	IDGD	
CCOC(=O)c1cc(S(=O)(=O)NNC(=O)c2ccccn2)cc(Br)c1C	811674878	JVCSFDSRUZXXDW-UHFFFAOYSA-N	442.291	1.953	50	20	IDGD	
CCCCOc1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)cn1	813033821	NAXBTPFNCLHJKD-UHFFFAOYSA-N	435.506	1.593	50	20	IDGD	
Cn1cc(Br)c(C(=O)NNC(=O)COc2ccc(Br)cc2)n1	814363121	HFPAMCGKAFYVJC-UHFFFAOYSA-N	432.072	1.785	50	20	IDGD	
CCOc1nc2ccc(C(=O)OCC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)cc2[nH]1	815443967	OQYTWUAZPLJDRB-UHFFFAOYSA-N	427.373	1.488	50	20	IDGD	
COCc1cc(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)cc(C(=O)OC)c1	815565735	YAIOKBNCBOKEHQ-UHFFFAOYSA-N	449.847	1.438	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)N(C)CC(=O)NNc2nc3ccccc3n2C)cc1	816578039	JVZODPIBOMVQNY-UHFFFAOYSA-N	430.490	1.296	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	843446207	CELSNILRFZPUDY-YVEFUNNKSA-N	434.832	1.638	50	20	IDGD	
COc1ccc(NC(=O)COc2ccc(C(=O)N3CC[C@@H](B(O)O)C3)cc2OC)cc1	864234913	YTXLIZVLISJAMI-OAHLLOKOSA-N	428.250	1.410	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=S)Nc1cccc(S(=O)(=O)N(C)C)c1	913445848	YTQOHLPZWZIAGQ-UHFFFAOYSA-N	436.559	1.896	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc3nc(O)[nH]c3c2)c1	914748612	REZXHHJFWXXDMO-UHFFFAOYSA-N	431.474	1.374	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCc2ccnc(-n3cccn3)c2)cc(OC)c1OC	914827981	KUXSTFNAQNFOTF-UHFFFAOYSA-N	426.433	1.437	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)CCCN1C(=O)CCC1=O	915616578	BYIRUXITGKZUMS-LLVKDONJSA-N	426.267	1.293	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)NC(C)(C)C)N(S(C)(=O)=O)CC2	915879271	LQHXWLVCNNXMQC-CQSZACIVSA-N	442.538	1.082	50	20	IDGD	
COc1ccc(OC)c(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1	916261460	GZECHNCPXGKYED-UHFFFAOYSA-N	436.490	1.098	50	20	IDGD	
COc1cc(C=NNC(=O)[C@H](C)CN2CCOCC2)cc(I)c1O	916361759	FLIIHTFWHYAYKN-LLVKDONJSA-N	447.273	1.424	50	20	IDGD	
CCCNC(=O)CN1CCC(NC(=O)NNC(=O)c2ccc(Br)s2)CC1	916518676	DJGIKKTZRNSAPU-UHFFFAOYSA-N	446.371	1.445	50	20	IDGD	
O=C(CN1C(=O)NC2(CCCCC2)C1=O)NNC(=O)c1ccc(F)cc1Br	918339901	WPWZLFOJLFMQJJ-UHFFFAOYSA-N	441.257	1.604	50	20	IDGD	
O=C(CC(F)(F)F)NNC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1	919816995	MDBBMMDSSFXKBG-SNVBAGLBSA-N	438.384	1.095	50	20	IDGD	
O=C(NC1CC1)c1cccc(S(=O)(=O)NNC(=O)c2nnc(-c3ccccc3)o2)c1	919961622	GZHOZIGWFSQTNA-UHFFFAOYSA-N	427.442	1.252	50	20	IDGD	
NC(=O)c1ccc(/C=C/C(=O)N2CCC[C@@H]2C(=O)NNC(=O)NC2CCCCC2)cc1	920029497	DUZRVRCRHVNONN-LVMGUKCRSA-N	427.505	1.453	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)NCc2cc(C)on2)cc1	920850834	KBIGTZKICMKCMQ-YBEGLDIGSA-N	434.456	1.954	50	20	IDGD	
NC(=O)[C@H]1CCCN(c2ccc(C(=O)NNC(=O)c3cc(-c4ccccc4)[nH]n3)cc2)C1	1317985992	YVLUCQWTBHMBME-KRWDZBQOSA-N	432.484	1.853	50	20	IDGD	
CC(=O)c1cccc(S(=O)(=O)NCCC(=O)NNc2cncc(Br)c2)c1	1320245380	GDFCNIXRERGAOT-UHFFFAOYSA-N	441.307	1.858	50	20	IDGD	
COCCNS(=O)(=O)c1cccc(CNC(=O)NNC(=O)c2ccccc2Cl)c1	1322976689	WZVVQPZNDKKEIB-UHFFFAOYSA-N	440.909	1.409	50	20	IDGD	
Nc1cnnc(NNC(=O)CCn2cnc3ccc(Br)cc3c2=O)c1Cl	1340602646	UBDQJJQJEKCNTN-UHFFFAOYSA-N	438.673	1.718	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(Cl)c4nncn4c3)C2)C1	1778948322	UKHXJYXOPPTCJN-KBXCAEBGSA-N	442.303	1.080	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cccnn2)C1	1779650220	RKYOZUAWQCOBID-JCKWVBRZSA-N	425.327	1.635	50	20	IDGD	
Cn1nc(C(F)(F)F)cc1C(=O)N1CC[C@@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1779656069	CWLIQMMZLYPQGW-QGZVFWFLSA-N	448.518	1.734	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(C1)CN(C(=O)C1CCC1)CCO2	1780097013	NBWUXNRKNXIKBK-NRFANRHFSA-N	431.445	1.764	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc(C)nc2O)C1	1780141825	UUMDYZZCLJVAFI-RZQQEMMASA-N	425.913	1.477	50	20	IDGD	
CCOc1ccc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)nn1	1780426002	CJIOBUCIBYVXCW-ROUUACIJSA-N	431.320	1.555	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2)c1cc(F)c(F)cc1F	1780891774	YWHQYDIXLRCYKZ-GPMSIDNRSA-N	434.842	1.831	50	20	IDGD	
COc1cnc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)c(F)c1	1781227559	BGRYJPDQWPIWRY-ZWKOTPCHSA-N	434.295	1.909	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781332888	GCROMPOQYVTXQD-HNSFDTNUSA-N	447.301	1.262	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(Cl)c(O)cc3O)C2)C1	1781472362	FSBKNAUTIVOFLW-SCLBCKFNSA-N	433.288	1.449	50	20	IDGD	
COc1ccc([C@H](O)C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](C)Br)C3)C2)cc1	1783527804	GMQXISQTCSBRAW-IYJAJMOOSA-N	441.322	1.342	50	20	IDGD	
Cc1occ(C(F)(F)F)c1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]2C1	1784090675	KPPBULMVMOODBJ-IMIFBBOLSA-N	438.830	1.800	50	20	IDGD	
Cc1ncc(/C=C/C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)s1	1784687670	BKCRBJHDIUZFCT-PWFUPBTHSA-N	432.315	1.985	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3(C)CC3)[C@H]2C1	1786298196	ZQORRCAVZSNPJY-FNHZYXHNSA-N	445.472	1.914	50	20	IDGD	
C[C@H](Nc1cccnc1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21	1786866113	GHEATAMWBFEAJM-OSZUESSQSA-N	443.317	1.552	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21)c1cc(Cl)nc2n[nH]cc12	1787236705	YQUDZTYGLCPCHF-FNYBSCSFSA-N	430.267	1.739	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]3C2)c(-n2nccn2)c1	1787447905	JTBVLRCMMFJWQX-IKICRFKJSA-N	435.887	1.703	50	20	IDGD	
Cc1nnc(CC(=O)NC2(c3ccc(NC(=O)c4ccc(B(O)O)cc4)cc3)CCC2)o1	1788140655	GKIIUDFFGDCPJI-UHFFFAOYSA-N	434.261	1.048	50	20	IDGD	
COc1ccnc(C(=O)Nc2ccc(C3(NC(=O)c4cccc(B(O)O)c4)CCC3)cc2)c1	1789756628	RYKGVMKGYYDPJZ-UHFFFAOYSA-N	445.284	1.832	50	20	IDGD	
COc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]3C2)nn1C	1789872749	VYTKBBCIMJEMEP-MMNXLFCMSA-N	433.336	1.258	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]21	1790609464	ANHZQQIGHNTFCS-REZKGXPESA-N	439.336	1.764	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CNc3ccc(F)cc3)C[C@@H]21	1791251256	CFHWQQCBNFVMJV-MGHWNKPDSA-N	427.904	1.471	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cn3cnc4ccccc43)C[C@@H]21)C(Cl)Cl	1791298347	LDYFHCFMJUFWPV-XEZPLFJOSA-N	425.316	1.820	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(C)(C)n1nc(C)ccc1=O)C2	1793449357	UJCXOKLVSKWIPM-KYHPRHEASA-N	438.956	1.284	50	20	IDGD	
Cc1noc(C)c1CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)CBr)C2	1793882669	RNDLNLLHPJYJKB-JAMKOXHTSA-N	428.327	1.455	50	20	IDGD	
Cn1ncc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)C(C)(C)CCl)C3)c1C(F)(F)F	1794274851	CKODDGYHPCMMTK-PTEHBNRSSA-N	436.862	1.907	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ncn(-c2cccc(F)c2)n1	1794289795	OTGAJIFNZUFAQT-RMHZUWNSSA-N	435.887	1.627	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCN1CCCCC1	1795294271	REPKIDLXMBFSBW-KYHPRHEASA-N	430.387	1.626	50	20	IDGD	
COc1ccc(F)cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1	1796192831	UCPMBWVDTIYKIP-BCDXTJNWSA-N	426.253	1.080	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(Cl)ncn1	1798305991	JAXILSRDKFWYMI-NJBDSQKTSA-N	431.718	1.364	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C=C(/C)C(=O)O)C2	1799220490	UFDFSGNWRUPXOH-FUUYKEDTSA-N	445.428	1.803	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(-n2cccn2)cc1	1799600688	ALUJJJKHPMESDT-SCNOPHJPSA-N	447.333	1.859	50	20	IDGD	
O=C([C@@H](F)Br)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C(F)(F)C(F)(F)C(=O)O)C2	1800156996	MTOSCRGFVMHPSL-ULAWRXDQSA-N	437.159	1.670	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1COc3ccccc3O1)C2	1800757973	YWDDWZUWTWGXET-XIUQWWLSSA-N	439.306	1.199	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3c(s1)CCCC3)C2	1801011725	YFOXLLOXCXPJOJ-VPTLXERWSA-N	448.589	1.203	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1=NN(c3ccccc3)C(=O)C1)C2)C(Cl)Cl	1801016293	WGJQFXJDQKXSAO-DRXBFXEBSA-N	439.299	1.173	50	20	IDGD	
CNC(=O)CC(=O)N1CC[C@H](CNC(=O)[C@@H](C)CBr)[C@@H]1c1cccnc1	1803011131	NYHZICUBXSZXGW-QEORTHHSSA-N	425.327	1.255	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)Cn2cc(Cl)cn2)[C@H]1c1cccnc1)[C@@H](O)CCl	1803137726	DFLNRJSENRRTCC-QRTARXTBSA-N	426.304	1.237	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)Cc2cccc(Cl)n2)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803141838	SIQLTNZLYIAKRN-URLQWDBASA-N	437.327	1.978	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2nc(O)n3c2CCCC3)[C@@H]1c1cccnc1)[C@H](O)CCl	1803143038	RLNBMZGWAXIMOO-YXJHDRRASA-N	447.923	1.239	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cc3cnccc3[nH]2)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803143255	XVTNNUWBVCTBQR-ZOCIIQOWSA-N	427.892	1.877	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)Cc2cccc(OC)n2)[C@@H]1c1cccnc1	1804395368	HRLZBBYOFYKWTQ-MMOPVJDHSA-N	446.935	1.988	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CCc2ccco2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807362603	LPZHLRMJPNWSRC-CVDCTZTESA-N	447.300	1.307	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)c2ccnnc2O)[C@H]1c1cccnc1	1812866451	GBVVNZXRCWRVBH-WHOFXGATSA-N	434.294	1.680	50	20	IDGD	
N[C@@H](Cc1cccnc1)C(=O)N1CC[C@H](CNC(=O)C(Cl)Cl)[C@@H]1c1cccnc1	1813080873	ZSDIBAHIUYXVMG-IKGGRYGDSA-N	436.343	1.856	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H]1CCCSC1)CC2)c1cccc(B(O)O)c1	1815362003	XYQFRSGRKUQKKX-UKRRQHHQSA-N	445.375	1.192	50	20	IDGD	
Cc1ccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)cn1	1816372204	QVZVXVJVUHUHGH-QGZVFWFLSA-N	427.509	1.792	50	20	IDGD	
C[C@H](Nc1nccs1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](O)CCl)CC2	1817216993	VKYUIRQYAOZESU-ATZCPNFKSA-N	429.955	1.612	50	20	IDGD	
Cc1n[nH]c(C)c1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1	1817476595	LRHMRANJYGFOOA-KRWDZBQOSA-N	436.281	1.049	50	20	IDGD	
C[Si](C)(C)OCC(=O)Nc1cc([C@H]2CCCCN2C(=O)CCN2CCOCC2)[nH]n1	1819593689	QFPPBYHOASWAHV-QGZVFWFLSA-N	437.617	1.976	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccc(F)n2)n[nH]1	1819739423	CHWSZVDQMHIVFR-HNNXBMFYSA-N	431.472	1.623	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H]1C[C@H]1C1CC1)CC2	1819789935	AIPIRXHPYSBSDA-KWCYVHTRSA-N	440.529	1.414	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)CCBr)[nH]n1)c1cc(CO)on1	1820346769	NFAUTRYHIMGHLK-ZDUSSCGKSA-N	426.271	1.981	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1CCc2nc(NC(=O)c3c[nH]c(=O)cn3)sc2C1	1821464138	XGZLZRXKSZUOQJ-RKDXNWHRSA-N	440.323	1.483	50	20	IDGD	
CC[C@@H](Br)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CNC(=O)N(C)C)[nH]n1	1822084383	KRMMTEOGOKZUDI-YPMHNXCESA-N	443.346	1.847	50	20	IDGD	
Cc1cc(CC(=O)N2CCCC[C@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)nn1C	1822412425	QZHJUDJHUFYTEL-KRWDZBQOSA-N	444.540	1.059	50	20	IDGD	
CC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(=O)n3[nH]cnc3n1)CC2	1822843044	JTDNNPVZOGCOHL-IUCAKERBSA-N	435.897	1.117	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H]3CCC(=O)N3C)sc2C1	1823043058	QCMQABVLBRXSMB-SCVCMEIPSA-N	443.367	1.707	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](O)c1ccccc1)CC2	1826085358	NZBUZMRJPBGFLD-LIRRHRJNSA-N	445.545	1.162	50	20	IDGD	
Cc1cncc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)c1	1827051425	YTDOGYXNRPGJKO-QFIPXVFZSA-N	435.333	1.617	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CC=CCC3)C2)C1	1830533538	PYLONSZEOWEGFX-GPMSIDNRSA-N	429.355	1.830	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccsc3)C2)C1	1830538906	UTIYYIJECGNVRQ-RDTXWAMCSA-N	445.379	1.778	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)c(Cl)c1	1830736926	BWUYIWWJXQAVON-VQIMIIECSA-N	431.316	1.318	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C13CC(F)(C1)C3)CCO2	1831580931	VOPSWCQFXLFGGY-RXOFBLNVSA-N	433.318	1.366	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3n[nH]c(CC)c3F)C2)C1	1831644114	OPSOOIAZBBRFPX-DJJJIMSYSA-N	430.908	1.589	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3nnsc3C3CC3)C2)C1	1831645665	CZFKNCXWFPTMNN-AUUYWEPGSA-N	442.969	1.893	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(C)nc3O)C2)C1	1831653817	FAGRVDPDBJWVQO-OXQOHEQNSA-N	425.913	1.573	50	20	IDGD	
C[C@@H](C(=O)NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1)C1(O)CCC1	1833070664	GXRBMOIQRLTWMY-BBRMVZONSA-N	448.377	1.800	50	20	IDGD	
CC(C)[C@H](O)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](C)CBr)CC2)CC1	1833265462	XELASBUMDVPLPJ-YOEHRIQHSA-N	432.403	1.606	50	20	IDGD	
O=C(c1cnc(-c2ccccn2)nc1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1833292180	WURYRDPGRQGMPG-OXJNMPFZSA-N	449.870	1.143	50	20	IDGD	
Cc1ncc(CC(=O)N2CCC(N3CCC(NC(=O)[C@H](O)CCl)CC3)CC2)s1	1833313191	YWVZQCAWPWZSSL-QGZVFWFLSA-N	428.986	1.165	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)CCl)CC2)CC1	1833313270	CTRNFNPZBJALIJ-WMLDXEAASA-N	428.788	1.394	50	20	IDGD	
O=C(c1ccc(OC(F)F)cn1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1833638893	HUUJFTYULGBTQX-GUYCJALGSA-N	437.802	1.287	50	20	IDGD	
Cc1nc(C)c(C(=O)N2CCO[C@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)s1	1834075041	CJTRALCJPJXXSC-IBGZPJMESA-N	441.626	1.681	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3ccc(=O)oc3)CC2)CC1	1834340931	MJWJMDLJHNSBLS-QGZVFWFLSA-N	425.913	1.079	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(C)cn3)CCO2)C1	1834378221	AYLVTMLMLBHFDX-DNVCBOLYSA-N	440.338	1.634	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)c3ccc(F)cn3)C2)C1	1834819164	IMCKFQYDNUMURF-KRWDZBQOSA-N	430.274	1.076	50	20	IDGD	
C[C@H](Oc1cccnc1)C(=O)N1CCC(N2CCC(NC(=O)[C@H](F)Cl)CC2)CC1	1835082723	DGIWOLZAQDJVDW-KSSFIOAISA-N	426.920	1.955	50	20	IDGD	
Cc1nnc(CC(=O)N2CCC(N3CCC(NC(=O)[C@@H](F)Br)CC3)CC2)o1	1836412595	NGHVLRPJWNSZGB-MRXNPFEDSA-N	446.321	1.183	50	20	IDGD	
CN(C)c1cccc(C(=O)N2CCC(OC3CCN(C(=O)[C@H](O)CCl)CC3)CC2)c1	1836717942	GIGZWUNLASDOAV-HXUWFJFHSA-N	437.968	1.965	50	20	IDGD	
COc1ccc2[nH]cc(C(=O)N3CCO[C@@]4(COCCN(C(=O)[C@H](F)Cl)C4)C3)c2c1	1836923810	VKWPNRYGKNOQOZ-PXNSSMCTSA-N	439.871	1.781	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](CN)c3ccccc3)C2)C1	1837711880	VDUCDTKWXNDCTD-UGKGYDQZSA-N	449.624	1.037	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3nc[nH]c3[N+](=O)[O-])CC2)CC1	1838095102	NGNOLKTWBKILQG-CQSZACIVSA-N	427.889	1.948	50	20	IDGD	
COCc1c[nH]c(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)c1	1838519412	MKOLBILCTQSDKK-SCLBCKFNSA-N	444.326	1.015	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cn4ccsc4n3)C2)C1	1839145473	IKZWRXNZBPPMEL-UGSOOPFHSA-N	426.926	1.483	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](Br)CC)C2)C1	1839148185	PVACYMZQOBCLDL-HEHGZKQESA-N	425.751	1.634	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](Br)CC)C2)C1	1839148186	PVACYMZQOBCLDL-WWGRRREGSA-N	425.751	1.634	50	20	IDGD	
CC(C)c1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)n[nH]1	1839153956	WTGRXRXHAGIEPQ-RBUKOAKNSA-N	447.363	1.839	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(O)ccc3F)C2)C1	1839154767	XKPMNTOSFJKORZ-OALUTQOASA-N	449.306	1.838	50	20	IDGD	
C[C@H](C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2)c1ccccn1	1839156159	DEAXBADPFDRACP-BEVDRBHNSA-N	444.359	1.878	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc4nn(C)cc4c3)CCO2)C1	1839506081	ZKNAVXLZYBNMHB-LAUBAEHRSA-N	434.924	1.661	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccnc(C)c3)C2)C1	1839965397	XNESEKVLFPEZLS-APWZRJJASA-N	440.338	1.634	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(F)c3F)C2)C1	1840034569	PRYKNDOLOKUYHG-SGTLLEGYSA-N	447.276	1.818	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccnc(Cl)c3)C2)C1	1840150845	RSCSIONXXRNTRW-KSSFIOAISA-N	432.304	1.059	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3CCc4ccccc43)C2)C1	1840155601	FMFCVWKTRLINJE-XQBPLPMBSA-N	436.936	1.427	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)C2CCN(c3ccccc3)CC2)C1	1841310788	KVJXCMACLDHGSA-UHFFFAOYSA-N	447.344	1.100	50	20	IDGD	
Cn1nccc1C(=O)N1CC2(CCCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C1	1841924311	WMXPGOSBJLAZFB-ZDUSSCGKSA-N	425.917	1.369	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)c2c[nH]c(-c3ccc(F)cc3)c2)C1	1842263578	QBAIYUASCXCGLA-UHFFFAOYSA-N	447.275	1.631	50	20	IDGD	
O=C(c1ccc(OC(F)F)cc1F)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843011765	QLGJQWHWDGKGSA-UHFFFAOYSA-N	448.206	1.238	50	20	IDGD	
N#Cc1cccc(C(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)c1Cl	1844264569	JAZRAZKOTYRQRG-UHFFFAOYSA-N	438.875	1.341	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC12CN(C(=O)c1nc3ccccc3n(C)c1=O)C2	1846070699	YZPRCJRBZPFMGV-ZDUSSCGKSA-N	447.333	1.924	50	20	IDGD	
COc1cc(F)cc(/C=C/C(=O)N2CCCC23CN(C(=O)c2ccc(B(O)O)cc2)C3)c1	1846261552	PILOXKAFHVZTOY-FPYGCLRLSA-N	438.264	1.045	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@H]1CC(=O)CN1C(=O)OC(C)(C)C)C2	1846360663	XUDWYAMKDZFGBM-GJZGRUSLSA-N	443.928	1.022	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)c1ccc(OCC3CC3)c(F)c1)C2	1846386519	VJTZJCHCMYJNGS-UHFFFAOYSA-N	446.523	1.805	50	20	IDGD	
O=C(COC(=O)/C=C/c1ccc(Br)o1)NNC(=O)c1cccc([N+](=O)[O-])c1	11194086	DUUOKBBJYYJRHB-FNORWQNLSA-N	438.190	1.968	50	20	IDGD	
O=C(CNC(=O)c1ccc(Br)cc1)NNC(=S)NCCc1cccs1	21125067	INEDJNXGTGSHCZ-UHFFFAOYSA-N	441.376	1.978	50	20	IDGD	
O=C(COc1ccc(F)cc1Br)NNC(=O)[C@@H]1COc2ccccc2O1	26692444	SVCCGAUHDSNKAN-HNNXBMFYSA-N	425.210	1.954	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)N3CCC(N(C)S(C)(=O)=O)CC3)cc2C1	725859988	JHIFDELMWFZOIT-GFCCVEGCSA-N	428.580	1.583	50	20	IDGD	
CC(C)(C)NC(=S)NNC(=O)[C@H](CCS(C)(=O)=O)NC(=O)c1ccc(Cl)cc1	726141182	HNZFAHFPMMTSJI-ZDUSSCGKSA-N	448.998	1.167	50	20	IDGD	
CC(C)NC(=O)C(=O)NNC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)c1ccc(F)cc1F	726157668	YCWXSJKJRBPDCE-ZLIFDBKOSA-N	436.459	1.410	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)c3ccn(C)n3)c2)cc1	727364520	RCWBFDWXDWNKNG-UHFFFAOYSA-N	429.458	1.304	50	20	IDGD	
CCn1c(=O)c2ccccc2n(CC(=O)NNC(=O)c2c(Cl)cccc2Cl)c1=O	727792746	OJRPAJIIJHPUSF-UHFFFAOYSA-N	435.267	1.951	50	20	IDGD	
COc1cccc(N2CC[C@H](NC(=O)NNC(=O)C(=O)Nc3ccc(C)c(C)c3)C2)c1	728221335	RLPGGCPATYAQST-KRWDZBQOSA-N	425.489	1.860	50	20	IDGD	
O=C(NNC(=O)N1CCN(c2ccc([N+](=O)[O-])nc2)CC1)c1cccc(OC(F)F)c1	728600057	YAVORIYWFTWJGC-UHFFFAOYSA-N	436.375	1.768	50	20	IDGD	
CS(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1	728845356	HZGJTOOJDGDBJG-UHFFFAOYSA-N	437.909	1.211	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1)N(C)C1CC1	729618108	ZXHFJXOSJHPLCR-MRXNPFEDSA-N	448.531	1.815	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)C1CCN(S(=O)(=O)c2ccccc2F)CC1	730034347	MVAPDEBMZSREBS-UHFFFAOYSA-N	449.504	1.712	50	20	IDGD	
COc1c(F)cc(CC(=O)NNC(=O)c2cccc3ncccc23)cc1S(N)(=O)=O	730226327	JAFOOCHFECXFPW-UHFFFAOYSA-N	432.433	1.034	50	20	IDGD	
COC1CCN(C2(CNC(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)CCCC2)CC1	730914190	MYWRLUPADJFPAM-UHFFFAOYSA-N	442.524	1.030	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)nnn1-c1ccc2ncccc2c1	731343023	ARWMGEBXUFRUGE-UHFFFAOYSA-N	440.427	1.174	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)C1CCN(S(=O)(=O)c2cccnc2)CC1)c1ccccc1	731998949	IPBQNWQXMOPQEV-LJQANCHMSA-N	430.530	1.824	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1	732052872	TXMGVDAEIRHGBC-LBPRGKRZSA-N	442.457	1.678	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Cn2c(=O)nc(O)c3ccccc32)cc1Br	732306256	WMQISHSRENHDSU-UHFFFAOYSA-N	447.245	1.334	50	20	IDGD	
NC(=O)c1ccccc1N1CC[C@H](NC(=O)NNC(=O)c2cc(Br)c[nH]2)C1	732572780	GLYQHHRZCRRFHT-NSHDSACASA-N	435.282	1.099	50	20	IDGD	
Cn1c(N)c(C(=O)/C(C#N)=C\c2cc3ccccc3nc2N2CCCCC2)c(=O)n(C)c1=O	732578273	ITRRDVPCPNDVAG-LGMDPLHJSA-N	444.495	1.995	50	20	IDGD	
O=C(NN=Cc1nc(-c2ccc(Br)cc2)c[nH]1)N[C@@H]1CCS(=O)(=O)C1	732712889	SEQSXHQPFLXYBJ-GFCCVEGCSA-N	426.296	1.659	50	20	IDGD	
CCOC(=O)c1ccc(C(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)nc1C	734824864	KHZDTSCGOKXMRK-UHFFFAOYSA-N	449.508	1.910	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)CCC(=O)c2ccccc2)CC1	735118371	TYVLMSXDOBFNNQ-UHFFFAOYSA-N	431.518	1.124	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2cn(-c3cccc(C(F)(F)F)c3)nn2)C[C@H](C)O1	740076019	QKDGNPOEHDNIDK-STQMWFEESA-N	440.426	1.546	50	20	IDGD	
Cn1cc(S(=O)(=O)N2CCOCC2)cc1C(=O)NNC(=O)c1cccc2ccccc12	741577159	XRXIXXAOWNRNTE-UHFFFAOYSA-N	442.497	1.274	50	20	IDGD	
CCO[C@H](C)c1noc(CN2CCN(C(=O)/C(C#N)=C/c3cc(C#N)n(C)c3C)CC2)n1	742793262	LRUZRWSOMLFAMH-VHWUNXFSSA-N	437.504	1.937	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)Cc2ccc(S(=O)(=O)C(F)F)cc2)c1	745077048	SNTXCPJPSVPQLL-UHFFFAOYSA-N	440.424	1.538	50	20	IDGD	
Cc1c(Br)ccc(C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)c1N	745452395	MYIKEFCEXUVJHE-UHFFFAOYSA-N	431.246	1.829	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@@H]2[C@H]3CCCO[C@H]3C2(C)C)cc1	745860369	QNURABMWXQQNAK-KBAYOESNSA-N	438.550	1.150	50	20	IDGD	
O=C(CNC(=O)[C@@H]1c2ccccc2C(=O)N1Cc1ccccc1)NNC(=O)NC1CCCC1	745866518	CUSOVYHUONWIMQ-NRFANRHFSA-N	449.511	1.773	50	20	IDGD	
C[C@@H]1C[C@@H](NC(=O)NNC(=O)c2ccc(Cl)cc2Cl)C(=O)N1c1cnn(C)c1	745916560	CSFJBVKLRBIZBN-YMTOWFKASA-N	425.276	1.865	50	20	IDGD	
COC(=O)c1ccsc1N1CC[C@H](NC(=O)/C(C#N)=C\c2cc(C#N)n(C)c2C)C1=O	746642288	XUVSOEUTNGHCCD-QHIITQONSA-N	437.481	1.882	50	20	IDGD	
O=C(Cn1c(S)nc2ccccc2c1=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	746689688	UCTDXQZHVQBBBV-UHFFFAOYSA-N	445.526	1.269	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)NCC1(N2CCSCC2)CCCCC1	746764506	ARRITGMRBXFNLT-UHFFFAOYSA-N	430.578	1.959	50	20	IDGD	
COC[C@@H](NC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1)c1ccc(C)o1	746769967	IZBSMISRGOCPQK-MRXNPFEDSA-N	438.506	1.235	50	20	IDGD	
Cn1ccnc(NNC(=O)c2ccc(Cl)c(S(=O)(=O)NCc3ccccc3)c2)c1=O	747941368	ATOBVRYFBWSBHR-UHFFFAOYSA-N	447.904	1.669	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)[C@H]1CCCN1C(=O)c1ccc2c(c1)OCO2	749562389	WGENIWVCRJLZML-OAHLLOKOSA-N	429.404	1.385	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)[C@@H]1CC(=O)N(CCOc2ccccc2Cl)C1	751993129	GFNOEKJSFFXOLB-CYBMUJFWSA-N	438.912	1.020	50	20	IDGD	
CNS(=O)(=O)c1cccc(NC(=O)[C@@H](C)NC(=O)/C(C#N)=C\c2ccc(F)cc2)c1	752056096	CUOXTKVBRLAFIB-NWFCWYBLSA-N	430.461	1.784	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)NCCNS(=O)(=O)c2ccc(Cl)s2)cc1	752689165	OJWDYMHMGMVLLZ-UHFFFAOYSA-N	430.939	1.886	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)N[C@H]3CCCN(Cc4ccccn4)C3=O)n[nH]2)cc1	753289300	KZTYRBFOHORORR-SFHVURJKSA-N	447.499	1.915	50	20	IDGD	
C[C@H](NCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)c1nc(-c2cccc(F)c2)no1	755039335	NEMWHZANBUJLKO-NSHDSACASA-N	428.380	1.896	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)CNC(=O)c1ccccc1C(F)(F)F	755287493	UPGVUOCDBVCDDS-UHFFFAOYSA-N	428.392	1.074	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)Nc2ccc(N3CCCS3(=O)=O)cc2)c1	755592525	HOVVJIQBSNGIGL-UHFFFAOYSA-N	432.462	1.046	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)Nc1ccc(N2CCNC(=O)C2)c(Cl)c1	755937619	JWAWIEXDBFJNDZ-UHFFFAOYSA-N	442.863	1.380	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)ccc1C(N)=O	756400444	KRKQUZVYPSEYIB-UHFFFAOYSA-N	445.501	1.345	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)c1cc2ccccc2n1Cc1ccccc1F	758057529	VRUCIPOBSFHNNW-CYBMUJFWSA-N	432.477	1.527	50	20	IDGD	
CC(C)N1C(=O)c2ccc(C(=O)NNc3nc(O)c4ccccc4n3)cc2S1(=O)=O	758307305	GYUVEKJCGMLSTC-UHFFFAOYSA-N	427.442	1.645	50	20	IDGD	
CC(C)C[C@H](CCC(=O)NNC(=O)c1cccnc1)C(=O)NNC(=O)c1cccnc1	759108729	AJFWFSSKCVSNKU-HNNXBMFYSA-N	426.477	1.141	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(n2cc(C(=O)NNc3ncccc3[N+](=O)[O-])nn2)CC1	759301433	PUMRNSVMDAYWAD-UHFFFAOYSA-N	432.441	1.910	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCCCSc2nccs2)c2ccccc2c1=O	759585936	LGUUQIUNRDXVPE-UHFFFAOYSA-N	432.531	1.999	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)[C@](C)(O)CN2C(=O)C(C)(C)c3ccccc32)cc1C	760054894	ZLTVVGDTHMEEIM-XMMPIXPASA-N	439.512	1.905	50	20	IDGD	
CC(C)[C@@H](NS(=O)(=O)c1ccc2c(c1)OCCCO2)C(=O)NNc1ncc(F)cn1	760906367	TZTKWVWVAOTYMX-MRXNPFEDSA-N	439.469	1.223	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)Cn2nnc(-c3ccc(C)cc3)n2)n[nH]1	763155420	SAIULJGMOHYQGG-UHFFFAOYSA-N	432.444	1.508	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)c3cc(S(=O)(=O)NC(C)C)c[nH]3)n[nH]2)c1	763173912	GTTFDYBISMEODB-UHFFFAOYSA-N	444.517	1.783	50	20	IDGD	
CN1C(=O)CCc2cc(NC(=O)C(=O)NNC(=O)c3cc4ccccc4cc3O)ccc21	763517346	HRXYDCUAHSSIBQ-UHFFFAOYSA-N	432.436	1.854	50	20	IDGD	
CCCN1Cc2cccc(NC(=O)C(=O)NNC(=O)COc3ccc(OC)cc3)c2C1	763660845	HTTZQNMBZFRMQQ-UHFFFAOYSA-N	426.473	1.586	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc3c(c2)NC(=O)[C@H](C)O3)cc1C	763666545	IUGWBMBVUSZQKZ-ZDUSSCGKSA-N	426.429	1.188	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)C(=O)Nc1cccc(OCc2cccnc2)c1	763679812	PHCBUXAMINYOLM-UHFFFAOYSA-N	438.415	1.965	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)NCc2ccc(N3CCCS3(=O)=O)cc2)cc1	763707710	NICZHIGHNMBSQO-UHFFFAOYSA-N	446.529	1.698	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(N(C)C)c2)c(OCCN(C)C)c1	763759820	CHSMPHXJZAEERE-UHFFFAOYSA-N	427.505	1.401	50	20	IDGD	
CCCCOc1cccc(NC(=O)C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c1	763785542	HMKSHXHXBNLEGE-UHFFFAOYSA-N	437.456	1.512	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])nn1[C@H](C)C1CC1	763807698	FKKXGZTZTZYHEL-GFCCVEGCSA-N	430.421	1.236	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccnn1Cc1ccccn1	763865127	ISEJYGAXHDZWQI-ZDUSSCGKSA-N	426.408	1.019	50	20	IDGD	
COC(=O)c1cc(OC)c(OC)cc1NC(=O)C(=O)NNC(=O)Cc1ccc(Cl)cc1	763936854	QMBYJTJDBKOLED-UHFFFAOYSA-N	449.847	1.472	50	20	IDGD	
Cn1cccc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CC[C@@H](C(C)(C)C)C3)c1=O	763939002	APTQKZHXKZUBEZ-CYBMUJFWSA-N	430.530	1.998	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)C(=O)Nc1ccc(F)cc1-c1ccc(F)cc1	763999435	WSMOKSJLDTWTNY-GFCCVEGCSA-N	437.424	1.152	50	20	IDGD	
O=C(NNC(=O)C1CCCC1)C(=O)Nc1cccc(S(=O)(=O)NC2=NCCCCC2)c1	764069025	RBUCTGARMWIGTJ-UHFFFAOYSA-N	449.533	1.214	50	20	IDGD	
NC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ccc(F)cc2Br)ccc1F	764086974	ZLFBMVARANLULG-UHFFFAOYSA-N	441.188	1.226	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2O1)C(=O)Nc1cccc(Cl)c1-n1cncn1	764162703	DWFBFLMJMYWICQ-OAHLLOKOSA-N	426.820	1.010	50	20	IDGD	
Cc1ncsc1C(=O)NNC(=O)C(=O)Nc1ccccc1C(=O)N1C[C@@H](C)C[C@@H](C)C1	764247590	UDYWREQPXHLTLT-BETUJISGSA-N	443.529	1.969	50	20	IDGD	
O=C(NNC(=O)c1cccc2ncccc12)C(=O)Nc1ccc(N2CCOCC2)c(F)c1	764260304	QHFHWSMUXNQORY-UHFFFAOYSA-N	437.431	1.610	50	20	IDGD	
CCCCOc1ccccc1NC(=O)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	764260952	UNPLXMFOPOZLET-UHFFFAOYSA-N	440.504	1.658	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1ccc(OCc2ccncc2)cc1	764279033	WJFFWFJSMWPDJR-UHFFFAOYSA-N	436.424	1.531	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1ccc(OC(F)F)c(Cl)c1	764279663	AVFAUQWHEWNXAG-UHFFFAOYSA-N	429.763	1.812	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)C(=O)Nc1ccccc1CN1CCc2ccccc21	764355089	ZCUZFZTXTSPMRO-UHFFFAOYSA-N	429.480	1.973	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(Oc2ccc(Cl)nn2)cc1	764398119	CXOJPOIXYXZKRY-NSHDSACASA-N	437.840	1.060	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)C(=O)Nc2nc(-c3ccccc3F)cs2)c1	764433159	KXAYRSXDJVJUTG-UHFFFAOYSA-N	442.432	1.702	50	20	IDGD	
O=C(Cc1ccc(CC(=O)NNc2nccnc2Cl)cc1)NNc1nccnc1Cl	764464355	YWRYGYLLIYWYCQ-UHFFFAOYSA-N	447.286	1.945	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)NCc1cccc(N2CCCS2(=O)=O)c1	765304511	UCFHDIBTFGYJNC-UHFFFAOYSA-N	438.531	1.456	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)CCC(=O)OC(C)(C)C)cc2)CC1	765464044	HUZLUOIXQYIEAW-UHFFFAOYSA-N	426.539	1.188	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)CCCS(=O)(=O)c2ccc(Br)cc2)n[nH]1	765586107	MJRKNJGXWFFKLG-UHFFFAOYSA-N	429.296	1.496	50	20	IDGD	
COc1cc(C#N)ccc1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	766252040	QMGZJPVEMWFIPQ-UHFFFAOYSA-N	443.485	1.818	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1c(Cl)nc2ccccn12	766642936	PENJGJHXZOEDQV-UHFFFAOYSA-N	440.891	1.207	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@H]3CCN(C4CCCCC4)C3)CC2)cc1	766651020	YSASKKZCQIEOQP-QFIPXVFZSA-N	441.620	1.915	50	20	IDGD	
CO[C@@H](C(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1)c1ccccc1	766670309	WXJOZWLCSHVSMF-OAQYLSRUSA-N	430.936	1.993	50	20	IDGD	
Cc1nn(C)c2[nH]c(=O)c(CCC(=O)NNC(=O)c3cc(-c4cccs4)[nH]n3)c(C)c12	768261800	XAZCLHXLTVQYMW-UHFFFAOYSA-N	439.501	1.724	50	20	IDGD	
COC(=O)c1cccc(CCNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1	768725886	XPARHSDSOFLEQB-UHFFFAOYSA-N	426.477	1.053	50	20	IDGD	
CN1C(=O)C[C@@H](NC(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)[C@@H]1c1ccc(Cl)cc1	768985790	DHRROPAITBCRMD-PBHICJAKSA-N	447.835	1.870	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@]2(CC(=NNC(=O)C(=O)NC3CC3)c3ccccc3O2)C1	769569232	FYLMDYQAXHJWPK-JOCHJYFZSA-N	428.489	1.948	50	20	IDGD	
O=C(NNC(=O)c1cc(I)ccc1O)c1ccc2c(c1)OCCO2	770416928	FTDLMBSGWRWCJJ-UHFFFAOYSA-N	440.193	1.843	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)C(=O)Nc1ccnn1-c1cccc(F)c1	770771213	JDLGENNSHZWUKY-UHFFFAOYSA-N	433.403	1.597	50	20	IDGD	
CCCCN1C(=O)c2ccccc2N2C(=O)CC[C@@]12C(=O)O[C@H](C)C(=O)NNC(=O)CC	771965996	MEPJLRFNCBMRDB-JLCFBVMHSA-N	444.488	1.255	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)c1ccc(S[C@H]2CCOC2=O)cc1	772884033	HNJUQZREIXTDSX-INIZCTEOSA-N	447.900	1.825	50	20	IDGD	
CNS(=O)(=O)c1ccc2c(c1)N(C(=O)C(=O)NNc1ccc(C(F)(F)F)cn1)CC2	773667960	XBZZUEYWCKABFM-UHFFFAOYSA-N	443.407	1.041	50	20	IDGD	
Cc1ccc(C(=O)NNS(=O)(=O)c2ccccc2S(=O)(=O)N2CCCC2)c(O)c1	775271627	NQKAWTPBJPNSPY-UHFFFAOYSA-N	439.515	1.108	50	20	IDGD	
COc1cc(C(=O)NNc2cccc(S(C)(=O)=O)c2)cc(NS(C)(=O)=O)c1OC	776528184	SBXLTIXBIKJCMF-UHFFFAOYSA-N	443.503	1.236	50	20	IDGD	
COc1ccc([C@@H]2[C@H](C(=O)NNC(=O)CNC(=O)OC(C)(C)C)CCC(=O)N2C)cc1	778437018	RLDFZLUFKJTZEH-CRAIPNDOSA-N	434.493	1.277	50	20	IDGD	
CCn1c(NNC(=O)[C@H](O)[C@@H](O)c2nc3ccccc3s2)nc2ccccc2c1=O	779475395	LGRNJZSGQKEGKH-HZPDHXFCSA-N	425.470	1.564	50	20	IDGD	
COC(=O)c1cc(F)cc(S(=O)(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)c1	782249176	JMLUNWPEHJDRNK-UHFFFAOYSA-N	442.421	1.261	50	20	IDGD	
CN(C)C1CCN(c2ccc(NC(=O)C(=O)NNC(=O)c3ccc(O)cc3)cc2F)CC1	782837462	LKZSIUTYZRQILY-UHFFFAOYSA-N	443.479	1.461	50	20	IDGD	
CC(C)CCn1nccc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)NC(C)C)cn1	783262227	BVLWEECGVZLMIV-UHFFFAOYSA-N	437.526	1.093	50	20	IDGD	
O=C(NNc1ccc(-n2cccn2)nn1)C(=O)Nc1ccc(CCN2CCCCC2)cc1	783436771	PXCDXABWFMCPPG-UHFFFAOYSA-N	434.504	1.773	50	20	IDGD	
Cc1ccc(NNC(=O)C(=O)Nc2ccc(S(=O)(=O)N3CCCCCC3)cc2)nn1	783950087	KSVKCKCECUNBFL-UHFFFAOYSA-N	432.506	1.432	50	20	IDGD	
Cn1cnc2cc(NC(=O)C(=O)NNc3ccc(S(=O)(=O)NC4CC4)cc3)ccc21	784210489	QQXBMFZLAACDNP-UHFFFAOYSA-N	428.474	1.096	50	20	IDGD	
O=C(NNc1nc(Br)cn2ccnc12)[C@H]1CC=CC[C@@H]1C(=O)N1CCOCC1	784782780	DHYYCOFALLYGCP-STQMWFEESA-N	449.309	1.376	50	20	IDGD	
C=CCN(C)S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2cc(F)cc(OC)c2)cc1	785241424	JGGHUJAZTFHGBM-UHFFFAOYSA-N	436.465	1.723	50	20	IDGD	
O=C(COC(=O)c1cc(O)c2ccsc2c1)NNC(=O)[C@@H]1COc2ccccc2O1	786139159	YWCZOBUUHZOOIT-INIZCTEOSA-N	428.422	1.751	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)CN2CCc3ccccc3C2=O)CC1	788751246	KOCNZHUNAOHOOA-UHFFFAOYSA-N	445.520	1.415	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2cc(Br)ccc2O1)C1CCN(c2ncccn2)CC1	791573942	KUSNLKCYPGZQOM-INIZCTEOSA-N	446.305	1.607	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)CCN2CCN(C(=O)OC(C)(C)C)CC2)c1	792017367	HYZBIWXGVBOIJA-UHFFFAOYSA-N	436.509	1.408	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)[C@@](C)(O)Cn2c(C)cccc2=O)c1	792138853	SXTQWIZTPVCGCX-SFHVURJKSA-N	438.278	1.140	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)[C@@H]2CC(c3cc(OC)ccc3OC)=NO2)c1	792632346	BEVYRVASZAWWCC-IBGZPJMESA-N	428.445	1.465	50	20	IDGD	
Cc1nc2cc(F)c(F)cc2n1CC(=O)NNC(=O)c1csc(N2CCOCC2)n1	792807855	DYDFJZAMEXTUBY-UHFFFAOYSA-N	436.444	1.377	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2cc(O)ccc2C(F)(F)F)ccc1Cl	792809411	OVXOHCWLZIBOCX-UHFFFAOYSA-N	437.783	1.787	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C2CCN(S(=O)(=O)c3ccc(F)c(F)c3)CC2)n1	794090216	PYEMSBVHLSBKKG-UHFFFAOYSA-N	438.456	1.530	50	20	IDGD	
CC(CCc1ccc(I)cc1)=NNC(=O)[C@@H](C)NS(C)(=O)=O	794509073	YJKYHDKAFWPKFD-LLVKDONJSA-N	437.303	1.654	50	20	IDGD	
CC(C)NS(=O)(=O)c1cccc(C(=O)NNc2ccccc2S(=O)(=O)N(C)C)c1	795168673	BNVJSNDLMRQQCZ-UHFFFAOYSA-N	440.547	1.381	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(C)(C)[C@H]1C(=O)OCC(=O)NNC(=O)c1ccc(C#N)cc1	796219877	RZQDNKPXLSUPMK-MRXNPFEDSA-N	430.461	1.508	50	20	IDGD	
N#Cc1ccc(OC2CCN(CC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)CC2)c(F)c1	796514340	JIIVNTQMEKGWIY-UHFFFAOYSA-N	441.419	1.910	50	20	IDGD	
O=C(NNC(=O)c1ccccn1)Nc1ccc(NS(=O)(=O)Cc2ccccc2)cn1	797653435	SPVYUERMLCVGRY-UHFFFAOYSA-N	426.458	1.885	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cc4ccccc4c(=O)o3)CC2)cc1	797743445	QQJMYVUEQRWTRU-UHFFFAOYSA-N	434.496	1.680	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccnc(OCc2ccccc2)c1	800622487	MJZHCZRSMBHKFP-UHFFFAOYSA-N	445.435	1.697	50	20	IDGD	
O=C(CC(F)(F)F)NNC(=O)NCCOc1ccc(I)cc1	802326349	SZESJYALFISDQT-UHFFFAOYSA-N	431.152	1.953	50	20	IDGD	
O=C(NNC(=O)c1ccccc1Br)C(=O)Nc1ccc(OC(F)F)nc1	802565744	IORJXQMVFWNCJY-UHFFFAOYSA-N	429.177	1.845	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C[C@H]1COCCN1C(=O)OC(C)(C)C	802937889	HYMFIWHMFWMNEA-AWEZNQCLSA-N	439.534	1.961	50	20	IDGD	
Cc1nc(Cn2nnc(NC(=O)C(=O)NNc3ccc(Cl)cc3Cl)c2C)no1	803563537	ODIOPBNBTJJWLE-UHFFFAOYSA-N	425.236	1.715	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)[C@@H]1CSCN1C(=O)c1ccc(Cl)cc1	804952353	NCOIKOJADSTNJH-AWEZNQCLSA-N	429.893	1.974	50	20	IDGD	
Cc1cc([N+](=O)[O-])ccc1NNC(=O)[C@H]1CN(Cc2nc(O)c3ccccc3n2)CCO1	805375929	ZSGCAMZPDRGWCA-GOSISDBHSA-N	438.444	1.896	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)[C@H]2CCN(c3ccc(C#N)cc3F)C2)n1	805591411	SSSCPKAGSVICIM-AWEZNQCLSA-N	445.476	1.222	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)Nc1ccc(S(=O)(=O)[C@@H](C)C#N)cc1	806458527	KJJLLQMYCPAJSJ-ZDUSSCGKSA-N	432.458	1.613	50	20	IDGD	
COc1ccc(CS(C)(=O)=O)cc1NC(=O)NNC(=O)[C@@H](C)Oc1ccccc1F	806638621	FEBGAEUUDNTMHF-GFCCVEGCSA-N	439.465	1.999	50	20	IDGD	
CCc1cc(NC(=O)C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)ccc1F	806973443	BKJAWGSDDSMRDE-UHFFFAOYSA-N	436.465	1.038	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccc2c(c1)C(=O)CC(C)(C)O2	806977644	SGLAEAQUQWLHBS-UHFFFAOYSA-N	425.441	1.768	50	20	IDGD	
Cc1cc([N+](=O)[O-])ccc1NNC(=O)C(=O)Nc1ccc(C(=O)N2CCN(C)CC2)cc1	807454887	BDCNFVHSAVVJGI-UHFFFAOYSA-N	440.460	1.373	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)C(=O)Nc1ccc2c(c1)C(=O)OC2	808934744	SXIAJHKNBSAPHX-UHFFFAOYSA-N	448.229	1.284	50	20	IDGD	
CS(=O)(=O)CC1CCC(=NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)CC1	814691138	OPDMEDHHECSWRR-UHFFFAOYSA-N	441.575	1.792	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCc2nncn2C1)C(=O)Nc1ccc(Oc2cccc(F)c2)cc1	815691438	QAORTZWAIJNMRT-ZDUSSCGKSA-N	438.419	1.558	50	20	IDGD	
COC(=O)c1c(C)csc1NC(=O)C(=O)NNc1ccccc1S(=O)(=O)N(C)C	815751448	ZTQOHWKIRSOWHC-UHFFFAOYSA-N	440.503	1.175	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)NCCCc2nnc(S)n2C)N(C)c2ccccc21	818241366	DQYCWZLUEKZKCG-UHFFFAOYSA-N	439.545	1.823	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)c2csc(S(N)(=O)=O)c2)c1	818747019	XLSXGWRTKUQKRY-UHFFFAOYSA-N	434.293	1.702	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CSc1nnc(-c2ccoc2C)n1N	844101656	FDEDKPKFIWANIQ-UHFFFAOYSA-N	436.881	1.776	50	20	IDGD	
Cn1c(CCC(=O)NNc2ccccc2)nc2cc(S(=O)(=O)N3CCOCC3)ccc21	868106115	WESJLTFOVGDOBJ-UHFFFAOYSA-N	443.529	1.670	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)[C@@H](C)NC(=O)C(C)(C)C)c2ccccc2c1=O	871398729	IOBNFZLXCSROCU-CQSZACIVSA-N	429.521	1.899	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)[C@@H]2CC(=O)N(Cc3ccccc3Cl)C2)C[C@@H](C)O1	912920214	YQWZZFWCEGMAEV-BFYDXBDKSA-N	436.940	1.335	50	20	IDGD	
COc1nn(C)c2nc(C)c(CCC(=O)NNC(=O)COc3ccccc3F)c(C)c12	914748807	HKLIKNVFJNVFML-UHFFFAOYSA-N	429.452	1.892	50	20	IDGD	
O=C(CCCN1C(=O)CCC1=O)NNC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1	915638297	FECHVXVEQFYWBX-UHFFFAOYSA-N	446.467	1.625	50	20	IDGD	
CC(C)N1CCC(NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)CC1	915896875	ICLSDRWALRPDHC-UHFFFAOYSA-N	437.566	1.288	50	20	IDGD	
O=C(O)COc1ccc(Br)cc1C=NNC(=O)Cc1cc(O)nc(S)n1	915957269	IBTRYHLYFNMKES-UHFFFAOYSA-N	441.263	1.390	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)N[C@@H](CN2CCOCC2)c2ccccc2)cc1	916216688	QKPJMAXMMPTDEE-FQEVSTJZSA-N	428.489	1.478	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NCCC(=O)N2CCCCC2)c2ccccc2c1=O	916437710	MNZGQRZHZZYHIM-UHFFFAOYSA-N	442.520	1.543	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=S)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1	916559393	ANRKOSSQLGUAGT-UHFFFAOYSA-N	448.570	1.576	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H]2CCCc3c2cnn3C)c1	916604701	MVCUXWSUNCEQEE-KRWDZBQOSA-N	448.549	1.472	50	20	IDGD	
CCCc1noc(CCCC(=O)NNC(=O)c2nn(CCC)c(=O)c3ccccc23)n1	916728495	WVZJCPUZPSISMM-UHFFFAOYSA-N	426.477	1.926	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCCCCC2)cc1C(=O)NNC(=O)CC(F)(F)F	918365493	AAYVUJIPTOSFNO-UHFFFAOYSA-N	437.440	1.973	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)[C@H](C)Sc2nnnn2C2CC2)c2ccccc2c1=O	918413016	LBIHMDWVHSMGRS-NSHDSACASA-N	442.505	1.070	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCN(c2ccc(Cl)cc2)C1=O)c1ccc(-n2cnnn2)cc1	919691015	QGICVBXQUVWHNN-MRXNPFEDSA-N	425.836	1.130	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)Nc2cccc(N3CCNC3=O)c2)c2ccccc2c1=O	919896711	AIIRHEBELXTYIZ-UHFFFAOYSA-N	449.471	1.974	50	20	IDGD	
C[C@@H](Cc1ccc(O)cc1)NC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	919910937	CIFUUDCLCBUUGG-SFHVURJKSA-N	425.533	1.866	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2cc(-c3ccc(OC)cc3)[nH]n2)c2ccccc2c1=O	920212553	OZTGZELKRJYOJL-UHFFFAOYSA-N	432.440	1.890	50	20	IDGD	
Cc1ccc(-c2nn(CCC#N)cc2C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)cc1C	920852199	VHWSMQXKQZMLBG-INIZCTEOSA-N	444.517	1.212	50	20	IDGD	
Cc1cc(C)n(-c2ccc(NC(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)cn2)n1	920934984	ZDJCNLCVBGYLSJ-UHFFFAOYSA-N	428.474	1.754	50	20	IDGD	
O=C(CCN1CCN(C(=O)[C@H]2CCCO2)CC1)NNc1cncc(Br)c1	1116394942	AEAHLGAKMVCVOA-OAHLLOKOSA-N	426.315	1.001	50	20	IDGD	
Cc1cc(C)n2ncc(C(=O)NNC(=O)c3ccc(CSc4nncn4C)cc3)c2n1	1317783691	UYWGOVOCEYMTNH-UHFFFAOYSA-N	436.501	1.842	50	20	IDGD	
COC(=O)c1cc(CNC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)oc1C	1317915795	DIXACSOMGMGTLL-UHFFFAOYSA-N	443.504	1.417	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)CN(C)C(=O)OC(C)(C)C	1318715363	DDJYGAYVIVSRJD-ZDUSSCGKSA-N	446.508	1.381	50	20	IDGD	
CC1(C)C(=O)Nc2ccc(S(=O)(=O)NNC(=O)c3cncn3-c3ccccc3)cc21	1319060799	MDGMIDVXUWXBLP-UHFFFAOYSA-N	425.470	1.725	50	20	IDGD	
CC(C)=NO[C@@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Br)C1	1780776814	KYXXJUCQFRUSKV-ZOMKSWQUSA-N	436.322	1.992	50	20	IDGD	
CC(=O)N/C(=C\c1ccco1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Cl)C2	1781057614	ZXBHDOFSGDOHCN-HHTSUVIWSA-N	441.887	1.805	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(N4CCN(C)CC4)cc3)CCO2)C1	1781210965	FHYPZKFGXTYPOW-REWPJTCUSA-N	448.995	1.899	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2)[C@H]1CCc2ccccc2O1	1782146552	HBGQBKNPEMWTJI-WGQQHEPDSA-N	436.936	1.494	50	20	IDGD	
Cc1csc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CCC(=O)NN(C)C)C2)c1	1782208929	BOUJHXUDTVLTKI-DYESRHJHSA-N	436.578	1.557	50	20	IDGD	
C[C@H]1CC[C@H](C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cccc(B(O)O)c2)C3)CC1	1782684443	LJTNOLKKYVWHDR-ZUXGEGRZSA-N	442.365	1.320	50	20	IDGD	
O=C(/C=C/c1cccc(O)c1)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1783272949	FRKANNPTPMUYTI-NCWIEVAOSA-N	427.270	1.926	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3c(O)cc(O)cc3O)CCO2)C1	1783353477	OUDOIQLXNWGGES-XIKOKIGWSA-N	443.294	1.420	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)CNc3ccc(F)cc3)CCO2)C1	1783532853	OIRJQCHHRDMAJH-ACJLOTCBSA-N	428.302	1.851	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccnc(OCC(C)C)c3)CCO2)C1	1783876979	ZCMAEBBBLMKMRB-LAUBAEHRSA-N	439.940	1.814	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccn(-c4ccccc4)n3)CCO2)C1	1783880624	FAOKEIJBWVXNMO-UTKZUKDTSA-N	432.908	1.570	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)COc3cccnc3)C[C@@H]21	1783968659	FCUOVVPZOBMNHB-OTRWWLKZSA-N	440.338	1.471	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)C3CC(C)(C)C3)C2)C1	1784025571	SCZXQJSMPUWURW-NMWDDECMSA-N	429.521	1.387	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(F)(F)F)C[C@@H]21)[C@H](O)CCl	1784086322	KFXDOKMNYLDYAM-FATJJJSSSA-N	435.830	1.293	50	20	IDGD	
CN(C)c1ccc(CCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]3C2)cc1	1784095993	QPHGYTFSUKXDDQ-FFGOWVMKSA-N	437.968	1.265	50	20	IDGD	
Cc1nc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CO[Si](C)(C)C)C[C@@H]32)cs1	1785292837	PRUGBPVYUOZICS-XIRDDKMYSA-N	425.627	1.825	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)CCCNC(=O)OC(C)(C)C)C2)C1	1785570180	HPFHIRGVVNRUNC-YWZLYKJASA-N	447.960	1.375	50	20	IDGD	
CC(=O)Nc1ccc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]3C2)cc1	1787447317	TXELLVIVAXSSDE-XPYUAMARSA-N	425.888	1.702	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc([N+](=O)[O-])c4c3OCO4)C[C@@H]21)[C@@H](F)Cl	1787447688	CFFQPRZBMUMZFM-DFGBYOQWSA-N	443.815	1.451	50	20	IDGD	
Cc1n[nH]c(C)c1C(=O)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1	1788147837	JXQVVNLNBPWNSA-UHFFFAOYSA-N	432.289	1.768	50	20	IDGD	
CCC1(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)C[C@@H]32)CCC1	1788228067	JCYJQWAGKWDNEX-BODMQJBDSA-N	443.548	1.680	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(C)(C)OC(=O)NC(C)C)[C@H]2C1	1789753045	RQYHRJMVNGWNGL-VGWMRTNUSA-N	447.960	1.133	50	20	IDGD	
CCc1[nH]nc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](Br)CC)[C@H]3C2)c1F	1790961219	MQLOIRUQGJQXSF-FMSGJZPZSA-N	445.333	1.878	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnoc3COC)C[C@@H]21	1790961879	RVYHFWXYTKXJIJ-MXAVVETBSA-N	444.326	1.588	50	20	IDGD	
CCC[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2C1)n1cccc1	1791290983	HIOXQSKSUJAPBO-MUGJNUQGSA-N	447.580	1.182	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1)c1cncc(O)c1	1791468241	XIGOAJYQHIPGQH-UHFFFAOYSA-N	431.257	1.529	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cn(C)c3ncccc13)C2	1792871007	OJXUGTBHYGTAMT-ZJOBFFGXSA-N	449.349	1.808	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCCn1ccnc1)C2	1792873058	KDDRFCDLQBBXIW-PNBKFKSVSA-N	427.343	1.284	50	20	IDGD	
CC(C)(CCl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cc1cn3c(nc1=O)SCC3)C2	1792885261	PFQZZGYXYHXJPT-QDMKHBRRSA-N	438.981	1.795	50	20	IDGD	
Cc1noc(-c2ccccc2)c1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](O)CCl	1792978417	UROJTKILATXRNY-KYHPRHEASA-N	433.892	1.453	50	20	IDGD	
Cc1nnc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)Br)C3)s1	1794110609	XVUUEUNLTCNSAT-ADGXKJENSA-N	431.356	1.152	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1CCCCC1	1795049718	CWYJKGXWNXUYOQ-PHHZKWSHSA-N	429.521	1.290	50	20	IDGD	
CC[C@@H](C)[C@H](N)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)C2	1795558110	XGUBCHGKGNUKKG-JEBHCDCDSA-N	446.498	1.835	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1cnc(Cl)s1	1798236072	UVRJWHDCJUAXGA-MBLNEYKQSA-N	426.695	1.690	50	20	IDGD	
CC(C)(C)n1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)n1	1798440788	SCDDKTGIRIMKRG-QDMKHBRRSA-N	439.520	1.202	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ncccc1C(F)(F)F)c1cccc(B(O)O)c1	1798913704	TYTNJPOPWSRCPD-MUJYYYPQSA-N	447.222	1.346	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nc(OC)ccc1[N+](=O)[O-])C2	1799270136	QINKCQIPOPJOHD-OXIQGZBJSA-N	426.857	1.219	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c(O)cc(O)cc1O)C2	1799275711	AMPSZLHZGDBYKB-KDAHECLUSA-N	433.288	1.243	50	20	IDGD	
CCSc1cccnc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(B(O)O)cc1)C2	1799509822	BIYQAHZTAQLRJL-BCDXTJNWSA-N	439.346	1.439	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1CC[C@@H]2CCC(=O)N2C1	1799933290	QBIYQPXXDRJAGB-AYYATWNNSA-N	426.355	1.809	50	20	IDGD	
Cn1nccc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C#N)=C/c1ccc(F)cc1F	1800332632	UDDXHFKZBHYJMU-AOWDBCOTSA-N	441.438	1.509	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cn1cnc3ccccc31)C2	1800644229	NZKDVSXBIREJHQ-YGTYGHESSA-N	449.349	1.799	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c(cnn3C)c1)C2	1800759342	MCZWPJJUNMMKLB-RMIITELYSA-N	435.322	1.560	50	20	IDGD	
N=C(N)NCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](Br)Cc1ccccc1	1801568414	WXDKIYVHSTTZSO-QKPAOTATSA-N	436.354	1.114	50	20	IDGD	
COC[C@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](C)NC(=O)c1ccc(F)cc1)C2	1802284048	VZDKDKUIBLBFAR-CUWKQTPXSA-N	439.915	1.836	50	20	IDGD	
COc1ccccc1OCC(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1	1802801993	AUPLNIGYMRHQJC-FIKGOQFSSA-N	447.919	1.775	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@H]1CCN(C(=O)CS(C)(=O)=O)[C@H]1c1cccnc1	1803009273	SGDPYJPDMKHYML-XPKDYRNWSA-N	446.367	1.163	50	20	IDGD	
CCOc1ccc(C(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)nn1	1803142050	WSIYDPXZXPWJKO-KYJSFNMBSA-N	433.896	1.190	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC2(CCN(C(=O)c3cc(O)nc(O)n3)CC2)C1	1805384509	ODYPRLOPYUVWPO-GFCCVEGCSA-N	441.326	1.764	50	20	IDGD	
Cc1occc1C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1	1805613604	HNGYMMDXEYOFLB-UZLBHIALSA-N	448.483	1.615	50	20	IDGD	
C=CCOCCCC(=O)N1CCCC2(CCN(C(=O)c3ccc(B(O)O)cc3)CC2)C1	1806013983	ZDGSADIHWDAVOB-UHFFFAOYSA-N	428.338	1.194	50	20	IDGD	
COc1ncc(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)cc1C	1806097090	NXFVMQDGYNBIEM-SZMVWBNQSA-N	432.908	1.713	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)c1cccc2c[nH]nc12	1808056019	XHLLCIWKENYTFC-IEZWGBDMSA-N	427.892	1.877	50	20	IDGD	
COC(=O)CSCC(=O)N1CCC2(CCCN(C(=O)CCBr)C2)CC1	1809066428	MCFAQSNBAJAEES-UHFFFAOYSA-N	435.384	1.909	50	20	IDGD	
CN1CCN(CC(=O)N2CC[C@@H](CNC(=O)CO[Si](C)(C)C)[C@@H]2c2cccnc2)CC1	1810546147	PFJNRVSJNFPBBV-UGKGYDQZSA-N	447.656	1.186	50	20	IDGD	
CN1CCCn2nc(C(=O)NC[C@@H]3CCN(C(=O)[C@H](F)Cl)[C@@H]3c3cccnc3)cc2C1	1812286543	ZLDQDZDYCWXBKV-IPELMVKDSA-N	448.930	1.968	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H](CNC(=O)[C@@H]2CCNC(=O)C2)[C@H]1c1cccnc1	1813139214	WVYURUSGJAPWDW-WRWLIDTKSA-N	432.597	1.465	50	20	IDGD	
O=C(CCc1ccc[nH]1)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1	1815354761	RPYLSERCRZOHHD-INIZCTEOSA-N	438.318	1.010	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1	1816728262	CWHNQJKXDNKUHV-VXNVDRBHSA-N	441.307	1.959	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccnc(F)c2)[nH]n1)c1cccc(B(O)O)c1	1817474132	NBEWDFUHMRFNQC-QGZVFWFLSA-N	437.240	1.243	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](N)Cc2cscn2)n[nH]1	1817980467	MEBYQAPEDAJCJC-KCQAQPDRSA-N	440.957	1.682	50	20	IDGD	
Cn1cc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@@H](O)CCl)CC3)c2cccnc21	1819428295	OSIMXEWKNXKWIQ-YGRLFVJLSA-N	433.921	1.855	50	20	IDGD	
CNC(=S)NCCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)CO[Si](C)(C)C)CC2	1819809084	JEQAROANEGOKBE-LLVKDONJSA-N	443.671	1.391	50	20	IDGD	
C[C@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)c3cc(=O)ccn3C)sc2C1	1821318519	CSZWNCZIPJMFPQ-UWVGGRQHSA-N	439.335	1.851	50	20	IDGD	
C[C@H](Br)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)Cn2ccncc2=O)[nH]n1	1822188713	NBBLWUDEKYUUCX-AAEUAGOBSA-N	437.298	1.442	50	20	IDGD	
COc1ccc(CC(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@@H](O)CCl)CC3)c(C#N)c1	1822805582	YXJCQWUUAQNVLU-CJNGLKHVSA-N	448.932	1.778	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCS(C)(=O)=O)n[nH]1	1822969801	AVXCTZAWDWJMIG-CQSZACIVSA-N	430.603	1.688	50	20	IDGD	
O=C(CCC(=O)N1CCC([C@H]2CCCCN2C(=O)[C@H](O)CCl)CC1)N1CCCC1	1824178787	KUYBHTXGZIPXFX-QZTJIDSGSA-N	427.973	1.608	50	20	IDGD	
Cc1cc(C(=O)N2CCC([C@H]3CCCCN3C(=O)[C@H](O)CCl)CC2)nc2nccn12	1824187905	LCWFXPZNEANCBJ-QZTJIDSGSA-N	433.940	1.871	50	20	IDGD	
O=C(CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H](O)CCl)CC1)N1CCCC1	1824944325	ZLOWLZYSRRVHGK-MSOLQXFVSA-N	427.973	1.608	50	20	IDGD	
Cc1ncc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)s1	1827059167	HWUIBGCIKDKHAK-IBGZPJMESA-N	441.362	1.678	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H](O)N2CCOCC2)CC1	1828963910	KOGFVCSJSDIJLX-BJLQDIEVSA-N	429.989	1.664	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccncc2O)CC1	1829177671	JFMYEAXKQQMCOU-GOSISDBHSA-N	431.537	1.394	50	20	IDGD	
COCc1c[nH]c(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)c1	1830364738	SBMOGBVYOBUSKE-HXUWFJFHSA-N	427.929	1.496	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccc(F)cn3)C2)C1	1831645989	HQDYGCYSHZBHHZ-PXNSSMCTSA-N	427.904	1.627	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)cnc1C	1833299851	TUKQAGUOTJAPNM-MAUKXSAKSA-N	444.301	1.459	50	20	IDGD	
COC(OC)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)CBr)CC2)CC1	1833388668	RQWSARQZUWYNEL-ZDUSSCGKSA-N	434.375	1.208	50	20	IDGD	
Cc1nn(C)cc1C(=O)NC1CCN(C2CCN(C(=O)[C@H](C)Br)CC2)CC1	1833583836	KYJDSFHLQSWTIO-ZDUSSCGKSA-N	440.386	1.697	50	20	IDGD	
CN(C)c1ncc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)o1	1833900841	CWGKZMFJCYUODV-ROUUACIJSA-N	449.335	1.047	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cscn3)CCO2)C1	1834260017	UVVWINBHELITOW-WBMJQRKESA-N	432.340	1.387	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cncc(C)c3)CCO2)C1	1834288111	LDYFQUVQZRLGTE-APWZRJJASA-N	440.338	1.634	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@H](C)NC(=O)NCC)CC2)CC1	1835704779	ZAZQSPZMDABYNQ-MAUKXSAKSA-N	444.020	1.673	50	20	IDGD	
C[C@@H](C(=O)N1CCC(N2CCC(NC(=O)CO[Si](C)(C)C)CC2)CC1)n1cccn1	1835837909	RTKCHJMMKDTKHH-KRWDZBQOSA-N	435.645	1.867	50	20	IDGD	
CCc1ccnc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@](C)(Cl)CCl)C3)C2)c1	1836359982	MXTLGKJCVIDHMW-UXHICEINSA-N	444.359	1.950	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)Cc3cccnc3)CC2)CC1)[C@@H](F)Br	1836412729	RZKJHFCSUYMUAS-GOSISDBHSA-N	441.345	1.886	50	20	IDGD	
CC[C@H](Br)C(=O)NC1CCN(C2CCN(C(=O)c3[nH]nnc3C)CC2)CC1	1836541982	QEMKLEFBGVZDPN-HNNXBMFYSA-N	441.374	1.472	50	20	IDGD	
CN(C)c1ccc(C(=O)N2CCC(OC3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)cc1	1836717506	FGGVNQIQTVARBK-FQEVSTJZSA-N	437.968	1.965	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)c(C)n1C	1838385719	ZHPIYPVNWFIFLD-PMACEKPBSA-N	446.375	1.948	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)/C=C(\C)NC(C)=O)CC2)CC1	1838721520	SSTGLHOCJLMGDU-QIXNEVBVSA-N	429.945	1.279	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(O)cc3)CCO2)C1	1838971921	ROTDRCKRCJVQDR-APWZRJJASA-N	441.322	1.636	50	20	IDGD	
COC(=O)c1ccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)s1	1839035052	UICDRHHLPPLPMN-MAUKXSAKSA-N	448.900	1.068	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(OC(F)F)cn3)C2)C1	1839142996	IDTSGVIXTLAUJJ-KUHUBIRLSA-N	447.866	1.770	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccnc3SC)C2)C1	1839146876	ZHALLTDTGJDARC-BEFAXECRSA-N	427.954	1.891	50	20	IDGD	
COc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)nc1	1839153024	RUYYRBPCHNFNLY-RBUKOAKNSA-N	446.331	1.397	50	20	IDGD	
Cc1nccnc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2	1839153689	OLCSVPWRYPQKOH-ZWKOTPCHSA-N	431.320	1.091	50	20	IDGD	
COc1cccc2[nH]cc(C(=O)N3CCO[C@]4(COCCN(C(=O)[C@H](F)Cl)C4)C3)c12	1839557862	ZFPRXLYGKIYCNF-FXAWDEMLSA-N	439.871	1.781	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc(C)s3)C2)C1	1839964532	URVLXTQQRYZWNQ-SUMWQHHRSA-N	446.367	1.695	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cc(C)on3)C2)C1	1839967121	BDYTWTOWIZNSIT-CRAIPNDOSA-N	444.326	1.155	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccccc3)C2)C1	1840031968	JDVUUKRWTYZFMG-KXBFYZLASA-N	425.323	1.469	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccccc3Cl)C2)C1	1840154191	OWXOIXYPYBIQTC-QFBILLFUSA-N	431.316	1.664	50	20	IDGD	
CC(C)(C)c1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)[nH]n1	1840189008	RDHLDPHURTYAJI-SFHVURJKSA-N	433.336	1.581	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCCC12CN(C(=O)[C@H](O)C(C)(C)C)C2	1841923887	BJLVRSCCIZAEFA-KBPBESRZSA-N	431.961	1.729	50	20	IDGD	
O=C(/C=C/c1cc(F)c(F)c(F)c1)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843015167	PBMOCRSLDUIBRZ-AATRIKPKSA-N	444.218	1.314	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)[C@@H]1Cc3ccccc3CN1)C2	1843416076	WHLFKOBOMCQNOA-BJRSOBTISA-N	448.527	1.038	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](CC1CC1)C(=O)N1CCCC12CN(C(=O)[C@@H](O)CCl)C2	1846297313	BWXFWWMSFACVIN-CABCVRRESA-N	429.945	1.483	50	20	IDGD	
COc1cc2ncn(CCCC(=O)NNC(=O)c3ccccc3O)c(=O)c2cc1OC	10785148	QWBXMYXDKVFDRS-UHFFFAOYSA-N	426.429	1.361	50	20	IDGD	
COc1ccccc1CCC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	15525911	LEFYURIOEBFWJL-UHFFFAOYSA-N	431.514	1.874	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)c1sc2nc3n(c(=O)c2c1C)CCC3	15668558	LOHPMIKIRLGCBS-UHFFFAOYSA-N	428.470	1.561	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)Cn2nc(-c3ccccc3)oc2=O)c2ccccc2c1=O	16498963	LWPSOGFGHXWRGL-UHFFFAOYSA-N	448.439	1.084	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNS(=O)(=O)c3cccc(S(N)(=O)=O)c3)cc2C1	22410658	IBFGZKWXWBLBBW-JTQLQIEISA-N	429.545	1.144	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)c1ccc2c(c1)C(=O)N(C[C@@H]1CCCO1)C2=O	25628856	LXBHGHCTIFPKOX-INIZCTEOSA-N	425.416	1.604	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NN=Cc2ccc(N3CCOCC3)c(F)c2)ccc1Cl	727257086	UBQPNFMYFZAZNQ-UHFFFAOYSA-N	440.884	1.727	50	20	IDGD	
CC(C)CCn1nc(C(=O)NNC(=S)NCC(=O)NC(C)C)c2ccccc2c1=O	727271152	QXVVNRGYXXHNJU-UHFFFAOYSA-N	432.550	1.076	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)N[C@H](CN2CCN(C)CC2)c2ccccc2)cc1	727946171	SPAHHCFPCAILRF-OAQYLSRUSA-N	441.532	1.393	50	20	IDGD	
CCC(=O)Nc1cccc(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)c1	728214639	CXTIJXUGNGNQOW-UHFFFAOYSA-N	445.545	1.728	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3ccc4nc(O)oc4c3)cc2)CC1	728216114	RCCFFPZGVZBSCZ-UHFFFAOYSA-N	431.474	1.226	50	20	IDGD	
CCOc1ccccc1[C@@H](CC(=O)NNC(=O)c1ccc2c(c1)OCCO2)NC(C)=O	728234243	GCPAJJLUVYTYRZ-QGZVFWFLSA-N	427.457	1.885	50	20	IDGD	
COc1ccccc1/C(C)=C/C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	728344604	XLQOAMZAHMIIFW-FIIODCPWSA-N	426.425	1.629	50	20	IDGD	
O=C(NNC(=O)N1CCC([C@@H](O)c2ccccc2)CC1)C1CCN(c2ncccn2)CC1	728961259	DWYRKVREJGZYFQ-FQEVSTJZSA-N	438.532	1.879	50	20	IDGD	
CC[C@H](NC(=O)NNC(=O)COc1ccc(C)c(C)c1)c1cccc(S(N)(=O)=O)c1	729613065	MYSHWNCZUBRSTC-SFHVURJKSA-N	434.518	1.811	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)CS(=O)(=O)Cc1ccc(Br)cc1	731492219	CKKUWHTYBGXCKZ-UHFFFAOYSA-N	441.303	1.834	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)N1CCCN(S(=O)(=O)c2ccc(F)cc2)CC1	731848245	CXJUOXVCWTZAPM-OAHLLOKOSA-N	428.530	1.104	50	20	IDGD	
CN1CCN(CCCN(C)C(=O)CCC(=O)C(C#N)=C2N(C)c3ccccc3N2C)CC1	731885559	UEEYFGBQQJLFBH-UHFFFAOYSA-N	438.576	1.753	50	20	IDGD	
CCc1ocnc1C(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	739676246	QKQMQAFDXSDDSW-UHFFFAOYSA-N	428.470	1.790	50	20	IDGD	
CC(C)(C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1)c1ccc([N+](=O)[O-])cc1	739681382	XJKUKSAOPPAXQE-UHFFFAOYSA-N	440.865	1.634	50	20	IDGD	
C[C@]1(C2CC2)NC(=O)N(CC(=O)NNC(=O)NCc2cccc(C(F)(F)F)c2)C1=O	742459022	BTKOCUNBJCRHIS-QGZVFWFLSA-N	427.383	1.256	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2ccc(OC)c(Br)c2)c[nH]1	743258488	GKDFVMLZTVARQO-UHFFFAOYSA-N	432.252	1.196	50	20	IDGD	
O=C(CCSc1ccc(F)cc1)NNC(=O)c1ccc(C[C@@H]2CC(=O)NC2=O)cc1	743290662	ILRFLMGNSYUUKD-OAHLLOKOSA-N	429.473	1.974	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)N[C@@H]1CC(=O)N([C@@H]2C[C@@H]2c2ccccc2)C1	743508950	VIWTURGORWRGNF-IIAWOOMASA-N	446.305	1.878	50	20	IDGD	
CN(C)c1ccc(N2CCC(NC(=O)NNC(=O)CNC(=O)c3ccco3)CC2)cc1	743576492	DJAKIGVQZFIHPB-UHFFFAOYSA-N	428.493	1.075	50	20	IDGD	
Cc1ccc(CCC(=O)NCC(=O)NNC(=O)c2cc(Br)ccc2O)cc1	743733573	MGTFQAXDYLJKAX-UHFFFAOYSA-N	434.290	1.973	50	20	IDGD	
C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)OCC(=O)NNC(=O)c1ccc(C#N)cc1	744869118	GQOJVXAALHJNPS-LLVKDONJSA-N	446.803	1.892	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(CCNC(=O)NNC(=O)c2cc3c(s2)CCC3)CC1	744896269	WCIZVUZWXZRIKH-UHFFFAOYSA-N	437.566	1.734	50	20	IDGD	
COC(C)(C)CNC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	745890044	MLAQRJGROHYZBH-UHFFFAOYSA-N	426.520	1.918	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@@H](C)c2nc(C(C)(C)C)no2)c2ccccc2c1=O	745918147	YFWYESNJYUWEQW-NSHDSACASA-N	427.465	1.802	50	20	IDGD	
COC(=O)COc1c(C)cc(C=NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1C	746487035	PBIHCVMLQVZEOT-UHFFFAOYSA-N	447.513	1.869	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)c1cn(-c2ccccc2C(F)(F)F)nn1	746550806	VVPNZZKFFPKQPJ-UHFFFAOYSA-N	429.362	1.938	50	20	IDGD	
CC(C)(C)OC(=O)NC1(CC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)CCC1	746827132	DJHLNLHBMLPDIY-UHFFFAOYSA-N	425.507	1.689	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)Cn1cnc2scc(-c3cccs3)c2c1=O	747322572	BADUUICQDLJOTC-UHFFFAOYSA-N	425.495	1.972	50	20	IDGD	
CSc1nc(C(C)C)nc(C)c1C(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	747344334	CKAXXEPUIFGMGA-UHFFFAOYSA-N	426.502	1.952	50	20	IDGD	
O=C(NCc1cccc(C(F)(F)F)c1)NNS(=O)(=O)c1ccc(-n2cnnn2)cc1	747406440	ARBRGMMEVJOHIZ-UHFFFAOYSA-N	441.395	1.374	50	20	IDGD	
O=C(NNC(=O)c1ccc[nH]1)c1ccc(OS(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1	747663815	ZCROSUUVBRTVLB-UHFFFAOYSA-N	430.398	1.765	50	20	IDGD	
CC(C)Cn1ncc2cc(C(=O)NNC(=O)c3csc(N4CCOCC4)n3)cnc21	748212434	NJCZEXZNISOVAY-UHFFFAOYSA-N	429.506	1.455	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3ncc(C#N)cc3Cl)cc2)CC1	748618751	FMRLGDRXGVLSTG-UHFFFAOYSA-N	434.909	1.300	50	20	IDGD	
O=C(NNC(=S)NC[C@@H]1CCOC1)c1ccccc1NS(=O)(=O)c1cccs1	749643291	AJLSVVYTWIMTRK-LBPRGKRZSA-N	440.572	1.694	50	20	IDGD	
CCCNC(=O)Nc1ccc(CC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1	751295393	YJFMXMWTFMSJLX-UHFFFAOYSA-N	436.472	1.469	50	20	IDGD	
COc1cc(OC)cc(N2C[C@H](C(=O)NNC(=O)COCc3ccccc3)CC2=O)c1	752314788	BMCIRBFIDLFMRI-MRXNPFEDSA-N	427.457	1.421	50	20	IDGD	
O=C(NNC(=O)c1cnccn1)Nc1ccc(-c2csc(N3CCOCC3)n2)cc1	755584567	WYLAEHBPJWITPE-UHFFFAOYSA-N	425.474	1.903	50	20	IDGD	
COC(=O)CCNC(=O)c1ccc(NC(=O)NNC(=O)COc2ccc(C)cc2)cc1	755604077	OIWQQEOMEVMKFM-UHFFFAOYSA-N	428.445	1.520	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)Nc1ccc(C(=O)NCC(F)(F)F)cc1	755690173	FCKPHFULVHLPNX-OAHLLOKOSA-N	438.362	1.971	50	20	IDGD	
COC(=O)CNC(=O)Cc1ccc(NC(=O)NNC(=O)c2ccc3ccccc3n2)cc1	755863530	NUASUBZCRMNZBZ-UHFFFAOYSA-N	435.440	1.533	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)ccc1O)Nc1cc(-n2cnnn2)ccc1F	756335625	JIMFNYLCGSZSRZ-UHFFFAOYSA-N	436.201	1.736	50	20	IDGD	
CNS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2cccc(Br)c2)cc1	756641303	SXKGUZDSHLUJJJ-UHFFFAOYSA-N	427.280	1.824	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2cc(Br)c[nH]2)cc1NS(C)(=O)=O	756781339	ABXXXZQVKRDKKF-UHFFFAOYSA-N	446.283	1.624	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1ccc(Oc2ccc(Cl)cn2)cc1	756791274	RJRBQOGCBCGGSW-SNVBAGLBSA-N	427.870	1.618	50	20	IDGD	
O=C(NNC(=O)c1c[nH]c2ccccc12)Nc1ccccc1OCC(=O)N1CCOCC1	756876210	YQZIQXPSBZQWSP-UHFFFAOYSA-N	437.456	1.872	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1cc(Br)c(F)cc1Cl	757595022	ADRBUTGBWNHYCP-RXMQYKEDSA-N	431.671	1.332	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H](C#N)[C@H](NC(=O)NNC(=O)COc2ccc(C#N)cc2)C1	758752249	MECSLELMWGWWLK-GOEBONIOSA-N	428.449	1.027	50	20	IDGD	
O=C(NCCc1nc(-c2cccc(Cl)c2)no1)NNC(=O)C(=O)Nc1ccccn1	758770110	IKSWTQMXDZBQDH-UHFFFAOYSA-N	429.824	1.297	50	20	IDGD	
CC1CCN(CC(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)CC1	761783887	GMUICDSXHZXHAR-UHFFFAOYSA-N	433.512	1.938	50	20	IDGD	
COCc1nc(OC)c2c(C)c(C(=O)NNc3nccc(N4CCOCC4)n3)sc2n1	762862690	YACAWCGWWJPLMI-UHFFFAOYSA-N	445.505	1.538	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)c2cc(=O)n(-c3ccc(C)cc3)[nH]2)n[nH]1	763165024	IPDQTQQWQAAZKA-UHFFFAOYSA-N	432.440	1.948	50	20	IDGD	
N#Cc1c(Cl)cccc1S(=O)(=O)N1CCN(S(=O)(=O)CBr)CC1	763206947	YUQDCUFJEJBSED-UHFFFAOYSA-N	442.744	1.200	50	20	IDGD	
Cc1cc(Br)ccc1NC(=O)C(=O)NNC(=O)[C@@H]1COc2ccccc2O1	763569792	BRVXIJAROUEIFR-HNNXBMFYSA-N	434.246	1.683	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)c(OC)cc1Cl	763570354	DQAAZTZZSLGRQQ-MRXNPFEDSA-N	435.820	1.283	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc(OC)c1C(C)C	763573209	QHDABJFZWLZVTA-GOSISDBHSA-N	443.456	1.753	50	20	IDGD	
COC(=O)Cc1ccccc1NC(=O)C(=O)NNC(=O)COc1ccc(C(C)(C)C)cc1	763595488	RDZMZFMMOYYOML-UHFFFAOYSA-N	441.484	1.865	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)C(=O)Nc2ccc(-n3nccn3)nc2)c1	763596341	WYDYKMZOBMNKBI-UHFFFAOYSA-N	437.460	1.259	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2ccc3oc(N(C)C)nc3c2)c1	763645648	WXKBNBHHUPCPEZ-UHFFFAOYSA-N	425.445	1.676	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc3c(c2)nc(C2CC2)n3C)cc1	763660097	XCIYYCSOXCGXRS-UHFFFAOYSA-N	437.456	1.624	50	20	IDGD	
Cc1cc(C)c(NC(=O)C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c(C)c1	763718228	JCQSJKHBUZNIDL-UHFFFAOYSA-N	432.502	1.262	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)C(=O)Nc1cccnc1-n1cccn1	763848581	DDQUPFLWQWIFKN-HNNXBMFYSA-N	444.451	1.974	50	20	IDGD	
COC(=O)CCc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)cc1	763852676	XHDBLMIMJYIQGA-INIZCTEOSA-N	441.484	1.962	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccc2oc(N(C)C)nc2c1	763864346	BCZACKBKFZPRLV-LLVKDONJSA-N	429.408	1.586	50	20	IDGD	
Cc1cc(S(C)(=O)=O)ccc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccc(F)cc1	763867210	TUJZUSJBAKHANU-LBPRGKRZSA-N	437.449	1.091	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(F)cc2OCC#N)cc1	763878313	OSQLISUFAJBLAN-CYBMUJFWSA-N	442.403	1.484	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(C(=O)OC)c2C)cc1OC	763913044	XEWRASSHGOMXBV-UHFFFAOYSA-N	443.456	1.979	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)Nc1ccc(C(=O)N2CCOCC2)cc1	763925624	LNDYWQKSCLNWOE-UHFFFAOYSA-N	430.486	1.810	50	20	IDGD	
O=C(NNC(=O)c1cnccn1)C(=O)Nc1ccc(-c2n[nH]c(-c3ccccc3)n2)cc1	764030754	GMLTXXPBWPSYPV-UHFFFAOYSA-N	428.412	1.328	50	20	IDGD	
O=C(NNC(=O)c1cccc(C(F)(F)F)c1)C(=O)Nc1cccc(N2CCOCC2)c1	764038010	YDTZUNFXGXTZLX-UHFFFAOYSA-N	436.390	1.942	50	20	IDGD	
COC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(C)cc3)[nH]n2)c1C	764111680	OTRZVPVNPLGUGT-UHFFFAOYSA-N	435.440	1.880	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(N(C)C(=O)OC)cc2)o1	764138834	KVVDJJUUCAHKKM-UHFFFAOYSA-N	445.476	1.724	50	20	IDGD	
CC(C)CCC(=O)NNC(=O)C(=O)Nc1ccc(C(=O)N(C)[C@@H]2CCCN(C)C2)cc1	764203131	KEFUTCRDZCSPMI-GOSISDBHSA-N	431.537	1.375	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1ccc2c(c1)OC1(CCCCC1)O2	764276867	DFGMALLBQMVVDG-UHFFFAOYSA-N	441.440	1.989	50	20	IDGD	
COCC(=O)NNC(=O)C(=O)Nc1ccc(N2CCC(OC)CC2)c(C(F)(F)F)c1	764299347	CZWQDCQZMFZITI-UHFFFAOYSA-N	432.399	1.053	50	20	IDGD	
O=C(CCCc1cccs1)NNC(=O)C(=O)Nc1cccc(Cn2cccnc2=O)c1	764340805	HARWFKUGBNTPCN-UHFFFAOYSA-N	439.497	1.462	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2ccccc2O[C@H](C)C#N)n[nH]1	764378273	XNUDCVJODLRGLU-CYBMUJFWSA-N	448.439	1.776	50	20	IDGD	
CNC(=O)c1ccc(C)c(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(C)c(C)c3)[nH]n2)c1	764388430	RHBFDICHNTYWCT-UHFFFAOYSA-N	448.483	1.761	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)C(=O)Nc1cnn(-c2ccc(C(F)(F)F)cc2)c1	764389798	ZUZSELQVMCBTQQ-UHFFFAOYSA-N	432.362	1.994	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)C(=O)Nc1cccc(N2CCCCC2=O)c1	764399928	AVCVJWKFHBBOMM-UHFFFAOYSA-N	442.497	1.787	50	20	IDGD	
Cc1noc2ncc(C(=O)NNC(=O)CN3CCN(Cc4ccccc4Cl)CC3)cc12	765754042	HINQGIISZGKWPP-UHFFFAOYSA-N	442.907	1.763	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H](NC(C)=O)C2CCCC2)c1	766064038	JEDMFDRPVXBXLS-SFHVURJKSA-N	438.550	1.173	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cccc(Br)c2)n(-c2ncccn2)n1	768238956	IJWHKQXETZCTRE-UHFFFAOYSA-N	444.249	1.133	50	20	IDGD	
COc1ccc(C(=O)N(C)C)cc1NC(=O)NNc1c(OC)cccc1S(C)(=O)=O	769227745	JRNBJVCMKYOQBO-UHFFFAOYSA-N	436.490	1.958	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)N2CCCC[C@H]2CS(N)(=O)=O)N(C)c2ccccc21	769581808	KIAHWEADYPPQDF-HNNXBMFYSA-N	445.545	1.327	50	20	IDGD	
Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	769886946	HVBXUAPCPKQVDL-MRXNPFEDSA-N	443.412	1.664	50	20	IDGD	
CNC(=O)Cn1nc(NC(=O)NNc2ccccc2S(=O)(=O)NC(C)(C)C)cc1C	770082339	SLGQGAVLLRMPHC-UHFFFAOYSA-N	437.526	1.163	50	20	IDGD	
CC(C)[C@@H](NC(=O)C12CC3CC(CC(C3)C1)C2)C(=O)NNc1nc(O)c2cnn(C)c2n1	770993032	ZHGFPMUOGLRBFY-CPUAJEGOSA-N	441.536	1.869	50	20	IDGD	
CCOc1ccc(C(=O)NCC(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)cc1	771009664	RYGIWPLXGOWANQ-UHFFFAOYSA-N	427.465	1.559	50	20	IDGD	
CCC[C@H](NC(=O)Cc1ccccc1)C(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772182353	HRACHCKTTRKITR-SFHVURJKSA-N	444.919	1.631	50	20	IDGD	
CC(C)(C)OC(=O)N1CCSC[C@@H]1CC(=O)NNc1nccc(N2CCOCC2)n1	772476322	JFUFDPQBKYQQJD-AWEZNQCLSA-N	438.554	1.499	50	20	IDGD	
Cc1cc(S(=O)(=O)NCCNC(=O)NNc2ccccc2S(C)(=O)=O)c(C)s1	772625078	MNSJNNXVGMAKAS-UHFFFAOYSA-N	446.576	1.373	50	20	IDGD	
O=C(NNC(=O)N1CCC(C(=O)C(F)(F)F)CC1)c1csc(N2CCOCC2)n1	773132662	SBVPDGLTIHUKQH-UHFFFAOYSA-N	435.428	1.178	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)ncc1Br	773687237	XMZDWVAPAMCHHE-UHFFFAOYSA-N	431.250	1.129	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1nn(C(C)(C)C)cc1C#N	774009406	PASOJDYEMVKLAQ-LLVKDONJSA-N	432.868	1.717	50	20	IDGD	
O=C(COC(=O)[C@H]1CC(=O)N(Cc2ccccc2)C1)NNC(=O)c1cccc(Cl)c1	775494899	QMCNZWLVCAUHIK-INIZCTEOSA-N	429.860	1.693	50	20	IDGD	
CCOC(=O)c1c(NC(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)c(C#N)cn1CCOC	775765447	KWPXMLBVXVJKBT-INIZCTEOSA-N	441.444	1.339	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1nnc(-c2c(F)cccc2Cl)s1	775903133	MNKSCMANHQRHGY-LURJTMIESA-N	436.878	1.088	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)N[C@H]2CCO[C@]3(CCS(=O)(=O)C3)C2)c1C	776075502	BEHRVZVRPYOXLS-GQIGUUNPSA-N	439.534	1.137	50	20	IDGD	
CCn1c(=O)nc(O)c2c(C(=O)NNc3cccc(S(C)(=O)=O)c3)cc(C3CC3)nc21	776538009	FXHIJAUJFLHJOU-UHFFFAOYSA-N	443.485	1.555	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)C(=O)Nc2ccc(C(=O)N3CCOCC3)c(F)c2)c1	778697511	OBEUQLOEQVWFQY-UHFFFAOYSA-N	444.419	1.167	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)[C@@H](O)[C@H](O)c1nc2ccccc2[nH]1	779581988	JPGQOYDRJQIXKR-HOTGVXAUSA-N	437.481	1.850	50	20	IDGD	
COC(=O)CC(C)(C)CC(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	780647113	VMCAFHLOVQUUGD-UHFFFAOYSA-N	438.956	1.584	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)[C@H]2C[C@]23CCN(C(=O)OC(C)(C)C)C3)cc1	781285853	RSTBFSBHPKQRSM-ZHRRBRCNSA-N	431.489	1.946	50	20	IDGD	
CCc1c(C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)nnn1Cc1ccc(F)cc1	782542814	YIYWKKUPKHLWLP-UHFFFAOYSA-N	445.476	1.506	50	20	IDGD	
COCC(=O)N1CCc2cc(NC(=O)C(=O)NNc3nc4ccccc4s3)ccc21	782813515	LEXPSEIUCFMZJW-UHFFFAOYSA-N	425.470	1.914	50	20	IDGD	
Cn1cc(NC(=O)C(=O)NNc2ccc(Cl)cc2[N+](=O)[O-])cc(Br)c1=O	783291603	NKGOHVRNJOJEJL-UHFFFAOYSA-N	444.629	1.791	50	20	IDGD	
Cc1cc(OCc2ccccc2)ccc1NC(=O)C(=O)NN[C@]1(C)CCS(=O)(=O)C1	783428819	XPKGGZDVPXEAQG-OAQYLSRUSA-N	431.514	1.711	50	20	IDGD	
Cc1ccccc1-n1nc(C(C)(C)C)cc1NC(=O)C(=O)NNC(=O)C(=O)N1CCCC1	784003541	ZMFRHQTWRTXKAQ-UHFFFAOYSA-N	440.504	1.187	50	20	IDGD	
O=C(CCN1CCOCC1)Nc1cc(NC(=O)C(=O)NNc2ccccc2)ccc1F	784769727	NCPMTZFPVPSYHX-UHFFFAOYSA-N	429.452	1.568	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNc2ccc(C(F)(F)F)nn2)c(OC(F)F)c1	784886564	VGXCXTMFHVRRFR-UHFFFAOYSA-N	449.292	1.965	50	20	IDGD	
O=C(NNc1c(F)cc(C(=O)NC2CC2)cc1F)C(=O)Nc1ccccc1-n1cncn1	785100068	OKSMDJOVTDGMFV-UHFFFAOYSA-N	441.398	1.520	50	20	IDGD	
Cc1ccccc1NS(=O)(=O)c1ccc(C(=O)NNC(=O)N2CCN(C)CC2)cc1	788164384	AIWSGDMCCJXYIJ-UHFFFAOYSA-N	431.518	1.398	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NN=Cc1ccc2c(c1)NC(=O)CO2	788720340	LLFIQHQHSXHBKP-UHFFFAOYSA-N	441.919	1.939	50	20	IDGD	
CSSCCNS(=O)(=O)c1ccc(C)c(S(=O)(=O)N2CCOCC2)c1	790350197	QCAKIQGGQMLDPF-UHFFFAOYSA-N	426.607	1.305	50	20	IDGD	
COc1cc(C(=O)NNc2cccc(F)c2[N+](=O)[O-])cc(NS(C)(=O)=O)c1OC	790585235	FLOFEHOFDWSTFP-UHFFFAOYSA-N	428.398	1.880	50	20	IDGD	
CCS(=O)(=O)c1ccc([C@@H](C)NC(=O)NNC(=O)COc2ccccc2OC)cc1	790656683	PEGYUJAEWLQZMM-CQSZACIVSA-N	435.502	1.959	50	20	IDGD	
Cn1ccnc(NNC(=O)C(=O)Nc2c3c(nn2-c2ccc(Cl)cc2)CCC3)c1=O	792292681	MXIFTUAOTCOAQS-UHFFFAOYSA-N	427.852	1.190	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCc2ccc3ncccc3c2)cc1	792322842	VDLKOIGODVLODX-UHFFFAOYSA-N	441.513	1.694	50	20	IDGD	
CC[C@@H](C)CC[C@H](O)CC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	792774055	MOMGWRHTZITSJT-WBVHZDCISA-N	425.551	1.809	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc3ccn(C)c(=O)c3c2)c2ccccc2n1	793023615	SOEBUDACCUAQGJ-UHFFFAOYSA-N	429.436	1.795	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(CC(=O)NNC(=O)c2cccc(Br)c2)cc1	793577285	BVZNCBOFRPPVGH-UHFFFAOYSA-N	440.319	1.703	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)CNS(=O)(=O)c2c[nH]c3ncccc23)cc1	794788965	XXSTWJVHZZKDFE-UHFFFAOYSA-N	433.515	1.089	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H]2CN(CC(=O)NNC(=O)c3cccc(C#N)c3)CC[C@@H]21	795127505	FKJGYSKTDJKLLV-MSOLQXFVSA-N	427.505	1.651	50	20	IDGD	
COC(=O)c1cc(Br)ccc1NC(=O)C(=O)NNC(=O)c1cccc(C)n1	797370614	ILBLBJHAJJEBOG-UHFFFAOYSA-N	435.234	1.339	50	20	IDGD	
CO[C@H](C(=O)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1)c1cnn(C)c1	798940451	IIIPFLWNLPUKTB-VXKWHMMOSA-N	433.512	1.882	50	20	IDGD	
CC1=C(C(=O)NNc2ccccc2S(=O)(=O)NC(C)(C)C)[C@H](C)n2ncnc2N1C	798982241	GRQVEKHDUUPHHE-ZDUSSCGKSA-N	433.538	1.783	50	20	IDGD	
CSC[C@@H](C)C(=O)N1CCC(C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)CC1	799298045	SVZVZTVYZQKPKK-KGLIPLIRSA-N	425.526	1.978	50	20	IDGD	
CCc1cccc(C)c1NNC(=O)NCCS(=O)(=O)N1CCN(c2ccccn2)CC1	799544351	NEFMSYHTVCMNDY-UHFFFAOYSA-N	446.577	1.731	50	20	IDGD	
Cc1c([N+](=O)[O-])ccc(F)c1NC(=O)C(=O)NNC(=O)[C@H]1OCC[C@H]1c1ccccc1	800635253	XEEYEGNYLMUYRZ-GUYCJALGSA-N	430.392	1.701	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)CN2C(=O)N[C@](C)(c3ccccc3OC)C2=O)cc1	802056464	PCYNNFFQRPUCOM-OAQYLSRUSA-N	441.444	1.324	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(OC(F)F)cc2F)cc1	802565900	PYQCNUJXCNXOEN-UHFFFAOYSA-N	427.335	1.601	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)CCc2c(C)nc3c4cccnc4nn3c2C)c1	803205349	USHWTFYQKRJQPG-UHFFFAOYSA-N	446.471	1.642	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c(C)c1OC	804146427	UCXPKUGSVPMOLG-UHFFFAOYSA-N	447.513	1.872	50	20	IDGD	
Cc1cc([N+](=O)[O-])ccc1NNC(=O)CNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	805384145	DCOYLLLNPAKSGZ-UHFFFAOYSA-N	435.462	1.027	50	20	IDGD	
CC(C)[C@H](NC(=O)NNC(=O)COc1ccc(Br)cc1)c1nncn1C	805767618	YQKIUVCPNCUYKY-AWEZNQCLSA-N	425.287	1.684	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)Nc1cc(F)c(F)cc1N1CCOCC1	806712340	VCVWIVFKKHOTFK-SFHVURJKSA-N	434.399	1.794	50	20	IDGD	
O=C(NNC(=O)c1cc(Cl)ccc1O)C(=O)Nc1ccc(F)c(N2CCCNC2=O)c1	806975699	LMTRTCLVOPKNKW-UHFFFAOYSA-N	449.826	1.504	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)NCc2cc(C)nn2C)c2ccccc2c1=O	807221845	HFHFMHNTAIFMCL-UHFFFAOYSA-N	425.493	1.773	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCc2ccnc(OC(F)F)c2)nc1	807255724	LTMBZSJKPFHKHX-UHFFFAOYSA-N	444.464	1.935	50	20	IDGD	
CS(=O)(=O)c1cc(Br)ccc1NC(=O)C(=O)NNc1ncccc1F	807302089	WPDZPUYFLPZVDH-UHFFFAOYSA-N	431.243	1.469	50	20	IDGD	
Cc1cc(Cl)ccc1S(=O)(=O)NCCNC(=O)NNC(=O)Cc1ccccc1F	807547553	IKKZYPBSGHSZGK-UHFFFAOYSA-N	442.900	1.639	50	20	IDGD	
C[C@H](CN1CCOCC1)C(=O)NN=C1CCN(C(=O)OC(C)(C)C)C[C@H]1[C@@H]1CCOC1	812225347	XJKMWRHDWKHTRC-KURKYZTESA-N	438.569	1.720	50	20	IDGD	
CN(C)c1cc(Br)cc(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c1	814368502	FWMIHFMBWOAVMZ-UHFFFAOYSA-N	430.266	1.566	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCc2nncn2C1)C(=O)Nc1cccc(C#Cc2ccccc2)c1	815691651	WYSAVHVLTGRELQ-SFHVURJKSA-N	428.452	1.026	50	20	IDGD	
CCn1cc(-c2nn(C)cc2C(=O)NNC(=O)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)cn1	816509190	GZZKBBDAQKZHSQ-CQSZACIVSA-N	445.524	1.712	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)CN2C(=O)N[C@@](C)(c3ccc(F)cc3)C2=O)cc1C	818485683	ZZXXIRRHAUKBFG-QFIPXVFZSA-N	442.447	1.436	50	20	IDGD	
CC(C)[C@H](NS(=O)(=O)c1ccc2c(c1)OCCCO2)C(=O)NNC(=O)CC1CC1	819123121	QAGYKWAVFULKEY-SFHVURJKSA-N	425.507	1.098	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc2c(c1)nc(CCC(=O)NNC(=O)CC1CC1)n2C	819125895	DYXNUZDTJPRZMW-UHFFFAOYSA-N	435.550	1.484	50	20	IDGD	
CSCC[C@H](NC(=O)c1cccc(C)c1)C(=O)NNC(=O)[C@H]1COc2ccccc2O1	859420412	XRKFRRDZYNHLNR-QFBILLFUSA-N	443.525	1.834	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)c1cc(S(N)(=O)=O)ccc1F	913036864	DKKBXAOSWNMOQG-UHFFFAOYSA-N	434.474	1.980	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2ccc(=O)n(-c3ccc(F)cc3)n2)c2ccccc2c1=O	914846514	MZOGNBQFMBJJSO-UHFFFAOYSA-N	448.414	1.176	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)NCc2cccc(NS(C)(=O)=O)c2)c1C	916246330	DQAVHKREPSWMJP-OAHLLOKOSA-N	434.518	1.973	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)NC[C@@H](C(C)C)N2CCN(C)CC2)cc1	916258259	PVPYMBZZMWHTIJ-XLIONFOSSA-N	435.569	1.455	50	20	IDGD	
COc1ccc(C(=O)NN=Cc2c(C)nn([C@@H]3CCS(=O)(=O)C3)c2Cl)cc1OC	916289130	ZZXHYVNUJIPRNC-CYBMUJFWSA-N	440.909	1.986	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)c1ccc(OCC(=O)NC2CC2)cc1	916489988	UNFMNGDWKFQOBF-CYBMUJFWSA-N	441.444	1.957	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCCCN(C)C(=O)OC(C)(C)C)nc1	916579977	SATDCHWDBJSEJV-UHFFFAOYSA-N	444.558	1.651	50	20	IDGD	
CC[C@H]1CCCC[C@H]1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	916634849	RKICFJKDQULNGO-MAUKXSAKSA-N	438.550	1.620	50	20	IDGD	
COc1cc(CNC(=O)NNC(=O)Cc2c[nH]c3ccccc23)ccc1OCC(N)=O	916640714	JHPPPWGJAGCKQA-UHFFFAOYSA-N	425.445	1.114	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2cccnc2)nc2ccccc12)N[C@H]1CCS(=O)(=O)C1	919886608	VIDQUPCFZSVUMM-AWEZNQCLSA-N	425.470	1.428	50	20	IDGD	
CCNC(=O)CN1CCCN(C(=O)/C(C#N)=C/c2cc(C)n([C@@H](C)COC)c2C)CC1	920455980	KKMSHZFLDLAZPN-LANLRWRYSA-N	429.565	1.890	50	20	IDGD	
Cc1ccc(N(C)S(=O)(=O)c2cccc(C(=O)NNC(=O)CN3CCCC3=O)c2)cc1	920826294	KQACKNDQMQAWHZ-UHFFFAOYSA-N	444.513	1.204	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCn3c(nnc3C3CCCC3)C2)cc1OC	1319374444	IOORKSSQLIMDBG-UHFFFAOYSA-N	428.493	1.230	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)NCc2cnn(CC(F)(F)F)c2)CC1	1319733886	BMESPOYLIWONQN-UHFFFAOYSA-N	448.446	1.923	50	20	IDGD	
COc1ccccc1-n1c(C)nnc1SCC(=O)NNC(=O)c1n[nH]c2c1CCCC2	1337241980	GEYUQBRGRFNAOZ-UHFFFAOYSA-N	441.517	1.740	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1)C(=O)N1CCCC[C@H]1C	1339212072	IOIZXLJKOHMOGL-HUUCEWRRSA-N	439.557	1.753	50	20	IDGD	
Cc1cc(C(N)=O)cc(C)c1C(=O)N1CC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1779012581	YXHUAMSDQDHIQS-IBGZPJMESA-N	428.316	1.650	50	20	IDGD	
Cc1cccc(C)c1SCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1779285042	DYIKFOVSLPTVFX-UZLBHIALSA-N	426.966	1.825	50	20	IDGD	
COc1ccc2[nH]cc(C(=O)N3CCO[C@]4(CCN(C(=O)CO[Si](C)(C)C)C4)C3)c2n1	1779297898	BTVNNFFQGCNIAN-NRFANRHFSA-N	446.580	1.867	50	20	IDGD	
CCc1cc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](Br)CC)CCO3)n(C)n1	1779625735	BOVJZELXGAWJBV-KBXCAEBGSA-N	427.343	1.600	50	20	IDGD	
CSc1ncccc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2	1779911027	LFWVUBZWBSXDBF-QMTMVMCOSA-N	427.954	1.531	50	20	IDGD	
O=C(Cc1cc2cccnc2cc1F)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1781176930	DHCPPSUPYOXCBQ-GHTZIAJQSA-N	435.883	1.346	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)N1CCO[C@]2(CCN(C(=O)[C@@](C)(Cl)CCl)C2)C1	1781231780	FHICZSDNDQPJPU-ZWKOTPCHSA-N	438.352	1.577	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cccn3nccc23)C1	1781297766	LBPRPESGBCENTG-HGHGUNKESA-N	434.924	1.716	50	20	IDGD	
O=C(c1ccc2ncncc2c1)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781332349	XQIMPSISAODGOI-QAPCUYQASA-N	437.269	1.764	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(CCN(C(=O)c3ccc([N+](=O)[O-])cc3F)C2)C1	1781552324	ZPTUAJZZARIYCP-KRWDZBQOSA-N	444.257	1.962	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H]1CCc3nc[nH]c3C1)C2	1782179248	WDMTZWFLCDMKIR-GEPFMOHWSA-N	438.956	1.282	50	20	IDGD	
O=C(Cc1ccc(O)cn1)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Br)C2	1782634020	DUOPZGDUPJKWGQ-QGPMSJSTSA-N	444.301	1.534	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)[C@@H](C)Cn3cccn3)CCO2)C1	1783342613	CLBRZAFODYDQOR-MPGHIAIKSA-N	427.343	1.523	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cc4cccnn4n3)CCO2)C1	1783353716	ZOIZBEWGAGXTNZ-RDTXWAMCSA-N	436.310	1.346	50	20	IDGD	
CCOc1ncccc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CO[Si](C)(C)C)C[C@@H]21	1783391649	QHZALDJQJKRAQD-SZMVWBNQSA-N	435.597	1.925	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H]2[C@@H](C1)[C@@H]2C(=O)N1CC[C@]2(CN(C(=O)[C@H](F)Cl)CCO2)C1	1783502192	MXPDOFWFPXGDLF-MMAYUGFLSA-N	445.919	1.464	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)c1ccccc1Cl)CCO2	1783539455	JHATWVIGELCQHS-WBHUJUFNSA-N	445.741	1.987	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(OC(F)F)cn3)CCO2)C1	1783873406	OIFWDBYQRLHKAT-FZKQIMNGSA-N	433.839	1.380	50	20	IDGD	
CC[C@H](O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C[C@@H]21	1783961001	JZTWNLVQRYYBRU-KNTDACPZSA-N	433.455	1.622	50	20	IDGD	
CC(=O)N/C(C)=C/C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]2C1	1783972386	KNHJNDLVTQYUMB-GKVARZMTSA-N	430.343	1.037	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21)[C@@H]1CC(=O)N(C2CCCC2)C1	1784967871	PJJUNCWWKHAOID-XIZOUUALSA-N	429.920	1.292	50	20	IDGD	
O=C(c1ccc(F)c(C(F)(F)F)c1)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1785207882	HFUMOIPVQGVHCH-RHSMWYFYSA-N	438.805	1.888	50	20	IDGD	
Cc1ccc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Br)C[C@@H]32)cn1	1785399669	IDMZWGURYFTBBI-JKQORVJESA-N	428.302	1.603	50	20	IDGD	
C[C@@H](NC(=O)c1ccccc1)C(=O)N1CC[C@@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1785553277	RHZWMSYSLFRBEE-OPAMFIHVSA-N	435.952	1.900	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccco3)[C@H]2C1	1785900183	CLHOBFUIHRIIBW-RBOWNIJDSA-N	427.461	1.007	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(CO)c(F)c3)C[C@@H]21	1786408097	HSTDFQQWUBXOHZ-ZOBUZTSGSA-N	443.313	1.696	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3[nH]nc4ccncc34)[C@H]2C1	1787341163	LXMZGVNGVVGFDE-UHXUCMFUSA-N	436.310	1.335	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccncc3F)[C@H]2C1	1787757281	KBLDIIFMMUXENY-PCBIJLKTSA-N	428.302	1.988	50	20	IDGD	
COC(=O)Nc1cccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Cl)C[C@@H]32)c1	1789981742	SBDIAURLYYOIIT-TUUVXOQKSA-N	427.860	1.993	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc[n+]([O-])cc3)C[C@@H]21	1790960341	BVJJYGQTVAWOCP-VGWMRTNUSA-N	426.311	1.087	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CCc4nc[nH]c4C3)C[C@@H]21	1791064647	BIPGNNSYXUCPHB-QDEPRCCBSA-N	439.354	1.278	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3ccc(F)cc3)[C@H]2C1	1791099522	BNTLUYNKIORMSW-IHPCNDPISA-N	448.539	1.111	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)n3cc(C)cn3)[C@H]2C1	1791598996	GCSQYKNMTTYJBE-VIQHNZTISA-N	441.370	1.906	50	20	IDGD	
COC(=O)C12CCC(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)[C@@H](O)CCl)(CC1)CC2	1793111540	NRGQXXQCXRLHTC-FWBCYNTJSA-N	426.941	1.738	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnco1)C2	1793878364	XMPUQDIPSPTJNV-XFMPKHEZSA-N	442.900	1.010	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1ccc(F)cc1Cl)c1ccc(B(O)O)cc1	1793987932	JIEGUEYZAXLYLI-REPLKXPHSA-N	444.699	1.653	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1CCc2sccc2C1	1794163587	HMPKQUUGIDZSKX-BCDXTJNWSA-N	447.605	1.117	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CO[Si](C)(C)C)C3)n1	1794280422	LIQTWMUEIZXQFG-CCWDJLKJSA-N	434.569	1.095	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)c1cc2c(Cl)cncc2s1	1795921452	JSMJFCPYDWHBEZ-SKILGCBUSA-N	444.340	1.753	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)c1cc(Cl)c(F)cc1F	1796189451	OUDKUGQFNGRHIF-QDMKHBRRSA-N	448.662	1.864	50	20	IDGD	
C[C@H](CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)Oc1ccccc1	1796193055	KIVTZMPJOKNNJU-RZXSNQJFSA-N	436.317	1.476	50	20	IDGD	
CC[C@@H](NC(N)=O)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C(C#N)=C/c1ccc(F)cc1F)C2	1796761778	DYZYEQHHXMAAJG-HDAOGJMZSA-N	445.470	1.957	50	20	IDGD	
C[C@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](F)Br)C2)[C@@H]1SC(=N)NC1=O	1796879383	NHBWQXDILBULPL-OJHQEIPXSA-N	435.319	1.118	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc2cc(O)ccc2n1)c1cccc(B(O)O)c1	1797377893	JLBGANPNKCMEQV-REPLKXPHSA-N	445.284	1.186	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CS[C@@H]1CCCCO1)C2	1797956879	IZEQFAKUZXMTIU-WTLGNFPFSA-N	430.643	1.687	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(F)cc([N+](=O)[O-])c1	1799631734	OEUDSOIASNMUJG-ADGXKJENSA-N	444.257	1.721	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2nn[nH]c2c1	1800144802	XSHUTXWZUGIPJF-ZWUHOBOKSA-N	436.310	1.335	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3cnccc3[nH]1)C2	1800641551	DSAYGZKUHUCODL-UMPJEAMMSA-N	435.322	1.940	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c(c1)OCO3)C2	1800757229	JYEBJFPGCSNGRD-VFFTVRQLSA-N	425.279	1.402	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnccc1N(C)C)C2	1800757758	KBCBGVIUMXFPSE-NFFDBFGFSA-N	425.327	1.134	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc([N+](=O)[O-])c3c1OCO3)C2	1802278870	BRDSLOCZSYQJTL-GFQSEFKGSA-N	439.852	1.829	50	20	IDGD	
C[C@H](Nc1cccnc1)C(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]1c1cccnc1	1803138327	JOTLUOFRZIIVFD-QNDJGXFYSA-N	431.924	1.583	50	20	IDGD	
Cc1ncc(/C=C/C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)s1	1803187540	QQDYFEOIUBSCDH-UUOOTRITSA-N	425.319	1.097	50	20	IDGD	
N#Cc1ccc(CC(=O)N2CCCC3(CCN(C(=O)c4cccc(B(O)O)c4)CC3)C2)cc1	1804943027	VTZREFHOIZUGDA-UHFFFAOYSA-N	445.328	1.326	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC2(CCCN(C(=O)[C@@H](O)C(C)(C)C)C2)CC1	1805442355	JCUIDEDRRCTPHO-OAKZWBAKSA-N	445.564	1.759	50	20	IDGD	
CN1C(=O)CC[C@H]1C(=O)N1CC[C@H](CNC(=O)CCBr)[C@@H]1c1cccnc1	1806343930	LKHFKDBYGZNXSS-VKJFTORMSA-N	437.338	1.493	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)NC[C@@H]1CCN(C(=O)[C@@](C)(Cl)CCl)[C@H]1c1cccnc1	1808231657	IEBMLYZMHRIIHE-XLPNERPQSA-N	444.363	1.771	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2cc(=O)n3[nH]cnc3n2)[C@H]1c1cccnc1	1808260837	YNVMZAAFVJXRSS-ZQIUZPCESA-N	443.895	1.150	50	20	IDGD	
C[C@H](NC(=O)c1cnccn1)C(=O)N1CC[C@H](CNC(=O)[C@H](F)Cl)[C@H]1c1cccnc1	1808313217	BRVROWUTEOCUFE-JFOHDYCDSA-N	448.886	1.230	50	20	IDGD	
Cc1ccoc1C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1808494430	PMBCMZKAYYHYOP-ICSRJNTNSA-N	433.273	1.296	50	20	IDGD	
C[C@@H]1CCC[C@@H]1C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1809662021	AWOJWBNGKDVTCY-ONZODILHSA-N	429.565	1.897	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)c1n[nH]c2ccccc12	1809822860	TXQVTNLAPXJXOW-YJLNNSPDSA-N	427.892	1.877	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)[C@H]2CCNC(=O)C2)[C@H]1c1cccnc1	1812868068	RPRUHLVKMPVLQD-HPZZRFSDSA-N	437.338	1.397	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@H]1c1cccnc1)[C@@H]1[C@H]2COC[C@H]21	1813659494	MNXKYQHZCYFIHT-DERJNBNXSA-N	426.286	1.670	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(F)c1)CC2)c1cccc(B(O)O)c1	1815361181	ZOZQCELTXUVYTQ-INIZCTEOSA-N	439.277	1.502	50	20	IDGD	
Cc1cc(C(=O)NCC(=O)N[C@H]2CCc3nc(NC(=O)[C@@H](F)Cl)sc3C2)no1	1817125162	GKEVAGDWVAQZTM-ISVAXAHUSA-N	429.861	1.316	50	20	IDGD	
Cc1ccc(O)c(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)c1	1817472582	NSMBHTFCZMDHKW-IBGZPJMESA-N	448.288	1.723	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1)[C@H]1ON=C(c2ccccc2)O1	1819296594	VISWEHQETHBJAF-AUSJPIAWSA-N	447.879	1.736	50	20	IDGD	
C[C@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)CCc3nc(N)n[nH]3)sc2C1	1819561991	VAXWRNUYCNLWBQ-YUMQZZPRSA-N	442.343	1.172	50	20	IDGD	
C[Si](C)(C)OCC(=O)Nc1cc([C@H]2CCCCN2C(=O)CCS(C)(=O)=O)[nH]n1	1819597124	IGKFINKMMXUBFQ-CQSZACIVSA-N	430.603	1.688	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)C(Cl)Cl	1822417926	JDLJMLLVGPHHIN-ZDUSSCGKSA-N	425.081	1.199	50	20	IDGD	
COc1ccnc(C(=O)N2CCC([C@H]3CCCCN3C(=O)[C@H](O)CCl)CC2)c1OC	1824184841	RYWHYVBGXCNBJM-HZPDHXFCSA-N	439.940	1.932	50	20	IDGD	
CC(=O)N[C@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H](O)CCl)CC1)C(C)(C)C	1824359055	YHZHQWUZXJYYAN-KZNAEPCWSA-N	429.989	1.757	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC([C@H]2CCCCN2C(=O)C[C@H]2NC(=O)NC2=O)CC1	1825075471	ZWJMIQNQVLVOKX-HZPDHXFCSA-N	438.601	1.056	50	20	IDGD	
O=C(CN1CCCCC1=O)Nc1nc2c(s1)C[C@H](NC(=O)CCBr)CC2	1825860658	NOAJVXQACLLAER-LLVKDONJSA-N	443.367	1.853	50	20	IDGD	
C[C@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)CN3CCCCC3=O)sc2C1	1825868009	NCIWRIJBLKVLNF-QWRGUYRKSA-N	443.367	1.851	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1nc3ccccn3n1)CC2	1825998856	NJOKJPSINKGZMC-GHMZBOCLSA-N	434.909	1.665	50	20	IDGD	
CC(=O)N1CCCC[C@H]1C1CCN(C(=O)CN(C)NC(=O)NCc2ccccc2)CC1	1826589900	BLGVBLNZYZJDRB-NRFANRHFSA-N	429.565	1.972	50	20	IDGD	
Cc1cccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)n1	1827056357	SVYHONLCRIBFLF-JOCHJYFZSA-N	435.333	1.617	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2nccnc2C(N)=O)CC1	1829510179	GBOVOCPLTXXKQG-INIZCTEOSA-N	447.612	1.660	50	20	IDGD	
C[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1)C1(O)CCC1	1829743462	JVFUFIPZRDQLGQ-OLMNPRSZSA-N	437.364	1.230	50	20	IDGD	
Cc1ccn(C)c1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)CBr)CCO2	1830542762	DPNKNMVPKZHYIQ-BEFAXECRSA-N	442.354	1.435	50	20	IDGD	
O=C(Cc1c(F)cccc1Cl)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1830720000	QQOUPWCRBRSVHV-APWZRJJASA-N	449.306	1.078	50	20	IDGD	
COC[C@H](NC(C)=O)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H](C)Br)CC1	1831655349	OCZPCBXKSCARGX-XOKHGSTOSA-N	446.386	1.541	50	20	IDGD	
Cc1onc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)c1C	1831981933	KCLBEMPTWXBGIE-ZWKOTPCHSA-N	434.320	1.598	50	20	IDGD	
Cc1ccc(CCC(=O)N2CCO[C@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)nc1	1832995672	SAGNWMVJWWPHCR-LJQANCHMSA-N	430.332	1.583	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3ccc(Cl)nc3)CC2)CC1)[C@H](O)CCl	1833306862	IRRYYPWWBWAFAH-MRXNPFEDSA-N	429.348	1.520	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCC(N2CCC(NC(=O)CN3CCOC3=O)CC2)CC1	1833388119	QCKLWGGNTGIRIO-LJQANCHMSA-N	449.379	1.247	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)c3nc[nH]c3[N+](=O)[O-])CC2)CC1	1833532241	IOWRMFLUMLBNAU-HNNXBMFYSA-N	440.932	1.911	50	20	IDGD	
O=C(Cn1cc([N+](=O)[O-])cn1)NC1CCN(C2CCN(C(=O)C(Cl)Cl)CC2)CC1	1833787124	VPZPTLZWTKRFII-UHFFFAOYSA-N	447.323	1.167	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)c3cnccc3F)C2)C1	1834822578	WRUDKFXLVMAVGV-QGZVFWFLSA-N	430.274	1.076	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)c1ccc2nonc2c1	1835320379	NPESWAVCSMQSMQ-GOSISDBHSA-N	435.912	1.008	50	20	IDGD	
O=C(c1ccc2c(c1)OCO2)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836718383	WPTPEPPOHATMAQ-KRWDZBQOSA-N	438.908	1.627	50	20	IDGD	
Cn1nc(C(=O)N2CCC(OC3CCN(C(=O)[C@@H](F)Br)CC3)CC2)cc1O	1837270265	IHSOASFHWBPNLO-OAHLLOKOSA-N	447.305	1.428	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCC(OC2CCN(C(=O)[C@@H]3CCC(=O)N3)CC2)CC1	1837737653	FDUGUVDKMUYDOZ-KXBFYZLASA-N	434.364	1.500	50	20	IDGD	
C/C=C/C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)CCO2	1838528174	JUMQCJVMCPATMX-SHTLVRLNSA-N	447.444	1.166	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cc(CO)on3)CC2)CC1	1838558276	XDDUMBZXBDERGX-INIZCTEOSA-N	429.901	1.033	50	20	IDGD	
C=CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)CCO2	1839744238	WEDBPRPTRRDEBB-BPNKPRMTSA-N	431.439	1.904	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3ccc(C)cc3)CCO2)C1	1839939393	QWADPFGFHOVOMW-SIKLNZKXSA-N	438.952	1.638	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccsc3)C2)C1	1839963412	JKZOVJGKFMLILS-RHSMWYFYSA-N	431.352	1.992	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3c(F)cccc3Cl)C2)C1	1840153768	ARBVNSHGQTYVFB-AUUYWEPGSA-N	449.306	1.803	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(N(C)C)c3)C2)C1	1840154409	WPKGMKYNOPXQQL-GHTZIAJQSA-N	439.940	1.076	50	20	IDGD	
CSc1ccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)cc1	1840302050	RXCJRBUGVYRDLJ-PXNSSMCTSA-N	442.965	1.007	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3c(C)nn(C)c3C)CCO2)C1	1840436834	AWKDTCRFGZFJOP-XLIONFOSSA-N	426.945	1.053	50	20	IDGD	
Cc1cccc(F)c1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)Br)C2)C1	1840651985	FADMSTALXSSXSX-LIRRHRJNSA-N	443.313	1.988	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)c(O)c1	1840670719	RYFCTAUPUDBXQD-MAUKXSAKSA-N	445.285	1.461	50	20	IDGD	
COc1ccc([C@H](O)C(=O)N2CCCC23CN(C(=O)[C@H](C)CBr)C3)cc1	1841181746	NHPOUYHNCLKLNK-CJNGLKHVSA-N	425.323	1.963	50	20	IDGD	
COc1cccc(CC(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)c1C	1844265193	FBUQNPUZFNHBMQ-UHFFFAOYSA-N	437.500	1.062	50	20	IDGD	
CC(=O)C[C@H](C)C(=O)N1CCCC12CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1846325282	BMTORNUWNUCGFC-ZFWWWQNUSA-N	429.945	1.937	50	20	IDGD	
CCn1c(NNC(=O)c2ccc3c(c2)CCN3S(C)(=O)=O)nc2ccccc2c1=O	11160215	MUROAPWHEHWUMH-UHFFFAOYSA-N	427.486	1.495	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)c2ccc(CCNS(C)(=O)=O)cc2)cc1	18071842	HKVABVDUENFHOH-OAHLLOKOSA-N	449.529	1.406	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)CCc2c(C)nc(-c3cccnc3)[nH]c2=O)c1	60353938	HIQMJONDVLHISI-UHFFFAOYSA-N	435.484	1.916	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)COc2ccc3c(c2)CCC(=O)N3)c2ccccc2c1=O	105620194	VXUFEGAGNBSPSE-UHFFFAOYSA-N	449.467	1.531	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)NNC(=O)CNC(=O)c1cccs1	725739286	BLPRLLRGJZNZFE-HNNXBMFYSA-N	446.529	1.761	50	20	IDGD	
CC(C)NC(=O)C(=O)NNC(=O)[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)c1cccc(Cl)c1	726157342	SVOPTKVTGXNKHS-XKQJLSEDSA-N	434.924	1.785	50	20	IDGD	
CCn1c(NNC(=O)[C@@H]2CC(=O)N(Cc3ccc(OC)cc3)C2)nc2ccccc2c1=O	726524515	JQPUFMFRSHZFAQ-MRXNPFEDSA-N	435.484	1.917	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(N2CCCS2(=O)=O)cc1)c1c[nH]c2ccccc12	726765140	WVAWQUMHKGNLNJ-UHFFFAOYSA-N	434.499	1.331	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)Cn2nnc(-c3ccc(C)cc3)n2)c2ccccc2c1=O	727975059	STIHQDUFUOEEJL-UHFFFAOYSA-N	446.471	1.230	50	20	IDGD	
C[C@H](NC(=O)c1n[nH]c2ccccc12)C(=O)NNC(=O)c1ccc(Br)s1	728203119	GEYIPRJMCXWDPC-QMMMGPOBSA-N	436.291	1.966	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)c1cc(F)ccc1Br)N1C(=O)NC2(CCCC2)C1=O	728546281	QCSZRWRGGVJIIP-VIFPVBQESA-N	441.257	1.602	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NCC(=O)NNC(=O)CC(C)(C)C)c1	728608037	QYZZFMIQTOVCKC-UHFFFAOYSA-N	426.539	1.031	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2cccnc2OCC(F)(F)F)n1	728724484	ZAKNOTVXHBDGDN-UHFFFAOYSA-N	432.380	1.335	50	20	IDGD	
N#Cc1cccc(OC2CCN(C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)CC2)c1	729221096	HZVCENJEJWHNCR-UHFFFAOYSA-N	432.444	1.432	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)CN1Cc2ccccc2C1=O	730051298	KBOYHWAOPARWFS-UHFFFAOYSA-N	431.832	1.309	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])cc1OC	731051362	YXDBPLVWRVULCC-UHFFFAOYSA-N	436.808	1.456	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)NC2CCN(CC(=O)N(C)C)CC2)c(C)n1C[C@H]1CCCO1	731655623	QZEXNFLPMNGKQR-WVWKGNOCSA-N	441.576	1.860	50	20	IDGD	
COCCOc1ccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc1	732053567	SXJMKXZDKKRRSF-UHFFFAOYSA-N	447.513	1.571	50	20	IDGD	
N#Cc1cccc(OCCCCC(=O)NNC(=O)c2csc(N3CCOCC3)n2)c1	732054136	PUZHGQNDGUAYLD-UHFFFAOYSA-N	429.502	1.862	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)cn1	734418815	PBJYVCVPSYZAQQ-UHFFFAOYSA-N	427.467	1.890	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(Oc2ccccc2Cl)cc1)[C@H]1CCS(=O)(=O)C1	734741569	LBAKZWJEZVEFQK-LBPRGKRZSA-N	444.918	1.877	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)c1ccc(C)cc1)C(=O)NNc1ccc(Cl)nn1	735687473	KNHAXTNIIKYCOJ-ZDUSSCGKSA-N	429.955	1.982	50	20	IDGD	
COc1ccc(-c2nn(CCC#N)cc2/C=C(/C#N)C(=O)N[C@H]2CCN(C)C2=O)cc1OC	737993276	GOKXJYZFNLLDLP-QMJOVRGKSA-N	448.483	1.735	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)C[C@@H](NC(C)=O)c1ccc(Br)cc1	740852677	HZHQABLMFUOECU-OAHLLOKOSA-N	441.326	1.469	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2c[nH]c3c(C)cc(F)cc3c2=O)c2ccccc2c1=O	741745262	YODZHDXQNWDXNW-UHFFFAOYSA-N	435.415	1.780	50	20	IDGD	
Cc1cc(C)nc(-n2[nH]c(C(=O)NNC(=O)c3ccc(COc4ccccc4)o3)cc2=O)n1	741749289	YFCQTZJLBSRMQH-UHFFFAOYSA-N	448.439	1.819	50	20	IDGD	
CC(=NNC(=O)C[C@@H](C(=O)NN=C(C)c1cncs1)N1CCOCC1)c1cncs1	741766493	MFISKENFQNGZRW-AWEZNQCLSA-N	449.562	1.071	50	20	IDGD	
O=C(CN1CCn2c(Cc3ccccc3)nnc2C1)NNC(=O)c1cccc([N+](=O)[O-])c1	741795571	PTEMFPOPADRIDI-UHFFFAOYSA-N	435.444	1.054	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCC2(N(C)C)Cc3ccccc3C2)cc(OC)c1OC	743506433	NZZPBFRJSNWWMK-UHFFFAOYSA-N	442.516	1.756	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NCc2ccc(N3CCOCC3)cc2)cc1	743560983	XNQLIRGXTCMHOK-UHFFFAOYSA-N	447.517	1.463	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NCc2ccc(Br)c(F)c2)c2ccccc2c1=O	746972479	JWKBXRGISKBQKX-UHFFFAOYSA-N	448.252	1.979	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NC[C@H](c2ccccc2)C(C)(C)CO)c2ccccc2c1=O	747455691	HRJPEHZIDAHTQZ-GOSISDBHSA-N	437.500	1.680	50	20	IDGD	
COc1cc(OC)cc(N2CC[C@@H](NC(=O)NNC(=O)Cc3ccccc3F)C2=O)c1	747954218	KPFXHFAGXMFLQY-GOSISDBHSA-N	430.436	1.521	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)C1(S(C)(=O)=O)CCCC1	749838093	OGHFAQVZVWQJQX-NSHDSACASA-N	433.324	1.721	50	20	IDGD	
O=C(O)CCCOc1ccc(S(=O)(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1F	751260054	HVCSSGOAHOZSAR-UHFFFAOYSA-N	441.393	1.601	50	20	IDGD	
Cc1noc(Cl)c1CC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	751281177	OFYXSUPWJWRQGL-UHFFFAOYSA-N	426.882	1.425	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)c2cc(S(N)(=O)=O)cc(Cl)c2F)cc1	751806136	VNQLDZALSVLLKV-UHFFFAOYSA-N	443.840	1.053	50	20	IDGD	
Cc1cc(S(N)(=O)=O)cc(C(=O)NNc2nc(Br)cn3ccnc23)c1C	752626332	QMMUKTIKMMHTNT-UHFFFAOYSA-N	439.295	1.513	50	20	IDGD	
CS(=O)(=O)N1CC[C@H](CNC(=O)NNC(=O)c2cc3c(s2)CCCCCC3)C1	753661678	QTTMJCVETFZERM-CYBMUJFWSA-N	428.580	1.633	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)NC[C@H]1CCCN1S(C)(=O)=O	753691068	JDRVRYQREDQRHI-RHSMWYFYSA-N	434.518	1.362	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2cccc(C(=O)NC)c2)c1	755515201	QIMXJZQEZNZJTN-UHFFFAOYSA-N	447.517	1.543	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)NCCC1CCC1	756115037	BRFLSQYUVAFPAQ-UHFFFAOYSA-N	438.550	1.161	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)NNC(=O)c2nnc(O)c3ccccc23)cc1C	756514370	GDCNCYWJOXUVMJ-UHFFFAOYSA-N	444.473	1.872	50	20	IDGD	
CCNC(=O)N1CCc2ccc(NC(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)cc21	756730567	RGKBYHHJDGTVCG-UHFFFAOYSA-N	449.471	1.492	50	20	IDGD	
O=C(NNC(=O)c1cc2ccccc2cc1O)Nc1cnn(CC(=O)N2CCOCC2)c1	756834379	GDTZZFIAKBPXBQ-UHFFFAOYSA-N	438.444	1.067	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)N[C@@H]1CCN(C(=O)CCc2ccccc2)C1	756913616	JCOJRUUIILPEBI-OAHLLOKOSA-N	448.321	1.955	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)Nc1ccc(C(=O)NC2CCOCC2)cc1	757619300	NBEAVZGLKCTYJD-UHFFFAOYSA-N	427.417	1.970	50	20	IDGD	
C#CCNC(=S)NNC(=O)CCN1CCN(C(c2ccccc2)c2ccccc2)CC1	758173979	YVQZKALYUSFCKU-UHFFFAOYSA-N	435.597	1.912	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)COc2c(C)nn(C)c2C)c2ccccc2c1=O	758373657	ZDSJAZKIERJVAV-UHFFFAOYSA-N	440.504	1.777	50	20	IDGD	
Cc1cccc(-n2ncc(C(=O)N3CCN(S(=O)(=O)CBr)CC3)c2C)c1	758526376	CGHXURCIVOCJEY-UHFFFAOYSA-N	441.351	1.929	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1cn(C)c(=O)c2ccccc12	760065441	FHVLZOVOVZLGAD-UHFFFAOYSA-N	427.486	1.215	50	20	IDGD	
COc1ccsc1S(=O)(=O)NNC(=O)c1ccc(CSc2nncn2C)cc1	760334591	JDTMLEHAJPTODY-UHFFFAOYSA-N	439.544	1.801	50	20	IDGD	
COC(=O)N(C)Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1	763442232	ODHKSJNIWKDDGT-UHFFFAOYSA-N	429.389	1.193	50	20	IDGD	
CC(C)n1cnnc1-c1ccccc1NC(=O)C(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	763467115	OWZCATGEVWSPNQ-UHFFFAOYSA-N	437.416	1.834	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)[nH]n1)C(=O)Nc1ccn(Cc2ccncc2)n1	763605622	WARWPYXNKAXVCK-UHFFFAOYSA-N	430.428	1.116	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(C)nn1-c1ccccc1F	763647188	OOHZGWSLNODDBL-UHFFFAOYSA-N	441.419	1.493	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2ccc(C(=O)NC(C)C)cc2)c1	763665362	HAKAFIWUCVMRFZ-UHFFFAOYSA-N	426.473	1.607	50	20	IDGD	
CCn1cnnc1-c1cccc(NC(=O)C(=O)NNC(=O)COc2ccc(C)c(C)c2)c1	763668005	XKRTVNIHRCKYGR-UHFFFAOYSA-N	436.472	1.747	50	20	IDGD	
CC(C)S(=O)(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)c2cccc(N(C)C)c2)c1	763760209	HEXICWBIEIHQFO-UHFFFAOYSA-N	446.529	1.476	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2cccc(OC(F)F)c2)c2ccccc2c1=O	763785032	BGCPDLVGMSAJNC-UHFFFAOYSA-N	445.382	1.418	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)C(=O)Nc1ccc(CC(F)(F)F)cc1	763790798	OTOOCEPKUQDHKJ-UHFFFAOYSA-N	433.346	1.840	50	20	IDGD	
CCOC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)cc1	763808442	WANJRABUSQQDSY-UHFFFAOYSA-N	425.401	1.292	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cc(N3CCNC3=O)ccc2Cl)cc1	763822323	YNJXSTJZSGMUDK-UHFFFAOYSA-N	445.863	1.343	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)cc1Br	763840265	OZFMSQMBIURNIP-UHFFFAOYSA-N	440.225	1.762	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1cnn(Cc2ccccc2)c1	763848525	CQDYUXPCBHFLRC-AWEZNQCLSA-N	425.420	1.624	50	20	IDGD	
CC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(C(C)=O)cc2)c1C	763872024	JFZGVSZIYUIVOK-AWEZNQCLSA-N	440.456	1.709	50	20	IDGD	
CCC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(C(C)=O)cc2)cc1	763877428	JIAFCWNDDPRULF-AWEZNQCLSA-N	440.456	1.791	50	20	IDGD	
COC(=O)c1csc(NC(=O)C(=O)NNC(=O)c2ccc(Br)s2)c1	763942330	YBMGIJQNSZUXBO-UHFFFAOYSA-N	432.277	1.758	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccccc2-n2cc(Br)cn2)n[nH]1	764106768	RONZDDYNSNROQY-UHFFFAOYSA-N	432.238	1.066	50	20	IDGD	
CCN(c1ccccc1)S(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)CC2CC2)cc1	764144787	RJWFYGPGUBKQSH-UHFFFAOYSA-N	444.513	1.788	50	20	IDGD	
C[C@@H]1COCCN1c1ccc(NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)cc1	764243735	XMZJPMUEFAARFH-MRXNPFEDSA-N	435.484	1.653	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)Cc2cc[nH]n2)ccc1NC(=O)OC(C)(C)C	764297746	XXGICSIBAJJQRH-UHFFFAOYSA-N	432.437	1.094	50	20	IDGD	
CCOC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccccc2F)cc1C#N	764319711	RXEOGHCSOZFHPO-UHFFFAOYSA-N	427.392	1.594	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)C1CCC(NC(=O)CC2CCCC2)CC1	764344207	UYPBJZIOYIBYPN-UHFFFAOYSA-N	429.521	1.214	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)C(=O)Nc1ccccc1CN1CCOCC1	764393557	HSPFYNYISRHQNX-UHFFFAOYSA-N	444.513	1.103	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)[C@@H](C)NS(=O)(=O)c3cccc(C#N)c3)cc2C1	764571789	KLSOKKLEIDGWLY-CHWSQXEVSA-N	446.554	1.873	50	20	IDGD	
CCCOc1ccc(C(=O)NNS(=O)(=O)c2cnn(-c3ccccn3)c2C)cc1OC	765029264	OOQQEXVFTAUSAT-UHFFFAOYSA-N	445.501	1.996	50	20	IDGD	
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)NNC(=O)COc1ccccc1[N+](=O)[O-]	765892891	NBZFHKGMJDTYHY-WBVHZDCISA-N	427.461	1.825	50	20	IDGD	
CN(C1CCCCC1)S(=O)(=O)c1ccccc1NC(=O)C(=O)NNc1cnccn1	766260125	JNNCEMBCBFYROI-UHFFFAOYSA-N	432.506	1.512	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(\C#N)C(=O)N2CCN(C(=O)[C@@H]3CCCN3C)CC2)c1C	766332308	AZQPYHDVHGCAEI-KXNLXUQCSA-N	441.576	1.984	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)C3(NC(=O)OC(C)(C)C)CC3)n[nH]2)cc1OC	768277193	QDEBBTMEKDRSDZ-UHFFFAOYSA-N	445.476	1.912	50	20	IDGD	
COC(=O)CCc1csc(NC(=O)NNc2c(OC)cccc2S(C)(=O)=O)n1	769238907	AARXFCHFFYBCFE-UHFFFAOYSA-N	428.492	1.809	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)N[C@H]3CCCC[C@@H]3CNC(=O)OC(C)(C)C)nc21	770402664	UAEJEDAHZRPJTO-YPMHNXCESA-N	434.501	1.779	50	20	IDGD	
O=C(Cc1cc(F)ccc1Br)NNC(=O)c1csc(N2CCOCC2)n1	771228498	RFINSRDVNPAJKT-UHFFFAOYSA-N	443.298	1.885	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1ccc(C)c(S(=O)(=O)N2CCCCC2)c1	771870140	FEAAXENTDMEIIT-CQSZACIVSA-N	425.507	1.272	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)CCCNC(=O)c2ccccc2)C1	773419147	MDGWRQJOZNDMGG-KRWDZBQOSA-N	432.521	1.991	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(OCC(F)F)c(C(F)(F)F)c2)n[nH]1	773539738	CPIVRQPREYEXAF-UHFFFAOYSA-N	435.309	1.781	50	20	IDGD	
CN1CCN(CCOc2ccc(NC(=O)C(=O)NNc3ccc4ccccc4n3)cc2)CC1	773662175	QTXAIWRQRMYMRW-UHFFFAOYSA-N	448.527	1.943	50	20	IDGD	
O=C(NNc1ncc(Cl)cc1Cl)C(=O)Nc1ccc(S(=O)(=O)NC2CC2)cc1	773679413	ZEXXEKHPWUWMJD-UHFFFAOYSA-N	444.300	1.911	50	20	IDGD	
CCn1nccc1C(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	775765491	LDJJBKCRBQSWHD-UHFFFAOYSA-N	427.486	1.456	50	20	IDGD	
COc1cc(C)nc(NNC(=O)[C@H]2C[C@H](C)C[C@H]2C(=O)NNc2nc(C)cc(OC)n2)n1	775867858	OQJULLVOAFCOLH-OJNYZHBWSA-N	444.496	1.149	50	20	IDGD	
O=C(NNC(=O)C(=O)N1CCCC1)N[C@H](c1cc(F)cc(Br)c1)C1CC1	776258845	HCFFKZBVLRAIGJ-AWEZNQCLSA-N	427.274	1.992	50	20	IDGD	
COc1ccc2c(c1)OC[C@H](C(=O)N1CCN(S(=O)(=O)CBr)CC1)C2	777777945	ULYYTNFGZDWTBG-CYBMUJFWSA-N	433.324	1.073	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)CNC(=O)OC(C)(C)C)[C@H]1CN(Cc2ccccc2)CCO1	778673618	BKRRTCYFQAJGOM-DOTOQJQBSA-N	435.525	1.131	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1ncc(Cc2ccccc2Cl)s1	782123265	FNFPGYKIOUUSMN-NSHDSACASA-N	440.909	1.525	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)c1cccc(NS(=O)(=O)C(F)(F)F)c1	782549245	GFYARUNYRLWOIC-UHFFFAOYSA-N	431.392	1.960	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1cccnc1-c1ccc(Cl)s1	782702179	IEQWJZOUDWLKFO-SNVBAGLBSA-N	426.882	1.601	50	20	IDGD	
Cc1cc(C(=O)NCC(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)ccc1[N+](=O)[O-]	782759203	OSDXAQVTYNDSLN-UHFFFAOYSA-N	428.430	1.546	50	20	IDGD	
COc1ccc(Cn2nccc2NC(=O)C(=O)NNc2cncc(Cl)n2)c(OC)c1	783258452	JIJAIZVEZOKVJW-UHFFFAOYSA-N	431.840	1.474	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)c2n[nH]c3c2CN(C(=O)OC(C)(C)C)CC3)nc1C	783701968	CPQGBEUDZHSUHS-UHFFFAOYSA-N	445.480	1.735	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)C(=O)Nc1ccc(OC2CCCCC2)cc1	784004170	JTNVNARIWZSBKF-UHFFFAOYSA-N	428.445	1.507	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)cc1[N+](=O)[O-]	784210590	WYLAATFYCGOJIZ-UHFFFAOYSA-N	449.445	1.126	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)c2ccn(CCOC)n2)c2ccccc2c1=O	784293437	JBMXTPSROGXSQY-UHFFFAOYSA-N	426.477	1.504	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(NC(=O)C(=O)NNc2ccc(OC(F)F)cc2)c1	784312050	JRNKLJQAXJNAIO-UHFFFAOYSA-N	428.417	1.620	50	20	IDGD	
CN1C(=O)c2ccc(NC(=O)C(=O)NNc3ccc(OCC(F)(F)F)cc3)cc2C1=O	784367805	AJYJHTKVUSUHDR-UHFFFAOYSA-N	436.346	1.935	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)Cc2ccc3c(c2)NC(=O)C3)CC1	784665752	SBAALWARSJINDP-UHFFFAOYSA-N	431.493	1.454	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNc2cc(Cl)ccn2)cc1S(=O)(=O)N(C)C	784856300	KZCWXLOMWFOOGZ-UHFFFAOYSA-N	441.897	1.466	50	20	IDGD	
CCNC(=O)c1ccc(NC(=O)C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)cc1	785108973	UYPGNJUBXDUCTK-UHFFFAOYSA-N	445.426	1.689	50	20	IDGD	
CCN(CC)CCN1C(=O)C(=NNC(=O)C(C)(C)O)c2cc(Br)ccc21	785462594	PCEBRYDXDLTCCW-UHFFFAOYSA-N	425.327	1.729	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccc(Br)c(C)c2F)n1	789741191	QIIILWHRUKFWLZ-UHFFFAOYSA-N	426.246	1.496	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C(=O)Nc2cccc(Br)n2)nc2ccccc21	793034128	DYSOMUWHZJHJCJ-UHFFFAOYSA-N	431.250	1.059	50	20	IDGD	
CSc1nc(C)c(CCC(=O)NNC(=O)CNC(=O)OCc2ccccc2)c(O)n1	794072355	VSMJGUXXRPAKMD-UHFFFAOYSA-N	433.490	1.219	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNS(=O)(=O)c2cc(Cl)c(C)c(C(=O)O)c2)cc1C	794867459	XDZHDEKXERYSBT-UHFFFAOYSA-N	439.877	1.912	50	20	IDGD	
C=C(CBr)COC(=O)c1ccc(OC)c(S(=O)(=O)N2CCOCC2)c1	795336698	KGPROXPZRSZENA-UHFFFAOYSA-N	434.308	1.824	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN(C(=O)COc2ccccc2)C1)Nc1ccc2c(c1)OCO2	802097304	JFUQASIQSAZONA-OAHLLOKOSA-N	440.456	1.886	50	20	IDGD	
O=C(NNC(=O)c1cn(-c2ccc(C(F)(F)F)cn2)nn1)Nc1ccc2c(c1)OCO2	802100155	JDUOVALHXAIDKK-UHFFFAOYSA-N	435.322	1.876	50	20	IDGD	
COc1ccc(Cl)c(NC(=O)NNC(=O)[C@@H](C)N2C(=O)[C@@H]3[C@H]4CC[C@@H](O4)[C@@H]3C2=O)c1	802114071	PJOVEVNLABPGDZ-FYIZZCSQSA-N	436.852	1.052	50	20	IDGD	
O=C(NNC(=O)c1cncc(C(F)(F)F)c1)c1ccc(S(=O)(=O)N2CCCC2)cc1	808372083	IDSWGBQWNSNLPV-UHFFFAOYSA-N	442.419	1.960	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cc(C)n(-c3ccc(F)cc3F)n2)cc1	808934415	DKYQVOJJHIPJGF-UHFFFAOYSA-N	443.410	1.932	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc3c2COC3=O)cc1OC	808934638	OOYPHBZIWJUVSZ-UHFFFAOYSA-N	441.440	1.944	50	20	IDGD	
Cc1noc(C)c1S(=O)(=O)NCC(=O)NNc1ccc([N+](=O)[O-])cc1Br	811222778	YOSHPDHAFFKCID-UHFFFAOYSA-N	448.255	1.384	50	20	IDGD	
Cc1noc2nc(C(C)C)cc(C(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)c12	813469011	JOVHUXAXVLQFSO-UHFFFAOYSA-N	445.501	1.980	50	20	IDGD	
CCOC(=O)c1cc(Cl)cc(S(=O)(=O)NNC(=O)COc2ccccc2O)c1	813664881	ACOFFGKEJFRPKN-UHFFFAOYSA-N	428.850	1.611	50	20	IDGD	
CCCn1c(C)cc(/C=C(/C#N)C(=O)OCc2c(N(C)C)n(C)c(=O)n(C)c2=O)c1C	814063907	QMSXKKGRHVABOM-BOPFTXTBSA-N	427.505	1.629	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN[C@H](C)c2ccc(N3CCCOC3=O)cc2)n1	814657407	DEIZXNBUEYSDGK-CQSZACIVSA-N	431.518	1.839	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)c2cnn(-c3ccccn3)c2N)cc1C	815308097	KJILFTBHAGTFTB-UHFFFAOYSA-N	428.474	1.400	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCO1)C(=O)Nc1cccc(COc2ccc3c(c2)OCO3)c1	815779726	SHIJUAKBLMPADE-QGZVFWFLSA-N	427.413	1.259	50	20	IDGD	
CCOc1ccc(NNC(=O)C(=O)Nc2ccc(NC(=O)[C@H](C)n3cncn3)cc2)cc1	815815018	HIRRPSQWQVUFFO-AWEZNQCLSA-N	437.460	1.958	50	20	IDGD	
O=C(Cn1c2ccccc2c(=O)c2ccccc21)NNC(=O)c1ccc(-n2cnnn2)cc1	818860792	LWTUHZIPCYNCFI-UHFFFAOYSA-N	439.435	1.592	50	20	IDGD	
Cc1ccc(C)c(S(=O)(=O)NCCC(=O)OCC(=O)NNC(=O)c2cccs2)c1	846755072	FFCXKBNNLPZOQI-UHFFFAOYSA-N	439.515	1.038	50	20	IDGD	
CSCC[C@@H](NC(=O)c1ccccc1)C(=O)NNC(=O)[C@H]1COc2ccccc2O1	859439199	PKJGEFJJYRTOTG-CRAIPNDOSA-N	429.498	1.526	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)CCc2nc3ccccc3oc2=O)c2ccccc2c1=O	884824184	JPDYFGOAAVFBPX-UHFFFAOYSA-N	447.451	1.702	50	20	IDGD	
O=C(C[C@H]1SC(N2CCCC2)=NC1=O)Nc1ccc(C(=O)NNc2ncccn2)cc1	913044049	LLPCCZAUNKFRIH-OAHLLOKOSA-N	439.501	1.656	50	20	IDGD	
COC(=O)NNC(=O)[C@@H](CCSC)NS(=O)(=O)c1cc(Cl)ccc1Cl	913176909	MADVVAKGUOVNFV-SNVBAGLBSA-N	430.335	1.781	50	20	IDGD	
O=C(NCCn1ccnc1)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	915905613	WYUBJKRFAISPRF-UHFFFAOYSA-N	431.460	1.229	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCCc2cccc(Cl)c2)cc1	915909810	JTEPRPAOYRPBPQ-UHFFFAOYSA-N	438.937	1.842	50	20	IDGD	
O=C(NN=C1CCN(c2ccccn2)CC1)c1cccc(S(=O)(=O)N2CCOCC2)c1	915938571	BWMOLINJWOEZOC-UHFFFAOYSA-N	443.529	1.489	50	20	IDGD	
CCn1nc(C(=O)NN=C(C)c2cccc(S(=O)(=O)NC)c2)c2ccccc2c1=O	915947204	JICWMUAPSQWWGL-UHFFFAOYSA-N	427.486	1.479	50	20	IDGD	
CCOc1cccc2c1OCC(C(=O)NNC(=O)c1sc(N3CCOCC3)nc1C)=C2	916134751	YKBARVSFBBDQQG-UHFFFAOYSA-N	444.513	1.924	50	20	IDGD	
CCS(=O)(=O)NCCNC(=O)NNC(=O)c1cc(-c2ccccc2)nc2ccccc12	916516922	TZZCOMIACSYTQU-UHFFFAOYSA-N	441.513	1.785	50	20	IDGD	
O=C(CSc1ccc(Cl)cc1)NNC(=O)NC[C@]1(N2CCOCC2)CCSC1	916636584	GMXKIKXWWSTQEH-GOSISDBHSA-N	445.010	1.970	50	20	IDGD	
O=C(CN1CCCCCCC1=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	916736273	FQRPJKMKEXCPND-UHFFFAOYSA-N	436.534	1.025	50	20	IDGD	
COc1ccc(S[C@@H](C)C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1	917328250	OGBDBNDSCXMSST-UGSOOPFHSA-N	446.481	1.706	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)NCc1cccc(CN2CCOCC2)c1	918223284	GMCDDYNXDYCDTG-UHFFFAOYSA-N	442.516	1.827	50	20	IDGD	
COc1cc(OC)c(CNC(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)c(OC)c1	918231012	RXJLJTKKYCWPGS-UHFFFAOYSA-N	430.461	1.798	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)c2ccc3c(c2)C[C@@H](C)N3S(C)(=O)=O)o1	920248420	FKVDKKMVAQAQCV-CQSZACIVSA-N	448.545	1.907	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CN2CCCC2=O)c([N+](=O)[O-])cc1OCc1cscn1	920433498	ULODGJVKKSSORQ-UHFFFAOYSA-N	449.445	1.022	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)[C@@H]2COc3ccc(F)cc3C2)cc1OC	1116401395	VJFYBRJGKOGSRE-AWEZNQCLSA-N	432.404	1.398	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)c1cn(-c2ccc(Br)cc2)nn1	1116637931	GVHDDKHXSVCNFF-LLVKDONJSA-N	438.282	1.769	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)[C@@H]2CCN(c3ccc(F)cc3)C2=O)CC1	1339205097	RTZFFRMXYQTEEZ-KRWDZBQOSA-N	448.495	1.973	50	20	IDGD	
C[C@@H](O)CNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2ccc(C(C)(C)C)cc2)cc1	1353486824	RYCMRATVKAAJSH-CQSZACIVSA-N	433.530	1.718	50	20	IDGD	
CC(=O)N(C)[C@@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)Br)C2	1778107214	DAAWYTPFUYYOQK-ZFHGCVPZSA-N	432.359	1.151	50	20	IDGD	
Cc1cnc2c(C(=O)N3CC[C@]4(CN(C(=O)CO[Si](C)(C)C)CCO4)C3)cnn2c1	1778527346	RCSWOYCKXUUDKE-FQEVSTJZSA-N	431.569	1.333	50	20	IDGD	
Cn1ccc(=O)cc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CO[Si](C)(C)C)C1	1779545454	NHNLZDMFDQDAES-WIYYLYMNSA-N	435.597	1.364	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccnnc2O)C1	1779963854	GZRMIPABIORLLP-WPKBUWHJSA-N	441.326	1.341	50	20	IDGD	
CN1CCC[C@H](C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)CCBr)C3)C1	1780573379	YODCGTZCGRBQPV-FRQCXROJSA-N	430.387	1.627	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H]2CCC(=O)N2C)C1	1780792395	DPULVAICCCIWHM-NXEZDXNNSA-N	444.370	1.295	50	20	IDGD	
COc1cc(CC(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](F)Cl)CCO3)ccc1[N+](=O)[O-]	1781190508	ZDGDUIPOYCAFOQ-FUHWJXTLSA-N	429.832	1.510	50	20	IDGD	
COc1cc(CC(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](F)Cl)CCO3)ccc1[N+](=O)[O-]	1781190510	ZDGDUIPOYCAFOQ-SJLPKXTDSA-N	429.832	1.510	50	20	IDGD	
CN(C)c1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@](C)(Cl)CCl)C3)C2)nc1	1781228611	VRXOMFVXGIQUIO-RTBURBONSA-N	429.348	1.827	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc4nn[nH]c4c3)CCO2)C1	1781233215	RKJDRKWSJWGKOG-MSOLQXFVSA-N	426.304	1.638	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCC(=O)OC)C2	1781900855	WGCSHRRAFGVANU-HBUWYVDXSA-N	433.343	1.627	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnn(C)c1Cl)C2	1781997980	POHTUHULTYYXNU-CJBNDPTMSA-N	447.761	1.984	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1ccc3ncnn3c1)C2	1782174043	ZGPOYZRFFOXNPN-CBGDNZLLSA-N	449.939	1.040	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)Cc2cnc(C)s2)C1	1782510430	OUKOEZAHVWRYKZ-GPMSIDNRSA-N	429.970	1.762	50	20	IDGD	
O=C([C@H](O)CCl)N1CCO[C@]2(CCN(C(=O)[C@H]3CCc4cccc(Cl)c43)C2)C1	1782852640	FBKOYUICQICUQM-NBQZKYEYSA-N	427.328	1.799	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)COc3ccc(O)cc3)CCO2)C1	1783527514	CJMYVUDFXIYPFU-ACJLOTCBSA-N	427.295	1.384	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cnn(Cc4ccccc4)c3)CCO2)C1	1783877704	NOSZPTOUHHSMAK-SIKLNZKXSA-N	446.935	1.629	50	20	IDGD	
Cc1c(C(=O)N2CCO[C@@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)ccc(F)c1F	1783936986	BWYVBFDJRYEDGB-OAQYLSRUSA-N	438.475	1.090	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)COc3cccnc3)C[C@@H]21	1786401339	YBLLHNYONATSGM-BPUTZDHNSA-N	426.311	1.225	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CO[Si](C)(C)C)C[C@@H]21	1790990107	PWIHHAIJXSEDSF-JYJNAYRXSA-N	443.617	1.342	50	20	IDGD	
CC1CCN(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]3C2)CC1	1791055580	XSUXSJSZIHDANF-QZWWFDLISA-N	430.387	1.481	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc4[nH]ncc34)C[C@@H]21	1791058084	YBOGGLMUQMZTHB-LMMLAZSQSA-N	435.322	1.940	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cccnc3Cl)C[C@@H]21	1791252213	DPVPZGQPPKPYSL-JONQDZQNSA-N	430.332	1.511	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc(C#N)cc1)C2	1792866489	AYSHNQTXPZXLRH-UEILYKACSA-N	434.334	1.721	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(Br)cs1)C2)[C@@H](O)CCl	1792978070	BJJGAMVWFCVTPG-PKCZLINISA-N	437.743	1.314	50	20	IDGD	
COc1cccc(N2C[C@H](C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)[C@@H](O)CCl)CC2=O)c1	1793106601	OPLUPBYBNUKARZ-IIZUFCTNSA-N	449.935	1.286	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H]1CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2	1793649714	IRKQKCHMVHKEMH-QZCUMHFISA-N	447.935	1.900	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)c1cc(-c2ccco2)no1	1796189199	JMNSBTUIJDTIRK-BJWYYQGGSA-N	435.245	1.180	50	20	IDGD	
COc1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)cn1	1796891031	YPPFLKVWNKBSAI-FWKYCFCSSA-N	438.488	1.476	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1(C)CN(C(=O)OC(C)(C)C)C1	1797275921	KCHKFUOHXKNKBP-FZKCQIBNSA-N	443.972	1.850	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnc2snnc2c1	1798506356	OBQJDQIDXDAVEW-YWVIFJGQSA-N	435.582	1.141	50	20	IDGD	
CC(C)NC(=O)OC(C)(C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)Br)C2	1799130608	KCNSWEWYEIDERV-FQUUOJAGSA-N	448.358	1.273	50	20	IDGD	
COc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCBr)C3)c(F)c1	1799519262	JWRNFZUZELGPOU-DPIQGUFMSA-N	429.286	1.823	50	20	IDGD	
Cc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@](C)(Cl)CCl)C3)nc2nccn12	1799990103	IOHAVVZOHLNDMV-QPWUGHHJSA-N	440.331	1.477	50	20	IDGD	
CCCNC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](Br)CC	1800638305	XYLUNFFIAKKEGP-LOUJCGABSA-N	432.359	1.056	50	20	IDGD	
CN(C)C(=O)NCC(=O)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@@H]1c1cccnc1	1802680395	JKLXFNCFSWUXGR-CFVMTHIKSA-N	444.305	1.049	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H]2Cc3ccccc3CN2)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803138591	CRPRJQVFHHXKCZ-XSDIEEQYSA-N	442.947	1.402	50	20	IDGD	
Cc1noc(C)c1C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1805538580	SOVASYZDWFWNBQ-LAUBAEHRSA-N	442.520	1.379	50	20	IDGD	
Cc1c[nH]cc1C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1807361119	HKGRULNWPSMUJE-RXVVDRJESA-N	432.289	1.031	50	20	IDGD	
C[C@H](C(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)n1cccc1C=O	1807392056	UKADXWCMEBPUHD-HYEGPXJVSA-N	432.908	1.562	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)c1cc2cn[nH]c2cn1	1810082610	KJFADWXBQFKIIV-VHSSKADRSA-N	428.880	1.272	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC2(CCCN(C(=O)[C@H]3CCCO3)C2)CC1	1810216932	IGKGSXNPEKISGC-WCIBBKAISA-N	429.521	1.531	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H](CNC(=O)[C@H]2CNC(=O)C2)[C@@H]1c1cccnc1	1812644000	UHUWWHAYXHXHIM-ZLHSVIROSA-N	427.332	1.460	50	20	IDGD	
CC(C)C1(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)CCC1	1813664590	JRRCAXITLGJPTD-IRLDBZIGSA-N	449.360	1.907	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(=O)n3[nH]nnc3n2)n[nH]1	1817812397	FPTRBBPXQYDNNM-ZWNOBZJWSA-N	447.887	1.249	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)COC(C)C)[nH]n1	1818110333	AHPJEHISDNHZTD-PTZPRWATSA-N	443.508	1.961	50	20	IDGD	
COc1cccc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)CCC(=O)NN(C)C)CC3)c1	1822099765	FHDUEGKHHKKIBH-CQSZACIVSA-N	445.545	1.751	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2n[nH]cc2[N+](=O)[O-])[nH]n1	1822372810	NLCYLAZMQHHLDX-ONGXEEELSA-N	425.833	1.601	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](C)n2cnnn2)n[nH]1	1822863287	MGICEGVQIFZKRX-HOSYDEDBSA-N	425.291	1.433	50	20	IDGD	
O=C(CSc1nc[nH]n1)Nc1nc2c(s1)C[C@@H](NC(=O)CCBr)CC2	1826667500	QTXCNBSJKFYNTD-QMMMGPOBSA-N	445.368	1.751	50	20	IDGD	
Cc1cccc(CC(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)n1	1827049049	HQUZMLODMMBFDY-HSZRJFAPSA-N	449.360	1.546	50	20	IDGD	
O=C(CCOc1ccc(F)cc1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1830254175	DZKCRVLGODABHF-IEBWSBKVSA-N	432.851	1.585	50	20	IDGD	
CC1CCN(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)CC1	1830353640	IEJWMQCXBCQGQZ-OAQYLSRUSA-N	429.989	1.440	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@](C)(O)C(F)(F)F)C2)C1	1830358157	MMHKEFKOHJCKQJ-HOTGVXAUSA-N	430.851	1.021	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3N(C)C)C2)C1	1831643864	JICMWNKQJGEMDN-UWJYYQICSA-N	438.956	1.625	50	20	IDGD	
Cn1ncc2c(C(=O)N3CCC(N4CCC(NC(=O)[C@@H](O)CCl)CC4)CC3)cccc21	1833310627	VUELHDPXCSHDPI-FQEVSTJZSA-N	447.967	1.358	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccn3C)CCO2)C1	1833905416	LKZZSSDCRDAQOT-KBXCAEBGSA-N	428.327	1.126	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)CCBr)C3)C2)c(C)o1	1834089832	BJPOGAJLZQSNIO-SFHVURJKSA-N	429.311	1.751	50	20	IDGD	
COc1cnc(C(=O)NC2CCN(C3CCN(C(=O)CO[Si](C)(C)C)CC3)CC2)cn1	1834316518	BUFOPPRFVCPANP-UHFFFAOYSA-N	449.628	1.522	50	20	IDGD	
CN1CCC(C(=O)N2CCC(N3CCC(NC(=O)CCBr)CC3)CC2)CC1	1834421670	QBEGRASCEPYBON-UHFFFAOYSA-N	443.430	1.685	50	20	IDGD	
Cc1cc(CC(=O)N2CCC(N3CCC(NC(=O)[C@H](F)Br)CC3)CC2)on1	1836413558	JEHFRCJITVXUTC-KRWDZBQOSA-N	445.333	1.788	50	20	IDGD	
O=C(CCBr)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836716625	GSDGFVNXSAREBN-CQSZACIVSA-N	425.751	1.370	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](C)n3ccnc3)CC2)CC1	1836779967	JQSOSBNQGXAQGB-QAPCUYQASA-N	426.945	1.697	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc4ncnn4c3)CCO2)C1	1837164630	LEYWCELGJIPZIX-FQEVSTJZSA-N	435.912	1.064	50	20	IDGD	
CN(C)c1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)cn1	1838198950	YAQDXAIFTSAHNA-GOSISDBHSA-N	431.320	1.021	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(O)c(F)c3)C2)C1	1839154746	XCVAVPCHYVDGQE-MOPGFXCFSA-N	449.306	1.838	50	20	IDGD	
CO[C@@H](C)C(=O)N1CCOC[C@@]2(CN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)CCO2)C1	1839744229	VWCUWBJUEBVLQI-UDVCIYDASA-N	449.454	1.363	50	20	IDGD	
Cc1onc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)c1C	1840030120	AOHMHCHCWQIZRM-YVEFUNNKSA-N	430.299	1.145	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)c3ccccc3)C2)C1	1840030846	YCNPDFIVTFCLDZ-QOKNQOGYSA-N	443.313	1.937	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)cc1O	1840034233	FOXMGEWBCOIXHN-KUHUBIRLSA-N	441.322	1.554	50	20	IDGD	
COc1cccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)c1C	1840070504	VVLQHSJHEGATHN-QUCCMNQESA-N	428.888	1.537	50	20	IDGD	
O=C(Cc1cccc(Cl)n1)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840186609	RKRAAFRCJCOSSD-KRWDZBQOSA-N	436.723	1.538	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(CN(C(=O)CC[C@H]3CCOC3)CCO2)C1	1840588767	POYLOXYERGRJMJ-FXAWDEMLSA-N	428.602	1.111	50	20	IDGD	
C[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1)c1ccccc1	1840892979	OVJZBYYEXCPPLS-GMBSWORKSA-N	443.313	1.937	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)[C@H]2[C@H]3c4ccccc4S[C@H]32)C1	1844275954	WHWUREVMCFFAPE-HSALFYBXSA-N	428.558	1.451	50	20	IDGD	
Cc1ccn2c(=O)c(C(=O)N3CC4(CCCN4C(=O)CO[Si](C)(C)C)C3)cnc2c1	1844378159	MLMQUWJSWVMRIP-UHFFFAOYSA-N	428.565	1.671	50	20	IDGD	
CC(C)Oc1ccc(C(=O)N2CCCC23CN(C(=O)CCC(=O)NN(C)C)C3)cc1C#N	1846880506	IZMIECKOAAFOTG-UHFFFAOYSA-N	441.532	1.535	50	20	IDGD	
CC(C)(C)OC(=O)NCCOCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)C(C)(C)CCl	1847438594	WTNJNLUMKNBHIA-GJZGRUSLSA-N	431.961	1.995	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ccc3nnc(C(F)(F)F)n3n2)CC1)c1ccccc1O	10627241	MQSFMHCZOJBBBC-UHFFFAOYSA-N	449.393	1.526	50	20	IDGD	
O=C(CCn1cnc2sccc2c1=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	116783997	IZBQDTCDOGCWBW-UHFFFAOYSA-N	433.515	1.432	50	20	IDGD	
O=C(NCc1cccc(C(F)(F)F)c1)NNC(=O)[C@H]1CC[C@H](C(F)(F)F)NC1=O	195718468	LWVYBUBEYQZMAT-WDEREUQCSA-N	426.317	1.993	50	20	IDGD	
CC(=NNC(=O)Cc1nc(C)cs1)c1ccc(S(=O)(=O)NCCCC(=O)O)cc1	725857846	BNCNGJCGCUXPAB-UHFFFAOYSA-N	438.531	1.678	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)NCCCc2cnn(C)c2)c2ccccc2c1=O	726851279	KVXCWUDZDUOKCV-UHFFFAOYSA-N	439.520	1.897	50	20	IDGD	
O=C(NNC(=S)NCCc1cccnc1)c1cccc(S(=O)(=O)N2CCCC2)c1	727693219	WTFJHEBCFYPSBH-UHFFFAOYSA-N	433.559	1.218	50	20	IDGD	
O=C(CCCc1ccccc1)NNS(=O)(=O)c1ccc(N2C[C@H](C(=O)O)CC2=O)cc1	727721670	MQNHEPRDADBHJS-MRXNPFEDSA-N	445.497	1.457	50	20	IDGD	
NC(=O)c1ccc(/C=C\C(=O)N2CCC[C@@H]2C(=O)NNc2nc(-c3cccnc3)no2)cc1	728075042	QXLKYCGWYZBBRI-CGQZWFTASA-N	447.455	1.378	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN1c1ncnc2sccc12)c1nnc(O)c2ccccc12	728511774	BITPNQYVGINTHK-AWEZNQCLSA-N	435.469	1.770	50	20	IDGD	
CC(=NNC(=O)C1CCN(c2ncccn2)CC1)c1ccc(O)c(CN2CCOCC2)c1	728783121	ZQYGDFXTKPQIQL-UHFFFAOYSA-N	438.532	1.771	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)NCCn2c(=O)oc3ccccc32)cc1	730127914	PALJWEWWKYGGFZ-CQSZACIVSA-N	428.445	1.791	50	20	IDGD	
C[C@@H]1CCCN(S(=O)(=O)c2cc(C(=O)NNC(=O)c3cccc(N(C)C)c3)n(C)c2)C1	730161274	WVFAVAVUFRBSIC-OAHLLOKOSA-N	447.561	1.587	50	20	IDGD	
C[C@H]1CCCN(S(=O)(=O)c2cc(C(=O)NNC(=O)c3cccc(C#N)c3)n(C)c2)C1	730182311	YZLYEPKVZQUIEB-AWEZNQCLSA-N	429.502	1.392	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)CC[C@@H]2NC(=O)N(c3cccc(C)c3)C2=O)cc1	730830657	SIMXCUREWHXFND-SFHVURJKSA-N	439.472	1.468	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)c2sccc2S(=O)(=O)C(F)F)c1	730962220	NDHHSSIKMWPNSW-UHFFFAOYSA-N	438.455	1.223	50	20	IDGD	
Cc1ccc(-n2nc(C(=O)NNC(=O)N[C@@H]3CCS(=O)(=O)C3)c3c2CCCC3)cc1	731003841	OWBNTCIESAGSPG-CQSZACIVSA-N	431.518	1.191	50	20	IDGD	
NC(=O)c1ccc(/C=C\C(=O)N2CCC[C@@H]2C(=O)NNC(=O)Cc2ccccc2F)cc1	731329903	CLYNIBHQRPEVEO-UZRURVBFSA-N	438.459	1.319	50	20	IDGD	
NC(=O)c1ccccc1N1CC[C@@H](NC(=O)NNC(=O)c2cccc(OC(F)F)c2)C1	732573729	XVIWDGJHQBPMJP-CYBMUJFWSA-N	433.415	1.610	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)N[C@H]2CCN(c3ccccc3C(N)=O)C2)c1	732595684	UQLNHBKVOAHFEA-INIZCTEOSA-N	425.489	1.390	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3cccc(-n4cccn4)c3)cc2)CC1	735115807	PFJVISOJALSFAF-UHFFFAOYSA-N	440.529	1.565	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)CCc2ccccc2Cl)CC1	735117074	AAWUSHSQHQNTCG-UHFFFAOYSA-N	437.953	1.747	50	20	IDGD	
O=C(NNc1cccnn1)c1ccccc1NS(=O)(=O)c1ccc2nc(O)[nH]c2c1	736703962	AXRWTLIITHYZML-UHFFFAOYSA-N	425.430	1.616	50	20	IDGD	
CC(C)[C@@H](Cc1ccccc1)C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	740086543	ZJZSMHOTEUFEJV-LJQANCHMSA-N	445.589	1.976	50	20	IDGD	
CCS(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=O)CCN2C[C@H](C)O[C@@H](C)C2)c1	740922024	NRRJXNGBZKVDOL-STQMWFEESA-N	431.942	1.394	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(CC(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)C(=O)C1	741171915	BXQSDPWQWISBPG-UHFFFAOYSA-N	434.537	1.430	50	20	IDGD	
CS(=O)(=O)[C@H]1CCCCC1=NNC(=O)CN1c2cccc3cccc(c23)S1(=O)=O	741454336	DMFPPTCTDYRKDV-INIZCTEOSA-N	435.527	1.808	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)[C@H](c1cccc(F)c1)N1CCOCC1	741883655	RIVMSBFPKNDCFU-NRFANRHFSA-N	431.464	1.824	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)c2ccc(OC)c(N3CCNC3=O)c2)o1	742053908	AHGHMODESFGBHF-UHFFFAOYSA-N	429.477	1.734	50	20	IDGD	
O=C(NNC(=S)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1)NC1CCCC1	743584524	KGDWFDRELJCERA-UHFFFAOYSA-N	427.552	1.151	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)NNC(=O)c2cccc(C#N)c2)cc1Cl	743590664	VBYLLNGSPARKPF-UHFFFAOYSA-N	432.824	1.910	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)NC3CCCC3)CC2)cc1	744052779	STTSIZCKJPYYHW-UHFFFAOYSA-N	436.534	1.563	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)CNC(=O)c2ccc(C(F)(F)F)cc2)c1	744565111	TWSPECZEHJCQAT-UHFFFAOYSA-N	437.374	1.748	50	20	IDGD	
CC(C)[C@H](NC(=O)c1cccs1)C(=O)OCC(=O)NNC(=O)c1cccc(C#N)c1	744612426	DVRXINZQNAEHDD-KRWDZBQOSA-N	428.470	1.379	50	20	IDGD	
C[C@@H]1CN(c2ccc(C(=O)OCC(=O)NNC(=O)c3ccc(C#N)cc3)cn2)C[C@@H](C)O1	744716079	ZPMONBBGVHKMNY-HUUCEWRRSA-N	437.456	1.185	50	20	IDGD	
C[C@H](CC(=O)c1cccc(F)c1)C(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	745396162	GCCZFIJGHUCQQQ-GFCCVEGCSA-N	431.376	1.947	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)NC[C@@H](C)CN1CCN(C)CC1	745859860	FSCBHTUCYVRHAZ-OAHLLOKOSA-N	430.578	1.946	50	20	IDGD	
NC(=O)COc1cccc(CNC(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)c1	745900207	SUJFLTGTWUEXIS-UHFFFAOYSA-N	446.407	1.671	50	20	IDGD	
CCn1nc(C(=O)NN=Cc2cnc3cnc(Br)cn23)c2ccccc2c1=O	746371570	XSALAZKGNKECFN-UHFFFAOYSA-N	440.261	1.986	50	20	IDGD	
NC(=O)[C@@H]1CCCN1Cc1cccc(NC(=O)NNC(=O)CCOc2ccccc2)c1	747099855	NIHJBPVTLGJDJH-IBGZPJMESA-N	425.489	1.758	50	20	IDGD	
C[C@]1(c2ccc3ccccc3c2)NC(=O)N(CC(=O)NNC(=O)Cc2ccncc2)C1=O	747324851	MLAHWRWDAYVQMS-HSZRJFAPSA-N	431.452	1.392	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)c1ccc(F)c(S(N)(=O)=O)c1	748593713	KRGFYUZDHKEZFB-UHFFFAOYSA-N	444.510	1.307	50	20	IDGD	
CCOC(=O)c1ccc(N2CC(NC(=O)NNC(=O)c3ccc(Cl)cc3F)C2)nc1	753283679	MFGHLOYHBVBANG-UHFFFAOYSA-N	435.843	1.884	50	20	IDGD	
COC(=O)c1cc2c(cc1NC(=O)C(=O)NNc1nc(C(F)(F)F)cs1)OCO2	753850465	GHAQPEWHCJDOFH-UHFFFAOYSA-N	432.336	1.759	50	20	IDGD	
CON(C)S(=O)(=O)c1ccc(NC(=O)NNC(=O)Cc2c[nH]c3ccccc23)cc1	755534472	MKSVTEQTORUDOG-UHFFFAOYSA-N	431.474	1.745	50	20	IDGD	
CCOCCCn1c(NNC(=O)c2cc(S(N)(=O)=O)c(C)o2)nc2ccccc2c1=O	756102177	MVKDAQYEJKPFBH-UHFFFAOYSA-N	449.489	1.129	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)Nc1ccc(Oc2ccc(Cl)nn2)cc1	756561211	CKGCEKNQNMSCIE-SNVBAGLBSA-N	425.854	1.510	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)N[C@H](C)c2ccc([S@@](C)=O)cc2)nc1	756721320	GFRKRFCGLWFGGA-DBDZUICISA-N	439.563	1.893	50	20	IDGD	
Cc1cnn(-c2ccc(C(N)=O)cc2NC(=O)NNC(=O)COc2ccccc2F)c1	757878292	YFDAYXIPUQYKIM-UHFFFAOYSA-N	426.408	1.650	50	20	IDGD	
CC(C)CCn1nc(C(=O)NNC(=O)Nc2nccn(C)c2=O)c2ccccc2c1=O	757904845	MUTAMVLYKYCTRG-UHFFFAOYSA-N	425.449	1.003	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)c1cccc(S(=O)(=O)NCC2CC2)c1	760439301	BXNPLEYOAHIECM-UHFFFAOYSA-N	440.522	1.051	50	20	IDGD	
C#CCNS(=O)(=O)N1CCN(CCP(=O)(c2ccccc2)c2ccccc2)CC1	761024812	PTTHGNKNCGRANN-UHFFFAOYSA-N	431.498	1.086	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)COc1ccccc1[N+](=O)[O-])c1cn(-c2ccccc2)nn1	761785360	HOUYJMKEYVLJQR-CYBMUJFWSA-N	425.405	1.646	50	20	IDGD	
CN(C)C(=O)C[C@H]1CN(C(=O)C(=O)NNC(=O)c2ccccc2)c2ccc(Cl)cc21	763424671	CXKSNONXAJTFRB-AWEZNQCLSA-N	428.876	1.710	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c(OCCN(C)C)c1	763443257	YYMIMXIKAQEXGF-UHFFFAOYSA-N	429.433	1.243	50	20	IDGD	
O=C(NNC(=O)c1ccc2ccccc2n1)C(=O)Nc1ccccc1CN1CCOCC1	763455051	MYJSSNIXYVWRNB-UHFFFAOYSA-N	433.468	1.467	50	20	IDGD	
O=C(NNC(=O)c1ccc2ccccc2n1)C(=O)Nc1ccc2nc3n(c(=O)c2c1)CCC3	763456299	ZOCSZPVDYRAOPJ-UHFFFAOYSA-N	442.435	1.291	50	20	IDGD	
COCC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2cc3ccccc3cc2O)cc1	763524201	XUPLVKOTXYMBNO-UHFFFAOYSA-N	436.424	1.530	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccc3nc(C)oc3c2)cc(OC)c1OC	763540377	UJEABHLUQNIQFN-UHFFFAOYSA-N	428.401	1.562	50	20	IDGD	
CS(=O)(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)c2c[nH]c3ccccc23)c1	763541007	NGBAUQHTUFMABA-UHFFFAOYSA-N	434.861	1.625	50	20	IDGD	
COc1c(Cl)cc(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1Cl	763578804	QFSVWAZDQDOBKT-AWEZNQCLSA-N	440.239	1.928	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)C(=O)Nc2cnn(-c3ccccn3)c2)c1	763598045	SJOZHISIPRHVSO-UHFFFAOYSA-N	436.472	1.864	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(=O)n(Cc3ccccc3)c2)c1	763619329	SMZYMJMXDCEJSS-UHFFFAOYSA-N	434.452	1.370	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(SC(F)F)nc1	763663376	SNCKUDXQUWHMDR-UHFFFAOYSA-N	426.401	1.570	50	20	IDGD	
CCNC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)COc2ccccc2OCC)c1	763682749	VTCZMGMUKLYWDL-UHFFFAOYSA-N	443.460	1.392	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1	763692778	CKFHTNADQGGKCH-UHFFFAOYSA-N	437.206	1.522	50	20	IDGD	
O=C(CSc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1ccc(-n2cncn2)nc1	763736448	UJIISJRAFAZXCD-UHFFFAOYSA-N	431.865	1.194	50	20	IDGD	
O=C(CC12CC3CC(CC(C3)C1)C2)NNC(=O)C(=O)Nc1ccc2c(c1)NC(=O)CO2	763736929	VCCGNMONCHRQKC-UHFFFAOYSA-N	426.473	1.710	50	20	IDGD	
O=C(NNC(=O)c1cccc(Cl)c1)C(=O)Nc1ccc(S(=O)(=O)NC2CC2)cc1	763748593	VDZBIKJJWJAULI-UHFFFAOYSA-N	436.877	1.180	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2cccc(NC(=O)C(C)C)c2)c1	763773497	YNBGZYAYSQUECM-UHFFFAOYSA-N	428.445	1.698	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)C(=O)Nc2cc(F)c(F)cc2Cl)c2ccccc2c1=O	763790822	PKXCHRNAOOXPLT-UHFFFAOYSA-N	435.774	1.265	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(F)c(-n3nnnc3C3CC3)c2)cc1	763831826	NJXRGWPXBYFYQR-UHFFFAOYSA-N	437.435	1.641	50	20	IDGD	
Cc1ccc(N2CCOC2=O)cc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccc(F)cc1	763871678	HBNZVLBOVGKMCA-ZDUSSCGKSA-N	444.419	1.644	50	20	IDGD	
COc1cc(C)c(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(C(C)=O)cc2)cc1OC	763872294	NKURCPDRFDVKAK-AWEZNQCLSA-N	443.456	1.768	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2cc(C)n(-c3cccc(Cl)c3)n2)n1	763891235	NFWUGLAJNQFZCW-UHFFFAOYSA-N	429.868	1.434	50	20	IDGD	
C[C@H](c1cccc(NC(=O)C(=O)NNC(=O)Cc2ccc(F)cc2)c1)N1CCOCC1	763921125	QZSBKUBPKQSULI-OAHLLOKOSA-N	428.464	1.548	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)on1)C(=O)Nc1cccc(CN2CCOC2=O)c1	764004208	UTLSXWQWZUTLRE-UHFFFAOYSA-N	449.423	1.694	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1ccccc1Cn1cncn1	764012238	MZGSRLFEMRDCJN-UHFFFAOYSA-N	428.836	1.388	50	20	IDGD	
CC(C)Oc1ccc(C#N)cc1NC(=O)C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	764077780	NHNLESVHKBTHHJ-UHFFFAOYSA-N	444.469	1.149	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc(O[C@H]4CCOC4)cc3)n[nH]2)cc1	764109748	AZCMVGJPAGQRII-SFHVURJKSA-N	449.467	1.953	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1O)C(=O)Nc1ccc2nc3n(c(=O)c2c1)CCC3	764117771	RLWOBLCZEXZJQE-UHFFFAOYSA-N	441.831	1.101	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1cccc(C(=O)N2CCCCC2)c1	764130572	KHVIGZATGVEGNA-UHFFFAOYSA-N	438.484	1.650	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(CCC(=O)N3CCCC3)cc2)cc1	764181515	FBTHOADHNJXHOY-UHFFFAOYSA-N	433.468	1.513	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)N3CCCCCC3)cc2)c1	764234717	IDMHNWZOEWRICA-UHFFFAOYSA-N	433.468	1.974	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3cccc(C#N)c3)cc2F)C[C@@H](C)O1	764234822	KTLBTYDNMCCPKN-OKILXGFUSA-N	439.447	1.711	50	20	IDGD	
CC(C)(C)NC(=O)c1cccc(NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)c1	764239072	DCNKNRHEPSKAAR-UHFFFAOYSA-N	435.484	1.956	50	20	IDGD	
CC(C)C[C@@H](C)n1nccc1NC(=O)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	764261037	WAJDJJFYOUKQEF-OAHLLOKOSA-N	442.524	1.283	50	20	IDGD	
CCN(Cc1ccccc1NC(=O)C(=O)NNC(=O)CCc1ccccc1O)C(C)=O	764280499	AJYXSUSHJNRCFU-UHFFFAOYSA-N	426.473	1.479	50	20	IDGD	
Cc1ccc(Cn2nccc2NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)o1	764376268	AUPVBFMHZNDNFK-UHFFFAOYSA-N	439.457	1.684	50	20	IDGD	
COc1cc(OC)c(NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)cc1F	764377331	CEADLXHUXYYFTM-UHFFFAOYSA-N	427.335	1.601	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1cc(C(C)(C)C)nn1-c1ccc(F)cc1	764398389	GQSBNFVKBSJKAC-ZDUSSCGKSA-N	449.483	1.446	50	20	IDGD	
CCOc1ccc(Oc2ccccc2NC(=O)C(=O)NNC(=O)[C@H]2COCCO2)cc1	764435440	VDLWPWDSVLNWMQ-GOSISDBHSA-N	429.429	1.379	50	20	IDGD	
COc1nccnc1NNC(=O)C1CCN(S(=O)(=O)c2cccnc2Cl)CC1	764481213	AMZISRLSIBVCOT-UHFFFAOYSA-N	426.886	1.078	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)c1ccc(CN2C(=O)CCC2=O)cc1	765310658	JPWHXVTXFHJVGY-UHFFFAOYSA-N	432.477	1.402	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2cccs2)[nH]n1)c1cccc(S(=O)(=O)NC2CC2)c1	765569049	DDGPDPOZCKACRM-UHFFFAOYSA-N	431.499	1.654	50	20	IDGD	
CNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cc(-c3cc(C)ccc3C)[nH]n2)cc1	765577937	YWLGRWCJJOICHM-UHFFFAOYSA-N	427.486	1.676	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)CCNC(=O)C3CCCCC3)n[nH]2)cc1OC	765597622	VPIKRHXFQSWCEC-UHFFFAOYSA-N	443.504	1.942	50	20	IDGD	
CN(C)c1ccc(CCC(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cc1	766637065	WJLSLEBKRHDJSM-UHFFFAOYSA-N	437.544	1.291	50	20	IDGD	
COc1cc2c(cc1NC(=O)C(=O)NNC(=O)COc1cc(C)ccc1C)NC(=O)CC2	768231889	IAVMINNDWTYYFV-UHFFFAOYSA-N	440.456	1.362	50	20	IDGD	
COc1ccc(Br)c(CC(=O)NNC(=O)CNC(=O)c2cccs2)c1	768571203	ODOPXVZQFSLDBS-UHFFFAOYSA-N	426.292	1.639	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)CN1C(=O)N[C@@]2(CCCC[C@H]2C)C1=O	768635279	XCWAORVZDSHXQL-CWTRNNRKSA-N	438.506	1.043	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1cccc(C(F)(F)F)c1)C(=O)NNc1ccnc(N(C)C)n1	771022019	ISXSCJREKXUKAF-SNVBAGLBSA-N	432.428	1.372	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)COc1ccc(C=O)cc1Br	772168554	YUTAMAPOHUQRGN-LLVKDONJSA-N	429.267	1.766	50	20	IDGD	
CS(=O)(=O)c1cc(C(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)ccc1Cl	772192678	OQNWMDXSBFLMJQ-UHFFFAOYSA-N	444.296	1.474	50	20	IDGD	
C[C@H](C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1)c1cn(C)c2ccccc12	772845322	RTDBSHDPKODBJO-XOBRGWDASA-N	437.452	1.812	50	20	IDGD	
C[C@H](CNC(=O)NNc1cccc(S(C)(=O)=O)c1)N1CCN(c2ccccc2)CC1	776616591	IATMDFKYLKFKSM-QGZVFWFLSA-N	431.562	1.927	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNS(=O)(=O)c1ccc(Br)c(F)c1	777939223	JZWKNWXMACTFCI-UHFFFAOYSA-N	426.264	1.422	50	20	IDGD	
COC(=O)[C@H]1C[C@H](OC)CCN1C(=O)CCC(=O)C(C#N)=C1N(C)c2ccccc2N1C	778456013	IBXGIPHNBVTKMY-DNVCBOLYSA-N	440.500	1.836	50	20	IDGD	
C#CCCCCCC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	779718468	FCBMIVPUSMUVGT-UHFFFAOYSA-N	435.546	1.371	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)NCC1CCN(CC(F)(F)F)CC1	780628720	RMVCQCXVJKEJAB-UHFFFAOYSA-N	433.387	1.578	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCc2ccc(C)nc2N2CCCC2)c2ccccc2c1=O	781385497	BIPOTEVKKBOBQT-UHFFFAOYSA-N	449.515	1.864	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)Nc3ccc([N+](=O)[O-])cc3)nc2)CC1	781946979	LUPVIWMXVKSODW-UHFFFAOYSA-N	435.466	1.075	50	20	IDGD	
CCC[C@H]1CN(C(=O)OC(C)(C)C)CCN1CC(=O)NNC(=O)Cc1nc(C)cs1	782095705	MJKYEROCDRVCMM-HNNXBMFYSA-N	439.582	1.863	50	20	IDGD	
O=C(NNc1ncncc1Cl)C(=O)Nc1ccc2c(ccn2CCN2CCOCC2)c1	782167002	SMBLRALEGXEYNW-UHFFFAOYSA-N	443.895	1.499	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(-c3cnn(C)c3)ccc2F)c1	782537926	OFRYSJPONXPQIG-UHFFFAOYSA-N	445.476	1.551	50	20	IDGD	
COC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(NC(=O)NNC(=O)C3CCC3)cc2)C1	782549841	LEAVAUCZLJYAJR-CQSZACIVSA-N	438.506	1.213	50	20	IDGD	
Cc1cc(-c2ncccc2NC(=O)C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cs1	782703235	WSJAANXURBXLAK-UHFFFAOYSA-N	448.468	1.494	50	20	IDGD	
Cc1cc(C(=O)NCC(=O)NNC(=O)c2cccc(Br)c2)ccc1[N+](=O)[O-]	782710525	HHBFHFVQEXXHPH-UHFFFAOYSA-N	435.234	1.857	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2ccc(O)cc2)cccc1S(=O)(=O)NC(C)(C)C	782830323	HMXRUXIUZVMBSH-UHFFFAOYSA-N	448.501	1.177	50	20	IDGD	
CCCOC(=O)c1ccc(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)cc1	782893361	IVPGIDYDWXHOJO-UHFFFAOYSA-N	437.456	1.469	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2ccccc2Oc2cc(F)cc(F)c2)CCS(=O)(=O)C1	783428349	VBMZGYPAQOXKJC-IBGZPJMESA-N	439.440	1.894	50	20	IDGD	
CCc1ccccc1OCC(=O)NNS(=O)(=O)c1ccc([N+](=O)[O-])cc1C(=O)OC	783805645	JUUCGXBKURBWAF-UHFFFAOYSA-N	437.430	1.332	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2cc(-n3cnnn3)ccc2F)ccc1Br	783923168	OJHGJAFQVJBZJO-UHFFFAOYSA-N	434.229	1.954	50	20	IDGD	
CCOc1ccc(C(=O)N2CCCCC2)cc1NC(=O)C(=O)NNc1ccc(C)nn1	783948690	BNBGEEIRBYESSY-UHFFFAOYSA-N	426.477	1.892	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)C(=O)Nc1ccccc1COc1ccccc1	784002917	WZXQBISNHQPQRW-UHFFFAOYSA-N	436.424	1.375	50	20	IDGD	
CC(C)(C)Oc1cc(F)ccc1NC(=O)C(=O)NNC(=O)CNC(=O)c1cccs1	784003276	CUXLAMDZHMZBKQ-UHFFFAOYSA-N	436.465	1.580	50	20	IDGD	
Cc1c(NNC(=O)C(=O)Nc2ccc(CN3C(=O)CCC3=O)cc2)cccc1[N+](=O)[O-]	784357825	KIKIWONUIMSJLV-UHFFFAOYSA-N	425.401	1.634	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNc2cccc(S(C)(=O)=O)c2)c(OC)cc1Cl	784839673	NQSYDGAALNDQKR-UHFFFAOYSA-N	427.866	1.843	50	20	IDGD	
CCCCOc1ccc(OC)cc1NC(=O)C(=O)NNC(=O)c1cc([N+](=O)[O-])ccc1O	785022763	JMAFFBUZYADMAA-UHFFFAOYSA-N	446.416	1.888	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2nc(C(F)(F)F)cs2)cc1NS(C)(=O)=O	785145547	GNQUZJFJMDEEEK-UHFFFAOYSA-N	437.425	1.924	50	20	IDGD	
CCNC(=O)Nc1ccc(C)c(NC(=O)C(=O)NNC(=O)COc2ccc(C)c(C)c2)c1	787540648	CCLANSWKCRXVSD-UHFFFAOYSA-N	441.488	1.918	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2cc(-c3ccsc3)nn2C)c1	787541014	IJBXPQICVBUPET-UHFFFAOYSA-N	427.486	1.930	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2cc(-c3ccsc3)nn2C)c1	787541490	SUMPMXGBSOBALO-UHFFFAOYSA-N	427.486	1.930	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NC[C@H]2CCCN(c3ccccc3)C2)c2ccccc2c1=O	789313483	CQZAWBBVRWNFNR-MRXNPFEDSA-N	434.500	1.794	50	20	IDGD	
CN(Cc1ccccc1NC(=O)C(=O)NNC(=O)CNC(=O)c1ccco1)c1ccccc1	789758268	RRYYHSBFHVZNMR-UHFFFAOYSA-N	449.467	1.432	50	20	IDGD	
COc1cc(NNC(=O)C(=O)Nc2ccccc2C(=O)N2CCOCC2)ccc1Cl	789796432	UXXLXGSVOLWTHV-UHFFFAOYSA-N	432.864	1.903	50	20	IDGD	
O=C(NNS(=O)(=O)c1cccc(S(=O)(=O)N2CCCCCC2)c1)c1ccccc1	790382217	OUCJJYCOZSHRHB-UHFFFAOYSA-N	437.543	1.875	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1cc([C@H]2CCCOC2)nn1C	790952321	QWLMGCZPKFGGGL-NSHDSACASA-N	435.868	1.376	50	20	IDGD	
O=C(NNc1cccc(F)c1[N+](=O)[O-])C(=O)Nc1ccc(S(=O)(=O)C(F)F)cc1	790999791	FLZIICIVOGOBSF-UHFFFAOYSA-N	432.336	1.812	50	20	IDGD	
CN(C)N(C(=O)CCNS(=O)(=O)c1ccc2ccccc2c1)[C@@H]1CCS(=O)(=O)C1	792855086	OGMBBXKGKCIUJQ-QGZVFWFLSA-N	439.559	1.001	50	20	IDGD	
Cn1ccc2ccc(NC(=O)C(=O)NNC(=O)c3cccc(Br)c3)cc2c1=O	793026845	UAPMYZOFJIQDDQ-UHFFFAOYSA-N	443.257	1.701	50	20	IDGD	
CCC(=O)c1ccc(Cl)c(S(=O)(=O)NNC(=O)CNC(=O)c2cccs2)c1	794583499	ASNHENNOPNQCSK-UHFFFAOYSA-N	429.907	1.734	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)c2ccccc2)(S(C)(=O)=O)CC1	794740426	QEYQMSQAMROINM-UHFFFAOYSA-N	425.507	1.262	50	20	IDGD	
C=C(CBr)COC(=O)[C@@H](NS(=O)(=O)c1ccc(Cl)cc1)[C@H](C)O	795321826	YXHNIWBZATWMHM-GWCFXTLKSA-N	426.716	1.862	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1ccnc(NC(=O)C2CC2)c1	796841139	QUSMUOXZXVXLMP-UHFFFAOYSA-N	445.501	1.208	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNC(=O)C(=O)Nc1nc2c(s1)CCCC2	797368872	IGHAIWISMWQPKN-UHFFFAOYSA-N	431.474	1.034	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)Nc1cc(S(=O)(=O)N2CCCC2)ccn1	797673584	GZIUFPWDGDWNKM-UHFFFAOYSA-N	433.490	1.357	50	20	IDGD	
O=C(NCC(F)(F)F)NNC(=O)[C@H]1CCC(=O)N1Cc1ccc(Br)cc1	798315530	JUOPSRQWPNEVHN-LLVKDONJSA-N	437.216	1.833	50	20	IDGD	
CN1C(=O)COc2cc(NC(=O)C(=O)NNC(=O)CC34CC5CC(CC(C5)C3)C4)ccc21	799257670	OLZOSVITEDBXRJ-UHFFFAOYSA-N	440.500	1.734	50	20	IDGD	
CC(C)(C)[C@@H](NC(N)=O)C(=O)NNC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1	800324287	SMMHYHQRWLMHAO-INIZCTEOSA-N	435.488	1.778	50	20	IDGD	
O=C(NNC(=O)C1CCN(S(=O)(=O)c2cccnc2)CC1)Nc1ccc2c(c1)OCO2	802102329	MDKFRAPNJQOKPU-UHFFFAOYSA-N	447.473	1.064	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)[C@@H]2CCN(c3ccc(C#N)cc3F)C2)cc1	805589611	KZDGRDRHTGSCJU-QGZVFWFLSA-N	435.415	1.400	50	20	IDGD	
COC(=O)c1cc(NC(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)c(C)cc1Br	806740589	TYBAPFMKYWARQJ-SECBINFHSA-N	448.295	1.132	50	20	IDGD	
CCN(C)C(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(C)cc3)[nH]n2)c1	806976695	VMINHQLGUAFGMY-UHFFFAOYSA-N	448.483	1.877	50	20	IDGD	
C[C@@H](CCNS(=O)(=O)c1ccccc1)NC(=O)NNc1ccc2c(=O)[nH]ccc2c1	807218411	BKCUENKQYVGOAO-AWEZNQCLSA-N	429.502	1.911	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)C(=O)Nc1ccc(C(=O)Nc2ccccc2)cc1	807429170	NGEQEHBZEZQRDQ-UHFFFAOYSA-N	442.439	1.996	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cccc(OC)c2O)cc2[nH]ccc12	808934476	HAXLMOFSYVTCER-UHFFFAOYSA-N	426.385	1.068	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2ccc3c(c2)SCC(=O)N3)ccc1Cl	809982580	KKABRYNCZADDKN-UHFFFAOYSA-N	440.890	1.106	50	20	IDGD	
CC(=O)N[C@H](CC(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1)c1ccc(F)cc1F	812732147	UOOVKQCANZDPIB-GOSISDBHSA-N	440.472	1.926	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)cc1OC	813033993	UOFGWGJDOITWPR-UHFFFAOYSA-N	436.490	1.426	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H](C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)C[C@H]2C[C@H]21	815257198	FJUNMUWONFKRAM-JLZZUVOBSA-N	436.534	1.968	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@H](CS(C)(=O)=O)c2ccccc2)c2ccccc2c1=O	816806332	YYHAQOOYNIVHRV-QGZVFWFLSA-N	442.497	1.006	50	20	IDGD	
CCOc1ccc(NNC(=O)Cc2ccc(OC)c(S(=O)(=O)N3CCOCC3)c2)cc1	817925593	JHIAUGOLRSWZNJ-UHFFFAOYSA-N	449.529	1.801	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)[C@H]2CC(=O)N(c3cc(Cl)ccc3OC)C2)c1	825781921	LCBJEQGDRGHIMN-ZDUSSCGKSA-N	446.891	1.970	50	20	IDGD	
COc1cccc([C@@H](CNC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)N(C)C)c1	838524595	MZWMJLRCPFIHOC-GOSISDBHSA-N	438.488	1.833	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)c2ccc3c(c2)C(=O)N(C[C@@H]2CCCO2)C3=O)cc1	864017140	SYXDMKYLKHWXRB-KRWDZBQOSA-N	448.435	1.173	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)CNS(=O)(=O)c2cccc(F)c2)cc1	912839848	IAZDBBPTMLQLMB-CYBMUJFWSA-N	439.465	1.118	50	20	IDGD	
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC(=NNC(=O)c2nnc(O)c3ccccc23)CC1	914559150	ARXOIFFMGVHSBU-UHFFFAOYSA-N	443.489	1.246	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN1C(=O)c1cc(Cl)ccc1Cl)[C@@H]1CCS(=O)(=O)C1	914719720	ONEDJRVFEFYDJU-QMTHXVAHSA-N	448.328	1.180	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)CCS(=O)(=O)c2ccc3c(c2)CCC3)cc1	915479014	XJNSGLFZBVBIIR-UHFFFAOYSA-N	444.509	1.652	50	20	IDGD	
Cc1nnnn1[C@@H](Cc1cccc(F)c1)C(=O)NNC(=O)[C@@H](C)Oc1ccccc1F	915697596	SNPDAXNQKZKSNL-PXAZEXFGSA-N	430.415	1.658	50	20	IDGD	
Cc1cc(C=NNC(=O)[C@H](C)CN2C[C@H](C)O[C@H](C)C2)c(C)n1CCN1CCOCC1	915954498	GDKXOWSRBUYXME-RLLQIKCJSA-N	433.597	1.633	50	20	IDGD	
COc1cc(-n2cnnn2)c(Cl)cc1C(=O)NNC(=O)c1ccc2c(c1)OCCO2	916043905	CVDFMNUACGFXQQ-UHFFFAOYSA-N	430.808	1.170	50	20	IDGD	
CCN(CC)Cc1ccccc1CNC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	916216925	YKBGSRVWRUGXOG-UHFFFAOYSA-N	436.516	1.920	50	20	IDGD	
CC(=NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1ccccc1[N+](=O)[O-]	916258177	MOUKRQAAWWHACJ-UHFFFAOYSA-N	432.458	1.770	50	20	IDGD	
CC(=NNC(=O)[C@@H](C)CN1C[C@H](C)O[C@H](C)C1)c1ccc(O)c(CN2CCOCC2)c1	916365903	MOTIGTYSPLDUKU-OKZBNKHCSA-N	432.565	1.810	50	20	IDGD	
NC(=O)c1cc(C(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)c[nH]1	916736893	XSBQBAAZRQMNOW-UHFFFAOYSA-N	433.471	1.051	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccnc(C)n2)c1	917391842	JCOCVVUMQUNGIM-UHFFFAOYSA-N	441.469	1.669	50	20	IDGD	
Cc1ccc([C@H](CNC(=O)NNC(=O)COc2ccccc2F)N2CCOCC2)cc1	918099567	UPVURLANCQALLO-IBGZPJMESA-N	430.480	1.917	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)c1ccc(F)c(S(=O)(=O)N(C)C)c1	918682275	QNENCKXLLKVZEQ-UHFFFAOYSA-N	447.492	1.449	50	20	IDGD	
COCCNC(=O)/C(C#N)=C/c1cn(CCC(N)=O)nc1-c1ccc(Br)cc1	920847000	AOBQZIUJMADKRE-GXDHUFHOSA-N	446.305	1.858	50	20	IDGD	
O=C(CN1CCN(C(=O)Cc2ccccc2F)CC1)NNC(=O)c1ccccc1Cl	921191855	RTTRBCVJGCTUMC-UHFFFAOYSA-N	432.883	1.627	50	20	IDGD	
NC(=O)NN=Cc1cc(I)cc(I)c1O	1317773148	URSRIPCGBATCLM-UHFFFAOYSA-N	430.971	1.604	50	20	IDGD	
O=C(NCC1(N2CCOCC2)CCCCC1)NNC(=O)c1cncn1-c1ccccc1	1317899014	KHGIBQJKXDIOQD-UHFFFAOYSA-N	426.521	1.851	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2ccccc2N2CCCC2=O)cc1	1337181579	VHWSKKMPPDJNLF-UHFFFAOYSA-N	444.513	1.204	50	20	IDGD	
CCc1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)CCBr)C3)n[nH]1	1777728785	XIVNDBRSAHWAPP-CRAIPNDOSA-N	427.343	1.885	50	20	IDGD	
Cc1nc2ncccn2c1C(=O)N1CC[C@@]2(CN(C(=O)CCBr)CCO2)C1	1777897885	DQSGGPQKHAYSTE-GOSISDBHSA-N	436.310	1.266	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)Cc2cnc[nH]2)C1	1777991829	ULAQMCVOGNITCL-JCKWVBRZSA-N	427.343	1.497	50	20	IDGD	
O=C(c1cn2ccc(Cl)cc2n1)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1778057631	KZTLHMYMKFJANC-KDOFPFPSSA-N	427.288	1.031	50	20	IDGD	
Cc1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](F)Cl)C3)ncc1[N+](=O)[O-]	1778248602	RBMFYHMQESHQMK-IIDMSEBBSA-N	428.848	1.960	50	20	IDGD	
COc1nccc(C(=O)N2CCO[C@@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)c1F	1779296088	JLJCNGQKWOQPKC-LJQANCHMSA-N	425.533	1.524	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(OC)cn1)C2	1782172377	APSMMPDFOZWCRP-WRWLIDTKSA-N	425.913	1.472	50	20	IDGD	
CCOC(CC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](Cl)COC)C1)OCC	1782180097	RRHXKUCZQOVYHR-RZQQEMMASA-N	434.961	1.543	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3c4c(nn3C)CCC4)C2)C1	1782440427	AZNUUMBKLWVHKI-KZULUSFZSA-N	425.327	1.136	50	20	IDGD	
Cn1ncnc1C(=O)N1CCO[C@@]2(CCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1	1782864411	VUYYBZKLMCFVBE-JTVVXKTLSA-N	442.426	1.144	50	20	IDGD	
CNc1nsnc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]21	1783523748	PXVWKEGAFHYQAD-ZGNZKYAMSA-N	436.365	1.409	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2	1783529642	WDMHELQBLDWATC-MJVIPROJSA-N	426.149	1.631	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](C)Br)C3)C2)ncc1[N+](=O)[O-]	1783533970	CGIILLAKWVHKGF-YVEFUNNKSA-N	441.282	1.525	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cccc4c3cnn4C)CCO2)C1	1783534758	YSOQCYWLXWDDGB-ORAYPTAESA-N	435.322	1.800	50	20	IDGD	
O=C(Cc1ccc(Cl)c(F)c1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21	1783814501	SABRJUIBDCPJKN-PYTWLRIVSA-N	433.307	1.601	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cnc4c(Cl)cccn34)CCO2)C1	1783876330	UUARZZKXYBBHKN-KUHUBIRLSA-N	441.315	1.685	50	20	IDGD	
O=C1CCc2ccc(C(=O)N3CCO[C@]4(CCN(C(=O)C(Cl)Cl)C4)C3)nc2N1	1783945316	GMDQRJLSPCGLPF-SFHVURJKSA-N	427.288	1.214	50	20	IDGD	
CCC(=O)N[C@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](Br)CC)C[C@@H]21	1784369270	BQISKJLZZKKMBE-FQKPHLNHSA-N	432.359	1.054	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)N1CC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1785570241	KIMLMKXCNRNXDW-GOSISDBHSA-N	438.352	1.925	50	20	IDGD	
C[C@H](Nc1ccccn1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCBr)[C@H]2C1	1786406047	FHNRMCXNBXDVPB-VGWMRTNUSA-N	439.354	1.647	50	20	IDGD	
CCc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)CBr)C[C@@H]32)n(C)n1	1788941360	PTTUOLOQHMNYBW-RMRKRWHISA-N	441.370	1.607	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C(=C/c3ccco3)NC(C)=O)C[C@@H]21	1789866926	RNSOPHMROIGOEH-RYNGGPEBSA-N	437.924	1.754	50	20	IDGD	
Cc1nccn1[C@@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]2C1	1789872547	IVINYLSZUGZMEP-RWBKLUSOSA-N	431.364	1.969	50	20	IDGD	
Cc1c([N+](=O)[O-])ccc(F)c1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21	1790237432	IJBYVBVJAJICIV-APYUEPQZSA-N	443.859	1.235	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(O)c(O)c(Cl)c3)[C@H]2C1	1790246174	PPCFTTXNMVMIAE-ZAJUMQRFSA-N	447.315	1.598	50	20	IDGD	
CN1CCC[C@H](C(=O)Nc2ccc(C3(NC(=O)c4cccc(B(O)O)c4)CCC3)cc2)C1	1790391634	XWRKVMKSKYRUAH-SFHVURJKSA-N	435.333	1.456	50	20	IDGD	
O=C([C@@H](O)CCl)N1CC[C@H]2CO[C@@H](CNC(=O)C3(c4ccc(Cl)cc4)CC3)[C@H]2C1	1790751332	ZBIQDZAZHJDCFU-MGHWNKPDSA-N	441.355	1.951	50	20	IDGD	
CCN1CCC(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)CBr)C[C@@H]32)CC1	1792293564	YAVOEMKJUVGPLL-UBDQQSCGSA-N	444.414	1.729	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCOc1ccc(F)cc1	1792736720	GNFJJIGFDFRWQN-QOIYZWAUSA-N	428.888	1.438	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)(Cl)Cl)C2	1792872220	SCLKFRKEPXQFTL-DOLQZWNJSA-N	436.561	1.977	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C=C/c1ccc(F)cc1F	1793681800	DJIQWFFNFVWYJL-PXSURDLUSA-N	428.863	1.821	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCc1cccc([N+](=O)[O-])c1	1793700597	VAQNKZUKUJFTFA-UPHUGPLXSA-N	449.580	1.969	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnn(C(C)(C)C)c1Cl	1794430687	BTQJLYXVGWJALK-AYRXBEOTSA-N	447.363	1.749	50	20	IDGD	
CC(C)n1nc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)C(C)(C)CCl)C3)cc1C(=O)O	1794432183	SPUUOHNVDXVXEU-YWVIFJGQSA-N	440.928	1.630	50	20	IDGD	
CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CO[Si](C)(C)C)C2)C(=O)OC(C)(C)C	1795338564	CORAPWANTHVUSA-JLVBRIDZSA-N	443.617	1.294	50	20	IDGD	
O=C1CC[C@@H](C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](Br)Cc2ccccc2)C3)N1	1795703477	QYOSNKSZLZHRAI-ADHGMGHFSA-N	448.361	1.909	50	20	IDGD	
C[Si](C)(C)C#CCCCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1	1796188670	GYYFTUFCINXFRZ-WKCHPHFGSA-N	440.425	1.669	50	20	IDGD	
C[C@@H](O)[C@H](NC(=O)c1ccccc1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](F)Cl	1796804176	HOQAIKCBPDQFJT-NSCXZMNLSA-N	425.888	1.338	50	20	IDGD	
CC(=O)O[C@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C(C)C	1796891986	TVFBDFMJSHKQGF-SHYMGOFDSA-N	445.520	1.346	50	20	IDGD	
Cc1nc2ccncc2cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CO[Si](C)(C)C)C2	1797364497	SDIQNIBLWRBTAY-UPHUGPLXSA-N	442.592	1.993	50	20	IDGD	
Cc1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)n(C(F)F)n1	1798440056	XRHSZTNWWAVNBQ-CLLJXQQHSA-N	447.446	1.151	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)ccc1F)C2	1798441819	MULQUXQAIBEJLT-CLLJXQQHSA-N	427.436	1.095	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(F)cnc1Cl)c1cccc(B(O)O)c1	1798726073	WKTBUEORFLENHA-MUJYYYPQSA-N	431.660	1.120	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc3nccn13)C2	1799279325	IUHFGDFCYKTPNC-AODNKKSCSA-N	425.316	1.774	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)nc(Cl)c1)C2)[C@H](F)Br	1799347105	FDCLQJJIGLXOPT-FQPOAREZSA-N	436.665	1.334	50	20	IDGD	
CC(=O)N/C(=C\c1ccco1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(C)(C)CCl)C2	1799685407	ZZSOKUOQPPUSIR-COSZLBEHSA-N	437.924	1.611	50	20	IDGD	
CC(=O)N[C@@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](O)CCl)C2)c1ccc(F)cc1	1799821214	IRXPOEPYDDOUIB-FLXSYLCISA-N	425.888	1.241	50	20	IDGD	
Cc1ccc([C@@H](C)C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCC(=O)NN(C)C)C3)cc1	1800620890	BRXIPZZFXAUBJK-NSAZKJPHSA-N	430.549	1.061	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCCCCC(C)(C)C	1800672091	ULKGKVCVBAGJNM-OPMZPASUSA-N	438.613	1.946	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2[nH]nc3ccncc23)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803139303	NZSQWCJOFHSJTR-QANKJYHBSA-N	428.880	1.272	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)CCNC(=S)NC)[C@@H]1c1cccnc1	1803692072	PFSHIOYFOCUZHE-SOLBZPMBSA-N	440.013	1.979	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)c2cnc[nH]2)[C@@H]1c1cccnc1	1805571103	FSOTVUBNZDFTQE-ZUPKNDBLSA-N	448.487	1.258	50	20	IDGD	
Cc1nnc(CC(=O)N2CC[C@H](CNC(=O)[C@@H](F)Br)[C@@H]2c2cccnc2)o1	1808661277	HQTGYIXDXHZRTQ-UHOFOFEASA-N	440.273	1.712	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H](CNC(=O)Cn2nccn2)[C@@H]1c1cccnc1	1808920953	YRSGEIKHAMKVPG-UNEWFSDZSA-N	435.326	1.410	50	20	IDGD	
O=C1Cc2cc(C(=O)NC[C@@H]3CCN(C(=O)[C@@H](O)CCl)[C@H]3c3cccnc3)ccc2N1	1809683446	IKJVGWWKDLJUAA-QSFXBCCZSA-N	442.903	1.496	50	20	IDGD	
Cc1nc(C(=O)N2CCC3(CCCN(C(=O)c4cccc(B(O)O)c4)C3)CC2)cs1	1809976919	YHXRARXRFNXEMW-UHFFFAOYSA-N	427.335	1.290	50	20	IDGD	
CCOC(CC(=O)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1)OCC	1809980290	UERIBOQHQFDVEP-UHFFFAOYSA-N	446.353	1.000	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC2(CCCN(C(=O)[C@@H](N)Cc3cscn3)C2)CC1	1810795111	ONJRRPCUTUJIQN-HOTGVXAUSA-N	428.986	1.498	50	20	IDGD	
CC(=O)N[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)[C@](C)(Cl)CCl)[C@@H]1c1cccnc1	1812657693	XCJJRQBWZZXNRK-BMHLXIAXSA-N	429.348	1.848	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)CN2CCCCC2=O)[C@H]1c1cccnc1	1812976004	APVGYXTXFHKZRN-ABSDTBQOSA-N	436.940	1.354	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2cnc(N(C)C)o2)[C@H]1c1cccnc1	1813029510	ODVCXTRRGFPNOQ-ZOBUZTSGSA-N	435.912	1.709	50	20	IDGD	
CC(=O)Nc1cc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)[C@@H](O)CCl)n[nH]2)ccn1	1814871036	IEUJIIYIJYNVDK-CABCVRRESA-N	434.884	1.669	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc3nc(CO)[nH]c3c2)[nH]n1)[C@H](O)CCl	1814871246	LLPSAQYSJFFNGV-HZPDHXFCSA-N	446.895	1.684	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](C)Br)CC2	1820149946	WAUQVDSHPFQNJB-BBBLOLIVSA-N	429.340	1.529	50	20	IDGD	
CCNC(=O)N[C@@H](C)C(=O)N[C@H]1CCc2nc(NC(=O)CO[Si](C)(C)C)sc2C1	1820166038	YZABROSOYRJBBY-RYUDHWBXSA-N	441.630	1.614	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN2CCNC2=N)[nH]n1	1822088133	QHEKWNXBLJBYOM-AAEUAGOBSA-N	440.346	1.415	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCS(C)(=O)=O)[nH]n1	1822192385	SWBAKMUWASDRFK-PWSUYJOCSA-N	435.344	1.620	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)CCc2cnccn2)[nH]n1	1822416845	RFCGSENCLUCTOA-QGZVFWFLSA-N	442.524	1.198	50	20	IDGD	
COC(OC)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)CC1	1824340849	XRKUGDFTBHAXJM-LSPPGFKNSA-N	447.536	1.359	50	20	IDGD	
CC1CCN(CC(=O)N2CCCC[C@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1	1824367020	ZUQWERUORLORJJ-NRFANRHFSA-N	449.640	1.711	50	20	IDGD	
COc1ccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)cn1	1824742105	FNKYPIVHKYKVTR-LJQANCHMSA-N	445.564	1.697	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](C)O)sc2C1	1825623966	KCZLSSHEGJHIBH-MWLCHTKSSA-N	448.457	1.583	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnc3ncccn13)CC2	1826000190	OCFKFFZPPYHDRY-GHMZBOCLSA-N	434.909	1.665	50	20	IDGD	
CC1=C(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)CCO1	1827052949	PUNBKQNJCNRLHL-OAQYLSRUSA-N	426.322	1.294	50	20	IDGD	
CCc1cc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)n[nH]1	1827053147	WPCBJDSFBMQGMS-NRFANRHFSA-N	438.337	1.199	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H](N)Cc2cscn2)CC1	1831833111	LEDPZWBEDSBNNR-FGTMMUONSA-N	443.013	1.886	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnc(N(C)C)o2)CC1	1831871466	FZYPSKFRYYQRAD-KRWDZBQOSA-N	448.568	1.347	50	20	IDGD	
Cc1cnn([C@H](C)C(=O)N2CCC([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)c1	1831876502	GSXOOTYBVPYVKN-QUCCMNQESA-N	446.596	1.745	50	20	IDGD	
O=C(c1ccc(F)s1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1833217636	PJCSNHSWMYDSAQ-IUODEOHRSA-N	439.278	1.648	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCC(N2CCC(NC(=O)Cn3ccccc3=O)CC2)CC1	1834820700	GWHVXVPTNHBAAI-UHFFFAOYSA-N	436.984	1.685	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)/C=C/c3ccccc3)CCO2)C1	1835114822	XAYBFEZFQHEYDI-APJIANLZSA-N	437.334	1.940	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](C)S)CC2)CC1	1836559937	NGQAFGHAHZXJJI-LZCVXGSNSA-N	448.593	1.010	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3F)C2)C1	1837711356	FJTMTQBPVWSPQR-IBGZPJMESA-N	425.533	1.142	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3ccnc(Cl)n3)CC2)CC1	1838460091	CSBVROJREKTZET-HNNXBMFYSA-N	445.347	1.996	50	20	IDGD	
CCOc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)nn1	1838829671	KIAGCZMRSYBCTE-HXUWFJFHSA-N	440.928	1.210	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)c(O)c1	1839203443	LMEDHIBYRREROM-CRAIPNDOSA-N	445.285	1.461	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)c(F)c1	1839260815	HJXHVJSRUOJWGX-LIRRHRJNSA-N	443.313	1.988	50	20	IDGD	
O=C(c1cn2c(F)cccc2n1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1839554974	SXDOAWBGCXQFPM-CRAIPNDOSA-N	428.823	1.078	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)(Cl)Cl)CCO2	1839922358	UXMYDZQMFFNDIK-AWEZNQCLSA-N	447.819	1.665	50	20	IDGD	
Cc1ccc(O)c(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)c1	1840034277	GRDZEDNVYMBJMG-KUHUBIRLSA-N	441.322	1.554	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)c(C)n1C	1840034542	OLGAGQQNKBOZCJ-LIRRHRJNSA-N	442.354	1.495	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccnc3Cl)C2)C1	1840149264	KETIRYRHCCYNRO-KDOFPFPSSA-N	432.304	1.059	50	20	IDGD	
O=C(Cc1cccc(F)c1F)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840189746	JVQOOKZAVLCPPW-SFHVURJKSA-N	437.270	1.767	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)CCc1c(C)noc1C)C2	1843415657	XGDGZEQFBZCFPJ-BUVRLJJBSA-N	440.504	1.561	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1cc3ncccc3[nH]1)C2	1843416684	MYRLGTQNUGZKFS-VULFUBBASA-N	433.472	1.514	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@]23C[C@@H](CO2)N(C(=O)OC(C)(C)C)C3)C1	1845078719	OANXJSAEXWMWQX-ZSDSOXJFSA-N	441.956	1.986	50	20	IDGD	
O=C([C@H](O)CCl)N1CC2(CCCN2C(=O)c2ccc3[nH]nc(C(F)(F)F)c3c2)C1	1845710591	JJTZXPDLPSRYNR-CYBMUJFWSA-N	430.814	1.998	50	20	IDGD	
CC(=O)N[C@H](C)C(=O)N1CCCC12CN(C(=O)[C@@H](Br)Cc1ccccc1)C2	1846006259	LKRRZCMEKFENJW-PBHICJAKSA-N	436.350	1.721	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1846360810	GUTGRADBCPSQIQ-OLZOCXBDSA-N	438.352	1.576	50	20	IDGD	
CCN1CCN(c2ccc(C(=O)N3CC4(CCCN4C(=O)[C@@H](Cl)COC)C3)cc2)CC1	1846365330	OAGMKDNYPGFTEY-FQEVSTJZSA-N	448.995	1.899	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H]1CN(C(=O)OC(C)(C)C)C[C@H]1O	1847868438	BKVZEWPHMJRBBE-QUSNUVHPSA-N	443.972	1.824	50	20	IDGD	
COc1ccc(OCCCC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1	17406377	PIEBSNVUYLIQCK-UHFFFAOYSA-N	449.529	1.631	50	20	IDGD	
O=C(NNC(=O)c1n[nH]c(=O)c2ccccc12)c1ccc(=O)n(Cc2ccccc2Cl)c1	17849442	RFJLGKHETZJKGP-UHFFFAOYSA-N	449.854	1.861	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	726249395	WTDGSFITTMENNA-QGZVFWFLSA-N	429.546	1.721	50	20	IDGD	
COc1ccc(C(=O)N[C@@H](C(=O)NNC(=O)Cn2nc(C)cc2C)c2ccccc2)cc1	727098779	SITCDHQMYUYFRZ-OAQYLSRUSA-N	435.484	1.827	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)NCCCc2nnc3n2CCCCC3)cc1C	727607542	REEUABUDWILTKJ-UHFFFAOYSA-N	427.509	1.523	50	20	IDGD	
O=C(NNc1nc(-c2cccnc2)no1)[C@H]1CCCN(S(=O)(=O)c2ccc(F)cc2)C1	728079453	VPJLWUSZYAAAMZ-AWEZNQCLSA-N	446.464	1.815	50	20	IDGD	
Cc1nc(CC(C)C)sc1C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	728343561	ONUKNUOKHNNJLA-HNNXBMFYSA-N	433.486	1.794	50	20	IDGD	
CN(C)C(=O)[C@@H]1CCCN1CCCNC(=O)NNC(=O)c1cccc(OC(F)F)c1	728751116	ITUXHUOWAPAFHA-HNNXBMFYSA-N	427.452	1.175	50	20	IDGD	
C[C@H]1Oc2ccccc2N(CCC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)C1=O	728847430	DZLKAIPUFYMECW-OAHLLOKOSA-N	438.488	1.045	50	20	IDGD	
O=C(NNC(=O)N1CCN(c2ccc(Cl)cn2)CC1)C1CCN(c2ncccn2)CC1	728959325	LGFPEWPSWSRZOU-UHFFFAOYSA-N	444.927	1.304	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)C1=NN(c2ccccc2)[C@H](c2ccccc2)C1	729276045	VZCZNHUFKRNJDA-KSSFIOAISA-N	429.502	1.079	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCc2cc(F)ccc2F)cc1	729622324	YAESIAVUOHWEDC-UHFFFAOYSA-N	426.445	1.424	50	20	IDGD	
CCN1CCC[C@H]1CN1C[C@H](C(=O)NNC(=O)COc2cc(C)ccc2C(C)C)CC1=O	729627431	LFDJWRWBUBOUQT-MOPGFXCFSA-N	444.576	1.977	50	20	IDGD	
O=C(Cn1c(=O)ccn(Cc2ccccc2)c1=O)NNC(=O)c1cccc2ncccc12	730226623	ONOLBWRZIPSMBO-UHFFFAOYSA-N	429.436	1.068	50	20	IDGD	
COCCCNC(=O)NNC(=O)CCCS(=O)(=O)c1ccc(Br)cc1	731003286	KGSDLQOGGKVHFM-UHFFFAOYSA-N	436.328	1.370	50	20	IDGD	
COc1ccc(Br)c(C(=O)NN=C2CCN(CCN3CCOCC3)CC2)c1	731558613	ZNLUDVNCFBVPEX-UHFFFAOYSA-N	439.354	1.972	50	20	IDGD	
Cc1cc(C)cc(C(=O)N2CCC[C@H](C(=O)NNC(=O)CCN3C[C@@H](C)O[C@H](C)C3)C2)c1	732264726	WLVYEQQCXSDDFL-AQNXPRMDSA-N	444.576	1.802	50	20	IDGD	
Cc1nn(-c2ccccc2)c2sc(C(=O)NNC(=O)N[C@@H](C)CS(C)(=O)=O)cc12	733660877	YIQVQEQLOFOKEP-NSHDSACASA-N	435.531	1.773	50	20	IDGD	
CC(=O)N[C@@H](Cc1c[nH]c2ccc(Br)cc12)C(=O)NNC(=O)c1cccnc1	742032760	ZSXBIGZGTNBRTR-KRWDZBQOSA-N	444.289	1.834	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CCCOc2ccc(S(C)(=O)=O)cc2)cc1C	744463956	VVSWXRXVEWJMSW-UHFFFAOYSA-N	447.513	1.652	50	20	IDGD	
CCOC(=O)c1cc(C(=O)OCC(=O)NNC(=O)c2cccc(C)c2)cc([N+](=O)[O-])c1	744553512	AVCNEVDHNPFEQA-UHFFFAOYSA-N	429.385	1.698	50	20	IDGD	
CCOC(=O)[C@@H]1CCCN(C(=O)[C@@H](C)OC(=O)/C(C#N)=C\c2cc(C#N)n(C)c2C)C1	744632039	IXOKMNFVVLCZQZ-OQWQLGHJSA-N	426.473	1.846	50	20	IDGD	
Cc1cc(=O)n(CC(=O)NC(C)C)c(C)c1C(=O)NNC(=O)[C@H](C)Oc1ccccc1F	746098603	VYLVENOFEFFADS-HNNXBMFYSA-N	446.479	1.357	50	20	IDGD	
COc1ccc([C@@H](CNC(=O)NNC(=O)Cc2ccncc2)N2CCOCC2)cc1OC	747489409	FOCDIAIVNUNFKS-GOSISDBHSA-N	443.504	1.045	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)CCOc1cccc(C(N)=O)c1	748601896	IIXREZMRVVCDJV-UHFFFAOYSA-N	434.518	1.775	50	20	IDGD	
C[C@H](NS(=O)(=O)c1ccc(C(N)=O)cc1)C(=O)NNc1ccc(OC(F)F)cc1	748661278	PYJJIWGCAZGAOW-JTQLQIEISA-N	428.417	1.197	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)[C@H]3CCN(C4CCCCC4)C3)cc2)CC1	748848506	MNLPTVBXYIOVJK-SFHVURJKSA-N	449.621	1.720	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(CC(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)C1	750508206	NVCMPLZZOFAHBK-UHFFFAOYSA-N	436.421	1.156	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)Cc1csc(NC(=O)c2cccs2)n1	751204075	CCQDBTHSGULWCI-UHFFFAOYSA-N	433.471	1.170	50	20	IDGD	
COc1cn(-c2ccccc2)nc1C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	751393951	ZNIRPVFBBPCLQI-UHFFFAOYSA-N	449.876	1.257	50	20	IDGD	
CCOCCCn1c(NNC(=O)[C@H]2CS[C@@]3(C)CCC(=O)N23)nc2ccccc2c1=O	752048443	UGXFRLBSEODYJZ-IERDGZPVSA-N	445.545	1.720	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)CCCCN2C(=O)c3ccccc3C2=O)cc1	753591174	FRJQOIFYJLOUNB-UHFFFAOYSA-N	448.435	1.329	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2c(F)cc(C#N)cc2F)c1	755037340	QXORZYMFUNQOLF-UHFFFAOYSA-N	436.440	1.942	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NN=Cc1[nH]cnc1C)N(S(C)(=O)=O)CC2	755572660	OODXLMFRVOUNKP-MRXNPFEDSA-N	435.506	1.135	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)ccc1N1CCCC1=O	755594918	TYEFWEHDYQDBHG-UHFFFAOYSA-N	446.485	1.692	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)COc2ccccc2C#N)c(OCC(=O)N(C)C)c1	756202588	JNZIECZTCXVDMR-UHFFFAOYSA-N	425.445	1.565	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNS(=O)(=O)c2cc(C(=O)O)cc(F)c2F)cc1	756930002	QCAPVIQMNGRJHX-JTQLQIEISA-N	444.412	1.839	50	20	IDGD	
COC(=O)c1cc(NC(=O)NNC(=O)Cc2ccccc2OC)cc(S(C)(=O)=O)c1	757674387	SWJMFSBZDZKAAZ-UHFFFAOYSA-N	435.458	1.281	50	20	IDGD	
COc1ncnc(N(C)C)c1NC(=O)NNC(=O)c1cc(Br)ccc1O	757709213	OHOOENOGUDLBKX-UHFFFAOYSA-N	425.243	1.486	50	20	IDGD	
CC1CCN(CCc2cccc(NC(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)c2)CC1	757847498	CINTWBTXALDBEJ-HNNXBMFYSA-N	425.555	1.051	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)Nc2ccc(F)c(S(=O)(=O)NC3CC3)c2)cc1	757874507	PVVFOSRGXSARPP-UHFFFAOYSA-N	436.465	1.807	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)Nc2cccc3c2CCN3S(C)(=O)=O)cc1OC	758302060	ZAIRJGPTJRXSPY-UHFFFAOYSA-N	448.501	1.883	50	20	IDGD	
O=C(N=c1cc[nH]cc1F)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	760001143	FSSYBMMEFHPRKN-UHFFFAOYSA-N	432.415	1.867	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2cc3ccccc3nc2Br)n1	760277806	SIXHJSZNVBPPAR-UHFFFAOYSA-N	445.277	1.597	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)[C@@H](C(C)C)N3CCCS3(=O)=O)n[nH]2)cc1	763173545	PBTVKMXXEPIVCP-GOSISDBHSA-N	433.534	1.460	50	20	IDGD	
NC(=O)[C@H](NNC(=O)C1CCN(c2ncccn2)CC1)c1cccc(Br)c1	763383635	OJGYLEJCJFUUBA-OAHLLOKOSA-N	433.310	1.303	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(N(C)C)c(C)c2)cc(OC)c1OC	763539510	MMXFNHZPTKGVEN-UHFFFAOYSA-N	430.461	1.487	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc3nc(N4CCOCC4)sc3c2)c(C)o1	763576018	FEACSYQOUCCOSY-UHFFFAOYSA-N	443.485	1.742	50	20	IDGD	
CCOC(=O)c1c(C)csc1NC(=O)C(=O)NNC(=O)[C@H]1COc2ccccc2O1	763578225	NFWPLGFIRPSCBD-CYBMUJFWSA-N	433.442	1.159	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)c(F)c1	763600449	IBIWWIYOVQVJSN-UHFFFAOYSA-N	425.376	1.402	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2cc(Cl)ccc2C(=O)N(C)C)c1	763668797	PVMCNWVQJFZDPK-UHFFFAOYSA-N	446.891	1.824	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cc3c(cc2Cl)OCCO3)cc1	763674963	RGZIDJZTPWRCHR-UHFFFAOYSA-N	430.804	1.148	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2F)cnc1Br	763682397	NJVXCQFJHCVHKF-UHFFFAOYSA-N	425.214	1.457	50	20	IDGD	
CCOC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCC3)cc1	763782287	RTZABSWBULGAAJ-UHFFFAOYSA-N	431.470	1.578	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2c(F)cc(Cl)cc2F)c2ccccc2c1=O	763786609	QOLJTEVXOVXBRU-UHFFFAOYSA-N	449.801	1.748	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccccc2N2C[C@H](C)O[C@H](C)C2)cc1	763811734	LJORYZDQKBQUPJ-CALCHBBNSA-N	440.500	1.774	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(C[S@](=O)CCOC)c2)cc1	763832394	PZPPWENUWVFNNY-SSEXGKCCSA-N	431.514	1.544	50	20	IDGD	
CCOC(=O)N(C)c1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)cc1	763848335	BVKHCSSTLFOLSC-CYBMUJFWSA-N	446.435	1.972	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccn(-c3ncccc3F)n2)cc1OC	763913063	YNMDOHSLUGQTBV-UHFFFAOYSA-N	442.407	1.213	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)C(=O)Nc1cccc(Oc2ccncc2)c1	763916596	HKGBWTXVLFSROL-UHFFFAOYSA-N	444.411	1.249	50	20	IDGD	
COC(=O)c1ccc(C)c(NC(=O)C(=O)NNC(=O)c2cc(Br)cn2C)c1	764004572	HRTVNMZROJJUNQ-UHFFFAOYSA-N	437.250	1.282	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1ccn(Cc2ccncc2)n1	764012197	MOYYZUAFEMSKES-UHFFFAOYSA-N	428.836	1.388	50	20	IDGD	
CCn1nnnc1-c1cccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2OC)c1	764013304	ZHKXBMZJCLJIFB-UHFFFAOYSA-N	443.851	1.422	50	20	IDGD	
CN1CCc2ccc(NC(=O)C(=O)NNC(=O)c3ccc(F)cc3Br)cc21	764085687	NNFZRJPJKPQBLH-UHFFFAOYSA-N	435.253	1.980	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccccc3C[S@@](C)=O)n[nH]2)cc1	764110676	AMKCAKUWINCJNN-WJOKGBTCSA-N	439.497	1.663	50	20	IDGD	
CCn1cc(NC(=O)C(=O)NNC(=O)c2cc(OC)ccc2Br)ccc1=O	764233882	ZMNYPOHGFIGPEG-UHFFFAOYSA-N	437.250	1.039	50	20	IDGD	
CCCOc1ccc(NC(=O)C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c(C)c1	764268178	YRACRZSNFVIZTB-UHFFFAOYSA-N	440.504	1.576	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)C(=O)Nc1cc(C)n(-c2ccc(Cl)cc2Cl)n1	764297613	DWQAIOGBZLSJMP-UHFFFAOYSA-N	436.259	1.919	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)C(C)(C)c2ccccc2)cc1Cl	764302851	PETDURLSVDVZCT-UHFFFAOYSA-N	447.875	1.956	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)CCCc2cccs2)c(F)cc1F	764340422	BYEVVYAXJJPXEX-UHFFFAOYSA-N	425.413	1.922	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc(F)cc3F)n[nH]2)cc1OC	764379521	ZZEDECMWUNMQOC-UHFFFAOYSA-N	445.382	1.772	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cnn(CC(F)F)c3)n[nH]2)cc1	764384904	MCYXXNHEIURJEH-UHFFFAOYSA-N	431.403	1.500	50	20	IDGD	
COc1nccnc1NNC(=O)CNC(=O)[C@@H]1c2ccccc2C(=O)N1Cc1ccccc1	764469626	KXDQVPFVLLAIAG-IBGZPJMESA-N	446.467	1.442	50	20	IDGD	
CS(=O)(=O)c1cc(C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)cc([N+](=O)[O-])c1	765616130	KPQHUHSMNACQNR-UHFFFAOYSA-N	447.404	1.602	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)C3CCN(C(=O)C(C)C)CC3)CC2)cc1	765749672	PMVSYCKAIDBBIP-UHFFFAOYSA-N	443.592	1.155	50	20	IDGD	
CN1CCCCC/C1=N\S(=O)(=O)c1cccc(NC(=O)C(=O)NNc2cnccn2)c1	766260970	ZEMWWUWCTJRWOX-KOEQRZSOSA-N	445.505	1.151	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2csc(S(C)(=O)=O)c2)c2ccccc2c1=O	766295039	JXUXLPYHCWGPSN-UHFFFAOYSA-N	434.499	1.346	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)N2CCN(C(=O)[C@@H]3CCCN3C)CC2)c1C	766345248	HXQYBRYXWRATJF-LDVBQKTRSA-N	427.549	1.423	50	20	IDGD	
NC(=O)[C@@H]1CC(C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)=NN1c1ccccc1	768277627	UMVZBYSHOZKXJW-SFHVURJKSA-N	435.419	1.097	50	20	IDGD	
CC(C)Cn1ncc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1C1CC1	768649126	QHYBFPPIJOAIKI-SFHVURJKSA-N	442.472	1.561	50	20	IDGD	
O=C(NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)N[C@@H]1CCOC2(CCC2)C1	769194524	SFBUOBHOOXVJRS-MRXNPFEDSA-N	436.534	1.517	50	20	IDGD	
O=C(NNC(=O)c1cnc(Cl)cn1)c1cccc(S(=O)(=O)NCc2ccccc2)c1	769470610	LWDWDLQVVNYGCE-UHFFFAOYSA-N	445.888	1.683	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)NC1CCN(C2CCN(C)CC2)CC1	770440845	RSIIENUMYHRHEQ-OAHLLOKOSA-N	437.972	1.996	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)C1CCN(S(=O)(=O)/C=C\c2ccccc2)CC1	771930772	BUNVOQUZRTUIHC-QKXCFHHRSA-N	437.518	1.188	50	20	IDGD	
CN1CCN([C@@H](C(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)c2ccccc2)CC1	772885085	UZOFDPPSLUNUSF-LJQANCHMSA-N	443.935	1.092	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)c1ccc([C@@]2(C)NC(=O)NC2=O)cc1	772962486	BWOWWJHWFXFLOR-PRWKNARSSA-N	430.848	1.623	50	20	IDGD	
O=C(NNc1cccc2c1CCCC2)C(=O)Nc1cnn(Cc2nnc3n2CCCC3)c1	773651748	RJEASMDTASPKKZ-UHFFFAOYSA-N	434.504	1.820	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)cn1C	774008097	FPCDEJHJJOAXHK-NSHDSACASA-N	436.852	1.409	50	20	IDGD	
CC(C)c1[nH]nc(C(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)c1[N+](=O)[O-]	776205482	LYYBWRLHABREII-UHFFFAOYSA-N	439.473	1.691	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)NCC(F)(F)CNC(=O)OC(C)(C)C)c1	777672232	FCEQVLPVOGOJLV-UHFFFAOYSA-N	432.424	1.808	50	20	IDGD	
CC(C)CS(=O)(=O)N1CCC(NC(=O)NNC(=O)NCc2ccc(Cl)cc2)CC1	777768266	KONHWXPWKRHKQX-UHFFFAOYSA-N	445.973	1.804	50	20	IDGD	
O=C(NCCS(=O)(=O)NC[C@@H]1CCCCO1)NNc1ccccc1OC(F)(F)F	779572489	UTFBAJDOSOQZGT-LBPRGKRZSA-N	440.444	1.700	50	20	IDGD	
C[C@H]1C(=O)CC[C@H](C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)C1(C)C	780154821	DLBMSFLCPVWWJK-WMLDXEAASA-N	435.546	1.874	50	20	IDGD	
O=S(=O)(CCCCCl)NC[C@@H](O)COc1ccc(I)cc1	780795533	YSBYCCKFOWVONG-GFCCVEGCSA-N	447.722	1.969	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1cccc(NC(=O)C(=O)NNc2ncncc2Cl)c1	782159316	PUMWXQIEHMZGGN-UHFFFAOYSA-N	426.886	1.289	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)cc1F	783262234	BWWOADLDLYZHJR-UHFFFAOYSA-N	439.469	1.388	50	20	IDGD	
CCCNC(=O)[C@H]1CN(C(=O)C(=O)NNc2cccc(C(=O)OC)c2)c2ccccc2O1	784851514	CAOYSJNKMGSYSJ-GOSISDBHSA-N	440.456	1.237	50	20	IDGD	
COc1ccc(S(=O)(=O)NC(C)(C)C)cc1NC(=O)C(=O)NNc1ccnc(F)c1	784852071	RJCNMHASWZXDHY-UHFFFAOYSA-N	439.469	1.388	50	20	IDGD	
O=C(NNc1ccc(Cl)nc1)C(=O)Nc1ccc(CC(=O)N2CCSCC2)cc1	784869759	JWAMALGSDALTIM-UHFFFAOYSA-N	433.921	1.935	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)Nc1ccc2c(c1)OC1(CCCC1)O2	785024097	SLBGXAVLYFZYLC-UHFFFAOYSA-N	442.384	1.742	50	20	IDGD	
CCOC(=O)c1cnn(C)c1NC(=O)C(=O)NNc1ccc(F)cc1Br	786412142	OROKOAAKRRGREL-UHFFFAOYSA-N	428.218	1.580	50	20	IDGD	
CCOc1ccccc1[C@](N)(C(=O)NNC(=O)c1ccc2c(c1)OCO2)C(F)(F)F	787993489	XRYJJSSTQOIXGM-SFHVURJKSA-N	425.363	1.992	50	20	IDGD	
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)NNC(=O)[C@H]1OCC[C@H]1c1ccccc1	788496138	HJAAFQIMTRAYEV-YOEHRIQHSA-N	449.441	1.264	50	20	IDGD	
O=C(CCC/N=C1/NS(=O)(=O)c2ccccc21)NNc1nnc(-c2ccccn2)s1	788565288	NPELJQWTXKTATD-UHFFFAOYSA-N	443.514	1.562	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1ccnc(Oc2ccc(F)cc2F)c1	788739839	RNSMTNNXACQUCI-SECBINFHSA-N	429.405	1.243	50	20	IDGD	
Cn1nc([C@H]2CCCOC2)cc1NC(=O)C(=O)NNC(=O)CCSc1ccc(F)cc1	790952516	RGWMXEUPHAZWFB-ZDUSSCGKSA-N	449.508	1.722	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2c(C)nc3ccccn23)cc(Cl)c1F	792269343	XLMICUNBDIIJKS-UHFFFAOYSA-N	447.810	1.622	50	20	IDGD	
O=C(NNC(=O)[C@@H]1[C@H]2[C@H]3C[C@@H]4[C@H]5[C@@H](C[C@H]42)[C@@H]1[C@@H]53)c1ccc(S(=O)(=O)N2CCCC2)cc1	792805096	BQKWNQWZBGBPBX-MMERRTHSSA-N	441.553	1.626	50	20	IDGD	
Cc1nn(-c2ccccc2)c(N)c1C=NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	794863811	JPVZPPWDFMLAAR-UHFFFAOYSA-N	426.502	1.777	50	20	IDGD	
Cc1c(NC(=O)NNC(=O)CNC(=O)OCc2ccccc2)cccc1N1CCNC1=O	797651087	LSZHNNCHHQZQCM-UHFFFAOYSA-N	440.460	1.604	50	20	IDGD	
COC(=O)c1c(F)cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)cc1F	802566171	CFLCIASGVCXTCY-VIFPVBQESA-N	439.346	1.444	50	20	IDGD	
COC(=O)N(C)NC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(Br)cc2)C1	804125608	WFFCIXSMFOBAQC-LLVKDONJSA-N	434.312	1.579	50	20	IDGD	
CNS(=O)(=O)c1cc(NC(=O)C(=O)NNc2nc(C(F)(F)F)cs2)ccc1F	807021189	CIZPLZUUBFUSJX-UHFFFAOYSA-N	441.388	1.291	50	20	IDGD	
CC(C)(C)OC(=O)N1CCc2ccccc2[C@H]1CNC(=O)NNC(=O)C(=O)NC1CC1	807437012	PCPRVLCPEZDTQB-MRXNPFEDSA-N	431.493	1.130	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)CNS(=O)(=O)c1ccc(Cl)c(Cl)c1	810356790	WZYAJXQJJRQWBR-UHFFFAOYSA-N	446.312	1.758	50	20	IDGD	
CN(C)S(=O)(=O)CCNC(=O)NNC(=O)c1cc2c(s1)CC[C@@H](C(C)(C)C)C2	812692886	CTRRWJBEBGSZJD-CYBMUJFWSA-N	430.596	1.735	50	20	IDGD	
CC1(C)CN(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)C[C@H](C(F)(F)F)O1	814271028	UPNXFBVHRJESEC-LLVKDONJSA-N	437.444	1.376	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=O)CNc2ccccc2)ccc1OC	823327703	ALRLCPHUNKOMCI-UHFFFAOYSA-N	434.518	1.599	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)[C@H]2CC(=O)N(c3cc(C)ccc3OC)C2)c1	825782407	WWUVICKKNBOTLY-HNNXBMFYSA-N	426.473	1.625	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)CCN2C(=O)[C@H]3CCCC[C@@H]3C2=O)cc1OC	913069819	PLDJPLGYGYXLDQ-HOTGVXAUSA-N	431.489	1.810	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@@H]2C(=O)NNC(=O)COc2ccc(C)cc2)c(OC)c1	915060459	GHYYECBNSOZLRX-LJQANCHMSA-N	441.484	1.843	50	20	IDGD	
CN(C)[C@@H](CNC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)c1cccs1	915897764	KCTHSQBGUBRUHO-IBGZPJMESA-N	444.605	1.894	50	20	IDGD	
CCn1c(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)nc2ccccc21	915928094	DKWALNNYROEAGH-UHFFFAOYSA-N	444.517	1.451	50	20	IDGD	
CCCc1c(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cnn1Cc1ccccc1	916144941	ZXSITECJBCGGGW-UHFFFAOYSA-N	430.472	1.934	50	20	IDGD	
CC(C)NS(=O)(=O)c1cccc(CNC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c1	916489953	SEXPDWVLDKJRIL-UHFFFAOYSA-N	435.462	1.426	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)NCCOc1ccc(F)cc1	916613107	PLZSMMREFYABMG-UHFFFAOYSA-N	429.496	1.747	50	20	IDGD	
COc1cc(CNC(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)ccc1OCC(N)=O	916640409	CZLAJFUPTCPLDE-UHFFFAOYSA-N	430.505	1.606	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(F)cc2)C1)c1ccc(Cl)nc1	917250851	ITSPCWTVZZGQNW-CYBMUJFWSA-N	440.884	1.736	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)c2ccc(F)cc2NC(=O)c2ccoc2)c2ccccc2c1=O	917387841	PORSKBYNBHWCKD-UHFFFAOYSA-N	449.398	1.993	50	20	IDGD	
Cc1cc(Cl)ccc1S(=O)(=O)NNC(=O)c1sc(N2CCOCC2)nc1C	917724051	SCRSAMUVKYSIRI-UHFFFAOYSA-N	430.939	1.873	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)N[C@H](C)c1ccc(S(=O)(=O)N(C)C)cc1	918104375	IOVLPLAUHIDKAQ-OAHLLOKOSA-N	448.545	1.970	50	20	IDGD	
CCOc1ccc(OCc2ccc(C(=O)NNC(=S)NCC(=O)N(C)C)cc2)cc1	918717198	NOCFUBRZFDILJV-UHFFFAOYSA-N	430.530	1.861	50	20	IDGD	
CC(C)c1c(C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)cnn1-c1ccc(Cl)cc1	919890080	ZOAWXIXGMGPWAX-ZDUSSCGKSA-N	439.925	1.780	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N[C@@H](C)Cn2cccn2)cc1	920853407	CHNYRDZHJUSAFH-IQFISFIMSA-N	447.499	1.742	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)Nc2ccc(=O)n(C)c2)cc1	920853672	DNXPREDKRRAFGB-WJDWOHSUSA-N	446.467	1.678	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1OCCO	1116896315	LOBSKJRRCSUPHM-UHFFFAOYSA-N	437.493	1.474	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cnn(-c4ccncc4)c3C)CC2)cc1	1323115197	OTDDMZKABWQYHJ-UHFFFAOYSA-N	447.543	1.463	50	20	IDGD	
CCc1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](F)Br)C3)n[nH]1	1777729841	YZOHMGTXJGSSSO-JKIFEVAISA-N	431.306	1.790	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2)c1cc(-c2ccncc2)[nH]n1	1779738393	NVZFDTKGGKKAFA-DBXWQHBBSA-N	447.923	1.199	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(N(C)C)nc3)C2)C1	1779764579	JRUKNZFDIJIFRW-UGSOOPFHSA-N	425.327	1.375	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(Cl)Cl)C2)c1cc2cccnn2n1	1779993939	BQZSSZAGLOKAMA-RDTXWAMCSA-N	426.304	1.661	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnc3c(c1)CCNCC3)C2	1780708011	PNNQZJKODSGLOZ-KKLQWCBXSA-N	448.995	1.915	50	20	IDGD	
COc1nn(C)cc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Br)C1	1780771244	XXFUOSQONFDJFP-IIYDPXPESA-N	447.305	1.247	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](CCN)NC(=O)OC(C)(C)C)CCO2	1781213926	VYQLQRGZCACNCR-BXTJHSDWSA-N	446.976	1.076	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)c3n[nH]c4c3CCCC4)CCO2)C1	1781228205	ZOKBPBPUNZDFPH-RTBURBONSA-N	429.348	1.968	50	20	IDGD	
Cn1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](F)Br)C3)C2)c(C(F)F)n1	1781329763	JMFAWOJKXDMKHO-XHDPSFHLSA-N	439.232	1.492	50	20	IDGD	
O=C(c1cn2ccsc2n1)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781331715	PZHJIWMWGLGYBE-NHYWBVRUSA-N	431.287	1.530	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](O)NC(=O)OC(C)(C)C)C2)C1	1781853822	QITBHWFVVMUWKK-KSMMKXTCSA-N	433.933	1.067	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnn4c3OCCC4)C2)C1	1782273727	JVWGXKHXZPNFKL-UGSOOPFHSA-N	441.326	1.140	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnn4c3OCCC4)C2)C1	1782281616	HWFWRKMLOYCARP-KBXCAEBGSA-N	441.326	1.283	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3n[nH]c4cccc(F)c34)C2)C1	1782485183	IQADFGUGYLGWJK-BBATYDOGSA-N	439.285	1.929	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2	1782708890	YJVXGCWKJFLURZ-DQYPLSBCSA-N	425.309	1.614	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cnc(OC)cn3)CCO2)C1	1783342670	DBWJAYFEGFDSJT-YVEFUNNKSA-N	427.299	1.102	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)Cc3ccc4c(c3)CCO4)C2)C1	1783422487	ZFHQJEFYBQVJSH-VLIAUNLRSA-N	437.334	1.777	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3cccc([N+](=O)[O-])c3)[C@H]2C1	1783438457	OVSBIIQWSYTZIS-WDSOQIARSA-N	449.580	1.969	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cn4c(Cl)cccc4n3)CCO2)C1	1783876238	XIGJGKPIAMIFQE-BFUOFWGJSA-N	441.315	1.685	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3c(C)nc4ccc(F)cn34)CCO2)C1	1783881973	OQMNVCUPBMTTRJ-YWZLYKJASA-N	438.887	1.479	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)Cc3ccc(F)cc3OC)CCO2)C1	1783883796	KDGNRECXYOYLLO-UZLBHIALSA-N	428.888	1.461	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(C(F)(F)F)c3)C[C@@H]21)[C@@H](O)CCl	1784091976	AKLYCJHOFCYAEA-TUUVXOQKSA-N	434.842	1.898	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cc4cccnc4cc3F)C[C@@H]21)[C@@H](O)CCl	1784092924	OBWMDEGNSLCNSM-QHERXFFYSA-N	449.910	1.496	50	20	IDGD	
COC(=O)CSCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]21	1784512016	PVXBZMHUILJOFK-NEULZYRMSA-N	441.377	1.109	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H]3CCCN3C(C)C)C2)C1	1784806799	KXAUJTRDRHTGNU-TXPKVOOTSA-N	430.387	1.863	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CC[C@@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)cc1	1785106394	YBZWLMDBGNVBOY-OAQYLSRUSA-N	433.581	1.940	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC1(c2ccc(NC(=O)[C@H](O)c3ccco3)cc2)CCC1	1785857222	UKUOLMHSSSEJEF-LJQANCHMSA-N	449.467	1.759	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc(OCF)cn3)C[C@@H]21	1786401410	ZFWWROOQQRPRLV-OBJOEFQTSA-N	445.289	1.161	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C[C@@H](N)c3cccnc3)[C@H]2C1	1786932078	RAMINNYXKUHQGV-GWFJUFKTSA-N	439.354	1.235	50	20	IDGD	
CCCC(=O)N[C@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]21	1788742394	GPGXUKSLPGJNIX-QWHKOUAISA-N	436.380	1.507	50	20	IDGD	
CC[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]2C1)N(CC)CC	1788765939	WOUXGWKMZBEISY-VJANTYMQSA-N	427.662	1.938	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccn(C(F)F)c3=O)[C@H]2C1	1788797856	WDQLYAIYMHPIMT-MXAVVETBSA-N	447.866	1.091	50	20	IDGD	
C[C@H]1CCc2c(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]4C3)n[nH]c21	1789925693	HLXSQHJHCPLKSH-LTNQRRLNSA-N	443.317	1.743	50	20	IDGD	
CCCC(=O)N[C@@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]2C1	1791055735	HGCVVIQYWCASMB-QTVXIADOSA-N	432.359	1.054	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc4c(c3)OCO4)C[C@@H]21	1791251780	VQACSCGKXTWBGV-FPXQBCRKSA-N	438.908	1.191	50	20	IDGD	
COc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)CBr)cc1	1792872690	WPDVEBRFBPHJQJ-JJAZEVLHSA-N	425.323	1.929	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1C[C@@H]1c1ccc(F)c(F)c1)C2)[C@H](O)CCl	1792975444	RZJBVWANJIOWPF-WHGULVMYSA-N	428.863	1.258	50	20	IDGD	
CC(=O)N[C@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@](C)(Cl)CCl)C2)C(C)(C)C	1793194181	LWDUARSEKNCERS-ZEKKIGMLSA-N	436.380	1.363	50	20	IDGD	
COc1cc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)Br)C3)ccn1	1793903112	SSQYRRGUHGRTFB-FRQROOTJSA-N	440.338	1.396	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1n[nH]c(C2CC2)c1F	1794478827	SWLXNYZIHYOOTB-ZKCLLBTKSA-N	443.317	1.660	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)c1ccccc1C(F)(F)F	1796191641	IVTHNNSTNFMCOZ-BJWYYQGGSA-N	446.234	1.951	50	20	IDGD	
Cc1cc(C)n2ncc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)CO[Si](C)(C)C)c2n1	1797955837	IJGVBLDFSDGZLR-HGKCTWBKSA-N	445.596	1.401	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@](C)(O)C(F)(F)F)C2	1800640124	KSBTUPITQPAOFT-AYDOGRCQSA-N	431.249	1.063	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)ccc1O)C2	1800643078	KWSGQJAURBPSRL-YHYOWMERSA-N	427.295	1.475	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C#Cc1ccc(Cl)cc1)C2	1800971471	ZQSSGKGRIFYVSW-LORHWOILSA-N	425.312	1.535	50	20	IDGD	
COc1cc(F)ccc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Br)C2	1801647982	UYECJUHVPZBBDP-LSSIXWDNSA-N	429.286	1.821	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2c(c1)CCCO2	1801673071	MQPCDQBGOPCLMK-PTOXDTDZSA-N	437.334	1.998	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1CCN(C(=O)c2cc(O)n[nH]2)[C@@H]1c1cccnc1	1803010088	ZLPKFVRQBHUORV-PVXIVEMSSA-N	436.310	1.861	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H]1CCC[C@@H]1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](O)CCl)C2	1804408882	CHPJCEFKJAGRRW-FHULIHMCSA-N	443.972	1.918	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)c2cc(O)n(C)n2)[C@@H]1c1cccnc1	1804898315	GMUCKLJGNJHJKA-RBOXIYTFSA-N	436.310	1.624	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)c1cc(C(F)F)no1	1807721240	YVKRSJSPLRJFRA-WHOFXGATSA-N	428.823	1.927	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)c1ccc2nc[nH]c2c1	1809815729	FVDOHDGNRHNTIY-IPELMVKDSA-N	427.892	1.877	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@H]1c1cccnc1)c1cc(CO)on1	1811590954	AJLXYBUFDRMOTR-TUKIKUTGSA-N	441.257	1.572	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)C[C@@H](N)c2cccnc2)[C@@H]1c1cccnc1	1813032011	UFONXSDZWBKKMA-CTAFRAEOSA-N	445.951	1.826	50	20	IDGD	
Cc1cccnc1C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1813068998	RIGLYUYLOWYCSN-GCJKJVERSA-N	438.532	1.478	50	20	IDGD	
COc1nn(C)cc1C(=O)N1CC[C@@H](CNC(=O)C(Cl)Cl)[C@@H]1c1cccnc1	1813077281	IPMSHGDZWPMAMD-JSGCOSHPSA-N	426.304	1.947	50	20	IDGD	
CCC[C@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(=O)n3[nH]nnc3n2)[nH]n1	1815318942	QGQKWQZEEJAAGX-GWCFXTLKSA-N	447.887	1.249	50	20	IDGD	
O=C(/C=C/c1cccnc1)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1	1815337234	PHEIKCVQXNSZBE-QYSIDVQXSA-N	448.313	1.157	50	20	IDGD	
C[C@@]1(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)CC=CCC1	1815361745	QHVSWVGVLIZHEZ-OPAMFIHVSA-N	439.346	1.795	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)CCc3cnn(C)c3)sc2C1	1815438071	WUKCBKULRIZWRB-OLZOCXBDSA-N	425.942	1.675	50	20	IDGD	
CC(C)(C)OCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1815591175	OKSUIFHUJSMVMI-KRWDZBQOSA-N	428.298	1.211	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CN2CCNC2=N)n[nH]1	1817296247	CHDRIZKTVSMZMH-PXAZEXFGSA-N	430.340	1.478	50	20	IDGD	
CCc1nc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)co1	1817476598	LSZXQHRVKWINPP-QGZVFWFLSA-N	437.265	1.260	50	20	IDGD	
C[C@@H]1CC[C@H](C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cnccc3C(=O)NN)n[nH]2)O1	1819402784	LGOGFPTUKIGYAB-CSMYWGQOSA-N	441.492	1.282	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)[C@H](C)Nc3cnccn3)sc2C1	1819837111	RCMNFWXBLRQTBR-SRVKXCTJSA-N	438.941	1.600	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN2C(=O)C=CC2=O)[nH]n1	1820869093	PVAWKHINIGGYGF-KPZWWZAWSA-N	442.303	1.563	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](C)O)n[nH]1	1822175663	KWOSTPRWRXJWQS-BZNIZROVSA-N	445.432	1.930	50	20	IDGD	
COC(=O)NCC(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H](C)CBr)CC1	1824096878	XTEYDCQCDMJTBP-HIFRSBDPSA-N	432.359	1.993	50	20	IDGD	
C=C(C(=O)N[C@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1)C(F)(F)F	1826090176	YJVWHNHJFCDMJM-JTQLQIEISA-N	433.456	1.547	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](C)n3cncn3)sc2C1	1826781724	HHSHVHALEXNJAH-GMTAPVOTSA-N	441.355	1.939	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)CCc3ccoc3)sc2C1	1827114657	NUCZRYFAIXUJKH-CQSZACIVSA-N	433.534	1.654	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cncs2)CC1	1828925639	OAFBSHOGJAPRBR-QGZVFWFLSA-N	442.545	1.689	50	20	IDGD	
CC(C)n1nccc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830364671	OLMRCHJWQREOQN-FQEVSTJZSA-N	426.945	1.799	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3Cc4ccccc4N3)C2)C1	1830366732	VFWCZNBRQKWGAR-AVRDEDQJSA-N	435.952	1.745	50	20	IDGD	
CC(C)=NO[C@@H](C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1	1830419262	NRJJUXVORPECFY-PKOBYXMFSA-N	437.585	1.780	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cn3nnc4ccccc43)CCO2)C1	1832198527	JRJUOYXZQWVECK-OAQYLSRUSA-N	449.939	1.153	50	20	IDGD	
Cc1cc(C)n(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)n1	1833040295	CCLWAYGQMBQETP-RBUKOAKNSA-N	447.363	1.193	50	20	IDGD	
Cc1ccc(F)c(C(=O)N2CCC(N3CCC(NC(=O)[C@@H](O)CCl)CC3)CC2)c1	1833313894	RXLLEGMBRMWMMM-IBGZPJMESA-N	425.932	1.919	50	20	IDGD	
Cc1noc(C)c1CC(=O)NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1833728085	VMYIMVLHFYOFOO-SFHVURJKSA-N	426.945	1.005	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)cn1	1833999431	MXBRCNDHELZCTQ-YOEHRIQHSA-N	430.274	1.151	50	20	IDGD	
Cn1ccc(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](F)Br)CC3)CC2)c1	1834078763	GMQLXCMUGNQHEY-MRXNPFEDSA-N	429.334	1.901	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccn(CC)n3)CCO2)C1	1834408949	LULGHAZWUFGUDE-KSSFIOAISA-N	443.342	1.147	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)CCC(F)(F)F)CCO2)C1	1835319133	ODMCEAMZUDYBFR-SWLSCSKDSA-N	445.276	1.816	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cnc4ncccn34)CC2)CC1	1835388124	MGNRUVKZQMFBRS-QGZVFWFLSA-N	448.955	1.168	50	20	IDGD	
O=C([C@H](O)CCl)N1CCC(OC2CCN(C(=O)[C@H](F)Br)CC2)CC1	1836717885	LMIBJLJTYNJKDL-OLZOCXBDSA-N	429.714	1.275	50	20	IDGD	
O=C(c1cc2cc(F)ccc2[nH]1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1836803283	AVDVQXMGTFUPAW-VQIMIIECSA-N	427.835	1.911	50	20	IDGD	
O=C(c1n[nH]c2ccc(F)cc12)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1837041239	ADZWVTIGHDSPIS-YJBOKZPZSA-N	428.823	1.306	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCC(OC2CCN(C(=O)Cn3cncn3)CC2)CC1	1837965329	LPIPVXFQWXAUSR-GOSISDBHSA-N	432.352	1.513	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)[C@@H]3CCC(=O)N3C)CC2)CC1	1838651218	ZWVIXVJJHFUZOV-CJNGLKHVSA-N	444.370	1.389	50	20	IDGD	
Cc1ccn(C)c1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1	1838821166	ARWUPFCCULDVLF-MOPGFXCFSA-N	432.348	1.640	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnn4c(C)cc(C)nc34)C2)C1	1839144497	BUMVWHBXMAMALT-LAUBAEHRSA-N	449.939	1.434	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cn4ccsc4n3)C2)C1	1839145472	IKZWRXNZBPPMEL-SCLBCKFNSA-N	426.926	1.483	50	20	IDGD	
COc1ccnc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)c1	1839153351	HGIIXLWBONMVOH-OALUTQOASA-N	446.331	1.397	50	20	IDGD	
Cc1nc(C)c(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)o1	1839153875	UOBUZYSEURYTEW-QZTJIDSGSA-N	434.320	1.598	50	20	IDGD	
Cc1onc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)c1C	1839198443	DMEZBSPHVWURSU-XJKSGUPXSA-N	434.262	1.052	50	20	IDGD	
O=C(C[C@@H]1CCCCO1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839198991	PSNRINWWYJHEQC-YSVLISHTSA-N	437.306	1.093	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)c(C)n1	1839200872	RERLJOAVZBVUPN-QAPCUYQASA-N	444.301	1.459	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)ccc1O	1839307952	BWJQUAWRBFEOIY-OAQYLSRUSA-N	436.581	1.622	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnn4c3OCCC4)CCO2)C1	1839516156	CVWKMEPDOTUEHS-JXFKEZNVSA-N	440.928	1.143	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)C[C@H](C)c3ccccc3)CCO2)C1	1839932321	RCELJSUSORHGDV-JLMWRMLUSA-N	438.952	1.890	50	20	IDGD	
Cc1nc(F)ccc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)Br)CCO2	1840034483	NHTURJDJBQOAOI-KPZWWZAWSA-N	444.301	1.383	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(F)c3F)C2)C1	1840154071	KLBUHOSBANLVLP-KUHUBIRLSA-N	432.851	1.289	50	20	IDGD	
C[C@H](Br)C(=O)N1CC2(CCCN2C(=O)[C@@H]2CC(=O)N(C3CCCC3)C2)C1	1841860524	ZOHPQEQVMIVWCV-UONOGXRCSA-N	426.355	1.764	50	20	IDGD	
O=C([C@H](Br)Cc1ccccc1)N1CC2(CCCN2C(=O)Cn2cncn2)C1	1843082305	DJKZVGGCLLBTGD-MRXNPFEDSA-N	432.322	1.488	50	20	IDGD	
O=C([C@H](O)CCl)N1CC2(CCCN2C(=O)c2nn(-c3ccccc3)c3c2COC3)C1	1843227166	APCOOBZPVLKAHE-QGZVFWFLSA-N	430.892	1.319	50	20	IDGD	
CN(CC(=O)N1CCCC12CN(C(=O)[C@]1(C)CC1(F)F)C2)NC(=O)NCc1ccccc1	1845039918	VWDOJPJANLOIKN-FQEVSTJZSA-N	449.502	1.581	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC2(CCCN2C(=O)[C@H]2CC(c3ccccc3)=NN2)C1	1845741155	ZMCXLUKCFYIABY-WMLDXEAASA-N	433.350	1.987	50	20	IDGD	
O=C(c1cn2cccc(Br)c2n1)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl	1847562519	XPIHBNVEEVPVDQ-IHRRRGAJSA-N	441.713	1.512	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(OC)c([N+](=O)[O-])c2)cc1OC	11341931	JRLISJMBHWHCJU-UHFFFAOYSA-N	433.373	1.239	50	20	IDGD	
O=C(CCCN1C(=O)c2ccc(Br)cc2C1=O)NNC(=O)c1ccccc1O	17575190	UKSGBWABQHYHOD-UHFFFAOYSA-N	446.257	1.992	50	20	IDGD	
COc1ccccc1N1C[C@@H](C(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)CC1=O	23684754	KITJCUNLKLOIGH-AWEZNQCLSA-N	443.456	1.535	50	20	IDGD	
Cc1ccc(S(=O)(=O)NC2CC2)cc1C(=O)NNC(=O)[C@H]1COc2ccccc2O1	24880342	ZGIVUBXCWXSWJT-GOSISDBHSA-N	431.470	1.037	50	20	IDGD	
C#CCNS(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc3c(s2)CC[C@@H](C)C3)c1	32195161	DQTJQLWWMAPWQV-CYBMUJFWSA-N	431.539	1.859	50	20	IDGD	
CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)C(C)(C)CC)c(=O)n2Cc1ccccc1	110416262	ZWSXPDWASBTNSP-UHFFFAOYSA-N	440.504	1.012	50	20	IDGD	
Cc1[nH]c2ccccc2c1CCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	727034900	XHCPNJNNGZCZRV-UHFFFAOYSA-N	443.529	1.913	50	20	IDGD	
O=C(NNC(=O)c1cc(Cl)ccc1NS(=O)(=O)c1ccccc1)C(=O)NC1CC1	727367423	QYWKHTAXUDPNEO-UHFFFAOYSA-N	436.877	1.180	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(-n3cccc3)cc2O)cc1OC	728359004	BPRWIUGGFFHYDM-UHFFFAOYSA-N	439.424	1.818	50	20	IDGD	
CCN(CCCNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)c1ccccc1	728943131	HWEVUCSZZFETCE-UHFFFAOYSA-N	425.537	1.940	50	20	IDGD	
Cc1[nH]c2ccnn2c(=O)c1CC(=O)NNC(=O)[C@H](C)Oc1cccc(Br)c1	729282003	IWPXAIJZKALBGE-NSHDSACASA-N	448.277	1.251	50	20	IDGD	
CCC1CCC2(CC1)NC(=O)N(CC(=O)NNC(=O)Cn1ccc3ccccc31)C2=O	729451232	OYXLSCNTQSZOSK-UHFFFAOYSA-N	425.489	1.680	50	20	IDGD	
C[C@H]1CCCN(S(=O)(=O)c2cc(C(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)n(C)c2)C1	730159216	SMUYYYPUOPEQHC-ZDUSSCGKSA-N	449.489	1.429	50	20	IDGD	
O=C(CCS(=O)(=O)c1ccc2c(c1)OCCO2)NNC(=O)c1cccc2ncccc12	730225314	ZIIATYAOXHRNJO-UHFFFAOYSA-N	441.465	1.631	50	20	IDGD	
COCCCNC(=O)NNC(=O)CC[C@@H]1NC(=O)N(c2ccc(Cl)c(Cl)c2)C1=O	730531940	GDPDTOBHJXJJJA-ZDUSSCGKSA-N	446.291	1.565	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)[C@H](c2ccccc2)N2CCCCC2=O)n1	731251946	NXUHHGDNPRNGNZ-FQEVSTJZSA-N	444.513	1.438	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2C[C@H](C)O[C@@H](C)C2)c1	731491215	FKQYGPJZVVQNES-GJZGRUSLSA-N	447.513	1.568	50	20	IDGD	
C[C@H](CC(=O)NN=c1sc2ccccc2n1C)NS(=O)(=O)c1cccnc1Cl	731894865	BXDUNJCFCQVRLO-LLVKDONJSA-N	439.950	1.977	50	20	IDGD	
CCc1nc(CN2CCN(C(=O)/C(C#N)=C\c3cc(C)n(CCOC)c3C)CC2)no1	732087734	CGGWXXVYAYTTSD-UYRXBGFRSA-N	426.521	1.948	50	20	IDGD	
O=C(NCCS(=O)(=O)NC[C@@H]1CCCCO1)NNC(=O)C12CC3CC(CC(C3)C1)C2	732474087	GJPILJVQIRYFAZ-FAKMSMKASA-N	442.582	1.022	50	20	IDGD	
Cc1cc(NNC(=O)[C@H]2CC(=O)N([C@H]3CCS(=O)(=O)C3)C2)ccc1Br	734254949	RJMTWYXQNWLJDP-AAEUAGOBSA-N	430.324	1.236	50	20	IDGD	
CN(CCO)S(=O)(=O)c1ccccc1CNC(=O)NNc1cc(F)c(F)cc1F	734669537	WQAOBMDRNRQEOC-UHFFFAOYSA-N	432.424	1.543	50	20	IDGD	
Cc1ccc(C)c(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)c3cnn(C)c3)cc2)c1	735473059	LXMFHNDGOOJTNU-UHFFFAOYSA-N	427.486	1.913	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)N[C@H](C)CN2CCN(c3ccccn3)CC2)cc1	735585763	HXEPTOYFBCWOFX-GOSISDBHSA-N	426.521	1.310	50	20	IDGD	
CC[C@@H](C)[C@H](NC(=O)N1CCCC1)C(=O)NNC(=O)c1nn(CC)c(=O)c2ccccc12	736066336	BOXKGUAWHVTLMZ-PBHICJAKSA-N	442.520	1.398	50	20	IDGD	
Cn1c(NNC(=O)c2ccc(N3CCCS3(=O)=O)cc2Cl)nc2ccccc2c1=O	736093098	VHKVYJKCRKGUKY-UHFFFAOYSA-N	447.904	1.884	50	20	IDGD	
O=C(CCn1nnc2ccccc2c1=O)NNC(=O)NCc1cccc(C(F)(F)F)c1	742459209	HBJDDZBJLXSLJP-UHFFFAOYSA-N	434.378	1.731	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCCc2cccs2)cc(NS(C)(=O)=O)c1OC	742583265	IIIFNJZUXOIJQT-UHFFFAOYSA-N	442.519	1.324	50	20	IDGD	
COc1ccc(O[C@@H](C)CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1	743510155	QORDGELQIZVJGF-ZDUSSCGKSA-N	435.506	1.400	50	20	IDGD	
Cc1cc(N2CC[C@@H](NC(=O)NNC(=O)c3c(Cl)cccc3Cl)C2=O)n(C)n1	743585204	DWBLKXBDGUJGJR-GFCCVEGCSA-N	425.276	1.785	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)c2cnn(-c3ccc(O)nn3)c2C)cc1Cl	743834735	RHLPTFMMSMQCBF-UHFFFAOYSA-N	447.839	1.813	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)[C@@H]2CCN(c3ccc(Cl)cc3)C2=O)c1	744842741	QTNHNSNZUUZIBQ-QGZVFWFLSA-N	440.843	1.569	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)N[C@@H](C)CN2CCN(c3ccccc3)CC2)cc1	745836625	CJTUUGQIZYAQIR-IBGZPJMESA-N	425.533	1.915	50	20	IDGD	
Cc1nccn1CCCCNC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	745842368	JQSLHAVZVNZRBC-UHFFFAOYSA-N	427.553	1.514	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2ccc(C)c(C(=O)NNC(=O)N3CCOCC3)c2)cc1	745992945	OMDJDCRYEOAQNY-UHFFFAOYSA-N	448.501	1.491	50	20	IDGD	
Cc1cccc(N2CCN(CCC(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)CC2)c1	746123968	VSRMQBOQRTYYQE-UHFFFAOYSA-N	444.557	1.372	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2ccc3nc(C)c(C)nc3c2)cc1OC	746180044	AYTHVHLMKIDNJA-UHFFFAOYSA-N	438.440	1.882	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)NCCCS(=O)(=O)Cc1ccccc1	746751067	HMRZPARXEFXYJQ-UHFFFAOYSA-N	429.502	1.212	50	20	IDGD	
C[C@H](c1ccccc1)[C@](C)(O)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	747348555	MWCPKFVWZUXSHT-ZHRRBRCNSA-N	445.541	1.787	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)[C@@H]2CCCN2S(=O)(=O)c2cccs2)c2ccccc21	749160030	QZVWMLJWTZLBQG-INIZCTEOSA-N	432.527	1.854	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)N[C@H]1CCN(CCCc2ccccc2)C1=O	750266321	HSCLJKXFQUYSBB-SFHVURJKSA-N	428.464	1.769	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)NC1CCSCC1	750330746	JLEDDNYSQCZSSE-UHFFFAOYSA-N	426.564	1.701	50	20	IDGD	
Cc1ccccc1-n1ncc(C(=O)NNC(=O)CNC(=O)c2ccco2)c1C(F)(F)F	751202990	YZRYJKBKOHWXPN-UHFFFAOYSA-N	435.362	1.984	50	20	IDGD	
Cc1cc(C(=O)NNS(=O)(=O)c2ccc(OCC(=O)O)c(F)c2)c2ccccc2n1	751260358	BWADUTIOBFJNSA-UHFFFAOYSA-N	433.417	1.769	50	20	IDGD	
O=C(Cc1cccc(Br)c1)NNC(=O)c1csc(N2CCOCC2)n1	751294792	RWTQOCGMUNOUNA-UHFFFAOYSA-N	425.308	1.746	50	20	IDGD	
O=C(NNS(=O)(=O)c1cnn([C@@H]2CCOC2)c1)c1cc(F)ccc1Br	751548459	RFNNWEMSCSLGEH-SNVBAGLBSA-N	433.259	1.369	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)c1nnc(O)c2ccccc12)c1ccc(S(=O)(=O)N(C)C)cc1	752502856	IZWPRIPCBZZVGZ-GFCCVEGCSA-N	443.485	1.150	50	20	IDGD	
C=CCn1c(=O)c2ccccc2n2c(SCC(=O)NNC(=O)c3ccc(C)o3)nnc12	752780349	ALTNVLLWEIFZIP-UHFFFAOYSA-N	438.469	1.685	50	20	IDGD	
Cn1c(NNC(=O)c2ccccc2S(=O)(=O)N2CCCCC2)nc2ccccc2c1=O	752908980	TWOXNXQKZKNPKP-UHFFFAOYSA-N	441.513	1.865	50	20	IDGD	
CN1CCCN(S(=O)(=O)c2cccc(NC(=O)NNC(=O)CC(F)(F)F)c2)CC1	756358603	KSGIFFNIKIIERX-UHFFFAOYSA-N	437.444	1.118	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)Nc2cnn(CC(=O)N(C)C)c2)cc1OC	756798396	ZRGLGJQLDSSONH-UHFFFAOYSA-N	432.481	1.625	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCc2n[nH]cc2C1)c1ccccc1NS(=O)(=O)c1cccs1	756872254	GRHYTWXFRUNGIS-LBPRGKRZSA-N	445.526	1.838	50	20	IDGD	
N#C/C(=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)NCCc1nc[nH]n1	759227084	OFTLSBZRZXICEP-NTEUORMPSA-N	438.879	1.463	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)CCc2nc(O)c3cnn(-c4ccccc4)c3n2)nc1	759722157	ZQBNJWNGDVSRNK-UHFFFAOYSA-N	433.428	1.779	50	20	IDGD	
CN1CCC(CNC(=S)NNC(=O)CN2c3cccc4cccc(c34)S2(=O)=O)CC1	760465575	ZIJFEKDVVDPWRU-UHFFFAOYSA-N	447.586	1.186	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)c1cn(-c2ccccc2)nn1	760916394	PNYVEXXSBDMGPL-CYBMUJFWSA-N	443.489	1.768	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)NCCCN1CCC[C@H]1C(=O)N(C)C	761680438	NUPKVIVJAJMREW-HNNXBMFYSA-N	437.566	1.060	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)C2=Cc3cc(F)ccc3OC2)CC1	762254130	JONQUFZSKFRFLE-UHFFFAOYSA-N	447.492	1.076	50	20	IDGD	
Cc1cc(F)c(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1F	762600162	ILLSPGMPSCVQTM-UHFFFAOYSA-N	433.458	1.147	50	20	IDGD	
O=C(Cc1csc(NC(=O)c2cccs2)n1)NNc1nccc(N2CCOCC2)n1	762857141	TZILINONUVUYCU-UHFFFAOYSA-N	445.530	1.769	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)CCCC[C@@H]3SC[C@@H]4NC(=O)N[C@H]34)n[nH]2)cc1	762952947	OCCVJHJXPRYMCD-LNLFQRSKSA-N	442.545	1.872	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2)cc1NC(=O)CN1CCCCC1	763424481	BCLRUFPOUXNGGF-UHFFFAOYSA-N	437.500	1.819	50	20	IDGD	
CCN(CC)C(=O)COc1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2)cc1Cl	763425413	JKXICFYUPKKKKN-UHFFFAOYSA-N	446.891	1.987	50	20	IDGD	
COc1ncncc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccncc2)nc2ccccc12	763535194	PZIPTPFVSANSSN-UHFFFAOYSA-N	443.423	1.495	50	20	IDGD	
Cc1cc(N2CCSCC2)ccc1NC(=O)C(=O)NNC(=O)c1ccc2c(c1)OCO2	763549242	VKWWAWDWJVMALT-UHFFFAOYSA-N	442.497	1.677	50	20	IDGD	
COC(=O)c1cc(C(C)C)ccc1NC(=O)C(=O)NNC(=O)[C@H]1COc2ccccc2O1	763571722	OBBMJZVQOGRBOA-GOSISDBHSA-N	441.440	1.523	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(C)cc1Br	763656641	DVGFZWHDMPEKRQ-UHFFFAOYSA-N	436.262	1.931	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cc(C#N)ccc2OC(F)F)cc1C	763666540	IQGAUXCDARRRHO-UHFFFAOYSA-N	432.383	1.941	50	20	IDGD	
CC(C)C(=O)NNC(=O)C(=O)Nc1ccc(N2C(=O)c3ccccc3C2=O)c(Cl)c1	763816775	OYXMQMGADBSNGT-UHFFFAOYSA-N	428.832	1.883	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc([S@@](C)=O)c(F)c2)c1C	763847550	DCVCIOBGTZSOSU-BRRNQIAESA-N	435.477	1.733	50	20	IDGD	
COc1ccncc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1cccc(Br)c1	763882249	HXXZJMKZUPJDAY-JTQLQIEISA-N	437.250	1.406	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(C(N)=O)ccc2F)cc1OC	763911523	GRADZKTZKBDVDC-UHFFFAOYSA-N	446.435	1.512	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)C(=O)Nc1ccccc1C(F)(F)F	763950106	SVNCMIGHUOHYKF-UHFFFAOYSA-N	433.346	1.996	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(N3C[C@@H](C)O[C@H](C)C3)cc2)c(O)c1	764109320	KFQQVKFYMSIFJR-HUUCEWRRSA-N	426.473	1.714	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)CC(F)(F)F)sc2c1CCSC2	764115855	YJNYEEYFXYELNM-UHFFFAOYSA-N	439.437	1.752	50	20	IDGD	
C[C@H]1CN(Cc2ccccc2NC(=O)C(=O)NNC(=O)c2cccc(C#N)c2)C[C@H](C)O1	764241871	MYKNKMXPBZIBNO-HOTGVXAUSA-N	435.484	1.567	50	20	IDGD	
CN(C)c1c(Cl)cccc1NC(=O)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	764258848	AUIIWKBHVFEZEZ-UHFFFAOYSA-N	445.911	1.199	50	20	IDGD	
C[C@@H]1Cc2ccccc2N1Cc1occc1C(=O)NNC(=O)CNC(=O)c1cccnc1	764344649	GVSAWSUUPHYDBD-OAHLLOKOSA-N	433.468	1.817	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)nc2n3CCCCC2)c1	764433104	JWOFARQXXDUIEM-UHFFFAOYSA-N	449.471	1.516	50	20	IDGD	
O=C(CS(=O)(=O)CCCc1ccccc1)NNC(=O)c1cc(-c2cccs2)[nH]n1	765563503	BJLOXPWNSPGJTR-UHFFFAOYSA-N	432.527	1.947	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)Cn3c(=O)nc(O)c4ccccc43)n[nH]2)c1	765582763	YQPFJTJDDNPYDA-UHFFFAOYSA-N	432.440	1.570	50	20	IDGD	
CNC(=O)c1cccc(C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)c1	765755182	OCAIQHMDVHPHLG-UHFFFAOYSA-N	443.935	1.278	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)c2ccc(=O)n(-c3ccccc3F)n2)n[nH]1	765880235	JZHFUVXJZUYGKI-UHFFFAOYSA-N	448.414	1.845	50	20	IDGD	
Cc1nc(CC(C)C)sc1C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	766643435	QERFPXJRKGWNEZ-UHFFFAOYSA-N	443.573	1.869	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)[C@@H]1CCc2c[nH]nc2C1	766662677	AQNDEACKCCSQKH-MRXNPFEDSA-N	430.940	1.133	50	20	IDGD	
Cc1cnc(N)c(S(=O)(=O)NNC(=O)c2ccc(CSc3nncn3C)cc2)c1	766891802	KSGITLKSXXPHRC-UHFFFAOYSA-N	433.519	1.016	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)c1ccc(N2C(=O)CCC2=O)c([N+](=O)[O-])c1	767428317	CBFVRSVBGXAJKL-UHFFFAOYSA-N	430.348	1.227	50	20	IDGD	
O=S(=O)(/C=C/c1ccccc1Cl)N1CCN(S(=O)(=O)CBr)CC1	767850443	KHDDELAGTVDAPM-BJMVGYQFSA-N	443.772	1.940	50	20	IDGD	
CN(C)[C@@H](CNC(=O)NNC(=O)C(=O)Nc1ccccn1)c1cccc(C(F)(F)F)c1	769535711	QTJMWRCRQJIYML-AWEZNQCLSA-N	438.410	1.672	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)F)cc1)Nc1cnn(CCN2CCOCC2)c1	770050457	AOFKIKOAEYCTLQ-UHFFFAOYSA-N	444.464	1.360	50	20	IDGD	
CC(C)(C(=O)OCC(=O)NNC(=O)c1cccc(Cl)c1)N1C(=O)c2ccccc2C1=O	770645729	RSXXJSLEJKVSDA-UHFFFAOYSA-N	443.843	1.719	50	20	IDGD	
CC(C)[C@@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772888375	IDPGDZULFAZBGR-CQSZACIVSA-N	426.901	1.653	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)[C@@H](c1ccccc1)N1CCSCC1	772890485	YFKGFRUPDCGIOH-GOSISDBHSA-N	446.960	1.894	50	20	IDGD	
O=C(NNc1cnc2ccccc2n1)C(=O)Nc1ccc2c(c1)C(=O)N(CC1CC1)C2=O	773716679	NBYBCNRRKMZIEP-UHFFFAOYSA-N	430.424	1.718	50	20	IDGD	
O=C(NNc1ncccn1)C(=O)Nc1cc(Br)cnc1OCC(F)(F)F	773720084	SYCAJAFEKAAGKV-UHFFFAOYSA-N	435.160	1.657	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)NC2CCN(C(=O)c3ccccc3C(F)(F)F)CC2)cn1	776178525	VEQKMNWBBQDNTE-UHFFFAOYSA-N	438.410	1.688	50	20	IDGD	
C#C[C@H](NC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1)[C@H]1CCCO1	776228641	AWLPHMDKZPFDKH-GOEBONIOSA-N	448.526	1.674	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)C2CCN(S(=O)(=O)c3cccnc3)CC2)c1	776527620	OSVRJRRWVNXYSS-UHFFFAOYSA-N	438.531	1.029	50	20	IDGD	
CCO[C@@H]1C[C@H](NC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])[C@@H]1Oc1ccccc1	776534403	PNNQAHDAKBJVES-CVAIRZPRSA-N	444.444	1.929	50	20	IDGD	
CC(C)N1C(=O)C[C@@H](C(=O)NNC(=O)N2CCOCC2)[C@H]1c1ccc(Cl)c(F)c1	776704628	DIKGLSGPGILRMD-CXAGYDPISA-N	426.876	1.850	50	20	IDGD	
COC(=O)N1CCC([C@@H](C)NC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)CC1	776922776	VFGGCDFEYVZLQK-GFCCVEGCSA-N	441.510	1.293	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)c2cc3c(O)ncnc3cn2)cc1	778286926	WKFGUKIKEIBCEM-UHFFFAOYSA-N	436.457	1.226	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1ccc2c(c1)CCC(=O)N2CC(F)(F)F	782125217	XUVDVSGGAPKCSH-UHFFFAOYSA-N	438.366	1.409	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2cc(S(=O)(=O)N3CCOCC3)ccc2C)cc1	783037158	MLIKKBOFFLOEOV-UHFFFAOYSA-N	448.501	1.106	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2ccc(Oc3ccccc3C#N)c(F)c2)CCS(=O)(=O)C1	783424243	CQMJYDAKTFAEQY-HXUWFJFHSA-N	446.460	1.626	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1ccc(SC(F)F)cc1	784005300	UMUGFAAOVOMLPR-UHFFFAOYSA-N	428.442	1.579	50	20	IDGD	
CS(=O)(=O)c1ccc(Cl)c(NC(=O)C(=O)NNc2ccnc(Br)c2)c1	784828670	NXJFBWJOTFUIGH-UHFFFAOYSA-N	447.698	1.983	50	20	IDGD	
COc1cccc(NNC(=O)C(=O)Nc2ccc(N3CCC(N(C)C)CC3)c(F)c2)n1	784846262	OACGINALRQCEBS-UHFFFAOYSA-N	430.484	1.842	50	20	IDGD	
Cn1ccnc1C(=O)c1ccc(NC(=O)C(=O)NNc2ccc(C(F)(F)F)nn2)cc1	784885845	DLLWRZMEWMMMQZ-UHFFFAOYSA-N	433.350	1.542	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNc2nccn(C)c2=O)sc2c1CCCCC2	785090770	YECCYGNJNCNHCG-UHFFFAOYSA-N	433.490	1.369	50	20	IDGD	
Cn1cnc2cc(NC(=O)C(=O)NNc3c(F)cc(C(=O)NC4CC4)cc3F)ccc21	785099881	MKFMWVSLTCWKKA-UHFFFAOYSA-N	428.399	1.826	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)N[C@@H]2CCCN(Cc3ccc(F)cc3F)C2=O)cc1	786973115	HNLRBXARKMKGCX-GOSISDBHSA-N	427.411	1.972	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)C(=O)Nc1ccc(-c2ccco2)cc1F	787543357	IPIANKHQTNLSBU-UHFFFAOYSA-N	435.375	1.461	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2cc([C@@H]3CCCOC3)nn2C)c1	790951819	MALGJYSMOOLLLM-OAHLLOKOSA-N	429.477	1.096	50	20	IDGD	
CCS(=O)(=O)c1ccc([C@H](C)NC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1	790988037	LWDJGMAEEPGNOW-SCLBCKFNSA-N	433.486	1.712	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)[C@](C)(O)Cn2cc(C(F)(F)F)ccc2=O)c1	792013587	CKHNQGNBABUAMU-LJQANCHMSA-N	441.406	1.461	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)NCCCCn2cc(Br)cn2)nc2ccccc21	792226205	PNUSDGCYBIDLOH-UHFFFAOYSA-N	448.325	1.886	50	20	IDGD	
O=C(Cc1ccc2c[nH]nc2c1)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	792774117	OMJDDVVKYGBSSQ-UHFFFAOYSA-N	441.513	1.741	50	20	IDGD	
Cc1nc2ccc(C(=O)NNC(=O)CN3CCN(C(=O)c4ccccc4)CC3)cc2n1C	793683783	UVNOPXMKGFOWEA-UHFFFAOYSA-N	434.500	1.101	50	20	IDGD	
Cc1onc(-c2cccnc2)c1C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	794780542	MRTZAMKGCKDVSH-UHFFFAOYSA-N	435.849	1.421	50	20	IDGD	
CCOC(=O)c1cc(S(=O)(=O)NNC(=O)c2cnccn2)c(F)cc1Br	795291038	VBKBWBCJDMVIHG-UHFFFAOYSA-N	447.242	1.178	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN[C@@H](CO)c2ccccc2OC(F)(F)F)n1	796526064	QDJYXGWIQNVETB-LBPRGKRZSA-N	432.424	1.363	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)Nc2ccc(C(=O)NCC(=O)N(C)C)c(Cl)c2)n1	797636294	ZEUAENYEAGAYTB-UHFFFAOYSA-N	432.868	1.328	50	20	IDGD	
COc1ccnc(NNC(=O)Nc2ccc(NS(=O)(=O)Cc3ccccc3)cn2)n1	797653689	HSGKRJGSWIJOOJ-UHFFFAOYSA-N	429.462	1.971	50	20	IDGD	
COc1ccccc1CONC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	798536733	QQZHMAJXDMAIAJ-UHFFFAOYSA-N	448.501	1.556	50	20	IDGD	
COc1cc(C(=O)CCC(=O)NNC(=O)C(=O)Nc2ccc(C)cc2)cc(OC)c1OC	801105553	HHWVQRAPOMTRIR-UHFFFAOYSA-N	443.456	1.770	50	20	IDGD	
C[C@@]1(c2cccc(C(=O)NNC(=O)Nc3ccc(OC(F)F)cc3)c2)NC(=O)NC1=O	802046990	YWZBPUUCHNOARZ-IBGZPJMESA-N	433.371	1.809	50	20	IDGD	
O=C(N[C@@H](C(=O)NN=c1cc[nH]cc1)c1ccccc1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1	803078200	DMUSEIVUPRUOJN-GOSISDBHSA-N	436.384	1.934	50	20	IDGD	
COC(=O)c1cc(NC(=O)NNc2ccc(-n3ccnc3)nn2)cc(S(C)(=O)=O)c1	806346783	RMGJDDNHOCYWAM-UHFFFAOYSA-N	431.434	1.001	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)C(=O)Nc1nc2c(s1)CSCC2	806977909	DFKNDZDKWVSUFF-UHFFFAOYSA-N	443.551	1.323	50	20	IDGD	
Cc1cccn(Cc2c(F)cccc2NC(=O)C(=O)NNc2cncc(Cl)n2)c1=O	806998078	QAVYJYAWSCUPMG-UHFFFAOYSA-N	430.827	1.869	50	20	IDGD	
COCC(C)(C)CCCNC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	807582748	CCTVKRYWEWKHFH-UHFFFAOYSA-N	440.566	1.868	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)C2(S(=O)(=O)c3ccccc3)CCOCC2)c1	807948523	LEVGGSWCFMLUAR-UHFFFAOYSA-N	431.514	1.537	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)Cc1ccc(S(=O)(=O)N2CCCCC2)cc1	808045421	KPOJCYRMDWSZDV-UHFFFAOYSA-N	441.550	1.340	50	20	IDGD	
COCCN(C)NC(=O)c1ccc(CNS(=O)(=O)c2ccc(NC(C)=O)cc2)cc1	808074914	MJZHPWMFORFEPX-UHFFFAOYSA-N	434.518	1.347	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)[C@H]2C[C@H](c3ccccc3)OC2=O)cc1OC	808585638	IEXGACLLEMQFOL-NVXWUHKLSA-N	442.424	1.312	50	20	IDGD	
N#Cc1ccc(-c2ccc(OCC(=O)NNC(=O)CNc3ccccc3C(N)=O)cc2)cc1	809541659	MPDSYYVWUHDWMW-UHFFFAOYSA-N	443.463	1.962	50	20	IDGD	
COC(=O)Nc1cccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)c1	813033359	PIUJAYMCNHHTML-UHFFFAOYSA-N	435.462	1.197	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2cccc(Br)c2)cc1	813033816	MVGBOEMZIZZZHN-UHFFFAOYSA-N	441.307	1.781	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)C(=O)Nc1cc(F)cc(F)c1F	815563474	DEXZZHACBKGZEX-UHFFFAOYSA-N	449.433	1.402	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)c2ccoc2C2(O)CCOCC2)C1	819659095	SEQHEGMGQJJQFB-AWEZNQCLSA-N	437.493	1.686	50	20	IDGD	
Cc1cc(C(=O)NNS(=O)(=O)c2ccc3[nH]c(=O)cnc3c2)c(C)n1-c1ccccc1	821128231	USWYRZRZWQJYPV-UHFFFAOYSA-N	437.481	1.954	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)c1	825796846	MSNGOXSRKDYNNK-UHFFFAOYSA-N	443.416	1.551	50	20	IDGD	
O=C(CNc1ccccc1)NNC(=O)c1cccc(S(=O)(=O)NC[C@@H]2CCCO2)c1	849211932	BWHGWQZCEUQCKX-KRWDZBQOSA-N	432.502	1.017	50	20	IDGD	
CC(=O)N1Cc2ccccc2C[C@@H]1C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	856531751	DTMILOUBICFHKX-HSZRJFAPSA-N	449.555	1.320	50	20	IDGD	
O=C(CN(Cc1ccccc1)S(=O)(=O)c1ccc(Cl)cc1)N1CC[C@H](B(O)O)C1	864234922	ZIFQHWUWQQZUKF-INIZCTEOSA-N	436.726	1.606	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)c1cn(-c2ccccc2Br)nn1	914708632	CLAYXBJDUPRTCP-INIZCTEOSA-N	444.245	1.631	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)c2ccc(F)c(S(=O)(=O)NC(C)C)c2)c1	914712568	MBBJJJXIOUOZEW-UHFFFAOYSA-N	439.465	1.604	50	20	IDGD	
COc1nn(C)c2nc(C)c(CCC(=O)NNC(=O)COc3ccc(F)cc3)c(C)c12	914749916	OFNCOJLAFHDAAD-UHFFFAOYSA-N	429.452	1.892	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)CNS(=O)(=O)c1cc(C)ccc1C	915776337	NFTAOMMWLIIUEU-UHFFFAOYSA-N	443.529	1.341	50	20	IDGD	
CCCCC[C@H](C)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	915885833	LICUGHPSLOZMTP-HNNXBMFYSA-N	426.539	1.620	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)NCCN2CCN(Cc3ccccc3)CC2)c1	915900984	AUOJPQDYISXKLF-UHFFFAOYSA-N	439.560	1.830	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)ccc1OCC(=O)NC(C)C	916138350	HEPQHLTXBLVUSR-CQSZACIVSA-N	447.463	1.966	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)NCc2ccnc(N3CCN(C)CC3)c2)cc1	916389815	FUTYFLFBFFOSBQ-UHFFFAOYSA-N	428.562	1.765	50	20	IDGD	
C[C@@H](Cn1cccn1)NC(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	916464475	WOOCBKGSJZEVCS-INIZCTEOSA-N	445.487	1.618	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	916556189	BTOLJDDIKJACSS-UHFFFAOYSA-N	431.514	1.839	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCc2nc(C)cs2)c1	916573717	VTQSJQMGIBDJOF-UHFFFAOYSA-N	439.563	1.669	50	20	IDGD	
CCNC(=O)COc1cccc(CNC(=O)NNC(=O)c2cc(Br)c[nH]2)c1	918091364	STRSYWNYOUJRHO-UHFFFAOYSA-N	438.282	1.436	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	918294165	KPKVOEMVHDRGAU-UHFFFAOYSA-N	426.498	1.887	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(CNC(=O)/C(C#N)=C/c2cc(C#N)n(C)c2C)cc1	918604863	VPJTYQHQPSEJCS-VCHYOVAHSA-N	441.513	1.353	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)NC[C@H](c2ccc(C)o2)N2CCOCC2)cc1	919899842	WPPFOPBPGBKMLD-LJQANCHMSA-N	430.505	1.933	50	20	IDGD	
O=C(NN=Cc1cccc(OCc2cccc(C(=O)O)c2)c1)N[C@H]1CCS(=O)(=O)C1	1318373420	PONPVCOCACHMIT-KRWDZBQOSA-N	431.470	1.784	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)Cn2cc(Br)cn2)CC1	1318903479	NNHWHZXPCWFTNH-UHFFFAOYSA-N	430.303	1.440	50	20	IDGD	
COc1ccc([C@@]2(C)NC(=O)N(CC(=O)NNc3cncc(Br)c3)C2=O)cc1	1319627932	YNQGVDMOZICPNT-GOSISDBHSA-N	448.277	1.763	50	20	IDGD	
CC(C)OCCCn1c(NNC(=O)[C@@H](C)N2C(=O)CCC2=O)nc2ccccc2c1=O	1321793777	ONKNSFGMETUFEI-CQSZACIVSA-N	429.477	1.192	50	20	IDGD	
O=C(NNc1nccnc1C1CCC1)Nc1ccc(S(=O)(=O)N2CCOCC2)cn1	1323520814	JOTUGBCCAWFGEW-UHFFFAOYSA-N	433.494	1.309	50	20	IDGD	
Cc1cc2c(cc1S(=O)(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1)OCO2	1325016730	QMOONLWHGTUFNH-UHFFFAOYSA-N	441.506	1.680	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2nc3ncccn3n2)C1	1778587264	XCEXVRXVEDNVIN-FOIQADDNSA-N	446.584	1.103	50	20	IDGD	
Cc1noc(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](F)Br)C2)n1	1780771936	VNOUWDYVBNLYKL-DJSGYFEHSA-N	433.278	1.125	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)CSc3ncccn3)CCO2)C1	1781227217	IKEHNDXZBKLSKX-IAGOWNOFSA-N	433.361	1.635	50	20	IDGD	
O=C(c1cc2cnccc2[nH]1)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781331080	CYUBMGQHQXISQT-PBHICJAKSA-N	425.258	1.697	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cccc(NC(=O)OC)c3)C2)C1	1781443494	BHUYFNNWZQPJSQ-OXQOHEQNSA-N	439.896	1.562	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(OC)c(OC)cc3C)C2)C1	1781895024	WLIMFYODNSWEAZ-KKSFZXQISA-N	440.924	1.710	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(O)cn1)C2	1781996918	YEFIKLOXCBILJD-CDHAZOANSA-N	426.311	1.698	50	20	IDGD	
Cc1nccc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](C)Br)C2)n1	1781999237	TYVPQFNRAISGPR-WBHUJUFNSA-N	425.327	1.696	50	20	IDGD	
COc1c(Cl)ccnc1C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](C)Br)C2)C1	1783535573	AKGUBBLSVMRVEU-DIFFPNOSSA-N	446.729	1.971	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cc(C)nn3-c3ccccc3)CCO2)C1	1783875505	MXHJYXGUFYIYPO-PGRDOPGGSA-N	446.935	1.878	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cc4cccnc4nc3O)CCO2)C1	1783880976	IVSYJGMVHLMPEB-YWZLYKJASA-N	434.880	1.033	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1ccc(Cl)cc1F)CCO2	1783932777	FFCQPPIRQGFDCT-FQEVSTJZSA-N	440.903	1.296	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc4ccccn34)C[C@@H]21	1786407083	OKQZJSUDRNTGKJ-DZKIICNBSA-N	435.322	1.713	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC1(c2ccc(NC(=O)C[C@@H]3NC(=O)NC3=O)cc2)CCC1	1786762912	ZQPWRPIADNSIAK-UGSOOPFHSA-N	441.315	1.955	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)c1cn2ccccc2n1	1787840948	KRHBQXKSFWWSSR-DUPGQFARSA-N	439.285	1.618	50	20	IDGD	
C=C[C@H](O)C(C)(C)C(=O)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1	1788145597	GVFROSXQOALRMZ-FQEVSTJZSA-N	436.317	1.687	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)c1cccc(C(F)(F)F)n1	1788878602	UZTWGZCPVDEIFE-IMIFBBOLSA-N	435.830	1.293	50	20	IDGD	
CCc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Br)C[C@@H]32)n(C)n1	1788946150	YEAUYBLUMCGUAR-LVGORTOPSA-N	431.306	1.266	50	20	IDGD	
COc1ccnc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)C(Cl)Cl)C[C@@H]32)c1OC	1789414058	UBZUZJUSGIBPFF-GVXVVHGQSA-N	432.304	1.496	50	20	IDGD	
Cc1nn(C)c(C)c1CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]2C1	1789926612	DJGKLWJKGIPLSN-NZUILWFCSA-N	445.333	1.250	50	20	IDGD	
C[C@@H](Oc1ccccn1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]2C1	1789926922	LIGQGCJJDOOBQL-BLDNINTCSA-N	444.301	1.519	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]21	1790609458	ANHZQQIGHNTFCS-LLLAAFKUSA-N	439.336	1.764	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(CO)o3)C[C@@H]21	1790961103	WKWUMUMHRZPPIO-PCBIJLKTSA-N	429.311	1.539	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(=O)oc3)C[C@@H]21	1790961913	XGVMUQAWZWFNGO-MXAVVETBSA-N	427.295	1.407	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/c1cc(F)c(F)c(F)c1)C2)[C@H](O)CCl	1792982996	XSACICNYSCCNLM-HQPDXQKMSA-N	432.826	1.306	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](O)CCl)CC1	1793117489	OYMCOUFXMIYEBO-YVSFHVDLSA-N	443.972	1.871	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cn3ccsc3n1)C2	1795115878	PYFAJEGLBNIXFL-GNXNZQSNSA-N	427.324	1.384	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](O)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCBr	1795495364	KYQUMZARQUPMKV-NWJSVONSSA-N	434.331	1.253	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1cscn1	1796242551	OXWZKFNHXPNNNE-TYQTXCSLSA-N	428.518	1.458	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(O)c(OC)c1	1798953670	DVDSEKSRLDERMQ-UMPJEAMMSA-N	441.322	1.778	50	20	IDGD	
C[C@H](Nc1cnccn1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@](C)(Cl)CCl	1799275812	BYMHAYWNYYCDMO-OZNCCCKXSA-N	430.336	1.103	50	20	IDGD	
C[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Br)n1cccc1C=O	1799346618	SWXAZAINCNRMPA-QIRZIZBZSA-N	430.274	1.142	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccnc3ncccc13)C2)[C@@H](F)Br	1799347017	KCLBCCJXIDYPBL-BAESOJJISA-N	437.269	1.524	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(F)c1[N+](=O)[O-]	1799634368	BIZVWCMEXDJXKS-NDPMZMCLSA-N	429.832	1.191	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CSc1ccncc1)C2	1800639930	CJCONKSMNJNFDZ-YXPYIKCWSA-N	442.379	1.937	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCCc1ccccc1F)C2	1800971291	UPHMBFFVPBSNMP-AXVVYFOYSA-N	426.916	1.992	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nccc(Cl)c1OC)C2	1800979023	OENFZRYSTPDBGN-ZMJPVWNMSA-N	432.304	1.201	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H]1CNC(=O)O1)C2	1801432949	WAZWIBDVKORBIZ-QLEUGIHGSA-N	430.411	1.618	50	20	IDGD	
C#CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2	1802128921	VYUHAEJJNKMUJC-XJFOESAGSA-N	448.347	1.296	50	20	IDGD	
CC[C@H](NC(C)=O)C(=O)NC[C@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1	1802541045	IQKDSNQHSSNKDD-SOLBZPMBSA-N	439.354	1.787	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2n[nH]c(C3CC3)c2F)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803141275	MLLFOKHGQKJYCI-SUNYJGFJSA-N	435.887	1.741	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)COc2ccccc2F)[C@H]1c1cccnc1)[C@H](O)CCl	1803148050	NOBIATBYMKGORN-VPWXQRGCSA-N	435.883	1.905	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)CN(C)C(=O)C(=O)O)[C@@H]1c1cccnc1	1803694767	LPKGCQUXKSFLKI-YQQAZPJKSA-N	438.912	1.038	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)Cc2cncnc2)[C@@H]1c1cccnc1	1804654785	VBIAGSSDBVDQLL-OWQGQXMQSA-N	432.322	1.904	50	20	IDGD	
Cc1ccc(=O)n(C(C)(C)C(=O)N2CCC3(CCCN(C(=O)[C@@H](O)CCl)C3)CC2)n1	1805522436	JDPAKOFYEDONMU-INIZCTEOSA-N	438.956	1.118	50	20	IDGD	
Cc1cncc(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)c1	1807363860	OVPKBMVACKSWJG-UGKGYDQZSA-N	444.300	1.098	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)c1[nH]nc2ncccc12	1808104588	KJLYQURZJYSACY-LXZKKBNFSA-N	428.880	1.272	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC2(CCCN(C(=O)CN3CCNC3=N)C2)CC1	1809751716	WZJUVYJQFYKGPU-CQSZACIVSA-N	428.375	1.231	50	20	IDGD	
Cc1ccc(C(=O)C(=O)N2CCC3(CCCN(C(=O)c4ccc(B(O)O)cc4)C3)CC2)cc1	1809974687	ZQQJQONMFVRULX-UHFFFAOYSA-N	448.328	1.403	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)[C@@H](COC)NC(C)=O)[C@@H]1c1cccnc1	1810560321	YTRMALSQGIPCDT-HCXYKTFWSA-N	438.956	1.646	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](O)C(=O)NC[C@@H]1CCN(C(=O)[C@H](F)Cl)[C@H]1c1cccnc1	1811507558	RGIGZBAKHUWZQN-RZLSGREXSA-N	444.891	1.465	50	20	IDGD	
C=C(C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)C(F)(F)F	1812677043	NIYJAKNYCSMZJJ-AEFFLSMTSA-N	447.222	1.200	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)[C@H](C)NC=O)[C@@H]1c1cccnc1	1812776768	IDLVSQIHINGJKK-QCEMKRCNSA-N	425.327	1.395	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)N1CC[C@H](CNC(=O)[C@H](C)Br)[C@@H]1c1cccnc1	1812864461	PLJDGHZIQGBZHE-IXKJSCDLSA-N	439.354	1.738	50	20	IDGD	
CC(=O)N[C@H](C)C(=O)N1CC[C@H](CNC(=O)[C@H](C)Br)[C@@H]1c1cccnc1	1812867200	GBNCRUBMZKVSPE-OJDYBEQGSA-N	425.327	1.395	50	20	IDGD	
Cc1cnc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)s1	1816285822	VXGUFTIISJUNSP-CQSZACIVSA-N	433.538	1.854	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3[nH]nc4ccncc34)sc2C1	1816866432	WZSWNSKGHAGMLB-ONGXEEELSA-N	434.909	1.894	50	20	IDGD	
O=C(CN1CCCC1=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](F)Br)[nH]n1	1817160020	PLYZOBHJPWWVFA-ABAIWWIYSA-N	430.278	1.715	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1cnccc1F	1817732823	KVQBDXIDZUCJAH-SFHVURJKSA-N	437.240	1.243	50	20	IDGD	
CC[C@@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN2CCS(=O)(=O)CC2)[nH]n1	1820853286	HZDRCDSIJZAXPD-HIFRSBDPSA-N	445.973	1.150	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](C)O)CC2	1821305032	YZMBRFRORRIXKW-GXSJLCMTSA-N	448.457	1.583	50	20	IDGD	
O=C(COc1ccc(O)nn1)Nc1cc([C@@H]2CCCCN2C(=O)C(Cl)Cl)[nH]n1	1821668351	NXMOCIKEAYDBPW-JTQLQIEISA-N	429.264	1.780	50	20	IDGD	
O=C(CCn1ccnn1)N[C@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1	1823013965	LPXVXXIRMNERON-QPUJVOFHSA-N	431.291	1.427	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](C)n3cnnn3)sc2C1	1826973972	WFOFOZUUUSUHGY-BBBLOLIVSA-N	442.343	1.334	50	20	IDGD	
Cc1ncc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)cn1	1827050371	PHRDTBICBSWJAZ-OAQYLSRUSA-N	436.321	1.012	50	20	IDGD	
O=C([C@H]1CCCS1)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827059666	FMGSSWVHCIIDMT-WOJBJXKFSA-N	430.379	1.495	50	20	IDGD	
O=C([C@H](O)CCl)N1CCC([C@H]2CCCCN2C(=O)c2cccn3c(O)nnc23)CC1	1827535583	NFVDSSKDZBCOLG-HZPDHXFCSA-N	435.912	1.268	50	20	IDGD	
N#CCC(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)[C@H](F)Cl)C2)C1	1828807459	BHIUPXOZIICKKU-FXAWDEMLSA-N	436.871	1.887	50	20	IDGD	
C[C@@H]1C[C@]1(C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1	1830218851	HOWVJTTUOGOVJB-ZOUOIUENSA-N	427.549	1.965	50	20	IDGD	
CC(C)(Cc1ccccc1)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1	1830719687	HIZVAYNZFPLTDB-XMSQKQJNSA-N	438.952	1.311	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](NC(C)=O)C(C)(C)C)CCO2	1831082176	DPGGOEADMXBFQB-CSODHUTKSA-N	445.988	1.401	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3CCN(C(C)C)CC3)C2)C1	1831639938	HEIIZCQZNNTURB-SIKLNZKXSA-N	444.016	1.971	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3c[nH]c4nccc-4c3)C2)C1	1831647803	YZMLMRKFWLTJMD-DYESRHJHSA-N	434.924	1.992	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)n3ccnc3C)C2)C1	1831658831	IORKLGASWXUDOZ-SYNHAJSKSA-N	426.945	1.616	50	20	IDGD	
Cc1cccnc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)CBr)C2)C1	1831820599	BWEABKHAGCHKRE-BEFAXECRSA-N	440.338	1.491	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)C(=O)c3ccco3)CCO2)C1	1832667440	FFKDZRKUDLWTRF-FZKQIMNGSA-N	443.294	1.092	50	20	IDGD	
O=C(Cc1cccnc1Cl)NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1833767480	YBILDLLCAABKBA-QGZVFWFLSA-N	443.375	1.449	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccns3)CCO2)C1	1833779023	PQINPVFPHZFSHV-WBMJQRKESA-N	432.340	1.387	50	20	IDGD	
O=C(CC1CCCC1)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1	1834364989	XGTOHCFHHYVWOD-UHFFFAOYSA-N	441.381	1.132	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)CC3CCOCC3)CCO2)C1	1835416524	VWADVPDHQUEZIA-KXBFYZLASA-N	447.370	1.291	50	20	IDGD	
C/C=C/C=C\C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1	1835738236	NZRZTTHSRXASOI-IAROGAJJSA-N	440.548	1.003	50	20	IDGD	
Cn1cc(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)cn1	1835986387	PYIHBOFALFLSBV-FQEVSTJZSA-N	426.945	1.074	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc4nncn4c3)CCO2)C1	1837012445	ORJREZBMDAPJBH-FQEVSTJZSA-N	435.912	1.064	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4cnccc4[nH]3)C2)C1	1837713085	GJQTUXYHKRDPBS-OAQYLSRUSA-N	446.580	1.484	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnccc3Cl)CCO2)C1	1837780881	QALZIPUTVFNZQK-CRAIPNDOSA-N	432.304	1.059	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cccnc3)C2)C1	1839152254	SGARUOAPYAITCX-RBUKOAKNSA-N	430.332	1.317	50	20	IDGD	
CN1CCC[C@H](C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)C1	1839154285	JEHSDCJYCKDNPH-ZYSHUDEJSA-N	436.380	1.021	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccccc3C(N)=O)CCO2)C1	1839349509	YOIROOPLTGTLHR-OAQYLSRUSA-N	437.924	1.121	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(C)nc3C)C2)C1	1840153929	GDMGUZSCEJHRRJ-FXAWDEMLSA-N	425.913	1.022	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4[nH]c(C)cc4c3)C2)C1	1840155161	RBUUBQYCGDIVOB-PGRDOPGGSA-N	449.935	1.800	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1C[C@]1(F)Cl)CCO2	1840247741	HTHINSIBLYCKSV-YXAMBPQSSA-N	441.725	1.541	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)/C=C/c3ccc(C)s3)CCO2)C1	1840397413	ZPILLCACWQDAMA-YWFTZVROSA-N	442.965	1.780	50	20	IDGD	
Cc1ncc(/C=C/C(=O)N2CCO[C@@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)s1	1840520386	CYNQCRWQGONCSO-YATRRXNKSA-N	434.345	1.725	50	20	IDGD	
COc1cc(C)ccc1C(=O)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1840680597	NBCAPKRJEPTWOJ-LJQANCHMSA-N	431.316	1.877	50	20	IDGD	
Cc1cc(Br)c(N)cc1C(=O)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1	1841350768	WRCOYDOPGJBPGG-CQSZACIVSA-N	430.730	1.756	50	20	IDGD	
CN[C@@H](CC(=O)N1CCCC12CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)C2)C(=O)O	1842953037	LCKIURRNLYIHKZ-VRXKTSEUSA-N	432.427	1.138	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCCC12CN(C(=O)COc1cccnn1)C2	1845871980	MRSUKFBIQOOBOS-CXUHLZMHSA-N	439.422	1.944	50	20	IDGD	
Cc1cn2c(=O)c(C(=O)N3CC4(CCCN4C(=O)[C@H](C)Br)C3)cnc2s1	1846176866	JDUVGCUWIUBJQD-NSHDSACASA-N	439.335	1.665	50	20	IDGD	
COc1ccc(C(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)cc1Cl	1846844678	IRZCUYQXZSIJRV-UHFFFAOYSA-N	428.681	1.159	50	20	IDGD	
CN(CC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H]1C[C@H]1C1CC1)NC(=O)NCc1ccccc1	1847490627	UINLZLKETUQCKV-WOZUAGRISA-N	439.560	1.581	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cc3c(C)nn(C)c3s2)cc1	10471228	GOZTURRPTOTHSO-UHFFFAOYSA-N	435.531	1.333	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc2ccccc2c1)NNC(=O)c1cccc([N+](=O)[O-])c1	17330373	FZLWVDCERQPQNV-UHFFFAOYSA-N	442.453	1.878	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccccc2Br)c1	17358746	GLKZEXPUCSXADT-UHFFFAOYSA-N	426.292	1.774	50	20	IDGD	
Cc1sc2ncn(CCC(=O)NNC(=O)c3ccc4c(c3)OCCO4)c(=O)c2c1C	22991440	SPXCLFRSISHUCP-UHFFFAOYSA-N	428.470	1.697	50	20	IDGD	
CCn1c(=O)c2ccccc2n(CC(=O)NNC(=S)Nc2cccc(Cl)c2)c1=O	26857710	BBEWXRHBDBLHON-UHFFFAOYSA-N	431.905	1.854	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)CN(C)Cc2ccccc2)c1	109355604	QERBSWCTRWQLNE-UHFFFAOYSA-N	432.546	1.610	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)CNC(=O)c3ccc(Br)o3)[nH]n2)cc1	195677650	QPHDUICTNDTPRP-UHFFFAOYSA-N	446.261	1.932	50	20	IDGD	
C[C@H](C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1)S(=O)(=O)c1ccc(F)cc1	726863387	RXBJIDTZXZAPLF-GFCCVEGCSA-N	441.506	1.572	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)[C@@H]1CCN(c2ccc(F)cc2)C1=O	728211288	QAGDABPQGNMHPY-SFHVURJKSA-N	432.477	1.763	50	20	IDGD	
CCc1c(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)[nH]c(C)c1C(C)=O	728330372	IXBNJELRNWEFLZ-INIZCTEOSA-N	429.429	1.232	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)[C@@H]2CCCN2c2ncnc3sccc23)cc1	728600754	RNIWMSVIBZDQRO-INIZCTEOSA-N	426.502	1.928	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)c2cccc3c2O[C@H](C)C(=O)N3)c2ccccc2c1=O	729300777	UMYLFXNQPZRXRT-GFCCVEGCSA-N	435.440	1.772	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(CCNC(=O)NNC(=O)c2ccccc2O)s1	729615099	XEWSSLBTARYJAK-UHFFFAOYSA-N	440.547	1.671	50	20	IDGD	
CC(C)(C)CC(=O)N1CSC[C@@H]1C(=O)OCC(=O)NNC(=O)c1cccc(Cl)c1	730322794	CPEPMHFXGCKKAW-CQSZACIVSA-N	441.937	1.982	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)Cc2ccccc2F)cc1S(=O)(=O)N1CCOCC1	731330322	JUEFKPNOOXISKP-UHFFFAOYSA-N	449.504	1.413	50	20	IDGD	
CCN1CCN(CC(=O)NNc2ccc(Br)cc2C(F)(F)F)C(=O)C1=O	731478339	AYFLITYBPNSBGZ-UHFFFAOYSA-N	437.216	1.602	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)CCNS(=O)(=O)c1ccc(OC)c(OC)c1)c1ccccc1	732132967	MCHPJCFJYDRSHA-QGZVFWFLSA-N	449.529	1.713	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2ccc(COc3ccccc3C#N)o2)C[C@@H](C)O1	732263122	KCAMRDBDSHIEEO-IYBDPMFKSA-N	426.473	1.991	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)c1ccc(CS(C)(=O)=O)o1	734252331	NZMNCJZOMNFQFI-UHFFFAOYSA-N	429.520	1.658	50	20	IDGD	
Cc1ccc(N2CCCC2)c(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1	735166080	CYZNMWUSFZKRQI-HXUWFJFHSA-N	439.468	1.739	50	20	IDGD	
CN(C)C(=O)CCCC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	735840050	CBZCGDKMLUQEMN-UHFFFAOYSA-N	446.529	1.185	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCCCC(=O)NNC(=O)COCc2ccccc2)cc1C	737926640	MANJHXJFHVQKCR-UHFFFAOYSA-N	433.530	1.726	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CCC[C@H]1C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	739552936	XSQBPTHSKIVCES-HZPDHXFCSA-N	432.525	1.534	50	20	IDGD	
CC(=NNC(=O)c1cc([N+](=O)[O-])ccc1O)c1ccc(S(=O)(=O)N2CCNCC2)cc1	741773401	ADNFQBXNAUWPJX-UHFFFAOYSA-N	447.473	1.048	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)[C@@H](C)NC(=O)c2cc3c(C)nn(C)c3s2)c1	742034511	OXDOSHIXOSNQQY-LLVKDONJSA-N	445.501	1.540	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)c1cn([C@H]2CCS(=O)(=O)C2)nc1C(C)C	742487983	CQRZXSNRAJNEJV-AWEZNQCLSA-N	444.517	1.397	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NCc2ccc(-n3ccnc3)cc2)cc1	743564697	HBDIAYCETODDER-UHFFFAOYSA-N	428.474	1.812	50	20	IDGD	
O=C(NNC(=O)N1CCN(C(=O)c2ccccn2)CC1)c1cccc(Br)c1	743688135	XRYDZPIDMIYTQV-UHFFFAOYSA-N	432.278	1.657	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)cc(NC(C)=O)c1OC	743821446	POOUEBYIOWARFU-UHFFFAOYSA-N	428.445	1.679	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)Cn2c(=O)ccn(Cc3ccccc3)c2=O)c(Cl)c1	743825148	VKCQJNYVNGNHBU-UHFFFAOYSA-N	441.875	1.873	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)NCc1ccccc1OCCN1CCOCC1	744292053	NBOPPYDFVDQSQV-UHFFFAOYSA-N	442.516	1.479	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)[C@H](Cc2cccc(F)c2)n2nnnc2C)c1	745017054	DAZPNGVFEAKKQM-SFHVURJKSA-N	440.435	1.217	50	20	IDGD	
COc1cc2c(cc1CNC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)O[C@@H](C)C2	746343679	FYAOZGOXRSMHNH-LBPRGKRZSA-N	433.486	1.566	50	20	IDGD	
CN1CCN([C@H](CNC(=O)NNC(=O)Cc2cn3ccccc3n2)c2cccs2)CC1	746743446	LFJJMPDNZOEPBE-QGZVFWFLSA-N	441.561	1.257	50	20	IDGD	
COc1cc(C)nc(NNC(=O)NC2CCN(C(=O)Cc3ccccc3OC)CC2)n1	746761839	MUGFNCIUPIUDGE-UHFFFAOYSA-N	428.493	1.662	50	20	IDGD	
COC[C@H](Cc1ccccc1)NC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	746778783	FLDNWBSGUFKMSM-NRFANRHFSA-N	439.560	1.787	50	20	IDGD	
CSCC[C@H](C(=O)NNC(=O)CCOc1ccccc1)N1C(=O)[C@H]2CCCC[C@@H]2C1=O	747179401	SBIWTONOHQJMHU-OKZBNKHCSA-N	447.557	1.900	50	20	IDGD	
CC(=NNC(=O)Cc1ccncc1)c1ccc(S(=O)(=O)N2CCCC[C@H]2C(=O)O)cc1	747641520	CZRZULMHBYFQCE-IBGZPJMESA-N	444.513	1.792	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCOCC2)cc1C(=O)NNC(=O)CC1CCCC1	749951336	CDKFBXRXNCCPHI-UHFFFAOYSA-N	425.507	1.057	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)[C@@H]1CC(=O)N(Cc2ccccc2Cl)C1	751209096	KGMGCICXVDICSV-CYBMUJFWSA-N	434.905	1.327	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)Cc3cnn(C)c3)c2)c(C)c1	751280806	KGIHMOFYCGWGNB-UHFFFAOYSA-N	441.513	1.841	50	20	IDGD	
COc1cc(C(=O)NNC(=O)/C=C/C(=O)Nc2ccc3n[nH]cc3c2)cc(OC)c1OC	752898290	FYPIMXFMFJUTOR-VOTSOKGWSA-N	439.428	1.545	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)CCCc2ccccc2)c(C)c([N+](=O)[O-])c1	753842195	ZLMVMWKDENZAME-UHFFFAOYSA-N	442.428	1.799	50	20	IDGD	
Cc1ncc(S(=O)(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)s1	754754649	NYHREMFSGPZOJL-UHFFFAOYSA-N	443.982	1.232	50	20	IDGD	
CCN(CC)C(=O)CCC(=O)NNC(=O)c1cccc(S(=O)(=O)N(CC)CC)c1	755037983	XKYGOJRDKLOFRG-UHFFFAOYSA-N	426.539	1.127	50	20	IDGD	
C#CCOCCC(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccc(OC)cc2)c1	755380757	FUKHHTYQBZBGCD-UHFFFAOYSA-N	431.470	1.297	50	20	IDGD	
COc1c(F)ccc(F)c1C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	755428476	VLAIANLKFQANPB-UHFFFAOYSA-N	427.429	1.751	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)n([C@@H]2CCS(=O)(=O)C2)n1	755538034	ZGCXJOPKDWFUEF-FYMRZPMTSA-N	435.550	1.920	50	20	IDGD	
C[C@]1(CNC(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)CCCO1	756079445	UFEZWCKCPCWPOX-HSZRJFAPSA-N	435.484	1.958	50	20	IDGD	
CCOC(=O)N(C)c1ccc(NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1	756192673	QORGSVGCWJUMIP-UHFFFAOYSA-N	438.444	1.993	50	20	IDGD	
COc1ccc(C(=O)N2CCN(C)CC2)cc1NC(=O)NNC(=O)c1ccccc1O	756247610	HUBMLSOUOZNSNB-UHFFFAOYSA-N	427.461	1.255	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)Nc1ccn(CCS(C)(=O)=O)n1	756758001	DLBPOHGRZYTKJE-AWEZNQCLSA-N	445.501	1.701	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)c1cncc(N2CCOCC2)c1	756866305	ACIMTPUVBXRAHO-CYBMUJFWSA-N	449.305	1.909	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NN=Cc2cc(O)c(O)c(Br)c2)c1	757560947	RLYRCBIXOFSXQT-UHFFFAOYSA-N	442.291	1.875	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)Nc2c(C)nn([C@H]3CCS(=O)(=O)C3)c2C)c1O	757872362	XOPGSXNWPDNHQM-LBPRGKRZSA-N	437.478	1.040	50	20	IDGD	
C[C@H](CC(=O)NNC(=O)c1ccc2ccccc2n1)NS(=O)(=O)c1cccnc1Cl	760210157	CDCIMFQKVVLKIX-GFCCVEGCSA-N	447.904	1.801	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1Br)C(=O)Nc1ccccn1	760373779	WBGYNPBDQDGZJM-UHFFFAOYSA-N	429.234	1.430	50	20	IDGD	
CCCS(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)c2ccc(C)o2)c(OC)c1	761269410	ASRVDIUIQNTRDC-UHFFFAOYSA-N	431.492	1.372	50	20	IDGD	
C[C@@H]1CN(Cc2ccc(C(=O)NNc3nccc(N4CCOCC4)n3)cc2)C[C@@H](C)O1	762848094	NMPMYJUJJSUHHQ-IAGOWNOFSA-N	426.521	1.679	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)c2cccc(S(=O)(=O)NC[C@@H]3CCCO3)c2)n1	762905940	BZVTYFBXTJZJAS-INIZCTEOSA-N	448.549	1.537	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)CCNS(=O)(=O)c2cccc([N+](=O)[O-])c2)n1	762915956	ZJCRGGQAYCFFIO-UHFFFAOYSA-N	437.482	1.043	50	20	IDGD	
O=C(CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@H]12)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	763172825	BBAWZGDOVDJMLA-BQFCYCMXSA-N	446.508	1.703	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNS(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-]	763439408	OHFMKKGFRZVQTD-UHFFFAOYSA-N	436.874	1.863	50	20	IDGD	
Cc1cccc(C(=O)N2CCCC2)c1NC(=O)C(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	763444822	BGRHZZZBZSFEAH-UHFFFAOYSA-N	439.428	1.539	50	20	IDGD	
O=C(NNC(=O)c1ccccc1O)C(=O)Nc1ccc2nc(N3CCOCC3)sc2c1	763525538	CLKJIYHRJRPCIR-UHFFFAOYSA-N	441.469	1.238	50	20	IDGD	
Cc1cc2c(cc1NC(=O)C(=O)NNC(=O)COc1cccc(C(F)(F)F)c1)OCO2	763639961	MWOGTLIMTHXVGS-UHFFFAOYSA-N	439.346	1.907	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(F)c(SC)c(F)c1	763664032	QBHQAGYYMRPQEL-UHFFFAOYSA-N	425.413	1.860	50	20	IDGD	
COC(=O)[C@H](C)Cc1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2F)cc1	763681695	PPFYHJBACVDAHX-CYBMUJFWSA-N	431.420	1.342	50	20	IDGD	
NC(=O)c1cc(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)ccc1Cl	763686129	KECXLZAMSJFAKR-UHFFFAOYSA-N	425.228	1.257	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1nn(-c2ccc(C#N)cn2)cc1C	763717170	PWFTYSZJMMBDDR-UHFFFAOYSA-N	447.455	1.175	50	20	IDGD	
COC(=O)c1csc(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)c1C	763745219	AWOOMDYNAHOPQU-UHFFFAOYSA-N	430.486	1.382	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(CCN2CCCC2)cc1	763809217	SSDWXQWXOIVNKU-UHFFFAOYSA-N	435.484	1.361	50	20	IDGD	
Cc1nc(Br)ccc1NC(=O)C(=O)NNC(=O)COc1ccccc1C#N	763814146	QJLZFWSHEGDXFV-UHFFFAOYSA-N	432.234	1.189	50	20	IDGD	
CC(C)C(=O)NNC(=O)C(=O)Nc1cccc(CS(=O)(=O)c2ccc(F)cc2F)c1	763817939	ZZZZEVUGAIYBQL-UHFFFAOYSA-N	439.440	1.681	50	20	IDGD	
COCCOc1ccc(F)cc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccccc1F	763851016	SUOZSABQALLEOE-GFCCVEGCSA-N	437.399	1.543	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2cccc(CCN3CCC(C)CC3)c2)n1	763882951	XVOREZAZAKZYPW-UHFFFAOYSA-N	440.548	1.560	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2scc(C(=O)OC)c2C)cc1OC	763901253	ITGHEOMGUSWVGH-UHFFFAOYSA-N	435.458	1.650	50	20	IDGD	
C#CC[C@]1(C(=O)NNC(=O)[C@H]2COc3ccccc3O2)CCCN1C(=O)OC(C)(C)C	763920792	RIUAYTJGUVPKAB-VGOFRKELSA-N	429.473	1.767	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccc(Cl)cc2)c(C)c1	763942959	WTWWOOAMKFMJKZ-UHFFFAOYSA-N	433.848	1.529	50	20	IDGD	
CC(=O)Nc1cc(NC(=O)C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)ccc1C	763944779	PQPVPRHOUXBHEZ-UHFFFAOYSA-N	436.428	1.244	50	20	IDGD	
COCCc1ccc(Oc2ccc(NC(=O)C(=O)NNC(=O)c3cnccn3)cc2)cc1	764025871	ZPGSBOKUILKSQN-UHFFFAOYSA-N	435.440	1.858	50	20	IDGD	
O=C1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3cccc4ccccc34)cc2)CCN1	764058251	NQZRWQKEBOLLBC-UHFFFAOYSA-N	431.452	1.176	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2csc(-c3ccccn3)n2)cc1	764127883	UFXBFVVVWORZGY-UHFFFAOYSA-N	425.470	1.932	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2cccc(Oc3cnccn3)c2)cc1	764132908	YLGIWLWXDCXATG-UHFFFAOYSA-N	435.440	1.996	50	20	IDGD	
CCNC(=O)c1ccc(C)c(NC(=O)C(=O)NNC(=O)c2ccc(CN(CC)CC)o2)c1	764139131	NUZBDRHRZYCYIT-UHFFFAOYSA-N	443.504	1.579	50	20	IDGD	
C[C@H]1CN(Cc2cccc(NC(=O)C(=O)NNC(=O)CCc3ccco3)c2)C[C@H](C)O1	764171456	LFPGIGBRKSULRH-HOTGVXAUSA-N	428.489	1.608	50	20	IDGD	
O=C(NNC(=O)c1cccc2ncccc12)C(=O)Nc1ccc(NC(=O)[C@H]2CCCO2)cc1	764253296	OVDIYBQJNCWAAH-LJQANCHMSA-N	447.451	1.752	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccccn2)cc1NC(=O)OC(C)(C)C	764267145	PPNXGNIFVBXUCZ-UHFFFAOYSA-N	443.460	1.766	50	20	IDGD	
CC[C@@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)CCc2ccccc2O)cc1	764281418	WQVYBOZIFGDNGK-CQSZACIVSA-N	426.473	1.639	50	20	IDGD	
C[C@@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)CCCc3cccs3)cn2)C[C@@H](C)O1	764342526	ZPZLXZWRHDIOTQ-HUUCEWRRSA-N	445.545	1.866	50	20	IDGD	
CC(C)CNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1	764351994	VNVKOJLQHRMNIE-UHFFFAOYSA-N	448.483	1.658	50	20	IDGD	
COC(=O)c1cc(F)c(F)cc1NC(=O)C(=O)NNC(=O)CSc1ccccc1O	764400793	HOZZPWCPGABPAU-UHFFFAOYSA-N	439.396	1.335	50	20	IDGD	
Cc1cccc(COc2ccc(NC(=O)C(=O)NNC(=O)[C@@H]3COCCO3)c(C)c2)c1	764430647	YEAVYJDOAJHEHO-IBGZPJMESA-N	427.457	1.384	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)CC(F)(F)F)cc(Br)c1F	764664226	SZNAIGXODDKCQT-UHFFFAOYSA-N	444.135	1.413	50	20	IDGD	
O=C(CCC(=O)N1CCN(c2ccccn2)CC1)NNC(=O)NCCc1cccs1	765121847	UAJMQPFOSMYQON-UHFFFAOYSA-N	430.534	1.145	50	20	IDGD	
O=C(CSc1ccccc1O)NNS(=O)(=O)c1cc2c3c(c1)CC(=O)N3CCC2	765143559	VYENVQMXDVZTMI-UHFFFAOYSA-N	433.511	1.329	50	20	IDGD	
O=C(CNC(=O)c1cc(-c2ccccc2)on1)NNC(=O)CSc1ccccc1O	765253329	QUGIKBRSYMLPRC-UHFFFAOYSA-N	426.454	1.717	50	20	IDGD	
Cc1cccc2c(CC(=O)NNC(=O)CN3CCN(C(=O)c4ccccc4)CC3)c[nH]c12	765738265	JLTGREZPEQIZQA-UHFFFAOYSA-N	433.512	1.624	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)[C@@H]1SCCc2sccc21	766643771	SHBUFUGQJUBISM-LJQANCHMSA-N	444.582	1.684	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C[C@H](C)S(=O)(=O)c1ccc(F)cc1	768634864	QXYDZJNVCFCLEG-LBPRGKRZSA-N	444.506	1.933	50	20	IDGD	
COc1ccccc1[C@]1(C)NC(=O)N(CC(=O)NNc2cc(C#N)cc(Cl)n2)C1=O	768711793	USUICGYOGVNFCY-IBGZPJMESA-N	428.836	1.526	50	20	IDGD	
CS(=O)(=O)c1ccc(C(=O)NNC(=O)Cc2ccccc2F)cc1Br	769742917	JWFXUMLLQHTOFM-UHFFFAOYSA-N	429.267	1.995	50	20	IDGD	
O=C(NNc1c(F)cccc1Cl)C(=O)Nc1ccc(CC(=O)N2CCOCC2)cc1	770805926	IMHVLJGFRFEPSS-UHFFFAOYSA-N	434.855	1.962	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)CCn3nc(O)c4ccccc4c3=O)nc21	770966555	UXUWTNMRHPOBQN-UHFFFAOYSA-N	438.448	1.236	50	20	IDGD	
C[C@H](NS(=O)(=O)c1cccs1)C(=O)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	771045219	MZDVSISNOPURMV-JTQLQIEISA-N	437.478	1.405	50	20	IDGD	
CS(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)c2ccc(Cl)cc2F)cc1F	771152168	RJYSPKVNLDAJHR-UHFFFAOYSA-N	439.849	1.613	50	20	IDGD	
CC(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)c1	771440570	WAUZVUPVVSXXSJ-UHFFFAOYSA-N	427.523	1.935	50	20	IDGD	
Cc1cc(F)c(S(=O)(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)cc1[N+](=O)[O-]	771606257	GLPCQWQQDVCQAR-UHFFFAOYSA-N	444.828	1.322	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)CSc1nncn1-c1ccc(C)c(Cl)c1	771923347	UEKUXKYFVMROEQ-LLVKDONJSA-N	425.898	1.810	50	20	IDGD	
COc1cccc(-c2nc(C)c(C(=O)OCC(=O)NNC(=O)Cc3nc(C)cs3)[nH]2)c1	772103999	DJPQVDBBALDJAP-UHFFFAOYSA-N	443.485	1.706	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)[C@@H](C(C)C)N1CCCS1(=O)=O	772630820	NBIHMVZQDKAZHF-OAHLLOKOSA-N	436.559	1.940	50	20	IDGD	
Cc1cc(S(=O)(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)ccc1OCC(=O)O	773264555	KZFIIKKBXMHAMP-LBPRGKRZSA-N	442.877	1.889	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)NCCOc2ccc(NS(C)(=O)=O)cc2)c1	773792376	ZRNLBLOEIXBTEH-UHFFFAOYSA-N	435.506	1.147	50	20	IDGD	
CCOC(=O)N1CCC[C@H]([C@@H](C)NC(=O)NNC(=O)CNC(=O)c2cccs2)C1	776866334	DRWQDEWWYJHWLU-OLZOCXBDSA-N	425.511	1.065	50	20	IDGD	
CSc1cccc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1[N+](=O)[O-]	777077152	CXELUGSCJUEQQW-AWEZNQCLSA-N	447.425	1.461	50	20	IDGD	
CCCc1nc(C)c(NC(=O)C(=O)NNC(=O)c2cc(Br)cn2C)s1	777141139	HMDAJNJHSPXHQQ-UHFFFAOYSA-N	428.312	1.905	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)Nc1ccnn1Cc1cccc(Cl)c1Cl	779463184	YNSXXKFSSHAGIB-NSHDSACASA-N	446.316	1.826	50	20	IDGD	
O=C(C[C@H](O)c1ccc(OCc2ccccc2)cc1)NNC(=O)[C@H]1CCS(=O)(=O)C1	780860067	JSSMYVOJRRXRGR-HKUYNNGSSA-N	432.498	1.271	50	20	IDGD	
N#CCCn1cc(/C=C(/C#N)C(=O)NCCNC(=O)c2cc[nH]n2)c(-c2ccccc2)n1	781042710	OIQHQLKQGDSDPN-LGMDPLHJSA-N	428.456	1.640	50	20	IDGD	
COC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(NC(=O)NNC(=O)C3CCC3)cc2)C1	782549838	LEAVAUCZLJYAJR-AWEZNQCLSA-N	438.506	1.213	50	20	IDGD	
COCCOCc1cccc(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)c1	782885948	MRCTVBOPTYHNSG-UHFFFAOYSA-N	439.472	1.065	50	20	IDGD	
CCCCn1nc(C(=O)NN/C=C2\C(=O)NC(=O)c3ccccc32)c2ccccc2c1=O	783678230	FKNOHEQSAZSZQN-AQTBWJFISA-N	431.452	1.742	50	20	IDGD	
CC(C)(C)c1nnc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)s1	784210275	LKMGDFLKVWSLCX-UHFFFAOYSA-N	438.535	1.358	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)C(=O)Nc1ccc2c(c1)C(=O)CCC2	784212924	HVMZEUYROWMYPQ-UHFFFAOYSA-N	442.497	1.728	50	20	IDGD	
Cc1c(NNC(=O)C(=O)Nc2ccc(S(=O)(=O)N3CCCC3)cc2)cccc1[N+](=O)[O-]	784358320	SAFGQFLAWFIHOK-UHFFFAOYSA-N	447.473	1.770	50	20	IDGD	
O=C(COC(=O)[C@@H]1CCCN1c1ccccc1)NNC(=O)[C@@H]1COc2ccccc2O1	785123656	ASNBDPZTADZYNR-LPHOPBHVSA-N	425.441	1.186	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2cccc(CS(=O)(=O)C(C)C)c2)n1	785231846	HMMLWMHBJVSKBP-UHFFFAOYSA-N	448.549	1.728	50	20	IDGD	
Cc1ccc(-n2cc(NC(=O)C(=O)NNC(=O)COc3ccccc3F)cn2)c(C)c1	786413541	BOZOFJVTUMYDEX-UHFFFAOYSA-N	425.420	1.793	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(CCC(=O)NNc2ccc(-n3ccnc3)nn2)cc1	788177947	OLEMGAODXITIDG-UHFFFAOYSA-N	443.533	1.769	50	20	IDGD	
CS(=O)(=O)[C@H]1CCCC(=NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)C1	788435615	WCCNGLMHLXBOFR-IBGZPJMESA-N	440.997	1.917	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)N[C@H](COC)[C@H]2CCCO2)c2ccccc2c1=O	789333617	BWGUBWPINDTBHV-QZTJIDSGSA-N	445.520	1.725	50	20	IDGD	
Cc1c(Br)ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2O)c1F	789735131	SXRYHVFAJQQFQK-UHFFFAOYSA-N	440.225	1.767	50	20	IDGD	
C[C@]1(c2ccccc2)NC(=O)N(CC(=O)NNC(=O)c2cc(-c3ccccc3)on2)C1=O	789899690	LLXWGVGIAYDIJA-JOCHJYFZSA-N	433.424	1.570	50	20	IDGD	
COc1cc(CC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)ccc1C	789949894	GPPXPSUILWEMET-UHFFFAOYSA-N	431.514	1.792	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Cn2c(S)nc3ccccc3c2=O)cc(OC)c1OC	790082023	WOKLUHWUUOVUBV-UHFFFAOYSA-N	444.469	1.172	50	20	IDGD	
COc1cc(Cl)c(S(=O)(=O)NNC(=O)CCc2ccccc2O)cc1C(=O)O	790391075	RNFADYRFODVIPO-UHFFFAOYSA-N	428.850	1.695	50	20	IDGD	
COc1cc(Cl)c(S(=O)(=O)NNC(=O)c2cccc(OC)c2O)cc1C(=O)O	790391829	NBNVAKYJIJYFDC-UHFFFAOYSA-N	430.822	1.384	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCC(=O)NNc1cccc(F)c1[N+](=O)[O-]	790588840	PQFWTOJXLRPEMK-CYBMUJFWSA-N	425.417	1.693	50	20	IDGD	
CC(=O)N1CCCN(c2ccc(F)cc2NC(=O)C(=O)NNC(=O)c2ccc(C)o2)CC1	790951929	IYYDQHPAGSZXJU-UHFFFAOYSA-N	445.451	1.185	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNS(=O)(=O)c1ccc2oc(=O)ccc2c1	794599325	YAGMBOYNQQNHHH-UHFFFAOYSA-N	431.426	1.029	50	20	IDGD	
C=C(CBr)COC(=O)[C@@H]1C[C@H](O)CN1S(=O)(=O)c1ccc(Cl)cc1	795315930	SQMSDZYUPSYXSY-JSGCOSHPSA-N	438.727	1.958	50	20	IDGD	
CCn1ncc2ccc(NC(=O)C(=O)NNC(=O)CNC(=O)OCc3ccccc3)cc21	797369469	YSJZYLZQQYWAGG-UHFFFAOYSA-N	438.444	1.069	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccccc2-n2cc(Br)cn2)n1	797371530	XJORAVOHJSMEOI-UHFFFAOYSA-N	443.261	1.738	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)CC(F)(F)F)cc(Br)cc1[N+](=O)[O-]	797535908	QXYWPITXFJVFDO-UHFFFAOYSA-N	427.133	1.704	50	20	IDGD	
N#Cc1cccnc1-n1cc(NC(=O)NNC(=O)CNC(=O)OCc2ccccc2)cn1	797645323	MSARQGHJCGUGRD-UHFFFAOYSA-N	434.416	1.218	50	20	IDGD	
CN(CCNC(=O)NNC(=O)c1cc2c(s1)CCC2)S(=O)(=O)c1ccc(F)cc1	798098156	QEMYXQLMYVMVCX-UHFFFAOYSA-N	440.522	1.641	50	20	IDGD	
CC1=C(C(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)[C@H](C)n2ncnc2N1C	798966038	GZVPGCUDAOAVMJ-ZDUSSCGKSA-N	448.528	1.293	50	20	IDGD	
COc1ccc(S(N)(=O)=O)c(OC)c1C(=O)NNc1ccc(C#N)cc1C(F)(F)F	799754277	JOJZSHVPTJRIJL-UHFFFAOYSA-N	444.391	1.999	50	20	IDGD	
CNS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccc(C#N)cc2C(F)(F)F)cc1	799839771	ASGIFDVXJRHPBW-UHFFFAOYSA-N	441.391	1.567	50	20	IDGD	
COCC[C@@H]1CCCC1=NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1	799883369	ZISHCFJAZIVAPM-SFHVURJKSA-N	436.578	1.610	50	20	IDGD	
CNC(=O)CNC(=O)c1cccc(NC(=O)NNC(=O)c2cc3c(s2)CC[C@H](C)C3)c1	800594612	DJLMITXDBLFOGN-LBPRGKRZSA-N	443.529	1.815	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)N2CCN(c3ccc(F)cc3)CC2)cc1	801107160	NZYBIIWLRKLLJK-INIZCTEOSA-N	427.480	1.431	50	20	IDGD	
COc1ccc(C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)c(C)c1OC	806871941	CCXWDEOQTNGBDS-UHFFFAOYSA-N	449.533	1.100	50	20	IDGD	
COCc1cnc(NC(=O)C(=O)NNC(=O)c2cc(-c3cc(C)ccc3C)[nH]n2)s1	807020734	CWHWFYAYGWBGQB-UHFFFAOYSA-N	428.474	1.696	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)C(=O)Nc1cc(F)ccc1OCC(F)(F)F	807428698	ISWWBLHOROVHJW-UHFFFAOYSA-N	439.329	1.824	50	20	IDGD	
O=C(NCc1ccncc1OC[C@H]1CCOC1)NNC(=O)[C@@H]1COc2ccccc2O1	807615198	OUPOHQMHMRQGCR-LIRRHRJNSA-N	428.445	1.167	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ccc(OC)cc2OC)cc2[nH]ccc12	808935157	LBNPFHQVRQNQFI-UHFFFAOYSA-N	440.412	1.371	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)C(=O)Nc1ncc(C(F)(F)F)s1	812979596	XSACVSYUVORTIB-UHFFFAOYSA-N	440.363	1.453	50	20	IDGD	
CC(C)[C@H](O)C(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2Cl)c1	813363011	AOEHTMAGRPFYIM-INIZCTEOSA-N	425.894	1.919	50	20	IDGD	
CCN(CC)CCN1C(=O)C(=NNC(=O)Cc2cc[nH]n2)c2cc(Br)ccc21	814957364	OIZZUVUWXROAPP-UHFFFAOYSA-N	447.337	1.924	50	20	IDGD	
N#Cc1cc(NC(=O)C(=O)NNC(=O)CCOc2ccccc2)ccc1Br	815568286	BYFYRQNRDPGXJG-UHFFFAOYSA-N	431.246	1.876	50	20	IDGD	
Cc1ccc(-c2csc(NC(=O)C(=O)NNC(=O)[C@@H]3CCc4nncn4C3)n2)s1	815691511	SEQRJVYOFORCMT-SNVBAGLBSA-N	431.503	1.120	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(NC(=O)C(=O)NNc2cccc(Cl)n2)ccc1Cl	815727466	ZTBIRJQTKIULMV-UHFFFAOYSA-N	432.289	1.721	50	20	IDGD	
O=C(NNc1ncncc1F)c1cc(I)ccc1N1CCOCC1	817079336	BZMHTWXHTRKLMU-UHFFFAOYSA-N	443.220	1.814	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)CNC(=O)NCc2ccco2)c1	818750221	GUDKYLWLGMXFGX-UHFFFAOYSA-N	425.239	1.771	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)c2nnn(-c3cccc([N+](=O)[O-])c3)c2C)cc1	818898517	QXRSCPQJUVBZGE-UHFFFAOYSA-N	425.405	1.366	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	913471557	DQEQQGSVPAQHAC-UHFFFAOYSA-N	427.486	1.123	50	20	IDGD	
COCCN1C[C@H](C(=O)NNC(=O)COc2ccccc2Cc2ccccc2)CC1=O	914458915	RCMXBMAULXAREB-LJQANCHMSA-N	425.485	1.299	50	20	IDGD	
CC(C)CNS(=O)(=O)c1ccc(C(=O)OCC(=O)NNC(=O)c2ccccc2)cc1	914976087	RHKWNRULXKSXQM-UHFFFAOYSA-N	433.486	1.239	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)NC[C@H](c1cccs1)N1CCOCC1	915894010	UPAHEDIRWAUKFN-MRXNPFEDSA-N	448.545	1.930	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)N[C@@H](CN1CCOCC1)c1ccccc1	916216318	FDVKTGSFCXGZFU-SFHVURJKSA-N	436.472	1.353	50	20	IDGD	
CCCS(=O)(=O)N1CCC(NC(=O)NNC(=O)Cc2ccc3ccccc3c2)CC1	916379377	CXISCISZKWEJCX-UHFFFAOYSA-N	432.546	1.917	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)NCCCN2CCN(c3ccccc3)CC2)c1	916487369	BBUZTPBFHJSWPG-UHFFFAOYSA-N	441.532	1.860	50	20	IDGD	
COc1cc(C=NNC(=O)Cc2csc(N3CCOCC3)n2)cc(OC)c1OC(C)=O	917566133	ATTUCRHNXVVEPT-UHFFFAOYSA-N	448.501	1.615	50	20	IDGD	
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)NNC(=O)c1cc(OC)c(OC)c(OC)c1	917717985	QYOPQLGUNHNIOB-UHFFFAOYSA-N	441.418	1.253	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2CCN(c3ccc(Cl)cc3)C2=O)c1	919712799	QWKMYJZXZQCENX-INIZCTEOSA-N	435.889	1.558	50	20	IDGD	
COc1ccc(OC)c(CCNC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)c1	919789997	GGZQNUIOBZYAOS-UHFFFAOYSA-N	425.445	1.782	50	20	IDGD	
CC(C)NC(=O)C(=O)NNC(=O)CCCOc1ccc(I)cc1	919839206	BKONAJFRIAKQFB-UHFFFAOYSA-N	433.246	1.122	50	20	IDGD	
O=C(NNC(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N[C@H]1CCS(=O)(=O)C1	919886840	WMDMUUOMIWQGRJ-JTQLQIEISA-N	433.330	1.855	50	20	IDGD	
COCCCNC(=O)NNC(=O)/C(=C/c1cccs1)n1nnnc1-c1ccccc1	920862300	WXSLMKSRSLSVFX-SSZFMOIBSA-N	427.490	1.767	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)Nc1cccc(CN2CCC[C@H]2C(N)=O)c1	920932704	BCXWHAWMCQTGLC-LIRRHRJNSA-N	443.479	1.896	50	20	IDGD	
O=C(NCc1nc(Cc2ccccc2)no1)NNC(=O)c1nn(-c2ccccc2)cc1O	921121572	XRRIXCUFHSSKFR-UHFFFAOYSA-N	433.428	1.696	50	20	IDGD	
O=C(NNC(=O)c1cncn1-c1ccccc1)c1ccc(S(=O)(=O)N2CCCC2)o1	1115837271	CDMGRSXESCRJRN-UHFFFAOYSA-N	429.458	1.325	50	20	IDGD	
COc1ccc(C=NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)cc1OCC(N)=O	1116590051	CZOZZHTVCICLRZ-UHFFFAOYSA-N	449.508	1.498	50	20	IDGD	
COc1cc(CNC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc(Cl)c1OC	1123824247	UAHXZTVFBLUYKZ-UHFFFAOYSA-N	445.863	1.748	50	20	IDGD	
Cc1[nH]c(-c2ccncc2)nc(=O)c1CC(=O)NNC(=O)c1ccc(Br)cc1	1317902181	FCUBSNWMLFFPIH-UHFFFAOYSA-N	442.273	1.907	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(-n3cccn3)c(F)c2)cc1OC	1318324783	HGHIILDZYBPBCV-UHFFFAOYSA-N	442.403	1.647	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCCC[C@H]2c2nnc([C@H]3CCCO3)o2)n1	1346265115	UTVMNWRYPYITEI-UONOGXRCSA-N	434.522	1.603	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc3c(n2)OCCO3)C1	1777953661	DMYZYNYOUPUIQW-SOIKWTOOSA-N	437.924	1.998	50	20	IDGD	
O=C(c1ccc2ncoc2c1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1778010310	IUNFDLAQFQXDOS-RHSMWYFYSA-N	426.242	1.962	50	20	IDGD	
Cc1ccc(C)c(C(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1	1779034085	LXDQKDCAQWFBME-HSZRJFAPSA-N	437.500	1.059	50	20	IDGD	
C=C[C@@H](O)C(C)(C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CO[Si](C)(C)C)C2	1779336019	PFTQVAUMNCPNIT-CBGDNZLLSA-N	426.630	1.925	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCBr)C2)c1ccncc1O	1779616682	VTXLVZRKVGOFSN-CRAIPNDOSA-N	426.311	1.700	50	20	IDGD	
COc1ccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](O)CCl)C3)cc1OC	1780382048	CKKPMATZFFXKRK-RRMPHLOHSA-N	440.924	1.431	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H]1CN(Cc3ccccc3)CCO1)CCO2	1781218385	HAUIFWLJXFSXMW-MZKRTTBSSA-N	449.979	1.735	50	20	IDGD	
Cn1nc2c(c1C(=O)N1CCO[C@@]3(CCN(C(=O)[C@](C)(Cl)CCl)C3)C1)CCC2	1781233635	VRXMOJNJPCRCSM-MOPGFXCFSA-N	429.348	1.589	50	20	IDGD	
C[C@H](Oc1ccccn1)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@](C)(Cl)CCl)C2)C1	1781234611	XCXDNKADCGXZMD-JVPBZIDWSA-N	430.332	1.915	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4ccoc4c3)C2)C1	1782326915	QSKXLWFJGUCOIS-QHCPKHFHSA-N	449.467	1.189	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)Cc2cnn(C)c2)C1	1782590526	PCTHTYOAKSIKJI-JCKWVBRZSA-N	427.343	1.260	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)CN3CCSCC3)CCO2)C1	1783339540	SLNDANBGGFGQQS-RHSMWYFYSA-N	434.400	1.039	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cc4n(n3)CCCO4)CCO2)C1	1783349857	UIQDSVGHEVZKJR-FZKQIMNGSA-N	441.326	1.283	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cc4n(n3)CCCC4)CCO2)C1	1783534713	YDXIPHBROLAHBE-UGSOOPFHSA-N	425.327	1.446	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cc(F)ccc1Cl)CCO2	1783934368	FGZNDFQOLHZFKN-HXUWFJFHSA-N	440.903	1.296	50	20	IDGD	
CC(=O)N[C@@H](C(=O)N1CCO[C@@]2(CCN(C(=O)C(Cl)Cl)C2)C1)c1ccc(F)cc1	1783948161	CVMBCOVWGJCGOL-DNVCBOLYSA-N	446.306	1.637	50	20	IDGD	
COc1ccnc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]3C2)c1	1783970200	OATJCKPKKORCBW-HPZZRFSDSA-N	440.338	1.715	50	20	IDGD	
C[Si](C)(C)OCC(=O)Nc1ccc(C2(NC(=O)C[C@H]3NC(=O)NC3=O)CCC2)cc1	1789647830	YYWGUMJIDMYBFC-OAHLLOKOSA-N	432.553	1.570	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]3C2)nc1	1789868020	LGWDFSIZSFTFLS-HAHWVIBASA-N	430.332	1.920	50	20	IDGD	
CC(C)N1CCC[C@H]1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]2C1	1789927220	PVFYLKWKMKLBMA-QXKUPLGCSA-N	434.350	1.529	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)[C@H](O)CCl)CCC2)cc1)c1cc(=O)nc2cccnn12	1790031551	NANUYGMOEOOJHD-MRXNPFEDSA-N	441.875	1.437	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccn4ccnc4c3)C[C@@H]21	1791055687	DVLDYIGNMVECTC-OEAJRASXSA-N	435.322	1.711	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cccc(Cl)n3)C[C@@H]21	1791252071	BFGQGPRFIDWBOM-HNKHHVNMSA-N	430.332	1.511	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CC(=O)N(C4CCCC4)C3)C[C@@H]21)C(Cl)Cl	1791292856	TZJWNRAYGKBFQD-SDADXPQNSA-N	446.375	1.561	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3cc(C)on3)[C@H]2C1	1791539002	RSUJFUBAVLOAJQ-HNKHHVNMSA-N	428.327	1.679	50	20	IDGD	
COC[C@H](Cl)C(=O)NC1(c2ccc(NC(=O)Cn3cc(C)c(O)nc3=O)cc2)CCC1	1792225759	ACQMUSOXALHMGG-INIZCTEOSA-N	448.907	1.645	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(O)c(F)c1)C2	1792874111	LDZYSHAZLWYWML-VFFTVRQLSA-N	429.286	1.766	50	20	IDGD	
C#CCO[C@@H](C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1793562309	ONHCCCNACOKENG-KSWRQPAISA-N	441.956	1.795	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnsn1	1794695511	YSHQYVQYQQDCCK-CLLJXQQHSA-N	445.457	1.937	50	20	IDGD	
CC(C)(C)OC(=O)N1CCOC[C@H]1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](F)Cl)C2	1796776426	VPJTZKGFYKKJKJ-AIEDFZFUSA-N	433.908	1.795	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(C)nn1C)C2	1796890038	VYDANYLFFJFYBS-YDOXXCSQSA-N	425.493	1.114	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(-c3ccccn3)[nH]n1)C2	1797957585	OVFJRMYMNLFDBB-YVWYUNDQSA-N	443.580	1.526	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc(Cl)s1)C2)[C@H](F)Br	1799348638	NVQROGLVMMQQCY-MBLNEYKQSA-N	426.695	1.690	50	20	IDGD	
Cc1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)n(C(F)F)n1	1799405328	IQBWQWXMBCQQSL-CLLJXQQHSA-N	447.446	1.151	50	20	IDGD	
CC(C)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(O)c([N+](=O)[O-])c1	1799480656	MUIPENPHLLWYJM-YWVIFJGQSA-N	425.869	1.769	50	20	IDGD	
COc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Br)C3)c(F)c1	1799520972	KDFKIAWUVBPLNJ-ANGCBRKESA-N	433.249	1.728	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1n[nH]c2cccc(F)c12	1800079470	ALPANDXVSGSISR-NWIKQPOISA-N	443.248	1.596	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccn2c(C)cc(C)nc12	1800138337	PUHHYOZPHYXAJB-CYGHRXIMSA-N	434.924	1.408	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1Cc2ccccc2N1	1800317752	DVNAQSLGAFVDNE-CRCOGDFISA-N	436.350	1.786	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(Cl)cnc1OC)C2	1800974240	RUMHAYAJSNDASB-JLUCKKNBSA-N	432.304	1.201	50	20	IDGD	
Cc1ncc(/C=C/C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Br)C3)s1	1801490377	XJWBDALVHZJPQA-ZTJYCSGJSA-N	432.315	1.745	50	20	IDGD	
CC[C@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](C)N1CCN(C)CC1)C2	1801804164	UFNVGJAGZRXTPO-KSWRQPAISA-N	429.403	1.434	50	20	IDGD	
COC[C@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](O)CCNC(=O)OC(C)(C)C)C2	1802282527	FPKVRUVNSQCAAF-XFIYOXNOSA-N	447.960	1.154	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1CN(C)C1	1803312352	OXERGEJXQSEICA-MUJYYYPQSA-N	430.461	1.334	50	20	IDGD	
CCS(=O)(=O)N[C@H](C)C(=O)N1CCCC2(CCN(C(=O)CO[Si](C)(C)C)CC2)C1	1805956151	DDBIWJHQHWHDRW-MRXNPFEDSA-N	447.674	1.397	50	20	IDGD	
C[C@H](Nc1cccnc1)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1	1807149627	AJNRVVFONPWHJJ-CBVHJVASSA-N	431.924	1.583	50	20	IDGD	
Cc1cncc(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)c1	1807369304	FNEVNSZVNAHYAR-SIKLNZKXSA-N	444.300	1.098	50	20	IDGD	
Cc1occc1C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1807369720	SPMDKWVFNAPJNU-RXVVDRJESA-N	433.273	1.296	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CCn2cncn2)[C@H]1c1cccnc1)[C@H](F)Br	1808681825	VYKBGEHRLGLUAT-BPUTZDHNSA-N	439.289	1.460	50	20	IDGD	
Cc1ccncc1C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1808785520	WGAOHSSELMAPOM-KNQAVFIVSA-N	444.300	1.098	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC2(CCCN(C(=O)CCNC(C)C)C2)CC1	1809933803	LZPISCJEWBZTMM-NLRVBDNBSA-N	444.580	1.740	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2cc(OC)n(C)n2)[C@@H]1c1cccnc1	1811636775	ZSKULOXGCBQARC-VKJFTORMSA-N	435.912	1.397	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)C2=NNC(=O)C2)[C@@H]1c1cccnc1	1812776631	TYPYVJOFKFSCCO-HEHGZKQESA-N	436.310	1.137	50	20	IDGD	
O=C(Cc1ccc2c(c1)CCO2)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1	1812824108	JPAPHUWWTFKKCW-JQVVWYNYSA-N	443.931	1.865	50	20	IDGD	
CCC[C@H](NC(C)=O)C(=O)N1CC[C@H](CNC(=O)[C@H](Cl)COC)[C@@H]1c1cccnc1	1813037362	FSFLTTZXUFUNEI-YRXWBPOGSA-N	438.956	1.646	50	20	IDGD	
CNC(=S)NCCC(=O)N1CC[C@@H](CNC(=O)C(Cl)Cl)[C@@H]1c1cccnc1	1813078081	NJPAALOOGRROEX-JSGCOSHPSA-N	432.377	1.375	50	20	IDGD	
COC(=O)NCC(=O)NC[C@@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1	1813264297	CIQXURBOXFJVCM-XJKSGUPXSA-N	427.299	1.228	50	20	IDGD	
N#Cc1ccccc1OCC(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](O)CCl)n[nH]1	1814875506	BCCLKJCVFWGFOS-HOTGVXAUSA-N	431.880	1.952	50	20	IDGD	
O=C(/C=C/c1ccco1)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1	1815337713	WFFAVJNNBQZAIH-TUPIDYKKSA-N	437.286	1.355	50	20	IDGD	
CCc1cc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)CCC(=O)NN(C)C)CC3)n[nH]1	1815903930	QZVIYLFFESGKBD-GFCCVEGCSA-N	433.538	1.027	50	20	IDGD	
CC[S@](=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](C)Br)CC2	1819519668	KRLYTSCLIQWFEZ-MZEXLTETSA-N	436.397	1.997	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2c[nH]c(=O)cn2)[nH]n1)[C@H](F)Br	1820935867	WBNLWEJELCEIAD-GWCFXTLKSA-N	427.234	1.489	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H]2CNC(=O)C2)n[nH]1	1821962357	ROEMZLNWKHBUSE-MDZLAQPJSA-N	426.315	1.711	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H]2CCC(=O)N2)[nH]n1	1822088618	WVQILIYRYDNZCB-LOWVWBTDSA-N	426.315	1.854	50	20	IDGD	
O=C(N[C@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1)c1cc(O)nc(O)n1	1823004655	RYNLQRBNROBHJY-XUOSJQGZSA-N	446.258	1.261	50	20	IDGD	
C[C@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1)n1ccnc1	1824312924	NURFUAREZGAEGL-UTKZUKDTSA-N	438.337	1.057	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(=O)ccn1C)CC2	1825645849	JTRQHKQEAHROBD-VHSXEESVSA-N	439.335	1.851	50	20	IDGD	
O=C(C#Cc1ccccc1)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827054484	BLTZMHXTZCSLLY-DEOSSOPVSA-N	444.340	1.651	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H](F)Br)CC1	1827566450	GGQFYZIJNJCHSJ-MJBXVCDLSA-N	435.338	1.744	50	20	IDGD	
Cc1cnoc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1	1828924551	YQVSJYRADGGNHW-SFHVURJKSA-N	440.504	1.529	50	20	IDGD	
C[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1)c1ccc(Cl)cc1	1830259682	XWMQJNJTIQWFFG-VHFSOBRXSA-N	445.343	1.500	50	20	IDGD	
CC(C)N[C@@H](C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2)C(C)C	1830358000	OCCRRYFNHBEXLK-UTKZUKDTSA-N	432.005	1.730	50	20	IDGD	
Cn1ncc2c(C(=O)N3CCOC[C@]4(C3)CN(C(=O)C(C)(C)CCl)CCO4)cccc21	1830361830	FTBXBAOBAXIVGI-QFIPXVFZSA-N	448.951	1.908	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(F)cn3C)C2)C1	1830538593	KNQRQFSWEDEUCS-SCLBCKFNSA-N	446.317	1.265	50	20	IDGD	
CC(C)Cc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)cc1	1830733708	RIMNHDKAFTVEJK-UGKGYDQZSA-N	438.952	1.555	50	20	IDGD	
COc1ccccc1CCC(=O)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1830996353	GVKLWYXYNJPJJJ-FQEVSTJZSA-N	445.343	1.888	50	20	IDGD	
COc1ccc(C(=O)N2CCC(N3CCC(NC(=O)[C@H](O)CCl)CC3)CC2)c(C)c1	1833313273	CUXNIIRPFFLHQK-HXUWFJFHSA-N	437.968	1.789	50	20	IDGD	
COc1cnc(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)c(F)c1	1834006031	NJBKXBKEEWZJMR-KRWDZBQOSA-N	442.919	1.014	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnc(OC)c(C)c3)CCO2)C1	1834574407	DEEVVKVILJNSFD-DYESRHJHSA-N	439.940	1.876	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)[C@H]1Cc2ccccc2O1	1835474695	IBOYVVBPYKYGLV-AZUAARDMSA-N	435.952	1.161	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3ccc[nH]3)CCO2)C1	1836018099	VENSNQLTRWTSDC-VQIMIIECSA-N	442.354	1.577	50	20	IDGD	
O=C(c1c[nH]c2cnccc12)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836717349	UOZLBMOFPIVOML-IBGZPJMESA-N	434.924	1.775	50	20	IDGD	
COCc1oncc1C(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836717566	FRZGIOUOMLQMEB-INIZCTEOSA-N	429.901	1.033	50	20	IDGD	
CC(C)=NO[C@@H](C)C(=O)N1CCOC[C@@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1837714469	HOGGEARNIKNFAH-QFBILLFUSA-N	429.590	1.095	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccnc(NC(C)=O)c3)C2)C1	1839145009	QLKOOLNJEAWKCP-OXJNMPFZSA-N	438.912	1.127	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cc(F)ccc3OC)C2)C1	1839148764	JAJRWIRKXMMLAM-UWJYYQICSA-N	442.915	1.851	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3coc(Cl)n3)C2)C1	1839151548	WAEFDVZONJSBGP-CVEARBPZSA-N	440.711	1.634	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc(Cl)s3)C2)C1	1840153040	BGPOMQLXBXAVOG-ZBEGNZNMSA-N	438.333	1.120	50	20	IDGD	
O=C(CC12CCCN1CCC2)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840189435	QKNDOFBAAZELMS-IBGZPJMESA-N	434.364	1.265	50	20	IDGD	
O=C(NC1(C(=O)N2CC3(CCCN3C(=O)[C@H](O)CCl)C2)CC1)OCc1ccccc1	1841350974	COUKUURTZGGLTJ-MRXNPFEDSA-N	435.908	1.249	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@](C)(C(=O)N2CC3(CCCN3C(=O)[C@H](O)CCl)C2)C1	1841351296	KRQZGXJKBWWBFE-AUUYWEPGSA-N	429.945	1.437	50	20	IDGD	
CN(CC(=O)N1CC2(CCCN2C(=O)c2ccns2)C1)NC(=O)NCc1ccccc1	1842322996	SYRLTVPAVJXPLE-UHFFFAOYSA-N	442.545	1.306	50	20	IDGD	
O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)CCBr)C1	1842639459	RBJHFNSBZCXEGS-HWKANZROSA-N	425.279	1.805	50	20	IDGD	
O=C([C@@H](F)Br)N1CC2(CCCN2C(=O)CCS(=O)(=O)c2ccccc2)C1	1842744731	UCWFYISEQVQDQC-OAHLLOKOSA-N	447.326	1.744	50	20	IDGD	
O=C(c1ccc(OCC2CC2)cc1)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843015373	IKBYNPUWEVJINZ-UHFFFAOYSA-N	434.301	1.286	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)c2cc3ccc(Cl)cc3nn2)C1	1843294411	LETBMWNWNYBBJA-UHFFFAOYSA-N	444.923	1.473	50	20	IDGD	
CC(C)(C)OC(=O)N(CC(=O)N1CCCC12CN(C(=O)[C@@H](O)CCl)C2)C1CCCC1	1843319905	BYHFUKVZHUBZLA-INIZCTEOSA-N	443.972	1.969	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)[C@@H](C)CBr)C2	1843415201	XITAFBFZUQIVNM-QVEXMKBASA-N	438.326	1.355	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)c1cnoc1C)C2	1844692173	PNYQEMHKMXYBNF-UHFFFAOYSA-N	428.401	1.947	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)c1n[nH]cc1I)C2	1845165986	UJUOROMDEZCFCV-VIFPVBQESA-N	436.681	1.849	50	20	IDGD	
CC(=O)N[C@@H](C)C(=O)N1CC2(CCCN2C(=O)[C@@H](Br)Cc2ccccc2)C1	1845942423	FKKCMAIYSRMUTM-YOEHRIQHSA-N	436.350	1.721	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)c1ccc([N+](=O)[O-])c3c1OCO3)C2	1846363582	QTQMHDXZLWUTNT-LBPRGKRZSA-N	425.825	1.394	50	20	IDGD	
CCN1CCN(c2ccc(C(=O)N3CCCC34CN(C(=O)[C@H](O)CCl)C4)cc2)CC1	1846898389	DBNQUZRKAQDTFB-LJQANCHMSA-N	434.968	1.245	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(F)(C(=O)N2CCCC23CN(C(=O)CCBr)C3)C1	1847127968	ASUHOLTYKYVOQJ-UHFFFAOYSA-N	448.333	1.934	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@H](F)C[C@H]1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl	1847568163	CNESKWNUTDGBCZ-YTFOTSKYSA-N	433.908	1.135	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)CCC(=O)c2ccc3c(c2)OCCO3)cc1	11138429	BOWXSPPELXRKBO-UHFFFAOYSA-N	426.425	1.734	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)c2cccc(N3CCCS3(=O)=O)c2)cc1	12887243	KAFLYEGTJVHDER-UHFFFAOYSA-N	431.470	1.153	50	20	IDGD	
CCOc1ccccc1OCCCC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	14382818	XHALCMZAIXMEOY-UHFFFAOYSA-N	449.529	1.956	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)Cn2cnc3sc(-c4ccccc4)cc3c2=O)n1	15758343	MOUMGKYRLDKHAM-UHFFFAOYSA-N	436.497	1.786	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CCN2C(=O)[C@@H](C)Oc3ccccc32)cc(OC)c1OC	16230038	XTOBAQVPBJRLTD-CYBMUJFWSA-N	443.456	1.678	50	20	IDGD	
C=CCn1c(S)nc2cc(C(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)ccc2c1=O	17329975	ZMCPBPKFHFXPKS-UHFFFAOYSA-N	425.426	1.854	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)N/N=C1/C(=O)Nc2cc3c(cc21)OCCCO3	17418101	YULODROHKNOIQD-UHFFFAOYSA-N	443.485	1.536	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C2CCN(S(=O)(=O)CC)CC2)cc1OC	20935605	UONKWVNOMHQFRX-UHFFFAOYSA-N	427.523	1.307	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=O)c2ccc3ccccc3n2)n(C)c1	21767953	OTASWEAIIALVBQ-UHFFFAOYSA-N	429.502	1.679	50	20	IDGD	
CC(=O)N1c2ccc(S(=O)(=O)NNC(=O)c3c(C)nc4ccccn34)cc2C[C@@H]1C	28679076	XHHHNASVIRWEPZ-LBPRGKRZSA-N	427.486	1.564	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2ccccc2NC(=O)NC(C)C)n1	57564208	NSIKNHKBMQQJMQ-UHFFFAOYSA-N	433.490	1.528	50	20	IDGD	
O=C(NNC(=O)[C@@H]1C[C@H]1c1ccc(Br)cc1)c1ccc(-n2cnnn2)cc1	109764435	SQXBOVWXCMISFV-JKSUJKDBSA-N	427.262	1.990	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)[C@H](c1ccccc1)N1CCC(O)CC1	727765298	SLUNQOIDOGSCCB-QFIPXVFZSA-N	427.501	1.810	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)NCCCN2CCC[C@H](C(N)=O)C2)c(C)n1C[C@H]1CCCO1	728078311	YLDSSROZYKJBPW-HQEIXYNQSA-N	441.576	1.895	50	20	IDGD	
CC(C)(C)c1ccc(N)c(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1	728334394	GZPIVHCZLURKCG-GOSISDBHSA-N	427.457	1.711	50	20	IDGD	
CC(=O)NCCc1ccc(S(=O)(=O)NNC(=O)c2cccc(OC(F)F)c2)s1	728510685	QORNNRZNFFDTKT-UHFFFAOYSA-N	433.458	1.651	50	20	IDGD	
Cc1ccc2c(c1)C(=O)N(CC(=O)NNC(=O)c1cc(F)ccc1Br)C2=O	728550963	QYVCYWAZMXMOSR-UHFFFAOYSA-N	434.221	1.954	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2ccc(-c3ccccc3)nc2O)n1	728728488	UEDSLSMLEIXYQV-UHFFFAOYSA-N	426.454	1.766	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1nn(-c2ccccc2)c2c1CCC2	728847701	LNMREDOZSPFPHF-UHFFFAOYSA-N	431.500	1.829	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1cc([N+](=O)[O-])ccc1N1CCCC1	728889316	BZFGMEGJCOANCQ-UHFFFAOYSA-N	439.476	1.663	50	20	IDGD	
CNS(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=S)Nc2ccc(N(C)C)cc2)c1	729689452	LGHYEJGRDAONPV-UHFFFAOYSA-N	441.966	1.946	50	20	IDGD	
O=C(COC(=O)Cc1ccccc1Br)NNC(=O)[C@H]1COc2ccccc2O1	729731366	URPSYJWGIWJHBM-MRXNPFEDSA-N	449.257	1.522	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)NC1CCN(C(=O)c2ccccc2F)CC1	730906472	ZKKUKZLSNJPLCG-UHFFFAOYSA-N	430.436	1.545	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)c2sccc2S(=O)(=O)C(F)F)c2ccccc2c1=O	730998095	JPUDTPIQPAVCSF-UHFFFAOYSA-N	442.425	1.066	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCCOC[C@@H]1CCOC1	731680445	LSCTUDDVMCXAES-CHWSQXEVSA-N	430.299	1.600	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCOCC2)cc1)c1ccccc1	731998199	ZQRJPMILKVRSEU-LJQANCHMSA-N	431.514	1.662	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)N[C@@H]2CCN(c3ccccc3C(N)=O)C2)c1	732595078	LUKZBWSCTBFEJA-MRXNPFEDSA-N	425.489	1.390	50	20	IDGD	
CCOC(=O)/C(C#N)=C\NCC1CCN(S(=O)(=O)c2ccc(OC)c(OC)c2)CC1	732951145	MHWHUENOZZHPIY-PEZBUJJGSA-N	437.518	1.665	50	20	IDGD	
Cc1cc(OC(F)F)c(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)s1	734058809	YUOIKYWESDJXMY-ZDUSSCGKSA-N	442.396	1.802	50	20	IDGD	
CN1C(=O)CC[C@H](C(=O)NNC(=O)C(=O)NC2CC2)[C@H]1c1ccc(C(F)(F)F)cc1	734418338	KJJHWJPVDJOERI-DZGCQCFKSA-N	426.395	1.041	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)CNC(=O)Nc2ccccc2)CC1	734824566	DDEHYSATVSCHLE-UHFFFAOYSA-N	434.497	1.538	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@H]2CCc3ccccc3C2)c1	735383940	FMGCVJHGBSLNSX-HNNXBMFYSA-N	430.530	1.686	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)[C@@H](Cc2ccccc2)n2nnnc2C)cc1	735630506	ILXWNUZJTFKPNZ-MGPUTAFESA-N	438.488	1.779	50	20	IDGD	
C[C@H]1Cc2cc(S(=O)(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)cc(Cl)c2O1	736064562	VEEFBLXEXGUULW-JTQLQIEISA-N	444.918	1.690	50	20	IDGD	
CC[C@@H](C)[C@H](NC(=O)N1CCCC1)C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C	736091073	BMFWYDFNEHTULG-KGLIPLIRSA-N	428.534	1.062	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CN2CCN(C(=O)[C@@H](C)Oc3cccc(C)c3)CC2)cc1	736621682	JSZMKDNATUILLE-LJQANCHMSA-N	438.528	1.676	50	20	IDGD	
O=C(CC[S@@](=O)c1ccc2c(c1)OCCO2)NNC(=O)c1cc(-c2ccccc2)[nH]n1	740749900	VCZICCQNCJXVKO-WJOKGBTCSA-N	440.481	1.807	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)[C@@H]1CCCN(C(=O)COc2ccccc2)C1	741207427	MPUXXPSNQQPYEV-MRXNPFEDSA-N	429.448	1.670	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])c2ccccc2c1=O	742473527	CGRHYYWRJCVZGW-UHFFFAOYSA-N	435.318	1.935	50	20	IDGD	
COc1ccccc1-n1cc(S(=O)(=O)NNC(=O)[C@H]2COc3ccccc3O2)cn1	743252235	RPVMZPQFSYJSEK-GOSISDBHSA-N	430.442	1.030	50	20	IDGD	
COC(=O)c1ccc(S(=O)(=O)NNC(=O)c2ccccc2OC)c(Br)c1	743258918	OCNVHQFWONMPQL-UHFFFAOYSA-N	443.275	1.868	50	20	IDGD	
Cc1ccc(OC[C@H](C)NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1	743352652	WQSRECILEGRLST-HNNXBMFYSA-N	434.518	1.657	50	20	IDGD	
CC(C)[C@H](NC(=O)c1cccs1)C(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	743831421	WPSSPYAQMMJUSC-HNNXBMFYSA-N	438.531	1.759	50	20	IDGD	
O=C(NNC(=O)C1CCN(S(=O)(=O)c2cc(F)ccc2F)CC1)NC1CCCC1	744059467	KPRULYMBIKMAPX-UHFFFAOYSA-N	430.477	1.639	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)c2cccc(NC(=O)[C@H]3CCCO3)c2)cc1	744550063	XBOUYFYAJCKVNJ-GOSISDBHSA-N	436.424	1.294	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)CCNS(=O)(=O)c2cc(C)ccc2C)c1	744565055	IYSDVCMMGGNYGX-UHFFFAOYSA-N	447.513	1.285	50	20	IDGD	
CC(C)(C)OC(=O)NC(C)(C)C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	744620923	ILTKEYODNIAPIY-UHFFFAOYSA-N	442.538	1.454	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCCN2c3ccccc3C[C@@H]2C)nc1	744885834	ITLXCAKSWMBMCC-HNNXBMFYSA-N	432.550	1.846	50	20	IDGD	
CS(=O)(=O)c1cccc(Oc2ncccc2CNC(=O)NNC(=O)c2ccc[nH]2)c1	745837217	BOFAXCBJTMCCEL-UHFFFAOYSA-N	429.458	1.750	50	20	IDGD	
C[C@H]1CCCN(S(=O)(=O)c2cc(C(=O)NNC(=O)N3CCOCC3)ccc2Cl)C1	745991759	GKXXVNZXOOUDQL-ZDUSSCGKSA-N	444.941	1.447	50	20	IDGD	
Cc1c(C(=O)NNC(=O)Cc2ccccc2F)cc(Br)cc1S(N)(=O)=O	747386446	OGNQTYRUGSTYRP-UHFFFAOYSA-N	444.282	1.548	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNS(=O)(=O)c1ccc2c(c1)CCCN2C(C)=O	747846344	LTBJJMKRAQHNKV-UHFFFAOYSA-N	447.513	1.773	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1)c1nncn1C	747979001	AMODHWJTXUBCLS-OXQOHEQNSA-N	433.516	1.834	50	20	IDGD	
CCN(CC)C(=O)CNC(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1	747984068	NKMTWBBYZZLROL-OAQYLSRUSA-N	437.544	1.812	50	20	IDGD	
CN(C1CCCCC1)S(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)N2CCCC2)c1	748247084	UDGYBVFRWQJJIX-UHFFFAOYSA-N	436.534	1.023	50	20	IDGD	
CCNC(=O)NC1(C(=O)NNc2ccccc2S(=O)(=O)NC(C)(C)C)CCCC1	748603275	VSJOJBRMNYEAHE-UHFFFAOYSA-N	425.555	1.838	50	20	IDGD	
O=C(CN1C(=O)NC2(CCCCC2)C1=O)NNc1nc(Br)cn2ccnc12	750243282	FOQVTEVLRLVERV-UHFFFAOYSA-N	436.270	1.190	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCn2cncc2C1)c1cccc(S(=O)(=O)N2CCCCC2)c1	750827933	FSLGOIVIQZZJAI-INIZCTEOSA-N	431.518	1.081	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2cnn([C@H]3CCOC3)c2)cc1Br	751547683	LWVUGBIYGKWGIC-NSHDSACASA-N	445.295	1.239	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCc2ccc([S@](C)=O)cc2)nc1	753049591	HNNBDVBWTBLTSD-NDEPHWFRSA-N	439.563	1.676	50	20	IDGD	
O=C(NNC(=O)N1CCCN(S(=O)(=O)c2cccc3cnccc23)CC1)C1CCCC1	753355576	LSWCJPYVZIJDDA-UHFFFAOYSA-N	445.545	1.862	50	20	IDGD	
COc1cc(OC)cc(OCCCNC(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)c1	753946797	LRMRAVMEUJHPSD-UHFFFAOYSA-N	434.405	1.731	50	20	IDGD	
COC[C@H](C)CC(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccc(OC)cc2)c1	755036455	DTMYAAWCHBUAKY-CQSZACIVSA-N	435.502	1.930	50	20	IDGD	
COC(=O)CSCc1cccc(NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c1	756398815	YZVBWUXKNSCGAA-UHFFFAOYSA-N	441.473	1.535	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1ccnc(Oc2ccccc2Cl)c1	756741895	YQABZIIZEAFPSU-JTQLQIEISA-N	427.870	1.618	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2cccc(N3CCCNC3=O)c2)c1	756793518	ZEQYAEAHLWUMNA-UHFFFAOYSA-N	431.474	1.476	50	20	IDGD	
CCCCN1C(=O)C[C@@H](C(=O)NNc2ccc(C(N)=O)nn2)[C@H]1c1ccc(OC)cc1	757399206	MYCRRIXLSUAYGV-DNVCBOLYSA-N	426.477	1.417	50	20	IDGD	
NC(=O)c1ccc(NNC(=O)[C@H]2CC(=O)N(c3ccc4c(c3)Cc3ccccc3-4)C2)nn1	757403255	ZKTGNIYRMWSIGP-HNNXBMFYSA-N	428.452	1.643	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)Nc1ccc(F)c(S(=O)(=O)NC2CC2)c1	757871794	MOUKZAZKZNOMMD-UHFFFAOYSA-N	436.465	1.670	50	20	IDGD	
C#CCNC(=S)NNC(=O)c1ccc(NS(=O)(=O)c2ccc(OCC)cc2)cc1	758170955	FYOAALXLBBPULH-UHFFFAOYSA-N	432.527	1.628	50	20	IDGD	
O=C(NCCOc1cccc(C(F)(F)F)n1)NNC(=O)c1ccc(-n2cnnn2)cc1	758651313	NZDGJHOBPVKCHV-UHFFFAOYSA-N	436.354	1.099	50	20	IDGD	
COc1cc(OC)cc(N2CCCN(CC(=O)NNC(=O)c3cccc(C#N)c3)CC2)c1	758744901	SPTDCIXYLILTPR-UHFFFAOYSA-N	437.500	1.549	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2ccnn2-c2nc(C)cc(C)n2)c1	760278124	AMSXBBBWHSBQSR-UHFFFAOYSA-N	437.460	1.061	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)CCc2ccc(S(=O)(=O)NC3CC3)cc2)n1	762909853	WAJAPKVLMPAIOB-UHFFFAOYSA-N	432.550	1.839	50	20	IDGD	
CS(=O)(=O)c1c(Cl)cccc1NC(=O)C(=O)NNC(=O)c1ccc2ccccc2n1	763465861	DFQNODWZJRWYRI-UHFFFAOYSA-N	446.872	1.691	50	20	IDGD	
N#Cc1cccc(-c2csc(NC(=O)C(=O)NNC(=O)c3ccc4c(c3)OCO4)n2)c1	763548063	HMZYUPZILXDSJM-UHFFFAOYSA-N	435.421	1.810	50	20	IDGD	
C[C@@H]1CN(C(=O)c2ccc(NC(=O)C(=O)NNC(=O)c3ccccc3F)cc2)C[C@@H](C)O1	763560977	GWWJGXJSDRRGBB-ZIAGYGMSSA-N	442.447	1.475	50	20	IDGD	
COC(=O)c1cc(C(C)C)ccc1NC(=O)C(=O)NNC(=O)[C@@H]1COc2ccccc2O1	763571726	OBBMJZVQOGRBOA-SFHVURJKSA-N	441.440	1.523	50	20	IDGD	
COCCn1ncc2ccc(NC(=O)C(=O)NNC(=O)c3c(C)nc4ccccn34)cc21	763627633	CGJPRCGNOOAHIF-UHFFFAOYSA-N	435.444	1.039	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(-c3nccc(C)n3)c2)cc1	763661243	LOMRSRCTEMEDDV-UHFFFAOYSA-N	435.440	1.626	50	20	IDGD	
O=C(COc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1cccc(C(=O)NC2CC2)c1	763694365	GABHTTYNYWKXBC-UHFFFAOYSA-N	430.848	1.397	50	20	IDGD	
COCCOc1ccc(C#N)cc1NC(=O)C(=O)NNC(=O)Cc1c[nH]c2ccccc12	763865776	WBQQAUJJBIYNMX-UHFFFAOYSA-N	435.440	1.393	50	20	IDGD	
Cc1nnc(-c2cccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc3ccc(F)cc3)c2)n1C	763872082	KBHSIRGJFCYHRZ-GFCCVEGCSA-N	440.435	1.483	50	20	IDGD	
CN1CCN(c2ccc(NC(=O)C(=O)NNC(=O)Cc3ccsc3)cc2Cl)CC1	764033765	OBQXFHPOPVEHQW-UHFFFAOYSA-N	435.937	1.482	50	20	IDGD	
COC(=O)CCc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(Br)c2)cc1	764063563	RUGGJWAICZENBP-UHFFFAOYSA-N	448.273	1.954	50	20	IDGD	
CC[C@H](C)C(=O)NNC(=O)C(=O)Nc1cc(S(=O)(=O)N(CC)CC)cc(C)c1C	764084160	LXTRBSAQRDTBLT-LBPRGKRZSA-N	426.539	1.466	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)cnc1Br	764125365	VNPXNCYXCGLZMF-UHFFFAOYSA-N	427.642	1.911	50	20	IDGD	
COC(=O)c1cc(Cl)cc(NC(=O)C(=O)NNC(=O)CCc2ccc(OC)cc2)c1	764127379	SOZZYTDZDOBADL-UHFFFAOYSA-N	433.848	1.854	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CCC2CCCCC2)c(OCC(=O)N(C)C)c1	764218686	UTWRLEBALRAWNW-UHFFFAOYSA-N	432.521	1.908	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)C(=O)Nc1cc2c(cc1Cl)OCCO2	764243791	ZPXRAGQLEWPPCZ-UHFFFAOYSA-N	428.832	1.852	50	20	IDGD	
Cc1cc(C(=O)NC2CCCC2)ccc1NC(=O)C(=O)NNC(=O)c1scnc1C	764245264	BVUUTWCGMWDLII-UHFFFAOYSA-N	429.502	1.832	50	20	IDGD	
CC(C)CNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)Cc2ccccn2)cc1Cl	764263169	AJEPQMPTHOYZOB-UHFFFAOYSA-N	431.880	1.449	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)Cc2cccnc2)cccc1C(=O)Nc1ccccc1	764268176	YPMOSXCCZAFKCU-UHFFFAOYSA-N	431.452	1.971	50	20	IDGD	
COc1ccc(OC(F)F)c(NC(=O)C(=O)NNC(=O)COc2ccccc2O)c1	764278518	ZKQDAQDJCSWGJN-UHFFFAOYSA-N	425.344	1.167	50	20	IDGD	
CCOC(=O)Cn1ccc2cc(NC(=O)C(=O)NNC(=O)Cc3ccccc3F)ccc21	764319994	VTRCBGWMTSXMPT-UHFFFAOYSA-N	440.431	1.672	50	20	IDGD	
CCCc1cc(NC(=O)C(=O)NNC(=O)c2ccc(OC)c(Br)c2)n(C)n1	764326441	ILWXYVTUKQACDU-UHFFFAOYSA-N	438.282	1.543	50	20	IDGD	
O=C(CCCc1cccs1)NNC(=O)C(=O)Nc1ccc(NC(=O)[C@@H]2CCCO2)cc1	764334306	CLMPZWJUTDZYAG-KRWDZBQOSA-N	444.513	1.974	50	20	IDGD	
COC(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(C)c(C)c3)[nH]n2)cc1	764387809	MLJFPEUFPMRWLU-UHFFFAOYSA-N	449.467	1.809	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1c(C)c(C(C)(C)C)nn1-c1ccccc1	764398250	QMTSBNSVSZEULI-OAHLLOKOSA-N	445.520	1.616	50	20	IDGD	
Cc1cccc(Cn2nccc2NC(=O)C(=O)NNC(=O)CSc2ccccc2O)c1	764403794	BIZHKKKQVMJCAO-UHFFFAOYSA-N	439.497	1.824	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)NCc2noc(C3CC3)n2)c2ccccc2c1=O	764467891	SHIQKIFSRDBTLP-UHFFFAOYSA-N	439.476	1.991	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2ccc(=O)n(-c3ccccc3F)n2)cc(OC)c1OC	765518562	DDZKMQIKTYFGNT-UHFFFAOYSA-N	442.403	1.472	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1csc(-c2ccoc2)n1	765734905	FGGJNGHDCGMOPE-UHFFFAOYSA-N	439.497	1.622	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)CSCc3ccccn3)CC2)cc1	766642990	SMFRVGZZDWYOAC-UHFFFAOYSA-N	427.574	1.588	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)C(=O)c1ccc(Cl)cc1	766655518	WTRZADJCGILUCW-UHFFFAOYSA-N	428.876	1.128	50	20	IDGD	
COc1cccc(CC(=O)N2CCN(CC(=O)NNC(=O)Cc3ccccc3C)CC2)c1	766859986	CDXQQEHBVSRPQV-UHFFFAOYSA-N	438.528	1.080	50	20	IDGD	
O=C(NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)N[C@@H]1CCCc2c[nH]nc21	767227118	PLDUBQJHZIKHAO-MRXNPFEDSA-N	432.506	1.216	50	20	IDGD	
COc1ccc2c(c1)OC[C@H](NC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)C2	768111889	LKTFKEJWDCTXJC-CQSZACIVSA-N	434.474	1.438	50	20	IDGD	
CS(=O)(=O)c1nc(C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)c2ccccn12	768262004	CXLMYZCXUGWSKJ-UHFFFAOYSA-N	430.471	1.264	50	20	IDGD	
COc1ccc(Br)c(CC(=O)NNC(=O)CCN2C[C@H](C)O[C@H](C)C2)c1	768930048	OFZHULRRCPCOCG-BETUJISGSA-N	428.327	1.647	50	20	IDGD	
O=C(NNC(=O)[C@H]1CC(=O)N(c2ccccc2Cl)C1)c1ccc(-n2cnnn2)cc1	769596671	HJWFHALFSGMLIO-ZDUSSCGKSA-N	425.836	1.130	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2ccc(S(N)(=O)=O)cc2F)c(C)n1-c1ccccc1	769738925	PZKRDMCRPGAZNJ-UHFFFAOYSA-N	430.461	1.955	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)c3ccc(-n4cnnn4)cc3Cl)nc21	770965885	OGPJFBDZWXGLBE-UHFFFAOYSA-N	428.844	1.673	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)c1cc(S(=O)(=O)NC(C)C)ccc1F	771990046	OJZBSEYQOCVPLP-GFCCVEGCSA-N	431.486	1.251	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)C(=O)Nc1ccc(F)cn1	773530132	UNFOFMOCEURYKB-SECBINFHSA-N	425.214	1.537	50	20	IDGD	
C[C@H]1CN(C(=O)c2ccc(NC(=O)C(=O)NNc3ccccc3[N+](=O)[O-])cc2)C[C@H](C)O1	773654492	XISIPSRJRGVTLM-KBPBESRZSA-N	441.444	1.926	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)N[C@H]1CCc2cc(O)ccc2C1	775091115	XEHBSSAZCDWKTM-FQEVSTJZSA-N	437.544	1.792	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)c2cn(-c3ccc(C(F)(F)F)cn3)nn2)c1	776541225	LKACHJZEBCAUOV-UHFFFAOYSA-N	426.380	1.842	50	20	IDGD	
CC[C@H](C)C(=O)NNS(=O)(=O)c1ccc(I)c(C(=O)OC)c1	778558014	OKMZBRZEWBBEKM-QMMMGPOBSA-N	440.259	1.433	50	20	IDGD	
O=C(NNC(=O)C1(c2cc(C(F)(F)F)ccc2Cl)CC1)N[C@H]1CCS(=O)(=O)C1	780460575	VOISTSPKSUFNKQ-JTQLQIEISA-N	439.843	1.908	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)N2C[C@H](C(=O)N3CCCCC3)Oc3ccccc32)cc1	783034768	HSKUFEDDYSYHSR-HXUWFJFHSA-N	438.484	1.945	50	20	IDGD	
CCCS(=O)(=O)Nc1cccc(NC(=O)C(=O)NNc2cncc(Cl)n2)c1C	783266116	OLLJAYKATVXKAI-UHFFFAOYSA-N	426.886	1.672	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2cc(Br)cnc2-n2cccn2)nc(C)n1	783326720	NHOYHXZUUBTZDJ-UHFFFAOYSA-N	431.254	1.518	50	20	IDGD	
COC(=O)COc1ccccc1C(C)=NNC(=O)Cc1csc(N2CCOCC2)n1	783811918	VVOSWEPRTBNFEV-UHFFFAOYSA-N	432.502	1.614	50	20	IDGD	
N#Cc1cc(NC(=O)C(=O)NNC(=O)CNC(=O)c2ccco2)ccc1Oc1ccccc1	784001698	BVLCVNMTLFGYBQ-UHFFFAOYSA-N	447.407	1.459	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)[C@@H](F)C(C)C)N(S(C)(=O)=O)CC2	784145104	MWEPGIZTWDXCJH-KSSFIOAISA-N	445.513	1.094	50	20	IDGD	
Cc1cc(S(N)(=O)=O)cc(NC(=O)C(=O)NNc2ccnc(Br)c2)c1C	784830366	OIPZMHQAEMYKNP-UHFFFAOYSA-N	442.295	1.190	50	20	IDGD	
O=C(NNc1ncc(F)cn1)C(=O)Nc1ccc(CCn2cc(Br)cn2)cc1	784950003	SZGIKXSATZXODI-UHFFFAOYSA-N	448.256	1.899	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)ccc1Cl	785067770	MQQLOGUFGLSTPR-UHFFFAOYSA-N	443.847	1.493	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1ccccc1OC(F)F	785330026	BYLDXFHJFUJULU-UHFFFAOYSA-N	429.401	1.782	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1nnn(Cc2ccc(C(F)(F)F)cc2)c1C	787150558	RRYWDSHFDUMMTI-LLVKDONJSA-N	427.383	1.756	50	20	IDGD	
CN(NS(=O)(=O)c1cccc(F)c1F)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	788917848	WPTGYRZRFSQXIW-UHFFFAOYSA-N	434.465	1.763	50	20	IDGD	
COc1ccc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c(OC(C)C)c1	789213883	SMXMVAVLLKBNHQ-IBGZPJMESA-N	444.440	1.627	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cc([C@@H]4CCCO4)nn3C)n[nH]2)cc1	789733557	NOEKMEDSZRMUBE-KRWDZBQOSA-N	437.460	1.370	50	20	IDGD	
C[C@H]1CCCN(S(=O)(=O)c2ccc(CNC(=O)NNc3nc4ccccn4n3)cc2)C1	790228050	KQQDJZBFLLZBPM-HNNXBMFYSA-N	443.533	1.976	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)/C=C\c1ccccc1)C(=O)NNc1nc2ccccn2n1	791253195	QZGCYFCPDGKJLU-SYCZXOQXSA-N	446.558	1.884	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1ncsc1C(F)(F)F	792238447	UDCQYUZOCSWMLS-UHFFFAOYSA-N	441.435	1.381	50	20	IDGD	
CC(C)c1c(NC(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)cnn1-c1ccccc1Cl	792498485	GPCSEIVACMIOPB-LLVKDONJSA-N	442.929	1.740	50	20	IDGD	
CC(=O)NC[C@@H]1CCn2ncc(C(=O)NNC(=O)[C@H](C)Oc3ccc4ccccc4c3)c2C1	792736020	DYIRIIDRHGOYME-DOTOQJQBSA-N	449.511	1.963	50	20	IDGD	
Cc1nc2ccc(C(=O)NNC(=O)c3ccc(S(=O)(=O)N4CCCC4)cc3)cc2n1C	792805311	FFIJNPGXRXTVKH-UHFFFAOYSA-N	441.513	1.741	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2c(C)nc3ccccn23)c(F)cc1C	793023861	XLHQOHMGFXNJGW-UHFFFAOYSA-N	441.419	1.667	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)c1cnn(CCO)c1-c1ccccc1	793831959	VNJYDCGJDFRTKF-UHFFFAOYSA-N	430.486	1.711	50	20	IDGD	
N#Cc1ccc(NC(=O)C(=O)NNC(=O)CNC(=O)OCc2ccccc2)cc1Cl	794063401	DTUSMLIJKZBANG-UHFFFAOYSA-N	429.820	1.224	50	20	IDGD	
O=C(CN[C@H](CO)c1ccc(Br)c(F)c1)NNC(=O)c1ccc(F)cc1	795331793	DVYJPGROOXIKGB-OAHLLOKOSA-N	428.233	1.812	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(C)n2)cc1OCc1cccnc1	797370905	WBMLPODBGGUCGE-UHFFFAOYSA-N	435.440	1.772	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)NCc3ccccc3F)cc2)n1	797371506	WDBVUAHRENGMQV-UHFFFAOYSA-N	449.442	1.859	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1[nH]nnc1-c1ccccc1	797733980	MXHVTVMUIFFXML-UHFFFAOYSA-N	428.474	1.250	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)NCCS(=O)(=O)CCc2ccccc2)cc1C	800756609	IUGRSJWIVORWBW-UHFFFAOYSA-N	446.529	1.230	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2CC(=O)N(C(C)(C)C)[C@H]2c2cnn(C)c2)cc1	801110843	HSSNEXOWHGHLAT-WMZOPIPTSA-N	440.504	1.203	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)[C@@H]2COCCN2CC(F)(F)F)cc1C	801342306	JXFABKBCJLIIAK-NSHDSACASA-N	437.440	1.186	50	20	IDGD	
COc1nccc(NC(=O)NNC(=O)c2nn(CCC(C)C)c(=O)c3ccccc23)n1	801722974	MKZQEQAUYSHFHT-UHFFFAOYSA-N	425.449	1.708	50	20	IDGD	
O=C(NNC(=O)c1ccc(S(=O)(=O)N2CCOCC2)cc1)Nc1ccc(Cl)cc1	802016595	HLQCBQYATYMGGH-UHFFFAOYSA-N	438.893	1.827	50	20	IDGD	
CS(=O)(=O)N1CCCc2cc(C(=O)NNC(=O)Nc3ccc4c(c3)OCO4)ccc21	802101369	LVMUWWMICLIKGZ-UHFFFAOYSA-N	432.458	1.594	50	20	IDGD	
COc1ccc(CN2C[C@H](C(=O)NNC(=O)Nc3ccc4c(c3)OCO4)CC2=O)cc1	802101632	RDDJWZXYGPPHIB-CQSZACIVSA-N	426.429	1.625	50	20	IDGD	
CCn1c(=O)c2ccccc2n(CC(=O)NNC(=O)Nc2cc(OC)ccc2Cl)c1=O	802110072	QUWLMKHWTSHIFQ-UHFFFAOYSA-N	445.863	1.698	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)Nc1ccc(OC(F)F)cc1F	802571942	HRDMHHDVPXKDFK-UHFFFAOYSA-N	428.279	1.441	50	20	IDGD	
N#Cc1cc(C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)ccc1F	802762655	JZWMAPXWTGIDIW-UHFFFAOYSA-N	429.883	1.930	50	20	IDGD	
CCS(=O)(=O)N1CCN(C(=O)NNC(=O)c2cccc(Br)c2)[C@H](C)C1	805159081	IPKSTVKDUMSDIU-LLVKDONJSA-N	433.328	1.159	50	20	IDGD	
O=C(NCC1(N2CCOCC2)CCCCC1)NNC(=O)c1cc(Br)c[nH]1	806998243	TXZXZMOODDNKER-UHFFFAOYSA-N	428.331	1.756	50	20	IDGD	
O=C(NCCC1(O)CCC1)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	807266079	OPAUDNBDIQMTEP-UHFFFAOYSA-N	435.488	1.638	50	20	IDGD	
Cc1ccc(C(=O)NNS(=O)(=O)N(C)C2CCN(C(=O)OC(C)(C)C)CC2)c(O)c1	808079187	SSDBVVANJYLYPL-UHFFFAOYSA-N	442.538	1.511	50	20	IDGD	
O=C(COC(=O)CCc1nc(O)c2c3c(sc2n1)CCC3)NNC(=O)c1cccs1	809279934	YJADSYUWNHBSBM-UHFFFAOYSA-N	446.510	1.884	50	20	IDGD	
Cc1nc2ccc(NC(=O)C(=O)NNc3ccccc3S(=O)(=O)NC(C)(C)C)cn2n1	810382650	IODMYVIYYSQWLO-UHFFFAOYSA-N	445.505	1.196	50	20	IDGD	
CCOC(=O)c1ccc(NNC(=O)[C@H](C)NS(=O)(=O)c2cccc(C#N)c2)cc1C	812722445	RHICDCBVGZWWKV-AWEZNQCLSA-N	430.486	1.854	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)N[C@H]1CC(=O)N(c2ccccc2F)C1	812930630	QOSJFLXFHJEFNT-ZDUSSCGKSA-N	438.419	1.467	50	20	IDGD	
CCCc1nnc(SCC(=O)NNC(=O)Nc2cc(Cl)c(OC)cc2OC)n1N	813575456	WAGJFGSIJNLQCZ-UHFFFAOYSA-N	443.917	1.560	50	20	IDGD	
O=C(CNC1(Cc2ccc(F)cc2)CCOCC1)NNC(=O)c1cccc([N+](=O)[O-])c1	815130563	MJQMOCLOZCCBKE-UHFFFAOYSA-N	430.436	1.876	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1cccc(Cn2cccn2)c1	815752551	WXDBAOGTQVJIGV-UHFFFAOYSA-N	442.501	1.264	50	20	IDGD	
CCOCCOc1ccc(Br)cc1NC(=O)C(=O)NNc1ncncc1F	815765277	LTBLKCUKVDCHJV-UHFFFAOYSA-N	442.245	1.875	50	20	IDGD	
COc1cccc(Cn2ccc3ccc(NC(=O)C(=O)NNC(=O)[C@H]4CCCO4)cc32)c1	815779467	HCGWIFKAMVGIJL-HXUWFJFHSA-N	436.468	1.963	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)C(=O)Nc2c(C)ccn(C)c2=O)c1	815865792	GCJWUYYLVDXNDS-UHFFFAOYSA-N	437.250	1.325	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)[C@@H](O)[C@@H](O)c1nc2ccccc2s1	817054080	RWHFWERRWNAGTC-JKSUJKDBSA-N	436.515	1.084	50	20	IDGD	
Cc1c(/C=C(\C#N)C(=O)N(C)CCOc2ccc(S(N)(=O)=O)cc2)cc(C#N)n1C	817222552	NOHBLHHLDIXYAR-MHWRWJLKSA-N	427.486	1.297	50	20	IDGD	
CCCCOc1ccc(C(=O)NNS(=O)(=O)c2cc(C(=O)O)n(C)c2)cc1OC	912980426	CWRQKLGUGDPMOW-UHFFFAOYSA-N	425.463	1.534	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)C1=NN(c2ccccc2)[C@H](c2ccccc2)C1	912995521	CJAKLVWTGNRHGC-LPHOPBHVSA-N	426.498	1.576	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)CCNS(=O)(=O)/C=C/c2ccccc2)c(C)c1	913164237	AVECOOUICDGKCT-ACCUITESSA-N	430.530	1.843	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)c2ccc(S(=O)(=O)N=c3cc[nH]cc3)cc2)cc1	914749805	MAPKECROMBDKMZ-UHFFFAOYSA-N	440.481	1.453	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NC[C@@H](c2ccc(F)cc2)N2CCOCC2)cc1OC	915897988	NKDYGFUYFPQPDL-SFHVURJKSA-N	446.479	1.860	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)c2ccccc2c1=O	915903051	TXEDRWBHGAOROZ-QGZVFWFLSA-N	434.500	1.635	50	20	IDGD	
CCN(CC)[C@H](CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)CC(C)C	916258649	HLXDHGATIYNEPM-KRWDZBQOSA-N	441.598	1.637	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NC[C@H](C)N(C)c2ccccc2)cc1	916451637	MRPBFWRVSCHHHK-KRWDZBQOSA-N	447.561	1.471	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NCc2cccc(S(=O)(=O)NC(C)C)c2)cc1	916486470	ULGQIPRNVMRCAL-UHFFFAOYSA-N	434.518	1.591	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)NCCCN2CCN(c3ccccc3)CC2)c1	916489842	QPHHSNKMQKMYHS-UHFFFAOYSA-N	425.533	1.917	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)NCCN1CCN(c2ccc(F)cc2)CC1	916513726	OKQIFQQAQHLIMS-UHFFFAOYSA-N	440.479	1.229	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NC[C@@H](C)N2CCN(c3ccccc3)CC2)cc1	916514294	AFFWAIRYGFUODM-LJQANCHMSA-N	425.533	1.915	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(S(=O)(=O)NC3CC3)c2)cc1C	916562748	YIFJBWZZWNHYOE-UHFFFAOYSA-N	430.486	1.144	50	20	IDGD	
CNC(=O)c1cccc(CNC(=O)NNC(=O)COc2ccc(Br)cc2)c1	916603593	UKLSWIPQDNPWQX-UHFFFAOYSA-N	435.278	1.718	50	20	IDGD	
CCn1c(NNC(=O)CCc2c(C)nc3c(C(N)=O)cnn3c2C)nc2ccccc2c1=O	916740185	JWOGLLCBVJGINU-UHFFFAOYSA-N	448.487	1.251	50	20	IDGD	
Cc1ccc(S(=O)(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)cc1Cl	917723721	KELXYQXKUKRSAN-UHFFFAOYSA-N	430.939	1.873	50	20	IDGD	
COC(=O)c1ccc(S(=O)(=O)NNC(=O)c2ccc(Br)s2)s1	917727886	QMXMQAWBAFAZPF-UHFFFAOYSA-N	425.307	1.982	50	20	IDGD	
Cc1nccn1CCCNC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	918225232	VLMZHXWDFKRWBH-UHFFFAOYSA-N	434.522	1.010	50	20	IDGD	
O=C(Cc1csc(-c2ccccc2Cl)n1)NNC(=O)N[C@H]1CCS(=O)(=O)C1	919886352	VTDPOWVDRLDBNO-JTQLQIEISA-N	428.923	1.524	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN(c2nc3ccccc3s2)C1)N[C@@H]1CCS(=O)(=O)C1	919886655	SZMBTWKNYFRZBI-QWHCGFSZSA-N	437.547	1.030	50	20	IDGD	
COc1ccc(-n2ccc(CNC(=O)NNC(=O)c3nnc(O)c4ccccc34)n2)cc1	919917286	ZVTFWKLRVYBGFC-UHFFFAOYSA-N	433.428	1.674	50	20	IDGD	
CC(C)n1nc(C(=O)NNS(=O)(=O)N2CCc3ccccc3C2)c2ccccc2c1=O	920757926	SJHWSWSDLGGVQM-UHFFFAOYSA-N	441.513	1.515	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)OCC(=O)N2CCC(C(N)=O)CC2)c(C)n1C[C@H]1CCCO1	1115811386	AIJBYSVBIHYCSL-PYIVIEQSSA-N	442.516	1.458	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)[C@H]2CS[C@]3(C)CCC(=O)N23)CC1	1116088800	ZQRURQQCSUDYAN-BFUOFWGJSA-N	426.539	1.235	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)CCS(=O)(=O)c2ccc(OC)cc2)cc1OC	1317707916	KCDYBBCNRQEOFE-UHFFFAOYSA-N	436.486	1.728	50	20	IDGD	
CCc1cc(OCC(=O)OCC(=O)NNC(=O)Cc2nc(C)cs2)ccc1Cl	1318248574	IERLJZYRGWTPSV-UHFFFAOYSA-N	425.894	1.979	50	20	IDGD	
COC(=O)C(=O)NNC(=O)N[C@@H]1CCCN(c2c(C)cc(Br)cc2C)C1=O	1323167309	BBCKHFIILITUES-GFCCVEGCSA-N	441.282	1.065	50	20	IDGD	
CCOc1cc(N2CCN(C)CC2)ccc1NC(=O)NNC(=O)c1n[nH]c2c1CCCC2	1342408732	QBIBEOKXAGHRPJ-UHFFFAOYSA-N	441.536	1.906	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)c2ccc(S(=O)(=O)N(C)CCO)cc2)cc1	1344525079	XGWLKMDQJABUDE-UHFFFAOYSA-N	437.543	1.161	50	20	IDGD	
COC[C@@]1(C(=O)NNC(=O)c2cncn2-c2ccccc2)CCN(C(=O)OC(C)(C)C)C1	1347466128	DZSCQSOLCSVFII-JOCHJYFZSA-N	443.504	1.907	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(CCN(C(=O)/C=C/C(=O)NCc3ccco3)C2)C1	1779209373	XYHKDBVWTWMIPI-IRUYWQDXSA-N	449.580	1.133	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CCO[C@@]2(CCN(C(=O)CO[Si](C)(C)C)C2)C1	1779301099	KNZASLCRFZBWRV-CSODHUTKSA-N	438.597	1.423	50	20	IDGD	
CCc1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](C)Br)C3)n(C)n1	1779768020	CAGZPZKOANTZIB-URKNILKWSA-N	441.370	1.893	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Br)C1	1780773782	WMJJIQYRGXQLNW-MBMVNNNZSA-N	436.322	1.058	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)CC(=O)Nc3ccc(F)cc3)C2)C1	1780883987	RKDKRUZMOCHLOH-JXFKEZNVSA-N	441.887	1.238	50	20	IDGD	
O=C(c1cnc2[nH]ncc2c1)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781329276	CILXNHGUJVYDJE-MLGOLLRUSA-N	426.246	1.092	50	20	IDGD	
O=C(c1ccc2nccnc2c1)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781329450	GCXDBGCUAREYJS-CRAIPNDOSA-N	437.269	1.764	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3c4c(nn3C)CCC4)C2)C1	1782434320	HAKUGICWCIMUFQ-YJYMSZOUSA-N	439.354	1.383	50	20	IDGD	
O=C(c1cnc[nH]1)N1CCO[C@@]2(CCN(C(=O)[C@@H](Br)Cc3ccccc3)C2)C1	1783019616	YCOPLXRYMLVGGD-OXJNMPFZSA-N	447.333	1.859	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)Cc3ccccc3O)C2)C1	1783239494	FUFOQEQWJDAMOM-KXBFYZLASA-N	425.323	1.938	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](C)Br)C3)C2)n1	1783532985	VLKWEESYTZKNLM-KPZWWZAWSA-N	439.310	1.267	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccnc4c3OCO4)CCO2)C1	1783538005	RVSBPVKNZYVTJN-PIGZYNQJSA-N	426.267	1.037	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H]1CC[C@@H]3CCC(=O)N3C1)CCO2	1783538073	SPMDRLBUHUTJTM-ZTENYAIWSA-N	442.354	1.001	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](C)Oc1cccnc1)CCO2	1783540623	ZVKNLLKOKIOMRC-IYOUNJFTSA-N	426.311	1.462	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CC[C@@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1783849439	OIPKLMRSLIMCDZ-GCKMJXCFSA-N	426.941	1.837	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(-c4ncc[nH]4)cc3)CCO2)C1	1783884912	VOQDDGSNTQHCLD-UTKZUKDTSA-N	432.908	1.774	50	20	IDGD	
O=C(Cn1ccc2sccc2c1=O)N1CCO[C@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783943013	DONIHVXJYJWUCW-GOSISDBHSA-N	444.340	1.697	50	20	IDGD	
CCn1nc(C)cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]2C1	1783966083	ZBKNYBMBVXCSSM-DYWXZXKOSA-N	441.370	1.836	50	20	IDGD	
CSc1cccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]3C2)c1O	1784091505	WGLFWPWGKGDRNG-MXAVVETBSA-N	428.938	1.307	50	20	IDGD	
C[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]2C1)N1CSCSC1	1787446406	IKYQUKMAGBXYAH-PEDHHIEDSA-N	425.979	1.544	50	20	IDGD	
CC(=O)Nc1ccc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Cl)C[C@@H]32)cc1	1788190186	VSHCSJKLXIBHBE-XPYUAMARSA-N	425.888	1.702	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3Cc4ccccc4O3)C[C@@H]21	1788762478	BHRGJCSTDWPBSC-XEYPJELSSA-N	432.593	1.821	50	20	IDGD	
CC(C)c1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)Br)C[C@@H]32)n[nH]1	1789325776	VVTLWEKSTFRMTA-QCQGSNGOSA-N	427.343	1.910	50	20	IDGD	
COC(C)(C)C(=O)NC1(c2ccc(NC(=O)c3cnccc3C(=O)NN)cc2)CCC1	1789519998	ZCTSAESFUGRDJM-UHFFFAOYSA-N	425.489	1.858	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]3C2)ccc1O	1789923564	UXXLUXJGBGXPLP-DARAHFNDSA-N	429.286	1.984	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C=C/c3cnc[nH]3)[C@H]2C1	1791506615	RIVSUKCBFFSNQG-ZDQDDMNOSA-N	425.327	1.576	50	20	IDGD	
CCOc1ncccc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Br)C2	1792382011	RWDJLJNKTCVPHN-GUIRCDHDSA-N	426.311	1.467	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C=C/c1ccc([N+](=O)[O-])o1	1793109184	KASCTXKEFRUCBT-GTLIUFDXSA-N	442.266	1.574	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](O)CCl)C1	1793116775	TYWMDLFGHMWLJN-NQNKBUKLSA-N	443.972	1.871	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)COc1c(C)cc(C)cc1C	1793242802	PBNNVJOGJAHEGH-AJYBTWMASA-N	438.952	1.834	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cncc(S(C)(=O)=O)c1)C2	1793445953	XUKAMFGEZUKOKR-FSDCSDTHSA-N	443.953	1.096	50	20	IDGD	
Cc1nn(C)c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)CBr)C3)c1F	1794493622	XNHIJXWCNAHGOD-ZKCLLBTKSA-N	431.306	1.102	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Cl)C[C@H]2C[C@H]21	1796361199	KZFMWZDHUWULNS-WXUBNNCZSA-N	445.919	1.508	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc2ncnn2c1	1798233999	ZWJJDSRYIDRNQX-AUHJYUKYSA-N	448.487	1.115	50	20	IDGD	
Cc1cc(C(=O)NCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](F)Br)C3)no1	1798509399	GUYXQCQTNJADQQ-MIJXAVMKSA-N	431.262	1.042	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1C[C@H]1F	1799173858	WDEVOESRPGKASZ-DEPYFDJDSA-N	433.908	1.066	50	20	IDGD	
COc1cnc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Br)c(F)c1	1799347414	KIIDZKQUCXLZPH-NVVZYBJKSA-N	434.237	1.123	50	20	IDGD	
N#Cc1ccc(F)c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Br)C3)c1	1799747876	YBANTQVXUNBLBY-BAESOJJISA-N	428.233	1.591	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cncc(S(C)(=O)=O)c1)C2	1800078095	STSSDKMPZFXYPJ-AHXJXLJNSA-N	448.372	1.973	50	20	IDGD	
C=CC[C@@H](CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2)NC(=O)OC(C)(C)C	1801927950	ATPMUNFPZFRNNK-SSRUIJIPSA-N	447.935	1.970	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H](O)C[C@H]1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](F)Cl)C2	1802028169	GIIOVXXJQBHRCG-QLKXBERHSA-N	433.908	1.529	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cn3ccccc3n2)[C@H]1c1cccnc1)[C@@H](O)CCl	1803138929	HXKHVQJVNHZWPB-IEZWGBDMSA-N	427.892	1.649	50	20	IDGD	
CC(C)Cc1cc(C(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)n(C)n1	1803138986	QKMPDDUCXSCWRZ-UXPWSPDFSA-N	447.967	1.933	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccccc1OC(F)F)c1ccc(B(O)O)cc1	1803773769	NEAGVRVOGJZJFT-BJWYYQGGSA-N	444.243	1.533	50	20	IDGD	
O=C(c1nc2cc([N+](=O)[O-])ccc2[nH]1)N1CCC2(CCCN(C(=O)[C@H](O)CCl)C2)CC1	1805525900	ALXGMVDGUJFADU-MRXNPFEDSA-N	449.895	1.916	50	20	IDGD	
CC1=CC[C@H](C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)CC1	1807376752	WFKIYPBTKRIJBI-AVCGJXAMSA-N	447.344	1.827	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)c1ccc2c(n1)OCCO2	1808180304	BPBBPQXQOQLIFU-ZVZYQTTQSA-N	446.891	1.167	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)C(F)(F)C(F)(F)C(=O)O)[C@H]1c1cccnc1)[C@H](F)Cl	1808308391	JYGBMNHZHPXVAL-DCAQKATOSA-N	443.756	1.977	50	20	IDGD	
Cc1cc2nnc(C(=O)N3CC[C@H](CNC(=O)[C@@H](F)Cl)[C@@H]3c3cccnc3)c(C)n2n1	1808312833	JXAKRKQUXGCMHI-FHLIZLRMSA-N	445.886	1.990	50	20	IDGD	
Cn1nncc1C(=O)N1CC[C@H](CNC(=O)[C@@H](F)Br)[C@@H]1c1cccnc1	1808651708	PHQFSDGSIPPNPZ-KWCYVHTRSA-N	425.262	1.220	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)CCNC(C)=O)[C@@H]1c1cccnc1	1812779253	QMDNQKKCQFQHOI-XYJFISCASA-N	439.354	1.787	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)Cn2nc(C)cc2C)[C@@H]1c1cccnc1	1813028218	LFIZQJKODHKCRJ-WSTZPKSXSA-N	433.940	1.855	50	20	IDGD	
C#CCCCCC(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1813228220	UCNLCGMBUWTRGS-WMZHIEFXSA-N	427.549	1.654	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)c1	1813894890	KFFUVQVVHVSSCU-DFQSSKMNSA-N	444.919	1.959	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ncn(-c3ccccc3)n2)[nH]n1)[C@@H](O)CCl	1814871564	SFBMLBURDABGHV-CVEARBPZSA-N	443.895	1.896	50	20	IDGD	
CCOC(=O)N[C@@H](O)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)C(C)(C)CCl)CC2	1819458907	YSDUDFHBKQYXQC-ZANVPECISA-N	432.930	1.385	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](F)Cl)CC2)c1cc(=O)nc2cccnn12	1821265400	XTBUEYCHAKROGS-RTHLEPHNSA-N	436.856	1.306	50	20	IDGD	
C[C@](O)(CC(=O)O)CC(=O)Nc1cc([C@@H]2CCCCN2C(=O)CO[Si](C)(C)C)[nH]n1	1822410440	PQVYFTUPVLFTAF-IFXJQAMLSA-N	440.573	1.869	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)C(=O)c2ccccc2)[nH]n1	1822413575	ZSUSJYDBOHCRGA-QGZVFWFLSA-N	440.504	1.658	50	20	IDGD	
CCN1CCC(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)CC1	1822417848	QPYWFWMOQIKTRG-GOSISDBHSA-N	447.584	1.507	50	20	IDGD	
N#Cc1ccc2[nH]nc(C(=O)Nc3nc4c(s3)C[C@@H](NC(=O)[C@H](O)CCl)CC4)c2c1	1823888774	OMJOFBCBEXEGKO-IINYFYTJSA-N	444.904	1.717	50	20	IDGD	
COCCn1ccc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)[C@@H](O)CCl)CC2)n1	1824182757	JECFBWCZTCIPAP-ROUUACIJSA-N	426.945	1.363	50	20	IDGD	
C[C@@H](Cn1cccn1)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1	1825342323	UQJFDBLIXWTBKP-ICSRJNTNSA-N	446.596	1.512	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)COc1cccnn1)CC2	1825648080	XVMAPKZKNPBBBJ-UWVGGRQHSA-N	440.323	1.708	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)Cc1ccsc1)CC2	1826085136	GPHHHDLORHQERD-ZDUSSCGKSA-N	435.575	1.732	50	20	IDGD	
O=C(c1ccncc1F)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827059980	ZRMIDNWAHHQLST-OAQYLSRUSA-N	439.296	1.448	50	20	IDGD	
Cn1cc(CCC(=O)N2CCOC[C@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)cn1	1830357735	JCMLPUZMJYQTNS-FQEVSTJZSA-N	426.945	1.074	50	20	IDGD	
CC1=C(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)CCO1	1830538876	SQBSATYUWRQMRT-FZKQIMNGSA-N	431.327	1.168	50	20	IDGD	
CC1=C(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)CCO1	1830538877	SQBSATYUWRQMRT-SCLBCKFNSA-N	431.327	1.168	50	20	IDGD	
CC(C)(C)OC(=O)CC(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1831986045	IUSQRAXUIHUMDE-FQEVSTJZSA-N	432.945	1.440	50	20	IDGD	
COc1cnc(C(=O)N2CCC(N3CCC(NC(=O)C(C)(C)CCl)CC3)CC2)cn1	1833212289	VVAYAVWKHOMECZ-UHFFFAOYSA-N	437.972	1.935	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cccc4nccn34)CC2)CC1)[C@H](O)CCl	1833312562	XMZKLSWEIHVHTH-GOSISDBHSA-N	433.940	1.119	50	20	IDGD	
COC[C@@H](C)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)CBr)CC2)CC1	1833522982	IKLPRZBQXSUTDZ-LSDHHAIUSA-N	432.403	1.872	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)C3(C#N)CC3)CC2)CC1	1834599629	PATVCEMFNWBMLN-CQSZACIVSA-N	425.371	1.893	50	20	IDGD	
Cc1cnoc1C(=O)NC1CCN(C2CCN(C(=O)[C@H](C)Br)CC2)CC1	1836071858	LRWFRSIHTKYOTK-ZDUSSCGKSA-N	427.343	1.952	50	20	IDGD	
CCc1ccnc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)c1	1836360036	DPHFWSUPXFWWLU-AUUYWEPGSA-N	440.338	1.497	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1Cc3ccccc3O1)CCO2	1836649764	AMJHWAAOMJTVGJ-KNQAVFIVSA-N	448.592	1.298	50	20	IDGD	
O=C(COc1ccc(F)cc1)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836716836	UEKMVMYZSMOPMN-IBGZPJMESA-N	442.915	1.803	50	20	IDGD	
O=C(c1cc2cn[nH]c2cn1)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836717392	WAENCAQZMYXMJC-SFHVURJKSA-N	435.912	1.170	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)/C=C/c3ccoc3)CC2)CC1	1837108457	BCEYNEKOHIBKBO-HWKANZROSA-N	446.548	1.664	50	20	IDGD	
Cc1noc(C)c1CC(=O)N1CCOC[C@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1837710030	CXZJCRPYXPUSKA-HXUWFJFHSA-N	439.585	1.142	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc4cccnn4n3)CCO2)C1	1838422319	XXOJPHGRYGERRJ-HXUWFJFHSA-N	435.912	1.064	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](C)NC=O)CC2)CC1	1838640505	YZPZEFCFYNJHDZ-CJNGLKHVSA-N	432.359	1.293	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccccc3F)CCO2)C1	1838856969	KBLYSVGDNZABGJ-ACJLOTCBSA-N	429.286	1.679	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)cc1	1838967858	ZOGGKFFDIONFHW-LIRRHRJNSA-N	441.322	1.549	50	20	IDGD	
CC(C)n1nccc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839200633	MTFPCYYXEVXOSK-YOEHRIQHSA-N	447.305	1.225	50	20	IDGD	
N#Cc1cccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)c1	1839201599	BVMJQYNWMQLNLE-MAUKXSAKSA-N	440.269	1.319	50	20	IDGD	
C[C@H](C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2)c1ccccc1	1839203668	RMPBJUNCWSBRRO-QOKNQOGYSA-N	443.313	1.937	50	20	IDGD	
Cc1cccc(F)c1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839203755	VJJLGPPHHCKYGS-CRAIPNDOSA-N	447.276	1.895	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccccc3)C2)C1	1839966044	SMOZUSIYVZFSRL-VQIMIIECSA-N	425.323	1.930	50	20	IDGD	
Cc1ncccc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2	1840031241	JOUHYNJTBHLLRI-ACJLOTCBSA-N	426.311	1.243	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCBr)C2)C1	1840031740	AZKIBFPFOXAOPU-SMDDNHRTSA-N	442.148	1.011	50	20	IDGD	
COc1cccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)c1	1840034517	OBBJJNWTWJVFIS-KUHUBIRLSA-N	441.322	1.549	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccc(F)c(F)c3)C2)C1	1840151459	BZFRZYFOQZTIKZ-QRWLVFNGSA-N	446.878	1.218	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCCC12CN(C(=O)CCN1CCCC1)C2	1841925574	KMJYNMONXSEMSX-INIZCTEOSA-N	442.988	1.808	50	20	IDGD	
Cc1ccc(CCC(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)s1	1842017977	CAKHSTJLYGSVSC-UHFFFAOYSA-N	427.530	1.505	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2cnc3ccoc3c2)C1	1843288177	ZODOIKMMIDUGIE-AFUMVMLFSA-N	434.456	1.779	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@H]2COCCN2C(=O)OC(C)(C)C)C1	1843347552	JUSGAJRDDHSAOA-CABCVRRESA-N	445.944	1.080	50	20	IDGD	
CCc1[nH]nc(C(=O)N2CC3(CCCN3C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)c1Cl	1843415702	BTWLWVDJHYFKSR-FSJBWODESA-N	445.911	1.577	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)[C@H](C)N(C)C(C)=O)C1	1843427271	ZYXZZMHUXHWPBB-ZDUSSCGKSA-N	446.460	1.204	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2c(C)nc3ccccn23)C1	1843651823	WJZNXDBUJZMXHK-WGOQTCKBSA-N	447.499	1.594	50	20	IDGD	
COc1ccc(Br)cc1C(=O)N1CCCC12CN(C(=O)[C@@H](O)CCl)C2	1845280835	AHEATLLBIYMTOL-ZDUSSCGKSA-N	431.714	1.874	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@H]2C[C@@H](O)CN2C(=O)OC(C)(C)C)C1	1846217639	YYIHTVYETRNPJU-ILXRZTDVSA-N	429.945	1.578	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)Cc1ccc(Br)nc1)C2	1846363490	LWWWRADLYIDINB-ZDUSSCGKSA-N	430.730	1.844	50	20	IDGD	
Cc1noc(-c2ccccc2)c1C(=O)N1CC2(CCCN2C(=O)CCC(=O)NN(C)C)C1	1846384773	GSCITPOJOJWQLF-UHFFFAOYSA-N	439.516	1.840	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CNC(=O)OC(C)(C)C	1847510956	ITLYMHMBXJDGOL-ZOBORPQBSA-N	448.358	1.247	50	20	IDGD	
C[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl	1847556960	UIMWCDLCCWDFDM-NRKLIOEPSA-N	443.972	1.681	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)Cc1cccc(Cl)n1	1848261710	GAKGKMHWJDKZFG-QVICEKFBSA-N	442.907	1.613	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1ccc[n+]([O-])c1	1848289560	RVMQGNJCRIPCMO-ROUUACIJSA-N	440.412	1.283	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)c2ccc(-n3cncn3)c([N+](=O)[O-])c2)cc1OC	15761862	VLWVQZFDLSSDCI-UHFFFAOYSA-N	426.389	1.658	50	20	IDGD	
C=CCn1c(=S)[nH]c2cc(C(=O)NNC(=O)c3n[nH]c(=O)c4ccccc34)ccc2c1=O	17195096	KMKQRCLAZJUTFT-UHFFFAOYSA-N	448.464	1.556	50	20	IDGD	
CC[C@@H](C)NS(=O)(=O)c1ccc(C(=O)NNC(=O)c2c(C)nc3ccccn23)cc1	17583138	DDRRKSYQLYJJJU-CYBMUJFWSA-N	429.502	1.794	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2ccc(N3CCNC3=O)c(C)c2)c2ccccc2c1=O	108787247	ZHDPALQBPYNWPP-UHFFFAOYSA-N	434.456	1.329	50	20	IDGD	
Cc1nc(-c2cccnc2)nc(O)c1CCC(=O)NNC(=O)CNC(=O)c1cccs1	725739578	JGYJZGYQTJOGGV-UHFFFAOYSA-N	440.485	1.124	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)[C@@H](C)NC(=O)c2n[nH]c3ccccc23)cc1OC	726382291	ONAWCYAYLFJKRH-CYBMUJFWSA-N	439.472	1.940	50	20	IDGD	
C[C@@H](NC(=S)NNC(=O)c1cc(S(=O)(=O)NCc2ccccc2)ccc1O)C1CC1	727271486	FAMHKAXKCDTORI-CYBMUJFWSA-N	448.570	1.778	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1ccc(N2CCCC2)nn1	727875049	NDFPOINWYGJJMJ-UHFFFAOYSA-N	433.852	1.357	50	20	IDGD	
CC[C@H](N=c1nn[nH]n1-c1ccccc1)C(=O)NNC(=O)CSc1ccc(Cl)cc1	729508749	LYRGSLHABBMLOQ-INIZCTEOSA-N	445.936	1.868	50	20	IDGD	
C[C@@H](CN1CCN(C)CC1)NC(=O)NNC(=O)COc1ccccc1-c1ccccc1	730129750	COFVCOQTTVCVKE-SFHVURJKSA-N	425.533	1.699	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc2ccccc2c1)NNC(=O)COc1ccccc1O	730782883	XIYZQKDPDGPLCW-UHFFFAOYSA-N	443.481	1.440	50	20	IDGD	
COc1cc(C=O)c([N+](=O)[O-])cc1OCC(=O)NNC(=O)c1cccc(OC(F)F)c1	731629898	IOFTUAXIVVGTHI-UHFFFAOYSA-N	439.327	1.857	50	20	IDGD	
COc1ccc(-c2noc(CN3CCN([C@H](C)C(=O)NNC(=O)CC(C)C)CC3)n2)cc1	731848547	GPSLQAARRUGPQU-MRXNPFEDSA-N	444.536	1.445	50	20	IDGD	
Cc1ccc(-c2nnc(S)n2CCC(=O)NNC(=O)CCN2C[C@H](C)O[C@@H](C)C2)cc1	732263748	OJHHQLCHDAFEJR-HOTGVXAUSA-N	446.577	1.579	50	20	IDGD	
COc1ccc(-n2c(C)cc(/C=C(/C#N)C(=O)c3c(N)n(C)c(=O)n(C)c3=O)c2C)cc1	732578344	LBYFKZJAAJFPTL-WJDWOHSUSA-N	433.468	1.872	50	20	IDGD	
O=C(NN=Cc1c(N2CCOCC2)nc2ccccn2c1=O)c1cnn(-c2ccccc2)c1	733077090	GYNXBAARAGXZHM-UHFFFAOYSA-N	443.467	1.481	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(C(=O)NNc2nc3ccccc3c(=O)n2C)ccc1Cl	733262379	TYEUNINIDMWOFH-UHFFFAOYSA-N	435.893	1.594	50	20	IDGD	
COc1ccc(C(=O)NNc2nccnc2Cl)cc1S(=O)(=O)NCc1ccccn1	734260219	FVVYRWZVLOSEFG-UHFFFAOYSA-N	448.892	1.769	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CSc2nnnn2-c2ccc3c(c2)OCCO3)cc1	734982635	UBAMSYYHGRCNGP-UHFFFAOYSA-N	426.458	1.295	50	20	IDGD	
Cc1cccc2cc(C(=O)NNc3ncccc3S(=O)(=O)N3CCN(C)CC3)oc12	735117102	NYAHUPYEIYJUDU-UHFFFAOYSA-N	429.502	1.829	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)NC1CCN(S(=O)(=O)Cc2ccccc2)CC1	735513673	YRMLFOPSUGMWRS-UHFFFAOYSA-N	430.530	1.933	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)c1ccc(C)c(S(=O)(=O)N(CC)CC)c1	740851994	FUAJYPYNAMJPNS-UHFFFAOYSA-N	426.539	1.091	50	20	IDGD	
Cc1cc(F)c(S(=O)(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1[N+](=O)[O-]	742028715	CBQMPQNUTOLUOV-UHFFFAOYSA-N	431.423	1.069	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H](C)Cc2c(C)nn(C)c2C)c1	742032602	QPMBNZDQDVPAEW-AWEZNQCLSA-N	449.577	1.707	50	20	IDGD	
C[C@@H]1CCCN(C(C)(C)CNC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)C1	743561430	MTTHPKYCLAEXBF-CQSZACIVSA-N	425.555	1.936	50	20	IDGD	
CN(CCN1CCN(CC(=O)NNC(=O)c2ccc(C#N)cc2)CC1)Cc1ccccc1	744398486	IXUOCGMFTYYAIL-UHFFFAOYSA-N	434.544	1.069	50	20	IDGD	
CC(=NNC(=O)N1CCOCC1)c1ccc(S(=O)(=O)Nc2ccc(C(=O)O)cc2)cc1	745601964	AVABKZQUTXEPSK-UHFFFAOYSA-N	446.485	1.951	50	20	IDGD	
O=C(Cc1cccc2ccccc12)NNC(=O)[C@@H]1CCCCN1C(=O)c1ccc(O)nn1	746108610	BWDOSZAIAVPWHP-IBGZPJMESA-N	433.468	1.720	50	20	IDGD	
O=C(NCCNS(=O)(=O)c1cccnc1)NNC(=O)c1cc2c(s1)CCCCC2	746326032	MSCPBPKLLWQJLQ-UHFFFAOYSA-N	437.547	1.335	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@@H](C)CN(C)C(=O)OC(C)(C)C	746821491	KSHBMFHTOALASZ-LBPRGKRZSA-N	441.554	1.552	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)c1ccccc1)C(=O)NNC(=O)c1ccc(C#N)cc1	747175986	VHRSYNRXJDYORR-QGZVFWFLSA-N	432.527	1.419	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NCCC(=O)N2CCN(c3ccccc3)CC2)cc1	748464645	HMJRYSSHVWZEFM-UHFFFAOYSA-N	439.516	1.443	50	20	IDGD	
NC(=O)c1cccc(OCCC(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)c1	748520820	FHVZRXOEFOHNJH-UHFFFAOYSA-N	431.392	1.991	50	20	IDGD	
Cc1cc(N2CCC(NC(=O)NNC(=O)[C@@H](C)Oc3ccccc3F)CC2)nc(C)n1	749617392	KKNATYRJVMBJSJ-CQSZACIVSA-N	430.484	1.999	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CCc2c(C)nn(-c3ccc(S(N)(=O)=O)cc3)c2C)o1	752524628	LEQKKRRXGDYYDN-UHFFFAOYSA-N	445.501	1.432	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@H](C(=O)NNc2nc3ccccc3c(=O)n2C)C(C)C)cc1	752900448	DFASXIWSNKYIFS-SFHVURJKSA-N	443.529	1.688	50	20	IDGD	
CC[C@@H](NC(=O)NNC(=O)c1cc(C)n(-c2ccccc2)c1C)C(=O)N1CCOCC1	753059677	VHEDKSQLMKTALK-LJQANCHMSA-N	427.505	1.676	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)c2ccc(O[C@H](C)C(=O)NNC(=O)CO)cc2)cc1C	753444343	KBULDGBWPFLWRP-OAHLLOKOSA-N	435.502	1.036	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H]2CCOC(C)(C)C2)c1	754676040	QMIRNEXUCFNMPR-OAHLLOKOSA-N	426.539	1.619	50	20	IDGD	
COCCCOc1cc(C)ccc1CNC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	755088228	SXFHZEIVIRVSHW-UHFFFAOYSA-N	439.476	1.530	50	20	IDGD	
O=C(CSc1nnc(O)nc1O)NN=Cc1cn(-c2cccc(Cl)c2Cl)nn1	755619202	WMJYCJPHVOZWQO-UHFFFAOYSA-N	441.260	1.413	50	20	IDGD	
COc1ccc(-c2nn(CCC#N)cc2/C=C(/C#N)C(=O)N[C@@H]2CNC(=O)C2)cc1OC	755931513	FFPBGQAARHUVOC-KCPLEYNQSA-N	434.456	1.393	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(F)c(NC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1	756684434	OEXHEQMBEJSJJE-INIZCTEOSA-N	438.437	1.069	50	20	IDGD	
CCOC(=O)c1cc(Br)cc(S(=O)(=O)NNC(=O)c2ccccn2)c1	756928382	NLUZKZTXTGUTQQ-UHFFFAOYSA-N	428.264	1.644	50	20	IDGD	
O=C(Cc1ccn(-c2ccc(F)cc2)n1)N1CCN(S(=O)(=O)CBr)CC1	758512453	LXWDQMJKNGSWFN-UHFFFAOYSA-N	445.314	1.380	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)CN2CCN(Cc3cccc(Cl)c3)C(=O)C2)cc1	758763131	HFIPEADFCFBTMU-UHFFFAOYSA-N	425.876	1.317	50	20	IDGD	
NC(=O)[C@H]1CC[C@H](CNC(=O)NNC(=O)c2cn(-c3ccccc3)nc2-c2ccccc2)O1	760205195	XLRBNVCXJYLBEE-IEBWSBKVSA-N	448.483	1.516	50	20	IDGD	
O=C(NNC(=O)c1cn(-c2ccccc2)nc1-c1ccccc1)C(=O)Nc1cnns1	760279623	OMHUOBWOYVNUNU-UHFFFAOYSA-N	433.453	1.791	50	20	IDGD	
CCOc1ccc(N2C[C@@H](C(=O)NNC(=O)CCNC(=O)OC(C)(C)C)CC2=O)cc1	760442353	JSKZNRSLTIDKND-AWEZNQCLSA-N	434.493	1.500	50	20	IDGD	
C[C@@H](O)c1cn(CC(=O)NNC(=O)COc2ccc(OCc3ccccc3)cc2)nn1	763013551	QOCGWNLYUYHOHY-OAHLLOKOSA-N	425.445	1.137	50	20	IDGD	
Cc1cc(C)c(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c(Br)c1	763574804	IRUDZWWGXFAZLL-HNNXBMFYSA-N	448.273	1.992	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(N3CCO[C@@H](C)C3)cc2)c1	763630935	RYIOXHCYIYSVNH-INIZCTEOSA-N	426.473	1.385	50	20	IDGD	
CCOC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(OC)cc2)cc1	763661355	NODWRSQUFSRCCF-UHFFFAOYSA-N	430.417	1.429	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)C(=O)Nc1ccc(OCc2ccncc2)cc1	763680999	DDZGGGFENVXRGR-UHFFFAOYSA-N	438.415	1.965	50	20	IDGD	
CN(C)c1ncncc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccco2)nc2ccccc12	763762943	GMQWYVPVGBXLBX-UHFFFAOYSA-N	445.439	1.751	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(N)=O)c(F)c2)cc1	763769568	MZUJJLBXOCTJRE-UHFFFAOYSA-N	430.436	1.749	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)C(=O)Nc2ccc3n[nH]cc3c2)c2ccccc2c1=O	763790579	LHFAYGOXBHJXRG-UHFFFAOYSA-N	433.428	1.253	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(S(=O)(=O)N3CCCC3)c2)cc1	763830411	OCTHODIVZYKGEV-UHFFFAOYSA-N	444.513	1.433	50	20	IDGD	
COC(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)c1	763840136	IVMDJLIPDSQRAB-HNNXBMFYSA-N	427.457	1.572	50	20	IDGD	
Cc1nc(-c2cccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc3ccccc3F)c2)no1	763866634	XFLOVHSNRDUVLI-LLVKDONJSA-N	427.392	1.738	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccc(C(=O)Nc3ccccc3)cc2)n1	763890896	HWRMVSCUGJSZCN-UHFFFAOYSA-N	434.456	1.538	50	20	IDGD	
O=C(CCSc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccc(-n2cncn2)c(F)c1	763895998	WCRUTHVFOYBZEJ-UHFFFAOYSA-N	446.439	1.814	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(-n3ccnn3)cc2)cc1OC	763912364	XTLPYNSEUMAHRL-UHFFFAOYSA-N	438.444	1.464	50	20	IDGD	
Cc1nc2cc(NC(=O)C(=O)NNC(=O)c3nn(-c4ccccc4)cc3O)ccc2n1C	763945038	SFSUFPCGWHBWRI-UHFFFAOYSA-N	433.428	1.173	50	20	IDGD	
CC(C)S(=O)(=O)c1ccccc1NC(=O)C(=O)NNC(=O)c1ccc2c(c1)OCCO2	764003397	CUCGBMIJMRXHKN-UHFFFAOYSA-N	447.469	1.040	50	20	IDGD	
O=C(CC(F)(F)F)NNC(=O)C(=O)Nc1ccc(NC(=O)NCc2ccco2)cc1	764112629	NAWFRMJEMMFLKK-UHFFFAOYSA-N	427.339	1.640	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2O1)C(=O)Nc1cc(N2CCCC2=O)ccc1Cl	764151163	GMDRFXVSZIGFBI-KRWDZBQOSA-N	442.859	1.556	50	20	IDGD	
O=C(CC1CCCC1)NNC(=O)C(=O)Nc1ccc(CC(=O)N2CCSCC2)cc1	764187637	HOOAYDHHHOBCPM-UHFFFAOYSA-N	432.546	1.471	50	20	IDGD	
O=C(Cc1ccccn1)NNC(=O)C(=O)Nc1cccc(-c2nnc3n2CCCCC3)c1	764267342	TZQUWNQIYPMNRG-UHFFFAOYSA-N	433.472	1.395	50	20	IDGD	
CCOc1ccc(C#N)cc1NC(=O)C(=O)NNC(=O)c1cc(Br)ccc1O	764276938	IVVMOBKYLTVYEV-UHFFFAOYSA-N	447.245	1.825	50	20	IDGD	
C[C@H](C(=O)NNc1c(F)cc(C(=O)NC2CC2)cc1F)N1C(=O)[C@H]2CCCC[C@H]2C1=O	764335376	UTIUEVRRWHDWQC-HONMWMINSA-N	434.443	1.864	50	20	IDGD	
Cc1nn(-c2ccc(C#N)cc2)c(NC(=O)C(=O)NNC(=O)COCc2ccccc2)c1C	764363924	WTIBIRQFLJBLIJ-UHFFFAOYSA-N	446.467	1.664	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc(C(=O)NC)cc3)n[nH]2)cc1	764384576	DTRWLHTYJCPQSI-UHFFFAOYSA-N	434.456	1.398	50	20	IDGD	
COC(=O)c1cc(C(C)C)ccc1NC(=O)C(=O)NNC(=O)c1cncc(NC(C)=O)c1	764434454	WXZNBNSGPZHOLE-UHFFFAOYSA-N	441.444	1.350	50	20	IDGD	
C[C@@](O)(Cc1ccccc1)C(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	766664761	SHJYJLALTDROJP-HSZRJFAPSA-N	444.963	1.599	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)[C@@H]1CS[C@@H](Cc2ccccc2F)C(=O)N1	766669056	FXKPNGMJOYVSQU-HOTGVXAUSA-N	437.518	1.515	50	20	IDGD	
CCCS(=O)(=O)c1ccccc1C(=O)OCC(=O)NNC(=O)Cc1ccccc1C	767283679	PNJGNOKYBPMVMV-UHFFFAOYSA-N	432.498	1.726	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)C(C)(C)C(N)=O)c2)c(C)c1	767403208	JCUQOWXITMYGIJ-UHFFFAOYSA-N	432.502	1.377	50	20	IDGD	
Cc1nn(CC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)cc1-c1ccccc1	767429326	WZIIESSYJNYGGV-UHFFFAOYSA-N	440.529	1.921	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2ccc(O)c(C(=O)NNc3nccc(OC)n3)c2)cc1	769690296	DOUUFZUOYHCHPZ-UHFFFAOYSA-N	445.457	1.757	50	20	IDGD	
CSCCNC(=S)NNC(=O)CCNC(=O)c1cc(F)ccc1Br	769769170	QMBUGOUDZIZIDR-UHFFFAOYSA-N	437.360	1.566	50	20	IDGD	
O=C(NNC(=O)c1ccc2nsnc2c1)c1ccc(S(=O)(=O)N2CCCC2)cc1	770549315	MMYXRFHTVUIBOR-UHFFFAOYSA-N	431.499	1.551	50	20	IDGD	
CCS(=O)(=O)NC1CCN(C(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)CC1	770646001	BQADMWMIUZNYGQ-GFCCVEGCSA-N	432.930	1.252	50	20	IDGD	
COC(=O)c1cc(OC)c(OC)c(OC)c1NC(=O)C(=O)NNc1ccc(C#N)cc1	773692662	IUCCHIAMCRPUKU-UHFFFAOYSA-N	428.401	1.452	50	20	IDGD	
O=C(Cc1cccc2ccccc12)NNC(=O)N[C@@H]1CCO[C@@]2(CCS(=O)(=O)C2)C1	776076093	IEIUHICSFGRRLV-UTKZUKDTSA-N	431.514	1.449	50	20	IDGD	
COCc1nnc(-c2cccc(C(=O)NNC(=O)c3csc(N4CCOCC4)n3)c2)o1	776703564	YRCYJVWMIIMALL-UHFFFAOYSA-N	444.473	1.251	50	20	IDGD	
Cn1nc(SCC(=O)NN=C2C[C@@H](OCc3ccccc3)C2(C)C)c(=O)n(C)c1=O	776763879	RCDRUQOWDCRJSP-OAHLLOKOSA-N	431.518	1.059	50	20	IDGD	
COC(=O)[C@H](NCC(=O)NNC(=O)c1cccs1)c1ccc(Br)cc1	777614066	YDXHGLWYYFCVRO-CQSZACIVSA-N	426.292	1.776	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)c2ccc(S(=O)(=O)NC(C)(C)C)o2)nc1C	778429194	PXYQIZJFRBKYFG-UHFFFAOYSA-N	425.467	1.388	50	20	IDGD	
COCC(=O)N1CCc2cc(NC(=O)C(=O)NNC(=O)c3cc4c(s3)CCC4)ccc21	778708067	UDLRORJSQSDDKR-UHFFFAOYSA-N	442.497	1.172	50	20	IDGD	
C[C@@H](NC(=O)CC(C)(C)C)C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	778941213	PIPNKELXDLJGOM-CQSZACIVSA-N	426.539	1.092	50	20	IDGD	
O=S(=O)(c1ccc(CCCl)cc1)N1CCC[C@@H](S(=O)(=O)N2CCOCC2)C1	779635845	VVFVJNKGSPWPTO-QGZVFWFLSA-N	436.983	1.283	50	20	IDGD	
CN(C)[C@H](C(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)c1cccc(Cl)c1	780102452	HGYNMJBKYYTFSC-KRWDZBQOSA-N	434.836	1.855	50	20	IDGD	
N#C[C@@H](c1ccc(F)cc1)N1CCN(CC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)CC1	780313586	WMYNWGVRTIVRKI-IBGZPJMESA-N	440.435	1.377	50	20	IDGD	
CCNC(=O)N(C)NC(=O)c1cc(S(=O)(=O)NCC(C)C)ccc1Br	780711597	MPGLINMHEQVHCM-UHFFFAOYSA-N	435.344	1.690	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)NCCNS(=O)(=O)c2ccc(Cl)s2)c1	780844529	MRSOYSZDLKYBGR-UHFFFAOYSA-N	432.911	1.793	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccccc2CCN(C)C)cc1OC	782701802	KQUQIUDVXMFRBC-UHFFFAOYSA-N	428.489	1.598	50	20	IDGD	
NC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2Cl)cc1	782925665	JOUJJXAHKWWLBN-UHFFFAOYSA-N	425.228	1.257	50	20	IDGD	
O=C(NNC(=O)C(=O)NC1CC1)C(=O)Nc1ccccc1S[C@H](Cl)C(F)(F)F	782966592	OOBPNWWLHVRHBV-AWEZNQCLSA-N	438.815	1.270	50	20	IDGD	
Cc1ccc(C)c(NNC(=O)C(=O)Nc2cc(C3CC3)nn2[C@H]2CCS(=O)(=O)C2)c1	783369018	GWEZCWVNTVPRNE-HNNXBMFYSA-N	431.518	1.819	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2cccc3c2CCCC3)n([C@H]2CCS(=O)(=O)C2)n1	783451592	QPFZRTFCBGYCMP-HNNXBMFYSA-N	431.518	1.512	50	20	IDGD	
CN1CCC[C@H](N(C)C(=O)c2ccc(NC(=O)C(=O)NNc3nccnc3Cl)cc2)C1	784781843	PAJRZFOTJITGCG-HNNXBMFYSA-N	445.911	1.378	50	20	IDGD	
CC(=O)NCc1ccc(NC(=O)C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)cc1	785099454	GESUXODLACBPDA-UHFFFAOYSA-N	445.426	1.575	50	20	IDGD	
CN(C)Cc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccccn2)cc1Br	786417653	VOYQPIBQSHYNDK-UHFFFAOYSA-N	434.294	1.234	50	20	IDGD	
CN1C[C@@H](C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)c2ccccc2C1=O	787404236	PFGHSOBLVVAVIH-QGZVFWFLSA-N	444.513	1.020	50	20	IDGD	
Cc1ccc(N2CCNC2=O)cc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccccc2)on1	787543268	HEQKQUQAHRJPOW-UHFFFAOYSA-N	448.439	1.579	50	20	IDGD	
COc1c(C)cnc(Cn2cnc(NC(=O)C(=O)NNc3cnc4ccccc4n3)n2)c1C	789745068	DYPLQWHCVOLGBZ-UHFFFAOYSA-N	447.459	1.372	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cccc(N4CCC4=O)c3)n[nH]2)cc1	790951461	FRRSNVXZKNBQJC-UHFFFAOYSA-N	432.440	1.522	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2cccc(F)c2[N+](=O)[O-])cc1S(=O)(=O)N(C)C	790999083	WGVQMKFJSXRHKU-UHFFFAOYSA-N	439.425	1.374	50	20	IDGD	
CC[C@H](C)n1ncc(NC(=O)C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)c1C	792268440	IJDKBGIHYYIBRR-LBPRGKRZSA-N	425.449	1.454	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)c1ccccc1NS(=O)(=O)C(F)(F)F	792797512	DZOJVGGJFPCSCV-UHFFFAOYSA-N	431.392	1.960	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)[C@@H]1CCCN(C(=O)c2ccncc2)C1	795169073	INFNOGMZTBRUMU-MRXNPFEDSA-N	431.518	1.327	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNC(=O)C(=O)Nc1cc(C(F)(F)F)ccn1	797369006	LOZUQAWTYAERKJ-UHFFFAOYSA-N	439.350	1.113	50	20	IDGD	
COC(=O)c1ccc(NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1OC	797674932	YSXYVBBWLQGVOA-UHFFFAOYSA-N	428.449	1.341	50	20	IDGD	
O=C(NCCNS(=O)(=O)c1ccc(F)cc1Cl)NNC(=O)c1ccccc1F	801058884	MMCBSILOHZNYNK-UHFFFAOYSA-N	432.836	1.541	50	20	IDGD	
COc1ccc(-c2nnc(S)n2CC(=O)NNC(=O)Nc2ccc3c(c2)OCO3)cc1	802096858	HYUWDEXVLYBPIX-UHFFFAOYSA-N	442.457	1.824	50	20	IDGD	
CC(C)C[C@@H](C(=O)NNC(=O)Nc1ccc2c(c1)OCO2)N1C(=O)[C@H]2CC=CC[C@H]2C1=O	802106342	BWDBNWMTMWCRDD-XHSDSOJGSA-N	442.472	1.934	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)NC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1	802334221	UXAALBCRRVEPMK-HNNXBMFYSA-N	430.486	1.844	50	20	IDGD	
Cc1ccc(C2=NO[C@@H](CNC(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)C2)cc1C	802382207	VTUDLWYNUDKLHY-MRXNPFEDSA-N	448.483	1.688	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(OC(F)F)cc2F)c1	802567134	MSVGSGRTWFDDLO-UHFFFAOYSA-N	445.375	1.230	50	20	IDGD	
NC(=O)c1ccc(/C=C\C(=O)N2CCC[C@H]2C(=O)NNc2ccc3c(=O)[nH]ccc3c2)cc1	803430889	NJBOAFSYPCOLBP-KYRNDMNFSA-N	445.479	1.775	50	20	IDGD	
C[C@H](C#N)S(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1	806458999	RZJHOVFPBBRDJY-SJKOYZFVSA-N	430.442	1.365	50	20	IDGD	
COC(=O)c1cc(CNC(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)ccc1OC	806968539	DXMFZQNHZUXPGO-UHFFFAOYSA-N	447.444	1.652	50	20	IDGD	
N#Cc1ncn(CCNC(=O)NNC(=O)COc2ccc(OCc3ccccc3)cc2)n1	807509152	RGXKAXCLMGJYAF-UHFFFAOYSA-N	435.444	1.138	50	20	IDGD	
Cn1nnc2c1C[C@@H](C(=O)NNC(=O)c1nc(-c3ccccc3)n(-c3ccccc3)n1)CC2	809981628	RGHORXBQMHJDLD-INIZCTEOSA-N	442.483	1.629	50	20	IDGD	
O=C(COC(=O)[C@H](O)c1ccc(Cl)cc1F)NNC(=O)c1cccc([N+](=O)[O-])c1	811370848	RVIBKXYLUJJADD-OAHLLOKOSA-N	425.756	1.425	50	20	IDGD	
CN(NC(=O)c1cc(CN2CCCC2)on1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	812547355	KGPFQRWIGSDFEQ-UHFFFAOYSA-N	436.513	1.520	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)[C@@H]1OCCc2sccc21	813866260	NFXPUWPHKWETKX-GTNSWQLSSA-N	427.486	1.642	50	20	IDGD	
C[C@H]1CN(c2ccc(Cl)c(F)c2)CCN1C(=O)NNC(=O)CNC(=O)c1ccco1	814295487	VMXMAKBUZPXIPM-LBPRGKRZSA-N	437.859	1.753	50	20	IDGD	
CC(=NNC(=O)Nc1ccc(S(N)(=O)=O)cc1)c1cccc(S(=O)(=O)N(C)C)c1	814967974	IQQYAFKAIJQNSV-UHFFFAOYSA-N	439.519	1.130	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1)C1CC1	815564916	XCRLGDUNXXLPEO-LJQANCHMSA-N	438.440	1.128	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)CNC(=O)c2ccc(F)cc2F)C1	816509770	BSZLHNQYBWHVJY-LBPRGKRZSA-N	440.447	1.489	50	20	IDGD	
CCOC(=O)c1c[nH]nc1S(=O)(=O)NNC(=O)c1sc(-c2ccccc2)nc1C	818788915	VBPATRJGTCWTME-UHFFFAOYSA-N	435.487	1.642	50	20	IDGD	
CS(=O)(=O)CC[C@H](NS(=O)(=O)c1ccccc1)C(=O)NNc1cccc(Cl)c1	849928975	LGJDCIHPXKKOBI-INIZCTEOSA-N	445.950	1.565	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CC(=O)N(c2cccc(Br)c2)C1)c1ccc2c(c1)OCO2	913632796	XLZARXRAEBSGEF-GFCCVEGCSA-N	446.257	1.992	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@@H](C)c2nc3ccccc3[nH]2)cc1	915926538	DVZXTHQHGAAKCF-AWEZNQCLSA-N	444.517	1.583	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNS(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1	916108695	NXUQIUBIRLNEAL-UHFFFAOYSA-N	448.486	1.639	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cccc(N3CCOC3=O)c2)cc1	916112253	FRRJUKIVTQGKDJ-UHFFFAOYSA-N	446.485	1.033	50	20	IDGD	
CNS(=O)(=O)c1ccc(CNC(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)s1	916232826	MDJBRPFPNFOUGZ-SNVBAGLBSA-N	430.483	1.093	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCC(C)(C)N2C[C@H](C)O[C@@H](C)C2)nc1	916234443	GCMUFDKFCJSQHY-GJZGRUSLSA-N	442.586	1.282	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCc2ccnc(N3CCCC3)c2)nc1	916254954	YFLYRJSBUFSJHM-UHFFFAOYSA-N	447.565	1.934	50	20	IDGD	
O=C(NCCNC(=O)c1ccc(Cl)cc1)NNC(=O)c1nnc(O)c2ccccc12	916262887	VBMYXADPVNDSGZ-UHFFFAOYSA-N	428.836	1.363	50	20	IDGD	
COc1cc(OC)cc(C(=O)NN=C(C)c2ccc(S(=O)(=O)N3CCNCC3)cc2)c1	916314854	ZAFKFNBZHIAELR-UHFFFAOYSA-N	446.529	1.452	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)NC1CCC2(CC1)OCCO2	916412957	WNEWUDXQDFRHEL-UHFFFAOYSA-N	428.283	1.844	50	20	IDGD	
C[C@@H]1CCCC[C@@H]1OCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	916514334	MMJPAUZYANSYHK-PBHICJAKSA-N	426.539	1.476	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)NCc3cc[nH]n3)c2)cc1	916637603	WIVCCTNFGYWUCW-UHFFFAOYSA-N	444.473	1.363	50	20	IDGD	
CCCN(C(=O)[C@H](C)OC(=O)/C(C#N)=C\c1ccc(OC)cc1)[C@H]1CCS(=O)(=O)C1	916726443	CYLLEBVULHQBLV-SCCVEGEBSA-N	434.514	1.960	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNS(=O)(=O)c1ccc(CCCl)cc1	917723738	LFDFJKNSGPZWTF-UHFFFAOYSA-N	444.966	1.693	50	20	IDGD	
CCOc1ccccc1CNC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	919779058	SFWBMQGVEWSELD-UHFFFAOYSA-N	448.549	1.243	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)NCCNS(=O)(=O)c1cccc(Cl)c1	919902091	XHKINOUMEKWGBG-UHFFFAOYSA-N	440.909	1.200	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2cccc(CN3CCCC3)c2)ccc1Cl	920082166	NVEXVGUVIVJWEM-UHFFFAOYSA-N	436.921	1.658	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)c2cccc(NC(=O)CCn3ccnc3)c2)nc2ccccc21	920092942	IAHCXMMCKKGTQG-UHFFFAOYSA-N	445.483	1.802	50	20	IDGD	
CC(C)CO[C@H](C)C(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	920805940	VUTNQUUGNXIWKC-MRXNPFEDSA-N	433.530	1.987	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)[C@H]1COc2ccccc2O1)c1cccc(N2CCOC2=O)c1	920966281	JMRFHLNVCHJDFR-SCLBCKFNSA-N	426.429	1.875	50	20	IDGD	
CNC(=O)COc1cccc(CC(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)c1	1116322571	IEPLPMKWGMVSGR-UHFFFAOYSA-N	448.520	1.148	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)Nc2ccccc2S(C)(=O)=O)CC1	1116562008	TUYULCRSPSGWSH-UHFFFAOYSA-N	440.522	1.890	50	20	IDGD	
COc1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2ccccc2Cl)cc1OC	1317829818	QJZMJRMTHGGMOC-UHFFFAOYSA-N	427.866	1.097	50	20	IDGD	
Nc1cnnc(NNC(=O)CN2C(=O)c3ccc(Br)cc3C2=O)c1Cl	1319425642	USOHWNDZFICRCR-UHFFFAOYSA-N	425.630	1.214	50	20	IDGD	
COc1ccc2[nH]c(C)c(C(=O)OCC(=O)NNC(=O)[C@H]3COc4ccccc4O3)c2c1	1334627778	NPMHARZCXOXBTM-GOSISDBHSA-N	439.424	1.629	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)Nc2nccs2)C1	1778074168	ULUOFRHHKZNKPH-NRTGNBEESA-N	444.985	1.711	50	20	IDGD	
CC/C=C(\C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C1	1778094399	IMNAOKYPYPYXPN-JNPFCBEJSA-N	443.548	1.991	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(CCN(C(=O)c3n[nH]c4c(F)cccc34)C2)C1	1778633526	YRIPGCZHZLWXAD-SFHVURJKSA-N	439.285	1.931	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(C1)CN(C(=O)c1sccc1Cl)CCO2	1779032413	JHLVLGPMJBHXNM-LJQANCHMSA-N	449.920	1.157	50	20	IDGD	
Cc1nc[nH]c1CSCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2	1779287043	LJCLZDAWFQJQCK-GPMSIDNRSA-N	444.985	1.065	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@@]2(C1)CN(C(=O)C1(F)CN(C(=O)OC(C)(C)C)C1)CCO2	1781224355	VLBKCUHUNYJPIR-AUUYWEPGSA-N	447.935	1.793	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)Cc3cnc4ccccn34)CCO2)C1	1781225492	KSFUFVPGWKXCKO-PMACEKPBSA-N	439.343	1.943	50	20	IDGD	
O=C([C@@H]1Cc2ccccc2N1)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781332637	CFYPLHPMSJTXEN-MPGHIAIKSA-N	426.286	1.544	50	20	IDGD	
CC(C)(C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1)c1ccccn1	1781333889	HDEZPAVMXCWZCS-KSSFIOAISA-N	428.302	1.880	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3c(F)cc(OC)cc3F)C2)C1	1781709764	LACUINNGLDZUDJ-ORAYPTAESA-N	432.851	1.671	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CCC(=O)NN(C)C)C2)cc1F	1782212374	YGGADUCPXDBPEC-AUSIDOKSSA-N	448.539	1.635	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](C)N1C[C@H]3C[C@H]3C1)CCO2	1783349382	LGSJQWXKEITORX-CLLBMXBRSA-N	428.371	1.330	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)C[C@@H]3OCCc4ccccc43)CCO2)C1	1783871530	SSIUQZHWLVXGPQ-CNNODRBYSA-N	436.936	1.774	50	20	IDGD	
C#CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCO[C@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783952075	MLGJEDXCZRIASI-DJJJIMSYSA-N	448.347	1.537	50	20	IDGD	
C[C@H](NC(=O)c1ccccc1)C(=O)N1CCO[C@@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783952644	UTMIFAMJOSFYEF-ORAYPTAESA-N	428.316	1.439	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCN3CCCCC3)C[C@@H]21	1783968606	YFLVURYXGLLLAV-XSLAGTTESA-N	444.414	1.873	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCN3CCCCC3)[C@H]2C1	1786579864	XGEZTTXWFFMYAU-QZWWFDLISA-N	430.387	1.626	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1)c1ccc(=O)oc1	1787586649	UGYJGPAEPSWSHO-UHFFFAOYSA-N	432.241	1.381	50	20	IDGD	
CSCC[C@@H](O)C(=O)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1	1788149357	LNQYAMGXPGVASZ-LJQANCHMSA-N	442.346	1.228	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(C)nc3O)[C@H]2C1	1789311855	LZMCSGXOFAOVRG-TUUVXOQKSA-N	440.338	1.862	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cc(C)[nH]n3)C[C@@H]21	1790960935	UMBIWDNXQNKSAK-TUUVXOQKSA-N	427.343	1.414	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3(C(=O)OC)CC3)C[C@@H]21	1790963683	GQNOEJYZJRSHOH-FQUUOJAGSA-N	431.327	1.093	50	20	IDGD	
C[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]21)c1cccs1	1791555898	PFBMETRTDQLKPQ-QAETUUGQSA-N	436.578	1.204	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1ccc(C2(NC(=O)C[C@](C)(O)CC(=O)O)CCC2)cc1	1791602553	MTMSSVIEWHOYEH-NRFANRHFSA-N	448.520	1.109	50	20	IDGD	
CC(C)n1nccc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)CBr	1792870302	BOUNWPXBYJXGAN-HGTKMLMNSA-N	427.343	1.698	50	20	IDGD	
Cc1cc(C)n(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)CBr)n1	1792871862	AVWNTSFFGMUZIP-GMLZMKKNSA-N	441.370	1.511	50	20	IDGD	
CS(=O)(=O)Cc1ncccc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C(Cl)Cl)C2	1794724871	QNCZKHLIORDCJT-ZSBIGDGJSA-N	434.345	1.682	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccnc(OC)c1F	1795911354	LNMYKGZEZPKXSL-WJNVRWDZSA-N	444.301	1.606	50	20	IDGD	
CCOc1c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](Cl)COC)C3)cnc2c1cnn2C	1796538636	RCNWLEQCWGBRNE-UMPJEAMMSA-N	449.939	1.873	50	20	IDGD	
CC(C)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)COc1cc(Cl)ccn1	1797902227	VAYNCFFYAJOXMG-FVCICTRLSA-N	430.332	1.968	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(=O)nc2sccn12	1799096633	SBRCJTDWUABUGG-YFKTTZPYSA-N	439.335	1.791	50	20	IDGD	
COc1ccc(OCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Br)cc1	1799343116	NWGBYILNSUWSGR-CZAMWMTLSA-N	445.285	1.354	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2nn[nH]c2c1	1800144799	XSHUTXWZUGIPJF-OQMKEHIESA-N	436.310	1.335	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)COc2ccc(O)cc2)[C@@H]1c1cccnc1)[C@H](O)CCl	1803136559	CVAQCZFZBHRXBG-QKYXUNIQSA-N	433.892	1.472	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC2(CCN(C(=O)[C@H]3CCC(=O)NC3)CC2)C1	1805382405	FMHGEPSSJSUAQV-CABCVRRESA-N	428.371	1.775	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)Cc2ccccc2)[C@@H]1c1cccnc1	1806519407	CHUOBVHBGRXHDQ-YKSBVNFPSA-N	437.544	1.703	50	20	IDGD	
Cc1ccc(CC(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)o1	1807368484	UINYVENRWMDMLH-AUSIDOKSSA-N	447.300	1.225	50	20	IDGD	
O=C(Cc1ccsc1)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1807559770	PNFSQNLNCZUSJF-SIKLNZKXSA-N	449.341	1.385	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)c2cnoc2)[C@@H]1c1cccnc1	1808417584	NCNCMAMXIFCSAN-RUVVGEKZSA-N	449.471	1.523	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCC2(CCCN(C(=O)c3cc4n(n3)CCNC4=O)C2)CC1	1808816416	PRBBVPLLCZVASG-OAHLLOKOSA-N	435.956	1.879	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)c1cnc2snnc2c1	1811342569	NEJORTNJPJNRFB-VBNZEHGJSA-N	446.920	1.401	50	20	IDGD	
COC(=O)C1(C(=O)NC[C@@H]2CCN(C(=O)[C@H](C)Br)[C@H]2c2cccnc2)CC1	1812690284	OOUGJYFJKGIXNA-QEJZJMRPSA-N	438.322	1.824	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)Cc3ccc(F)cn3)sc2C1	1815506825	LXIXBTWFTSNPMF-AWEZNQCLSA-N	448.524	1.205	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)Cc2ccccc2)n[nH]1	1816891765	VHAVINZMMCJLFW-LJQANCHMSA-N	447.499	1.957	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CN2CCNC2=N)n[nH]1	1817299081	WWXABZHQPNTHPK-YPMHNXCESA-N	440.346	1.415	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1)c1cnc2c(c1)CCNCC2	1821698771	OIFCVEAUCSLHII-ZWKOTPCHSA-N	446.939	1.399	50	20	IDGD	
Cc1ccc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2cccc(B(O)O)c2)CC3)cc1C	1822149928	PNULFEULNSSJBT-GOSISDBHSA-N	449.341	1.979	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)Cn2cc([N+](=O)[O-])cn2)[nH]n1	1822367378	MVIXYFFXFYBSTP-GXTWGEPZSA-N	439.860	1.461	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](Cl)COC)n[nH]1	1822371075	RDANAKZWAZNXKD-MBNYWOFBSA-N	428.921	1.363	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H]2C[C@@]2(F)Cl)[nH]n1	1822416973	UFZIYBAHUKMMFO-YNKQFZHNSA-N	428.896	1.699	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc(=O)n3[nH]cnc3n2)[nH]n1)C(Cl)Cl	1822417575	ARPIEKGOLKUUMI-SNVBAGLBSA-N	439.263	1.250	50	20	IDGD	
CC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](C)NS(=O)(=O)CC)CC2	1822840338	YUABUCNCZKOGLC-MXWKQRLJSA-N	436.987	1.400	50	20	IDGD	
CN(C)C(=O)NCC(=O)N[C@H]1CCc2nc(NC(=O)[C@@](C)(Cl)CCl)sc2C1	1822858039	TWYXJXUBKLYPII-FVMDXXJSSA-N	436.365	1.563	50	20	IDGD	
O=C(Cc1cnccn1)N[C@@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1	1822998259	BAKKLXOJPDDDDX-OQPBUACISA-N	428.287	1.778	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](O)CCl)CC2)c1ccccc1-n1nccn1	1823546203	FLTWBBIYAAMHRR-XHDPSFHLSA-N	446.920	1.549	50	20	IDGD	
O=C1Cc2cccc(C(=O)Nc3nc4c(s3)C[C@H](NC(=O)[C@H](O)CCl)CC4)c2N1	1824198856	NJJXDAHWCFFIHP-ZWNOBZJWSA-N	434.905	1.463	50	20	IDGD	
O=C([C@H](O)CCl)N1CCC([C@H]2CCCCN2C(=O)C(F)(F)C(F)(F)C(=O)O)CC1	1824865613	GUHKOWDNCGTWKU-VXGBXAGGSA-N	446.825	1.561	50	20	IDGD	
CCOc1ncccc1C(=O)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1829545516	QDRFWGCLFIYLJL-GOSISDBHSA-N	432.304	1.354	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)n(C(F)F)n1	1830364370	HJZAGOCSMGOVMS-IBGZPJMESA-N	448.898	1.922	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830366233	LJTMNSWRLCKYQH-KUHUBIRLSA-N	434.917	1.269	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3c(F)c(C)nn3C)C2)C1	1831643842	IGINSEZQVYKTRV-IFXJQAMLSA-N	430.908	1.345	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CN2CCCCC2=O)CC1	1831768521	NIXPKCODESEGHN-MSOLQXFVSA-N	427.973	1.872	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H](O)CCl)CC1	1831814249	XYKXOUKLECVLAD-RDGPPVDQSA-N	440.968	1.961	50	20	IDGD	
O=C(c1cnc(-c2ccccn2)nc1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1833292182	WURYRDPGRQGMPG-OXQOHEQNSA-N	449.870	1.143	50	20	IDGD	
C[C@H](Cc1ccncc1)C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)CCl)CC2)CC1	1833312552	WYHRBCVICFJZJX-OXQOHEQNSA-N	436.984	1.432	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)[C@@H]1CCCCC1(F)F	1833548388	GELLRBGFCPWMEI-DLBZAZTESA-N	435.943	1.983	50	20	IDGD	
Cc1ccsc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)Br)C2)C1	1833948567	QSOCNDUYPQWUGT-DYVFJYSZSA-N	431.352	1.910	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)CC(C)(C)O)CC2)CC1	1834575329	FWQWGYRASYTYOH-INIZCTEOSA-N	432.403	1.893	50	20	IDGD	
O=C(c1cnoc1C1CC1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1834617410	PSQWUTPMDNKYGZ-PBHICJAKSA-N	446.273	1.313	50	20	IDGD	
CC(C)NCCC(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)Br)CC2)CC1	1834782750	ANUVFBOLRNMSJO-OAHLLOKOSA-N	431.419	1.730	50	20	IDGD	
O=C(Cc1ccccn1)NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1	1834890378	HCJPBKQNOMRCFZ-SFHVURJKSA-N	441.345	1.886	50	20	IDGD	
O=C(c1cc(O)ncn1)N1CCC(OC2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1836940603	IXFNKLCPMYHNCO-OAHLLOKOSA-N	445.289	1.485	50	20	IDGD	
Cc1cc(/C=C/C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)no1	1837558597	RISKQGXWLXQFHY-MRSWZFEJSA-N	442.310	1.236	50	20	IDGD	
O=C(c1cc(-c2cccnc2)[nH]n1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1838027859	RKEABFCUUJGDLQ-QFBILLFUSA-N	437.859	1.076	50	20	IDGD	
CSc1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)c1O	1838565617	CCISLRMGZVGEJO-SFHVURJKSA-N	449.356	1.988	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C=C3\C(=O)Nc4ccccc43)C2)C1	1839145296	CKIGTWXLDXJGBO-LTCHYWQDSA-N	447.919	1.496	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)c(O)c1	1839203444	LMEDHIBYRREROM-MAUKXSAKSA-N	445.285	1.461	50	20	IDGD	
CC(C)=NO[C@@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1	1839227097	JLOGTAAWYONTHA-LPHOPBHVSA-N	429.590	1.095	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)ccc1O	1839310252	FPLABBSEURCVHD-QAPCUYQASA-N	445.285	1.461	50	20	IDGD	
CC(=O)Nc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)ccc1C	1839402959	SRRZQLFZPOLPLJ-XLIONFOSSA-N	441.887	1.558	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](OC)c3ccccc3)C2)C1	1840151712	MCTFFALBTVNDFJ-UEXGIBASSA-N	440.924	1.084	50	20	IDGD	
O=C(c1cnnc2ccccc12)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840187759	VDEPRQLFBXPDKX-IBGZPJMESA-N	439.299	1.504	50	20	IDGD	
COc1nc(C)ccc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840188932	LYQBELVXBRKLRF-SFHVURJKSA-N	432.304	1.272	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCCC12CN(C(=O)Cn1ccnc1)C2	1841924332	ZBXYQJOFVIRYQC-AWEZNQCLSA-N	425.917	1.219	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2cn(C)nc2C(F)F)C1	1843575643	LALBWEQZSQESTK-WYMPLXKRSA-N	447.446	1.309	50	20	IDGD	
Cn1c(=O)c(C(=O)N2CCCC23CN(C(=O)[C@@H](F)Br)C3)nc2ccccc21	1843744315	MGCYJDJUZTUTRD-CQSZACIVSA-N	437.269	1.441	50	20	IDGD	
O=C1CCc2ccc(C(=O)N3CC4(CCCN4C(=O)[C@@H](F)Br)C3)nc2N1	1845217163	ITETUCCCIKTGHW-CYBMUJFWSA-N	425.258	1.474	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)c2ccc(OC(F)(F)F)cc2)C1	1845316633	IQTGKNHSBMQTFK-UHFFFAOYSA-N	448.206	1.396	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](O)CCl)C[C@H]2C[C@H]21	1847558213	JESFOQQMYHZWSY-JOWFITRBSA-N	427.929	1.186	50	20	IDGD	
COc1ccc(N2C[C@@H](C(=O)NNC(=O)c3c(C)nc4ccccn34)CC2=O)c(OC)c1	17580757	WOSDZJFJXBPQFY-AWEZNQCLSA-N	437.456	1.474	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)CN(C)C(=O)c2cccs2)c2ccccc2c1=O	105970795	PRJAHDNKYWIOJT-UHFFFAOYSA-N	427.486	1.401	50	20	IDGD	
Cc1nc(S(=O)(=O)N2CCC(C(=O)NNc3ccc(F)c(F)c3F)CC2)cn1C	110959129	ZRDASQGNMWDIPF-UHFFFAOYSA-N	431.440	1.690	50	20	IDGD	
O=C(CN1C(=O)COc2cc(Br)ccc21)NNc1nc(-c2ccncc2)no1	726376840	GMRLUQPMVRWWRK-UHFFFAOYSA-N	445.233	1.763	50	20	IDGD	
CC(=O)N[C@@H](CC(=O)NNC(=O)C(=O)Nc1ccc(C)c(C)c1)c1c(F)cccc1F	727493003	FSJJSJGXWMOUIN-KRWDZBQOSA-N	432.427	1.935	50	20	IDGD	
C[C@H](C#N)Oc1ccc(C=NNC(=O)C(=O)NN=Cc2ccc(O[C@H](C)C#N)cc2)cc1	727683255	DRYHDKJKBLZQPC-HZPDHXFCSA-N	432.440	1.869	50	20	IDGD	
Cn1cc(S(=O)(=O)N2CCCCC2)cc1C(=O)NNC(=O)CCCc1ccccc1	727717520	YNBGRRXANDJNKC-UHFFFAOYSA-N	432.546	1.984	50	20	IDGD	
CCOc1cn(-c2ccccc2)nc1C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	728464865	YPJYZMQCVTUYTI-UHFFFAOYSA-N	428.470	1.749	50	20	IDGD	
COC(=O)COc1ccc(S(=O)(=O)NNC(=O)c2cccc(OC(F)F)c2)cc1	728510493	KMPIVMURMRWUHO-UHFFFAOYSA-N	430.385	1.463	50	20	IDGD	
CCOC(=O)C[C@@H](NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)c1ccccc1	728961837	RQLVJGNQRPHXDH-GOSISDBHSA-N	440.504	1.718	50	20	IDGD	
O=C(COC(=O)Cc1ccccc1C(F)(F)F)NNC(=O)[C@@H]1COc2ccccc2O1	729763927	XMCJJYIHBGGFGS-INIZCTEOSA-N	438.358	1.779	50	20	IDGD	
C[C@H](NS(=O)(=O)c1ccc(Cl)cc1)C(=O)NNC(=O)CCc1ccccc1O	730034473	VFOGYOCRLAYDTR-LBPRGKRZSA-N	425.894	1.493	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2csc(-c3ccoc3)n2)cc1	730998019	GWNMFVNYNGSUBK-UHFFFAOYSA-N	434.499	1.793	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)Cc1ccc(S(=O)(=O)N2CCCCC2)cc1	731493161	SNEHNTSYKMBSFA-UHFFFAOYSA-N	431.514	1.874	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)c1ccc2c(c1)S(=O)(=O)N(C1CC1)C2=O)c1ccccc1	731997098	ROXDLRUPUXHLEW-MRXNPFEDSA-N	427.482	1.948	50	20	IDGD	
O=C(NNC(=O)C1CCC1)c1cc(S(=O)(=O)N2CCOCC2)c(Cl)cc1Cl	732142616	ZZZMSOZPYMIOSB-UHFFFAOYSA-N	436.317	1.575	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1cnn(-c2ccccc2)c1)c1cccc(S(N)(=O)=O)c1	733335068	HTXWWLQOCBUWCB-ZDUSSCGKSA-N	428.474	1.225	50	20	IDGD	
COCCN(CC(=O)NNC(=O)c1cc(Cl)ccc1OC)Cc1ccc2c(c1)OCO2	734151546	JQONYXRMCXXETE-UHFFFAOYSA-N	449.891	1.987	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)c1cccc(I)c1	734239242	JNYVEZLBHDWNMB-UHFFFAOYSA-N	448.261	1.760	50	20	IDGD	
COc1ccc(C=NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)c(OCC(=O)O)c1	734363601	MORSFKAAPIXKMM-UHFFFAOYSA-N	441.849	1.223	50	20	IDGD	
CCCn1nc(C(=O)NNS(=O)(=O)c2ccc([N+](=O)[O-])c(C)c2)c2ccccc2c1=O	734420164	YBTBHDLRDCSGEQ-UHFFFAOYSA-N	445.457	1.646	50	20	IDGD	
O=C(NCCn1cncn1)NNc1ccc(S(=O)(=O)NC2CCCCCCC2)cn1	735580563	RQVQEPWHNHDCPY-UHFFFAOYSA-N	436.542	1.391	50	20	IDGD	
COc1ccc(C(=O)N2CCC(NC(=O)NNC(=O)c3ccccc3)CC2)cc1OC	735761830	ZIJSHOVCUWHVFD-UHFFFAOYSA-N	426.473	1.953	50	20	IDGD	
Cc1cc(NNC(=O)CCNS(=O)(=O)c2ccc(OC(F)(F)F)cc2)nc(C)n1	736716637	RDFHHRSEWKKKDE-UHFFFAOYSA-N	433.412	1.804	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)[C@@H]1CSCN1C(=O)c1ccc(C(C)(C)C)cc1	740853182	XHTVWUYXQVSRTC-KRWDZBQOSA-N	448.589	1.951	50	20	IDGD	
CC(C)(NS(C)(=O)=O)C(=O)NNC(=O)COc1ccc(OCc2ccccc2)cc1	742033843	SCTGEPMZADNTDG-UHFFFAOYSA-N	435.502	1.120	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)NCc2cccc(C(F)(F)F)c2)ccc1F	742453418	UUUNLTPQNHVWRC-UHFFFAOYSA-N	434.371	1.636	50	20	IDGD	
C[C@H](CN1CCOCC1)C(=O)NN=Cc1ccc(OCC(=O)O)c(Br)c1	743431633	YCIAKFKRBWSTKP-GFCCVEGCSA-N	428.283	1.331	50	20	IDGD	
O=C(CCCCC/N=C1/NS(=O)(=O)c2ccccc21)NNc1ncnc2[nH]cnc12	743471783	WBXIRLRXNAEFQD-UHFFFAOYSA-N	428.478	1.095	50	20	IDGD	
O=C(NNC(=O)N[C@H]1CCN(CC(F)(F)F)C1=O)Nc1ccc(OC(F)F)cc1	743627203	WAQVKPVARZOAFG-JTQLQIEISA-N	425.314	1.787	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)CCc2c(C)nc3c(C#N)cnn3c2C)c1	744705110	JCMPTUASAFMHKU-UHFFFAOYSA-N	434.456	1.463	50	20	IDGD	
CO[C@@H](CNC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)c1ccc(Cl)cc1	745864115	WMGVQLDPLDYJIW-INIZCTEOSA-N	429.864	1.919	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)CC[S@](=O)c1ccc2c(c1)OCCO2	746102354	AHOZAHKBZGEBQN-PMERELPUSA-N	428.470	1.373	50	20	IDGD	
Cc1cc(=O)c(C(=O)NNC(=O)Cc2cn3ccccc3n2)nn1-c1ccccc1[N+](=O)[O-]	746544955	CDYVPTAEJKXESN-UHFFFAOYSA-N	447.411	1.101	50	20	IDGD	
Cc1c(C(=O)NNC(=O)Cc2cn3ccccc3n2)nnn1-c1ccc2ncccc2c1	746545142	HOHTXOVYTLKWBI-UHFFFAOYSA-N	426.440	1.775	50	20	IDGD	
Cc1cc(CN2C(=O)c3ccccc3C2=O)cc(C(=O)NNC(=O)Cc2ccncc2)c1O	747326585	OZZCMMGCQGRAIH-UHFFFAOYSA-N	444.447	1.896	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)c2cc(N3CCNC3=O)ccc2Cl)cc1	747717656	WEPYIMLHAFGZOV-UHFFFAOYSA-N	430.848	1.796	50	20	IDGD	
CCOc1ccc(CN2C(=O)c3ccccc3C2=O)cc1C(=O)NNc1nccn(C)c1=O	747942437	VQLDTWSRJOYJQT-UHFFFAOYSA-N	447.451	1.732	50	20	IDGD	
Cc1nn(Cc2ccc(Cl)cc2)c(C)c1C(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1	748702173	FOARPEUMIOJPBZ-HNNXBMFYSA-N	439.925	1.333	50	20	IDGD	
Cc1ccc(-n2cnnc2SCC(=O)NNC(=O)CNC(=O)c2ccco2)cc1C	751204214	GBSOFWPZJXVADN-UHFFFAOYSA-N	428.474	1.147	50	20	IDGD	
Cc1c(C(=O)NNC(=O)CNC(=O)c2ccco2)cnn1-c1cccc(C(F)(F)F)c1	751205180	YHXLWLGXALGPSU-UHFFFAOYSA-N	435.362	1.984	50	20	IDGD	
O=C(CCc1nc(-c2ccc(Cl)cc2)no1)NNC(=O)CNC(=O)c1cccs1	751208479	FDOPTSDYRNZCGN-UHFFFAOYSA-N	433.877	1.962	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NN/C=C1\C(=O)N(c2ccccn2)C(=O)c2ccccc21	751259021	FKEAJQZQDCBUJT-VBKFSLOCSA-N	447.476	1.722	50	20	IDGD	
COC(=O)C[C@H](NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)c1ccc(Cl)cc1	752000068	PNQIYKNFAGDMQQ-INIZCTEOSA-N	443.851	1.564	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)n1	752860492	PVLJLEPEMXREEN-UHFFFAOYSA-N	447.473	1.507	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N[C@H](C)C[S@@](C)=O)cc1	753149695	BXHBFYGABPRFMJ-SRDFDJSUSA-N	443.529	1.224	50	20	IDGD	
O=C(NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)NNC(=O)c1cccc2cccnc12	754166840	CVNDQNVZERYLJS-UHFFFAOYSA-N	443.441	1.561	50	20	IDGD	
Cc1ccccc1-n1c(C)cc(/C=C(\C#N)C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)c1C	754753608	GJEJGTZBYNCCTK-WAKXPGHKSA-N	440.525	1.892	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)N[C@@H]1CCN(c2c(F)cccc2F)C1=O	755086213	OCIFRMJWZNQSLL-CQSZACIVSA-N	434.399	1.488	50	20	IDGD	
O=C(CC12CC3CC(CC(C3)C1)C2)NNC(=O)NCCN1C(=O)[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O	755254923	DRRFMADQNYFJBH-SFAQPYHFSA-N	440.544	1.730	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)Nc2cccc(S(=O)(=O)N(C)C)c2)cc1	755368509	YGDJFEVAEDKAEV-CQSZACIVSA-N	448.501	1.760	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)N[C@@H]2CCN(c3ncccc3F)C2)cc1	756156517	SLQAOBCUFHCUNW-HUUCEWRRSA-N	431.468	1.996	50	20	IDGD	
CCc1ccc(NC(=O)NNC(=O)c2cccc(OC(F)F)c2)cc1S(N)(=O)=O	756524442	JEKFVGMQKPUVCJ-UHFFFAOYSA-N	428.417	1.964	50	20	IDGD	
CS(=O)(=O)Nc1ccc(NC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc1	756707440	PBYAHMVRZKLYRA-UHFFFAOYSA-N	430.446	1.416	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N[C@@H]2CCCC[C@H]2O)cc1	757098726	DXJPDAJFSBJKFD-WASAWGCPSA-N	437.500	1.761	50	20	IDGD	
CC[C@@H]1CN(CC(=O)NNC(=O)c2cccc(C#N)c2)CC[C@@H]1NC(=O)OC(C)(C)C	757113853	ZSZLWTNYTBYGMQ-AEFFLSMTSA-N	429.521	1.944	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cccnc2I)cc1OC	757689034	ANTOGTRMKGFALQ-UHFFFAOYSA-N	427.198	1.778	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)NCc2cnn(C)c2C)c2ccccc2c1=O	759608001	LEKWCJNDOYUQJX-UHFFFAOYSA-N	425.493	1.773	50	20	IDGD	
CCNS(=O)(=O)c1ccc(CC(=O)NNC(=O)c2cc3ccccc3cc2O)cc1	760159305	QWWFURCGUNTONV-UHFFFAOYSA-N	427.482	1.847	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)Cn1cc(I)cn1	763388952	GEDWKPSBKCXNRY-UHFFFAOYSA-N	434.621	1.611	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccnn1-c1cccc(Cl)c1	763447143	ZGNCZRHFQXXBGE-UHFFFAOYSA-N	428.792	1.834	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1ccc(Cl)c(C(=O)N(C)C)c1	763624747	NCMKPKBFBMHBBL-UHFFFAOYSA-N	442.863	1.398	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(CN3CCCCC3)c2)cc1	763662119	VNXNOZHBLRYOPI-UHFFFAOYSA-N	440.500	1.846	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2ccc(N3CCOCC3)c(C)c2)c1	763665623	ZVSLEQRPNASAEB-UHFFFAOYSA-N	440.500	1.613	50	20	IDGD	
COCCn1ccc2ccc(NC(=O)C(=O)NNC(=O)COc3ccc(C#N)cc3)cc21	763675496	XYXRDRUHJNIUPC-UHFFFAOYSA-N	435.440	1.324	50	20	IDGD	
CCc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1C	763719117	VEJTULLCZVFVGK-UHFFFAOYSA-N	432.502	1.207	50	20	IDGD	
O=C(NNC(=O)c1cccc(Cl)c1)C(=O)Nc1cccc(-c2nnnn2C2CC2)c1	763750909	RWPNJJVWBMJGQF-UHFFFAOYSA-N	425.836	1.728	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(N(C)C)c2)c(C)c1	763760413	NNEJIPWRAPDANC-UHFFFAOYSA-N	428.445	1.013	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2ccc(N3CCCC3=O)cc2)c1	763772661	OIQIMCWWVIOEEB-UHFFFAOYSA-N	426.429	1.230	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2ccc3[nH]c(C)cc3c2)c2ccccc2c1=O	763786940	ROMQVSXIJMFJOZ-UHFFFAOYSA-N	432.440	1.606	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2cnn(-c3ccccc3)c2)c2ccccc2c1=O	763787282	WKEWIVCWJZJMSD-UHFFFAOYSA-N	445.439	1.002	50	20	IDGD	
COC(=O)CCc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)cc1	763856201	DVYHBNOEAYDLJT-CYBMUJFWSA-N	431.420	1.485	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(N(C)C(C)=O)cc2)cc1	763861384	OYEUKVKZULRQIB-CQSZACIVSA-N	442.472	1.621	50	20	IDGD	
COC(=O)CCc1ccc(NC(=O)C(=O)NNC(=O)CSc2ccc(C)cc2)cc1	763896660	QKKLSCQHVFGZIM-UHFFFAOYSA-N	429.498	1.979	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cccn2C)n(-c2cccc(C(F)(F)F)c2)n1	763999126	OKPYWXKIWVYXSG-UHFFFAOYSA-N	434.378	1.938	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccccc1	764048324	XQBBAJPCKPAAMZ-MRXNPFEDSA-N	449.554	1.875	50	20	IDGD	
Cc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NNC(=O)c1cccc(Br)c1	764063569	SBTJOOYDRJRREO-UHFFFAOYSA-N	447.289	1.859	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)c1ccn(-c2ccccc2[N+](=O)[O-])n1	764095147	SUBJBEPZTWRUBM-UHFFFAOYSA-N	442.457	1.978	50	20	IDGD	
O=C(CCc1ccccc1)NNC(=O)C(=O)Nc1ccccc1S(=O)(=O)C(F)F	764184671	CHXQNJIEJSSGMA-UHFFFAOYSA-N	425.413	1.402	50	20	IDGD	
CC[C@@H](C)NS(=O)(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)CCC(C)C)c1	764202957	GKSNDNFDMDTJKN-CQSZACIVSA-N	426.539	1.427	50	20	IDGD	
CCOC(=O)c1ccn(-c2ccccc2NC(=O)C(=O)NNC(=O)c2cccc(C#N)c2)n1	764242379	POCQHGFBUSXGAT-UHFFFAOYSA-N	446.423	1.320	50	20	IDGD	
O=C(Cc1ccccn1)NNC(=O)C(=O)Nc1cc(C(=O)N2CCCCC2)ccc1Cl	764266630	HMVVSYAHHRDWEU-UHFFFAOYSA-N	443.891	1.690	50	20	IDGD	
C[C@@H]1CN(C(=O)C(=O)NNC(=O)c2cc(Br)ccc2O)c2ccccc2O1	764279757	DYQPYZPZBLBING-SNVBAGLBSA-N	434.246	1.730	50	20	IDGD	
CCNC(=O)N1CCc2ccc(NC(=O)C(=O)NNC(=O)Cc3ccccc3F)cc21	764312993	GKBXCWOCLAFGID-UHFFFAOYSA-N	427.436	1.246	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(OCCNC(=O)OC(C)(C)C)c2)o1	764371652	QJUYFHOXLULTRO-UHFFFAOYSA-N	446.460	1.891	50	20	IDGD	
CN(C)C(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)cc1	764380395	ZIAHWEFZRNSGTG-UHFFFAOYSA-N	434.399	1.075	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cc(CC(C)C)nn3C)n[nH]2)cc1	764384696	JALDSIUNAZZLSQ-UHFFFAOYSA-N	437.504	1.971	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1)C(=O)Nc1cnn(Cc2ccccc2)c1	764387632	LTJUFUVLKGMXLZ-UHFFFAOYSA-N	447.430	1.860	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)C(=O)Nc1cccnc1Br	764393645	KDFBPVRQKMBOGK-UHFFFAOYSA-N	425.264	1.428	50	20	IDGD	
CC(C)(Oc1ccc(C#N)cc1)C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	764552407	NQVKRFAWWYCCNE-UHFFFAOYSA-N	436.877	1.478	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNc2ncc(F)cn2)cc(Br)c1F	764672531	IJNZXPZAMYIKHV-UHFFFAOYSA-N	430.165	1.386	50	20	IDGD	
C[C@@](O)(CNC(=O)NNC(=O)c1csc(N2CCOCC2)n1)c1cccc(Cl)c1	765196562	UIOMVJLCWGNRPB-GOSISDBHSA-N	439.925	1.485	50	20	IDGD	
O=C(CSc1nnc(-c2cccnc2)n1Cc1ccco1)NNC(=O)N1CCOCC1	765327701	BINBPRJTHXZDKT-UHFFFAOYSA-N	443.489	1.147	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)OC(C)(C)C)cc1S(=O)(=O)NC(C)(C)C	765390347	LXMVFTWXVRTORQ-UHFFFAOYSA-N	428.511	1.566	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1ccc(Cl)cc1[N+](=O)[O-]	765734002	UDUMNKVZMMIMND-UHFFFAOYSA-N	445.863	1.467	50	20	IDGD	
CCn1cnc2c1c(=O)n(CC(=O)NN=Cc1cc(C)oc1C)c(=O)n2Cc1ccccc1	767896548	HHHFLVHECDNFHF-UHFFFAOYSA-N	448.483	1.788	50	20	IDGD	
CSCCNC(=S)NNC(=O)[C@H]1CC(=O)N(CCOc2ccccc2Cl)C1	769767900	AJPWDDGJJKYNNP-LBPRGKRZSA-N	430.983	1.426	50	20	IDGD	
Cc1cc(S(=O)(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)cc([N+](=O)[O-])c1F	771608567	VRKBUDISFJRDCI-UHFFFAOYSA-N	444.828	1.322	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNS(=O)(=O)c1cccc(C(F)(F)F)c1	771609294	ZZFHZRXASYCPTF-UHFFFAOYSA-N	435.811	1.985	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccccc1	771847314	VIBXXAMYPDLWOJ-UHVIJJLKSA-N	434.456	1.860	50	20	IDGD	
O=C(CN1CCCCCCC1)Nc1ccc(NC(=O)C(=O)NNc2ncccn2)cc1	773721718	SKYIYSFWJHSGMY-UHFFFAOYSA-N	425.493	1.763	50	20	IDGD	
COc1ccc(O)c(S(=O)(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)c1	775669469	JYQHIRPIOMLBMK-UHFFFAOYSA-N	432.458	1.315	50	20	IDGD	
CO[C@@H]1[C@@H](C)[C@H](NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)C1(C)C	776067320	QPIJVGQCDPNGLS-RRQGHBQHSA-N	426.539	1.005	50	20	IDGD	
C[C@H](NC(=O)CC(C)(C)C)C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	778292873	DSMFZSRQIXSMSK-AWEZNQCLSA-N	438.550	1.173	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)[C@H](O)[C@@H](O)c2nc3ccccc3s2)cc1OC	779489812	UUERKDMFZIODFR-QZTJIDSGSA-N	445.497	1.949	50	20	IDGD	
CCNC(=O)N(C)NC(=O)c1cc(S(=O)(=O)N(CC)CC)ccc1Br	780711305	KKTOWSIXGBNMPT-UHFFFAOYSA-N	435.344	1.786	50	20	IDGD	
COc1ccc(NNC(=O)CCc2nc3cc(S(=O)(=O)N(C)C)ccc3n2C)nc1	781536217	URVXDZUDTGHWFZ-UHFFFAOYSA-N	432.506	1.303	50	20	IDGD	
COc1ccc(C(=O)NNc2ncncc2Cl)cc1S(=O)(=O)NCc1ccccn1	782076842	IAPFELNYWVZDNO-UHFFFAOYSA-N	448.892	1.769	50	20	IDGD	
CC[C@H]1C[C@H](CC(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)CCO1	782118798	WHRZZLWOOIYENO-CVEARBPZSA-N	425.555	1.056	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)C(=O)NC2CC2)cc1OCc1cccc(Cl)c1	782968116	XWIWJOWMONVUSI-UHFFFAOYSA-N	444.875	1.592	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)C1(Cc2ccc(F)cc2)CC1	783675746	CJVOSQLUZOLWTD-UHFFFAOYSA-N	438.503	1.754	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1ccc(OC(F)(F)F)cc1	784004431	GCXZZGDNHKXYDU-UHFFFAOYSA-N	430.364	1.163	50	20	IDGD	
C[C@H]1CN(C(=O)c2ccc(NC(=O)C(=O)NNc3nccnc3Cl)cc2)C[C@H](C)O1	784778368	WWRBCQVOWMMZCJ-RYUDHWBXSA-N	432.868	1.461	50	20	IDGD	
COc1ccc(S(=O)(=O)NC2CC2)cc1NC(=O)C(=O)NNc1ncccc1Cl	784821441	SLVBSGKFNRQWKQ-UHFFFAOYSA-N	439.881	1.266	50	20	IDGD	
C[C@@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(NC(=O)C(=O)NNc3ccnc(F)c3)cc2)C1	784848678	LEJNPOFUHGVEIF-ZIAGYGMSSA-N	449.508	1.969	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)C(=O)Nc2ccccc2S(=O)(=O)C(F)F)c1	784852739	NYKJOGVCRRIWGJ-UHFFFAOYSA-N	427.385	1.551	50	20	IDGD	
Cc1cc(C(=O)N2CCC[C@@H](C)C2)ccc1NC(=O)C(=O)NNc1ccnc(N(C)C)n1	784970996	PARAUWZAVQYTIT-CQSZACIVSA-N	439.520	1.805	50	20	IDGD	
O=C(NNc1c(F)cc(C(=O)NC2CC2)cc1F)C(=O)Nc1ccc(-n2ccnn2)cc1	785100493	AZWISLJDLQAFID-UHFFFAOYSA-N	441.398	1.520	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2cccc(N3CCCS3(=O)=O)c2)cc1Cl	785120336	RSXRWIWGBALRPK-UHFFFAOYSA-N	438.893	1.970	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1ccccc1O[C@H](C)C#N	785331280	RUTUFDBCZKHPHY-GFCCVEGCSA-N	432.458	1.471	50	20	IDGD	
O=C(COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CCOCC1)NNC(=O)c1ccc(Cl)cc1	785721668	LAMFSVJLSKQEEV-DLBZAZTESA-N	449.891	1.085	50	20	IDGD	
Cc1cc(NC(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)nn1CCC#N	785862384	VZGHNEKZWIAFPS-UHFFFAOYSA-N	434.501	1.746	50	20	IDGD	
CC1=C(C(=O)NNC(=O)COc2ccc(Br)cc2)[C@H](C)n2ncnc2N1C	788260795	HJTVNVZTHTVLHE-NSHDSACASA-N	435.282	1.552	50	20	IDGD	
O=C(COC(=O)/C=C\c1ccc(I)o1)NNC(=O)c1ccccc1	788916913	OEERUENJHSKFLK-CLFYSBASSA-N	440.193	1.902	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)c2cccnc12	789811556	DTZNIQFPJOUUJJ-YWZLYKJASA-N	434.452	1.902	50	20	IDGD	
CN(CC(=O)NNC(=O)c1cc(-c2ccco2)nc2ccccc12)[C@H]1CCS(=O)(=O)C1	789939340	LADUTOJZHKABSP-AWEZNQCLSA-N	442.497	1.375	50	20	IDGD	
O=C(NNS(=O)(=O)c1cccc(S(=O)(=O)N2CCCCCC2)c1)c1ccc[nH]1	790386152	LJGCXNJGXZZQDU-UHFFFAOYSA-N	426.520	1.203	50	20	IDGD	
Cn1nc([C@H]2CCCOC2)cc1NC(=O)C(=O)NNC(=O)Cc1cccc2ccccc12	790951065	BSWDBXQQRVPTCQ-KRWDZBQOSA-N	435.484	1.796	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cc([C@@H]3CCCOC3)nn2C)cc1C	790951206	FAGTXUCHFKZLJG-OAHLLOKOSA-N	429.477	1.096	50	20	IDGD	
CCCCn1ncc(NC(=O)C(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)c1C(C)C	792287966	XJQGSQOJGJXXST-UHFFFAOYSA-N	432.437	1.820	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)Nc2ccc(S(=O)(=O)NC)cn2)cc1	792400184	KWVNJHHEMLUCIQ-GFCCVEGCSA-N	437.478	1.009	50	20	IDGD	
CC(C)c1ccccc1NC(=S)NNC(=O)[C@H](C)N1C(=O)[C@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O	792492059	PMNRIVLOGDATKR-IYYOBANKSA-N	430.530	1.679	50	20	IDGD	
C[C@H]1C(=O)CC[C@@H]1CC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	792789617	LWNOWWJOZWNVKB-NVXWUHKLSA-N	443.525	1.931	50	20	IDGD	
Cc1nc(C#N)c(N2CCC(C(=O)OCC(=O)NNC(=O)c3cccc(Cl)c3)CC2)o1	796281186	XPBKXTCYZAEZPF-UHFFFAOYSA-N	445.863	1.729	50	20	IDGD	
COc1cc(C)c(NC(=O)C(=O)NNC(=O)CNC(=O)OCc2ccccc2)cc1OC	797368992	LGMWQUUUSKSLLB-UHFFFAOYSA-N	444.444	1.025	50	20	IDGD	
COc1ccc(OC)c(C2=NO[C@H](C(=O)NNC(=O)C(=O)Nc3ccc(C)c(C)c3)C2)c1	798310637	SYKBOVVZLIAYOJ-IBGZPJMESA-N	440.456	1.600	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N(C)[C@@H](C)c2ccc(S(N)(=O)=O)cc2)c(OC)c1	799920465	GSACPASKIUBBGV-LBPRGKRZSA-N	436.490	1.399	50	20	IDGD	
COc1ccc(-n2c(C)cc(/C=C(/C#N)C(=O)NCCC(=O)NS(C)(=O)=O)c2C)cc1	800551976	GVGGUGPJZOQDJA-ATVHPVEESA-N	444.513	1.592	50	20	IDGD	
CCCN1C(=O)CC[C@@H](C(=O)NNC(=O)C(=O)Nc2ccc(C)cc2)[C@@H]1c1cncn1C	801105173	AHXHBWWUWLEQMI-VQIMIIECSA-N	440.504	1.204	50	20	IDGD	
C[C@H](NS(=O)(=O)c1cccs1)C(=O)NNC(=O)Nc1ccc(OC(F)F)cc1	802043640	KSXYWIVCYOWXBV-VIFPVBQESA-N	434.446	1.869	50	20	IDGD	
Cc1ccc2[nH]cc(C(=O)NNC(=O)CN3CCN(C(=O)c4ccccc4)CC3)c(=O)c2c1	804458513	LORNDSWQHOORQJ-UHFFFAOYSA-N	447.495	1.056	50	20	IDGD	
Cc1nc(Cl)ccc1S(=O)(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	805076317	TZRTXXKTWKRIMC-UHFFFAOYSA-N	447.945	1.841	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2ccc(S(=O)(=O)[C@@H](C)C#N)cc2)c(OC)c1	806458923	QWOCGXLMZKYHLU-LBPRGKRZSA-N	432.458	1.856	50	20	IDGD	
COCCNC(=O)[C@H](C)OC(=O)c1ccc(NC(=O)NNc2ccc(Cl)nn2)cc1	806749110	YIGQEUBVEMWGNE-NSHDSACASA-N	436.856	1.587	50	20	IDGD	
O=C(NNC(=O)c1ccncc1)C(=O)Nc1cc(C(F)(F)F)cc(Br)n1	806972417	VSYMMINAROHGGE-UHFFFAOYSA-N	432.156	1.658	50	20	IDGD	
CN(C)CCN1C(=O)C(=NNC(=O)C(=O)NCc2ccc(Cl)cc2)c2ccccc21	807979952	HQVFNEUNLOEYLN-UHFFFAOYSA-N	427.892	1.385	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)N1CCN([C@@H]2CCN(C(=O)OC(C)(C)C)C2)CC1	808769878	DONPPBYXSMOYSX-IAGOWNOFSA-N	425.574	1.195	50	20	IDGD	
CC(C)CC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)NNC(=O)c1ccc(Br)s1	809981321	HARPQLQLHSWXPO-NSHDSACASA-N	442.339	1.768	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)Nc1cnn(-c2ccc(F)cc2)c1C(F)(F)F	810322975	SISOHVBUMYCMKV-SECBINFHSA-N	449.386	1.618	50	20	IDGD	
NC(=O)c1ccc(OCC(F)F)c(NC(=O)C(=O)NNc2nccnc2C2CCC2)c1	810415969	LWCBBZHZVTZWIP-UHFFFAOYSA-N	434.403	1.569	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCC(=O)NNc2nc3ccccc3[nH]2)cc1OCC	810793184	FRNCOFPAWFPIGJ-UHFFFAOYSA-N	433.490	1.782	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)CN2C(=O)[C@@H](C)Oc3ccccc32)c2ccccc2c1=O	811904562	HBUQGTDCBDYXJN-CQSZACIVSA-N	449.467	1.382	50	20	IDGD	
COC[C@]1(CNC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)OCCc2ccccc21	811922130	LRDATLZCRXMBGO-UGKGYDQZSA-N	427.457	1.271	50	20	IDGD	
C[S@@](=O)c1ccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc1	813633546	NAEFPVOHRFMHJE-MUUNZHRXSA-N	435.527	1.283	50	20	IDGD	
CCn1cnc2c1c(=O)n(CC(=O)NN=C1CCS[C@H]1C)c(=O)n2Cc1ccccc1	814745891	JVARLRQLHZKTNB-AWEZNQCLSA-N	440.529	1.426	50	20	IDGD	
N#Cc1cc(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)ccc1Br	815564879	WCHCFHWWDULXLF-HNNXBMFYSA-N	445.229	1.247	50	20	IDGD	
Cc1cc(C)c(NC(=O)C(=O)NNC(=O)[C@@H]2CCc3nncn3C2)c(Br)c1	815693291	RSDSPIDBGUOXEG-LLVKDONJSA-N	435.282	1.006	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)C(=O)Nc2cnc3c(c2)COCC3)c1	815866204	SLONSYUZYDAPFL-UHFFFAOYSA-N	449.261	1.785	50	20	IDGD	
CC(C)NC(=O)CSc1ccccc1C(=O)NNC(=O)[C@@H]1COc2ccccc2O1	859414768	KWMDGHIGMMAJBY-KRWDZBQOSA-N	429.498	1.904	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)[C@@H]2CC(=O)N(CC(F)(F)F)C2)c2ccccc2c1=O	914750656	UBMOJEBOPGUKBU-LLVKDONJSA-N	439.394	1.149	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2cc(-c3ccccc3F)on2)ccc1Cl	914877491	XXTLJLHHVWZMLP-UHFFFAOYSA-N	438.824	1.856	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)c2cccc[n+]2[O-])c1	916095711	OEIPFIYWEWBOST-UHFFFAOYSA-N	442.453	1.204	50	20	IDGD	
Cn1ccnc1[C@@H](NC(=O)NNC(=O)COc1ccccc1[N+](=O)[O-])c1ccccc1F	916224854	VQRCJGPRQCTYKO-SFHVURJKSA-N	442.407	1.966	50	20	IDGD	
Cc1ccc([C@@H](CNC(=O)NNC(=O)COc2ccc(C)c(C)c2)N2CCOCC2)o1	916229713	WFMZGUUMWAOTOP-LJQANCHMSA-N	430.505	1.988	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cc(C(=O)NNC(=O)[C@@H](C)OC)ccc1Cl	917697663	HNDZLLMKKIVJJX-LLVKDONJSA-N	441.893	1.945	50	20	IDGD	
O=C(NNC(=O)c1sccc1S(=O)(=O)N1CCOCC1)c1ccc2ccccc2c1	918112226	XUQHUCYAGPCNHL-UHFFFAOYSA-N	445.522	1.997	50	20	IDGD	
CC[C@@H](NC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)c1ccc2c(c1)OCCO2	918129449	GGTPEMXXBMOLMO-MRXNPFEDSA-N	433.486	1.957	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)NCc2cccc(CN3CCOCC3)c2)nc2ccccc21	918224089	QFYZMHWIPDOAPR-UHFFFAOYSA-N	436.516	1.479	50	20	IDGD	
CN(C)N(C(=O)[C@@H]1CCCN(C(=O)CCOc2ccccc2)C1)[C@@H]1CCS(=O)(=O)C1	918557328	WUAKSQDVFCKKDD-QZTJIDSGSA-N	437.562	1.186	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1c[nH]c(C(=O)N2CCCC2)c1	919527213	JCGOJJKUVLKXHG-UHFFFAOYSA-N	448.863	1.531	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)NCc2cccc(NC(=O)[C@@H]3CCCO3)c2)cc1	920237337	IOVRIUREJLDWBI-IBGZPJMESA-N	437.456	1.585	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@@H]2CCCN(Cc3cccnc3)C2)cc(OC)c1OC	920253663	FBFQDVKOOKWXLY-MRXNPFEDSA-N	428.489	1.781	50	20	IDGD	
CCn1c(NNC(=O)CCCNS(=O)(=O)c2ccc(F)cc2)nc2ccccc2c1=O	920438506	VEJGBROEOXJOJU-UHFFFAOYSA-N	447.492	1.757	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)NCc3ccco3)CC2)cc1	920856380	BWVWXLVNCSATHP-UHFFFAOYSA-N	448.501	1.414	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc(Br)cc1)NNC(=O)NCc1ccco1	920889851	NNXWDBNQQWVPND-UHFFFAOYSA-N	445.295	1.241	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)c2ccccc2Cn2cncn2)CC1	1116144166	PBLTYYMTTCWQNO-UHFFFAOYSA-N	428.493	1.735	50	20	IDGD	
Cc1c(I)cccc1NC(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1	1320263370	IXQRWUYGFKDWPQ-VIFPVBQESA-N	437.259	1.187	50	20	IDGD	
O=C(NNC(=O)c1cncn1-c1ccccc1)N[C@@H]1CCCN(C(=O)N2CCCC2)C1	1323825476	VHHAXERFVPAPFA-MRXNPFEDSA-N	425.493	1.497	50	20	IDGD	
CC(C)(C)c1ccc(NNC(=O)c2ccc(S(=O)(=O)NC[C@H]3CCCO3)cc2)nn1	1328714472	LGRZJBDCDWADOV-OAHLLOKOSA-N	433.534	1.988	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnc4cc(C)ccn4c3=O)C2)C1	1777999412	ZROZLMDAIDFORU-IIBYNOLFSA-N	432.908	1.464	50	20	IDGD	
CCCC(=O)N[C@@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](Cl)COC)C2	1779519709	HSIPSXBVDLYUHH-ZFCANOHDSA-N	431.961	1.059	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@](C)(Cl)CCl)C1)n1cncn1	1780715195	MDXORIJVYYVADL-KJWYOANISA-N	432.352	1.589	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)COCCNC(=O)OC(C)(C)C)C2)C1	1781202264	ZDYGSAJKMSABBG-MGPUTAFESA-N	447.960	1.375	50	20	IDGD	
O=C(Cc1cccc([N+](=O)[O-])c1)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781324646	BHEDMOINGISWJK-WBVHZDCISA-N	444.257	1.658	50	20	IDGD	
O=C(c1c[nH]c2ncccc12)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781329882	MQFIBNVINYRLMB-CXAGYDPISA-N	425.258	1.697	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnn3ccccc13)C2	1782172747	MKMZHEZRXSOZKU-YRISNDGFSA-N	434.924	1.716	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cccc4ccnn34)C2)C1	1782228828	WYWRVFWLWMCWQJ-DNVCBOLYSA-N	435.322	1.951	50	20	IDGD	
CC(C)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cn3nnc4ccccc43)C[C@@H]21	1783846346	PMQHQMFNXWGNMQ-MPGHIAIKSA-N	433.940	1.676	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](N)c3ccccn3)C[C@@H]21	1783968680	YTXCBZUHWUWZNX-CUINURIISA-N	439.354	1.092	50	20	IDGD	
COc1nn(C)cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]2C1	1783968703	GNLPFABVEJKREM-ABHRYQDASA-N	443.342	1.053	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3c(F)cncc3F)C[C@@H]21	1783969342	GMPLAJLGBJYLHA-ASHKBJFXSA-N	446.292	1.984	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nc4ccc(F)cn4n3)C[C@@H]21	1784622030	DMZOGEHIYHCBHK-HNKHHVNMSA-N	437.903	1.869	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3cc(F)ccn3)[C@H]2C1	1785240915	IDJOGAPNDXLHMK-PYTWLRIVSA-N	442.329	1.916	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cncc(S(C)(=O)=O)c3)[C@H]2C1	1785587908	WEHJQHBCKCLKST-STECZYCISA-N	443.953	1.096	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)c1[nH]nc2ccncc12	1787341583	VYKNSYGLYXBDNK-YARBFKLUSA-N	440.273	1.242	50	20	IDGD	
C[C@H]1CCc2c(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)[C@@H](F)Br)C[C@@H]43)n[nH]c21	1787952777	WNTJLMDJVBFJCZ-LTNQRRLNSA-N	443.317	1.743	50	20	IDGD	
C=CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)[C@H]2C1	1789221924	SFIWXFZFOGIKAG-FNHZYXHNSA-N	431.445	1.690	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]3C2)cc1	1789924611	OYJQMFWMWGUMBM-TUUVXOQKSA-N	429.286	1.979	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3c(C)nc4ccccn34)C[C@@H]21	1791253839	HMGROMIRGRCVBW-QAETUUGQSA-N	434.924	1.490	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]2C1)[S@@](=O)c1ccccc1	1791295873	JXJQTICQPJNATN-BVEJICRYSA-N	447.384	1.966	50	20	IDGD	
COc1ccc(C(=O)NC2(c3ccc(NC(=O)CCC(=O)NN(C)C)cc3)CCC2)nn1	1791601092	LNHUXXMTXNMRFP-UHFFFAOYSA-N	440.504	1.606	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccn3ccnc13)C2	1792870315	CEZUNCAAXFDXTE-AYDFFVQHSA-N	435.322	1.569	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3nn(C)cc3c1)C2	1792874115	LEWGSFPEODQIRG-GMLZMKKNSA-N	449.349	1.808	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1CC(O)C1	1792894417	BAXMHMABORNMIX-FMZHINHGSA-N	431.439	1.232	50	20	IDGD	
COc1cc(F)cc(/C=C/C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](O)CCl)c1	1792982408	CRAIYTKKJHVQJJ-XPFYKSGMSA-N	426.872	1.037	50	20	IDGD	
CC(C)Oc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](O)CCl)cc1C#N	1792983390	KHVUGRCMAHBOAW-SFNKJDCFSA-N	435.908	1.148	50	20	IDGD	
COc1cc2c(O)cccc2cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](O)CCl	1792983503	KVPWOZOUVBWCQL-ZZXMYQEDSA-N	448.903	1.357	50	20	IDGD	
COc1ccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCBr)C3)cc1C	1793652102	FQBIFWYYQJJSAP-CWPLJXCYSA-N	439.350	1.921	50	20	IDGD	
Cc1nc(C)c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)s1	1798440780	RMKMYAURZKHYIU-BTTYYORXSA-N	428.518	1.324	50	20	IDGD	
C[C@@H]1C[C@@]1(C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1799158688	PRWOJHNXYOGHLQ-PQKAOMOJSA-N	443.972	1.754	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cn1cnc3ccccc31)C2	1799278468	IBFISYNRPVMHPJ-ZZXMYQEDSA-N	439.343	1.862	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c(c1)OCO3)C2	1800640681	DJYVUTXNASXASU-UMPJEAMMSA-N	439.306	1.792	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cn(C)c3ncccc13)C2	1800641978	PEPQVBXYCLYJCG-DLTLXFJOSA-N	449.349	1.950	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)Br)c1	1800763567	DEEXEZUVJPZJKS-FIUQPQMISA-N	438.322	1.632	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(CC(C)C)nn1C)C2	1800975850	VPIQWLRHSPOKKH-KPEUIFRASA-N	426.945	1.076	50	20	IDGD	
CC[C@@H](NC(N)=O)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C(C#N)=C/c1ccc(F)cc1F	1801436713	XHDBDHTXBXGQEW-HDAOGJMZSA-N	445.470	1.957	50	20	IDGD	
O=C(Cn1nnc2ccccc21)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1	1804014794	GNNYUKLWCSNKRI-CVAIRZPRSA-N	442.907	1.132	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)Cc2cccc(OC)n2)[C@H]1c1cccnc1	1804395374	HRLZBBYOFYKWTQ-PLMTUMEDSA-N	446.935	1.988	50	20	IDGD	
CC(C)CNC(=O)C(=O)N1CC[C@@H](CNC(=O)CCBr)[C@H]1c1cccnc1	1806340600	HLJDOPRDSOICLG-DOTOQJQBSA-N	439.354	1.645	50	20	IDGD	
COCCOCC(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)CBr)[C@@H]1c1cccnc1	1806753531	OKKMFTUATIHFJQ-QILLFSRXSA-N	442.354	1.781	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)Cc2cscn2)[C@@H]1c1cccnc1	1807496881	AZCXRGRBFFRANN-KKSFZXQISA-N	444.561	1.160	50	20	IDGD	
Cc1c(C(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@H]2c2cccnc2)nc2ccccn12	1809078723	ZBPYIXGZUXUYBG-QKLQHJQFSA-N	441.919	1.957	50	20	IDGD	
C[C@@H]1CCc2c(C(=O)NC[C@@H]3CCN(C(=O)[C@@H](O)CCl)[C@H]3c3cccnc3)n[nH]c21	1809250093	DPAXIHQWINHNHM-AGLNLLDASA-N	431.924	1.774	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](F)Cl)[C@H]1c1cccnc1)c1cc2n(n1)CCCNC2=O	1809678903	KMXHKTFKWMBJIN-RRQGHBQHSA-N	448.886	1.266	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)C3(F)CCCCC3)CC2)C1	1809972565	QVLODCFJPAKLLS-UHFFFAOYSA-N	430.329	1.884	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)c3cc[nH]c4nccc3-4)CC2)C1	1809978312	RFJJWYSHAYKJQI-UHFFFAOYSA-N	446.316	1.353	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC2(CCCN(C(=O)CCc3ccc[nH]3)C2)CC1	1810047008	HXXUWWPCKJIYBL-UHFFFAOYSA-N	438.532	1.491	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H](CNC(=O)C2=NNC(=O)C2)[C@H]1c1cccnc1	1810221049	FUBCJLCVXSEZQV-DWQUBVKVSA-N	426.304	1.200	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)c1ccnc2c1OCO2	1811309934	VFGIOKYONOFLRG-BPUTZDHNSA-N	432.864	1.125	50	20	IDGD	
C[C@H](C(=O)NC[C@@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1)n1ccnn1	1812397026	YDBYCEJUSRBDRQ-UKPHBRMFSA-N	435.326	1.725	50	20	IDGD	
COC(=O)C12CC(C(=O)NC[C@@H]3CCN(C(=O)[C@H](O)CCl)[C@H]3c3cccnc3)(C1)C2	1812834023	MBZIQFIBMXUDMD-LLDIDSMRSA-N	435.908	1.030	50	20	IDGD	
C=CCNC(=O)/C=C\C(=O)N1CC[C@H](CNC(=O)[C@@H](C)Br)[C@@H]1c1cccnc1	1812864508	UNPOZIRDGSUEQV-UFHUSNMYSA-N	449.349	1.729	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)[C@H](C)Cn2ccnc2)[C@H]1c1cccnc1	1813033288	LIMHXXQQKKRWOK-BVBHFADKSA-N	433.940	1.874	50	20	IDGD	
Cc1cnoc1C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1813073855	PKGWVSAYDIAXTB-APWZRJJASA-N	428.493	1.071	50	20	IDGD	
CSCC[C@H](O)C(=O)NC[C@@H]1CCN(C(=O)[C@H](C)Br)[C@@H]1c1cccnc1	1813095716	OCIAUTQNNBKCBO-QCEMKRCNSA-N	444.395	1.985	50	20	IDGD	
CC(C)C1(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)CCC1	1813665741	XXPRWXRMPMZDIV-UNMCSNQZSA-N	449.360	1.907	50	20	IDGD	
C[C@H](CBr)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H]2CCC(=O)N2)[nH]n1	1814780333	MBAAHPSAFUUWCZ-NTZNESFSSA-N	426.315	1.711	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)Cc2cnc3ccccn23)[nH]n1)[C@H](O)CCl	1814863752	BDULPYUNQNRBAZ-JKSUJKDBSA-N	430.896	1.892	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@H]1CCc2nc(NC(=O)c3cc(O)n[nH]3)sc2C1	1815203402	BGUGNRSWFIEIFP-YUMQZZPRSA-N	428.312	1.829	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H]2CCC(=O)N2)n[nH]1	1817089996	FWWAXAHEBSLCQJ-DMDPSCGWSA-N	426.315	1.854	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)C2=CCCS2)[nH]n1)c1cccc(B(O)O)c1	1817474578	VILMLMPHMGVEKR-INIZCTEOSA-N	426.307	1.416	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)Cc2ccncc2)[nH]n1	1819404108	YUAAPSCSCVIUQD-GOSISDBHSA-N	448.487	1.352	50	20	IDGD	
CC(C)O[C@H](C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1819507235	MDUGRKRQXLGUFG-DYVFJYSZSA-N	443.508	1.528	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1)c1nc2ccc(F)cn2n1	1821595182	AJADXGSEGIBLPW-OLZOCXBDSA-N	435.847	1.497	50	20	IDGD	
O=C([C@H]1Cc2ccccc2CN1)N1CCC([C@@H]2CCCCN2C(=O)[C@H](O)CCl)CC1	1824182998	NCVTXUUXGDUJRP-QHAWAJNXSA-N	433.980	1.920	50	20	IDGD	
COc1ccc(C(=O)N[C@H]2CCc3nc(NC(=O)[C@H](C)Br)sc3C2)nn1	1825642329	POFLBNBXPPDIAZ-IUCAKERBSA-N	440.323	1.951	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1nn(C)c3c1CCC3)CC2	1825999770	CLQWBZHPVLBZIB-ZYHUDNBSSA-N	437.953	1.845	50	20	IDGD	
C[C@@H](C(=O)N[C@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1)n1cccc1	1826092122	MWCWXICODIZAON-KBPBESRZSA-N	432.550	1.491	50	20	IDGD	
O=C(Cc1ccncc1)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827056370	FDAOTINZVFGHJJ-QFIPXVFZSA-N	435.333	1.237	50	20	IDGD	
O=C([C@H](O)CCl)N1CCC([C@@H]2CCCCN2C(=O)c2ccc3nc(CO)[nH]c3c2)CC1	1828097159	MSNQTGSITAYILA-RBUKOAKNSA-N	448.951	1.888	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CN2CCN(C(C)=O)CC2)CC1	1828493672	RTKKROLAMIUELL-UXHICEINSA-N	441.016	1.788	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3cc(C)no3)CCO2)C1	1832573758	PRUPFTVTKIITMK-CRAIPNDOSA-N	444.326	1.155	50	20	IDGD	
CC[C@H](C)[C@@H](O)C(=O)NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1	1833499722	SKVVEDPYYRNNCN-MAZHCROVSA-N	436.366	1.656	50	20	IDGD	
CCc1oncc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](Br)CC)C2)C1	1834522367	RIEUFTQZLUAVKG-RDTXWAMCSA-N	444.326	1.481	50	20	IDGD	
O=C(Cc1ccccn1)NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1	1834888615	CJPRTKQYESYRFX-UHFFFAOYSA-N	437.382	1.981	50	20	IDGD	
COC(=O)[C@@H]1CC[C@@H](C(=O)N2CCC(N3CCC(NC(=O)[C@@H](F)Cl)CC3)CC2)C1	1835079467	YRSZAMSELNCHLT-CKEIUWERSA-N	431.936	1.682	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CN3CCCCC3)CCO2)C1	1835378721	COTMCRWCOGSXJA-QFBILLFUSA-N	446.386	1.102	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC1CCN(C2CCN(C(=O)c3csc(N)n3)CC2)CC1	1835833581	UHOCKBSRZHESOY-UHFFFAOYSA-N	439.658	1.762	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnc(N)s3)CCO2)C1	1835846204	BAJIBYNHNLFOEN-CVEARBPZSA-N	437.349	1.032	50	20	IDGD	
O=C(c1cnnc(Cl)c1)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836714927	DMEYLCZCAJTGRE-HNNXBMFYSA-N	431.320	1.342	50	20	IDGD	
O=C(CNc1ccc(F)cc1)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836716797	QSNAQYYPWIOQFJ-LJQANCHMSA-N	441.931	1.836	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc4n(n3)CCC4)CCO2)C1	1837093751	BYDRGYKRHSOOFX-OALUTQOASA-N	445.347	1.136	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC(OC2CCN(C(=O)c3ccc(O)nn3)CC2)CC1	1837368282	LZLSZLHOMSYRRX-UHFFFAOYSA-N	436.585	1.646	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)Cc3nnc(C)o3)CC2)CC1	1837940560	YGXMVKSMONTJQT-MRXNPFEDSA-N	428.917	1.173	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)[C@H](C)n3ccnn3)CC2)CC1	1838730504	XKEBBGFLDXNAGE-KBPBESRZSA-N	442.358	1.621	50	20	IDGD	
COc1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)c1	1838929082	XPVTYNUMCCBGGP-QAPCUYQASA-N	445.285	1.456	50	20	IDGD	
C[C@H](C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2)c1ccccn1	1839156162	DEAXBADPFDRACP-YSSFQJQWSA-N	444.359	1.878	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc4[nH]c(C)cc4c3)CCO2)C1	1839616650	HHXMNMKTOKUYKT-XMSQKQJNSA-N	449.935	1.800	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)C3CCSCC3)C2)C1	1839967302	IDRKEZBNLMMWJE-YJBOKZPZSA-N	449.411	1.760	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3cccnc3)C2)C1	1840031725	ANTXEHPKXASMFB-BEFAXECRSA-N	440.338	1.254	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)n3cccc3)C2)C1	1840036354	IVVQQQBEBZDOTO-MPGHIAIKSA-N	428.327	1.289	50	20	IDGD	
CCc1cnc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](Cl)COC)CCO3)s1	1840153190	GZHAQKPEBYNTHW-KDOFPFPSSA-N	431.942	1.029	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3ccccc3F)C2)C1	1840156028	HKPAABPWRZERCT-UWJYYQICSA-N	442.915	1.469	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)/C=C/c3ccc(C)s3)C2)C1	1840156733	YIMNMSPHILBJGJ-ZARSWLQMSA-N	442.965	1.780	50	20	IDGD	
COc1ccc(Cn2cc(CC(=O)N3CC4(CCCN4C(=O)[C@@H](O)CCl)C3)cn2)cc1	1841350015	CHCYHEWXNKCOIM-IBGZPJMESA-N	446.935	1.286	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)C2(C(F)(F)F)CCC2)C1	1842846382	YROURAQYTVEXRB-UHFFFAOYSA-N	425.411	1.235	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC2(CCCN2C(=O)C(C)(C)n2nc(C)ccc2=O)C1	1844354609	BXPDPBHOJBQCIY-AWEZNQCLSA-N	439.354	1.664	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2nc3ccccc3o2)C1	1845596113	GXJMPDOKUCIQNX-AFUMVMLFSA-N	434.456	1.779	50	20	IDGD	
CCS(=O)(=O)c1ccc(CC(=O)N2CCCC23CN(C(=O)[C@@H](Cl)COC)C3)cc1	1845939721	OJWQEDXUXUABSR-KRWDZBQOSA-N	442.965	1.480	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)CCN1C(=O)c3ccccc3C1=O)C2	1846360719	BYDMNVVAYFPUMJ-MRXNPFEDSA-N	433.892	1.130	50	20	IDGD	
CC1(CC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](O)CCl)CN(C(=O)OC(C)(C)C)C1	1847568700	IVSOQRJAMFSKKJ-KKUMJFAQSA-N	429.945	1.435	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H]1CC(=O)N(Cc2ccccc2)C1	1847715660	DLDNYGUEJSQWBQ-YRXWBPOGSA-N	433.936	1.491	50	20	IDGD	
CC(=O)N(C)CCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)/C(C#N)=C/c1ccc(F)cc1F	1848021459	UJTOAWWQQCZXFG-AHJJFNAJSA-N	430.455	1.942	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CCN2C(=O)[C@H](C)Oc3ccccc32)cc(OC)c1OC	16230039	XTOBAQVPBJRLTD-ZDUSSCGKSA-N	443.456	1.678	50	20	IDGD	
O=C(COc1ccccc1-c1ccccc1)NNC(=O)CN1C(=O)[C@H]2CC=CC[C@H]2C1=O	17201849	JGYAZSPNQPKSMP-KDURUIRLSA-N	433.464	1.831	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@H](C(=O)NNC(=O)c2c(C)nc3ccccn23)C(C)C)cc1	17581245	AWPBGFMDZFVRAB-SFHVURJKSA-N	443.529	1.715	50	20	IDGD	
C[C@@H]1CC(C)(C)C[C@]2(C1)NC(=O)N(CC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)C2=O	21001361	HDLBCNWSBADETQ-ODXCJYRJSA-N	431.449	1.493	50	20	IDGD	
Cn1c(=O)c2ccc(C(=O)NNC(=O)c3cc4c(s3)CCCCCC4)nc2n(C)c1=O	24642584	KBNPVFCQEDOWDA-UHFFFAOYSA-N	441.513	1.428	50	20	IDGD	
Cc1nc2c(C(N)=O)cnn2c(C)c1CCC(=O)NNC(=O)c1cc(-c2ccccc2)n[nH]1	108059960	WXNGXRUVLGQQRJ-UHFFFAOYSA-N	446.471	1.229	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NC[C@H]1COc2ccccc2C1	117284744	NKJJENQOKXLROZ-AWEZNQCLSA-N	431.518	1.483	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@@H]2CCCN(CC(F)(F)F)C2)c2ccccc2c1=O	195617280	JATRQTYUSFOZSI-GFCCVEGCSA-N	425.411	1.452	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C1(S(=O)(=O)c2ccc(Cl)cc2)CC1	725742017	XTHKWQHOYNTDMS-UHFFFAOYSA-N	441.918	1.285	50	20	IDGD	
CC(C)(C)OC(=O)NNC(=O)[C@H](CCS(C)(=O)=O)NC(=O)c1ccc(Cl)cc1	725897901	LHHFBZBIVOWUGL-ZDUSSCGKSA-N	433.914	1.429	50	20	IDGD	
CCCOC(=O)c1ccc(S(=O)(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)cc1	727795568	NRQUCBIWAZUDLB-UHFFFAOYSA-N	433.486	1.818	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)N[C@@H](CN2CCN(C)CC2)c2ccccc2)cc1	727945534	LNWCGMPUHSOZGM-NRFANRHFSA-N	425.533	1.693	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Cn2ccc3ccccc32)cc1S(=O)(=O)NC(C)C	729450512	YRKPMJZUXLOGTL-UHFFFAOYSA-N	444.513	1.798	50	20	IDGD	
Cc1cc(C(=O)N2CCC[C@@H]2C(=O)NNC(=O)CCc2ccccc2O)ccc1[N+](=O)[O-]	730032605	CGSMPFXSIZRDCL-GOSISDBHSA-N	440.456	1.994	50	20	IDGD	
CCc1c(C(C)=NNC(=O)CSc2nn(C)c(=O)n(C)c2=O)oc2ccc(C)cc12	730570838	MCTZBCIDMLDJOH-UHFFFAOYSA-N	429.502	1.729	50	20	IDGD	
COc1ccc([C@H](CNC(=O)NNC(=O)COc2ccccc2O)N(C)C)cc1OC	730903502	LWOFBXDCUDIHJN-HNNXBMFYSA-N	432.477	1.422	50	20	IDGD	
CC(C)NC(=O)C(=O)NNC(=O)CSc1nccn1-c1ccc(C(F)(F)F)cc1	732051925	CNNLJQMLDBXMQZ-UHFFFAOYSA-N	429.424	1.655	50	20	IDGD	
COc1ccc([C@H]2CCCCC2=NNC(=O)CSc2nn(C)c(=O)n(C)c2=O)cc1F	732712367	DGNLZEXZWOSCRL-CYBMUJFWSA-N	449.508	1.549	50	20	IDGD	
CN(CCO)S(=O)(=O)c1ccc(C(=O)NNC(=O)NCc2ccc(Cl)cc2)cc1	733004481	KBGRMJWVTIFWJU-UHFFFAOYSA-N	440.909	1.097	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)nnn1-c1ccc2c(c1)OCCO2	733108416	PPNYZTOVSLFJQO-UHFFFAOYSA-N	445.439	1.607	50	20	IDGD	
O=C(CNC(=O)c1cccc(Br)c1)NNC(=O)c1cnn(-c2ccccc2)c1	733364356	KRBIKNGTODTBMH-UHFFFAOYSA-N	442.273	1.826	50	20	IDGD	
CCS(=O)(=O)C[C@@H](C)NC(=O)NNC(=O)[C@H](C)Oc1cccc(Br)c1	733660305	OIWQYEKYUKOASK-MNOVXSKESA-N	436.328	1.370	50	20	IDGD	
CC(C)NC(=O)C(=O)NNC(=O)[C@@H]1CCC(=O)N(C)[C@H]1c1ccc(C(F)(F)F)cc1	734418784	NKYLBDUOCIUCOU-HIFRSBDPSA-N	428.411	1.287	50	20	IDGD	
CN1C(=O)C[C@@H](C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)[C@H]1c1cccc(Cl)c1	734419374	PMJAWJSOIWRMLH-SJLPKXTDSA-N	439.863	1.296	50	20	IDGD	
O=C(COC(=O)[C@@H]1C[C@H]1c1c(F)cccc1F)NNC(=O)[C@@H]1COc2ccccc2O1	734924241	SKBUNXKAFYJWFZ-QFSBIZTOSA-N	432.379	1.599	50	20	IDGD	
Cc1ccc(S(=O)(=O)Nc2cccc(C(=O)NNC(=O)c3cnn(C)c3)c2)cc1F	735470682	GZYKIXMNIPRZMP-UHFFFAOYSA-N	431.449	1.743	50	20	IDGD	
CC(=NNC(=O)C(=O)Nc1ccc(C)cc1)c1cccc(S(=O)(=O)N2CCOCC2)c1	739412447	BAJCHSLEVGEIBN-UHFFFAOYSA-N	444.513	1.495	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2cccc(OC(F)F)c2)ccc1OC	739668563	PQYATCLKABGNDH-UHFFFAOYSA-N	430.385	1.707	50	20	IDGD	
Cn1cc(S(=O)(=O)N2CCOCC2)cc1C(=O)NNc1cccc(C(F)(F)F)n1	740132688	RFUZSMDZAQLSBG-UHFFFAOYSA-N	433.412	1.217	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)[C@@H]1CCN(c2cc(Cl)ccc2Cl)C1=O	740849594	GKBPEDJGZJHJFZ-LBPRGKRZSA-N	429.304	1.799	50	20	IDGD	
Cc1c(NC(=O)NNC(=O)COc2ccccc2O)cccc1S(=O)(=O)NC1CC1	741073272	ZXUSWVMKDHLDQT-UHFFFAOYSA-N	434.474	1.373	50	20	IDGD	
Cc1nn(C)c2sc(C(=O)N[C@H](C)C(=O)NNC(=O)c3cccc(N(C)C)c3)cc12	742037396	SNVIGAFENRNZTJ-GFCCVEGCSA-N	428.518	1.589	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)[C@H]2CCCCN2C(=O)c2ccc(O)nn2)o1	742246785	BNYMRNRVABVDBZ-MRXNPFEDSA-N	444.492	1.073	50	20	IDGD	
CNS(=O)(=O)c1ccc(C(=O)NNC(=O)NCc2cccc(C(F)(F)F)c2)cc1	742459855	XYJBJCADKPRARD-UHFFFAOYSA-N	430.408	1.758	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)N[C@@H]1CC(=O)N([C@@H]2C[C@H]2c2ccccc2)C1	743700379	BDDPTFXUQGMGJV-YZLZLFLDSA-N	436.468	1.314	50	20	IDGD	
NC(=O)[C@@H]1CC(C(=O)NNC(=O)c2cc(Br)ccc2O)=NN1c1ccccc1	743731949	FAVMJAJUIGLSPF-AWEZNQCLSA-N	446.261	1.036	50	20	IDGD	
CCNC(=O)NNC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc(Br)s1	743900771	LKPBTTCRYBMAAP-SECBINFHSA-N	439.357	1.404	50	20	IDGD	
CN(C)c1ccc([N+](=O)[O-])cc1C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	744619493	QWHVUPDXAPSKRG-UHFFFAOYSA-N	449.489	1.439	50	20	IDGD	
CC(C)[C@H](C(=O)OCC(=O)NNC(=O)c1ccc(C#N)cc1)S(=O)(=O)C1CCCCC1	744952719	GNQYEALNERKOKM-LJQANCHMSA-N	449.529	1.635	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)C[C@@H]2CCCN(C(=O)NCC(C)C)C2)c1	745112920	WJVRFNIQXVZJEZ-KRWDZBQOSA-N	432.521	1.767	50	20	IDGD	
C[C@H](CCOc1ccccc1)C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	745765079	NRSCYAPFYUQTPG-DNVCBOLYSA-N	428.441	1.622	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)[C@]1(O)CCN(Cc2ccccc2)C1	746094817	SWTAUEXSKJSLTO-FQEVSTJZSA-N	448.317	1.612	50	20	IDGD	
N#Cc1cccc(C(=O)NNS(=O)(=O)c2ccc([N+](=O)[O-])cc2Br)c1	746591925	QRWNJZYBOPUXKR-UHFFFAOYSA-N	425.220	1.852	50	20	IDGD	
COc1cc(C)nc(NNC(=O)NCc2cccc(CN3CCC[C@H](C(N)=O)C3)c2)n1	746760088	LBIMDGKOTBRHFG-KRWDZBQOSA-N	427.509	1.317	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)N[C@@H](C)c1ccc(NC(=O)c2ccncc2)cc1	748628976	BFZBSMBTYXJCJR-GJZGRUSLSA-N	429.477	1.777	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)N[C@@H]1CCN(c2ccc(C(F)(F)F)cc2)C1=O	748635884	SPIKHEDSPJYINQ-BXUZGUMPSA-N	432.399	1.193	50	20	IDGD	
CC(C)(C)OC(=O)NCCCOC1CCN(C(=O)NNC(=O)Cc2cccnc2)CC1	749111299	GGSGPDRHXJUQAD-UHFFFAOYSA-N	435.525	1.761	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)[C@H]1CCCN1C(=O)c1ccc2c(c1)OCO2	749561984	TURMJTSLLKRORZ-SUMWQHHRSA-N	443.431	1.774	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCC1(CS(C)(=O)=O)CC1	752001548	DLTHERZFIOPEGN-LLVKDONJSA-N	448.339	1.372	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)Cc1ccc(I)cc1	754224279	NAJTXAXUNIKHTM-UHFFFAOYSA-N	426.210	1.766	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2cc(O)nc3ccccc23)c1	754374121	RSOYLLJPWYVKAW-UHFFFAOYSA-N	443.485	1.335	50	20	IDGD	
CC(C)Cn1c(=O)nc(O)c2c(C(=O)NNc3ncnc4[nH]cnc34)cc(C(C)C)nc21	754420288	PBRNZXLSCHGCSA-UHFFFAOYSA-N	437.464	1.700	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)Nc1cc(S(=O)(=O)N2CCCCC2)ccc1C	755393032	PNFPCFWREASBGY-OAHLLOKOSA-N	442.538	1.374	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)c2cc(S(C)(=O)=O)ccc2F)c2ccccc2c1=O	755408062	VBWUMEDCSKWUEG-UHFFFAOYSA-N	446.460	1.595	50	20	IDGD	
NC(=O)CCNC(=O)c1cccc(NC(=O)NNC(=O)COc2ccc(Cl)cc2)c1	756393905	UFQVBLULBAEZRG-UHFFFAOYSA-N	433.852	1.177	50	20	IDGD	
COCCS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2cc(Br)c[nH]2)cc1	756549361	FEAZODNXDREXPT-UHFFFAOYSA-N	445.295	1.664	50	20	IDGD	
COCCS(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)cc1	756556307	WEFUVKJYWRCIGD-ZDUSSCGKSA-N	439.465	1.866	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)Nc1cccc(-c2nnnn2CC)c1	756687504	VEYRTFRVWKOTRB-UHFFFAOYSA-N	425.449	1.990	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)Nc1ccc2c(c1)NC(=O)CC2	756748000	UOAFTKJPRGZNNB-UHFFFAOYSA-N	436.516	1.936	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)Nc1ccc(C(=O)NCC(=O)N(C)C)c(Cl)c1	757724344	CYQPMMZHLOFJGM-UHFFFAOYSA-N	431.880	1.933	50	20	IDGD	
Cc1nn([C@H]2CCS(=O)(=O)C2)c(C)c1NC(=O)NNC(=O)c1cccc(Cl)c1	757872479	ZDYMUVFXZGIHEO-AWEZNQCLSA-N	425.898	1.979	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)N1CCN(Cc2cccc(Cl)c2)C(=O)C1	758834788	RRLIBMYKHKNAEI-UHFFFAOYSA-N	440.891	1.995	50	20	IDGD	
O=[N+]([O-])c1ccccc1S(=O)(=O)N1CCN(CCI)CC1	759325341	WZVFTVMYWMQIHP-UHFFFAOYSA-N	425.248	1.336	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)n1	760139239	SWSJSDRILOOUBC-UHFFFAOYSA-N	444.429	1.092	50	20	IDGD	
CCO[C@@H]1C[C@@H](NC(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)[C@]12CCCO2	760144096	UQJBRDGPZYIPLW-DRSNIGMVSA-N	443.504	1.648	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCC2(CN(C)C)CCCC2)nc1	760174363	DEMHGRXNFQQQIE-UHFFFAOYSA-N	426.587	1.860	50	20	IDGD	
COC(=O)CS(=O)(=O)Cc1ccc(CNC(=O)NNC(=O)c2ccccc2C)cc1	760199711	SRRPEYVFKPFGAA-UHFFFAOYSA-N	433.486	1.227	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)[C@H]1CCCN1C(=O)OCC(F)(F)F	760442686	NSCPEEZYBSXNLJ-SNVBAGLBSA-N	426.392	1.212	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCC(C(=O)NNc3ncc(F)cn3)CC2)cc1OC	760905734	LXVJIDDFVNVYNZ-UHFFFAOYSA-N	439.469	1.177	50	20	IDGD	
Cc1c(/C=C(\C#N)C(=O)OCC(=O)Nc2cc(-n3cnnn3)ccc2F)cc(C#N)n1C	761058526	CSZQDKFYYVPMMB-LHHJGKSTSA-N	434.391	1.409	50	20	IDGD	
COc1ccc2c(c1)[C@H](C(=O)NNC(=O)CN1CCN(C(=O)c3ccccc3)CC1)CC2	762089051	YPCITGVNPWRHQS-HXUWFJFHSA-N	436.512	1.330	50	20	IDGD	
O=C(NNc1nccc(N2CCOCC2)n1)c1cccc(S(=O)(=O)N2CCCCC2)c1	762860162	JAUZYEJDQPFXNQ-UHFFFAOYSA-N	446.533	1.245	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc1	762947472	XHTUFAROWPKDRV-UHFFFAOYSA-N	445.497	1.398	50	20	IDGD	
O=C(NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1)c1cnc2[nH]cnc2c1	763272198	GVIGEHNHBHGGMJ-UHFFFAOYSA-N	442.482	1.895	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1ccccc1OC[C@@H]1CCCCO1	763466053	GGMMPZNNEUIEKM-INIZCTEOSA-N	442.428	1.942	50	20	IDGD	
CC(C)C(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1	763573418	SBHOADNWOQACEZ-KRWDZBQOSA-N	426.429	1.207	50	20	IDGD	
Cc1ccc(Br)cc1NC(=O)C(=O)NNC(=O)COc1ccc(C#N)cc1	763678584	HEOOKMMBODUFKT-UHFFFAOYSA-N	431.246	1.794	50	20	IDGD	
CCc1ccc(-n2nc(C(=O)NNC(=O)CNC(=O)c3cccnc3)c3c2CCC3)cc1	763823237	CZJQXWLMESNGPR-UHFFFAOYSA-N	432.484	1.509	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)C(=O)Nc1ccc(I)cc1Cl	763994418	XJBDUVXVSWYNCS-UHFFFAOYSA-N	446.632	1.683	50	20	IDGD	
Cc1nc2nc(N)nn2c(C)c1CC(=O)NNc1c(F)cc(C(=O)NC2CC2)cc1F	764329152	QBBOTXJTAZRGDK-UHFFFAOYSA-N	430.419	1.180	50	20	IDGD	
COCCOc1ccc(C#N)cc1NC(=O)C(=O)NNC(=O)C(F)(F)Oc1ccccc1	764380346	WPCWQQYZKQGWSB-UHFFFAOYSA-N	448.382	1.341	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)NCc2ccc(N3CCCS3(=O)=O)cc2)c1	764778257	AFCAPTSCOKLBGB-UHFFFAOYSA-N	438.531	1.456	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)NC[C@@H]2CCCCN2C2CC2)c2ccccc2c1=O	765667571	QFOJAWGMBGKIEP-INIZCTEOSA-N	426.521	1.938	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)N[C@H]1CCO[C@@H](C2CC2)C1	765905952	RATFQEWVXIRGDP-FUHWJXTLSA-N	436.534	1.373	50	20	IDGD	
O=C(NNC(=O)[C@H]1CC(=O)N(c2ccc(Cl)c(F)c2)C1)c1nnc(O)c2ccccc12	766556340	RXBKTCZPIMSLHA-JTQLQIEISA-N	443.822	1.942	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)c1ccc(N2C[C@H](C)O[C@@H](C)C2)nc1	768641824	WVHOEUIIVZOVIC-KBPBESRZSA-N	434.518	1.864	50	20	IDGD	
CC(=O)N1CCc2c(NC(=O)C(=O)NNC(=O)CSc3ccccc3O)cccc21	769267442	SGEVUINOQQNDDN-UHFFFAOYSA-N	428.470	1.179	50	20	IDGD	
O=C(Oc1ccc([N+](=O)[O-])c2ncccc12)C1=NN([C@H]2CCS(=O)(=O)C2)C(=O)CC1	770136876	OKMUZEIDHHVYAQ-NSHDSACASA-N	432.414	1.214	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)N1CCN(c2ccc(C(N)=O)cn2)CC1	770188796	NKMJOTCPRVOUBQ-ZDUSSCGKSA-N	446.895	1.164	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)c2ccc(F)cc2Br)cn1	770222406	OIIIPTGMPOVPEI-UHFFFAOYSA-N	445.270	1.308	50	20	IDGD	
O=C1COc2ncc(C(=O)NNC(=O)c3ccc(Br)cc3Cl)cc2N1	770736546	PFYMIXYTYPCSQW-UHFFFAOYSA-N	425.626	1.903	50	20	IDGD	
COc1cc([N+](=O)[O-])ccc1OC(=O)CN1C(=O)N[C@@](C)(c2ccccc2OC)C1=O	771318048	HMCYBOVAGLHHHL-FQEVSTJZSA-N	429.385	1.985	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1cc(Br)cc(Br)c1	773208708	NVBIRYOGCDDYHT-SSDOTTSWSA-N	440.113	1.407	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NNC(=O)CNC(=O)c2ccc(C#N)cc2)C1	773410574	DHAYFWRROPDHFF-MRXNPFEDSA-N	429.477	1.083	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)CNC(=O)c2cc(F)cc(F)c2)C1	774273835	ZTNNHJXKUWQBHV-LBPRGKRZSA-N	440.447	1.489	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)Nc2cnn(Cc3nnc4n3CCCC4)c2)cc1	775207729	XNYRALSNJVJNCX-UHFFFAOYSA-N	438.496	1.783	50	20	IDGD	
Cc1ccc(S(=O)(=O)C[C@H](C)NC(=O)NNC(=O)Cc2cn3ccccc3n2)cc1	776193284	GYVQECLLGMFKLO-HNNXBMFYSA-N	429.502	1.378	50	20	IDGD	
C[C@@H]1CC(C)(C)C[C@]2(C1)NC(=O)N(CC(=O)NNc1cccc(S(C)(=O)=O)c1)C2=O	776528790	XBTZVCQMGBHCRW-XCLFUZPHSA-N	436.534	1.670	50	20	IDGD	
O=C(COC(=O)C1(c2ccc(F)cc2F)CCC1)NNC(=O)[C@H]1COc2ccccc2O1	777213196	OMRWKXCFDDMVMV-GOSISDBHSA-N	446.406	1.917	50	20	IDGD	
COc1cc(NC(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)cc(OC)c1OC	778219723	LHXLMKUGWPSPIW-UHFFFAOYSA-N	439.494	1.943	50	20	IDGD	
COc1ccc(N2CCN(C(=O)/C=C/C(=O)NNC(=O)Cc3ccccc3F)CC2)cc1	778266252	NMELETOOMRRPER-ZHACJKMWSA-N	440.475	1.429	50	20	IDGD	
O=C(NNc1ccc([N+](=O)[O-])cc1Br)C(=O)Nc1ccn(CC(F)F)n1	778759741	PHZQVLLXOUBHKT-UHFFFAOYSA-N	433.169	1.901	50	20	IDGD	
CC(C)S(=O)(=O)c1ccc(CC(=O)NNC(=O)CCN2C[C@@H](C)O[C@H](C)C2)cc1	781417709	MFNVIBZRDNGMLJ-HZPDHXFCSA-N	425.551	1.058	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)CSc2ccc(C)cc2)c(OC)c1	782120939	NEFXJNDYSMRGJG-UHFFFAOYSA-N	431.470	1.668	50	20	IDGD	
CNC(=O)Cn1ccc2ccc(NC(=O)C(=O)NNc3ncccc3C(F)(F)F)cc21	783121285	YRNNRCDRTJSBFQ-UHFFFAOYSA-N	434.378	1.883	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2ccnn2[C@@H]2CCN(Cc3ccccc3)C2)nc(C)n1	783327071	XDTBCZMYPKUZPJ-GOSISDBHSA-N	434.504	1.819	50	20	IDGD	
Cn1c(=NNC(=O)C(=O)Nc2cccc(N3CCCS3(=O)=O)c2)sc2ccccc21	783349224	DKGFXYSEIBSHLB-UHFFFAOYSA-N	445.526	1.350	50	20	IDGD	
O=C(Cc1csc(COc2ccc(Cl)cc2)n1)NNC(=O)[C@@H]1CCS(=O)(=O)C1	783645509	KSVZYUSYSGPUHX-LLVKDONJSA-N	443.934	1.500	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1cccc(N2CCCCC2)c1	784005355	XATULZOOKUDBSA-UHFFFAOYSA-N	429.502	1.254	50	20	IDGD	
Cn1cnn(-c2ccc(NC(=O)C(=O)NNc3ccc(OC(F)(F)F)cc3)cc2)c1=O	784803674	IXSOCAXFDITALA-UHFFFAOYSA-N	436.350	1.551	50	20	IDGD	
O=C(NNc1c(F)cc(C(=O)NC2CC2)cc1F)C(=O)Nc1ccc(OC2COC2)cc1	785099652	JJDGNRQSNOYHKM-UHFFFAOYSA-N	446.410	1.716	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)c1nc(C(F)(F)F)cs1	787418597	QJQCFTSTVCJPIE-QMMMGPOBSA-N	426.384	1.843	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCCCC2)cc1C(=O)NNc1ccc(-n2ccnc2)nn1	788175363	RUZPPNBUIBYUHN-UHFFFAOYSA-N	441.517	1.902	50	20	IDGD	
CS(=O)(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cc3ccccc3o2)ccc1Cl	788332792	GVSMPGSZNUTXGA-UHFFFAOYSA-N	435.845	1.889	50	20	IDGD	
COc1ccc(NC(=O)c2cccc(NC(=O)C(=O)NNc3nc4ccccn4n3)c2)cn1	792394193	JECVYFFIMQEALG-UHFFFAOYSA-N	446.427	1.467	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)c2cnn3c2C[C@H](CNC(C)=O)CC3)cc1	792736834	RPGDXXNHBGVDRO-GDBMZVCRSA-N	443.504	1.209	50	20	IDGD	
COC(=O)c1cc(F)c(Br)cc1NC(=O)C(=O)NNC(=O)c1ccc(C)o1	797007307	QESPCJPESNBHMO-UHFFFAOYSA-N	442.197	1.676	50	20	IDGD	
CN(C)c1ccc(NC(=O)C(=O)NNC(=O)CNC(=O)OCc2ccccc2)cc1Cl	797368734	GJXSFHCIMBNBCM-UHFFFAOYSA-N	447.879	1.418	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc(Cl)c(CN2CCOCC2)c1	797536121	VIBKUDIDKCAKDB-UHFFFAOYSA-N	446.891	1.581	50	20	IDGD	
Cc1ccc(-n2cnnc2)c(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)c1	797904899	RYADYAOMCUXHCP-UHFFFAOYSA-N	442.501	1.354	50	20	IDGD	
NC(=O)c1ccc(CSc2ncccc2C(=O)NNC(=O)NCC(F)(F)F)cc1	798313770	NDLLEYZIBMFMAQ-UHFFFAOYSA-N	427.408	1.979	50	20	IDGD	
Cc1cc(O[C@H]2CCN(C)C2=O)ccc1NC(=O)C(=O)NNc1cccc([N+](=O)[O-])c1	799257630	GXZFSMBWPNZEHN-KRWDZBQOSA-N	427.417	1.595	50	20	IDGD	
CC(=O)c1cccc(S(=O)(=O)NCCC(=O)NNc2ccc3c(=O)[nH]ccc3c2)c1	803427391	NOGKPYPHMIVWKI-UHFFFAOYSA-N	428.470	1.542	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)C(=O)Nc2ccc(F)c(N3CCCNC3=O)c2)c1	806968568	LOFMHHBSAKXFSH-UHFFFAOYSA-N	449.464	1.231	50	20	IDGD	
COCc1cnc(NC(=O)C(=O)NNC(=O)c2ccc(F)cc2Br)s1	806976184	HWDFCBQUGALTDA-UHFFFAOYSA-N	431.243	1.591	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)CCc1nc(O)c2cnn(-c3ccccc3)c2n1	807370856	VDJFANRAYAZNBW-UHFFFAOYSA-N	442.476	1.390	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)[C@H]2C[C@@H](c3ccccc3)OC2=O)ccc1Cl	809555607	BNEGWYCQZTUPSE-OCCSQVGLSA-N	437.861	1.053	50	20	IDGD	
Cc1ccc(C)c(S(=O)(=O)NCC(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)c1	810586201	ZUUCTCCYYXYYKY-UHFFFAOYSA-N	445.476	1.572	50	20	IDGD	
C[C@H](CN1CCOCC1)C(=O)NN=C1CCN(C(=O)OC(C)(C)C)C[C@@H]1[C@H]1CCOC1	812225344	XJKMWRHDWKHTRC-FGTMMUONSA-N	438.569	1.720	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2O)cc1)[C@@H]1C[C@H]1C	815569327	PADCDTGSLNEULM-CXAGYDPISA-N	440.456	1.318	50	20	IDGD	
COC(=O)N1CCN(c2ccc(NC(=O)C(=O)NNc3ccc(OC)cc3)cn2)CC1	815584569	IJGRFBYLOUPTMC-UHFFFAOYSA-N	428.449	1.060	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)cc(OC)c1C	815657473	ZBHYQVPQUMBHEP-UHFFFAOYSA-N	436.490	1.344	50	20	IDGD	
COCCN(C)NC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(Br)cc2)C1	816561790	LTIYMADRJZMQKT-ZDUSSCGKSA-N	434.356	1.459	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)/C(=C\c1ccc(F)cc1)n1nnnc1C	818023800	QMXDGHMENMZNLA-LFIBNONCSA-N	426.408	1.354	50	20	IDGD	
CCCOc1ccc(C(=O)NNS(=O)(=O)c2ccc3c(c2)C(=O)N(C)C3=O)cc1OC	861647594	LBSRZHOCQOBLAW-UHFFFAOYSA-N	447.469	1.333	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@@H]2C(=O)NNc2nc(C)cc(C)n2)cc1	877465388	SVEXIFUSUCBVFT-GOSISDBHSA-N	431.518	1.983	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)CCC(=O)c2ccc3c(c2)OCCCO3)C[C@@H](C)O1	912919428	NSYGFVHFSXYKSX-IYBDPMFKSA-N	433.505	1.458	50	20	IDGD	
O=C(CNS(=O)(=O)c1c(F)cccc1F)NNC(=O)C12CC3CC(CC(C3)C1)C2	913489356	FEYMLTGVZQLWOI-UHFFFAOYSA-N	427.473	1.607	50	20	IDGD	
CN(CC(=O)NNC(=O)COc1ccc(Br)cc1)C(=O)c1cccs1	914711181	SUBOPZRUFJCXBB-UHFFFAOYSA-N	426.292	1.809	50	20	IDGD	
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)COc1ccc(C#N)cc1	915188366	HSTJUXQVMJEQAA-OAQYLSRUSA-N	447.495	1.949	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)c3cccc[n+]3[O-])c2)c(C)c1	916097572	SKGSUMXTUBUCQT-UHFFFAOYSA-N	440.481	1.812	50	20	IDGD	
O=C(NC[C@@H]1CCCOC1)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	918124476	SBYMPWRDNOQCMF-KRWDZBQOSA-N	446.529	1.536	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)NCc1cccc(OCC(=O)N(C)C)c1	918224626	WWXXBZCEQAZJSQ-UHFFFAOYSA-N	430.461	1.072	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)c1ccc(C)cc1)C(=O)NNC(=O)CC(F)(F)F	918363749	CHNKKQOOKCMXAN-GFCCVEGCSA-N	427.470	1.495	50	20	IDGD	
O=C(CNC(=O)c1ccc(Br)s1)NNC(=O)COc1ccc(F)cc1	918673613	NLNUIMNPTQXLDE-UHFFFAOYSA-N	430.255	1.606	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2cc(F)cc3nc(S)[nH]c23)ccc1Cl	919690081	IUDVAZUKNYOHGP-UHFFFAOYSA-N	443.869	1.366	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2n[nH]c3c2CCCC3)c(I)c1	1116270773	LGKNVTVPAQKPGR-UHFFFAOYSA-N	440.241	1.977	50	20	IDGD	
Cc1c(C(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)cnn1-c1ccccn1	1318556988	GWUBUYBUUGZFGZ-UHFFFAOYSA-N	428.493	1.984	50	20	IDGD	
Cc1nnc(O)c(CNC(=O)NNC(=O)[C@H](C)Oc2cccc(Br)c2)c1C	1318567721	VYQGBOJMAZMTPF-NSHDSACASA-N	438.282	1.859	50	20	IDGD	
Cn1cc(-c2nc(C(=O)NNC(=O)C3CCN(C(=O)OC(C)(C)C)CC3)cs2)cn1	1322956565	DRAYRSPMKZZDPW-UHFFFAOYSA-N	434.522	1.952	50	20	IDGD	
C[C@@H](O)CNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2ccc3ccccc3c2)cc1	1337093307	DDAZDEMVSOPTIB-CQSZACIVSA-N	427.482	1.574	50	20	IDGD	
Cc1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](F)Cl)C3)ncc1[N+](=O)[O-]	1778248605	RBMFYHMQESHQMK-RVKKMQEKSA-N	428.848	1.960	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)nn1C(F)F	1779299341	XYDYLWDREFSYNL-GOSISDBHSA-N	430.528	1.882	50	20	IDGD	
O=C(c1cc(Cl)cc2nn[nH]c12)N1CC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1780223152	AUCSOLDUONHZFQ-INIZCTEOSA-N	432.695	1.859	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1ccc(O)cn1)C2)[C@@H](F)Br	1780776890	HTQKPAXKBCKVRO-QGPMSJSTSA-N	444.301	1.534	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)Cc3ccc4ncnn4c3)CCO2)C1	1781232847	ZATICAHHZXUMGG-OALUTQOASA-N	440.331	1.338	50	20	IDGD	
COc1cc(OC)cc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](F)Br)C3)C2)c1	1781332918	CKIKRBAUQLUNOF-YJBOKZPZSA-N	445.285	1.838	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2)c1ccnc2c(O)cccc12	1781405363	HXEYYTIDYKCUMQ-NJNPRVFISA-N	447.919	1.668	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cncc(O)c2)C1	1782042725	YVSVQGKREHXWAH-CDHAZOANSA-N	426.311	1.698	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)c3cc4ccsc4[nH]3)C2)C1	1782294214	SHGRBAUZUQKZRV-FQEVSTJZSA-N	433.534	1.046	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnn4c3CCC4)C2)C1	1782313904	FUSZAIFPLXPFSK-FZKQIMNGSA-N	425.327	1.304	50	20	IDGD	
CCOC(=O)C1(C(=O)N2CC[C@@]3(CN(C(=O)[C@@H](C)CBr)CCO3)C2)CC1	1782913122	QWWIWPDFFOQDOY-SUMWQHHRSA-N	431.327	1.191	50	20	IDGD	
COc1ccccc1CC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1783328096	BICBFXIVFCWQDF-WMZOPIPTSA-N	429.286	1.758	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3c(F)cc(OC)cc3F)CCO2)C1	1783881526	RWVTWJRPKNLCDN-DJJJIMSYSA-N	432.851	1.671	50	20	IDGD	
C[C@H](CC(=O)N1CCO[C@]2(CCN(C(=O)C(Cl)Cl)C2)C1)NC(=O)OC(C)(C)C	1783945964	UTFWYWWTLYIWHJ-KZULUSFZSA-N	438.352	1.923	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(CO)o3)C[C@@H]21	1783969789	LFUFVPNGSYHYMG-DUPGQFARSA-N	429.311	1.396	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)C(=O)c3cccn3C)C2)C1	1784610845	IVFCAUYSHGXKQP-UGSOOPFHSA-N	426.311	1.211	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(C(N)=O)cc3)C2)C1	1784931820	UYQXOQNMVXRTCH-MOPGFXCFSA-N	428.316	1.465	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3CCC3)[C@H]2C1	1786303454	DNFNWOFRSQPAER-QSFXBCCZSA-N	445.472	1.914	50	20	IDGD	
C[C@H](Cn1ccnc1)C(=O)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1	1788143856	ZCQXJPOHSRDILZ-QGZVFWFLSA-N	446.316	1.647	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]2C1)n1cccc1C=O	1789922967	VLQBZWXNLHPPLU-MLEONAHRSA-N	444.301	1.532	50	20	IDGD	
Cc1ccc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]3C2)cc1C	1791288089	WNJISXLVHAQGPY-ACRUOGEOSA-N	444.576	1.199	50	20	IDGD	
Cc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)CBr)c(O)c1	1792873009	IOKRLRFQRQGWHH-VWPFQQQWSA-N	425.323	1.935	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1CCN(c2ccccc2)CC1	1792907235	ZBNWVLHKSXVZCY-KOUHRCEDSA-N	449.979	1.746	50	20	IDGD	
CC(C)OC(=O)c1ncccc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2	1794315674	HNEWSAAIEJVUOV-DABQJJPHSA-N	444.315	1.654	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCc1cn[nH]c1	1794335666	BZDDHGSPGZCHOO-FWKYCFCSSA-N	425.493	1.115	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(F)cn1	1795295347	AWNFEZAOWNOWFQ-TWXBYECESA-N	426.452	1.607	50	20	IDGD	
Cn1c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](O)CCl)C3)cc2c1-c1ncccc1OC2	1796392972	YEPNQMVLPPUVNB-IVSAIRAKSA-N	444.919	1.831	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](F)Br)C2	1796892822	WYLYGWKYTDQLDJ-RPHACJDCSA-N	442.289	1.449	50	20	IDGD	
COc1ccc(-c2cc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)[C@H](O)CCl)C4)n[nH]2)cc1	1796950170	IPZJDMPPVNXRBO-NXEZDXNNSA-N	432.908	1.937	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc2nc[nH]c2c1	1798067866	LGZNTOAHWJUJAA-QDMKHBRRSA-N	433.472	1.127	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(N(C)C)ccc1[N+](=O)[O-]	1798539736	LSMHSVZXHBOCQX-VLWCASSMSA-N	438.912	1.881	50	20	IDGD	
C[C@H]1C[C@@]1(C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1799158690	PRWOJHNXYOGHLQ-PYWNROJRSA-N	443.972	1.754	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CCN(C(=O)OC(C)(C)C)C1)C2	1799267788	FXIHTJZICQTESE-SIRPWMCASA-N	443.972	1.850	50	20	IDGD	
C[C@H](Nc1cccnc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Br	1799346652	UZISWZNQZHYWCZ-QIRZIZBZSA-N	429.290	1.162	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccc([N+](=O)[O-])cc1F	1800403271	VERQTIMPSRWNEC-ZFHGCVPZSA-N	443.859	1.120	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cn2c(F)cccc2n1	1801028130	CRCJNXRTMMGRIT-QDMKHBRRSA-N	430.484	1.098	50	20	IDGD	
CC[C@@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](N)Cc1cscn1)C2	1801801563	LHUOPJPZSHYPBN-RCSLCFTFSA-N	429.384	1.825	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2nccc3nc[nH]c23)[C@@H]1c1cccnc1)[C@H](O)CCl	1803138854	GHDTVYUBTALCBL-JCKWVBRZSA-N	428.880	1.272	50	20	IDGD	
CC(C)[C@H](S)C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1803598096	JOYYVXUWGCDYGD-HOJAQTOUSA-N	441.362	1.035	50	20	IDGD	
COc1cncc(CCC(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)c1	1804482127	QGUYXHRGQUMMFD-HFSMHLIXSA-N	446.935	1.724	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC2(CCN(C(=O)c3cccc(=O)n3O)CC2)C1	1805382607	GPFPYCCBZMGJFP-AWEZNQCLSA-N	440.338	1.961	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)C1CCCCC1	1806223899	CBANRYTWGILEQM-IFMALSPDSA-N	435.333	1.661	50	20	IDGD	
Cc1nc(CC(=O)N2CCCC3(CCN(C(=O)c4cccc(B(O)O)c4)CC3)C2)cs1	1807040780	LVWZTVDEMFTJPP-UHFFFAOYSA-N	441.362	1.219	50	20	IDGD	
O=C(Cn1ccccc1=O)NC[C@@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1	1807438356	WOSYXATZFCXPON-OXJNMPFZSA-N	447.333	1.734	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)Cn2cc([N+](=O)[O-])cn2)[C@H]1c1cccnc1	1808250222	IOVPNKYNWOXMAB-ZVZYQTTQSA-N	434.884	1.910	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)C(F)F)[C@@H]1c1cccnc1	1808414889	OLROITSBEBGKGH-JBVPVUGKSA-N	432.431	1.487	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)c3ccc(Cl)o3)CC2)C1	1809972041	KTXFINAATHODGV-UHFFFAOYSA-N	430.697	1.771	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)C3CCSCC3)CC2)C1	1809972650	KVSLZQIBPHEQDZ-UHFFFAOYSA-N	430.379	1.354	50	20	IDGD	
C=CC[C@H](C)C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1	1810306394	YFHAUYAQMSXJHT-RIFZZMRRSA-N	436.516	1.612	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC2(CCCN(C(=O)c3cnc4ccoc4c3)C2)CC1	1810682060	MDKMLSQLCSYDKN-UHFFFAOYSA-N	447.300	1.666	50	20	IDGD	
CC(=O)N/C(C)=C/C(=O)NC[C@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1	1812317769	YYMIIBOZYSVBRX-OLBRDBERSA-N	437.338	1.912	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2nc3ncccn3n2)[C@H]1c1cccnc1	1813030393	IVMGAIUUWXXDRQ-JYJNAYRXSA-N	443.895	1.093	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)[C@@H]2C[C@@]2(F)Cl)[C@@H]1c1cccnc1	1813074005	NPWDPLQJKRYXOL-VOGPDBBUSA-N	439.919	1.385	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H]2C[C@@H]2C2CC2)n[nH]1	1814759186	JISIZAMHORACBT-IIDMSEBBSA-N	437.504	1.760	50	20	IDGD	
CCS(=O)(=O)N[C@@H](C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)C(Cl)Cl)[nH]n1	1815167871	KNZSCRSLNHAWEC-ONGXEEELSA-N	440.353	1.533	50	20	IDGD	
O=C(CCc1ccc[nH]1)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1	1815354763	RPYLSERCRZOHHD-MRXNPFEDSA-N	438.318	1.010	50	20	IDGD	
COc1ccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)cn1	1815440894	KGNVKYQCUSFNLW-GOSISDBHSA-N	449.276	1.113	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)Cn3ccccc3=O)sc2C1	1815451784	PKQXNGZSEQOWCI-WDEREUQCSA-N	439.335	1.700	50	20	IDGD	
Cc1c(C(=O)N[C@@H]2CCc3nc(NC(=O)[C@@H](F)Cl)sc3C2)cn2[nH]cnc(=O)c12	1817125325	LCPJVYJMXZWULC-AMIZOPFISA-N	438.872	1.548	50	20	IDGD	
CN1CCN(C2(C(=O)N[C@@H]3CCc4nc(NC(=O)[C@H](F)Cl)sc4C3)CC2)CC1	1817128653	QCRNWDRHRDOIPG-RISCZKNCSA-N	429.949	1.370	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@H](O)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](F)Cl)n[nH]1	1818035555	NUZLVZNERVIFJO-MBNYWOFBSA-N	447.895	1.822	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc[nH]n2)[nH]n1	1818110879	RSNDPYBNDYJYMS-SOAGAIGUSA-N	437.464	1.573	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3cnc4[nH]ncc4c3)sc2C1	1818956721	SSKLCWPGCYEBCG-RYUDHWBXSA-N	434.909	1.894	50	20	IDGD	
O=C(/C=C\C(=O)NC1CC1)Nc1nc2c(s1)C[C@H](NC(=O)CCBr)CC2	1819525868	ABYDPXDMUTWILC-ISALQUGTSA-N	441.351	1.675	50	20	IDGD	
CC(C)O[C@H](C)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnccc1C(=O)NN)CC2	1820009887	HWVCOHCGMGBHRU-VXGBXAGGSA-N	446.533	1.181	50	20	IDGD	
C[C@H](C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@](C)(Cl)CCl)[nH]n1)n1cnnn1	1822860474	GZGJLAVMJJZSNA-NSODJVPESA-N	429.312	1.886	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](C)n2cnnn2)n[nH]1	1822863290	MGICEGVQIFZKRX-UMNHJUIQSA-N	425.291	1.433	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CN(CCO)CCO)CC1	1824619218	UUNFYJWROMAZEI-RTBURBONSA-N	432.005	1.300	50	20	IDGD	
CC(C)(O)CC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1	1826635379	NHLMNXVIKCUBJX-SFHVURJKSA-N	431.537	1.079	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H](F)Br)CC1	1827566449	GGQFYZIJNJCHSJ-MELADBBJSA-N	435.338	1.744	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)[C@@H](O)CCl)CC2)nc2nccn12	1830925814	CVIXWSYWQYPALY-ROUUACIJSA-N	433.940	1.871	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(N(C)C)cn3)C2)C1	1831644265	SQIFNAHPSJGZAS-DYESRHJHSA-N	438.956	1.625	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccn4cncc4c3)C2)C1	1831649705	AIKTWFMGBNXACE-NQIIRXRSSA-N	434.924	1.812	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)Cn2ccncc2=O)CC1	1831655957	GKHLFXWWOLVGNV-GOEBONIOSA-N	439.354	1.646	50	20	IDGD	
COCc1oncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1	1831873319	PIPZESDCDPSUKZ-GOSISDBHSA-N	449.552	1.427	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC([C@H]2CCCCN2C(=O)CN2C(=O)C=CC2=O)CC1	1831984325	REDUWQORVARXBS-QGZVFWFLSA-N	435.597	1.383	50	20	IDGD	
CCOCCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1	1832357638	FBHMAWIBECJKEF-LJQANCHMSA-N	431.537	1.345	50	20	IDGD	
Cc1ccc(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)cn1	1832903702	NKZRYRFZAIJLTB-QFIPXVFZSA-N	449.624	1.631	50	20	IDGD	
COc1ncccc1CCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1833000354	PWZIKEALWFAZLC-LPHOPBHVSA-N	429.876	1.014	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3ccc4nc[nH]c4c3)CC2)CC1)[C@H](O)CCl	1833310588	SLEFIMXTXIEGTD-LJQANCHMSA-N	433.940	1.348	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)c1nc(Cl)ccc1F	1833899971	CVRSCQZXRFBLSW-OAHLLOKOSA-N	447.338	1.659	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cc(C)nn3C)CC2)CC1	1834190395	SDUIMNSQVUYDJS-KRWDZBQOSA-N	425.961	1.168	50	20	IDGD	
CC[C@@H](C)[C@H](N)C(=O)NC1CCN(C2CCN(C(=O)CO[Si](C)(C)C)CC2)CC1	1834688223	KTHYCBFVJDUEQG-UZLBHIALSA-N	426.678	1.783	50	20	IDGD	
O=C(C#Cc1ccccc1)N1CCOC[C@@]2(C1)CN(C(=O)CCBr)CCO2	1834822320	HHHVTTCPKJVACP-HXUWFJFHSA-N	435.318	1.280	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)COc3ccc(F)cc3)CCO2)C1	1834964219	QFWCHVUZRFUCJY-YLJYHZDGSA-N	428.888	1.678	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3cn[nH]c3)CC2)CC1	1835174571	PLRXPMPPXOTSCP-INIZCTEOSA-N	426.359	1.768	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1)[C@@H]1CCC=CO1	1835723164	XXOYVHSFXRRKBX-HOTGVXAUSA-N	432.334	1.941	50	20	IDGD	
CC[C@@H](C)[C@@H](N)C(=O)N1CCC(N2CCC(NC(=O)CO[Si](C)(C)C)CC2)CC1	1835833542	PGBVXHYPBSNNEU-OXQOHEQNSA-N	426.678	1.783	50	20	IDGD	
Cc1nccnc1C(=O)NC1CCN(C2CCN(C(=O)[C@H](C)Br)CC2)CC1	1836014613	PGWJTVBWLQKSBN-ZDUSSCGKSA-N	438.370	1.754	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3cc(F)cc(F)c3)CCO2)C1	1836123460	UXRKKWJRGTXNGN-XLIONFOSSA-N	446.878	1.218	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC(OC2CCN(C(=O)CCC(N)=O)CC2)CC1	1836673103	AZMHXOPCISKEKR-ZDUSSCGKSA-N	432.359	1.282	50	20	IDGD	
Cn1nc(C(=O)N2CCC(OC3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)c2c1CCC2	1836717079	GXQHDGSVOUMVDK-SFHVURJKSA-N	438.956	1.121	50	20	IDGD	
O=C(c1nc2ccccc2[nH]1)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836718435	XLOVZPSVHRSNCE-SFHVURJKSA-N	434.924	1.775	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)C3=NN(C)C(=O)CC3)CC2)CC1	1837057712	SQELCHLKCZQBSJ-INIZCTEOSA-N	426.945	1.611	50	20	IDGD	
O=C(c1csc(C(F)(F)F)n1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1838189332	LKMKBJNPVSMJRJ-QMTHXVAHSA-N	445.822	1.766	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](Cl)COC)CC2)CC1	1838787623	ZOISDBJXPUPBIQ-HOTGVXAUSA-N	425.353	1.493	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(Cl)ccc3F)C2)C1	1840149011	APFFPQNEYPWEBB-HNAYVOBHSA-N	449.306	1.803	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc4cc[nH]c34)C2)C1	1840152773	SSRZMQLZGOAVQP-DYESRHJHSA-N	435.908	1.492	50	20	IDGD	
COc1ccc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)cc1O	1840186599	BGTCVSJVUREXOR-LJQANCHMSA-N	447.315	1.203	50	20	IDGD	
O=C(c1cc2ccccn2n1)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840187607	NCWZIVKFYAARRF-GOSISDBHSA-N	427.288	1.208	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)c2cccc(N3CCCNC(=O)C3)n2)C1	1842304903	AKZPXEYPUVPSID-OAHLLOKOSA-N	433.940	1.242	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1cccnc1Cl)C2	1843415039	CXWITPYPRTVKAC-ZMOGYAJESA-N	428.880	1.686	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)CCc1cccnc1C)C2	1843415438	QQXVBOFHFPPCKK-YZSQISJMSA-N	436.516	1.660	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)c1cncn1C)C2	1844692227	XHUPIQFOOCGMHD-UHFFFAOYSA-N	427.417	1.384	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)c2ccc3occ(Cl)c3c2)C1	1844747836	YLKFLOZNXLXETF-UHFFFAOYSA-N	438.676	1.897	50	20	IDGD	
COc1cc(C(=O)N2CCCC23CN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C3)ccc1C	1844955274	PWLRRWDJEMFAIV-PCLIKHOPSA-N	437.500	1.955	50	20	IDGD	
CC1=C(C(=O)N2CC3(CCCN3C(=O)CN(C)NC(=O)NCc3ccccc3)C2)CCO1	1845038659	FFGYHINVQSDWGU-UHFFFAOYSA-N	441.532	1.230	50	20	IDGD	
C[C@H](C(=O)N1CC2(CCCN2C(=O)/C(C#N)=C/c2ccc(F)cc2F)C1)n1cnnn1	1845871971	LJVIDHDFPXMRMV-BKNIFWKGSA-N	427.415	1.323	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2	1846362862	AUUVXUOZAAQTTK-OAHLLOKOSA-N	439.852	1.591	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)CC1CN(C(=O)OC(C)(C)C)C1)C2	1846365798	WREYDYXUIZZLSM-OAHLLOKOSA-N	429.945	1.701	50	20	IDGD	
COC(=O)C12CCC(C(=O)N3CC4(CCCN4C(=O)CCC(=O)NN(C)C)C3)(CC1)CC2	1846385183	ZYPDEHIRQVUDFH-UHFFFAOYSA-N	448.564	1.076	50	20	IDGD	
COC(OC)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](Br)Cc1ccccc1	1847696069	OTGPQNSSZLZELW-JYJNAYRXSA-N	425.323	1.813	50	20	IDGD	
COc1ccc(C)cc1N1C[C@@H](C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)CC1=O	10158778	KBSRCNQTBKNOCN-HNNXBMFYSA-N	449.467	1.709	50	20	IDGD	
O=C(CNC1=NS(=O)(=O)c2ccccc21)NNC(=O)c1cc2c(s1)CCCCCC2	12697490	OVNMTGAQWKYUIO-UHFFFAOYSA-N	446.554	1.907	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)CCc2c(C)nc3nc(C(F)(F)F)nn3c2C)n1	15758259	LITVZXJIGJUPNE-UHFFFAOYSA-N	438.414	1.353	50	20	IDGD	
C=CCn1c(S)nc2cc(C(=O)NNC(=O)[C@@H]3COc4ccccc4O3)ccc2c1=O	26975633	PKCGYIOVMLUHLV-KRWDZBQOSA-N	438.465	1.472	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)[C@@H](NC(=O)c1ccccc1)c1ccccc1	725740920	JPGQSPZMLMOHLB-IBGZPJMESA-N	436.493	1.797	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)N1CCC(c2nc3ccccc3[nH]2)CC1	725873817	QUXQOGFQFZPUTE-UHFFFAOYSA-N	426.502	1.975	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C2CCN(C(=O)OCC(C)C)CC2)c2ccccc2c1=O	726157612	UQROFWRSZWYRCE-UHFFFAOYSA-N	443.504	1.682	50	20	IDGD	
Cc1noc([C@@H](C)NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)n1	726277720	DORKBMVORSQXFA-GFCCVEGCSA-N	436.494	1.258	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)NCC(=O)N2CCc3ccccc32)cc1	726281349	NURVDTCIOTWYPK-HNNXBMFYSA-N	426.473	1.772	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2cccc(CS(N)(=O)=O)c2)c(C)n1-c1ccccc1	726521822	VDIUPGJHXDTTCT-UHFFFAOYSA-N	426.498	1.957	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCCc2cccc(C(N)=O)c2)nc1	726719671	UTOPLABRPJEHNR-UHFFFAOYSA-N	434.522	1.080	50	20	IDGD	
COc1ccc(-n2cnnc2SCC(=O)NNC(=O)c2cc(Cl)ccc2OC)cn1	728791948	BCRAIZCJUNMYNR-UHFFFAOYSA-N	448.892	1.886	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)NCCN1CCN(c2ccc(F)cc2)CC1	729496313	HMCNMUQFHNBWNF-UHFFFAOYSA-N	438.507	1.933	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)[C@H](CCSC)NS(=O)(=O)c1ccccc1	731494597	XGQFDDHJOINEFT-INIZCTEOSA-N	437.543	1.556	50	20	IDGD	
CC(=O)N1CCCCC[C@@H]1C1CCN(CC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)CC1	731667044	RSUPFSYRDNQUHT-HXUWFJFHSA-N	445.520	1.859	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2ccc(-c3nc(=O)o[nH]3)cc2)c2ccccc2c1=O	731891162	JXZRNDXVFRIPLJ-UHFFFAOYSA-N	434.412	1.225	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)Sc1nnc(N2CCOCC2)n1-c1ccccc1	731904049	DEWIUVGAACRLAG-HNNXBMFYSA-N	432.550	1.778	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)CCCNC(=O)c2ccc(F)cc2F)C[C@@H](C)O1	732260726	GWAHUOSDSDUJMG-ZIAGYGMSSA-N	426.464	1.122	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)Oc2ccc([N+](=O)[O-])c(C(=O)OC)c2)n(C)c1	732651297	DUEYDJHXWNESFZ-UHFFFAOYSA-N	439.446	1.970	50	20	IDGD	
O=C(NNC(=O)C(=O)N1CCCC1)N[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	734071437	KFFGIDFSMDTDQQ-OAHLLOKOSA-N	427.427	1.233	50	20	IDGD	
Cc1[nH]c2ccnn2c(=O)c1CC(=O)NNc1cc(C(F)(F)F)nc(-c2ccccn2)n1	734258057	DTMCRMIHCQHZQM-UHFFFAOYSA-N	444.377	1.888	50	20	IDGD	
CN1C(=O)C[C@H](C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)[C@@H]1c1cccc(Cl)c1	734419375	PMJAWJSOIWRMLH-WMZOPIPTSA-N	439.863	1.296	50	20	IDGD	
CCOCCCN1CC[C@H](NC(=O)NNC(=O)Cc2nc3ccccc3n2C)[C@@H](C)C1	734684396	NPNZGHMHDTWFNA-IRXDYDNUSA-N	430.553	1.583	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)CC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1F	734816495	UEJICPXGOQJEDJ-UHFFFAOYSA-N	444.444	1.449	50	20	IDGD	
O=C(CSc1nnnn1-c1ccc2c(c1)OCCO2)NNC(=O)c1cccc(Cl)c1	734980679	HVARFVCXSGFOHN-UHFFFAOYSA-N	446.876	1.640	50	20	IDGD	
CC(=NNC(=O)Cc1csc(N2CCOCC2)n1)[C@H]1CN(Cc2ccccc2)CCO1	735612334	NFUDDONIFQYTMS-HXUWFJFHSA-N	443.573	1.915	50	20	IDGD	
CC(=NNC(=O)c1csc(N2CCOCC2)n1)[C@@H]1CN(Cc2ccccc2)CCO1	735612335	NFXAPAGEAOFRAR-IBGZPJMESA-N	429.546	1.986	50	20	IDGD	
Cc1noc(C)c1C[C@@H](C)NC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	739047741	FDTUYTILRZBYAB-MRXNPFEDSA-N	428.537	1.765	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCc2cc3ccccc3o2)c1	740482266	TVPUVTPNZOFNHE-UHFFFAOYSA-N	430.486	1.870	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)c1ccc(OCC(=O)N2[C@@H](C)CCC[C@@H]2C)cc1	740850991	JZIHJFXYPGJUCJ-HOTGVXAUSA-N	446.548	1.921	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2c(C)nn(CC)c2Cl)c1	742032268	DDMHQOWTLZIURS-UHFFFAOYSA-N	441.941	1.970	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cc(N3CCNC3=O)ccc2Cl)cc(OC)c1OC	742032854	CPFODNMOZLNCTK-UHFFFAOYSA-N	448.863	1.970	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)CCN2CCN(c3ccccn3)CC2)o1	742246915	HSHLABQLUZIHFJ-UHFFFAOYSA-N	428.537	1.490	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)CN(C[C@H]2CCCO2)C(=O)OC(C)(C)C)C[C@@H](C)O1	743290063	ABDZLOOIRQDMFA-BRWVUGGUSA-N	442.557	1.049	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Nc2ccc(N(C)C)cc2)cc(Cl)c1OCC(N)=O	743828939	PEFWHTZMGWTXDX-UHFFFAOYSA-N	435.868	1.745	50	20	IDGD	
C[C@@H](c1ccc(F)cc1F)N1CCN(CC(=O)NNC(=O)c2cccc(C#N)c2)CC1	744398772	PSBDODBIZJHQSL-HNNXBMFYSA-N	427.455	1.976	50	20	IDGD	
COc1ccc2c(c1)C[C@@H](C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1)CO2	744620811	OHBKRWRPHMVLKG-MRXNPFEDSA-N	447.513	1.411	50	20	IDGD	
O=C(COC(=O)c1ccc(OC2CCC2)cc1)NNC(=O)[C@H]1COc2ccccc2O1	745672833	RKFSZDHEQPPZCP-LJQANCHMSA-N	426.425	1.762	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NCCC(=O)OC(C)(C)C)c2ccccc2c1=O	745835840	FNQGPIDJUPWDSD-UHFFFAOYSA-N	431.493	1.872	50	20	IDGD	
O=C(NNC(=O)[C@]1(O)CCN(Cc2ccccc2)C1)c1cc(F)ccc1Br	746215492	ITAZIFTWDHQAAQ-IBGZPJMESA-N	436.281	1.986	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2ccc(OCc3cccnc3)cc2)n1	746954452	OEOOHBMQMWTBGG-UHFFFAOYSA-N	440.481	1.972	50	20	IDGD	
O=C(CN1CCOC[C@@H]1C[C@@H](O)c1ccccc1)NNC(=O)c1ccc([N+](=O)[O-])cc1	747661464	XWSXWGJILPNIKF-RBUKOAKNSA-N	428.445	1.180	50	20	IDGD	
CS(=O)(=O)N1CCCC[C@@H]1C(=O)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1	748522041	KRJIJAWPPIZYEZ-GFCCVEGCSA-N	429.442	1.237	50	20	IDGD	
COCCOCC(=O)NC1CCC(C(=O)NNC(=O)c2cc(-c3ccccc3)on2)CC1	748701198	NDERWCVMYJNDMW-UHFFFAOYSA-N	444.488	1.441	50	20	IDGD	
CCc1nc(C(=O)NNC(=O)C(=O)N2CCCC2)nn1-c1c(Cl)cccc1Cl	748734182	ZUUXHRIFVVALAL-UHFFFAOYSA-N	425.276	1.520	50	20	IDGD	
Cc1cc(Br)ccc1NNC(=O)C1CCN(c2ccc3nnnn3n2)CC1	748748742	SCCRLXDMFSEUMD-UHFFFAOYSA-N	431.298	1.950	50	20	IDGD	
CC[C@@H](NC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)c1nnc2n1CCCCC2	749580398	SZSUJSJKAPTGMF-OAHLLOKOSA-N	434.522	1.503	50	20	IDGD	
O=C(CCc1ccccc1)NNC(=O)NCc1ccccc1OCCN1CCOCC1	749931325	AAAIDABKJZAZDO-UHFFFAOYSA-N	426.517	1.861	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)NCC2CCN(CC(=O)NC(C)(C)C)CC2)cc1	751110989	KJXCPMSZFKFFHB-UHFFFAOYSA-N	447.580	1.585	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)c2ccc(OCc3ccccc3)nc2)c2ccccc2c1=O	751293327	ITVLLIQLNCPGAZ-UHFFFAOYSA-N	429.436	1.982	50	20	IDGD	
O=C(COC(=O)Cc1cccc(C(F)(F)F)c1)NNC(=O)[C@H]1COc2ccccc2O1	752882867	JDMDDGYLPHTXDV-MRXNPFEDSA-N	438.358	1.779	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCC[C@@H](C)N2CCCCC2)cc1	753417889	DREKRAUTFLLIOJ-QGZVFWFLSA-N	439.582	1.210	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)c2cc([N+](=O)[O-])c(N)cc2OC)cc1C	753456207	HPKOJZCFKPKIGC-UHFFFAOYSA-N	436.446	1.736	50	20	IDGD	
COCc1nc(Cl)cc(NNC(=O)CCc2c(C)nc3c(C(N)=O)cnn3c2C)n1	753978990	CNDVZIRIZJUDFG-UHFFFAOYSA-N	432.872	1.111	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cc(C)nc3ccccc23)cc(OC)c1OCC(N)=O	754778243	YEAPGHNHSHOOEI-UHFFFAOYSA-N	438.440	1.499	50	20	IDGD	
O=C(NNC(=O)C1CCCC1)Nc1ccc(Cl)c(S(=O)(=O)N2CCOCC2)c1	755360092	CLHVWNQUCKFKCJ-UHFFFAOYSA-N	430.914	1.704	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)COc2ccc(C)c(C)c2)n([C@H]2CCS(=O)(=O)C2)n1	755530027	DJVMJVDLXYUQPY-HNNXBMFYSA-N	435.506	1.400	50	20	IDGD	
CN(CC(=O)O)c1ccc(C(F)(F)F)cc1C=NNC(=O)CNC(=O)c1ccco1	755678427	GQIGDNGRXRXEGJ-UHFFFAOYSA-N	426.351	1.699	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccc(N3CCCCC3)nc2)c1	755844825	LYIUIVFCEKLSKS-UHFFFAOYSA-N	446.533	1.789	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)[C@H]2COc3ccccc3O2)c(Cl)cc1F	755957109	LLMXEGAQYRLKAC-CQSZACIVSA-N	444.824	1.415	50	20	IDGD	
C[C@@]1(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)CCCO1	756084411	NEBGPGCNIMAGES-NRFANRHFSA-N	446.529	1.678	50	20	IDGD	
CCOC(=O)C1CCN(C(=O)c2ccc(NC(=O)NNC(=O)c3cccn3C)cc2)CC1	756680755	BWTUPPAVCLZWCS-UHFFFAOYSA-N	441.488	1.907	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)Nc1cc(S(=O)(=O)N(C)C)ccc1F	756685654	RRACGLKCWZRDOE-UHFFFAOYSA-N	438.481	1.870	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2cccc(Cl)c2)cc1	756783095	DTRUABUIXWRIJH-UHFFFAOYSA-N	426.882	1.731	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)Nc1ccc(C[C@H]2CC(=O)NC2=O)cc1	756814360	FRKNGJUJEBWYKB-ZDUSSCGKSA-N	441.400	1.032	50	20	IDGD	
CCn1c(NNC(=O)CN2C(=O)N[C@]3(C[C@@H](C)C[C@@H](C)C3)C2=O)nc2ccccc2c1=O	756909530	YKFUNJAGGTWUGV-HSAQVAQVSA-N	440.504	1.606	50	20	IDGD	
O=C(NCc1cc2c(cc1OC(F)F)OCO2)NNC(=O)[C@H]1COc2ccccc2O1	756960021	UILXIZNCBPBMAU-MRXNPFEDSA-N	437.355	1.687	50	20	IDGD	
CN(C1CCCCC1)S(=O)(=O)c1cccc(C(=O)NNc2ccc(C(N)=O)nn2)c1	757393147	SVMLPQUQLBHESU-UHFFFAOYSA-N	432.506	1.286	50	20	IDGD	
Cc1ccn(C)c(=O)c1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	757630858	MZZDUUHJHXTQGT-UHFFFAOYSA-N	447.517	1.335	50	20	IDGD	
CCc1onc(C)c1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	757783106	TVHDJEVPZDTHCT-UHFFFAOYSA-N	437.478	1.033	50	20	IDGD	
CN(NC(=O)c1ccc2c(c1)C(=O)N(C)C2=O)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758782637	UUWBBCAEODQGFJ-UHFFFAOYSA-N	445.476	1.162	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NC[C@@H]2CN(Cc3ccccc3)CCCO2)cc1OC	758860527	CWEAMOMPTCMIBX-LJQANCHMSA-N	442.516	1.939	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)[C@H]1CC(=O)N(C)[C@@H]1c1ccc(Cl)c(F)c1	759154145	UMZYOCRYJCVQOE-BLLLJJGKSA-N	426.876	1.451	50	20	IDGD	
Cn1c(=NNC(=O)[C@@H](CCC(N)=O)NC(=O)OCc2ccccc2)sc2ccccc21	760098082	WHAIHKSTQWOINE-OAHLLOKOSA-N	441.513	1.732	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccnn2Cc2ccc(F)cc2)cc1	760278259	BIGDLBMROIBSJY-UHFFFAOYSA-N	441.419	1.244	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)NC1CCC(F)(F)CC1	761776479	QOOIJWNCXKFCGV-UHFFFAOYSA-N	430.477	1.993	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)[C@H](C)NS(=O)(=O)c1cccc(C#N)c1	762371556	ZYQLUBBXYZYKCX-ZDUSSCGKSA-N	448.526	1.173	50	20	IDGD	
CCCCS(=O)(=O)N1CCC[C@H]1C(=O)NNC(=O)c1cc(-c2ccc(C)cc2)[nH]n1	762955074	MOEJRPHEUVKRTE-SFHVURJKSA-N	433.534	1.740	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)c2ccccc2CN2CCOCC2)n[nH]1	763156639	ZUVMTUMFVQQYKU-UHFFFAOYSA-N	435.484	1.992	50	20	IDGD	
O=C(NNC(=O)c1ccccc1Br)C(=O)Nc1cnn(Cc2ccccn2)c1	763482980	QAQCJNKZIFIXHC-UHFFFAOYSA-N	443.261	1.489	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccnn2[C@H](C)CC(C)C)cc(OC)c1OC	763539488	MBSUDCPBZOJGRI-CYBMUJFWSA-N	447.492	1.916	50	20	IDGD	
Cc1ccnc(-c2ccc(NC(=O)C(=O)NNC(=O)[C@H]3COc4ccccc4O3)cc2)n1	763571032	KEXKNQYRZMFQNU-GOSISDBHSA-N	433.424	1.378	50	20	IDGD	
COC(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)COc2ccc(C(C)(C)C)cc2)c1	763594939	NYOOUEUBKLBJBT-UHFFFAOYSA-N	441.484	1.865	50	20	IDGD	
CC(=O)Nc1cc(NC(=O)C(=O)NNC(=O)COc2cc(C)ccc2C)c(F)cc1F	763665556	JVGSPNRZHKUQPX-UHFFFAOYSA-N	434.399	1.705	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2ccc(C)c(OC)c2C)c2ccccc2c1=O	763785655	KSPPAAOGWCQASE-UHFFFAOYSA-N	437.456	1.442	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(C(=O)NCc3ccccn3)c2)cc1	763832417	QUVGPQSHYVZPJZ-UHFFFAOYSA-N	445.479	1.974	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cccc(Cn3cncn3)c2)c1C	763854012	NWFZCCAQGGTRNM-INIZCTEOSA-N	436.472	1.497	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(-c3ncon3)cc2)cc1	763859485	CHEXYBFHFHCQCV-ZDUSSCGKSA-N	439.428	1.689	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccc(N2CCCC2=O)c(F)c1	763866645	XHUBMIIZJHUGFM-GFCCVEGCSA-N	446.410	1.645	50	20	IDGD	
CNC(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CC[C@H](C)C3)cc1	763943794	UPGRUBSOXOUZEP-LBPRGKRZSA-N	428.514	1.561	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)C(=O)Nc1ccc2nc(C(F)F)[nH]c2c1	763995061	LEXSWFLVOWTJAN-UHFFFAOYSA-N	441.192	1.991	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1ccc(C)c(-n2cnnn2)c1	764020083	UHUSXMMRILNVFI-UHFFFAOYSA-N	429.824	1.032	50	20	IDGD	
O=C(Cc1ccc2ccccc2c1)NNC(=O)C(=O)Nc1ccn(Cc2ccccn2)n1	764082428	NGPYGFFLSWENNI-UHFFFAOYSA-N	428.452	1.808	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CCc2ncc(NC(=O)C(=O)NNC(=O)c3ccoc3)cc2C1	764168718	SOBNZQLMARDXSO-CQSZACIVSA-N	443.460	1.456	50	20	IDGD	
CN1CCCN(c2ccc(NC(=O)C(=O)NNC(=O)Cn3ccc4ccccc43)cc2)CC1	764245294	PKEZLZKZFYMFTJ-UHFFFAOYSA-N	448.527	1.569	50	20	IDGD	
C[C@@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)Cc3cccnc3)cc2F)C[C@@H](C)O1	764263859	MMRUQTWQBGJLPV-ZIAGYGMSSA-N	429.452	1.163	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1ccc(Oc2ccc(F)cc2)nc1	764275559	NKOIYADWISOBTQ-UHFFFAOYSA-N	440.387	1.884	50	20	IDGD	
COc1cc(Br)cc(NC(=O)C(=O)NNC(=O)COCc2ccccc2)c1	764366052	JJQYYSUUPIAJID-UHFFFAOYSA-N	436.262	1.760	50	20	IDGD	
O=C(NNC(=O)C(F)(F)Oc1ccccc1)C(=O)Nc1ccccc1C(=O)N1CCCC1	764379370	CRELYYISDXWNPL-UHFFFAOYSA-N	446.410	1.680	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1ccc(OC)c([N+](=O)[O-])c1	764393082	CGARIXWHBJCKAR-UHFFFAOYSA-N	434.430	1.490	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)CSc2ccccc2OC)ccc1C	764397853	NXNYEOHGGDWXHO-UHFFFAOYSA-N	431.470	1.668	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NN=C3[C@@H]4CCCO[C@H]4C3(C)C)CC2)cc1	764816875	DOKXYZKEXDQGQT-GHTZIAJQSA-N	448.589	1.609	50	20	IDGD	
COC(=O)c1ccc2[nH]cc(C=NNC(=O)CN3CCN(C(=O)c4ccccc4)CC3)c2c1	764817533	FPCCVHCQMKZHPS-UHFFFAOYSA-N	447.495	1.863	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)CNC(=O)C3CCCCC3)n[nH]2)cc1OC	765596523	ITIYRNRQGCYBCV-UHFFFAOYSA-N	429.477	1.551	50	20	IDGD	
O=C(CCc1cncc2ccccc12)N1CCN(S(=O)(=O)CBr)CC1	765640531	WVXURLPVPCWBFN-UHFFFAOYSA-N	426.336	1.994	50	20	IDGD	
C[C@@H](CC(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1)C(=O)c1ccccc1	765738551	LXYHTTYKPQSXFJ-SFHVURJKSA-N	436.512	1.501	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@@H](C)NC(=O)c3cccs3)CC2)cc1	765749734	RZEPJCUANUBDOG-QGZVFWFLSA-N	443.573	1.140	50	20	IDGD	
CC(C)CC(=O)NCCC(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	765756063	WHWLEKOHGNOZDB-UHFFFAOYSA-N	437.972	1.157	50	20	IDGD	
Cc1cc(C(=O)NC2CCN(CC(=O)NNC(=O)Cc3ccccc3C)CC2)c(C)o1	766877867	HEWWZRMEWNOTSP-UHFFFAOYSA-N	426.517	1.789	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3cc(OC(F)F)n(C)n3)n[nH]2)cc1OC	767246774	ILBQLQPNSDHXSK-UHFFFAOYSA-N	436.375	1.504	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)c1cc(F)ccc1N1CCOCC1	767336070	JQZYXVIVDICMNA-UHFFFAOYSA-N	429.448	1.518	50	20	IDGD	
CC(=NNC(=O)C[C@H](C(=O)NN=C(C)c1cscn1)N1CCOCC1)c1cscn1	767900891	OCYVBEOBYNELMK-MRXNPFEDSA-N	449.562	1.071	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NC[C@@H]1[C@H]2Cc3ccccc3[C@@H]21	767926172	BHNLMRJZWQZBQH-ZACQAIPSSA-N	427.530	1.818	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(C)(C)O)cc1S(=O)(=O)N[C@@H]1CCCC[C@@H]1C	768245760	FXCBCCVKVBNYJQ-GXTWGEPZSA-N	427.523	1.084	50	20	IDGD	
O=C(Cn1c(S)nc2ccccc2c1=O)NNC(=O)c1cc(-c2cccs2)[nH]n1	768262218	GEGCZQRZRQUYHY-UHFFFAOYSA-N	426.483	1.598	50	20	IDGD	
C=CCOc1cc(OC)ccc1C(=O)N1CCN(S(=O)(=O)CBr)CC1	768386865	GFRINJDYIRYOMB-UHFFFAOYSA-N	433.324	1.700	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cc3c(s2)CC[C@@H](C)C3)cc(OC)c1OCC(N)=O	769375075	IQYGRGYKLOFHAH-LLVKDONJSA-N	447.513	1.829	50	20	IDGD	
CSCCNC(=S)NNC(=O)[C@@H]1CC(=O)N(c2cccc(Br)c2)C1	769764489	CYKVLZLEGROJIV-SNVBAGLBSA-N	431.381	1.660	50	20	IDGD	
C[C@H](NC(=O)NNc1nc(O)c2cnn(C)c2n1)[C@H]1CCCN(C(=O)OC(C)(C)C)C1	770369673	PPLTXGHUEPQSJY-RYUDHWBXSA-N	434.501	1.731	50	20	IDGD	
Cc1cc(C(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)cc(S(N)(=O)=O)c1C	770957798	FPDNBUKEXLPGRE-UHFFFAOYSA-N	433.494	1.308	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)c3ccc(F)c(S(=O)(=O)NC(C)(C)C)c3)nc21	770970408	XXTZHSMEWFCEEJ-UHFFFAOYSA-N	437.457	1.042	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)N[C@H]2CCO[C@@]3(CCOC3)C2)nc1	771435346	QUYIYOHAUMRTQF-KSSFIOAISA-N	427.527	1.076	50	20	IDGD	
O=C(CCN1C(=O)[C@H]2[C@H](C1=O)[C@H]1CC[C@H]2O1)NNc1ccc(Br)c(F)c1	771682795	YTVSRVUJYNKRIV-QHSBEEBCSA-N	426.242	1.584	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)c1ccc(I)c(N)c1	772183441	XYXPDIWLZRPAQI-SECBINFHSA-N	433.246	1.612	50	20	IDGD	
Cc1sc2ncn(CC(=O)NNC(=O)C(=O)NCc3ccc(Cl)cc3)c(=O)c2c1C	772195719	ORZCMIKQDKOWOR-UHFFFAOYSA-N	447.904	1.192	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)C[C@H](O)c2cccc(F)c2)c1	772556400	VZTUHSXEAQUWIC-SFHVURJKSA-N	437.493	1.741	50	20	IDGD	
COC(=O)c1ccccc1CC(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	775747526	MNLSTTGONFKPQB-UHFFFAOYSA-N	434.493	1.746	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)N[C@@H](c1ccc(C(C)(C)C)cc1)C(F)(F)F	775953848	BBWZTOOTPNXDTE-MFKMUULPSA-N	438.472	1.856	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)N[C@H](C)CS(=O)(=O)c1ccc(C)cc1	776195771	QVHVOKXPWABWOL-MRXNPFEDSA-N	449.529	1.965	50	20	IDGD	
CN(NC(=O)CN1CCCCCCC1=O)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776201968	OAFDOWKUDZCPKK-UHFFFAOYSA-N	425.530	1.415	50	20	IDGD	
COCCO[C@H]1COCC[C@@H]1NC(=O)NNC(=O)c1ccc(COc2ccccc2)o1	776845247	UMMCLLGNVDAEJI-HKUYNNGSSA-N	433.461	1.623	50	20	IDGD	
COc1c(F)cc(S(=O)(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)cc1[N+](=O)[O-]	777600573	WGGDLQGXCVFVGS-UHFFFAOYSA-N	440.409	1.308	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)N1CCN(S(=O)(=O)CBr)CC1	777833594	XIIHIZUBBNALST-LBPRGKRZSA-N	440.360	1.212	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)[C@@H]2CC(=O)N(Cc3ccc(OC)cc3)C2)nc1C	778427758	FKMSRRBRHOPZCL-OAHLLOKOSA-N	427.461	1.462	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)c1cnc2ncc(Br)cc2c1	780159192	NCPSJIFLPDFSNV-HNNXBMFYSA-N	429.230	1.993	50	20	IDGD	
COC(=O)CCCC(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccc(OC)cc2)c1	780979871	YLMGVBLEFMPLQP-UHFFFAOYSA-N	449.485	1.600	50	20	IDGD	
O=C(NNc1ncncc1Cl)c1ccc2c(c1)S(=O)(=O)N(C[C@@H]1CCCO1)C2=O	781820702	YUFAUVKGBVCQMN-NSHDSACASA-N	437.865	1.210	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)NCc2cccc(S(=O)(=O)N(C)C)c2)c1	782535740	BDILPJDPAFAXGO-UHFFFAOYSA-N	436.490	1.098	50	20	IDGD	
COC(=O)CN1CCN(c2ccc(NC(=O)C(=O)NNc3ccc(OC)cc3)cc2)CC1	783038083	ZWBNWTVWJCYYDU-UHFFFAOYSA-N	441.488	1.072	50	20	IDGD	
Cn1c(=NNC(=O)C(=O)Nc2ccccc2C(=O)N2CCOCC2)sc2ccccc21	783349519	KVWDJPOOSUCLFP-UHFFFAOYSA-N	439.497	1.283	50	20	IDGD	
Cn1c(=NNC(=O)C(=O)Nc2ccc(C[C@H]3CC(=O)NC3=O)cc2)sc2ccccc21	783351067	FYNVUMKVMKRHCO-ZDUSSCGKSA-N	437.481	1.016	50	20	IDGD	
NC(=O)COc1cccc(NC(=O)C(=O)NNc2nc(-c3ccc(Cl)cc3)no2)c1	784796080	ZQXFDWPCAOHYDA-UHFFFAOYSA-N	430.808	1.336	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)NC(C)(C)C)n(CCC#N)n1	784833289	MRJNRILVJLZJJR-UHFFFAOYSA-N	447.521	1.264	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)[C@@H]3CCC(=O)N3C)c2)c(C)c1	784976309	NUURFUKOLXXZSU-SFHVURJKSA-N	444.513	1.486	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)C(=O)Nc1cccc(CCN2CCCC2)c1	785068655	ZGTYSFFVSDEFMX-UHFFFAOYSA-N	434.500	1.301	50	20	IDGD	
COc1ccc(C(=O)NNc2ccc(-n3ccnc3)nn2)nc1I	788178377	NWHIQVPSMZEJKQ-UHFFFAOYSA-N	437.201	1.427	50	20	IDGD	
CS(=O)(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cccc3ncccc23)ccc1Cl	788334665	ZWQSTVORCVLWNH-UHFFFAOYSA-N	446.872	1.691	50	20	IDGD	
CC(C)Oc1cc(NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)ccc1C(N)=O	788774552	IWMXCBIWVYBZTH-UHFFFAOYSA-N	438.444	1.286	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)NCCCCn1cc(Br)cn1	792223318	XDRLNGUMOCXIKU-UHFFFAOYSA-N	428.262	1.974	50	20	IDGD	
CC(C)NC(=O)NC1(C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)CCCCC1	792289472	KCAVNCGCMRUHJI-UHFFFAOYSA-N	427.546	1.849	50	20	IDGD	
O=C(CCCc1nc(O)c2ccccc2n1)NNC(=O)CNC(=O)OCc1ccccc1	794076376	NQMADRNJJNYIGB-UHFFFAOYSA-N	437.456	1.732	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)CNC(=O)c2cccs2)c(Br)c1	794585778	XAJLKPJQYCJCMY-UHFFFAOYSA-N	448.320	1.259	50	20	IDGD	
CC(C)Oc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)cc1C(N)=O	796989497	FQZWUPYVFKYEKB-LBPRGKRZSA-N	446.435	1.265	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CO[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1C	798309027	FSIWXBWOUAJZNU-QGZVFWFLSA-N	448.520	1.805	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ccc(C#N)cc2C(F)(F)F)cc1S(N)(=O)=O	799841776	OOKAITKTXCEUSE-UHFFFAOYSA-N	441.391	1.615	50	20	IDGD	
Cn1c(=O)n(C)c2cc(N3CCCCC3)c(NC(=O)C(=O)NNC(=O)C3CCCC3)cc21	800623058	FFDZNWCADNKMDD-UHFFFAOYSA-N	442.520	1.143	50	20	IDGD	
Cc1c([N+](=O)[O-])ccc(F)c1NC(=O)C(=O)NNC(=O)c1cnn(-c2ccccc2)c1	800623637	TVZARQWGVKJMEK-UHFFFAOYSA-N	426.364	1.628	50	20	IDGD	
Cc1c(NC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)nnn1Cc1ccccc1F	801804582	NUTFRTAMNBWENL-KRWDZBQOSA-N	426.408	1.767	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Nc2ccc(Br)cc2)sc1S(N)(=O)=O	801995520	KDOBIPSTRMQMHX-UHFFFAOYSA-N	449.308	1.633	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)CCOCC(F)(F)C(F)(F)F)cc1	802065990	GTXWVFANOXELRK-UHFFFAOYSA-N	433.355	1.847	50	20	IDGD	
C[C@@H](C(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)n1ccc2ccccc2c1=O	805628048	FMKSUFZDDOYYTE-ZDUSSCGKSA-N	438.396	1.475	50	20	IDGD	
Cc1cc([N+](=O)[O-])ccc1NNC(=O)C(=O)Nc1cccc(N2CCCS2(=O)=O)c1	807456434	MCLAZZBAYYZZMR-UHFFFAOYSA-N	433.446	1.525	50	20	IDGD	
Cc1ccc(Br)c(S(=O)(=O)NCCNC(=O)NNC(=O)c2ccc[nH]2)c1	807563428	JKPIRYFDGMVBCY-UHFFFAOYSA-N	444.311	1.008	50	20	IDGD	
NC(=O)c1ccc(NC(=O)C(=O)NNc2ncccc2C(F)(F)F)c(OCC(F)F)c1	810391795	IIADOUZNJUQUQO-UHFFFAOYSA-N	447.320	1.925	50	20	IDGD	
Cc1cc(S(=O)(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)ccc1C(F)(F)F	811677724	IEAKZLJCFMLBAN-UHFFFAOYSA-N	426.380	1.613	50	20	IDGD	
COc1ccc(CNC(=O)NNC(=O)Nc2ccc(C)cc2Cl)cc1S(N)(=O)=O	812431854	RHFUVJJXNYAUND-UHFFFAOYSA-N	441.897	1.840	50	20	IDGD	
COC(=O)c1cn(-c2cccc(NC(=O)C(=O)NNc3cnc4ccccc4n3)c2)nn1	812981380	XNJLUDDUDBCPRO-UHFFFAOYSA-N	432.400	1.079	50	20	IDGD	
COC[C@]1(C(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)CCN(C(=O)OC(C)(C)C)C1	813373836	JGURYFQCGQXWTL-QFIPXVFZSA-N	448.520	1.663	50	20	IDGD	
COC(=O)C12CCC(C(=O)OCC(=O)NNC(=O)c3ccc(OC)c(OC)c3)(CC1)CC2	814591064	UPWXGZQDIGDWQL-UHFFFAOYSA-N	448.472	1.522	50	20	IDGD	
CCCN1C(=O)c2ccccc2N2C(=O)CC[C@@]12C(=O)NNC(=O)NCc1ccco1	814625422	CUMSQFGAFYTLOJ-OAQYLSRUSA-N	425.445	1.499	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1nc(CC(F)(F)F)cs1	815565269	ILZKTIHTDTXYJZ-UHFFFAOYSA-N	446.407	1.812	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cn(Cc3ccccc3)nn2)o1	815568283	BULGJQOKTAVNBC-UHFFFAOYSA-N	439.476	1.161	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCc2nncn2C1)C(=O)Nc1cc(Cl)ccc1OC1CCCC1	815692389	PXKUKDALRRMRAM-GFCCVEGCSA-N	446.895	1.601	50	20	IDGD	
CCCOC(=O)c1cc(Br)ccc1NC(=O)C(=O)NNC(=O)[C@H]1CCCO1	815778322	MDAPSTWPWSUKLQ-CYBMUJFWSA-N	442.266	1.281	50	20	IDGD	
Cc1cc(C(=O)NCC(=O)NNc2ccccc2S(=O)(=O)N(C)C)ccc1[N+](=O)[O-]	817054633	RBZSNUGTJKGXKX-UHFFFAOYSA-N	435.462	1.027	50	20	IDGD	
O=C(Cn1cnc2ccccc21)NNC(=O)c1sccc1S(=O)(=O)N1CCCC1	822780356	IDDSKGPRLZHHLP-UHFFFAOYSA-N	433.515	1.344	50	20	IDGD	
C[C@H]1CC(C)(C)C[C@]2(C1)NC(=O)N(CC(=O)NNC(=O)COc1ccccc1F)C2=O	864019977	WUAFJPMHFPHIQW-ZSEKCTLFSA-N	434.468	1.489	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C1=NN(c2ccc(F)cc2)[C@H](C(N)=O)C1	913465466	CHEHFDCGOMQDLH-KRWDZBQOSA-N	427.436	1.035	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)c1cn(-c2ccccc2Br)nn1	914832238	PJCSWRDRRLEYFD-UHFFFAOYSA-N	445.277	1.912	50	20	IDGD	
CC(=O)Nc1ccc(NC(=S)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1	915117527	LAGUSLUHMOTJJX-UHFFFAOYSA-N	441.922	1.577	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)N2CCN(C(=O)CN(C)C)CC2)c(C)n1C[C@H]1CCCO1	915267770	RZJMSYPEPSECJC-DMMSUNFISA-N	427.549	1.423	50	20	IDGD	
COCc1ccccc1CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	916425706	SQHUQJDMKKMQJS-UHFFFAOYSA-N	446.529	1.762	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)N[C@H]1CCN2CCC[C@@H]2C1	916573906	SJAWTPOYGCKQIE-ZWKOTPCHSA-N	449.577	1.432	50	20	IDGD	
CC(C)N1C(=O)c2ccc(C(=O)NNC(=O)COc3ccccc3F)cc2S1(=O)=O	916741346	YGXHFNAUISGEIE-UHFFFAOYSA-N	435.433	1.219	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)CNC(=O)c1c[nH]c2ccccc2c1=O	917920434	UJYBHLKPZCPSRT-UHFFFAOYSA-N	446.467	1.018	50	20	IDGD	
CC(=O)Nc1ccc(S[C@H](C)C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1	917926291	VTINWRRBRNTJJW-GFCCVEGCSA-N	425.474	1.563	50	20	IDGD	
COc1c(F)cc(CC(=O)NNC(=O)c2ccc3ccccc3c2)cc1S(N)(=O)=O	918110540	HRXKWXDYCUSIIU-UHFFFAOYSA-N	431.445	1.639	50	20	IDGD	
O=C(NC[C@H]1CCCOC1)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	918123904	DEEHBJVEFJDBDY-QGZVFWFLSA-N	435.484	1.815	50	20	IDGD	
CCC(=O)N1CCCC[C@@H]1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	918541034	OUAYKUMERVDDBB-QGZVFWFLSA-N	436.534	1.023	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2cnn(CCOC)c2)c1	918542626	BLQZHTSSFDXJKR-UHFFFAOYSA-N	438.510	1.027	50	20	IDGD	
O=C(NNC(=O)N1CCCN(Cc2ccc(F)cc2)CC1)c1ccc(-n2cnnn2)cc1	918779434	SWPITTAPBVRWOG-UHFFFAOYSA-N	438.467	1.364	50	20	IDGD	
Cc1nc(-c2ccc(Cl)cc2)sc1C(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1	919888247	BGNXHFHDWUZMEQ-LBPRGKRZSA-N	428.923	1.903	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)NCCN2CCN(Cc3ccccc3)CC2)cc1	919902462	GWFOWWVQSRXZQY-UHFFFAOYSA-N	439.560	1.776	50	20	IDGD	
CCN(CC)C(=O)c1ccc(S(=O)(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1	920308529	XTFQYPUHVQMPOQ-SFHVURJKSA-N	433.486	1.318	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@H](CCSC)N2C(=O)[C@@H]3CCCC[C@H]3C2=O)cc1	1115817506	IPQHTQRMGGTREL-ZACQAIPSSA-N	433.530	1.753	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN2CCC[C@@H](c3n[nH]cc3NC(C)=O)C2)cc1C	1116512097	UMPYGCPVVHSKPX-CQSZACIVSA-N	432.550	1.941	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)[C@H]2CC[C@@H](C(F)(F)F)NC2=O)CC1	1318622985	SWZBUQRYGPGIGO-RYUDHWBXSA-N	436.431	1.238	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4cnccc4n3)C2)C1	1777734507	XUTIGPNFZPVVPG-NRFANRHFSA-N	428.565	1.925	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(CCN(C(=O)/C=C3\C(=O)Nc4ccccc43)C2)C1	1778905464	GFRPOTNBLDSHGW-SJAXDAAESA-N	443.576	1.704	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)C#CC3(O)CCCCC3)C2)C1	1779066625	BPSSQWSHWXEVGW-UZLBHIALSA-N	441.366	1.688	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CN1CCOCC1)C2	1780713467	TZBRISZMYMFOIH-AYOQOUSVSA-N	436.380	1.069	50	20	IDGD	
Cc1ncccc1CCC(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781325510	DQGYNCQWHVPAGL-AEFFLSMTSA-N	428.302	1.843	50	20	IDGD	
Cn1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)c(C(F)F)n1	1781329758	JMFAWOJKXDMKHO-IAQYHMDHSA-N	439.232	1.492	50	20	IDGD	
O=C(c1cc2ccoc2cn1)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781334556	YOUQLDGKDQCFEK-PBHICJAKSA-N	426.242	1.962	50	20	IDGD	
CCN1CCC(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](Cl)COC)C2)CC1	1782177805	CPBDGSZBTMSWRM-WAOWUJCRSA-N	429.989	1.486	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)COc3ccc(O)cc3)[C@H]2C1	1783841966	UXCXNJHGVKYECX-SNRMKQJTSA-N	436.581	1.602	50	20	IDGD	
CC(C)c1nc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)C(C)(C)CCl)[C@H]3C2)no1	1783846261	NWPIWQMPWVYURV-KKUMJFAQSA-N	426.945	1.980	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3nc4cc(C)c(C)cc4[nH]3)CCO2)C1	1783877457	IZOIEDVSTZVDNN-VFNWGFHPSA-N	434.924	1.877	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C=C/C(=O)NCc3ccccc3)[C@H]2C1	1784055009	MNEHBJYCJQQDIN-JSJLCOFSSA-N	447.963	1.856	50	20	IDGD	
Cc1nc2cc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]4C3)ccc2s1	1784092119	HINRICFECWOJEQ-OTRWWLKZSA-N	437.949	1.798	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3COc4ccccc4O3)[C@H]2C1	1785039556	FIZGHLQNNLAKKD-CPLUKWAASA-N	448.592	1.658	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(C)(C)NCCC#N)[C@H]2C1	1786859826	IRIRXBDBLFDWIE-JONQDZQNSA-N	443.386	1.421	50	20	IDGD	
C[C@H](CBr)C(=O)NC1(c2ccc(NC(=O)CN3CCNC3=N)cc2)CCC1	1788013078	UPIOVSQILVXTJM-CYBMUJFWSA-N	436.354	1.991	50	20	IDGD	
CCc1oncc1C(=O)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1	1788145909	DOCHPFXCMJUYET-UHFFFAOYSA-N	433.273	1.978	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)c1cc2n(n1)CCC2	1788415053	RGJQSGCZPVCGQA-LVGORTOPSA-N	429.290	1.113	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(-n4cccn4)nc3)[C@H]2C1	1788984305	TZCPUAWRNBAVSW-FJIDUMEYSA-N	431.924	1.878	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)c1cc2cccnn2c1	1790434355	QYKLJURIBDOZRJ-DDWPSWQVSA-N	439.285	1.618	50	20	IDGD	
N#Cc1ccccc1OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]2C1	1791297882	KLIDQRWTOMCLRZ-DZKIICNBSA-N	426.300	1.720	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)c1cc(Br)ccc1F	1792692761	DROCDBKBPBYJPY-OWLDWWDNSA-N	449.704	1.391	50	20	IDGD	
COc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)CBr)C3)cn1	1793567610	FFJDAXHZJGLHNG-OEYIWLLWSA-N	426.311	1.324	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)[C@H]1CCCN(Cc2ccccc2)C1	1793750793	NWOWOJFHUQSCLJ-AFDCHOCNSA-N	449.979	1.088	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1CCN(Cc2ccccn2)CC1	1794161401	NETABNUHNPMGNL-YHELAOLJSA-N	448.995	1.901	50	20	IDGD	
Cn1nncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1794517292	CKZSEURELWLYFM-CRWXNKLISA-N	440.932	1.199	50	20	IDGD	
CC(C)(C)n1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)n1	1794739619	BVWCXYAUFQOKHE-QDMKHBRRSA-N	439.520	1.202	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1COc3ccccc3O1)C2	1795111455	PCJGPQCQKJDIAU-VLWCASSMSA-N	439.306	1.201	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cncc(F)c1	1795222523	QUUUOPWYMPBPEJ-FQKKEUPESA-N	426.452	1.607	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](O)c1ccccc1	1795382311	SSVGESPYIWSSQG-BTYMGIQYSA-N	425.323	1.341	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1sc2nccnc2c1N	1795704487	IVGFRHQIODKCMH-OPDFLTKYSA-N	437.953	1.884	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)c1nc(-c2ccccc2)ns1	1795916927	IURZCOODYHMJAP-XGUBFFRZSA-N	436.921	1.008	50	20	IDGD	
COc1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)c(F)c1	1796189477	RMKGJQUBLYFRCI-BJWYYQGGSA-N	426.253	1.080	50	20	IDGD	
O=C(CCc1c[nH]c2ncccc12)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1	1796192869	VFZWGKXXBNQXHT-ACDBMABISA-N	446.316	1.127	50	20	IDGD	
O=C(/C=C/C(=O)c1cccs1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2	1796446841	ISFAOHPEGCVGGC-JMAOVPHRSA-N	445.310	1.767	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cn1c(=O)n(C)c2ccccc21	1797750339	RAOQPFNKWXBJHI-QKPAOTATSA-N	434.924	1.232	50	20	IDGD	
O=C(CS[C@@H]1CCCCO1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2	1797793764	ZQVIUSOXBOPKED-DLTLXFJOSA-N	435.384	1.621	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1C[C@@H]1c1ccc(F)c(F)c1)C2	1800970677	GYZLWUCZDZPEIO-XPYFFNBCSA-N	442.890	1.912	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(OC)c(Cl)c1	1801792889	APNKURYHVPDHOA-YXPYIKCWSA-N	431.316	1.806	50	20	IDGD	
C=CCC(CC=C)C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1803082070	NICHMTPVDRQSMV-GMAHTHKFSA-N	447.344	1.849	50	20	IDGD	
COc1ccccc1OCC(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1	1803136588	DBTZOXDSTOOYGD-WWMYMODYSA-N	447.919	1.775	50	20	IDGD	
CC(=O)N[C@H](C(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)C(C)(C)C	1803377701	JTKKUSRDCIERAU-XWTMOSNGSA-N	438.956	1.238	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@@H]1c1cccnc1)c1ccc(O)nn1	1805274757	GTXATFRUDLMRNY-GLQYFDAESA-N	438.257	1.587	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2ccn(C)c2)[C@H]1c1cccnc1	1805294858	HRNSKQXYEZDITL-LAUBAEHRSA-N	426.521	1.113	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC2(CCN(C(=O)Cn3ccncc3=O)CC2)C1	1805388809	HBJKGELVDWZRHE-OAHLLOKOSA-N	439.354	1.506	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)c2cnc[nH]2)[C@H]1c1cccnc1	1805571100	FSOTVUBNZDFTQE-PAAWNMQJSA-N	448.487	1.258	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)ccn1	1807361449	QAHCTMXKCLHEIN-IFMALSPDSA-N	444.300	1.098	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)c2cc[nH]n2)[C@H]1c1cccnc1	1808407797	DQEJDDBRWKJTID-VQMZYRHSSA-N	448.487	1.258	50	20	IDGD	
Cc1c(F)ccc(C(=O)N2CCCC3(CCN(C(=O)CCC(=O)NN(C)C)CC3)C2)c1N	1809925535	FBGIJDHUIYAIRP-UHFFFAOYSA-N	447.555	1.934	50	20	IDGD	
Cc1ccsc1C(=O)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1	1809968400	ZLEJRSKJIYIFSH-UHFFFAOYSA-N	426.347	1.895	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)/C=C/C2CC2)[C@@H]1c1cccnc1	1810296043	ZQGITIJHSIXBHF-QNIGJGFBSA-N	434.500	1.366	50	20	IDGD	
CC(=O)C(C)(C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1815077189	KRCXAELGYHKMAS-QGZVFWFLSA-N	426.282	1.011	50	20	IDGD	
Cc1ccncc1C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1	1815340038	CBVANTDSYXVAIE-OAHLLOKOSA-N	436.302	1.066	50	20	IDGD	
Cc1nc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)cs1	1816580062	WHINLFONSDAHMB-HNNXBMFYSA-N	433.538	1.854	50	20	IDGD	
CNC(=S)NCCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCBr)n[nH]1	1816781854	HNGOWQFISJSTRZ-GFCCVEGCSA-N	445.387	1.671	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H]2CCC(=O)N2)n[nH]1	1816972716	FWWAXAHEBSLCQJ-GVXVVHGQSA-N	426.315	1.854	50	20	IDGD	
C[C@H](NC(=O)c1ccccn1)C(=O)N[C@H]1CCc2nc(NC(=O)[C@H](F)Cl)sc2C1	1817132878	AMWJWQIACSVJPF-BHDSKKPTSA-N	439.900	1.803	50	20	IDGD	
Cc1ccc(CC(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)cc1	1817473389	QUPKVDOWOWPWSD-OAQYLSRUSA-N	446.316	1.947	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)Cc2cccs2)[nH]n1)c1cccc(B(O)O)c1	1817475563	UGGRIQOXGCGFHP-SFHVURJKSA-N	438.318	1.700	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](F)Br)[nH]n1	1817994531	VWBZXLJWEDTVLV-PEXQALLHSA-N	433.282	1.539	50	20	IDGD	
COCc1oncc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1	1818357189	NHDOVMGBEBKMHT-OAHLLOKOSA-N	447.496	1.223	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)CCBr)[nH]n1)c1nc2ncccn2n1	1818616676	AKUCGCMFHQGVBG-GFCCVEGCSA-N	447.297	1.938	50	20	IDGD	
O=C1COc2ccc(C(=O)Nc3cc([C@@H]4CCCCN4C(=O)[C@H](O)CCl)[nH]n3)cc2N1	1819100807	FLPCABXEHQOPAV-LSDHHAIUSA-N	447.879	1.646	50	20	IDGD	
CC[C@H](C)[C@H](N)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819402120	NWZOVJBKADKOOH-XZOAIXRZSA-N	442.524	1.088	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC([C@H]2CCCCN2C(=O)C2=NN(C)C(=O)CC2)CC1	1824927263	APFIKVDGPJJHBG-CZUORRHYSA-N	441.370	1.998	50	20	IDGD	
CC(=O)N(C)CCC(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](C)Br)sc2C1	1825635770	KLAXYUSFWUJKKC-GXSJLCMTSA-N	431.356	1.707	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)COc3cccnn3)sc2C1	1826764888	AZCPOMKWGWNSIX-QWRGUYRKSA-N	425.898	1.178	50	20	IDGD	
Cc1cc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)cnc1C	1827049994	CTMRFNVSLOLVJB-HSZRJFAPSA-N	449.360	1.925	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC[C@@H]1C1CCN(C(=O)[C@H]2CC[C@H](O)CC2)CC1	1827060249	CPGYUYSYTLSCGP-STZQEDGTSA-N	442.365	1.151	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1	1829102253	MAWBUKKAJITYQR-HXUWFJFHSA-N	446.429	1.451	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(Cl)nc3)CCO2)C1	1829511797	FOEPRJKJRYYNGH-YVEFUNNKSA-N	446.729	1.588	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)COc3cccnc3)C2)C1	1830359208	WKFXOXPDVXYBCH-FQEVSTJZSA-N	425.913	1.182	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)C/N=C/c3ccco3)C2)C1	1830365418	XLSZMDLKTPCHOE-WNBNNUDTSA-N	425.913	1.420	50	20	IDGD	
CC(=O)C(C)(C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)CBr)C2)C1	1831117202	RLHPJVFAKNMHAT-UGSOOPFHSA-N	433.343	1.089	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3nnc(C)s3)C2)C1	1831641337	YEBDMNPDXXSQIK-BEFAXECRSA-N	444.985	1.643	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3[nH]nc4ccncc34)C2)C1	1831647141	RAWGFFQGQUXAFN-MGPUTAFESA-N	435.912	1.435	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)C[C@@H](NC)C(=O)O)CC2)CC1	1833532482	REJGGRZFNUZKMC-IAGOWNOFSA-N	430.977	1.028	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCBr)C3)C2)nc1C	1833690099	WFVWVSIWGVHVMG-LJQANCHMSA-N	440.338	1.553	50	20	IDGD	
Cc1nc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)cs1	1834456320	KXIJZYLUKFKOQD-GOSISDBHSA-N	427.599	1.373	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)CN3CCCCC3)CC2)CC1	1834613755	SHGYWFUGRAVJLM-LJQANCHMSA-N	429.005	1.298	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3ccn4nccc4c3)CC2)CC1	1835630632	LEZLWBHMKKWZES-FQEVSTJZSA-N	447.967	1.773	50	20	IDGD	
O=Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCBr)C3)C2)s1	1835941189	WNUGKVJPIRMIFL-QGZVFWFLSA-N	445.335	1.416	50	20	IDGD	
C#CCO[C@@H](C)C(=O)N1CCC(N2CCC(NC(=O)[C@H](F)Br)CC2)CC1	1836413380	FBNHHFYWUPMGDP-BBRMVZONSA-N	432.334	1.287	50	20	IDGD	
O=C(COC1CCCCC1)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836624465	NTSJTFYYANKHOR-LJQANCHMSA-N	430.973	1.934	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C4CC4)on3)C2)C1	1837708856	QNLIGELKCNLXJF-FQEVSTJZSA-N	437.569	1.474	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3sccc3F)C2)C1	1837710321	VDQCBPBUALADGB-GOSISDBHSA-N	430.574	1.809	50	20	IDGD	
Cc1cnoc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)CBr)C2)C1	1838389306	BUAYBOSFIFDRHU-SJKOYZFVSA-N	430.299	1.084	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(F)c3)CCO2)C1	1838909215	RVDYGEZECQJQIW-IFXJQAMLSA-N	443.313	1.927	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4c(cnn4C)c3)C2)C1	1839145203	YRBLXBFROBJDCZ-LAUBAEHRSA-N	434.924	1.661	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccccn3)C2)C1	1839152330	WOQAERVWOSBOPD-RBUKOAKNSA-N	430.332	1.317	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(O)nc3)C2)C1	1839153830	SWLTYLABVWPYAE-MSOLQXFVSA-N	432.304	1.094	50	20	IDGD	
O=C(c1ccc(Cl)c(F)c1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1	1839269673	QSMKIKOIIVVREY-YJBOKZPZSA-N	435.279	1.149	50	20	IDGD	
O=C(c1cc(O)c(O)c(Cl)c1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1839434022	JFHXWXMUTHLHLJ-WMLDXEAASA-N	437.251	1.356	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)C[C@@H]3CCCCO3)C2)C1	1839962561	KLUANUNPUOKXCV-BXWFABGCSA-N	447.370	1.576	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)C(C)(F)F)C2)C1	1840030634	QZZMHTGKICSUAW-SJCJKPOMSA-N	441.313	1.908	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ncccc3F)C2)C1	1840034658	SCGSLYOPXCRBCK-YVEFUNNKSA-N	430.274	1.074	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(F)c3C)C2)C1	1840149202	HSHNGKIGSIJKHP-UZLBHIALSA-N	428.888	1.458	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3CCCCC3(F)F)C2)C1	1840150126	FRRBJHWNNVNDTJ-VKJFTORMSA-N	438.899	1.522	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(F)c(F)c3C)C2)C1	1840156873	XCSGETACDOLBSV-YWZLYKJASA-N	446.878	1.597	50	20	IDGD	
C#CCCCCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](Br)CC)C2)C1	1840295117	WXGHVZCCHPFDFL-VQIMIIECSA-N	429.355	1.810	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCn3nc(C)cc3C)CCO2)C1	1840347823	ZDJWIAQLUHEFPM-PXNSSMCTSA-N	426.945	1.364	50	20	IDGD	
C[C@@H](Cc1ccco1)C(=O)N1CCO[C@@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1	1840470963	IRWGCWCUJIPRCI-LAUBAEHRSA-N	438.597	1.766	50	20	IDGD	
C[C@H]1CC[C@@H](C(=O)N2CC3(CCCN3C(=O)[C@H](O)CCl)C2)N1C(=O)OC(C)(C)C	1841348793	SFIVTFSFVLYRDU-SOUVJXGZSA-N	429.945	1.578	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCCC12CN(C(=O)[C@@H]1[C@H]3COC[C@H]31)C2	1841925660	TYUIJKNBQOFOEL-LJISPDSOSA-N	427.929	1.214	50	20	IDGD	
CC(C)[C@@H](C(=O)N1CC2(CCCN2C(=O)c2cnccc2C(=O)NN)C1)c1ccccc1	1844263637	ZUCDWWMAUJXQOB-HXUWFJFHSA-N	435.528	1.942	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC2(CCCN2C(=O)[C@H](C)NC(=O)c2ccccn2)C1	1845770661	WQPBTYAPEBJQAK-KBPBESRZSA-N	437.338	1.577	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC12CN(C(=O)C(F)(F)C(F)(F)C(=O)O)C2	1846068907	USGVPFNPOZOZSK-QMMMGPOBSA-N	433.196	1.719	50	20	IDGD	
O=C(c1c(C(F)(F)F)nc2ccc(F)cn12)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl	1847562699	KCAQZPOFZGVZEW-SDDRHHMPSA-N	448.804	1.907	50	20	IDGD	
Cc1nc(COc2ccc(Cl)cc2)sc1C(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1	10213898	YSTIJBWMQROTQS-LLVKDONJSA-N	443.934	1.880	50	20	IDGD	
O=C(COC(=O)COc1cccc(N2CCCC2=O)c1)NNC(=O)c1ccc(Cl)cc1	10604441	LMMWSSQKFFSVBN-UHFFFAOYSA-N	445.859	1.850	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(CCC(=O)NNC(=O)c2ccc3c(c2)OCO3)cc1	14800525	WFLSECYFJPITER-UHFFFAOYSA-N	447.513	1.840	50	20	IDGD	
O=C(COc1ccc(Br)cc1F)NNC(=O)[C@H]1COc2ccccc2O1	15794920	RPCVUXDSUXGBBH-OAHLLOKOSA-N	425.210	1.954	50	20	IDGD	
CCc1ccc(CCC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1	19172872	XOEOJZBXDVLTJA-UHFFFAOYSA-N	445.541	1.664	50	20	IDGD	
COc1cc(C(=O)NNC(=O)COc2ccc3ccc(=O)oc3c2)cc(OC)c1OC	26687471	XFMPGIMBUCCNIN-UHFFFAOYSA-N	428.397	1.659	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C1=NN(Cc2ccc(F)cc2)C(=O)CC1	107840081	MSNACJRTQNBITQ-UHFFFAOYSA-N	442.447	1.929	50	20	IDGD	
COc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NNC(=S)Nc2ccccc2OC)cc1	725908719	QBIWOBLIDQZNBT-LBPRGKRZSA-N	438.531	1.388	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)CNS(=O)(=O)c2ccc3c(c2)COC3)c1C	726382484	STDGXCUZIPNXMK-OAHLLOKOSA-N	447.513	1.227	50	20	IDGD	
CCc1nc(CCNC(=O)NNc2ccc(S(=O)(=O)N(CC)CC)cn2)cs1	726716463	CPTKMOQODRPZGR-UHFFFAOYSA-N	426.568	2.000	50	20	IDGD	
O=C(NNS(=O)(=O)c1csc(-c2ccc(Br)cc2)n1)N1CCOCC1	726930001	BCMOHBGWGSPQGQ-UHFFFAOYSA-N	447.336	1.808	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)CN(C)C(=O)[C@@H](C)n2cccn2)c1	728526344	RVAVMISCFBOFBX-LLVKDONJSA-N	438.282	1.135	50	20	IDGD	
COCCNS(=O)(=O)c1cccc(C(=O)NNC(=O)c2cccc(OC(F)F)c2)c1	728545457	JBEDDSBBAJZTFC-UHFFFAOYSA-N	443.428	1.288	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCN(c2ccc(F)cc2)C1=O)C1CCN(c2ncccn2)CC1	728890436	QONDAUWJYMNYFI-KRWDZBQOSA-N	426.452	1.033	50	20	IDGD	
CC(C)(C)OC(=O)N1CCCN(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)CC1	728960174	VMSKUTJKRVEEEY-UHFFFAOYSA-N	447.540	1.377	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])cc1C	731050382	IUKFBAUNIZDAPX-UHFFFAOYSA-N	434.836	1.821	50	20	IDGD	
O=C(CCCS(=O)(=O)c1ccc(Br)cc1)NNC(=O)NCC(F)(F)F	731059334	OJBABEJHGDNLFM-UHFFFAOYSA-N	446.245	1.896	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)NC1CCN(CC(=O)N(C)C)CC1	731762018	WCZIJJIGGJJKCJ-UHFFFAOYSA-N	444.561	1.615	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)Cc2cn3cccc(C)c3n2)cc1OC	731914118	VNWQXXHPGXMJON-UHFFFAOYSA-N	426.429	1.207	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)NCC(=O)N1CCN(C(=O)OC(C)(C)C)CC1)c1ccccc1	732245299	XXMWYLKWIUMEOF-KRWDZBQOSA-N	447.536	1.590	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NCc2nc(-c3ccc(OC)cc3)n[nH]2)cc1	741415389	BLEYQNZYNPVUSZ-UHFFFAOYSA-N	426.433	1.398	50	20	IDGD	
Cc1ccc(C=NNC(=O)C[C@H](C(=O)NN=Cc2ccc(C)cc2)N2CCOCC2)cc1	741766898	QAEOMQFJNIERHS-JOCHJYFZSA-N	435.528	1.995	50	20	IDGD	
Cc1nn(C)c2sc(C(=O)N[C@@H](C)C(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)cc12	742031778	OGYDIPLYTLLWFX-JTQLQIEISA-N	430.446	1.431	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCN(c2cccc(Cl)c2)C1=O)c1nnc(O)c2ccccc12	742034278	LHUNWBQLHRTIHH-OAHLLOKOSA-N	425.832	1.803	50	20	IDGD	
O=C(CCN1C(=O)[C@H]2[C@H](C1=O)[C@H]1CC[C@H]2O1)NNc1ccc(C(F)(F)F)cc1[N+](=O)[O-]	743297601	TWYTULRWOGMVMU-QHSBEEBCSA-N	442.350	1.609	50	20	IDGD	
C[C@@H]1CCCN(CCCCNC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)C1	743547722	FFPATHJKPLOIBO-OAHLLOKOSA-N	425.555	1.938	50	20	IDGD	
Cc1cc(=O)oc2cc(OCC(=O)NNC(=O)Nc3ccc(S(C)(=O)=O)cc3)ccc12	743830287	BDTIMZQTBAFJQS-UHFFFAOYSA-N	445.453	1.737	50	20	IDGD	
O=C(NNC(=O)c1ccc(CN2C(=O)CNC2=O)cc1)Nc1ccc(OC(F)F)cc1	743832824	CJOZSFPWRBKKDF-UHFFFAOYSA-N	433.371	1.806	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)[C@H](C(C)C)n2nnc(-c3ccccc3)n2)c1	744847352	WHWDUVSUHBMJKJ-IBGZPJMESA-N	436.472	1.850	50	20	IDGD	
CN(C)C(=O)NNC(=O)CN1C(=O)/C(=C/c2ccc(Br)cc2)SC1=S	746005951	FIYXPDOHNFDGCD-XFFZJAGNSA-N	443.348	1.953	50	20	IDGD	
Cc1oc(C(=O)O)cc1S(=O)(=O)NNC(=O)c1nc(Cl)c(Cl)c(N)c1Cl	746053748	HLRZBOBUOVQDHD-UHFFFAOYSA-N	443.652	1.847	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)CC[S@](=O)c2ccc3c(c2)OCCO3)c1	746094936	HUVSPWLFYAXBSZ-PMERELPUSA-N	434.470	1.434	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)Nc2cnn(CC#N)c2)cc1	747434007	AZCCQBYFBYSDES-MHWRWJLKSA-N	444.455	1.700	50	20	IDGD	
COc1cc(C)nc(NNC(=O)NNC(=O)[C@H](C)Oc2cccc(Br)c2)n1	747491931	YIHHOUNRRKVXIQ-JTQLQIEISA-N	439.270	1.681	50	20	IDGD	
CN(C)C(=O)CNC(=S)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1	747623497	KKDQMIXIKYXQGE-IBGZPJMESA-N	425.558	1.197	50	20	IDGD	
O=C(NNC(=O)/C(=C\c1cccs1)n1nnnc1-c1ccccc1)C(=O)N1CCCC1	748240450	GIQUGXKCBBQMQY-DTQAZKPQSA-N	437.485	1.170	50	20	IDGD	
CCCCN1C(=O)C[C@@H](C(=O)NNC(=O)C(=O)N2CCCC2)[C@H]1c1ccc(OC)cc1	748246699	GALJOFJKUNIBHY-IEBWSBKVSA-N	430.505	1.155	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)NCCC1CCN(CC(F)(F)F)CC1	748968262	ROONIVWDPARIDW-UHFFFAOYSA-N	447.414	1.968	50	20	IDGD	
CC(C)CCN1CCC(CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)CC1	751111875	PXUALHFCRKQUOA-UHFFFAOYSA-N	438.598	1.682	50	20	IDGD	
CC[C@@H](C)C(=O)N1CCC[C@@H](C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)C1	751292833	BCLMJXRNBZTLIJ-DGCLKSJQSA-N	444.941	1.033	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)NNc2nc(-c3ccccn3)nc3c2CCC3)c(C)o1	751394029	ZRSZKXOUCMQCRV-UHFFFAOYSA-N	428.474	1.594	50	20	IDGD	
C[C@@H](CC(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1)c1ccc(F)cc1F	751859339	OZXXFRMSUYVQFV-SGTLLEGYSA-N	434.395	1.989	50	20	IDGD	
C[C@@H](C[S@](C)=O)NC(=O)NNc1ccc(S(=O)(=O)NC2CCCCCCC2)cn1	753358462	JUGWNQTVHIMNHB-POXGOYDTSA-N	445.611	1.866	50	20	IDGD	
Cc1ccc(SCC(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c(C)c1	753568282	MOJQSVRDKRAEJZ-KRWDZBQOSA-N	430.482	1.926	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)C(=O)Nc1cc(C(=O)OC)cc([N+](=O)[O-])c1C)c1ccccc1	753841983	WKBYNFGSQAZHEO-OAHLLOKOSA-N	442.428	1.970	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)CN1C(=O)NC2(C[C@@H](C)C[C@H](C)C2)C1=O	756862089	ABCYJFZKXOIKJB-GJZGRUSLSA-N	446.504	1.358	50	20	IDGD	
Cn1c(C(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)cccc1=O	756863857	NLGHWADDGUGKLR-UHFFFAOYSA-N	429.436	1.218	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)CN1C(=O)N[C@]2(C[C@@H](C)C[C@@H](C)C2)C1=O	756871203	QPJCNNQRXZIVLS-NGVSDPCNSA-N	426.477	1.150	50	20	IDGD	
CNS(=O)(=O)c1cccc(NC(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)c1C	757720374	CWDSPBNRFVVABQ-UHFFFAOYSA-N	428.474	1.760	50	20	IDGD	
CS(=O)(=O)N1CCc2c(NC(=O)NNC(=O)c3ccc4c(c3)OCCO4)cccc21	758302824	RCHOXXHNDVIVGP-UHFFFAOYSA-N	432.458	1.246	50	20	IDGD	
O=C(c1cc(-c2cccc(F)c2)no1)N1CCN(S(=O)(=O)CBr)CC1	758513948	WMFKYUPJHZBWFP-UHFFFAOYSA-N	432.271	1.921	50	20	IDGD	
COc1ccc(C(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)cc1[N+](=O)[O-]	758785183	BXDIFFKUYZVBMI-UHFFFAOYSA-N	437.453	1.853	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)[C@](C)(OC)c2ccccc2F)cc1OC	759280724	OXWRNYMJAICSMG-OAQYLSRUSA-N	434.420	1.709	50	20	IDGD	
Cc1ccc(C(=O)NNS(=O)(=O)c2ccc(Br)c([N+](=O)[O-])c2)c(O)c1	760343083	BCBOCEGJHNYTPE-UHFFFAOYSA-N	430.236	1.995	50	20	IDGD	
COC(=O)C12CCC(C(=O)NNc3ccccc3S(=O)(=O)N3CCOCC3)(CC1)C2	760394756	QSAMNTSQTLZHRM-UHFFFAOYSA-N	437.518	1.274	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)[C@@H]1CCCN1C(=O)c1ccc2c(c1)OCO2	760437859	LKIODEGRCZYSMT-AWEZNQCLSA-N	448.476	1.082	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2cc(I)ccc2F)C[C@H](C)O1	762442629	HTDDIEXIAPHPAT-QWRGUYRKSA-N	449.264	1.691	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)N[C@@H]1CC[C@H]2SCCS[C@@H]12	763064390	SFUADBXDDVQDTE-GGPKGHCWSA-N	449.646	1.909	50	20	IDGD	
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)c1C	763439805	UMIIOMMTOPKRGM-UHFFFAOYSA-N	430.483	1.826	50	20	IDGD	
COc1ccc2c(c1)[C@H](C(=O)OCC(=O)NNC(=O)c1ccc(OC)c(OC)c1)CC2	763456193	ZABIRYJURYPORJ-MRXNPFEDSA-N	428.441	1.747	50	20	IDGD	
CC[C@@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1	763472203	UAVVIJGNSXTBFI-GFCCVEGCSA-N	427.417	1.523	50	20	IDGD	
CCc1cccc(C)c1NC(=O)C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	763529441	BAVYWGHYNYBCDY-UHFFFAOYSA-N	437.544	1.856	50	20	IDGD	
CN(C)C1CCN(c2ccc(NC(=O)C(=O)NNC(=O)c3ccccc3O)cc2F)CC1	763532385	YSIAMBJYCNYWMJ-UHFFFAOYSA-N	443.479	1.461	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2cnn(-c3ccccc3Cl)c2)c1	763625899	ZRZCFRKSAQKFEU-UHFFFAOYSA-N	427.848	1.999	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccc(OC[C@@H]2CCCO2)c1	763657756	RIGPZVLEXFBJPX-KRWDZBQOSA-N	443.456	1.418	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(N3CCO[C@@H](C)C3)cc2)cc1	763662087	UBNWPTSWPKTQQP-HNNXBMFYSA-N	442.472	1.085	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)C(=O)Nc1ccnn1CCc1ccccc1	763681671	PJPNZQHRCQWRJU-UHFFFAOYSA-N	425.420	1.430	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)c(OC)cc1Cl	763732763	DRQKVMWGPOBMHS-UHFFFAOYSA-N	446.891	1.896	50	20	IDGD	
Cc1nn(-c2ccc(C#N)cc2)c(NC(=O)C(=O)NNC(=O)c2cccc(N(C)C)c2)c1C	763754490	SUCJNMROQMANDX-UHFFFAOYSA-N	445.483	1.827	50	20	IDGD	
COCCn1cc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccco3)nc3ccccc23)cn1	763764009	OKNJEVHNSSRCDO-UHFFFAOYSA-N	448.439	1.737	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2ccc(-n3cccn3)c(F)c2)c1	763771525	HYRAGIOBUIJQLJ-UHFFFAOYSA-N	427.392	1.428	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2cccc3c2ccn3C)c2ccccc2c1=O	763786544	QFFLAWGLVAJRHV-UHFFFAOYSA-N	432.440	1.308	50	20	IDGD	
CCn1nnnc1-c1cccc(NC(=O)C(=O)NNC(=O)Cc2c[nH]c3ccccc23)c1	763860631	KRKPXRLJRAHDAQ-UHFFFAOYSA-N	432.444	1.170	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)ccc1N1CCOCC1	763872150	KVVLNQLWBJNDAG-HNNXBMFYSA-N	444.463	1.524	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(C(C)=O)cc2)ccc1C	763873791	YRPMRAGYYMVMNG-AWEZNQCLSA-N	441.440	1.538	50	20	IDGD	
O=C(Cc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1ccc2nc3n(c(=O)c2c1)CCC3	763930977	BWKAVVOZOCAYAE-UHFFFAOYSA-N	439.859	1.325	50	20	IDGD	
Cc1nn(C)c2ncc(NC(=O)C(=O)NNC(=O)c3ccc(COc4ccccc4)o3)cc12	763950824	YZARSCNUNOXZTP-UHFFFAOYSA-N	448.439	1.848	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)C(=O)Nc1cc(-c2nnc3n2CCCCC3)ccc1F	763998014	CPJNCVJUJPVMKK-UHFFFAOYSA-N	439.451	1.549	50	20	IDGD	
Cc1cc(Oc2ccccc2)ccc1NC(=O)C(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1	764003118	YUQYNIWDQRYSRT-AWEZNQCLSA-N	431.470	1.308	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1cc(C(=O)N(C)C)ccc1C	764020031	TVCWKIJOZDHOQC-UHFFFAOYSA-N	432.864	1.759	50	20	IDGD	
CCNC(=O)N1CCc2ccc(NC(=O)C(=O)NNC(=O)c3ccccc3OC)cc21	764048737	SVZPWTJOPQGWAC-UHFFFAOYSA-N	425.445	1.187	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)nc1)C(=O)Nc1ccc(-c2n[nH]c(C3CC3)n2)cc1	764100149	WQSLIGNTAPDVLQ-UHFFFAOYSA-N	425.836	1.797	50	20	IDGD	
Cc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)c1C(=O)N1CCCC1	764118014	XSEFANCLZYAZHM-UHFFFAOYSA-N	444.875	1.990	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2cccc(C(=O)N3CCCC3)c2C)c1O	764130049	AASHWLFNFFBPNO-UHFFFAOYSA-N	440.456	1.345	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2O1)C(=O)Nc1ccccc1C(=O)N1CCCCC1	764155352	ZFSYYHCHSOUZFZ-IBGZPJMESA-N	436.468	1.402	50	20	IDGD	
COCc1c(Br)cccc1NC(=O)C(=O)NNC(=O)c1ccc(C#N)cc1	764177805	RNJOHWKNRKEAOF-UHFFFAOYSA-N	431.246	1.867	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)C(=O)Nc1ccc(CN2C(=O)CCC2=O)cc1)c1ccccc1	764327606	CLULPNKTUWJEEE-GOSISDBHSA-N	436.468	1.615	50	20	IDGD	
O=C1C[C@H](Cc2ccc(NC(=O)C(=O)NNC(=O)c3cc4ccccc4o3)cc2)C(=O)N1	764331139	RAYFBDGGOHJCIK-AWEZNQCLSA-N	434.408	1.038	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)cc1C(=O)NC(C)C	764349683	SOGFJFIQDDIOMW-UHFFFAOYSA-N	432.864	1.892	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1)C(=O)Nc1cnn(CC(F)(F)F)c1	764387740	MQWJHNNMFYBCMF-UHFFFAOYSA-N	439.329	1.374	50	20	IDGD	
CN(C)c1cccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)n1	764725366	KYSDADPPPIOIJL-UHFFFAOYSA-N	446.533	1.789	50	20	IDGD	
COc1cccc([C@@H](O)C(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)c1	765176796	OACKASLTCICYCZ-JOCHJYFZSA-N	426.517	1.002	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)c3cc(C)[nH]n3)cc2)cc1	765587632	ORDKYDMOLJQILS-UHFFFAOYSA-N	441.469	1.796	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)[C@@H]2CC(=O)N(c3ccccc3OC)C2)n[nH]1	765593229	UYJPNUXBACNAIQ-CQSZACIVSA-N	449.467	1.908	50	20	IDGD	
CC(=O)Nc1cc(C(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)ccc1C	765749428	NFGJUUMKCHUVPH-UHFFFAOYSA-N	437.544	1.841	50	20	IDGD	
CC[C@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)CN1CCN(Cc2ccc(C)cc2)CC1	766647380	DYTVHDKILZCKKT-IBGZPJMESA-N	447.580	1.563	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cnc(-c4ccccc4)[nH]3)CC2)cc1	766649486	PXLRVJLABGAGSJ-UHFFFAOYSA-N	432.528	1.964	50	20	IDGD	
CC(C)(C)[C@@H](Br)C(=O)NCCS(=O)(=O)N1CCN(c2ccccn2)CC1	767030436	BMAUODHJPRHIFG-HNNXBMFYSA-N	447.399	1.459	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNS(=O)(=O)c1ccc2c(c1)oc(=O)n2CC	767437461	HUGWRYGPHDDLNR-UHFFFAOYSA-N	435.458	1.402	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)CN3CCN(c4ccccn4)CC3)n[nH]2)c1	768269782	PWMPXFCEKCVLFT-UHFFFAOYSA-N	433.516	1.672	50	20	IDGD	
CCc1ccc(-c2cc(-c3nnc(SCC(=O)NNC(=O)C(C)(C)C)n3N)n[nH]2)cc1	768418095	XXCKFNFBPCPTSR-UHFFFAOYSA-N	442.549	1.897	50	20	IDGD	
CCCCNC(=O)NNC(=O)c1cc(S(=O)(=O)Nc2ccc(OC)cc2)ccc1O	769730922	XSADEHROXPVDGF-UHFFFAOYSA-N	436.490	1.946	50	20	IDGD	
CCc1ccccc1C(=O)NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1	770195865	QIDUHZVOTZZETH-UHFFFAOYSA-N	444.557	1.325	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)NCCN3CCN(c4cccc(Cl)c4)CC3)nc21	770411401	HHKGOCSNSXGQCX-UHFFFAOYSA-N	445.915	1.171	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)c3ccc(F)c(S(=O)(=O)N4CCCCC4)c3)nc21	770980744	UHYKRFGPMBFYQK-UHFFFAOYSA-N	449.468	1.140	50	20	IDGD	
CNS(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)cc1	773250184	AIDBZCGVDFPBBA-LLVKDONJSA-N	447.922	1.025	50	20	IDGD	
COc1cc([C@@H](NC(=O)NNC(=O)c2cc(C)[nH]n2)C(F)(F)F)cc(OC)c1OC	776002971	UTNNOMFZXVOZOY-CQSZACIVSA-N	431.371	1.992	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NC[C@@H]2COC3(CCC(C)CC3)O2)cc(OC)c1OC	776885713	RGTOLFZQCCWCSM-DYDLGINISA-N	437.493	1.978	50	20	IDGD	
CCOC(=O)N1CCC[C@@H]([C@H](C)NC(=O)NNC(=O)c2nnc(O)c3ccccc23)C1	777266524	AABGBADUVGKJRA-QWHCGFSZSA-N	430.465	1.536	50	20	IDGD	
COc1ccc(N2CCN(C(=O)/C=C/C(=O)NNc3nc(C)cc(OC)n3)CC2)cc1	778302744	IZIBZITYXYDGOS-CMDGGOBGSA-N	426.477	1.150	50	20	IDGD	
COC(=O)[C@@H]1C[C@@H](OC)CCN1C(=O)CCC(=O)C(C#N)=C1N(C)c2ccccc2N1C	778456015	IBXGIPHNBVTKMY-KXBFYZLASA-N	440.500	1.836	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N[C@H]2CCCC[C@@H]2O)cc1	779333826	DXJPDAJFSBJKFD-YXOXSWSVSA-N	437.500	1.761	50	20	IDGD	
CCC1(C(=O)NNC(=O)CNC(=O)c2cccnc2)CCN(C(=O)c2ccccc2)CC1	781429931	VWVNQEGRZZQHBU-UHFFFAOYSA-N	437.500	1.291	50	20	IDGD	
O=C(NNC(=O)C(=O)NC1CC1)C(=O)Nc1ccc(Sc2ccccc2)c(Cl)c1	782966501	NETQVVNUNGBOBU-UHFFFAOYSA-N	432.889	1.856	50	20	IDGD	
CCCOc1cc(C)ccc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)NC(C)C)cn1	783264965	UVEQOPJWRGXBOL-UHFFFAOYSA-N	449.533	1.947	50	20	IDGD	
Cc1cccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)c1C	784229233	AXZCCQMETOFUCC-UHFFFAOYSA-N	445.545	1.321	50	20	IDGD	
O=C(NNc1ccc(OC(F)F)cc1)C(=O)Nc1cccc(S(=O)(=O)NC2CC2)c1	784309441	OZQMOTQFNZSZBR-UHFFFAOYSA-N	440.428	1.811	50	20	IDGD	
Cc1cc(Br)ccc1NNC(=O)C(=O)Nc1cccc(C(=O)NCC(N)=O)c1	784413885	YZDNUFQFVVRQIU-UHFFFAOYSA-N	448.277	1.054	50	20	IDGD	
CCOC(=O)c1cnn(-c2cccc(NC(=O)C(=O)NNc3ccc(Cl)nn3)c2)c1C	784792322	OSHDUFHAIJPHTM-UHFFFAOYSA-N	443.851	1.883	50	20	IDGD	
CCc1c(C(=O)NNC(=O)COc2ccccc2OC)nnn1Cc1ccc(F)cc1	784802963	ZXPGGACBHSPJAT-UHFFFAOYSA-N	427.436	1.877	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1ccn(-c2ccccc2)n1	785330536	JTENXXQHQLJBFV-UHFFFAOYSA-N	429.458	1.366	50	20	IDGD	
O=C(COC(=O)[C@H]1CC=CC[C@@H]1C(=O)N1CCOCC1)NNC(=O)c1cccc(Cl)c1	785712521	IHUCLHKHPJGJFN-IRXDYDNUSA-N	449.891	1.085	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)N[C@H]1CCCN(C2CCCCC2)C1=O	785920985	CEMTYXLRWPVEGO-HNNXBMFYSA-N	433.465	1.628	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)c2sc(S(N)(=O)=O)c(C)c2Cl)cc1OC	791195601	DGUBHWJSGOELAS-UHFFFAOYSA-N	447.922	1.839	50	20	IDGD	
CN(C)NC(=O)Nc1cccc(NC(=O)CN2C(=O)N[C@@]3(CCc4ccccc43)C2=O)c1	791278206	ZRUWHGUPNBHOAJ-JOCHJYFZSA-N	436.472	1.617	50	20	IDGD	
CN(C)c1nccc(NNC(=O)C(=O)Nc2c3c(nn2-c2ccc(Cl)cc2)CCC3)n1	792292241	VPSHWEIKCWVZPN-UHFFFAOYSA-N	440.895	1.952	50	20	IDGD	
O=C(NNc1nc2ccccn2n1)C(=O)Nc1ccnn1Cc1cnn(-c2ccccc2)c1	792391758	GXHIATVFYMWCDC-UHFFFAOYSA-N	442.443	1.242	50	20	IDGD	
C[C@](O)(Cn1cc(C(F)(F)F)ccc1=O)C(=O)NNC(=O)CCc1ccccc1O	792640519	BXIQALBUQJGIKD-SFHVURJKSA-N	427.379	1.104	50	20	IDGD	
Cn1nc(O)c2c(C(=O)NNC(=O)CNC(=O)OCc3ccccc3)cc(C3CC3)nc21	794070184	QJRNRNGGRAWLRG-UHFFFAOYSA-N	438.444	1.239	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H](O)c2cccc(C(F)(F)F)c2)c1	794764021	QLCMHAXQOIXBBA-OAHLLOKOSA-N	445.419	1.450	50	20	IDGD	
CNC(=O)c1cc(Cl)cc(S(=O)(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c1OC	795276826	BOXPFXGFWBBPHK-UHFFFAOYSA-N	442.837	1.240	50	20	IDGD	
CNC(=O)COc1ccc(NC(=O)C(=O)NNc2ncc(Cl)cc2Cl)c(C)c1	797018195	XVRKNPYSOSFVBL-UHFFFAOYSA-N	426.260	1.903	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)C(=O)Nc1ccc(Cl)c(CN2CCOCC2)c1	797536323	ZYPXDWDRBYEOFC-UHFFFAOYSA-N	448.882	1.640	50	20	IDGD	
CNC(=O)C[C@H](NC(=O)NNc1nc(O)c2cnn(C(C)(C)C)c2n1)c1ccccc1	797547423	TUIFZDZMWBTGIP-AWEZNQCLSA-N	426.481	1.790	50	20	IDGD	
O=C(NNC(=O)C(=O)N1CCCC1)N[C@H]1C[C@H](c2ccc(F)c(Br)c2)C1	797581131	OTSQXENZBFLMGZ-HAQNSBGRSA-N	427.274	1.787	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@H]2C(=O)OCC(=O)NNC(=O)c2cccs2)cc1	798792613	BJALWOCAPSUDMZ-HNNXBMFYSA-N	431.470	1.366	50	20	IDGD	
O=C(NNC(=O)C1(c2cncc(Br)c2)CC1)c1ccc(-n2cnnn2)cc1	798835347	HGSJBVRHQNSBEB-UHFFFAOYSA-N	428.250	1.313	50	20	IDGD	
CN(C)C(=O)c1ccc(S(=O)(=O)NNC(=O)c2ccc(Br)s2)cc1	799520443	ZDWUUODHSJQMQE-UHFFFAOYSA-N	432.321	1.836	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2N2CCOCC2)cc1	802120858	IXJARSLHOHJCJH-UHFFFAOYSA-N	428.449	1.964	50	20	IDGD	
CN1C(=C(C#N)C(=O)COC(=O)c2ccc(C(N)=O)c(Cl)n2)N(C)c2ccccc21	805574455	HOLJRBYAZRXVKH-UHFFFAOYSA-N	425.832	1.881	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)N[C@H](CS(=O)(=O)N(C)C)C(F)(F)F)c(Cl)c1	805768328	XXVDCFYDWIJKAO-LLVKDONJSA-N	445.851	1.806	50	20	IDGD	
CCOC(=O)c1ccc(C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1	809984171	XEKAVEPFIHQXSC-UHFFFAOYSA-N	433.486	1.253	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(-n2ccc(C(F)(F)F)n2)cc1	810387098	FQUVBEFDEWQSNS-LLVKDONJSA-N	443.382	1.029	50	20	IDGD	
COC[C@@]1(CNC(=O)NNC(=O)c2cc(OC)cc(OC)c2)OCCc2ccccc21	811922436	OAPFTORDIPZWFJ-JOCHJYFZSA-N	429.473	1.762	50	20	IDGD	
Cc1ccc(NC(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)cc1N1CCNC1=O	812971876	WEHAZPPKXBUADB-UHFFFAOYSA-N	432.506	1.924	50	20	IDGD	
Cc1nn(C)c2cc(NC(=O)C(=O)NNC(=O)c3cc(Br)ccc3O)ccc12	812980481	RRMPNYGEDYFKLT-UHFFFAOYSA-N	446.261	1.750	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2cccnc2OCC(F)F)cc1	813033268	LREJUJGAFWEMMJ-UHFFFAOYSA-N	443.432	1.058	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccncc2)cc1S(=O)(=O)C1CCCC1	815563611	IPGBCASYIRSQFH-UHFFFAOYSA-N	430.486	1.506	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)nnn1Cc1ccccc1F	815568859	WYLBANXNGFYUJR-UHFFFAOYSA-N	446.826	1.533	50	20	IDGD	
Cc1ccc(Oc2ccc(NC(=O)C(=O)NNC(=O)[C@H]3CCc4nncn4C3)cc2)nc1	815692947	GTRHQCGRMQETKA-AWEZNQCLSA-N	435.444	1.122	50	20	IDGD	
CC(C)(C)OC(=O)NCCOc1cccc(NC(=O)C(=O)NNc2ncncc2F)c1	815764947	AFHZIDSJRMVCHL-UHFFFAOYSA-N	434.428	1.601	50	20	IDGD	
COCCn1cc(NC(=O)C(=O)NNc2cc(C(=O)OC)ccc2Br)cn1	815865629	AKRAWAHHOXXGNE-UHFFFAOYSA-N	440.254	1.160	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)[C@H](CS(C)(=O)=O)c2ccccc2)cc1	816817432	BQXOALJOYNFPGQ-HNAYVOBHSA-N	434.514	1.828	50	20	IDGD	
Cc1nnnn1/C(=C/c1ccc(F)cc1)C(=O)NNC(=O)[C@@H](C)Oc1ccccc1F	818029940	RQDJIPZOHODQME-PBSOMRJOSA-N	428.399	1.873	50	20	IDGD	
COc1cc(/C=C/C(=O)NNC(=O)N2CCN(C)CC2)ccc1OCc1c(C)noc1C	819721031	KYOJGOLDUJHMFT-SOFGYWHQSA-N	443.504	1.880	50	20	IDGD	
Cc1nc2ccccc2n1CC(=O)NN=Cc1c(N2CCOCC2)nc2ccccn2c1=O	874055452	BHLRHRNYKIGPOQ-UHFFFAOYSA-N	445.483	1.340	50	20	IDGD	
C=CCNC(=S)NNC(=O)c1cccnc1SCC(=O)Nc1ccc2c(c1)OCO2	913435791	UAZFOIXASUNOCC-UHFFFAOYSA-N	445.526	1.836	50	20	IDGD	
O=C(CN1CCCS1(=O)=O)NNC(=O)c1cn(-c2ccccc2)nc1-c1ccccc1	916101664	ZTHKWTLXOYJIAK-UHFFFAOYSA-N	439.497	1.336	50	20	IDGD	
Cc1nn([C@@H]2CCS(=O)(=O)C2)c(Cl)c1C=NNC(=O)[C@@H]1COc2ccccc2O1	916292276	VBXWHWGGKBKARC-WBMJQRKESA-N	438.893	1.495	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)NCC[C@@](O)(c2nccn2C)C(F)(F)F)c1	916378564	OMJAVUAUEPTKGN-QGZVFWFLSA-N	445.398	1.222	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)N2CCN(C(=O)C(=O)N3CCCC3)CC2)c(C)n1CC(C)C	916433435	QISGCOCOFKPDIO-STZFKDTASA-N	439.560	1.961	50	20	IDGD	
O=C(NC[C@H](c1ccccc1)N1CCOCC1)NNC(=O)c1nnc(O)c2ccccc12	916509478	PHAOQIMTHKVQSK-GOSISDBHSA-N	436.472	1.353	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C(C)C)c2)cc1C	916562697	SSXJKVVVAVHQJA-UHFFFAOYSA-N	446.529	1.732	50	20	IDGD	
O=C(NNC(=O)[C@H]1CC(=O)N(c2ccc(Cl)cc2)C1)c1nnc(O)c2ccccc12	916720351	RFQDSQZNRSOMQV-NSHDSACASA-N	425.832	1.803	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)S(=O)(=O)N(C[C@H]1CCCO1)C2=O)c1ccccc1	918550204	QWZSJQWBKYSQGI-OAHLLOKOSA-N	429.454	1.085	50	20	IDGD	
CNS(=O)(=O)c1ccc([C@@H](C)NC(=O)NNC(=O)c2c(C)nc3ccccn23)cc1	919779776	ZEDIEZJSZVRWOC-GFCCVEGCSA-N	430.490	1.256	50	20	IDGD	
CCOc1ccc(-c2nc(CC(=O)NNC(=O)N[C@H]3CCS(=O)(=O)C3)cs2)cc1	919884630	HFLNFBCWPLRIDZ-ZDUSSCGKSA-N	438.531	1.269	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)N[C@@H]2CCCN(S(C)(=O)=O)C2)cc1OC	920239816	DKNNRARMFRWZRL-OAHLLOKOSA-N	442.538	1.242	50	20	IDGD	
COc1ccc([C@H]2[C@H](C(=O)NNC(=O)c3n[nH]c4c3CCCC4)CCC(=O)N2C)cc1	1251882120	QNRQCGXHSGTBIP-UZLBHIALSA-N	425.489	1.668	50	20	IDGD	
COc1cccc(/C=C(\C(=O)NNC(=O)c2cncn2-c2ccccc2)n2nnnc2C)c1	1318012815	DZSBICOLUIAELG-XDHOZWIPSA-N	444.455	1.635	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)[C@@H]2CC[C@@H](C(F)(F)F)NC2=O)CC1	1318622972	SWZBUQRYGPGIGO-NEPJUHHUSA-N	436.431	1.238	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)N1[C@H](C)CC[C@H]1C	1320622458	IWGOFLGBICORIM-ZACQAIPSSA-N	436.578	1.884	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4nc(CO)[nH]c4c3)C2)C1	1777703920	JCIANEZOGBLAJM-NRFANRHFSA-N	446.580	1.350	50	20	IDGD	
C[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1C(=O)N1CC[C@@]2(CN(C(=O)[C@H](F)Cl)CCO2)C1	1778348827	HHBFVKWTEYDAIQ-KZDUYQQSSA-N	447.935	1.854	50	20	IDGD	
C[C@@H](C(=O)N1CCO[C@@]2(CCN(C(=O)CO[Si](C)(C)C)C2)C1)N1CSCSC1	1779296839	HNIMHFWLJSOUTL-MAUKXSAKSA-N	447.699	1.711	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CC23CCCN2CCC3)C1	1780665465	UGKWKUQOSNAVML-WAOWUJCRSA-N	442.000	1.773	50	20	IDGD	
Cc1cccc(CCC(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)n1	1781326696	QZHLVYNMIIBRSP-AEFFLSMTSA-N	428.302	1.843	50	20	IDGD	
O=C(c1cccc(F)c1[N+](=O)[O-])N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1781772496	XYYMUAKEEUQVIF-CZUORRHYSA-N	448.220	1.868	50	20	IDGD	
C[C@H](Cn1ccnc1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Br)C2	1782548374	HPOIOFZZMYCVRF-ZXFNITATSA-N	445.333	1.724	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3c(F)cncc3F)CCO2)C1	1783351313	JLPIQLMSUTZYFC-APPDUMDISA-N	432.265	1.977	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)C#CC3(O)CCCCC3)CCO2)C1	1783533716	GDZCRKRVYNOOFH-HNAYVOBHSA-N	427.339	1.298	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cnc4ccccc4n3)CCO2)C1	1783534409	JGKJJFNUWYVOER-BFUOFWGJSA-N	433.306	1.857	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](C)NC(=O)OC(C)(C)C)C2)C1	1783711873	BCJMJVZBSUCVJJ-VEVIJQCQSA-N	448.358	1.513	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)c1cc(C2CC2)on1	1783756486	JLTWKWFWORFFPH-XEZPLFJOSA-N	426.311	1.930	50	20	IDGD	
CC(C)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CC(c4ccccc4)=NN3)C[C@@H]21	1783853117	ZJPRLBKGCHHTMG-ZULIPRJHSA-N	446.979	1.997	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3scnc3C(F)(F)F)CCO2)C1	1783875091	CSSUTZAHJIRBMV-ZUZCIYMTSA-N	441.859	1.859	50	20	IDGD	
Cc1cnc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]3C2)cn1	1783968496	VMPZMBOHHUKPBB-PCBIJLKTSA-N	425.327	1.409	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C#Cc3ccc(Cl)cc3)C[C@@H]21)[C@H](O)CCl	1784084196	NPTVUAWKRXTBBW-OWLYRPNTSA-N	425.312	1.271	50	20	IDGD	
Cc1nccn1[C@H](C)C(=O)N1CC[C@]2(CN(C(=O)[C@@H](C)CBr)CCO2)C1	1784628630	LHTLKPXXYWEWDF-PMUMKWKESA-N	427.343	1.613	50	20	IDGD	
CC[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)N(CC)CC	1784630674	VTBHSNKEBXMZPU-ARKGTOAJSA-N	436.366	1.777	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3CC[C@H](C(=O)OC)CC3)[C@H]2C1	1784797066	CMZHRHCBDWTRQV-QQCJEOGWSA-N	428.957	1.963	50	20	IDGD	
COc1cc(F)ccc1CC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](C)Br)CCO2	1785659923	AIUWYHWTQLQBDY-DJJJIMSYSA-N	443.313	1.990	50	20	IDGD	
C[C@@H](C(=O)Nc1ccc(C2(NC(=O)c3cnccc3C(=O)NN)CCC2)cc1)n1ccnc1	1786232769	SAFRYRXYDFKBIO-HNNXBMFYSA-N	447.499	1.891	50	20	IDGD	
Cn1ncc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]3C2)c1C(F)(F)F	1787444407	ZPGVONLMIRHMQH-KYVBTAMFSA-N	426.798	1.567	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc4ccccn4n3)[C@H]2C1	1787846357	OSMLBHREVFYZHC-HPZZRFSDSA-N	435.322	1.711	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C#CC3(O)CCCCC3)C[C@@H]21)[C@H](F)Br	1789926360	VAKQNRGXEWBWTC-JKQORVJESA-N	445.329	1.355	50	20	IDGD	
Cc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]32)ccc1F	1790088294	IVTJZBAJFXRASS-LNLFQRSKSA-N	434.512	1.100	50	20	IDGD	
Cc1n[nH]c(C)c1CC(=O)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1	1790583328	LWBXBJLNFSIOBO-UHFFFAOYSA-N	446.316	1.697	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCCn3ccnc3)C[C@@H]21	1790963360	GHIUGCYNRXQQOH-QAETUUGQSA-N	441.370	1.817	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Cl)C[C@@H]21	1791082143	FFYSHMONWSNONN-ARKGTOAJSA-N	447.935	1.900	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/C(=O)c3cccs3)C[C@@H]21	1791254981	YUEMRYJZMGCHQE-MWDSRFMCSA-N	440.949	1.721	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)c1ccc(Br)cc1F	1792688731	GHHUFPQJEQZLOV-OWLDWWDNSA-N	449.704	1.391	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H](C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](O)CCl)C1	1793111857	ZNDGMIJNWNDYAZ-IBEHDNSVSA-N	429.945	1.481	50	20	IDGD	
CC(=O)N[C@@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@](C)(Cl)CCl)C2)C(C)(C)C	1793194182	LWDUARSEKNCERS-ZIUCBDDQSA-N	436.380	1.363	50	20	IDGD	
CC(C)c1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)no1	1795308513	KHHLHECXMDXMBB-BTTYYORXSA-N	426.477	1.362	50	20	IDGD	
Nc1ccccc1/C=C/C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2	1795652926	WPPCRXLXEKRRSC-YBWDHYDSSA-N	426.286	1.562	50	20	IDGD	
CCOc1ccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Cl)cc1OC	1796368382	KRWNDPMEKCEDPR-FTUNRGFVSA-N	428.888	1.760	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1snnc1C1CC1	1796707536	PCKAYHYZVVUKSC-RNJOBUHISA-N	443.367	1.792	50	20	IDGD	
Cc1c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)Br)C3)nc2ccccn12	1796847728	DBRWFEZWFMVUPB-DPYKFYPSSA-N	435.322	1.629	50	20	IDGD	
C[C@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@](C)(Cl)CCl)C2)[C@H]1SC(=N)NC1=O	1796881167	ZIFJLSDWHABODS-XBEPSMQDSA-N	435.377	1.663	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(C(F)(F)F)c[nH]1)c1ccc(B(O)O)cc1	1797011689	UJKCHUFOMFDDEJ-MUJYYYPQSA-N	435.211	1.279	50	20	IDGD	
O=C1Cc2cc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@H](F)Br)C4)ccc2N1	1797332653	CQWHWEWFGRYTQK-VZAMPYOESA-N	440.269	1.075	50	20	IDGD	
Cc1cc(C(=O)NCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](C)CBr)C3)no1	1798504934	CGVPKLJMRHZKMV-RUZUBIRVSA-N	441.326	1.382	50	20	IDGD	
CC1=NN(c2ccc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@H](F)Cl)C4)cc2)C(=O)C1	1798979945	GKMLHHABZYPQPF-DACLVMHWSA-N	436.871	1.537	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccn2nccc12	1799972401	BIPMZLYDORCOBS-ZJOBFFGXSA-N	435.322	1.569	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(-c3cccs3)on1)C2	1800977028	PEPMQGQMFSSCQQ-LKQDWFRTSA-N	439.921	1.860	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1ccc(F)cc1F)c1cccc(B(O)O)c1	1801822005	QHKNBCUDKVNTSH-REPLKXPHSA-N	428.244	1.139	50	20	IDGD	
COC(=O)NCC(=O)N1CC[C@H](CNC(=O)[C@@H](C)CBr)[C@H]1c1cccnc1	1803018195	YLMPZGNXORJWSH-JGGQBBKZSA-N	441.326	1.474	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cnnc3ccccc23)[C@H]1c1cccnc1)[C@@H](O)CCl	1803139754	VHQVIQJXRITNDM-YSSFQJQWSA-N	439.903	1.944	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)[C@@](C)(O)C(F)(F)F)[C@@H]1c1cccnc1	1803998608	QFEAZERUSDXGTR-XJIUQZFPSA-N	437.846	1.655	50	20	IDGD	
CC(C)(C)OC(=O)NC1(C(=O)N2CCC3(CCCN(C(=O)[C@@H](O)CCl)C3)CC2)CC1	1805529047	HLNISQLDMWWTOY-HNNXBMFYSA-N	443.972	1.875	50	20	IDGD	
C=C(C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)C(F)(F)F	1807368156	PQQVZLJTHMRTIS-SJLPKXTDSA-N	447.222	1.200	50	20	IDGD	
COc1cc(C(=O)N2CC[C@@H](CNC(=O)C(Cl)Cl)[C@H]2c2cccnc2)nn1C	1813079824	NNONNFMOIRRPSF-SWLSCSKDSA-N	426.304	1.947	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc(-n3ccnc3)ccn2)[nH]n1)[C@H](O)CCl	1814872975	IILCIHDCHKIYKS-IAGOWNOFSA-N	443.895	1.896	50	20	IDGD	
Cc1ncsc1C(=O)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1	1815355527	VDEYOVHIXJLOKJ-ZDUSSCGKSA-N	442.331	1.127	50	20	IDGD	
Cc1cc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@@H](O)CCl)CC3)ncc1[N+](=O)[O-]	1817618546	FVMVBRNYMPBJBZ-ZANVPECISA-N	439.881	1.580	50	20	IDGD	
Cn1ncc2c(C(=O)Nc3nc4c(s3)C[C@@H](NC(=O)[C@H](O)CCl)CC4)cccc21	1818552885	IYDLDTPMACFJLA-ZUZCIYMTSA-N	433.921	1.855	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](F)Br)CC2)c1n[nH]cc1[N+](=O)[O-]	1820304168	MJHHPTCQMBVLSY-GPXNAGAYSA-N	447.246	1.691	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1)[C@H]1CC(c2ccccc2)=NN1	1821611737	XUSYDHSZJLJDCD-SQNIBIBYSA-N	444.923	1.768	50	20	IDGD	
CC[C@@H](Br)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CNC(=O)OC)[nH]n1	1822092755	VKLUCXMODNYSSF-PWSUYJOCSA-N	430.303	1.931	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCS(C)(=O)=O)n[nH]1	1822971946	CSMTYOWBOUKGEP-PWSUYJOCSA-N	435.344	1.620	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)CCl)CC2)c1ccc(O)c([N+](=O)[O-])c1	1823222566	KGJSDKPPAJOGJX-RNCFNFMXSA-N	440.865	1.582	50	20	IDGD	
CN(C)C(=O)NCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H](F)Br)CC1	1823882383	SBSWNIARNUSCLR-HIFRSBDPSA-N	435.338	1.568	50	20	IDGD	
O=C1C[C@H](C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)CCBr)CC3)CCN1	1826215576	UCGXXPGFSICNDC-ZJUUUORDSA-N	429.340	1.366	50	20	IDGD	
COC(=O)CCCCCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](O)CCl)CC2	1826232185	SZFVGOFEFKGKOI-AAEUAGOBSA-N	431.942	1.778	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H]3[C@H]4COC[C@H]43)sc2C1	1827377652	FJSZMKCKAVDFTM-TUYISWAISA-N	428.352	1.979	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)CN3C(=O)CSC3=S)sc2C1	1828247170	NKRRDURLXKQYSC-DTWKUNHWSA-N	447.007	1.933	50	20	IDGD	
COc1ccnc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)c1	1830364436	KIZWPUGIOXQZCC-FQEVSTJZSA-N	425.913	1.425	50	20	IDGD	
C[C@@H](C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2)n1ccccc1=O	1830364724	RHHYLGOHVFWHCN-KKSFZXQISA-N	439.940	1.131	50	20	IDGD	
O=C(CCn1cncn1)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](F)Br)CC1	1830381101	GYCAXJUZDAQLMD-GOEBONIOSA-N	430.322	1.978	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)C3(O)CCC3)C2)C1	1830533451	NTMFMGLEMWAZKB-IIDMSEBBSA-N	447.370	1.025	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCCc3ccncc3)CCO2)C1	1833060108	UHAUVVIHFDAGDA-RXVVDRJESA-N	439.940	1.115	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3ccccn3)CCO2)C1	1833190553	NHARPXKSFMTHGG-DNVCBOLYSA-N	440.338	1.254	50	20	IDGD	
Cc1nc(C)c(C(=O)N2CCC(N3CCC(NC(=O)[C@H](O)CCl)CC3)CC2)s1	1833309459	WKZYNMQXBUSELN-MRXNPFEDSA-N	428.986	1.545	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3ccc(CO)c(F)c3)CC2)CC1)[C@H](O)CCl	1833313594	LKFMDIJDMOUDBS-LJQANCHMSA-N	441.931	1.103	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)C(=O)Nc3cccnc3)CC2)CC1	1833533747	OLDSUCVFSYBOPF-LJQANCHMSA-N	449.983	1.999	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(OC)n3)CCO2)C1	1833762451	TVSRTEQXRGNYLB-QRWLVFNGSA-N	425.913	1.568	50	20	IDGD	
Cc1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)n1	1834050523	DMWKJCIFJPWHMC-OALUTQOASA-N	430.332	1.696	50	20	IDGD	
C[C@H](Nc1cccnc1)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1835685649	RCOFVACSHOHOEG-KKSFZXQISA-N	438.956	1.603	50	20	IDGD	
O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)CCc1cccnc1)CCO2	1836177271	JCGAKWQIXDWELD-LJQANCHMSA-N	440.338	1.256	50	20	IDGD	
Cc1ccc2oc(C(=O)N3CCO[C@]4(COCCN(C(=O)[C@@H](F)Cl)C4)C3)cc2n1	1836264916	MTEVOTPZPDGKTN-VQIMIIECSA-N	425.844	1.741	50	20	IDGD	
CCc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](Br)CC)C3)C2)n[nH]1	1836281847	HLSBZOFQIQGFFJ-RDTXWAMCSA-N	443.342	1.216	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnn4cc(C)cnc34)CCO2)C1	1836944789	WJVXGGHDYNSPEM-DYESRHJHSA-N	449.939	1.515	50	20	IDGD	
Cn1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)c(C(F)(F)F)n1	1837960772	TXVYOMXJFIAVPY-WFASDCNBSA-N	442.797	1.043	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCBr)C2)C1	1839150909	BUZKFIXKZXIAAM-GJZGRUSLSA-N	446.169	1.464	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)ccn1	1839153899	VQPDJNKFGQMHHE-OALUTQOASA-N	430.332	1.696	50	20	IDGD	
CC(C)c1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)n[nH]1	1839153957	WTGRXRXHAGIEPQ-RTBURBONSA-N	447.363	1.839	50	20	IDGD	
CC(C)c1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)no1	1839197787	IHWUVKWXYDJVPD-YOEHRIQHSA-N	448.289	1.559	50	20	IDGD	
O=C([C@H](F)Br)N1CCO[C@]2(COCCN(C(=O)[C@H]3CCCS3)C2)C1	1839203326	IKAHXTBZBVCIDO-XUJVJEKNSA-N	425.320	1.029	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3ccc(F)cc3)CCO2)C1	1840056237	UDMXPTAQCYTLRM-NQIIRXRSSA-N	442.915	1.469	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C(C)C)on3)C2)C1	1840150418	KPPSMOCUUGAPEV-LIRRHRJNSA-N	429.901	1.122	50	20	IDGD	
O=C(c1cc(O)cc([N+](=O)[O-])c1)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840189156	AFBZMYXVYHADJR-QGZVFWFLSA-N	448.259	1.174	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)n1cccc1)CCO2	1840355040	RHLNPNFPLFEFOB-DAYGRLMNSA-N	428.327	1.289	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@](F)(C(=O)N2CC3(CCCN3C(=O)[C@@H](O)CCl)C2)C1	1841351095	FZYWSNGTXMYTQT-DJJJIMSYSA-N	433.908	1.139	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H]1C(=O)N1CCCC12CN(C(=O)[C@@H](O)CCl)C2	1841474218	XUELNKKHSIGQJB-ZNMIVQPWSA-N	429.945	1.483	50	20	IDGD	
CC(C)(C)n1ncc(C(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)c1Cl	1842258041	FUVRRZCHDHAEHP-UHFFFAOYSA-N	444.728	1.102	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2scnc2C2CC2)C1	1842307188	UBJZVBQOZMHFRM-UHFFFAOYSA-N	426.502	1.150	50	20	IDGD	
CS(=O)(=O)c1ccc(CC(=O)N2CCCC23CN(C(=O)CCBr)C3)cc1	1842810292	BRWBUESQOZTTBJ-UHFFFAOYSA-N	443.363	1.621	50	20	IDGD	
COc1ccc(Cl)cc1CC(=O)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843015008	YCEAPSQFCSNYRW-UHFFFAOYSA-N	442.708	1.088	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)COc1ccc(O)cc1)C2	1843415101	JWLZJDYTGNMQKC-BUVRLJJBSA-N	439.472	1.108	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)[C@H]1CNc3ccccc31)C2	1843415886	YNADNMITZLRPDT-AEIQVQRHSA-N	434.500	1.533	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)Cc1ccc(Cl)s1)C2	1844263625	YYPOAPGHFHWEHT-UHFFFAOYSA-N	433.921	1.460	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)c1cc(C)nn1C)C2	1844692198	SNAVWSGNORCHFV-UHFFFAOYSA-N	441.444	1.693	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)c2ccc(C(F)(F)F)cc2)C1	1844947570	XEKMUZXHFLNAFS-UHFFFAOYSA-N	432.207	1.516	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCCC12CN(C(=O)c1cccnc1CS(C)(=O)=O)C2	1845169527	PRYGOQBREVYXAL-KRWDZBQOSA-N	448.372	1.680	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)c1cn3c(Cl)cccc3n1)C2	1846384874	TZROOQUKSSUOLI-UHFFFAOYSA-N	432.912	1.178	50	20	IDGD	
O=C(c1cc(=O)c(OCc2ccccc2)c[nH]1)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl	1847556151	FLOMLSHQFOOYEV-LNLFQRSKSA-N	445.903	1.369	50	20	IDGD	
COc1ccc(-c2n[nH]c(=S)n2CCC(=O)NNC(=O)Cn2nc(C)cc2C)cc1	12666428	XJONEZMBKDFJSN-UHFFFAOYSA-N	429.506	1.667	50	20	IDGD	
CCCOc1ccc(C(=O)NNS(=O)(=O)c2cc(C(=O)O)ccc2OC)cc1OC	13361159	OHEJRIHHXXWZMA-UHFFFAOYSA-N	438.458	1.814	50	20	IDGD	
CCN(CC(=O)NNC(=O)Cc1nc(C)cs1)CC(=O)Nc1ccc(NC(C)=O)cc1	14922513	HCIBKGIKYJMLPQ-UHFFFAOYSA-N	446.533	1.060	50	20	IDGD	
O=C(NNC(=O)c1sccc1S(=O)(=O)N1CCc2ccccc2C1)c1ccccn1	29505349	ZCDBWHDONVQXNB-UHFFFAOYSA-N	442.522	1.965	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)C2CCN(S(=O)(=O)c3c(C)noc3C)CC2)cc1	105109198	MWSFBGXGSOMUOQ-UHFFFAOYSA-N	449.533	1.260	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2sccc2S(=O)(=O)N2CCCC2)cc1OC	105560798	GJPJGOYTPRHWEY-UHFFFAOYSA-N	439.515	1.625	50	20	IDGD	
CN(C)CC(C)(C)CNC(=S)NNC(=O)c1ccc(CSc2nncn2C)cc1	727065304	ULKASSZFRYXIQZ-UHFFFAOYSA-N	435.623	1.804	50	20	IDGD	
CCn1c(=O)c(=O)[nH]c2cc(C(=O)NNC(=S)Nc3ccc(OC)c(F)c3)ccc21	727499150	NSIBFLAZCKNRFM-UHFFFAOYSA-N	431.449	1.489	50	20	IDGD	
COc1cc(C(=O)NNC(=O)N[C@@H](C)c2ccc3c(c2)CC(=O)N3C)cc(OC)c1OC	728302463	PILNCEQHWONEPY-LBPRGKRZSA-N	442.472	1.937	50	20	IDGD	
CN(CCO)S(=O)(=O)c1ccc(C(=O)NNC(=O)c2ccc3ccccc3c2)cc1	728313804	LMZPTRKVFOROEM-UHFFFAOYSA-N	427.482	1.527	50	20	IDGD	
COc1cccc(/C=C(/C(=O)NNC(=O)c2cccc3ncccc23)n2nnnc2C)c1	730225095	LXLRZXHWIYSESO-MOSHPQCFSA-N	429.440	1.998	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccccc1	730779569	GMLGABURDZSKCU-MRXNPFEDSA-N	433.486	1.162	50	20	IDGD	
CC(C)(C(=O)NNC(=O)c1cc(S(=O)(=O)N2CCOCC2)ccc1F)c1ccccc1	731178034	UGJGUMLWDKMWLD-UHFFFAOYSA-N	449.504	1.585	50	20	IDGD	
C[C@H]1CCCN(S(=O)(=O)c2cc(C(=O)NNC(=O)Cc3ccccc3F)n(C)c2)C1	731330075	MVMAVKWWPABUNX-AWEZNQCLSA-N	436.509	1.589	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)c1csc(-c2ccc3c(c2)OCCO3)n1	731330959	HRXXNSCZUVIKDQ-UHFFFAOYSA-N	428.426	1.365	50	20	IDGD	
CNc1cc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc(Cl)n1	731874631	KFFJJZAJQXXUSQ-UHFFFAOYSA-N	437.909	1.636	50	20	IDGD	
CN(C(=O)C1CC1)c1ccccc1C(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	732327896	VQLVELCWKCIQCE-UHFFFAOYSA-N	440.412	1.586	50	20	IDGD	
Cc1nn(CCCl)c(C)c1C(=O)N1CCCN(S(=O)(=O)c2c(C)noc2C)CC1	733915376	WWIZCADULYOFTN-UHFFFAOYSA-N	443.957	1.880	50	20	IDGD	
C[C@H]1CCCC[C@@H]1CCNC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	734071641	NTOXWELMZKWOID-DLBZAZTESA-N	438.598	1.860	50	20	IDGD	
Cc1oc2ncn(C)c(=O)c2c1C(=O)NNc1ccccc1S(=O)(=O)NC(C)(C)C	734251120	ZWQGAEMNIWTJAS-UHFFFAOYSA-N	433.490	1.669	50	20	IDGD	
NS(=O)(=O)c1ccc(F)c(CNC(=O)NNC(=O)c2cc3c(s2)CCCCC3)c1	734676571	SLJFGZHFQUODRH-UHFFFAOYSA-N	440.522	1.948	50	20	IDGD	
CN(C)CC[C@@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)C(C)(C)C	734953200	KUUHDXZWTWXEPI-MRXNPFEDSA-N	427.571	1.247	50	20	IDGD	
O=C(NNC(=O)c1cnc(-c2ccccc2)[nH]1)c1ccc(S(=O)(=O)N2CCCC2)cc1	736066377	FIHZJVYYRRBXOC-UHFFFAOYSA-N	439.497	1.936	50	20	IDGD	
COc1ccccc1C(=O)NNS(=O)(=O)c1cccc(I)c1	739672238	SEQOLVSSIBUFPB-UHFFFAOYSA-N	432.239	1.923	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)N2CCC[C@H](CNS(N)(=O)=O)C2)c(C)n1C[C@H]1CCCO1	739699414	QPUMAUBQUNFBKT-SIMNFHIRSA-N	449.577	1.223	50	20	IDGD	
CC(C)(C)CNC(=O)c1ccc(C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1	741533262	BSOLWMZGANLDLG-UHFFFAOYSA-N	431.514	1.941	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NN=Cc1c[nH]c2ncccc12	741761157	XPNHDAKNZOQEOK-UHFFFAOYSA-N	441.513	1.667	50	20	IDGD	
CCO[C@H]1C[C@@H](NC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)C12CCCC2	743510355	VRPAWUSVDBYBRL-CABCVRRESA-N	437.566	1.970	50	20	IDGD	
O=C(NCCc1nc(C(F)(F)F)cs1)NNC(=O)C1CCN(c2ncccn2)CC1	743589156	PQPHVJIHPBIAHG-UHFFFAOYSA-N	443.455	1.741	50	20	IDGD	
O=C(NCCNS(=O)(=O)c1ccccc1)NNC(=O)c1cccc(Br)c1	743685833	FZXUELZNPNEPCN-UHFFFAOYSA-N	441.307	1.372	50	20	IDGD	
CS(=O)(=O)NC[C@H]1CCCN(C(=O)NNC(=O)c2cccc(Br)c2)C1	743686788	HWSVBEMIWRFMHH-LLVKDONJSA-N	433.328	1.065	50	20	IDGD	
Cn1cc(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)c(-c2ccncc2)n1	744619117	IOUAOSDSDRKJGC-UHFFFAOYSA-N	442.501	1.260	50	20	IDGD	
O=C(COC(=O)c1ncoc1-c1ccc2c(c1)OCCO2)NNC(=O)c1cccs1	745293321	PHKBFKLNKIYDLE-UHFFFAOYSA-N	429.410	1.792	50	20	IDGD	
CCN1CCN(c2ccc(F)cc2[C@H](C)NC(=O)NNC(=O)Cc2ccncc2)CC1	747586503	NCPGAYMVFRTSLI-INIZCTEOSA-N	428.512	1.997	50	20	IDGD	
O=C(NNc1cccc([N+](=O)[O-])c1)[C@H]1CCCN1S(=O)(=O)c1cccc([N+](=O)[O-])c1	748004632	NHULBJYDDCXBJV-MRXNPFEDSA-N	435.418	1.799	50	20	IDGD	
O=C(COc1ccccc1)NCC(=O)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1	748522848	IDMUZWHQYGQAJL-UHFFFAOYSA-N	431.392	1.618	50	20	IDGD	
CC[C@@H](Oc1cccc(C)c1)C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	749536279	MSVBFCNSEULNMA-GOSISDBHSA-N	447.561	1.627	50	20	IDGD	
O=C(CC1CCCC1)NNC(=O)c1ccc2c(c1)S(=O)(=O)N(C[C@@H]1CCCO1)C2=O	749940932	ZREXIDYSJNLINX-HNNXBMFYSA-N	435.502	1.351	50	20	IDGD	
O=C(NNc1nc(Br)cn2ccnc12)c1nn(-c2ccc(F)cc2)ccc1=O	750246295	AFBIYXUULHVGPO-UHFFFAOYSA-N	444.224	1.934	50	20	IDGD	
O=C(NNC(=O)N1CCN(CC(=O)N2CCc3ccccc32)CC1)c1cc2ccccc2o1	750285150	XOQLVMXXZBGCBZ-UHFFFAOYSA-N	447.495	1.994	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)c2cc(S(C)(=O)=O)ccc2N)cc1C	750415286	XJIGGQXGTYNXAD-UHFFFAOYSA-N	439.515	1.223	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1Br)C(=O)NNC(=O)CNC(=O)c1ccco1	751201276	GVISVTSGICZVLT-SECBINFHSA-N	428.214	1.526	50	20	IDGD	
NS(=O)(=O)c1cc(Cl)c(F)c(C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c1	752300368	CQTNOBIAYKFZMN-UHFFFAOYSA-N	437.840	1.387	50	20	IDGD	
COc1ccc2c(c1)CC[C@H](NC(=O)NNc1ccc(S(=O)(=O)NC(C)C)cn1)C2	753284666	IAJZTBGSPLISNZ-INIZCTEOSA-N	433.534	1.961	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(CC(=O)NNc2ccc(-c3ccccc3)nn2)C(=O)C1	754471466	XVWRLQROXUJXRV-UHFFFAOYSA-N	426.477	1.666	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)Nc1ccc(OC)c(-n2nnnc2C)c1	756318767	JIOCWIMAGKQPEE-UHFFFAOYSA-N	443.489	1.933	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccc(O[C@@H]3CCOC3)cc2)c1	756683819	VWUYVUDHKNPPQD-QGZVFWFLSA-N	448.501	1.571	50	20	IDGD	
CCOC(=O)[C@H](C)NC(=O)c1ccc(NC(=O)NNC(=O)c2ccc(C#N)cc2)cc1F	756819476	SCYKLHKTJHUAGV-LBPRGKRZSA-N	441.419	1.845	50	20	IDGD	
COCCN(C)S(=O)(=O)NC(=O)/C(C#N)=C/c1cc(C)n(-c2ccc(OC)cc2)c1C	757322493	GQUIEPFHBQPRAG-QGOAFFKASA-N	446.529	1.949	50	20	IDGD	
CCc1nnc(O)c(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)c1CC	758257492	SKDAFCPSJYITIF-UHFFFAOYSA-N	435.506	1.085	50	20	IDGD	
C[C@@H]1CC(C)(C)C[C@]2(C1)NC(=O)N(CC(=O)NNc1nc(O)c3ccccc3n1)C2=O	758296283	XJGASYDWQQVWGX-GTJPDFRWSA-N	426.477	1.915	50	20	IDGD	
COc1cccc(Oc2ccc(CNC(=O)NNC(=O)C(=O)Nc3ccccn3)cn2)c1	758682714	DPPXKSPEVJDDOY-UHFFFAOYSA-N	436.428	1.747	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@H](C#N)[C@@H](NC(=O)NNC(=O)COc2ccccc2C#N)C1	758775074	VRVIURCPHLDQJA-CABCVRRESA-N	428.449	1.027	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)[C@@H]1COc2ccc(Br)cc21	759113988	QLANVRRAAJNPLX-GFCCVEGCSA-N	443.298	1.780	50	20	IDGD	
CC[C@H](CC(F)(F)F)NC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	761040381	GMESFBMIGKIKFQ-GFCCVEGCSA-N	438.476	1.375	50	20	IDGD	
O=C(COC(=O)c1cc(C(F)(F)F)ccc1F)NNC(=O)[C@H]1COc2ccccc2O1	761259115	FJRWSRWTXUIQKZ-OAHLLOKOSA-N	442.321	1.989	50	20	IDGD	
CC(=O)N(CCc1ccccc1)CC(=O)OCC(=O)NNC(=O)c1cccc(Cl)c1	761592472	QFCUADKVHYXWTF-UHFFFAOYSA-N	431.876	1.735	50	20	IDGD	
Cc1cc(C(=O)O)cc(S(=O)(=O)NNC(=O)c2cccc(C#N)c2)c1Br	762474268	DDCOPFNQFBFQKV-UHFFFAOYSA-N	438.259	1.951	50	20	IDGD	
CC[C@@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1	763445041	DUEKMZQAPYUWHV-GFCCVEGCSA-N	427.417	1.523	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(OCC(F)(F)F)cc1	763446236	OTXRSRUSFNJHOE-UHFFFAOYSA-N	426.307	1.936	50	20	IDGD	
CN1CCOc2ccc(NC(=O)C(=O)NNC(=O)c3ccccc3Br)cc21	763482685	KOQIHJOOQDARAF-UHFFFAOYSA-N	433.262	1.677	50	20	IDGD	
CC(=O)NNC(=O)C(=O)Nc1ccc(CNC(=O)c2ccc(Br)cc2)cc1	763516904	PKAWUECWOSOAAT-UHFFFAOYSA-N	433.262	1.485	50	20	IDGD	
Cc1nc(N2CCOCC2)ccc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccccc2)[nH]n1	763604862	OILBWKUFUQHKIE-UHFFFAOYSA-N	449.471	1.016	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccccc1C(=O)N1CCCC1	763662539	JIUMFAAJORDVPZ-UHFFFAOYSA-N	440.456	1.096	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccc(NC(=O)OC)c1	763682686	UJOIJBUFHQKDOU-UHFFFAOYSA-N	430.417	1.429	50	20	IDGD	
O=C(COc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1ccc2c(c1)CCCC(=O)N2	763686804	UMZWDVUYYVHBRE-UHFFFAOYSA-N	430.848	1.780	50	20	IDGD	
O=C(NNC(=O)C1=S=C2CCCC2=C1)C(=O)Nc1ccc([S@](=O)C(F)(F)F)cc1	763782954	IXBKABDAJZRVTP-LJAQVGFWSA-N	445.444	1.602	50	20	IDGD	
Cc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1cccc(C)c1C	763850795	ACAJPLCZMNODNT-INIZCTEOSA-N	440.500	1.867	50	20	IDGD	
CCS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)cc1	763872834	PEUOLSZQAAIYIK-LBPRGKRZSA-N	437.449	1.173	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(NC(=O)COC)cc2)cc1OC	763900278	CGBHBBVYWGLKKF-UHFFFAOYSA-N	444.444	1.079	50	20	IDGD	
COc1c(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCCCCC3)cccc1C(N)=O	763911812	NNEFNUSCWMIVSE-UHFFFAOYSA-N	444.513	1.914	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl	763944777	PQIOCVXKLSLDKX-UHFFFAOYSA-N	444.791	1.539	50	20	IDGD	
Cc1ccccc1-n1nccc1NC(=O)C(=O)NNC(=O)c1cc(Br)c[nH]1	763994386	CPHWCMDETWSIRF-UHFFFAOYSA-N	431.250	1.671	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1ccc(C(=O)NC2CC2)cc1	764013508	YXHHNBJZNDNEBM-UHFFFAOYSA-N	430.848	1.641	50	20	IDGD	
C#CCOc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(F)cc2Br)cc1	764084669	FZUFMEAMJLPTFA-UHFFFAOYSA-N	434.221	2.000	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc([S@](=O)C(F)(F)F)cc2)c(O)c1	764105767	XXYZVNQUEPJLMW-LJAQVGFWSA-N	429.376	1.728	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccnn2Cc2ccc(Br)cc2)n[nH]1	764106760	RFHUMFFUMHGFKI-UHFFFAOYSA-N	446.265	1.125	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2ccc(-n3cncn3)c(F)c2)cc1	764127106	NSHRKOOSKWSJFR-UHFFFAOYSA-N	426.408	1.134	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1cccc(OC[C@H]2CCCO2)c1	764132499	PHGCDVJXPPWRNJ-GOSISDBHSA-N	427.457	1.582	50	20	IDGD	
COC(=O)CCCOc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)cc1	764153599	MGCUGRQBGIEMIN-GOSISDBHSA-N	441.440	1.108	50	20	IDGD	
CC(=O)N(C)c1ccccc1NC(=O)C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C	764204524	XQKUYFMNXBKGPF-UHFFFAOYSA-N	435.481	1.060	50	20	IDGD	
O=C(NNC(=O)c1cccc(OC(F)F)c1)C(=O)Nc1ccccc1CN1CCOCC1	764259493	JARDTPGDWBLICY-UHFFFAOYSA-N	448.426	1.520	50	20	IDGD	
Cc1ccc(C(=O)N2C[C@@H](C)C[C@@H](C)C2)cc1NC(=O)C(=O)NNC(=O)Cc1cc[nH]n1	764293454	PFNMHXDGPRYLJY-OKILXGFUSA-N	440.504	1.165	50	20	IDGD	
N#Cc1ccc(-n2ccc(NC(=O)C(=O)NNC(=O)Cc3ccccc3F)n2)c(Cl)c1	764318612	GAFREWTXOFDHTF-UHFFFAOYSA-N	440.822	1.865	50	20	IDGD	
COc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NNC(=O)CCCc1cccs1	764340126	TXEMNGHIGWOOLX-UHFFFAOYSA-N	432.502	1.567	50	20	IDGD	
COC(=O)c1cc2cc(NC(=O)C(=O)NNC(=O)c3ccc(O)c(Cl)c3)ccc2o1	764349547	OIBJAGDILKTHAI-UHFFFAOYSA-N	431.788	1.978	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)C(=O)Nc1ccc(C(=O)NCc2ccccc2F)cc1	764353256	GQCABJHOLWHILQ-UHFFFAOYSA-N	449.442	1.479	50	20	IDGD	
CC(C)OC(=O)c1c(NC(=O)C(=O)NNC(=O)c2cnn(C)c2)sc2c1CCCC2	764360154	TZNMTTBCRHHTBX-UHFFFAOYSA-N	433.490	1.325	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)C(=O)Nc1ccc(-c2nnnn2C(C)C)c(F)c1	764389523	SHOZCAJYULBVIA-UHFFFAOYSA-N	426.412	1.163	50	20	IDGD	
Cc1c(Br)cc(C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)c(=O)n1C	765184581	IMSUQCQVHQWKJE-UHFFFAOYSA-N	430.262	1.921	50	20	IDGD	
O=C(CNC(=O)c1ccccc1OC(F)F)NNC(=O)CSc1ccccc1O	765404519	WPDUAXQELZVILK-UHFFFAOYSA-N	425.413	1.663	50	20	IDGD	
CCC1(CC)NC(=O)N(CC(=O)NNC(=O)c2cc(-c3cc(C)ccc3C)[nH]n2)C1=O	765582282	VULCVESRIUIKLD-UHFFFAOYSA-N	426.477	1.565	50	20	IDGD	
CCn1c(=O)n(CC(=O)NNC(=O)c2cc(-c3ccccc3OC)[nH]n2)c2ccccc21	765592063	HZTKTIVKQXHFMW-UHFFFAOYSA-N	434.456	1.683	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3ccc(OCC(N)=O)cc3)n[nH]2)cc1OC	765597006	PTRQEPXKYFWTPP-UHFFFAOYSA-N	439.428	1.033	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)[C@@H]3CCC[C@H](C)C3)CC2)cc1	765727856	JCMCTRMPUORTHQ-ZWKOTPCHSA-N	436.578	1.275	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1cc2ccccc2oc1=O	765735382	LTAOELIZTATWNO-UHFFFAOYSA-N	434.452	1.012	50	20	IDGD	
O=C(CCc1ccccc1Cl)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765736740	ADTNATRKFXKGDL-UHFFFAOYSA-N	428.920	1.878	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)cc1	765756673	NMMDCHIWWXZLGN-UHFFFAOYSA-N	446.935	1.693	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cccn3Cc3ccncc3)CC2)cc1	766647152	AGKUUVJESZBJCX-UHFFFAOYSA-N	446.555	1.819	50	20	IDGD	
C[C@H](C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1)N1CCc2ccccc21	766653241	RWWRNALLAZBELM-GOSISDBHSA-N	435.528	1.043	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)c(-c2cccs2)n1	768277936	BIUCHZNXNPDNDX-UHFFFAOYSA-N	439.906	1.524	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)CN3CCCCCCC3=O)n[nH]2)cc1OC	768279803	UIKBLDVRKDIUFI-UHFFFAOYSA-N	429.477	1.648	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)c1ccc(C[C@@H]2CC(=O)NC2=O)cc1	768628576	AIOKURGAUVLHDA-CQSZACIVSA-N	431.470	1.061	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)NC2CCN([C@@H]3CCCC[C@H]3O)CC2)nc2ccccc21	769158995	CHZAMNNJMDNSBM-RTBURBONSA-N	428.537	1.214	50	20	IDGD	
C[C@@H]1C[C@@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)CCO1	770353477	CCEGPAWNPZSSEH-QAPCUYQASA-N	446.529	1.677	50	20	IDGD	
COC(=O)COc1cccc(CNC(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)c1	770394578	CRTYKXOHAWOPCP-UHFFFAOYSA-N	443.464	1.665	50	20	IDGD	
O=C(NNC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1)c1cnc2[nH]nnc2c1	771500755	BIMYUVCOEHTOOF-UHFFFAOYSA-N	425.412	1.675	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNS(=O)(=O)c1cc(F)ccc1[N+](=O)[O-]	771604418	KBQOCXHTUJKXQX-UHFFFAOYSA-N	430.801	1.013	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cnn(CC(=O)NC3CCCC3)c2)cc(OC)c1OC	772048567	VULVTRVBOAHSEI-UHFFFAOYSA-N	445.476	1.043	50	20	IDGD	
C=CCc1ccc(OCC(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)c(OC)c1	772191189	CXEJTADSIYBGNN-UHFFFAOYSA-N	431.876	1.920	50	20	IDGD	
COc1cc(Br)c(S(=O)(=O)NNC(=O)c2ccccc2F)cc1C(=O)O	772860980	HTALBNZPTMTRPQ-UHFFFAOYSA-N	447.238	1.918	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(Br)c(C)n2)cc1OC	773513826	YKXAKQOCSGYPSJ-UHFFFAOYSA-N	437.250	1.569	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(C(F)(F)F)ccn2)cc1OC	773531967	NUZFZVFOCOYCLQ-UHFFFAOYSA-N	426.351	1.907	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)CN[C@H](C)c1ccc(S(=O)(=O)N(C)C)cc1	775194336	XHCMKCLFKUQXDN-MRXNPFEDSA-N	432.546	1.286	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)N[C@@H](c1ccccc1OC(F)F)C(F)(F)F	776001645	QFOCDTLOKNRZNM-KCJUWKMLSA-N	445.366	1.657	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2N2CCOCC2)cc1	776108516	RVXVQNRGBPRLJX-UHFFFAOYSA-N	429.433	1.313	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)[C@@H](C)n1nnnc1C(C)(C)C	777796131	UJKMWAFWUROCQV-GHMZBOCLSA-N	439.314	1.909	50	20	IDGD	
O=C(NNC(=O)[C@]12CCC(=O)N1c1ccccc1C(=O)N2C1CC1)c1cccc([N+](=O)[O-])c1	777838379	YBCLYODXKFJZAM-QFIPXVFZSA-N	449.423	1.497	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN(C)C[C@]2(O)CCN(Cc3ccccc3)C2)cc1C	778497675	KJMOYPJXXWLBOO-HSZRJFAPSA-N	444.601	1.949	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)c2c[nH]c(C#N)c2)c1	778522095	OAUXRSUDNQANRM-UHFFFAOYSA-N	439.453	1.771	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)[C@H](O)[C@H](O)c2nc3ccccc3s2)cc1OC	779473184	KENAYQOKRZQAOG-SJORKVTESA-N	431.470	1.559	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2c(N)cccc2[N+](=O)[O-])c1	779491656	SKDIEKXRUQVCJW-UHFFFAOYSA-N	435.462	1.282	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)c2cccc([N+](=O)[O-])c2Br)cc1	781678105	NHIHOSUHRQGSPE-UHFFFAOYSA-N	447.201	1.847	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)cc1)C(=O)Nc1ccc(Cl)cc1C(=O)N1CCCC1	782834353	SYDAWUOWNGEUDZ-UHFFFAOYSA-N	430.848	1.681	50	20	IDGD	
CN1CCC/C1=N/S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2cccc(F)c2)cc1	783035850	FKQUJEPUVSBVDM-ULJHMMPZSA-N	433.465	1.720	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2ccccc2CN2CCc3ccccc32)CCS(=O)(=O)C1	783426519	MLIGDYYUZNDCHM-JOCHJYFZSA-N	442.541	1.386	50	20	IDGD	
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)NNC(=O)c1cccc(OC(F)F)c1	783828624	PRCYLMPITZZVCH-UHFFFAOYSA-N	445.356	1.606	50	20	IDGD	
CNC(=O)[C@@H]1CN(C(=O)C(=O)NNc2ccc(Br)c(C)c2)c2ccccc2O1	783921263	QCQJYCNQIRMCQP-INIZCTEOSA-N	447.289	1.741	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNc2cc(C)ccn2)c(C(=O)N2CCCC2)cc1OC	783929432	UZEURMUOLNDXJB-UHFFFAOYSA-N	427.461	1.725	50	20	IDGD	
N#C/C(=C/C1CC1)C(=O)OCC(=O)N1CCN(S(=O)(=O)c2ccc(Cl)s2)CC1	786673456	HDFKVMLFTMEDMR-LCYFTJDESA-N	443.934	1.638	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)N[C@H]1CCCN(c2ccc(Cl)cc2Cl)C1=O	788917282	UVCSPXHELSERCM-FZMZJTMJSA-N	447.319	1.871	50	20	IDGD	
O=C(NC[C@H]1CCCN(c2ccccc2)C1)NNC(=O)C1CCN(c2ncccn2)CC1	789316985	JGKTVHOIUUBNPY-GOSISDBHSA-N	437.548	1.940	50	20	IDGD	
CC(C)(C)n1cc(C#N)cc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	789757450	NTNARUCZIADTSK-UHFFFAOYSA-N	444.517	1.637	50	20	IDGD	
CCc1c(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)cnn1-c1ccccc1Cl	790490041	JSLVSMIHOIXLBE-LLVKDONJSA-N	425.898	1.219	50	20	IDGD	
O=C(NCc1nnc2n1CCOC2)NNC(=O)Nc1ccc(Br)cc1Cl	790676766	KNTHDFAJAYYTJR-UHFFFAOYSA-N	444.677	1.760	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)c2cc(Br)cc(S(N)(=O)=O)c2C)n1	794078351	YKZXHDWURQJJNI-UHFFFAOYSA-N	427.280	1.183	50	20	IDGD	
C=CCn1c(=O)c2ccccc2n2c(SCC(=O)NNC(=O)c3cccc(C)n3)nnc12	794090442	SPLDZFZLVVWNBI-UHFFFAOYSA-N	449.496	1.487	50	20	IDGD	
Cc1ccc(C)c(S(=O)(=O)NNC(=O)CNC(=O)OCc2ccccc2)c1[N+](=O)[O-]	794597408	SMOPMGSTYUTXJT-UHFFFAOYSA-N	436.446	1.448	50	20	IDGD	
COC(=O)c1cc(F)c(Br)cc1NC(=O)C(=O)NNc1nc(C)cc(C)n1	796990597	ZIZUZJXYZKKMJJ-UHFFFAOYSA-N	440.229	1.863	50	20	IDGD	
CCNC(=O)N(C)c1cccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)c1	797001200	GYQFVWJANPYGTQ-UHFFFAOYSA-N	433.852	1.611	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cc(-c3ccnn3C)ccc2C)cc1	799257625	NUWQLRVZROQHQK-UHFFFAOYSA-N	437.456	1.569	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1sc(N2CCOCC2)nc1-c1ccccc1	799564001	GFQBUXJSUMFSSG-ZDUSSCGKSA-N	432.502	1.749	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)NCCC(=O)NNC(=O)Nc2cc(F)cc(F)c2)cc1	802007051	ZZLMOOXOIJYBQQ-UHFFFAOYSA-N	440.428	1.689	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)Nc1cc(F)c(Br)c(Cl)c1	806720906	ARRMJTKWWSGYNN-ZCFIWIBFSA-N	428.667	1.829	50	20	IDGD	
O=C(CCc1ccco1)NNC(=O)C(=O)Nc1ccc2nccnc2c1Br	806977614	RCEGQMSFCADMJD-UHFFFAOYSA-N	432.234	1.704	50	20	IDGD	
N#Cc1cc(Oc2ccc(NC(=O)C(=O)NNC(=O)[C@H]3Cc4ccccc4O3)cc2)ccn1	810386707	NMOGAGVMZYJVQZ-HXUWFJFHSA-N	443.419	1.835	50	20	IDGD	
COC(=O)c1c(F)ccc(NC(=O)C(=O)NNC(=O)CCc2ccc(OC)cc2)c1C	810386958	YYHXTDHWUNBJKT-UHFFFAOYSA-N	431.420	1.648	50	20	IDGD	
CN(C)c1ncn(-c2cccc(NC(=O)NNc3ccc(S(=O)(=O)N(C)C)cc3)c2)n1	812963982	LFKRBRQMKRFSHM-UHFFFAOYSA-N	444.521	1.732	50	20	IDGD	
Cc1c(NC(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)cccc1N1CCNC1=O	812971428	JWRKAPDKICPGQT-UHFFFAOYSA-N	432.506	1.924	50	20	IDGD	
O=C1NC(=O)C(=NNC(=O)c2ccc(CN3C(=O)c4cccc5cccc3c45)cc2)C(=O)N1	814213531	DCADNPMCIKZFSZ-UHFFFAOYSA-N	441.403	1.452	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@@H]1CCCN(c2ccccc2)C1=O	814365889	YCVXMJJDULRMLM-INIZCTEOSA-N	443.529	1.492	50	20	IDGD	
Cn1cnnc1COCC(=O)NNC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1	814733262	NXDWPCXJEFPOGP-UHFFFAOYSA-N	432.444	1.041	50	20	IDGD	
O=C(NN=C1CC(C(=O)O)(c2cccc(Br)c2)C1)[C@@H]1CCS(=O)(=O)C1	814782190	SFVFCDJCJIZTLP-HQNRFAHOSA-N	429.292	1.472	50	20	IDGD	
CN(C)c1ccc(S(=O)(=O)N(C)C)cc1NC(=O)C(=O)NNc1cccc(Cl)n1	815728412	BQENQQLGBDBJCZ-UHFFFAOYSA-N	440.913	1.133	50	20	IDGD	
O=C(NNc1ncncc1F)c1cc(S(=O)(=O)N2CCCC2)ccc1Br	817079658	WKZMABANEBNUNS-UHFFFAOYSA-N	444.286	1.920	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NNC(=O)c2cn(Cc3ccccn3)nn2)C1	819658614	OBMISVAVGBNKCZ-CQSZACIVSA-N	429.481	1.130	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)CCNS(=O)(=O)c1ccccc1Cl	825649169	DLUIFTKRAVEMTA-UHFFFAOYSA-N	440.909	1.277	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)[C@@H]2CS[C@@H](Cc3ccccc3F)C(=O)N2)c1	896299567	FQUDAGPMRYHZSX-ROUUACIJSA-N	430.505	1.496	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCN(Cc3csc(C)n3)CC2)cc1OC	912888242	QXDHDIQUNHRDMJ-UHFFFAOYSA-N	433.534	1.048	50	20	IDGD	
N#Cc1ccc(S(=O)(=O)NCC(=O)NNC(=O)CC23CC4CC(CC(C4)C2)C3)cc1	913500064	JNCBPKVIJVLXSE-UHFFFAOYSA-N	430.530	1.590	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)c2cc(S(=O)(=O)NC(C)C)ccc2F)c1	914711076	NQLYQYMTDWDDCH-UHFFFAOYSA-N	437.493	1.969	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H]2CC(=O)N(C(C)(C)C)C2)c1	914748521	LAFRVOLZYJGXMX-HNNXBMFYSA-N	438.550	1.125	50	20	IDGD	
COc1cccc(CO[C@@H](C)C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c1	915275216	QSPQNPSOCMIJLD-IBGZPJMESA-N	440.544	1.960	50	20	IDGD	
CC1=NN(c2ccc(C(=O)NNC(=O)c3sc(N4CCOCC4)nc3C)cc2)CC1	915357363	AZRWRFJMSNMHKB-UHFFFAOYSA-N	428.518	1.949	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)NC[C@@H](c2ccc(F)cc2)N2CCOCC2)c1	915897388	FCBJVDUKJGYGRM-FQEVSTJZSA-N	429.496	1.909	50	20	IDGD	
O=C(NCCCN1C(=O)NC2(CCCC2)C1=O)NNC(=O)C12CC3CC(CC(C3)C1)C2	915906202	RFOQHEGIKLWSOO-UHFFFAOYSA-N	431.537	1.788	50	20	IDGD	
O=C(NCCCNc1ccccn1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	916576522	JAHLWXHEGIZYJV-UHFFFAOYSA-N	446.533	1.312	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2CC(=O)N(c3ccc(Cl)cc3)C2)c1	917108935	VJJWLLPLZKDOAB-CYBMUJFWSA-N	435.889	1.558	50	20	IDGD	
COc1cccc(SCC(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1	917291153	NTDCXMBUTPEMPS-QGZVFWFLSA-N	432.454	1.318	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2cccc(C(=O)NC3CC3)c2)ccc1OC(C)C	917727914	SCQGFVBAEFYHCK-UHFFFAOYSA-N	447.513	1.998	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)c1nnn(-c2cccc([N+](=O)[O-])c2)c1C	920424728	XJCMWNJNIMHVTC-UHFFFAOYSA-N	426.389	1.333	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)Nc2nc(CN3C[C@H](C)O[C@H](C)C3)cs2)c1O	920938311	JXRGRJPDRQRSKZ-TXEJJXNPSA-N	435.506	1.933	50	20	IDGD	
C[C@@H](OC[C@H]1CCCCO1)C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	921166736	NRIQDDCWIYLEKL-NVXWUHKLSA-N	439.534	1.206	50	20	IDGD	
C[C@@H](CC(=O)NNC(=O)c1ccccc1Cl)NS(=O)(=O)c1cccnc1Cl	1318359599	NYFVXZPYXNURFF-JTQLQIEISA-N	431.301	1.907	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2CCCCN2Cc2ccncc2)c1	1318462312	FEIGOBOONZIJNU-IBGZPJMESA-N	445.545	1.148	50	20	IDGD	
C[C@H]1CN(C(=O)c2ccc(CNC(=O)NNc3nncc(N)c3Cl)cc2)C[C@@H](C)O1	1319308719	DHZUDKOUIZKRGH-TXEJJXNPSA-N	433.900	1.788	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)c2ccc(OC)cc2)cc1F	1319638455	KEXLSGAXMFCYAO-UHFFFAOYSA-N	431.467	1.219	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)c3cc4cccnc4s3)C2)C1	1777758672	QAGKJJCDLWSFJQ-OAQYLSRUSA-N	445.545	1.113	50	20	IDGD	
Cn1cc(F)cc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Br)C2	1778376081	XFBFVHXTXUNZJJ-JKIFEVAISA-N	434.281	1.982	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)C#CC3(O)CCCCC3)C2)C1	1779066621	BPSSQWSHWXEVGW-JXFKEZNVSA-N	441.366	1.688	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@]2(C1)CN(C(=O)Cn1nnc3ccccc31)CCO2	1779294076	LAUWWQKXIMXQNF-HXUWFJFHSA-N	431.569	1.113	50	20	IDGD	
COC(C)(C)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1	1780095280	OHGSVIWXINZHBA-OAQYLSRUSA-N	449.460	1.389	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cnc4cc(C)ccn4c3=O)CCO2)C1	1781218838	KGDKKSXENPBXFI-KKSFZXQISA-N	432.908	1.464	50	20	IDGD	
COc1cc(F)ccc1C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781333896	HLXXFZTYIWIARH-RHSMWYFYSA-N	433.249	1.968	50	20	IDGD	
C/C=C(\C)C(=O)N1CC[C@]2(CN(C(=O)CN(C)NC(=O)NCc3ccccc3)CCO2)C1	1783071672	PDUSJRLAENTNNC-BWQBYBMGSA-N	443.548	1.129	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cn4ccc(Cl)cc4n3)CCO2)C1	1783874063	CDZUMOANGBEXFE-LIRRHRJNSA-N	441.315	1.685	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@]1(F)CCCCC1(F)F)CCO2	1783875651	SADLCKUKTUCYJD-JQFCIGGWSA-N	426.863	1.988	50	20	IDGD	
COc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]3C2)ccn1	1783969750	KJHMDRBGXHGMPE-OEAJRASXSA-N	440.338	1.715	50	20	IDGD	
C[C@@H](Cn1ccnc1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]2C1	1783973647	CFLJAJJRLOLNKP-WOYTXXSLSA-N	441.370	1.530	50	20	IDGD	
COC(=O)[C@@H]1CC[C@@H](C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]32)C1	1784088112	VOBAYOUBUBKFEB-IZAUMXAJSA-N	449.375	1.792	50	20	IDGD	
Cc1ccc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)CBr)C[C@@H]32)cn1	1785397301	GZTCSSHPAAVJKE-QCSYZSNVSA-N	438.366	1.943	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC1(c2ccc(NC(=O)c3ccc(=O)oc3)cc2)CCC1	1787590991	WHOFBUTXJSCMFT-UHFFFAOYSA-N	426.473	1.761	50	20	IDGD	
COc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]32)nc1	1787760737	SNUHDNLRBFRHGB-HAHWVIBASA-N	430.332	1.920	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc(C(C)(C)C)cn3)[C@H]2C1	1787788247	KTQPWMNOQBRYDZ-MPTYRVRUSA-N	438.956	1.621	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3c[nH]c4ncccc34)[C@H]2C1	1787878071	XMEJYUSVCMSMLR-KNPMLCFXSA-N	435.322	1.940	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)c1ccn2nccc2c1	1788448025	QQOZOEMKETXMEQ-QCEMKRCNSA-N	439.285	1.618	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3Cc4ccccc4O3)C[C@@H]21)[C@H](F)Br	1789925677	HHFLZHXTOFLYLU-HNWLLIRGSA-N	441.297	1.660	50	20	IDGD	
Cc1nccn1[C@@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]2C1	1789927285	SYZVUAIMMGKVPZ-MFGQWXODSA-N	431.306	1.423	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1)c1cc[n+]([O-])cc1	1789951717	VGICQRCFTMTUNB-UHFFFAOYSA-N	431.257	1.061	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3n[nH]c4ccc(C#N)cc34)[C@H]2C1	1790330625	LYYANTWBNAPEAX-SCNOPHJPSA-N	445.907	1.282	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)Cn3ccnc3)C[C@@H]21	1790964543	ZVKQQWOHAWEOPH-HMDCTGQHSA-N	441.370	1.672	50	20	IDGD	
O=C(COc1ccccc1F)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21	1790967339	QKNOHZCGXMLKQI-HJXMPXNTSA-N	447.276	1.875	50	20	IDGD	
CCc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](C)Br)[C@H]3C2)n(C)n1	1791058775	FIIVDAWAGVJUNG-DUPGQFARSA-N	427.343	1.359	50	20	IDGD	
C[C@@H](C(=O)Nc1ccc(C2(NC(=O)c3cnccc3C(=O)NN)CCC2)cc1)n1ccnn1	1791099339	BZUOPEHOPJXXQM-AWEZNQCLSA-N	448.487	1.286	50	20	IDGD	
NC(=O)c1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCBr)C[C@@H]32)cc1	1791893077	ORQKWNPFBPVHQQ-JYJNAYRXSA-N	438.322	1.164	50	20	IDGD	
CCOC(=O)N1CCC(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](Cl)CC)C[C@@H]32)CC1	1792144302	ZXXMZOQAKUZDKW-FJIDUMEYSA-N	443.972	1.852	50	20	IDGD	
C[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCl	1793111439	IUCWXBAVDKMAIS-WBAHDQRJSA-N	443.972	1.727	50	20	IDGD	
CC(C)(C)OC(=O)NCCOCCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](O)CCl)C2	1793417026	PMERWXFRZHCFHK-FZKCQIBNSA-N	447.960	1.156	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)COc1cccnc1	1793933656	FUNMDDIWRSCZHU-VWPFQQQWSA-N	426.311	1.081	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@](C)(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Cl)C3)C1	1797181400	YYZCZJPDGBSQKO-SGQRUEDASA-N	447.935	1.758	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1n[nH]c2c(F)cccc12	1797493387	UAFMUAUKRQPDCP-DYNIEEOBSA-N	439.285	1.689	50	20	IDGD	
COc1ccccc1OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@](C)(Cl)CCl	1799273542	KWUFRPKIONUVHJ-VLBMKZOESA-N	445.343	1.900	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(C)nc1OC)C2	1800642070	VBMXMXILJXCNMH-OCVGTWLNSA-N	440.338	1.775	50	20	IDGD	
CC[C@H](NC(C)=O)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@H]1c1cccnc1	1802549475	NOGGUPSJMVHILA-YHUYYLMFSA-N	443.317	1.693	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1)c1cc(O)ncn1	1803739397	VWODJMLSOGVPDB-CXAGYDPISA-N	434.294	1.682	50	20	IDGD	
CCOC(=O)N[C@H](O)C(=O)NC[C@H]1CCN(C(=O)C(C)(C)CCl)[C@@H]1c1cccnc1	1810086739	IKPSSHAPOXGTMN-BFYDXBDKSA-N	440.928	1.417	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)CCNC(=S)NC)[C@@H]1c1cccnc1	1810306544	VPPCILNAISXWOQ-RYRKJORJSA-N	440.013	1.979	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)c1cc2cccnn2n1	1811264465	XKIBADHQHZBXLL-JCGIZDLHSA-N	428.880	1.044	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)c1cnn2cccc(F)c12	1812280599	NQXJFCOMTXQZDT-BMGDILEWSA-N	445.882	1.788	50	20	IDGD	
O=C(CN1CCCC1=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCBr)CC2	1814589999	DMZSSAILBONTFL-JTQLQIEISA-N	429.340	1.463	50	20	IDGD	
C[C@H](NC(=O)c1ccccn1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](O)CCl)n[nH]1	1814875031	MLDACNLAIKXRAL-APHBMKBZSA-N	448.911	1.215	50	20	IDGD	
C[C@@H](C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1)c1ccccc1	1815347751	NIAUMAASHMIPMI-RDTXWAMCSA-N	449.341	1.852	50	20	IDGD	
O=C(CCBr)Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)n2)[nH]n1	1816780635	BGNZOKUEUTZFJW-LLVKDONJSA-N	439.270	1.702	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)C(F)(F)C(F)F)[nH]n1)c1ccc(B(O)O)cc1	1817470145	KELIHPYXPOIRJS-ZDUSSCGKSA-N	442.178	1.296	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)CC(F)(F)F)[nH]n1	1819402153	PXXMXTKVBWUNMY-CYBMUJFWSA-N	439.398	1.667	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CO[Si](C)(C)C)n[nH]1	1819595324	HSPSWGJHAYAWPF-UKRRQHHQSA-N	438.605	1.961	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccncc2O)n[nH]1	1819676636	JCZZGZCMWOMYAD-OAHLLOKOSA-N	429.481	1.189	50	20	IDGD	
C[C@H](Cn1cncn1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](F)Br)CC2	1820072921	VPWXYFGYGTVKCC-LNLATYFQSA-N	445.318	1.673	50	20	IDGD	
CCCC(=O)N[C@H](C)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](Cl)COC)CC2	1820120355	WUUPCAKQCWWUPO-WOPDTQHZSA-N	430.958	1.614	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](F)Br)[nH]n1	1822415532	LHYANGKTRAYTBK-ABAIWWIYSA-N	447.309	1.465	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H](O)C(C)C)CC1	1824254236	QGXNSALRKCZHQG-UXIDLFCBSA-N	445.564	1.757	50	20	IDGD	
COC[C@@H](C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1	1824606238	YAANCCHELYFPMK-DNVCBOLYSA-N	431.537	1.201	50	20	IDGD	
C=C(CC(=O)OCC)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](Cl)COC)sc2C1	1826007021	POEHPLWCMKJUQL-VXGBXAGGSA-N	429.926	1.818	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1CCc2nc(NC(=O)COc3cccnn3)sc2C1	1826761352	AQVWNWVUZKDRNC-GFCCVEGCSA-N	435.582	1.776	50	20	IDGD	
Cc1cccnc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827055871	MWVZUJDNQUWPOV-NRFANRHFSA-N	435.333	1.617	50	20	IDGD	
O=C(c1nccs1)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827056033	OHRQKKCKKLETLN-SFHVURJKSA-N	427.335	1.370	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCC(F)(F)F)C2)C1	1830537073	BARCVGFBQZJQBR-IUODEOHRSA-N	445.276	1.816	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccnc3S)C2)C1	1831638666	GBMDGGFDBIVFCQ-KXBFYZLASA-N	427.954	1.848	50	20	IDGD	
C=CCSCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1832458702	WRNYXFFHSFSRGW-HIFRSBDPSA-N	425.320	1.053	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cn4ccccc4n3)CC2)CC1)[C@H](O)CCl	1833310635	WDYBJONKPRNBPO-GOSISDBHSA-N	433.940	1.119	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)c3cnc(O)nc3O)CC2)CC1	1833532158	FWCGYBNNQJBDHP-MRXNPFEDSA-N	439.944	1.481	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3coc(Cl)n3)CCO2)C1	1833557907	YWXSJLWTVTVUHS-HZPDHXFCSA-N	440.711	1.634	50	20	IDGD	
Cc1ocnc1C(=O)NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1	1836008864	COHIOVQBGLLAOL-HNNXBMFYSA-N	431.306	1.859	50	20	IDGD	
Cn1cc(CC(=O)N2CCC(N3CCC(NC(=O)[C@@H](F)Br)CC3)CC2)cn1	1836414499	NQIAQYUTIIKBEI-QGZVFWFLSA-N	444.349	1.225	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cccn3cncc13)CCO2	1837112526	FUCHBBSLVXMOHI-OAQYLSRUSA-N	446.580	1.256	50	20	IDGD	
O=C1Nc2ccccc2/C1=C/C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1837322496	CWPHZWSGRDCCHA-ORTJSENNSA-N	437.855	1.013	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3nccc4occc34)C2)C1	1837711886	VWBMZZDKHJLINW-OAQYLSRUSA-N	447.564	1.749	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(OC)ccn3)CCO2)C1	1837952388	UAJXOCMCJVXTSJ-OXQOHEQNSA-N	425.913	1.568	50	20	IDGD	
O=C(c1c(O)cc(O)cc1O)N1CCC(OC2CCN(C(=O)[C@@H](F)Cl)CC2)CC1	1838083922	GLYQEZUGFNQQSW-QGZVFWFLSA-N	430.860	1.950	50	20	IDGD	
O=C(c1ccn(-c2ccccc2)n1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1838745081	HALAAOPXAOAUFS-PXNSSMCTSA-N	436.871	1.477	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)NNc3ccccc3)C2)C1	1839141494	KBBYGWHZVKCFJN-DJPFJPOOSA-N	438.956	1.465	50	20	IDGD	
Cc1cccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)n1	1839151109	IGIHWOXTVJWAJR-OALUTQOASA-N	430.332	1.696	50	20	IDGD	
O=C(C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2)c1ccccc1	1839197623	CFSWTWIZQPIDOB-YJBOKZPZSA-N	443.269	1.016	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C1(Br)CC1)CCO2	1839205365	FZHUEFIWPVSDSX-BBRMVZONSA-N	437.762	1.778	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CNC(C)(C)C)C2)C1	1839963275	GLKVSUWJQNFHPZ-KSSFIOAISA-N	434.375	1.004	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)C3=C(C)OCC3)C2)C1	1839964171	JAFOJDCEYYFZIY-QAPCUYQASA-N	431.327	1.311	50	20	IDGD	
CCn1nc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)cc1C	1840033617	LIIIXAQOFNAYLX-KSSFIOAISA-N	443.342	1.065	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3c(C)c[nH]c3C)C2)C1	1840150758	RDPVJVZCDAOKLA-WIYYLYMNSA-N	441.956	1.274	50	20	IDGD	
C[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1)c1cccs1	1840375876	DFDSHRXGYOIECP-QEORTHHSSA-N	449.342	1.999	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)c2ccc(N3CCN(C)CC3)cc2)C1	1841036650	RZOOEOSDEFPJKB-IBGZPJMESA-N	434.968	1.509	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)C2CN(C(=O)c3ccccc3OC)C2)C1	1841248787	NGZHTJXESWWHRQ-QGZVFWFLSA-N	433.936	1.988	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCCC12CN(C(=O)[C@H]1CCCOC1)C2	1841925592	MCLBJILEEXNOOW-GJZGRUSLSA-N	429.945	1.749	50	20	IDGD	
CC(C)n1nc(C(=O)N2CCCC23CN(C(=O)[C@@H](C)Br)C3)cc1C(=O)O	1842261167	DORXQJPWSBUEBW-LLVKDONJSA-N	427.299	1.763	50	20	IDGD	
N#Cc1cccc(CCC(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)c1	1844263280	MGJSFTGOGNOXJL-UHFFFAOYSA-N	432.484	1.007	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)c2cc(C#N)c[nH]2)C1	1844796333	JRHAATIDHNGWGS-UHFFFAOYSA-N	437.412	1.851	50	20	IDGD	
COc1cc(C)c(C)cc1C(=O)N1CCCC12CN(C(=O)c1cnccc1C(=O)NN)C2	1845539707	XZKBKXWCSBTMQH-UHFFFAOYSA-N	437.500	1.441	50	20	IDGD	
Cc1ccc2c(/C=C/C(=O)N3CCCC34CN(C(=O)c3cccc(B(O)O)c3)C4)c[nH]c2c1	1847120800	HJUBIDOCLYGVGA-VQHVLOKHSA-N	443.312	1.687	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@@H](O)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@](C)(Cl)CCl	1847512629	QYXIQWBOZPRISB-ZVZLLHMNSA-N	438.352	1.310	50	20	IDGD	
O=C(Cc1cc(Br)ccc1O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl	1847565453	RRLBNTZUAQFPDS-KCQAQPDRSA-N	431.714	1.499	50	20	IDGD	
CNS(=O)(=O)c1ccc(C(=O)NNC(=O)Cc2nc(-c3ccccc3)cs2)cc1	10600665	KCPLKROPUXBVSG-UHFFFAOYSA-N	430.511	1.722	50	20	IDGD	
COc1ccc(Cl)cc1N1C[C@H](C(=O)NNC(=O)COc2ccc(C#N)cc2)CC1=O	15706146	CCRCPQXIZJZNLS-CQSZACIVSA-N	442.859	1.800	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cnc3n(c2=O)CCS3)ccc1OCCC(C)C	15765004	FRBKRHDPGDETHI-UHFFFAOYSA-N	432.502	1.857	50	20	IDGD	
NS(=O)(=O)Cc1cccc(C(=O)NNC(=O)NCc2cccc(C(F)(F)F)c2)c1	726528887	JWSHDDABUWTMLR-UHFFFAOYSA-N	430.408	1.638	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)cn1	726871190	FLCYZBDEIYMKKO-UHFFFAOYSA-N	433.490	1.731	50	20	IDGD	
CC(C)c1ccccc1NC(=S)NNC(=O)[C@@H]1CC(=O)N([C@@H]2CCS(=O)(=O)C2)C1	727171860	OHWDSXSBGQOLII-ZIAGYGMSSA-N	438.575	1.163	50	20	IDGD	
CCCS(=O)(=O)Nc1ccc(C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc1	728064337	CLKHNOLMRLXHAO-UHFFFAOYSA-N	443.485	1.804	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)Cc3c[nH]c4cc(F)ccc34)cc2)CC1	728214520	QOOMDARJUZJKLF-UHFFFAOYSA-N	445.520	1.929	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)CSCc3cccnc3)cc2)CC1	728214666	DMYFAOFUMGJKSQ-UHFFFAOYSA-N	435.575	1.394	50	20	IDGD	
CC(=O)Nc1cc(Cl)ccc1C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	728342404	DKSLTGOAKKMNEZ-KRWDZBQOSA-N	447.831	1.443	50	20	IDGD	
Cc1c(C=NNC(=O)[C@@H](C)NS(C)(=O)=O)c2ccccn2c1C(=O)c1ccccc1	728435038	UBPCEWQETYOWQV-OAHLLOKOSA-N	426.498	1.867	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc(Br)cc(C(=O)O)c1F)c1ccccc1O	728501446	LGRWTVCJSRTDOZ-UHFFFAOYSA-N	433.211	1.615	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2ccc(N3CCC(C)CC3)nc2)n1	728732423	WYDQCSWQHDVGGM-UHFFFAOYSA-N	431.518	1.630	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCCCNC(=O)OC(C)(C)C)c2ccccc2c1=O	729054047	KJZVJDLOSBJBME-UHFFFAOYSA-N	432.481	1.275	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)Cc2c(C)nc3c(c(O)nn3C)c2C)cc1	729282554	BOQWCQWXKPFWGN-AWEZNQCLSA-N	441.488	1.847	50	20	IDGD	
N#C/C(=C\c1ccc(OC(F)(F)C(=O)O)cc1)C(=O)Nc1ccc(S(N)(=O)=O)cc1	730732269	HSDZOMRAESXGLY-FMIVXFBMSA-N	437.380	1.936	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)CS(=O)(=O)Cc1ccc(Br)cc1	731330492	XVJJXVDVSMAOTL-UHFFFAOYSA-N	443.294	1.893	50	20	IDGD	
Cc1ccc(C)c(NC(=S)NNC(=O)CN2C(=O)COc3ccc([N+](=O)[O-])cc32)c1	731531664	GACVBFDGVUYVIH-UHFFFAOYSA-N	429.458	1.955	50	20	IDGD	
CC(C)(C)OC(=O)NCc1ccc(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1	731853954	NTSWSGFBHURRNA-UHFFFAOYSA-N	437.460	1.762	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NC[C@H]2CCc3ccccc32)cc1	732468703	COFFFOPYTGCEMZ-QGZVFWFLSA-N	430.530	1.676	50	20	IDGD	
O=C(CCc1nc(-c2nc[nH]n2)no1)NNc1cc(C(F)(F)F)nc(-c2cccnc2)n1	734259460	VVIHISWDOQVONI-UHFFFAOYSA-N	446.353	1.801	50	20	IDGD	
COc1ccc([C@@H]2[C@@H](C(=O)NNC(=O)c3nnc(O)c4ccccc34)CCC(=O)N2C)cc1	734416999	GPMATRJSVZEYCT-FXAWDEMLSA-N	449.467	1.715	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)NCc2cc(S(N)(=O)=O)ccc2F)cc1OC	734673124	GKRCSPPYXYUOJH-UHFFFAOYSA-N	440.453	1.025	50	20	IDGD	
CC(=O)NCC(=O)N1CCc2cc(C(=O)NNC(=O)c3cc(Cl)ccc3O)ccc21	735686096	AGTOOTZHQUXPJB-UHFFFAOYSA-N	430.848	1.146	50	20	IDGD	
CC1(C)[C@H]2OCC[C@@H]2[C@H]1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	741425555	LWWMJRIDWMGFGD-ZACQAIPSSA-N	436.534	1.229	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)c2cn([C@@H]3CCS(=O)(=O)C3)nc2C(C)C)c1	742473023	ZKUAZFQUAYBVJF-MRXNPFEDSA-N	448.545	1.823	50	20	IDGD	
O=C(O)COc1ccc(S(=O)(=O)NNC(=O)c2cccc(Br)c2)cc1	743263871	JTFZOIJSWDPQSL-UHFFFAOYSA-N	429.248	1.536	50	20	IDGD	
COc1cc(C=NNC(=O)Cc2cc(O)nc(O)n2)ccc1OC(=O)c1cccs1	743446460	VLRMTWDQHFWIOO-UHFFFAOYSA-N	428.426	1.870	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)N[C@@H]1CC(=O)N([C@@H]2C[C@H]2c2ccccc2)C1	743510503	XIRFKCKFCGCHGA-SOLBZPMBSA-N	426.448	1.692	50	20	IDGD	
CN1CCN(c2ncccc2CNC(=O)NNC(=O)Nc2ccc(N(C)C)cc2)CC1	743565058	PDJPUNAOYRPLTP-UHFFFAOYSA-N	426.525	1.435	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])cc1	743826440	DIQACDXATPQYFO-UHFFFAOYSA-N	434.840	1.897	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCCN(c2nc(C)ns2)CC1	744420615	REXXIUITGCFYAJ-UHFFFAOYSA-N	438.941	1.482	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc2c(c1)nc(CCC(=O)NNC(=O)N(C)C)n2CC	746003044	ABTNMRZCMBWWSC-UHFFFAOYSA-N	438.554	1.322	50	20	IDGD	
O=C(COC(=O)c1cc(-c2ccccc2)ns1)NNC(=O)[C@@H]1COc2ccccc2O1	747102863	KGKXOPWUNHQLDD-KRWDZBQOSA-N	439.449	1.954	50	20	IDGD	
CCCS(=O)(=O)CC(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1	747785490	VDNYIZDXCXNNCO-HXUWFJFHSA-N	429.542	1.586	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)N2CCC(C(=O)NNc3cccc(C#N)c3)CC2)o1	748041686	VICWEBVYBFXPOI-UHFFFAOYSA-N	446.485	1.872	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)NCCC(=O)N1CCN(c2ccccc2)CC1	748464267	AONKDPXKDBYGSD-UHFFFAOYSA-N	449.515	1.326	50	20	IDGD	
CCCn1nc(C(=O)NNS(=O)(=O)c2ccc(C(=O)OCC)o2)c2ccccc2c1=O	748639540	ILPCLVHWOFMHCF-UHFFFAOYSA-N	448.457	1.200	50	20	IDGD	
COc1cc(OC)cc(N2CC[C@@H](NC(=O)NNC(=O)COc3ccccc3O)C2)c1	748659655	CPDJWXQEEMMEIR-CQSZACIVSA-N	430.461	1.398	50	20	IDGD	
Cn1c(N)c(C=NNC(=O)c2ccc(COc3ccc(Cl)cc3)cc2)c(=O)n(C)c1=O	749812020	JMCBZJFOBYRQJE-UHFFFAOYSA-N	441.875	1.663	50	20	IDGD	
Cn1c(=O)nc(O)c2nc(CCC(=O)Oc3ccc([N+](=O)[O-])cc3Br)[nH]c21	750716546	UODIPCKLQCHXQO-UHFFFAOYSA-N	438.194	1.571	50	20	IDGD	
CCN1C(=O)[C@@H]2CN(C(=O)/C(C#N)=C\c3cc(C)n([C@H](C)COC)c3C)CCN2C1=O	752507887	KFIFNTAISVMYBQ-HJKDRAGNSA-N	427.505	1.714	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)N[C@H]1CCCN(Cc2ccccn2)C1=O	753299303	QKPDGYKFFZBLPM-PBHICJAKSA-N	429.452	1.510	50	20	IDGD	
Cc1oc(C(=O)NNC(=O)c2cccc(Br)c2)cc1S(=O)(=O)N(C)C	753626088	ZXTHRNUOOQZZRM-UHFFFAOYSA-N	430.280	1.676	50	20	IDGD	
Cc1ccc2cccc(S(=O)(=O)NNC(=O)C3CCN(c4ncccn4)CC3)c2n1	753982623	UHTFPWXVTLSFMN-UHFFFAOYSA-N	426.502	1.559	50	20	IDGD	
Cc1cc(I)ccc1NC(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1	755352978	CSFDLRCIMHMZGS-SECBINFHSA-N	437.259	1.187	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2cccc([N+](=O)[O-])c2C)cc1	755406291	YGUATSWFHMKZPB-UHFFFAOYSA-N	435.462	1.685	50	20	IDGD	
CN1CCN(C(=O)c2ccccc2NC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)CC1	755624304	RWXZTIWPJAVIHM-UHFFFAOYSA-N	426.433	1.449	50	20	IDGD	
COc1ccc(S(=O)(=O)C(F)(F)F)cc1NC(=O)NNC(=O)Cc1ccncc1	756297159	CLAFYUVBZBFCIJ-UHFFFAOYSA-N	432.380	1.779	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)Nc2ccc(OC)c(N3CCOC3=O)c2)cc1	756812555	DDUHDRFWAWNQHB-UHFFFAOYSA-N	430.417	1.892	50	20	IDGD	
O=C(NN=c1cc[nH]cc1Cl)[C@@H]1CCCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1	757418090	YUBHNNZFVXHTEV-GFCCVEGCSA-N	439.881	1.609	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)COc2ccc(F)cc2)cc1-n1nnnc1C1CC1	757621176	NJCZTJXRZYDKGF-UHFFFAOYSA-N	441.423	1.919	50	20	IDGD	
O=C(COC(=O)C(F)(F)c1c(F)cccc1F)NNC(=O)[C@H]1COc2ccccc2O1	757827902	OJYNYYGSQOIPQE-CQSZACIVSA-N	442.321	1.587	50	20	IDGD	
CCc1cc(C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)c(C)nn1	759390629	GYIIRSREZFMYRI-UHFFFAOYSA-N	430.940	1.580	50	20	IDGD	
O=C(NNc1nccc(N2CCOCC2)n1)[C@H]1CCCN(C(=O)COc2ccccc2)C1	762860751	IOEXTERGEPAYHO-KRWDZBQOSA-N	440.504	1.074	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)N[C@H]1CCN(c2ccc(Cl)c(F)c2)C1	763461392	YIMHBEXFISWPPC-ZDUSSCGKSA-N	444.858	1.678	50	20	IDGD	
O=C(NNC(=O)c1ccccc1Br)C(=O)Nc1cccc(-n2ccnn2)c1	763484372	YJZGOHYALJWNCQ-UHFFFAOYSA-N	429.234	1.430	50	20	IDGD	
O=C(NNC(=O)c1c[nH]c2ccccc12)C(=O)Nc1ccccc1CN1C(=O)CCC1=O	763541618	ZBJBGAJZWKCRIK-UHFFFAOYSA-N	433.424	1.217	50	20	IDGD	
CC(C)(C)NC(=O)c1ccccc1NC(=O)C(=O)NNC(=O)[C@H]1COc2ccccc2O1	763572228	MDVLOENIBYMADK-QGZVFWFLSA-N	440.456	1.141	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)Nc1ccccc1OC1CCCC1	763573703	UNCHIWIVUZPNMZ-LJQANCHMSA-N	425.441	1.934	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(-n2cccn2)c(F)c1	763645827	CPHOMYMJUZMSGA-UHFFFAOYSA-N	427.392	1.185	50	20	IDGD	
CO[C@H](C)C(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)c1	763686788	UEGRIKYHMXGMGY-GFCCVEGCSA-N	448.863	1.478	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(-n2cncn2)c(Cl)c1	763716189	BXQBBJQQOGFBHY-UHFFFAOYSA-N	442.863	1.648	50	20	IDGD	
CCc1cccc(C)c1NC(=O)C(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1	763731548	AZMOJDDUSIZWNY-UHFFFAOYSA-N	446.529	1.272	50	20	IDGD	
NC(=O)CCSc1ccccc1NC(=O)C(=O)NNC(=O)c1cc2c(s1)CCC2	763781186	GPQCCPRBLZPHDY-UHFFFAOYSA-N	432.527	1.604	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccc(NC(=O)c2ccoc2)c1	763808332	LAZVLTRVRKGHDI-UHFFFAOYSA-N	447.407	1.568	50	20	IDGD	
Cc1ccc(C(=O)NC2CC2)cc1NC(=O)C(=O)NNC(=O)Cc1c[nH]c2ccccc12	763860979	MWPFPAGSQUFQQZ-UHFFFAOYSA-N	433.468	1.697	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccccc1CN1CCOCC1	763864626	DPJKQMKRSVYFDU-HNNXBMFYSA-N	444.463	1.211	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1cccc(-c2nccn2C)c1	763866638	XFNXMNLMVSRGBO-CYBMUJFWSA-N	425.420	1.780	50	20	IDGD	
CCCn1cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(Br)c2)cn1	763884249	TXWIZFPFUAIHKD-LLVKDONJSA-N	438.282	1.609	50	20	IDGD	
CCNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)CCSc2ccc(F)cc2)c1	763895426	DSIIBMDHMBISQJ-UHFFFAOYSA-N	432.477	1.844	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(N(CC)CC)nc2)cc1OC	763912019	KLVPTJHKQARCSV-UHFFFAOYSA-N	429.477	1.735	50	20	IDGD	
CC(C)(C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)cc1	763974500	RHXNHKFMJKKLSC-UHFFFAOYSA-N	432.864	1.974	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)cnn1-c1ccccc1F	763996206	WHZKNLYYACTOOJ-UHFFFAOYSA-N	449.240	1.810	50	20	IDGD	
CC[C@H](C)NS(=O)(=O)c1cccc(NC(=O)C(=O)NNC(=O)Cc2ccsc2)c1	764034612	SMRCYDKFJDGNMW-LBPRGKRZSA-N	438.531	1.154	50	20	IDGD	
CN1C(=O)c2ccc(NC(=O)C(=O)NNC(=O)Cc3cccc4ccccc34)cc2C1=O	764036267	MAOOHVDWKYHDBR-UHFFFAOYSA-N	430.420	1.394	50	20	IDGD	
C[C@H]1CC(C)(C)C[C@@]2(C1)NC(=O)N(CC(=O)NNC(=O)CSc1ccccc1O)C2=O	764049317	YEVIJJAKJPHEND-YEJXKQKISA-N	448.545	1.769	50	20	IDGD	
O=C1CCc2cc(NC(=O)C(=O)NNC(=O)c3ccc(F)cc3Br)ccc2N1	764084807	IDYIHOIKUGLRJA-UHFFFAOYSA-N	449.236	1.873	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cnn(Cc4ccccn4)c3)n[nH]2)cc1	764112193	XKWRJVYZYPUHMY-UHFFFAOYSA-N	444.455	1.425	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)cc1C(=O)OC	764117045	NMMMJUVKILSEFI-UHFFFAOYSA-N	449.803	1.019	50	20	IDGD	
CC(C)OCCOCc1cccc(NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)c1	764163726	LJFJDOJDSUXKMA-HXUWFJFHSA-N	441.484	1.718	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)C(=O)NNC(=O)CC1CCCC1	764183702	KDQFJWRHBOPFFN-UHFFFAOYSA-N	440.522	1.002	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)CN(C)C3)c1	764231236	GARPKBQIDMMNGD-UHFFFAOYSA-N	447.289	1.803	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccccc2I)c1	764237924	NLKUSIWMLCMBTE-UHFFFAOYSA-N	434.193	1.563	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)c2ccc(F)c(I)c2)C[C@@H](C)O1	764321382	UUTNEBNJSVESKC-GHMZBOCLSA-N	449.264	1.691	50	20	IDGD	
COC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)cc1F	764382684	PLDCYRJCJCPADP-UHFFFAOYSA-N	446.420	1.855	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)c(OC)cc1Cl	764403745	AGYYBWHBGCJCFC-UHFFFAOYSA-N	439.877	1.941	50	20	IDGD	
O=C1C[C@H](Cc2ccc(NC(=O)C(=O)NNC(=O)c3ccc(Cl)cc3F)cc2)C(=O)N1	764410939	WYNTUMNTKMSCOX-NSHDSACASA-N	446.822	1.084	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1F)C(=O)Nc1cccc(C(=O)N2CCOCC2)c1	764411521	ZQCLGHHDOJWCPL-UHFFFAOYSA-N	448.838	1.351	50	20	IDGD	
CCCOC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cncc(NC(C)=O)c2)cc1	764434591	XTGRPCDGACSVKE-UHFFFAOYSA-N	427.417	1.007	50	20	IDGD	
CCc1ccc(C(=O)OCC(=O)NNC(=O)Cc2ccccc2C)cc1S(C)(=O)=O	766168231	AFCJLNKHGDUNPM-UHFFFAOYSA-N	432.498	1.508	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1ccnc(Br)c1	766640842	CCEKHKSEPIKUDK-UHFFFAOYSA-N	446.305	1.063	50	20	IDGD	
Cc1cc(C)cc(C2(C(=O)NNC(=O)CN3CCN(C(=O)c4ccccc4)CC3)CC2)c1	766645721	SATAVNXQMSWRKY-UHFFFAOYSA-N	434.540	1.940	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)CN1CCN(C(=O)c2cc3ccccc3[nH]2)CC1	766873272	YRTZYGSCHZGTRS-UHFFFAOYSA-N	433.512	1.624	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1cccc(Br)n1	767163606	OPIVXXRFXIXMGQ-UHFFFAOYSA-N	426.296	1.520	50	20	IDGD	
O=C(NNc1nccc(N2CCOCC2)n1)c1ccc2c(c1)nc(O)n2CC(F)(F)F	768245045	YQMLNGJVEPLHOG-UHFFFAOYSA-N	437.382	1.688	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)CSc1nnc(N2CCOCC2)n1C1CC1	768291177	NXFLPBQUNNTJQA-UHFFFAOYSA-N	430.534	1.240	50	20	IDGD	
Cc1cc(CSc2ncccc2C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)no1	769597766	RGADILZJGWFDMW-UHFFFAOYSA-N	436.457	1.721	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)[C@@H](C)Oc1cccc(Cl)c1)c1cccc(S(N)(=O)=O)c1	770102897	MJBRWKRUUZTWIZ-NWDGAFQWSA-N	440.909	1.846	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ncoc2-c2ccc(F)cc2)c1	770212062	MXKQPTQLLJXAFC-UHFFFAOYSA-N	432.433	1.806	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)N[C@@H]3CCN(C(=O)C4CCCC4)C3)nc21	770409480	BERMWHGHRMPMFE-CYBMUJFWSA-N	430.513	1.704	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)N[C@H]3CCCC[C@H]3N3CCOCC3)nc21	770410547	ASRLESFYCINAFL-LSDHHAIUSA-N	432.529	1.556	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2C[C@@H](C)N(C(=O)OC(C)(C)C)C[C@@H]2C)n1	772330473	LCWMZZNLLBEDQL-UONOGXRCSA-N	425.555	1.471	50	20	IDGD	
C#CCNS(=O)(=O)c1ccc(C(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)cc1	772955626	SIANSYQKSYCJJQ-CYBMUJFWSA-N	435.889	1.480	50	20	IDGD	
CN1CCN(C(=O)NNC(=O)C[C@](O)(c2nc3ccccc3s2)C(F)(F)F)CC1	773660152	VHOOUUCAEMJPAX-INIZCTEOSA-N	431.440	1.425	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCCCN(C)C)cc1C(=O)NNc1cc(Cl)nc(N)n1	773866753	YJQXBVKPVADLNW-UHFFFAOYSA-N	441.945	1.008	50	20	IDGD	
COc1c(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)cccc1C(N)=O	774009622	RLICLBULZBEVTI-SNVBAGLBSA-N	434.836	1.001	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@H](NC(=O)NNC(=O)CNC(=O)c1ccco1)C1CCCC1	775122579	XGOONXUWBZQLGR-AWEZNQCLSA-N	437.497	1.423	50	20	IDGD	
Cc1cc(N2CCC[C@H](NC(=O)NNC(=O)C(=O)Nc3ccc(C)c(C)c3)C2)n(C)n1	775139076	UMOBDKMVYQEBKA-KRWDZBQOSA-N	427.509	1.283	50	20	IDGD	
O=C(CSCC(=O)NN=c1cc[nH]c2ccccc12)NN=c1cc[nH]c2ccccc12	775604491	MSQYTDAKGZXIGR-UHFFFAOYSA-N	432.509	1.946	50	20	IDGD	
COCCO[C@H]1COCC[C@@H]1NC(=O)NNC(=O)Nc1cc(Cl)c(OC)cc1OC	776939805	RZRPDVAAIFFMDW-LRDDRELGSA-N	446.888	1.513	50	20	IDGD	
COCCO[C@@H]1COCC[C@@H]1NC(=O)NNC(=O)c1cc(OC)ccc1Br	777280346	ZMAWPRQNTPUXRT-LSDHHAIUSA-N	446.298	1.222	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)CCc2c(C)nc3c(c(O)nn3C)c2C)nc1C	778426794	RRWUSHMNTNAMIF-UHFFFAOYSA-N	427.465	1.642	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)c1cnn(-c2ccc(Br)cc2)c1	778440539	IZNNJIOSZYKVFM-UHFFFAOYSA-N	438.282	1.921	50	20	IDGD	
COc1cc(OC)c(NC(=O)C(=O)NNC(=O)c2scnc2C)cc1Br	778711014	UALLAOMIYABIAG-UHFFFAOYSA-N	443.279	1.631	50	20	IDGD	
COc1cccc(NNC(=O)c2ccc3c(c2)S(=O)(=O)N(C[C@@H]2CCCO2)C3=O)n1	780771094	AODBMSKAPVRHPI-ZDUSSCGKSA-N	432.458	1.171	50	20	IDGD	
CC(=O)Nc1ccc(C)c(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)c1	780842281	UYBYXAUDVNHAIS-UHFFFAOYSA-N	432.502	1.731	50	20	IDGD	
O=C(CN1CCC[C@@H](S(=O)(=O)NC2CCCC2)C1)NNC(=O)c1cccc(Cl)c1	782057117	YAVXIEOPACVMBT-QGZVFWFLSA-N	442.969	1.427	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2ccc(NC(=O)c3cccnc3)c(OC)c2)nc1	782145370	QNPKIXNLKNELER-UHFFFAOYSA-N	436.428	1.828	50	20	IDGD	
CC(C)C(=O)Nc1nc(CC(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cs1	782356559	XZVAQJIQZJGQQB-UHFFFAOYSA-N	449.445	1.193	50	20	IDGD	
O=C(O)c1cc(S(=O)(=O)NNC(=O)N2CCOCC2)c(Br)cc1Cl	782461501	DLHCUUYEVUZFPG-UHFFFAOYSA-N	442.675	1.036	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C(=O)Nc2ccc(F)c(Br)c2)nc2ccccc21	782887228	REGIZWQWDGWJGL-UHFFFAOYSA-N	448.252	1.804	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)[C@H]3CO[C@H](C)C3)c2)cc1	784142972	DBRYMQUNLVRONG-UKRRQHHQSA-N	433.486	1.682	50	20	IDGD	
CCN1CCc2ccc(NC(=O)C(=O)NNc3ccc(S(=O)(=O)NC4CC4)cc3)cc21	784216085	MSMDIFHVSOANEE-UHFFFAOYSA-N	443.529	1.592	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)F)cc1)C(=O)Nc1ccn(-c2ccccc2)n1	784835277	LNMNWGDACAQAME-UHFFFAOYSA-N	435.412	1.950	50	20	IDGD	
O=C(NNc1ccnc(Br)c1)C(=O)Nc1ccccc1C(=O)N1CCOCC1	784838020	QBJPKVVSVKKUEN-UHFFFAOYSA-N	448.277	1.398	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)COCc2ccnn2C)c2ccccc2c1=O	785689934	VHCNUZRAPYLVQV-UHFFFAOYSA-N	426.477	1.298	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCC(=O)c2cccn21)c1ccc(S(=O)(=O)N2CCCC2)cc1	788721567	WEQKGHROKIGZEP-KRWDZBQOSA-N	430.486	1.251	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)Nc2ccc(-c3cnn(C)c3)nn2)c2ccccc2c1=O	788790499	SDFPBOBGWDLTHL-UHFFFAOYSA-N	447.459	1.634	50	20	IDGD	
Nc1nc(Cl)cc(NNC(=O)Nc2ccc(S(=O)(=O)C[C@@H]3CCCO3)cc2)n1	789097544	KKPBYAPEUKBSJD-NSHDSACASA-N	426.886	1.814	50	20	IDGD	
COc1c(C(=O)N(C)C)cc(Cl)cc1S(=O)(=O)NNC(=O)c1ccccc1F	790050769	YFOHPEJFADRXDQ-UHFFFAOYSA-N	429.857	1.813	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ncccc2C)cc(N2CCN(C(C)C)CC2)c1	792266643	TWWUEUIMDPHDKZ-UHFFFAOYSA-N	438.532	1.629	50	20	IDGD	
CCCCn1ncc(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)c1C(C)C	792267552	ILLIAONVWTXXKI-UHFFFAOYSA-N	426.477	1.843	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cccn2C)cc(N2CCN(C(C)C)CC2)c1	792269890	YKRLWZITACCKEK-UHFFFAOYSA-N	426.521	1.264	50	20	IDGD	
CC(C)Cc1ncc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)NC(C)(C)C)cn1	792350621	LDBYWMWPNNQQFT-UHFFFAOYSA-N	448.549	1.834	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)c(F)cc1C	793024905	ICSIZNRBQATAKU-UHFFFAOYSA-N	449.460	1.895	50	20	IDGD	
COCCOC1CCC(C(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)CC1	793520442	VDDZCHITHIHLSH-UHFFFAOYSA-N	442.557	1.938	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(C)nc3ccccc23)cc1OC	796992996	ZUDKZJACVBTJBM-UHFFFAOYSA-N	436.424	1.738	50	20	IDGD	
CC(C)(C)OC(=O)NNC(=O)C(=O)Nc1cnc(N2CCOCC2)c(Br)c1	799260224	QUXJVTBCSQTDKQ-UHFFFAOYSA-N	444.286	1.175	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)C2=NN(Cc3ccc(F)cc3)C(=O)CC2)cc1	801105506	GGOJORRZBCXPHL-UHFFFAOYSA-N	425.420	1.399	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)NCCNS(=O)(=O)c1ccc(F)cc1Cl	802432393	VWTMPKFUJZBMDR-UHFFFAOYSA-N	446.863	1.470	50	20	IDGD	
Cc1cc2ccc(C(=O)NNc3ncccc3S(=O)(=O)N3CCN(C)CC3)cn2c1	806871872	BPVRCZLQPADHGE-UHFFFAOYSA-N	428.518	1.336	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C#N)c(Br)c2)cc1OC	806973003	VVEGAIIUEFYAPX-UHFFFAOYSA-N	447.245	1.738	50	20	IDGD	
O=C(CNC(=O)NNC(=O)c1cc(Br)c[nH]1)Nc1ccc(F)c(F)c1F	807151387	ZXAWHVIRGXYLIA-UHFFFAOYSA-N	434.172	1.777	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)C(=O)Nc1ccc(-c2ncc3n2CCCC3)cc1	807429724	WVWFKXRLRDZENC-UHFFFAOYSA-N	443.471	1.944	50	20	IDGD	
CCn1cc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)cn1	807517432	GPWKWBHUSSZIPA-UHFFFAOYSA-N	434.522	1.222	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)NCc1ccncc1OC[C@H]1CCOC1	807616971	ZCBHUJNIVDRTLG-HNNXBMFYSA-N	430.461	1.415	50	20	IDGD	
COc1cc(F)c(F)cc1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	810271485	UQDFBVSZTGJTAT-UHFFFAOYSA-N	428.417	1.690	50	20	IDGD	
CC(C)n1ncc2cc(C(=O)OCC(=O)NNC(=O)[C@@H]3COc4ccccc4O3)cnc21	811624718	OLKQATDOOASBFW-KRWDZBQOSA-N	439.428	1.156	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2nnc(C(C)(C)C)s2)cc1	813033992	UMVPWNPGOAYGLL-UHFFFAOYSA-N	426.524	1.168	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)cc2cccnc12	815565957	FQRWTHRNUHRVDE-LBPRGKRZSA-N	426.404	1.936	50	20	IDGD	
O=C(Cc1cccc2ccccc12)NNC(=O)C(=O)Nc1cn(Cc2ccccc2)nn1	815567792	MEUUTKWZJSUHDU-UHFFFAOYSA-N	428.452	1.808	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3ccnc(-c4ncc[nH]4)c3)n[nH]2)cc1OC	815886646	DDQQZZVTFSMCLK-UHFFFAOYSA-N	433.428	1.954	50	20	IDGD	
O=C(CNc1ccccc1)NNC(=O)c1ccc(S(=O)(=O)NC[C@@H]2CCCO2)cc1	823328327	GYCLCFYJFQWJIU-KRWDZBQOSA-N	432.502	1.017	50	20	IDGD	
Cn1c(=O)n(CCC(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)c2ccccc21	828775453	ZWCCJXZOUPDKTR-UHFFFAOYSA-N	430.848	1.388	50	20	IDGD	
COCCOC(=O)c1c(C)[nH]c(C(=O)NNC(=O)Cc2nc3ccccc3n2C)c1C	915638312	GVFBCQRQRWTVQQ-UHFFFAOYSA-N	427.461	1.325	50	20	IDGD	
COC(=O)c1ccc(C=NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)o1	915937788	UTVLHMVLOCIZLM-UHFFFAOYSA-N	449.485	1.170	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)NC1CCN(C(=O)c2ccoc2)CC1	916261577	ONCUAMLNJKCNLT-UHFFFAOYSA-N	430.461	1.692	50	20	IDGD	
CCN(CC)Cc1cccc(CNC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c1	916400893	OKUHFGHQXVBJMO-UHFFFAOYSA-N	436.516	1.920	50	20	IDGD	
O=C(NCCCS(=O)(=O)Cc1ccccc1)NNC(=O)[C@@H]1COc2ccccc2O1	916576961	HFFBHGXSOYQDGU-SFHVURJKSA-N	433.486	1.162	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)C[C@@H]2Oc3ccccc3NC2=O)c2ccccc2c1=O	916854750	NWAXFSGXUOZOTN-KRWDZBQOSA-N	435.440	1.357	50	20	IDGD	
CCCC(=O)N1CCC[C@H](C(=O)NNC(=O)c2nn(CCC)c(=O)c3ccccc23)C1	917518724	CLPYHFRLLFNGIY-HNNXBMFYSA-N	427.505	1.606	50	20	IDGD	
O=C(O)c1cc2c(c(S(=O)(=O)NNC(=O)c3ccc4c(c3)OCCO4)c1)CCCC2	917732445	VVKQBCBFZBZVED-UHFFFAOYSA-N	432.454	1.658	50	20	IDGD	
Cc1nc(CSc2ccc(C(=O)NNC(=O)N[C@H]3CCS(=O)(=O)C3)cc2)cs1	919888219	AXDUWYBBJMSRPN-ZDUSSCGKSA-N	440.572	1.875	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)c2cccc(CS(C)(=O)=O)c2)CC1	1116087063	HFNYVFSDGCSFNB-UHFFFAOYSA-N	439.534	1.639	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CC(=O)N(c2c(F)cccc2F)C1)c1cncn1-c1ccccc1	1116451100	ODUXRSOJHUHMQQ-CYBMUJFWSA-N	425.395	1.965	50	20	IDGD	
Cn1c(=O)oc2cc(NC(=O)NNC(=O)C3CCN(C(=O)OC(C)(C)C)CC3)ccc21	1254721482	SQGDUENTIDZQQV-UHFFFAOYSA-N	433.465	1.931	50	20	IDGD	
CC(C)(C)OC(=O)N1CCCCC[C@@H]1C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	1255279704	AFYGHBNRRXEEQA-MRXNPFEDSA-N	429.481	1.603	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NC2CCN(C[C@H]3CCCO3)CC2)cc1	1318892364	CEAZBTUNMDNFKN-MRXNPFEDSA-N	439.538	1.069	50	20	IDGD	
O=C(NNC(=O)c1cccc(Br)c1)N[C@H]1CCO[C@]2(CCS(=O)(=O)C2)C1	1319833406	WFUUHPFYFFUKDZ-XJKSGUPXSA-N	446.323	1.129	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2)C1=NO[C@H](c2ccccc2)C1	1778788037	VKVWNVHKIPGLQU-PSHVLCQKSA-N	449.935	1.618	50	20	IDGD	
COc1ccnc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)c1OC	1780451550	SNSZMSNZJDZSMA-SGTLLEGYSA-N	442.310	1.326	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781325265	LPYIZTVDTHUEHZ-GBIKHYSHSA-N	430.112	1.538	50	20	IDGD	
O=C(c1cccc2c[nH]nc12)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781330611	CSGCATYWWOFIJT-RHSMWYFYSA-N	425.258	1.697	50	20	IDGD	
O=C(c1nccc2nc[nH]c12)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781331485	QWCHQCOIAYRHNJ-CZUORRHYSA-N	426.246	1.092	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2	1781897702	OGYQALVXBCIGMI-VPWBDBDCSA-N	425.751	1.274	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccn(C)n1)C2	1781900442	QDYXPVPGUUYXQQ-DDUZABMNSA-N	427.343	1.721	50	20	IDGD	
COc1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](C)Br)C3)C2)ccc1O	1783538949	ZDAMVGFJEYDOBB-KZULUSFZSA-N	427.295	1.628	50	20	IDGD	
O=C([C@H](F)Br)N1CCO[C@]2(CCN(C(=O)[C@H]3CCc4ccccc4O3)C2)C1	1783845550	MIQSUXGXJGRERP-GJYPPUQNSA-N	441.297	1.901	50	20	IDGD	
O=C1CSc2ncc(C(=O)N3CCO[C@@]4(CCN(C(=O)C(Cl)Cl)C4)C3)cc2N1	1783949875	NJOSWXLAUONCAT-QGZVFWFLSA-N	445.328	1.373	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)c3ccccc3)C[C@@H]21	1783968122	QSYGRFVQEDKZGB-NBZXXOOGSA-N	439.350	1.731	50	20	IDGD	
Cc1noc(C)c1CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]2C1	1783970233	UDGVFGNCYBQXCV-GQGQLFGLSA-N	442.354	1.845	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccnc(C(F)(F)F)c3)C[C@@H]21)[C@H](O)CCl	1784087000	SXOCAISSFCWWFY-FQUUOJAGSA-N	435.830	1.293	50	20	IDGD	
Cc1nc2cccc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]4C3)c2s1	1784090721	LONMGVXDWFXXBV-SDNTUTLCSA-N	437.949	1.798	50	20	IDGD	
COc1cnc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCBr)C[C@@H]32)c(F)c1	1785736937	ZPCGDLAMNAWJOK-WHOFXGATSA-N	444.301	1.608	50	20	IDGD	
Cc1cc(O)c([N+](=O)[O-])cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]2C1	1787449853	NBWJSLQSEBSFOV-LVLWZLKYSA-N	429.832	1.737	50	20	IDGD	
CC(C)(C)[C@@H](O)C(=O)NC1(c2ccc(NC(=O)c3cnccc3C(=O)NN)cc2)CCC1	1789519943	SHJNLRGVUDUNPJ-SFHVURJKSA-N	439.516	1.840	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC1(c2ccc(NC(=O)c3ccncc3O)cc2)CCC1	1789703286	RRNYEQWQDRTCNK-UHFFFAOYSA-N	425.489	1.908	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)COc3cccnc3)C[C@@H]21)[C@H](F)Br	1789922495	NRTYSCZAYMLUQP-PCBIJLKTSA-N	430.274	1.131	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4nonc4c3)C[C@@H]21)[C@H](F)Br	1789922749	MCBUWMJUBWPBHQ-GVARAGBVSA-N	441.257	1.507	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)[C@@H](F)Br	1789923247	AMVVTIALMANOHC-RXKWGBCNSA-N	434.075	1.347	50	20	IDGD	
CCOC(CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)Br)C[C@@H]21)OCC	1791424466	QXRDYFRVIKGPLG-AJNGGQMLSA-N	435.359	1.539	50	20	IDGD	
COc1ccc(Cl)c(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](O)CCl)c1F	1792982571	IXDXSSQTPQYPND-MSNRECKUSA-N	449.306	1.220	50	20	IDGD	
COC[C@H](C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2	1793440801	CRDYPWHIBPZHSG-FIIQBIKZSA-N	449.460	1.006	50	20	IDGD	
Cn1cncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1794141283	QRQIRHJAVFDYDX-XGUBFFRZSA-N	439.944	1.804	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCS(=O)(=O)c1ccccc1	1795301157	WLAGFBVAQRTQLU-LORHWOILSA-N	442.965	1.457	50	20	IDGD	
COc1cc(OC)c(F)c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Cl)C3)c1F	1795490353	NLWPVCKZFYBEQP-HAHWHCPGSA-N	436.814	1.720	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2)c1cnc2c(Cl)cccn12	1796066503	KHQSZLQBOCXXDV-DDFAGTSDSA-N	431.707	1.995	50	20	IDGD	
O=C(Cn1ccc2c(F)cccc21)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1	1796187788	FCTIZYIRCCDKNP-REPLKXPHSA-N	449.291	1.412	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C=C/C(=O)c1cccs1	1796448476	VEWXPIQUSQFIOI-KUGIXWJLSA-N	426.922	1.330	50	20	IDGD	
CCCc1onc(C)c1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)Br)C2	1796615090	FKOGQDOPYVQALA-VFFTVRQLSA-N	428.327	1.922	50	20	IDGD	
CC(C)(C)OC(=O)N[C@]1(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](F)Cl)CCOC1	1796812187	YKICAYNXPPKZOP-QEAYJNAZSA-N	433.908	1.843	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnc2ccccn12	1796953862	MXHRSVCDQOOLJB-AODNKKSCSA-N	425.316	1.774	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2n(n1)CCCO2	1797436802	FVAXZRPAPADZNQ-TYYYEBLRSA-N	431.320	1.105	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cn2ccsc2n1	1797485797	DBVJLQGZHGASRP-QTFJUKGGSA-N	431.345	1.835	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CC=CCC1	1799227470	OZSGVQGXYWCUIB-FSWGRJFZSA-N	427.505	1.066	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccn3nccc3c1)C2	1799275772	BACCJPDNEJIISM-QHHYFVSCSA-N	425.316	1.774	50	20	IDGD	
CN(C)c1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@](C)(Cl)CCl)nc1	1799277443	RTXVTPNJIFTJIR-AODNKKSCSA-N	429.348	1.587	50	20	IDGD	
Cc1cc(C)n(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@](C)(Cl)CCl)n1	1799278714	WPIFASVSGDQKGE-HIRMHNASSA-N	431.364	1.716	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CCc3ccoc3C1)C2)[C@H](F)Br	1799343145	OOCPYHKMACZWKG-IGNRKKQASA-N	429.286	1.665	50	20	IDGD	
COc1ccc(C)c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Br)c1	1799348665	LRUICOWEGMFVCM-VZAMPYOESA-N	429.286	1.897	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1n[nH]c2c(Cl)cccc12	1799902465	NOZCQPKKTLJNRY-JLUCKKNBSA-N	441.315	1.673	50	20	IDGD	
COC(=O)CCCCCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CO[Si](C)(C)C)C2	1801073868	YBFZZPCFTUZJSI-CWPLJXCYSA-N	428.602	1.551	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cc3ncsc3[nH]2)[C@H]1c1cccnc1)[C@@H](O)CCl	1803142533	DZLIMJAXQSWTCA-RCBQFDQVSA-N	433.921	1.939	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)Cn2cnc3ccccc32)[C@H]1c1cccnc1)[C@H](O)CCl	1803146772	PZYHQAJJHOHIPG-SCWSEQNSSA-N	441.919	1.737	50	20	IDGD	
CCS(=O)(=O)CC(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)Br)[C@H]1c1cccnc1	1803518085	PKOLPVUFUXMYER-INWMFGNUSA-N	446.367	1.306	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](F)Cl)C2)C(C)(C)O	1804433077	BKOGLTDMIQDMPS-ITGHMWBKSA-N	435.924	1.823	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CC(F)(F)F)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807365594	VWALQLLFNUBTMR-MAUKXSAKSA-N	435.211	1.033	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)cn1C	1807374835	JPGZNYQWMDUTSG-DENIHFKCSA-N	446.316	1.042	50	20	IDGD	
COc1ncc(C(=O)N2CCCC3(CCN(C(=O)CCC(=O)NN(C)C)CC3)C2)cc1F	1807568335	BCOQHYPXPZXHRZ-UHFFFAOYSA-N	449.527	1.447	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H](CNC(=O)Cn2cncn2)[C@H]1c1cccnc1	1807603956	ZKUQHTFUAPKXGZ-KYJSFNMBSA-N	425.320	1.615	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)c1cc(C(F)F)no1	1807721222	YVKRSJSPLRJFRA-LNSITVRQSA-N	428.823	1.927	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2[nH]nc3ccncc23)[C@@H]1c1cccnc1	1808101545	NMXNXVFGCWVKEE-ALKREAHSSA-N	442.907	1.926	50	20	IDGD	
Cc1nnc(CC(=O)N2CC[C@H](CNC(=O)[C@H](F)Br)[C@H]2c2cccnc2)o1	1808661279	HQTGYIXDXHZRTQ-WQVCFCJDSA-N	440.273	1.712	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)N1CC[C@H](CNC(=O)[C@H](F)Br)[C@@H]1c1cccnc1	1808662501	MDOCTAWSISMERI-FWYOQMDTSA-N	443.317	1.645	50	20	IDGD	
Cc1nc(C(=O)N2CCC3(CCCN(C(=O)c4ccc(B(O)O)cc4)C3)CC2)ccc1F	1809969401	UVVABLYIWWQMRJ-UHFFFAOYSA-N	439.296	1.368	50	20	IDGD	
O=C(CCc1cccs1)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1	1809975086	SFYNCSBUGSFXEQ-UHFFFAOYSA-N	440.374	1.906	50	20	IDGD	
Cc1ccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)[nH]n2)nc1	1816542106	MFIFOCHZJMTJFB-SFHVURJKSA-N	448.487	1.731	50	20	IDGD	
O=C1CCc2ccc(C(=O)Nc3nc4c(s3)C[C@H](NC(=O)[C@H](O)CCl)CC4)nc2N1	1816659485	OAGBSRWUGRLWRF-ZWNOBZJWSA-N	449.920	1.248	50	20	IDGD	
Cc1ncccc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1	1817473168	JLVRBPMBITZAFA-IBGZPJMESA-N	433.277	1.413	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)C23CC(F)(C2)C3)[nH]n1	1819401748	QPMFTOZZNSUUMT-VUZGARFFSA-N	441.467	1.606	50	20	IDGD	
CC(C)O[C@H](C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1819507234	MDUGRKRQXLGUFG-CXAGYDPISA-N	443.508	1.528	50	20	IDGD	
Cc1nn(C)c(C)c1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1	1822411029	XDJFOGCOXPZPSZ-MRXNPFEDSA-N	444.540	1.439	50	20	IDGD	
CC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](C)[C@H]1SC(=N)NC1=O)CC2	1822846002	VQMXDOFAZDATRD-KIKITERTSA-N	443.982	1.875	50	20	IDGD	
Cn1cc2cc(C(=O)Nc3nc4c(s3)C[C@H](NC(=O)[C@@H](O)CCl)CC4)ccc2n1	1823949497	PUJZCIOTHISCTD-DOMZBBRYSA-N	433.921	1.855	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](O)CCl)CC2)c1cnc2ccc(F)cn12	1824268955	RGUHOOWQTVSGCT-GWCFXTLKSA-N	437.884	1.755	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)n(C)n1	1825926553	CGXVELOIGCPEFS-GOSISDBHSA-N	432.569	1.335	50	20	IDGD	
CCn1ccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)n1	1826091521	GFCSGAOOCIUNLG-OAQYLSRUSA-N	438.337	1.130	50	20	IDGD	
O=C(Cn1ccncc1=O)N1CCC([C@@H]2CCCCN2C(=O)CCBr)CC1	1826359632	LYOUNGOOOYDXPS-INIZCTEOSA-N	439.354	1.648	50	20	IDGD	
O=C(CN1CCCCC1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827051492	ZFKLUZANCDLOEC-QFIPXVFZSA-N	441.381	1.086	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)c[nH]1	1827893092	KZWIZHIIAPVYON-FQEVSTJZSA-N	438.532	1.869	50	20	IDGD	
CCc1cc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)no1	1829378402	MJTMSFLDESDMLZ-NRFANRHFSA-N	439.321	1.464	50	20	IDGD	
O=C(c1cccc(-c2cnco2)c1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1830733747	SIXPDOXOHPVZPR-LAUBAEHRSA-N	449.891	1.011	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)C2=COCCC2)CC1	1831917941	NOWKBIDCGNIQTJ-FQEVSTJZSA-N	441.532	1.613	50	20	IDGD	
Cc1cnn([C@H](C)C(=O)N2CCCC[C@@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)c1	1832186568	CENGYLNVEGCAQB-UYAOXDASSA-N	446.596	1.745	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)CCN3CCOCC3)CC2)CC1	1833532117	CTXQOSSRFSBLLB-FQEVSTJZSA-N	443.032	1.688	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnc(OCF)cn3)CCO2)C1	1833566707	SCENVLOIUVVOAH-IBGZPJMESA-N	444.891	1.117	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnccc3N(C)C)CCO2)C1	1833660412	ZDNBZXCFFVZFRK-UTKZUKDTSA-N	438.956	1.625	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccccc3O)CCO2)C1	1833751884	HTFUXLSNJNJSNR-KUHUBIRLSA-N	441.322	1.493	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC(OC2CCN(C(=O)[C@H]3C[C@@H]3C3CC3)CC2)CC1	1836657047	KYCVXNFJFGVOKR-YADHBBJMSA-N	440.349	1.025	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc(Cl)s3)C2)C1	1837715265	GBGXZHIHFKLCIN-KRWDZBQOSA-N	448.017	1.718	50	20	IDGD	
CCc1cnc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)s1	1837724445	OTVJFVQDVHOTLH-PXAZEXFGSA-N	446.367	1.559	50	20	IDGD	
C[C@H](Nc1ccccn1)C(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1837738175	OYICQEYSSVKZCW-HRAATJIYSA-N	438.956	1.603	50	20	IDGD	
O=C(c1ccc(Cl)nc1Cl)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1837825643	SZJHVCFSWIOXAE-MLGOLLRUSA-N	440.686	1.993	50	20	IDGD	
O=C(c1c[nH]c(=O)cn1)N1CCC(OC2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1838538792	JTFWBSDWVHEZTF-OAHLLOKOSA-N	445.289	1.073	50	20	IDGD	
C[C@@H](C(=O)N1CCC(OC2CCN(C(=O)[C@@H](F)Br)CC2)CC1)n1ccnn1	1838648151	JYFPQWQWVGXYJO-SWLSCSKDSA-N	446.321	1.528	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)c(O)n1	1838671217	DDVJKUNXVBFQTE-FQEVSTJZSA-N	437.569	1.017	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C(C)(C)C)n[nH]3)C2)C1	1839145436	HPMKWSSRTMYMEN-VLIAUNLRSA-N	426.945	1.795	50	20	IDGD	
O=C(/C=C/C1CCCC1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1839180707	ZBDHFXCFPMDBLV-MMUANNJHSA-N	433.318	1.880	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccsc3)C2)C1	1839964019	CRULYWXZMATNND-QAPCUYQASA-N	445.379	1.921	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3CC3(F)F)C2)C1	1839965476	ZKWKWNZMJQAOMP-XUJVJEKNSA-N	425.270	1.272	50	20	IDGD	
O=C(c1ccc(Cl)nc1F)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840186127	BPTZACVDDPICJB-INIZCTEOSA-N	440.686	1.748	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccc(O)cn3)CCO2)C1	1840494861	XAYCXULENRBPMM-FXAWDEMLSA-N	425.913	1.194	50	20	IDGD	
O=C(c1ccoc1I)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1	1841350776	XBAMVXQMNZAXHA-SNVBAGLBSA-N	438.649	1.301	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@H](CCO)NC(=O)OC(C)(C)C)C2	1841665908	AISOLFGQKZNWTP-GJZGRUSLSA-N	431.961	1.873	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@H](O)CCNC(=O)OC(C)(C)C)C2	1841669276	KYWAAEUQIXNCBQ-CABCVRRESA-N	431.961	1.873	50	20	IDGD	
Cc1nocc1C(=O)N1CCCC12CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1842493145	UVKPKNQUROCYBQ-AWEZNQCLSA-N	426.901	1.932	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)Cc2nnc(C)o2)C1	1843044966	NCJRBUKKQWRPEZ-UHFFFAOYSA-N	443.416	1.271	50	20	IDGD	
Cc1nn[nH]c1C(=O)N1CCCC12CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1843159620	DBYRRFVTVRQZPO-LBPRGKRZSA-N	426.905	1.062	50	20	IDGD	
CN(CC(=O)N1CC2(CCCN2C(=O)[C@@H](F)Cl)C1)NC(=O)NCc1ccccc1	1843365445	QWICYLOXBWZGCU-MRXNPFEDSA-N	425.892	1.070	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)[C@H]2Cc3ccccc3O2)C1	1843908301	YNQCOOPLSBLQIS-KWXFCVSUSA-N	435.484	1.328	50	20	IDGD	
C[C@H](Br)C(=O)N1CC2(CCCN2C(=O)[C@@H](O)CCNC(=O)OC(C)(C)C)C1	1845224070	WQKGQAKPEPEORC-STQMWFEESA-N	448.358	1.249	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC2(CCCN2C(=O)CCn2ccnn2)C1	1846622164	RGQDHWCKCYLAHT-AWEZNQCLSA-N	440.932	1.004	50	20	IDGD	
COc1cc(CCNC(=O)NNC(=O)COc2ccccc2C#N)c([N+](=O)[O-])cc1OC	9754975	DXJCVOQEWOIUCJ-UHFFFAOYSA-N	443.416	1.436	50	20	IDGD	
COCCCn1c(=S)[nH]c2cc(C(=O)NNC(=O)c3ccccc3O)ccc2c1=O	17575965	JOAANXROCVJGFB-UHFFFAOYSA-N	428.470	1.876	50	20	IDGD	
Cc1ccc(CC(=O)N2CCN(CC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)CC2)cc1	110300827	ATJLEEFUPUZRFR-UHFFFAOYSA-N	439.472	1.051	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1)N1CCN(C)CC1	725895203	VPPWTYGXHUAANG-CVDCTZTESA-N	435.572	1.397	50	20	IDGD	
COCCCNC(=S)N(C)NC(=O)CNS(=O)(=O)c1c(C)c(C)cc(C)c1C	726075929	QIWBLDCTIAPXAL-UHFFFAOYSA-N	430.596	1.073	50	20	IDGD	
CC(C)NC(=O)C(=O)NNC(=O)c1cccc(S(=O)(=O)N[C@H](C)c2ccccc2)c1	726614936	XUDCSTOJNWQCKR-CQSZACIVSA-N	432.502	1.012	50	20	IDGD	
O=C(NNC(=O)c1ccc[nH]1)c1cccc(S(=O)(=O)Nc2ccc3c(c2)OCO3)c1	726630150	IPJIEBRHMDJQAU-UHFFFAOYSA-N	428.426	1.619	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)N[C@@H](C)c1cccc(S(=O)(=O)N(C)C)c1	727610692	SVXFMDKEXXBMSB-AWEZNQCLSA-N	434.518	1.580	50	20	IDGD	
O=C(NN=Cc1nccn1CC(F)(F)F)c1cccc(S(=O)(=O)N2CCOCC2)c1	727687212	KUVHDCFUOSRBHK-UHFFFAOYSA-N	445.423	1.230	50	20	IDGD	
O=C(O)CNC(=O)c1ccc(S(=O)(=O)NNC(=O)c2c(Cl)cccc2Cl)cc1	727796094	GGAURBGNPUOCBJ-UHFFFAOYSA-N	446.268	1.431	50	20	IDGD	
CN1CCN(C[C@H](NC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c2ccccc2)CC1	727944506	DNSARYRHUOTZCO-IBGZPJMESA-N	426.477	1.528	50	20	IDGD	
CN(C)N(C(=O)[C@@H]1CS[C@]2(c3ccc(F)cc3)CCC(=O)N12)[C@@H]1CCS(=O)(=O)C1	728179662	NPSRBDHVQQXGRY-GJYPPUQNSA-N	441.550	1.209	50	20	IDGD	
Cn1cc(S(N)(=O)=O)cc1C(=O)NNc1ccc(S(=O)(=O)Nc2ccccc2)cc1	728217859	TVDXXDRVFGOOJI-UHFFFAOYSA-N	449.514	1.230	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1csc(N2CCOCC2)n1)c1ccc2c(c1)CC(=O)N2C	728301406	CMCIHFLGHLIAGU-GFCCVEGCSA-N	444.517	1.204	50	20	IDGD	
CCOC(=O)C1=NN(c2ccccc2)[C@@H](C(=O)OCC(=O)NNC(=O)c2cccs2)C1	728635241	RDRNJHICMICAKS-OAHLLOKOSA-N	444.469	1.250	50	20	IDGD	
O=C(NNC(=O)N1CCN(C(=O)CN2CCCC2)CC1)c1c(Cl)cccc1Cl	728715187	OGXWRDRMKRZFOA-UHFFFAOYSA-N	428.320	1.588	50	20	IDGD	
O=C(NCCCN1CCc2ccccc2C1)NNC(=O)C1CCN(c2ncccn2)CC1	728945035	GFLACTRGCJDODY-UHFFFAOYSA-N	437.548	1.472	50	20	IDGD	
CNC(=O)NNC(=O)CCN(c1ccc(OC)cc1)S(=O)(=O)c1cccc(Cl)c1	729339793	AMSRZFDHYMQTRV-UHFFFAOYSA-N	440.909	1.894	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)N1CCN(CC(=O)Nc2ccccc2)CC1	729510802	NIPVLJBWIQAJFK-UHFFFAOYSA-N	434.500	1.638	50	20	IDGD	
O=C(NCc1ccc(Br)cc1)NNC(=O)C1CCN(c2ncccn2)CC1	730132037	RAILOHMOIARLDA-UHFFFAOYSA-N	433.310	1.986	50	20	IDGD	
NC(=O)c1ccc(/C=C\C(=O)N2CCC[C@H]2C(=O)NN=c2cc[nH]c3ccccc23)cc1	730288697	WXKSDXIVUBYXJT-ZAGZISDZSA-N	429.480	1.903	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)[C@@H](Cc1ccccc1)NC(=O)c1cccnc1	730781593	UCPBKMFGQAFTGS-GOSISDBHSA-N	434.452	1.355	50	20	IDGD	
O=C(NCCCN(C(=O)C1CCC1)C1CC1)NNC(=O)c1nn(-c2ccccc2)cc1O	731364050	JPSNQOULFNUCGE-UHFFFAOYSA-N	440.504	1.703	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)[C@@H]2CC(=O)N(c3cccc4ccccc34)C2)C[C@@H](C)O1	732259431	DLQROHBCTHQMMX-ZHALLVOQSA-N	438.528	1.839	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)CN3C(=O)C(=O)N(C)C3=O)c3ccccc3n2)cc1	733087067	SQPKXIXMDNNHIG-UHFFFAOYSA-N	445.435	1.392	50	20	IDGD	
CS(=O)(=O)c1ccc(OCCNC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1	733648845	RIACEYXHLDPJTB-UHFFFAOYSA-N	443.485	1.299	50	20	IDGD	
Cc1cc(F)ccc1-c1ccc(C=NNC(=O)CSc2nn(C)c(=O)n(C)c2=O)o1	734298745	JZPCVNNBQAVMLB-UHFFFAOYSA-N	431.449	1.429	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)c2ccc(-n3cccn3)nc2)CC1	734825834	ORCUSDJLXMJQBH-UHFFFAOYSA-N	429.481	1.611	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)CSc1nnc(C)n1-c1cc(C)ccc1C	740853312	NTTSXJUWQDJRIP-UHFFFAOYSA-N	432.550	1.737	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N[C@H]2CCC[C@@H](S(C)(=O)=O)C2)cc1Br	740915708	QLHXOFNNKLEWGT-NWDGAFQWSA-N	448.339	1.758	50	20	IDGD	
O=C(CCS(=O)(=O)c1ccc2c(c1)OCCCO2)NNc1nc(-c2cccnc2)no1	741214659	PONZJHYDDOAPPQ-UHFFFAOYSA-N	445.457	1.600	50	20	IDGD	
Cc1c(S(=O)(=O)NNC(=O)[C@H]2COc3ccccc3O2)cnn1-c1ccc(Cl)cc1	742025408	MMWHYAKBOVSZGU-QGZVFWFLSA-N	448.888	1.984	50	20	IDGD	
CCCCc1ccc(NC(=S)NNC(=O)CCN2C(=O)[C@@H]3[C@H]4CC[C@@H](O4)[C@@H]3C2=O)cc1	743821896	XNEWOWLXPUOLGO-RWQQGDIJSA-N	444.557	1.899	50	20	IDGD	
Cc1ccc(-n2cc(C(=O)NNc3ccccc3S(=O)(=O)N3CCOCC3)nn2)cc1	744620233	GWEOGWKXRRFEAT-UHFFFAOYSA-N	442.501	1.354	50	20	IDGD	
CC(C)(C)CC(=O)N1CSC[C@H]1C(=O)OCC(=O)NNC(=O)c1cccc(C#N)c1	744974540	RXVVZQTVUWLBBP-HNNXBMFYSA-N	432.502	1.200	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NN=C1CCO[C@@H]1C)N(S(C)(=O)=O)CC2	747743036	ZKNFNGZTMBJTAV-MLGOLLRUSA-N	425.507	1.234	50	20	IDGD	
COc1ccc(Cn2ncc3cc(C(=O)NNc4nccn(C)c4=O)cnc32)c(OC)c1	747941550	HCFOBWPIINLUCL-UHFFFAOYSA-N	435.444	1.347	50	20	IDGD	
CC(C)NC(=O)N1CCC[C@H]1C(=O)NNc1ccccc1S(=O)(=O)NC(C)(C)C	748603166	SWGXVIYXMSFYKB-HNNXBMFYSA-N	425.555	1.789	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N(C)C[C@H]2CCOC2)cc1	749433602	WDCLNFMCHGHNRN-CJMVGXJBSA-N	437.500	1.836	50	20	IDGD	
COc1cc(C(=O)NNc2nc(Br)cn3ccnc23)ccc1OCC(N)=O	750247939	HWWXDYNSFYSAHG-UHFFFAOYSA-N	435.238	1.121	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)N[C@@H]1CCN(CCCc2ccccc2)C1=O	750292989	VRARDZZSPZCJOG-XLIONFOSSA-N	438.484	1.391	50	20	IDGD	
Cc1nnc2n1C[C@H](C(=O)NNC(=O)c1nc(-c3ccccc3)n(-c3ccccc3)n1)CC2	750715610	STHKCBBYJSVUNH-QGZVFWFLSA-N	442.483	1.858	50	20	IDGD	
Cc1nc2c(C#N)cnn2c(C)c1CCC(=O)NNC(=S)NCCc1cccs1	753078480	PBNQWZIHBPZONO-UHFFFAOYSA-N	427.559	1.950	50	20	IDGD	
O=C(NNC(=S)NCCc1cccs1)[C@H]1CCCN1S(=O)(=O)c1cccs1	753079917	WKMQXJRZKIDONR-CYBMUJFWSA-N	444.629	1.701	50	20	IDGD	
COCCN(C)S(=O)(=O)[C@H]1CCCN(C(=O)NNC(=O)C(C)(C)c2ccccc2)C1	755249800	NHZPPRMYOWZISB-KRWDZBQOSA-N	440.566	1.077	50	20	IDGD	
CN(c1cccc(Cl)c1)S(=O)(=O)c1cccc(C(=O)NNC(=O)Cc2cc[nH]n2)c1	755283602	ZMTKUEPEACALKZ-UHFFFAOYSA-N	447.904	1.892	50	20	IDGD	
COC(=O)CNC(=O)c1ccc(NC(=O)NNC(=O)COc2ccc(C)c(C)c2)cc1	755549464	SRQZDNOAWBZTFN-UHFFFAOYSA-N	428.445	1.438	50	20	IDGD	
Cn1c(=O)c2cc(NC(=O)NNC(=O)CSc3ccc(Cl)cc3)cnc2n(C)c1=O	755845774	GRWWYOHTPPEQLP-UHFFFAOYSA-N	448.892	1.231	50	20	IDGD	
COC(=O)CNC(=O)Cc1ccc(NC(=O)NNC(=O)CSc2ccc(C)cc2)cc1	755861875	JALOAUDLRUEPSD-UHFFFAOYSA-N	444.513	1.772	50	20	IDGD	
CN1CCC/C1=N/S(=O)(=O)c1ccc(NC(=O)NNC(=O)c2ccccc2O)cc1	756073163	NDHWFUCJSHCJLZ-QJOMJCCJSA-N	431.474	1.672	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)Nc1ccccc1CN1CCOCC1	756115815	SEHYSNODFLSFQH-UHFFFAOYSA-N	429.433	1.659	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)Nc1cccc(C[S@](=O)c2ccccc2)c1	756590735	PMAFQHNVPAMNDB-JMGYQRAPSA-N	435.527	1.582	50	20	IDGD	
CC(C)(C)OC(=O)Nc1ccc(F)c(NC(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)c1	756620419	KBTOKFPEUOBTQQ-SNVBAGLBSA-N	430.458	1.760	50	20	IDGD	
CNS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2cc(-c3ccccc3OC)[nH]n2)cc1	756650064	UCDZOTNVDAPWFR-UHFFFAOYSA-N	444.473	1.460	50	20	IDGD	
CCCCN1C(=O)CC[C@@H](C(=O)NNc2ccc(C(N)=O)nn2)[C@@H]1c1ccc(OC)cc1	757408052	PAFVFFRCOKJWGE-UZLBHIALSA-N	440.504	1.807	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)c1cn(C(C)(C)C)nc1-c1ccc(F)cc1F	758048495	TUXZVWSCCJIDQL-SNVBAGLBSA-N	443.476	1.282	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)NCc1ccc(S(C)(=O)=O)c(Cl)c1	758852018	DSMVLNWZHKTGLS-UHFFFAOYSA-N	435.893	1.844	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)c2cnn(CCO[C@H]3CCCCO3)c2C)c1	760123535	OOABYPHRPNGXSP-FQEVSTJZSA-N	431.493	1.616	50	20	IDGD	
O=C(NNC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1)C(=O)Nc1cnns1	760280162	RKEHRESXZWZEFG-UHFFFAOYSA-N	434.441	1.186	50	20	IDGD	
COc1cc(Br)cc(S(=O)(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1	760509229	GTKONKMCYHNOBQ-HNNXBMFYSA-N	443.275	1.607	50	20	IDGD	
Cn1c(SCC(=O)NNC(=O)c2ccc(F)cc2)nc2cc([N+](=O)[O-])ccc2c1=O	762483620	LSSJGHWMIZXRHD-UHFFFAOYSA-N	431.405	1.534	50	20	IDGD	
CC(C)(C)OC(=O)NCCOc1cccc(NC(=O)C(=O)NNC(=O)c2ccccn2)c1	763468363	XQHLITWQGRRPSY-UHFFFAOYSA-N	443.460	1.385	50	20	IDGD	
CCN(CC)CCOc1ccccc1NC(=O)C(=O)NNC(=O)c1ccc2c(c1)OCO2	763550948	JOOROUZCRAHMFT-UHFFFAOYSA-N	442.472	1.536	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(N3CCCC3=O)cc2)cc1OC	763551447	XEPKWZLFVCNRKG-UHFFFAOYSA-N	426.429	1.230	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)ccc1N1CCOCC1	763613288	LVYAQTXNLLDNLJ-UHFFFAOYSA-N	448.483	1.621	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2cc(F)ccc2OC[C@H]2CCCO2)c1	763630946	SHIQVMRPILHZLK-QGZVFWFLSA-N	445.447	1.857	50	20	IDGD	
COC(=O)C(C)(C)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C)c(C)c2)cc1	763667036	OIDYVUBSRFACQS-UHFFFAOYSA-N	441.484	1.919	50	20	IDGD	
CCN(Cc1ccccc1NC(=O)C(=O)NNC(=O)COc1ccc(C#N)cc1)C(C)=O	763680649	GEOKMIAVXKKTSC-UHFFFAOYSA-N	437.456	1.092	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)C(=O)Nc1ccc(F)c(F)c1	763694916	NEHRXKDMUYQRFR-UHFFFAOYSA-N	428.189	1.892	50	20	IDGD	
O=C(NNC(=O)c1cccc(Cl)c1)C(=O)Nc1ccc2nc(N3CCOCC3)oc2c1	763750664	QVFGYKMWIFGNRE-UHFFFAOYSA-N	443.847	1.718	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cnn(C[C@@H]3CCCO3)c2)cc1	763861392	PAMONMSAZOEXJI-KSSFIOAISA-N	445.476	1.014	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccn(-c3ccncc3)n2)cc1	763866320	OQXOCHBBDQOTFG-CQSZACIVSA-N	438.444	1.219	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(N(C)C(C)=O)cc2)cc1	763873190	SCUZEAXGGQBUPV-AWEZNQCLSA-N	440.456	1.425	50	20	IDGD	
COCC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)CCSc2ccc(F)cc2)cc1	763894972	JFPIKUGBPGIVGF-UHFFFAOYSA-N	448.476	1.679	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)C(=O)Nc1cncnc1N(C)C	763901958	OQVCKMRPDHNQHE-UHFFFAOYSA-N	425.474	1.374	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(N)=O)cc2F)cc1OC	763912506	PDXMXJJFNWAVJE-UHFFFAOYSA-N	446.435	1.512	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)C(=O)Nc1ccc2c(c1)OCCCO2	763945333	WRNZMWYLROVRLU-UHFFFAOYSA-N	437.412	1.139	50	20	IDGD	
O=C(Cc1ccsc1)NNC(=O)C(=O)Nc1ccn(-c2ncccc2C(F)(F)F)n1	764034700	JLYKOXDNJKTSLU-UHFFFAOYSA-N	438.391	1.676	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1cc(N2CCCC2=O)ccc1Cl	764043407	UJNARMIHWVIGNO-UHFFFAOYSA-N	430.848	1.875	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCCCC2)cc1NC(=O)C(=O)NNC(=O)C1CCCC1	764065764	AAHUNNCAHWUJOD-UHFFFAOYSA-N	436.534	1.446	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)nc1)C(=O)Nc1cccc(NC(=O)c2ccoc2)c1	764093778	XQNUEFBATKAIDW-UHFFFAOYSA-N	427.804	1.980	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)NC(=O)CC3)o1	764138958	LWZMUVOFQBBETB-UHFFFAOYSA-N	427.461	1.406	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2cccc(OC(F)F)c2)cc(OC)c1OC	764250730	MMHOORSBNTUYMI-UHFFFAOYSA-N	439.371	1.714	50	20	IDGD	
CC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2cc(F)ccc2Br)c1	764270701	QLNVPMFYIKOALO-UHFFFAOYSA-N	437.225	1.946	50	20	IDGD	
Cc1cc(Oc2ncccn2)ccc1NC(=O)C(=O)NNC(=O)COc1ccccc1O	764278526	ZLOXCTWQSFKXGN-UHFFFAOYSA-N	437.412	1.448	50	20	IDGD	
CS(=O)(=O)Nc1cccc(CC(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)c1	764333582	CCBLMQSRIXDAAF-UHFFFAOYSA-N	438.456	1.914	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)C(=O)Nc2cc(Br)ccc2Br)cn1	764359597	VZLTYTVWRGBEJW-UHFFFAOYSA-N	445.071	1.345	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)N[C@@H]2CCCC[C@H]2N2CCOCC2)cc1	764373980	ILEUVTJITVHZJG-NSISKUIASA-N	434.537	1.826	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc(C#N)cc3)n[nH]2)cc1OC	764379364	XJFYTMBMOWHZFP-UHFFFAOYSA-N	434.412	1.365	50	20	IDGD	
COc1cc(OC)c(NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)cc1F	764384954	OHIRIGWVOWPMPU-UHFFFAOYSA-N	433.421	1.694	50	20	IDGD	
CC(C)(C)n1cc(C#N)c(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)n1	764386905	FEMLGEJGBGYOHC-UHFFFAOYSA-N	438.423	1.439	50	20	IDGD	
CCOc1cc2c(cc1NC(=O)C(=O)NNC(=O)CSc1ccccc1O)O[C@H](C)C2	764394237	QFHHXMKIGINXAI-GFCCVEGCSA-N	445.497	1.993	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(=NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)CC1	764828835	UNAVVAPXWHFEHA-UHFFFAOYSA-N	443.548	1.948	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)c(C)c1	765126590	KEVFMVNJWQBTBN-UHFFFAOYSA-N	446.573	1.439	50	20	IDGD	
C[C@H](NC(=O)c1n[nH]c2ccccc12)C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C	765317034	IVRWNCRWGXURTQ-LBPRGKRZSA-N	432.481	1.134	50	20	IDGD	
CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CCN(S(=O)(=O)CBr)CC1	765638979	RNYFJTMEKSWVGP-AWEZNQCLSA-N	448.339	1.990	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cc4ccccc4c(O)n3)CC2)cc1	765749651	ZWHIQFRYEAONLD-UHFFFAOYSA-N	433.512	1.828	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)c1OC	765750086	ZBJYSNYWJIMXSE-UHFFFAOYSA-N	426.517	1.591	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	765757774	GEKMSVOPFFDFII-UHFFFAOYSA-N	434.899	1.823	50	20	IDGD	
CC(C)c1cc(NC(=O)C(=O)NNC(=O)c2cccc(N(C)C)c2)n(-c2ncccn2)n1	768237327	JNBGXNDFUQBMBL-UHFFFAOYSA-N	436.476	1.251	50	20	IDGD	
O=C(CNC(=O)c1c[nH]c2ccccc2c1=O)NNC(=O)c1cc(-c2cccs2)[nH]n1	768261878	XPBVTVASJWQPHZ-UHFFFAOYSA-N	436.453	1.171	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3ccc4c(c3)OCC(=O)N4)n[nH]2)cc1OC	768276559	KRKPXGXWNBDADU-UHFFFAOYSA-N	437.412	1.500	50	20	IDGD	
O=C(CS(=O)(=O)Cc1ccc(Br)cc1)NNC(=S)Nc1ccccn1	768581647	TXVYCNFKGXNCKX-UHFFFAOYSA-N	443.348	1.777	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)NC2CCN([C@@H]3CCC[C@@H]3O)CC2)cc1	769155287	MUYDAHNGJLZGRE-YSGRDPCXSA-N	434.537	1.561	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@H]2CCO[C@]3(CCSC3)C2)c2ccccc2c1=O	769235876	RLMAUMPGADJGND-RNODOKPDSA-N	431.518	1.415	50	20	IDGD	
CNC(=O)COc1ccc(NC(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)cc1	770027420	TYQGODJXHMZZCP-UHFFFAOYSA-N	428.417	1.956	50	20	IDGD	
O=C(NNC(=O)[C@H]1CC(=O)N(c2c(F)cccc2F)C1)c1cc(Br)c[nH]1	770602267	MWQADPZGDNGOST-QMMMGPOBSA-N	427.205	1.870	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)Cc2cccc(OCC(F)(F)F)c2)c2ccccc2c1=O	770747260	FATLDIDTMSSNEL-UHFFFAOYSA-N	434.374	1.878	50	20	IDGD	
COc1ccccc1C(=O)NNS(=O)(=O)c1cc(C(=O)O)c(F)cc1Br	771144009	NCFNAHPJHIBVEN-UHFFFAOYSA-N	447.238	1.918	50	20	IDGD	
Cn1cnnc1COC(=O)/C(C#N)=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	771855149	UQYMXHMOWCYDTO-ZSOIEALJSA-N	439.863	1.858	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)[C@@H]1CC(=O)N(c2ccc(F)c([N+](=O)[O-])c2)C1	771973295	IYMXXBJHGHTGCN-VXGBXAGGSA-N	438.412	1.212	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)[C@H](c1ccccc1)N1CCSCC1	772890488	YFKGFRUPDCGIOH-SFHVURJKSA-N	446.960	1.894	50	20	IDGD	
O=C1C[C@@H](Cc2ccc(NC(=O)C(=O)NNc3ccc(C(F)(F)F)cn3)cc2)C(=O)N1	773676909	XRXWKGMBJYOHCY-LLVKDONJSA-N	435.362	1.387	50	20	IDGD	
N#Cc1ccc(NNC(=O)C(=O)Nc2ccc(C(=O)N3CCOCC3)c(Cl)c2)cc1	773698181	ZULZIRHOWDSWQI-UHFFFAOYSA-N	427.848	1.766	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(N3CCCN(C)CC3)cc2)cc1F	773890934	WVHREMJUZDOWGG-UHFFFAOYSA-N	427.480	1.676	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)ccc1C(=O)N(C)C	774008404	HXTCAUILXZXOKE-ZDUSSCGKSA-N	446.891	1.904	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCc2nn(C)c3ccccc23)c1	776178137	IEOQKUOEYBCCAG-UHFFFAOYSA-N	444.517	1.010	50	20	IDGD	
CC(C)N1CC[C@H](NC(=O)NNC(=O)C(=O)NC2CC2)[C@@H]1c1ccc(Cl)c(F)c1	777750537	PYVSITGMBBZSIR-HOTGVXAUSA-N	425.892	1.612	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)CCNS(=O)(=O)c2ccc(C)c(C)c2)nc1C	778422203	XITPTZLYRWKYRT-UHFFFAOYSA-N	435.506	1.390	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccccc3CCN(C)C)n[nH]2)cc1	782702832	RJGBAJCERHPNKH-UHFFFAOYSA-N	434.500	1.889	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C(=O)N2C[C@@H]3CCCN3c3ccccc32)nc2ccccc21	782888594	VTAJFGOCOZJTJJ-HNNXBMFYSA-N	432.484	1.279	50	20	IDGD	
COC(=O)c1c(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)sc(C)c1C	782892905	FBXDJVNFIZHNTF-UHFFFAOYSA-N	443.485	1.367	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)C(=O)Nc1cccc2cnccc12	784210451	PYJHHKIRXVDNSK-UHFFFAOYSA-N	425.470	1.757	50	20	IDGD	
COc1cccc(NNC(=O)C(=O)Nc2ccc(S(=O)(=O)N3CCC[C@@H](C)C3)cc2)n1	784846630	ULDMMJKUUBUSNR-CQSZACIVSA-N	447.517	1.593	50	20	IDGD	
CN1CCC[C@H](N(C)C(=O)c2ccc(NC(=O)C(=O)NNc3ccnc(F)c3)cc2)C1	784848156	DIHBMRYJCUPFLC-KRWDZBQOSA-N	428.468	1.469	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)C(=O)Nc1ccn(-c2ccccc2Cl)n1	785067340	LFVOMMZMVKJZJI-UHFFFAOYSA-N	437.847	1.502	50	20	IDGD	
O=C(Cn1cc(NC(=O)C(=O)NNc2cc(C(F)(F)F)ccc2F)cn1)NC1CC1	785170988	OMKICMDUWJFCDZ-UHFFFAOYSA-N	428.346	1.401	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)C(C)(C)S(=O)(=O)C1CC1	785700892	UYCIWNAODHPQOR-SNVBAGLBSA-N	433.324	1.720	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(-c3ccco3)cc2F)c1	787542638	CHFICCIPURIPJN-UHFFFAOYSA-N	445.428	1.889	50	20	IDGD	
CN1CCN(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C3CCCCC3)c2)CC1	788166244	KHWXAWAPYCXSRN-UHFFFAOYSA-N	437.566	1.242	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)NOC[C@@H]2CCOC2)cc1	788573694	HKDZKKOPCVKGAM-DISPHTKASA-N	439.472	1.425	50	20	IDGD	
C[C@]1(C(N)=O)CCN(C(=O)NNC(=O)[C@@H]2Cc3ccccc3CN2Cc2ccccc2)C1	792879438	KJYZIGKASRPBGI-RDPSFJRHSA-N	435.528	1.552	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2CCCN2C(=O)Cc2cccs2)cc1C	798309353	LGEIPZQIIYALAK-KRWDZBQOSA-N	428.514	1.685	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NC2CCN(c3nccs3)CC2)c2ccccc2c1=O	798508755	OJJMSLJDMCLKCG-UHFFFAOYSA-N	427.490	1.003	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)Cc2ccc(C(=O)NNC(=O)c3cnnn3C)cc2)cc1	798825239	MCLOADQXGFTQSC-UHFFFAOYSA-N	442.501	1.019	50	20	IDGD	
CCOc1ccc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)c3n[nH]cc3C)cc2)cc1	799409181	POZJHEZTZKASAJ-UHFFFAOYSA-N	443.485	1.992	50	20	IDGD	
C[C@H](c1ccccc1)N(C)C(=O)CN(C)C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	799856776	FJTBLXIBJCIDJV-OAHLLOKOSA-N	436.476	1.168	50	20	IDGD	
CCN1CCN(CC(=O)NNc2c(Br)cccc2Br)C(=O)C1=O	801504687	SMBUUOQXBSWTKY-UHFFFAOYSA-N	448.115	1.345	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)CCNS(=O)(=O)c2cccc(C(C)=O)c2)cc1	802055057	UUUHCWDNGNOLPS-UHFFFAOYSA-N	434.474	1.419	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(C(F)(F)F)nc2C)cc1	802565635	DFRRXGCQRJXEBO-UHFFFAOYSA-N	426.351	1.582	50	20	IDGD	
N#Cc1cc(F)cc(C2(C(=O)OCC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)CC2)c1	803921407	AIKJQVNWPIHLQF-UHFFFAOYSA-N	426.360	1.642	50	20	IDGD	
COC(=O)c1scc(-c2ccc(C)cc2)c1NC(=O)C(=O)NNC(=O)[C@@H]1COCCO1	806980398	OWQWJNKYLGMABX-AWEZNQCLSA-N	447.469	1.011	50	20	IDGD	
COc1cc(Cl)c(NC(=O)C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc1C	808934531	JPUJDRDORMYHEX-UHFFFAOYSA-N	443.847	1.948	50	20	IDGD	
Cc1cc(C(F)(F)F)ncc1NC(=O)C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C	810386802	SBFHJHAACQVIIZ-UHFFFAOYSA-N	447.414	1.800	50	20	IDGD	
C/C(C=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O)=C\c1ccccc1OC(F)F	811636876	NJTMKYQENUEINH-HCFAEROASA-N	439.444	1.378	50	20	IDGD	
COC(=O)Cc1cc(Br)ccc1S(=O)(=O)NNC(=O)c1ccc(C)o1	811687955	KUMHAYCXUMPGCB-UHFFFAOYSA-N	431.264	1.689	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cc(Cl)ccc2O)cc1	812014040	MQBUMQYEOGMHTR-UHFFFAOYSA-N	427.866	1.045	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)N2CCN(c3ccccc3)CC2)cc1	812447251	KKKQAEKIEUPCQJ-KRWDZBQOSA-N	440.500	1.349	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)c(C)cc1C	813033475	VMAJPRMFKRCDMS-UHFFFAOYSA-N	448.501	1.422	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@@H]2C[C@H]3C[C@H]3N2C(=O)OC(C)(C)C)c2ccccc2c1=O	814214969	KTDRHBVOXWRLOM-WQVCFCJDSA-N	441.488	1.575	50	20	IDGD	
CN(C)C(=O)COc1cccc(NC(=O)NNc2ccccc2S(=O)(=O)N(C)C)c1	814605946	REWXWTQTARGVOB-UHFFFAOYSA-N	435.506	1.553	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)CN2C(=O)C(F)(F)Oc3ccccc32)o1	814621604	AWVZWTCZNJXQKW-UHFFFAOYSA-N	436.415	1.901	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NN=C(C)CCCO)N(S(C)(=O)=O)CC2	814759256	WPZALEHWTFVYFL-INIZCTEOSA-N	427.523	1.217	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(N(C(C)=O)C3CC3)cc2)c1O	815568530	LJXJFOISMNDUMO-UHFFFAOYSA-N	426.429	1.316	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)Cc2ccc(-n3cnnn3)cc2)c1	816716195	BHRLELSZUKIKGG-UHFFFAOYSA-N	431.250	1.897	50	20	IDGD	
CC[C@@H](C)C(=O)NNC(=O)C[C@@H]1c2cc(OC)c(OC)cc2CCN1S(C)(=O)=O	818038738	JNVGKFXUQIAETQ-IUODEOHRSA-N	427.523	1.146	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)[C@@H](NS(C)(=O)=O)C(C)(C)C)c1	818750020	AWTQXYIYQNVWNA-GFCCVEGCSA-N	436.328	1.643	50	20	IDGD	
CCS(=O)(=O)N[C@H](CCSC)C(=O)NNC(=O)c1cc(-c2ccccc2)on1	819102823	ATYOWDZHLXXOGQ-CYBMUJFWSA-N	426.520	1.164	50	20	IDGD	
CN1C(=O)c2ccc(S(=O)(=O)NNC(=O)c3cc4c(s3)CCCCC4)cc2C1=O	861667111	PIQWLXQOKOJHMD-UHFFFAOYSA-N	433.511	1.866	50	20	IDGD	
CC(C)(C)c1ccc(C(=O)N[C@H](CCS(C)(=O)=O)C(=O)NNc2ncccn2)cc1	913043850	ACVJWVUYBQTESS-MRXNPFEDSA-N	433.534	1.451	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)NCCCN1C(=O)NC2(CCCCC2)C1=O	913638335	IDKIBBHMUXXAPO-UHFFFAOYSA-N	441.492	1.232	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)c2cnn(-c3ccccn3)c2C(F)(F)F)cc1	915188302	ADSOMIJFQISBHN-UHFFFAOYSA-N	430.346	1.998	50	20	IDGD	
COc1cccc(C[C@@H](C(=O)NNC(=O)c2ccc(Cl)cc2OC)n2nnnc2C)c1	915687574	FZQHVQFNUXRQBH-KRWDZBQOSA-N	444.879	1.897	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)N[C@@H](C)Cn2cccn2)c2ccccc2c1=O	916464803	YPTVCAPAGOJSRG-HNNXBMFYSA-N	425.493	1.816	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)NCCN1CCN(c2ccc(F)cc2)CC1	916513638	ILSLHWVKEFJZPC-UHFFFAOYSA-N	433.459	1.496	50	20	IDGD	
CCCCS(=O)(=O)N1CCC[C@H]1C(=O)NNC(=O)c1ccc(Br)s1	918688761	COQOUFABEYMJFX-JTQLQIEISA-N	438.369	1.866	50	20	IDGD	
COc1ccccc1CC(=O)NN=C(C)c1ccc(S(=O)(=O)NCCCC(=O)O)cc1	920375646	BRIZUVHGAFQGSU-UHFFFAOYSA-N	447.513	1.921	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(N2CCOCC2)c(C(=O)NNC(=O)CC(C)C)c1	920444450	HIZDXGGZDZBOEX-UHFFFAOYSA-N	440.566	1.361	50	20	IDGD	
O=C(COC(=O)[C@@H]1CCN(c2ccc(F)cc2)C1=O)NNC(=O)c1cccc(Cl)c1	920569550	OEPJLGFIWBLWOE-MRXNPFEDSA-N	433.823	1.836	50	20	IDGD	
CN(C)C(=O)c1cccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1	920931645	ZNMMFGCARPIVOT-UHFFFAOYSA-N	433.490	1.105	50	20	IDGD	
COc1cccc(C2CC(=O)C(=CNNC(=O)c3ccc(-n4cnnn4)cc3)C(=O)C2)c1	920979973	OQAWMCOPXCZZBV-UHFFFAOYSA-N	432.440	1.505	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2cc3c(cc2Br)OCCO3)cc1	1115914860	PMOBEBOUZGLOGU-UHFFFAOYSA-N	443.275	1.852	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NCc2cc(OCC(F)F)ccn2)cc1	1116506991	CHMDPISFHAUHJE-UHFFFAOYSA-N	443.432	1.665	50	20	IDGD	
CC[C@@]1(C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)CCN(C(=O)OC(C)(C)C)C1	1319565427	LOAUMFSUYDVBLN-JOCHJYFZSA-N	444.488	1.900	50	20	IDGD	
C[S@](=O)Cc1ccc(CNC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)cc1	1326880676	CZBQQOFINLQXNK-NDEPHWFRSA-N	438.531	1.505	50	20	IDGD	
CN(C)C(=O)[C@H]1CCC[C@H](NC(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)C1	1339221081	OTOMEKGYMHHCLE-HOTGVXAUSA-N	439.557	1.611	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@]2(C1)CN(C(=O)c1nn[nH]c1C(F)(F)F)CCO2	1779298993	SOESEFARTHCFEM-HNNXBMFYSA-N	435.479	1.119	50	20	IDGD	
C[C@@H](Nc1cnccn1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CO[Si](C)(C)C)C2	1779393331	LEPIGRBOZYIACF-CBGDNZLLSA-N	449.628	1.642	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cn3[nH]cnc(=O)c3c2C)C1	1780018982	NHZYAACSQMUYMN-GCKMJXCFSA-N	449.939	1.476	50	20	IDGD	
C=C(CC(=O)OCC)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Br)C2	1780738210	CHSDPUJVSFNKED-QIIPPGSGSA-N	449.317	1.700	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H]2CCC(=O)N2C)C1	1780787045	CTNBFISGKUJFIY-XTDOFWJNSA-N	444.370	1.152	50	20	IDGD	
O=C(c1cnc(Cl)s1)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781332343	XPPSQPXFLLLDIU-ZANVPECISA-N	426.695	1.931	50	20	IDGD	
O=C(c1onc2ccccc12)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781334761	ZUTLHVKOUGQEKE-WMLDXEAASA-N	426.242	1.962	50	20	IDGD	
CC(=O)N/C(C)=C/C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)CBr)C2	1781457627	IVVXTLFKNVTVMK-HVIDWFGJSA-N	444.370	1.571	50	20	IDGD	
C[C@H](C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCBr)C2)n1ccnn1	1781544993	PUESJYLUJMZFNU-CKEIUWERSA-N	428.331	1.138	50	20	IDGD	
COc1nn(C)cc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)Br)C1	1781996756	SYJQSIFFEGZIOR-RVZJWNSFSA-N	443.342	1.340	50	20	IDGD	
CN(C)c1c(F)cc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)cc1F	1782104851	IESAUWHVUMYDCV-DNVCBOLYSA-N	431.867	1.074	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](C)N1C[C@H]3C[C@@H]3C1)CCO2	1783349391	LGSJQWXKEITORX-RGQDEETRSA-N	428.371	1.330	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc([N+](=O)[O-])o3)[C@H]2C1	1783364954	VRLCSUNCMKVVKZ-FMSGJZPZSA-N	444.282	1.955	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc4c(c3)OCO4)CCO2)C1	1783535139	ZHEUEUWCUNLGFF-XIKOKIGWSA-N	425.279	1.642	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@@H](C(=O)N2CC[C@@]3(CN(C(=O)CCBr)CCO3)C2)C1	1783856285	IQJFKUIPNWQSDF-SPYBWZPUSA-N	445.354	1.581	50	20	IDGD	
CC#C[C@H](CC(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](Cl)COC)C2)C1)c1ccc(O)cc1	1783879156	PDCQPJHKXULPFL-QMHWCDLVSA-N	448.947	1.973	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1CCCCC1(F)F)CCO2	1783933196	DVPYWIMHBDECJR-KXBFYZLASA-N	430.496	1.015	50	20	IDGD	
Cc1cc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]3C2)n[nH]1	1783967849	YMLYUOGMMMSCBT-MZGVZZPPSA-N	427.343	1.271	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CNC(=O)c3cc(C)on3)C[C@@H]21	1784618292	XWMDCQOWKJHAOW-JKQORVJESA-N	440.928	1.100	50	20	IDGD	
Cc1cc(C)c(C(=O)N2CC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)c(C)c1	1784986075	MNLYPBYTLIBTIF-XMMPIXPASA-N	436.317	1.049	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(C)nn3CC)[C@H]2C1	1787290646	VQCMENFJGOPVBR-JKQORVJESA-N	441.370	1.978	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C/N=C/c3ccco3)[C@H]2C1	1788680944	AKRLPQCCJCBPKO-XFCHMZBFSA-N	440.338	1.852	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(OC)n3)C[C@@H]21	1790960646	AALCAATXDIUUTM-YXWQFLTLSA-N	440.338	1.857	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(Cl)nc(OC)c3)C[C@@H]21	1791255286	JQPUFZKJIRZEEF-MHEUCROKSA-N	446.331	1.591	50	20	IDGD	
Cn1ccc2c(O)ncc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]4C3)c21	1791298457	YXLVSBSLKBJLRY-BPNCWPANSA-N	441.315	1.676	50	20	IDGD	
CC[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)CBr)N(CC)CC	1792868900	VMLUNVRTRKUPNZ-KSWRQPAISA-N	432.403	1.727	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(-n3ccnc3)ccn1)C2	1793448550	FLWZFSWBPPWXKJ-HIRMHNASSA-N	431.924	1.878	50	20	IDGD	
CC(=O)NCCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1794144029	DZWOBSJHYZCRPB-FZKCQIBNSA-N	444.960	1.283	50	20	IDGD	
C[C@@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)CBr)C2)n1cccc1C=O	1795746760	QWMCBJKOMBOFEM-JGFGOLAASA-N	440.338	1.482	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc2[nH]ncc12	1796155634	VODYMPBIXIBXNO-KOFHJDLBSA-N	435.322	1.797	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2ccccn2n1	1796831354	UJKACSXSFPLPLH-VWPFQQQWSA-N	435.322	1.569	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1nn(C)c2c1CCC2	1797048772	FXZKUWBBOILDJN-FAXLKDOZSA-N	439.354	1.286	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1nc2ccccc2n(C)c1=O	1797524304	WOJQOMBBOCPLFQ-LXTVHRRPSA-N	432.908	1.439	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1nc2c(=O)[nH]c3ccccc3n2n1)[C@@H](F)Cl	1797659591	VKCVRCTWWVLXFY-FBKDDSFISA-N	432.843	1.357	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CCc3ccccc3[C@@H]1O)C2	1797953979	ZOHMIWNSPQBWJE-KOLYYURTSA-N	446.620	1.724	50	20	IDGD	
Cn1ccc2cccc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3cnccc3C(=O)NN)c21	1798440702	VLNJZNGBMRFOGA-BJWYYQGGSA-N	446.511	1.742	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN1CCC(C)CC1)C2	1800638195	RLHSZSWQTMWJRV-DFGXFYAUSA-N	430.387	1.481	50	20	IDGD	
Cc1ccc(S(=O)(=O)CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C(Cl)Cl)cc1	1801016002	NDRMXYQYNBFPBU-YWVIFJGQSA-N	449.356	1.162	50	20	IDGD	
Cc1nn(C)c(C)c1CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@](C)(Cl)CCl)C2	1801380690	LDOMLORJUSADRP-QOIYZWAUSA-N	431.364	1.405	50	20	IDGD	
Cc1ccn2ncc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)CCC(=O)NN(C)C)c2c1	1802333352	VTKMBSWJIXEVOP-BJWYYQGGSA-N	426.521	1.268	50	20	IDGD	
CS(=O)(=O)N1CCC(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)C(Cl)Cl)CC1	1802342007	MXOJCGGCQBXMQU-CLLJXQQHSA-N	426.366	1.100	50	20	IDGD	
N[C@H](CC(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)c1cccnc1	1803139378	XRIKOORMKHUOSS-MLYOOKFZSA-N	431.924	1.172	50	20	IDGD	
Cc1nnc(CCC(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)s1	1803142409	WRFUFXDGMSNGMO-RKVPGOIHSA-N	437.953	1.480	50	20	IDGD	
CN(C)c1ccc(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)nc1	1805090560	HMSCZXGIYRTYEQ-SNRMKQJTSA-N	431.924	1.462	50	20	IDGD	
CC(C)n1nc(C(=O)N2CCC3(CCCN(C(=O)[C@@H](O)CCl)C3)CC2)cc1C(=O)O	1805518587	PXTKQYMZWVRVQS-INIZCTEOSA-N	440.928	1.607	50	20	IDGD	
C[C@H](NC(=O)c1ccccc1)C(=O)N1CCC2(CCCN(C(=O)[C@H](O)CCl)C2)CC1	1805529064	IJKVBKVCBWMBIS-FUHWJXTLSA-N	435.952	1.636	50	20	IDGD	
Cc1ccc(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)nc1	1805867756	HTYIAPDTKVMOBE-DENIHFKCSA-N	444.300	1.098	50	20	IDGD	
O=C(CC1CCCC1)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1806190323	VBENIMJUWZDULD-NZQKXSOJSA-N	435.333	1.661	50	20	IDGD	
CCOC(=O)/C=C/C(=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@H]1c1cccnc1	1806297590	MGBKNEKXJGIRPK-XUVYTIDKSA-N	442.285	1.897	50	20	IDGD	
Cc1cccc(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)c1	1807375427	OPEVEFDSGWHXCY-JTHBVZDNSA-N	443.312	1.703	50	20	IDGD	
Cc1nnc(CC(=O)NC[C@@H]2CCN(C(=O)[C@@H](F)Br)[C@H]2c2cccnc2)o1	1807478310	GXJZEHDFIOZHJP-VBNZEHGJSA-N	440.273	1.712	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H](CNC(=O)[C@H](F)Cl)[C@H]1c1cccnc1)N1CCN(C)CC1	1808316230	WWGWHPPDBHXFIH-DDBAPUKQSA-N	425.936	1.258	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)c3ccc(F)cc3F)CC2)C1	1809978049	RJOWSDMNBBEROB-UHFFFAOYSA-N	442.271	1.803	50	20	IDGD	
Cc1cc(C(=O)NCC(=O)N[C@@H]2CCc3nc(NC(=O)[C@@H](F)Cl)sc3C2)no1	1817125161	GKEVAGDWVAQZTM-AMIZOPFISA-N	429.861	1.316	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)ccn1	1817476974	VAWVSGBSSTXHTB-IBGZPJMESA-N	433.277	1.413	50	20	IDGD	
CC(=O)N1CCN(CC(=O)N2CCCC[C@@H]2c2cc(NC(=O)[C@H](F)Cl)n[nH]2)CC1	1818039356	RWULLNIWPSUZAP-PBHICJAKSA-N	428.896	1.100	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cocn2)[nH]n1	1818111333	DDVBHYVFJPSYES-SOAGAIGUSA-N	438.448	1.838	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H]2C[C@H]2F)[nH]n1	1818112975	XZTFQQCCJNJFHE-MEGIBFAXSA-N	429.456	1.894	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)C[C@H]2NC(=O)NC2=O)[nH]n1	1820862313	NBCGVNXBNPECOX-RLFDGXBXSA-N	445.307	1.236	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)CN2CCCC2=O)[nH]n1)[C@@H](F)Br	1820932331	GEUQRAYYCLKFSR-IAQYHMDHSA-N	430.278	1.715	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(=O)n2O)CC1	1825494186	BZDZJIIPZWYXDV-JKSUJKDBSA-N	425.913	1.573	50	20	IDGD	
Cc1cnc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)cn1	1825873585	UFEJGGJJFCQTJK-OAQYLSRUSA-N	436.321	1.012	50	20	IDGD	
Cc1cc(C(=O)N[C@@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)c(C)n1C	1826087966	MFICPEJOYLXELK-CQSZACIVSA-N	446.577	1.697	50	20	IDGD	
O=C1C[C@H](C(=O)N2CCC([C@@H]3CCCCN3C(=O)CCBr)CC2)CCN1	1826360780	VIICEMJXQNFIKO-CVEARBPZSA-N	428.371	1.917	50	20	IDGD	
CCc1ncccc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827050048	FRXXFKIIGJZEPN-QHCPKHFHSA-N	449.360	1.871	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)/C=C/c3ccoc3)C2)C1	1830535333	MRGXSNVSBFHXAH-JDDKEMAESA-N	441.322	1.780	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccncc3)C2)C1	1830537799	OYAYVMXCKORBQD-KBXCAEBGSA-N	426.311	1.183	50	20	IDGD	
O=C(/C=C/c1ccc(F)cc1F)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1830726252	PXXUAUIHQUFBCG-VGCZDJJCSA-N	444.862	1.034	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4cccnn4c3)C2)C1	1831654876	YOBDWENNHWCZAQ-WIYYLYMNSA-N	434.924	1.812	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cccnc3S)CC2)CC1	1833081686	UYQUWXWLFUATAN-KRWDZBQOSA-N	440.997	1.809	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3ccn(C(F)F)n3)CC2)CC1)[C@H](O)CCl	1833312628	SXOFFNQYAJSVCQ-OAHLLOKOSA-N	433.887	1.063	50	20	IDGD	
CC(C)c1nc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)co1	1833346445	JYOIJCLUXKUIFP-GUYCJALGSA-N	448.289	1.559	50	20	IDGD	
Cc1nc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](C)CBr)C3)C2)co1	1834203790	NQZWQDKQYIVZRG-SJCJKPOMSA-N	430.299	1.084	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)C(=O)c3ccccc3)CCO2)C1	1834706805	UPQJRSJNLAWMGP-PMACEKPBSA-N	443.327	1.562	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)CC3CCOCC3)CCO2)C1	1835416521	VWADVPDHQUEZIA-BEFAXECRSA-N	447.370	1.291	50	20	IDGD	
Cc1n[nH]c(C)c1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)CBr)C2)C1	1837801565	WHGXQTCJSWDBBN-XIKOKIGWSA-N	443.342	1.128	50	20	IDGD	
O=C(c1c[nH]c(=O)cn1)N1CCC(OC2CCN(C(=O)[C@H](F)Br)CC2)CC1	1838538791	JTFWBSDWVHEZTF-HNNXBMFYSA-N	445.289	1.073	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(OC)cc(OC)c3)CCO2)C1	1838934597	ZPVPOOCUDYIHIK-GHTZIAJQSA-N	440.924	1.791	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)ccc1F	1839321231	PSOLUCBFUYWMQG-QAPCUYQASA-N	447.276	1.895	50	20	IDGD	
O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1[C@H]3C=CS[C@H]31)CCO2	1839696716	UYXUKHPYQMJULU-MMTVNHQJSA-N	431.352	1.103	50	20	IDGD	
C=CCC(F)(F)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](Br)CC)C2)C1	1839890505	DFOQIIFCKAOVOU-XJKSGUPXSA-N	439.297	1.828	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3cccnc3C)C2)C1	1840149932	BYKFIDRJJRMNGC-NQIIRXRSSA-N	439.940	1.033	50	20	IDGD	
CCCc1onc(C)c1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](Cl)COC)CCO2	1840152321	FNHRPJXQCLCAMO-QRWLVFNGSA-N	443.928	1.259	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)/C=C/c3cccc(O)c3)C2)C1	1840155982	LTXFJZIRNLSZCT-ABGJEJFVSA-N	438.908	1.116	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CCCSC1)CCO2	1840859851	AOBVXDGUPSTVLP-RVKKMQEKSA-N	449.411	1.617	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H](O)C[C@H]1C(=O)N1CC2(CCCN2C(=O)C(C)(C)CCl)C1	1841227482	KHHXZHFPOXWEJJ-CABCVRRESA-N	443.972	1.825	50	20	IDGD	
O=C(c1cc2cc[nH]c2cc1Cl)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843011378	XFFRYJGXZZHCRN-UHFFFAOYSA-N	437.692	1.632	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)CCc1ccccc1Cl)C2	1844263878	FLWIDDMUFJZIPF-UHFFFAOYSA-N	441.919	1.788	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)(C)O)C2	1845168546	LVAIRTPWKPYMEL-UONOGXRCSA-N	431.961	1.871	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC2(CCCN2C(=O)[C@H]2CC(c3ccccc3)=NN2)C1	1845741154	ZMCXLUKCFYIABY-RHSMWYFYSA-N	433.350	1.987	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@H]2Cc3[nH]nc(C(F)(F)F)c3C2)C1	1845858689	KDYXPMFHTMVFON-JQWIXIFHSA-N	434.846	1.601	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)CCc1c[nH]c3ncccc13)C2	1846386550	ZGRVJMIFDRRFFF-UHFFFAOYSA-N	426.521	1.072	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1ccc(S(C)(=O)=O)cn1	1847495845	OJDDPYZYGRSMRT-UGFHNGPFSA-N	444.351	1.332	50	20	IDGD	
CS(=O)(=O)Cc1cccc(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c1	14798007	MIKYRYVSLAOLOP-UHFFFAOYSA-N	444.557	1.205	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)c2n[nH]c(=O)c3ccccc23)cc1	21290912	XKUWWJSZGQCAKU-UHFFFAOYSA-N	435.469	1.419	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)c2ccc(-n3c(C)nc4ccccc4c3=O)cc2)n1	27609056	ALXIACUPSZZSGD-UHFFFAOYSA-N	430.468	1.969	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)CCS(=O)(=O)c2ccc3c(c2)OCCO3)c1	28640610	LRZTYCGTUGTERZ-UHFFFAOYSA-N	448.497	1.465	50	20	IDGD	
C=CCNS(=O)(=O)c1cc(C(=O)NNC(=O)COc2ccccc2OC)ccc1F	116853098	BINZWOPRKKNHBJ-UHFFFAOYSA-N	437.449	1.139	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)[C@H](C)NS(=O)(=O)c1ccc(C)cc1	726021682	ONXYCHBSLJRYQI-HNNXBMFYSA-N	435.502	1.287	50	20	IDGD	
CS(=O)(=O)c1ccc(Br)c(C(=O)NNC(=O)c2ccc3c(c2)OCO3)c1	728854898	HAKQNKYKUSBVDC-UHFFFAOYSA-N	441.259	1.656	50	20	IDGD	
C[C@@H](c1ccc(-n2cncn2)cc1)N(C)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	728958609	BKHXVKPJNKYERZ-INIZCTEOSA-N	449.519	1.708	50	20	IDGD	
O=C(NCCCCN1CCN(c2ncccn2)CC1)NNC(=O)c1cccc(Cl)c1	729233861	XUDXPEJPJUGTCZ-UHFFFAOYSA-N	431.928	1.676	50	20	IDGD	
CSCC[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)NNC(=O)Cc1ccccn1	729391877	QQGUHBLZIDNWPO-INIZCTEOSA-N	431.474	1.231	50	20	IDGD	
Cc1cc(S(C)(=O)=O)c(C)c(S(=O)(=O)NNC(=O)c2ccc(Cl)cc2O)c1	730203050	GZXSYTAIDAFABD-UHFFFAOYSA-N	432.907	1.689	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)OCCN(C)S(=O)(=O)N(C)C)c(C)n1C[C@H]1CCCO1	731143966	HQYYHSZGNDKOKW-TVNWYLLRSA-N	438.550	1.472	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)[C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])o2)cc1OC	731874637	KKTDZELOERHSTH-CYBMUJFWSA-N	446.416	1.661	50	20	IDGD	
CN(Cc1ccccc1Br)C(=O)CCNC(=O)NNC(=O)Cc1cccnc1	732245803	GTQXDOKKCYVCAU-UHFFFAOYSA-N	448.321	1.766	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)NCc1ccc(OCCN2CCCC2)cc1	732252906	BQMNSKJSFQVBND-UHFFFAOYSA-N	428.489	1.776	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)[C@@H]2CC(=O)N(c3ccc4c(c3)CCC4)C2)C[C@@H](C)O1	732262037	HYXVAYHEVHXZNL-GPMSIDNRSA-N	428.533	1.175	50	20	IDGD	
COc1ccc(S(N)(=O)=O)cc1C(=O)NNc1nc(-c2ccccn2)nc(C)c1C	734260016	RJNNQXRHRUYTSN-UHFFFAOYSA-N	428.474	1.568	50	20	IDGD	
O=C(CN1CCN(C(=O)CCCC[C@H]2CCSS2)CC1)N[C@H]1CCS(=O)(=O)C1	736165219	AEXYGJJQTJGYJV-HOTGVXAUSA-N	449.664	1.148	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NC[C@@H](C)CN2CCOCC2)c2ccccc2c1=O	739049103	OEWZDHUFZRRTBN-MRXNPFEDSA-N	444.536	1.109	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NN=Cc1cc(I)c(O)c(OC)c1	740763200	BQPUTLFHURFNBF-UHFFFAOYSA-N	433.246	1.760	50	20	IDGD	
O=C(C[C@H](C(=O)NN=Cc1ccccc1F)N1CCOCC1)NN=Cc1ccccc1F	741766399	LAQJOAMDNUGBNQ-HXUWFJFHSA-N	443.454	1.656	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2SCCc3sccc32)c1	742471138	ONALIIBGJCBYGW-OAHLLOKOSA-N	425.557	1.790	50	20	IDGD	
C[C@H](CC(=O)NNc1nc(-c2ccncc2)no1)/N=C1/NS(=O)(=O)c2ccccc21	742612503	JYRSJYGDYOPNDG-LLVKDONJSA-N	427.446	1.092	50	20	IDGD	
C=CCNS(=O)(=O)c1cccc(C(=O)OCC(=O)NNC(=O)c2cccc(C)c2)c1	744553465	MFDRSAGWMSIYMB-UHFFFAOYSA-N	431.470	1.077	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)N[C@H]2C[C@H](C)N(c3ccccc3)C2=O)nc1	745882503	OYMMTINSHUYFIR-YOEHRIQHSA-N	446.533	1.588	50	20	IDGD	
CCOCC(=O)NNC(=O)N[C@H](c1cccc(S(C)(=O)=O)c1)c1ccc(F)c(F)c1	745903288	FKYMCISTGJKUNI-GOSISDBHSA-N	441.456	1.825	50	20	IDGD	
C[C@@H]1C[C@@H](NC(=O)NNC(=O)CCSc2ccc(F)cc2)C(=O)N1c1cnn(C)c1	745919957	XSPOPASFLMQYKP-MLGOLLRUSA-N	434.497	1.566	50	20	IDGD	
CCCOc1ccc(C(=O)NNS(=O)(=O)c2cc(C(=O)OC)n(C)c2)cc1OC	745977530	YAPZGNBEGJEYAF-UHFFFAOYSA-N	425.463	1.232	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NCc2ccccc2Br)c2ccccc2c1=O	746963726	VRCKTZHHJHJWKH-UHFFFAOYSA-N	430.262	1.840	50	20	IDGD	
O=C(COC(=O)C1CC(OCc2ccccc2)C1)NNC(=O)c1cccc([N+](=O)[O-])c1	747054707	ODHLAPFIIUDABL-UHFFFAOYSA-N	427.413	1.894	50	20	IDGD	
Cc1nc(Cl)cc(NNC(=O)c2cccc(S(=O)(=O)N3C[C@H](C)O[C@H](C)C3)c2)n1	747982189	UWMIXXDCCKCLAE-TXEJJXNPSA-N	439.925	1.993	50	20	IDGD	
O=C(CCN/C(O)=C1/N=CC=CC1=O)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1	748523648	YALIQBODUJFHMV-PFONDFGASA-N	432.380	1.340	50	20	IDGD	
NS(=O)(=O)c1ccc(N2CCOCC2)c(C(=O)NNc2ccc(OC(F)F)cc2)c1	748661761	ZSBMPWJDJJRTFO-UHFFFAOYSA-N	442.444	1.529	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)c1cc(S(=O)(=O)N2CCC2)ccc1Cl	748693419	FSBBHRBRHKXEQL-UHFFFAOYSA-N	425.869	1.877	50	20	IDGD	
Cc1cc(Br)ccc1NNC(=O)C1=NN([C@@H]2CCS(=O)(=O)C2)C(=O)CC1	748737040	OFMXPTYZRKZBLI-GFCCVEGCSA-N	443.323	1.366	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2cc(F)cc(C(=O)O)c2)cc1Br	749144331	WSOVBTNBAUVKGW-UHFFFAOYSA-N	447.238	1.918	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)NC1CCN(c2cc(C)nc(C)n2)CC1	749615722	KTKOTLCCTLKYSZ-UHFFFAOYSA-N	442.520	1.870	50	20	IDGD	
O=C(O)c1ccc(C=NNC(=O)c2cc(S(=O)(=O)NCc3ccccc3)ccc2O)[nH]1	749810328	QOHWTMIHJIVSPK-UHFFFAOYSA-N	442.453	1.661	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)c1cccc(F)c1I	749917006	VWMRPDFREWYRDB-UHFFFAOYSA-N	430.173	1.976	50	20	IDGD	
O=C(CCN1C(=O)[C@@H]2CCCC[C@H]2C1=O)NNc1nc(Br)cn2ccnc12	750244113	VXKSUKLZGITCPU-GHMZBOCLSA-N	435.282	1.500	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)NNC(=O)COc2ccc(Br)cc2)c(C)o1	751297211	JHVPHAVUEJBFLL-UHFFFAOYSA-N	446.279	1.099	50	20	IDGD	
CC(C)C(=O)NNC(=O)[C@H](CCS(C)(=O)=O)NC(=O)c1ccc(C(C)(C)C)cc1	751297722	QVRAZSYSVVTLCD-INIZCTEOSA-N	425.551	1.321	50	20	IDGD	
COc1ccnc(NNC(=O)c2sccc2S(=O)(=O)NCc2cccs2)n1	751322695	YJHLJGJOCXUZHK-UHFFFAOYSA-N	425.517	1.844	50	20	IDGD	
CO[C@H](C)c1nc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cs1	753057900	RKFNONGNDKRRHP-LLVKDONJSA-N	441.535	1.245	50	20	IDGD	
CC[C@@H](NC(=O)NNC(=O)c1ccc(OC)c(Br)c1)C(=O)N1CCOCC1	753060836	XARBZTUNFHNKSI-CYBMUJFWSA-N	443.298	1.039	50	20	IDGD	
COc1ccc(N2C(=O)CC[C@H](C(=O)NNC(=O)CO)[C@@H]2c2ccccc2OC)cc1	753452811	SYUPTMLJWZXSSF-UWJYYQICSA-N	427.457	1.328	50	20	IDGD	
C[C@@H](NCC(=O)NNC(=O)c1ccc(C#N)cc1)[C@H]1CCCN(C(=O)OC(C)(C)C)C1	754314469	BNLXFPABZGVBRS-QAPCUYQASA-N	429.521	1.944	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCCCC2)cc1NC(=O)NNC(=O)c1cnn(C)c1	755409801	AEGRQTJNDHMWTH-UHFFFAOYSA-N	436.494	1.070	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)Nc1cccc(S(=O)(=O)NC2CC2)c1	755586278	UBUXNAXVCJOSCU-GFCCVEGCSA-N	436.465	1.887	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)NC2CCN(S(=O)(=O)C(C)(C)C)CC2)c1	755900979	SXWHDEGWYYUJDQ-UHFFFAOYSA-N	425.555	1.289	50	20	IDGD	
COC(=O)CCOc1ccc(NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1	756278440	JCRXYHQVZWPEEP-UHFFFAOYSA-N	435.458	1.499	50	20	IDGD	
CN(C1CC1)S(=O)(=O)c1ccc(NC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1	756400167	CCSSDEMMGJGYPZ-UHFFFAOYSA-N	433.446	1.844	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)c2cccc3ncccc23)ccc1S(=O)(=O)N(C)C	757775366	JOECDFZAGMVNIP-UHFFFAOYSA-N	443.485	1.960	50	20	IDGD	
CS(=O)(=O)CCn1cccc(NC(=O)NNC(=O)Cc2ccc3ccccc3c2)c1=O	757780520	JWWKYNOIKLYPAQ-UHFFFAOYSA-N	442.497	1.442	50	20	IDGD	
COC(=O)c1ccccc1CCC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	758055370	OCWHSXZZAIEERG-UHFFFAOYSA-N	433.486	1.117	50	20	IDGD	
CCS(=O)(=O)N1CCC(CNC(=O)NNC(=O)CCSc2ccc(F)cc2)CC1	758746644	XLLSBCIQBHPDGI-UHFFFAOYSA-N	446.570	1.700	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)C(=O)Nc1ccccn1)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	758748505	NXBGSQMRRSXUCK-UONOGXRCSA-N	434.497	1.386	50	20	IDGD	
O=C(CN1CC[C@@H](N2CC(=O)Nc3ccccc32)C1)NNC(=O)c1cccc(Cl)c1	759910211	LFEGDAXEBCWCKP-MRXNPFEDSA-N	427.892	1.634	50	20	IDGD	
Cc1ccc(F)c(NNC(=O)[C@@H](CCS(C)(=O)=O)NS(=O)(=O)c2ccccc2)c1	760141459	LSRFLHUAMWNOFW-MRXNPFEDSA-N	443.522	1.359	50	20	IDGD	
COC(=O)[C@@H](C)NC(=O)/C(C#N)=C\c1cn(CCC(N)=O)nc1-c1ccc(OC)cc1	761103440	KWKHFHIWOXJNAV-NWFCWYBLSA-N	425.445	1.019	50	20	IDGD	
CN1CC[C@H](CNC(=O)NN[C@@]2(C)CCS(=O)(=O)C2)[C@H]1c1ccc(Cl)c(F)c1	763091484	KSAOEBGMWZKCFC-QBIMZIAESA-N	432.949	1.853	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2ccncc2Br)cc1	763122188	NICPZRBWMODAHE-UHFFFAOYSA-N	441.307	1.234	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)C(=O)Nc1ccc(F)cc1	763512905	UWFAXHQKJHGEPE-UHFFFAOYSA-N	448.476	1.400	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)C(=O)Nc1ccc(OCC(F)(F)F)nc1	763548074	IBAVZCASXQDGGZ-UHFFFAOYSA-N	426.307	1.151	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)Nc1ccccc1OC(F)(F)F	763573997	WLRXFNMTFYRDNK-AWEZNQCLSA-N	425.319	1.511	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccccc1OC(F)(F)F	763656537	CLYBKTXVAPUHAM-UHFFFAOYSA-N	427.335	1.759	50	20	IDGD	
O=C(CSc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1cccnc1-n1cncn1	763734905	NOHRFCWZURKWKS-UHFFFAOYSA-N	431.865	1.194	50	20	IDGD	
CCc1nnc(-c2cccc(NC(=O)C(=O)NNC(=O)CN3CCCc4ccccc43)c2)o1	763737018	WGADXSHYZZSBDV-UHFFFAOYSA-N	448.483	1.838	50	20	IDGD	
COCCn1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccco3)nc3ccccc23)n1	763764094	PWOUWSQKLKDHOR-UHFFFAOYSA-N	448.439	1.737	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)c1	763772993	RUPVVZHCFZKHGN-UHFFFAOYSA-N	440.456	1.340	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)C1=Cc2cc(Br)ccc2OC1	763826429	ZJZQMILALKDOSQ-UHFFFAOYSA-N	431.246	1.197	50	20	IDGD	
COC(=O)NCc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)cc1	763863773	BXPWQUAISWSPCS-GFCCVEGCSA-N	432.408	1.235	50	20	IDGD	
CC(=O)N(Cc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccc(F)cc2)cc1)C1CC1	763918345	FOXXZQXLAIKUFV-UHFFFAOYSA-N	426.448	1.665	50	20	IDGD	
CC(=O)Nc1cc(NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)c(F)cc1F	763978247	HBPXCPIIAMCAST-UHFFFAOYSA-N	426.763	1.682	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)on1)C(=O)Nc1ccccc1C(=O)N1CCCC1	764015898	ASPIYXVFWRAKTP-UHFFFAOYSA-N	447.451	1.977	50	20	IDGD	
CC(=O)N1CCc2cc(NC(=O)C(=O)NNC(=O)c3cc(-c4ccccc4)on3)ccc21	764017207	UMZUELOJCXNFSP-UHFFFAOYSA-N	433.424	1.650	50	20	IDGD	
C[S@@](=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cccc(C(F)(F)F)c2)cc1F	764039867	BJEFSGWHEUXVIG-GDLZYMKVSA-N	431.367	1.982	50	20	IDGD	
CNC(=O)Cn1ccc2ccc(NC(=O)C(=O)NNC(=O)c3ccc4ccccc4c3)cc21	764067235	RQPNMCGFIWLMRG-UHFFFAOYSA-N	443.463	1.940	50	20	IDGD	
CCC(CC)NC(=O)[C@H]1CN(C(=O)C(=O)NNC(=O)C2CCCC2)c2ccccc2O1	764078098	YIBRJGNIJMXWHN-GOSISDBHSA-N	430.505	1.423	50	20	IDGD	
O=C(Cc1ccc2ccccc2c1)NNC(=O)C(=O)Nc1cccn(CC(F)(F)F)c1=O	764083939	GSMYVKSTPNTJAK-UHFFFAOYSA-N	446.385	1.892	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2ccc(NC(=O)C3CC3)nc2)cc1	764130590	ABCDAXGNFCFUHI-UHFFFAOYSA-N	425.445	1.157	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(Cl)ccc2C(=O)N2CCCC2)cc1	764177889	UDDBPHPRCYMQHN-UHFFFAOYSA-N	439.859	1.847	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1cccc(OCc2cscn2)c1	764277609	FSXYMGJGZYOTPB-UHFFFAOYSA-N	442.453	1.593	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)C(=O)Nc1cccc(Cl)c1-n1cncn1	764289638	WVSHMKHEULJFKH-UHFFFAOYSA-N	428.836	1.345	50	20	IDGD	
O=C(CCC(=O)N1CCN(c2ccccc2)CC1)NNC(=O)c1ccc2c(c1)OCCO2	764635749	OALIXYUZJXYINL-UHFFFAOYSA-N	438.484	1.348	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)cc1	765126587	JXJOAUULXKEOSP-UHFFFAOYSA-N	446.573	1.521	50	20	IDGD	
CC(=O)N1CCc2ccccc2[C@@H]1CC(=O)NNC(=O)CCCNC(=O)OC(C)(C)C	765322741	LVZJHMVBRYAZRF-SFHVURJKSA-N	432.521	1.975	50	20	IDGD	
COc1ccc(-c2ncc(C(=O)N([C@@H]3CCS(=O)(=O)C3)N(C)C)s2)cc1OC	766369046	QMAPRXWHOHWULP-CYBMUJFWSA-N	425.532	1.933	50	20	IDGD	
O=C(CSCc1cccnc1)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	766664357	PWWVVWKNPFPHQN-UHFFFAOYSA-N	447.992	1.933	50	20	IDGD	
Cc1nc(COc2ccc(C(=O)OCC(=O)NNC(=O)Cc3ccccc3C)cc2)no1	767266308	ZJHXNGCQUULGBN-UHFFFAOYSA-N	438.440	1.812	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1C1CC1	767414024	CCITTXOEFLOBSH-UHFFFAOYSA-N	431.514	1.963	50	20	IDGD	
C[C@@H](C(=O)NNc1ccc(S(=O)(=O)C(F)F)cc1)S(=O)(=O)C1CCOCC1	767956866	BWZPEOSLCYRHGW-JTQLQIEISA-N	426.463	1.108	50	20	IDGD	
COc1ccc2c(c1)OC[C@@H](NC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)C2	768111887	LKTFKEJWDCTXJC-AWEZNQCLSA-N	434.474	1.438	50	20	IDGD	
Cc1nn(CC(=O)OC(C)C)c(C)c1C=NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	768353170	VGEVBVNBMSZYGO-UHFFFAOYSA-N	449.533	1.466	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)c1cc([N+](=O)[O-])ccc1SCCO	768635855	KCDFFDMSKAGXPY-UHFFFAOYSA-N	441.487	1.848	50	20	IDGD	
COc1ccc(C(=O)N2CCOCC2)cc1NC(=O)C(=O)NNc1c(C)cccc1F	770821636	HFKFXGUACUFACM-UHFFFAOYSA-N	430.436	1.697	50	20	IDGD	
CC[C@@H](C)NS(=O)(=O)c1ccc(C(=O)O[C@@H](C)C(=O)NNC(=O)CC(C)C)cc1	771933659	XEBTUXRRPBLJQA-KGLIPLIRSA-N	427.523	1.502	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)[C@H]1CCCN1S(=O)(=O)c1cccs1	772064691	NGSMPQWFJPIYID-CHWSQXEVSA-N	431.536	1.026	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)[C@H]1CCCN(C(=O)COc2ccccc2)C1	772147619	YJAPHRFHKFXACQ-SJORKVTESA-N	433.505	1.429	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)[C@H]3CCCC3(C)C)CC2)cc1	773388330	CPCUNZBDHIRNBR-GOSISDBHSA-N	436.578	1.275	50	20	IDGD	
COC(=O)c1cn(CCOC(=O)/C(C#N)=C/c2cc(C)n(C[C@@H]3CCCO3)c2C)nn1	774595113	VAEZCBAUJOSFET-LTXFRBGYSA-N	427.461	1.812	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)CN(C)C)ccc1NC(=O)c1cccc(S(C)(=O)=O)c1	775474195	ILDJPYJGLOOFDQ-UHFFFAOYSA-N	447.517	1.365	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)Nc1ccc(C[C@H]2NC(=O)NC2=O)cc1	775707233	OXQJCXSEFHFYIN-MRXNPFEDSA-N	425.445	1.231	50	20	IDGD	
CN(NC(=O)c1ccnc(-n2cccn2)c1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776201041	DUZQMGVWQZFHSY-UHFFFAOYSA-N	429.481	1.517	50	20	IDGD	
Cc1noc(C)c1CSCC(=O)N1CCN(S(=O)(=O)CBr)CC1	777831557	CEKPLOLLZSTNRA-UHFFFAOYSA-N	426.358	1.351	50	20	IDGD	
COc1cccc(NNC(=O)c2ccc(S(=O)(=O)N(C)C)c(Br)c2)n1	780770223	MPAGLKQNQZJCMC-UHFFFAOYSA-N	429.296	1.860	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@H]3CCC(=O)[C@@H](C)C3(C)C)CC2)cc1	780927069	QNDWPZSHWAKLAZ-UYAOXDASSA-N	428.577	1.901	50	20	IDGD	
O=C(NNc1ncncc1Cl)C1CCN(S(=O)(=O)c2cccnc2Cl)CC1	781804365	HUKRQQCRKJANOF-UHFFFAOYSA-N	431.305	1.722	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1cnn(C)c1C(F)(F)F	782124069	LQRHEOUHWYXHJD-UHFFFAOYSA-N	431.396	1.326	50	20	IDGD	
COCCn1cc(C(=O)NNC(=O)[C@H](C)Oc2cccc(Br)c2)c(C)n1	782538495	XXXUDMZYKGUHOR-LBPRGKRZSA-N	425.283	1.829	50	20	IDGD	
CNC(=O)c1cc(Oc2ccccc2NC(=O)C(=O)NNc2cc(C)nc(C)n2)ccn1	783326456	GZNLUZGMIRKXMQ-UHFFFAOYSA-N	435.444	1.722	50	20	IDGD	
COc1cc(Oc2ccccc2)ccc1NC(=O)C(=O)NN[C@@]1(C)CCS(=O)(=O)C1	783427839	QKRYOENENKQCDF-FQEVSTJZSA-N	433.486	1.624	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2cccc(Cl)c2SCC(F)F)CCS(=O)(=O)C1	783428764	XHGJFESJOJILGW-OAHLLOKOSA-N	441.909	1.834	50	20	IDGD	
O=C(Cc1csc(N2CCOCC2)n1)NN=C1CCOc2c1cc(F)cc2[N+](=O)[O-]	783810054	JWIDCEFHVHEOIT-UHFFFAOYSA-N	435.437	1.873	50	20	IDGD	
COc1ccc(I)c(NC(=O)C(=O)NNc2ccc(Cl)nn2)c1	784793040	LXQBBYRLSCNMNY-UHFFFAOYSA-N	447.620	1.825	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)C(=O)Nc2ccc([S@@](=O)C(F)(F)F)cc2)c1	784844201	IZBGYUCYUCJYME-MUUNZHRXSA-N	449.432	1.799	50	20	IDGD	
CCc1noc(-c2cc(Cl)ccc2NC(=O)C(=O)NNc2ccnc(N(C)C)n2)n1	784969350	LCZZSJXIQFZGAN-UHFFFAOYSA-N	430.856	1.890	50	20	IDGD	
CC[C@@]1(C)Oc2ccc(NC(=O)C(=O)NNC(=O)c3cncc(NC(C)=O)c3)cc2O1	785990243	DBDPRYIIXWDSBW-FQEVSTJZSA-N	427.417	1.337	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2cccnc2-c2cnn(C)c2)c2ccccc2c1=O	786206424	AKNLZOIGMNBZLW-UHFFFAOYSA-N	432.444	1.678	50	20	IDGD	
O=C(COC(=O)CCc1nnc(C2CCCC2)o1)NNC(=O)[C@H]1COc2ccccc2O1	786747125	AZBBYNXNPRDUCB-MRXNPFEDSA-N	444.444	1.190	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(-c2ccsc2)nn1C	787540575	AQHGYRUABHLIEZ-UHFFFAOYSA-N	443.485	1.712	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)Cc2ccc(Cl)cc2)cccc1N1CCNC1=O	787544412	RLQBSPQQLLPNRG-UHFFFAOYSA-N	429.864	1.507	50	20	IDGD	
CS(=O)(=O)c1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2F)ccc1Cl	788330884	MWCQQEMTRUQPMD-UHFFFAOYSA-N	443.840	1.048	50	20	IDGD	
CCC(=O)c1ccc(OCCCCC(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)cc1	788500930	DCTCLLUBLUPNIX-HNNXBMFYSA-N	425.507	1.346	50	20	IDGD	
O=C(NNc1nnc(-c2ccccn2)s1)[C@H]1CC(=O)N(c2ccc3c(c2)OCCO3)C1	788557982	CZHJSPFSXAPSKD-LBPRGKRZSA-N	438.469	1.868	50	20	IDGD	
COc1ccc(OC)c(S(=O)(=O)N2CCN(C(=O)NCCSSC)CC2)c1	790877164	VSZYNVWEZYMLQN-UHFFFAOYSA-N	435.593	1.731	50	20	IDGD	
CCOC(=O)c1csc([C@@H]2CCCN2CC(=O)NNC(=O)c2cccc(C#N)c2)n1	792471346	STQBGZGOMNERKC-INIZCTEOSA-N	427.486	1.790	50	20	IDGD	
COc1ccc(Cn2cc(NC(=O)C(=O)NNC(=O)c3c[nH]c4ccccc34)cn2)cc1	793023081	HFFMQVGGCUZTTO-UHFFFAOYSA-N	432.440	1.821	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)[C@H](C#N)Cc1ccc(C#N)cc1	795827602	ZWBURQNNIQCXRJ-HNNXBMFYSA-N	440.843	1.907	50	20	IDGD	
CCOc1cccc(S(=O)(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)c1	799914184	GAPMRFXMHFHXNN-UHFFFAOYSA-N	430.486	1.999	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(C(=O)NNC(=O)Nc2ccc(Br)cc2)n(C)c1	801995104	YKDHOWCQCNMKLW-UHFFFAOYSA-N	444.311	1.504	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)C2(n3cccn3)CCN(C(=O)OC(C)(C)C)CC2)nc1	802893143	BHHXJLGJQGQBLH-UHFFFAOYSA-N	444.492	1.934	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)NCc1ccncc1OC[C@H]1CCOC1	807615567	IQEGNRHGWUAAFU-AWEZNQCLSA-N	445.432	1.315	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)NCc1ccncc1OC[C@@H]1CCOC1	807616115	OEAMENODMDSNNQ-OAHLLOKOSA-N	425.445	1.278	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)[C@@H]2C[C@@H](c3ccccc3)OC2=O)cc1OC	808585639	IEXGACLLEMQFOL-RDJZCZTQSA-N	442.424	1.312	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(Cl)c(Cl)c1)NNc1nc(-c2ccncc2)no1	810310254	OFUKSILKXSPNKO-UHFFFAOYSA-N	443.272	1.860	50	20	IDGD	
CC(C)(C)c1ccc(C(=O)NNC(=O)C(=O)Nc2ccccc2-n2cnc(C#N)n2)cc1	810386395	XIHRPDYEFMZRKR-UHFFFAOYSA-N	431.456	1.836	50	20	IDGD	
Cc1nc(-c2cccnc2)nc(NNC(=O)CNS(=O)(=O)c2ccc(C#N)cc2)c1C	810421716	MVADTHXDIBGUCX-UHFFFAOYSA-N	437.485	1.449	50	20	IDGD	
CCCNC(=O)c1cccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)c1	813033092	DYTAPZNCQPQFSS-UHFFFAOYSA-N	447.517	1.159	50	20	IDGD	
CCOc1ccc(OC)cc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	813033624	CDMXHEQOALZUHE-UHFFFAOYSA-N	436.490	1.426	50	20	IDGD	
Cc1cc(C)nc(-n2nc(C)cc2NC(=O)NNc2ccccc2S(=O)(=O)N(C)C)n1	814519241	TYRWVDWVOUARFS-UHFFFAOYSA-N	444.521	1.986	50	20	IDGD	
CCOC(=O)c1cc(COC)cc(NC(=O)C(=O)NNC(=O)Cc2ccc(F)cc2)c1	815566753	DISKNLCWJFIZMR-UHFFFAOYSA-N	431.420	1.477	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)[C@H]2CCCCN2S(=O)(=O)c2ccccc2)cc1	825536035	KILAXFOCOXRWLL-LJQANCHMSA-N	446.529	1.498	50	20	IDGD	
C=CCNC(=S)NNC(=O)CNS(=O)(=O)c1cc(C(F)(F)F)ccc1Cl	913435501	MWYJYXHUWGCGGR-UHFFFAOYSA-N	430.861	1.318	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)[C@@H]1CC(=O)N(C2CCCCC2)C1	914708157	LWVSPMJLWREUTF-LJQANCHMSA-N	441.576	1.527	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)c2nnc(O)c3ccccc23)c1	914750620	QVTRTFQJAJNALQ-UHFFFAOYSA-N	447.448	1.236	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)c1csc(N2CCOCC2)n1)N1CCc2ccccc21	914828104	PQQPYAGQURSGCF-CQSZACIVSA-N	430.534	1.375	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@H](c2ccco2)N2CCCCC2)c1	915896003	UJBCHAHBHIGUHL-QGZVFWFLSA-N	434.518	1.854	50	20	IDGD	
CC(=NNC(=O)c1c(C)nc2ccccn12)c1ccc(S(=O)(=O)NCC(=O)O)cc1	915931056	FAHFDKRNUMZZRJ-UHFFFAOYSA-N	429.458	1.160	50	20	IDGD	
Cc1nn(-c2ccc(F)cc2F)c(C)c1C=NNC(=O)CSc1nnc(O)nc1O	915957365	JQIZUGVTAPWANE-UHFFFAOYSA-N	435.416	1.606	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)N[C@H](C)c3cccc(S(N)(=O)=O)c3)n[nH]2)cc1	916197506	VQTAZVCIDTUTML-CYBMUJFWSA-N	442.501	1.738	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NCc2ccc(N(C)C)nc2)c2ccccc2c1=O	916444126	KUCRXNCQAYSSBB-UHFFFAOYSA-N	437.504	1.802	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)NCCCN1CCN(c2ccccc2)CC1	916488965	KJONPAYKYPRGAZ-UHFFFAOYSA-N	436.516	1.480	50	20	IDGD	
C[C@H]1C[C@H](C)CN(CCCCNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)C1	916506124	YKTLSZSCXCOUFL-HOTGVXAUSA-N	438.598	1.682	50	20	IDGD	
CCOc1ccc(/C=C(/C#N)C(=O)OCC(=O)Nc2ccc(S(N)(=O)=O)cc2)cc1	916597746	WKDSBEZVKOQXBP-PTNGSMBKSA-N	429.454	1.822	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCCNc2ncccc2C#N)nc1	916641233	KQWCHROQWNMLEK-UHFFFAOYSA-N	432.510	1.117	50	20	IDGD	
C[C@H](NC(=O)c1ccc(Br)s1)C(=O)NNC(=O)c1ccc2c(c1)OCO2	916728394	GWAHQJJXDKLYOM-QMMMGPOBSA-N	440.275	1.819	50	20	IDGD	
CC(C)[C@H](NS(=O)(=O)c1ccc(Br)cc1)C(=O)NNC(=O)C(C)(C)C	917180445	UVLPLWPWUCWOEJ-ZDUSSCGKSA-N	434.356	1.946	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2c(C)cccc2[N+](=O)[O-])cc(OC)c1OC	917717181	AKZCDHJXJUTSDM-UHFFFAOYSA-N	425.419	1.552	50	20	IDGD	
COC(=O)c1ccc(Br)c(S(=O)(=O)NNC(=O)c2ccc(C)cc2O)c1	917753601	JQGNJUPKYCXYFJ-UHFFFAOYSA-N	443.275	1.873	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCc2cccnc2-n2ccnc2C)c2ccccc2c1=O	919778790	DKOGQJJONJWTTR-UHFFFAOYSA-N	446.471	1.450	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)NCC[C@](O)(c1nccn1C)C(F)(F)F	920045179	VNEWKDPEEISDSR-KRWDZBQOSA-N	429.399	1.142	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCC2CC2)cc1S(=O)(=O)N[C@@H]1CCCC[C@H]1C	920859276	UQTVRJWGQIXOKT-CZUORRHYSA-N	438.550	1.906	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)CN2C(=O)c3ccccc3S2(=O)=O)c1	921188280	QFXRIHOXUIVBES-UHFFFAOYSA-N	445.497	1.489	50	20	IDGD	
N#C/C(=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)N1CC(O)(C2CC2)C1	1320784067	YIEQEBQSQSFYPD-OQLLNIDSSA-N	439.903	1.969	50	20	IDGD	
CC1(C)C(=O)N(C[C@@](C)(O)C(=O)NNC(=O)c2cncn2-c2ccccc2)c2ccccc21	1320884069	NBIFDEQISRYOGD-XMMPIXPASA-N	447.495	1.709	50	20	IDGD	
O=C(NCCC1CCOCC1)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	1321839420	NLSIDBZKKYGAAB-UHFFFAOYSA-N	438.550	1.622	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2nnc3cc(C)nn3c2C)C1	1778562487	CYHFOCXORRPYON-WHSLLNHNSA-N	448.955	1.886	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4ncnn4c3)C2)C1	1778735506	ARMHMTCZBLOSOD-ACJLOTCBSA-N	436.310	1.204	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccn4nccc4c3)C2)C1	1778740533	SGDUXCSNZQTLFU-QFBILLFUSA-N	435.322	1.951	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc4cn[nH]c4cn3)C2)C1	1778770593	ZALDYIIGWVOYRX-KPZWWZAWSA-N	436.310	1.432	50	20	IDGD	
COc1c(Cl)ccnc1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2	1780327746	AXIJIVDQDMGBNM-DIFFPNOSSA-N	446.729	1.971	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)c(O)c1	1780551506	YGNFJDCELDCGGO-ORAYPTAESA-N	441.322	1.875	50	20	IDGD	
CCOc1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](F)Br)C3)C2)nn1	1781333243	FIBXVDAUDQMQIS-BBRMVZONSA-N	431.262	1.009	50	20	IDGD	
O=C(c1cnc2ccc(F)cn12)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781333879	TTYFAWGYIQSLBB-YOEHRIQHSA-N	443.248	1.607	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1[nH]nc3ncccc13)C2	1782172910	QHIMNPIGMPHMHS-STXHMFSFSA-N	435.912	1.339	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4nn[nH]c4c3)C2)C1	1782582708	HFAMIARRMOBWCV-MSOLQXFVSA-N	426.304	1.638	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cccn4ccnc34)CCO2)C1	1783349222	KCADEYGJYJXISA-HNAYVOBHSA-N	435.322	1.951	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](C)Br)C3)C2)cc1	1783536904	HXWJTZXPSXQNQW-DJJJIMSYSA-N	438.322	1.872	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(OCCCO)cc3)CCO2)C1	1783883152	VILHJBBRKDAAAO-RXVVDRJESA-N	440.924	1.145	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cccc(F)c1Cl)CCO2	1783935848	YISZTQRKFLGTRD-HXUWFJFHSA-N	440.903	1.296	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(Cl)nn3)C[C@@H]21	1783970602	XGBFIYWEXDYITL-UHXUPSOCSA-N	445.745	1.754	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccccc3C(F)(F)F)C[C@@H]21)[C@H](O)CCl	1784093234	SLPMIAPYFPNGMU-YUDUHTQSSA-N	434.842	1.898	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3cncc(OC)c3)[C@H]2C1	1785269297	WJOLEYICPOZFOU-WNHJNPCNSA-N	439.940	1.256	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Cl)C[C@@H]21)c1ccc(OCCCO)cc1	1789236075	XVZMOZUDMYUCIT-LEUOFYLZSA-N	428.888	1.576	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC1(c2ccc(NC(=O)c3ccc(CO)o3)cc2)CCC1	1789762963	OTHWCUOHIBSISM-UHFFFAOYSA-N	449.467	1.832	50	20	IDGD	
Cc1nccn1CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)CBr)C[C@@H]21	1790646523	LFGHQPQXDLUGCT-TUUVXOQKSA-N	427.343	1.202	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(OC)nn3)C[C@@H]21	1790961278	XXQRRZXASKYKGX-ABHRYQDASA-N	441.326	1.252	50	20	IDGD	
CC(=O)O[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)Br)[C@H]2C1)C(C)C	1791055928	KSPRNEVPAZQCAB-VLVIQNCWSA-N	433.343	1.337	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](N)c3cccc(Cl)c3)C[C@@H]21	1791251772	VMMYJJOEKBDUOT-PEJOBZMASA-N	444.359	1.573	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COCc1ccccc1)C2	1792868392	XVKAGDRQAVVAKW-VYCZESIESA-N	439.350	1.824	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nc3cc([N+](=O)[O-])ccc3[nH]1)C2)[C@@H](F)Cl	1796366965	QEGGYLMSYGCHSF-HZZFPTLFSA-N	425.804	1.209	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1c[nH]c2ncccc12	1796880367	YDNPFKQKORHHIA-VZAMPYOESA-N	435.322	1.940	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(OC2CCOCC2)n1)[C@@H](O)CCl	1799059482	NXQJOTSZHRFZJY-KRXQYRFLSA-N	437.924	1.491	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(CCN3CCCC3)nc1)C2	1799270105	QAAZICGUYOCFLU-YHELAOLJSA-N	448.995	1.941	50	20	IDGD	
COc1ccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@](C)(Cl)CCl)cc1O	1799273477	IPILVYJYRXSZIG-ZZXMYQEDSA-N	445.343	1.769	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Br)o1	1799349957	OPHHQWBMQUZBKN-RDBQEKCUSA-N	432.246	1.132	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1cn2c(F)cccc2n1	1799999581	MKKHNQWJONJVAZ-ANGCBRKESA-N	443.248	1.367	50	20	IDGD	
COc1ncc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)Br)cc1F	1800757679	IISOKRRVBQUWJY-SGESHTKJSA-N	430.274	1.216	50	20	IDGD	
COC(=O)N(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2)Cc1ccccc1	1800851784	TVYDYCVIKUPXSO-MVJTYMMSSA-N	441.887	1.379	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCCCCC(C)(C)C)C2	1801013048	RWKRSLNZRLLOOA-OPMZPASUSA-N	438.613	1.946	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnc2c(c1)CCNCC2	1801310947	CQVRTUGPNOQURA-SJWGOKEGSA-N	435.366	1.805	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@H]1CCN(C(=O)c2ccnnc2O)[C@H]1c1cccnc1	1803013565	DZHZMRKEWZZHHX-XPKDYRNWSA-N	448.321	1.928	50	20	IDGD	
COc1ccc(F)cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc(B(O)O)c1)C2	1803606307	MJASLBGEYRGBMC-BCDXTJNWSA-N	426.253	1.080	50	20	IDGD	
CS(=O)(=O)c1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](O)CCl)C3)cc1F	1803882635	KBELVVICVTVDQI-XFMPKHEZSA-N	432.901	1.081	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2cn(C)nc2OC)[C@@H]1c1cccnc1	1805308902	WPBBTIGOJAZHJF-XIRDDKMYSA-N	435.912	1.397	50	20	IDGD	
Cc1ncccc1C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1805494341	BPUSFUXNTSIIAP-UGKGYDQZSA-N	444.300	1.098	50	20	IDGD	
CC(C)Cc1cc(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)n(C)n1	1807841443	DRDSCBVNDVSJJC-VDGAXYAQSA-N	447.967	1.933	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)C(C)(C)C#N)[C@H]1c1cccnc1	1808410613	VFDOFGSUXDQXTQ-UKVGILNFSA-N	449.515	1.771	50	20	IDGD	
CO[C@@H](C(=O)N1CCCC2(CCN(C(=O)CCC(=O)NN(C)C)CC2)C1)c1ccccc1	1809156077	LQDHOCNSKAPKJW-JOCHJYFZSA-N	444.576	1.978	50	20	IDGD	
CC(C)c1nc(C(=O)N2CCC3(CCCN(C(=O)c4cccc(B(O)O)c4)C3)CC2)co1	1809975027	PHUDTJQXEQGDRU-UHFFFAOYSA-N	439.321	1.636	50	20	IDGD	
N#CC1(C(=O)N2CC[C@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)CCC1	1810309419	QWPFHTGNFBVQTN-VQIMIIECSA-N	447.499	1.094	50	20	IDGD	
Cc1nnc(CC(=O)N2CC[C@@H](CNC(=O)CO[Si](C)(C)C)[C@@H]2c2cccnc2)o1	1810541637	LIWLTALTVFVCFI-JXFKEZNVSA-N	431.569	1.873	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2nc3ncccn3n2)[C@H]1c1cccnc1)C(Cl)Cl	1813078794	AFSCRPRQHQCNNB-STQMWFEESA-N	434.287	1.643	50	20	IDGD	
CCNC(=S)NCC(=O)N1CC[C@H](CNC(=O)C(Cl)Cl)[C@@H]1c1cccnc1	1813081137	JDQHIRXXMRYFAH-OCCSQVGLSA-N	432.377	1.375	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)[C@@H](C)Cn2ccnc2)[C@@H]1c1cccnc1	1813416857	JCCCFJRJYDIVST-NQYYFHDYSA-N	433.940	1.874	50	20	IDGD	
Cc1cc2nnc(C(=O)N3CCCC[C@@H]3c3cc(NC(=O)[C@H](O)CCl)n[nH]3)c(C)n2n1	1814870748	BMCZMFVFJDCUEN-ZIAGYGMSSA-N	446.899	1.370	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](C)CBr)CC2	1817292627	LXHUUAKATMEBPQ-FOGDFJRCSA-N	445.383	1.953	50	20	IDGD	
COc1ccccc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1	1817472413	INSOQJYBXIDKIY-LJQANCHMSA-N	448.288	1.718	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(CO)on2)[nH]n1)[C@H](F)Br	1820939020	DBYFDMWLRDINIJ-AAEUAGOBSA-N	430.234	1.886	50	20	IDGD	
CCNC(=S)NCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](Cl)COC)[nH]n1	1821646421	YAKADNDUEFEVQM-AAEUAGOBSA-N	430.962	1.140	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)[C@@H]1[C@H]2C=CS[C@@H]21	1821706741	GQEBPYQSTZFQLC-HYEGPXJVSA-N	438.318	1.271	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H](O)CCl)CC1	1824186042	NTIALDLKPFQDLM-JKSUJKDBSA-N	431.961	1.731	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1c[nH]c(=O)cn1)CC2	1825450699	UEAGUWRPZDOLHH-IUCAKERBSA-N	440.323	1.626	50	20	IDGD	
Cc1oncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1	1826029609	YKZVPJLEYBXLNJ-LJQANCHMSA-N	440.504	1.529	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(F)cn1)CC2	1826080702	UOOLFQRFOUNXSZ-LBPRGKRZSA-N	434.497	1.276	50	20	IDGD	
CC(C)O[C@@H](C)C(=O)N[C@@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1	1826088077	RDWZUKFUMRSUEB-QWHCGFSZSA-N	425.555	1.242	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC([C@@H]2CCCCN2C(=O)CC[C@H](N)C(N)=O)CC1	1826936686	ZBIKJBFCXBXOCV-IRXDYDNUSA-N	426.634	1.050	50	20	IDGD	
Cc1ncncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827057374	DFAVETNLHZAXCN-OAQYLSRUSA-N	436.321	1.012	50	20	IDGD	
CN[C@@H](CC(=O)N1CCC([C@H]2CCCCN2C(=O)CO[Si](C)(C)C)CC1)C(=O)O	1829102469	RPNRZBHFQDOZDC-DLBZAZTESA-N	427.618	1.520	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3ccc(C#N)cc3)CCO2)C1	1829634337	LFKGTUJDFLXEQM-SIKLNZKXSA-N	433.936	1.965	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)COC(C)(C)C)C2)C1	1830535642	ROQGDIXVNUBHKS-RDTXWAMCSA-N	435.359	1.289	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(F)cn3C)C2)C1	1830538592	KNQRQFSWEDEUCS-FZKQIMNGSA-N	446.317	1.265	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cscn3)C2)C1	1830538997	YDFUULFOCIUEHN-GUYCJALGSA-N	446.367	1.173	50	20	IDGD	
Cc1cccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)c1Cl	1830737302	GZZUIAXZHCXRDV-BEFAXECRSA-N	431.316	1.318	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H]2CNC(=O)C2)CC1	1831421492	YVKIIPRTTIDUDY-PMPSAXMXSA-N	428.371	1.916	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4c(c3)CNC4=O)C2)C1	1831649726	AXLZKQAAVOSNIO-PGRDOPGGSA-N	449.935	1.408	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4cn[nH]c4cn3)C2)C1	1831649842	BZUJVZTVQBHTRP-MGPUTAFESA-N	435.912	1.435	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CN2CCNC2=N)CC1	1831650517	LSCIBXVEJVKOQV-UKRRQHHQSA-N	428.375	1.229	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(Cl)ncn3)C2)C1	1831654427	KTRKVIGAKWQZKD-UGSOOPFHSA-N	431.320	1.608	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H]2CCCS2(=O)=O)CC1	1831657242	UWIABWKUGKJAOH-IMJJTQAJSA-N	449.411	1.967	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)C(=O)OCC)C2)C1	1831659291	QGUODYRJIRLFGS-QRWLVFNGSA-N	432.945	1.440	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](CC)N(CC)CC)CCO2	1831662169	NMNWFNFXOWNSKG-BBTUJRGHSA-N	432.005	1.971	50	20	IDGD	
CC(=O)C[C@H](C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1	1831801013	YXUBXQLNACZBMN-YWZLYKJASA-N	443.548	1.534	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)[C@H](CC)NC(C)=O)CC2)CC1	1833529950	KGOFBSNPJKMPRP-MOPGFXCFSA-N	429.005	1.880	50	20	IDGD	
Cc1noc(C)c1C(=O)N1CCO[C@@]2(COCCN(C(=O)CCBr)C2)C1	1834063048	YJAKNHQKPTYFOG-QGZVFWFLSA-N	430.299	1.146	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)C3(F)CC3)CC2)CC1	1835117600	BYHSLISMMRFPAK-CVKSISIWSA-N	446.527	1.194	50	20	IDGD	
Cc1nc(CC(=O)N2CCOC[C@@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)cs1	1837710173	MHFZPPIYNPZIKC-IBGZPJMESA-N	441.626	1.302	50	20	IDGD	
COCCOCC(=O)N1CCC(OC2CCN(C(=O)[C@@H](C)Br)CC2)CC1	1837769197	NBOHPRSHTMHMRX-CQSZACIVSA-N	435.359	1.431	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)c(C)n1	1838363868	RENGDBOAISYZRE-CRAIPNDOSA-N	444.301	1.459	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3ccc([N+](=O)[O-])[nH]3)CC2)CC1	1838558887	AZOYJTDTHYYYBM-OAHLLOKOSA-N	442.900	1.789	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)/C=C/C3CCCC3)CCO2)C1	1839179484	GRWOEWBNFRNEFJ-QLHUVDSISA-N	429.355	1.973	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccccc3O)C2)C1	1839962886	UMMROGMTIUXJIP-DNVCBOLYSA-N	441.322	1.636	50	20	IDGD	
C=CCC(F)(F)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H](Br)CC)CCO2)C1	1839966925	UNQJHSSCRWOVTJ-BBRMVZONSA-N	439.297	1.828	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4c(s3)CCC4)C2)C1	1840150227	IAESITOGLQBXSP-FOIQADDNSA-N	442.965	1.561	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC12CN(C(=O)CN1C(=O)CSC1=S)C2	1841290153	QRENAPJNWBZOHK-SNVBAGLBSA-N	434.381	1.081	50	20	IDGD	
O=C(c1cc(=O)c(OCc2ccccc2)c[nH]1)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1	1841349988	AYNDXTZXCDCKNG-SFHVURJKSA-N	445.903	1.371	50	20	IDGD	
CC(=O)C[C@@H](C)C(=O)N1CC2(CCCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C1	1841925338	MQUINDWXYREPRT-HIFRSBDPSA-N	429.945	1.937	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)c1ccc(O)nc1)C2	1844692757	GZVUSUITBFMTQK-UHFFFAOYSA-N	440.412	1.752	50	20	IDGD	
COc1ccc(C2(C(=O)N3CCCC34CN(C(=O)CCC(=O)NN(C)C)C4)CCC2)cc1	1845162417	KTZFJFWNDARMTD-UHFFFAOYSA-N	442.560	1.693	50	20	IDGD	
O=C([C@@H](F)Br)N1CC2(CCCN2C(=O)c2cnc3c(c2)CCNCC3)C1	1845797662	GVJZCLGPUWMGLM-OAHLLOKOSA-N	425.302	1.277	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CNC(=O)c1cccs1	1847495449	HQBPHRKYLGEIED-AGIUHOORSA-N	428.352	1.711	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)Nc2cccc(Cl)c2)c1)C(=O)NC1CC1	10214438	PAYRBKSZEOVEIX-UHFFFAOYSA-N	436.877	1.180	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cnn(-c3ccccc3)c2C)cc1OC	12583935	XFNWGGUOBRNMKD-UHFFFAOYSA-N	438.440	1.816	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2ccc(Cl)c(S(C)(=O)=O)c2)cc(OC)c1OC	15792659	BCVKGUXPYHJPHF-UHFFFAOYSA-N	442.877	1.844	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)[C@H](CC(C)C)N1C(=O)[C@H]2CC=CC[C@@H]2C1=O	15879858	ZETSQZQEUOVHOB-ULQDDVLXSA-N	443.500	1.587	50	20	IDGD	
C[C@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)NNC(=S)NCCc2cccs2)C1=O	21124404	JYVXGQRPYGVZPO-LJQANCHMSA-N	449.533	1.392	50	20	IDGD	
Cc1cc(Cl)ccc1OCCCC(=O)NNC(=O)CN1C(=O)[C@H]2CC=CC[C@H]2C1=O	21768945	SEGDHYQQFSLQAC-IYBDPMFKSA-N	433.892	1.906	50	20	IDGD	
O=C(CSc1n[nH]c(=O)n1CCc1ccccc1)NNC(=O)c1ccc([N+](=O)[O-])cc1	26267574	SKRADECVRDBOSR-UHFFFAOYSA-N	442.457	1.276	50	20	IDGD	
COc1ccc(CN(C)CC(=O)NNC(=O)Cc2nc(C)cs2)cc1OC(F)F	26453386	TUCSIAURQNIREJ-UHFFFAOYSA-N	428.461	1.883	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CCc2c(C)nn(CCC#N)c2C)cc(OC)c1OC	46543935	UMBOZLOGMPDJPD-UHFFFAOYSA-N	429.477	1.833	50	20	IDGD	
CSCC[C@@H](NC(=O)c1cccc(C)c1)C(=O)NNC(=O)CNC(=O)c1ccco1	725739949	PFBDQCNTIYLYNQ-OAHLLOKOSA-N	432.502	1.017	50	20	IDGD	
COc1ccccc1[C@@H](CNC(=O)NNC(=O)CNC(=O)c1ccco1)N1CCCCC1	726104646	UIOOAQCBJZGPHZ-QGZVFWFLSA-N	443.504	1.576	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NCCCc2nc3c(s2)CCCC3)c2ccccc2c1=O	727231041	YXAWBVWMTYDJLJ-UHFFFAOYSA-N	440.529	1.846	50	20	IDGD	
CCC(=O)N[C@H](CCSC)C(=O)NNC(=O)c1cc(OC)ccc1Br	728526482	WVMPBNJPRVQNQU-CYBMUJFWSA-N	432.340	1.867	50	20	IDGD	
CN(C)CCCOc1ccc(CNC(=O)NNC(=O)c2nnc(O)c3ccccc23)cc1	728751529	GCTRSAYUXHNPQE-UHFFFAOYSA-N	438.488	1.810	50	20	IDGD	
C=CCn1c(=O)c2ccccc2n2c(SCC(=O)NNC(=O)Cc3cccnc3)nnc12	728892665	BOCFFIGXXFYTAI-UHFFFAOYSA-N	449.496	1.107	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)N1CCN(C(=O)c2ccccc2OC(F)F)CC1	728957535	XHGKDYDLWYNOIL-UHFFFAOYSA-N	433.415	1.424	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)c1ccc(OCC(F)(F)C(F)F)nc1	729167625	NEUDSCVBZDRYNO-CYBMUJFWSA-N	429.326	1.962	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)[C@@H]1CCCN(S(=O)(=O)Cc2ccccc2)C1	730514645	BZEWVEHYRRUGIT-GOSISDBHSA-N	433.505	1.758	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCN(c2ccc3c(c2)OCCO3)C1=O)c1cc(-c2ccccc2)on1	730520423	GSQUKXZJMROCMW-MRXNPFEDSA-N	448.435	1.927	50	20	IDGD	
COc1ccc(-c2nnc(S)n2CCC(=O)NNC(=O)COc2ccccc2O)cc1	730835545	IHBBGFNVHLWHIZ-UHFFFAOYSA-N	443.485	1.565	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])c1	731050962	RUPSWQJEJLJXOY-UHFFFAOYSA-N	436.808	1.456	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccccc1	732303632	KIIFLESAPXMTCN-KRWDZBQOSA-N	437.543	1.777	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)NCc1ccc(N(C)S(C)(=O)=O)cc1	732475393	DPNPBOSKQZMSRQ-CYBMUJFWSA-N	438.481	1.519	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)c2ccc(S(C)(=O)=O)o2)cc1	733124180	VTJHTHOJARHXSB-UHFFFAOYSA-N	435.487	1.179	50	20	IDGD	
O=C(NNc1ncccc1Cl)c1ccc2c(c1)S(=O)(=O)N(C[C@@H]1CCCO1)C2=O	734247733	YGSFRALPBRCVGR-LBPRGKRZSA-N	436.877	1.815	50	20	IDGD	
C[C@@H]1CN(S(=O)(=O)c2cccc(C(=O)NNc3nccnc3Cl)c2)C[C@@H](C)O1	734261074	OTHUQJXVTVFQEC-VXGBXAGGSA-N	425.898	1.685	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)[C@@H]2CCCc3ccccc32)CC1	735117720	HAJHXRQGBZAQTQ-GOSISDBHSA-N	429.546	1.581	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)NCc1ccc(N2CCC(CO)CC2)cc1	738496116	NUBBZKQCHYTLAL-UHFFFAOYSA-N	426.517	1.943	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNS(=O)(=O)c2ccc(N3CCOC3=O)cc2)cc1	740809938	LTTYZHLLBXMJAY-CQSZACIVSA-N	449.485	1.819	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)c1cc(S(=O)(=O)NC(C)(C)C)ccc1C	740850816	APNOVLPSUVIQLB-UHFFFAOYSA-N	426.539	1.138	50	20	IDGD	
C#CCOc1ccc(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)cc1	743333985	BYZCRHWIHPJBKX-UHFFFAOYSA-N	428.514	1.392	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)c2ccc(S(=O)(=O)C(F)F)cc2)c1	744459817	FKDJBQLPALKZTN-UHFFFAOYSA-N	426.397	1.609	50	20	IDGD	
Cc1ccc([C@H](CNC(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)N2CCOCC2)cc1	745682825	RVSBVPARUOOSDS-SFHVURJKSA-N	443.460	1.626	50	20	IDGD	
COc1ccnc(NNC(=O)NCc2cccnc2Oc2cccc(S(C)(=O)=O)c2)n1	745841030	WQKMFSAJGKQTIT-UHFFFAOYSA-N	444.473	1.902	50	20	IDGD	
CCN1CCN(C[C@H](C)CNC(=O)NNC(=O)c2cccc(Br)c2)CC1	745861264	AWKMIFWDYRJUNP-CQSZACIVSA-N	426.359	1.667	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NCC(C)(C)C(=O)NCC)c2ccccc2c1=O	746328837	TUVUIKIGRGKLBF-UHFFFAOYSA-N	430.509	1.303	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNS(=O)(=O)c2cc(C(=O)O)c(F)cc2Cl)c1	746352528	PATLXULQTKAGAV-UHFFFAOYSA-N	432.813	1.818	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCCc1cn2cccc(C)c2n1	746776783	XYISKOOURBGNNI-UHFFFAOYSA-N	443.533	1.431	50	20	IDGD	
O=C(NCCOc1ncccc1C(F)(F)F)NNC(=O)[C@H]1COc2ccccc2O1	746796587	SGCPKONECRVQPP-CQSZACIVSA-N	426.351	1.650	50	20	IDGD	
N#Cc1csc(C=NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1	748075732	XLYHBTFJGPINCW-UHFFFAOYSA-N	432.527	1.724	50	20	IDGD	
CCc1cc(N2CCC(NC(=O)NNC(=O)c3cc([N+](=O)[O-])ccc3O)CC2)ncn1	748664492	WGJKSCWKFQKIGO-UHFFFAOYSA-N	429.437	1.266	50	20	IDGD	
CCOC(=O)C1CCN(S(=O)(=O)NNC(=O)c2cc3c(s2)CCCCC3)CC1	748673947	IHWRTAQTRGAZAC-UHFFFAOYSA-N	429.564	1.771	50	20	IDGD	
CCc1ccccc1OCC(=O)NNS(=O)(=O)c1cc(OC)c(C(=O)O)cc1Cl	749141998	MCKMRWBBYZSPQJ-UHFFFAOYSA-N	442.877	1.998	50	20	IDGD	
Cn1ccnc1[C@@](O)(CCNC(=O)NNC(=O)c1cc2ccccc2o1)C(F)(F)F	749548612	WYAIGMDXABUAEC-KRWDZBQOSA-N	425.367	1.951	50	20	IDGD	
COC[C@@H](C)n1c(C)cc(/C=C(\C#N)C(=O)NNC(=O)CNC(=O)c2ccco2)c1C	751204929	SMJFSUXUDDNLGT-IREQLNLFSA-N	427.461	1.390	50	20	IDGD	
O=C(NNS(=O)(=O)c1cnn([C@H]2CCOC2)c1)c1ccc(COc2ccccc2)o1	751538847	PNSBCLNCOLIGMB-AWEZNQCLSA-N	432.458	1.640	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)c1cccc2nc(O)oc12	752127756	SBNKCZSMJGTMAA-UHFFFAOYSA-N	443.891	1.766	50	20	IDGD	
N#Cc1csc(C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1	752268935	SHZFJNVMBWHCHP-UHFFFAOYSA-N	448.526	1.034	50	20	IDGD	
CC[C@H](NC(=O)NNC(=O)[C@H](C)Oc1ccc2ccccc2c1)C(=O)N1CCOCC1	753057049	KOABKBXOCICDOC-KXBFYZLASA-N	428.489	1.575	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)Nc1ccc(NC(=O)[C@@H]2CCCO2)cc1	755640494	HWQFANSYNNKJDA-INIZCTEOSA-N	436.428	1.919	50	20	IDGD	
COc1ccc(C(=O)N2CCOCC2)cc1NC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	756256259	GJVQSNMAEQFUDB-UHFFFAOYSA-N	443.416	1.542	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)[C@](C)(O)CN1Cc2ccccc2C1=O	756882745	ZKBYOVZQFIRHKI-OAQYLSRUSA-N	429.498	1.342	50	20	IDGD	
O=C(NCc1ccc2c(c1)CCS2(=O)=O)NNC(=O)c1ccc(Br)s1	757727170	NAEDDMOQCHBXJX-UHFFFAOYSA-N	444.332	1.985	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)c2cncc(I)c2)c1	757735904	UGYXQWQAOSKDMH-UHFFFAOYSA-N	426.214	1.568	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)COc1ccc(Cl)cc1C1CCCCC1	758034973	JBIJTAHDXRUYSV-LBPRGKRZSA-N	431.942	1.852	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc2c3c(c1)CCC(=O)N3CCC2)c1cc([N+](=O)[O-])ccc1O	758168062	KYPUGWWEVALKMS-UHFFFAOYSA-N	446.441	1.149	50	20	IDGD	
O=C(NNC(=O)c1cc(F)ccc1I)C(=O)Nc1ccccn1	758835369	ZCYFXFLNFASEOE-UHFFFAOYSA-N	428.161	1.225	50	20	IDGD	
CCO[C@@H]1COCC[C@H]1NC(=O)NNC(=O)[C@H](C)Oc1cccc(Br)c1	759217830	XKMDUCUBJUNQES-NILFDRSVSA-N	430.299	1.741	50	20	IDGD	
COC[C@@H](C)n1c(C)cc(/C=C(/C#N)C(=O)N2CCC3(CC2)NC(=O)N(C)C3=O)c1C	759621361	HNVOZCPBPVKPGP-JQFNYASXSA-N	427.505	1.762	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(Br)c([N+](=O)[O-])c1)c1cccc([N+](=O)[O-])c1	760337190	LKHWODYEDGTNRV-UHFFFAOYSA-N	445.207	1.889	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)[C@H]1CC(=O)N(c2ccc(Cl)c(F)c2)C1	760437078	BIDJAUCLCMHJQQ-NSHDSACASA-N	442.875	1.894	50	20	IDGD	
O=C(NNC(=O)c1ccccc1O)C(=O)Nc1ccc(CCN2CCSCC2)cc1	763528749	SLCUODWOTQIBBI-UHFFFAOYSA-N	428.514	1.383	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(Cl)c(C#N)c2)cc(OC)c1OC	763539502	MLPNEJUGUBMCBB-UHFFFAOYSA-N	432.820	1.637	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)cc1Cl	763550821	HIVHAYKGTOVLKU-UHFFFAOYSA-N	435.820	1.494	50	20	IDGD	
COC(=O)c1cc(F)c(F)cc1NC(=O)C(=O)NNC(=O)c1ccc(OC)c(OC)c1	763551189	UDJOWTBJKZGLLK-UHFFFAOYSA-N	437.355	1.168	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)Nc1ccc(-n2cccn2)c(Cl)c1	763579009	SNMMVAWIBCDGLT-KRWDZBQOSA-N	441.831	1.452	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(CC(F)(F)F)cc1	763645780	BITAIYLDUJOHMG-UHFFFAOYSA-N	425.363	1.965	50	20	IDGD	
CSc1cc2c(cc1NC(=O)C(=O)NNC(=O)COc1cc(C)cc(C)c1)OCCO2	763648694	WHLAFJSXPPTSBW-UHFFFAOYSA-N	445.497	1.961	50	20	IDGD	
CC(C)(C)NC(=O)c1ccccc1NC(=O)C(=O)NNC(=O)COc1ccc(C#N)cc1	763682583	WXYVSFLAOLVJCC-UHFFFAOYSA-N	437.456	1.251	50	20	IDGD	
CCOC(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)c1	763727351	CYEQXDPQPZTYPP-UHFFFAOYSA-N	438.484	1.331	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccn(Cc3ccncc3)n2)c1C	763851134	QWBISKGHKXMTJI-INIZCTEOSA-N	436.472	1.497	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cnn(-c3ccncc3)c2)cc1	763864365	BQVVLAVUJJKZEF-CQSZACIVSA-N	438.444	1.219	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ncn(Cc2ccccc2)n1	763867332	ZYXZUBALVLHVLQ-CYBMUJFWSA-N	426.408	1.019	50	20	IDGD	
C[C@H]1COCCN1c1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1	764003865	JVFYULIWJVZMAN-AWEZNQCLSA-N	440.456	1.083	50	20	IDGD	
O=C(Cc1ccc2ccccc2c1)NNC(=O)C(=O)Nc1ccccc1Cn1cncn1	764092531	XBKWAGXQEXFTFB-UHFFFAOYSA-N	428.452	1.808	50	20	IDGD	
CC(C)n1nnnc1-c1ccccc1NC(=O)C(=O)NNC(=O)c1ccc(Cl)nc1	764100243	YLIMBWISBPJOCB-UHFFFAOYSA-N	428.840	1.369	50	20	IDGD	
Cc1cccc(C(=O)N2CCCC2)c1NC(=O)C(=O)NNC(=O)c1ccc(Cl)cc1O	764117731	QGTQKBFNYSVIDC-UHFFFAOYSA-N	444.875	1.990	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2ccc(C)c(NC(C)=O)c2C)cc1	764124143	DBEDTOXCPVJHTL-UHFFFAOYSA-N	426.473	1.989	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2c(Cl)cccc2Cl)cc1	764220944	HPVGREQBHFNLEZ-UHFFFAOYSA-N	430.269	1.797	50	20	IDGD	
CN(C)CCC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2cccc3ncccc23)cc1	764252773	LDNIANBHERTXOF-UHFFFAOYSA-N	448.483	1.525	50	20	IDGD	
O=C(Cc1ccccn1)NNC(=O)C(=O)Nc1cccc(N2C(=O)c3ccccc3C2=O)c1	764264665	QXAPYGPTNTVXMP-UHFFFAOYSA-N	443.419	1.211	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)ccc1O)C(=O)Nc1cnn(CC(F)F)c1	764279764	FCGOGPXRHFYSEI-UHFFFAOYSA-N	432.181	1.016	50	20	IDGD	
CC(C)OC(=O)c1c(NC(=O)C(=O)NNC(=O)Cc2cc[nH]n2)sc2c1CCCC2	764293002	JWXIIXBKWYKZKJ-UHFFFAOYSA-N	433.490	1.244	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)c2cncc(NC(C)=O)c2)cc1Cl	764432555	FYAKRBSEYSIMGV-UHFFFAOYSA-N	449.851	1.118	50	20	IDGD	
C/C=C(/C=C\C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)CC	764591079	IARQRHBCTFEWSM-VKENUJKVSA-N	435.546	1.700	50	20	IDGD	
CC(=NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1)c1ccc([S@](C)=O)cc1	764827860	KMDGGMIRCHHQJD-PMERELPUSA-N	426.542	1.722	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)/C=C/c3ccc4c(c3)OCO4)CC2)cc1	765748417	DDKXTCRQZIPTQU-VQHVLOKHSA-N	436.512	1.702	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2cnc3c(Cl)c(C)nn3c2)cc1OC	766307633	LSHOHWYCRHOHAJ-UHFFFAOYSA-N	425.854	1.332	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)N[C@H]1CCCc2c[nH]nc21	767226628	JUUDFCDOGHZRDS-KRWDZBQOSA-N	446.533	1.606	50	20	IDGD	
Cc1sc(S(=O)(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)cc1[N+](=O)[O-]	767475565	NSWLLNQTSQSURT-UHFFFAOYSA-N	432.867	1.244	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(Cl)c(C(=O)NNc2ccc([N+](=O)[O-])cc2)c1	768243724	VXPJUTMTTISPHA-UHFFFAOYSA-N	428.854	1.930	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)c3ccc(C[C@@H]4CC(=O)NC4=O)cc3)n[nH]2)cc1	768268353	NCQSPYZWZJMZEA-GOSISDBHSA-N	445.479	1.919	50	20	IDGD	
CCCOc1cccc(CC(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1	770204392	WWXWKKSGSSFCEU-IBGZPJMESA-N	428.441	1.549	50	20	IDGD	
C[C@@H](CBr)CN1CC(S(=O)(=O)N2CCN(C(=O)OC(C)(C)C)CC2)C1	770668405	YXCXLCPCQHEBJN-ZDUSSCGKSA-N	440.404	1.584	50	20	IDGD	
Cc1cc(F)ccc1C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	771236852	WLWCZUCDWYIPDK-UHFFFAOYSA-N	449.504	1.549	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)CCNC(=O)NC12CC3CC(CC(C3)C1)C2	771941537	TVIQPNCVVWTPKF-HIGJEIRPSA-N	436.553	1.770	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)c1cc(S(=O)(=O)N(C)C(C)C)ccc1F	771996429	UYCDEYMYVADMOX-ZDUSSCGKSA-N	445.513	1.593	50	20	IDGD	
CC(C)COc1cccc(OCC(=O)NNC(=O)c2csc(N3CCOCC3)n2)c1	772789676	JEKILELAZYFGBX-UHFFFAOYSA-N	434.518	1.855	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccnn1Cc1ccccn1	774000964	AWECAYHWDNRXEK-ZDUSSCGKSA-N	442.863	1.533	50	20	IDGD	
COC(=O)[C@@H](C)n1cccc1C=NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	774587820	WGDAWTQEIHHZRA-QGZVFWFLSA-N	425.489	1.130	50	20	IDGD	
COc1ccnc(NNC(=O)Nc2ccc(S(=O)(=O)NC3=NCCCCC3)cc2)n1	775460786	XSLPYYTVWRHZII-UHFFFAOYSA-N	433.494	1.885	50	20	IDGD	
CO[C@@H](c1ccccc1F)[C@@H](C)NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1	775736141	NMILLDAQDOONEG-RDTXWAMCSA-N	430.484	1.939	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)CC(C)(C)CC(=O)OC)c1	775760057	VQLLMUGUETZOMT-UHFFFAOYSA-N	427.523	1.458	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(NC(=O)NNc2cccc(S(C)(=O)=O)c2)cc1	776474852	REUBTNCWHCQECM-UHFFFAOYSA-N	442.519	1.163	50	20	IDGD	
O=C(c1ccccc1Br)N1CCN(S(=O)(=O)CBr)CC1	777777555	MBHNVSWBRRNQFY-UHFFFAOYSA-N	426.130	1.889	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)[C@H]2CCN(c3ccc4c(c3)OCCO4)C2=O)nc1C	778428929	FVBPCARSJNWYGA-CQSZACIVSA-N	441.444	1.229	50	20	IDGD	
COCC[C@H](NC(=O)NNC(=O)c1sc(N2CCOCC2)nc1C)c1ccc(C)o1	778589213	PPNDHKARBCXCEQ-AWEZNQCLSA-N	437.522	1.911	50	20	IDGD	
Cn1cc(-c2nn(C)cc2C(=O)NNc2ccccc2S(=O)(=O)NC(C)(C)C)cn1	780950362	GCTHXEHSNFBNNL-UHFFFAOYSA-N	431.522	1.654	50	20	IDGD	
CCCCN(C)S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ncncc2Cl)cc1	782159887	LIGNIZVMCOIHKW-UHFFFAOYSA-N	440.913	1.632	50	20	IDGD	
CCOc1cc(Br)ccc1NC(=O)C(=O)NNc1ccc(-n2cccn2)nn1	783433532	VTUVGSVVBVXYFX-UHFFFAOYSA-N	446.265	1.905	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)C(=O)Nc1ccc(Cl)cc1OC(F)F	784001687	BIYRYKRFZMNSJQ-UHFFFAOYSA-N	430.751	1.050	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1cccc(C(F)F)c1Cl	784003650	KJHFFJADBVAXFO-UHFFFAOYSA-N	430.820	1.855	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1ccc(F)cc1C(F)(F)F	784003749	NMXCJGOXAOECCL-UHFFFAOYSA-N	432.355	1.422	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNc2cccc(S(C)(=O)=O)c2)cc1Cl	784839269	HWYIPUKPFUSNQP-UHFFFAOYSA-N	441.893	1.851	50	20	IDGD	
CCOC(=O)COc1ccc(NC(=O)C(=O)NNc2ccc(C(F)(F)F)nn2)cc1	784886623	WAOHNQAQAFNRIT-UHFFFAOYSA-N	427.339	1.519	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ccnc(N(C)C)n2)cc1OCC(F)(F)F	784971070	SICTXNSWNSVLJB-UHFFFAOYSA-N	428.371	1.574	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2ccc(C(=O)NC(C)C)cc2C)n1	785226275	FVYUSLLPZHYHKN-UHFFFAOYSA-N	427.509	1.851	50	20	IDGD	
Nc1ccc([N+](=O)[O-])cc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	786689613	UWAUULSWZAAKMQ-UHFFFAOYSA-N	433.446	1.036	50	20	IDGD	
Cc1ccc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)N3CCN(C)CC3)cc2)cc1C	788165860	HNSPUQJXZSICGU-UHFFFAOYSA-N	445.545	1.706	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)CNS(=O)(=O)c1cccc(C(C)=O)c1	789910021	YUUNANJWEJBDFL-UHFFFAOYSA-N	439.877	1.291	50	20	IDGD	
COC(=O)NNC(=O)C(=O)Nc1cc(OC)c(Br)cc1Br	792260809	ODLKKIAUPLGUML-UHFFFAOYSA-N	425.033	1.546	50	20	IDGD	
CC1(C)Cc2cc(NC(=O)C(=O)NNC(=O)CNC(=O)OCc3ccccc3)ccc2O1	797368521	CDHCDPCCMVMLHZ-UHFFFAOYSA-N	440.456	1.412	50	20	IDGD	
CC1(c2cc(NC(=O)C(=O)NNC(=O)CNC(=O)OCc3ccccc3)no2)CCCC1	797369473	YXTPBLUHURPVFO-UHFFFAOYSA-N	443.460	1.519	50	20	IDGD	
CNC(=O)[C@]1(C)CCN(C(=O)NNC(=O)[C@@H]2Cc3ccccc3CN2Cc2ccccc2)C1	797607090	AJFQECUVHJKFSR-SQJMNOBHSA-N	449.555	1.812	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c(OC)c(C)c1OC	797679684	WZOAZWBIIAEASV-UHFFFAOYSA-N	427.421	1.463	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@H](C(=O)NN=c2sc3ccccc3n2C)[C@@H](C)O)cc1	798304108	JTXIZUMCGUXKMC-DYVFJYSZSA-N	434.543	1.208	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)[C@@H](C)NS(=O)(=O)c2ccc(C#N)cc2)c2ccccc2n1	799010127	RXFZVKRLZFYNBY-CQSZACIVSA-N	437.481	1.543	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)Cc2ccc(S(=O)(=O)N3CCCC3)s2)cc1	802059490	XRPBYDAHOURYII-UHFFFAOYSA-N	438.531	1.937	50	20	IDGD	
COC[C@@H](C)n1c(C)cc(/C=C(\C#N)C(=O)NS(=O)(=O)c2cnc3n2CCC3)c1C	802208937	DEZJAMRMOCIVAO-IREQLNLFSA-N	431.518	1.867	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)NCCn1cc(Br)cn1	805838394	UGRSYSMDFHSSNP-UHFFFAOYSA-N	433.307	1.281	50	20	IDGD	
CCOC(=O)CC(C)(C)CC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1	806343680	NBPXDLCXZYJGJX-UHFFFAOYSA-N	427.523	1.132	50	20	IDGD	
COCCCOc1ccc(NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1OC	806623872	YEKLVRYBEDHSOM-UHFFFAOYSA-N	441.448	1.553	50	20	IDGD	
CC(C)Cn1ncc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)c1C1CC1	806977076	URGOWIGBPCSJRJ-UHFFFAOYSA-N	427.461	1.587	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)NCCCn1cc(Br)cn1	807613294	YSQPHIBRVDYLEU-UHFFFAOYSA-N	440.298	1.844	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)NCc2ccncc2OC[C@H]2CCOC2)cc1	807615220	FYRXMPBGJAHFEY-INIZCTEOSA-N	425.445	1.278	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1cccc2c1COC2=O	808934074	ZFPWSRCPQUZFJC-UHFFFAOYSA-N	446.485	1.516	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNc2ccc(S(C)(=O)=O)cc2)cc2[nH]ccc12	808937465	YHAFRHAFMSXTBU-UHFFFAOYSA-N	430.442	1.440	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)c1c(F)ccc(O)c1F	809725636	XXAUPRPSDMLFCJ-UHFFFAOYSA-N	438.862	1.903	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCc2nncn2C1)C(=O)Nc1cccc(CCCc2ccccc2)c1	815691882	DPNIFGSSGAREBK-IBGZPJMESA-N	446.511	1.802	50	20	IDGD	
COC(=O)c1cc(NNC(=O)CN(C)S(=O)(=O)c2ccc(NC(C)=O)cc2)ccc1C	816688454	RCKKKGFBXAYAHD-UHFFFAOYSA-N	448.501	1.504	50	20	IDGD	
CCS(=O)(=O)N[C@@H](C)C(=O)NNC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1	816829011	XRQWOXKYLVVIOC-AWEZNQCLSA-N	442.501	1.023	50	20	IDGD	
COCCCN(C(=O)/C(C#N)=C/c1cc(C)n(CCOC)c1C)[C@H]1CCS(=O)(=O)C1	841771893	ZRSRNPJNMPFHHU-ACSPXDACSA-N	437.562	1.711	50	20	IDGD	
CN1C(=O)c2ccc(S(=O)(=O)NNC(=O)CC34CC5CC(CC(C5)C3)C4)cc2C1=O	861548842	VDWQZZUDUWINHF-UHFFFAOYSA-N	431.514	1.828	50	20	IDGD	
Cc1cc(C)nc(-n2nc(C)c(CC(=O)OCC(=O)NNC(=O)c3ccccc3)c2C)n1	914657562	QVJUXIWSOJJJJS-UHFFFAOYSA-N	436.472	1.443	50	20	IDGD	
C[C@H]1CN(Cc2ccc(C(=O)NNC(=O)[C@H]3COc4ccccc4O3)cc2)C[C@@H](C)O1	914775514	RXYWRVARZIAOPU-VWKPWSFCSA-N	425.485	1.897	50	20	IDGD	
COc1cccc(C[C@@H](C(=O)NNC(=O)c2cc(Br)c[nH]2)n2nnnc2C)c1	915686139	OPADHKCNFDSHLY-HNNXBMFYSA-N	448.281	1.326	50	20	IDGD	
O=C(Cc1cccc2ccccc12)NNC(=O)NCCCN1C(=O)NC2(CCCC2)C1=O	915906292	YLSAVMRTTOSBRV-UHFFFAOYSA-N	437.500	1.967	50	20	IDGD	
O=C(NNC(=O)c1ccc(NC(=O)c2ccc(Br)o2)cc1)C(=O)NC1CC1	916127579	LYTDJZDYBIDSSC-UHFFFAOYSA-N	435.234	1.334	50	20	IDGD	
CC[C@H](C)NC(=O)c1cccc(CNC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c1	916476726	KYLFXHBECZOODE-AWEZNQCLSA-N	436.476	1.335	50	20	IDGD	
CN(CCCNC(=O)NNC(=O)c1nn(-c2ccccc2)cc1O)C(=O)OC(C)(C)C	916579927	PFXGZSPCMRNWMY-UHFFFAOYSA-N	432.481	1.779	50	20	IDGD	
Cc1ccc(NC(=O)C2CCN(CC(=O)NNC(=O)Cc3nc(C)cs3)CC2)nc1	918188227	UTKMGZWLZGAPKG-UHFFFAOYSA-N	430.534	1.196	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)c1ccc2c(c1)S(=O)(=O)N(C[C@H]1CCCO1)C2=O	918550180	LHPPTSKKEKYGQX-OAHLLOKOSA-N	443.481	1.393	50	20	IDGD	
Cc1c(C)c(C)c(S(=O)(=O)NCCC(=O)NNC(=O)NCC(F)(F)F)c(C)c1C	918707300	RZJAJWPFBOXZMM-UHFFFAOYSA-N	438.472	1.790	50	20	IDGD	
CC(=O)N1C[C@H](C(=O)NNC(=O)COc2ccc(Br)cc2)Oc2ccccc21	919665492	ZRKJLLLJQALONM-QGZVFWFLSA-N	448.273	1.789	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)N2CCC(N3CCNC3=O)CC2)N(C)c2ccccc21	919851405	SSZRYCJCPSRKJX-UHFFFAOYSA-N	436.516	1.673	50	20	IDGD	
O=C(CSCc1ccc(Br)cc1)NNC(=O)N[C@@H]1CCS(=O)(=O)C1	919886871	XCHGHKIYRIPOIC-GFCCVEGCSA-N	436.353	1.200	50	20	IDGD	
C[C@H]1CCC[C@H](CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)C1	919916152	PLJGJVPEJYVRSM-HOTGVXAUSA-N	438.550	1.478	50	20	IDGD	
C[C@@H]1CN(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)C[C@H](c2ccccc2)O1	920313931	GIESQLCZLWUQDX-RHSMWYFYSA-N	431.518	1.796	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)NNc2ncccn2)cc1	920852976	DFFSDXXHBHUSEG-RVDMUPIBSA-N	432.444	1.274	50	20	IDGD	
CC(C)NC(=S)NNC(=O)CNS(=O)(=O)c1cc(C(F)(F)F)ccc1Cl	1317697137	UCHNCKAXRIAQLO-UHFFFAOYSA-N	432.877	1.541	50	20	IDGD	
CN1CCN(c2ccccc2CNC(=O)NNC(=O)c2cc(Br)c[nH]2)CC1	1318275513	KZKVQENWOMXMJS-UHFFFAOYSA-N	435.326	1.673	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N[C@@H]2CCN(Cc3cc(OC)cc(OC)c3)C2)cc1	1319126193	CDRXTBAJDFSNQX-QGZVFWFLSA-N	428.489	1.931	50	20	IDGD	
NC(=O)C1CCN(C(=O)C2CCN(C(=O)NNC(=O)CCCc3ccccc3)CC2)CC1	1321488684	QZTZPQULOHTCGY-UHFFFAOYSA-N	443.548	1.186	50	20	IDGD	
COc1c(C(=O)N2CCN(S(=O)(=O)CBr)CC2)cnn1-c1ccccc1	1324084466	ZVODRTIBGNEJBZ-UHFFFAOYSA-N	443.323	1.321	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2)c1cc(-c2cccnc2)[nH]n1	1779753889	ROIOYUVDKQJPCO-DBXWQHBBSA-N	447.923	1.199	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(Cl)ncn3)C2)C1	1779815728	HKCZIADPLTYDCY-MEDUHNTESA-N	431.718	1.605	50	20	IDGD	
O=C(c1cccc(OC2CCOCC2)n1)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Cl)CCO2	1779904007	MEMKHMKUHNLDKF-XLIONFOSSA-N	441.887	1.617	50	20	IDGD	
C/C=C(/C)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1	1780098073	AXKCHKYTMQXDNV-ITJNAYANSA-N	431.445	1.930	50	20	IDGD	
COc1cc(OC)cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](O)CCl)C3)c1	1780384560	KNZLSNSHOOUUNA-DBXWQHBBSA-N	440.924	1.431	50	20	IDGD	
Cc1ccncc1CCC(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781327261	ZMTXQKZLHKTCOJ-SJLPKXTDSA-N	428.302	1.843	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnn3ncccc13)C2	1782172615	HRQFESXYCABJOU-XAUMDUMWSA-N	435.912	1.111	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CSc2nc[nH]n2)C1	1782482593	KWLUNIOOFHNQGE-HWWQOWPSSA-N	446.371	1.194	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)Cc3c(C)nn(C)c3C)CCO2)C1	1783354519	SACWCQBZUCUNKH-VQIMIIECSA-N	441.370	1.583	50	20	IDGD	
Cc1cc(C)n(CCC(=O)N2CCO[C@]3(CCN(C(=O)[C@H](C)Br)C3)C2)n1	1783539934	PBTWTBFDZZWKSJ-MAUKXSAKSA-N	427.343	1.503	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)Cc3cccc(C(F)(F)F)n3)CCO2)C1	1783873200	MBWLOUGPYOWVRV-KBXCAEBGSA-N	449.857	1.727	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3occc3Br)CCO2)C1	1783874340	CZSQORXZXWVDOX-BLLLJJGKSA-N	435.702	1.739	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(=O)c3ccccc3)C[C@@H]21	1783967420	HJXVYUZQMNZFPX-IWCQGFGOSA-N	437.334	1.880	50	20	IDGD	
CC(C)(C)OC(=O)N1C(=O)CC[C@@H]1C(=O)N1CC[C@]2(CN(C(=O)[C@@H](F)Cl)CCO2)C1	1784192988	ULZIEGNCRJQTTI-BBEGDGIKSA-N	447.891	1.277	50	20	IDGD	
C[C@H](Cc1ccccn1)C(=O)N1CC[C@]2(CN(C(=O)[C@H](F)Br)CCO2)C1	1784287619	XNLUJFLBVLNAEC-QIIPPGSGSA-N	428.302	1.781	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21)[C@H]1CC(=O)N(C2CCCC2)C1	1784969746	KFGZCAYESIXAIM-SDADXPQNSA-N	446.375	1.561	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3c[nH]c(C(C)(C)C)c3)[C@H]2C1	1785571320	PODFVJFOXWVVHQ-SZMVWBNQSA-N	447.580	1.279	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]3C2)cc1NC(C)=O	1787448188	XKDIAOMPYNLNPV-USJZOSNVSA-N	441.887	1.781	50	20	IDGD	
COc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)CBr)C[C@@H]32)nn1	1789100967	OFGAOODOMRZQFX-ABHRYQDASA-N	441.326	1.110	50	20	IDGD	
COc1ccc2[nH]cc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)C(Cl)Cl)C[C@@H]43)c2n1	1789190622	YJNFEGYMMOCHOX-JKOKRWQUSA-N	441.315	1.969	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]2C1	1789923396	KZXBQQQXSDNEET-ROKJBNPBSA-N	434.133	1.893	50	20	IDGD	
COc1nccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]3C2)c1F	1791057839	ILZGHBDIYGUFKQ-XWUBHJNHSA-N	444.301	1.606	50	20	IDGD	
O=C1NCc2cc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]4C3)ccc21	1791298400	WGBKCGWSMUWBMA-CQDKDKBSSA-N	426.300	1.327	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCl)c1cccc(OCC(F)(F)F)n1	1793111000	VYKAPCIGSNQUAW-GFQSEFKGSA-N	435.830	1.874	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1CCC(CO)CC1	1793854392	YHUMOFNLFAIGED-OARYSHLNSA-N	431.371	1.548	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)Br)C3)n1	1794281009	KQOCKHLUCJUHFZ-YGSHXTJESA-N	439.310	1.027	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccoc1C(F)(F)F)c1cccc(B(O)O)c1	1797016904	LUNDUNMQSOQEIB-QDMKHBRRSA-N	436.195	1.544	50	20	IDGD	
Cn1cnc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CO[Si](C)(C)C)c1C(F)(F)F	1797955857	KNNLUCBDVFYCKA-DABQJJPHSA-N	448.518	1.494	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1c[nH]c2ccc(OC)nc12	1798485896	OIMMKYGCFOJYSK-IFOZYUSPSA-N	436.896	1.029	50	20	IDGD	
CCc1nc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C3)co1	1798908943	FJYOQDUXEFOOOX-JWBKOJIWSA-N	426.477	1.623	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nn[nH]c1C(F)(F)F)C2	1799276763	LGLDLWGADABKHK-FJBRNLEUSA-N	444.241	1.263	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc3c1OCCO3)C2)[C@H](F)Br	1799347965	ZPWGUBJSPKCJKQ-VAECKANCSA-N	443.269	1.352	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCN1CCCCC1)C2	1800639198	KITFAPDYONWLJR-DFGXFYAUSA-N	430.387	1.626	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc(F)cn1)C2	1800639510	GWNJLIQTLOZKAD-RBNVPPIJSA-N	428.302	1.526	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nccc3[nH]ccc13)C2	1800640071	UHDKAHCLPMGYMN-FAXLKDOZSA-N	435.322	1.940	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C(Cl)Cl)C1	1801014758	CAPUUGMCZOYESR-CLLJXQQHSA-N	436.336	1.247	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)CN2CCSCC2)[C@H]1c1cccnc1	1802448201	HXMDKWXZSBUJRM-ZIFCJYIRSA-N	440.997	1.390	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1CCN(C(=O)CCC(N)=O)[C@H]1c1cccnc1	1803014889	HIYNIJPHFIDHLE-IFIJOSMWSA-N	425.327	1.384	50	20	IDGD	
Cc1nccn1CCCC(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]1c1cccnc1	1803145535	DPCKHOLOULMANA-WSTZPKSXSA-N	433.940	1.672	50	20	IDGD	
COC(OC)C(=O)NC[C@@H]1CCN(C(=O)[C@H](C)CBr)[C@H]1c1cccnc1	1803344802	WRPIAPBPVPTACC-SNPRPXQTSA-N	428.327	1.737	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)CSCC(=O)OC)[C@@H]1c1cccnc1	1803579534	HHJFNUHIOOKKMQ-MPGHIAIKSA-N	443.953	1.247	50	20	IDGD	
O=C(COc1cc(Cl)ccn1)N1CCC2(CCCN(C(=O)[C@@H](O)CCl)C2)CC1	1805522231	GOKKMIAZSLBJRY-HNNXBMFYSA-N	430.332	1.945	50	20	IDGD	
Cc1nocc1C(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1805828789	QWLNRFYHZAEGJG-UZLBHIALSA-N	428.493	1.071	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)nc1	1807361632	BYJJPFCRCQKPCI-KNQAVFIVSA-N	444.300	1.098	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H](CNC(=O)[C@@H](C)NC=O)[C@@H]1c1cccnc1	1808345705	NRMZYWKASKQUHI-XOUADPBQSA-N	425.327	1.253	50	20	IDGD	
Cc1ccoc1C(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1808502355	WYBHNQGMOAGZQJ-YLJYHZDGSA-N	427.505	1.676	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2c[nH]c(=O)cn2)[C@@H]1c1cccnc1)[C@H](F)Br	1808676148	NKAXFGAZHCECLB-GLQYFDAESA-N	438.257	1.175	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1	1809063409	VPYVWWFOZSEDNE-ABSDTBQOSA-N	441.919	1.957	50	20	IDGD	
CNc1ccc(C(=O)N2CCCC3(CCN(C(=O)c4ccc(B(O)O)cc4)CC3)C2)cc1	1809720540	ANFMZKPJPWHSLB-UHFFFAOYSA-N	435.333	1.567	50	20	IDGD	
CCOc1ccc(C(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@H]2c2cccnc2)nn1	1811622864	PSKOUWOSDRLIBG-LESCRADOSA-N	433.896	1.190	50	20	IDGD	
C#CC(=O)NC[C@H]1CCN(C(=O)CN(C)NC(=O)NCc2ccccc2)[C@@H]1c1cccnc1	1812530668	KBUZXLMTKDLTDZ-NFBKMPQASA-N	448.527	1.067	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)Cc2cc(C)n(C)n2)[C@H]1c1cccnc1	1813028597	PUZOWMBAZFTZDT-QRFRQXIXSA-N	433.940	1.626	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)c2cccc(=O)n2O)[C@H]1c1cccnc1)C(Cl)Cl	1813077319	JNSSGKYFZHDKMU-DOMZBBRYSA-N	425.272	1.604	50	20	IDGD	
CC1(C)CC(C(=O)N[C@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)C1	1815361512	ICVRYSHRBILDQA-HNNXBMFYSA-N	427.335	1.485	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@H](F)Br)[nH]n1)c1cccc(=O)n1O	1816148881	NHPNVIFFNIBSJN-YGRLFVJLSA-N	442.245	1.805	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCBr)n[nH]1	1816782572	VGJZHBMAOXICLF-DGCLKSJQSA-N	426.315	1.878	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccno1)CC2	1817277091	IPHIGCDNFVGTOI-DLDHGHKKSA-N	441.473	1.491	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](C)CN)[nH]n1	1818112048	RRCDOCJVUQCSAE-ROSSUFOISA-N	428.497	1.131	50	20	IDGD	
C[C@@H]1CCC[C@@H]1C(=O)N[C@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1	1819796976	KMIJOTFQFLKULC-AGIUHOORSA-N	442.545	1.804	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](C)Nc3cnccn3)sc2C1	1819837117	RCMNFWXBLRQTBR-WOPDTQHZSA-N	438.941	1.600	50	20	IDGD	
CC(C)O[C@@H](C)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnccc1C(=O)NN)CC2	1820009883	HWVCOHCGMGBHRU-RYUDHWBXSA-N	446.533	1.181	50	20	IDGD	
N#Cc1c[nH]c(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)[nH]n2)c1	1820307911	HZIBARNWTQGGHY-KRWDZBQOSA-N	447.459	1.228	50	20	IDGD	
CCCNC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1	1822410288	CRPIWXDCXWBFTC-INIZCTEOSA-N	449.556	1.081	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CN)CC1	1825008841	QZWFIUSDSKQEQT-JKSUJKDBSA-N	430.977	1.697	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)N[C@H]1CCc2nc(NC(=O)[C@H](C)Br)sc2C1	1825642335	PRIJMAKBFCEZHU-AEJSXWLSSA-N	429.340	1.529	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnc(N(C)C)o1)CC2	1825994745	YRFPJZMJODEGAD-ZJUUUORDSA-N	427.914	1.677	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)/C=C\C(=O)NC1CC1)CC2	1826000510	UWMBZSGLXPYYQL-MVSYMCDOSA-N	426.926	1.144	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](O)c1ccccc1)CC2	1826085355	NZBUZMRJPBGFLD-AUUYWEPGSA-N	445.545	1.162	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)CCCn3ccnc3)sc2C1	1826690854	PXXVJUZCNYVQDZ-AWEZNQCLSA-N	447.565	1.105	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(=O)n3[nH]cnc3n2)CC1	1827049514	OWEXQEFTIRXKOB-HOCLYGCPSA-N	434.928	1.668	50	20	IDGD	
CS(=O)(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](F)Br)CC2	1827211281	DKOLROSJWXEIHG-HQJQHLMTSA-N	442.332	1.180	50	20	IDGD	
O=C([C@H](O)CCl)N1CCC([C@H]2CCCCN2C(=O)[C@@H]2ON=C(c3ccccc3)O2)CC1	1828816288	FYOMKLULDNTKAA-HMFYCAOWSA-N	449.935	1.941	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@H](O)N2CCOCC2)CC1	1828965651	QOASDFSIMOARMP-MSOLQXFVSA-N	429.989	1.522	50	20	IDGD	
CN1C(=O)CC[C@H]1C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H](F)Br)CC1	1830380423	NBPWNTDMFITFHW-DZKIICNBSA-N	432.334	1.917	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)on1	1830537798	OVNVHJFBWXSEAH-YVEFUNNKSA-N	430.299	1.084	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3ccc4cc[nH]c4c3)CC2)CC1)[C@@H](O)CCl	1833309973	GAEULDHCQLDCRE-FQEVSTJZSA-N	432.952	1.953	50	20	IDGD	
C[C@@H](Cc1ccncc1)C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)CCl)CC2)CC1	1833312551	WYHRBCVICFJZJX-OXJNMPFZSA-N	436.984	1.432	50	20	IDGD	
Cn1ccc(C(=O)NC2CCN(C3CCN(C(=O)CCBr)CC3)CC2)c1	1834078098	OHIRISNRORAKFS-UHFFFAOYSA-N	425.371	1.995	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)c3coc(Cl)n3)C2)C1	1834819747	ZOKISKNMWLSYKV-OAHLLOKOSA-N	436.690	1.183	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccccc3Cl)CCO2)C1	1835013672	FMIJLGQOSFPYMM-YLJYHZDGSA-N	445.343	1.593	50	20	IDGD	
Cc1nccnc1C(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)Br)CC2)CC1	1836014612	PGWJTVBWLQKSBN-CYBMUJFWSA-N	438.370	1.754	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)c3ncon3)CC2)CC1	1836044540	ZKOHOJOMFHOTGF-GFCCVEGCSA-N	428.331	1.286	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3[nH]nc4ncccc34)CCO2)C1	1836451393	WGNBSODIFXRCPX-FOIQADDNSA-N	435.912	1.435	50	20	IDGD	
C=CC(=O)N[C@@H](C)C(=O)N1CCC(OC2CCN(C(=O)C(C)(C)CCl)CC2)CC1	1836623775	PSTZTGSNXWGCDS-HNNXBMFYSA-N	427.973	1.941	50	20	IDGD	
NC[C@H](C(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)c1ccccc1	1836716818	SDEORZQUISNMJN-PMACEKPBSA-N	437.968	1.327	50	20	IDGD	
O=C(c1cc2sccc2s1)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1	1836857194	BYYAJBWQUJMADN-SGTLLEGYSA-N	444.962	1.633	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc4c(C)cccc4[nH]3)CCO2)C1	1836918534	BFZOBVQMVCNZMQ-JTSKRJEESA-N	449.935	1.800	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)c3ncn(C)n3)CC2)CC1	1837383472	OYDXUHFTKMSVTO-GFCCVEGCSA-N	428.331	1.211	50	20	IDGD	
Cc1occc1C(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1	1837455577	IFGUVPZDTWXLIF-UHFFFAOYSA-N	440.305	1.194	50	20	IDGD	
CCOC(CC(=O)N1CCOC[C@@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1)OCC	1837717665	LQTVBOSILWMJSX-FQEVSTJZSA-N	446.617	1.084	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccnc3SC)CCO2)C1	1838287205	FPMLOGCUXBUWIZ-BEFAXECRSA-N	427.954	1.891	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC(OC2CCN(C(=O)CCn3cncn3)CC2)CC1	1838431922	CBLULGYSEVZHHS-UHFFFAOYSA-N	437.617	1.518	50	20	IDGD	
Cc1ncccc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2	1839151558	WDPQEARAXAUBIY-RBUKOAKNSA-N	430.332	1.696	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccc(F)cn3)C2)C1	1839152433	ZACIDTBXKVJXIQ-RTBURBONSA-N	448.322	1.456	50	20	IDGD	
Cc1ccc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)cc1	1839199300	MKGXORQREYEMTI-HKUYNNGSSA-N	443.313	1.684	50	20	IDGD	
CC1(C)CCC(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)CC1	1839229901	WJAVHCCYRNFSFY-LAUBAEHRSA-N	430.973	1.649	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3c(F)ccc(O)c3F)CCO2)C1	1839411795	KKQLKKLVGUEWQD-BLVKFPJESA-N	432.851	1.758	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(O)nc3)C2)C1	1839965580	DQVSIMCUSZGETH-RDTXWAMCSA-N	442.310	1.031	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CC[C@H](O)CC3)C2)C1	1839966808	QKOKKFBTHYUMNM-YKTARERQSA-N	447.370	1.167	50	20	IDGD	
CCc1ccnc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)c1	1840031729	APFHRIKLGOPVGS-AUUYWEPGSA-N	440.338	1.497	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccncc3F)C2)C1	1840032756	JNKOCJMFUSZYOX-SJCJKPOMSA-N	430.274	1.074	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4ccccc4o3)C2)C1	1840152695	PWUMMYBWTUMVRZ-IIBYNOLFSA-N	436.892	1.757	50	20	IDGD	
O=C(c1ccc2n[nH]cc2c1)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840187781	WTFZLPOWZISAOB-GOSISDBHSA-N	427.288	1.437	50	20	IDGD	
CC(=O)Nc1ccccc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1840724261	UDNFUGKGERJTLE-VQIMIIECSA-N	427.860	1.249	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C1(C#N)CCC1)CCO2	1840815681	DPKLERTWNCXWIU-RDTXWAMCSA-N	428.327	1.310	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2cc(Cl)cnc2O)C1	1840984544	GMYJOQSUUXMZHM-WYMPLXKRSA-N	444.879	1.392	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1O)C2	1841668924	COGBJKRDBRKFEG-PMPSAXMXSA-N	443.972	1.825	50	20	IDGD	
CN1CCC(C(=O)N2CC3(CCCN3C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)CC1	1841924071	RYOGXZAPUBGGMW-INIZCTEOSA-N	442.988	1.664	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)/C=C\c2c[nH]c3ccccc23)C1	1841971451	BNSYPABBFPAPJJ-KTKRTIGZSA-N	429.285	1.378	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2cnccc2N(C)C)C1	1842285183	QTIBPBVBYOANBO-MFKUBSTISA-N	437.504	1.099	50	20	IDGD	
COc1cc(C(=O)N2CC3(CCCN3C(=O)CCBr)C2)c([N+](=O)[O-])cc1O	1842638907	XAIKHTGGLWUWND-UHFFFAOYSA-N	442.266	1.911	50	20	IDGD	
C[C@@H](NC(=O)c1ccc(F)cc1)C(=O)N1CCCC12CN(C(=O)[C@H](F)Br)C2	1845004052	NHEHQCQKBVYNCL-RISCZKNCSA-N	444.276	1.838	50	20	IDGD	
C[C@H](NC=O)C(=O)N1CCCC12CN(C(=O)/C(C#N)=C/c1ccc(Br)cc1)C2	1845180623	MXHGKYKWSLSUDO-FSEGOYHTSA-N	445.317	1.694	50	20	IDGD	
COCCOCCOCCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](C)CBr	1847499771	MDRDYLYJVOLQHT-PMPSAXMXSA-N	435.359	1.289	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@]1(C)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl	1847555866	AGQCQCKHGNKMHR-KZDUYQQSSA-N	429.945	1.578	50	20	IDGD	
Cc1nc(N2CCOCC2)[nH]c(=O)c1CCC(=O)NNC(=O)c1ccc(C(C)(C)C)cc1	10124911	DPDJUGRIFQKVDV-UHFFFAOYSA-N	441.532	1.606	50	20	IDGD	
CCCn1nc(C(=O)NNS(=O)(=O)c2ccc([N+](=O)[O-])cc2)c2ccccc2c1=O	16095536	QJIKNWBISCIMQQ-UHFFFAOYSA-N	431.430	1.338	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)c1ccc(S(C)(=O)=O)c([N+](=O)[O-])c1	16270146	ZSIPUHZMTCKVOG-UHFFFAOYSA-N	445.251	1.174	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)COc2cc(C)ccc2Cl)cc1	17406009	CJWWARXGCFKGCQ-UHFFFAOYSA-N	439.921	1.804	50	20	IDGD	
O=C(CCN1CCCC1=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	110700814	JKSHFFNSTQZTKH-UHFFFAOYSA-N	436.515	1.322	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NCc1cccc(CN2CCCC2=O)c1	725872124	AQZYWDLCSYQQFU-UHFFFAOYSA-N	429.502	1.131	50	20	IDGD	
O=C(NNC(=O)[C@@H]1C[C@H]2CCCC[C@@H]2N1C(=O)c1ccc(F)cc1F)C(=O)N1CCCC1	726160899	NGIDUCMFSFZHJU-BVGQSLNGSA-N	448.470	1.508	50	20	IDGD	
O=C(CNCC(F)(F)F)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	727765934	WAZZUMALLLMLTB-UHFFFAOYSA-N	444.435	1.078	50	20	IDGD	
O=C(CC/N=C1/NS(=O)(=O)c2ccccc21)NNC(=O)c1c(Cl)cccc1Cl	727805959	GLSAHHDYYIKALN-UHFFFAOYSA-N	441.296	1.883	50	20	IDGD	
COc1ccc(C(=O)NNC(=S)NCC2CCC2)cc1S(=O)(=O)NC(C)(C)C	727866427	HQCFSVZQBDVBKC-UHFFFAOYSA-N	428.580	1.681	50	20	IDGD	
CNc1ccc(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)cc1[N+](=O)[O-]	728212760	CJRMWWKCNIFTMS-UHFFFAOYSA-N	448.505	1.330	50	20	IDGD	
Cc1noc2ncc(C(=O)NNc3ccc(S(=O)(=O)N4CCN(C)CC4)cc3)cc12	728213422	BNCWTNAYIUWHPB-UHFFFAOYSA-N	430.490	1.224	50	20	IDGD	
CC(=O)NCC(=O)N1CCC[C@H]1C(=O)NNC(=O)c1cc2c(s1)CC[C@H](C(C)(C)C)C2	728512752	JAYBCADHAOUDRL-HOTGVXAUSA-N	448.589	1.787	50	20	IDGD	
CCN1CCC[C@@H]1CN1C[C@H](C(=O)NNC(=O)c2cc(-c3ccccc3)on2)CC1=O	729625674	AYWWJVRIYBMINQ-IAGOWNOFSA-N	425.489	1.435	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)c1ccc2c(c1)C(=O)N(C[C@@H]1CCCO1)C2=O	730034387	PCCGOYKITKLJOH-INIZCTEOSA-N	437.452	1.561	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)[C@H]1CCN(c2ccc3c(c2)OCCO3)C1=O	730519066	FMDAXLXUAXMHTM-OAHLLOKOSA-N	435.440	1.228	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NN=Cc2ccc(OC(F)(F)C(=O)O)cc2)c1	730726929	HXTNLRLBICOHOJ-UHFFFAOYSA-N	441.412	1.757	50	20	IDGD	
O=C(NNC(=O)C(=O)NC1CC1)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	731403941	BMFFCYGEOYQGDF-UHFFFAOYSA-N	428.320	1.567	50	20	IDGD	
C[C@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(S(=O)(=O)NNC(=O)C3CCC3)cc2)C1	732047923	KXXIBWMOTHGCBE-OKILXGFUSA-N	429.564	1.463	50	20	IDGD	
CC(C)N1C(=O)c2ccc(C(=O)NNc3ccccc3S(C)(=O)=O)cc2S1(=O)=O	732304361	VJIRECHNFXBZDS-UHFFFAOYSA-N	437.499	1.400	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)c1cccc(O)c1	732888733	DCZXWJZBHMBBPE-CQSZACIVSA-N	432.502	1.882	50	20	IDGD	
Cc1ccc(-n2c(NNC(=O)Cn3ccc(=O)n(C)c3=O)nc3ccccc3c2=O)c(C)c1	733265626	VVRXPEMDNOTJOH-UHFFFAOYSA-N	446.467	1.006	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)C[C@@H](NC(N)=O)c2ccccc2)CC1	734825102	UMSIVUBTHQUELV-MRXNPFEDSA-N	448.524	1.516	50	20	IDGD	
COc1cc(C)sc1C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	735117327	QZXBDAOEKRUYIU-UHFFFAOYSA-N	425.536	1.153	50	20	IDGD	
CC(C)(C)[C@@H]1OCCC[C@@H]1CNC(=O)NNC(=O)c1csc(N2CCOCC2)n1	735677370	DZCHZMSIWRIMEA-UKRRQHHQSA-N	425.555	1.765	50	20	IDGD	
CN(C)c1nccc(NNC(=O)c2ccc(NC3=NS(=O)(=O)c4ccccc43)cc2)n1	740103017	KJBSCIBOOOOMIG-UHFFFAOYSA-N	437.485	1.861	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C[C@H](C)/N=C2/NS(=O)(=O)c3ccccc32)c1	742472359	PPYXNGAZVPBEAI-HNNXBMFYSA-N	444.513	1.347	50	20	IDGD	
CCNS(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)c2cccc(Br)c2)c1	742769236	LEPLNTKKBKMFOH-UHFFFAOYSA-N	444.282	1.961	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2cccc(F)c2C)c1	743252136	MNLOCVJOCKQQJA-UHFFFAOYSA-N	443.522	1.788	50	20	IDGD	
CS(=O)(=O)Cc1ccc(C(=O)NNC(=O)c2cc(Br)ccc2O)cc1	743732333	QNABUXOUVHXNDS-UHFFFAOYSA-N	427.276	1.774	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)CCCc2nc(O)c3ccccc3n2)cc1	743829693	AZMSJUQDWNOIJM-UHFFFAOYSA-N	443.485	1.915	50	20	IDGD	
Cc1nc(COc2ccc(C(=O)NNC(=O)Nc3ccc(S(C)(=O)=O)cc3)cc2)no1	743829951	HVIRIHTVEOPPKD-UHFFFAOYSA-N	445.457	1.827	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1cc([N+](=O)[O-])ccc1O)c1cccc(N2CCOC2=O)c1	745781419	OEKUXSGLLFUAFW-LLVKDONJSA-N	429.389	1.962	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)C1CCCCC1	745839152	TZDGLURGUANTEV-HNNXBMFYSA-N	438.550	1.620	50	20	IDGD	
Cc1ccc(O[C@H](C)CNC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1	745888837	UZQGBKWNVACVOY-QGZVFWFLSA-N	448.545	1.722	50	20	IDGD	
COc1cc(C)nc(NNC(=O)CNC(=O)c2ccccc2I)n1	746694765	ZSBZYIYINFVGAE-UHFFFAOYSA-N	441.229	1.271	50	20	IDGD	
Cc1noc(C)c1S(=O)(=O)N1CCC[C@H](C(=O)NNC(=O)c2ccc(C#N)cc2)C1	747174535	XSEYBLWYXNSGBL-INIZCTEOSA-N	431.474	1.025	50	20	IDGD	
COc1ccc(N2C[C@@H](C(=O)NNC(=O)CCOc3ccccc3)CC2=O)c(OC)c1	747180544	CZUIIDDEADZTGC-HNNXBMFYSA-N	427.457	1.673	50	20	IDGD	
Cc1c(C(=O)NNC(=O)Cc2ccncc2)nnn1C1CCN(C(=O)OC(C)(C)C)CC1	747324370	AJSUTUCIYBVVIC-UHFFFAOYSA-N	443.508	1.557	50	20	IDGD	
COc1ccc(C(=O)NNc2nccn(C)c2=O)cc1S(=O)(=O)N1CCCCCC1	747941380	BPEWOLAFHXMYAU-UHFFFAOYSA-N	435.506	1.111	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCCCN(C)C)cc1C(=O)NNc1ccc([N+](=O)[O-])cc1	747987281	HJDQNOJVQSOLLR-UHFFFAOYSA-N	435.506	1.890	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)c1nn(-c2ccc(OC)cc2)cc1O	748011038	SRHAUJOUYFDGCZ-UHFFFAOYSA-N	426.429	1.825	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)NCC3CCN(S(C)(=O)=O)CC3)cc2C1	748827519	MRXJYQIOSKSJRX-GFCCVEGCSA-N	428.580	1.489	50	20	IDGD	
Cc1noc(C)c1S(=O)(=O)N1CCC(C(=O)NNC(=O)c2cc3ccccc3o2)CC1	749476740	CJTWKSSLXHLGOE-UHFFFAOYSA-N	446.485	1.900	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CNC(=O)c2ccco2)cc(OC)c1Br	751204200	FUWRFNKFWTWAOJ-UHFFFAOYSA-N	426.223	1.250	50	20	IDGD	
C[C@@H](NC(=S)NNC(=O)c1cccc(S(=O)(=O)NC[C@H]2CCCO2)c1)C1CC1	751620968	NDOPJNRAPKKHPU-IUODEOHRSA-N	426.564	1.051	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)c2cc(S(=O)(=O)N(C)C)oc2C)cc1OC	753276586	NKUHQAIJUPHGFD-UHFFFAOYSA-N	425.463	1.320	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)N1CCc2c(Br)ccc(F)c2C1	754177479	VAWODCHFAYKGCP-UHFFFAOYSA-N	439.241	1.710	50	20	IDGD	
C[C@@H]1CN(S(=O)(=O)c2ccc(NC(=O)NNC(=O)c3ccncc3)cc2)C[C@@H](C)O1	755425156	ZFDQNQISOKODRV-ZIAGYGMSSA-N	433.490	1.346	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccc(S(=O)(=O)C(F)F)cc2)c1	755443147	DVBJXFSFEOCFDF-UHFFFAOYSA-N	447.441	1.553	50	20	IDGD	
COCCn1ccc(NC(=O)NNC(=O)[C@H](C)Oc2cccc(Br)c2)n1	756311628	PUNFVWXUQOHNFL-NSHDSACASA-N	426.271	1.912	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1ccc(OCc2cccc(C#N)c2)c(F)c1	756355702	RFFOUKPHFDPMCH-GFCCVEGCSA-N	449.464	1.367	50	20	IDGD	
COc1cccc(OC)c1CC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	757381195	BNAFBWXZLJBDAS-UHFFFAOYSA-N	448.545	1.326	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@@H]2CCN(C(C)=O)c3ccccc32)c2ccccc2c1=O	757786088	GUFGAUPWNILEQY-GOSISDBHSA-N	448.483	1.858	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)Nc2ccc(C(=O)N3CCOCC3)cc2C)c1	757830741	KXEAJHZIBMVHIT-UHFFFAOYSA-N	440.460	1.287	50	20	IDGD	
CN(NC(=O)CNc1ccccc1[N+](=O)[O-])C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758785231	CVPZBDVPOUEOAW-UHFFFAOYSA-N	436.469	1.642	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN(c2ncccc2C(F)(F)F)C1)C(=O)Nc1ccccn1	758835914	YOHXVURGSRFJNB-GFCCVEGCSA-N	436.394	1.498	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)[C@H](C)NC(=O)c2ccc(Br)s2)nc1	759734404	DCLBMVIIURLBAJ-QMMMGPOBSA-N	427.280	1.954	50	20	IDGD	
CN(C)c1ccc(-c2cncc(C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)c2)cc1	760296189	LXOIHLTWZIDJGT-UHFFFAOYSA-N	428.456	1.865	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)c1ccc(I)c(O)c1	760798295	GRIQYKAWPRIGPR-UHFFFAOYSA-N	442.209	1.845	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COCc2ccccc2)nc1I	761168119	OUUICVXHHOPSFN-UHFFFAOYSA-N	441.225	1.673	50	20	IDGD	
COc1ccc2c(c1)[C@H](C(=O)NNC(=O)CN1CCN(Cc3ccc(C)cc3)CC1)CC2	762089027	XMADMFDOGAEDDT-JOCHJYFZSA-N	436.556	1.999	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)CCNC(=O)c1n[nH]c2ccccc12	762373399	OWRVTXVFWPRFFH-UHFFFAOYSA-N	427.486	1.631	50	20	IDGD	
O=C(NNc1nccc(N2CCOCC2)n1)C1CCN(C(=O)CCc2ccccc2)CC1	762848268	PHESSDYEXKFPPX-UHFFFAOYSA-N	438.532	1.628	50	20	IDGD	
C[C@@H](NC(=O)c1cccc(Cl)c1Cl)C(=O)NNc1nccc(N2CCOCC2)n1	762860024	AQMLDMUVOFVXAF-LLVKDONJSA-N	439.303	1.882	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccnc(OCC(F)(F)F)c2)cc1OC	763550297	CCFZPTJSUUZUAS-UHFFFAOYSA-N	442.350	1.440	50	20	IDGD	
CC(C)(C)c1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccccc2S(C)(=O)=O)cc1	763594608	KRTVSOQFMQBNDP-UHFFFAOYSA-N	447.513	1.553	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)[nH]n1)C(=O)Nc1ccc(O[C@@H]2CCOC2)cc1	763606316	YFBKHRJUEPPSTJ-QGZVFWFLSA-N	435.440	1.644	50	20	IDGD	
CCn1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2-c2ccccc2)ccc1=O	763644702	WPHJAGCKRSKFIB-UHFFFAOYSA-N	434.452	1.700	50	20	IDGD	
C#CCOc1cc(F)ccc1NC(=O)C(=O)NNC(=O)COc1ccccc1OCC	763679612	AUARPZXFZQDTOV-UHFFFAOYSA-N	429.404	1.401	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccc(-c2nnc(C)n2C)c1	763711376	IVCQPRMKRIIHHS-UHFFFAOYSA-N	436.472	1.518	50	20	IDGD	
Cc1ccc(Cn2cccc(NC(=O)C(=O)NNC(=O)c3cccc(N(C)C)c3)c2=O)cc1	763759818	CGZISVPDDZYHAS-UHFFFAOYSA-N	447.495	1.671	50	20	IDGD	
CCc1cccc2c1N(C(=O)C(=O)NNC(=O)c1nn(C(C)C)c(=O)c3ccccc13)CC2	763790756	NYUWKOPAELRUFR-UHFFFAOYSA-N	447.495	1.890	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(F)c(C(=O)N(C)C)c2)c1C	763840584	MVSXTQQCCBGEAZ-AWEZNQCLSA-N	444.463	1.698	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1cc2c(cc1F)CCC(=O)N2	763864437	JJSAQOCCIQEIMV-JTQLQIEISA-N	432.383	1.403	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccc(Br)nc1	763865108	IKTQOHXGKCQVSD-VIFPVBQESA-N	425.214	1.537	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cnn(CC(F)(F)F)c2)cc1	763873042	RWDOPEQVDUZAKT-NSHDSACASA-N	441.366	1.201	50	20	IDGD	
COC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(C(C)=O)cc2)cc1	763877104	HOKZLBPIUMOATF-CYBMUJFWSA-N	442.428	1.621	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1Br	763917191	REQJDVNVDISFLO-UHFFFAOYSA-N	444.249	1.133	50	20	IDGD	
CCOC(=O)c1c(F)cccc1NC(=O)C(=O)NNC(=O)c1cc(Br)c[nH]1	763998630	RHKBYDCWBJCGOJ-UHFFFAOYSA-N	441.213	1.493	50	20	IDGD	
Cc1nc(-c2cccc(NC(=O)C(=O)NNC(=O)c3cc(-c4ccccc4)on3)c2)n[nH]1	764003173	BFKFOOGYTVJCQE-UHFFFAOYSA-N	431.412	1.835	50	20	IDGD	
CC(=O)N(C)c1ccccc1NC(=O)C(=O)NNC(=O)c1cc(Br)cn1C	764004645	KJJNZIDGLVBURZ-UHFFFAOYSA-N	436.266	1.170	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc(N2C[C@@H](C)O[C@H](C)C2)nc1	764039963	AEHFJGHNDXDTEX-ZIAGYGMSSA-N	427.461	1.104	50	20	IDGD	
CSc1c(F)cc(NC(=O)C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1F	764086903	WADYHKWKFOHCOK-UHFFFAOYSA-N	443.453	1.490	50	20	IDGD	
NC(=O)CCOc1ccccc1NC(=O)C(=O)NNC(=O)Cc1ccc2ccccc2c1	764090654	FLDUYTWZOVFXKG-UHFFFAOYSA-N	434.452	1.423	50	20	IDGD	
Cc1nnc(-c2cccc(NC(=O)C(=O)NNC(=O)c3ccc(Cl)cc3O)c2)n1C	764126211	FROLQQJISHAWHV-UHFFFAOYSA-N	428.836	1.549	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2ccc(O[C@@H]3CCOC3)cc2)cc1	764127117	OCLRXAFJFHNQSK-LJQANCHMSA-N	427.457	1.582	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3ccc(Cl)cc3O)cc2)CCO1	764127702	YNVHSMVHZKTSPE-LBPRGKRZSA-N	432.864	1.670	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(C(=O)OC)c2C)o1	764139018	MSJDWWWJKUDNDJ-UHFFFAOYSA-N	430.461	1.616	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)CCc2ccccc2)cccc1C(=O)N1CCOCC1	764192926	NDMBYCWFBKYCMZ-UHFFFAOYSA-N	438.484	1.186	50	20	IDGD	
NC(=O)CCOc1ccc(NC(=O)C(=O)NNC(=O)c2c(Cl)cccc2Cl)cc1	764221493	LIEAFCQNPYGHDM-UHFFFAOYSA-N	439.255	1.647	50	20	IDGD	
COc1ccc(Cn2nccc2NC(=O)C(=O)NNC(=O)c2cccc(C#N)c2)c(OC)c1	764238880	ZADLAGIVMGZPMC-UHFFFAOYSA-N	448.439	1.220	50	20	IDGD	
CCCCOc1cccc(NC(=O)C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1	764259987	MCAWUTHERXIIPU-UHFFFAOYSA-N	440.504	1.658	50	20	IDGD	
CN(C)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)CCc2ccccc2O)cc1Cl	764288682	KOYNQDOENNCPNE-UHFFFAOYSA-N	432.864	1.466	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(C)cnc2OC)cc1Br	764325927	ARGYWYFEXVJEBU-UHFFFAOYSA-N	437.250	1.569	50	20	IDGD	
O=C1CCCc2cc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc3ccccc3)ccc2N1	764379648	GPPDTPSIYGVGNW-UHFFFAOYSA-N	432.383	1.719	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(C(=O)N(C)C2CCCCC2)cc1	764400307	PBWWRIIJHRYEHR-HNNXBMFYSA-N	448.520	1.229	50	20	IDGD	
Cc1ccc(-c2n[nH]c(SCC(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)n2)cc1	764581383	XQVHKVXJUKIADW-UHFFFAOYSA-N	435.473	1.309	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1F	765185428	NKGBJIXUOWCYQM-UHFFFAOYSA-N	428.829	1.160	50	20	IDGD	
C[C@H](C(=O)NNC(=O)NCc1cccc(C(F)(F)F)c1)S(=O)(=O)C1CCOCC1	765308349	PDGDLBHOUNHFHR-LLVKDONJSA-N	437.440	1.518	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)COc3ccc([N+](=O)[O-])cc3)n[nH]2)cc1OC	765596912	BCZADFCWLKIEAK-UHFFFAOYSA-N	441.400	1.842	50	20	IDGD	
N#Cc1cccc(OCC(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)c1	765751481	LLUYLHBMLUKFFG-UHFFFAOYSA-N	441.919	1.556	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)[C@@]12CCC(=O)N1c1ccccc1S2	767275768	AJEBOKCGFOPLGD-QFIPXVFZSA-N	439.493	1.857	50	20	IDGD	
Cc1ccc(OCCCC(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c(C)c1	767464663	HJIUCNKQSRWUEG-HXUWFJFHSA-N	442.468	1.993	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)CO[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)C[C@@H](C)O1	767822657	MOIYRKYGBBINPI-BRWVUGGUSA-N	442.557	1.049	50	20	IDGD	
Cc1noc(C)c1S(=O)(=O)NCC(=O)NNC(=O)CSc1ccc(Cl)cc1	768522007	GFFZEYRNQYFQHD-UHFFFAOYSA-N	432.911	1.163	50	20	IDGD	
C[C@@H]1C[C@@H](NC(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)CCO1	770354505	HJTSPDFFUTXIHP-WBVHZDCISA-N	435.484	1.956	50	20	IDGD	
Cc1cc2c(N3CCC[C@H]3C(=O)NNC(=O)CNC(=O)c3cccs3)ncnc2s1	770529945	IHOONENHZJTFCA-ZDUSSCGKSA-N	444.542	1.607	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)NNc1ccccc1S(C)(=O)=O	770656771	MMRYOPNYNDHRLI-LLVKDONJSA-N	426.882	1.868	50	20	IDGD	
C[C@H](NS(=O)(=O)c1cccc(C(F)(F)F)c1)C(=O)NNC(=O)Cc1ccccc1F	770954829	HBCADJMBNAEYEO-NSHDSACASA-N	447.410	1.901	50	20	IDGD	
COC(=O)c1ccc2c(c1)CN(CC(=O)NNC(=O)c1ccc(OC)c(OC)c1)CC2	771452311	MFFDNTNRSGHIIL-UHFFFAOYSA-N	427.457	1.310	50	20	IDGD	
CNC(=O)COc1cccc(CC(=O)NNC(=O)c2cc(F)ccc2Br)c1	772224642	BOFULBBVSIBMDG-UHFFFAOYSA-N	438.253	1.717	50	20	IDGD	
N#Cc1cccc(NNC(=O)C(=O)Nc2ccc3c(ccn3CC(=O)N3CCOCC3)c2)c1	773698569	JMXAECJWQZZENS-UHFFFAOYSA-N	446.467	1.454	50	20	IDGD	
O=C(NNc1cnc2ccccc2n1)C(=O)Nc1cnn(-c2cnc3ccccc3n2)c1	773722161	AGCUYDSIGFSQRQ-UHFFFAOYSA-N	425.412	1.841	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2ccccc2CN(C)C(=O)OC(C)(C)C)n1	773724730	VTVFFZSKCUVBQO-UHFFFAOYSA-N	430.465	1.934	50	20	IDGD	
O=C(CCNS(=O)(=O)c1cccc([N+](=O)[O-])c1)NNc1ccc(C(F)(F)F)cn1	775243430	LMBLBEVXIDKDTD-UHFFFAOYSA-N	433.368	1.820	50	20	IDGD	
COC(=O)N1CCC[C@@H]([C@@H](C)NC(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)C1	776244473	NIOPTRNHMYYDSL-VXGBXAGGSA-N	434.501	1.780	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)cc1	776248806	OXNZZCJSTWPELR-UHFFFAOYSA-N	446.935	1.693	50	20	IDGD	
CSCCCCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	776257155	BLXNHCNZHLYLPA-UHFFFAOYSA-N	444.579	1.185	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)c1cnn(-c2cccc(Cl)c2)n1	777460850	FFVDDFKLDOYWIC-UHFFFAOYSA-N	433.255	1.652	50	20	IDGD	
O=C(NNC(=O)c1ccc2cccnn12)c1cccc(S(=O)(=O)NCc2ccccc2)c1	777791060	DAVBHRNZVGHOPQ-UHFFFAOYSA-N	449.492	1.888	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCOCC2)cc1C(=O)NNc1cc(Cl)ccn1	778453235	GOJHVKYOFJXFSA-UHFFFAOYSA-N	426.882	1.521	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N[C@H](CO)CC(F)(F)F	778587573	DHHVFZCXELOXNR-WPRPVWTQSA-N	428.205	1.860	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)[C@H]2CCN2C(=O)OC(C)(C)C)c2ccccc2c1=O	780170656	ABQIKVGNBVFPRO-OAHLLOKOSA-N	429.477	1.577	50	20	IDGD	
CC(C)(C)OC(=O)NCc1nnc(SCC(=O)NNC(=O)c2ccc(C#N)cc2)o1	780350862	YBYFFRSHUZWOGB-UHFFFAOYSA-N	432.462	1.519	50	20	IDGD	
C[C@H]1C(=O)CC[C@@H](C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)C1(C)C	780926477	LJQLISLCIWQIFS-WMZOPIPTSA-N	428.533	1.233	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2ccc(N3CCC(N(C)C)CC3)c(F)c2)nc1	782142503	UVHMRXBAIHNTJK-UHFFFAOYSA-N	430.484	1.842	50	20	IDGD	
COc1ccc(Cn2nccc2NC(=O)C(=O)NNc2ncncc2Cl)c(OC)c1	782166047	MXJCYMGZUTWSRO-UHFFFAOYSA-N	431.840	1.474	50	20	IDGD	
O=C(COC(=O)c1ncsc1-c1ccccc1)NNC(=O)[C@@H]1COc2ccccc2O1	782383467	BZVCZIGLFWCEJU-INIZCTEOSA-N	439.449	1.954	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H]1CCC[C@H](NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)C1	782547502	XWSPVGNQMVHZRZ-GJZGRUSLSA-N	444.496	1.442	50	20	IDGD	
O=C(NNc1ccc(F)cc1F)C(=O)Nc1cccc(S(=O)(=O)NC2=NCCC2)c1	783339469	CBBDGUDBCXUFLQ-UHFFFAOYSA-N	437.428	1.517	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2cccc(COc3cccc(F)c3)c2)CCS(=O)(=O)C1	783424931	GNOUTICHLPNYGO-FQEVSTJZSA-N	435.477	1.541	50	20	IDGD	
COc1ccc(C(=O)N2CCN(C)CC2)cc1NC(=O)C(=O)NN(C)c1ccccc1	783434275	GVLBSBJGFAIXNW-UHFFFAOYSA-N	425.489	1.189	50	20	IDGD	
CC(C)(C)C(=O)N=c1cc[nH]cc1C=NNC(=O)Cc1csc(N2CCOCC2)n1	783810194	NCDRHZLAOUWXRX-UHFFFAOYSA-N	430.534	1.474	50	20	IDGD	
Cc1ccc(NNC(=O)C(=O)Nc2ccccc2S(=O)(=O)N(C)C2CCCCC2)nn1	783948003	PKYVNNKONAJQDB-UHFFFAOYSA-N	446.533	1.820	50	20	IDGD	
Cc1cc(N2CCC(NC(=O)NNc3ccc(S(=O)(=O)NC(C)C)cn3)CC2)n[nH]1	784660877	GGCVLZRPAAVRJJ-UHFFFAOYSA-N	436.542	1.095	50	20	IDGD	
C[C@H]1CN(c2ccccc2NC(=O)C(=O)NNc2cccc(S(C)(=O)=O)c2)C[C@@H](C)O1	784841408	IOJPSXYSEJJFRH-GASCZTMLSA-N	446.529	1.786	50	20	IDGD	
CCOc1ccc(C(=O)N2CCCCC2)cc1NC(=O)C(=O)NNc1ncc(F)cn1	784949091	DWUQFVYEFQVXEJ-UHFFFAOYSA-N	430.440	1.722	50	20	IDGD	
CC(=O)N1CCN(c2cccc(NC(=O)C(=O)NNc3ccc(C#N)c(Cl)c3)c2)CC1	785092087	AHQMRBWPQHGYPQ-UHFFFAOYSA-N	440.891	1.962	50	20	IDGD	
CCN1CCN(c2ccc(NC(=O)C(=O)NNc3nccc(N(CC)CC)n3)cc2)CC1	785225181	FXVKCCBVZYLIJJ-UHFFFAOYSA-N	440.552	1.547	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)[C@H](O)Cc2cccc(C(F)(F)F)c2)n1	785747565	ZAVXULAEOKAUBD-CYBMUJFWSA-N	445.419	1.307	50	20	IDGD	
O=C(COC(=O)[C@@H]1[C@H](C(F)(F)F)[C@H]2CC[C@H]1O2)NNC(=O)c1ccc([N+](=O)[O-])cc1	785802036	UXMOORPQRGYMFO-MHDGFBEUSA-N	431.323	1.255	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCc1ccc(CCN(C)C)cc1	786103677	QUFCSJRSVLNUPU-UHFFFAOYSA-N	446.577	1.536	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(O)ccc2C(F)(F)F)c1	788618622	BQAKTGWDUCUJTE-UHFFFAOYSA-N	431.392	1.736	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NCc2cccn(CC)c2=O)c2ccccc2c1=O	789295797	YLIOEIWLBMMMMH-UHFFFAOYSA-N	438.488	1.522	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)NC[C@H](Cc1cccc(F)c1)C(=O)N1CCOCC1	789309915	INLYVJMUCDHGRA-SFHVURJKSA-N	442.491	1.796	50	20	IDGD	
COC(=O)c1cccc(Cl)c1S(=O)(=O)NNC(=O)c1cc(OC)cc(OC)c1	790046343	ZHIDAGUVMSIISR-UHFFFAOYSA-N	428.850	1.767	50	20	IDGD	
Cc1ccc(C(=O)N2CCOCC2)cc1NC(=O)C(=O)NNc1cccc(F)c1[N+](=O)[O-]	790998022	ABQCENLSKAXPMA-UHFFFAOYSA-N	445.407	1.597	50	20	IDGD	
CC(C)(C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)C(F)F	791445844	SVVXHEPGOQSEGH-UHFFFAOYSA-N	433.477	1.079	50	20	IDGD	
C[C@@](O)(Cn1cc(C(F)(F)F)ccc1=O)C(=O)NNC(=O)Cc1c[nH]c2ccccc12	792023806	WGGJSAXOBIZCKJ-LJQANCHMSA-N	436.390	1.490	50	20	IDGD	
Cn1c(NNC(=O)CCN2CCN(C(=O)OC(C)(C)C)CC2)nc2ccccc2c1=O	792177375	ACUWJQUILAEPRY-UHFFFAOYSA-N	430.509	1.319	50	20	IDGD	
Cc1ccccc1NC(=O)NNC(=O)C(=O)Nc1ccc(Cc2nnc3n2CCC3)cc1	792277002	FLTNXXODNUMLSB-UHFFFAOYSA-N	433.472	1.915	50	20	IDGD	
C[C@@](O)(CN1C(=O)NC2(CCCC2)C1=O)C(=O)NNc1ccccc1Br	793709826	URKWOTMGZDYLSC-MRXNPFEDSA-N	425.283	1.508	50	20	IDGD	
CCCS(=O)(=O)Nc1ccccc1C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	794722578	XSBCABFEGMDLKO-UHFFFAOYSA-N	440.547	1.846	50	20	IDGD	
Cc1cccc(-c2cc(Cl)ccc2NC(=O)C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)c1	796998231	CGBDGVZPDBWNCL-CQSZACIVSA-N	449.916	1.836	50	20	IDGD	
COC(=O)c1cc(F)cc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2F)c1F	797010809	HCYVJKDKGAFDOD-UHFFFAOYSA-N	429.738	1.944	50	20	IDGD	
COC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)c1C	798043382	PRIGZHFUVQMIEU-UHFFFAOYSA-N	438.444	1.389	50	20	IDGD	
CN1C(=O)COc2cc(NC(=O)C(=O)NNC(=O)c3ccc(Cl)cc3Cl)ccc21	799260547	PZKUMKMPWXYNRU-UHFFFAOYSA-N	437.239	1.748	50	20	IDGD	
Cc1cccc(-n2c(C)cc(/C=C(\C#N)C(=O)NCCC(=O)NS(C)(=O)=O)c2C)c1	800553209	JZXGIZGFOMZMPK-LDADJPATSA-N	428.514	1.892	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1ccc(OCC(F)(F)F)c(Cl)c1	800569383	WBTBYOBYRKSPPU-SSDOTTSWSA-N	432.808	1.372	50	20	IDGD	
C[C@@H](CCNS(=O)(=O)c1ccccc1)NC(=O)NNC(=O)COc1ccc(F)cc1	802529055	OTAXOQWZLKYTGB-AWEZNQCLSA-N	438.481	1.292	50	20	IDGD	
CSC[C@H](C(=O)NNc1ccc(-n2ccnc2)nn1)N1C(=O)[C@H]2CCCC[C@H]2C1=O	804955934	ZGCUZIGCJTXITE-HZSPNIEDSA-N	429.506	1.012	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2cc(Br)ncc2Cl)n1	805625149	KVKQYTHZNYJJRO-UHFFFAOYSA-N	447.698	1.809	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2cc(Cl)cc3c2OCC(=O)N3)c1	806973358	MVJNNXPDWLZJTC-UHFFFAOYSA-N	446.847	1.453	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)C(=O)Nc1nc(-c2ccco2)cs1	807005738	IVGCHEJKCOXXRQ-UHFFFAOYSA-N	447.498	1.926	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)C(=O)Nc1ccc(I)cc1	807428709	JAAHJHHWGVJJAL-UHFFFAOYSA-N	449.212	1.349	50	20	IDGD	
Cc1cc([N+](=O)[O-])ccc1NNC(=O)C(=O)Nc1ccc(C)c(S(=O)(=O)N(C)C)c1	807457136	RIPMKDBRZGYDFK-UHFFFAOYSA-N	435.462	1.544	50	20	IDGD	
Cc1ccc(C(=O)N2CCOCC2)cc1NC(=O)C(=O)NNc1nccnc1C1CCC1	807459683	BSZLKKWVASNNAF-UHFFFAOYSA-N	438.488	1.607	50	20	IDGD	
NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2c[nH]c3ccccc23)c(OCC(F)F)c1	810385352	OXIFWBWUMHBRFK-UHFFFAOYSA-N	445.382	1.310	50	20	IDGD	
CCOc1cc(Br)c(F)cc1NC(=O)C(=O)NNc1nccnc1OC	810389158	AAENYFKAWJMOBI-UHFFFAOYSA-N	428.218	1.867	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2cc3ccccc3o2)cc1	810481980	BILRDNFYXBTQFL-UHFFFAOYSA-N	430.442	1.131	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(C#N)cc(N(C)C)c2)c1	814361454	WWCPSWVBKPIPCK-UHFFFAOYSA-N	443.529	1.730	50	20	IDGD	
CC(=NNC(=O)Cn1c(C)nc2ccccc21)c1ccc(S(=O)(=O)CC(N)=O)cc1	814730618	RLXHBNPBYATGQC-UHFFFAOYSA-N	427.486	1.144	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)c1cnn(C)c1I	814842328	CAQKGQVDPIKBFT-UHFFFAOYSA-N	434.621	1.762	50	20	IDGD	
COCCN1[C@H]2CC[C@H]1CC(N(C)CC(=O)NNC(=O)c1ccc(OC)c(OC)c1)C2	815209616	ACEWVEIDUUQGNP-IRXDYDNUSA-N	434.537	1.038	50	20	IDGD	
Cc1nc(Cn2nnc(NC(=O)C(=O)NNc3ccc(Br)c(C)c3)c2C)no1	815592493	JRDMKQBDJUQHLZ-UHFFFAOYSA-N	449.269	1.479	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)c1nccnc1C(=O)Nc1ccc(Cl)cc1	819727228	CDJWKYISVHKBOR-UHFFFAOYSA-N	435.868	1.933	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)cc1C	913422991	BEWPSZXYFRYOKV-UHFFFAOYSA-N	427.486	1.433	50	20	IDGD	
COCCCNC(=O)NNC(=O)c1ccc(CN(C)S(=O)(=O)c2ccc(C)cc2)cc1	915879585	AQGMUUQXQILUCL-UHFFFAOYSA-N	448.545	1.796	50	20	IDGD	
CCO[C@@H]1C[C@H]1C(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccc(OC)cc2)c1	916095740	QPEDUSWQZKCDJL-QZTJIDSGSA-N	433.486	1.682	50	20	IDGD	
Cc1oc(C)c(S(N)(=O)=O)c1C(=O)NNC(=O)COc1ccc(Br)cc1	916108588	UELNHAOYJJXHCF-UHFFFAOYSA-N	446.279	1.146	50	20	IDGD	
O=C(NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1)C(=O)Nc1ccccc1	916160484	PXTJUBJEPPPOBF-UHFFFAOYSA-N	444.494	1.949	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NC[C@H](C)N2CCC[C@@H](C)C2)cc1	916450563	SNPMUPVOYHQEHQ-SJORKVTESA-N	439.582	1.066	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H](C)CN2CCCCC2)c1	916461751	JEWXOHDLTSKZEE-INIZCTEOSA-N	439.582	1.536	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)NC[C@@H](c1ccccc1)N1CCOCC1	916509033	JDFPXUBYWBVCLA-SFHVURJKSA-N	428.489	1.478	50	20	IDGD	
Cc1ccc(NCCCNC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)nc1	916521322	ACPGTNIDGDPYQW-UHFFFAOYSA-N	439.564	1.735	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)NCc2cccc(OCC(=O)NC)c2)cc1OC	918096271	QECVELUTNARNAP-UHFFFAOYSA-N	430.461	1.363	50	20	IDGD	
O=C(CCOCc1ccccc1)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	918141826	XFSNVJBMMWQHRF-UHFFFAOYSA-N	447.513	1.075	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)CCn2cccn2)c1	918187167	WXAXTUYNYQYTGP-UHFFFAOYSA-N	443.485	1.544	50	20	IDGD	
Cc1nccn1CCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	918225278	WCBAXTQYSQMKBS-UHFFFAOYSA-N	448.549	1.400	50	20	IDGD	
CC(=O)Nc1ccc(F)c(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1	919678254	ZTIBPMXAYYUGTD-UHFFFAOYSA-N	448.476	1.643	50	20	IDGD	
O=C(NCCN1C(=O)c2ccccc2C1=O)NNC(=O)c1ccc(Br)s1	919788973	ZGYDWOMOTQZGJF-UHFFFAOYSA-N	437.275	1.751	50	20	IDGD	
CNC(=O)NNC(=O)c1ccc(NS(=O)(=O)c2ccc(Br)s2)cc1	919879280	YKUYRXFKBQLQEC-UHFFFAOYSA-N	433.309	1.885	50	20	IDGD	
Cc1nc(COc2ccc(F)cc2)sc1C(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1	919888436	CRDWFWOGBAIAOF-LBPRGKRZSA-N	442.494	1.301	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)NCCc1cc(OC)c(OC)cc1[N+](=O)[O-]	919902587	SAJWSIFNTOSSHY-UHFFFAOYSA-N	432.433	1.736	50	20	IDGD	
CCOCCOc1ccc(S(=O)(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1	920394970	IYTLGVAGKQDFHP-UHFFFAOYSA-N	442.515	1.129	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)NCc2cnn(C)c2)cc1	920852373	WUIAVYAXWRASPV-MFOYZWKCSA-N	433.472	1.391	50	20	IDGD	
O=C(COC(=O)c1ccc(CN2C(=O)CNC2=O)cc1)NNC(=O)c1cccc(Cl)c1	921180995	TYIVFRWGEXAJIY-UHFFFAOYSA-N	444.831	1.010	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](C(=O)NNc1ccc(S(=O)(=O)C(F)F)cc1)C(C)(C)O	1117670195	ZBKYBWKQSHRUHN-GFCCVEGCSA-N	437.465	1.790	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)Nc2ccc3c(c2)C(=O)NCC3)CC1	1254729377	GUQMRRNUPXQASZ-UHFFFAOYSA-N	431.493	1.772	50	20	IDGD	
CS(=O)(=O)Nc1cc(C(=O)NNC(=O)c2n[nH]c3c2CCCC3)cc(C(F)(F)F)c1	1322374089	HTYUTDIKPLOQQG-UHFFFAOYSA-N	445.423	1.754	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)[C@]3(F)CCOC3)c2)cc1	1326636503	OOXBOEQXEHGETC-IBGZPJMESA-N	437.449	1.386	50	20	IDGD	
COC(=O)Cc1cccc(S(=O)(=O)NNC(=O)c2ccc(Br)cc2)c1	1330030528	URPLGOYRAKJYLN-UHFFFAOYSA-N	427.276	1.788	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)CCN3Cc4ccccc4C3=O)C2)C1	1778187106	UIPYRKUVDDNFID-PGRDOPGGSA-N	449.935	1.116	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(Cl)nn3)C2)C1	1779432791	PMQNWKZYBUZINQ-BZNIZROVSA-N	431.718	1.747	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnn(Cc4ccccc4)c3)C2)C1	1779599164	IHKINTZIZUVDSY-UGKGYDQZSA-N	446.935	1.629	50	20	IDGD	
COc1nc(C)ccc1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2	1779743596	OSDZONDZEHDYEA-FZKQIMNGSA-N	426.311	1.626	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3c[nH]c4ccc(OC)nc34)C2)C1	1780045792	FRTCIXPLIKTZNV-XOBRGWDASA-N	436.896	1.269	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(CCN(C(=O)c3cnc4snnc4c3)C2)C1	1780069339	QXTVOFKTMQKNMO-GOSISDBHSA-N	435.582	1.381	50	20	IDGD	
Cc1ccccc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)C2	1780339523	SCYXIFLEHPAFJZ-AUSIDOKSSA-N	430.549	1.496	50	20	IDGD	
COc1cc(OC)cc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)c1	1780663040	SHVNWSKUIBPCHH-YJBOKZPZSA-N	445.285	1.838	50	20	IDGD	
CC(=O)N[C@@H](C(=O)N1CC[C@]2(CN(C(=O)[C@H](F)Cl)CCO2)C1)c1cccc(Cl)c1	1780930258	PRVGXXSQBHQODP-JTDSTZFVSA-N	446.306	1.882	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(-n4c(O)nnc4O)cc3)CCO2)C1	1781217384	IOIYNTAOLSBBIQ-YWZLYKJASA-N	449.895	1.139	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)[C@@H](NC(C)=O)c3ccc(F)cc3)CCO2)C1	1781218935	UHZNXOJRPOJWSH-LVCYWYKZSA-N	439.915	1.850	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(S(C)(=O)=O)ccc3F)CCO2)C1	1781219946	SSMXFFHPLKZANF-KXBFYZLASA-N	446.928	1.690	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)c3cccc4c3NC(=O)C4)CCO2)C1	1781232214	HVTJPPXSGOXMJS-UXHICEINSA-N	440.327	1.861	50	20	IDGD	
Cc1nn(C)c(C)c1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)Br)C1	1781997064	ARRIYVBXYFSUBW-IOHHAYIISA-N	441.370	1.948	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(CO)on1)C2	1782003914	XYQADXFUIBQYHV-JDSLSITLSA-N	430.299	1.078	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCc1ccccc1)C2	1782210681	BZCHWSCKOYOQOX-HYBUGGRVSA-N	444.576	1.506	50	20	IDGD	
CC(C)(C)OC(=O)N1CC2(C[C@@H]2C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](F)Cl)CCO3)C1	1783448917	CVHKCEZEJNIWRH-CKNLXJGOSA-N	445.919	1.608	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](C)Br)C3)C2)cc1OC	1783537305	NKWNKBANFYUZIZ-BFUOFWGJSA-N	441.322	1.931	50	20	IDGD	
COc1ccc(/C=C/C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)c(F)c1	1783655952	PSNOOHGMOQLGHI-SXZYKWEXSA-N	426.872	1.277	50	20	IDGD	
Cc1cc(NC(=O)CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)C(C)(C)CCl)[C@H]3C2)no1	1783850726	QGRXLRPCMCATHZ-KKUMJFAQSA-N	440.928	1.556	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@H](C(=O)N2CC[C@@]3(CN(C(=O)[C@@H](F)Br)CCO3)C2)C1	1783866780	XAKOHGNAKVXQEK-LWGWVAHUSA-N	449.317	1.486	50	20	IDGD	
CC#C[C@H](CC(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](Cl)COC)C2)C1)c1ccc(O)cc1	1783879158	PDCQPJHKXULPFL-XQFWAAQXSA-N	448.947	1.973	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)Cc3cc(F)ccc3OC)C2)C1	1784087811	QRFPLLJJTJOHET-OXQOHEQNSA-N	428.888	1.461	50	20	IDGD	
Cc1ccc(NCCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]3C2)c(C)c1	1784091279	MSZCKKIJXWVCLK-XEYPJELSSA-N	437.968	1.685	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C=C/c3ccsc3)[C@H]2C1	1785408117	RDXLHVNCCFYIQA-PNTMDVIESA-N	434.562	1.114	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCN3CCN(C)CC3)[C@H]2C1	1786725950	NKOMOCFAHSXYHU-VJANTYMQSA-N	429.005	1.011	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)Nc3nccs3)[C@H]2C1	1787490058	XXDVYBADQRNNKN-YTFOTSKYSA-N	430.958	1.177	50	20	IDGD	
CC(=O)Nc1ccc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)C(Cl)Cl)C[C@@H]32)cc1	1788190809	PPQVUCNPGGOUFZ-XIRDDKMYSA-N	442.343	1.971	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC1(c2ccc(NC(=O)c3cc(=O)n4[nH]nnc4n3)cc2)CCC1	1788408496	FVXVIVYVEMRMID-CYBMUJFWSA-N	429.868	1.578	50	20	IDGD	
C[C@@H](Nc1nccs1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]2C1	1788762726	QDUZSZMYZGBIOR-UGUYLWEFSA-N	440.642	1.775	50	20	IDGD	
CN(C)c1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CO[Si](C)(C)C)C[C@@H]32)cn1	1789025389	XCESSURPSYEDNA-BZSNNMDCSA-N	434.613	1.592	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nccc4[nH]ccc34)C[C@@H]21)[C@H](F)Br	1789923075	RTKVYGHCITYFOD-ZAJUMQRFSA-N	439.285	1.847	50	20	IDGD	
COc1cnc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](C)Br)[C@H]3C2)c(F)c1	1791057320	SLFQVBKDWVLHRJ-UHXUCMFUSA-N	444.301	1.606	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)[C@@H]1CCc2nc[nH]c2C1	1791530196	HPKPLEAMJIKWTM-NQMOMTLDSA-N	443.317	1.185	50	20	IDGD	
Cc1cc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)CBr)ccn1	1792868825	QRLFXWDDAOXPSF-UEILYKACSA-N	438.366	1.943	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)Oc1cccnc1)C2	1792873004	IOHNQXJBXQYIHB-LBKYZSNHSA-N	440.338	1.470	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1(Br)CC1)C2	1792874030	JJFBYBQIZWGZJQ-WISYIIOYSA-N	438.160	1.535	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)C(C)C	1793231183	BUVBZPMNILJBKX-YGTYGHESSA-N	433.461	1.789	50	20	IDGD	
CN(CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnco1)NC(=O)NCc1ccccc1	1793803120	WANDTCWFNVNZKR-BCDXTJNWSA-N	440.504	1.273	50	20	IDGD	
COc1ncc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CO[Si](C)(C)C)C3)cc1F	1794364363	OTRATTURDTUDSR-XOIINTDNSA-N	425.533	1.284	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C#Cc1ccccc1	1795690024	YDRFPUVUYAQZOE-WRVZLUGYSA-N	431.496	1.810	50	20	IDGD	
Cc1c(F)ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Br)C3)c1N	1795702573	UDZKCOKFMBQIAM-ANGCBRKESA-N	432.265	1.610	50	20	IDGD	
CC[C@@H](NC)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1796174950	UIQKVYUTRBKEGE-JKJDWNRSSA-N	430.977	1.755	50	20	IDGD	
Cn1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)c(C(F)(F)F)c1	1797155544	ILSKEDKOTWUUID-MUJYYYPQSA-N	449.238	1.289	50	20	IDGD	
Cc1nc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)CBr)C3)sc1C	1798405910	HLBRNEBLZUQALV-WBMYTEFPSA-N	430.368	1.994	50	20	IDGD	
COc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)C(Cl)Cl)C3)c([N+](=O)[O-])cc1O	1798595181	NRXFXGPUDAFBDK-ICCCGROCSA-N	448.259	1.316	50	20	IDGD	
O=C1CCc2ccc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@@H](F)Br)cc21	1799347200	MUMWFDKWBSPKHG-DLTLXFJOSA-N	439.281	1.709	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccn3cncc3c1)C2)[C@@H](F)Br	1799350132	RIDNMXKWKCJZGP-AYRXBEOTSA-N	425.258	1.228	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cncc(S(C)(=O)=O)c1)C2	1800078096	STSSDKMPZFXYPJ-KYZVSKTDSA-N	448.372	1.973	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CC(c2ccccc2)=NN1	1800158721	XTUVNQVWYZROKL-UIVXMWCNSA-N	449.349	1.126	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@](C)(Cl)CCl)C2	1800230986	GVSWVYXHSWSKAW-KCRLFOLJSA-N	425.309	1.374	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CC[C@H](C(=O)OC)C1)C2	1800637635	FLYYTCVFPNAVGX-YUDUXTHKSA-N	445.354	1.339	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c(c1)CCCO3)C2	1800763031	MSUMSRUZQBYZND-PTOXDTDZSA-N	437.334	1.998	50	20	IDGD	
COc1cccc(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CCC(=O)NN(C)C)C3)c1C	1802051553	WAWPWUKRIUNCFZ-REPLKXPHSA-N	430.549	1.557	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1(NC(=O)OC(C)(C)C)CC1	1802224518	BMKCQPIYPQYWMJ-LXTVHRRPSA-N	429.945	1.651	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)c1cc(Cl)cnc1O	1802331708	YQQZDQDCRNFOEH-VBNZEHGJSA-N	439.299	1.755	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cn(C)cc1C(F)(F)F)C2	1802336283	LMPBBTVTFZIGCU-BTTYYORXSA-N	443.470	1.669	50	20	IDGD	
O=C(CCc1ccco1)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1804585026	RYDDEFTZHXUUOA-AUSIDOKSSA-N	447.300	1.307	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)c2cccc(=O)n2O)[C@@H]1c1cccnc1	1804952399	QZANHNQMTYOHFJ-QEORTHHSSA-N	449.305	1.584	50	20	IDGD	
Cc1cc[nH]c1C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1	1805010021	SVRLORFOCGDHHO-OXQOHEQNSA-N	447.499	1.350	50	20	IDGD	
Cc1ccsc1C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1805397601	ULIPAFRXYSGKSV-UYAOXDASSA-N	449.341	1.765	50	20	IDGD	
CN1Cc2ccccc2C[C@H]1C(=O)N1CCC2(CCCN(C(=O)[C@H](O)CCl)C2)CC1	1805518191	PTCPMUFKPPECDD-VQTJNVASSA-N	433.980	1.874	50	20	IDGD	
Cc1ccc(C(=O)NCC(=O)N2CCC3(CCCN(C(=O)[C@H](O)CCl)C3)CC2)cc1	1805529139	MVGGRJSXWFRLOZ-GOSISDBHSA-N	435.952	1.556	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)c2ccon2)[C@H]1c1cccnc1	1805996638	WEUHQEWMCOYMNZ-AMZMXHDESA-N	449.471	1.523	50	20	IDGD	
O=C(COC1CCCCC1)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1	1809968258	UADZXLDTZFADKZ-UHFFFAOYSA-N	442.365	1.561	50	20	IDGD	
Cc1cc(CCC(=O)N2CCC3(CCCN(C(=O)c4cccc(B(O)O)c4)C3)CC2)ccn1	1809975010	NGVRXZQSPPFFDD-UHFFFAOYSA-N	449.360	1.547	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)c1cc2cn[nH]c2cn1	1810082599	KJFADWXBQFKIIV-DOPJRALCSA-N	428.880	1.272	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)c1cc2ncsc2[nH]1	1810577385	HOEQCPJMYIOKFZ-RCBQFDQVSA-N	433.921	1.939	50	20	IDGD	
CCNC(=S)NCC(=O)NC[C@H]1CCN(C(=O)C(C)(C)CCl)[C@H]1c1cccnc1	1812327989	CIJJUEHUOHCGMX-WBVHZDCISA-N	440.013	1.836	50	20	IDGD	
C=CC[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1	1812588168	CCSFIYFQZLUDQJ-KNBMTAEXSA-N	436.516	1.612	50	20	IDGD	
Cc1nnc(CC(=O)N2CC[C@H](CNC(=O)[C@H](C)Br)[C@@H]2c2cccnc2)o1	1812863281	GJKVMQVMQSVFQI-KHIZAZIESA-N	436.310	1.805	50	20	IDGD	
O=C(CCc1ccoc1)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1813523790	WXUKATVOGBCCBT-OFNKIYASSA-N	447.300	1.307	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)C23CC(C2)C3)[C@@H]1c1cccnc1	1813644441	KFYSQYVFGJGFIL-UYEBVHNJSA-N	434.500	1.200	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](C)CBr)n[nH]1	1814780046	FFLQERLTOJZKRG-NTZNESFSSA-N	443.346	1.880	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](N)c3ccccn3)sc2C1	1815022243	KHECPEKJDYESTD-RBZYPMLTSA-N	438.351	1.934	50	20	IDGD	
C=CCOCCCC(=O)Nc1cc([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1	1815208061	QYYJCLFGAQTWQV-QGZVFWFLSA-N	434.541	1.758	50	20	IDGD	
Cc1ccc(CC(=O)Nc2cc([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)cn1	1815979064	PDRRNJKDXPPODJ-GOSISDBHSA-N	441.536	1.721	50	20	IDGD	
C[C@H](NC(=O)c1ccccn1)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](F)Cl)sc2C1	1817132884	AMWJWQIACSVJPF-IMSIIYSGSA-N	439.900	1.803	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)C23CC(F)(C2)C3)[nH]n1)c1cccc(B(O)O)c1	1817474398	QZWYSBOTFIFCFH-YMTQGWHGSA-N	426.257	1.288	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc[nH]n2)[nH]n1	1818110880	RSNDPYBNDYJYMS-UPVZUOOXSA-N	437.464	1.573	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2nc3ncccn3n2)n[nH]1	1818621219	URZHEPWJTVDHLC-ZYHUDNBSSA-N	447.297	1.937	50	20	IDGD	
CC(=O)C[C@H](C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819404215	DTKUNNWPVUTIOG-SJCJKPOMSA-N	441.492	1.329	50	20	IDGD	
CC(C)NC(=O)OC(C)(C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1	1820739357	FXNDMHGOMAEBNV-UONOGXRCSA-N	443.932	1.915	50	20	IDGD	
C#CC(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)[nH]n1	1821874785	BUFJWWCFLNDCAC-SFHVURJKSA-N	437.504	1.381	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CN1CCNC1=N)CC2	1822863976	WFOCPFUMTWEZOU-JDNHERCYSA-N	433.365	1.131	50	20	IDGD	
CN1N=C(C(=O)N[C@H]2CCc3nc(NC(=O)[C@@H](F)Br)sc3C2)CCC1=O	1823002971	VUOYOVSGKAWJBY-JVXZTZIISA-N	446.302	1.354	50	20	IDGD	
CC[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CNC(=O)OC)CC2	1825453128	PEFPVMWZUAXYEM-RKDXNWHRSA-N	433.328	1.585	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC([C@H]2CCCCN2C(=O)CN2CCOCC2)CC1	1826716867	YBUKTXLDYVCPAN-LJQANCHMSA-N	425.646	1.790	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)C(C)(C)NCCC#N)CC1	1826896092	BZJMRFNLZZWXRL-IBGZPJMESA-N	448.612	1.261	50	20	IDGD	
CN[C@H](CC(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H](F)Br)CC1)C(=O)O	1826946778	ZFYYDGQIFQYNQB-UMVBOHGHSA-N	436.322	1.359	50	20	IDGD	
O=C(CCN1CCCC1)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827060305	WJWWQJODEYUVSA-JOCHJYFZSA-N	441.381	1.086	50	20	IDGD	
Cc1cc(CC(=O)N2CCCC[C@@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)n[nH]1	1829015366	AAPDSUUDABJRBZ-LJQANCHMSA-N	432.569	1.253	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)C1(O)CCC1)CCO2	1829731529	NRRNCTLVDKFNAF-RKVPGOIHSA-N	447.370	1.025	50	20	IDGD	
CS(=O)(=O)CC(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](F)Br)CC1	1830374628	KOMDRFTYTOULFA-GXTWGEPZSA-N	427.336	1.341	50	20	IDGD	
O=C([C@H](F)Cl)N1CCOC[C@@]2(C1)CN(C(=O)C13CC(C(F)(F)F)(C1)C3)CCO2	1831701234	CTUAUYQPLPQMKA-IWNGFBJFSA-N	428.810	1.710	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)C2=COCCC2)CC1	1831914408	BSWHSIXVEBABEV-NRFANRHFSA-N	426.322	1.294	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)C2=COCCC2)CC1	1831915373	PWBVFWFLOFDNJH-NRFANRHFSA-N	426.322	1.294	50	20	IDGD	
C#CCO[C@H](C)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](C)CBr)CC2)CC1	1833265264	RQVKQAXDHCVHCF-JKSUJKDBSA-N	442.398	1.627	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)cnc1C	1833298577	NEMLHAZBWJNJGE-OAQYLSRUSA-N	435.597	1.620	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)Cc3c(F)cccc3F)CC2)CC1)[C@H](O)CCl	1833313239	BJLXGOISWANAKI-LJQANCHMSA-N	443.922	1.679	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnc(N(C)C)o3)CCO2)C1	1833896168	QJSPWNQFGUCLPK-KUHUBIRLSA-N	428.917	1.218	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccn3C)CCO2)C1	1833911724	HUNIJAGLAUPUFK-KBXCAEBGSA-N	428.327	1.269	50	20	IDGD	
Cc1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)n1	1834051595	VDSWUHZJPLJGFE-YOEHRIQHSA-N	430.274	1.151	50	20	IDGD	
O=C(CCBr)NC1CCN(C2CCN(C(=O)CCc3cn[nH]c3)CC2)CC1	1834422508	QTPOACPDGZRSAI-UHFFFAOYSA-N	440.386	1.699	50	20	IDGD	
CCCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1	1834881890	AZAPIZLAPCCOSE-NRFANRHFSA-N	449.460	1.390	50	20	IDGD	
COc1ccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)cc1	1835071105	AWCHAQYXAWRVRU-IBGZPJMESA-N	431.316	1.498	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(-n4cnnc4)cc3)CCO2)C1	1835498508	JGYQICLGKROEIW-GHTZIAJQSA-N	447.923	1.355	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3n[nH]cc3[N+](=O)[O-])CC2)CC1	1835869309	PRRHLMGQUJUCLT-AWEZNQCLSA-N	426.905	1.521	50	20	IDGD	
Cc1nc(C(=O)N2CCOC[C@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)sc1C	1837715235	DHMFOPAPKOFZOI-IBGZPJMESA-N	441.626	1.681	50	20	IDGD	
O=C(c1cccnn1)N1CCC(OC2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1838452686	BAVCFAJMIDNWKX-OAHLLOKOSA-N	429.290	1.779	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(COCCN(C(=O)C(C)C)C2)C1	1838528290	OJHWREIEKSUATD-NRFANRHFSA-N	449.460	1.246	50	20	IDGD	
O=C(CCC(F)(F)F)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839199482	ORNLVZWUYXSFLW-WCQYABFASA-N	435.212	1.476	50	20	IDGD	
O=C(c1ccc([N+](=O)[O-])cc1F)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1839278031	YOPGXFUDOLVJOZ-WMLDXEAASA-N	433.795	1.338	50	20	IDGD	
O=C(c1ccc2ccnn2c1)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1839571082	ACNAWAVPRSFXJM-GOSISDBHSA-N	427.288	1.208	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3[nH]ccc3C)C2)C1	1839962327	ATSXYVIBLAGPIG-KSSFIOAISA-N	428.327	1.567	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4sccn4c3)C2)C1	1840151967	SLKDFRYAFTZYOK-BEFAXECRSA-N	441.937	1.325	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCCc3cccnc3)C2)C1	1840156182	JMZALXNPGKJBBD-NQIIRXRSSA-N	439.940	1.115	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccccc3NC(C)=O)CCO2)C1	1840724945	SHOHLYCEDSKZIQ-UTKZUKDTSA-N	437.924	1.732	50	20	IDGD	
COc1cc(F)ccc1CC(=O)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1840935507	HXCPBCUOYBNDNL-LJQANCHMSA-N	449.306	1.637	50	20	IDGD	
CC(C)(C)OC(=O)NC1CCC(C(=O)N2CC3(CCCN3C(=O)[C@@H](O)CCl)C2)CC1	1841354700	PRQWERLXYINYKC-GPANFISMSA-N	443.972	1.873	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)[C@H]2C[C@@H]2c2ccc(F)c(F)c2)C1	1841397681	UZEMRVWNQRPYLZ-MSOLQXFVSA-N	440.255	1.265	50	20	IDGD	
O=C([C@@H](O)CCl)N1CC2(CCCN2C(=O)c2cc(=O)c(OCc3ccccc3)c[nH]2)C1	1842131071	IRTTUXHNPLFNJD-SFHVURJKSA-N	445.903	1.371	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)CC[C@@H]2CNc3ccccc3C2)C1	1842957909	RVRPJDIGILEYJZ-SFHVURJKSA-N	441.576	1.627	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC12CN(C(=O)C1(c3cccc(Cl)c3)CC1)C2	1843011303	QIOLXQZQNQNYCN-UHFFFAOYSA-N	438.720	1.569	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)Cc2ccn(C)n2)C1	1843056522	KLCSNGYLCRWFOE-UHFFFAOYSA-N	441.444	1.313	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)N1CCCC12CN(C(=O)c1ccc(B(O)O)cc1)C2	1844982755	HQPPCBWWMQJHFQ-UHFFFAOYSA-N	428.681	1.159	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC12CN(C(=O)Cc1ccc(S(C)(=O)=O)cc1)C2	1846176406	GTQYIUINNMOMQU-ZDUSSCGKSA-N	443.363	1.619	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC12CN(C(=O)c1cnc3c(c1)NC(=O)CS3)C2	1846178848	WXQGJYPMWDBFKG-SNVBAGLBSA-N	439.335	1.726	50	20	IDGD	
COC(=O)NCC(=O)N1CCCC12CN(C(=O)[C@@H](Br)Cc1ccccc1)C2	1846512633	GEKMWTIAMPUCTN-HNNXBMFYSA-N	438.322	1.552	50	20	IDGD	
CC(=O)N[C@H](C(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12)C(C)C	15903405	HFOUWBZLOSZLFL-IBGZPJMESA-N	435.484	1.367	50	20	IDGD	
O=C(NNC(=O)C1CCN(C2=NS(=O)(=O)c3ccccc32)CC1)c1ccccc1O	17575044	BIGNHYRBOVNFBT-UHFFFAOYSA-N	428.470	1.014	50	20	IDGD	
CCOc1ccccc1N1C[C@H](C(=O)NNC(=O)c2cc(Br)c[nH]2)CC1=O	24122377	UUKBHYHDRHPRHA-LLVKDONJSA-N	435.278	1.990	50	20	IDGD	
COc1ccc(CN2C[C@@H](C(=O)NNC(=O)c3cc(OC)cc(OC)c3)CC2=O)cc1	726499010	QMPGFMPGEBKKCH-INIZCTEOSA-N	427.457	1.522	50	20	IDGD	
CNS(=O)(=O)c1cccc([C@@H](C)NC(=O)NNC(=O)c2ccc3c(c2)OCCO3)c1	727607986	JTQJPJVNWNDICW-GFCCVEGCSA-N	434.474	1.071	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(Cl)c(S(=O)(=O)NNC(=O)c2ccccc2)c1	728260575	JEMMXJKWYDFFAK-UHFFFAOYSA-N	445.950	1.994	50	20	IDGD	
CSCC[C@@H](NC(=O)c1ccc([N+](=O)[O-])o1)C(=O)NNC(=O)c1cccc(C#N)c1	728871252	SWPLTMCILUQKAV-CYBMUJFWSA-N	431.430	1.372	50	20	IDGD	
CCCN(CC(=O)NNC(=O)Cc1nc(C)cs1)[C@@H]1CCN(C(=O)OC(C)(C)C)C1	729483212	HKKTYWHHRSKCQR-OAHLLOKOSA-N	439.582	1.863	50	20	IDGD	
Cc1c(C(=O)NNC(=O)Cn2cnc3ccccc32)nnn1-c1ccc2c(c1)OCCO2	731469903	CUHZJFMKIZKVBZ-UHFFFAOYSA-N	433.428	1.158	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(OCCOC)cc2)c1	732049578	UPAILLPLWYTAPP-UHFFFAOYSA-N	449.529	1.817	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2occc2COc2cccc(C#N)c2)C[C@@H](C)O1	732260378	DIRZXDXWHWHYSE-IYBDPMFKSA-N	426.473	1.991	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(/C#N)C(=O)NNC(=O)CCN2C[C@H](C)O[C@@H](C)C2)c1C	732262195	RPJBQRPSGDDEHT-JJOYAJTASA-N	445.564	1.866	50	20	IDGD	
Cc1c(C(=O)NNC(=O)CCN2C[C@H](C)O[C@H](C)C2)nnn1-c1cccc2ncccc12	732263318	LTLVAAJWUVAZIL-GASCZTMLSA-N	437.504	1.384	50	20	IDGD	
CN(C)c1ncc(Br)cc1C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	733218962	JCHSOEHROTZXGQ-UHFFFAOYSA-N	448.325	1.378	50	20	IDGD	
CCOCCCn1c(NNC(=O)c2n[nH]c(CC)c2[N+](=O)[O-])nc2ccccc2c1=O	733364760	DWYFQZMABHTOPT-UHFFFAOYSA-N	429.437	1.774	50	20	IDGD	
CCOC(=O)N1CCC(NC(=O)CCCNC(=O)c2c(C)nn(CCCl)c2C)CC1	733874567	ANTMODWBZNCDEW-UHFFFAOYSA-N	441.960	1.986	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)c1ccc(CNC(=O)C2CCCC2)cc1	734242176	WKHMFKOBWRSZEM-UHFFFAOYSA-N	447.536	1.962	50	20	IDGD	
COc1ccc(/C=C(\C#N)C(=O)Nc2ccc(S(N)(=O)=O)cc2)c(OCC(=O)O)c1	734483751	SBVVZWXRMGUBFR-MDWZMJQESA-N	431.426	1.352	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)COc1ccccc1F)[C@@H]1CN(Cc2ccccc2)CCO1	741266136	JDXAQVNQPCYFTQ-JXFKEZNVSA-N	430.480	1.824	50	20	IDGD	
CCO[C@@H](C)c1nc(CN2CCN(C(=O)NNC(=O)Cc3cccnc3)CC2)cs1	743588685	FOLFWNIMOMYIGM-HNNXBMFYSA-N	432.550	1.737	50	20	IDGD	
CCCS(=O)(=O)N1CCCC[C@@H]1C(=O)NNC(=O)c1cc(Br)ccc1O	743730183	RAHPOHULNCUMTK-CYBMUJFWSA-N	448.339	1.510	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)c1cn([C@H]2CCS(=O)(=O)C2)nc1C(C)C	744361784	CLKRZQGKVFKGAD-HNNXBMFYSA-N	434.518	1.378	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1cccnc1-n1cccn1	744619539	RUIMSDPTGGUGJE-UHFFFAOYSA-N	428.474	1.045	50	20	IDGD	
Cc1noc(C)c1CSCC(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	744621672	XNTDMJSWUQNWOJ-UHFFFAOYSA-N	440.547	1.689	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)N[C@H]2CC(=O)N(CCOc3ccccc3)C2)cc1	745848979	ZEGYWROIMRKXOV-INIZCTEOSA-N	442.472	1.084	50	20	IDGD	
CC(C)(C)S(=O)(=O)CCNC(=O)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1	745898149	PZHDUNYFAVPPNY-UHFFFAOYSA-N	431.458	1.820	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)N[C@@H]1CC(=O)N([C@H]2C[C@H]2c2ccccc2)C1	746774100	UYCRCXVXMISYFV-QYZOEREBSA-N	432.484	1.364	50	20	IDGD	
O=C(CCN1CCN(C(=O)[C@H]2CCCO2)CC1)NNc1ccc(OCC(F)(F)F)cc1	748701559	LISNBPCOJJTPPF-QGZVFWFLSA-N	444.454	1.784	50	20	IDGD	
CN(C)CC(C)(C)CNC(=O)C1CCN(CC(=O)NNC(=O)c2ccc(F)cc2)CC1	749846403	ZFCFSKSUYJPRNA-UHFFFAOYSA-N	435.544	1.003	50	20	IDGD	
Cc1cc(F)ccc1-n1cc(O)c(C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)n1	751380991	JBGUXOJCLJINME-UHFFFAOYSA-N	436.444	1.494	50	20	IDGD	
Cc1cc(C(=O)NNS(=O)(=O)c2cnn([C@@H]3CCOC3)c2)c(C)n1-c1ccccc1	751538991	UZNCNDHVBGMKSF-QGZVFWFLSA-N	429.502	1.875	50	20	IDGD	
CO[C@@H](C)c1nc(CN2CCCN(CC(=O)NNC(=O)c3ccccc3)CC2)cs1	752354461	FPTCJIOTYNHBPD-INIZCTEOSA-N	431.562	1.819	50	20	IDGD	
COCC[C@@H](Cc1ccco1)NC(=O)NNc1ccc(S(=O)(=O)NC(C)C)cn1	753283851	YIUGBFFYLOTDAN-AWEZNQCLSA-N	425.511	1.635	50	20	IDGD	
COc1ccc2c(c1)CC[C@H](NC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)C2	753291932	PRYDXLHKXMNIEO-INIZCTEOSA-N	432.502	1.992	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2cc(C)cc(C(=O)O)c2F)cc(OC)c1OC	753768444	FWZBBMWUQGPITI-UHFFFAOYSA-N	442.421	1.481	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)Nc2cccc(S(=O)(=O)N3CCOCC3)c2)c1	755354652	SWFOPHAWXRZCQD-UHFFFAOYSA-N	429.458	1.046	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2nnc(C(F)(F)F)s2)c1	755483364	FEYVKROUHXFWGF-UHFFFAOYSA-N	438.413	1.274	50	20	IDGD	
CNS(=O)(=O)c1cc(NC(=O)NNC(=O)[C@H](C)Oc2ccc(C(C)=O)cc2)ccc1C	755515915	OLNIJFQPAUIGCN-AWEZNQCLSA-N	448.501	1.726	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(N3C[C@H]4CC[C@H]3C4)cc2)cc1	756164899	QWFKCRLCLFYQHE-YJBOKZPZSA-N	438.484	1.849	50	20	IDGD	
CCc1c(NC(=O)C(=O)NNC(=O)c2c(C)nc3ccccn23)cnn1CCC(C)C	756165549	YZXVDYMJBYVKME-UHFFFAOYSA-N	425.493	1.847	50	20	IDGD	
Cc1c(CS(C)(=O)=O)cccc1NC(=O)NNC(=O)c1nnc(O)c2ccccc12	756596803	HFCNWTZNQZFKBB-UHFFFAOYSA-N	429.458	1.655	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CN2CCN(CC(=O)Nc3ccccc3F)CC2)c1	756642583	OMLFSRCMVRKSJI-UHFFFAOYSA-N	427.480	1.151	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2ccc(OC)c(NS(C)(=O)=O)c2)c(OC)c1	756782091	NAJIVVGZZLNDDJ-UHFFFAOYSA-N	438.462	1.550	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)Nc2cnn(CC(=O)NC3CC3)c2)cc1OC	756795423	KBUOSJTYDIOLRL-UHFFFAOYSA-N	430.465	1.426	50	20	IDGD	
COc1cc(C(=O)N(C)C)ccc1NC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	756869439	WCKOWXCUDYQWPW-UHFFFAOYSA-N	434.474	1.267	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)Nc1ccc(C(=O)NC2CCOCC2)cc1	757619878	VOQUYHCEOUBJLD-UHFFFAOYSA-N	430.436	1.966	50	20	IDGD	
O=C(NNC(=O)[C@@H](Cc1ccccc1)NC(=O)c1ccccc1)C(=O)Nc1ccccn1	758828688	UOZVJSAIQQMZPB-GOSISDBHSA-N	431.452	1.209	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@@H](C(=O)NNC(=O)C(=O)Nc1ccccn1)c1ccccc1	758837436	BPHDQXXXGLWZLN-OAHLLOKOSA-N	427.461	1.476	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)[C@@H]1CC(=O)N(c2ccc(Cl)c(F)c2)C1	760437072	BIDJAUCLCMHJQQ-LLVKDONJSA-N	442.875	1.894	50	20	IDGD	
COC(=O)c1cn([C@H]2CCN(C(=O)NNC(=O)c3cc4c(s3)CC[C@@H](C)C4)C2)nn1	760656145	LQJKDQZJNRIEJQ-YPMHNXCESA-N	432.506	1.552	50	20	IDGD	
CCCS(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)c2ccccc2C)cc1F	762463539	SKKOTMCVSPODQA-UHFFFAOYSA-N	429.495	1.909	50	20	IDGD	
Cc1c(I)cccc1C(=O)NNc1nccc(N2CCOCC2)n1	762862659	XQJXDBYWISPMFD-UHFFFAOYSA-N	439.257	1.983	50	20	IDGD	
Cc1ccc(-n2c(NNC(=O)Cn3cc([C@H](C)O)nn3)nc3ccccc3c2=O)c(C)c1	763046970	FNGNJSDZNISDPA-HNNXBMFYSA-N	433.472	1.791	50	20	IDGD	
O=C(Cn1nnc(-c2ccc(Cl)cc2)n1)NNC(=O)c1cc(-c2cccs2)[nH]n1	763157742	KYQMECVZJGCKRM-UHFFFAOYSA-N	428.865	1.906	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)COCC(=O)NCc3cccnc3)n[nH]2)c1	763174127	JMMXRHWOWQXUJT-UHFFFAOYSA-N	436.472	1.183	50	20	IDGD	
O=C(NNC(=O)c1ccccc1Br)C(=O)Nc1ccc(N2CCCC2)nc1	763484373	YOBPFAYWXZKMPE-UHFFFAOYSA-N	432.278	1.844	50	20	IDGD	
CN(Cc1cccc(NC(=O)C(=O)NNC(=O)c2ccccc2O)c1)Cc1cscn1	763531811	RSJYMBPKJYRBPE-UHFFFAOYSA-N	439.497	1.880	50	20	IDGD	
CCCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(OC)c(OC)c2)cc1	763541890	BNHMJVBKGGSOSE-UHFFFAOYSA-N	428.445	1.243	50	20	IDGD	
CC(=O)Nc1cc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)c(F)cc1F	763601051	NLBMQGWEQBQOFA-UHFFFAOYSA-N	442.382	1.713	50	20	IDGD	
COCCOc1cc(C)ccc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccccc2)[nH]n1	763613390	OAILBOOJGMFJKS-UHFFFAOYSA-N	437.456	1.810	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2c(C)nc3ccccn23)ccc1N1CCOCC1	763628716	FCJMEAWCDNXBSI-UHFFFAOYSA-N	436.472	1.187	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccc(OC[C@H]2CCCO2)c1	763657758	RIGPZVLEXFBJPX-QGZVFWFLSA-N	443.456	1.418	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)cc1	763658717	AKJGSGUNZYKCKQ-UHFFFAOYSA-N	440.456	1.096	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(NC(=O)C(C)C)cc2)cc1	763659043	HRPRICAOFSVTRT-UHFFFAOYSA-N	428.445	1.455	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cc3c(cc2F)CCC(=O)N3)cc1C	763666553	IZBADFSCTIKTMG-UHFFFAOYSA-N	428.420	1.492	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccc(N2CCCNC2=O)c1	763711317	HHPDROPIMHTFOI-UHFFFAOYSA-N	439.472	1.334	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(C(=O)N(C)C)cc1OC	763716601	JTXOHQJPRZUWFK-UHFFFAOYSA-N	442.472	1.124	50	20	IDGD	
CC(C)Cn1ncc(NC(=O)C(=O)NNC(=O)c2nnc(O)c3ccccc23)c1C(C)C	763789699	AHOYCPNYXDXCAU-UHFFFAOYSA-N	439.476	1.711	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)c1ccn(-c2cccc(Br)c2)n1	763819807	GMRCNMAXCDGISW-UHFFFAOYSA-N	443.261	1.221	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccc(Br)c(F)c1	763837214	AGMLAPFQPLUGBM-UHFFFAOYSA-N	428.189	1.892	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)C(=O)Nc1cc(C(N)=O)ccc1F	763904459	ZTHMYAWWTWTHKQ-UHFFFAOYSA-N	441.444	1.756	50	20	IDGD	
C#CC[C@]1(C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)CCCN1C(=O)OC(C)(C)C	763920786	RIUAYTJGUVPKAB-HTAPYJJXSA-N	429.473	1.767	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc(NC(=O)[C@@H](C)n2cncn2)cc1	763950022	IBJZVOFIVNDGQB-CQSZACIVSA-N	435.444	1.186	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2cccn2C)cc1NC(=O)OC(C)(C)C	763997143	WGXGYQDNCHJGQF-UHFFFAOYSA-N	431.449	1.780	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1ccc(-n2cncn2)c(F)c1	764010515	AMZMBEYSYGJLNI-UHFFFAOYSA-N	432.799	1.468	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(OC)c([N+](=O)[O-])c2)o1	764138717	ILTDDKQNLKXRMG-UHFFFAOYSA-N	433.421	1.438	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2O1)C(=O)Nc1ccc(OCCc2ccccc2)nc1	764153171	JQHAOYFGWYJMTL-FQEVSTJZSA-N	446.463	1.793	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2O1)C(=O)Nc1cc(F)c(Br)cc1F	764167415	JTTUQRFUVVLEGH-AWEZNQCLSA-N	440.200	1.817	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2scnc2C)cc1OCc1ccncc1	764245408	SNOJVRHSDNSALX-UHFFFAOYSA-N	441.469	1.834	50	20	IDGD	
O=C1CSc2ccc(NC(=O)C(=O)NNC(=O)c3cccc(OC(F)F)c3)cc2N1	764249697	CPUXLWNGGRHJBU-UHFFFAOYSA-N	436.396	1.732	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3cccc4ncccc34)cn2)C[C@@H](C)O1	764258079	USGBCHOHYAXXLK-GASCZTMLSA-N	448.483	1.643	50	20	IDGD	
C[C@H]1CN(Cc2cccc(NC(=O)C(=O)NNC(=O)Cc3cccnc3)c2)C[C@H](C)O1	764268363	JQVPHKUKLFMGHG-HOTGVXAUSA-N	425.489	1.019	50	20	IDGD	
CS(=O)(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)c1	764348909	CFSFZSVZUCLPTJ-UHFFFAOYSA-N	446.268	1.502	50	20	IDGD	
COc1cc(OC)cc(OCCNC(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)c1	764375574	XHWFOMTVTGYPLS-UHFFFAOYSA-N	430.461	1.669	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=S)NCCc1ccccn1	764519676	VXKSOFZKOWBKGO-UHFFFAOYSA-N	447.008	1.591	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)NCC1(N2CCOCC2)CC1	764831931	XNVGDDIGVRITCL-UHFFFAOYSA-N	427.299	1.023	50	20	IDGD	
CCNS(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)c1	765313792	PBJMZHNZAJJBOW-UHFFFAOYSA-N	446.501	1.190	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)c1ccc(=O)n(-c2ccc(F)cc2)n1	765317214	MCTCUFPQKJNHPN-UHFFFAOYSA-N	433.440	1.438	50	20	IDGD	
CC[C@H](O[C@H]1CCC[C@H](C)C1)C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765735322	JWKDCHRHALSUHS-JBACZVJFSA-N	444.576	1.966	50	20	IDGD	
COc1cc(C(=O)OCC(=O)NNC(=O)Cc2ccccc2C)c([N+](=O)[O-])cc1OC	767232248	HRNURJBZTTVZEP-UHFFFAOYSA-N	431.401	1.467	50	20	IDGD	
CCOCC(=O)NNC(=O)N[C@H]1CCCN(c2ccc(Br)c(C)c2)C1=O	768432148	YMQATAURPDYKHL-AWEZNQCLSA-N	427.299	1.620	50	20	IDGD	
COc1ccccc1N1C[C@H](C(=O)NNc2c(OC)cccc2S(C)(=O)=O)CC1=O	768612445	NDOVKANGEWLMGA-CYBMUJFWSA-N	433.486	1.604	50	20	IDGD	
N#Cc1cc(Cl)nc(NNC(=O)c2ccc(S(=O)(=O)N=c3cc[nH]cc3)cc2)c1	768701233	AYPHDHPCYICDKC-UHFFFAOYSA-N	428.861	1.981	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)NC2CCN([C@H]3CCC[C@@H]3O)CC2)cc1OC	769157431	VGLFIYNRWTZQII-ROUUACIJSA-N	434.537	1.806	50	20	IDGD	
CCCCCCn1cc(S(=O)(=O)NNC(=O)c2ccc(Cl)cc2F)c(O)nc1=O	769634200	REVWALXHJZAVGK-UHFFFAOYSA-N	446.888	1.945	50	20	IDGD	
CSCCNC(=S)NNC(=O)c1ccc2c(=O)n(Cc3ccco3)c(S)nc2c1	770241416	XZTVZVQUBAVNOG-UHFFFAOYSA-N	449.583	1.798	50	20	IDGD	
Cc1ccc(S(=O)(=O)NC(C)(C)C)cc1C(=O)NNc1nc(O)c2cnn(C)c2n1	770982105	FCCFVQQCGFUSPN-UHFFFAOYSA-N	433.494	1.211	50	20	IDGD	
CS(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)c2cc3ccccc3o2)cc1F	771149496	FHLFLWNBDCPXIC-UHFFFAOYSA-N	427.435	1.567	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)CCC(=O)c3ccccn3)cc2)CC1	771432230	ROWVNSVDOHRADE-UHFFFAOYSA-N	431.518	1.124	50	20	IDGD	
CC(C)(C(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1)N1C(=O)c2ccccc2C1=O	771444121	HXKLCGRBDOMYFU-UHFFFAOYSA-N	442.859	1.178	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)CCNS(=O)(=O)c1ccc2ccccc2c1	771864071	XYJPSOYRVMOFQC-OAHLLOKOSA-N	449.529	1.633	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(CCN3CCOCC3)cc2)cc1F	773889116	LZKRPQNSOPQEBQ-UHFFFAOYSA-N	428.464	1.409	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)Nc1ccc2c(c1)CCC(=O)N2CC1CC1	776067024	YLGDEFOLRRYXGK-UHFFFAOYSA-N	446.471	1.818	50	20	IDGD	
O=C(NCc1cc(Br)ccc1Br)NNC(=O)C(=O)N1CCCC1	776238270	ICHZXXKULPWQTM-UHFFFAOYSA-N	448.115	1.664	50	20	IDGD	
CC1CCC2(CC1)OC[C@@H](CNC(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)O2	776948682	GJQCLOSEOVVCOB-RDYUPDBUSA-N	428.530	1.944	50	20	IDGD	
CCNS(=O)(=O)c1ccccc1S(=O)(=O)NNC(=O)c1ccc2ccccc2n1	777591975	VXFHOPUWKXZZAZ-UHFFFAOYSA-N	434.499	1.156	50	20	IDGD	
O=C(CCCc1ccccc1)NNS(=O)(=O)c1ccc(N2CCOC2=O)c([N+](=O)[O-])c1	777623098	FEKBOBPRCYHOFY-UHFFFAOYSA-N	448.457	1.884	50	20	IDGD	
CCS(=O)(=O)N1CCC[C@H](C(=O)NNc2ccc([N+](=O)[O-])cc2Br)C1	779142668	BLLDXZCSMMCJIN-JTQLQIEISA-N	435.300	1.862	50	20	IDGD	
O=C(NN=c1cc[nH]cc1)[C@@H]1CCCN(S(=O)(=O)c2ccc(Br)cc2)C1	780760021	VOXQPSKRMMAKPT-CYBMUJFWSA-N	439.335	1.810	50	20	IDGD	
CCCOc1cccc(NC(=O)C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)c1	782896354	GQTGCVDLZNBYOB-UHFFFAOYSA-N	447.517	1.477	50	20	IDGD	
CCOC(=O)Nc1ccc(NC(=O)C(=O)NNc2ccc(S(C)(=O)=O)cc2)cc1C#N	783071157	FYWARTUDGGFSGK-UHFFFAOYSA-N	445.457	1.612	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2cc(F)ccc2Cl)nc1	783262458	DECRZCUFDSRGCW-UHFFFAOYSA-N	429.861	1.643	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2ccccc2COCc2ccccc2)CCS(=O)(=O)C1	783426023	LHJKDVDAWANLNY-NRFANRHFSA-N	431.514	1.540	50	20	IDGD	
O=C(NNc1ccc(-n2cccn2)nn1)C(=O)Nc1ccc(F)cc1-c1nc(C2CC2)no1	783436774	PZNOGSFQOPYITL-UHFFFAOYSA-N	449.406	1.811	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNS(=O)(=O)c1c(F)c(F)c(F)c(F)c1F	783819750	ADCCYTFFUMMJMD-UHFFFAOYSA-N	429.348	1.183	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2cc(C)nn2[C@@H]2CCN(Cc3ccccc3)C2)ncn1	783945516	LRUWIBXACIIEQK-GOSISDBHSA-N	434.504	1.819	50	20	IDGD	
Cc1ccc(C)c(NC(=O)C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)c1	784230675	PRAKXQUYUUDNJC-UHFFFAOYSA-N	445.545	1.321	50	20	IDGD	
O=C1C[C@H](Cc2ccc(NC(=O)C(=O)NNc3ccnc(Br)c3)cc2)C(=O)N1	784836819	BXHZCPJOLNWZLX-NSHDSACASA-N	446.261	1.131	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)Nc1ccc(OC[C@H]2CCCO2)cc1	785023481	NHBVPSMKSDAZHR-OAHLLOKOSA-N	444.400	1.258	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(C(=O)COC(=O)/C(C#N)=C\C3CC3)CC2)cc1C	786668736	IFGDCXHBONFZOY-PDGQHHTCSA-N	431.514	1.540	50	20	IDGD	
CN1C(=O)Cc2cc(NC(=O)C(=O)NNC(=O)CSc3ccc(Cl)cc3)ccc21	789732920	SKLIRVZQJDYDDH-UHFFFAOYSA-N	432.889	1.737	50	20	IDGD	
O=C(NNC(=O)c1ccn(CC(F)F)n1)c1cccc(S(=O)(=O)N2CCCC2)c1	789866747	AMWCTCRERZIARW-UHFFFAOYSA-N	427.433	1.008	50	20	IDGD	
COc1cc(C(F)(F)F)ncc1NC(=O)C(=O)NNC(=O)c1ccc(OC)c(OC)c1	792264866	XGLOVEYVBYMMSC-UHFFFAOYSA-N	442.350	1.526	50	20	IDGD	
C[C@H]1CN(C(=O)c2ccc(NC(=O)C(=O)NNc3nc4ccccn4n3)cc2)C[C@H](C)O1	792393465	HMSUAJGAKQAWGO-KBPBESRZSA-N	437.460	1.061	50	20	IDGD	
C[C@@]1(C(N)=O)CCN(C(=O)NNC(=O)[C@@H]2Cc3ccccc3CN2Cc2ccccc2)C1	792879436	KJYZIGKASRPBGI-GBXCKJPGSA-N	435.528	1.552	50	20	IDGD	
CCOC(=O)c1cc(Cl)cc(S(=O)(=O)NNC(=O)c2ccc3c(c2)OCO3)c1	793350164	FWFGQALCLMDTRC-UHFFFAOYSA-N	426.834	1.869	50	20	IDGD	
C[C@@H](CCc1ccc(I)cc1)NC(=O)NNC(=O)C(=O)NC1CC1	793351944	JSBDEJPOQBLACB-JTQLQIEISA-N	444.273	1.221	50	20	IDGD	
N#Cc1cnn(-c2ccc(C(=O)NNC(=O)CNC(=O)OCc3ccccc3)cc2)c1N	794062012	RQZIIJSZEWUSOT-UHFFFAOYSA-N	433.428	1.014	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNS(=O)(=O)c1c(Cl)cc(Cl)cc1C(=O)OC	795325719	XHLOXPRPGVUESQ-UHFFFAOYSA-N	440.305	1.394	50	20	IDGD	
CC(C)Oc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)cc1C(N)=O	796992984	ZFHKJFIZSYQVBR-UHFFFAOYSA-N	448.863	1.391	50	20	IDGD	
COC(=O)[C@H]1CC[C@H](C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)CC1	797905331	VYRVRDKHCJIOFK-SHTZXODSSA-N	425.507	1.130	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CCC(=O)Nc2nnc(C(C)C)s2)cc1C	798307351	QDDGNCUVXZFMMI-UHFFFAOYSA-N	432.506	1.783	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)N[C@H]1CCCN(C(=O)Cc2ccccc2)C1	800983830	VZAVKPNKBDVBJM-HNNXBMFYSA-N	448.321	1.955	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)[C@@H]2CS[C@]3(C)CCC(=O)N23)cc1Cl	802077302	QAENEIAVSHNBHC-APPDUMDISA-N	428.898	1.964	50	20	IDGD	
C[C@H]1C[C@@H](C)C[C@]2(C1)NC(=O)N(CC(=O)NNC(=O)Nc1ccc3c(c1)OCO3)C2=O	802093696	WXQVGZLQWJBBRN-OYHTYJOISA-N	431.449	1.315	50	20	IDGD	
C[C@](O)(Cn1cc(C(F)(F)F)ccc1=O)C(=O)NNC(=O)Nc1ccc2c(c1)OCO2	802104942	MPNOCUJXMVRDMS-KRWDZBQOSA-N	442.350	1.200	50	20	IDGD	
COC[C@@]1(CNC(=O)NNC(=O)c2ccc(C#N)cc2)CCCN1C(=O)OC(C)(C)C	805026109	CIPOBCFMRVLIHS-NRFANRHFSA-N	431.493	1.918	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(F)cc1OC1CCOCC1	806971954	ABMOJEVTPAPYNA-UHFFFAOYSA-N	446.391	1.691	50	20	IDGD	
CCn1c(=O)nc(O)c2c(C(=O)NNc3cc(Cl)nc(COC)n3)cc(C3CC3)nc21	807234478	JAYFVKAUWQQVPX-UHFFFAOYSA-N	445.867	1.741	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cc(OC)cc(OC)c2)cc2[nH]ccc12	808934760	UTHZNHSATUAZSW-UHFFFAOYSA-N	440.412	1.371	50	20	IDGD	
COC[C@]1(CNC(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)OCCc2ccccc21	812476920	CEQWDZLSDFSJDM-FQEVSTJZSA-N	430.417	1.359	50	20	IDGD	
COC[C@]1(CNC(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)OCCc2ccccc21	812476995	FMCHFNZUOPXACJ-QHCPKHFHSA-N	440.500	1.687	50	20	IDGD	
Cc1ccc(-c2ncco2)cc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	813033055	CAOAGGOTFHYSHM-UHFFFAOYSA-N	443.485	1.982	50	20	IDGD	
O=C([C@@H](O)c1ccc(Cl)cc1F)N1CCN(S(=O)(=O)CBr)CC1	813510487	ZVQLSOOYBLJOBC-LBPRGKRZSA-N	429.695	1.339	50	20	IDGD	
O=C(NNC(=O)C1CCC1)C(=O)Nc1ccc([N+](=O)[O-])c(I)c1	815569945	MGKVVFGOSGVBMO-UHFFFAOYSA-N	432.174	1.085	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)C(=O)Nc1nc(CC(F)(F)F)cs1	815570123	RSQSAYMSCDLPHJ-UHFFFAOYSA-N	438.391	1.833	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)[C@H]2CS[C@H](Cc3ccccc3F)C(=O)N2)c1	891387466	BCWUKWLKOZPYKW-QZTJIDSGSA-N	447.488	1.447	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)CN2C(=O)N[C@]3(C[C@H](C)CC(C)(C)C3)C2=O)c(C)c1	913164890	XKMPIRLBVJBPAD-CMJOXMDJSA-N	443.548	2.000	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCc2ccccc2Cn2cncn2)cc(OC)c1OC	914829443	RFCJQWGESNXQQS-UHFFFAOYSA-N	440.460	1.496	50	20	IDGD	
CN(C)N(C(=O)c1ccc(F)cc1I)[C@@H]1CCS(=O)(=O)C1	915277607	YHSAHSNJWPORQA-SNVBAGLBSA-N	426.251	1.536	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)c2cc(S(=O)(=O)N3CCCC3)c(C)o2)c1	915811500	RYNGPIFUTNBGOH-UHFFFAOYSA-N	437.474	1.465	50	20	IDGD	
O=C(NC[C@H]1CN(Cc2ccccc2)CCO1)NNC(=O)c1ccc2c(c1)OCCO2	915894836	QKALHHUYSLBLPC-SFHVURJKSA-N	426.473	1.303	50	20	IDGD	
Cn1ccnc1[C@H](NC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)c1ccccc1	916220728	YDHGJOCIMDZEJI-QGZVFWFLSA-N	427.486	1.557	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCCNC(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)cc1	916277052	RCZCEWZYCBVBKH-CQSZACIVSA-N	438.481	1.210	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NC[C@@H](C)N2CCN(c3ccccc3)CC2)cc1	916514867	QSWRTAPZOOHIBI-GOSISDBHSA-N	441.532	1.615	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)NC[C@@]2(N3CCOCC3)CCSC2)cc1OC	916636457	DCMOXWCDJINYLU-FQEVSTJZSA-N	438.550	1.246	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)[C@H]2CC(=O)N(c3ccc(Cl)cc3)C2)c2ccccc2c1=O	917387615	FESRAKJQYWZMJK-LBPRGKRZSA-N	439.859	1.401	50	20	IDGD	
CN(CC(=O)NNC(=O)COc1ccc(F)cc1)C(=O)c1ccc(Br)o1	917916164	BPHDCTDHXTUQKF-UHFFFAOYSA-N	428.214	1.480	50	20	IDGD	
COC(=O)[C@@H](C)Sc1ccccc1C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	917925845	NEYVHSNCQVKSBC-GFCCVEGCSA-N	426.458	1.391	50	20	IDGD	
CNS(=O)(=O)c1ccc([C@H](C)NC(=O)NNC(=O)[C@H](C)Oc2ccccc2F)cc1	919779135	NSWQMEUXRNKCRM-STQMWFEESA-N	438.481	1.593	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cccnc2)cc1S(=O)(=O)Cc1cc(C)no1	919806563	FUUMSPAAJLFWBL-UHFFFAOYSA-N	430.442	1.435	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CCN2C(=O)NC3(CCCC3)C2=O)ccc1OC(C)C	920290796	FAVGGEPTONSZDJ-UHFFFAOYSA-N	432.477	1.498	50	20	IDGD	
O=C(NNc1ncccn1)c1cc(S(=O)(=O)N2CCOCC2)ccc1N1CCCCC1	920447621	MRJYLWNKFZXREV-UHFFFAOYSA-N	446.533	1.245	50	20	IDGD	
Cc1ccc(C(=O)NCC(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)s1	1322918922	LKSZXVAYJCXMMC-UHFFFAOYSA-N	439.538	1.516	50	20	IDGD	
CCc1cc(C(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)nn1C	1323647216	OFHXWWDGENVLFB-UHFFFAOYSA-N	430.468	1.816	50	20	IDGD	
O=C(c1ccn2ccnc2c1)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1778566663	BLGGWFGSWRZHAK-PBHICJAKSA-N	425.258	1.468	50	20	IDGD	
Cn1cc(C(=O)N2CC[C@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)c2cccnc21	1778770595	ONHCAQAAGNPFFV-NRFANRHFSA-N	430.581	1.868	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc3ncnn3c2)C1	1779172171	XFUAZHUCZFFGDQ-RZQQEMMASA-N	435.912	1.111	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cc(O)nc(Cl)c1)CCO2	1779296624	WPLONWXSPQDKKA-GOSISDBHSA-N	427.961	1.736	50	20	IDGD	
CC(=O)N(C)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CO[Si](C)(C)C)C1	1779539865	NTJJYTQSZGHHMB-YLJYHZDGSA-N	427.618	1.220	50	20	IDGD	
O=C(c1cc([N+](=O)[O-])cc2c1OCC2)N1CC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1780094541	NDVUJLFKOXLHRT-SFHVURJKSA-N	444.271	1.777	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc(F)cc2)C1	1780417759	ZRJQRCBGLWYIIY-XMSQKQJNSA-N	434.512	1.326	50	20	IDGD	
CC(C)=NO[C@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Br)C1	1780776812	KYXXJUCQFRUSKV-VWPFQQQWSA-N	436.322	1.992	50	20	IDGD	
O=C(Nc1ccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)cc1)C1CC1	1781465666	WYWATNWVGXJBDW-DYESRHJHSA-N	435.908	1.078	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)n1cncn1)C2	1781904500	YLHUJKAPRMSEMU-BASYENTBSA-N	442.358	1.527	50	20	IDGD	
CC[S@](=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)Br)C1	1781997576	CPMDNALNLNTGRE-DQMDSTQDSA-N	437.400	1.442	50	20	IDGD	
COC(=O)c1ccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](F)Cl)CCO3)c([N+](=O)[O-])c1	1782090122	NOXUSAYFLNELQW-RDTXWAMCSA-N	443.815	1.359	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnnc(Cl)c1)C2	1782171136	PIOZWYPQDRFYHN-PMUMKWKESA-N	431.320	1.511	50	20	IDGD	
C[C@H](CC(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2)c1ccccc1	1783278807	ADKTUHJWYQVATM-HOYKHHGWSA-N	436.317	1.004	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(OC)nc3)CCO2)C1	1783344477	TVHWMEVJIAZGKX-KSSFIOAISA-N	426.311	1.707	50	20	IDGD	
CCC[C@@H](C(=O)N1CCO[C@@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1)n1cccc1	1783934323	DJPDSTRPFVFYAN-PGRDOPGGSA-N	433.553	1.032	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnnc(Cl)c3)C[C@@H]21	1783969353	LMUNKKDVPGCMMS-IMIFBBOLSA-N	445.745	1.754	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](C)Oc3ccccn3)C2)C1	1784480594	LJHIQIYNKOPEDS-SPYBWZPUSA-N	440.338	1.710	50	20	IDGD	
COc1ccc(CC(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)cc1F	1784706129	PWBNVNFGWSZJMY-AEFFLSMTSA-N	447.276	1.897	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3COc4ccccc4O3)[C@H]2C1	1785039565	FIZGHLQNNLAKKD-FVCZOJIISA-N	448.592	1.658	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc(Br)cn3)C[C@@H]21)[C@@H](F)Cl	1787444327	UAGZDQMOACYWJG-LOHUMSBYSA-N	448.720	1.901	50	20	IDGD	
O=C(/C=C/c1cnccn1)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1	1788149421	PQMCWPBOGPOESS-MDZDMXLPSA-N	442.284	1.618	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)Br)C[C@@H]32)o1	1788608721	KHCDXPLOPMUWSH-NHULGOKLSA-N	442.310	1.615	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)c1c(F)cncc1F	1789006621	ZBACORMBELSELK-MJVIPROJSA-N	432.265	1.738	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(C)nc3O)[C@H]2C1	1789311851	LZMCSGXOFAOVRG-HNKHHVNMSA-N	440.338	1.862	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3c(F)c(C)nn3C)C[C@@H]21	1790960667	AGYZRVLFOQDPPK-XUXIUFHCSA-N	445.333	1.634	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H]1C[C@H](C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Cl)C[C@@H]32)C1	1792223895	NULZMJORSYYJGU-QNILMXGZSA-N	447.935	1.804	50	20	IDGD	
CCSc1ncccc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCC(=O)NN(C)C)C2	1792448480	DDMBPLOCWUNNOO-MUJYYYPQSA-N	433.578	1.818	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CNc1ccc(F)cc1)C2	1792868077	SPDRYXWBCXOZKB-ZUMXRPEOSA-N	442.329	1.858	50	20	IDGD	
COC(=O)[C@@H]1CC[C@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)CBr)C1	1792868558	FFKSYDZZDGFYFQ-GTDBDLECSA-N	445.354	1.196	50	20	IDGD	
CC(=O)OC[C@@H](OC(C)=O)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](C)CBr	1792986573	AIKOHZPNAVQCNI-LMXXTMHSSA-N	447.326	1.150	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1CCN(C(C)C)CC1	1793800013	GUJXMEIAMSGKSO-MHORFTMASA-N	444.414	1.870	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(O)(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](F)Cl)C3)CC1	1793908099	XLQDCSMHFQIBDI-LXTVHRRPSA-N	447.935	1.921	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCn1c(=O)oc2ccccc21	1793983933	JFSCCGJNMILIRN-NXEZDXNNSA-N	435.908	1.592	50	20	IDGD	
CC[C@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCC(=O)NN(C)C)C2)c1ccccc1	1795079751	LYGZSHQVJOIDJK-WEMPKCCASA-N	430.549	1.143	50	20	IDGD	
COc1ncccc1CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@](C)(Cl)CCl	1799273807	JDWXDZHFAQHGAF-MQJTVSLUSA-N	444.359	1.849	50	20	IDGD	
N[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Br)c1cccc(Cl)c1	1799346591	SFYRDNJBOAPANA-FONWIUJUSA-N	448.720	1.620	50	20	IDGD	
CC[C@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C[C@H](O)CNC(=O)OC(C)(C)C)C2	1800074523	DRCMZCIKYVMVLC-QRJUGERDSA-N	431.961	1.918	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nnsc1C1CC1)C2	1800641261	VGXYOBDQTLANJH-YVECIDJPSA-N	443.367	1.792	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCCNC(=O)OC(C)(C)C	1802122938	BTJFCKRQOTXPJP-JYYAWHABSA-N	447.960	1.135	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC2(CCN(C(=O)CN3CCNC3=N)CC2)C1	1805383656	UTQBSQADSOCCLP-CQSZACIVSA-N	428.375	1.089	50	20	IDGD	
COC(=O)c1ccc(CC(=O)N2CCC3(CCCN(C(=O)[C@@H](O)CCl)C3)CC2)s1	1805525126	DASSQGWDVFPLBH-HNNXBMFYSA-N	442.965	1.908	50	20	IDGD	
C[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCC2(CCCN(C(=O)[C@H](O)CCl)C2)CC1	1805528343	ROGFKQRVJNWDJR-HUUCEWRRSA-N	431.961	1.731	50	20	IDGD	
O=C(CCBr)NC[C@H]1CCN(C(=O)Cn2ccncc2=O)[C@@H]1c1cccnc1	1806346493	ISJLSUYNIHTNOR-DNVCBOLYSA-N	448.321	1.129	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@H]1CCN(C(=O)CSC(=N)N)[C@@H]1c1cccnc1	1808297387	ZDGWRRJUUABPAE-MRRJBJDNSA-N	432.377	1.950	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@H]1CCN(C(=O)CN2CCOC2=O)[C@@H]1c1cccnc1	1810538175	TVFAXFJFPZSIFI-VQIMIIECSA-N	434.569	1.391	50	20	IDGD	
Cc1ccn(C)c1C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1811606635	LYNVDDVPOQNGLM-UGKGYDQZSA-N	446.316	1.042	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)CN2CCCCC2=O)[C@@H]1c1cccnc1	1812976015	APVGYXTXFHKZRN-ZWOKBUDYSA-N	436.940	1.354	50	20	IDGD	
Cc1ccncc1C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1813071699	VLGALLKXDNQNOE-GCJKJVERSA-N	438.532	1.478	50	20	IDGD	
C[C@@H]1CCC[C@H]1C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1	1815344050	DMISCMWSQCEBOP-DAXOMENPSA-N	427.335	1.485	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@H]2CCC(F)(F)C2)[nH]n1)c1ccc(B(O)O)cc1	1817470819	ZDIAMWGYBNFKNV-WMLDXEAASA-N	446.263	1.831	50	20	IDGD	
COc1ccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)nc1	1817471873	SYMGHCLWBFTKLQ-LJQANCHMSA-N	449.276	1.113	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@@H](F)Br)[nH]n1)c1cc(O)nc(O)n1	1818031473	HBDSUPXJFAVYCY-BXKDBHETSA-N	443.233	1.607	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnoc2)n[nH]1	1818185181	USXLBVUSUJJGCR-UPVZUOOXSA-N	438.448	1.838	50	20	IDGD	
COCc1oncc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1	1818357188	NHDOVMGBEBKMHT-HNNXBMFYSA-N	447.496	1.223	50	20	IDGD	
C[Si](C)(C)OCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)CN1CCOC1=O)CC2	1820160307	JKUJYEKSFCPZBK-LLVKDONJSA-N	426.571	1.359	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3n[nH]cc3[N+](=O)[O-])sc2C1	1820303738	YVPDTPFGOUFJNF-YUMQZZPRSA-N	428.858	1.254	50	20	IDGD	
O=C(/C=C\C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](F)Br)n[nH]1)NC1CC1	1820935499	NJURNCUNAMWXMY-INIQLVOJSA-N	442.289	1.927	50	20	IDGD	
CCNC(=S)NCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](F)Br)n[nH]1	1820936989	LBZXXOYIBOVCJB-ZWNOBZJWSA-N	449.350	1.576	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1	1822117003	FMRRJERNRSKNFP-STQMWFEESA-N	429.905	1.526	50	20	IDGD	
Cc1cccc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2ccc(B(O)O)cc2)CC3)c1	1822134733	QFOFJDZQCOTBAP-KRWDZBQOSA-N	435.314	1.671	50	20	IDGD	
C[C@H](Br)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)n(C)n2)[nH]n1	1822186103	GJOPNTFNHXTVBT-CABZTGNLSA-N	425.287	1.938	50	20	IDGD	
Cc1cc(CC(=O)N2CCCC[C@@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)no1	1822416408	CVDZEWNSAMDCNT-MRXNPFEDSA-N	431.497	1.314	50	20	IDGD	
O=C(Cc1cnccn1)N[C@@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1	1822998256	BAKKLXOJPDDDDX-AMIZOPFISA-N	428.287	1.778	50	20	IDGD	
O=C(N[C@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1)c1cnc(O)nc1O	1823005421	ZWJOOWXHYMVTGX-SSDLBLMSSA-N	446.258	1.261	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H]2C[C@H](O)CN2)CC1	1824094184	HSURXHXAJOQWLE-IWCQGFGOSA-N	430.387	1.360	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)C(C)(C)CNC(C)=O)CC2	1825993784	FLOIUXBRHRZTLV-NWDGAFQWSA-N	430.958	1.471	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(O)cn2)CC1	1826217949	MIXFUNXALMDCQR-LJQANCHMSA-N	431.537	1.394	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc([N+](=O)[O-])o3)CCO2)C1	1829481105	HZBULAHOGMJBFQ-ACJLOTCBSA-N	429.857	1.665	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(F)n3)C2)C1	1830540085	MQUKOHIKTOANID-SCLBCKFNSA-N	444.301	1.322	50	20	IDGD	
Cc1cccnc1C(=O)N1CCC([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1	1831870893	IKDFKYAEJHTXQN-LJQANCHMSA-N	429.565	1.996	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)CC2CCOCC2)CC1	1831871877	XYGSAUYHXJIGRF-HXUWFJFHSA-N	436.597	1.796	50	20	IDGD	
Cc1onc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)c1C	1831981661	GPDAYODHTDHJIY-XJKSGUPXSA-N	434.262	1.052	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCC(N2CCC(NC(=O)CN3CCOC3=O)CC2)CC1	1833388117	QCKLWGGNTGIRIO-IBGZPJMESA-N	449.379	1.247	50	20	IDGD	
CC(C)CNC(=O)C(=O)NC1CCN(C2CCN(C(=O)[C@@](C)(Cl)CCl)CC2)CC1	1835130337	AOEGNAUQLRWPNF-FQEVSTJZSA-N	449.423	1.567	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)c1ccc2nc[nH]c2c1	1835556517	IOVZFMUEDQLIPU-LJQANCHMSA-N	433.940	1.348	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CSc3ncccn3)CCO2)C1	1836109726	HCQBWAIWGYJODP-DNVCBOLYSA-N	442.969	1.433	50	20	IDGD	
CN1CCc2cc(C(=O)N3CCC(OC4CCN(C(=O)[C@H](O)CCl)CC4)CC3)ccc21	1836717179	LSMCNWRXWYBEBB-OAQYLSRUSA-N	449.979	1.891	50	20	IDGD	
O=C(c1cc(Cl)ccn1)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836718627	XFYUCJRAGMCJCW-KRWDZBQOSA-N	430.332	1.947	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836719170	OXDFYYUQBGLFIF-BXUZGUMPSA-N	425.751	1.368	50	20	IDGD	
Cc1cc(C(=O)N2CCC(OC3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)nc2nccn12	1836719357	QEQQXJQASLYMEJ-SFHVURJKSA-N	449.939	1.250	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)[C@@H]3CNC(=O)O3)CC2)CC1	1836903893	SMKPITRAKSGGIX-GJZGRUSLSA-N	446.342	1.267	50	20	IDGD	
O=C(c1cn2cc(F)ccc2n1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1836960478	QACQAIUVFTVGAS-QAPCUYQASA-N	428.823	1.078	50	20	IDGD	
CCc1ncccc1C(=O)N1CCOC[C@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1837712228	KLPDMTGVIXOSQJ-NRFANRHFSA-N	435.597	1.566	50	20	IDGD	
Cc1ccc(O)c(C(=O)N2CCOC[C@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)c1	1837714861	QHTIEZDKQCHLEG-NRFANRHFSA-N	436.581	1.622	50	20	IDGD	
O=C(c1cncc(C(F)(F)F)c1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1838181091	IBVCNDXOIIWGJN-CJNGLKHVSA-N	439.793	1.705	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ncccc3F)CCO2)C1	1838243072	HCXQQTFWIFWAKR-UGSOOPFHSA-N	444.301	1.322	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)C3CCC4(CC3)OCCO4)C2)C1	1839147842	DSVPHPCPWRNIOB-XLIONFOSSA-N	444.956	1.394	50	20	IDGD	
O=C(c1ccc(O)cc1F)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1839316987	CXPXTFCSEOBMAA-YOEHRIQHSA-N	449.248	1.292	50	20	IDGD	
C=CC[C@H](C(=C)C)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H](C)Br)CCO2)C1	1840033537	IJJNLNDQMNYEND-GPMSIDNRSA-N	429.355	1.995	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(Cl)s3)C2)C1	1840149796	AFNOVRCZHBCMMQ-SJCJKPOMSA-N	437.345	1.725	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccc(O)cn3)CCO2)C1	1840498004	JMAVBAUPOZYZPQ-MOPGFXCFSA-N	446.331	1.022	50	20	IDGD	
COc1cc(Cl)cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)c1	1840740266	BXNLFPSXBRMLTR-VQIMIIECSA-N	447.315	1.018	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)C2(c3ccc(F)cc3)CC2)C1	1841867023	VJWRSBBQMDGLCE-UHFFFAOYSA-N	437.475	1.373	50	20	IDGD	
O=C(c1ccccc1C(F)(F)F)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843014408	HGAGMJBUPJOCNN-UHFFFAOYSA-N	432.207	1.516	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)CN1CCCC1)C2	1844692003	XKFHYGWWOWAIQD-UHFFFAOYSA-N	430.461	1.433	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)[C@](C)(Cl)CCl)C1	1845170305	KPCVFJJGWAUNCP-ORWNMUSCSA-N	428.320	1.560	50	20	IDGD	
O=C(Cc1cc(F)ccc1Cl)N1CC[C@H]2[C@@H]1CCN2C(=O)c1ccc(B(O)O)cc1	1848014900	GOGKEFXBTKOGFN-OALUTQOASA-N	430.672	1.217	50	20	IDGD	
COc1cc(C=NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc(OC)c1OC	16309171	VDFWMDHEBLFCTH-UHFFFAOYSA-N	435.502	1.792	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)CN1C(=O)N[C@]2(C[C@H](C)CC(C)(C)C2)C1=O	21199799	ZDMSLOGNRWTERV-DMZKTXOQSA-N	440.504	1.541	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c2[nH]ncc2c1	60365711	XEBHHJQAUHZHCJ-UHFFFAOYSA-N	427.486	1.731	50	20	IDGD	
CCC1(CC)NC(=O)N(CC(=O)OCC(=O)C(C#N)=C2N(C)c3ccccc3N2C)C1=O	115598995	GDWCLZWALPLRNM-UHFFFAOYSA-N	439.472	1.531	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)Nc2nc3nc(C)cc(C)n3n2)c2ccccc2c1=O	725853290	PXYBXQDRYJXJJJ-UHFFFAOYSA-N	449.475	1.718	50	20	IDGD	
CCC(C)(C)C(=O)NNC(=O)C[C@@H]1c2cc(OC)c(OC)cc2CCN1S(C)(=O)=O	726798459	XSQLRVQJKPXBAD-OAHLLOKOSA-N	441.550	1.536	50	20	IDGD	
CCOc1ccc(CC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)cc1	728212865	IIHVCRKPFPNZEZ-UHFFFAOYSA-N	432.546	1.707	50	20	IDGD	
COc1ccc(Cl)c(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1N	728341876	YKOVQJYFRFESRZ-CQSZACIVSA-N	435.820	1.075	50	20	IDGD	
CCCOc1cn(-c2ccccc2)nc1C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	728512732	HSGVZHJWWRDLPT-UHFFFAOYSA-N	432.444	1.712	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1cccc(C(=O)N(C)C)c1	728642290	DQHOCPBQSRXCHK-UHFFFAOYSA-N	433.848	1.668	50	20	IDGD	
COc1cc2ncn(CCCC(=O)NNC(=O)c3cccc(C#N)c3)c(=O)c2cc1OC	728828171	JJIGONAJMKHXAG-UHFFFAOYSA-N	435.440	1.527	50	20	IDGD	
O=C(CCn1cnc2ccc(Br)cc2c1=O)NNC(=O)Cc1cccnc1	728851211	RCQZPOIQFVPPPJ-UHFFFAOYSA-N	430.262	1.334	50	20	IDGD	
COCCn1nc(C(=O)NNC(=O)c2ccc(Br)cc2Cl)ccc1=O	728870048	OHEKQJJAMHLNGH-UHFFFAOYSA-N	429.658	1.380	50	20	IDGD	
COc1cccc(C[C@@H](C(=O)NNC(=O)Cn2ccc3ccccc32)n2nnnc2C)c1	729450646	ISIRFACLCDOHMS-FQEVSTJZSA-N	433.472	1.576	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)[C@H]2CS[C@@H](Cc3ccccc3F)C(=O)N2)cn1	729691982	GULIDHUIXGRTPJ-CABCVRRESA-N	449.533	1.390	50	20	IDGD	
COC(=O)c1ccc(C(F)(F)F)cc1S(=O)(=O)NNC(=O)c1cccc(C#N)c1	730203867	YKKJSKRJFNQNBT-UHFFFAOYSA-N	427.360	1.987	50	20	IDGD	
Cc1nc(-c2c(C)c(C)nn(C)c2=O)sc1C(=O)NNC(=O)COc1ccccc1O	730779512	CJGAYTLRPWNCGU-UHFFFAOYSA-N	443.485	1.375	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=O)COc2ccccc2O)ccc1C	730779521	CRVNHIQYCVBTHB-UHFFFAOYSA-N	435.502	1.571	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)c2cc(C(N)=O)n(-c3ccccc3)n2)cc1	731958561	SKFWBIIBNLZHQE-CQSZACIVSA-N	437.456	1.598	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)Cn1cc(S(=O)(=O)N(CC)CC)ccc1=O)c1ccccc1	731996835	FXWKVITWGZMXCF-SFHVURJKSA-N	448.545	1.220	50	20	IDGD	
CCCCS(=O)(=O)N1CCC[C@H]1C(=O)NNC(=O)c1ccc(CN(CC)CC)o1	734125416	GKNCHYFHIDMJAY-INIZCTEOSA-N	428.555	1.477	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2ccc(Cl)cc2O)CC1	735117034	LWDRYBPYTGMUGX-UHFFFAOYSA-N	425.898	1.134	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)CCNC(=O)c2ccc(C)cc2O)cc1C	736807702	MTYHZSVUKVEBBQ-UHFFFAOYSA-N	447.513	1.757	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)N2C[C@H](C)C[C@@H](C)C2)c1	739667537	PMKRPVRFBWNMAL-HUUCEWRRSA-N	446.595	1.174	50	20	IDGD	
COCCS(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=O)c2cnn(C)c2)c1Cl	740786040	GRDXUYWOFIGEFY-UHFFFAOYSA-N	435.289	1.222	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)c1ccc(S(=O)(=O)Nc2ccc(C)cc2)cc1	740851286	XRGLZKGLJDXDAV-UHFFFAOYSA-N	446.529	1.862	50	20	IDGD	
O=C(COC(=O)c1ccc(SCCCO)cc1)NNC(=O)[C@@H]1COc2ccccc2O1	740978146	SDALZVQNEUXTAA-SFHVURJKSA-N	446.481	1.305	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H](C)Cc2c(C)nn(C)c2C)c1	742032609	QPMBNZDQDVPAEW-CQSZACIVSA-N	449.577	1.707	50	20	IDGD	
Cc1cc(OCc2ccc(C(=O)NNC(=O)c3cn(CC(N)=O)nn3)cc2)ccc1Cl	742469653	GECGRUWOIMWIEZ-UHFFFAOYSA-N	442.863	1.379	50	20	IDGD	
CCS(=O)(=O)NCc1ccc(C(=O)NNC(=O)c2cccc(Br)c2)cc1	742769828	QWRKPYCADRJRFU-UHFFFAOYSA-N	440.319	1.963	50	20	IDGD	
CN(C)C1(CNC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)Cc2ccccc2C1	743633943	GZAYVGGPNOTCNF-UHFFFAOYSA-N	434.500	1.621	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CN2CCN([C@H](CO)c3ccc(Cl)cc3)CC2)c1	744399043	DNYOTBLMZFILEI-HXUWFJFHSA-N	441.919	1.324	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1cc(=O)c2ccccc2o1	744618836	FDDSGGMOYFESIW-UHFFFAOYSA-N	429.454	1.571	50	20	IDGD	
Cc1cc(=O)c(C(=O)OCC(=O)NNC(=O)c2ccccc2)nn1-c1cccc(Cl)c1	745225197	UXHZUZHPOKALRS-UHFFFAOYSA-N	440.843	1.812	50	20	IDGD	
O=C(CC[S@](=O)c1ccc2c(c1)OCCO2)NNC(=O)c1cnn(-c2ccccc2)c1	746259256	MRDKIBPSIQQASB-HKBQPEDESA-N	440.481	1.602	50	20	IDGD	
COC(=O)c1cc(C(=O)OC)cc(S(=O)(=O)NNC(=O)c2ccc(Cl)cc2F)c1	747618420	STDJTRIWZZXCLB-UHFFFAOYSA-N	444.824	1.676	50	20	IDGD	
Cn1c(=O)nc(O)c2nc(CCC(=O)NNc3ccc(F)cc3Br)[nH]c21	748074672	MLGLTNNKEYTMHX-UHFFFAOYSA-N	425.218	1.340	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCCCN2CCN(c3ccncc3)CC2)cc1OC	748344074	SPYYFVOQDYUDQA-UHFFFAOYSA-N	442.520	1.255	50	20	IDGD	
COc1ccccc1C1(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)CC1	749114242	OMLXTVJJBPOLIX-UHFFFAOYSA-N	443.525	1.973	50	20	IDGD	
O=C(NNC(=O)[C@H]1CC(=O)N(CCOc2ccccc2Cl)C1)c1cccc([N+](=O)[O-])c1	751524015	MHSIRAWXENKQNU-AWEZNQCLSA-N	446.847	1.937	50	20	IDGD	
Cc1cc(S(N)(=O)=O)cc(C(=O)NNC(=O)[C@@H](C)Nc2nc3ccccc3s2)c1C	751591486	VYHCCERWKKZTFZ-GFCCVEGCSA-N	447.542	1.822	50	20	IDGD	
CSCCNC(=S)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	752733748	JKBYSMBMLWGTOM-UHFFFAOYSA-N	427.559	1.860	50	20	IDGD	
CCCn1c(=O)nc(O)c2c(C(=O)NNc3cc(Cl)nc(N)n3)cc(C3CC3)nc21	753457451	LUEYPGQYFGMNFV-UHFFFAOYSA-N	430.856	1.567	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(NC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c1	755368457	XAPHQRCUKUDPHB-UHFFFAOYSA-N	428.474	1.589	50	20	IDGD	
CCNC(=O)c1ccc(NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1	755941627	QMCHXAVKWRFGIR-UHFFFAOYSA-N	447.517	1.218	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2cc(C(F)(F)F)cnc2O)c1	756173521	YUSBTMAKISLFTB-UHFFFAOYSA-N	447.395	1.523	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)Nc1cccc(C(=O)OCc2ccccc2)c1	756450854	UHKSAJITSDBWNS-MRXNPFEDSA-N	431.470	1.631	50	20	IDGD	
COc1ccc(S(=O)(=O)NC(C)(C)C)cc1NC(=O)NNC(=O)CC(F)(F)F	756671285	BARCJMZHLCAFDK-UHFFFAOYSA-N	426.417	1.877	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)N[C@H]1CCN(C(=O)CCc2ccccc2)C1	756916453	BZEWFLORCOZQFF-SFHVURJKSA-N	440.500	1.638	50	20	IDGD	
COCc1nc2n(n1)C[C@@H](NC(=O)NNC(=O)c1cc(F)ccc1Br)CC2	757787675	VHIHBCIQUBAZBP-JTQLQIEISA-N	441.261	1.285	50	20	IDGD	
Cc1nn(C)c(C)c1OCC(=O)NNC(=O)c1ccc(CSc2nncn2C)cc1	758363882	YGWGPAQCDTZNEB-UHFFFAOYSA-N	429.506	1.298	50	20	IDGD	
CCc1nc(C(=O)NNC(=O)C(=O)Nc2ccccn2)nn1-c1c(Cl)cccc1Cl	758840904	TTZOGHKWKCQRPL-UHFFFAOYSA-N	448.270	1.931	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)[C@@H](CC(C)C)/N=C2/NS(=O)(=O)c3ccccc32)nc1	759728329	BUJFBYPBYBIBFU-OAHLLOKOSA-N	445.501	1.465	50	20	IDGD	
CCS(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=O)CCNC(=O)OC(C)(C)C)c1	760437100	BMOHZYOUAADOSS-UHFFFAOYSA-N	433.914	1.809	50	20	IDGD	
CCN(CC(=O)NNC(=O)c1ccc(F)cc1)CC(=O)Nc1ccc2c(c1)OCCO2	762223033	ODNSYPRRMDHRRD-UHFFFAOYSA-N	430.436	1.319	50	20	IDGD	
O=C(NNc1nccc(N2CCOCC2)n1)c1ccc(I)c(F)c1	762865654	JXXUNMGHWGOZGC-UHFFFAOYSA-N	443.220	1.814	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)OC(C)(C)O3)cc(OC)c1OC	763539409	LJLUINOLHVEHHJ-UHFFFAOYSA-N	445.428	1.619	50	20	IDGD	
CCCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C)c(C)c2)cc1	763665296	SONWEODAFXIWAZ-UHFFFAOYSA-N	426.473	1.608	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(F)cc2OCC2CC2)cc1	763678625	IZQCCQWBOPOJLK-UHFFFAOYSA-N	426.404	1.651	50	20	IDGD	
N#Cc1cccnc1-n1cc(NC(=O)C(=O)NNC(=O)CC23CC4CC(CC(C4)C2)C3)cn1	763732960	HQVGRTQZCAXYGG-UHFFFAOYSA-N	447.499	1.831	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)C(=O)Nc1ccc(F)cc1OCC1CC1	763789913	GGPQHNARPDNEAK-UHFFFAOYSA-N	439.403	1.663	50	20	IDGD	
CC(C)Cn1ncc(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)c1C(F)F	763809528	WIVDWQLTKBMGIJ-UHFFFAOYSA-N	434.403	1.513	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)C(=O)Nc1cc(N2CCCC2=O)ccc1Cl	763842645	HNQDBOMIFPXWCT-UHFFFAOYSA-N	448.838	1.771	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)OC)c(C)c2)cc1	763861544	QPZPCQMWWIENIY-CQSZACIVSA-N	443.456	1.734	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccnn2Cc2ccc(Cl)c(F)c2)n1	763885018	IRMBUEZNXXSHLJ-UHFFFAOYSA-N	447.858	1.323	50	20	IDGD	
COC(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CC[C@@H](C)C3)c1	763940940	VJXNACCGCXLOIG-GFCCVEGCSA-N	429.498	1.988	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3cccc4c3oc(=O)n4C)cc2C1	763941980	LHEXUNQXIJNZQT-SNVBAGLBSA-N	428.470	1.718	50	20	IDGD	
C=C(C)COc1cccc(NC(=O)C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)c1	763943951	HEUTWPMXVBLNRL-UHFFFAOYSA-N	435.440	1.933	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)C(=O)Nc1cccc(Oc2cnccn2)c1	763999315	VLDMBSOTIZCUAQ-UHFFFAOYSA-N	445.233	1.759	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1	763999439	WTBQEWVTNWXDFK-UHFFFAOYSA-N	430.602	1.739	50	20	IDGD	
COc1ccc(CN2C[C@H](C(=O)NNC(=O)CSc3ccccc3O)CC2=O)cc1	764048464	QPTHVPOBEKTKIA-OAHLLOKOSA-N	429.498	1.689	50	20	IDGD	
Cc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)nc2)c1C(=O)N1CCCC1	764093346	UIBBRDZRGYYHLL-UHFFFAOYSA-N	429.864	1.679	50	20	IDGD	
Cc1nc(COc2ccc(NC(=O)C(=O)NNC(=O)c3ccc(Cl)cc3O)cc2)no1	764126278	GTRZTXALRFJHHE-UHFFFAOYSA-N	445.819	1.716	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1O)C(=O)Nc1ccc(CCN2CCOCC2)cc1	764126591	MVAVQBLVFFYFJF-UHFFFAOYSA-N	446.891	1.320	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNC(=O)Cc2ccccc2OC)ccc1Cl	764131625	JSWGVLCZFUELEW-UHFFFAOYSA-N	433.848	1.854	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccc(C(=O)NCC(C)C)cc1C	764136328	OPECCUKJUXTVSP-UHFFFAOYSA-N	440.500	1.718	50	20	IDGD	
O=C(CCC1CCCCC1)NNC(=O)C(=O)Nc1ccc(C(=O)N2CCOCC2)cc1	764211050	LYTFTPDDERKKQL-UHFFFAOYSA-N	430.505	1.605	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2scnc2C)cc1OCc1cccnc1	764246393	OOAIBTAZVDKGDZ-UHFFFAOYSA-N	441.469	1.834	50	20	IDGD	
COc1cc(C)ccc1Oc1ccc(NC(=O)C(=O)NNC(=O)Cc2cccnc2)cn1	764265895	GYHWYMBGGIYACT-UHFFFAOYSA-N	435.440	1.915	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)c(Cl)c1)C(=O)Nc1ccccc1S(=O)(=O)C(F)F	764350033	YPKJMKFYHASMDY-UHFFFAOYSA-N	447.803	1.442	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)c(Cl)c1)C(=O)Nc1ccc(CN2CCCC2=O)cc1	764350110	XSVWIZUCFDAPBZ-UHFFFAOYSA-N	430.848	1.568	50	20	IDGD	
COc1cccc(Cn2ccc3ccc(NC(=O)C(=O)NNC(=O)c4cnn(C)c4)cc32)c1	764359262	OGSMRTGSHJJOSV-UHFFFAOYSA-N	446.467	1.831	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)C(=O)Nc1ccc([S@](=O)C(F)(F)F)cc1	764368629	ZKNHKZFKNINKNY-PMERELPUSA-N	443.403	1.617	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)c2ncccc2C)c2ccccc12	764388204	DGUISIZCLHQSSR-UHFFFAOYSA-N	436.424	1.495	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)C(=O)Nc2c(F)cc(Cl)c(C)c2F)c1	764432626	HPNJWUOCWCOTES-UHFFFAOYSA-N	425.779	1.680	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NN=C1C(=O)Nc2ccc(Cl)cc21	764827139	GPXPSOUGUMYCMQ-UHFFFAOYSA-N	425.876	1.570	50	20	IDGD	
Cc1cccc(NC(=S)NNC(=O)CCC(=O)N2CCN(c3ncccn3)CC2)c1C	767854605	IDQXJXNJSMZANJ-UHFFFAOYSA-N	441.561	1.540	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NC[C@@H]1[C@@H]2Cc3ccccc3[C@@H]12	767926171	BHNLMRJZWQZBQH-GVDBMIGSSA-N	427.530	1.818	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)N[C@@H]1CCO[C@]2(CCSC2)C1	769229337	BRBQXDYZRQZULM-XMSQKQJNSA-N	447.605	1.584	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2nccn3c(Br)cnc23)cc1C	769739279	XYJVIXPGWCEZAO-UHFFFAOYSA-N	431.250	1.508	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)NNC(=O)c1cnn(-c2ccccc2)c1	770517203	JXHYHMNBCHBENK-ZDUSSCGKSA-N	442.863	1.968	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCCCC2)cc1C(=O)NNc1nc(O)c2cnn(C)c2n1	770989425	GBSQATRLMYCAAJ-UHFFFAOYSA-N	445.505	1.309	50	20	IDGD	
O=C(Cc1ccccc1I)NNC(=O)c1ccc(-n2cnnn2)cc1	771229158	BUCKUQIGRJKKBM-UHFFFAOYSA-N	448.224	1.271	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)[C@@H](C(C)C)N2CCCS2(=O)=O)cc1	772631407	RIZQCXCIWHJASP-RHSMWYFYSA-N	427.523	1.060	50	20	IDGD	
Cc1cccc(NC(=O)C(=O)NNC(=O)c2nn(CCC(C)C)c(=O)c3ccccc23)n1	773527188	IYFXQSCCOBNFCX-UHFFFAOYSA-N	436.472	1.546	50	20	IDGD	
CCOC(=O)c1cc(Br)ccc1NC(=O)C(=O)NNc1nccc(OC)n1	773727350	XISYVHKPDWTRBO-UHFFFAOYSA-N	438.238	1.506	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccnn2CC2CC2)c1	776034652	SDNVNDIIXFQAPU-UHFFFAOYSA-N	434.522	1.790	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H]2CCN(c3ccc(Cl)cc3)C2)c1	776333329	SZLWULNCLAPMMH-HNNXBMFYSA-N	436.921	1.966	50	20	IDGD	
COc1cccc([C@H]2[C@@H](C(=O)NNC(=O)c3cccc(OC)c3O)CC(=O)N2C2CC2)c1	776467230	KDYPEWMTBSJYTR-PXNSSMCTSA-N	439.468	1.923	50	20	IDGD	
CCOC(=O)N1CCC[C@H]([C@H](C)NC(=O)NNC(=O)CNC(=O)c2cccs2)C1	776866336	DRWQDEWWYJHWLU-STQMWFEESA-N	425.511	1.065	50	20	IDGD	
Cc1cnn(-c2c(C(=O)NNC(=O)c3nn(C(C)C)c(=O)c4ccccc34)c(C)nn2C)c1	778296595	YVUVMOWFKAYTCB-UHFFFAOYSA-N	448.487	1.588	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)C[C@@H]1Sc2ccc(Cl)cc2NC1=O	778442576	XMLSWJCJEOUFHD-LBPRGKRZSA-N	428.898	1.815	50	20	IDGD	
O=C(NNc1nccnc1Cl)[C@H]1CC[C@H](C(=O)NNc2nccnc2Cl)CC1	778506542	PFQGVVLFFMDPCT-MGCOHNPYSA-N	425.280	1.966	50	20	IDGD	
COc1cccc2[nH]cc(CC(=O)NNC(=O)c3ccc(Cl)c(S(N)(=O)=O)c3)c12	778531224	GGEZESPVHPORQS-UHFFFAOYSA-N	436.877	1.481	50	20	IDGD	
O=C(Nc1cnn(CCN2CCOCC2)c1)C(=O)NN(Cc1ccccc1)c1ccccc1	782825250	NPOQHOCISWZNQR-UHFFFAOYSA-N	448.527	1.892	50	20	IDGD	
CS(=O)(=O)CCc1ccc(NC(=O)C(=O)NNc2ccc(Cl)cc2[N+](=O)[O-])cc1	783289695	RWXWMTWSDQVCAY-UHFFFAOYSA-N	440.865	1.917	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2cccc(CCCc3ccccc3)c2)CCS(=O)(=O)C1	783427184	MKXPOFIMBKRJKI-QFIPXVFZSA-N	429.542	1.998	50	20	IDGD	
COc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)C(=O)NNc1nccc2sccc12	783444438	DOLSGGGRQQUWEW-UHFFFAOYSA-N	449.514	1.637	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)cc1	783704500	NJCOAYVZYCKYFR-UHFFFAOYSA-N	435.481	1.269	50	20	IDGD	
CC(=NNC(=O)[C@H](C)CN1CCOCC1)[C@H]1CN(C(=O)OCc2ccccc2)CCO1	783809195	ZVHRKTBSFAFZRY-YLJYHZDGSA-N	432.521	1.484	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)C(=O)Nc1ccc(SC2CCCC2)cc1	784001684	BHIHFTOPVPIWTC-UHFFFAOYSA-N	430.486	1.830	50	20	IDGD	
COC(=O)[C@H]1CN(C(=O)C(=O)NNc2ccc(Br)cn2)c2ccccc2O1	784339039	FQPBCVDWJLDATC-CYBMUJFWSA-N	435.234	1.254	50	20	IDGD	
CCOc1cc(N2CCN(C)CC2)ccc1NC(=O)C(=O)NNc1cc(Cl)ccn1	784860420	FALHHHUWHIDAJG-UHFFFAOYSA-N	432.912	1.967	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNc2c(OC)cccc2S(C)(=O)=O)cc1F	785331236	QJEVAVOFXBTVNQ-UHFFFAOYSA-N	439.421	1.106	50	20	IDGD	
CCOc1ccc(C(=O)NNS(=O)(=O)c2ccc(C(=O)OC)cc2OC)cc1OC	785480948	JTONDIUWPHDPLG-UHFFFAOYSA-N	438.458	1.512	50	20	IDGD	
COc1ccc(OC)c([C@@H]2C[C@@H]2C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1	788085916	FKMHYHKHYRMARK-WMZOPIPTSA-N	447.513	1.519	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1ccc(-n2cccn2)cc1C	789596156	HXCBWKMABOXKTP-UHFFFAOYSA-N	443.485	1.675	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(-c3ccc(F)cc3F)nn2C)c(O)c1	789733745	ULTAEEJIDQDNTD-UHFFFAOYSA-N	429.383	1.779	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cc([C@@H]3CCCO3)nn2C)c1C	789741548	WUVTZZCRROVDID-YOEHRIQHSA-N	429.477	1.442	50	20	IDGD	
Cn1nccc1[C@H]1CCCC(=NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)C1	790281379	HAOHFIRUVOQOJJ-INIZCTEOSA-N	445.545	1.885	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)[C@@](C)(O)Cn1c(C)cccc1=O	792020820	FUBIRSVRVBGPQO-NRFANRHFSA-N	426.498	1.801	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(NC(=O)N(C)C)c2C)cc1	792355144	QJJWIXHYJYZTEO-UHFFFAOYSA-N	427.461	1.562	50	20	IDGD	
O=C(NNc1nc2ccccn2n1)C(=O)Nc1ccc(N2CCc3sccc3C2)nc1	792393141	DGFTZBNTSZZZGW-UHFFFAOYSA-N	434.485	1.830	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N1C[C@@H](C)O[C@]2(CCOC2)C1	792782087	YXWRIPXZEBIHPI-FHSNZYRGSA-N	442.310	1.837	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12	794069768	KDWZERCHMXTPME-UHFFFAOYSA-N	425.401	1.692	50	20	IDGD	
Cc1ccc(N2CCOCC2)cc1NC(=O)C(=O)NNc1cccc(S(C)(=O)=O)c1	797536470	XAJNHSAEVCZLSB-UHFFFAOYSA-N	432.502	1.317	50	20	IDGD	
Cc1ccc(N2CCNC2=O)cc1NC(=O)NNC(=O)CNC(=O)OCc1ccccc1	797651142	MXINSTJOOOSKPI-UHFFFAOYSA-N	440.460	1.604	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)Nc2cc(S(=O)(=O)N3CCCC3)ccn2)cc1	797674095	QMSRKNJYTKSKMF-UHFFFAOYSA-N	433.490	1.406	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@@H]2C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc1	799099815	FERHRVXWYPINSE-GOSISDBHSA-N	449.467	1.652	50	20	IDGD	
O=C(CN1C(=O)c2cccc(Cl)c2S1(=O)=O)NNC(=O)c1ccccc1Cl	799317200	AJAWOQHKSSXYPA-UHFFFAOYSA-N	428.253	1.599	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)c1cc(Cn2cc(Br)cn2)on1	804951836	BFXBECNJKOQMOT-UHFFFAOYSA-N	430.226	1.415	50	20	IDGD	
COC(=O)Nc1cccc(CNC(=O)NNC(=O)CNC(=O)OCc2ccccc2)c1	805405560	OVWIIJPZWKASHI-UHFFFAOYSA-N	429.433	1.622	50	20	IDGD	
CN1C(=C(C#N)C(=O)COC(=O)[C@]2(c3ccccc3)CNC(=O)C2)N(C)c2ccccc21	811236159	JTLXEQAPEULMBW-DEOSSOPVSA-N	430.464	1.878	50	20	IDGD	
O=C(COc1ccc(OCc2ccccc2)cc1)NNC(=O)[C@@]12CCC(=O)N1CCS2	811917035	GIOUWPGCKNGFAQ-QFIPXVFZSA-N	441.509	1.857	50	20	IDGD	
C[C@H]1C[C@H](NC(=O)NNC(=O)CNC(=O)c2cccs2)c2ccsc2S1(=O)=O	812658947	QHBMBZBXZVGMQN-ONGXEEELSA-N	442.544	1.177	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@H](F)C[C@H]1CNC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	813815409	LVIRXVSEZOHKRI-XEZPLFJOSA-N	438.456	1.504	50	20	IDGD	
CC(=NNC(=O)C(=O)Nc1ccccn1)c1cc(Br)ccc1OCC(=O)O	814869126	CQJKOOUGUPMZSQ-UHFFFAOYSA-N	435.234	1.786	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)C(=O)Nc1ccc([C@@H]2CCOC2)cc1	815569195	KIJVWEOMUVWXOH-OAHLLOKOSA-N	434.493	1.581	50	20	IDGD	
COCc1cc(NC(=O)C(=O)NNc2ccc(C(F)(F)F)nn2)cc(C(=O)OC)c1	815602599	FAPJLPPTUONGOT-UHFFFAOYSA-N	427.339	1.510	50	20	IDGD	
Cc1cnc(S(C)(=O)=O)nc1C(=O)NNC(=O)COc1ccccc1-c1ccccc1	816805679	DZJNQZRMVHQYEK-UHFFFAOYSA-N	440.481	1.696	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)c1ccc2c(=O)n(C)c(S)nc2c1	817054567	OJEKYLWAXNCVJL-UHFFFAOYSA-N	433.515	1.229	50	20	IDGD	
CC[C@H](C)C(=O)NNC(=O)C[C@H]1c2cc(OC)c(OC)cc2CCN1S(C)(=O)=O	818038740	JNVGKFXUQIAETQ-WFASDCNBSA-N	427.523	1.146	50	20	IDGD	
COc1ccc([N+](=O)[O-])cc1NS(=O)(=O)c1ccc(C(=O)N2CC[C@H](B(O)O)C2)cc1	864234344	QGQRBLOUZKELFZ-ZDUSSCGKSA-N	449.250	1.093	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1cc(C(=O)N2CC[C@H](B(O)O)C2)ccc1Br	864234853	XGQOSIRSXZNAQV-NSHDSACASA-N	433.133	1.215	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(C(=O)NNC(=O)NC2CCCCC2)ccc1Br	913451064	KBTPNMMARHEVMB-UHFFFAOYSA-N	447.355	1.976	50	20	IDGD	
C=CCNS(=O)(=O)c1cc(C(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)ccc1F	914595037	GXYBGQWRYNYOKB-UHFFFAOYSA-N	448.476	1.307	50	20	IDGD	
Cc1ccc(C)c(S(=O)(=O)NCC(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)c1	915787668	HDXCPQLBMVXCER-QGZVFWFLSA-N	433.530	1.813	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2ccccc2OC)c1	916107915	RKENOZQRBILKOX-UHFFFAOYSA-N	441.531	1.349	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@H]2CC(c3cccc(F)c3)=NO2)cc1	916112390	CFZUSCJSLKLZBM-GOSISDBHSA-N	448.476	1.095	50	20	IDGD	
CN(CCNC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)c1ccccc1	916226232	QWDCGLDYINPMSF-UHFFFAOYSA-N	445.545	1.552	50	20	IDGD	
CO[C@@H](CNC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)c1ccccc1	916271013	BHLOFBOOOVIYKN-NRFANRHFSA-N	425.533	1.917	50	20	IDGD	
Cc1cccc([C@H](CNC(=O)NNC(=O)COc2ccc(F)cc2)N2CCOCC2)c1	916435993	RFPREPMBTCAVBD-FQEVSTJZSA-N	430.480	1.917	50	20	IDGD	
CCCNC(=O)c1cccc(CNC(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)c1	916478258	DDPAQMHQLBCWMP-UHFFFAOYSA-N	425.489	1.912	50	20	IDGD	
CCNC(=O)COc1cccc(CNC(=O)NNC(=O)[C@H](C)Oc2ccccc2F)c1	918090515	GJNUPGBMGXHPOI-AWEZNQCLSA-N	432.452	1.639	50	20	IDGD	
CC[C@H](NC(=O)NNC(=O)COc1cccc(C)c1)c1ccccc1OCC(=O)NC	918222576	YCNIREBXDILFLA-SFHVURJKSA-N	428.489	1.980	50	20	IDGD	
CS(=O)(=O)N[C@H]1CCCN(C(=O)NNC(=O)c2ccc(COc3ccccc3)o2)C1	918779192	FGHKQNLWPXKNHT-AWEZNQCLSA-N	436.490	1.227	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)c2cc(S(=O)(=O)N(C)C)ccc2Cl)cc1	919835713	PXNGIECAXAKNTK-UHFFFAOYSA-N	439.921	1.993	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2cnc(C)s2)c1	1115889090	YISLPQLWVWKCFG-UHFFFAOYSA-N	425.536	1.626	50	20	IDGD	
O=C(NNc1cncc(Br)c1)C1CCN(S(=O)(=O)c2cccnc2)CC1	1319543696	WMSOJLXAUJIOEO-UHFFFAOYSA-N	440.323	1.783	50	20	IDGD	
Cn1ncc2cc(S(=O)(=O)NNC(=O)NCc3cccc(C(F)(F)F)c3)cnc21	1320731400	IDMQBDYFNSGMGN-UHFFFAOYSA-N	428.396	1.680	50	20	IDGD	
Cn1cc(N2CC[C@@H](NC(=O)NNC(=O)c3cc(F)ccc3Br)C2)cn1	1339222102	YLBXXDFQAODDMV-LLVKDONJSA-N	425.262	1.545	50	20	IDGD	
C[C@@H](Cn1cncn1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CO[Si](C)(C)C)C2	1779499661	NTLJTSRFDYDJGL-SQGPQFPESA-N	437.617	1.280	50	20	IDGD	
Cn1cc(C(=O)N2CC[C@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)c(C(F)(F)F)n1	1779540240	FSQVEJFZAHVGEV-KRWDZBQOSA-N	448.518	1.734	50	20	IDGD	
O=C(COCc1ccccc1)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781327974	FUYNXEUBIVGLFK-WMZOPIPTSA-N	429.286	1.724	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccn(C)c1=O)C2	1781997123	FBNXUKVPMYEJFJ-ZXYWRSMDSA-N	440.338	1.296	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(Cl)ncn1)C2	1782173740	OAMGMPHCVMORJE-WPKBUWHJSA-N	431.320	1.511	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)Cc3cnc4ccccn34)CCO2)C1	1783528104	JYNPWWMATNEPGZ-KUHUBIRLSA-N	435.322	1.490	50	20	IDGD	
O=C(c1cc(=O)nc2sccn12)N1CCO[C@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783948490	PBEWQGKVPQUTRR-INIZCTEOSA-N	431.301	1.003	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](C)Oc3cccnc3)C2)C1	1784549530	WVAZZYLVRNZGNC-QOKNQOGYSA-N	440.338	1.852	50	20	IDGD	
COc1ccc(F)cc1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1785025123	RVLPWFOGYSFXHJ-WMLDXEAASA-N	433.249	1.968	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccnc(C(F)F)c3)[C@H]2C1	1785526438	JKJIVJIACDEFCO-YXWQFLTLSA-N	431.867	1.866	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4cnccc4[nH]3)C[C@@H]21	1786406789	DYQOQOZFAGGVHT-JDFRZJQESA-N	435.322	1.941	50	20	IDGD	
N[C@@H](CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)c1cccnc1	1786927675	XMHIDESOQKWQID-QAETUUGQSA-N	439.354	1.236	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(O)nc(O)c3)[C@H]2C1	1787295009	KXYUIWHRYDXTQT-DEQVHRJGSA-N	442.310	1.260	50	20	IDGD	
Cc1nn2cc(CC(=O)N3CC[C@H]4CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]4C3)nc2s1	1787443742	RYKSXXMCXBXNCC-NHULGOKLSA-N	429.905	1.156	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CC3CC3)C[C@@H]21	1789222351	URWSQESRTOMJNT-QSFXBCCZSA-N	445.472	1.914	50	20	IDGD	
C=CC[C@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C[C@@H]21	1790829677	QYWKYMSXYJTMLJ-BQRDVNJZSA-N	429.521	1.312	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(Cl)cnc3O)C[C@@H]21	1791054428	GVGCDXUDEGNJGN-OAACRXHESA-N	446.729	1.817	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4cccn4cn3)C[C@@H]21	1791055863	JQGJMHZRNRIJOS-RMRKRWHISA-N	435.322	1.711	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1snnc1C1CC1)C2	1792868357	VEMDNEBXDRQKPY-FOUMNBMASA-N	443.367	1.650	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](O)CCl)C1	1793111856	ZNDGMIJNWNDYAZ-ARKGTOAJSA-N	429.945	1.481	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)COc1c(C)cc(C)cc1C	1793242805	PBNNVJOGJAHEGH-DMUMMCEESA-N	438.952	1.834	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CC[C@H](C(=O)OC)CC1)C2	1793447660	LYHMNUZEGAYNOG-PDCGBLAGSA-N	428.957	1.963	50	20	IDGD	
CC(C)c1nc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)Br)C3)no1	1794003023	KQAAKCCCDSUDTJ-MCYUEQNJSA-N	429.315	1.109	50	20	IDGD	
Cc1ccc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Br)C3)nc1	1794091135	GAYISEUTVCDMKK-DLTLXFJOSA-N	428.302	1.603	50	20	IDGD	
O=C(CCNC(=O)c1ccc[nH]1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCBr	1795490909	AMWYELWTXPZFEB-BTTYYORXSA-N	425.327	1.558	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2c[nH]nc2c1	1796165379	AFSKFMUFGCXDJS-RMIITELYSA-N	435.322	1.797	50	20	IDGD	
C=CC[C@@H](CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Cl)NC(=O)OC(C)(C)C	1796369758	CSFUFNOCKSBFLK-AUOOEQCUSA-N	447.935	1.970	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(C)nc(O)c1	1796379058	HJVNZBJQEZCUTM-HLPPOEQASA-N	426.311	1.472	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(F)cn1C)C2	1796892550	OIIPLSHYAOFXOW-XMOXNHLCSA-N	428.468	1.550	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(-n3cccn3)cc1)C2	1797956273	NPCPOEZQWBYQBW-RMFSNUHRSA-N	442.592	1.927	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)NC(=O)c1ccc(F)cc1	1799050058	FXRFNRNOTWCAJQ-CNGORYIKSA-N	439.915	1.551	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3cccn3cn1)C2)[C@@H](F)Br	1799347855	VMJCWXVACIMFNC-BAESOJJISA-N	425.258	1.228	50	20	IDGD	
CS(=O)(=O)c1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](F)Br)nc1	1800157109	HBABYSTVAUTCSH-FBKDDSFISA-N	448.314	1.427	50	20	IDGD	
CC(=O)N[C@H](C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1801677485	UUJTZGIBDLQQDC-JZYAIQKZSA-N	444.960	1.281	50	20	IDGD	
COC(=O)CSCC(=O)NC[C@H]1CCN(C(=O)C(Cl)Cl)[C@@H]1c1cccnc1	1803580329	LRWMYMLBHNJANI-IUODEOHRSA-N	434.345	1.797	50	20	IDGD	
C[C@H](CS(C)(=O)=O)C(=O)NC[C@@H]1CCN(C(=O)C(Cl)Cl)[C@H]1c1cccnc1	1803591778	XLZIBYFJRHOPAY-XBFCOCLRSA-N	436.361	1.572	50	20	IDGD	
C[C@H](C#N)c1cccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)c1	1803679329	PMIGCHYSUGMNFU-ZHHJKBAOSA-N	431.301	1.559	50	20	IDGD	
O=C(/C=C/c1ccoc1)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1804314689	YLLWLEAJJHJYCB-HXKKIVOGSA-N	445.284	1.387	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)c1n[nH]c2c1CCCC2	1808041063	RAAZHULQAYNJJP-POZUXBRTSA-N	431.924	1.603	50	20	IDGD	
Cc1ncc(C(=O)NC[C@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)s1	1808907072	HPHJXIBRPGQQEQ-OXQOHEQNSA-N	444.561	1.539	50	20	IDGD	
CC(C)N[C@@H](C(=O)N1CCCC2(CCN(C(=O)c3cccc(B(O)O)c3)CC2)C1)C(C)C	1809942042	HWKUEJSUFQMDSH-OAQYLSRUSA-N	443.397	1.234	50	20	IDGD	
Cc1nnc(CC(=O)N2CC[C@H](CNC(=O)[C@H](C)Br)[C@H]2c2cccnc2)o1	1812863274	GJKVMQVMQSVFQI-FABXCBLPSA-N	436.310	1.805	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccccc2-n2nccn2)[nH]n1)[C@@H](O)CCl	1814873286	UKYDPPLPGKNCKT-IRXDYDNUSA-N	443.895	1.896	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)Cc3ccsc3)sc2C1	1815612526	FRQYXECJLMKRJR-CYBMUJFWSA-N	435.575	1.732	50	20	IDGD	
CN[C@H](CC(=O)N1CCCC[C@H]1c1cc(NC(=O)CCBr)n[nH]1)C(=O)O	1816781948	JLEDXYKTBKVAOZ-NEPJUHHUSA-N	430.303	1.250	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@H](O)CCl)CC2)c1[nH]cnc1-c1cccnc1	1821257468	YSCBJKUFBYNWFT-DGCLKSJQSA-N	446.920	1.754	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CN1CCOC1=O)CC2	1822861403	ZJNJVRXMFLURLO-FVMDXXJSSA-N	435.333	1.744	50	20	IDGD	
CC(C)(C)[C@H](O)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1	1824135394	ZUFJSXOKTYORIR-VQTJNVASSA-N	430.354	1.007	50	20	IDGD	
COCCn1ccc(C(=O)N[C@@H]2CCc3nc(NC(=O)[C@H](Cl)COC)sc3C2)n1	1825997858	DDVGWROIIVFEDQ-VXGBXAGGSA-N	441.941	1.466	50	20	IDGD	
Cc1ccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)nc1	1827056008	NOYDAUHILFHNJY-JOCHJYFZSA-N	435.333	1.617	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ncc(F)cc3F)C2)C1	1830353584	GARYZESNJUFJAG-LJQANCHMSA-N	431.867	1.695	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3n[nH]c(C4CC4)c3F)C2)C1	1830357619	BKXGFEFTPLVPAD-HXUWFJFHSA-N	442.919	1.761	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)o1	1830535852	UQHTYPSLRSHBRC-UGSOOPFHSA-N	429.311	1.689	50	20	IDGD	
CSCC(C)(C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1831538321	PFCQMBHYGRLXOB-WBMJQRKESA-N	441.363	1.523	50	20	IDGD	
COc1ccc(C(=O)N2CCC(N3CCC(NC(=O)[C@@H](O)CCl)CC3)CC2)s1	1833308490	UEVMSEUCTQVXQZ-HNNXBMFYSA-N	429.970	1.542	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3ncc(F)cc3F)CC2)CC1	1833603315	BCRVGUFYNYSLTJ-MRXNPFEDSA-N	444.910	1.799	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ocnc3C)CCO2)C1	1834369335	HPHWXOQFUFOOQU-GUYCJALGSA-N	430.299	1.227	50	20	IDGD	
CCc1oncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)Br)C2)C1	1834522122	FPGIPCVZHREZSP-SJKOYZFVSA-N	430.299	1.090	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3nc4ccccn4n3)CC2)CC1	1834970433	XPKJOJWCMDPGQY-QGZVFWFLSA-N	448.955	1.168	50	20	IDGD	
O=C([C@H](F)Cl)N1CCOC[C@@]2(C1)CN(C(=O)[C@]1(F)CCCCC1(F)F)CCO2	1836627704	MZCMQWGGGVGOKE-APHBMKBZSA-N	430.826	1.895	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)Cc3cc(C)n(C)n3)CC2)CC1	1836772407	PZWATNRQIZWJCE-LJQANCHMSA-N	440.972	1.523	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3n[nH]c4ccc(F)cc34)CCO2)C1	1837043036	OXVVOWRXMOYLDX-FOIQADDNSA-N	438.887	1.789	50	20	IDGD	
Cc1cncc(C(=O)N2CCC(OC3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)c1	1837500218	BKJZAIYINQICOA-UHFFFAOYSA-N	445.564	1.375	50	20	IDGD	
O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(Cl)cn1)CCO2	1837894538	OSTOZQFUZQTWKW-QGZVFWFLSA-N	446.729	1.590	50	20	IDGD	
CC(C)n1nccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)CCBr)C2)C1	1838020373	CYCJDVPGBIBKAB-GOSISDBHSA-N	443.342	1.319	50	20	IDGD	
O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)c1ccccc1F)CCO2	1838854360	DKWLRFWMWRJCAC-GOSISDBHSA-N	429.286	1.681	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccc4ncnn4c3)CCO2)C1	1839047533	UIIWNACHBLBXMI-DYESRHJHSA-N	449.939	1.136	50	20	IDGD	
CC(C)=NO[C@H](C)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2	1839154190	GBYHMWYFTXCWBC-FHLIZLRMSA-N	438.352	1.480	50	20	IDGD	
O=C(c1cc2cccnn2c1)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1839562132	LIMGHCDNXAZVGA-GOSISDBHSA-N	427.288	1.208	50	20	IDGD	
C=CCC(F)(F)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)Br)C2)C1	1839890740	QVNVYAVETZCRAS-DOMZBBRYSA-N	425.270	1.438	50	20	IDGD	
CC(C)[C@H]1CC[C@H](C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)CC1	1839974494	OLJVCIPNEFVNKJ-NEYJZJCJSA-N	430.973	1.505	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(O)c(F)c3)C2)C1	1840035396	PXMVHJXYDZGFMD-KZULUSFZSA-N	445.285	1.385	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(OC)cc3)C2)C1	1840153807	AXKWCRXHQZTNQZ-XLIONFOSSA-N	426.897	1.019	50	20	IDGD	
C[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1)c1cccs1	1840375875	DFDSHRXGYOIECP-JDFRZJQESA-N	449.342	1.999	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1cccc3ncccc13)C2	1844264193	RFHSSXNLAWZVSJ-UHFFFAOYSA-N	430.468	1.364	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCCC12CN(C(=O)[C@@H]1C[C@@]13C(=O)Nc1ccccc13)C2	1844379273	LKSKAQVZVMHCPH-AOMKIAJQSA-N	427.577	1.951	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)[C@@H]1C[C@H]3CC[C@@H]1O3)C2	1844693151	BRGHCXOZLOYDEC-SUMDDJOVSA-N	443.456	1.905	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)c2cccc(-c3cnccn3)c2)C1	1844734140	UPRWNHXTTYAZJZ-UHFFFAOYSA-N	436.516	1.334	50	20	IDGD	
CC(C)(C)OC(=O)NC1(C(=O)N2CC3(CCCN3C(=O)[C@@H](F)Br)C2)CC1	1845220839	QJNKQNHSPPMSKB-LLVKDONJSA-N	434.306	1.938	50	20	IDGD	
O=C([C@@H](O)CCl)N1CC2(CCCN2C(=O)Cc2ccc(Br)cc2F)C1	1845943318	MIZRRYIVUMWHMB-AWEZNQCLSA-N	433.705	1.934	50	20	IDGD	
CC(C)[C@H](CNC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)[C@H](O)CCl)C2	1846311028	ALUPOMANDOUWKQ-LSDHHAIUSA-N	431.961	1.586	50	20	IDGD	
C[C@H](C(=O)N1CCCC12CN(C(=O)[C@@H](Br)Cc1ccccc1)C2)n1cnnn1	1846648346	WKHWGEVHLMWFQR-ZBFHGGJFSA-N	447.337	1.444	50	20	IDGD	
Cn1ncc(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](F)Br)c1C(F)(F)F	1848304625	QTTMVDBWJJTVBI-QXEWZRGKSA-N	427.196	1.945	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2ccc(OC(F)F)cc2)cc1	17405996	HRTFBCPUQDMERF-UHFFFAOYSA-N	427.429	1.678	50	20	IDGD	
O=C(COC(=O)CCNS(=O)(=O)c1ccccc1)NNC(=O)c1ccc(Cl)cc1	21691252	OHZPKWZXNVFASQ-UHFFFAOYSA-N	439.877	1.013	50	20	IDGD	
C[C@H](NC(=O)c1ccco1)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	28196717	WGNYJTLGBNKZSQ-AWEZNQCLSA-N	448.501	1.034	50	20	IDGD	
C[C@H]1CCCC[C@@]12NC(=O)N(CC(=O)NNC(=O)c1cc(-c3ccccc3)on1)C2=O	28792810	BTSWNCMCQWLISQ-YEJXKQKISA-N	425.445	1.603	50	20	IDGD	
CCOc1ccc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)c3ccon3)cc2)cc1	109027553	JECCOXJGYFJCJQ-UHFFFAOYSA-N	430.442	1.949	50	20	IDGD	
Cc1cc(C)n(-c2ccc(Cl)c(C(=O)NNC(=O)CNC(=O)c3cccs3)n2)n1	725741950	WJYKODKVVIVAPK-UHFFFAOYSA-N	432.893	1.790	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=S)NCC2CCC2)sc1Br	727865392	NYRFNIUPTAPZHB-UHFFFAOYSA-N	427.371	1.067	50	20	IDGD	
CN(C)N(C(=O)c1cc(F)ccc1I)[C@@H]1CCS(=O)(=O)C1	728161418	IILSPKOKMIHEAA-SNVBAGLBSA-N	426.251	1.536	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)NCCCN2C[C@H](C)O[C@@H](C)C2)c1	728742789	OOCHRWSCGWUUKF-STQMWFEESA-N	443.342	1.901	50	20	IDGD	
O=C(NCc1ccc(-n2cncn2)nc1)NNC(=O)c1cc(F)ccc1Br	728744806	PMZZMIGGYQQYLQ-UHFFFAOYSA-N	434.229	1.708	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)Cc2ccc(S(=O)(=O)N3CCCCC3)s2)c1	728828373	VHLUUGCTOLIBTA-UHFFFAOYSA-N	432.527	1.798	50	20	IDGD	
Cc1ccc(C(=O)NCCC(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)c(O)c1	728972415	VDTHCZBWSAPRAH-UHFFFAOYSA-N	427.429	1.960	50	20	IDGD	
CC[C@@H](CC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)C(C)C	729301816	MGHRKUACNKYBKZ-SFHVURJKSA-N	439.578	1.860	50	20	IDGD	
O=C(NNC(=O)c1cnn[nH]1)c1ccc(Cl)c(NS(=O)(=O)c2ccc(F)cc2)c1	729455587	MTHFSRNAXNLOBY-UHFFFAOYSA-N	438.828	1.473	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)[C@@H](C(C)C)N(C)C)c2)cc1	730103893	KQVGHYDDFARCES-LJQANCHMSA-N	448.545	1.843	50	20	IDGD	
O=C(NCCS(=O)(=O)NCc1ccccc1)NNC(=O)c1cccc2ncccc12	730119062	PVMSGWUNQFENAH-UHFFFAOYSA-N	427.486	1.298	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCN(c2ccc3c(c2)OCCO3)C1=O)c1ccc2c(c1)OCO2	730513381	ZVUNIUGMPXPXQO-CQSZACIVSA-N	425.397	1.001	50	20	IDGD	
COc1ccc2cc(C(C)=NNC(=O)CSc3nn(C)c(=O)n(C)c3=O)ccc2c1	730568774	AUMLWSSENZIWAZ-UHFFFAOYSA-N	427.486	1.273	50	20	IDGD	
COC(=O)NCCCC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	730768538	BBQVTXLDGHOSLN-UHFFFAOYSA-N	448.501	1.062	50	20	IDGD	
C[C@@H](NC(=O)c1ccc(Br)s1)C(=O)NNC(=O)COc1ccccc1O	730778899	YOMHBKIMKQHILJ-SECBINFHSA-N	442.291	1.561	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)c1ccc2c(c1)C(=O)N(Cc1ccncc1)C2=O	730782404	MJUPKIIIMUOHJQ-UHFFFAOYSA-N	446.419	1.423	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)NC3CCN(CCS(C)(=O)=O)CC3)cc2C1	731679821	XBPYZJRNPKIZNM-ZDUSSCGKSA-N	442.607	1.326	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)CNC(=O)c1cc(OC)c(OC)c(OC)c1)c1ccccc1	732292226	SXNMYEWMPXQNHC-INIZCTEOSA-N	429.473	1.783	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)c2cc(S(=O)(=O)C(C)C)ccc2F)cc1	732395823	JABJWDPUSCGKNK-UHFFFAOYSA-N	436.461	1.934	50	20	IDGD	
Cn1c(N)c(C(=O)/C(C#N)=C/c2ccccc2I)c(=O)n(C)c1=O	732578051	BIKOCXISVMNMSE-JXMROGBWSA-N	436.209	1.061	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](NC(=O)NNC(=O)CNC(=O)c2cccs2)C1	734167802	COQUPBYWNPWXFW-GFCCVEGCSA-N	425.511	1.208	50	20	IDGD	
CSCC[C@@H](NC(=O)c1ccc([N+](=O)[O-])o1)C(=O)NNC(=O)Cc1ccsc1	734439466	FADBBRWSZOVGLJ-LLVKDONJSA-N	426.476	1.491	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)C3(c4cccc(F)c4)CC3)cc2)CC1	734549638	XWHYOKWHOGBYQI-UHFFFAOYSA-N	432.521	1.937	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)C2CCN(c3cnccn3)CC2)CC1	734880697	BQCLXTMPUKXWHT-UHFFFAOYSA-N	447.540	1.423	50	20	IDGD	
COc1ccc(S(=O)(=O)C[C@H](C)C(=O)NNC(=O)c2ccc(OC)c(OC)c2)cc1	734990181	BGPSXSWJMSCUHG-ZDUSSCGKSA-N	436.486	1.583	50	20	IDGD	
CCC(=O)Nc1cccc(C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)c1	735118275	PLUZMUNQNRYREK-UHFFFAOYSA-N	446.533	1.123	50	20	IDGD	
CC(=NNC(=O)Cc1csc(N2CCOCC2)n1)[C@@H]1CN(Cc2ccccc2)CCO1	735612333	NFUDDONIFQYTMS-FQEVSTJZSA-N	443.573	1.915	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCC[C@@H](CN3CCC(C)CC3)C2)cc1OC	735871464	PBADKOKNZBZSTI-SFHVURJKSA-N	432.565	1.909	50	20	IDGD	
Cc1ccccc1O[C@@H](C)C(=O)N1CCN(CC(=O)NNC(=O)c2cccs2)CC1	736622965	FLAJGDMSHVFBRN-INIZCTEOSA-N	430.530	1.429	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)c2cc(S(N)(=O)=O)ccc2C)cc1C	736734650	DEVOYJAPURHZTO-UHFFFAOYSA-N	439.515	1.193	50	20	IDGD	
CC[C@@H](C)[C@H](NC(=O)N1CCCC1)C(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	736834792	ZPMXQYGMSWPQJE-DYVFJYSZSA-N	449.464	1.119	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H]2[C@@H]3CCO[C@@H]3C2(C)C)c1	741426608	VVFWXBFYGBMNHL-BBWFWOEESA-N	438.550	1.475	50	20	IDGD	
COc1ccc(-c2nnc(SCC(=O)NNC(=O)c3cccc(C)c3)n2N)c(OC)c1	742449632	LDUIQDSGWNIKOA-UHFFFAOYSA-N	442.501	1.538	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N[C@@H]2CC(=O)N([C@@H]3C[C@H]3c3ccccc3)C2)cc1OC	743521332	PRAXUQVHOCWDSA-FGTMMUONSA-N	438.484	1.805	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)CC[C@@H]2Cc3ccccc3NC2=O)cc1	743830025	KQJJBDMPQRVQFP-CQSZACIVSA-N	430.486	1.834	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)[C@H](c2ccccc2)N2CCSCC2)cc1	745087749	CCIVWPJSNAFPFH-FQEVSTJZSA-N	438.509	1.653	50	20	IDGD	
O=C(NN=C1CCC[C@@H](N2C(=O)c3ccccc3C2=O)C1)c1ccc(-n2cnnn2)cc1	745198436	QMZHNGQDLGZHCY-QGZVFWFLSA-N	429.440	1.987	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)c2sccc2S(=O)(=O)N2CCCC[C@H]2CCO)n1	745491384	MRSKOJLTWGSUMK-AWEZNQCLSA-N	439.563	1.837	50	20	IDGD	
Cc1cc(N2CC[C@H](NC(=O)NNC(=O)c3cc4c(s3)CCCCC4)C2=O)n(C)n1	745907132	ZIZURUFLMFJMAF-AWEZNQCLSA-N	430.534	1.808	50	20	IDGD	
CC(C)c1nc(C#N)c(NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)o1	746340084	YFXFLNPBIOGWQI-UHFFFAOYSA-N	447.517	1.766	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)c1ccccc1NS(=O)(=O)C(F)(F)F	746641047	LFDXBTAYWXXBST-UHFFFAOYSA-N	441.391	1.600	50	20	IDGD	
COc1ccc(CN2CC[C@H](NC(=O)NNC(=O)Cc3cn4ccccc4n3)C2=O)cc1	746765419	JNRASIZWUZEZGZ-SFHVURJKSA-N	436.472	1.017	50	20	IDGD	
CN(C)[C@@H](CNC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)c1ccc(Cl)cc1	746778863	YLNKVHFISRCHMM-KRWDZBQOSA-N	438.937	1.990	50	20	IDGD	
COc1ccccc1C(C)(C)C(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1	746817782	FXFYNCNMPUTQMA-UHFFFAOYSA-N	433.530	1.749	50	20	IDGD	
COc1cc(OC)cc(N2CC[C@@H](NC(=O)NNC(=O)c3cccc(N(C)C)c3)C2=O)c1	747952932	DWTWPQOJGZAMDO-LJQANCHMSA-N	441.488	1.519	50	20	IDGD	
Cc1ccsc1[C@H]1C[C@H]1C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	747975397	LLGDFBWAGYZNGI-ZWKOTPCHSA-N	426.542	1.765	50	20	IDGD	
COc1ccccc1C1(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)CC1	749161211	VQWTZMYDMHGMGA-UHFFFAOYSA-N	443.525	1.973	50	20	IDGD	
CN(C)N(C(=O)c1ccc2ncc(I)n2c1)[C@@H]1CCS(=O)(=O)C1	749317921	LRORXRUYFZSBLA-LLVKDONJSA-N	448.286	1.045	50	20	IDGD	
O=C(NNC(=O)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1)[C@@H]1CCS(=O)(=O)C1	751062870	NSKYJKXIUHHSPF-RHSMWYFYSA-N	433.452	1.023	50	20	IDGD	
Cc1nn(C(C)(C)C)cc1C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	752634288	LOAHUFHQKSTUNV-UHFFFAOYSA-N	434.566	1.640	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)ccc1F	752798602	XJJZCKHKSYCWPR-UHFFFAOYSA-N	437.421	1.487	50	20	IDGD	
CO[C@H]1C[C@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)C1(C)C	753554939	FEDNZTKRJZIOGN-IRXDYDNUSA-N	438.550	1.619	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)sc1S(N)(=O)=O	754184752	UCYPANSFOIKOCN-LLVKDONJSA-N	427.504	1.249	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(n2cc(NC(=O)C(=O)NNc3ccccn3)cn2)CC1	755347216	BRZAWOKWHVSURG-UHFFFAOYSA-N	429.481	1.932	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)Nc1cccc(C(=O)N2CCOCC2)c1	755933133	FSSWWJJEPBBQRL-UHFFFAOYSA-N	436.266	1.716	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)CCC(=O)NC3CCCC3)CC2)cc1	756002958	LPKKTEFAYDUECW-UHFFFAOYSA-N	429.565	1.099	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)[C@@H](O)c2cc(Cl)cc(Cl)c2)n1	756752823	GNVZXPGAYMVTJU-HNNXBMFYSA-N	432.285	1.725	50	20	IDGD	
O=C(Cn1cc(NC(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)cn1)NC1CCCC1	756795150	ONVZMPQNGSNCCG-UHFFFAOYSA-N	442.505	1.860	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)Nc1ccc(C[C@H]2CC(=O)NC2=O)cc1	756817255	WXXRKHRMQVBMCL-JSGCOSHPSA-N	428.420	1.651	50	20	IDGD	
Cc1cnn(-c2ccc(S(=O)(=O)NNC(=O)[C@@H]3COc4ccccc4O3)cc2F)c1	757644746	KOGLMUXGRZGFNN-SFHVURJKSA-N	432.433	1.469	50	20	IDGD	
CC[C@@H](C)NS(=O)(=O)c1cccc(NC(=O)NNC(=O)c2cncc(NC(C)=O)c2)c1	757711780	RSTAHTCHMKNVOX-GFCCVEGCSA-N	448.505	1.583	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](CCC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)C1	758095904	MNPHMSMJXUATOD-AWEZNQCLSA-N	429.481	1.461	50	20	IDGD	
COc1ccc(-c2nc(C)c(C(=O)NNC(=O)C(=O)Nc3ccccn3)s2)cc1OC	758841847	VPUDTQDJIVIAKQ-UHFFFAOYSA-N	441.469	1.930	50	20	IDGD	
Cc1nc(COc2cccc(C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)c2)no1	759020653	PTDIOEZAXKZQTL-UHFFFAOYSA-N	437.460	1.425	50	20	IDGD	
N#Cc1ccc(C(=O)NNS(=O)(=O)c2ccc(Br)c([N+](=O)[O-])c2)cc1	760343894	ZWBQJFNXCFEFDR-UHFFFAOYSA-N	425.220	1.852	50	20	IDGD	
CN1CCC(CNC(=S)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)CC1	760492778	KRWAXPSZZVKFLK-UHFFFAOYSA-N	428.603	1.406	50	20	IDGD	
C[C@H](OC1CCCCCC1)C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	761568898	ZJJNXVZWOCWWGP-INIZCTEOSA-N	439.582	1.589	50	20	IDGD	
O=C(NNC(=O)c1ccccn1)C(=O)Nc1ccc(CC(=O)N2CCc3ccccc32)cc1	763466368	HEHKQBSKOLORPZ-UHFFFAOYSA-N	443.463	1.613	50	20	IDGD	
O=C(NNC(=O)c1cccnc1)C(=O)Nc1cc(-c2nnc3n2CCCCC3)ccc1F	763491351	HZGKKSZEMFVWBP-UHFFFAOYSA-N	437.435	1.605	50	20	IDGD	
COc1ncnc(N(C)C)c1NC(=O)C(=O)NNC(=O)COc1cc(C)ccc1C(C)C	763598443	YPEZQNWXKNNCJX-UHFFFAOYSA-N	444.492	1.148	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2ccc(C)c(N3CCOC3=O)c2)c1	763665548	YQNTWPTYLLIEQY-UHFFFAOYSA-N	440.456	1.733	50	20	IDGD	
O=C(NNC(=O)C1=S=C2CCCC2=C1)C(=O)Nc1ccnn1-c1cccc(Cl)c1	763784640	FTWLVSOTYQWGCV-UHFFFAOYSA-N	429.889	1.814	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)C(=O)Nc2cscc2C)c2ccccc2c1=O	763801560	YBJGUKYBMSYDDS-UHFFFAOYSA-N	427.486	1.966	50	20	IDGD	
COC(=O)c1c(NC(=O)C(=O)NNC(=O)COc2ccc(C)cc2)sc2c1CCCC2	763822359	YURIEBQYBPOIEO-UHFFFAOYSA-N	445.497	1.887	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)Cc2c(C)nn(CC(F)(F)F)c2C)cc1	763840856	CXOVWEGPZLSHBR-UHFFFAOYSA-N	426.395	1.918	50	20	IDGD	
CC(C)n1ncc2cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc3ccc(F)cc3)cnc21	763866383	OWWJVEMFYKPGFW-GFCCVEGCSA-N	428.424	1.705	50	20	IDGD	
COC(=O)c1ccsc1NC(=O)C(=O)NNC(=O)c1ccc(Br)s1	763938396	FABDVDJZCMNNPE-UHFFFAOYSA-N	432.277	1.758	50	20	IDGD	
Cc1cc2c(cc1NC(=O)C(=O)NNC(=O)c1ccc(Br)s1)OCO2	763940395	QLXPTXVQOLJSLP-UHFFFAOYSA-N	426.248	1.947	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)C(=O)Nc1cccc(-n2ccnc2)c1	763945043	SLHPPJHVHNADCU-UHFFFAOYSA-N	431.412	1.163	50	20	IDGD	
Cc1ccnn1-c1ccccc1NC(=O)C(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	763949641	QIKIJUIWFHGWQT-UHFFFAOYSA-N	445.439	1.472	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)cc1N1CCOC1=O	763977848	WBBFFEQCUSLBEU-UHFFFAOYSA-N	432.820	1.710	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1ccc(Cc2ccncc2)cc1	764004180	MCYMXTKQBSBNDF-UHFFFAOYSA-N	432.436	1.843	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1ccc(CN2CCOC2=O)cc1	764020418	XZLIBKXOBYHHEJ-UHFFFAOYSA-N	446.847	1.701	50	20	IDGD	
COc1ccc(C#N)cc1NC(=O)C(=O)NNC(=O)c1ccc(F)cc1Br	764086318	QQDJDNYSZLCUNP-UHFFFAOYSA-N	435.209	1.868	50	20	IDGD	
O=C1CN(c2ccc(NC(=O)C(=O)NNC(=O)Cc3ccc4ccccc4c3)cc2)CCN1	764092208	OUNVMPJDBIYPFU-UHFFFAOYSA-N	445.479	1.105	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(N3C[C@H](C)O[C@@H](C)C3)nc2)c(O)c1	764104605	BQECSDWZYGBUJS-KBPBESRZSA-N	427.461	1.109	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)cc1	764125021	QFPADFSUECTNKP-UHFFFAOYSA-N	440.865	1.207	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2O1)C(=O)Nc1ccc(-c2noc(C(F)F)n2)cc1	764163870	NAORTFBVCLMMJH-CQSZACIVSA-N	443.366	1.764	50	20	IDGD	
O=C(Cc1cc[nH]n1)NNC(=O)C(=O)Nc1cccc(C[S@](=O)C2CCCCC2)c1	764294404	YMFPLHICFLTISX-PMERELPUSA-N	431.518	1.320	50	20	IDGD	
Cc1nc(Br)ccc1NC(=O)C(=O)NNC(=O)c1cnn(-c2ccccc2)c1	764350734	JTPUGDAXVXDLTH-UHFFFAOYSA-N	443.261	1.738	50	20	IDGD	
Cc1cccc(Cn2nccc2NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)c1	764377163	APJQNPDXIAMDEX-UHFFFAOYSA-N	443.410	1.998	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1ccccc1Oc1cc(F)cc(F)c1	764397052	FHIRULOWPAZOLW-LBPRGKRZSA-N	437.399	1.895	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COCCO1)C(=O)Nc1ccccc1SC[C@@H]1CC1(Cl)Cl	764430047	RDCSPSKPGBUPMZ-JQWIXIFHSA-N	448.328	1.474	50	20	IDGD	
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	765316496	SUGGWACXMMLBQH-HNAYVOBHSA-N	445.545	1.946	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)c2cc(S(=O)(=O)N(C)C)ccc2O)c1C	766969202	XBFPNQWTTDUVQU-AWEZNQCLSA-N	435.502	1.488	50	20	IDGD	
O=C(NNC(=O)c1ccccc1O)C(=O)Nc1cnn(-c2ccccc2)c1C(F)(F)F	769257104	WDCYQUSKSDLGPU-UHFFFAOYSA-N	433.346	1.996	50	20	IDGD	
COc1cccc(C[C@@H](C(=O)NNc2ccc(OC)cc2[N+](=O)[O-])n2nnnc2C)c1	769313509	ZDEYDNWVOWBERT-SFHVURJKSA-N	427.421	1.834	50	20	IDGD	
Cc1noc(C)c1CSCC(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	769649039	YQADQRNRGAXHFY-INIZCTEOSA-N	435.458	1.055	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)NCCCn1nc2n(c1=O)CCCC2	770261088	WSYYIPCMBMVQSE-ZDUSSCGKSA-N	436.900	1.223	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)c3cc([N+](=O)[O-])cc4c3OCCO4)nc21	770966054	QLHWTIVQPHHPPS-UHFFFAOYSA-N	429.393	1.723	50	20	IDGD	
N#Cc1cccc(C(=O)NNS(=O)(=O)c2cc(C(=O)O)c(F)cc2Br)c1	771144325	RABHMQYQBDYXJO-UHFFFAOYSA-N	442.222	1.781	50	20	IDGD	
CC(C)c1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cn1	772005173	QKVUONFNZGNUSP-UHFFFAOYSA-N	432.502	1.301	50	20	IDGD	
COCCOCc1cc(C(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)ccc1F	772197057	UOCWOTWFOSTPOX-UHFFFAOYSA-N	437.855	1.720	50	20	IDGD	
COc1c([N+](=O)[O-])ccc(C=NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)c1O	773029468	YTZXCRDUPBIRMF-UHFFFAOYSA-N	436.446	1.388	50	20	IDGD	
O=C(NNc1ccc(C(F)(F)F)cn1)C(=O)Nc1cccc(CN2C(=O)CNC2=O)c1	773680784	ZTMTYNFVLMQVAX-UHFFFAOYSA-N	436.350	1.234	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1ccc(C(N)=O)cc1)C(=O)NNc1ccc(C(F)(F)F)cn1	775257160	DIRJIVAAHHAEHH-SECBINFHSA-N	431.396	1.009	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)CN(C)C)c(C(=O)N2[C@@H](C)CCC[C@H]2C)cc1OC	775481471	KOTMJYAZLCASCR-OKILXGFUSA-N	435.525	1.821	50	20	IDGD	
O=C(NNC(=O)C(=O)N1CCCC1)N[C@@H](c1cc(F)cc(Br)c1)C1CC1	776258846	HCFFKZBVLRAIGJ-CQSZACIVSA-N	427.274	1.992	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1N1CCOCC1)c1ccc2c(c1)OCCO2	776297305	NGBNCXULEJKOEZ-UHFFFAOYSA-N	428.401	1.277	50	20	IDGD	
COc1cccc([C@H]2[C@@H](C(=O)NNC(=O)Cn3cnc4ccccc43)CC(=O)N2C2CC2)c1	776448731	RZALCOAAFCWORJ-MBSDFSHPSA-N	447.495	1.945	50	20	IDGD	
CC(=O)c1cc(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)c(C)nc1C	777135393	GKBBQWXNXSBXOH-UHFFFAOYSA-N	445.545	1.594	50	20	IDGD	
O=C(NNc1ccc(-n2cccn2)nn1)N[C@@H]1CCN(c2ccc(F)c(Cl)c2)C1=O	777753042	TVBIUCGACXQGQV-CQSZACIVSA-N	430.831	1.886	50	20	IDGD	
COCCc1nnc(-c2cccc(C(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)c2)o1	778530795	JCUFRPUVEPVJLY-UHFFFAOYSA-N	448.439	1.247	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(C(=O)NNC(=O)Cc2nc(-c3ccccc3)cs2)n(C)c1	778565731	WLEDLDAKVOVXOE-UHFFFAOYSA-N	447.542	1.403	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C(=O)Nc2cccc(N3CCCCC3=O)c2)nc2ccccc21	782888680	XXGXAWCAGSYQDX-UHFFFAOYSA-N	448.483	1.419	50	20	IDGD	
N#Cc1cccnc1OC1CCC(NC(=O)NNC(=O)c2nnc(O)c3ccccc23)CC1	783035938	JNRXPIVRDVFXIV-UHFFFAOYSA-N	447.455	1.936	50	20	IDGD	
O=C(NNc1ccc(-n2cccn2)nn1)C(=O)Nc1cccc(NC(=O)c2ccccc2)c1	783433309	NZHWMRHFIODIAF-UHFFFAOYSA-N	442.439	1.996	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)CNC(=O)c2ccco2)cccc1OCC(F)(F)F	784001682	BDSSNADGQDAVNJ-UHFFFAOYSA-N	442.350	1.045	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1ccc(OC2CCCC2)cc1	784004969	MPFMVTRMOVOREK-UHFFFAOYSA-N	430.486	1.585	50	20	IDGD	
CNS(=O)(=O)c1cc(NC(=O)C(=O)NNc2ccc(OC(F)(F)F)cc2)ccc1C	784803893	OZEAIDDSZZVPDN-UHFFFAOYSA-N	446.407	1.884	50	20	IDGD	
CCOC(=O)[C@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNc2ccc(Cl)nc2)cc1	784875507	UZBYJNXYUGRFNA-NSHDSACASA-N	433.852	1.498	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)N[C@@H]3CCCN(Cc4ccc(F)cc4F)C3=O)nc21	786968861	SXUNBIIKQQBJIZ-CQSZACIVSA-N	446.418	1.164	50	20	IDGD	
CC(C)Oc1cc(NC(=O)C(=O)NNC(=O)C(C)(C)c2ccccc2)ccc1C(N)=O	789735189	UMCNXGUSPKPIHD-UHFFFAOYSA-N	426.473	1.636	50	20	IDGD	
O=C(Cc1ccc2c[nH]nc2c1)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	790070634	XGEPZGSCVGGSGZ-UHFFFAOYSA-N	427.486	1.351	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)[C@H]2CCN(CC(F)(F)F)C2)CC1	792186696	LKYJQTKXSUCYCY-LBPRGKRZSA-N	437.463	1.601	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2cccc(NC(=O)N(C)C)c2C)c1	792355924	XGCGEUBESWILQK-UHFFFAOYSA-N	441.488	1.870	50	20	IDGD	
CNS(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@@H](C)Oc2ccc3ccccc3c2)nc1	792392298	ZJFHVULQUIRYLQ-CYBMUJFWSA-N	443.485	1.763	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNC(=O)[C@@H]1CC(c2ccccc2[N+](=O)[O-])=NO1	794070607	BMTKPNREQZJSEU-KRWDZBQOSA-N	441.400	1.162	50	20	IDGD	
Cc1nn(C(C)C)c(C)c1CC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	794179894	FOSSYDUXDQXCLU-UHFFFAOYSA-N	426.565	1.983	50	20	IDGD	
Cn1c(=O)c2c(ncn2CC(=O)NN=Cc2cc(Cl)ccc2OCC2CC2)n(C)c1=O	797402409	ZZIJLBDYWFGDQX-UHFFFAOYSA-N	444.879	1.026	50	20	IDGD	
COC(=O)c1cccc(NC(=O)C(=O)NNC(=O)COc2cccc(C)c2)c1OC(C)C	799257895	VGCAMNFNBOCEQB-UHFFFAOYSA-N	443.456	1.734	50	20	IDGD	
C[C@@H](Sc1ccccc1C(=O)NNC(=O)c1csc(N2CCOCC2)n1)C(N)=O	801104646	VPFMPSZWOSVKFR-LLVKDONJSA-N	435.531	1.020	50	20	IDGD	
Cc1nn(C)c(Br)c1C(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	801183085	WPOYJPLABIIYLZ-UHFFFAOYSA-N	428.674	1.222	50	20	IDGD	
O=C(CN1C(=O)NC2(CCCCC2)C1=O)NNC(=O)Nc1ccc(Br)cc1	801999254	YXHMMUGDSVNWOO-UHFFFAOYSA-N	438.282	1.857	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2c[nH]c3c(F)cc(F)cc3c2=O)cc1	802064269	KTLHSQIWOIJITF-UHFFFAOYSA-N	436.396	1.676	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2nn(-c3ccc(F)cc3)cc2O)cc1	802064429	QARHHRUEMZSEKV-UHFFFAOYSA-N	433.421	1.587	50	20	IDGD	
Cc1cccc(N2CCN(CCCNC(=O)NNc3ccc(-n4ccnc4)nn3)CC2)c1	804958167	MGHHVCJBEKHNAB-UHFFFAOYSA-N	435.536	1.809	50	20	IDGD	
N#Cc1ccncc1C(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	805156186	LDBVZJJGEFZMBS-UHFFFAOYSA-N	435.465	1.507	50	20	IDGD	
C[C@H]1CCc2c(sc3nc(CCC(=O)NNC(=O)N4CCN(C)CC4)nc(O)c23)C1	807382043	VBCZHNQUWMLMMI-LBPRGKRZSA-N	432.550	1.443	50	20	IDGD	
Cc1cc(C(=O)N2CCOCC2)ccc1NC(=O)C(=O)NNc1nccnc1C1CCC1	807462382	XRGJWGMLRIVLAY-UHFFFAOYSA-N	438.488	1.607	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)[C@@H]3C[C@H]3C3CCN(C(=O)OC(C)(C)C)CC3)nc21	810400491	HPQBPDJOSXARGP-QWHCGFSZSA-N	431.497	1.795	50	20	IDGD	
Cc1cc(=O)cc(C)n1CCCC(=O)N1CCN(S(=O)(=O)CBr)CC1	810911709	JILQMPNDTLCKTR-UHFFFAOYSA-N	434.356	1.072	50	20	IDGD	
COc1ccc(S(=O)(=O)NCC(=O)NNc2ccc(C(F)(F)F)cn2)cc1OC	811164606	VFWAXWDHGQXZHB-UHFFFAOYSA-N	434.396	1.539	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCC(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)cc1C	811462019	JUHIWSRGFCPTBN-CQSZACIVSA-N	439.921	1.850	50	20	IDGD	
CC(=NNC(=O)C1=S=C2CC[C@H](C)CC2=C1)c1ccc(S(=O)(=O)CC(N)=O)cc1	814759752	NEGPABKPCKLFEF-LBPRGKRZSA-N	433.555	1.624	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cnn(C)c2I)cc1C	814778847	AQBBOOQTLDOCDB-UHFFFAOYSA-N	441.229	1.041	50	20	IDGD	
CCOc1ccc(NNC(=O)C(=O)Nc2ccc(CC(=O)N3CCOCC3)cc2)cc1	815815641	KZTMCNIZHUBIOL-UHFFFAOYSA-N	426.473	1.568	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)[C@H]2CS[C@H](Cc3ccccc3F)C(=O)N2)cc1C	888438411	YWLYTQNELVYPHF-RTBURBONSA-N	445.516	1.812	50	20	IDGD	
C[C@@H]1CC(C)(C)C[C@@]2(C1)NC(=O)N(CC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)C2=O	912764470	QHCIEWXWVNCWPW-MPBGBICISA-N	431.449	1.493	50	20	IDGD	
C[C@@H](NC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)[C@@H]1C[C@H]2CC[C@H]1C2	915883183	CZOBHRWCGDVSJE-CVYDXHPNSA-N	436.582	1.469	50	20	IDGD	
CC(=NNC(=O)COc1cccc(C)c1)c1ccc(S(=O)(=O)NCCC(=O)O)cc1	915928799	YWFLJGOGWALRNV-UHFFFAOYSA-N	433.486	1.667	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2c(C)nc3ccccn23)ccc1OCC(=O)NC(C)C	916148257	PQFGCDDLQPRRCH-UHFFFAOYSA-N	439.472	1.630	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(CNC(=O)NNC(=O)Cn2nc(C)cc2C)s1	916233415	XAIPGHVEHQTONG-UHFFFAOYSA-N	442.567	1.123	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CNC(=O)c2ccc(Br)s2)cc1OC	916728565	NODWUEPQEDOBQF-UHFFFAOYSA-N	442.291	1.719	50	20	IDGD	
C[C@@H](NC(=O)c1ccc(Br)s1)C(=O)NNC(=O)COc1ccc(F)cc1	917917595	YNJSPNJBACEVQU-SECBINFHSA-N	444.282	1.994	50	20	IDGD	
CCN(CCCNC(=O)NNC(=O)c1ccc(Br)s1)S(C)(=O)=O	918119122	LGOWGDNJYXXUMC-UHFFFAOYSA-N	427.346	1.126	50	20	IDGD	
C[C@@H](Cc1cccc(O)c1)NC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	919784613	UMROIVJWROIAHX-SFHVURJKSA-N	425.533	1.866	50	20	IDGD	
C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)C1	919786587	XIBXYZYVQHUFBX-CRAIPNDOSA-N	430.530	1.870	50	20	IDGD	
O=C(CCc1ncc(-c2ccc(Cl)cc2)o1)NNC(=O)N[C@@H]1CCS(=O)(=O)C1	919889775	TYDSMEVFZJMXJV-CYBMUJFWSA-N	426.882	1.445	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)N[C@H](C)CN1C[C@@H](C)C[C@@H](C)C1	919924740	VJHZJXQAAZEYBE-QLFBSQMISA-N	438.598	1.599	50	20	IDGD	
NC(=O)[C@H]1CCCN1Cc1cccc(NC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1	920932451	LLUXVHYRWQCYMT-APWZRJJASA-N	439.472	1.129	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2cc(C3CC3)nn2[C@@H]2CCS(=O)(=O)C2)cc1	1320425094	UTFGVOQZRGRHRF-CQSZACIVSA-N	433.490	1.595	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2)c1cc2[nH]ccc2s1	1778728745	USDXQQHMDQDVKF-VVFCZOMOSA-N	425.938	1.957	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnn3cc(C)cnc23)C1	1779023194	KJKGBABJICYFCN-CBGDNZLLSA-N	449.939	1.419	50	20	IDGD	
Cc1cccc(C)c1SCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1779285038	DYIKFOVSLPTVFX-OXJNMPFZSA-N	426.966	1.825	50	20	IDGD	
C=C[C@H](O)C(C)(C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)Br)C2	1779339209	GVCCFMMTZOISQX-NXEZDXNNSA-N	431.371	1.857	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Br)C2)[C@@H](F)Br	1780773824	NHMFHXNPEKCDLM-ORXSELOVSA-N	448.102	1.881	50	20	IDGD	
O=C(/C=N/O[C@@H]1CCCCO1)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781331183	GECXQGMWDUYLNH-JXXCDNMZSA-N	436.278	1.036	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc3ccnn13)C2	1782179801	UPUHZFNUCJOCDD-HGHGUNKESA-N	434.924	1.716	50	20	IDGD	
O=C1CSc2ncc(C(=O)N3CC[C@]4(C3)CN(C(=O)[C@H](F)Cl)CCO4)cc2N1	1782425872	UNCKFJATGUDLOV-GUYCJALGSA-N	428.873	1.104	50	20	IDGD	
C[C@H](Oc1ccccc1)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1783321030	KATLOJPJSPDBCY-YEWWUXTCSA-N	429.286	1.974	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)CCc3nnc(C)s3)CCO2)C1	1783344126	NGLQFDBXNGWMIW-GUYCJALGSA-N	445.383	1.783	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ncc(OC)cc3F)CCO2)C1	1783344560	RGIUBECHDNHGLL-UGSOOPFHSA-N	444.301	1.846	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc4ccnn4c3)CCO2)C1	1783351492	BFBIJZFTKCBFKT-APWZRJJASA-N	435.322	1.951	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cnc(OCF)cn3)CCO2)C1	1783533242	YIXNRRKNLVMVLZ-BDJLRTHQSA-N	431.262	1.009	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H]3CC=CC[C@@H]3C(=O)OC)C2)C1	1783847530	BVPLIMIZMYNEHO-IAGYGMIVSA-N	426.941	1.979	50	20	IDGD	
COC(=O)CCCCCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](C)CBr)CCO2	1784044674	XPVXCJDYJNFZAS-BEFAXECRSA-N	447.370	1.971	50	20	IDGD	
CC[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)Br)C[C@@H]21)N(CC)CC	1784632209	JFYICLZTAJZNSM-WOYTXXSLSA-N	432.403	1.870	50	20	IDGD	
O=C(CC[C@@H]1CNc2ccccc2C1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21	1786901185	RQEXIJYKGJZUQB-PAMRQWRISA-N	449.979	1.630	50	20	IDGD	
O=C(Cc1ccncc1)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1	1788150307	CEEHTKLRZLHSRU-UHFFFAOYSA-N	429.285	1.752	50	20	IDGD	
O=C(Cc1ccccn1)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1	1788281525	YAOMEYOBHZHVJG-UHFFFAOYSA-N	429.285	1.752	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3ON=C(c4ccccc4)O3)[C@H]2C1	1788516826	WMZOWWBEWXYJOA-BOSXTWCSSA-N	449.935	1.966	50	20	IDGD	
Cc1nc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]3C2)cs1	1789922360	LBKBWPNRGVGERM-NHULGOKLSA-N	434.331	1.664	50	20	IDGD	
CN[C@@H](CC(=O)NC1(c2ccc(NC(=O)[C@@H](F)Br)cc2)CCC1)C(=O)O	1790534945	XSXSTMPEJKDRFO-GXTWGEPZSA-N	430.274	1.874	50	20	IDGD	
Cc1nccn1CC(=O)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1	1791106486	XQXGJNZUEVZBJQ-UHFFFAOYSA-N	432.289	1.319	50	20	IDGD	
CCOC(=O)N1CCC(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Cl)C[C@@H]32)CC1	1792144151	VPVPAUBWVHULSP-YHUYYLMFSA-N	433.908	1.369	50	20	IDGD	
Cc1cccc2c(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3ccc(B(O)O)cc3)n[nH]c12	1796189429	MSNVSNUVCKCHFR-BCDXTJNWSA-N	432.289	1.117	50	20	IDGD	
Cc1c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)oc2ccccc12	1796190963	JGXAGWBCBRIYNS-REPLKXPHSA-N	432.285	1.987	50	20	IDGD	
CN(C)c1ccc([N+](=O)[O-])c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Cl)c1	1796365907	GAVNVXGIFCPYDE-OXUXUCFPSA-N	428.848	1.398	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](Br)Cc1ccccc1)C2)c1cnoc1	1796527434	HXJZQYRQNFXUKK-XMTFNYHQSA-N	448.317	1.884	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(=O)cco1)C2	1796889975	QXYFEHHWOMCGJL-NGYDUSEUSA-N	425.445	1.026	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COc1cccc(Cl)c1)C2)[C@H](F)Br	1799341901	ACOOSYBARWRKGM-OJXGSEEGSA-N	449.704	1.999	50	20	IDGD	
Cc1c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](O)CCl)C3)cc(Cl)cc1[N+](=O)[O-]	1799765494	KFUDIYZEIUOWRG-OXUXUCFPSA-N	446.287	1.360	50	20	IDGD	
CN(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H]1CCOC1)C2)NC(=O)NCc1ccccc1	1799869080	AZVZXZSHAJPVIZ-HAGHYFMRSA-N	443.548	1.007	50	20	IDGD	
C[C@H](CN)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](Br)Cc1ccccc1	1800436286	URXAXTYAEZVPPX-FWEDZOCSSA-N	438.366	1.177	50	20	IDGD	
C[C@@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc3n(n1)CCCNC3=O)C2	1801962408	IOEFYADITFIBHU-FVCCEPFGSA-N	438.326	1.052	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cc1ccc3c(c1)CCCO3)C2	1802335997	DAQMFIYMUBNTLT-ACDBMABISA-N	442.560	1.565	50	20	IDGD	
Cc1nc(CC(=O)NC[C@@H]2CCN(C(=O)CCBr)[C@@H]2c2cccnc2)no1	1804489347	LTNXKLOXWJXYOH-KBXCAEBGSA-N	436.310	1.807	50	20	IDGD	
O=C(/C=C/c1ccco1)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1804614948	QAAWGODSWHIAEZ-QNDZLASUSA-N	445.284	1.387	50	20	IDGD	
O=C(CCBr)NC[C@H]1CCN(C(=O)CCn2ccnn2)[C@@H]1c1cccnc1	1806346234	CRMPPPLDFSUIHQ-CRAIPNDOSA-N	435.326	1.554	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)c2ccccc2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807360197	IEEJNJYXIHGKNQ-IFMALSPDSA-N	429.285	1.395	50	20	IDGD	
Cc1cnc(C(=O)N2CCCC3(CCN(C(=O)c4cccc(B(O)O)c4)CC3)C2)s1	1807913655	LKUXESBNEYNMRB-UHFFFAOYSA-N	427.335	1.290	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cc(O)n[nH]2)[C@H]1c1cccnc1)[C@H](F)Br	1808662411	ZZDSRWUAGSGFHJ-BPNCWPANSA-N	426.246	1.520	50	20	IDGD	
COC(=O)C1(C(=O)N2CC[C@H](CNC(=O)[C@@H](F)Br)[C@@H]2c2cccnc2)CC1	1808677824	DFTMDLLCBIVUJL-HZSPNIEDSA-N	442.285	1.731	50	20	IDGD	
Cc1noc(C)c1CC(=O)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1	1809975169	WAVITRXULPZWEL-UHFFFAOYSA-N	439.321	1.059	50	20	IDGD	
CCc1noc(C)c1C(=O)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1	1809977542	CZRRXNZVXVTJOH-UHFFFAOYSA-N	439.321	1.384	50	20	IDGD	
COc1ccnc(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)c1OC	1811647173	GIXSXPJLEHZYPG-MPGHIAIKSA-N	448.907	1.413	50	20	IDGD	
O=C1Cc2cccc(C(=O)NC[C@@H]3CCN(C(=O)[C@@H](O)CCl)[C@@H]3c3cccnc3)c2N1	1812207977	LZUYKQMSYPITBG-RIFZZMRRSA-N	442.903	1.496	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)c1cnc2ccc(F)cn12	1812237941	LZGJUTNNWAGKSI-UCLAIMLFSA-N	445.882	1.788	50	20	IDGD	
COc1ccccc1CC(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1	1812762892	JKFYBSHMSCOICQ-BBTUJRGHSA-N	431.920	1.938	50	20	IDGD	
C[C@]1(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)CC=CCC1	1813579539	OFNCUJHVPSMOIV-XTJBDQBJSA-N	447.344	1.827	50	20	IDGD	
Cc1ccc(O)c(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)c1	1817472583	NSMBHTFCZMDHKW-LJQANCHMSA-N	448.288	1.723	50	20	IDGD	
Cc1cc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2ccc(B(O)O)cc2)CC3)cn1C	1817695161	BJDXYHCALGLFIX-INIZCTEOSA-N	438.318	1.009	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](F)Br)[nH]n1	1819354798	ZPERVZHGXRQJOW-IRUJWGPZSA-N	447.309	1.800	50	20	IDGD	
Cc1nc(F)ccc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1	1819987243	QUJABRYQVGZZHR-INIZCTEOSA-N	445.499	1.931	50	20	IDGD	
CCOc1ccc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@H](O)CCl)CC3)nn1	1821750193	QEQLUBFYQDTUMF-BXKDBHETSA-N	425.898	1.157	50	20	IDGD	
COc1ccccc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCC(=O)NN(C)C)CC2	1821927383	CDBBGGBEWSCGGU-CYBMUJFWSA-N	445.545	1.751	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](N)Cc2cccnc2)[nH]n1	1822368919	JPCAKUXRKQNYQE-VYDXJSESSA-N	434.928	1.621	50	20	IDGD	
C[C@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1)C1(O)CCC1	1823733452	WNUPRKXZKBZYFB-DYESRHJHSA-N	442.365	1.151	50	20	IDGD	
O=C(COC(=O)C(F)(F)F)N1CCC([C@H]2CCCCN2C(=O)[C@H](O)CCl)CC1	1824186579	OYSVDHLSMROMDA-CHWSQXEVSA-N	428.835	1.311	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)C(C)(C)CNC(C)=O)CC2	1825993791	FLOIUXBRHRZTLV-VXGBXAGGSA-N	430.958	1.471	50	20	IDGD	
Cc1cc(C)n(CCC(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@@H](O)CCl)CC3)n1	1826573330	IDTKMZWJCQRSFF-OCCSQVGLSA-N	425.942	1.558	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)COc3cccnn3)sc2C1	1826764889	AZCPOMKWGWNSIX-WDEREUQCSA-N	425.898	1.178	50	20	IDGD	
CC(C)O[C@@H](C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1	1828924096	ISSFLIFDDFPRAT-JXFKEZNVSA-N	445.564	1.732	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CC(F)(F)F)CC1	1828925648	OKEGXFNUWAYMCW-MRXNPFEDSA-N	441.454	1.871	50	20	IDGD	
Cc1ncncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1	1829358013	OZEOVTLYKOGMRB-NRFANRHFSA-N	436.321	1.012	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3ccc(C#N)cc3)CCO2)C1	1829634338	LFKGTUJDFLXEQM-UGKGYDQZSA-N	433.936	1.965	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccc(F)cn3)C2)C1	1830357840	LMGGHDNPCJIJIQ-FQEVSTJZSA-N	427.904	1.485	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@](C)(O)C(F)(F)F)C2)C1	1830358160	MMHKEFKOHJCKQJ-HZPDHXFCSA-N	430.851	1.021	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@H]2CCC(=O)NC2)CC1	1831649747	NGABTZQKULAJTE-BPUTZDHNSA-N	428.371	1.916	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(C)n(CC)n3)C2)C1	1831652378	ZKHILXGULRAVKW-OXQOHEQNSA-N	426.945	1.689	50	20	IDGD	
CN1CCC[C@H](C(=O)N2CCC([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)C1	1831873879	DIPXVKRSWRBUJV-PMACEKPBSA-N	435.613	1.321	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)cnc1C	1833301375	DLEBVFBCXCGIPQ-AUUYWEPGSA-N	440.338	1.552	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cc4cccnc4[nH]3)CC2)CC1)[C@H](O)CCl	1833309822	AJXQTGQEKXIMOE-GOSISDBHSA-N	433.940	1.348	50	20	IDGD	
CC(C)N1CCC[C@H]1C(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)CCl)CC2)CC1	1833313042	ROMPACNJYGRBHB-OALUTQOASA-N	429.005	1.031	50	20	IDGD	
COc1cnc(C(=O)NC2CCN(C3CCN(C(=O)[C@H](O)CCl)CC3)CC2)c(F)c1	1834006033	NJBKXBKEEWZJMR-QGZVFWFLSA-N	442.919	1.014	50	20	IDGD	
O=C(/C=C/c1ccoc1)N1CCOC[C@]2(C1)CN(C(=O)CCBr)CCO2	1834818994	GIAOWGSACFJKEB-KROLTMCQSA-N	427.295	1.534	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cn4ccccc4n3)CC2)CC1	1835300826	HUAQDELCFCZPSV-GOSISDBHSA-N	447.967	1.773	50	20	IDGD	
CC/C=C(\C)C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1	1835737348	KXEBDYFXRNTTIQ-AYSLTRBKSA-N	442.564	1.227	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3cc(F)cc(F)c3)CCO2)C1	1836121648	HDVLGUPPBGGCNY-PXNSSMCTSA-N	430.879	1.981	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC1CCN(C2CCN(C(=O)Cn3ccnc3)CC2)CC1	1836398248	DRQVHOWABPMSFY-IBGZPJMESA-N	430.380	1.691	50	20	IDGD	
Cc1cnn(CC(=O)N2CCC(N3CCC(NC(=O)[C@@H](F)Br)CC3)CC2)c1	1836412769	TYYXMTRVQIGFPT-QGZVFWFLSA-N	444.349	1.454	50	20	IDGD	
O=C(CCN1CCCCC1)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836716693	JIILLCDQZIJFGE-LJQANCHMSA-N	429.989	1.461	50	20	IDGD	
CC(C)N[C@H](C(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1)C(C)C	1836716708	KQLLIOLOOPFPTF-MOPGFXCFSA-N	432.005	1.607	50	20	IDGD	
COc1ccsc1C(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836718264	MRACTMKWVZAKQW-HNNXBMFYSA-N	430.954	1.969	50	20	IDGD	
O=C(c1ccc2nn[nH]c2c1)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836718913	IPCHSIDHDYWZIG-SFHVURJKSA-N	435.912	1.170	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3n[nH]c(C)c3F)CC2)CC1	1837330995	HBZYVIFDPODNRT-HNNXBMFYSA-N	430.908	1.723	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)/C=N/O[C@H]3CCCCO3)CCO2)C1	1837525409	NWUZCSBHBBGPDH-ZQUFOJLJSA-N	445.944	1.237	50	20	IDGD	
Cc1onc(C(=O)N2CCOC[C@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)c1C	1837710225	PHUYTOBPABMKGQ-IBGZPJMESA-N	425.558	1.213	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)cc1	1838967855	ZOGGKFFDIONFHW-AUUYWEPGSA-N	441.322	1.549	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)n3cccc3C=O)C2)C1	1839143718	GMSQJNWNIRXWIC-KNBMTAEXSA-N	425.913	1.335	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C#CC3(O)CCCCC3)C2)C1	1839146341	XESTVVYVWYDLFF-LAUBAEHRSA-N	426.941	1.159	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3c(C)nn(C)c3C)C2)C1	1839148780	JOKQMVIGYMRFGD-YLJYHZDGSA-N	426.945	1.053	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C1(Br)CC1)CCO2	1839205368	FZHUEFIWPVSDSX-XJKSGUPXSA-N	437.762	1.778	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1[C@H]3C=CS[C@@H]31)CCO2	1839700279	KSCOLGAXRAQONM-JSEZXORMSA-N	445.379	1.491	50	20	IDGD	
O=C(C(Cl)Cl)N1CCO[C@]2(COCCN(C(=O)[C@@H]3Cc4ccccc4N3)C2)C1	1840189636	CZXUQRBRVWAMJW-KXBFYZLASA-N	428.316	1.283	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)/C=C\c1c[nH]c3ccccc13)C2	1844263589	TYJBVTLJSNDAGW-SREVYHEPSA-N	444.495	1.697	50	20	IDGD	
C[C@H](C#N)c1cccc(C(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)c1	1844265497	JJRWBJZYMGEQPP-OAHLLOKOSA-N	432.484	1.443	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC2(CCCN2C(=O)c2ccccc2C(=O)OCCO)C1	1844719668	PVIYMZOUUZVLSO-LJQANCHMSA-N	443.327	1.889	50	20	IDGD	
CCC(=O)N[C@H](C)C(=O)N1CC2(CCCN2C(=O)/C(C#N)=C/c2ccc(F)cc2F)C1	1845870304	ACGZMZGTNHSWGR-BRYYZUPOSA-N	430.455	1.990	50	20	IDGD	
O=C(c1cnc(O)[nH]1)N1CC2(CCCN2C(=O)[C@H](Br)Cc2ccccc2)C1	1845941755	QWGOBZIMKMXSHI-CQSZACIVSA-N	433.306	1.939	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCCC12CN(C(=O)c1cc(=O)nc3sccn13)C2	1846071446	SWMVBZSFHIPFLC-LLVKDONJSA-N	439.335	1.747	50	20	IDGD	
CC(C)[C@H](CC(=O)N1CCCC12CN(C(=O)[C@H](O)CCl)C2)NC(=O)OC(C)(C)C	1846293203	AHFJRVBWYXJMSG-LSDHHAIUSA-N	431.961	1.729	50	20	IDGD	
COc1cc(C(=O)N2CCCC23CN(C(=O)CCC(=O)NN(C)C)C3)cc(OC)c1C	1846871727	OIJFOWGXGMEHBQ-UHFFFAOYSA-N	432.521	1.202	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NCc1ccccc1CN1CCOCC1	9872420	PBMQIHKCYHQGRT-MRXNPFEDSA-N	430.480	1.956	50	20	IDGD	
COc1cc(CCC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc(OC)c1	15429613	YJPDLKVDNNYPEV-UHFFFAOYSA-N	435.502	1.348	50	20	IDGD	
COc1ccc(N2C[C@H](C(=O)NNC(=O)COc3cc(C)ccc3C)CC2=O)c(OC)c1	17202882	FWTNLJPHUIUPKW-MRXNPFEDSA-N	441.484	1.900	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2ccc(N3C[C@H](C)O[C@@H](C)C3)nc2)cc(OC)c1OC	30018304	JHFYGMCUPSMCTD-KBPBESRZSA-N	444.488	1.796	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)CNc2ccc(C#N)cc2)c1	109154102	LADKZPGGJVEFQI-UHFFFAOYSA-N	429.502	1.462	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)c2ccc3c(c2)[nH]c(=O)c(=O)n3CC)o1	109420732	FFUYYHKDDVJFIK-UHFFFAOYSA-N	427.461	1.219	50	20	IDGD	
Cc1nn(-c2ccccc2)cc1CCCNC(=O)NNC(=O)CNC(=O)c1cccs1	725872628	FLHWQGPJLAGYCG-UHFFFAOYSA-N	440.529	1.935	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)NCCCN2CCC[C@@H]2C(=O)N(C)C)c1	726277367	MOTUZDYDFIEZAL-LJQANCHMSA-N	447.580	1.770	50	20	IDGD	
N#C/C(=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)NCCn1cncn1	726535921	ISKVCHVRCMPLHY-DHDCSXOGSA-N	438.879	1.394	50	20	IDGD	
CN1C(=C(C#N)C(=O)COC(=O)Cc2ccc(S(N)(=O)=O)cc2)N(C)c2ccccc21	728369645	RFPOPUACBIQOOB-UHFFFAOYSA-N	440.481	1.310	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)[C@H]2CCCCN2S(C)(=O)=O)c1	728529969	WUOLDCAOXKFXPS-CYBMUJFWSA-N	434.312	1.033	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1Br	728847435	FHSFUKPCKGRPGD-UHFFFAOYSA-N	434.294	1.925	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H]2CCCN(C(=O)c3ccccc3)C2)c1	731165636	AFHZWACUQVJNHX-KRWDZBQOSA-N	429.498	1.404	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)c2ccccc2CS(=O)(=O)c2ccccc2)n1	731186653	YFNUOCMGNPLLME-UHFFFAOYSA-N	426.498	1.935	50	20	IDGD	
O=C(NNc1nc(-c2cccnc2)no1)c1ccc(F)c(S(=O)(=O)N2CCCC2)c1	732110937	UFPJRFMSHNSPPS-UHFFFAOYSA-N	432.437	1.812	50	20	IDGD	
CNc1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc(Cl)n1	732258971	WZCWBHDRBLLKEG-UHFFFAOYSA-N	437.909	1.636	50	20	IDGD	
C[C@H]1CN(Cc2ccc(C(=O)NNC(=O)CCN3C[C@@H](C)O[C@H](C)C3)cc2)C[C@H](C)O1	732262636	VBAAAIOQYTYJQG-YRXWBPOGSA-N	432.565	1.556	50	20	IDGD	
Cn1c(NNC(=O)c2sccc2S(=O)(=O)N2CCCC2)nc2ccccc2c1=O	733262363	SLKQHDMYEUOPNM-UHFFFAOYSA-N	433.515	1.536	50	20	IDGD	
NC(=O)[C@H]1CCCN1Cc1cccc(NC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c1	733332677	LGDHOGAEJXCLMD-HXUWFJFHSA-N	447.499	1.789	50	20	IDGD	
CN(C)CC(=O)NNC(=O)c1ccc(Br)cc1I	733359704	OCKDEROHTQZBRG-UHFFFAOYSA-N	426.052	1.376	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(\C#N)C(=O)NS(=O)(=O)CCCC(=O)OC)c1C	734087820	CLIQCFXVCXWNLR-FBJMNJBLSA-N	425.507	1.619	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NCCOC[C@@H]2CCCO2)c2ccccc2c1=O	734677501	VXUMVRCKYTVDHU-HNNXBMFYSA-N	431.493	1.336	50	20	IDGD	
COc1ccc(CN2CC[C@H](NC(=O)NNC(=O)COc3ccc(OC)cc3)C2=O)cc1	734682839	CTAKTFRFQMPIPB-IBGZPJMESA-N	442.472	1.214	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2ccc(NNC(=O)c3cnc[nH]3)c([N+](=O)[O-])c2)cc1	736545659	YNKUOPNLBLDXQU-UHFFFAOYSA-N	432.418	1.884	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNC(=O)CCN2C(=O)[C@@H]3[C@H]4CC[C@@H](O4)[C@@H]3C2=O)cc1	742473860	OUGZKYDOYSYXOB-LFGUQSLTSA-N	443.500	1.425	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@@H](C)C(=O)NNC(=O)CN1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O	742477025	CJRGWMCQLVEEBC-WEBKGQRMSA-N	449.891	1.034	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)CCCOc3cccnc3)cc2)CC1	743334324	HSJVOJSDQRXZSW-UHFFFAOYSA-N	433.534	1.320	50	20	IDGD	
CCO[C@@H](C)c1noc(CN2CCN(C(=O)NNC(=O)c3cccc(C#N)c3)CC2)n1	743589269	HESLXSRETBSLOS-AWEZNQCLSA-N	427.465	1.211	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)CN2CCN(c3ncc(Cl)cc3Cl)CC2)cc1	744387926	ZJYOTOMUGCAROU-UHFFFAOYSA-N	433.299	1.843	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@@H](C)CCc2cccn2C)cc1	745874875	GNYVVODKLVCPKB-INIZCTEOSA-N	435.550	1.306	50	20	IDGD	
C[C@@]1(NNC(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2=O)CCS(=O)(=O)C1	745875095	KXNIMDKDFJXMHF-KBXCAEBGSA-N	446.476	1.164	50	20	IDGD	
Cc1nnc(-c2ccc(C(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)cc2)o1	746093478	HFTOBQIRLWVFPX-UHFFFAOYSA-N	429.458	1.370	50	20	IDGD	
COc1cc(C)nc(NNC(=O)[C@H](CC(C)C)/N=C2/NS(=O)(=O)c3ccccc32)n1	746623262	IYWUEXWHNGJPCA-AWEZNQCLSA-N	432.506	1.390	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@H]2C(=O)NNC(=O)Cc2ccncc2)cc1	747318646	BYJVEYXMXXMHLY-IBGZPJMESA-N	444.513	1.218	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)CN1C(=O)CCOc2ccccc21	747473474	FVAYLLFIXNPJMV-UHFFFAOYSA-N	448.273	1.791	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@](F)(C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)C1	748210923	STZGZJPULRMPNC-FQEVSTJZSA-N	434.424	1.212	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCCC(=O)N1CCCCCC1	748343054	GCNWSBRNPOJJHS-UHFFFAOYSA-N	438.554	1.025	50	20	IDGD	
N#CCCCS(=O)(=O)c1ccc(C(=O)OCC(=O)NNC(=O)c2ccccc2)cc1	748408428	ADEYMMQBVZKSRY-UHFFFAOYSA-N	429.454	1.382	50	20	IDGD	
Cc1nn(C)c(C)c1S(=O)(=O)N[C@H](C)C(=O)NNc1ccc(OCC(F)(F)F)cc1	748693571	CJXVFQPPCCMZBZ-LLVKDONJSA-N	449.455	1.788	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cccc(Cl)c2[N+](=O)[O-])c1	749865356	JTGJIRUAARVUEM-UHFFFAOYSA-N	426.838	1.573	50	20	IDGD	
O=C(NCc1cccc(COCC(F)(F)F)c1)NNC(=O)C(=O)Nc1ccccn1	750440486	ARSUUYHDNKUYLH-UHFFFAOYSA-N	425.367	1.630	50	20	IDGD	
O=C(Cc1ccc(OCc2ccccn2)cc1)NNC(=O)c1ccc(-n2cnnn2)cc1	751556561	OMCGHWZTPAAARQ-UHFFFAOYSA-N	429.440	1.640	50	20	IDGD	
O=C(NNC(=O)N1CCO[C@H](CCc2ccccc2)C1)c1csc(N2CCOCC2)n1	754135270	QRGJJBDQUAYJEP-QGZVFWFLSA-N	445.545	1.668	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1ncc(Cc2ccc(F)c(F)c2)s1	755479915	RQORRJPOTXKWOE-QMMMGPOBSA-N	433.462	1.103	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1cccc(NC(=O)NNC(=O)c2ccc3c(c2)OCO3)c1	755516248	RBLBAACXQNQPOZ-UHFFFAOYSA-N	434.474	1.959	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1ccc(N(C)C2CCCCC2)c(F)c1	755940638	ALILAHQSWKZKSY-LBPRGKRZSA-N	429.518	1.685	50	20	IDGD	
CN1CCCCC/C1=N/S(=O)(=O)c1ccc(NC(=O)NNC(=O)c2cnccn2)cc1	756113774	KOUQGYCLXLGLHQ-UQQQWYQISA-N	445.505	1.536	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc1	756565823	YZJGUGMEXZEUEN-UHFFFAOYSA-N	444.473	1.806	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Cc2c[nH]c3ncccc23)c1	756901596	OJJVNEWDMUAAGN-UHFFFAOYSA-N	429.502	1.597	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1C(=O)N(C)C	757592761	WNQNBFCQDWYWSC-UHFFFAOYSA-N	425.493	1.556	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)c2cc(Br)nn2C)cc1C	758808676	TYPNRIXIYAYILP-UHFFFAOYSA-N	429.296	1.733	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H](C(=O)NNC(=O)C(=O)Nc2ccccn2)C[C@@H]2CCCC[C@H]21	758830394	KHRCBKRLGKWJBQ-ZNMIVQPWSA-N	431.493	1.736	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@H](C(=O)NNC(=O)C(=O)Nc1ccccn1)c1ccccc1	758837435	BPHDQXXXGLWZLN-HNNXBMFYSA-N	427.461	1.476	50	20	IDGD	
NC(=O)[C@@H](Cc1ccc(Cl)cc1)NNC(=O)CCN1CCN(c2ccccc2)CC1	760576667	KHLMGVNAFCXBJW-HXUWFJFHSA-N	429.952	1.570	50	20	IDGD	
CCOc1ccc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)c3cncnc3)cc2)cc1	760798148	FFYHLCMYPBYZTK-UHFFFAOYSA-N	441.469	1.751	50	20	IDGD	
CC(=NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1)c1cnc(C)s1	761266188	FCTXSWIAHHEUEJ-UHFFFAOYSA-N	435.575	1.607	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)N[C@@H]1C[C@H](C)N(c2cnn(C)c2)C1=O	761722602	ZEVRJZCNGYERQH-GXTWGEPZSA-N	432.506	1.045	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)N[C@H](C)c2cn(-c3ccccc3)nn2)nc1	761785840	IFRBHOMFKJMPGM-CQSZACIVSA-N	444.521	1.736	50	20	IDGD	
COC(=O)Nc1cc(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc(C(F)(F)F)c1	763149478	KWLAJYXKXHWEGH-UHFFFAOYSA-N	449.349	1.934	50	20	IDGD	
CN(C)C(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)ccc1Cl	763466195	HSWTVUMRAKCHHG-UHFFFAOYSA-N	433.808	1.350	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cccnc2)n(-c2cccc(Br)c2)n1	763490831	BOWOSLUAELKVML-UHFFFAOYSA-N	443.261	1.738	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)Nc1ccc(OCC(F)(F)F)cc1	763573684	UFLRJFVNGOHCJK-OAHLLOKOSA-N	439.346	1.554	50	20	IDGD	
COC(=O)[C@H](C)Cc1ccc(NC(=O)C(=O)NNC(=O)COc2cc(C)ccc2C)cc1	763668933	SXCCMKHFZNVOHB-MRXNPFEDSA-N	441.484	1.820	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2nc(-c3cccc(C#N)c3)cs2)cc1	763674686	PDIIWRKJHWKGNS-UHFFFAOYSA-N	446.448	1.718	50	20	IDGD	
CCOc1cc(NC(=O)C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)ccc1C	763718911	SBZSFNJPLQJVJS-UHFFFAOYSA-N	448.501	1.044	50	20	IDGD	
O=C(NNC(=O)c1cccc(Cl)c1)C(=O)Nc1ccccc1C(=O)N1CCOCC1	763750916	SMLYGTCCJFSNBA-UHFFFAOYSA-N	430.848	1.212	50	20	IDGD	
CS(=O)(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCC3)c1	763783507	PNVMCECQICQAEU-UHFFFAOYSA-N	441.918	1.693	50	20	IDGD	
CS(=O)(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCC3)cc1F	763785191	LWXMFBOCDBQLKU-UHFFFAOYSA-N	439.490	1.320	50	20	IDGD	
COc1ccc(F)cc1NC(=O)C(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12	763790714	NLOCQLZZGWKCLD-UHFFFAOYSA-N	441.419	1.525	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccccc2C(=O)NC(C)(C)C)cc1	763813229	ZVVJYQHFANHNMG-UHFFFAOYSA-N	426.473	1.688	50	20	IDGD	
CN(CC(C)(C)C)C(=O)c1cccc(C(=O)NNC(=O)CNC(=O)c2cccnc2)c1	763818701	NRYLALBODLCLRT-UHFFFAOYSA-N	425.489	1.391	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)C(=O)Nc1cccc(C#Cc2ccccn2)c1	763842119	BVCOPTBBWUNZJH-UHFFFAOYSA-N	432.411	1.785	50	20	IDGD	
COC(=O)c1cc(Cl)ccc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccccc1F	763858431	RZWWBGZRCPCKFR-JTQLQIEISA-N	437.811	1.819	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)Cc3ccc(F)cc3)cn2)C[C@H](C)O1	763919625	WIOWLOZWEYLVGV-KBPBESRZSA-N	429.452	1.163	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(F)cc2OCC#N)ccc1OC(C)C	763922225	UHSNBHMAETZCAG-UHFFFAOYSA-N	444.419	1.924	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)nn1[C@H](C)C1CC1	763943978	IPYJSAPAXHWSSU-CYBMUJFWSA-N	437.460	1.454	50	20	IDGD	
O=C(NNC(=O)c1cc(Cl)ccc1O)C(=O)Nc1ccc(CN2CCCC2=O)cc1	763974184	MZDVHMDNVFFMKI-UHFFFAOYSA-N	430.848	1.568	50	20	IDGD	
Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NNC(=O)C1=S=C(c2ccc(F)cc2)C=C1	763975403	HSWXLKFBPOWFDV-UHFFFAOYSA-N	442.428	1.824	50	20	IDGD	
Cc1ccnc(-c2cccc(NC(=O)C(=O)NNC(=O)c3cc(Br)c[nH]3)c2)n1	763998603	QPWALRMQADDSCB-UHFFFAOYSA-N	443.261	1.942	50	20	IDGD	
COCCOc1cc(C)ccc1NC(=O)C(=O)NNC(=O)c1ccc2c(c1)OCCO2	764003701	LHIXIRYHBKDZMT-UHFFFAOYSA-N	429.429	1.191	50	20	IDGD	
COCCOc1ncccc1NC(=O)C(=O)NNC(=O)c1cccc(Br)c1	764058987	MDDCDBQGENVASI-UHFFFAOYSA-N	437.250	1.269	50	20	IDGD	
CCCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccccc2OC)cc1	764133687	YYPXXRDYHXLGQR-UHFFFAOYSA-N	448.501	1.176	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)NC)c(Cl)c2)o1	764138888	LSJXHLGBTGCCJK-UHFFFAOYSA-N	449.895	1.534	50	20	IDGD	
CC(C)CCC(=O)NNC(=O)C(=O)Nc1ccc2c(ccn2CCN2CCOCC2)c1	764199154	NMVWSLVYOYAAKD-UHFFFAOYSA-N	429.521	1.496	50	20	IDGD	
COc1ccc2cc(NC(=O)C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)ccc2n1	764204518	XCJSQFDHJAIMJN-UHFFFAOYSA-N	445.476	1.634	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1ccc(F)cc1Br	764275766	UEMPUFDQLIXIOJ-UHFFFAOYSA-N	426.198	1.459	50	20	IDGD	
COc1cc(F)c(NC(=O)C(=O)NNC(=O)c2cc(Br)ccc2O)cc1F	764276490	DYNIMNRCXZJAQB-UHFFFAOYSA-N	444.188	1.841	50	20	IDGD	
CCN(CC)C(=O)c1ccccc1NC(=O)C(=O)NNC(=O)CCc1ccccc1O	764279227	ZHXFTXFTBFZJNN-UHFFFAOYSA-N	426.473	1.593	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3cc4ccccc4o3)cn2)C[C@@H](C)O1	764331645	YZYCCDWZSCSUAT-OKILXGFUSA-N	437.456	1.841	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)c1cccc(CN2CCS(=O)(=O)CC2)c1	765248542	FBRYMJPMWBCXOS-UHFFFAOYSA-N	449.554	1.176	50	20	IDGD	
CON(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)CSc2ccccc2O)cc1	765251026	WAGRFSVKVACFAB-UHFFFAOYSA-N	425.488	1.127	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1ccc(-n2cccc2)nc1	765733020	LNIGPDSDEGAOEA-UHFFFAOYSA-N	432.484	1.091	50	20	IDGD	
Cc1ccc(F)c(C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)c1F	767149945	FQUPIADNYJRVEW-UHFFFAOYSA-N	425.461	1.361	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CC(NS(=O)(=O)c3ccc(CCCl)cc3)C2)cc1	767298060	WQLXTISZSLEJJI-UHFFFAOYSA-N	444.962	1.828	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@H]2COc3cc(OC)ccc3C2)c2ccccc2c1=O	768108242	WLGKNUNDLGVQLH-CQSZACIVSA-N	437.456	1.373	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](OCC(=O)NNC(=O)COc2ccc(C#N)cc2)C1	769043510	ZRFOOURZSOZDQC-QGZVFWFLSA-N	432.477	1.501	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)Cc2ccccc2NC(C)=O)cc1OC	769465924	XMSLKYPGLPJZRQ-UHFFFAOYSA-N	429.429	1.209	50	20	IDGD	
CSCCNC(=S)NNC(=O)c1cn(C2CCN(C(=O)OC(C)(C)C)CC2)nn1	769769553	NNQLREOCGAIWQA-UHFFFAOYSA-N	443.599	1.322	50	20	IDGD	
CC(=O)N[C@@H](CC(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)c1ccccc1	770279937	IVOULZZUFDTEFH-KRWDZBQOSA-N	428.401	1.167	50	20	IDGD	
Cn1ccnc1[C@](O)(CC(=O)NNc1nc(O)c2cnn(C(C)(C)C)c2n1)C(F)(F)F	770958050	GWLGGCWXGJGKKI-MRXNPFEDSA-N	442.402	1.304	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)c1ccc2c(c1)C(=O)N(Cc1ccco1)C2=O	771854733	FDTFGWLKXOLCBD-ZDUSSCGKSA-N	441.440	1.815	50	20	IDGD	
COc1ccc([C@H](OC)[C@H](C)NC(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1	771904482	KNTXDHPKXZAWGW-SUMWQHHRSA-N	449.533	1.709	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@@H]2[C@H]3CCc4ccccc4[C@@H]32)cc1	772630384	OZELCJZTDZCBBC-SESVDKBCSA-N	442.541	1.674	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNS(=O)(=O)c1cc2c3c(c1)CC(=O)N3CCC2	773250450	DHVIBQBUWKMOTM-GFCCVEGCSA-N	449.916	1.952	50	20	IDGD	
O=C1C[C@H](Cc2ccc(NC(=O)C(=O)NNc3ccc(C(F)(F)F)cn3)cc2)C(=O)N1	773676911	XRXWKGMBJYOHCY-NSHDSACASA-N	435.362	1.387	50	20	IDGD	
Nc1nc(Cl)cc(NNC(=O)c2sccc2S(=O)(=O)N2CCSCC2)n1	773861147	NFHFNGNYIKRTFP-UHFFFAOYSA-N	434.956	1.268	50	20	IDGD	
CC(C)C[C@@H](/N=C1/NS(=O)(=O)c2ccccc21)C(=O)NNc1cc(Cl)nc(N)n1	773862945	ZKWGNHBOORECNS-LLVKDONJSA-N	437.913	1.309	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)cc1F	774010024	UKKXCGPFXGMVDV-JTQLQIEISA-N	437.811	1.819	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)NC[C@H]1COC2(CCCC2)O1	774309187	NPSKOEFIXXBBAX-IBGZPJMESA-N	431.537	1.215	50	20	IDGD	
COc1cccc(NNC(=O)Nc2ccc(N3CCOCC3)cc2N2CCOCC2)n1	780458377	GAKONSOCSBDCJR-UHFFFAOYSA-N	428.493	1.912	50	20	IDGD	
COc1ccc(C[C@H](C)C(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)cc1OC	781357475	PQCSMIUPURHCEB-ZDUSSCGKSA-N	433.892	2.000	50	20	IDGD	
Cc1ccc(CNC(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)c(N2CCCC2)n1	781385441	AGQFKPXPFMQQIT-UHFFFAOYSA-N	447.565	1.898	50	20	IDGD	
CC(=O)N1CCN(c2cccc(NC(=O)C(=O)NNC(=O)CCc3ccccc3)c2)CC1	782117087	JPFFBPVVQDXECX-UHFFFAOYSA-N	437.500	1.074	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cnn(C)c2C(F)(F)F)cc1	782121379	WQVJHXFXMWWBOE-SNVBAGLBSA-N	441.366	1.195	50	20	IDGD	
CCNS(=O)(=O)c1ccc2c(c1)N(C(=O)C(=O)NNc1nccc3sccc13)CC2	783435352	DVBBKHIIPWHMOF-UHFFFAOYSA-N	445.526	1.627	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)C(=O)Nc1cccc2cccnc12	784210097	CFOLOSUJNKKZSI-UHFFFAOYSA-N	425.470	1.757	50	20	IDGD	
CC(=O)c1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)cc1C	784212473	ARVBQERDZCKECE-UHFFFAOYSA-N	430.486	1.720	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)[C@@H]2CC=CC[C@H]2C(=O)N2CCOCC2)cc1	784294870	TYIBPFYUKWZTOX-NSISKUIASA-N	445.516	1.441	50	20	IDGD	
Cc1c(NNC(=O)C(=O)Nc2cc(S(=O)(=O)N(C)C)ccc2F)cccc1[N+](=O)[O-]	784353129	COIMSFGAWMRXPJ-UHFFFAOYSA-N	439.425	1.374	50	20	IDGD	
C[C@H](OC(=O)/C(C#N)=C\C1CC1)C(=O)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1	786680076	GNBPOICCTDHYCH-QXPQOBGOSA-N	433.486	1.438	50	20	IDGD	
CCNC(=O)Nc1ccc(C)c(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)c1	787544519	SDBKXZGHZFUNQD-CYBMUJFWSA-N	445.451	1.829	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNc2ccc(Br)nc2)cccc1N1CCNC1=O	787562222	OFJHBLWJNFXETI-UHFFFAOYSA-N	433.266	1.764	50	20	IDGD	
CC1(c2cc(NC(=O)C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)no2)CCCC1	789735147	LHRNSKKDKGBLGK-UHFFFAOYSA-N	441.492	1.299	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cnc(C(F)(F)F)cc1OC	792269294	WIGRKELKJPPGCP-UHFFFAOYSA-N	440.378	1.836	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)cc(-n2cccn2)c1	792355558	SNDCEJBKTFAAPM-UHFFFAOYSA-N	429.820	1.640	50	20	IDGD	
COCCN1C(=O)CCc2cc(NC(=O)C(=O)NNc3ccc4c(=O)[nH]ccc4c3)ccc21	793065494	NLVQOAAFORTGAI-UHFFFAOYSA-N	449.467	1.536	50	20	IDGD	
CC(=O)NC1(c2noc(CCC(=O)NNC(=O)c3cccc(C)n3)n2)CCCCCC1	794081029	YVBCWYJVOGJJMU-UHFFFAOYSA-N	428.493	1.852	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)Nc2ccc(C(=O)OC)nn2)c2ccccc2c1=O	799231828	UEOPIKXYVDFGDZ-UHFFFAOYSA-N	439.432	1.240	50	20	IDGD	
COC(=O)c1cccc(NC(=O)C(=O)NNC(=O)COc2ccccc2O)c1OC(C)C	799259456	YCPIVWZGIXGVKJ-UHFFFAOYSA-N	445.428	1.131	50	20	IDGD	
O=C(CSc1nnc2c(=O)[nH]c3ccccc3n12)NNC(=O)c1cccc(Cl)c1	799825841	AWSLCXXTEYXVPY-UHFFFAOYSA-N	428.861	1.778	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CCC[C@H]1C(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	802067683	KABIPEXKVBMGBM-HUUCEWRRSA-N	440.522	1.936	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)N1CC[C@@]2(CCN(Cc3ccccc3)C2)C1	805043910	XKGXCVDLFMFUPJ-JOCHJYFZSA-N	425.489	1.348	50	20	IDGD	
O=C(COCc1ccccn1)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	805155357	ZOERQUQCRRWKJK-UHFFFAOYSA-N	432.502	1.234	50	20	IDGD	
N#CCCn1cc(/C=C(/C#N)C(=O)OCCn2cc(C(N)=O)nn2)c(-c2ccccc2)n1	805943404	XDGQKQIHKCQRCO-WJDWOHSUSA-N	430.428	1.305	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N=c1ccnc2n(C)[nH]cc1-2	806484038	ZZDWXIUQVJDLLS-JTQLQIEISA-N	433.266	1.725	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)Nc1ccc(F)c(N2CCCNC2=O)c1	806803990	COAHXRKFSGMLIV-UHFFFAOYSA-N	439.407	1.861	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(C#N)c(Br)c2)cc1	806974287	CUNMCSCPMQHEJM-UHFFFAOYSA-N	431.246	1.794	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2c(C)c(C(F)(F)F)nn2C)c1C	806975046	LLVUUBANQDCPHJ-GFCCVEGCSA-N	441.410	1.918	50	20	IDGD	
O=C(NNc1nccnc1C1CCC1)C(=O)Nc1ccc2nc(N3CCOCC3)oc2c1	807461599	LDIWVTPBPUBTMG-UHFFFAOYSA-N	437.460	1.804	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)Nc2ccc(C(N)=O)cc2OCC(F)F)cc1	810302524	SYADITULPMDLHD-UHFFFAOYSA-N	433.371	1.533	50	20	IDGD	
O=C(COC(=O)c1ccc2c(c1)SCC(=O)N2)NNC(=O)c1ccc([N+](=O)[O-])cc1	811297494	LRDJKHJCUYWLFN-UHFFFAOYSA-N	430.398	1.257	50	20	IDGD	
O=C(CNS(=O)(=O)c1cccc(Br)c1)NNc1nccnc1C1CCC1	811527437	OGMHFEYVIWLFPT-UHFFFAOYSA-N	440.323	1.928	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NN=Cc1cn(-c2ccccc2Br)nn1	811644698	GPBGAPLBZXAHLP-UHFFFAOYSA-N	428.250	1.305	50	20	IDGD	
CC[C@]1(CNC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)OCCc2ccccc21	811926101	LYPIZBWSHGUSHQ-OAQYLSRUSA-N	431.514	1.912	50	20	IDGD	
COc1ccc([C@H](O)C2CCN(C(=O)NNC(=O)CNC(=O)c3cccs3)CC2)cc1	812882670	UIAFPKIWHLKMMR-IBGZPJMESA-N	446.529	1.673	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@H](NC(=O)OC(C)(C)C)C(C)C)c2ccccc2c1=O	814216002	YLQWKRWTJWRYQC-OAHLLOKOSA-N	431.493	1.727	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCc2nncn2C1)C(=O)Nc1ccccc1N1CCCCCC1	815693110	MGDKOFSTIHCVRN-HNNXBMFYSA-N	425.493	1.007	50	20	IDGD	
O=C(NNc1cccc(Cl)n1)C(=O)Nc1ccc(S(=O)(=O)C[C@@H]2CCCO2)cc1	815726870	YBFXJSATGMPIGW-ZDUSSCGKSA-N	438.893	1.770	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C[C@](O)(c2nccn2C)C(F)(F)F)cc1	818649176	LPWFCRQSQQRTPU-XIKOKIGWSA-N	444.410	1.574	50	20	IDGD	
Cn1c(=NNC(=O)c2cc(S(N)(=O)=O)ccc2Br)sc2ccccc21	848949223	YFVSGKVNYIYWBE-UHFFFAOYSA-N	441.332	1.895	50	20	IDGD	
O=C(c1cc(S(=O)(=O)N2CCCCC2)ccc1N1CCCCC1)N1CC[C@@H](B(O)O)C1	864233439	JRPCFMACLCMIDK-QGZVFWFLSA-N	449.382	1.540	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2cnc3c(c2)c(O)nc(=O)n3C)c(C)n1-c1ccccc1	886980561	ZRZGWOKKHNIFDZ-UHFFFAOYSA-N	432.440	1.516	50	20	IDGD	
CNS(=O)(=O)c1cccc(CNC(=O)NNC(=O)c2cc3c(s2)CC[C@@H](C)C3)c1	915259069	CPIARNABHLJZPS-GFCCVEGCSA-N	436.559	1.925	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc2ccccc2c1)NNC(=O)Cc1c[nH]c2ccccc12	915787742	YJNSZCORFWNLTN-UHFFFAOYSA-N	436.493	1.990	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)CS(=O)(=O)Cc2ccc(C#N)cc2)cc1	915813992	WZMNEPVFTIAXPY-OAHLLOKOSA-N	445.497	1.487	50	20	IDGD	
CCn1c(NNC(=O)CS(=O)(=O)Cc2ccc(C#N)cc2)nc2ccccc2c1=O	916156932	AJUJZNLQQLRSRI-UHFFFAOYSA-N	425.470	1.346	50	20	IDGD	
COc1ccc(C)cc1CCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	916194739	BTNGTJQXCBRFRJ-UHFFFAOYSA-N	434.518	1.441	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCCNc2ccc(C#N)cn2)nc1	916520311	GHSATVAQSIYUTN-UHFFFAOYSA-N	432.510	1.117	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)NCCc1cn2c(n1)CCCC2	916578533	NKKLKSYILALCAU-UHFFFAOYSA-N	439.564	1.305	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NC[C@@H]2CCN(C3CC3)C2)c2ccccc2c1=O	916580291	ZBTBQMOVKZSJDW-HNNXBMFYSA-N	426.521	1.625	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)NCc1ccc(N2CCOCC2)c(F)c1	918217466	DTNWSIIAJMELEQ-UHFFFAOYSA-N	426.452	1.763	50	20	IDGD	
CN(C)N(C(=O)[C@@H]1CCCN(C(=O)CCOc2ccccc2)C1)[C@H]1CCS(=O)(=O)C1	918557327	WUAKSQDVFCKKDD-MSOLQXFVSA-N	437.562	1.186	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)NCCN2C(=O)c3ccccc3C2=O)cc1OC	919788977	ZOJYBPJGMKKDSW-UHFFFAOYSA-N	440.456	1.724	50	20	IDGD	
Cc1nn(Cc2ccccc2)c2sc(C(=O)NNC(=O)N[C@H]3CCS(=O)(=O)C3)cc12	919884939	LTJJTOVLSOJZJJ-AWEZNQCLSA-N	447.542	1.586	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)CNC(=O)c2cc(F)cc(F)c2)c2ccccc2c1=O	919961991	CZLXGDYCXDFFSM-UHFFFAOYSA-N	443.410	1.276	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)N[C@@H](CC(=O)N(C)C)c2ccccc2)cc1C	920046013	GLIOIWFFMKJBHF-SFHVURJKSA-N	425.489	1.792	50	20	IDGD	
CC/C=C(\C)C(=O)N1CSC[C@@H]1C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C	1251873827	FWRZXHBRNLRHFG-BWODNOAJSA-N	429.543	1.099	50	20	IDGD	
Cc1ccc(S(=O)(=O)n2ccc(C(=O)NNC(=O)c3n[nH]c4c3CCCC4)c2)cc1	1321730415	JQTAHJDZNOGUGT-UHFFFAOYSA-N	427.486	1.710	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@H](C)c2ccc(F)c(F)c2)cc1	1322124769	XQUHMMDYHOKQQK-CYBMUJFWSA-N	425.457	1.845	50	20	IDGD	
O=C(CNC(=O)c1cc(Cl)ccn1)NNC(=O)c1ccc(F)cc1Br	1323790222	PZBVFHXRWHUHBE-UHFFFAOYSA-N	429.633	1.828	50	20	IDGD	
CC(=O)Nc1cc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](F)Cl)C2)ccn1	1778025602	DDOMQYPAGOBESS-SIXWZSSISA-N	426.876	1.702	50	20	IDGD	
Cc1cc(NC(=O)CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](F)Cl)C2)no1	1778026021	KHJHEJSXBCUVKU-PZPSRYQVSA-N	430.864	1.360	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4scnc4c3)C2)C1	1778643269	FYVUSZNMDIPJJJ-NRFANRHFSA-N	445.545	1.113	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](C)Nc3ccccn3)C2)C1	1779332347	VGHUPXJMVBCXNN-VCBZYWHSSA-N	439.354	1.885	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C=N/N2CCCCC2)C1	1779363925	NXRICFXZXXYYJL-BZLZVXNVSA-N	428.961	1.226	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)CC(C)(C)C(=O)OC(C)(C)C)C2)C1	1780889417	DNNIRMSTNFJZKF-YCRPNKLZSA-N	446.972	1.828	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccnc4c3OCO4)CCO2)C1	1781231190	HERJAJSPPQTAQO-QZTJIDSGSA-N	430.288	1.490	50	20	IDGD	
O=C(c1cccc2ccnn12)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781333630	PHSGMRLRZKVXNI-PBHICJAKSA-N	425.258	1.468	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](CC)NC(C)=O)C2	1781897908	UQBHRNGTXBBXPB-YIOZNXECSA-N	446.386	1.589	50	20	IDGD	
CCc1ccc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CCC(=O)NN(C)C)C2)cn1	1782210755	HFWCRFRDXQBTEH-AUSIDOKSSA-N	445.564	1.145	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1nc3ccccn3n1)C2)C(Cl)Cl	1782215231	MCOORVPFALVUTA-KZULUSFZSA-N	426.304	1.661	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnc(OCF)cn1)C2)C(Cl)Cl	1782216454	QKFRQJHCIBDXQM-SJKOYZFVSA-N	435.283	1.714	50	20	IDGD	
C[C@H](C(=O)N1CC[C@]2(CN(C(=O)C(Cl)Cl)CCO2)C1)[S@](=O)c1ccccc1	1782685212	FQCFITJGFGPRMO-GOXOYUAHSA-N	433.357	1.816	50	20	IDGD	
CN1CC(C(=O)N2CCO[C@@]3(CCN(C(=O)/C(C#N)=C/c4ccc(F)cc4F)C3)C2)C1	1782867466	ITCPNPAZNGCHQX-XXFFJTNUSA-N	430.455	1.263	50	20	IDGD	
C[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(C)(C)CCl)[C@H]2C1)[C@H]1SC(=N)NC1=O	1783850431	HLVVIAAHXRFJDW-IKOXMDCHSA-N	444.985	1.034	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cnc4cc(Cl)ccn34)CCO2)C1	1783875978	QFDNEVXVYDFDHB-LIRRHRJNSA-N	441.315	1.685	50	20	IDGD	
Cc1ccc2[nH]c(C(=O)N3CCO[C@@]4(CCN(C(=O)CCC(=O)NN(C)C)C4)C3)cc2c1	1783935640	XBRACZTZOGJAEV-HSZRJFAPSA-N	441.532	1.293	50	20	IDGD	
Cc1cc(Cl)cc(C(=O)N2CCO[C@@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)c1	1783938103	UKWHYECESMWZQP-OAQYLSRUSA-N	436.940	1.465	50	20	IDGD	
COC(=O)[C@@H]1CC[C@@H](C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Br)C[C@@H]32)C1	1784088529	WTPYFPMVICNPBG-SPJHXALWSA-N	449.317	1.246	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccnc3-c3ccccc3)C[C@@H]21)[C@@H](O)CCl	1784090802	NILXLCQVTMKAEV-LEAZDLGRSA-N	443.931	1.942	50	20	IDGD	
COC(=O)c1ccc(OCC(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](F)Cl)CCO3)cc1	1785720481	YTEIOTUBSLIACQ-VQIMIIECSA-N	428.844	1.216	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(Cl)s3)[C@H]2C1	1785973847	MUPMWIHHRKBLFH-IHRRRGAJSA-N	442.969	1.368	50	20	IDGD	
Cc1nn(C)cc1C(=O)Nc1ccc(C2(NC(=O)c3cnccc3C(=O)NN)CCC2)cc1	1786509952	BJPVWSYPYMMOCU-UHFFFAOYSA-N	447.499	1.789	50	20	IDGD	
COCc1oncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]21	1787722501	KVORAUCRWSMDAI-CQEJWKIFSA-N	434.320	1.651	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)c1cc2c(F)cc(F)cc2[nH]1	1787918809	HGDRPMUAPLMOPQ-NQVRKPIFSA-N	441.862	1.639	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc4cn[nH]c4cn3)[C@H]2C1	1788467298	RMEHWYKUYUQRNT-NPWXVWPOSA-N	440.331	1.788	50	20	IDGD	
Cc1nnc(CC(=O)NC2(c3ccc(NC(=O)c4cnccc4C(=O)NN)cc3)CCC2)o1	1789522440	GBHWYHDWDYVWEN-UHFFFAOYSA-N	449.471	1.367	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3CC[C@@H]4CCC(=O)N4C3)[C@H]2C1	1789766915	GABOOQWHLHSKMF-XEZGLNCPSA-N	439.984	1.775	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccnc(Cl)n3)C[C@@H]21	1789870842	ZBUSEHYFBWOFGA-NDBFUVGKSA-N	435.739	1.960	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cc(C)on3)C[C@@H]21	1790964285	WNJHHGSKWJQCBZ-HNKHHVNMSA-N	428.327	1.679	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(F)nc3F)C[C@@H]21	1791054322	AGWUQKHUVPXZFW-URBCHYCLSA-N	432.265	1.737	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc4nccn34)C[C@@H]21	1791063881	VSSDSYYLCMZQGJ-HOSILWTGSA-N	435.322	1.711	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1n[nH]c3c1CC[C@@H]3C)C2	1792867885	JQPKFEPEBYNHDP-SMTWKSNJSA-N	439.354	1.694	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3ncncc3c1)C2	1792871403	XYILKTQBCZYDPE-GMLZMKKNSA-N	447.333	1.864	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cn1ccc2c(F)cccc21	1792928906	RZBHUECSUKSQQN-FKEXNYPISA-N	437.899	1.624	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCn1c(=O)oc3ccccc31)C2	1793445487	JZLZNRMVKTYFGB-UIVXKWKOSA-N	449.935	1.982	50	20	IDGD	
CC(C)c1nc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Br)C3)no1	1794002682	XIOUFBUKWLUCJQ-RDBQEKCUSA-N	433.278	1.016	50	20	IDGD	
C=CCC(CC=C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1	1796439428	CSVIVOOVKMAWSB-WCARGJHZSA-N	441.532	1.478	50	20	IDGD	
Cc1ccn2ncc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)c3cnccc3C(=O)NN)C4)c2c1	1796706948	YYMOVKYNGDTNRM-MUJYYYPQSA-N	447.499	1.207	50	20	IDGD	
CN(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1CCC1)C2)NC(=O)NCc1ccccc1	1799864905	SQNJJSPXLBEXNB-ACDBMABISA-N	427.549	1.771	50	20	IDGD	
COC[C@@H](C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN(C)NC(=O)NCc1ccccc1	1799865632	FJZCKTGLCSLFTK-RSPOEFSDSA-N	445.564	1.253	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CC[C@H]2CCC(=O)N2C1)[C@H](F)Br	1799930531	AUIFXNSWDPXXCJ-DKTZCXADSA-N	430.318	1.716	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)Nc1cccnc1)C2	1800756825	RYSRMVNEUCYNJE-IPVBOJNNSA-N	425.327	1.255	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cn(C)c3ncccc13)C2	1800759055	FKSSZRRHQVBFRI-JFILPPLUSA-N	435.322	1.560	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)N(C)C(=O)OC(C)(C)C)C2	1800977497	RZQGSYOKPNYWDF-IBEHDNSVSA-N	447.960	1.085	50	20	IDGD	
Cc1cc(Cl)ccc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCC(=O)NN(C)C	1801008922	IUSVXHPZDBBBEO-YVWYUNDQSA-N	436.940	1.225	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)COc1ccc(O)nn1	1801264798	WUIFYYORIFLKFA-FVCCEPFGSA-N	427.299	1.230	50	20	IDGD	
Cn1cc2cc(C(=O)N3CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]3c3cccnc3)ccc2n1	1803148511	RIZDQYJJDODDBB-UXPWSPDFSA-N	441.919	1.888	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)Cc2cccnc2)[C@H]1c1cccnc1	1807626767	JKAZURHXUNIBDA-AUSIDOKSSA-N	438.532	1.098	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)c1nnsc1C1CC1	1808734203	WBEOPRSFPNWICF-SQWLQELKSA-N	435.937	1.730	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2cn3ncccc3n2)[C@H]1c1cccnc1	1809358303	SSVSCZVVMKPMJN-TXPKVOOTSA-N	442.907	1.698	50	20	IDGD	
Nc1ccccc1/C=C/C(=O)N1CCCC2(CCN(C(=O)c3cccc(B(O)O)c3)CC2)C1	1809849104	UFPCATQROPLGMU-MDZDMXLPSA-N	447.344	1.507	50	20	IDGD	
C[C@H](Cc1ccccn1)C(=O)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1	1809979987	JLQGRHHRZPDVRD-LJQANCHMSA-N	449.360	1.485	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1CCN(C(=O)c2ccnnc2O)[C@@H]1c1cccnc1	1810543623	DADAUVDRKSEVAQ-MAUKXSAKSA-N	429.553	1.748	50	20	IDGD	
NC(=O)c1ccccc1C(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1	1811268574	BJMHGISGCPGKDY-WBAXXEDZSA-N	430.892	1.100	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H](CNC(=O)c2c[nH]c(=O)cn2)[C@@H]1c1cccnc1	1811450280	SHKFFRMDCDMRMF-BEFAXECRSA-N	429.553	1.336	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2cnn3c2OCCC3)[C@@H]1c1cccnc1	1812120422	WLTPFPHCRATDLP-NJAFHUGGSA-N	447.923	1.634	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)CCSC(=N)N)[C@@H]1c1cccnc1	1813030783	LCJGFFJLTJFOFX-OFQRWUPVSA-N	427.958	1.358	50	20	IDGD	
CSCC[C@H](O)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@@H]1c1cccnc1	1813094440	YVKWGPZGHZNWLG-BYNSBNAKSA-N	448.358	1.892	50	20	IDGD	
CC(C)[C@@H](S)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1815243267	IQLCNNFXCIYQFK-DOTOQJQBSA-N	445.549	1.669	50	20	IDGD	
O=C(C#Cc1ccccc1)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1	1815339985	YZMAHQUOBYWQPQ-GOSISDBHSA-N	445.309	1.100	50	20	IDGD	
O=C(Cc1cscn1)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1817546246	QBVXGGSNYLVQCJ-QGZVFWFLSA-N	439.306	1.095	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2nc3ncccn3n2)n[nH]1	1818621209	UKDLCXLFDSXSMH-YPMHNXCESA-N	432.872	1.407	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccccc2O)[nH]n1	1819402200	UHTXWPCAFZZOKK-QGZVFWFLSA-N	449.471	1.734	50	20	IDGD	
COC[C@H](NC(C)=O)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](F)Br)[nH]n1	1819611827	NUNSKBNIIWTARU-SCRDCRAPSA-N	448.293	1.243	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)/C=N/O[C@@H]3CCCCO3)sc2C1	1819907869	UCECTEYCUPROCO-NYVFSLHZSA-N	444.941	1.838	50	20	IDGD	
CCOc1ccc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@@H](Cl)COC)CC3)nn1	1821760220	CGMUBMQECJWVLZ-MNOVXSKESA-N	439.925	1.811	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1	1822374332	JGDIKJRUMBAXEV-TZMCWYRMSA-N	428.921	1.029	50	20	IDGD	
O=C(CCCn1cccc1)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1822827118	LPUNJZCUQUWIID-FQEVSTJZSA-N	449.320	1.677	50	20	IDGD	
CCc1ccnc(C(=O)N[C@@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)c1	1826085192	JHODOAZKRSHVAY-CQSZACIVSA-N	444.561	1.699	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H]2CCCOC2)CC1	1828925583	LWMFOLAYHFQPQU-YLJYHZDGSA-N	443.548	1.345	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H](N)CCC(N)=O)CC1	1829102056	GHNJVIOFZUXANK-IRXDYDNUSA-N	426.634	1.050	50	20	IDGD	
C/C(=C\c1cccs1)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1	1829696735	IDQKPQITKCRYHT-VZFRGVLESA-N	428.938	1.208	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](Cl)COC)CC1	1831830562	DXKYUNZACMPUNJ-PVAVHDDUSA-N	430.977	1.568	50	20	IDGD	
Cc1nn(C)cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1	1831877069	SCSFVNOSTRVUNY-ROUUACIJSA-N	433.336	1.035	50	20	IDGD	
Cc1cccc(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)c1F	1833155205	CLTBWFFXMIXDAR-SFHVURJKSA-N	425.932	1.919	50	20	IDGD	
C=CCNC(=O)/C=C\C(=O)N1CCC(N2CCC(NC(=O)[C@@H](Cl)CCC)CC2)CC1	1833530810	XGLHQNCXDPPEJU-RURPWVQCSA-N	439.000	1.824	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)Cc3csc(C)n3)CC2)CC1	1833819240	GBUNUJJCFHOCOD-SFHVURJKSA-N	443.013	1.819	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cncc(F)c1)CCO2	1834357135	FUNMZTNMWMXBPW-LJQANCHMSA-N	425.533	1.142	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)CCN3CCCCC3)CC2)CC1	1834529965	VBBZUKKYECFEAK-FQEVSTJZSA-N	443.032	1.688	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnoc3C3CC3)CCO2)C1	1834609942	QBDWNADWEAUHLZ-FQEVSTJZSA-N	425.913	1.887	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CCC(F)(F)F)CCO2)C1	1835329018	KIXOYUWSWCQNBW-SMDDNHRTSA-N	431.249	1.569	50	20	IDGD	
CC(=O)c1cc(C(=O)N2CCC(N3CCC(NC(=O)CO[Si](C)(C)C)CC3)CC2)n[nH]1	1835835295	ROQBQVOFYKAWTO-UHFFFAOYSA-N	449.628	1.649	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H]3CCCOC3)CC2)CC1)[C@@H](F)Br	1836414407	JJWCEBNKAFVNNV-XJKSGUPXSA-N	434.350	1.675	50	20	IDGD	
O=C([C@H](O)CCl)N1CCC(OC2CCN(C(=O)[C@@H]3CCc4ccoc4C3)CC2)CC1	1836713605	HXFKHXSFZDFFED-VQIMIIECSA-N	438.952	1.983	50	20	IDGD	
C=CC[C@H](C(=C)C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1837311077	YSKHYDKZQURQLS-IIDMSEBBSA-N	433.318	1.902	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(F)nc3)CCO2)C1	1837851014	CMGZCJBGRKOYOC-SJCJKPOMSA-N	430.274	1.074	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3ncccc3F)CCO2)C1	1838243071	HCXQQTFWIFWAKR-SCLBCKFNSA-N	444.301	1.322	50	20	IDGD	
O=C(c1cncc2cnccc12)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1838466815	UDSLZOQKUQZVCQ-IBGZPJMESA-N	439.299	1.504	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(C)nc3OC)C2)C1	1839145857	GDGODHLJGOUKKN-UZLBHIALSA-N	425.913	1.486	50	20	IDGD	
CN1CCCC[C@@H]1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2	1839150660	SWRXSEKCDBLYTM-LZQZEXGQSA-N	436.380	1.163	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3CC[C@H](O)CC3)C2)C1	1839155299	QIAUABPQNDLKRG-LNMJFAINSA-N	437.364	1.230	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3ccc[nH]3)C2)C1	1839963947	AXEJWOHWXMGJGE-QFBILLFUSA-N	442.354	1.577	50	20	IDGD	
Cc1cc(F)cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)c1	1840034831	YKKMDHKHBZFSNO-KUHUBIRLSA-N	443.313	1.988	50	20	IDGD	
Cc1cnn([C@H](C)C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@](C)(Cl)CCl)C3)C2)c1	1840406303	SQLQHAXKZHCTEH-LZQZEXGQSA-N	447.363	1.445	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2cccnc2S)C1	1841061259	DKIDOFJVMRSCRH-YDZHTSKRSA-N	426.502	1.321	50	20	IDGD	
COC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)[C@H](C)Br)C2	1843383316	NTGXWPOYTMZFHX-QWHCGFSZSA-N	448.358	1.513	50	20	IDGD	
Cc1ccn2c(=O)c(C(=O)N3CCCC34CN(C(=O)[C@@H](F)Br)C4)cnc2c1	1843787855	VTOOINABBSLMOJ-CQSZACIVSA-N	437.269	1.510	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)Cc2cc3cccnc3cc2F)C1	1845141888	GSPMCLGFVFYGSP-UHFFFAOYSA-N	441.507	1.493	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)N2CC3(CCCN3C(=O)[C@H](F)Br)C2)c1	1845215848	HXGPJWIPXMKUMG-ZDUSSCGKSA-N	433.299	1.598	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H]2C[C@@]2(C(=O)N2CCCC23CN(C(=O)[C@H](O)CCl)C3)C1	1846126241	RAUFFPUUKQRNJC-ARGWCVDVSA-N	427.929	1.047	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)c1cc(S(C)(=O)=O)ccc1F)C2	1846364575	XWRLSECHONUYLH-AWEZNQCLSA-N	432.901	1.300	50	20	IDGD	
COc1ccc(C(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)c(Cl)c1	1846848356	IPLIXEHGWLDZBR-UHFFFAOYSA-N	428.681	1.159	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)N3CCC(C(=O)N4CCOCC4)CC3)cc2C1	9793558	NWDRFANQBZWZNS-AWEZNQCLSA-N	434.562	1.798	50	20	IDGD	
CCOc1ccc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)[C@@H]3CCCO3)cc2)cc1	15737358	QPMAZBHXOKAKIW-SFHVURJKSA-N	433.486	1.826	50	20	IDGD	
NS(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)CC23CC4CC(CC(C4)C2)C3)cc1	18995181	CAPQCWKOWAJTDR-UHFFFAOYSA-N	427.548	1.250	50	20	IDGD	
O=C(NNC(=O)c1cnc2ccccc2n1)c1ccc(S(=O)(=O)N2CCCC2)cc1	21783645	ZVNIBVUZIRAGBB-UHFFFAOYSA-N	425.470	1.489	50	20	IDGD	
Cc1ccc(NC(=S)NNC(=O)CN2C(=O)COc3ccc([N+](=O)[O-])cc32)c(C)c1	28616087	DWDZAIUPZKJDEB-UHFFFAOYSA-N	429.458	1.955	50	20	IDGD	
O=C(COc1cccc(C(F)(F)F)c1)NNC(=O)c1csc(N2CCOCC2)n1	68856551	SIFNGLXFQGFXOB-UHFFFAOYSA-N	430.408	1.839	50	20	IDGD	
COCCCNC(=O)NNC(=O)c1nnn(C2CCN(C(=O)OC(C)(C)C)CC2)c1C	726163760	ZNRLVTIYTDZRSH-UHFFFAOYSA-N	439.517	1.139	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)CNS(=O)(=O)c1cc(C(F)(F)F)ccc1Cl	726538728	WCWKNORSEGOETN-UHFFFAOYSA-N	438.815	1.437	50	20	IDGD	
Cn1nc(C(=O)NNC(=S)NCCc2ccc3c(c2)OCCO3)c2ccccc2c1=O	726745339	HGTQVAWKQNLOBJ-UHFFFAOYSA-N	439.497	1.056	50	20	IDGD	
Cn1c(SCC(=O)NNC(=O)CNC(=O)c2cccs2)nnc1-c1cccs1	726756345	KGCFNUZEQAHYQD-UHFFFAOYSA-N	436.544	1.275	50	20	IDGD	
O=C(CCc1nc2ccccc2n1-c1ccccc1)NNC(=O)[C@H]1CCS(=O)(=O)C1	728370738	BFZRLBWGUKVKTG-HNNXBMFYSA-N	426.498	1.540	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)c2ccc3c(c2)SC2=NS(=O)(=O)CCN23)c1	728827519	RQHKRHMHXBQHAI-UHFFFAOYSA-N	427.467	1.245	50	20	IDGD	
COC(=O)/C=C/c1cc(OC)c(OC)c(S(=O)(=O)NNC(=O)c2cccc(C#N)c2)c1	728853509	PMZZKRGCFNBIOC-BQYQJAHWSA-N	445.453	1.385	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)N2CCN(S(=O)(=O)c3ccc(F)cc3)CC2)c1	728954657	LPJKUAQTCDDZQH-UHFFFAOYSA-N	431.449	1.058	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)[C@@H]2C[C@@H](O)CN2C(=O)OCc2ccccc2)cc1	729509680	ABLFWHZXBVVOTA-MJGOQNOKSA-N	427.457	1.293	50	20	IDGD	
Cc1nn(-c2ccccc2)c2sc(C(=O)NNC(=O)Cn3[nH]cc4c(=O)ncnc3-4)cc12	730584633	XBAMDBHAWHRTLT-UHFFFAOYSA-N	448.468	1.241	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)c1sccc1S(=O)(=O)N1CCCC1	730782022	DVFLZIBISIEUDG-UHFFFAOYSA-N	425.488	1.078	50	20	IDGD	
CN(C(=O)c1ccco1)c1ccccc1C(=O)NNC(=O)CNC(=O)c1cccs1	731005268	YMEZVSNRXLJMQQ-UHFFFAOYSA-N	426.454	1.809	50	20	IDGD	
CC(C)(C(=O)NNC(=O)[C@H]1CCCN1C(=O)/C=C\c1ccc(C(N)=O)cc1)c1ccccc1	731176238	LRVGIJJKBHNVKX-NLBZTSMMSA-N	448.523	1.915	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)NCCS(=O)(=O)NCC3CCC3)n[nH]2)cc1	731760967	LDAWCKMWFOMKRJ-UHFFFAOYSA-N	434.522	1.049	50	20	IDGD	
COCCOc1cc([N+](=O)[O-])c(C(=O)NNc2nc(-c3ccncc3)no2)cc1OC	732065850	YMVZWEMFDXBDEB-UHFFFAOYSA-N	430.377	1.831	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2cccc(S(N)(=O)=O)c2)cc1Br	732235279	RCBUCCKCYGHMHM-UHFFFAOYSA-N	443.279	1.572	50	20	IDGD	
CSCC[C@H](NC(=O)Cc1ccccc1)C(=O)NNC(=O)[C@H]1COc2ccccc2O1	732749661	CXFXNMZZKKGIAJ-QFBILLFUSA-N	443.525	1.454	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCCc2cccc(F)c2F)cc1	732894390	LHZZYGGGUMBBIH-UHFFFAOYSA-N	440.472	1.467	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)N[C@H]1CCCN(c2cc(CC)ncn2)C1	732913916	HQCQMJPHWOWGFO-KRWDZBQOSA-N	442.520	1.816	50	20	IDGD	
CNS(=O)(=O)[C@@H]1CCCN(C(=O)/C(C#N)=C\c2cc(C)n(C[C@H]3CCCO3)c2C)C1	733279215	RIAVNNXZKCGMCB-LDWJFSKOSA-N	434.562	1.731	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)NCc1cc2c(nc1O)CCC2	733650969	DKMDKTASNMJMGN-UHFFFAOYSA-N	438.532	1.319	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)[C@@H]1CC(=O)N(Cc2ccco2)C1	734251940	UJVYPBBELKCRFC-CQSZACIVSA-N	434.518	1.848	50	20	IDGD	
CN1CCC[C@H](CNC(=O)NNC(=O)C(=O)NC2CC2)[C@@H]1c1ccc(C(F)(F)F)cc1	735587033	QQTXWSAJIKKKCL-CJNGLKHVSA-N	441.454	1.697	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)c2ccccc2NS(C)(=O)=O)cc1C	736755222	MSWNKYZJDJCSMC-UHFFFAOYSA-N	439.515	1.608	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)N[C@H](C)C(=O)N2CCCC[C@H]2C)nc1	737047782	OFZAHANHXBEGRV-HUUCEWRRSA-N	440.570	1.528	50	20	IDGD	
O=C(NNS(=O)(=O)N1CCCC1)c1ccccc1NS(=O)(=O)c1cccs1	740705642	JTFSUPDXDHXTLT-UHFFFAOYSA-N	430.533	1.124	50	20	IDGD	
CCO[C@H](C)c1ncc(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)s1	742478493	PWGRVSZPFITSPR-MRVPVSSYSA-N	432.911	1.616	50	20	IDGD	
C[C@H](CC(=O)NNC(=O)Cn1ccc2ccccc21)/N=C1/NS(=O)(=O)c2ccccc21	742643088	RKJHGOFWSCKKDP-CQSZACIVSA-N	439.497	1.306	50	20	IDGD	
CC(=O)N1CCCc2cc(S(=O)(=O)NNC(=O)c3cc([N+](=O)[O-])ccc3O)ccc21	743268771	KCTFPRKVTKDYCT-UHFFFAOYSA-N	434.430	1.223	50	20	IDGD	
Cn1cc([C@H](O)CNC(=O)NNC(=O)[C@@H]2Cc3ccccc3CN2Cc2ccccc2)cn1	743574700	WKSOXADXCCWMOO-FCHUYYIVSA-N	448.527	1.411	50	20	IDGD	
Cc1nc([N+](=O)[O-])cn1CC(=O)NNC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1	743737929	KSNBVOFBFDMOEP-UHFFFAOYSA-N	446.427	1.809	50	20	IDGD	
CCC1(CC)NC(=O)N(CC(=O)NNC(=O)Nc2cc(Cl)c(OC)cc2OC)C1=O	743834202	VCBOMOOIULVAAE-UHFFFAOYSA-N	441.872	1.621	50	20	IDGD	
CCN(CC)C(=O)CCCC(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	744620321	JJOIBNQFPXIFRL-UHFFFAOYSA-N	426.539	1.189	50	20	IDGD	
CC(C)COC(=O)N1CCC(C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)CC1	744921462	HZDDQZVGWYZMHM-UHFFFAOYSA-N	430.461	1.367	50	20	IDGD	
Cc1nc(CNC(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)no1	745854030	FLSZXAFYLNIFNL-UHFFFAOYSA-N	436.475	1.385	50	20	IDGD	
CNS(=O)(=O)c1cccc(NC(=O)[C@H](C)NC(=O)c2c(C)nn(CCCl)c2C)c1	746229321	NAEWGLVBCHTLEU-LBPRGKRZSA-N	441.941	1.404	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)N[C@@H]2CCCN(CC(F)(F)F)C2=O)c1C	746339237	LVCRCSJVTLSVKF-ZIAGYGMSSA-N	430.427	1.954	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)[C@H]1CSCN1C(=O)c1ccc(Cl)cc1	746544944	AZMUFQCMCRIYKZ-MRXNPFEDSA-N	443.916	1.893	50	20	IDGD	
N#Cc1ccc(C(=O)NNS(=O)(=O)c2ccc(I)cc2)cc1	747072546	BWPCQGFMABWLBX-UHFFFAOYSA-N	427.223	1.786	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCC[C@H](C)[C@H]2CNC(=O)OC(C)(C)C)n1	747971086	XVRJKPJILXDAKG-DZGCQCFKSA-N	439.582	1.767	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)NC[C@@H](c1cccc(Cl)c1)N1CCOCC1	748627814	LUTDRCYHITXIBL-PBHICJAKSA-N	428.917	1.095	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)N[C@@H](C)c1ccc(NC(=O)c2ccncc2)cc1	748628982	BFZBSMBTYXJCJR-LSDHHAIUSA-N	429.477	1.777	50	20	IDGD	
CN(C)C(=O)CS(=O)(=O)c1ccc(C(=O)NNc2ccc(OC(F)F)cc2)cc1	748656518	VUDFJSYKYQYLPV-UHFFFAOYSA-N	427.429	1.907	50	20	IDGD	
O=C(NNC(=O)c1cc2ccccc2o1)c1ccc(S(=O)(=O)NC[C@@H]2CCCO2)cc1	749473605	IKZOIHNOWRSCKA-INIZCTEOSA-N	443.481	1.965	50	20	IDGD	
CCS[C@H]1CCCC[C@H]1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	750675200	IMNASTWCTSLRKL-CVEARBPZSA-N	428.580	1.945	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H]2CCN(c3cccc(Cl)c3)C2)c1	751103500	QPFVJLZGXRPTMX-HNNXBMFYSA-N	436.921	1.966	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2ccc(C(=O)CCC(=O)O)cc2)c(OC)c1	751213665	ZZGJFAHKVLNFQV-UHFFFAOYSA-N	436.442	1.375	50	20	IDGD	
CCOc1ccc(C(=O)NNS(=O)(=O)c2ccc(OCC(=O)O)c(F)c2)cc1OC	751263134	HQVOBRBBLYPHFH-UHFFFAOYSA-N	442.421	1.320	50	20	IDGD	
CCCOc1ccc(C(=O)NNS(=O)(=O)c2cnc3c(c2)c(C)nn3C)cc1OC	751263257	JOSMLHSGLUTDBN-UHFFFAOYSA-N	433.490	1.697	50	20	IDGD	
CN(C[C@@H](O)CN1CCOCC1)C(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccccc1	751431838	RZZJWJCQNSAIBO-FBHQFGEZSA-N	448.527	1.522	50	20	IDGD	
CCC(CC)(CNC(=O)OC(C)(C)C)C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	751556981	YCAOTBGUDNHBDN-UHFFFAOYSA-N	431.497	1.754	50	20	IDGD	
COc1ccc(-c2nn(-c3ccccc3)cc2CC(=O)NNC(=O)CN2CCCC2=O)cc1	751616399	FMDVKUOFPDEOAI-UHFFFAOYSA-N	447.495	1.860	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2cccc(C(=O)NNC(=S)N[C@@H](C)C3CC3)c2)C[C@@H](C)O1	751619678	WIPLVGFMPGMFHB-MJBXVCDLSA-N	440.591	1.392	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)N[C@@H]3CCC[C@@H]4CN(Cc5ccccc5)C[C@H]43)nc21	753317644	XAHDRTYCKQDGBH-KBAYOESNSA-N	436.520	1.996	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)N(CCS(C)(=O)=O)C2CC2)N(C)c2ccccc21	753755173	ZDXBCBFLQPNHSZ-UHFFFAOYSA-N	430.530	1.693	50	20	IDGD	
C[C@H](NC(=O)OC(C)(C)C)[C@@H](C)C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	755313020	PPOYRTRGHNQCIN-ZJUUUORDSA-N	448.929	1.298	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc(OC)c1	755375286	UFEBJTDBWXYONQ-UHFFFAOYSA-N	448.501	1.955	50	20	IDGD	
COc1ccc(S(=O)(=O)NC2CC2)cc1NC(=O)NNC(=O)c1ccc2c(c1)OCO2	755611056	HZVUGYHRIPRMHY-UHFFFAOYSA-N	448.457	1.331	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)Nc3ccn(CC(=O)N4CCOCC4)n3)cc2C1	756652926	COBXIBBFAFXBTK-ZDUSSCGKSA-N	446.533	1.395	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2ccc(OC)c(OC)c2)cc1NS(C)(=O)=O	756782105	NGGLCBPSLQGMRS-UHFFFAOYSA-N	438.462	1.550	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)Nc2ccc(C(N)=O)cc2F)c2ccccc2c1=O	756821240	NIZYQSBHJHZJLJ-UHFFFAOYSA-N	426.408	1.682	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)Nc1cc(C2CC2)nn1[C@@H]1CCS(=O)(=O)C1	756857283	UBFHEUBULFXWCL-CQSZACIVSA-N	448.461	1.495	50	20	IDGD	
CCOc1ccc(C(=O)N(C)C)cc1NC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	756882673	PCOXJSMTDUZUTI-SFHVURJKSA-N	428.445	1.780	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)NCc2ccc3c(c2)CCS3(=O)=O)cc1OC	757739985	GJAOCVNDALZCFW-UHFFFAOYSA-N	433.486	1.568	50	20	IDGD	
Cc1cc(C(=O)N2CCOCC2)ccc1NC(=O)NNC(=O)c1ccc2c(c1)OCO2	757830960	NQUFCSDIOKJJSL-UHFFFAOYSA-N	426.429	1.663	50	20	IDGD	
O=C(c1cnc(-c2cccnc2)s1)N1CCN(S(=O)(=O)CBr)CC1	758528579	WIXVYLWLFSHZKH-UHFFFAOYSA-N	431.337	1.645	50	20	IDGD	
COc1ccccc1[C@@H](CNC(=O)NNC(=O)C(=O)Nc1ccccn1)N1CCCCC1	758710095	MLPDEGIVOBWYIT-QGZVFWFLSA-N	440.504	1.586	50	20	IDGD	
Cc1c(C(=O)NNC(=O)C(=O)Nc2ccccn2)cnn1-c1ccc(Br)cc1	758833927	LFZQWIJUVVQBLS-UHFFFAOYSA-N	443.261	1.738	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ccc3cccc(O)c3n2)CC1)C(=O)Nc1ccccn1	759099024	OTVGECSLIMZQBM-UHFFFAOYSA-N	434.456	1.338	50	20	IDGD	
Cc1ccnc(-n2nccc2NC(=O)C(=O)NNC(=O)c2ccccc2Br)c1	760280944	ZTVHXFMYQMJFKM-UHFFFAOYSA-N	443.261	1.738	50	20	IDGD	
CCS(=O)(=O)c1cccc(S(=O)(=O)NNC(=O)c2ccc(OC)c(OC)c2)c1	760335036	PHOGXOWGYACWOV-UHFFFAOYSA-N	428.488	1.121	50	20	IDGD	
COc1ccc2c(c1)OC[C@@H]2CC(=O)OCC(=O)NNC(=O)c1ccc(OC)c(OC)c1	760621583	YDCSYJNANNBZSS-AWEZNQCLSA-N	444.440	1.583	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NNc2nccc(N3CCOCC3)n2)ccc1C	762852704	YQZUKWYTYWQBEG-UHFFFAOYSA-N	448.549	1.409	50	20	IDGD	
O=C(COC/C=C\c1ccccc1)NNc1ccccc1S(=O)(=O)N1CCOCC1	763432422	HNPMBFURDVQBOS-TWGQIWQCSA-N	431.514	1.881	50	20	IDGD	
CC(C)OC(=O)NCc1ccc(NC(=O)C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1	763446750	WVVDFRQIKUNRDU-UHFFFAOYSA-N	443.416	1.629	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccnn2C2CCCC2)cc(OC)c1OC	763540374	UHQVXDARNHJVPW-UHFFFAOYSA-N	431.449	1.424	50	20	IDGD	
COC(=O)c1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)c1ccc(OC)c(OC)c1	763549827	ACOUJHUNSNKJJA-UHFFFAOYSA-N	435.820	1.544	50	20	IDGD	
COCCCOc1cccc(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1	763573156	XRBFCVYIVITDDJ-SFHVURJKSA-N	429.429	1.028	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cccc(S(=O)(=O)N3CCCCC3)c2)c(C)o1	763583342	MZVUTLCWDIXESU-UHFFFAOYSA-N	448.501	1.471	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(CNC(=O)OC(C)C)cc2)c1	763619094	NTAXLBQADSLYFY-UHFFFAOYSA-N	442.472	1.795	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2ccc(CC(=O)N(C)C)cc2)c1	763668538	NJUSHULQDSVNME-UHFFFAOYSA-N	426.473	1.099	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(-c2n[nH]c(C)n2)cc1	763680468	FYYHLZSGRWVHMO-UHFFFAOYSA-N	438.444	1.344	50	20	IDGD	
O=C(NNC(=O)c1cc2c(s1)CCC2)C(=O)Nc1ccccc1CN1CCOCC1	763775399	QNLVWSNYGKZRGS-UHFFFAOYSA-N	428.514	1.469	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)C(=O)Nc2sc(C)nc2C)c2ccccc2c1=O	763804338	LIPAXXFNOZEUKQ-UHFFFAOYSA-N	442.501	1.670	50	20	IDGD	
COCCCn1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc3ccccc3c2)n1	763851594	UJRFDLYNUGJIRH-OAHLLOKOSA-N	439.472	1.626	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cccc(-n3ccnc3)c2)cc1	763862511	XVNBUKPWLYUYBT-HNNXBMFYSA-N	437.456	1.824	50	20	IDGD	
CNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2c(C)cc(Cl)cc2C)c1	763884999	ZYIYPOVRYKWTHZ-ZDUSSCGKSA-N	446.891	1.870	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3cnn(-c4ncccc4C#N)c3)cc2C1	763943111	RBBKLRLKJHXTKK-LBPRGKRZSA-N	449.496	1.725	50	20	IDGD	
O=C(NNC(=O)c1ccc2ccccc2c1)C(=O)Nc1cccc(Cn2cccnc2=O)c1	764066955	MKJDXEZACRFYDB-UHFFFAOYSA-N	441.447	1.845	50	20	IDGD	
CN1CCC/C1=N/S(=O)(=O)c1cccc(NC(=O)C(=O)NNC(=O)CC(C)(C)C)c1	764198616	IASSAVVXSSBBMI-HAHDFKILSA-N	437.522	1.022	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)C(=O)Nc1ccc(-n2cccn2)c(F)c1	764202262	AUVAUWSYGUOLHN-UHFFFAOYSA-N	448.455	1.402	50	20	IDGD	
Cc1ncsc1C(=O)NNC(=O)C(=O)Nc1ccc(N2CCC(CN(C)C)CC2)cc1	764244360	GNYGEXMRQUAJKM-UHFFFAOYSA-N	444.561	1.629	50	20	IDGD	
COc1cc(Br)cc(C)c1NC(=O)C(=O)NNC(=O)c1scnc1C	764246169	FHKLINJYXHMDCQ-UHFFFAOYSA-N	427.280	1.931	50	20	IDGD	
COC(=O)c1cc(Cl)ccc1NC(=O)C(=O)NNC(=O)c1cc(-c2cccs2)[nH]n1	764382952	SZVUTJPGYCXCQL-UHFFFAOYSA-N	447.860	1.978	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cccnc3-n3cccn3)n[nH]2)cc1C	764386342	GIWWANRWKBZAER-UHFFFAOYSA-N	444.455	1.674	50	20	IDGD	
CN(C)C(=O)COc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2F)c1	764412519	FVDFHCUKSNKESJ-UHFFFAOYSA-N	436.827	1.346	50	20	IDGD	
Cc1ccc([C@H](C)[C@H](O)C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cc1	765178585	YLWSWBHOIPAHBA-AVRDEDQJSA-N	438.528	1.065	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)N1CCNC(=O)[C@@H]1c1cccc(Br)c1	766246375	CIQIVVSIELQBRT-WBMJQRKESA-N	425.327	1.504	50	20	IDGD	
CSc1ccc(S(=O)(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1Cl	766353513	KDEZIMBZWAPEJE-UHFFFAOYSA-N	448.979	1.978	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)C[C@@H]2CN(C(=O)OC(C)(C)C)CCO2)cc1	767493473	PVSKJAQDWRNLBK-MRXNPFEDSA-N	435.477	1.325	50	20	IDGD	
C[C@@H]1CN(S(=O)(=O)c2ccc(C(=O)NNC(=S)Nc3ccccn3)cc2)C[C@@H](C)O1	768578225	DJWXEYZGXMPJMS-ZIAGYGMSSA-N	449.558	1.511	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)CCc1c(C)nc(SC)nc1O	768642097	YSURMJUMTWYQGS-UHFFFAOYSA-N	426.520	1.701	50	20	IDGD	
N#Cc1cc(Cl)nc(NNC(=O)c2cc(S(N)(=O)=O)c(Br)s2)c1	768704585	VLCZAVCRMMHLCS-UHFFFAOYSA-N	436.700	1.835	50	20	IDGD	
CSCCNC(=S)NNC(=O)[C@H]1CC(=O)N(Cc2cccc(C(F)(F)F)c2)C1	769778867	PEMIJEWKPIBHIT-LBPRGKRZSA-N	434.509	1.912	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NCC(=O)NNc2c(F)cccc2Cl)c1	770299579	KYHLBXCMTLWPPH-UHFFFAOYSA-N	428.873	1.603	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)[C@@H]3CCCN(C(=O)CCOc4ccccc4)C3)nc21	770973290	CIWVVLKJJYDRNJ-CQSZACIVSA-N	439.476	1.220	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1cn(CCC#N)nc1-c1ccc([N+](=O)[O-])cc1	772051048	AMGNKMGKFMFHDU-LBPRGKRZSA-N	428.405	1.475	50	20	IDGD	
CNC(=O)COc1cccc(CC(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)c1	772476520	KUORCVWCGQNFAJ-UHFFFAOYSA-N	432.427	1.668	50	20	IDGD	
C[C@@H]1CN(c2ccnc(C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)c2)C[C@@H](C)O1	772486189	GIBVEIMJOSGZKS-HUUCEWRRSA-N	435.525	1.761	50	20	IDGD	
CCNS(=O)(=O)c1ccc(CC(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)cc1	772955215	RXMSZWKMKOAKOG-ZDUSSCGKSA-N	439.921	1.796	50	20	IDGD	
Cn1c(=O)n(C)c2nc(NC(=O)CCC(=O)NNc3ccc(C(F)(F)F)cn3)ccc21	775264718	LCXBVCPNKLOUSR-UHFFFAOYSA-N	437.382	1.548	50	20	IDGD	
CC[C@@H](C)Oc1cc(CNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)ccn1	776909723	XMRJSUJLVULDEV-OAHLLOKOSA-N	427.509	1.796	50	20	IDGD	
O=C(c1cnn(-c2ccc(Cl)cc2)c1)N1CCN(S(=O)(=O)CBr)CC1	777777879	RFVYFSMUPDEQBL-UHFFFAOYSA-N	447.742	1.966	50	20	IDGD	
CC[C@@H](C)n1nc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1C	777882025	WCQPBIWOUVSLRI-CQSZACIVSA-N	449.533	1.258	50	20	IDGD	
CN1C(=O)C[C@@H](C(=O)NNC(=O)CCNC(=O)OC(C)(C)C)[C@H]1c1cccc(Cl)c1	780974471	XZNUGIATPLTZPX-RHSMWYFYSA-N	438.912	1.922	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2c(C)csc2C(=O)OC)cc1	782120215	HOCGQVDVJNEQRW-LBPRGKRZSA-N	449.485	1.795	50	20	IDGD	
Cc1ccc([C@@H](CN2CCOCC2)NCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1	782350219	WPHVFNITJDGBDO-HXUWFJFHSA-N	441.488	1.327	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C(=O)Nc2ccc(Br)cc2)nc2ccccc21	782893429	IEHFRHSNKBUUGY-UHFFFAOYSA-N	430.262	1.664	50	20	IDGD	
Cc1ccccc1NC(=O)NNC(=O)C(=O)Nc1ccc(C)c(N2CCCS2(=O)=O)c1	783417623	XIJIGFKKPJGOPB-UHFFFAOYSA-N	445.501	1.635	50	20	IDGD	
Cc1nc(-c2ccc(NC(=O)C(=O)NNC(=O)CNC(=O)c3cccs3)cc2)cs1	784004313	VZSKAEBYAJUUDT-UHFFFAOYSA-N	443.510	1.696	50	20	IDGD	
O=C(NNc1ccc(Cl)nc1)C(=O)Nc1ccc(N2CCN(C(=O)C3CC3)CC2)nc1	784874095	CKZMWFOGUSVOCN-UHFFFAOYSA-N	443.895	1.270	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)Nc1cccc(OC[C@@H]2CCCO2)c1	785021799	CPAJGTVKANKORY-HNNXBMFYSA-N	444.400	1.258	50	20	IDGD	
CCc1cc(Br)ccc1NNC(=O)C(=O)Nc1cccc(S(N)(=O)=O)c1	785098750	DTNZEBGMDCOETK-UHFFFAOYSA-N	441.307	1.741	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)cc1	785102196	FAZXMECQBLIZGP-UHFFFAOYSA-N	432.383	1.725	50	20	IDGD	
Cc1ccc(-n2cc(NC(=O)C(=O)NNc3cccc(S(C)(=O)=O)c3)cn2)c(C)c1	786411595	MPYGNRLBPUZDSM-UHFFFAOYSA-N	427.486	1.974	50	20	IDGD	
O=C(NCc1nc(-c2cccc(F)c2)no1)NNC(=O)C1CCN(c2ncccn2)CC1	787404143	NCQOUPPHOXVXMC-UHFFFAOYSA-N	440.439	1.413	50	20	IDGD	
COC[C@@H](C)Oc1ccc(Cl)cc1NC(=O)C(=O)NNc1ccc(-n2cccn2)nn1	787897823	CIDNRTGNWSBAPN-GFCCVEGCSA-N	445.867	1.811	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)C(C)(C)N2CCOCC2)c2ccccc2c1=O	788265548	NHCZDTPCVFYIDN-UHFFFAOYSA-N	429.521	1.459	50	20	IDGD	
CCOC1CC(CCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(CC)CC)c2)C1	788865667	ZBBKZZATFJNHKA-UHFFFAOYSA-N	440.566	1.866	50	20	IDGD	
Cc1cc(S(=O)(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)ccc1F	788917748	UWHVXWBMIMVAQZ-UHFFFAOYSA-N	430.502	1.932	50	20	IDGD	
COc1nc(Br)ccc1NC(=O)C(=O)NNC(=O)COc1ccc(F)cc1	789585022	VMKSOIKPVDBBAJ-UHFFFAOYSA-N	441.213	1.157	50	20	IDGD	
CC(=O)N1CCc2ccc(S(=O)(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)cc2CC1	790049956	LRMWPWJBHZGMHI-UHFFFAOYSA-N	432.458	1.165	50	20	IDGD	
C[C@@H](C(=O)NNc1nc2ccccn2n1)N1C(=O)c2ccc(Br)cc2C1=O	791243793	RJMOPEWUOWBEJA-VIFPVBQESA-N	429.234	1.620	50	20	IDGD	
CNC(=O)c1cc2cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc3ccccc3F)ccc2[nH]1	792352761	JIWIYTZIRQFLCZ-LLVKDONJSA-N	441.419	1.220	50	20	IDGD	
C[C@](O)(Cn1cc(C(F)(F)F)ccc1=O)C(=O)NNc1ccc(Br)nc1	792643739	SXZPSCOELXHAHS-AWEZNQCLSA-N	435.200	1.919	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNC(=O)COc2ccc(C)cc2)c(F)cc1C	793021579	FOVVYQSGOITNRQ-UHFFFAOYSA-N	431.420	1.784	50	20	IDGD	
CCOC(=O)c1cc(COC)cc(S(=O)(=O)NNC(=O)c2c(C)nc3ccccn23)c1	793350928	SKAOCKMOKFRYNU-UHFFFAOYSA-N	446.485	1.589	50	20	IDGD	
CCOC(=O)c1cc(COC)cc(S(=O)(=O)NNC(=O)CCc2ccccc2O)c1	793392310	HUJYOKQNCLTLJD-UHFFFAOYSA-N	436.486	1.658	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2I)n1	794077496	QDZAOLOKZWFJEF-UHFFFAOYSA-N	426.170	1.978	50	20	IDGD	
CCc1ccccc1OCC(=O)NNS(=O)(=O)c1ccccc1S(=O)(=O)C(F)F	794577876	AGAQQNPECFCNQS-UHFFFAOYSA-N	448.469	1.634	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc(Cl)ccc1C(F)(F)F)N[C@@H]1CCS(=O)(=O)C1	795303697	RPDWZHKXXBBQLP-MRVPVSSYSA-N	435.833	1.038	50	20	IDGD	
Cc1ccc(CN(C)C)cc1NC(=O)C(=O)NNC(=O)CNC(=O)OCc1ccccc1	797368474	BGVPTMSAMRTGIS-UHFFFAOYSA-N	441.488	1.069	50	20	IDGD	
C[S@](=O)c1ccc(CC(=O)NNC(=O)COc2ccc(Br)cc2)cc1	797789761	NTEIZPWRJXTFOL-VWLOTQADSA-N	425.304	1.955	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)[C@H]2CCCN2C(=O)c2ccc(OC)cc2)cc1	799098730	XGVJFNROMKZPSO-LJQANCHMSA-N	426.473	1.568	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)Nc1ccc(OCC(F)(F)F)c(Cl)c1	800570202	HFFNOSCVZCFPQM-QMMMGPOBSA-N	429.804	1.869	50	20	IDGD	
CNC(=O)CNC(=O)c1cccc(NC(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)c1	800596377	XIWVYQBBKPVAID-HNNXBMFYSA-N	441.488	1.399	50	20	IDGD	
CC(C)NS(=O)(=O)c1cc(C(=O)NNC(=O)Nc2ccc3c(c2)OCO3)ccc1F	802102248	JDJQVZQWZPBFFZ-UHFFFAOYSA-N	438.437	1.708	50	20	IDGD	
Cc1nc(C(F)(F)F)ccc1NC(=O)C(=O)NNC(=O)COc1ccccc1[N+](=O)[O-]	802566394	MYTLXKXRWYBHBK-UHFFFAOYSA-N	441.322	1.482	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)Cc2ccc(C(=O)NNC(=O)[C@](C)(O)C3CC3)cc2)cc1	804148094	VVZWQYFRPQSPAI-JOCHJYFZSA-N	445.541	1.738	50	20	IDGD	
COc1ccc(-n2c(C)nnc2SCC(=O)NNc2ccc(-n3ccnc3)nn2)cc1	804954273	IPIWDXYBMMBDNT-UHFFFAOYSA-N	437.489	1.795	50	20	IDGD	
Cc1cc(Cl)ccc1S(=O)(=O)NCCNC(=O)NNC(=O)c1ccc(C#N)cc1	805026825	CEWXPYDJRNBCMZ-UHFFFAOYSA-N	435.893	1.443	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(CCCNC(=O)NNc2ccc(-n3ccnc3)nn2)CC1	805180196	GHKBIVMAVMUHOW-UHFFFAOYSA-N	445.528	1.231	50	20	IDGD	
C[C@@H](C#N)S(=O)(=O)c1ccc(NC(=O)NNC(=O)c2nnc(O)c3ccccc23)cc1	806456670	SQYWTPODRLYABO-NSHDSACASA-N	440.441	1.488	50	20	IDGD	
CCOc1ccc(NC(=S)NNC(=O)[C@H](Cc2cnc[nH]2)NC(=O)CC(C)C)cc1	810022415	LWOLRFRFWSBGFL-KRWDZBQOSA-N	432.550	1.900	50	20	IDGD	
NC(=O)c1ccc(OCC(F)F)c(NC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1	810342958	LSLUTAAFVXRZGG-HNNXBMFYSA-N	436.371	1.422	50	20	IDGD	
Cc1cccc2c1OC[C@@H](NC(=O)NNC(=O)c1sc(N3CCOCC3)nc1C)C2	812641796	PLGAJAISOJLRPR-HNNXBMFYSA-N	431.518	1.544	50	20	IDGD	
CCNC(=O)N(C)NC(=O)C(=O)Nc1ccc2c(c1)CN(C(=O)OC(C)(C)C)CCO2	812987466	PHZQUENPYWZCQF-UHFFFAOYSA-N	435.481	1.447	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(Br)c(C#N)c2)cc1	815565739	YEGKKJLDNHIWAD-UHFFFAOYSA-N	447.245	1.494	50	20	IDGD	
CNC(=O)Oc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(OC(C)C)c(OC)c2)c1	815567026	MKCGMYANKCWBKF-UHFFFAOYSA-N	444.444	1.600	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)Cn2ccc3ccccc3c2=O)C1	816510421	VYDPDVMVXSUUBI-INIZCTEOSA-N	428.489	1.796	50	20	IDGD	
CN(C)N(C(=O)c1ccn(-c2ccc(Br)cc2)n1)[C@@H]1CCS(=O)(=O)C1	816776956	MOHYEPHWEGGEAO-CQSZACIVSA-N	427.324	1.741	50	20	IDGD	
C[C@@H]1CCCN(S(=O)(=O)c2ccc(C(=O)NNC(=O)CNc3ccccc3)cc2)C1	823327722	BSZRRLWSMYANLF-MRXNPFEDSA-N	430.530	1.980	50	20	IDGD	
CNS(=O)(=O)Cc1ccc(CNC(=O)NNC(=O)c2ccc(Cl)cc2OC)cc1	838491520	QQTIKIYNFUSGDS-UHFFFAOYSA-N	440.909	1.542	50	20	IDGD	
O=C(CN1CCCN(Cc2ccc(F)cc2)CC1)NNC(=O)c1ccc([N+](=O)[O-])cc1	841401669	JBIXBMBCXQCOJD-UHFFFAOYSA-N	429.452	1.703	50	20	IDGD	
Cn1nc(C(=O)NN=Cc2c(Cl)nc(N)nc2N2CCCC2)c2ccccc2c1=O	863965613	NIYYXCOLMIAWLW-UHFFFAOYSA-N	426.868	1.323	50	20	IDGD	
CSC[C@H](C(=O)NNC(=O)COc1cc(C)ccc1C)N1C(=O)[C@@H]2CCCC[C@H]2C1=O	864002814	QLMJSTMGQRHUML-BRWVUGGUSA-N	447.557	1.736	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)[C@H]2CS[C@@H](Cc3ccccc3F)C(=O)N2)c1	896299562	FQUDAGPMRYHZSX-MSOLQXFVSA-N	430.505	1.496	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCCc2nnc3n2CCCCC3)ccc1OC(C)C	914534878	QGESPFXUKYQAJY-UHFFFAOYSA-N	430.509	1.987	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cnn1Cc1ccccc1	915635689	JMWBYHBKMVJCPZ-UHFFFAOYSA-N	441.513	1.565	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)NC[C@H](c2cccs2)N2CCOCC2)cc1C	915893248	HELWKEXIWQOUNH-QGZVFWFLSA-N	445.545	1.707	50	20	IDGD	
O=C(NCCCN1CCCC1)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	916196044	LAJBQBUUMKWTFY-UHFFFAOYSA-N	448.527	1.875	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NCc2ccc(C(=O)N3CCN(C)CC3)cc2)cc1	916389969	FRRHJNPELFYLAE-UHFFFAOYSA-N	439.516	1.292	50	20	IDGD	
C[C@H]1CCCN([C@@H](C)CNC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)C1	916450120	CMTUHGPQBWQBFU-PMACEKPBSA-N	430.597	1.650	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)[C@H]1COc2ccccc2O1)N1CCN(c2ccccc2)CC1	916514602	HLMGLASXGBZXHA-LAUBAEHRSA-N	439.516	1.368	50	20	IDGD	
Nc1cc(C(F)(F)F)ccc1C(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	916540339	OOXIGASAWMGNDB-UHFFFAOYSA-N	426.307	1.814	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(CCCNC(=O)NNC(=O)Cc2ccc(F)cc2)CC1	916640993	RJDQXSYSIPITNT-UHFFFAOYSA-N	437.516	1.641	50	20	IDGD	
O=C(CCc1nc(O)c2cnn(-c3ccccc3)c2n1)NNC(=O)c1ccc(Cl)nc1	917250744	HMOUKUJBMSGXIS-UHFFFAOYSA-N	437.847	1.963	50	20	IDGD	
CCCC(=O)N1CCCC[C@H]1C(=O)NNC(=O)c1nn(CCC)c(=O)c2ccccc12	918146086	NKXJYMYPJMBLFG-KRWDZBQOSA-N	427.505	1.749	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCc2cccc(CN3CCOCC3)c2)cc1OC	918223039	CNJSTCXFYUPQDA-UHFFFAOYSA-N	428.489	1.680	50	20	IDGD	
Cn1c(=O)c2cc(C(=O)NNc3ccc(C(F)(F)F)cc3[N+](=O)[O-])n(C)c2n(C)c1=O	919744263	WHZVFDZCYOSFBH-UHFFFAOYSA-N	440.338	1.260	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc([N+](=O)[O-])c1	920841121	HNONLABZIRIDGB-UHFFFAOYSA-N	432.458	1.763	50	20	IDGD	
CCN(CC)[C@@H](CNC(=O)NNC(=O)C(=O)NC1CC1)c1ccc(C(F)(F)F)cc1	920919410	NUNAFYNBLAXUKA-HNNXBMFYSA-N	429.443	1.697	50	20	IDGD	
Cn1ncc2cc(S(=O)(=O)NNC(=O)c3ccc(F)cc3Br)cnc21	1116683205	SNROCYXAVRPBNU-UHFFFAOYSA-N	428.243	1.493	50	20	IDGD	
O=C(NNC(=O)c1n[nH]c2c1CCCC2)Nc1ccc(CN2C(=O)CSC2=O)cc1	1254713385	FVOIKAPQJFSKEK-UHFFFAOYSA-N	428.474	1.950	50	20	IDGD	
CC(C)Cn1cnc(S(=O)(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)c1	1339965513	VOQYEZDTFYEVQK-UHFFFAOYSA-N	429.543	1.496	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc4n(n3)CCCC4)C2)C1	1778557795	SKMZHCQGEXUODZ-AUUYWEPGSA-N	439.354	1.694	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4scnc4c3)C2)C1	1778643270	FYVUSZNMDIPJJJ-OAQYLSRUSA-N	445.545	1.113	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@]2(C)C[C@@H]2C)C1	1780617924	ITJATANZIUIZHB-WZTJLKLKSA-N	443.548	1.680	50	20	IDGD	
Cc1nccc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](F)Br)C2)n1	1780773754	VUAJBMJMWIZEEA-JKIFEVAISA-N	429.290	1.603	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(C)n3ccnc3n2)C1	1781311965	FOQHWNTXSAAGEM-QLVMHMETSA-N	449.939	1.419	50	20	IDGD	
Cn1ncc2c(C(=O)N3CCO[C@]4(CCN(C(=O)[C@H](F)Br)C4)C3)cccc21	1781329485	GNHPBRLZKADJMR-YJBOKZPZSA-N	439.285	1.707	50	20	IDGD	
O=C(c1cccc(C(F)(F)F)c1F)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1781624021	HUCWGAOJYBXDPE-GUYCJALGSA-N	438.805	1.888	50	20	IDGD	
Cc1nnc(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](C)Br)C2)o1	1781998117	OEEIONAODINDRI-XTQGRXLLSA-N	429.315	1.218	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C=C/c1cnc[nH]1)C2	1782001234	BXUFNVGCYCGNJH-XCACBCFESA-N	425.327	1.720	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc3cccnn3c1)C2	1782178593	LWZMVBNJVSECQF-DBXWQHBBSA-N	434.924	1.716	50	20	IDGD	
O=C(c1nc2ccccc2o1)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1782235174	ACKBDZVGABJFKA-SUMWQHHRSA-N	426.242	1.962	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H]2CC[C@H](O)CC2)C1	1782325400	XRJUGHUCTHZTEQ-NEYJZJCJSA-N	426.630	1.903	50	20	IDGD	
C[C@H](C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Br)C2)n1cncn1	1782532329	XLAWEKCGZIHHCZ-NFFDBFGFSA-N	432.294	1.044	50	20	IDGD	
CCCCCc1ncc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)s1	1782712435	HWNKSTUHSLGJCR-LIRRHRJNSA-N	429.970	1.919	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)/C=N/N3CCCCC3)CCO2)C1	1783348828	BIVHKBHUGLQLKO-UDBLOYCBSA-N	429.359	1.462	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccnc4c3OCO4)CCO2)C1	1783352809	SWTVTKBNCNJVTJ-ACJLOTCBSA-N	440.294	1.427	50	20	IDGD	
C[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](C)Br)C2)C1	1783529212	SUNDHWYKVVKZTL-VBHSOAQHSA-N	448.358	1.513	50	20	IDGD	
Cc1nc2sccn2c1C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](C)Br)C2)C1	1783534538	VXUTYBRKLOIASY-DIFFPNOSSA-N	441.351	1.931	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccnc4ncccc34)CCO2)C1	1783535484	DNSMMHWTZQMMCU-YJYMSZOUSA-N	433.306	1.857	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@H](C(=O)N2CC[C@]3(CN(C(=O)CCBr)CCO3)C2)C1	1783856279	IQJFKUIPNWQSDF-KHYOSLBOSA-N	445.354	1.581	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CC[C@H](O)CC3)C[C@@H]21	1783974138	JIXDRLVPVDCRGY-JHMPBIJASA-N	431.371	1.548	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H]3CCc4nc[nH]c4C3)C2)C1	1784353703	ZHIKGMDBRVYURB-VEVIJQCQSA-N	425.327	1.128	50	20	IDGD	
Cc1nn(C)c(C)c1CC(=O)N1CC[C@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2	1784512601	LGZDZKMHEBNIJS-MOPGFXCFSA-N	431.364	1.646	50	20	IDGD	
COc1cnc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]32)cn1	1786243151	QWJLYYULOBUGTR-MMNXLFCMSA-N	431.320	1.315	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc4c(s3)CCC4)[C@H]2C1	1786252111	MPEFGCIKSLZFJB-ULQDDVLXSA-N	448.589	1.203	50	20	IDGD	
CCCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C[C@@H]21	1786442137	DPQKUMXEYZPUSN-UFYCRDLUSA-N	445.564	1.112	50	20	IDGD	
Cc1nnc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Br)C[C@@H]32)s1	1787057628	FSSRFLQTMHFEGS-RMIALFOJSA-N	435.319	1.059	50	20	IDGD	
CCn1nc(C)cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21	1787287972	AWUNEEFLOALJPT-DZKIICNBSA-N	427.343	1.590	50	20	IDGD	
CN1CCC(CC(=O)NC2(c3ccc(NC(=O)c4cccc(B(O)O)c4)cc3)CCC2)CC1	1788145415	PDVNVEIEFAKQER-UHFFFAOYSA-N	449.360	1.846	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cncc(F)c3)C[C@@H]21	1790961175	KVHRXPNUBCSMSX-DDWPSWQVSA-N	428.302	1.988	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](C)Br)[C@H]3C2)nc1	1791057111	CJQWGHMGFPOKLH-DUPGQFARSA-N	426.311	1.467	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)nc(Cl)c3)C[C@@H]21	1791252218	DRGALXUDSCVUAD-PYJNHQTQSA-N	432.304	1.288	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CSc3nc[nH]n3)[C@H]2C1	1791558716	DTPMYOFRWWSNPB-CYDGBPFRSA-N	446.371	1.050	50	20	IDGD	
COC[C@H](Cl)C(=O)NC1(c2ccc(NC(=O)C[C@](C)(O)CC(=O)O)cc2)CCC1	1791596638	UBSKPFCPSVFBFN-KXBFYZLASA-N	426.897	1.990	50	20	IDGD	
CCN1CCC(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Br)C[C@@H]32)CC1	1792296238	QAPDRVZTRCMZAG-YHUYYLMFSA-N	434.350	1.389	50	20	IDGD	
N#Cc1ccc(CCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)cc1	1792479919	MPBUWYLSZYRNAM-KOUNCHBCSA-N	431.301	1.123	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(C)nn1CC	1796136206	CDOIRMXUDGHDHB-HLPPOEQASA-N	427.343	1.588	50	20	IDGD	
COc1cc(F)c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)c(F)c1	1796191725	RWJWPGWGDDCRNK-MUJYYYPQSA-N	444.243	1.219	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1Cc3[nH]nc(C(F)(F)F)c3C1)C2)[C@H](F)Cl	1796370402	JENPTRNQESIVCC-ZPOVSZSPSA-N	438.809	1.267	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2nccnc2c1	1797057426	ZJJIGRVJKHZBJS-DPYKFYPSSA-N	433.306	1.616	50	20	IDGD	
Cn1ncc2c(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)CO[Si](C)(C)C)C4)cccc21	1797090117	TVTZTPWXXQPSFW-YVWYUNDQSA-N	430.581	1.628	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(=O)nc2sccn12)[C@@H](F)Br	1799096383	URHJEVSGSGWEQQ-BSTOTGJRSA-N	443.298	1.698	50	20	IDGD	
CN(CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1C[C@H]1F)NC(=O)NCc1ccccc1	1799960299	ZWGPAPRTHSGYQJ-XCDZQEORSA-N	431.512	1.329	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2)c1cn2c(F)cccc2n1	1799997943	CICWQAPMSMLCAV-DPIQGUFMSA-N	439.285	1.462	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc(Cl)c(F)c1)C2	1800970572	GKEVBVPBJKAABN-ZFHGCVPZSA-N	433.307	1.865	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCOc1ccc(F)cc1)C2	1800974294	URUKFNSCEOSMBP-QOIYZWAUSA-N	428.888	1.438	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nc(C)oc1C(F)(F)F)C2	1800975205	LLRLPPWTHKANJA-USZNOCQGSA-N	439.818	1.459	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1=NO[C@H](c3ccccc3)C1)C2	1800978029	JUQKLBQDMKMHLQ-MGGVOPSTSA-N	435.908	1.347	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CC1(O)CCC1	1801588012	ZQQAEZFDZXGQMF-RNCDSHHQSA-N	445.466	1.766	50	20	IDGD	
COC(=O)C[C@H](NC(=O)OC(C)(C)C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](F)Cl)C2	1802020364	DCTSQXFLPXCEEP-KBRXKUPHSA-N	449.907	1.615	50	20	IDGD	
O=C(Cc1cc(F)ccc1[N+](=O)[O-])N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2	1802094389	AHRBERNYTBHHKX-QHBPRCKVSA-N	434.251	1.670	50	20	IDGD	
C=CCNC(=O)/C=C\C(=O)NC[C@@H]1CCN(C(=O)[C@H](C)Br)[C@@H]1c1cccnc1	1802491244	XKRAUDMQUUHFQT-HYXRZBIWSA-N	449.349	1.729	50	20	IDGD	
C[C@H](NNc1ccccc1)C(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1	1802508318	AULDKWNGZADJQF-UUXHPUJUSA-N	445.951	1.692	50	20	IDGD	
O=C(CCC(=O)N1CCCC1)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1	1804144687	BGZAOWHRUZNPKW-ZWOKBUDYSA-N	436.940	1.090	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@H](CNC(=O)c2cccc(=O)n2O)[C@@H]1c1cccnc1	1804949042	DRVXCNXHURBEBX-JXFKEZNVSA-N	444.564	1.652	50	20	IDGD	
CN(C)c1ccc(C(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@H]2c2cccnc2)nc1	1805090557	HMSCZXGIYRTYEQ-IPELMVKDSA-N	431.924	1.462	50	20	IDGD	
C[C@H]1Oc2ccc(C(=O)N3CCC4(CCCN(C(=O)[C@@H](O)CCl)C4)CC3)cc2NC1=O	1805525579	ZUGGQGICXMGRIY-PBHICJAKSA-N	449.935	1.851	50	20	IDGD	
Cc1ccncc1CCC(=O)N1CCCC2(CCN(C(=O)CCC(=O)NN(C)C)CC2)C1	1807078851	NABQTIDDTOMGOX-UHFFFAOYSA-N	443.592	1.927	50	20	IDGD	
N[C@H](CC(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)c1cccnc1	1807260433	OPHPYCQBEJUZQP-DMUMMCEESA-N	431.924	1.172	50	20	IDGD	
O=C(COc1ccccc1)N1CCCC2(CCN(C(=O)c3cccc(B(O)O)c3)CC2)C1	1809179031	WTZAAVDJROXMGC-UHFFFAOYSA-N	436.317	1.290	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)C(Cl)Cl)[C@@H]1c1cccnc1)c1n[nH]cc1[N+](=O)[O-]	1810638995	TVTYQVHNWAAMNU-ZWNOBZJWSA-N	427.248	1.836	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1	1814060905	YUPBWKZIXCQSPK-WFXMLNOXSA-N	442.903	1.638	50	20	IDGD	
O=C(/C=C/C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](O)CCl)n[nH]1)NCc1ccco1	1814874199	YVBYFEWAUPPWCA-MIVXPEEVSA-N	449.895	1.467	50	20	IDGD	
N[C@H](C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](F)Br)CC2)c1ccccn1	1815018458	DTKXYEMKICTJQI-OXHMUOHRSA-N	442.314	1.841	50	20	IDGD	
O=C(CCC(F)(F)F)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1	1815354927	XMRYLFVEBCTLRB-GFCCVEGCSA-N	441.240	1.391	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)CSc3ncccn3)sc2C1	1815635972	ZUKWDBPFEWJSSR-MNOVXSKESA-N	441.966	1.891	50	20	IDGD	
O=C(CCc1ccccn1)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1816007210	AMMWFSGYJALYQE-HXUWFJFHSA-N	447.304	1.423	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccnc(F)c2)[nH]n1)c1cccc(B(O)O)c1	1817474130	NBEWDFUHMRFNQC-KRWDZBQOSA-N	437.240	1.243	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)/C=C\C(=O)NC3CC3)sc2C1	1819532980	YANIYELWJPVLNH-FCMDYUIFSA-N	441.351	1.673	50	20	IDGD	
Nc1n[nH]c(CCC(=O)Nc2nc3c(s2)C[C@H](NC(=O)CCBr)CC3)n1	1819553792	PGDLQHWEGRWHAM-MRVPVSSYSA-N	442.343	1.173	50	20	IDGD	
CC(C)/C=C/C(=O)N[C@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1	1819801867	URCWAZRJGHAUGD-UXONFWTHSA-N	428.518	1.580	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCc1cnn(C)c1)CC2	1825999929	YBNXDKXDTODGOD-QWHCGFSZSA-N	425.942	1.675	50	20	IDGD	
O=C(Cn1cc([N+](=O)[O-])cn1)N[C@H]1CCc2nc(NC(=O)C(Cl)Cl)sc2C1	1826093244	JRKHHUOHJYBAPY-ZETCQYMHSA-N	433.277	1.664	50	20	IDGD	
CCOCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)CC1	1826455243	ZIMWQFUEGXFXGX-GXDFBKAQSA-N	431.537	1.777	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@H]2CCCO2)CC1	1827679437	CHFAFVSRPFPMKC-UXIDLFCBSA-N	443.548	1.919	50	20	IDGD	
C[C@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1)N1C[C@H]2C[C@H]2C1	1828817195	NSFWHWJXYLTAEN-PBASOCQRSA-N	447.624	1.319	50	20	IDGD	
CN1CCC(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)CC1	1830353591	GGWITWJXSFBYEY-OAQYLSRUSA-N	429.989	1.440	50	20	IDGD	
COCc1c[nH]c(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)c1	1830364737	SBMOGBVYOBUSKE-FQEVSTJZSA-N	427.929	1.496	50	20	IDGD	
C[C@H](Sc1cccs1)C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1	1830730550	BFQYKAPLEBLJOX-PMUMKWKESA-N	448.994	1.285	50	20	IDGD	
CN1CCCC[C@@H]1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1	1830760768	OTYCXUOYVHFNDX-AYOQOUSVSA-N	436.380	1.163	50	20	IDGD	
CC(C)(C)OC(=O)CCCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1830800420	FBSWRXHXOUHFSP-QFBILLFUSA-N	436.908	1.489	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(OC)cn3)C2)C1	1831647596	XYXYFOPSDMPCPG-JXFKEZNVSA-N	425.913	1.568	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)Nc3ccccn3)C2)C1	1831650813	LGMQEMDDNOIQEL-WWMYMODYSA-N	438.956	1.746	50	20	IDGD	
Cc1ccn(C)c1C(=O)N1CCC([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1	1831874588	SGBXBZKUDJJJPP-LJQANCHMSA-N	431.581	1.940	50	20	IDGD	
Cc1nc(CC(=O)NC2CCN(C3CCN(C(=O)[C@H](C)Br)CC3)CC2)no1	1833812180	PVBILLVQTZZJRE-LBPRGKRZSA-N	442.358	1.276	50	20	IDGD	
Cc1nn[nH]c1C(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)CBr)CC2)CC1	1834931878	XGBYHNFJFILNFY-LBPRGKRZSA-N	441.374	1.329	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccccn3)CCO2)C1	1836190781	GVDQOMGPLWSYKI-APWZRJJASA-N	440.338	1.254	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)c3cc4ncccn4n3)CC2)CC1	1836397126	RZFLFSSRZYBGPX-QGZVFWFLSA-N	432.956	1.932	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](F)Br)CC2)CC1	1836414419	JUBCAFLINTZCOP-ZIAGYGMSSA-N	442.757	1.502	50	20	IDGD	
NC[C@@H](C(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)c1ccccc1	1836716819	SDEORZQUISNMJN-UXHICEINSA-N	437.968	1.327	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CS[C@@H]3CCCCO3)CCO2)C1	1837507350	BNHAGDPHBBBPAR-KVSKMBFKSA-N	434.986	1.720	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)n1ccccc1=O)CCO2	1837681996	LJMGEQRNBUKDJD-WWMYMODYSA-N	439.940	1.273	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(Cl)ccn3)CCO2)C1	1837867291	MODPYHALGCVXML-PXAZEXFGSA-N	446.729	1.588	50	20	IDGD	
O=C(c1cccnn1)N1CCC(OC2CCN(C(=O)[C@H](F)Br)CC2)CC1	1838452685	BAVCFAJMIDNWKX-HNNXBMFYSA-N	429.290	1.779	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(C#N)c[nH]3)CCO2)C1	1838740184	HCUHCWBXOHXPJF-KBXCAEBGSA-N	439.310	1.130	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3nnc(-c4ccccc4)o3)C2)C1	1839146231	WVERXWSYUABJNF-IERDGZPVSA-N	448.907	1.824	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCNC(=O)OC(C)(C)C)C2)C1	1839149517	JMSNJLLEJGDHAA-FOIQADDNSA-N	447.960	1.375	50	20	IDGD	
Cc1ccc(O)c(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)c1	1839201681	FUVPXCJTCVWBHX-YJBOKZPZSA-N	445.285	1.461	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(C)c(Cl)c3)C2)C1	1840149653	WNIQEJWGCNMCFY-XLIONFOSSA-N	445.343	1.972	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)C(C)(F)F)C2)C1	1840150061	FBMNUVQMQRTGRP-ACJLOTCBSA-N	426.888	1.378	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(C)c3Cl)C2)C1	1840156155	JKHYPHOVJWXITO-OXQOHEQNSA-N	445.343	1.972	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CC[C@H]3CCOC3)CCO2)C1	1840590560	SKVRSCPSGBAKAX-RLFYNMQTSA-N	433.343	1.043	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC12CN(C(=O)c1ccc(S(C)(=O)=O)cn1)C2	1841286237	QQQOAQVLPICIGF-LBPRGKRZSA-N	444.351	1.333	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)C[C@H](O)CNC(=O)OC(C)(C)C)C2	1841669868	XZZYRYFWWFMLPR-LSDHHAIUSA-N	431.961	1.873	50	20	IDGD	
CC(=O)N1CCC(N2CCC(C(=O)N3CCCC34CN(C(=O)[C@H](F)Cl)C4)CC2)CC1	1843951928	FVABDGUXLGCVDC-SFHVURJKSA-N	442.963	1.447	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1cc(Cl)ccc1F)C2	1844263268	LDBCNDIFAVYBSB-UHFFFAOYSA-N	431.855	1.608	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2cc(O)ccc2F)C1	1845337701	SXBHIHQMZGRWGP-ZMOGYAJESA-N	427.436	1.482	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC12CN(C(=O)CNC(=O)c1cccs1)C2	1846069239	PYWOJYMYXDOAIV-LBPRGKRZSA-N	428.352	1.855	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC12CN(C(=O)c1ccc(N3C(=O)C=CC3=O)cc1)C2	1846179935	FEKNGDHYDFRDCN-ZDUSSCGKSA-N	446.301	1.716	50	20	IDGD	
CCc1c(Br)c(C(=O)N2CC3(CCCN3C(=O)[C@H](Cl)COC)C2)nn1C	1846361574	BMUYQOSBZVBVAP-LLVKDONJSA-N	447.761	1.816	50	20	IDGD	
C[C@H]1CC[C@@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](O)CCl)CN1C(=O)OC(C)(C)C	1847568979	RXAUFWLATLPNLU-BQJWPVKWSA-N	443.972	1.824	50	20	IDGD	
O=C(COC(=O)CCNC(=O)NC12CC3CC(CC(C3)C1)C2)NNC(=O)c1ccccc1	11439633	QBEHTZCOYFCDNX-UHFFFAOYSA-N	442.516	1.649	50	20	IDGD	
Cc1nnc(NNC(=O)Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)[nH]c1=O	11548375	XNZRPDFTQKTGJM-UHFFFAOYSA-N	446.427	1.920	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCCC3)cc2)c1	15667967	UAFUUIJRJDAKMZ-UHFFFAOYSA-N	445.541	1.939	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)[C@H]2CC(=O)N(Cc3ccccc3)C2)c2ccccc2c1=O	15945827	AONJUQCZOMNFBW-KRWDZBQOSA-N	447.495	1.787	50	20	IDGD	
O=C(/C=C/c1cccs1)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	25166761	ROMQSWCCKOQQKG-UXBLZVDNSA-N	449.554	1.562	50	20	IDGD	
CCCc1nnc(S)n1CC(=O)NNC(=O)c1ccc(CSc2nncn2C)cc1	25444672	GMRLNARYTKNFFK-UHFFFAOYSA-N	446.562	1.401	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)N1CCC(NC(=O)c2ccsc2)CC1	725872120	AWGQSFGIKQHFNY-UHFFFAOYSA-N	435.531	1.175	50	20	IDGD	
CC(C)C(=O)NNC(=O)c1cc(S(=O)(=O)N2CCOCC2)ccc1N1CCCCC1	726098052	UXMBKHLNNIANQK-UHFFFAOYSA-N	438.550	1.115	50	20	IDGD	
CN(C)N(C(=O)Cn1cnc2sc(-c3ccccc3)cc2c1=O)[C@H]1CCS(=O)(=O)C1	728177618	FZRDVKVNCKTOBF-HNNXBMFYSA-N	446.554	1.617	50	20	IDGD	
O=C(CN1C(=O)[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)NNC(=O)c1cc(F)ccc1Br	728549695	NUYRPLJLMSIYEP-WDQYXFPCSA-N	436.237	1.156	50	20	IDGD	
CN(CCCNC(=S)NNC(=O)C1CCN(c2ncccn2)CC1)c1ccccc1	728796591	IGENKAJQGJTVLE-UHFFFAOYSA-N	427.578	1.715	50	20	IDGD	
CC[C@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	728889515	BETXLGAZASKXBO-HOCLYGCPSA-N	434.541	1.780	50	20	IDGD	
CCCNC(=O)c1cccc(CNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1	728946776	CBTOFEFUDJMMHF-UHFFFAOYSA-N	439.520	1.363	50	20	IDGD	
CCOc1cc2c(cc1[C@@H]1C[C@H]1C(=O)NNC(=O)CNC(=O)c1ccco1)O[C@H](C)C2	730490083	WWDUXJAYYZWGRZ-IVMMDQJWSA-N	427.457	1.683	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)nc1	730769542	NIPNOGMNLUVNOF-UHFFFAOYSA-N	427.467	1.890	50	20	IDGD	
COc1cc(OC)c(CCNC(=O)NNC(=O)c2nnc(O)c3ccccc23)c(OC)c1	731119138	NUYGEFSAODZFOE-UHFFFAOYSA-N	441.444	1.548	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(F)cc2)C1	731328386	FUQWNSSJENSPFY-HNNXBMFYSA-N	437.468	1.756	50	20	IDGD	
CCc1c(C(=O)NNC(=O)CCN2C[C@H](C)O[C@@H](C)C2)nnn1-c1cccc(Cl)c1	732258996	JTJSIUIZYLTQOF-KBPBESRZSA-N	434.928	1.743	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)N[C@@H]1CCN(c2ccccc2F)C1=O	732892936	JUORAVBCUGISCM-OAHLLOKOSA-N	430.436	1.739	50	20	IDGD	
O=C(NNC(=O)N1CCN(CCOc2ccccc2)CC1)c1cnn(-c2ccccc2)c1	733351082	NHKQIERGGRKDCT-UHFFFAOYSA-N	434.500	1.923	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)NC1CCN(C[C@@H]2CCCO2)CC1	734283982	UYGRSQYYNIOFSM-KRWDZBQOSA-N	428.493	1.165	50	20	IDGD	
CN1C(=O)C[C@H](C(=O)NNC(=O)CNC(=O)c2cccs2)[C@@H]1c1cccc(Cl)c1	734391887	NRWDYSDHQVJDJN-GUYCJALGSA-N	434.905	1.498	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2ccc(C(F)F)cc2)CC1	735118323	RSPZQFZVHAGGPF-UHFFFAOYSA-N	425.461	1.712	50	20	IDGD	
Cc1cc(S(=O)(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)cnc1Cl	735265965	SACKAZIWHCIEON-UHFFFAOYSA-N	431.927	1.268	50	20	IDGD	
CC(C)[C@H](NS(=O)(=O)c1ccc2ccccc2c1)C(=O)NNC(=O)c1cnn(C)c1	735471030	JULSSJKILPMSOE-SFHVURJKSA-N	429.502	1.337	50	20	IDGD	
COc1ccc(C)cc1NC(=O)[C@H]1CCCN1CC(=O)NNC(=O)Cc1nc(C)cs1	735494288	AUNQOBDAGZVHKJ-MRXNPFEDSA-N	445.545	1.562	50	20	IDGD	
Cc1cc(CN2C(=O)c3ccccc3C2=O)cc(C(=O)NNC(=O)c2c[nH]nc2C)c1O	735516737	YRHUXAMUQBTROX-UHFFFAOYSA-N	433.424	1.603	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)[C@]2(O)CCN(Cc3ccccc3)C2)cc1OC	735836906	NPULAXSPBQUQEY-QHCPKHFHSA-N	427.501	1.882	50	20	IDGD	
CC(=O)N1CCCc2ccc(S(=O)(=O)NNC(=O)[C@@H]3COc4ccccc4O3)cc21	736064647	XDPYSYQQOPPRIB-IBGZPJMESA-N	431.470	1.135	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)NCCN1CCN(Cc2ccccc2)CC1	738456082	BRWMJLKEUQBFKZ-UHFFFAOYSA-N	425.533	1.351	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)[C@@H]1CC(=O)N(c2cccc(Br)c2)C1	740850156	WFIMDOCPZLKRQP-LLVKDONJSA-N	439.310	1.254	50	20	IDGD	
N#Cc1ccc(S(=O)(=O)NNC(=O)c2ccc(Br)s2)c([N+](=O)[O-])c1	741203291	DTECCYZMTJFCBE-UHFFFAOYSA-N	431.249	1.914	50	20	IDGD	
CN(CC(=O)NNC(=O)c1ccccc1)C[C@H](O)COc1ccccc1C(F)(F)F	741800019	SBQFUOWASKVZFU-HNNXBMFYSA-N	425.407	1.838	50	20	IDGD	
Cn1c(=O)c2cc(C(=O)NNc3c(F)cc(F)cc3Br)n(C)c2n(C)c1=O	742109407	OMPQVILHHUWQSY-UHFFFAOYSA-N	442.220	1.373	50	20	IDGD	
CCS(=O)(=O)c1ccc(Sc2ccccc2C(=O)NNC(=O)C(=O)NC(C)C)cc1	742487936	ABHGVCZUPIEMHA-UHFFFAOYSA-N	449.554	1.917	50	20	IDGD	
O=C(NNC(=O)c1cccc(Br)c1)NNC(=O)[C@H]1COc2ccccc2O1	743687737	PXJQPAZJMKOPRU-CQSZACIVSA-N	435.234	1.264	50	20	IDGD	
CN(C)Cc1cccc(NC(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)c1	744450100	LOOPOYKCLQYWJW-UHFFFAOYSA-N	433.534	1.918	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)CCC(=O)N2CCC(c3ccccc3)=N2)cc1	744459849	LMEKIXFADYTZMY-UHFFFAOYSA-N	447.451	1.279	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H]1CC(=O)OCC(=O)NNC(=O)c1ccc(C#N)cc1	745457651	HBHLKFYPBIRVLK-MRXNPFEDSA-N	430.461	1.652	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc(Br)cc(C(F)(F)F)c1)N1CCOCC1	746590714	DKKIVAAAMGWNOV-UHFFFAOYSA-N	432.218	1.703	50	20	IDGD	
O=C(CCOc1ccccc1)NNC(=O)NCCCN1C(=O)NC2(CCCCC2)C1=O	747105023	VYZGJZUZXOYJIW-UHFFFAOYSA-N	431.493	1.431	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cc(F)cc(Cl)c2O)cc1OC	748475401	NBSGGGVHUSWDGA-UHFFFAOYSA-N	426.784	1.820	50	20	IDGD	
O=C(CN1CCN(c2ccccn2)CC1)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1	748521929	IDWJPOGKOLFXAT-UHFFFAOYSA-N	443.451	1.640	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)[C@@H]1OCCc2ccccc21	750422956	BTGZMPJBYOGKGG-JOCHJYFZSA-N	442.947	1.919	50	20	IDGD	
CC(C)(C)NC(=O)CN1CCC(CNC(=O)NNC(=O)c2cccc3ncccc23)CC1	751111450	LYKAROYSXZPNLK-UHFFFAOYSA-N	440.548	1.806	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)Nc1ccc(N2CCOCC2)cc1N1CCOCC1	755452006	CRPFYYNUWOWTIW-UHFFFAOYSA-N	440.504	1.150	50	20	IDGD	
CCOCC(=O)NNC(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)[C@H]2C[C@H]3CC[C@H]2C3)cc1	755512534	MHGZJWVYBYEVJY-YRBFXIGRSA-N	438.550	1.979	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)CNC(=O)NCc2ccc([N+](=O)[O-])cc2)c(OC)c1	757182656	ULFIZJDYMZKTGD-UHFFFAOYSA-N	431.405	1.333	50	20	IDGD	
NC(=O)c1ccc(NNC(=O)c2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2)nn1	757401053	BWRMWDRFNPASOS-UHFFFAOYSA-N	430.421	1.272	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)CN2C(=O)N[C@]3(C[C@@H](C)C[C@@H](C)C3)C2=O)cc1	757841799	PTJOOJTWGIMBQO-YEZVWNJWSA-N	444.488	1.046	50	20	IDGD	
N#Cc1ccc(-n2ccc(NC(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)n2)c(Cl)c1	757999911	YZJMYWLLCAZAED-UHFFFAOYSA-N	448.834	1.840	50	20	IDGD	
Cc1nnc(-c2ccc(C(=O)OCC(=O)NNC(=O)[C@H]3COc4ccccc4O3)cc2)o1	758968950	BSMOXQJCGSQRBM-QGZVFWFLSA-N	438.396	1.189	50	20	IDGD	
CCOc1cc(C(=O)NNS(=O)(=O)c2cn(C)c(Cl)n2)cc(OCC)c1OCC	759707860	KLVVPCDFPWDTGL-UHFFFAOYSA-N	446.913	1.893	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)N[C@H]2CCOC[C@@H]2OCC)c2ccccc2c1=O	760127396	PHIRYZFCSHYHMA-IRXDYDNUSA-N	431.493	1.335	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCC2(CN(C)C)CCCC2)cc1	760175375	NZQHJFUOYHNFDM-UHFFFAOYSA-N	439.582	1.068	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)c1ccc2c(c1)CCCN2S(C)(=O)=O	761633939	PKYUYYYVIGNHCO-UHFFFAOYSA-N	449.554	1.961	50	20	IDGD	
CS(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)CSc2ccccc2O)cc1F	763410435	NIUABWJJKRZEDH-UHFFFAOYSA-N	449.507	1.005	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(F)c(Br)c1	763443678	NEBQJRISTYSKTR-UHFFFAOYSA-N	425.170	1.896	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)n([C@@H]2C[C@H]3CC[C@H]2C3)n1	763446277	QBCIXORQCCKWNT-DUVNUKRYSA-N	426.433	1.861	50	20	IDGD	
Cc1ccc(N2CCOC2=O)cc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccccc2)[nH]n1	763614070	PPLWYENUYJPKHO-UHFFFAOYSA-N	448.439	1.741	50	20	IDGD	
CCOC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2c(C)nc3ccccn23)cc1C#N	763627685	CTFLVRRESGZOLJ-UHFFFAOYSA-N	449.427	1.483	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2ccc([N+](=O)[O-])c(Cl)c2)cc1OC	763724445	NGSVBWUWQUYJLA-UHFFFAOYSA-N	437.792	1.883	50	20	IDGD	
CC(C)S(=O)(=O)c1ccccc1NC(=O)C(=O)NNC(=O)c1cc2c(s1)CCC2	763785766	QZGQIMDYUGNIIH-UHFFFAOYSA-N	435.527	1.819	50	20	IDGD	
Cn1c(C2CC2)nc2cc(NC(=O)C(=O)NNC(=O)COc3ccccc3C#N)ccc21	763808295	IZBAPXNNSOYVGV-UHFFFAOYSA-N	432.440	1.487	50	20	IDGD	
COCCOc1cc(C)ccc1NC(=O)C(=O)NNC(=O)COc1ccccc1C#N	763813290	KDNHSWLADBZEGL-UHFFFAOYSA-N	426.429	1.057	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)C(=O)Nc1ccc(C(N)=O)cc1F	763850877	BMYURZAHSZREFF-GFCCVEGCSA-N	438.415	1.631	50	20	IDGD	
COc1ncnc(N(C)C)c1NC(=O)C(=O)NNC(=O)c1cc2c(s1)CCCCCC2	763912211	SRDDLHKWGHNODV-UHFFFAOYSA-N	446.533	1.671	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccccc2C(=O)N(C)C)ccc1OC(C)C	763915706	FNCOILSBEPLMLJ-UHFFFAOYSA-N	442.472	1.584	50	20	IDGD	
O=C(NNC(=O)c1ccc(COc2ccccc2)o1)C(=O)Nc1ccn(-c2ccncc2)n1	763950042	IFUAPTBSZUTEHD-UHFFFAOYSA-N	446.423	1.839	50	20	IDGD	
CC(C)C[C@H](C)n1nccc1NC(=O)C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	764078393	SIOZLQVUUWTNPD-ZDUSSCGKSA-N	435.506	1.293	50	20	IDGD	
CC[C@@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(OC)c(S(=O)(=O)N2CCCCC2)c1	764082416	NTAREPSTVXXAQM-CYBMUJFWSA-N	440.522	1.002	50	20	IDGD	
COc1ccc(COc2cccc(F)c2)cc1NC(=O)C(=O)NNC(=O)c1cc(C)[nH]n1	764106298	HSSLFDSQQJKCEO-UHFFFAOYSA-N	441.419	1.845	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(-n3nccn3)cc2C(F)(F)F)cc1	764177183	KMYICXDQGUMYPR-UHFFFAOYSA-N	443.345	1.557	50	20	IDGD	
COc1ccc(NC(=O)c2cccc(NC(=O)C(=O)NNC(=O)Cc3cccnc3)c2)cn1	764268757	PSQOZSYNILRKCC-UHFFFAOYSA-N	448.439	1.066	50	20	IDGD	
COCC(=O)NNC(=O)C(=O)Nc1cc(C(=O)OC(C)(C)C)ccc1Br	764301362	BPLYLESWVVIAKY-UHFFFAOYSA-N	430.255	1.137	50	20	IDGD	
CCn1cnnc1-c1ccccc1NC(=O)C(=O)NNC(=O)c1cnn(-c2ccccc2)c1	764350639	HELQECODMOZCAB-UHFFFAOYSA-N	444.455	1.550	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc(C(N)=O)c(C)c3)n[nH]2)cc1	764384469	ASZRTLHKAFPNTE-UHFFFAOYSA-N	434.456	1.446	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)N2CCC[C@H](S(C)(=O)=O)C2)N(C)c2ccccc21	764431273	AQPFLHCPJXSZFI-HNNXBMFYSA-N	430.530	1.693	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)CSc2nc3ccccc3nc2N2CCCC2)n1	764566759	PEHATPPLBVCROZ-UHFFFAOYSA-N	439.545	1.983	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNS(=O)(=O)c1cccc(Cl)c1	765117468	FMGOCCNUYSVYHZ-UHFFFAOYSA-N	436.921	1.108	50	20	IDGD	
Cc1onc(-c2ccccn2)c1C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	765729369	PKBQYPDKZDWSIN-UHFFFAOYSA-N	443.485	1.823	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)CNC(=O)CNC(=O)OC(C)(C)C	766327183	PZCCHIJPDQLIME-CQSZACIVSA-N	444.488	1.395	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1ccccc1-n1cccn1	766642265	LGRFFJJPJXSWKP-UHFFFAOYSA-N	432.484	1.091	50	20	IDGD	
O=C(NNc1ncnc2ccsc12)c1sccc1S(=O)(=O)N1CCOCC1	766678301	HVSPCOGGYMFQQL-UHFFFAOYSA-N	425.517	1.531	50	20	IDGD	
N#Cc1ccc(NNC(=O)CCC(=O)N2CCN(c3ncccn3)CC2)cc1C(F)(F)F	768185949	SSSWAGDQVNFHBD-UHFFFAOYSA-N	447.421	1.939	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)[C@H](Cc3ccccc3)NC(=O)OC(C)(C)C)nc21	770971836	AKUKOIFNNBABCL-AWEZNQCLSA-N	427.465	1.648	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1cc(S(=O)(=O)N2CCCCC2)ccc1Cl	771968933	RFAKMYUFFAHLHV-LBPRGKRZSA-N	445.925	1.617	50	20	IDGD	
Cc1ccc2nc(CSCC(=O)NNC(=O)C(=O)NCc3ccc(Cl)cc3)cn2c1	772898267	OUEKBSRGWMGXKP-UHFFFAOYSA-N	445.932	1.993	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CCCC1=NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	773207803	LSTZXESBYSTYCK-GOSISDBHSA-N	443.548	1.994	50	20	IDGD	
C[C@H](C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1)c1cn(C)c2ccccc12	773390117	JMFKSLFCYAVVDQ-SFHVURJKSA-N	447.539	1.887	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)Nc1ccc(C(F)(F)F)cn1	773527875	KHAIWSHFSCWDMQ-UHFFFAOYSA-N	434.172	1.601	50	20	IDGD	
COC(=O)CNC(=O)c1ccc(NC(=O)C(=O)NNc2ncc(Cl)cc2Cl)cc1	773678850	TUQHSRKJBOHMTC-UHFFFAOYSA-N	440.243	1.373	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NN=C2C(=O)Nc3c(F)cc([N+](=O)[O-])cc32)c1	774334981	CHNIMEHYTVIXKX-UHFFFAOYSA-N	435.393	1.070	50	20	IDGD	
COc1ccccc1[C@@](N)(C(=O)NNc1nccc(N2CCOCC2)n1)C(F)(F)F	776173540	XXZHFLZQAIIRRQ-QGZVFWFLSA-N	426.399	1.181	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCC[C@](C)(O)c1ccccc1	777411837	JEDZPFVKXWXXJX-FQEVSTJZSA-N	433.534	1.530	50	20	IDGD	
Cc1cc2ccccc2nc1NNC(=O)Cc1c(C)nn(-c2cncc3nnnn23)c1C	777477821	JOCQVOAGKPHHAP-UHFFFAOYSA-N	428.460	1.864	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)c1cc(Br)c2c(c1)OCCO2	778433240	GZORAWMQOUOOHZ-UHFFFAOYSA-N	430.255	1.506	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@H](C(=O)NNc2nc(-c3ccccc3)no2)[C@@H](C)O)cc1	779514054	JTFAPZIVNDTIEE-CJNGLKHVSA-N	431.474	1.216	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)N[C@H]1CCC[C@@H]1CCO	779710382	FPJCSLSANBDCFX-QAPCUYQASA-N	438.550	1.356	50	20	IDGD	
O=C(NNC(=O)c1noc2c1CCCCC2)c1cccc(S(=O)(=O)N2CCOCC2)c1	780155003	NARSWKBHJAUARH-UHFFFAOYSA-N	448.501	1.039	50	20	IDGD	
O=C(CSc1nnc(O)nc1O)NN=C1CCC(N2C(=O)c3ccccc3C2=O)CC1	780209378	XNARAZKZZHZMCM-UHFFFAOYSA-N	442.457	1.086	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)N[C@H]2CCCN(c3ccc(C#N)cc3)C2=O)c1	780893357	ABLAGEJNRFGAQP-SFHVURJKSA-N	427.486	1.783	50	20	IDGD	
CCN(CC)CCNC(=O)c1cccc(NC(=O)C(=O)NNc2ncncc2Cl)c1	782165182	FBBYJELMWVKERW-UHFFFAOYSA-N	433.900	1.283	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)NCc2cccc(S(=O)(=O)N(C)C)c2)cc1C	782766145	GIFUSMDFWSVYBW-UHFFFAOYSA-N	447.517	1.023	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)nn1-c1ccccc1	782895299	ZXOCOTLJLIGLOD-UHFFFAOYSA-N	431.456	1.396	50	20	IDGD	
CN1CCN(CC(=O)N(C)c2ccc(NC(=O)C(=O)NNc3cccc(F)c3)cc2)CC1	783039935	SESDTYAAABMUNK-UHFFFAOYSA-N	442.495	1.118	50	20	IDGD	
C[C@H]1CCCN(Cc2ccc(NC(=O)C(=O)NNC(=O)CNC(=O)c3ccco3)cc2)C1	784002885	WFTQIRNCIRZRNT-HNNXBMFYSA-N	441.488	1.027	50	20	IDGD	
CN(C)C(=O)COc1ccc(NC(=O)C(=O)NNc2ccc(Br)cn2)cc1	784339939	NOKHNKSGPYCLRE-UHFFFAOYSA-N	436.266	1.393	50	20	IDGD	
CCOC(=O)c1ccn(-c2ccccc2NC(=O)C(=O)NNc2ccc(Cl)nn2)n1	784789593	KKESQJOZGJWFTR-UHFFFAOYSA-N	429.824	1.574	50	20	IDGD	
COC[C@H](C)NS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2cc(C)ccc2F)cc1	784885031	SYMRPAKIQIFLBM-ZDUSSCGKSA-N	438.481	1.529	50	20	IDGD	
CC[C@@]1(C)Oc2ccc(NC(=O)C(=O)NNC(=O)COc3ccc(OC)cc3)cc2O1	785992048	VIERDTYDVVWYFO-NRFANRHFSA-N	429.429	1.758	50	20	IDGD	
CN1C[C@H](C(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)c2ccccc2C1=O	787513458	FSEPOTVQVRRZAN-KRWDZBQOSA-N	445.520	1.492	50	20	IDGD	
CCN(CC)Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(OC)c(OC)c2)cc1	787894606	OSOLCBLGCYKRJM-UHFFFAOYSA-N	428.489	1.945	50	20	IDGD	
COc1nn(C)cc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccncc2)nc2ccccc12	789586842	QVGXPUXVQOFEFA-UHFFFAOYSA-N	445.439	1.439	50	20	IDGD	
O=C(COC(=O)c1ccc(Br)o1)NNC(=O)[C@@H]1COc2ccccc2O1	790082007	UZARHYMCPWXOCG-LBPRGKRZSA-N	425.191	1.186	50	20	IDGD	
COc1cc(Cl)c(S(=O)(=O)NNC(=O)c2c(C)nc3ccccn23)cc1C(=O)O	790387650	SRRHUYBYIXMXSY-UHFFFAOYSA-N	438.849	1.626	50	20	IDGD	
CO[C@@H]1CCOc2c(NC(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)cccc21	790577423	QWLQFFLFNVEKJO-QGZVFWFLSA-N	448.501	1.873	50	20	IDGD	
C[C@@H]1CN(c2ccc(NC(=O)C(=O)NNc3cccc(F)c3[N+](=O)[O-])cn2)C[C@@H](C)O1	790998652	QMKCUWBLJGSRKU-VXGBXAGGSA-N	432.412	1.824	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)NCCCCn1cc(Br)cn1	792221286	ODHIKCLVNSUCRV-UHFFFAOYSA-N	435.282	1.707	50	20	IDGD	
CCOC(=O)Oc1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1	800315006	SXUQLKJDJYRDHY-UHFFFAOYSA-N	435.458	1.547	50	20	IDGD	
CC(C)[C@@H](C(=O)NNC(=O)Nc1ccc(Br)cc1)N1CCCS1(=O)=O	801999992	NMEAIDNKOIMTCA-ZDUSSCGKSA-N	433.328	1.662	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1)NNC(=O)Nc1ccc(Cl)cc1	802016539	FGGKSWPCIUDWLA-UHFFFAOYSA-N	441.853	1.770	50	20	IDGD	
CC(C)S(=O)(=O)c1ccccc1C(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	802067156	NNLCJRIPMMPQEF-UHFFFAOYSA-N	439.515	1.739	50	20	IDGD	
COC[C@@H](C)n1c(C)cc(/C=C(/C#N)C(=O)NS(=O)(=O)c2cnc3n2CCC3)c1C	802208938	DEZJAMRMOCIVAO-KDVQLTRESA-N	431.518	1.867	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)N[C@H]1CCCN(C(=O)Cc2ccccc2)C1	802473795	QFCGEHKYLHJPTC-KRWDZBQOSA-N	426.473	1.335	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)[C@@H]1CCCN(C(=O)c2ccncc2)C1	803489956	NSCURVFEKFTJRB-LJQANCHMSA-N	438.484	1.176	50	20	IDGD	
O=C(NCCCCN1CCN(c2ncccn2)CC1)NNc1ccc2c(=O)[nH]ccc2c1	806734426	ISQCZQLQQVMGGD-UHFFFAOYSA-N	436.520	1.547	50	20	IDGD	
CN1CCOc2ccc(C(=O)NNc3ccccc3S(=O)(=O)N3CCOCC3)cc21	806974109	UZMJUOVKFZGHBR-UHFFFAOYSA-N	432.502	1.293	50	20	IDGD	
Cc1ccc([C@@H](CNC(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)N2CCOCC2)o1	807023247	GRWWNCCVUVSJSV-CRAIPNDOSA-N	434.468	1.898	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)N[C@@H](C)CN(C)C)c2)cc1	807576258	OEBSOZXPQSBDOT-AWEZNQCLSA-N	449.533	1.390	50	20	IDGD	
O=C(COC(=O)c1cncc(C(F)(F)F)c1)NNC(=O)[C@@H]1COc2ccccc2O1	808620335	YOTCJFYQGPIUOQ-AWEZNQCLSA-N	425.319	1.245	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc4c(c3)C(=O)OC4)n[nH]2)cc1C	808935439	XFPXOVKRTUTEJZ-UHFFFAOYSA-N	433.424	1.764	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2ccc(F)cc2Br)cc1	810172190	BULXFAHAABGQIM-UHFFFAOYSA-N	444.282	1.636	50	20	IDGD	
CCc1cc(NNC(=O)CNS(=O)(=O)c2ccccc2F)nc(-c2ccccn2)n1	810384249	BDRKBRJHRQYZIY-UHFFFAOYSA-N	430.465	1.662	50	20	IDGD	
CC[C@@H]1[C@H](C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)CCN1C(=O)OC(C)(C)C	810619049	LAAYZUVZHZSCMH-ZIAGYGMSSA-N	443.545	1.877	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)Nc2ccc(CCN3CCOCC3)cc2)cc1	812926977	WTOOGPBGIXURHR-UHFFFAOYSA-N	447.561	1.960	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2ccc3c(c2)CN(C(=O)OC(C)(C)C)CCO3)ncn1	812984921	ZLUPDGWWQKPEDX-UHFFFAOYSA-N	442.476	1.996	50	20	IDGD	
CC(C)(C)OC(=O)N1CCOc2ccc(NC(=O)C(=O)NNc3cccnn3)cc2C1	812985504	CXSSXBCQRDQWKN-UHFFFAOYSA-N	428.449	1.688	50	20	IDGD	
Cc1nc2cc(NC(=O)C(=O)NNc3ccc(S(=O)(=O)N(C)C)cc3)ccc2n1C	813033052	BXZIXGPMGXWVLG-UHFFFAOYSA-N	430.490	1.214	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)N[C@H]3CC(=O)N(c4ccccc4F)C3)nc21	813236264	IVUIRGZSBXITSM-NSHDSACASA-N	442.455	1.858	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)c2nn(C)cc2Br)c2ccccc2c1=O	814364955	TVPCOBONYLTULF-UHFFFAOYSA-N	433.266	1.548	50	20	IDGD	
CCOCCOc1ccc(Br)cc1NC(=O)C(=O)NNC(=O)[C@H]1CCCO1	815779371	CIRPPXVLEUATFN-CQSZACIVSA-N	444.282	1.129	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)CNC(=O)c2ccc(F)c(F)c2)C1	816511021	MIOHGNJHDUTYCQ-ZDUSSCGKSA-N	440.447	1.489	50	20	IDGD	
O=C(NNc1nc[nH]n1)[C@@H]1CCCN(S(=O)(=O)c2ccc(Br)cc2)C1	816633152	PSIQENQMKLIXQV-SNVBAGLBSA-N	429.300	1.111	50	20	IDGD	
CCCCC(=O)N1CSC[C@H]1C(=O)NNC(=O)[C@H]1CCCN(C(=O)OC(C)(C)C)C1	819658887	QDLYMIXBAXEHBU-GJZGRUSLSA-N	442.582	1.873	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)c2ccc3c(c2)C(=O)N(C[C@@H]2CCCO2)C3=O)cc1	825588782	LYTFZVJYMQSNKT-KRWDZBQOSA-N	436.468	1.643	50	20	IDGD	
CCOc1ccccc1N1C[C@@H](C(=O)NNC(=O)CNc2cccc(OC)c2)CC1=O	825776627	KQVVDPANAYSNMC-HNNXBMFYSA-N	426.473	1.706	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)O[C@H](C)C(=O)Nc2ncnc3[nH]cnc23)c1C	897563604	XKHNNQAKUYVWJH-UVYNJXETSA-N	437.460	1.895	50	20	IDGD	
CC(=O)c1cccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)OC(C)(C)C)CC2)c1	913176378	WPLLUXXOOVXSOL-UHFFFAOYSA-N	425.507	1.846	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)c2ccccc2NS(C)(=O)=O)c2ccccc2c1=O	913588082	ONYXJTZASDGXDT-UHFFFAOYSA-N	443.485	1.424	50	20	IDGD	
COc1cc(OC)c2cc(C(=O)OCC(=O)NNC(=O)c3cccs3)[nH]c2c1OC	915473831	VJKCKCVQGSDTPG-UHFFFAOYSA-N	433.442	1.873	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cnc3nc(O)nc(O)c3c2)ccc1OCCC(C)C	915670837	BZAYWFPOVJBBGL-UHFFFAOYSA-N	441.444	1.944	50	20	IDGD	
COc1ccc(S(=O)(=O)N[C@H](C)C(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)cc1	915788042	RIVIGPVIHYJQTA-HZPDHXFCSA-N	449.529	1.594	50	20	IDGD	
CC(=NNC(=O)c1ccc(-n2cnnn2)cc1)c1ccc(OCC(=O)N2CCOCC2)cc1	916352207	RVZHAKYJHDYNSJ-UHFFFAOYSA-N	449.471	1.054	50	20	IDGD	
CCCc1c(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)[nH]c(C)c1C(=O)OC	916734683	LBFSDNWZUAOQGD-UHFFFAOYSA-N	435.506	1.430	50	20	IDGD	
CC[C@@H](NC(=O)NNC(=O)c1cccc(N(C)C)c1)c1ccccc1OCC(=O)NC	918221528	KXNAGCOSYPZHIA-GOSISDBHSA-N	427.505	1.973	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)N[C@@H]3CCS(=O)(=O)C3)c3ccccc3n2)o1	919884381	FTVDTTRIVTYQJE-CYBMUJFWSA-N	428.470	1.934	50	20	IDGD	
CCCCn1c(C)cc(/C=C(/C#N)C(=O)N(C)CC(=O)N[C@@H]2CCS(=O)(=O)C2)c1C	920291299	UUNJGWNKOWOAOB-ZYNFKGNASA-N	434.562	1.574	50	20	IDGD	
CC(=NNC(=O)c1sc(N2CCOCC2)nc1C)c1cccc(OCC(=O)N(C)C)c1	920482334	KKXJLGUTVONEBF-UHFFFAOYSA-N	445.545	1.909	50	20	IDGD	
NC(=O)[C@@H]1CCCN1Cc1cccc(NC(=O)NNC(=O)COc2ccccc2F)c1	920930536	OFEGFIBVWNISQQ-KRWDZBQOSA-N	429.452	1.507	50	20	IDGD	
O=C(NN=C1CCOc2c(F)cccc21)c1cccc(S(=O)(=O)N2CCOCC2)c1	921254131	SJJMPSQIBYDWAT-UHFFFAOYSA-N	433.461	1.763	50	20	IDGD	
O=C(NNC(=O)[C@H](Cc1ccccc1)NC(=O)c1cccnc1)c1ccc2c(c1)OCCO2	921304256	UDZZTBBEINKVEM-IBGZPJMESA-N	446.463	1.655	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)Cc2ccc(S(=O)(=O)CCO)cc2)c1C	1116423292	WYJCATSSEPFUGO-MRXNPFEDSA-N	434.514	1.227	50	20	IDGD	
CC(C)(C)OC(=O)N1CCO[C@@H](CC(=O)NNC(=O)c2cncn2-c2ccccc2)C1	1253079824	FRQCGYPLJBAJTO-INIZCTEOSA-N	429.477	1.659	50	20	IDGD	
CN(CCNC(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1)C(=O)OC(C)(C)C	1318667949	CJTBUNZPYBXQDA-UHFFFAOYSA-N	443.545	1.831	50	20	IDGD	
O=C(CN1CCC(O)(Cc2ccccc2F)CC1)NNC(=O)c1cccc([N+](=O)[O-])c1	1320903544	OCWRCESUOIUTDW-UHFFFAOYSA-N	430.436	1.565	50	20	IDGD	
O=C(COC(=O)c1ccc(OCC2CC2)nc1)NNC(=O)[C@@H]1COc2ccccc2O1	1322438005	JQTNXHDCXZUKMF-KRWDZBQOSA-N	427.413	1.015	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4c(c3)CNC4=O)C2)C1	1778723825	XSJGOIMZYVWTSU-NRFANRHFSA-N	431.565	1.225	50	20	IDGD	
Cc1cc(CC(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](C)Br)C3)n[nH]1	1779464537	KQQIQHMDMWGDTD-JCKWVBRZSA-N	427.343	1.558	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCSC(=N)N)C2	1780713567	YMTGJVREMZILPR-OAUYIBNBSA-N	439.409	1.753	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)C/N=C/c1ccco1)C2)[C@@H](F)Br	1780775012	TXUCSFDNHXTJDJ-VVPGEPNGSA-N	444.301	1.903	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)Cn3ccc4sccc4c3=O)CCO2)C1	1781215105	HZEQWRPGRIGEAS-FOIQADDNSA-N	437.949	1.910	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)c3nn[nH]c3C(F)(F)F)CCO2)C1	1781232044	SMKKJKIEKOFSDA-KBPBESRZSA-N	444.241	1.503	50	20	IDGD	
O=C([C@H](F)Br)N1CCO[C@@]2(CCN(C(=O)C3(Br)CC3)C2)C1	1781347409	UEDLGCNSLYIOPZ-CABZTGNLSA-N	428.096	1.434	50	20	IDGD	
Cc1nc(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](C)Br)C2)no1	1781997069	BBNRWQZWUXVQIZ-XTQGRXLLSA-N	429.315	1.218	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1ccn(C)n1)C2	1781998058	MTLSHHKANPPJKF-JCKWVBRZSA-N	427.343	1.260	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccnn3CCOC)CCO2)C1	1783347289	FNYFQNSJXJGLBG-KDOFPFPSSA-N	443.342	1.147	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cccc(C(=O)N(C)C)c3)CCO2)C1	1783883918	MWGLLHBBGJWKAT-UWJYYQICSA-N	437.924	1.086	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)COc3cccc(Cl)c3)C[C@@H]21)[C@H](O)CCl	1784084555	XWSPZIYCOAKYTM-SJWGOKEGSA-N	431.316	1.298	50	20	IDGD	
COc1cc(Cl)ccc1CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]2C1	1784094815	STRBMLXXQOCFAI-SCNOPHJPSA-N	445.343	1.471	50	20	IDGD	
C[C@H](CBr)C(=O)Nc1ccc(C2(NC(=O)CC[C@H](N)C(N)=O)CCC2)cc1	1786069138	MAVXEAKPPRXOMG-DOMZBBRYSA-N	439.354	1.744	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc(OC)cn3)[C@H]2C1	1786243980	YWKRJSGICQDHJJ-XPCVCDNBSA-N	441.326	1.252	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc[nH]c3C)C[C@@H]21	1787509117	TWLUZZHQIDMOSU-IIYRHJEWSA-N	440.504	1.050	50	20	IDGD	
Cc1nc2ncccn2c1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21	1787982750	MJVUUKIKZCZHNO-AVGNSLFASA-N	426.304	1.435	50	20	IDGD	
O=C(CN1CCCCC1)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1	1788143685	MAZCKICUZTWDAJ-UHFFFAOYSA-N	435.333	1.600	50	20	IDGD	
CCc1nc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)CBr)C[C@@H]32)co1	1788989546	DKLBXGWXJQSRPU-OSFYFWSMSA-N	428.327	1.861	50	20	IDGD	
C[C@@H]1CCc2c(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]4C3)n[nH]c21	1789925694	HLXSQHJHCPLKSH-QCEZPJONSA-N	443.317	1.743	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1ccc(C2(NC(=O)CSc3nc[nH]n3)CCC2)cc1	1791603216	LDGJUJBCGQSUJD-UHFFFAOYSA-N	445.549	1.404	50	20	IDGD	
COc1nccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)CBr)c1F	1792867629	IFJFHPMFZZXSLA-MCYUEQNJSA-N	444.301	1.464	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c(Cl)ccc(Cl)c1O)C2)[C@@H](O)CCl	1792980065	KUMJJTYKTZSBAZ-NVVZYBJKSA-N	437.707	1.502	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1CC(=O)N(C2CCCC2)C1	1794030882	FKQHQKZOTUWAFJ-VGAPYMQISA-N	425.957	1.670	50	20	IDGD	
CC(C)(C)OC(=O)CCCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1	1796189619	IQYGTNRBEQCKCE-REPLKXPHSA-N	444.337	1.130	50	20	IDGD	
C[C@H]1CC[C@@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Cl)N1C(=O)OC(C)(C)C	1796361778	UDAMXLDOHUAPCO-IATJYDTKSA-N	447.935	1.898	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(SC)c1O	1798564346	KWLSKLFQGJTXML-LMWOUKEDSA-N	428.938	1.571	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Br)o1	1799349955	OPHHQWBMQUZBKN-DJBIQUGXSA-N	432.246	1.132	50	20	IDGD	
CN(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](F)Cl)C2)NC(=O)NCc1ccccc1	1799871691	VUUORKCXEPCEMB-KYHPRHEASA-N	439.919	1.505	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(-c2cc[nH]n2)cc1	1800613334	ZKIPBZOJQXZHEW-REPLKXPHSA-N	438.532	1.702	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccn3ccnc13)C2	1800641774	KCGLSAVZQZNMLZ-XRGAULLZSA-N	435.322	1.711	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccnn1-c1ccccc1)C2	1800756751	DLRZFIVJYAOPGS-ZXFNITATSA-N	447.333	1.859	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc([N+](=O)[O-])c(OC)c1)C2	1800982749	KGWZXAYXDPFFCG-UMPJEAMMSA-N	441.868	1.060	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(C3CC3)cc1)C2	1801012623	SHLYMRVLFHQUFE-HATOLVCRSA-N	428.533	1.140	50	20	IDGD	
Cc1ccc(-n2ccnn2)c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C(Cl)Cl)c1	1801016851	XULBIESXNWUSNZ-YWVIFJGQSA-N	438.315	1.583	50	20	IDGD	
COc1cc(CCC(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)ccn1	1804273833	VDHRHGUSRJWFJF-WAOWUJCRSA-N	446.935	1.724	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC2(CCCN(C(=O)C(F)(F)C(F)(F)C(=O)O)C2)CC1	1806538605	NWHJPZGMHRZSQC-LLVKDONJSA-N	446.825	1.827	50	20	IDGD	
Cc1cc(C(=O)NC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)c[nH]1	1808778270	LJWUPRBKAOWBND-LAUBAEHRSA-N	426.521	1.411	50	20	IDGD	
O=C1NCCn2nc(C(=O)N3CCCC4(CCN(C(=O)C(Cl)Cl)CC4)C3)cc21	1808822620	XEJVYZVYAUJCQA-UHFFFAOYSA-N	428.320	1.275	50	20	IDGD	
NC(=O)c1nccnc1C(=O)N1CC[C@@H](CNC(=O)C(Cl)Cl)[C@@H]1c1cccnc1	1813078198	GLNQECKPYAEVJM-FZMZJTMJSA-N	437.287	1.094	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@H]1CCc2nc(NC(=O)CS(C)(=O)=O)sc2C1	1814325496	QQEUBICSJKTMRY-RTHLEPHNSA-N	428.363	1.336	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)CN3CCCC3=O)sc2C1	1814600580	GHFDTWSKKARUAU-QWRGUYRKSA-N	443.367	1.851	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1)[C@@H]1COc2ccccc2O1	1815672134	JTTRUVONIVNYAK-ZQIUZPCESA-N	434.880	1.842	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)CN2CCCCC2)n[nH]1	1817136464	FNWXXRPCWATEBG-QGZVFWFLSA-N	433.557	1.261	50	20	IDGD	
CC[C@@H](NC)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[nH]n1	1817462576	FRICTEQCTYHBBD-GBWSIVELSA-N	442.524	1.534	50	20	IDGD	
CC(C)N1CCC[C@H]1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1	1823022996	SOWJHMKUJLDZNH-ROUUACIJSA-N	447.584	1.648	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)Cn1nc(C)cc1C)CC2	1825994726	YHCSMUCKKVNSGP-OLZOCXBDSA-N	425.942	1.822	50	20	IDGD	
C[C@@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)CCBr)CC1)n1cnnn1	1826360057	CMSHWXDQPUKXLU-DZGCQCFKSA-N	427.347	1.639	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC([C@H]2CCCCN2C(=O)CS(C)(=O)=O)CC1	1826630044	XIMGOVSIXSNPFV-HUUCEWRRSA-N	437.400	1.824	50	20	IDGD	
CC(=O)C[C@@H](C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827055435	WBPPNWQQRLSNNI-IERDGZPVSA-N	428.338	1.215	50	20	IDGD	
CCc1nc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)co1	1829389176	XWPAFEHXKQDFQW-GOSISDBHSA-N	433.553	1.843	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)cc1Cl	1830107412	QSDWCOCVUNJQEM-APWZRJJASA-N	431.316	1.318	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccncc3)C2)C1	1830537802	OYAYVMXCKORBQD-RDTXWAMCSA-N	426.311	1.183	50	20	IDGD	
Cc1c[nH]cc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)CBr)CCO2	1830538283	AUBLUCWTQNMTNU-ACJLOTCBSA-N	428.327	1.424	50	20	IDGD	
O=C(c1cc(-c2ccccc2)no1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1830731711	MEVPFEGLEDXRLK-LAUBAEHRSA-N	449.891	1.011	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)Cn3ccnc3)C2)C1	1831660180	ZLDZYAUXKQUARA-ZWOKBUDYSA-N	426.945	1.383	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3nc(C)sc3C)CCO2)C1	1833151663	VKOJKNLCPKGJJO-KXBFYZLASA-N	429.970	1.776	50	20	IDGD	
Cc1cc(C)n(CCC(=O)N2CCC(N3CCC(NC(=O)[C@@H](O)CCl)CC3)CC2)n1	1833312844	HSLHMRGTUKPQFS-IBGZPJMESA-N	439.988	1.061	50	20	IDGD	
Cc1nccn1CCCC(=O)N1CCC(N2CCC(NC(=O)[C@H](O)CCl)CC2)CC1	1833313037	REFZDTRSAZILMS-LJQANCHMSA-N	439.988	1.143	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(C)cnc3Cl)CCO2)C1	1834559335	HMDKVXCKGJCMTP-BEFAXECRSA-N	446.331	1.367	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cc[nH]c4nccc3-4)CC2)CC1	1835011534	NGIWQFALVYFRMV-LJQANCHMSA-N	447.967	1.954	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3ccc4nncn4c3)CC2)CC1	1835584322	QJSGEQNVRPLOGQ-GOSISDBHSA-N	432.956	1.932	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)CS(C)(=O)=O)CC2)CC1	1836394742	FHUXLTDHUGSVGO-WMLDXEAASA-N	436.018	1.256	50	20	IDGD	
CC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)[C@@](C)(O)C(F)(F)F)CC2)CC1	1836395153	UYTNVSQTJBLLBA-WMLDXEAASA-N	427.895	1.889	50	20	IDGD	
CN1C(=O)CC[C@H]1C(=O)N1CCC(OC2CCN(C(=O)C(C)(C)CCl)CC2)CC1	1836624460	RAXVBLDNRDGLPN-KRWDZBQOSA-N	427.973	1.871	50	20	IDGD	
Cc1c(C(=O)N2CCC(OC3CCN(C(=O)[C@H](O)CCl)CC3)CC2)nc2ccccn12	1836717423	AYEKTQRRHMBQCO-GOSISDBHSA-N	448.951	1.855	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cc(O)nc(O)n3)CC2)CC1	1836920133	YLCHJMWGKZNROG-HNNXBMFYSA-N	440.928	1.908	50	20	IDGD	
Cc1ccc(C(=O)N2CCC(OC3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)o1	1836955997	HHHAHHWEMPZRCY-UHFFFAOYSA-N	434.537	1.573	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc4n(n3)CCCC4)CCO2)C1	1836974215	QRHOCQOPFSXXTA-DYESRHJHSA-N	438.956	1.697	50	20	IDGD	
O=C(c1cnsn1)N1CCC(OC2CCN(C(=O)[C@H](F)Br)CC2)CC1	1837298148	KBMKESRCYSNULF-ZDUSSCGKSA-N	435.319	1.841	50	20	IDGD	
Cc1cscc1C(=O)N1CCOC[C@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1837713300	UWMWYNVAROKNKG-IBGZPJMESA-N	426.611	1.978	50	20	IDGD	
CCc1cnc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](Cl)COC)C3)C2)s1	1837726214	XXCOQMKRPCCLMM-KBXCAEBGSA-N	431.942	1.029	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)c3ccc(F)nc3)CC2)CC1	1838450899	CZRUXDGSWILOOI-UHFFFAOYSA-N	449.527	1.206	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)[C@H]3CCNC(=O)C3)CC2)CC1	1838773491	JRZQJEWTFVUTOT-KBPBESRZSA-N	444.370	1.295	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4c(c3)CNC4=O)C2)C1	1839145985	SNVUJYNIUDFAIR-LAUBAEHRSA-N	435.908	1.017	50	20	IDGD	
CN1CCCC[C@@H]1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2	1839150656	SWRXSEKCDBLYTM-ATZDWAIDSA-N	436.380	1.163	50	20	IDGD	
CCc1nc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)co1	1839153752	QUZBTWUAYMZOCF-ROUUACIJSA-N	434.320	1.543	50	20	IDGD	
O=C(/C=C/C1CCCC1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1839180708	ZBDHFXCFPMDBLV-OZZQIWQLSA-N	433.318	1.880	50	20	IDGD	
C#CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](Br)Cc1ccccc1)CCO2	1839802254	PUGOZDKUONVEQE-FXAWDEMLSA-N	435.318	1.082	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc4ccoc34)C2)C1	1840154751	FNKNVBXTBRUURF-DYESRHJHSA-N	436.892	1.757	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4[nH]c(C)cc4c3)C2)C1	1840155159	RBUUBQYCGDIVOB-AVRDEDQJSA-N	449.935	1.800	50	20	IDGD	
Cc1cc(C)n(CCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)n1	1840190642	FVYFKPFPCDRVRV-GOSISDBHSA-N	433.336	1.150	50	20	IDGD	
C#CCCCCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](Br)CC)C2)C1	1840295116	WXGHVZCCHPFDFL-QFBILLFUSA-N	429.355	1.810	50	20	IDGD	
C[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)CCBr)C2)C1)c1ccccn1	1840500539	JCDAUNYJLCZKDK-HNAYVOBHSA-N	440.338	1.427	50	20	IDGD	
COC1(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@](C)(Cl)CCl)C3)C2)CCC1	1840617262	TXQAJPBASSOWCF-MJGOQNOKSA-N	437.364	1.638	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H]1CC[C@H](C(=O)N2CCCC23CN(C(=O)[C@H](O)CCl)C3)CC1	1841754464	GBLBEPCIULHUAK-BZUAXINKSA-N	443.972	1.873	50	20	IDGD	
COC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)CCBr)C1	1842638233	CSBAYOYDSFGCSR-CYBMUJFWSA-N	448.358	1.515	50	20	IDGD	
O=C(c1ccc(N2CCCCC2)cc1)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843012030	WVFGHGYTMCMFSC-UHFFFAOYSA-N	447.344	1.488	50	20	IDGD	
O=C([C@@H]1CCc2cccc(Cl)c21)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843014971	VRXOJPKDBWVJBU-GOSISDBHSA-N	438.720	1.567	50	20	IDGD	
O=C(c1c(F)ccc(Cl)c1F)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843015709	VYMFHMCIRGOWPN-UHFFFAOYSA-N	434.635	1.429	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1c(F)ccc(O)c1F)C2	1843416707	RCYSEXDSBIRSJO-BRJLIKDPSA-N	445.426	1.621	50	20	IDGD	
COc1ccc(C(=O)N2CCCC23CN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C3)c(F)c1	1845333712	CIYKBUNGYHBGDD-AFUMVMLFSA-N	441.463	1.785	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)COc2ccccc2C#N)C1	1846979534	BNGZPHYHQDMRHQ-WGOQTCKBSA-N	448.483	1.274	50	20	IDGD	
CN1CCCC[C@@H]1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1847575710	NCEJBVZGJNIFKM-LUKYLMHMSA-N	442.988	1.805	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H]1CCc2nc(O)nc(O)c2C1	1848217425	LBGJDBXDTFMMPM-RWDUKZEUSA-N	443.331	1.431	50	20	IDGD	
CC(C)[C@H](NS(=O)(=O)c1ccc2c(c1)OCCCO2)C(=O)NNC(=O)c1ccccn1	17328830	OKIMVNRNXHCHRJ-SFHVURJKSA-N	448.501	1.007	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)[C@@H]1CC(=O)N(Cc2ccco2)C1	21637870	FHOZOVDPTPFZDQ-GFCCVEGCSA-N	449.847	1.295	50	20	IDGD	
Cn1cc(S(N)(=O)=O)cc1C(=O)OCC(=O)NN=C(c1ccccc1)c1ccccc1	26263926	HGSMSSKHVOQTLB-UHFFFAOYSA-N	440.481	1.398	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2cc(C#N)cn2C(C)(C)C)cc1	725853601	WMEPEGVTYLYOMF-UHFFFAOYSA-N	446.533	1.897	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cn(-c3cccc(C)c3)nn2)cc1OC	725964733	BPARZXDKJOSKNQ-UHFFFAOYSA-N	439.428	1.211	50	20	IDGD	
NS(=O)(=O)c1ccc(C(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)cc1Cl	726066679	VEKAJLRDTWTTHK-UHFFFAOYSA-N	446.268	1.259	50	20	IDGD	
Cc1nc(CN2CCC(C(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)CC2)cs1	726869708	JAYOVOMBOZUAMX-UHFFFAOYSA-N	440.529	1.372	50	20	IDGD	
CC(C)CC(=O)N1CCN(C(=O)CCCCCNC(=O)NNC(=O)C2CCCC2)CC1	727605839	YDRYDGHCUVKODY-UHFFFAOYSA-N	437.585	1.784	50	20	IDGD	
CN(C)N(C(=O)c1ccc(S(=O)(=O)N2CCCCCC2)cc1)[C@@H]1CCS(=O)(=O)C1	728177201	YVJRLHYFLDDVGA-QGZVFWFLSA-N	443.591	1.357	50	20	IDGD	
O=C(NNC(=O)c1cc(F)ccc1Br)c1ccc(CN2C(=O)CNC2=O)cc1	728549400	GESSWAPWKNJMAK-UHFFFAOYSA-N	449.236	1.715	50	20	IDGD	
COc1ccc([N+](=O)[O-])cc1CNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1	728947446	XDLVTKBLKRRYBO-UHFFFAOYSA-N	429.437	1.140	50	20	IDGD	
Cc1nc(-c2ncccn2)nc(O)c1CC(=O)NNC(=O)[C@H](C)Oc1ccccc1F	729283919	YDOKQVSEGHUPGU-LBPRGKRZSA-N	426.408	1.244	50	20	IDGD	
CC(=O)Nc1cc(F)c(S(=O)(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1Cl	729663057	CFBVMLHDPQWOGF-UHFFFAOYSA-N	430.801	1.969	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)N1CCC[C@H]1C(=O)NNC(=O)COc1ccccc1O	730781945	CUBFUXCFVZPVQI-HNNXBMFYSA-N	447.875	1.885	50	20	IDGD	
O=C(NCCCNC(=O)c1cccc(F)c1)NNC(=O)c1cc(Br)c[nH]1	732236519	YEDBBLDBTFXHRR-UHFFFAOYSA-N	426.246	1.680	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCCNC(=O)c2ccc(C)cc2)nc1	732468375	OMIGXXZHYVMFBO-UHFFFAOYSA-N	448.549	1.477	50	20	IDGD	
CCc1cc(N2CCC[C@@H](NC(=O)NNC(=O)c3cc(Br)c[nH]3)C2)ncn1	732915140	WLDDBVOMKFHYIF-CYBMUJFWSA-N	436.314	1.743	50	20	IDGD	
Cn1c(C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc2c(=O)n3ccccc3nc21	733108459	JQASAFRLMWPTMY-UHFFFAOYSA-N	427.424	1.447	50	20	IDGD	
O=C(NC[C@@H]1CN(Cc2ccccc2)CCO1)NNC(=O)c1cnn(-c2ccccc2)c1	733639711	GPCPUDVSMXIAMA-OAQYLSRUSA-N	434.500	1.717	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)CC[C@@H]2NC(=O)N(c3ccc(C#N)cc3)C2=O)cc1	733805378	SIWBHPIUMMTLRC-SFHVURJKSA-N	434.456	1.331	50	20	IDGD	
N#Cc1ccc(C(=O)NNS(=O)(=O)c2cc3c(cc2Br)CCC(=O)N3)cc1	734807188	JUGDSBUSDZGRDB-UHFFFAOYSA-N	449.286	1.829	50	20	IDGD	
C[C@@H](NC(=O)c1cccs1)C(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	734822443	WJOJJEIXOOWJGO-GFCCVEGCSA-N	439.538	1.596	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)c2cccc(Br)c2)c([N+](=O)[O-])c1	743264021	NJLZIHCBVICYEZ-UHFFFAOYSA-N	430.236	1.989	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)N[C@@H]1CC(=O)N([C@H]2C[C@H]2c2ccccc2)C1	743609530	XXKRRZSQXQTVPP-GIVPXCGWSA-N	444.495	1.973	50	20	IDGD	
COc1ccc(C(=O)Nc2nc(CC(C)=NNC(=O)N3CCOCC3)ns2)cc1OC	745590791	FOCDPMCJBYIVPZ-UHFFFAOYSA-N	448.505	1.768	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCN([C@H](C#N)c2ccccc2)CC1	746448571	GVFAGKBNVDNGIC-LJQANCHMSA-N	441.919	1.992	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)c2nc(C)n(-c3n[nH]c(C(F)(F)F)n3)n2)c1	747199837	YPGQOHFRIPIXQT-UHFFFAOYSA-N	438.370	1.169	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2ccccc2O)cc(Br)cc1S(N)(=O)=O	747522125	AVFQLYCRUGNVRA-UHFFFAOYSA-N	428.264	1.185	50	20	IDGD	
O=C(CCNS(=O)(=O)c1cccs1)NNc1nc(-c2ccccn2)nc2c1CCC2	748339980	UGDOHMMQPXKCJD-UHFFFAOYSA-N	444.542	1.901	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)(F)F)cc1)[C@@H]1CC[C@H](C(F)(F)F)NC1=O	748517975	BWQKXFONBODJDU-NXEZZACHSA-N	433.330	1.880	50	20	IDGD	
CC(C)[C@H](C(=O)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1)N1CCCS1(=O)=O	748520469	QULUCTYXYBRFGU-CYBMUJFWSA-N	443.469	1.483	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)c1cc(Br)c2c(c1)OCCO2	748601803	NDDFUQZKXGQAOR-OAHLLOKOSA-N	435.230	1.821	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCC(=O)N(C)C2CCCCC2)nc1	748665525	YPFAUFDHMOAHLW-UHFFFAOYSA-N	426.543	1.186	50	20	IDGD	
CC[C@@H](CS(=O)(=O)c1ccccc1)NC(=O)NNC(=O)c1ccc2c(c1)OCCO2	752702949	GQPLTVFKKUBGEV-HNNXBMFYSA-N	433.486	1.654	50	20	IDGD	
Cn1c(NNC(=O)c2ccc(S(=O)(=O)N3CCCCC3)cc2)nc2ccccc2c1=O	752905785	AGUAQSBLEVYFKW-UHFFFAOYSA-N	441.513	1.865	50	20	IDGD	
C[C@]1(CCC(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)CCC(=O)N1	753431661	VNMCBIRGHYVEIN-OAQYLSRUSA-N	435.956	1.054	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc(C(F)(F)F)c1	753841161	PUMCSSVQBAEKSG-UHFFFAOYSA-N	433.350	1.389	50	20	IDGD	
CCOc1nc2sccn2c1C=NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	753917868	CAODAQCRVZDASX-UHFFFAOYSA-N	427.895	1.859	50	20	IDGD	
Cc1noc(C)c1S(=O)(=O)NC1(C(=O)NNc2ccc(C(F)(F)F)nn2)CCCC1	755197100	CBIZGGABQIBKHX-UHFFFAOYSA-N	448.427	1.835	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)Nc1cccc(Cn2nc3ccccn3c2=O)c1	755938297	PWJFXXCEZVTIHZ-UHFFFAOYSA-N	446.467	1.914	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)cc1	756208215	VUVXQKJVWRQGGD-UHFFFAOYSA-N	446.529	1.716	50	20	IDGD	
CS(=O)(=O)Nc1ccc(NC(=O)NNC(=O)c2ccc3c(c2)OCO3)cc1Cl	756704311	FFXNDZMLGGSGKJ-UHFFFAOYSA-N	426.838	1.907	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)Nc3ccn(CCN(C)C)n3)n[nH]2)cc1OC	756766207	WJYATKHMPIDUFJ-UHFFFAOYSA-N	442.480	1.319	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)COc2ccc(F)cc2)cc1NS(C)(=O)=O	756781610	HNAVLRFQCLKAEW-UHFFFAOYSA-N	426.426	1.438	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)CN2C(=O)c3cccc([N+](=O)[O-])c3C2=O)c(OC)c1	757180162	QPOJIGFMQLOPHI-UHFFFAOYSA-N	428.357	1.129	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(F)(F)[C@@H](C(=O)NNC(=O)COc2ccc(C#N)cc2)C1	757758449	DELCAOXYNVLXBG-OAHLLOKOSA-N	438.431	1.977	50	20	IDGD	
NC(=O)c1cc(C(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)co1	759407500	CWCNMETZIAMDQZ-UHFFFAOYSA-N	431.412	1.155	50	20	IDGD	
CC(C)CNS(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1	759661307	FMZQOETXBRMWOH-UHFFFAOYSA-N	449.489	1.673	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)N[C@H]2CCOC[C@H]2OCC)c2ccccc2c1=O	760127391	PHIRYZFCSHYHMA-DLBZAZTESA-N	431.493	1.335	50	20	IDGD	
COC(=O)c1ccc(F)c(S(=O)(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)c1	763432890	KSOCMACJYLIYHO-UHFFFAOYSA-N	433.458	1.227	50	20	IDGD	
CCNC(=O)COc1cccc(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3n2)c1	763451449	ZRGXPSNLYGDOBE-UHFFFAOYSA-N	435.440	1.149	50	20	IDGD	
C=CCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc3ccccc3cc2O)cc1	763522798	QUXXAYDDABCZTD-UHFFFAOYSA-N	432.436	1.861	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(OC)c(OC)c(OC)c2)cc1OC	763550324	CYNBTIKLABWEMW-UHFFFAOYSA-N	433.417	1.129	50	20	IDGD	
CC(C)(C)OC(=O)c1ccc(Br)c(NC(=O)C(=O)NNC(=O)C2CC2)c1	763563146	ZLVJFMGLVJVSBG-UHFFFAOYSA-N	426.267	1.900	50	20	IDGD	
COc1ccc(OC(F)F)c(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1	763574111	WWBZDXRQPSWWAV-OAHLLOKOSA-N	437.355	1.223	50	20	IDGD	
COC(=O)[C@@H](C)Cc1ccc(NC(=O)C(=O)NNC(=O)c2c(C)nc3ccccn23)cc1	763628815	FXYIBLILAVWKHC-ZDUSSCGKSA-N	437.456	1.394	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccccc2CN2CCOCC2)cc1C	763664933	NVBQXCORJZGOPI-UHFFFAOYSA-N	440.500	1.301	50	20	IDGD	
CCOc1cc2c(cc1NC(=O)C(=O)NNC(=O)COc1ccccc1C#N)O[C@@H](C)C2	763808772	QNNBUUYIBUVOTL-ZDUSSCGKSA-N	438.440	1.445	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccnn2Cc2cccc3ccccc23)n1	763893301	UQYLWAXKGMMOLK-UHFFFAOYSA-N	445.483	1.684	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)C(=O)Nc2ccc3c(c2)S(=O)(=O)CC3)cc1	763896612	PCBWVNDPSQFHTJ-UHFFFAOYSA-N	433.511	1.203	50	20	IDGD	
COC(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(Br)s2)c1	763940149	DYWMEVREOSRFIK-UHFFFAOYSA-N	440.275	1.626	50	20	IDGD	
C[C@@H]1CCC2=S=C(C(=O)NNC(=O)C(=O)Nc3ccnn3Cc3ccccc3)C=C2C1	763943813	UQHYQIKUYDUHCM-CQSZACIVSA-N	437.525	1.855	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cccc([S@](C)=O)c3)n[nH]2)cc1	764111800	QLABMIQPZNGBJQ-PMERELPUSA-N	425.470	1.522	50	20	IDGD	
CN1CCN(c2ccccc2NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)CC1	764117029	MTSQRIFIYQESRL-UHFFFAOYSA-N	431.880	1.197	50	20	IDGD	
CCOc1cc2c(cc1NC(=O)C(=O)NNC(=O)Cc1ccccc1OC)O[C@H](C)C2	764131808	SBXYFIBRJIUZJP-CYBMUJFWSA-N	427.457	1.746	50	20	IDGD	
CN(C)CC(=O)NNC(=O)C(=O)Nc1ccc(C(=O)N2CCC[C@H]2c2ccccc2)cc1	764203959	GPWUARJVKSDWDB-IBGZPJMESA-N	437.500	1.311	50	20	IDGD	
COC(=O)CCSCc1cccc(NC(=O)C(=O)NNC(=O)c2cccc(C#N)c2)c1	764236404	XSVFYOPZZDZKFI-UHFFFAOYSA-N	440.481	1.754	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)C(=O)Nc1ccc(N2CCOCC2)c(F)c1	764244142	ALOUAIGHPRZQRU-UHFFFAOYSA-N	439.447	1.403	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cnn(C)c2C(F)F)cc1Br	764326958	RSQANOIMMVZBTC-UHFFFAOYSA-N	446.208	1.529	50	20	IDGD	
CS(=O)(=O)Cc1cc(F)ccc1NC(=O)C(=O)NNC(=O)CCCc1cccs1	764342405	YHNLQXXGPUGGDG-UHFFFAOYSA-N	441.506	1.541	50	20	IDGD	
CCCS(=O)(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)COCc2ccccc2)c1	764368551	YOVYBZNMUHLWAW-UHFFFAOYSA-N	448.501	1.141	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)C(=O)Nc1cccc(CN(C)Cc2cscn2)c1	764385768	IKSQRTTYYIYOTG-UHFFFAOYSA-N	438.513	1.878	50	20	IDGD	
CC(C)(C)OC(=O)NNC(=O)C(=O)Nc1ccc(NC(=O)CN2CCCCCC2)cc1	765386740	MYPJVXJVHZJDHX-UHFFFAOYSA-N	433.509	1.996	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)C#Cc3ccc4c(c3)OCO4)CC2)cc1	766639933	CKHCGDPGJMUMTJ-UHFFFAOYSA-N	434.496	1.040	50	20	IDGD	
CC(=O)c1c(C)[nH]c(C(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)c1C	766643186	UKWXMGLTDIHAMZ-UHFFFAOYSA-N	425.533	1.721	50	20	IDGD	
CCn1cnc2c1c(=O)n(CC(=O)NN=Cc1cncs1)c(=O)n2Cc1ccccc1	767756722	VQRYNVLESVHBPC-UHFFFAOYSA-N	437.485	1.035	50	20	IDGD	
CC(C)(O)C(=O)NNC(=O)c1cccnc1SCC(=O)Nc1ccc2c(c1)OCO2	768245960	GJGIDPSXXBNBFW-UHFFFAOYSA-N	432.458	1.073	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)[C@H]1CSCN1C(=O)OC(C)(C)C	768612628	PTAIXXDBRKFOHA-LLVKDONJSA-N	431.536	1.852	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)c1ccc(Cl)c(NS(C)(=O)=O)c1	768630325	QMUMLEUMVFHBQG-UHFFFAOYSA-N	447.922	1.881	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)Cc1ccc(S(=O)(=O)C(F)F)cc1	768634150	FTVOEYFWBGSIMQ-UHFFFAOYSA-N	448.469	1.781	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)CCn1c(S)nc2ccccc2c1=O	768636298	RASXXFWKLLGLBN-UHFFFAOYSA-N	448.526	1.631	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)c1ccc(N2CCCS2(=O)=O)cc1	769705785	LOTMERDPIIMDDC-UHFFFAOYSA-N	427.280	1.392	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccc(NC(=O)NNc3ccc(Cl)nn3)c2)CC1	769978460	WHWFAOSQSBXOFQ-UHFFFAOYSA-N	425.902	1.215	50	20	IDGD	
CNC(=O)COc1ccc(NC(=O)C(=O)NNc2ccc(Br)c(F)c2)cc1	770816230	RYDWLYZDUPACTB-UHFFFAOYSA-N	439.241	1.795	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)[C@H]3CCCN(C(=O)Nc4ccccc4F)C3)nc21	770972075	POPNUYGEBGEWHX-NSHDSACASA-N	428.428	1.595	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)[C@@H](C(C)C)N2CCCS2(=O)=O)cc1OC	772632141	WTYPVJYEYQNRNE-QGZVFWFLSA-N	427.523	1.305	50	20	IDGD	
O=C(C[C@@H](O)c1ccc(Cl)cc1)NNc1ccccc1S(=O)(=O)N1CCOCC1	772733726	DMJHYXDIFVHPAQ-QGZVFWFLSA-N	439.921	1.928	50	20	IDGD	
COc1cc(Br)c(S(=O)(=O)NNC(=O)NCc2ccco2)cc1C(=O)O	772856798	RFNSHVRUHWQKHH-UHFFFAOYSA-N	448.251	1.442	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2cc(-c3nnc4n3CCCCC4)ccc2F)n1	773727304	VSSVNPUWWQJECG-UHFFFAOYSA-N	440.439	1.691	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1cccnc1-n1cccn1	774009376	OOBANIYJUHFHKP-GFCCVEGCSA-N	428.836	1.474	50	20	IDGD	
CNS(=O)(=O)c1ccc([C@H](C)NC(=O)NNc2cccc(S(C)(=O)=O)c2)cc1	776616880	KKKRUDUKFVXMJW-LBPRGKRZSA-N	426.520	1.386	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)NCc2cccc(C(=O)NC[C@@H]3CCCO3)c2)c1	776618650	DDFCLKNOCMAOLL-SFHVURJKSA-N	446.529	1.825	50	20	IDGD	
CN(C)c1cnc(C(=O)NNC(=O)[C@@H]2Cc3ccccc3CN2Cc2ccccc2)cn1	779660747	MRBWVZLBBRBCBX-NRFANRHFSA-N	430.512	1.931	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1cn(-c2cccc(Cl)c2)nn1	780599626	JZWIPYJUTUNGET-UHFFFAOYSA-N	426.868	1.388	50	20	IDGD	
CCNC(=O)N(C)NC(=O)c1cccc(S(=O)(=O)NCc2ccc3c(c2)OCO3)c1	780708941	KSJYHBQWNKHKRE-UHFFFAOYSA-N	434.474	1.200	50	20	IDGD	
O=C(NCc1ccccc1CN1CC[C@@H](O)C1)NNC(=O)c1cc([N+](=O)[O-])ccc1O	781955358	POUKFDBZXVZDHR-MRXNPFEDSA-N	429.433	1.011	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2cc(Br)c(OC)cc2OC)nc1	782145522	TVYIADGEYUHZTP-UHFFFAOYSA-N	425.239	1.952	50	20	IDGD	
COCCOc1ccc(C#N)cc1NC(=O)C(=O)NN=c1sc2ccccc2n1C	783350163	WHNVSXYBOGUINX-UHFFFAOYSA-N	425.470	1.707	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)cc1	783408759	NGWLYJZKPNOSSI-UHFFFAOYSA-N	445.375	1.849	50	20	IDGD	
Cc1ccccc1NC(=O)NNC(=O)C(=O)Nc1ccc(NS(C)(=O)=O)c(Cl)c1	783416947	JLSASIYPLCEKHU-UHFFFAOYSA-N	439.881	1.811	50	20	IDGD	
Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)C(=O)NN[C@@]1(C)CCS(=O)(=O)C1	783423934	BOTGFFMMSMJDJI-FQEVSTJZSA-N	443.485	1.191	50	20	IDGD	
O=C(NNc1ccc(-n2cccn2)nn1)C(=O)Nc1cccc(Cl)c1N1CCOCC1	783433028	KHJNVIQZAIYXFL-UHFFFAOYSA-N	442.867	1.234	50	20	IDGD	
Cn1c(C2CC2)nc2cc(NC(=O)C(=O)NNC(=O)CNC(=O)c3cccs3)ccc21	784003668	LEMRTMXCMSWRKP-UHFFFAOYSA-N	440.485	1.028	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)C(=O)Nc2ccnn2Cc2ccccc2F)c1	784843545	AKRYZKRLTWSDBX-UHFFFAOYSA-N	431.449	1.556	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1cn(C)nc1-c1ccoc1	789266218	AWLNJDZRCRNLLM-UHFFFAOYSA-N	432.820	1.960	50	20	IDGD	
COC(=O)NCc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)cc1	789810218	LJFBKNNNINEKHP-ROUUACIJSA-N	440.456	1.201	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N[C@H](C)c1nnnn1C1CC1	790711728	BJGNPEJSVSTNLX-ZJUUUORDSA-N	438.286	1.629	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)c2ccc(F)c(S(C)(=O)=O)c2)cc1C	792461197	POGJQOPNMPFJQX-UHFFFAOYSA-N	442.490	1.780	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCN(C)[C@H](Cc2ccccc2)C1	792939686	HSBQLAKZKDWQCD-GOSISDBHSA-N	430.936	1.968	50	20	IDGD	
Cc1ccn(-c2ccc(NC(=O)C(=O)NNC(=O)CN3CCCc4ccccc43)cc2)n1	793022983	FRUUCNKPXHZLBZ-UHFFFAOYSA-N	432.484	1.719	50	20	IDGD	
COc1c(NC(=O)C(=O)NNC(=O)c2ccccc2F)cc(Cl)cc1C(=O)N(C)C	793023096	HJUZPATZOCOSCG-UHFFFAOYSA-N	436.827	1.589	50	20	IDGD	
CC(C)(C)c1cc(NC(=O)C(=O)NNC(=O)c2cccnc2)n(-c2ccc(C#N)cc2)n1	793023307	LWJXMTYWSRORIW-UHFFFAOYSA-N	431.456	1.836	50	20	IDGD	
CCNC(=O)N(C)c1cccc(NC(=O)C(=O)NNC(=O)Cc2c[nH]c3ccccc23)c1	796991029	YUSQKOXMKGJMQO-UHFFFAOYSA-N	436.472	1.662	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2ccc(F)cc2-c2cnn(C)c2)n1	797103322	JFRGTRBWWKIUAZ-UHFFFAOYSA-N	426.456	1.944	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)NCCN2CCN(C)C(C)(C)C2)c1	799685773	FULHPFQAXFIKJO-UHFFFAOYSA-N	442.358	1.428	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2cnn(-c3ccc(Cl)cc3)n2)cc1	802069204	XYPDKEBZRGDQFH-UHFFFAOYSA-N	434.865	1.791	50	20	IDGD	
COc1ccc(Cl)c(NC(=O)NNC(=O)c2cc(S(=O)(=O)NC(C)C)c[nH]2)c1	802116466	FGDFWQSNXWVABT-UHFFFAOYSA-N	429.886	1.830	50	20	IDGD	
O=C(NC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1)NNC(=O)c1cc(Br)c[nH]1	802338660	YNTFUUUEBPEGEG-CYBMUJFWSA-N	448.277	1.849	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)N[C@@H]1CCN(C(=O)Nc2ccccc2)C1	802495533	JFRVYWOCRUOLJD-CQSZACIVSA-N	435.444	1.586	50	20	IDGD	
CN(C(=O)OC(C)(C)C)[C@@H](C(=O)NNc1ccccc1S(C)(=O)=O)c1cnn(C)c1	802762355	CSEXWJFPNKPHIP-MRXNPFEDSA-N	437.522	1.875	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2ccc(-n3ccnc3)nn2)ccc1OCC(F)(F)F	807428910	KKKOUPSEMFOIHX-UHFFFAOYSA-N	435.366	1.994	50	20	IDGD	
O=C(NNC(=O)N1CCC[C@@H](CNS(=O)(=O)C2CC2)C1)c1cnn(-c2ccccc2)c1	808271576	WJHZCHGMYMEAPP-HNNXBMFYSA-N	446.533	1.021	50	20	IDGD	
COc1ccc(S(=O)(=O)NCC(=O)NNc2ccc(Br)nc2)cc1OC	810395940	QTVSBNABXMGUIU-UHFFFAOYSA-N	445.295	1.283	50	20	IDGD	
CC(C)(C(=O)NNS(=O)(=O)CCCN1C(=O)c2ccccc2C1=O)c1ccccc1	811684895	XSEYSFBXFYXBDA-UHFFFAOYSA-N	429.498	1.601	50	20	IDGD	
CNS(=O)(=O)c1ccc(-c2ccc(C=NNC(=O)Cc3cc(O)nc(S)n3)o2)cc1	812456135	PQEAERIQGQLGNU-UHFFFAOYSA-N	447.498	1.332	50	20	IDGD	
CN(C)CCc1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)cc1	813033044	BLHJYBCQENGWNM-UHFFFAOYSA-N	433.534	1.123	50	20	IDGD	
CC(C)(C(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1csc(-c2c(F)cccc2F)n1	814101594	CZASDUAFUGGVSM-SNVBAGLBSA-N	443.497	1.948	50	20	IDGD	
N#C[C@@H]1CCCC(=NNC(=O)C[C@@H](C(=O)NN=C2CCC[C@@H](C#N)C2)N2CCOCC2)C1	814854995	COSKCZKSQYOZEC-HLIPFELVSA-N	441.536	1.449	50	20	IDGD	
COCc1cc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCC3)cc(C(=O)OC)c1	815565854	BRUCXCPBAPIBOY-UHFFFAOYSA-N	431.470	1.570	50	20	IDGD	
CNC(=O)COc1cccc(CC(=O)NNC(=O)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)c1	819658509	MLUIBPASYXRRHN-MRXNPFEDSA-N	448.520	1.148	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)N(C)CCCC(=O)NNC(=O)CNc2ccccc2)cc1	823327711	AZUPDTRBBWFUTQ-UHFFFAOYSA-N	446.529	1.549	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2CCN(C(C)C)C[C@@H]2c2cnn(C)c2)cc1C	849485552	GXBFOLAKGOFJFB-WOJBJXKFSA-N	440.548	1.637	50	20	IDGD	
COc1ccc2[nH]cc(CC(=O)OCC(=O)NNC(=O)c3ccc(OC)c(OC)c3)c2c1	915515486	LVMMSQVAWNFSBL-UHFFFAOYSA-N	441.440	1.741	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)nn1C(C)(C)C	916125048	BBEBADSMALOMEW-UHFFFAOYSA-N	433.534	1.806	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)NCc1ccc(N2CCO[C@H](C)C2)nc1	916393323	YHLUTKKOYMAIDY-OAHLLOKOSA-N	429.477	1.225	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCCCN1C[C@@H](C)C[C@H](C)C1	916460552	KEELNCWNLCFLLF-GJZGRUSLSA-N	438.598	1.600	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)NCCN1CCN(c2ccc(F)cc2)CC1	916513609	GXBDACBNPGLPBW-INIZCTEOSA-N	447.486	1.885	50	20	IDGD	
CCCCOc1ccc(C(=O)NCC(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)cc1	916562870	URQYKSIYWUSNEF-UHFFFAOYSA-N	440.500	1.998	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)NCCS(=O)(=O)NCc1ccccc1	916645115	DHSWPELYMWIMCP-AWEZNQCLSA-N	438.481	1.043	50	20	IDGD	
O=C(NCc1cccc(Cn2cccn2)c1)NNC(=O)c1csc(N2CCOCC2)n1	918001537	BGKQWNNGZXOQOC-UHFFFAOYSA-N	441.517	1.369	50	20	IDGD	
COc1cccc(/C=C(\C#N)C(=O)OCC(=O)NCc2ccc(S(C)(=O)=O)cc2)c1	918977370	WDWCYSMUWVSZPW-LICLKQGHSA-N	428.466	1.865	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCc2ccn(-c3ccccc3)n2)nc1	919658053	MAEWRNXWIGAOSA-UHFFFAOYSA-N	429.506	1.780	50	20	IDGD	
O=C(NNC(=O)c1ccc2nc(O)oc2c1)c1cccc(S(=O)(=O)N2CCCC2)c1	919807476	OEYXPASXYGXDQR-UHFFFAOYSA-N	430.442	1.393	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1)NNc1c(F)c(F)nc(F)c1F	920424268	ZYCLJLRXHWPCRG-UHFFFAOYSA-N	437.331	1.358	50	20	IDGD	
Cc1c(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cnn1C1CCCC1	1323148941	FOWSFYIUQRWQKO-SFHVURJKSA-N	428.445	1.451	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](N)Cc2cscn2)C1	1777968989	VRFAANKJVUXMEV-YYAJDYIMSA-N	428.986	1.544	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccn(CCOC)n2)C1	1778245112	QEMPXMPXTQBFTO-XAUMDUMWSA-N	426.945	1.674	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H]2CCCN(C)C2)C1	1780569020	XRYQCJBIKUQBAI-WOCWXWTJSA-N	444.414	1.873	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)nc(O)n1)C2	1780712077	VFZSVGLOLUOCNN-NXOUGTEYSA-N	447.319	1.252	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)c1ccco1)C2)[C@H](F)Br	1780770732	XZIQISBMHXLHTG-XJIUQZFPSA-N	433.274	1.517	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(N4CCOCC4)cn3)CCO2)C1	1781213630	LFKYCLVJAUBHTM-DYESRHJHSA-N	436.940	1.379	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc4c(c3)CNC4=O)CCO2)C1	1781229491	DVHDVXGKNKPASA-VQTJNVASSA-N	440.327	1.610	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)CCO2)C1	1781233638	CKVRAUMONOOWRY-ROUUACIJSA-N	446.287	1.980	50	20	IDGD	
O=C([C@H](F)Br)N1CC[C@@]2(C1)CN(C(=O)[C@@H]1CCc3ccoc3C1)CCO2	1781325211	KZWOLPITAZCNRT-QIIPPGSGSA-N	429.286	1.905	50	20	IDGD	
O=C(c1cnnc2ccccc12)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781330188	SROYLMQKILNWGC-QAPCUYQASA-N	437.269	1.764	50	20	IDGD	
O=C(c1cccc2nc[nH]c12)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781331765	VWSHCMJMWXLZQB-YOEHRIQHSA-N	425.258	1.697	50	20	IDGD	
Cc1cc(C)n(CCC(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](F)Br)C3)C2)n1	1781333116	CSJLMOUHZRUBEB-RDJZCZTQSA-N	431.306	1.410	50	20	IDGD	
COc1cccc(OC)c1C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781333638	HSQCOUCENNYDCK-CRAIPNDOSA-N	445.285	1.838	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnn(C)c1)C2	1781899721	DOFWODOQCMPOEZ-IIDMSEBBSA-N	427.343	1.721	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C[C@H](N)c1cccnc1)C2	1782170711	UTDFQKWNUXDVLN-BMQTXXJKSA-N	438.956	1.239	50	20	IDGD	
CCC(=O)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](Br)Cc1ccccc1)CCO2	1783095045	QPLFOTJUIFEHPY-OXQOHEQNSA-N	437.334	1.802	50	20	IDGD	
CC(C)(C)CCCCCC(=O)N1CC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2	1783390827	LNFOCNJSHJYJAQ-DEOSSOPVSA-N	444.381	1.807	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H]3CCc4ccccc4O3)C2)C1	1783848416	LQOMJOBVFWPZDR-VHFSOBRXSA-N	437.334	1.994	50	20	IDGD	
COc1cc(CC(=O)N2CCO[C@]3(CCN(C(=O)C(Cl)Cl)C3)C2)ccc1[N+](=O)[O-]	1783947308	SIARVMHCBUJKQT-GOSISDBHSA-N	446.287	1.780	50	20	IDGD	
CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCO[C@@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783952904	WQSOVZLWHHADEA-KPZWWZAWSA-N	438.352	1.923	50	20	IDGD	
Cc1cccc(C)c1SCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]2C1	1784091467	VLFHFJPWSNXPLZ-FJIDUMEYSA-N	440.993	1.975	50	20	IDGD	
CCOc1ccc(Cl)cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]2C1	1784091953	FWNGPSWYXDKTIE-PTOXDTDZSA-N	445.343	1.932	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cn3cc(Cl)cn3)[C@H]2C1	1787004646	GSZHYRBTUDUGIP-XWUBHJNHSA-N	433.734	1.300	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)c1ccc(Br)cn1	1788831139	LGIHVHOVVYHCCU-LVGORTOPSA-N	446.729	1.037	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(Cl)nn3)[C@H]2C1	1788836761	LJAOATPFZCLVFZ-BTIUKSQHSA-N	435.739	1.960	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C[C@H]3C[C@@H]4CC[C@H]3C4)[C@H]2C1	1790907374	ZMRLYNBGHJWKHC-JIFZMYKYSA-N	434.581	1.165	50	20	IDGD	
CCc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](Br)CC)[C@H]3C2)n(C)n1	1790960645	PITGCWBQDLTVRN-QEWYBTABSA-N	441.370	1.749	50	20	IDGD	
CC(=O)O[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]2C1)C(C)C	1791055924	KSPRNEVPAZQCAB-AKSVOJBYSA-N	433.343	1.337	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc4c3cnn4C)C[C@@H]21	1791254319	OIGKTAZVYRNUHG-UHEFJODHSA-N	434.924	1.420	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(OC)c3F)[C@H]2C1	1792108462	XUDUJGKFCGLLLR-QEWYBTABSA-N	428.888	1.681	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(C2CC2)on1	1792777256	UQYSAIREBQYXMT-XMOXNHLCSA-N	438.488	1.938	50	20	IDGD	
C[C@@H]1Oc2ccc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)C(C)(C)CCl)cc2NC1=O	1792784029	JHTBFWPHHWKNNW-FRQROOTJSA-N	449.935	1.874	50	20	IDGD	
Cc1ccn2ncc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@H](C)CBr)c2c1	1792868084	OQJUTXIVIDTUMA-ZXFNITATSA-N	449.349	1.877	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(=O)c1ccc(Cl)cc1	1792948456	CSVCHXCESBKRSE-IKVITTDRSA-N	443.725	1.896	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(OCC3CC3)c(F)c1)C2)[C@H](O)CCl	1792983336	HNGUKJTUJXFLOP-LORHWOILSA-N	440.899	1.417	50	20	IDGD	
O=C(Cc1ccc(Br)nc1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCl	1793115278	HKQPJRKVEBGOJM-CRWXNKLISA-N	430.730	1.625	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1CCNC1=N	1796027789	YJVZEEVBCRUBQE-FZBFXSHXSA-N	442.470	1.350	50	20	IDGD	
COc1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)cc1Cl	1796192886	VZJLYFMUFXUCLE-BCDXTJNWSA-N	442.708	1.594	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Cl)C1	1796368041	BETZKWTZCOLZIP-BDLOOMQFSA-N	447.935	1.758	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C(F)(F)C(F)F)C2	1796890734	ISAGVTZRVGEWFJ-MSSISCLTSA-N	431.390	1.659	50	20	IDGD	
C[C@H](NNc1ccccc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CO[Si](C)(C)C	1797953778	GURWHSWBIKHJCT-LJCCNALRSA-N	434.613	1.433	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@]1(C)CCCN1)C2	1799220624	KWWZRMLPCWAECM-JEZSTIGHSA-N	444.488	1.914	50	20	IDGD	
Cc1nnc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Br)s1	1799344699	RUJXGFWBLRRVRB-DJBIQUGXSA-N	435.319	1.059	50	20	IDGD	
C[C@@H](Oc1ccccc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2	1799379013	KPDIKVZHMJWLMG-CNRIWFPOSA-N	429.286	1.734	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](F)Br)c1ccc2c(n1)OCCO2	1800159726	ZGDFJLPIZJORMF-FBKDDSFISA-N	428.258	1.795	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccnc3c(O)cccc13)C2	1800762142	OOUJVTUSGZHGOK-KOFHJDLBSA-N	448.317	1.927	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)nc3ccccc13)C2	1800978758	ZYWUYLPIAXKAIX-UESRRSCYSA-N	433.892	1.397	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccccc1C1CC1)C2	1801012254	QCSUYWQLTCLCRA-FAQVEIGNSA-N	428.533	1.140	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccc(F)cc1OC	1802181489	NDYXHPYPLNGZNS-MVWRLGRASA-N	428.888	1.220	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)[C@@H]1C[C@@H]1C1CC1	1802990740	VFZFZUFCSHKDRV-BDKRGJGYSA-N	433.317	1.127	50	20	IDGD	
COC(=O)CCCCCC(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]1c1cccnc1	1803145671	GPKRGWUVJPUDET-HLIPFELVSA-N	439.940	1.811	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2nccnc2C(N)=O)[C@H]1c1cccnc1	1803692313	SGXLJQXXCOKARA-MPGHIAIKSA-N	444.923	1.698	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1cc(F)ccc1F)c1ccc(B(O)O)cc1	1804099209	UISWXZLZLWQXST-REPLKXPHSA-N	428.244	1.139	50	20	IDGD	
Cc1cc[nH]c1C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1	1805010019	SVRLORFOCGDHHO-JXFKEZNVSA-N	447.499	1.350	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)c1[nH]nc2ccncc12	1808095153	LNWNKIRSGMCHRE-FDQGKXFDSA-N	428.880	1.272	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC2(CCCN(C(=O)Cc3cccc(F)c3)C2)CC1	1809238092	ZPRICEBJVYCKSO-UHFFFAOYSA-N	432.540	1.972	50	20	IDGD	
Cc1cc(C(=O)NCC(=O)NC[C@@H]2CCN(C(=O)[C@@H](F)Cl)[C@H]2c2cccnc2)no1	1810375538	IZFYCEREUVMKBO-RRQGHBQHSA-N	437.859	1.348	50	20	IDGD	
COC(=O)C1(C(=O)NC[C@@H]2CCN(C(=O)CO[Si](C)(C)C)[C@@H]2c2cccnc2)CC1	1812689464	FLBYRVSAPUHYGB-FUHWJXTLSA-N	433.581	1.892	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)/C=C\C(=O)NC2CC2)[C@H]1c1cccnc1	1812866089	HILQDQRDPRMFRX-MXSDWFRLSA-N	449.349	1.706	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)Cc2ccc(O)cn2)[C@H]1c1cccnc1	1813033451	NTOBQGLLTITMBL-BPAFIMBUSA-N	432.908	1.685	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)[C@@H](C)S)[C@@H]1c1cccnc1	1813036927	MYINBRJVXADFRM-SFZPGSKNSA-N	442.545	1.540	50	20	IDGD	
Cc1ccoc1C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1813070911	OBWPUROUPJOOME-YLJYHZDGSA-N	427.505	1.676	50	20	IDGD	
Cc1cc(C)n(CCC(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)n1	1813303120	DYOVUANLYOTOQI-BJLQDIEVSA-N	433.940	1.591	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)/C=C/c2cnccn2)[C@H]1c1cccnc1	1813486765	LZWWJNKJQAHMKH-HKGJNHHRSA-N	429.908	1.845	50	20	IDGD	
C[C@H](CBr)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](C)n2cnnn2)[nH]n1	1814783433	OLQUREQKKNEZHY-NQBHXWOUSA-N	439.318	1.681	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1	1815349952	AFUARPSTSSVWLZ-KGLIPLIRSA-N	435.742	1.456	50	20	IDGD	
Cc1cc2nnc(C(=O)Nc3cc([C@H]4CCCCN4C(=O)[C@H](O)CCl)[nH]n3)c(C)n2n1	1818587936	LWKDOGXHXZVGST-ZIAGYGMSSA-N	446.899	1.370	50	20	IDGD	
CCCC(=O)N[C@@H](C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1	1819565509	MTUQIXFXRRIOAD-HOCLYGCPSA-N	449.556	1.080	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)C/N=C/c3ccco3)sc2C1	1819956121	DEOQBKSWKIHSDL-PUFAJPFRSA-N	446.533	1.140	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1)c1cc(-n2ccnc2)ccn1	1820341240	CRISWOBMHXEFGX-DLBZAZTESA-N	443.895	1.896	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1cc([C@H]2CCCCN2C(=O)Cn2cnnn2)[nH]n1	1822086968	DOQVAEUHJZKLEH-CMPLNLGQSA-N	425.291	1.262	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CN2CCNC2=N)[nH]n1	1822088157	QHEKWNXBLJBYOM-WCQYABFASA-N	440.346	1.415	50	20	IDGD	
C[C@@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)n1cccc1	1822672933	UNGULQRFKJNWFD-KXBFYZLASA-N	435.293	1.458	50	20	IDGD	
O=C(N[C@@H]1CCc2nc(NC(=O)[C@H]3CC=CCC3)sc2C1)c1ccc(B(O)O)cc1	1822786284	DFBIJMYBAKJINY-XJKSGUPXSA-N	425.319	1.405	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCS(C)(=O)=O)n[nH]1	1822971945	CSMTYOWBOUKGEP-JQWIXIFHSA-N	435.344	1.620	50	20	IDGD	
C[C@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)[C@H](C)n3ccnn3)sc2C1	1824692155	BIGXMBWKQIDNBX-GUBZILKMSA-N	427.328	1.691	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC([C@@H]2CCCCN2C(=O)C[C@@H]2NC(=O)NC2=O)CC1	1825075470	ZWJMIQNQVLVOKX-HOTGVXAUSA-N	438.601	1.056	50	20	IDGD	
C[C@H](C(=O)N[C@@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1)n1cccc1	1826092125	MWCWXICODIZAON-ZIAGYGMSSA-N	432.550	1.491	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)[C@H](C)n3cnnn3)sc2C1	1826984459	GCZCNLSKMAYLHI-GUBZILKMSA-N	442.343	1.476	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H](N)Cc2cccnc2)CC1	1827642960	DSEXCOSGRURYCY-HSALFYBXSA-N	436.984	1.825	50	20	IDGD	
Cc1nc[nH]c1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1	1828926140	AFRAFPSNWWVPQC-GOSISDBHSA-N	439.520	1.264	50	20	IDGD	
CCS(=O)(=O)CC(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](F)Br)CC1	1830375519	DQFFYJSFFPLPPL-DZGCQCFKSA-N	441.363	1.731	50	20	IDGD	
CCn1nccc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)CBr)CCO2	1830537600	KZUXFEZYAVAXAD-KDOFPFPSSA-N	443.342	1.004	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccc4ncnn4c3)C2)C1	1831654472	LBVGVSXOJCYBCD-UTKZUKDTSA-N	449.939	1.136	50	20	IDGD	
Cc1cccnc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1	1831835366	UUCYEJCZIARKCR-RBUKOAKNSA-N	430.332	1.696	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC(N2CCC(NC(=O)c3csnn3)CC2)CC1	1833556794	OIURLOMRHJQNLW-UHFFFAOYSA-N	425.631	1.575	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)c3cnco3)CC2)CC1	1833594683	XUSFVTLVBLEMHZ-ZDUSSCGKSA-N	427.343	1.891	50	20	IDGD	
CCn1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)n1	1834409121	XOJKYRARCMDDMY-ZWKOTPCHSA-N	433.336	1.209	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC(OC2CCN(C(=O)[C@H](C)CC(N)=O)CC2)CC1	1836670858	VLWLIGLPYQXXEU-KGLIPLIRSA-N	446.386	1.528	50	20	IDGD	
N[C@H](CC(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)c1cccnc1	1836716886	WKUPUXYIDKEGTO-MOPGFXCFSA-N	438.956	1.070	50	20	IDGD	
CC(C)N[C@H](C(=O)N1CCOC[C@@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1)C(C)C	1837711889	VZCZUAMCJAIIFK-PZJWPPBQSA-N	443.661	1.317	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cncc(F)c3)C2)C1	1837712241	KYUCPIYLZGSYKJ-LJQANCHMSA-N	425.533	1.142	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CCCSC3)C2)C1	1837717831	OXKWSWQQMKVLLA-VQIMIIECSA-N	430.643	1.438	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC(OC2CCN(C(=O)[C@@H]3CCC(=O)N3)CC2)CC1	1837737169	LLTXWJFUDUKYMK-KRWDZBQOSA-N	425.602	1.115	50	20	IDGD	
O=C(c1cc(Cl)cc2nn[nH]c12)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1838618632	CWBHFCOZXOGQBE-WMLDXEAASA-N	446.266	1.216	50	20	IDGD	
CCOc1ccccc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](Cl)COC)C2)C1	1838886499	ZXDBQRNJOJPDJP-LAUBAEHRSA-N	440.924	1.409	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4ncsc4[nH]3)C2)C1	1839145633	NRRUFXGHWIYHRS-SGTLLEGYSA-N	426.926	1.712	50	20	IDGD	
CN1CCC(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)CC1	1839150108	ZIRNJGXYKJCLBX-RTBURBONSA-N	436.380	1.021	50	20	IDGD	
COc1cc(Cl)ccc1CC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1839752963	FFIPDIXGENECHF-HKUYNNGSSA-N	449.306	1.882	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)(Cl)Cl)CCO2	1839923269	VRUOCORZSOFZKO-ZWNOBZJWSA-N	438.135	1.067	50	20	IDGD	
O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)C1CC3(CCC3)C1)CCO2	1840602812	QVKOLIOIBWKEJJ-LJQANCHMSA-N	429.355	1.808	50	20	IDGD	
C=C1C[C@@H](C(=O)N2CC3(CCCN3C(=O)[C@H](O)CCl)C2)N(C(=O)OC(C)(C)C)C1	1841353977	AWFLDXUZESTJPY-LSDHHAIUSA-N	427.929	1.355	50	20	IDGD	
O=C(CCS(=O)(=O)c1ccccc1)N1CC2(CCCN2C(=O)CCBr)C1	1842637710	WXZYKBKZSOGYEX-UHFFFAOYSA-N	443.363	1.839	50	20	IDGD	
O=C(C1CCN(c2ccccc2)CC1)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843010466	TTYXLTAPEXLZDE-UHFFFAOYSA-N	447.344	1.100	50	20	IDGD	
O=C(c1ccccc1C(F)(F)F)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843011780	RLAXZGNBWHGGRK-UHFFFAOYSA-N	432.207	1.516	50	20	IDGD	
C[C@H](C(=O)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1)c1ccc(Cl)cc1	1843012751	LFCNGKAQVAQZDA-HNNXBMFYSA-N	426.709	1.641	50	20	IDGD	
CCOc1ncc(Cl)cc1C(=O)N1CCCC12CN(C(=O)CCC(=O)NN(C)C)C2	1844519913	SVEYEOGHOHVQAN-UHFFFAOYSA-N	437.928	1.324	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)c2ccccc2C(F)(F)F)C1	1844886395	VXIDSYVAZYTUFY-UHFFFAOYSA-N	432.207	1.516	50	20	IDGD	
O=C([C@H](O)CCl)N1CC2(CCCN2C(=O)Cc2ccc(Br)cc2F)C1	1845943319	MIZRRYIVUMWHMB-CQSZACIVSA-N	433.705	1.934	50	20	IDGD	
CC(=O)N[C@@H](Cc1cccc(F)c1)C(=O)N1CCCC12CN(C(=O)CO[Si](C)(C)C)C2	1847013479	LWPHBXGXNPWVJC-IBGZPJMESA-N	449.599	1.928	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](O)[C@](C)(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](F)Cl)C1	1847238168	VZFYSHDYIIHAGK-AUQLDDPISA-N	447.935	1.731	50	20	IDGD	
O=C(c1ccc2[nH]nc(Br)c2c1)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl	1847564398	ZERNZCYWAKLAEW-IHRRRGAJSA-N	441.713	1.741	50	20	IDGD	
O=C1C[C@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](F)Br)CN1C1CCCC1	1848040643	PKUZMJNQHKBGQW-ATVPRXPUSA-N	430.318	1.670	50	20	IDGD	
COC[C@@H](C)NC(=S)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	16187214	OEGBBJWRRWYBMI-LLVKDONJSA-N	428.561	1.693	50	20	IDGD	
O=C(COC(=O)CSc1ccc(F)c(F)c1)NNC(=O)c1cccc([N+](=O)[O-])c1	17834697	DSQWRXLOWWNLAJ-UHFFFAOYSA-N	425.369	1.970	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCc1ccnc(-n2cccn2)c1	28377068	NCXQSFORLQZWPO-UHFFFAOYSA-N	442.505	1.013	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2ccc(N3CCCC3=O)cc2)cc(OC)c1OC	28807995	BFNMGXVIGJOXMW-UHFFFAOYSA-N	449.485	1.463	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)CCCOc2ccccc2C)cc1	105636874	OTNZNJUPGGNGDO-UHFFFAOYSA-N	433.530	1.931	50	20	IDGD	
COCCCNC(=S)N(C)NC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	726075780	GEFMTBVPLMAIOG-UHFFFAOYSA-N	428.580	1.349	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)NC[C@H](c1ccccc1Cl)N1CCCC1	726084984	FWRUYMYXANCCIV-MRXNPFEDSA-N	433.896	1.830	50	20	IDGD	
C=CCn1c(SCC(=O)NNC(=O)C(=O)NC(C)C)nnc1-c1ccc(Cl)cc1	726616521	ODNZBRRPEHUTPE-UHFFFAOYSA-N	436.925	1.549	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@@H]2CCCN2C(=O)OCC(F)(F)F)cc(OC)c1OC	727785415	VTUIENCRIUWCRC-NSHDSACASA-N	449.382	1.637	50	20	IDGD	
CCCCC(=O)N1CSC[C@H]1C(=O)NNC(=O)c1cc(OC)c(OC)c(OC)c1	727983180	PCTWZKYSDSAIOQ-ZDUSSCGKSA-N	425.507	1.565	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCCC(=O)NNc2nc(-c3ccccc3)no2)cc1	728080337	FFPXHQBCNFWXAK-UHFFFAOYSA-N	431.474	1.947	50	20	IDGD	
O=C(NNc1nc(-c2ccccc2)no1)c1ccc(S(=O)(=O)NC[C@H]2CCCO2)cc1	728081258	MBZWHOAQRDJFSF-MRXNPFEDSA-N	443.485	1.951	50	20	IDGD	
CCCc1nnc(S)n1CC(=O)NNC(=O)c1cc(OC)ccc1Br	728609086	MDGFLPVDTZIFLG-UHFFFAOYSA-N	428.312	1.752	50	20	IDGD	
Cc1cc(C=NNC(=O)C2CCN(c3ncccn3)CC2)c(C)n1CCN1CCOCC1	728783289	ICJARTUQEILPKS-UHFFFAOYSA-N	439.564	1.594	50	20	IDGD	
C[C@]1(c2ccc3ccccc3c2)NC(=O)N(CC(=O)NNC(=O)Cc2cccnc2)C1=O	728856704	VPOKKBGDEAZDBW-HSZRJFAPSA-N	431.452	1.392	50	20	IDGD	
COc1cc(CCC(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc(OC)c1	729994154	IIZVUOBRXUPTMC-LJQANCHMSA-N	444.440	1.167	50	20	IDGD	
C[C@]12CCC(=O)N1c1ccccc1C(=O)N2CC(=O)NNC(=O)CCc1ccccc1O	730033633	KAHRIONPQBSGIC-HSZRJFAPSA-N	436.468	1.471	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)CCCN(C)S(=O)(=O)c1ccc(C(C)=O)cc1	731491303	HXIKSIYMJCSNSP-UHFFFAOYSA-N	447.513	1.760	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)N1CCN(CC(=O)Nc2ccccc2Cl)CC1	731499898	OVPVRTJIPVLQHI-UHFFFAOYSA-N	445.907	1.959	50	20	IDGD	
CCOc1ccccc1C(=O)NCCCC(=O)NNC(=O)C(=O)Nc1ccc(C)c(C)c1	731992328	KAOGGJCRCKIPRF-UHFFFAOYSA-N	440.500	1.998	50	20	IDGD	
CSCC[C@@H](C(=O)NNc1nc(-c2ccncc2)no1)N1C(=O)[C@H]2CCCC[C@H]2C1=O	732065420	FNCYIEPXNLDYCM-ZNMIVQPWSA-N	444.517	1.872	50	20	IDGD	
COC(=O)c1cc(OC(=O)c2ccc(OC)c(S(=O)(=O)N(C)C)c2)ccc1[N+](=O)[O-]	732654347	SFIXXIKEBUJMAX-UHFFFAOYSA-N	438.414	1.860	50	20	IDGD	
CC(C)(C)S(=O)(=O)CCNC(=O)NNC(=O)COc1ccc(Br)cc1	733353175	WETZARPQKVRDLN-UHFFFAOYSA-N	436.328	1.372	50	20	IDGD	
CC(C)n1c(C(F)(F)F)nc2cc(C(=O)NNC(=O)N[C@@H]3CCS(=O)(=O)C3)ccc21	734427882	FJWYQCPKIJYLMD-LLVKDONJSA-N	447.439	1.767	50	20	IDGD	
NS(=O)(=O)c1ccc(F)c(CNC(=O)NNC(=O)c2c(Cl)cccc2Cl)c1	734525264	YBCUEVRCLHFBHU-UHFFFAOYSA-N	435.264	1.924	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)N[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)cc1	734539758	AINABFMXMJISCI-HXUWFJFHSA-N	440.500	1.768	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)N(C)CCCC(=O)NNc2ccc(Cl)nn2)cc1	735687521	LCBCLTWFTQHXRQ-UHFFFAOYSA-N	425.898	1.877	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CSc2nnc(SCC(N)=O)s2)cc1C	735979785	QLHWLHYRJBRVRW-UHFFFAOYSA-N	431.590	1.601	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)NCc1cccc(C(=O)NC[C@@H]2CCCO2)c1	738990884	QTQMLDCTFOUFSY-FQEVSTJZSA-N	440.500	1.643	50	20	IDGD	
CC(C)n1ccc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)n1	739052383	QNSJUQABEOFWCC-UHFFFAOYSA-N	448.549	1.783	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)N[C@@H]2CCN(c3ccc(Cl)cc3)C2=O)cc1	740483309	AGIIKNQIYRANOA-QGZVFWFLSA-N	432.864	1.863	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)NCc1cc(F)ccc1N1CCOCC1	740903708	RZFJZDYVKXMENO-UHFFFAOYSA-N	432.452	1.580	50	20	IDGD	
CN(CCCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)C1=NS(=O)(=O)c2ccccc21	741882062	KCDBFMOVZMXWSR-UHFFFAOYSA-N	445.457	1.217	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCc2c[nH]nc2C1)c1cccc(S(=O)(=O)N2CCCCC2)c1	742468242	QOYAYJPPUIEFDI-OAHLLOKOSA-N	431.518	1.150	50	20	IDGD	
Cn1ccc(N2CCC[C@@H](NC(=O)NNC(=O)c3ccc(Br)s3)C2=O)n1	743518714	QNFLNKITYADRMD-SECBINFHSA-N	441.311	1.384	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(I)cc2)cc1	744484766	ZJLKFAVGENCFBV-UHFFFAOYSA-N	449.204	1.781	50	20	IDGD	
Cn1ccnc1[C@H](NC(=O)NNC(=O)c1cc([N+](=O)[O-])ccc1O)c1ccccc1F	745394597	JIXKLNSCVOQVRI-MRXNPFEDSA-N	428.380	1.907	50	20	IDGD	
C[C@H]1C[C@@H](NC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)C(=O)N1c1ccccc1	745881704	LDMVUSPFLMXTFI-WMLDXEAASA-N	434.456	1.716	50	20	IDGD	
CC[C@H](C)C[C@H](C)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	745889306	GVIRZKDMTJFXBR-GJZGRUSLSA-N	426.539	1.476	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)CC[S@](=O)c2ccc3c(c2)OCCO3)c1	746093645	UPGHGPIMHNRPOZ-PMERELPUSA-N	432.498	1.799	50	20	IDGD	
CC[C@@H](NC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)C1CCOCC1	746427115	YKTNFBIIQTZTFI-GOSISDBHSA-N	438.550	1.620	50	20	IDGD	
Cc1c(C(=O)NNC(=O)Cc2cn3ccccc3n2)nnn1-c1cccc2cnccc12	746548394	HOOZFIQUHAHFKA-UHFFFAOYSA-N	426.440	1.775	50	20	IDGD	
Cc1ccc(CNC(=O)C2CCN(C(=O)NNC(=O)CNC(=O)c3ccco3)CC2)cc1	747501342	CGXHZLKEHXVVRK-UHFFFAOYSA-N	441.488	1.087	50	20	IDGD	
N#Cc1ccc(NNC(=O)C2CCN(S(=O)(=O)c3ccc4c(c3)OCCO4)CC2)cc1	748115074	VSOJVLUXQINJPH-UHFFFAOYSA-N	442.497	1.873	50	20	IDGD	
C[C@H](c1ccccc1)[C@@](C)(O)C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	748620577	RCUHUJHFQKJFGW-VGOFRKELSA-N	446.573	1.621	50	20	IDGD	
NS(=O)(=O)c1cccc(N2C[C@@H](C(=O)NNc3cc(F)c(F)c(F)c3)CC2=O)c1	748811845	JADJSWQIZLQLAA-VIFPVBQESA-N	428.392	1.248	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)c2ccc(-c3n[nH]c(C4CC4)n3)cc2)c2ccccc2c1=O	748837727	HSRQYASOXRJXBS-UHFFFAOYSA-N	429.440	1.671	50	20	IDGD	
COc1cc(S(=O)(=O)NNC(=O)c2c(C)nc3ccccn23)c(Cl)cc1C(=O)O	749141446	KIBUWQFHVHWSRZ-UHFFFAOYSA-N	438.849	1.626	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)NCCNC(=O)c2cccc(Br)c2)c1	749917514	FNAURMNXMVNESD-UHFFFAOYSA-N	449.305	1.897	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C2CCN(S(=O)(=O)c3ccc4c(c3)OCCO4)CC2)o1	752525140	WGKKUIGVONVHBT-UHFFFAOYSA-N	449.485	1.221	50	20	IDGD	
C[C@@H](NC(=O)/C(C#N)=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)c1nc[nH]n1	752637710	LINHKLVBFWRALQ-ZBQKXELDSA-N	438.879	1.981	50	20	IDGD	
O=C(NNC(=O)N1CCS(=O)(=O)[C@@H]2CCCC[C@H]21)c1ccc(Br)s1	753811329	SSJUKALNEVDBKX-MWLCHTKSSA-N	436.353	1.907	50	20	IDGD	
Cc1ccccc1-n1c(C)cc(/C=C(\C#N)C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)c1C	754753606	GJEJGTZBYNCCTK-HDZGYNCQSA-N	440.525	1.892	50	20	IDGD	
COC(=O)CNC(=O)Cc1ccc(NC(=O)NNC(=O)c2cc(C)nc3ccccc23)cc1	755863312	CHNRZDNBHFVEFU-UHFFFAOYSA-N	449.467	1.841	50	20	IDGD	
COC(=O)NCc1ccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1	756609502	CLJGZFSREKDDGK-UHFFFAOYSA-N	449.489	1.259	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2ccc(C#N)cc2)cc1S(=O)(=O)NC1CC1	756683878	WNYFYDJUOBHOQK-UHFFFAOYSA-N	429.458	1.474	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1ccc2cc(Br)ccc2c1	757704926	WOKHUOHHSCDFIH-SECBINFHSA-N	429.296	1.693	50	20	IDGD	
COCCOc1cc(C(=O)NNC(=O)c2nnc(O)c3ccccc23)nc2ccccc12	758070486	BWAISOBMVVRSAN-UHFFFAOYSA-N	433.424	1.984	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)CNS(=O)(=O)c2ccc(OC(F)(F)F)cc2)nc1	759724716	DVMKPFZFUUCLKE-UHFFFAOYSA-N	448.379	1.188	50	20	IDGD	
CS(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)Cn2ccc3ccccc32)cc1F	760361830	BAKOGAZIVBJYLX-UHFFFAOYSA-N	425.463	1.194	50	20	IDGD	
COc1cc(OC)cc(C(=O)NCC(=O)NNC(=O)CSc2ccccc2OC)c1	761636998	MMVWDDUAWCOMGX-UHFFFAOYSA-N	433.486	1.382	50	20	IDGD	
Cc1cccc(-c2nnc(S)n2CCC(=O)NNc2nccc(N3CCOCC3)n2)c1	762854155	WJDHZPFITQCVSO-UHFFFAOYSA-N	440.533	1.702	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)CCC(=O)Nc2nnc(C3CC3)o2)n[nH]1	763156204	XVXMFMVPDOEYEA-UHFFFAOYSA-N	439.432	1.526	50	20	IDGD	
CC(=O)N(Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1)C(C)C	763455422	RYZDPRWRFTXMBH-UHFFFAOYSA-N	441.444	1.751	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)N[C@@H]1CCO[C@@H](C(C)(C)C)C1	763461018	QAZNAQLMMVBAOP-ZIAGYGMSSA-N	425.555	1.826	50	20	IDGD	
Cc1ccc(F)c(NC(=O)C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1	763509295	QWIGVOIMFMHNRI-UHFFFAOYSA-N	448.476	1.318	50	20	IDGD	
CC(C)CC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1	763572136	PUWYMGCZLHAAKB-SFHVURJKSA-N	440.456	1.597	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccn(-c3ncccc3F)n2)cc1C	763681241	UWOVAYPEDWISLG-UHFFFAOYSA-N	426.408	1.188	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2cnn(-c3ccccc3F)c2C)c1	763771731	FQSTXKZYDPWUMI-UHFFFAOYSA-N	441.419	1.737	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2cccc(-c3cnco3)c2)c2ccccc2c1=O	763785612	JWGLZXNENOMLGY-UHFFFAOYSA-N	446.423	1.471	50	20	IDGD	
COC(=O)N(C)c1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)cc1	763865846	ROOPVZGGIOFECL-LBPRGKRZSA-N	432.408	1.582	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)C(=O)Nc1ccc(OC2CCCC2)cc1	763920593	AAXSJNPUNMQRTL-UHFFFAOYSA-N	435.444	1.383	50	20	IDGD	
Cc1ccc(NC(=O)Nc2ccccc2)cc1NC(=O)C(=O)NNC(=O)c1cnccn1	764024518	LSMCMZDPRWAKOW-UHFFFAOYSA-N	433.428	1.829	50	20	IDGD	
C[S@@](=O)Cc1ccccc1NC(=O)C(=O)NNC(=O)c1cccc(Br)c1	764063710	WMKDXQJCDNPWSP-AREMUKBSSA-N	438.303	1.727	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)C(=O)N1CCCC1	764070885	RTZRUUOEXKBHFA-KRWDZBQOSA-N	443.504	1.374	50	20	IDGD	
CCCCOc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c(C)c1	764078382	RYISTNISIGYTRM-UHFFFAOYSA-N	447.513	1.977	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccccc2CN2C[C@@H](C)O[C@H](C)C2)c(O)c1	764105853	ZHFNFMMEFHUZPW-HZPDHXFCSA-N	440.500	1.710	50	20	IDGD	
COC(=O)c1c(NC(=O)C(=O)NNC(=O)c2ccc(C)cc2O)sc2c1CCCC2	764111691	OYBRRDHRWODEGV-UHFFFAOYSA-N	431.470	1.827	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1O)C(=O)Nc1ncn(Cc2ccc(Cl)cc2)n1	764125392	WTIXHIWHRIBOQM-UHFFFAOYSA-N	449.254	1.739	50	20	IDGD	
CCC(=O)Nc1ccc(Cl)c(NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)c1	764155058	VZUKWWPBPYGULR-MRXNPFEDSA-N	430.848	1.778	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)C(=O)Nc2cccc(C(=O)N3CCSCC3)c2)c1	764233760	DVVOLEQNECZFAC-UHFFFAOYSA-N	437.481	1.147	50	20	IDGD	
O=C(Cc1ccccn1)NNC(=O)C(=O)Nc1cccc(COc2ccc3c(c2)OCO3)c1	764267936	XCDJLAFWXCXDEU-UHFFFAOYSA-N	448.435	1.718	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)C(=O)Nc1ccc(=O)n(Cc2ccccc2)c1	764277335	CASNCQQWMSBTGI-UHFFFAOYSA-N	434.452	1.321	50	20	IDGD	
C[C@H](CC#N)Sc1ccccc1NC(=O)C(=O)NNC(=O)COc1ccccc1O	764278377	XSXMAWRRLXAGQT-CYBMUJFWSA-N	428.470	1.951	50	20	IDGD	
CCS(=O)(=O)c1ccccc1Oc1ccc(NC(=O)C(=O)NNC(=O)COC)cc1	764299277	FLEMGZIKLMJDNC-UHFFFAOYSA-N	435.458	1.005	50	20	IDGD	
CS(=O)(=O)c1c(F)cc(NC(=O)C(=O)NNC(=O)CCCc2cccs2)cc1F	764342108	UZVCDHILLVQCEE-UHFFFAOYSA-N	445.469	1.539	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc4[nH]ccc4c3)n[nH]2)cc1OC	764378711	MJZYLDQBNDXASG-UHFFFAOYSA-N	448.439	1.975	50	20	IDGD	
O=C(NNC(=O)[C@H]1COCCO1)C(=O)Nc1ccc(Sc2ccc(Cl)cc2)cc1	764430468	WQKCQAMWHSZISL-MRXNPFEDSA-N	435.889	1.993	50	20	IDGD	
COc1nccnc1NNC(=O)c1ccc(S(=O)(=O)N(C)C)c(Br)c1	764464609	OSMYBETWYFOJNX-UHFFFAOYSA-N	430.284	1.255	50	20	IDGD	
Cc1onc(-c2ccncc2)c1C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	764552437	OAXNHGRRHTUSTD-UHFFFAOYSA-N	435.849	1.421	50	20	IDGD	
O=C(CCN1C(=O)[C@H]2CCCC[C@H]2C1=O)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	765618795	OIHPOVPZXBSNTQ-GASCZTMLSA-N	427.436	1.542	50	20	IDGD	
Cc1cc(N2CC[C@H](NC(=O)NNC(=O)Cc3ccncc3)C2=O)ccc1Br	765914734	DUYYVHYPYXFZEL-INIZCTEOSA-N	446.305	1.831	50	20	IDGD	
CON(C)C(=O)[C@H](CCSC)NC(=O)NNC(=O)[C@H](C)Oc1cccc(C)c1C	767163562	INGLQAFVUBUPKL-GJZGRUSLSA-N	426.539	1.543	50	20	IDGD	
O=C(NNC(=O)c1cn(-c2ccccc2)nc1-c1ccccc1)C(=O)Nc1cncnc1	768229303	AUDXMFNRSPHBJN-UHFFFAOYSA-N	427.424	1.729	50	20	IDGD	
O=C(NNc1ccc([N+](=O)[O-])cc1)C1CCN(C2=NS(=O)(=O)c3ccccc32)CC1	768246817	PVIQLTIWPPZTNO-UHFFFAOYSA-N	429.458	1.899	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)Cn3cc(Br)cn3)n[nH]2)cc1OC	768278837	KPXOVXDOPRXUKB-UHFFFAOYSA-N	449.265	1.514	50	20	IDGD	
CC1(C)C(=O)Nc2ccc(C(=O)OCC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)cc21	768695438	DCLAVVQPJVLTRH-UHFFFAOYSA-N	426.385	1.443	50	20	IDGD	
COc1cccc2c1OC[C@H](NC(=O)NNc1nc(O)c3cnn(C(C)(C)C)c3n1)C2	770378492	WIZPBEIEODVPCK-GFCCVEGCSA-N	427.465	1.925	50	20	IDGD	
C[C@H](NS(=O)(=O)c1cccc(C(F)(F)F)c1)C(=O)NNC(=O)c1cccc(C#N)c1	770950860	BOIJTECXXTZSNU-NSHDSACASA-N	440.403	1.705	50	20	IDGD	
CC(C)(C)OCc1cc(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)no1	771391308	GDCVAKWZQRTKEE-UHFFFAOYSA-N	438.506	1.768	50	20	IDGD	
O=C(CN1CCC[C@@H](c2nnc3n2CCCCC3)C1)NNC(=O)c1cccc([N+](=O)[O-])c1	771792200	UADXTBYSLFVHFG-MRXNPFEDSA-N	441.492	1.553	50	20	IDGD	
CCC(CC)NC(=O)[C@H]1CN(C(=O)C(=O)NNc2nc(C)cc(C)n2)c2ccccc2O1	773479265	GNAFJRDQJSSCAR-GOSISDBHSA-N	440.504	1.636	50	20	IDGD	
COC(=O)c1c(F)cccc1NNC(=O)CCS(=O)(=O)c1ccc2c(c1)OCCO2	773618913	DJGNFSGFOFNGAI-UHFFFAOYSA-N	438.433	1.691	50	20	IDGD	
CN1CCC[C@H](N(C)C(=O)c2ccc(NC(=O)C(=O)NNc3ccc(C#N)cc3)cc2)C1	773692340	FLADAXKXDJJKHM-FQEVSTJZSA-N	434.500	1.806	50	20	IDGD	
CC(C)(C)c1ccc(C(=O)N[C@@H](CCS(C)(=O)=O)C(=O)NNc2cnccn2)cc1	775281830	YBJUSJGOMVHJMW-INIZCTEOSA-N	433.534	1.451	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)Nc2ccc(S(=O)(=O)NCC3CC3)cc2)c1	776473011	DMEGSQISZZDADV-UHFFFAOYSA-N	438.531	1.927	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)[C@H]2CCCN2S(=O)(=O)c2cccs2)c1	776527853	LAJIFCOAFKYVAN-CQSZACIVSA-N	429.545	1.448	50	20	IDGD	
COCCNC(=O)CSc1ccccc1C(=O)NNc1cccc(S(C)(=O)=O)c1	776540899	DXPFIPNQZNISFG-UHFFFAOYSA-N	437.543	1.702	50	20	IDGD	
COC(=O)c1cc(Br)c(S(=O)(=O)NNC(=O)c2ccccc2O)s1	777594663	UWSBBSSQXJBIGY-UHFFFAOYSA-N	435.277	1.626	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)NC[C@@H]1COC2(CCOCC2)O1	777761578	VPBHVCNYAYSTMT-DNVCBOLYSA-N	429.473	1.860	50	20	IDGD	
COC(=O)CNC(=O)NNS(=O)(=O)c1csc(-c2cccc(Br)c2)n1	779844932	BOZZEELOONQRCI-UHFFFAOYSA-N	449.308	1.238	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)[C@H]2C[C@@]23CCN(C(=O)OC(C)(C)C)C3)nc2ccccc21	780171906	UNLLLISMIBENAR-JLCFBVMHSA-N	427.505	1.910	50	20	IDGD	
COC(=O)c1scc(C)c1NC(=O)C(=O)NNC(=O)c1cccc(OC(F)F)c1	782118428	XBLXDHWHISTAAK-UHFFFAOYSA-N	427.385	1.844	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNc2ncnc3ccsc23)cc1Cl	783254050	XJFRGKZRIVUTSS-UHFFFAOYSA-N	435.849	1.978	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2cc(C(F)(F)F)ccc2N2CCCC2)CCS(=O)(=O)C1	783424948	GUILRMQEVRQRIJ-QGZVFWFLSA-N	448.467	1.442	50	20	IDGD	
O=C(NNc1ccc([N+](=O)[O-])cc1Cl)C(=O)Nc1ccc(CN2C(=O)CNC2=O)cc1	784380583	XVYKMOUPOBYHPX-UHFFFAOYSA-N	446.807	1.382	50	20	IDGD	
O=C(COCCNC(=O)c1ccccc1)NNC(=O)NCc1cccc(C(F)(F)F)c1	784636105	LHEAYDUHXDJLCF-UHFFFAOYSA-N	438.406	1.982	50	20	IDGD	
O=C(NNc1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(F)c(S(=O)(=O)NC2CC2)c1	784827650	GXXCCVZYAZNVRH-UHFFFAOYSA-N	437.409	1.256	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)c(Cl)n1	784835580	CSGHICFPBBUHGK-UHFFFAOYSA-N	434.808	1.822	50	20	IDGD	
CC(C)Cc1noc(-c2cc(Cl)ccc2NC(=O)C(=O)NNc2nccn(C)c2=O)n1	785085770	FLIJXLRRJBFUOS-UHFFFAOYSA-N	445.867	1.764	50	20	IDGD	
CCN(Cc1ccccc1NC(=O)C(=O)NNc1nccn(C)c1=O)C(=O)OC(C)(C)C	785085827	GJMWPSHMUPXSLA-UHFFFAOYSA-N	444.492	1.619	50	20	IDGD	
Cc1ccc(C(=O)NCC2CC2)cc1NC(=O)C(=O)NNC(=O)COc1ccc(C#N)cc1	785991015	NHDAXWOUDWYYOQ-UHFFFAOYSA-N	449.467	1.171	50	20	IDGD	
COC(=O)CCc1cccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)on2)c1	786413550	BTARJZFDHXBWNU-UHFFFAOYSA-N	436.424	1.847	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1cccnc1-c1cnn(C)c1	786416661	HPCIQQZPUMHNAV-UHFFFAOYSA-N	428.836	1.544	50	20	IDGD	
CNS(=O)(=O)c1cccc(NC(=O)[C@@H](C)NC(=O)/C(C#N)=C/c2ccc(O)cc2)c1	787330470	YYFJTLFBKOLLRI-QQFZQELXSA-N	428.470	1.351	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(-c3ccsc3)nn2C)o1	787542093	FZGYHDCMMSJHPV-UHFFFAOYSA-N	444.517	1.983	50	20	IDGD	
C[C@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)NNc2nnc(-c3ccccn3)s2)C1=O	788564706	BPOZSLIRFMOHIM-LJQANCHMSA-N	441.448	1.650	50	20	IDGD	
Cc1cc(F)cc(-n2cc(C(=O)OCC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)nn2)c1	789057913	JYIGQHVTBKAQDQ-UHFFFAOYSA-N	442.363	1.241	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCC(COc3ccc(Cl)nc3)CC2)n1	789315532	SKKXWQRSLIUGCJ-UHFFFAOYSA-N	437.953	1.981	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)CC1	789852602	IXJINPXQYFCJFM-UHFFFAOYSA-N	429.477	1.986	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2cc([C@@H]3CCCOC3)nn2C)cc1	790952573	RRSMGTLVMAIOPS-OAHLLOKOSA-N	429.477	1.041	50	20	IDGD	
COc1cccc(Cn2nccc2NC(=O)C(=O)NNc2nc3ccccn3n2)c1OC	792393014	CTKPEQWQYCJQAY-UHFFFAOYSA-N	436.432	1.073	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)C(=O)Nc1ccc2c(c1)N(CC(F)F)C(=O)CS2	793026607	SJKRXORBOLOTHD-UHFFFAOYSA-N	449.439	1.114	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccc2ccn(C)c(=O)c2c1	793067390	WDMZQRZKYVJAIJ-LBPRGKRZSA-N	442.859	1.745	50	20	IDGD	
COc1cc(C)c(Br)cc1C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	794783164	DKSOXKVNBHIHJL-UHFFFAOYSA-N	431.250	1.817	50	20	IDGD	
COC(=O)Cn1ncc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCCCC3)c1C	796999487	NEWRJFZTBPYBLS-UHFFFAOYSA-N	433.490	1.095	50	20	IDGD	
CNC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)C(C)(C)c2ccccc2)c(C)c1	797009125	OWXCXFZCOFGYOT-UHFFFAOYSA-N	426.473	1.184	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNC(=O)C(=O)Nc1cc(F)c(F)cc1Cl	797369470	YUWPRYPDZRYUBX-UHFFFAOYSA-N	440.790	1.631	50	20	IDGD	
Cc1ccc([C@@H](NCC(=O)NNC(=O)Cc2nc(C)cs2)[C@@H](C)S(C)(=O)=O)cc1	797996934	FXFWSRZMMKVUKO-KUHUBIRLSA-N	438.575	1.214	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)NCCCNC(=O)/C=C\c2ccccc2)nc2ccccc21	800761038	HKURFAVHEFBZLE-SEYXRHQNSA-N	434.500	1.666	50	20	IDGD	
CO[C@H](C)CS(=O)(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	800831470	VDKRLXOSYCFTGN-CQSZACIVSA-N	430.486	1.044	50	20	IDGD	
C[C@H](CCNS(=O)(=O)c1ccccc1)NC(=O)NNC(=O)COc1ccccc1C#N	802526656	DWAOELFPVMNFBS-OAHLLOKOSA-N	445.501	1.025	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(-c2ccc(Cl)s2)nc1	802567067	HMTLJSDNESZZDO-SNVBAGLBSA-N	426.882	1.601	50	20	IDGD	
N#CCCn1cc(/C=C(\C#N)C(=O)N2CC[C@@](O)(C(N)=O)C2)c(-c2ccc(Cl)cc2)n1	803163896	DTBWWBAKDDBXGH-VPFXQZGESA-N	438.875	1.473	50	20	IDGD	
CC(C)Oc1ncccc1C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	806342210	FPVASCMCIITEFG-UHFFFAOYSA-N	432.502	1.728	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cn(C4CC4)c(C)cc3=O)CC2)cc1	807093358	MBYMCHAPWDHMIB-UHFFFAOYSA-N	437.544	1.379	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ncccc2F)cc1S(=O)(=O)N1CCCC1	807301695	FPAPOVMAFMFILX-UHFFFAOYSA-N	437.453	1.096	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)NC1CCN(C(=O)c2cc(Cl)c[nH]2)CC1	807514395	RPPDZXXYYJMINC-UHFFFAOYSA-N	434.840	1.825	50	20	IDGD	
COc1ccc(C(Cc2ccccn2)=NNC(=O)CSc2nnc(O)nc2O)cc1	807958987	LQKFXFJGYSKKJI-UHFFFAOYSA-N	426.458	1.542	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNS(=O)(=O)c1c(F)cccc1OC(F)(F)F	808104696	MPZZUPAYJMNXDB-UHFFFAOYSA-N	431.364	1.559	50	20	IDGD	
COC[C@]1(C(=O)OCC(=O)NNC(=O)c2ccc(C)cc2)CCN(C(=O)OC(C)(C)C)C1	811400758	SNCHSDYPYNLQAY-QFIPXVFZSA-N	449.504	1.573	50	20	IDGD	
COc1ccc(C(=O)N(C)C)cc1NC(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	812926143	KXGFLNUGAVBVFR-UHFFFAOYSA-N	435.506	1.796	50	20	IDGD	
CNC(=O)CCOc1ccc(NC(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)cc1	812933858	BJXMJPBVHMALJG-UHFFFAOYSA-N	435.506	1.600	50	20	IDGD	
CC(C)[C@@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)c1csc(N2CCOCC2)n1	814224989	NSSQRXBOBBXFJW-CYBMUJFWSA-N	427.527	1.290	50	20	IDGD	
CN(C/C=C\C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)CC(F)(F)F	814361852	HDCNDXGYXJLDSK-YVMONPNESA-N	427.471	1.396	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)C[C@@H]1CCCS(=O)(=O)C1	814739416	OJBHBEYYYOOANS-NEPJUHHUSA-N	433.324	1.579	50	20	IDGD	
NS(=O)(=O)c1ccc(NC(=O)NN=Cc2cn3ccc(Br)cc3n2)cc1	814967230	BIIUAGFBVCAPLO-UHFFFAOYSA-N	437.279	1.900	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2)nnn1Cc1ccccc1F	815563718	LUODIKJEZUHLBY-UHFFFAOYSA-N	430.827	1.827	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(\C#N)C(=O)NS(=O)(=O)c2cnn3c2OCCC3)c1C	816205302	RGPKILOKXCAVEW-VEJKBTLKSA-N	447.517	1.703	50	20	IDGD	
Nc1nc(Cl)c(C=NNC(=O)c2cc(Br)c[nH]2)c(N2CCOCC2)n1	874101853	LRYOCQNGZIGDDT-UHFFFAOYSA-N	428.678	1.403	50	20	IDGD	
Cn1cc(/C=C(/C#N)C(=O)Nc2nc(-c3ccc(O)c(O)c3)cs2)c(=O)n(C)c1=O	884183247	HBESASMNOIYYPQ-WZUFQYTHSA-N	425.426	1.164	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)COc2ccc(Br)cc2F)C[C@@H](C)O1	912920194	XSOUHSXEGKKXQH-TXEJJXNPSA-N	432.290	1.614	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)CCc2ccc(S(=O)(=O)NC3CC3)cc2)c1	913465228	RZGPADVWOYXBPB-UHFFFAOYSA-N	445.541	1.903	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)C1CCN(c2ncccn2)CC1	915806786	VGRBDKHODDGZLA-UHFFFAOYSA-N	434.294	1.682	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)NCCNS(=O)(=O)c2cccc(Cl)c2)c1	916295702	SMZNCNZEOIQYQM-UHFFFAOYSA-N	439.925	1.329	50	20	IDGD	
CCc1c(C(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)cnn1C	916327313	JTTWKMSKCOGHGX-UHFFFAOYSA-N	430.468	1.816	50	20	IDGD	
Cc1ccc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)s1	916375811	URRUKWVPVIYTGN-UHFFFAOYSA-N	438.531	1.222	50	20	IDGD	
CC1CCN(c2ccc(CNC(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)cn2)CC1	916389443	ZLTRSFSOIOPNDE-UHFFFAOYSA-N	435.492	1.438	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)CN1c2cccc3cccc(c23)S1(=O)=O	916559131	BLYOUJBVLUKXSE-UHFFFAOYSA-N	425.466	1.713	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(S(=O)(=O)NC(C)(C)C)cc2)cc1C	916562692	SKFIUXMENAFOBE-UHFFFAOYSA-N	446.529	1.780	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(Cl)cc1)NNC(=O)c1cc2ccccc2cc1O	917358382	SVAVGVCYUQVQAM-UHFFFAOYSA-N	433.873	1.938	50	20	IDGD	
Cc1cccc(NC(=O)N2CCC[C@H](C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)C2)c1	917925408	LSIHMWYRUSLNSR-KRWDZBQOSA-N	448.487	1.676	50	20	IDGD	
O=C(CCN1CCCS1(=O)=O)NNC(=O)c1ccccc1OCc1ccc(F)cc1	918200142	OIIKQVQIHKCWCC-UHFFFAOYSA-N	435.477	1.591	50	20	IDGD	
CCn1cnc2c1c(=O)n(CC(=O)NN=C/C=C\c1ccco1)c(=O)n2Cc1ccccc1	920369643	XYPQPDQGYZERSC-PNEYQUTDSA-N	446.467	1.836	50	20	IDGD	
COc1cc(C(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)c(N)c(OC)c1OC	920645830	ULSSKIAYHQYSGE-UHFFFAOYSA-N	437.836	1.566	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)CCCC[C@@H]2SC[C@H]3NC(=O)N[C@@H]32)cc1OC	921302886	RFOIFQQURLOKMA-SKDZVZGDSA-N	436.534	1.581	50	20	IDGD	
CCOC(=O)C1=NN(c2ccccc2)[C@@H](C(=O)NNC(=O)c2cncn2-c2ccccc2)C1	1251717136	WPNBFELSFXGIRC-LJQANCHMSA-N	446.467	1.831	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)NC1CCC(O)(c2cccnc2)CC1	1255065295	GOZUUNAEOARXRC-UHFFFAOYSA-N	439.520	1.249	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2cc(Br)cc(C(=O)O)c2)cc1	1319582935	JIDXODZRGKCBLG-UHFFFAOYSA-N	429.248	1.779	50	20	IDGD	
COc1ccc(C(=O)N2CCOCC2)cc1NC(=O)NNC(=O)c1n[nH]c2c1CCCC2	1320411800	VESZMYIMYWDYRX-UHFFFAOYSA-N	442.476	1.236	50	20	IDGD	
COc1cccc(C2=NO[C@H](C(=O)NNC(=O)C3CCN(C(=O)OC(C)(C)C)CC3)C2)c1	1321027465	BTVSSZNUWKTZFV-SFHVURJKSA-N	446.504	1.983	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN1C(=O)c1ccc2c(c1)OCO2)c1cncn1-c1ccccc1	1325093773	LHCNNZVJDMKORN-KRWDZBQOSA-N	447.451	1.667	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)CN2CCN(Cc3cccc4cccnc34)CC2)cc1	1335643576	IKDITPPDWDQBOH-UHFFFAOYSA-N	428.496	1.685	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCCc1ccc(N(C)C)cc1	1338244629	ZXSFUYVQODVJSU-UHFFFAOYSA-N	432.550	1.541	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3nnc4cc(C)nn4c3C)C2)C1	1777778977	GSYQJTBVBAURGP-QRWLVFNGSA-N	434.928	1.592	50	20	IDGD	
O=C([C@@H](O)CCl)N1CCO[C@]2(CCN(C(=O)C3(c4cccc(Cl)c4)CC3)C2)C1	1778066767	DAHGVUMBHXNLIV-QFBILLFUSA-N	427.328	1.801	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@](C)(C(=O)N2CC[C@]3(CN(C(=O)[C@@H](F)Cl)CCO3)C2)C1	1778179565	QWOSUHHYLRLCHL-UAOJZALGSA-N	447.935	1.998	50	20	IDGD	
Cc1nnsc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)Br)C2	1778241303	VKOJAMTUWLEAJU-NSODJVPESA-N	431.356	1.757	50	20	IDGD	
O=C(c1ccc2nc[nH]c2c1)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1778511758	UDRVZIHFGFCBJA-WMLDXEAASA-N	425.258	1.697	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc4n(n3)CCC4)C2)C1	1778671685	NQYLIWCUEFIWSK-KBXCAEBGSA-N	425.327	1.446	50	20	IDGD	
CC[C@H]1CC[C@H](C(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)CC1	1779034141	OHUILDFSYYCABC-SEPYTNNBSA-N	443.548	1.345	50	20	IDGD	
O=C(/C=N/N1CCCCC1)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Br)C2	1779365757	FFMMBEJKWQNKLN-GXTSNSKESA-N	447.349	1.663	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1CCOC1)CCO2	1780099136	UMNGPANGIXDCNU-VFNWGFHPSA-N	447.444	1.000	50	20	IDGD	
COc1ncccc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Br)C1	1780770889	IHTLYNDJQLEUAB-HBUWYVDXSA-N	444.301	1.908	50	20	IDGD	
C[C@@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Br)C1)n1cncn1	1780776882	HMOISIVHRIDZFJ-VPWBDBDCSA-N	432.294	1.044	50	20	IDGD	
COc1ncc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)cc1F	1781227507	AMLKHFPIUCNXEU-ZWKOTPCHSA-N	434.295	1.909	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](O)CCNC(=O)OC(C)(C)C)C2)C1	1781340924	UBBUHRDPTLELDJ-BXTJHSDWSA-N	447.960	1.109	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C=N/O[C@H]1CCCCO1)C2	1782175293	GFWQPULZZMQBMT-FNCSKKEUSA-N	445.944	1.283	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccnc4ncccc34)C2)C1	1782342215	SXECHTCIIGYDRJ-DJJJIMSYSA-N	433.306	1.857	50	20	IDGD	
O=C(c1cn2c(F)cccc2n1)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1782373333	HQDVIMYBRHNIED-YOEHRIQHSA-N	443.248	1.607	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)Cn3cc(Cl)cn3)CCO2)C1	1783342196	JKMWXLVPQQVVPH-CJNGLKHVSA-N	433.734	1.540	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccnc(Cl)n3)CCO2)C1	1783349355	KSTHOKXEJUPMJN-ZBEGNZNMSA-N	431.718	1.747	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cc(OC)ccn3)CCO2)C1	1783349899	VMQBRGANOZAWMG-RDTXWAMCSA-N	426.311	1.707	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cnn4c3CCC4)CCO2)C1	1783353594	PZCQYEZDECABPQ-KDOFPFPSSA-N	425.327	1.446	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)CCc3ccc(O)nn3)CCO2)C1	1783355834	YDYMTQYQLBDOSS-RDTXWAMCSA-N	441.326	1.118	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cn(C)c4ncccc34)CCO2)C1	1783534718	YFNFEMYREQZLDA-ORAYPTAESA-N	435.322	1.800	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3c[nH]c4ccc(OC)nc34)CCO2)C1	1783880581	DKUNRTKHGGPANE-JLTOFOAXSA-N	436.896	1.269	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3cc(F)ccn3)[C@H]2C1	1785240294	MXDRBWYARWLDAZ-SNRMKQJTSA-N	437.588	1.985	50	20	IDGD	
CN(CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21)C(=O)OC(C)(C)C	1786622560	HWLZUKZOGQLHFP-AVGNSLFASA-N	438.352	1.637	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC1(c2ccc(NC(=O)c3cnc(N)s3)cc2)CCC1	1788099487	DLWJVELLWISPQA-UHFFFAOYSA-N	430.534	1.846	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(O)c(OC)c3)[C@H]2C1	1789603279	FRUMZFUFHXBTND-AFIMGQEJSA-N	426.897	1.248	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)ON=C(C)C)C[C@@H]21	1790963306	RHLUKPBDVYXXDS-CWVYHPPDSA-N	432.359	1.941	50	20	IDGD	
Cc1cc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]3C2)nn1C	1791055128	KEYUDQXPXAOSME-VRKREXBASA-N	427.343	1.034	50	20	IDGD	
COc1ccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)Br)C3)cc1O	1792730315	MSHCEKKGERVSAL-GNTLTTKYSA-N	441.322	1.316	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CCCN(Cc3ccccc3)C1)C2)[C@H](O)CCl	1792975416	QVHWPDCFVXOWQG-YMQHIKHWSA-N	449.979	1.088	50	20	IDGD	
Cc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCBr)nc2nccn12	1795115045	BMMJGOHVFOOVGZ-YWVIFJGQSA-N	436.310	1.026	50	20	IDGD	
Cc1ccc(S(=O)(=O)CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)C(Cl)Cl)C3)cc1	1795323956	UYVOOANVMFIOHT-YWVIFJGQSA-N	449.356	1.162	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C[C@@H](N)c1cccnc1	1795679831	RCHWUOGFHNSDJR-MOXHTAKSSA-N	429.348	1.297	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(-c2ccco2)no1	1796129029	DKAKNCYOSPDJIR-LSSIXWDNSA-N	438.278	1.921	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccn2cncc2c1	1797506703	RBYVDIOMFYQSHX-FSDCSDTHSA-N	435.322	1.711	50	20	IDGD	
CC(=O)Nc1ccc(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CCC(=O)NN(C)C)C3)cc1	1797834109	QFQSYKBXVMWTFZ-ACDBMABISA-N	443.548	1.199	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cn3cc(F)ccc3n1)C2)[C@H](F)Br	1799349860	MGURLCQCJOYYEQ-OWLDWWDNSA-N	443.248	1.367	50	20	IDGD	
CC[C@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](CCO)NC(=O)OC(C)(C)C)C2	1800067681	LWEANJWTBPZFBX-QRJUGERDSA-N	431.961	1.918	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](O)Cc1ccccc1	1800635857	KGMDYEMXQUSSJL-YPLULLRNSA-N	429.344	1.416	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)n1cccc1C=O)C2	1800639815	NRWCQYVHYWQUHL-QZLJAVCYSA-N	440.338	1.625	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnn3ccncc13)C2	1800640621	CDEVQVNNMBBLJF-LMWOUKEDSA-N	436.310	1.106	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CCCN1C(C)C)C2	1800644102	IKTMFRYXJOUEMS-BPKGMFCQSA-N	430.387	1.622	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c(c1)OCCO3)C2	1800758357	XOQCPOLLETWYSK-MBMVNNNZSA-N	439.306	1.444	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c(c1C)OCCO3)C2	1800975523	PWVURNISEKJYOJ-KPEUIFRASA-N	438.908	1.223	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cn3cc(Cl)ccc3n1)C2	1802336630	QYYIEKJBONBPBT-MUJYYYPQSA-N	446.939	1.613	50	20	IDGD	
Cn1cc(C(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)c(C(F)F)n1	1803139355	ONEJDULBSIDNIZ-IVMMDQJWSA-N	441.866	1.672	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cn3c(F)cccc3n2)[C@H]1c1cccnc1)[C@@H](O)CCl	1803148970	ZFCVELZPZXKVGL-QOKNQOGYSA-N	445.882	1.788	50	20	IDGD	
CC(=O)NC(C)(C)C(=O)NC[C@@H]1CCN(C(=O)[C@H](C)Br)[C@H]1c1cccnc1	1803598821	TWPZCCWIOBAKRU-RCBQFDQVSA-N	439.354	1.786	50	20	IDGD	
COc1ccc(F)c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)c1	1803600630	FRCYNKFIEIQKBI-BTTYYORXSA-N	441.463	1.398	50	20	IDGD	
COc1nccnc1C(=O)N1CC[C@H](CNC(=O)CCBr)[C@@H]1c1cccnc1	1806339447	LZLIUMUPUBZPEO-PBHICJAKSA-N	448.321	1.985	50	20	IDGD	
O=C(CC(F)(F)F)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1806835359	CSKNTEIHSDXKTN-YJBOKZPZSA-N	435.211	1.033	50	20	IDGD	
O=C(COCc1ccccc1)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1	1806874391	PUWQUQPVEOMVEC-ZVDOUQERSA-N	431.920	1.904	50	20	IDGD	
O=C(CN1CCOCC1)NC[C@@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1	1806903624	GBGYIGBQRFITNM-LPHOPBHVSA-N	439.354	1.205	50	20	IDGD	
CC1=CC[C@H](C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)CC1	1807363541	OZVZHKYVPQGBGX-WPYKKVEZSA-N	447.344	1.827	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC2(CCCN(C(=O)[C@H]3CNc4ccccc43)C2)CC1	1809803465	VECQCCGHKIRUBM-NRFANRHFSA-N	447.344	1.421	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1	1809969694	MQNBZEXVLJCSCH-LJQANCHMSA-N	441.164	1.448	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)[C@@H](OC(C)=O)C(C)C)[C@H]1c1cccnc1	1810108992	QLDYWFQXVUNYJX-HCXYKTFWSA-N	439.940	1.929	50	20	IDGD	
COc1nn(C)cc1C(=O)N1CC[C@H](CNC(=O)CO[Si](C)(C)C)[C@@H]1c1cccnc1	1810540972	NYANZZGXBTWDET-APWZRJJASA-N	445.596	1.995	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)[C@@H]1Cc2ccccc2N1	1812430712	CCIZBOPSYDTFCF-LEAZDLGRSA-N	428.920	1.724	50	20	IDGD	
C=CC[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1	1812588169	CCSFIYFQZLUDQJ-RIFZZMRRSA-N	436.516	1.612	50	20	IDGD	
CSCC[C@H](O)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@H]1c1cccnc1	1813094442	YVKWGPZGHZNWLG-ZQDZILKHSA-N	448.358	1.892	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2sccc2F)[nH]n1)c1cccc(B(O)O)c1	1817474532	UJVLYAHRIDNKCN-INIZCTEOSA-N	442.281	1.910	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)CC[C@H]2CCOC2)[nH]n1)c1ccc(B(O)O)cc1	1817475500	PPFARMUZOKPHLO-HNAYVOBHSA-N	440.309	1.212	50	20	IDGD	
CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](F)Cl)n[nH]1	1818044174	VEUDZJKSFXICCU-FMKPAKJESA-N	439.879	1.407	50	20	IDGD	
O=C1Nc2c(C(=O)Nc3nc4c(s3)C[C@@H](NC(=O)[C@H](O)CCl)CC4)cccc2C1=O	1819342243	WTUWPKBRGGBGHX-QPUJVOFHSA-N	448.888	1.103	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)/C=C\C(=O)NC3CC3)sc2C1	1819532598	DBQPNFUHSMZSRR-QHDQMSKJSA-N	426.926	1.144	50	20	IDGD	
CNC(=S)NCCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCBr)CC2	1819804868	OXSMPPVEWBHSRE-VIFPVBQESA-N	448.412	1.324	50	20	IDGD	
CCc1cc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)nn1C	1819992507	TUEFERYOGVLUNN-KRWDZBQOSA-N	444.540	1.385	50	20	IDGD	
Nc1n[nH]c(CCC(=O)N2CCCC[C@@H]2c2cc(NC(=O)[C@@H](F)Br)n[nH]2)n1	1820935786	SXUGYHBFFQZKOY-NOZJJQNGSA-N	443.281	1.425	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)COc2cccnn2)[nH]n1)[C@H](F)Br	1820937841	RLHIKNOQEYYUGA-NHYWBVRUSA-N	441.261	1.961	50	20	IDGD	
C[C@@H](Cn1ccnc1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1	1822789290	OZVVFBOQDFSRQY-RDJZCZTQSA-N	444.540	1.308	50	20	IDGD	
Cc1cc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@H](O)CCl)CC3)nc2nccn12	1824111385	RCTHSMNAHYKLEF-ZWNOBZJWSA-N	434.909	1.320	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CN1CCOCC1)CC2	1825445402	WAOQNYZEJHBAIO-NEPJUHHUSA-N	445.383	1.561	50	20	IDGD	
CC[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1c[nH]c(=O)cn1)CC2	1825450700	UEAGUWRPZDOLHH-RKDXNWHRSA-N	440.323	1.626	50	20	IDGD	
COc1ccc(C(=O)N[C@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)cn1	1826083904	VFIRIQMQTHVSBW-ZDUSSCGKSA-N	446.533	1.146	50	20	IDGD	
Cc1ccc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)c(C)n1	1827052621	SDUDDVZZXYQTKU-QHCPKHFHSA-N	449.360	1.925	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H](Cl)COC)CC1	1828876645	UPDCSUOUVGEQBC-PVAVHDDUSA-N	430.977	1.568	50	20	IDGD	
Cc1[nH]ccc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1	1828926767	RFVYGYLUJVMJME-HXUWFJFHSA-N	438.532	1.869	50	20	IDGD	
O=C([C@@H](O)CCl)N1CCC([C@@H]2CCCCN2C(=O)c2nc(O)n3c2CCCC3)CC1	1829134127	BLZMQBDQWZTIMO-RDJZCZTQSA-N	438.956	1.758	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2c[nH]c(=O)cn2)CC1	1829718729	ZUIMVSMRWSHYCP-SWLSCSKDSA-N	425.327	1.787	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccc(C#N)cc3)CCO2)C1	1829898476	HMGRPBJDGAXWDZ-QFIPXVFZSA-N	433.936	1.822	50	20	IDGD	
Cn1c(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)cc2ccccc21	1830433280	MGAIGLORHXDGCG-PZJWPPBQSA-N	437.899	1.712	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccccc3F)C2)C1	1830542756	DBJVRJVOIMWVEA-IFXJQAMLSA-N	443.313	1.927	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)C(C)(C)C)CCO2	1830631838	IGCMAZYZBHXUFR-SUNYJGFJSA-N	435.359	1.023	50	20	IDGD	
O=C(c1csc2c1CCCC2)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1830731069	HPVLYFSNQHKIDA-JXFKEZNVSA-N	442.965	1.297	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(N(C)C)cn3)C2)C1	1831644268	SQIFNAHPSJGZAS-UWJYYQICSA-N	438.956	1.625	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCc2cncnc2)CC1	1831870980	JOOAEMCQDZUMIF-HXUWFJFHSA-N	444.580	1.402	50	20	IDGD	
CC(C)N1CCC[C@H]1C(=O)N1CCC([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1	1831876257	BWAUNOPOECRSDE-RTWAWAEBSA-N	449.640	1.852	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3ccc(C)s3)CCO2)C1	1832888011	FMUSIXWBUHDNTQ-FXAWDEMLSA-N	444.981	1.699	50	20	IDGD	
Cc1ccn(CC(=O)NC2CCN(C3CCN(C(=O)CO[Si](C)(C)C)CC3)CC2)n1	1833854055	NLWATDHJERGWSD-UHFFFAOYSA-N	435.645	1.615	50	20	IDGD	
CC(C)c1nc(C(=O)NC2CCN(C3CCN(C(=O)[C@H](O)CCl)CC3)CC2)co1	1833925443	ZWFLCTNQGKUFQV-QGZVFWFLSA-N	426.945	1.583	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)CCSC(=N)N)CC2)CC1	1834707476	YRBMGJDFHCZEJP-INIZCTEOSA-N	432.034	1.982	50	20	IDGD	
COc1ccc(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)cc1	1834846339	PEMYHPMKZPAEMD-ICSRJNTNSA-N	428.888	1.619	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)NC1CCN(C2CCN(C(=O)[C@H](C)Br)CC2)CC1	1835125396	PSKWCJWOHRLNBM-UONOGXRCSA-N	445.402	1.208	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3ccsc3)CCO2)C1	1836008492	DHRDRKGLEZJCRJ-LPHOPBHVSA-N	430.954	1.391	50	20	IDGD	
COc1nccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)c1F	1836240021	YOTJZELJAJCOSI-KRWDZBQOSA-N	436.267	1.103	50	20	IDGD	
CC[C@H](Br)C(=O)NC1CCN(C2CCN(C(=O)c3cn[nH]c3)CC2)CC1	1836541868	KKJUYPLYOHVELX-INIZCTEOSA-N	426.359	1.768	50	20	IDGD	
O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)C1(C(F)(F)F)CC1)CCO2	1836716470	WQCGAOQOVDCCET-AWEZNQCLSA-N	443.260	1.570	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnn4cccnc34)CCO2)C1	1836844402	KWWZYFHYUDZSEW-OXJNMPFZSA-N	435.912	1.207	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(O)cc3)CCO2)C1	1838971646	KGWJNPQBQHTUAR-FZKQIMNGSA-N	427.295	1.246	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cccc(Cl)n3)C2)C1	1839142542	RPNPPGGSMVDDFR-BEFAXECRSA-N	430.332	1.751	50	20	IDGD	
CCc1nn(C)c(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](Cl)CC)CCO3)c1Cl	1839143169	NLKODSHHUBOTHH-YJYMSZOUSA-N	447.363	1.723	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc([N+](=O)[O-])[nH]3)C2)C1	1839153487	IKPSTLBYSUXCQA-DLBZAZTESA-N	449.291	1.229	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)C[C@H]3C[C@@H]4CC[C@H]3C4)CCO2)C1	1839915834	BIBHSQPLQKOLGE-OHHNFCFSSA-N	428.957	1.523	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)C(C)(C)C)C2)C1	1839962175	WPAJXZOWJABBEC-PMUMKWKESA-N	435.359	1.023	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc4ccn(C)c34)C2)C1	1840152754	RZROHTDFVNSGHN-GCJKJVERSA-N	449.935	1.502	50	20	IDGD	
O=C(/C=C/c1ccc([N+](=O)[O-])o1)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840186896	RANYLJXKYJQVNJ-DUXHTMCSSA-N	448.259	1.461	50	20	IDGD	
O=C(Cc1ccc2c(c1)OCO2)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840188166	RQMWUMGMGLLZMU-LJQANCHMSA-N	445.299	1.218	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(C)c(F)c3F)CCO2)C1	1840702173	IXMWNPCAOVRHOB-MGPUTAFESA-N	446.878	1.597	50	20	IDGD	
Cc1ccc(S/C=C/C(=O)N2CC3(CCCN3C(=O)c3cccc(B(O)O)c3)C2)cc1	1843014308	WVEYTDCXFYMDJN-JLHYYAGUSA-N	436.342	1.798	50	20	IDGD	
CC(=O)N[C@H](Cc1cc(F)c(F)c(F)c1)C(=O)N1CC2(CCCN2C(=O)[C@@H](F)Cl)C1	1843365208	FUXSIDSHPXSYBC-GDBMZVCRSA-N	449.832	1.889	50	20	IDGD	
CC(=O)N[C@H](Cc1cc(F)c(F)c(F)c1)C(=O)N1CCCC12CN(C(=O)[C@H](F)Cl)C2	1845019811	SGBLDXKZSMRXFY-ZBFHGGJFSA-N	449.832	1.889	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@H]2CN(C(=O)OC(C)(C)C)C[C@H]2O)C1	1845104036	RQURVMHVDVGOTO-OWCLPIDISA-N	443.972	1.825	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)Cc2cc[nH]n2)C1	1845827281	AAYLMBTVORXADK-UHFFFAOYSA-N	427.417	1.303	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1ccc(N2CCN(C)CC2)cc1	1847243368	REMIMXKIDFMNOY-AABGKKOBSA-N	434.968	1.508	50	20	IDGD	
O=C(c1cccc2nc(C(F)(F)F)[nH]c12)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl	1847559758	QIDQOTYQWQAJEO-RWMBFGLXSA-N	430.814	1.997	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CCn1ccnn1	1848098459	CLQNNJNPHICAEG-KKUMJFAQSA-N	440.932	1.002	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)c2ccc(CN3C(=O)CCC3=O)cc2)cc1OC	12693454	XWIWPTZYEGSCTG-UHFFFAOYSA-N	425.441	1.818	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)C2CCN(S(=O)(=O)c3cc(F)ccc3F)CC2)n1	14513179	CDNWXMVPFPQRKH-UHFFFAOYSA-N	425.461	1.916	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)c1cc([N+](=O)[O-])ccc1Sc1ccccc1	15639599	RZWUPXVKGIWVFN-LBPRGKRZSA-N	435.483	1.942	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)c1cccc(S(=O)(=O)N2CCCCC2)c1	15795326	SNGUKRAHWWQEAN-LJQANCHMSA-N	445.497	1.462	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2n[nH]c(=O)c3ccccc23)c1	17194764	WUDZCUHYBAXONA-UHFFFAOYSA-N	443.485	1.028	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNS(=O)(=O)c2cccc(S(N)(=O)=O)c2)cc1	23392253	ZVOPABXBVNDBPC-UHFFFAOYSA-N	441.531	1.382	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)[C@H]2CC(=O)N(Cc3ccc(OC)cc3)C2)o1	726527884	LJNALGGPMWKNFE-KRWDZBQOSA-N	442.516	1.940	50	20	IDGD	
COC(=O)N1CCC[C@@H](NC(=O)NNC(=O)[C@H](C)Oc2cccc(Br)c2)C1	726610556	LNYJMCBGJPNTMR-WCQYABFASA-N	443.298	1.778	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)[C@H]2CSCN2C(=O)OC(C)(C)C)c2ccccc2c1=O	727114356	QKRRTHPRUOMDGL-CYBMUJFWSA-N	433.490	1.005	50	20	IDGD	
CC1CCN(c2ccc(C(=O)OCC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)cn2)CC1	727205664	YHALNLXVJVZYKO-UHFFFAOYSA-N	441.444	1.844	50	20	IDGD	
CC(C)n1nc(C(=O)NNS(=O)(=O)c2ccc3c(c2)COC3)c2ccccc2c1=O	727720687	VCROFGKMBXHOKS-UHFFFAOYSA-N	428.470	1.631	50	20	IDGD	
O=C(Cn1c(=O)ccn(Cc2ccccc2)c1=O)NNC(=O)c1c(Cl)cccc1Cl	727793317	BYCPYVOWJNYKNU-UHFFFAOYSA-N	447.278	1.826	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)N[C@@H](CN1CCN(C)CC1)c1ccccc1	727944515	DUNGOWUYJMZKKC-FQEVSTJZSA-N	425.533	1.557	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)N[C@H](CN1CCN(C)CC1)c1ccccc1	727946049	QUOCXOXZNMJILH-OAQYLSRUSA-N	439.560	1.947	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2cc3c(cc2Cl)NC(=O)C3)cc1OC	728015328	NZOKKKISDXLOGR-UHFFFAOYSA-N	425.850	1.475	50	20	IDGD	
Cc1ccc(S(=O)(=O)NC(C)(C)C)cc1C(=O)N([C@@H]1CCS(=O)(=O)C1)N(C)C	728178418	APHMAKVQKLAXLM-CQSZACIVSA-N	431.580	1.178	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)c2cccc(S(=O)(=O)NCC3CC3)c2)c1	728205969	NSCCXDPJIGVNHT-UHFFFAOYSA-N	432.502	1.257	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)N[C@H](C)c2ccc3c(c2)CC(=O)N3C)nc1	728398312	AYSMDPLRYRNECQ-CYBMUJFWSA-N	446.533	1.675	50	20	IDGD	
CCN(CC)C(=O)c1ccc(C(=O)OCC(=O)NNC(=O)Cc2nc(C)cs2)cc1	729123189	CUQKPKRZXYDCNK-UHFFFAOYSA-N	432.502	1.480	50	20	IDGD	
NC(=O)c1ccc(C(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)s1	729298318	BBVQMLDBUMWKFQ-UHFFFAOYSA-N	447.476	1.680	50	20	IDGD	
CN(C[C@@H]1CCN(CC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)C1)C(=O)OC(C)(C)C	729476745	IVPVEZBNRYUPCW-AWEZNQCLSA-N	435.481	1.545	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)c2nnn(-c3cccc4c3CCN(C)C4)c2C)c1	731470091	NHZAKRBKMJWHBN-UHFFFAOYSA-N	434.500	1.712	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2c(C)oc3ncn(C)c(=O)c23)cc1Br	732033300	AALRUCYANYELGL-UHFFFAOYSA-N	435.234	1.681	50	20	IDGD	
CCCS(=O)(=O)Nc1ccc(C(=O)NNC(=O)CCN2C[C@H](C)O[C@H](C)C2)cc1	732262745	WAFHRLIPWASPAU-GASCZTMLSA-N	426.539	1.099	50	20	IDGD	
O=C(COC(=O)c1csc(-c2ncccn2)n1)NNC(=O)c1cccc([N+](=O)[O-])c1	732326982	GPIVRLAPWYBDRE-UHFFFAOYSA-N	428.386	1.126	50	20	IDGD	
CC(C)[C@@H](C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)S(=O)(=O)C1CCCCC1	734239364	NPBURCSMSHPMHN-HNNXBMFYSA-N	448.586	1.614	50	20	IDGD	
Cc1nc(-c2ccccn2)nc(NNC(=O)C2CCN(c3ccc4nncn4n3)CC2)c1C	734256831	NILUSFJQZJLMLJ-UHFFFAOYSA-N	444.503	1.953	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN2CCC(CNC(=O)c3cnn(C)c3)CC2)cc1C	738312907	YVEZCUWNTHHKNM-UHFFFAOYSA-N	446.577	1.255	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1CNC(=O)NNC(=O)COCc1ccccc1	738461371	SFPYXHDWYJSMMP-UHFFFAOYSA-N	448.545	1.811	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)NCCNc1nccc(C(F)(F)F)n1	739045465	MQRXLKFAVTVLGF-JTQLQIEISA-N	430.362	1.844	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)C[C@H]3CCOC3)c2)cc1	739676655	ZYXIURKREYTGLD-CQSZACIVSA-N	433.486	1.684	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)[C@H]2CCC[C@@H]2NC(=O)OC(C)(C)C)n1	740296523	LBVRVTZECUNYNV-STQMWFEESA-N	440.522	1.378	50	20	IDGD	
O=C(NC[C@@H](O)c1c(F)cccc1Cl)NNC(=O)C1CCN(c2ncccn2)CC1	741280226	XOMYBBFHESGYGF-OAHLLOKOSA-N	436.875	1.550	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)COc1ccc(C#N)cc1)[C@H]1CN(Cc2ccccc2)CCO1	741431582	HNUQMQUZSAMPQI-LAUBAEHRSA-N	437.500	1.557	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)CN(C[C@H]2CCCO2)C(=O)OC(C)(C)C)c1	741885784	RMMPQNXFSUMASY-OAHLLOKOSA-N	437.493	1.881	50	20	IDGD	
Cc1cc(-n2cncn2)ccc1C(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	742077974	XXHVPGLXOGCUEI-UHFFFAOYSA-N	443.508	1.919	50	20	IDGD	
Cc1ccccc1[C@H](CC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)NC(N)=O	743830056	LWLGROYKJQIEKP-INIZCTEOSA-N	433.490	1.351	50	20	IDGD	
O=C(NCc1ccc(CN2CCCC2=O)cc1)NNC(=O)c1cc([N+](=O)[O-])ccc1O	745694415	GKWACILIGOEFPV-UHFFFAOYSA-N	427.417	1.567	50	20	IDGD	
Cn1ccc(N2CCC[C@H](NC(=O)NNC(=O)Nc3ccc(OC(F)F)cc3)C2=O)n1	745883299	NUTOJCLXUYRWHQ-ZDUSSCGKSA-N	437.407	1.553	50	20	IDGD	
CC(C)(CNC(=O)NNC(=O)C(=O)NC1CC1)Sc1ccc(Br)cc1	745891241	MHJVSTCUZRHLFE-UHFFFAOYSA-N	429.340	1.929	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)[C@H]2CCCN2Cc2ccccn2)c2ccccc2c1=O	746096473	GRZGBIAQWNQSFA-LJQANCHMSA-N	434.500	1.798	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)N[C@H]2CCCN(CC(F)(F)F)C2=O)cc1	746340136	VVVDOKMJQQBAKM-DOMZBBRYSA-N	446.426	1.736	50	20	IDGD	
CCO[C@H](CCNC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)C(C)C	746422022	SRLCGCCDSDCDSZ-QGZVFWFLSA-N	442.586	1.095	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN(CCN1CCOCC1)c1ccccc1	746463470	RORLRRFFWSPHGT-UHFFFAOYSA-N	446.935	1.948	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)CCOc1ccc(S(C)(=O)=O)cc1	746516735	VACAIFHPBVSSDX-UHFFFAOYSA-N	444.513	1.619	50	20	IDGD	
O=C(/C=C\c1ccc(I)o1)NNC(=O)Cc1cn2ccccc2n1	746549613	CEFMGKLUSPPRCC-ALCCZGGFSA-N	436.209	1.935	50	20	IDGD	
CSCc1noc(CCC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)n1	746768632	PJXOPQBRYZJPKS-UHFFFAOYSA-N	432.550	1.225	50	20	IDGD	
O=C(COC(=O)C1CC(OCc2ccccc2)C1)NNC(=O)[C@H]1COc2ccccc2O1	747050955	CIZHSSPTOVLHRU-LBXVMSDZSA-N	440.452	1.512	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3CN2Cc2ccccc2)no1	747779302	RLCKRXJHFIUHAX-LJQANCHMSA-N	433.468	1.696	50	20	IDGD	
Cc1nn(-c2ccccn2)c2nc(C3CC3)cc(C(=O)NNC(=O)C(=O)N3CCCC3)c12	748344137	WBWGXHUOWJEKMP-UHFFFAOYSA-N	433.472	1.385	50	20	IDGD	
CCCCS(=O)(=O)N1CCC[C@@H]1C(=O)NNc1c(F)cc(C(=O)NC2CC2)cc1F	748834026	HGXZDZGVZOMNHB-MRXNPFEDSA-N	444.504	1.894	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)NCCC(=O)NNC(=O)c2cc3ccccc3o2)cc1	749543941	GPLFLOCAUZRVEI-UHFFFAOYSA-N	429.454	1.765	50	20	IDGD	
C[C@@H](NC(=S)NNC(=O)CS(=O)(=O)Cc1ccc(Br)cc1)C1CC1	751616215	ARCKPEDKOHVRHA-SNVBAGLBSA-N	434.381	1.658	50	20	IDGD	
O=C(CN1CCOC[C@@H]1C[C@@H](O)c1cccs1)NNC(=O)c1cccc([N+](=O)[O-])c1	753858778	JAIPILLQJRLQLM-JKSUJKDBSA-N	434.474	1.242	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCc2cc(O)nc3ccccc23)nc1	754377663	ALKWHPMNXONUAD-UHFFFAOYSA-N	430.490	1.848	50	20	IDGD	
O=C(Cn1cnc2ccccc21)NNC(=O)c1cccc(I)c1O	754848188	WXUZNMPEJHOHDU-UHFFFAOYSA-N	436.209	1.808	50	20	IDGD	
C#CCOCCC(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2OC)c1	755381490	NGSWWJALQRCZAH-UHFFFAOYSA-N	431.470	1.297	50	20	IDGD	
C[C@@H]1CN(S(=O)(=O)c2ccc(NC(=O)NNC(=O)Cc3ccncc3)cc2)C[C@@H](C)O1	755422327	JUXDSJBEYBWZLZ-HUUCEWRRSA-N	447.517	1.275	50	20	IDGD	
CCS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1	755600873	VNYOIALHGZOAQO-UHFFFAOYSA-N	429.458	1.194	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)c(Cl)c1)Nc1cccc(N2CCS(=O)(=O)CC2)c1	756208577	ZTTLVFYUCFWKNC-UHFFFAOYSA-N	438.893	1.747	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2ccn(CC(=O)N(C)C)n2)cc1Br	756311064	LEBIULOKFPNABB-UHFFFAOYSA-N	439.270	1.209	50	20	IDGD	
CCCN1C(=O)CCc2cc(NC(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)ccc21	757889589	KGXIDILJGYJIOU-UHFFFAOYSA-N	434.460	1.818	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NNC(=O)c2cc(OC)ccc2Br)cn1	758150536	MXAKOLBUWPFPCA-UHFFFAOYSA-N	430.280	1.875	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)CCc2ccc(S(=O)(=O)N3CCCC3)cc2)nc1	759728779	IWTZKABRDGHJSS-UHFFFAOYSA-N	432.502	1.729	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)NCc1cccc(OCC(=O)N(C)C)c1	761668057	CZAYYXCLCKWFQP-UHFFFAOYSA-N	446.529	1.785	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)N[C@H]1C[C@@H](C)N(c2cnn(C)c2)C1=O	761722610	ZEVRJZCNGYERQH-OCCSQVGLSA-N	432.506	1.045	50	20	IDGD	
C[S@@](=O)Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)ccc1Cl	763442404	PFAYAEHJRNEFBW-GDLZYMKVSA-N	438.849	1.526	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1CNC(=O)NNC(=O)CSc1ccccc1O	763459740	BZVWQZVFCIWSAE-UHFFFAOYSA-N	438.531	1.265	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccccn2)n([C@H]2CCN(Cc3ccccc3)C2)n1	763464907	XVEOELGRDJHOPI-SFHVURJKSA-N	447.499	1.433	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccnn2-c2ccccc2)cc(OC)c1OC	763540144	SGJWVSYRUFTTOT-UHFFFAOYSA-N	439.428	1.298	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cc(Br)ccc2F)cc1	763680977	HPWWJGFBACRSFB-UHFFFAOYSA-N	435.209	1.625	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(SC(F)F)nc1	763682179	OXDMCAVTFWMPME-UHFFFAOYSA-N	440.428	1.960	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc2c(c1)CCCN2C(C)=O	763711743	ARYGUZTZRSBFTN-UHFFFAOYSA-N	438.484	1.713	50	20	IDGD	
N#CCOc1cc(F)ccc1NC(=O)C(=O)NNC(=O)CN1CCCc2ccccc21	763736455	UUVMCOPZQOIFRD-UHFFFAOYSA-N	425.420	1.267	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)C(=O)Nc2cccc(C)c2C)cc1	763739086	YQKPABUFKZPTIG-UHFFFAOYSA-N	432.502	1.018	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(NS(=O)(=O)CC)c(C)c2)cc1	763830366	DGKXZMCYZXPVSJ-UHFFFAOYSA-N	432.502	1.719	50	20	IDGD	
COc1cccc(-c2nsc(NC(=O)C(=O)NNC(=O)COc3ccc(F)cc3)n2)c1	763839033	XZFLBKHLUKAMQS-UHFFFAOYSA-N	445.432	1.518	50	20	IDGD	
CO[C@H]1Cc2ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc3cccc(C)c3C)cc2C1	763840255	JWNGNAQWEOBVKD-KXBFYZLASA-N	425.485	1.970	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)Cc3c[nH]c4ccccc34)cc2)CCO1	763861408	QPXGWWJNWWIQJH-HNNXBMFYSA-N	435.484	1.722	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1cc2c(cc1F)CCC(=O)N2	763864439	JJSAQOCCIQEIMV-SNVBAGLBSA-N	432.383	1.403	50	20	IDGD	
CC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(C(C)=O)cc2)c1	763878925	UNPQINNPZAWKQA-CYBMUJFWSA-N	426.429	1.401	50	20	IDGD	
CC(C)CC(=O)NNC(=O)C(=O)Nc1cccc(CS(=O)(=O)Cc2ccccc2)c1	763881421	FRBWFPKZLGNZJQ-UHFFFAOYSA-N	431.514	1.934	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccccc2OC[C@H]2CCCCO2)n1	763885383	KSXDWRUIWSSIQB-MRXNPFEDSA-N	429.477	1.234	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(C(=O)OC)cs2)cc1OC	763910279	BFBWMTAVLLUCNO-UHFFFAOYSA-N	435.458	1.732	50	20	IDGD	
COCCc1cc(NC(=O)C(=O)NNC(=O)C2=S=C3CCCCCCC3=C2)n(C)n1	763912564	XKOQGNCYUAFJST-UHFFFAOYSA-N	433.534	1.067	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)ccc1Cl	763977834	VSZMGHDLQXQELC-UHFFFAOYSA-N	426.212	1.885	50	20	IDGD	
O=C(NNC(=O)c1ccc[nH]1)C(=O)Nc1cc(-c2nnc3n2CCCCC3)ccc1F	763979460	IIFMRFATUPPSAL-UHFFFAOYSA-N	425.424	1.538	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)on1)C(=O)Nc1ccccc1O[C@@H]1CCOC1	764004614	ZENUUMUGXLXCJY-OAHLLOKOSA-N	436.424	1.909	50	20	IDGD	
CC[C@H](C)C(=O)NNC(=O)C(=O)Nc1cc(C)nn1[C@@H]1CCN(Cc2ccccc2)C1	764087218	YJUZRVWVTXMIGS-MAUKXSAKSA-N	426.521	1.771	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(NC(C)=O)c(C)c2)o1	764139532	XDDLZYNVQDBZPE-UHFFFAOYSA-N	429.477	1.788	50	20	IDGD	
C=CCNC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2cccc3cccnc23)cc1	764144740	POTHPOXGGDGFQQ-UHFFFAOYSA-N	432.440	1.942	50	20	IDGD	
CC(=O)Nc1cc(NC(=O)C(=O)NNC(=O)c2cccc3ncccc23)c(F)cc1F	764254081	YPDJHZPLWFSTJN-UHFFFAOYSA-N	427.367	1.871	50	20	IDGD	
O=C1Cc2cc(NC(=O)C(=O)NNC(=O)c3cc(F)ccc3Br)ccc2N1	764270775	SZLCULYMTYDPSZ-UHFFFAOYSA-N	435.209	1.483	50	20	IDGD	
COC(=O)c1ccsc1NC(=O)C(=O)NNC(=O)c1cc(F)ccc1Br	764276888	HVSAORSVMBHKCQ-UHFFFAOYSA-N	444.238	1.836	50	20	IDGD	
O=C(NCc1noc(C2CC2)n1)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	764465709	RZYQVQGEDATFIL-UHFFFAOYSA-N	448.505	1.266	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)CSc1ccccc1O)N1CCN(c2ccc(F)cc2)CC1	765252550	MURZAAOVCSYGEU-HNNXBMFYSA-N	432.521	1.982	50	20	IDGD	
CCOC(=O)c1cnc(C)c(C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)c1	767163648	OZJMLWYKMPMTCA-UHFFFAOYSA-N	433.490	1.243	50	20	IDGD	
O=C(COC(=O)CCc1cc2ccccc2nc1O)NNC(=O)c1cccc([N+](=O)[O-])c1	767792353	DYWGPLORFWKUAH-UHFFFAOYSA-N	438.396	1.786	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)CNc1ccccc1)N1C(=O)c2ccc(Br)cc2C1=O	769649027	YKGKEJIWQSSIIZ-NSHDSACASA-N	445.273	1.693	50	20	IDGD	
Cn1cnn(-c2ccc(NC(=O)NNc3ccc(S(=O)(=O)C(F)F)cc3)cc2)c1=O	771461160	OKWSUXOYALKTSJ-UHFFFAOYSA-N	438.416	1.716	50	20	IDGD	
CCN(CC)C(=O)COc1cccc(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2)c1	773639367	OIVXUIXJDNFXFZ-UHFFFAOYSA-N	429.433	1.924	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNc2c(F)cccc2F)cc1S(=O)(=O)N(C)C	773707548	KRGNSVPYDWHRRW-UHFFFAOYSA-N	442.444	1.696	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2ccc(C(=O)NCCc3ccccc3)cc2)n1	773724557	RQRWDDGGYRQGFL-UHFFFAOYSA-N	434.456	1.540	50	20	IDGD	
CCO[C@H](CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)c1ccccc1	775199334	BHWWLSRGBJFCRM-GOSISDBHSA-N	434.518	1.659	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N2CCOCC2)cc1NC(=O)NNC(=O)c1ccccc1	775284219	ROENNBKHVMOOAC-UHFFFAOYSA-N	448.501	1.573	50	20	IDGD	
Cn1cc(S(=O)(=O)NNC(=O)c2c[nH]c3ccccc23)cc1C(=O)NCC(F)(F)F	775669050	CWOHFBIHDTWJNU-UHFFFAOYSA-N	443.407	1.422	50	20	IDGD	
COc1cccc([C@H]2[C@H](C(=O)NNC(=O)Cc3cn4ccccc4n3)CC(=O)N2C2CC2)c1	776335080	XHZKDGMXZAGWDJ-XXBNENTESA-N	447.495	1.785	50	20	IDGD	
COCCO[C@@H]1COCC[C@@H]1NC(=O)NNC(=O)[C@@H](C)Oc1ccc2ccccc2c1	777278934	LJOIARRHZTZEAX-UIAACRFSSA-N	431.489	1.758	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)n1	778888658	ZPONCVSVYUYELQ-UHFFFAOYSA-N	444.372	1.508	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1c[nH]nc1-c1cnn(C)c1	781410366	KUDODPHSZAVJOS-UHFFFAOYSA-N	432.824	1.090	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)C(=O)Nc2cccnc2-c2csc(C)c2)c1	782702146	HCZMSBJBZKBDLX-UHFFFAOYSA-N	438.469	1.872	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)cc1)C(=O)Nc1cccc(-c2nnc3n2CCCCC3)c1	782838034	XPIWWATZZIOMLQ-UHFFFAOYSA-N	434.456	1.777	50	20	IDGD	
CCNC(=O)COc1ccc(NC(=O)C(=O)NNc2ncccc2C(F)(F)F)cc1	783119365	COXJREPZEWTDKT-UHFFFAOYSA-N	425.367	1.697	50	20	IDGD	
COCCOc1cc(NC(=O)C(=O)NN=c2sc3ccccc3n2C)ccc1OC	783350172	WOHOTTAJGYNAQS-UHFFFAOYSA-N	430.486	1.844	50	20	IDGD	
O=C(NNc1cccc2c1CCCC2)C(=O)Nc1ncn(CC(=O)N2CCCCCC2)n1	783454685	MFGGEQYNFWGCHX-UHFFFAOYSA-N	439.520	1.641	50	20	IDGD	
O=C(NNC(=O)C(=O)N1CCCC1)C(=O)Nc1ccc(OCc2ccccn2)c(Cl)c1	783998577	CJXYLAOMYCDGJN-UHFFFAOYSA-N	445.863	1.022	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H]2CN(C(=O)NNC(=O)CNC(=O)c3ccco3)C[C@H]21	784263366	MHWZZYLZKYYXDU-RBSFLKMASA-N	449.508	1.375	50	20	IDGD	
CNC(=O)c1cc(Oc2ccccc2NC(=O)C(=O)NNc2ncc(F)cn2)ccn1	784955103	AZSWKCCBLVAHBA-UHFFFAOYSA-N	425.380	1.244	50	20	IDGD	
COC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2cc(-c3cc(C)ccc3C)[nH]n2)c1	785126993	XNWXJDWYOLWJAL-UHFFFAOYSA-N	435.440	1.880	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)C(=O)Nc3nn(C(C)(C)C)cc3C#N)n[nH]2)c1	785130951	WKZOFABANDUKMR-UHFFFAOYSA-N	448.487	1.916	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)[C@@H]2CCC[C@H](C(N)=O)C2)c2ccccc2c1=O	786688722	RWFMXIHXCQMAJD-LSDHHAIUSA-N	427.505	1.639	50	20	IDGD	
CN(C)NC(=O)Nc1cccc(NC(=O)C2=NN(c3ccc(F)cc3)[C@@H](C(N)=O)C2)c1	788254424	IDDOUMNJVQDFAO-QGZVFWFLSA-N	427.440	1.483	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NNc2nnc(-c3ccccn3)s2)n(C)c1	788555065	IKMQBGOIHKRTSR-UHFFFAOYSA-N	435.535	1.726	50	20	IDGD	
O=C(NNC(=O)N1CC(=O)N(CC2CC2)C1)[C@H]1Cc2ccccc2CN1Cc1ccccc1	789830584	UBOZDRSSHPGTAD-JOCHJYFZSA-N	447.539	1.866	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)c1cnnn1-c1cccc(F)c1	789867175	NEOYRMIASNBIEK-UHFFFAOYSA-N	437.479	1.380	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)[C@H]2COCCN2C2CCCC2)c2ccccc2c1=O	789939925	RQITZIVXDCUGCF-GOSISDBHSA-N	427.505	1.211	50	20	IDGD	
CCC[C@@H](CCCS(C)(=O)=O)C(=O)NNc1nc(O)c2cnn(C(C)(C)C)c2n1	789942299	OAGBNUADTRPGLZ-LBPRGKRZSA-N	426.543	1.971	50	20	IDGD	
COc1cc(OC2CC2)ccc1C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	790120184	MNHKPRRWBQSRGJ-UHFFFAOYSA-N	439.877	1.612	50	20	IDGD	
Cc1noc(C)c1S(=O)(=O)N1CCC[C@H](C(=O)NNc2cccc(F)c2[N+](=O)[O-])C1	791069515	MPWBSWDYFNTBMA-LBPRGKRZSA-N	441.441	1.883	50	20	IDGD	
COCCC[C@H](Cc1ccccc1)NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	792286490	TVPLQZHGDYXWRE-QGZVFWFLSA-N	437.500	1.915	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)Nc2ccc(S(=O)(=O)NC)cn2)cc1OC	792399402	BMZJSQQVHRSIKI-UHFFFAOYSA-N	437.478	1.254	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)[C@H]2CC(c3cc(OC)ccc3OC)=NO2)c1	792632349	BEVYRVASZAWWCC-LJQANCHMSA-N	428.445	1.465	50	20	IDGD	
Cc1ccc(NC(=O)OC(C)(C)C)cc1C(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1	793177447	RCVFCZOEOFTEGV-CYBMUJFWSA-N	426.495	1.473	50	20	IDGD	
C[C@H](C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1)c1ccc2c(c1)OCO2	794394429	XSQOOOXOAHAFLU-INIZCTEOSA-N	438.484	1.124	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NN=Cc1c(F)ccc(I)c1F	794520147	KTRXOMBTFSDUSE-UHFFFAOYSA-N	444.179	1.845	50	20	IDGD	
N#CCc1ccccc1S(=O)(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	794579161	RNOKGYGQAPGSJD-UHFFFAOYSA-N	448.526	1.160	50	20	IDGD	
C[C@H](Oc1ccc(C=O)cc1)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	794743077	WIFLIPDBVHRLBG-HNNXBMFYSA-N	445.497	1.512	50	20	IDGD	
CC(C)Oc1ccc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCC3)cc1C(N)=O	796991038	YXWGEBBHTYXWQP-UHFFFAOYSA-N	430.486	1.523	50	20	IDGD	
COC(=O)CN1CCN(c2ccc(NC(=O)NNC(=O)c3cccc(C)n3)cc2)CC1	797623948	UGVJCMTWFCIZSG-UHFFFAOYSA-N	426.477	1.152	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2c(F)ccc([N+](=O)[O-])c2C)cc1	800622761	RNWFHTDGAFTUFZ-LBPRGKRZSA-N	448.407	1.994	50	20	IDGD	
COC(=O)c1cc(C=NNC(=O)CN2c3cccc4cccc(c34)S2(=O)=O)n(C)c1C	800808377	JUDVWTUWDLTVAG-UHFFFAOYSA-N	440.481	1.932	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@@H](C(=O)NNC(=O)Nc2ccc(Cl)cc2)[C@@H](C)O)cc1	802017838	BKBQPFCIOVCZLB-MLGOLLRUSA-N	440.909	1.529	50	20	IDGD	
N#Cc1ccc(NNC(=O)CNS(=O)(=O)c2c[nH]c3ncccc23)cc1C(F)(F)F	802830454	XRVITLNDHHYYHX-UHFFFAOYSA-N	438.391	1.875	50	20	IDGD	
Cn1ncc(NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)c1-c1ccccc1	806979528	YTFSESDGUGUZRY-UHFFFAOYSA-N	435.469	1.938	50	20	IDGD	
CN1CCN(C(=O)NNC(=O)C2(c3ccc(I)cc3)CC2)CC1	807383024	YWANRDAXITXPIH-UHFFFAOYSA-N	428.274	1.311	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(OC)c(NC(=O)C(=O)NNc2cccc(F)n2)c1	807391675	FCHSAFWVPNSXIW-UHFFFAOYSA-N	439.469	1.342	50	20	IDGD	
CCOC(=O)C(=O)c1cc(S(=O)(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)cn1C	808069049	MHMFQVIGLVYWRN-UHFFFAOYSA-N	437.518	1.297	50	20	IDGD	
CC(=O)N1C[C@@H]2CCC[C@H](NC(=O)NNC(=O)c3nn(-c4ccccc4)cc3O)[C@H]2C1	808357715	NDUIYYQZQPBYHS-XIRDDKMYSA-N	426.477	1.169	50	20	IDGD	
Cc1nc2c3ccccc3nn2c(C)c1CCC(=O)N([C@H]1CCS(=O)(=O)C1)N(C)C	809800302	OEUMSRSZOQOVQM-INIZCTEOSA-N	429.546	1.924	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2ccc3c(c2)SCC(=O)N3)cc1	809984013	RQIBPOTXJGEJKM-UHFFFAOYSA-N	448.526	1.121	50	20	IDGD	
NC(=O)c1ccc(S(=O)(=O)N2CCN(Cc3ccc(OCCCCl)cc3)CC2)o1	811456562	CRDHRUCHIQCZCW-UHFFFAOYSA-N	441.937	1.893	50	20	IDGD	
COc1cccc(C2(CNC(=O)NNC(=O)c3csc(N4CCOCC4)n3)CC2)c1	811851627	LQFBJSCPWZCXCG-UHFFFAOYSA-N	431.518	1.664	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCc2ccc(CC(N)=O)cc2)cc1Br	811878307	HSBLIYGNZUTPOT-UHFFFAOYSA-N	435.278	1.630	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cc(C)cnc2Br)cc1	812980710	ZNLLPGJWSRPAQQ-UHFFFAOYSA-N	437.250	1.326	50	20	IDGD	
COC[C@@H](C)n1c(C)cc(/C=C(/C#N)C(=O)NS(=O)(=O)c2cncc(C#N)c2)c1C	813982492	LAJPNMYDTRIRKH-ZMNVVMRHSA-N	427.486	1.991	50	20	IDGD	
O=C(NNC(=O)c1ccc(Br)s1)C(=O)Nc1cn(Cc2ccccc2)nn1	815566889	IJTOWTXNNVBPJI-UHFFFAOYSA-N	449.290	1.550	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)C(C)(C)C)N(S(C)(=O)=O)CC2	849286359	XERATPVPJGHGSM-AWEZNQCLSA-N	427.523	1.146	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1ccccc1	912638396	BORVXVWLVZSCKA-IBGZPJMESA-N	431.514	1.662	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN1C(=O)c1ccc(Cl)c(Cl)c1)[C@H]1CCS(=O)(=O)C1	914719813	RUWNUORWFTVRAB-SMDDNHRTSA-N	448.328	1.180	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)COCC2CC2)c1	915636275	DFRJKCBIQXUFFG-UHFFFAOYSA-N	433.486	1.684	50	20	IDGD	
COCCOc1cccc(CNC(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)c1	916514540	SWEUFMWKXUCZFD-UHFFFAOYSA-N	437.522	1.620	50	20	IDGD	
Cc1ccc([C@@H](CNC(=O)NNC(=O)c2c(C)nc3ccccn23)N2CCOCC2)cc1	918099519	RFSPDOSZXKBXDA-LJQANCHMSA-N	436.516	1.969	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)NCc2ccc(CS(C)(=O)=O)cc2)cc1C	918101886	LEZKMWHEYHYDPC-UHFFFAOYSA-N	432.502	1.317	50	20	IDGD	
COc1cc2ncn(CCCC(=O)NNC(=O)c3ccc(C)cc3O)c(=O)c2cc1OC	918337485	ODPVFCLZWKXUER-UHFFFAOYSA-N	440.456	1.669	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)NCc2ccc(C(=O)N3CCN(C)CC3)cc2)cc(C#N)n1C	918580308	NNSREWYKOBEDGX-MTJSOVHGSA-N	430.512	1.816	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1	919810474	HLLXNAYVJPKIAL-OAHLLOKOSA-N	446.485	1.765	50	20	IDGD	
C[C@H](Sc1ccc(Br)cc1)C(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1	919886319	REHWJTFNKXULMN-GXSJLCMTSA-N	436.353	1.447	50	20	IDGD	
C[C@@H]1C[C@@H](C)CN(C[C@@H](C)NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)C1	919924636	QQWUXHDUWCXCCK-NJDAHSKKSA-N	444.624	1.896	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N2CCSCC2)cc1	920851471	MIUHKQPESDNMEV-FOWTUZBSSA-N	425.514	1.916	50	20	IDGD	
COC(=O)Cc1cc(=O)n(-c2ccc(C(=O)NNC(=O)NCCc3cccs3)cc2)[nH]1	920859405	KNRNEUQEXDSAQA-UHFFFAOYSA-N	443.485	1.129	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)Nc1cccc(CN2CCC[C@@H]2C(N)=O)c1	920931457	SYBGUQWXPMOFEI-LJQANCHMSA-N	439.516	1.930	50	20	IDGD	
CCC1CCC(CNC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)CC1	921118293	OQWVPOJZURWVAU-UHFFFAOYSA-N	438.598	1.860	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)N[C@H]2CCCN(C(=O)c3ccccc3)C2)c2ccccc2c1=O	1115946654	PCWINNGOWQSWOH-INIZCTEOSA-N	448.483	1.182	50	20	IDGD	
Cn1c(=O)cc(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c2ccccc21	1248674548	CTWURIAHMRTEOB-UHFFFAOYSA-N	433.512	1.512	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)[C@@H](CC)N=c1nn[nH]n1-c1ccccc1	1318373032	KXQWMUODTKFEDF-MRXNPFEDSA-N	447.503	1.034	50	20	IDGD	
Cn1cc([C@@H](NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c2ccccc2)cn1	1320204883	HLCFLNUREBTCCT-SFHVURJKSA-N	427.486	1.557	50	20	IDGD	
CS(=O)(=O)CC[C@@H](C(=O)NNC(=O)c1cncn1-c1ccccc1)c1ccccc1	1321420640	LYWJRUNWNCTXHI-GOSISDBHSA-N	426.498	1.852	50	20	IDGD	
O=C(CNC(=O)c1ccc(Br)s1)NNC(=O)c1n[nH]c2c1CCCC2	1321752408	QJQRMEJIJVKEOB-UHFFFAOYSA-N	426.296	1.304	50	20	IDGD	
CC(=O)N(c1nc(C=NNC(=O)[C@@H]2CCS(=O)(=O)C2)cs1)c1ccc(F)cc1F	1337047421	VCTSCKINEZNWGN-LLVKDONJSA-N	442.469	1.991	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NC2CCC(O)(c3cccnc3)CC2)c1	1342824167	HBSIVLNXZXDORX-UHFFFAOYSA-N	432.502	1.260	50	20	IDGD	
Cc1cn2c(=O)c(C(=O)N3CC[C@@]4(C3)CN(C(=O)C(Cl)Cl)CCO4)cnc2s1	1777990909	YOAPVQNZVKPFOY-QGZVFWFLSA-N	445.328	1.312	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)C3=NO[C@@H](c4ccccc4)C3)C2)C1	1778173302	CMPRZOKHSHMKDZ-CDXJDZJCSA-N	435.908	1.588	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3n[nH]c4c(F)cccc34)C2)C1	1778636757	FAAHTIORGHKSMP-VOJFVSQTSA-N	439.285	1.929	50	20	IDGD	
O=C(c1ccn2nccc2c1)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1778734184	GDKONMIEGOIBQH-WMLDXEAASA-N	425.258	1.468	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2)c1cc2ncsc2[nH]1	1779569533	KJJGTOXWXPSZIO-HBUWYVDXSA-N	426.926	1.352	50	20	IDGD	
CCc1cc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)nn1C	1779830310	VZEXQGWBWSEZDS-SCLBCKFNSA-N	427.343	1.457	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc4c(c3)CC(=O)N4)CCO2)C1	1781230543	VBRQEVMOVSYDRQ-VQTJNVASSA-N	440.327	1.861	50	20	IDGD	
Cn1nc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](F)Br)C3)C2)c2c1CCC2	1781329149	AGRPZVFRQQTFHN-WMLDXEAASA-N	429.290	1.043	50	20	IDGD	
CCC[C@@H](NC(C)=O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)Br)C1	1782001243	CBCTVFCIVFJMMH-NVQRDWNXSA-N	446.386	1.589	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3c4c(nn3C)CCC4)C2)C1	1782442033	UXRWNULNGNMCNA-IFXJQAMLSA-N	439.354	1.526	50	20	IDGD	
COc1cccc2c1C[C@H](C(=O)N1CC[C@@]3(CN(C(=O)[C@@H](O)CCl)CCO3)C1)CC2	1782986381	ZDGDKCBISZAOFT-NRJQMVOHSA-N	436.936	1.230	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cc(O)c(O)c(Cl)c3)CCO2)C1	1783536562	KDSHPNXHKDNOFN-DYZYQPBXSA-N	447.713	1.978	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)N2CC[C@]3(CN(C(=O)[C@@H](F)Cl)CCO3)C2)C1	1783550074	RPYXYAXVYRSOBL-STXHMFSFSA-N	447.935	1.998	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)C[C@@H]3CNc4ccccc4O3)CCO2)C1	1783877838	RCURDGKUVVDOKC-VWKPWSFCSA-N	437.924	1.333	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3cccc([N+](=O)[O-])c3)C[C@@H]21)[C@H](O)CCl	1784086632	YXLQGIVHQIHFKK-OWLYRPNTSA-N	439.896	1.107	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCBr)[C@H]3C2)o1	1786406331	NIJZQFKMXPFZMR-YDHLFZDLSA-N	442.310	1.616	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnn4c3OCCC4)C[C@@H]21	1786407343	SPDNLCSHXBGIIX-QEJZJMRPSA-N	441.326	1.044	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(O)c(OC)c3)[C@H]2C1	1789603282	FRUMZFUFHXBTND-XSWJXKHESA-N	426.897	1.248	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCn3c(=O)oc4ccccc43)C[C@@H]21	1789858982	UEJGASOUDNDJKN-GGXPGOJBSA-N	449.935	1.982	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ncc(F)cc3F)C[C@@H]21)[C@H](F)Br	1789921477	LKNQQBQDJKCEML-JDVFRBCBSA-N	436.228	1.644	50	20	IDGD	
CCOC(=O)c1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Cl)C[C@@H]32)cc1	1790260718	IQFBZCYFJNOAFC-QAETUUGQSA-N	426.872	1.991	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nc[nH]c3[N+](=O)[O-])C[C@@H]21	1790962076	UFLBJKVJVGJWMV-BJDJZHNGSA-N	444.286	1.085	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3c(C)n[nH]c3C)C[C@@H]21	1790963216	OTVJUYHCSRMSKB-LLLHUVSDSA-N	441.370	1.722	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCSC)C[C@@H]21	1790964491	YLLBLGQSWDHSBX-RMEBNNNOSA-N	437.400	1.254	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3Cc4ccccc4N3)C[C@@H]21	1791063238	DKCKZQBWKADJHB-ADBDHWBDSA-N	436.350	1.786	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cccc(OC)c3C)C[C@@H]21	1791257799	UCQHDIKMYXPNFS-GNBUJSLZSA-N	438.952	1.780	50	20	IDGD	
Cc1cnn([C@H](C)C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Br)C[C@@H]32)c1	1791597574	QZXIQUPQSNPECR-CAEXGNQWSA-N	431.306	1.423	50	20	IDGD	
C[C@H](CBr)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](C)[C@H]1SC(=N)NC1=O)C2	1792988322	VPUQIYGWZZFLAN-JOLBHGKHSA-N	445.383	1.458	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(C)(C)OC(=O)NC(C)C)C2	1793451578	CUBDRCOLCCORKS-QKPAOTATSA-N	431.961	1.897	50	20	IDGD	
COc1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C3)cn1	1793807473	YDQCMXSTZZSLTB-FWKYCFCSSA-N	438.488	1.476	50	20	IDGD	
CCc1nn(C)c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CO[Si](C)(C)C)C3)c1Cl	1794423674	YNSSHLMSCUTPSP-FVCICTRLSA-N	443.020	1.691	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cncc(S(C)(=O)=O)c1	1794626503	VXINVGJGDLLDQS-DEQVHRJGSA-N	444.351	1.520	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)c1csc(-c2ccccc2)n1	1796691746	HXWCWYSVZYCBMQ-YALNPMBYSA-N	435.933	1.613	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)n1ccccc1=O	1797937350	KOFAQPOHVGTNJS-XGYYKPKNSA-N	440.338	1.172	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(Cl)cnc1O)C2	1797953197	SXBBQJIONYLSDN-DRXBFXEBSA-N	427.961	1.495	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)nc3ccccc13)C2	1797956021	VYHLFIOPZMUADE-USGNIVHTSA-N	443.576	1.995	50	20	IDGD	
CC(C)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccn(C(F)F)c1=O	1797992966	DHNWNDCGETZINJ-DABQJJPHSA-N	431.867	1.712	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(N(C)C)nc1	1798268626	XQEQRXLEUFUAPG-ZIEJDFEHSA-N	425.327	1.134	50	20	IDGD	
CCc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](Br)CC)C3)nn1C	1798325664	KMHCUSJKDLUEOU-LMWOUKEDSA-N	427.343	1.359	50	20	IDGD	
N#CCc1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)cc1	1798442156	YVZBAHKCLLYILC-BCDXTJNWSA-N	432.484	1.317	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1n[nH]cc1I)[C@@H](F)Cl	1798790997	UNYHFTSAJALQHK-FBSDJGSXSA-N	440.644	1.801	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1[nH]cnc1-c1cccnc1	1799187402	HVOXXTRSEQQKAO-BJWYYQGGSA-N	439.520	1.097	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C12CC(C(=O)OC)(C1)C2	1800705251	NXUPWGPKUCPOHS-MHCPSFEUSA-N	443.338	1.093	50	20	IDGD	
COc1cc(C)c(C)cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc(B(O)O)c1)C2	1800797131	IKGNIYUQLZVYDV-ACDBMABISA-N	436.317	1.557	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@](C)(Cl)CCl)C3)C1	1800968620	GUPLIAFEBYNRLB-MXSVDAKMSA-N	449.375	1.792	50	20	IDGD	
C[C@H](CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCC(=O)NN(C)C)C2)Oc1ccccc1	1801453382	FNZBVXNRUXGDHS-AKHDSKFASA-N	430.549	1.855	50	20	IDGD	
Cc1cccc(C(=O)N2CCCC3(CCN(C(=O)c4ccc(B(O)O)cc4)CC3)C2)c1F	1805074237	QHCXXTBFWKTBFH-UHFFFAOYSA-N	438.308	1.973	50	20	IDGD	
O=C([C@@H]1ON=C(c2ccccc2)O1)N1CCC2(CCCN(C(=O)[C@@H](O)CCl)C2)CC1	1805522146	FXPWVCCSFIZPMI-JXFKEZNVSA-N	435.908	1.552	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2ccc(F)cn2)[C@H]1c1cccnc1	1805985672	DKSXSEVWSSBPRL-IIBYNOLFSA-N	442.495	1.308	50	20	IDGD	
C#CCO[C@H](C)C(=O)N1CCCC2(CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CC2)C1	1806003475	CXJWYAYHLWNYEW-UPMNJHNBSA-N	441.532	1.390	50	20	IDGD	
CC(=O)N(C)CCC(=O)N1CC[C@H](CNC(=O)CCBr)[C@@H]1c1cccnc1	1806343272	TZBINBGCLREYAZ-APWZRJJASA-N	439.354	1.741	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC2(CCCN(C(=O)CCN3C(=O)C=CC3=O)C2)CC1	1806385401	BYHYVCUJPRSWGL-UHFFFAOYSA-N	435.597	1.384	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)Cc2cccs2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1	1807370893	MUFIVUBMWXSWOR-PGRDOPGGSA-N	449.341	1.385	50	20	IDGD	
C[C@]1(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](F)Br)[C@@H]2c2cccnc2)CCCN1	1808088621	OMMWQHMFOCVETB-LUXYFRNMSA-N	427.318	1.920	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)C2(F)CC2)[C@H]1c1cccnc1	1808416201	GVLCRSNEXUEXOV-QRTPEGJISA-N	440.479	1.724	50	20	IDGD	
Cc1ccc(C(=O)C(=O)N2CCC3(CCCN(C(=O)c4cccc(B(O)O)c4)C3)CC2)cc1	1809979791	BTACTPRSFNUXRY-UHFFFAOYSA-N	448.328	1.403	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H](CNC(=O)/C=C\C(=O)NC2CC2)[C@@H]1c1cccnc1	1810129122	CDKOUQSOGUBZRT-XKOLFZHYSA-N	444.608	1.774	50	20	IDGD	
CC(F)(F)C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1	1810303988	YTBCWOICDHGPEE-CZUORRHYSA-N	432.431	1.055	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC2(CCCN(C(=O)[C@@H](CC)NC(N)=O)C2)CC1	1810822694	AGRNGXSURGANGC-UONOGXRCSA-N	431.375	1.838	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@H](CNC(=O)c2c[nH]c(=O)cn2)[C@@H]1c1cccnc1	1811453703	LSMLDQGGZGDROT-AXHNFQJDSA-N	438.315	1.721	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2nc3ccccn3n2)[C@H]1c1cccnc1	1813030890	NCOWOIWEDMEDHQ-RYRKJORJSA-N	442.907	1.698	50	20	IDGD	
C[C@H](C(=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@@H]1c1cccnc1)n1cncn1	1813402167	ONYZJQJAWSVIBP-FAAHXZRKSA-N	439.289	1.631	50	20	IDGD	
CCS(=O)(=O)CC(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](C)CBr)[nH]n1	1815171714	QWUIQSSBTILMPX-DGCLKSJQSA-N	449.371	1.868	50	20	IDGD	
CCc1ccc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)cc1	1815360583	JPYWWCGNPSLYOV-SFHVURJKSA-N	449.341	1.925	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccnc(F)c2)n[nH]1	1815424997	XCUKFWODINIQMG-HNNXBMFYSA-N	431.472	1.623	50	20	IDGD	
O=C(N[C@H]1CCc2nc(NC(=O)[C@H](F)Cl)sc2C1)c1cc(=O)nc2cccnn12	1817128828	QVUDKKKRZKWMHG-RTHLEPHNSA-N	436.856	1.306	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1	1817475909	ZNHPIXZPSBCRDG-MRXNPFEDSA-N	432.717	1.660	50	20	IDGD	
COC1(CC(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)CCC1	1817480048	ZUGYDXIAFPBOHK-GOSISDBHSA-N	440.309	1.355	50	20	IDGD	
Nc1n[nH]c(CCC(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@H](F)Br)CC3)n1	1819559597	AXBRPKIVTXWEJS-KBUNVGBDSA-N	446.306	1.079	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)Cc2ccncc2)n[nH]1	1820717669	DSOURAUGNFNDLL-GOSISDBHSA-N	448.487	1.352	50	20	IDGD	
CC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CNC(=O)c1cc(C)on1)CC2	1822849170	HPTDPHJABXHEPC-MNOVXSKESA-N	439.925	1.799	50	20	IDGD	
O=C(CC[C@@H]1CCOC1)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1823028493	NAXJPBYMEBRWMV-BEFAXECRSA-N	440.309	1.212	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](O)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](F)Cl)CC2	1823565643	DLCIBEQXVAVPSX-LIEFSGRHSA-N	436.893	1.433	50	20	IDGD	
O=C1CC[C@H](C(=O)N2CCCC[C@@H]2C2CCN(C(=O)[C@@H](F)Br)CC2)CN1	1823842103	XUSOVXLVJLJRFJ-SQWLQELKSA-N	432.334	1.823	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H](C)n2cnnn2)CC1	1824096301	OKHVHDQSDQTAJL-FMKPAKJESA-N	441.374	1.885	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)COC(C)(C)C)CC2	1826082929	GMGFASWLGQVFPK-GFCCVEGCSA-N	425.555	1.243	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCBr)CC2	1826085126	FTXNDFVWSRUVAO-SNVBAGLBSA-N	446.371	1.213	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@]1(C)CC1(F)F)CC2	1826092051	KAZUKVDXNGQAIT-BTDLBPIBSA-N	429.493	1.473	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)CCCn3cccc3)sc2C1	1826929999	SHHFMUFUDKSPJE-HNNXBMFYSA-N	446.577	1.710	50	20	IDGD	
O=C(C1CC(F)(F)C1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827048918	CQLWDUAWQYRHSX-IBGZPJMESA-N	434.292	1.645	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(F)nc2)CC1	1829193729	FUTBXDFTWQIABE-SFHVURJKSA-N	433.528	1.827	50	20	IDGD	
C[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1)C1(O)CCC1	1829743460	JVFUFIPZRDQLGQ-JLSDUUJJSA-N	437.364	1.230	50	20	IDGD	
O=C(CCn1ccnn1)N1CCC([C@H]2CCCCN2C(=O)[C@H](F)Br)CC1	1830381318	ISNWTKBYONASKH-ZBFHGGJFSA-N	430.322	1.978	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccncc3F)C2)C1	1830538455	FXNPOTYASMUTFP-ACJLOTCBSA-N	444.301	1.322	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)CC[C@@H]3CCOC3)C2)C1	1830545000	DLAWPARHIRXPSS-GPMSIDNRSA-N	447.370	1.291	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)c2cc(F)c[nH]2)CC1	1831706873	MOEUMQUKGCZNAS-FQEVSTJZSA-N	427.285	1.381	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3noc(C)c3C)CCO2)C1	1831984218	FKKPWCYXSAZQLT-KSSFIOAISA-N	444.326	1.535	50	20	IDGD	
Cc1cc(CC(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)no1	1832130388	QUOBWCACWCAYLR-OAQYLSRUSA-N	439.321	1.139	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3c[nH]c4ncccc34)CC2)CC1)[C@@H](O)CCl	1833310297	PKAQQSZRZPUJEW-SFHVURJKSA-N	433.940	1.348	50	20	IDGD	
C[C@@H](C(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)Br)CC2)CC1)n1ccnc1	1833378980	ZTSQERRFQJKCET-CABCVRRESA-N	440.386	1.799	50	20	IDGD	
CC[C@H](C(=O)NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)N(CC)CC	1833535916	SOZNHNGYVOILOG-MOPGFXCFSA-N	431.021	1.278	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3cncc(F)c3)CCO2)C1	1834352659	HPUHHXPXWDOFGC-SCLBCKFNSA-N	444.301	1.322	50	20	IDGD	
O=C(CCBr)NC1CCN(C2CCN(C(=O)c3cccc(O)n3)CC2)CC1	1834421143	LAORVEQQQDUXKI-UHFFFAOYSA-N	439.354	1.757	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)C(=O)c3ccccc3)CCO2)C1	1834708240	YECZLQSKORPZLH-AUUYWEPGSA-N	439.306	1.109	50	20	IDGD	
C[C@@H]1CC[C@H](C(=O)N2CCC(N3CCC(NC(=O)CO[Si](C)(C)C)CC3)CC2)O1	1835836908	AVMWCORZEQOXCC-VQIMIIECSA-N	425.646	1.977	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3noc4ccccc34)CCO2)C1	1835982879	YCNLLSRBAFLEIQ-IIBYNOLFSA-N	435.908	1.844	50	20	IDGD	
O=C(c1cc(Cl)ncn1)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836718192	JOHHMAQUPWOPEJ-OAHLLOKOSA-N	431.320	1.342	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)Cn3nc(C)cc3C)CC2)CC1	1837180625	JCWJHYALLFMQES-LJQANCHMSA-N	440.972	1.752	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)Cc3nc(C)no3)CC2)CC1	1837951236	KWKLNQMULMCCFG-INIZCTEOSA-N	428.917	1.173	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(C(C)(C)C)n[nH]3)CCO2)C1	1837993921	MDJYTNMNFIDKOZ-JLTOFOAXSA-N	442.944	1.031	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccoc1Cl)CCO2	1838844463	QPIROLREIDKNGX-GOSISDBHSA-N	430.961	1.855	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(Cl)nc3F)C2)C1	1839142608	UEDFCQGHJBHPIV-SCLBCKFNSA-N	434.295	1.962	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3F)C2)C1	1839152149	PEHJQOZNSVHTSQ-QZTJIDSGSA-N	434.295	1.527	50	20	IDGD	
Cc1cccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)c1F	1839197442	WOVMWWAAHPCGKY-CRAIPNDOSA-N	447.276	1.895	50	20	IDGD	
O=C(C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2)c1ccccc1	1839197622	CFSWTWIZQPIDOB-QAPCUYQASA-N	443.269	1.016	50	20	IDGD	
Cc1ccc(F)c(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)c1	1839202156	WELNUQXLMMKWTH-QAPCUYQASA-N	447.276	1.895	50	20	IDGD	
Cn1nc2c(c1C(=O)N1CCO[C@]3(COCCN(C(=O)C(C)(C)CCl)C3)C1)CCC2	1839581226	DNGOHBVJOYGWEE-OAQYLSRUSA-N	438.956	1.244	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3ccccc3C)CCO2)C1	1839942993	SSNUOHVXXVSVTQ-DENIHFKCSA-N	438.952	1.638	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](S)C(C)C)C2)C1	1839963106	ZZESKWVOAHAPAN-JJRVBVJISA-N	437.400	1.571	50	20	IDGD	
CSCC(C)(C)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](C)Br)CCO2)C1	1840030300	IDZJEMTVIFAGRO-SUMWQHHRSA-N	437.400	1.615	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3CCCSC3)C2)C1	1840035845	HYDJGTRYFASZAQ-GRDNDAEWSA-N	435.384	1.369	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4ccoc4cn3)C2)C1	1840154718	DPEHCCADKRKMAZ-YWZLYKJASA-N	437.880	1.152	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)Cc3ccccc3)C2)C1	1840156019	MFWHCWBNKYPPJS-ZWCUEREDSA-N	438.952	1.575	50	20	IDGD	
O=C(c1ccnc2ncccc12)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840189981	WJRGDBMAVBAKFK-IBGZPJMESA-N	439.299	1.504	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)n1cc(C)cn1)CCO2	1840402501	FYXJDMLSLGUDPM-UWVAXJGDSA-N	426.945	1.616	50	20	IDGD	
O=C(c1cnc2cc(C(F)(F)F)ccn12)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1	1841353258	NLEWPENHYBHAEK-CYBMUJFWSA-N	430.814	1.770	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)CCN2C(=O)Cc3ccccc3C2=O)C1	1841402778	KUVHLIDOVJBYIC-KRWDZBQOSA-N	447.919	1.059	50	20	IDGD	
CC(=O)N/C(C)=C/C(=O)N1CC2(CCCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C1	1841925466	YZASRUIXXWELQZ-GLNPCMGASA-N	442.944	1.362	50	20	IDGD	
Cn1nc(C(=O)N2CCCC23CN(C(=O)[C@H](Br)Cc2ccccc2)C3)cc1O	1842192424	CIROVWCBDPAQNL-OAHLLOKOSA-N	447.333	1.949	50	20	IDGD	
Cc1ncc(C(=O)N2CCCC23CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C3)cn1	1842332615	WPNXQIRBSHCEME-HNNXBMFYSA-N	437.928	1.734	50	20	IDGD	
O=C(c1ccc2nc(Br)nn2c1)N1CC2(CCCN2C(=O)[C@H](F)Cl)C1	1843363401	BQQVGNSTTMEKOG-NSHDSACASA-N	430.665	1.843	50	20	IDGD	
CCc1[nH]nc(C(=O)N2CC3(CCCN3C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)c1F	1843415605	QASFZCBITRUBBI-FSJBWODESA-N	429.456	1.062	50	20	IDGD	
CC(C)(C)OC(=O)N1C(=O)CC[C@@H]1C(=O)N1CCCC12CN(C(=O)C(Cl)Cl)C2	1846485709	NBUANFKAHYELMI-LLVKDONJSA-N	434.320	1.920	50	20	IDGD	
Cc1ccc2nc(COc3ccc(C(=O)NNC(=O)[C@@H]4CCS(=O)(=O)C4)cc3)cn2c1	11715560	ZYHUDEKSYLDYFL-MRXNPFEDSA-N	442.497	1.417	50	20	IDGD	
O=C(CC1(C(=O)O)CCCCC1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	13254712	ZQYVUKDPDIVDJC-UHFFFAOYSA-N	437.518	1.657	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc1	15948286	HUJIDXZCMXYKNO-UHFFFAOYSA-N	430.486	1.504	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)Nc3cccc([N+](=O)[O-])c3)nc2)CC1	16500616	XOTMZJFFLZRNOY-UHFFFAOYSA-N	435.466	1.075	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cnc3c(c2)c(C)nn3C)c1	23735436	BQOZNDIEPUEEHJ-UHFFFAOYSA-N	444.517	1.382	50	20	IDGD	
CCOc1ccc(CN2CCN(CC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)CC2)cc1	27567731	QZRCBDRBNVKGCT-UHFFFAOYSA-N	441.488	1.572	50	20	IDGD	
C[C@H]1CC(C)(C)C[C@]2(C1)NC(=O)N(CC(=O)NNC(=O)c1cc(Cl)ccc1O)C2=O	105349507	OIXGZDFXFFVWPL-YBTHPKLGSA-N	436.896	1.943	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(Cl)nc1Cl)c1csc(N2CCOCC2)n1	109687229	KMSPGGDMQDXGHZ-UHFFFAOYSA-N	438.318	1.305	50	20	IDGD	
C[C@H]1CCCN(Cc2ccccc2CNC(=O)NNC(=O)CNC(=O)c2ccco2)C1	725870549	KLYOZZAPFQHHOF-INIZCTEOSA-N	427.505	1.772	50	20	IDGD	
COc1cc(CNC(=O)NNC(=O)CNC(=O)c2ccco2)ccc1OCC(F)(F)F	725870791	SBBJIHUCRQJANK-UHFFFAOYSA-N	444.366	1.490	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)NC2CCN(c3ccc(C#N)cn3)CC2)nc2ccccc21	727605369	HAQCWDVNOBEXMQ-UHFFFAOYSA-N	432.488	1.382	50	20	IDGD	
CCN(C)[C@H](C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)c1ccccc1	727765774	RIXRHYHWSORSQZ-FQEVSTJZSA-N	444.557	1.925	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3ccccc3OC(F)F)cc2)CC1	728214021	KTARIZNNESFCCV-UHFFFAOYSA-N	440.472	1.981	50	20	IDGD	
C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	728846196	MZPYLSUJWUOWIR-GFCCVEGCSA-N	448.867	1.870	50	20	IDGD	
CS(=O)(=O)c1cc(Br)cc(C(=O)NNC(=O)Cc2cccnc2)c1F	728851699	UDMHDQLNSDJXLB-UHFFFAOYSA-N	430.255	1.390	50	20	IDGD	
Cc1nn(C(C)(C)C)c2nc(C3CC3)cc(C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)c12	729273978	DUUZAMJHPDNKPE-NSHDSACASA-N	436.538	1.071	50	20	IDGD	
CC[C@H](NC(=O)NNC(=O)COc1ccccc1O)c1ccccc1OCC(=O)N(C)C	730902289	GXVIZAYDOPKBDG-INIZCTEOSA-N	444.488	1.720	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)Cc2csc(NC(=O)c3ccco3)n2)C[C@@H](C)O1	732259560	HJGZHZNHCUXCTQ-CHWSQXEVSA-N	435.506	1.178	50	20	IDGD	
COc1cc(C(=O)NNc2ccccc2S(C)(=O)=O)cc(Cl)c1OCC(N)=O	732303795	LOBJOHKUNIGJJM-UHFFFAOYSA-N	427.866	1.373	50	20	IDGD	
CCOCCCn1c(NNC(=O)CS(=O)(=O)C2CCCC2)nc2ccccc2c1=O	733265597	HDBPOWLORHUDAM-UHFFFAOYSA-N	436.534	1.624	50	20	IDGD	
Cc1cc(NNC(=O)c2cccc(S(=O)(=O)NCc3ccc4c(c3)OCO4)c2)ncn1	734255727	XUJVBJXNMJMQRB-UHFFFAOYSA-N	441.469	1.749	50	20	IDGD	
Cc1cccc(CSCC(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)c1	735116615	AFGGNHJNQAUTMS-UHFFFAOYSA-N	449.602	1.703	50	20	IDGD	
COc1ccc(C)cc1NC(=O)[C@@H]1CCCN1CC(=O)NNC(=O)Cc1nc(C)cs1	735494286	AUNQOBDAGZVHKJ-INIZCTEOSA-N	445.545	1.562	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)NCc2ccccc2NS(=O)(=O)c2ccccc2)cn1	735579765	LWTULTCSMFKSSG-UHFFFAOYSA-N	428.474	1.365	50	20	IDGD	
COc1cc(OC)cc([C@@H](O)CNC(=O)NNC(=O)c2cc(Br)c[nH]2)c1	735677405	FYOHKNAOCAECNV-AWEZNQCLSA-N	427.255	1.472	50	20	IDGD	
Cc1cc(F)cc2c(=O)c(C(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)c[nH]c12	741743934	RTFAHWPNFAMJOY-UHFFFAOYSA-N	446.460	1.301	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1cccc(F)c1	741879131	LERSVTHAWJWJSK-CQSZACIVSA-N	435.477	1.411	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CCc2ccccc2O)cc(NS(C)(=O)=O)c1OC	743338129	JQFXCLRIHRXFTJ-UHFFFAOYSA-N	437.474	1.175	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NCCCn2cnc3ccccc32)cc1	743504067	KIJZMWILKLWDDR-UHFFFAOYSA-N	430.490	1.866	50	20	IDGD	
O=C(NNC(=O)[C@H]1CC(=O)N(Cc2ccccn2)C1)c1cc(Br)ccc1O	743733959	WCMRJKZXHBDLQT-NSHDSACASA-N	433.262	1.359	50	20	IDGD	
COc1ccc(C)cc1-n1ccc(C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)n1	744877038	VOEURPSJRBQWTD-UHFFFAOYSA-N	433.424	1.679	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)NCCS(=O)(=O)NC[C@@H]2CCCCO2)c(Cl)c1	745816053	RVELONDSEFORJC-ZDUSSCGKSA-N	447.945	1.473	50	20	IDGD	
Cc1cccc(NS(=O)(=O)c2cc(C(=O)NNC(=O)N3CCOCC3)ccc2C)c1	745991701	FBDRVUSLIBGQOL-UHFFFAOYSA-N	432.502	1.791	50	20	IDGD	
CCN(c1ccccc1)S(=O)(=O)c1ccc(C(=O)NNC(=O)N2CCOCC2)cc1	745992891	LORSCXKIEZNFJG-UHFFFAOYSA-N	432.502	1.588	50	20	IDGD	
CSc1nc(-c2ccco2)nc(C)c1C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	747199956	KWTGOPBCYNDBPQ-UHFFFAOYSA-N	436.457	1.817	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NN/C=C1\C(=O)N(c2ccccn2)C(=O)c2ccccc21	751260363	KNIZQVSTOYVMHH-VBKFSLOCSA-N	431.408	1.253	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2cn(C(C)C)cn2)c1	753943312	SNBZGVLMBOZGNE-UHFFFAOYSA-N	443.551	1.118	50	20	IDGD	
CC1(C)C[C@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)CCO1	754675323	MRFLXMBNRXATOK-MRXNPFEDSA-N	438.550	1.763	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)Nc1ccc2c(c1)CCC(=O)N2	755631190	ZJZLGQPKRROQDC-UHFFFAOYSA-N	436.516	1.936	50	20	IDGD	
CSc1nnnn1-c1cccc(NC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])c1	755735703	ZRYKTUZTSSFYMR-UHFFFAOYSA-N	444.433	1.524	50	20	IDGD	
CC(C)C[C@H](C)OCCC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	755775796	JEPKHZQHADKQBL-KRWDZBQOSA-N	426.583	1.907	50	20	IDGD	
COC(=O)c1cccc(NC(=O)C(=O)NNC(=O)CCc2ccccc2)c1Br	756155742	SQKSSZGWIHVWPP-UHFFFAOYSA-N	448.273	1.954	50	20	IDGD	
O=C(NNC(=O)c1c[nH]c2ccccc12)Nc1cccc(N2CCS(=O)(=O)CC2)c1	756205525	IMEUKOXAMQAULO-UHFFFAOYSA-N	427.486	1.869	50	20	IDGD	
COC(=O)CN1CCN(c2ccc(NC(=O)NNC(=O)c3cccc(C#N)c3)cc2)CC1	756394831	ZQRYMUHZAMLRSD-UHFFFAOYSA-N	436.472	1.320	50	20	IDGD	
Cc1cccc(NS(=O)(=O)c2cccc(C(=O)NNc3ccc(C(N)=O)nn3)c2)c1	757402149	IIBDXNOFOAEVAP-UHFFFAOYSA-N	426.458	1.442	50	20	IDGD	
CCN1CCN(C(=O)Cc2ccc(NC(=O)NNC(=O)c3ccc(Cl)nc3)cc2)CC1	757582322	MWVBFMZLZUUWRZ-UHFFFAOYSA-N	444.923	1.908	50	20	IDGD	
COC(=O)c1cc(NC(=O)NNC(=O)c2c[nH]c3ccccc23)cc(S(C)(=O)=O)c1	757673806	KHFBIWSGYKYSSF-UHFFFAOYSA-N	430.442	1.825	50	20	IDGD	
CCOC(=O)C(C)(C)n1cc(NC(=O)NNC(=O)c2nnc(O)c3ccccc23)cn1	757721784	ZSUAMCDMGOFYRW-UHFFFAOYSA-N	427.421	1.297	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NN=Cc1nc(Cl)cs1	758089187	AZBFRISKRIXGMC-UHFFFAOYSA-N	442.950	1.900	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCCSc2nccs2)c1	759602748	ZBEHKCFXMFYQSX-UHFFFAOYSA-N	443.576	1.520	50	20	IDGD	
Cc1ccnc(-n2nccc2NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)c1	760289569	DYNBHZWIERRYMI-UHFFFAOYSA-N	430.371	1.333	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCC([C@H](O)c2nccn2C)CC1	760876787	TWRIWJOXPGBZRN-SFHVURJKSA-N	435.912	1.289	50	20	IDGD	
CCC(CC)[C@@H](C)C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	761215345	OWMIIKIRFYURQB-MRXNPFEDSA-N	439.578	1.860	50	20	IDGD	
O=C(NNc1nccc(N2CCOCC2)n1)c1cn(-c2ccc(C(F)(F)F)cn2)nn1	762862723	YFJFDWISKHROSC-UHFFFAOYSA-N	435.370	1.065	50	20	IDGD	
CCn1cnnc1-c1cccc(NC(=O)C(=O)NNC(=O)c2ccc(OC)c(OC)c2)c1	763550137	HGHIECPAUGJJHQ-UHFFFAOYSA-N	438.444	1.382	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)Nc1ccnn1-c1ccc(Cl)cc1	763573858	VITKXZIRSMHVTB-MRXNPFEDSA-N	441.831	1.452	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2cccc(C(F)(F)F)c2)ccc1C(N)=O	763640472	XZSCSOJFAJBTOT-UHFFFAOYSA-N	438.362	1.278	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)COc2cc(C)cc(C)c2)c(C)c1	763649248	IFHMKOFJACKINF-UHFFFAOYSA-N	443.456	1.329	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)cc1Cl	763681785	NSDSTTYZTMICET-UHFFFAOYSA-N	446.847	1.402	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(N2CCO[C@@H](C)C2)cc1	763710600	AVGDJLBWDAMWPO-INIZCTEOSA-N	440.500	1.639	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2ccc(OC[C@@H]3CCCO3)cc2)c1	763773559	YTJMBNUUQPOLCU-KRWDZBQOSA-N	443.456	1.661	50	20	IDGD	
CCSCc1cccc(NC(=O)C(=O)NNC(=O)c2nnc(O)c3ccccc23)c1	763789724	AAMMFXPMJJGSJL-UHFFFAOYSA-N	425.470	1.988	50	20	IDGD	
Cc1cccc(F)c1NC(=O)C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	763797552	WGCPGGKFZZXSJR-UHFFFAOYSA-N	448.476	1.318	50	20	IDGD	
Cc1ccc(S(C)(=O)=O)cc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1cccc(C)c1C	763848551	IVRJIZBPXYTHRV-OAHLLOKOSA-N	447.513	1.569	50	20	IDGD	
COC(=O)c1ccc(OC)cc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1cccc(C)c1C	763851068	QGRRRGOSVGGRTG-CQSZACIVSA-N	443.456	1.652	50	20	IDGD	
COC(=O)c1cc(Cl)cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)c1	763867285	ZKFHPOUYXCZTPP-JTQLQIEISA-N	437.811	1.819	50	20	IDGD	
Cc1nc(-c2cccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc3ccc(F)cc3)c2)n[nH]1	763867660	YEGDWJDYXOHUCS-NSHDSACASA-N	426.408	1.473	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cc3c(cc2Cl)OCCO3)cc1OC	763901206	MATKZUTZCKAEOB-UHFFFAOYSA-N	449.847	1.918	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3cccc([C@@H]4CNC(=O)C4)c3)cc2C1	763944224	XXPSEQICTMSBHZ-WFASDCNBSA-N	440.525	1.876	50	20	IDGD	
CNC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCCCC3)cc1	763969652	YIRJNLWBRFHQRC-UHFFFAOYSA-N	444.513	1.542	50	20	IDGD	
CCS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)cc1	763974181	MTCMJOQBPIVIHV-UHFFFAOYSA-N	425.850	1.239	50	20	IDGD	
Cc1nc(Br)ccc1NC(=O)C(=O)NNC(=O)c1ccc2c(c1)OCCO2	764006336	PBBWMCGPIMKVFO-UHFFFAOYSA-N	435.234	1.323	50	20	IDGD	
O=C(NNC(=O)c1cccc(Br)c1)C(=O)Nc1cnn(C[C@H]2CCCO2)c1	764058185	DJQJFWCIXUFOJX-CQSZACIVSA-N	436.266	1.224	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(OCCCN(C)C)cc2)c1O	764132307	MVZOEWXXWNGFGL-UHFFFAOYSA-N	430.461	1.131	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccc(N2CCCC2=O)c(Cl)c1	764135573	IVZUOLXJWPIERZ-UHFFFAOYSA-N	444.875	1.804	50	20	IDGD	
C[C@H](C(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)CC2CCCC2)c1)n1cccn1	764178523	CFDOQBUHFFFZBD-CQSZACIVSA-N	426.477	1.749	50	20	IDGD	
CCOC(=O)c1ccsc1NC(=O)C(=O)NNC(=O)c1cccc(OC(F)F)c1	764259680	MCTYKNHEOPSDOH-UHFFFAOYSA-N	427.385	1.926	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)C(=O)Nc1ccc(-c2n[nH]c(-c3ccccc3)n2)cc1	764267484	WSPPKUZBIGWXPV-UHFFFAOYSA-N	441.451	1.862	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNC(=O)CCc2ccccc2O)ccc1Cl	764278104	JUDYNOUEUDSDMT-UHFFFAOYSA-N	433.848	1.941	50	20	IDGD	
CCCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)CCc2ccccc2O)cc1Cl	764278410	PCKAJAZGTVCFBL-UHFFFAOYSA-N	446.891	1.904	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)C(=O)Nc1cccc(CN2CCCCC2=O)c1	764281231	NLGRMPWFBOOIGE-UHFFFAOYSA-N	438.484	1.623	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)C(=O)Nc2cc(C(F)(F)F)ccc2SCCC#N)cn1	764358960	LHKYVWUTHNYLDA-UHFFFAOYSA-N	440.407	1.844	50	20	IDGD	
Cc1nc(-c2ccccc2)ncc1C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	764554813	XBDYQRAGRXJUQN-UHFFFAOYSA-N	445.888	1.828	50	20	IDGD	
C[C@H](CN1CCN(c2ccccc2)CC1)NC(=O)NNc1ccccc1S(C)(=O)=O	765804674	MEFQPLXAJWIWBF-QGZVFWFLSA-N	431.562	1.927	50	20	IDGD	
CCCC(=O)N1CCCC[C@@H]1C(=O)NNC(=O)CN1CCN(Cc2ccc(C)cc2)CC1	766641899	NYIHVVNDOOFAKE-OAQYLSRUSA-N	443.592	1.441	50	20	IDGD	
COc1cc(C(=O)NNC(=S)Nc2ccc(C)c(C)c2)cc(OC)c1OCC(N)=O	768061706	KKVZBGYRPBWQQF-UHFFFAOYSA-N	432.502	1.816	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)c1nccc2c(S(N)(=O)=O)cccc12	768465233	YPRUXCDMNUUUSH-NSHDSACASA-N	432.433	1.250	50	20	IDGD	
CCNc1nc(C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)cs1	769301887	JUJPPNZVHZTQGK-UHFFFAOYSA-N	436.969	1.807	50	20	IDGD	
CN(C)C(=O)COc1ccc(C(F)(F)C(=O)NNC(=O)Cn2cnc3ccccc32)cc1	769536969	FVJSPNPQTJDRTL-UHFFFAOYSA-N	445.426	1.443	50	20	IDGD	
COc1ccccc1[C@@]1(C)NC(=O)N(CC(=O)NNc2nc(-c3ccncc3)no2)C1=O	771424211	KADJTYJGBCUZGM-HXUWFJFHSA-N	437.416	1.051	50	20	IDGD	
COC1(C(=O)O[C@@H](C)C(=O)NNC(=O)CC(C)C)CCN(C(=O)OC(C)(C)C)CC1	772038839	VHOGWVUMLNCVKX-AWEZNQCLSA-N	429.514	1.528	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)cc1	772972126	SNEAGJMGZBKIHY-KBPBESRZSA-N	439.921	1.930	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)c2ccc(Cl)c(NS(C)(=O)=O)c2)c1	773082693	ZUKHEZFJDBEJFF-UHFFFAOYSA-N	425.854	1.140	50	20	IDGD	
NC(=O)C1CCN(c2ccc(NC(=O)C(=O)NNc3ccc([N+](=O)[O-])cc3)cc2)CC1	773640347	XSVGPNWVUZGUFW-UHFFFAOYSA-N	426.433	1.378	50	20	IDGD	
COc1ccc(S(=O)(=O)NCCC(=O)NNc2ccc(C(F)(F)F)cn2)cc1OC	775257133	BHMFQWPMSJRODA-UHFFFAOYSA-N	448.423	1.929	50	20	IDGD	
NC(=O)CC[C@@H](C(=O)NNc1ccc(C(F)(F)F)cn1)N1C(=O)c2ccccc2C1=O	775261622	MGEZJVXXTLZZMY-ZDUSSCGKSA-N	435.362	1.474	50	20	IDGD	
Cn1nc(Br)c2c(=O)n(CC(=O)NNc3ncc(Cl)cc3Cl)cnc21	775271826	RTYOJYVSNGYAMS-UHFFFAOYSA-N	447.080	1.738	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@@H]1CN(CC(=O)NNC(=O)c2ccccc2Cl)CCO1	775847266	BPCQHBNSRGJKFG-CYBMUJFWSA-N	426.901	1.327	50	20	IDGD	
O=C(COC(=O)[C@@H]1CCc2c(Cl)cccc21)NNC(=O)[C@H]1COc2ccccc2O1	775932105	POUQPVZIQYCZBA-RDTXWAMCSA-N	430.844	1.900	50	20	IDGD	
O=C(c1ccccc1)c1nc[nH]c1C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	776344581	VKZKIKHKIXEUGC-UHFFFAOYSA-N	425.470	1.838	50	20	IDGD	
Cc1cccc(-c2nnc(S)n2CCC(=O)NNC(=O)CNC(=O)OC(C)(C)C)c1	778442445	WGFILZBBWPDBMW-UHFFFAOYSA-N	434.522	1.604	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)[C@@H]3CCC(C)(C)C3)CC2)cc1	781711069	VDFRTUMHUNWHOJ-QGZVFWFLSA-N	436.578	1.275	50	20	IDGD	
CN1CCN(CC(=O)N(C)c2ccc(NC(=O)NNc3ncncc3Cl)cc2)CC1	782034411	RTYKOPGCBHVPCC-UHFFFAOYSA-N	432.916	1.489	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1Cl)C(=O)Nc1cccnc1N1CCOCC1	782928076	YENCUEJGAJBWNP-UHFFFAOYSA-N	438.271	1.625	50	20	IDGD	
COc1ccccc1CSc1ccccc1NC(=O)C(=O)NNC(=O)C(=O)NC1CC1	782964921	AXXSGXMMUHNFGJ-UHFFFAOYSA-N	442.497	1.352	50	20	IDGD	
COc1ccc(Oc2ccc(NC(=O)C(=O)NN[C@@]3(C)CCS(=O)(=O)C3)cn2)cc1	783426155	GCRXLHVFAJIGHW-IBGZPJMESA-N	434.474	1.019	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)CNC(=O)c2cccs2)cc(OC)c1C(C)C	784005404	ZGHXYWGSUFALKP-UHFFFAOYSA-N	448.501	1.405	50	20	IDGD	
O=C(NNc1ccc(Cl)nn1)C(=O)N1C[C@H](C(=O)N2CCCCC2)Oc2ccccc21	784789775	PICVTUPGDUCTGE-OAHLLOKOSA-N	444.879	1.380	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)C(=O)Nc2ccn(-c3cccc(F)c3C#N)n2)c1	784843718	CKSQJDITOOCVKK-UHFFFAOYSA-N	442.432	1.368	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)C(=O)Nc1cccc(CN2CCCCC2)c1	785060282	HPTHGMGDQUAREX-UHFFFAOYSA-N	434.500	1.649	50	20	IDGD	
O=C(NNc1nc(C(F)(F)F)cs1)C(=O)Nc1cccc(S(=O)(=O)NC2CC2)c1	785148166	XQXSIVQTTLPVNI-UHFFFAOYSA-N	449.436	1.684	50	20	IDGD	
CCN1CCC(n2nccc2NC(=O)C(=O)NNc2nccc(N(CC)CC)n2)CC1	785226114	PKCNKNHFVCACBM-UHFFFAOYSA-N	429.529	1.258	50	20	IDGD	
COC(=O)c1ccc(S(=O)(=O)NNC(=O)c2ccc(Cl)cc2OC)c(OC)c1	785480911	IQBSEBJKPJTUIZ-UHFFFAOYSA-N	428.850	1.767	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)c1cc(S(=O)(=O)N2CCCC2)ccc1Cl	788177067	ASPLWMYVLOASQG-UHFFFAOYSA-N	447.908	1.857	50	20	IDGD	
Cc1cc([C@H](CC(=O)NNC(=O)C(=O)NC2CC2)NC(=O)OC(C)(C)C)cc(Cl)n1	788495732	PXMQODAUKWLBEG-ZDUSSCGKSA-N	439.900	1.425	50	20	IDGD	
O=C(NNc1nnc(-c2ccccn2)s1)c1cccc(CN2CCS(=O)(=O)CC2)c1	788567215	WGRYHSKWVZLBGN-UHFFFAOYSA-N	444.542	1.587	50	20	IDGD	
CCOc1ccc(OC(C)(C)C(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1	788876026	UYLKYXMVTJMAID-UHFFFAOYSA-N	434.518	1.997	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)NCc2ccc(NC(C)=O)nc2)c1	789296431	ZPHVTLGPJKCVRT-UHFFFAOYSA-N	436.266	1.955	50	20	IDGD	
O=C(COc1cccc(C(F)(F)F)c1)NNC(=O)C(=O)Nc1nc2c(s1)CCC2	789732646	RQVBCVQLTBTONO-UHFFFAOYSA-N	428.392	1.816	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1cc([C@@H]2CCCO2)nn1C	789740637	XYDKIUVHEDLNOP-ZDUSSCGKSA-N	433.490	1.158	50	20	IDGD	
Cn1c(N)c(C(=O)/C(C#N)=C/c2cccc(I)c2)c(=O)n(C)c1=O	790587408	TWGMJIPIEKVWGO-UXBLZVDNSA-N	436.209	1.061	50	20	IDGD	
Cc1ccn(C[C@](C)(O)C(=O)NNc2ccccc2S(=O)(=O)NC(C)(C)C)c(=O)c1	790717398	ANDZBHQYUYYRBT-FQEVSTJZSA-N	436.534	1.128	50	20	IDGD	
COCC1(C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)CCN(C(=O)OC(C)(C)C)CC1	792789076	GEIARDCHFUVAAW-KRWDZBQOSA-N	449.504	1.638	50	20	IDGD	
Cc1ccc(N2N=C(Br)C[C@@H]2C(=O)N([C@H]2CCS(=O)(=O)C2)N(C)C)cc1	792855788	SYWPPRAGYSFPHH-LSDHHAIUSA-N	443.367	1.774	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)c1cc(F)c(F)cc1C(=O)c1ccccc1	793337124	MTLFHFYWPRRNKF-UHFFFAOYSA-N	427.363	1.980	50	20	IDGD	
COC(=O)[C@]1(c2ccccc2)CCN(CC(=O)NNC(=O)c2ccc(OC)c(OC)c2)C1	794809810	YTZWHHYROUZOGG-HSZRJFAPSA-N	441.484	1.282	50	20	IDGD	
Cc1sc2nc(CC(=O)NN=C(CS(=O)(=O)N(C)C)C(C)C)nc(O)c2c1C	794876295	CDAMDOHPDVGXEI-UHFFFAOYSA-N	427.552	1.576	50	20	IDGD	
CS(=O)(=O)C1(C(=O)OCC(=O)NN=C(c2ccccc2)c2ccccc2)CCOCC1	796390365	UYQBIHUOLSYUJN-UHFFFAOYSA-N	444.509	1.692	50	20	IDGD	
COC(=O)c1ccc(NC(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)nn1	799232755	PFBCGXSVHPCMPO-UHFFFAOYSA-N	425.405	1.021	50	20	IDGD	
Cc1cccnc1NNC(=O)C(=O)Nc1cnc(N2CCOCC2)c(Br)c1	799263248	RUVFESMWMXLIQB-UHFFFAOYSA-N	435.282	1.466	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2nnn(-c3ccc4c(c3)OCCO4)c2C)cc1	801106601	ZMMJCLLUTIWMKN-UHFFFAOYSA-N	436.428	1.055	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)CC[C@@H]2NC(=O)N(c3ccc(C#N)cc3)C2=O)cc1	802051651	YGZLNYKQQFYYMZ-KRWDZBQOSA-N	436.428	1.625	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1cc(C(F)(F)F)cc(Br)n1	806981416	SOMCLGDAVLLRIX-UHFFFAOYSA-N	435.160	1.743	50	20	IDGD	
COc1cc(OC)cc(Oc2ccc(CNC(=O)NNC(=O)C(=O)N3CCCC3)cc2)c1	807227498	YQYXBJWWSWKHLN-UHFFFAOYSA-N	442.472	1.949	50	20	IDGD	
CC(C)CC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)NNC(=O)c1cc(Br)c[nH]1	809972017	BPIACGBYMWNYHT-ZDUSSCGKSA-N	425.287	1.035	50	20	IDGD	
O=C(CNS(=O)(=O)c1c[nH]c2ncccc12)NNc1ccc(Br)nc1	810394810	AWTGHRGSGMFPKO-UHFFFAOYSA-N	425.268	1.142	50	20	IDGD	
CCn1c(SCC(=O)NN=Cc2ccc(S(N)(=O)=O)cc2)nnc1-c1ccccc1	811645064	WZHFENVRBVFXKM-UHFFFAOYSA-N	444.542	1.855	50	20	IDGD	
COCC(=O)N1CCc2cc(NC(=O)NNc3ccc(S(=O)(=O)N(C)C)cc3)ccc21	812964197	NHZNMSVBMHQBNL-UHFFFAOYSA-N	447.517	1.621	50	20	IDGD	
CC(C)C(=O)Nc1cc(C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)ccn1	815482083	CWSBCUITXZQCOQ-UHFFFAOYSA-N	429.389	1.202	50	20	IDGD	
CNC(=O)c1cc(Oc2cccc(NC(=O)C(=O)NNc3nccnc3OC)c2)ccn1	815571460	FFIASLWCGRHADW-UHFFFAOYSA-N	437.416	1.114	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)[C@@H](O)[C@H](O)c2nc3ccccc3[nH]2)c1	818751011	VGXCCVOIJXHAKI-GJZGRUSLSA-N	449.261	1.650	50	20	IDGD	
NC(=O)N[C@H](CC(=O)NNC(=O)COc1ccc(Br)cc1)c1cccs1	821904356	MVRIDLNSICLKOK-GFCCVEGCSA-N	441.307	1.837	50	20	IDGD	
COc1ccc(CC(=O)NNc2ccc(F)cc2F)cc1S(=O)(=O)N1CCOCC1	876990480	FDJGLQJXTDSGBB-UHFFFAOYSA-N	441.456	1.680	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)C2CCN(C(=O)/C=C/c3ccccc3)CC2)C[C@@H](C)O1	912921734	UQXLQCOJCDDLCD-TYFAACHXSA-N	442.560	1.585	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CNS(=O)(=O)c2ccccc2F)ccc1OC(C)C	913153665	SVIRBQOQSFOPDZ-UHFFFAOYSA-N	439.465	1.361	50	20	IDGD	
Cc1c(/C=C(\C#N)C(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)cc(C#N)n1C	913286863	LOLWEQCNCUMPNG-GIDUJCDVSA-N	425.832	1.770	50	20	IDGD	
Cn1ccnc1[C@H](NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)c1cccc(F)c1	914598239	RCXRVOUZPBRLOG-QGZVFWFLSA-N	435.423	1.269	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(OCC(=O)NNC(=O)C2CCCC2)c([N+](=O)[O-])c1	914842737	KOZKCIMFFKETKR-UHFFFAOYSA-N	442.494	1.342	50	20	IDGD	
O=C(NC[C@@H](c1ccc(F)cc1)N1CCOCC1)NNC(=O)c1cccc([N+](=O)[O-])c1	915897750	JOBAXUQYQBAKMV-SFHVURJKSA-N	431.424	1.751	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCCCN2C(=O)NC3(CCCCC3)C2=O)cc1OC	916268773	PSXQVYYURCEKFC-UHFFFAOYSA-N	447.492	1.293	50	20	IDGD	
CCCC(=O)N1CCC[C@H]1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	917529023	JUYQGIOCGZTGSA-KRWDZBQOSA-N	436.534	1.023	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNS(=O)(=O)c2cc(C)c(C(=O)O)s2)cc1	917723823	NKPCGIQDOSKPKI-NSHDSACASA-N	428.488	1.930	50	20	IDGD	
C[C@@H](COc1ccccc1)NC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	918087534	GFDGBSZYYYYDPG-INIZCTEOSA-N	448.549	1.111	50	20	IDGD	
O=C(NNC(=O)[C@H]1CC(=O)N(CC(F)(F)F)C1)c1ccc(F)cc1Br	918342106	REVTZXQCHQHJOT-ZETCQYMHSA-N	426.164	1.760	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)N[C@@H](C)COc1cccc(F)c1	918775935	FXWWBRMJDLQUDE-LBPRGKRZSA-N	437.497	1.839	50	20	IDGD	
CS(=O)(=O)N1CCC[C@H](NC(=O)NNC(=O)c2ccc(COc3ccccc3)o2)C1	920240172	KUZCVIULXBLZDV-AWEZNQCLSA-N	436.490	1.227	50	20	IDGD	
O=C(NC[C@H]1CCN(c2ccc(F)c(F)c2)C1)NNC(=O)c1ccc(-n2cnnn2)cc1	921123462	UXBAFHTUQNECBJ-CYBMUJFWSA-N	442.430	1.411	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)C3(c4cccc(C#N)c4)CC3)CC2)cc1	1253330734	YREKJDAXLLBBEM-UHFFFAOYSA-N	431.540	1.864	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)Nc2ccnc(Cc3ccccc3)n2)c2ccccc2c1=O	1320140111	QWGJABXTSVIQAU-UHFFFAOYSA-N	429.440	1.781	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)c2ccn(-c3ccncc3)n2)CC1	1339158388	XCPLRZDZPWOWSM-UHFFFAOYSA-N	429.481	1.611	50	20	IDGD	
O=C(C/N=C/c1ccco1)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Br)C2	1779445635	IRVDDNYSORLHPM-VVPGEPNGSA-N	444.301	1.903	50	20	IDGD	
CC(C)c1ccc(C(=O)N2CC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)cc1	1780760487	CLNKFVWTQDDTFN-XMMPIXPASA-N	436.317	1.247	50	20	IDGD	
COc1c(C)cc(C(=O)N2CC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)cc1C	1781876467	OKFPQOLENXGESU-QHCPKHFHSA-N	446.548	1.129	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(O)nc1)C2	1782003643	PTIKASKXESZBQA-WPKBUWHJSA-N	426.311	1.698	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H]1CCCN(C)C1)C2	1782003942	ZCUYCIBBPXXEAQ-WFXMFSGNSA-N	430.387	1.626	50	20	IDGD	
Cc1ccn2c(C(=O)N3CC[C@]4(CN(C(=O)CCBr)CCO4)C3)cnc2c1	1782488505	UHDOUXJSBGQYAK-IBGZPJMESA-N	435.322	1.871	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@H](C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](C)Br)C3)C2)C1	1783539844	OHYVKMMZECYGBP-GJRWTSMGSA-N	445.354	1.579	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc4c(c3)CCCC4=O)CCO2)C1	1783874068	CHOYFZQGHQYVJV-AVRDEDQJSA-N	434.920	1.903	50	20	IDGD	
C[C@@H](C#N)c1cccc(C(=O)N2CCO[C@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)c1	1783937844	PBLZAMUGIXEAHL-SBUREZEXSA-N	441.532	1.130	50	20	IDGD	
CCC[C@H](NC(C)=O)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](Br)CC)CCO2	1785446378	GCPCQYHJIBDLMS-VKJFTORMSA-N	432.359	1.295	50	20	IDGD	
CC(C)N[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CO[Si](C)(C)C)C[C@@H]21)C(C)C	1786963666	OZRULIFVSAFEOY-CGBFIWBNSA-N	427.662	1.840	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc[nH]c4nccc3-4)[C@H]2C1	1787329948	MXTMTOUIWMLLIU-KNPMLCFXSA-N	435.322	1.891	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc4snnc4c3)C[C@@H]21	1788763508	NJFSVJRZVKPVGC-NOLJZWGESA-N	449.609	1.531	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc4cccnn4n3)[C@H]2C1	1789144137	GILXSBQPCRLYQS-BCRCDCHUSA-N	440.331	1.559	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1ccc(C2(NC(=O)CN3CCCC3)CCC2)cc1	1789519668	CXRWJGPKRFGLCV-UHFFFAOYSA-N	436.516	1.529	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC1(c2ccc(NC(=O)Cc3cc[nH]n3)cc2)CCC1	1791116591	KBNHMEGDSDPULS-UHFFFAOYSA-N	433.472	1.399	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cn(C)c4ncccc34)C[C@@H]21	1791255336	MPJLNBIVEHLBDN-IKICRFKJSA-N	434.924	1.420	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]2C1)N1CSCSC1	1791298136	CYBBVXHBOGFJGX-VOAKCMCISA-N	442.434	1.813	50	20	IDGD	
COC(=O)CCCCCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)Br)C[C@@H]21	1791353432	CGAOWUVUGNXERR-VGWMRTNUSA-N	447.370	1.873	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCl)[C@H]1CC(=O)N(Cc2cccs2)C1	1793110554	KVKHLNOCVHEFSX-KSXIZUIISA-N	439.965	1.335	50	20	IDGD	
COc1cccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)CBr)C3)n1	1793983799	IFDVQGWIBKSQQH-FLTUCWPJSA-N	440.338	1.253	50	20	IDGD	
Cc1cc(C)n(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCBr)n1	1795117215	TWINXQSHJWIBBY-JLVBRIDZSA-N	427.343	1.265	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)c1cc2cc(F)c(F)cc2[nH]1	1797336219	FOFHJKURVMIKPK-ZWUPXRALSA-N	427.835	1.249	50	20	IDGD	
Cc1nc2sccn2c1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Br)C2	1797546411	YHOSGVKTDIUOBC-FOUMNBMASA-N	441.351	1.691	50	20	IDGD	
C[C@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2)c1ccc(O)cc1	1799297690	ODPVMRCQVOWBGI-FRQROOTJSA-N	425.323	1.870	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1c(O)cc(O)cc1O	1799655618	VZPAEUFDHBFEQL-OJLPPKNESA-N	443.294	1.038	50	20	IDGD	
Cc1nn2cc(CC(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)[C@H](F)Br)nc2s1	1800157233	RFPUYJMFDNCZOV-TWJQMWNJSA-N	444.330	1.970	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(F)F)C2)[C@H](Br)Cc1ccccc1	1800436748	PEHZRPQDXCNUOS-LXTVHRRPSA-N	431.277	1.847	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nnsc1C1CC1)C2	1800641260	VGXYOBDQTLANJH-RNJOBUHISA-N	443.367	1.792	50	20	IDGD	
Cc1noc(C)c1CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)Br	1800757014	LPYCDZDLICNDTH-JAMKOXHTSA-N	428.327	1.597	50	20	IDGD	
CCOC(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](Br)CC)C2)OCC	1801148622	FNQGYSJHFBWTLW-UMPJEAMMSA-N	435.359	1.539	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(CO)c(F)c1	1801902577	LZNGZSNUDJIMQQ-QHHYFVSCSA-N	433.307	1.758	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)Cc2cccnc2Cl)[C@H]1c1cccnc1)[C@@H](O)CCl	1803136381	PQSBSNXXEUJRRM-BQFCYCMXSA-N	437.327	1.978	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]1c1cccnc1	1803145808	IGYJVHARHXLIGO-ZRSRNVLSSA-N	449.935	1.443	50	20	IDGD	
COC(=O)CSCC(=O)NC[C@H]1CCN(C(=O)C(Cl)Cl)[C@H]1c1cccnc1	1803580327	LRWMYMLBHNJANI-DOMZBBRYSA-N	434.345	1.797	50	20	IDGD	
CN1N=C(C(=O)NC[C@@H]2CCN(C(=O)C(C)(C)CCl)[C@@H]2c2cccnc2)CCC1=O	1804116168	YPUSBZRSXYWUGQ-MAUKXSAKSA-N	433.940	1.961	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)NC[C@H]1CCN(C(=O)CN)[C@@H]1c1cccnc1	1804239573	NVVUZWPHYVHUSS-HLLBOEOZSA-N	439.944	1.178	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)CSC1=S	1804334596	TVMJFBZZMHFKQY-YFKTTZPYSA-N	448.408	1.516	50	20	IDGD	
C[C@@H]1[C@H](C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](O)CCl)C3)CCN1C(=O)OC(C)(C)C	1804630016	CJJBSWCOZHZTBA-DBHDPKECSA-N	443.972	1.870	50	20	IDGD	
Cc1ccc(CCC(=O)N2CCCC3(CCN(C(=O)c4ccc(B(O)O)cc4)CC3)C2)nc1	1807055051	DOQGIVDCIQMYNF-UHFFFAOYSA-N	449.360	1.547	50	20	IDGD	
O=C(/C=C/C1CCCC1)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1808482472	XPMLEUPSBSWUOY-LSCLZPPHSA-N	447.344	1.827	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)c1cc2cccn2cn1	1809446927	RBYRMEGHAARDII-IPELMVKDSA-N	427.892	1.649	50	20	IDGD	
O=C(CCC(F)(F)F)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1	1809967719	HXQQPIRCKNMKPY-UHFFFAOYSA-N	426.244	1.554	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)[C@@H]3CCc4ccccc43)CC2)C1	1809972372	ICRNVOSOGLOUNJ-HSZRJFAPSA-N	446.356	1.941	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)c1cccn2nccc12	1812150877	CSMWMZLWHLXVBZ-SNRMKQJTSA-N	427.892	1.649	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2cnn3ncccc23)[C@@H]1c1cccnc1	1813031209	PDBPFBAMJPPGKP-VDZJLULYSA-N	442.907	1.698	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2cc3ncccn3n2)[C@H]1c1cccnc1	1813031453	VMYNLBXZYXUVEO-BXWFABGCSA-N	442.907	1.698	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CNC(=O)C(F)(F)F)[C@H]1c1cccnc1)C(Cl)Cl	1813081977	IIPWVEOXIXPABD-JQWIXIFHSA-N	441.237	1.570	50	20	IDGD	
COC(OC)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[nH]n1	1815033113	UXBIGYZBWMMXHN-GIEPYWIESA-N	445.480	1.155	50	20	IDGD	
CN(CC(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1)C(=O)c1ccccc1	1815086123	BRECWPBXUJPAOI-IAGOWNOFSA-N	447.923	1.774	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)c3cc(O)n[nH]3)sc2C1	1815217360	DMVHZMIMRCVISM-YUMQZZPRSA-N	428.312	1.971	50	20	IDGD	
CCOCC(=O)Nc1cc([C@H]2CCCCN2C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[nH]n1	1816881850	MSMPXAKFNUUGNS-DXRSZSRVSA-N	429.481	1.572	50	20	IDGD	
CC(C)CNC(=O)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](C)Br)CC2	1817331009	WUEPYZNJDLLLQX-VHSXEESVSA-N	431.356	1.611	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)ccn1	1817476978	VAWVSGBSSTXHTB-LJQANCHMSA-N	433.277	1.413	50	20	IDGD	
CNC(=S)NCCC(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](C)Br)[nH]n1	1819409050	QIDWTTFMMWHERL-ZYHUDNBSSA-N	445.387	1.669	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1CCc2nc(NC(=O)C(=O)Nc3cccnc3)sc2C1	1820048510	UMEMSPLZCCJZQZ-GFCCVEGCSA-N	447.593	1.940	50	20	IDGD	
COC[C@@H](NC(C)=O)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)C(C)(C)CCl)CC2	1820183802	GQORNAXQRTURAT-DGCLKSJQSA-N	430.958	1.471	50	20	IDGD	
C#CC(=O)N1CCCC[C@@H]1c1cc(NC(=O)CN(C)NC(=O)NCc2ccccc2)n[nH]1	1820711575	SGWYCOVQEDGYOF-GOSISDBHSA-N	437.504	1.381	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)COc2cccnn2)[nH]n1)[C@@H](F)Br	1820937842	RLHIKNOQEYYUGA-XHDPSFHLSA-N	441.261	1.961	50	20	IDGD	
CC[C@@H](Br)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2CNC(=O)O2)[nH]n1	1822083892	DJRWCTXZXSKMHC-USWWRNFRSA-N	428.287	1.684	50	20	IDGD	
C[C@H](Cn1cccn1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1	1822410229	BZADUPVFBOCCHR-WBVHZDCISA-N	444.540	1.308	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnc(N)s2)[nH]n1	1822414529	WCYUSSVCQWEDGR-GFCCVEGCSA-N	434.526	1.127	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)Cc3ccc4ncnn4c3)sc2C1	1822501270	LUAFBBICHYZOPY-QWHCGFSZSA-N	448.936	1.594	50	20	IDGD	
CC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CN1CCN(C(C)=O)CC1)CC2	1822848013	OLZJRIVEUMNCFB-KBPBESRZSA-N	441.985	1.237	50	20	IDGD	
COC(=O)NCC(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](C)CBr)CC1	1824096881	XTEYDCQCDMJTBP-ZFWWWQNUSA-N	432.359	1.993	50	20	IDGD	
CC[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnc(O)[nH]1)CC2	1825450754	VUANVYBLDGBMQO-JGVFFNPUSA-N	428.312	1.971	50	20	IDGD	
Cc1nnc(CC(=O)N[C@@H]2CCc3nc(NC(=O)[C@H](C)Br)sc3C2)o1	1825640461	AHYMHRKUIWVICE-IONNQARKSA-N	428.312	1.773	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccnc3c1OCO3)CC2	1826002808	CUEUQJLEYHZAIC-GXSJLCMTSA-N	438.893	1.746	50	20	IDGD	
Cc1cnc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)s1	1827050157	GZOMDAPVGIGUBH-LJQANCHMSA-N	441.362	1.678	50	20	IDGD	
Cc1cc(C)n(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)n1	1830358101	LSZPZOSSMWADIM-FQEVSTJZSA-N	426.945	1.221	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H](O)N2CCOCC2)CC1	1831654887	IFEUSCGKRYNDCL-URLQWDBASA-N	446.386	1.040	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)Oc3ccccn3)C2)C1	1831657424	OGJSQVOEDZQKAQ-WWMYMODYSA-N	439.940	1.713	50	20	IDGD	
Cc1cncc(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)c1	1832958959	MQBVJQNVVREAOY-QFIPXVFZSA-N	449.624	1.631	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1)[C@H]1CCCCO1	1833112976	RJUQKEWKAQKHSD-HZPDHXFCSA-N	434.350	1.818	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)Cc3cc(F)ccc3F)CC2)CC1)[C@@H](O)CCl	1833313417	FCCIQEXWAOKVGP-IBGZPJMESA-N	443.922	1.679	50	20	IDGD	
CC(=O)N[C@H](C(=O)NC1CCN(C2CCN(C(=O)C(Cl)Cl)CC2)CC1)C(C)(C)C	1833402781	DJUSIFREKFYHFF-MRXNPFEDSA-N	449.423	1.913	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)[C@H](C)NC(=O)CC)CC2)CC1	1833529706	HFACTUANKBKKMA-MAUKXSAKSA-N	429.005	1.880	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1)c1csnn1	1833558522	LTXMUTJZKNQLQG-CYBMUJFWSA-N	434.335	1.414	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC(N2CCC(NC(=O)COc3cccnc3)CC2)CC1	1833758257	LMMRYCIWAYVOPK-UHFFFAOYSA-N	448.640	1.884	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cnc(OCF)cn3)CC2)CC1	1833990972	XPVALDUBKCZPOG-INIZCTEOSA-N	441.935	1.985	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccnc(Cl)c3)CCO2)C1	1834185609	KEZXCAUYKAKRKM-YVEFUNNKSA-N	446.729	1.588	50	20	IDGD	
COc1cscc1C(=O)N1CCOC[C@@]2(CN(C(=O)CCBr)CCO2)C1	1834821603	OYTGBSPGGBHTOK-QGZVFWFLSA-N	447.351	1.612	50	20	IDGD	
O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)CCC(F)(F)F)CCO2	1835319898	NINOAJGDCKELRL-CQSZACIVSA-N	431.249	1.570	50	20	IDGD	
CCc1cc(C(=O)NC2CCN(C3CCN(C(=O)C(Cl)Cl)CC3)CC2)n(C)n1	1835957798	IGVIMEBYJUEHKM-UHFFFAOYSA-N	430.380	1.971	50	20	IDGD	
C[C@H](C(=O)N1CCC(N2CCC(NC(=O)[C@H](F)Br)CC2)CC1)n1cncn1	1836414254	BGHPCYKVMDHYHH-DOMZBBRYSA-N	445.337	1.101	50	20	IDGD	
C[C@H](C(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)n1ccccc1=O	1836717620	ZCAXVVZBAAORJM-QAPCUYQASA-N	439.940	1.008	50	20	IDGD	
Cc1n[nH]c(C)c1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1	1837807066	KOEYODVXRQXMBE-ROUUACIJSA-N	433.336	1.333	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)Cn3ccccc3=O)CC2)CC1	1837934409	IXHAQPMCSZDVDI-GOSISDBHSA-N	439.940	1.101	50	20	IDGD	
C=CCC(=O)N1CCC(OC2CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CC2)CC1	1838103176	MGDCBZDZSZYMCR-LFVJCYFKSA-N	429.521	1.695	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCCn3ccnc3C)C2)C1	1839149155	VFFSLZBINFDZFC-YLJYHZDGSA-N	426.945	1.446	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(O)c(O)c(Cl)c3)CCO2)C1	1839433623	MHPIDFUNTGRWSW-YJYMSZOUSA-N	447.315	1.839	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccccn3)C2)C1	1839963163	BOSFHZLDKKYWIR-KSSFIOAISA-N	426.311	1.325	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CCBr)C2)C1	1840031739	AZKIBFPFOXAOPU-RISCZKNCSA-N	442.148	1.011	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(C4CC4)cc3)C2)C1	1840155105	PXBVIWHHFMGSDO-SIKLNZKXSA-N	436.936	1.888	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840187772	VZXNLXAAZFFSRA-LJQANCHMSA-N	441.315	1.516	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)Cc1ccco1)CCO2	1840472529	JRAWYGHSOASWBB-SYNHAJSKSA-N	428.913	1.168	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843014483	OYUJNADQFQUMTO-UHFFFAOYSA-N	428.681	1.159	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H]2COC[C@@]2(C(=O)N2CC3(CCCN3C(=O)[C@@H](F)Cl)C2)C1	1843361469	JJTPNVRIJGGITA-MNVSYLFESA-N	445.919	1.608	50	20	IDGD	
Cn1cc(C(=O)N2CCCC23CN(C(=O)[C@H](F)Br)C3)c(C(F)(F)F)n1	1844465017	QORIRGOWDZXFTG-JTQLQIEISA-N	427.196	1.946	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCCC12CN(C(=O)[C@@H]1CCc3nc(O)nc(O)c3C1)C2	1845169381	FXZPIMBKXLMPFI-ADLMAVQZSA-N	443.331	1.432	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)CSc1ccccc1[N+](=O)[O-])C2	1846386305	YEVVSEXSRGKPMQ-UHFFFAOYSA-N	449.533	1.263	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](O)CCl)CC1	1847558297	BMALSZLYGZEOIL-LTIDMASMSA-N	443.972	1.825	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@](F)(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](O)CCl)C1	1847559976	WCZAOSJFSHJOCU-WZFJYNIESA-N	433.908	1.137	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)C1(O)CCN(C(=O)OC(C)(C)C)CC1	1847977582	DXSDEFQQEQVGAB-JYJNAYRXSA-N	443.972	1.968	50	20	IDGD	
CSc1cccc(N2C[C@H](C(=O)OCC(=O)NNC(=O)c3cccs3)CC2=O)c1	10265087	NLYYHFFJQUWFNJ-GFCCVEGCSA-N	433.511	1.827	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)Cn1c(=O)n(C)c2ccccc21	14167605	PLBRJUGPHHRKSM-UHFFFAOYSA-N	446.847	1.006	50	20	IDGD	
CC(=O)N1CCc2cc(S(=O)(=O)NNC(=O)c3cncn3-c3ccccc3)ccc21	15246601	SZDFMVVEDQKHQL-UHFFFAOYSA-N	425.470	1.405	50	20	IDGD	
O=C(CN1C(=O)[C@@H]2CCCC[C@H]2C1=O)NNC(=S)Nc1cccc(Br)c1	16107911	QEWIIQSCSAXDCB-CHWSQXEVSA-N	439.335	1.942	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Cc2csc(-c3ccccn3)n2)c2ccccc2c1=O	17189943	FNVGXCFMCBFUAD-UHFFFAOYSA-N	434.481	1.939	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N1CCN(c2cnccn2)CC1	26149157	WCXATCJKQWVRGW-CYBMUJFWSA-N	449.309	1.569	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)c2nc3nc(C)cc(C)n3n2)c2ccccc2c1=O	26791316	NLONPVKGCWIGJA-UHFFFAOYSA-N	448.487	1.716	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2ccccc2NS(C)(=O)=O)c2ccccc2c1=O	68991289	AKBQPPNXDZPHNR-UHFFFAOYSA-N	443.485	1.253	50	20	IDGD	
Cc1cccc(-c2nnc(S)n2CC(=O)NNC(=O)CNC(=O)c2cccs2)c1	725741493	OFUPAXLEAHYRSR-UHFFFAOYSA-N	430.515	1.181	50	20	IDGD	
Cc1cccc(C(=O)N2CCCN(C(=O)NNC(=O)CNC(=O)c3cccs3)CC2)c1	725871374	GYFOARMBVZXZNR-UHFFFAOYSA-N	443.529	1.375	50	20	IDGD	
Cc1nc2n(n1)C[C@H](NC(=O)NNC(=O)[C@H](C)Oc1cccc(Br)c1)CC2	727230011	YLFVWGNHXRFMES-GXFFZTMASA-N	437.298	1.462	50	20	IDGD	
O=C(CCCNS(=O)(=O)c1ccc2c(c1)CCCC2)NNC(=S)NCC1CCC1	727869238	JBWQHDULSNLLIT-UHFFFAOYSA-N	438.619	1.919	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@H](C(=O)NNc2nc(-c3cccnc3)no2)C(C)C)cc1	728078507	IDMJIZZAEQOGAV-INIZCTEOSA-N	430.490	1.886	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)c2ccc3c(c2)S(=O)(=O)N(C(C)C)C3=O)cc1	728204551	VPGVRUDVPGHDDE-UHFFFAOYSA-N	430.486	1.421	50	20	IDGD	
COc1ccc(OC)c(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)c1	728213170	FWQHGIDZHJGPGO-UHFFFAOYSA-N	434.518	1.397	50	20	IDGD	
CCOC(=O)c1ccc(Br)c(S(=O)(=O)NNC(=O)c2ccccn2)c1	728501039	DCVJCNBIFIFMSK-UHFFFAOYSA-N	428.264	1.644	50	20	IDGD	
O=C(Cn1nnc2ccccc2c1=O)NNC(=O)c1ccc(Br)cc1Cl	728828792	HKTGTMIOXMZQEC-UHFFFAOYSA-N	436.653	1.669	50	20	IDGD	
O=C(Cc1cc(Cl)c2c(c1)OCCO2)NNC(=O)C1CCN(c2ncccn2)CC1	728848163	XXDQMJUZGWLWKY-UHFFFAOYSA-N	431.880	1.508	50	20	IDGD	
CC(=O)Nc1ccc(CCNC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)cc1	728944675	JILSOTMNRFZXTJ-UHFFFAOYSA-N	446.533	1.433	50	20	IDGD	
CC1CCN([C@@H](CNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)C(C)C)CC1	728949894	VWTLMNYYGAVFPZ-IBGZPJMESA-N	431.585	1.780	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@H](C)C(=O)NNC(=O)c1ccc(S(N)(=O)=O)s1	729301108	YVROXCJOYHMMFP-SNVBAGLBSA-N	431.923	1.894	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cccc3ncccc23)cc1S(=O)(=O)NC1CC1	730226643	OYMOUHKCDHERDU-UHFFFAOYSA-N	440.481	1.759	50	20	IDGD	
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC[C@H](C(=O)NN=c2cc[nH]c3ccccc23)C1	730288875	CQPFIWVPAVITOH-HNNXBMFYSA-N	428.518	1.541	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(/C#N)C(=O)NCCC(=O)N2CCN(C(C)=O)CC2)c1C	730783436	NVXNIGBASAZERL-WBRURWICSA-N	443.548	1.416	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NCCCC(=O)N1Cc2ccccc2C1	732245098	PNRFLEUFBRRKFO-UHFFFAOYSA-N	429.502	1.131	50	20	IDGD	
CC(C)N1CCN(c2ccc(C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)cc2)CC1	734242138	VDYJZICUPDUYTC-UHFFFAOYSA-N	448.568	1.686	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)c1ccc(NS(C)(=O)=O)cc1	734250778	IXJKWFHJLNTKNW-UHFFFAOYSA-N	440.547	1.892	50	20	IDGD	
COc1ccc(S(=O)(=O)C[C@H](C)C(=O)NNc2nc3ccccc3c(=O)n2C)cc1	735053282	DUYMBUDSSDWEEF-ZDUSSCGKSA-N	430.486	1.495	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cc(C(=O)NNC(=O)c3cnn(C)c3)ccc2C)cc1	735470574	CICLVNFRRRYSNZ-UHFFFAOYSA-N	443.485	1.613	50	20	IDGD	
C[C@H](CN1CCOCC1)C(=O)NN=C1C(=O)Nc2c(Br)cc(Cl)cc21	735611866	FIWNIPHAZRNTLI-SECBINFHSA-N	429.702	1.843	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NC[C@H]2CCCN(Cc3ccccc3)C2)c2ccccc2c1=O	743359047	QQVMJXCKCAUQOJ-GOSISDBHSA-N	448.527	1.790	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)N[C@@H]1CC(=O)N(CCOc2ccccc2)C1	743639869	YJCAFTUUMIGBQL-MRXNPFEDSA-N	440.456	1.082	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)N[C@@H]2CC(=O)N([C@@H]3C[C@H]3c3ccccc3)C2)c1	743702053	NNJKAZSGCSOZRW-LSTHTHJFSA-N	438.484	1.805	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)CSc2ccc3c(c2)OCCO3)cc1	744499983	GRGGCBLCSQBXFH-UHFFFAOYSA-N	427.438	1.426	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H]1CCC[C@@H]1C(=O)OCC(=O)NNC(=O)c1cccc(C#N)c1	745074875	SOWRPOGIGUZUKM-HOTGVXAUSA-N	430.461	1.556	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)NCCS(=O)(=O)NC[C@H]2CCCCO2)c(Cl)c1	745816052	RVELONDSEFORJC-CYBMUJFWSA-N	447.945	1.473	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)N[C@@H]2CCCN(c3ccn(C)n3)C2=O)c1C	745882567	HQICZYRVXULAEU-JKSUJKDBSA-N	428.493	1.330	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)c1ccc(-n2cccn2)cc1	745925572	QMZYNHNKPNGOJM-CQSZACIVSA-N	431.456	1.824	50	20	IDGD	
Cc1cc(=O)c(C(=O)NNC(=O)N2CCOCC2)nn1-c1ccccc1C(F)(F)F	745992291	YVBMNLMMVXBELH-UHFFFAOYSA-N	425.367	1.246	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)NCCNS(=O)(=O)c2cccnc2)c1C	746270570	GVLKHKNJRFMRTI-LDADJPATSA-N	431.518	1.148	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCC(=O)NC1CCCCC1	746719005	VOHCKKZWQROBEN-LBPRGKRZSA-N	441.326	1.996	50	20	IDGD	
COC(=O)Cc1cc(=O)n(-c2ccc(C(=O)NNC(=O)c3ccc(Cl)cc3F)cc2)[nH]1	747432212	YPDGQZGERLPANS-UHFFFAOYSA-N	446.822	1.748	50	20	IDGD	
Cc1cccc(OCCC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)c1	748618813	HJNKPYUCVVNUOJ-UHFFFAOYSA-N	432.546	1.843	50	20	IDGD	
CC(C)(CCC(=O)NNC(=O)c1cccc(C#N)c1)C(=O)NNC(=O)c1cccc(C#N)c1	749380615	XUQGUCPNRVGRBI-UHFFFAOYSA-N	446.467	1.459	50	20	IDGD	
N#C/C=C(\c1ccc([N+](=O)[O-])cc1)N1CCN(S(=O)(=O)c2ccc(C(N)=O)o2)CC1	750036531	QLLSJPDSMOMYLZ-VIZOYTHASA-N	431.430	1.158	50	20	IDGD	
O=C(Cn1cc(Br)ccc1=O)NNc1nc(Br)cn2ccnc12	750247759	TYVXUGVMULLMIO-UHFFFAOYSA-N	442.071	1.559	50	20	IDGD	
Cc1cc(C)cc(-n2ccnc2SCC(=O)NNC(=O)CNC(=O)c2ccco2)c1	751200880	BIOFZFYHWDXAMV-UHFFFAOYSA-N	427.486	1.752	50	20	IDGD	
CSc1cccc(N2C[C@@H](C(=O)NNC(=O)CNC(=O)c3cccs3)CC2=O)c1	751208171	ACHDSUAIIQQKJN-LBPRGKRZSA-N	432.527	1.400	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2I)n1	751293043	RDQJRBLBUBEWQV-UHFFFAOYSA-N	443.201	1.474	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)C1=NN(c2ccccc2)[C@H](C(C)=O)C1	751294137	MBSPCAJHLZVVAD-FQEVSTJZSA-N	432.484	1.970	50	20	IDGD	
COc1ccc(C(=O)CNC(=O)CCC(=O)NNC(=O)c2cccc(N(C)C)c2)cc1	751297300	RPJORCDQMFIEGK-UHFFFAOYSA-N	426.473	1.302	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cc(S(N)(=O)=O)oc2C)cc1Br	754202779	AJJITTPNPHUVSE-UHFFFAOYSA-N	432.252	1.081	50	20	IDGD	
C[C@@H](NCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	754309724	BVSKBMQVDXLOOS-GDBMZVCRSA-N	449.508	1.981	50	20	IDGD	
CC(C)C[C@@H](C)OCCC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	755038102	ZZFYXGOQIZHFRQ-MRXNPFEDSA-N	441.550	1.310	50	20	IDGD	
CC(C)(C)OC(=O)Nc1ccc(CCNC(=O)NNC(=O)CNC(=O)c2ccco2)cc1	755141008	XUNLAOBZMMRUOP-UHFFFAOYSA-N	445.476	1.930	50	20	IDGD	
C[C@@H]1Oc2ccc(NC(=O)NNC(=O)C3CCN(c4ncccn4)CC3)cc2NC1=O	755558584	OMYMFOFELBCUHL-LBPRGKRZSA-N	425.449	1.265	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)Nc2ccc(-n3nccn3)nc2)c2ccccc2c1=O	755946985	ATZWKVBWLCXIAU-UHFFFAOYSA-N	447.459	1.639	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)Nc1ccc(C(=O)NCc2ccccc2F)cc1	755956543	QGDNHVOZFIRQEZ-AWEZNQCLSA-N	432.452	1.960	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)Nc1cccc(C(=O)N2CCSCC2)c1	756274530	SNHLVKDCBREKIA-SFHVURJKSA-N	442.497	1.868	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)Nc2ccc(S(=O)(=O)C[C@@H]3CCCO3)cc2)c1O	756495336	QDZNNHWNQNJFPC-AWEZNQCLSA-N	449.485	1.820	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)ccc1O)Nc1ccc2c(c1)S(=O)(=O)CC2	757709285	NMWSYTKDJNLSLN-UHFFFAOYSA-N	440.275	1.951	50	20	IDGD	
CC(C)C[C@H](Cc1cccc(Br)c1)C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O	758043059	DOINZSALRIGZEN-GXTWGEPZSA-N	448.383	1.739	50	20	IDGD	
COc1cccc([C@@H](CNC(=O)NNC(=O)C(=O)Nc2ccccn2)N2CCCC2)c1	758675924	RWLINDAYSWZDCA-QGZVFWFLSA-N	426.477	1.196	50	20	IDGD	
CC(=O)[C@@H]1C[C@H](CC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)C1(C)C	759376394	KFDLMLCVVZLJSZ-AEFFLSMTSA-N	435.546	1.874	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NC[C@@H](C[C@@H](C)O)c1ccccc1	759611713	OWQGSOBZDIDHOA-RHSMWYFYSA-N	447.561	1.787	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cccc([C@H]3CCOC3)c2)cc1OC	761533391	BSLBSQAKMLHGBY-KRWDZBQOSA-N	428.441	1.826	50	20	IDGD	
Cc1cnc(C2CCN(C(=O)NNC(=O)c3csc(N4CCOCC4)n3)CC2)s1	763128977	BJDPICYSXZHFTP-UHFFFAOYSA-N	436.563	1.979	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccnn2-c2cccc(Cl)c2)cc1OC	763551460	XPVUAROQJHLVIE-UHFFFAOYSA-N	443.847	1.943	50	20	IDGD	
Cc1nccc(-c2cccc(NC(=O)C(=O)NNC(=O)[C@H]3COc4ccccc4O3)c2)n1	763577783	LOTDRVDYJOOWMT-LJQANCHMSA-N	433.424	1.378	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1cccc(OC[C@H]2CCCO2)c1	763628454	KPUHBVXVMTWMQW-QGZVFWFLSA-N	437.456	1.600	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2cnn(-c3ccccc3F)c2C)c1	763629755	HOKBRMWLEPTWOR-UHFFFAOYSA-N	425.420	1.793	50	20	IDGD	
CN(C)Cc1cccc(NC(=O)C(=O)NNC(=O)COc2cccc(C(F)(F)F)c2)c1	763638556	AOULPNRBIRIQIW-UHFFFAOYSA-N	438.406	1.932	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2ccnn2Cc2ccccc2F)c1	763648692	WEIGNPWQGIGFMZ-UHFFFAOYSA-N	439.447	1.852	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(CS(C)(=O)=O)cc2)cc1C	763678734	BJVLCADQUIPGTH-UHFFFAOYSA-N	433.486	1.013	50	20	IDGD	
CSc1cc2c(cc1NC(=O)C(=O)NNC(=O)COc1ccccc1F)OCCO2	763680084	RMFAJYXYASYRAU-UHFFFAOYSA-N	435.433	1.484	50	20	IDGD	
CSCCc1ccc(NC(=O)C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1	763790823	PNBHHLGWBRCFBZ-UHFFFAOYSA-N	439.497	1.239	50	20	IDGD	
CCOC(=O)c1c(F)cccc1NC(=O)C(=O)NNC(=O)COc1ccccc1[N+](=O)[O-]	763804339	SCKWMAJPCBWVDY-UHFFFAOYSA-N	448.363	1.076	50	20	IDGD	
CN(C(=O)c1cccc(C(=O)NNC(=O)CNC(=O)c2cccnc2)c1)c1ccccc1	763825069	POBNTSDTQINGDE-UHFFFAOYSA-N	431.452	1.549	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1cccc(C(=O)NC(C)(C)C)c1	763865403	PNORYRREKCNFKY-CYBMUJFWSA-N	444.463	1.907	50	20	IDGD	
CCOC(=O)c1c(F)cccc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccc(F)cc1	763872036	JJVTXUOEFXMXLX-NSHDSACASA-N	435.383	1.695	50	20	IDGD	
C[C@H]1CN(Cc2cccc(NC(=O)C(=O)NNC(=O)Cc3ccc(F)cc3)c2)C[C@H](C)O1	763919794	VOIICZBDMBKKMF-HOTGVXAUSA-N	442.491	1.764	50	20	IDGD	
CN(C)C(=O)c1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)c1cc(Cl)ccc1O	763973976	JFABERWKYNTERH-UHFFFAOYSA-N	439.255	1.801	50	20	IDGD	
CN(C)C1CCN(c2ccc(NC(=O)C(=O)NNC(=O)c3cccn3C)cc2F)CC1	763996465	RCIWYOPYJGAOCC-UHFFFAOYSA-N	430.484	1.094	50	20	IDGD	
COc1cccc(Cn2nccc2NC(=O)C(=O)NNC(=O)Cc2ccsc2)c1OC	764034592	SKAHLGKCHHTWCI-UHFFFAOYSA-N	443.485	1.339	50	20	IDGD	
N#Cc1cccnc1-n1cc(NC(=O)C(=O)NNC(=O)Cc2ccc3ccccc3c2)cn1	764084232	JACPEUFCOZJNPH-UHFFFAOYSA-N	439.435	1.621	50	20	IDGD	
COC(=O)c1ccsc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccc(C)cc2)[nH]n1	764109971	FHBZJOZSMWTABS-UHFFFAOYSA-N	427.442	1.633	50	20	IDGD	
COC(=O)c1cc(C(C)C)ccc1NC(=O)C(=O)NNC(=O)c1cccc(OC)c1O	764133853	YEHDOKGCKHGHJM-UHFFFAOYSA-N	429.429	1.711	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccccc2F)cc1N1CCCS1(=O)=O	764321486	YNCPKCDFHIHJFY-UHFFFAOYSA-N	448.476	1.003	50	20	IDGD	
O=C(CNC(=O)c1ccc2c(c1)OCO2)NNc1c(F)cc(C(=O)NC2CC2)cc1F	764335898	WDUCDHXUXIYCMJ-UHFFFAOYSA-N	432.383	1.459	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(N3CCC(N(C)C)CC3)c(F)c2)o1	764370165	NZHAWQCEVKJLKS-UHFFFAOYSA-N	431.468	1.657	50	20	IDGD	
Cc1cc(N2CCOCC2)ccc1NC(=O)C(=O)NNC(=O)C(F)(F)Oc1ccccc1	764380108	ORJTVCQSCANROL-UHFFFAOYSA-N	448.426	1.589	50	20	IDGD	
CC(=O)N(C)c1cccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)c1	764386516	AFTNFJQKIYKNBO-UHFFFAOYSA-N	438.419	1.598	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)ccc1F	764388108	PYNLKGBSLXMFJN-UHFFFAOYSA-N	443.366	1.541	50	20	IDGD	
COC(=O)c1csc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(C)c(C)c3)[nH]n2)c1	764389180	YVCPEOZOQWIIGB-UHFFFAOYSA-N	441.469	1.941	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1ccc(-c2n[nH]c(C)n2)cc1	764392733	KNAYUONEFBFCKK-UHFFFAOYSA-N	440.485	1.667	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1ccc(C(=O)N(C)C)cc1	764398507	SXPNVSRUJJWJEU-UHFFFAOYSA-N	430.486	1.275	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H](O)[C@@H](C)c2ccc(C)cc2)c1	764584900	LPBWBNNPAQERPP-JXFKEZNVSA-N	447.557	1.951	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)Cc3nnc(O)c4ccccc34)CC2)cc1	765748199	KHEGCCJROSNBRN-UHFFFAOYSA-N	448.527	1.152	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)NCc2ccn(C)n2)cc1	765914866	SMMLAEXLNVXBQR-LFIBNONCSA-N	433.472	1.391	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)C1(C(=O)NC2CC2)CCC1	766659621	DEGCQYGQIPFKJY-UHFFFAOYSA-N	447.967	1.054	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)[C@H](C)OC[C@H]3CCCCO3)n[nH]2)cc1OC	768275707	DUOHVHWGDHIGPX-DZGCQCFKSA-N	432.477	1.829	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)NC)nc2)cc1OC	770221506	XARQAZWXRBFOJX-UHFFFAOYSA-N	436.490	1.252	50	20	IDGD	
C[C@@H]1CN(c2ccnc(C(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)c2)C[C@@H](C)O1	770813732	OYYLSTFRQKKZHO-ZIAGYGMSSA-N	436.472	1.017	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)c1ccc(N)cc1I	772187626	VVEJGRJJGRAEMO-SECBINFHSA-N	433.246	1.612	50	20	IDGD	
COCCOc1cccc(CC(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)c1	772465120	SVIUPTPVWQRGCF-UHFFFAOYSA-N	449.529	1.419	50	20	IDGD	
COc1cc([C@H](NC(=O)NNC(=O)Cc2cc[nH]n2)C(F)(F)F)cc(OC)c1OC	775997338	AEFMFWWUAJCIIZ-HNNXBMFYSA-N	431.371	1.612	50	20	IDGD	
COc1ccc(N2C[C@H](C(=O)NNc3cccc(S(C)(=O)=O)c3)CC2=O)c(OC)c1	776720830	IOOOPTWHXVPXQT-CYBMUJFWSA-N	433.486	1.604	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@@H]2COC3(CCCCCC3)O2)c1	776960035	YIIOXWWOYNQATE-OAHLLOKOSA-N	425.507	1.500	50	20	IDGD	
CCOC(=O)CN(CC(=O)NNC(=O)C1CC1)[C@H](C)c1cccc(Br)c1	777713790	WUUGOWSELSLDCJ-GFCCVEGCSA-N	426.311	1.933	50	20	IDGD	
CC1=NN(c2ccc(C(=O)N3CCN(S(=O)(=O)CBr)CC3)cc2)CC1	777777077	DPMMZYKGRRFYLZ-UHFFFAOYSA-N	429.340	1.713	50	20	IDGD	
COc1ccc(/C=C/C(=O)N2CCN(S(=O)(=O)CBr)CC2)cc1OC	777835627	BOGISWVULYFZDA-GQCTYLIASA-N	433.324	1.543	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCc3c(ncn3-c3ccccc3)C2)cc1OC	778236031	MDQVGSQSZTXFAK-UHFFFAOYSA-N	435.484	1.709	50	20	IDGD	
Cc1ccc(S(=O)(=O)n2ccc(C(=O)NNC(=O)CNC(=O)OC(C)(C)C)c2)cc1	778437675	IJTGXIODKBJBNQ-UHFFFAOYSA-N	436.490	1.319	50	20	IDGD	
C[C@H](CN1CCN(c2ccccc2)CC1)NC(=O)NNC(=O)CNC(=O)OC(C)(C)C	778676517	PTPNXJPUAQVQPA-MRXNPFEDSA-N	434.541	1.052	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NC[C@H]2CC(=O)N(C3CC3)C2)c2ccccc2c1=O	780892659	NNAJYPMCQLVHMN-CQSZACIVSA-N	440.504	1.152	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H](C)C2=CCN(C)CC2)c1	781397512	CJCGAWBYPYURAY-HNNXBMFYSA-N	437.566	1.312	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)c2ccc(O)cc2)sc2c1CCSC2	782837261	HCXILCIKAZNQLI-UHFFFAOYSA-N	449.510	1.819	50	20	IDGD	
CCc1ccc(NC(=O)C(=O)NNc2ccc(Br)cc2)cc1S(N)(=O)=O	783005657	BMRUEYRSWKHXSX-UHFFFAOYSA-N	441.307	1.741	50	20	IDGD	
CSc1nnnn1-c1cccc(NC(=O)C(=O)NNc2ncccc2C(F)(F)F)c1	783120802	RFGGKXLOTNKBKK-UHFFFAOYSA-N	438.395	1.880	50	20	IDGD	
O=C1CN(c2ccc(NC(=O)C(=O)NNc3ccc(Cl)cc3[N+](=O)[O-])cc2)CCN1	783292079	VHIMBQVSMJRHBJ-UHFFFAOYSA-N	432.824	1.266	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)F)cc1)C(=O)Nc1ccc(-n2nccn2)cc1	784833605	ORKGUQXPRYCLQD-UHFFFAOYSA-N	436.400	1.345	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1cccc2c1OCCC2=O	785330330	FMAPDYYEWXZUPP-UHFFFAOYSA-N	433.442	1.146	50	20	IDGD	
Cc1ccc(C(=O)NCC2CC2)cc1NC(=O)C(=O)NNC(=O)CCc1ccccc1O	785991339	QHCFWLZRTLLUEB-UHFFFAOYSA-N	438.484	1.559	50	20	IDGD	
CC(C)(C)c1cnc(CCC(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)o1	786205432	BWEIPXSQNOXBTK-OAHLLOKOSA-N	431.445	1.435	50	20	IDGD	
CCN(C(=O)COC(=O)/C(C#N)=C\C1CC1)c1c(O)nc(=O)n(Cc2ccccc2)c1N	786672523	BAEMSYYXOHTXJD-YBEGLDIGSA-N	437.456	1.335	50	20	IDGD	
CCc1ccccc1OCC(=O)NNS(=O)(=O)c1cc(F)ccc1OCCOC	786713408	HDOYEKOCDLGXKV-UHFFFAOYSA-N	426.466	1.802	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)[C@H]2CC(c3cccc(OC)c3)=NO2)c2ccccc2c1=O	791459293	WTXRDOXGBHLVET-LJQANCHMSA-N	449.467	1.769	50	20	IDGD	
CCOC(=O)NNC(=O)C(=O)Nc1cc(OC)c(Br)cc1Br	792266346	QECLARZNFKANPH-UHFFFAOYSA-N	439.060	1.936	50	20	IDGD	
COC(=O)c1nn(C)c(C)c1/C=C(/C#N)C(=O)Nc1c(C)n(C)n(-c2ccccc2)c1=O	792866988	RNGQKHNQQIUCES-PTNGSMBKSA-N	434.456	1.859	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C[C@@H]1COCCN1C(=O)OC(C)(C)C	794787444	ILTAFUSWEASIFX-DZGCQCFKSA-N	425.457	1.766	50	20	IDGD	
O=C(CNS(=O)(=O)c1c[nH]c2ncccc12)NNc1nc(-c2ccc(Cl)cc2)no1	796401597	ISPBMYYOGGCMIK-UHFFFAOYSA-N	447.864	1.688	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2ccc(F)c(N3CCOC3=O)c2)n1	797104762	SFTCFHFKYGQTGO-UHFFFAOYSA-N	431.428	1.500	50	20	IDGD	
O=C(NC[C@@H]1CCCN1C1CCCCC1)NNC(=O)C1CCN(c2ncccn2)CC1	798064322	WDJUSSJIUOFXIU-IBGZPJMESA-N	429.569	1.821	50	20	IDGD	
Cc1cc(CNC(=O)NN[C@]2(C)CCS(=O)(=O)C2)ccc1I	798476877	BSYJIPFZVOWQLB-CQSZACIVSA-N	437.303	1.481	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@H]2C(=O)NNC(=S)Nc2ccc(OC)nc2)cc1	799290031	WTBXSXDQPSSNSN-INIZCTEOSA-N	429.502	1.721	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)NCCNS(=O)(=O)c2ccc(F)cc2F)c1	799672823	HPQQLSMWBFSBSA-UHFFFAOYSA-N	428.417	1.356	50	20	IDGD	
O=C(/C=C/c1ccccc1)NCCCNC(=O)NNC(=O)CNC(=O)c1cccs1	799911411	DGKASLWCWVIDQG-MDZDMXLPSA-N	429.502	1.028	50	20	IDGD	
Cc1nn(C)c(Br)c1C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	800796649	DDJZTGNGRJUBMR-UHFFFAOYSA-N	449.353	1.464	50	20	IDGD	
C[C@H](CNC(=O)OC(C)(C)C)C(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	803103339	XBZXMFPIVMSOMV-CQSZACIVSA-N	443.545	1.783	50	20	IDGD	
COc1ccc(S(=O)(=O)NCCC(=O)NNc2ccc3c(=O)[nH]ccc3c2)cc1OC	803427247	LAZMDEWSCFLQSP-UHFFFAOYSA-N	446.485	1.357	50	20	IDGD	
N#Cc1ccc(N2CCC(C(=O)OCC(=O)NNC(=O)c3cccs3)CC2)c(F)c1	803868125	QXXGGYPMOZQAFQ-UHFFFAOYSA-N	430.461	1.980	50	20	IDGD	
O=C(NNC(=O)c1ccc2oc(O)nc2c1)c1ccc(S(=O)(=O)N2CCCC2)cc1	805151456	RXSIMFDWBAGNKW-UHFFFAOYSA-N	430.442	1.393	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1[nH]nnc1-c1ccccc1	805553148	JABVWZMHCZRVIT-UHFFFAOYSA-N	429.820	1.752	50	20	IDGD	
O=C1COc2c(cc(Cl)cc2NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCC3)N1	806974330	FHSYGXXQSKDWCD-UHFFFAOYSA-N	434.861	1.621	50	20	IDGD	
COC(=O)c1cc(Br)c(OC)cc1NC(=O)C(=O)NNc1ccc(C)nn1	807004111	HGFGOCODIITQNE-UHFFFAOYSA-N	438.238	1.425	50	20	IDGD	
O=C(NCc1ccc(C(=O)N2CCCCC2)cc1)NNC(=O)[C@H]1COc2ccccc2O1	807025668	XLFNDWGFCUANOK-HXUWFJFHSA-N	438.484	1.983	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NCCCn2cc(Br)cn2)cc1	807610752	IIJJJLKZGIOOSG-UHFFFAOYSA-N	426.271	1.454	50	20	IDGD	
O=C(NCc1ccncc1OC[C@@H]1CCOC1)NNC(=O)c1cnn(-c2ccccc2)c1	807616974	ZCQHGTJNGSLDAC-MRXNPFEDSA-N	436.472	1.827	50	20	IDGD	
Cc1c(/C=C(\C#N)C(=O)OCC(=O)NC(=O)Nc2ccc3c(c2)OCO3)cc(C#N)n1C	809303063	FZLIEURNEMUZAR-LHHJGKSTSA-N	435.396	1.732	50	20	IDGD	
Cc1cc(C)nc(SCc2ccc(C(=O)NNC(=O)[C@H](CO)NC(=O)C(C)C)cc2)n1	813402527	IEDZIQSUDUYPNK-KRWDZBQOSA-N	445.545	1.280	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2C(F)(F)F)c2ccccc2c1=O	814730028	IYDPDZAYNKZPNL-UHFFFAOYSA-N	435.318	1.935	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)nc2)cc1)[C@@H]1C[C@@H]1C	815567622	FUQQRZUNYVDCHD-MEDUHNTESA-N	429.864	1.896	50	20	IDGD	
Cc1cc(N2CCCC[C@@H]2C)ccc1NC(=O)C(=O)NNC(=O)[C@H]1CCc2nncn2C1	815692405	QGSPOAJKENFVMZ-HOTGVXAUSA-N	439.520	1.314	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNc2cccc(Cl)n2)cc1S(=O)(=O)N(C)C	815728287	XWDPWQJYMWQPHR-UHFFFAOYSA-N	441.897	1.466	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1ccc(N2CCCC2)nc1	815751479	AXJUKUPLGZZFML-UHFFFAOYSA-N	432.506	1.014	50	20	IDGD	
O=C(COC(=O)c1ccc(N2CCCC2=O)cc1)NNC(=O)c1cccc([N+](=O)[O-])c1	839563224	IXBPXYMHOLIMSA-UHFFFAOYSA-N	426.385	1.340	50	20	IDGD	
CCCCOc1ccc(C(=O)NNS(=O)(=O)c2n[nH]cc2C(=O)OC)cc1OC	912522923	YLLSBFGFFDEUKC-UHFFFAOYSA-N	426.451	1.007	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc2c(c1)OCCCO2)NNC(=O)c1ccc(Cl)cc1	913108756	LDUYKXIFVSVOJD-UHFFFAOYSA-N	439.877	1.241	50	20	IDGD	
Cc1ccc(OCCC(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1C	913395246	ALQJIRJCEDWYRK-LJQANCHMSA-N	428.441	1.603	50	20	IDGD	
COc1cc2cc(C(=O)NNC(=O)c3nnc(O)c4ccccc34)[nH]c2c(OC)c1OC	914781831	RIJOJUXECDANRI-UHFFFAOYSA-N	437.412	1.917	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)[C@H]1CCCN1C(=O)C(C)(C)C	915014108	IQGFCZZMGXRSRS-CQSZACIVSA-N	439.896	1.690	50	20	IDGD	
Cc1c(C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cnn1Cc1ccccc1	915538254	DWUGDILWEZAPQQ-UHFFFAOYSA-N	437.412	1.766	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)COc2ccc(Br)cc2C=O)cc1	915590069	PGXRIOIMULYHOD-UHFFFAOYSA-N	449.257	1.953	50	20	IDGD	
CCCCS(=O)(=O)N1CCC[C@H]1C(=O)NNC(=O)COc1ccccc1OCC	916032981	LKCOVZAMJNZJTJ-HNNXBMFYSA-N	427.523	1.206	50	20	IDGD	
CCc1ncncc1C(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	916105358	FRZCIQFNEXVDNY-UHFFFAOYSA-N	439.497	1.592	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCc2ccc(C(=O)N(C)C)cc2)nc1	916250802	WXICSNLMWWYCNB-UHFFFAOYSA-N	448.549	1.640	50	20	IDGD	
CCCOc1ccc(CNC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1OC	916393978	RUHDKXWRJRXIER-UHFFFAOYSA-N	439.472	1.875	50	20	IDGD	
CCN(CC)C(=O)CCCNC(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12	916577505	GEKJPOJHXKZQSL-UHFFFAOYSA-N	430.509	1.570	50	20	IDGD	
Cn1ncc2c1CCC[C@@H]2NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	916604498	IRVQPGTYPIFLIV-KRWDZBQOSA-N	446.533	1.226	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCC(CC(=O)N3CCCC3)CC2)cc1OC	917119946	MAKGACYOKPABRD-UHFFFAOYSA-N	432.521	1.189	50	20	IDGD	
O=C(COC(=O)Cn1c(=O)oc2cc([N+](=O)[O-])ccc21)NNC(=O)c1cccc(Cl)c1	917241059	MWZOLEXXQVCCQP-UHFFFAOYSA-N	448.775	1.161	50	20	IDGD	
CN(C)[C@@H](CNC(=O)NNC(=O)c1nn(-c2ccccc2)cc1O)c1ccc(F)cc1	918091341	RXNIHOVSGHHRJM-KRWDZBQOSA-N	426.452	1.964	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCCOc2ccccc2C)cc1	918128685	LUJANDKMVNSYRC-UHFFFAOYSA-N	434.518	1.333	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)NCc2cccc(OCC(=O)N(C)C)c2)c1	918224696	YTBQADJGEBPZCT-UHFFFAOYSA-N	428.489	1.680	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)c2nc3ncc(Br)cn3n2)cc1	919806538	CZZJKEURYCKNBU-JTQLQIEISA-N	449.265	1.514	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)[C@H]2CS[C@@H](Cc3ccccc3F)C(=O)N2)cc1	920212646	FRSXQOLFAXJPBL-MOPGFXCFSA-N	445.516	1.757	50	20	IDGD	
C[C@H]1CCCC[C@H]1CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	920241854	HAUMFFZBCRIEAL-RDJZCZTQSA-N	438.550	1.478	50	20	IDGD	
Cc1nc(O)cc(-c2ccc(NC(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)cc2)n1	920837050	SHGPRFHQLSZANB-UHFFFAOYSA-N	445.439	1.871	50	20	IDGD	
O=C(NCc1cccc(OCCN2CCOCC2)c1)NNC(=O)c1cccc([N+](=O)[O-])c1	920919850	CHWWVHNYJFYPDD-UHFFFAOYSA-N	443.460	1.450	50	20	IDGD	
CS(=O)(=O)NC1(CNC(=O)NNC(=O)c2cncn2-c2ccccc2)CCCCC1	1115855048	XHRRUGNGLBYCGO-UHFFFAOYSA-N	434.522	1.068	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCN(C(=O)OCc3ccccc3)CC2)cc1	1116186371	VROMHXYRGCHRIN-UHFFFAOYSA-N	426.473	1.411	50	20	IDGD	
CC(=O)N1CCN(c2ccc(C(=O)NNC(=O)c3ccccc3Cl)cc2[N+](=O)[O-])CC1	1317712080	IUSGBPPKWVUHIT-UHFFFAOYSA-N	445.863	1.992	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCc2ccc(S(=O)(=O)N3CCCC3)cc2)cc1	1317894592	OHRYFRHDSXLQIC-UHFFFAOYSA-N	432.502	1.624	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1)c1nnc2ccccn12	1318668230	GCVJAGHXBVQRGN-CYBMUJFWSA-N	431.497	1.768	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3ncoc3[C@H]3CCCO3)CC2)cc1	1319401567	QJAHBDYBSUIGSU-GOSISDBHSA-N	427.505	1.413	50	20	IDGD	
Cc1c(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cnn1C1CCCC1	1319625643	MFILJSZDBROXEQ-UHFFFAOYSA-N	438.532	1.526	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)c1ccc(OCC2CC2)nc1	1325860077	DOJMQXDHWOZEQH-UHFFFAOYSA-N	444.513	1.730	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2cccc(Cl)c2F)c1	1330236945	OVUPBXGZSVYPFU-UHFFFAOYSA-N	428.873	1.874	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccc(NC(=O)NNc3nccnc3C3CCC3)c2)CC1	1346314608	LEGRIIZTZWGBCV-UHFFFAOYSA-N	445.549	1.829	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H]1CC[C@H]3CCC(=O)N3C1)C2)[C@H](F)Cl	1778025206	NKZXGFNEGSTPOK-UTHDKSHUSA-N	429.920	1.436	50	20	IDGD	
O=C([C@@H]1Cc2ccccc2O1)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1778253239	SWFXHAWJVYWHJR-MPGHIAIKSA-N	427.270	1.511	50	20	IDGD	
O=C(c1n[nH]c2ccccc12)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1778520740	XPPNBZGKICTISJ-PBHICJAKSA-N	425.258	1.697	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc4cccnn4n3)C2)C1	1779961357	ARJQVLBUBPSSFU-RDTXWAMCSA-N	436.310	1.346	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1ncccn1)C2)[C@@H](F)Br	1780771000	OVIVSRXPMJITBS-SRCQZFHVSA-N	429.290	1.224	50	20	IDGD	
COC(=O)[C@H]1CC[C@H](C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](F)Br)C3)C2)CC1	1781326983	VWBFCCAGBSBAGT-NUXNZHGMSA-N	449.317	1.486	50	20	IDGD	
CSCC[C@H](O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCBr)C2	1782227358	HCCYBJNMMOVOHH-JJRVBVJISA-N	437.400	1.399	50	20	IDGD	
CC/C=C(\C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2	1782835114	JCHWMHXGCLWJNF-JNPFCBEJSA-N	443.548	1.991	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(N(C)C)cn3)CCO2)C1	1783532298	LROHLLPWDAXCQM-ACJLOTCBSA-N	425.327	1.375	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](N)c1cccc(Cl)c1)CCO2	1783533405	UPGVIWSIEZJTIH-XLWVJDPXSA-N	444.757	1.953	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccnc4c3OCO4)CCO2)C1	1783537996	RVSBPVKNZYVTJN-APPDUMDISA-N	426.267	1.037	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)/C=C/c3cc(F)cc(OC)c3)C2)C1	1783695146	SJSBSHVWTMWPLE-BSDDYQGESA-N	440.899	1.931	50	20	IDGD	
C[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1783704916	KEKHFRKATMXJCG-JLTOFOAXSA-N	431.961	1.995	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)CCc3ccc(F)c(F)c3)CCO2)C1	1783869211	OLHPKADFMZYOJG-MGPUTAFESA-N	430.879	1.981	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(OC)c(C)c(OC)c3)CCO2)C1	1783884107	PSSFGYCUZLQCHX-IERDGZPVSA-N	440.924	1.710	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1CCC[C@H]3CCCC[C@H]31)CCO2	1783934526	IQFWXNKTAGSYSZ-FIXDAVPBSA-N	448.608	1.796	50	20	IDGD	
COc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Br)C[C@@H]32)cn1	1784763350	CLSCIIVBDDTNBX-ABHRYQDASA-N	430.274	1.374	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc([N+](=O)[O-])c(OC)c3)C2)C1	1785182543	ILDFJBSVQHYLCI-AUUYWEPGSA-N	441.868	1.301	50	20	IDGD	
CCOc1cnc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]32)cn1	1785609537	ZPLVQLKFJXFJOT-VODUFIJXSA-N	445.347	1.705	50	20	IDGD	
CN(C)c1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCBr)C[C@@H]32)nc1	1785748066	ODRKDLJXFGUULT-QRTARXTBSA-N	439.354	1.526	50	20	IDGD	
COCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](Br)Cc3ccccc3)C[C@@H]21	1786496233	DMVXNAZWRBSTNU-FJIDUMEYSA-N	439.350	1.619	50	20	IDGD	
O=C(Cn1cc(Cl)cn1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21	1787003357	NXEFGRWQWGXOSG-QVSJOPQTSA-N	437.697	1.207	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(CC(C)C)nn3C)[C@H]2C1	1787213494	ZJWJHMKNZQQKMX-RMRDIRSESA-N	440.972	1.466	50	20	IDGD	
CC(=O)N[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]2C1)C(C)(C)C	1788762139	MPIUYWVGFJDZOT-LSTDLKDCSA-N	441.645	1.368	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3nnc(C)s3)C[C@@H]21	1790960834	ASZOLGPRBIJINV-FQUUOJAGSA-N	445.383	1.542	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nsnc3NC)C[C@@H]21	1790962360	VZDQICYYERHBTM-BJDJZHNGSA-N	446.371	1.347	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CC(=O)OC(C)(C)C)C[C@@H]21	1791055212	OMBBBUMAPAYTOM-XUXIUFHCSA-N	433.343	1.481	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3cc(F)ccn3)C[C@@H]21	1791057803	XNTFUBZSYNLGHP-PYTWLRIVSA-N	442.329	1.916	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(-c4cccnc4)[nH]n3)C[C@@H]21	1791255415	QOUVRQIDKJPZKA-GGXPGOJBSA-N	447.923	1.319	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCCCn3cccc3)C[C@@H]21	1791291224	QCCSEZBGBQCKIJ-UFYCRDLUSA-N	447.580	1.011	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]3C2)nn1C(F)F	1791296294	BHGKREVHZGCLBF-NHCYSSNCSA-N	425.263	1.984	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1ccc(C2(NC(=O)c3cc(O)ncn3)CCC2)cc1	1791600008	UTICVNMFVJOHHT-UHFFFAOYSA-N	426.477	1.303	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(Cl)nc1F	1794538957	CZYBYOPXBQMSGQ-CLLJXQQHSA-N	425.892	1.499	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1[nH]nc2ccncc12	1796214574	YXHMADHFSYHMID-NDPMZMCLSA-N	436.310	1.335	50	20	IDGD	
CCOc1c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Cl)cnc2c1cnn2C	1796363353	PBTWHQLVIPUKQM-YHYOWMERSA-N	439.875	1.105	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1CC3(CCC3)C1)C2	1796446287	RDZLEZSQGQWGQO-GJPBQQDYSA-N	441.532	1.290	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ncn(C(C)C)n1	1796635518	ZYCNTTNBDAAVSD-XJFOESAGSA-N	428.331	1.236	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CC12CCCN1CCC2	1799213981	YCHFUCQBDLKNMA-PNBKFKSVSA-N	428.371	1.378	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](NC(C)=O)c1ccc(F)cc1	1799820470	DGSIDIBLQKXQKN-ZRSRNVLSSA-N	439.915	1.895	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1CCC2(CC1)OCCO2	1800381913	JNWFZRSBXYYNKS-DMRZNYOFSA-N	445.354	1.293	50	20	IDGD	
CCC[C@@H](NC(C)=O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](Br)CC	1800645201	VSPNBSIINNMJNI-NPJQDHAYSA-N	432.359	1.054	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CC[C@@H]1CNc3ccccc3C1)C2	1800975831	VEIRSBHRYIXOHA-GASSVWHLSA-N	449.979	1.894	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(OC)cc(OC)c1)C2	1800979026	OJLPIHCJKFXWHY-DACLVMHWSA-N	426.897	1.161	50	20	IDGD	
CO[C@H](C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](Br)Cc1ccccc1)C2	1801043435	RIBNUOVUUHLBRF-FWEDZOCSSA-N	439.350	1.617	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)COc1ccc(O)nn1	1801269901	UFTWKKGGVZIRBQ-YVECIDJPSA-N	427.299	1.373	50	20	IDGD	
CC(C)(CCl)C(=O)NC[C@@H]1CCN(C(=O)CN2C(=O)C=CC2=O)[C@@H]1c1cccnc1	1802902502	OVVPLAVBJXUTKJ-HNAYVOBHSA-N	432.908	1.277	50	20	IDGD	
Cc1cnc2c(C(=O)N3CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]3c3cccnc3)cnn2c1	1803142986	QDDQRPPKSRNUGL-NJAFHUGGSA-N	442.907	1.352	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)CCN2C(=O)C=CC2=O)[C@@H]1c1cccnc1	1803686198	LGZJXUSZAZZEBA-LLGFUMIMSA-N	446.935	1.810	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1CC(=O)C1	1804161274	PVKXXZXHYMJHAY-QDMKHBRRSA-N	429.429	1.751	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)CCc2ccco2)[C@@H]1c1cccnc1	1804590974	JGXDSEPDYFGPPJ-JPYJTQIMSA-N	441.532	1.686	50	20	IDGD	
C[C@]1(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)CC1(F)F	1807368223	QOZALESFYCOMTE-HGHGUNKESA-N	443.259	1.126	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)s1	1807369456	KKTFYTHAGNMIJJ-RXVVDRJESA-N	449.341	1.765	50	20	IDGD	
Cn1ncc2cc(C(=O)NC[C@@H]3CCN(C(=O)[C@H](O)CCl)[C@@H]3c3cccnc3)ccc21	1809419065	DYDUOBLVCLBQAE-PWIZWCRZSA-N	441.919	1.888	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC2(CCCN(C(=O)CCN3CCN(C)CC3)C2)CC1	1809554978	UWHKKNGZRUOZPD-SFHVURJKSA-N	429.005	1.109	50	20	IDGD	
O=C(/C=C\C(=O)NC1CC1)NC[C@@H]1CCN(C(=O)C(Cl)Cl)[C@@H]1c1cccnc1	1810133699	KKAUFWXMLOTXTN-MZVVEVKISA-N	425.316	1.726	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2[nH]nc3ccncc23)[C@@H]1c1cccnc1	1813031155	OVXMERWMGMLXPY-SIXWZSSISA-N	442.907	1.926	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2ccc(F)cn2)[C@@H]1c1cccnc1	1813070027	DGACRPZHXXRNNG-IIBYNOLFSA-N	442.495	1.308	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)c1ccc(CO)c(F)c1	1813990302	GNNILVWIIBZZIM-IPELMVKDSA-N	435.883	1.632	50	20	IDGD	
O=C(NCCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](O)CCl)n[nH]1)c1ccc[nH]1	1814866988	BTBZXYOLPGOZJS-CABCVRRESA-N	436.900	1.150	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)/C=N/O[C@@H]2CCCCO2)[nH]n1)[C@@H](O)CCl	1814872703	KAVKKAWMROTBOP-FOLUXADTSA-N	427.889	1.531	50	20	IDGD	
CN[C@H](CC(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](C)CBr)CC2)C(=O)O	1815073852	YCOFHKACXONGCG-FXPVBKGRSA-N	447.355	1.149	50	20	IDGD	
CC(C)CNC(=O)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](F)Br)[nH]n1	1818134699	KNBGAEKTVQIPSU-DGCLKSJQSA-N	432.294	1.865	50	20	IDGD	
Cc1ccoc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1818170945	ZGQJPVWSNPIKLI-MRXNPFEDSA-N	437.460	1.929	50	20	IDGD	
Cc1cc(C)n2ncc(C(=O)Nc3cc([C@@H]4CCCCN4C(=O)[C@H](O)CCl)[nH]n3)c2n1	1818584311	SFROKDSNAYHYPU-JKSUJKDBSA-N	445.911	1.975	50	20	IDGD	
CC[C@@H](NC(N)=O)C(=O)N[C@H]1CCc2nc(NC(=O)CO[Si](C)(C)C)sc2C1	1820165079	SSDFVLQHWSNWKL-WDEREUQCSA-N	427.603	1.354	50	20	IDGD	
COC[C@H](NC(C)=O)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](F)Br)n[nH]1	1820935343	KQQQPYYAHRLAQT-SCRDCRAPSA-N	448.293	1.243	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)C2CC(F)(F)C2)[nH]n1	1822411936	DUDQPYKJEZQFBH-CQSZACIVSA-N	426.468	1.820	50	20	IDGD	
Cc1nccn1CC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](F)Br)CC2	1824710164	VNEMFAZIEGLBTA-TVQRCGJNSA-N	430.303	1.951	50	20	IDGD	
CCS(=O)(=O)CC(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](C)Br)sc2C1	1825635394	FBZFYSKMJNMACC-DTWKUNHWSA-N	438.369	1.273	50	20	IDGD	
C=CCOCCCC(=O)N[C@@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1	1826083702	PTEHUUPOLIBCIX-CQSZACIVSA-N	437.566	1.411	50	20	IDGD	
O=C([C@@H]1CCCOC1)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827060081	OVONOLHUZXAFSF-CTNGQTDRSA-N	428.338	1.026	50	20	IDGD	
CCNC(=S)NCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)CO[Si](C)(C)C)CC1	1831091829	NRFWCFAMBURKRX-QGZVFWFLSA-N	442.702	1.942	50	20	IDGD	
O=C(Cc1cc([N+](=O)[O-])ccc1F)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1832430256	ZRHNIORVBRLXHJ-WMZOPIPTSA-N	447.822	1.267	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3nnc(C)s3)CCO2)C1	1833020876	QNIWHSCXMFQBLP-KDOFPFPSSA-N	430.958	1.253	50	20	IDGD	
CC1(C(=O)NC2CCN(C3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)CCC1	1833054310	ZLQAMCUENZTNDT-UHFFFAOYSA-N	442.564	1.061	50	20	IDGD	
CC(C)(C)c1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)ccn1	1833367806	GTJPYHDDWQGECG-IIBYNOLFSA-N	439.940	1.049	50	20	IDGD	
CCc1nn(C)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)c1Cl	1833593557	SOYOLOWPMVTZDO-YOEHRIQHSA-N	437.299	1.240	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)C(Cl)Cl)CC2)CC1)c1cccc(=O)n1O	1833963548	MVASJMCEMPLQAX-UHFFFAOYSA-N	431.320	1.075	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](F)Cl)CC2)CC1)c1cncn1-c1ccncc1	1834013554	DDBZNJSUFZFKSF-LJQANCHMSA-N	448.930	1.987	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3cscn3)CCO2)C1	1834252507	GXYYGRHBHMVWQI-BLLLJJGKSA-N	432.340	1.244	50	20	IDGD	
O=C(CCBr)NC1CCN(C2CCN(C(=O)Cc3cncnc3)CC2)CC1	1834422463	NQOMQXOVDNPFGI-UHFFFAOYSA-N	438.370	1.376	50	20	IDGD	
CC(C)(C)NCC(=O)NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1	1834697609	MDDSLRPSGXJAOM-UHFFFAOYSA-N	431.419	1.731	50	20	IDGD	
O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)CC1CCOCC1)CCO2	1835418325	GKHQAUKOGICDQX-GOSISDBHSA-N	433.343	1.045	50	20	IDGD	
Cc1ncccc1CCC(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836714904	BXQZKRUXVBZVFK-HXUWFJFHSA-N	437.968	1.921	50	20	IDGD	
CC(C)n1nccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1	1838021507	DLNRGDXFOSBGJT-HXUWFJFHSA-N	438.601	1.386	50	20	IDGD	
CCCc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](Cl)COC)C3)C2)cc1	1839016772	ZHZFTQAKRPRFMF-UGKGYDQZSA-N	438.952	1.963	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cncc(O)c3)C2)C1	1839155632	ZOTMKMSVFUYHFV-QZTJIDSGSA-N	432.304	1.094	50	20	IDGD	
O=C(/C=C/c1ccsc1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839198402	ZFFFBUYFCBBCCV-XGERFZHZSA-N	447.326	1.908	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)c(F)c1	1839260812	HJXHVJSRUOJWGX-IFXJQAMLSA-N	443.313	1.988	50	20	IDGD	
Cc1cc(C)n2ccc(C(=O)N3CCO[C@]4(COCCN(C(=O)[C@H](F)Cl)C4)C3)c2n1	1839626784	UTLGXTBOAHEJHQ-OXJNMPFZSA-N	438.887	1.556	50	20	IDGD	
C[C@H](Oc1ccccc1)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1839952025	IEPLCTNFSHKPJX-LIRRHRJNSA-N	431.316	1.714	50	20	IDGD	
Cc1ccccc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)Br)CCO2	1840034274	GQPKAOCLWBUEHJ-KXBFYZLASA-N	425.323	1.848	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4ccccc4n3C)C2)C1	1840152748	RVIIRPWNNAJSIU-VGSWGCGISA-N	449.935	1.502	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(F)c(C)cc3F)C2)C1	1840155936	GLXAECBYNPHVPS-QRWLVFNGSA-N	446.878	1.597	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3ccoc3)CCO2)C1	1840512562	DEASECYRXPYITI-KXBFYZLASA-N	443.338	1.700	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(OC)ccc3F)CCO2)C1	1840686682	ZOJJNBQUXLRTNP-UZLBHIALSA-N	428.888	1.922	50	20	IDGD	
O=C(Cc1cc(F)ccc1F)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1840811966	SKQMAYXXJXBESP-SFHVURJKSA-N	437.270	1.767	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)Cc1ccn(C)n1)C2	1844692305	JLYBLEZOXIYCDE-UHFFFAOYSA-N	441.444	1.313	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)CCCn2c(O)nc3ccccc32)C1	1845013443	WRPOKQNGTZJXLV-OAHLLOKOSA-N	434.924	1.979	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@H]1COCCN1C(=O)OC(C)(C)C)C2	1845163153	IOMVLVJHUUACAK-LSDHHAIUSA-N	429.945	1.843	50	20	IDGD	
CCOC(=O)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)[C@H](Cl)CC)C1	1845168726	WIMMCCFQBPCVQH-ZIAGYGMSSA-N	445.944	1.664	50	20	IDGD	
Cn1c(=O)c(C(=O)N2CC3(CCCN3C(=O)[C@@](C)(Cl)CCl)C2)nc2ccccc21	1845170625	FFCFTGWSAXGGSW-IBGZPJMESA-N	437.327	1.987	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2cccc3nscc23)C1	1845667422	FPMFKZTXHKAGOF-UHFFFAOYSA-N	436.497	1.426	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CCCC(=O)Nc1ccccc1	1847539965	AJBUCPZFMMDPIN-OALUTQOASA-N	443.548	1.370	50	20	IDGD	
Cn1c(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](O)CCl)cc2c1-c1ncccc1OC2	1847559003	GXAYLYXVYIBBPI-DZKIICNBSA-N	430.892	1.395	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CC(=O)N(c2ccccc2Cl)C1)c1csc(N2CCOCC2)n1	12802307	BFTDHHOPBNCCHR-GFCCVEGCSA-N	449.920	1.447	50	20	IDGD	
O=C(COC(=O)C1CCN(C(=O)/C=C/c2ccccc2)CC1)NNC(=O)c1ccccc1	24199321	VKBVODGXCXFQKG-VAWYXSNFSA-N	435.480	1.943	50	20	IDGD	
CC[C@H](CNC(=O)NNC(=O)CNC(=O)c1cccs1)N1CCc2ccccc2C1	725873832	RBALMNIIRYVAPG-QGZVFWFLSA-N	429.546	1.645	50	20	IDGD	
Cc1ccc(C(=O)NNc2nc(-c3cccnc3)no2)cc1S(=O)(=O)N1CCOCC1	728078635	NRTRZTDLQKJSRP-UHFFFAOYSA-N	444.473	1.218	50	20	IDGD	
Cc1c(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)cnn1C(C)(C)C	728216079	PSGPTUPGKDVPJH-UHFFFAOYSA-N	434.566	1.640	50	20	IDGD	
O=C(COC(=O)[C@@H](c1ccccc1)n1cccn1)NNC(=O)[C@H]1COc2ccccc2O1	728332726	NPFVBLNYWNGKQA-UYAOXDASSA-N	436.424	1.003	50	20	IDGD	
O=C(NNC(=O)c1nc2ncc(Br)cn2n1)c1cccc(OC(F)F)c1	728485512	ARYJPACCVPOCTM-UHFFFAOYSA-N	427.165	1.563	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)CS[C@H]2CCS(=O)(=O)C2)c1	728528571	GIPWLSKBHKEGNW-JTQLQIEISA-N	437.337	1.139	50	20	IDGD	
O=C(NNC(=O)[C@@]12CCC(=O)N1c1ccccc1S2)C1CCN(c2ncccn2)CC1	728847399	DDEGDEMZSZYLSN-NRFANRHFSA-N	438.513	1.469	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)NNC(=O)COc2ccc(Br)cc2)c1	728954587	JYVKZUTWFULVOL-UHFFFAOYSA-N	432.234	1.375	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)N1CCC[C@@H](CN2CCN(c3ccccn3)CC2)C1	728958145	UDINFECUFNANFZ-FQEVSTJZSA-N	437.548	1.294	50	20	IDGD	
CNS(=O)(=O)c1ccc(CCC(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)cc1	728974201	GZEFAWJVFSYPOH-UHFFFAOYSA-N	447.485	1.667	50	20	IDGD	
CC(C)[C@H]1CCC[C@H](NC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)C1	729058855	QZAGGBQETVURGS-IRXDYDNUSA-N	438.598	1.859	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)C1CCN(S(=O)(=O)c2cccnc2)CC1	729450723	NFNSZTAXCKTRMU-UHFFFAOYSA-N	441.513	1.285	50	20	IDGD	
O=C(CCNS(=O)(=O)c1cccc(Cl)c1)NNC(=O)CCc1ccccc1O	730034074	QIEUXQHSOVKECH-UHFFFAOYSA-N	425.894	1.494	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)N[C@H](C)c2nnc3n2CCC3)c2ccccc2c1=O	730934244	GOGCGLDVGBTAHF-CYBMUJFWSA-N	438.492	1.440	50	20	IDGD	
C[C@H]1CCC[C@@H](NC(=O)CN2CCN(CC(=O)NNC(=O)c3cccc(Cl)c3)CC2)C1	731214310	CLNWYFDEGAWYEE-QFBILLFUSA-N	449.983	1.414	50	20	IDGD	
O=C(NC[C@H]1CCCN1CC1CCCCC1)NNC(=O)c1ccc(-n2cnnn2)cc1	731497022	RRAZMHQRULONAW-LJQANCHMSA-N	426.525	1.651	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)NCCCCN1CCN(c2ncccn2)CC1	731502575	MIXHGFYAYSJZIS-UHFFFAOYSA-N	427.509	1.032	50	20	IDGD	
O=C(NNc1nc(-c2cccnc2)no1)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1	732110721	LITQJWSBIVPZIL-NSHDSACASA-N	429.418	1.849	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2occc2CS(=O)(=O)c2ccccc2)C[C@@H](C)O1	732259464	DYNKTSBEXLMONN-IYBDPMFKSA-N	449.529	1.514	50	20	IDGD	
Cc1occc1C(=O)Nc1nc(CC(=O)NNC(=O)CCN2C[C@H](C)O[C@@H](C)C2)cs1	732261218	BMCKNLAXPOVHEX-STQMWFEESA-N	449.533	1.486	50	20	IDGD	
CN1C(=O)C[C@@H](C(=O)OCC(=O)NNC(=O)c2cccs2)[C@@H]1c1cccc(Cl)c1	734636050	LOTRGXVMVAATSB-DYVFJYSZSA-N	435.889	1.925	50	20	IDGD	
COCCOc1ccc(-n2nc(C)c(C(=O)NNC(=O)COc3ccc(C)cc3)n2)cc1	735029101	SVJBIGKZMLTJKE-UHFFFAOYSA-N	439.472	1.749	50	20	IDGD	
C[C@@H](C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1)n1cnc2ccccc21	735116803	GOTBIEQKQVGSNL-HNNXBMFYSA-N	443.533	1.072	50	20	IDGD	
COCCNS(=O)(=O)c1cccc(CNC(=O)NNC(=O)C(C)(C)c2ccccc2)c1	735513402	ONMHREBOHWPSHU-UHFFFAOYSA-N	448.545	1.420	50	20	IDGD	
O=C(NNc1ccc(OC(F)F)cc1)NC1CCN(S(=O)(=O)C2CCOCC2)CC1	737057990	OTPRDHZWDHWZAV-UHFFFAOYSA-N	448.492	1.887	50	20	IDGD	
N#Cc1cccc(C(=O)NNS(=O)(=O)c2cccc(I)c2)c1	739668138	JEVKMUCDNOLCSI-UHFFFAOYSA-N	427.223	1.786	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](C(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1)c1cccc(Cl)c1	740815045	IABQZOWRJLTBQH-GXTWGEPZSA-N	445.925	1.488	50	20	IDGD	
COC(=O)c1ccc(S(=O)(=O)NNC(=O)C(F)(F)Oc2ccccc2)c([N+](=O)[O-])c1	741650865	BOHQMVMDTNRMJS-UHFFFAOYSA-N	445.356	1.363	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNS(=O)(=O)c2ccc(N(C)C(C)=O)cc2)cc1	742026175	NBKXUVURSDVFOE-CQSZACIVSA-N	435.502	1.845	50	20	IDGD	
CCOc1ccc(OCc2ccc(C(=O)NNC(=O)C(C)(C)NS(C)(=O)=O)cc2)cc1	742033273	MCZPWJQBPMRMAB-UHFFFAOYSA-N	449.529	1.753	50	20	IDGD	
O=C(NNC(=O)c1c[nH]cc1-c1ccc2c(c1)OCCO2)c1ccc(-n2cnnn2)cc1	742035730	XLOCOLGJNAYWLZ-UHFFFAOYSA-N	431.412	1.503	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)c1	743813018	KIIJVIGSGQMOEE-UHFFFAOYSA-N	436.446	1.406	50	20	IDGD	
COc1cc(C(=O)N2CCN(CC(=O)NNC(=O)c3ccc(C#N)cc3)CC2)ccc1C	744386911	NVJMNQQMLDYSAW-UHFFFAOYSA-N	435.484	1.094	50	20	IDGD	
N#CCCn1cc(/C=C(/C#N)C(=O)N2CCC[C@H](S(N)(=O)=O)C2)c(-c2ccccc2)n1	744530332	HLFCGCLVVBAXAH-GTVARFKMSA-N	438.513	1.650	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)c2ccc(F)c(S(=O)(=O)N(C)C)c2)c1	744811848	WJCSDNKDUYKRAS-UHFFFAOYSA-N	437.449	1.002	50	20	IDGD	
COc1cc(CNC(=O)NNC(=O)Nc2ccc(N(C)C)cc2)ccc1OCC(N)=O	745616487	KBVDMGXVZPKHFF-UHFFFAOYSA-N	430.465	1.161	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NCc2ccccc2N2CCOCC2)cc1	745786728	XSEPKFMKADOPCX-UHFFFAOYSA-N	447.517	1.463	50	20	IDGD	
Cc1cnc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)s1	745877121	HETIKGPIRZJIHD-UHFFFAOYSA-N	437.547	1.770	50	20	IDGD	
Cc1cc(=O)n(CC(=O)NC(C)C)c(C)c1C(=O)NN=c1sc2ccccc2n1C	746015822	SPNDQDUGCQFTNM-UHFFFAOYSA-N	427.530	1.789	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Cc2cccc([N+](=O)[O-])c2C)cc1	747719362	OICDYGQLQXEHIM-UHFFFAOYSA-N	434.474	1.222	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCCC(=O)NNC(=O)c2cc3ccccc3o2)cc1	749478911	ORLXLYCKLKRKQG-UHFFFAOYSA-N	431.470	1.961	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN[C@@](C)(C(N)=O)c1cccc(Cl)c1	750054198	ATXHRZIWJZCYEA-LJQANCHMSA-N	439.299	1.753	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2occc2Br)cc1OC	751698617	FAHMHIDTCZGJNQ-UHFFFAOYSA-N	427.207	1.677	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(=O)n(CC(=O)NNc2ccc(C#N)c(Cl)c2)c1	753301309	ZZXCKNWQVWQTSJ-UHFFFAOYSA-N	437.909	1.547	50	20	IDGD	
CC1CCN(S(=O)(=O)c2ccc(C(=O)NNc3cc(Cl)nc(N)n3)s2)CC1	753453673	HYQLJGVVFDSIMK-UHFFFAOYSA-N	430.943	1.951	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)c1cc(F)cc([N+](=O)[O-])c1Br	754994897	CQSQGQPPDSOCCH-UHFFFAOYSA-N	429.158	1.280	50	20	IDGD	
CCN(CC)C(=O)CCC(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	755041227	OXGCHXJYSJZDCV-UHFFFAOYSA-N	449.511	1.854	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)Nc1c(C)n(C)n(-c2ccccc2)c1=O	755320585	OCHONQPNTDENJI-UHFFFAOYSA-N	425.445	1.725	50	20	IDGD	
CCNC(=O)N1CCc2ccc(NC(=O)NNC(=O)[C@@H]3COc4ccccc4O3)cc21	756731064	WNAFMVMSHJFIIS-SFHVURJKSA-N	425.445	1.771	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)Nc2ccc(S(=O)(=O)NC3CC3)cc2)cc1	756777116	VAOTTXMIABVNGJ-UHFFFAOYSA-N	434.474	1.368	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)Nc2cnc3c(c2)C[C@H](NC(=O)OC(C)(C)C)CC3)n[nH]1	757927837	MBRUKRARUPJLIE-CYBMUJFWSA-N	429.481	1.962	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)c2ccc(Br)cc2-n2cncn2)cc1	758060357	YSODPYHVYFDCHT-UHFFFAOYSA-N	441.245	1.741	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)N[C@H]2CN(C(=O)OC(C)(C)C)C[C@H]2C#N)nc2ccccc21	758771005	MXJYINFNNGEXBX-HIFRSBDPSA-N	441.492	1.205	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)N2CC[C@H](NC(=O)NC3CC3)C2)N(C)c2ccccc21	761023958	IZCGAEBSMZMXGZ-INIZCTEOSA-N	436.516	1.720	50	20	IDGD	
N#C/C(=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)NCC1(CO)CC1	762688520	NKJZBTVABNMFQN-OQLLNIDSSA-N	427.892	1.875	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NN=Cc1ccc(OCCN2CCOCC2)c(Cl)c1	763198611	HAJHRFRXSMVMIG-UHFFFAOYSA-N	445.907	1.326	50	20	IDGD	
CN(C)CCOc1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2Br)cc1	763482848	LNVOOIQAAPIACD-UHFFFAOYSA-N	449.305	1.789	50	20	IDGD	
CC(=O)NNC(=O)C(=O)Nc1ccc(-c2sc(CC(N)=O)cc2Br)cc1	763517356	HZANCCIZBATRCI-UHFFFAOYSA-N	439.291	1.311	50	20	IDGD	
COc1ccccc1OC[C@@H](C)CNC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	763544146	MZZCTMXGFYCCFV-AWEZNQCLSA-N	435.502	1.758	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)C(=O)Nc2ccnc(C(=O)N(C)C)c2)c1	763596363	FRCRDWKEUZOSLD-UHFFFAOYSA-N	441.488	1.380	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccnn2-c2ccc(Cl)cc2)cc1	763658738	ATXAUGRRMYAOGJ-UHFFFAOYSA-N	443.847	1.699	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cnn(CC(C)C)c2C(C)C)cc1	763659341	MODJUGRLNXREJR-UHFFFAOYSA-N	431.493	1.836	50	20	IDGD	
COC(=O)c1c(NC(=O)C(=O)NNC(=O)COc2ccccc2F)sc2c1CCCC2	763683322	XXDTWPXGYVUNAU-UHFFFAOYSA-N	449.460	1.718	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(F)ccc1OC(F)F	763683889	CBNWSSLIRMPLSQ-UHFFFAOYSA-N	441.362	1.991	50	20	IDGD	
CCCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C)cc2)cc1	763813204	YWKAMNNNQYJBFN-UHFFFAOYSA-N	448.501	1.312	50	20	IDGD	
CC(C)C[C@H](NC(=O)c1ccc(Cl)cc1)C(=O)NNC(=O)CNC(=O)c1cccnc1	763825470	YIGIQHSFMMDBHF-KRWDZBQOSA-N	445.907	1.457	50	20	IDGD	
Cc1nnc(-c2cccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc3ccc(F)cc3)c2)o1	763864367	BXAYXVDQHGKTSX-NSHDSACASA-N	427.392	1.738	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1NC(=O)C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	763916686	JIXGLGFSEMHSSZ-UHFFFAOYSA-N	448.468	1.494	50	20	IDGD	
CCCOc1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	763921595	MFWWPTBPAFDDCS-UHFFFAOYSA-N	443.851	1.504	50	20	IDGD	
Cc1nc(CC(C)C)c(NC(=O)C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)s1	763943278	CGPLNKFXCSKWJJ-UHFFFAOYSA-N	442.501	1.941	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)Nc1cccc(-n2cccn2)c1	764001572	BATJAJIDGYDYGQ-UHFFFAOYSA-N	431.250	1.373	50	20	IDGD	
CCOc1cc(N2CCN(C)CC2)ccc1NC(=O)C(=O)NNC(=O)Cc1ccsc1	764033086	GBMSXPGKDPKSCD-UHFFFAOYSA-N	445.545	1.227	50	20	IDGD	
COC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2cccc(Br)c2)c1C	764059244	PULLDVQPAJVHHZ-UHFFFAOYSA-N	434.246	1.944	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2cccc(Br)c2)c1	764078372	RVBDJHBRPWBHIP-UHFFFAOYSA-N	440.275	1.252	50	20	IDGD	
COC(=O)c1cc(Cl)ccc1NC(=O)C(=O)NNC(=O)c1ccc(Cl)cc1O	764124511	JLVOSRIXIPMUEZ-UHFFFAOYSA-N	426.212	1.885	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2cccc(CC(=O)OC(C)(C)C)c2)c1O	764131454	GXFHYQNDRVHAKA-UHFFFAOYSA-N	443.456	1.685	50	20	IDGD	
CCCN1C(=O)CCc2cc(NC(=O)C(=O)NNC(=O)c3cccc(OC)c3O)ccc21	764132354	NKOAGSGTFMWYQH-UHFFFAOYSA-N	440.456	1.490	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)CCc2ccccc2)cc1Cl	764192904	QKGLVLVHDBYSGS-UHFFFAOYSA-N	433.848	1.611	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2c(Cl)cccc2Cl)ccc1-n1cnnn1	764220654	BWBYUAGCHGTWGZ-UHFFFAOYSA-N	434.243	1.677	50	20	IDGD	
Cc1nnnn1-c1cc(NC(=O)C(=O)NNC(=O)CCCc2ccccc2)ccc1F	764223551	IEXGEIMGHDTCPD-UHFFFAOYSA-N	425.424	1.219	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2scnc2C)ccc1Br	764246444	HYMOPKBNXYTNKM-UHFFFAOYSA-N	441.263	1.400	50	20	IDGD	
CCOc1cc(NC(=O)C(=O)NNC(=O)Cc2cccnc2)c([N+](=O)[O-])cc1OCC	764264886	ZHFAVFTYHJBDOX-UHFFFAOYSA-N	431.405	1.116	50	20	IDGD	
CC[C@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)CCc2ccccc2O)cc1	764281416	WQVYBOZIFGDNGK-AWEZNQCLSA-N	426.473	1.639	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)C(=O)N1C[C@@H]2CCCN2c2ccccc21	764352065	YYHPQILCJUVEDY-SFHVURJKSA-N	430.468	1.649	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3c(F)cccc3F)n[nH]2)cc1OC	764378782	OACSJNPXQCWMOV-UHFFFAOYSA-N	445.382	1.772	50	20	IDGD	
O=C(NNc1ccc(-n2cccn2)nn1)N[C@@H]1CCN(c2ccc(Cl)c(F)c2)C1=O	764510857	DUUMSYRLTRXTCQ-CQSZACIVSA-N	430.831	1.886	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)N[C@H]2CCN(c3ccc(Cl)c(F)c3)C2=O)cc1	764512329	MPNLYAUTDVRKLV-KRWDZBQOSA-N	445.838	1.865	50	20	IDGD	
CC(=NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C)[C@@H](C)c1nc2ccccc2s1	764817281	KOYKSPQUSWLPDI-LLVKDONJSA-N	439.501	1.339	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)NCc1cccc(N2CCCS2(=O)=O)c1	765193021	JCRJKTWHZXLSAX-UHFFFAOYSA-N	448.501	1.145	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)CCNC(=O)N1CCc2ccccc2C1	765311031	PDIAZFVKYZYONI-UHFFFAOYSA-N	447.536	1.597	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)[C@H]1CCCN(C(=O)N2CCCC2)C1	765319604	ZYDQYDHKDZQXBF-HNNXBMFYSA-N	425.530	1.367	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2cnc3c(c2)NC(=O)CS3)c2ccccc2c1=O	765469374	NKSGOTGLVSOSAS-UHFFFAOYSA-N	438.469	1.321	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C[C@H](NC(N)=O)c2ccccc2C)n[nH]1	765592750	QVXLAYIFLDTRAD-INIZCTEOSA-N	436.472	1.954	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ncc(F)cn2)c(I)c1	765699855	AIYGJLRSJMFCLB-UHFFFAOYSA-N	431.165	1.311	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1cnn(-c2ccccc2)c1	765734939	FVNVRYJDXFOKSI-UHFFFAOYSA-N	432.484	1.091	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)c1cccc2c1OCCO2	765759023	SLSZEOHPTHJVIM-UHFFFAOYSA-N	444.919	1.690	50	20	IDGD	
Cc1cc(N(C)C)cc(C)c1NC(=O)C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	766258370	FGNIBCKRCMJNSZ-UHFFFAOYSA-N	432.502	1.173	50	20	IDGD	
O=C(/C=C/c1cncc(F)c1)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	766662697	BQJMJKRERWEDHX-ZZXKWVIFSA-N	431.899	1.853	50	20	IDGD	
CC(C)(C)NC(=O)CN1CCN(C(=O)COC(=O)[C@H](Br)C(C)(C)C)CC1	766749400	LGNJGRDDCLXLOD-HNNXBMFYSA-N	434.375	1.398	50	20	IDGD	
CC(C)CCC(=O)NNC(=O)C(=O)Nc1ccccc1OCC(=O)Nc1cccnc1	768238909	HEJXHXRMXWQHCW-UHFFFAOYSA-N	427.461	1.621	50	20	IDGD	
Cc1[nH]nc(C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c1Br	768618544	JPMNHEVJJLCMBB-UHFFFAOYSA-N	426.183	1.007	50	20	IDGD	
C[C@@]1(c2cccc(C(=O)NNC(=O)c3cc(-c4ccc(F)cc4)[nH]n3)c2)NC(=O)NC1=O	769280293	MVVHOMANKJKYEM-NRFANRHFSA-N	436.403	1.345	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc(Br)c(Cl)cc1Cl)N1CCOCC1	769866675	WANVYFXDQBTMPU-UHFFFAOYSA-N	433.111	1.991	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)NCCNC(=O)Cc1cccc(F)c1	770449739	WILNJMWFXLKVEB-CYBMUJFWSA-N	436.871	1.936	50	20	IDGD	
CCOC(=O)[C@@]1(C(C)C)CCN(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)C1	770511719	AZOSGPBUMPBKOM-NRFANRHFSA-N	432.525	1.345	50	20	IDGD	
COc1nn(C)c2nc(C)c(CCC(=O)NNc3nc(O)c4cnn(C)c4n3)c(C)c12	770982068	DOACULDWWBALJM-UHFFFAOYSA-N	425.453	1.052	50	20	IDGD	
CC(C)(C)OC(=O)NNC(=O)CN1C(=O)N[C@@](C)(c2ccc(Br)cc2)C1=O	771211528	IODRISDNDQTWSU-KRWDZBQOSA-N	441.282	1.772	50	20	IDGD	
CC(C)(C)OC(=O)N1CCSC[C@@H]1CC(=O)NNC(=O)Cc1cn2ccccc2n1	772150464	NYTPYFAVPGZTKI-HNNXBMFYSA-N	433.534	1.767	50	20	IDGD	
C[C@@H]1CN(c2ccnc(C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)c2)C[C@@H](C)O1	772284071	PVZLMOXSBPFYRR-ZIAGYGMSSA-N	436.513	1.164	50	20	IDGD	
CC(C)(NC(=O)Nc1ccccc1)C(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772905853	QOILUWIMQXOEFP-UHFFFAOYSA-N	431.880	1.704	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)c1ccc(S(=O)(=O)N(C)C)cc1	772971241	YPKLPUBUQODMAZ-LBPRGKRZSA-N	425.894	1.819	50	20	IDGD	
Cc1ccc(-n2nc(C)cc2NC(=O)C(=O)NNC(=O)Cc2cccc3ccccc23)nn1	773500942	XXDAPMZEAWVJMR-UHFFFAOYSA-N	443.467	1.761	50	20	IDGD	
O=C(CN1CCCc2ccccc21)NNC(=O)C(=O)Nc1ccc(Br)cn1	773521524	DJBROYYXLUZAME-UHFFFAOYSA-N	432.278	1.383	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)C(=O)Nc1ccc(Br)cn1	773543503	VMULTGZCFZOPKH-UHFFFAOYSA-N	444.286	1.235	50	20	IDGD	
COC(=O)c1ccccc1CC(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	775763626	NRWDXYDIJXSJIB-UHFFFAOYSA-N	433.486	1.180	50	20	IDGD	
O=C(NNC(=O)c1ccc(Br)s1)Nc1ccnn1[C@H]1CCS(=O)(=O)C1	776059744	RFABNLRAMWOZDW-QMMMGPOBSA-N	448.324	1.533	50	20	IDGD	
Cc1cc(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c(C)o1	776271878	LBYHQORSILQZID-UHFFFAOYSA-N	427.504	1.304	50	20	IDGD	
CCOC(=O)N1CCC[C@@H]([C@H](C)NCC(=O)NNC(=O)c2cc(Cl)ccc2OC)C1	776826404	GUCMBQYNVLLVNL-UONOGXRCSA-N	440.928	1.956	50	20	IDGD	
CCOC(=O)N1CCC([C@H](C)NC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)CC1	777678104	IENYYCYTCCCYFR-AWEZNQCLSA-N	444.492	1.779	50	20	IDGD	
COc1nc(N2CCN(S(=O)(=O)CCCCCl)CC2)ncc1Br	780810505	QKJKUOXLSFAABT-UHFFFAOYSA-N	427.752	1.719	50	20	IDGD	
O=C(CCNS(=O)(=O)c1cccc(Br)c1)NNc1ncncc1Cl	781820710	ZEKIJQCWYRSFBC-UHFFFAOYSA-N	434.703	1.704	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2noc3c2CCCCC3)CC1	781932169	DOPOVWDWFUUDHJ-UHFFFAOYSA-N	434.522	1.032	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)cc1)C(=O)Nc1ccc(Cc2nnc3n2CCCCC3)cc1	782837936	VAWBUEFLKDPREX-UHFFFAOYSA-N	448.483	1.701	50	20	IDGD	
CN(C)c1nnc(-c2ccc(NC(=O)C(=O)NN=c3sc4ccccc4n3C)cc2)o1	783349185	BIIRMNXCBZSXKB-UHFFFAOYSA-N	437.485	1.926	50	20	IDGD	
O=C(NN=c1cc[nH]cc1)C(=O)Nc1ccccc1N1CCN(CCc2ccncc2)CC1	783370195	NLHLXWSUQKTIFR-UHFFFAOYSA-N	445.527	1.345	50	20	IDGD	
Cc1ccccc1NC(=O)NNC(=O)C(=O)Nc1ccc(C(=O)N2CCOCC2)cc1C	783416796	AMIDPKQPUQWQLA-UHFFFAOYSA-N	439.472	1.567	50	20	IDGD	
CC1CCN(c2cccc(NC(=O)C(=O)NNC(=O)CNC(=O)c3ccco3)c2)CC1	784002404	OODVZISZENLGCB-UHFFFAOYSA-N	427.461	1.032	50	20	IDGD	
COC(=O)CNC(=O)c1ccc(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2Cl)cc1	784382547	ALBRQIDIQUGWLW-UHFFFAOYSA-N	449.807	1.233	50	20	IDGD	
O=C(NNc1ncc(F)cn1)C(=O)Nc1ccc(S(=O)(=O)c2ccc(F)cc2)cc1	784950051	LKURRVJQPGBWPI-UHFFFAOYSA-N	433.396	1.669	50	20	IDGD	
CS(=O)(=O)CC[C@@H](C(=O)OCC(=O)NNC(=O)c1cccc(C#N)c1)c1ccccc1	789114645	HAHCFSFZRXFZRD-GOSISDBHSA-N	443.481	1.081	50	20	IDGD	
COc1nn(C)cc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccco2)nc2ccccc12	789586356	MLYUCMHHGKLINB-UHFFFAOYSA-N	434.412	1.637	50	20	IDGD	
CCNC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2c(C)nc3ccccn23)c1C	789731907	KBPLWEVMXHPSNS-UHFFFAOYSA-N	437.460	1.492	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cc([C@H]3CCCO3)nn2C)cc1	789741001	MHZOCXAISJAVNM-CXAGYDPISA-N	443.460	1.028	50	20	IDGD	
COc1c(C(=O)N(C)C)cc(Cl)cc1S(=O)(=O)NNC(=O)NCc1ccco1	790053631	GLEUUHOTSWLBJM-UHFFFAOYSA-N	430.870	1.336	50	20	IDGD	
Cc1ccc(C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)c(F)c1Cl	790730341	NBCWTHHHNDTSIL-UHFFFAOYSA-N	441.916	1.876	50	20	IDGD	
C[C@@](O)(Cn1cc(C(F)(F)F)ccc1=O)C(=O)NNc1ccnc(Br)c1	792334907	FNPRRUZWEDNNLA-CQSZACIVSA-N	435.200	1.919	50	20	IDGD	
COc1c(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3n2)cc(Cl)cc1C(N)=O	793022806	CRHUVBSAMYIBRZ-UHFFFAOYSA-N	441.831	1.395	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cc(=O)c3ccc(F)cc3o2)cc1	794766428	HVUBSCPQHLRKBT-UHFFFAOYSA-N	447.444	1.322	50	20	IDGD	
COCCNC(=O)c1cccc(S(=O)(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)c1	795280705	SCGZHEDHWNOTEU-UHFFFAOYSA-N	435.546	1.589	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)[C@@](C)(NC(C)=O)c2ccc(S(C)(=O)=O)cc2)cc1	797412429	MOSDTXZDINYJCF-NRFANRHFSA-N	431.514	1.465	50	20	IDGD	
Cc1ccc(NNC(=O)C(=O)Nc2cc3c(cc2N2CCCCC2)n(C)c(=O)n3C)nn1	800629129	MGJDJNUYVGHHQC-UHFFFAOYSA-N	438.492	1.048	50	20	IDGD	
O=C(NNC(=O)C1CCN(S(=O)(=O)c2cccnc2)CC1)Nc1ccc(Cl)cc1	802018676	RYRMVGKYIVCJQO-UHFFFAOYSA-N	437.909	1.989	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCN(c2ccc3c(c2)OCCO3)C1=O)Nc1ccc2c(c1)OCO2	802105243	RMVYPWVYQJXKEL-AWEZNQCLSA-N	440.412	1.392	50	20	IDGD	
COC[C@@H](C)n1c(C)cc(/C=C(/C#N)C(=O)NC2CCC3(CC2)NC(=O)NC3=O)c1C	804732785	ZBLKDLJJZLMMPY-AZOWTZNISA-N	427.505	1.856	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2ccc(F)c(S(=O)(=O)N(C)C)c2)cc1OC	806544119	UVHZNLCEIKVVGT-UHFFFAOYSA-N	440.453	1.560	50	20	IDGD	
CCc1nnc(NC(=O)[C@@H](C)[C@@H](C)NC(=O)NNC(=O)COc2ccccc2C#N)s1	807566112	SFSOZBROQIOKTK-NWDGAFQWSA-N	445.505	1.345	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)[C@@H]1C[C@@H](c2ccccc2)OC1=O	809702914	ASSUQHLSGDUFBD-WMZOPIPTSA-N	445.497	1.455	50	20	IDGD	
COC[C@@]1(C(=O)NNC(=O)COc2ccccc2OC)CCN(C(=O)OC(C)(C)C)C1	809933693	QTGVWKOGHGMLBS-OAQYLSRUSA-N	437.493	1.495	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cccn2C)c(C(=O)NCC(F)(F)F)cc1F	810384971	SVAFGQVHVKDBKO-UHFFFAOYSA-N	443.357	1.164	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)NCC(=O)NNc2ccc(C(F)(F)F)cn2)cc1	811164481	TXMJXRNNBMEBPJ-UHFFFAOYSA-N	431.396	1.480	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)N1CCN(c2ccccc2)CC1	812540353	QUXDTSLYWDEALK-UHFFFAOYSA-N	428.514	1.284	50	20	IDGD	
Cc1ccc(CN2C(=O)CC[C@@H]2C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)cc1	812729044	CTRWANBVJBZEEY-LJQANCHMSA-N	430.530	1.880	50	20	IDGD	
CC(C)Oc1cc(F)ccc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	813033869	OYUGCOIAYXKTEZ-UHFFFAOYSA-N	438.481	1.945	50	20	IDGD	
CCCc1nnc(SCC(=O)NNC(=O)[C@H](C)Oc2c(C)cc(Cl)cc2C)n1N	813366553	SZCYSNFETNJQJE-LBPRGKRZSA-N	440.957	1.922	50	20	IDGD	
CC(C)(C(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1csc(-c2ccccc2F)n1	814380911	VUJMIKDUZZVBFQ-LLVKDONJSA-N	425.507	1.809	50	20	IDGD	
O=C(NNC(=O)C1CCC(OC[C@@H]2CCCO2)CC1)c1csc(N2CCOCC2)n1	814736951	XTQQFESIMDRXPI-GPANFISMSA-N	438.550	1.495	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNc2cccc(Cl)n2)(S(C)(=O)=O)CC1	817011708	GYVFRXUFQVXBCS-UHFFFAOYSA-N	432.930	1.992	50	20	IDGD	
O=C(COC(=O)c1ccc(NC(=O)C2CC2)cc1)NNC(=O)[C@H]1COc2ccccc2O1	819497112	PSOWZGAITXQYGP-GOSISDBHSA-N	439.424	1.179	50	20	IDGD	
C[C@H]1CCCN(S(=O)(=O)c2ccc(C(=O)NNC(=O)c3ccc4c(c3)OCO4)cc2)C1	859346074	NSHLKKCRCGVCDL-AWEZNQCLSA-N	445.497	1.911	50	20	IDGD	
C[C@H]1CC(C)(C)C[C@@]2(C1)NC(=O)N(CC(=O)NNC(=O)COc1ccc(C#N)cc1)C2=O	864017028	JZLVHKYRKCZKAA-RCDICMHDSA-N	441.488	1.221	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(S(=O)(=O)N2CCCCC2)cc1)NC1CCCCC1	906372186	CWOLIACOAMVAFL-UHFFFAOYSA-N	444.579	1.686	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)CCNC(=O)c2ccc(C(C)(C)C)cc2)C[C@@H](C)O1	912924586	AEEIXITUEVBWOJ-IAGOWNOFSA-N	432.565	1.751	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)NC[C@H](c2ccc(OC)c(OC)c2)N(C)C)c1	915898144	SPXWBFXWXMMLBZ-GOSISDBHSA-N	446.504	1.968	50	20	IDGD	
COc1cc([C@@H](C)NC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc(OC)c1OC	916483790	XLWOEOKQGQMSDR-KZULUSFZSA-N	431.445	1.944	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccc(C(N)=O)cc2C)c1	916633442	CJLACKLPTBCNAU-UHFFFAOYSA-N	447.517	1.591	50	20	IDGD	
CN(CC(=O)NNC(=O)Cc1nc2ccccc2n1C)C(=O)c1ccc(Br)o1	917393920	ZQLWZBKPWFWKOT-UHFFFAOYSA-N	448.277	1.391	50	20	IDGD	
COC(=O)c1cc(Br)ccc1S(=O)(=O)NNC(=O)c1ccc(C)cc1O	917753214	CWYNIZKEPUZCFT-UHFFFAOYSA-N	443.275	1.873	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NC[C@@H](C)CN2CCCCC2)nc1	918104596	SROKKOAOENTALG-MRXNPFEDSA-N	426.587	1.860	50	20	IDGD	
O=C(COc1ccccc1CNC(=O)NNc1ccc(Cl)nn1)NC[C@@H]1CCCO1	918218574	XLBLEXQSXYMSAT-AWEZNQCLSA-N	434.884	1.630	50	20	IDGD	
Cc1nc2c(C(N)=O)cnn2c(C)c1CCC(=O)NNC(=O)c1ccc(Cl)cc1O	918361655	FXFKHVRUAIMYFW-UHFFFAOYSA-N	430.852	1.198	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)NCCC(=O)N[C@H]2CCS(=O)(=O)C2)c(C)n1CCC(C)C	918570813	XYLJYKRQMWYMKR-CBXNMNPBSA-N	448.589	1.868	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)OCC(=O)N[C@H](C)C(=O)N(C)C)c(C)n1C[C@H]1CCCO1	918952511	IGMTUNIVIGDTLP-MMTGQSPISA-N	430.505	1.327	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCCN(C)Cc2ccccc2)cc1	919790052	JIQPPBDWBATDRP-UHFFFAOYSA-N	447.561	1.078	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)[C@H](CSC)N1C(=O)[C@H]2CCCC[C@@H]2C1=O	919822964	XMBPJIOQAVOWLQ-JYJNAYRXSA-N	433.530	1.292	50	20	IDGD	
O=C(COc1cc(Cl)c(Cl)cc1Cl)NNC(=O)N[C@@H]1CCS(=O)(=O)C1	919885571	MCWYYOIOOJMQMN-SSDOTTSWSA-N	430.697	1.543	50	20	IDGD	
C#CCN1CCC(C(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)CC1	919964198	CHJBIIZJDBEGJM-UHFFFAOYSA-N	443.511	1.495	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)CCS(=O)(=O)c1ccc2c(c1)OCCO2	920006816	VNVGSVSNQHMIMG-UHFFFAOYSA-N	434.470	1.020	50	20	IDGD	
COc1cc(CN(C)C(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc(OC)c1	920048475	BHRQJMZJJLLLLA-UHFFFAOYSA-N	435.506	1.483	50	20	IDGD	
COc1cc(C(=O)NN/C=C2\C(=O)NC(=S)N(CC(C)C)C2=O)ccc1OC(C)C	920979768	IIIYSLREBBQYCL-NTEUORMPSA-N	434.518	1.500	50	20	IDGD	
Cc1noc(-c2ccc(C(=O)N3CCN(S(=O)(=O)CBr)CC3)cc2)n1	1254753099	DYSCZFMJKLPCOS-UHFFFAOYSA-N	429.296	1.485	50	20	IDGD	
CN(C)c1ccc(CCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1	1318157739	WUWVRGRSJWBBPA-UHFFFAOYSA-N	433.534	1.190	50	20	IDGD	
Cc1cnn(CC2CC2)c1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	1320247377	QTEGCPQORBUXAN-UHFFFAOYSA-N	446.533	1.853	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1csc(-c2ccco2)n1	1322641432	COXSGIBOCKQBQP-UHFFFAOYSA-N	439.497	1.622	50	20	IDGD	
COc1cccc([C@H]2[C@@H](C(=O)NNC(=O)c3n[nH]c4c3CCCC4)CC(=O)N2C2CC2)c1	1323487168	KNZNZFJHMOGKAC-UWJYYQICSA-N	437.500	1.810	50	20	IDGD	
O=C(NNC(=O)c1n[nH]c2c1CCCC2)Nc1cccc(Cn2nc3ccccn3c2=O)c1	1325336268	JKQQOGZLIWBJJO-UHFFFAOYSA-N	446.471	1.613	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2ccc(S(=O)(=O)N3CCCC3)c(OC)c2)cc1	1325339298	IXPMRCDGMGBQSV-UHFFFAOYSA-N	448.501	1.955	50	20	IDGD	
Cn1nc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)c2c1CCC2	1777963649	TZVSNJSSKRWRMA-YOEHRIQHSA-N	429.290	1.043	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H]1CC[C@@H]3CCC(=O)N3C1)C2)[C@H](F)Cl	1778025209	NKZXGFNEGSTPOK-VFXOAVOPSA-N	429.920	1.436	50	20	IDGD	
O=C(C#CC1(O)CCCCC1)N1CC[C@]2(C1)CN(C(=O)CCBr)CCO2	1779062596	MDYRKXVDODZCLB-IBGZPJMESA-N	427.339	1.300	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2)c1cc(-c2ccccn2)[nH]n1	1779766765	YNKAQRUIXIBRIV-WAOWUJCRSA-N	447.923	1.199	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccoc3Cl)C2)C1	1780454741	XCBWVRDFGJXFIV-VMHRPQTGSA-N	447.879	1.511	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)c(OC)c1	1780536887	PYNMDFMVVOSDBN-BFUOFWGJSA-N	441.322	1.931	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@](C)(Cl)CCl)C1	1780714792	IQRLLODNWOZOLT-NSNWQYSKSA-N	429.772	1.990	50	20	IDGD	
O=C([C@H]1CCc2ccoc2C1)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781325217	KZWOLPITAZCNRT-YEWWUXTCSA-N	429.286	1.905	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](C)Br)C2)nn1	1781997958	PHBVPXDHBDSCOJ-RVZJWNSFSA-N	441.326	1.396	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1c(C)nn(C)c1C)C2	1782172097	OTHYFSCMYDULMU-JXXFODFXSA-N	426.945	1.418	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(C(C)C)[nH]n1)C2	1782173452	BOHCKGOFSPNTDY-WIBUTAKZSA-N	426.945	1.914	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)Cc3cnc(C)s3)CCO2)C1	1783352944	KCBQKBJXQZRKCI-RHSMWYFYSA-N	430.368	1.997	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)c1ccc([N+](=O)[O-])o1	1783363825	VASKVCKKHUXGEE-PZEZNAACSA-N	434.218	1.472	50	20	IDGD	
O=C(/C=C/c1ccc(O)cc1Cl)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1783775092	PMLSESHFKUVIJL-VEPPAERVSA-N	429.300	1.488	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cnc4c(Cl)cccn34)CCO2)C1	1783876326	UUARZZKXYBBHKN-AUUYWEPGSA-N	441.315	1.685	50	20	IDGD	
C[C@H](Sc1ccccc1)C(=O)N1CCO[C@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1	1783933293	GLIPKMVBCDRYPX-JTSKRJEESA-N	448.589	1.370	50	20	IDGD	
C/C=C/C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)[C@H]2C1	1785078783	AZZOXDMDDWNGSH-GLGJLECESA-N	429.945	1.674	50	20	IDGD	
Cc1nnc(CCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]32)s1	1785325575	QOCUTKJFEYZOCP-NUXNZHGMSA-N	449.404	1.995	50	20	IDGD	
CC(C)OC(=O)c1ncccc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Cl)C[C@@H]21	1785583032	SSFVGRHPXIKNLC-NZUILWFCSA-N	441.887	1.775	50	20	IDGD	
C=C(CC(=O)OCC)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCBr)[C@H]2C1	1786409014	OVNQUBZQUGJEFF-KKUMJFAQSA-N	431.327	1.261	50	20	IDGD	
COCCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C[C@@H]21	1786638811	RNULQLMMGSGNEF-VFIHFLKLSA-N	433.455	1.888	50	20	IDGD	
C[C@@H](Br)C(=O)NC1(c2ccc(NC(=O)C[C@H]3NC(=O)NC3=O)cc2)CCC1	1786764540	PAAPMQURDVYNTM-ZWNOBZJWSA-N	437.294	1.502	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]3C2)c(C)n1	1789924671	SFPMEWSYMIEWHS-TUUVXOQKSA-N	428.302	1.982	50	20	IDGD	
CN(C)c1c(F)cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](O)CCl)C[C@@H]32)cc1F	1790296314	YEPCBEKJABAXII-BHADISHBSA-N	445.894	1.224	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)[C@@H]1Cc2ccccc2N1	1790681853	HHBKDWVROIYVKY-LAQRGFTBSA-N	436.350	1.788	50	20	IDGD	
CC(C)n1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]3C2)n1	1791059220	RRQCQOXQKDIONO-HOSILWTGSA-N	427.343	1.841	50	20	IDGD	
CCOc1ccccc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2C1	1791290820	OLLWJRIZKFBMKW-QRFRQXIXSA-N	446.548	1.052	50	20	IDGD	
C[C@H](Oc1ccccn1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)Br)C[C@@H]21	1791626296	AADNXVVTBYYAOO-YXMSTPNBSA-N	440.338	1.612	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ncc(Cl)cc1Cl)c1cccc(B(O)O)c1	1792464962	UOHQDENMJKAESH-MUJYYYPQSA-N	448.115	1.634	50	20	IDGD	
CCOC(=O)[C@@H]1CCC[C@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)C(Cl)Cl)C3)C1	1792958863	WMCWBAIWCWCVTO-ZQNQSHIBSA-N	435.348	1.749	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CCN1C(=O)OC(C)(C)C	1793632097	SJIVYDFBHVUNNH-NPJQDHAYSA-N	429.945	1.603	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(N(C)C)cn1	1794462552	QSTUJERWBSYOQG-YXPYIKCWSA-N	439.354	1.524	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1CCCO1	1796339463	UDOPKOLNPZQUBM-NXEZDXNNSA-N	431.445	1.951	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2nccn2c1	1797076891	BEAVSRDRRWCLJG-JJAZEVLHSA-N	435.322	1.569	50	20	IDGD	
COc1ccc2c(/C=C/C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@H](O)CCl)C4)c[nH]c2c1	1797142437	XJWSKYYEPAXQQM-KWHUGRLPSA-N	447.919	1.379	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc3ncoc3c1)C2	1798440632	ULHXQSMLXCBXOX-QDMKHBRRSA-N	434.456	1.392	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(=O)nc2sccn12	1799094302	YCTSAXCGMKPRNN-BTTYYORXSA-N	434.594	1.859	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1c(F)ccc(OC)c1OC	1799663015	LDQYRGFGWDOQOH-LKQDWFRTSA-N	444.887	1.300	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(F)c(F)c1	1799757338	VLJBVHBWYIHCAN-BTTYYORXSA-N	429.427	1.529	50	20	IDGD	
CC(C)(C)OC(=O)NCC[C@H](O)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C(Cl)Cl)C2	1800169122	MILZMJYUZGMLOI-RNJOBUHISA-N	438.352	1.704	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2	1800333137	OXHHOSKZTIHTPL-UKJYWXTOSA-N	427.810	1.996	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1Cc3ccccc3CN1)C2	1800758384	YGHZLLOGVKRVGA-IHXXTUNLSA-N	436.350	1.074	50	20	IDGD	
NC(=O)c1ccccc1C(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1	1803140995	JWIZRMFRQXUWIF-JLSDUUJJSA-N	430.892	1.100	50	20	IDGD	
O=C(COCc1ccccc1)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1	1806874390	PUWQUQPVEOMVEC-ZJOUEHCJSA-N	431.920	1.904	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC2(CCCN(C(=O)CCc3ccco3)C2)CC1	1807114401	GNURWOLVTGJKMG-UHFFFAOYSA-N	439.516	1.756	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)[C@H]2C[C@H]2F)[C@H]1c1cccnc1	1807821152	WAGNJVIXONUZGJ-AYCZLPQWSA-N	440.479	1.579	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2cc3ncccn3n2)[C@H]1c1cccnc1	1809766996	DDPSCQWHKAWLCM-TXPKVOOTSA-N	442.907	1.698	50	20	IDGD	
C/C(=C\c1cccnc1)C(=O)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1	1809979715	AAEXFTKYOXKAKO-XDJHFCHBSA-N	447.344	1.710	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)CC2CCC2)[C@H]1c1cccnc1	1810307680	FXKPFBKKRYTPMY-UWJYYQICSA-N	436.516	1.590	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)C(OC)OC)[C@@H]1c1cccnc1	1812773526	GEFXNPRTSKAAKG-SOUVJXGZSA-N	428.327	1.880	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)CCc2ccco2)[C@H]1c1cccnc1	1813070345	HYXYZWAEJJLTQG-MBSDFSHPSA-N	441.532	1.686	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)C2CC(C)(C)C2)[C@@H]1c1cccnc1	1813130092	VVANMEHOBQTDGE-UWJYYQICSA-N	429.565	1.897	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc(F)nc2F)n[nH]1	1814333055	HWTCCALBJWCGQW-CQSZACIVSA-N	449.462	1.762	50	20	IDGD	
C[C@H](NC(=O)c1ccccn1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](O)CCl)n[nH]1	1814875032	MLDACNLAIKXRAL-MAZHCROVSA-N	448.911	1.215	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](N)CCC(N)=O)n[nH]1	1817249017	BVUIPDUWZGOHMR-NTZNESFSSA-N	443.346	1.168	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CO[Si](C)(C)C)CC2	1817301118	BLXUUTAABFJXNH-DGCLKSJQSA-N	426.615	1.773	50	20	IDGD	
CCOC(=O)N[C@@H](O)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CO[Si](C)(C)C)n[nH]1	1819595087	AMAQRAQOUWZANI-CJNGLKHVSA-N	441.561	1.318	50	20	IDGD	
C[C@@](O)(CC(=O)O)CC(=O)N1CCCC[C@@H]1c1cc(NC(=O)CO[Si](C)(C)C)n[nH]1	1819597419	YIKNVTAEHQEGGT-KUHUBIRLSA-N	440.573	1.869	50	20	IDGD	
CC1(C)CC(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cnccc4C(=O)NN)sc3C2)C1	1819801044	XXWUSHDWYVAOLG-GFCCVEGCSA-N	442.545	1.804	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CC[C@H](N)C(N)=O)CC1	1826931477	GOAAWCPZSXXSTH-KBMXLJTQSA-N	445.402	1.230	50	20	IDGD	
N#CCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Cl)CCN2C(=O)OCc1ccccc1	1829052619	PNBXPNGUVNIVMX-XLIONFOSSA-N	436.871	1.887	50	20	IDGD	
O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)c1cccnc1Cl)CCO2	1829493489	KTUYJZVGRWANAN-QGZVFWFLSA-N	446.729	1.590	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)ccn1	1830539144	CMRBHGUSAJRBLU-IFXJQAMLSA-N	440.338	1.491	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H](N)Cc2cccnc2)CC1	1831831745	AOWSLVIONVNAHQ-AABGKKOBSA-N	436.984	1.825	50	20	IDGD	
O=C1C[C@H](C(=O)N2CCCC[C@@H]2C2CCN(C(=O)CCBr)CC2)CCN1	1831936091	WBIFPHONGBXNHX-HZPDHXFCSA-N	428.371	1.917	50	20	IDGD	
C[C@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1)c1ccccn1	1832328125	KXIOGUDENWHSMV-FDDCHVKYSA-N	449.360	1.798	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H]3CCc4ccoc4C3)CC2)CC1)[C@@H](O)CCl	1833305850	AFZSUAMKVFOOLL-APWZRJJASA-N	437.968	1.556	50	20	IDGD	
Cc1nc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)ccc1F	1833466328	YJONDADDQFBGCS-RBUKOAKNSA-N	448.322	1.835	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3ncn(C(C)C)n3)CC2)CC1	1835205416	GHSCWHJLVJKIRB-QGZVFWFLSA-N	440.976	1.298	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)c1cn2ccccc2n1	1835300042	FNBGNBMUQQVHJM-SFHVURJKSA-N	433.940	1.119	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)/C=C/c3cc(C)on3)CC2)CC1	1835778897	WSJOJQZVTUZZGX-GNAXCBTBSA-N	438.956	1.822	50	20	IDGD	
CN1CCC[C@@H](C(=O)N2CCC(N3CCC(NC(=O)CO[Si](C)(C)C)CC3)CC2)C1	1835836146	NTHHYLHZUQHRSY-GOSISDBHSA-N	438.689	1.751	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3ccc(F)nc3C)CC2)CC1	1836030535	LBSSVXWIJCYKSG-GOSISDBHSA-N	440.947	1.968	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC1CCN(C2CCN(C(=O)c3cc(O)n[nH]3)CC2)CC1	1836398479	KWGXYZSFNRPBOF-SFHVURJKSA-N	432.352	1.537	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3noc4c3CCCC4)CCO2)C1	1836429528	HJERBPHQKLLMKZ-QRWLVFNGSA-N	425.913	1.641	50	20	IDGD	
O=C(c1c(F)cncc1F)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836718664	YPGCMUJMHFDPCZ-MRXNPFEDSA-N	431.867	1.572	50	20	IDGD	
O=C(Cn1cc([N+](=O)[O-])cn1)N1CCC(OC2CCN(C(=O)[C@@H](F)Cl)CC2)CC1	1837136509	RUNXOBUHGIJMGT-MRXNPFEDSA-N	431.852	1.324	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)c3ncnn3C)CC2)CC1	1837371938	VCUOQSVNUAYQRH-GFCCVEGCSA-N	428.331	1.211	50	20	IDGD	
CCc1cc(C(=O)N2CCOC[C@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)cc(C)n1	1837713101	HOUQILJEAQPQAS-QFIPXVFZSA-N	449.624	1.874	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cnccc1Cl)CCO2	1837777562	YKWKXXIKPHUKSV-IBGZPJMESA-N	441.988	1.657	50	20	IDGD	
NC(=O)c1ccc(C(=O)N2CCC(OC3CCN(C(=O)[C@H](F)Cl)CC3)CC2)cc1	1838086333	ZSEFHKUBXRDFTG-KRWDZBQOSA-N	425.888	1.932	50	20	IDGD	
Cc1nn(C)c(C)c1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2	1839150346	JUVXLWQCUXDXIE-RBUKOAKNSA-N	447.363	1.343	50	20	IDGD	
O=C(Cc1cccc(F)c1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839199211	KFXWLGXGHKMXQM-WMZOPIPTSA-N	447.276	1.515	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(C)c(O)c3)CCO2)C1	1839269173	GMKCRNTYWNHWOA-OXJNMPFZSA-N	426.897	1.024	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(O)ccc3O)CCO2)C1	1839446184	HGLSYTWKRSVKNG-UZLBHIALSA-N	426.897	1.575	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)cc(C)c1C(=O)O	1839480401	GCHJRQCVCIZEDI-OXQOHEQNSA-N	442.871	1.606	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3onc4ccccc34)CCO2)C1	1839547601	HIPZKDZDQPYVCD-FOIQADDNSA-N	437.880	1.152	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3ccco3)C2)C1	1840031358	NKSAKQJTZUFKFS-KDOFPFPSSA-N	429.311	1.452	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(C)c3Cl)C2)C1	1840156154	JKHYPHOVJWXITO-OXJNMPFZSA-N	445.343	1.972	50	20	IDGD	
O=C(/C=C/C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2)c1cccs1	1840187665	PIFFAMGCVLZYRR-OAJJDEHYSA-N	447.340	1.747	50	20	IDGD	
C/C(=C\c1cccnc1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840190742	KVFSXTPTANUAKN-JNMQVBFRSA-N	428.316	1.745	50	20	IDGD	
O=C(c1ccccc1OC(F)(F)F)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843012705	HHXSCPGHEJKFOH-UHFFFAOYSA-N	448.206	1.396	50	20	IDGD	
CCN(CC)[C@@H](C(=O)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1)c1ccccc1	1843015004	XTMVWACEVAHPTC-JOCHJYFZSA-N	449.360	1.267	50	20	IDGD	
CCN(CC)C[C@H](C)C(=O)N1CC2(CCCN2C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C1	1843416985	LFAKVEVPMXEAPH-FWGBXFHKSA-N	430.553	1.302	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2ccc3c(c2)CC(=O)N3)C1	1844005052	XZKPHEVHHJOTPZ-VULFUBBASA-N	448.483	1.132	50	20	IDGD	
CCCN1CCN(c2ccc(C(=O)N3CCCC34CN(C(=O)[C@H](O)CCl)C4)cc2)CC1	1845564799	LHOGZTZNKUPJSI-HXUWFJFHSA-N	448.995	1.635	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2cccc3ccncc23)C1	1845601607	MVKNEXLCKRFEIS-UHFFFAOYSA-N	430.468	1.364	50	20	IDGD	
CCOC(=O)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)[C@H](Cl)CC)C2	1847044951	YYFXLSSAUXGALW-KGLIPLIRSA-N	445.944	1.664	50	20	IDGD	
COc1cc(OC)c(OC)cc1CNC(=O)NNC(=O)c1n[nH]c(=O)c2ccccc12	9754528	QRVMZAINRQXBTL-UHFFFAOYSA-N	427.417	1.093	50	20	IDGD	
C[C@H](SCC(=O)Nc1ccc(F)cc1)C(=O)OCC(=O)NNC(=O)c1ccccc1	10472223	PGVWFMQLMHZFRR-ZDUSSCGKSA-N	433.461	1.890	50	20	IDGD	
Cc1nnc(NNC(=O)Cc2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2)[nH]c1=O	11266124	NUAFAIIGTIIXGP-UHFFFAOYSA-N	432.437	1.099	50	20	IDGD	
C[C@H]1Cc2cc(C(=O)NNC(=O)[C@@H](C)Oc3ccc(F)cc3)ccc2N1S(C)(=O)=O	14939579	KJKRDSAGQSMTMA-QWHCGFSZSA-N	435.477	1.765	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)c2ccc(S(=O)(=O)N3C[C@@H](C)C[C@@H](C)C3)cc2)n1	15462378	RZIUVXYVWCQSJO-GASCZTMLSA-N	447.561	1.628	50	20	IDGD	
CCCn1nc(C(=O)NNS(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2)c2ccccc2c1=O	15562725	LVPBUFHQVSETEY-UHFFFAOYSA-N	445.457	1.646	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cc(Cl)nc(Cl)c2)cc1	15709639	BVZTXHHWLPZPKV-UHFFFAOYSA-N	431.301	1.779	50	20	IDGD	
C[C@H]1C[C@@H](C)CN(C(=O)CN2CCN(CC(=O)NNC(=O)c3ccccc3Cl)CC2)C1	23370330	KAIFSZZCOSZJRJ-CALCHBBNSA-N	449.983	1.223	50	20	IDGD	
C[C@H](SCC(=O)Nc1ccc(F)cc1)C(=O)NNC(=O)[C@H]1COc2ccccc2O1	23712885	CVURKEQKTNKYST-YVEFUNNKSA-N	433.461	1.873	50	20	IDGD	
CCOc1ccc(N[C@@H](C)C(=O)NNC(=O)c2cccc(C)c2)cc1S(=O)(=O)N(C)C	25215232	GXBVHNOHWQLOBB-HNNXBMFYSA-N	448.545	1.906	50	20	IDGD	
CSc1nc2nc(C)c(CC(=O)NNC(=O)[C@@H](C)Oc3ccc(F)cc3)c(C)n2n1	27198201	MXRZKJWUAHRWAH-GFCCVEGCSA-N	432.481	1.760	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])c[nH]1)c1cccc(S(=O)(=O)NCc2ccccc2)c1	28715287	MQMQPIBZXGLENS-UHFFFAOYSA-N	443.441	1.476	50	20	IDGD	
COc1ccc(-c2n[nH]c(=S)n2CC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1	105162691	IJALEYOCGVNJEB-INIZCTEOSA-N	441.469	1.604	50	20	IDGD	
COc1ccccc1[C@H](CNC(=O)NNC(=O)CNC(=O)c1ccco1)N1CCCC1	726084302	OYVXWPNXBHBLGR-INIZCTEOSA-N	429.477	1.186	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N[C@@H](CCSC)C(=O)NNC(=O)c2ccc[nH]2)cc1	726630130	IIXMTSRAJKLMRU-INIZCTEOSA-N	440.547	1.275	50	20	IDGD	
CCCCC(=O)N1CSC[C@@H]1C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	727981905	AAYWMTFAPNQCCM-LJQANCHMSA-N	447.605	1.438	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)CCc2ccc(S(=O)(=O)NC3CC3)cc2)c1	728206032	QNWKRALZEBEZFF-UHFFFAOYSA-N	446.529	1.328	50	20	IDGD	
CN(C)C(=O)COc1cccc(CNC(=O)NNC(=O)c2cccc(OC(F)F)c2)c1	728595768	VQIYWDBNEQSOEC-UHFFFAOYSA-N	436.415	1.899	50	20	IDGD	
CC[C@@H](N=c1nn[nH]n1-c1ccccc1)C(=O)NNC(=O)[C@@H](C)Oc1ccc(F)cc1	729281785	DNOZWHVEDSOCKQ-CXAGYDPISA-N	427.440	1.029	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)[C@H](Cc1cccc(F)c1)n1nnnc1C	729297445	KYTLHZHSJPZYJP-INIZCTEOSA-N	428.424	1.139	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@@H]2CC(=O)N(c3ccc(F)c([N+](=O)[O-])c3)C2)c(OC)c1	729950215	OPCLSNMRDDWXAB-LLVKDONJSA-N	446.391	1.565	50	20	IDGD	
CCS(=O)(=O)N[C@H](CCSC)C(=O)NNC(=O)c1cc2c(s1)CC[C@H](C)C2	730517004	HGPMLNCJYYQMFM-WCQYABFASA-N	433.621	1.695	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)[C@@H]1CCN(c2ccc3c(c2)OCCO3)C1=O	730546678	GLYCTCFSBJAOCG-KRWDZBQOSA-N	434.452	1.613	50	20	IDGD	
Cc1nc2cc(F)cc(C(=O)OCC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)c2nc1C	732328959	GQUKQMKNNCXQKQ-UHFFFAOYSA-N	441.375	1.912	50	20	IDGD	
O=C(NNC(=O)[C@@H]1C[C@@H]1c1ccc(OCc2ccccc2)cc1)[C@@H]1CCS(=O)(=O)C1	732535119	RTBWUHUEXSUVKO-MISYRCLQSA-N	428.510	1.951	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)NNC(=O)NCC1CCN(S(=O)(=O)C(F)F)CC1	733044912	AFBOMNDVPTVZJM-UHFFFAOYSA-N	443.476	1.305	50	20	IDGD	
C[C@@H](NC(=O)/C(C#N)=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)N(C)C	733163333	JYPHHKONEQJSIR-NWFCWYBLSA-N	442.907	1.579	50	20	IDGD	
COc1ccc(Cl)cc1NCC(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	733500309	IZIPHAUENNQDIX-UHFFFAOYSA-N	436.808	1.673	50	20	IDGD	
Cc1ccc(C#N)cc1S(=O)(=O)NNC(=O)c1ccc(CSc2nncn2C)cc1	734119047	ZXANMZYSVAYTNX-UHFFFAOYSA-N	442.526	1.911	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)c(-c2ccc([N+](=O)[O-])cc2)n1	734239899	ZDQCGYCBYAEIEJ-UHFFFAOYSA-N	447.452	1.464	50	20	IDGD	
CCN(CC(=O)NNC(=O)c1sc(N2CCOCC2)nc1C)C(=O)OC(C)(C)C	734419246	NNPUOLKHMNOXTA-UHFFFAOYSA-N	427.527	1.306	50	20	IDGD	
CCOCCCN1CC[C@@H](NC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)[C@@H](C)C1	734542031	KGHONLLIUPSIQJ-FUHWJXTLSA-N	444.536	1.659	50	20	IDGD	
CCOCCCN1CC[C@@H](NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)[C@H](C)C1	734682530	BXDIBUMYSFFOOB-CRAIPNDOSA-N	444.536	1.015	50	20	IDGD	
COc1ccc(S(=O)(=O)C[C@@H](C)C(=O)NNC(=O)COc2ccccc2OC)cc1	735028225	JTLUQSLEUCCMCV-CQSZACIVSA-N	436.486	1.340	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NN=C1C(=O)Nc2c(Cl)cc(Br)cc21	735614297	SFWGMWSVRKYLJO-UHFFFAOYSA-N	425.626	1.898	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)N1CCN(Cc2ccc(Cl)cc2)C(=O)C1	738450427	MNCPMZGLTGUGPJ-UHFFFAOYSA-N	440.891	1.995	50	20	IDGD	
CC(=NNC(=O)c1nn(C)c(=O)c2ccccc12)c1cccc(N2CCCS2(=O)=O)c1	741161843	JYXZZNNZLKGLPH-UHFFFAOYSA-N	439.497	1.627	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCc2nc(-c3ccccc3)n[nH]2)cc(OC)c1OC	741419910	ZTGHDVBRIAUCIF-UHFFFAOYSA-N	426.433	1.642	50	20	IDGD	
O=C(NNc1ncnc2[nH]cnc12)c1ccc2c(c1)C(=O)N(CCc1ccccc1)C2=O	743470615	IGQACDYOEWZEIS-UHFFFAOYSA-N	427.424	1.949	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NC[C@@H](C)Oc1cccc(F)c1	743509667	JHONPDFVOAXORK-GFCCVEGCSA-N	437.497	1.839	50	20	IDGD	
Cc1sc2nc(CN3CCN(CC(=O)NNC(=O)C(C)(C)C)CC3)nc(O)c2c1C	744385554	QNKWABINHYTAOX-UHFFFAOYSA-N	434.566	1.325	50	20	IDGD	
CN(CC(=O)NNC(=O)c1ccc(C#N)cc1)[C@@H]1CCN(c2ccccc2Cl)C1=O	744400945	RNCVDZREXVBDMH-GOSISDBHSA-N	425.876	1.710	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1cc(-c2cccs2)[nH]n1	744619764	XTNKCHSKPWGZGT-UHFFFAOYSA-N	433.515	1.916	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)c2c(Br)ccc(F)c2N)cc1	744916610	DJOYBRZBYIRZJR-UHFFFAOYSA-N	435.209	1.660	50	20	IDGD	
CCOc1cc(C=NNC(=O)N2CCOCC2)ccc1OCCn1c([N+](=O)[O-])cnc1C	745603247	YZJUAVJBXLOEFA-UHFFFAOYSA-N	446.464	1.953	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)NC[C@@H](C)CN2CCN(C)CC2)c(C)n1-c1ccccc1	745859842	FDTPTEBZZDZSCF-QGZVFWFLSA-N	426.565	1.922	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1ccc(C)c(C(=O)NNC(=O)N2CCOCC2)c1	745993011	SJHJZVDYQRFEJJ-UHFFFAOYSA-N	448.501	1.491	50	20	IDGD	
CC(C)CO[C@@H](C)c1noc(CN(C)C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)n1	745998304	IYVGJSBCCXGOCI-ZDUSSCGKSA-N	443.468	1.265	50	20	IDGD	
COC(=O)c1ccsc1N1CC[C@@H](NC(=O)NNC(=O)Cc2ccc(F)cc2)C1=O	746781273	RRGCXTDNJYHJBW-CQSZACIVSA-N	434.449	1.352	50	20	IDGD	
COc1ccc(-n2c(C)nnc2SCC(=O)N([C@H]2CCS(=O)(=O)C2)N(C)C)cc1	746949525	MAJYSFQUHFAOQD-HNNXBMFYSA-N	439.563	1.169	50	20	IDGD	
COc1cc(CN2CCN(CC(=O)NNC(=O)c3cccc(C)c3)CC2)cc(OC)c1	747843667	OXFTYWDVTBTGOZ-UHFFFAOYSA-N	426.517	1.591	50	20	IDGD	
O=C(NCCS(=O)(=O)N1CCOCC1)NNc1ncc(C(F)(F)F)cc1Cl	748112295	WTJLUHCTPAGXEK-UHFFFAOYSA-N	431.824	1.042	50	20	IDGD	
Cc1ccc(C)c(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)C(=O)N3CCCC3)cc2)c1	748246458	LENWGIQSAAEYEL-UHFFFAOYSA-N	444.513	1.488	50	20	IDGD	
Cc1nc(Cl)cc(NNC(=O)[C@@H]2CCCN(S(=O)(=O)c3c(C)n[nH]c3C)C2)n1	748339216	QEVVVMKIHXZBGX-GFCCVEGCSA-N	427.918	1.322	50	20	IDGD	
O=C(NCCC(=O)N1CCN(c2ccccn2)CC1)NNC(=O)c1cccc2cccnc12	748466281	XTGDEALSMADBBY-UHFFFAOYSA-N	447.499	1.313	50	20	IDGD	
CCCn1nc(C(=O)NNS(=O)(=O)c2cccc(C)c2C#N)c2ccccc2c1=O	749754377	OMDRVAREXYXVDA-UHFFFAOYSA-N	425.470	1.610	50	20	IDGD	
C[C@@H]1CN(S(=O)(=O)c2cccc(C(=O)NNC(=O)CCc3ccccc3)c2)C[C@@H](C)O1	749803639	GSBQJVXJRWDHQG-IAGOWNOFSA-N	445.541	1.878	50	20	IDGD	
COCCS(=O)(=O)c1ccc(C(=O)OCC(=O)NNC(=O)c2ccc(C)cc2)cc1	750151032	WQJJVDVMUBEHPJ-UHFFFAOYSA-N	434.470	1.033	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccccc1)NNc1nc(Br)cn2ccnc12	750242869	AHRFXJNLPYLSIY-UHFFFAOYSA-N	439.295	1.304	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNS(=O)(=O)c1cc(C(F)(F)F)ccc1Cl	751282126	JJFOEPFKRYZIJL-UHFFFAOYSA-N	425.772	1.691	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)NNC(=O)[C@H](C)Oc2ccc3ccccc3c2)c(C)o1	751299016	ZJGWVHAUGJRYGS-ZDUSSCGKSA-N	431.470	1.878	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)c1ccc(=O)n(CCOc2ccccc2Cl)c1	751995256	XPKGMEMZFMGSOS-UHFFFAOYSA-N	448.907	1.647	50	20	IDGD	
CN1C(=C(C#N)C(=O)COC(=O)COCCNC(=O)c2ccccc2)N(C)c2ccccc21	752320341	FNPSQXBCKQLTAE-UHFFFAOYSA-N	448.479	1.867	50	20	IDGD	
CCOC(=O)c1ccc(N2CC(NC(=O)NNc3ccccc3S(C)(=O)=O)C2)nc1	753278159	BLIMNVOOWMMWPA-UHFFFAOYSA-N	433.490	1.177	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)NC[C@H]2CCN(S(C)(=O)=O)C2)c1	753669787	KHWSDKRCPHAITI-OAHLLOKOSA-N	426.539	1.109	50	20	IDGD	
C[C@@H]1CCCN(S(=O)(=O)c2ccc(NC(=O)NNC(=O)Cc3ccncc3)cc2)C1	755446262	BPLRJGURDZFIFF-OAHLLOKOSA-N	431.518	1.898	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)Nc1ccc(CC(=O)N2CCOCC2)cc1	755862795	SVTVGVFUOWKASH-UHFFFAOYSA-N	426.429	1.283	50	20	IDGD	
CO[C@H](C)C(=O)Nc1cccc(NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1	756228242	QDYYWUWHXHUHJB-CQSZACIVSA-N	441.492	1.519	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)Nc1ccn(-c2cccc(C(F)(F)F)c2)n1	757998369	WOESGCQRVSOGRO-JTQLQIEISA-N	431.396	1.479	50	20	IDGD	
O=C(Cc1ccc(-n2cccc2)cc1)N1CCN(S(=O)(=O)CBr)CC1	758519320	YZWZEGYVCAPRDW-UHFFFAOYSA-N	426.336	1.846	50	20	IDGD	
COc1ccc(CNC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)c(F)c1	758865106	IKNKDORQSXDQRU-UHFFFAOYSA-N	438.481	1.294	50	20	IDGD	
Cc1cc(S(C)(=O)=O)cc(C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)c1C	759113600	LJCRNARTNDLRHZ-UHFFFAOYSA-N	428.511	1.176	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)c2ccc3ncc(I)n3c2)nc1	759739986	VKVNUINREBGYQH-UHFFFAOYSA-N	437.197	1.877	50	20	IDGD	
COc1cc(N2CCN(CC(=O)NNC(=O)c3cccs3)CC2)cc(OC)c1OC	759880085	WGRWQIDPSJWFSH-UHFFFAOYSA-N	434.518	1.357	50	20	IDGD	
COC(=O)CS(=O)(=O)Cc1ccc(CNC(=O)NNc2cccc([N+](=O)[O-])c2)cc1	760195378	OBKLBXJGTVFTNV-UHFFFAOYSA-N	436.446	1.509	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)C2(NC(=O)OC(C)(C)C)CC2)c2ccccc2c1=O	760280506	QJWMQMHKTDIZQH-UHFFFAOYSA-N	429.477	1.625	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)CCNC(=O)[C@@H]2CCCN2C(=O)OC(C)(C)C)cc1	760801864	WHHARPDNUOZKGK-KRWDZBQOSA-N	448.520	1.427	50	20	IDGD	
O=C(NNc1nccc(N2CCOCC2)n1)C1CCN(c2ccccc2[N+](=O)[O-])CC1	762864513	CBAHAQLDNCWJMZ-UHFFFAOYSA-N	427.465	1.581	50	20	IDGD	
O=C(NNC(=O)c1ccc2ccccc2n1)C(=O)Nc1cccc(-c2nnnn2C2CC2)c1	763450905	RMJMJEIXQPIXIS-UHFFFAOYSA-N	442.439	1.623	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1cc2c(cc1Cl)OCCO2	763625410	QTDOOLSPFSDFAZ-UHFFFAOYSA-N	429.820	1.467	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(Cl)c2N2CCOCC2)c1	763631182	WDZCVSAUBLCNGB-UHFFFAOYSA-N	446.891	1.650	50	20	IDGD	
Cc1cnc(O)n1-c1ccccc1NC(=O)C(=O)NNC(=O)COc1ccc(Cl)cc1	763695851	YPEFWBUWSHPCRP-UHFFFAOYSA-N	443.847	1.705	50	20	IDGD	
Cc1nnnn1-c1cccc(NC(=O)C(=O)NNC(=O)CSc2ccc(Cl)cc2)c1	763733909	IRIABAZEMNBVQZ-UHFFFAOYSA-N	445.892	1.502	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cnn(Cc3ccccn3)c2)c1C	763849433	LORCOYMYEPSUKV-INIZCTEOSA-N	436.472	1.497	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(C)nc2N(C)C)cc1	763861561	QTHJIZGJZJXRRW-AWEZNQCLSA-N	429.477	1.408	50	20	IDGD	
COCCOC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)Cc2ccc(Cl)cc2)c1	763932845	VWRGWBRCBWFFGN-UHFFFAOYSA-N	448.863	1.864	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)C(=O)Nc1cccc(CS(=O)(=O)NC(C)(C)C)c1	763957801	KDJHTXMUJBASJB-UHFFFAOYSA-N	446.529	1.613	50	20	IDGD	
C[C@H](c1ccc(NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)cc1)N1CCOCC1	763973897	GLSRBOAGIVJPJM-CYBMUJFWSA-N	446.891	1.839	50	20	IDGD	
COCC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2OC)cc1	764012519	SFJQIICGMRQGBK-UHFFFAOYSA-N	434.836	1.333	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)c2cccc(OC)c2O)sc2c1CCC2	764130085	AMXWPZLPPOSPDJ-UHFFFAOYSA-N	447.469	1.527	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(C(=O)NC)c2C)o1	764139122	NTZUETQUUSHCOX-UHFFFAOYSA-N	429.477	1.189	50	20	IDGD	
CCOC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)CCOc2ccccc2)cc1C#N	764162029	YZZAKJZCBFJREH-UHFFFAOYSA-N	439.428	1.682	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccn(-c3ccc(Cl)cc3C#N)n2)c1	764236459	ZDEQROKKTLXFDH-UHFFFAOYSA-N	433.815	1.669	50	20	IDGD	
C[C@@H]1Oc2ccc(NC(=O)C(=O)NNC(=O)c3cccc(OC(F)F)c3)cc2NC1=O	764249692	COGKXQUWVHPPAT-VIFPVBQESA-N	434.355	1.407	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccccc3-n3cncn3)n[nH]2)cc1C	764389143	XUHXWBIHBPUNGF-UHFFFAOYSA-N	444.455	1.674	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)C(=O)Nc1ccc(Oc2cccnc2)nc1	764400773	HEDHJWSZLIMUEU-UHFFFAOYSA-N	439.453	1.853	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)NCCS(=O)(=O)CC2CC2)cc1Cl	765955590	BAIICMHCEZSPMH-UHFFFAOYSA-N	434.902	1.518	50	20	IDGD	
CC[S@@](=O)c1ccccc1C(=O)NNC(=O)CN1CCN(Cc2ccc(C)cc2)CC1	766642357	RFZXOTZEMPXQTP-WJOKGBTCSA-N	442.585	1.701	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1c[nH]cc1-c1ccccc1	766649762	JSIRUUUEYNTMBF-UHFFFAOYSA-N	431.496	1.901	50	20	IDGD	
COCc1ccc([C@@H]2CCCN2C(=O)NNC(=O)c2csc(N3CCOCC3)n2)o1	767296297	JLJYBGZKNBTQSB-HNNXBMFYSA-N	435.506	1.911	50	20	IDGD	
O=C(COc1ccccc1NC(=O)C(=O)NNC(=O)c1ccccc1O)Nc1cccnc1	768234285	RPOJFJAKGVNLMB-UHFFFAOYSA-N	449.423	1.204	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)[C@H]2CC(=O)N(Cc3ccccn3)C2)n[nH]1	768276936	NVOUTCSBCIUTJE-AWEZNQCLSA-N	434.456	1.290	50	20	IDGD	
CCN1CCC[C@@H]1CN1C[C@@H](C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)CC1=O	768279281	MBNUGRCJNNGIGH-DOTOQJQBSA-N	442.495	1.310	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N(C)C)nc2)ccc1OC(C)C	770220635	RDKHFAFDJSLDTC-UHFFFAOYSA-N	436.490	1.203	50	20	IDGD	
CCNC(=O)N(C)NC(=O)C1CCN(S(=O)(=O)c2cccc(C(F)(F)F)c2)CC1	770548821	JLVDCXYYTCJRRG-UHFFFAOYSA-N	436.456	1.799	50	20	IDGD	
O=C(CN1C(=O)Cn2c(cc3ccccc32)C1=O)NNc1ccnc(Br)c1	771531941	HDUKFAFSPZNUKG-UHFFFAOYSA-N	428.246	1.925	50	20	IDGD	
O=C(CCC(=O)N1CCN(c2ccccn2)CC1)NNc1ccnc(Br)c1	771533955	XRGAWXSEWMYEHY-UHFFFAOYSA-N	433.310	1.811	50	20	IDGD	
Cc1cc(=O)oc2cc(OCC(=O)NNC(=O)C(=O)NCc3ccc(Cl)cc3)ccc12	772196665	NCNYMGKJYYQWIG-UHFFFAOYSA-N	443.843	1.597	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)cnn1C1CCCC1	773662147	POPQFTKNRGRLOC-UHFFFAOYSA-N	446.533	1.829	50	20	IDGD	
CCCNC(=O)[C@H]1CN(C(=O)C(=O)NNc2cnc3ccccc3n2)c2ccccc2O1	773722887	ONTOCHIZZWFUFL-GOSISDBHSA-N	434.456	1.393	50	20	IDGD	
Nc1nc(Cl)cc(NNC(=O)c2cn(CCOc3ccc(C=O)cc3Cl)nn2)n1	773867231	KHGIRAAGRZWDFF-UHFFFAOYSA-N	437.247	1.606	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)NC[C@H]1CC[C@@H](C(=O)N(C)C)O1	774664357	VKAFQMSINVTJAV-CABCVRRESA-N	431.518	1.698	50	20	IDGD	
CCc1nn(C)c(Cl)c1C(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776204060	AXMDYZOTSBOURK-UHFFFAOYSA-N	428.921	1.885	50	20	IDGD	
COc1ccc([C@]2(C)NC(=O)N(CC(=O)NNc3cccc(S(C)(=O)=O)c3)C2=O)cc1	776528023	QFXAIVREDKOHAP-FQEVSTJZSA-N	446.485	1.009	50	20	IDGD	
O=C(CN1CCN(c2nnc(C(F)(F)F)s2)CC1)NNC(=O)c1ccccc1Cl	776864517	JWLHOEGIBRPGEM-UHFFFAOYSA-N	448.858	1.794	50	20	IDGD	
Cc1nn(CC(F)(F)F)c(C)c1[C@H](C)C(=O)NNC(=O)CCN1C[C@H](C)O[C@@H](C)C1	778503041	JGAAQPKMFDZEEK-AVGNSLFASA-N	433.475	1.812	50	20	IDGD	
COc1cccc(NNC(=O)[C@@H](CCS(C)(=O)=O)NC(=O)c2ccc(Cl)cc2)n1	781024465	ZOKYTCRWFUKJDT-CQSZACIVSA-N	440.909	1.420	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NCc1ccccc1CN1CC[C@@H](O)C1	781954845	OGGSDEQQYYZSKY-DNVCBOLYSA-N	430.480	1.690	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2c(C)cc(C)c(CC(=O)O)c2C)cc1OC	782249166	JKHGXYMVUIRUPI-UHFFFAOYSA-N	436.486	1.879	50	20	IDGD	
CC(C)(C)c1ccc(S(=O)(=O)N2CCN(S(=O)(=O)CBr)CC2)cc1	782401486	FUXZRWSOXFEFQH-UHFFFAOYSA-N	439.397	1.973	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNc2ncnc3ccsc23)cccc1C(=O)N1CCOCC1	783261756	JHUWGHSTJAGOOP-UHFFFAOYSA-N	440.485	1.554	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)Nc2ccccc2C)cc1N1CCOC1=O	783416184	PGFFRCZRZGGFDG-UHFFFAOYSA-N	427.417	1.752	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1ccc(Cl)c(C(F)(F)F)c1	784004793	KIMZGIRIWGIDAX-UHFFFAOYSA-N	448.810	1.936	50	20	IDGD	
CS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNc2cccc([N+](=O)[O-])c2)cc1Cl	784829632	VHRHATJMJCZZPP-UHFFFAOYSA-N	427.826	1.702	50	20	IDGD	
C[C@@H](c1cccc(NC(=O)C(=O)NNc2ccc(C(F)(F)F)nn2)c1)N1CCOCC1	784886335	OOYVWIMHINMKDO-LBPRGKRZSA-N	438.410	1.970	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NN=C1C(=O)Nc2ccc(Br)c(Cl)c21	788020071	IZBVNLHELOJXIF-UHFFFAOYSA-N	436.653	1.700	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)CNc1ccccc1C(N)=O	788265976	RAJHHDGQNSGZAR-NSHDSACASA-N	435.278	1.575	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1cccc2c1OCC[C@H]2OC	790963155	BAMHBTHXGNYMES-CQSZACIVSA-N	449.485	1.651	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cc3nccnc3cc2F)cc1	792017357	HNTJAYKVRZQTRR-UHFFFAOYSA-N	431.449	1.159	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3cc(Cn4cccn4)on3)n[nH]2)cc1OC	794393928	VATNZZSFARIDFT-UHFFFAOYSA-N	437.416	1.402	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)Cn1nc(-c2ccccc2)ccc1=O	795159919	AKLBRZHIKBBZLP-UHFFFAOYSA-N	427.486	1.304	50	20	IDGD	
CCCn1nc(C(=O)NNS(=O)(=O)c2cccc(OCC)c2)c2ccccc2c1=O	799914482	PNTHNKGPSYSDRN-UHFFFAOYSA-N	430.486	1.829	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(CCC(=O)NNC(=O)Nc2ccc3c(c2)OCO3)CC1	802103190	NVDXXDDILVBSMJ-UHFFFAOYSA-N	435.481	1.511	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(OC(F)F)cc2F)cc1OC	802565820	LZZJPCBHFPHGOY-UHFFFAOYSA-N	427.335	1.844	50	20	IDGD	
O=C(CNS(=O)(=O)c1c[nH]c2ncccc12)NNc1ccc(F)cc1Br	802826035	SFYPWFCUWYBREY-UHFFFAOYSA-N	442.270	1.886	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)CN(C)c1cc(Br)ccc1[N+](=O)[O-]	803723902	QSKNPIXKVUSHPM-SECBINFHSA-N	431.243	1.283	50	20	IDGD	
O=C(NNC(=O)[C@H]1COCCO1)C(=O)Nc1nc(CC23CC4CC(CC(C4)C2)C3)cs1	806979736	DEZWTTZCSZNKAJ-JISUQADQSA-N	448.545	1.403	50	20	IDGD	
O=C(CCCc1cccs1)NNC(=O)C(=O)Nc1ccc(F)c(N2CCCNC2=O)c1	806980199	RCNNDKBQCBHJER-UHFFFAOYSA-N	447.492	1.916	50	20	IDGD	
CN(C)c1c(C=NNC(=O)NCc2cccc(C(F)(F)F)c2)c(=O)n(C)c(=O)n1C	807966325	YRZNSTSQZKHWNT-UHFFFAOYSA-N	426.399	1.002	50	20	IDGD	
COCCOCc1ccc(C=NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cc1	807976893	VZCWOKPYOZISJM-UHFFFAOYSA-N	438.528	1.758	50	20	IDGD	
O=C(NNC(=O)c1ccc(COc2ccccc2)o1)C(=O)Nc1ccc2c(c1)C(=O)OC2	808934560	LBDYNHWOBFSICE-UHFFFAOYSA-N	435.392	1.929	50	20	IDGD	
CN(C)S(=O)(=O)CCNC(=O)NNc1ccc(-c2cccc(C(F)(F)F)c2)nn1	811977758	QUMUBAULMKLOAE-UHFFFAOYSA-N	432.428	1.680	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)Nc1cccc(N2C(=O)CNC2=O)c1	813837006	AXVYIYIRDJBSKR-UHFFFAOYSA-N	432.462	1.142	50	20	IDGD	
COc1cccc(C(=O)NNS(=O)(=O)CCCCN2C(=O)c3ccccc3C2=O)c1O	814210324	CVQCFXRYPUMQRY-UHFFFAOYSA-N	447.469	1.041	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(N(C(C)=O)C3CC3)cc2)cc1	815565721	XQDVWZOWEJUZLB-UHFFFAOYSA-N	440.456	1.375	50	20	IDGD	
C[C@H]1CCCCN1CC(=O)Nc1ccc(F)c(NC(=O)C(=O)NNc2ncncc2F)c1	815765002	BWXRAZNEPISCCJ-LBPRGKRZSA-N	447.446	1.650	50	20	IDGD	
CC(C)NS(=O)(=O)c1cc(C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)ccc1F	914709739	WMNSHMLBCZPECY-INIZCTEOSA-N	437.449	1.113	50	20	IDGD	
CNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2ccccc2OCc2ccc(F)cc2)o1	915059516	AVIKDPFAYSYSLJ-UHFFFAOYSA-N	447.444	1.981	50	20	IDGD	
Cc1cc(C)n(-c2ccc(C(=O)OCC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)cn2)n1	915421651	WFXDHDLLHKXKRP-UHFFFAOYSA-N	438.400	1.410	50	20	IDGD	
COc1ccc(OC)c(CNC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c1	916261360	DEWWIOWRVDATBL-UHFFFAOYSA-N	441.532	1.747	50	20	IDGD	
CCOC(=O)N[C@H](CNC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)CC(C)C	916631181	LJAWYHRTLWZBMK-AWEZNQCLSA-N	428.511	1.195	50	20	IDGD	
Cc1cc(Br)ccc1C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	917319552	HYDZLUIROKYCLK-INIZCTEOSA-N	449.257	1.902	50	20	IDGD	
NC(=O)[C@@H]1CC(C(=O)NNC(=O)c2cc3ccccc3cc2O)=NN1c1ccc(F)cc1	918781298	PYMDPOYFVSPHAH-SFHVURJKSA-N	435.415	1.566	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1cc(F)cc([N+](=O)[O-])c1N	919508040	XXCYWYYHOADQQT-UHFFFAOYSA-N	440.771	1.596	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=O)CCc2ccc(OC)cc2)n(C)c1	919836410	NCAAAWHBRQORJU-UHFFFAOYSA-N	436.534	1.458	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(CNC(=O)NNC(=O)Cc2ccccc2OC)cc1	919898847	OLDATCDOWVCWGI-UHFFFAOYSA-N	448.545	1.799	50	20	IDGD	
COCCOCCC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	920340031	HYONUBYLYVRABW-UHFFFAOYSA-N	427.504	1.363	50	20	IDGD	
COc1cc(N2C[C@H](C(=O)NNC(=O)NCc3ccco3)CC2=O)cc(OC)c1OC	920857704	NCHMCODTLWZZFF-GFCCVEGCSA-N	432.433	1.189	50	20	IDGD	
O=C(Cn1nc2n(c1=O)CCCCC2)NNC(=O)c1ccc(COc2ccccc2)o1	1317786428	NVUWMCPYXXGWMW-UHFFFAOYSA-N	425.445	1.404	50	20	IDGD	
COC(=O)C(=O)NNC(=O)NCCc1ccc(OCC(=O)Nc2cccc(C)c2)cc1	1318941616	LXDOBEOWEAHSFV-UHFFFAOYSA-N	428.445	1.058	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)COc1ccc(Br)cc1)C(=O)NCC(F)(F)F	1325422857	LGRCPALVNLYSNX-QMMMGPOBSA-N	441.204	1.225	50	20	IDGD	
C[C@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1)n1ccnc1	1337863159	XFGPCQISTJVLNF-OAHLLOKOSA-N	427.486	1.384	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCc2cc(OCC(F)F)ccn2)nc1	1341965396	RYSLMUNXIDXZAI-UHFFFAOYSA-N	444.464	1.634	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](C)Nc3ccccn3)C2)C1	1779323684	QAPPMKXHFVVFLO-ZRGWGRIASA-N	439.354	1.743	50	20	IDGD	
CCOc1ncc(Cl)cc1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1779679989	GTZWEJNAAVAXEY-KBXCAEBGSA-N	432.304	1.177	50	20	IDGD	
O=C(c1cc2ccoc2cn1)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781334559	YOUQLDGKDQCFEK-RHSMWYFYSA-N	426.242	1.962	50	20	IDGD	
C[C@@H](O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)C2	1781995257	AIHODKGQCCCVQY-IYKZQOMLSA-N	433.455	1.766	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)Nc1nccs1)C2	1782172839	NKNFHRHAXZPKFZ-NXEZDXNNSA-N	444.985	1.711	50	20	IDGD	
O=C(CC1Cc2ccccc2C1)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2	1783303682	NQVDOOJNQHIAHG-TXTKFYIRSA-N	434.964	1.905	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@](C)(O)C(F)(F)F)CCO2	1783343453	NCNBODYGBCXROC-GDLCADMTSA-N	431.249	1.303	50	20	IDGD	
COc1cccc(CC(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](C)Br)C3)C2)c1	1783532521	JMKATWMCXDCSKV-AUUYWEPGSA-N	425.323	1.851	50	20	IDGD	
CC(=O)Nc1cc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](C)Br)C3)C2)ccn1	1783535038	WAOMRVICTLJHKY-SGTLLEGYSA-N	439.310	1.267	50	20	IDGD	
CCc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]3C2)n[nH]1	1783965880	WIFPSYINSQALIS-DSPQJCBJSA-N	427.343	1.596	50	20	IDGD	
COc1cc(F)cc(/C=C/C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]3C2)c1	1784094510	OTVQTDZWKBVEHJ-KQOGDJKHSA-N	440.899	1.427	50	20	IDGD	
COc1ccc(COCC(=O)N2CC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)cc1	1784099065	ZOZNYJFXTJUATC-IBGZPJMESA-N	431.316	1.845	50	20	IDGD	
Cc1ccc2[nH]cc(CC(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)[C@@H](O)CCl)C[C@@H]43)c2c1	1785179669	XQVGAQBLCALHIB-HSCHXYMDSA-N	433.936	1.598	50	20	IDGD	
O=C(CCc1ncc[nH]1)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1	1788143869	ZZRNXTMMWFWFLV-UHFFFAOYSA-N	432.289	1.470	50	20	IDGD	
Cn1ccc(CC(=O)Nc2ccc(C3(NC(=O)c4ccc(B(O)O)cc4)CCC3)cc2)n1	1788216375	ZJHQSJZIDGARSO-UHFFFAOYSA-N	432.289	1.090	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C=N/N3CCCCC3)[C@H]2C1	1788602242	SCZONJMYVKXIIR-CKCGSTQVSA-N	443.386	1.469	50	20	IDGD	
CNC(=O)CC(=O)NC1(c2ccc(NC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)cc2)CCC1	1788643792	BYGVCKGFJMETMP-MZJWZYIUSA-N	438.488	1.391	50	20	IDGD	
COc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)Br)C[C@@H]32)ccn1	1788908990	IWOSNZQEBPAEJJ-UNQGMJICSA-N	426.311	1.467	50	20	IDGD	
C[Si](C)(C)OCC(=O)Nc1ccc(C2(NC(=O)CN3CC(=O)NC3=O)CCC2)cc1	1789647735	VAWFWFJUIUSFDF-UHFFFAOYSA-N	432.553	1.524	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(NC(C)=O)c(O)c3)[C@H]2C1	1790306246	KCTNFKXRVHVMGK-FPXQBCRKSA-N	437.924	1.961	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3noc4ccccc34)C[C@@H]21	1791253673	FLBVDPUZMDQEPV-FJXLLPKBSA-N	435.908	1.604	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccccc3Cl)C[C@@H]21	1791290668	ITYXGVPKQSPCGC-ZVZYQTTQSA-N	436.940	1.306	50	20	IDGD	
CC(C)N(C)CC(=O)Nc1ccc(C2(NC(=O)c3cnccc3C(=O)NN)CCC2)cc1	1792001318	PACAMQNTNLACBP-UHFFFAOYSA-N	438.532	1.773	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H]1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCl	1793107686	UWGTXKQEZFGQNP-DBWAAGBOSA-N	443.972	1.918	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(-n3ccnc3)ccn1)C2	1793448553	FLWZFSWBPPWXKJ-LORHWOILSA-N	431.924	1.878	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1CCc2nc(O)nc(O)c2C1)C(Cl)Cl	1794385335	HBMINSZLRHUCOA-MMWGEVLESA-N	429.304	1.435	50	20	IDGD	
O=C(CCc1c[nH]c2ccccc12)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1	1796189158	DVOMDKASLABIKE-WKCHPHFGSA-N	445.328	1.732	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CC(=O)Nc1ccc(F)cc1	1799035874	XLKWPFXCYNREEL-AODNKKSCSA-N	425.888	1.761	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCN1C(=O)c3ccccc3C1=O)C2	1799263673	RZZPKJXIXPTDMT-QOIYZWAUSA-N	447.919	1.280	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nc3ccccc3n(C)c1=O)C2	1799267891	HPQUHAPWTUGQER-LOUJCGABSA-N	432.908	1.154	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc3ncccn13)C2	1799275123	LAOLDPWZSCGLGV-JPVZDGGYSA-N	426.304	1.169	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc(F)c(F)c1)C2)[C@@H](F)Br	1799346173	GZOKOPCIEXQRQT-OXUXUCFPSA-N	435.240	1.787	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2)c1cc(F)cc([N+](=O)[O-])c1	1799628320	FWEUFMCHELRJJZ-DRXBFXEBSA-N	444.257	1.722	50	20	IDGD	
CCOc1cccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CCC(=O)NN(C)C)C3)c1O	1800694337	LXOWGZMRCXZNTR-MUJYYYPQSA-N	432.521	1.416	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(C(F)(F)F)nc1)C2	1800975678	QSPSEIDMQYQYDV-XFMPKHEZSA-N	435.830	1.557	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cn3ccc(Cl)cc3n1)C2	1802335938	BNKASRIBPCVPOF-MUJYYYPQSA-N	446.939	1.613	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)[C@@H]2C[C@@H]2C2CC2)[C@@H]1c1cccnc1	1802989165	OGGHDAJSBYMRQL-VELGLUOQSA-N	448.527	1.446	50	20	IDGD	
C[C@H](CC(N)=O)C(=O)NC[C@@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1	1803663378	FLMZJTDXXHLJPR-IFIJOSMWSA-N	425.327	1.384	50	20	IDGD	
Cn1ncnc1C(=O)NC[C@@H]1CCN(C(=O)[C@](C)(Cl)CCl)[C@H]1c1cccnc1	1805279079	IUMOVYGRLHCZJM-SUNYJGFJSA-N	425.320	1.766	50	20	IDGD	
C[C@H](NC(=O)c1ccccn1)C(=O)N1CCC2(CCCN(C(=O)[C@@H](O)CCl)C2)CC1	1805525656	CSYVPWPXYMJSKV-RDJZCZTQSA-N	436.940	1.031	50	20	IDGD	
O=C(CCBr)NC[C@@H]1CCN(C(=O)Cn2ccccc2=O)[C@@H]1c1cccnc1	1806340248	ASABJFKFGKLEQN-OXJNMPFZSA-N	447.333	1.734	50	20	IDGD	
Cc1nc(CC(=O)N2CC[C@H](CNC(=O)[C@@H](F)Br)[C@@H]2c2cccnc2)no1	1808650659	BUWVZPITLILNNS-UHOFOFEASA-N	440.273	1.712	50	20	IDGD	
N=C(N)SCCC(=O)N1CC[C@H](CNC(=O)[C@@H](F)Br)[C@@H]1c1cccnc1	1808661884	SILMAAPSZNCEGX-KWCYVHTRSA-N	446.346	1.795	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC2(CCCN(C(=O)CN3CCNC3=N)C2)CC1	1809751712	WZJUVYJQFYKGPU-AWEZNQCLSA-N	428.375	1.231	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)C3CCC(CO)CC3)CC2)C1	1809974857	BTMWPTIDEIIXRX-UHFFFAOYSA-N	442.365	1.010	50	20	IDGD	
O=C(c1cnc(O)nc1O)N1CCCC2(CCN(C(=O)[C@H](F)Br)CC2)C1	1810870130	NHCHQUXOYPLGDH-NSHDSACASA-N	431.262	1.423	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1)c1c[nH]c(=O)cn1	1811452189	NJHMGJSGIBILLS-GUYCJALGSA-N	434.294	1.270	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1ccccc1	1811664503	WCUYOBARKLAAJA-UNMCSNQZSA-N	429.285	1.395	50	20	IDGD	
COc1cc(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)ccc1O	1811940956	VSVNYCAIHKBKOV-IEZWGBDMSA-N	433.892	1.715	50	20	IDGD	
CCC(=O)N[C@H](C)C(=O)N1CC[C@H](CNC(=O)[C@H](C)Br)[C@H]1c1cccnc1	1812863809	CYCOOOIWEHZZGW-TZDHZFECSA-N	439.354	1.786	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)[C@H]2CCNC(=O)C2)[C@@H]1c1cccnc1	1812868066	RPRUHLVKMPVLQD-GZIXRCOHSA-N	437.338	1.397	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)[C@@H]2CCNC(=O)C2)[C@H]1c1cccnc1	1812868073	RPRUHLVKMPVLQD-YXPYIKCWSA-N	437.338	1.397	50	20	IDGD	
Cc1cccnc1C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1	1815337224	OYVCYVSKHPOKII-OAHLLOKOSA-N	436.302	1.066	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)C(C)(C)NCCC#N)n[nH]1	1817319842	MTRADLQPCKKYMO-INIZCTEOSA-N	446.556	1.057	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(O)cc2)[nH]n1)c1ccc(B(O)O)cc1	1817472790	YCGMVMWEGFSIJH-IBGZPJMESA-N	434.261	1.415	50	20	IDGD	
CCc1cc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)no1	1817477065	YAQVFDQUHMPUNR-GOSISDBHSA-N	437.265	1.260	50	20	IDGD	
Cc1nnsc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1	1818256867	LFGBEAYCEPSQTO-CYBMUJFWSA-N	434.526	1.249	50	20	IDGD	
Cc1occc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819402062	LFQZXXBQDYOYJE-QGZVFWFLSA-N	437.460	1.929	50	20	IDGD	
C[C@](O)(CC(=O)O)CC(=O)N[C@@H]1CCc2nc(NC(=O)CO[Si](C)(C)C)sc2C1	1820169619	ZUIIYZUIJVSSJM-ADLMAVQZSA-N	443.598	1.522	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@H](O)CCl)CC2)c1cc2ncsc2[nH]1	1820217170	QVYNQUNGKSOKMF-RDDDGLTNSA-N	425.923	1.906	50	20	IDGD	
COc1ccnc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)[C@@H](O)CCl)[nH]n2)c1OC	1820385938	HCNHCKYSCIOXBH-STQMWFEESA-N	437.884	1.728	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)c3ncccc3F)sc2C1	1820925555	AQYIBKSNQLGJCK-NSHDSACASA-N	434.497	1.276	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)Cn2ccncc2=O)[nH]n1)[C@H](F)Br	1820938150	ZNZODUOHPIVYQT-NHYWBVRUSA-N	441.261	1.349	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnn3c2OCCC3)n[nH]1	1821434938	XAWPTZJFXRWXIT-DZGCQCFKSA-N	436.900	1.948	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cncc(O)c2)[nH]n1	1822416540	HBOXNCIYQKDVDJ-INIZCTEOSA-N	429.481	1.189	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)[C@@H]1CCCS1	1823010396	YQBVAMKPWQLLDF-IRXDYDNUSA-N	428.323	1.291	50	20	IDGD	
CC[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)Cn1nccn1)CC2	1825451197	GQDPAXDLMHYCPV-VHSXEESVSA-N	427.328	1.520	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)c2ccsc2)CC1	1825795501	KJJJXDHDXQDYRN-HXUWFJFHSA-N	426.347	1.975	50	20	IDGD	
O=C(CCc1ccoc1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827054689	JJDDPVXQMMNTPY-QFIPXVFZSA-N	438.333	1.826	50	20	IDGD	
Cc1cc(C(=O)NCC(=O)N2CCCC[C@@H]2C2CCN(C(=O)[C@H](F)Cl)CC2)no1	1828986328	LQFLCHHLTBBFIN-WBVHZDCISA-N	428.892	1.867	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCCC[C@H]1C1CCN(C(=O)CN2CC(=O)NC2=O)CC1	1829097238	FFKXHSOWLXVJAM-INIZCTEOSA-N	438.601	1.009	50	20	IDGD	
O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(Cl)nc1)CCO2	1829505250	LKTRQTLKJYBHAZ-KRWDZBQOSA-N	446.729	1.590	50	20	IDGD	
O=C([C@H](F)Cl)N1CCC([C@H]2CCCCN2C(=O)c2cc(=O)nc3cccnn23)CC1	1829620907	WTUHZEBCFJDGCB-KDOFPFPSSA-N	435.887	1.857	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3ccc(C#N)cc3)CCO2)C1	1829635498	JOOYZSAJNDBMAF-UGKGYDQZSA-N	449.935	1.201	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cn3cc(Cl)cn3)C2)C1	1831647105	QABZGYXAVIRKSU-CRAIPNDOSA-N	433.336	1.400	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)C(=O)c3cccn3C)C2)C1	1831657909	CEOOLMUXVSAQRY-MGPUTAFESA-N	425.913	1.072	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)C(F)(F)Cl)CC1	1832017925	XKQDYUUUNXLOCM-MRXNPFEDSA-N	428.672	1.431	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnn(-c4cccnc4)c3)CCO2)C1	1833621452	IUTZXDGYRTUUMY-WIYYLYMNSA-N	447.923	1.355	50	20	IDGD	
COc1nn(C)cc1C(=O)NC1CCN(C2CCN(C(=O)C(Cl)Cl)CC2)CC1	1834082867	CMTYUJCMOLZJMD-UHFFFAOYSA-N	432.352	1.418	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1)C1CCOCC1	1834546139	BTBFGIMVOVMJJV-INIZCTEOSA-N	434.350	1.675	50	20	IDGD	
N#Cc1ccc(F)c(C(=O)N2CCC(OC3CCN(C(=O)[C@H](O)CCl)CC3)CC2)c1	1836717761	IWPWBZZRJURHTN-LJQANCHMSA-N	437.899	1.909	50	20	IDGD	
N=C(N)SCC(=O)N1CCC(OC2CCN(C(=O)[C@H](F)Br)CC2)CC1	1837827754	AWEXSRRPOZNQRJ-ZDUSSCGKSA-N	439.351	1.302	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(Cl)ccn3)CCO2)C1	1837867369	OSIOPQMYRKHZMC-KDOFPFPSSA-N	432.304	1.059	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccnc(C)c3)CCO2)C1	1837941485	LHTMDONIMDGAMM-VQIMIIECSA-N	440.338	1.634	50	20	IDGD	
CC(C)CCC(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1	1838394699	ONSJZEMWDBTHGG-UHFFFAOYSA-N	445.564	1.734	50	20	IDGD	
COCc1c[nH]c(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)c1	1838519413	MKOLBILCTQSDKK-UGSOOPFHSA-N	444.326	1.015	50	20	IDGD	
COc1ncccc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2	1839151210	KVBJSPPDUNSYFU-RBUKOAKNSA-N	446.331	1.397	50	20	IDGD	
N#Cc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)cc1	1839202201	XOQOSPBJMVAUJQ-YJBOKZPZSA-N	440.269	1.319	50	20	IDGD	
CC(=O)Nc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)ccc1C	1839402958	SRRZQLFZPOLPLJ-PXNSSMCTSA-N	441.887	1.558	50	20	IDGD	
O=C(c1cccn2nccc12)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1839540580	LEQGCIMKTDUBBF-SFHVURJKSA-N	427.288	1.208	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(C)o3)C2)C1	1839962925	VLCUFWGUCZILML-KBXCAEBGSA-N	429.311	1.832	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(F)c(C)c3N)C2)C1	1840152145	YKGZJUHFOIKSHA-QRWLVFNGSA-N	443.903	1.040	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(Cl)cn3)C2)C1	1840153365	MADFOCODTWQJFF-KBXCAEBGSA-N	432.304	1.059	50	20	IDGD	
O=C(CSC1CCCC1)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840186273	FGEXJKDSOQXNPJ-KRWDZBQOSA-N	425.378	1.922	50	20	IDGD	
CC[C@H](C)CC(=O)N1CCCC12CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2	1841490757	URVNFXKPEAJWDC-SFHVURJKSA-N	429.565	1.972	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)C2(c3cccc(F)c3)CC2)C1	1841861812	VNHCRKVHICTELR-UHFFFAOYSA-N	437.475	1.373	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)Cc2cccc(F)c2)C1	1842706196	GNLXPKXBERYEAC-MFKUBSTISA-N	425.464	1.706	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC2(CCCN2C(=O)CNC(=O)c2cc(C)on2)C1	1844309870	HRCCSBNQKCARFO-LBPRGKRZSA-N	427.299	1.090	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)/C=C(/C)C(=O)O)C2	1844693598	XKTLJBZUTNUFIB-WQLSENKSSA-N	431.401	1.368	50	20	IDGD	
CS(=O)(=O)Cc1ccc(C(=O)N2CC3(CCCN3C(=O)[C@H](F)Br)C2)cn1	1845217150	HXTIZAZGHRHHHM-ZDUSSCGKSA-N	448.314	1.134	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)c1cn3cc(Cl)ccc3n1)C2	1846384877	UIFKDYFJVUDFPA-UHFFFAOYSA-N	432.912	1.178	50	20	IDGD	
C#CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)CO[Si](C)(C)C)C2	1847070259	VEBFHYPAYOFJBZ-INIZCTEOSA-N	437.613	1.958	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cccc(N2CCCNC(=O)C2)n1	1847865262	MBSXKTNBJXWRCS-NJAFHUGGSA-N	447.967	1.631	50	20	IDGD	
O=C(/C=C\c1c[nH]c2ccccc12)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cccc(B(O)O)c1	1848141623	RGARBYCFTLAULU-LHDJESEWSA-N	429.285	1.377	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1cccc(N2CCCC2=O)c1	14890539	ZAGIYMCZBIMYOH-UHFFFAOYSA-N	429.502	1.490	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)COc1ccccc1[N+](=O)[O-]	15314994	RWDRPTRJQHTNMS-UHFFFAOYSA-N	427.461	1.333	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2ccc(C(=O)NNC(=O)Cc3ccc(F)cc3)cc2)C[C@@H](C)O1	15528894	DISUHPAGOQWASB-GASCZTMLSA-N	449.504	1.627	50	20	IDGD	
O=C(COC(=O)COCc1nc2ccccc2s1)NNC(=O)c1ccc([N+](=O)[O-])cc1	18020416	QRCDMTFLBZKDDV-UHFFFAOYSA-N	444.425	1.726	50	20	IDGD	
COc1ccc(-c2n[nH]c(=S)n2CC(=O)NNC(=O)COc2ccc(F)cc2)cc1	18101703	ZGJPWSDAPZZRNQ-UHFFFAOYSA-N	431.449	1.982	50	20	IDGD	
CON(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)c1	20919298	JYLVOYQISUWOGP-HNNXBMFYSA-N	435.502	1.714	50	20	IDGD	
C[C@H](NC(=O)c1ccco1)C(=O)NNC(=O)c1ccc(CSc2nncn2C)cc1	21290891	JKHGFAJEHDHUDI-LBPRGKRZSA-N	428.474	1.280	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@H](C(=O)NNC(=O)[C@H]2COc3ccccc3O2)C(C)C)cc1	26692506	QTWDBHZIKQVKFT-MOPGFXCFSA-N	447.513	1.285	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C2CCN(S(=O)(=O)c3cn(C)c(C)n3)CC2)cc1	109583625	CBNVOOGYXHZWNS-UHFFFAOYSA-N	433.534	1.153	50	20	IDGD	
COc1ccc(CN2C[C@H](C(=O)NNC(=O)COc3cc(C)ccc3C)CC2=O)cc1	726521735	PNXLEVOGFOAGFR-GOSISDBHSA-N	425.485	1.887	50	20	IDGD	
O=C(NNC(=S)NCCc1ccc2c(c1)OCCO2)c1nn(-c2ccccc2)cc1O	726745148	YBMYJDOCVMMFBR-UHFFFAOYSA-N	439.497	1.701	50	20	IDGD	
C[C@@]1(NNC(=O)NCCc2ccc(I)s2)CCS(=O)(=O)C1	727034634	QPBHQJBARHEHJK-GFCCVEGCSA-N	443.332	1.276	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)N[C@@H](C)c2cccc(S(=O)(=O)N(C)C)c2)c1	727610878	WDBAMIPNBIKDIN-HNNXBMFYSA-N	434.518	1.716	50	20	IDGD	
Cc1csc(N2CCN(C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)CC2)n1	728960223	XCNQIVPECSELOG-UHFFFAOYSA-N	430.538	1.021	50	20	IDGD	
NS(=O)(=O)c1ccc(C(=O)NNC(=O)c2ccc(Br)cc2Cl)cc1	728985760	VBUSKDACMMESIY-UHFFFAOYSA-N	432.683	1.825	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)[C@H]2CC(=O)N(C[C@@H]3CCCN3CC)C2)cc1OC	729627777	UVQIBQNSGAGRFB-ROUUACIJSA-N	446.548	1.578	50	20	IDGD	
CCCCN1C(=O)CC[C@@H](C(=O)NNC(=O)Cc2cc[nH]n2)[C@H]1c1ccc(OC)cc1	730102459	DYBZSJRVLKQDOF-WIYYLYMNSA-N	427.505	1.888	50	20	IDGD	
CCN=c1nc(NCC)n2c(SCC(=O)NN=c3cc[nH]c4ccccc34)n[nH]c2n1	730288427	HPHMSWAYHRRWRA-UHFFFAOYSA-N	438.521	1.010	50	20	IDGD	
CC(=NNC(=O)[C@H]1CCS(=O)(=O)C1)c1ccc(S(=O)(=O)NCc2ccccc2)cc1	730576236	MVOWNLRQTLDDFO-SFHVURJKSA-N	449.554	1.440	50	20	IDGD	
C[C@H]1CCCCN1C(=O)CN1CCN(C(=O)NNC(=O)C(C)(C)c2ccccc2)CC1	731222059	MTSIXNZUHHRLIG-SFHVURJKSA-N	429.565	1.724	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)N1CCN([C@H](C)C(=O)Nc2cccc(F)c2)CC1	731500472	HFCQLEWKVQZIRB-OAHLLOKOSA-N	443.479	1.834	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)CNC(=O)N2CCc3ccccc3C2)cc1	731866296	KVMDZZJJWFTASF-INIZCTEOSA-N	440.500	1.768	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)c2oc3ccccc3c2CS(C)(=O)=O)C[C@@H](C)O1	732260111	AVWKVBFRUMJFEL-ZIAGYGMSSA-N	437.518	1.238	50	20	IDGD	
C[C@H](CSc1ccccc1)C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	732390763	GNEPUVRQGRFTMO-KDOFPFPSSA-N	430.482	1.945	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)NCCCNC(=O)c2ccc(F)cc2)cc1C	732468282	JULQIOXEGIRUCF-UHFFFAOYSA-N	429.452	1.532	50	20	IDGD	
CCOCCCn1c(NNC(=O)[C@]23CCC(=O)N2CCS3)nc2ccccc2c1=O	733268848	SKNNLGAKXVWIOI-HXUWFJFHSA-N	431.518	1.332	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@@]2(O)CCN(Cc3ccccc3)C2)cc(OC)c1OC	733884980	NBCPMBRGVIHSIZ-JOCHJYFZSA-N	429.473	1.110	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)N[C@@H]2CCC[C@@H](C(=O)N(C)C)C2)nc1	734223127	YFENSWVWNGHIJE-ZIAGYGMSSA-N	426.543	1.041	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)CN1C(=O)c2ccccc2C1=O	734251819	OFIQIJXMHIKRGK-UHFFFAOYSA-N	430.486	1.503	50	20	IDGD	
O=C(COc1ccccc1C=NNC(=O)c1csc(N2CCOCC2)n1)NCC1CC1	734746653	JVLQXYXIXFCVLL-UHFFFAOYSA-N	443.529	1.649	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)N[C@H]2CC(=O)N(CCN3CCOCC3)C2)c(C)n1CC(C)C	736153581	RFYXDEPRUCABDF-ZAAFRKLLSA-N	441.576	1.717	50	20	IDGD	
CC[C@@H](C)[C@H](NC(=O)N1CCCC1)C(=O)OCC(=O)NNC(=O)c1ccc(Cl)cc1	736837659	XXAKMVGFANOFIP-DYVFJYSZSA-N	438.912	1.864	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2CCCCN2Cc2ccccc2)c1	741144438	SBYMICHRVWRBFU-FQEVSTJZSA-N	444.557	1.753	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)[C@@H]2CCCN(C(=O)COc3ccccc3)C2)cc1	741207063	OHKXQUNJBTZTTB-GOSISDBHSA-N	436.468	1.402	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)[C@@H]1CCCN(C(=O)COc2ccccc2)C1	741285538	UBPOJBXNCMLSDS-MRXNPFEDSA-N	431.514	1.851	50	20	IDGD	
CCc1ccc(CC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1	741508137	CDAKZUYKFMSYTN-UHFFFAOYSA-N	431.514	1.274	50	20	IDGD	
Cc1ccc([C@H](C)C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)o1	742486955	GFBTZUGNFYMFAW-INIZCTEOSA-N	449.529	1.493	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NCc2cnn(Cc3ccccc3)c2)cc1	743553112	ZDWGIPNWCDYVLM-UHFFFAOYSA-N	442.501	1.871	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CN2CCN(C(=O)CCCc3ccccc3)CC2)c1	744393191	KTPBKLIBBYDKRD-UHFFFAOYSA-N	433.512	1.486	50	20	IDGD	
CC[C@H](C)NS(=O)(=O)c1ccc(C(=O)OCC(=O)NNC(=O)c2cccc(C)c2)cc1	744561287	OUZWQJLFRWXNFM-HNNXBMFYSA-N	447.513	1.690	50	20	IDGD	
O=C(NNC(=O)c1nccc2ccccc12)c1cccc(S(=O)(=O)N2CCOCC2)c1	745475707	JVEJPSBUMCMFNJ-UHFFFAOYSA-N	440.481	1.331	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)N[C@@H]2CC(=O)N(CCOc3ccccc3)C2)cc1	745848623	UQVQNQNSIIFRQT-QGZVFWFLSA-N	426.473	1.384	50	20	IDGD	
C[C@@H](OC[C@@H]1CCCO1)C(=O)NNc1ccc(S(=O)(=O)Nc2nccs2)cc1	747943495	ZEPIWVBHKADJAV-OCCSQVGLSA-N	426.520	1.971	50	20	IDGD	
C[C@H]1CCC[C@@H](C)N1C(=O)COc1ccc(C(=O)NNC(=O)C(=O)N2CCCC2)cc1	748246605	MLXUEELHQAHIDL-IYBDPMFKSA-N	430.505	1.238	50	20	IDGD	
O=C(NCCC(=O)N1CCN(c2ccccn2)CC1)NNC(=O)c1cc2c(s1)CCC2	748464567	FMUCTJOPYGKTFY-UHFFFAOYSA-N	442.545	1.315	50	20	IDGD	
Cc1oc(C(=O)NNc2ccccc2S(=O)(=O)NC(C)(C)C)cc1S(N)(=O)=O	748602697	PHGSFGJDBCJEQQ-UHFFFAOYSA-N	430.508	1.069	50	20	IDGD	
CNS(=O)(=O)C[C@@H]1CCCN1C(=O)CCC(=O)C(C#N)=C1N(C)c2ccccc2N1C	749519418	ZGTUEPSWVCOLNE-HNNXBMFYSA-N	445.545	1.197	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)[C@@H](C)N2CCSCC2)c2ccccc2c1=O	750810757	XLFSYMHDJVZRNE-OAHLLOKOSA-N	431.562	1.785	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)[C@H]1CC(=O)N(c2ccc3c(c2)CCC3)C1	751209258	MTNTUPXIKRVEKE-HNNXBMFYSA-N	426.498	1.167	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCO[C@]3(CCc4ccccc43)C2)cc1OC	753274616	KKZXDFLXABIGSX-HSZRJFAPSA-N	425.485	1.639	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2csc([C@@H]3CCCO3)n2)cc1	755397132	FWBDWSGBJXZWQK-HNNXBMFYSA-N	438.531	1.385	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)Nc1cccc(S(=O)(=O)NC2CC2)c1	755586170	SYMHQALWFMJGKE-UHFFFAOYSA-N	434.474	1.368	50	20	IDGD	
COC(=O)CCNC(=O)c1ccc(NC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1	755603246	JTBXUOXRPONNBA-UHFFFAOYSA-N	429.389	1.354	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)Nc2cccc(N3CCCS3(=O)=O)c2)cc1	755885828	QERSWBACNOKMKB-UHFFFAOYSA-N	429.458	1.330	50	20	IDGD	
Cc1cc(C(=O)N2CCCC2)ccc1NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	756274681	OLGUFBDKODAEDL-UHFFFAOYSA-N	448.483	1.944	50	20	IDGD	
CS(=O)(=O)CCOc1cccc(NC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c1	756297998	QEKSMLDXGLIZRL-UHFFFAOYSA-N	443.485	1.762	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCC[C@@H]2CN2C[C@H](C)O[C@@H](C)C2)cc1OC	756502371	SBADYQDYYSGAGR-XYJFISCASA-N	434.537	1.038	50	20	IDGD	
O=C(COC(=O)Cc1ccc([N+](=O)[O-])cc1Br)NNC(=O)c1cccs1	756524269	CFAAZCCPJPQYQS-UHFFFAOYSA-N	442.247	1.966	50	20	IDGD	
CS(=O)(=O)NCc1ccc(NC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1	756622996	AUENRNLKPCDYBX-UHFFFAOYSA-N	428.474	1.388	50	20	IDGD	
O=C(NNC(=O)c1cc(COc2c(Cl)cccc2Cl)on1)C(=O)N1CCCC1	758471671	HUJCOMXTABRSNZ-UHFFFAOYSA-N	427.244	1.944	50	20	IDGD	
C[C@@H]1Cc2ccccc2N1C(=O)[C@H]1CCCC[C@H]1C(=O)NNC(=O)C(=O)Nc1ccccn1	758835512	WSYHCQUKQOHABP-NXHRZFHOSA-N	449.511	1.952	50	20	IDGD	
O=C(CNC(=O)c1sc2ccccc2c1Cl)NNC(=O)C(=O)Nc1ccccn1	758906882	JFNBEPIMJSHJNC-UHFFFAOYSA-N	431.861	1.466	50	20	IDGD	
CCNS(=O)(=O)c1ccc(CC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1	759379710	LQAMJTSEDRPVLB-UHFFFAOYSA-N	427.486	1.174	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCCc2cccc([N+](=O)[O-])c2)cc1	759675728	QGRGGXYKQBWQBU-UHFFFAOYSA-N	449.489	1.097	50	20	IDGD	
CC(C)S(=O)(=O)c1ccc(CC(=O)NNC(=O)CCNC(=O)OC(C)(C)C)cc1	760438186	SECYNDDZJMOELA-UHFFFAOYSA-N	427.523	1.473	50	20	IDGD	
O=C(NNC(=O)c1ccnc(OC2CCC2)c1)c1cccc(S(=O)(=O)N2CCCC2)c1	761137014	DPLQPOQEUXUCKZ-UHFFFAOYSA-N	444.513	1.872	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1ccncc1Br	763139249	DWTQIXYICSZPOM-UHFFFAOYSA-N	426.296	1.520	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)C(=O)Nc1ccccc1F	763511807	HSYGVKLBBRDCAB-UHFFFAOYSA-N	434.449	1.010	50	20	IDGD	
CCN1CCN(c2ccc(Cl)cc2NC(=O)C(=O)NNC(=O)c2ccccc2O)CC1	763525335	AFQIWXRYIXESJB-UHFFFAOYSA-N	445.907	1.587	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)C(=O)Nc1ccc(F)c(Cl)c1	763532356	WZMKVYGMSOCPII-UHFFFAOYSA-N	447.898	1.777	50	20	IDGD	
O=C(NNC(=O)C1CC1)C(=O)Nc1ccc(N2C(=O)c3ccccc3C2=O)c(Cl)c1	763558471	QQVQHXJVVSPCJQ-UHFFFAOYSA-N	426.816	1.637	50	20	IDGD	
Cc1ccnc(-c2cccc(NC(=O)C(=O)NNC(=O)[C@@H]3COc4ccccc4O3)c2)n1	763571920	PNVKPTHTRQYYPA-SFHVURJKSA-N	433.424	1.378	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)cc1F	763605398	SAJHFEODLNKWJW-UHFFFAOYSA-N	425.376	1.402	50	20	IDGD	
COC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)cc1F	763614600	UHQWGAQBWMKXKJ-UHFFFAOYSA-N	440.391	1.794	50	20	IDGD	
CCOC(=O)c1ccsc1NC(=O)C(=O)NNC(=O)CN1CCCc2ccccc21	763727305	BYKJVJLLOMISNS-UHFFFAOYSA-N	430.486	1.464	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cccc(C(=O)NC3CC3)c2)c1C	763852240	GHHSDQCQJAVWKN-HNNXBMFYSA-N	438.484	1.749	50	20	IDGD	
CC[C@H](C)n1nc(NC(=O)C(=O)NNC(=O)c2cc(Br)cn2C)cc1C	764005328	YKNYLDUEBPHQMP-VIFPVBQESA-N	425.287	1.663	50	20	IDGD	
CCN1CCN(c2ccc(NC(=O)C(=O)NNC(=O)c3ccc(C)cc3O)c(C)c2)CC1	764109230	IQBZUHKHGUIAFI-UHFFFAOYSA-N	439.516	1.551	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccn(-c2cccc(F)c2C#N)n1	764133186	UUTZFQOZTWQZHM-UHFFFAOYSA-N	436.403	1.220	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)C(=O)Nc2ccc(NC(=O)C3CC3)cc2C(F)(F)F)cn1	764359324	RJXNVGPMAUZQGT-UHFFFAOYSA-N	438.366	1.187	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1)C(=O)Nc1ccn(-c2ccncc2)n1	764389114	XBMLQGFMLGTVOM-UHFFFAOYSA-N	434.391	1.196	50	20	IDGD	
CCCCOC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cncc(NC(C)=O)c2)cc1	764434323	VAPUPHFMEIMXLW-UHFFFAOYSA-N	441.444	1.397	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2OC)c1)N(C)C	764457713	MTIRNSRJMAGXBU-QGZVFWFLSA-N	434.518	1.597	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)[C@@H](C)S(=O)(=O)C1CCOCC1	764553096	QHHDRFYUHDRQSY-LSDHHAIUSA-N	434.514	1.737	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1cccc(C#N)c1)C(=O)NNC(=O)c1ccc(Cl)cc1Cl	764574316	QMMNGSMJQNVCSD-SNVBAGLBSA-N	441.296	1.993	50	20	IDGD	
COc1cc(OC)cc(C(=O)NCC(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)c1	765621918	ZSINADAGRWOJNQ-UHFFFAOYSA-N	441.419	1.424	50	20	IDGD	
CC(C)(C)n1cc(C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)cn1	766669765	SMLNNGBLUUOPBU-UHFFFAOYSA-N	432.956	1.870	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)CNC(=O)c1ccc(C(C)(C)C)cc1	767242333	PONUXSMGGZJFNW-UHFFFAOYSA-N	439.512	1.956	50	20	IDGD	
CCCS(=O)(=O)Nc1cccc(C(=O)OCC(=O)NNC(=O)Cc2ccccc2C)c1	767268044	AWYKGJALOZNPDX-UHFFFAOYSA-N	447.513	1.694	50	20	IDGD	
Cc1ccc(S(N)(=O)=O)c(C(=O)NNC(=O)c2cc(F)ccc2Br)c1	767416573	WAHOBJZBHLVJEG-UHFFFAOYSA-N	430.255	1.619	50	20	IDGD	
CC(C)(C)OC(=O)N1CCO[C@H](C(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)C1	767446160	XNTQTMOBSYJKGR-AWEZNQCLSA-N	441.868	1.280	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)c1ccc(N2C(=O)CCC2=O)c([N+](=O)[O-])c1	767488995	DRWSQJKWEGXMED-UHFFFAOYSA-N	446.803	1.985	50	20	IDGD	
C[C@@H]1CCCN(C(=O)C(=O)NNC(=O)c2nc(-c3ccccc3)n(-c3ccccc3)n2)C1	769675074	KGVMVEOZESMGSA-MRXNPFEDSA-N	432.484	1.954	50	20	IDGD	
C[C@H]1C[C@@H](NC(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)CCO1	770356478	WPVSTGGTVVYWBJ-KXBFYZLASA-N	435.488	1.900	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)Nc3ccncn3)c2)cc1	770760027	PONNZLVXFLMPGB-UHFFFAOYSA-N	442.457	1.753	50	20	IDGD	
CCc1ccc(S(=O)(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)cc1C(=O)O	771607658	PHEHKKAWRCABBB-UHFFFAOYSA-N	439.877	1.227	50	20	IDGD	
Cc1ccc(NC(=O)CSCC(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)cc1	772196731	PWSFJZAADMNWES-UHFFFAOYSA-N	448.932	1.784	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)[C@H]1CC=CC[C@@H]1C(=O)N1CCOCC1	772971225	YFTAMPVHRFHPQC-WBAXXEDZSA-N	435.908	1.696	50	20	IDGD	
COc1c([N+](=O)[O-])ccc(C=NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)c1O	773067366	FIRLIIXAJMURCA-UHFFFAOYSA-N	441.444	1.217	50	20	IDGD	
COCCOc1ccc(Br)cc1NC(=O)C(=O)NNc1nccc(OC)n1	773723887	ICKCTZXMEARVGI-UHFFFAOYSA-N	440.254	1.355	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)Nc3ccnn3[C@@H]3CCS(=O)(=O)C3)cc2C1	776053454	CRBSUIUZLCLOJA-DGCLKSJQSA-N	437.547	1.896	50	20	IDGD	
CCOC(=O)N1CCC[C@H]([C@@H](C)NCC(=O)NNC(=O)c2ccc(OC)c(OC)c2)C1	776823229	MMMIJKRCOARJRZ-ZBFHGGJFSA-N	436.509	1.311	50	20	IDGD	
COC(=O)[C@@](C)(NCC(=O)NNC(=O)c1cccs1)c1cccc(Br)c1	777615227	DCWLZOHZEGSMIC-KRWDZBQOSA-N	440.319	1.950	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)NCc1cc2c(cc1OC(F)F)OCO2	778699192	UNFXMTKICXTKNR-UHFFFAOYSA-N	432.380	1.372	50	20	IDGD	
O=C(NNc1ccc2ccccc2n1)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(F)cc1	780999297	LPBADMBQUNYMPA-QAPCUYQASA-N	430.461	1.641	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCC(C)(NC(=O)OC(C)(C)C)CC2)n1	781976213	NXOOOTPUDKSIEC-UHFFFAOYSA-N	425.555	1.521	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c(OC)c1	782117678	QYXZRLJVFDMREP-UHFFFAOYSA-N	437.412	1.067	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(OC3COC3)cc2)cc1OC	782121400	XKDAAAINYAYHHL-UHFFFAOYSA-N	429.429	1.271	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)Cc2ccn(C)n2)c1	782548213	AHQDXIWRTVEDFW-UHFFFAOYSA-N	443.485	1.233	50	20	IDGD	
COC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(NC(=O)NNC(=O)C(C)C)cc2)C1	782549994	MPOAETMDNJHWNF-ZDUSSCGKSA-N	426.495	1.069	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)C(=O)Nc1ccc(C(C)C)cc1	782898016	WIEZYMLFWYVYAO-UHFFFAOYSA-N	431.518	1.811	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2cccc(CN3CCC(C(N)=O)CC3)c2)cc1	783039378	ORJSZRZVMFYRDZ-UHFFFAOYSA-N	425.489	1.474	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2ccc(F)c(S(=O)(=O)NC(C)(C)C)c2)nc(C)n1	783326603	KHBHPRSMPVISIA-UHFFFAOYSA-N	438.485	1.391	50	20	IDGD	
CC(=O)Nc1cc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)ccc1F	784215391	HXUYRIVGZJIGSO-UHFFFAOYSA-N	449.464	1.307	50	20	IDGD	
NC(=O)CCOc1ccc(NC(=O)C(=O)NNc2ccc(F)cc2Br)cc1	784803155	BXVDOYJUAKKHGT-UHFFFAOYSA-N	439.241	1.924	50	20	IDGD	
Cc1ccc(F)c(NNC(=O)C(=O)Nc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1	784884938	MHJWVFQLWOCKDK-UHFFFAOYSA-N	436.465	1.237	50	20	IDGD	
CN(C1CC1)S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2cc(F)c(F)c(F)c2)cc1	785082586	DMKDHATXZZBEFC-UHFFFAOYSA-N	442.419	1.969	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2nccn(C)c2=O)n(-c2cccc(C(F)(F)F)c2)n1	785089542	BGOZNVFDHSJCSS-UHFFFAOYSA-N	435.366	1.375	50	20	IDGD	
Cn1cc(-c2ncccc2NC(=O)C(=O)NNC(=O)c2ccccc2Br)cn1	786414119	KBWFQCZYEUTBPM-UHFFFAOYSA-N	443.261	1.644	50	20	IDGD	
CCNC(=O)Nc1ccc(C)c(NC(=O)C(=O)NNC(=O)COc2ccccc2CC)c1	787541424	RTYOHUNISOZCCP-UHFFFAOYSA-N	441.488	1.864	50	20	IDGD	
O=C(NNC(=O)c1cc(O)ccc1[N+](=O)[O-])c1ccc(S(=O)(=O)N2CCCC2)cc1	788266600	YPVXHSBDYXETFJ-UHFFFAOYSA-N	434.430	1.160	50	20	IDGD	
C[C@@](O)(Cn1cc(C(F)(F)F)ccc1=O)C(=O)NNC(=O)NCCc1cccs1	792082844	AONBWRBKFCESJQ-MRXNPFEDSA-N	432.424	1.253	50	20	IDGD	
CCc1c(NC(=O)C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cnn1C(CC)CC	792269215	NZZKDWNGRSALAR-UHFFFAOYSA-N	439.480	1.182	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CCCN2C(=O)c3ccc(Br)cc3C2=O)n1	794078216	VYMGAZKFCKBYFH-UHFFFAOYSA-N	445.273	1.990	50	20	IDGD	
CCNC(=O)N(C)c1cccc(NC(=O)C(=O)NNC(=O)c2cc(OC)cc(OC)c2)c1	796990203	OQLDIUJJKIYXIR-UHFFFAOYSA-N	443.460	1.269	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(CC(=O)NNC(=S)NCCc2cccs2)cc1	798124616	CASXMPLPNPMOLN-UHFFFAOYSA-N	426.589	1.279	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2ccc(C)c(S(=O)(=O)N3CCOCC3)c2)cc1	802056318	JOEDVZZPWHGYMK-UHFFFAOYSA-N	448.501	1.491	50	20	IDGD	
NS(=O)(=O)c1cccc2c(C(=O)NNC(=O)Nc3ccc4c(c3)OCO4)nccc12	802106495	IATCVJDTXWRDGB-UHFFFAOYSA-N	429.414	1.077	50	20	IDGD	
COc1ccc(Cl)c(NC(=O)NNC(=O)Cn2cc(Br)c(O)nc2=O)c1	802110393	HDWDISLPFBIQSR-UHFFFAOYSA-N	446.645	1.226	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)CCn2c(S)nc3ccccc3c2=O)cc1	802117730	ADWBMYHYADIXHM-UHFFFAOYSA-N	426.502	1.994	50	20	IDGD	
COc1ccc([C@@]2(C)NC(=O)N(CC(=O)NNc3ccc4c(=O)[nH]ccc4c3)C2=O)cc1	803430874	PMKYIUYGOWUDLA-JOCHJYFZSA-N	435.440	1.447	50	20	IDGD	
Cc1c(C(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)nnn1Cc1ccncc1	803969153	FGZJQJGURRGYTI-UHFFFAOYSA-N	428.836	1.301	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCCn2cc(Br)cn2)cc(OC)c1OC	804866347	XKFZBDAKABAIOG-UHFFFAOYSA-N	442.270	1.316	50	20	IDGD	
CCCn1c(=O)nc(O)c2c(C(=O)NNc3ccc(-n4ccnc4)nn3)cc(C3CC3)nc21	804952866	XQUFSRJAIFPHNN-UHFFFAOYSA-N	447.459	1.517	50	20	IDGD	
COCCNC(=O)[C@@H](C)OC(=O)c1ccc(NC(=O)NNc2ncncc2Cl)cc1	806747090	YLKFOUHOCABJGB-LLVKDONJSA-N	436.856	1.587	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)C(=O)Nc2ccc(F)c(N3CCCNC3=O)c2)c1	806968772	PEOZWVCVTAXOKK-UHFFFAOYSA-N	429.408	1.614	50	20	IDGD	
CC(C)(C(=O)NNC(=O)Cc1cn2ccccc2n1)S(=O)(=O)c1ccc(Cl)cc1	806989075	WFVUREPPANSFPV-UHFFFAOYSA-N	434.905	1.930	50	20	IDGD	
CC[C@@H](C)N[C@H](CNC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)c1ccco1	807439987	JJRQOBDXAYHGLB-CZUORRHYSA-N	426.477	1.600	50	20	IDGD	
CC[C@@H]1[C@H](C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)CCN1C(=O)OC(C)(C)C	810348681	QXXHIYFZKUISRR-IAGOWNOFSA-N	446.552	1.876	50	20	IDGD	
O=C(CNS(=O)(=O)c1cccnc1)NNc1cc([N+](=O)[O-])ccc1Br	811497123	RWGAHWOYCRDVPR-UHFFFAOYSA-N	430.240	1.174	50	20	IDGD	
COC(=O)c1cn(-c2cccc(NC(=O)NNC(=O)c3cc(Br)c[nH]3)c2)nn1	812977090	BJGFYQIZYSUPOJ-UHFFFAOYSA-N	448.237	1.611	50	20	IDGD	
COc1ccc(NC(=O)NN=C(C)c2ccc(S(=O)(=O)NCCC(=O)O)cc2)cc1	814997490	QRHHGLOJYRCRII-UHFFFAOYSA-N	434.474	1.994	50	20	IDGD	
CN(NC(=O)c1ccnc(-c2ncc[nH]2)c1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	816087515	BHSCNFQLXHWXNR-UHFFFAOYSA-N	429.481	1.721	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CNc2ccccc2)cc1S(=O)(=O)NC(C)(C)C	823327919	OLEIZEBEYQYNPK-UHFFFAOYSA-N	434.518	1.645	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)c1cnn(-c2ccccc2F)c1C(F)(F)F	912505987	LIAZMVKLQYGPPD-VIFPVBQESA-N	434.371	1.226	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccccc1C(F)(F)F)NNC(=O)Cc1ccc(F)cc1	913156212	YLBZPGXPODJCJK-UHFFFAOYSA-N	433.383	1.513	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)c1cc(C(F)(F)F)ccc1Cl)C(=O)NNC(C)=O	913173038	DRPZPKXRSUUOPA-LLVKDONJSA-N	447.888	1.926	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)CN2C(=O)[C@@H]3[C@@H](C2=O)[C@H]2C=C[C@H]3C2)c(C)n1-c1ccccc1	913419369	NLLVEAMGMJCXPN-LRGYGIHKSA-N	432.480	1.662	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1cc(Cl)ccc1I	915279510	LYMFBSQYERMZGN-SSDOTTSWSA-N	442.662	1.140	50	20	IDGD	
Cn1ccnc1[C@](O)(CCNC(=O)NNC(=O)c1cc2c(s1)CCC2)C(F)(F)F	916379005	XJEDUNDFQLRQOA-MRXNPFEDSA-N	431.440	1.755	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)NCc2ccc(CN3C[C@H](C)O[C@@H](C)C3)cc2)n1	916385809	GTUBNTAZHALYFA-ROUUACIJSA-N	428.537	1.640	50	20	IDGD	
Cn1nc(C(C)(C)C)cc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	916726392	MVNLRMJRFWAKNT-UHFFFAOYSA-N	433.534	1.577	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)NCc2ccc(OCCOc3ccccc3)nc2)n1	918222552	XQEBWXDUPBMLFF-UHFFFAOYSA-N	438.488	1.883	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)N2CCN(CC(=O)N3CCc4ccccc43)CC2)cc(C#N)n1C	918597911	QOJNCNOJUMQWDW-BKUYFWCQSA-N	442.523	1.846	50	20	IDGD	
CNS(=O)(=O)c1ccc([C@@H](C)NC(=O)NNC(=O)c2ccc(OC)c(OC)c2)cc1	919779707	WBHPFKGFMCHHOY-GFCCVEGCSA-N	436.490	1.317	50	20	IDGD	
CC(C)(C)Cc1noc2nc(C3CC3)cc(C(=O)NNC(=O)N[C@@H]3CCS(=O)(=O)C3)c12	919884470	FVLIWVNNZUMTNC-GFCCVEGCSA-N	449.533	1.820	50	20	IDGD	
COc1cccc(C(=O)NNS(=O)(=O)c2cc(Br)ccc2[N+](=O)[O-])c1O	919958193	GOFCQFHCRMGMSH-UHFFFAOYSA-N	446.235	1.695	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)N[C@H]2CCCN(S(C)(=O)=O)C2)cc1OC	920239814	DKNNRARMFRWZRL-HNNXBMFYSA-N	442.538	1.242	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)CCNS(=O)(=O)c2cccc([N+](=O)[O-])c2)c2ccccc21	920340204	KWSSGLNYQWQMHC-UHFFFAOYSA-N	445.457	1.216	50	20	IDGD	
NC(=O)[C@@H]1CCCN1Cc1cccc(NC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c1	920929729	LRYSIGOIWLBVFP-KRWDZBQOSA-N	426.433	1.511	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCC[C@H]1CN1C[C@H](C)O[C@H](C)C1	921192855	COJONGHEEUVDHL-UXLLHSPISA-N	438.956	1.683	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CNS(=O)(=O)c2ccccc2C(F)(F)F)cc1	1115813467	TUBNBPSDWWHSOM-UHFFFAOYSA-N	431.392	1.454	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)c2cc3c(c(S(N)(=O)=O)c2)CCC3)cc1	1318660236	KFJWPGGVOZNRAM-CYBMUJFWSA-N	447.513	1.450	50	20	IDGD	
CN(C)c1ccc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)c2ccccc12	1777813466	FUBJMWMTZFZMOO-OFNKIYASSA-N	445.947	1.949	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccn(C(F)F)n3)C2)C1	1779618612	WVZSKZOIYWVJEW-BZNIZROVSA-N	435.269	1.895	50	20	IDGD	
COc1nc(C)ccc1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](C)CBr)CCO2	1779738090	IBKFJLGHTJHRCC-YJYMSZOUSA-N	440.338	1.873	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(C1)CN(C(=O)C(C)(F)F)CCO2	1780096876	JSIYJZYMMWKPLF-LJQANCHMSA-N	441.387	1.619	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H]3CCN3C(=O)OC(C)(C)C)C2)C1	1781014949	FBUFLCARGBZTQN-SXGZJXTBSA-N	445.944	1.080	50	20	IDGD	
C[C@H](NNc1ccccc1)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781326615	ZDAANVAMZKJQAL-JCKWVBRZSA-N	443.317	1.512	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cc(OC)nn3C)CCO2)C1	1783345054	WOELKBGYYIQWEE-YVEFUNNKSA-N	429.315	1.046	50	20	IDGD	
CC(C)[C@H]1CC[C@H](C(=O)N2CC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)CC1	1783370993	VWRZKUAZHCNUFT-JXQFQVJHSA-N	442.365	1.272	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)COc3cc(Cl)ccn3)CCO2)C1	1783533688	FOIMWZXRQJOKLN-SJKOYZFVSA-N	446.729	1.727	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCN3CCN(C)CC3)C[C@@H]21	1784615933	VHFVKQLNLSUVLT-OKYOBFRVSA-N	429.005	1.011	50	20	IDGD	
CN(CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]2C1)C(=O)c1ccccc1	1787443614	OEYKJDOMBXCMID-OVWQWFNUSA-N	425.888	1.273	50	20	IDGD	
Cn1ncc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CO[Si](C)(C)C)C[C@@H]32)c1Cl	1789082953	UQFXGDJCANOMFV-QEJZJMRPSA-N	428.993	1.518	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(Cl)nn3)C[C@@H]21	1789870761	UNVNNXFMSYNUMA-NDBFUVGKSA-N	435.739	1.960	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3ccc(F)c(C#N)c3)[C@H]2C1	1789907180	AHAGEWQDRKKAON-RMRDIRSESA-N	437.899	1.473	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3COc4ccccc4O3)C[C@@H]21	1791252558	MQXOJRZJTGRFAR-IJCKYZCQSA-N	438.908	1.060	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4cnccc4n3)C[C@@H]21	1791254300	NPQNYLMAHTZQAC-FPXQBCRKSA-N	432.908	1.477	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)NC(=O)OC(C)(C)C	1792761923	MYZCGIUNPXEWSN-YHQUGGNUSA-N	448.358	1.273	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3c(Cl)cncc3s1)C2)[C@@H](O)CCl	1792977041	PSFYWDWBSGPOJR-SKILGCBUSA-N	444.340	1.753	50	20	IDGD	
CC(=O)N[C@@H](C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1794144228	ZFGPHECEPYLJDH-SLZITWOASA-N	444.960	1.281	50	20	IDGD	
Cc1nc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)CBr)C3)ccc1F	1794353429	WCANMLCNPXFYGT-VFFTVRQLSA-N	428.302	1.763	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccnc(C(F)(F)F)c1	1794545939	HZHNRLNTTOYDQW-XFMPKHEZSA-N	435.830	1.557	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CNc1ccc(F)cc1	1795989933	ZAAUEKUAJHQNNL-BJWYYQGGSA-N	440.479	1.188	50	20	IDGD	
O=C(Cc1cccc2ncccc12)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1	1796189971	OQEOVKGFZXTPBA-WKCHPHFGSA-N	443.312	1.409	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)c1scnc1C1CC1	1796190787	MABNRHHPYVBOFI-BJWYYQGGSA-N	425.319	1.266	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](O)[C@@H](C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](F)Cl)C1	1796809437	MPMGDRAORRTJOL-PLZKBRGSSA-N	447.935	1.777	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2nccn2c1	1797081254	RUCOMSQWZFSSSL-QHHYFVSCSA-N	425.316	1.774	50	20	IDGD	
C[C@H]1CCc2c(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)c3cnccc3C(=O)NN)C4)n[nH]c21	1797492449	GZPWHPMVVUXHMJ-FQUUOJAGSA-N	437.504	1.024	50	20	IDGD	
C/C=C(/C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O	1798522961	JCHPJNIRMSSRFF-SRQBAGKHSA-N	431.445	1.690	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1(F)CN(C(=O)OC(C)(C)C)C1)C2	1799273461	HISUTJQPQNMEGJ-XGUBFFRZSA-N	447.935	1.552	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](CN)c1ccccc1)C2	1799274774	HVKPBUKXOMFEKF-JZBZHOAESA-N	428.360	1.555	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2c(c1)C(=O)CC2	1799960573	QLVRRFRLGFTQOF-ZKRNXSKHSA-N	435.318	1.802	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2ccoc2cn1	1800870039	UNPJTTLRWZWXJN-QDMKHBRRSA-N	434.456	1.392	50	20	IDGD	
C[C@@H](Cc1ccc(F)cc1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(B(O)O)cc1)C2	1801490940	FPKADBACCGNNIV-RWXMBLCBSA-N	438.308	1.636	50	20	IDGD	
O=C1C[C@@H](C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](Br)Cc2ccccc2)C3)CN1	1801678849	IWSUVERGOXPDBH-UYTYNIKBSA-N	448.361	1.767	50	20	IDGD	
COC(=O)CCCCCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnccc1C(=O)NN)C2	1802456085	KHVSASIMWUPVPU-MUJYYYPQSA-N	445.520	1.060	50	20	IDGD	
COc1cccc(CC(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)c1	1803138195	HHVIIIFDZCQWBF-SLYNCCJLSA-N	431.920	1.938	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cc(O)nc(Cl)c2)[C@@H]1c1cccnc1)[C@H](O)CCl	1803142498	XOHVGBIQQCYPFT-DXCKQFNASA-N	439.299	1.755	50	20	IDGD	
Cc1cccc(F)c1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnccc1C(=O)NN)C2	1803500660	JPMKVHJAWFFZKO-QDMKHBRRSA-N	425.464	1.698	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)COc2cccnc2)[C@H]1c1cccnc1	1804338203	CIECKAJAAQPSJH-XKGZKEIXSA-N	432.908	1.815	50	20	IDGD	
O=C(CSc1ccncc1)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1	1804351029	NGFPTDZYXBRZPQ-VDZJLULYSA-N	434.949	1.874	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2nccnc2OC)[C@@H]1c1cccnc1	1804979810	CPGSWJZQGXHBEL-ZOBUZTSGSA-N	433.896	1.454	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC2(CCN(C(=O)C[C@](C)(O)CC(=O)O)CC2)C1	1805389264	KROCGFAIKZHCNA-KSSFIOAISA-N	447.370	1.864	50	20	IDGD	
Cc1ccsc1C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1805397599	ULIPAFRXYSGKSV-ICSRJNTNSA-N	449.341	1.765	50	20	IDGD	
C[C@H](CS(C)(=O)=O)C(=O)N1CCCC2(CCN(C(=O)CCBr)CC2)C1	1806040928	DPBAIMXGAPHEJG-CQSZACIVSA-N	437.400	1.683	50	20	IDGD	
CC(=O)N1CC[C@H](CNC(=O)CN(C)NC(=O)NCc2ccccc2)[C@@H]1c1cccnc1	1807453104	NCQFBNFLVHKMIK-IRLDBZIGSA-N	438.532	1.454	50	20	IDGD	
N=C(N)SCCC(=O)N1CC[C@H](CNC(=O)[C@H](F)Br)[C@@H]1c1cccnc1	1808661886	SILMAAPSZNCEGX-XBFCOCLRSA-N	446.346	1.795	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)C2=CCCC2)[C@H]1c1cccnc1	1810299048	NHUDNIBASOTWKQ-PXNSSMCTSA-N	434.500	1.510	50	20	IDGD	
Cc1cc(C(=O)NC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)ccn1	1810789614	BFBUDXJVZTWBNY-SIKLNZKXSA-N	438.532	1.478	50	20	IDGD	
CSCC[C@H](O)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)Br)[C@H]1c1cccnc1	1813095715	OCIAUTQNNBKCBO-OEAJRASXSA-N	444.395	1.985	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@H](CNC(=O)CSc2nc[nH]n2)[C@H]1c1cccnc1	1813346232	CKVVGIGWYXWATK-MAUKXSAKSA-N	448.625	1.849	50	20	IDGD	
O=C(CCc1ccc[nH]1)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1	1815339891	SELFFXLZMVZYFP-INIZCTEOSA-N	438.318	1.010	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1	1815349951	AFUARPSTSSVWLZ-KBPBESRZSA-N	435.742	1.456	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CN2CCNC2=N)n[nH]1	1817292318	SFDZMAWSTQRYCG-AAEUAGOBSA-N	440.346	1.273	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ncon2)[nH]n1	1818112910	VACWNQWSLOVOMW-YTRQYYDFSA-N	439.436	1.233	50	20	IDGD	
C[C@H](Br)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2CCNC(=O)C2)[nH]n1	1822191245	DYHKYFWFSRKYKH-LOWVWBTDSA-N	426.315	1.711	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCS(C)(=O)=O)n[nH]1	1822967584	RRTFRITYLDPYBT-DGCLKSJQSA-N	449.371	1.868	50	20	IDGD	
COCCn1nccc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)CC1	1824183550	YYCIPGABVMTSRZ-WMZOPIPTSA-N	426.945	1.363	50	20	IDGD	
COC(=O)C12CC(C(=O)N3CCC([C@H]4CCCCN4C(=O)[C@H](O)CCl)CC3)(C1)C2	1824184701	CUFAWUAHSIARQP-AJHHTPGJSA-N	426.941	1.549	50	20	IDGD	
O=C(N[C@@H]1CCc2nc(NC(=O)[C@H]3CCCS3(=O)=O)sc2C1)C(Cl)Cl	1824940565	XYFPKESZZHIDIJ-GMSGAONNSA-N	426.347	1.436	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)C[C@H](NC)C(=O)O)CC2	1825446939	LXUUXRHPZFRXCU-QXEWZRGKSA-N	447.355	1.291	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H]1CCNC(=O)C1)CC2	1825647236	LEXNBORUSRUDFI-IVZWLZJFSA-N	429.340	1.365	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnc(OCF)cn1)CC2	1825994159	QXHFGFWZHJTHCS-NXEZZACHSA-N	443.888	1.719	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnc(OCF)cn1)CC2	1825994160	QXHFGFWZHJTHCS-UWVGGRQHSA-N	443.888	1.719	50	20	IDGD	
Cc1n[nH]c(C)c1CC(=O)N[C@@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1	1826088779	OQLNADHKMIKXGL-CYBMUJFWSA-N	447.565	1.011	50	20	IDGD	
Cc1ccn(C)c1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1	1829825769	JJMIBFUYENTTLD-OAQYLSRUSA-N	437.349	1.560	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(Cl)ccc3F)CCO2)C1	1830192022	MMRJWJFLSCJDDI-DNVCBOLYSA-N	449.306	1.803	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(=O)n3[nH]nnc3n2)CC1	1830306470	LNPOQWDVHPQSBW-HIFRSBDPSA-N	435.916	1.063	50	20	IDGD	
O=C(C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1)c1ccc(Cl)cc1	1830686638	NBRYPWLUBAHQJU-CRAIPNDOSA-N	433.263	1.514	50	20	IDGD	
C=CCO[C@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)CBr)C2)C1	1831419004	JBUUCYDDHCOLDN-IIDMSEBBSA-N	433.343	1.065	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)COc3cccnc3)C2)C1	1831640578	NSPMTRNUYLLGRG-PXNSSMCTSA-N	425.913	1.324	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccn4cncc4c3)C2)C1	1831649707	AIKTWFMGBNXACE-WIYYLYMNSA-N	434.924	1.812	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CC34CCCN3CCC4)C2)C1	1831653612	BIPZCXHUPJKHDW-XMSQKQJNSA-N	442.000	1.869	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3cc(F)ccn3)CCO2)C1	1832855994	VWECHNFIKPLUJC-XLIONFOSSA-N	427.904	1.627	50	20	IDGD	
O=C(/C=C/c1cccnc1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1833103607	WSGFITGTPGWATM-NDIJEHHESA-N	442.285	1.242	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3[nH]ccc3C)CCO2)C1	1833547412	BAXJTYXHSQLVGQ-KBXCAEBGSA-N	428.327	1.567	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)CCCNC)CC2)CC1	1834713614	RUDZXIJKSGCULN-QGZVFWFLSA-N	431.419	1.731	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3ccccc3-n3nccn3)CC2)CC1)[C@H](F)Cl	1835081617	XHUYHEAQGYATAN-IBGZPJMESA-N	448.930	1.987	50	20	IDGD	
CC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)c3cnn4ccncc34)CC2)CC1	1836393994	FZFKVMAUOFEBGE-SFHVURJKSA-N	432.956	1.932	50	20	IDGD	
CC[C@@H](Br)C(=O)NC1CCN(C2CCN(C(=O)c3nc[nH]n3)CC2)CC1	1836541979	PSZHUFLQLSZMSL-CQSZACIVSA-N	427.347	1.163	50	20	IDGD	
COC(=O)NCC(=O)N1CCC(OC2CCN(C(=O)[C@H](C)CBr)CC2)CC1	1836674027	MHFTYCGTQQXGFT-CYBMUJFWSA-N	448.358	1.372	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccc(F)cn3)C2)C1	1837711660	MYEFBGPOYXYOPL-HXUWFJFHSA-N	439.560	1.071	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(CC)nn3C)CCO2)C1	1838038920	LKGWDIJIFSBPFR-OXQOHEQNSA-N	426.945	1.460	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(C#N)c3)CCO2)C1	1838908581	ILRBIPQVKMXRBF-IFXJQAMLSA-N	436.306	1.412	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CSCc3[nH]cnc3C)C2)C1	1839145362	FPBKBCBXYVFWQN-BEFAXECRSA-N	444.985	1.425	50	20	IDGD	
CC(C)=NO[C@H](C)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2	1839154192	GBYHMWYFTXCWBC-OLMNPRSZSA-N	438.352	1.480	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cc(O)ccc1F)CCO2	1839295565	QMPGUWSIZPQGHZ-FQEVSTJZSA-N	440.544	1.453	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3C[C@@H]3F)C2)C1	1839741770	AFMHVGHURQAUDR-QUZUAECRSA-N	449.429	1.686	50	20	IDGD	
O=C(c1ccc2nonc2c1)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840187798	XLMSMJYCICPMTO-QGZVFWFLSA-N	429.260	1.097	50	20	IDGD	
O=C(Cc1noc2ccccc12)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840188183	TWEUPEQMONYOFY-IBGZPJMESA-N	442.299	1.630	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)c2cnn(C)c2C)C1	1842521339	NHAJVALOQBYYBL-UHFFFAOYSA-N	441.444	1.693	50	20	IDGD	
CCOC(=O)N1CCC(C(=O)N2CC3(CCCN3C(=O)CCBr)C2)CC1	1842639409	MMVHAUZZNJZVAS-UHFFFAOYSA-N	430.343	1.843	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1sc(C)nc1C)C2	1843415387	DPHQVPMHMPCPFJ-YDZHTSKRSA-N	428.518	1.711	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)[C@H]2C[C@@H]2c2ccc(Cl)cc2)C1	1843873125	OSQSIWKCCNCXIM-UXHICEINSA-N	438.720	1.641	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@H]2CN(C(=O)OC(C)(C)C)C[C@@H]2C)C1	1843972769	WHUXBNBGPMFQQD-JYJNAYRXSA-N	443.972	1.947	50	20	IDGD	
O=C([C@@H](O)CCl)N1CC2(CCCN2C(=O)c2cc(Br)cc3[nH]ncc23)C1	1844099584	RYYXIHNPNUFJLU-AWEZNQCLSA-N	441.713	1.742	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)c2n[nH]c3c2CCc2ncccc2-3)C1	1844663915	NZNJIRFEDNZFOB-OAHLLOKOSA-N	429.908	1.641	50	20	IDGD	
COc1cc(C(=O)N2CCCC23CN(C(=O)[C@H](C)Br)C3)c([N+](=O)[O-])cc1O	1844738158	PEKKKWSSYPMKKJ-JTQLQIEISA-N	442.266	1.909	50	20	IDGD	
COc1ccc([N+](=O)[O-])c(C(=O)N2CC3(CCCN3C(=O)[C@H](F)Br)C2)n1	1845217624	KWJVXSDSJDJAMC-LBPRGKRZSA-N	431.218	1.506	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CC3(CCCN3C(=O)[C@H](F)Br)C2)cc1O	1845219303	HLFYHCOIRWLDJN-AWEZNQCLSA-N	428.258	1.858	50	20	IDGD	
Cc1nn(C)c(C)c1CCC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	10127742	RKLNMYNGWNHICJ-UHFFFAOYSA-N	433.534	1.215	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)[C@H](C)NS(=O)(=O)c2ccc(C)cc2)cc1OC	12694402	UULOBWMBKRBSDG-AWEZNQCLSA-N	435.502	1.530	50	20	IDGD	
CS(=O)(=O)N1CCC(C(=O)NNC(=O)COc2ccccc2-c2ccccc2)CC1	14223350	GHKFPLSGXRTXSR-UHFFFAOYSA-N	431.514	1.551	50	20	IDGD	
CC(=O)N1C=Cc2ccccc2[C@@H]1CC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	15856963	CJXMQXGFXVNKBY-IBGZPJMESA-N	431.452	1.659	50	20	IDGD	
C[C@H]1Cc2cc(C(=O)NNC(=O)Cc3nc4ccccc4n3C)ccc2N1S(C)(=O)=O	17411329	CEDJUMNZIFSEMB-ZDUSSCGKSA-N	441.513	1.288	50	20	IDGD	
COc1ccc(-c2nnc(S)n2CC(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)cc1	18055358	LNVFSOVFVFZIIH-GFCCVEGCSA-N	445.476	1.996	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)cc1	18103868	DPMUOEHDHJTRJO-IRXDYDNUSA-N	433.530	1.894	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)CCn1nnc2ccccc2c1=O	23566086	GJIWMROSIRQCSV-OAHLLOKOSA-N	431.452	1.950	50	20	IDGD	
CCOC(=O)NCCC(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	46660796	PQDYWKSCCZDYTC-UHFFFAOYSA-N	437.460	1.286	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CC[C@H](NC(=O)Nc3ccc(F)cc3)C2)n1	726187500	YOAFRDJKAUWZDB-HNNXBMFYSA-N	434.497	1.177	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)NCc1ccc([C@@]2(C)NC(=O)NC2=O)cc1	726282204	KNVUWXXCDGBELA-JOCHJYFZSA-N	439.472	1.213	50	20	IDGD	
C[C@H](C#N)Oc1ccc(C=NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1	727687257	LWABHTQWLSXZIO-MRXNPFEDSA-N	442.497	1.762	50	20	IDGD	
O=C(CCCc1ccccc1)NNC(=O)CCS(=O)(=O)c1ccc2c(c1)OCCO2	727717043	QZOKDUYJWXGHNP-UHFFFAOYSA-N	432.498	1.792	50	20	IDGD	
CCOc1ccc(C(=O)NNS(=O)(=O)c2ccc(OCC)c(C(=O)O)c2)cc1OC	727720278	JYVPDUZUZCKRGX-UHFFFAOYSA-N	438.458	1.814	50	20	IDGD	
O=C(NNc1nc(-c2cccnc2)no1)C1CCN(S(=O)(=O)c2ccccc2F)CC1	728078827	XABLZXCDLZNSRY-UHFFFAOYSA-N	446.464	1.815	50	20	IDGD	
CN(C)N(C(=O)c1cccc(CS(=O)(=O)NC(C)(C)C)c1)[C@@H]1CCS(=O)(=O)C1	728161970	QTTAORQZFZFYGW-MRXNPFEDSA-N	431.580	1.010	50	20	IDGD	
COc1cccc2c1OC[C@H](NC(=O)NNC(=O)c1cc(OC)c(OC)c(OC)c1)C2	728398544	HCRMJCNUXIDGTE-CQSZACIVSA-N	431.445	1.669	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)Cn2cnc3ccccc32)ccc1OCC(=O)OC	728511252	GJXVJCOKELSKLW-UHFFFAOYSA-N	426.429	1.448	50	20	IDGD	
Cn1c(=NNC(=O)c2cc(S(N)(=O)=O)c(Br)s2)sc2ccccc21	729509066	FTXPATCEMQZEEE-UHFFFAOYSA-N	447.361	1.957	50	20	IDGD	
CC(C)(C)C(=O)NNC(=O)CN1CCN(Cc2ccc(Br)cc2F)CC1	729521166	YKGOCLWQUGCYAX-UHFFFAOYSA-N	429.334	1.899	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)[C@H]2CC(=O)N(c3ccc4c(c3)OCCO4)C2)cn1	729693307	SBFJWPUNLCRFDS-LBPRGKRZSA-N	443.485	1.232	50	20	IDGD	
O=C(CC[C@@H]1NC(=O)N(c2ccc(Cl)cc2)C1=O)NNC(=O)c1cccc([N+](=O)[O-])c1	730736903	YVXFAOCQAIWIBJ-HNNXBMFYSA-N	445.819	1.914	50	20	IDGD	
O=C(NNC(=O)c1ccc2ccccc2c1)c1ccc2c(c1)S(=O)(=O)N=C1N=CNN12	731808100	FVHBVWOVQHJOHI-UHFFFAOYSA-N	434.437	1.326	50	20	IDGD	
Cc1ccccc1-n1c(C)cc(/C=C(/C#N)C(=O)N2CCN(S(N)(=O)=O)CC2)c1C	732066030	DRXVOPMAVPYRBA-UYRXBGFRSA-N	427.530	1.657	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)[C@@H]1CC(=O)N(C[C@@H]2CCCN2CC)C1	733125433	HMGFDAFEGAJXSM-SJORKVTESA-N	440.548	1.079	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)Cn2ccc3ccccc32)CC1	735117087	AUHWKTIMOPYINL-UHFFFAOYSA-N	428.518	1.116	50	20	IDGD	
CC(=O)NCC(=O)N1CCc2cc(C(=O)NNC(=O)NCc3ccc(Cl)cc3)ccc21	735704170	RGXHYCIDMCTZLS-UHFFFAOYSA-N	443.891	1.509	50	20	IDGD	
C[C@H](CNC(=O)CCC(=O)C(C#N)=C1N(C)c2ccccc2N1C)CN1CCOCC1	737985879	WRGPAIYSAXXLGD-QGZVFWFLSA-N	425.533	1.742	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2ccccc2CN2CCOCC2)c2ccccc2c1=O	740738265	BVDTYIWUMNFAGN-UHFFFAOYSA-N	449.511	1.714	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN(C)Cc1ccc(S(C)(=O)=O)cc1	740886942	HQIBITASBPYJKD-UHFFFAOYSA-N	439.921	1.645	50	20	IDGD	
COc1cccc(C(=O)NNS(=O)(=O)c2c(F)cc(NC(C)=O)c(Cl)c2F)c1O	741647503	DPUCOSFMSJEATL-UHFFFAOYSA-N	449.819	1.914	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NN=C2C(=O)Nc3cc(N4CCOCC4)ccc32)cc1	741768119	MAPRYCPBOVPROH-UHFFFAOYSA-N	443.485	1.405	50	20	IDGD	
Cc1cc(S(=O)(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)cc(C)c1F	742026984	YMNUMQLOZASHDL-UHFFFAOYSA-N	428.511	1.667	50	20	IDGD	
O=C(CN1C(=O)[C@H]2[C@H](C1=O)[C@H]1CC[C@H]2O1)NNc1c(F)cc(F)cc1Br	742709017	UBQMPJQOEHRYQX-FPQZTECRSA-N	430.205	1.333	50	20	IDGD	
CCc1ccccc1OCC(=O)NNS(=O)(=O)c1cnn(-c2ccccc2OC)c1	743249498	DXWZNGNDNOXPQT-UHFFFAOYSA-N	430.486	1.832	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)CNC(=O)c2ccc(Cl)c(Cl)c2)cc1	744565256	WENPXSPOJQPDPM-UHFFFAOYSA-N	449.250	1.599	50	20	IDGD	
CC(=O)c1cccc(O[C@@H](C)C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)c1	744619223	KOKIOODMOKDCDD-INIZCTEOSA-N	447.513	1.821	50	20	IDGD	
CC(C)(C)C(=O)NCCCC(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	744620122	FGIPICWVOBDIRE-UHFFFAOYSA-N	426.539	1.093	50	20	IDGD	
Cc1cc(Br)cc(C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)c1N	745010855	CDQHOXVBPATLAI-UHFFFAOYSA-N	431.246	1.829	50	20	IDGD	
Cc1ccc(O[C@@H](C)CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1	745888045	GYUGSNBSMIGNEZ-HNNXBMFYSA-N	434.518	1.657	50	20	IDGD	
CCC1(CNC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)CCOCC1	745931666	QUMSQDWYMFRCKD-UHFFFAOYSA-N	438.550	1.622	50	20	IDGD	
Cc1noc(C)c1S(=O)(=O)NC1(C(=O)NNC(=O)c2c[nH]c3ccccc23)CCCC1	746100647	JNOYQXQIZFTURC-UHFFFAOYSA-N	445.501	1.825	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1F)NNC(=O)C1CCN(c2ncccn2)CC1	747501505	YCBDVYUKGKNDJJ-UHFFFAOYSA-N	435.847	1.161	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)c2cc(S(=O)(=O)N(C)C)ccc2F)o1	747715912	UOKYHWUGJMNVQD-UHFFFAOYSA-N	440.497	1.586	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc2c(c1)OCCCO2)NNc1cccc([N+](=O)[O-])c1	748004626	MRROTMLSQYFCLC-UHFFFAOYSA-N	436.446	1.568	50	20	IDGD	
O=C(NCCC(=O)N1CCN(c2ccccc2)CC1)NNC(=O)c1ccc2ccccc2n1	748464731	JEUMFNNMUKPCIE-UHFFFAOYSA-N	446.511	1.918	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)CNS(=O)(=O)c1cccs1	748594742	XTGZMHMHIVBSKV-UHFFFAOYSA-N	446.576	1.247	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)NCCC(=O)Nc1ccc(Br)cc1	748618670	OYZHGZMGMBDGOP-NSHDSACASA-N	431.287	1.160	50	20	IDGD	
COc1cc(CNC(=O)NN[C@]2(C)CCS(=O)(=O)C2)cc(Br)c1OC	749188319	GMAWDMAVHLCFQT-OAHLLOKOSA-N	436.328	1.347	50	20	IDGD	
O=C(NCc1csc(CNC(=O)c2ccccc2)n1)NNc1ccc(-n2cccn2)nn1	750665154	RKBMSMXOZNZLQU-UHFFFAOYSA-N	449.500	1.875	50	20	IDGD	
CC[C@@H](C)NS(=O)(=O)c1ccc(C(=O)NNC(=O)CNC(=O)c2cccs2)cc1	751209131	MBVBSHDOMKVGCX-GFCCVEGCSA-N	438.531	1.016	50	20	IDGD	
CN(C)C(=O)c1ccc(C=NNC(=O)CN2c3cccc4cccc(c34)S2(=O)=O)[nH]1	752162263	BGQYKEHEJAAUBC-UHFFFAOYSA-N	425.470	1.529	50	20	IDGD	
C[C@H](CC(=O)OCc1ccccc1)NC(=O)NNC(=O)c1csc(N2CCOCC2)n1	753001267	UXLCPBXRHOECII-CQSZACIVSA-N	447.517	1.446	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NC2CCC(c3nc(C)no3)CC2)c2ccccc2c1=O	753353285	UXYDJOKTCUKATB-UHFFFAOYSA-N	439.476	1.778	50	20	IDGD	
C[C@H](C(=O)OCC(=O)NNC(=O)c1ccc(C#N)cc1)c1ccc(S(C)(=O)=O)cc1	753481830	BNOKTGUNPMJQLY-ZDUSSCGKSA-N	429.454	1.070	50	20	IDGD	
O=C(CC[C@@H]1NC(=O)N(c2ccc(Cl)c(Cl)c2)C1=O)NNC(=O)Cc1cc[nH]n1	755285403	BIVIKFJGWUAKDK-ZDUSSCGKSA-N	439.259	1.312	50	20	IDGD	
CNS(=O)(=O)c1cc(NC(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)ccc1C	755515121	JZGMBTAIQFVABR-UHFFFAOYSA-N	443.526	1.361	50	20	IDGD	
CCCc1cnc(NC(=O)C(=O)NNC(=O)c2cc(Br)ccc2O)s1	756154452	DCJVQTACSYNVKC-UHFFFAOYSA-N	427.280	1.963	50	20	IDGD	
CNS(=O)(=O)c1ccc(C)c(NC(=O)NNC(=O)CSc2ccccc2OC)c1	756527921	RXPSFGBLSVJZFR-UHFFFAOYSA-N	438.531	1.857	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)Nc1cccc(C[S@](=O)Cc2ccccc2)c1	756595886	ZEOTTWHXMRQPLD-SFNQZPIRSA-N	449.554	1.723	50	20	IDGD	
CN(C)C(=O)Cn1cnc(NC(=O)NNC(=O)c2cc(-c3ccco3)nc3ccccc23)n1	756771008	QPTUEZQAYFTMDE-UHFFFAOYSA-N	448.443	1.641	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cccc4c3oc(=O)n4C)CC2)cc1	757095960	NQKNTEPNJHKJKA-UHFFFAOYSA-N	437.500	1.019	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1ccc(Br)c2ccccc12	757886440	BUFYTNGZEFKWJV-VIFPVBQESA-N	429.296	1.693	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)[C@@H](Sc1ccccc1F)c1ccccc1	758028177	ZHNKCKLBJJCFNP-WBMJQRKESA-N	425.507	1.744	50	20	IDGD	
CCc1ccc(S(C)(=O)=O)cc1C(=O)OCC(=O)NNC(=O)Cc1ccccc1C	758941414	SEVWLKIHOSMHEP-UHFFFAOYSA-N	432.498	1.508	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)c1ccc(Br)cc1-n1cncn1	759011261	IKLVOGBCRUEWNQ-UHFFFAOYSA-N	432.234	1.575	50	20	IDGD	
COCCC(C)(C)C(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	759380061	UWTJPTLCPRGREM-UHFFFAOYSA-N	433.530	1.989	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)CSc1nc2cc([N+](=O)[O-])ccc2c(=O)n1C	762484431	MSZNKWDDVAOWET-UHFFFAOYSA-N	441.469	1.632	50	20	IDGD	
CCOC(=O)C1=NN(c2ccccc2)[C@@H](C(=O)NNc2nccc(N(CC)CC)n2)C1	762905462	AJYCMUORQXZYHN-QGZVFWFLSA-N	425.493	1.964	50	20	IDGD	
Cc1nn(CC(F)(F)F)cc1C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	763436222	ZUHWJTYIEAYEJX-UHFFFAOYSA-N	447.439	1.532	50	20	IDGD	
O=C(CN1CCCCCC1)Nc1ccc(NC(=O)C(=O)NNC(=O)c2ccncc2)cc1	763465438	WIMNLATZCVNYPY-UHFFFAOYSA-N	438.488	1.296	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1ccn(-c2ccccc2Cl)n1	763467274	APBTWWCIXZCIIX-UHFFFAOYSA-N	428.792	1.834	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)c2ccncc2)sc2c1CCCCC2	763467629	VFFUMPSYNPTHIU-UHFFFAOYSA-N	430.486	1.988	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1)C(=O)Nc1cc2c(cc1[N+](=O)[O-])OCCCO2	763500743	WMDKUCGEQWFUIE-UHFFFAOYSA-N	434.792	1.809	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3ccc4c(c3)OCO4)cc2)C[C@@H](C)O1	763548118	JLZNONAGNJLLEF-OKILXGFUSA-N	440.456	1.429	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)COc2cccc(C)c2)ccc1N1CCCC1=O	763630897	PZUDPZPZHQMJIV-UHFFFAOYSA-N	440.456	1.295	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccc(-c2nnc(C)o2)c1	763681354	KDRLUONRBILYOA-UHFFFAOYSA-N	439.428	1.609	50	20	IDGD	
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC(=O)C(=O)NNC(=O)C(C)C	763817163	DDROBLAAEAKPBG-UHFFFAOYSA-N	428.445	1.698	50	20	IDGD	
COc1cc(OC)c(OC)cc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1cccc(C)c1C	763849698	MFIIQVYZIYHHGA-AWEZNQCLSA-N	445.472	1.883	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)N1C[C@@H]2CCCN2c2ccccc21	763865436	PWYKTKKOOZCGKU-GJZGRUSLSA-N	426.448	1.756	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccc(C(=O)NCC(C)C)c(Cl)c2)n1	763881732	OZTLJRJYOYVHLS-UHFFFAOYSA-N	448.911	1.325	50	20	IDGD	
COC(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)c1	763994866	AARWFTRGNKHBSN-UHFFFAOYSA-N	443.641	1.617	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)C(=O)Nc1ccc(-c2nnc3n2CCCCCC3)cc1	763999457	SMQJINCWYPEEAX-UHFFFAOYSA-N	435.488	1.800	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)on1)C(=O)Nc1cccc(N2CCCNC2=O)c1	764015969	BKTBMZPDURYUSC-UHFFFAOYSA-N	448.439	1.661	50	20	IDGD	
O=C(Cc1cccc2ccccc12)NNC(=O)C(=O)Nc1ccc(-n2cncn2)c(F)c1	764034485	BSUCNZSYCGERSR-UHFFFAOYSA-N	432.415	1.888	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(Cl)c3cccnc23)c1	764078005	QAMWBZDXIOGDHH-UHFFFAOYSA-N	446.872	1.691	50	20	IDGD	
CC[C@@H](C)C(=O)NNC(=O)C(=O)Nc1cc(OC)c(OC)cc1C(=O)N1CCCCC1	764083479	JMFSLKLTTXIVAP-CYBMUJFWSA-N	434.493	1.462	50	20	IDGD	
N#Cc1ccc(-n2ccc(NC(=O)C(=O)NNC(=O)c3ccc(Cl)nc3)n2)c(Cl)c1	764100297	LYRWBPNINOZYMN-UHFFFAOYSA-N	444.238	1.845	50	20	IDGD	
CCOC(=O)c1c(C)csc1NC(=O)C(=O)NNC(=O)c1ccc(Cl)cc1O	764124953	PGQUWYJSAXPTIL-UHFFFAOYSA-N	425.850	1.992	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2O1)C(=O)Nc1cccc(C#Cc2ccccn2)c1	764151042	DUGIQVPBAITRBY-OAQYLSRUSA-N	426.432	1.571	50	20	IDGD	
Cc1cnn(-c2ccc(C(N)=O)cc2NC(=O)C(=O)NNC(=O)CCCc2ccccc2)c1	764223610	KHUJDUAUBKQOKQ-UHFFFAOYSA-N	448.483	1.388	50	20	IDGD	
O=C(NNC(=O)c1cccc2ncccc12)C(=O)Nc1cccc(CN2CCOC2=O)c1	764253281	OISRDLRMILSQDT-UHFFFAOYSA-N	433.424	1.587	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)C(=O)Nc1ccc(OCc2ccccn2)c(Cl)c1	764297763	YNGGCSCPXKTZJU-UHFFFAOYSA-N	428.836	1.745	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C(=O)Nc1ccc(N2CCCS2(=O)=O)cc1)c1ccccc1	764330766	XNBZUZWNDROWBU-SFHVURJKSA-N	444.513	1.506	50	20	IDGD	
CCN(c1ccccc1)S(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)C2CCC2)cc1	764334312	COHVRTVONZIIAO-UHFFFAOYSA-N	444.513	1.788	50	20	IDGD	
Cc1cc(C(=O)N2CCC[C@H](C)C2)ccc1NC(=O)C(=O)NNC(=O)Cc1ccncc1	764356011	PCRNHGMTZYXRFC-HNNXBMFYSA-N	437.500	1.591	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCc2cccnc2OCC(F)F)c2ccccc2c1=O	764511574	HFJCNJJWMXFMNX-UHFFFAOYSA-N	446.414	1.600	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)[C@@H](C)NS(=O)(=O)c2ccc(C#N)cc2)c1	764525282	OMRMKLNAKAVXSH-OAHLLOKOSA-N	430.486	1.068	50	20	IDGD	
C[C@H](CNC(=O)NNc1ccccc1S(C)(=O)=O)N1CCN(c2ccccc2)CC1	765656881	HNSLBGQYIRMVQR-QGZVFWFLSA-N	431.562	1.927	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)c1ccc([N+](=O)[O-])s1	765756724	OQEZIDRMEFZDAE-UHFFFAOYSA-N	437.909	1.889	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNS(=O)(=O)c2cnc(Cl)c(OC)c2)cc1	767437421	GSBQVPQYZITLBK-LLVKDONJSA-N	429.882	1.919	50	20	IDGD	
O=C(NNC(=O)c1cccc(Br)c1)NC1CCN([C@H]2CCC[C@H]2O)CC1	767958922	LCLRFDXWBRKJFK-JKSUJKDBSA-N	425.327	1.771	50	20	IDGD	
COc1ccc(Cn2nnnc2SCC(=O)NNC(=O)Cc2ccccc2C)cc1	768289087	SDZRYDPZROLSJH-UHFFFAOYSA-N	426.502	1.521	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)CN2C(=O)N[C@@]3(CCCC(C)(C)C3)C2=O)cn1	768571911	YCGXBXDCLQTCDR-LJQANCHMSA-N	434.522	1.299	50	20	IDGD	
N#Cc1cc(Cl)nc(NNC(=O)[C@H](CCC(N)=O)NC(=O)OCc2ccccc2)c1	768696350	XBWBJKJFRNVRKP-AWEZNQCLSA-N	430.852	1.610	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)N[C@H]3CCC[C@@H](S(C)(=O)=O)C3)nc21	770396411	HXVIGAISFCVBBT-WDEREUQCSA-N	425.515	1.269	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)[C@H]1CCCN1Cc1ccc(F)cc1	772904449	HUGVCBPMJJFASK-GOSISDBHSA-N	432.883	1.907	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NNC(=O)C[C@H](NC(N)=O)c2cccs2)C1	773418326	TWJPFBYKLAXEHY-OLZOCXBDSA-N	439.538	1.642	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2ccc(Br)cc2Cl)nn1C	773498603	BCLXGDMUYQBTTF-UHFFFAOYSA-N	430.646	1.244	50	20	IDGD	
N#Cc1cccc(NNC(=O)C(=O)N2C[C@H](C(=O)N3CCCCC3)Oc3ccccc32)c1	773686320	ULNSCNBQXVXOHO-HXUWFJFHSA-N	433.468	1.808	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccccc2C(=O)N2CCOCC2)cc1F	773888207	FBKZQLFVVDGMOI-UHFFFAOYSA-N	428.420	1.006	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)[C@H]2C[C@H](C)C[C@H]2C(=O)NNC(=O)c2cc(C)oc2C)c(C)o1	775764882	GYNMTCIBNQPBMN-XRVCCXLKSA-N	444.488	1.991	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)c1c(C)cc(=O)n(CC(=O)NC(C)C)c1C	776840848	LUCHTHJQQRDFDC-UHFFFAOYSA-N	428.489	1.002	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CN2CCNC(=O)[C@H]2c2ccc(C(F)(F)F)cc2)c1	777714652	YEEOQEWFLVLEKX-GOSISDBHSA-N	434.418	1.948	50	20	IDGD	
O=C(CSCC(=O)N1CCN(S(=O)(=O)CBr)CC1)c1ccccc1	777833181	VMVOYSPDIXLHKS-UHFFFAOYSA-N	435.365	1.429	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)NC[C@H]1CCN(c2ccc(F)c(F)c2)C1	778629931	BIVYHGJZAOIEKZ-GFCCVEGCSA-N	427.452	1.646	50	20	IDGD	
CC(C)OCCS(=O)(=O)NCC(=O)NNc1ccc([N+](=O)[O-])cc1Br	779143099	RCPRVXZXYWHWPF-UHFFFAOYSA-N	439.288	1.145	50	20	IDGD	
CCC1(CC)NC(=O)N(CC(=O)NNc2ccc([N+](=O)[O-])cc2Br)C1=O	779144583	ASDLPFMAFDHAGJ-UHFFFAOYSA-N	428.243	1.911	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)N[C@@H](C)CCNC(=O)OC(C)(C)C)nc1	779389284	RDTJYBQOUJJQQO-ZDUSSCGKSA-N	444.558	1.698	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)N1CCC(CCCN2CCOCC2)CC1	779995877	XSJRKEHLRMTSEY-UHFFFAOYSA-N	437.566	1.043	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)C1=CCN(C)CC1	781397071	WNPGEMBPWDYHPR-MRXNPFEDSA-N	449.577	1.456	50	20	IDGD	
Cc1cccc(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1F	781557598	GMVBRJVJAXMATH-UHFFFAOYSA-N	441.506	1.542	50	20	IDGD	
CCn1c(=O)n(CC)c2nc(NC(=O)CCC(=O)NNc3ncncc3Cl)ccc21	781816033	ZRZFHAZUCKKZDU-UHFFFAOYSA-N	432.872	1.543	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCOC[C@@H]2CC(=O)c2cccs2)cc1OC	781916118	ALNLWMHGCZNHPI-HNNXBMFYSA-N	447.513	1.500	50	20	IDGD	
CCNC(=O)N(C)NS(=O)(=O)c1ccc(S(=O)(=O)N2C[C@@H](C)C[C@@H](C)C2)cc1	782478144	IBGJQBULYBTWKI-OKILXGFUSA-N	432.568	1.208	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)F)cc1)[C@@H]1CC=CC[C@@H]1C(=O)N1CCOCC1	784445746	ATQAMVUFMURJFI-CVEARBPZSA-N	443.472	1.567	50	20	IDGD	
CCOC(=O)COc1ccc(NC(=O)C(=O)NNc2ccnc(Br)c2)cc1	784836891	AQAHNDWCINMNCM-UHFFFAOYSA-N	437.250	1.868	50	20	IDGD	
CN(C)c1nccc(NNC(=O)C(=O)Nc2cnn(-c3ccccc3)c2C(F)(F)F)n1	784971281	XUADNDSFHFWLSE-UHFFFAOYSA-N	434.382	1.829	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@@H]2C[C@@H]2c2cc(OC)ccc2OC)c2ccccc2c1=O	788084136	YTKHYYOTAZUABK-SJLPKXTDSA-N	436.468	1.998	50	20	IDGD	
CC(C)[C@H](NC(=O)Cc1ccc2ccccc2c1)C(=O)NNC(=O)N1CCN(C)CC1	788166153	IWAVXBSXEJBZRN-NRFANRHFSA-N	425.533	1.511	50	20	IDGD	
COC(=O)c1ccc(F)c(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)c1	789821453	TVDHKODUWIBUFA-YOEHRIQHSA-N	429.404	1.271	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)NC[C@@H]1CCN(Cc2ccccc2)C1	792229781	JVOXHOVRDXHQNN-KRWDZBQOSA-N	427.461	1.826	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1ccc2ccn(C)c(=O)c2c1	793024971	GTKSVXHEDYRSBJ-UHFFFAOYSA-N	428.832	1.600	50	20	IDGD	
CC(C)(C)OC(=O)NNC(=O)C(=O)Nc1ccc2c(c1)N(CC(F)F)C(=O)CS2	793030606	HQXJCRIKQPGFAF-UHFFFAOYSA-N	430.433	1.885	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)NC[C@H]2CCCN(C(C)=O)C2)cc1Cl	793202091	FEFVSSORPSQDMU-GFCCVEGCSA-N	427.889	1.951	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)COc2cc(C)ccc2C)c(OC)c(C)c1OC	796992724	WROKDKKNWSOXIP-UHFFFAOYSA-N	445.472	1.803	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)Cc3ccc([S@@](C)=O)cc3)CC2)cc1	797940395	PCDSMVLXELDUOX-WJOKGBTCSA-N	442.585	1.240	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2nc(Br)ccc2F)cc1	798126839	IDLWRNTZZNTENM-UHFFFAOYSA-N	431.243	1.853	50	20	IDGD	
Cc1c(I)cc([N+](=O)[O-])cc1C(=O)NNC(=O)c1cccnc1	801102096	BDIIDJHSOWXTFD-UHFFFAOYSA-N	426.170	1.978	50	20	IDGD	
CCc1nnc(NC(=O)[C@@H](C)[C@H](C)NC(=O)NNC(=O)COc2cccc(C)c2)s1	804867055	FGWPSQMEEIMUFG-STQMWFEESA-N	434.522	1.781	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)C(=O)Nc2cc(C)ns2)c2ccccc2c1=O	806974631	PXPBSAPLXCVAHV-UHFFFAOYSA-N	442.501	1.751	50	20	IDGD	
COCC1(CNC(=O)NN[C@]2(C)CCS(=O)(=O)C2)CCN(C(=O)OC(C)(C)C)CC1	807270832	ZEVJKVGQNZGPJX-GOSISDBHSA-N	448.586	1.031	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)C(=O)Nc1ccc(CCN2CCCCC2)cc1	807429014	OAPVKDBAODVTJM-UHFFFAOYSA-N	434.504	1.773	50	20	IDGD	
Cc1ccc(C)n1-c1ccc(C(=O)NNC(=O)NC2CCC3(CC2)NC(=O)NC3=O)cc1	807545942	NRQIMFYTMAYMNZ-UHFFFAOYSA-N	438.488	1.559	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2ccc3c(c2)C(=O)OC3)cc1	808893251	YUQUDSWSEVGVEQ-UHFFFAOYSA-N	432.458	1.139	50	20	IDGD	
C[C@H]1Oc2ccccc2[C@@H]1NC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	812429964	BUZGDJUDYWYAHX-AUUYWEPGSA-N	444.513	1.937	50	20	IDGD	
COC(=O)C12CCC(C(=O)OCC(=O)NNC(=O)[C@@H]3COc4ccccc4O3)(CC1)CC2	814590165	GYBZFCMWKSBJTR-XDGVHFHYSA-N	446.456	1.031	50	20	IDGD	
NS(=O)(=O)c1ccc(NC(=O)NN=Cc2cnc3cnc(Br)cn23)cc1	814965973	SKMGGUYUMGBNMF-UHFFFAOYSA-N	438.267	1.295	50	20	IDGD	
O=C(NNC(=O)c1ccccn1)C(=O)Nc1cc(Cl)ccc1I	815563793	OEZKVNKDNDEYOC-UHFFFAOYSA-N	444.616	1.739	50	20	IDGD	
CC(C)[C@@H](C(=O)NNc1ccccc1S(=O)(=O)N(C)C)N1C(=O)c2ccccc2C1=O	817053291	LDVXUOXAIVQYJW-SFHVURJKSA-N	444.513	1.701	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C1=NN(Cc2ccc(F)cc2)C(=O)CC1	817053640	ZZEXJTOPUODXFO-UHFFFAOYSA-N	447.492	1.698	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)CN2C(=O)N[C@@]3(CCCC[C@H]3C)C2=O)cc1OC	913069827	PWABYKRSSIDCSL-JLCFBVMHSA-N	446.504	1.746	50	20	IDGD	
CCCS(=O)(=O)c1ccccc1C(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	915457741	AQWMCLHJKHNZOU-UHFFFAOYSA-N	449.441	1.397	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NN=Cc1c(C)n[nH]c1C)N(S(C)(=O)=O)CC2	915952446	WHURFOCDMHBKBZ-QGZVFWFLSA-N	449.533	1.443	50	20	IDGD	
CC1=NN(c2ccc(C(=O)NNC(=O)c3ccc(Cl)c(S(N)(=O)=O)c3)cc2)CC1	916133279	CEGMROHDKITMAH-UHFFFAOYSA-N	435.893	1.648	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NC2CCN(CC(=O)Nc3ccccc3)CC2)cc1	916240081	LUDVWHXBNRQFSW-UHFFFAOYSA-N	439.516	1.807	50	20	IDGD	
COc1cc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)ccn1	916255461	DHYLFPQQZWOOMG-UHFFFAOYSA-N	433.490	1.019	50	20	IDGD	
CCCNC(=O)CN1CCC(NC(=O)NNC(=O)COc2cc(C)ccc2C(C)C)CC1	916518911	NTCCFNCSNVHFDC-UHFFFAOYSA-N	447.580	1.818	50	20	IDGD	
CCCOc1ccc(Oc2ncccc2CNC(=O)NNC(=O)C(=O)NC2CC2)cc1	916626834	WKFWEVALVJTATE-UHFFFAOYSA-N	427.461	1.772	50	20	IDGD	
O=C(COc1ccc(CCNC(=O)NNc2ccc(-n3cccn3)nn2)cc1)NC1CC1	918107332	IEVINZBAWULDFZ-UHFFFAOYSA-N	436.476	1.189	50	20	IDGD	
CCOc1ccc(/C=C(\C#N)C(=O)NCCNS(=O)(=O)c2ccc([N+](=O)[O-])cc2)cc1	920039793	LYRPKXFVHGOSCK-DTQAZKPQSA-N	444.469	1.995	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C=NNC(=O)c1sc(N2CCOCC2)nc1C	1115814186	FMPZGWXLWZAYNK-UHFFFAOYSA-N	436.563	1.654	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)c2n[nH]cc2I)cc1	1255036685	SNEBOKRQNQMWRE-VIFPVBQESA-N	444.229	1.642	50	20	IDGD	
CCOCCCn1c(NNC(=O)[C@H]2CC23CCS(=O)(=O)CC3)nc2ccccc2c1=O	1259651834	LDXWFQKDBAAYNH-MRXNPFEDSA-N	448.545	1.481	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)[C@@H]2CC(=O)N(c3ccccc3F)C2)CC1	1318611351	FZFGYISUHZIUFH-OAHLLOKOSA-N	448.495	1.973	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NC[C@H](OC)c2ccc(F)cc2)c2ccccc2c1=O	1319076264	DURUHNKBIJOVLZ-KRWDZBQOSA-N	427.436	1.887	50	20	IDGD	
CC(C)CN1C(=O)/C(=C/NNC(=O)c2ccc(Br)cc2)C(=O)NC1=S	1337124129	ZOERDRLVKHCSKP-KPKJPENVSA-N	425.308	1.467	50	20	IDGD	
O=C(CSc1ccc(Cl)cc1)NNC(=O)[C@H]1Nc2ccccc2S(=O)(=O)N1	1339965005	MSOLIRVMIMQQMT-HNNXBMFYSA-N	426.907	1.310	50	20	IDGD	
COCC1(C(=O)NNC(=O)c2n[nH]c3c2CCCC3)CCN(C(=O)OC(C)(C)C)CC1	1344367639	ZMTBVAYRKXRTAI-UHFFFAOYSA-N	435.525	1.713	50	20	IDGD	
Cn1nc(C(=O)N2CC[C@]3(CN(C(=O)CCBr)CCO3)C2)c2c1CCC2	1777959512	DZJVTHNWMJBXGF-SFHVURJKSA-N	425.327	1.137	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ncn(C(C)C)n2)C1	1778280406	WOJPYFHSVAWKLT-SPYBWZPUSA-N	427.933	1.240	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2)c1ccc2cnccc2c1	1778605725	PAQGMZXKTHTTHV-WOIUINJBSA-N	431.920	1.962	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc4cn[nH]c4cn3)C2)C1	1778780336	BRPCNSNBZOQHPO-ZWKOTPCHSA-N	426.304	1.638	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccc3c(n1)OCCO3)CCO2	1779296020	ZMVJHKSZPMUROU-HXUWFJFHSA-N	435.553	1.148	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H]1ON=C(c3ccccc3)O1)CCO2	1779296852	IFILVRZJDJRJLF-RTWAWAEBSA-N	447.564	1.403	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCS(C)(=O)=O)C2	1780714409	CHSKHZPDBPEUGS-KBRIMQKVSA-N	443.393	1.171	50	20	IDGD	
Cn1cccc1C(=O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Br)C1	1780777257	PQVIUISIDIODKW-DDUZABMNSA-N	444.301	1.412	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCN1CCCC1)C2)[C@@H](F)Br	1780778530	LPKIHCMDAZMWLH-QGPMSJSTSA-N	434.350	1.677	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)CNC(=O)c3cccs3)CCO2)C1	1781225251	UTVRRRHXPSATPD-MSOLQXFVSA-N	448.372	1.544	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(CCN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)C2)C1	1781764609	INYPQOXKWWREJE-QGZVFWFLSA-N	444.257	1.962	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)COCCOC)C2	1781899969	INDXNGOTDDVUDJ-IIDMSEBBSA-N	435.359	1.337	50	20	IDGD	
C=C(CC(=O)OCC)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)Br)C1	1782003339	JMKZTTZNRHPZEY-SPYBWZPUSA-N	445.354	1.793	50	20	IDGD	
Cc1cccn2ncc(C(=O)N3CC[C@@]4(C3)CN(C(=O)[C@H](C)Br)CCO4)c12	1782522107	YJHXPTAUIFMNRV-IFXJQAMLSA-N	435.322	1.870	50	20	IDGD	
CC[C@@H](NC)C(=O)N1CCO[C@@]2(CCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1	1782864489	NAZJYPKJDYSXAA-BYCJELGNSA-N	432.471	1.700	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)CNC(=O)c3ccco3)CCO2)C1	1783343636	WDMDVFNUIWHKJQ-FZKQIMNGSA-N	442.310	1.013	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cccn4nccc34)CCO2)C1	1783351821	DIAMHSHHOZOYOR-KXBFYZLASA-N	435.322	1.951	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cncc4cnccc34)CCO2)C1	1783535633	AXGGHUZXZIOOEB-YJYMSZOUSA-N	433.306	1.857	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)Cc3ccc(OC)cc3C#N)CCO2)C1	1783882233	WVDIHNVXOHFBKA-NQIIRXRSSA-N	435.908	1.193	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)N3C[C@@H]4C[C@H]4C3)C[C@@H]21	1783967819	XOEUVPVPTMJBDQ-YBPYCPRNSA-N	442.398	1.337	50	20	IDGD	
CCn1nc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]3C2)c2ccccc21	1784089800	JHQOSLPRRRNPQK-IKICRFKJSA-N	434.924	1.249	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCBr)[C@H]2C1	1786407163	IZPDCNRLSLXFSM-CYDGBPFRSA-N	440.176	1.925	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc4c3NC(=O)C4=O)[C@H]2C1	1788433473	ARFLVRJOYUVLJU-RCBQFDQVSA-N	447.919	1.680	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(C)nn3C(F)F)[C@H]2C1	1789335015	YLYIQUZITBMAQR-XPCVCDNBSA-N	434.871	1.434	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(-n4ccnc4)ccn3)[C@H]2C1	1789373012	QRRGTONHDYXSBG-RMRDIRSESA-N	431.924	1.878	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCC(=O)N3CCCC3)C[C@@H]21	1789868689	JAPQIFMPPYXJOT-ULMVMLMRSA-N	448.391	1.605	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN3CCCCC3=O)C[C@@H]21	1789872941	LYVBSWPPBMOUIU-XLPNERPQSA-N	434.364	1.215	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3CCc4ccccc4O3)[C@H]2C1	1791231222	ZOZWXAFDFMKNPT-OIGVQNGMSA-N	436.936	1.614	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)n3cccc3C=O)C[C@@H]21	1791254887	VWECFUTZOUNUOU-KSIDHJATSA-N	425.913	1.095	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)COc1cccc(Cl)c1)c1cccc(B(O)O)c1	1792832249	RUVMLEBAVDELTJ-REPLKXPHSA-N	442.708	1.351	50	20	IDGD	
CCOC(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)CBr)OCC	1792872176	PNHLYJMJIMFHHO-VWPFQQQWSA-N	435.359	1.396	50	20	IDGD	
CC(C)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCn1c(=O)oc2ccccc21	1793981609	WDFXRBHAZPIZPQ-CCWDJLKJSA-N	449.935	1.839	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ncc(OC)cc1F	1794453409	CIWGICRSKURVQV-NDPMZMCLSA-N	444.301	1.606	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1=CCCC1	1795043369	FPCPVOGPBKSPHY-CWPLJXCYSA-N	443.456	1.834	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1nc2ccccc2n(C)c1=O	1796995361	VZVUFPAAHAAEOM-BASYENTBSA-N	446.935	1.544	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc2ncccc2c1	1797324479	UYGHWUADWYGEJQ-BCDXTJNWSA-N	444.495	1.799	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2ncsc2[nH]1	1797980660	XORNDYCGCHJQMT-DYNIEEOBSA-N	441.351	1.859	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C[C@H]1C[C@@H]3CC[C@H]1C3)C2	1798442763	CHLWZWDSYHSUMT-NWCWSAAOSA-N	425.533	1.763	50	20	IDGD	
C[C@H](NC(=O)c1cnccn1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CO[Si](C)(C)C)C2	1798549988	KSDPJHNYKVEGLZ-JONQDZQNSA-N	433.585	1.085	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1c(OC)cccc1OC	1798828232	KEDGDUPKBVAHHW-AHXJXLJNSA-N	426.897	1.161	50	20	IDGD	
O=C(OCCO)c1ccccc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C(Cl)Cl)C2	1799270428	OVYDVPHHBLAPJE-CLLJXQQHSA-N	429.300	1.891	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnoc1C1CC1)C2	1800639489	ZTQNAENCUQGERC-AYRXBEOTSA-N	426.311	1.929	50	20	IDGD	
Cc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)Br)cc(C)c1O	1800763224	VDGHKESLRANQRU-DMRZNYOFSA-N	425.323	1.996	50	20	IDGD	
C[C@H](Oc1cccnc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2	1801403929	GWSGYWYIAFCNOI-QIRZIZBZSA-N	430.274	1.129	50	20	IDGD	
Cc1nc(CC(=O)NC[C@@H]2CCN(C(=O)CO[Si](C)(C)C)[C@@H]2c2cccnc2)no1	1804496198	LCWZHNMZLGVIRA-OXJNMPFZSA-N	431.569	1.873	50	20	IDGD	
COc1ncccc1CCC(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1	1804540519	KJVMBHDXSKGXGO-BJLQDIEVSA-N	446.935	1.724	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)CSC(=N)N)[C@H]1c1cccnc1	1807009778	QTJUVGZHQXSBJE-VHRBIJSZSA-N	428.356	1.497	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@H]1CCN(C(=O)[C@@H]2CCC(=O)N2)[C@H]1c1cccnc1	1808296568	SCGWNIVGEBFRFR-DFHZNHDVSA-N	427.332	1.602	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2cnncc2C(=O)O)[C@H]1c1cccnc1	1810804524	PVHPGWFZSXSWRE-XOKHGSTOSA-N	447.879	1.143	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)Cn2ccncc2=O)[C@@H]1c1cccnc1	1812340673	MEEWQFDSCZLUFH-ZWOKBUDYSA-N	431.924	1.752	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)c2ncnn2C)[C@@H]1c1cccnc1	1812775068	PQZAAJLWXQNQLH-SOUVJXGZSA-N	435.326	1.703	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)c2ccc[n+]([O-])c2)[C@H]1c1cccnc1	1812864580	ISFKUPLNUWUVRK-QRTARXTBSA-N	433.306	1.818	50	20	IDGD	
Cc1cncc(C(=O)N2CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)c1	1813070363	ICTFAIJHVAUOFD-XMSQKQJNSA-N	438.532	1.478	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2ccccc2O)[C@H]1c1cccnc1	1813071818	YBEQAXDTJHJGIX-JTSKRJEESA-N	439.516	1.480	50	20	IDGD	
CSCC[C@H](O)C(=O)NC[C@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1	1813092510	WGXMJNNRYMABEN-HLLBOEOZSA-N	444.395	1.986	50	20	IDGD	
CN(CC(=O)N1CCCC[C@@H]1c1cc(NC(=O)C(C)(C)CCl)n[nH]1)C(=O)C(=O)O	1814698861	FRILVSKBGIRQND-GFCCVEGCSA-N	427.889	1.210	50	20	IDGD	
COc1ccc(CC(=O)N2CCCC[C@@H]2c2cc(NC(=O)[C@@H](O)CCl)n[nH]2)cc1O	1814864687	RQITZGMLMJFSCT-ZBFHGGJFSA-N	436.896	1.958	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cocn1)CC2	1817277600	ZDROMWXTKMTTHA-IVWJEFBKSA-N	441.473	1.491	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)C(Cl)Cl)[nH]n1	1819404642	RRQBTIHBAIKXHZ-LBPRGKRZSA-N	440.291	1.518	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnoc2C2CC2)[nH]n1	1822413491	YIULSHOOVZDJCD-MRXNPFEDSA-N	443.508	1.954	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(C=O)s2)[nH]n1	1822413977	JNCBQRXUPSUVAV-OAHLLOKOSA-N	446.533	1.963	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@]2(C)CC2(F)F)[nH]n1	1822417157	BJIOFGWRIUKOPQ-FZKQIMNGSA-N	426.468	1.820	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)[C@H](O)CCl)CC2)n1	1824180234	FGAKXGPTQTZTGC-ZWKOTPCHSA-N	436.940	1.873	50	20	IDGD	
C[C@@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1)n1ccnc1	1824312925	NURFUAREZGAEGL-UWJYYQICSA-N	438.337	1.057	50	20	IDGD	
CSCC(C)(C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1	1824560264	HTKZXPZBTVUKIB-FQEVSTJZSA-N	446.422	1.989	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(O)n(C)n1)CC2	1825637414	ZNCXKWUMNYMBKB-SFYZADRCSA-N	428.312	1.591	50	20	IDGD	
CC(=O)N/C(C)=C/C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](C)Br)sc2C1	1825647902	XUAQBUSZLUXBMQ-VAMACUPYSA-N	429.340	1.878	50	20	IDGD	
Cc1cncc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)c1	1826002947	HFNDVUIILOERQP-JOCHJYFZSA-N	435.333	1.617	50	20	IDGD	
CCc1cc(C(=O)N[C@H]2CCc3nc(NC(=O)[C@@H](Cl)COC)sc3C2)n(C)n1	1826003940	VFIHYKUQGSYVRW-RYUDHWBXSA-N	425.942	1.919	50	20	IDGD	
C[C@@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1)C1(O)CCC1	1827049338	RMTLMEQYTJJTJP-LAUBAEHRSA-N	442.365	1.151	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC([C@H]2CCCCN2C(=O)Cn2cncn2)CC1	1827185759	OULYHQAFJRSYBT-GDBMZVCRSA-N	426.359	1.929	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CO[Si](C)(C)C)CC1	1827561934	JZEZQKZJHISSNO-DLBZAZTESA-N	426.634	1.905	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H](F)Cl)CC1	1828926963	VFKSEEMDFQSOIY-CVEARBPZSA-N	425.892	1.453	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3ccc(C#N)cc3)CCO2)C1	1829635496	JOOYZSAJNDBMAF-SIKLNZKXSA-N	449.935	1.201	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnnc4ccccc34)C2)C1	1830362384	USUUGDALRADOER-JOCHJYFZSA-N	446.935	1.965	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)CC(F)(F)F)C2)C1	1830537354	DXKLKBOBRKBDOF-BXUZGUMPSA-N	431.249	1.426	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)c[nH]1	1830538775	POVGTHRYDUZAKU-ACJLOTCBSA-N	428.327	1.424	50	20	IDGD	
CC1CCN(CC(=O)N2CCO[C@@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)CC1	1831104360	OZIIGHXADFLTBS-NRFANRHFSA-N	441.645	1.026	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H]2CNC(=O)C2)CC1	1831553005	FAIFYARUGJHHRC-JYJNAYRXSA-N	428.371	1.916	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H]2CCCS2(=O)=O)CC1	1831657236	UWIABWKUGKJAOH-BPUTZDHNSA-N	449.411	1.967	50	20	IDGD	
COCCOCCOCCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H](O)CCl)CC1	1831722014	NWYIRBRUIXPADY-RTBURBONSA-N	448.988	1.276	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)Cc2ccc(F)cn2)CC1	1831870762	FRRZXFHKVQTNEZ-FQEVSTJZSA-N	447.555	1.756	50	20	IDGD	
Cc1onc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)c1C	1831981932	KCLBEMPTWXBGIE-ROUUACIJSA-N	434.320	1.598	50	20	IDGD	
Cc1ccc(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)nc1	1832989419	DPOKUWISTJIAFA-QFIPXVFZSA-N	449.624	1.631	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3coc(C(C)C)n3)CCO2)C1	1833350591	CZTQTXFFKLYBJE-IFXJQAMLSA-N	429.901	1.122	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)CCBr)CC2)CC1	1834423474	KQJRRTRFTYLCQM-OAHLLOKOSA-N	438.794	1.597	50	20	IDGD	
CCc1noc(C)c1C(=O)N1CCOC[C@@]2(CN(C(=O)CCBr)CCO2)C1	1834823039	FSPGPWGDSMODFY-GOSISDBHSA-N	444.326	1.400	50	20	IDGD	
COC(=O)[C@@H]1CC[C@H](C(=O)N2CCC(N3CCC(NC(=O)[C@@H](F)Cl)CC3)CC2)C1	1835079469	YRSZAMSELNCHLT-JJRVBVJISA-N	431.936	1.682	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)C3=COCCC3)CC2)CC1)[C@H](F)Br	1836414570	RJGCTMFNJBJBDJ-INIZCTEOSA-N	432.334	1.943	50	20	IDGD	
O=C(Cc1noc2ccccc12)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836716822	SEHAUDUSDSEEFC-IBGZPJMESA-N	449.935	1.969	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(OC2CCN(C(=O)[C@@H]3C[C@@H]3F)CC2)CC1	1837009873	ANWREUAPZBTPAE-BWJSHVIVSA-N	447.511	1.477	50	20	IDGD	
O=C(c1n[nH]c2cc(Cl)ccc12)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1837085293	LNVLIMXNBQFAKA-QAPCUYQASA-N	445.278	1.821	50	20	IDGD	
CCc1ccc(C(=O)N2CCOC[C@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)cn1	1837712512	WYNYHZGVEAOMDR-NRFANRHFSA-N	435.597	1.566	50	20	IDGD	
C[C@@H]1CCC[C@@H]1C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1	1837919209	QDNYFOANKKRZCJ-VGSWGCGISA-N	442.365	1.415	50	20	IDGD	
CC(C)CCC(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1	1837920286	WGSCDVIJGFKAAE-UHFFFAOYSA-N	430.354	1.415	50	20	IDGD	
CCc1noc(C)c1C(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1838052602	FSFXAGAEEPHDFK-HXUWFJFHSA-N	427.929	1.880	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)[C@H]3C[C@@H](O)C3)CC2)CC1	1838269245	MLGZYRZVZYHJDU-JKIFEVAISA-N	431.371	1.929	50	20	IDGD	
CC(C)c1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@](C)(Cl)CCl)C3)C2)n[nH]1	1838698743	XESQPCSAEHJBPZ-MOPGFXCFSA-N	447.363	1.839	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@H]3CC[C@H](O)CC3)CC2)CC1	1838785451	GGYREHNVTANDPK-GPMSIDNRSA-N	430.973	1.790	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(-n4ccnc4)ccn3)CCO2)C1	1838795746	NLVJDFHNZFFJQB-DYESRHJHSA-N	447.923	1.355	50	20	IDGD	
O=C(c1ccoc1Cl)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1838844813	MEXULBUUOPOXOI-NHYWBVRUSA-N	439.665	1.694	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc4[nH]c(C)cc4c3)CCO2)C1	1839616648	HHXMNMKTOKUYKT-GCJKJVERSA-N	449.935	1.800	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc4ccoc4c3)C2)C1	1840152330	FPJLTXDQLZGWCZ-YWZLYKJASA-N	437.880	1.152	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3nc(C)c(C)s3)C2)C1	1840154049	JJFDCYODJYGIID-KBXCAEBGSA-N	431.942	1.084	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(C)ccc3F)C2)C1	1840155195	RXUIBBIZLJVPQK-JXFKEZNVSA-N	428.888	1.458	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3c(C)nn(C)c3C)CCO2)C1	1840434515	DKEMYFMUIHGMIE-GHTZIAJQSA-N	440.972	1.443	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)c(Cl)c1	1840693724	PJPKQWNDMQIZQC-APWZRJJASA-N	431.316	1.318	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)[C@@H]2C[C@@H]2c2ccc(F)cc2)C1	1841242769	NVBOHZXFSAVRSZ-QZTJIDSGSA-N	437.475	1.445	50	20	IDGD	
CC[C@@H](NC(C)=O)C(=O)N1CC2(CCCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C1	1841924094	UQTJIFSWRVJQCZ-CABCVRRESA-N	444.960	1.237	50	20	IDGD	
Cc1onc(-c2ccccc2)c1C(=O)N1CCCC12CN(C(=O)c1cccc(B(O)O)c1)C2	1842365279	UXHNXEYNXGFYJP-UHFFFAOYSA-N	445.284	1.461	50	20	IDGD	
O=C(c1cc2ccc(Cl)cc2[nH]1)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843009741	DFVGJNDXYQPJGT-UHFFFAOYSA-N	437.692	1.632	50	20	IDGD	
Cc1cccc(Cl)c1C(=O)N1CCCC12CN(C(=O)c1cnccc1C(=O)NN)C2	1845387135	YRYHBXWZRVCKPU-UHFFFAOYSA-N	427.892	1.778	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H]2C[C@@H](C[C@@H]2O)[C@H]1C(=O)N1CCCC12CN(C(=O)[C@@H](F)Cl)C2	1846203416	WSPQSDRNTPRCPR-YYFQZIEXSA-N	445.919	1.483	50	20	IDGD	
CC#C[C@H](CC(=O)N1CCCC12CN(C(=O)c1ccc(B(O)O)cc1)C2)c1ccc(O)cc1	1846415683	AAESZXHZAWWQGF-HXUWFJFHSA-N	446.312	1.086	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H]1C=C[C@@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](O)CCl)C1	1847556177	DOCXXQQVKRXEPM-YXMSTPNBSA-N	427.929	1.257	50	20	IDGD	
CS(=O)(=O)c1ccc(Cl)c(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](O)CCl)c1	1847568037	LAOLOOKRPPXKIO-KKUMJFAQSA-N	435.329	1.159	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](CCO)NC(=O)OC(C)(C)C	1847644495	XNVWNTOYPPGREB-MQYQWHSLSA-N	448.358	1.247	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)Cc1cnccn1	1847670631	CKEOHUQRKSVVMV-JYJNAYRXSA-N	437.928	1.353	50	20	IDGD	
COc1cc(C(=O)NCC(=O)NNC(=O)c2cc(Cl)ccc2O)cc(OC)c1OC	10625764	XXNORMPKCZZGRD-UHFFFAOYSA-N	437.836	1.262	50	20	IDGD	
CCOc1ccc(NS(=O)(=O)c2cccc(C(=O)NNc3nnc(C)c(=O)[nH]3)c2)cc1	10899247	BDWXUVKDPMETMW-UHFFFAOYSA-N	444.473	1.430	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)c1nn(-c2ccccc2)c(C)cc1=O	16055126	RTASGSVGWXAGTG-UHFFFAOYSA-N	430.468	1.914	50	20	IDGD	
Cc1cc(SCC(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)c(C)cc1Br	16785556	SDCASRTVLCAXAP-LLVKDONJSA-N	435.365	1.740	50	20	IDGD	
CC(C)Cn1c(CCC(N)=O)nnc1SCC(=O)NNC(=O)c1ccccc1Cl	17274574	DIMGWRWJUCLRHJ-UHFFFAOYSA-N	438.941	1.559	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)c2ccc(S(=O)(=O)NC(C)(C)C)cc2)nc2ccccc21	26538987	XHRTUWJVBHKHOB-UHFFFAOYSA-N	443.529	1.654	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)N3CCOCC3)c2)cc1	27338079	RYGAHHKNBWHXPP-UHFFFAOYSA-N	434.474	1.183	50	20	IDGD	
O=C(NNC(=O)[C@@H]1C[C@H]2CCCC[C@@H]2N1C(=O)c1ccc(Cl)cc1)C(=O)N1CCCC1	726160882	MTEDPDJSEMFPQT-NJAFHUGGSA-N	446.935	1.883	50	20	IDGD	
CCN(CCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)C(C)C	726714377	QIWGYYNZMQPQBP-UHFFFAOYSA-N	425.555	1.145	50	20	IDGD	
CS(=O)(=O)c1cc(C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)ccc1Cl	726862495	PKXNDGXCQNZKTF-UHFFFAOYSA-N	443.934	1.941	50	20	IDGD	
C[C@]1(NNC(=O)NCc2cccc(NC(=O)NCc3ccncc3)c2)CCS(=O)(=O)C1	727031819	YVAGLLILTYODAP-FQEVSTJZSA-N	446.533	1.284	50	20	IDGD	
CCS(=O)(=O)N1CCC[C@H](C(=O)NNC(=O)c2cc(OC)ccc2Br)C1	728526313	QLNGVCXJHIHUTO-NSHDSACASA-N	448.339	1.280	50	20	IDGD	
O=C(CCCC[C@@H]1SC[C@H]2NC(=O)N[C@@H]21)NNC(=O)c1cccc(OC(F)F)c1	728543920	NYIRNHWCTGYUFX-IPYPFGDCSA-N	428.461	1.775	50	20	IDGD	
CC(=O)N1CCN(c2ccc(C(=O)NNC(=O)c3cccc(C#N)c3)cc2[N+](=O)[O-])CC1	728827928	GHWDKMBVEXADCH-UHFFFAOYSA-N	436.428	1.210	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)c2cc(S(C)(=O)=O)ccc2Br)n1	728856775	AJHOCCLPDUVVNH-UHFFFAOYSA-N	429.296	1.127	50	20	IDGD	
CC(C)NC(=O)Nc1ccccc1C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	728889637	LKWQNUGOWZMATH-UHFFFAOYSA-N	425.493	1.684	50	20	IDGD	
C[C@H](CC(=O)NNC(=O)CNC(=O)c1cccs1)S(=O)(=O)c1ccc(F)cc1	729180507	CYFHNQGSADKYTJ-LLVKDONJSA-N	427.479	1.017	50	20	IDGD	
CCCN(CC(=O)NNC(=O)Cc1nc(C)cs1)[C@H]1CCN(C(=O)OC(C)(C)C)C1	729483209	HKKTYWHHRSKCQR-HNNXBMFYSA-N	439.582	1.863	50	20	IDGD	
CSC[C@H](C(=O)NNC(=O)c1cccc2ncccc12)N1C(=O)[C@H]2CCCC[C@@H]2C1=O	730224936	FZUULKGYOQGGFM-XYJFISCASA-N	440.525	1.903	50	20	IDGD	
O=C(NCCS(=O)(=O)N1CCSCC1)NNc1ccc(F)cc1Br	730673452	WOGMNNFRAKAVLJ-UHFFFAOYSA-N	441.348	1.593	50	20	IDGD	
O=C(CCCSc1ccc(Br)cc1)NNC(=O)[C@@H]1CCS(=O)(=O)C1	730958809	BIVLTTKJFVGEDR-LLVKDONJSA-N	435.365	1.904	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)CCCN1CCN(c2ccccc2)CC1	732263976	KKOXLVLRMXLUQI-UHFFFAOYSA-N	425.533	1.857	50	20	IDGD	
C[C@]12CCC(=O)N1c1ccccc1C(=O)N2CC(=O)NNc1ccccc1S(C)(=O)=O	732302469	HMEROTWCUCGNNS-OAQYLSRUSA-N	442.497	1.532	50	20	IDGD	
CCOCCCn1c(NNC(=O)[C@@]23CCC(=O)N2CCS3)nc2ccccc2c1=O	733268847	SKNNLGAKXVWIOI-FQEVSTJZSA-N	431.518	1.332	50	20	IDGD	
COc1cc(F)c([C@H](C)NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1OC	734069242	MVZSRZBFDHZJPW-NSHDSACASA-N	443.435	1.795	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)CC1(N2CCOCC2)CCCC1	735836061	CFBCCXWDWOMTIB-UHFFFAOYSA-N	437.566	1.084	50	20	IDGD	
CC(=O)N1CCN(C(=O)CCNC(=O)NNc2ccc(F)cc2Br)CC1	737065750	ZNLCEAXNZQMOEX-UHFFFAOYSA-N	430.278	1.295	50	20	IDGD	
O=C(Cc1ccc(NS(=O)(=O)c2cccs2)cc1)NNc1ncnc2[nH]cnc12	740746459	GDAPNSGEWGTISR-UHFFFAOYSA-N	429.487	1.901	50	20	IDGD	
CN1CCN(C(=O)/C(C#N)=C/c2cn(CCC(N)=O)nc2-c2ccc(Cl)cc2)CC1=O	740836256	CUNNCLWIGNGPPK-XNTDXEJSSA-N	440.891	1.286	50	20	IDGD	
CC(=NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)c1cnc(C)nc1C	741453261	NVVNCFBNRORVAG-UHFFFAOYSA-N	445.545	1.587	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)[C@@H]2CCCN(C(=O)N3CCc4sccc4C3)C2)n1	741662209	LWEUVRGLQUQTII-QGZVFWFLSA-N	444.561	1.599	50	20	IDGD	
Cc1cc(Br)c(S(=O)(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)s1	742025335	BVUMDMWKGTUOSM-UHFFFAOYSA-N	443.308	1.418	50	20	IDGD	
C[C@]1(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)CCCN(C(=O)c2ccccc2)C1	742035232	CYBLMZKECVIICN-QFIPXVFZSA-N	433.472	1.366	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)[C@@H]3C[C@@]34CCc3ccccc34)cc2)CC1	743334678	MKSTYSXKEYMPMG-JTHBVZDNSA-N	440.569	1.970	50	20	IDGD	
Cc1ccc(N2C[C@H](C(=O)OCC(=O)NNC(=O)c3ccc(C#N)cc3)CC2=O)cc1F	744497036	IVNATXCJNMCLNO-MRXNPFEDSA-N	438.415	1.363	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)c1ccc(S(N)(=O)=O)s1	745485151	JUFAAAZHRUDUIA-MRVPVSSYSA-N	448.320	1.387	50	20	IDGD	
CNS(=O)(=O)c1cccc(NC(=O)[C@@H](C)NC(=O)c2c(C)nn(CCCl)c2C)c1	746229320	NAEWGLVBCHTLEU-GFCCVEGCSA-N	441.941	1.404	50	20	IDGD	
COc1ccc(N2CCN(CCNC(=O)NNC(=O)CCOc3ccccc3)CC2)cc1	747307145	RPAKVPQJSDVBLT-UHFFFAOYSA-N	441.532	1.617	50	20	IDGD	
CSCC[C@@H](NC(=O)c1ccc2ccccc2n1)C(=O)NNC(=O)Cc1ccncc1	747429145	HCXMCTJTFTZRAP-LJQANCHMSA-N	437.525	1.871	50	20	IDGD	
COc1cc(OC)cc(N2CC[C@H](NC(=O)NNC(=O)COc3cccc(C)c3)C2=O)c1	747956837	WHAMALFXLDQCCW-IBGZPJMESA-N	442.472	1.527	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NNc2ccccc2F)o1	748050277	VXUNRHXIPPZSJT-AWEZNQCLSA-N	425.438	1.892	50	20	IDGD	
N#Cc1ccsc1C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	748053793	XQVWHUUCABDWAO-UHFFFAOYSA-N	448.526	1.034	50	20	IDGD	
O=C(NNC(=O)c1oc2ccccc2c1CSc1ncccn1)C(=O)N1CCCC1	748732420	JPGLARKBHDMJRO-UHFFFAOYSA-N	425.470	1.899	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)CNC(=O)c1cc(-c2ccccc2)on1	749400319	BOEXUUXYWJEQKX-CYBMUJFWSA-N	426.404	1.825	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)NCc2ccccc2CS(C)(=O)=O)cc1	749585130	FEUSYHRDZXBFGV-OAHLLOKOSA-N	449.529	1.928	50	20	IDGD	
O=C(Cc1csc(-c2cccc(C(F)(F)F)c2)n1)NNC(=O)[C@H]1CCS(=O)(=O)C1	750716073	MNQLSFYOFBBLTE-NSHDSACASA-N	447.460	1.954	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NCC2CCN(CC(=O)NC(C)(C)C)CC2)cc1	751112456	WQXFNTVKLGUPOF-UHFFFAOYSA-N	449.552	1.031	50	20	IDGD	
Cc1nn(-c2ccccc2)c2sc(C(=O)NNC(=O)NCc3cc(C(N)=O)no3)cc12	752684415	JSYZTWPWZAXTQO-UHFFFAOYSA-N	439.457	1.627	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)NC[C@H]2CCCCS2(=O)=O)c1	753268523	CIBYVMLCDSVWLS-LLVKDONJSA-N	434.312	1.369	50	20	IDGD	
Cc1ccc(-n2cnc3c2CCN(CC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)C3)cc1	753792392	JVJMXYZRJZCNQE-UHFFFAOYSA-N	434.456	1.908	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)N[C@@H]1[C@@H]2CCO[C@@H]2C12CCCC2	755091749	VOMIDHZWQNFWTR-NNWRFLSQSA-N	441.576	1.877	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)Nc1ccc2c(c1)CCO2	755718104	RUEMEPHCAXBYDC-UHFFFAOYSA-N	430.486	1.873	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)Nc2ccc(N3CCCC3=O)c(F)c2)c2ccccc2c1=O	756547685	GIYVYUZEIKRGSZ-UHFFFAOYSA-N	438.419	1.666	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)Nc1cc(S(=O)(=O)N(C)C)ccc1F	756681343	ABUVTUZBPWRUQE-UHFFFAOYSA-N	440.453	1.316	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)Nc2cccc3c2CCN3S(C)(=O)=O)c1	758295179	DXYWPVFCDOZURW-UHFFFAOYSA-N	432.502	1.857	50	20	IDGD	
COc1ccc(C[C@@H](C)C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1	758567011	BYRZJRIAAISQPC-KUHUBIRLSA-N	428.441	1.404	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N[C@H]1CCCS(=O)(=O)C1	758661112	XSMCINQGKRLHTF-JQWIXIFHSA-N	434.312	1.124	50	20	IDGD	
CCCCCCn1nc(C(=O)NNC(=O)C(=O)Nc2ccccn2)c2ccccc2c1=O	758838689	ACCWDKJWUQNZHX-UHFFFAOYSA-N	436.472	1.772	50	20	IDGD	
COc1ccsc1S(=O)(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	760334042	FQPNTWRHAYDBTL-UHFFFAOYSA-N	445.544	1.165	50	20	IDGD	
CCS(=O)(=O)Nc1cc(OC)ccc1S(=O)(=O)NNC(=O)c1cccc(Cl)c1	761267263	PQYCODWOWQJZCJ-UHFFFAOYSA-N	447.922	1.734	50	20	IDGD	
Cn1nc(SCC(=O)NN=C(CCc2ccccc2)c2ccccc2)c(=O)n(C)c1=O	762605490	WYKPSYHIBUHBBR-UHFFFAOYSA-N	437.525	1.724	50	20	IDGD	
CS(=O)(=O)c1cc(S(=O)(=O)NNC(=O)CSc2ccccc2O)ccc1F	763413622	VDMFGWJGEUZRMT-UHFFFAOYSA-N	434.492	1.037	50	20	IDGD	
CCNS(=O)(=O)c1ccc(CNC(=O)NNC(=O)CSc2ccccc2O)cc1	763525626	JYZSROFQQXUDPC-UHFFFAOYSA-N	438.531	1.313	50	20	IDGD	
CN1CCN(C[C@@H](NC(=O)NNC(=O)CSc2ccccc2O)c2ccccc2)CC1	763527675	YMTFSQYSXJNFMG-GOSISDBHSA-N	443.573	1.803	50	20	IDGD	
CSc1ccc(NC(=O)C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1	763531409	NQRMNVYKZXJHPJ-UHFFFAOYSA-N	441.557	1.707	50	20	IDGD	
C[C@@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3c[nH]c4ccccc34)cn2)C[C@@H](C)O1	763539864	ANHKQKPIDZQMPY-ZIAGYGMSSA-N	436.472	1.576	50	20	IDGD	
COCCn1ccc2ccc(NC(=O)C(=O)NNC(=O)c3ccc(OC)c(OC)c3)cc21	763550890	SUXMNQPPTLUSHZ-UHFFFAOYSA-N	440.456	1.705	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)Nc1ccc(Br)c(F)c1	763573357	ZLRQXLKZKVMQJF-AWEZNQCLSA-N	438.209	1.514	50	20	IDGD	
CSc1ccc(NC(=O)C(=O)NNC(=O)COc2cccc(C(F)(F)F)c2)cn1	763639392	NKCNXBKJUGBUOO-UHFFFAOYSA-N	428.392	1.987	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)C(=O)Nc1ccc(N2CCCC2=O)c(Cl)c1	763679748	CHSZLHJGNGKJGS-UHFFFAOYSA-N	448.838	1.771	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)cc1	763685509	WTYZXFTZIPREFZ-UHFFFAOYSA-N	435.820	1.057	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)NC(C)(C)C)cc2)c1	763759251	YECVXMIQBISNRS-UHFFFAOYSA-N	425.489	1.681	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2cccc(C(F)F)c2)c2ccccc2c1=O	763786339	MEYBKFZAVYZXNF-UHFFFAOYSA-N	429.383	1.754	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)C(=O)Nc1ccc(-n2ccnn2)cc1	763855453	WVMIWMPCSWQIJT-OAHLLOKOSA-N	444.451	1.974	50	20	IDGD	
CCOC(=O)c1c(F)cccc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccccc1F	763857632	NNBYOTTVHKRYJV-NSHDSACASA-N	435.383	1.695	50	20	IDGD	
CCNC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)c1	763865842	RMEFUCRUJRQZMH-LBPRGKRZSA-N	431.424	1.521	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)C(=O)Nc1ccc(C#N)cc1	763882727	LJRUTQZXTKNPNN-NSHDSACASA-N	431.246	1.874	50	20	IDGD	
CCc1cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(Br)c2)no1	763882810	MBDTZEJZRUVROS-VIFPVBQESA-N	425.239	1.553	50	20	IDGD	
CN(C)c1nnc(-c2ccc(NC(=O)C(=O)NNC(=O)Cc3ccc(F)cc3)cc2)o1	763918694	KKYCZPXKKDIDEG-UHFFFAOYSA-N	426.408	1.270	50	20	IDGD	
CNC(=O)c1ccc(OC)c(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCCCC3)c1	763969583	WTMCAMWTEPBEIR-UHFFFAOYSA-N	444.513	1.785	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc[nH]2)cc1NC(=O)CN1CCCCC1	763980349	RWIMNKLWSURPLU-UHFFFAOYSA-N	426.477	1.147	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)C(=O)Nc1ccc(NC(=O)C2CC2)cc1	763994813	HCNNFEBIVCNCHY-UHFFFAOYSA-N	434.250	1.525	50	20	IDGD	
COC(=O)c1csc(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)c1C	763995098	MNQFGHVENVSLFD-UHFFFAOYSA-N	429.252	1.333	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2cccn2C)ccc1NC(=O)OC(C)(C)C	763997149	WKWFFTGNZWNVHC-UHFFFAOYSA-N	431.449	1.780	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1cc2c(cc1Cl)OCCO2	764004283	OQZPDPNLKCIWIX-UHFFFAOYSA-N	433.804	1.282	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cccc(COCC(F)(F)C(F)F)c2)n[nH]1	764106823	VCYWBWOENBPEKR-UHFFFAOYSA-N	431.346	1.535	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(C)cc3)[nH]n2)cc1C	764111734	SIFAQIMYHRQADA-UHFFFAOYSA-N	435.440	1.880	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2cc(F)cc(N3CCOCC3)c2)cc1	764125874	DBPUWEWXMLXCHB-UHFFFAOYSA-N	444.463	1.390	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)N2C[C@H]3CCCN3c3ccccc32)o1	764138905	LWKWACDBXDRENN-MRXNPFEDSA-N	439.516	1.898	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)C(=O)Nc1ccc(N2CCOC2=O)cc1	764203539	MUNDBGUKTISRIU-UHFFFAOYSA-N	449.464	1.034	50	20	IDGD	
COC(=O)c1ccc(OCc2ccccc2)c(NC(=O)C(=O)NNC(=O)C2CCC2)c1	764338780	LFFOVGWWLAFEJY-UHFFFAOYSA-N	425.441	1.938	50	20	IDGD	
CN1C(=O)CCc2cc(NC(=O)C(=O)NNC(=O)c3cnn(-c4ccccc4)c3)ccc21	764342823	KDIMMAGONHGTEH-UHFFFAOYSA-N	432.440	1.181	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)C(=O)Nc2cc(C3CCCCC3)nn2C)c1	764431143	WWPVSWQVIFCENB-UHFFFAOYSA-N	427.465	1.221	50	20	IDGD	
CCOC(=O)N1CCC[C@@H](C(=O)NNC(=O)c2cc(-c3ccc(OC)c(OC)c3)[nH]n2)C1	765595624	AJFADRRWZSFETH-CQSZACIVSA-N	445.476	1.723	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1ccc(Br)nc1	765734451	ZEQFFHGCFTZJPJ-UHFFFAOYSA-N	446.305	1.063	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3ccc(C(F)(F)F)cn3)CC2)cc1	765754537	MAYXKDHIJUJSHR-UHFFFAOYSA-N	435.450	1.988	50	20	IDGD	
COc1cc(C#N)ccc1NC(=O)C(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12	766258550	HQRVCXFUOXEQQR-UHFFFAOYSA-N	448.439	1.257	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)CCC(=O)N1CCN(c2ccccc2)CC1	766661434	BXPGVVWCPMQAMQ-UHFFFAOYSA-N	430.530	1.662	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)[C@@H]1CCN(c2ccc(Cl)cc2)C1=O	767305585	HSLVEIGEHPKFJB-GOSISDBHSA-N	443.887	1.935	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)Cn3c(O)nc4ccccc4c3=O)n[nH]2)cc1	768269029	ZTCGBGVFRKAXLS-UHFFFAOYSA-N	432.440	1.516	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)[C@@H]1CC(=O)N(c2c(F)cccc2F)C1	768634859	QWSMQOUTTPLOEL-LLVKDONJSA-N	439.440	1.873	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)N(C)CC(=O)NNc2cc(C#N)cc(Cl)n2)cc1	768695854	SDHFYQBCWXOQRU-UHFFFAOYSA-N	436.881	1.329	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)c1ccc(OCC(F)(F)F)cn1	768914813	ICEUSELBBFULQU-UHFFFAOYSA-N	425.363	1.878	50	20	IDGD	
CS(=O)(=O)N1CCN(c2ccc(NC(=O)NNc3nc4ccccc4s3)cn2)CC1	770026782	GERSXWWQHOGDII-UHFFFAOYSA-N	447.546	1.922	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)NCC(=O)N3CCCc4ccccc43)nc21	770352719	APVSQSDRMMWUBY-UHFFFAOYSA-N	438.492	1.892	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(C)c(C(=O)NNc2nc(O)c3cnn(C)c3n2)c1	770974670	YUYRGGOZXXDXLR-UHFFFAOYSA-N	433.494	1.165	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)C1(C(=O)Nc2ccc(F)cc2)CC1	772883499	BELHYTVQCIKCJJ-UHFFFAOYSA-N	432.839	1.662	50	20	IDGD	
Cc1ccc(-n2nc(C)cc2NC(=O)C(=O)NNC(=O)Cc2ccc(Cl)cc2)nn1	773498540	AKQYBJOUHIXCAW-UHFFFAOYSA-N	427.852	1.261	50	20	IDGD	
CS(=O)(=O)c1ccccc1-n1cc(NC(=O)C(=O)NNc2c(F)cccc2F)cn1	773713584	KTTYYHUYLUIERR-UHFFFAOYSA-N	435.412	1.636	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCc2nc(C(F)(F)F)n[nH]2)cc1Br	776254052	NXLIGIQFDUASBT-UHFFFAOYSA-N	437.176	1.739	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCN(C(=O)OC(C)(C)C)[C@@H](C)[C@H]2C)n1	776607335	STQNDQZIQRFQJV-KGLIPLIRSA-N	425.555	1.471	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)NCC1=CCN(C(=O)OC(C)(C)C)CC1	777412435	ULLVUWSMTRTUMP-UHFFFAOYSA-N	434.493	1.972	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)[C@H](O)[C@@H](O)c1nc2ccccc2s1	779491544	QLKOGMHUPHCYDH-RTBURBONSA-N	439.497	1.450	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccccc1S(=O)(=O)NC1CC1)c1c[nH]c2ccccc12	780364441	AZGJNWXNOZLBPH-UHFFFAOYSA-N	434.499	1.232	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)N[C@H]2CCCN(c3ccc(C#N)cc3)C2=O)cc1	780897286	VLMMSTAJCXQRPA-IBGZPJMESA-N	437.456	1.472	50	20	IDGD	
CC1(NC(=O)OC(C)(C)C)CCN(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)CC1	780946000	AGSWWQONNHVRIX-UHFFFAOYSA-N	444.496	1.396	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNc2ncncc2Cl)c(OCC(F)(F)F)c1	782166382	UCMBHAVXDRQOEW-UHFFFAOYSA-N	447.757	1.940	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1ccc(OC2CCC2)c(F)c1	784003429	FEKPJIMSJUKIRL-UHFFFAOYSA-N	434.449	1.334	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)c2nnn(Cc3noc(C)n3)c2C)cc1OC	784741753	OUVNRXQHEMTTEV-UHFFFAOYSA-N	429.437	1.198	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNc2ccc(Br)nc2)c(C)c1	784809563	SICJELHZYDLITF-UHFFFAOYSA-N	437.250	1.786	50	20	IDGD	
O=C(NNc1ncccc1Cl)C(=O)Nc1ccc(F)c(S(=O)(=O)NC2CC2)c1	784817575	ZXSDATCGVZIELU-UHFFFAOYSA-N	427.845	1.397	50	20	IDGD	
O=C(NNc1ncc(F)cn1)C(=O)Nc1ccnn1Cc1ccccc1Br	784950544	UBNVRZYJZCQDDS-UHFFFAOYSA-N	434.229	1.705	50	20	IDGD	
CN1CCN(C(=O)c2ccccc2NC(=O)C(=O)NNc2ccc(C#N)c(Cl)c2)CC1	785086845	SQCGVBIRQMIJLS-UHFFFAOYSA-N	440.891	1.681	50	20	IDGD	
Cc1ccc(-n2cc(NC(=O)C(=O)NNC(=O)[C@@H]3COc4ccccc4O3)cn2)c(C)c1	786414379	MWMLCQXEOQUWBE-IBGZPJMESA-N	435.440	1.415	50	20	IDGD	
CCCCCn1nc(C(=O)NNS(=O)(=O)C[C@@H]2CCCOC2)c2ccccc2c1=O	788138838	GWRSJWMXZHMZIA-OAHLLOKOSA-N	436.534	1.578	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN2CCN(c3c(C#N)c(C)nn3C)CC2)cc1C	788276023	QBRFOTBYYRIJNI-UHFFFAOYSA-N	429.550	1.116	50	20	IDGD	
NC(=O)CCNC(=O)c1cccc(NC(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)c1	788595525	JMPMWDBWWRTCJB-HKUYNNGSSA-N	439.472	1.017	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)C(=O)Nc2nc3c(s2)CCC3)c1	789735466	PRKWMZDQHQZHTI-UHFFFAOYSA-N	439.291	1.803	50	20	IDGD	
COc1c(C)cnc(Cn2cnc(NC(=O)C(=O)NNc3ccc([N+](=O)[O-])cc3)n2)c1C	789745382	IEUKSYLAEWQMFA-UHFFFAOYSA-N	440.420	1.337	50	20	IDGD	
COCCOc1ccccc1NC(=O)C(=O)NNC(=O)[C@H]1OCC[C@H]1c1ccccc1	789810253	LXJQTKIEQBOOHS-LPHOPBHVSA-N	427.457	1.370	50	20	IDGD	
CN(NC(=O)c1cnnn1-c1cccc(F)c1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	790021007	RZFWOEQKVFFQRN-UHFFFAOYSA-N	447.471	1.656	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCCC2)c1	790063122	DYRHWUMHNWQCLY-UHFFFAOYSA-N	441.550	1.802	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)Cn1ccc2ccccc2c1=O	790462263	LNZPBNLGDMWWGA-UHFFFAOYSA-N	433.512	1.361	50	20	IDGD	
CN(C)c1nccc(NNC(=O)C(=O)Nc2cccc(CCC(=O)OC(C)(C)C)c2)n1	792366941	FVPFAPUTIAMMGO-UHFFFAOYSA-N	428.493	1.899	50	20	IDGD	
Cc1nc(SC(F)F)sc1CC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	792823217	RHNRCUJYWJEVDN-UHFFFAOYSA-N	425.446	1.746	50	20	IDGD	
CN(CC(N)=O)C(=O)c1cccc(NC(=O)C(=O)NNc2ccccc2C(F)(F)F)c1	793017389	DHYYBABFXYQDQP-UHFFFAOYSA-N	437.378	1.345	50	20	IDGD	
CC(C)[C@H](C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1)N1C(=O)c2ccccc2C1=O	794716591	DHRLHSUEHURDTL-GOSISDBHSA-N	444.513	1.701	50	20	IDGD	
O=C(CN1CCNC(=O)[C@@H]1c1ccc(Br)cc1)NNC(=O)c1ccccc1	796573836	DQKJHNPUBHZMHF-KRWDZBQOSA-N	431.290	1.383	50	20	IDGD	
COC(=O)c1cc(Cl)c(Cl)cc1NC(=O)C(=O)NNc1ccnc(N(C)C)n1	797538523	LVRITRNDFBYJQD-UHFFFAOYSA-N	427.248	1.718	50	20	IDGD	
COC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)c1C	798041741	FIQJMNNBUOFREE-LBPRGKRZSA-N	432.408	1.866	50	20	IDGD	
COC(=O)c1ccccc1NNC(=O)c1ccc(S(N)(=O)=O)c(Br)c1	798337242	HAFHZGRSHQKPGV-UHFFFAOYSA-N	428.264	1.640	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(NC(=O)NNC(=O)c2nnc(O)c3ccccc23)ccc1F	806542400	QQELSUFOTWXIKD-UHFFFAOYSA-N	448.436	1.191	50	20	IDGD	
CNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)CC2CCCC2)c1Br	806978341	XEKAQQCWMGPOIR-UHFFFAOYSA-N	425.283	1.475	50	20	IDGD	
Cc1cc(F)ccc1NNC(=O)C(=O)N1C[C@H](C[C@H]2COCC(=O)N2)c2ccccc21	807001991	OQCYGFDHMCUJIB-HOCLYGCPSA-N	426.448	1.613	50	20	IDGD	
O=C(NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)NNc1ccc2c(=O)[nH]ccc2c1	807108289	UHLAHNFEKOCYHJ-UHFFFAOYSA-N	431.430	1.536	50	20	IDGD	
CN(C)c1c(C=NNC(=O)COc2ccccc2-c2ccccc2)c(=O)n(C)c(=O)n1C	807947671	FFDJVGSNAYOSKO-UHFFFAOYSA-N	435.484	1.346	50	20	IDGD	
CCS(=O)(=O)N1CCC([C@H](C)N(C)C(=O)NNC(=O)COCc2ccccc2)CC1	808275371	UOWSOYYJYJHUAL-INIZCTEOSA-N	440.566	1.326	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2ccnc(C(F)(F)F)c2)cc1OC	808665277	RRAIWUFIGXTGJA-UHFFFAOYSA-N	427.335	1.736	50	20	IDGD	
O=C(C[C@@H]1CCCC(=O)N1)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	809558410	ZNZBATIQLNIREI-LBPRGKRZSA-N	436.515	1.369	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)c1ccc2c(c1)SCC(=O)N2	809937777	HNLWWEYERFAMTF-UHFFFAOYSA-N	439.541	1.704	50	20	IDGD	
Cn1nnc2c1C[C@H](C(=O)NNC(=O)COc1ccc(-c3ccc(C#N)cc3)cc1)CC2	809940983	ULSRLJSCEVFKGN-GOSISDBHSA-N	430.468	1.685	50	20	IDGD	
COC(=O)Cc1cc(Br)ccc1S(=O)(=O)NNC(=O)c1cccc(C)n1	811701082	SOUFGVUHUQMWOG-UHFFFAOYSA-N	442.291	1.491	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2cc(C3CCCC3)nn2C)cc1	813033578	ACLKJBGBVNLZJH-UHFFFAOYSA-N	434.522	1.410	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cnc3c(F)ccc(F)c3c2)cc1	814724168	QKNZNKUVAFNESC-UHFFFAOYSA-N	448.451	1.903	50	20	IDGD	
COC(=O)N1CCN(c2ccc(NC(=O)C(=O)NNc3cccnc3Cl)cn2)CC1	815601189	PUGPTECZPABMRN-UHFFFAOYSA-N	433.856	1.100	50	20	IDGD	
Cc1nc(-c2ccccc2NC(=O)C(=O)NNc2ccccc2S(=O)(=O)N(C)C)no1	815752337	NYCLXVZVEHZAGH-UHFFFAOYSA-N	444.473	1.377	50	20	IDGD	
COc1cc(C(=O)NNc2ccccc2S(=O)(=O)N(C)C)cnc1Br	817053719	DCUJGOBOBFWKFC-UHFFFAOYSA-N	429.296	1.860	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)/C(=C/c1ccc(F)cc1)n1nnnc1C	818023429	IFAYLXNNUVPKJM-ATVHPVEESA-N	440.435	1.744	50	20	IDGD	
C[C@@H]1CN(S(=O)(=O)c2cccc(C(=O)NNC(=O)CNc3ccccc3)c2)C[C@@H](C)O1	823327779	FPSLKNDPCDKJTE-HZPDHXFCSA-N	446.529	1.358	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)CN1C(=O)N[C@@]2(C[C@H](C)CC(C)(C)C2)C1=O	825615291	PXNFNJHHNMZNIH-JLCFBVMHSA-N	445.520	1.391	50	20	IDGD	
CCC[C@H](NC(=O)NCc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccc(C)cc1	847338213	YDDCVGVAGPYDME-SFHVURJKSA-N	443.479	1.888	50	20	IDGD	
O=C(Cc1ccc(Br)cc1)N[C@H](C(=O)N1CC[C@@H](B(O)O)C1)c1ccccc1	864233823	KNFNEHISZWXBIS-APWZRJJASA-N	445.122	1.924	50	20	IDGD	
CC(C)[C@H](NC(=O)NCc1ccccc1)C(=O)NNC(=O)c1ccc2c(c1)OCCO2	900253465	DDWVHASHCWAKDA-IBGZPJMESA-N	426.473	1.743	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C1=NN(c2ccc(F)cc2)[C@@H](C(N)=O)C1	913465467	CHEHFDCGOMQDLH-QGZVFWFLSA-N	427.436	1.035	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NC[C@@H](c2cccs2)N2CCOCC2)cc1OC	915893267	IBWVMKOCWKHKBT-HNNXBMFYSA-N	434.518	1.783	50	20	IDGD	
CCC(CC)[C@H](CNC(=O)NNC(=O)Cc1nc2ccccc2n1C)N1CCOCC1	916256351	SRPCABXFHIDYMM-IBGZPJMESA-N	430.553	1.583	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNS(=O)(=O)C2=Cc3ccccc3CC2)ccc1Cl	916566993	UFXUADPKJMZSGP-UHFFFAOYSA-N	441.918	1.539	50	20	IDGD	
CC(C)CCOc1ccc(S(=O)(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1	917727869	OUTCJVQTUJENFU-UHFFFAOYSA-N	430.490	1.711	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)CNS(=O)(=O)c3c[nH]c4ncccc34)cc2C1	918758800	AUATUJRMCPPFIU-LLVKDONJSA-N	447.542	1.489	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)c1ccc(N2CCCC2=O)cc1	920965314	KELMPTGKDDZNGO-CQSZACIVSA-N	444.513	1.922	50	20	IDGD	
Cc1nn([C@H]2CCS(=O)(=O)C2)c(C)c1C=NNC(=O)c1cncn1-c1ccccc1	1248424120	YVIBEBCGFATCJG-KRWDZBQOSA-N	426.502	1.809	50	20	IDGD	
CSCC[C@H](NC(=O)Cc1ccccc1)C(=O)NNC(=O)c1n[nH]c2c1CCCC2	1251801506	MQMJWKYCXODQNW-KRWDZBQOSA-N	429.546	1.530	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(C)(F)F)C2	1778091574	VTANGSVHMCRFKD-DHSLWRBWSA-N	439.463	1.290	50	20	IDGD	
CO/C=C(\C)C(=O)N1CC[C@]2(C1)CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)CCO2	1778841286	UTLBFJRYVJGBIF-KVDXNUTJSA-N	447.444	1.514	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C=C\C(=O)NC2CC2)C1	1779230716	OEUMKZCVLRTSEV-NQOROCTESA-N	446.375	1.571	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Cl)C2)c1nc(O)n2c1CCCC2	1779576486	KHTMQJDJEWBAMZ-ZXYWRSMDSA-N	428.892	1.587	50	20	IDGD	
CC(C)(C)c1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](O)CCl)C3)[nH]n1	1779725337	DEUKYLGRZHSMKJ-AKCHCHLHSA-N	426.945	1.434	50	20	IDGD	
CN(C)c1ccc([N+](=O)[O-])c(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](F)Cl)CCO3)c1	1780117154	GDWXWCCBJDSKDY-QAPCUYQASA-N	428.848	1.639	50	20	IDGD	
CCSc1cccnc1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](Cl)COC)CCO2	1780465331	LNMJSTNEHAWYSR-LIRRHRJNSA-N	427.954	1.891	50	20	IDGD	
Cn1ccc(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@](C)(Cl)CCl)C2)n1	1780713292	PTRMAZDPGVOINR-AYOQOUSVSA-N	431.364	1.713	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@](C)(Cl)CCl)C1)n1cncn1	1780715188	MDXORIJVYYVADL-DTTOXWODSA-N	432.352	1.589	50	20	IDGD	
Cc1nnc(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](F)Br)C2)o1	1780771950	WOQZAAJNUZHMMR-DJSGYFEHSA-N	433.278	1.125	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(C(=O)O)n(C(C)C)n3)CCO2)C1	1781214550	ZMAMWNPXGFZYTB-YJYMSZOUSA-N	426.901	1.623	50	20	IDGD	
CC(C)(C)n1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)n1	1781325640	GMQVOGGKXVADMU-DYVFJYSZSA-N	431.306	1.772	50	20	IDGD	
O=C(c1ccc2cncn2c1)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781331649	OISFOBIECVNCEN-YOEHRIQHSA-N	425.258	1.468	50	20	IDGD	
Cn1cc2cc(C(=O)N3CCO[C@@]4(CCN(C(=O)[C@@H](F)Br)C4)C3)ccc2n1	1781333221	MLWBSHIIILNOPQ-CRAIPNDOSA-N	439.285	1.707	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(F)nc1F)C2	1782166680	HNIRSQDOJAFMMV-IQUTYRLHSA-N	431.867	1.741	50	20	IDGD	
CC(=O)N[C@@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C(Cl)Cl)C1)C(C)(C)C	1782214169	MMMDTJVFFNLUEY-BIENJYKASA-N	436.380	1.855	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(CCN(C(=O)c3cn4c(F)cccc4n3)C2)C1	1782370375	WHFCHYVOYJGFHM-FQEVSTJZSA-N	434.544	1.768	50	20	IDGD	
CCOc1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](C)Br)C3)C2)nn1	1783535664	BKGAGPLPTFLQNK-PXAZEXFGSA-N	427.299	1.102	50	20	IDGD	
C[C@@H](Cc1ccccc1)C(=O)N1CCO[C@@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1	1783938493	ZRKYGKMMBGSOMR-FDDCHVKYSA-N	430.549	1.068	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(-c4cccs4)on3)C[C@@H]21)[C@@H](O)CCl	1784091171	KVPCIAVEVZCWNO-DUPGQFARSA-N	439.921	1.596	50	20	IDGD	
CCSc1cccnc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]2C1	1784093455	ZPQRKZKIPFCYRC-AJNGGQMLSA-N	427.954	1.387	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](C)Cn3ccnc3)C2)C1	1784506032	LSCAHGCTNXJJKT-MPGHIAIKSA-N	427.343	1.523	50	20	IDGD	
Cc1nnc(CCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCBr)C[C@@H]32)s1	1785323217	YOCWJFMJCRXFLZ-IHRRRGAJSA-N	445.383	1.544	50	20	IDGD	
C[C@H](Cn1cccn1)C(=O)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1	1786967881	CYYNSMVXKVDFKR-QGZVFWFLSA-N	446.316	1.647	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC1(c2ccc(NC(=O)c3ccc[n+]([O-])c3)cc2)CCC1	1787002003	OUHJIEZZYNRTKM-UHFFFAOYSA-N	425.489	1.441	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cc(F)ccc3[N+](=O)[O-])C[C@@H]21)[C@@H](F)Cl	1787451306	GUKBVTISSYNSHU-CDUAKIRFSA-N	431.823	1.791	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)N(C)C(C)=O)[C@H]2C1	1787521054	BHWTXJRAPQTMBT-CHUNWDLHSA-N	432.359	1.006	50	20	IDGD	
CCc1cc(C(=O)Nc2ccc(C3(NC(=O)c4cccc(B(O)O)c4)CCC3)cc2)n(C)n1	1789805773	SNCPIIBIDGPLSV-UHFFFAOYSA-N	446.316	1.724	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(C)n(CC)n3)C[C@@H]21	1790961061	WEFQNYVUHXBDCG-JKQORVJESA-N	441.370	1.978	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)C3(O)CCC3)C[C@@H]21	1790962214	QUOJRSATYMLJCM-GVRJEKJASA-N	431.371	1.691	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21	1790963195	OAQRZLNMTGLGJJ-SVNGYHJRSA-N	444.139	1.830	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3CCc4nc[nH]c4C3)[C@H]2C1	1791530488	UOJZHRQGUFPVKI-WLZFUECHSA-N	439.354	1.278	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(OC)ccc3F)[C@H]2C1	1791949837	KZSHIZYFZBHSJI-PTOXDTDZSA-N	428.888	1.681	50	20	IDGD	
CCOc1ncccc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](Br)CC)C2	1792382627	QHECCHPOZHJXNC-XRGAULLZSA-N	440.338	1.857	50	20	IDGD	
C[C@@H](NNc1ccccc1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCC(=O)NN(C)C)C2	1792589969	XASQTEWVKITIPP-OQIJWPOYSA-N	430.553	1.003	50	20	IDGD	
CC(C)N1CCC(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)CBr)CC1	1792869048	ZXKMRRKTBAKZBN-OWLYRPNTSA-N	444.414	1.727	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnccn1)C2	1794141337	UJTJXOSMAGLJKW-XGUBFFRZSA-N	437.928	1.861	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnnc(Cl)c1	1794219212	PYLXFNAOLVUNMI-GFQSEFKGSA-N	431.718	1.507	50	20	IDGD	
CC(C)(C)c1cnc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCBr)cn1	1795114505	QHCMEYKDFBNXCX-FVCICTRLSA-N	439.354	1.762	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CNC(=O)c1ccco1	1796284065	HOSLGCFMIFQSIK-FQUUOJAGSA-N	426.311	1.679	50	20	IDGD	
Cc1ccc(CCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)cn1	1798440789	SECZXVHCZNSXLD-BCDXTJNWSA-N	436.516	1.273	50	20	IDGD	
Cc1ccc(C)c(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)c1	1798443081	QLWOUCHVKQJNDA-REPLKXPHSA-N	435.528	1.796	50	20	IDGD	
COc1cccc(OC)c1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Br	1799348552	KAEPPSJFVVZSLH-OXUXUCFPSA-N	445.285	1.598	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2)c1n[nH]c2cccc(F)c12	1800076001	WGTLUPCPEALOKS-CULMDFNYSA-N	439.285	1.690	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1c(C)n[nH]c1C)C2	1800642496	LMPPSXGKADYAJP-IARIHHJXSA-N	427.343	1.332	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H]2Cc3ccccc3O2)[C@@H]1c1cccnc1)[C@H](O)CCl	1803143281	YWQIOUKMBOCQCD-KVPLUYHFSA-N	429.904	1.691	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)NC(=O)OCC)[C@@H]1c1cccnc1	1803691863	MIIOVGSQYANDII-LISAXSMJSA-N	440.928	1.559	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(-c2ncc[nH]2)cc1)c1ccc(B(O)O)cc1	1803782734	VLQJJRIUTGZSSV-WKCHPHFGSA-N	444.300	1.322	50	20	IDGD	
Cc1cccnc1C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1803799669	KKBLIICTWFOXQL-KNQAVFIVSA-N	444.300	1.098	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2nc(C)c(C)nc2O)[C@@H]1c1cccnc1	1804875815	WTXVMKXBDISXHE-BQFCYCMXSA-N	447.923	1.767	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2cc(C(=O)O)ncn2)[C@H]1c1cccnc1	1804969761	ZKBURYGBZZMEOE-GRDNDAEWSA-N	431.880	1.907	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)N2CCCC3(CCN(C(=O)[C@@H](O)CCl)CC3)C2)c1	1805130244	VMLXMQQYOMEGFI-KRWDZBQOSA-N	442.965	1.535	50	20	IDGD	
Cc1nc(C(=O)NC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)co1	1805691295	VQCCYELJRWRPKJ-HNAYVOBHSA-N	449.471	1.010	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)/C=C/C2CCCC2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1	1807374322	YUFAAFHCVPDRPR-HFXZDLCHSA-N	447.344	1.827	50	20	IDGD	
O=C(Cn1ccnn1)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@H]1c1cccnc1	1807683310	ZZKXREURMUVNGJ-QEJZJMRPSA-N	425.262	1.070	50	20	IDGD	
C=C(Oc1ccccc1O)C(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1	1808400855	PGNCENZCENQOTJ-ILZDJORESA-N	445.903	1.985	50	20	IDGD	
CN1CCN(CC(=O)NC[C@H]2CCN(C(=O)C(Cl)Cl)[C@H]2c2cccnc2)CC1	1809607245	XDSUDZFEJHLYIQ-WBVHZDCISA-N	428.364	1.139	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@@H]1c1cccnc1)c1cnc(O)[nH]1	1810949953	GSKHOQHHXLVEHB-CYZMBNFOSA-N	426.246	1.520	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2cccc(C#N)c2)[C@@H]1c1cccnc1	1811797306	WTMJJKTYPABIML-OFNKIYASSA-N	448.527	1.646	50	20	IDGD	
COc1nccnc1C(=O)N1CC[C@H](CNC(=O)[C@@H](C)Br)[C@@H]1c1cccnc1	1812864746	KJJPAVKVHHQBLF-XPKDYRNWSA-N	448.321	1.983	50	20	IDGD	
O=C(/C=C/c1ccccc1)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2	1814033165	XBLNMMNBIFXEOM-PEKVBPLLSA-N	447.325	1.762	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)C2(C#N)CCC2)[C@H]1c1cccnc1	1814056399	BPDZRKSIJUJQIB-YLJYHZDGSA-N	426.521	1.154	50	20	IDGD	
CN1CCC(CC(=O)Nc2cc([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)CC1	1814545747	ZUWCBZUJQTUPAY-SFHVURJKSA-N	447.584	1.507	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)Cn3ccccc3=O)sc2C1	1815451778	PKQXNGZSEQOWCI-GHMZBOCLSA-N	439.335	1.700	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)CCc2ccoc2)[nH]n1)c1cccc(B(O)O)c1	1817479778	QMMNOUPLDMQTLM-IBGZPJMESA-N	436.277	1.621	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](C)CBr)[nH]n1	1817989133	QEYUIQRGEYTSPO-NTZNESFSSA-N	443.346	1.880	50	20	IDGD	
CC1=CC[C@@H](C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2ccc(B(O)O)cc2)CC3)CC1	1818623111	YCSYAFKUMJVIKO-PBHICJAKSA-N	439.346	1.795	50	20	IDGD	
C[C@@H]1C[C@@]1(C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1820770700	VEUVEKHRDZKEFM-YDZGXFTCSA-N	425.493	1.760	50	20	IDGD	
Cc1ccc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)CCC(=O)NN(C)C)CC3)c(O)n1	1821518124	AJMJVMKHVOIHEQ-LBPRGKRZSA-N	446.533	1.151	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(CO)on2)[nH]n1	1822190646	SPGNPKLLPQUCRD-NOZJJQNGSA-N	426.271	1.979	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)C1CC2(CCC2)C1	1823052970	APWFWASBPRCBRK-IBGZPJMESA-N	436.321	1.976	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H]3CCC(=O)N3C)sc2C1	1823054519	KGQKTMAFXZXENG-UMNHJUIQSA-N	443.367	1.849	50	20	IDGD	
C[C@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1)C1(O)CCC1	1823737764	XJNLTAFMRMWDDV-MJGOQNOKSA-N	436.597	1.530	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)C2=NNC(=O)C2)CC1	1824092006	LWSDMYOYRMKZIY-IUODEOHRSA-N	427.343	1.513	50	20	IDGD	
Cc1cnc2c(C(=O)N3CCC([C@H]4CCCCN4C(=O)[C@H](O)CCl)CC3)cnn2c1	1824186515	NJJSLTLHMSABFG-QZTJIDSGSA-N	433.940	1.871	50	20	IDGD	
O=C(c1coc(Cl)n1)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827050358	OFUFGMWHOZEHMF-GOSISDBHSA-N	445.712	1.555	50	20	IDGD	
CC[C@H](C)[C@H](O)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827050747	XKXKHXLHAZOWHX-DQLDELGASA-N	430.354	1.007	50	20	IDGD	
O=C([C@@H]1CCCSC1)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827055481	YUXQCTLTICZKCN-TZIWHRDSSA-N	444.406	1.743	50	20	IDGD	
CN1CCN(C2(C(=O)N3CCC([C@H]4CCCCN4C(=O)[C@@H](F)Cl)CC3)CC2)CC1	1827611192	ODCIHUCGMVDHIT-QZTJIDSGSA-N	428.980	1.921	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCCC[C@H]1C1CCN(C(=O)C[C@@H]2NC(=O)NC2=O)CC1	1829097215	DDUHCHZROOMYLC-HOTGVXAUSA-N	438.601	1.056	50	20	IDGD	
O=C([C@H](O)CCl)N1CCC([C@@H]2CCCCN2C(=O)c2cnc3snnc3c2)CC1	1829623876	RVBLRTBUXKRHBF-JKSUJKDBSA-N	437.953	1.919	50	20	IDGD	
O=C(c1cc(Cl)ccc1F)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1	1830183393	OHYRJQNTDOICIK-YJBOKZPZSA-N	435.279	1.149	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(CC)nn3C)C2)C1	1831651523	QKENUUWSSVIUQL-OXQOHEQNSA-N	426.945	1.460	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2csc(N)n2)CC1	1831871465	REFVFLVGCYDAPA-MRXNPFEDSA-N	436.582	1.332	50	20	IDGD	
Cc1cc(C)n(CC(=O)N2CCC([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)n1	1831871677	WBXTYZWVTDDNKR-FQEVSTJZSA-N	446.596	1.493	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(F)cn2C)CC1	1831873167	LZSIXQIYIFVQNA-SFHVURJKSA-N	435.544	1.771	50	20	IDGD	
CN1N=C(C(=O)NC2CCN(C3CCN(C(=O)C(C)(C)CCl)CC3)CC2)CCC1=O	1833688132	CTPZRQLOWYJPRA-UHFFFAOYSA-N	439.988	1.431	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@](C)(Cl)CCl)C3)C2)nn1C	1834122560	VQONGTQZZPIYOQ-MSOLQXFVSA-N	433.336	1.035	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1)c1ccccn1	1834126748	PPMJPMPKYZXWNV-MRXNPFEDSA-N	427.318	1.957	50	20	IDGD	
O=C(C(Cl)Cl)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1Cc3ccccc3O1)CCO2	1836654026	LXXYNTWEIPSGOE-DNVCBOLYSA-N	429.300	1.250	50	20	IDGD	
Cc1occc1C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1	1837455508	DQDDMZSCIGTYKQ-UHFFFAOYSA-N	440.305	1.194	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3CCC(F)(F)C3)C2)C1	1837708511	ITLLPDZVFYPNGR-MAUKXSAKSA-N	434.556	1.730	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(F)cc3F)C2)C1	1837714708	MKIQBTNQLLZNON-HXUWFJFHSA-N	442.535	1.886	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3sccc3OC)CCO2)C1	1838299328	HDMGKIAUMRUTCL-UGSOOPFHSA-N	432.926	1.081	50	20	IDGD	
O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(F)c(F)c1)CCO2	1839008749	ZBWRRMGNZJKYAR-GOSISDBHSA-N	447.276	1.820	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CNc3ccc(F)cc3)C2)C1	1839143925	MBPKUSFOXHDFGT-PXNSSMCTSA-N	427.904	1.711	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)CC[C@H]3CCOC3)C2)C1	1839156243	IVMSBKTZZPMCCW-SNRMKQJTSA-N	437.364	1.496	50	20	IDGD	
CSCC(C)(C)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H](F)Br)CCO2)C1	1839198551	HWAOUORUDKDGDH-WBMJQRKESA-N	441.363	1.523	50	20	IDGD	
O=C(C1CCSCC1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839203473	LZRQVKRARGXMKI-CZUORRHYSA-N	439.347	1.277	50	20	IDGD	
Cc1ccn2c(C(=O)N3CCO[C@@]4(COCCN(C(=O)C(C)(C)CCl)C4)C3)cnc2c1	1839600954	WVBDVJGGWAUTIW-QFIPXVFZSA-N	448.951	1.978	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3ccco3)C2)C1	1839962576	KUVCJMSABIXBIX-VQIMIIECSA-N	443.338	1.842	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(O)nc3)C2)C1	1839965579	DQVSIMCUSZGETH-KSSFIOAISA-N	442.310	1.031	50	20	IDGD	
COc1cscc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2	1840032923	NPKKINFKLMRBBM-PXAZEXFGSA-N	447.351	1.610	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccoc3Cl)C2)C1	1840034469	MLJLBPGVPCBYAJ-MEDUHNTESA-N	435.702	1.786	50	20	IDGD	
N#Cc1cccc(CCC(=O)N2CCOC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)c1	1840186976	HIVYTJJQKVPJFS-FQEVSTJZSA-N	440.327	1.751	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)Oc1cccnc1)CCO2	1840449792	KMHPGUGXHFUJRA-PLMTUMEDSA-N	439.940	1.713	50	20	IDGD	
COc1cc(Cl)cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)c1	1840740263	BXNLFPSXBRMLTR-APWZRJJASA-N	447.315	1.018	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC2(CCCN2C(=O)[C@H](O)CNC(=O)OC(C)(C)C)C1	1841300149	ROUKWCIEFVSWFN-QWHCGFSZSA-N	448.358	1.249	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)CCc1c(C)c[nH]c1C)C2	1843415508	UJJXQUNJZLOAPX-YZSQISJMSA-N	438.532	1.902	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)[C@H]1[C@H]3c4ccccc4S[C@H]31)C2	1844264482	XSXFLEIFSGAOBJ-CEXWTWQISA-N	449.536	1.390	50	20	IDGD	
CCOC(=O)N1CCC(C(=O)N2CC3(CCCN3C(=O)[C@@H](F)Br)C2)CC1	1845220669	GVIYYNWSJXDDQX-CYBMUJFWSA-N	434.306	1.749	50	20	IDGD	
O=C(COC(=O)c1cccc(I)c1)NNC(=O)c1cccs1	10716219	UCKLKHSMDHTOTN-UHFFFAOYSA-N	430.223	1.971	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cc(C(=O)NNc3nnc(C)c(=O)[nH]3)ccc2C)cc1	10899253	XJWMAMDVNJXDHM-UHFFFAOYSA-N	444.473	1.348	50	20	IDGD	
CCOc1ccc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)N3CCOCC3)cc2)cc1	27338126	GFOPPWZFMSUMLQ-UHFFFAOYSA-N	448.501	1.573	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)NCc1ccc([C@]2(C)NC(=O)NC2=O)cc1	726283385	YIUKBKISOMJPKX-QKVFXAPYSA-N	443.435	1.178	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2ccc(C(=O)NNC(=S)NCC3CCC3)cc2)C[C@@H](C)O1	727867178	UGOOEEQPCMJEPD-OKILXGFUSA-N	440.591	1.394	50	20	IDGD	
CC(=O)c1cccc(S(=O)(=O)NCCC(=O)NNc2nc(-c3cccnc3)no2)c1	728076153	FVKNSLBLXWOLRB-UHFFFAOYSA-N	430.446	1.146	50	20	IDGD	
C[C@H](Oc1ccc2c(c1)CCC2)C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	728326008	ATRQOUBBYBHJPE-XOBRGWDASA-N	440.452	1.473	50	20	IDGD	
CC(C)[C@H](C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)S(=O)(=O)C1CCCCC1	728513229	UMPZVMZBQNGIFT-QGZVFWFLSA-N	434.522	1.195	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)c2ccc3c(c2)C[C@H](C)N3S(C)(=O)=O)cn1	729693297	RUUZNOMIICBRBP-NSHDSACASA-N	435.531	1.432	50	20	IDGD	
COc1cc(C=NNC(=O)[C@H]2CCS(=O)(=O)C2)ccc1OC(=O)c1ccc(F)cc1	730576704	UXHATYXAIGOMRS-HNNXBMFYSA-N	434.445	1.938	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)[C@H]2CCN(c3ccc4c(c3)OCCO4)C2=O)c(C)c1	730586045	ZPLRCOYOPSSFNZ-QGZVFWFLSA-N	438.484	1.687	50	20	IDGD	
Cc1c(C(=O)NNC(=O)[C@H]2COc3ccccc3O2)nnn1-c1ccc2ncccc2c1	731327428	WDVGLMZIXBECCE-LJQANCHMSA-N	430.424	1.725	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)c1ccc2c(c1)S(=O)(=O)N(C1CC1)C2=O)c1ccccc1	731997095	ROXDLRUPUXHLEW-INIZCTEOSA-N	427.482	1.948	50	20	IDGD	
Cc1ccccc1-n1nc(C(=O)NNC(=O)CCN2C[C@H](C)O[C@@H](C)C2)c2c1CCC2	732263081	ZVGLRVUYSQYNAC-IRXDYDNUSA-N	425.533	1.930	50	20	IDGD	
CC(C)(C(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)c1ccc2c(c1)OCCO2	732333165	OKGPDMDZYZHOKF-UHFFFAOYSA-N	443.412	1.648	50	20	IDGD	
C[C@@]1(NNC(=O)N[C@H]2CCCN(Cc3ccc(F)cc3Cl)C2)CCS(=O)(=O)C1	732469379	GYVNTPHJRCWEET-MAUKXSAKSA-N	432.949	1.825	50	20	IDGD	
CCOC(=O)C1=NN(c2ccccc2)[C@@H](C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)C1	733109111	SLVJLUMXNJBMQC-HXUWFJFHSA-N	446.467	1.831	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)NCc3cc(S(N)(=O)=O)ccc3F)cc2C1	734516997	NANTTZJEYPNTNQ-JTQLQIEISA-N	440.522	1.804	50	20	IDGD	
Cc1cc(C)cc(C(=O)NCC(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)c1	734881984	QQRIOLKTIAQWGP-UHFFFAOYSA-N	447.536	1.763	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)N[C@H]2CCN(c3cnn(C)c3)C2=O)c1	735583707	BJJVCOZIJSSXJB-KRWDZBQOSA-N	428.493	1.367	50	20	IDGD	
CN(C)C(=O)CCCC(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	735840275	PUGZCQZXXHQJQX-UHFFFAOYSA-N	435.488	1.408	50	20	IDGD	
CCCCn1c(C)cc(/C=C(/C#N)C(=O)N[C@H]2CC(=O)N(CCN3CCOCC3)C2)c1C	736150837	BEISJWSPXGWODY-BHJKQYKASA-N	441.576	1.861	50	20	IDGD	
COc1ccc(-c2nn(CCC#N)cc2/C=C(/C#N)C(=O)N2CCN(C)C(=O)C2)cc1OC	740836324	GWAXPCHJLQMJSG-BOPFTXTBSA-N	448.483	1.689	50	20	IDGD	
CC(=NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)c1cccc(S(=O)(=O)N(C)C)c1	741769762	AJIVZKXAEJSPAI-UHFFFAOYSA-N	438.531	1.886	50	20	IDGD	
COC(=O)Cn1cc(S(=O)(=O)NNC(=O)c2cc(C)n(-c3ccccc3)c2C)cn1	742255388	GRLDRIMGCOCQHA-UHFFFAOYSA-N	431.474	1.087	50	20	IDGD	
CC(C)c1nn([C@@H]2CCS(=O)(=O)C2)cc1C(=O)NNC(=O)c1ccc2ccccc2n1	742463391	LXZWQXDAUDTZCR-OAHLLOKOSA-N	441.513	1.989	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@@]2(C)CCc3ccccc3C2)cc1	742471802	KFTGYQBRLPDUHZ-QFIPXVFZSA-N	429.542	1.958	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ccc3nncn3n2)CC1)c1cccc(Br)c1	742770170	PYKFVOAIFJYWLY-UHFFFAOYSA-N	444.293	1.564	50	20	IDGD	
CCNS(=O)(=O)c1ccc(F)c(C(=O)OCC(=O)NNC(=O)c2cccc(C)c2)c1	744809271	GQOSKLKQXUTNPP-UHFFFAOYSA-N	437.449	1.050	50	20	IDGD	
CC(=NNC(=O)C(=O)NC(C)C)c1ccc(S(=O)(=O)NCc2ccc(F)cc2)cc1	744817600	LFTQXBOCCHLROM-UHFFFAOYSA-N	434.493	1.669	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)NCCc1ccn(-c2ccc(F)cc2)n1	745891798	DZYUZWNYBUDYNI-UHFFFAOYSA-N	442.407	1.872	50	20	IDGD	
Cc1ccc(C(=O)C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)cc1	746032916	BWMRHQGKCVWAAT-UHFFFAOYSA-N	429.498	1.814	50	20	IDGD	
C[C@H](CC(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)c1cccc(F)c1	746084146	BVXPIZFURFVHAZ-ACJLOTCBSA-N	444.415	1.565	50	20	IDGD	
CS(=O)(=O)N1CCCc2cc(C(=O)NNC(=O)Cc3cn4ccccc4n3)ccc21	746545728	UFUYFZNZPMMTKU-UHFFFAOYSA-N	427.486	1.050	50	20	IDGD	
COc1cc(C)nc(NNC(=O)[C@@H](CCSC)NS(=O)(=O)c2ccccc2)n1	746624089	WEYPURXJCYMIQC-CQSZACIVSA-N	425.536	1.337	50	20	IDGD	
Cc1ccc(-n2cnnn2)cc1NC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	747443458	BQYURNFNDMDBIM-UHFFFAOYSA-N	430.450	1.232	50	20	IDGD	
Cc1nc(Cl)cc(NNC(=O)c2ccc(C)c(S(=O)(=O)N3CCOCC3)c2)n1	748338863	KRPCUXOIFVHKEZ-UHFFFAOYSA-N	425.898	1.525	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c2c(c1)OCCO2)c1ccc(-n2cnnn2)cc1	748700561	PMWSJXSTRAFIKY-UHFFFAOYSA-N	445.233	1.271	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)[C@@H]1CC(=O)N(c2cccc3ccccc23)C1	751209761	SEQVSEYZVWROHV-OAHLLOKOSA-N	436.493	1.832	50	20	IDGD	
CCNS(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(Br)ccc2O)c1	751392110	LJVQGDMGUJRKPP-UHFFFAOYSA-N	442.291	1.528	50	20	IDGD	
CCCN(CCC)S(=O)(=O)N1CCN(C(=O)NNC(=O)c2ccccc2C)CC1	753033077	OYZDMTMOUACMOO-UHFFFAOYSA-N	425.555	1.334	50	20	IDGD	
COc1c(S(=O)(=O)NNC(=O)c2cnccn2)cc(Br)c(C)c1[N+](=O)[O-]	755002010	NVLJPBRLCUVURW-UHFFFAOYSA-N	446.239	1.088	50	20	IDGD	
O=C(NCCN1C(=O)[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)NNC(=O)c1cccc(Br)c1	755175721	HKXLZZGFRCGPCZ-LWWSYDQCSA-N	447.289	1.200	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)Nc2cccc(CN3CCCCC3=O)c2)c2ccccc2c1=O	756292028	ODPJYLFOMQZNHI-UHFFFAOYSA-N	448.483	1.913	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)Nc1cnn(CC(=O)N(C)C)c1	756801693	MILXBYINELLUTF-UHFFFAOYSA-N	427.490	1.870	50	20	IDGD	
CN(C)C(=O)Cn1cc(NC(=O)NNC(=O)COc2cccc(C(F)(F)F)c2)cn1	756803136	XEMUCAFPPHPGOJ-UHFFFAOYSA-N	428.371	1.222	50	20	IDGD	
COc1ccccc1N1CC[C@@H](NC(=O)NNC(=O)c2ccc3c(c2)OCCO3)C1=O	757288218	WALGURJSJOZYFQ-CQSZACIVSA-N	426.429	1.216	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2cccc(OCCF)c2)cc1	757680442	VORGMTYZNRAHIX-UHFFFAOYSA-N	438.481	1.817	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)Nc2cccc(S(=O)(=O)NCc3ccco3)c2)n1	757866204	JCNZCOBZEGAALS-UHFFFAOYSA-N	446.489	1.424	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)[C@@H](Sc1ccc(F)cc1F)c1ccccc1	758028011	BFVUHNPURAUOIG-BZNIZROVSA-N	443.497	1.883	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccc(Br)cc21)c1ccc(-n2cnnn2)cc1	758096127	PWGKMFCVUGAFGA-CQSZACIVSA-N	429.234	1.362	50	20	IDGD	
O=C(NNc1nc(O)c2ccccc2n1)c1ccc2c(c1)C(=O)N(C[C@@H]1CCCO1)C2=O	758299034	AGUUXZMUXUHXJY-ZDUSSCGKSA-N	433.424	1.867	50	20	IDGD	
COc1cc(C(=O)N2CCN(S(=O)(=O)CBr)CC2)cc2c1O[C@@H](C)C2	758535183	MWUUURISFVTRSM-NSHDSACASA-N	433.324	1.459	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@H](C#N)[C@@H](NC(=O)NNC(=O)COc2ccc(C#N)cc2)C1	758752255	MECSLELMWGWWLK-ZBFHGGJFSA-N	428.449	1.027	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)C(=O)Nc1ccccn1)c1noc(-c2ccc(Cl)cc2)n1	758841938	ZABKOWWMBFQPJX-SNVBAGLBSA-N	429.824	1.815	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)c2cccc(NC(=O)CSc3nncn3C)c2)nc1	759738850	SKESJIXIZSWXRC-UHFFFAOYSA-N	441.473	1.484	50	20	IDGD	
CCN1CCN(S(=O)(=O)c2ccc(Cl)c(C(=O)NNc3ncc(F)cn3)c2)CC1	760922748	ODHFPHMVKCPAPS-UHFFFAOYSA-N	442.904	1.352	50	20	IDGD	
COc1cc(C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc2c1O[C@@H](C)C2	761065979	PQXPAEVSJRADMO-NSHDSACASA-N	429.385	1.545	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)CN(CCc2ccccc2)C(C)=O)n[nH]1	761486593	CXISCWFJNGMSHR-UHFFFAOYSA-N	435.484	1.938	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c(Cl)c1	763532348	WLGMPTWZIWLGAD-UHFFFAOYSA-N	443.935	1.947	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccccc2N2CCCC2)cc(OC)c1OC	763539652	OOXNPXXJGXQFKE-UHFFFAOYSA-N	442.472	1.712	50	20	IDGD	
COC(=O)c1cc(C)ccc1NC(=O)C(=O)NNC(=O)c1cc(OC)c(OC)c(OC)c1	763540578	WVYVJUZKEZIUOG-UHFFFAOYSA-N	445.428	1.207	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2F)cc1N1CCCCC1=O	763575252	SCQNXIAMHFATJE-UHFFFAOYSA-N	428.420	1.751	50	20	IDGD	
COCCn1ccc2ccc(NC(=O)C(=O)NNC(=O)COc3ccc(OC)cc3)cc21	763660821	HLLWYHDUNGCGFB-UHFFFAOYSA-N	440.456	1.461	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cnn(-c3ccccc3F)c2C)cc1	763661888	QNJMZOMSORGQKH-UHFFFAOYSA-N	441.419	1.493	50	20	IDGD	
Cc1nc2cc(NC(=O)C(=O)NNC(=O)c3nn(C(C)C)c(=O)c4ccccc34)ccc2o1	763790752	NYNGBMCQVNUOLC-UHFFFAOYSA-N	448.439	1.827	50	20	IDGD	
COC(=O)c1csc(NC(=O)C(=O)NNC(=O)CCSc2ccc(F)cc2)c1	763895129	KZTUESWBDXDTCJ-UHFFFAOYSA-N	425.463	1.942	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(C(N)=O)ccc2C)cc1OC	763912043	LQWXUFBVJRGUSF-UHFFFAOYSA-N	442.472	1.681	50	20	IDGD	
COC(=O)c1cc(C(C)C)ccc1NC(=O)C(=O)NNC(=O)c1ccc2c(c1)OCCO2	764006202	MAZMFCOSBULHLY-UHFFFAOYSA-N	441.440	1.768	50	20	IDGD	
COc1cc(C(=O)N(C)C)ccc1NC(=O)C(=O)NNC(=O)c1ccc(Cl)cc1OC	764010876	DSFLMXFTQGPACU-UHFFFAOYSA-N	448.863	1.459	50	20	IDGD	
O=C(NNC(=O)c1cccc(C(F)(F)F)c1)C(=O)Nc1ccc2c(c1)S(=O)(=O)CC2	764037958	XNWGRLKJAHFOOB-UHFFFAOYSA-N	441.387	1.435	50	20	IDGD	
CCCS(=O)(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2ccccc2OC)c1C	764047111	BPQWCVNLFQGQJM-UHFFFAOYSA-N	448.501	1.555	50	20	IDGD	
NC(=O)CCOc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(Br)c2)cc1	764058967	LJRNZCJCNSAXHK-UHFFFAOYSA-N	449.261	1.103	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccccc2C(F)(F)F)c1	764077743	MTWGTVDHIPBFID-UHFFFAOYSA-N	429.376	1.509	50	20	IDGD	
CCN(Cc1cccc(NC(=O)C(=O)NNC(=O)Cc2cc[nH]n2)c1)C(=O)OC(C)(C)C	764297357	PGXOGJAEXATBBZ-UHFFFAOYSA-N	444.492	1.495	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)C(=O)Nc1ccc(OCC(F)(F)F)cc1	764366531	MZEVBBVBUOKCDH-UHFFFAOYSA-N	425.363	1.930	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1ccc(-c2ncon2)cc1	764394336	ZVCCPNAYVKIAMF-UHFFFAOYSA-N	427.442	1.623	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@H]2CCO[C@H](C(C)(C)C)C2)cc1	764509550	AEIYHELDNWZMCI-RDJZCZTQSA-N	440.566	1.540	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@@H](C)C(=O)NNC(=O)Nc1nc(CS(C)(=O)=O)no1	765246438	IJNWCHVXEDDDJM-JTQLQIEISA-N	445.885	1.505	50	20	IDGD	
CC[C@H](O[C@H]1CCC[C@@H](C)C1)C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765735320	JWKDCHRHALSUHS-GIVPXCGWSA-N	444.576	1.966	50	20	IDGD	
COc1cccc(COCC(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)c1	766643568	YAWFSXRJXGLYHE-UHFFFAOYSA-N	440.544	1.485	50	20	IDGD	
COc1ccc(-n2nnc(C(=O)NNc3c(OC)cccc3S(C)(=O)=O)c2C)cc1	768628674	LENFLBKIRLCAHE-UHFFFAOYSA-N	431.474	1.753	50	20	IDGD	
CC(C)(C)OC(=O)N1Cc2ccc(C(=O)NNC(=O)N[C@@H]3CCS(=O)(=O)C3)cc2C1	768981933	PDDGVFRCCDKPQF-OAHLLOKOSA-N	438.506	1.068	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=S)NCCSC)c1	769769508	NJCADAIHSQTZRV-UHFFFAOYSA-N	439.028	1.842	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NCc2cccc3c2OCCCO3)cc1	770084118	FEMTXOQBIKTWHF-UHFFFAOYSA-N	434.474	1.787	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)NCC3(N4CCCC4)CCOCC3)nc21	770381391	ACELJOMVTJQWTQ-UHFFFAOYSA-N	432.529	1.558	50	20	IDGD	
O=C(NNC(=O)c1cccc2nccn12)c1cccc(S(=O)(=O)NCc2ccccc2)c1	770644829	PBFPNYXRNZWURJ-UHFFFAOYSA-N	449.492	1.888	50	20	IDGD	
CCNS(=O)(=O)c1ccc(C)c(C(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)c1	770965778	NBWDNNCDHVPPFS-UHFFFAOYSA-N	447.521	1.650	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)CN1C(=O)c2cc(Cl)c(Cl)cc2C1=O	771939962	MVOOUKPEAZNIRA-SECBINFHSA-N	444.271	1.715	50	20	IDGD	
COc1cc(OC)cc(N2C[C@@H](C(=O)O[C@@H](C)C(=O)NNC(=O)CC(C)C)CC2=O)c1	772180185	AKEINRBFSLIBMT-KBPBESRZSA-N	435.477	1.182	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)c1ccn(-c2c(F)cccc2F)n1	772194970	FTYUHBKRKBHFPL-UHFFFAOYSA-N	433.802	1.881	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C1=NN(c2ccccc2)[C@@H](C(N)=O)C1	772970397	BVMZEROGIHFZGH-YVEFUNNKSA-N	429.864	1.375	50	20	IDGD	
N#C/C(=C/c1ccc(O)cc1)C(=O)Nc1cccc(S(=O)(=O)N2CCNC(=O)C2)c1	776622733	MSYCNSMPAUWVES-GDNBJRDFSA-N	426.454	1.058	50	20	IDGD	
COC(=O)Nc1ccc(S(=O)(=O)NNC(=O)c2ccc(Cl)nc2)cc1[N+](=O)[O-]	777607584	IMEVJNZPBKXKIJ-UHFFFAOYSA-N	429.798	1.445	50	20	IDGD	
CC(C)(C)OC(=O)NCC(F)(F)CNC(=O)NNC(=O)[C@H]1COc2ccccc2O1	777677704	LPNPKDZZIODEIH-CYBMUJFWSA-N	430.408	1.317	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2cc3c(cc2F)NC(=O)CC3)c1	778707328	PHNIDTNARCWFGP-UHFFFAOYSA-N	428.420	1.492	50	20	IDGD	
COCc1noc(CN2CCN(C(=O)NNC(=O)c3cc4c(s3)CC[C@@H](C)C4)CC2)n1	780946611	MQBVARAPDWCBHC-CYBMUJFWSA-N	448.549	1.575	50	20	IDGD	
COC(=O)C1(CNC(=O)NNC(=O)COc2ccc(Br)cc2)CCOCC1	781839001	FZFXJYOFDFSMIE-UHFFFAOYSA-N	444.282	1.128	50	20	IDGD	
CC(=O)N1CCN(Cc2ccccc2NC(=O)NNC(=O)COc2cccc(C)c2)CC1	782079176	RTIMVEOJFVZPEN-UHFFFAOYSA-N	439.516	1.891	50	20	IDGD	
N#C/C(=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)O[C@@H]1CCOC1=O	782180073	CSSXNRSMNSIUSM-LRFDDAOPSA-N	428.832	1.845	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)cc1)C(=O)Nc1ccc(N2CCSCC2)c(Cl)c1	782835756	DRZYAAKQEPFOET-UHFFFAOYSA-N	434.905	1.999	50	20	IDGD	
C=CCN(C)S(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)Nc2ccccc2C)cc1	783415500	DYRHFMPFENNQSI-UHFFFAOYSA-N	445.501	1.593	50	20	IDGD	
Cc1ccccc1NC(=O)NNC(=O)C(=O)Nc1cccc(S(=O)(=O)NC2CC2)c1C	783417612	WVCMUMJQZHAPEI-UHFFFAOYSA-N	445.501	1.536	50	20	IDGD	
CC(C)(C)c1nsc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)n1	784216041	MKLWTUPAJSYIOS-UHFFFAOYSA-N	438.535	1.358	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)[C@@H]2CC=CC[C@@H]2C(=O)N2CCOCC2)c1C	784293133	GHZQYFRUWVGWII-QRVBRYPASA-N	429.517	1.659	50	20	IDGD	
O=C(NNc1ccnc(F)c1)C(=O)Nc1cccc(S(=O)(=O)NC2=NCCCCC2)c1	784846866	HWGYTNSCJHCYDE-UHFFFAOYSA-N	448.480	1.553	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNc2ccc(Cl)nc2)cc(S(C)(=O)=O)c1	784869859	QBXSRMGEOLXBAX-UHFFFAOYSA-N	440.865	1.397	50	20	IDGD	
CS(=O)(=O)c1c(F)cc(NC(=O)C(=O)NNc2cccc(C(F)(F)F)n2)cc1F	784951984	ZOQZAEBZVGECAO-UHFFFAOYSA-N	438.334	1.864	50	20	IDGD	
CN(C)c1nccc(NNC(=O)C(=O)Nc2cccc(C(=O)N3CCc4ccccc43)c2)n1	784971027	QPNWEAWVWATYLY-UHFFFAOYSA-N	445.483	1.827	50	20	IDGD	
CCOC(=O)/C=C/c1ccc(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)cc1	785059995	GAZRKETWEWLEAV-DHZHZOJOSA-N	435.440	1.239	50	20	IDGD	
COc1cc(F)cc(NNC(=O)C(=O)Nc2ccc(F)c(N3CCCS3(=O)=O)c2)c1	785242371	YVJQOWJSSPQCLN-UHFFFAOYSA-N	440.428	1.595	50	20	IDGD	
COCCOc1cccc(NC(=O)C(=O)NNc2c(OC)cccc2S(C)(=O)=O)c1	785339234	RWTUGKYRWRBGBG-UHFFFAOYSA-N	437.474	1.206	50	20	IDGD	
O=C(COC(=O)[C@H]1[C@H](C(F)(F)F)[C@H]2CC[C@H]1O2)NNC(=O)c1ccc([N+](=O)[O-])cc1	785802035	UXMOORPQRGYMFO-HBJVGIJOSA-N	431.323	1.255	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2cc(Br)c(F)cc2F)n1	786414026	JERIXSSQHVZRKJ-UHFFFAOYSA-N	430.209	1.327	50	20	IDGD	
NC(=O)[C@H]1CCC[C@H](C(=O)NNC(=O)c2nc(-c3ccccc3)n(-c3ccccc3)n2)C1	786687829	ITARMAXBPCCUAH-IRXDYDNUSA-N	432.484	1.987	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1cccnc1C(F)(F)F	788591334	QJPBJDOKNFCJSL-UHFFFAOYSA-N	435.406	1.319	50	20	IDGD	
O=C(CNC(=O)c1ccccc1OC(F)F)NNC(=O)c1nn(-c2ccccc2)cc1O	789852581	BRSAJCAGRLPGSY-UHFFFAOYSA-N	445.382	1.370	50	20	IDGD	
CO[C@@H]1CCOc2c(NC(=O)C(=O)NNC(=O)[C@H](C)Oc3ccccc3F)cccc21	790951872	MJDWUULCZKBBJC-BLLLJJGKSA-N	431.420	1.849	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccc(N3CCCCC3)c3ncccc23)n1	792352041	AJWDUGHANZDIFJ-UHFFFAOYSA-N	449.515	1.825	50	20	IDGD	
CN(C)N(C(=O)c1cc(S(=O)(=O)Nc2ccccc2F)c[nH]1)[C@@H]1CCS(=O)(=O)C1	792853621	FYMTUBROUQFAEV-GFCCVEGCSA-N	444.510	1.061	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H]2[C@@H](C1)[C@@H]2C(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	796082188	NITMHCXWSAUIBX-FOLVSLTJSA-N	448.432	1.012	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1)C(=O)c1ccc(O)cc1	798154651	NZVZGHIOCPABFT-UHFFFAOYSA-N	442.435	1.738	50	20	IDGD	
CSC[C@@H](C)C(=O)N1CCC(C(=O)NNC(=O)c2cc(Br)c[nH]2)CC1	799409033	JODOXXUOWDANTI-SNVBAGLBSA-N	431.356	1.776	50	20	IDGD	
Cc1c(/C=C(\C#N)C(=O)NCCNS(=O)(=O)c2ccc(F)cc2F)cc(C#N)n1C	799740782	CGBSZVGSFSCTBZ-VGOFMYFVSA-N	433.440	1.485	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)c2nnn(CCOc3ccc(F)cc3)c2C)c1	800323687	ZNVFWGBFGLULNJ-UHFFFAOYSA-N	427.436	1.953	50	20	IDGD	
Cn1c(=O)c2ccc(C(=O)NNc3cc([N+](=O)[O-])ccc3Br)nc2n(C)c1=O	800618612	CVFUYCMJKLDORE-UHFFFAOYSA-N	449.221	1.060	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)N[C@H]1CCN(C(=O)Nc2ccccc2)C1	801078100	VKBVZANEBPQXLD-INIZCTEOSA-N	449.471	1.828	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)C1CN(C(=O)OC(C)(C)C)C1	802064423	QAQQFTPFDBJECV-GFCCVEGCSA-N	440.522	1.746	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ncc(OC)s2)c1	806513277	GBUHOBNTCIDFKE-UHFFFAOYSA-N	427.508	1.649	50	20	IDGD	
Cc1c(C(F)(F)F)nn(C)c1NC(=O)C(=O)NNC(=O)c1cc(-c2cccs2)[nH]n1	806979243	OVIHXJSHROPJHC-UHFFFAOYSA-N	441.395	1.599	50	20	IDGD	
COC(=O)c1cn(CCNC(=O)NNC(=O)[C@H](C)Oc2ccc3ccccc3c2)nn1	807251106	PVUNPUDCQIIMEF-ZDUSSCGKSA-N	426.433	1.016	50	20	IDGD	
CN1CCN(C(=O)NNC(=O)CSc2nccn2-c2ccc(C(F)(F)F)cc2)CC1	807379019	QGBIDZCWHZHXKD-UHFFFAOYSA-N	442.467	1.971	50	20	IDGD	
CNC(=O)c1cc(Oc2ccc(NC(=O)C(=O)NNc3ncccc3F)cc2F)ccn1	810412571	HVGVXOBJLGPNTN-UHFFFAOYSA-N	442.382	1.989	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)C3(F)CCCCC3)CC2)cc1	810592934	RHRIEFMLLPDAGN-UHFFFAOYSA-N	440.541	1.121	50	20	IDGD	
COCC1(C(=O)NNC(=O)c2cncc(NC(C)=O)c2)CCN(C(=O)OC(C)(C)C)CC1	810663222	OSPIQNHJAJUSBN-UHFFFAOYSA-N	449.508	1.465	50	20	IDGD	
COC(=O)c1ccc(Cl)c(C(=O)OCC(=O)NNC(=O)Cc2nc(C)cs2)c1	811292139	RUWHNAYBUFOZDP-UHFFFAOYSA-N	425.850	1.438	50	20	IDGD	
COCc1cc(NC(=O)C(=O)NNC(=O)c2cc(OC)cc(OC)c2)cc(C(=O)OC)c1	815566221	MGABIBOBBJDSKT-UHFFFAOYSA-N	445.428	1.037	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNc2ncncc2F)c(C)cc1Br	815765446	QXNBXQFMANBKMN-UHFFFAOYSA-N	426.202	1.555	50	20	IDGD	
CCCCn1c(CCC(=O)NNc2nc[nH]n2)nc2cc(S(=O)(=O)N(C)C)ccc21	816632172	XCGPIISOJSQTDC-UHFFFAOYSA-N	434.526	1.281	50	20	IDGD	
O=C(c1cc(-c2cccnc2)nc2c1cnn2Cc1cccnc1)N1CC[C@@H](B(O)O)C1	864232232	XKVCALOVKDLLLD-QGZVFWFLSA-N	428.261	1.626	50	20	IDGD	
O=C(COc1cccc([N+](=O)[O-])c1)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	914750357	DVSORLLUJGCQSJ-UHFFFAOYSA-N	448.457	1.219	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(NC(=O)C(C)C)cc2)cc1OC	914930027	HIGOWSUKURLHQS-UHFFFAOYSA-N	443.456	1.916	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)CN2C(=O)COc3cc(Br)ccc32)c1	915286443	UQOGOXJGJGEDFU-UHFFFAOYSA-N	448.273	1.709	50	20	IDGD	
CNS(=O)(=O)c1ccc(CNC(=O)NNC(=O)COc2ccc(C)c(C)c2)s1	916232818	MBJQIOSLOJEXHF-UHFFFAOYSA-N	426.520	1.182	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NN=Cc2ccc(OCC(=O)O)cc2)c1	916261673	VIBQXXBMVYDAGC-UHFFFAOYSA-N	433.486	1.944	50	20	IDGD	
O=C(CCC(=O)N1CCc2sccc2C1)NNC(=O)c1csc(N2CCOCC2)n1	917683228	FKWSAXKHZMZROR-UHFFFAOYSA-N	449.558	1.167	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)cc1C(=O)O	917717805	NFKCXHJTNMGENN-UHFFFAOYSA-N	440.430	1.043	50	20	IDGD	
C[C@@H]1NC(C(=O)NNC(=O)c2ccc(F)cc2Br)=NN(c2ccccc2)C1=O	918642004	SIQOEHFYSMAHQO-JTQLQIEISA-N	448.252	1.688	50	20	IDGD	
COCCOc1cccc(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)c1	919690583	QBWRKRVVWSZYIW-UHFFFAOYSA-N	427.866	1.087	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)CCNS(=O)(=O)c2cccc(C(C)=O)c2)cc1	919835639	MNSXROQTCKBDDX-UHFFFAOYSA-N	447.513	1.346	50	20	IDGD	
Cc1csc(SCc2ccccc2C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)n1	919889985	XVWCSGJUQXCJRT-CYBMUJFWSA-N	440.572	1.875	50	20	IDGD	
CN(C)N(C(=O)c1ccc(CS(=O)(=O)c2ccccc2)o1)[C@H]1CCS(=O)(=O)C1	1115816214	LJYWVPRAUJDEKY-AWEZNQCLSA-N	426.516	1.359	50	20	IDGD	
COCc1nocc1C(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	1117705124	MSUJJKCCLVELHC-UHFFFAOYSA-N	433.428	1.598	50	20	IDGD	
CC(C)CN(CC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)C(=O)OC(C)(C)C	1252951709	WYGKEVOWVIHEMM-UHFFFAOYSA-N	427.523	1.744	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)Cn2nc3n(c2=O)CCCCC3)cc1OC	1317786353	GEKDEKDPKOHFBW-UHFFFAOYSA-N	431.493	1.420	50	20	IDGD	
COc1cc(Br)c(OC)c(C(=O)NNC(=O)CNC(=O)c2cccs2)c1	1318134958	INPZEMNSLJPBSP-UHFFFAOYSA-N	442.291	1.719	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)NC2CCC3(CC2)OCCO3)CC1	1318625686	IIBHTBRFLVXEJS-UHFFFAOYSA-N	426.514	1.650	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)c2nc(C3CC3)n(-c3ccccc3)n2)cc1	1318882444	VTIXNTGABNLEFN-UHFFFAOYSA-N	430.424	1.634	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)Cn2cc(C(F)(F)F)ccc2=O)cc1	1321446361	ODPWIQOZVYFEGR-UHFFFAOYSA-N	432.380	1.124	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H]2CCCC[C@@H]2N(C)C)c1	1322740633	OBSHKAPNEIXPRP-ROUUACIJSA-N	439.582	1.534	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccn4ccnc4c3)C2)C1	1778570001	JKNNGBGQAXJCEN-BEFAXECRSA-N	435.322	1.951	50	20	IDGD	
C[C@H](Nc1cnccn1)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2	1779059268	RLKQDZDVMRMAPM-DOPJRALCSA-N	430.336	1.343	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc4ncsc4[nH]3)C2)C1	1779341141	JDQXPPNELRVREF-QFYYESIMSA-N	427.324	1.851	50	20	IDGD	
CN(C)c1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](F)Br)C3)C2)cn1	1781331665	OMJOKPZRHBGGFX-YOEHRIQHSA-N	429.290	1.282	50	20	IDGD	
Cn1nc2c(c1C(=O)N1CCO[C@]3(CCN(C(=O)[C@H](F)Br)C3)C1)CCC2	1781332799	JICWGQNOXBNKNL-YOEHRIQHSA-N	429.290	1.043	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C(=O)c2ccc(C)cc2)C1	1782097774	KIYPESBBFOTUIZ-JBYIUTFZSA-N	436.936	1.945	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CCC(=O)NN(C)C)C2)s1	1782210690	CLXIPZXIEMHWOF-DYESRHJHSA-N	436.578	1.557	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnn4c3CCC4)C2)C1	1782313906	FUSZAIFPLXPFSK-UGSOOPFHSA-N	425.327	1.304	50	20	IDGD	
Cc1ccc(C)c(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C3)c1	1782894800	HHKQPXSPDUFHGF-HYBUGGRVSA-N	444.576	1.804	50	20	IDGD	
COc1ccc(F)c(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](O)CCl)C3)c1	1782920708	IRYZFJSBZCGMKA-MBOZVWFJSA-N	428.888	1.562	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cc(C(C)(C)C)n[nH]3)CCO2)C1	1783536725	IPJQRYSBKCSJGL-KZULUSFZSA-N	427.343	1.934	50	20	IDGD	
Cc1ccc(CCC(=O)N2CCO[C@@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc1F	1783933691	VRXIUQFRYQOXOZ-HSZRJFAPSA-N	448.539	1.270	50	20	IDGD	
CC[C@H](C(=O)N1CCO[C@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1)c1ccccc1	1783936361	MGBOGWRWOUXSCL-CVDCTZTESA-N	430.549	1.383	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccnc3S)C[C@@H]21	1783964125	KRQWBIVJCRVICL-DHMWGJHJSA-N	442.379	1.995	50	20	IDGD	
CCC[C@H](NC(C)=O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]2C1	1783975599	OCTZEDQTCCLDEO-VFTHGPRRSA-N	446.386	1.302	50	20	IDGD	
Cc1nccn1CCCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1784409892	TXQRBMUDACJEIR-RDJZCZTQSA-N	431.306	1.492	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](O)C(=O)NC1(c2ccc(NC(=O)[C@@H](O)CCl)cc2)CCC1	1786135583	KDZFUNCXWPGNQW-GOEBONIOSA-N	441.912	1.563	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(=O)cco3)[C@H]2C1	1786284314	BMKSWKXLLZTKTN-ZIEJDFEHSA-N	427.295	1.407	50	20	IDGD	
O=C(COc1cccnc1)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1	1786756829	HKFICFBXHQLANJ-UHFFFAOYSA-N	445.284	1.588	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3cscn3)[C@H]2C1	1787041424	NGXKSHUQNZQNPK-MHEUCROKSA-N	430.368	1.839	50	20	IDGD	
C[C@H](CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]2C1)NC(=O)OC(C)(C)C	1787446050	SVALSEGXWZCKGJ-BLDNINTCSA-N	435.924	1.804	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(OC)n(C)n3)[C@H]2C1	1789401509	KGRQENVYOFKBRS-XPCVCDNBSA-N	443.342	1.196	50	20	IDGD	
COc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Br)C[C@@H]32)c(O)c1	1789482436	ZGMZNTTYDCRFHD-NHJBHEPMSA-N	445.285	1.685	50	20	IDGD	
O=C(NC1(c2ccc(NC(=O)c3ccncc3O)cc2)CCC1)c1cccc(B(O)O)c1	1789701169	LKFCUHOTQXSUGS-UHFFFAOYSA-N	431.257	1.529	50	20	IDGD	
Cc1cncc(CCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]3C2)c1	1789922621	QCQFQCSQRIGMNS-NBOOPKSLSA-N	442.329	1.993	50	20	IDGD	
C[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]21)c1cccs1	1791555899	PFBMETRTDQLKPQ-QZWWFDLISA-N	436.578	1.204	50	20	IDGD	
CC(C)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cncn1-c1ccncc1)C2	1792784893	VBEVMNXJXXVAEL-JLVBRIDZSA-N	431.924	1.736	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCOc1ccc(F)cc1)c1cccc(B(O)O)c1	1792813942	UPZGRLCGJVZPPF-ACDBMABISA-N	440.280	1.226	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCc1ccccn1	1794488882	ROCKWJVCYAMQMR-INZAXJFKSA-N	436.516	1.786	50	20	IDGD	
O=C(CCOc1ccc(F)cc1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1	1796189713	QPHCMPVEJSFUBJ-ACDBMABISA-N	440.280	1.226	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1csc3c1CCCO3)C2)[C@H](F)Br	1799346697	WVOWGEGMECINRE-DJBIQUGXSA-N	447.326	1.967	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)cc([N+](=O)[O-])c1	1799732020	GAXFSQHCRNRYES-ADGXKJENSA-N	442.266	1.287	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(-n2cncn2)c1	1799774720	YYDGZMYYRBEWTC-UKBAYJJMSA-N	431.924	1.878	50	20	IDGD	
Cc1cccc2c(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@@H](C)Br)C4)n[nH]c12	1800074102	CIQCFSXWZYYPTG-NFFDBFGFSA-N	435.322	1.858	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2)[C@H](O)c1ccccc1Cl	1801198894	GFAVOTOTQUBSTQ-CZAMWMTLSA-N	445.741	1.748	50	20	IDGD	
COC[C@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](NC(C)=O)c1ccc(F)cc1)C2	1802283847	QTQJOULFTWFUQB-XCDZQEORSA-N	439.915	1.895	50	20	IDGD	
CC(C)c1nc(CC(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]2c2cccnc2)no1	1803135786	HNAHTBDQOYHZIM-IIDMSEBBSA-N	435.912	1.436	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)CCC(F)(F)F)[C@H]1c1cccnc1	1806832421	PYLKPGWYLUTUCV-DNVCBOLYSA-N	443.470	1.803	50	20	IDGD	
CC[C@@H](NC(N)=O)C(=O)N1CCCC2(CCN(C(=O)[C@@H](C)CBr)CC2)C1	1810811819	LMOVFPDGHODOGF-UONOGXRCSA-N	431.375	1.696	50	20	IDGD	
COc1nc(C)ccc1C(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1	1811045002	FWCRALFRHJKWEG-CGTJXYLNSA-N	432.908	1.713	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1)c1c[nH]c(=O)cn1	1811452184	NJHMGJSGIBILLS-CXAGYDPISA-N	434.294	1.270	50	20	IDGD	
Cc1ccc(C(=O)C(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)cc1	1812961998	YLAOWJXMHNYLPF-FHWLQOOXSA-N	429.904	1.878	50	20	IDGD	
COCCn1ccc(C(=O)N2CC[C@H](CNC(=O)[C@@H](Cl)COC)[C@@H]2c2cccnc2)n1	1813030338	HXHCOCUHPLMCDH-AOIWGVFYSA-N	449.939	1.498	50	20	IDGD	
Cc1cccnc1C(=O)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1	1815350599	ZNUVBMRIFQRZKK-HNNXBMFYSA-N	436.302	1.066	50	20	IDGD	
Cc1ccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)nc1C	1816235953	STRPPESNDKKZLS-FQEVSTJZSA-N	447.304	1.721	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)C1CCC1)CC2	1817277304	PJLPEASBUGMOHN-OBPDLJBASA-N	428.518	1.989	50	20	IDGD	
CNCCCC(=O)Nc1cc([C@H]2CCCCN2C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[nH]n1	1817309084	XCEZBLBUXQOXPW-NFXIUMSZSA-N	442.524	1.535	50	20	IDGD	
COc1nccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)[C@H](O)CCl)[nH]n2)c1F	1817664101	GOFIGJCKZWQKSF-CHWSQXEVSA-N	425.848	1.858	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(OC)nn3)sc2C1	1821073509	YARRSDZQPQQBBC-UWVGGRQHSA-N	425.898	1.421	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1822185205	YYCGYNYKQNSCLU-ABAIWWIYSA-N	449.114	1.179	50	20	IDGD	
Cn1ccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)c1	1825724945	YWMHHZKFTXVERX-FQEVSTJZSA-N	438.532	1.571	50	20	IDGD	
CCc1cc(C(=O)N[C@@H]2CCc3nc(NC(=O)[C@H](Cl)COC)sc3C2)nn1C	1826003604	OECYWQWIDJXTCE-ZYHUDNBSSA-N	425.942	1.919	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2CCC(=O)N2)CC1	1826536913	JVHWTKPPYGRNNX-KBMXLJTQSA-N	428.371	1.916	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(C(N)=O)cc3)sc2C1	1827506886	YDTMGGVZOIYZLR-CHWSQXEVSA-N	436.921	1.722	50	20	IDGD	
CC(C)OCC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1	1828921846	CFGXZKXPQUVBIN-IBGZPJMESA-N	431.537	1.343	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnc(Cl)nc3)CCO2)C1	1829513793	CKKWROBESGCVMM-RDTXWAMCSA-N	431.320	1.608	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)CC34CCCN3CCC4)C2)C1	1830363646	GMJDWRLCLLWPJT-QFIPXVFZSA-N	442.000	1.726	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)C(F)(F)C(F)F)CCO2)C1	1832189750	MHZUOOGWBLQMQT-UONOGXRCSA-N	439.233	1.580	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)C(F)(F)C(F)F)CCO2)C1	1832189752	MHZUOOGWBLQMQT-ZIAGYGMSSA-N	439.233	1.580	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H]3Cc4ccccc4O3)CC2)CC1)[C@H](O)CCl	1833309852	BHMNRFSPIUMEDI-UYAOXDASSA-N	435.952	1.161	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccnc(C(F)F)c3)CCO2)C1	1833324056	MFUCFWSHNCEVPD-IFXJQAMLSA-N	447.866	1.343	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)[C@H](COC)NC(C)=O)CC2)CC1	1833533348	BFARQIAQUGYSRF-OALUTQOASA-N	445.004	1.117	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](C)Cn3cccn3)CC2)CC1	1833890500	ZIRZGGBOKXRMLX-QFBILLFUSA-N	439.988	1.345	50	20	IDGD	
Cc1nn(C)c(C(=O)NC2CCN(C3CCN(C(=O)C(Cl)Cl)CC3)CC2)c1F	1834030356	VEALIKJCNFFCPV-UHFFFAOYSA-N	434.343	1.857	50	20	IDGD	
O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)c1cnoc1C1CC1)CCO2	1834612736	RGBRDELHWVXSLK-SFHVURJKSA-N	442.310	1.407	50	20	IDGD	
Cc1ccn(C)c1C(=O)N1CCOC[C@]2(CN(C(=O)CCBr)CCO2)C1	1834824019	RDHNXKXDSMFAMX-SFHVURJKSA-N	428.327	1.189	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cnn4ncccc34)CC2)CC1	1835040515	PTWHMJCMYZGCJW-SFHVURJKSA-N	448.955	1.168	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cc4ncccn4n3)CC2)CC1	1835542695	AIAIJTWVTVXOSE-KRWDZBQOSA-N	432.956	1.932	50	20	IDGD	
C=CC[C@H](C(=C)C)C(=O)NC1CCN(C2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1	1835683365	BVHVOALXMOPAIK-OAQYLSRUSA-N	447.624	1.699	50	20	IDGD	
N[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1)c1cccc(Cl)c1	1835730980	PZEYIZGQKHDZOM-RLFYNMQTSA-N	434.295	1.331	50	20	IDGD	
COc1ccsc1C(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836718267	MRACTMKWVZAKQW-OAHLLOKOSA-N	430.954	1.969	50	20	IDGD	
O=C(c1cccc2nccn12)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836718703	AJGKDIGZRRBGKA-GOSISDBHSA-N	434.924	1.546	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc4ncccn4n3)CCO2)C1	1836866215	BAIOKIVOOPFBRQ-MGPUTAFESA-N	435.912	1.207	50	20	IDGD	
O=C(c1cncnc1)N1CCC(OC2CCN(C(=O)[C@H](F)Br)CC2)CC1	1837507269	KTUIOQKCLVHHGX-HNNXBMFYSA-N	429.290	1.779	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3Cl)C2)C1	1837715553	WUNWCHXAQLEGNR-IBGZPJMESA-N	441.988	1.657	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cccnc3Cl)C2)C1	1839142489	QGSFYECMYAYZGZ-KXBFYZLASA-N	430.332	1.751	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc(C(C)(C)C)cn3)C2)C1	1839144504	CDNUSIPHHANCIX-BTYIYWSLSA-N	438.956	1.862	50	20	IDGD	
CN1CCCC[C@H]1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2	1839150663	SWRXSEKCDBLYTM-ZYSHUDEJSA-N	436.380	1.163	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(F)nc3)C2)C1	1839153912	VTAUNVSHIFEDHT-ROUUACIJSA-N	434.295	1.527	50	20	IDGD	
CC(C)c1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)n[nH]1	1839153955	WTGRXRXHAGIEPQ-OALUTQOASA-N	447.363	1.839	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3ccoc3)C2)C1	1839156623	WCDCKPRKHNLWBZ-RBUKOAKNSA-N	433.332	1.905	50	20	IDGD	
Cc1cccnc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839198606	KGDSTTGPMQAOEJ-WMLDXEAASA-N	430.274	1.151	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CCC=CO3)C2)C1	1839964981	KGLLOZHONLMQNX-DAYGRLMNSA-N	431.327	1.309	50	20	IDGD	
COC1(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)CCC1	1840036306	IPPPPBBNKIXITG-KDOFPFPSSA-N	433.343	1.185	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(F)c[nH]3)CCO2)C1	1840063855	QFANASFFJXPWIP-YVEFUNNKSA-N	432.290	1.255	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3cccnc3C)C2)C1	1840149933	BYKFIDRJJRMNGC-RXVVDRJESA-N	439.940	1.033	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3c(C)nn(C)c3C)CCO2)C1	1840436835	AWKDTCRFGZFJOP-YLJYHZDGSA-N	426.945	1.053	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)N2CC3(CCCN3C(=O)[C@H](O)CCl)C2)CC1	1841351365	MKGJRKIPOBBPNJ-JKSUJKDBSA-N	443.972	1.827	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@](C)(C(=O)N2CC3(CCCN3C(=O)[C@H](O)CCl)C2)C1	1841354506	FELDAEKBOJAJFP-FOIQADDNSA-N	443.972	1.827	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@H]2CN(C(=O)OC(C)(C)C)CCO2)C1	1841428403	BOVBOSGXQMFKQJ-CABCVRRESA-N	429.945	1.843	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](C(=O)N1CCCC12CN(C(=O)[C@@H](O)CCl)C2)C(C)(C)C	1843323000	OQUDTYVNGFSLDN-UONOGXRCSA-N	431.961	1.729	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)c2c(Cl)ccc3c2OCO3)C1	1843707208	ZGOVIUVTNJRITJ-UHFFFAOYSA-N	436.896	1.259	50	20	IDGD	
COc1cc(C(=O)N2CC3(CCCN3C(=O)CO[Si](C)(C)C)C2)c([N+](=O)[O-])cc1O	1844378682	TXLVZBCFMVDJON-UHFFFAOYSA-N	437.525	1.978	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@H]2CN(C(=O)OC(C)(C)C)C[C@H]2O)C1	1845107822	NHINRYXFIPAQHH-SOUVJXGZSA-N	429.945	1.435	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@H]2CCCN2C(=O)OC(C)(C)C)C1	1846202454	JOVBDQVLNWNJKF-HUUCEWRRSA-N	429.945	1.843	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@]13C[C@@H]1CCN3C(=O)OC(C)(C)C)C2	1846364809	KQACJYZDYRZPED-PDSXEYIOSA-N	441.956	1.843	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)Cc1ccc3c(c1)CCCO3)C2	1846384987	HWPVZNYRTNUVMH-UHFFFAOYSA-N	428.533	1.131	50	20	IDGD	
CCn1c(NNC(=O)CCNS(=O)(=O)c2cc(C)ccc2C)nc2ccccc2c1=O	10680543	ZPTUOAAGUJNIGW-UHFFFAOYSA-N	443.529	1.845	50	20	IDGD	
O=C(CN1CCSC1=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	15427874	KEZKCJRPQFPDOT-UHFFFAOYSA-N	440.528	1.479	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)c1c(-n2cccc2)sc2c1CCSC2	16146013	RRLAJXCAGYZRDJ-NSHDSACASA-N	425.557	1.524	50	20	IDGD	
NC(=O)NCCCCC(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	26773522	JTGDECGQCQNGBL-UHFFFAOYSA-N	436.472	1.044	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)Cn1nnc2ccccc2c1=O	105181675	CAEQDSXMYWKIAO-NSHDSACASA-N	446.261	1.169	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NCc1cccc(NC(=O)[C@H]2CCCO2)c1	726242183	VRJKHWZAWSFUKP-OAHLLOKOSA-N	445.501	1.126	50	20	IDGD	
C#Cc1cccc(NC(=S)NNC(=O)[C@H]2CS[C@@H](Cc3ccccc3F)C(=O)N2)c1	727499678	LAPULZZQLMSYGM-MSOLQXFVSA-N	442.541	1.968	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CN2C(=O)COc3cc(Br)ccc32)c1	728825290	SLEUZDIEXGFISA-UHFFFAOYSA-N	429.230	1.507	50	20	IDGD	
COCCOc1cn(-c2ccccc2)nc1C(=O)NNC(=O)c1c(C)nc2ccccn12	729304405	RJFGZGGSJUBFGN-UHFFFAOYSA-N	434.456	1.928	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)N[C@@H](C)[C@H](C)N2CCOCC2)c2ccccc2c1=O	729624664	WMOYFYLMJNKYIM-GJZGRUSLSA-N	430.509	1.031	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H](CCNC(=O)NNC(=O)[C@H]2COc3ccccc3O2)C1	730138974	LGRKKMBVCIEOSR-RHSMWYFYSA-N	434.493	1.804	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)[C@H](CCSC)NC(=O)c1ccc([N+](=O)[O-])o1	731493852	IMHOCNQKCMLJHY-LBPRGKRZSA-N	436.446	1.509	50	20	IDGD	
CC(C)[C@H](NC(=O)OCc1ccccc1)C(=O)NNC(=O)CCN1C[C@H](C)O[C@@H](C)C1	732261413	MTOTXPSCGVAKRQ-ZWOKBUDYSA-N	434.537	1.584	50	20	IDGD	
CC(C)CNS(=O)(=O)c1ccc(C(=O)NNc2ccccc2S(C)(=O)=O)cc1	732305305	IECRGFSNYJZLAR-UHFFFAOYSA-N	425.532	1.781	50	20	IDGD	
O=C(COC(=O)c1cc(-c2ccc(F)cc2)[nH]n1)NNC(=O)c1cccc([N+](=O)[O-])c1	732328455	ZEAFRSRAHNXNNZ-UHFFFAOYSA-N	427.348	1.742	50	20	IDGD	
COC(=O)CCCS(=O)(=O)NC(=O)/C(C#N)=C/c1cc(C)n(C[C@H]2CCCO2)c1C	734090621	VLCTULHJXGVZDH-ZKTNYTPDSA-N	437.518	1.590	50	20	IDGD	
COc1ccc(CN2CC[C@@H](NC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)C2=O)cc1	734685814	VVSRORJWPYDUDT-QGZVFWFLSA-N	427.417	1.349	50	20	IDGD	
CC(C)[C@H](CNC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)NC(=O)OC(C)(C)C	734690811	YTTXCWUGDAJKTQ-HNNXBMFYSA-N	446.508	1.427	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2ccc(F)c(NC(C)=O)c2)cc(OC)c1OC	736540236	WDNDJUCCYWFMOF-UHFFFAOYSA-N	441.437	1.433	50	20	IDGD	
O=C(NN=c1cc(C(F)(F)F)[nH]c(-c2ccncc2)n1)c1cnc2nc(O)nc(O)c2c1	736708482	RVZQLFYMOPBHMP-UHFFFAOYSA-N	444.333	1.486	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)NCCCN1CCN(c2ccncc2)CC1	738466996	GISLBBGCKSKNON-UHFFFAOYSA-N	426.521	1.141	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NN=C2C(=O)Nc3cc4c(cc32)OCCCO4)cc1	741771299	MASSCIAELPLIFQ-UHFFFAOYSA-N	430.442	1.729	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc(NC(C)=O)c1OC	743292143	AHZHVVUMDMUKPD-UHFFFAOYSA-N	439.428	1.628	50	20	IDGD	
O=C(NNC(=O)[C@H]1CN(Cc2ccccc2)CCO1)c1cc(Br)ccc1O	743731267	NHUUEIZOEISLDC-QGZVFWFLSA-N	434.290	1.817	50	20	IDGD	
O=C(CN1C(=O)c2ccccc2S1(=O)=O)NNC(=O)Nc1ccc(OC(F)F)cc1	743832594	WVRWDDMEGQUVPX-UHFFFAOYSA-N	440.384	1.285	50	20	IDGD	
Cc1ccc([C@@](O)(CC(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)C(F)(F)F)o1	744657750	JAVIZBGNXCDYRR-SFHVURJKSA-N	439.346	1.604	50	20	IDGD	
Cc1c(C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)cnn1-c1ccc(F)cc1F	744731987	ONMMHLLMACWBCY-UHFFFAOYSA-N	439.378	1.949	50	20	IDGD	
O=C(COC(=O)CNC(=O)c1cc2ccccc2[nH]1)NNC(=O)c1cccc(Cl)c1	745643180	LDHJNYLDLOAXBO-UHFFFAOYSA-N	428.832	1.556	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)c2cn(C)nc2-c2ccncc2)c2ccccc2c1=O	745835540	NRALRARFPVHDCG-UHFFFAOYSA-N	431.456	1.848	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)[C@H]2CCCCN2C(=O)c2ccc(O)nn2)c1	746093699	VTOGTIJWAJOPKX-QGZVFWFLSA-N	427.461	1.020	50	20	IDGD	
CC(C)CN1CCC[C@H](CNC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)C1	746328884	WCSVMLWQJRPASR-OAQYLSRUSA-N	444.624	1.897	50	20	IDGD	
COC(=O)c1ccsc1N1CC[C@@H](NC(=O)NNC(=O)COc2ccc(C)cc2)C1=O	746779881	LRFFCKIFEIOTMA-OAHLLOKOSA-N	446.485	1.358	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1F)c1cccc(CN2CCS(=O)(=O)CC2)c1	747329549	OLEWDOQVGPQICP-UHFFFAOYSA-N	439.896	1.784	50	20	IDGD	
O=C(COc1ccccc1C(=O)NNC(=O)C(=O)N1CCCC1)Nc1ccccc1F	748246963	RFLWJOGTKPPBOV-UHFFFAOYSA-N	428.420	1.227	50	20	IDGD	
C[C@H](Cn1cncn1)NC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	749211343	MTMIDSAIMBWHLK-GFCCVEGCSA-N	449.518	1.173	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)N2CCN(C[C@H]3CCOC3)CC2)N(C)c2ccccc21	749511065	JTVUBPVPOCKWOI-GOSISDBHSA-N	437.544	1.838	50	20	IDGD	
CCCCCn1nc(C(=O)NNS(=O)(=O)c2ccc(C#N)nc2)c2ccccc2c1=O	751264641	YNFBJJPYILBYTO-UHFFFAOYSA-N	440.485	1.477	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)[C@H](CCS(C)(=O)=O)NC(=O)OCc2ccccc2)o1	752781204	JLRHLFCXWWXAIQ-HNNXBMFYSA-N	437.474	1.079	50	20	IDGD	
CCn1cc([C@H]2C[S@@](=O)CCN2C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cn1	753134495	FQTHQNYTMDPEPJ-OKXSDPAFSA-N	441.517	1.249	50	20	IDGD	
CCc1cc(Br)ccc1NNC(=O)NCCNS(=O)(=O)Cc1ccon1	753211926	VGPMDVQIICBQRV-UHFFFAOYSA-N	446.327	1.745	50	20	IDGD	
COC(=O)c1cc2c(cc1NC(=O)C(=O)NNc1ccnc(Br)c1)OCO2	753853001	OHBPRQMQTBUHIN-UHFFFAOYSA-N	437.206	1.441	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Cc2c(F)cccc2F)c1	755037620	TWHCZPGWTWVVQO-UHFFFAOYSA-N	425.457	1.999	50	20	IDGD	
COc1cc(C=NNC(=O)C(=O)Nc2ccc(C)cc2)c([N+](=O)[O-])cc1OCC(=O)O	755598820	KWOVRGAZVXTNLQ-UHFFFAOYSA-N	430.373	1.464	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)Nc2cccnc2-n2cncn2)c1	756291701	LJIFAOOXUZLWFD-UHFFFAOYSA-N	432.238	1.900	50	20	IDGD	
NC(=O)CCSc1ccccc1NC(=O)NNC(=O)COc1ccccc1[N+](=O)[O-]	756360895	GXQWKHYYWWZUGL-UHFFFAOYSA-N	433.446	1.794	50	20	IDGD	
CC[C@@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)[C@H]1CCCO1	756736221	DFCIXMJUHROHAG-QZTJIDSGSA-N	438.550	1.763	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)N[C@@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1C#N	758780120	YCTFVPXMLCMENV-JKSUJKDBSA-N	431.493	1.717	50	20	IDGD	
Cc1nn(C)c(C)c1C[C@@H](C)C(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758786572	NMXIYCJDUIPEIO-CQSZACIVSA-N	436.557	1.851	50	20	IDGD	
COC(=O)c1cccc(CC(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)c1	759229160	MGRWELYWTUBLIN-UHFFFAOYSA-N	433.486	1.180	50	20	IDGD	
COc1cccc2c1CC[C@H]2NC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1	760208513	ZZGHBAGTKQPHHQ-GOSISDBHSA-N	446.529	1.642	50	20	IDGD	
CCS(=O)(=O)Nc1cc(OC)ccc1S(=O)(=O)NNC(=O)c1ccccc1C	761272613	MIKKDQJWSYZMFO-UHFFFAOYSA-N	427.504	1.389	50	20	IDGD	
C[C@H](CN1CCOCC1)C(=O)NN=C1CCOC[C@@H]1[C@@H]1CCCN1C(=O)OC(C)(C)C	762416979	DRUBRXWZVLSKJS-AOIWGVFYSA-N	438.569	1.863	50	20	IDGD	
CCN(CC)CCNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2ccccc2)c1	763426553	YREXPJGBPXFZQS-UHFFFAOYSA-N	425.489	1.158	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)[C@@H]2CC23CCN(C(=O)OC(C)(C)C)CC3)C[C@@H](C)O1	763468000	ZUFVPUVGICBNDV-ZACQAIPSSA-N	438.569	1.670	50	20	IDGD	
Cc1cccc(C(=O)N2CCCC2)c1NC(=O)C(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	763471388	JSFLDDSNUQNARS-UHFFFAOYSA-N	439.428	1.539	50	20	IDGD	
COC(=O)c1ccc(C)c(NC(=O)C(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)c1	763539180	JWGMHXSVBSJAFQ-UHFFFAOYSA-N	445.428	1.207	50	20	IDGD	
COC(=O)c1cc2cc(NC(=O)C(=O)NNC(=O)c3ccc(OC)c(OC)c3)ccc2o1	763550409	LYEDBHROSCADJQ-UHFFFAOYSA-N	441.396	1.636	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(NC(=O)C3CC3)ccc2C)cc1OC	763551196	UFFILGACBLYIBQ-UHFFFAOYSA-N	440.456	1.760	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c(Br)c1	763569679	AEPVIJOQLGUBLF-HNNXBMFYSA-N	434.246	1.683	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc3c(cnn3C(C)C)c2)cc1	763661202	LFOZHIUSDUXULH-UHFFFAOYSA-N	425.445	1.791	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2cc(S(C)(=O)=O)ccc2F)c1	763665074	DBLKZCDICQZNIB-UHFFFAOYSA-N	437.449	1.011	50	20	IDGD	
O=C(CN1CCCc2ccccc21)NNC(=O)C(=O)Nc1ccc(N2CCCC2)c(F)c1	763745588	GUTXLJSXDBZGPQ-UHFFFAOYSA-N	439.491	1.965	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2ccc(-c3ccc[nH]3)cc2)c2ccccc2c1=O	763785027	BDKGSLTVVLDDMF-UHFFFAOYSA-N	444.451	1.811	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(S(=O)(=O)CCCOC)cc2)cc1	763829742	KWJNQEYKSCPZDP-UHFFFAOYSA-N	447.513	1.459	50	20	IDGD	
CC(C)CCn1nc(C(=O)NNC(=O)C(=O)Nc2ccc(F)cc2)c2ccccc2c1=O	763843139	OYKYMHZRHCNYCJ-UHFFFAOYSA-N	439.447	1.981	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccc(O[C@@H]2CCOC2)cc1	763864457	JNGPLWCSPOXAIG-XJKSGUPXSA-N	431.420	1.547	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@H](C)C(=O)NNC(=O)C(=O)Nc1cc(C)n(CCC#N)n1	763882314	IPEDNYKJZPFPCL-CQSZACIVSA-N	446.895	1.929	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3cnn(Cc4ccncc4)c3)cc2C1	763942874	PFRZAFPUCPKEFB-CYBMUJFWSA-N	438.513	1.912	50	20	IDGD	
Cc1ccc(C(=O)N2C[C@@H](C)C[C@@H](C)C2)cc1NC(=O)C(=O)NNC(=O)c1cccn1C	763993406	PSYCSDXQVNDTLS-GASCZTMLSA-N	439.516	1.851	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccccc2COc2ccc(CC#N)cc2)n[nH]1	764105906	BSSSGTOLWICOMR-UHFFFAOYSA-N	432.440	1.763	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccoc2)cc1S(=O)(=O)N1CCCCC1	764163492	JTKVKGXQZUDBJK-UHFFFAOYSA-N	434.474	1.162	50	20	IDGD	
Cc1nccn1-c1ccc(NC(=O)C(=O)NNC(=O)c2cccc(OC(F)F)c2)cn1	764260335	VFLKKOYMTUZDOG-UHFFFAOYSA-N	430.371	1.577	50	20	IDGD	
O=C(NNC(=O)c1cc(F)ccc1Br)C(=O)Nc1ccn(-c2ccncc2)n1	764277378	LIBTWNAJMHWQLM-UHFFFAOYSA-N	447.224	1.569	50	20	IDGD	
COCCOc1ccc(F)cc1NC(=O)C(=O)NNC(=O)c1ccc(O)c(Cl)c1	764346361	XVIRYJFFZQZBLQ-UHFFFAOYSA-N	425.800	1.610	50	20	IDGD	
COc1ccc(S(=O)(=O)C(F)(F)F)cc1NC(=O)C(=O)NNC(=O)c1ccc(C)o1	764368022	RARLQLCUHRKWKV-UHFFFAOYSA-N	449.363	1.290	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)c(F)cc1F	764382346	HMGHUSDRPADIJO-UHFFFAOYSA-N	449.395	1.603	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1cc(C2CCCC2)nn1C	764397727	MGTJRUONTGCWKH-UHFFFAOYSA-N	431.518	1.965	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)[C@H](C)NS(=O)(=O)c2cccc(C#N)c2)c1	764526635	YFODHSWKLLRKJL-HNNXBMFYSA-N	430.486	1.068	50	20	IDGD	
CCOC(=O)c1cnn2c(C(=O)NNC(=O)c3cc(-c4ccc(F)cc4)[nH]n3)ccnc12	764752540	YHZJQDQEASNBKP-UHFFFAOYSA-N	437.391	1.510	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)CSc2nnc(-c3ccncc3)n2-c2ccccc2)cn1	765469965	PEXQRWOYVRETRY-UHFFFAOYSA-N	434.485	1.616	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cc(C)[nH]n2)cc1S(=O)(=O)N1C[C@H](C)C[C@@H](C)C1	765588351	XLMYRLPGCNUJJB-CHWSQXEVSA-N	449.533	1.468	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)CCc2nc(-c3ncccn3)no2)n[nH]1	765600546	MADIZNNYMPBIAZ-UHFFFAOYSA-N	434.416	1.319	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCCN(C(=O)NNC(=O)c3ccccc3)CC2)cc1	765640332	GNABISVBDBHTNL-UHFFFAOYSA-N	432.502	1.446	50	20	IDGD	
O=C(NCCNS(=O)(=O)c1cccc(Cl)c1)NNc1ncnc2ccsc12	765645375	IRDYCHUGSUPJMI-UHFFFAOYSA-N	426.911	1.949	50	20	IDGD	
Cn1ccnc1[C@](O)(CCNC(=O)NNc1ccccc1S(C)(=O)=O)C(F)(F)F	765690624	QHGDGBXBZYJURZ-OAHLLOKOSA-N	435.428	1.290	50	20	IDGD	
CCc1c(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)[nH]c(C)c1C(C)=O	766642171	KIWHXTNEFLRGGV-UHFFFAOYSA-N	439.516	1.307	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)[C@H]1CCC[C@@H]1NC(=O)OC(C)(C)C	767343575	BIOAHBKUGAIOAS-IRXDYDNUSA-N	433.505	1.922	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NN=Cc2cncc(Br)c2)cc1	767366436	GRHWMVNMMRTOOQ-UHFFFAOYSA-N	425.308	1.923	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cccc(-c4nc[nH]n4)c3)CC2)cc1	767743372	XLDMMPIDTJSRHZ-UHFFFAOYSA-N	433.516	1.359	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)[C@@H](C)NS(=O)(=O)c2ccc(C#N)cc2)c(C)c1	767853056	LYPQETWWRZFSDM-OAHLLOKOSA-N	429.502	1.101	50	20	IDGD	
CCn1c(O)nc2cc(C(=O)NNC(=O)c3cc(-c4ccc(F)cc4)[nH]n3)ccc2c1=O	768277160	SEHNNHZYWZHOEQ-UHFFFAOYSA-N	436.403	1.726	50	20	IDGD	
C=CCn1c(SCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)nnc1-c1cnccn1	768410831	DDEKWAUFICVUQA-UHFFFAOYSA-N	440.445	1.383	50	20	IDGD	
CC(C)(C)OC(=O)N1Cc2ccc(C(=O)NNC(=O)N[C@H]3CCS(=O)(=O)C3)cc2C1	768981932	PDDGVFRCCDKPQF-HNNXBMFYSA-N	438.506	1.068	50	20	IDGD	
CNS(=O)(=O)c1ccc(CNC(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)s1	770110908	PDSBFXLVNILJDU-JTQLQIEISA-N	446.938	1.608	50	20	IDGD	
Cc1nnnn1/C(=C/c1ccccc1)C(=O)NNc1nc(O)c2cnn(C(C)(C)C)c2n1	770965793	NEAIZAXRKQCOJW-XNTDXEJSSA-N	434.464	1.723	50	20	IDGD	
COc1cc(C)nc(NNC(=O)CN2C(=O)N[C@@](C)(c3ccc(F)c(Cl)c3)C2=O)n1	771400609	JWPFCZIDJSEGNR-SFHVURJKSA-N	436.831	1.496	50	20	IDGD	
O=C(CCS(=O)(=O)c1ccc2c(c1)OCCO2)NNc1ccnc(Br)c1	771554281	YCCGIHDIPFXHNF-UHFFFAOYSA-N	442.291	1.922	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)NCCc1cc(Cl)ccc1Br	771974072	DFOIMCZCGXOUHI-UHFFFAOYSA-N	443.685	1.998	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)C(=O)Nc1cc(C(F)(F)F)ccn1	773542524	PLFVQYYIZCGGQH-UHFFFAOYSA-N	433.387	1.491	50	20	IDGD	
Cc1nc(NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)ccc1Br	773545769	IGNDYNXCUCWFAZ-UHFFFAOYSA-N	430.262	1.893	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)NCCc1ccc(OCC(F)(F)F)nc1	773609575	DUQORRGVGBTUHX-UHFFFAOYSA-N	436.394	1.786	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ccccc2[N+](=O)[O-])c(C)c1S(=O)(=O)NC1CC1	773656121	YYVPQKZRNUJLLE-UHFFFAOYSA-N	447.473	1.734	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1nc(-c2nccn2C)cs1	774008030	DRRGGVYAKJURRX-SNVBAGLBSA-N	448.892	1.750	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccccc1S(=O)(=O)N1CCCC1)c1c[nH]c2ccccc12	775251565	YENHYHLEGZLRMT-UHFFFAOYSA-N	448.526	1.576	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccccc1S(=O)(=O)N1CCCC1)c1cccc(Cl)c1	775252802	ZASJWAJPAPAQMJ-UHFFFAOYSA-N	443.934	1.748	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cnc3sc(C)c(C)n3c2=O)cc(OC)c1OC	775638130	AWXBBONFQFMBLU-UHFFFAOYSA-N	432.458	1.473	50	20	IDGD	
CCCCOc1ccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cn1	776065297	LDLCMTVRESFWAE-UHFFFAOYSA-N	435.506	1.977	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1=O	776180564	FSQWWSQLNGVJGJ-AAEUAGOBSA-N	432.399	1.193	50	20	IDGD	
CCC(CC)n1nc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cc1C	776490206	UGSOXVICQTWXPB-UHFFFAOYSA-N	440.548	1.772	50	20	IDGD	
COc1cc(C(=O)N2CCN(S(=O)(=O)CBr)CC2)cc(OC)c1OC	777777476	JJXUFSCJCHUPCE-UHFFFAOYSA-N	437.312	1.152	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@@H](C)NC(=O)CC(C)(C)C)CC2)cc1	778998375	SXQWBZYMELIXHC-GOSISDBHSA-N	431.581	1.201	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)C(F)(F)c2ccccc2OCC(=O)N(C)C)cc1	779161863	KRXHILSCOZXOEV-UHFFFAOYSA-N	434.443	1.813	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)ccc1O	779488284	DNILXZDEUPPHME-UHFFFAOYSA-N	447.513	1.115	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H]2CCC[C@@H]2CCO)c1	779710297	CATAUVXMQBUZCF-RHSMWYFYSA-N	426.539	1.212	50	20	IDGD	
O=C(CSc1n[nH]c(-c2ccc3c(c2)OCCO3)n1)NNC(=O)c1ccc(F)cc1	779820549	DUPRRILTCNZSRQ-UHFFFAOYSA-N	429.433	1.935	50	20	IDGD	
Cc1cc(N2C[C@@H](C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)CC2=O)ccc1F	779903283	GLAJNERZBSONJX-INIZCTEOSA-N	440.479	1.341	50	20	IDGD	
Cc1c(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cnn1C1CCCCC1	781305084	GXYSASLLIHIPMI-LJQANCHMSA-N	442.472	1.841	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)C(=O)N2C[C@@H](C)Oc3ccccc32)nc1	783264870	SJYVEZMEEXVDJB-CYBMUJFWSA-N	433.490	1.026	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)(F)F)cc1)C(=O)Nc1cnc2c(c1)COCC2	783408541	LPDLXKFENPYDIG-UHFFFAOYSA-N	444.391	1.530	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ccc(-n3cccn3)nn2)c(OC[C@H]2CCCO2)c1	783436722	ORYWOFWJCQLJNP-OAHLLOKOSA-N	437.460	1.610	50	20	IDGD	
Cc1cc(C(=O)N2CCSCC2)ccc1NC(=O)C(=O)NNc1nccnc1Cl	784777831	MTHXMRIWVNRVKE-UHFFFAOYSA-N	434.909	1.709	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)C(=O)Nc2cc(N3CCNC3=O)ccc2Cl)c1	784853422	HLLSSYRNOWIRRS-UHFFFAOYSA-N	431.836	1.738	50	20	IDGD	
CC[C@H](C)NS(=O)(=O)c1cccc(NC(=O)C(=O)NNc2cccc(C(=O)OC)c2)c1	784855255	UMUABWDGZWVICF-ZDUSSCGKSA-N	448.501	1.632	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(\C#N)C(=O)N2CCN(c3cnc(O)nc3N)CC2)c1C	788156012	WWZXFGNZDWZYFK-ZNBBLSJYSA-N	439.520	1.646	50	20	IDGD	
O=C(NC[C@@H](Cc1cccc(F)c1)C(=O)N1CCOCC1)NNC(=O)c1ccccc1	789309516	DTBYEDRLGYVOCN-GOSISDBHSA-N	428.464	1.487	50	20	IDGD	
CC(C)Oc1cc(NC(=O)C(=O)NNC(=O)Cc2c[nH]c3ccccc23)ccc1C(N)=O	789740735	HNLWMKPMPFDNII-UHFFFAOYSA-N	437.456	1.383	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2nc3c(s2)CCCC3)nc1	789745987	FXBMNTVXPOFQGS-UHFFFAOYSA-N	438.535	1.185	50	20	IDGD	
Cc1sc2nc(CS[C@@H](C)C(=O)NNC(=O)CN3CCCC3=O)nc(O)c2c1C	789856269	CWSRDNLPWCSYHP-NSHDSACASA-N	437.547	1.405	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@H](C(=O)NNC(=O)c2ccc3ccccc3n2)[C@H](C)O)cc1	792544175	YEZNNEFPRZCKCY-LIRRHRJNSA-N	442.497	1.032	50	20	IDGD	
O=C(CCc1cncnc1)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	794200323	KOJSRTHZGYOFTG-UHFFFAOYSA-N	439.497	1.349	50	20	IDGD	
COC(=O)/C=C/c1cc(OC)c(OC)c(S(=O)(=O)NNC(=O)c2cccc(C)n2)c1	794601002	MZHABXKIMINEJE-CMDGGOBGSA-N	435.458	1.217	50	20	IDGD	
CN(C(=O)[C@@H]1CCN(C(=O)NNC(=O)CNC(=O)c2cccs2)C1)c1ccccc1	797607181	GYKLEGZGGWJKBR-CQSZACIVSA-N	429.502	1.204	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2cccc(CN3CCS(=O)(=O)CC3)c2)cc1	802063056	RVKXLGAMWSLFJF-UHFFFAOYSA-N	432.502	1.392	50	20	IDGD	
CN(CC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)C(=O)OCc1ccccc1	802066565	ZFEVPGRFSLWTFU-UHFFFAOYSA-N	434.474	1.511	50	20	IDGD	
Cc1nc(C(F)(F)F)ccc1NC(=O)C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C	802567100	MIPOYCIFUCBOFH-UHFFFAOYSA-N	447.414	1.800	50	20	IDGD	
CN(NC(=O)[C@]1(O)CCc2ccccc2C1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	803101052	CMENQAHYHHWLNC-QFIPXVFZSA-N	432.521	1.542	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@@H]2CCN(c3ccc(C#N)cc3F)C2)c2ccccc2c1=O	804161180	MKGIEQQTAXTASU-OAHLLOKOSA-N	448.458	1.715	50	20	IDGD	
Cc1c(C(=O)NNc2ccc(-n3ccnc3)nn2)nnn1-c1ccc(OC(F)F)cc1	804954768	NZPNOYLANULRNK-UHFFFAOYSA-N	427.375	1.910	50	20	IDGD	
COCCNC(=O)[C@@H](C)OC(=O)c1ccc(NC(=O)NNc2ccc(Cl)nn2)cc1	806749109	YIGQEUBVEMWGNE-LLVKDONJSA-N	436.856	1.587	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2)ccc1F	806972570	DHBXHAQSPNKYHR-UHFFFAOYSA-N	442.856	1.129	50	20	IDGD	
C[C@@]1(C2CC2)NC(=O)N(c2ccc(CNC(=O)NNc3nc4ccccn4n3)cc2)C1=O	807243243	ZYTURUXSSFDFEN-NRFANRHFSA-N	434.460	1.781	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)C(=O)Nc1ccc(OC(F)F)c2cccnc12	807428685	IPTAIDCBPZHDIH-UHFFFAOYSA-N	440.370	1.894	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2C)c(OCC(=O)N(C)C)c1	807455802	VBQCSRYCBFRCLQ-UHFFFAOYSA-N	429.433	1.760	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)C1(S(=O)(=O)c2ccccc2)CCOCC1	809144375	LVWQXXKLBWWKLC-UHFFFAOYSA-N	436.461	1.375	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@H]2C[C@H](c3ccccc3)OC2=O)cc1	809557825	HOSQFLQECQJYOV-QZTJIDSGSA-N	445.497	1.067	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@@H]2NC(=O)NNC(=O)C(=O)Nc1ccccn1	813808950	OYCLPEVVOJNUSS-ZDUSSCGKSA-N	432.481	1.140	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)C(=O)Nc1cc(Cl)ccc1I	815569575	ZEONKKSVCBOFSE-UHFFFAOYSA-N	447.620	1.376	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@H]2CCCO2)n(-c2cccc(Br)c2)n1	815778351	NLYLDFDDSVENTD-CYBMUJFWSA-N	436.266	1.208	50	20	IDGD	
CCOc1ccc(NNC(=O)C(=O)Nc2cc(C(=O)N3CCOCC3)ccc2C)cc1	815817047	ZTYOHYNOQKIVQQ-UHFFFAOYSA-N	426.473	1.948	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)c1ccc(OC)c(S(=O)(=O)NC2CC2)c1	825649225	JCELBCHJHLPADR-UHFFFAOYSA-N	448.501	1.018	50	20	IDGD	
COc1cccc(C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c1OC(F)F	849197119	VNFVNIKGQMSOBC-UHFFFAOYSA-N	439.327	1.823	50	20	IDGD	
Cc1nc(C=NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c2ccccn12	914601254	MBAUYJDXFDIIED-UHFFFAOYSA-N	427.486	1.428	50	20	IDGD	
CCOc1ccccc1C(=O)N1CCC[C@@H]1C(=O)NNC(=O)[C@H]1COc2ccccc2O1	914774744	IOAYOMHWHQMTJM-OXQOHEQNSA-N	439.468	1.677	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)CNS(=O)(=O)c2ccc(Br)cc2)cc1	915783202	JFBRXJXLIAHFOU-UHFFFAOYSA-N	440.319	1.751	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)NCc2ccc(N3CCO[C@@H](C)C3)nc2)cc1C	916393024	QSCFODXVPZVMPQ-INIZCTEOSA-N	440.504	1.393	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@H]2CCN(c3ccccc3)C2)c1	916580286	YNPIAPGMIZKGFJ-MRXNPFEDSA-N	445.545	1.407	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCN(C(=O)Cc2ccccc2)CC1	917111344	AYWXENQVPUTCST-UHFFFAOYSA-N	444.919	1.497	50	20	IDGD	
CCCS(=O)(=O)CC(=O)NNC(=O)c1ccc(CSc2nc(C)cc(C)n2)cc1	919806229	SAHSDEAODANZFU-UHFFFAOYSA-N	436.559	1.972	50	20	IDGD	
O=C(C=C1CCCCC1)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	919839794	SBRBRDGCRVKOGO-UHFFFAOYSA-N	435.546	1.678	50	20	IDGD	
O=C(/C=C\c1cc(C(F)(F)F)ccc1Cl)NNC(=O)N[C@@H]1CCS(=O)(=O)C1	919885723	QYJPEARSVXJHST-PNDGHQIGSA-N	425.816	1.890	50	20	IDGD	
O=C(Cn1cnc2ccc(Br)cc2c1=O)NNC(=O)c1n[nH]c2c1CCCC2	1317839517	ZFEWNTSUNOIKKM-UHFFFAOYSA-N	445.277	1.222	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)N[C@H]2CCO[C@@]3(CCS(=O)(=O)C3)C2)c2ccccc2n1	1319831599	JSFQWAIWDCWEJM-XOBRGWDASA-N	432.502	1.224	50	20	IDGD	
CC(C)(C)OC(=O)Nc1cccc(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)n1	1321608207	SOKYNWFQKHHQAD-UHFFFAOYSA-N	441.492	1.896	50	20	IDGD	
O=C(c1cccn2cncc12)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1778686533	REUPGDXPCXPNMZ-PBHICJAKSA-N	425.258	1.468	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2)c1ccc2cccnc2n1	1778946409	VMUHKGRIXVKVTC-CSODHUTKSA-N	432.908	1.357	50	20	IDGD	
Cc1cc(C)n2ncc(C(=O)N3CCO[C@]4(CCN(C(=O)CO[Si](C)(C)C)C4)C3)c2n1	1779295514	QHZMCHLCDRBDOQ-NRFANRHFSA-N	445.596	1.641	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C=N/N2CCCCC2)C1	1779363884	MWPIUWMPYDMHRP-OSSLJJSHSA-N	443.386	1.755	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2)c1ccc(O)c([N+](=O)[O-])c1	1780873098	FMFUMNUVTHRJDU-GPMSIDNRSA-N	441.868	1.028	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cc([N+](=O)[O-])cc4c3OCC4)CCO2)C1	1781220709	CHPDENXUHLNIPN-OXQOHEQNSA-N	437.880	1.991	50	20	IDGD	
O=C(/C=C/c1ccc([N+](=O)[O-])o1)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781325780	QVZAKVYUJYTCQP-NCOFJEEWSA-N	446.229	1.721	50	20	IDGD	
COc1cnc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)c(F)c1	1781328140	JCXDQOJWGMSHEI-CZUORRHYSA-N	434.237	1.363	50	20	IDGD	
C=CCC(F)(F)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCC(=O)NN(C)C)C1	1782213401	PBMGOFLIQNVUEC-DNVCBOLYSA-N	430.496	1.085	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cccc4nccn34)C2)C1	1782362934	DRMPQARTVPJLJI-KUHUBIRLSA-N	435.322	1.951	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)Cc3cnc4ccccn34)CCO2)C1	1783528096	JYNPWWMATNEPGZ-AUUYWEPGSA-N	435.322	1.490	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)CCOCCOCCOC)C2)C1	1783661551	KCFGYLMCHVWHOM-XLIONFOSSA-N	434.961	1.294	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4cccn4cn3)C[C@@H]21	1783966560	GWWBOBKPNFSRKK-OAOQPFQOSA-N	449.349	1.959	50	20	IDGD	
Cc1cc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)CBr)C[C@@H]32)nn1C	1784237091	RUNXWACUIRMOQT-CSFVBSKPSA-N	441.370	1.282	50	20	IDGD	
O=C(C[C@@H]1OCCc2ccccc21)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21	1784395627	XMDMLRSOWUESQT-UVBQOVKKSA-N	436.936	1.270	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3sc4nccnc4c3N)[C@H]2C1	1786953294	WGVDXYJHEUJMQU-CYDGBPFRSA-N	437.953	1.884	50	20	IDGD	
Cc1cnn(CC(=O)NC2(c3ccc(NC(=O)c4cccc(B(O)O)c4)cc3)CCC2)c1	1788143885	RTPFPIGXHCLEBB-UHFFFAOYSA-N	432.289	1.319	50	20	IDGD	
Cc1cc(/C=C/C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Br)C[C@@H]32)no1	1788675392	SCJOHJVACBRJMC-VEGNLECUSA-N	430.274	1.666	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C[C@@H](N)c3cccnc3)C[C@@H]21	1788764097	LCTCNXSMTLVDBP-OKYOBFRVSA-N	434.613	1.303	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21)c1cc([N+](=O)[O-])cc2c1OCC2	1789218451	RZDMDFVHYAKGLX-SIUGBPQLSA-N	441.843	1.657	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3C[C@H]4CC[C@@H]3O4)[C@H]2C1	1791089732	DHHMCGORYODJIU-NGLPHOLESA-N	429.355	1.707	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(CO)c(F)c3)[C@H]2C1	1792092270	XVSDGTQOTRKSGY-LNLFQRSKSA-N	438.572	1.763	50	20	IDGD	
COc1nccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)CBr)c1F	1792867630	IFJFHPMFZZXSLA-OHTBPHCPSA-N	444.301	1.464	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3nonc3c1)C2	1792868245	RWPXIULZYDIKGS-YGSHXTJESA-N	437.294	1.457	50	20	IDGD	
COc1ccccc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)CBr	1792872461	JDMLJFOCQYQTGL-VWPFQQQWSA-N	425.323	1.929	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1ccc(C(F)(F)F)cn1)C2)[C@H](O)CCl	1792975014	GTBDADSFNTVPQF-DJZPMSPPSA-N	449.857	1.222	50	20	IDGD	
CC(C)(C)n1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Br)C3)n1	1794421101	ZAYANYRPJRXYTE-XCCSTKFXSA-N	431.306	1.532	50	20	IDGD	
C[C@@H](Nc1cccnc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@](C)(Cl)CCl)C2	1795605662	JOSWZMUASBRAQD-TWAUDHPGSA-N	429.348	1.708	50	20	IDGD	
CCc1[nH]nc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)Br)C3)c1Cl	1795904749	ZZWDJRPBZFOFLP-ORXSELOVSA-N	433.734	1.612	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)c1cncc(C(F)(F)F)c1	1796188696	JWWJFWSCDASMOO-BCDXTJNWSA-N	447.222	1.346	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cn1ccnn1)[C@H](Br)Cc1ccccc1	1796336447	WYVTWBSPRJWUMN-XMTFNYHQSA-N	446.349	1.923	50	20	IDGD	
Cc1c(Br)c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Cl)nn1C	1796366524	ZKFXLRJYDCJTGT-PKCZLINISA-N	437.697	1.229	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1ccc2nc[nH]c2c1	1797412163	IMZITHZFQIAFNM-BAESOJJISA-N	425.258	1.457	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cn1c(=O)n(C)c2ccccc21	1797750407	VBFGIUXZFMVKPO-XQLPTFJDSA-N	449.349	1.762	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(-n3ccnc3)ccn1)C2	1797957567	NYPCHLGPHMQTFN-CWPLJXCYSA-N	443.580	1.322	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1cncc2cnccc12	1798458056	BNBYHRLNGYUNRK-NOXHYTERSA-N	437.269	1.524	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CC[C@@H](C(=O)OC)C1)C2	1800637629	FLYYTCVFPNAVGX-AYCBFJCHSA-N	445.354	1.339	50	20	IDGD	
CCc1[nH]nc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](Br)CC)c1F	1800639349	QEJPYRFJPDVUEJ-FBKDDSFISA-N	431.306	1.488	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=N/O[C@H]1CCCCO1)C2	1800641996	PZFIBHHBTIPVND-QEUSUPOWSA-N	446.342	1.279	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc(-c3cnco3)c1)C2	1802338541	NABQAQYEBFMRBO-REPLKXPHSA-N	439.516	1.966	50	20	IDGD	
N#Cc1ccc(CC(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@H]2c2cccnc2)cc1	1802573267	JYUJQEOZJJWGOG-ZVDOUQERSA-N	426.904	1.801	50	20	IDGD	
O=C(COc1ccc(O)cc1)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1	1802886493	NDBHZFFOBXOBGG-QKYXUNIQSA-N	433.892	1.472	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)Cn2nc(C)cc2C)[C@@H]1c1cccnc1	1804579107	BVOZEYVWAIJASJ-HBFSDRIKSA-N	433.940	1.855	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2coc(Cl)n2)[C@H]1c1cccnc1	1805020873	CHSARNORKYWYJM-KBXCAEBGSA-N	448.911	1.416	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)/C=C/C2CC2)[C@H]1c1cccnc1	1810296040	ZQGITIJHSIXBHF-HAYFENEFSA-N	434.500	1.366	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1CCN(C(=O)c2ccc[n+]([O-])c2)[C@@H]1c1cccnc1	1810541536	UVNZSBUEJPVSNA-FXAWDEMLSA-N	428.565	1.886	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)c1nn[nH]c1C(F)(F)F	1811562124	DCPAAXVJZCHBKK-DMDPSCGWSA-N	446.817	1.138	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)Cc2cccnc2)[C@@H]1c1cccnc1	1813070776	JUHYMBFKXOWDLT-AUSIDOKSSA-N	438.532	1.098	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)[C@@H]2CCCSC2)[C@H]1c1cccnc1	1813074759	UTEXOBRVNWCVRK-UEXGIBASSA-N	447.605	1.604	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)CCc2ccoc2)[C@H]1c1cccnc1	1813528515	NGGXYBUDJMJCKS-AUSIDOKSSA-N	441.532	1.686	50	20	IDGD	
COCCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1)CC2	1814281067	DEDVTPUCWXHUIX-IVWKQIGUSA-N	432.506	1.226	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1CCc2nc(NC(=O)CN)sc2C1	1814774720	DMOANQUGHBKBSI-KOLCDFICSA-N	431.946	1.146	50	20	IDGD	
Cc1ccncc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1818335533	IGMKLPQWABYCLW-IBGZPJMESA-N	433.277	1.413	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@H](C(=O)Nc2cc([C@H]3CCCCN3C(=O)[C@@H](O)CCl)[nH]n2)C1	1822361430	QNZVWWYWHNQART-XNISGKROSA-N	440.928	1.981	50	20	IDGD	
O=C(CCn1ccnn1)Nc1cc([C@H]2CCCCN2C(=O)[C@H](F)Br)[nH]n1	1822809733	PVHILUBHSKQKST-RISCZKNCSA-N	428.266	1.774	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H]2CNC(=O)C2)CC1	1824096085	JOAQUDIIYIPYDY-KBMXLJTQSA-N	428.371	1.773	50	20	IDGD	
Cc1cccnc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1	1824696767	HZKCRWLLBFDUQN-NRFANRHFSA-N	435.333	1.617	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CN)CC1	1825008840	QZWFIUSDSKQEQT-HOTGVXAUSA-N	430.977	1.697	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CNC(=O)N(C)C)CC2	1825440280	NWBGWEFBCCVKPG-ZJUUUORDSA-N	446.371	1.500	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCC(=O)N1CCCC1)CC2	1825995508	YHYVQJMOLVCSQV-CHWSQXEVSA-N	442.969	1.712	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CSc1nc[nH]n1)CC2	1826008895	JUNPPFOFEIZGNF-DTWKUNHWSA-N	430.943	1.219	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)C/N=C/c1ccco1)CC2	1826088322	WBIYVSDQIALENO-SRRANQMSSA-N	446.533	1.140	50	20	IDGD	
O=C([C@@H]1C[C@H]2CC[C@@H]1O2)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827060538	OSVXOBVSCDZRIP-YSFYHYPLSA-N	440.349	1.167	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@H]1CCc2nc(NC(=O)CCS(C)(=O)=O)sc2C1	1827212035	SMIPRFWVIYELQQ-BJOHPYRUSA-N	442.390	1.726	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CCCCO1)CCO2	1829926870	UDIVGOGYWKKPKC-MPGHIAIKSA-N	433.343	1.185	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(O)ccc3O)C2)C1	1830366578	SOPHUISOQLWTHE-FQEVSTJZSA-N	426.897	1.433	50	20	IDGD	
Cc1c[nH]cc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)CBr)CCO2	1830538284	AUBLUCWTQNMTNU-FZKQIMNGSA-N	428.327	1.424	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)C(Cl)Cl)CC1	1831878292	CKQJKNIGNANTEI-OAHLLOKOSA-N	442.347	1.722	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H]3C[C@H]3c3ccccc3)CC2)CC1)[C@H](O)CCl	1833312879	JXVSBXVCRZGDAC-PWRODBHTSA-N	433.980	1.961	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cc(F)c(F)cc3F)CC2)CC1)[C@@H](O)CCl	1833313237	BDCHVJGPDISHAH-SFHVURJKSA-N	447.885	1.889	50	20	IDGD	
C#CCO[C@H](C)C(=O)NC1CCN(C2CCN(C(=O)[C@H](C)CBr)CC2)CC1	1833464242	SLYOTZWTFRIDBN-HZPDHXFCSA-N	442.398	1.627	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@](C)(O)C(F)(F)F)CC2)CC1	1833641802	PCVNQCHRZHGXKO-YOEHRIQHSA-N	443.894	1.125	50	20	IDGD	
CCOc1ccc(C(=O)N2CCC(N3CCC(NC(=O)[C@@H](F)Cl)CC3)CC2)nn1	1835081974	JABWEVWLEXBCFT-QGZVFWFLSA-N	427.908	1.595	50	20	IDGD	
C[C@H](CS(C)(=O)=O)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](F)Cl)CC2)CC1	1836873891	JOBNMKBLYGEHGH-IUODEOHRSA-N	426.938	1.200	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc4n(n3)CCCO4)CCO2)C1	1836966828	KXBHDWPPZIZBPO-HXUWFJFHSA-N	440.928	1.001	50	20	IDGD	
C=CC[C@H](C(=C)C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)Br)C2)C1	1837312143	VALNWGQEGPYOCY-FCEWJHQRSA-N	429.355	1.995	50	20	IDGD	
Cc1cc(/C=C/C(=O)N2CCO[C@]3(COCCN(C(=O)CCBr)C3)C2)no1	1837554135	DKORUUQJHSVCHT-DCKQQPRJSA-N	442.310	1.238	50	20	IDGD	
CCOC(=O)/C=C/C(=O)N1CCC(OC2CCN(C(=O)[C@H](Cl)COC)CC2)CC1	1837639075	KPMDACKRGZSFEQ-LAQIPUCWSA-N	430.929	1.358	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)/C=C/c3ccccc3N)C2)C1	1837711748	OTSSPYJOPDGTPR-UVIRAJKCSA-N	447.608	1.590	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccccc3F)CCO2)C1	1838856970	KBLYSVGDNZABGJ-FZKQIMNGSA-N	429.286	1.679	50	20	IDGD	
CCOc1cccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](Cl)COC)C3)C2)c1	1839020225	QYDKTCYZHGZGOK-WIYYLYMNSA-N	440.924	1.409	50	20	IDGD	
CN1CCC(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)CC1	1839150103	ZIRNJGXYKJCLBX-MOPGFXCFSA-N	436.380	1.021	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3Cc4ccccc4C3)C2)C1	1840155861	DZDSSMMILUKRHI-SIKLNZKXSA-N	436.936	1.112	50	20	IDGD	
O=C(C(Cl)Cl)N1CCO[C@@]2(COCCN(C(=O)C34CC(C(F)(F)F)(C3)C4)C2)C1	1840186887	QUPNRSLGIFHZIW-GPANFISMSA-N	445.265	1.979	50	20	IDGD	
Cc1cc(C)n(CCC(=O)N2CCO[C@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)n1	1840345572	VHLKVUKBMVATLJ-OAQYLSRUSA-N	440.972	1.611	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)Oc1ccccn1)CCO2	1840426992	RBGCGHUWRCYDSN-GUXCAODWSA-N	425.913	1.323	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](CCC)NC(C)=O)CCO2	1840851245	KZYSHIVSTAVFLK-ZWOKBUDYSA-N	431.961	1.155	50	20	IDGD	
CC(C)(C)OC(=O)N1CC2(C[C@H]2C(=O)N2CC3(CCCN3C(=O)[C@@H](O)CCl)C2)C1	1841353904	XEGUANGZTDWWDG-KBPBESRZSA-N	427.929	1.047	50	20	IDGD	
C[C@H](Sc1ccccc1)C(=O)N1CCCC12CN(C(=O)c1cnccc1C(=O)NN)C2	1841526271	MRSWMNYFGSBYBS-HNNXBMFYSA-N	439.541	1.683	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)Cc1noc3ccccc13)C2	1843415871	WYIJDPMWGVWKIU-MFKUBSTISA-N	448.483	1.708	50	20	IDGD	
O=C(c1c[nH]c(=O)cn1)N1CC2(CCCN2C(=O)[C@@H](Br)Cc2ccccc2)C1	1845942268	VXQRUEFKVFBXKR-HNNXBMFYSA-N	445.317	1.593	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H]2CC[C@@H](C2)[C@H]1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl	1847564091	QXRKPNFYOXINNT-JNNCMOEMSA-N	441.956	1.576	50	20	IDGD	
CCn1c(NNC(=O)CNC(=O)c2ccc(OC)c(OC)c2)nc2ccccc2c1=O	11161172	RVHMSPTZZSNTPC-UHFFFAOYSA-N	425.445	1.307	50	20	IDGD	
Cc1ccc2nc(COc3ccc(C(=O)NNC(=O)[C@H]4CCS(=O)(=O)C4)cc3)cn2c1	11715572	ZYHUDEKSYLDYFL-INIZCTEOSA-N	442.497	1.417	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)c2ccc(CS(=O)(=O)c3ccccc3)o2)cc1	18111204	AZPJNEOPIDMWLD-UHFFFAOYSA-N	439.449	1.965	50	20	IDGD	
O=C(CNC(=O)c1ccc(Br)o1)NNC(=S)NCCc1cccs1	21124242	JSFRTWVAPJQDOO-UHFFFAOYSA-N	431.337	1.571	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(Cl)s1)NNC(=O)c1cc(-c2ccccc2)[nH]n1	725880118	XJMKGOLENSZMNM-UHFFFAOYSA-N	439.906	1.531	50	20	IDGD	
COc1ccc(N2CCC(NC(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)CC2)cc1	726610470	JRXKLJKXEOGQJW-UHFFFAOYSA-N	436.476	1.284	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])c(C)c2)c(O)c1	726622486	ZAUNYKQCYLCTGQ-KRWDZBQOSA-N	426.429	1.983	50	20	IDGD	
CCn1nc(C)c(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)c1C	726928950	ITEQKLDKVWSNEF-UHFFFAOYSA-N	433.534	1.769	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)Cc2ccc(C(=O)NNC(=O)c3cocn3)cc2)cc1	729297109	UVEOAOVIDKMNIR-UHFFFAOYSA-N	428.470	1.879	50	20	IDGD	
Cc1cc(S(=O)(=O)NNC(=O)CCc2ccccc2O)ccc1OCCCC(=O)O	729962999	REVGAMYGTUSJOM-UHFFFAOYSA-N	436.486	1.887	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)[C@H]2CCCN(S(=O)(=O)Cc3ccccc3)C2)c1	730447365	LRKYHPHKWNRKDO-IBGZPJMESA-N	444.557	1.756	50	20	IDGD	
CCOC(=O)c1ccc(-c2ccc(C=NNC(=O)CSc3nnc(O)nc3O)o2)cc1	730558306	HMJVRAMOILIJAZ-UHFFFAOYSA-N	443.441	1.962	50	20	IDGD	
O=C(NN=Cc1nc(-c2cccc(Br)c2)c[nH]1)N[C@H]1CCS(=O)(=O)C1	731925573	KUYUDDIYLWWGBS-LBPRGKRZSA-N	426.296	1.659	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)N[C@H](Cc2ccccc2)CN2CCOCC2)cc1	732476462	KHDGNUFBIORMIL-HXUWFJFHSA-N	437.500	1.211	50	20	IDGD	
COc1cc(C(=O)NNC(=O)N[C@H]2CCN(c3ccccc3F)C2=O)cc(OC)c1OC	732820157	IEBGZGROZVVWPC-AWEZNQCLSA-N	446.435	1.601	50	20	IDGD	
O=C(NCc1ccnc(OC2CCOCC2)c1)NNC(=O)c1cc(Br)c[nH]1	733336206	NQHQMDZMORURET-UHFFFAOYSA-N	438.282	1.874	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccccc1Cl)NNC(=O)c1cnn(-c2ccccc2)c1	733364428	OCXGLUAUNXBHGQ-UHFFFAOYSA-N	447.904	1.655	50	20	IDGD	
C[C@H](CS(C)(=O)=O)NC(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1	733662567	NHNCZSFYLJFDSZ-OXQOHEQNSA-N	444.557	1.377	50	20	IDGD	
CCS(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)c1	735658708	GIZDRKJOYYJEQE-UHFFFAOYSA-N	448.929	1.602	50	20	IDGD	
O=C(Oc1ccc([N+](=O)[O-])cc1Br)[C@H]1CC(=O)N([C@H]2CCS(=O)(=O)C2)C1	739311489	QBZMPBOWBZOLSQ-ONGXEEELSA-N	447.263	1.298	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)NC[C@@H](O)c1cc(Cl)c2c(c1)OCCO2	740025208	FLWXQERDSUGATR-CQSZACIVSA-N	445.863	1.745	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)[C@H]1CCCN(C(=O)COc2ccccc2)C1	741285536	UBPOJBXNCMLSDS-INIZCTEOSA-N	431.514	1.851	50	20	IDGD	
Cn1c(=NNC(=O)c2ccc(F)c(S(=O)(=O)Cc3ncon3)c2)sc2ccccc21	742243335	XHFSJCRQUNUTTG-UHFFFAOYSA-N	447.473	1.982	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)Nc2ccc(S(N)(=O)=O)cc2)c(OC)cc1Cl	743811158	QKVMIAOOBWMSST-UHFFFAOYSA-N	443.869	1.863	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CN2CCC[C@H](NS(=O)(=O)c3cccc(F)c3)C2)c1	744397147	BUXSCHWVDZDFFP-SFHVURJKSA-N	448.520	1.338	50	20	IDGD	
Cc1ccc([C@](O)(CC(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)C(F)(F)F)o1	744656700	FELYGOLDWZXRSD-GOSISDBHSA-N	439.346	1.604	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)[C@@H](C)Oc1ccc2ccccc2c1)CN1CCN(C)CC1	745861187	AAWNIKIIEICMOX-QZTJIDSGSA-N	427.549	1.821	50	20	IDGD	
CCS(=O)(=O)c1ccc(N2CCC(NC(=O)NNC(=O)Cc3ccncc3)CC2)cc1	747584385	KJLSFYPQZWBGSM-UHFFFAOYSA-N	445.545	1.417	50	20	IDGD	
CN(C)C(=O)CN1C(=O)C(=NNC(=O)Cc2ccncc2)c2cc(Br)ccc21	747645210	AAOXJQHFUQQKIP-UHFFFAOYSA-N	444.289	1.342	50	20	IDGD	
CN1CCC[C@H](NC(=O)NNC(=O)[C@@H]2Cc3ccccc3CN2Cc2ccccc2)C1=O	748664616	LRVANZWEAVQWOB-SFTDATJTSA-N	435.528	1.565	50	20	IDGD	
CNS(=O)(=O)c1csc(C(=O)NNC(=O)c2cc(OC)ccc2Br)c1	748708011	KFQAPIVDDKAUBP-UHFFFAOYSA-N	448.320	1.502	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(Cl)s1)NNC(=O)c1cc(Br)c[nH]1	749837276	BXGUIYFHTIRFPW-UHFFFAOYSA-N	441.716	1.232	50	20	IDGD	
CCCS(=O)(=O)N1CCCC[C@@H]1C(=O)NNc1nc(Br)cn2ccnc12	750246426	LTUXDJVKQLAGCV-LLVKDONJSA-N	445.343	1.529	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN(C(=O)c2ccc3n[nH]cc3c2)C1)c1ccc2c(c1)OCO2	751290641	NYUKBLIEHROADJ-HNNXBMFYSA-N	435.440	1.605	50	20	IDGD	
C[C@@H]1CN(S(=O)(=O)c2ccc(C(=O)NNC(=S)N[C@H](C)C3CC3)cc2)C[C@@H](C)O1	751619254	LVGAKPUAJYIURX-MGPQQGTHSA-N	440.591	1.392	50	20	IDGD	
CCOC(=O)c1ccc(N2CC(NC(=O)NNC(=O)[C@@H](C)Oc3ccccc3F)C2)nc1	753283145	KIZRODZLANOWBN-CYBMUJFWSA-N	445.451	1.384	50	20	IDGD	
O=C(COC(=O)CSc1ccccc1Cl)NNC(=O)[C@H]1COc2ccccc2O1	753548101	BXLXJHZKDOQAFU-OAHLLOKOSA-N	436.873	1.963	50	20	IDGD	
Cc1ccc(O)c(C=NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1	755490270	LOYTWMWJBIOFPJ-UHFFFAOYSA-N	431.514	1.804	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)Nc2cccc(S(=O)(=O)NC(C)(C)C)c2)c1	755513473	AFBOOVASPRZQPL-UHFFFAOYSA-N	448.505	1.583	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NN=Cc1[nH]cnc1C)N(S(C)(=O)=O)CC2	755572654	OODXLMFRVOUNKP-INIZCTEOSA-N	435.506	1.135	50	20	IDGD	
COC(=O)CCNC(=O)c1ccc(NC(=O)NNC(=O)c2cc(Cl)ccc2O)cc1	755603739	MVFDETBPXITMHV-UHFFFAOYSA-N	434.836	1.805	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2ccc(C(=O)OC)cc2F)c2ccccc2c1=O	756403497	PVZDMQGSNCLKPW-UHFFFAOYSA-N	427.392	1.809	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN(CCc2ccccc2)[C@H]2CCOC2)cc1OC	756544960	SQDPMAFGKVFHAC-IBGZPJMESA-N	427.501	1.798	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)Nc2ccc(S(=O)(=O)NC)cc2)cc1	756639903	IEFWERFCICNVHQ-ZDUSSCGKSA-N	436.490	1.614	50	20	IDGD	
CS(=O)(=O)CCc1ccc(NC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])cc1	757749632	VFSAKIBTCZRCFW-UHFFFAOYSA-N	436.446	1.414	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)ncn1	757763413	MYZXEDZMCPJEQB-UHFFFAOYSA-N	445.443	1.654	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1cc(C(F)(F)F)ccc1Br	758045065	BGAFJSLYGRPTLC-LURJTMIESA-N	432.218	1.167	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)[C@H](Sc1ccc(F)cc1)c1ccccc1	758049234	YRIJIAOGNVMTIY-MLGOLLRUSA-N	425.507	1.744	50	20	IDGD	
CCOC(=O)[C@@H]1CCC(=NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)C[C@@H]1C	758120197	XQZNXPVZXYWYGB-FXAWDEMLSA-N	428.533	1.916	50	20	IDGD	
CN1C(=O)C[C@H](C(=O)NNC(=O)CNC(=O)c2ccco2)[C@H]1c1ccc(Cl)c(F)c1	758960132	KPYQOEQADMUQSI-APPDUMDISA-N	436.827	1.169	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCc2ccccc2-c2cnn(C)c2)c2ccccc2c1=O	759621030	YWGPEXXBJIPUIQ-UHFFFAOYSA-N	445.483	1.961	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)[C@@H]2CCCN2C(=O)Nc2ccc3c(c2)OCCO3)nc1	759728687	GPMXPQOSJCYMIX-HNNXBMFYSA-N	441.444	1.779	50	20	IDGD	
COc1ccc(/C=C(\C#N)C(=O)OCC(=O)Nc2cc(S(N)(=O)=O)ccc2C)cc1	759861590	RQDUEAJROOJGFA-OQLLNIDSSA-N	429.454	1.740	50	20	IDGD	
C[C@@H](C1CC1)n1nccc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	760303434	NNPIDUFODSHOKW-LBPRGKRZSA-N	432.506	1.377	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)[C@H](C)Sc3nnnn3C3CC3)n[nH]2)cc1	763166603	VIEKGJGYRLPKMQ-NSHDSACASA-N	426.506	1.902	50	20	IDGD	
CCS(=O)(=O)N[C@@H](CCSC)C(=O)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	763172885	DHGRPBAXFLEFQI-ZDUSSCGKSA-N	443.526	1.038	50	20	IDGD	
COc1ccc(C(=O)O)cc1S(=O)(=O)NNC(=O)CCCNC(=O)OC(C)(C)C	763439044	HGKDUSOHRQFQBN-UHFFFAOYSA-N	431.467	1.008	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2ccccn2)cc1NC(=O)OC(C)(C)C	763464457	SRNJNNPFYGVZPY-UHFFFAOYSA-N	429.433	1.837	50	20	IDGD	
O=C(Cc1ccc(NC(=O)C(=O)NNC(=O)c2cccnc2)cc1)Nc1ccccc1F	763492047	STXBZQGYJXVHLB-UHFFFAOYSA-N	435.415	1.802	50	20	IDGD	
O=C(NNC(=O)c1cccnc1)C(=O)Nc1cc(F)c(F)cc1I	763495027	PJSPLVTXCAHASY-UHFFFAOYSA-N	446.151	1.364	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1ccc(N2CCO[C@@H](C)C2)cc1	763629657	QFUPHBBYFFDKBR-AWEZNQCLSA-N	436.472	1.268	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2ccc(C)c(C(=O)NC(C)C)c2)c1	763648261	BBEJJLWWTQSCIQ-UHFFFAOYSA-N	440.500	1.915	50	20	IDGD	
CC(=O)Nc1cc(NC(=O)C(=O)NNC(=O)COc2ccc(C)c(C)c2)c(F)cc1F	763665311	TUWBBDJHGTXJGH-UHFFFAOYSA-N	434.399	1.705	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cn(-c2ccccc2)nc1C	763684469	LXVLSQDCZDTUDV-UHFFFAOYSA-N	437.456	1.744	50	20	IDGD	
N#Cc1c(F)cccc1-n1ccc(NC(=O)C(=O)NNC(=O)c2cccc(Cl)c2)n1	763752791	QUIGVEIDCQXUKN-UHFFFAOYSA-N	426.795	1.936	50	20	IDGD	
COC(=O)c1ccc(OC(C)C)c(NC(=O)C(=O)NNC(=O)c2cccc(N(C)C)c2)c1	763758817	VCPCQYNPKUNHLH-UHFFFAOYSA-N	442.472	1.726	50	20	IDGD	
C[C@H](c1ccc(NC(=O)C(=O)NNC(=O)c2cccc(N(C)C)c2)cc1)N1CCOCC1	763759891	FXUOQTQFBBARGU-MRXNPFEDSA-N	439.516	1.546	50	20	IDGD	
CCCNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2cc(OC)cc(OC)c2)c1	763772340	PUTBZRLRXONUDA-UHFFFAOYSA-N	428.445	1.243	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)cc1C(=O)N(C)C	763839368	GAHNABXAMVCCPW-MRXNPFEDSA-N	440.500	1.867	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cccc(NC(C)=O)c2C)cc1	763859820	GCJMXWIOZGZIBK-AWEZNQCLSA-N	442.472	1.906	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(F)c(NC(C)=O)c2)cc1	763860506	HZHCPGXKJNHOMT-LBPRGKRZSA-N	446.435	1.736	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2sccc2C(=O)OC)cc1	763861300	NPCGTTRMZJPKHM-NSHDSACASA-N	435.458	1.487	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)Cc2c[nH]c3ccccc23)ccc1Cl	763865705	RFXHWDHBQKVCMQ-UHFFFAOYSA-N	428.832	1.937	50	20	IDGD	
Cc1cnn(-c2ccc(NC(=O)C(=O)NNC(=O)c3cc(Br)c[nH]3)cc2F)c1	763996225	XFBRUSSKQVMJBL-UHFFFAOYSA-N	449.240	1.810	50	20	IDGD	
CC(C)(C)c1cc(NC(=O)C(=O)NNC(=O)Cc2ccsc2)n(-c2ccccn2)n1	764033686	MTBQFQAFHKXUBA-UHFFFAOYSA-N	426.502	1.955	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2cc(C)[nH]n2)cc1NC(=O)C1CCCCC1	764098958	QLGCYHFLCKHODL-UHFFFAOYSA-N	442.476	1.645	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)CCC(=O)N3)o1	764138204	FJZIZPKHBZWHJB-UHFFFAOYSA-N	427.461	1.406	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)NC3CC3)cc2)o1	764138954	LWJVVDJUKDJUBZ-UHFFFAOYSA-N	441.488	1.413	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2O1)C(=O)Nc1cc(F)c(N2CCCC2)c(F)c1	764164480	QBVJEDULTTXJJI-KRWDZBQOSA-N	430.411	1.655	50	20	IDGD	
Cc1cc(Oc2ncccn2)ccc1NC(=O)C(=O)NNC(=O)[C@@H]1Cc2ccccc2O1	764166297	AUQLOIMRYISQEL-SFHVURJKSA-N	433.424	1.667	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)CCCc2ccccc2)cc1N1CCOC1=O	764227044	LSRVPLXSZXWBMR-UHFFFAOYSA-N	440.456	1.761	50	20	IDGD	
CSc1cc2c(cc1NC(=O)C(=O)NNC(=O)c1ccc(O)c(Cl)c1)OCCO2	764349067	FFEYGMRBWLGVQP-UHFFFAOYSA-N	437.861	1.938	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(=O)n(Cc3ccccc3Cl)c2)o1	764371915	PJXMVHPMDPBRMQ-UHFFFAOYSA-N	428.832	1.851	50	20	IDGD	
Cc1ccc(-c2nc3cc(F)ccc3n2C(C)C)cc1NC(=O)C(=O)NNC(=O)CO	764421872	OIWKMOMDJYIRAX-UHFFFAOYSA-N	427.436	1.810	50	20	IDGD	
O=C(NNC(=O)c1ccnn1C1CCCC1)c1cccc(S(=O)(=O)N2CCOCC2)c1	764461104	BDQOPCNHIQEPQR-UHFFFAOYSA-N	447.517	1.094	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)[C@@H]1CCCN(C(=O)NC2CCCC2)C1	765317538	PAVNBCJHMGKGPT-OAHLLOKOSA-N	439.557	1.803	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cc(C)[nH]n2)cc1S(=O)(=O)N1C[C@@H](C)C[C@@H](C)C1	765588350	XLMYRLPGCNUJJB-BETUJISGSA-N	449.533	1.468	50	20	IDGD	
Cc1[nH]c2ccccc2c1CC(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765734911	FKRZBIKZRPZSIS-UHFFFAOYSA-N	433.512	1.624	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@H](C)NC(=O)C3CCCCC3)CC2)cc1	765755776	SBMXVMREMQPFCS-IBGZPJMESA-N	443.592	1.345	50	20	IDGD	
N#Cc1ccc(CC(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)cc1	765756092	LEKLOLPCFRVKGF-UHFFFAOYSA-N	425.920	1.719	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)NC[C@H]2CCCS2(=O)=O)c2ccccc2c1=O	767174250	HJYNPTHLNWBVST-CQSZACIVSA-N	449.533	1.108	50	20	IDGD	
COCCN(CCNC(=O)NNC(=O)c1cc(Br)c[nH]1)C(=O)OC(C)(C)C	767186771	COEJMOJORSYVFP-UHFFFAOYSA-N	448.318	1.605	50	20	IDGD	
CCc1ccc(N2C[C@@H](C(=O)OCC(=O)NNC(=O)Cc3ccccc3C)CC2=O)cc1	767257246	KRHLAKHFJPISAL-IBGZPJMESA-N	437.496	1.844	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)c1sc(-c2ncccn2)nc1C	767295676	YKCGDVHGNJKLSW-UHFFFAOYSA-N	425.470	1.764	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)CN2C(=O)N[C@@]3(CCCC(C)(C)C3)C2=O)c1	768701523	DOPXROZQOAGBAE-JOCHJYFZSA-N	444.488	1.190	50	20	IDGD	
COC(=O)CCN1CCN(C(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)[C@@H](C)C1	770655599	FTZUBLCCXNVWSY-UONOGXRCSA-N	426.901	1.417	50	20	IDGD	
O=C(NCCNS(=O)(=O)c1ccccc1[N+](=O)[O-])NNc1c(F)cccc1Cl	771328639	VUGIIACYTZEJGF-UHFFFAOYSA-N	431.833	1.992	50	20	IDGD	
CCc1nc(-c2ccc(C(=O)NNC(=O)C(=O)NCc3ccc(Cl)cc3)cc2)n[nH]1	772883520	CDICJTWEMUUELG-UHFFFAOYSA-N	426.864	1.765	50	20	IDGD	
Cc1cc(C)cc(N2CC[C@@H](C(=O)NNC(=O)C(=O)NCc3ccc(Cl)cc3)C2=O)c1	772889346	FYLHQLCGRJRPGU-SFHVURJKSA-N	442.903	1.774	50	20	IDGD	
COc1ccc(CC(=O)O)cc1S(=O)(=O)NNC(=O)[C@H](C)Oc1cccc(Cl)c1	773251649	NMYSKUHWDCMOJX-NSHDSACASA-N	442.877	1.753	50	20	IDGD	
CC(C)c1nccnc1NNC(=O)C(=O)Nc1ccc(C(=O)N2C[C@H](C)O[C@@H](C)C2)cc1	774000289	SFRWOJGTGYYNMY-GJZGRUSLSA-N	440.504	1.931	50	20	IDGD	
Cn1cc(NS(=O)(=O)c2ccsc2C(=O)NNc2cnc3ccccc3n2)cn1	774780456	UQPYTGHIMDVXRV-UHFFFAOYSA-N	429.487	1.983	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1=O	776180574	FSQWWSQLNGVJGJ-WCQYABFASA-N	432.399	1.193	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)CCNS(=O)(=O)c2cccc(Cl)c2)c1	776529020	CAVMEDMLNQRQSS-UHFFFAOYSA-N	431.923	1.555	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@]2(C[C@H]2C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)C1	781886762	RPMCBNULLVTCQU-NYHFZMIOSA-N	441.488	1.986	50	20	IDGD	
O=C(NNc1nccc(N2CCOCC2)n1)c1cccc(NS(=O)(=O)C(F)(F)F)c1	782851913	XSBMRMDNKDSJJG-UHFFFAOYSA-N	446.411	1.332	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNc2ccc(C)nn2)c(Br)cc1F	783947964	OPGMQOKTTVLFPS-UHFFFAOYSA-N	426.202	1.555	50	20	IDGD	
NC(=O)[C@H](Cc1ccc(C(F)(F)F)cc1)NNC(=O)C1CCN(c2ncccn2)CC1	784065123	NKYSCECCMMSRCU-INIZCTEOSA-N	436.438	1.429	50	20	IDGD	
O=C(Cn1cc(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2Cl)cn1)NC1CCCC1	784382542	ACNPEHJXTPVVEC-UHFFFAOYSA-N	449.855	1.585	50	20	IDGD	
O=C(NNc1ccc(OC(F)(F)F)cc1)C(=O)Nc1ccn(CCN2CCOCC2)n1	784800858	GECDKQXVHAJCHN-UHFFFAOYSA-N	442.398	1.196	50	20	IDGD	
CC(=O)N1CCN(Cc2ccc(NC(=O)C(=O)NNc3ncccc3Cl)cc2)CC1	784815164	PQIHMAQKWRWPMN-UHFFFAOYSA-N	430.896	1.481	50	20	IDGD	
CN(C)c1ccc(S(=O)(=O)N(C)C)cc1NC(=O)C(=O)NNc1ncccc1Cl	784818107	NMGFMHKZEMNTMN-UHFFFAOYSA-N	440.913	1.133	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C[C@H](NC(=O)OC(C)(C)C)C2CC2)c2ccccc2c1=O	785013979	OQAWPTKBRLVPQA-INIZCTEOSA-N	443.504	1.871	50	20	IDGD	
Cc1cnn(-c2ccc(C(N)=O)cc2NC(=O)C(=O)NNc2cc(F)c(F)c(F)c2)c1	785088302	JATGDXPRWSHJGY-UHFFFAOYSA-N	432.362	1.779	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNc2cc(F)cc(OC)c2)cc1OC	785235239	QKJYGJOSKCEMJZ-UHFFFAOYSA-N	440.453	1.686	50	20	IDGD	
COC(=O)CCc1ccc(NC(=O)C(=O)NNc2c(OC)cccc2S(C)(=O)=O)cc1	785330899	NVXDOIOZMGZHKL-UHFFFAOYSA-N	449.485	1.286	50	20	IDGD	
O=C(Cc1ccccc1CO)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	787439379	JEUXAYWSFYIFIX-UHFFFAOYSA-N	430.936	1.340	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1)c1ncnn1C	788884860	CYWOHWCDYDVYOE-UZLBHIALSA-N	433.516	1.834	50	20	IDGD	
Cn1nc(CC(C)(C)C)cc1NC(=O)C(=O)NNC(=O)[C@H]1OCC[C@H]1c1ccccc1	789814061	ZDXYGZVIWFPWNI-WMZOPIPTSA-N	427.505	1.667	50	20	IDGD	
Cc1c(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cccc1[N+](=O)[O-]	790564908	NOPMAJLICSRAJH-UHFFFAOYSA-N	435.462	1.298	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)Nc2ccnn2-c2ccc(Br)cn2)n1	790580157	RZZIEXVWTHVGBI-UHFFFAOYSA-N	433.270	1.696	50	20	IDGD	
CO[C@H]1CCOc2c(NC(=O)C(=O)NNC(=O)C(F)(F)Oc3ccccc3)cccc21	790952103	JIKDYUIKUAWWIQ-HNNXBMFYSA-N	435.383	1.914	50	20	IDGD	
C[C@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)n1ccc2ccccc2c1=O	791198050	YBRWDFZDSLMOLJ-CQSZACIVSA-N	442.497	1.274	50	20	IDGD	
O=C(COC(=O)[C@H]1CCS(=O)(=O)c2ccccc21)NNC(=O)c1ccc(Cl)cc1	792816044	DPMSIPCRIFRHNW-HNNXBMFYSA-N	436.873	1.605	50	20	IDGD	
COC(=O)c1cc(F)c(Br)cc1NC(=O)C(=O)NNc1cccc(OC)n1	796985198	NSEVEEYRAWEMFO-UHFFFAOYSA-N	441.213	1.860	50	20	IDGD	
CC(=O)N[C@](C)(C(=O)NNc1ccc(C(F)(F)F)nn1)c1ccc(S(C)(=O)=O)cc1	797747007	CIKFPMHJIIBBNI-INIZCTEOSA-N	445.423	1.394	50	20	IDGD	
CCCCNS(=O)(=O)c1ccc(C)c(NC(=O)C(=O)NNC(=O)CC2CCCC2)c1	799834692	HPOSZVIOFIILQK-UHFFFAOYSA-N	438.550	1.740	50	20	IDGD	
COC(=O)c1c(F)cc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)cc1F	802567166	NSHTYPDOYTXYPP-UHFFFAOYSA-N	427.747	1.510	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCCC1(O)CCOCC1	804879348	DMXJUSWDOAEQHB-LBPRGKRZSA-N	430.299	1.478	50	20	IDGD	
Cc1cc([N+](=O)[O-])ccc1NNC(=O)[C@H]1CC(=O)N(c2cccc(S(N)(=O)=O)c2)C1	805382721	VNTQEZFSRDCIRP-LBPRGKRZSA-N	433.446	1.047	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)N1CCC[C@@H](CNS(=O)(=O)C2CC2)C1	808266141	JSRURMBLHLQSFA-HNNXBMFYSA-N	433.534	1.176	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)C(=O)OC3)cc1	808934489	HRTGMZTYBIBWRT-LBPRGKRZSA-N	425.397	1.113	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(=NNC(=O)CNC(=O)c2cccnc2)[C@H]([C@H]2CCOC2)C1	812226802	UDCIOYSADZBLIJ-IRXDYDNUSA-N	445.520	1.577	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(=NNC(=O)CNC(=O)c2ccco2)[C@H]([C@H]2CCOC2)C1	812227251	WHQGXUPFEIOCKU-GJZGRUSLSA-N	434.493	1.775	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@H]2c3ccccc3O[C@H]2C)cc1	812430779	RNKIEDWPOTVKID-IFXJQAMLSA-N	432.502	1.468	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)N[C@@H]2CC(=O)N(c3ccccc3F)C2)cc1	812932217	OHHBODGQVMVBLQ-CYBMUJFWSA-N	449.464	1.370	50	20	IDGD	
CN(C)c1nc2cc(NC(=O)C(=O)NNc3ccc(S(=O)(=O)N(C)C)cc3)ccc2o1	813033890	QADQCRCOIMXIPI-UHFFFAOYSA-N	446.489	1.226	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccc3c(c2)OCCO3)c1	813465419	QFQMVANNAMXMTB-UHFFFAOYSA-N	448.501	1.955	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](NC(=O)NN[C@@]2(C)CCS(=O)(=O)C2)CC12CCC2	813800594	VEFYXZPVHJEFPU-KSSFIOAISA-N	430.571	1.690	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@H](F)C[C@H]1CNC(=O)NNC(=O)c1ccc2c(c1)OCCO2	813811271	WSDRTERTIZIVIQ-KBPBESRZSA-N	438.456	1.749	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(/C#N)C(=O)NS(=O)(=O)c2cnn3c2OCCC3)c1C	816205299	RGPKILOKXCAVEW-DUPVFGOHSA-N	447.517	1.703	50	20	IDGD	
CC(=O)[C@@H]1CC(C(=O)NNc2ccccc2S(=O)(=O)N(C)C)=NN1c1ccccc1	817052810	QYZOZUAEWMOUOP-SFHVURJKSA-N	429.502	1.604	50	20	IDGD	
O=S(=O)(c1c(Br)cc(F)cc1Br)N1CC[C@H](B(O)O)C1	864231171	JOWOGJKHHSZINV-LURJTMIESA-N	430.886	1.588	50	20	IDGD	
CCC[C@@H](NC(=O)NCc1ccc(Br)cc1)C(=O)N1CC[C@H](B(O)O)C1	864234525	SGIIBGSGOZTJLX-DZGCQCFKSA-N	426.120	1.492	50	20	IDGD	
COc1ccc(C(=O)NN=Cc2c(N3CCOCC3)nc3ccccn3c2=O)cc1OC	864237230	QEELKEQWEWZPSU-UHFFFAOYSA-N	437.456	1.312	50	20	IDGD	
CN(CC(=O)NNC(=O)c1ccc(-c2ccc(F)cc2)s1)[C@@H]1CCS(=O)(=O)C1	914531861	JGRWFYCPGBSPCU-CQSZACIVSA-N	425.507	1.434	50	20	IDGD	
NS(=O)(=O)c1ccc2c(c1)oc(=O)n2CC(=O)NNc1ccccc1C(F)(F)F	914605050	OVZDYOMPYUHHQX-UHFFFAOYSA-N	430.364	1.404	50	20	IDGD	
O=C(NNC(=O)C1CCN(C(=O)COc2ccccc2)CC1)c1cccc([N+](=O)[O-])c1	914836249	CWUYUEWXJXEXBA-UHFFFAOYSA-N	426.429	1.673	50	20	IDGD	
Cc1cc(C)n(-c2ccc(CC(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)cc2)n1	915642281	ALOVIPWGVVETII-UHFFFAOYSA-N	426.498	1.896	50	20	IDGD	
CCCCS(=O)(=O)N1CCC[C@H]1C(=O)NNC(=O)c1cc(OC)c(OC)c(OC)c1	915874378	DZXOYNNUVHQTSI-AWEZNQCLSA-N	443.522	1.068	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)NC[C@H]1CN(Cc2ccccc2)CCO1	915894994	SWCDCTARBUNRHA-FQEVSTJZSA-N	426.517	1.859	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)NC[C@@H]1CN(Cc2ccccc2)CCO1	915894997	SWCDCTARBUNRHA-HXUWFJFHSA-N	426.517	1.859	50	20	IDGD	
COc1cc(-n2cnnn2)c(Cl)cc1C(=O)NNC(=O)c1c(C)nc2ccccn12	916148217	LWELEQLGABWADW-UHFFFAOYSA-N	426.824	1.355	50	20	IDGD	
CS(=O)(=O)NCCNC(=O)NNC(=O)c1cc(-c2ccccc2)nc2ccccc12	916294234	GAWFAJHYILNMCI-UHFFFAOYSA-N	427.486	1.395	50	20	IDGD	
CCOc1ccc(/C=C(/C#N)C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1	916599097	GGMZLLJJDDWXOT-WJDWOHSUSA-N	438.396	1.905	50	20	IDGD	
Cc1ccc(S(=O)(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc1F	917722115	PMJXPMWNBBWWJY-UHFFFAOYSA-N	441.506	1.542	50	20	IDGD	
CCN1C(=O)c2ccc(C(=O)NNC(=O)COc3ccc(C)c(C)c3)cc2S1(=O)=O	917908330	HTWOHPHGHBEVSN-UHFFFAOYSA-N	431.470	1.308	50	20	IDGD	
COC1(C(=O)NNC(=O)COc2ccc(C#N)cc2)CCN(C(=O)OC(C)(C)C)CC1	917908574	NVBRYNRRUXTXPV-UHFFFAOYSA-N	432.477	1.501	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NCCCn2ccnc2C)c2ccccc2c1=O	918223206	HFUKTMCHBJWJHI-UHFFFAOYSA-N	425.493	1.736	50	20	IDGD	
Cc1c(/C=C(\C#N)C(=O)OCC(=O)NCCCN2CCCCCC2=O)cc(C#N)n1C	919044084	HDODREAFWQPRLO-WOJGMQOQSA-N	425.489	1.564	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2ccc(OCC3CC3)cc2)cc1	919810650	VGNDYWGIBXBIDG-UHFFFAOYSA-N	431.514	1.866	50	20	IDGD	
Cc1csc([C@@](O)(CC(=O)NNC(=O)[C@H]2COc3ccccc3O2)C(F)(F)F)n1	920253414	BIYWQNNULPWPOG-WBMJQRKESA-N	431.392	1.579	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)c3cccn3C)CC2)cc1	920430941	LHAKHNJVHIFYFV-UHFFFAOYSA-N	434.518	1.286	50	20	IDGD	
COc1cc(OCC(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)ccc1[N+](=O)[O-]	921111110	OYZJTJILWZDCPT-UHFFFAOYSA-N	437.792	1.640	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN1C(=O)c1ccccc1OC(F)F)c1n[nH]c2c1CCCC2	1115866581	IBBMQXIQAXTUHH-OAHLLOKOSA-N	447.442	1.956	50	20	IDGD	
CC(C)(C)OC(=O)N1CCCCC[C@H]1C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	1255279703	AFYGHBNRRXEEQA-INIZCTEOSA-N	429.481	1.603	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NCc2cccc(CN3CCN(C)CC3)c2)cc1	1321513881	WLQFLTWVYMCKCT-UHFFFAOYSA-N	441.532	1.352	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)N[C@H](C)CC(=O)OC(C)(C)C	1327238571	MFPRJQSCVVJMRN-LLVKDONJSA-N	427.527	1.352	50	20	IDGD	
Cn1ncc2c(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)[C@@H](O)CCl)C4)cccc21	1778708304	JGSALQVTDVGJNV-WAOWUJCRSA-N	434.924	1.301	50	20	IDGD	
C=C(C)CC(C)(C)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1	1779032627	VSVZDIAEWPZRTQ-JOCHJYFZSA-N	429.521	1.121	50	20	IDGD	
CN(C)c1cccc(OCC(=O)N2CCO[C@@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)c1	1779293733	BAGFWHSLUUPXND-JOCHJYFZSA-N	449.624	1.813	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(-n4ccnc4)ccn3)C2)C1	1780384647	QYUGDWOHNPQNDH-NRFANRHFSA-N	431.924	1.976	50	20	IDGD	
COc1ccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](O)CCl)C3)c(F)c1	1780897913	DVUAZNLHFJUWEY-MBOZVWFJSA-N	428.888	1.562	50	20	IDGD	
CC(=O)Nc1cc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)ccn1	1781329733	JEYFHDXCMJPDFK-PBHICJAKSA-N	443.273	1.174	50	20	IDGD	
O=C1NCc2cc(C(=O)N3CCO[C@@]4(CCN(C(=O)[C@@H](F)Br)C4)C3)ccc21	1781331317	IFVDIQQFKAUTLU-RDTXWAMCSA-N	440.269	1.064	50	20	IDGD	
O=C(c1n[nH]c2cccc(F)c12)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781332435	HNOKLMBQWYYNSF-YOEHRIQHSA-N	443.248	1.836	50	20	IDGD	
O=C(c1cccc(F)c1[N+](=O)[O-])N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781334309	XTMISFGUMQOAMS-BBRMVZONSA-N	448.220	1.868	50	20	IDGD	
O=C(CCCc1cccnc1)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781335569	VWXHAAZQARVFNL-SJLPKXTDSA-N	428.302	1.925	50	20	IDGD	
O=C(c1ccc(-c2ccc(O)nn2)cc1)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Cl)CCO2	1782115830	ODEHMXBFXMWSKV-XLIONFOSSA-N	434.855	1.827	50	20	IDGD	
O=C(c1cnc2ccc(Cl)cc2c1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1782271688	NVIDSBHZROXWDH-FXAWDEMLSA-N	438.311	1.931	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cnc4snnc4c3)CCO2)C1	1783537291	NIDGXLFLTZRYAJ-QLJPJBMISA-N	440.323	1.313	50	20	IDGD	
C[C@@H](CC(=O)N1CCO[C@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1)Oc1ccccc1	1783937806	XUXKIAXXMDMFNV-MBSDFSHPSA-N	446.548	1.047	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccccc3N3CCCCC3)C[C@@H]21)[C@@H](O)CCl	1784093031	ZVBHTBRQWFJIHZ-GIUOSPMZSA-N	449.979	1.870	50	20	IDGD	
CC(=O)Nc1ccccc1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2	1785100828	SOADLXNBWVSWSI-YJYMSZOUSA-N	438.322	1.872	50	20	IDGD	
CCOC(=O)c1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)C(Cl)Cl)C[C@@H]32)ccn1	1789339555	QOORALZFYADULS-YDHLFZDLSA-N	444.315	1.655	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C/N=C/c3ccco3)C[C@@H]21	1789870520	LCNNSGMTHYHONB-WNSOGJMVSA-N	430.332	1.915	50	20	IDGD	
C[C@@H](Nc1cccnc1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]2C1	1789923104	YJTQBRSPZXHLSH-MLEONAHRSA-N	443.317	1.552	50	20	IDGD	
COCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](Br)Cc3ccccc3)[C@H]2C1	1790780848	WGFUNEIAGKXYIO-FJIDUMEYSA-N	439.350	1.619	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4nncn4c3)C[C@@H]21	1791056149	OZSQOPRJZULJIS-UNQGMJICSA-N	436.310	1.106	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nccc4[nH]ccc34)C[C@@H]21	1791058033	WQJOPHACMHLHRM-DSPQJCBJSA-N	435.322	1.940	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc4c3cnn4C)C[C@@H]21	1791254318	OIGKTAZVYRNUHG-KUZCPNRJSA-N	434.924	1.420	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3COc4ccccc4O3)C[C@@H]21)C(Cl)Cl	1791294356	ZDOZDUJTDCBGKL-GVAFMPQTSA-N	429.300	1.610	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1ccc(C2(NC(=O)Cn3cc(C)c(O)nc3=O)CCC2)cc1	1791572186	UFEOMIIEGJBAHW-INIZCTEOSA-N	448.907	1.645	50	20	IDGD	
COc1cc(C(=O)NC2(c3ccc(NC(=O)CCC(=O)NN(C)C)cc3)CCC2)nn1C	1791600965	RNHIVXYJECNXSR-UHFFFAOYSA-N	442.520	1.549	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)Cc1ccncc1)C2	1792872098	LXSZGWGXKOKVPU-QKGUJMCYSA-N	438.366	1.881	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1CCCC1)C2	1793880930	LLJJXIZXWNEMSB-YVSFHVDLSA-N	443.972	1.898	50	20	IDGD	
Cn1ccnc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1794141273	QBVDNOFKJWSHBW-XGUBFFRZSA-N	439.944	1.804	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccnc(Cl)c1	1794753705	WVADIYXBGMLBSD-DNVSUFBTSA-N	430.730	1.969	50	20	IDGD	
COc1ccc(F)cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCBr	1795116943	HEJKMVBBMYAJMZ-DPIQGUFMSA-N	429.286	1.823	50	20	IDGD	
O=C(Cc1cc(F)ccc1F)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1	1796190685	YFXSBDWFGLGJOE-REPLKXPHSA-N	428.244	1.139	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Cl)C[C@@H]2C[C@@H]21	1796361196	KZFMWZDHUWULNS-SNEOULSLSA-N	445.919	1.508	50	20	IDGD	
CCOC(=O)C1(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)CC1	1796893543	FZGSKZJPFJKFRS-BDHJUDLHSA-N	443.504	1.102	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1cc2n(n1)CCCC2	1797442401	CQITYYBITABJTG-JLUCKKNBSA-N	429.290	1.113	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCN1Cc3ccccc3C1=O)C2	1799267545	BEAWKNVTNDZKIR-WQDJSCAQSA-N	433.936	1.640	50	20	IDGD	
COC(=O)[C@@H]1CC[C@@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@](C)(Cl)CCl)C1	1799273266	ATSXTEWATNFJFG-VZTYJIHUSA-N	435.348	1.402	50	20	IDGD	
COc1ncc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Br)cc1F	1799347041	CUHVUTBVSGCLQN-LFSVMHDDSA-N	434.237	1.123	50	20	IDGD	
Cc1nc2ccc(F)cn2c1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CO[Si](C)(C)C)C2	1799955735	CVALMLVAKVTDOI-CCWDJLKJSA-N	448.571	1.837	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](O)Cc1ccccc1	1800632363	OAXSPVPFEZCKOJ-MWTISTBLSA-N	439.350	1.211	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnn(-c3cccnc3)c1)C2	1800757358	DLQRXVUCQHNXEK-JJAZEVLHSA-N	448.321	1.254	50	20	IDGD	
CC(C)c1nc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)Br)no1	1800757587	QMMVXTPQEHVWTC-OHTBPHCPSA-N	429.315	1.109	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c[nH]c3nccc-3c1Cl)C2	1800974787	ALVBMODDCONIHL-VAECKANCSA-N	441.315	1.625	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCCn1cccc1	1801411193	VFFIFTGJAYCRFY-CUSZFKRNSA-N	426.355	1.889	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)Br)C3)c1	1801787396	MROYRRMNAUATHY-FIUQPQMISA-N	438.322	1.632	50	20	IDGD	
CC[C@@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(C(=O)O)ncn1)C2	1801798345	CRBQSAWUAABAPT-WRWGMCAJSA-N	425.283	1.600	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCc1c[nH]c2ncccc12	1802067828	PFEFXNMHGQEAJG-FRQROOTJSA-N	449.349	1.869	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1C[C@@H]1c1ccccc1	1802208282	WJBAWADZAMPIQT-JEIKXUOUSA-N	433.512	1.741	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](C)NC(=O)c1ccc(F)cc1)C2	1802284056	VZDKDKUIBLBFAR-SOGIYBJLSA-N	439.915	1.836	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cccc3c2OCCO3)[C@@H]1c1cccnc1)[C@H](O)CCl	1803139650	RZVIINGSKCYLST-KVSKMBFKSA-N	445.903	1.772	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC2(CCCN(C(=O)c3cc(C4CC4)on3)C2)CC1	1805143194	LBQFCLMCFDRSMI-UHFFFAOYSA-N	437.305	1.390	50	20	IDGD	
COC(=O)C1(C(=O)N2CC[C@H](CNC(=O)CCBr)[C@@H]2c2cccnc2)CC1	1806346523	KADLHEXDWGDVFL-ZBFHGGJFSA-N	438.322	1.826	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)Cc2ccccc2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807363824	OVGQNFRQUKYSNN-URXFXBBRSA-N	443.312	1.324	50	20	IDGD	
Cc1nnc(CC(=O)NC[C@@H]2CCN(C(=O)[C@@H](C)Br)[C@@H]2c2cccnc2)o1	1807474613	INLKHVAOLWVKET-HYSWKAIVSA-N	436.310	1.805	50	20	IDGD	
O=C(CCc1ccccn1)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1	1809975177	WHFVTRGYHSZDQD-UHFFFAOYSA-N	435.333	1.239	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@H]1CCN(C(=O)c2cc(O)nc(O)n2)[C@@H]1c1cccnc1	1810542449	RMUZZXDEODYGKH-RDTXWAMCSA-N	445.552	1.454	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@@H](CNC(=O)Cn2ccncc2=O)[C@@H]1c1cccnc1	1812339811	LPLXWRBYRHVHBY-LPHOPBHVSA-N	431.924	1.609	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2cccc(=O)n2C)[C@H]1c1cccnc1	1813029139	CIICUAFBMVFGSO-BXWFABGCSA-N	432.908	1.354	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H]2CNC(=O)O2)n[nH]1	1815279513	GSCDKFWXJVOGJX-JLLWLGSASA-N	428.287	1.684	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccns2)n[nH]1	1816274133	FWBFGNVARNGUNS-CQSZACIVSA-N	440.489	1.484	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1cscn1	1816485921	DCANGMCFMNHCSD-MRXNPFEDSA-N	425.279	1.166	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1cncs1	1816581674	NYQFBZXDNQCCNS-OAHLLOKOSA-N	425.279	1.166	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CS(C)(=O)=O)n[nH]1	1817059485	JVFPWMQGMKKRCO-ZYHUDNBSSA-N	435.344	1.620	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCc2cncnc2)n[nH]1	1817556004	ONDDVOOQJKSBFZ-QGZVFWFLSA-N	442.524	1.198	50	20	IDGD	
CC(=O)Nc1cc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)[C@H](O)CCl)[nH]n2)ccn1	1818416591	TYNVLJLEGFEFJH-HUUCEWRRSA-N	434.884	1.669	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccccn2)[nH]n1	1819402113	NWGCAYAOSJKOIL-KRWDZBQOSA-N	434.460	1.423	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)/C=N/O[C@H]3CCCCO3)sc2C1	1819907872	UCECTEYCUPROCO-QJRKHYHYSA-N	444.941	1.838	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)Cc2ccccc2O)n[nH]1	1822012991	ISOXWSWYIMABBT-QGZVFWFLSA-N	442.520	1.723	50	20	IDGD	
Cc1onc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)c1C	1822410519	LIPNYJPFWTUWFH-HNNXBMFYSA-N	431.497	1.693	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)[C@H]1CCCS1	1823008602	IAMPKKWBZVQOAN-DLBZAZTESA-N	428.323	1.291	50	20	IDGD	
C[C@]1(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)CC1(F)F	1823394195	QANXNJOFTDLGFD-HNAYVOBHSA-N	432.236	1.441	50	20	IDGD	
Cc1cc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)[C@@H](O)CCl)CC2)nc2nccn12	1824187910	LCWFXPZNEANCBJ-ROUUACIJSA-N	433.940	1.871	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CN2CC(=O)NC2=O)CC1	1824608953	DWTOQJMTVPKCCI-HZPDHXFCSA-N	426.945	1.565	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccn(C)c1=O)CC2	1825635487	HLHLUSLGFQTZRC-ZJUUUORDSA-N	439.335	1.851	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)Cn1ccccc1=O)CC2	1825640715	CJSPYNGJONBXLR-WDEREUQCSA-N	439.335	1.700	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H]1CCc3nc[nH]c3C1)CC2	1826008827	IAJZOVSIXBZKPF-WOPDTQHZSA-N	437.953	1.837	50	20	IDGD	
CNc1ccc(C(=O)N[C@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)cc1	1826085479	WDIABJZRKBGSLH-HNNXBMFYSA-N	444.561	1.784	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(Cl)cc3F)CCO2)C1	1830090329	SWBFLQHNQSOQFP-DNVCBOLYSA-N	449.306	1.803	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)cn1	1830538101	VXILWQAHNONWQG-KUHUBIRLSA-N	440.338	1.491	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC[C@H]1C1CCN(C(=O)C2=NN(C)C(=O)CC2)CC1	1831648452	GOQDCAULEHMUSW-CJNGLKHVSA-N	441.370	1.998	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H]2CCCS2(=O)=O)CC1	1831835103	OEFQYSDKPCGQLC-ULQDDVLXSA-N	434.986	1.437	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H]2C[C@]2(F)Cl)CC1	1831875578	ZHOJRYJQPKNLKR-RZQQEMMASA-N	430.952	1.904	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)CCCn2ccnc2)CC1	1832159199	ZWGMPWVHYKLJNF-HXUWFJFHSA-N	446.596	1.656	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)C(=O)c2cccn2C)CC1	1832299781	LENCLUPNPGTCBG-GOSISDBHSA-N	445.564	1.201	50	20	IDGD	
CCC(=O)N[C@@H](C)C(=O)NC1CCN(C2CCN(C(=O)CO[Si](C)(C)C)CC2)CC1	1833419923	JMLHIOJZEYUHCS-INIZCTEOSA-N	440.661	1.324	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cccnc3C(N)=O)CC2)CC1	1833918520	WUGCURRFVSQSGW-GOSISDBHSA-N	449.983	1.773	50	20	IDGD	
Cc1ccsc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1833945937	PMRFDMNJRHJCQC-XJKSGUPXSA-N	435.315	1.817	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@](C)(Cl)CCl)C3)C2)n(C)n1	1834165795	XYGPBNQQDMDWQZ-QZTJIDSGSA-N	433.336	1.035	50	20	IDGD	
Cn1cc(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)c(C(F)F)n1	1835240636	VJYVQCCQEDZCOV-HNNXBMFYSA-N	447.914	1.143	50	20	IDGD	
C=CCO[C@@H](C)C(=O)N1CCC(N2CCC(NC(=O)[C@H](F)Br)CC2)CC1	1836413392	FJSVQBHUFRNDSL-BBRMVZONSA-N	434.350	1.840	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H]3CC[C@H](O)CC3)CC2)CC1)[C@H](F)Br	1836414283	BYXOMGHBHNMRBJ-JQFCIGGWSA-N	448.377	1.800	50	20	IDGD	
O=C(c1ccc(Cl)cn1)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836717935	FYCMDMLSEQWSIJ-KRWDZBQOSA-N	430.332	1.947	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc4ncncc4c3)CCO2)C1	1837026022	PBCKJUDFPMFPOV-DYESRHJHSA-N	432.908	1.717	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)c3cn(C)cn3)CC2)CC1	1837551630	QHNIUVVEELIVMB-CYBMUJFWSA-N	427.343	1.816	50	20	IDGD	
Cc1cc(/C=C/C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)no1	1837557026	CCOBLQMPXXPPJD-CZHQAMEJSA-N	446.331	1.689	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)Nc1ccccn1)CCO2	1837738726	XXPBDHJBKWNBPD-WWMYMODYSA-N	438.956	1.746	50	20	IDGD	
N[C@@H](C(=O)N1CCC(OC2CCN(C(=O)C(Cl)Cl)CC2)CC1)c1ccccn1	1837875643	HCDWUHCSNXCESU-MRXNPFEDSA-N	429.348	1.884	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cccnc3Cl)C2)C1	1839142486	QGSFYECMYAYZGZ-BEFAXECRSA-N	430.332	1.751	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(OC(F)F)cn3)C2)C1	1839142997	IDTSGVIXTLAUJJ-LIRRHRJNSA-N	447.866	1.770	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3Cc4ccccc4CN3)C2)C1	1839144520	CVGBGZCWBKQZEL-KNKQGSTJSA-N	435.952	1.175	50	20	IDGD	
O=C(c1n[nH]c2c(Cl)cccc12)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1839495757	WFHMZTLDUOQULS-QAPCUYQASA-N	445.278	1.821	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CCNC(C)C)C2)C1	1839963931	AMHIOCNYPKXPHZ-QAPCUYQASA-N	434.375	1.004	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3CC=CCC3)C2)C1	1839965842	MSRUEOPKDRAXFL-FCEWJHQRSA-N	429.355	1.973	50	20	IDGD	
CC(C)N1CCC[C@H]1C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](C)Br)CCO2)C1	1840036109	FONCARCNMKXDSV-BXWFABGCSA-N	446.386	1.099	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)/C=C/c3cccs3)C2)C1	1840151995	TXMRFOJBTQXFTI-BSCWQEJHSA-N	428.938	1.472	50	20	IDGD	
COc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)c(O)c1	1840189082	VNLCXZYGZBNTCS-SFHVURJKSA-N	433.288	1.275	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CC[C@H](O)CC1)CCO2	1840270707	BYYVEAUCLLZRGR-OHDICMOHSA-N	437.364	1.230	50	20	IDGD	
C[C@@H]1CC[C@@H](C(=O)N2CCCC23CN(C(=O)[C@H](O)CCl)C3)CN1C(=O)OC(C)(C)C	1841033983	YADDYJKPFHCGKY-BZUAXINKSA-N	443.972	1.825	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)[C@@H](O)C(C)(C)C)C1	1841315363	JVQHHSMVWISKHS-QGZVFWFLSA-N	433.461	1.744	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@]2(C(=O)N2CC3(CCCN3C(=O)[C@H](O)CCl)C2)C1	1841353489	ADGUHHCXJGMTTG-ZSDSOXJFSA-N	441.956	1.437	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC2(CCCN2C(=O)[C@H]2CC(=O)N(C3CCCC3)C2)C1	1841860523	ZOHPQEQVMIVWCV-KGLIPLIRSA-N	426.355	1.764	50	20	IDGD	
Cn1c(=O)n(CC(=O)N2CC3(CCCN3C(=O)CCBr)C2)c2ccccc21	1842637991	CSYXTJZIIZGPQX-UHFFFAOYSA-N	435.322	1.328	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)[C@H](C)Nc1ccccn1)C2	1843416340	YIVYEELTCPKRDM-CXEIWHQESA-N	437.504	1.219	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1ccc(N(C)C)nc1)C2	1843416535	VQTRODRYFRDCPD-MFKUBSTISA-N	437.504	1.099	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)Cn1cnc3ccccc31)C2	1843417120	YWMWWHLDLALMRA-WGOQTCKBSA-N	447.499	1.374	50	20	IDGD	
C[C@@H](C(=O)N1CCCC12CN(C(=O)[C@H](F)Br)C2)N1CSCSC1	1844318700	DNBJSFZFAKGVOT-QWRGUYRKSA-N	426.377	1.923	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@H](NC(C)=O)c2cccc(Cl)c2)C1	1845019012	HSGRFXPIIRWZMP-IAGOWNOFSA-N	442.343	1.974	50	20	IDGD	
COc1cc(/C=C/C(=O)N2CCCC23CN(C(=O)[C@H](O)CCl)C3)cc(OC)c1OC	1845948998	IMJDWGCWIPWTHC-LLYBFZRZSA-N	438.908	1.529	50	20	IDGD	
Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CC2(CCCN2C(=O)CCC(=O)NN(C)C)C1	1846385670	GMGVEUKXZKWNQU-UHFFFAOYSA-N	435.456	1.232	50	20	IDGD	
Cc1cccc(C)c1NC(=O)CNC(=O)NNC(=O)c1csc(N2CCOCC2)n1	10257536	APZFOUOHSBPNHL-UHFFFAOYSA-N	432.506	1.179	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@@H]2C(=O)NNC(=S)NC(C)(C)C)cc1	12748651	FRUIRQOQFIJAOR-MRXNPFEDSA-N	440.591	1.726	50	20	IDGD	
C[C@@H]1Cc2cc(C(=O)NNC(=O)c3cc(-c4ccccc4)n[nH]3)ccc2N1S(C)(=O)=O	14805857	NEUXCBKRHSWABQ-CYBMUJFWSA-N	439.497	1.862	50	20	IDGD	
COc1cc(C(=O)NNC(=S)Nc2ccc(C)cc2C)cc(OC)c1OCC(N)=O	16174883	BGIWGUYKBRRDFK-UHFFFAOYSA-N	432.502	1.816	50	20	IDGD	
Cc1ccc(S(=O)(=O)Nc2ccc(F)cc2)cc1C(=O)NNc1nnc(C)c(O)n1	23311115	PSLDOARRSRWSHR-UHFFFAOYSA-N	432.437	1.891	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2ccc([N+](=O)[O-])c(OC)c2)cc1OC	725948490	QMZKBZZLWNAOSI-UHFFFAOYSA-N	433.373	1.239	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=S)Nc2ccc(OC)nc2)c1	726892053	COHGOVNUTCPHOF-UHFFFAOYSA-N	437.547	1.752	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NNC(=O)c1c(Cl)cccc1Cl	727844091	CUXKJRZYWCAWKC-UHFFFAOYSA-N	430.273	1.460	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(OC)c(C(=O)NNC(=S)NCC2CCC2)c1	727866209	VQUAUTVWPJRBHO-UHFFFAOYSA-N	428.580	1.635	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)c1	728213191	GEGTZSOGTGYWLE-UHFFFAOYSA-N	432.546	1.762	50	20	IDGD	
CC[C@H](C)C(=O)NNS(=O)(=O)c1ccc(S(=O)(=O)N2C[C@H](C)C[C@@H](C)C2)cc1	728259515	FRSDPLOBTGKYPZ-KFWWJZLASA-N	431.580	1.709	50	20	IDGD	
O=C(COC(=O)c1cccc(Nc2ncccn2)c1)NNC(=O)[C@@H]1COc2ccccc2O1	728324180	XZQXYVINNJRNCB-SFHVURJKSA-N	449.423	1.364	50	20	IDGD	
CCOC(=O)C1=NN(c2ccccc2)[C@@H](C(=O)NNC(=O)c2c(C)nc3ccccn23)C1	728712900	IFPOVCDCTYHKGS-QGZVFWFLSA-N	434.456	1.602	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(CCCCl)cc1)C1CCN(c2ncccn2)CC1	728854370	UDVBEXPMGHBUTF-UHFFFAOYSA-N	437.953	1.874	50	20	IDGD	
CC1(C)CN(C2(CNC(=O)NNC(=O)CNC(=O)c3ccco3)CCCCC2)CCO1	731284559	ADHDGYDIDUWGOR-UHFFFAOYSA-N	435.525	1.154	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)c1nnn(-c2cccc3c2CCN(C)C3)c1C	731461646	VLNOXGQFFXJUPQ-UHFFFAOYSA-N	434.500	1.576	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc(F)c(F)c1)NNC(=O)NCc1ccc(Cl)cc1	733003461	PUEPHBDFMHNPDN-UHFFFAOYSA-N	446.863	1.817	50	20	IDGD	
C[C@]1(NNC(=O)N[C@H]2CCN(c3cccc(OC(F)(F)F)c3)C2)CCS(=O)(=O)C1	734067328	JQFGFINCZZNMQE-LRDDRELGSA-N	436.456	1.545	50	20	IDGD	
CC(C)N1CC[C@@H](NC(=O)NNC(=O)[C@@H]2Cc3ccccc3CN2Cc2ccccc2)C1=O	734168671	ZXDWJFNVRHQPDF-YADHBBJMSA-N	449.555	1.953	50	20	IDGD	
CCOC(=O)N1[C@@H](C(=O)NNC(=O)CNC(=O)c2ccco2)CC[C@@H]1c1ccc(C)o1	736483296	ZBHMVQZKJZSGSC-ZIAGYGMSSA-N	432.433	1.420	50	20	IDGD	
CN1CCN(C(=O)c2ccc(CNC(=O)NNC(=O)COCc3ccccc3)cc2)CC1	738457665	VITDDDPNDYAXRZ-UHFFFAOYSA-N	439.516	1.121	50	20	IDGD	
COc1cccc(Oc2ncccc2CNC(=O)NNC(=O)CNC(=O)c2ccco2)c1	741278196	VGWBSXHPCIBEME-UHFFFAOYSA-N	439.428	1.736	50	20	IDGD	
CC(=NNC(=O)c1cc([N+](=O)[O-])ccc1O)c1ccc(OCC(=O)N2CCOCC2)cc1	741774239	YTTVDVPILDOPJO-UHFFFAOYSA-N	442.428	1.692	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)[C@H](C)NC(=O)c2cc3c(C)nn(C)c3s2)c1	742034514	OXDOSHIXOSNQQY-NSHDSACASA-N	445.501	1.540	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)c2cn(Cc3ccccn3)nn2)cc1	742469711	HXQNJVNHTTUBLH-UHFFFAOYSA-N	449.500	1.217	50	20	IDGD	
CCS(=O)(=O)NCc1ccc(C(=O)NNC(=S)Nc2ccc(OC)c(F)c2)cc1	743819911	DCINVOSNZDYYJE-UHFFFAOYSA-N	440.522	1.905	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)CCc2nc(-c3ccsc3)no2)cc1	743830318	RLKCGJRTOUPTLZ-UHFFFAOYSA-N	435.487	1.987	50	20	IDGD	
COc1cccc(OC)c1OC1CCN(CC(=O)NNC(=O)c2ccc(C#N)cc2)CC1	744387867	YOTWIEANUOXCBK-UHFFFAOYSA-N	438.484	1.880	50	20	IDGD	
C[C@H](CN1CCN(c2ccccc2)CC1)NC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	745838139	KIXPGZJAEYPKTR-MRXNPFEDSA-N	426.477	1.750	50	20	IDGD	
COCCOC[C@@H](C)NC(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1	745863259	CRIYPFKSRGMZMG-XMSQKQJNSA-N	440.544	1.995	50	20	IDGD	
Cc1noc(C)c1S(=O)(=O)NC1(C(=O)NNC(=O)Cc2ccccc2F)CCCC1	746239652	NWGMYASVWPIKKP-UHFFFAOYSA-N	438.481	1.412	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)Cn3c(S)nc4ccccc4c3=O)n[nH]2)cc1	746687609	SJNINPLLZRWRRW-UHFFFAOYSA-N	434.481	1.845	50	20	IDGD	
O=C(CN1CCOC[C@H]1C[C@H](O)c1ccccc1)NNC(=O)c1ccc([N+](=O)[O-])cc1	747661081	XWSXWGJILPNIKF-MOPGFXCFSA-N	428.445	1.180	50	20	IDGD	
O=C(NNc1ccc(Br)cc1F)[C@H]1CC(=O)N([C@H]2CCS(=O)(=O)C2)C1	748171496	RXWUZAJWTKSMCA-ONGXEEELSA-N	434.287	1.067	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)[C@]2(F)CCN(C(=O)OC(C)(C)C)C2)c2ccccc2c1=O	748286392	UNPIQXDBHNEGKU-FQEVSTJZSA-N	433.440	1.044	50	20	IDGD	
C[C@H](C(=O)NNc1nc(-c2ccccn2)nc2c1CCC2)N1C(=O)NC2(CCCC2)C1=O	748337226	BSJHEYMXBDYPTE-CYBMUJFWSA-N	435.488	1.724	50	20	IDGD	
O=C(NCCCN1CCN(c2ccncc2)CC1)NNC(=O)c1cccc2cccnc12	748463157	LERCJSARPNXFLE-UHFFFAOYSA-N	433.516	1.786	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)NC[C@H](c1cccc(Cl)c1)N1CCOCC1	748627816	LUTDRCYHITXIBL-WMLDXEAASA-N	428.917	1.095	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)C2(C(=O)NC3CC3)CC2)c2ccccc2c1=O	749403928	SMJLAKKGDAIRHT-UHFFFAOYSA-N	425.489	1.407	50	20	IDGD	
CCCCCn1nc(C(=O)NNS(=O)(=O)c2c[nH]c(C(=O)O)c2)c2ccccc2c1=O	750838735	YAWAAARPWVZMMD-UHFFFAOYSA-N	447.473	1.236	50	20	IDGD	
O=C(NN=C1C(=O)N(Cc2ncon2)c2ccc(Br)cc21)c1cccnc1	750911476	FCCKEXZPZWKHGH-UHFFFAOYSA-N	427.218	1.908	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)[C@@H]2CCCN(C(=O)[C@H](C)CC)C2)c2ccccc2c1=O	751052902	BLTZADCSOINDNH-HZPDHXFCSA-N	441.532	1.852	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@H](C)C(=O)NNC(=O)CCCN1C(=O)NC(C)(C)C1=O	751458056	KUFYEUAUFXQOLX-CYBMUJFWSA-N	438.912	1.982	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)[C@H]1CCC[C@@H](C(=O)NNC(=O)c2ncccc2C)C1	752241258	ALBVSKSRJRFBNN-IYBDPMFKSA-N	438.488	1.122	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)c2cc(S(=O)(=O)N(C)C)oc2C)cc1OC	753278864	BBHJCZMCULEQRN-UHFFFAOYSA-N	439.490	1.711	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)N[C@H]1CCN(c2ccccn2)C1	753733343	WQIQFISPTVLWOE-IBGZPJMESA-N	437.548	1.203	50	20	IDGD	
COC[C@H](C)CC(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2OC)c1	755036722	HUETYUKGRFSLAS-CQSZACIVSA-N	435.502	1.930	50	20	IDGD	
COc1cc(I)c(C(=O)NNC(=O)Cc2cc[nH]n2)cc1OC	755289687	RVEKQMVWDKGCGH-UHFFFAOYSA-N	430.202	1.035	50	20	IDGD	
CNC(=O)c1ccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1	755500741	PGULJMICSRAQNN-UHFFFAOYSA-N	445.501	1.297	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1ccc(NC(=O)c2ccco2)c(Cl)c1	756159600	CDBRMLOIBYVJOB-VIFPVBQESA-N	443.869	1.276	50	20	IDGD	
O=C(Cc1ccc(Cl)cc1)NNC(=O)Nc1cccc(N2CCS(=O)(=O)CC2)c1	756205491	IAZPLLDUULWISS-UHFFFAOYSA-N	436.921	1.970	50	20	IDGD	
CCOC(=O)[C@H](C)NC(=O)c1ccc(NC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1	756790211	NLYKBPRCMSMGMJ-LBPRGKRZSA-N	443.416	1.743	50	20	IDGD	
O=C(NNC(=O)c1cnccn1)Nc1ccc(S(=O)(=O)NCc2ccccc2)cc1	756865302	PXDJAMDNKRFKLM-UHFFFAOYSA-N	426.458	1.422	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NC[C@@H]2CCN(CC(C)C)C2)nc1	757304436	KFEDIGGCGKMAIT-INIZCTEOSA-N	426.587	1.716	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNS(=O)(=O)c2cncc(Cl)c2)cc1	757925504	JQIVPXJMOABDOT-UHFFFAOYSA-N	438.922	1.779	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)c2cccc(S(=O)(=O)N3C[C@@H](C)O[C@H](C)C3)c2)nc1	759737485	CBNTXSWRQWCPHV-ZIAGYGMSSA-N	448.501	1.423	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCc2nn(C)c3ccccc23)nc1	760175745	VDZLVJZSUHFPMR-UHFFFAOYSA-N	431.522	1.825	50	20	IDGD	
COc1nn(C)c2nc(C)c(CCC(=O)NNC(=O)CCNC(=O)OC(C)(C)C)c(C)c12	760432644	NWUIMNZFEIZENQ-UHFFFAOYSA-N	448.524	1.589	50	20	IDGD	
COc1cc(Br)cc(S(=O)(=O)NNC(=O)c2ccc3c(c2)OCO3)c1	760511553	YQMLUAJANHBKSJ-UHFFFAOYSA-N	429.248	1.810	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N2CC[C@@H](NC(=O)NC3CC3)C2)cc1Br	760679272	VCXHXIAZWCDGIY-GFCCVEGCSA-N	440.298	1.348	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COc2ccccc2F)nc1I	761135329	IGQFIRRYPNFLSS-UHFFFAOYSA-N	445.188	1.674	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)NCc1ccc(C(=O)Nc2ccc(F)cc2)cc1	761781998	ZZDQUSLAMVJPBO-CQSZACIVSA-N	432.452	1.960	50	20	IDGD	
Cn1nccc1CCNC(=O)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1	762572436	SLKJUBAHASCTKQ-QFIPXVFZSA-N	432.528	1.920	50	20	IDGD	
Cc1ccc(NC(=O)CS[C@H](C)C(=O)NNc2nccc(N3CCOCC3)n2)cc1	762860794	JKYOPCXOFJUADY-OAHLLOKOSA-N	430.534	1.825	50	20	IDGD	
Cc1nn([C@@H]2CCS(=O)(=O)C2)c(C)c1C=NNC(=O)CCCNC(=O)OC(C)(C)C	763376994	XIDXTRRNMSHUEN-OAHLLOKOSA-N	441.554	1.615	50	20	IDGD	
COCCn1ccc2ccc(NC(=O)C(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)cc21	763445428	HLTJURBPEUQBGJ-UHFFFAOYSA-N	425.401	1.596	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(NC(=O)[C@@H]2CCCO2)cc1	763466859	NPIFHUNLWCCILF-INIZCTEOSA-N	441.400	1.112	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1C(=O)NC(C)C	763470053	FKIFJLDVNZFTPB-UHFFFAOYSA-N	427.417	1.441	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(-n3cccn3)cc2)cc(OC)c1OC	763540546	WLZZWGOZKBFOGY-UHFFFAOYSA-N	439.428	1.298	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(F)cc2OC(F)F)cc1OC	763551250	NEXUUHSEVNRSSA-UHFFFAOYSA-N	427.335	1.844	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(-n3cncn3)c(F)c2)c2ccccc2n1	763615206	BUVKKULELLFZDK-UHFFFAOYSA-N	433.403	1.663	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccc(CN2CCOC2=O)c1	763712439	QXECMWTUCLTSPE-UHFFFAOYSA-N	440.456	1.366	50	20	IDGD	
C[C@@H]1Oc2ccc(NC(=O)C(=O)NNC(=O)C34CC5CC(CC(C5)C3)C4)cc2NC1=O	763728295	QXNDIRBSYOTXNW-VAWJCMALSA-N	426.473	1.708	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)NC(C)C)cc2)c1C	763841963	VOMUPEOVOGCTGS-MRXNPFEDSA-N	440.500	1.995	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccc(N2CCCC2=O)cc1	763872859	PMUIUCXTTXOLLI-ZDUSSCGKSA-N	428.420	1.506	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2cc(F)ccc2SCC(F)F)n1	763886886	ZLZWTAMMZWZHEL-UHFFFAOYSA-N	429.424	1.782	50	20	IDGD	
C[C@H]1CCC2=S=C(C(=O)NNC(=O)C(=O)Nc3ccc(-c4ncon4)cc3)C=C2C1	763941288	KEYZYBBXKKEYIN-NSHDSACASA-N	425.470	1.661	50	20	IDGD	
CS(=O)(=O)CCOc1cccc(NC(=O)NNC(=O)CSc2ccccc2O)c1	763946915	BDSLMCSLPRSQNW-UHFFFAOYSA-N	439.515	1.761	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)C(=O)CCC2	764005331	YMANEWAHCCJSBM-UHFFFAOYSA-N	433.262	1.706	50	20	IDGD	
CCOC(=O)c1cc(F)c(F)cc1NC(=O)C(=O)NNC(=O)c1ccc2c(c1)OCCO2	764005621	CQDFSABRPILDHV-UHFFFAOYSA-N	449.366	1.312	50	20	IDGD	
CCN1CCC(n2nccc2NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)CC1	764124496	IREONJDTOQVGLP-UHFFFAOYSA-N	434.884	1.299	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)[C@@H]1CC(c2cc(F)ccc2F)=NO1	765317205	LZOKJPWESKJRPB-HNNXBMFYSA-N	426.420	1.910	50	20	IDGD	
CCOC(=O)c1cnn2c(C(=O)NNC(=O)CSc3ccccc3OC)ccnc12	765383020	WAYAEVHARKSXFO-UHFFFAOYSA-N	429.458	1.468	50	20	IDGD	
COc1ccc(I)c(NC(=O)C(=O)NNC(=O)OC(C)(C)C)c1	765386030	IDTMLLSAUACJNM-UHFFFAOYSA-N	435.218	1.794	50	20	IDGD	
CSc1nc2nc(C)c(CC(=O)NNC(=O)c3cc(-c4cccs4)[nH]n3)c(C)n2n1	765570310	ZAQPEYCNCFFERK-UHFFFAOYSA-N	442.530	1.918	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cc(C)[nH]n2)cc1S(=O)(=O)N[C@@H]1CCCC[C@@H]1C	765588384	ZEVMOALNFRKSKT-SWLSCSKDSA-N	449.533	1.659	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1ccccc1C(=O)N1C[C@@H](C)C[C@H](C)C1	766264465	LBVOBOZBRVPSEM-KBPBESRZSA-N	426.477	1.685	50	20	IDGD	
CN(C)c1cc(C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)ccn1	766667771	DATRIMUWUPBPLF-UHFFFAOYSA-N	430.940	1.380	50	20	IDGD	
O=C(CC(F)(F)F)NNC(=O)NCCOc1ccc(S(=O)(=O)C(F)(F)F)cc1	766837538	LUAJCNDTCQJBEH-UHFFFAOYSA-N	437.318	1.642	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc(Cl)c(F)c(C(=O)O)c1)c1cc(Br)c[nH]1	767738148	PMCNJKVCJVFTBK-UHFFFAOYSA-N	440.634	1.891	50	20	IDGD	
O=S(=O)(/C=C/c1ccc(F)cc1)N1CCN(S(=O)(=O)CBr)CC1	767851574	RCZPNUXKPXOVPY-BJMVGYQFSA-N	427.317	1.426	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)C(=O)Nc1cnc(Cl)c(Br)c1	768233256	LXHOQUOLSAPUFG-UHFFFAOYSA-N	445.632	1.802	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)[C@@H](C)NC(=O)c2n[nH]c3ccccc23)n[nH]1	768281798	PTAKNYYGCBXBCI-GFCCVEGCSA-N	447.455	1.541	50	20	IDGD	
CSCCNC(=S)NNC(=O)C1CCN(c2oc(-c3ccco3)nc2C#N)CC1	770248265	UYZORSOBUAIYRL-UHFFFAOYSA-N	434.547	1.881	50	20	IDGD	
CNS(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)nc1	770760860	TYHMQFWPVXCHAS-JTQLQIEISA-N	427.870	1.263	50	20	IDGD	
CCN1CCN(c2cccc(NC(=O)C(=O)NNC(=O)c3c[nH]c4ccccc34)c2)CC1	770775260	ZEGALQZYNQDGOG-UHFFFAOYSA-N	434.500	1.710	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(C)c(C(=O)O[C@@H](C)C(=O)NNC(=O)CC(C)C)c1	771934935	XNFIXDUAUXGRKU-HNNXBMFYSA-N	441.550	1.764	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)ccc1O)Nc1ccc(N2CCOCC2)cn1	772408322	SBMNNAJNXVMGKJ-UHFFFAOYSA-N	436.266	1.853	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)N[C@H]2CC(=O)N(C3CCCCC3)C2)cc1	772563784	LCHBVZGQYIILDU-AWEZNQCLSA-N	437.522	1.359	50	20	IDGD	
O=C(NNc1ncc(F)cn1)c1c[nH]c2ccc(I)cc2c1=O	772839482	XQDZBZMDIWMNPL-UHFFFAOYSA-N	425.161	1.819	50	20	IDGD	
C=CC(=O)NCc1ccc(C(=O)NNC(=O)[C@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1	773410603	DRYGRAIIAOAUBE-KRWDZBQOSA-N	430.505	1.897	50	20	IDGD	
Cc1ccc(I)cc1NC(=O)C(=O)NNC(=O)Cc1ccccn1	773496469	MPXQEICNLXKBOT-UHFFFAOYSA-N	438.225	1.323	50	20	IDGD	
Cc1nnnn1-c1cc(NC(=O)C(=O)NNc2ncc(Cl)cc2Cl)ccc1F	773680589	URVOPVBQFDDTGL-UHFFFAOYSA-N	425.211	1.893	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2cc(I)ccc2Cl)n1	773726622	OHOACIYAQGFXBD-UHFFFAOYSA-N	447.620	1.825	50	20	IDGD	
O=C(NNc1ncc(Cl)cc1Cl)c1ccc2c(c1)S(=O)(=O)N=C1N=CNN12	775275564	GCXTYJPVNZXQKT-UHFFFAOYSA-N	426.245	1.557	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2ccc(-c3csc(N)n3)cc2)n1	775880013	UPCNCLVIEOVQKT-UHFFFAOYSA-N	431.499	1.704	50	20	IDGD	
CN(NC(=O)CN1C(=O)/C(=C/c2ccc(Br)cc2)SC1=S)C(N)=O	778415527	JLEGECWIYULDGK-POHAHGRESA-N	429.321	1.692	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)c2ccc(F)c(S(=O)(=O)NC(C)C)c2)nc1C	778425495	AJNFTPDRPRCGEI-UHFFFAOYSA-N	439.469	1.544	50	20	IDGD	
COc1ccc(-n2ccnc2SCC(=O)NNC(=O)CNC(=O)OC(C)(C)C)cc1	778440299	DPWFRSAJNFKNQK-UHFFFAOYSA-N	435.506	1.645	50	20	IDGD	
Cn1cc([C@@H](CO)NC(=O)NNC(=O)[C@H]2Cc3ccccc3CN2Cc2ccccc2)cn1	778643076	YFGMKOPDNZFNNY-FGZHOGPDSA-N	448.527	1.411	50	20	IDGD	
CC(C)S(=O)(=O)c1ccc(CC(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)cc1	781310211	WBZLCMLPQRHRQN-UHFFFAOYSA-N	443.481	1.287	50	20	IDGD	
COc1ccccc1[C@](N)(C(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)C(F)(F)F	782163241	ZCPYBMSJRJZCRF-IBGZPJMESA-N	449.389	1.120	50	20	IDGD	
CC(C)COc1ccccc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)NC(C)C)cn1	783264379	OJIMALRGOSTBFO-UHFFFAOYSA-N	449.533	1.885	50	20	IDGD	
CC(C)Oc1cc(Br)cc(NC(=O)C(=O)NN[C@@]2(C)CCS(=O)(=O)C2)c1	783426265	GTYWVKZRHZLARQ-INIZCTEOSA-N	448.339	1.373	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)C(=O)Nc1ccc(Br)c(F)c1	785067843	PYMLEURYDNUTAV-UHFFFAOYSA-N	434.225	1.565	50	20	IDGD	
Cn1ccnc(NNC(=O)C(=O)Nc2ccc(Br)c(Cl)c2Cl)c1=O	785085702	CXCYFVOFDPZJHL-UHFFFAOYSA-N	435.065	1.931	50	20	IDGD	
CCCOC(=O)c1ccc(NC(=O)C(=O)NNc2c(OC)cccc2S(C)(=O)=O)cc1	785330082	DBSZCBHDULMDSE-UHFFFAOYSA-N	449.485	1.747	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1ccc(OC(C)C)c(C#N)c1	785330814	MZPPQMMACVLWHX-UHFFFAOYSA-N	446.485	1.839	50	20	IDGD	
Cc1ccc(N2CCNC2=O)cc1NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1	786297779	QRBCERPXQFEGQF-UHFFFAOYSA-N	438.492	1.384	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ccc(C)cc2)cc1S(=O)(=O)N1CCCC1	787557264	WYOIWBQPTBOEDD-UHFFFAOYSA-N	432.502	1.870	50	20	IDGD	
CCc1cc(NNC(=O)CCC(=O)Nc2ccc3nc(O)[nH]c3n2)nc(-c2ccccn2)n1	787884354	HJCCAHZTLFJMEK-UHFFFAOYSA-N	447.459	1.940	50	20	IDGD	
COc1nc(Br)ccc1NC(=O)C(=O)NNC(=O)CCCc1ccccc1	789584566	NSVBNLRBXLMSKQ-UHFFFAOYSA-N	435.278	1.962	50	20	IDGD	
Cn1nc(-c2ccc(F)cc2F)cc1NC(=O)C(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	789730616	UQJVCNWYFYSZBI-UHFFFAOYSA-N	444.354	1.673	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC[C@@H]2C)cc1	790063128	FBSAYOJKEZFKGO-HNNXBMFYSA-N	441.550	1.800	50	20	IDGD	
CCCC[C@H](/N=C1/NS(=O)(=O)c2ccccc21)C(=O)NNc1nc2ccccn2n1	791239373	GADHIIDTIKTFJG-AWEZNQCLSA-N	427.490	1.470	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)[C@](C)(O)Cn2cc(C(F)(F)F)ccc2=O)nc1C	792302273	WMJNNJNPDLVMJC-QGZVFWFLSA-N	443.382	1.037	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)Cc2ccc([S@@](C)=O)cc2)c2ccccc2c1=O	797793582	YVPHWIOUQLQDPC-SSEXGKCCSA-N	426.498	1.548	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2ccccc2C)cc1OCC	798149399	CYHBIDFMGKPNBT-UHFFFAOYSA-N	435.502	1.532	50	20	IDGD	
CN(C)Cc1cc(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)ccc1Cl	799258610	HUGMUEHOQQCADQ-UHFFFAOYSA-N	442.701	1.892	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2ccc(C(=O)NNC(=O)Nc3ccccc3)cc2)C[C@@H](C)O1	801984629	FQGHWSJLSICMFX-GASCZTMLSA-N	432.502	1.951	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)C2CCN(C(=O)N(C)C)CC2)cc1Cl	802075080	IELYMXICSGJKHH-UHFFFAOYSA-N	427.889	1.904	50	20	IDGD	
COc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NNC(=O)Nc2ccc(N(C)C)cc2)cc1	802124399	MFLZJNPLQHOVMA-ZDUSSCGKSA-N	435.506	1.281	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)C[C@H]2COCCN2C(=O)OC(C)(C)C)cn1	803183687	YAGGQIRYQVYUBO-ZDUSSCGKSA-N	425.511	1.434	50	20	IDGD	
CN1CCN(CCCNC(=O)NNc2ccc(-n3ccnc3)nn2)[C@@H](c2ccccc2)C1	804952279	MEFOLNPXRSPVDE-LJQANCHMSA-N	435.536	1.667	50	20	IDGD	
O=C(OCc1ccccc1)N1CC[C@@](F)(C(=O)NNc2ccc(-n3ccnc3)nn2)C1	804954219	BXAOMOZREWVJAN-FQEVSTJZSA-N	425.424	1.856	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN(Cc2cccs2)[C@@H]2C=C[C@H](CO)C2)cc1OC	805769496	WUFUAJUXNPPLSK-DOTOQJQBSA-N	445.541	1.966	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)Nc1cc(N2CCCS2(=O)=O)ccc1F	806224538	LAHUTPWQUQPIMT-UHFFFAOYSA-N	432.441	1.490	50	20	IDGD	
C[C@H](C(=O)NNC(=O)C1CCN(c2ncccn2)CC1)C1CN(C(=O)OC(C)(C)C)C1	806792449	NNOVCWGLIISAAV-AWEZNQCLSA-N	432.525	1.343	50	20	IDGD	
COC(=O)c1cc(C)c(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)c(Cl)c1	806977378	GQCCFFCBGISWES-HNNXBMFYSA-N	431.832	1.525	50	20	IDGD	
Cc1cc(I)cc(NC(=O)C(=O)NNC(=O)Cc2cccnc2)c1	806979042	QKDSUENXRVFOCI-UHFFFAOYSA-N	438.225	1.323	50	20	IDGD	
CCN1C[C@H](CN(C)C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)Oc2ccccc21	807135121	KWOYDHLQFTXBLS-KRWDZBQOSA-N	436.476	1.236	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)CNS(=O)(=O)c2c(Cl)cccc2Cl)c1O	810191071	MFGMUBMCYHGNGA-UHFFFAOYSA-N	448.284	1.447	50	20	IDGD	
CCc1ccc([N+](=O)[O-])cc1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	810316212	SVSJYUNHLRJURW-UHFFFAOYSA-N	435.462	1.874	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)CNS(=O)(=O)c2ccccc2C(F)(F)F)n1	810560922	PYWULUWBZINDTJ-UHFFFAOYSA-N	446.455	1.763	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2ccnc(N3CCC[C@@H](C)C3)c2)n1	812652406	FCHJETGUUHTEKN-CYBMUJFWSA-N	431.518	1.630	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)[C@H]1COc2ccccc2O1)c1ccc(N2CCCNC2=O)cc1	812944292	LFIIWOADCUIKTF-IFXJQAMLSA-N	439.472	1.838	50	20	IDGD	
COC(=O)c1cn(-c2cccc(NC(=O)C(=O)NNc3nccnc3C3CCC3)c2)nn1	812996066	VQRHOKPYPHKOHL-UHFFFAOYSA-N	436.432	1.193	50	20	IDGD	
CC(=O)Nc1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)cc1C	813033560	ZGAMTUVOTUXYLH-UHFFFAOYSA-N	433.490	1.286	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)COc1ccccc1C#N)c1ccc(N2CCCNC2=O)cc1	813238105	BHDVKJVRVJZJOD-HNNXBMFYSA-N	436.472	1.948	50	20	IDGD	
Cc1ccc([C@@H](CN2CCOCC2)NC(=O)NNC(=O)COc2ccccc2C#N)cc1	813495258	TYJKDZLHMLSVAG-HXUWFJFHSA-N	437.500	1.649	50	20	IDGD	
N#Cc1cccc(Oc2ccc(NC(=O)C(=O)NNC(=O)[C@H]3CCc4nncn4C3)cc2)c1	815692364	PMBKNHIVAQPRDL-HNNXBMFYSA-N	445.439	1.291	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1ccccc1OCC1CC1	815751986	XEJYKHLVIKNXAI-UHFFFAOYSA-N	432.502	1.808	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)O[C@H](C)C(=O)N2CCN(C(C)=O)CC2)c1C	853510751	RTABYUFBFPSVPS-UOBPLZBXSA-N	430.505	1.281	50	20	IDGD	
O=C(COC(=O)CCS(=O)(=O)c1ccc(F)cc1)NNC(=O)c1cccc(Cl)c1	913219720	UYMNIJPHAXKNOK-UHFFFAOYSA-N	442.852	1.647	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)[C@@H]2CC(=O)N(c3ccc(Br)c(C)c3)C2)n1	913897858	CENWCLILUOLARL-CQSZACIVSA-N	448.321	1.771	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)c1cc(C2CC2)nc2c1c(O)nc(=O)n2C	914333699	OKMVAAUSEABZCF-SNVBAGLBSA-N	441.419	1.279	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)CCC(=O)CCC(=O)c2cccs2)c2ccccc2c1=O	915190514	ACCMOXOTKPXBKZ-UHFFFAOYSA-N	440.481	1.768	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)NCCN1CCN(Cc2ccccc2)CC1	915902690	ZYGRWLOXKFXOAK-SFHVURJKSA-N	443.523	1.741	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)NCc1ccccc1CN1CCOCC1	915927805	ZZUNVAJKLHAPFM-UHFFFAOYSA-N	442.516	1.827	50	20	IDGD	
COc1cc(C=NNC(=O)COc2cccc(C)c2)ccc1OCC(=O)N1CCOCC1	915931008	BOOMOMNEXWTCLF-UHFFFAOYSA-N	441.484	1.770	50	20	IDGD	
CCCCS(=O)(=O)N1CCC(C(=O)NNC(=O)Cc2nc3ccccc3n2C)CC1	916116487	CVGCRHSVANNSFD-UHFFFAOYSA-N	435.550	1.105	50	20	IDGD	
CCn1cnc2c1c(=O)n(CC(=O)NN=Cc1cccc(C)c1)c(=O)n2Cc1ccccc1	916331295	GLTLLTBYRHGZFG-UHFFFAOYSA-N	444.495	1.887	50	20	IDGD	
COCCn1cc(C(=O)NNC(=O)COc2ccccc2Cc2ccccc2)ccc1=O	917388243	OQEGGENYYZYPND-UHFFFAOYSA-N	435.480	1.926	50	20	IDGD	
CCn1c(NNC(=O)[C@H](Cc2ccc(F)cc2)n2nnnc2C)nc2ccccc2c1=O	918016105	DTIPLEHTSDFBKY-SFHVURJKSA-N	436.451	1.778	50	20	IDGD	
Cc1ccccc1OCCNC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	918127925	AZSVKPUNRXWMFC-UHFFFAOYSA-N	446.529	1.803	50	20	IDGD	
COCCn1cc(NC(=O)NNC(=O)[C@H](C)Oc2cccc(Br)c2)cn1	918542695	FQLOPJWYAAFNTP-NSHDSACASA-N	426.271	1.912	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)C3CCOCC3)CC2)cc1	920213219	VQWNDWPFPSBGIG-UHFFFAOYSA-N	439.534	1.060	50	20	IDGD	
C[C@@H]1CN(Cc2csc(NC(=O)NNC(=O)COc3ccc(C#N)cc3)n2)C[C@@H](C)O1	920930545	OHCBGYDXPBWRDK-ZIAGYGMSSA-N	444.517	1.856	50	20	IDGD	
CC(C)(O)C(=O)NNC(=O)c1ccc(Cl)c(S(=O)(=O)Nc2ccc(F)cc2)c1	1320806878	ATKCRMWFPSRXTB-UHFFFAOYSA-N	429.857	1.812	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnc4cc(C)ccn4c3=O)C2)C1	1777993841	CGLNWGADHWQVOT-VGSWGCGISA-N	446.935	1.854	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2)[C@@H](F)Cl	1778028175	SGNHPBXCQSWVOY-HNJKLQPHSA-N	442.871	1.865	50	20	IDGD	
COc1ccc2c(/C=C/C(=O)N3CC[C@]4(C3)CN(C(=O)[C@@H](O)CCl)CCO4)c[nH]c2c1	1778118864	YOUUYMWSEVFIGV-VIWWTTNSSA-N	447.919	1.619	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc4n(n3)CCCC4)C2)C1	1778565358	XKCIPZZCYQVTBD-BEFAXECRSA-N	439.354	1.836	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4cncn4c3)C2)C1	1778690917	PXIBZUDIPXELSZ-KUHUBIRLSA-N	435.322	1.809	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)C#CC3(O)CCCCC3)C2)C1	1779067686	XGSCGERIIPPEAC-DNVCBOLYSA-N	427.339	1.298	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccnc4c3OCO4)C2)C1	1780029226	WHGQTPRIEHWDND-ROUUACIJSA-N	430.288	1.490	50	20	IDGD	
N#Cc1c[nH]c(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](F)Br)C3)c1	1780180952	LUWJOHKLLGKNLZ-JKIFEVAISA-N	427.274	1.704	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc3c1NC(=O)C3=O)C2	1780704999	ZQUKLQBMQCUSTE-WJONJSRFSA-N	447.919	1.966	50	20	IDGD	
NC[C@H](C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1)c1ccccc1	1781331353	PAOHLWQATCLCLM-DAYGRLMNSA-N	428.302	1.249	50	20	IDGD	
COc1ccc(F)cc1C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781335633	XYCJOHWZLCSXNU-WMLDXEAASA-N	433.249	1.968	50	20	IDGD	
C=CC[C@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnccc1C(=O)NN)C2	1781742650	XCAVNKZKFIEVJG-QXATTWAWSA-N	429.521	1.025	50	20	IDGD	
Cc1ccc(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CCC(=O)NN(C)C)C2)o1	1782214796	ZWOGIDOZJBYMOV-XMSQKQJNSA-N	434.537	1.017	50	20	IDGD	
Cc1ccn2c(C(=O)N3CC[C@]4(C3)CN(C(=O)[C@@H](F)Br)CCO4)cnc2c1	1782487465	FONJJHQNBOJLSB-QAPCUYQASA-N	439.285	1.777	50	20	IDGD	
O=C(Cc1ccc(O)cn1)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCBr)C2	1782629800	YDLAJMKJAOTHJY-VQIMIIECSA-N	440.338	1.629	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)CCc3ccc(O)nn3)CCO2)C1	1783355832	YDYMTQYQLBDOSS-KSSFIOAISA-N	441.326	1.118	50	20	IDGD	
CCc1nn(C)c(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](C)Br)C3)C2)c1Cl	1783532992	VTQJCDGUFWVPGE-PIGZYNQJSA-N	447.761	1.863	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](C)Br)C3)C2)cc1	1783536907	HXWJTZXPSXQNQW-ORAYPTAESA-N	438.322	1.872	50	20	IDGD	
CCOc1ncc(Cl)cc1C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](Cl)COC)C2)C1	1783877648	MNMSQYMUTIDIME-KXBFYZLASA-N	446.331	1.831	50	20	IDGD	
C[C@@](O)(C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CO[Si](C)(C)C)C[C@@H]21)C(F)(F)F	1784875044	XQUCOJRPFYCCQW-WFGGJUAMSA-N	426.508	1.131	50	20	IDGD	
C[C@@H](Cn1cccn1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21	1785442568	UEEMVVAHKSYKKM-YYFQZIEXSA-N	431.306	1.189	50	20	IDGD	
COc1ccnc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]32)c1	1788892030	CWBTWYGDYIRBLX-HAHWVIBASA-N	430.332	1.920	50	20	IDGD	
CN(C)c1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Br)C[C@@H]32)cn1	1789027417	SEOJNLNWWFPMLA-YXWQFLTLSA-N	443.317	1.431	50	20	IDGD	
Cc1ccc(O)c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Br)C[C@@H]32)c1	1789493133	SOPLTSIWGFPUOG-MZGVZZPPSA-N	429.286	1.984	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cn4cccnc4n3)C[C@@H]21	1789867854	HDBUYLSLPZUWNG-VODUFIJXSA-N	440.331	1.559	50	20	IDGD	
Cc1noc(C)c1CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]2C1	1789922111	HQPDHUYBWSDPLR-NZUILWFCSA-N	446.317	1.894	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(Cl)cnc1OC	1792402811	IXLHUWCRYVXWPO-BAESOJJISA-N	432.304	1.201	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)n1cccc1C=O)C2	1792868473	YLLKWWLMKLOSSQ-SVZOTFJBSA-N	440.338	1.482	50	20	IDGD	
CN1CCc2cc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)CCBr)ccc21	1795114576	ZDDDEPHFMUEEQG-HGKCTWBKSA-N	436.350	1.667	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCc1cncnc1	1795807544	RATXTPIZCYMXMB-IVSAIRAKSA-N	425.327	1.172	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2)C1CC1	1796360150	HAVANOWVDWJYSU-AIEDFZFUSA-N	433.908	1.414	50	20	IDGD	
COC(=O)C[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](F)Cl	1796809968	BPPCOEYJFMYWRI-OKWIKPQFSA-N	449.907	1.615	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(C)nc1OC	1798248631	QZDLJLFIPHTNOB-XRGAULLZSA-N	440.338	1.775	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCc1cc(F)ccn1)C2	1798440790	SEKIDJSZNFQUHJ-BJWYYQGGSA-N	440.479	1.104	50	20	IDGD	
Cc1n[nH]cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)C2	1798660698	BXKHWBUQPNXLPB-QYFXKUKHSA-N	441.438	1.807	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Br)C1	1799352275	NSWJVJIYWDSAEM-DEPYFDJDSA-N	449.317	1.246	50	20	IDGD	
CC(=O)Nc1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)ccc1C	1800640692	PZAWNBNDTWTFMF-WKCHPHFGSA-N	449.316	1.199	50	20	IDGD	
Cc1ccc(C)c(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)c1	1801757944	NQBOOUZHWBLZMD-REPLKXPHSA-N	435.528	1.796	50	20	IDGD	
CC[C@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnncc1C(=O)O)C2	1801804492	VRVIZUXGARDOEA-MIJXAVMKSA-N	425.283	1.600	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cc1c[nH]c3ccccc13)C2	1802337253	TWWUYJKLGKHOMP-BCDXTJNWSA-N	425.533	1.722	50	20	IDGD	
COc1cc(C)c(C)cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCC(=O)NN(C)C	1802337822	AUNMTOJGKBSBLM-BCDXTJNWSA-N	430.549	1.937	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2nc(O)n3c2CCCC3)[C@H]1c1cccnc1)[C@@H](O)CCl	1803143039	RLNBMZGWAXIMOO-ZVZYQTTQSA-N	447.923	1.239	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@H](CNC(=O)[C@@H]2CNC(=O)O2)[C@H]1c1cccnc1	1803647958	JDKBDAMBEVEONT-FLTUCWPJSA-N	429.304	1.432	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CCC2(CCCN(C(=O)[C@@H](O)CCl)C2)CC1	1805528694	XJSIXAWPRNQIDP-BBWFWOEESA-N	426.941	1.573	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1CCN(C(=O)CN2CCOC2=O)[C@@H]1c1cccnc1	1808290947	ZRUWTXANKDBFFQ-GMBSWORKSA-N	443.331	1.776	50	20	IDGD	
CSCC[C@H](O)C(=O)N1CC[C@H](CNC(=O)[C@H](F)Br)[C@@H]1c1cccnc1	1808678999	SMZKUCDKDNEVNF-QPSCCSFWSA-N	448.358	1.892	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)c1ccc2ncnn2c1	1810052579	QYJJLIDEYZYSCQ-QILLFSRXSA-N	428.880	1.044	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1CCN(C(=O)CN2CCOCC2)[C@@H]1c1cccnc1	1810540249	INEKGVPTVQMNCA-GHTZIAJQSA-N	434.613	1.271	50	20	IDGD	
COc1cc(C(=O)N2CC[C@H](CNC(=O)CO[Si](C)(C)C)[C@H]2c2cccnc2)nn1C	1810543706	DUXYDFZINYVBRD-OXQOHEQNSA-N	445.596	1.995	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)C(OC)OC)[C@H]1c1cccnc1	1812773524	GEFXNPRTSKAAKG-KKUMJFAQSA-N	428.327	1.880	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)CC(F)(F)F)[C@@H]1c1cccnc1	1813071866	VSUSWHCTVNSPPR-KBXCAEBGSA-N	429.443	1.413	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)CCN3CCN(C)CC3)sc2C1	1814583730	VTLJFUPPIHCWBO-KBPBESRZSA-N	428.002	1.710	50	20	IDGD	
CC(C)(CCl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(=O)n3[nH]cnc3n2)[nH]n1	1814693838	FBTNMNHNVKTFFC-CYBMUJFWSA-N	446.899	1.712	50	20	IDGD	
Cc1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCC(=O)NN(C)C)CC2	1817774693	GEBICZPBGAQPQB-ZDUSSCGKSA-N	430.534	1.445	50	20	IDGD	
CC(=O)OC[C@H](OC(C)=O)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](F)Cl)n[nH]1	1818039997	NSICFMWGTKGJSI-KCQAQPDRSA-N	432.836	1.431	50	20	IDGD	
Nc1n[nH]c(CCC(=O)Nc2cc([C@H]3CCCCN3C(=O)[C@H](F)Br)[nH]n2)n1	1819286198	NIYOKYYEWVAZGJ-RNCFNFMXSA-N	443.281	1.425	50	20	IDGD	
C[C@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](F)Br)[nH]n1)n1ccnn1	1821724454	DWKALMQVFKLCNZ-SUZMYJTESA-N	428.266	1.945	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CNC(=O)N(C)C)[nH]n1	1822084382	KRMMTEOGOKZUDI-WCQYABFASA-N	443.346	1.847	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)C(C)(C)CNC(C)=O)[nH]n1	1822372139	ZJZJJVIDVIXILP-UKRRQHHQSA-N	427.933	1.818	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H]2CC[C@H](O)CC2)n[nH]1	1822545961	QKRRVOIZWXBBIN-ZOBUZTSGSA-N	434.541	1.326	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)C2=COCC2)n[nH]1	1822985735	FLTVSFQHXSJNRY-MRXNPFEDSA-N	425.449	1.018	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H]3CCC(=O)N3C)sc2C1	1823054511	KGQKTMAFXZXENG-FOGDFJRCSA-N	443.367	1.849	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccccc2O)CC1	1825667766	LFVCJYQVZUJSRC-IBGZPJMESA-N	430.549	1.999	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)/C=N/N1CCCCC1)CC2	1826000085	KLNZJVJRRLHHMQ-RLXLQZHTSA-N	427.958	1.781	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc3n(n1)CCCO3)CC2	1826000393	SMKBXQUODFWKFV-GHMZBOCLSA-N	439.925	1.602	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnn3ccncc13)CC2	1826000637	ZFQKKUFOOFVQPE-JQWIXIFHSA-N	434.909	1.665	50	20	IDGD	
Cc1onc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)c1C	1827050376	PVSWVIJYLNCMAZ-FQEVSTJZSA-N	439.321	1.518	50	20	IDGD	
CCc1cc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)no1	1829380595	BUOQWFKTMAUTBE-IBGZPJMESA-N	433.553	1.843	50	20	IDGD	
C[C@H](Cn1ccnc1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830370802	YPAYXTQSJFAVKR-UZLBHIALSA-N	426.945	1.241	50	20	IDGD	
Cc1ncc(C(=O)NC2CCN(C3CCN(C(=O)[C@H](C)CBr)CC3)CC2)[nH]1	1833578009	QGCPDZXJMSUFJT-CYBMUJFWSA-N	440.386	1.934	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnccc3N(C)C)CCO2)C1	1833660410	ZDNBZXCFFVZFRK-DYESRHJHSA-N	438.956	1.625	50	20	IDGD	
O=C(CCNC(=O)c1ccc[nH]1)NC1CCN(C2CCN(C(=O)[C@H](F)Cl)CC2)CC1	1833799487	OSWBPJYUAWTILA-SFHVURJKSA-N	441.935	1.241	50	20	IDGD	
COCCOCC(=O)NC1CCN(C2CCN(C(=O)[C@](C)(Cl)CCl)CC2)CC1	1834566874	AHUWUIFBXQYXKA-LJQANCHMSA-N	438.396	1.457	50	20	IDGD	
Cc1ncc(CC(=O)N2CCOC[C@]3(CN(C(=O)CCBr)CCO3)C2)s1	1834826811	XAGGCZVIBJNKGS-KRWDZBQOSA-N	446.367	1.235	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(C=O)s3)CCO2)C1	1835946752	UAWUMSQSOBLGME-MSOLQXFVSA-N	449.356	1.867	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC(OC2CCN(C(=O)[C@H]3CNC(=O)C3)CC2)CC1	1836673598	HXICQZVTKVAIPQ-ZIAGYGMSSA-N	444.370	1.152	50	20	IDGD	
COC(=O)CCCCCC(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836720157	LBGOXIAAMFXXDV-GOSISDBHSA-N	446.972	1.708	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)[C@H](C)CC(N)=O)CC2)CC1	1836911936	FFKNIICMSPOJCX-CZUORRHYSA-N	446.386	1.670	50	20	IDGD	
O=C(c1n[nH]c2cc(Cl)ccc12)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1837085289	LNVLIMXNBQFAKA-CRAIPNDOSA-N	445.278	1.821	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cn(C)nc3OC)CC2)CC1	1837377775	CMVMVWGWWZJSNM-KRWDZBQOSA-N	442.944	1.295	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(O)ccc3O)C2)C1	1837716021	XTGHCURRDPBDTM-FQEVSTJZSA-N	438.553	1.019	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc(C(C)(C)C)cn3)C2)C1	1839144507	CDNUSIPHHANCIX-YCRPNKLZSA-N	438.956	1.862	50	20	IDGD	
Cc1nc(F)ccc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2	1839153782	SGXIVCDMMQJETP-MOPGFXCFSA-N	448.322	1.835	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)cnc1C	1839197930	MZGMUVODYLNQKQ-QAPCUYQASA-N	444.301	1.459	50	20	IDGD	
O=C(C[C@@H]1C[C@@H]2CC[C@H]1C2)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839202973	VHMOIBQXLYGDFT-OKVDMCGNSA-N	447.345	1.960	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(OC)cc3F)CCO2)C1	1839293050	NVSHGOKOAAXSEE-OXQOHEQNSA-N	444.887	1.158	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3n[nH]c(C)c3F)C2)C1	1839962700	OLUGGJZZZUZDMA-YVEFUNNKSA-N	447.305	1.101	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4sccn4c3)C2)C1	1840151970	SLKDFRYAFTZYOK-KXBFYZLASA-N	441.937	1.325	50	20	IDGD	
O=C(c1ccc2ncncc2c1)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840188277	AFWHPQHMSNPNRB-IBGZPJMESA-N	439.299	1.504	50	20	IDGD	
Cc1ccc(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)c(C)n1	1840337576	CFEKJJHTUCNCKL-ICSRJNTNSA-N	427.904	1.622	50	20	IDGD	
C[C@]1(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)CC=CCC1	1840557190	SBBKMJODTNLZBU-WBAXXEDZSA-N	433.318	1.880	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(F)cc3C)CCO2)C1	1840778467	BRVYBRVMXJOGPU-XLIONFOSSA-N	428.888	1.458	50	20	IDGD	
CC[C@H](C)[C@H](O)C(=O)N1CCCC12CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1841630076	NTPQVGPWKFRJFM-KKUMJFAQSA-N	431.961	1.729	50	20	IDGD	
Cn1cncc1C(=O)N1CC2(CCCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C1	1841924249	OOUMKFWLFCFMPE-ZDUSSCGKSA-N	425.917	1.369	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC2(CCCN2C(=O)c2nc3ccccc3n(C)c2=O)C1	1843742928	SMNOGOKDQPYIAX-CYBMUJFWSA-N	447.333	1.782	50	20	IDGD	
COc1ccc2oc(C(=O)N3CC4(CCCN4C(=O)c4cnccc4C(=O)NN)C3)cc2c1	1844264428	RQOMFHIMYJHAFI-UHFFFAOYSA-N	449.467	1.571	50	20	IDGD	
C[C@H](Br)C(=O)N1CC2(CCCN2C(=O)C[C@H](O)CNC(=O)OC(C)(C)C)C1	1845231534	SXVAEAACEHQRIF-STQMWFEESA-N	448.358	1.249	50	20	IDGD	
COc1cc(Cl)cc(C(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)c1	1846854857	QRVAZBCSGCKHEH-UHFFFAOYSA-N	428.681	1.159	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H]1C=C[C@@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](O)CCl)C1	1847556174	DOCXXQQVKRXEPM-OLMNGRFOSA-N	427.929	1.257	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H]2C[C@@]2(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](O)CCl)C1	1847563925	RZCXKEXCBGYBKD-BINAMKIQSA-N	427.929	1.045	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)NCCc3ccc(S(N)(=O)=O)cc3)cc2C1	9794344	JRIFAFWAAMEERP-GFCCVEGCSA-N	436.559	1.707	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCOCC3)cc2)cc1C	15886736	GHOKADQZECUQAT-UHFFFAOYSA-N	447.513	1.164	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)CCN2C(=O)[C@H](C)Oc3ccccc32)cc1	16192189	YKRHDPBPKVDFFH-HNNXBMFYSA-N	425.441	1.503	50	20	IDGD	
CC(C)(C)c1ccc(C(=O)NCCC(=O)NNC(=O)c2n[nH]c(=O)c3ccccc23)cc1	17194052	ZBQNHJZSWGEQFI-UHFFFAOYSA-N	435.484	1.802	50	20	IDGD	
Cc1ccc([C@@H](CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)N2CCCC2)o1	725871215	DONXBNONOUMKGR-MRXNPFEDSA-N	448.549	1.662	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N[C@H](CCSC)C(=O)NNC(=O)c2ccc[nH]2)cc1	726630131	IIXMTSRAJKLMRU-MRXNPFEDSA-N	440.547	1.275	50	20	IDGD	
CN1C(=C(C#N)C(=O)COC(=O)CNC(=O)c2ccc(C#N)cc2)N(C)c2ccccc21	727010987	USVAHLVFMDVERJ-UHFFFAOYSA-N	429.436	1.722	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)NCCCCCC(=O)N2CCN(C(=O)CC(C)C)CC2)n1	727481041	OAHWJCWFPJMHJO-UHFFFAOYSA-N	447.584	1.997	50	20	IDGD	
C[C@@H]1CC(C)(C)C[C@@]2(C1)NC(=O)N(CC(=O)NNc1nc(-c3cccnc3)no1)C2=O	728078899	AHXSFXDCAVIQDT-MPBGBICISA-N	427.465	1.712	50	20	IDGD	
Cc1nn(Cc2ccccc2Cl)c(Cl)c1C=NNC(=O)[C@@H](C)NS(C)(=O)=O	728437199	NCYZUTIISLMRTL-LLVKDONJSA-N	432.333	1.934	50	20	IDGD	
O=C(CN1C(=O)[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)NNC(=O)c1cc(F)ccc1Br	728549693	NUYRPLJLMSIYEP-PVFTVIPPSA-N	436.237	1.156	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(Cl)c(C(=O)NN=c2cc[nH]c3ccccc23)c1	730288034	ZVAJOPIGQWQNGK-UHFFFAOYSA-N	434.905	1.992	50	20	IDGD	
CCOc1cc2c(cc1[C@@H]1C[C@H]1C(=O)NNC(=O)CNC(=O)c1ccco1)O[C@@H](C)C2	730490081	WWDUXJAYYZWGRZ-DUVNUKRYSA-N	427.457	1.683	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)N1CCN([C@@H](C)C(=O)Nc2cccc(F)c2)CC1	731500471	HFCQLEWKVQZIRB-HNNXBMFYSA-N	443.479	1.834	50	20	IDGD	
Cc1ccc(C2(C(=O)NNC(=O)c3csc(N4CCOCC4)n3)CCOCC2)cc1	732053919	LDIQCWDUZJWWAR-UHFFFAOYSA-N	430.530	1.798	50	20	IDGD	
CCc1c(C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cnn1-c1ccccn1	732326063	VNVCSVKJRQHXRW-UHFFFAOYSA-N	438.400	1.356	50	20	IDGD	
O=C(COC(=O)c1ccn(-c2cccc(F)c2)n1)NNC(=O)c1cccc([N+](=O)[O-])c1	732332735	PQMNIKSTWNKJKD-UHFFFAOYSA-N	427.348	1.538	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)N[C@H](Cc2ccccc2)CN2CCOCC2)cc1	732476469	KYAGZFLPEIXUPP-LJQANCHMSA-N	442.516	1.348	50	20	IDGD	
Cc1nc2ccccc2cc1C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	735117360	SKAWGJNKFHAUKA-UHFFFAOYSA-N	440.529	1.631	50	20	IDGD	
CN(C)C(=O)CCNC(=O)NNc1ccc(S(=O)(=O)NC2CCCCCCC2)cn1	735578979	DNZXPDVURJMYIM-UHFFFAOYSA-N	440.570	1.577	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)N[C@H](C)CN2CCN(c3ccccn3)CC2)cc1C	735587109	RSNXIVSXLFHRHJ-LJQANCHMSA-N	440.548	1.618	50	20	IDGD	
O=C(CN(Cc1cccnc1)c1ccccc1)NNC(=O)c1ccc(-n2cnnn2)cc1	735647555	RYJFRIUZHRPZIO-UHFFFAOYSA-N	428.456	1.525	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)CNC(=O)c2cc(C)cc(C)c2)cc1C	736744125	VQGJDOIMDCJSAL-UHFFFAOYSA-N	431.514	1.970	50	20	IDGD	
COC(=O)Nc1ccc(CCNC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])cc1	739034108	JUWZCKKYQLUWNU-UHFFFAOYSA-N	431.405	1.725	50	20	IDGD	
O=C(NCCc1cccs1)NNC(=O)[C@@H]1CCCN(C(=O)COc2ccccc2)C1	741212563	QVZBPVPMRCYAHU-MRXNPFEDSA-N	430.530	1.939	50	20	IDGD	
O=C(CS[C@H]1CCS(=O)(=O)C1)NNC(=O)NCc1cccc(C(F)(F)F)c1	742459737	WKJPLWBOHXQELO-LBPRGKRZSA-N	425.454	1.456	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)[C@@H](CNC(=O)OC(C)(C)C)c2ccccc2)C[C@@H](C)O1	743292312	XLFMPJZIONGDMJ-SCTDSRPQSA-N	448.564	1.942	50	20	IDGD	
O=C(NCCNS(=O)(=O)Cc1ccccc1)NNC(=O)c1cccc2ccccc12	743629029	WPYNBYUFWIAGHZ-UHFFFAOYSA-N	426.498	1.903	50	20	IDGD	
CS(=O)(=O)c1ccc(OCCCC(=O)NNC(=O)c2nnc(O)c3ccccc23)cc1	743737973	NBRMBIVHZYYDFY-UHFFFAOYSA-N	444.469	1.359	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)n1nnc(-c2ccccc2)n1	743829878	GECWHGHPIAJKEX-LBPRGKRZSA-N	429.462	1.158	50	20	IDGD	
Cc1cc(C)c(C)c(S(=O)(=O)N2CCN(CC(=O)NNC(=O)C(C)(C)C)CC2)c1C	744385606	YUPFWSWGGKXJDL-UHFFFAOYSA-N	438.594	1.420	50	20	IDGD	
CN(C)c1ncc(Br)cc1C(=O)OCC(=O)NNC(=O)c1cccc(C#N)c1	745025741	JKRVLADNXCJXEF-UHFFFAOYSA-N	446.261	1.400	50	20	IDGD	
C[C@H](CCc1ccc2c(c1)OCO2)NC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	746232478	QCLBQZILFJECDN-CYBMUJFWSA-N	433.486	1.784	50	20	IDGD	
CC(C)c1nc(C#N)c(NNC(=O)c2cccc(S(=O)(=O)NC[C@@H]3CCCO3)c2)o1	746339112	HPTKKKUXWJKMGN-AWEZNQCLSA-N	433.490	1.884	50	20	IDGD	
COc1cc(C)nc(NNC(=O)NC2CCN(C(=O)c3ccc(OC)c(OC)c3)CC2)n1	746769714	PBOPAWXDXNOFQF-UHFFFAOYSA-N	444.492	1.742	50	20	IDGD	
CNS(=O)(=O)c1cccc(S(=O)(=O)NNC(=O)c2ccc(Cl)cc2Cl)c1	747407009	NDCJCQRVKBYXMT-UHFFFAOYSA-N	438.314	1.525	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NN=C1C(=O)Nc2c(I)cccc21	747638661	PBXWFRCZDYHVOM-UHFFFAOYSA-N	445.220	1.954	50	20	IDGD	
Cc1cc(=O)c(C(=O)NNc2ccc(S(C)(=O)=O)cc2)nn1-c1ccccc1[N+](=O)[O-]	748128609	FRDGWYGAAGOMGR-UHFFFAOYSA-N	443.441	1.610	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)/C=C/c3ccc([N+](=O)[O-])cc3)cc2)CC1	748623037	HRSQBMPWLCBIFR-NYYWCZLTSA-N	445.501	1.687	50	20	IDGD	
COc1ccc([C@@H](C)CC(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1	750539231	NBSRZFPJITWSIQ-IFXJQAMLSA-N	428.441	1.719	50	20	IDGD	
COc1ccc(C(=O)CCC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1F	751297599	MSOUVYXPOJVITH-UHFFFAOYSA-N	426.404	1.505	50	20	IDGD	
C[C@@H](NC(=S)NNC(=O)CNC(=O)c1ccccc1I)C1CC1	751619245	LTXWZMKJQTUVLJ-SECBINFHSA-N	446.314	1.315	50	20	IDGD	
C[C@@H]1C[C@H](CNC(=O)OC(C)(C)C)CN1CC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	752085234	NGTSHYBXTYENNS-ZIAGYGMSSA-N	435.481	1.591	50	20	IDGD	
CC(=O)c1cccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)c3ccc(C)o3)CC2)c1	752524959	TWXPQHGQJICNST-UHFFFAOYSA-N	433.486	1.653	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@H](C)c2ccc(S(C)(=O)=O)cc2)cc(OC)c1OC	753182199	ZTFWCGSNUBNARK-GFCCVEGCSA-N	436.486	1.681	50	20	IDGD	
C[C@H]1C[C@H](CCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)CCO1	753333689	DKKDMPVCINEQCM-JKSUJKDBSA-N	438.550	1.620	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(C(=O)NNc2cc(Cl)nc(N)n2)ccc1Br	753683042	YQZVJYRARULFOP-UHFFFAOYSA-N	449.718	1.482	50	20	IDGD	
O=C(COC(=O)c1cccnc1I)NNC(=O)c1cccs1	754941535	IBPQSQCJGJPVLT-UHFFFAOYSA-N	431.211	1.366	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)[C@H](C)CS(=O)(=O)c1ccc(F)cc1	755035844	GNBSSULXVZUNJL-CQSZACIVSA-N	438.477	1.861	50	20	IDGD	
C[C@@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(NC(=O)NNC(=O)c3cnn(C)c3)cc2)C1	755419297	BTPQOGAAYDKISC-ZIAGYGMSSA-N	434.522	1.553	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1ccccc1CN(C)C1CCCCC1	755425748	QXLVDXFVLMMSEC-AWEZNQCLSA-N	425.555	1.542	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)C(=O)Nc1ccc(N2C[C@H]3CC[C@H]2C3)cc1	756154829	IRIWXMFXXMEGSM-LIRRHRJNSA-N	446.471	1.051	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)Nc1cccc(N2CCS(=O)(=O)CC2)c1	756206227	LVZJIXMDXDTPMN-UHFFFAOYSA-N	443.485	1.025	50	20	IDGD	
CN(C)C(=O)Cn1cnc(NC(=O)NNC(=O)COc2ccccc2-c2ccccc2)n1	756770903	PIZGMFJUUQPPPK-UHFFFAOYSA-N	437.460	1.265	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)N[C@@H]1CCN(C(=O)CCc2ccccc2)C1	757276760	XGFOGCLZBCKLIU-MRXNPFEDSA-N	448.483	1.513	50	20	IDGD	
Cc1nn([C@H]2CCS(=O)(=O)C2)c(C)c1NC(=O)NNC(=O)C(C)(C)c1ccccc1	757871102	DKAUINVVAPAGKU-INIZCTEOSA-N	433.534	1.990	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)COc1ccc(-c2ccccc2)cc1Cl	758035278	KMASGYBJUUZZCA-GFCCVEGCSA-N	425.894	1.471	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)c1cc(-c2cccs2)n(-c2ccccc2)n1	758035885	OJEGZQCHQCIIGN-GFCCVEGCSA-N	433.515	1.300	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)NCC1CCN(S(=O)(=O)CC)CC1	758741709	FTUJBFCVTTWCDL-UHFFFAOYSA-N	426.539	1.020	50	20	IDGD	
CC(=O)Nc1nc(C(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)cs1	758782674	WJJPZQNWFRBNQG-UHFFFAOYSA-N	426.499	1.351	50	20	IDGD	
CC[C@@H]1Oc2cc([C@@H](C)NC(=O)NNC(=O)C(=O)Nc3ccccn3)ccc2NC1=O	758821394	MTZKATHAPUFXQQ-RISCZKNCSA-N	426.433	1.221	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cnc([C@H]3CCCO3)s2)cc1	760264585	SDNZYVXCQCWOCS-CQSZACIVSA-N	438.531	1.385	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNS(=O)(=O)c1ccc([N+](=O)[O-])c(C(=O)O)c1	760339931	OHTMAXMWNCSGCU-UHFFFAOYSA-N	447.223	1.017	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)Cn3cnc(-c4ccccc4)n3)CC2)cc1	761953076	NBHSQHYFPOWRND-UHFFFAOYSA-N	447.543	1.219	50	20	IDGD	
O=C(NNC(=O)c1ccc2ccccc2n1)C(=O)Nc1cccc(N2CCCNC2=O)c1	763449014	BUFQPSJOIDPTQN-UHFFFAOYSA-N	432.440	1.554	50	20	IDGD	
CC(C)(C)c1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccccc2-n2ccnn2)cc1	763593270	AJOFLGBLRHHBCQ-UHFFFAOYSA-N	436.472	1.730	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccccc2N2CCCCC2)cc1	763664043	QFBLLQRCDRRQIC-UHFFFAOYSA-N	426.473	1.850	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2ccn(CCc3ccncc3)n2)c1	763668136	JSMWXJNQMVDVPP-UHFFFAOYSA-N	436.472	1.303	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2ccc(-n3cncn3)c(F)c2)c1	763669691	YOPMEALYVSGJSB-UHFFFAOYSA-N	426.408	1.188	50	20	IDGD	
COCCCOc1ccccc1NC(=O)C(=O)NNC(=O)CN1CCCc2ccccc21	763729170	VQJISSXMEIEAPP-UHFFFAOYSA-N	440.500	1.641	50	20	IDGD	
CCOC(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)c1	763841388	QXOXWMDMQFOIEG-INIZCTEOSA-N	441.484	1.962	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)C(=O)N(C)C3=O)c1C	763848440	HSDCTDLKJMIWOG-ZDUSSCGKSA-N	438.440	1.083	50	20	IDGD	
COC(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)Cc2c[nH]c3ccccc23)c1	763856295	HCBOIWOHDKLDAC-UHFFFAOYSA-N	428.832	1.937	50	20	IDGD	
CCS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)Cc2c[nH]c3ccccc23)cc1	763860081	ARLGNWAHYNWJHO-UHFFFAOYSA-N	428.470	1.290	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1	763860694	KOTOZAZKSYXARK-ZDUSSCGKSA-N	430.417	1.855	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1cccnc1N1CCCCC1	763867361	VFVGRRWVGJKGLU-AWEZNQCLSA-N	429.452	1.764	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(F)c(C(=O)OC)c2)cc1	763867601	XOYSHNJMXQRVEE-GFCCVEGCSA-N	447.419	1.564	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)Cc2ccc(Cl)cc2)ccc1N1C(=O)CCC1=O	763931065	CUDJHIRLFQRVFD-UHFFFAOYSA-N	442.859	1.630	50	20	IDGD	
CC(=O)Nc1ccc(C)c(NC(=O)C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)c1	763950127	SZVFBSNYNYBNMY-UHFFFAOYSA-N	436.428	1.244	50	20	IDGD	
Cc1cc(SC(C)(C)C)ccc1NC(=O)C(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1	763999294	VEHNSDHPPOPDRT-LBPRGKRZSA-N	427.548	1.406	50	20	IDGD	
COC(=O)c1ccc(OC)cc1NC(=O)C(=O)NNC(=O)Cc1cccc2ccccc12	764028815	PKBMMNSNCCFFQI-UHFFFAOYSA-N	435.436	1.964	50	20	IDGD	
Cc1nnnn1[C@H](Cc1ccc(F)cc1)C(=O)NNC(=O)CSc1ccccc1O	764045463	LMRJHASURTZNQI-OAHLLOKOSA-N	430.465	1.550	50	20	IDGD	
Cc1nc(C)n(-c2ccccc2NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)n1	764116996	LSSDXCYKLVHKLW-UHFFFAOYSA-N	428.836	1.643	50	20	IDGD	
CC(C)(C(=O)NNC(=O)C(=O)Nc1ccc(N2C(=O)CCCC2=O)cc1)c1ccccc1	764303824	ZVSJGFDQAVUKBE-UHFFFAOYSA-N	436.468	1.794	50	20	IDGD	
CC(C)(C(=O)NNC(=O)C(=O)Nc1ccccc1C(=O)N1CCOCC1)c1ccccc1	764308960	JSQFNMYYEBVKDQ-UHFFFAOYSA-N	438.484	1.223	50	20	IDGD	
CCOc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NNC(=O)C(C)(C)c1ccccc1	764309912	WTVMJHANVPBLCY-UHFFFAOYSA-N	440.500	1.851	50	20	IDGD	
CS(=O)(=O)NCc1ccc(C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)o1	764333366	SWOSQQDKSVTHNY-UHFFFAOYSA-N	428.417	1.256	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@@H]2C)ccc1NC(=O)C(=O)NNC(=O)c1cnn(C)c1	764360182	UJYRWQHPQVKERQ-AWEZNQCLSA-N	426.477	1.143	50	20	IDGD	
Cc1ccc(Cn2nccc2NC(=O)C(=O)NNC(=O)COCc2ccccc2)s1	764366935	FQXVEBSLGOHVGK-UHFFFAOYSA-N	427.486	1.604	50	20	IDGD	
COc1cc(F)c(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)cc1F	764387718	MJLNLKCAWRBHAZ-UHFFFAOYSA-N	433.346	1.902	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)C(=O)Nc1cc2c(cc1[N+](=O)[O-])OCCCO2	764405015	HSKWDOBRJUGBRV-UHFFFAOYSA-N	428.401	1.393	50	20	IDGD	
Cc1[nH]c(-c2ccncc2)nc(=O)c1CC(=O)NNC(=O)CCCNC(=O)OC(C)(C)C	765319352	VYSQWYGFNSSTJQ-UHFFFAOYSA-N	444.492	1.135	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)NNC(=O)c1ccc(Br)s1	765641378	OLVSHHOQTFKPPF-UHFFFAOYSA-N	433.309	1.885	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cccc(C[S@](C)=O)c3)CC2)cc1	765749365	XGKMSQAVOWWCAF-HKBQPEDESA-N	442.585	1.452	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)NCCOc1ccc(S(=O)(=O)C(F)(F)F)cc1	766533115	YROKIULAQMFFGO-UHFFFAOYSA-N	446.407	1.327	50	20	IDGD	
O=C(NCCc1cccs1)NNC(=O)c1ccc(N2C(=O)CCC2=O)c([N+](=O)[O-])c1	767724415	UFBFJBFHMYDEQW-UHFFFAOYSA-N	431.430	1.496	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)c2cc(Br)c(C)n(C)c2=O)c1	768934638	KIDUNHYEQJUKBI-UHFFFAOYSA-N	436.262	1.383	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)CCSc2ccc(F)cc2)cn1	770219887	NLUSWIUFHXDMIP-UHFFFAOYSA-N	426.495	1.414	50	20	IDGD	
COc1ccc(NNC(=O)CN2C(=O)N[C@@](C)(c3ccccc3OC)C2=O)c([N+](=O)[O-])c1	771273327	LXTMPDSYCUDFTJ-FQEVSTJZSA-N	443.416	1.522	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNS(=O)(=O)c1ccc(Cl)c([N+](=O)[O-])c1	771606570	IBGKEJGCSVEEPR-UHFFFAOYSA-N	447.256	1.528	50	20	IDGD	
Cc1nc2ccccc2n1CCC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	771869829	ZIRFPERJZHGGSF-UHFFFAOYSA-N	429.502	1.446	50	20	IDGD	
C[C@@H]1Oc2ccccc2N(CCC(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)C1=O	772187792	FKFBESBORAAJKX-ZDUSSCGKSA-N	444.875	1.308	50	20	IDGD	
Cc1ccc(-n2nc(C)cc2NC(=O)C(=O)NNC(=O)Cc2ccc3ccccc3c2)nn1	773496069	JXLDZZIHGPPWFZ-UHFFFAOYSA-N	443.467	1.761	50	20	IDGD	
O=C(NNc1ccccc1[N+](=O)[O-])C(=O)Nc1ccc(F)c(S(=O)(=O)NC2CC2)c1	773651338	SSSOBWCYTQWCBO-UHFFFAOYSA-N	437.409	1.256	50	20	IDGD	
N#Cc1ccc(NNC(=O)C(=O)Nc2c(C(=O)N3CCOCC3)oc3ccccc23)cc1	773699422	FIZCRRSFTAITCB-UHFFFAOYSA-N	433.424	1.859	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1c[nH]nc1-c1ccccn1	774009724	SJCZQUXOQGIGHX-LLVKDONJSA-N	428.836	1.679	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)Nc2ccnn2[C@@H]2CCS(=O)(=O)C2)o1	776056613	MDAUKBWZRZTYBZ-CYBMUJFWSA-N	438.510	1.144	50	20	IDGD	
Cc1ccc(S(=O)(=O)C[C@H](C)NC(=O)NNC(=O)c2nnc(O)c3ccccc23)cc1	776190871	FSQHTSVJHPEWFK-ZDUSSCGKSA-N	443.485	1.450	50	20	IDGD	
CCO[C@@H]1C[C@H](NC(=O)NNC(=O)[C@@H](C)Oc2cccc(Br)c2)[C@@H]1OC	776473686	OPQYFTAZSBKOOO-KAOXEZKKSA-N	430.299	1.739	50	20	IDGD	
COc1cc(OC)cc(N2C[C@@H](C(=O)NNc3cccc(S(C)(=O)=O)c3)CC2=O)c1	776534609	MEAXCMZCTWTLHS-ZDUSSCGKSA-N	433.486	1.604	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(OCC(=O)NNC(=O)CNC(=O)c2cccs2)CC1	777135746	MMVCNYOVFDXOTH-UHFFFAOYSA-N	440.522	1.041	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)CCNS(=O)(=O)c2cc(C)ccc2C)nc1C	778424805	AVAGBLPOCWDTFZ-UHFFFAOYSA-N	435.506	1.390	50	20	IDGD	
O=C(NNc1cc(Cl)ccn1)[C@H]1CCCN1S(=O)(=O)c1cccc([N+](=O)[O-])c1	778446608	VOKIIAVWSBIOJK-CQSZACIVSA-N	425.854	1.940	50	20	IDGD	
C[C@H](NC(=O)CC(C)(C)C)C(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	778858552	DVDNICLCWURDDD-ZDUSSCGKSA-N	427.546	1.657	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2ccc(Cl)c(S(=O)(=O)N(C)C)c2)nc1	782145115	BYDYLJIRGNQEKY-UHFFFAOYSA-N	427.870	1.076	50	20	IDGD	
CS(=O)(=O)CCOc1cccc(NC(=O)C(=O)NNc2ncccc2C(F)(F)F)c1	783127516	USHUIBWZZJEUTP-UHFFFAOYSA-N	446.407	1.606	50	20	IDGD	
O=C(NNc1ncnc2ccsc12)C(=O)Nc1ccccc1S(=O)(=O)C(F)F	783261169	ACSXXXQWRKYKIL-UHFFFAOYSA-N	427.414	1.769	50	20	IDGD	
Cc1c(Cl)cccc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)NC(C)C)cn1	783263695	JVPSLTJRXDNXLP-UHFFFAOYSA-N	425.898	1.812	50	20	IDGD	
Cc1ccc(Oc2ccc(NC(=O)C(=O)NN[C@@]3(C)CCS(=O)(=O)C3)cn2)cc1C	783426507	MFHBKZORHCGMHI-FQEVSTJZSA-N	432.502	1.627	50	20	IDGD	
Cc1ccnc(NNC(=O)C(=O)Nc2ccc(N3CCOCC3)cc2N2CCOCC2)c1	783931154	JCKFPBVQJSUUKH-UHFFFAOYSA-N	440.504	1.145	50	20	IDGD	
CC(C)Oc1ncccc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	784214599	AAHNCNZWDYHKMU-UHFFFAOYSA-N	433.490	1.391	50	20	IDGD	
CS(=O)(=O)c1c(Cl)cccc1NC(=O)C(=O)NNc1ccnc(Br)c1	784829136	XWKXYJIJJVNDEH-UHFFFAOYSA-N	447.698	1.983	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)Cn1c(=O)oc2cc([N+](=O)[O-])ccc21	785343756	HIZMCOUNGKBULM-SNVBAGLBSA-N	434.792	1.771	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)[C@H]1CCCN(C(=O)CCOc2ccccc2)C1	788178929	UGWBLSOFNLIQBZ-KRWDZBQOSA-N	435.488	1.813	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)C(=O)Nc2nc3c(s2)CCCCC3)c2ccccc2c1=O	789732372	NANVDUMVOQUYRR-UHFFFAOYSA-N	440.485	1.059	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)N[C@@H]1CCN(Cc2ccc(C)cc2)C1=O	790700886	KMLKPMVFFVSYSP-GOSISDBHSA-N	440.500	1.904	50	20	IDGD	
Cn1c(=NNC(=O)[C@@](C)(O)Cn2cc(C(F)(F)F)ccc2=O)sc2ccccc21	792044310	LLHCVQSQPXNFER-KRWDZBQOSA-N	426.420	1.803	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)C(=O)Nc2cccc(Cl)n2)c1	793027146	VRLOSNAIANCEAY-UHFFFAOYSA-N	427.642	1.906	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNS(=O)(=O)c1ccc(Cl)c(C(=O)O)c1	794598784	NEWHENJTWDRETK-UHFFFAOYSA-N	441.849	1.274	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)c(OC)c(C)c1OC	796989273	CXCCAOUQJLYKAP-GFCCVEGCSA-N	449.435	1.713	50	20	IDGD	
CC(C)S(=O)(=O)c1ccccc1NC(=O)NNC(=O)CNC(=O)OCc1ccccc1	797626308	UQWOJWALSAVSOW-UHFFFAOYSA-N	448.501	1.948	50	20	IDGD	
CN(CCNC(=O)NNc1ccccc1S(C)(=O)=O)S(=O)(=O)c1ccc(F)cc1	798098858	SVAMFVPIVUKILG-UHFFFAOYSA-N	444.510	1.176	50	20	IDGD	
Cc1cc(O[C@H]2CCN(C)C2=O)ccc1NC(=O)NNC(=O)COc1ccccc1F	799241066	QBNDGOZQMJLGDO-SFHVURJKSA-N	430.436	1.975	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(OC(F)(F)F)c(C#N)c1	799834137	JDVAYFMBJYVTGB-UHFFFAOYSA-N	447.329	1.493	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)NCCNS(=O)(=O)c2ccc(F)cc2Cl)cc(C#N)n1C	801516327	CESSSAATELIMHQ-AUWJEWJLSA-N	449.895	1.999	50	20	IDGD	
COc1ccc([C@@]2(C)NC(=O)N(CC(=O)NNC(=O)Nc3ccc(Cl)cc3)C2=O)cc1	802022778	QUBQOZBTRGKSOA-HXUWFJFHSA-N	445.863	1.969	50	20	IDGD	
O=C(N=c1cc[nH]cc1)NNC(=O)[C@@H]1CCCN(C(=O)N2CCc3sccc3C2)C1	802031221	FKYVLSBIZKDSKM-OAHLLOKOSA-N	428.518	1.608	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)CNS(=O)(=O)c2cccs2)cc1Cl	802075501	CTESRZAXBDCRLB-UHFFFAOYSA-N	448.910	1.550	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)CSCc2cc(=O)n3ccsc3n2)cc1	802121405	BUNKZRVKOWJARM-UHFFFAOYSA-N	432.531	1.908	50	20	IDGD	
COC[C@@H](O)CNC(=O)/C(C#N)=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	802225322	AIVGUQFBEFWVNW-QHIITQONSA-N	431.880	1.109	50	20	IDGD	
C#Cc1cc(F)c(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)c(F)c1	802567720	WPTXZGQPXPAVNN-UHFFFAOYSA-N	427.342	1.875	50	20	IDGD	
COC(=O)CC[C@@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)c1cc(Cl)ccc1O	806354279	CZVPPCONELOYHD-GFCCVEGCSA-N	429.857	1.653	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1cc2n(n1)CCCC2	806968607	MGPXLGKYDDAKJD-UHFFFAOYSA-N	434.522	1.378	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2cccc(F)c2Cn2cccc(C)c2=O)n1	807070220	RIVXQSMUYFTOJJ-UHFFFAOYSA-N	437.431	1.447	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)N1CCC(C(=O)NNC(=O)N2CCN(C)CC2)CC1	807380947	WUXDDXVPZVPOAL-UHFFFAOYSA-N	437.928	1.189	50	20	IDGD	
COCC[S@@](=O)Cc1cccc(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2C)c1	807455601	QEQARBOTHVFGRQ-SSEXGKCCSA-N	434.474	1.880	50	20	IDGD	
COC[C@]1(C(=O)NNC(=O)CSc2ccccc2O)CCN(C(=O)OC(C)(C)C)C1	810807052	FGQGKEBCXWROBM-FQEVSTJZSA-N	439.534	1.905	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2cc(C)cnc2Br)c1	812978746	BOFCOMFGKAZQPU-UHFFFAOYSA-N	437.250	1.569	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(C)cnc1Br	812980388	SHUAXJOFRAHMOI-UHFFFAOYSA-N	435.278	1.880	50	20	IDGD	
COc1cc(Cl)c(NC(=O)C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)cc1C	813033788	LHYJLWILZHYMQY-UHFFFAOYSA-N	440.909	1.989	50	20	IDGD	
CC[C@@H]1[C@@H](C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)CCN1C(=O)OC(C)(C)C	813367946	PZZSJRAXNXWDPN-JKSUJKDBSA-N	429.481	1.459	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NN=C[C@@H]1CCCOC1)N(S(C)(=O)=O)CC2	814759338	YYVWBPOPYLRUIZ-YOEHRIQHSA-N	439.534	1.481	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCO1)C(=O)Nc1cc(C(F)(F)F)cc(Br)n1	815779683	QVDUTWNSVQEAJW-SSDOTTSWSA-N	425.161	1.128	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)NCC(=O)NCCN2CCCCCC2)c1C	817157586	KDJGRUNYNOGNIM-QNGOZBTKSA-N	429.565	1.767	50	20	IDGD	
C=CCn1c(S)nc2cc(C(=O)NNC(=O)CNc3ccccc3OC)ccc2c1=O	825630464	HJMPQHQSEHXFGI-UHFFFAOYSA-N	439.497	1.753	50	20	IDGD	
O=C(COC(=O)/C=C\c1nc2ccccc2s1)NNC(=O)[C@@H]1COc2ccccc2O1	849190089	YVPJNEBVTHJHQA-YDZSZYSISA-N	439.449	1.840	50	20	IDGD	
COC(=O)c1cc(C(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)cc([N+](=O)[O-])c1	859262706	ZUBANONJTJMMDH-UHFFFAOYSA-N	433.373	1.482	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)CSCc1cc(=O)n2ccsc2n1	887199552	DBFKTXYIBAEGHZ-UHFFFAOYSA-N	434.499	1.224	50	20	IDGD	
COc1cc(F)c(S(=O)(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)cc1OC	914563003	NDBRVRUWOKMLAU-UHFFFAOYSA-N	425.438	1.408	50	20	IDGD	
Cc1nc2c(C#N)cnn2c(C)c1CCC(=O)OCC(=O)NNC(=O)c1cccs1	914994540	NPEFOOUQPMAGQX-UHFFFAOYSA-N	426.458	1.216	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)N[C@@H](C)c2ccc(-n3cncn3)cc2)nc1	915923351	MXEZNNXBKOTVSL-AWEZNQCLSA-N	444.521	1.736	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(NC(=S)NNC(=O)Cn2cnc3ccccc32)c1	916120332	PWTLYWYNLHBVRN-UHFFFAOYSA-N	432.531	1.304	50	20	IDGD	
O=C(NCc1ccccc1CS(=O)(=O)N1CCOCC1)NNc1cccc([N+](=O)[O-])c1	916229355	ONQFYTNDOLHEHT-UHFFFAOYSA-N	449.489	1.583	50	20	IDGD	
C[C@]1(NNC(=O)NC[C@H](c2c(F)cccc2Cl)N2CCCC2)CCS(=O)(=O)C1	916433858	XDRUHLUFMITQMN-QAPCUYQASA-N	432.949	1.997	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)NC[C@H](c2ccccc2Cl)N2CCOCC2)n1	916437769	QHERYKFSOMFWLC-GOSISDBHSA-N	434.928	1.557	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCc1ccc(-n2cccn2)cc1	916519247	JUUWBLOHWISRGE-UHFFFAOYSA-N	441.517	1.618	50	20	IDGD	
Cc1n[nH]cc1CNC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	916578384	HGNTZSSJZXXNET-UHFFFAOYSA-N	434.503	1.725	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)c2ccccc2c1=O	916607877	ZLLOQKKOYBJBKW-QGZVFWFLSA-N	434.500	1.542	50	20	IDGD	
NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NNC(=O)COc3ccccc3F)cc2)C1	918002205	UZYHBJCTWROTDA-INIZCTEOSA-N	443.479	1.437	50	20	IDGD	
CCCOc1ccc(C(=O)NNS(=O)(=O)c2cc(C(=O)O)ccc2F)cc1OC	918063388	VTDKBIGHJRGIJP-UHFFFAOYSA-N	426.422	1.945	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(/C#N)C(=O)OCC(=O)N2CCC[C@H](NC(C)=O)C2)c1C	918818770	YVJCMGKINFELPJ-QLEZNRJXSA-N	444.532	1.890	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)c2ccc3c(c2)C[C@@H](C)N3S(C)(=O)=O)cc1	919836477	SREMUPQMPCGYET-CQSZACIVSA-N	431.514	1.800	50	20	IDGD	
Cc1c(CC(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)nnn1-c1ccccc1	919959427	SIKUSZIAIDCHHG-UHFFFAOYSA-N	445.483	1.870	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)[C@@H]2CCCN2C(=O)/C=C\c2ccc(C(N)=O)cc2)c(O)c1	920037430	PAUWOSQZDCPYKC-VTSXBNNFSA-N	436.468	1.265	50	20	IDGD	
CS(=O)(=O)N1CCC[C@@H](NC(=O)NNC(=O)c2ccc(COc3ccccc3)o2)C1	920240173	KUZCVIULXBLZDV-CQSZACIVSA-N	436.490	1.227	50	20	IDGD	
CCCNC(=O)NNC(=O)c1ccc(OC)c(S(=O)(=O)N2C[C@H](C)C[C@@H](C)C2)c1	921042608	CXUKODHPQCQVKS-ZIAGYGMSSA-N	426.539	1.716	50	20	IDGD	
CCN1CCN(Cc2ccccc2CNC(=O)NNC(=O)c2ccc(OC)cc2)CC1	1115854479	GNHZZOAECLCSQJ-UHFFFAOYSA-N	425.533	1.977	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2ccc(OCC3CC3)nc2)cc1	1318400419	WYOXJFMVKDXGEI-UHFFFAOYSA-N	432.502	1.261	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1nc(-c2ccc(F)cc2)n2c1CCCCC2	1337619884	NXNPRAYOOSQERM-CQSZACIVSA-N	434.493	1.611	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCC(=O)NNc2nnc(-c3ccccn3)s2)cc1	1343553469	WICFVNSIYSEVFC-UHFFFAOYSA-N	434.503	1.420	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc3c[nH]nc3c2)C1	1777884622	VKYNGMGONZGAKU-HGHGUNKESA-N	434.924	1.944	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4cccnc4n3)C2)C1	1778433720	JRNKVRPIPIHAFY-DJJJIMSYSA-N	433.306	1.857	50	20	IDGD	
COc1ccc2cc(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)[C@@H](O)CCl)C4)[nH]c2c1	1778550355	HYLGYANDYBUNRN-NNMXDRDESA-N	449.935	1.904	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1[nH]nc3ccncc13)C2	1779543584	ITDPFZUMZJBRPF-DYESRHJHSA-N	445.596	1.937	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(CCN(C(=O)c3ccc(-n4cccn4)nc3)C2)C1	1779688702	KKZHETJXDFIXEW-IBGZPJMESA-N	448.321	1.496	50	20	IDGD	
C[C@@H]1Oc2ccc(C(=O)N3CC[C@@]4(C3)CN(C(=O)C(Cl)Cl)CCO4)cc2NC1=O	1780181613	XQMICXVHDGGBEL-JEOXALJRSA-N	442.299	1.653	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)N2CCN(C)CC2)C1	1780641127	QJJCMHPGTZCQLX-BMQTXXJKSA-N	429.005	1.154	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)Cc3ccc(S(C)(=O)=O)cc3)CCO2)C1	1781212813	HJDREVJJMJVSQK-YLJYHZDGSA-N	442.965	1.480	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)c3cn4cccnc4n3)CCO2)C1	1781230705	YBHTZMVTWVSMPT-ROUUACIJSA-N	426.304	1.409	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)Cc3ccc4ncnn4c3)CCO2)C1	1781232854	ZATICAHHZXUMGG-RBUKOAKNSA-N	440.331	1.338	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Cl)C2)c1cc2cccnc2nc1O	1781249288	CYRQBGNQNRMSRI-QEEYODRMSA-N	436.871	1.997	50	20	IDGD	
O=C(c1cc2ccccn2n1)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781329649	IGRJAOBXINKLOG-WMLDXEAASA-N	425.258	1.468	50	20	IDGD	
Cn1cc2cc(C(=O)N3CCO[C@@]4(CCN(C(=O)[C@H](F)Br)C4)C3)ccc2n1	1781333223	MLWBSHIIILNOPQ-MAUKXSAKSA-N	439.285	1.707	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)COc1cccnc1)C2	1781997134	FQQXXVSWJCYKCP-IDHHARJASA-N	440.338	1.758	50	20	IDGD	
CC(=O)NCC(C)(C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)Br)C1	1781997333	RFENYTMGAUZKAJ-ZXYWRSMDSA-N	446.386	1.446	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1noc3c1CCCC3)C2	1782172930	QSQOMLKQIVQLCY-LUQKVYGDSA-N	439.940	1.935	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCC(=O)NN(C)C)C1)c1ccccc1	1782213879	BAQJQAQYHRKWDE-MFSJNOQSSA-N	444.576	1.677	50	20	IDGD	
COC(=O)C12CC(C(=O)N3CC[C@H]4OCCC[C@@]4(CNC(=O)C(Cl)Cl)C3)(C1)C2	1782220909	GJNFDNGTIKQBNY-MLHVSEJTSA-N	433.332	1.647	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCc2ncc[nH]2)C1	1782398352	QRWKUAZOWODJEZ-QMTMVMCOSA-N	441.370	1.887	50	20	IDGD	
C[C@H](C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCBr)C2)n1cncn1	1782529409	DXRMNTXFWGBLDM-CKEIUWERSA-N	428.331	1.138	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc4ncncc4c3)CCO2)C1	1783534851	ZWQPYTUCZADWSI-YJYMSZOUSA-N	433.306	1.857	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)Cc3cc(F)ccc3[N+](=O)[O-])CCO2)C1	1783884120	QMJSJFQKRUXDBR-HNAYVOBHSA-N	443.859	1.360	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](C)Oc3ccccn3)C2)C1	1784490679	BMGZQLBLBNSCED-DOXZYTNZSA-N	440.338	1.852	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](C)Oc3cccnc3)C2)C1	1784549531	WVAZZYLVRNZGNC-SIXWZSSISA-N	440.338	1.852	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3ccc(OC)c(C)c3)[C@H]2C1	1784843386	OHETZYAJJQMMST-GNBUJSLZSA-N	438.952	1.780	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3cnn(C)c3)[C@H]2C1	1787012255	KJQNJZSBVBDGEU-OEAJRASXSA-N	427.343	1.116	50	20	IDGD	
Cc1cc(C)nc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Br)C[C@@H]32)c1	1787191337	ZGWKIKQHLVDERR-SDADXPQNSA-N	428.302	1.982	50	20	IDGD	
COc1cc(OC)c(F)c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]3C2)c1	1787447873	HXZGWTWJQJEBPE-CDUAKIRFSA-N	432.851	1.971	50	20	IDGD	
Cc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)Br)C[C@@H]32)cc(O)n1	1787457364	GAYSFVXCAVLHAB-DHMWGJHJSA-N	426.311	1.472	50	20	IDGD	
N[C@H](C(=O)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1)c1ccccn1	1788140658	GUYPIYMCYBMYMD-NRFANRHFSA-N	444.300	1.209	50	20	IDGD	
O=C(CCc1cncnc1)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1	1788140679	JKQUOSKCKDSTAH-UHFFFAOYSA-N	444.300	1.537	50	20	IDGD	
O=C1COc2ccc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)[C@H](F)Cl)C[C@@H]43)cc2N1	1788362753	RCICUGCNHPEUCY-HJXMPXNTSA-N	425.844	1.145	50	20	IDGD	
Cc1nnc(CCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]3C2)s1	1789868303	AQZSHRBXXNTNKO-WZTLGTBRSA-N	449.404	1.995	50	20	IDGD	
CCOC(=O)O[C@@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]2C1	1789871550	FWGUMQLNRGCCMJ-NTIKPUAMSA-N	439.336	1.764	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4ncccn4n3)C[C@@H]21)[C@@H](F)Br	1789926020	LDRWUHIEOZDNTD-TZQJONAQSA-N	440.273	1.013	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccccc3-n3nccn3)[C@H]2C1	1790167815	DUCOZQUHDQDXPB-XPYUAMARSA-N	447.923	1.114	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccn4nccc34)C[C@@H]21	1791063691	QEPIZEJJMXOIAC-HPZZRFSDSA-N	435.322	1.711	50	20	IDGD	
Nc1c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]3C2)sc2nccnc12	1791294412	VSNZBDIDEIMFJS-GUBZILKMSA-N	444.344	1.671	50	20	IDGD	
O=C(CCCn1ccnc1)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21	1791562451	LJNKCVLIZNFFBI-JYJNAYRXSA-N	427.343	1.428	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1ccc(C2(NC(=O)c3cccn(C)c3=O)CCC2)cc1	1791599460	ICQCZABVAIXYIB-UHFFFAOYSA-N	439.516	1.506	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(C(=O)N(C)C)c3)[C@H]2C1	1792099859	ZGAUBQJCJDOZPO-OKYOBFRVSA-N	435.952	1.999	50	20	IDGD	
CCC[C@@H](NC(C)=O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)CBr)C[C@@H]21	1792182092	KOZPUXOYFXTTPQ-DWBZUHSKSA-N	446.386	1.302	50	20	IDGD	
O=C(Cc1cccc([N+](=O)[O-])c1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2	1792421596	PULZJVISJUPKGH-ZSBFGKGUSA-N	440.294	1.512	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)COCc1ccccc1	1795426623	DYAIWCLOWUHQLK-SFNKJDCFSA-N	439.350	1.966	50	20	IDGD	
C=C(Oc1ccccc1O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Br)C2	1796433412	CQVRUKMOOZNFPF-MBMVNNNZSA-N	439.306	1.658	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnn2ccccc12	1796839802	PTIUMKKLSMOYPS-ZJOBFFGXSA-N	435.322	1.569	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](C)n1cccn1)C2	1796893016	HLGJOVULMGVYHD-UFYZLLATSA-N	425.493	1.216	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1c[nH]c2ccc(OC)cc12	1797408794	YNFNTKBGICPRLR-OESLAJAZSA-N	435.908	1.634	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccn2cncc12	1797525570	PGAYVYSINAAXFA-IARIHHJXSA-N	435.322	1.711	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1nc2c(=O)[nH]c3ccccc3n2n1	1797659743	NIIBELQWVDNQOB-CRWXNKLISA-N	442.907	1.840	50	20	IDGD	
O=C(CS[C@H]1CCCCO1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2	1797799845	TVBLRNPXZPUDSP-FONWIUJUSA-N	439.347	1.526	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1O	1799985097	GIDQUJNKCOVZCL-NEMWNAMBSA-N	443.972	1.870	50	20	IDGD	
CCN(C)[C@H](C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)C2	1800166008	HPANUGYQHCUMHE-ILCOLZDNSA-N	446.498	1.802	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1CCN(CC)CC1)C2	1800644917	KOGTWMWLCRNASY-YYIAUSFCSA-N	430.387	1.481	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CC[C@H]1CNc3ccccc3C1)C2	1800975833	VEIRSBHRYIXOHA-JHRANDQASA-N	449.979	1.894	50	20	IDGD	
COc1ccc(F)c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C(Cl)Cl)c1OC	1801017336	NFFZUEKBEMUMLX-WDAIWFPHSA-N	435.279	1.850	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@H]1CCN(C(=O)CCC(N)=O)[C@H]1c1cccnc1	1803014891	HIYNIJPHFIDHLE-MRRJBJDNSA-N	425.327	1.384	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cc3ncccc3[nH]2)[C@H]1c1cccnc1)[C@H](O)CCl	1803146399	ASCJMHWHHALYMT-KYNGSXCRSA-N	427.892	1.877	50	20	IDGD	
Cc1ccncc1CCC(=O)N1CCCC2(CCN(C(=O)c3cccc(B(O)O)c3)CC2)C1	1807070533	ABWPJNYWRPDQAW-UHFFFAOYSA-N	449.360	1.547	50	20	IDGD	
CN[C@H](CC(=O)NC[C@@H]1CCN(C(=O)[C@](C)(Cl)CCl)[C@@H]1c1cccnc1)C(=O)O	1807206275	SPJQXYTYZQIFIZ-XWESNNAXSA-N	445.347	1.386	50	20	IDGD	
C=C(C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)C(F)(F)F	1807368158	PQQVZLJTHMRTIS-WMZOPIPTSA-N	447.222	1.200	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@H]1CCN(C(=O)Cn2cncn2)[C@H]1c1cccnc1	1808294905	CRMFDEIMLCQSLX-HFTRVMKXSA-N	425.320	1.615	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CS(=O)(=O)N2CCCC2)[C@H]1c1cccnc1)[C@H](F)Cl	1808313351	WRTNUKPQDWDITE-XIRDDKMYSA-N	446.932	1.047	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Cl)[C@@H]1c1cccnc1	1808416710	CYLJKDUSZMIFRH-YFNDBRTESA-N	448.886	1.756	50	20	IDGD	
C#CCO[C@H](C)C(=O)N1CC[C@H](CNC(=O)[C@H](F)Br)[C@@H]1c1cccnc1	1808649817	XYRQWBVEXGQASW-OJLVUWQFSA-N	426.286	1.816	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@H](CNC(=O)Cn2nccn2)[C@@H]1c1cccnc1	1808961857	YKVRBKCPKRRQME-ZVZYQTTQSA-N	425.320	1.615	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC2(CCCN(C(=O)COc3ccc(F)cc3)C2)CC1	1809183337	CWCSATMGRKCNMU-UHFFFAOYSA-N	448.539	1.809	50	20	IDGD	
Cc1cc2nnc(C(=O)NC[C@@H]3CCN(C(=O)[C@@H](F)Cl)[C@@H]3c3cccnc3)c(C)n2n1	1809185391	FQJVCTBBTYEUDO-BMGDILEWSA-N	445.886	1.990	50	20	IDGD	
O=C(c1ccc2nonc2c1)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1	1809972295	MGFWNHXJYLIRAZ-UHFFFAOYSA-N	448.288	1.061	50	20	IDGD	
CC(C)CNC(=O)C(=O)N1CC[C@H](CNC(=O)CO[Si](C)(C)C)[C@H]1c1cccnc1	1810542759	XXQOKQUNYNOHBB-IEBWSBKVSA-N	434.613	1.711	50	20	IDGD	
CC(=O)N/C(C)=C/C(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)Br)[C@@H]1c1cccnc1	1812322204	KBAHCSMOANIOAD-OSAQNDDDSA-N	437.338	1.911	50	20	IDGD	
C=C(C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)C(F)(F)F	1812677044	NIYJAKNYCSMZJJ-FUHWJXTLSA-N	447.222	1.200	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)[C@H](C)n2ccnn2)[C@@H]1c1cccnc1	1812868801	MRMVZUVQLYMKTF-DARAHFNDSA-N	435.326	1.724	50	20	IDGD	
CSCC(C)(C)C(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1813068969	RDUMRFOBFKOQTM-FXAWDEMLSA-N	449.621	1.850	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1	1814060903	YUPBWKZIXCQSPK-WAOWUJCRSA-N	442.903	1.638	50	20	IDGD	
CCC[C@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](O)N2CCOCC2)[nH]n1	1815319338	IGWJNTSDLHFEAV-YEWWUXTCSA-N	427.933	1.460	50	20	IDGD	
Cc1cc(C(=O)N[C@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)ccn1	1815344114	INHSLXCFUKLFMO-INIZCTEOSA-N	436.302	1.066	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccoc2Cl)[nH]n1)c1ccc(B(O)O)cc1	1817472659	QEIFOAFZHHHTKG-MRXNPFEDSA-N	442.668	1.956	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccn3c(O)nnc23)n[nH]1	1817967846	ANRWPHBOSQAKJR-JSGCOSHPSA-N	447.883	1.718	50	20	IDGD	
O=C1NCCCn2nc(C(=O)N3CCCC[C@@H]3c3cc(NC(=O)[C@H](F)Cl)n[nH]3)cc21	1818038980	HHDCTKHBEMZPDU-DOMZBBRYSA-N	437.863	1.580	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(Cl)ncn2)n[nH]1	1819981307	YXXKLJKLIZMONI-CQSZACIVSA-N	448.915	1.532	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](C)n3ccccc3=O)sc2C1	1820130882	LWZNUCHLAZUYSG-XQQFMLRXSA-N	438.937	1.732	50	20	IDGD	
Nc1n[nH]c(CCC(=O)N2CCCC[C@H]2c2cc(NC(=O)[C@@H](F)Br)n[nH]2)n1	1820935788	SXUGYHBFFQZKOY-TVQRCGJNSA-N	443.281	1.425	50	20	IDGD	
C[C@H](O)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)[nH]n1	1822172588	KXYYSVPBUQHWCZ-UBHSHLNASA-N	443.932	1.915	50	20	IDGD	
COCCn1nccc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](Cl)COC)n[nH]1	1822367711	ACINNXGPWTYQQO-UKRRQHHQSA-N	438.916	1.812	50	20	IDGD	
CC(=O)N/C(C)=C/C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](F)Br)CC2	1824475195	HTXIJGAYGCPQMY-UNBPSNLMSA-N	433.303	1.786	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)C23CC(F)(C2)C3)CC1	1824580357	KLQQPYDSGHWXGN-WDGBRCNXSA-N	443.523	1.811	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)C(F)(F)C(F)F)CC1	1824844086	WKGMJCFGYHNIFE-INIZCTEOSA-N	444.234	1.500	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](O)CCl)CC2)C1CCC2(CC1)OCCO2	1824896529	MHOVSDXVHWRRKD-GXTWGEPZSA-N	443.953	1.588	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(=O)oc2)CC1	1826225413	VEKVFNYHVAYVLU-GOSISDBHSA-N	432.521	1.246	50	20	IDGD	
O=C(C1CC1)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCN2C(=O)OCc1ccccc1	1828552003	ZJSZZAQDJXYXQU-XMSQKQJNSA-N	449.935	1.448	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccc(C#N)cc3)CCO2)C1	1829898475	HMGRPBJDGAXWDZ-JOCHJYFZSA-N	433.936	1.822	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)COc3ccc(F)cc3)C2)C1	1830359873	XPEGMPLTUSPVJE-OAQYLSRUSA-N	442.915	1.926	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3[C@@H]4C=CS[C@@H]34)C2)C1	1830544198	QHZYFYSGOGJODQ-KQVLKZGSSA-N	445.379	1.349	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CC[C@@H](C(=O)OC)C1)CCO2	1830714240	NQRXQANBGOBSLH-IHSNIMORSA-N	430.929	1.050	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3cc(C)n(C)n3)CCO2)C1	1830945621	OGJLPYUNYVLGPI-PXNSSMCTSA-N	426.945	1.135	50	20	IDGD	
CCc1cc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)no1	1831873100	AGWZFOVLHVMKAH-IBGZPJMESA-N	433.553	1.843	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@](C)(O)C(F)(F)F)CCO2	1832148604	AGOIPYYYVPDRLB-JKSUJKDBSA-N	430.851	1.021	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1Cc3ccccc3CN1C)CCO2	1832472837	SZAZNPDPCXMFFJ-JTAQYXEDSA-N	449.979	1.517	50	20	IDGD	
CC[C@H](NC(C)=O)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)Br)CC2)CC1	1833097313	LXOIAIDQOHDWDM-DYVFJYSZSA-N	445.402	1.256	50	20	IDGD	
CCc1cc(C(=O)N2CCC(N3CCC(NC(=O)[C@@H](O)CCl)CC3)CC2)cc(C)n1	1833310779	SBYVBGJVRDSTRI-FQEVSTJZSA-N	436.984	1.737	50	20	IDGD	
O=C(Cn1nnc2ccccc21)NC1CCN(C2CCN(C(=O)[C@H](F)Cl)CC2)CC1	1833650961	HBSAFTOHEOVXCJ-IBGZPJMESA-N	436.919	1.537	50	20	IDGD	
O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)c1ccnc(Cl)c1)CCO2	1834180695	CBWQBSUNDATCJA-QGZVFWFLSA-N	446.729	1.590	50	20	IDGD	
Cc1cnn(CC(=O)N2CCC(N3CCC(NC(=O)CCBr)CC3)CC2)c1	1834421806	MMGGBPSJHZDFFC-UHFFFAOYSA-N	440.386	1.548	50	20	IDGD	
COc1ccc(C(=O)N2CCOC[C@]3(CN(C(=O)CCBr)CCO3)C2)cc1	1834824206	WOXITIDXMJXWPT-IBGZPJMESA-N	441.322	1.550	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)N1C[C@H]3C[C@@H]3C1)CCO2	1837279729	RKSOKJDLCDEVMR-NPGRCNIMSA-N	427.973	1.191	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cnc(OC)cn3)CC2)CC1	1837572168	IGSKXZHRECRZQP-MRXNPFEDSA-N	440.928	1.351	50	20	IDGD	
Cc1n[nH]c(C)c1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1	1837807065	KOEYODVXRQXMBE-QZTJIDSGSA-N	433.336	1.333	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)ccn1	1837940475	CJTIBDOGFBHFFP-OALUTQOASA-N	430.332	1.696	50	20	IDGD	
Cn1ncc(C(=O)N2CCO[C@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)c1Cl	1838305731	QBQZXNFZYRWUCU-GOSISDBHSA-N	433.336	1.409	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3Cc4ccccc4CN3C)C2)C1	1839142059	CRELMGSZPBFZDI-SXWKCWPCSA-N	449.979	1.517	50	20	IDGD	
Cc1nc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)cs1	1839197937	NICBICRHMRSILJ-IUODEOHRSA-N	436.303	1.212	50	20	IDGD	
O=C(CCc1cccnc1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839198677	AHXVYFXHFPKXLS-SJLPKXTDSA-N	444.301	1.161	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(OC)cc3F)CCO2)C1	1839293049	NVSHGOKOAAXSEE-OXJNMPFZSA-N	444.887	1.158	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3cccc(F)c3F)CCO2)C1	1839982754	ZEGNLEFBVUVGPC-YWZLYKJASA-N	430.879	1.981	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(Cl)(Cl)Cl)C2)C1	1840155433	BVGWYHPNAKSNMF-GWCFXTLKSA-N	438.135	1.067	50	20	IDGD	
CCc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)cc(C)n1	1840187668	PJOAQTOSDNAIQG-LJQANCHMSA-N	430.332	1.826	50	20	IDGD	
O=C(C(Cl)Cl)N1CCO[C@@]2(COCCN(C(=O)[C@]3(F)CCCC=C3F)C2)C1	1840190453	YHGWCKKGXMQSCT-IRXDYDNUSA-N	427.275	1.992	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@]1(C)C(=O)N1CCCC12CN(C(=O)[C@@H](O)CCl)C2	1841774445	FDOYTWXPTSBNHW-LIRRHRJNSA-N	429.945	1.579	50	20	IDGD	
O=C(c1n[nH]cc1I)N1CC2(CCCN2C(=O)[C@@H](F)Cl)C1	1843364368	HIOITSYPHKADCH-SECBINFHSA-N	426.617	1.366	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)[C@H](C)Cc1ccncc1)C2	1843417118	YBGGRVXKLNLLPC-MSZQUAHTSA-N	436.516	1.598	50	20	IDGD	
CCOC(=O)/C=C/C(=O)N1CC2(CCCN2C(=O)c2cc([N+](=O)[O-])ccc2OC(C)=O)C1	1844692400	SFJZVCMQJNYKSS-BQYQJAHWSA-N	445.428	1.456	50	20	IDGD	
CN(CC(=O)N1CC2(CCCN2C(=O)[C@@H](F)Br)C1)C(=O)c1ccccc1	1845215776	DOINFWSQWIZTMB-OAHLLOKOSA-N	426.286	1.653	50	20	IDGD	
Cn1nc(C(F)(F)F)cc1C(=O)N1CC2(CCCN2C(=O)[C@H](F)Br)C1	1845218747	ZOUUDFMEQJOSRA-JTQLQIEISA-N	427.196	1.946	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)Cn2ccnc2C)C1	1845820577	XEMVVXQKBOCTMJ-UHFFFAOYSA-N	441.444	1.542	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)c1n[nH]c3c1CCc1ncccc1-3)C2	1846363162	SIDJYVGTURQRCB-OAHLLOKOSA-N	429.908	1.641	50	20	IDGD	
COc1cc(C)ccc1C(=O)N1CCCC12CN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2	1846799404	UNCXDVZLWJNYLJ-PCLIKHOPSA-N	437.500	1.955	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H]2CC[C@@H](C2)[C@@H]1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl	1847564097	QXRKPNFYOXINNT-NQLMQOPMSA-N	441.956	1.576	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc(Cl)c1OCC(N)=O	9811034	AIWPTHHKBPBGRW-UHFFFAOYSA-N	435.820	1.059	50	20	IDGD	
COc1cc(CCC(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc(OC)c1	16057591	NWLRUNMFDCZYRW-UHFFFAOYSA-N	441.893	1.398	50	20	IDGD	
CCCOc1c(Cl)cc(/C=C(\C#N)C(=O)c2c(N)n(C)c(=O)n(C)c2=O)cc1OC	16881618	VGKKTODOABOLIE-KPKJPENVSA-N	432.864	1.907	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NNC(=O)Cn2cnc3ccccc32)cc1	17404039	FMINBTPBNWTOAJ-IBGZPJMESA-N	441.513	1.345	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)NCc1ccccc1	25107738	BPQNYPUIWJHPHI-UHFFFAOYSA-N	446.529	1.171	50	20	IDGD	
CSCc1nc2ccccc2n1CC(=O)NNC(=O)c1csc(N2CCOCC2)n1	105180842	SGHKMPCZVCANDC-UHFFFAOYSA-N	446.558	1.654	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)c1cccc(NC(=O)c2ccc3nc[nH]c3c2)c1	725740624	HRBDKTQDTVZOGU-UHFFFAOYSA-N	446.423	1.599	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(N2CCCCC2)c(C(=O)NNC(=S)NC(C)(C)C)c1	726141176	HGWNKIDMSXPWJF-UHFFFAOYSA-N	441.623	1.835	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)NCc1cccc(C(F)(F)F)c1)N1C(=O)NC2(CCCC2)C1=O	726528791	GNEASOADVPJZSR-NSHDSACASA-N	441.410	1.789	50	20	IDGD	
C#Cc1cccc(NC(=S)NNC(=O)CNC(=O)c2cc(OC)c(OC)c(OC)c2)c1	727501086	GOUWHMDFJXWZNJ-UHFFFAOYSA-N	442.497	1.441	50	20	IDGD	
Cc1cccn2cc(COc3ccc(C=NNC(=O)[C@@H](C)NS(C)(=O)=O)cc3)nc12	728434840	QWVHFGWVAMMCMJ-OAHLLOKOSA-N	429.502	1.610	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)[C@@H]2CCCN2c2ncnc3sccc23)nc2ccccc21	728511349	KFFZTGQAZFBFMY-INIZCTEOSA-N	435.513	1.937	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2cnn(-c3ccccc3Cl)c2)n1	728732667	AXGLAVANEMGXBT-UHFFFAOYSA-N	433.877	1.838	50	20	IDGD	
O=C(NNC(=O)N1CCCN(Cc2cscn2)CC1)C1CCN(c2ncccn2)CC1	728961735	NCAJAOZPCQIQAL-UHFFFAOYSA-N	444.565	1.098	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCc2ccccc2)cc1C(=O)NNC(=O)Cc1cc[nH]n1	730103428	ZDGZTBRHWIOHKQ-UHFFFAOYSA-N	427.486	1.200	50	20	IDGD	
O=C(NNC(=O)c1ccn(-c2ccc(Cl)c(Cl)c2)n1)N[C@@H]1CCS(=O)(=O)C1	730212716	JIHSGKGZWGJOSF-SECBINFHSA-N	432.289	1.310	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)Cc1cc2c(cc1Br)OCCO2	730841739	KLGYQSOUPLHCEF-UHFFFAOYSA-N	437.246	1.695	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)c1ccccc1S(=O)(=O)N1CCOCC1)c1ccccc1	731996350	KYOOLPMIDPKDNQ-KRWDZBQOSA-N	431.514	1.662	50	20	IDGD	
C[C@@H](c1nc(-c2cccs2)no1)N1CCN(CC(=O)NNC(=O)c2cccs2)CC1	732984425	SHSNRKFUMWNFTP-ZDUSSCGKSA-N	446.558	1.999	50	20	IDGD	
O=C(COc1ccccc1C=NNC(=O)C1CCN(c2ncccn2)CC1)NCC1CC1	734748698	VPHUTQCYKJOFGD-UHFFFAOYSA-N	436.516	1.748	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)[C@H]1CS[C@@H](Cc2ccccc2F)C(=O)N1	737923136	LZBXJCYVEITYNC-MSOLQXFVSA-N	431.489	1.333	50	20	IDGD	
Cc1cc(C)c(S(=O)(=O)NCCC(=O)NNC(=O)COCc2ccccc2)c(C)c1	737927496	YFFLFOVVOLFDDX-UHFFFAOYSA-N	433.530	1.644	50	20	IDGD	
Cn1c(=O)c2cc(C(=O)Oc3ccc([N+](=O)[O-])cc3Br)cnc2n(C)c1=O	739312049	YKSGKSYDLYDBDT-UHFFFAOYSA-N	435.190	1.522	50	20	IDGD	
CC(C)(C)OC(=O)Nc1ccc(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)c(Cl)c1	740818140	FHOIIFAXFLDKKI-LLVKDONJSA-N	446.913	1.818	50	20	IDGD	
CC(C)(C)OC(=O)N(CC(=O)NNC(=O)COc1ccc(C#N)cc1)C[C@@H]1CCCO1	742032925	CTWGSFIXLRSBLV-KRWDZBQOSA-N	432.477	1.501	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NCc2ccccc2Cn2ccnc2)cc1	743526734	KLCGGVXKTWHABZ-UHFFFAOYSA-N	442.501	1.871	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(-n2ncc(Cl)c(Cl)c2=O)cc1)NC1CCCC1	743729981	VQMABWMQFAIEGV-UHFFFAOYSA-N	446.316	1.974	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)c2ccc(I)cc2)c1	744483851	OPJWPZFUXCDOST-UHFFFAOYSA-N	449.204	1.781	50	20	IDGD	
COc1ccc(CCNC(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)c(OC)c1OC	745799054	MRAQBDRZUUINNK-UHFFFAOYSA-N	434.405	1.513	50	20	IDGD	
Cc1nc2c(c(O)nn2C)c(C)c1CCC(=O)NNC(=O)[C@@H](C)Oc1ccccc1F	746097730	MQXPDKQZFCAKLK-CYBMUJFWSA-N	429.452	1.977	50	20	IDGD	
CNS(=O)(=O)c1cccc(NC(=O)CNC(=O)c2c(C)nn(CCCl)c2C)c1	746223921	IGTLZZGYZLGQIP-UHFFFAOYSA-N	427.914	1.015	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccccc2)C1	746553776	RRHWIWOLBCOGIC-MRXNPFEDSA-N	441.513	1.125	50	20	IDGD	
O=C(CCNS(=O)(=O)/C=C\c1ccccc1)NNC(=O)Cc1cn2ccccc2n1	746702163	QDYGGRIBQIDZKN-RAXLEYEMSA-N	427.486	1.005	50	20	IDGD	
C[C@@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)NNC(=O)CCOc2ccccc2)C1=O	747179246	BRIMUSRXUUNZGK-NRFANRHFSA-N	428.420	1.209	50	20	IDGD	
O=C(O)CCCOc1ccc(S(=O)(=O)NNC(=O)c2ccc(Cl)nc2)cc1F	747606117	FXWGKFASFDSYSC-UHFFFAOYSA-N	431.829	1.741	50	20	IDGD	
Cc1oc(S(=O)(=O)N(C)C)cc1C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	753293014	CHFGZPMDRFAXAG-UHFFFAOYSA-N	442.519	1.036	50	20	IDGD	
CC(=O)c1c(C)[nH]c(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1C(C)C	753494613	ONPHDSHQQXMBNE-INIZCTEOSA-N	443.456	1.793	50	20	IDGD	
C[C@H]1CC/C(=C/C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)C1	753573660	QOZXZFXAQMZYTR-UKJPIOLTSA-N	435.546	1.534	50	20	IDGD	
COc1cccc(OC)c1C=NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	755472171	MZDBMZCKVNZITC-UHFFFAOYSA-N	433.486	1.489	50	20	IDGD	
Cc1sc2nc(CC(=O)NN=Cc3cnc(N4CCOCC4)s3)nc(O)c2c1C	755540538	MOPNUNUISHDKKE-UHFFFAOYSA-N	432.531	2.000	50	20	IDGD	
CCCOc1cc(NC(=O)NNC(=O)[C@@H]2COCCO2)c([N+](=O)[O-])cc1OCCC	755558919	QRGILBBEGFDQFK-INIZCTEOSA-N	426.426	1.741	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccc(NC(=O)NNC(=O)Cc3ccc(F)cc3)c2)CC1	756213158	TYKBNMDYDSODSA-UHFFFAOYSA-N	449.508	1.157	50	20	IDGD	
CCn1cnnc1-c1ccccc1NC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	756513980	CCOHXQRTFYWDJG-UHFFFAOYSA-N	428.474	1.835	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)NNC(=O)COc2ccc(OC)cc2)cc1C	756514867	JTVSGBULWHEGNO-UHFFFAOYSA-N	436.490	1.997	50	20	IDGD	
CC(=O)NCc1ccc(NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1	756554726	POARQXKYFRWMMS-UHFFFAOYSA-N	447.517	1.105	50	20	IDGD	
C[C@@H](NC(=O)OC(C)(C)C)c1ccc(NC(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)cc1	756816688	TUENOQINMMFHTD-TZMCWYRMSA-N	440.522	1.860	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)c2cncc(I)c2)c2ccccc2c1=O	756862449	CLSKEVKBRHGQTD-UHFFFAOYSA-N	449.208	1.008	50	20	IDGD	
CN1C(=O)C[C@@H](C(=O)NNC(=O)C(=O)Nc2ccccn2)[C@@H]1c1ccc(Cl)c(F)c1	759364851	PKBKTHGDIOVZQS-BZNIZROVSA-N	433.827	1.180	50	20	IDGD	
N#CC1=CCN(C(=O)c2ccc(Br)c(S(=O)(=O)N3CCOCC3)c2)CC1	760003055	FFNVZLZCLMYVPU-UHFFFAOYSA-N	440.319	1.766	50	20	IDGD	
CCO[C@@H]1C[C@@H](NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)[C@@]12CCCO2	760141259	HKCMONULQSRVBQ-VIZSFHNOSA-N	445.564	1.256	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccnn2[C@@H](C)C2CC2)cc1	760277443	LHDNGKWJCSMEJB-JSGCOSHPSA-N	427.461	1.610	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)c2cccc(Br)c2I)cn1	760547748	SFQYJDNIPGCUSI-UHFFFAOYSA-N	449.046	1.862	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)c1cc(S(=O)(=O)NC2CC2)ccc1C	761622227	QKMFSLOOANLQED-UHFFFAOYSA-N	449.554	1.998	50	20	IDGD	
CCc1nc(C(=O)NNc2nccc(N3CCOCC3)n2)nn1-c1ccccc1Cl	762867571	IOUKDFPHQVHSNT-UHFFFAOYSA-N	428.884	1.867	50	20	IDGD	
CC(=NNC(=O)[C@@H](C)CN1CCCCCC1)c1c(C)nn(CCS(C)(=O)=O)c1C	763153224	AJRAIPFQGPRCDE-HNNXBMFYSA-N	425.599	1.897	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNS(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-]	763439951	ZATHPOPZQROALF-UHFFFAOYSA-N	436.874	1.863	50	20	IDGD	
CNC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)c2cc(C)nc3ccccc23)cc1	763615973	JPCDKOJLRZXASA-UHFFFAOYSA-N	435.440	1.068	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(OC[C@H]2CCCO2)cc1	763645809	CEPJICCANORQOH-QGZVFWFLSA-N	443.456	1.418	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2cccc(N3CCCCC3=O)c2)c1	763647423	MWHGNJNYUDVGBF-UHFFFAOYSA-N	438.484	1.985	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc3nn(C(C)C)cc3c2)cc1	763660439	AAJOXALUANWLNE-UHFFFAOYSA-N	425.445	1.791	50	20	IDGD	
Cc1ccc(C#N)cc1NC(=O)C(=O)NNC(=O)COc1ccc(Br)cc1	763695637	RMDZYNNPILDFFD-UHFFFAOYSA-N	431.246	1.794	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)n(-c2ccc(F)cc2)n1	763812755	IDKDKSDBPZPXCZ-UHFFFAOYSA-N	436.403	1.356	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccc(Oc2cccnc2)nc1	763838140	OGDXYDNGPPEZOO-UHFFFAOYSA-N	425.376	1.573	50	20	IDGD	
Cc1cn(-c2ccccc2)nc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccc(F)cc1	763871051	CNOVAISBNHUBHO-AWEZNQCLSA-N	425.420	1.873	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2cc(NC(=O)OC(C)(C)C)ccc2C)n1	763892352	ZIIIDPODBROOJZ-UHFFFAOYSA-N	444.492	1.941	50	20	IDGD	
CCOC(=O)Cn1ccc2cc(NC(=O)C(=O)NNC(=O)Cc3ccc(F)cc3)ccc21	763919332	NTVUFUWORJMLSC-UHFFFAOYSA-N	440.431	1.672	50	20	IDGD	
O=C(Cc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1ccc(NC(=O)[C@@H]2CCCO2)cc1	763932862	UBOUQHDYKGOEDE-KRWDZBQOSA-N	444.875	1.786	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)C(=O)Nc1cc(F)ccc1Oc1ccccc1	763999870	XMZUFPFOJIYAAH-LBPRGKRZSA-N	435.433	1.139	50	20	IDGD	
Cc1cccc(Cn2nccc2NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)c1	764006718	TUFSRAKDQQSZCX-UHFFFAOYSA-N	435.440	1.411	50	20	IDGD	
CCNC(=O)COc1cccc(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3c2)c1	764066265	DKMHZJUGBXXYJT-UHFFFAOYSA-N	434.452	1.754	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccc(=O)n(Cc2ccccc2)c1	764132814	QOCCSMRRZVHEMK-UHFFFAOYSA-N	434.452	1.234	50	20	IDGD	
CCNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2ccc(CN(CC)CC)o2)c1	764138620	FYGRDEMHLIGLPU-UHFFFAOYSA-N	429.477	1.271	50	20	IDGD	
COC(=O)CCSc1cccc(NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)c1	764168200	OGAKTBSILJSJJI-QGZVFWFLSA-N	443.481	1.431	50	20	IDGD	
CC(C)CCC(=O)NNC(=O)C(=O)Nc1c(C(=O)N2CCOCC2)oc2ccccc12	764200266	XKIIBFRVFDIVCO-UHFFFAOYSA-N	430.461	1.427	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)C(=O)Nc1ccc(F)c(NC(=O)Cc2ccccc2)c1	764268018	DCVDZZCVVQNBQV-UHFFFAOYSA-N	449.442	1.731	50	20	IDGD	
Cc1ccc(Oc2ccc(NC(=O)C(=O)NNC(=O)COc3ccccc3O)cc2)nn1	764281101	XVAPTBFYHWWASG-UHFFFAOYSA-N	437.412	1.448	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C(=O)Nc1ccc(N2CCOCC2)nc1C)c1ccccc1	764327514	AECFPDHFJRLXKS-KRWDZBQOSA-N	425.489	1.506	50	20	IDGD	
Cc1cc(S(N)(=O)=O)cc(NC(=O)C(=O)NNC(=O)CCCc2cccs2)c1C	764340846	JRNHAGSJUROOES-UHFFFAOYSA-N	438.531	1.121	50	20	IDGD	
Cc1nnc(Sc2ccc(NC(=O)C(=O)NNC(=O)c3cnn(C)c3)c(C)c2)s1	764358919	KKEDRUFXRIQVID-UHFFFAOYSA-N	431.503	1.439	50	20	IDGD	
CC(=O)N1CCCc2cc(NC(=O)C(=O)NNC(=O)CSc3ccccc3O)ccc21	764394005	MLCNARRKKPHZPN-UHFFFAOYSA-N	442.497	1.570	50	20	IDGD	
CCCc1c(NC(=O)C(=O)NN[C@]2(C)CCS(=O)(=O)C2)cnn1-c1ccccc1C	764671778	BEDFILYPOXFFKQ-HXUWFJFHSA-N	433.534	1.270	50	20	IDGD	
CCn1c(NNC(=O)C[C@H]2CN(C(=O)OC(C)(C)C)CCO2)nc2ccccc2c1=O	764717579	SCQNAOVYQPVLIG-AWEZNQCLSA-N	431.493	1.886	50	20	IDGD	
Cn1c(=O)c2c(ncn2CC(=O)NN=Cc2ccc(-c3cccc(F)c3)s2)n(C)c1=O	764812580	MRLZVSSMBCCLNE-UHFFFAOYSA-N	440.460	1.452	50	20	IDGD	
COc1cccc([C@H](O)C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)c1	765176991	QWWVOFQZFDDNSP-NRFANRHFSA-N	446.935	1.347	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)c1c[nH]n2c1nc(=O)c1ccccc12	765313003	JMQDSSWYOFYOAZ-UHFFFAOYSA-N	428.449	1.242	50	20	IDGD	
O=C(Cc1ccccc1OC(F)F)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765731772	BLSVMZJMDAFYSS-UHFFFAOYSA-N	446.454	1.436	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)COc3ccc([N+](=O)[O-])cc3)CC2)cc1	765749199	UPNTYKRSQHEEBS-UHFFFAOYSA-N	441.488	1.247	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNS(=O)(=O)c2cnc3c(Cl)c(C)nn3c2)c1	766309792	HEFRRHLUNMCNAY-UHFFFAOYSA-N	425.854	1.332	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(Cl)c2)cc1NC(=O)CCN(C)C	768238617	RNTWGBIKZDMSGV-UHFFFAOYSA-N	445.907	1.938	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)[C@H](C(C)C)N2C[C@H](C)O[C@@H](C)C2)n[nH]1	768282074	WBDNNMFCCBSQOQ-AVYPCKFXSA-N	429.521	1.980	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)[C@H]1CCCN1C(=O)OCC(F)(F)F	768612509	NUOYTQPASBQNHJ-SNVBAGLBSA-N	439.412	1.705	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)c1ccc(=O)n(-c2ccc(F)cc2)n1	768641616	UCFFFMHXBKTEFS-UHFFFAOYSA-N	432.433	1.541	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2cccc3c2CCN3C(C)=O)c2ccccc2c1=O	769260129	JPSDCHDJOMKZPV-UHFFFAOYSA-N	434.456	1.792	50	20	IDGD	
COC(=O)C1(O)CCN(C(=O)/C(C#N)=C/c2cn(CCC#N)nc2-c2ccccc2)CC1	770249969	IVHYAFCCSOKTIZ-NBVRZTHBSA-N	433.468	1.897	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)NCCCN1CCC[C@@H](C(N)=O)C1	770513369	SWAQDIWHTNNDLY-UONOGXRCSA-N	425.917	1.025	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2cccc(OC)c2F)n[nH]1	770770724	BKIJILROXSCWRF-UHFFFAOYSA-N	427.392	1.633	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2c(C)cccc2SC)c2ccccc2c1=O	770775258	ZDDWULSDMLCODM-UHFFFAOYSA-N	439.497	1.846	50	20	IDGD	
Cc1cc(C)c(S(=O)(=O)NCCC(=O)O[C@H](C)C(=O)NNC(=O)CC(C)C)c(C)c1	771869082	SGNOBAFBYJIQRJ-MRXNPFEDSA-N	441.550	1.405	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)C[C@H]2CSCCN2C(=O)OC(C)(C)C)C[C@@H](C)O1	772374227	NVKUYGCMPASZCX-XHSDSOJGSA-N	444.598	1.376	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1ccc(OCC(F)F)c(C(F)(F)F)c1	772540654	LBOGQRKTOGXFRM-ZETCQYMHSA-N	448.370	1.440	50	20	IDGD	
CC(C)Oc1ccc(S(=O)(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1	773235095	VCLCBZLQLARDNC-UHFFFAOYSA-N	447.922	1.398	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)c2cn(Cc3cccc(F)c3)nn2)C1	773411795	RMQYHUVDVXRZND-HNNXBMFYSA-N	446.483	1.874	50	20	IDGD	
COc1cccc(Cn2nccc2NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2)c1OC	773657133	YNLQTCYEQKDDCC-UHFFFAOYSA-N	440.416	1.939	50	20	IDGD	
CS(=O)(=O)N1CCc2c(NC(=O)C(=O)NNc3ncc(Cl)cc3Cl)cccc21	773680510	RULUGEQCAAKXQS-UHFFFAOYSA-N	444.300	1.792	50	20	IDGD	
CCN1CCN(Cc2ccc(NC(=O)C(=O)NNC(=O)c3ccc(C)c(F)c3)cc2)CC1	773888267	IWVRFUSJNWNXJA-UHFFFAOYSA-N	441.507	1.671	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN[C@H](CN2CCCC2=O)c2ccccc2)cc1OC	774915628	VHQOJPMWSMHHFC-GOSISDBHSA-N	440.500	1.418	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)Nc2ccc(C[C@H]3NC(=O)NC3=O)cc2)cc1	775708430	OPECKFZIZQGXDJ-MRXNPFEDSA-N	427.486	1.691	50	20	IDGD	
COC(=O)N1CCC[C@H]([C@@H](C)NC(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)C1	776244430	NIOPTRNHMYYDSL-NEPJUHHUSA-N	434.501	1.780	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)NCc2cccc(C(=O)NC[C@H]3CCCO3)c2)c1	776618649	DDFCLKNOCMAOLL-GOSISDBHSA-N	446.529	1.825	50	20	IDGD	
C[C@H](CN1CCN(c2ccccn2)CC1)NC(=O)NNc1cccc(S(C)(=O)=O)c1	776620939	CEBTYCNOURAITM-MRXNPFEDSA-N	432.550	1.322	50	20	IDGD	
COc1ccc(Cn2ccc(NC(=O)C(=O)NNC(=O)c3ccc(Cl)nc3)n2)cc1	778715101	YWFPLZMFZMICEH-UHFFFAOYSA-N	428.836	1.388	50	20	IDGD	
COC(=O)c1cc(N2CCOCC2)ccc1NC(=O)C(=O)NNc1ccc(F)cc1F	783345213	XIFVDHWIVQDCHQ-UHFFFAOYSA-N	434.399	1.670	50	20	IDGD	
CCN(CC)CCNC(=O)c1cccc(NC(=O)C(=O)NNc2nccnc2Cl)c1	784777706	GTGHSIBBBALYOL-UHFFFAOYSA-N	433.900	1.283	50	20	IDGD	
CO[C@@H](C)C(=O)Nc1cccc(NC(=O)C(=O)NNc2ccnc(Br)c2)c1	784836782	AEYYWTAEBCVLPC-JTQLQIEISA-N	436.266	1.899	50	20	IDGD	
Cc1ccc(C(=O)NCC2CC2)cc1NC(=O)C(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	785989049	QWZSWMDCTCFKKR-UHFFFAOYSA-N	439.428	1.443	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ccccc2F)cc1S(=O)(=O)N1CCCC1	787550890	ZFJRQTJDAXAQNI-UHFFFAOYSA-N	436.465	1.701	50	20	IDGD	
CC(C)(C(=O)NNC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1)N1CCOCC1	788265534	MUFWSLDXVYDZTA-UHFFFAOYSA-N	434.500	1.806	50	20	IDGD	
CC(C)c1cc(NC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])n(-c2ncccn2)n1	789258259	QDCJVABRFHYVGB-UHFFFAOYSA-N	440.420	1.926	50	20	IDGD	
COc1cc(NNC(=O)CCC(=O)Nc2ccc3c(n2)n(C)c(=O)n3C)ccc1Cl	790175482	JKQRGQPZIRGXTE-UHFFFAOYSA-N	432.868	1.796	50	20	IDGD	
Cc1ccn(C[C@@](C)(O)C(=O)NNC(=O)c2sc(-c3ccccc3)nc2C)c(=O)c1	790484014	CBUNZDVMPOAHFC-OAQYLSRUSA-N	426.498	1.801	50	20	IDGD	
CO[C@H]1CCOc2c(NC(=O)C(=O)NNC(=O)[C@H](C)Oc3ccc(F)cc3)cccc21	790952894	XLDDZMLDAJJOAA-SJCJKPOMSA-N	431.420	1.849	50	20	IDGD	
CCc1c(NC(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)cnn1-c1ccccc1Cl	792482350	CCNKPQQAJWYGHU-JTQLQIEISA-N	428.902	1.179	50	20	IDGD	
COc1ccc(Cn2cc(NC(=O)C(=O)NNc3ccc4c(=O)[nH]ccc4c3)cn2)cc1	793068780	DDHNUCUIKNCAOZ-UHFFFAOYSA-N	432.440	1.863	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)N2CCC[C@H](NS(=O)(=O)c3cccc(F)c3)C2)n1	793228715	PQDZOLKDXQWJEA-HNNXBMFYSA-N	435.481	1.326	50	20	IDGD	
CCn1nc(C)c(CC(=O)NNC(=O)c2cc(-c3ccc(OC)c(OC)c3)[nH]n2)c1C	794392656	IXRJZZRXLSEIJF-UHFFFAOYSA-N	426.477	1.931	50	20	IDGD	
Cc1cc([N+](=O)[O-])cc(S(=O)(=O)NNC(=O)CNC(=O)OCc2ccccc2)c1F	794599373	YRGRRLZUHRLMDA-UHFFFAOYSA-N	440.409	1.278	50	20	IDGD	
CN(C(=O)OC(C)(C)C)[C@@H](C(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)c1cnn(C)c1	794711755	GCLNQHPQWTXKLR-OAHLLOKOSA-N	432.437	1.698	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)[C@@]2(C)CCN(C(=O)OCc3ccccc3)C2)C[C@@H](C)O1	794898435	FQNXYFNOCMJEBS-PNCHPQGNSA-N	446.548	1.682	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CN[C@@H](CO)c2ccc(Br)c(F)c2)c1	795333191	ICCYQFRFRNFSKC-INIZCTEOSA-N	435.253	1.544	50	20	IDGD	
Cc1nc(C#N)c(N2CCC(C(=O)OCC(=O)NNC(=O)c3ccc(Cl)cc3)CC2)o1	796280375	SMWLPJZYBABFCT-UHFFFAOYSA-N	445.863	1.729	50	20	IDGD	
CN(CC(=O)NNC(=O)c1ccccc1)Cc1cn(-c2cccc(Br)c2)nn1	796594314	RVHYOHBDSQUTQO-UHFFFAOYSA-N	443.305	1.923	50	20	IDGD	
CCOC(=O)Oc1ccc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1	800287154	VWCAKVXNXIYPPT-KRWDZBQOSA-N	444.396	1.366	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)CNS(=O)(=O)c2c[nH]c3ncccc23)c2ccccc2n1	803338292	DLFFDRIHRYJVOY-UHFFFAOYSA-N	438.469	1.159	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@H](C(=O)NNc2ccc3c(=O)[nH]ccc3c2)[C@H](C)O)cc1	803433203	KNIOYRQHPSEURT-UGSOOPFHSA-N	430.486	1.008	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cnn(CC(C)C)c2C2CC2)c(OC)c1	806978746	JMIIFVWTZFJKLM-UHFFFAOYSA-N	429.477	1.833	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)C[C@@H]1COCCN1C(=O)OC(C)(C)C	807211286	MMKKLYOATZLKOL-CYBMUJFWSA-N	430.502	1.075	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)c1cccc(NN2C(=O)[C@@H]3CC=CC[C@H]3C2=O)c1	807370621	OUTCLXFQDGWPAH-IAGOWNOFSA-N	444.488	1.515	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NN=Cc1ccc(S(N)(=O)=O)c(Cl)c1	807951764	AHPRDONVRPKNAF-UHFFFAOYSA-N	443.938	1.353	50	20	IDGD	
COC(=O)C(C)(C)CS(=O)(=O)NNC(=O)c1ccc(Br)cc1Cl	808089733	XCYNBHNBHTYSLK-UHFFFAOYSA-N	427.704	1.866	50	20	IDGD	
O=C(CN(CC(=O)NNC(=O)c1ccccc1)c1ccccc1)NNC(=O)c1ccccc1	812446691	CRUYJGJXYMLMLB-UHFFFAOYSA-N	445.479	1.415	50	20	IDGD	
COc1c(F)cc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)cc1F	813033910	QWCPKARABMHJLT-UHFFFAOYSA-N	428.417	1.306	50	20	IDGD	
CCN1CCc2ccc(NC(=O)C(=O)NNc3ccc(S(=O)(=O)N(C)C)cc3)cc21	813034066	XANPQCMZSSZMNA-UHFFFAOYSA-N	431.518	1.401	50	20	IDGD	
CCNC(=O)COc1ccc(NC(=O)NNc2ccccc2S(=O)(=O)N(C)C)cc1	814553670	KQAPEXGLDDMARJ-UHFFFAOYSA-N	435.506	1.600	50	20	IDGD	
CCCN1C(=O)c2ccccc2N2C(=O)CC[C@]12C(=O)NNC(=O)c1ccc(C#N)cc1	814675438	NDSDDJLYOVOGNK-QHCPKHFHSA-N	431.452	1.708	50	20	IDGD	
CNC(=O)c1cc(Oc2cccc(NC(=O)C(=O)NNc3nc(C)cc(C)n3)c2)ccn1	815558252	XALTVJUTDPMPNZ-UHFFFAOYSA-N	435.444	1.722	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)Cc2ccccc2F)nnn1Cc1ccccc1F	815569193	KHYZEHQBBHMWSP-UHFFFAOYSA-N	428.399	1.242	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2cc(Cl)ccc2OC(F)(F)F)CCS(=O)(=O)C1	815590255	PQPJKDWKUZCLIW-CYBMUJFWSA-N	429.804	1.375	50	20	IDGD	
Cc1cn(-c2ccccc2)nc1NC(=O)C(=O)NNc1ccccc1S(=O)(=O)N(C)C	815752119	DEBDGCMTOSXBHM-UHFFFAOYSA-N	442.501	1.513	50	20	IDGD	
O=C(/C=C\c1ccco1)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	863949955	CBSMCCKSOAHZAC-POHAHGRESA-N	433.486	1.094	50	20	IDGD	
CC(=O)c1c(C)[nH]c(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1C	912642952	QPGJJCPWYWONAT-UHFFFAOYSA-N	432.502	1.693	50	20	IDGD	
O=C(Cc1ccc(S(=O)(=O)N2CCOCC2)s1)NNc1ccccc1[N+](=O)[O-]	913105995	IKBAOFGULGFMIN-UHFFFAOYSA-N	426.476	1.363	50	20	IDGD	
COC[C@@H](C)n1c(C)cc(/C=C(/C#N)C(=O)OCC(=O)NCC(=O)N2CCCC2)c1C	913150144	NUHPTGYMQIKAQC-DZGUVLCISA-N	430.505	1.501	50	20	IDGD	
COc1ccccc1NC(=S)NNC(=O)CCC/N=C1/NS(=O)(=O)c2ccccc21	913440912	GSJTUPNIEJZJNC-UHFFFAOYSA-N	447.542	1.532	50	20	IDGD	
CC(C)NS(=O)(=O)c1cc(C(=O)NNC(=O)c2ccc3c(c2)OCCO3)ccc1F	914720427	BHTGPHRCXPWIJB-UHFFFAOYSA-N	437.449	1.358	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)C2CCN(C(=O)COc3ccccc3)CC2)cc1	914857631	LWANFDJXPIDHFU-UHFFFAOYSA-N	440.500	1.572	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NN=C1COc2cc(O)ccc21	915937983	WLDJCIUDOSUXQZ-UHFFFAOYSA-N	445.497	1.259	50	20	IDGD	
O=C(CN1CCC[C@@H]1c1ccc2c(c1)OCCO2)NNC(=O)c1cccc([N+](=O)[O-])c1	916150253	YNFGDSMHDJXMSW-QGZVFWFLSA-N	426.429	1.964	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)N[C@H](C)c1cccc(S(N)(=O)=O)c1	916197458	SSRGGAIJKNDKTO-CYBMUJFWSA-N	436.490	1.203	50	20	IDGD	
O=C(Cc1cccc2ccccc12)NNC(=O)NCCNS(=O)(=O)c1ccccc1	916293766	FVIVSXDITWZTEG-UHFFFAOYSA-N	426.498	1.691	50	20	IDGD	
Cc1ccccc1CN1CCC(NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)CC1	916382295	ZAKMTPIRCPCBMJ-UHFFFAOYSA-N	434.504	1.579	50	20	IDGD	
COCc1ccc(CNC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1	916425805	WHMCHUUYQWGEEZ-UHFFFAOYSA-N	425.533	1.876	50	20	IDGD	
CC[C@H](C)NC(=O)c1cccc(CNC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c1	916476805	MPFJUWKKTUADPQ-AWEZNQCLSA-N	446.529	1.763	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)c2ccc(OC)cc2OC)sc(C)c1C	916563113	WRHFNUWTUKPQPJ-UHFFFAOYSA-N	449.485	1.959	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)c1ccc(NC(=O)NC2CC2)cc1	916645613	BEVVQDIFHWVUGX-ZDUSSCGKSA-N	449.475	1.651	50	20	IDGD	
CNC(=O)CN1CCN(C(=O)/C(C#N)=C/c2cc(C)n(-c3ccc(OC)cc3)c2C)CC1	917525472	VQPYGOPFSOXEAI-XSFVSMFZSA-N	435.528	1.900	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)c2csc(N3CCOCC3)n2)c2cccnc12	917723763	LNDFBFFRMGIGQT-UHFFFAOYSA-N	449.514	1.160	50	20	IDGD	
CCOc1ccc(C(=O)NNS(=O)(=O)c2cccc(C(=O)NC3CC3)c2)cc1OC	917727379	HNAJFFXQEKBZCW-UHFFFAOYSA-N	433.486	1.609	50	20	IDGD	
O=C(NNC(=O)c1ccc(S(=O)(=O)N2CCOCC2)o1)c1ccc2ccccc2c1	918110266	UBBXANQCGRCFCH-UHFFFAOYSA-N	429.454	1.529	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)NCc2ccccc2OCC(=O)NC[C@@H]2CCCO2)n1	918217820	LQWPFUQEACUTTQ-KRWDZBQOSA-N	428.493	1.594	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1OCCO	918676031	HHRNAPMTSNSTSP-UHFFFAOYSA-N	442.516	1.040	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@H]1CCN(c2ccc(F)cc2)C1=O	919690979	XJPZZQXBQKPNQM-OAHLLOKOSA-N	447.492	1.241	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(Br)c3c(c2)OCO3)c1	919812920	NFBYSVLTDRFABL-UHFFFAOYSA-N	441.259	1.656	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NC2CCN(C[C@@H]3CCCO3)CC2)cc1	1318892362	CEAZBTUNMDNFKN-INIZCTEOSA-N	439.538	1.069	50	20	IDGD	
CN(CCO)S(=O)(=O)c1ccc(C(=O)NNC(=O)c2ccc(Cl)cc2Cl)cc1	1326973411	POUYOIHWIUGUMA-UHFFFAOYSA-N	446.312	1.681	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)c2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cn1	1332497020	LZYSDAHDQIGXNW-CQSZACIVSA-N	428.518	1.423	50	20	IDGD	
CCCCC(=O)N1CSC[C@H]1C(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1	1339204552	LEKPEGJWGZWJIA-HNNXBMFYSA-N	442.582	1.873	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)C[C@@H]3CNc4ccccc4O3)C2)C1	1778934888	XGCHUWIFTYRKGP-VWKPWSFCSA-N	437.924	1.333	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2)c1cc(C(F)(F)F)ccn1	1779790347	MVERWBXQPJWSIR-IIDMSEBBSA-N	449.857	1.828	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(Cl)ncn2)C1	1779898868	UOMZJEMZKJBANP-WPKBUWHJSA-N	431.320	1.511	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(N4C(=O)C=CC4=O)cc3)CCO2)C1	1781224751	ZYGDXEGMBDPWCJ-VGSWGCGISA-N	445.903	1.577	50	20	IDGD	
O=C(CSc1ccncc1)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781326786	UMODYRWZLPEOAT-GOEBONIOSA-N	432.315	1.694	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2	1781897700	OGYQALVXBCIGMI-BRXULGCHSA-N	425.751	1.274	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](Br)CC)C1	1781899866	BISYNYZIJDHHFR-KYZVSKTDSA-N	447.374	1.121	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnsn1)C2	1781900338	ARHCXEBMGBFMFV-NORZTCDRSA-N	431.356	1.839	50	20	IDGD	
CNc1nsnc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)Br)C1	1781995330	JHMYTVVYJUJOLY-LYOVBCGYSA-N	446.371	1.491	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(=O)n1C)C2	1781996638	OWAWSWDJNNRPNR-ZBQZNYHESA-N	440.338	1.296	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cn1cc(Cl)cn1)C2	1781997974	LRFOWHZTQFDHSW-SUYBPPKGSA-N	447.761	1.834	50	20	IDGD	
Cn1cc(CC(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@](C)(Cl)CCl)C3)cn1	1782591409	UVRDOXJXVNEWNA-ATZDWAIDSA-N	431.364	1.713	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(Cl)c(O)cc3O)CCO2)C1	1783537992	SESGCUXPDTZXHP-QGHHPUGFSA-N	447.713	1.978	50	20	IDGD	
O=C(CCCCCCCCBr)N1CC[C@@]2(C1)CN(C(=O)C(O)O)CCO2	1785666309	SEJYDDMCGIAVSK-GOSISDBHSA-N	435.359	1.253	50	20	IDGD	
C[C@@H](Oc1cccnc1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCBr)[C@H]2C1	1786407764	UGRTWLMQQMAGDK-OHFALNGGSA-N	440.338	1.614	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CSCc3[nH]cnc3C)[C@H]2C1	1788540871	DUKSMUXGCPEFJH-JKQORVJESA-N	444.985	1.185	50	20	IDGD	
C[Si](C)(C)C#CCCCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21	1788592020	JAHHCCBTSJTFFM-FJIDUMEYSA-N	429.033	1.617	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnn(C)c3Cl)[C@H]2C1	1789080404	CMHVHOQWIYHYLU-XWUBHJNHSA-N	447.761	1.698	50	20	IDGD	
Cc1nccn1[C@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]2C1	1789872549	IVINYLSZUGZMEP-SOOYWPCWSA-N	431.364	1.969	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnn4c3CCC4)C[C@@H]21)[C@H](F)Br	1789925622	RXUIHUSSPIUSDE-LVGORTOPSA-N	429.290	1.113	50	20	IDGD	
COC(=O)C12CC(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)CCBr)C[C@@H]43)(C1)C2	1791015995	IDTBPHDKUHXLOX-HQIQFYROSA-N	443.338	1.094	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3CCOC3)[C@H]2C1	1791757652	ZEVXXNIGZXMURR-WJAIEZPQSA-N	445.466	1.888	50	20	IDGD	
COc1ccccc1C(=O)N1CC(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](F)Cl)C3)C1	1792920249	ZHCNLRUSIQDTFW-BASYENTBSA-N	437.899	1.940	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(Br)c1F)C2)[C@@H](O)CCl	1792979712	BKNFVNAOIZDNAT-FJHTZYQYSA-N	449.704	1.391	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](C)NS(=O)(=O)CC	1793536404	QLJXZMKAUDHRTA-RKQHYHRCSA-N	438.388	1.126	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCc1ccc(F)nc1	1794022182	FIMQHJLBYURNQY-MBMVNNNZSA-N	428.302	1.526	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1ccc(Br)cn1)[C@H](O)CCl	1794440163	USFKTHWSSCDGPS-LXTVHRRPSA-N	430.730	1.625	50	20	IDGD	
O=C(Cc1ccccc1Cl)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1	1796191205	LEOXWOCZPYYVMM-REPLKXPHSA-N	426.709	1.514	50	20	IDGD	
C=C(Oc1ccccc1O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)Br)C2	1796433411	CQVRUKMOOZNFPF-DPYKFYPSSA-N	439.306	1.658	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1c(Br)cnn1C	1796748861	OWUIBSSHCBBNJZ-LYIQGSDWSA-N	433.734	1.403	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2cccnc2nc1O	1799919473	MHFKFZDEGVTTJY-YALNPMBYSA-N	432.908	1.946	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnccn1)C2	1800332429	KQFKOBWSSNJCOS-AHHPBITISA-N	439.422	1.565	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ncccc1Br)C2)C(Cl)Cl	1801017103	NKFWPZHGVKZHLQ-DOFRTFSJSA-N	437.121	1.851	50	20	IDGD	
COC[C@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1nn(C)c(C)c1Br)C2	1802279000	HLUBGDYUYNEUFD-RNJOBUHISA-N	447.761	1.997	50	20	IDGD	
CC[C@H](NC(C)=O)C(=O)NC[C@@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1	1802541041	IQKDSNQHSSNKDD-BQFCYCMXSA-N	439.354	1.787	50	20	IDGD	
COc1ccc(CCC(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)cn1	1803136399	QALMOVVEFBSLPL-LVCYWYKZSA-N	446.935	1.724	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC2(CCN(C(=O)CN3CCOC3=O)CC2)C1	1805383476	LPPSVLGXKOYZFU-CQSZACIVSA-N	430.343	1.701	50	20	IDGD	
C[C@@H](C(=O)N1CCC2(CCCN(C(=O)[C@@H](C)CBr)C2)CC1)n1cnnn1	1805388877	DGAFWEPWIYGHGO-KBPBESRZSA-N	427.347	1.496	50	20	IDGD	
Cn1c(=O)c(C(=O)N2CCC3(CCCN(C(=O)[C@@H](O)CCl)C3)CC2)nc2ccccc21	1805524180	KHVIOPIWBOCXKS-KRWDZBQOSA-N	446.935	1.378	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCC2(CCCN(C(=O)[C@@H](C)NS(=O)(=O)CC)C2)CC1	1805954216	RRTAWSXGFXKYHI-HZPDHXFCSA-N	436.018	1.953	50	20	IDGD	
C[C@H]1CC[C@H](C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)CC1	1807376395	YSGXPWWICKGNJD-PGCKSFNISA-N	449.360	1.907	50	20	IDGD	
CN(C)C(=O)NCC(=O)N1CC[C@H](CNC(=O)[C@](C)(Cl)CCl)[C@@H]1c1cccnc1	1808290192	QLPPHZDJTSVLCW-SIXWZSSISA-N	444.363	1.595	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)c1nn[nH]c1C(F)(F)F	1811562146	DCPAAXVJZCHBKK-LOWVWBTDSA-N	446.817	1.138	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)[C@H]2CCCS2)[C@H]1c1cccnc1	1813074453	RVHNFGGKDVBLAO-QKLQHJQFSA-N	433.578	1.356	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)[C@H](C)n2cncn2)[C@H]1c1cccnc1	1813403020	CYPRKOSJZIKZSF-WMHQRMGPSA-N	435.326	1.724	50	20	IDGD	
O=C(NCCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](O)CCl)n[nH]1)c1ccccc1	1814875796	IRYHXDKVJVCRFG-SJORKVTESA-N	447.923	1.822	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1CCc2nc(NC(=O)CN3CCNC3=N)sc2C1	1814927626	INKLQDRSAWDTPS-JDNHERCYSA-N	433.365	1.131	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1	1815349954	AFUARPSTSSVWLZ-ZIAGYGMSSA-N	435.742	1.456	50	20	IDGD	
Cc1ncc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)[nH]n2)[nH]1	1815403800	JAXNVLUFILNPCK-MRXNPFEDSA-N	437.464	1.059	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@H]1CCc2nc(NC(=O)CCc3nc(N)n[nH]3)sc2C1	1819558170	QRIHAFUBNPMOPW-JTQLQIEISA-N	437.602	1.240	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](COC)NC(C)=O)n[nH]1	1819606175	SEWABLFTTPWJMW-BPUTZDHNSA-N	427.933	1.960	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(B(O)O)cc1)CC2)c1cccc(F)c1	1822041852	DSHSFOKRQPAGQM-INIZCTEOSA-N	439.277	1.502	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@](C)(O)C(F)(F)F)[nH]n1	1822369983	KQKDZOXEJYLWMQ-ZVWUFJHRSA-N	426.823	1.969	50	20	IDGD	
CC(=O)NCC(C)(C)C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1	1822998920	KVBBLERAENNDJX-JOYOIKCWSA-N	449.346	1.908	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1c(C)nn(C)c1C)CC2	1825994941	QUDLCMXQPIFOKM-VXGBXAGGSA-N	425.942	1.973	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)Cc1nnc(C)s1)CC2	1825998727	JBDWEXUPJOXZOE-UWVGGRQHSA-N	429.955	1.712	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H]3CCNC(=O)C3)sc2C1	1826222411	XESLVYLDMJEELF-KEYDSSBGSA-N	433.361	1.818	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CC[C@@H](N)C(N)=O)CC1	1826931475	GOAAWCPZSXXSTH-BMFZPTHFSA-N	445.402	1.230	50	20	IDGD	
C=CCOCCCC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827056045	RAGDFIJVYNLWGP-QFIPXVFZSA-N	442.365	1.583	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3Cc4ccccc4O3)C2)C1	1830362397	UYSWZUQKPVNHSI-XMSQKQJNSA-N	436.936	1.712	50	20	IDGD	
CCOC(=O)C1(C(=O)N2CCOC[C@@]3(CN(C(=O)C(C)(C)CCl)CCO3)C2)CC1	1830365797	HSNUPJPLBUNKGJ-LJQANCHMSA-N	430.929	1.051	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccn3C)C2)C1	1830537343	DHZBCFRXKKUCFA-KSSFIOAISA-N	428.327	1.126	50	20	IDGD	
O=C(c1cc2ccoc2s1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1830723900	TWSSYPNEABJUSP-ACJLOTCBSA-N	428.894	1.164	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CC34CCCN3CCC4)C2)C1	1831653608	BIPZCXHUPJKHDW-GCJKJVERSA-N	442.000	1.869	50	20	IDGD	
Cc1onc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)c1C	1831984293	HGRFJSIZJIMPTF-SJKOYZFVSA-N	430.299	1.145	50	20	IDGD	
C=CCNC(=O)/C=C\C(=O)NC1CCN(C2CCN(C(=O)[C@@H](Cl)CCC)CC2)CC1	1833074662	WXZOCABTQIPVBV-RURPWVQCSA-N	439.000	1.824	50	20	IDGD	
COc1ncc(C(=O)N2CCC(N3CCC(NC(=O)[C@@H](O)CCl)CC3)CC2)cc1F	1833308650	ZIBBDEGIRJYEKN-KRWDZBQOSA-N	442.919	1.014	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3coc(C(C)C)n3)CCO2)C1	1833350593	CZTQTXFFKLYBJE-LIRRHRJNSA-N	429.901	1.122	50	20	IDGD	
CCn1nc(C(=O)N2CCOC[C@]3(CN(C(=O)CCBr)CCO3)C2)cc1C	1834822974	BMHDADGOKRZVCT-SFHVURJKSA-N	443.342	1.066	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@]3(CN(C(=O)CCBr)CCO3)C2)ccn1	1834823344	OYSABMKMXVZVON-SFHVURJKSA-N	426.311	1.245	50	20	IDGD	
CC[C@H](NC(C)=O)C(=O)N1CCC(N2CCC(NC(=O)CO[Si](C)(C)C)CC2)CC1	1835835152	QXCSDIKACBEVDF-IBGZPJMESA-N	440.661	1.324	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC1CCN(C2CCN(C(=O)c3cncc(O)c3)CC2)CC1	1835837442	HPCCETHHABQYQN-UHFFFAOYSA-N	434.613	1.824	50	20	IDGD	
O=C([C@@H]1Cc2ccccc2N1)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836719367	QKXPGUYZLLZTCE-PMACEKPBSA-N	435.952	1.622	50	20	IDGD	
O=C(c1ccn(-c2ccccc2)n1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1838745080	HALAAOPXAOAUFS-FXAWDEMLSA-N	436.871	1.477	50	20	IDGD	
CC(C)n1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)n1	1838790195	POIQTSXJJMYYGV-KBXCAEBGSA-N	443.342	1.317	50	20	IDGD	
Cc1ccn(C)c1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)CBr)C2)C1	1838815505	HOSWSYSFRVCNEC-KXBFYZLASA-N	442.354	1.435	50	20	IDGD	
COc1ccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)c(C#N)c1	1839132950	URYYWWNKFJBZNM-ICSRJNTNSA-N	439.871	1.100	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(OC)c(OC)c3)C2)C1	1839146697	SUPKNUKKEHFFSZ-IERDGZPVSA-N	440.924	1.791	50	20	IDGD	
COc1cccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)c1	1839201524	ABMYUBDJILCEMP-QAPCUYQASA-N	445.285	1.456	50	20	IDGD	
O=C(C1CC2(CCC2)C1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839203511	NKCIYTIUUMLPES-KBXCAEBGSA-N	433.318	1.714	50	20	IDGD	
CC(C)=NO[C@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1	1839226337	LTGCUUZVVOKZOH-JLSDUUJJSA-N	438.352	1.480	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(C)n3)C2)C1	1839963574	OJVCHVBUIRMVPP-KXBFYZLASA-N	440.338	1.634	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3occc3C)C2)C1	1839964068	FJQTWWKPNKKHHZ-RDTXWAMCSA-N	429.311	1.832	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(F)(F)Cl)C2)C1	1839967141	CAVRQPOSKNIONF-GWCFXTLKSA-N	433.677	1.448	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(O)cc3F)C2)C1	1840035130	GWMXSRARJPMKNW-XIKOKIGWSA-N	445.285	1.385	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(N(C)C)cc3)C2)C1	1840154530	YNTAEULEQLDOCD-NQIIRXRSSA-N	439.940	1.076	50	20	IDGD	
C[C@@H](Nc1cccnc1)C(=O)N1CCOC[C@]2(CN(C(=O)C(Cl)Cl)CCO2)C1	1840188068	MBCWYYORQRLHHC-FZKQIMNGSA-N	431.320	1.142	50	20	IDGD	
COC(=O)CCCCCC(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1840234350	NKNJVIHSKUNKOH-OAQYLSRUSA-N	446.972	1.831	50	20	IDGD	
CC(C)N1CCC[C@H]1C(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1840580889	NYPVKBSVKYSIAD-LAUBAEHRSA-N	429.989	1.581	50	20	IDGD	
C#CCO[C@@H](C)C(=O)N1CCCC12CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1841598956	NKLIKTXSIPNWLJ-GJZGRUSLSA-N	427.929	1.360	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)CNC(C)(C)C)C1	1842903209	HNUFMAZUDVSWBR-UHFFFAOYSA-N	432.477	1.725	50	20	IDGD	
COc1c(Cl)cccc1C(=O)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843015309	CEWZWGIULNTJMU-UHFFFAOYSA-N	428.681	1.159	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2cc3ncsc3[nH]2)C1	1844394528	YNMBGODMDLBQOH-WYMPLXKRSA-N	439.501	1.575	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)c2ccc(OC)c(Br)n2)C1	1844613753	LWYKXRXJRKRDEG-NSHDSACASA-N	446.729	1.924	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)CCNC(C)C)C2	1844692366	PFHNODMOLSPVTN-UHFFFAOYSA-N	432.477	1.725	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)c1cc(O)no1)C2	1844692829	OSDBWQXHURGNPF-UHFFFAOYSA-N	430.373	1.345	50	20	IDGD	
O=C(c1ccc(N2CCOCC2)cn1)N1CC2(CCCN2C(=O)[C@H](F)Br)C1	1845216779	KNYCXQYFULFNHW-HNNXBMFYSA-N	441.301	1.426	50	20	IDGD	
Cc1ccn2c(=O)c(C(=O)N3CC[C@H]4[C@@H]3CCN4C(=O)[C@H](C)CBr)cnc2c1	1847500761	FNFWGNYCINYDDA-KBMXLJTQSA-N	447.333	1.849	50	20	IDGD	
CN1CCC[C@H]1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1847960618	NJKPJQFIGPAYLF-VGWMRTNUSA-N	428.961	1.415	50	20	IDGD	
O=C(Cc1cc(Cl)c2c(c1)OCCO2)NNC(=O)c1csc(N2CCOCC2)n1	10766863	BGWKERPEJYVHCD-UHFFFAOYSA-N	438.893	1.408	50	20	IDGD	
CCn1c(SCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)nnc1-c1ccncc1	21179768	NWYXRUGZUHCZCS-UHFFFAOYSA-N	427.446	1.822	50	20	IDGD	
CSCC[C@@H](NC(=O)NNC(=O)CNC(=O)c1cccs1)c1nnc2ccccn12	726086567	LHQUSVSUBYSLKK-GFCCVEGCSA-N	447.546	1.345	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)NCc1ccc(Br)cc1Cl	726247682	PIKPLUGSTCTKNU-UHFFFAOYSA-N	429.658	1.956	50	20	IDGD	
COc1ccc(CN2C[C@H](C(=O)NNC(=O)COc3ccccc3OC)CC2=O)cc1	726621194	QFFUFLYLRNQXPT-MRXNPFEDSA-N	427.457	1.279	50	20	IDGD	
CCOC(=O)C1=NN(c2ccccc2)[C@H](C(=O)NNC(=O)c2ccc3c(c2)OCCO3)C1	727747977	FQLGZKAWCGPHKA-KRWDZBQOSA-N	438.440	1.417	50	20	IDGD	
CCCS(=O)(=O)Nc1ccc(C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1	728021329	GVLXDVJBYZDBFZ-UHFFFAOYSA-N	439.515	1.317	50	20	IDGD	
C=CCOc1ccccc1C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	728214794	SLTJAXVDTNSTAI-UHFFFAOYSA-N	430.530	1.944	50	20	IDGD	
CCOc1ccccc1[C@H](CC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)NC(C)=O	728264173	AZPOSONOQNRJAA-SFHVURJKSA-N	437.460	1.090	50	20	IDGD	
COc1ccc(C(=O)O)cc1S(=O)(=O)NNC(=O)c1cc(F)ccc1Br	728510479	ZWUGRTTUTTVKJT-UHFFFAOYSA-N	447.238	1.918	50	20	IDGD	
CC(C)C(=O)Nc1nc(CC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cs1	728845474	ITUIZNJBWALWGR-UHFFFAOYSA-N	431.522	1.134	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)C1CCN(S(=O)(=O)/C=C/c2ccccc2)CC1	728852162	POVUGARHFKGHBZ-GXDHUFHOSA-N	428.514	1.484	50	20	IDGD	
COC(=O)c1cc(Br)ccc1S(=O)(=O)NNC(=O)Cc1cccnc1	728856452	RODHBIXDMYPOMX-UHFFFAOYSA-N	428.264	1.183	50	20	IDGD	
CCCC(=O)Nc1cccc(CNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1	728946126	AJBIULOHUICBBP-UHFFFAOYSA-N	439.520	1.962	50	20	IDGD	
CC[C@@H](N=c1nn[nH]n1-c1ccccc1)C(=O)NNC(=O)c1cc2c(s1)CC[C@H](C)C2	729282337	RRHHQZLSRCTYMU-XJKSGUPXSA-N	439.545	1.922	50	20	IDGD	
O=C(CCc1nc2cc(C(F)(F)F)ccc2s1)NNC(=O)[C@@H]1CCS(=O)(=O)C1	730457351	HBMABCUEZBRZBS-SECBINFHSA-N	435.449	1.830	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)CCS(=O)(=O)c1ccc2c(c1)OCCO2)c1ccccc1	731996867	GNQABETVOYICTC-QGZVFWFLSA-N	432.498	1.963	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(NC(C)=O)cc1)c1ccccc1	731998875	FUIIUNYYRKKGTN-LJQANCHMSA-N	446.529	1.607	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2c3ccccc3C[C@@H]2C)c1	732082679	JVYDJFANFVGUJZ-ZDUSSCGKSA-N	439.497	1.933	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)NNC(=O)c1csc(N2CCOCC2)n1)c1ccccc1	732235907	LQLVIPKVOXSRCL-CQSZACIVSA-N	432.506	1.149	50	20	IDGD	
CCc1nc(CN2CCC(CNC(=O)NN[C@@]3(C)CCS(=O)(=O)C3)CC2)cs1	732470539	JOCQCUIAAMAJDZ-SFHVURJKSA-N	429.612	1.299	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)N[C@@H]1CCN(c2ccccc2C(N)=O)C1	732594993	JANSXHUTJHOXQG-MRXNPFEDSA-N	425.489	1.336	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)N[C@@H]1CCN(c2ccccc2F)C1=O	732892696	FOAXVPXACSAFKB-CYBMUJFWSA-N	431.380	1.249	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCCNC(=O)NNC(=O)NCc2ccc(Cl)cc2)cc1	732991084	VJWVWNFKZXTVTK-UHFFFAOYSA-N	439.925	1.640	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)C1=NN(Cc2ccc(F)cc2)C(=O)CC1	733108200	LESIEMBQOGVNBI-UHFFFAOYSA-N	434.431	1.951	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2C[C@H](C)N(C(=O)OC(C)(C)C)[C@H](C)C2)n1	733202822	TYEZALWINRYBDQ-OKILXGFUSA-N	425.555	1.471	50	20	IDGD	
CC(C)OCCCn1c(NNC(=O)[C@@H]2CCCN(C(N)=O)C2)nc2ccccc2c1=O	733265632	HYKUAPDFQFBZDX-OAHLLOKOSA-N	430.509	1.445	50	20	IDGD	
Cn1c(NNC(=O)CNC(=O)c2ccc(Br)s2)nc2ccccc2c1=O	733365425	KHGQWRLICXDGHI-UHFFFAOYSA-N	436.291	1.631	50	20	IDGD	
N#CCCn1cc(/C=C(\C#N)C(=O)OCCCN2C(=O)CNC2=O)c(-c2ccccc2)n1	733378366	SXABUOTXDKARDK-SFQUDFHCSA-N	432.440	1.856	50	20	IDGD	
Cc1nn(CCCl)c(C)c1C(=O)Nc1cccc(S(=O)(=O)N2CCN(C)CC2)c1	733889501	AENNNPZWOASBLV-UHFFFAOYSA-N	439.969	1.927	50	20	IDGD	
Cc1cc(NNC(=O)c2ccc(Cl)c(S(=O)(=O)N3C[C@@H](C)O[C@H](C)C3)c2)ncn1	734256307	CUUIDGKAPHIKQI-CHWSQXEVSA-N	439.925	1.993	50	20	IDGD	
CC(=O)NCCNC(=O)CCC(=O)NNC(=O)c1cc(-c2ccco2)nc2ccccc12	735647418	NLGJYHIRNONGLR-UHFFFAOYSA-N	437.456	1.288	50	20	IDGD	
CCOC(=O)N1[C@H](C(=O)NNC(=O)CNC(=O)c2cccs2)CC[C@H]1c1ccc(C)o1	736482997	WNMYAAPWRVHCGQ-KBPBESRZSA-N	448.501	1.889	50	20	IDGD	
NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NNC(=O)COCc3ccccc3)cc2)C1	738497177	NAISFNKVYDPJQT-IBGZPJMESA-N	439.516	1.436	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)c2ccc(CNS(=O)(=O)CC)cc2)cc1	741661247	CPBLULCGWFDDIL-OAHLLOKOSA-N	449.529	1.753	50	20	IDGD	
CC(=NNC(=O)N[C@H]1CCS(=O)(=O)C1)c1ccc(S(=O)(=O)CC(F)(F)F)cc1	741762974	XYUVHRBHEOLDFE-LBPRGKRZSA-N	441.453	1.233	50	20	IDGD	
CNC(=O)COc1cccc(CNC(=O)NNC(=O)c2cccc(Br)c2)c1	743542503	OXMJSTLTKUIKRE-UHFFFAOYSA-N	435.278	1.718	50	20	IDGD	
CN(C[C@@H]1CCCN1C(=O)NNC(=O)CNC(=O)c1cccs1)C(=O)OC(C)(C)C	743577581	DFHUVVQGBYDMPL-ZDUSSCGKSA-N	439.538	1.550	50	20	IDGD	
NS(=O)(=O)c1cccc(CNC(=O)NNC(=O)c2cccc(Br)c2)c1	743687437	QRBXZRXCRQTFIC-UHFFFAOYSA-N	427.280	1.241	50	20	IDGD	
Cc1nn(CCC(=O)NNC(=O)c2cc(Br)ccc2O)c(C)c1[N+](=O)[O-]	743732343	QVHSNVVCRGBHCP-UHFFFAOYSA-N	426.227	1.728	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)NCc2cccc(C(F)(F)F)c2)nc2nc(O)nc(O)c12	746172313	KLAWTKHPVYGSCH-UHFFFAOYSA-N	436.350	1.907	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@@H](C(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)C1	746272518	UFPXNJYOURKITR-ZIAGYGMSSA-N	426.514	1.696	50	20	IDGD	
COC(=O)c1ccsc1N1CC[C@@H](NC(=O)NNC(=O)c2ccc(C#N)cc2)C1=O	746778718	DFGQBHPFABUTPB-CQSZACIVSA-N	427.442	1.156	50	20	IDGD	
O=C(CN1CCN(C(=O)OCc2ccccc2)CC1)NNC(=O)NCCc1cccs1	747366687	KPHPOWPQEHLBDI-UHFFFAOYSA-N	445.545	1.575	50	20	IDGD	
Cc1nn(Cc2cccc(Br)c2)c(C)c1C(=O)NNC(=O)C(=O)N1CCCC1	747906814	BVXLYFRRTMOXSO-UHFFFAOYSA-N	448.321	1.694	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1ccc(C(N)=O)cc1)C(=O)NNc1cccc(Br)c1	748032522	KONXOMMLVLNIGR-SNVBAGLBSA-N	441.307	1.358	50	20	IDGD	
O=C(Cn1cc(Br)c(O)nc1=O)NNc1ccc(F)cc1Br	748076868	RRWDGRWFCWYLQA-UHFFFAOYSA-N	436.035	1.756	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)Cc2cccc([N+](=O)[O-])c2C)cc1OC	748475774	QKYKMNVFVIYFQS-UHFFFAOYSA-N	431.401	1.467	50	20	IDGD	
CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)NNC(=O)[C@@H]1COc2ccccc2O1	749330842	AZQBUEMLMHINDH-XLIONFOSSA-N	440.431	1.342	50	20	IDGD	
C[C@@H](NC(=S)NNC(=O)c1ccc(F)c(S(=O)(=O)N2CCCCC2)c1)C1CC1	751621318	SROZTPLLKNRREX-GFCCVEGCSA-N	428.555	1.908	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2cnn(-c3ccc(Cl)cc3)n2)n1	751821135	XRHHDQBNQAEXDB-UHFFFAOYSA-N	434.865	1.233	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)[C@H]2CC(=O)N(c3cc(OC)cc(OC)c3)C2)c1	752266657	PJJIAGVHDNIWQM-AWEZNQCLSA-N	443.456	1.535	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)N[C@H]1CCCN(Cc2ccccn2)C1=O	753296690	DNNAJQJYRLOWQY-INIZCTEOSA-N	443.529	1.704	50	20	IDGD	
C[C@]1(CCC(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)CCC(=O)N1	753428488	GANPUXOLOPCKNF-OAQYLSRUSA-N	435.956	1.054	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNC(=O)NC[C@@H]2CCN(S(C)(=O)=O)C2)cc1	753660492	LCZXSGWXSHPAKD-HNNXBMFYSA-N	426.539	1.337	50	20	IDGD	
Cc1nccc(NCc2cccc(C(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)c2)n1	755040387	XVQCPGPOXHSZBE-UHFFFAOYSA-N	439.497	1.875	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cc(C(=O)NNC(=O)Cc3cc[nH]n3)ccc2C)cc1	755289803	URQIFYANCPPHLZ-UHFFFAOYSA-N	443.485	1.531	50	20	IDGD	
CCC(=O)NNC(=O)Nc1cc(S(=O)(=O)N(CC)CC)ccc1N1CCOCC1	755393906	YHPZLJZSGJXZRR-UHFFFAOYSA-N	427.527	1.116	50	20	IDGD	
CC(=O)Nc1cccc(NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)c1	755495144	OLZRSSFPDZWCHT-UHFFFAOYSA-N	433.490	1.427	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)Nc1ccc(N2CCCS2(=O)=O)cc1	755591150	AGEIHLXMMWRAAB-UHFFFAOYSA-N	428.474	1.649	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)Nc1nnc(C23CC4CC(CC(C4)C2)C3)s1	756022537	SIRYMVQUOMNITG-OTAOWBFXSA-N	439.563	1.593	50	20	IDGD	
COc1ccc(C(=O)N2CCN(C)CC2)cc1NC(=O)NNC(=O)c1ccc(Cl)nc1	756248420	LANUIGIKLIRBSU-UHFFFAOYSA-N	446.895	1.598	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)Nc2ccc(OCCC(N)=O)cc2)cc1	756509031	JYFUFNMJVMJTTC-CQSZACIVSA-N	428.445	1.764	50	20	IDGD	
COC(=O)c1cc(NC(=O)NNC(=O)c2ccc(O)c(Cl)c2)cc(S(C)(=O)=O)c1	757673779	JLHKLXHQZUGUNR-UHFFFAOYSA-N	441.849	1.702	50	20	IDGD	
CCn1cc(C(=O)NNC(=O)CCN2C[C@H](C)O[C@@H](C)C2)c(=O)c2cc(Cl)ccc21	757715676	PQUWGIGNBJCGTD-KBPBESRZSA-N	434.924	1.935	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2cn(C)c(=O)c3ccccc23)c2ccccc2c1=O	757816787	NIEFWXGPDCUXOQ-UHFFFAOYSA-N	431.452	1.733	50	20	IDGD	
C[C@H]1C[C@@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)CC[C@H]1C	758717685	GRFCKRQKXOWOII-VYDXJSESSA-N	438.550	1.476	50	20	IDGD	
Cc1cc(-n2cncn2)ccc1C(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758785225	CUSXEDPFLJPGQT-UHFFFAOYSA-N	443.508	1.825	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)c1ccc(OC)cc1I	760635229	KUACSFJHNWXROR-UHFFFAOYSA-N	433.246	1.366	50	20	IDGD	
O=C(NNC(=O)c1ccc(-c2ccc(F)cc2)s1)C1=CC=CN2CCS(=O)(=O)N=C12	761700142	HUJXNCOLTMUORL-UHFFFAOYSA-N	446.485	1.813	50	20	IDGD	
CCOCCC1(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)CCCC1	761771527	QHXJWUVUVSBUIW-UHFFFAOYSA-N	440.566	1.868	50	20	IDGD	
O=C(CC1CCSCC1)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	761784381	BOBLRZBQKNTXMU-UHFFFAOYSA-N	427.548	1.002	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)c1cc(NS(C)(=O)=O)ccc1O	762360930	HJMJLJXAXUWTNI-UHFFFAOYSA-N	425.488	1.326	50	20	IDGD	
CC(C)(C(=O)OCC(=O)NNC(=O)c1cccc(C#N)c1)c1ccc([N+](=O)[O-])cc1F	763000489	RFNLFBCYMYQBIK-UHFFFAOYSA-N	428.376	1.888	50	20	IDGD	
O=C(NNC(=O)c1cccnc1)C(=O)Nc1ccnn1Cc1ccc(C(F)(F)F)cc1	763490899	FIUVBBSVCLAZJJ-UHFFFAOYSA-N	432.362	1.745	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)N1CC2(CCCC2)c2c(F)cccc21	763570844	IYLVNAUOEMZQEI-GOSISDBHSA-N	439.443	1.972	50	20	IDGD	
Cc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccccc2)[nH]n1	763614061	PHTQVUJTNFLGKU-UHFFFAOYSA-N	434.456	1.487	50	20	IDGD	
CC(=O)Nc1ccc(Cl)c(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)c1	763674993	STFKIOFTZJOARZ-UHFFFAOYSA-N	429.820	1.335	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)C(=O)Nc2ccc(Cl)cc2Cl)c2ccccc2c1=O	763789819	FHBJKUVNGFKKPR-UHFFFAOYSA-N	434.239	1.640	50	20	IDGD	
CC(C)COc1ccccc1NC(=O)C(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	763791588	XBDSHHHIRYXRPM-UHFFFAOYSA-N	437.456	1.368	50	20	IDGD	
CCOC(=O)/C=C\c1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)cc1	763837277	DIRBGRXMVJWTEB-XGICHPGQSA-N	429.404	1.567	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cccc(OCCN(C)C)c2)c1C	763842208	WWIRECCKQCGQQB-KRWDZBQOSA-N	442.516	1.797	50	20	IDGD	
C[S@](=O)c1ccc(NC(=O)C(=O)NNC(=O)CCSc2ccc(F)cc2)cc1F	763895140	LETQWQSPJWMHHF-LJAQVGFWSA-N	441.481	1.971	50	20	IDGD	
Cc1cn(-c2ccccc2)nc1NC(=O)C(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	763943257	AQBYUUXRCSNHCT-UHFFFAOYSA-N	445.439	1.472	50	20	IDGD	
Cc1ccc(-c2ncco2)cc1NC(=O)C(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	763943331	FRSYIMRUCOGWRX-UHFFFAOYSA-N	446.423	1.941	50	20	IDGD	
CCOC(=O)c1cc(C)sc1NC(=O)C(=O)NNC(=O)c1cc(Cl)ccc1O	763978991	QDWHSWMJJHHLMF-UHFFFAOYSA-N	425.850	1.992	50	20	IDGD	
CN(C)C(=O)COc1cccc(NC(=O)C(=O)NNC(=O)Cc2ccc3ccccc3c2)c1	764081439	JJNXAEIFATXURD-UHFFFAOYSA-N	448.479	1.635	50	20	IDGD	
CC(C)n1cnnc1-c1ccccc1NC(=O)C(=O)NNC(=O)c1ccc(Cl)nc1	764092253	HZSVYEROZBMWSB-UHFFFAOYSA-N	427.852	1.974	50	20	IDGD	
O=C(CC(F)(F)F)NNC(=O)C(=O)Nc1ccc(-c2noc(C(F)(F)F)n2)cc1	764114366	ADCVOOAHYWPNLY-UHFFFAOYSA-N	425.245	1.794	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)c(C)c1	764124597	LLPLDVJJXNQCAL-UHFFFAOYSA-N	435.820	1.306	50	20	IDGD	
CCCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)CCc2ccc(OC)cc2)cc1	764125376	WGZKNDKKSDIWAM-UHFFFAOYSA-N	426.473	1.554	50	20	IDGD	
COC(=O)CSCc1cccc(NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)c1	764152361	DIGQQAFSTJLSBI-QGZVFWFLSA-N	443.481	1.182	50	20	IDGD	
Cc1cc(Br)c(NC(=O)C(=O)NNC(=O)Cc2cccnc2)cc1[N+](=O)[O-]	764268228	MUJKNOCDIHZSKF-UHFFFAOYSA-N	436.222	1.389	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)cc1	764376830	IUJJAYYCIUMQLD-UHFFFAOYSA-N	443.441	1.090	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2cccc([N+](=O)[O-])c2C)n[nH]1	764379070	PRMOLPUSCMJUNB-UHFFFAOYSA-N	438.400	1.702	50	20	IDGD	
COc1cc(F)c(NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)cc1OC	764383006	UJINGKJIGMPDEM-UHFFFAOYSA-N	433.421	1.694	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1cc(Cl)ccc1N1CCCCC1	764399625	KYYRNMKBNSHCSG-ZDUSSCGKSA-N	426.901	1.468	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2cncc(NC(C)=O)c2)cc1OC(C)C	764433218	MDMFTWSFVFBYLA-UHFFFAOYSA-N	429.433	1.236	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NN=Cc1ccc(C)nc1)N(S(C)(=O)=O)CC2	764895982	IYURKDNEYUTELM-SFHVURJKSA-N	446.529	1.806	50	20	IDGD	
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)NNC(=O)c2csc(N3CCOCC3)n2)c1C	765026442	BHUGAPQUTPKBAN-UHFFFAOYSA-N	441.491	1.128	50	20	IDGD	
CCS(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)c1	765317817	WAWYMFLXOWMSOX-UHFFFAOYSA-N	431.486	1.685	50	20	IDGD	
C[C@@H](Cc1ccc(F)c(Br)c1)C(=O)NNC(=O)CNC(=O)c1ccco1	765381810	JOEPVWOBGMDGBM-JTQLQIEISA-N	426.242	1.937	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)COc3cccc([N+](=O)[O-])c3)n[nH]2)cc1OC	765596845	NFTWVSGTDNCDLO-UHFFFAOYSA-N	441.400	1.842	50	20	IDGD	
O=C(Cc1c(F)cccc1Cl)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765732724	JYCLXUAUMOHLCO-UHFFFAOYSA-N	432.883	1.627	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)c1ccc(N2C(=O)CCC2=O)c([N+](=O)[O-])c1	766351323	MWRVNVXKPZMFSO-NSHDSACASA-N	444.375	1.616	50	20	IDGD	
CCC1(CC)[C@H](NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)C[C@H]1OC	767162443	UZXBJYHVRIWKKU-IAGOWNOFSA-N	440.566	1.540	50	20	IDGD	
O=C(COc1ccccc1Cc1ccccc1)NNC(=O)NC[C@H]1CCCS1(=O)=O	767172917	LRMZPWPPDYROEF-GOSISDBHSA-N	431.514	1.564	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN(C(=O)N2CCCC2)C1)c1cc(-c2ccc(F)cc2)[nH]n1	768277746	VQHACMSCHIBJED-HNNXBMFYSA-N	428.468	1.905	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1ccc(-n2cnc3ccccc32)nc1	768398934	UYHRJVMJSUEXEV-UHFFFAOYSA-N	442.483	1.888	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)CN2C(=O)N[C@@]3(CCCC(C)(C)C3)C2=O)cc1	768706482	RCNGVDASONKRCE-JOCHJYFZSA-N	444.488	1.190	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)N1CCN(C(=O)NC(C)(C)C)CC1	770647842	OEIYZKIUAGQZER-CYBMUJFWSA-N	425.917	1.974	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@@H](C)C(=O)NNC(=O)[C@@H](NS(C)(=O)=O)C(C)(C)C	770750799	ZEYXEWBMQCJSRF-SWLSCSKDSA-N	433.958	1.835	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1ccc(=O)n(CCOc2ccccc2Cl)c1	772217115	YLEFHVQZJSKYBY-CYBMUJFWSA-N	435.864	1.683	50	20	IDGD	
CCOC(=O)[C@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNc2ccccc2[N+](=O)[O-])cc1	773648216	PGYJVSLBUBJUGB-LBPRGKRZSA-N	443.416	1.358	50	20	IDGD	
Cc1ccc(S(=O)(=O)NC[C@@H](NCC(=O)NNC(=O)C2CC2)c2ccccc2)c(C)c1	775461913	FNTCQQHYWDFQPU-LJQANCHMSA-N	444.557	1.470	50	20	IDGD	
CC(C)C[C@@H]1OCCC[C@@H]1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	776258232	CRHBVYCRQMSRFV-IRXDYDNUSA-N	426.539	1.475	50	20	IDGD	
Cc1ccc(C)c(S(=O)(=O)NCCC(=O)NNc2cccc(S(C)(=O)=O)c2)c1	776534672	OTZOGJRIVOSDEY-UHFFFAOYSA-N	425.532	1.519	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)c3ccncn3)c2)c(C)c1	778282971	MEMOZYMBTPWLGW-UHFFFAOYSA-N	425.470	1.969	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)CNC(=O)c2cccc(O)c2)cc1	778286224	KJPGDLXAJYXBPO-UHFFFAOYSA-N	440.485	1.004	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(N2CCOCC2)c(C(=O)NNc2cc(Cl)ccn2)c1	778446427	FHPVSIBXEUWWIA-UHFFFAOYSA-N	439.925	1.579	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)N[C@@H]1CCN(c2ccc(Cl)c(Cl)c2)C1=O	779379349	APQUIODDSGILDA-IINYFYTJSA-N	433.292	1.481	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc(C(=O)O)c(F)c(Cl)c1F)c1ccc2c(c1)OCCO2	779830759	IEUJLJNTDMTWKR-UHFFFAOYSA-N	448.787	1.711	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)cc1)C(=O)Nc1ccc(F)cc1I	782832863	UZMKBBUEGDMWST-UHFFFAOYSA-N	443.172	1.536	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ncccc2C(F)(F)F)cc1NS(C)(=O)=O	783120244	QQUGXFWWCNIJLB-UHFFFAOYSA-N	431.396	1.862	50	20	IDGD	
CN1CCc2ccc(NC(=O)C(=O)NNc3ccccc3S(=O)(=O)NC(C)(C)C)cc21	784833905	SCZSPUFIGBTOJJ-UHFFFAOYSA-N	445.545	1.838	50	20	IDGD	
CC(C)(C)OC(=O)N1CCc2ccc(NC(=O)C(=O)NNc3ncc(F)cn3)cc2C1	784949070	CSMGMZZOJVOZEY-UHFFFAOYSA-N	430.440	1.991	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(NC(=O)C(=O)NNc2ncc(F)cn2)ccc1Cl	784950255	WGVJSUBBLDMHMO-UHFFFAOYSA-N	444.876	1.381	50	20	IDGD	
Cn1ccnc(NNC(=O)C(=O)Nc2cc(Br)cc(C(F)(F)F)c2)c1=O	785089511	ACIUQAOODYOIHD-UHFFFAOYSA-N	434.172	1.643	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1cccc(-c2n[nH]c(C)n2)c1	785330559	KBHWCQYBVVCZOU-UHFFFAOYSA-N	444.473	1.274	50	20	IDGD	
CCS(=O)(=O)CCn1cc(C)c(NC(=O)C(=O)NNc2cccc3c2CCCC3)n1	787561458	XUDJYPIHZVPHOG-UHFFFAOYSA-N	433.534	1.587	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NN=C2CCC[C@@H](S(C)(=O)=O)C2)c1	788408240	JHNOLYQXIFXGRS-MRXNPFEDSA-N	429.564	1.790	50	20	IDGD	
Cn1c(=O)c2cc(C(=O)Oc3ccc([N+](=O)[O-])cc3Br)n(C)c2n(C)c1=O	789434940	XUIJKTLJEVPICP-UHFFFAOYSA-N	437.206	1.466	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(-n2cccn2)cc1C	789586386	NMKQKLAYNUSHBT-UHFFFAOYSA-N	437.456	1.744	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)CCNC(=O)c1ccc(Br)cc1	790064058	SGBQTDJGMNQRHW-UHFFFAOYSA-N	430.299	1.506	50	20	IDGD	
C[C@]1(C2CC2)NC(=O)N(c2cccc(CNC(=O)NNC(=O)Cc3ccncc3)c2)C1=O	790892245	BNNCPTUDQBCZEQ-JOCHJYFZSA-N	436.472	1.380	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1cc([C@@H]2CCCOC2)nn1C	790952821	WAVGRRSVDUJSJA-QWHCGFSZSA-N	433.440	1.007	50	20	IDGD	
Cc1ccn(C[C@](C)(O)C(=O)NNC(=O)NCc2cccc(C(F)(F)F)c2)c(=O)c1	791129051	VHERBBJZTVOQAM-SFHVURJKSA-N	426.395	1.457	50	20	IDGD	
CN(C)CC1CCN(c2ccc(NC(=O)C(=O)NNc3nc4ccccn4n3)cc2)CC1	792396043	XAIRVELSJUHSHJ-UHFFFAOYSA-N	436.520	1.589	50	20	IDGD	
CN(C)N(C(=O)c1cc([C@H]2CCN(C(=O)OC(C)(C)C)C2)[nH]n1)[C@H]1CCS(=O)(=O)C1	792848314	FOGSARDXCKSWPS-KBPBESRZSA-N	441.554	1.240	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)N(C)[C@@H](C)c2cccc(N3CCCS3(=O)=O)c2)n1	793228895	UFKYFLQURQPTLS-HNNXBMFYSA-N	431.518	1.977	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C2(NS(=O)(=O)c3cccc(F)c3)CCCCC2)n1	794073083	WFMRZVQRWMEUAN-UHFFFAOYSA-N	434.493	1.972	50	20	IDGD	
CNC(=O)c1cc(Cl)cc(S(=O)(=O)NNC(=O)NCCc2cccs2)c1OC	795301734	JDLHWJZTUFQBQG-UHFFFAOYSA-N	446.938	1.505	50	20	IDGD	
Cc1ccc(-c2cccnc2)cc1NC(=O)C(=O)NNC(=O)[C@H]1COc2ccccc2O1	796992959	YCOVRDJWPMXEHA-HXUWFJFHSA-N	432.436	1.983	50	20	IDGD	
Cc1ccc(N2CCOCC2)cc1NC(=O)C(=O)NNC(=O)CCc1ccccc1O	797534932	HCSDYSRWCVEHEW-UHFFFAOYSA-N	426.473	1.256	50	20	IDGD	
CCOc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccccc1F	799258394	BHXWIKGFSDDMQR-NSHDSACASA-N	434.380	1.686	50	20	IDGD	
CC[C@](O)(C(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)c1cccc(Cl)c1	800320472	BHJIBZKTGFYPJH-LJQANCHMSA-N	435.820	1.850	50	20	IDGD	
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNc1ccc(-n2ccnc2)nn1	804953887	BTPXZPYWYYBPCE-SFHVURJKSA-N	432.488	1.970	50	20	IDGD	
COC(=O)c1cc(C)c(NC(=O)C(=O)NNC(=O)c2cccc(N(C)C)c2)c(Cl)c1	806973442	BJSXVLPJCMNIFG-UHFFFAOYSA-N	432.864	1.901	50	20	IDGD	
O=C(NNC(=O)c1cc(F)ccc1Br)NC1CCC2(CC1)NC(=O)NC2=O	807545312	SHZISKRIFHKPES-UHFFFAOYSA-N	442.245	1.053	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)[C@@H]1CSCN1C(=O)c1ccc(Cl)cc1	808045142	DDVILMBAHLNFBQ-AWEZNQCLSA-N	429.926	1.792	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)C2(c3cccc(Cl)c3)CC(=O)C2)c1	809941227	YTOJEBQFVGHYQJ-UHFFFAOYSA-N	449.916	1.652	50	20	IDGD	
COC(=O)c1c(F)ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)c1F	810386182	PGFBVMOGUJDSEH-SECBINFHSA-N	439.346	1.444	50	20	IDGD	
N#Cc1cc(Oc2ccc(NC(=O)C(=O)NNC(=O)[C@@H]3Cc4ccccc4O3)cc2)ccn1	810386706	NMOGAGVMZYJVQZ-FQEVSTJZSA-N	443.419	1.835	50	20	IDGD	
N#Cc1ccc(S(=O)(=O)NCC(=O)NNc2nc(-c3ccc(Cl)cc3)no2)cc1	810397681	XJRVSNQXKCKVNA-UHFFFAOYSA-N	432.849	1.683	50	20	IDGD	
C[C@H]1C[C@H](NC(=O)NNC(=O)COc2ccccc2C#N)c2ccsc2S1(=O)=O	812649883	ISEQJJOZHDQKJM-FZMZJTMJSA-N	434.499	1.636	50	20	IDGD	
CC(C)(C(=O)NNS(=O)(=O)CCCCN1C(=O)c2ccccc2C1=O)c1ccccc1	814211220	UACKYTOWQQJDBY-UHFFFAOYSA-N	443.525	1.991	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCc2nncn2C1)C(=O)Nc1cc(Cl)ccc1OCC1CCC1	815692114	JNUYEQFODWZUGP-ZDUSSCGKSA-N	446.895	1.459	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1ccccc1-n1cccn1	815752201	IKGIELYERSUECJ-UHFFFAOYSA-N	428.474	1.204	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCO1)C(=O)Nc1ccc(OCC(F)F)c(C(F)(F)F)c1	815779334	AWXGXSDOMTZNIQ-LLVKDONJSA-N	425.310	1.614	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)[C@@H]1[C@H]2CN(C(=O)OC(C)(C)C)C[C@H]21	815890672	NDPDDFUCHISTIR-NHAGDIPZSA-N	426.514	1.552	50	20	IDGD	
O=C(NNC(=O)C1CCN(S(=O)(=O)c2cccnc2Cl)CC1)NC1CCCCC1	818312529	SXZQBBZHWQUQDF-UHFFFAOYSA-N	443.957	1.799	50	20	IDGD	
O=C(CC1CC1)NNC(=O)CN1CCN(Cc2ccc(Br)cc2F)CC1	819114424	IIBYCMIZJTYFLU-UHFFFAOYSA-N	427.318	1.653	50	20	IDGD	
COc1ccccc1NC(=O)COc1ccc(C(=O)N2CC[C@H](B(O)O)C2)cc1OC	864233142	FXWHKSXIGPKAAQ-HNNXBMFYSA-N	428.250	1.410	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)CCc2ccc(S(=O)(=O)NC3CC3)cc2)cc1	913660818	JINYNWFAEOJOJP-UHFFFAOYSA-N	442.497	1.158	50	20	IDGD	
CN(C)[C@H](CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)Cc1ccccc1	915900878	IOYQPMZWRWWFMG-SFHVURJKSA-N	447.561	1.054	50	20	IDGD	
CC(=NNC(=O)Cn1nc(C)cc1C)c1ccc(S(=O)(=O)NCCCC(=O)O)cc1	916342743	AEOSJURNHKTIGW-UHFFFAOYSA-N	435.506	1.183	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1cc(F)cc2nc(S)[nH]c12	917496033	IFJMPPHDOOJOHU-UHFFFAOYSA-N	436.494	1.667	50	20	IDGD	
O=C(NNS(=O)(=O)CCc1ccccc1)c1cccc(S(=O)(=O)N2CCCC2)c1	917717951	OOWAFKAZYMJASJ-UHFFFAOYSA-N	437.543	1.278	50	20	IDGD	
CCNS(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)c2cc(OC)cc(OC)c2)c1	917911351	FTSXOUASSVPEID-UHFFFAOYSA-N	425.438	1.216	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NC[C@H](C)Cn2cccn2)c2ccccc2c1=O	919779026	PZURQSMKYRDYRQ-HNNXBMFYSA-N	425.493	1.673	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@H](C)CN2C[C@@H](C)C[C@H](C)C2)c2ccccc2c1=O	919924585	OMUCUYZLUITPFA-HRCADAONSA-N	428.537	1.727	50	20	IDGD	
CS(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)c2c[nH]c3ccccc23)c(F)c1	919954120	DSFLTCAMQRYCNU-UHFFFAOYSA-N	426.451	1.302	50	20	IDGD	
COc1cc(C=NNC(=O)N[C@@H]2CCS(=O)(=O)C2)ccc1OC(=O)c1ccncc1	920381964	UTGCWFAFYVVTCN-OAHLLOKOSA-N	432.458	1.130	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)[C@H](C)OC[C@H]2CCCO2)c2ccccc2c1=O	921021472	IPKRTHJOQDZULE-JKSUJKDBSA-N	430.505	1.932	50	20	IDGD	
Cc1nn(Cc2ccccc2)c(C)c1C(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	933537116	KVWITRLQTMEQQE-UHFFFAOYSA-N	430.468	1.870	50	20	IDGD	
O=C(NCCN1C(=O)c2ccccc2C1=O)NNC(=O)c1ccc(Br)cc1	1115885528	OOCULYNLRUZRMM-UHFFFAOYSA-N	431.246	1.689	50	20	IDGD	
O=C(NNC(=O)N1CCC([C@H]2C(=O)Nc3ccccc32)CC1)c1ccc(-n2cnnn2)cc1	1338325669	USOJPPGLJZTHID-LJQANCHMSA-N	446.471	1.465	50	20	IDGD	
O=C(c1ccc2cccnc2n1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1778434007	UYEGIZUBJYMNAC-RDTXWAMCSA-N	437.269	1.764	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H]3ON=C(c4ccccc4)O3)C2)C1	1778873533	QIYPUJZSTAKAKQ-SFTDATJTSA-N	447.564	1.403	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)C#CC3(O)CCCCC3)C2)C1	1779066623	BPSSQWSHWXEVGW-OXQOHEQNSA-N	441.366	1.688	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Cl)C2)c1cc(=O)nc2sccn12	1779988429	KUCDRFVODDHPFK-UVBSCNOISA-N	442.900	1.418	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc([N+](=O)[O-])[nH]2)C1	1780234028	QJNVQQHBMFMBMN-XTQGRXLLSA-N	443.298	1.834	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)CC34CCCN3CCC4)C2)C1	1781134094	CWUJJOSVLRKJDI-KXBFYZLASA-N	428.371	1.618	50	20	IDGD	
O=C(c1ccc2nccnc2c1)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781329456	GCXDBGCUAREYJS-YJBOKZPZSA-N	437.269	1.764	50	20	IDGD	
Cc1nn(C)cc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)Br)C1	1781997164	HWKNNKSVHAIIKA-CDHAZOANSA-N	427.343	1.639	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](NC(C)C)C(C)C)C2	1782170677	SOPIRMPNXUYNKU-XKGFGPFHSA-N	432.005	1.777	50	20	IDGD	
O=C(Cc1cccc(C(F)(F)F)c1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1782979458	MEXNXHPHNXOLSB-MAUKXSAKSA-N	434.842	1.678	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)Cc3ccc(F)cc3OC)CCO2)C1	1783883793	KDGNRECXYOYLLO-OXQOHEQNSA-N	428.888	1.461	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CC[C@@H]3CCOC3)C[C@@H]21	1783975031	DTGZIZRXFYGENU-NRKLIOEPSA-N	431.371	1.814	50	20	IDGD	
CN(C)c1ccc(CCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]3C2)cc1	1784095994	QPHGYTFSUKXDDQ-LEAZDLGRSA-N	437.968	1.265	50	20	IDGD	
O=C(C[C@H]1COc2ccccc2O1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Cl)C[C@@H]21	1784391344	CTVNITCUWOFZLX-DPSXKDBOSA-N	426.872	1.731	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3ccc4c(c3)OCO4)[C@H]2C1	1786596505	LEWOCQKGCSMRQN-ZWOKBUDYSA-N	448.592	1.789	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4nn[nH]c4c3)C[C@@H]21	1789872828	ZWOYOGFFGINGOC-LKTHJCGVSA-N	440.331	1.788	50	20	IDGD	
N#Cc1ccc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]3C2)cc1	1789921258	ZFVHGEAMWFTEJQ-OVWQWFNUSA-N	438.297	1.771	50	20	IDGD	
C[C@H](CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]21)c1ccccc1	1790926845	SCCMQLWCVCRECU-HZEGPAAWSA-N	444.576	1.533	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnn4ccc(C)cc34)C[C@@H]21	1791254892	VXZQPYQULQNSDJ-RMRDIRSESA-N	434.924	1.490	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC1(c2ccc(NC(=O)c3cncc(O)c3)cc2)CCC1	1791469751	VOHMSTRQOSOWKW-UHFFFAOYSA-N	425.489	1.908	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CC[C@H]3CCOC3)[C@H]2C1	1791812590	ZVKJEKBWHRDKGI-WOYTXXSLSA-N	431.371	1.814	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)n1ccccc1=O)C2	1792870363	FPJJZIVCGUFKKW-LBKYZSNHSA-N	440.338	1.030	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cccc(Cl)n1)C2	1792870779	UJCGTORERXVWHS-KOFHJDLBSA-N	444.757	1.898	50	20	IDGD	
Cc1nccn1CCCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)CBr	1792873201	OLNHXOSDPBFSTR-SCNOPHJPSA-N	441.370	1.592	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(N2CCOCC2)cn1	1794768129	NRVJUJBLVLXODH-DFGXFYAUSA-N	436.940	1.424	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1CCN(Cc3ccccn3)CC1)C2)[C@@H](F)Cl	1796361549	ITOKNCJWDXQQEK-UKBAYJJMSA-N	438.931	1.418	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C[C@H]1CNc2ccccc2O1	1797677630	JLWKRZQREMAMGF-OYFMXXACSA-N	437.924	1.093	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc(Br)cn1)C2	1799264744	TWGSHDNPVNXYSK-RBNVPPIJSA-N	444.757	1.994	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(C2CC2)cc1	1799778764	HHUPRTQYQLUGLG-RMFSNUHRSA-N	449.511	1.080	50	20	IDGD	
COc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](F)Br)n1	1800159256	FYJOUPGTCKGQOX-QOBXEIRBSA-N	445.245	1.941	50	20	IDGD	
CO[C@@H](C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](Br)Cc1ccccc1	1800435951	GEOCVFQNNAOUBA-JFMONLCZSA-N	439.350	1.617	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3nn[nH]c3c1)C2	1800642944	DOUZVTAJSJECKQ-ZWUHOBOKSA-N	436.310	1.335	50	20	IDGD	
CCCc1onc(C)c1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)Br	1800757693	OGYZRQHKPXLWEO-YGSHXTJESA-N	428.327	1.922	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3ncsc3[nH]1)C2	1800759153	IUMBTEPQGPBYQU-XHSYRHOGSA-N	427.324	1.611	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnc2c(c1)CCNCC2)[C@H](F)Br	1801310065	MIMXHARWMWTJQN-IVSAIRAKSA-N	439.329	1.712	50	20	IDGD	
C[C@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H]1CC[C@@H]3CCC(=O)N3C1)C2	1801968472	WHBBVEZCQFGXNI-PRFSMCDRSA-N	426.355	1.809	50	20	IDGD	
C[C@@H](S)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN(C)NC(=O)NCc1ccccc1)C2	1802295639	VFNACNNIRFTDQT-NRSFXHEJSA-N	433.578	1.289	50	20	IDGD	
COc1ccc([C@H]2C[C@@H]2C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CCC(=O)NN(C)C)cc1	1802334965	UTBBVPKAGYKEPO-QIYLELGZSA-N	442.560	1.810	50	20	IDGD	
CC(C)(CCl)C(=O)NC[C@@H]1CCN(C(=O)Cn2ccncc2=O)[C@H]1c1cccnc1	1802904733	NSMDSMIJXIATIM-LPHOPBHVSA-N	431.924	1.609	50	20	IDGD	
NC[C@H](C(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)c1ccccc1	1803138744	MKJHISWEFUXUOH-FUMNGEBKSA-N	430.936	1.430	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2noc3c2CCCC3)[C@@H]1c1cccnc1)[C@H](O)CCl	1803139785	VUWPMUMAOWDVBM-ZSZQSSIHSA-N	432.908	1.868	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccn3cncc3c2)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803142779	IZGXAUMNKKEIKC-YTQUADARSA-N	427.892	1.649	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)[C@@H](C)NS(=O)(=O)CC)[C@H]1c1cccnc1	1803507157	NRAHMOHNFVAAGH-MXASKKJJSA-N	444.985	1.433	50	20	IDGD	
Cc1nc(O)c(C(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)nc1C	1804870561	NYEVMMLUOSLTFQ-ZMSDIMECSA-N	433.896	1.113	50	20	IDGD	
Cc1nocc1C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1805828786	QWLNRFYHZAEGJG-OXJNMPFZSA-N	428.493	1.071	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)CNC(=O)c2cc(C)on2)[C@@H]1c1cccnc1	1808263854	PZBGKVRYINPCNK-JTDSTZFVSA-N	447.923	1.831	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)C[C@@](C)(O)CC(=O)O)[C@@H]1c1cccnc1	1808278111	OSKOLZWLQLFVBB-AIUZKBQUSA-N	425.913	1.721	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)C[C@](C)(O)CC(=O)O)[C@@H]1c1cccnc1	1808278114	OSKOLZWLQLFVBB-VOGPDBBUSA-N	425.913	1.721	50	20	IDGD	
O=C(CCBr)N1CCCC2(CCN(C(=O)c3cccc(=O)n3O)CC2)C1	1809065287	GLEDJBUTSSFONS-UHFFFAOYSA-N	426.311	1.715	50	20	IDGD	
CN1CCc2cc(C(=O)NC[C@@H]3CCN(C(=O)[C@H](O)CCl)[C@H]3c3cccnc3)ccc21	1809317875	ZJENGHJOFUPCLV-TYPHKJRUSA-N	442.947	1.993	50	20	IDGD	
Cc1ncccc1CCC(=O)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1	1809974839	AEXPXWXLUHLOSA-UHFFFAOYSA-N	449.360	1.547	50	20	IDGD	
COc1cccc(C(=O)N2CCC3(CCCN(C(=O)c4cccc(B(O)O)c4)C3)CC2)c1	1809978057	SMDCWNSVWDFINX-UHFFFAOYSA-N	436.317	1.534	50	20	IDGD	
Cc1cc(C)nc(C(=O)N2CCCC3(CCN(C(=O)c4cccc(B(O)O)c4)CC3)C2)c1	1810326894	DUMUIZVIXDWDMA-UHFFFAOYSA-N	435.333	1.537	50	20	IDGD	
C[C@H](C(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1)C1(O)CCC1	1813067719	BONORVANHBKKIC-MMOPVJDHSA-N	445.564	1.012	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2ccccc2O)[C@H]1c1cccnc1	1813071820	YBEQAXDTJHJGIX-VGSWGCGISA-N	439.516	1.480	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)C(Cl)Cl)[C@@H]1c1cccnc1	1813081779	APVXUAGWZGGKRV-CJNGLKHVSA-N	430.336	1.264	50	20	IDGD	
CS(=O)(=O)CCC(=O)NC[C@@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1	1813574012	KGHSSCOZZSATPN-WMLDXEAASA-N	446.367	1.307	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@H]1CCc2nc(NC(=O)CN3CCOCC3)sc2C1	1814557314	BFDQRZSTOMTFDP-RYUDHWBXSA-N	445.383	1.418	50	20	IDGD	
CC(C)[C@@H](S)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1815240991	XNXZQRLEJCIUFA-SJLPKXTDSA-N	430.339	1.350	50	20	IDGD	
Cn1ccc(CC(=O)Nc2nc3c(s2)C[C@@H](NC(=O)CCBr)CC3)n1	1815545289	MFBFAVIQIZBMJZ-JTQLQIEISA-N	426.340	1.816	50	20	IDGD	
CC(=O)N(C)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](F)Br)[nH]n1	1815582895	JRNHVUVWAQCNCN-DOMZBBRYSA-N	432.294	1.961	50	20	IDGD	
O=C(CCBr)N[C@H]1CCc2nc(NC(=O)c3cnc(O)nc3O)sc2C1	1817082121	XCWHGXCPXGHVOK-ZETCQYMHSA-N	442.295	1.355	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(B(O)O)cc1)CC2)c1ccc(F)cc1	1822178244	NNNHVABFLFUJHE-INIZCTEOSA-N	439.277	1.502	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)Cc2cccnc2)[nH]n1	1822414346	RYRJFSHQQQOMOR-QGZVFWFLSA-N	427.509	1.413	50	20	IDGD	
C[C@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCBr)[nH]n1)n1cnnn1	1822857111	WBXPXERAUIPRMX-PWSUYJOCSA-N	425.291	1.435	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccnc2S)CC1	1823760086	DLFFSKOVHTXGDN-GOSISDBHSA-N	447.605	1.977	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)CCl)CC2)c1cnc2c(c1)CCNCC2	1824635407	JWVUGFYGUHHUII-CJNGLKHVSA-N	449.964	1.052	50	20	IDGD	
CC(C)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnccc1C(=O)NN)CC2	1825140278	SPVAJXHJCAYKMM-LBPRGKRZSA-N	430.534	1.804	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CS(C)(=O)=O)CC2	1825445124	NZMXJFOBWVVMIZ-BDAKNGLRSA-N	438.369	1.273	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(=O)n2O)CC1	1825494178	BZDZJIIPZWYXDV-CVEARBPZSA-N	425.913	1.573	50	20	IDGD	
CCC(=O)N[C@H](C)C(=O)N[C@H]1CCc2nc(NC(=O)[C@H](C)Br)sc2C1	1825636226	RXTXPZXECBZWSZ-AEJSXWLSSA-N	431.356	1.753	50	20	IDGD	
COc1ccnc(C(=O)N[C@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)c1	1826087639	HAQHUGSMAAVJCI-LBPRGKRZSA-N	446.533	1.146	50	20	IDGD	
N[C@@H](Cc1cccnc1)C(=O)N[C@H]1CCc2nc(NC(=O)C(Cl)Cl)sc2C1	1826099366	YJERYEOQERRMLK-QWRGUYRKSA-N	428.345	1.824	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)c2ccc(F)cn2)CC1	1826138446	IGVPDRKGAHFIFX-OAQYLSRUSA-N	439.296	1.448	50	20	IDGD	
Cc1nccn1[C@H](C)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCC(=O)NN(C)C)CC2	1827042395	CUPCADYQEFIDNY-OCCSQVGLSA-N	447.565	1.194	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3nnsc3C3CC3)C2)C1	1830357850	MOZBYTNCQNRWBR-IBGZPJMESA-N	442.969	1.751	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1830732828	BMLSOYGUAIRSHA-BEFAXECRSA-N	447.315	1.018	50	20	IDGD	
C[C@H](Sc1ccccc1)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1	1831149789	IIVUTGBCHWKCFB-RIFZZMRRSA-N	442.965	1.223	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C13CC(F)(C1)C3)CCO2	1831580927	VOPSWCQFXLFGGY-BQPQTXTPSA-N	433.318	1.366	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3c(C)nc4ncccn34)C2)C1	1831647063	OUYMBASNCZJBNH-IIBYNOLFSA-N	449.939	1.515	50	20	IDGD	
Cc1cnn([C@@H](C)C(=O)N2CCC([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)c1	1831876501	GSXOOTYBVPYVKN-ICSRJNTNSA-N	446.596	1.745	50	20	IDGD	
Cc1[nH]nc(C(=O)NC2CCN(C3CCN(C(=O)[C@H](F)Br)CC3)CC2)c1F	1834019086	DKUYUSQGQBDYHL-HNNXBMFYSA-N	448.312	1.733	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)c3ccc(F)s3)C2)C1	1834819707	YSNTYIWXNUOHCV-MRXNPFEDSA-N	435.315	1.742	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3cncnc3)CCO2)C1	1836053174	WAEIZSFFIKUBNU-OALUTQOASA-N	445.347	1.102	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)C(C)(C)NC(C)=O)CC2)CC1	1836879293	JRHZPBCHIRKPRS-QGZVFWFLSA-N	431.961	1.154	50	20	IDGD	
Cn1ccc(C(=O)N2CCC(OC3CCN(C(=O)[C@@H](F)Br)CC3)CC2)n1	1837490055	DPUJQTSOADVABY-OAHLLOKOSA-N	431.306	1.723	50	20	IDGD	
CCOC(=O)/C=C/C(=O)N1CCC(OC2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1837638563	GFTIXZKIKGRBIP-REMYHPOOSA-N	449.317	1.795	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)nc1	1839151083	HOHOMHGWAVXEMF-RTBURBONSA-N	430.332	1.696	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)c(C)o1	1839197571	BFQRLAVQRNJVOD-YOEHRIQHSA-N	433.274	1.657	50	20	IDGD	
CC(=O)Nc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)ccc1C	1839402960	SRRZQLFZPOLPLJ-YLJYHZDGSA-N	441.887	1.558	50	20	IDGD	
CO[C@H](C)C(=O)N1CCOC[C@]2(CN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)CCO2)C1	1839744226	VWCUWBJUEBVLQI-GDYRARJKSA-N	449.454	1.363	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(CO)o3)C2)C1	1839964817	DPSTXDYXNQYFTH-KBXCAEBGSA-N	445.310	1.015	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccncc3)C2)C1	1839965835	MHDAPGJTYKBIRT-QFBILLFUSA-N	440.338	1.254	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3(C(F)(F)F)CCC3)C2)C1	1840152071	WJPMDLWLYBSIBB-BBRMVZONSA-N	442.862	1.429	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4cc[nH]c4c3)C2)C1	1840152379	GWQDOZUVQLJYOF-DYESRHJHSA-N	435.908	1.492	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H]1CCC[C@@H]1C(=O)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1	1841354719	QVTAATZJKUPEOU-KKUMJFAQSA-N	429.945	1.483	50	20	IDGD	
CC(=O)N[C@H](C(=O)N1CCCC12CN(C(=O)[C@H](F)Br)C2)c1ccc(F)cc1	1845006528	AEEDPCQIYZHIML-GJZGRUSLSA-N	444.276	1.897	50	20	IDGD	
CC(C)[C@@H](S)C(=O)N1CC2(CCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)C1	1845038179	AVZXDWZWROZANP-LJQANCHMSA-N	447.605	1.490	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@H]1CN(C(=O)OC(C)(C)C)CC[C@H]1O)C2	1845164928	LKASHXPSZLJUTO-HRCADAONSA-N	443.972	1.825	50	20	IDGD	
O=C([C@@H](O)CCl)N1CC2(CCCN2C(=O)c2cc(Br)ccc2[N+](=O)[O-])C1	1845363944	PYHLQFNACROTIP-ZDUSSCGKSA-N	446.685	1.774	50	20	IDGD	
O=C([C@H](F)Br)N1CC2(CCCN2C(=O)c2nc3cc([N+](=O)[O-])ccc3[nH]2)C1	1845577577	QZSCKEUJWHGNOE-LBPRGKRZSA-N	440.229	1.979	50	20	IDGD	
C[C@H](Sc1ccccn1)C(=O)N1CCCC12CN(C(=O)c1cnccc1C(=O)NN)C2	1846577308	DHBBKVQGNGKTBS-AWEZNQCLSA-N	440.529	1.078	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC2(CCCN2C(=O)COc2cccnn2)C1	1846593955	PCEWFESCOFFFQF-CXUHLZMHSA-N	439.422	1.944	50	20	IDGD	
CCN1CCN(c2ccc(C(=O)N3CC[C@H]4[C@@H]3CCN4C(=O)[C@H](O)CCl)cc2)CC1	1847567765	DBJNUNULZOYOQO-SLFFLAALSA-N	434.968	1.244	50	20	IDGD	
O=C(NCc1ccccc1OC(F)F)NNC(=O)c1csc(N2CCOCC2)n1	10259440	CSZXCZZKSAVYOG-UHFFFAOYSA-N	427.433	1.725	50	20	IDGD	
COc1ccc(C)cc1CC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	14847371	HAGFXKUQIRXCLF-UHFFFAOYSA-N	431.514	1.792	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c(OC)c1OC	15896069	YQJUMLCNYWMLBL-UHFFFAOYSA-N	437.474	1.038	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CCc2c(C)nc3ncnn3c2C)ccc1OC(C)C	27236953	WOHFAXMZYSKPLX-UHFFFAOYSA-N	426.477	1.931	50	20	IDGD	
COc1cc(C=NNC(=O)COc2ccccc2F)ccc1OCC(=O)N1CCOCC1	254509353	FOMBCBHOLVJUJE-UHFFFAOYSA-N	445.447	1.601	50	20	IDGD	
O=C(COCc1nc2ccccc2s1)NNC(=O)c1csc(N2CCOCC2)n1	726089433	PCXQUWYGRMVGFB-UHFFFAOYSA-N	433.515	1.567	50	20	IDGD	
Cc1c(C(=O)NNC(=O)CC(F)(F)F)nnn1C1CCN(C(=O)OC(C)(C)C)CC1	726191048	GDVKNQQVDIEMMJ-UHFFFAOYSA-N	434.419	1.872	50	20	IDGD	
CC(C)NC(=O)C(=O)NNC(=O)c1cc(I)cc(C(F)(F)F)c1	728018000	FMNFDOCFPINOTM-UHFFFAOYSA-N	443.163	1.596	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2ccc(Br)c(F)c2)n1	728731996	ZOSDIBVAFAXBBT-UHFFFAOYSA-N	430.255	1.900	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)NCCOc2ccc(S(C)(=O)=O)cc2)c1	730066758	PAUNADCIFLOMDO-UHFFFAOYSA-N	435.502	1.495	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Cc2cc[nH]n2)cc1S(=O)(=O)N1C[C@H](C)C[C@@H](C)C1	730103006	UPNUIHLUDIXJSK-ZIAGYGMSSA-N	449.533	1.089	50	20	IDGD	
COc1ccccc1C[C@@H](C)CC(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	730656842	ZKEQWFWEVNDMSP-FOIQADDNSA-N	442.468	1.795	50	20	IDGD	
CC(=O)Nc1ccc(NS(C)(=O)=O)c(C(=O)NNC(=O)COc2ccc(C)cc2)c1	731435021	VJKMYFKTMGDDHF-UHFFFAOYSA-N	434.474	1.165	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)c1	731958279	QPLWHBOPTXWPIC-AWEZNQCLSA-N	448.457	1.739	50	20	IDGD	
C[C@@H]1Cc2ccccc2N1Cc1occc1C(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1	732755162	PIJQPQOXGCGZPU-HIFRSBDPSA-N	432.502	1.362	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)NCC1CCN(S(=O)(=O)C(F)F)CC1)c1ccccc1	733044906	ACTIRTOMGPFKSF-HNNXBMFYSA-N	432.493	1.775	50	20	IDGD	
O=C(CCCn1cncn1)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	733124238	YWRAYCYKSKLDDE-UHFFFAOYSA-N	431.456	1.278	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N[C@@H](C)c2nncn2C)cc1	733132848	XWMBNFUGSKMRMY-FBKCMUNRSA-N	448.487	1.347	50	20	IDGD	
Cc1cc(NNC(=O)CN2CCN(Cc3ccc(Br)cc3F)CC2)ncn1	734255683	VBJGMHOAEHMARY-UHFFFAOYSA-N	437.317	1.948	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2cccn2C)c(F)cc1Br	734419118	LBPULCLLOHVBMU-UHFFFAOYSA-N	434.243	1.337	50	20	IDGD	
O=C(NNC(=O)c1cccnc1SCC1CCCCC1)N[C@H]1CCS(=O)(=O)C1	734428630	WGNHKJXERBZBKA-AWEZNQCLSA-N	426.564	1.885	50	20	IDGD	
CN1CC[C@@H](OC(=O)/C(C#N)=C/c2cn(CCC(N)=O)nc2-c2ccc(Cl)cc2)C1=O	734880376	DNEHJOZFVNBJLX-IDKBZEPQSA-N	441.875	1.760	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)Cc2ccc3c(c2)CCCC3)CC1	735117938	JQKLLJVWRXBLHS-UHFFFAOYSA-N	443.573	1.582	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)c2sccc2S(=O)(=O)NC2CCCCCC2)cn1	735471154	REDGIZOUKMRUMD-UHFFFAOYSA-N	425.536	1.558	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)c2ccc(C)c(S(C)(=O)=O)c2)cc1C	736789793	JWZDSFLYXIKLKB-UHFFFAOYSA-N	438.527	1.949	50	20	IDGD	
CN(CCN1CCN(C(=O)OC(C)(C)C)CC1)CC(=O)NNC(=O)c1ccc(F)cc1	738327333	ZWPMKRNWGIHZHD-UHFFFAOYSA-N	437.516	1.071	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)[C@H]1CCN(c2cccc(Br)c2)C1=O	740851432	FAUSZLPVKHSBST-CQSZACIVSA-N	439.310	1.254	50	20	IDGD	
O=C(CN1C(=O)NC2(CCCCC2)C1=O)NNC(=O)NCc1cccc(C(F)(F)F)c1	742459567	MJUFCJJQAHXWNO-UHFFFAOYSA-N	441.410	1.791	50	20	IDGD	
CN(C)C(=O)CS(=O)(=O)c1ccc(C(=O)NNc2ccc(Br)nc2)cc1	743404692	BLYULTAKVAFAAS-UHFFFAOYSA-N	441.307	1.463	50	20	IDGD	
Cc1nn(C)c(C)c1S(=O)(=O)N[C@H](C)C(=O)NNc1ccc(Br)nc1	743405302	GRVCQGXDCNGGDB-SECBINFHSA-N	431.316	1.005	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)N1CCc2ccccc21	743534343	RWYIZCSBFLUQFC-CQSZACIVSA-N	431.518	1.877	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)C2CCC(NC(=O)C3CCCC3)CC2)c1	744922963	UMJATWUUUVFGOT-UHFFFAOYSA-N	440.500	1.728	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)Cc1cn2ccccc2n1)c1ccc(S(=O)(=O)N(C)C)cc1	746754729	DIOCBDFZWVYJOE-CQSZACIVSA-N	444.517	1.219	50	20	IDGD	
COc1ncnc(N)c1C=NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	747627304	GABDLDJUSBJBIN-UHFFFAOYSA-N	429.440	1.590	50	20	IDGD	
Cn1nccc1C(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2Cl)c1	748830764	GIVNRFUSUBLXIM-UHFFFAOYSA-N	433.877	1.949	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)NCc1ccccc1CN1CCC(O)CC1	749589767	IQBQZHNJKPDGJB-UHFFFAOYSA-N	428.489	1.258	50	20	IDGD	
CNC(=O)Cc1noc(COC(=O)/C(C#N)=C/c2cc(C)n(C[C@H]3CCCO3)c2C)n1	750318001	JEWJFPIJNWNGSL-QLGNDSFESA-N	427.461	1.606	50	20	IDGD	
COC(=O)c1cc2c(cc1NC(=O)C(=O)NNc1ccc(Cl)cc1[N+](=O)[O-])OCO2	753841139	LWUWDAKHOHSOMT-UHFFFAOYSA-N	436.764	1.845	50	20	IDGD	
O=C(NCCN1C(=O)[C@@H]2[C@@H](C1=O)[C@H]1C=C[C@H]2C1)NNC(=O)c1c(Cl)cccc1Cl	755150549	VRKDFXJVYFLMRB-NUZBWSBOSA-N	437.283	1.745	50	20	IDGD	
O=C(NNc1ccc(C(F)(F)F)nn1)c1cccc(S(=O)(=O)N2CCOCC2)c1	755182907	QEZCJYICRPMGAI-UHFFFAOYSA-N	431.396	1.273	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c(F)c1	755392309	JABZISTYAVRUAS-UHFFFAOYSA-N	436.465	1.622	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)c(OC)c1	755405152	NFDXCIHFZRKESS-UHFFFAOYSA-N	436.490	1.486	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2cnccn2)cc1S(=O)(=O)N1CCCCC1	755412687	GBSLTYOVOPEUEU-UHFFFAOYSA-N	434.478	1.126	50	20	IDGD	
CCOc1ccc(NC(=O)NNC(=O)CC(F)(F)F)cc1S(=O)(=O)N1CCCC1	755472727	WOQLSYFZUUZQPP-UHFFFAOYSA-N	438.428	1.975	50	20	IDGD	
Cc1oc(C(=O)NNC(=O)COc2ccccc2-c2ccccc2)cc1S(N)(=O)=O	755637810	BIPLGBLKFBSXFO-UHFFFAOYSA-N	429.454	1.742	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)c2cc(Br)ccc2O)cc1-n1cnnn1	755686758	KKUOYXRBBAPHEC-UHFFFAOYSA-N	432.238	1.905	50	20	IDGD	
Cc1c(NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cccc1C(=O)N1CCCC1	756277687	TZAURBCFTYXNQC-UHFFFAOYSA-N	448.483	1.944	50	20	IDGD	
CNC(=O)COc1ccc(NC(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)cc1	756443198	SIEWXSQYRLDELT-UHFFFAOYSA-N	432.433	1.304	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=S)NC[C@H]1CCCCO1	758252989	TZLDDHARVJMYTO-GOSISDBHSA-N	440.013	1.522	50	20	IDGD	
CN(NC(=O)c1ccc(N2CCCC2)nc1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758786225	JPSWHPHCWPPBCC-UHFFFAOYSA-N	432.525	1.931	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)NCC[C@@H](O)c1ccc(Cl)c(Cl)c1	758957791	QIQNCFRXLYDFSA-CYBMUJFWSA-N	429.260	1.770	50	20	IDGD	
C[C@H](NC(=O)OC(C)(C)C)[C@H]1CN(C(=O)NNC(=O)COCc2ccccc2)CCO1	760775442	GGOHTPYAMQDWMO-DOTOQJQBSA-N	436.509	1.558	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)NCc1ccc(Cn2cncn2)cc1	761656206	HUJIIZVZGMZPCV-UHFFFAOYSA-N	426.502	1.958	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)Cc1c(C)nc2c(c(O)nn2C)c1C	762371283	UXYORJVABMLIRP-UHFFFAOYSA-N	429.502	1.782	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)[C@H]2CC(=O)N(c3ccc4c(c3)OCCO4)C2)n1	762912452	KBIPAXDXEOIECN-AWEZNQCLSA-N	426.477	1.590	50	20	IDGD	
CCCCS(=O)(=O)N1CCC[C@@H]1C(=O)NNC(=O)c1cc(-c2ccc(C)cc2)[nH]n1	762955070	MOEJRPHEUVKRTE-GOSISDBHSA-N	433.534	1.740	50	20	IDGD	
Cc1nn(CC(F)(F)F)c(C)c1CC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	763280869	FJHWEVGKOQIGCR-UHFFFAOYSA-N	436.394	1.313	50	20	IDGD	
CCC(=O)NNC(=O)C(=O)Nc1cc(S(=O)(=O)N(CC)CC)ccc1N(CC)CC	763440886	CGIYWYAWIWORSE-UHFFFAOYSA-N	441.554	1.059	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(F)cc2)c1	763509938	XAQRSECAQDJFSA-UHFFFAOYSA-N	436.465	1.256	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(S(=O)(=O)N(C)C3CC3)cc2)c(C)o1	763586098	KATYCTPPKWGQCW-UHFFFAOYSA-N	434.474	1.079	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)C(=O)Nc2ccccc2-n2cncn2)c1	763598428	YDTBPNMHSZTNBH-UHFFFAOYSA-N	436.472	1.864	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(NC(=O)C(C)C)c2)cc1	763660376	BBZYNHLGJUVLDB-UHFFFAOYSA-N	428.445	1.455	50	20	IDGD	
O=C(NNC(=O)c1cc2c(s1)CCC2)C(=O)Nc1cccc(N2CCCS2(=O)=O)c1	763784656	FXQVHPLXIONVNT-UHFFFAOYSA-N	448.526	1.176	50	20	IDGD	
Cc1nc(-c2ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc3ccccc3F)cc2)n[nH]1	763866287	VJDNHTKZASUSLS-LLVKDONJSA-N	426.408	1.473	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccccc2N2CCOC2=O)cc1OC	763902269	UKDINVSDJADXKI-UHFFFAOYSA-N	442.428	1.450	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)C(=O)Nc1cccnc1OCC(F)F	763950083	SNAQVVHNMSMXPU-UHFFFAOYSA-N	446.370	1.017	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)C2=S=C3CCCCCC3=C2)n(C2CCOCC2)n1	763975123	DPGRQXVJKACMQG-UHFFFAOYSA-N	445.545	1.611	50	20	IDGD	
CC(=O)Nc1cc(NC(=O)C(=O)NNC(=O)c2cn(C)c3ccccc23)c(F)cc1F	763982102	WYQZEMBWPOWMFT-UHFFFAOYSA-N	429.383	1.815	50	20	IDGD	
CN(Cc1cccc(NC(=O)C(=O)NNC(=O)Cc2ccsc2)c1)C(=O)C(F)(F)F	764033617	LWJPRCFGFGAMDF-UHFFFAOYSA-N	442.419	1.597	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccn(Cc4ccccn4)n3)n[nH]2)cc1	764111184	NPJORQWOMNSREZ-UHFFFAOYSA-N	444.455	1.425	50	20	IDGD	
O=C(CC(F)(F)F)NNC(=O)C(=O)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1	764114965	ITMYLWKHCHMGKT-AWEZNQCLSA-N	438.410	1.368	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2c(Cl)cccc2Cl)cn1C	764221775	ZQPCAFWAKRDSNN-UHFFFAOYSA-N	427.244	1.908	50	20	IDGD	
Cc1ncsc1C(=O)NNC(=O)C(=O)Nc1nc2cc3c(cc2s1)OC(F)(F)O3	764247625	UZPQUDSEXZAYDN-UHFFFAOYSA-N	441.397	1.782	50	20	IDGD	
Cc1ccc(N2CCOC2=O)cc1NC(=O)C(=O)NNC(=O)CCc1ccccc1O	764288719	LJMLLKCHRPTCGB-UHFFFAOYSA-N	426.429	1.376	50	20	IDGD	
CCCS(=O)(=O)N1CCCC[C@@H]1C(=O)NNc1c(F)cc(C(=O)NC2CC2)cc1F	764328358	AOMIUIANMQPWJS-MRXNPFEDSA-N	444.504	1.894	50	20	IDGD	
CCOC(=O)N1[C@H](c2ccc(C)o2)CC[C@@H]1C(=O)NNC(=O)CNC(=O)c1cccnc1	764345180	OQWJUWRVAJFWDL-JKSUJKDBSA-N	443.460	1.222	50	20	IDGD	
Cc1nc(C)n(-c2ccccc2NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)n1	764350943	NBCSKCSNKPYQKU-UHFFFAOYSA-N	444.455	1.470	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)C(=O)Nc2ccc(OCc3cccc(F)c3)c(F)c2)cn1	764358208	GMGAXHYYTVMYAM-UHFFFAOYSA-N	429.383	1.677	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NN=Cc3cnc(Cl)c(C)c3)CC2)cc1	764817452	PUKLYCODWRFLHG-UHFFFAOYSA-N	449.964	1.808	50	20	IDGD	
Cn1c(=O)c2c(ncn2CC(=O)NN=C2CCC[C@H]2c2ccc(Cl)cc2)n(C)c1=O	764819880	WVDSZMPBKDDADP-AWEZNQCLSA-N	428.880	1.527	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NN=Cc3c[nH]c4ncccc34)CC2)cc1	764820522	ZZKJQBXKFJWSFT-UHFFFAOYSA-N	440.529	1.328	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1CNC(=O)NNc1ccccc1S(C)(=O)=O	765644178	QVZGMBXENZQDGX-UHFFFAOYSA-N	426.520	1.167	50	20	IDGD	
CC(C)C[C@@H](NC(=O)OCc1ccccc1)C(=O)NNc1nc(O)c2cnn(C)c2n1	767476335	UPXHTNPAFCYCDT-OAHLLOKOSA-N	427.465	1.853	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1cnn(C(F)F)c1	768229500	LWGIEGSSSAXGCW-UHFFFAOYSA-N	430.437	1.437	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)NC[C@]1(N2CCOCC2)CCSC1	770298092	IKVGEBXGJAXEMN-AUUYWEPGSA-N	442.969	1.646	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)Nc1ccn(CCS(C)(=O)=O)n1	770511792	CIPKKQHVVMYGEV-NSHDSACASA-N	429.886	1.201	50	20	IDGD	
CCc1nc(-c2ccc(C(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)cc2)n[nH]1	770748233	ZYJNAVCMWMSKBV-UHFFFAOYSA-N	442.501	1.359	50	20	IDGD	
Cc1cccc(F)c1NNC(=O)C(=O)Nc1cccc(CN2CCC(C(N)=O)CC2)c1	770822129	VVQKWBXVTOPTSV-UHFFFAOYSA-N	427.480	1.913	50	20	IDGD	
CC(C)[C@@H](C(=O)NNC(=O)COc1ccc(Br)cc1)N1CCCS1(=O)=O	772630626	MLQQNZODPBLGRB-HNNXBMFYSA-N	448.339	1.035	50	20	IDGD	
O=C(NNC(=O)c1ccc2ccccc2n1)Nc1cnn(Cc2nnc3n2CCCC3)c1	772635895	JWFOPAZMUFXYQE-UHFFFAOYSA-N	431.460	1.874	50	20	IDGD	
CS(=O)(=O)Nc1ccc(OCCNC(=O)NNC(=O)CCCc2ccccc2)cc1	773541971	LDBCXJONDMUPBP-UHFFFAOYSA-N	434.518	1.790	50	20	IDGD	
N#CC1=CCN(C(=O)[C@H](CCC(N)=O)NS(=O)(=O)c2cccc(C(F)(F)F)c2)CC1	773544936	OTWYEDFBHNIVJI-HNNXBMFYSA-N	444.435	1.300	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNc2cccc(C#N)c2)cc1S(=O)(=O)N(C)C	773685502	MDMZODBXDMKLBL-UHFFFAOYSA-N	431.474	1.289	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccc(C(=O)NC2CC2)cc1	774009536	QGOBECWUSLGBKL-GFCCVEGCSA-N	444.875	1.786	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2ccc(OC)cn2)c1	775090777	YKKKOODTGBFHOX-UHFFFAOYSA-N	435.506	1.265	50	20	IDGD	
O=C(NNC(=O)c1cc2c(s1)CCCCC2)N[C@H]1CCO[C@]2(CCS(=O)(=O)C2)C1	776076510	MDYXZRDTYXYLPV-IFXJQAMLSA-N	441.575	1.697	50	20	IDGD	
COC1(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)CCCCC1	776188232	AHTPASFHMBROON-UHFFFAOYSA-N	438.550	1.764	50	20	IDGD	
CC(C)c1ncc(Cl)c(C(=O)N2CCN(S(=O)(=O)CBr)CC2)n1	777777515	KWFAYYRGZQOAQP-UHFFFAOYSA-N	425.736	1.693	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)[C@@H]2CCCN2C(=O)c2ccc3c(c2)OCO3)nc1C	778424658	ZFJUYFYOIOSFDB-HNNXBMFYSA-N	441.444	1.438	50	20	IDGD	
Cc1ccc(CNC(=O)NNC(=O)CNC(=O)OC(C)(C)C)c(OC[C@@H]2CCCO2)c1	778702812	UFCHQKDNUQBVBF-INIZCTEOSA-N	436.509	1.908	50	20	IDGD	
COC[C@@H](C)n1ccc(NC(=O)C(=O)NNC(=O)c2ccc(F)cc2Br)n1	778712408	HCOJESUFMFLPKK-SECBINFHSA-N	442.245	1.392	50	20	IDGD	
NS(=O)(=O)c1ccc(CC(=O)NNc2ccc([N+](=O)[O-])cc2Br)s1	779146932	NNMURLWHLXAXSJ-UHFFFAOYSA-N	435.281	1.752	50	20	IDGD	
O=C(NNc1ncncc1Cl)[C@H]1CCC[C@H](C(=O)NNc2ncncc2Cl)C1	781824681	GCSFDQRQEGWBLI-UWVGGRQHSA-N	425.280	1.966	50	20	IDGD	
CCC(=O)c1cccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)c1	783258406	HZAQRMKGJAPCKD-UHFFFAOYSA-N	433.490	1.443	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1ccccc1N1CCCCC1	784004325	WJRUJBPLFWFHCO-UHFFFAOYSA-N	429.502	1.254	50	20	IDGD	
Cc1coc(-c2cc(NC(=O)C(=O)NNC(=O)CNC(=O)c3ccco3)ccc2C)n1	784004500	PAMKENPNRTYLQE-UHFFFAOYSA-N	425.401	1.067	50	20	IDGD	
CSc1cc2c(cc1NC(=O)C(=O)NNc1cccc(S(C)(=O)=O)c1)OCCO2	784844863	RSQLHWSCQMPAAL-UHFFFAOYSA-N	437.499	1.665	50	20	IDGD	
CS(=O)(=O)CCOc1ccc(Cl)cc1NC(=O)C(=O)NNc1ccc(Cl)nc1	784869653	DDBQRQHSBISEJO-UHFFFAOYSA-N	447.300	1.894	50	20	IDGD	
CCC(=O)Nc1ccc(NC(=O)C(=O)NNc2c(OC)cccc2S(C)(=O)=O)cc1	785330468	IDXIFKXRNFBUIO-UHFFFAOYSA-N	434.474	1.529	50	20	IDGD	
CC(=O)N[C@H](CC1CCC1)C(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	787515920	ROMHUANOGXKDRF-MRXNPFEDSA-N	425.530	1.317	50	20	IDGD	
Cn1nc(-c2ccc(Cl)s2)cc1NC(=O)C(=O)NNC(=O)[C@@H]1Cc2ccccc2O1	787542442	KFCFBBHFJDLQKY-ZDUSSCGKSA-N	445.888	1.892	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)c3cncn3C)c2)cc1	788267779	PIBGTQXUONTLTQ-UHFFFAOYSA-N	429.458	1.304	50	20	IDGD	
COc1cc(NNC(=O)C(=O)Nc2ccc(CNS(C)(=O)=O)cc2)ccc1Cl	789797273	SERSUAFJLWYQLV-UHFFFAOYSA-N	426.882	1.480	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@@H](NC(=O)C(F)(F)F)C(C)C)cc1Br	789949612	SAQNBZOWYPMQOD-NSHDSACASA-N	440.216	1.922	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)nc1Br	793022886	DPVFBDDQAAQPDP-LBPRGKRZSA-N	435.234	1.078	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2O1)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1	793026275	PNMKNRWFCXYHCR-CQSZACIVSA-N	449.217	1.447	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)NCC2(S(C)(=O)=O)CC2)c2ccccc2c1=O	793270312	NMDLUSXATVZNLC-UHFFFAOYSA-N	449.533	1.108	50	20	IDGD	
CCNC(=O)N(C)c1cccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)c1	796992629	UJWQHAPIIAXVOZ-UHFFFAOYSA-N	449.471	1.642	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNC(=O)C(=O)Nc1c[nH]nc1-c1ccccc1	797369395	UTUFVCNJDPDWDL-UHFFFAOYSA-N	436.428	1.089	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2ccccc2F)cc1OCC	798149213	WTLVVAFQOOFFLX-UHFFFAOYSA-N	439.465	1.363	50	20	IDGD	
CCn1ncc2cc(C(=O)OCC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)c(C)nc21	799575112	PVGUZHNEGRRAIA-UHFFFAOYSA-N	426.389	1.286	50	20	IDGD	
Cc1ccc(OCc2ccccc2)c(NC(=O)C(=O)NN[C@]2(C)CCS(=O)(=O)C2)c1	799836091	WBJQBNIBOWERJF-OAQYLSRUSA-N	431.514	1.711	50	20	IDGD	
C[C@H](Sc1ccccc1C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)C(N)=O	801156664	AOILHUCECMRRRK-NSHDSACASA-N	425.511	1.121	50	20	IDGD	
C[C@@H](CCNS(=O)(=O)c1ccccc1)NC(=O)NNC(=O)Nc1ccc(N(C)C)cc1	801797131	WSOWQGGUXZLGSX-HNNXBMFYSA-N	448.549	1.845	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)NNC(=O)Nc2cc(OC)c(Cl)cc2OC)co1	802077763	ZMQRYDKSGAGJBN-UHFFFAOYSA-N	432.842	1.325	50	20	IDGD	
CC(C)(C(=O)N1CCN(S(=O)(=O)CBr)CC1)c1cc(F)cc(C#N)c1	803038397	RHWXCQJWSNXQNZ-UHFFFAOYSA-N	432.315	1.801	50	20	IDGD	
COCC1(C(=O)NNc2ccc(-n3ccnc3)nn2)CCN(C(=O)OC(C)(C)C)CC1	804955699	QJARNBPURAMGTQ-UHFFFAOYSA-N	431.497	1.769	50	20	IDGD	
O=C(NNc1nccnc1C1CCC1)c1cc(S(=O)(=O)N2CCOCC2)ccc1F	805470296	OUWOFIBGUJDEMP-UHFFFAOYSA-N	435.481	1.661	50	20	IDGD	
COC[C@H](C)Oc1ccc(Cl)cc1NC(=O)C(=O)NNc1ccc(-n2ccnc2)nn1	807429321	TYDZAUIXRPXGNZ-LBPRGKRZSA-N	445.867	1.811	50	20	IDGD	
Cc1ccc(Sc2nsc(NC(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)n2)cc1	810247680	WBVGSUWVZOXESV-SNVBAGLBSA-N	427.533	1.585	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NN=C2CCN(C(N)=O)CC2)c1	812376127	PLPOAJRUZYOBOM-UHFFFAOYSA-N	445.501	1.756	50	20	IDGD	
C[C@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)[C@@H]1OCCc2sccc21	814210625	HSMAHVZPQMRATH-SJCJKPOMSA-N	437.543	1.710	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1cccc(N2CCCC2=O)c1	815752193	HSBWRPXUPRFDCO-UHFFFAOYSA-N	445.501	1.146	50	20	IDGD	
Cc1nnc(NNC(=O)c2cccc(S(=O)(=O)N3CCCc4ccccc43)c2)nc1O	817281587	MNDRWAOFJXYMTD-UHFFFAOYSA-N	440.485	1.784	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(C(=O)NNC(=O)CNc2cccc(OC)c2)cc1	825786811	YVBXCHJJWMEXKM-UHFFFAOYSA-N	434.518	1.599	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccc3c(c2)OCO3)CC1)NNC(=O)c1cccc(Cl)c1	897571913	BDFNZOUAOJQMMF-UHFFFAOYSA-N	444.875	1.288	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)CN2C(=O)N[C@]3(CCCC[C@@H]3C)C2=O)cc1OC	913069824	PWABYKRSSIDCSL-FPTDNZKUSA-N	446.504	1.746	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(/C#N)C(=O)O[C@H](C)C(=O)N2CCC[C@H](C(N)=O)C2)c1C	913150252	QQHMEDGSGSJBTA-FEYMEMCDSA-N	444.532	1.875	50	20	IDGD	
CCc1c(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cnn1-c1ccccn1	915059971	MIZWDWNABMTKAP-UHFFFAOYSA-N	442.501	1.155	50	20	IDGD	
COCCNC(=O)CNC(=O)C(=O)Nc1ccccc1S[C@H](Cl)C(F)(F)F	915744591	DZPCHNRPTVJQDM-AWEZNQCLSA-N	427.832	1.723	50	20	IDGD	
COc1cccc(C[C@@H](C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)n2nnnc2C)c1	915800035	JGTOLEISBKKZRA-KRWDZBQOSA-N	425.405	1.143	50	20	IDGD	
COc1cc([C@H](C)NC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc(OC)c1OC	916483789	XLWOEOKQGQMSDR-KPZWWZAWSA-N	431.445	1.944	50	20	IDGD	
CCOc1ccc(/C=C(\C#N)C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1	916599751	ZZEQIVNQKVFMQZ-MHWRWJLKSA-N	438.396	1.905	50	20	IDGD	
CC(C)(C)C(=O)NNC(=O)c1ccc(NC(=O)C[C@H]2SC(N3CCCC3)=NC2=O)cc1	917181512	NQGYREJCLUHJFO-OAHLLOKOSA-N	445.545	1.916	50	20	IDGD	
C=CCNC(=O)c1cccc(S(=O)(=O)NNC(=O)c2ccc(OCC)c(OC)c2)c1	917727363	GZQKEPYNVITMOS-UHFFFAOYSA-N	433.486	1.633	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(Br)cc1Br)c1cnccn1	917732038	JMUGSGQAGAAHSR-UHFFFAOYSA-N	436.085	1.625	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cn(C)nc2C(F)(F)F)cc1OC	919461594	JBZXFHGNBMFWFU-UHFFFAOYSA-N	430.339	1.074	50	20	IDGD	
O=C(NNC(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1)N[C@@H]1CCS(=O)(=O)C1	919885928	PWHFGOYFMRFPLZ-OAHLLOKOSA-N	447.473	1.338	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)c2cc(S(=O)(=O)NC(C)C)ccc2F)cc1	920012593	WJGKBNUHWMQAAE-UHFFFAOYSA-N	437.493	1.915	50	20	IDGD	
COc1cc(C(=O)NNC(=O)N[C@H](CC(=O)N(C)C)c2ccccc2)cc(OC)c1OC	920047382	RHTIQLYNVPTCAQ-MRXNPFEDSA-N	444.488	1.876	50	20	IDGD	
O=C(CN1CCCC1=O)NNC(=O)c1nc(-c2cccs2)n(-c2cccc(F)c2)n1	920436191	YGHRJGAVONKTIM-UHFFFAOYSA-N	428.449	1.518	50	20	IDGD	
C[C@@H]1CN(S(=O)(=O)c2cc(C(=O)NNC(=O)NC3CC3)ccc2Cl)C[C@@H](C)O1	920766528	PHPXRPRLFRIXPS-GHMZBOCLSA-N	430.914	1.244	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)[C@H](CC(C)C)N2C(=O)[C@H]3CC=CC[C@H]3C2=O)c1	929085602	GJLIHXQIKJXCGC-OTWHNJEPSA-N	443.500	1.831	50	20	IDGD	
Cn1ccc(NNC(=O)C2CCN(S(=O)(=O)c3cccc(C(F)(F)F)c3)CC2)n1	1256184575	OHDHLFRAQFAPMC-UHFFFAOYSA-N	431.440	1.983	50	20	IDGD	
COC(=O)c1ccc(S(=O)(=O)NNC(=O)c2ccc(OC)cc2)c(Br)c1	1318886503	BNGPSCKADJHCGX-UHFFFAOYSA-N	443.275	1.868	50	20	IDGD	
COC(=O)C(=O)NN=Cc1ccc(OCC(=O)Nc2ccc(Cl)cc2OC)c(OC)c1	1319346908	UVLSXUUYRAMKDP-UHFFFAOYSA-N	449.847	1.998	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)[C@H](c1cnn(C)c1)N(C)C(=O)OC(C)(C)C	1322408600	SSZNDXNCQJVSBV-KRWDZBQOSA-N	441.492	1.745	50	20	IDGD	
COC(=O)C12CCC(C(=O)N3CC[C@]4(CN(C(=O)[C@H](F)Cl)CCO4)C3)(CC1)CC2	1778303225	QMPUNFILACBMRG-XHNVJUCFSA-N	430.904	1.864	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccn4nccc4c3)C2)C1	1778727132	CAPLHWIHXVUPJI-AUUYWEPGSA-N	435.322	1.809	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@]2(CN(C(=O)CNC(=O)c3cccs3)CCO2)C1	1779296178	INUNVCOBPWHLTC-IBGZPJMESA-N	439.610	1.159	50	20	IDGD	
C[C@@H](Nc1cnccn1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CO[Si](C)(C)C)C1	1779545712	XMQPUPGCYMECQX-CBGDNZLLSA-N	449.628	1.642	50	20	IDGD	
COc1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](F)Br)C3)ccn1	1779719596	SOCSTTKLNAAGFK-DDUZABMNSA-N	444.301	1.908	50	20	IDGD	
CC(C)=NO[C@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Br)C1	1780776749	KYXXJUCQFRUSKV-VMUDFCTBSA-N	436.322	1.992	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)CCN3Cc4ccccc4C3=O)CCO2)C1	1781220257	ZXXVBEKQSHTEBP-PGRDOPGGSA-N	433.936	1.880	50	20	IDGD	
Cc1ccn(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](C)Br)C2)n1	1781996431	IYEZZFYGVSUWSD-IIDMSEBBSA-N	427.343	1.489	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1c(C)noc1C)C2	1782172057	MKGWYWPGXTXSPN-MBOZVWFJSA-N	427.929	1.602	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc3nncn3c1)C2	1782175012	AIOUGAXBAQCCLE-JXXFODFXSA-N	435.912	1.111	50	20	IDGD	
CCOC(CC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](Cl)COC)C2)OCC	1782340767	NAPBWSRVBWLDQW-JXXFODFXSA-N	434.961	1.543	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](C)Nc1ccccn1)CCO2	1783349226	KEJWSLFNAZEUKK-YZVOILCLSA-N	439.354	1.885	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)c3ccco3)[C@H]2C1	1783566064	RNEDJWSFKBNASG-PLPKTUSISA-N	429.311	1.466	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc4c(c3)NC(=O)CC4)CCO2)C1	1783880777	GNZAPWAYNGRBAA-IIBYNOLFSA-N	435.908	1.269	50	20	IDGD	
C[C@H](Oc1cccnc1)C(=O)N1CC[C@@]2(CN(C(=O)[C@@H](F)Br)CCO2)C1	1784549160	YTEBPGGOCZLKLD-QEORTHHSSA-N	430.274	1.369	50	20	IDGD	
N#Cc1ccccc1OCC(=O)N1CC[C@]2(CN(C(=O)CCBr)CCO2)C1	1785375500	BPSYUKAUTVQSBQ-LJQANCHMSA-N	436.306	1.552	50	20	IDGD	
COc1ncc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Br)C[C@@H]32)cc1F	1785638806	YLCXNJGHGSBHQQ-RETIQXCHSA-N	448.264	1.513	50	20	IDGD	
COCc1oncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCBr)[C@H]2C1	1786407273	VNWUXFWPRTWTNB-UBHSHLNASA-N	430.299	1.199	50	20	IDGD	
CC(=O)c1cc(C(=O)NC2(c3ccc(NC(=O)c4ccc(B(O)O)cc4)cc3)CCC2)n[nH]1	1788140468	ZDSLJDCXBGTZEB-UHFFFAOYSA-N	446.272	1.354	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4ncnn4c3)[C@H]2C1	1788451341	GOXHWBGANSPJSN-XMDUPGNXSA-N	440.331	1.559	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]2C1	1788763453	DZYDRNBKQYQFQS-UGUYLWEFSA-N	430.574	1.379	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccn(C(F)F)n3)C[C@@H]21	1788764196	CTRCAIQANYUDBD-YDHLFZDLSA-N	430.528	1.723	50	20	IDGD	
Cc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]32)cc1C	1789565541	ZDNAYJJAVYGKHB-UFYCRDLUSA-N	430.549	1.270	50	20	IDGD	
O=Cc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]3C2)s1	1789922548	LMJTVRWRXMYGBJ-QVSJOPQTSA-N	433.299	1.844	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4cccn4cn3)C[C@@H]21)[C@@H](F)Br	1789926447	YFWPZEDVNPOKAL-DLKVLKDVSA-N	439.285	1.618	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CO[Si](C)(C)C)C[C@@H]21	1790961258	XQDAOFYTLFPOJS-XQLPTFJDSA-N	435.435	1.991	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21	1791239449	VAQIRIDKLCBYBA-RMEBNNNOSA-N	433.332	1.525	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cn(C)nc3C(F)F)C[C@@H]21	1791255014	ZLZHRGVHWBFUQG-IMIFBBOLSA-N	434.871	1.205	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4c(c3)NC(=O)CC4)C[C@@H]21	1791256643	FTNMKTREELTZFV-DWRORGKVSA-N	449.935	1.418	50	20	IDGD	
O=C(CN(CCO)CCO)Nc1ccc(C2(NC(=O)CCBr)CCC2)cc1	1791327166	JRLDTTCTWJHNGQ-UHFFFAOYSA-N	442.354	1.192	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C=C/C(C)C)[C@H]2C1	1791862966	BXANUVZSQJCJDC-PXNAMXSLSA-N	429.521	1.312	50	20	IDGD	
CCC[C@H](NC(C)=O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](Br)CC)C[C@@H]21	1792188400	GFSIUTNAZMZNMP-KSWRQPAISA-N	446.386	1.444	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(N(C)C)c1)C2	1792872660	UJNGZNKOPKAWBB-SCNOPHJPSA-N	438.366	1.987	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccccc1N1CCCCC1)C2)[C@H](O)CCl	1792980449	OVIYWGDGGBVOOY-WOUAJJJCSA-N	435.952	1.480	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H]1CCOC1)C2	1794143895	YRSFXWGTXOQHHU-QMHWVQJVSA-N	429.945	1.793	50	20	IDGD	
Cc1onc(-c2ccccc2)c1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2	1794610581	MRQVTRLAQLYBAZ-DFGXFYAUSA-N	433.892	1.453	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)[C@H]1CNc2ccccc21	1795621196	VKAYATCLHUYPAI-AYCVOAMHSA-N	426.286	1.476	50	20	IDGD	
COC(=O)C12CCC(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@@H](F)Cl)(CC1)CC2	1796365606	UVSLZDHLNJIJIH-MRPNUNQFSA-N	430.904	1.624	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(OC3CCOCC3)n1)C2)[C@H](F)Cl	1796365773	ACEVQWUGIXPIMF-GGNLRSJOSA-N	441.887	1.377	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2)c1ccc(CCN2CCCC2)nc1	1796503910	ATDNMYSPBIVRIX-UKBAYJJMSA-N	438.931	1.458	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1nnsc1C1CC1	1796644214	BDXMVRASFMEHFS-YVECIDJPSA-N	443.367	1.792	50	20	IDGD	
COc1cccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)n1	1796889809	JJQWGBNSLSEGHO-MVRRYPJTSA-N	438.488	1.476	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccn2ccnc12	1797456153	WZVUUDOERBHRRO-QPWUGHHJSA-N	425.316	1.774	50	20	IDGD	
Cc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Br)nn1C(F)F	1799348559	KHOHUEONEZNCCX-RBLKWDMZSA-N	439.232	1.480	50	20	IDGD	
N#Cc1ccccc1OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Br	1799350592	ZCTBHTUCYDJTKC-DLTLXFJOSA-N	440.269	1.217	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc3c1cnn3C)C2	1800759168	JCRPOORTIKNBQE-JRATXPSKSA-N	435.322	1.560	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1=Cc3ccccc3NC(=O)C1)C2	1800979185	WEHPHHAPFXMZSM-AXVVYFOYSA-N	447.919	1.256	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)COc1cccc(Cl)c1)C2	1802333956	DZPNXUVMYXZRFM-BJWYYQGGSA-N	436.940	1.730	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cc1ccc3ncccc3c1)C2	1802334049	GZGJOHKQOSNKGO-ACDBMABISA-N	437.544	1.789	50	20	IDGD	
COc1ccc([C@@H](C)C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CCC(=O)NN(C)C)cc1	1802334102	INJOBGVSYKVOLK-OQIJWPOYSA-N	430.549	1.810	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)C(C)(C)C#N)[C@H]1c1cccnc1	1802686485	LCNNFRKTFYOFSG-HMDFAQMRSA-N	449.515	1.771	50	20	IDGD	
C[C@H](Nc1ccccn1)C(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1	1803142628	FWFLCVHXIIOHEJ-RUENVJTFSA-N	431.924	1.583	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1	1803145804	IGYJVHARHXLIGO-LFDJNIOPSA-N	449.935	1.443	50	20	IDGD	
O=C(CCc1ccco1)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1804585118	RYDDEFTZHXUUOA-WMZHIEFXSA-N	447.300	1.307	50	20	IDGD	
C[C@@H]1[C@@H](C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](O)CCl)C3)CCN1C(=O)OC(C)(C)C	1804630018	CJJBSWCOZHZTBA-RGGMIXCSSA-N	443.972	1.870	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC2(CCN(C(=O)CCS(C)(=O)=O)CC2)C1	1805389791	USZCZQLRRXWTQI-CQSZACIVSA-N	437.400	1.683	50	20	IDGD	
CC(=O)C(C)(C)C(=O)N1CCCC2(CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CC2)C1	1805831256	SRJDIAGFKVTTKW-PCLIKHOPSA-N	443.548	1.967	50	20	IDGD	
Cc1nc(CC(=O)N2CCCC3(CCN(C(=O)CCC(=O)NN(C)C)CC3)C2)c(C)s1	1807215102	BTGHFSOXNXAGEA-UHFFFAOYSA-N	449.621	1.907	50	20	IDGD	
CN1C(=O)CC[C@H]1C(=O)NC[C@@H]1CCN(C(=O)CO[Si](C)(C)C)[C@H]1c1cccnc1	1808768668	BKFULTGBSUVPFL-ZWOKBUDYSA-N	432.597	1.560	50	20	IDGD	
Cc1ccncc1C(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1808791262	HQEJAVKMONBUGT-XMSQKQJNSA-N	438.532	1.478	50	20	IDGD	
CCOC(=O)N[C@H](O)C(=O)NC[C@H]1CCN(C(=O)C(C)(C)CCl)[C@H]1c1cccnc1	1810086742	IKPSSHAPOXGTMN-HLLBOEOZSA-N	440.928	1.417	50	20	IDGD	
C#CCCCCC(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1	1810304210	ASPQOOSWXHXGEK-GCJKJVERSA-N	448.527	1.593	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)[C@H](C)Nc2cnccn2)[C@@H]1c1cccnc1	1810325455	NTAHOFGEAGBVIF-RUENVJTFSA-N	446.939	1.632	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)NC[C@H]1CCN(C(=O)CO[Si](C)(C)C)[C@@H]1c1cccnc1	1810526843	HGMTVCDXUXOJDR-WRWLIDTKSA-N	432.597	1.630	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCSC)[C@H]1c1cccnc1	1813032444	BISUDBISSDEXOS-QAETUUGQSA-N	429.970	1.455	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)C2CC(F)(F)C2)[C@@H]1c1cccnc1	1813068619	PEIICEFPOARRKY-HNAYVOBHSA-N	437.491	1.506	50	20	IDGD	
C[C@@H](CBr)C(=O)Nc1cc([C@H]2CCCCN2C(=O)Cn2cnnn2)[nH]n1	1814780039	FDXFPGZXRQXQKF-CMPLNLGQSA-N	425.291	1.120	50	20	IDGD	
O=C(CC(F)(F)F)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1	1815339449	GDJCJCQUIPZJHY-NSHDSACASA-N	427.213	1.001	50	20	IDGD	
Cc1ccsc1C(=O)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1	1815355019	LKTKKFKGQCJCKN-AWEZNQCLSA-N	441.343	1.732	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)C(=O)c1ccccc1	1816716348	YYUASXYEIFWGBM-LJQANCHMSA-N	446.272	1.278	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(=O)n3[nH]cnc3n2)n[nH]1	1817466747	LTVXMXIOECJPDF-RISCZKNCSA-N	446.899	1.854	50	20	IDGD	
CCNC(=O)N[C@@H](C)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCBr)CC2	1819684618	JDLAICIOKQJAPX-UWVGGRQHSA-N	446.371	1.548	50	20	IDGD	
C[C@H](Cn1cncn1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CO[Si](C)(C)C)CC2	1820072425	GZCATIJJOVHFCY-CHWSQXEVSA-N	436.614	1.834	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CN2CCNC2=N)[nH]n1	1820863461	DNTFIDAZYCZKFI-SJKOYZFVSA-N	430.340	1.478	50	20	IDGD	
CC(=O)N(C)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](F)Br)n[nH]1	1820930894	KEEOMEDDTSOVAW-IUODEOHRSA-N	432.294	1.961	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2)c1cccc(F)c1	1822041859	DSHSFOKRQPAGQM-MRXNPFEDSA-N	439.277	1.502	50	20	IDGD	
CCOC(=O)C1(C(=O)N2CCCC[C@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)CC1	1822416331	ARQCGVFBGZMMOE-HNNXBMFYSA-N	448.524	1.118	50	20	IDGD	
O=C(CCn1ccnn1)N[C@@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1	1823013963	LPXVXXIRMNERON-PELKAZGASA-N	431.291	1.427	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)C[C@H]2CCCCO2)CC1	1824904594	CQRYGLIISVZGDJ-YADHBBJMSA-N	442.365	1.559	50	20	IDGD	
Cc1cccc(C(=O)N[C@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)n1	1826080517	PCHDNWNLMUHMTA-ZDUSSCGKSA-N	430.534	1.445	50	20	IDGD	
O=C(CN1CCOCC1)N1CCC([C@H]2CCCCN2C(=O)CCBr)CC1	1826357647	FRMUXFAKZKLBLH-QGZVFWFLSA-N	430.387	1.723	50	20	IDGD	
Nc1n[nH]c(CCC(=O)N2CCC([C@H]3CCCCN3C(=O)CCBr)CC2)n1	1826359308	XGKRKKHBVJELDD-CQSZACIVSA-N	441.374	1.724	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)CCc2ccc[nH]2)CC1	1827108531	IBOFCGHXROQWQZ-QFIPXVFZSA-N	437.349	1.561	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)CCc2ccc[nH]2)CC1	1827109301	YRAHYGUZBOSORP-JOCHJYFZSA-N	437.349	1.561	50	20	IDGD	
Cc1cc(NC(=O)CC(=O)N2CCCC[C@H]2C2CCN(C(=O)[C@H](O)CCl)CC2)no1	1827660093	LXWNJSOKHAQYQP-JKSUJKDBSA-N	440.928	1.531	50	20	IDGD	
C=CCO[C@H](C)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1	1828923964	ZJKFEQHSRIAOCP-OXQOHEQNSA-N	443.548	1.510	50	20	IDGD	
CSCC(C)(C)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCBr)C2)C1	1831533447	WXIUXDNENYBELW-QGZVFWFLSA-N	437.400	1.617	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1	1831833225	MNOGWINXWNBTHC-JKSUJKDBSA-N	425.913	1.980	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCC(=O)N3CCCC3)CCO2)C1	1832418905	QUOPFKKMSMDLSA-UWJYYQICSA-N	443.972	1.253	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3noc(C(C)C)n3)CCO2)C1	1832792146	XNPYNUQQGCEOPW-AUUYWEPGSA-N	428.917	1.209	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3nc(Cl)ccc3F)CCO2)C1	1833242197	ADLZUIMCGMSXKU-XIKOKIGWSA-N	434.295	1.962	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3c(F)ccnc3Cl)CCO2)C1	1833252908	AOSMUJKGMBTUOC-KPZWWZAWSA-N	434.295	1.962	50	20	IDGD	
COc1nccnc1C(=O)NC1CCN(C2CCN(C(=O)C(Cl)Cl)CC2)CC1	1833971995	IGNZQJLBYGPGLA-UHFFFAOYSA-N	430.336	1.474	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3F)C2)C1	1834822577	WRUDKFXLVMAVGV-KRWDZBQOSA-N	430.274	1.076	50	20	IDGD	
O=C(Cc1ccc(F)cc1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1835051034	IPDOJLZSPSOVAL-AEFFLSMTSA-N	447.276	1.515	50	20	IDGD	
COC(=O)[C@@H]1CC[C@H](C(=O)N2CCC(N3CCC(NC(=O)[C@H](F)Cl)CC3)CC2)C1	1835079470	YRSZAMSELNCHLT-VBQJREDUSA-N	431.936	1.682	50	20	IDGD	
CC[C@@H](C)[C@@H](O)C(=O)N1CCC(N2CCC(NC(=O)CO[Si](C)(C)C)CC2)CC1	1835834782	KGXINDTUMPNCFK-OXQOHEQNSA-N	427.662	1.817	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)Cc3ccncc3)CC2)CC1	1836348268	QMGLDJXLDPWJQD-HNNXBMFYSA-N	437.382	1.979	50	20	IDGD	
Cc1nc(CC(=O)N2CCC(OC3CCN(C(=O)[C@H](O)CCl)CC3)CC2)c(C)s1	1836715264	OCXNTYBTKQEAMM-GOSISDBHSA-N	443.997	1.901	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc4c(c3)CNC4=O)CCO2)C1	1837147114	JTDYVENHPDCNSU-JOCHJYFZSA-N	449.935	1.265	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3c(F)c(C)nn3C)CC2)CC1	1837338681	LHYTXDZWLGJQAU-MRXNPFEDSA-N	444.935	1.734	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)c3ncccn3)CC2)CC1	1837503371	QAVXFKNUMIGWRS-CYBMUJFWSA-N	425.327	1.872	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(OC)ccn3)CCO2)C1	1837952385	UAJXOCMCJVXTSJ-JXFKEZNVSA-N	425.913	1.568	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(-n4ccnc4)ccn3)C2)C1	1839146390	NXOHUJLARHAFIF-LAUBAEHRSA-N	447.923	1.355	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccccc3O)CCO2)C1	1839909440	LNYLXJYNTYPKQW-KUHUBIRLSA-N	441.322	1.175	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3CCCSC3)C2)C1	1839967698	VACDJHICUOUTIU-RVKKMQEKSA-N	449.411	1.760	50	20	IDGD	
O=C(c1n[nH]c2ccccc12)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840188564	PODJFCQEKKCEAV-SFHVURJKSA-N	427.288	1.437	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)/C=C/c3cnc[nH]3)CCO2)C1	1840343784	ZVOXWODWOUCIMU-DJSXQKDESA-N	431.320	1.116	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(C)c3Cl)CCO2)C1	1840693229	NYGGXRMSIJHTLT-OXJNMPFZSA-N	445.343	1.972	50	20	IDGD	
COc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)ccc1[N+](=O)[O-]	1840758000	LHBYYIRSSHAAJN-YJBOKZPZSA-N	445.831	1.208	50	20	IDGD	
CN(C)C(=O)C(=O)N1CCCC12CN(C(=O)/C(C#N)=C/c1ccc(Br)cc1)C2	1842837821	MKKPGOZXWQIKBG-XNTDXEJSSA-N	445.317	1.648	50	20	IDGD	
CCOC(=O)c1cc(C(=O)N2CCCC23CN(C(=O)[C@H](F)Br)C3)ccn1	1844791620	OUAJQYGYAIIZRR-ZDUSSCGKSA-N	428.258	1.766	50	20	IDGD	
CC(=O)NCCC(=O)N1CCCC12CN(C(=O)[C@@H](Br)Cc1ccccc1)C2	1846009912	XWYFHVKLIYWZHX-KRWDZBQOSA-N	436.350	1.722	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](F)Br)c1	1847381954	CLQYFIXIRMVDSD-MELADBBJSA-N	433.299	1.596	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(Br)s2)C1)C1CC1	29509453	HGELEOIZABRYNG-JTQLQIEISA-N	436.353	1.469	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)[C@H]1CCCN(C(=O)Nc2ccccc2)C1	725742003	XMHMMOGEXAEPCN-AWEZNQCLSA-N	429.502	1.569	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)[C@@H](C)NC(=O)c2n[nH]c3ccccc23)cc1	726379035	DTKCTJSZOZZDSK-KGLIPLIRSA-N	439.472	1.695	50	20	IDGD	
O=C(COC(=O)CCS(=O)(=O)c1ccc(Cl)cc1)NNC(=O)c1cccs1	728315623	OIZOQCLQHBFBDI-UHFFFAOYSA-N	430.891	1.570	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2)c1cccc(OC(F)F)c1	728510522	MELHSQYMUMTFPC-UHFFFAOYSA-N	445.356	1.591	50	20	IDGD	
CCN1CCC[C@@H]1CN1C[C@H](C(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)CC1=O	729626373	CZLGNFNYPAZTHA-IPMKNSEASA-N	430.549	1.551	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)CN2C(=O)N[C@@](C)(c3ccc(C)cc3)C2=O)cn1	729692163	MWXCDRMOLJOWNW-FQEVSTJZSA-N	442.501	1.183	50	20	IDGD	
CC(=O)N1CCN(C(=O)CCNC(=O)/C(C#N)=C/c2cc(C)n(CC(C)C)c2C)CC1	730787868	WWTWIWLVYMOWSC-FYJGNVAPSA-N	427.549	1.865	50	20	IDGD	
O=C(CCCCOc1ccc(Br)cc1)NNC(=O)[C@H]1CCS(=O)(=O)C1	731163514	JLBGCGZULHRSLG-LBPRGKRZSA-N	433.324	1.580	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NNC(=O)c2ccc(C#N)cc2)cc1Br	732242273	AEFDFNHNRVSLQR-UHFFFAOYSA-N	432.234	1.618	50	20	IDGD	
Cc1sc2nc(CCC(=O)NNC(=O)CCN3C[C@H](C)O[C@@H](C)C3)nc(O)c2c1C	732261622	FEAJCJUNLQEKJT-RYUDHWBXSA-N	435.550	1.593	50	20	IDGD	
CCOCCCn1c(NNC(=O)c2ccc(S(C)(=O)=O)o2)nc2ccccc2c1=O	733268892	UBHKUGDKXVEXJQ-UHFFFAOYSA-N	434.474	1.577	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)NCc1ccnc(OC2CCOCC2)c1	733654735	UCKQGVYQULIEQG-UHFFFAOYSA-N	444.488	1.948	50	20	IDGD	
N#Cc1ccc(N2C(=O)N[C@H](CCC(=O)NNC(=O)c3ccc4ccccc4n3)C2=O)cc1	733774731	QZNRLSHQDHRAFE-LJQANCHMSA-N	442.435	1.773	50	20	IDGD	
Cc1ccc(OCC(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)c(C)c1	735116727	DAODCOILWGTHGT-UHFFFAOYSA-N	433.534	1.157	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2cc3cc(Cl)ccc3[nH]2)CC1	735116838	IDHQSLPFBHWSKX-UHFFFAOYSA-N	448.936	1.909	50	20	IDGD	
COc1ccc(S(=O)(=O)C[C@H](C)C(=O)OCC(=O)NNC(=O)c2ccccc2)cc1	735160332	GPNYVQPRUOMSDV-AWEZNQCLSA-N	434.470	1.109	50	20	IDGD	
CN(C)C(=O)Nc1cccc(C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c1	740374759	ZQPDQCSEHGXSNA-UHFFFAOYSA-N	429.389	1.306	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)[C@H](NC(=O)C12CC3CC(CC(C3)C1)C2)C(C)C	740851243	WBWHAFKYYYXJFE-FBXSJCODSA-N	434.581	1.796	50	20	IDGD	
CN(CCCC(=O)NNC(=O)COc1ccccc1F)C1=NS(=O)(=O)c2ccccc21	742033897	SOQYWJAVQBPWEK-UHFFFAOYSA-N	448.476	1.213	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CSc2nnc(CCC(N)=O)n2Cc2ccco2)c1	742451554	XFGJXOWQTLDUQR-UHFFFAOYSA-N	442.501	1.199	50	20	IDGD	
O=C(CN1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O)NNC(=O)c1ccc(-c2ccc(F)cc2)s1	742485228	BZYORERPBDZGBH-HLNSBACISA-N	443.456	1.478	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)CN2CCN(C(=O)c3c(F)cccc3Cl)CC2)cc1	744395122	SJCAWMBGHNCHGN-UHFFFAOYSA-N	443.866	1.570	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H]1CC(=O)OCC(=O)NNC(=O)c1cccc(C#N)c1	745458722	OCQLJVNAJVGCEE-INIZCTEOSA-N	430.461	1.652	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)NC[C@@H](C)CN2CCN(C)CC2)cc1Cl	745861651	DFYWIFQYFPKLPZ-CYBMUJFWSA-N	442.948	1.576	50	20	IDGD	
CN(C)[C@H](CNC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)c1ccc(Cl)cc1	746778512	VYMUYLLSJZZBCU-QGZVFWFLSA-N	428.884	1.563	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)Cc1ccncc1)N1C(=O)c2ccc(Br)cc2C1=O	747323144	KMGRFDXCKUBIPF-JTQLQIEISA-N	431.246	1.219	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)c1cnn(-c2ccc(Cl)nn2)c1C(F)(F)F	747324818	JJMPZRGMUQYTEU-UHFFFAOYSA-N	425.758	1.733	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NCCCN2CCN(c3ccncc3)CC2)cc1C	748465276	NNPBDZPLFZQPAO-UHFFFAOYSA-N	440.548	1.620	50	20	IDGD	
O=C(Cn1c(=O)ccn(Cc2ccccc2)c1=O)NNc1ccc([N+](=O)[O-])cc1Cl	748721838	HIAXUNPYWKFNAF-UHFFFAOYSA-N	429.820	1.763	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCCCNC(=O)C2CCC2)cc1Br	749115016	FNGBGKHNYJPKJK-UHFFFAOYSA-N	427.299	1.708	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNS(=O)(=O)c1cc(C(=O)O)cc2c1CCCC2	751281276	CQLSCBHKBRDEKE-UHFFFAOYSA-N	437.499	1.065	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)[C@H]1CC(=O)N(CCOc2ccccc2Cl)C1	751540430	BWXHQAAFYQYZIS-AWEZNQCLSA-N	449.866	1.933	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)NC[C@H]2CCC[C@]23NC(=O)N(C)C3=O)cc1OC	752025524	YHMWWQFCLQCTSJ-SZNDQCEHSA-N	447.492	1.149	50	20	IDGD	
CCCn1c(=O)nc(O)c2c(C(=O)NNc3cc(Cl)nc(N)n3)cc(C(C)C)nc21	753681495	KLZLFRZMJSLIND-UHFFFAOYSA-N	432.872	1.813	50	20	IDGD	
CC(C)N(CCS(C)(=O)=O)C(=O)CCC(=O)C(C#N)=C1N(C)c2ccccc2N1C	753754179	BXNNZUBLPVDBDW-UHFFFAOYSA-N	432.546	1.939	50	20	IDGD	
Cc1nccc(NCc2cccc(C(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)c2)n1	754844859	YWMKVSSHVHDNMS-UHFFFAOYSA-N	443.467	1.719	50	20	IDGD	
O=C(CSc1nc(-c2ccccc2)no1)NNC(=O)C1CCN(c2ncccn2)CC1	755249304	SZFGCYCQFBUZOB-UHFFFAOYSA-N	439.501	1.683	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)Nc2cccc(N3C(=O)CN(C)C3=O)c2)cc1	755994678	ZXTGMXFEYZSICN-UHFFFAOYSA-N	425.445	1.879	50	20	IDGD	
COCCOc1cc(C)ccc1NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1	756044973	LRYZKVPAVSAKAQ-UHFFFAOYSA-N	428.493	1.880	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN(Cc2ccccc2O)C[C@@H]2CCCO2)cc1OC	756337385	WLYPLUHJJKVFCG-SFHVURJKSA-N	443.500	1.852	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)Nc2cccc(C(=O)NCCC(N)=O)c2)c1	756395701	YSXAIZGYRLSJOW-UHFFFAOYSA-N	427.461	1.140	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2ccc3ccn(C)c3c2)cc1	756760846	PCHJQBZKEGGPSD-UHFFFAOYSA-N	429.502	1.960	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)Nc1ccc(S(=O)(=O)NCC2CC2)cc1	756784674	PZHIDCVJMGBJES-UHFFFAOYSA-N	432.502	1.866	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)Nc1ccc(C(=O)NC2CCOCC2)cc1	757619279	LYNIHKPHGTWRAR-UHFFFAOYSA-N	430.436	1.966	50	20	IDGD	
CC(C)c1ccc(-n2cnnc2SCC(=O)NNC(=O)C(=O)Nc2ccccn2)cc1	758829721	HUAFUPXGJANMPR-UHFFFAOYSA-N	439.501	1.664	50	20	IDGD	
CN(Cc1cc(Br)cn1C)C(=O)NNC(=O)CNC(=O)c1cccs1	758862338	QYDVURYBRLEDQB-UHFFFAOYSA-N	428.312	1.452	50	20	IDGD	
COc1cc(C(=O)OCC(=O)NNC(=O)Cc2nc(C)cs2)ccc1OC(F)F	759433728	PJFHLCZDCLDAHW-UHFFFAOYSA-N	429.401	1.608	50	20	IDGD	
COc1ccc(C[C@@H](C)CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1	759676501	PVXUBXOEKBUQNA-OAHLLOKOSA-N	448.545	1.768	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)CN1C(=O)N[C@@](C)(c2ccccc2)C1=O	761634653	ZMDDELPLYNHXMV-NRFANRHFSA-N	442.497	1.402	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1c[nH]c2cccc([N+](=O)[O-])c12	762937323	IZVCJTVENKTPDI-UHFFFAOYSA-N	430.446	1.752	50	20	IDGD	
O=C(NNC(=O)c1cccnc1)C(=O)Nc1ccnn1Cc1ccc(Br)cc1	763491813	OZPSWUOEBDQHHS-UHFFFAOYSA-N	443.261	1.489	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(F)cc2OCC(F)F)cc1	763661916	QOVWJZQNHAOCGW-UHFFFAOYSA-N	441.362	1.643	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(NC(C)=O)ccc1OC	763717549	ZSIOMEWIMWDTPD-UHFFFAOYSA-N	428.445	1.381	50	20	IDGD	
CSc1cccc(NC(=O)C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1	763717889	BVTYVZHLUBDHDA-UHFFFAOYSA-N	436.515	1.059	50	20	IDGD	
Cc1cc(C)n(-c2ccc(NC(=O)C(=O)NNC(=O)CN3CCCc4ccccc43)cn2)n1	763728436	QGVVMKPMUUKHMN-UHFFFAOYSA-N	447.499	1.423	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCC3)c(OCC(=O)N(C)C)c1	763785222	MGBXTKCUHYVDAR-UHFFFAOYSA-N	444.513	1.412	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cccc3c2OCCO3)cc1	763859815	GBABCIPIGYCKCH-ZDUSSCGKSA-N	429.429	1.410	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)C(=O)N(C)CC3)cc1OC	763901881	KXNICTWFIVJPOF-UHFFFAOYSA-N	440.456	1.122	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(N3CCNC3=O)c2)cc1OC	763902216	SHRQFOWIRAFDFA-UHFFFAOYSA-N	441.444	1.023	50	20	IDGD	
CCC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2cc(Br)cn2C)cc1	764004993	QNYKKUOZSASQCR-UHFFFAOYSA-N	436.266	1.536	50	20	IDGD	
C[C@@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3ccc4c(c3)OCCO4)cc2)CCO1	764006713	SYPVQVOJZRHEJK-CQSZACIVSA-N	440.456	1.083	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1ccn(-c2ncccc2F)n1	764020431	YFZXVSXKLBPLDW-UHFFFAOYSA-N	432.799	1.468	50	20	IDGD	
O=C(Cc1cccc2ccccc12)NNC(=O)C(=O)Nc1ccccc1CN1CCNC1=O	764028559	MILPRNDJXHSMAH-UHFFFAOYSA-N	445.479	1.694	50	20	IDGD	
O=C(NNC(=O)c1ccc(F)cc1Br)C(=O)Nc1ccn(CC(F)F)n1	764084875	JITVLISKGVMFRS-UHFFFAOYSA-N	434.172	1.450	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)nc2)ccc1Br	764098379	MJEGGWJAAKGPNN-UHFFFAOYSA-N	427.642	1.906	50	20	IDGD	
Cc1cnc(O)n1-c1ccccc1NC(=O)C(=O)NNC(=O)c1ccc(Cl)cc1O	764126705	OPRZSVFJBDQAKW-UHFFFAOYSA-N	429.820	1.645	50	20	IDGD	
CCOC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)cc1C#N	764166558	CFGQKFHQHGYQBC-QGZVFWFLSA-N	437.412	1.216	50	20	IDGD	
O=C(NNC(=O)c1cc(F)ccc1Br)C(=O)Nc1ccc2nccnc2c1	764270386	LNXZLDIMDRKRGP-UHFFFAOYSA-N	432.209	1.931	50	20	IDGD	
CC(C)Oc1ccc(NC(=O)C(=O)NNC(=O)c2cc(Br)ccc2O)cn1	764279852	GDRRCPHPHUTCIQ-UHFFFAOYSA-N	437.250	1.737	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)C(=O)Nc1ccccc1O[C@@H]1CCOC1	764350373	DIHVWEHAJNTSBX-QGZVFWFLSA-N	435.440	1.440	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(C(=O)N3CCSCC3)ccc2C)o1	764370505	CZARLDNBKAKRGY-UHFFFAOYSA-N	430.486	1.485	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(S(=O)(=O)NCCC(C)C)cc2)o1	764371531	OVXGKUIADLVKHC-UHFFFAOYSA-N	436.490	1.312	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1cc2c(cc1Cl)OCO2	764397413	ITTUBHYUCHDAMZ-UHFFFAOYSA-N	437.861	1.956	50	20	IDGD	
COc1ccccc1N1CC[C@H](NC(=O)NNC(=O)CSc2ccccc2O)C1=O	764445409	FCBKRNJSSKHWLJ-ZDUSSCGKSA-N	430.486	1.629	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)NCCCN2CCCO[C@H](C)C2)c1	764585017	RJWSWUDFRSJMJJ-CYBMUJFWSA-N	443.342	1.903	50	20	IDGD	
Cc1ccc([C@H](C)[C@@H](O)C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cc1	765178588	YLWSWBHOIPAHBA-PGRDOPGGSA-N	438.528	1.065	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)c1ccc(-n2ncc(C#N)c2N)cc1	765318652	KPYFGBWLXARUET-UHFFFAOYSA-N	427.465	1.392	50	20	IDGD	
CC(C)NS(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)c1	765566509	ZHOQIXXQHLCVOO-UHFFFAOYSA-N	433.515	1.900	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)c3cc(S(N)(=O)=O)ccc3C)n[nH]2)cc1C	765567874	SVFKGRCUGQDYJI-UHFFFAOYSA-N	427.486	1.724	50	20	IDGD	
CC(C)OC(=O)C[C@H]1CCCN(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)C1	766086960	HUVHWNJYJTVVDI-MRXNPFEDSA-N	432.525	1.488	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)[C@H](C)N3C(=O)NC4(CCCC4)C3=O)n[nH]2)c1	768270255	XSWCJSUKBFCELZ-AWEZNQCLSA-N	438.488	1.708	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)CCc2c(C)nc3cc(O)nn3c2C)n[nH]1	768274715	XARKZEQXQZEXTA-UHFFFAOYSA-N	449.471	1.844	50	20	IDGD	
CCOc1cccc(-c2nnc(SCC(=O)NNC(=O)c3ccc(C#N)cc3)n2N)c1	768424445	RXNBKAHORFDLBU-UHFFFAOYSA-N	437.485	1.483	50	20	IDGD	
Cc1ccc(S(=O)(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)c(Cl)n1	769651107	NOCBOYQUKCZOGE-UHFFFAOYSA-N	431.927	1.268	50	20	IDGD	
CC(C)c1ccc(S(=O)(=O)NCCC(=O)NNc2nc(O)c3cnn(C)c3n2)cc1	770982280	FUQJSDYLQGIBMH-UHFFFAOYSA-N	433.494	1.004	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccccc1	771847335	VIBXXAMYPDLWOJ-ZKMNFCBKSA-N	434.456	1.860	50	20	IDGD	
CC(C)(C)OC(=O)N1CCSC[C@H]1CC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	772009836	KEFMSEGMGNAVBT-CJNGLKHVSA-N	437.518	1.716	50	20	IDGD	
CN(CCNC(=O)NNC(=O)Cc1ccc(Cl)cc1)S(=O)(=O)c1cccs1	772017776	XPNYESQURFEXLY-UHFFFAOYSA-N	430.939	1.595	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)c1ccc(CN2C(=O)CNC2=O)cc1	772995276	OHBIRHFXNTWNPL-GFCCVEGCSA-N	430.848	1.620	50	20	IDGD	
O=C(NNC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1)C(=O)Nc1ccc(F)cn1	773524506	JJANJAUVEVDFSD-UHFFFAOYSA-N	445.414	1.868	50	20	IDGD	
O=C(NNc1ccc(C(F)(F)F)cn1)C(=O)Nc1ccccc1CN1C(=O)CCC1=O	773670207	XVZKJRBQWGEROA-UHFFFAOYSA-N	435.362	1.831	50	20	IDGD	
CN1CCN(C(=O)NNC(=O)c2coc(-c3ccc(Br)cc3F)n2)CC1	773671705	ALIJPDPHDMUWHK-UHFFFAOYSA-N	426.246	1.845	50	20	IDGD	
COC(=O)c1c(F)cccc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1cccc(Cl)c1	774009577	RFQUHZNJZVZRJU-SNVBAGLBSA-N	437.811	1.819	50	20	IDGD	
C[C@@H](NCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)c1ccc(N2CCOC2=O)cc1	775266823	MFMPQOXJHYVBJU-CYBMUJFWSA-N	427.417	1.663	50	20	IDGD	
O=C(CN1CCC(c2nnc3n2CCCC3)CC1)NNC(=O)c1ccc([N+](=O)[O-])cc1	775825359	BPEWMZIEFPOEKE-UHFFFAOYSA-N	427.465	1.163	50	20	IDGD	
O=C(NNC(=O)C12CC3CC(CC(C3)C1)C2)N[C@H]1CCO[C@@]2(CCS(=O)(=O)C2)C1	776073049	JCQJTXVMWUYNLP-JZUXOTBCSA-N	425.551	1.270	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCCc2nn(C)c3ccccc23)c2ccccc2c1=O	776178122	HPSIFRRWVCQKNZ-UHFFFAOYSA-N	433.472	1.490	50	20	IDGD	
COc1ccc(Cn2ccc(NC(=O)C(=O)NNc3cccc(S(C)(=O)=O)c3)n2)cc1	778697662	REUDLSXKMWXXCX-UHFFFAOYSA-N	443.485	1.425	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)[C@H](O)[C@@H](O)c2nc3ccccc3[nH]2)c(C)n1-c1ccccc1	779580414	ZGSKDZODBOCOBM-WOJBJXKFSA-N	433.468	1.826	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H](C)[C@@H]2CCCOC2)c1	780864079	ZOSJEIDDFJMBHT-GOEBONIOSA-N	426.539	1.476	50	20	IDGD	
COc1ccc(NNC(=O)C(F)(F)C(F)(F)C(=O)NNc2ccc(OC)cn2)nc1	781516480	RPXRVQAYKQEYOG-UHFFFAOYSA-N	432.334	1.351	50	20	IDGD	
CCOc1ccc(OC)cc1NC(=O)C(=O)NNC(=O)Cc1nc2ccccc2n1C	782894612	QLXAAYZJOKABES-UHFFFAOYSA-N	425.445	1.309	50	20	IDGD	
CN(C1CC1)S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ncnc3ccsc23)cc1	783253549	JMQZLFSHFSKXII-UHFFFAOYSA-N	446.514	1.556	50	20	IDGD	
C#CCOc1ccc(F)cc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)NC(C)C)cn1	783264933	SZZAANUOLZSAQC-UHFFFAOYSA-N	449.464	1.001	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2cncc(Cl)n2)cc1S(=O)(=O)NC(C)(C)C	783266743	ZSKGRLPVLBSFTF-UHFFFAOYSA-N	440.913	1.597	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2ccc(S(=O)(=O)NCCC(C)C)cc2)nc(C)n1	783326440	GHOCETREOKYENR-UHFFFAOYSA-N	434.522	1.500	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNc2cc(C)ccc2C)cc(S(C)(=O)=O)c1	783362540	XPTGCDCGNXERJY-UHFFFAOYSA-N	433.486	1.965	50	20	IDGD	
COc1cc(Oc2ccccc2)ccc1NC(=O)C(=O)NNC(=O)C(=O)N1CCCC1	783999433	ODWQXZZSMHKLPJ-UHFFFAOYSA-N	426.429	1.196	50	20	IDGD	
O=C(NNC(=O)C(=O)N1CCCC1)C(=O)Nc1ccc(F)cc1-c1ccc(Cl)cc1	784000011	RNTAUKRJCNJLFS-UHFFFAOYSA-N	432.839	1.854	50	20	IDGD	
O=C(NNc1ccccc1C(F)(F)F)C(=O)Nc1cccc(CN2C(=O)CNC2=O)c1	784831504	QYZWGKYVAGTZBH-UHFFFAOYSA-N	435.362	1.839	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)[C@@H]2Cc3cc(C)c(C)cc3O2)cc1OC	786399605	NAROMFNCKNNDCS-IBGZPJMESA-N	428.441	1.629	50	20	IDGD	
CCNC(=O)Nc1ccc(C)c(NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1	786421487	DUXRHVFWGMVPKK-UHFFFAOYSA-N	440.508	1.996	50	20	IDGD	
COC[C@H](C)Oc1ccc(Cl)cc1S(=O)(=O)NNC(=O)CNC(=O)c1ccco1	786724436	ZKMMFRSVNSXIHY-NSHDSACASA-N	445.881	1.086	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCc2ccc(NC(C)=O)nc2)nc1	789299797	UFTCSOJVVJKBCB-UHFFFAOYSA-N	435.510	1.292	50	20	IDGD	
Cc1cc(F)c(Br)cc1NC(=O)C(=O)NNC(=O)[C@@H]1Cc2ccccc2O1	789583986	AQAGQMGKBPWWJQ-HNNXBMFYSA-N	436.237	1.986	50	20	IDGD	
CC(=O)Nc1ccc(Cl)c(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)c1	789816354	GEICGNOGZZTIOB-YJBOKZPZSA-N	444.875	1.957	50	20	IDGD	
CCOc1ccc(-c2nc(CC)c(C(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)s2)cc1	791476607	HFCQMLROZYSCTL-CYBMUJFWSA-N	437.543	1.967	50	20	IDGD	
C[C@@](O)(Cn1cc(C(F)(F)F)ccc1=O)C(=O)NNC(=O)c1cc2c(s1)CCC2	792017387	IWCCYOHCVVCQMT-QGZVFWFLSA-N	429.420	1.630	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@H](C)C(=O)NNC(=O)[C@](C)(O)Cn1c(C)cccc1=O	792023780	VZJPWUYMMDQJEY-QVKFZJNVSA-N	435.908	1.793	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2cccc(Cl)c2Br)n1	792268807	JSYCZBLXMHTSGV-UHFFFAOYSA-N	428.674	1.702	50	20	IDGD	
O=C(NNc1nc2ccccn2n1)C(=O)Nc1ccc(Cl)c(-n2nnnc2C2CC2)c1	792394866	NYEUSGCXDABWIF-UHFFFAOYSA-N	438.839	1.318	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)c2cc(Cn3cccn3)on2)CC1	794337360	XGEFRKYKSJGVLO-UHFFFAOYSA-N	433.469	1.263	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NN=C(CS(=O)(=O)N(C)C)C(C)C)n[nH]2)cc1OC	794920838	VLDZRHPQJMHFKU-UHFFFAOYSA-N	437.522	1.727	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H]2CN(CC(=O)NNC(=O)c3cccc(C#N)c3)CC[C@H]21	795127514	FKJGYSKTDJKLLV-ZWKOTPCHSA-N	427.505	1.651	50	20	IDGD	
COc1ccc(CN2C[C@@H](C(=O)NNc3ccccc3S(=O)(=O)N(C)C)CC2=O)cc1	795168341	NIYAQOQVUQZQRN-INIZCTEOSA-N	446.529	1.437	50	20	IDGD	
Cc1nn(Cc2ccccc2)c(N)c1C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	795196975	VVOJFBRTFWFPIY-UHFFFAOYSA-N	427.486	1.300	50	20	IDGD	
CCOC(=O)Cc1cccc(S(=O)(=O)NNC(=O)c2nnc(-c3ccccc3)o2)c1	795304450	VZEKZVQHSYWECM-UHFFFAOYSA-N	430.442	1.466	50	20	IDGD	
C[C@H]1[C@@H](NCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)[C@H](C)CCN1C(=O)OC(C)(C)C	796646443	BOLGNUPDNIXAGK-GLJUWKHASA-N	449.508	1.979	50	20	IDGD	
O=C(NCC(F)(F)F)NNC(=O)c1ccc2c(c1)S(=O)(=O)c1ccccc1C2=O	798316853	XKMHZKWLGYOFCL-UHFFFAOYSA-N	427.360	1.570	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2nnn(-c3ccc4ncccc4c3)c2C)cc1	801109528	RMBGIIXCHSHZDH-UHFFFAOYSA-N	429.440	1.832	50	20	IDGD	
COC(=O)[C@@H]1C[C@@H]2[C@@H](CC[C@@H](C)N2CC(=O)NNC(=O)c2cc(Cl)ccc2OC)O1	801601292	LRMSFKSVYQESIU-PREXVCJDSA-N	439.896	1.293	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)S(=O)(=O)N(C[C@H]1CCCO1)C2=O)Nc1ccccc1	801985923	NYKIJEFPOJLJIE-OAHLLOKOSA-N	444.469	1.477	50	20	IDGD	
O=C(CSCc1cc(=O)n2ccsc2n1)NNC(=O)Nc1ccc2c(c1)OCO2	802101581	QGICAOYGQZSDFR-UHFFFAOYSA-N	433.471	1.571	50	20	IDGD	
COC(=O)CC[C@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)c1ccc2c(c1)OCCO2	806347120	GSJOIIBOBRGYAR-ZDUSSCGKSA-N	437.449	1.065	50	20	IDGD	
Cc1cccn(Cc2c(F)cccc2NC(=O)C(=O)NNC(=O)c2ccccc2F)c1=O	806972950	TVBPZSJDFUFMTR-UHFFFAOYSA-N	440.406	1.883	50	20	IDGD	
COc1ccc(CC(=O)NCc2ccc(C(=O)NNC(=O)N3CCN(C)CC3)cc2)cc1	807380669	LZUFHEIVEPURJZ-UHFFFAOYSA-N	439.516	1.156	50	20	IDGD	
COc1ccc(S(=O)(=O)NCC(=O)NNc2ccccc2Br)cc1OC	810680200	HWGSACWXQSERFV-UHFFFAOYSA-N	444.307	1.888	50	20	IDGD	
C[C@]1(CNC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)OCCc2sccc21	811945812	IGISTSNJRPMQLQ-GOSISDBHSA-N	438.531	1.975	50	20	IDGD	
CSCC[C@@H](NC(=O)c1ccco1)C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	812727157	OSZUIXSGMMKYOR-OAHLLOKOSA-N	440.547	1.525	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)[C@H]2CC(=O)N(c3ccc(F)cc3F)C2)cc1	812728652	UKOYWLQJKOWION-LBPRGKRZSA-N	438.456	1.711	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2cccc(C(F)(F)F)n2)cc1	813033063	COXZWFOGAZUQNE-UHFFFAOYSA-N	431.396	1.433	50	20	IDGD	
CCNC(=O)c1ccc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)N(C)C)c(C)c1	815751883	SJPLRNGXVNFPMR-UHFFFAOYSA-N	447.517	1.077	50	20	IDGD	
Cc1nn(-c2ccccc2)cc1NC(=O)C(=O)NNc1ccccc1S(=O)(=O)N(C)C	815752304	MZKRQOZEBUCLQL-UHFFFAOYSA-N	442.501	1.513	50	20	IDGD	
Cc1ccc(-c2nc3cc(F)ccc3n2C)cc1NC(=O)C(=O)NNC(=O)[C@H]1CCCO1	815779971	DTSSNDJJIYORHS-GOSISDBHSA-N	439.447	1.953	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)c2c(I)cnn2C)cc1	816781845	ZRHSRADAKSHDLM-UHFFFAOYSA-N	449.274	1.032	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NCC(=O)NNc2cccc(Cl)n2)c1	817006456	KOJPUMUSXYZOCI-UHFFFAOYSA-N	439.925	1.639	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)OCC(=O)NNC(=O)[C@@H]3COc4ccccc4O3)n[nH]2)cc1	839240066	XKIUJRPVBPUVBK-IBGZPJMESA-N	436.424	1.529	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)CCNS(=O)(=O)c1ccc(F)c(F)c1	913459256	DKALKUBUBZTPLT-UHFFFAOYSA-N	441.456	1.422	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)Cc1cc2ccccc2nc1O	915636510	NTRJVXXAFOZADT-UHFFFAOYSA-N	427.486	1.546	50	20	IDGD	
O=C(NC[C@H](c1ccc(F)cc1)N1CCOCC1)NNC(=O)[C@H]1COc2ccccc2O1	915898074	QCRKEAKGDACDOF-YLJYHZDGSA-N	444.463	1.369	50	20	IDGD	
CC(=NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1ccc2c(c1)CC(=O)N2	915938624	CKAKNYZOJASQBV-UHFFFAOYSA-N	442.497	1.356	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CC(=O)N(c2ccc(Cl)cc2)C1)c1csc(N2CCOCC2)n1	916734420	FZEPYZHSXISPDA-GFCCVEGCSA-N	449.920	1.447	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)[C@@H](C)NS(=O)(=O)c1cccs1	917908561	NGNPZNOELBTPTL-GFCCVEGCSA-N	427.504	1.040	50	20	IDGD	
CN(CC(=O)NNC(=O)Cn1ccc2ccccc21)S(=O)(=O)c1ccc(Cl)cc1	918293170	WXJIGANRCNSGJH-UHFFFAOYSA-N	434.905	1.763	50	20	IDGD	
Cc1cnn(CCC(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)c1	918296732	ZSVOFSZUHYZLTA-UHFFFAOYSA-N	441.513	1.521	50	20	IDGD	
O=C(CNC(=O)c1cccc([N+](=O)[O-])c1)NNC(=O)c1ccc(F)cc1Br	918340259	HAUWGTBIZGOPTL-UHFFFAOYSA-N	439.197	1.687	50	20	IDGD	
O=C(Cc1ccc2c(c1)OCO2)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	918550524	VCYPTZUXYIVHMY-UHFFFAOYSA-N	445.497	1.594	50	20	IDGD	
CC(C)C[C@H](NC(=O)c1ccc(Cl)cc1)C(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1	919885914	PQSURZUHDUXPRQ-CABCVRRESA-N	444.941	1.002	50	20	IDGD	
CN(C)C(=O)Cn1cc(C(=O)NNC(=O)c2cc3c(s2)CC[C@H](C(C)(C)C)C3)nn1	919926225	KZKDUZBBBRKGCU-ZDUSSCGKSA-N	432.550	1.654	50	20	IDGD	
Cc1ncc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)s1	920042936	AENDWGWSIOROOV-UHFFFAOYSA-N	437.547	1.770	50	20	IDGD	
Cc1c([C@H](C)NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cnn1C	1317882284	DIWMZBJUFMICLU-ZDUSSCGKSA-N	434.522	1.218	50	20	IDGD	
CC(=O)NCCc1ccc(S(=O)(=O)NNC(=O)c2cncn2-c2ccccc2)s1	1319518983	UQLBTUQLSAKWKL-UHFFFAOYSA-N	433.515	1.236	50	20	IDGD	
Nc1cnnc(NNC(=O)N[C@@H]2CCN(c3cccc(Br)c3)C2=O)c1Cl	1320869709	PRVPSCXELFEWDW-LLVKDONJSA-N	440.689	1.906	50	20	IDGD	
CC(C)(C)c1ccc(NNC(=O)CNS(=O)(=O)c2cccc(Br)c2)nn1	1324598896	NTNYQDZQTGXNCI-UHFFFAOYSA-N	442.339	1.958	50	20	IDGD	
CCOc1ccc(NC(=S)NNC(=O)c2cc3c(c(S(N)(=O)=O)c2)CCC3)cc1	1345088814	CWEWWVTXATWEJM-UHFFFAOYSA-N	434.543	1.853	50	20	IDGD	
O=C(c1c(Cl)ccc2c1OCO2)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1777798956	ZTZUJMQGFOAGQS-SGTLLEGYSA-N	431.272	1.112	50	20	IDGD	
Cc1nc[nH]c1CSCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1778914400	RWKBVOROKJJIEA-GDBMZVCRSA-N	449.346	1.472	50	20	IDGD	
CCCC(=O)N[C@H](C)C(=O)N1CC[C@]2(CN(C(=O)[C@@H](C)CBr)CCO2)C1	1779250238	QLWAYXXMTJGOMN-PMUMKWKESA-N	432.359	1.152	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)c(OC)c1	1779299570	BSBVHZIMMKYIAR-OAQYLSRUSA-N	436.581	1.999	50	20	IDGD	
C[C@H](Nc1ccccn1)C(=O)N1CC[C@@]2(CN(C(=O)CCBr)CCO2)C1	1779321732	OHAHENNRMASNQY-KBXCAEBGSA-N	425.327	1.497	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2)c1cc(-c2ccccc2)[nH]n1	1780148815	UJYLYMLSWRPNAC-WOIUINJBSA-N	446.935	1.804	50	20	IDGD	
CCc1cc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](F)Br)C2)n(C)n1	1780773968	QLTFJDPDMZDNSO-IIDMSEBBSA-N	445.333	1.801	50	20	IDGD	
CCOc1cnc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@](C)(Cl)CCl)C3)C2)cn1	1781227892	FVHKRLFVRUDWTR-MSOLQXFVSA-N	431.320	1.555	50	20	IDGD	
O=C(c1ccc2ncoc2c1)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781330140	RCBIMIGXZNNKBS-WMLDXEAASA-N	426.242	1.962	50	20	IDGD	
O=C(c1cnc2ccc(F)cn12)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781333878	TTYFAWGYIQSLBB-WMLDXEAASA-N	443.248	1.607	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cn1ccc(C)n1)C2	1781900517	DLGIFIOVOVXCNS-FRQCXROJSA-N	441.370	1.879	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1nccc3[nH]ccc13)C2	1782172691	KDEYPWHWQTYNRY-LUQKVYGDSA-N	434.924	1.944	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1cnc(C)s1)C2	1782179042	RTTPMEFOWPQAKU-FRQCXROJSA-N	429.970	1.762	50	20	IDGD	
O=C(c1n[nH]c2c(Cl)cccc12)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1782215599	OPVJEDBFENMYRV-UGSOOPFHSA-N	427.288	1.260	50	20	IDGD	
CC(C)[C@H](O)C(=O)N1CCO[C@]2(CCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1	1782862050	OCCYVDXOXCMQMM-VVMXEWNRSA-N	433.455	1.719	50	20	IDGD	
C[C@H](N[C@H](C(=O)N1CC[C@@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1)C1CC1)c1ccccc1	1782887479	JMKXIDLTCSSZKD-BOWONNERSA-N	449.979	1.545	50	20	IDGD	
CO[C@H](C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](C)Br)C2)C1)c1ccccc1	1783532882	ONBHTGVEPRGRHQ-SIXWZSSISA-N	425.323	1.987	50	20	IDGD	
CC(C)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CC[C@H]4CCC(=O)N4C3)C[C@@H]21	1783851729	GOFWBXMFDXOMFP-ATIWLJMLSA-N	439.984	1.632	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)Cc3cc([N+](=O)[O-])ccc3F)CCO2)C1	1783873171	LVFFKOMJLGIXQI-KXBFYZLASA-N	443.859	1.360	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccnc(Br)c3)CCO2)C1	1783878013	UNXXTNMPAIFVGQ-SUMWQHHRSA-N	446.729	1.541	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H]1CCCCC1(F)F)CCO2	1783933193	DVPYWIMHBDECJR-BEFAXECRSA-N	430.496	1.015	50	20	IDGD	
CC(C)(C)OC(=O)NC(C)(C)C(=O)N1CCO[C@@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783943074	SSWSIWVESSDFTB-GOSISDBHSA-N	438.352	1.923	50	20	IDGD	
N#Cc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]3C2)c(Cl)c1	1784092208	KJAKJLMOBVQXDE-SDNTUTLCSA-N	426.300	1.405	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(-c4cc[nH]n4)cc3)C[C@@H]21)[C@@H](O)CCl	1784092613	RABYUWGXSMZUCC-CAMMJAKZSA-N	432.908	1.270	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](NC(C)=O)C(C)(C)C)[C@H]2C1	1784313137	SANFHXPFVNVVOW-JCECYMMASA-N	429.989	1.924	50	20	IDGD	
Cc1nn(C)cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)CBr)C[C@@H]21	1784720793	IVRRVSLVZVWNHN-MZGVZZPPSA-N	427.343	1.353	50	20	IDGD	
C[C@](O)(C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CO[Si](C)(C)C)C[C@@H]21)C(F)(F)F	1784875043	XQUCOJRPFYCCQW-QCQGSNGOSA-N	426.508	1.131	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ncc(F)cc3F)C[C@@H]21	1786401186	SXHGKUHNSQWXIT-JKOKRWQUSA-N	432.265	1.738	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)COc3ccc(F)cc3)[C@H]2C1	1786491542	CKKPDIYWIAYKFI-PYTWLRIVSA-N	443.313	1.968	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4c(n3)NC(=O)CC4)[C@H]2C1	1787265163	CPMBFJHDIYNZEO-CUSZFKRNSA-N	448.951	1.967	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(C(F)(F)F)c[nH]3)[C@H]2C1	1787592154	RIMOZCALZFVHLO-NHULGOKLSA-N	437.846	1.881	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4c(c3)CNC4=O)[C@H]2C1	1788441175	MZOFABNFGAQZEW-QZHFEQFPSA-N	433.936	1.931	50	20	IDGD	
CCOC(=O)c1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](Cl)CC)C[C@@H]32)ccn1	1789339067	ZXJOQDWQTOBJLV-OVWQWFNUSA-N	437.924	1.869	50	20	IDGD	
C[C@@H](C(=O)Nc1ccc(C2(NC(=O)CCC(=O)NN(C)C)CCC2)cc1)N1C[C@H]2C[C@H]2C1	1789446113	YSLGNZIEDVMAMJ-OKZBNKHCSA-N	441.576	1.834	50	20	IDGD	
CC(C)(C)[C@H](O)C(=O)NC1(c2ccc(NC(=O)c3cnccc3C(=O)NN)cc2)CCC1	1789519942	SHJNLRGVUDUNPJ-GOSISDBHSA-N	439.516	1.840	50	20	IDGD	
CN1CCC(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]3C2)CC1	1789920918	HPDCBTYITMCJLQ-JKQORVJESA-N	434.350	1.389	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CSc3nc[nH]n3)C[C@@H]21	1790963272	BAEQGDHMHPEHTP-RVMXOQNASA-N	446.371	1.050	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4n[nH]cc4c3)C[C@@H]21	1791057270	JYRHGDATLPBKSG-ONQXIZJVSA-N	435.322	1.940	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc4ccoc34)C[C@@H]21	1791294011	YBINRNGEMNRYCT-WDSOQIARSA-N	442.516	1.399	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC1(c2ccc(NC(=O)COc3cccnn3)cc2)CCC1	1791849820	BRDFZDRKWNUHCM-UHFFFAOYSA-N	440.504	1.363	50	20	IDGD	
CCN(CC)C[C@@H](C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)CBr	1792872132	NLOIYGPLNYJRSI-OVYGPGRDSA-N	432.403	1.585	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@](C)(Cl)CCl)C2	1792874543	QZLFVFWEKBNMBY-BJIWRROBSA-N	430.170	1.843	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C(=O)C1CC1	1793019239	JYDCLQIDAONQBR-XGUBFFRZSA-N	427.929	1.736	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C[C@@H]1COc2ccccc2O1	1793482812	XKBMDQHVGWHTAM-XMTFNYHQSA-N	444.532	1.228	50	20	IDGD	
C[C@H](NNc1ccccc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCBr	1795113169	MISFVGRLVWBZRZ-AFIMGQEJSA-N	439.354	1.366	50	20	IDGD	
C[C@@H](Oc1ccccn1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCBr	1795116903	FGWDHPREWSAZLW-VWPFQQQWSA-N	426.311	1.224	50	20	IDGD	
CC(C)(C)c1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)cn1	1796189616	IITWBKAYLSRNEI-ACDBMABISA-N	435.333	1.625	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C=C/C(=O)c1cccs1	1796448475	VEWXPIQUSQFIOI-CBHLTWEASA-N	426.922	1.330	50	20	IDGD	
COc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)C(Cl)Cl)C3)n1	1796719430	PHCWJCLEGFSXIQ-BZBKMWRSSA-N	433.248	1.005	50	20	IDGD	
C[C@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@](C)(Cl)CCl)C2)[C@@H]1SC(=N)NC1=O	1796881163	ZIFJLSDWHABODS-JJFBLWEHSA-N	435.377	1.663	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CS[C@H]1CCCCO1	1797791713	QGNYPAWZXXEMGV-BIYBGRMPSA-N	449.411	1.867	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(N3CCOCC3)cn1)C2	1799264509	OVNRZMFBBQTYTD-HIRMHNASSA-N	436.940	1.139	50	20	IDGD	
C[C@H](Nc1ccccn1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@](C)(Cl)CCl	1799275687	AFTAEBMWXKNDTR-WXZWTWHISA-N	429.348	1.708	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c(c1)CC(=O)N3)C2	1799277525	WXXVTFOFVJJEEN-HXFPYSNGSA-N	440.327	1.621	50	20	IDGD	
CCOCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN(C)NC(=O)NCc1ccccc1	1799864711	KBZRANJXIJTKGY-REPLKXPHSA-N	431.537	1.007	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2cccnn2c1	1800006635	NMAJHZSVSKWYGA-JJAZEVLHSA-N	435.322	1.569	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](NC(C)C)C(C)C)C2	1800640155	WWHGUULTOYYYQI-BPKGMFCQSA-N	432.403	1.772	50	20	IDGD	
CCSc1cccnc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](Cl)COC	1800978810	KXYHZGSJRQQFFQ-FQLMCAECSA-N	427.954	1.651	50	20	IDGD	
C[C@H](Oc1ccccn1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@](C)(Cl)CCl)C2	1801366211	CLKQABOIRVJBDV-MABMQTIPSA-N	430.332	1.675	50	20	IDGD	
Cc1cc(Cl)cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)c1	1803631413	FVFUGZJAELLNET-ACDBMABISA-N	426.709	1.894	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)CN(C)C(=O)C(=O)O)[C@H]1c1cccnc1	1803694770	LPKGCQUXKSFLKI-ZOBUZTSGSA-N	438.912	1.038	50	20	IDGD	
Cn1cccc(C(=O)NC[C@@H]2CCN(C(=O)CO[Si](C)(C)C)[C@@H]2c2cccnc2)c1=O	1803833943	JSOCSQHUEZEEJK-FXAWDEMLSA-N	442.592	1.951	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H](C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](O)CCl)C3)C[C@H]2C[C@H]21	1804400992	KCPJBXKFWXFARO-YRXKBASHSA-N	441.956	1.622	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)c2ccccn2)[C@@H]1c1cccnc1	1805446973	SPFWJPRKGJRCLG-UZLBHIALSA-N	445.483	1.109	50	20	IDGD	
CC(C)=CCCC(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1807367145	QOVMZVOXDXIPJW-NZQKXSOJSA-N	435.333	1.827	50	20	IDGD	
CC(C)=NO[C@@H](C)C(=O)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1	1809980798	UPGBYCDYFVHIJW-KRWDZBQOSA-N	429.326	1.012	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2ccc3ncnn3c2)[C@@H]1c1cccnc1	1810060025	NVJNRTJHKFIJEC-AYBZRNKSSA-N	442.907	1.698	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)[C@H]2CC2(F)F)[C@@H]1c1cccnc1	1810302586	LWSXZNYXRBZSMR-IAOVAPTHSA-N	444.442	1.055	50	20	IDGD	
Cc1noc(CC(=O)N2CC[C@H](CNC(=O)[C@@H](C)Br)[C@H]2c2cccnc2)n1	1812865371	XCRVNKDMRCCIFC-JDSLSITLSA-N	436.310	1.805	50	20	IDGD	
Cc1ncsc1C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1813070383	IGWSFPZQOXVWNT-VQIMIIECSA-N	444.561	1.539	50	20	IDGD	
CC(C)=NO[C@H](C)C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1813073734	SNGMUVCDDWBSBR-BLIXFSHQSA-N	446.552	1.261	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)C2CCC(O)CC2)[C@@H]1c1cccnc1	1813196912	BKAAIJPPXKEIDI-UOCVTNFKSA-N	445.564	1.012	50	20	IDGD	
C[C@@H](CBr)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CN2CCOC2=O)[nH]n1	1814778361	GJFZGMVAQAPMRW-WCQYABFASA-N	442.314	1.885	50	20	IDGD	
CNc1ccc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)CCC(=O)NN(C)C)CC3)cc1	1814880813	CAQQZZIZLYQIDX-OAHLLOKOSA-N	444.561	1.784	50	20	IDGD	
CN(CC(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1)C(=O)c1ccccc1	1815086124	BRECWPBXUJPAOI-IRXDYDNUSA-N	447.923	1.774	50	20	IDGD	
CC(C)C1(C(=O)N[C@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)CCC1	1815361449	FJRBLALLXIHIAY-INIZCTEOSA-N	441.362	1.875	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1cnoc1C1CC1	1816655602	FSHFLFLVLRRJCI-GOSISDBHSA-N	449.276	1.575	50	20	IDGD	
COc1ccc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@H](O)CCl)CC3)c(OC)c1	1821931461	LNEVGHZQFBCSHX-IINYFYTJSA-N	439.921	1.986	50	20	IDGD	
C[C@H](Br)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN2CCOCC2)[nH]n1	1822184822	WRUAYNVPUYQNSV-JSGCOSHPSA-N	428.331	1.517	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@]2(C)CC2(F)F)[nH]n1	1822417155	BJIOFGWRIUKOPQ-ACJLOTCBSA-N	426.468	1.820	50	20	IDGD	
O=C(Cc1cnccn1)N[C@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1	1822998260	BAKKLXOJPDDDDX-SDBXPKJASA-N	428.287	1.778	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H]3CNC(=O)C3)sc2C1	1825190983	GEJFWOHWOVGKHJ-KXUCPTDWSA-N	429.340	1.222	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cn(C)nc2OC)CC1	1825734515	JHBQMVSEIJLOGD-SJORKVTESA-N	426.945	1.916	50	20	IDGD	
O=C(c1c[nH]c(=O)cn1)N1CCC([C@@H]2CCCCN2C(=O)CCBr)CC1	1826359219	YHYZGRHIAPTRKM-HNNXBMFYSA-N	425.327	1.788	50	20	IDGD	
C[C@H](C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@](C)(Cl)CCl)CC2)n1cnnn1	1826990241	XTEKNBMQNYYHBH-CEFVDNRUSA-N	432.337	1.539	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@@H](O)CCl)CC3)c1	1827741927	WPJJGUCMOZZPNS-ZFWWWQNUSA-N	436.921	1.927	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)CCl)CC2	1827968980	DXUPOBSJMUADAX-PWSUYJOCSA-N	446.957	1.570	50	20	IDGD	
Cc1n[nH]cc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1	1828924296	OPIICWYOQUGORP-LJQANCHMSA-N	439.520	1.264	50	20	IDGD	
CCCC(=O)N[C@H](C)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830364497	MLQXQSAHVQNLMM-FOIQADDNSA-N	431.961	1.013	50	20	IDGD	
Cc1nscc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)CBr)CCO2	1830534962	FYXGMKVOXZQEII-SJKOYZFVSA-N	446.367	1.553	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)cn1	1830538100	VXILWQAHNONWQG-IFXJQAMLSA-N	440.338	1.491	50	20	IDGD	
CC1(C)CCC(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)CC1	1830733392	KZPIDOZHLBVDCR-UTKZUKDTSA-N	430.973	1.649	50	20	IDGD	
COc1ccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)cc1C	1832090515	VVEDVIXJRPDIAK-UYAOXDASSA-N	428.888	1.537	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2CCOC2)CC1	1832376555	KHACKFHMCXMAEO-SQPFYLMHSA-N	443.548	1.777	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3ccnc(OC)c3)CCO2)C1	1832595958	MHTSZSHXGCGWDT-UTKZUKDTSA-N	439.940	1.497	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccccc3O)CCO2)C1	1833751877	HTFUXLSNJNJSNR-AUUYWEPGSA-N	441.322	1.493	50	20	IDGD	
Cc1cncc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)c1	1834285423	PIRPLRXPZJSUSK-WMLDXEAASA-N	430.274	1.151	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3sc(N)nc3C)CC2)CC1	1834755260	HLWGCGBPPGTUGU-OAHLLOKOSA-N	444.001	1.473	50	20	IDGD	
CC(C)n1nccc1C(=O)N1CCOC[C@@]2(CN(C(=O)CCBr)CCO2)C1	1834823473	WKOUKLRGSKNEDX-GOSISDBHSA-N	443.342	1.319	50	20	IDGD	
C[C@@]1(C(=O)N2CCOC[C@]3(CN(C(=O)CCBr)CCO3)C2)CC=CCC1	1834826323	LIKJPZIMJLYLAY-MOPGFXCFSA-N	429.355	1.974	50	20	IDGD	
CN(CC(=O)N1CCC(N2CCC(NC(=O)[C@@H](F)Cl)CC2)CC1)C(=O)OC(C)(C)C	1835080083	ICCSNMIZGSPJBB-QGZVFWFLSA-N	448.967	1.959	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1)c1ccc(CO)o1	1835929265	RLNUVRYMIGYEBY-INIZCTEOSA-N	446.317	1.648	50	20	IDGD	
Cn1cnc(C(=O)N2CCC(N3CCC(NC(=O)[C@](C)(Cl)CCl)CC3)CC2)c1	1836398758	STWPMCJQGRAGCF-LJQANCHMSA-N	430.380	1.842	50	20	IDGD	
O=C(c1c[nH]c2ncccc12)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836717740	IHYVAFDYKNLREU-SFHVURJKSA-N	434.924	1.775	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1	1839020775	URYXWVFEPZMSIE-KXBFYZLASA-N	447.315	1.018	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(O)c([N+](=O)[O-])c3)C2)C1	1839147506	SWLNDFGXORXMTG-AUUYWEPGSA-N	441.868	1.388	50	20	IDGD	
CCc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)cn1	1839197812	JDDUEDAAVLVWIG-CRAIPNDOSA-N	444.301	1.405	50	20	IDGD	
CCc1ncccc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839197926	MTZCHBLFMHTKEF-QAPCUYQASA-N	444.301	1.405	50	20	IDGD	
C[C@]1(C(=O)N2CCOC[C@@]3(CN(C(=O)[C@H](F)Br)CCO3)C2)CC=CCC1	1839203888	ZQLSHTUKWHVGGC-JCGIZDLHSA-N	433.318	1.880	50	20	IDGD	
COc1ccc(F)c(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)c1OC	1839374936	QDNPTKNGVGIAQW-VQIMIIECSA-N	448.850	1.447	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H]3C[C@H]4CC[C@@H]3O4)CCO2)C1	1840050333	FYJGGQQQYKYTDK-HIGHGGLBSA-N	435.348	1.247	50	20	IDGD	
COc1cc(C#N)cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)c1	1840188780	BQGSDIXNJJTJRO-LJQANCHMSA-N	442.299	1.441	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)c1ccccn1)CCO2	1840330154	NJJJHVNXIDMYBA-KKSFZXQISA-N	439.940	1.069	50	20	IDGD	
Cc1ncc(CC(=O)N2CCO[C@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)s1	1840399630	DVFABIWAEKEDTE-LJQANCHMSA-N	441.626	1.302	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H]1CC(=O)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1	1841350110	IPLNDSRCVFKQBE-LSDHHAIUSA-N	429.945	1.579	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC2(CCCN2C(=O)c2cncc(S(C)(=O)=O)c2)C1	1842188213	RXNJOVBWBPUYHL-GFCCVEGCSA-N	444.351	1.333	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)c2ccn(C)n2)C1	1842467554	IVYBGYSIICXUAB-UHFFFAOYSA-N	427.417	1.384	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2cc(C(F)F)no2)C1	1843117418	SRYOLSLHIXPHPD-FOKLQQMPSA-N	434.403	1.563	50	20	IDGD	
COCCOCCOCCC(=O)N1CC2(CCCN2C(=O)[C@](C)(Cl)CCl)C1	1845173163	XXVVTXLZAKDMMP-QGZVFWFLSA-N	425.353	1.496	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)c2cnc3ccc(Cl)cc3c2)C1	1845610492	OWJPJGCHJNMJOD-UHFFFAOYSA-N	449.703	1.699	50	20	IDGD	
N=C(N)SCC(=O)N1CC2(CCCN2C(=O)[C@@H](Br)Cc2ccccc2)C1	1845940924	RCHRGGHQODIKOE-AWEZNQCLSA-N	439.379	1.823	50	20	IDGD	
Cn1cncc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1848095949	YZYWFNOERUZYRE-IHRRRGAJSA-N	425.917	1.368	50	20	IDGD	
COc1ccc(C)cc1N1C[C@H](C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)CC1=O	10158776	KBSRCNQTBKNOCN-OAHLLOKOSA-N	449.467	1.709	50	20	IDGD	
COC(=O)c1ccc(C(=O)OC)c(S(=O)(=O)NNC(=O)c2cc3c(s2)CCC3)c1	16094918	XYZPALDIUDDQLT-UHFFFAOYSA-N	438.483	1.433	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc(F)cc1)NNC(=S)NCCc1cccs1	21125390	GNRMDVHGBIXRPF-UHFFFAOYSA-N	430.552	1.294	50	20	IDGD	
CSc1cccc(N2C[C@@H](C(=O)NNC(=O)[C@@H]3COc4ccccc4O3)CC2=O)c1	26974249	HOCSSXHDLOVVGL-UGSOOPFHSA-N	427.482	1.749	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)[C@H](NC(=O)c1ccccc1)c1ccccc1	725740923	JPGQSPZMLMOHLB-LJQANCHMSA-N	436.493	1.797	50	20	IDGD	
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC[C@@H](C(=O)NNC(=O)c2c[nH]c3ccccc23)C1	728203110	FWSHTNZQWANGPI-CQSZACIVSA-N	444.517	1.370	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)c2sccc2S(=O)(=O)Nc2cnn(C)c2)cc1	728204400	KVPRBJJCOLKUBM-UHFFFAOYSA-N	448.530	1.464	50	20	IDGD	
CC(C)NC(=O)NNS(=O)(=O)c1ccc(S(=O)(=O)N2C[C@@H](C)C[C@@H](C)C2)cc1	728263364	XECQEEOZWDRBCD-OKILXGFUSA-N	432.568	1.254	50	20	IDGD	
CCCS(=O)(=O)Nc1ccccc1C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	728889797	FOHWSKLTOMSSMA-UHFFFAOYSA-N	446.533	1.306	50	20	IDGD	
CC(C)c1ccc(S(=O)(=O)N2CCN(C(=O)NNC(=O)Cc3cccnc3)CC2)cc1	728956959	DEIUUOVQVWQXCN-UHFFFAOYSA-N	445.545	1.495	50	20	IDGD	
CC[C@H](CC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)C(C)C	729301814	MGHRKUACNKYBKZ-GOSISDBHSA-N	439.578	1.860	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C1CCN(S(=O)(=O)c2ccc(C#N)cc2)CC1	731491472	LKJJXUHDECJGGF-UHFFFAOYSA-N	442.497	1.429	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)c2ccc(=O)n(Cc3ccccc3Cl)c2)C[C@@H](C)O1	732261132	KOMORWZDNIJSSH-HZPDHXFCSA-N	446.935	1.810	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)[C@@H](Cc1ccccc1)NC(=O)c1cccnc1	732303934	OOTMOQLHLQQJRH-LJQANCHMSA-N	438.509	1.970	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)N[C@H](Cc2ccccc2)CN2CCOCC2)cc1	732476162	ACQRTNVRISXTRA-OAQYLSRUSA-N	440.544	1.902	50	20	IDGD	
CSCC[C@@H](NC(=O)Cc1ccccc1)C(=O)NNC(=O)[C@H]1COc2ccccc2O1	732749664	CXFXNMZZKKGIAJ-VQIMIIECSA-N	443.525	1.454	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)/C(=C/c1ccco1)NC(=O)c1ccccc1	732952458	XOILSSOALDZWQM-UYRXBGFRSA-N	443.423	1.487	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N[C@H](C)c2nncn2C)cc1	733132847	XWMBNFUGSKMRMY-DWKHYPNZSA-N	448.487	1.347	50	20	IDGD	
C[C@]1(NNC(=O)N[C@H]2CCN(c3ccc(C(F)(F)F)cc3)C2=O)CCS(=O)(=O)C1	733851461	ZNUBBGQESIDRNW-BBRMVZONSA-N	434.440	1.192	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)NC1CCN(S(=O)(=O)Cc2ccccc2)CC1	735584555	WUXVDHVOTLIBLG-UHFFFAOYSA-N	448.520	1.693	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNS(=O)(=O)c1ccc2c(c1)N(C(C)=O)CCC2	736063220	FKEPSQCOXVSVBU-UHFFFAOYSA-N	447.513	1.773	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)[C@H]2CC(=O)N(Cc3ccccc3)C2)cc1C	736729938	NAJYFNFOQZFRKY-INIZCTEOSA-N	443.525	1.972	50	20	IDGD	
CN(CC(=O)NNC(=O)CCCc1ccccc1)S(=O)(=O)c1cccc([N+](=O)[O-])c1	737542092	FJQZIDNIFHTAKX-UHFFFAOYSA-N	434.474	1.386	50	20	IDGD	
CCC(CC)CNC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	739033955	HYHVCSNKAJJWOU-UHFFFAOYSA-N	440.566	1.407	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)[C@@H]1CN(Cc2ccccc2)CCO1	741424274	BMOQLKPEJCVFEI-BEFAXECRSA-N	427.461	1.828	50	20	IDGD	
CCN1CCC[C@H]1CN1C[C@H](C(=O)NNC(=O)c2cccc(Br)c2)CC1=O	742773255	RTFHMOXYGCUWFM-ZBFHGGJFSA-N	437.338	1.543	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2ccc(C(=O)O)c(Cl)c2)c1	743252524	DBTDSKWHIWOXPY-UHFFFAOYSA-N	432.863	1.065	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cc(Br)ccc2O)ccc1OCC(N)=O	743731871	BAWNOTHWHLJGMP-UHFFFAOYSA-N	438.234	1.102	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CN2CCN([C@@H](CO)c3ccc(Cl)cc3)CC2)c1	744399042	DNYOTBLMZFILEI-FQEVSTJZSA-N	441.919	1.324	50	20	IDGD	
COC[C@@H](C)n1c(C)cc(/C=C(\C#N)C(=O)OCc2nc(CS(C)(=O)=O)no2)c1C	744459960	HFSDFFVAFCBHIX-DFWYYUMKSA-N	436.490	1.890	50	20	IDGD	
C=CCSCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	745280811	ACFPCUJSOKRXGQ-UHFFFAOYSA-N	426.564	1.724	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)NCCCN2CCC[C@@H](C(N)=O)C2)c(C)n1-c1ccccc1	745831319	FSTKCHCIGNPANR-GOSISDBHSA-N	440.548	1.626	50	20	IDGD	
C[C@H]1C[C@@H](NC(=O)NNC(=O)c2ccc(Cl)cc2Cl)C(=O)N1c1cnn(C)c1	745916555	CSFJBVKLRBIZBN-LKFCYVNXSA-N	425.276	1.865	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)[C@@H]1[C@@H](C)OC(C)(C)N1C(=O)OC(C)(C)C	746094168	CPCRBTAPHFQVLV-DYVFJYSZSA-N	437.493	1.982	50	20	IDGD	
COc1ccc(C(=O)N2CCC(NC(=O)NNC(=O)Cc3ccncc3)CC2)cc1OC	747584265	MLEIFUQPCWIRKE-UHFFFAOYSA-N	441.488	1.277	50	20	IDGD	
C[C@H](CN1CCCCCC1)C(=O)NNC(=S)Nc1cccc(S(=O)(=O)N(C)C)c1	747725429	MPMUEGICGLIAHO-OAHLLOKOSA-N	441.623	1.767	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1)[C@H]1CC(=O)N(C2CC2)C1	747779678	VRQPODBWTGONSA-UNMCSNQZSA-N	432.524	1.772	50	20	IDGD	
NC(=O)COc1ccc(C(=O)NNc2ccc(S(=O)(=O)Nc3nccs3)cc2)cc1	747942519	AKWTUOCQCKTXCQ-UHFFFAOYSA-N	447.498	1.565	50	20	IDGD	
NC(=O)[C@@H]1CC(C(=O)NNc2nc(-c3ccccn3)nc3c2CCC3)=NN1c1ccccc1	747982487	BSXUOLMKFPXUTO-IBGZPJMESA-N	442.483	1.591	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)NCC2CCN(S(C)(=O)=O)CC2)c1	749017894	YQVJPRAWGRTVHX-UHFFFAOYSA-N	440.566	1.499	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)c1ccc(S(=O)(=O)CCOC)cc1	749561996	UIMBSTNMGKVBIS-UHFFFAOYSA-N	444.513	1.480	50	20	IDGD	
NC(=O)c1ccc(/C=C\C(=O)N2CCC[C@@H]2C(=O)NNC(=O)CCc2ccccc2)cc1	749800082	JIDXUMIRHWROJM-UMDONVSZSA-N	434.496	1.570	50	20	IDGD	
C[C@H](C(=O)NNc1nc(Br)cn2ccnc12)N1C(=O)NC2(CCCC2)C1=O	750250471	SZLUKQXVRFJRLT-SECBINFHSA-N	436.270	1.188	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2cccn2Cc2ccncc2)ccc1Cl	751294781	RHSJJVHNWJVRGJ-UHFFFAOYSA-N	433.877	1.307	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NN=C1CN(C)C[C@@H]1C)N(S(C)(=O)=O)CC2	752163333	VGKIQOKNGQPFPJ-GUYCJALGSA-N	438.550	1.006	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(Br)cc2)o1	752522976	LHRRSZZDGXEJLP-UHFFFAOYSA-N	430.280	1.432	50	20	IDGD	
CC[C@@H](NC(=O)NNC(=O)[C@@H](C)Oc1ccc2ccccc2c1)C(=O)N1CCOCC1	753057041	KOABKBXOCICDOC-DNVCBOLYSA-N	428.489	1.575	50	20	IDGD	
COc1cccc([C@H](C)CC(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1	753540222	VUCGZZODIKDKBR-KUHUBIRLSA-N	428.441	1.719	50	20	IDGD	
COCCOCCS(=O)(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1	754748405	BWPWWUWLEMGGMH-OAQYLSRUSA-N	447.557	1.227	50	20	IDGD	
O=C1C[C@H](Cc2ccc(NC(=O)NNC(=O)c3cc(-c4ccccc4)[nH]n3)cc2)C(=O)N1	756815180	JBXMNVPYVIRQJI-HNNXBMFYSA-N	432.440	1.748	50	20	IDGD	
Cc1ccc2nc(-c3ccccc3)cc(C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)c2c1	758029690	MXQGTGHABCXJNU-CQSZACIVSA-N	426.498	1.909	50	20	IDGD	
CCCS(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)NC2CCCCC2)c(OC)c1	761265772	AYUQNIAOYXYBJS-UHFFFAOYSA-N	448.567	1.672	50	20	IDGD	
O=C(CSCC(F)(F)F)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	761487252	HGHGTLILHVJOFF-UHFFFAOYSA-N	438.903	1.901	50	20	IDGD	
C=CCNS(=O)(=O)c1cccc(C(=O)NNC(=O)CSc2ccccc2OC)c1	761624967	NJEFWXIXUFIJHR-UHFFFAOYSA-N	435.527	1.713	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N[C@@H]2C=C[C@H](CO)C2)cc1	761902067	ONPUUTDTVFNXDT-POVFRKGSSA-N	435.484	1.394	50	20	IDGD	
CNC(=O)c1ccc(OC)c(NC(=O)C(=O)NNC(=O)c2cc3ccccc3cc2O)c1	763527211	MUNXVPXOQUUQCC-UHFFFAOYSA-N	436.424	1.313	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cnc1Br	763571302	LWUYNOWXNRPIIT-ZDUSSCGKSA-N	435.234	1.078	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2ccc(CC(=O)N(C)C)cc2)c1	763646138	BVBJBLZOGXOQPO-UHFFFAOYSA-N	426.473	1.099	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccnn1-c1ccc(Cl)cc1	763646571	IDXDGENCBAIXSS-UHFFFAOYSA-N	443.847	1.699	50	20	IDGD	
Cc1ccc(Br)c(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)c1	763680971	HNSQTRFRGAFKNK-UHFFFAOYSA-N	431.246	1.794	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccc(-c2n[nH]c(C3CC3)n2)c1	763809596	XHGYDLDALQLWPE-UHFFFAOYSA-N	445.439	1.386	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(N3CCOC[C@@H]3C)cc2)cc1	763809747	OSATWJALQSDLRL-INIZCTEOSA-N	426.473	1.385	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)C(=O)Nc1nc2c(s1)COCC2	763852412	INQCSRXTWFOSLP-LBPRGKRZSA-N	440.481	1.922	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1cccc(OCCN(C)C)c1	763852765	YRPUOZDNQZPVTM-CQSZACIVSA-N	432.452	1.320	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccc(Oc2cccnc2)nc1	763873417	SRQNLRDPLHPYSL-ZDUSSCGKSA-N	439.403	1.961	50	20	IDGD	
CN(c1ccccc1NC(=O)C(=O)NNC(=O)Cc1ccc(Cl)cc1)S(C)(=O)=O	763932632	QBNAYKWWYCVUCD-UHFFFAOYSA-N	438.893	1.064	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)Nc1ccn(Cc2ccccc2)n1	764004990	QNUMMLWYJMWVKA-UHFFFAOYSA-N	445.277	1.432	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1cccc([C@H](C)N2CCOCC2)c1	764042350	HMOBCJWKTABMAN-HNNXBMFYSA-N	426.473	1.488	50	20	IDGD	
COC(=O)[C@@H]1CCCCN1C(=O)c1cccc(NC(=O)C(=O)NNC(=O)C2CCCC2)c1	764070592	MLEHIBHSFPTEBA-KRWDZBQOSA-N	444.488	1.130	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(n2cc(NC(=O)C(=O)NNC(=O)C3CCCC3)cn2)CC1	764077608	ROBJPKQKQUNQDF-UHFFFAOYSA-N	448.524	1.731	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(C)cc3)[nH]n2)cn1	764110398	IUEFMUXNGRJNIW-UHFFFAOYSA-N	438.444	1.205	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(Oc3ncccn3)cc2C)c1O	764130998	CYJGGQQYMMZETA-UHFFFAOYSA-N	437.412	1.691	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2O1)C(=O)Nc1cccc(Cl)c1-n1cccn1	764169108	UGXBYYNDCWSWRK-MRXNPFEDSA-N	425.832	1.615	50	20	IDGD	
COC(=O)Nc1cc(NC(=O)C(=O)NNC(=O)c2cccc3ncccc23)ccc1F	764258308	YVUJJOGIPOKJCG-UHFFFAOYSA-N	425.376	1.952	50	20	IDGD	
O=C(Cc1ccccn1)NNC(=O)C(=O)Nc1ccc(C(=O)NCc2ccccc2F)cc1	764264940	VXJKCQUXFNICRR-UHFFFAOYSA-N	449.442	1.479	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc(F)ccc2Br)c(N(C)C)n1	764270069	DMYYAVOWLBJCRK-UHFFFAOYSA-N	438.257	1.757	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)ccc1O)C(=O)Nc1cnn(-c2ccncc2)c1	764280733	SAPZINFBKCCEHF-UHFFFAOYSA-N	445.233	1.135	50	20	IDGD	
CCN(Cc1ccccc1NC(=O)C(=O)NNC(=O)c1c[nH]nc1C)C(=O)OC(C)(C)C	764295794	QSVMILSDEWLMAE-UHFFFAOYSA-N	444.492	1.875	50	20	IDGD	
CCOC(=O)c1c(F)cccc1NC(=O)C(=O)NNC(=O)C(F)(F)Oc1ccccc1	764379311	VPKZHBYBSTWBGO-UHFFFAOYSA-N	439.346	1.760	50	20	IDGD	
COC(=O)N(C)Cc1ccc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)cc1	764405322	RQTUZJLXDCNUOI-UHFFFAOYSA-N	446.485	1.469	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COCCO1)C(=O)Nc1ccccc1S[C@@H](Cl)C(F)(F)F	764424993	LYBVPSOZUIPQOX-LKFCYVNXSA-N	441.815	1.407	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@@H]2CCO[C@H](C(C)(C)C)C2)cc1	764509557	AEIYHELDNWZMCI-WBVHZDCISA-N	440.566	1.540	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2cc(C)c(C)c(S(=O)(=O)N3CCC(C)CC3)c2)n[nH]1	765587647	GCVGJNIGNKMCBE-UHFFFAOYSA-N	433.534	1.830	50	20	IDGD	
COc1ccccc1/C(C)=C/C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765733906	SSUGRCATRDLJNP-FBMGVBCBSA-N	436.512	1.704	50	20	IDGD	
CC(=O)N/C(=C/c1ccccc1)C(=O)NNC(=O)CN1CCN(Cc2ccc(C)cc2)CC1	765748722	PRHUCSJTRCYMTG-XQNSMLJCSA-N	449.555	1.437	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCN([C@H](C)c2nccs2)CC1	767002195	CWDGTUBRHKRNBD-CYBMUJFWSA-N	437.953	1.945	50	20	IDGD	
O=C(CCC(=O)c1ccc2c(c1)CCC(=O)N2)NNC(=O)CNC(=O)c1cccs1	767248739	ONTFRDYQIMSAJG-UHFFFAOYSA-N	428.470	1.173	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)Cn1cnc2sc(C)c(C)c2c1=O	767269471	UJVRAXYLSAMRLZ-UHFFFAOYSA-N	442.497	1.317	50	20	IDGD	
CS(=O)(=O)CC[C@@H](NC(=O)c1ccc(Cl)cc1)C(=O)NN=c1cc[nH]cc1Cl	768448739	QJXYLPMNOMCXCM-OAHLLOKOSA-N	445.328	1.487	50	20	IDGD	
CC[C@@H](Nc1c([N+](=O)[O-])c(C)nn1C)C(=O)NNc1c(OC)cccc1S(C)(=O)=O	768627708	FBYGMEXZYAAJIE-LLVKDONJSA-N	440.482	1.383	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)c2cccc([C@@]3(C)NC(=O)NC3=O)c2)o1	768977288	RHEVTGPHNDONGT-OAQYLSRUSA-N	427.461	1.251	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)CCCC[C@@H]3SC[C@@H]4NC(=O)N[C@H]34)nc21	770967603	XYXUNBYFKGMDTN-OBJOEFQTSA-N	448.553	1.456	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)Cn3c(S)nnc3-c3ccc(Cl)cc3)nc21	770971075	FXYYKKSJMUNMIO-UHFFFAOYSA-N	431.869	1.413	50	20	IDGD	
Cc1nc(NC2CC2)sc1C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	771026407	AOKDKAGPWDRHRL-UHFFFAOYSA-N	437.547	1.804	50	20	IDGD	
COc1ccccc1[C@]1(C)NC(=O)N(CC(=O)NNC(=O)c2cc3ccccc3o2)C1=O	771272806	DFQKUGPRVCGJOI-QFIPXVFZSA-N	436.424	1.670	50	20	IDGD	
O=C(COc1ccccc1Cc1ccccc1)NNC(=O)NCc1nnnn1CC1CC1	771374787	OXSVJPXXXFEZQX-UHFFFAOYSA-N	435.488	1.583	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=S)NCCc1ccc2c(c1)OCCO2	771540317	HGRZLGZDSCONPV-UHFFFAOYSA-N	448.932	1.465	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)c1cc(S(=O)(=O)NC(C)C)ccc1F	771990048	OJZBSEYQOCVPLP-LBPRGKRZSA-N	431.486	1.251	50	20	IDGD	
CC(C)(CCCO)CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	772630576	RHACUYMGBCBUGI-UHFFFAOYSA-N	440.566	1.604	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](CC(F)F)C(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772896979	DUWJJEZAWAQTQS-GFCCVEGCSA-N	448.854	1.652	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccc(C(F)(F)F)cn2)cc1	773667620	QRBBWYIJZHGDIC-UHFFFAOYSA-N	445.423	1.869	50	20	IDGD	
O=C(NNc1cnc2ccccc2n1)C(=O)Nc1cc(N2CCCS2(=O)=O)ccc1F	773722839	LSLCKIKVBOVASN-UHFFFAOYSA-N	444.448	1.391	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)nn1-c1ccc(Cl)cc1Cl	776292826	FHHQLLHRSOPRCE-SNVBAGLBSA-N	431.301	1.683	50	20	IDGD	
Cc1cc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)nn1[C@H](C)C1CC1	777192804	YCFVHLHYZBYHDV-FZKQIMNGSA-N	428.445	1.307	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNS(=O)(=O)c1cc(F)c(OC)c([N+](=O)[O-])c1	777595788	JWYLTTVPECIEEC-UHFFFAOYSA-N	443.409	1.530	50	20	IDGD	
COC(=O)c1ccccc1NNC(=O)C1CCN(S(=O)(=O)c2c(C)noc2C)CC1	777772601	FEWJQTSRTCODNE-UHFFFAOYSA-N	436.490	1.622	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)C1(NC(=O)NCc2ccccc2)CCCC1	778437045	TXJMNHFLTQAAPQ-UHFFFAOYSA-N	433.509	1.471	50	20	IDGD	
CCOC(=O)c1cc(F)cc(S(=O)(=O)NNC(=O)c2cc(Br)c[nH]2)c1	778557003	LDFOMNLLCUTKIW-UHFFFAOYSA-N	434.243	1.716	50	20	IDGD	
CN(C)[C@@H](C(=O)OCC(=O)NNC(=O)c1ccc(C#N)cc1)c1c(F)cccc1Cl	780108964	FYKJEDFPIOJDNI-GOSISDBHSA-N	432.839	1.958	50	20	IDGD	
CCOc1ccc(OCc2ccc(C(=O)NNC(=O)CN3CCN(C)C(=O)C3)cc2)cc1	780158186	BPMFLLQPXWJWSU-UHFFFAOYSA-N	440.500	1.199	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)NCCN3CCNC(=O)C3)c3ccccc3n2)cc1	781399614	LYLZPLIVUUPAJS-UHFFFAOYSA-N	446.511	1.586	50	20	IDGD	
CC(=O)N1CCN(Cc2ccccc2NC(=O)NNC(=O)c2ccc(Cl)nc2)CC1	782078135	RRANRNRDOUSFMU-UHFFFAOYSA-N	430.896	1.866	50	20	IDGD	
Cn1cccc1C(=O)NNS(=O)(=O)c1cc(C(=O)O)c(Cl)cc1Br	782463472	VUJACGBPJWCMPE-UHFFFAOYSA-N	436.671	1.763	50	20	IDGD	
CNS(=O)(=O)c1ccc(C)c(NC(=O)C(=O)NNc2ccccc2Br)c1	782983926	JNSHVUZILHCRLQ-UHFFFAOYSA-N	441.307	1.747	50	20	IDGD	
O=C(NNc1ncnc2ccsc12)C(=O)Nc1cccc(N2CCCS2(=O)=O)c1	783261331	FHAOJIYWPAIIOR-UHFFFAOYSA-N	432.487	1.313	50	20	IDGD	
CC[C@@H](C)NS(=O)(=O)c1cccc(NC(=O)C(=O)NNc2cc(Cl)ccn2)c1	784856278	JYYVVZSOUVUCOR-LLVKDONJSA-N	425.898	1.894	50	20	IDGD	
O=C(NNc1cccc(C(F)(F)F)n1)C(=O)Nc1ccc(S(=O)(=O)NC2CC2)cc1	784953001	XOWMSLKNVWABEV-UHFFFAOYSA-N	443.407	1.623	50	20	IDGD	
CSc1cc2c(cc1NC(=O)C(=O)NNC(=O)Cc1cn3ccccc3n1)OCCO2	785060623	ISXHYQYCRVPKDD-UHFFFAOYSA-N	441.469	1.156	50	20	IDGD	
O=C(NNc1c(F)cc(C(=O)NC2CC2)cc1F)C(=O)Nc1ccn(CC(F)(F)F)n1	785099842	LNNVZKMJOXEFOZ-UHFFFAOYSA-N	446.336	1.698	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1ccc2c(c1)CC(C)(C)O2	785330475	IMVXWWBZLMZSFW-UHFFFAOYSA-N	433.486	1.894	50	20	IDGD	
CC[C@]1(C)Oc2ccc(NC(=O)C(=O)NNC(=O)[C@H]3COc4ccccc4O3)cc2O1	785987704	GTBYEPKKPMBXPG-DYESRHJHSA-N	427.413	1.510	50	20	IDGD	
CCOC(=O)c1cnn(C)c1NC(=O)C(=O)NNC(=O)c1cccc(C(F)(F)F)c1	786417682	WRWPPPRWCCPNJC-UHFFFAOYSA-N	427.339	1.015	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)CC2CCC3(CC2)OCCO3)cc1	788085015	DOKCYHZOVUXAEW-UHFFFAOYSA-N	439.534	1.086	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)c1ccnc(Cl)c1I	788163685	JNRBOSRIZJVMRY-UHFFFAOYSA-N	441.653	1.890	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Nc2ccnn2-c2nc(C)cc(C)n2)cc(OC)c1OC	789313079	UWNKKVRPZCCIAI-UHFFFAOYSA-N	441.448	1.771	50	20	IDGD	
O=C(NNC(=O)[C@H]1OCC[C@H]1c1ccccc1)C(=O)Nc1ccc(O[C@H]2CCOC2)cc1	789809993	JVWMXGLEPUZASH-UFYCRDLUSA-N	439.468	1.513	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)[C@@H](C)[C@H](C)C(=O)NNC(=O)c1ccccc1OC	790615985	JOHNRQGMQWGPQM-KBPBESRZSA-N	442.472	1.198	50	20	IDGD	
CNC(=O)c1cc2cc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc3ccccc3)ccc2[nH]1	792357035	YEMPARUDGMXGTR-UHFFFAOYSA-N	445.382	1.285	50	20	IDGD	
NC(=O)[C@@H](NC(=O)NNC(=O)Cn1ccc2ccccc21)c1cccc(Br)c1	792916950	BVYCGNTYWMUORJ-KRWDZBQOSA-N	444.289	1.961	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CN2C(=O)N[C@@](C)(c3ccc(F)c(Cl)c3)C2=O)n1	794072923	TYKUXESGNWRIFE-IBGZPJMESA-N	433.827	1.411	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1O)C(=O)Nc1ccc(F)c(N2CCOC2=O)c1	797002743	SEYARWWRIAXMMM-UHFFFAOYSA-N	436.783	1.541	50	20	IDGD	
Cn1c(=NNC(=O)c2ccc(S(N)(=O)=O)c(Br)c2)sc2ccccc21	798318556	LZRGWTXXBQDTSD-UHFFFAOYSA-N	441.332	1.895	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2ccc3c(c2)OCO3)cc1S(=O)(=O)N(C)C	802096953	KGLBDFHUIQKDGT-UHFFFAOYSA-N	436.446	1.141	50	20	IDGD	
Cc1cc(F)cc2c1S(=O)(=O)N(CC(=O)NNC(=O)c1ccc(Cl)cc1)C2=O	804919769	CWTXRZLJYIHKLL-UHFFFAOYSA-N	425.825	1.393	50	20	IDGD	
COc1ccc(C(=O)NNc2ccc(-n3ccnc3)nn2)cc1S(=O)(=O)NC(C)(C)C	804952196	JYHXFDBOGSQQLF-UHFFFAOYSA-N	445.505	1.505	50	20	IDGD	
O=C(NC[C@@H]1CCCS(=O)(=O)C1)NNC(=O)c1ccc(Br)cc1Cl	805067404	RNCDJOBFQTXEJC-VIFPVBQESA-N	438.731	1.871	50	20	IDGD	
C[C@H](Cc1cncc2ccccc12)C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	805682297	RNEQJRASDILNCS-VFNWGFHPSA-N	449.463	1.944	50	20	IDGD	
COC(=O)c1cc(C)c(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)c(Cl)c1	806974347	GJMPOCWEPQKAMS-UHFFFAOYSA-N	437.811	1.739	50	20	IDGD	
COC(=O)c1c(C)csc1NC(=O)C(=O)NNC(=O)c1cccc(OC(F)F)c1	806979354	ZPKVJOCVZBINBH-UHFFFAOYSA-N	427.385	1.844	50	20	IDGD	
C[C@H]1CCCN(Cc2ccc(NC(=O)C(=O)NNc3ccc(-n4ccnc4)nn3)cc2)C1	807428342	BBSCMTOSVRZCJZ-INIZCTEOSA-N	434.504	1.976	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCC(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)cc1	811462149	MAMDBMMNCZFMBI-ZDUSSCGKSA-N	425.894	1.542	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@@H]2CCC[C@H]3CN(C(C)=O)C[C@H]32)c2ccccc2c1=O	812435067	YCMQBPAPYUDAQK-BMGDILEWSA-N	440.504	1.007	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)CCC(=O)c2ccc3c(c2)CCC(=O)N3)cc1	812730948	GYCDGPCJHPBJQS-UHFFFAOYSA-N	444.513	1.928	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2cc(C)cnc2Br)c1	812979744	GEWRYCXDONQBDE-UHFFFAOYSA-N	435.278	1.934	50	20	IDGD	
Nc1ncc2c(n1)CCCC2=NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	814691126	OASZMURCOWWRSM-UHFFFAOYSA-N	428.518	1.704	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)C1CCN(c2noc3ccc(Cl)cc23)CC1	814801775	LYOVPDSRHDGGAD-GFCCVEGCSA-N	440.909	1.280	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)N(C)C)nn1-c1ccccc1	815752070	ASVLOPZAYLUTGV-UHFFFAOYSA-N	442.501	1.513	50	20	IDGD	
CC(C)[C@H](NC(=O)COc1ccccc1)C(=O)NNC(=O)CSc1ccccc1O	815889520	CNPRKTIILGVNFS-FQEVSTJZSA-N	431.514	1.852	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CCCNC(=O)NC2CCCCC2)cc(OC)c1OC	817776357	HPDNIJSWHSPYBT-UHFFFAOYSA-N	436.509	1.886	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@H](C(=O)NNC(=O)CNc3ccccc3)C2)s1	849212023	OJFRYLNPSRHTRR-HNNXBMFYSA-N	436.559	1.717	50	20	IDGD	
O=C(NNC(=O)c1c[nH]c2ccccc12)c1sccc1S(=O)(=O)N1CCOCC1	871595558	VTRDHYAIBCCQQS-UHFFFAOYSA-N	434.499	1.325	50	20	IDGD	
CCCS(=O)(=O)Nc1cccc(C(=O)OCC(=O)NNC(=O)c2ccc(C)cc2)c1	900659272	QYONAPPSHSYWHD-UHFFFAOYSA-N	433.486	1.765	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)CN2C(=O)N[C@@]3(C[C@H](C)CC(C)(C)C3)C2=O)cc1	913431551	RBWJJYIGLFQNRF-IVZQSRNASA-N	429.521	1.691	50	20	IDGD	
COc1nn(C)c2nc(C)c(CCC(=O)NNC(=O)Cc3nc4ccccc4n3C)c(C)c12	914748275	RUTBSIYRSKBHLG-UHFFFAOYSA-N	449.515	1.803	50	20	IDGD	
CCOC(=O)N[C@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)C(C)C	915062771	DRGWWKHOMBHDSP-INIZCTEOSA-N	440.522	1.003	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cc(-c3cccnc3)on2)cc1	915357354	ALXFNUOMOIIECO-UHFFFAOYSA-N	429.458	1.127	50	20	IDGD	
CCO[C@H]1C[C@@H]1C(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2OC)c1	916095372	GPGPYIYYUKPXGH-YJBOKZPZSA-N	433.486	1.682	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)NCCCOC[C@H]1CCCO1	916209398	KOBRPBOXLVGYDX-OAHLLOKOSA-N	430.299	1.744	50	20	IDGD	
CSCC[C@@H](NC(=O)NNC(=O)COc1ccc(C#N)cc1)c1nnc2ccccn12	916224037	UHEYQHKUTNIEHB-MRXNPFEDSA-N	439.501	1.805	50	20	IDGD	
CCS(=O)(=O)N1CCC(NC(=O)NNC(=O)c2cc(-c3ccc(C)cc3)[nH]n2)CC1	916259296	CJOCEYAYVJNHDI-UHFFFAOYSA-N	434.522	1.143	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)NCC[C@@](O)(c2nccn2C)C(F)(F)F)c1	916377937	GVPCLXBXWBSNAX-QGZVFWFLSA-N	428.415	1.270	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCc2cccc(N3CCCC3=O)c2)cc(OC)c1OC	916516226	QQTFREOLESBFTE-UHFFFAOYSA-N	442.472	1.983	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)[C@@H](C)Sc1nncn1C	917921829	DOKXDWIWWDOXHM-VHSXEESVSA-N	428.312	1.673	50	20	IDGD	
CN(CC(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1)Cc1ccccc1	1116297619	BQGJIHLTHQUABH-UHFFFAOYSA-N	443.979	1.737	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)c2n[nH]cc2I)c1C	1320432056	DZAMGTCEIYLMGB-JTQLQIEISA-N	428.230	1.860	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)N(C)C2CCN(C(=O)OC(C)(C)C)CC2)cc1	1323395681	OCWQWDWPBPXTRI-UHFFFAOYSA-N	442.538	1.506	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)CN2CCC(CO)CC2)c2ccccc2c1=O	1338738713	VGWLSGGQFOODCX-UHFFFAOYSA-N	429.521	1.052	50	20	IDGD	
CN(CC(=O)NNc1cncc(Br)c1)S(=O)(=O)c1cccc([N+](=O)[O-])c1	1341215432	UXTLOLROLQIVMN-UHFFFAOYSA-N	444.267	1.516	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4cncn4c3)C2)C1	1778695325	GVBPIODJROBCRE-LPHOPBHVSA-N	435.322	1.951	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc4cn[nH]c4cn3)C2)C1	1778770594	ZALDYIIGWVOYRX-KZULUSFZSA-N	436.310	1.432	50	20	IDGD	
Cc1cc(C(N)=O)cc(C)c1C(=O)N1CCO[C@@]2(CCN(C(=O)CO[Si](C)(C)C)C2)C1	1779297098	QWWIQYIZNHLGQZ-JOCHJYFZSA-N	447.608	1.697	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3c(-c4ccncn4)noc3C)C2)C1	1780049617	RRISOBHVRDIGLP-VBKZILBWSA-N	433.896	1.901	50	20	IDGD	
CCOC(=O)c1cccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](F)Cl)CCO3)c1F	1780110512	KVVDOWRNPIECBA-DNVCBOLYSA-N	430.835	1.980	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(CCN(C(=O)c3nn[nH]c3C(F)(F)F)C2)C1	1780361855	AQBVHNKENYCZNA-OAHLLOKOSA-N	435.479	1.119	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc([N+](=O)[O-])c4c3OCO4)CCO2)C1	1781219383	XVCAJXJLOSHVRL-YJYMSZOUSA-N	439.852	1.784	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)c3cc4n(n3)CCCC4)CCO2)C1	1781229922	LHVJUMFKLNHGLH-OALUTQOASA-N	429.348	1.899	50	20	IDGD	
O=C(CCc1cccc(O)c1)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781333061	BFPUUAUKQJUPBU-FUHWJXTLSA-N	429.286	1.845	50	20	IDGD	
O=C(c1cccc(F)c1[N+](=O)[O-])N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781334312	XTMISFGUMQOAMS-CJNGLKHVSA-N	448.220	1.868	50	20	IDGD	
O=C(COc1ccccc1F)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781335231	WKQJXYJVYYJMEX-WBVHZDCISA-N	433.249	1.725	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc3nn[nH]c3c2)C1	1781442546	FCNYLGQFTHQLAH-JNAXZKDPSA-N	435.912	1.339	50	20	IDGD	
CCOC(=O)O[C@@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](Cl)COC)C2	1781516468	NHQAJRHJERSGPG-NRTGNBEESA-N	434.917	1.316	50	20	IDGD	
O=C([C@@H](Br)Cc1ccccc1)N1CC[C@]2(C1)CN(C(=O)[C@@H]1C=CCN1)CCO2	1783024166	UZSDYTKYTRHOPW-WFXMLNOXSA-N	448.361	1.351	50	20	IDGD	
CCOCC(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](Br)Cc3ccccc3)C2)C1	1783024171	VBQUDXLVBJYWBK-FXAWDEMLSA-N	439.350	1.859	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cccc3ccccc13)CCO2	1783935568	VRJKWUVSESCHIK-XMMPIXPASA-N	438.528	1.656	50	20	IDGD	
COc1cc(C)c(C(=O)N2CCO[C@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)c(C)c1	1783935717	XTLKKKZVJQGTPI-QHCPKHFHSA-N	446.548	1.129	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]2C1	1783974560	QAZBRSYOZSFPFJ-PPCPHDFISA-N	440.176	1.781	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3csc4c3CCCO4)C[C@@H]21)[C@@H](O)CCl	1784090223	UTEAKLGAQNXCAI-MZGVZZPPSA-N	428.938	1.266	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CC(=O)OC(C)(C)C)[C@H]2C1	1784781405	JIARCLZMHDOWPY-AJNGGQMLSA-N	447.370	1.871	50	20	IDGD	
CC1(CC(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](F)Cl)CCO3)CN(C(=O)OC(C)(C)C)C1	1785709755	QPGRLDYLRHXLBS-QRWLVFNGSA-N	447.935	1.998	50	20	IDGD	
CC(=O)NC(C)(C)C(=O)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1	1786386217	AMDMPHQUDYXONA-UHFFFAOYSA-N	437.305	1.029	50	20	IDGD	
Cc1[nH]nc(C(=O)Nc2ccc(C3(NC(=O)CCC(=O)NN(C)C)CCC3)cc2)c1F	1787164206	ZCYQKQDSKYANFX-UHFFFAOYSA-N	430.484	1.978	50	20	IDGD	
Cc1ccn(CC(=O)NC2(c3ccc(NC(=O)c4ccc(B(O)O)cc4)cc3)CCC2)n1	1788140352	UENAYMJIFJCHGC-UHFFFAOYSA-N	432.289	1.319	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)c1ccc2[nH]ccc2n1	1788318325	LSICIBLJCXPUSL-DCGLDWPTSA-N	435.322	1.941	50	20	IDGD	
CCc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCBr)C[C@@H]32)n(C)n1	1788942910	MHQWCARTUWLFKE-NOLJZWGESA-N	427.343	1.361	50	20	IDGD	
CCn1nc(C(=O)Nc2ccc(C3(NC(=O)c4cccc(B(O)O)c4)CCC3)cc2)cc1C	1789856176	HVXFGRWVDNZKLO-UHFFFAOYSA-N	446.316	1.953	50	20	IDGD	
O=C(CCCn1cccc1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21	1791665931	BXIDAJBUTWNLCK-JKQORVJESA-N	430.318	1.939	50	20	IDGD	
Cn1cccc1C(=O)C(=O)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1	1791921088	NNAZWLXEAJEXJE-UHFFFAOYSA-N	445.284	1.336	50	20	IDGD	
Cc1ccn2c(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@@H](C)CBr)cnc2c1	1792874342	MXDZDBAYMXWBIL-AFIMGQEJSA-N	449.349	1.877	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@@H](O)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCBr)C2	1793007570	IGISFXZYCGUCCT-XJFOESAGSA-N	448.358	1.295	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cn1ccc2sccc2c1=O	1794316362	BOJMSOFOPRQHBR-HLPPOEQASA-N	437.949	1.955	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(N2CCOCC2)cn1	1794768130	NRVJUJBLVLXODH-KYHPRHEASA-N	436.940	1.424	50	20	IDGD	
COc1ccc([C@H](C)C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)cc1	1796189695	PIPAQSSWFYMMIV-KQLYMOGASA-N	436.317	1.431	50	20	IDGD	
C=CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Cl	1796365371	WIORLJIJJMBKGG-AICCOOGYSA-N	433.908	1.580	50	20	IDGD	
COCc1oncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)CBr)C2	1796684848	XOUVRLKRPBVCPU-OHTBPHCPSA-N	430.299	1.055	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2c(s1)CCCC2	1797385711	TYBPTXOTIAAGRY-VPTLXERWSA-N	448.589	1.203	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cn1c(=O)n(C)c2ccccc21	1797750336	RAOQPFNKWXBJHI-FZKCQIBNSA-N	434.924	1.232	50	20	IDGD	
Cc1nc2ccncc2cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc(B(O)O)c1)C2	1798014909	SHVIZLLSWSTEQL-ACDBMABISA-N	444.300	1.184	50	20	IDGD	
CCN(C)[C@@H](C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)C2	1800166009	HPANUGYQHCUMHE-XVOKVJDBSA-N	446.498	1.802	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cn[nH]c1)C2)[C@H](Br)Cc1ccccc1	1800435716	NGKIJCNYDBSVDQ-XMTFNYHQSA-N	447.333	1.619	50	20	IDGD	
COc1ccccc1CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2	1800627413	XBPDOQVSEWXOFW-CCWDJLKJSA-N	425.323	1.612	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)NC(=O)OC(C)(C)C	1800866406	MYZCGIUNPXEWSN-VJTDZRGJSA-N	448.358	1.273	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc(F)cc1Cl)C2	1800974113	LGIVALSMLLQASU-VLWCASSMSA-N	433.307	1.865	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnn(Cc3ccccc3)c1)C2)C(Cl)Cl	1801016869	ABPALFIDKSPMNM-BJWYYQGGSA-N	437.327	1.938	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CCc2ccccc2C1	1801844125	RNXCUAFWYGXTTK-YSTOQKLRSA-N	447.539	1.742	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1ccc(CO)c(F)c1	1801901821	GAQDLXMENDCWEP-NEBZKDRISA-N	433.249	1.212	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H]2[C@@H](C1)[C@@H]2C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](O)CCl)C2	1801929472	UHCNPKPDMHQHNB-PZLJCXPPSA-N	441.956	1.337	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2cscn2)[C@@H]1c1cccnc1	1805748431	ODBIOZJKHWYTEI-BEFAXECRSA-N	430.534	1.231	50	20	IDGD	
Cc1ccc(CCC(=O)N2CCCC3(CCN(C(=O)c4cccc(B(O)O)c4)CC3)C2)nc1	1807055038	CNYWCDCEFCMIQG-UHFFFAOYSA-N	449.360	1.547	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)c2cccc(F)c2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1	1807375264	NOVUSCBNDLKMFX-DENIHFKCSA-N	447.275	1.534	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)Cc2cnccn2)[C@H]1c1cccnc1)[C@H](F)Br	1808649481	SEPCDANUXATQDC-JQFCIGGWSA-N	436.285	1.811	50	20	IDGD	
Cn1nncc1C(=O)N1CC[C@H](CNC(=O)[C@@H](F)Br)[C@H]1c1cccnc1	1808651710	PHQFSDGSIPPNPZ-MRVWCRGKSA-N	425.262	1.220	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2nc3ncccn3n2)[C@H]1c1cccnc1	1809230128	IPZRGFWPEYDTJW-OWCLPIDISA-N	427.896	1.856	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)/C=C\C(=O)NC2CC2)[C@H]1c1cccnc1	1810134958	SCNQTLZETLGGMK-ZLMSYNRNSA-N	434.924	1.176	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)C2=CCCC2)[C@@H]1c1cccnc1	1810299046	NHUDNIBASOTWKQ-FXAWDEMLSA-N	434.500	1.510	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2cc3ncccn3n2)[C@@H]1c1cccnc1	1813031458	VMYNLBXZYXUVEO-JTDSTZFVSA-N	442.907	1.698	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)N1CC[C@@H](CNC(=O)C(Cl)Cl)[C@H]1c1cccnc1	1813078784	SFVCYLPCJCJIFS-KWCYVHTRSA-N	430.336	1.599	50	20	IDGD	
Cc1ccsc1C(=O)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1	1815355021	LKTKKFKGQCJCKN-CQSZACIVSA-N	441.343	1.732	50	20	IDGD	
Cc1cc2nnc(C(=O)N[C@@H]3CCc4nc(NC(=O)[C@H](F)Cl)sc4C3)c(C)n2n1	1817122526	JRAHJRFSJYOKMZ-OTYXRUKQSA-N	437.888	1.958	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCc2nc(N)n[nH]2)n[nH]1	1819286024	WTQRWTUDPGDFIK-GXSJLCMTSA-N	439.318	1.518	50	20	IDGD	
Cc1c(C(=O)Nc2cc([C@H]3CCCCN3C(=O)[C@@H](F)Cl)[nH]n2)cn2[nH]cnc(=O)c12	1820117494	HWORVRXRNHIBTQ-IUODEOHRSA-N	435.847	1.894	50	20	IDGD	
COC[C@H](NC(C)=O)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](C)Br)n[nH]1	1822189234	QNRGSJJHIWYDJF-DDTOSNHZSA-N	444.330	1.336	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CN2C(=O)C=CC2=O)n[nH]1	1822530733	ZCQLXZQLEOOPLU-SGTLLEGYSA-N	442.303	1.563	50	20	IDGD	
CS(=O)(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1	1823014420	WFWFWFVBZIMPNJ-HQJQHLMTSA-N	442.332	1.180	50	20	IDGD	
Cc1cnn([C@@H](C)C(=O)N[C@@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)c1	1826092066	KKDYJRZNQUEEEL-UONOGXRCSA-N	447.565	1.194	50	20	IDGD	
C[C@@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1)n1ccnc1	1827048859	APVVCHAMVQIBOR-LAUBAEHRSA-N	438.337	1.057	50	20	IDGD	
Cn1cc(F)cc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1	1827943279	IWWZEOQKAFEFDJ-HXUWFJFHSA-N	441.312	1.391	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CC2(O)CCC2)CC1	1828925528	JSRODYDDQOFQSC-LJQANCHMSA-N	443.548	1.224	50	20	IDGD	
O=C(c1cc(Cl)ccc1F)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1	1830183390	OHYRJQNTDOICIK-MAUKXSAKSA-N	435.279	1.149	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CNc4ccccc43)C2)C1	1830359081	LIUCBOCXLZJXRG-HTAPYJJXSA-N	435.952	1.917	50	20	IDGD	
O=C(CN1CCOC1=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](F)Br)CC1	1830376230	KSHTZHDFQXHMAZ-DZGCQCFKSA-N	434.306	1.749	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](F)Br)CC1	1830381010	DJKMZLWRMUNFEC-WMLDXEAASA-N	449.365	1.670	50	20	IDGD	
CC(C)[C@@H](S)C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](C)CBr)CCO2)C1	1830535689	SBCLPKCALXVJLW-CPUCHLNUSA-N	437.400	1.428	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cn3cc(Cl)cn3)C2)C1	1831647108	QABZGYXAVIRKSU-YJBOKZPZSA-N	433.336	1.400	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3nc(C)sc3C)CCO2)C1	1833149705	DTQZERILJYTQIN-HNAYVOBHSA-N	445.969	1.013	50	20	IDGD	
Cc1cccc2c(C(=O)N3CCC(N4CCC(NC(=O)[C@@H](O)CCl)CC4)CC3)n[nH]c12	1833311759	FGNODIUIARNBRM-SFHVURJKSA-N	447.967	1.656	50	20	IDGD	
CCC(=O)N[C@@H](C)C(=O)NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1	1833422093	VEOLPZNEYLGWGH-AWEZNQCLSA-N	445.402	1.258	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCBr)CCO3)C2)c(C)n1C	1834823080	HXQLOJOAHDRNHO-LJQANCHMSA-N	442.354	1.497	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3c(O)cc(O)cc3O)CC2)CC1)[C@@H](F)Cl	1835081480	SFJHAZVAPRLFNN-QGZVFWFLSA-N	429.876	1.523	50	20	IDGD	
C[C@@H](C(=O)NC1CCN(C2CCN(C(=O)[C@@H](F)Cl)CC2)CC1)n1ccccc1=O	1835826533	VIXAPUHRXYESEP-KBXCAEBGSA-N	426.920	1.515	50	20	IDGD	
COc1ccc(C(=O)N2CCC(N3CCC(NC(=O)CO[Si](C)(C)C)CC3)CC2)nn1	1835836077	DWPACKQWXAOKBF-UHFFFAOYSA-N	449.628	1.522	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)CO[Si](C)(C)C)CC2)CC1	1835837745	OBFWFEHEBUFLFX-QGZVFWFLSA-N	434.053	1.663	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccn4ccnc34)CCO2)C1	1836995029	GLQDRPGTOMQUAM-UTKZUKDTSA-N	434.924	1.812	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cn4ccsc4n3)CCO2)C1	1837045502	YUVAYYZYYNOELR-AUUYWEPGSA-N	440.953	1.873	50	20	IDGD	
Cn1c(C(=O)N2CCC(OC3CCN(C(=O)C(Cl)Cl)CC3)CC2)cccc1=O	1837379297	CYYNDNGANFUZLD-UHFFFAOYSA-N	430.332	1.801	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)/C=N/N3CCCCC3)CC2)CC1	1838392112	LNKJJKFXBSEOHW-CKMDTHJYSA-N	442.988	1.711	50	20	IDGD	
O=C(CCCCCCCCCCCl)N1CCO[C@@]2(COCCN(C(=O)C(O)O)C2)C1	1839124191	SIHNJCGUJKKDKF-NRFANRHFSA-N	448.988	1.503	50	20	IDGD	
Cc1cccc(C)c1NC(=O)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1839157601	YVBQOSBZMOEORT-JXFKEZNVSA-N	441.887	1.233	50	20	IDGD	
CC(C)n1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)n1	1839201983	PMVOZRIOCWWRJV-RHSMWYFYSA-N	447.305	1.225	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)C[C@@H](C)c3ccccc3)CCO2)C1	1839932324	RCELJSUSORHGDV-ZWCUEREDSA-N	438.952	1.890	50	20	IDGD	
C[C@H](Cn1ccnc1)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1	1840433608	ZJFKNPPLBNRRQY-AYOQOUSVSA-N	447.363	1.212	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3ccoc3)CCO2)C1	1840516807	NNHJLRVCUYDEFZ-LPHOPBHVSA-N	443.338	1.842	50	20	IDGD	
Cc1cccc(F)c1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)Br)C2)C1	1840651983	FADMSTALXSSXSX-IFXJQAMLSA-N	443.313	1.988	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)Cc2ccc(Cl)c(F)c2)C1	1841208024	DMAYOFQVABJQBX-UHFFFAOYSA-N	430.672	1.219	50	20	IDGD	
COc1cc(Cl)cc(C(=O)N2CC3(CCCN3C(=O)c3cccc(B(O)O)c3)C2)c1	1843015702	VERZCXCBQOQOLL-UHFFFAOYSA-N	428.681	1.159	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC12CN(C(=O)c1cccnc1CS(C)(=O)=O)C2	1846176145	PBHJSQDXAVKOOI-GFCCVEGCSA-N	444.351	1.227	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)Cc1ccc(OC)cc1[N+](=O)[O-])C2	1846363793	DYKQNWDFIBOCDB-HNNXBMFYSA-N	425.869	1.603	50	20	IDGD	
C=C[C@@H]1C[C@]1(NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)[C@H](Cl)COC)C1	1846365871	ZZOCDCSZPSQTST-VTJXTGGHSA-N	441.956	1.913	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)C2CCN(c3nc4ccccc4o3)CC2)C[C@H](C)O1	10889356	GRHXJRIHMGTMTC-HOTGVXAUSA-N	429.521	1.691	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(Br)c[nH]2)c1	23914018	XVVAPZVSCZJZQP-UHFFFAOYSA-N	443.323	1.883	50	20	IDGD	
C[C@@H]1Cc2cc(C(=O)NNC(=O)Cc3c[nH]c4ccccc34)ccc2N1S(C)(=O)=O	24455160	QOXAFWMCYXRFSS-CYBMUJFWSA-N	426.498	1.882	50	20	IDGD	
Cc1ccc(C)c(C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1	25166222	ZPJYCNYHONBWMS-UHFFFAOYSA-N	445.541	1.718	50	20	IDGD	
COc1ccc(N2CCC(NC(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)CC2)cc1	726714870	AMOSAJOHXQUUFM-UHFFFAOYSA-N	446.529	1.712	50	20	IDGD	
C#Cc1cccc(NC(=S)NNC(=O)[C@H](CSC)N2C(=O)[C@@H]3CCCC[C@H]3C2=O)c1	727501248	PICJBXBPOLFNTN-ZACQAIPSSA-N	444.582	1.892	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)N[C@H](CN1CCN(C)CC1)c1ccccc1	727843396	JGZDZFUZOWPMTF-LJQANCHMSA-N	441.532	1.393	50	20	IDGD	
O=C(NNc1nc(-c2cccnc2)no1)c1ccc2c(c1)C(=O)N(C[C@H]1CCCO1)C2=O	728078336	ASFBRIWKOTWEKE-CQSZACIVSA-N	434.412	1.664	50	20	IDGD	
O=C(COC(=O)[C@H]1CSCN1C(=O)c1ccc(Cl)cc1)NNC(=O)c1ccccc1	730332243	GRRJBDQWAXDQJA-MRXNPFEDSA-N	447.900	1.860	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)[C@H]1CCCN(S(=O)(=O)Cc2ccccc2)C1	730514797	LLZSRZVFNIVUBJ-KRWDZBQOSA-N	449.504	1.594	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)c1ccc(S(=O)(=O)NCc2ccco2)cc1	731345422	UDJCTZHSPSPUNO-UHFFFAOYSA-N	431.445	1.901	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCCCC(=O)N2Cc3ccccc3C2)cc1OC	732237860	NKCRFMDAPXHARC-UHFFFAOYSA-N	426.473	1.970	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2cccc(NC(=O)c3cccnc3)c2)C[C@@H](C)O1	732261492	MYZDSBFQWUCPJH-IYBDPMFKSA-N	425.489	1.594	50	20	IDGD	
CC(=O)c1cccc(O[C@@H](C)C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c1	732333784	VDNSBERMPTZQBC-ZDUSSCGKSA-N	429.385	1.569	50	20	IDGD	
CCn1cc(C=NNC(=O)c2cc(S(=O)(=O)NCc3ccccc3)ccc2O)cn1	732528553	PBPJQNDEWAERIG-UHFFFAOYSA-N	427.486	1.851	50	20	IDGD	
O=C(CCCc1cccs1)NNC(=O)CCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1	732555962	CJBLOFJKYZPABF-UHFFFAOYSA-N	440.503	1.495	50	20	IDGD	
CCOCCOc1ccc(S(=O)(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1	733123329	ZFCRWIJASGWSDN-UHFFFAOYSA-N	430.486	1.911	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N(C)[C@H](C)[C@H](C)S(C)(=O)=O)cc1Br	733347705	HNQWYYAFZXWKJT-ZJUUUORDSA-N	436.328	1.566	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCc2ccc3c(c2)CCO3)c1	734069292	OMWKGBSJQJNCMP-UHFFFAOYSA-N	432.502	1.059	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NCC(=O)NNc2c(F)cccc2F)c1	735695915	LQLUNQUOCZGPRY-UHFFFAOYSA-N	440.472	1.868	50	20	IDGD	
Cc1c(Cl)cccc1OCC(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	736905320	HTTRGCMWXYHEPM-KRWDZBQOSA-N	434.832	1.558	50	20	IDGD	
O=C(CCCc1nc(C2CC2)no1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	739676597	WZCXHSQARHIOLP-UHFFFAOYSA-N	447.517	1.515	50	20	IDGD	
COc1cc(C(=O)NCC(=O)NNc2ncccc2C(F)(F)F)cc(OC)c1OC	740093439	QCBYXFQXGGXAMX-UHFFFAOYSA-N	428.367	1.999	50	20	IDGD	
C[C@H]1C[C@H](C)CN(S(=O)(=O)c2ccc(C(=O)NNc3ccnc(N(C)C)n3)cc2)C1	740105028	USLWCIWXZCTETC-GJZGRUSLSA-N	432.550	1.966	50	20	IDGD	
COC(=O)c1cc(Cl)cc(S(=O)(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1	741649484	UELMDJKJDFWWLT-OAHLLOKOSA-N	426.834	1.276	50	20	IDGD	
Cn1c(=O)c2ccccc2n2c(SCC(=O)NNC(=O)c3cccc(C#N)c3)nnc12	741850640	CNIHINNRZVYRQI-UHFFFAOYSA-N	433.453	1.006	50	20	IDGD	
NC(=O)CS(=O)(=O)c1ccc(C(=O)NNC(=O)CCSc2ccc(F)cc2)cc1	742479924	CWLAGDQMDAFUQO-UHFFFAOYSA-N	439.490	1.028	50	20	IDGD	
NC(=O)[C@H]1CCCN(CCCNC(=O)NNC(=O)Nc2ccc(OC(F)F)cc2)C1	743594930	XTKFAHXPYNIBBL-LBPRGKRZSA-N	428.440	1.211	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)CC[C@H]2Cc3ccccc3NC2=O)cc1	743830024	KQJJBDMPQRVQFP-AWEZNQCLSA-N	430.486	1.834	50	20	IDGD	
O=C(Cc1cnn(-c2ccccc2)c1)NNc1ccccc1S(=O)(=O)N1CCOCC1	744619693	VVIINTNMKDKYPK-UHFFFAOYSA-N	441.513	1.579	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)N[C@H]2CCN(Cc3ccccc3)C2=O)cc1OC	744878039	OQBYSBVCQKKCHU-KRWDZBQOSA-N	426.473	1.839	50	20	IDGD	
C[C@H](O)CC(C)(C)CNC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	745845393	NZUHFGUODRMERC-AWEZNQCLSA-N	426.539	1.212	50	20	IDGD	
CCOC(=O)c1sc2[nH]c(CSCCC(=O)NNC(=O)N(C)C)nc(=O)c2c1C	746012440	BLKKUFFANAXSAE-UHFFFAOYSA-N	441.535	1.395	50	20	IDGD	
C[C@H](SCC(=O)Nc1ccc(F)cc1)C(=O)NNC(=O)Cc1cn2ccccc2n1	746552977	BOTFDKGNZOZILH-ZDUSSCGKSA-N	429.477	1.924	50	20	IDGD	
C#CCN1C(=O)C(=NNC(=O)Cc2cc(O)nc(S)n2)c2cc(Br)ccc21	747047401	ZRHHFGXHGFXABF-UHFFFAOYSA-N	446.286	1.276	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)CNC(=O)NCc2ccc([N+](=O)[O-])cc2)c2ccccc2n1	748360271	RCVDJUMJVUMSPN-UHFFFAOYSA-N	436.428	1.712	50	20	IDGD	
CC(C)(C)OC(=O)NC1(CNC(=O)NNC(=O)C(=O)N2CCCC2)CCCCCC1	748455697	ZKJOZUQGNZCANB-UHFFFAOYSA-N	425.530	1.557	50	20	IDGD	
O=C(NCc1cccc(NC(=O)c2ccc(F)cc2)c1)NNC(=O)C(=O)N1CCCC1	748462497	UINNLPUKPUOANZ-UHFFFAOYSA-N	427.436	1.531	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(C)c(NC(=S)NNC(=O)[C@@H](C)OCCOC)c1	748608158	ROGVTNVTRAIXEW-CQSZACIVSA-N	446.595	1.395	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)/C=C\c3ccc([N+](=O)[O-])cc3)cc2)CC1	748623041	HRSQBMPWLCBIFR-WCIBSUBMSA-N	445.501	1.687	50	20	IDGD	
CCc1cc(SC#N)cc(CC)c1NC(=O)Cn1c(=O)c2c(ncn2C)n(C)c1=O	748666572	AMLYWOSUEVPYLL-UHFFFAOYSA-N	426.502	1.770	50	20	IDGD	
Cc1nc(C)c(S(=O)(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)s1	751215294	YFJRTANWERCWDU-UHFFFAOYSA-N	433.556	1.652	50	20	IDGD	
CCC(=O)NCc1cc(S(=O)(=O)NNC(=O)Cn2ccc3ccccc32)ccc1OC	751548463	RFTICKXYPFAYGG-UHFFFAOYSA-N	444.513	1.686	50	20	IDGD	
Cc1c(/C=C(\C#N)C(=O)NCCNS(=O)(=O)c2ccc(Cl)s2)cc(C#N)n1C	752257585	UDXIVVVMEIAMES-NTUHNPAUSA-N	437.934	1.922	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)N[C@H]1CCCN(Cc2ccccn2)C1=O	753287194	AKZZDVJPZFMDQP-INIZCTEOSA-N	431.880	1.879	50	20	IDGD	
O=C(COC(=O)Cc1ccc(I)cc1)NNC(=O)c1cccs1	753458307	RVRIHUNABNCTPF-UHFFFAOYSA-N	444.250	1.900	50	20	IDGD	
COc1ccc(N2CCN(CC(=O)NNC(=O)c3cc(Cl)ccc3OC)CC2)cc1	755371666	ZQUVCCLTJGTFQG-UHFFFAOYSA-N	432.908	1.940	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cccc(-n3ccnn3)c2)c1	755381607	OOEHOTFWMUYUNW-UHFFFAOYSA-N	442.501	1.373	50	20	IDGD	
CCOc1ccc(NC(=O)NNC(=O)c2cc(C)[nH]n2)cc1S(=O)(=O)N(CC)CC	755449873	HXRORBMMPNVUAE-UHFFFAOYSA-N	438.510	1.614	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)Nc1ccc(S(=O)(=O)NC2=NCCCCC2)cc1	755499863	MTTXRESBUIJRTN-UHFFFAOYSA-N	433.494	1.435	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1cccc(NC(=O)c2cccs2)c1	755601668	IWXPMPPIEZRJMU-JTQLQIEISA-N	425.492	1.091	50	20	IDGD	
COC(=O)c1nscc1S(=O)(=O)NNC(=O)c1ccc(F)cc1Br	755963243	UZPNLHFZXRAGTB-UHFFFAOYSA-N	438.256	1.455	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)N[C@@H]2CCc3nc(COC)nn3C2)cc1OC	757784726	ALWKXUSIDFFMNU-CQSZACIVSA-N	432.481	1.181	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)Nc2cccc3c2CCN3S(C)(=O)=O)cc1	758295764	IQRWSFDNAXXGHA-UHFFFAOYSA-N	432.502	1.803	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)N[C@H]2CN(C(=O)OC(C)(C)C)C[C@@H]2C#N)cc1C	758752120	LVWQSDMTOXWFQN-HOCLYGCPSA-N	444.492	1.331	50	20	IDGD	
COc1ccc(C(=O)Nc2ccccc2C(=O)NNC(=O)C(=O)Nc2ccccn2)cc1	758839429	KFOALAZQEYPAJB-UHFFFAOYSA-N	433.424	1.742	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)NC[C@@H]1CC(=O)N(Cc2ccccc2)C1	759683036	LKRBFYQZCPFCFD-RDJZCZTQSA-N	428.464	1.972	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1ccc(-n2ccnn2)cc1	760649831	WBKVRDIABQLCEV-UHFFFAOYSA-N	428.474	1.045	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1)c1ccc2nnc(O)n2c1	762969313	VHJOZYREXXFFRC-FQEVSTJZSA-N	442.479	1.823	50	20	IDGD	
O=C(NNC(=O)c1ccncc1)C(=O)Nc1ccnn1Cc1ccc(Br)cc1	763462670	SCJJUFCFVWUAKA-UHFFFAOYSA-N	443.261	1.489	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)C(=O)Nc1cccc(F)c1	763512949	VOFFSTJNGMMTQS-UHFFFAOYSA-N	448.476	1.400	50	20	IDGD	
COC(=O)c1cc(Br)ccc1NC(=O)C(=O)NNC(=O)c1ccccc1O	763529747	MAFIPALJFAVFNK-UHFFFAOYSA-N	436.218	1.341	50	20	IDGD	
COc1cc(C)ccc1NC(=O)C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	763531319	MJNQVBLSCJKNCV-UHFFFAOYSA-N	439.516	1.302	50	20	IDGD	
CCCCOc1ccc(OC)cc1NC(=O)C(=O)NNC(=O)[C@H]1COc2ccccc2O1	763572593	MVDSFOXYOGBENN-LJQANCHMSA-N	443.456	1.800	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1OCC(F)F	763573370	ZSJXBYMIHHHPSK-INIZCTEOSA-N	435.383	1.565	50	20	IDGD	
CCOc1cc(N2CCN(C)CC2)ccc1NC(=O)C(=O)NNC(=O)c1ccccc1F	763574756	HXZAVJUQJQDPLH-UHFFFAOYSA-N	443.479	1.376	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)[nH]n1)C(=O)Nc1ccn(Cc2ccccc2)n1	763605363	RNVZRFOKHINUBR-UHFFFAOYSA-N	429.440	1.721	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2cccc(C(F)(F)F)c2)n(CCC#N)n1	763638611	CVHRBAMOZWEZEU-UHFFFAOYSA-N	438.366	1.289	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)COc2cccc(C(F)(F)F)c2)c(OC)c1	763640217	UDHOPTUUROIGQA-UHFFFAOYSA-N	441.362	1.888	50	20	IDGD	
O=C(COc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1ccc(N2CCOC2=O)cc1	763685280	SNMPPQKATSNGMH-UHFFFAOYSA-N	432.820	1.462	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1nc(-c2nccn2C)cs1	763717215	RLSJFSFNFGDEJT-UHFFFAOYSA-N	428.474	1.271	50	20	IDGD	
CC(C)n1cnnc1-c1ccccc1NC(=O)C(=O)NNC(=O)c1cccc(N(C)C)c1	763753672	ISQKJZAJJOGHGV-UHFFFAOYSA-N	435.488	1.992	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)C(=O)Nc1cc(F)ccc1Br	763842390	ZUAUIPBAWYMDMU-UHFFFAOYSA-N	428.189	1.892	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccc(Br)nc1	763851642	UTBFLDJODOUDOE-SECBINFHSA-N	425.214	1.537	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cc(C)nn2CCC#N)cc1	763862670	YZHRPBNRPGOQOC-AWEZNQCLSA-N	428.449	1.057	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc([S@](C)=O)c(F)c2)cc1	763873013	REXHVEFPKMIKID-VEWZGRNOSA-N	449.460	1.319	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(C(C)=O)cc2)cc1F	763878574	RLJCPENYMLXXLO-CYBMUJFWSA-N	431.420	1.980	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3ccccc3C(=O)N(C)C)cc2C1	763939427	MTRWUNZYMAZHKL-GFCCVEGCSA-N	428.514	1.974	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1cccnc1N1CCCCC1	764003694	HUYQJWFYQLVNHC-UHFFFAOYSA-N	425.445	1.243	50	20	IDGD	
CC(C)n1cc2cc(NC(=O)C(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)ccc2n1	764077164	IBDAIFBKRXKWNK-UHFFFAOYSA-N	443.485	1.420	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2O1)C(=O)Nc1ccc(N2CCSCC2)cc1	764153001	YWIFYZSFKHFBGP-SFHVURJKSA-N	426.498	1.329	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)CCC2CCCCC2)cc1-n1nnnc1C	764218327	QBRQEYLQTCEPNE-UHFFFAOYSA-N	429.481	1.426	50	20	IDGD	
C[C@H]1COCCN1c1ccc(NC(=O)C(=O)NNC(=O)c2cccc(OC(F)F)c2)cc1	764260384	WYVTVOPUVDPNEP-ZDUSSCGKSA-N	448.426	1.913	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1cc(CC2CC2)nn1-c1ccccc1	764276051	XMPSTNDDMWZQFP-UHFFFAOYSA-N	449.467	1.695	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2ccc3nc(C)cn3c2)n[nH]1	764377273	MDWHZKZSGPHHIY-UHFFFAOYSA-N	433.428	1.441	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cc(F)ccc3F)n[nH]2)cc1OC	764378036	HKJYWWFUWBKJPE-UHFFFAOYSA-N	445.382	1.772	50	20	IDGD	
COC(=O)NCc1ccc(NC(=O)C(=O)NNC(=O)CSc2ccccc2OC)cc1	764392611	ICXPKIJSKUWFSV-UHFFFAOYSA-N	446.485	1.429	50	20	IDGD	
COc1ccsc1S(=O)(=O)NNC(=O)CN1CCN(Cc2ccc(C)cc2)CC1	765128934	YLCJUDFFJWHGCZ-UHFFFAOYSA-N	438.575	1.192	50	20	IDGD	
CNC(=O)[C@@H]1CCC[C@@H]1NC(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1	765667012	VITPHOSDKNBQIZ-BHIFYINESA-N	449.555	1.859	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NCC(=O)NNC(=O)CSc1ccc(Cl)cc1	766339017	UQJHPSVOIRXTLS-UHFFFAOYSA-N	430.914	1.220	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1c[nH]nc1-c1ccccc1	766639748	AEFCQSQNKDQDAO-UHFFFAOYSA-N	432.484	1.296	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)CN1CCN(CCN(C)Cc2ccccc2)CC1	766873067	PCEHPVBPELTAHJ-UHFFFAOYSA-N	437.588	1.435	50	20	IDGD	
CC(=NNC(=O)c1ccc2c(c1)OCCO2)c1ccc(S(=O)(=O)NCCC(=O)O)cc1	767489824	WWYRYNSAOKMSGY-UHFFFAOYSA-N	447.469	1.365	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)[C@@H]1CC(=O)N(c2ccc(F)cc2F)C1	768641208	OAVJXGNYFDJCRA-LLVKDONJSA-N	439.440	1.873	50	20	IDGD	
CON(C)S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2c(F)cccc2Cl)cc1	770810916	HNRRNZGAOHFGPN-UHFFFAOYSA-N	430.845	1.743	50	20	IDGD	
C[C@@H]1C[C@H](NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)CCN1C(=O)OC(C)(C)C	772339909	QJJRSYXEHFUMFH-UKRRQHHQSA-N	444.496	1.394	50	20	IDGD	
COc1cc(F)cc(NNC(=O)C(=O)Nc2ccc(I)cn2)c1	773718796	YPQNRAIEHLJMSN-UHFFFAOYSA-N	430.177	1.916	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)ccc1NC(C)=O	774008100	IUDVPCLBGAPKFV-LLVKDONJSA-N	448.863	1.860	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)N[C@@H](c1cccc2ccccc12)C(F)(F)F	776009677	MYSFYAHPDDTOIE-HZMBPMFUSA-N	432.424	1.711	50	20	IDGD	
O=C(COC(=O)c1ccc(C(F)(F)F)cc1O)NNC(=O)c1cccc([N+](=O)[O-])c1	776399029	ATFUKUMATMSKJE-UHFFFAOYSA-N	427.291	1.937	50	20	IDGD	
COc1ccc2nc(NNC(=O)c3cc(C)c4c(=O)n(C)c(=O)n(C)c4n3)c(C)cc2c1	778477228	XIWDCNSZWZIGIH-UHFFFAOYSA-N	434.456	1.563	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@H](O)[C@H](O)c2nc3ccccc3s2)ccc1OC(C)C	779488687	ICBCZCCFVYODNT-MSOLQXFVSA-N	445.497	1.948	50	20	IDGD	
C[C@@H]1Oc2ccc(C(=O)C3CCN(S(=O)(=O)CBr)CC3)cc2NC1=O	782433887	KJAFTGJZXXUJQG-JTQLQIEISA-N	431.308	1.983	50	20	IDGD	
CCOc1ccc(Oc2ccc(NC(=O)C(=O)NNC(=O)C(=O)NC3CC3)cc2)cc1	782967738	WTNHUNVYJYWVMJ-UHFFFAOYSA-N	426.429	1.242	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccc(Cl)cc2)cc1	783336389	NWAAZAVIHRIGLR-UHFFFAOYSA-N	426.882	1.347	50	20	IDGD	
CCOC(=O)COc1ccc(NC(=O)C(=O)NN=c2sc3ccccc3n2C)cc1	783349678	NJBXBZASLBPVCF-UHFFFAOYSA-N	428.470	1.752	50	20	IDGD	
COc1ccc(N2CCN(C(=O)/C(C#N)=C/c3cn(Cc4cccnc4)nn3)CC2)cc1	783698854	AOOGZNKHTAGEFI-CPNJWEJPSA-N	429.484	1.986	50	20	IDGD	
O=C(NNC(=O)C(=O)N1CCCC1)C(=O)Nc1ccccc1Nc1ccc(F)cc1F	783999211	LDAXYBWAHIBGNU-UHFFFAOYSA-N	431.399	1.417	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNc2ncccc2Cl)ccc1S(=O)(=O)N(C)C	784819869	ZDCJPZBEEBHYKK-UHFFFAOYSA-N	427.870	1.076	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNc2cccc(S(C)(=O)=O)c2)ccc1Cl	784839835	PUUCWGHPLIOOGU-UHFFFAOYSA-N	425.850	1.612	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)C(=O)Nc2ccc(C)c(S(=O)(=O)N(C)C)c2)c1	784852526	VIBUCCCBRWSVQX-UHFFFAOYSA-N	434.474	1.114	50	20	IDGD	
CCNC(=O)N(C)NC(=O)C(=O)Nc1ccc(Oc2ccc(S(C)(=O)=O)cc2)cc1	784915947	SAHSJBKJAIULNR-UHFFFAOYSA-N	434.474	1.513	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)Nc1ccc(CC(F)(F)F)cc1	785023377	GUABGOTXFWJBRA-UHFFFAOYSA-N	426.307	1.805	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)C(=O)Nc3cccc(-n4ccnn4)c3)n[nH]2)c1	785126742	DHSRSRAEJAQOMW-UHFFFAOYSA-N	444.455	1.674	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(c2ncc(NC(=O)NNC(=O)c3ccoc3)cn2)CC1	786180858	FIPRHGPUWIHDCM-UHFFFAOYSA-N	431.453	1.593	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)C(C)(C)S(=O)(=O)C2CC2)CC1	786183526	DAWWWKKZHMIMLF-UHFFFAOYSA-N	432.543	1.072	50	20	IDGD	
CCCCN1C(=O)CC[C@H](C(=O)NNC(=O)N2CCN(C)CC2)[C@H]1c1ccccc1OC	788169519	QQPCZXJMOYYQPI-GHTZIAJQSA-N	445.564	1.763	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1cccc2c1OCC[C@@H]2N(C)C	789740307	FLRHTOOBHVRYMJ-DYVFJYSZSA-N	444.463	1.764	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)nnn1Cc1ccc(F)cc1F	790292573	FEXBYGRPABASBV-UHFFFAOYSA-N	449.439	1.391	50	20	IDGD	
COC[C@@H](C)n1c(C)cc(/C=C(/C#N)C(=O)N2CCN(C(=O)C(=O)NC(C)C)CC2)c1C	790903406	CRNJABCGCWWTSN-SYERDGIWSA-N	443.548	1.415	50	20	IDGD	
O=C(NNC(=O)C1CCC1)c1cc(Br)c(C(=O)NNC(=O)C2CCC2)o1	792166971	QOJRGCRBYZRKBT-UHFFFAOYSA-N	427.255	1.164	50	20	IDGD	
CCc1c(NC(=O)C(=O)NNC(=O)CNC(=O)c2cccs2)cnn1C(CC)CC	792279078	GXVIEJMHQAUOKQ-UHFFFAOYSA-N	434.522	1.384	50	20	IDGD	
COc1ccccc1OCC(=O)NN=C[C@H]1CCCN(C(=O)CNC(=O)OC(C)(C)C)C1	794469520	VBWXORTVKJPBHF-MRXNPFEDSA-N	448.520	1.939	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNS(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	794596004	BGWVZCXKTQHQNQ-UHFFFAOYSA-N	442.837	1.484	50	20	IDGD	
Cc1nnc(COCC(=O)NNC(=O)[C@H](C)Oc2cccc(Br)c2)s1	794785801	FQRSYWFWRFIYJQ-VIFPVBQESA-N	429.296	1.741	50	20	IDGD	
C[C@H](CC(=O)NNc1ccccc1S(=O)(=O)N(C)C)S(=O)(=O)c1ccc(F)cc1	795160003	BMNQFEKUCSLYTN-CYBMUJFWSA-N	443.522	1.772	50	20	IDGD	
CNC(=O)c1cc(Cl)cc(S(=O)(=O)NNC(=O)c2cccc(OC)c2O)c1OC	795304846	OFZWYWPBGLEPHW-UHFFFAOYSA-N	443.865	1.046	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H](C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)C[C@H]2C[C@H]21	796051775	AJSPJRNAZTVJPD-OAGGEKHMSA-N	428.445	1.260	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(F)c(C3CC3)c2)c1	799258010	XYVHGKZSPLPPTB-UHFFFAOYSA-N	448.476	1.353	50	20	IDGD	
CSC[C@H](C)C(=O)N1CCC(C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)CC1	799407534	VJYDOZHOSDSTTC-KBPBESRZSA-N	425.526	1.978	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)[C@@H](NS(C)(=O)=O)C(C)(C)C)c(OC)cc1Cl	802084776	JKYTXIKAZHJJJX-CYBMUJFWSA-N	436.918	1.474	50	20	IDGD	
CCOC(Cn1cc(C(=O)NNC(=O)Nc2cc(OC)ccc2Cl)nn1)OCC	802112003	WHHVDMHXPVXCHF-UHFFFAOYSA-N	426.861	1.806	50	20	IDGD	
C[C@@]12CCC(=O)N1c1ccccc1C(=O)N2CC(=O)NNc1ccc2c(=O)[nH]ccc2c1	803437954	XEDUVNUCBUHTDN-QHCPKHFHSA-N	431.452	1.970	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)[C@H](C)Oc1ccc(C=O)cc1	803965407	NRVBNNSAGZMSNC-LBPRGKRZSA-N	434.832	1.933	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NNc2ccc(-n3ccnc3)nn2)ccc1F	804954448	KKCQQRNYTFBYOV-UHFFFAOYSA-N	433.469	1.589	50	20	IDGD	
O=C(Cc1ccc(S(=O)(=O)N2CCCCC2)s1)NNc1ccc(-n2ccnc2)nn1	804955097	QHUFRZGXBPHCNX-UHFFFAOYSA-N	447.546	1.584	50	20	IDGD	
O=C(NC[C@H]1CCCS(=O)(=O)C1)NNC(=O)c1ccc(Br)cc1Cl	805067403	RNCDJOBFQTXEJC-SECBINFHSA-N	438.731	1.871	50	20	IDGD	
CC(C)(C)OC(=O)N1CCOC[C@@H]1CC(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	806346222	JFBTUZITHVJFIM-HNNXBMFYSA-N	445.476	1.365	50	20	IDGD	
COCCOc1ccc(S(C)(=O)=O)cc1NC(=O)NNC(=O)Cc1ccccc1F	806735985	INZCPIFEBMSTBV-UHFFFAOYSA-N	439.465	1.650	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(Br)c2)sn1	806975206	QOLVXNANRGGKBW-VIFPVBQESA-N	427.280	1.767	50	20	IDGD	
CCCCN1C(=O)C[C@@H](C(=O)NNC(=O)N2CCN(C)CC2)[C@H]1c1ccc(OC)cc1	807379315	WZUNQXMTTFRULD-UYAOXDASSA-N	431.537	1.373	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)c1nccn1-c1ccccc1	807583659	FUFPDNZWOZDDLW-AWEZNQCLSA-N	431.456	1.824	50	20	IDGD	
CN(C)CCOc1ccc(/C=C/C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1	808231947	HNCATXXYWMEVBN-FMIVXFBMSA-N	431.514	1.505	50	20	IDGD	
Cc1c(/C=C(\C#N)C(=O)OCC(=O)N2CCN(C(=O)c3ccco3)CC2)cc(C#N)n1C	809300963	NQNIMAUFORIVPM-LICLKQGHSA-N	435.440	1.233	50	20	IDGD	
COC(=O)c1c(F)ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C)c(C)c2)c1C	810384311	CITUFTFELGXUMB-UHFFFAOYSA-N	431.420	1.702	50	20	IDGD	
CCOc1cc(Br)c(F)cc1NC(=O)C(=O)NNC(=O)Cc1ccncc1	810387319	PUXLYVQJMPPJAD-UHFFFAOYSA-N	439.241	1.711	50	20	IDGD	
C[C@H](CN1CCOCC1)C(=O)NN=C1CCN(C(=O)OC(C)(C)C)C[C@H]1[C@H]1CCOC1	812225350	XJKMWRHDWKHTRC-SQNIBIBYSA-N	438.569	1.720	50	20	IDGD	
Nc1c(C(=O)NNC(=O)COc2ccc(Br)cc2)cnn1-c1ccccn1	814719785	DOMVUPGRSGSWRR-UHFFFAOYSA-N	431.250	1.452	50	20	IDGD	
CN(C)C(=O)CN1C(=O)C(=NNC(=O)N=c2cc[nH]cc2)c2cc(Br)ccc21	815002658	LLFMBOVFQOUOOA-UHFFFAOYSA-N	445.277	1.227	50	20	IDGD	
CC(C)(c1ccc(NC(=O)C(=O)NNC(=O)[C@H]2CCc3nncn3C2)cc1)C(F)(F)F	815692313	OGQKCGSCIOUYDF-NSHDSACASA-N	438.410	1.467	50	20	IDGD	
CCOC(=O)c1ccccc1NC(=O)C(=O)NNc1ccccc1S(=O)(=O)N(C)C	815751823	PRLMPBRVTPRUEH-UHFFFAOYSA-N	434.474	1.195	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)CNS(=O)(=O)c1c(C)c(C)cc(C)c1C	825615131	JLDIIYXIXCNMDW-UHFFFAOYSA-N	448.545	1.467	50	20	IDGD	
Cc1nn(C)c2nc(-c3cccs3)cc(C(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)c12	841751105	WPZFRZVXVHQBON-NSHDSACASA-N	433.515	1.201	50	20	IDGD	
Cn1cc(/C=C(\C#N)C(=O)Nc2cc(Cl)ccc2N2CCOCC2)c(=O)n(C)c1=O	884057851	SLELOLLDOAAWTB-UKTHLTGXSA-N	429.864	1.120	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)[C@@H]2CS[C@@H](Cc3ccccc3F)C(=O)N2)c1	891387467	BCWUKWLKOZPYKW-ROUUACIJSA-N	447.488	1.447	50	20	IDGD	
CC(=O)Nc1cccc(-n2nnnc2SCC(=O)NNC(=O)c2ccccc2Cl)c1	914531122	PNCZLJJXDFQJAA-UHFFFAOYSA-N	445.892	1.827	50	20	IDGD	
COc1nn(C)c2nc(C)c(CCC(=O)NNC(=O)Cn3cnc4ccccc43)c(C)c12	914748255	QXFLRWIROALKRM-UHFFFAOYSA-N	435.488	1.724	50	20	IDGD	
CN(C)N(C(=O)[C@H]1CC(=O)N(Cc2cccc(C(F)(F)F)c2)C1)[C@H]1CCS(=O)(=O)C1	915830352	XWYCLPYRRGAFLD-HOCLYGCPSA-N	447.479	1.546	50	20	IDGD	
CN(C)C1(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)CCCCC1	915891344	YZSLEKOYKYAYAP-UHFFFAOYSA-N	425.555	1.145	50	20	IDGD	
CC(=NNC(=O)CNc1ccc(C)cc1)c1ccc(S(=O)(=O)N2CCOCC2)cc1	915922008	UVDXNZWCBNKRAO-UHFFFAOYSA-N	430.530	1.968	50	20	IDGD	
CCC(CC)[C@@H](CNC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)N1CCOCC1	916256387	UTANXXNNKIYBAE-GOSISDBHSA-N	440.566	1.171	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)NCCNS(=O)(=O)c3ccccc3)n[nH]2)cc1	916293992	QZOUZIZIBDPCGC-UHFFFAOYSA-N	442.501	1.308	50	20	IDGD	
CCCC(=O)Nc1cccc(CNC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c1	916514071	RUIPKNIVESDTIN-UHFFFAOYSA-N	436.472	1.816	50	20	IDGD	
C[C@H](Nc1nc2ccccc2s1)C(=O)NNC(=O)c1cnc2nc(O)nc(O)c2c1	916739956	DBZMXJOLVTVFHV-QMMMGPOBSA-N	425.430	1.307	50	20	IDGD	
C[C@@H](C(=O)N(C)CC(=O)NNC(=O)c1ccc(COc2ccccc2)o1)n1cccn1	917496699	JMKJBQUBKDUZEQ-HNNXBMFYSA-N	425.445	1.536	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(S(=O)(=O)NC2CC2)cc1)c1ccc(Cl)cc1O	917758072	NRBOTVUYBQFDLQ-UHFFFAOYSA-N	445.906	1.110	50	20	IDGD	
Cc1ccccc1C1(CNC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)CCOCC1	919921589	SMJWSACVTJGBFM-UHFFFAOYSA-N	449.511	1.934	50	20	IDGD	
COc1ccc([N+](=O)[O-])c(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c1	920273488	JWDFRRZPINRURD-UHFFFAOYSA-N	427.461	1.577	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)c2ccccc2c1=O	921301231	RLHROFDRKWYBMQ-UHFFFAOYSA-N	447.411	1.585	50	20	IDGD	
COC(=O)[C@@H]1CS(=O)(=O)CCN1C(=O)/C(C#N)=C/c1cc(C)n(CCC(C)C)c1C	1120800336	YFBZPCOBIGAUJJ-MVDPLZLPSA-N	435.546	1.857	50	20	IDGD	
Cc1ccc2c(c1)S[C@@H](C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1)C2	1251902548	QNBQDBDIHDFQCG-QGZVFWFLSA-N	447.586	1.486	50	20	IDGD	
CC(=O)N1C[C@@H](C(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)Oc2ccccc21	1318567696	VLDRCCWUDXEWBJ-SFHVURJKSA-N	446.504	1.595	50	20	IDGD	
Cn1cc(N2CC[C@H](NC(=O)NNC(=O)COc3ccccc3Cc3ccccc3)C2)cn1	1322975136	LORRIWPPVUHDCN-FQEVSTJZSA-N	448.527	1.999	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)NNC(=O)[C@H]1CS[C@H](Cc2ccccc2F)C(=O)N1	1337242231	IJUMSJXHKKQIDN-RTBURBONSA-N	440.500	1.840	50	20	IDGD	
CNC(=S)NCCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(C)(C)CCl)C2	1779375331	LFCRUNVOKQCLQO-AUUYWEPGSA-N	433.018	1.249	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCOCCOCCOC)C2	1780709634	PXTVKVPJPUCECU-DBXWQHBBSA-N	448.988	1.587	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)c1ccccc1)C2)[C@H](F)Br	1780771973	XNIFLVIWTHFVHI-OAFZBRQQSA-N	443.313	1.924	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnn3c1CCC3)C2)[C@@H](F)Br	1780777353	XIHHWGQUWBFECW-IIDMSEBBSA-N	443.317	1.647	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3c(O)cc(O)cc3O)C2)C1	1781818985	SKYLVVBECHJYDP-BTDLBPIBSA-N	429.267	1.030	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C=C/c1cnccn1)C2	1782002434	PQDQSBXTRMXQPU-ZHKIMASESA-N	437.338	1.787	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCc1nnc(C)s1)C2	1782171172	QFMHHWCPVYNSOF-SPYBWZPUSA-N	444.985	1.547	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(C)nn1C(F)F)C2	1782173823	RDVOTEOTIBHULG-ZXYWRSMDSA-N	448.898	1.968	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3n[nH]c4c(Cl)cccc34)C2)C1	1782219626	CEMRBPWBDFAGOQ-KUHUBIRLSA-N	441.315	1.914	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(CCN(C(=O)c3cc4cccnc4nc3O)C2)C1	1782259937	DFPIONYGLPCKSZ-IBGZPJMESA-N	449.305	1.564	50	20	IDGD	
O=C(c1cnc2c(F)c(F)ccc2c1)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1782467673	LQWQDIBUKKXWMQ-FOIQADDNSA-N	439.846	1.556	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(CO)c(F)c3)CCO2)C1	1783352771	IFLKSPRQXRIZBU-BEFAXECRSA-N	443.313	1.935	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](N)c1cccc(Cl)c1)CCO2	1783533403	UPGVIWSIEZJTIH-QITLCBANSA-N	444.757	1.953	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](C)Br)C3)C2)n(C(F)F)n1	1783535588	ALTIZIMXECJCLB-BZNIZROVSA-N	435.269	1.814	50	20	IDGD	
Cc1ccn2c(C(=O)N3CCO[C@@]4(CCN(C(=O)[C@@H](C)Br)C4)C3)cnc2c1	1783538000	VIBYPPGMOMMOJG-AUUYWEPGSA-N	435.322	1.870	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(Cl)nc4n[nH]cc34)CCO2)C1	1783875707	PLCKRVKLKRRVAT-ACJLOTCBSA-N	442.303	1.309	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cnc4cc(Cl)ccn34)CCO2)C1	1783875972	QFDNEVXVYDFDHB-IFXJQAMLSA-N	441.315	1.685	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3ccccc3Cl)C[C@@H]21)[C@@H](O)CCl	1784089422	BTWFNIOONGHAKB-LAQRGFTBSA-N	429.344	1.852	50	20	IDGD	
C[C@H](CNC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]2C1	1787443749	SEYZEUXHSAUVTM-CAEXGNQWSA-N	435.924	1.661	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccoc3C)C[C@@H]21	1787508910	RNNGMQHWNYNQFG-MQLVQPQLSA-N	441.488	1.315	50	20	IDGD	
C[C@@H]1CCc2c(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)CCBr)C[C@@H]43)n[nH]c21	1787950371	HWFCFRFCIWDKSX-DHMWGJHJSA-N	439.354	1.838	50	20	IDGD	
COC[C@H](Cl)C(=O)NC1(c2ccc(NC(=O)CNCP(=O)(O)O)cc2)CCC1	1787971050	ZIVYUVSVXAEONN-AWEZNQCLSA-N	433.829	1.099	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)c1cc2ncccn2n1	1788303744	GCSLQARKCIXDBK-UHXUCMFUSA-N	440.273	1.013	50	20	IDGD	
COc1cc(C(=O)Nc2ccc(C3(NC(=O)c4ccc(B(O)O)cc4)CCC3)cc2)ccn1	1789772080	XJALDFYQSVXAHP-UHFFFAOYSA-N	445.284	1.832	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccnc(Cl)n3)C[C@@H]21	1789870841	ZBUSEHYFBWOFGA-BTIUKSQHSA-N	435.739	1.960	50	20	IDGD	
CCOC(=O)c1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]3C2)ccn1	1791296726	WVNNDMCYHLWWBX-YDHLFZDLSA-N	444.315	1.655	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCCn3ccnc3)[C@H]2C1	1791566094	CZUPODLPDYCQKD-NXOAAHMSSA-N	441.370	1.817	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(F)nc1F	1792372185	WZKACRLBJGSSOW-NJBDSQKTSA-N	432.265	1.594	50	20	IDGD	
CCN1CCC(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)CBr)CC1	1792872864	BNEOQCHERSEWLP-LLLHUVSDSA-N	430.387	1.339	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(C)(C)C#N)C2	1793880230	YKEYEEJGJZQMOA-XGUBFFRZSA-N	442.944	1.258	50	20	IDGD	
O=C(C[C@@H]1OCCc2ccccc21)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1	1796190061	TXEDEJZRVDHOOA-KGSLCBSSSA-N	448.328	1.322	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CCC[C@@H]1C)C2	1796441949	JHFGKINVNLKMCZ-WVMZQYFNSA-N	429.521	1.146	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(Cl)nc(OC)c1	1798291616	ROWVJWAHMPTKLG-ZWUHOBOKSA-N	432.304	1.201	50	20	IDGD	
C[C@H]1Oc2ccc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@H](F)Cl)C4)cc2NC1=O	1798583330	ZUZYNIOYYXRKQA-KDDSUGKUSA-N	425.844	1.144	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CC[C@H]2CCC(=O)N2C1	1799152865	PHQHRCOLNVPQME-YNNDZGMISA-N	425.957	1.385	50	20	IDGD	
C[C@H](Oc1ccccn1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@](C)(Cl)CCl	1799278775	XNWMZWUTKLEIGJ-WXZWTWHISA-N	430.332	1.675	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c[nH]c3nccc-3c1)C2)[C@H](F)Br	1799346216	KCCSYINIHKFZDB-CRWXNKLISA-N	425.258	1.408	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)(Cl)Cl)C2)[C@H](F)Br	1799346953	JIXVBIPRPFLOEE-YWIQKCBGSA-N	426.497	1.637	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1n[nH]c3ccc(F)cc13)C2)[C@@H](F)Br	1799349513	HSCUSGSCUVARRS-NWIKQPOISA-N	443.248	1.596	50	20	IDGD	
CCOC(=O)c1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CO[Si](C)(C)C)C3)cc1	1799791586	RBLCSMSIRMFKIT-OPVJXMOQSA-N	448.592	1.918	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)CBr)C2	1800637628	FLMGRFIAWATAOE-YYHQMBLXSA-N	440.176	1.781	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(OCCCO)cc1)C2)C(Cl)Cl	1801016393	IGXHABJFOUKONJ-MIFYACCESA-N	431.316	1.455	50	20	IDGD	
COC[C@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(Cl)c3nncn3c1)C2	1802279949	DBBHTIXFTLLGIZ-XFMPKHEZSA-N	426.304	1.888	50	20	IDGD	
COc1cncc(CCC(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)c1	1803141383	NLHDBLUOGOPXLL-LMNJBCLMSA-N	446.935	1.724	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)Cn2cc([N+](=O)[O-])cn2)[C@H]1c1cccnc1	1804421689	NVXPPJJAKYKJBE-UWWQBHOKSA-N	434.884	1.910	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC2(CCCN(C(=O)[C@@H]3CC=CCC3)C2)CC1	1805403297	MCKZZICSPQHEHS-QGZVFWFLSA-N	425.533	1.886	50	20	IDGD	
O=C(CCBr)NC[C@@H]1CCN(C(=O)c2cc[n+]([O-])cc2)[C@@H]1c1cccnc1	1806344291	ZNSCJHPXAPNCHN-FUHWJXTLSA-N	433.306	1.820	50	20	IDGD	
O=C(CCBr)NC[C@@H]1CCN(C(=O)CCn2ccnn2)[C@@H]1c1cccnc1	1806346235	CRMPPPLDFSUIHQ-MAUKXSAKSA-N	435.326	1.554	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)Cc2ccsc2)[C@H]1c1cccnc1	1807565324	ZITRBSQACYVQGT-XMSQKQJNSA-N	443.573	1.765	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1CCN(C(=O)CS(C)(=O)=O)[C@H]1c1cccnc1	1808297319	YTQUDZYDDBOAQB-QRTARXTBSA-N	436.361	1.368	50	20	IDGD	
Cc1cc(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)cn1C	1808724679	WGJYHEXFTOAPBZ-UGKGYDQZSA-N	446.316	1.042	50	20	IDGD	
COc1nc(C)ccc1C(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1	1811045005	FWCRALFRHJKWEG-JQHSSLGASA-N	432.908	1.713	50	20	IDGD	
COCCn1nccc1C(=O)N1CC[C@H](CNC(=O)[C@@H](Cl)COC)[C@H]1c1cccnc1	1813031451	VHPYWVCDGZKGSY-ZIFCJYIRSA-N	449.939	1.498	50	20	IDGD	
Cc1ccnc(C(=O)N2CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)c1	1813071303	QWSKINJLMBTLGL-PGRDOPGGSA-N	438.532	1.478	50	20	IDGD	
Cc1cc(NC(=O)CC(=O)N2CCCC[C@@H]2c2cc(NC(=O)[C@@H](O)CCl)n[nH]2)no1	1814871407	OKEANOIXAISLAN-OLZOCXBDSA-N	438.872	1.327	50	20	IDGD	
C=CCO[C@H](C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1815214483	VWTSONDUSNXJFR-DYVFJYSZSA-N	441.492	1.305	50	20	IDGD	
C[C@H](C(=O)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1)c1ccccc1	1815363958	CSTMDZFHTGNBFY-KBXCAEBGSA-N	449.341	1.852	50	20	IDGD	
Cc1ccncc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1818335780	WPSDHRPFKOSTJC-LJQANCHMSA-N	433.277	1.413	50	20	IDGD	
COc1nn(C)cc1C(=O)N[C@@H]1CCc2nc(NC(=O)CO[Si](C)(C)C)sc2C1	1820161100	PNJWTPVICDZCFR-LLVKDONJSA-N	437.598	1.963	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](O)CCl)CC2)c1cn2c(F)cccc2n1	1824134926	VWRZPRDHGHIUBG-CABZTGNLSA-N	437.884	1.755	50	20	IDGD	
O=C1COc2ccc(C(=O)N3CCC([C@@H]4CCCCN4C(=O)[C@H](O)CCl)CC3)cc2N1	1824184872	AGOILMNNGVRZPQ-ZWKOTPCHSA-N	449.935	1.851	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)Cn1nnc3ccccc31)CC2	1825994955	QVFNMHFLKLPGDB-VXGBXAGGSA-N	448.936	1.754	50	20	IDGD	
Cc1oncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1	1826029607	YKZVPJLEYBXLNJ-IBGZPJMESA-N	440.504	1.529	50	20	IDGD	
O=C([C@@H](O)CCl)N1CCC([C@H]2CCCCN2C(=O)c2nn[nH]c2C(F)(F)F)CC1	1829790917	YAPSWJLDUYRGDS-NEPJUHHUSA-N	437.850	1.657	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccn(C(F)F)n3)C2)C1	1830365568	ZSRDDLIXAAGAFT-GOSISDBHSA-N	434.871	1.613	50	20	IDGD	
O=C(CN1CCCC1=O)N1CCC([C@H]2CCCCN2C(=O)[C@H](F)Br)CC1	1830374587	IZPFDCJXSLXLLJ-PBHICJAKSA-N	432.334	1.919	50	20	IDGD	
CN1C(=O)CC[C@H]1C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H](F)Br)CC1	1830400547	GJUCKXKQLJKZGX-OFQRWUPVSA-N	432.334	1.917	50	20	IDGD	
O=C(CCCc1ccccc1F)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1	1830692393	XWBIMFYOHIELJX-GHTZIAJQSA-N	442.915	1.205	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC([C@H]2CCCCN2C(=O)CCC(N)=O)CC1	1831405477	MWJPPPYJYBMKGV-BFTFCADCSA-N	444.536	1.006	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CN2CCNC2=N)CC1	1831650514	LSCIBXVEJVKOQV-HIFRSBDPSA-N	428.375	1.229	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCc2nc(N)n[nH]2)CC1	1831830978	KYFCLSDJDFNHNK-LSDHHAIUSA-N	426.949	1.193	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](C)C3(O)CCC3)CC2)CC1	1833071586	HYCZUJSBYXIVGE-QAPCUYQASA-N	429.989	1.363	50	20	IDGD	
O=C(/C=C/c1ccco1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1833078821	XXWWHADYKXMEKY-JUPLKNRCSA-N	431.258	1.440	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)CC3CCN(C)CC3)CC2)CC1	1833135174	NXBNIDJMIILWTE-HXUWFJFHSA-N	443.032	1.544	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cc4ncsc4[nH]3)CC2)CC1)[C@H](O)CCl	1833311742	BVKQHDCSNYJIQG-MRXNPFEDSA-N	439.969	1.409	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)C)CCO2	1834734287	SBWDJAWKFYZVBC-NRFANRHFSA-N	449.460	1.246	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)Cc3ccc(F)cn3)CC2)CC1	1834838279	LWNJDXBKNDMCDH-IBGZPJMESA-N	440.947	1.589	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(CN(C(=O)CCC(F)(F)F)CCO2)C1	1835323138	LYLVFERGSATXLK-INIZCTEOSA-N	426.508	1.637	50	20	IDGD	
CC[S@](=O)CCC(=O)NC1CCN(C2CCN(C(=O)C(C)(C)CCl)CC2)CC1	1835653924	SNFRURDYGNAYNT-NDEPHWFRSA-N	434.046	1.982	50	20	IDGD	
C=C[C@@H](O)C(C)(C)C(=O)NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1	1835717271	OXEIGUUQVNKNES-CVEARBPZSA-N	448.377	1.822	50	20	IDGD	
Nc1nc2cc(C(=O)N3CCO[C@@]4(COCCN(C(=O)[C@H](F)Cl)C4)C3)ccc2s1	1835784682	KJELUJIQVHDVQH-KSSFIOAISA-N	442.900	1.483	50	20	IDGD	
Cc1ccccc1NCC(=O)N1CCO[C@@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1	1835865304	MXRLUBVTFCIONO-QFIPXVFZSA-N	449.624	1.715	50	20	IDGD	
CC1=C(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](C)CBr)C3)C2)CCO1	1836268276	OKAXVIUUBZVFOE-ACJLOTCBSA-N	431.327	1.168	50	20	IDGD	
O=C(c1nccc2occc12)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1836295694	OKFUJIMWSJABHH-SFHVURJKSA-N	428.272	1.702	50	20	IDGD	
O=C(c1cnnc2ccccc12)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836718390	WWYCLNIDBKEUMB-FQEVSTJZSA-N	446.935	1.842	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(F)c(OC)c3)C2)C1	1839148652	FKGFAWTUEZBNEF-YWZLYKJASA-N	428.888	1.922	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CC[C@@H]3CCOC3)C2)C1	1839156241	IVMSBKTZZPMCCW-AYOQOUSVSA-N	437.364	1.496	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)/C=C/c3cnccn3)C2)C1	1839156406	OMAZQSFNPGGXQB-XVXNLHAJSA-N	443.331	1.183	50	20	IDGD	
Cc1nccn1[C@H](C)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2	1839156527	RYQWXBKEYMBCFY-NIKGAXFTSA-N	447.363	1.445	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(=O)c3ccco3)C2)C1	1839962352	BPIWFANFVRLGMB-UGSOOPFHSA-N	443.294	1.092	50	20	IDGD	
COc1ccccc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2	1840034211	DTVDJGVYHBGPEB-AUUYWEPGSA-N	441.322	1.549	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3sc(C)nc3C)C2)C1	1840150235	IDQZOGXNJJNHTN-KBXCAEBGSA-N	431.942	1.084	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C(C)C)no3)C2)C1	1840154115	LWJRJCFQUBDYDM-KUHUBIRLSA-N	429.901	1.122	50	20	IDGD	
O=C(C(Cl)Cl)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3CNc4ccccc43)C2)C1	1840188149	QXOOOIFUXDTRSL-AUUYWEPGSA-N	428.316	1.456	50	20	IDGD	
C[C@H]1CC[C@H](C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)CC1	1840530728	IIZBDMBNOMACRY-ATNYBXOESA-N	435.334	1.960	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C13CCC(CC1)CC3)CCO2	1840543906	GAVJFSTUCNLIJN-BWGXQHLSSA-N	428.957	1.667	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC12CN(C(=O)CCNC(=O)c1ccc[nH]1)C2	1841285687	JYKYREDSLZXGHC-ZDUSSCGKSA-N	425.327	1.369	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)CCc2ccc(C)cn2)C1	1842044786	TVORXJPPQXJKTH-YZSQISJMSA-N	436.516	1.660	50	20	IDGD	
O=C(c1c[nH]c2cc(Cl)ccc12)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843011312	RIYHPUMOQMJIAS-UHFFFAOYSA-N	437.692	1.632	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)/C=C/c1cccc(O)c1)C2	1843417049	QWFQSHKXZKUBQC-IVTGQKOESA-N	435.484	1.743	50	20	IDGD	
CC(=O)C[C@@H](C)C(=O)N1CC2(CCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)C1	1845039320	FGAGCABCRGMQRG-QGZVFWFLSA-N	443.548	1.151	50	20	IDGD	
Cc1c(C(=O)N2CC3(CCCN3C(=O)[C@@](C)(Cl)CCl)C2)cn2[nH]cnc(=O)c12	1845171837	ZLJKBXRPTKWRGL-KRWDZBQOSA-N	426.304	1.384	50	20	IDGD	
O=C(c1ccc(N2CCOCC2)cn1)N1CC2(CCCN2C(=O)[C@@H](F)Br)C1	1845216780	KNYCXQYFULFNHW-OAHLLOKOSA-N	441.301	1.426	50	20	IDGD	
CCOC(=O)c1ncn2c1CC[C@H](C(=O)N1CCCC13CN(C(=O)[C@@H](Cl)CC)C3)C2	1845863351	VGKWGVMYEJPCKJ-GJZGRUSLSA-N	436.940	1.843	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CCc1cccc([N+](=O)[O-])c1	1847995238	BCVRCINAKNQELF-ROUUACIJSA-N	431.493	1.102	50	20	IDGD	
Cn1nc(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)cc1O	1848095673	MHCDJUOJVQBUDV-IHRRRGAJSA-N	441.916	1.073	50	20	IDGD	
Cc1c(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)cnn1C	1848095860	VWCXOLJLCOOJJH-JYJNAYRXSA-N	439.944	1.676	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)CCNc2ccccc2[N+](=O)[O-])cc1	10890986	WROQPMKQWUZZSW-UHFFFAOYSA-N	449.489	1.173	50	20	IDGD	
COc1ccc(-c2noc(CCC(=O)OCC(=O)NNC(=O)c3ccc(C)cc3)n2)cc1	12262591	ONJQCGCDLFUTQE-UHFFFAOYSA-N	438.440	1.991	50	20	IDGD	
Cc1cc(C)cc(OCc2nnc(SCC(=O)NNC(=O)c3ccc(F)cc3)n2N)c1	24197233	DCUODWCFQDJYSC-UHFFFAOYSA-N	444.492	1.880	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)c1ccc(Cl)c(S(C)(=O)=O)c1	26736983	NNYJPTLOTJAJMG-UHFFFAOYSA-N	426.878	1.982	50	20	IDGD	
COCCCNC(=S)N(C)NC(=O)c1cccc(CN2C(=O)c3ccccc3C2=O)c1	726075497	IKISTAVAMOQZEM-UHFFFAOYSA-N	440.525	1.970	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(CNC(=O)NNC(=O)COc2ccc(C#N)cc2)CC1	726267382	YVXHXEXWGVUDCF-UHFFFAOYSA-N	431.493	1.915	50	20	IDGD	
CC(C)(C)OC(=O)N1Cc2ccccc2C[C@@H]1C(=O)NNC(=O)CNC(=O)c1ccco1	727156279	CCZGRORFHWZIHF-MRXNPFEDSA-N	442.472	1.519	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NNc2nc(-c3cccnc3)no2)s1	728077261	UTGVSKXAZLEYQX-ZDUSSCGKSA-N	434.503	1.798	50	20	IDGD	
Cc1cc(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)c2n[nH]cc2c1	728214514	QIEYRVHRLKKPHI-UHFFFAOYSA-N	428.518	1.564	50	20	IDGD	
O=C(COC(=O)c1c[nH]nc1C1CCCCC1)NNC(=O)[C@H]1COc2ccccc2O1	728344232	SZIIKVQAMFTCHW-QGZVFWFLSA-N	428.445	1.602	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(\C#N)C(=O)N2CCN(C(=O)CN3CCCC3)CC2)c1C	728551767	MZGPHJMYMPYQMT-KWJZBXMYSA-N	441.576	1.986	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)COc2ccccc2C(F)(F)F)n1	728721849	IYFLQAWMVRBZNO-UHFFFAOYSA-N	431.392	1.782	50	20	IDGD	
C[C@H](C(=O)NNC(=O)c1cccc(C#N)c1)N1C(=O)c2ccc(Br)cc2C1=O	728828659	VKKZJVLZPBODDR-SNVBAGLBSA-N	441.241	1.766	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)[C@@H]1CC(=O)N(c2ccc3c(c2)OCCO3)C1	729449754	BHJNZRMVBFYXIT-MRXNPFEDSA-N	434.452	1.613	50	20	IDGD	
CCc1ccccc1-n1cnnc1SCC(=O)NNC(=O)COc1ccccc1O	730778523	PWVZUEDTYBNNDM-UHFFFAOYSA-N	427.486	1.854	50	20	IDGD	
COc1ccc([C@@H](CNC(=O)NNC(=O)COc2ccccc2O)N2CCOCC2)cc1	730901753	FDCNIFIWVIMLEQ-GOSISDBHSA-N	444.488	1.184	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)N(C)CCCC(=O)NNC(=O)Cc2ccccc2F)cc1	731329367	HXKFSIKQDKFSKG-UHFFFAOYSA-N	449.504	1.819	50	20	IDGD	
COc1ccc(Cn2cc(C(=O)OCC(=O)NNC(=O)Cc3nc(C)cs3)cn2)cc1	731741231	LNJVLHHZXYEJPX-UHFFFAOYSA-N	443.485	1.252	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)NC2CCN(CC(=O)N(C)C)CC2)c(C)n1-c1ccccc1	731762359	QNXBVSHLKCESIK-UHFFFAOYSA-N	440.548	1.591	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)[C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)cc1	732050327	SHNRDJLKWZMTOD-CQSZACIVSA-N	443.441	1.359	50	20	IDGD	
Cc1nn(CCCl)c(C)c1C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	733908790	CAAUVULARJEIJF-UHFFFAOYSA-N	432.956	1.712	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2cccc(C(=O)NNS(=O)(=O)c3cnc[nH]3)c2)c(C)c1	736540525	ZUKUJXDUJJEXOS-UHFFFAOYSA-N	449.514	1.451	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2coc(-c3ccccc3)n2)CC1	738544312	ZKWOUGYVQBCPFS-UHFFFAOYSA-N	442.501	1.430	50	20	IDGD	
O=C(NCCCCc1ccc([N+](=O)[O-])cc1)NNC(=O)c1csc(N2CCOCC2)n1	740483421	RENWEZINCKUZGG-UHFFFAOYSA-N	448.505	1.855	50	20	IDGD	
CC(C)c1ccc(N2CC[C@H](C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)C2=O)cc1	741660602	XMPSVJVRYVDKKK-LJQANCHMSA-N	433.472	1.600	50	20	IDGD	
C[C@H](CC(=O)NNC(=O)c1cc2c(s1)CCC2)/N=C1/NS(=O)(=O)c2ccccc21	742473927	KHXRNWFWPHIWJC-LLVKDONJSA-N	432.527	1.515	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)C(=O)N1CCCC[C@H]1C	743581741	FAYUUXQKLLCJEK-CHWSQXEVSA-N	425.511	1.215	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1cnn(Cc2ccccc2)c1	744621814	GYOOAAGVSWKHQD-UHFFFAOYSA-N	441.513	1.709	50	20	IDGD	
CCOC(=O)COc1ccc(CCNC(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1	745912278	RFKCEJKIAUYZLH-UHFFFAOYSA-N	443.456	1.586	50	20	IDGD	
COc1ccc(-c2nn(CCC#N)cc2/C=C(/C#N)C(=O)NNC(=O)N(C)C)cc1OC	746005999	IPWQTYJVAGFDCD-GDNBJRDFSA-N	437.460	1.690	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N2CCC(C(=O)NNc3nc(C)cc(OC)n3)CC2)cc1	746629943	BNPXGFFIUIHAIF-UHFFFAOYSA-N	449.533	1.736	50	20	IDGD	
CNS(=O)(=O)c1ccc([C@H](C)NC(=O)NNC(=O)c2cccc3cccnc23)cc1	747537883	ICLHPEWTQMKBAX-ZDUSSCGKSA-N	427.486	1.848	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)N[C@@H]1CCCN(Cc2ccc(F)cc2Cl)C1	748631190	LNRYJFRYDGEPQO-XJKSGUPXSA-N	430.908	1.825	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)o1	748639504	HDKSCPWNWNDGHY-UHFFFAOYSA-N	428.419	1.105	50	20	IDGD	
COc1cc(OC)cc(N2CC[C@@H](NC(=O)NNC(=O)COc3ccc(C#N)cc3)C2)c1	748662172	QOCZLXLZLSVXGL-MRXNPFEDSA-N	439.472	1.564	50	20	IDGD	
Cc1cccc(CCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1	749184880	CTZQWOMUHAREGA-UHFFFAOYSA-N	430.530	1.966	50	20	IDGD	
C[C@H]1C(=O)Nc2cc(C(=O)NNc3ccc(S(=O)(=O)NC4CC4)cc3)ccc2N1C	749955211	FZWHSTRCTTYBBI-LBPRGKRZSA-N	429.502	1.661	50	20	IDGD	
Cc1c(C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)cnn1CCC(C)C	750537112	CCKSFDBRZJTKMA-UHFFFAOYSA-N	449.581	1.326	50	20	IDGD	
Cc1cnc([C@H](C)NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)s1	750665426	XGUCMUREFTWYCS-ZDUSSCGKSA-N	437.547	1.941	50	20	IDGD	
N#Cc1ccc(CN2CC[C@H](NC(=O)NNC(=O)COc3ccc(F)cc3)C2=O)cc1	753736984	AJGBLXNZSZXOJB-SFHVURJKSA-N	425.420	1.208	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)n([C@@H]2CCS(=O)(=O)C2)n1	755530630	GSXHETXQDIAHCG-CQSZACIVSA-N	443.489	1.408	50	20	IDGD	
CON(C)S(=O)(=O)c1ccc(NC(=O)NNC(=O)c2ccc3ccccc3n2)cc1	755531276	CSYQMIRAQRJUMR-UHFFFAOYSA-N	429.458	1.883	50	20	IDGD	
CN1CC(=O)N(c2cccc(NC(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)c2)C1=O	755992013	KXQSUFTYFVTXLJ-UHFFFAOYSA-N	448.480	1.543	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1ccc2c(c1)CCN2C(=O)OC(C)(C)C	756309033	FIVWVOSRHFJWDN-LLVKDONJSA-N	441.510	1.075	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN[C@](C)(C(N)=O)c2cccc(Cl)c2)cc1OC	756602167	SADNHHFBOQAOCV-FQEVSTJZSA-N	434.880	1.109	50	20	IDGD	
O=C(NNC(=O)C12CC3CC(CC(C3)C1)C2)Nc1cnn(CC(=O)N2CCOCC2)c1	756836555	XCRSZSYGJUOZSC-UHFFFAOYSA-N	430.509	1.111	50	20	IDGD	
NC(=O)c1ccc(NNC(=O)C2CCN(C(=O)c3ccc(C(F)(F)F)cc3)CC2)nn1	757401923	GVKKTGSWHLFVPW-UHFFFAOYSA-N	436.394	1.590	50	20	IDGD	
COC(=O)c1cc(NC(=O)NNC(=O)COc2cc(C)cc(C)c2)cc(S(C)(=O)=O)c1	757674444	UUKXJIASQKINMC-UHFFFAOYSA-N	449.485	1.725	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1ccnc(Br)c1	758157904	LABHQYYMOFENOM-UHFFFAOYSA-N	426.296	1.520	50	20	IDGD	
CS(=O)(=O)N1CCc2c(NC(=O)NNC(=O)COc3ccccc3C#N)cccc21	758299037	NPMVBYQJGZAYRR-UHFFFAOYSA-N	429.458	1.112	50	20	IDGD	
COCCOc1cc(C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)nc2ccccc12	758400109	ATFLNRCKXCKIDM-UHFFFAOYSA-N	443.481	1.738	50	20	IDGD	
Cc1c([C@@H](C)NC(=O)NNC(=O)C(=O)Nc2ccccn2)cnn1-c1ccc(F)cc1	758693141	ALRVCNXFRSRELO-GFCCVEGCSA-N	425.424	1.745	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)c1cnn(CCO[C@@H]2CCCCO2)c1C	760122699	BJKLFTHIKBNYKW-HXUWFJFHSA-N	431.493	1.616	50	20	IDGD	
N#Cc1cccc(C(=O)NNS(=O)(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)c1	760361877	BYPYVASZPSWFTL-UHFFFAOYSA-N	448.526	1.356	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NN=C2C(=O)Nc3cc(N(C)C)ccc32)cc1	761750099	UUMRDWGMAHZSRN-UHFFFAOYSA-N	429.502	1.154	50	20	IDGD	
CCc1ncc(S(=O)(=O)NNC(=O)c2ccc(CSc3nncn3C)cc2)s1	763372577	CIVLJOWVRBEZNX-UHFFFAOYSA-N	438.560	1.750	50	20	IDGD	
CCN(Cc1ccccc1NC(=O)C(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)C(C)=O	763442396	OWJLWVWNGPPORM-UHFFFAOYSA-N	427.417	1.363	50	20	IDGD	
COc1cc2nc(C)sc2cc1NC(=O)C(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	763444828	BJPDFCFOSRFCGC-UHFFFAOYSA-N	429.414	1.921	50	20	IDGD	
CCNC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)COc2cc(C)ccc2C)c1	763668345	LEVAHEGAGAMBEU-UHFFFAOYSA-N	427.461	1.610	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)C(=O)Nc2cc(C#N)ccc2C)c2ccccc2c1=O	763801293	MONLIIPZDVBHAP-UHFFFAOYSA-N	446.467	1.776	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccc(Oc2cnccn2)c1	763812075	BUVFRAIPFCLGKQ-UHFFFAOYSA-N	432.396	1.305	50	20	IDGD	
Cc1nccn1-c1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)cn1	763851039	TUGWFOHWMWQYGA-GFCCVEGCSA-N	426.408	1.268	50	20	IDGD	
CCOC(=O)c1c(C)csc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccc(F)cc1	763873856	ZPCDRVSIWKUZSC-LLVKDONJSA-N	437.449	1.926	50	20	IDGD	
COC(=O)CCSc1cccc(NC(=O)C(=O)NNC(=O)Cc2ccc(F)cc2)c1	763918282	AJSRKCCGWHCSLT-UHFFFAOYSA-N	433.461	1.810	50	20	IDGD	
C[C@H](Oc1ccccc1NC(=O)C(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1)c1ccccc1	764001597	BFWBDXPDLIKFSS-HOCLYGCPSA-N	445.497	1.347	50	20	IDGD	
CC(C)(C)[S@](=O)Cc1cccc(NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)c1	764164643	SASWOXKMORACJW-WTPASJBYSA-N	443.525	1.823	50	20	IDGD	
CN(C)CC(=O)NNC(=O)C(=O)Nc1ccc(NC(=O)c2ccco2)cc1C(F)(F)F	764205098	YZZVWBZJDXKQMQ-UHFFFAOYSA-N	441.366	1.198	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CCc2ccccc2O)c(OC[C@H]2CCCO2)c1	764289913	ZKNQAQMBNITVTR-QGZVFWFLSA-N	441.484	1.977	50	20	IDGD	
COCC(=O)NNC(=O)C(=O)Nc1ccc(OC)c(NC(=O)Nc2ccccc2OC)c1	764300028	RMTOUMUORQUXOL-UHFFFAOYSA-N	445.432	1.080	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)C(=O)Nc1c(C)n(C)n(-c2ccccc2)c1=O)c1ccccc1	764329247	VSQUFKWVPVYDIW-GOSISDBHSA-N	435.484	1.764	50	20	IDGD	
O=C(CCN1C(=O)[C@H]2CCCC[C@H]2C1=O)NNc1c(F)cc(C(=O)NC2CC2)cc1F	764333090	DKPDPURTZONPOA-OKILXGFUSA-N	434.443	1.865	50	20	IDGD	
C[C@H]1C[C@H](C)CN(S(=O)(=O)c2ccc(NC(=O)C(=O)NNC(=O)C3CCC3)cc2)C1	764340994	BYEIEKBTVBZHPY-KBPBESRZSA-N	436.534	1.239	50	20	IDGD	
Cc1cc(C)n(-c2ccc(NC(=O)C(=O)NNC(=O)CSc3ccccc3O)cn2)n1	764401620	PIVYXPTWQYEWPR-UHFFFAOYSA-N	440.485	1.468	50	20	IDGD	
C[C@](O)(CNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)c1ccccc1Cl	765242551	FEKLFJGDHBBENB-FQEVSTJZSA-N	432.912	1.585	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)CSc1nnc(-c2ccncc2)n1-c1ccccc1	765441526	MOFXPBJIOPCTPA-UHFFFAOYSA-N	434.485	1.914	50	20	IDGD	
C[C@@H](Oc1cccnc1)C(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	765757537	VCZYEVOPMWDPEB-MRXNPFEDSA-N	431.924	1.468	50	20	IDGD	
C[C@H]1C[C@@H]1c1ccc(CCC(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)o1	766642900	OOYUMKUIOQJKRW-PXNSSMCTSA-N	438.528	1.941	50	20	IDGD	
COc1cccc(C[C@@H](C(=O)NNc2ccccc2S(C)(=O)=O)n2nnnc2C)c1	766664259	ZSPDNQGYMSBDFB-KRWDZBQOSA-N	430.490	1.321	50	20	IDGD	
O=CNc1ccc(C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)cc1	766669196	OEXYGFONHNVECF-UHFFFAOYSA-N	429.908	1.487	50	20	IDGD	
Cc1sc2nc(CC(=O)NN=C(CNS(C)(=O)=O)c3ccccc3)nc(O)c2c1C	766687500	NJYPBHUHFZSQTP-UHFFFAOYSA-N	447.542	1.626	50	20	IDGD	
COC(=O)C1(C(=O)NNC(=O)c2cccc(S(=O)(=O)Nc3ccc(OC)cc3)c2)CC1	766955705	USQXWAKUJFSYNG-UHFFFAOYSA-N	447.469	1.210	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)[C@@H](C)NS(=O)(=O)c1cccc(C#N)c1	767736181	XEAHUOSRYRKNFU-CQSZACIVSA-N	430.486	1.014	50	20	IDGD	
CC[C@@H](N=c1nn[nH]n1-c1ccccc1)C(=O)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	768288909	HSAYWFXRGJXXES-MRXNPFEDSA-N	449.450	1.265	50	20	IDGD	
CC(=O)Nc1cccc(-n2nnnc2SCC(=O)NNC(=O)Cc2ccccc2C)c1	768290449	HMLDQNNADYOCDD-UHFFFAOYSA-N	439.501	1.411	50	20	IDGD	
NS(=O)(=O)c1cccc2c(C(=O)NNC(=O)NCc3ccc(Cl)cc3)nccc12	768478787	OERQBOIRTJLVML-UHFFFAOYSA-N	433.877	1.680	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2cccc(C(=O)NNC(=S)Nc3ccccn3)c2)C[C@H](C)O1	768585446	MOSRABIAFISVPT-KBPBESRZSA-N	449.558	1.511	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)[C@H](C)NS(=O)(=O)c3cccs3)n[nH]2)cc1	768848050	MUZCFXNCHQKYKL-LBPRGKRZSA-N	433.515	1.575	50	20	IDGD	
C=CCN1C(=O)c2ccc(C(=O)NNc3nc(O)c4cnn(C(C)(C)C)c4n3)cc2C1=O	770955966	RUAKDIOBUNCXIV-UHFFFAOYSA-N	435.444	1.826	50	20	IDGD	
COc1ccc2c(c1)nc(CNC(=O)NNc1ccc(S(=O)(=O)NC(C)C)cn1)n2C	771391420	IPWMGWIWFJCGJS-UHFFFAOYSA-N	447.521	1.490	50	20	IDGD	
C[C@H](NC(=O)c1ccc(Cl)cc1)C(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772202125	YQLRWUPLZJSHCW-NSHDSACASA-N	437.283	1.576	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)[C@H]3CC(c4ccccc4)=NO3)cc2)CC1	772442456	NNGIYCOVZSJLAY-HXUWFJFHSA-N	443.529	1.259	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NN=Cc1ncc(C2OCCO2)s1	773068497	NAIDWYHKGHSYME-UHFFFAOYSA-N	429.502	1.097	50	20	IDGD	
O=C(NNc1ccc(Cl)c(F)c1)C(=O)Nc1cnn(Cc2nnc3n2CCCC3)c1	773708176	CVOSBBYNPDUMRR-UHFFFAOYSA-N	432.847	1.734	50	20	IDGD	
COC(=O)c1cc(N2CCOCC2)ccc1NC(=O)C(=O)NNc1c(F)cccc1F	773710232	ZDAPMKOHCCCRGH-UHFFFAOYSA-N	434.399	1.670	50	20	IDGD	
CC(C)c1nccnc1NNC(=O)C(=O)Nc1ccc(Cl)c(S(=O)(=O)N(C)C)c1	773997142	GDZXKPVBOPAUJC-UHFFFAOYSA-N	440.913	1.586	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)NCC(=O)N2CCN(c3ccccc3)CC2)c1	776618906	GDYUXPRVTNGXLP-UHFFFAOYSA-N	431.518	1.065	50	20	IDGD	
O=C(NC[C@H]1COC2(CCOCC2)O1)NNC(=O)c1ccc(COc2ccccc2)o1	776885758	SPKHEAFJGLRKOO-KRWDZBQOSA-N	431.445	1.725	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)[C@@]1(F)CCN(C(=O)OCc2ccccc2)C1	776968523	XOKNXZXQPGTABA-JOCHJYFZSA-N	445.447	1.972	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)c1ccc(I)c(F)c1	778437707	JRVRKHLYHQLVMV-UHFFFAOYSA-N	437.209	1.716	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@H](C(=O)NNc2ccc(Cl)cc2[N+](=O)[O-])[C@H](C)O)cc1	779501926	TXCWXMBONCGXMK-ZBEGNZNMSA-N	442.881	1.728	50	20	IDGD	
CC(C)(C)OC(=O)NCc1ccc(NC(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)cc1	779503586	SFUPWUVXPKAQQG-CYBMUJFWSA-N	426.495	1.299	50	20	IDGD	
O=C(NNC(=O)[C@@H](O)[C@@H](O)c1nc2ccccc2[nH]1)c1ccc(COc2ccccc2)o1	779582263	NGQZTHUAFAUXMH-MOPGFXCFSA-N	436.424	1.590	50	20	IDGD	
Cc1cc(N2C[C@@H](C(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)CC2=O)ccc1F	779839668	NTQBVBZIWNPAAL-AWEZNQCLSA-N	433.461	1.352	50	20	IDGD	
CC(C)[C@H]1C[C@H](CC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)CCO1	782017456	ZARVOHAJEYZWMI-YLJYHZDGSA-N	438.594	1.907	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccccc2CCN(C)C)cc(OC)c1OC	782701947	MEQQZULMKYCJPS-UHFFFAOYSA-N	444.488	1.216	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ncnc3ccsc23)cc1	783254966	OYKILRWFRPHEAN-UHFFFAOYSA-N	434.503	1.460	50	20	IDGD	
O=C(NNc1ccc(-n2cccn2)nn1)C(=O)Nc1ccc(-c2n[nH]c(C3CC3)n2)cc1	783437065	RTFKLQXMSLFZLN-UHFFFAOYSA-N	430.432	1.407	50	20	IDGD	
CC(C)(C)c1nc2ccc(NC(=O)C(=O)NNC(=O)CNC(=O)c3ccco3)cc2s1	784003065	ZXTVQOPYJYODBP-UHFFFAOYSA-N	443.485	1.703	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)C(=O)Nc1ccc(Oc2ccc(F)cc2)nc1	784005043	XQWFSLZTPFTQMH-UHFFFAOYSA-N	441.375	1.122	50	20	IDGD	
Cc1cn(-c2ccc(C#N)cn2)nc1NC(=O)C(=O)NNc1ccc(Br)nc1	784810753	GQFRDGRRKFOWSE-UHFFFAOYSA-N	441.249	1.687	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1nn(-c2ccccc2)cc1C	785330703	KLKLTQXSBJEVKS-UHFFFAOYSA-N	443.485	1.675	50	20	IDGD	
Cc1cc2c(cc1C)O[C@H](C(=O)OCC(=O)NNC(=O)[C@@H]1COc3ccccc3O1)C2	786392418	VVWOMOHMGKXAFX-OALUTQOASA-N	426.425	1.138	50	20	IDGD	
N#CCCCN1C(=O)CCc2cc(NC(=O)C(=O)NNC(=O)Cc3ccsc3)ccc21	787888615	CVYNCGINULIQMS-UHFFFAOYSA-N	439.497	1.660	50	20	IDGD	
Cc1cc(=O)n(CC(=O)NC(C)C)c(C)c1C(=O)NNc1nnc(-c2ccccn2)s1	788561255	AQIMQRXQBZUZJV-UHFFFAOYSA-N	441.517	1.660	50	20	IDGD	
COc1ccc(C(=O)NCC(=O)NNc2nnc(-c3ccccn3)s2)cc1[N+](=O)[O-]	788562449	JCVVDYBVOFZVCM-UHFFFAOYSA-N	429.418	1.390	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=S)NCCc1ccc(F)cc1	789273164	IOFJCLDZKYCEHT-UHFFFAOYSA-N	443.548	1.322	50	20	IDGD	
Cc1c(C(=O)NNC(=O)COc2ccc(C#N)cc2)nnn1Cc1ccc(F)cc1F	790112692	IJQCJPHONIIQCM-UHFFFAOYSA-N	426.383	1.625	50	20	IDGD	
O=C(NNc1cccc(F)c1[N+](=O)[O-])C(=O)Nc1ccc(S(=O)(=O)NC2CC2)cc1	790994138	QSERZKPZHHQQRU-UHFFFAOYSA-N	437.409	1.256	50	20	IDGD	
Cc1nnnn1[C@H](Cc1ccc(F)cc1)C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	794721174	QDLBIHLNAAJALK-GOSISDBHSA-N	447.496	1.298	50	20	IDGD	
COc1ccccc1CCNC(=O)CNC(=O)NNC(=O)c1cccc(OC(F)F)c1	798063898	OKQIGTZGBMCNSP-UHFFFAOYSA-N	436.415	1.600	50	20	IDGD	
Cc1ccc(-c2ccnn2C)cc1NC(=O)C(=O)NNC(=O)COc1ccccc1F	799258043	YOMNQXKMHSIIPW-UHFFFAOYSA-N	425.420	1.700	50	20	IDGD	
NC(=O)c1cc(Br)cc(S(=O)(=O)NNC(=O)c2ccc(Cl)nc2)c1	799521492	GKSYMLLUSOXPMV-UHFFFAOYSA-N	433.671	1.220	50	20	IDGD	
C/C(C=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O)=C/c1ccccc1C(F)(F)F	799873218	BKLGZDAGJGBSKG-YIHCTDQQSA-N	441.435	1.795	50	20	IDGD	
COc1ccc(-c2nnc(S)n2CC(=O)NNC(=O)C(=O)Nc2ccc(C)cc2)cc1	801112141	XVLKLVXPJQSWDZ-UHFFFAOYSA-N	440.485	1.337	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCCCC2)cc1)NNC(=O)N=c1cc[nH]cc1	802030287	XYASUIXWLLNTKK-UHFFFAOYSA-N	431.518	1.464	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)[C@H](C)S(=O)(=O)C2CCOCC2)cc1Cl	802076321	HDVYMUPJCXPVAD-JTQLQIEISA-N	449.913	1.492	50	20	IDGD	
COc1ccc(C2=NO[C@@H](CNC(=O)NNC(=O)c3ccc4c(c3)OCCO4)C2)cc1	802371104	PGNVISYHDHIJRA-MRXNPFEDSA-N	426.429	1.604	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)Nc1cc(F)c(N2CCOCC2)cc1F	806742280	DWKYJTYCJLAQCP-UHFFFAOYSA-N	444.402	1.244	50	20	IDGD	
CC1CCN(S(=O)(=O)c2ccc(NC(=O)C(=O)NNc3cccc(F)n3)cc2)CC1	807392811	YYZGAVVJACCFCY-UHFFFAOYSA-N	435.481	1.723	50	20	IDGD	
CC(C)Oc1ccc([C@@H](CNC(=O)NNc2nc(O)c3cnn(C)c3n2)N(C)C)cc1	807588839	QGGDOHNUQNCEJX-MRXNPFEDSA-N	428.497	1.785	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)c1c(Br)nnn1C	809981184	BWGICXIKPSWMLR-SSDOTTSWSA-N	447.087	1.569	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)Nc2cccc(N3C(=O)NC(C)(C)C3=O)c2)c1	812976137	WCRVUJDSSQTSLV-UHFFFAOYSA-N	439.432	1.341	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2cc3c(cc2Cl)OCO3)cc1	813033627	CHAZVZBALXKWOO-UHFFFAOYSA-N	440.865	1.401	50	20	IDGD	
N#Cc1cccc(C(=O)NNS(=O)(=O)CCCCN2C(=O)c3ccccc3C2=O)c1	814211289	XNZHCOHDZCXDQJ-UHFFFAOYSA-N	426.454	1.199	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2cc(C(=O)NNC(=O)CC3CC3)ccc2Cl)C[C@H](C)O1	819104985	VCQLXYJYBWBTMT-RYUDHWBXSA-N	429.926	1.699	50	20	IDGD	
O=C(NNC(=O)c1cnn2cccnc12)c1nn(Cc2ccccc2)c(=O)c2ccccc12	912895642	HEVCOCPYTHGXLG-UHFFFAOYSA-N	439.435	1.562	50	20	IDGD	
O=C(CN1CCCCCC1=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	913151820	YUQLTPLAFQFURU-UHFFFAOYSA-N	436.534	1.025	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(=O)n(CC(=O)/C(C#N)=C2/Nc3ccccc3N2C)c1	913584278	WPACJHHLPUFPEI-PGMHBOJBSA-N	441.513	1.745	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)C1CCN(c2cnccn2)CC1	914084184	XCODTLZVPKYGLW-UHFFFAOYSA-N	437.548	1.053	50	20	IDGD	
CC(C)c1ccc(S(=O)(=O)c2ccc(NNC(=O)CN(C)S(C)(=O)=O)cc2)cc1	914712004	FOFZJBGUVRIIJS-UHFFFAOYSA-N	439.559	1.977	50	20	IDGD	
CC(C)NS(=O)(=O)c1cc(C(=O)NNC(=S)NCCc2cccs2)ccc1F	914881358	CUWHQLGTGDZMRI-UHFFFAOYSA-N	444.579	1.926	50	20	IDGD	
Cc1cc(C)nc(SCc2ccc(C(=O)NNC(=O)CN3CCCS3(=O)=O)cc2)n1	915874741	ZIGPARVUDHIQIM-UHFFFAOYSA-N	449.558	1.182	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NC[C@H](c2cccs2)N2CCOCC2)cc1	915893243	HDNRLWTVOJWBOP-QGZVFWFLSA-N	434.518	1.539	50	20	IDGD	
Cc1cc(C=NNC(=O)[C@@H](C)CN2C[C@H](C)O[C@H](C)C2)c(C)n1CCN1CCOCC1	915954500	GDKXOWSRBUYXME-YSIASYRMSA-N	433.597	1.633	50	20	IDGD	
CN(C)N(C(=O)c1cnn(-c2ccc(Br)cc2)c1)[C@H]1CCS(=O)(=O)C1	916040932	HQJWCKDBOCQRPS-HNNXBMFYSA-N	427.324	1.741	50	20	IDGD	
CN(C)N(C(=O)CCNC(=O)Nc1ccc(Br)cc1)[C@@H]1CCS(=O)(=O)C1	916041160	RFTCVTBFVNORMW-CQSZACIVSA-N	447.355	1.453	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2c[nH]nc2-c2ccncc2)c1	916107999	QJGSRFHMXNCZJC-UHFFFAOYSA-N	442.501	1.577	50	20	IDGD	
CCS(=O)(=O)N1CCC(NC(=O)NNC(=O)CC23CC4CC(CC(C4)C2)C3)CC1	916260206	TZAWWTOLNBWWNQ-UHFFFAOYSA-N	426.583	1.737	50	20	IDGD	
CC(=NNC(=O)COc1ccc(C#N)cc1)c1ccc(S(=O)(=O)N2CCOCC2)cc1	916300501	IULMTLJEVFNRCJ-UHFFFAOYSA-N	442.497	1.498	50	20	IDGD	
O=C(NCCc1ccc(OC(F)(F)F)cc1)NNC(=O)c1ccc(-n2cnnn2)cc1	916499373	QKYXFGPVVMDULK-UHFFFAOYSA-N	435.366	1.748	50	20	IDGD	
O=C(CCC(=O)N1CCc2sccc2C1)NNC(=O)c1cc(Br)c[nH]1	917667393	MKFKBULTQZCCJD-UHFFFAOYSA-N	425.308	1.965	50	20	IDGD	
COc1ccc(S[C@H](C)C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1	917918761	DPEBXFUBDGYZSN-SNVBAGLBSA-N	443.934	1.938	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@H](C)COc2cccc(C)c2)cc1	919781776	TYEQZAPDCJCIBY-QGZVFWFLSA-N	448.545	1.722	50	20	IDGD	
Cc1noc2nc(-c3ccccc3)cc(C(=O)NNC(=O)N[C@H]3CCS(=O)(=O)C3)c12	919889990	XWZOPENCNQAWDV-ZDUSSCGKSA-N	429.458	1.329	50	20	IDGD	
CS(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)c2ccc3ccccc3n2)c(F)c1	919955430	YQXNCWDKKOPLIC-UHFFFAOYSA-N	438.462	1.369	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)NCc1cccc(NC(=O)[C@H]2CCCO2)c1	920236335	BCYYQEHUGUZPNT-QGZVFWFLSA-N	436.472	1.904	50	20	IDGD	
Cc1nn(Cc2ccc(F)cc2)c(Cl)c1C=NNC(=O)N[C@@H]1CCS(=O)(=O)C1	920380221	HZLLHUVYKJQYBQ-CQSZACIVSA-N	427.889	1.853	50	20	IDGD	
COC(=O)c1ccc(COc2ccc(C=NNC(=O)N[C@@H]3CCS(=O)(=O)C3)cc2)cc1	920381759	TYSCJGXMGJDXGQ-GOSISDBHSA-N	445.497	1.872	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)Nc2cccc(CN3CCC[C@@H]3C(N)=O)c2)c1	920930017	DJBXJPXHUFFOMI-LJQANCHMSA-N	441.488	1.620	50	20	IDGD	
O=C(COC(=O)c1ccc(Cn2cccn2)cc1)NNC(=O)[C@H]1COc2ccccc2O1	928977173	VXEXWWPIZDJCJA-LJQANCHMSA-N	436.424	1.076	50	20	IDGD	
N#CCCn1cc(/C=C(/C#N)C(=O)NS(=O)(=O)C2CCOCC2)c(-c2ccccc2)n1	1115912307	QPXVZMQZYZGKHV-LGMDPLHJSA-N	439.497	1.996	50	20	IDGD	
Cc1cc(C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)nc2ccccc12	1160865772	XJLWGMUJJNOHHJ-UHFFFAOYSA-N	440.529	1.631	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)[C@@H]2CC23CCS(=O)(=O)CC3)c1	1322935864	VPJMQOOTLJBEAR-LBPRGKRZSA-N	431.308	1.434	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)COC(=O)C(F)(F)F)C2)C1	1778894592	LZMNREYBHFWQHT-HZMBPMFUSA-N	445.232	1.095	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CNC(=O)c2cc(C)on2)C1	1779435750	IGMHOHHGCJPAGS-AKCHCHLHSA-N	440.928	1.244	50	20	IDGD	
COc1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](C)Br)C3)nn1C	1780246068	WPDPKMNYVUCKRB-RVZJWNSFSA-N	443.342	1.340	50	20	IDGD	
CC[S@](=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Br)C1	1780774729	JUHOIMFMAHOLCA-KKJFCJBYSA-N	441.363	1.350	50	20	IDGD	
C[C@@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Br)C1)n1cncn1	1780776879	HMOISIVHRIDZFJ-RSUWNVLCSA-N	432.294	1.044	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cnc4c(c3)NC(=O)CS4)CCO2)C1	1781219989	UHCBXOAHMWQCBJ-DJJJIMSYSA-N	438.937	1.587	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc4c(n3)OCCO4)CCO2)C1	1781226889	CFQDLLUUSINGEA-RBUKOAKNSA-N	444.315	1.533	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)c3c(O)cc(O)cc3O)CCO2)C1	1781235456	ZNSSIVXUPRKDRL-ROUUACIJSA-N	433.288	1.483	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](C)Br)C2)nn1C	1781996424	IVDVFDGXWRIXAZ-DDUZABMNSA-N	427.343	1.639	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](C)Br)C2)nn1	1781997960	PHBVPXDHBDSCOJ-WPKBUWHJSA-N	441.326	1.396	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C=C/c1cnccn1)C2	1782002315	PQDQSBXTRMXQPU-SOCMVBSASA-N	437.338	1.787	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(Cl)nn3)CCO2)C1	1783349657	QOLOJDFTQRODAQ-BZNIZROVSA-N	431.718	1.747	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](C)Cn1ccnc1)CCO2	1783354915	YPGFMTBKMXWPOB-RVKKMQEKSA-N	427.343	1.523	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)CCc3cccc([N+](=O)[O-])c3)CCO2)C1	1783871226	OEKFWGCCHGRQQA-XLIONFOSSA-N	439.896	1.611	50	20	IDGD	
N#Cc1ccccc1OCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1785379822	VFAGXZWWQZCIED-AEFFLSMTSA-N	440.269	1.457	50	20	IDGD	
C[C@H](NC(=O)c1ccccc1)C(=O)N1CC[C@@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1785553276	RHZWMSYSLFRBEE-KSFYIVLOSA-N	435.952	1.900	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)c1ccc2nccn2c1	1788058796	QISRDRDMGPCKRX-RZLSGREXSA-N	439.285	1.618	50	20	IDGD	
CC[S@@](=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)CBr)C[C@@H]21	1788485294	UGTSBUVPHOIQFI-YCTKJRKISA-N	437.400	1.156	50	20	IDGD	
C[Si](C)(C)OCC(=O)Nc1ccc(C2(NC(=O)CN(CCO)CCO)CCC2)cc1	1789649469	GRPXRZKZGOGWMG-UHFFFAOYSA-N	437.613	1.259	50	20	IDGD	
Cc1cccc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]3C2)n1	1789921223	CCSDYAZVXXSVRM-NZUILWFCSA-N	428.302	1.603	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc4n(n3)CCCN(C)C4)[C@H]2C1	1790523589	BSUWLZIFKKKWFD-XPYUAMARSA-N	437.972	1.329	50	20	IDGD	
CC(=O)N[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)CBr)C(C)(C)C	1792868516	CBRDWJSBKPWWHI-JZYAIQKZSA-N	446.386	1.158	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=N/N1CCCCC1)C2	1792871247	SFCHTQOQYRZUBT-IIQSSOLDSA-N	429.359	1.079	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c[nH]c3c(Cl)cccc13)C2)[C@H](O)CCl	1792983151	BALACBVUDQNNLL-OXUXUCFPSA-N	426.300	1.624	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2)[C@H]1CC(=O)N(Cc2cccs2)C1	1793974542	SUVKGAZDFVDFDF-LVSLPLRBSA-N	443.928	1.221	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2c(s1)CCC2	1795337685	PJPLVGGYMBCWKW-QDMKHBRRSA-N	439.541	1.801	50	20	IDGD	
Nc1c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)C(Cl)Cl)C3)sc2nccnc12	1795706242	KYDKTWMKUZWPTC-DIYOJNKTSA-N	430.317	1.280	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2nccn2c1	1797080930	UYHXSNWURZVVBI-JYYAWHABSA-N	435.322	1.711	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2[nH]ccc2n1	1797399205	ZAVSLPOAXKSTRP-IPJQOSJUSA-N	435.322	1.940	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1cc(F)cnc1Cl	1798045504	WLLWSHYSNXYEQB-VVJJBPBLSA-N	438.656	1.768	50	20	IDGD	
C[C@@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnccc1C(=O)NN)c1ccc(O)cc1	1798442009	RIQICTWTXKFBCH-MXASKKJJSA-N	437.500	1.446	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cc1cc(F)ccc1F)C2	1798443533	GIEQOOSNECNWOZ-MUJYYYPQSA-N	443.454	1.458	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COCc1ccccc1)C2)[C@@H](F)Br	1799346401	QBEVFTPPKWRKFT-YALNPMBYSA-N	429.286	1.483	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)[S@@](=O)c1ccccc1)C2	1800979514	NUEDGSAGGBZMDM-BVQLZSKCSA-N	442.965	1.026	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCNC(=O)c1ccccc1	1801951691	QOJUCKQPZJDGLF-RMFSNUHRSA-N	447.608	1.248	50	20	IDGD	
COC[C@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)COc1ccc(C(=O)OC)cc1)C2	1802282492	ILXQHNXLYQKMJG-DFGXFYAUSA-N	438.908	1.744	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C[C@@H]1CNc3ccccc3O1)C2	1802337935	XLSGRJVCIXBPNP-XMTFNYHQSA-N	443.548	1.261	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cc3cccn3cn2)[C@H]1c1cccnc1)[C@@H](O)CCl	1803142782	JDBBZGJCEZBZGE-SNRMKQJTSA-N	427.892	1.649	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)Cc2cc(C)n(C)n2)[C@H]1c1cccnc1	1803293103	UCSGSVZEIWCEGO-IMFGXOCKSA-N	433.940	1.626	50	20	IDGD	
Cc1cc(F)c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)cc1F	1803658110	BWAPDVYIIXAGTF-BJWYYQGGSA-N	428.244	1.519	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@@H]1c1cccnc1)c1cc(O)ncn1	1803739974	BEVGPSSBCGXSFB-GLQYFDAESA-N	438.257	1.587	50	20	IDGD	
O=C(Cc1cccnc1Cl)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1	1804357966	ACJPVRMKNUEFCG-BQFCYCMXSA-N	437.327	1.978	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC2(CCCN(C(=O)C(F)(F)C(F)F)C2)CC1	1806498397	ZPCSKVGVNZXSQN-UHFFFAOYSA-N	430.207	1.112	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2cnn3ncccc23)[C@@H]1c1cccnc1	1808175826	PTJAQNDGOFKCIS-IEZWGBDMSA-N	442.907	1.698	50	20	IDGD	
Cn1ccc(C(=O)N2CC[C@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)c1	1810299957	VSNYHDVRNCESBV-OXQOHEQNSA-N	447.499	1.052	50	20	IDGD	
O=C(c1cc(O)nc(O)n1)N1CCCC2(CCN(C(=O)[C@@H](F)Br)CC2)C1	1810888633	GUOMCVFYCFKTRC-GFCCVEGCSA-N	431.262	1.423	50	20	IDGD	
Cc1nnc(CC(=O)N2CC[C@H](CNC(=O)[C@@H](C)Br)[C@H]2c2cccnc2)o1	1812863279	GJKVMQVMQSVFQI-JDSLSITLSA-N	436.310	1.805	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)Cc2cnccn2)[C@H]1c1cccnc1	1812864969	YWQRYWSUFXJSIX-YEWWUXTCSA-N	432.322	1.904	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)n2cncn2)[C@@H]1c1cccnc1	1812866946	BDIWMGCINGOHKZ-LQKXBSAESA-N	435.326	1.724	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)CNC(=O)c2ccco2)[C@@H]1c1cccnc1	1813031347	QOENBOKVIAQOLW-JTDSTZFVSA-N	448.907	1.364	50	20	IDGD	
COC1(CC(=O)N2CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)CCC1	1813072623	BZYIJKXNCCWBCZ-PGRDOPGGSA-N	445.564	1.420	50	20	IDGD	
CC(=O)Nc1cc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)[C@@H](O)CCl)n[nH]2)ccn1	1814871038	IEUJIIYIJYNVDK-GJZGRUSLSA-N	434.884	1.669	50	20	IDGD	
Cc1nc(C(=O)N[C@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)cs1	1815339368	BFZYYGSCRSUNDR-ZDUSSCGKSA-N	442.331	1.127	50	20	IDGD	
O=C(CCc1ccccn1)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1816008256	ZWWOITBZJZSELZ-FQEVSTJZSA-N	447.304	1.423	50	20	IDGD	
CC(C)O[C@@H](C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1	1817472329	QNKGAWYPPCQQNP-KSSFIOAISA-N	428.298	1.209	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H]2CCC=CO2)[nH]n1	1819403445	MFUVVIOSCQTZRA-IAGOWNOFSA-N	439.476	1.407	50	20	IDGD	
CCNC(=S)NCC(=O)N1CCCC[C@H]1c1cc(NC(=O)CO[Si](C)(C)C)n[nH]1	1819596967	WINWDLCLTZKAHB-AWEZNQCLSA-N	440.646	1.737	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(C#N)cc3)sc2C1	1822171420	LUDZRUOLSXPWLZ-HNNXBMFYSA-N	440.529	1.614	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)Cn2cc([N+](=O)[O-])cn2)[nH]n1	1822367380	MVIXYFFXFYBSTP-OCCSQVGLSA-N	439.860	1.461	50	20	IDGD	
C=C(CC(=O)OCC)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](Cl)COC)CC2	1822930336	LBUFKXXOZXEVCT-VXGBXAGGSA-N	429.926	1.818	50	20	IDGD	
O=C(CN1CCOC1=O)N[C@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1	1822999634	VRSFCMFSBZYMOD-CPCISQLKSA-N	435.275	1.198	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CNC(=O)OC)CC2	1825453127	PEFPVMWZUAXYEM-IUCAKERBSA-N	433.328	1.585	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccnnc2)CC1	1825837845	GNKFRUDDPAYCGF-IBGZPJMESA-N	437.504	1.022	50	20	IDGD	
O=C(N[C@@H]1CCc2nc(NC(=O)C(Cl)Cl)sc2C1)c1cccn2c(O)nnc12	1826099361	XZBNDRGBABPWCW-SSDOTTSWSA-N	441.300	1.921	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1C1CCN(C(=O)C(=O)C2CC2)CC1	1827677035	BTGNYDGHGGMZBW-QVWJKXSPSA-N	441.532	1.719	50	20	IDGD	
Cc1ocnc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1	1828924432	SOVHRAUQWDMEED-SFHVURJKSA-N	440.504	1.529	50	20	IDGD	
Cc1cnoc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1	1828924549	YQVSJYRADGGNHW-GOSISDBHSA-N	440.504	1.529	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cocn2)CC1	1828925950	UVSJMNPVDFNJFH-GOSISDBHSA-N	426.477	1.220	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)CN2CCOCC2)CC1	1829101890	ACVOPSUQYVWEOH-LJQANCHMSA-N	425.646	1.790	50	20	IDGD	
CN[C@H](CC(=O)N1CCC([C@@H]2CCCCN2C(=O)CO[Si](C)(C)C)CC1)C(=O)O	1829102476	RPNRZBHFQDOZDC-SJORKVTESA-N	427.618	1.520	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)ccn1	1829251014	YHBYJXKRAWCOLH-FQEVSTJZSA-N	429.565	1.996	50	20	IDGD	
O=C([C@H](F)Br)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CCC(F)(F)C1)CCO2	1829654817	AIPSCNBUSDCWID-TYNCELHUSA-N	443.260	1.569	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3c(C)c[nH]c3C)CCO2)C1	1830903687	KKAGKNIGBRIQKM-NQIIRXRSSA-N	441.956	1.274	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)C3=CCCS3)CCO2)C1	1831559403	YGRDLVLVEJRZTN-DYVFJYSZSA-N	433.368	1.637	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@H]1C1CCN(C(=O)C2=NN(C)C(=O)CC2)CC1	1831648451	GOQDCAULEHMUSW-BBRMVZONSA-N	441.370	1.998	50	20	IDGD	
C[C@@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1)n1cccn1	1832235866	JOOIYUUVWIDBKM-LAUBAEHRSA-N	438.337	1.057	50	20	IDGD	
COc1ccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)c(Cl)c1	1832537307	AGUFAHJNIOSIEZ-HKUYNNGSSA-N	449.306	1.882	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3ccc(C)cn3)CCO2)C1	1832995362	IUFUIYABSLGUNS-RXVVDRJESA-N	439.940	1.033	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@H]3CCC(=O)NC3)CC2)CC1	1833117850	BTDVCCCDKNGDOG-YJBOKZPZSA-N	426.989	1.492	50	20	IDGD	
C[C@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)c3ncon3)CC2)CC1	1833263060	HUPWDSMWJMNNRO-GFCCVEGCSA-N	428.331	1.286	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3n[nH]c(C)c3F)CC2)CC1	1834020626	WXDCMDABFHRGED-OAHLLOKOSA-N	429.924	1.296	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1	1835123555	ACXSUFKMQQDYHO-WBMJQRKESA-N	449.365	1.115	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3sc(N)nc3C)CCO2)C1	1835801583	WNMLJASJGRHWPX-FZKQIMNGSA-N	430.958	1.511	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccc(F)cn3)CCO2)C1	1836028192	UXDDUIUBUBSQFU-HXUWFJFHSA-N	427.904	1.485	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCC(OC2CCN(C(=O)c3cc(O)nc(O)n3)CC2)CC1	1836623513	MIZAOBHSFPJQBR-UHFFFAOYSA-N	440.928	1.765	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836719174	OXDFYYUQBGLFIF-RISCZKNCSA-N	425.751	1.368	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C1(C(F)(F)F)CC1)CCO2	1836723482	OHKPETUSKLTMAN-DOMZBBRYSA-N	428.835	1.039	50	20	IDGD	
Cc1cccc(/C=C/C(=O)N2CCOC[C@@]3(C2)CN(C(=O)CO[Si](C)(C)C)CCO3)n1	1837709335	YIXBEIOYLHVHIW-HYGBKTPJSA-N	447.608	1.711	50	20	IDGD	
Cc1nc(C)c(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](C)CBr)C3)C2)o1	1837999536	GHDIHHCBVWJQIP-XIKOKIGWSA-N	444.326	1.392	50	20	IDGD	
CC[S@@](=O)CCC(=O)N1CCC(OC2CCN(C(=O)[C@H](Cl)COC)CC2)CC1	1838363058	SVSMDZPTOQKOAS-JYRCXFKTSA-N	437.002	1.398	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(OC)cc3O)C2)C1	1839145687	CKQSCMUORPRJMB-OXJNMPFZSA-N	426.897	1.488	50	20	IDGD	
N#Cc1cccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)c1	1839201601	BVMJQYNWMQLNLE-YJBOKZPZSA-N	440.269	1.319	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)ON=C(C)C)CCO2	1839228279	YCEADPKGTZSCBB-RVKKMQEKSA-N	448.358	1.417	50	20	IDGD	
Cc1ccc(F)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)c1	1839312929	AGKJENNWKDGSTR-QAPCUYQASA-N	447.276	1.895	50	20	IDGD	
C[C@@H](Cc1ccncc1)C(=O)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1839661482	ZBQOPKHCNDMWPL-IFXJQAMLSA-N	430.332	1.520	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3C[C@H]3F)C2)C1	1839743850	AFMHVGHURQAUDR-APJXILSNSA-N	449.429	1.686	50	20	IDGD	
COc1cccc(/C=C/C(=O)N2CCO[C@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)c1	1839996267	AFTHGUTXVISSDT-RRFGBZISSA-N	443.327	1.969	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)cnc1C	1840031474	RJWXLYPMZGNQEA-IFXJQAMLSA-N	440.338	1.552	50	20	IDGD	
CC(C)c1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)n[nH]1	1840034460	MFFCJILDHMIHGI-FZKQIMNGSA-N	443.342	1.387	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(F)ccc3OC)C2)C1	1840156948	YPRRNOGBWTYRIS-OXQOHEQNSA-N	444.887	1.158	50	20	IDGD	
Cc1cnn([C@H](C)C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)c1	1840406302	SQLQHAXKZHCTEH-AYOQOUSVSA-N	447.363	1.445	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC2(CCCN2C(=O)[C@H]2CCC(=O)NC2)C1	1841114818	NQPNZUIIAWQMEC-MDNIKOHYSA-N	428.439	1.601	50	20	IDGD	
C[C@H](NC(=O)c1ccccn1)C(=O)N1CC2(CCCN2C(=O)[C@@H](C)CBr)C1	1841289400	YSNDDOYZIXTINL-KBPBESRZSA-N	437.338	1.434	50	20	IDGD	
CCOC(=O)c1c(CCC(=O)N2CCCC23CN(C(=O)[C@H](Cl)COC)C3)c[nH]c1C	1841456094	LFTFGLIKURXMKH-MRXNPFEDSA-N	439.940	1.890	50	20	IDGD	
Cc1nc(CC(=O)N2CCCC23CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C3)no1	1842028027	HPFXSZZYCLMQNK-ZDUSSCGKSA-N	441.916	1.256	50	20	IDGD	
O=C(c1ccc(-c2ccccc2)nc1)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843014166	FZLJXVWAOCXBIS-UHFFFAOYSA-N	441.296	1.559	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)c2cc(S(C)(=O)=O)ccc2F)C1	1845567652	ZTGSPRYMUTWYHP-AWEZNQCLSA-N	432.901	1.300	50	20	IDGD	
CC(=O)Nc1cc(C(=O)N2CC3(CCCN3C(=O)CCC(=O)NN(C)C)C2)ccc1C	1846385733	PEJIWMOAXUMOLY-UHFFFAOYSA-N	429.521	1.143	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CN2C(=O)CCOc3ccccc32)cc(OC)c1OC	21189785	ASJCOPRKYMPOIE-UHFFFAOYSA-N	429.429	1.289	50	20	IDGD	
O=C(CCc1nc(-c2ccc(Cl)cc2)no1)NNC(=O)c1ccc(-n2cnnn2)cc1	23787630	DKUDTEMOZQVDIG-UHFFFAOYSA-N	438.835	1.760	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2nnn(-c3cccc([N+](=O)[O-])c3)c2C)cc1OC	24357127	NAJLBZNVCNAEIJ-UHFFFAOYSA-N	426.389	1.576	50	20	IDGD	
Cc1ccc(S(=O)(=O)NC2CC2)cc1C(=O)NNC(=O)c1ccc2c(c1)OCCO2	105453947	AYWCQRMZWYMQLJ-UHFFFAOYSA-N	431.470	1.282	50	20	IDGD	
Cc1noc(-c2ccc(C(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)cc2)n1	105640240	DBIRDPXTUGNYDQ-UHFFFAOYSA-N	429.458	1.370	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(\C#N)C(=O)N2CCN(CC(=O)NC3CC3)CC2)c1C	214456142	AMHUTLUZBJKTHO-RONKMWSCSA-N	427.549	1.642	50	20	IDGD	
CC[C@@H](C)C(=O)N1Cc2ccccc2C[C@H]1C(=O)NNC(=O)CNC(=O)c1ccco1	725742043	ZBKNWYIWDJVQAA-PBHICJAKSA-N	426.473	1.156	50	20	IDGD	
COc1cc(CNC(=O)NNC(=O)CNC(=O)c2cccs2)ccc1OC(F)F	725874251	XIGWSLQFXOFTEM-UHFFFAOYSA-N	428.417	1.619	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)[C@H](C)NC(=O)c2n[nH]c3ccccc23)cc1OC	726382292	ONAWCYAYLFJKRH-ZDUSSCGKSA-N	439.472	1.940	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N2CCCO[C@H](C)C2)cc1	727400026	SNACCCKXZXDBRE-UWCCDQBKSA-N	437.500	1.978	50	20	IDGD	
CN(C)N(C(=O)CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])[C@@H]1CCS(=O)(=O)C1	728178416	XCZWLJJFPPOFEF-GFCCVEGCSA-N	438.428	1.908	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)NC2CCCC2)c(Br)cc1F	728506537	AEFCEALRFKAISB-UHFFFAOYSA-N	438.275	1.810	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	728714963	FLUIJRCWPMDWEK-KRWDZBQOSA-N	429.546	1.373	50	20	IDGD	
O=C(NCCNC(=O)c1ccc(Cl)cc1)NNC(=O)C1CCN(c2ncccn2)CC1	728944165	NXWLAPCGLVQKFP-UHFFFAOYSA-N	445.911	1.107	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)NCCCCN1CCN(c2ncccn2)CC1	729233820	WUSSUWZDLQQATH-UHFFFAOYSA-N	429.500	1.091	50	20	IDGD	
O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)NNC(=O)c1cnn[nH]1	729456619	WRYHRZMDLHLHFJ-UHFFFAOYSA-N	432.400	1.569	50	20	IDGD	
CN(C)c1ccc(NC(=S)NNC(=O)c2ccc(CCNS(C)(=O)=O)s2)cc1	729689240	FLPLVEOPHUKZRD-UHFFFAOYSA-N	441.604	1.537	50	20	IDGD	
O=C(NNC(=O)c1cccc2ncccc12)c1cccc(CN2CCS(=O)(=O)CC2)c1	730225908	ZBZKGKUPLDDYRP-UHFFFAOYSA-N	438.509	1.540	50	20	IDGD	
O=C(COC(=O)c1ccc(N2CCOCC2)c(F)c1)NNC(=O)c1cccc(Cl)c1	730373410	RVDJEARMDCSVKF-UHFFFAOYSA-N	435.839	1.934	50	20	IDGD	
C[C@@H]1CCCN(S(=O)(=O)c2ccc(C(=O)NNC(=O)COc3ccccc3O)cc2)C1	730782603	RMAQSQUWUILYNH-OAHLLOKOSA-N	447.513	1.653	50	20	IDGD	
CCCNC(=O)CCC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	731865871	VHGWVBFRMZVXLY-UHFFFAOYSA-N	438.531	1.616	50	20	IDGD	
CC(=O)N[C@H](CC(=O)NNC(=O)CCN1C[C@H](C)O[C@@H](C)C1)c1c(F)cccc1F	732263727	OATRVAWGKHZXGI-GDZNZVCISA-N	426.464	1.179	50	20	IDGD	
C[C@H]1Cc2ccccc2N1Cc1occc1C(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1	732755164	PIJQPQOXGCGZPU-ZFWWWQNUSA-N	432.502	1.362	50	20	IDGD	
O=C(O)c1cc2c(c(S(=O)(=O)NNC(=O)c3cnn(-c4ccccc4)c3)c1)CCC2	733123023	NHWVCZLSUIIHTA-UHFFFAOYSA-N	426.454	1.683	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)CNC(=O)Cc2cccc(F)c2)cc1C	736789486	FVTUBLNJQFEHHX-UHFFFAOYSA-N	435.477	1.421	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)C(=O)C2)n1	738341567	SLIBZZBCBOUJBB-UHFFFAOYSA-N	435.937	1.139	50	20	IDGD	
C[C@H]1C[C@@H](C)C[C@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)C1	740490208	OHLAAXRMCMNTDG-QLPKVWCKSA-N	438.550	1.476	50	20	IDGD	
Cc1ccc(F)c(NC(=S)NNC(=O)CN2CCN(C(=O)OC(C)(C)C)CC2=O)c1	741307025	ZPZCCCISIVFNPH-UHFFFAOYSA-N	439.513	1.531	50	20	IDGD	
C#CCOc1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)cc1	741659442	OIRSDGRZVNMDNJ-UHFFFAOYSA-N	441.509	1.948	50	20	IDGD	
COCc1ccc(C=NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)cc1	741759541	BMZLGSXIFYXTBV-UHFFFAOYSA-N	445.541	1.937	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)c1C	741818577	IZXCTLLLBWZRCC-RGVLZGJSSA-N	449.467	1.534	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Cn2ccc3ccccc32)cc(NS(C)(=O)=O)c1OC	742642638	JZJPRYXBGSXXFN-UHFFFAOYSA-N	446.485	1.491	50	20	IDGD	
COc1ccc(C(=O)O)cc1S(=O)(=O)NNC(=O)c1cccc(Br)c1	743264469	VFQPVXCCNIFCGU-UHFFFAOYSA-N	429.248	1.779	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@H]2C[C@]23CCc2ccccc23)cc1	743288319	AZELBVVAUNEZFO-KNQAVFIVSA-N	427.526	1.667	50	20	IDGD	
CCc1cc(NNC(=O)CCN2C(=O)[C@H]3[C@H](C2=O)[C@H]2CC[C@H]3O2)nc(-c2ccccn2)n1	743377033	WYHHZRPYOYHYMU-OHDICMOHSA-N	436.472	1.097	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)NCCS(=O)(=O)C(C)(C)C)cc1Cl	743609482	XARSFAZPALCCEW-UHFFFAOYSA-N	436.918	1.906	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)N2CCN(CC(=O)NNC(=O)c3cccc(C)c3)CC2)c1	744407735	QIUMNBDEPCMJLS-LJQANCHMSA-N	438.528	1.676	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)CCCNC(=O)c2ccc(F)cc2)c1	744853807	FTYSBLRGBBXXRB-UHFFFAOYSA-N	426.404	1.212	50	20	IDGD	
O=C(COC(=O)Cc1ccn(-c2ccc(F)cc2)n1)NNC(=O)c1cccc([N+](=O)[O-])c1	745420041	BEDYYAPVGXQPDS-UHFFFAOYSA-N	441.375	1.467	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)[C@H](C)Oc2ccc3ccccc3c2)cn1C	745976149	DWBTXHOVAJCPSL-ZDUSSCGKSA-N	431.470	1.742	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)NCC2(OC)CCOCC2)c2ccccc2c1=O	747449285	RJUFLHIAWLANAW-UHFFFAOYSA-N	445.520	1.726	50	20	IDGD	
Cc1c(Br)cccc1S(=O)(=O)NNC(=O)c1cc([N+](=O)[O-])ccc1O	747617030	LSUZXARKYZLVNI-UHFFFAOYSA-N	430.236	1.995	50	20	IDGD	
O=C(CN1CCOC[C@@H]1C[C@@H](O)c1ccccc1)NNC(=O)c1cccc([N+](=O)[O-])c1	747655517	CEVVKIBQYIOTKG-RBUKOAKNSA-N	428.445	1.180	50	20	IDGD	
CCc1c(C(=O)OCC(=O)NNC(=O)c2cc(Cl)ccc2OC)[nH]c(C)c1C(N)=O	748400034	ADRLQXKKADVAJT-UHFFFAOYSA-N	436.852	1.264	50	20	IDGD	
COc1ccc(/C=C\C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)cc1	748620094	PAFAJGHRISIEPQ-XGICHPGQSA-N	430.530	1.788	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)NNC(=O)c2nnc(-c3ccccc3)o2)cc1Cl	748641977	YBLJORLVQVACEC-UHFFFAOYSA-N	435.849	1.972	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CC2CCCC2)cc1S(=O)(=O)NCc1ccccn1	749945556	UKFMPVHGRMAWRD-UHFFFAOYSA-N	446.529	1.910	50	20	IDGD	
O=C(NN[C@@H](C(=O)NCc1ccccc1)c1ccccc1)c1ccc(-n2cnnn2)cc1	750268965	NKMIXAVTVCJYNX-OAQYLSRUSA-N	427.468	1.954	50	20	IDGD	
O=C(O)CCC(=O)c1ccc(S(=O)(=O)NNC(=O)Cn2ccc3ccccc32)cc1	751213162	QFEARFITSUPMGG-UHFFFAOYSA-N	429.454	1.699	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@H](C)c2ccc(F)cc2F)cc1	753054710	BJLONKFQUQFWMR-CYBMUJFWSA-N	440.472	1.985	50	20	IDGD	
C[C@@H](NCC(=O)NNC(=O)c1ccc(C#N)cc1)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	754314427	BNLXFPABZGVBRS-CRAIPNDOSA-N	429.521	1.944	50	20	IDGD	
Cn1c(C(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)ccc1[N+](=O)[O-]	754809154	AVEIIMZQHGGSGW-UHFFFAOYSA-N	446.427	1.710	50	20	IDGD	
C[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)C(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	755381304	FFFGEQXQHBBOMW-VXGBXAGGSA-N	426.901	1.653	50	20	IDGD	
C[C@@H]1CN(S(=O)(=O)c2ccc(NC(=O)NNC(=O)CC(F)(F)F)cc2)C[C@@H](C)O1	755422265	JOSXDEXZKYWEEG-GHMZBOCLSA-N	438.428	1.590	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)Nc1ccc(CN2C(=O)CCC2=O)cc1	755660725	CMXOHKIHHNOPGT-UHFFFAOYSA-N	448.439	1.693	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2cc(F)c(F)cc2F)cc1	756430987	LLEZKGKEDYOHFS-UHFFFAOYSA-N	430.408	1.886	50	20	IDGD	
C[C@@H](CS(=O)(=O)c1ccc(F)cc1)C(=O)OCC(=O)NNC(=O)c1cccc(C#N)c1	756715901	ZOKSUQXNOHNCAR-ZDUSSCGKSA-N	447.444	1.112	50	20	IDGD	
COc1cc(C(=O)N(C)C)ccc1NC(=O)NNC(=O)COc1ccccc1[N+](=O)[O-]	756869808	ZGDKXOJTPDJMJY-UHFFFAOYSA-N	431.405	1.537	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)c1cncc(I)c1	756899207	SQPNAVKGEALCKL-UHFFFAOYSA-N	425.182	1.532	50	20	IDGD	
COc1ccccc1NC(=S)NNC(=O)CN1C(=O)N[C@]2(C[C@@H](C)C[C@@H](C)C2)C1=O	757635840	ZSVNEVXHBZENKZ-NXCRSVRDSA-N	433.534	1.760	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2ccc(C)nc2N(C)C)cc1	757762326	SSXIPHCLLIHTLR-UHFFFAOYSA-N	434.522	1.238	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)c2ccc(Cl)cc2O)ccc1S(=O)(=O)N(C)C	757775907	MNPNHHGNKHIVJJ-UHFFFAOYSA-N	442.881	1.771	50	20	IDGD	
CC[C@@H](C)n1nc(NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1C	757910720	NSJUQBSUPAZTDY-CQSZACIVSA-N	436.538	1.944	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)[C@H](Sc1ccccc1F)c1ccccc1	758028175	ZHNKCKLBJJCFNP-MLGOLLRUSA-N	425.507	1.744	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1ccc(Oc2cccc(Cl)c2Cl)nn1	758047950	ZSOQHJFWYUQQOR-QMMMGPOBSA-N	448.288	1.274	50	20	IDGD	
CO[C@H]1Cc2ccc(NC(=O)NNC(=O)CN(C)S(=O)(=O)c3ccc(C)cc3)cc2C1	758054767	ILHMBDLICNNNAC-SFHVURJKSA-N	446.529	1.582	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)NC[C@@H](C)CC2(C)OCCO2)c2ccccc2c1=O	758852958	JRLOHBFMUUTXAG-AWEZNQCLSA-N	431.493	1.711	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)[C@H]1CCCN(CCI)C1	759350517	FEVNWQLXOJWQCA-LBPRGKRZSA-N	425.311	1.774	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)[C@](C)(O)CN1C(=O)C(C)(C)c2ccccc21	760064667	BLNFHGSKLJEKEI-QKFKETGDSA-N	443.475	1.816	50	20	IDGD	
CS(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1F	760357202	RGGWSRNJECRCEW-UHFFFAOYSA-N	438.462	1.038	50	20	IDGD	
C[C@H](CC(=O)NNC(=O)COCc1ccccc1)NS(=O)(=O)c1cccnc1Cl	760613437	CUOKROQTYGYALK-CYBMUJFWSA-N	440.909	1.156	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)C(=O)N1CCc2c(F)cccc21	763430196	NQTFVZSDXJELQY-UHFFFAOYSA-N	434.493	1.935	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)NCc1ccc(N2CCOCC2)c(F)c1	763480247	ZTZXIDNLBSRAEF-UHFFFAOYSA-N	434.493	1.991	50	20	IDGD	
CN1CCN(c2ncccc2CNC(=O)NNC(=O)CSc2ccccc2O)CC1	763483681	AKSHFJDOMMNOKF-UHFFFAOYSA-N	430.534	1.162	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)N3C[C@@H](C)O[C@H](C)C3)cc2)c(C)o1	763576199	IFHULZMQDPGIGV-ZIAGYGMSSA-N	442.472	1.546	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(-n3nnnc3C(C)C)c(C)c2)c(C)o1	763582439	HPJHMYHMDXHMTJ-UHFFFAOYSA-N	425.449	1.704	50	20	IDGD	
CCN(CC)CCNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2cc(C)oc2C)c1	763584257	XNOXXRGJAALELC-UHFFFAOYSA-N	443.504	1.368	50	20	IDGD	
CC(C)(C)n1cc(NC(=O)C(=O)NNC(=O)COc2cccc(C(F)(F)F)c2)cn1	763639247	JZDHRPGIPPCTFP-UHFFFAOYSA-N	427.383	1.822	50	20	IDGD	
COC(=O)N(C)Cc1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2OC)cc1	763663716	NATJSOLGAPQDFR-UHFFFAOYSA-N	444.444	1.058	50	20	IDGD	
CN(c1ccccc1NC(=O)C(=O)NNC(=O)C12CC3CC(CC(C3)C1)C2)S(C)(=O)=O	763727046	DRNXFVHWPLADDR-UHFFFAOYSA-N	448.545	1.385	50	20	IDGD	
O=C(CN1CCCc2ccccc21)NNC(=O)C(=O)Nc1ccccc1O[C@H]1CCOC1	763729410	YQNWEZQDQHDVHF-KRWDZBQOSA-N	438.484	1.393	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2ccc(Cl)c(C(=O)N(C)C)c2)c1	763772125	NIYMUYXBKJYQBQ-UHFFFAOYSA-N	448.863	1.459	50	20	IDGD	
CCOC(=O)c1cc(C)sc1NC(=O)C(=O)NNC(=O)c1nnc(O)c2ccccc12	763791699	XQTGPPIVDJSYPN-UHFFFAOYSA-N	443.441	1.282	50	20	IDGD	
CC(C)c1nc(C(=O)NNC(=O)CNC(=O)c2cccnc2)nn1-c1ccccc1F	763821643	VREQMVWVDUTVOP-UHFFFAOYSA-N	425.424	1.116	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccccc2N(C)C(C)=O)cc1	763872998	QSRGVEFTKZLSSH-CQSZACIVSA-N	440.456	1.425	50	20	IDGD	
CCOc1cc(Br)ccc1NC(=O)C(=O)NNC(=O)Cn1nc(C)cc1C	763880445	FDKRUBZGVCYYJV-UHFFFAOYSA-N	438.282	1.447	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2cccc(CSc3ccccn3)c2)n1	763884202	DALJZZILHVODHD-UHFFFAOYSA-N	438.513	1.973	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)on2)ccc1C(=O)N(C)C	764003882	PQPZKXUXXSYSNM-UHFFFAOYSA-N	435.440	1.752	50	20	IDGD	
CCNC(=O)c1ccc(C)c(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2OC)c1	764013172	VLRCMYOHEAPEFU-UHFFFAOYSA-N	432.864	1.806	50	20	IDGD	
COCCn1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Br)cc2Cl)n1	764059016	XWTPPKRSCCPWHZ-UHFFFAOYSA-N	444.673	1.345	50	20	IDGD	
Cn1nc(C2CCCCC2)cc1NC(=O)C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	764083752	ARLBTLBYXKHBOR-UHFFFAOYSA-N	447.517	1.271	50	20	IDGD	
CCn1cc(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3CN2Cc2ccccc2)cn1	764179305	QKVPDYQJLCJGFW-NRFANRHFSA-N	446.511	1.616	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)C(=O)Nc1cc(F)c(F)cc1I	764295678	OZCNXVMYKIBWNT-UHFFFAOYSA-N	449.155	1.001	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3ccc(O)c(Cl)c3)cn2)C[C@@H](C)O1	764349743	UPBRTXILBJYBTE-TXEJJXNPSA-N	447.879	1.454	50	20	IDGD	
CCCCN(C)S(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(C)o2)cc1	764368804	ZYFRIUFJIWAKOA-UHFFFAOYSA-N	436.490	1.408	50	20	IDGD	
Cc1nc(CCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)sc1C	764376537	UKZGCMWTEWIOSA-UHFFFAOYSA-N	425.536	1.197	50	20	IDGD	
COC(=O)Nc1cc(NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)ccc1F	764383254	ZGJLGRZYBDYUGW-UHFFFAOYSA-N	446.420	1.855	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccccc3C(=O)OC)n[nH]2)cc1	764384853	LGANNPMRWXJWRU-UHFFFAOYSA-N	435.440	1.825	50	20	IDGD	
COCCn1nc(C)c(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)c1C	764388568	SRPYBUGHSGWGDG-UHFFFAOYSA-N	443.439	1.075	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2F)cc1	764410462	HUCXLNIQUWBGKW-UHFFFAOYSA-N	442.856	1.640	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)C(C)(C)C)cc2)c1	764434956	ZQQLZYDMJFJFRR-UHFFFAOYSA-N	425.445	1.669	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=S)NCCc1ccccn1	764519603	RSULGVVWFQHQBN-UHFFFAOYSA-N	447.008	1.591	50	20	IDGD	
CCOc1ccc(-n2c(SCC(=O)NNC(=O)NC)nnc2-c2ccncc2)cc1	765069941	DVZFFWPNMOTZQT-UHFFFAOYSA-N	427.490	1.780	50	20	IDGD	
COc1ccccc1N1C[C@@H](C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)CC1=O	765316743	FDLIVOMPGSFLFG-AWEZNQCLSA-N	434.493	1.500	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)CCC(=O)Nc2ccc3nc(O)[nH]c3n2)c1C	765469609	UIHGRHXFYBWSPU-CYBMUJFWSA-N	440.460	1.614	50	20	IDGD	
Cc1sc2ncn(CC(=O)NNC(=O)c3cc(-c4cccs4)[nH]n3)c(=O)c2c1C	765569829	NRPWBJCXTHRHQC-UHFFFAOYSA-N	428.499	1.988	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)NCCCN1CCN(c2ccccc2)CC1	765678889	CEYPDPBKWGJMRH-UHFFFAOYSA-N	431.562	1.929	50	20	IDGD	
Cc1ccn(-c2ccc(C(=O)NNC(=O)CN3CCN(C(=O)c4ccccc4)CC3)cc2)n1	765736524	UFROTHCAJIUWHT-UHFFFAOYSA-N	446.511	1.400	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)c2ccc(N3C(=O)CCC3=O)c([N+](=O)[O-])c2)cc1	766478677	SFMDZCGVXGCZBF-UHFFFAOYSA-N	440.412	1.651	50	20	IDGD	
COc1cccc(OCCN2CCN(CC(=O)NNC(=O)c3ccc(F)cc3)CC2)c1	767049268	ZVWCRWZIZRTLGT-UHFFFAOYSA-N	430.480	1.292	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3cccc(OCC(N)=O)c3)n[nH]2)cc1OC	768278246	VXVVHWGJQNRSHF-UHFFFAOYSA-N	439.428	1.033	50	20	IDGD	
COc1cccc(OC)c1C(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	768291479	QVEIYBWKHCZQKU-UHFFFAOYSA-N	446.935	1.936	50	20	IDGD	
CCOc1cc(/C=C\C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)ccc1O	768631643	YDDRPYDHDODRGH-CLFYSBASSA-N	429.385	1.717	50	20	IDGD	
CSCCNC(=S)NNC(=O)c1ccc(S(=O)(=O)Nc2nccs2)cc1	770246413	KUBWFOJMEHPYLB-UHFFFAOYSA-N	431.590	1.416	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNS(=O)(=O)c1ccc2c(c1)CCCO2	771589134	IAVZYYBZOMCLBM-UHFFFAOYSA-N	438.531	1.236	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1ccc(I)c([N+](=O)[O-])c1	772084438	UWMRWWNYAHZURP-ZETCQYMHSA-N	435.174	1.302	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1	772885296	ZECBAMKQEKIBIP-UHFFFAOYSA-N	445.863	1.926	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)CCNS(=O)(=O)c1cccnc1	772973127	ZVFMTXSXMNNMNX-GFCCVEGCSA-N	426.882	1.018	50	20	IDGD	
O=C(NNc1cccc(Cl)c1)C(=O)Nc1cccc(S(=O)(=O)N2CCOCC2)c1	773729720	VIZMTWGCJAQXST-UHFFFAOYSA-N	438.893	1.443	50	20	IDGD	
CN(NC(=O)Cc1ccc2c(c1)NC(=O)C2)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776202912	YDPLIDALFSRGGE-UHFFFAOYSA-N	431.493	1.359	50	20	IDGD	
C=CCn1c(S)nc2cc(C(=O)NNC(=O)CNC(=O)OC(C)(C)C)ccc2c1=O	778438194	RCULKNVWUDYBKZ-UHFFFAOYSA-N	433.490	1.157	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1cccc2c1CCCN2C(=O)OC(C)(C)C	779378234	YSDPDAIEEDCWSS-LBPRGKRZSA-N	440.522	1.073	50	20	IDGD	
O=C(CN1CCN(CC(=O)Nc2ccc(F)cc2)CC1)NNC(=O)c1cccc(Cl)c1	780501366	KGEIRVUKSZFCRU-UHFFFAOYSA-N	447.898	1.496	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CN2CCNC(=O)[C@@H]2c2ccccc2C(F)(F)F)c1	782102907	XMFBPIAQYQYRCX-SFHVURJKSA-N	434.418	1.948	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)CCc2ccc(OC)cc2)c(OC)c1	782118758	ZZYMFYIHJOCHHW-UHFFFAOYSA-N	429.429	1.209	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2ccccc2S(=O)(=O)N2CCCCC2)nc1	782145791	PQZFWPNRKLCQMQ-UHFFFAOYSA-N	433.490	1.347	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2cc(C(=O)NCC(F)(F)F)ccc2C)nc1	782145792	XZCPRZXWDQITSZ-UHFFFAOYSA-N	425.367	1.773	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)c1cccc(NS(=O)(=O)C(F)(F)F)c1	782537900	OBTVCOCXUBVACH-UHFFFAOYSA-N	445.375	1.794	50	20	IDGD	
CNC(=O)[C@H]1CN(C(=O)C(=O)NNc2ccccc2Br)c2ccccc2O1	782982944	PONVOLVSRDNLER-OAHLLOKOSA-N	433.262	1.432	50	20	IDGD	
CC[C@@H](C)NS(=O)(=O)c1cccc(NC(=O)C(=O)NNc2ncnc3ccsc23)c1	783255293	QJOAJEPVVZFRCK-LLVKDONJSA-N	448.530	1.850	50	20	IDGD	
Cc1ccc(NNC(=O)C(=O)Nc2ccc(F)c(NC(=O)CCN3CCOCC3)c2)cc1	783342943	GYRWTHUKOOGUGS-UHFFFAOYSA-N	443.479	1.877	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2cc(F)c(N3CCCCC3)c(F)c2)CCS(=O)(=O)C1	783425705	CWTBWDNOPNAJRW-SFHVURJKSA-N	430.477	1.092	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2cccc(C[S@](=O)c3ccccc3)c2)CCS(=O)(=O)C1	783426047	FOQMANKMKALNSD-WRONEBCDSA-N	449.554	1.131	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CCC[C@H]2CN(CC(=O)NNC(=O)c3cccc(C#N)c3)C[C@H]21	784522500	HYRUEQZSPURZPQ-IPMKNSEASA-N	441.532	1.944	50	20	IDGD	
O=C(NNc1nccnc1Cl)C(=O)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1	784776608	OMTVRYJFFTZEBU-OAHLLOKOSA-N	440.895	1.855	50	20	IDGD	
COC(=O)CN1CCN(c2ccc(NC(=O)C(=O)NNc3ccc(F)cc3)cc2)CC1	784790233	RJSVCIYETQFQDO-UHFFFAOYSA-N	429.452	1.203	50	20	IDGD	
CCN(CC)CCNC(=O)c1cccc(NC(=O)C(=O)NNc2ncccc2Cl)c1	784817953	NFIOOWNVPNLMRA-UHFFFAOYSA-N	432.912	1.888	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)F)cc1)C(=O)Nc1ccc2c(c1)OCCO2	784833738	RXDFPNFZAJGGPS-UHFFFAOYSA-N	427.385	1.536	50	20	IDGD	
CC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)cc1Cl	785067807	OYBDQFYPGKJOJR-UHFFFAOYSA-N	428.836	1.275	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2cnn(-c3cnc4ccccc4n3)c2)n1	785226563	IWZLLDYCSBBISB-UHFFFAOYSA-N	446.475	1.534	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1ccnn1Cc1ccccc1	785329914	AIOIJJZJBLBDLZ-UHFFFAOYSA-N	443.485	1.425	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNc2c(OC)cccc2S(C)(=O)=O)ccc1C	785331262	QXHOIIDPEBWFDP-UHFFFAOYSA-N	435.458	1.276	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)CNS(=O)(=O)c1ccc(NC(C)C)c([N+](=O)[O-])c1	789516256	JFLRNYBZAXGVRA-UHFFFAOYSA-N	449.489	1.463	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cc([C@@H]3CCCO3)nn2C)cc1	789741674	YJHPCAATWFYVGZ-DYVFJYSZSA-N	445.476	1.224	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cnn3c2C[C@@H](CNC(C)=O)CC3)ccc1OC(C)C	792736212	FPXKIKRIJGPJOF-HNNXBMFYSA-N	443.504	1.452	50	20	IDGD	
CN(C)N(C(=O)c1cccc(NC(=O)c2ccc3nc[nH]c3c2)c1)[C@H]1CCS(=O)(=O)C1	792849980	MVYMNLAIGLMADQ-KRWDZBQOSA-N	441.513	1.921	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)c2nnn(C3CCN(C(=O)OC(C)(C)C)CC3)c2C)n1	794086154	FHMYEGRVCFFERJ-UHFFFAOYSA-N	443.508	1.937	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)c1cnnn1-c1c(Cl)cccc1Cl	795245184	XXKZXUQVPJSYAF-UHFFFAOYSA-N	429.264	1.860	50	20	IDGD	
CCNC(=O)OC[C@H]1CCCCN1CC(=O)NNC(=O)c1cc(Cl)ccc1OC	796171772	NFROHGRVPMZLKG-CQSZACIVSA-N	426.901	1.710	50	20	IDGD	
COC(=O)c1cc(F)c(Br)cc1NC(=O)C(=O)NNc1nccc(OC)n1	797020386	MDZYOLPUUZQMFF-UHFFFAOYSA-N	442.201	1.255	50	20	IDGD	
C[C@H](c1cccc(S(N)(=O)=O)c1)N(C)C(=O)NNC(=O)c1cccc(OC(F)F)c1	799916854	PXYSYQHEZOQEGI-LLVKDONJSA-N	442.444	1.983	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNS(=O)(=O)c2cccc3c2OCO3)CC1	800836870	ZYLSNBJXSVDHQR-UHFFFAOYSA-N	442.494	1.307	50	20	IDGD	
Nc1cc(F)c([N+](=O)[O-])cc1C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	801797891	ORDUBULIARGDOP-UHFFFAOYSA-N	430.440	1.289	50	20	IDGD	
O=C(CS(=O)(=O)Nc1ccc(N2CCCCC2)cc1)NNC(=O)N=c1cc[nH]cc1	802025715	DJJFCRFFVWDMDN-UHFFFAOYSA-N	432.506	1.088	50	20	IDGD	
Cc1nc(S(=O)(=O)NCC(=O)NNC(=O)Nc2ccc(Cl)cc2Cl)cn1C	802093554	GKPZUZQPWBWPQK-UHFFFAOYSA-N	435.293	1.167	50	20	IDGD	
COC(=O)c1c(F)cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)cc1F	802566144	BHJCXVMYPFCEDB-LBPRGKRZSA-N	449.410	1.922	50	20	IDGD	
COc1ccc(S(C)(=O)=O)cc1S(=O)(=O)NNC(=O)c1cc2c(s1)CCC2	802720771	LKPFCCWMXMJWTQ-UHFFFAOYSA-N	430.529	1.272	50	20	IDGD	
C[C@H]1C[C@@H](N2CCOCC2)CN1C(=O)CCC(=O)C(C#N)=C1N(C)c2ccccc2N1C	804440056	RDVXNGKIWLBXAI-ZWKOTPCHSA-N	437.544	1.979	50	20	IDGD	
COc1ccc2cc(NC(=O)C(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)ccc2c1	806974571	NKHKIEROGDQVFX-UHFFFAOYSA-N	445.435	1.495	50	20	IDGD	
O=C1COC[C@@H](C[C@H]2CN(C(=O)C(=O)NNc3ccccc3[N+](=O)[O-])c3ccccc32)N1	806984383	JYTATZRFNSCGPP-UONOGXRCSA-N	439.428	1.073	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)nn1-c1ccc(F)cc1F	808895757	SRXFBYOIZXRGPE-UHFFFAOYSA-N	439.386	1.901	50	20	IDGD	
Cc1noc(C)c1S(=O)(=O)NCC(=O)NNc1c(F)cc(F)cc1Br	810442474	UTZHJUQAIJXHLW-UHFFFAOYSA-N	439.238	1.754	50	20	IDGD	
O=C1CSc2cc(C(=O)NNc3ccccc3S(=O)(=O)N3CCOCC3)ccc2N1	810462890	ZZFVTIJBPRBNGG-UHFFFAOYSA-N	448.526	1.509	50	20	IDGD	
CC(C)(C)n1cnc(C(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)n1	812454522	NEJLZANMCAHTOQ-UHFFFAOYSA-N	445.487	1.810	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C[C@@H]2CN(C(=O)OC(C)(C)C)CCO2)cc1	812730956	HFDBUURZCMOXKX-OAHLLOKOSA-N	442.538	1.406	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCCn1c(C)nc2ccccc21	813495913	NOCYXISMZWDKIC-UHFFFAOYSA-N	443.533	1.590	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NN=C1CC(C(=O)O)(c2ccccc2)C1	814878553	CLWSYTFASPCHDE-UHFFFAOYSA-N	434.496	1.733	50	20	IDGD	
CNC(=O)c1cc(Oc2cccc(NC(=O)C(=O)NNc3nccc(OC)n3)c2)ccn1	815574082	DIQOVOYAOFDWIG-UHFFFAOYSA-N	437.416	1.114	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCc2nncn2C1)C(=O)Nc1ccc(F)cc1OC1CCCC1	815691202	IGTPQCIDEKNUIZ-GFCCVEGCSA-N	430.440	1.087	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCc2nncn2C1)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-]	816881649	LVUYHYQPULXDRP-OAHLLOKOSA-N	436.428	1.789	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)OCc2nc(C)no2)cc1	854247519	ULOPILFHPKACFY-DHDCSXOGSA-N	436.428	1.776	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)CSCC(=O)N1CCCCC1	856530542	JVNNWBOSXABMFF-UHFFFAOYSA-N	447.605	1.092	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)N2CCCN(S(C)(=O)=O)CC2)c(C)n1C[C@@H]1CCCO1	914847234	AIQYGVWAPHWULG-DTBYZMGXSA-N	434.562	1.685	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@H](Cc2ccc(F)cc2)n2nnnc2C)cc1OC	915685655	IMGUXYMOKKNXQD-INIZCTEOSA-N	428.424	1.383	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)CNS(=O)(=O)c2ccc(C#N)cc2)c1C	915787997	QLDBMGMZSJMNQI-OAHLLOKOSA-N	430.486	1.068	50	20	IDGD	
COc1ccc(C(C)=NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c(OC)c1	916258563	FPCCTNWALNDGQX-UHFFFAOYSA-N	447.513	1.879	50	20	IDGD	
CCn1cnc2c1c(=O)n(CC(=O)NN=Cc1ccsc1)c(=O)n2Cc1ccccc1	916330912	DLPAYDOZHKMNNW-UHFFFAOYSA-N	436.497	1.640	50	20	IDGD	
COc1ccc(CNC(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)cc1O	916642355	VRTOETHERXSZQV-UHFFFAOYSA-N	425.445	1.836	50	20	IDGD	
CC(=NNC(=O)c1sc(N)nc1C)c1ccc(S(=O)(=O)NCCCN(C)C)cc1	917546357	VKXPDXAYBLIODJ-UHFFFAOYSA-N	438.579	1.418	50	20	IDGD	
Cc1ccc(S(=O)(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1Cl	917725568	ORGOXNVRNCQXAL-UHFFFAOYSA-N	438.314	1.573	50	20	IDGD	
Cc1ccc2oc(C(=O)NNC(=O)c3cccc(S(=O)(=O)N4CCOCC4)c3)cc2c1	918279028	LKQNSMOTQLOUBJ-UHFFFAOYSA-N	443.481	1.837	50	20	IDGD	
O=C(NCCCN1CCN(c2ncccn2)CC1)NNC(=O)c1ccc2ccccc2c1	918780073	OFBVEVISEIPJSW-UHFFFAOYSA-N	433.516	1.786	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)Nc2cccnc2N2CCOCC2)CC1	1323830068	OCHQEPNBHDWQAD-UHFFFAOYSA-N	448.524	1.718	50	20	IDGD	
CN(CC(=O)NNc1nncc(N)c1Cl)c1cc(Br)ccc1[N+](=O)[O-]	1329101138	PKRMXDXGRKKPJM-UHFFFAOYSA-N	430.650	1.962	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Nc2cnn(Cc3cccnc3)c2)cc(OC)c1OC	1342406728	CWTKODFOIMPJTA-UHFFFAOYSA-N	426.433	1.819	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(Cl)Cl)C2)c1cnn2ncccc12	1777949142	ZLGBABWWFRQCPI-RDTXWAMCSA-N	426.304	1.661	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)CBr)C2	1779529066	XVJVUZKUXBJCCC-DEXNDLTESA-N	444.370	1.222	50	20	IDGD	
O=C(c1cc([N+](=O)[O-])cc2c1OCC2)N1CC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1780094540	NDVUJLFKOXLHRT-GOSISDBHSA-N	444.271	1.777	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Cl)C2)[C@@H]1CC[C@@H]2CCC(=O)N2C1	1780612181	VMXLOZASOSKPRO-VFXOAVOPSA-N	429.920	1.436	50	20	IDGD	
O=C(c1ccc2c(c1)OCCO2)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781330495	YEAGTCBCZMQVTJ-MAUKXSAKSA-N	443.269	1.592	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1cc(C)[nH]n1)C2	1781900975	GULSWMWRKCWMLW-GPMSIDNRSA-N	441.370	1.948	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc3nc[nH]c13)C2	1782173120	YCGYENHTCVGYIN-LUQKVYGDSA-N	434.924	1.944	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc3c1NC(=O)C3)C2	1782179756	SVBWULZXWCUANZ-GSHUGGBRSA-N	449.935	1.563	50	20	IDGD	
O=C(c1c[nH]c2c(Cl)cccc12)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1782451522	WYEJXPCZWOPUCA-BEFAXECRSA-N	426.300	1.865	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(F)nc3F)CCO2)C1	1783340474	YMLHPEWJINFETG-SJKOYZFVSA-N	432.265	1.977	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccc4nn[nH]c4c3)CCO2)C1	1783355485	UARISGOWKSYNIB-SCLBCKFNSA-N	436.310	1.575	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3n[nH]c4c3CC[C@@H]4C)CCO2)C1	1783534547	WDUGTSMKTJEQSH-OAVHHTNSSA-N	425.327	1.686	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccn4ccnc34)C[C@@H]21	1783966926	MTAVIMSKLIYNTP-OHFALNGGSA-N	449.349	1.959	50	20	IDGD	
Cc1cc(Cl)cc(C(=O)N2CC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)c1	1785042146	FSIPIRWILLHSNL-QFIPXVFZSA-N	442.708	1.086	50	20	IDGD	
CC(C)(C)n1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Br)C[C@@H]32)n1	1785700053	SXLUPCGXXKQOGS-NZBPQXDJSA-N	445.333	1.922	50	20	IDGD	
Cc1nc2ccc(F)cn2c1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]2C1	1787450535	ZAGKZHUYJFRSPB-PLNCSYRRSA-N	426.851	1.910	50	20	IDGD	
O=C(CCBr)Nc1ccc(C2(NC(=O)CN3C(=O)CNC3=O)CCC2)cc1	1787670020	BOWCKAKZEPPFAR-UHFFFAOYSA-N	437.294	1.457	50	20	IDGD	
C[C@@H](Cn1cccn1)C(=O)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1	1788144955	HTTCJPHXPZHAKX-KRWDZBQOSA-N	446.316	1.647	50	20	IDGD	
CCOC(=O)C(C)(C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]2C1	1788765919	DGTKPWTVOMDYFP-JYJNAYRXSA-N	428.602	1.407	50	20	IDGD	
CCc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](Br)CC)C[C@@H]32)n(C)n1	1788946255	QEXZCVQXEIBNDH-QEWYBTABSA-N	441.370	1.749	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC1(c2ccc(NC(=O)c3cnc4ncccn34)cc2)CCC1	1789046297	NIXOJZICIYWKDZ-UHFFFAOYSA-N	449.515	1.850	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(O)nc3)[C@H]2C1	1789300802	HJRKFFQOIJQRQQ-AJNGGQMLSA-N	426.311	1.554	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc(O)cn3)C[C@@H]21	1789872469	GFDQNQSNFNGGOT-BMYCAMMWSA-N	430.332	1.546	50	20	IDGD	
C[C@H](Nc1nccs1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]2C1	1789923003	PWBDJTQZQBSYTI-VLJOUNFMSA-N	449.346	1.614	50	20	IDGD	
Cc1ncc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]3C2)s1	1791065257	SMVMTHUWKJFSBP-WCUVEOEZSA-N	430.368	1.757	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN(C)C(=O)OC(C)(C)C)C[C@@H]21	1791251700	PWNRNAGDVZTGMZ-JONQDZQNSA-N	447.960	1.087	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3CCc4nc[nH]c4C3)[C@H]2C1	1791528466	OSHNUAJAHPLMJP-FPXQBCRKSA-N	434.613	1.346	50	20	IDGD	
CCC[C@@H](NC(C)=O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]21	1792184691	HQSYPQUORSPBMN-NAHJCDBISA-N	436.380	1.507	50	20	IDGD	
CN(C)C(=O)NCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C(C#N)=C/c1ccc(F)cc1F)C2	1792701648	WNONPEXJEBXPGZ-FZBFXSHXSA-N	445.470	1.781	50	20	IDGD	
COc1ccc([C@H]2C[C@H]2C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CCC(=O)NN(C)C)C3)cc1	1793523813	FBTRENSTNMZSNP-XOPFUANDSA-N	442.560	1.810	50	20	IDGD	
COc1ccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Br)C3)cc1C	1793654025	JLBUSEQBFRTDRO-LTCOOKNTSA-N	443.313	1.826	50	20	IDGD	
C[C@H](Nc1cccnc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2	1795606228	WBYKFCLYJJWVNS-ZZVJUGKHSA-N	429.290	1.162	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CNc2ccccc21	1795624072	BDTFTMXNJRDBRI-IJHJFAERSA-N	436.350	1.959	50	20	IDGD	
O=C(CC[C@H]1CNc2ccccc2C1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2	1795647821	VIMOESIBVKSVJE-ZBVIFMFPSA-N	435.952	1.240	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C[C@H](N)c1cccnc1	1795679825	RCHWUOGFHNSDJR-AMILPRIGSA-N	429.348	1.297	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)c1cccc(C(F)(F)F)c1	1796188533	RIQDETIPCDCGOY-REPLKXPHSA-N	446.234	1.951	50	20	IDGD	
CC(C)(C)OC(=O)NCCCCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Cl	1796365161	UVQWKTHLNTZGBF-OCVGTWLNSA-N	435.924	1.805	50	20	IDGD	
Cc1nc2cc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)c3cccc(B(O)O)c3)C4)ccc2s1	1797558534	IBWZONLVROXBRZ-REPLKXPHSA-N	449.341	1.850	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2)c1ncccc1Br	1798187744	GMMLMUNBGXTFTQ-DOFRTFSJSA-N	437.121	1.851	50	20	IDGD	
CC(=O)N[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@](C)(Cl)CCl)C(C)(C)C	1799273750	GHZCYMOTFLSDRD-WYGUVQOISA-N	436.380	1.363	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1c(O)cc(O)cc1O	1799655617	VZPAEUFDHBFEQL-DJQAVVSRSA-N	443.294	1.038	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1CC(O)C1)C2	1800332166	CNNRITYUAWGBPF-FMZHINHGSA-N	431.439	1.232	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccc([N+](=O)[O-])cc1F	1800402616	ITPQPOKYNUFUTE-HRJSJKBJSA-N	427.860	1.883	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccc([N+](=O)[O-])cc1F	1800402617	ITPQPOKYNUFUTE-ZFHGCVPZSA-N	427.860	1.883	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnoc1COC)C2	1800641216	SAEUYBARGQTAET-NDPMZMCLSA-N	430.299	1.198	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1n[nH]c3ccccc13)C2	1800642115	XMARKVRHPDUOSM-LMWOUKEDSA-N	435.322	1.940	50	20	IDGD	
COC[C@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cn1ccc3sccc3c1=O)C2	1802274691	WVFBDTOYLVFEJY-FQLMCAECSA-N	437.949	1.955	50	20	IDGD	
O=C1Cc2cc(C(=O)N3CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]3c3cccnc3)ccc2N1	1803143232	XMINEGIZZKLBSY-BPAFIMBUSA-N	442.903	1.496	50	20	IDGD	
C#CCO[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@H]1c1cccnc1	1803549647	CHYMHOLKYDJPHP-OEAJRASXSA-N	426.286	1.816	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC2(CCCN(C(=O)CNC(=O)c3cccnc3)C2)CC1	1806872450	GMLHDLIZMMLTPJ-QGZVFWFLSA-N	436.940	1.296	50	20	IDGD	
Cc1ncccc1C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1807365673	ZJTGDAAPAXPTIZ-KNQAVFIVSA-N	444.300	1.098	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)c1cnn2ncccc12	1808167149	NDJHDAYPLIUIIF-JCGIZDLHSA-N	428.880	1.044	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)c1cnc2ccccn12	1809213976	GKECPWOLQVKJFN-IEZWGBDMSA-N	427.892	1.649	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)[C@H](O)Cc1ccccc1	1812769413	XXIPGRPBBKJYBO-NMLBUPMWSA-N	431.920	1.291	50	20	IDGD	
CC(=O)N[C@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](O)CCl)n[nH]1)C(C)(C)C	1814863987	FCSKXMKWLFHJLG-IIAWOOMASA-N	427.933	1.552	50	20	IDGD	
Cc1cncc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)c1	1815354666	ADNSVOZVBJTVKZ-MRXNPFEDSA-N	436.302	1.066	50	20	IDGD	
CC1=CC[C@H](C(=O)N[C@@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)CC1	1815356859	UQOZROZIJCGSJR-WMLDXEAASA-N	439.346	1.795	50	20	IDGD	
O=C(/C=C/c1ccco1)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1815947855	JSYYJFFWLFAIMT-VYENPZKTSA-N	434.261	1.702	50	20	IDGD	
C=C(C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1)C(F)(F)F	1817474935	JMEXCNKXFZZTIU-HNNXBMFYSA-N	436.199	1.514	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@H](O)CCl)CC2)c1nnsc1C1CC1	1817702203	MZNWBTMVMJAKBP-PSASIEDQSA-N	427.939	1.698	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1	1818110676	NMBAHKREFIUBIC-VXWPIWARSA-N	449.899	1.136	50	20	IDGD	
Cc1ccc(=O)n(C(C)(C)C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@@H](F)Cl)CC3)n1	1820090136	XXMHZTDTUOKLMW-IINYFYTJSA-N	441.916	1.890	50	20	IDGD	
C[Si](C)(C)OCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCc1nc(N)n[nH]1)CC2	1820165678	LSWPQMMFAGNSGN-SNVBAGLBSA-N	437.602	1.240	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@H]1CCc2nc(NC(=O)c3c[nH]c(=O)cn3)sc2C1	1821471939	BOWHGEQIEDXEIH-ZKANADHPSA-N	430.317	1.689	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3c(O)cc(O)cc3O)sc2C1	1823529545	JEHPLMVARGIJKD-WCBMZHEXSA-N	441.893	1.740	50	20	IDGD	
Cc1ncsc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1	1825990795	WHHCVDRWCMNFBD-LJQANCHMSA-N	441.362	1.678	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(C(C)=O)[nH]n1)CC2	1825994658	WWKMXAPVLXCBTB-ZJUUUORDSA-N	425.898	1.548	50	20	IDGD	
O=C(c1cccc(O)n1)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827051255	QPFDGYCLOCSFKC-HXUWFJFHSA-N	437.305	1.014	50	20	IDGD	
Cc1ncncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827052550	NWOZCXIROAXFCE-NRFANRHFSA-N	436.321	1.012	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H](O)C(C)C)CC1	1827677455	UGWKOVNTRODCRH-MOYYENFUSA-N	445.564	1.757	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccncn2)CC1	1827745842	LFJREWSMUDMLGV-LJQANCHMSA-N	437.504	1.022	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnco2)CC1	1828923624	PRWVPPOUQRVZMF-KRWDZBQOSA-N	426.477	1.220	50	20	IDGD	
CC(C)(C)c1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)cn1	1829569305	AILOCDRCSZQTBG-UZLBHIALSA-N	427.904	1.984	50	20	IDGD	
O=C(c1cc2c(s1)CCCC2)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1830730785	DTRUVUGWWRBCFY-QRWLVFNGSA-N	442.965	1.297	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4cn[nH]c4cn3)C2)C1	1831649848	BZUJVZTVQBHTRP-YWZLYKJASA-N	435.912	1.435	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccnc(F)c3)CCO2)C1	1831894957	HNBILDFVVVQREY-SCLBCKFNSA-N	444.301	1.322	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3ccco3)CCO2)C1	1833052117	ISOOIEWBQFHDAX-KBXCAEBGSA-N	429.311	1.452	50	20	IDGD	
COC[C@H](C)C(=O)N1CCC(N2CCC(NC(=O)[C@H](C)CBr)CC2)CC1	1833265499	ZBYLDFRFRYJPOO-CABCVRRESA-N	432.403	1.872	50	20	IDGD	
CC(C)c1nc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)co1	1833346442	JYOIJCLUXKUIFP-CXAGYDPISA-N	448.289	1.559	50	20	IDGD	
Cc1ccc(CC(=O)N2CCOC[C@@]3(CN(C(=O)CCBr)CCO3)C2)cc1	1834822366	JLUMHHSJUSWYAI-HXUWFJFHSA-N	439.350	1.779	50	20	IDGD	
CCC1(C(=O)N2CCC(N3CCC(NC(=O)CO[Si](C)(C)C)CC3)CC2)COC1	1835837138	ABYJELGLAQQUDB-UHFFFAOYSA-N	425.646	1.836	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)n1cccc1C=O)CCO2	1835950873	XXOZOPBUQMTRDZ-MDKPJZGXSA-N	439.940	1.726	50	20	IDGD	
CC(C)=CCCC(=O)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1	1836379124	RZEGKHLOZBDYCH-UHFFFAOYSA-N	441.381	1.298	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)c3ccnn3C)CC2)CC1	1837487872	KNELIZYBSWTDPG-CYBMUJFWSA-N	427.343	1.816	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCCCn3cccc3)CCO2)C1	1837623074	CYDZWZHMRFAIGW-GHTZIAJQSA-N	441.956	1.369	50	20	IDGD	
CCOC(=O)/C=C/C(=O)N1CCC(OC2CCN(C(=O)[C@H](C)Br)CC2)CC1	1837639204	RTUYBAFUPLNNHL-NNTXTVRGSA-N	445.354	1.888	50	20	IDGD	
CC(C)n1nccc1C(=O)N1CCOC[C@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1837715571	XWULWSDPLSQCGV-FQEVSTJZSA-N	438.601	1.386	50	20	IDGD	
CCN(CC)C[C@H](C)C(=O)N1CCOC[C@@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1837716035	YJSMGXDEJVNNBG-GHTZIAJQSA-N	443.661	1.272	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)c3cnccc3F)CC2)CC1	1838007171	QUKXGKLJCMIRHF-UHFFFAOYSA-N	449.527	1.206	50	20	IDGD	
CN1C(=O)CC[C@H]1C(=O)N1CCC(OC2CCN(C(=O)[C@@](C)(Cl)CCl)CC2)CC1	1838638969	PTIWTGQHXNVKDS-JXFKEZNVSA-N	448.391	1.842	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)c(O)c1	1838887392	AOAQMOYXZGFNOV-OAQYLSRUSA-N	440.924	1.736	50	20	IDGD	
Cc1ccccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)Br)C2)C1	1838900413	DYARJEYVFALLLV-HNAYVOBHSA-N	425.323	1.848	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3ccc(F)nc3)C2)C1	1839142495	QHSAGNXFRZNWHJ-OXJNMPFZSA-N	427.904	1.627	50	20	IDGD	
Cc1nc(C)c(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)o1	1839153876	UOBUZYSEURYTEW-ROUUACIJSA-N	434.320	1.598	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)/C=C/c3cccc(O)c3)CCO2)C1	1839926511	XFCYBFWBZLDYPC-WMDOEDGGSA-N	438.908	1.116	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3cnc4[nH]ccc4c3)CCO2)C1	1840081505	RJZDTKMRZOGOLS-XMSQKQJNSA-N	448.951	1.969	50	20	IDGD	
CC(=O)C[C@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)CBr)C2)C1	1840126733	KFAFVZDAFUSTTG-PMUMKWKESA-N	433.343	1.089	50	20	IDGD	
O=C(COCc1ccccc1)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840187994	JCDZJNGDYNNDCA-LJQANCHMSA-N	431.316	1.463	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccc(O)cn3)CCO2)C1	1840494845	WLTIQYJBIIUJDO-FQEVSTJZSA-N	425.913	1.051	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCNC(=O)OC(C)(C)C)CCO2)C1	1840802578	UNRWAMYQQOJPEP-YWZLYKJASA-N	447.960	1.375	50	20	IDGD	
CCN1CCC(C(=O)N2CCO[C@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)CC1	1840928331	ARKBEEJOFDEQKJ-NRFANRHFSA-N	441.645	1.026	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)CCc2ccc(F)c(F)c2)C1	1841201046	VRZJGPAEAXMWNV-UHFFFAOYSA-N	428.244	1.094	50	20	IDGD	
C[C@@H]1C[C@@]1(C)C(=O)N1CCCC12CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2	1845087771	DZIPQTJQIIRHKR-VGOFRKELSA-N	427.549	1.582	50	20	IDGD	
Cc1ccc(CCC(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)c(C)n1	1846526515	AYVUBDMJSKGGRV-UHFFFAOYSA-N	436.516	1.147	50	20	IDGD	
COc1cccc(C(=O)N2CCCC23CN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C3)c1C	1846765614	NFRWDSAAPBZSQT-PCLIKHOPSA-N	437.500	1.955	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)C2=CN3CCS(=O)(=O)N=C3C=C2)cc1OC	12695271	SWIQHBCCJQUJHT-UHFFFAOYSA-N	448.501	1.133	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2ccc3c(c2)CCN3S(C)(=O)=O)ccc1OC(C)C	14939712	XJTJHXKSFLSXJI-UHFFFAOYSA-N	447.513	1.879	50	20	IDGD	
C#CCNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2ccc(OCC)c(OC)c2)cc1	26070952	NPUJPGQASRQQOE-UHFFFAOYSA-N	431.470	1.080	50	20	IDGD	
O=C(Cc1nn2c(C3CCCCC3)nnc2s1)NNC(=S)NCCc1ccccn1	726122728	YZUGSTDQADEDLB-UHFFFAOYSA-N	444.590	1.909	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)CS(=O)(=O)NC2CCC(C)CC2)cc1	726868999	LWKKSLPLPDKNCB-HWOWSKLDSA-N	441.550	1.498	50	20	IDGD	
C[C@@H]1CN(S(=O)(=O)c2ccc(C(=O)NNC(=S)NCC3CCC3)cc2)C[C@@H](C)O1	727867179	UGOOEEQPCMJEPD-ZIAGYGMSSA-N	440.591	1.394	50	20	IDGD	
O=C(CSCC(=O)N1CCCCC1)NNc1ccc(S(=O)(=O)NC2CC2)cc1	728210208	YJLFYUBQWUQBRN-UHFFFAOYSA-N	426.564	1.316	50	20	IDGD	
O=C(C[C@@H](c1ccccc1)N1CCOC1=O)NNC(=O)c1nn(-c2ccccc2)cc1O	728308140	YRRNNWAFGPDGSH-KRWDZBQOSA-N	435.440	1.923	50	20	IDGD	
COc1cc(C=NNC(=O)[C@@H](C)NS(C)(=O)=O)cc(OC)c1OCc1ccccc1	728434156	JAWBXBOESVKEGV-CQSZACIVSA-N	435.502	1.671	50	20	IDGD	
COCCCNC(=O)[C@@H](C)N1CCN(S(=O)(=O)c2ccc(CCCCl)cc2)CC1	728935810	FUEHGYYBAWPRTK-QGZVFWFLSA-N	446.013	1.706	50	20	IDGD	
O=C(NNC(=O)N1CCS(=O)(=O)CC1)[C@H]1Cc2ccccc2CN1Cc1ccccc1	729228135	ZHRBNCBBYAWUOA-HXUWFJFHSA-N	442.541	1.085	50	20	IDGD	
C[C@@H](CC(=O)NNC(=O)c1nnc(O)c2ccccc12)S(=O)(=O)c1ccc(F)cc1	729299809	ICTJZRURIDDPNS-NSHDSACASA-N	432.433	1.488	50	20	IDGD	
COCCNS(=O)(=O)c1cccc(C(=O)NNC(=O)c2cccc3ncccc23)c1	730225324	ZWMSDVPKOOYMSM-UHFFFAOYSA-N	428.470	1.234	50	20	IDGD	
CC(=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O)c1cc(F)c(Cl)cc1Cl	730569012	JDAFSQTYEHQIAV-UHFFFAOYSA-N	434.280	1.557	50	20	IDGD	
O=C(NCc1nnnn1-c1ccccc1)NNC(=O)c1cc(F)ccc1Br	730672271	DWOQFNIJTWJCBU-UHFFFAOYSA-N	434.229	1.708	50	20	IDGD	
Cc1ccc(N2C(=O)/C(=C/NNC(=O)[C@H]3CCS(=O)(=O)C3)c3ccccc3C2=O)cc1	730999604	ZYGKZMXAAZNOCD-UZUMKDMXSA-N	439.493	1.578	50	20	IDGD	
O=C(COC(=O)COc1ccccc1C(F)(F)F)NNC(=O)c1cccc([N+](=O)[O-])c1	732328263	SJJHUBIONZJOOM-UHFFFAOYSA-N	441.318	1.997	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NNc2ccc(Br)nc2)n(C)c1	732837453	GVHNJLMFQJCJMO-UHFFFAOYSA-N	430.328	1.970	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)N[C@@H]2CCCN(c3cc(N4CCOCC4)ncn3)C2)n1	732913992	JEIBJEFTMDJIJB-MRXNPFEDSA-N	427.513	1.015	50	20	IDGD	
Cc1ccc([C@]2(C)NC(=O)N(CC(=O)NNC(=O)NCc3ccc(Cl)cc3)C2=O)cc1	733004917	YGKKCXUIJYPVDT-NRFANRHFSA-N	443.891	1.946	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)c1ccc(S(C)(=O)=O)o1	733125770	KCCAAOZEUZALIL-SECBINFHSA-N	431.264	1.674	50	20	IDGD	
CCCCS(=O)(=O)N1CCC[C@H]1C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	734126852	GOXPBZDFTNOKDR-KRWDZBQOSA-N	444.579	1.165	50	20	IDGD	
COc1ccc(CN2CC[C@H](NC(=O)NNC(=O)COc3ccc(C)cc3)C2=O)cc1	734683155	FZROOVIOWWAPPB-IBGZPJMESA-N	426.473	1.514	50	20	IDGD	
CCC(=O)N1CCC[C@H](C(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)C1	734824630	GOHDXQVZLDTREQ-AWEZNQCLSA-N	425.530	1.365	50	20	IDGD	
O=C(COC(=O)c1cc2c(nc1O)CCCCC2)NNC(=O)c1ccc([N+](=O)[O-])cc1	738757571	DEKRTQMYGINTND-UHFFFAOYSA-N	428.401	1.582	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)Cc1csc(-c2ccc(OC)c(OC)c2)n1	740853120	LOEIOAUFRZOMAQ-UHFFFAOYSA-N	434.518	1.822	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)N[C@@H](C)[C@H]1CN(Cc2ccccc2)CCO1	741266684	LXEKYSRWYOLMMQ-QFBILLFUSA-N	436.516	1.876	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)C3CCN(C)CC3)c2)cc1	742239498	AMUCSBRZZAVBBS-UHFFFAOYSA-N	446.529	1.599	50	20	IDGD	
Cn1cc(C(=O)NNS(=O)(=O)c2ccc(Br)c(C(F)(F)F)c2)cn1	743261239	LIZVMQSKKQULHT-UHFFFAOYSA-N	427.202	1.825	50	20	IDGD	
CC(=NNC(=O)Cc1cc(O)nc(O)n1)c1ccc(OCC(=O)N2CCCCC2)cc1	743446374	UZPNDWBQPBPFMY-UHFFFAOYSA-N	427.461	1.362	50	20	IDGD	
C[C@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(C(=O)NNc3ncnc4[nH]cnc34)cc2)C1	743471558	OHYICQBIJVIXHM-BETUJISGSA-N	429.506	1.776	50	20	IDGD	
CN(CCc1ccccn1)C(=O)CNC(=O)NNC(=O)c1cccc(Br)c1	743583511	SPNITLQCLVYCPY-UHFFFAOYSA-N	434.294	1.489	50	20	IDGD	
CCO[C@H](C)c1noc(CN2CCN(C(=O)NNC(=O)c3cccc(C#N)c3)CC2)n1	743589270	HESLXSRETBSLOS-CQSZACIVSA-N	427.465	1.211	50	20	IDGD	
O=C(NNC(=O)N[C@@H]1CCN(CC(F)(F)F)C1=O)Nc1ccc(OC(F)F)cc1	743627204	WAQVKPVARZOAFG-SNVBAGLBSA-N	425.314	1.787	50	20	IDGD	
CNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cc(Br)ccc2O)cc1	743732426	VAWCPPJCXYXUFA-UHFFFAOYSA-N	428.264	1.138	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)[C@H]1CC(c2ccccc2)=NO1	744620897	QKXXVIKYTLSRHU-GOSISDBHSA-N	430.486	1.344	50	20	IDGD	
CC(=NNC(=O)c1cc(Cl)ccc1O)c1ccc(S(=O)(=O)NCCC(=O)O)cc1	744775638	DGMJUTNBWZGPLM-UHFFFAOYSA-N	439.877	1.953	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)N[C@@H]2C[C@@H](C)N(c3cnn(C)c3)C2=O)c1	745917978	MNINQRGASDAPKC-CRAIPNDOSA-N	442.520	1.755	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NN=C(Cc1ccccc1)[C@H](C)NC(=O)OC(C)(C)C	746576797	RAKGKLROUNRPIJ-KBPBESRZSA-N	426.539	1.552	50	20	IDGD	
COc1cc(C)nc(NNC(=O)CCc2nc(C3(NC(C)=O)CCCCCC3)no2)n1	746634290	AWTNFLLRTBGTID-UHFFFAOYSA-N	431.497	1.938	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)N[C@H](COC)Cc2ccccc2)nc1	746782478	MQBXGGXZCFYGGC-KRWDZBQOSA-N	435.550	1.996	50	20	IDGD	
COc1ccc2c(c1)OC[C@H](C(=O)OCC(=O)NNC(=O)c1ccc(OC)c(OC)c1)C2	747526725	NAZUDENUWBFWJN-OAHLLOKOSA-N	444.440	1.268	50	20	IDGD	
O=C(C[C@@H]1CCS(=O)(=O)C1)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1	747787308	NCYAJFIGUDBTOW-RXVVDRJESA-N	441.553	1.586	50	20	IDGD	
Cn1ccnc(NNC(=O)CC[C@H]2NC(=O)N(c3ccc(Cl)c(Cl)c3)C2=O)c1=O	747938028	NTNUBMBZKIUHQU-GFCCVEGCSA-N	439.259	1.435	50	20	IDGD	
O=C(NNc1ccc([N+](=O)[O-])cc1Cl)c1ccc2c(c1)S(=O)(=O)N=C1N=CNN12	748725370	CTEGUQIOUARLGE-UHFFFAOYSA-N	435.809	1.416	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cc3ccccc3o2)cc(NS(C)(=O)=O)c1OC	749471692	CGDVSXZFABKXMD-UHFFFAOYSA-N	433.442	1.896	50	20	IDGD	
COc1ccccc1N1CC[C@@H](CNC(=O)NNC(=O)[C@H]2COc3ccccc3O2)C1	749932229	RQDRBMOJISCJKY-MGPUTAFESA-N	426.473	1.692	50	20	IDGD	
COC[C@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1)C1CC1	750447463	SMTCWUXFVKMEKN-IBGZPJMESA-N	446.529	1.534	50	20	IDGD	
Cc1ccc(-n2cnnc2SCC(=O)NNC(=O)CNC(=O)c2cccs2)cc1C	751209652	UDHMZFBIKHUZJL-UHFFFAOYSA-N	444.542	1.615	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)NNC(=O)c2cc(OC)ccc2Br)c(C)o1	751376474	HUMLXXFGOQKFNS-UHFFFAOYSA-N	446.279	1.342	50	20	IDGD	
CCc1ccccc1-n1cc(O)c(C(=O)NNC(=O)c2nn(CC)c(=O)c3ccccc23)n1	752791548	AQYKUEMZUJNDNY-UHFFFAOYSA-N	446.467	1.945	50	20	IDGD	
N#Cc1ccc(NNC(=O)c2cccc(S(=O)(=O)N3CCNC(=O)C3)c2)cc1Cl	753316333	NSFZTTNMPLABIK-UHFFFAOYSA-N	433.877	1.089	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)CN2CCn3c(CCc4ccccc4)nnc3C2)cc1	754666163	YENIRHJNOQPBNP-UHFFFAOYSA-N	429.484	1.212	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)Nc3ccc(F)c(C(N)=O)c3)n[nH]2)cc1OC	755804201	SNJLTBWSGMJXAT-UHFFFAOYSA-N	442.407	1.798	50	20	IDGD	
CCc1c(NC(=O)C(=O)NNC(=O)c2ccc(OC)c(OC)c2)cnn1CCC(C)C	756162630	DLFBUMMQUZJSIW-UHFFFAOYSA-N	431.493	1.909	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)N[C@@H]1CCN(c2c(F)cccc2F)C1=O	756211150	KVJYFCLHCCEBGO-OAHLLOKOSA-N	428.399	1.291	50	20	IDGD	
CS(=O)(=O)CCOc1cccc(NC(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)c1	756297150	JPOKZWIDXQABRD-UHFFFAOYSA-N	443.485	1.967	50	20	IDGD	
O=C(Cc1ccc2ccccc2c1)NNC(=O)Nc1ccn(CC(=O)N2CCOCC2)n1	756660265	UOGZXKXWTNBESG-UHFFFAOYSA-N	436.472	1.291	50	20	IDGD	
O=C(NNC(=O)C(=O)N1CCCC1)N[C@@H]1CCN(c2ncc(C(F)(F)F)cc2Cl)C1	757760111	BSCFQOKZVWXNAM-LLVKDONJSA-N	448.833	1.285	50	20	IDGD	
COc1ccccc1[C@H](CNC(=O)NNC(=O)C(=O)Nc1ccccn1)N1CCCC1	758673006	YHNAAMIEADYIGS-INIZCTEOSA-N	426.477	1.196	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)C(=O)Nc1ccccn1)[C@H]1CCCN(C(=O)OC(C)(C)C)C1	758748502	NXBGSQMRRSXUCK-KGLIPLIRSA-N	434.497	1.386	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)CNS(=O)(=O)c3cccs3)n[nH]2)c1	763176027	VPXJKQWKAZRHAT-UHFFFAOYSA-N	433.515	1.495	50	20	IDGD	
COc1cc(C)c(S(=O)(=O)N2CCN(S(=O)(=O)CBr)CC2)cc1C	763206966	ZQOOAEYMSKBNQJ-UHFFFAOYSA-N	441.369	1.301	50	20	IDGD	
Cn1cccc(NC(=O)C(=O)NNC(=O)CCCOc2ccc(Cl)cc2Cl)c1=O	763504859	BMUPJCNOPVEGRH-UHFFFAOYSA-N	441.271	1.637	50	20	IDGD	
O=C(NNC(=O)c1ccccc1O)C(=O)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1	763531501	OHJFRZRBFIJLEO-QGZVFWFLSA-N	448.483	1.435	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(Oc3cccnc3)nc2)cc1OC	763550697	QBATYXJMJKIRPG-UHFFFAOYSA-N	437.412	1.686	50	20	IDGD	
CC(C)(C)NC(=O)c1ccccc1NC(=O)C(=O)NNC(=O)[C@@H]1COc2ccccc2O1	763572224	MDVLOENIBYMADK-KRWDZBQOSA-N	440.456	1.141	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2cc(F)c(F)cc2F)c2ccccc2c1=O	763785136	GLGYYMGZACTTTQ-UHFFFAOYSA-N	433.346	1.233	50	20	IDGD	
CCCN1C(=O)CCc2cc(NC(=O)C(=O)NNC(=O)COc3ccc(C)cc3)ccc21	763810857	CJKRRZKUPTZMCE-UHFFFAOYSA-N	438.484	1.849	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1nc(-c2nccn2C)cs1	763872145	KEXRYHGBMNQBCQ-SNVBAGLBSA-N	432.437	1.236	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2cc(C(=O)NC(C)C)ccc2Cl)n1	763892192	VYWWWKOSNHGJCK-UHFFFAOYSA-N	434.884	1.078	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(N3CCCC3=O)cc2)cc1OC	763904530	ZOZOLBBCEVJFIO-UHFFFAOYSA-N	440.456	1.620	50	20	IDGD	
O=C(CCCc1cccs1)NNC(=O)C(=O)Nc1ccc(CN2CCCC2=O)cc1	764340111	SRCNWXKMJPUTAC-UHFFFAOYSA-N	428.514	1.979	50	20	IDGD	
COC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)c1C	764386584	BCTAYNRCLUXAFF-UHFFFAOYSA-N	439.403	1.711	50	20	IDGD	
CCCNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)CSc2ccccc2OC)c1	764397094	FTRLQDXQYKGVEO-UHFFFAOYSA-N	444.513	1.713	50	20	IDGD	
Cc1nccn1-c1ccc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)cn1	764401118	KTVPKXDBYZLVSB-UHFFFAOYSA-N	426.458	1.160	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)C(=O)N1C[C@H]2CCCN2c2ccccc21	764401736	RIIDQDVKJDMEQX-CQSZACIVSA-N	426.498	1.647	50	20	IDGD	
N#C[C@@H](c1ccccc1)c1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2COCCO2)cc1Cl	764427441	ZSOIZPFLRJDDDS-WMZOPIPTSA-N	442.859	1.497	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)CCCc2ccccc2)cc1F	765645844	YLFTYXXYEXJCAB-UHFFFAOYSA-N	443.522	1.920	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3nnn(-c4ccccc4)c3C)CC2)cc1	765756435	WTRAKKNYJDQCCR-UHFFFAOYSA-N	447.543	1.463	50	20	IDGD	
C[C@H]1CCCCN1CC(=O)Nc1ccc(F)c(NC(=O)C(=O)NNc2cnccn2)c1	766260221	MDZJJWTUGSAWSE-ZDUSSCGKSA-N	429.456	1.510	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1ccccc1C(=O)N1C[C@H](C)C[C@@H](C)C1	766264469	LBVOBOZBRVPSEM-ZIAGYGMSSA-N	426.477	1.685	50	20	IDGD	
Cc1cc(=O)c(C(=O)NNc2ccccc2S(C)(=O)=O)nn1-c1ccccc1[N+](=O)[O-]	766669809	LTBQJQIQHLAEHN-UHFFFAOYSA-N	443.441	1.610	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(OC[C@H]2CCOC2)c(F)c1)c1ccc2c(c1)OCO2	767437042	DGMPMGVBYGURTB-LBPRGKRZSA-N	438.433	1.593	50	20	IDGD	
CCOc1ccc(-n2c(SCC(=O)NNC(=O)CN(C)C)nnc2-c2ccco2)cc1	767945211	AHIODUTVNNDMNO-UHFFFAOYSA-N	444.517	1.727	50	20	IDGD	
C[C@@H](NC(=O)c1n[nH]c2ccccc12)C(=O)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	768278192	ZJBOZCFOTDWJMN-LLVKDONJSA-N	435.419	1.672	50	20	IDGD	
C#Cc1cccc(NC(=S)NNC(=O)CN2C(=O)N[C@@]3(CCCC(C)(C)C3)C2=O)c1	768570293	BTDIWCMXPWLJQP-OAQYLSRUSA-N	427.530	1.876	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)CN2C(=O)N[C@@]3(CCCC(C)(C)C3)C2=O)c(C)c1	768928492	QFYBOJXMHZFNSU-JOCHJYFZSA-N	429.521	1.754	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)Cc3csc(-c4ccc5c(c4)OCO5)n3)nc21	770979756	IZTIBEXTDPJIJC-UHFFFAOYSA-N	425.430	1.607	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)c3cc(NS(C)(=O)=O)ccc3O)nc21	771008296	HAZHAZWQOZRFJD-UHFFFAOYSA-N	435.466	1.121	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)CN1C(=O)c2cc(Cl)c(Cl)cc2C1=O	771939966	MVOOUKPEAZNIRA-VIFPVBQESA-N	444.271	1.715	50	20	IDGD	
COc1cc(/C=C(/C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)c2ccccc2)ccc1O	772376424	UAEPAWGQFRIEGF-PCJMVEANSA-N	445.497	1.459	50	20	IDGD	
Cc1cc(S(=O)(=O)NCCNC(=O)NNC(=O)Cc2ccc(Cl)cc2)c(C)s1	772625815	PMOKXPMKKQBZMQ-UHFFFAOYSA-N	444.966	1.870	50	20	IDGD	
O=C(NNC(=O)c1ccc2cc(Br)ccc2c1)N[C@H]1CCS(=O)(=O)C1	773057849	BPVVZGSAEXMDDV-AWEZNQCLSA-N	426.292	1.733	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNS(=O)(=O)c1ccc2c(c1)oc(=O)n2C	773253094	XKMGCGYIRJULGL-JTQLQIEISA-N	425.850	1.562	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNc2nc(C)cc(C)n2)c(OCC(F)(F)F)c1	773484016	ZGHUDCNSVIDFSQ-UHFFFAOYSA-N	441.366	1.903	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)NCc1ccc(N2CCCS2(=O)=O)c(F)c1	773590310	SCYFFLMPEVSMQB-UHFFFAOYSA-N	438.456	1.578	50	20	IDGD	
C=CCN(C)S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2nccnc2C(C)C)cc1	773999114	AIOWRZHJHFQQPA-UHFFFAOYSA-N	432.506	1.488	50	20	IDGD	
C[C@H](CNC(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccc(Cl)cc1)S(N)(=O)=O	782037691	LDMPEFINDRZFLY-MLJKTZRHSA-N	446.920	1.817	50	20	IDGD	
CN1CCC/C1=N\S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccccc2F)cc1	782707418	NILGVDZAGZZIAS-JJIBRWJFSA-N	433.465	1.720	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)cc1Br	782886471	KXFFBVFRMWLNFP-UHFFFAOYSA-N	444.289	1.973	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C(=O)Nc2ccc3c(c2)OC2(CCCC2)O3)nc2ccccc21	782887104	OCZUZIQVQDQSSB-UHFFFAOYSA-N	449.467	1.943	50	20	IDGD	
COC(=O)CNC(=O)c1ccc(NC(=O)C(=O)NNc2ccccc2Br)cc1	782987985	AYLCAKSKISKJLP-UHFFFAOYSA-N	449.261	1.434	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccc(F)c(F)c2F)nc1	783265694	WPCHCASDGCDIBL-UHFFFAOYSA-N	431.396	1.267	50	20	IDGD	
CC1CCN(Cc2ccc(NC(=O)C(=O)NNC(=O)CNC(=O)c3ccco3)cc2)CC1	784004349	LLJNVLJBKHUCIN-UHFFFAOYSA-N	441.488	1.027	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNc2cc(C)ccc2F)cc1S(=O)(=O)N(C)C	784883927	JTZCOOHLFWMIQI-UHFFFAOYSA-N	438.481	1.865	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)[C@@H]2CCCN2C(=O)C(F)(F)F)cc1C	786574218	AMQFQUUMROEVNJ-JTQLQIEISA-N	435.424	1.476	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)CC(=O)NNC(=O)NCc2ccc(Cl)cc2)cc1F	787422295	DCRUOUZUIWYCMM-UHFFFAOYSA-N	441.868	1.986	50	20	IDGD	
CS(=O)(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3n2)ccc1Cl	788332336	ZUCVQLYNOZKGAO-UHFFFAOYSA-N	446.872	1.691	50	20	IDGD	
CC(=O)N1CCc2ccc(S(=O)(=O)NNC(=O)CCc3ccccc3O)cc2CC1	790053694	RNXDKJZFUWSLTI-UHFFFAOYSA-N	431.514	1.282	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)C#Cc2ccc(C(F)(F)F)cc2)c1	790113861	PDIUYUGIRZOJRM-UHFFFAOYSA-N	439.415	1.768	50	20	IDGD	
C[C@H]1C[C@H](C)CN(C(=O)c2ccccc2NC(=O)C(=O)NNc2nc3ccccn3n2)C1	792387805	IOZXPOHXEOWQGQ-GJZGRUSLSA-N	435.488	1.929	50	20	IDGD	
COc1c(NC(=O)C(=O)NNC(=O)c2cccc(C#N)c2)cc(Cl)cc1C(=O)N(C)C	793025091	JZHBVHNDDIABBS-UHFFFAOYSA-N	443.847	1.322	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)C(=O)Nc1cc(C(C)(C)C)nn1-c1ccc(C#N)cc1	793025446	KUDVVSKBMFIFBP-UHFFFAOYSA-N	434.460	1.473	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cnc3c(F)cccc3c2)cc1	794183336	RJVGBLIOKPJBLM-UHFFFAOYSA-N	430.461	1.764	50	20	IDGD	
Cc1cnc(COCC(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)o1	794766379	HISJYXLOHOQTNY-UHFFFAOYSA-N	447.451	1.719	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)c2ccnc(NC(=O)C3CC3)c2)c2ccccc2c1=O	794775390	MLGPZAIGLAJDKF-UHFFFAOYSA-N	434.456	1.796	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)[C@H]1CCCN(C(=O)c2ccncc2)C1	795169070	INFNOGMZTBRUMU-INIZCTEOSA-N	431.518	1.327	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc(Cl)ccc1C(F)(F)F)N[C@H]1CCS(=O)(=O)C1	795303714	RPDWZHKXXBBQLP-QMMMGPOBSA-N	435.833	1.038	50	20	IDGD	
CC(C)C[C@H](/N=C1/NS(=O)(=O)c2ccccc21)C(=O)NNC(=O)NCC(F)(F)F	798315984	GUKROEWLIRYTID-NSHDSACASA-N	435.428	1.033	50	20	IDGD	
CSc1cccc(F)c1C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	799100807	ZLSMBQCVEAJQMZ-UHFFFAOYSA-N	439.538	1.636	50	20	IDGD	
O=C(CCC/N=C1/NS(=O)(=O)c2ccccc21)NNc1ccc2c(=O)[nH]ccc2c1	803426819	CETLKVAYEYLVNY-UHFFFAOYSA-N	425.470	1.490	50	20	IDGD	
C=CCN1C(=O)C(=O)N(CC(=O)NNc2ccc(-c3cccc(C(F)(F)F)c3)nn2)C1=O	804210567	NLOPNQUNTLNUCE-UHFFFAOYSA-N	448.361	1.582	50	20	IDGD	
C[C@@H]1CCCN(S(=O)(=O)c2ccc(C(=O)NNc3ccc(-n4ccnc4)nn3)cc2)C1	804952607	QZKCHOVYWZIZKJ-OAHLLOKOSA-N	441.517	1.840	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)[C@](N)(c2cccc(F)c2)C(F)(F)F)c2ccccc2c1=O	806272443	GMLLCZHRDDHWAW-GOSISDBHSA-N	437.353	1.250	50	20	IDGD	
COC(=O)CC[C@@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)c1c(C)nc2ccccn12	806345424	XOJVYYUQLPEBGP-CYBMUJFWSA-N	433.465	1.250	50	20	IDGD	
CCOc1ccccc1N1CCN(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)CC1	807135538	KLOTWEMQXUTRIN-UHFFFAOYSA-N	436.476	1.238	50	20	IDGD	
CC(=O)C(=O)COC(=O)/C(C#N)=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	808484311	AQYNTZVSTQJZEC-RIYZIHGNSA-N	428.832	1.687	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)NCC(=O)NNc2cnc3ccccc3n2)cc1	811461213	HVSHFVUODHMFAG-UHFFFAOYSA-N	429.458	1.228	50	20	IDGD	
O=C(NN=CC1=Cc2ccccc2OC1)c1cccc(S(=O)(=O)N2CCOCC2)c1	812376749	PPIWLIZGUNFGRO-UHFFFAOYSA-N	427.482	1.899	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccc3c(c2)OCCCO3)cc1	813033527	XREUCMBHTUGBFJ-UHFFFAOYSA-N	434.474	1.180	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)C2CCC(OC[C@H]3CCCO3)CC2)c1	815346119	ZQEKGWCFNWOKBF-NKELODKYSA-N	429.473	1.617	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCO1)C(=O)Nc1cccc(-c2cn(Cc3ccccc3)nn2)c1	815779626	OGSJELOOCKJICB-LJQANCHMSA-N	434.456	1.258	50	20	IDGD	
CCn1c(NNC(=O)CN2C(=O)COc3ccc([N+](=O)[O-])cc32)nc2ccccc2c1=O	823911575	LDKMMDMHSUNBBB-UHFFFAOYSA-N	438.400	1.193	50	20	IDGD	
O=C(NCCc1ccc(F)cc1)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	903963170	VLTLSYIPPUAFBW-UHFFFAOYSA-N	434.493	1.797	50	20	IDGD	
Cc1ccccc1-n1ncc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1C	914748142	JFTZXSCMKCEBLV-UHFFFAOYSA-N	441.513	1.814	50	20	IDGD	
O=C(COC(=O)c1cn(-c2ccccc2C(F)(F)F)nn1)NNC(=O)c1ccccc1	914911716	DXPCKRRZFVMBTG-UHFFFAOYSA-N	433.346	1.904	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)NCc1cn2ccsc2n1	916218042	GPXLJUQFRLCWER-UHFFFAOYSA-N	427.534	1.439	50	20	IDGD	
CCC(CC)[C@@H](CNC(=O)NNC(=O)C(=O)Nc1ccc(C)c(C)c1)N1CCOCC1	916256480	YCOQFZSUXDMDPM-LJQANCHMSA-N	433.553	1.709	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)NCc1cccc(CN2CCCC2=O)c1	916415137	LCGRFTALZOPUSG-UHFFFAOYSA-N	426.473	1.727	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCCNC(=O)c2cccs2)nc1	916568686	BVYDZRVLGBSPFN-UHFFFAOYSA-N	440.551	1.230	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)c2ccc3c(c2)S(=O)(=O)N(C(C)C)C3=O)c1	916741327	WXSODUQPPOZOJR-UHFFFAOYSA-N	431.470	1.388	50	20	IDGD	
COc1ccc(C(=O)N2CCN(CC(=O)NNC(=O)c3ccc(F)cc3)CC2)c(OC)c1	917836869	XAQTVKJZZQNLBN-UHFFFAOYSA-N	444.463	1.062	50	20	IDGD	
COc1ccc(N2C[C@@H](C(=O)NNC(=O)Cc3ccccc3OC)CC2=O)c(OC)c1	919822794	KBGCVICTDMDRNZ-HNNXBMFYSA-N	427.457	1.455	50	20	IDGD	
Cc1[nH]c2ccc(Br)cc2c1CC(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1	919886021	PGACAIBRHHBYNX-NSHDSACASA-N	443.323	1.299	50	20	IDGD	
CC[C@H](C)[C@H](C)NC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	920048529	JGFIQVCEQYAGDZ-HOTGVXAUSA-N	440.566	1.405	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCc2ccco2)cc1S(=O)(=O)Cc1cc(C)no1	920855843	BRLHOTJPYKFNNU-UHFFFAOYSA-N	448.457	1.703	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)c1ccc(N2CCCC2=O)cc1	920983282	HPSDCQLUHSOUDS-CQSZACIVSA-N	448.483	1.766	50	20	IDGD	
CCNC(=O)NC1(C(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)CCCC1	1116090927	CKRRPYKYGAFOIN-UHFFFAOYSA-N	425.530	1.413	50	20	IDGD	
Cc1nn([C@H]2CCS(=O)(=O)C2)c(C)c1C=NNC(=O)Cc1nc2ccccc2n1C	1317710263	UVMZBQDVQVIBRA-HNNXBMFYSA-N	428.518	1.439	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccccc1C(F)(F)F)NNC(=O)c1n[nH]c2c1CCCC2	1317737260	MRHDCJQPHZRAHD-UHFFFAOYSA-N	445.423	1.047	50	20	IDGD	
O=C(CC[C@H]1NC(=O)N(c2ccc(Cl)cc2)C1=O)NNC(=O)c1n[nH]c2c1CCCC2	1318326991	MPLGYHMMROTIIB-OAHLLOKOSA-N	444.879	1.608	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cnn(C3CCCCC3)c2)cc1	1321719209	ZBUBKSAJPCHBOK-UHFFFAOYSA-N	433.534	1.778	50	20	IDGD	
CC(C)(C)c1ccc(NNC(=O)c2ccc(S(=O)(=O)NC[C@@H]3CCCO3)cc2)nn1	1328714470	LGRZJBDCDWADOV-HNNXBMFYSA-N	433.534	1.988	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)c3n[nH]cc3I)nc21	1342769414	RAAWASDOXNKNQB-UHFFFAOYSA-N	442.221	1.372	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)N[C@@H]2COc3c(F)cc(F)cc3C2)nc1	1346929599	SHRWIDPLKKSHCF-ZDUSSCGKSA-N	441.460	1.676	50	20	IDGD	
COc1ccc(C(=O)NCC(=O)NNC(=O)c2ccc(OC(C)C)c(OC)c2)cc1OC	1440331332	DHPKIKXOLQDQGO-UHFFFAOYSA-N	445.472	1.691	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2nnc3cc(C)nn3c2C)C1	1778562481	CYHFOCXORRPYON-GCKMJXCFSA-N	448.955	1.886	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)C[C@H]3CNc4ccccc4O3)C2)C1	1778934882	XGCHUWIFTYRKGP-CKJXQJPGSA-N	437.924	1.333	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)c3sccc3Cl)C2)C1	1779791257	QCUVGWNUWZBPFS-SFHVURJKSA-N	428.942	1.218	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(Cl)ncn1)C2)[C@@H](F)Br	1780773798	NDCFOLHDXMDXHP-AXAPSJFSSA-N	449.708	1.948	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cncc(O)c1)C2)[C@H](F)Br	1780777227	OZVYCXREENFORI-JKIFEVAISA-N	430.274	1.605	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cnc(-c4ccccn4)nc3)CCO2)C1	1781214320	TZEJNZOJXQXZCP-KKSFZXQISA-N	429.908	2.000	50	20	IDGD	
O=C([C@H](F)Br)N1CC[C@@]2(C1)CN(C(=O)[C@@H]1CCc3nc[nH]c3C1)CCO2	1781333106	CJJVJDQZVYZFAK-HYSWKAIVSA-N	429.290	1.035	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCNC(C)=O)C1	1781795413	HBOXASZQTFGTEO-HDMKZQKVSA-N	432.359	1.200	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H]1CCCN1C)C2	1781901163	KWPHEKQQKGVIQQ-YYAJDYIMSA-N	430.387	1.768	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CN2CCCCC2=O)C1	1782100286	LXDAWQFPSLJBOJ-DYESRHJHSA-N	439.629	1.364	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc3ccccn3n1)C2	1782172639	ITXUSGVNOSTHNE-HGHGUNKESA-N	434.924	1.716	50	20	IDGD	
O=C1Cc2cccc(C(=O)N3CC[C@@]4(C3)CN(C(=O)[C@H](F)Br)CCO4)c2N1	1782411381	DXSOYALUALMJMG-MAUKXSAKSA-N	440.269	1.315	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCO[C@]2(CCN(C(=O)Cc3cc[nH]n3)C2)C1	1782793837	DHSITRZAIBWPOW-NAVGAYGYSA-N	441.438	1.667	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](O)Cc3ccccc3)C2)C1	1783340989	FXGYBZWRKBIXDR-ZSZQSSIHSA-N	425.323	1.203	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cnn4ccncc34)CCO2)C1	1783347993	RBDBWYKUCAACKE-KSSFIOAISA-N	436.310	1.346	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3cccc([N+](=O)[O-])c3)[C@H]2C1	1783439428	ZFEHFCSQFFYGMV-OWLYRPNTSA-N	439.896	1.371	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccc4nccnc4c3)CCO2)C1	1783534557	WEMZVBZZZVRUCG-ORAYPTAESA-N	433.306	1.857	50	20	IDGD	
Cc1nccn1CCCC(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](C)Br)C2)C1	1783539815	OCODWOIVEKZACH-KDOFPFPSSA-N	427.343	1.585	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cc([N+](=O)[O-])c(O)cc3C)CCO2)C1	1783880262	GXTJFTJLXXUPFI-AUUYWEPGSA-N	441.868	1.306	50	20	IDGD	
CCCc1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc1	1783935444	UGXNSZYDWGGKSW-QHCPKHFHSA-N	430.549	1.456	50	20	IDGD	
Cc1cc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]3C2)no1	1783974821	VLELOQUHNDPGFH-XTBFLFJDSA-N	428.327	1.536	50	20	IDGD	
Cc1cc(C)n(CCC(=O)N2CC[C@]3(CN(C(=O)CCBr)CCO3)C2)n1	1784318021	WVGOWOAVWPKKFQ-GOSISDBHSA-N	427.343	1.505	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(=O)n3C)[C@H]2C1	1785866862	WYSVLOXHDKABJZ-HOSILWTGSA-N	440.338	1.010	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C[C@H](N)c3cccnc3)[C@H]2C1	1786928457	KDPJBVCFHHAIAZ-LLYLOPHFSA-N	443.375	1.688	50	20	IDGD	
Cc1ncc(C(=O)Nc2ccc(C3(NC(=O)c4cccc(B(O)O)c4)CCC3)cc2)cn1	1787216034	FGNDGAWWQQVXLR-UHFFFAOYSA-N	430.273	1.526	50	20	IDGD	
COc1ccc(C(=O)NC2(c3ccc(NC(=O)c4cccc(B(O)O)c4)cc3)CCC2)nc1	1788145728	UBGWNFCNQACRBT-UHFFFAOYSA-N	445.284	1.832	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)[C@@H]1Cc2ccccc2O1	1788184498	AQQCKSLYVKOGCD-XPYWIHLFSA-N	441.297	1.660	50	20	IDGD	
COC[C@H](Cl)C(=O)NC1(c2ccc(NC(=O)[C@@H](O)N3CCOCC3)cc2)CCC1	1789557124	PWTHQTTXBSPYQY-QFBILLFUSA-N	425.913	1.025	50	20	IDGD	
Cc1nnc(CCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]3C2)s1	1789922134	HXADUAINGULGPD-ASHKBJFXSA-N	449.346	1.449	50	20	IDGD	
COCc1c[nH]c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]3C2)c1	1789924826	XUOLPZAQPKRQMC-NZBPQXDJSA-N	432.290	1.445	50	20	IDGD	
COc1ccccc1CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21	1790952824	LGSFSDSFZNOIIV-ILXVDBEPSA-N	443.313	1.908	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3CCN(C)CC3)C[C@@H]21	1790962236	RESFNPJVNNMDKZ-QAETUUGQSA-N	430.387	1.481	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4nonc4c3)C[C@@H]21	1791057978	SVROBXJPZKOIBU-LESCFKLSSA-N	437.294	1.600	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]3C2)c(O)c1OC	1791296863	UMJUATJVRXGXMY-JKOKRWQUSA-N	447.315	1.806	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1ccc(C2(NC(=O)[C@H]3CCCS3(=O)=O)CCC2)cc1	1791571018	IPVXRHQJNWMGOK-JKSUJKDBSA-N	428.938	1.952	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(C(N)=O)cc3)[C@H]2C1	1791896762	IACBXCXJOMUGIH-MEYUZBJRSA-N	438.322	1.162	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(NC(C)=O)cc3)[C@H]2C1	1792005157	RSFGZOZHKPPUJO-WNHJNPCNSA-N	437.924	1.492	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nc3ccccc3[nH]1)C2	1792868034	NRSUUCDVGVGRPG-NFFDBFGFSA-N	435.322	1.797	50	20	IDGD	
CCOC(=O)c1cccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](O)CCl)c1F	1793113104	AVXBZVGKIFSNFK-ZWUHOBOKSA-N	426.872	1.854	50	20	IDGD	
C#CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Cl	1796369781	DLOKNDPMNVTGQH-XLWJZTARSA-N	431.892	1.027	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(C)n(C)n1)C2	1796889744	FVKYKLIVHKIIAN-YDOXXCSQSA-N	425.493	1.114	50	20	IDGD	
CCOC(=O)O[C@@H](C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C(C)=N/NC(=O)c1ccc[nH]1	1796893837	YRKZYOYWPGBHOF-CJDYHMCNSA-N	447.492	1.320	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C#CC1(O)CCCCC1	1797785397	QLWSGUYIAPHVGO-KYHPRHEASA-N	441.366	1.448	50	20	IDGD	
C[C@H](Nc1ccccn1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@](C)(Cl)CCl)C2	1797977585	IHPVPSYBWBLLMU-MABMQTIPSA-N	429.348	1.708	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2)C1=C2c3ccccc3C(=O)N2CC1	1798449990	RMOJFZAVTSYUOD-GWLLULGVSA-N	433.867	1.381	50	20	IDGD	
COc1ccc(C2(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@@H](O)CCl)C4)CCC2)cc1	1799259284	QJQRUTSMVBRLPI-QXGSTGNESA-N	436.936	1.306	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc3c(c1)OCO3)C2)[C@@H](F)Br	1799346715	XZABWWAKRKXTIO-CZAMWMTLSA-N	443.269	1.238	50	20	IDGD	
Cc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Br)nn1C(F)F	1799348557	KHOHUEONEZNCCX-QCMRWSPLSA-N	439.232	1.480	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(Cl)c1	1799618374	ANUNAJYKUHRRQE-MUJYYYPQSA-N	427.892	1.904	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](F)Br)c1cc(=O)nc2sccn12	1800160938	KZJQWBCWBIZZMK-BSTOTGJRSA-N	443.298	1.698	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccc2c(c1)CCO2	1800689984	SAYATVOCVGEREG-NNNWTRQLSA-N	441.355	1.990	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccnc3c(O)cccc13)C2	1800979766	ZYLVQWJZPYWMEO-VLWCASSMSA-N	433.892	1.397	50	20	IDGD	
CCOc1ncccc1C(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]1c1cccnc1	1803137796	RVLHBDKGZUVXJA-NXHRZFHOSA-N	432.908	1.795	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cccc3c2OCCO3)[C@H]1c1cccnc1)[C@@H](O)CCl	1803139649	RZVIINGSKCYLST-IEZWGBDMSA-N	445.903	1.772	50	20	IDGD	
Cc1ncccc1C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1805494337	BPUSFUXNTSIIAP-SIKLNZKXSA-N	444.300	1.098	50	20	IDGD	
C=CCSCC(=O)N1CCCC2(CCN(C(=O)c3cnccc3C(=O)NN)CC2)C1	1806678056	JOQXJIPTJLPZND-UHFFFAOYSA-N	431.562	1.449	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)CC(F)(F)F)[C@H]1c1cccnc1	1806840536	GIKBCEBCBXWNEK-RDTXWAMCSA-N	429.443	1.413	50	20	IDGD	
Cc1nc(C(=O)N2CCCC3(CCN(C(=O)CCC(=O)NN(C)C)CC3)C2)ccc1F	1807549238	QAZFPHOMDBTUCW-UHFFFAOYSA-N	433.528	1.747	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)c1nccc2nc[nH]c12	1808129932	YDBGZXFNABQETG-JCKWVBRZSA-N	428.880	1.272	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2cccnc2C(N)=O)[C@@H]1c1cccnc1	1808251312	QVNWZNGTISFQMU-QILLFSRXSA-N	429.908	1.913	50	20	IDGD	
Cc1nc(C(=O)N2CCCC3(CCN(C(=O)c4cnccc4C(=O)NN)CC3)C2)co1	1808401398	OSZPCWDPYAETEA-UHFFFAOYSA-N	426.477	1.140	50	20	IDGD	
CC(C)c1cc(C(=O)N2CCC3(CCCN(C(=O)c4ccc(B(O)O)cc4)C3)CC2)no1	1809967703	GKPOLGNGKVKJFS-UHFFFAOYSA-N	439.321	1.636	50	20	IDGD	
O=C(Cc1ccccc1F)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1	1809967766	KCUITYIJUZBJIV-UHFFFAOYSA-N	438.308	1.593	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)CO[Si](C)(C)C)[C@H]1c1cccnc1	1810548657	RZGBMBUFNQTIPP-DYESRHJHSA-N	449.628	1.312	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2cnn3c2OCCC3)[C@@H]1c1cccnc1	1812120424	WLTPFPHCRATDLP-SZMVWBNQSA-N	447.923	1.634	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2c3c(nn2C)CCC3)[C@@H]1c1cccnc1	1813034791	XTQOKWWBENUJTP-VDZJLULYSA-N	445.951	1.877	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2ccncc2F)[C@@H]1c1cccnc1	1813069829	DCYPFZIZWCUWNP-HRAATJIYSA-N	442.495	1.308	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2cscn2)[C@H]1c1cccnc1	1813071225	QRFMLENYKIMJJH-BEFAXECRSA-N	430.534	1.231	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H](CNC(=O)[C@H]2CCNC(=O)C2)[C@@H]1c1cccnc1	1813135903	MTHGAUMNWJADFT-IDVHHABFSA-N	441.359	1.850	50	20	IDGD	
C#CCCC(=O)NC[C@H]1CCN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@@H]1c1cccnc1	1814103236	IFTXLMILMMZIBG-ZNPGGGMWSA-N	434.500	1.635	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)COC(=O)C(F)(F)F)[nH]n1)[C@@H](O)CCl	1814873759	UCMRCHSNEPCTQF-ZJUUUORDSA-N	426.779	1.107	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1cncc(F)c1	1816530996	NOFZAHXBICIFFZ-GOSISDBHSA-N	437.240	1.243	50	20	IDGD	
O=C(CCBr)Nc1cc([C@@H]2CCCCN2C(=O)c2nc3ncccn3n2)[nH]n1	1816780864	MKPJCHDTFHDKNL-LBPRGKRZSA-N	447.297	1.938	50	20	IDGD	
O=C(CS(=O)(=O)N1CCCC1)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](F)Cl)[nH]n1	1818108680	QFPXOISZQOOKLK-WFASDCNBSA-N	435.909	1.362	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](F)Br)CC2)c1n[nH]cc1[N+](=O)[O-]	1820304170	MJHHPTCQMBVLSY-RRAGMBSWSA-N	447.246	1.691	50	20	IDGD	
COc1cc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@@H](F)Br)CC3)nn1C	1821771848	DWKCNUASEYMGES-JVXZTZIISA-N	446.302	1.802	50	20	IDGD	
COCc1c[nH]c(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)c1	1822414904	NPRPPVHRNBDJPB-QGZVFWFLSA-N	445.524	1.563	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H]2CCC(=O)NC2)CC1	1823842847	GNAKNCDJKJCOPU-BPUTZDHNSA-N	428.371	1.916	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC[C@H]1C1CCN(C(=O)Cn2cnnn2)CC1	1824094255	VENZLUWBOJNMLK-ZFWWWQNUSA-N	427.347	1.324	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)C2=CCCS2)CC1	1824564134	XRUTUCICWOQRGV-LJQANCHMSA-N	428.363	1.621	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(=O)n1C)CC2	1825636424	FUHMCBWSPKEJHT-ZJUUUORDSA-N	439.335	1.851	50	20	IDGD	
COc1ccc(C(=O)N[C@H]2CCc3nc(NC(=O)[C@@H](C)Br)sc3C2)nn1	1825642323	POFLBNBXPPDIAZ-BDAKNGLRSA-N	440.323	1.951	50	20	IDGD	
O=C([C@H]1[C@H]2SC=C[C@H]21)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827053465	QKUWRZRCLBRKNZ-BURNTYAHSA-N	440.374	1.475	50	20	IDGD	
O=C(C1CCC(O)CC1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827054710	KAMLDCQZNKPJGQ-UDJZJCJKSA-N	442.365	1.151	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3nccc4nc[nH]c34)C2)C1	1831645261	ANPHHUUAPQKMPM-JLTOFOAXSA-N	435.912	1.435	50	20	IDGD	
CC(=O)N/C(C)=C/C(=O)N1CCC([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1	1831874235	DXZBVIRZUUGPOQ-VVLLFNJHSA-N	435.569	1.019	50	20	IDGD	
O=C(CCc1cccc([N+](=O)[O-])c1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1832173522	QIFJECVJZZWVBM-HKUYNNGSSA-N	443.859	1.518	50	20	IDGD	
Cc1cc(C)n(CC(=O)N2CCO[C@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)n1	1833034760	KEGXMYNLBUVEMO-HXUWFJFHSA-N	426.945	1.221	50	20	IDGD	
O=C(/C=C/c1cccnc1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1833103611	WSGFITGTPGWATM-YPZLONQISA-N	442.285	1.242	50	20	IDGD	
CC[C@H](C(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)CCl)CC2)CC1)N(CC)CC	1833306711	ZJUSSVHBCZQISA-MOPGFXCFSA-N	431.021	1.278	50	20	IDGD	
Cc1ncccc1CCC(=O)N1CCC(N2CCC(NC(=O)[C@H](O)CCl)CC2)CC1	1833308170	KQZPAVWSISOLBI-HXUWFJFHSA-N	436.984	1.494	50	20	IDGD	
CN1CCCC[C@H]1C(=O)NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1	1833322037	QOYUMLKTXJETPJ-IRXDYDNUSA-N	447.393	1.733	50	20	IDGD	
CCc1cc(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](C)Br)CC3)CC2)n[nH]1	1834923559	DZYKCAVMOQSASC-CYBMUJFWSA-N	440.386	1.941	50	20	IDGD	
O=C(Cc1ccsc1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1836102157	LNSLWMGRDGGTKO-GDBMZVCRSA-N	435.315	1.438	50	20	IDGD	
Cc1cc(C(=O)NC2CCN(C3CCN(C(=O)CCBr)CC3)CC2)n[nH]1	1836145103	HWRUBKIGXTZZIW-UHFFFAOYSA-N	426.359	1.688	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC1CCN(C2CCN(C(=O)c3cc[n+]([O-])cc3)CC2)CC1	1836399899	PXSIJQSCNBRVSF-HXUWFJFHSA-N	443.375	1.742	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(F)c(F)c3)C2)C1	1837714578	KVAGZYRWBNMFJT-HXUWFJFHSA-N	442.535	1.886	50	20	IDGD	
O=C(c1c(O)cc(O)cc1O)N1CCC(OC2CCN(C(=O)[C@H](F)Cl)CC2)CC1	1838083921	GLYQEZUGFNQQSW-KRWDZBQOSA-N	430.860	1.950	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ncccc3F)CCO2)C1	1838250804	UZJINYJENTWSBP-ROUUACIJSA-N	434.295	1.527	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(Cl)c3)CCO2)C1	1838920301	QWJLOKYSHPNBBO-VQIMIIECSA-N	431.316	1.664	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(C#N)ccc3F)CCO2)C1	1839422099	CGZRCOONLYACHS-OXQOHEQNSA-N	439.871	1.021	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3nccnc3C)C2)C1	1839966140	VSGMPRQONVXAIY-RDTXWAMCSA-N	441.326	1.029	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(F)c[nH]3)CCO2)C1	1840063852	QFANASFFJXPWIP-PXAZEXFGSA-N	432.290	1.255	50	20	IDGD	
COc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)c(OC)c1	1840189069	ULMLTMKOYXJKOL-IBGZPJMESA-N	447.315	1.578	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)cc(C)c1O	1840190882	SIUFJDHZUBAVFB-LJQANCHMSA-N	431.316	1.883	50	20	IDGD	
O=C(Cn1cnc2ccccc21)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840190890	SQJGPONJEHPESQ-LJQANCHMSA-N	441.315	1.296	50	20	IDGD	
Cc1cnn([C@H](C)C(=O)N2CCO[C@]3(COCCN(C(=O)[C@](C)(Cl)CCl)C3)C2)c1	1840406301	SQLQHAXKZHCTEH-ATZDWAIDSA-N	447.363	1.445	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC2(CCCN2C(=O)[C@@H](O)CNC(=O)OC(C)(C)C)C1	1841298038	QHNPEKCQGIRKEM-STQMWFEESA-N	448.358	1.106	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@@H](C(=O)N2CCCC23CN(C(=O)[C@@H](O)CCl)C3)C[C@H]2C[C@H]21	1841361179	VTWFTRZPIVGCKY-TUVASFSCSA-N	427.929	1.187	50	20	IDGD	
CC(C)(C)OC(=O)N1CCOC[C@@H]1C(=O)N1CCCC12CN(C(=O)C(Cl)Cl)C2	1841751781	QHMPKMHPLOUGDE-GFCCVEGCSA-N	436.336	1.629	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)Cc2cccc(Cl)n2)C1	1842113454	BXGCSTWPCPFHAB-AFUMVMLFSA-N	442.907	1.615	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1coc(C(C)C)n1)C2	1843415631	UGAVQAQXEWQXEU-ZVHZXABRSA-N	426.477	1.749	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1ccc(Cl)c(F)c1)C2	1844264847	OXQULRMPIWMFSK-UHFFFAOYSA-N	431.855	1.608	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1ccnc3c(O)cccc13)C2	1844265159	ZYGUTMQBVQIYNL-UHFFFAOYSA-N	446.467	1.070	50	20	IDGD	
Cc1cc(O)c(C(=O)N2CCCC23CN(C(=O)[C@@H](O)CCl)C3)cc1Br	1845481943	TXIIDBYUCQOLOX-AWEZNQCLSA-N	431.714	1.880	50	20	IDGD	
C[C@H](Br)C(=O)N1CC2(CCCN2C(=O)c2cc(S(C)(=O)=O)ccc2F)C1	1845567339	SBKDCYFUYVRQPS-NSHDSACASA-N	447.326	1.830	50	20	IDGD	
COCCOCC(=O)N1CC2(CCCN2C(=O)[C@@H](Br)Cc2ccccc2)C1	1845940786	JMJHVBCNXSZPMJ-KRWDZBQOSA-N	439.350	1.859	50	20	IDGD	
COC(=O)[C@@H](CC(=O)N1CCCC12CN(C(=O)[C@H](F)Cl)C2)NC(=O)OC(C)(C)C	1846304627	IJPQWZJJNCRZMS-YPMHNXCESA-N	435.880	1.181	50	20	IDGD	
O=C1C[C@@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](F)Br)CN1C1CCCC1	1848040644	PKUZMJNQHKBGQW-DSRCVFDASA-N	430.318	1.670	50	20	IDGD	
CCn1c(NNC(=O)CN2C(=O)N[C@]3(CCCC[C@H]3C)C2=O)nc2ccccc2c1=O	10681435	OBOBGUGMVNKDRU-ASSNKEHSSA-N	426.477	1.360	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=S)NCCSc2ccccc2)c1	18139292	MUGKMPCNYBXDMZ-UHFFFAOYSA-N	438.600	1.838	50	20	IDGD	
CSCC[C@@H](NC(=O)c1ccco1)C(=O)NNC(=O)c1cc(Br)c[nH]1	28717757	PNBSFSCURQDMLB-SNVBAGLBSA-N	429.296	1.683	50	20	IDGD	
COCCNS(=O)(=O)c1cccc(C(=O)NNC(=O)COc2cc(C)ccc2C)c1	105803176	NPOITCZTFGLEHC-UHFFFAOYSA-N	435.502	1.068	50	20	IDGD	
CCCC(=O)N1CSC[C@@H]1C(=O)NNC(=O)c1nn(CCC)c(=O)c2ccccc12	727297092	FRDWYCXBYBXQIX-OAHLLOKOSA-N	431.518	1.269	50	20	IDGD	
O=C(NNS(=O)(=O)/C=C/c1ccccc1Cl)c1csc(N2CCOCC2)n1	727351529	MJGDLODRKDEPGH-BJMVGYQFSA-N	428.923	1.868	50	20	IDGD	
COc1ccccc1[C@@H](C)CC(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	728658135	GKSDHIAIQXKTEU-LIRRHRJNSA-N	428.441	1.719	50	20	IDGD	
CC1CCC(NC(=O)CN2CCN(C(=O)NNC(=O)c3cccc(C#N)c3)CC2)CC1	728953056	ANINGVFOZPBDCE-UHFFFAOYSA-N	426.521	1.225	50	20	IDGD	
CN(CC(=O)N1CCCC1)C(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1	729226797	DFPZAAYLZQBPQC-JOCHJYFZSA-N	449.555	1.909	50	20	IDGD	
CCCN(CCC)C(=O)CCC(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	729511759	RUEVTTSQVICHII-UHFFFAOYSA-N	432.930	1.177	50	20	IDGD	
CCOc1cccc(N2CCN(CC(=O)NNC(=O)c3cc(Cl)ccc3OC)CC2)n1	730266321	UABIVKSGIOANRF-UHFFFAOYSA-N	447.923	1.726	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)c1sc(-c2c(C)c(C)nn(C)c2=O)nc1C	731493910	BHXYKUGKPYGHQT-UHFFFAOYSA-N	427.486	1.912	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)c2c[nH]nc2C)cc1S(=O)(=O)NCc1ccccc1	731851709	PWXQWEWSAZDXRY-UHFFFAOYSA-N	427.486	1.580	50	20	IDGD	
CC1=NN(c2ccc(C(=O)OCC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)cc2)CC1	732326029	URFDJKXYHVBGAP-UHFFFAOYSA-N	425.401	1.799	50	20	IDGD	
CC[C@H](C)NS(=O)(=O)c1ccc(C(=O)NNc2nc3ccccc3c(=O)n2C)cc1	733263647	ORUFRHMUOROSIF-ZDUSSCGKSA-N	429.502	1.767	50	20	IDGD	
O=C(NNC(=S)Nc1ccc(OC(F)F)c(Cl)c1)N[C@@H]1CCS(=O)(=O)C1	735622746	FLARDTKABFJGMI-MRVPVSSYSA-N	428.870	1.629	50	20	IDGD	
CC(=NNC(=O)COc1ccccc1F)c1cccc(S(=O)(=O)N2CCOCC2)c1	739399751	JLTRMDVNCLFGIT-UHFFFAOYSA-N	435.477	1.766	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)[C@H]1CCC[C@@H]1NC(=O)OC(C)(C)C	739734857	YNGQUSFMTKXVTR-STQMWFEESA-N	429.518	1.535	50	20	IDGD	
O=C(COC(=O)Cc1c[nH]c2ccc(Cl)cc12)NNC(=O)[C@H]1COc2ccccc2O1	740303699	ZXXFZJUKWYVSBZ-GOSISDBHSA-N	443.843	1.894	50	20	IDGD	
CCN1C[C@@H](CN(C)CC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)Oc2ccccc21	741617234	UKTPTDOFXMEHNE-QGZVFWFLSA-N	427.461	1.575	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)NC[C@@H]2CN3CCC[C@@H]3CO2)cc1Cl	743593964	KHQBUWWMOZLLAJ-VXGBXAGGSA-N	427.889	1.556	50	20	IDGD	
CN(CC(=O)NNC(=O)Nc1ccc(OC(F)F)cc1)S(=O)(=O)c1ccccc1	743833500	SYJBAWFIHREZOW-UHFFFAOYSA-N	428.417	1.761	50	20	IDGD	
COc1cc(NC(C)=O)c(C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)cc1OC	744460097	PNRVNMFSPJKJLS-UHFFFAOYSA-N	440.412	1.152	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)c2cc(F)ccc2N2CCOCC2)cc1	744984079	HLTMVRDJOWCQJE-UHFFFAOYSA-N	426.404	1.152	50	20	IDGD	
COc1ccc(-c2nn(CCC#N)cc2/C=C(\C#N)C(=O)NNC(=O)N(C)C)cc1OC	746006000	IPWQTYJVAGFDCD-XNTDXEJSSA-N	437.460	1.690	50	20	IDGD	
C[C@@H](CC(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)c1cccc(F)c1	746084152	BVXPIZFURFVHAZ-UGSOOPFHSA-N	444.415	1.565	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)CCc2c(C)nc3cc(O)nn3c2C)cc1	747337366	PXHMDLULAAVRAF-OAHLLOKOSA-N	441.488	1.998	50	20	IDGD	
O=C(COC(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1)NNC(=O)c1cccc(Cl)c1	747681447	JSWKJXAGDSIFOU-UHFFFAOYSA-N	444.791	1.447	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)NCC2CCN(S(C)(=O)=O)CC2)c1C	749016688	BODCCUBKRNFGFY-HNNXBMFYSA-N	426.539	1.073	50	20	IDGD	
COc1ccccc1N1CC[C@H](CNC(=O)NNC(=O)c2nnc(O)c3ccccc23)C1	750331707	WYSDZSXUPGKJBZ-CQSZACIVSA-N	436.472	1.815	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)CCc2ccc(F)cc2F)CC1	752621327	AJTMOCMEAMLMDB-UHFFFAOYSA-N	439.488	1.372	50	20	IDGD	
COC(=O)c1cc(NC(=O)NNC(=O)c2ccc3c(c2)OCCO3)c(C)c([N+](=O)[O-])c1	753131300	RKQMAGUUOWDNHQ-UHFFFAOYSA-N	430.373	1.928	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)Cn1nc(-c2ccc([N+](=O)[O-])cc2)oc1=O	755249128	UAXNGRUBMYNKMR-UHFFFAOYSA-N	447.791	1.535	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)Nc1cccc(C(=O)N2CCOCC2)c1	755934834	WTGWYPHIHFCGJF-UHFFFAOYSA-N	428.445	1.399	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)CN2C(=O)NC3(C[C@@H](C)C[C@H](C)C3)C2=O)c1	756865244	OXCBDVXJYWTQHQ-HOTGVXAUSA-N	430.505	1.576	50	20	IDGD	
CS(=O)(=O)Cc1ccc(NC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])cc1F	757675977	QAZPYTMBJVFEOB-UHFFFAOYSA-N	440.409	1.510	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)COc2cccc(C(F)(F)F)c2)n1	758461640	OXFSKUYLWSDCBR-UHFFFAOYSA-N	431.392	1.782	50	20	IDGD	
Cc1cc(S(=O)(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc(C(=O)O)c1Cl	759090331	NYWGFHNRIZKZOT-UHFFFAOYSA-N	446.890	1.373	50	20	IDGD	
O=C(COC(=O)c1ccc(CS(=O)(=O)C(F)F)cc1)NNC(=O)c1ccccc1	759379691	VEGRDQOBMPXAJK-UHFFFAOYSA-N	426.397	1.442	50	20	IDGD	
Cc1nc(COc2cccc(C(=O)NNC(=O)c3nn(-c4ccccc4)cc3O)c2)no1	760118293	WUPJDFDVGRGTED-UHFFFAOYSA-N	434.412	1.923	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)c1ccoc1)N(S(C)(=O)=O)CC2	761418311	XDKQHCBTPLBFBZ-HNNXBMFYSA-N	437.474	1.007	50	20	IDGD	
Cn1cc(S(=O)(=O)N2CCOCC2)cc1C(=O)NNc1ccc(OC(F)(F)F)cc1	761581557	VFKPSRAGHZJIIR-UHFFFAOYSA-N	448.423	1.702	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2ccccc2)c(C(=O)N2CCCC2)cc1OC	763419275	AXGASNKXLJHKFA-UHFFFAOYSA-N	440.456	1.340	50	20	IDGD	
CCCN1CCN(c2ccc(NC(=O)C(=O)NNC(=O)c3ccccn3)cc2Cl)CC1	763466971	MODJKRPNRPXXOR-UHFFFAOYSA-N	444.923	1.667	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)C(=O)Nc1ccc(Cl)nc1	763531371	NCLNZDOVFSZRCC-UHFFFAOYSA-N	430.896	1.033	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)N3C[C@H](C)O[C@@H](C)C3)cc2)c(C)o1	763576196	IFHULZMQDPGIGV-KBPBESRZSA-N	442.472	1.546	50	20	IDGD	
CCNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)COc2ccc(C(C)(C)C)cc2)c1	763595469	QHNMHEGKSZLAPD-UHFFFAOYSA-N	440.500	1.899	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(S(=O)(=O)C(F)F)cc2)c1	763625534	SXIAOZCFBYSLKF-UHFFFAOYSA-N	441.412	1.156	50	20	IDGD	
COC(=O)c1cc(Cl)cc(NC(=O)C(=O)NNC(=O)COc2ccccc2OC)c1	763657459	MXRJFOMTJINTRA-UHFFFAOYSA-N	435.820	1.300	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(F)cc1OCC(F)F	763658046	UGOLPPKLKCCKCZ-UHFFFAOYSA-N	441.362	1.643	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccc(C(=O)NC(C)(C)C)c1	763663327	RLROFBOGMBHSAW-UHFFFAOYSA-N	442.472	1.388	50	20	IDGD	
C[C@H]1CCCN(Cc2ccc(NC(=O)C(=O)NNC(=O)COc3ccc(C#N)cc3)cc2)C1	763675435	WJLIWDSMPSCXAT-KRWDZBQOSA-N	449.511	1.955	50	20	IDGD	
Cc1cc(N2CCSCC2)ccc1NC(=O)C(=O)NNC(=O)COc1ccccc1F	763679576	ODLULGJSBCDVEC-UHFFFAOYSA-N	446.504	1.852	50	20	IDGD	
O=C(NNC(=O)[C@H]1C[C@]12CCOC2)c1cccc(S(=O)(=O)NCc2ccccc2)c1	763728741	QYSWHLGYFDJLMC-NQIIRXRSSA-N	429.498	1.353	50	20	IDGD	
CC(C)(C)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])cc1	763805008	QNOYYTALMCCMFX-UHFFFAOYSA-N	442.428	1.989	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)N(C)C)cc2)cc1	763860433	GYJJCMFRXVJWMW-AWEZNQCLSA-N	442.472	1.341	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(OCC(C)C)nc2)cc1	763878301	OPZTXVLZYQDSEP-OAHLLOKOSA-N	442.472	1.872	50	20	IDGD	
CC(C)CC(=O)NNC(=O)C(=O)Nc1cc(NC(=O)CN2CCCC[C@@H]2C)ccc1F	763881623	IEQVDRWDKMJANG-AWEZNQCLSA-N	435.500	1.771	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)C(=O)Nc1ccc(Oc2ccccc2)cc1	763916233	DVGVPXPQPUPCIR-UHFFFAOYSA-N	443.423	1.854	50	20	IDGD	
CC(C)N1CCN(c2cccc(NC(=O)C(=O)NNC(=O)Cc3ccc(F)cc3)c2)CC1	763918380	BUYKNIBXXCIXPQ-UHFFFAOYSA-N	441.507	1.685	50	20	IDGD	
Cc1ncc(-c2ccccc2)cc1NC(=O)C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	763920769	CUKFPVNMFXRSQZ-UHFFFAOYSA-N	442.439	1.432	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3ccccc3S(C)(=O)=O)cc2C1	763939863	OLPLBTPRNLXVIA-NSHDSACASA-N	435.527	1.676	50	20	IDGD	
Cc1nc(C)n(-c2ccccc2NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)n1	763977969	CAYAQZARCPNJDD-UHFFFAOYSA-N	428.836	1.643	50	20	IDGD	
O=C(NNC(=O)c1ccc[nH]1)C(=O)Nc1cccc(C(=O)Nc2ccc(Cl)cn2)c1	763981144	VNBOAOLTFIJLBA-UHFFFAOYSA-N	426.820	1.715	50	20	IDGD	
Cc1cc(C)n(-c2ccc(NC(=O)C(=O)NNC(=O)c3cc(Br)c[nH]3)cn2)n1	763996093	UZHOZRQBBLVAMY-UHFFFAOYSA-N	446.265	1.374	50	20	IDGD	
N#Cc1cc(Cl)ccc1-n1ccc(NC(=O)C(=O)NNC(=O)Cc2ccsc2)n1	764033848	AZJPARALQUGMPJ-UHFFFAOYSA-N	428.861	1.787	50	20	IDGD	
CS(=O)(=O)c1cccc(NC(=O)C(=O)NNC(=O)Cc2cccc3ccccc23)c1	764036215	LBHKSISGGSPCFE-UHFFFAOYSA-N	425.466	1.572	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2ccc(C(=O)c3nccn3C)cc2)cc1	764124567	KRLMXKQCYSBRPB-UHFFFAOYSA-N	449.467	1.378	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2cc(C)n(-c3ccccc3Cl)n2)c1O	764130895	BCDXTCDHWYRTJV-UHFFFAOYSA-N	443.847	1.948	50	20	IDGD	
CCOCCOCc1cccc(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)c1C	764166307	AXZWTAVFXAQYHM-FQEVSTJZSA-N	441.484	1.638	50	20	IDGD	
CCOC(=O)c1ccn(-c2ccccc2NC(=O)C(=O)NNC(=O)CCc2ccccc2)n1	764184650	AXJQJYPYLDRWBM-UHFFFAOYSA-N	449.467	1.768	50	20	IDGD	
CC(C)CCC(=O)NNC(=O)C(=O)Nc1ccc(S(=O)(=O)/N=C2\CCCN2C)cc1	764203818	XZSIKALDRGBKDZ-XQNSMLJCSA-N	437.522	1.022	50	20	IDGD	
CCNC(=O)COc1cccc(NC(=O)C(=O)NNC(=O)c2cccc3ncccc23)c1	764258354	ZXAANKHFKWFSHL-UHFFFAOYSA-N	435.440	1.149	50	20	IDGD	
CS(=O)(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)CCc2ccccc2O)c1	764288094	DLYUMEAKWKIIIZ-UHFFFAOYSA-N	439.877	1.168	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)C(=O)Nc2cccc3c2CCN3C(=O)OC(C)(C)C)cn1	764359520	USVBDZULCFLAHZ-UHFFFAOYSA-N	428.449	1.117	50	20	IDGD	
CC(C)(C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)COCc2ccccc2)cc1	764366408	LHOBFRLUJVCCEA-UHFFFAOYSA-N	426.473	1.518	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2cnc(Cl)c(C)c2)n[nH]1	764376807	ICWMRGDZEQBGBH-UHFFFAOYSA-N	428.836	1.842	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc(F)c(F)c3)n[nH]2)cc1OC	764379474	YRPMHCQKGKZQLV-UHFFFAOYSA-N	445.382	1.772	50	20	IDGD	
Cc1nc(-c2cccc(NC(=O)C(=O)NNC(=O)CSc3ccccc3O)c2)n[nH]1	764393537	HFIQLTNVZZXHDO-UHFFFAOYSA-N	426.458	1.364	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(Sc2nc(C)cs2)cc1	764401917	ZKURHQVVCBPJRJ-GFCCVEGCSA-N	438.531	1.740	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COCCO1)C(=O)Nc1ccc(Sc2ccccc2)c(Cl)c1	764433857	OGZARIHODKNRNP-HNNXBMFYSA-N	435.889	1.993	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)CNC(=O)NCc2ccc(F)cc2)n[nH]1	765593241	VGSJRJHOSYHEIW-UHFFFAOYSA-N	440.435	1.485	50	20	IDGD	
Cc1cc(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)ccc1C#N	766551176	DTPVZCBMBFQBOI-UHFFFAOYSA-N	448.526	1.275	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1ccccc1COC1CCOCC1	767956795	BFKJQYICXKRNSD-UHFFFAOYSA-N	439.516	1.850	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)C(=O)Nc1cnn(C(F)F)c1	768238655	SGEIBQZYMIYMLA-MRVPVSSYSA-N	446.208	1.594	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)c1cc(S(=O)(=O)N(C)C)ccc1O	768358928	HQNBCGCVXGMFEP-UHFFFAOYSA-N	439.515	1.204	50	20	IDGD	
C[C@@]1(c2cccc(C(=O)NNc3nc(Br)cn4ccnc34)c2)NC(=O)NC1=O	769165411	ACULDLMJLDOKMH-KRWDZBQOSA-N	444.249	1.303	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(C)(C)N1C(=O)c2ccccc2C1=O	769727475	LTQXKWUVDUWSQI-UHFFFAOYSA-N	425.441	1.686	50	20	IDGD	
C[C@]1(c2ccc(F)c(Cl)c2)NC(=O)N(CC(=O)NNC(=O)c2ccc(C#N)cc2)C1=O	770229870	XUNBQOUUVNRBRA-HXUWFJFHSA-N	443.822	1.579	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1ccc(S(=O)(=O)N2CCCC[C@H]2C)cc1	771939424	OPYJJTYYDMNOEC-KGLIPLIRSA-N	425.507	1.352	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)NCCNS(=O)(=O)c1cc(C)sc1C	771981629	ORCFRANUBMRLGD-UHFFFAOYSA-N	426.520	1.296	50	20	IDGD	
Cc1ncc(CCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)s1	772631005	LEGZCZSDCJDIQQ-UHFFFAOYSA-N	437.547	1.423	50	20	IDGD	
O=C(C[C@H](O)c1ccc(Cl)cc1)NNc1ccccc1S(=O)(=O)N1CCOCC1	772733725	DMJHYXDIFVHPAQ-KRWDZBQOSA-N	439.921	1.928	50	20	IDGD	
CC(=O)NCCc1ccc(S(=O)(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)s1	773251656	NUUVURWZORBSEP-NSHDSACASA-N	445.950	1.857	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNS(=O)(=O)c1cnn(C2CCOCC2)c1	773251778	NVSOZJYYSSCIQY-GFCCVEGCSA-N	428.898	1.665	50	20	IDGD	
CS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNc2ccccc2[N+](=O)[O-])cc1Cl	773648275	RZCZNNYVQXJKNW-UHFFFAOYSA-N	427.826	1.702	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)NCC(=O)NNc2ncc(Cl)cc2Cl)cc1	775263745	IBEDESFGAFPNBI-UHFFFAOYSA-N	447.300	1.987	50	20	IDGD	
CN(NC(=O)c1ccc(-c2nc[nH]n2)cc1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776200783	AJFZPDMBSZIXSK-UHFFFAOYSA-N	429.481	1.721	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)[C@H]1[C@@H](C)OC(C)(C)N1C(=O)OC(C)(C)C	776476344	HIPXBLAKSXBUJU-VNHYZAJKSA-N	429.514	1.872	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)/C(=C\c2ccccc2)NC(C)=O)cc1OC	776716611	FVLOZGHFHKRRSU-GZTJUZNOSA-N	441.440	1.185	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)c2c(C)nn(C)c2-n2cc(C)cn2)cc1	777422302	VRVFDKQKPHSPSA-OAHLLOKOSA-N	426.477	1.850	50	20	IDGD	
COc1cc(OC)cc(N2CC[C@H](N(C)CC(=O)NNC(=O)c3ccccc3)C2=O)c1	777617072	YUXOXXGTUHTVMM-IBGZPJMESA-N	426.473	1.202	50	20	IDGD	
Cc1csc([C@](O)(CC(=O)NNC(=O)CNC(=O)OC(C)(C)C)C(F)(F)F)n1	778434257	XAFMHFBHTXBZEY-CQSZACIVSA-N	426.417	1.264	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(C(=O)NNC(=O)CCSc2ccc(F)cc2)n(C)c1	778538703	PYBXPCNICUVOLW-UHFFFAOYSA-N	428.511	1.358	50	20	IDGD	
COc1cc(OC)c(NC(=O)C(=O)NNc2ccc(Cl)nn2)cc1Br	778697056	GLHNBPUXQFEKHP-UHFFFAOYSA-N	430.646	1.992	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)[C@H](O)[C@H](O)c1nc2ccccc2s1	779539215	BZKGTAJSVCXWKY-CABCVRRESA-N	438.506	1.143	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)[C@H]1CCCOC1	780859834	LDRVCKHQODLRTE-RDJZCZTQSA-N	438.550	1.620	50	20	IDGD	
CCNC(=O)COC(=O)/C(C#N)=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	782181548	UXMKQFICDKHFOK-ZROIWOOFSA-N	429.864	1.665	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccc(OC(C)C)cc2)nc1	783263669	IUCTZZQYXAKNLC-UHFFFAOYSA-N	435.506	1.637	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2cc(C)cc(C)c2)cc1S(=O)(=O)NC1CC1	783362156	MCMJNEQXZCABFK-UHFFFAOYSA-N	432.502	1.835	50	20	IDGD	
Cc1ccccc1NC(=O)NNC(=O)C(=O)Nc1ccc(C)c(S(=O)(=O)N(C)C)c1	783415404	BSEOLLBKYMMLRI-UHFFFAOYSA-N	433.490	1.345	50	20	IDGD	
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)NNC(=O)c1cc(Br)c[nH]1	783808441	YSHQMWSGHKRHLD-UHFFFAOYSA-N	447.223	1.095	50	20	IDGD	
Cc1cc(S(C)(=O)=O)ccc1NC(=O)C(=O)NNc1ccc(Br)cn1	784339631	OUPOJLZCEKTIMG-UHFFFAOYSA-N	427.280	1.638	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)C(=O)Nc1cccc(-c2n[nH]c(C3CC3)n2)c1	785059881	CNZHCEUAZTYAHP-UHFFFAOYSA-N	444.455	1.325	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=S)N[C@H](C)Cc2ccccc2)cc1	786056950	CUAXXRGKXPTFQO-MRXNPFEDSA-N	434.587	1.742	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1N1CCNC1=O	786356161	AQSFHVQABBLVDD-UHFFFAOYSA-N	435.444	1.238	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2ccn(C3CCN(C)CC3)n2)c2ccccc2c1=O	786700718	VRAWMHHQHMSDMB-UHFFFAOYSA-N	438.492	1.346	50	20	IDGD	
Cc1csc(C(=O)N([C@@H]2CCS(=O)(=O)C2)N(C)C)c1I	787889812	MHKXRQWDFVUYEX-SECBINFHSA-N	428.317	1.767	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)Nc1ccc(Cl)c(S(C)(=O)=O)c1	788310617	YOWYCIPYTFHXTQ-UHFFFAOYSA-N	427.866	1.984	50	20	IDGD	
COc1ccc(OC)c(C2=NO[C@@H](C(=O)NNC(=O)CSc3ccccc3O)C2)c1	792286158	IULPUJYEJRDANB-QGZVFWFLSA-N	431.470	1.842	50	20	IDGD	
C[C@H](C(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)[C@@H]1OCCc2sccc21	796496797	YVCZKWXSXZHONY-GTNSWQLSSA-N	433.442	1.911	50	20	IDGD	
CC(C)Oc1ccc(NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)cc1C(N)=O	796998244	CQDMKIRVUOSVNF-UHFFFAOYSA-N	434.836	1.331	50	20	IDGD	
CS(=O)(=O)CCc1ccc(NC(=O)NNC(=O)CNC(=O)OCc2ccccc2)cc1	797636669	GJKNKQLCLSWZKW-UHFFFAOYSA-N	448.501	1.353	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@@H]1CC(C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)=NO1	798986335	MYDQAQINCBBSHP-ZDUSSCGKSA-N	446.439	1.646	50	20	IDGD	
C[C@@H]1C[C@@H](C)CN(S(=O)(=O)c2cccc(C(=O)NNC(=O)N=c3cc[nH]cc3)c2)C1	802030295	YDQLLCZTVKQDDE-HUUCEWRRSA-N	431.518	1.637	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)[C@@H]1CS[C@]2(c3ccc(F)cc3)CCC(=O)N12	804954080	GOFJYYWAARCSJF-YWZLYKJASA-N	439.476	1.835	50	20	IDGD	
CCOC(=O)C(C)(C)c1csc(NC(=O)C(=O)NNC(=O)COc2ccc(C)cc2)n1	806974336	FTEPRZLPNXRUBT-UHFFFAOYSA-N	448.501	1.457	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cccc(C)n2)c(C)cc1Br	807069974	IDZROCNRKABCLG-UHFFFAOYSA-N	449.261	1.647	50	20	IDGD	
C[C@H]1[C@H](NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)CCN1Cc1ccccc1	807619978	CXXRVLIGWBYGQV-FXAWDEMLSA-N	437.548	1.686	50	20	IDGD	
CN(C)c1c(C=NNC(=O)CSc2nc3ccccc3s2)c(=O)n(C)c(=O)n1C	807950361	SZSAVAUALZLUEN-UHFFFAOYSA-N	432.531	1.002	50	20	IDGD	
CC(=NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)c1ccc(N2C(=O)CCC2=O)cc1	814213242	DGHOPWBAYSNKHA-UHFFFAOYSA-N	442.497	1.744	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)c2c[nH]c(C(=O)OC)c2)c2ccccc2c1=O	814220113	WQQSUZNPHPPGFQ-UHFFFAOYSA-N	425.445	1.776	50	20	IDGD	
CCOC(=O)c1cc(COC)cc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCC3)c1	815566643	ZXYOAQMFQVMIQU-UHFFFAOYSA-N	445.497	1.960	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1cc(-c2ccsc2)nn1C	815751592	FTWGHQMLMDRTLX-UHFFFAOYSA-N	448.530	1.481	50	20	IDGD	
Cc1nnnn1/C(=C/c1cccc(F)c1)C(=O)OCC(=O)NNC(=O)c1cccs1	818194736	LHYPSBTYICKSMZ-NTEUORMPSA-N	430.421	1.185	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc2oc(SCC(=O)NNC(=O)c3cccs3)nc2c1	849120415	SBUGETGWKPTQHZ-UHFFFAOYSA-N	440.528	1.693	50	20	IDGD	
CC(C)n1ncc2cc(/C=C\C(=O)NNC(=O)c3nnc(O)c4ccccc34)c(=O)[nH]c21	891640951	VIXROXCKKKWHQR-FPLPWBNLSA-N	433.428	1.429	50	20	IDGD	
CON=Cc1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)cc1	912642959	SFMRBRBJTWGVAK-UHFFFAOYSA-N	444.513	1.916	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1cccnc1N1CCCC1	913268897	LTXUZFCOWRYFRG-UHFFFAOYSA-N	432.864	1.962	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(Cl)cc1)NNC(=O)C12CC3CC(CC(C3)C1)C2	913489412	ODCGVISUHWJQBS-UHFFFAOYSA-N	425.938	1.982	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)[C@H]2CCCCN2S(=O)(=O)c2cccs2)cc1	915685018	JYMMBRAWWVCWTG-MRXNPFEDSA-N	448.526	1.389	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NCCc2cnn(-c3ccccc3)c2)c2ccccc2c1=O	916244855	BVDYVPXTWVFZQH-UHFFFAOYSA-N	431.456	1.306	50	20	IDGD	
O=C(O)COc1ccc(C=NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc1	916320809	KQNKULVFZUWPAL-UHFFFAOYSA-N	431.470	1.698	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@H]2CCC[C@H]23)cc1	916585280	WIVWIYMLVWFLRO-VINWQNLFSA-N	434.562	1.771	50	20	IDGD	
O=C(NCc1ccc(S(=O)(=O)N2CCCC2)cc1)NNC(=O)c1cccc([N+](=O)[O-])c1	916648165	YSGFZTXACVZCMM-UHFFFAOYSA-N	447.473	1.524	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2nc(N3CCCC3)ncc2Cl)c2ccccc2c1=O	916723195	WZIRWVUAVVWIHC-UHFFFAOYSA-N	441.879	1.535	50	20	IDGD	
O=C(NNC(=O)C(=O)NC1CC1)NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1	918099329	WSYKNMNWRLGAGD-UHFFFAOYSA-N	427.427	1.279	50	20	IDGD	
C[C@@H](Sc1cc(Cl)ccc1Cl)C(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1	919885050	JOKYVZQNSHBDQB-SCZZXKLOSA-N	426.347	1.992	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NC[C@@H]2CCN(c3ccc(F)cc3)C2)c2ccccc2c1=O	920047090	FTRNFRCAXADZTE-AWEZNQCLSA-N	438.463	1.543	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)c2ccc(N3NC(=O)CCC3=O)cc2)cc1OC	920288135	ONQBGVCVDPRHLT-UHFFFAOYSA-N	440.456	1.717	50	20	IDGD	
N#C/C(=C\c1cn(CCC(N)=O)nc1-c1ccc(Br)cc1)C(=O)NCCO	920847405	DEFXTBCGPOPRIK-UKTHLTGXSA-N	432.278	1.203	50	20	IDGD	
O=C(NC[C@H](c1cccc(F)c1)N1CCOCC1)NNC(=O)[C@@H]1COc2ccccc2O1	921199319	GOVWLMHEMMSNRA-XLIONFOSSA-N	444.463	1.369	50	20	IDGD	
COc1nc(C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc2ccccc12	921302126	RERKPISGAXFNOP-UHFFFAOYSA-N	442.497	1.634	50	20	IDGD	
CNS(=O)(=O)c1ccc(Br)c(C(=O)NNC(=O)c2ccc(C)cc2O)c1	1317928704	QSJHGHMQYKNPLJ-UHFFFAOYSA-N	442.291	1.446	50	20	IDGD	
C[C@@H]([C@@H](C)NC(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1)N1CCOCC1	1318971780	DHPKVLBLVPAGGF-CABCVRRESA-N	427.546	1.073	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)NCCC(=O)N2CCCCC2)CC1	1319584284	UMKUUHUWPVQIHQ-UHFFFAOYSA-N	425.530	1.367	50	20	IDGD	
CNS(=O)(=O)c1ccc(CC(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)cc1	1325400557	JCPCAANEBNKSEM-UHFFFAOYSA-N	433.458	1.277	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)NCCCOC[C@@H]2CCOC2)CC1	1329253746	SQWXKHUHVCKYCD-HNNXBMFYSA-N	428.530	1.407	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N[C@@H]2CCN(Cc3ccc(OC)cc3OC)C2=O)cc1	1346670621	QUWRSJUESYYMFD-GOSISDBHSA-N	442.472	1.458	50	20	IDGD	
C[C@H](Nc1ccccn1)C(=O)N1CC[C@@]2(CN(C(=O)[C@@H](F)Br)CCO2)C1	1779328188	DAZSVIMPNYZIMN-QEORTHHSSA-N	429.290	1.402	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccn(C(F)F)n3)C2)C1	1779613639	JGNBLMFPWFSISU-BZNIZROVSA-N	435.269	1.753	50	20	IDGD	
COc1ccnc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)c1OC	1780451548	SNSZMSNZJDZSMA-KPZWWZAWSA-N	442.310	1.326	50	20	IDGD	
CN1CCC[C@@H](C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](F)Br)C3)C1	1780576129	ZRPAWZKUXSOLKC-ZXFNITATSA-N	434.350	1.533	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Br)C1)n1ccnc1	1780770415	NAADIMZLMLJKEZ-VWPFQQQWSA-N	431.306	1.649	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](CCN)NC(=O)OC(C)(C)C)CCO2	1781213929	VYQLQRGZCACNCR-SXGZJXTBSA-N	446.976	1.076	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)[C@@H]3Cc4ccccc4CN3)CCO2)C1	1781227483	MJFFZSARQWGEQY-IOMROCGXSA-N	440.371	1.767	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1	1782009585	WZTYHYYYHYLGPQ-BMLIUANNSA-N	447.713	1.978	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1csc(C)n1)C2	1782170902	FGHKFUVFIMRWER-GPMSIDNRSA-N	429.970	1.762	50	20	IDGD	
C[C@H](N[C@H](C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2)C1CC1)c1ccccc1	1782887489	JMKXIDLTCSSZKD-ZPDADZDASA-N	449.979	1.545	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ncc(Cl)cn3)CCO2)C1	1783343373	HLKWKXNTTKFJOW-MLGOLLRUSA-N	431.718	1.747	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cc(=O)ccn3C)CCO2)C1	1783352074	MYNXBBROCMFIGY-KBXCAEBGSA-N	426.311	1.002	50	20	IDGD	
COc1cncc(CCC(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](C)Br)C3)C2)c1	1783529970	PZNCSHUZMOQJOV-AUUYWEPGSA-N	440.338	1.636	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cnn(C(C)(C)C)c3Cl)CCO2)C1	1783873522	QEYHTOYNMIUQNC-LIRRHRJNSA-N	447.363	1.989	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(F)cn3C)C[C@@H]21	1783965381	KMJROUCADOBVIR-DSPQJCBJSA-N	430.318	1.789	50	20	IDGD	
COc1ccc([C@@H]2C[C@@H]2C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]3C2)cc1	1784085048	BQAQQPSXKQSMSH-ZXIXUEFNSA-N	436.936	1.378	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H]3CCc4nc[nH]c4C3)C2)C1	1784353078	WTAIHMGWPCWPDN-VMDGZTHMSA-N	429.348	1.581	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccnn3CCOC)C[C@@H]21	1784618442	PFBBKCUQAXFQAZ-OVWQWFNUSA-N	426.945	1.530	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(N4C(=O)C=CC4=O)cc3)C2)C1	1785222391	BBBFINOGHQDMSQ-VGSWGCGISA-N	445.903	1.577	50	20	IDGD	
CCC[C@H](NC(C)=O)C(=O)N1CC[C@]2(CN(C(=O)[C@H](C)CBr)CCO2)C1	1785441040	YZVUISHVQGKVHR-QIIPPGSGSA-N	432.359	1.152	50	20	IDGD	
CC[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]21)c1ccccc1	1786364460	YIYGFGJVDSSVOL-TUFLPTIASA-N	444.576	1.533	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC1(c2ccc(NC(=O)c3cnc(N(C)C)o3)cc2)CCC1	1787262876	ZMGVSCWCTOYLLB-UHFFFAOYSA-N	442.520	1.861	50	20	IDGD	
Cc1cc(O)c([N+](=O)[O-])cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]2C1	1787449857	NBWJSLQSEBSFOV-UDNPPVAFSA-N	429.832	1.737	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc4cc[nH]c34)[C@H]2C1	1788073256	WCOALPSQTZUQSF-WDSOQIARSA-N	441.532	1.134	50	20	IDGD	
Cc1nc(C)c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)CBr)C[C@@H]32)o1	1788918787	KGFVUPGENBPWHM-KJEVXHAQSA-N	428.327	1.916	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C(=C/c3ccco3)NC(C)=O)C[C@@H]21	1789866923	RNSOPHMROIGOEH-FQMHSQOMSA-N	437.924	1.754	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(=O)Nc3cccnc3)C[C@@H]21	1789870783	VWFGQYYXDYEUON-VFSPDHHESA-N	443.331	1.236	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccccc3O)C[C@@H]21)[C@H](F)Br	1789924921	HZDZQXGMZUUOON-HPZZRFSDSA-N	429.286	1.605	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)Cn3ccnc3)C[C@@H]21	1790964551	ZVKQQWOHAWEOPH-XAJHFOFHSA-N	441.370	1.672	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@](C)(O)C(F)(F)F)C[C@@H]21	1791055209	OFGWLOAOFZWLIJ-SEKJGCFDSA-N	431.249	1.063	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccnc3SC)C[C@@H]21	1791255380	PACOYFAGTNLZBX-TUUVXOQKSA-N	427.954	1.651	50	20	IDGD	
COc1ccc(COCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)C(Cl)Cl)C[C@@H]32)cc1	1791384637	KSOIAOYEOLZQJO-XIRDDKMYSA-N	445.343	1.995	50	20	IDGD	
O=C(NC1(c2ccc(NC(=O)C3CCC(O)CC3)cc2)CCC1)c1cccc(B(O)O)c1	1791705947	HIAAHVSMUWSEKC-UHFFFAOYSA-N	436.317	1.665	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCN3CCCC3)[C@H]2C1	1792311760	ZRNWQPHIEVMCLS-QAETUUGQSA-N	430.387	1.483	50	20	IDGD	
CC(C)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C1\C(=O)Nc3ccccc31)C2	1792783352	UUVOVYSRLJWYQB-LRKVGGNXSA-N	431.920	1.877	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccn3nccc13)C2	1792874367	NPKOEJBZSGFRHX-VWPFQQQWSA-N	435.322	1.569	50	20	IDGD	
COCCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](Br)Cc1ccccc1)C2	1795349549	NMOBFGUTJDWRGG-ZMMAXQRCSA-N	439.350	1.619	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ncn(-c3cccc(F)c3)n1)C2)[C@H](F)Cl	1796361960	SLOJRWLSZZXLRO-JLUCKKNBSA-N	425.823	1.144	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CC(=O)Nc1cc(C)on1	1796417678	BPGDPZXSEUDKRC-KYZVSKTDSA-N	426.901	1.309	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nccc3[nH]ccc13)C2	1800640072	UHDKAHCLPMGYMN-LMWOUKEDSA-N	435.322	1.940	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc3ccnn13)C2	1800643355	QYPISQYRXIVOEZ-YXPYIKCWSA-N	435.322	1.711	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)Cc1ccccc1)C2	1800644478	VTEIWGWCXDOCEY-CWQOZTLDSA-N	439.350	1.353	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)n1cccc1C=O	1803139339	XGNDVBURQFULEW-OPNNQBFTSA-N	432.908	1.562	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)C[C@@H]2CCCCO2)[C@H]1c1cccnc1	1804105227	YHCZGCWTUFRQKV-SELNLUPBSA-N	445.564	1.420	50	20	IDGD	
CC(C)N1CCC(C(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@H]2c2cccnc2)CC1	1804143076	ZNWKBFVYPAZNGI-ZCNNSNEGSA-N	436.984	1.808	50	20	IDGD	
O=C(Cc1cncnc1)NC[C@@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1	1804646780	IJVXLBOWIPBHCL-LPHOPBHVSA-N	432.322	1.905	50	20	IDGD	
O=C(c1ccc(O)c([N+](=O)[O-])c1)N1CCC2(CCCN(C(=O)[C@H](O)CCl)C2)CC1	1805527118	SETAQDPMJPHAID-MRXNPFEDSA-N	425.869	1.745	50	20	IDGD	
O=C(NCCC(=O)N1CCC2(CCCN(C(=O)[C@H](O)CCl)C2)CC1)c1ccccc1	1805529007	FJMJAALUXDGDOQ-GOSISDBHSA-N	435.952	1.637	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2cnc(OC)cn2)[C@H]1c1cccnc1	1806044899	COBBBZWJIOQDRG-RVKKMQEKSA-N	433.896	1.454	50	20	IDGD	
O=C(CCBr)NC[C@@H]1CCN(C(=O)Cc2ncccn2)[C@@H]1c1cccnc1	1806341767	HFPQBYUWTZVSKG-HNAYVOBHSA-N	432.322	1.905	50	20	IDGD	
CCc1cc(C(=O)NC[C@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)n[nH]1	1807776782	WYCSIYAZLBRVQR-IIBYNOLFSA-N	441.536	1.060	50	20	IDGD	
CC(C)=CCCC(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1807972342	GQCDSIALNRXMRW-NZQKXSOJSA-N	435.333	1.827	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC2(CCCN(C(=O)c3cccs3)C2)CC1	1808072257	ZDWQYWMWXPWCAJ-UHFFFAOYSA-N	427.530	1.905	50	20	IDGD	
O=C(CCc1ccccc1)N1CCCC2(CCN(C(=O)c3cccc(B(O)O)c3)CC2)C1	1809080388	HBNYXAIYSDAUGL-UHFFFAOYSA-N	434.345	1.844	50	20	IDGD	
COc1ccc(C(=O)NC[C@H]2CCN(C(=O)CCBr)[C@@H]2c2cccnc2)nn1	1811205215	HWZFCYAPRXQXIS-RDTXWAMCSA-N	448.321	1.985	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1)c1ccnnc1O	1811222534	MOJPWHBDSCOFMI-CJNGLKHVSA-N	434.294	1.682	50	20	IDGD	
Cc1ccn(C)c1C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1811607592	UJPGOOVNIKOLNW-KNQAVFIVSA-N	446.316	1.042	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)n2ccccc2=O)[C@@H]1c1cccnc1	1813031455	OCCKEZFKSWWGME-HGKSCXNLSA-N	446.935	1.764	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)CCS(C)(=O)=O)[C@H]1c1cccnc1	1813576007	AUCCBJQOOYULIX-DUVNUKRYSA-N	446.367	1.306	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1	1816727888	BGNMZTZBHYIFAE-NXEZZACHSA-N	426.882	1.429	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](N)Cc2cccnc2)n[nH]1	1818073709	YNYVPIBWFSVFDM-ZOBUZTSGSA-N	434.928	1.621	50	20	IDGD	
O=C(/C=N/O[C@@H]1CCCCO1)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](O)CCl)CC2	1819901402	VJHMSIQFFARGQT-QKUPEDJASA-N	430.914	1.184	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN2CCOCC2)[nH]n1	1820864222	SQQLCWOCWIUZKL-KSSFIOAISA-N	432.352	1.970	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(=O)n2O)[nH]n1)[C@@H](F)Br	1820931081	FTGHZKHOEIARHK-IINYFYTJSA-N	442.245	1.805	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(O)ccc2O)n[nH]1	1821320305	YOTDKWWCLMOOOD-MRXNPFEDSA-N	444.492	1.500	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H]2CCCS2(=O)=O)n[nH]1	1821835705	JUDLVENDQQJUDM-YUTCNCBUSA-N	432.930	1.233	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCN2CCOCC2)[nH]n1	1822369248	NRTFDRVVSSCKOB-ZBFHGGJFSA-N	427.933	1.378	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)C2CCC(O)CC2)[nH]n1	1822416518	GOCRBGJWJYIYJB-DQPZFDDXSA-N	434.541	1.326	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H]2CCOC2)n[nH]1	1822952870	XLRNTTOZMRSKHQ-WLTXSABTSA-N	441.492	1.572	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@]2(C)CC2(F)F)n[nH]1	1823399485	SBZORCPWVWBPLD-ACJLOTCBSA-N	426.468	1.820	50	20	IDGD	
Cc1ccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)nc1C	1825620009	MTCGTRNZAOOSGY-HSZRJFAPSA-N	449.360	1.925	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnn3ncccc13)CC2	1825997871	DELZFWCZFLXKJB-ZYHUDNBSSA-N	434.909	1.665	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)C(=O)Nc1cccnc1)CC2	1826000201	OGIPKNMKVJMSNA-ZYHUDNBSSA-N	437.909	1.343	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](C)n3cnnn3)sc2C1	1826984458	GCZCNLSKMAYLHI-BBBLOLIVSA-N	442.343	1.476	50	20	IDGD	
O=C(c1ccncc1O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827052324	VJRJALQCRAKFLT-FQEVSTJZSA-N	437.305	1.014	50	20	IDGD	
CC(=O)C[C@H](C)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827060525	NGCYKASSSWUJAY-HRAATJIYSA-N	428.338	1.215	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)CCc2cncnc2)CC1	1827135098	PZDGHXHSQORGEY-HXUWFJFHSA-N	444.580	1.402	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1	1827428679	BRFUMNBNSXJPMX-KRWDZBQOSA-N	447.536	1.099	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4ncnn4c3)C2)C1	1830362081	KOIZKWMCASMALW-HXUWFJFHSA-N	435.912	1.064	50	20	IDGD	
Nc1n[nH]c(CCC(=O)N2CCC([C@@H]3CCCCN3C(=O)[C@@H](F)Br)CC2)n1	1830383019	VCJMZIRIEQWESW-SWLSCSKDSA-N	445.337	1.630	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)COC3CCCCC3)CCO2)C1	1830383783	JLROMGWUHLICNW-XLIONFOSSA-N	432.945	1.046	50	20	IDGD	
CCNC(=S)NCC(=O)N1CCCC[C@H]1C1CCN(C(=O)CO[Si](C)(C)C)CC1	1831091828	NRFWCFAMBURKRX-KRWDZBQOSA-N	442.702	1.942	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)/C=N/O[C@H]3CCCCO3)C2)C1	1831650142	DPLHWZZDNSLMSC-HQNYPKAYSA-N	445.944	1.379	50	20	IDGD	
CCNC(=S)NCC(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](C)Br)CC1	1831655765	AOQSIPYYYJLUBN-HIFRSBDPSA-N	447.443	1.874	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ncc(F)cc3F)CCO2)C1	1831968539	WUHOZEDJJXTLIK-APPDUMDISA-N	448.264	1.213	50	20	IDGD	
CC(C)(C)OC(=O)CC(=O)N1CCO[C@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1	1831989967	BSDFUNZUXMAWPH-HXUWFJFHSA-N	444.601	1.026	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cnnc(Cl)c1)CCO2	1833209261	AWGSVTWSXSZVHA-GOSISDBHSA-N	442.976	1.052	50	20	IDGD	
C[C@@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)c3csnn3)CC2)CC1	1833265334	UCDBYAFADYKODA-LBPRGKRZSA-N	444.399	1.754	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)Cc3ccc(F)cc3F)CC2)CC1)[C@@H](O)CCl	1833312576	YHPGSZNUVMKQCX-IBGZPJMESA-N	443.922	1.679	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCC(N2CCC(NC(=O)c3csnn3)CC2)CC1	1833558593	QLQAZYKREVISHK-QGZVFWFLSA-N	434.393	1.960	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cncc(F)c3)CCO2)C1	1834352657	HPUHHXPXWDOFGC-ACJLOTCBSA-N	444.301	1.322	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)nc1	1834378676	SUVRHKOJIDYSFM-RDTXWAMCSA-N	426.311	1.243	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)c3cncc(F)c3)C2)C1	1834819186	JROSIZMPUSXURL-QGZVFWFLSA-N	430.274	1.076	50	20	IDGD	
CC[C@H](C(=O)N1CCOC[C@]2(CN(C(=O)CCBr)CCO2)C1)N(CC)CC	1834819783	UXSJQERDFQRZHJ-APWZRJJASA-N	448.402	1.348	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)CC1CCOCC1)CCO2	1835422220	RVECQIUQDLHVRF-FQEVSTJZSA-N	428.602	1.111	50	20	IDGD	
O=C(/C=C\C(=O)NC1CCN(C2CCN(C(=O)C(Cl)Cl)CC2)CC1)NC1CC1	1835661056	VUVWWGPOHSRMFZ-ARJAWSKDSA-N	431.364	1.197	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC(OC2CCN(C(=O)Cn3nccn3)CC2)CC1	1836673159	JSYLCCNQBREHQF-AWEZNQCLSA-N	442.358	1.308	50	20	IDGD	
O=C(CCBr)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836716624	GSDGFVNXSAREBN-AWEZNQCLSA-N	425.751	1.370	50	20	IDGD	
C[C@@H](C(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1)n1ccccc1=O	1836717617	ZCAXVVZBAAORJM-MAUKXSAKSA-N	439.940	1.008	50	20	IDGD	
C[C@H](Cc1ccco1)C(=O)N1CCOC[C@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1837717696	MCSSHXGWHWMSCT-UTKZUKDTSA-N	438.597	1.766	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)CCN3CCOCC3)CC2)CC1	1837815333	ABJDZOISYARMRN-IBGZPJMESA-N	429.989	1.725	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)[C@H]3C[C@@]3(F)Cl)CC2)CC1	1838789699	UATVDJSIOHNAFX-UZLBHIALSA-N	446.951	1.283	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3nccc(OC)c3OC)C2)C1	1839145683	CJXOQOCBMKTWFJ-VBKZILBWSA-N	441.912	1.186	50	20	IDGD	
Cc1cc(/C=C/C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)no1	1839200384	JPJNQDDYGSHOGZ-QGBYBWSUSA-N	446.273	1.143	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccncc3F)C2)C1	1839964243	KXANVHQQHASUSL-KSSFIOAISA-N	444.301	1.464	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cncc(F)c3)C2)C1	1840031300	LOKJBFNQVOASGH-YVEFUNNKSA-N	430.274	1.074	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@H](O)[C@H](C(=O)N2CC3(CCCN3C(=O)C(C)(C)CCl)C2)C1	1841226746	CBCOCRHGNGAJFB-HUUCEWRRSA-N	443.972	1.683	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CC[C@H](C(=O)N2CC3(CCCN3C(=O)[C@@H](O)CCl)C2)C1	1841347638	AOKUMNGUXFTKML-ZNMIVQPWSA-N	429.945	1.483	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](C(=O)N2CC3(CCCN3C(=O)[C@H](F)Cl)C2)[C@H](O)C1	1843361674	HPTPKSHXVGGTJD-MJBXVCDLSA-N	433.908	1.342	50	20	IDGD	
O=C(/C=C/C(=O)N1CCCC12CN(C(=O)[C@@H](F)Br)C2)NCc1ccco1	1844344668	VYSMFZSNVZFPKM-MBVDDHJVSA-N	428.258	1.346	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)c2ccc3c(Cl)ccnc3c2)C1	1845584797	MUNSLOZCKREHGU-UHFFFAOYSA-N	449.703	1.699	50	20	IDGD	
C[C@@H](C(=O)N1CC2(CCCN2C(=O)/C(C#N)=C/c2ccc(F)cc2F)C1)n1cnnn1	1845871972	LJVIDHDFPXMRMV-FEZXJWFHSA-N	427.415	1.323	50	20	IDGD	
Cc1cccc(C(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)c1Cl	1846811165	CAOSFWKPBCVVQU-UHFFFAOYSA-N	427.892	1.778	50	20	IDGD	
CC(C)C[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)[C@@H](O)CCl)C2	1847087569	YOZYVDQEKCLUAO-GJZGRUSLSA-N	431.961	1.729	50	20	IDGD	
CN(CC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)C1=CCCS1)NC(=O)NCc1ccccc1	1847846393	QJAKROGFAUEADT-ROUUACIJSA-N	443.573	1.555	50	20	IDGD	
CNc1ccc(C(=O)OCC(=O)NNC(=O)c2cc(Cl)ccc2OC)cc1[N+](=O)[O-]	9924233	QQLFJTJVJHRFOQ-UHFFFAOYSA-N	436.808	1.917	50	20	IDGD	
Cc1nc2c3ccccc3nn2c(C)c1CCC(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1	10301989	LGCRZMNZESGMTE-AWEZNQCLSA-N	429.502	1.014	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)CCCN3S(C)(=O)=O)cc1	15025172	YAYOIUOAIVHRKE-UHFFFAOYSA-N	430.486	1.107	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)CCn2c(=S)[nH]c3ccccc3c2=O)c1	17060664	TXJRTVXCQJXPGO-UHFFFAOYSA-N	428.470	1.928	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cc(Br)c[nH]2)cc1OC	28176928	UWUJFAVGIXFYIV-UHFFFAOYSA-N	426.223	1.412	50	20	IDGD	
O=C(CCNS(=O)(=O)c1cccc(Cl)c1)NNC(=O)c1ccc2c(c1)OCCO2	105282724	AGSULQVVVNJABB-UHFFFAOYSA-N	439.877	1.241	50	20	IDGD	
O=C(NNC(=O)c1ccc(Br)s1)NC1CCN(C[C@@H]2CCOC2)CC1	303658304	AMDACORUTZSGHZ-NSHDSACASA-N	431.356	1.956	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@H]2CSCN2C(=O)CC(C)(C)C)cc(OC)c1OC	727752811	JYTIUMKSCUFPRT-CYBMUJFWSA-N	439.534	1.811	50	20	IDGD	
O=C(COC(=O)c1cccn1Cc1cccs1)NNC(=O)[C@@H]1COc2ccccc2O1	728331753	MDUZHXXHLZIHKW-SFHVURJKSA-N	441.465	1.742	50	20	IDGD	
NC(=O)c1ccc(SCC(=O)NNC(=O)c2cccc(OC(F)F)c2)c([N+](=O)[O-])c1	728488919	UWURSOLGPFZGBJ-UHFFFAOYSA-N	440.384	1.848	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)c1cnn[nH]1	729456141	SJJQIHNGRVUIEQ-UHFFFAOYSA-N	427.343	1.409	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CN2CCC[C@@H](NS(=O)(=O)c3cccc(F)c3)C2)cc1	729482086	KJVYIUAKYXYKLW-GOSISDBHSA-N	448.520	1.338	50	20	IDGD	
CN(C)c1ccc(NC(=S)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)o2)cc1	729691444	XQUNZHCXUUMOPB-UHFFFAOYSA-N	437.547	1.762	50	20	IDGD	
O=C(NNc1nc(-c2cccnc2)no1)[C@H]1CCCN(S(=O)(=O)Cc2ccccc2)C1	730588937	MSVQVJNDEUHTIK-KRWDZBQOSA-N	442.501	1.817	50	20	IDGD	
COCc1cc(CNC(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)ccc1F	730906924	QRQDRULQFAMLRK-UHFFFAOYSA-N	425.486	1.880	50	20	IDGD	
CCS(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=O)CNC(=O)c2cccs2)c1	731461454	WDBBHCRTEOCLSQ-UHFFFAOYSA-N	429.907	1.386	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cc(C(N)=O)n(-c3ccccc3)n2)cc(OC)c1OC	731892819	VZBRPYGNPMUTPB-UHFFFAOYSA-N	439.428	1.072	50	20	IDGD	
Cn1c(NNC(=O)c2nccnc2C(=O)NCc2ccc(F)cc2)nc2ccccc2c1=O	733260580	ILJBRLREUUITDJ-UHFFFAOYSA-N	447.430	1.550	50	20	IDGD	
Cc1nn(CCCl)c(C)c1C(=O)N1CCN(S(=O)(=O)c2ccc(C#N)cc2)CC1	733888240	RJUNNLFXWNGASC-UHFFFAOYSA-N	435.937	1.757	50	20	IDGD	
COc1ccc([C@H]2[C@H](C(=O)NNC(=O)COc3ccccc3OC)CCC(=O)N2C)cc1	734417680	IQLOKUSPUVLKNG-VGSWGCGISA-N	441.484	1.840	50	20	IDGD	
Cc1cc(S(=O)(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)cnc1Cl	735265637	LIVFXMOUYRDVPM-UHFFFAOYSA-N	435.893	1.958	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)[C@@H]1CS[C@@H](Cc2ccccc2F)C(=O)N1	737923140	LZBXJCYVEITYNC-ROUUACIJSA-N	431.489	1.333	50	20	IDGD	
Cc1cc(N2CCCS2(=O)=O)ccc1C(=O)NNC(=O)Cn1ccc2ccccc21	741559310	KHMSOKLVHPMYCJ-UHFFFAOYSA-N	426.498	1.951	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cccc(-c3cnn(C)c3)c2)c1	741659081	BEXIOJJZVOFXAI-UHFFFAOYSA-N	427.486	1.412	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H](c2ccccc2F)N2CCOCC2)c1	742535097	NIFJRRDOZQOYGX-SFHVURJKSA-N	435.477	1.064	50	20	IDGD	
Cc1nn(C)c(C)c1S(=O)(=O)N[C@@H](C)C(=O)NNc1ccc(Br)nc1	743405303	GRVCQGXDCNGGDB-VIFPVBQESA-N	431.316	1.005	50	20	IDGD	
CC(=O)Nc1ccccc1CNC(=O)NNC(=O)c1sc(N2CCOCC2)nc1C	743509637	IVIJDVLLPJAXCS-UHFFFAOYSA-N	432.506	1.391	50	20	IDGD	
CN(C)C(=O)CCN1CCC(NC(=O)NNC(=O)Nc2ccc(OC(F)F)cc2)CC1	743599729	WUXRQOBWQQZCLO-UHFFFAOYSA-N	442.467	1.566	50	20	IDGD	
C[C@H](NC(=O)c1ccc(Cl)cc1)C(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	743829461	QOPWJAKVWXYMBO-NSHDSACASA-N	438.893	1.715	50	20	IDGD	
CCCS(=O)(=O)Nc1cccc(C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)c1	744545676	DYLMPNOAXBMWTE-UHFFFAOYSA-N	444.469	1.328	50	20	IDGD	
C[C@H]1CN(c2ccc(C(=O)OCC(=O)NNC(=O)c3cccc(C#N)c3)cn2)C[C@@H](C)O1	744714102	APFFHTDKIXJCJI-GASCZTMLSA-N	437.456	1.185	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)CCC(=O)N2CCc3sccc3C2)c1	744836396	KXVWTEXGMGGEBE-UHFFFAOYSA-N	429.498	1.726	50	20	IDGD	
O=C(COC(=O)[C@@H]1SCCc2ccccc21)NNC(=O)[C@@H]1COc2ccccc2O1	745472210	GYWRVHSZAMXCDU-PKOBYXMFSA-N	428.466	1.548	50	20	IDGD	
CO[C@@H](CNC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1)C(C)C	745928539	PSDPHPULJUMFFC-IBGZPJMESA-N	448.545	1.780	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@H](C(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)C1	746272517	UFPXNJYOURKITR-UONOGXRCSA-N	426.514	1.696	50	20	IDGD	
CC(C)CN1CCC[C@@H](CNC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)C1	746328883	WCSVMLWQJRPASR-NRFANRHFSA-N	444.624	1.897	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@@H](C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)C1	746332849	QHGGARYGCOXWPJ-HUUCEWRRSA-N	425.507	1.130	50	20	IDGD	
COc1ccc(CCN2C[C@@H](C(=O)NNC(=O)c3ccc(C#N)cc3)CC2=O)cc1OC	747175790	LNSRIXVHLWAZDD-SFHVURJKSA-N	436.468	1.428	50	20	IDGD	
Cn1ccnc1[C@@](O)(CC(=O)NNc1nc(Br)cn2ccnc12)C(F)(F)F	750248366	MQPSRNAYVWGUIJ-ZDUSSCGKSA-N	448.203	1.509	50	20	IDGD	
CC(C)Nc1ccc(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)cn1	752798730	ZNLVIHUZNKLWAR-UHFFFAOYSA-N	432.550	1.595	50	20	IDGD	
CS(=O)(=O)NCc1ccc(C(=O)NNC(=O)c2ccc(COc3ccccc3)o2)o1	753564795	HAKBJTOTPAPTTE-UHFFFAOYSA-N	433.442	1.576	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)NC[C@H]1CCN(S(C)(=O)=O)C1	753660552	MEPFEYOIRQNGLJ-LSDHHAIUSA-N	434.518	1.219	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(O)c([N+](=O)[O-])c2)c1	754826795	ALQKYCXVUHIFMJ-UHFFFAOYSA-N	436.446	1.406	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N2CCOCC2)cc1NC(=O)NNC(=O)C1CCCC1	755443273	YVCFQHSSXJUPTP-UHFFFAOYSA-N	440.522	1.449	50	20	IDGD	
COc1ccc(C(=O)N2CCN(C)CC2)cc1NC(=O)NNC(=O)c1cccc(C#N)c1	756246626	FBJGXSGAMJJAEA-UHFFFAOYSA-N	436.472	1.421	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)Nc1cnn(CC(=O)N2C[C@H](C)O[C@H](C)C2)c1)c1ccccc1	756839712	SCQOTNMQKLEZFK-JTDSTZFVSA-N	442.520	1.865	50	20	IDGD	
COc1ccccc1NC(=S)NNC(=O)CN1C(=O)NC2(C[C@H](C)C[C@@H](C)C2)C1=O	757635839	ZSVNEVXHBZENKZ-CHWSQXEVSA-N	433.534	1.760	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)COCc2ccccc2)ccc1S(=O)(=O)N(C)C	757775797	KWQNZIYZEKYUAM-UHFFFAOYSA-N	436.490	1.315	50	20	IDGD	
COCCCS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2c(C)nc3ccccn23)cc1	757821505	BTWDNWFWLHDFCC-UHFFFAOYSA-N	445.501	1.919	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cnc1Br	757997335	KPEGUAATADXVAB-UHFFFAOYSA-N	431.250	1.866	50	20	IDGD	
Cc1c(C(=O)NNC(=O)C(=O)Nc2ccccn2)cnn1-c1cccc(Br)c1	758827787	NGOOAUAPJMNGOV-UHFFFAOYSA-N	443.261	1.738	50	20	IDGD	
CS(=O)(=O)c1ccc(CNC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1Cl	759296081	AJBORYLSOXLNOF-HNNXBMFYSA-N	439.877	1.414	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)c1ccc(-c2nnc(S)o2)cc1	759380882	PCGAQQFZNXDAQZ-UHFFFAOYSA-N	432.487	1.393	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)c2cc(Br)cc(S(N)(=O)=O)c2C)nc1	759725344	LZGZUHWFGBRRIS-UHFFFAOYSA-N	443.279	1.343	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)cc2)C[C@@H](C)O1	763472528	WMVWBSPELYICJX-OKILXGFUSA-N	441.444	1.608	50	20	IDGD	
O=C(NNC(=O)c1ccccc1F)C(=O)Nc1cccc(Cn2nc3ccccn3c2=O)c1	763575453	VVNZXDSDMHETNN-UHFFFAOYSA-N	448.414	1.083	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)Nc1cc(F)c(N2CCCC2)c(F)c1	763576476	AUXOSWUHTACFIR-KRWDZBQOSA-N	446.410	1.491	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNC(=O)COc2ccc(C(C)(C)C)cc2)cn1C	763599185	BLWXPBSKWSEHLM-UHFFFAOYSA-N	444.488	1.664	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cn(-c3ccccc3)nc2-c2ccccc2)n(C)n1	763600305	FJWWLZXRWFMXSW-UHFFFAOYSA-N	443.467	1.981	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(C)nn1Cc1ccccc1	763656837	FXMVDCKQVYOKLM-UHFFFAOYSA-N	437.456	1.413	50	20	IDGD	
Cc1nc(CC(C)C)c(NC(=O)C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)s1	763790605	LEVLXWMFWYLGNM-UHFFFAOYSA-N	442.501	1.297	50	20	IDGD	
COc1ccc(Br)c(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)c1	763807830	GYARVKCJVDUXSF-UHFFFAOYSA-N	447.245	1.494	50	20	IDGD	
CNC(=O)CCOc1ccc(NC(=O)C(=O)NNC(=O)Cc2c[nH]c3ccccc23)cc1	763865316	ODTZFGKTQBEYKC-UHFFFAOYSA-N	437.456	1.011	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)N2CCCc3ccc(F)cc32)cc1	763872960	PYLXTLXFLCENMU-CQSZACIVSA-N	427.432	1.922	50	20	IDGD	
O=C(NNC(=O)c1ccc(Br)s1)C(=O)Nc1ccc(-n2ccnn2)cc1	763938266	CSVZRCQTNRAOIC-UHFFFAOYSA-N	435.263	1.491	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2C)cc1S(=O)(=O)N(C)C	763956431	NUFDMROUIRVOIW-UHFFFAOYSA-N	448.501	1.044	50	20	IDGD	
Cc1ccc(Br)c(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)c1	764006340	PCHKWBLTGXDGMY-UHFFFAOYSA-N	434.246	1.928	50	20	IDGD	
O=C(NNC(=O)c1cccc(C(F)(F)F)c1)C(=O)Nc1ccc(NC(=O)C2CC2)nc1	764036947	FJIUQQOPWJWQQH-UHFFFAOYSA-N	435.362	1.849	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1cccc(NC(=O)c2ccncc2)c1	764041104	QRFFAFIGRZUHOZ-UHFFFAOYSA-N	433.424	1.742	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)nc1)C(=O)Nc1ccc(C(=O)NC2CCCC2)cc1	764099962	VCUADHOEOWSMTG-UHFFFAOYSA-N	429.864	1.807	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cccc3c2CCN(C(=O)OC(C)(C)C)C3)n[nH]1	764106729	QEJFXFVJYLBTBY-UHFFFAOYSA-N	442.476	1.411	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(S(=O)(=O)C(F)F)cc2)c(O)c1	764109925	DDFSXYKPDQJHGJ-UHFFFAOYSA-N	427.385	1.097	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2ccccc2O[C@H]2CCOC2)cc1	764126522	IORLMSWWVNBJNZ-KRWDZBQOSA-N	427.457	1.582	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccccc2O[C@H]2CCOC2)o1	764138096	AYYUGTCGXPZZIC-INIZCTEOSA-N	444.488	1.689	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cnn(Cc3ccccc3)c2)o1	764139296	RJRSQPQOTMIADN-UHFFFAOYSA-N	438.488	1.766	50	20	IDGD	
NC(=O)C1CCN(Cc2cccc(NC(=O)C(=O)NNC(=O)CC3CCCC3)c2)CC1	764188071	KRTZWPSGKWEXND-UHFFFAOYSA-N	429.521	1.050	50	20	IDGD	
CCN(CC)C(=O)Cn1ccc2cc(NC(=O)C(=O)NNC(=O)c3ccc(C)o3)ccc21	764370616	GKJJFUJMOYKYMX-UHFFFAOYSA-N	439.472	1.811	50	20	IDGD	
Cc1cc(C(=O)N2CCC(C)CC2)ccc1NC(=O)C(=O)NNC(=O)c1ncccc1C	764385893	OVHQTAFNCBBXGR-UHFFFAOYSA-N	437.500	1.970	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1)C(=O)Nc1cncc(Br)c1	764388043	OTEJAHHGRXESFL-UHFFFAOYSA-N	447.224	1.773	50	20	IDGD	
CCN(CC)c1ccc(NC(=O)C(=O)NNC(=O)CSc2ccccc2OC)cn1	764394620	UTQUFUQIOQJOJI-UHFFFAOYSA-N	431.518	1.815	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H](O)CCc2ccccc2)c1	764583839	BPJATALKMOEWPU-LJQANCHMSA-N	433.530	1.472	50	20	IDGD	
CCS[C@@H](C)c1noc(CN(C)C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)n1	765751085	JMVZPDKAVIHCSX-ZDUSSCGKSA-N	448.553	1.763	50	20	IDGD	
Cn1nnc2cc(C(=O)NNC(=O)CN3CCN(Cc4ccccc4Cl)CC3)ccc21	765753204	AEANFRDKWZCZEG-UHFFFAOYSA-N	441.923	1.201	50	20	IDGD	
COC(=O)c1ccc(C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)cc1	765754945	ATMFZDDHYJOHNP-UHFFFAOYSA-N	444.919	1.705	50	20	IDGD	
CN1CCO[C@H]([C@@H](NC(=O)NNC(=O)CNC(=O)c2ccco2)c2ccc(Cl)cc2)C1	766321931	SVSLZIYAXAWZAF-WMZOPIPTSA-N	449.895	1.065	50	20	IDGD	
CNS(=O)(=O)c1cccc([C@H](C)NC(=O)NNc2ccccc2S(C)(=O)=O)c1	766944889	NOBLTSPPHLLJOI-LBPRGKRZSA-N	426.520	1.386	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)Cc2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2)n[nH]1	768279062	XZZIZJXVFYLXRU-UHFFFAOYSA-N	431.449	1.662	50	20	IDGD	
CCc1c(C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cnn1-c1ccccc1OC	769539700	YVCWNTLZYXJVOW-UHFFFAOYSA-N	446.467	1.765	50	20	IDGD	
O=C(NNc1ccc(Cl)nn1)Nc1ccc(N2CCOCC2)cc1N1CCOCC1	769934106	NYBDHIGRBZSDCR-UHFFFAOYSA-N	433.900	1.952	50	20	IDGD	
COc1cccc(C(=O)NCCNC(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)c1	770129548	QXVMPNFQTYFPFR-ZDUSSCGKSA-N	434.880	1.876	50	20	IDGD	
CSCCNC(=S)NNC(=O)[C@H]1CCN(c2cccc(Br)c2)C1=O	770240019	LLLBYAPEHNAOHI-GFCCVEGCSA-N	431.381	1.660	50	20	IDGD	
O=C(NNC(=O)N1Cc2cccc(Br)c2C1)c1ccc(-n2cnnn2)cc1	770308159	SSRZSOAAEUONLR-UHFFFAOYSA-N	428.250	1.795	50	20	IDGD	
C[C@]1(c2ccc(Br)cc2)NC(=O)N(CC(=O)NNC(=O)c2cccnc2)C1=O	771217826	SHCUEMWJXQRFNQ-GOSISDBHSA-N	446.261	1.072	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)[C@H](O)Cc1ccccc1Cl	771854212	NZIQJHDOCXQVOX-HXUWFJFHSA-N	430.936	1.603	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1ccn(Cc2ccccc2)n1	771890575	OEPIXKIAACOWQY-UHFFFAOYSA-N	426.502	1.608	50	20	IDGD	
COc1ccc(COCCNC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)cc1	772052423	SLFQRFRSSGOAEK-UHFFFAOYSA-N	436.490	1.651	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)c1cc(S(N)(=O)=O)ccc1Cl	773177728	XKNOOBSKJWQAEC-SECBINFHSA-N	432.285	1.869	50	20	IDGD	
O=C(NNc1c(Cl)cccc1Cl)C(=O)Nc1cnn(CC(=O)N2CCOCC2)c1	773693865	BFJVOGUFUWSDQV-UHFFFAOYSA-N	441.275	1.131	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ncccn2)cc1S(=O)(=O)N1CCCCCC1	773720193	VLCSXNYNHYAFPB-UHFFFAOYSA-N	432.506	1.432	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1cnn(Cc2ccccn2)c1	774010734	YWYUDLZUMQRAJI-ZDUSSCGKSA-N	442.863	1.533	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)c2cnn(-c3ccc(F)cc3)n2)C1	774247917	XMCPCRQJUFIJRK-ZDUSSCGKSA-N	432.456	1.815	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)NC[C@@H]2COC3(CCCCC3)O2)c2ccccc2c1=O	776064628	LWJBZOYRJBDMDT-OAHLLOKOSA-N	443.504	1.997	50	20	IDGD	
COC(=O)N1CCC([C@H](C)NC(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)CC1	777261743	LEQCAMZEFAYHCK-ZDUSSCGKSA-N	442.542	1.261	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)NC1CCN(S(=O)(=O)CC(C)C)CC1	777765145	FPZGPHXFZSLCEI-UHFFFAOYSA-N	426.539	1.018	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)NNC(=O)c1ccc(COc2ccccc2)o1	778590329	YRFPCZLAEVJQMZ-UHFFFAOYSA-N	447.448	1.359	50	20	IDGD	
C[C@@H]1CCN(C(=O)OC(C)(C)C)[C@H](C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)C1	778835687	KEQHWWGZOVZLFV-KGLIPLIRSA-N	443.545	1.877	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc(O)cc2)n(-c2ccc(C(F)(F)F)cn2)n1	782834587	YVMOBLBPJHLOJS-UHFFFAOYSA-N	448.361	1.700	50	20	IDGD	
NS(=O)(=O)c1cc(F)cc(NC(=O)C(=O)NNc2ccc(Br)cc2F)c1	783087279	YWXUCHDKKNSXGU-UHFFFAOYSA-N	449.233	1.457	50	20	IDGD	
COCCNC(=O)Cn1cc(NC(=O)C(=O)NNc2cc(Cl)ccc2Cl)cn1	783369897	STQLFVDAFCGUNG-UHFFFAOYSA-N	429.264	1.034	50	20	IDGD	
CCn1c(NNC(=O)[C@H]2CC=CC[C@@H]2C(=O)N2CCOCC2)nc2ccccc2c1=O	784337214	NMRSQRKOOBZJMJ-HOTGVXAUSA-N	425.489	1.301	50	20	IDGD	
Cc1nc(Cn2cc(C(=O)NNC(=S)Nc3cccc(Br)c3)nn2)no1	784711459	JBMGUCVLGUZICZ-UHFFFAOYSA-N	437.283	1.412	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)c(N(C)C)n1	784835758	HFDIZYDNLPTYER-UHFFFAOYSA-N	427.433	1.534	50	20	IDGD	
CCOC(=O)c1cc(Br)ccc1NC(=O)C(=O)NNc1ncc(F)cn1	784949261	ILIGKTPCSRWNLI-UHFFFAOYSA-N	426.202	1.637	50	20	IDGD	
CCOc1cc(C#N)cc(Br)c1OCC(=O)NNC(=O)N1CCN(C)CC1	788165918	LIDRKYVQJIXTHO-UHFFFAOYSA-N	440.298	1.086	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@@H](C(=O)NNC(=O)Cc2ccc(Cl)cc2)[C@@H](C)O)cc1	789165875	BJAGDGOLHJPTDQ-FZKQIMNGSA-N	439.921	1.066	50	20	IDGD	
Cc1ccc(-n2cccn2)cc1NC(=O)C(=O)NNC(=O)[C@H]1OCC[C@H]1c1ccccc1	789811044	CEGIHTKLRYZAOI-ICSRJNTNSA-N	433.468	1.839	50	20	IDGD	
CN(C)c1nc2cc(NC(=O)C(=O)NNC(=O)[C@H]3OCC[C@H]3c3ccccc3)ccc2o1	789812795	NOXBZWDFRCDRKK-YJBOKZPZSA-N	437.456	1.552	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)[C@@H]1CCS(=O)(=O)c2ccccc21	791054954	GRWOBUHQNQUAGN-OAHLLOKOSA-N	435.889	1.065	50	20	IDGD	
O=C(NNC(=O)c1cc2sc(N3CCCC3)nc2s1)N[C@@H]1CCS(=O)(=O)C1	793176964	ORSSANFONUPYKT-SECBINFHSA-N	429.549	1.089	50	20	IDGD	
Cn1cc(-c2cc(F)ccc2NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cn1	796992053	LDOXAFXXEZDTBS-SFHVURJKSA-N	439.403	1.152	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc3ccccc3cc2O)cc1OC	796992976	YUBUZXKURPDYLF-UHFFFAOYSA-N	437.408	1.740	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)Cc2ccc([S@@](C)=O)cc2)c2ccccc2c1=O	797792010	JEIBMEYMSLSQBP-SSEXGKCCSA-N	426.498	1.719	50	20	IDGD	
O=C(NNc1nc(-c2cccnc2)no1)c1cccc(S(=O)(=O)NCc2ccco2)c1	798326340	RLENOYPFNBHWOV-UHFFFAOYSA-N	440.441	1.960	50	20	IDGD	
COC(=O)c1ccc(S(=O)(=O)NNC(=O)c2cc(C)nc3ccccc23)cc1OC	799120895	UFNXSDKLLGERIN-UHFFFAOYSA-N	429.454	1.962	50	20	IDGD	
Cc1cc(C)nc(C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1	800796086	BBVSOZNKDNCPIQ-UHFFFAOYSA-N	446.529	1.113	50	20	IDGD	
COCN1C(=O)CCc2cc(NC(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)ccc21	801789912	KTOSEYDXNKCPGN-UHFFFAOYSA-N	436.432	1.012	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@H]2CCCN(C(=O)N3CCCC3)C2)cc1	802066245	RUKSNJLNQZGABL-AWEZNQCLSA-N	437.522	1.171	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)CNC(=O)N2CCc3ccccc3C2)cc1	802067184	OYDSJNPDYBLQLF-UHFFFAOYSA-N	445.501	1.011	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@H]2CCN(c3ccc(C#N)cc3F)C2)c2ccccc2c1=O	804161178	MKGIEQQTAXTASU-HNNXBMFYSA-N	448.458	1.715	50	20	IDGD	
NC(=O)c1ccc(/C=C/C(=O)N2CCC[C@H]2C(=O)NNc2nccnc2C2CCC2)cc1	805461502	FZPUETONWDKOFS-MZEUMTGBSA-N	434.500	1.991	50	20	IDGD	
CCOC(=O)CC(C)(C)CC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	806306264	KPOLKKHJMYPAJM-UHFFFAOYSA-N	439.534	1.602	50	20	IDGD	
O=C(Cn1cc(Cl)cn1)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	806342017	BRSQHVPHUVQOIK-UHFFFAOYSA-N	447.904	1.476	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)C(=O)CC(C)(C)O2	806973323	LABGXYXAMDNJOH-UHFFFAOYSA-N	435.440	1.786	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2ccc(-n3cccn3)nn2)c(F)cc1Br	807002174	RKPMRIRKXJKNJP-UHFFFAOYSA-N	434.229	1.954	50	20	IDGD	
O=C1COC[C@@H](C[C@@H]2CN(C(=O)C(=O)NNc3cccnc3Cl)c3ccccc32)N1	807013436	RSNPNOJKMJOVMY-CHWSQXEVSA-N	429.864	1.214	50	20	IDGD	
O=C(NNC(=O)N1CCC[C@@H](CNS(=O)(=O)C2CC2)C1)c1cccc2cccnc12	808257362	YAYIHPZEIGADGD-AWEZNQCLSA-N	431.518	1.383	50	20	IDGD	
O=C(COc1cccc(C(F)(F)F)c1)NNC(=O)C(=O)Nc1cccc2c1COC2=O	808934570	LKCJSGQOJPHXSD-UHFFFAOYSA-N	437.330	1.541	50	20	IDGD	
O=C(CNS(=O)(=O)c1cccc(Br)c1)NNC(=O)Cc1ccccc1F	810372514	FTSUWYSARUAYRO-UHFFFAOYSA-N	444.282	1.257	50	20	IDGD	
COC(=O)c1c(F)ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)c1F	810387041	COJDKHWUVGAVGT-UHFFFAOYSA-N	449.395	1.603	50	20	IDGD	
CCc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	810394861	DIDYSMOFZOQURC-UHFFFAOYSA-N	447.473	1.680	50	20	IDGD	
COc1cc(F)c(F)cc1NC(=O)C(=O)NNc1c(OC)cccc1S(C)(=O)=O	810401092	VRCYVKNZESJDHF-UHFFFAOYSA-N	429.401	1.467	50	20	IDGD	
COC[C@@]1(CNC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)OCCc2ccccc21	811922126	LRDATLZCRXMBGO-SIKLNZKXSA-N	427.457	1.271	50	20	IDGD	
CSC[C@@H](C)C(=O)N1CCC(C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)CC1	812729663	QQJSRESMDWPIBM-CQSZACIVSA-N	442.607	1.618	50	20	IDGD	
COC(=O)[C@@]1(c2ccccc2)CCN(C(=O)NNC(=O)CNC(=O)c2cccs2)C1	814294202	HQZDDYHNKTVXAN-FQEVSTJZSA-N	430.486	1.035	50	20	IDGD	
CC(C)C(=O)Nc1cc(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)ccn1	814735728	FTXDWUCCJZPQEE-UHFFFAOYSA-N	439.881	1.052	50	20	IDGD	
Cc1nn(C)c(OCC(F)(F)F)c1C=NNC(=O)Nc1ccc(S(N)(=O)=O)cc1	814968264	WOLHRWSBXBHJKV-UHFFFAOYSA-N	434.400	1.473	50	20	IDGD	
COc1ccc(C(=O)N2CCN(C)CC2)cc1NC(=O)C(=O)NNc1cccc(Cl)n1	815726883	YNVQBSPJFHNYAP-UHFFFAOYSA-N	446.895	1.213	50	20	IDGD	
CN(C)NC(=O)Nc1cccc(NC(=O)CCNS(=O)(=O)c2ccc(F)c(F)c2)c1	816406628	XCGQWZQDDDTBBX-UHFFFAOYSA-N	441.460	1.870	50	20	IDGD	
O=C(CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@@H]12)NNC(=S)NCCc1cccs1	819427713	RCVAUUGPFDTKBG-KCQAQPDRSA-N	427.621	1.512	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)[C@@H]2C[C@@H](O)CN2S(=O)(=O)c2ccc(Cl)cc2)n1	877457681	QYMRHBBYKOFFLD-HIFRSBDPSA-N	425.898	1.014	50	20	IDGD	
COC(=O)NNC(=O)c1ccc(OC)c(S(=O)(=O)Nc2cc(OC)cc(OC)c2)c1	913176817	YCEMHNMAZLTCBS-UHFFFAOYSA-N	439.446	1.514	50	20	IDGD	
Cc1cc(C)c(C)c(S(=O)(=O)NCC(=O)NNC(=O)Cn2cnc3ccccc32)c1C	913495818	OWSNYPPZOVYWMI-UHFFFAOYSA-N	443.529	1.396	50	20	IDGD	
COc1c(F)cc(CC(=O)NNC(=O)c2cc3c(s2)CCC3)cc1S(N)(=O)=O	915594541	RBVOBBUZWRURMO-UHFFFAOYSA-N	427.479	1.036	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Cc2cc3ccccc3nc2O)c1	915635883	VXIBVMSOEOWJOX-UHFFFAOYSA-N	428.470	1.194	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)c3cccc(S(=O)(=O)N4CCCC4)c3)n[nH]2)o1	915685861	OUPUNCPSQJNAOU-UHFFFAOYSA-N	443.485	1.837	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)ccc1OCC(=O)NC(C)C	916090999	FZJGEFRYROISCK-UHFFFAOYSA-N	430.417	1.582	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@H](c2ccccc2)c2nccn2C)c2ccccc2c1=O	916220517	LAONCEJQCOEBKA-GOSISDBHSA-N	445.483	1.884	50	20	IDGD	
Cn1ccnc1[C@@H](NC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)c1ccc(F)cc1	916220750	ZGDKUTNKXVAJKY-KRWDZBQOSA-N	445.476	1.696	50	20	IDGD	
CN1CCN(C(=O)c2ccc(CNC(=O)NNC(=O)c3ccc4ccccc4n3)cc2)CC1	916391007	WMYWEQOQLMVNEN-UHFFFAOYSA-N	446.511	1.767	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)NCc2ccnc(-n3cccn3)c2)c2ccccc2c1=O	916394213	HNRYUSYVRGDMFB-UHFFFAOYSA-N	446.471	1.702	50	20	IDGD	
CCOC(=O)N[C@@H](CNC(=O)NNC(=O)c1nn(CC)c(=O)c2ccccc12)CC(C)C	916630623	HNAYAOYGXQHTSX-CQSZACIVSA-N	446.508	1.521	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2c(C)nn3c(C)cc(C)nc23)cc1	916736368	LPPQHXNIIRYNSO-UHFFFAOYSA-N	444.517	1.045	50	20	IDGD	
CN(C)c1nc2sc(C(=O)NNC(=O)c3csc(N4CCOCC4)n3)cc2s1	917497184	ZPPYCDLFPDIBRP-UHFFFAOYSA-N	438.560	1.792	50	20	IDGD	
O=C(NNC(=O)c1ccc(F)cc1Br)NC1CCN(C(=O)C2CC2)CC1	918202035	GGDABVOFACPRPA-UHFFFAOYSA-N	427.274	1.933	50	20	IDGD	
CNS(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=O)CCc2ccc(OC)cc2)c1	919835675	ONCDVHAUXNSLSG-UHFFFAOYSA-N	425.894	1.651	50	20	IDGD	
COc1cccc2c1OCCC2=NNC(=O)C(=O)NN=C1CCOc2c(OC)cccc21	920357953	KSXYEDIOXFCSKQ-UHFFFAOYSA-N	438.440	1.610	50	20	IDGD	
COc1cc(OCC(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)ccc1[N+](=O)[O-]	920999109	HDEMKOYPTDFSAX-UHFFFAOYSA-N	435.389	1.469	50	20	IDGD	
CCN(CC)C[C@H](C)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	921121532	OOURKFDUQBLNBN-HNNXBMFYSA-N	425.555	1.145	50	20	IDGD	
CC(=O)N1CCC(CNC(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)CC1	1116082828	BLOWPUNRHDWQDS-UHFFFAOYSA-N	425.530	1.222	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@H]2CC(=O)N(CCc3ccc(OC)c(OC)c3)C2)cc1	1317702554	NFEDGMCITBPFOR-KRWDZBQOSA-N	441.484	1.565	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)c1ccccc1F)C(=O)NNc1nncc(N)c1Cl	1319406137	OZLIHUAUOXLBLU-LLVKDONJSA-N	448.933	1.395	50	20	IDGD	
O=C(NCC(=O)N1CCN(c2ccccc2)CC1)NNC(=O)c1cncn1-c1ccccc1	1325025584	HHCDBKLGVBRIPO-UHFFFAOYSA-N	447.499	1.165	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C=C\C(=O)NC2CC2)C1	1779231447	TUKRUSZJNMQYKQ-QECQGUJISA-N	442.354	1.119	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cnnc3ccccc13)CCO2	1779295640	UWSAPJQRHPADIC-OAQYLSRUSA-N	428.565	1.925	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H]1CC(c3ccccc3)=NN1)CCO2	1779299322	RIFNHLWADUDKFV-SIKLNZKXSA-N	444.608	1.434	50	20	IDGD	
CC1(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cnccc3C(=O)NN)C2)CCC1	1779371784	ODSNRGAGMNAZPL-VGOFRKELSA-N	429.521	1.003	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1c(O)cc(O)cc1O)C2	1780707012	BBMKVJDAWKAKRH-OWDMVUQNSA-N	426.897	1.948	50	20	IDGD	
O=C1Cc2cc(C(=O)N3CCO[C@@]4(CCN(C(=O)[C@@H](F)Br)C4)C3)ccc2N1	1781329502	GRHREKBAWGVNOY-CRAIPNDOSA-N	440.269	1.315	50	20	IDGD	
C[C@H](Oc1ccccc1)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781333711	ISKPXSFQJWMJAW-DHSIGJKJSA-N	429.286	1.974	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCSC(=N)N)C2	1781899956	IDMDWROFMOSKFN-OGHNNQOOSA-N	449.415	1.691	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCCn1ccnc1)C2	1782002543	RELFENCPZCQLOE-FRQCXROJSA-N	441.370	1.961	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CN2CCCCC2=O)C1	1782108049	IKMPIXYZENHNRK-QMTMVMCOSA-N	444.370	1.296	50	20	IDGD	
CC[C@@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](Cl)COC)C1)N(CC)CC	1782171939	HBNXMBVKVIODBZ-LXGFNABISA-N	432.005	1.875	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(CCN(C(=O)c3nc4ccc(F)cn4n3)C2)C1	1782569442	SMSYCWYLRFWLFK-QGZVFWFLSA-N	440.273	1.097	50	20	IDGD	
CCS(=O)(=O)c1ccc(CC(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](F)Cl)CCO3)cc1	1783017195	JTCGYLOZJUUKPL-MJGOQNOKSA-N	446.928	1.387	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)COc3ccc(O)cc3)CCO2)C1	1783338055	CXFOFRKVUZVHMY-QFBILLFUSA-N	441.322	1.774	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cnc(N(C)C)o3)CCO2)C1	1783342458	ADXSCEDBAUSCBV-PXAZEXFGSA-N	429.315	1.358	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cc4n(n3)CCCO4)CCO2)C1	1783349859	UIQDSVGHEVZKJR-UGSOOPFHSA-N	441.326	1.283	50	20	IDGD	
Cc1noc(C)c1CCC(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](C)Br)C2)C1	1783532569	PRNFZJDMCSJCFF-SGTLLEGYSA-N	428.327	1.837	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3cnc4ccccn34)[C@H]2C1	1784050161	XUXIVAXPHOUWNU-OWLYRPNTSA-N	434.924	1.110	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(-c4ncc[nH]4)cc3)C[C@@H]21)[C@@H](O)CCl	1784095923	PKSYRSPFIISNDW-XSLAGTTESA-N	432.908	1.270	50	20	IDGD	
O=C(COc1cccnc1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21	1785146635	IBPJGUZEXXKBIW-PCBIJLKTSA-N	430.274	1.131	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C[C@@H]3COc4ccccc4O3)C[C@@H]21)[C@@H](F)Cl	1787443394	IFWNKLFAUDATKT-HIQFYHPCSA-N	426.872	1.731	50	20	IDGD	
O=C(/C=C/C(=O)c1cccs1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21	1787509975	WYHFLIISMPDRDN-WZJKIVPMSA-N	426.922	1.066	50	20	IDGD	
C[C@H](Cn1cccn1)C(=O)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1	1788144956	HTTCJPHXPZHAKX-QGZVFWFLSA-N	446.316	1.647	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)NC(=O)c3ccccc3)C[C@@H]21	1789864359	RGCZACSGHHZXDX-HZZCBIDNSA-N	435.952	1.802	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(O)c([N+](=O)[O-])c3)C[C@@H]21	1789867153	YMLHEQGMTNDOBZ-ZJOBFFGXSA-N	425.869	1.911	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]2C1	1789925833	WEUSSOZZMKATKO-HTFCKZLJSA-N	444.139	1.830	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(OC)cc3F)C[C@@H]21	1791256598	CVYQRZSFSSUAAL-PTOXDTDZSA-N	428.888	1.681	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(-c4cc[nH]n4)cc3)C[C@@H]21	1791257296	XHILPLAOCAIPRI-GNBUJSLZSA-N	446.935	1.924	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1c(Cl)cncc1Cl	1792410650	IJPRPUHXKSHFAQ-YJKIEOBBSA-N	436.723	1.845	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CC[C@@H]3CCC(=O)N3C1)C2	1793452341	ZOLNTRBMTFARTE-FJANGAQTSA-N	425.957	1.385	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1csc(C)n1	1794082091	LALYDRDNFQZYPY-FAXLKDOZSA-N	430.368	1.757	50	20	IDGD	
CCSc1cccnc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1	1796188610	ZCUZGWSBPWPMEQ-BCDXTJNWSA-N	439.346	1.439	50	20	IDGD	
Cc1nc2cccc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3ccc(B(O)O)cc3)c2s1	1796189005	LSSGULUMEWSWMI-BCDXTJNWSA-N	449.341	1.850	50	20	IDGD	
O=C1CCc2ccc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)[C@H](F)Br)C4)nc2N1	1796568429	LKKYONQKHKEENN-OXIQGZBJSA-N	439.285	1.909	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccncc1C(F)(F)F	1796625757	WZALQFXFECJYKP-BAESOJJISA-N	435.830	1.557	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](C)Cn1cccn1)C2	1796890957	QMKFDPYKGYJYAZ-CZRLGECOSA-N	439.520	1.291	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2n(n1)CCCC2	1797442636	NXBMWIBVGJMEFN-UESRRSCYSA-N	429.348	1.659	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc2c(c1)n(C)c(=O)n2C	1797504845	HKTNHOCRVHKCRA-FZKCQIBNSA-N	434.924	1.383	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccc(Br)nc1	1799031462	XXSHGDKAOSBXQT-LOUJCGABSA-N	444.757	1.994	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cn1nnc3ccccc31)C2	1799273677	FZRZJDKPTLQIFP-OESLAJAZSA-N	440.331	1.257	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(OC)c(OC)c1)C2	1800978729	IKZJGPJVVWNMJM-KRXQYRFLSA-N	426.897	1.161	50	20	IDGD	
COc1cccc(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)c1C	1802046147	JVNSSHWXWHWNKP-WKCHPHFGSA-N	436.317	1.178	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1CCN(CC)CC1	1802173732	IFXBPKCWIOHICQ-YVSFHVDLSA-N	430.387	1.481	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CSc2ccncc2)[C@H]1c1cccnc1)[C@@H](O)CCl	1803136812	VVOKXKSHYXBVBF-IEZWGBDMSA-N	434.949	1.874	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cccn3nccc23)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803148665	WCDFWBVQHCMTHM-ZYSHUDEJSA-N	427.892	1.649	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)c[nH]1	1807360814	CUBZSBJNNVMJEJ-WIYYLYMNSA-N	432.289	1.031	50	20	IDGD	
Cc1ccoc1C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1807375830	QFUUNYPINXQDOJ-AZUAARDMSA-N	433.273	1.296	50	20	IDGD	
CC(C)CNC(=O)C(=O)N1CC[C@H](CNC(=O)[C@@H](F)Br)[C@@H]1c1cccnc1	1808661729	CXTNOXAKMZYRCA-QLFBSQMISA-N	443.317	1.550	50	20	IDGD	
CN1C(=O)CC[C@H]1C(=O)NC[C@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1	1808757471	KQILIFLWKPHGQF-VKJFTORMSA-N	437.338	1.493	50	20	IDGD	
CC(C)CCC(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1	1810304236	BGPQDJTWKYIGKW-LAUBAEHRSA-N	438.532	1.836	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1	1810305174	IYKKCLGGPCHPCR-FHLIZLRMSA-N	444.923	1.417	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2cnn3c2CCC3)[C@H]1c1cccnc1	1812143734	CWESGBNBILVOTP-VDZJLULYSA-N	431.924	1.798	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)CNC(=S)NCC)[C@H]1c1cccnc1	1812328681	JFPQISDQGHTEMV-SOLBZPMBSA-N	440.013	1.979	50	20	IDGD	
Cc1nc(CC(=O)N2CC[C@H](CNC(=O)[C@H](C)Br)[C@H]2c2cccnc2)no1	1812865210	MVTIVHDLRXJTEX-FABXCBLPSA-N	436.310	1.805	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2nccc3nc[nH]c23)[C@@H]1c1cccnc1	1813032203	UXNJPPIAVYFBLX-YZVOILCLSA-N	442.907	1.926	50	20	IDGD	
N#Cc1cccc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)c1	1815343925	XSHWDBWPMVTKOR-QGZVFWFLSA-N	446.297	1.234	50	20	IDGD	
O=C(C[C@@H]1CCCCO1)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1	1815350297	OXJXFQRQAIKPEP-CVEARBPZSA-N	443.334	1.008	50	20	IDGD	
Cc1cccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)n1	1817470497	CCWSFGWULNHPCN-LJQANCHMSA-N	433.277	1.413	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)Cc2ccncc2)[nH]n1)c1ccc(B(O)O)cc1	1817472806	YUKJDCXMHIJQBK-IBGZPJMESA-N	433.277	1.033	50	20	IDGD	
Cc1cc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)[C@@H](O)CCl)[nH]n2)ncc1[N+](=O)[O-]	1818262467	UDCGJUJZWXIXBM-HIFRSBDPSA-N	436.856	1.927	50	20	IDGD	
CN1CCN(CC(=O)Nc2nc3c(s2)C[C@H](NC(=O)C(C)(C)CCl)CC3)CC1	1818794226	DIGXHCOMNWUZCT-CYBMUJFWSA-N	428.002	1.568	50	20	IDGD	
CC[S@](=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](C)Br)CC2	1819519670	KRLYTSCLIQWFEZ-ROXXKOOQSA-N	436.397	1.997	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CS(C)(=O)=O)[nH]n1	1820864155	RMPMFDGNKWMOTJ-IAQYHMDHSA-N	425.338	1.683	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@H](F)Br)CC2)c1cc[n+]([O-])cc1	1821053568	UBQVKIYOFZIMHH-SKDRFNHKSA-N	429.271	1.693	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2csc(N)n2)[nH]n1	1822414112	LSBVNHUKTCIEHR-ZDUSSCGKSA-N	434.526	1.127	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCNC(C)=O)CC2	1825452145	XWSMOQSGWPAVAP-MNOVXSKESA-N	431.356	1.755	50	20	IDGD	
C[C@H](O)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CC2	1825613124	DMNXWZJHOUHEGD-UMNHJUIQSA-N	446.957	1.568	50	20	IDGD	
COCCn1nccc1C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](Cl)COC)sc2C1	1825999303	UPNDYEWRCZRVPI-NEPJUHHUSA-N	441.941	1.466	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc3ncccn3n1)CC2	1826000098	KWEUTJVUBRKYDN-GHMZBOCLSA-N	434.909	1.665	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@H](O)C(C)C)CC1	1827677457	UGWKOVNTRODCRH-UXIDLFCBSA-N	445.564	1.757	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H]2C=CCN2)CC1	1827680051	CPOLPCDZBVQINQ-VEWSIASQSA-N	440.548	1.268	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(C#N)c[nH]2)CC1	1829778609	MPUIYKVBZZANMR-IBGZPJMESA-N	428.537	1.493	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccnc4c3OCO4)C2)C1	1831654112	IKOPRORINWFCPA-YWZLYKJASA-N	439.896	1.288	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)Oc3ccccn3)C2)C1	1831657426	OGJSQVOEDZQKAQ-XGHQBKJUSA-N	439.940	1.713	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)C2CCSCC2)CC1	1832943125	CLCOWDFFWUEHIR-OAQYLSRUSA-N	444.406	1.743	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)c1ccc(Cl)nc1	1833012013	KTRVHLSSIOLJSQ-INIZCTEOSA-N	429.348	1.520	50	20	IDGD	
O=C(COc1ccc(O)cc1)NC1CCN(C2CCN(C(=O)[C@H](F)Cl)CC2)CC1	1833210775	DFJUHTUDGMZVIK-IBGZPJMESA-N	427.904	1.877	50	20	IDGD	
C=CCO[C@@H](C)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)Br)CC2)CC1	1833477101	UJDFKOAANCZYAN-CABCVRRESA-N	430.387	1.933	50	20	IDGD	
C=CCO[C@H](C)C(=O)NC1CCN(C2CCN(C(=O)[C@H](C)Br)CC2)CC1	1833477104	UJDFKOAANCZYAN-LSDHHAIUSA-N	430.387	1.933	50	20	IDGD	
Cc1noc(C)c1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)CBr)C2)C1	1834061921	AOZIUELHFWKHEC-KPZWWZAWSA-N	444.326	1.392	50	20	IDGD	
O=C(CCBr)NC1CCN(C2CCN(C(=O)c3ccc(O)nc3)CC2)CC1	1834423440	WSFXIBTZULKIJT-UHFFFAOYSA-N	439.354	1.757	50	20	IDGD	
O=C(/C=C/c1ccccc1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1835109605	BZFJJNVWLQXEJD-JISXSJDESA-N	441.297	1.847	50	20	IDGD	
Cn1cc(C(=O)NC2CCN(C3CCN(C(=O)[C@H](O)CCl)CC3)CC2)c(C(F)F)n1	1835240637	VJYVQCCQEDZCOV-OAHLLOKOSA-N	447.914	1.143	50	20	IDGD	
CCn1nc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)c2ccccc21	1836342708	FNGAZJLUMXIVHG-YLJYHZDGSA-N	438.887	1.661	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3nc4ccccn4n3)CCO2)C1	1836392226	IOOVARCNBZGWFH-HXUWFJFHSA-N	435.912	1.064	50	20	IDGD	
Cn1cc2cc(C(=O)N3CCC(OC4CCN(C(=O)[C@@H](O)CCl)CC4)CC3)ccc2n1	1836718745	CKRWNQCHCSADCF-FQEVSTJZSA-N	448.951	1.785	50	20	IDGD	
O=C(c1n[nH]c2c(F)cccc12)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1837061203	RQKSCJHUKCTIID-GOSISDBHSA-N	445.278	1.576	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC(OC2CCN(C(=O)c3ccsc3)CC2)CC1	1837407968	USDQHHLUXMNTSA-UHFFFAOYSA-N	442.346	1.354	50	20	IDGD	
C[C@@H]1CCC[C@H]1C(=O)N1CCC(OC2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1	1838298160	SXFQUGKPGZBGCA-YLJYHZDGSA-N	436.597	1.794	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCCC(=O)OC(C)(C)C)C2)C1	1839141490	JXCZQAKVUMRPNB-HRAATJIYSA-N	446.972	1.972	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cncn3-c3ccncc3)C2)C1	1839142766	AHBPWQSKVNMCSM-DYESRHJHSA-N	447.923	1.355	50	20	IDGD	
O=C(CCc1ccoc1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839203553	ONELWAZMYOWAFI-RDJZCZTQSA-N	433.274	1.359	50	20	IDGD	
Cn1cc2cc(C(=O)N3CCOC[C@]4(C3)CN(C(=O)C(Cl)Cl)CCO4)ccc2n1	1840189993	WNZGRWKVZJRNBS-IBGZPJMESA-N	441.315	1.447	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)C3=COCCC3)CCO2)C1	1840217698	OSZSYSOAQNQVHI-QAPCUYQASA-N	431.327	1.311	50	20	IDGD	
CC[C@@H](NC(C)=O)C(=O)N1CCCC12CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1841085621	BMVCQDNCPZJIMO-CABCVRRESA-N	444.960	1.237	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC2(CCCN2C(=O)CCN2C(=O)c3ccccc3C2=O)C1	1841911230	NDEXNIBZXSBWCD-CYBMUJFWSA-N	448.317	1.660	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H]1CCC(=O)N1CCCC12CN(C(=O)[C@@H](O)CCl)C2	1843949330	PCKZLIOHBHBNSC-CVEARBPZSA-N	443.972	1.969	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@H]2CCC(=O)N2C(=O)OC(C)(C)C)C1	1846485947	ZUJGYLFGTYGFOF-ZIAGYGMSSA-N	443.928	1.370	50	20	IDGD	
CN(CC(=O)N1CC2(CCCN2C(=O)C2(C#N)CCC2)C1)NC(=O)NCc1ccccc1	1846975685	LWCVYJKGJAUAQO-UHFFFAOYSA-N	438.532	1.230	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)Cc1cc2ccccc2n1C	1847463820	PMINVWGQUAVLFK-PMACEKPBSA-N	425.533	1.296	50	20	IDGD	
COCCCn1c(SCC(=O)NNC(=O)c2ccccc2)nc2ccccc2c1=O	9411904	UPRQWKHFJTYYFL-UHFFFAOYSA-N	426.498	1.986	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)C[C@H](C)N3S(C)(=O)=O)cc1	15025208	HNSQKLWQJZXLBR-ZDUSSCGKSA-N	430.486	1.105	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(Cl)cc2)c1	17407644	YUXNVNRHZLVZAE-UHFFFAOYSA-N	439.921	1.804	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@H]2CCCCN2S(=O)(=O)c2ccccc2)cc1OC	22083986	HOXCPZUGLBNXMM-QGZVFWFLSA-N	447.513	1.708	50	20	IDGD	
CC(C)(C)NC(=S)NNC(=O)C1CCN(S(=O)(=O)c2cccnc2Cl)CC1	28716598	CHAUYFWXXWYCCN-UHFFFAOYSA-N	433.987	1.430	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](Cc1ccccc1)C(=O)NNC(=O)CNC(=O)c1ccco1	725740384	DWVPYMJWLOMFGX-OAHLLOKOSA-N	430.461	1.293	50	20	IDGD	
COCCCNC(=S)N(C)NC(=O)C1CCN(S(=O)(=O)c2ccccc2F)CC1	726076258	WAGFLYZWTYGWDM-UHFFFAOYSA-N	446.570	1.100	50	20	IDGD	
Cc1ccc(C(=O)N[C@H](C(=O)NNC(=O)c2csc(N3CCOCC3)n2)C(C)C)cc1	726089749	SBWGARWKRPGICE-KRWDZBQOSA-N	445.545	1.504	50	20	IDGD	
Cc1ccc(S(=O)(=O)NNC(=O)c2nnc(-c3ccccc3)o2)c(C)c1OCC(=O)O	726155240	JJMZHVDRWFGBBW-UHFFFAOYSA-N	446.441	1.440	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NCc1ccc(Br)c(F)c1	726250364	VEMISBJFBZHKCX-UHFFFAOYSA-N	429.271	1.910	50	20	IDGD	
Cc1noc(CNC(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)n1	727229547	BOLDEWIQNCGBGZ-UHFFFAOYSA-N	433.432	1.224	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)c1ccc(Br)cn1	727293844	CWDCPOYJDHXBPD-UHFFFAOYSA-N	432.322	1.817	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(CCC(=O)N([C@H]2CCS(=O)(=O)C2)N(C)C)cc1	728177577	DKHWJBJSTANWDJ-KRWDZBQOSA-N	445.607	1.142	50	20	IDGD	
Cn1c(N)c(C(=O)/C(C#N)=C\c2csc(-c3ccc4c(c3)OCO4)n2)c(=O)n(C)c1=O	728569225	RTDBQMGUTDVZQJ-WZUFQYTHSA-N	437.437	1.308	50	20	IDGD	
Cc1nn(-c2ccccc2)c2sc(C(=O)NNC(=S)NCCS(C)(=O)=O)cc12	729158519	ZUHQERIJCVPJCV-UHFFFAOYSA-N	437.572	1.549	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)cc(Cl)c1OCCC(C)C	729277321	ZBRPLUGHLOHRSR-LLVKDONJSA-N	435.930	1.472	50	20	IDGD	
CC(C)n1nc(C(=O)NNS(=O)(=O)c2ccc3c(c2)C[C@@H](C)O3)c2ccccc2c1=O	729964536	DMAODSXDYUBUTM-CYBMUJFWSA-N	442.497	1.924	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)NCc2nnnn2-c2ccccc2)N(C)c2ccccc21	730536000	KSOHJIKPRXFOFZ-UHFFFAOYSA-N	442.483	1.949	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@@H]2CC(=O)N(C3CCC(C)CC3)C2)c2ccccc2c1=O	731341672	OLTFCWOIDPTNKA-HWOWSKLDSA-N	439.516	1.605	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)NCC(C)(C)NS(C)(=O)=O	731680890	XANFBTYVGDWCJE-UHFFFAOYSA-N	425.536	1.390	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)N1CCc2ccccc2C1	731864098	OEWXTKDBZVSOTP-HNNXBMFYSA-N	430.530	1.145	50	20	IDGD	
COCCOc1ccc(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1	732053960	MSKSCGCMTKFTEO-UHFFFAOYSA-N	427.866	1.087	50	20	IDGD	
O=C(CCCN1CCN(c2ccccc2)CC1)NNC(=O)c1nnc(O)c2ccccc12	732257642	WREWGIXCPPIFPU-UHFFFAOYSA-N	434.500	1.699	50	20	IDGD	
C[C@H](NS(=O)(=O)c1ccc(Cl)cc1)C(=O)NNc1ccccc1S(C)(=O)=O	732304269	UVXISGXJOFFFCQ-NSHDSACASA-N	431.923	1.554	50	20	IDGD	
O=C(NCCCCN1C(=O)c2ccccc2C1=O)NNC(=O)c1nnc(O)c2ccccc12	732471677	KKAUKMXVBDXJTK-UHFFFAOYSA-N	448.439	1.356	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)N[C@@H]2CCN(c3ccccc3C(N)=O)C2)cc1	732594724	HOKIFKHATKRXPT-OAHLLOKOSA-N	427.530	1.795	50	20	IDGD	
CCOCCCn1c(NNC(=O)[C@@H](C)Sc2nncn2C)nc2ccccc2c1=O	733268896	UFXWPAKZCPNEAL-CYBMUJFWSA-N	431.522	1.576	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NC[C@H]2OCCc3ccccc32)cc1	733651487	JVYDCDBPIQMGFD-LJQANCHMSA-N	446.529	1.260	50	20	IDGD	
COCCN(CC(=O)NNC(=O)c1nn(-c2ccccc2)cc1O)C(=O)OC(C)(C)C	734012955	KJFIRRKZMKELEG-UHFFFAOYSA-N	433.465	1.222	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)[C@@H]1CCCN(C(=O)c2ccccc2)C1	734242084	RNRPLBAQKSRSCN-MRXNPFEDSA-N	433.509	1.394	50	20	IDGD	
CCCOc1ccc(C(=O)NNS(=O)(=O)c2ccc3c(c2)C(=O)NCC3)cc1OC	734806885	NZTDCCHSQWMNFH-UHFFFAOYSA-N	433.486	1.393	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)[C@H]2C[C@H]2c2c(F)cccc2F)ccc1Cl	734809244	JHPKBGDEMSINHE-ZJUUUORDSA-N	429.832	1.830	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)O[C@H]2CCN(C)C2=O)cc1	734889017	VHTPYEFSPYCPGI-RXBGNRNISA-N	437.456	1.115	50	20	IDGD	
CC(=O)NCC(=O)N1CCc2cc(C(=O)NNC(=S)NCCc3cccs3)ccc21	735703124	HFNNVEFGOJPGQL-UHFFFAOYSA-N	445.570	1.125	50	20	IDGD	
Cc1cc(N2C[C@H](C(=O)NNc3ncnc4[nH]cnc34)CC2=O)ccc1Br	740746548	ONKKYFDHXXLDDI-SNVBAGLBSA-N	430.266	1.920	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)c2ccc(C(=O)NCC(C)(C)C)cc2)c2ccccc2c1=O	741660042	HPJUNFBUVUYDHS-UHFFFAOYSA-N	435.484	1.784	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1cccc(-c2cnn(C)c2)c1	741663190	YLNNUSVJSDQJQE-UHFFFAOYSA-N	426.502	1.763	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=S)N[C@@H]2CCc3ccccc3C2)c1	742975719	NGEYEOVQMRQLOK-QGZVFWFLSA-N	432.571	1.603	50	20	IDGD	
Cc1cc(N2CC[C@@H](NC(=O)NNC(=O)c3cccc(Br)c3)C2=O)n(C)n1	743688034	UPSGALDIFDRATF-CYBMUJFWSA-N	435.282	1.241	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)CNC(=O)c2c(F)cccc2Cl)cc1	743829196	GBTOXTUHEUYIDS-UHFFFAOYSA-N	442.856	1.465	50	20	IDGD	
Cc1ccc(NC(=O)N(C)C)c(C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c1	745035976	SXSRYHBQRYICPZ-UHFFFAOYSA-N	443.416	1.615	50	20	IDGD	
C[C@H](O)[C@@H](NC(=O)C(C)(C)C)C(=O)OCC(=O)C(C#N)=C1N(C)c2ccccc2N1C	745700941	IDGAEQITVLDXDD-SCLBCKFNSA-N	428.489	1.332	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)c1cccc(-n2cccn2)c1	745932701	OVGFSMOPVRWHSX-CQSZACIVSA-N	431.456	1.824	50	20	IDGD	
O=C(CCN1CCN(c2ccccn2)CC1)NNC(=O)c1ccc(Br)s1	746100490	NCHGFEUNPDIBBD-UHFFFAOYSA-N	438.351	1.879	50	20	IDGD	
CN(C)[C@H](C(=O)NNC(=O)C1CCN(c2ncccn2)CC1)c1c(F)cccc1Cl	746218075	BGIVSPMMXZSFOQ-KRWDZBQOSA-N	434.903	1.936	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)c2ccccc2c1=O	747374223	VIDKJMRTZUEHGS-UHFFFAOYSA-N	435.318	1.935	50	20	IDGD	
Cn1cc(NS(=O)(=O)c2ccsc2C(=O)NNC(=O)CCOc2ccccc2)cn1	751397463	RGTLYHALLQHZDS-UHFFFAOYSA-N	449.514	1.513	50	20	IDGD	
Nc1nc(Cl)cc(NNC(=O)CCNS(=O)(=O)c2c(Cl)cccc2Cl)n1	753463402	DWDMVRCMYDTSEL-UHFFFAOYSA-N	439.712	1.831	50	20	IDGD	
CC(C)CCn1ncc(NC(=O)C(=O)NNC(=O)CNC(=O)c2ccco2)c1C(C)C	753851621	FNDASUJYCZXLTM-UHFFFAOYSA-N	432.481	1.162	50	20	IDGD	
N#Cc1cc(Br)cc(S(=O)(=O)NNC(=O)COc2ccccc2O)c1	754319388	ABKJVPRWSQOKOE-UHFFFAOYSA-N	426.248	1.415	50	20	IDGD	
CCCC[C@H](NC(=O)[C@H](C)NC(=O)C(C)(C)C)C(=O)NNC(=O)c1cccc(C#N)c1	755327154	PIVMRUTWWXCNNT-YOEHRIQHSA-N	429.521	1.545	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1	755515660	GGCJFOJBVVZAAZ-KRWDZBQOSA-N	434.474	1.366	50	20	IDGD	
O=C(COc1ccc(Cl)cc1)NNC(=O)Nc1ccc(CC(=O)N2CCOCC2)cc1	755861116	AAUFJXMHSNEXII-UHFFFAOYSA-N	446.891	1.973	50	20	IDGD	
CCc1ccccc1OCC(=O)NNS(=O)(=O)c1ccc(Cl)nc1C(=O)OC	755956955	KVPZYQJHXAVZDL-UHFFFAOYSA-N	427.866	1.473	50	20	IDGD	
CC(C)(C)OC(=O)NCC1(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)CCCC1	756929846	IGZWPNDATHOGFE-UHFFFAOYSA-N	446.552	1.926	50	20	IDGD	
COC(=O)c1csc(NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c1	757679577	JWQZSEJJQGRUGY-UHFFFAOYSA-N	431.518	1.900	50	20	IDGD	
CCN(CC)CCNC(=O)c1cc(NC(=O)NNC(=O)Cc2cc[nH]n2)ccc1Cl	757758151	QUWQMSQUDLPHOI-UHFFFAOYSA-N	435.916	1.530	50	20	IDGD	
O=C(NC[C@@H](c1ccc(Cl)cc1)N1CCOCC1)NNC(=O)C(=O)Nc1ccccn1	758723023	CRDFOVWIPKAXCL-INIZCTEOSA-N	446.895	1.077	50	20	IDGD	
CN(NC(=O)CSc1cccc[n+]1[O-])C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758782009	KSZOXCPJTNLAMJ-UHFFFAOYSA-N	425.511	1.048	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCCCc2ccc3c(c2)OCCO3)c1	758894521	OBFUDUZIEFXSDE-UHFFFAOYSA-N	433.486	1.438	50	20	IDGD	
COC(=O)c1ccccc1NNC(=O)CCNC(=O)[C@H]1CCCN1C(=O)OC(C)(C)C	760931679	RUAREZCEJMSNAD-MRXNPFEDSA-N	434.493	1.822	50	20	IDGD	
COCCCNC(=S)N(C)NC(=O)c1sc2nc(COC)nc(OC)c2c1C	761793516	ZZUZVLNPTGMWNC-UHFFFAOYSA-N	427.552	1.642	50	20	IDGD	
CN(C)CCOc1cc(CNC(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)ccn1	763090956	FLVFZUFINNVMPC-UHFFFAOYSA-N	443.512	1.449	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(C)nn2-c2ccccc2F)cc1OC	763543096	KSBZDYJZYZCCBU-UHFFFAOYSA-N	441.419	1.737	50	20	IDGD	
CCOc1cc(NC(=O)C(=O)NNC(=O)c2ccccc2F)c([N+](=O)[O-])cc1OCC	763561070	IFIFOBDMIIRAMA-UHFFFAOYSA-N	434.380	1.931	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)Nc1cnn(-c2ccccc2Cl)c1	763579513	WUXHGWKPOPLSLM-QGZVFWFLSA-N	441.831	1.452	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cccc(N3CCN(C(C)C)CC3)c2)c(C)o1	763584187	WBEOYPBZWBHJRE-UHFFFAOYSA-N	427.505	1.827	50	20	IDGD	
CNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)COc2ccc(C(C)(C)C)cc2)c1	763599060	AGBXQIXDXCWYKE-UHFFFAOYSA-N	426.473	1.509	50	20	IDGD	
COCCn1ncc2ccc(NC(=O)C(=O)NNC(=O)COc3cccc(C)c3)cc21	763622911	HUUKFLOHVWHNPC-UHFFFAOYSA-N	425.445	1.156	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(NC(C)=O)ccc1Cl	763648889	XWXIHGVXWUOYKY-UHFFFAOYSA-N	434.836	1.472	50	20	IDGD	
CCOC(=O)c1c(C)csc1NC(=O)C(=O)NNC(=O)COc1ccc(OC)cc1	763662091	UJPKYAKVJQVWHH-UHFFFAOYSA-N	435.458	1.407	50	20	IDGD	
COC(=O)C(C)(C)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)cc1	763674168	MRFVLZUQXPBPPE-UHFFFAOYSA-N	438.440	1.174	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)nn1-c1ccccc1	763687017	YOLMIPUVTMBKIS-UHFFFAOYSA-N	427.848	1.999	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2ccccc2OC(F)F)c2ccccc2c1=O	763786621	QQVUWQQZXLFDBZ-UHFFFAOYSA-N	445.382	1.418	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)Cc1c(C)nn(CC(F)(F)F)c1C	763828595	QNAROUFUBQQIFL-UHFFFAOYSA-N	440.422	1.846	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccc(-c3ncc4n3CCCC4)cc2)n1	763881505	OIWCJCSWZNRKSP-UHFFFAOYSA-N	435.488	1.486	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccc(CN3CCC[C@H](C)C3)cc2)n1	763886906	ZVVURYPDCWBCBA-HNNXBMFYSA-N	426.521	1.518	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)NC(=O)[C@@H](C)O3)cc1OC	763901137	GEQGWSGPSPFTFL-LLVKDONJSA-N	442.428	1.213	50	20	IDGD	
CC(C)n1cc2cc(NC(=O)C(=O)NNC(=O)c3nn(-c4ccccc4)cc3O)ccc2n1	763945428	XNTHYOOVAUQAMM-UHFFFAOYSA-N	447.455	1.908	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1ccc(OC(F)(F)F)cc1	764007100	ZRAMHZPKNROXLF-UHFFFAOYSA-N	425.319	1.756	50	20	IDGD	
COC(=O)CSCc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)nc2)c1	764093632	WGSNYLOEKINIIX-UHFFFAOYSA-N	436.877	1.541	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)nc1)C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F	764100985	MZIVJRWVHJNMDG-UHFFFAOYSA-N	429.723	1.644	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2cccc(-c3nnc(C)n3C)c2)cc1	764126861	KVDRENDCGNQDHW-UHFFFAOYSA-N	436.472	1.518	50	20	IDGD	
O=C(CC1CC1)NNC(=O)C(=O)Nc1ccc(Cl)c(S(=O)(=O)N2CCCC2)c1	764142783	KQJFPPOCSVLYIO-UHFFFAOYSA-N	428.898	1.011	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)CCc2ccco2)cc1	764168324	CLKKXKPMSSTJJB-UHFFFAOYSA-N	436.490	1.029	50	20	IDGD	
CC(C)(C)CC(=O)NNC(=O)C(=O)Nc1cc(N2CCCS2(=O)=O)ccc1Cl	764199642	QWSRWSWJHCJVJV-UHFFFAOYSA-N	430.914	1.402	50	20	IDGD	
COc1ccc(Cn2nccc2NC(=O)C(=O)NNC(=O)CC(C)(C)C)c(OC)c1OC	764199821	XFPCRAAYWPYMGY-UHFFFAOYSA-N	447.492	1.479	50	20	IDGD	
CC(C)Oc1cc(Br)cc(NC(=O)C(=O)NNC(=O)Cc2cccnc2)c1	764264862	YCZHOWFBNXTBQB-UHFFFAOYSA-N	435.278	1.960	50	20	IDGD	
CN(C(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccccn2)cc1)c1ccccc1	764270390	LTAVSMAOVSTSFK-UHFFFAOYSA-N	445.479	1.616	50	20	IDGD	
CC(C)NC(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)CCc2ccccc2O)c1	764288728	LLZFAINBIKRAKQ-UHFFFAOYSA-N	446.891	1.903	50	20	IDGD	
C[C@@H]1CCCC[C@@]12NC(=O)N(CC(=O)NNc1c(F)cc(C(=O)NC3CC3)cc1F)C2=O	764332071	BVDHGVIETJLUKW-WSVYEEACSA-N	449.458	1.801	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)C(=O)Nc1cccc(OCC(=O)Nc2ccccc2)c1	764354300	PMCVZQJGJPCHQV-UHFFFAOYSA-N	447.451	1.428	50	20	IDGD	
CCNC(=O)N1CCc2ccc(NC(=O)C(=O)NNC(=O)COCc3ccccc3)cc21	764366540	CAHGZVQMQBMHLW-UHFFFAOYSA-N	439.472	1.081	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@H](O)c3ccccc3Cl)CC2)cc1	765176826	OIQGWMBRERLZLT-OAQYLSRUSA-N	430.936	1.647	50	20	IDGD	
CN(C)S(=O)(=O)c1ccsc1C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C	765317771	SSNLBKUJBIXKFX-UHFFFAOYSA-N	434.540	1.064	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)c1cc(N2CCNC2=O)ccc1Cl	765319349	VTWNPVNCHKBSTH-UHFFFAOYSA-N	439.900	1.936	50	20	IDGD	
COC(=O)NNC(=O)C(=O)Nc1ccc(N2CCN(Cc3ccccc3)CC2)c(Cl)c1	765376036	KWALTBIXRUFCHQ-UHFFFAOYSA-N	445.907	1.988	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)C=C(C3CC3)C3CC3)CC2)cc1	765728616	MYAYQDBUBSDSGL-UHFFFAOYSA-N	446.573	1.195	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cnn(C)c3-n3cccc3)CC2)cc1	766649683	SJZSTMUJZOBUQS-UHFFFAOYSA-N	435.532	1.098	50	20	IDGD	
COc1cc(C(=O)NCC(=O)NNC(=S)Nc2ccccn2)ccc1OC(F)F	768578321	OSENKWNUROHTCD-UHFFFAOYSA-N	425.417	1.439	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2c(C)[nH]c(C(=O)OC)c2C)c2ccccc2c1=O	769049825	WVINSJLARICTHG-UHFFFAOYSA-N	425.445	1.613	50	20	IDGD	
Cc1oc2ncn(C)c(=O)c2c1C(=O)NNC(=O)[C@H](C)Oc1cccc(Br)c1	769421836	CXCRCYSNAQKSIM-JTQLQIEISA-N	449.261	1.826	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)c2nccn3c(Br)cnc23)cc1OC	769616232	IEPVYWHHTMNQMB-UHFFFAOYSA-N	434.250	1.974	50	20	IDGD	
CON(C)S(=O)(=O)c1cc(C(=O)O[C@@H](C)C(=O)NNC(=O)CC(C)C)ccc1Cl	771955630	WITQDQPCKNWMRA-NSHDSACASA-N	449.913	1.261	50	20	IDGD	
CCN1C(=O)c2ccccc2N2C(=O)CC[C@]12C(=O)O[C@@H](C)C(=O)NNC(=O)CC(C)C	771964996	BQTQJHVTVDWOJT-FPTDNZKUSA-N	444.488	1.111	50	20	IDGD	
CC(C)NC(=O)Nc1ccccc1C(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772898913	WQNBCLKJCSZIMC-UHFFFAOYSA-N	431.880	1.947	50	20	IDGD	
C[C@H](C(=O)NNC(=O)[C@H]1CCCN(C(=O)OC(C)(C)C)C1)n1nnc(-c2ccccc2)n1	773412244	USAHRBMNLOFAQB-ZBFHGGJFSA-N	443.508	1.696	50	20	IDGD	
COc1cc(C)c(NC(=O)C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)cc1F	773496357	KLHWUPFHGOAKOB-UHFFFAOYSA-N	426.445	1.534	50	20	IDGD	
CN1CCN(CCOc2ccc(NC(=O)C(=O)NNc3c(F)cccc3F)cc2)CC1	773714763	WZGDCSKNNLLYFH-UHFFFAOYSA-N	433.459	1.673	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccn(Cc2ccncc2)n1	774000985	BNFGFNHDHVFEHS-CYBMUJFWSA-N	442.863	1.533	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCOCC2)cc1NC(=O)NNc1ccc(C#N)cc1	775443910	AQIWPBIOQHOWBW-UHFFFAOYSA-N	431.474	1.736	50	20	IDGD	
CC(C)C[C@H]1OCCC[C@H]1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	776258231	CRHBVYCRQMSRFV-IAGOWNOFSA-N	426.539	1.475	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NNc2cccc(S(C)(=O)=O)c2)s1	776534719	RAOJCLBUMAZHPA-HNNXBMFYSA-N	443.572	1.756	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)N2CC[C@H](OCCN3CCOCC3)C2)c1C	778333867	GKDKRIOLTFCTTA-GYZZIOIESA-N	430.549	1.608	50	20	IDGD	
O=C(NNc1cc(Cl)ccn1)[C@@H]1CCCN1S(=O)(=O)c1cccc([N+](=O)[O-])c1	778446607	VOKIIAVWSBIOJK-AWEZNQCLSA-N	425.854	1.940	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3cc([N+](=O)[O-])ccc3O)n[nH]2)cc1OC	779674644	IHUTWJJVEBSVKU-UHFFFAOYSA-N	427.373	1.783	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccccc1S(=O)(=O)NC1CC1)c1cccc2ccccc12	780389983	XUIMLUDCDLPTSD-UHFFFAOYSA-N	445.522	1.904	50	20	IDGD	
COC[C@H](CNC(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12)OC	781387794	NZPRHXQXGKBTDV-INIZCTEOSA-N	439.472	1.050	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H](NC(=O)NNC(=O)CNC(=O)c2cccs2)C1	782562534	ZDSLXLGHZABUCB-CHWSQXEVSA-N	439.538	1.644	50	20	IDGD	
CCOc1cccc2[nH]cc(CC(=O)NNC(=O)c3csc(N4CCOCC4)n3)c12	782667936	XQVFEHWOKZMANW-UHFFFAOYSA-N	429.502	1.863	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)n([C@@H]2C[C@H]3CC[C@H]2C3)n1	782894164	NNTPKIIKSGIULW-RLFYNMQTSA-N	449.515	1.768	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H]1CCCCCC1=NNC(=O)CSc1nnc(O)nc1O	783822067	SEWIEHMNZUUAMT-JTQLQIEISA-N	426.499	1.705	50	20	IDGD	
O=C(NNc1ccccn1)C(=O)Nc1ccc(Cl)c(S(=O)(=O)N2CCCCC2)c1	784797876	IGGOOOMLACXIGF-UHFFFAOYSA-N	437.909	1.991	50	20	IDGD	
COCCc1cc(NC(=O)C(=O)NNc2c(F)cc(F)cc2Br)n(C)n1	785006501	CVGGXCGBEXRNCY-UHFFFAOYSA-N	432.225	1.732	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](CC(=O)NNC(=O)c1csc(N2CCOCC2)n1)C1CC1	785022461	RPUGMBJQVBDCFI-CYBMUJFWSA-N	439.538	1.434	50	20	IDGD	
Cn1c(C2CC2)nc2cc(NC(=O)C(=O)NNC(=O)Cc3cn4ccccc4n3)ccc21	785059847	BYPFIROSLLIQCD-UHFFFAOYSA-N	431.456	1.427	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)ccc1OC(C)C	785061050	RMPAFJGEFKSWJK-UHFFFAOYSA-N	425.445	1.459	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2cccc(C#N)c2)cc1S(=O)(=O)N1CCCC1	786123890	FBDSRHOHDDNTEF-UHFFFAOYSA-N	443.485	1.818	50	20	IDGD	
Cc1csc(C(=O)NNc2nc(O)c3cnn(C)c3n2)c1I	786980330	FLYNKSAJLVANSU-UHFFFAOYSA-N	430.231	1.800	50	20	IDGD	
Cn1nc([C@@H]2CCCO2)cc1NC(=O)C(=O)NNC(=O)COc1ccc(C(C)(C)C)cc1	789731871	ITYYROFQQRFYJJ-KRWDZBQOSA-N	443.504	1.734	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)[C@@H]1CC(=O)c2ccccc21	789813970	LQLKMDGXZARADC-LJQANCHMSA-N	440.931	1.975	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)CN2CCc3ccccc3C2=O)c2ccccc2c1=O	789868378	DQPKIPYKLRWOTN-UHFFFAOYSA-N	433.468	1.437	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)Cc2ccc(C(=O)NNC(=O)c3[nH]nnc3C)cc2)cc1	789868886	DWTWLCXKLALCLO-UHFFFAOYSA-N	442.501	1.317	50	20	IDGD	
CCS(=O)(=O)c1ccc([C@@H](C)NC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1	790988033	LWDJGMAEEPGNOW-ACJLOTCBSA-N	433.486	1.712	50	20	IDGD	
CCc1c(NC(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)cnn1-c1ccccc1Cl	792482351	CCNKPQQAJWYGHU-SNVBAGLBSA-N	428.902	1.179	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNS(=O)(=O)c1cncc(Br)c1	795280467	IAWVCPIBHZDKLC-UHFFFAOYSA-N	430.280	1.631	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN(C)Cc2nc(-c3cccs3)no2)cc1OC	796097541	AQZODGWLYWXNJC-UHFFFAOYSA-N	431.474	1.708	50	20	IDGD	
O=C(CN1CCC(O)(c2scnc2Br)CC1)NNC(=O)c1cccs1	797525748	RTBBRPHWWGKVTC-UHFFFAOYSA-N	445.364	1.712	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)c2[nH]nnc2-c2ccccc2)cc1	797701297	JPHNDFRGWQHNKL-UHFFFAOYSA-N	434.485	1.967	50	20	IDGD	
Cc1ccc(OCc2ccccc2)c(NC(=O)C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)c1	799835284	OORGBWNMFTUBIK-MRXNPFEDSA-N	445.497	1.095	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)N[C@H](Cn1ccccc1=O)c1ccccc1	800762048	COMOOLBQOHUZMA-LJQANCHMSA-N	430.468	1.810	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1nn(-c2cc(Cl)ccc2[N+](=O)[O-])cc1O	801386709	LXZWJLRJBMLBGI-MRVPVSSYSA-N	425.785	1.242	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NC[C@@H](O)c1cccc(Br)c1	801748609	FIKJFJFEMOPGNO-GFCCVEGCSA-N	441.307	1.304	50	20	IDGD	
O=C(CCN1CCCS1(=O)=O)NNC(=O)Nc1ccc(Br)cc1Cl	802040308	KATYYLHQJBBEOJ-UHFFFAOYSA-N	439.719	1.681	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)CN2C(=O)c3ccccc3C2=O)c(OC)cc1Cl	802077704	YJLIPCROCMTUMZ-UHFFFAOYSA-N	432.820	1.806	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2ccc(OC(F)F)nc2)n[nH]1	802567520	QEJJWSNWUZHCLQ-UHFFFAOYSA-N	446.370	1.481	50	20	IDGD	
CNS(=O)(=O)c1cc(NC(=O)C(=O)NNc2ccc(Br)cc2)ccc1F	806995667	NLFGGANNSKKRSS-UHFFFAOYSA-N	445.270	1.578	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)c(Cl)cc1F	806997636	JIHDGNSRDAEBEL-UHFFFAOYSA-N	443.888	1.951	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	807371345	JORKJNMKFHKEPJ-UHFFFAOYSA-N	438.484	1.995	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)NC1C[C@@H]2CC[C@H](C1)N2CC(=O)N(C)C	807515188	ZQAMGMMXAWSGGL-HNSVSWJLSA-N	435.500	1.007	50	20	IDGD	
O=C(NNC(=O)N1CCC[C@@H](CNS(=O)(=O)C2CC2)C1)c1ccc2ccccc2c1	808229154	PUOBNDKTQCZWAA-HNNXBMFYSA-N	430.530	1.988	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2C[C@H](c3ccccc3)OC2=O)c1	809541979	SGWRRIBEUQSSCZ-DLBZAZTESA-N	431.470	1.002	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(=NNC(=O)[C@@H]2CCS(=O)(=O)C2)[C@@H]([C@@H]2CCOC2)C1	812224139	BTXIPAWXMBOPDE-RBSFLKMASA-N	429.539	1.187	50	20	IDGD	
COc1ccc([C@@H](O)C2CCN(C(=O)NNC(=O)CNC(=O)c3ccco3)CC2)cc1	812881838	DJAWWYHXWHMYBR-LJQANCHMSA-N	430.461	1.204	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1ccc(N2CCNC2=O)cc1	812907080	QBOKEDLISLSDQY-UHFFFAOYSA-N	446.847	1.496	50	20	IDGD	
CN(C)c1cc(C#N)cc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1	814364590	ILMRPUJGJXAZDL-UHFFFAOYSA-N	441.513	1.484	50	20	IDGD	
COc1nc(N)nc(N2CCCC2)c1C=NNC(=O)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	814974271	ZRRXSTGHCOVHFD-CQSZACIVSA-N	447.540	1.765	50	20	IDGD	
CCn1c2ccccc2c2cc(NC(=O)C(=O)NNC(=O)[C@H]3CCc4nncn4C3)ccc21	815693247	QLUXCHZTALLNRJ-AWEZNQCLSA-N	445.483	1.754	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)c2ccc(NS(C)(=O)=O)cc2)C1	816510025	KPLCANZTJZGZNV-AWEZNQCLSA-N	440.522	1.466	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)c1cc(Cl)ccc1Cl)C(=O)NNc1nc[nH]n1	816633281	VUJTWDJZUAFPBK-SNVBAGLBSA-N	439.350	1.655	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)C2CCN([C@H]3CCSC3)CC2)c2ccccc2c1=O	816805976	NOCCCMMDVJTPNW-INIZCTEOSA-N	443.573	1.956	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)Cn2ccc(=O)c([N+](=O)[O-])c2)c1	818746997	XIGXJYZTSNSOIE-UHFFFAOYSA-N	425.195	1.449	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)[C@@H]2CCCN2S(=O)(=O)c2ccc(C)cc2)cc1	825536243	LRVHIMXLHIMADL-IBGZPJMESA-N	446.529	1.416	50	20	IDGD	
Cc1cc([N+](=O)[O-])c(C)cc1OC(=O)c1cccc(S(=O)(=O)N2CCNC(=O)C2)c1	912586972	FNUYZNQROPLKPO-UHFFFAOYSA-N	433.442	1.551	50	20	IDGD	
CCn1c(=O)nc(O)c2c(C(=O)NNC(=O)COc3ccc(F)cc3)cc(C(C)C)nc21	914333529	DBDORPDOZARIER-UHFFFAOYSA-N	443.435	1.620	50	20	IDGD	
O=C(NCc1nnc2ccc(C(F)(F)F)cn12)NNC(=O)c1ccc2c(c1)OCCO2	916222961	RDJBGXMLFJDOOJ-UHFFFAOYSA-N	436.350	1.664	50	20	IDGD	
CCN1CCN(Cc2ccccc2CNC(=O)NNc2ccc(-n3cccn3)nn2)CC1	916418060	ABXDVFXMVJRCMG-UHFFFAOYSA-N	435.536	1.626	50	20	IDGD	
CCCNC(=O)CN1CCC(NC(=O)NNC(=O)Cc2ccc3ccccc3c2)CC1	916518625	ACAPEQBISJNYJR-UHFFFAOYSA-N	425.533	1.703	50	20	IDGD	
Cc1c(NC(=O)[C@@H](C)SCC(=O)NNC(=O)C(C)(C)C)c(=O)n(-c2ccccc2)n1C	917180100	DCGWFNSUPNOXIP-CQSZACIVSA-N	447.561	1.738	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)[C@H](C)Sc2nncn2C)c2ccccc2c1=O	917919996	LWQQQFZFIXSXRO-ZDUSSCGKSA-N	443.533	1.657	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)NCCS(=O)(=O)c1ccc(Cl)cc1	919786103	POHQZLOYWRNPKD-UHFFFAOYSA-N	436.877	1.395	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)CNC(=O)c1ccc(Br)s1	919822825	MIYWYLIMWMIFQP-UHFFFAOYSA-N	426.292	1.639	50	20	IDGD	
O=C(CCc1ncc(-c2ccccc2Cl)o1)NNC(=O)N[C@@H]1CCS(=O)(=O)C1	919889697	RREKHSAXXAXOML-LLVKDONJSA-N	426.882	1.445	50	20	IDGD	
CC(C)N(C)S(=O)(=O)c1ccc(CNC(=O)NNc2ccc(-n3cccn3)nn2)cc1	920239749	CQASMPZRDNAWST-UHFFFAOYSA-N	444.521	1.518	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)c1cccc(NC(=O)CCn2ccnc2)c1	920422381	UCVGMWNZXYLHMH-UHFFFAOYSA-N	425.420	1.891	50	20	IDGD	
O=C(NC[C@@H]1CCN(c2ccc(F)c(F)c2)C1)NNC(=O)c1ccc(-n2cnnn2)cc1	921123463	UXBAFHTUQNECBJ-ZDUSSCGKSA-N	442.430	1.411	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(N2CCCCC2)c(NC(=O)NNC(=O)CCO)c1	1116633981	AUIXXQAJUFHYBO-UHFFFAOYSA-N	441.554	1.243	50	20	IDGD	
CN(C)CCS(=O)(=O)c1ccccc1C(=O)NNC(=O)c1cncn1-c1ccccc1	1323238975	PNMHXNPNKOUEAH-UHFFFAOYSA-N	441.513	1.282	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3nc4ccccc4n(C)c3=O)C2)C1	1777886910	LEYJKPORAHXRLN-OYHNWAKOSA-N	446.935	1.785	50	20	IDGD	
O=C(c1ccc2nccn2c1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1778014403	DSOGBADOVHPPSD-RHSMWYFYSA-N	425.258	1.468	50	20	IDGD	
C[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Cl)C1	1778030727	ZHUQNNBMYRNILD-VYGYDYRJSA-N	435.924	1.948	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4cccnc4n3)C2)C1	1778433722	JRNKVRPIPIHAFY-ORAYPTAESA-N	433.306	1.857	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c(C)c1	1779032468	LCWPRACQKSMWCN-HSZRJFAPSA-N	437.500	1.059	50	20	IDGD	
C=C(C)CC(C)(C)C(=O)N1CC[C@@]2(CN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CCO2)C1	1779241743	YJGKSFXCAWQJJA-QADUPLGGSA-N	443.548	1.943	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2nn[nH]c2C(F)(F)F)C1	1780196477	BPWNUFNSXYEILH-GLKRBJQHSA-N	437.850	1.968	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)n(C(F)F)n1	1780312183	CPEIQZVFLILNKS-SFHVURJKSA-N	430.528	1.882	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cccc(C)c3)C2)C1	1780672700	ISVYOTOOUAIHED-QADUPLGGSA-N	437.500	1.573	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](NC(C)=O)c1ccc(F)cc1)CCO2	1781218950	UHZNXOJRPOJWSH-WFXMLNOXSA-N	439.915	1.850	50	20	IDGD	
COc1ncc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@](C)(Cl)CCl)C3)C2)cc1F	1781227505	AMLKHFPIUCNXEU-QZTJIDSGSA-N	434.295	1.909	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)CCO2)C1	1781233640	CKVRAUMONOOWRY-ZWKOTPCHSA-N	446.287	1.980	50	20	IDGD	
O=C(c1cnn2ccccc12)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781330320	WHDIPBVCQGARCP-RHSMWYFYSA-N	425.258	1.468	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc3nn[nH]c3c1)C2	1782179832	NJBNGPCNGLJNJD-WIBUTAKZSA-N	435.912	1.339	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cc(=O)c4ccccc4o3)CCO2)C1	1783870161	VFSLSLOIMVXSCM-YCRPNKLZSA-N	434.876	1.490	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)n3ccnc3)[C@H]2C1	1784253677	FTPLJDVYPAWMHP-YXMSTPNBSA-N	427.343	1.455	50	20	IDGD	
CC(C)(C(=O)N1CC[C@@]2(CN(C(=O)[C@H](F)Br)CCO2)C1)c1ccccn1	1784276105	LTGBARCNNVIZDZ-KBXCAEBGSA-N	428.302	1.880	50	20	IDGD	
NC(=O)CC[C@H](N)C(=O)Nc1ccc(C2(NC(=O)CCBr)CCC2)cc1	1787977350	JLODFFOVAXUPPB-AWEZNQCLSA-N	425.327	1.498	50	20	IDGD	
Cc1nc2ncccn2c1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CO[Si](C)(C)C)C[C@@H]21	1787981051	BZYHZPZFBQQZPM-ULQDDVLXSA-N	445.596	1.483	50	20	IDGD	
CC[C@@H](Br)C(=O)NC1(c2ccc(NC(=O)CC[C@H](N)C(N)=O)cc2)CCC1	1788062394	ZJLGBBOHAVKLLI-CABCVRRESA-N	439.354	1.887	50	20	IDGD	
C[C@H](C(=O)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1)C1(O)CCC1	1788140542	WFXFUPYVLPFXKY-MRXNPFEDSA-N	436.317	1.665	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccn4ccnc4c3)C[C@@H]21	1788764310	KMBHXGFEWXTIAT-BZSNNMDCSA-N	430.581	1.779	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CC=CC[C@@H]3C(=O)OC)C[C@@H]21	1789864600	GSAFVTIIVYTSBT-QQCJEOGWSA-N	426.941	1.739	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc4cccnn4c3)[C@H]2C1	1790431714	DSMSTEZGOQQKEC-SNRMKQJTSA-N	430.581	1.779	50	20	IDGD	
CCOC(=O)O[C@@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)CBr)C[C@@H]21	1790605655	SVKUYGYDVWMYSX-YTFOTSKYSA-N	449.342	1.559	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4cccnc4[nH]3)C[C@@H]21	1791055706	FNIXXIMWKFBJBE-PCBIJLKTSA-N	435.322	1.940	50	20	IDGD	
CCOC(=O)O[C@@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]2C1	1791063977	ZJLZWJBLBSTIIZ-QMVSFRDZSA-N	435.315	1.311	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ncccc3C(F)(F)F)C[C@@H]21	1791255273	JAWHBJXMIISDCW-VIRABCJISA-N	449.857	1.948	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(Cl)c4nncn4c3)C[C@@H]21)C(Cl)Cl	1791298284	MRQIGLGMOGDRQF-GAFUQQFSSA-N	446.722	1.780	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](CN)c1ccccc1)C2	1792867956	ONTJXQUIYGXNIM-MWTISTBLSA-N	438.366	1.350	50	20	IDGD	
C[C@@H](CBr)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCc1ccc(O)nn1)C2	1792990694	GDDXUKNKHUOEDU-MHEUCROKSA-N	425.327	1.784	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1cc(O)nc(Cl)c1	1794414527	ZHWOILDFVUYGJX-FQPOAREZSA-N	436.665	1.334	50	20	IDGD	
COc1cc(OC)cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCBr)c1	1795114841	CPQWIWUNYKOMMD-ZSBFGKGUSA-N	441.322	1.692	50	20	IDGD	
O=C(Cc1c(F)cccc1Cl)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1	1796185729	KFJZEIVLERPYFX-BJWYYQGGSA-N	444.699	1.653	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1c[nH]c2cnccc12	1797564002	CIWKFEQHJCWKRG-ANGCBRKESA-N	425.258	1.457	50	20	IDGD	
Cn1ccc2cccc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)c3ccc(B(O)O)cc3)C4)c21	1797582995	ZYNYBNHZUKDJRA-ACDBMABISA-N	431.301	1.424	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(-c2cccnc2)[nH]n1	1798159472	IJCDYYHETSXMQB-CWPLJXCYSA-N	443.580	1.526	50	20	IDGD	
CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](Cl)CC	1799271343	NIRVXBIUXYZAED-DGADGQDISA-N	431.961	1.897	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccn(C(F)F)n1)C2	1799277832	QPNLAYSIDPTNSQ-DXCMXYRUSA-N	425.263	1.718	50	20	IDGD	
CCn1nc(C(C)C)cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Br	1799348313	DSTHCQLKSJUPDN-VZAMPYOESA-N	445.333	1.920	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCc1noc(-c2ccccc2)n1)[C@H](O)CCl	1799802981	ZBEDQWWXVFQWGE-YYIAUSFCSA-N	432.908	1.907	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@](C)(O)C(F)(F)F)C2	1800640128	KSBTUPITQPAOFT-MZODFIPJSA-N	431.249	1.063	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnn3c1CCC3)C2	1800643385	RWOHBFGXAUOMJE-FAXLKDOZSA-N	425.327	1.206	50	20	IDGD	
Cc1nc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)Br)c(C)s1	1800756300	AFYIECSYYFMBPO-NJYNRLGGSA-N	430.368	1.675	50	20	IDGD	
Cc1ccn2ncc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@H](C)Br)c2c1	1800757472	LWQNYJJEZYBQBR-ZJOBFFGXSA-N	435.322	1.629	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)C1Cc2ccccc2C1	1802198009	DZAHFJPMUWWDRI-YVSFHVDLSA-N	425.298	1.682	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C12CC(c3ccccc3)(C1)C2	1802218395	YMDURFXIBWHWAI-IPKWTVIASA-N	432.948	1.952	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1(c3ccc(F)cc3)CC1)C2	1802333536	YHWMCAYPONOMOW-REPLKXPHSA-N	430.524	1.869	50	20	IDGD	
Cc1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CCC(=O)NN(C)C)n(C(F)F)n1	1802336035	BTPBVJUIUKMYKT-BTTYYORXSA-N	426.468	1.211	50	20	IDGD	
Cc1noc(C)c1CCC(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1	1804599553	FOXWCVHFOWQLOA-HQRMLTQVSA-N	434.924	1.925	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@H](CNC(=O)Cc2cncnc2)[C@@H]1c1cccnc1	1804649268	QJIOGLHIRFXRDV-RXVVDRJESA-N	427.581	1.972	50	20	IDGD	
Cc1ccnc(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)c1	1807362584	MFXXBXYWEZXJLB-DENIHFKCSA-N	444.300	1.098	50	20	IDGD	
Cc1ccn(C)c1C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1807373454	BCFQIMVGEJBHSA-UGKGYDQZSA-N	446.316	1.042	50	20	IDGD	
CC(C)C1(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)CCC1	1807373727	FFCMUKIZHFMOJG-UNMCSNQZSA-N	449.360	1.907	50	20	IDGD	
O=C(CSc1ncccn1)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1	1807569648	RKJQCQYMHJGUQA-ZOBUZTSGSA-N	435.937	1.269	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](O)C(=O)N1CC[C@H](CNC(=O)[C@H](F)Cl)[C@H]1c1cccnc1	1808314445	HHJKBNTXOWFDFA-HGTKMLMNSA-N	444.891	1.465	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)[C@H]1Cc2ccccc2O1	1809579346	FDWOWAGSRNNBPL-CUDHKJQZSA-N	429.904	1.691	50	20	IDGD	
Cc1ccc(C(=O)N2CCC3(CCCN(C(=O)c4cccc(B(O)O)c4)C3)CC2)cc1O	1809980916	ZMSRIHCCABFWLE-UHFFFAOYSA-N	436.317	1.539	50	20	IDGD	
CC(=O)N[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)Br)[C@@H]1c1cccnc1	1812652130	LABJQBNWPAYPLQ-AVRGHOLYSA-N	425.327	1.395	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2cc3cn[nH]c3cn2)[C@H]1c1cccnc1	1813031383	MBEVCHKJVPGCAC-QOKNQOGYSA-N	442.907	1.926	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2ncccc2F)[C@H]1c1cccnc1	1813074159	QWUQJOPXBOCVDR-KKSFZXQISA-N	442.495	1.308	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)[C@@]2(C)CC2(F)F)[C@@H]1c1cccnc1	1814079215	QECNSPHHHBQWJS-MOXGXCLJSA-N	437.491	1.506	50	20	IDGD	
O=C1CC[C@H](C(=O)Nc2cc([C@@H]3CCCCN3C(=O)CCBr)[nH]n2)CN1	1814522792	IIBHLASRQVGZNM-AAEUAGOBSA-N	426.315	1.713	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@H]1CCc2nc(NC(=O)Cn3cccn3)sc2C1	1815707248	ZOQHHCYNHARWCL-QWRGUYRKSA-N	426.340	1.983	50	20	IDGD	
Cc1ncccc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1816391656	FLAPMPPELJCDGB-LJQANCHMSA-N	433.277	1.413	50	20	IDGD	
C[C@H](C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1)n1cccc1	1817474854	HSCOOHYZNICCHL-BEFAXECRSA-N	435.293	1.458	50	20	IDGD	
C=CCO[C@H](C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819401618	LCAYALLYDUHBJZ-DYVFJYSZSA-N	441.492	1.305	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](O)CCl)CC2)c1nc(O)n2c1CCCC2	1820232801	KARVATUHRDDALA-JOYOIKCWSA-N	439.925	1.207	50	20	IDGD	
COc1cccc(OC)c1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](O)CCl)CC2	1821941725	UGUKLEUKXYFERP-CMPLNLGQSA-N	439.921	1.986	50	20	IDGD	
C[C@@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1)n1cccn1	1822416734	MMVGLVJZLDBCPU-GOEBONIOSA-N	430.513	1.233	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)[C@H](C)N3CCN(C)CC3)sc2C1	1822702365	PFGPQKANRKAVEF-MELADBBJSA-N	428.002	1.708	50	20	IDGD	
O=C(CCNC(=O)c1ccccc1)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1	1823352835	MSPPZRVVCMNGHG-DLBZAZTESA-N	447.923	1.822	50	20	IDGD	
Cc1ncc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)cn1	1825700000	OZXYJMOIRHFHRE-OAQYLSRUSA-N	436.321	1.012	50	20	IDGD	
C=CCSCC(=O)N[C@@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1	1826082627	ADRWUMGZWKYIKU-GFCCVEGCSA-N	425.580	1.347	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)CC(F)(F)F)CC1	1826674133	HLYSYIMUQZZGIP-KRWDZBQOSA-N	426.244	1.552	50	20	IDGD	
CC[C@H](C)[C@@H](N)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1	1828925346	JWHLEAZSLJDQSU-RYGJVYDSSA-N	444.580	1.292	50	20	IDGD	
COCc1c[nH]c(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)c1	1829631003	KSDRETJEYCYIMM-HXUWFJFHSA-N	447.580	1.767	50	20	IDGD	
O=C(COc1cccc(Cl)c1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1830278524	DCTCHLYRORNXRR-WMZOPIPTSA-N	435.279	1.710	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1	1831655854	AHHHMYWLNCIFOB-HOCLYGCPSA-N	445.402	1.763	50	20	IDGD	
COC(=O)[C@@H]1CC[C@@H](C(=O)NC2CCN(C3CCN(C(=O)C(Cl)Cl)CC3)CC2)C1	1833307479	UZJDASRZQHSCDK-ZIAGYGMSSA-N	448.391	1.951	50	20	IDGD	
CC(C)N1CCC(C(=O)N2CCC(N3CCC(NC(=O)[C@H](O)CCl)CC3)CC2)CC1	1833308167	KQWNFJDSFSRAHA-HXUWFJFHSA-N	443.032	1.278	50	20	IDGD	
CC(C)N[C@H](C(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)CCl)CC2)CC1)C(C)C	1833310802	SYMITLZXSUUPLY-OALUTQOASA-N	431.021	1.180	50	20	IDGD	
C[C@H](Nc1ccccn1)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](F)Cl)CC2)CC1	1835084161	OHSPGZHYJGPVMF-KBXCAEBGSA-N	425.936	1.988	50	20	IDGD	
Cn1ccc2cccc(C(=O)NC3CCN(C4CCN(C(=O)[C@H](O)CCl)CC4)CC3)c21	1835399272	WARLXVHYMBIPDQ-HXUWFJFHSA-N	446.979	1.963	50	20	IDGD	
CC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)c3cnc(O)nc3O)CC2)CC1	1836393997	GQUOYWRWWYHVET-HNNXBMFYSA-N	425.917	1.090	50	20	IDGD	
CC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)COc3ccc(O)nn3)CC2)CC1	1836397269	BUTHYKHHOGUNBL-INIZCTEOSA-N	439.944	1.150	50	20	IDGD	
CC(=O)NC(C)(C)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](C)Br)CC2)CC1	1836879127	VBOKIWOORPUBEW-CYBMUJFWSA-N	446.386	1.683	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(F)nc3)C2)C1	1837715179	BGQHVXKVPOCKBI-IBGZPJMESA-N	425.533	1.142	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)c3ccccc3F)CC2)CC1	1838568468	HUSWMIJAROVYJV-UHFFFAOYSA-N	448.539	1.811	50	20	IDGD	
C[C@H](C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2)C1(O)CCC1	1839149921	WGSSVPBPMPGLEG-JLSDUUJJSA-N	437.364	1.230	50	20	IDGD	
Cc1cc(C)n(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)n1	1839150413	LVYOUJGOFCNOMK-OALUTQOASA-N	447.363	1.193	50	20	IDGD	
O=C([C@H](F)Br)N1CCO[C@]2(COCCN(C(=O)[C@H]3C[C@@]3(F)Cl)C2)C1	1839203048	XOZITHDACJFXMJ-OAACRXHESA-N	431.661	1.058	50	20	IDGD	
O=C(c1ccnc2c(O)cccc12)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1839606883	YLHBOJDAPMJSAK-FXAWDEMLSA-N	437.855	1.545	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H](O)Cc3ccccc3)CCO2)C1	1839956601	VUJCFXARIZMHGO-IPJJNNNSSA-N	438.952	1.454	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(F)nc3)C2)C1	1839964768	BUQVNONJBQGMGB-RDTXWAMCSA-N	444.301	1.464	50	20	IDGD	
Cc1nc(C)c(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)s1	1840031519	SHQZYQIRXXKYMN-GTNSWQLSSA-N	446.367	1.613	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)cn1	1840031536	SWGIFYRKKKSZEC-RDTXWAMCSA-N	426.311	1.243	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1C[C@H]1c1ccccc1)CCO2	1840121053	DZYZOLCAYYFHTP-ZVVDCOBXSA-N	436.936	1.500	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(OC)c3)C2)C1	1840154364	VLJHKKHHIOWDKL-YLJYHZDGSA-N	426.897	1.019	50	20	IDGD	
CC(C)(C(=O)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1)c1ccccn1	1840330192	OYAFMTJNFJKTHV-IBGZPJMESA-N	430.332	1.619	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CCCn3cccc3)CCO2)C1	1840463263	YXJQWJUOIUYADC-VQIMIIECSA-N	442.354	1.508	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@]1(C)CC1(F)F)CCO2	1840829577	KAYQTAYLZVHVSX-GLQYFDAESA-N	425.270	1.272	50	20	IDGD	
C=CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)[C@@H](Cl)COC)C2	1841748448	XEOHEAKRLHTRGQ-LSDHHAIUSA-N	429.945	1.913	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@H]2CC(=O)N(Cc3cccs3)C2)C1	1841980549	XUVRNJOKBLXTAQ-GOEBONIOSA-N	439.965	1.554	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)CCc2ncccc2C)C1	1841992474	FKXHFQCCIWGIHR-YZSQISJMSA-N	436.516	1.660	50	20	IDGD	
C[C@H](Br)C(=O)N1CC2(CCCN2C(=O)CCS(=O)(=O)c2ccccc2)C1	1842744919	OHBXQUCKKVSCIC-AWEZNQCLSA-N	443.363	1.837	50	20	IDGD	
O=C(c1cccc(-c2cnco2)c1)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843014675	NAXBBSSMQTWNHQ-UHFFFAOYSA-N	431.257	1.152	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1nnsc1C1CC1)C2	1843415929	FACGNXBQEJZMPF-WSDLNYQXSA-N	441.517	1.367	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)C1(c3ccccc3F)CC1)C2	1844265495	JFDKJDGPVWUJJY-UHFFFAOYSA-N	437.475	1.373	50	20	IDGD	
Cc1ccc(=O)n(C(C)(C)C(=O)N2CC3(CCCN3C(=O)[C@H](F)Br)C2)n1	1845217978	GGYAGHLILKELDN-ZDUSSCGKSA-N	429.290	1.181	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)CCOCCNC(=O)OC(C)(C)C)C2	1846360657	XTAAMDLLMPHRQM-OAHLLOKOSA-N	447.960	1.375	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)Cc1ccc(S(C)(=O)=O)cc1)C2	1846361173	CQBBAKKCXXWUFD-MRXNPFEDSA-N	428.938	1.090	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)[C@H](C)n2cccn2)C1	1846618917	IKFKHWGJOAKSJK-AWEZNQCLSA-N	441.444	1.795	50	20	IDGD	
C#CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)[C@H](C)Br)C2	1847071680	WSDRACQBVMIWIJ-KBPBESRZSA-N	442.354	1.890	50	20	IDGD	
Cc1cccc(NS(=O)(=O)c2ccc(C(=O)NNC(=O)C(=O)NC3CC3)cc2)c1C	9890008	XQBONTLAAGIKDB-UHFFFAOYSA-N	430.486	1.144	50	20	IDGD	
COc1ccc(CC(=O)OCC(=O)NNC(=O)c2cc(Cl)ccc2OC)cc1OC	11527226	UWPUZVWUHYLAII-UHFFFAOYSA-N	436.848	1.913	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)cc(OC)c1OCC(N)=O	15758608	HYXPDRYLJQGVGZ-CQSZACIVSA-N	445.472	1.413	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2ccccc2Br)cc1	17406304	UMMHDRLQCIHVDY-UHFFFAOYSA-N	440.319	1.839	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)c1ccc2c(c1)C(=O)N(C[C@H]1CCCO1)C2=O	17580875	QEAPWFWXXKWBFR-OAHLLOKOSA-N	447.451	1.493	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)c(N2CCCC2=O)c1)c1ccc(-n2cnnn2)cc1	23787585	NLPOAMSTFOFMHE-UHFFFAOYSA-N	425.836	1.517	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNS(=O)(=O)c2cc([N+](=O)[O-])ccc2OC)cc1	28808356	MRWCJKRMADLWKG-GFCCVEGCSA-N	439.446	1.779	50	20	IDGD	
COc1cccc(-n2ccnc2SCC(=O)NNC(=O)CNC(=O)c2cccs2)c1	725741083	LIMZCFJKNQUCEM-UHFFFAOYSA-N	445.526	1.612	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)N1CCCN(CCCc2ccccc2)CC1	725872205	BPMBTCLFEWYCBX-UHFFFAOYSA-N	443.573	1.859	50	20	IDGD	
COc1ccc(C(=O)Nc2cc(F)ccc2C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)cc1	726524054	OFUHESNYUBPNMU-ZDUSSCGKSA-N	449.460	1.282	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCOCC2)cc1C(=O)NNc1ccc(F)c(F)c1F	727759366	ZGEPOWBYNZTJSK-UHFFFAOYSA-N	445.419	1.890	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)c1ccc(I)cc1Cl	727996592	WKYVENKOBSCOAD-UHFFFAOYSA-N	447.616	1.729	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)CN2C(=O)c3ccccc3N3C(=O)CC[C@@]23C)c(C)c1	728205657	WWGHKAJAJFZXHL-DEOSSOPVSA-N	449.511	1.862	50	20	IDGD	
CCOc1ccccc1[C@@H](CC(=O)NNC(=O)CNC(=O)c1cccs1)NC(C)=O	728241092	PYDNEIZDWXFEBP-OAHLLOKOSA-N	432.502	1.292	50	20	IDGD	
COc1ccc2c(ccn2CC(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1	728328088	GDVZSTFZYNKSAN-IBGZPJMESA-N	439.424	1.181	50	20	IDGD	
C[C@H]1Cc2ccccc2N1Cc1ccoc1C(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1	728518492	UTKZEMYVABFOIZ-XJKSGUPXSA-N	432.502	1.362	50	20	IDGD	
O=C(NCc1cccc(N2CCOC2=O)c1)NNC(=O)C1CCN(c2ncccn2)CC1	728959841	QRXDHLGBICHREE-UHFFFAOYSA-N	439.476	1.180	50	20	IDGD	
CCCN(CCC)C(=O)CCC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	729282530	ANALKAPUYIRIEA-UHFFFAOYSA-N	426.539	1.127	50	20	IDGD	
CC(C)c1[nH]nc(C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c1Br	730095456	DDSCKMOPVPAZIL-UHFFFAOYSA-N	433.266	1.617	50	20	IDGD	
O=C(CSc1nnc(O)nc1O)NN=Cc1cc(Br)c2c(c1)OCO2	730558248	GFUMSJVWCRWJMV-UHFFFAOYSA-N	428.224	1.016	50	20	IDGD	
CCNS(=O)(=O)CCNC(=O)NNC(=O)CCCOc1ccc(Cl)cc1Cl	731759228	KLWFYAKHHUJTMR-UHFFFAOYSA-N	441.337	1.422	50	20	IDGD	
CC[C@@H](C)C(=O)N1Cc2ccccc2C[C@H]1C(=O)OCC(=O)NNC(=O)c1ccccc1	733532483	ZWCDWLKWZOORMN-UZLBHIALSA-N	437.496	1.990	50	20	IDGD	
N#CCCn1cc(/C=C(\C#N)C(=O)NS(=O)(=O)[C@H]2CCOC2)c(-c2ccccc2)n1	733722231	UVPFGLMZGGGPMD-FYXHJSOBSA-N	425.470	1.606	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NCc1nc(-c2ccc(Cl)cc2)no1	734524307	CIKIOOOCWWSYCV-UHFFFAOYSA-N	434.865	1.712	50	20	IDGD	
CN1CCN(CCCCNC(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)CC1	737065538	RYQVYEBZMISLDV-UHFFFAOYSA-N	437.488	1.634	50	20	IDGD	
CC(C)(C)Cc1nc(-c2cccc(C(=O)NNC(=O)N[C@H]3CCS(=O)(=O)C3)c2)no1	741671253	HHJZNXLIGCWMKF-AWEZNQCLSA-N	435.506	1.456	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)n1	744421524	IRQPSUSDTXFCRQ-UHFFFAOYSA-N	433.490	1.593	50	20	IDGD	
CC(=O)CCc1ccc(O[C@H](C)C(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1	745108105	WLXOLXKINBESKT-OAHLLOKOSA-N	446.529	1.730	50	20	IDGD	
CC(=O)N[C@@H](CC(=O)OCC(=O)NNC(=O)c1ccc(C)cc1)c1ccc(F)cc1F	745141744	PTOUBXLLNNJDEA-SFHVURJKSA-N	433.411	1.845	50	20	IDGD	
Cc1ccc(-n2c(NNC(=O)c3nc(O)nc(O)c3N)nc3ccccc3c2=O)c(C)c1	746257614	DCMYWLDUFHMQOY-UHFFFAOYSA-N	433.428	1.543	50	20	IDGD	
O=C(NNC(=O)c1ccc2n[nH]cc2c1)c1cccc(S(=O)(=O)N2CCCCC2)c1	746580294	UXMCRCXMHOZKAT-UHFFFAOYSA-N	427.486	1.812	50	20	IDGD	
CC(C)Oc1cc(Br)cc(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)c1	746594265	MGNOKRCHWPNVPN-GFCCVEGCSA-N	434.312	1.367	50	20	IDGD	
COC[C@@H](NC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)c1ccc(C)o1	746778559	WTKIYNAEGNJOFV-LJQANCHMSA-N	429.521	1.818	50	20	IDGD	
O=C(CCn1cc([N+](=O)[O-])cn1)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1	747784189	PAXZYHVBBKPPKA-OAQYLSRUSA-N	448.483	1.956	50	20	IDGD	
NC(=O)N1CCC[C@@H](C(=O)NNC(=O)[C@H]2Cc3ccccc3CN2Cc2ccccc2)C1	747787457	QMDZORYZEDGMQU-NHCUHLMSSA-N	435.528	1.552	50	20	IDGD	
COc1ccc(-c2nn(CCC#N)cc2/C=C(/C#N)C(=O)N[C@H](C)CC(N)=O)cc1OC	748715997	JCNFPSCBUUBOND-KWZJRMENSA-N	436.472	1.768	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)[C@H]2CCCN2S(=O)(=O)c2cccs2)c1O	749267259	SOAPDKRRJWEJIU-GFCCVEGCSA-N	425.488	1.077	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)c1cnc2c(cnn2Cc2ccccc2)c1	751208890	IYAIRWQTONYUSI-UHFFFAOYSA-N	434.481	1.732	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)Cc2ccccc2F)c(C)c([N+](=O)[O-])c1	753839463	ACKKRFRBMRYVKL-UHFFFAOYSA-N	432.364	1.158	50	20	IDGD	
O=C(CSCc1nc(O)c2c3c(sc2n1)CCCC3)NNC(=O)Cc1cc[nH]n1	755287240	VOXFTIXETWKVNQ-UHFFFAOYSA-N	432.531	1.622	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)NC1CCN(S(=O)(=O)C(F)(F)F)CC1	755304058	UYMACYNUMLOFPL-UHFFFAOYSA-N	426.392	1.013	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)Nc2cc(F)cc(S(N)(=O)=O)c2)cc1	756516141	QOJSSNGJGUTFFG-NSHDSACASA-N	438.437	1.296	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)cc1OC	761793435	HIQLTVVFMXRUDM-QGZVFWFLSA-N	426.473	1.839	50	20	IDGD	
O=C(NNC(=O)c1ccn(C2CCCC2)n1)c1ccc(S(=O)(=O)N2CCCC2)cc1	763125774	SRPIAMLCCWXOSQ-UHFFFAOYSA-N	431.518	1.858	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)C(=O)Nc1cc(F)ccc1Br	763455077	NHDVYTNDDKTSLY-UHFFFAOYSA-N	425.170	1.896	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)C(=O)Nc1ccccc1OCC(F)(F)F	763550771	GQEIVJFDEUZXJL-UHFFFAOYSA-N	425.319	1.756	50	20	IDGD	
CC(C)OCCOCc1cccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)c1	763551234	LFMYMYSSQNQEJP-UHFFFAOYSA-N	443.456	1.757	50	20	IDGD	
Cc1cccc(C(=O)N2CCCC2)c1NC(=O)C(=O)NNC(=O)COc1ccc(C#N)cc1	763675428	WBWYKPOLDGMDOD-UHFFFAOYSA-N	449.467	1.268	50	20	IDGD	
CSc1ccc(NC(=O)C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)cn1	763790350	IGQGFMBZISBTRY-UHFFFAOYSA-N	440.485	1.494	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)ccc1F	763796791	IEBGRQYXKFMOGP-UHFFFAOYSA-N	448.476	1.318	50	20	IDGD	
Cc1ccc(Cn2nc(C)c(CCC(=O)NNC(=O)CNC(=O)c3cccnc3)c2C)cc1	763820637	OHDBHWCZKAWCJU-UHFFFAOYSA-N	448.527	1.762	50	20	IDGD	
CC[C@H](C)n1nc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(C(C)=O)cc2)cc1C	763879560	YHQFXRULMNGKJQ-WFASDCNBSA-N	429.477	1.919	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccc3c(c2)nc(C(C)(C)C)n3C)n1	763880836	JLSCQUVIRFNGOB-UHFFFAOYSA-N	425.493	1.470	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CC[C@H](C)C3)cc1S(C)(=O)=O	763939228	BMZRVXBNHUDPFC-NSHDSACASA-N	449.554	1.985	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Br)s2)c(Cl)n1	763942141	VORFSZFVLBFJPE-UHFFFAOYSA-N	433.671	1.967	50	20	IDGD	
C[C@@H]1COCCN1c1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1	764003878	JVFYULIWJVZMAN-CQSZACIVSA-N	440.456	1.083	50	20	IDGD	
COc1ccc(S(=O)(=O)C[C@@H](C)C(=O)NNC(=O)CSc2ccccc2O)cc1	764045120	BRYWJMUBKNDXED-CYBMUJFWSA-N	438.527	1.750	50	20	IDGD	
COc1ccc(Br)c(NC(=O)C(=O)NNC(=O)c2ccc(Cl)nc2)c1	764092846	OPGWPXSMEPKDCN-UHFFFAOYSA-N	427.642	1.906	50	20	IDGD	
O=C(CCc1ccco1)NNC(=O)C(=O)Nc1cccc(C(=O)NCc2ccccn2)c1	764170084	UASOVDZVUZZLBZ-UHFFFAOYSA-N	435.440	1.323	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(OC)c(NC(=O)C(=O)NNC(=O)CC(C)(C)C)c1	764202101	KRSUMUHQPJQBIN-UHFFFAOYSA-N	442.538	1.248	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)C(=O)Nc1ccnn1-c1ccccc1	764204633	QQJOCXHUMWXKJC-UHFFFAOYSA-N	430.465	1.263	50	20	IDGD	
CN(Cc1cccc(NC(=O)C(=O)NNC(=O)Cc2cccnc2)c1)C(=O)OC(C)(C)C	764268324	HFYBVAYNDATEBX-UHFFFAOYSA-N	441.488	1.777	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)Cc2ccccn2)cccc1C(=O)Nc1ccccc1	764268521	WIJJJNSFPNIHQX-UHFFFAOYSA-N	431.452	1.971	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)Cc2cccnc2)cccc1-c1nnc2n1CCCCC2	764268973	ZRRXNYRBGDYXPK-UHFFFAOYSA-N	447.499	1.704	50	20	IDGD	
COc1nccnc1NNC(=O)C1CCN(S(=O)(=O)c2ccc(C(C)=O)cc2)CC1	764471263	RJNSQUUJMHYMEY-UHFFFAOYSA-N	433.490	1.232	50	20	IDGD	
C#CCNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)cc1	765568263	OYSSMJIZDNUUAJ-UHFFFAOYSA-N	429.483	1.125	50	20	IDGD	
Cc1nc(-c2ccco2)ccc1C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765734984	GMEKBKMKVGUPNP-UHFFFAOYSA-N	447.495	1.869	50	20	IDGD	
CCOc1ccc(NC(=O)CN2CCN([C@H](C)C(=O)NNC(=O)CC(C)C)CC2)cc1	767058938	QMMLUERBYMARIN-QGZVFWFLSA-N	433.553	1.223	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNC(=O)c2c(C)nc3ccccn23)c2ncccc12	768233210	LHKDTPAOCXJQDL-UHFFFAOYSA-N	432.440	1.989	50	20	IDGD	
CC(C)c1cc(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)n(-c2ncccn2)n1	768238764	UMBQAHXOVSRMQT-UHFFFAOYSA-N	441.423	1.090	50	20	IDGD	
O=C(NNC(=S)Nc1ccccn1)c1ccc(S(=O)(=O)NCc2ccco2)cc1	768584124	KJOVSIDRGFUMAU-UHFFFAOYSA-N	431.499	1.785	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2csc(NC3CC3)n2)c1	768917840	FVILWWIBMPKLHO-UHFFFAOYSA-N	437.547	1.823	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)CCc2cnn(-c3ccccc3)c2)ccc1Cl	769253953	USMDZQVCJGDTHF-UHFFFAOYSA-N	447.904	1.567	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)c1cc(Br)cc([N+](=O)[O-])c1	770176667	KTNWSONZODPALY-UHFFFAOYSA-N	446.258	1.826	50	20	IDGD	
CSCCNC(=S)NNC(=O)CC[C@@H]1NC(=O)N(c2ccc(Cl)cc2)C1=O	770247184	NMNAUUIRSYVONV-LBPRGKRZSA-N	429.955	1.403	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CN2C(=O)N[C@@](C)(c3ccc(Br)cc3)C2=O)o1	771277990	XHGVYMXKGZHMFS-SFHVURJKSA-N	449.261	1.579	50	20	IDGD	
CCc1c(C(=O)NNC(=O)CCN2C[C@@H](C)O[C@H](C)C2)cnn1-c1ccc(OC)cc1	771712886	IGOOUWWAIJYPBD-HZPDHXFCSA-N	429.521	1.704	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1cccc(S(=O)(=O)N(C)c2ccccc2)c1	771868442	PFVJLKXWZGVYBH-AWEZNQCLSA-N	433.486	1.614	50	20	IDGD	
COc1ccc([C@H](OC)[C@@H](C)NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1	772076495	KZSQXYDOHNZMAK-FZKQIMNGSA-N	435.502	1.819	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1ccc2ncc(I)n2c1	772167205	JHEFRKFMRWDMCP-QMMMGPOBSA-N	430.202	1.042	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)CN(C)S(=O)(=O)c1ccccc1	772970450	CMGMIVYOTOWNIS-ZDUSSCGKSA-N	425.894	1.575	50	20	IDGD	
Cc1cn2c(=O)c(C(=O)NNC(=O)[C@@H]3CCCN(C(=O)OC(C)(C)C)C3)cnc2s1	773411986	SQQHZXFHZNEIOP-GFCCVEGCSA-N	435.506	1.473	50	20	IDGD	
Cc1ccc(I)cc1NC(=O)C(=O)NNC(=O)Cc1cccnc1	773496886	QEZQLDUVPPRRJJ-UHFFFAOYSA-N	438.225	1.323	50	20	IDGD	
COC(=O)c1c(F)cccc1NNC(=O)c1cc(S(N)(=O)=O)ccc1Br	773618816	CXEOXGSUNQZCCB-UHFFFAOYSA-N	446.254	1.779	50	20	IDGD	
O=C(NNc1ccccc1[N+](=O)[O-])C(=O)Nc1ccccc1S(=O)(=O)N1CCCCC1	773654586	ZKROZGQZMSKVBB-UHFFFAOYSA-N	447.473	1.851	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNc2cccc(Cl)c2)ccc1S(=O)(=O)N(C)C	773741698	WKXMDBUSLDORLJ-UHFFFAOYSA-N	426.882	1.681	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)N2CCN(c3nnc(C(F)(F)F)s3)CC2)c1	776874764	OLBUTUIYHJOOJC-UHFFFAOYSA-N	425.396	1.605	50	20	IDGD	
CCOC(=O)N1CCC([C@@H](C)NC(=O)NNC(=O)CNC(=O)c2cccs2)CC1	777497842	GCNJSJAMCOAHIT-GFCCVEGCSA-N	425.511	1.065	50	20	IDGD	
Cc1cc(C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)nn1[C@H](C)C1CC1	777524163	SJYSNYANKAHSEN-OAHLLOKOSA-N	447.565	1.251	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CN2CCNC(=O)[C@@H]2c2ccc(C(F)(F)F)cc2)c1	777714653	YEEOQEWFLVLEKX-SFHVURJKSA-N	434.418	1.948	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)c2ccc(Cl)c(S(=O)(=O)N(C)C)c2)nc1C	778425328	QFSHYMJUTIGFPB-UHFFFAOYSA-N	441.897	1.622	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N[C@H](CO)c1cnn(C)c1	778589750	RNRGTEFUIJNZEA-IINYFYTJSA-N	426.271	1.014	50	20	IDGD	
Cc1cc(C)n(-c2ccc(CCNC(=O)NNC(=O)CNC(=O)OC(C)(C)C)cc2)n1	778617643	UZUPDUXDIHEIBO-UHFFFAOYSA-N	430.509	1.887	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2cc(Br)c(OC)cc2OC)n1	778729348	NRDDTVVZWVIJQH-UHFFFAOYSA-N	426.227	1.347	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)[C@H](NS(=O)(=O)c1ccc(C)cc1)[C@@H](C)O)c1ccccc1	779515774	BKQMRXYBGOHGJU-AYOQOUSVSA-N	433.530	1.364	50	20	IDGD	
Cc1ccc(-c2ncccc2NC(=O)C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)s1	782703240	WVGDPGFPLLLUGK-UHFFFAOYSA-N	448.468	1.494	50	20	IDGD	
COc1cccc(Cn2nccc2NC(=O)C(=O)NNC(=O)c2ccc(O)cc2)c1OC	782831564	TXQSZDSAPLWCHC-UHFFFAOYSA-N	439.428	1.054	50	20	IDGD	
Cc1ccccc1NC(=O)NNC(=O)C(=O)Nc1cccc(S(=O)(=O)NC(C)(C)C)c1	783415228	ZMLFEKNJVBDBTR-UHFFFAOYSA-N	447.517	1.863	50	20	IDGD	
Cc1ccccc1NC(=O)NNC(=O)C(=O)Nc1cccc(C(=O)N2CCOCC2)c1C	783415718	GMDCQNPLTUDNEJ-UHFFFAOYSA-N	439.472	1.567	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ccccn2)cc1S(=O)(=O)N1CCCCC1	784798735	YZTCNBKGULEPTA-UHFFFAOYSA-N	433.490	1.347	50	20	IDGD	
CN(C)C(=O)COc1ccc(NC(=O)C(=O)NNc2ccc(Br)nc2)cc1	784806961	JHTICPWRJSQLMO-UHFFFAOYSA-N	436.266	1.393	50	20	IDGD	
COc1cccc(NNC(=O)C(=O)Nc2ccc(C)c(S(=O)(=O)N3CCCCC3)c2)n1	784853138	YRTONUQUJZFVOC-UHFFFAOYSA-N	447.517	1.655	50	20	IDGD	
Cc1ccc(Br)cc1NC(=O)C(=O)NNC(=O)Cc1cn2ccccc2n1	785068631	YFZDSHUDZPURHE-UHFFFAOYSA-N	430.262	1.734	50	20	IDGD	
CCn1nnnc1-c1cccc(NC(=O)C(=O)NNc2nc(C(F)(F)F)cs2)c1	785146609	XLTULAKRBWOMBD-UHFFFAOYSA-N	426.384	1.917	50	20	IDGD	
CCOc1ccc(C(=O)NNS(=O)(=O)c2cc(F)ccc2OCCOC)cc1OC	786725580	XDYVUCUWHZRIPD-UHFFFAOYSA-N	442.465	1.882	50	20	IDGD	
CN1CCN(c2ccc(NC(=O)C(=O)NN=c3cc[nH]cc3)cc2Br)CC1	787897012	TYPLXLGSKWCDQY-UHFFFAOYSA-N	433.310	1.100	50	20	IDGD	
C[C@H](NS(=O)(=O)c1cccc(C#N)c1)C(=O)NNc1nnc(-c2ccccn2)s1	788556083	FDNNTPRRJDXPOY-NSHDSACASA-N	429.487	1.282	50	20	IDGD	
COc1cc(C)nc(NNC(=O)NC[C@H](Cc2cccc(F)c2)C(=O)N2CCOCC2)n1	789310616	PWFXVEVLEGQAPB-INIZCTEOSA-N	446.483	1.277	50	20	IDGD	
Cc1sc2nc(CS[C@H](C)C(=O)NNC(=O)CN3CCCC3=O)nc(O)c2c1C	789856268	CWSRDNLPWCSYHP-LLVKDONJSA-N	437.547	1.405	50	20	IDGD	
Cc1cc(OCC(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)ccc1Cl	789894571	ZETYGMIJTPIEJA-QGZVFWFLSA-N	434.832	1.558	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccc2c1OCC[C@@H]2OC	790951565	JDNUQZIYQMAHFR-HNNXBMFYSA-N	429.429	1.330	50	20	IDGD	
COc1ccc(OC)c(C2=NO[C@@H](C(=O)NNC(=O)c3ccc(OC)c(OC)c3)C2)c1	791450892	YNJBOWVFGNDIBL-LJQANCHMSA-N	429.429	1.675	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)cc(-n2cccn2)c1	792352775	JVKPSTLJFIZYMP-ZDUSSCGKSA-N	441.419	1.573	50	20	IDGD	
CNC(=O)c1cc2cc(NC(=O)C(=O)NNC(=O)[C@H]3OCC[C@H]3c3ccccc3)ccc2[nH]1	792368746	PYMOIFSJYYBASG-LPHOPBHVSA-N	449.467	1.186	50	20	IDGD	
CC(=O)NC[C@@H]1CCn2ncc(C(=O)NNC(=O)c3cc4c(s3)CC[C@H](C)C4)c2C1	792736190	LMOWEIGKQCMIAM-GXTWGEPZSA-N	429.546	1.843	50	20	IDGD	
O=C(CN1C(=O)C(F)(F)Oc2ccccc21)NNC(=O)c1cnn(-c2ccccc2)c1	794333011	YPIQACRWHBUHKJ-UHFFFAOYSA-N	427.367	1.652	50	20	IDGD	
CC(C)n1nccc1C=NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	794464712	HSEGPGQWOMSLTH-UHFFFAOYSA-N	433.534	1.568	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)CN2C(=O)C(F)(F)Oc3ccccc32)c1	796067257	XJMBZJZFDPCEKO-UHFFFAOYSA-N	433.367	1.318	50	20	IDGD	
Cc1ccc([C@@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)CNC(=O)c2ccco2)cc1	797717818	GHGXDNOFQZJFKO-QGZVFWFLSA-N	430.461	1.731	50	20	IDGD	
CCOCCCn1c(NNC(=O)c2cncc(-n3ccnn3)c2)nc2ccccc2c1=O	801896951	BARYLTLYIANZQI-UHFFFAOYSA-N	434.460	1.556	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)CN2CCN(c3ccccn3)CC2)cc1Cl	802076600	OWILAOHZDYMCFS-UHFFFAOYSA-N	448.911	1.727	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)Cn2nnc3ccccc3c2=O)c(OC)cc1Cl	802078757	UOEMXOCPBOBMSQ-UHFFFAOYSA-N	432.824	1.315	50	20	IDGD	
CN(CCC(=O)N1CCN(S(=O)(=O)CBr)CC1)C(=O)OC(C)(C)C	803037997	MQTFZYJVDCHAIO-UHFFFAOYSA-N	428.349	1.070	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)C(=O)Nc1cc(F)c(N2CCOCC2)cc1F	806980571	ZQKGJZGVFLFOCM-UHFFFAOYSA-N	436.390	1.269	50	20	IDGD	
COc1cccc([C@@H](CNC(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)N(C)C)c1	807005204	BZFVRWWSZANOCN-QGZVFWFLSA-N	446.504	1.968	50	20	IDGD	
C[C@@H](C(=O)N1CCN(S(=O)(=O)CBr)CC1)n1ccc2ccccc2c1=O	807196332	KGCWCCYTSLVBDT-ZDUSSCGKSA-N	442.335	1.389	50	20	IDGD	
COc1cc(NC(C)=O)c(Cl)cc1S(=O)(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	808066416	YQKIHJFYOGYEEV-UHFFFAOYSA-N	442.837	1.839	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCN(c2ccccc2Cl)C1)c1csc(N2CCOCC2)n1	809980824	WMCGDYLNESOREW-ZDUSSCGKSA-N	435.937	1.921	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)nn1C1CCCCC1	810384516	LYUQKIIFCSPAFY-UHFFFAOYSA-N	447.517	1.500	50	20	IDGD	
COC(=O)c1c(F)ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)c1F	810386097	MCTSFLULZCLOOV-GFCCVEGCSA-N	449.410	1.922	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccc(F)cc2OC(F)F)cc1	813033326	NVCSTGPAVJDJDN-UHFFFAOYSA-N	446.407	1.759	50	20	IDGD	
C[C@@H](C#N)Oc1ccccc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	813033407	RMWOSTGMKDLMAP-ZDUSSCGKSA-N	431.474	1.310	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCC2(COC)CCOCC2)nc1	813772308	XGGNJDXOBZEASR-UHFFFAOYSA-N	429.543	1.181	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)c2ccc3c(c2)NC(=O)CNC3=O)cc1OC	814248408	SQPKRRNBEWDIAC-UHFFFAOYSA-N	440.456	1.631	50	20	IDGD	
COC(=O)c1ccc(C(=O)NNC(=O)c2ccc(CSc3nncn3C)cc2)n1C	814717697	REAKMWYQBJNISL-UHFFFAOYSA-N	428.474	1.307	50	20	IDGD	
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC(=NNC(=O)Nc2ccc3c(c2)OCO3)CC1	814993888	JNUIGLMHRQJUOT-UHFFFAOYSA-N	434.478	1.717	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)N(C)C)cc2cccnc12	815752235	JZUTZOYEYGWBPO-UHFFFAOYSA-N	443.485	1.576	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNc2ncncc2F)cc(Br)c1F	815764653	PCDKLTKPXASXLF-UHFFFAOYSA-N	430.165	1.386	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H](C(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)C[C@H]2C[C@H]21	816596569	HSRDUIOPBLPAIF-DFBGVHRSSA-N	438.506	1.641	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)NNc2cc(C(=O)OC)ccc2Br)co1	816717554	HDSAWLPYMIDCBH-UHFFFAOYSA-N	432.252	1.494	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)C[C@H](c1nccn1C)C(F)(F)F	816828037	PGGFSSHHCPHBAB-LLVKDONJSA-N	446.455	1.519	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNS(=O)(=O)c3ccc4[nH]c(=O)c(=O)[nH]c4c3)cc2C1	817854454	OPLRTEVLYFMQRN-SECBINFHSA-N	434.499	1.026	50	20	IDGD	
CC(C)C[C@@H](C(=O)NNC(=O)c1cccc(N(C)C)c1)N1C(=O)[C@H]2CC=CC[C@H]2C1=O	904225106	VDDMSBKFRPOXFP-OTWHNJEPSA-N	426.517	1.880	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc2ccccc2c1)NNC(=O)c1ccc([N+](=O)[O-])cc1	912764437	LHFZSPUSLDENLQ-UHFFFAOYSA-N	428.426	1.488	50	20	IDGD	
Cc1ccccc1C(=O)N[C@H](CC(C)C)C(=O)NNC(=O)CCN1C[C@@H](C)O[C@H](C)C1	912921639	QETHACLLXYPIQM-QWFCFKBJSA-N	432.565	1.786	50	20	IDGD	
CC(C)[C@H](NC(=O)NCc1ccc(F)cc1)C(=O)NNC(=O)c1ccc2c(c1)OCCO2	913897867	DDZJMROLXBTXFA-IBGZPJMESA-N	444.463	1.882	50	20	IDGD	
CCc1ccc(C(=O)NNS(=O)(=O)c2ccc(N3C[C@@H](C(=O)O)CC3=O)cc2)cc1	914746513	KHYRGDFPNCRNBI-HNNXBMFYSA-N	431.470	1.310	50	20	IDGD	
Cc1cccc(NC(=S)NNC(=O)c2ccc(S(=O)(=O)N3CCOCC3)o2)c1C	914833779	LMVLJLPOGJDDTP-UHFFFAOYSA-N	438.531	1.549	50	20	IDGD	
CC(C)n1ncc2cc(/C=C/C(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)c(=O)[nH]c21	915197328	RIYULNFDVPENFB-BQYQJAHWSA-N	443.485	1.183	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)CN2CCCCCCC2=O)c1	915685879	PPBBPXVRAHQSDV-UHFFFAOYSA-N	438.550	1.271	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)NCc2ccccc2S(=O)(=O)N(C)C)c1	916237926	ZBVIGYIIQDUHFX-UHFFFAOYSA-N	434.518	1.463	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)NCc1cccc(NS(C)(=O)=O)c1	916246909	XVBKZWZXPUKGBC-UHFFFAOYSA-N	436.490	1.366	50	20	IDGD	
CN1CCN(Cc2ccc(CNC(=O)NNC(=O)COc3ccc(F)cc3)cc2)CC1	916387885	KHRZEQUAVHVROZ-UHFFFAOYSA-N	429.496	1.483	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCc2ccc(N3CCCCC3)nc2)c2ccccc2c1=O	916392362	PLHPOHXGQVDRPF-UHFFFAOYSA-N	449.515	1.946	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(\C#N)C(=O)N2CCN(C(=O)C(=O)NC3CC3)CC2)c1C	916409708	GCVUKYIBMNWPRO-QUYZQLMHSA-N	441.532	1.169	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NCCN1CCN(c2ccccc2)CC1	916515067	ZVEMNHBFBMAQMI-KRWDZBQOSA-N	429.496	1.746	50	20	IDGD	
O=C(NC[C@H]1Cc2ccccc2O1)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	916516316	SPCZFJIMGIOMTN-QGZVFWFLSA-N	444.513	1.419	50	20	IDGD	
O=C(NCCCNc1ccccn1)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	916576918	YTAGDOLTFUQJDC-UHFFFAOYSA-N	446.533	1.312	50	20	IDGD	
O=C(COCC(=O)NNC(=O)c1cccc(Cl)c1)NNC(=O)c1cccc(Cl)c1	916828745	UBJBEPIVVRBYLZ-UHFFFAOYSA-N	439.255	1.232	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CCCS(=O)(=O)N2CCCC2)ccc1OC(C)C	917391750	FROVGVWARUULPP-UHFFFAOYSA-N	427.523	1.449	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@@H](C)S(=O)(=O)c2ccc(F)cc2)cc(OC)c1OC	917905132	DSFMAGPAGCIKQH-LLVKDONJSA-N	440.449	1.475	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)N[C@H](C)CN2CCCC2=O)c2ccccc2c1=O	918099834	AXSKXPDOOIGOAV-CQSZACIVSA-N	428.493	1.152	50	20	IDGD	
CC(=O)N[C@H](C)c1ccc(S(=O)(=O)NNC(=O)c2cc(Br)c[nH]2)s1	918398733	FBISAFWIOQREHA-SSDOTTSWSA-N	435.325	1.659	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)OCC(=O)N2CCC3(CC2)OCCO3)c1C	918811215	YEBGKGPAWCNDIS-UYRXBGFRSA-N	431.489	1.567	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1)NNC(=O)c1c[nH]c2ccccc12	920431338	YLGFKVAJXVTGGZ-UHFFFAOYSA-N	431.430	1.206	50	20	IDGD	
O=C(COC(=O)c1cc(Br)c2c(c1)OCO2)NNC(=O)c1cccs1	920619628	VJKZNUUNLXQKGI-UHFFFAOYSA-N	427.232	1.857	50	20	IDGD	
CCN(CC)C[C@H](C)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	921121990	RTSKUFBAVMEVDA-INIZCTEOSA-N	439.582	1.536	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)c2cn(-c3ccc(Br)cc3)nn2)cc1	1317821357	LKKGTWYPRAGQBH-UHFFFAOYSA-N	445.277	1.912	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NC2CCN(C(C)=O)CC2)c2ccccc2c1=O	1318035370	VSTGUCVBQUCXGQ-UHFFFAOYSA-N	428.493	1.152	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])c(C)c2)cc1	1318319521	WCSOVESZGNCAMV-SFHVURJKSA-N	426.429	1.978	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1nc(-c2ccc(F)cc2)n2c1CCCCC2	1320140139	RSOIFHLQUUKNRY-LBPRGKRZSA-N	437.497	1.114	50	20	IDGD	
Nc1c(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](F)Cl)C2)sc2nccnc12	1778023079	PZHQSEXQUZZCDC-FWVNDXEPSA-N	441.916	1.935	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2)c1cc2[nH]ccc2s1	1778728744	USDXQQHMDQDVKF-URKNILKWSA-N	425.938	1.957	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@]2(C1)CN(C(=O)C[C@H]1COc3ccccc3O1)CCO2	1779293810	CYPIJEFPGCJKLS-JTSKRJEESA-N	448.592	1.898	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc([N+](=O)[O-])[nH]3)C2)C1	1780418740	CGKMWMYLTMQKKW-BDJLRTHQSA-N	429.271	1.540	50	20	IDGD	
O=C(c1n[nH]c2c1CCCC2)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781330931	IWQOKGAKTAPGRV-WMLDXEAASA-N	429.290	1.423	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)C[C@@H](O)CNC(=O)OC(C)(C)C)C2)C1	1781354416	FAVXBHFZUJSFHI-SIFCLUCFSA-N	447.960	1.109	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)C2)C1	1781765907	LKSSJSOXOSWCMC-GTNSWQLSSA-N	444.257	1.961	50	20	IDGD	
Cc1cc(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](C)Br)C2)no1	1782001190	AYWGZVGKEJSUBY-DDUZABMNSA-N	428.327	1.823	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C[C@H]1C[C@@H]3CC[C@H]1C3)C2	1782213233	GLQRONAJGRWNBI-YBZAYSDLSA-N	448.608	1.700	50	20	IDGD	
C[C@@H](C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCBr)C2)n1cccn1	1782556250	PRZBSJACWLZFHL-HDMKZQKVSA-N	427.343	1.743	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)Oc2cccnc2)C1	1782573673	MVVCAYZSBDQJIF-QTQZEZTPSA-N	439.940	1.617	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)/C=N/N3CCCCC3)CCO2)C1	1783348826	BIVHKBHUGLQLKO-KUDSMGGUSA-N	429.359	1.462	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(-n4ccnc4)ccn3)CCO2)C1	1783537558	OMTNUJNWRUWYJK-LIRRHRJNSA-N	448.321	1.494	50	20	IDGD	
COc1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](C)Br)C3)C2)ccc1O	1783538946	ZDAMVGFJEYDOBB-KPZWWZAWSA-N	427.295	1.628	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(N4CCCC4)ccn3)CCO2)C1	1783874001	BBTIAAREFYJZNJ-UWJYYQICSA-N	436.940	1.379	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cc(F)cc(Cl)c1)CCO2	1783938512	ZVSANOWTYYZUNM-HXUWFJFHSA-N	440.903	1.296	50	20	IDGD	
Cc1ccc(S(=O)(=O)CC(=O)N2CCO[C@]3(CCN(C(=O)C(Cl)Cl)C3)C2)cc1	1783946449	AVCRXAKMIBWYFG-GOSISDBHSA-N	449.356	1.402	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)COc3ccc(Cl)c(F)c3)C[C@@H]21)[C@H](O)CCl	1784086017	RLKAINBCMYJVPI-BHADISHBSA-N	449.306	1.437	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3CCCCN3C)[C@H]2C1	1784115529	UGJSHMDHKDCDQL-XAJHFOFHSA-N	430.387	1.481	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(CC(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](F)Cl)CCO3)C1	1785480190	IHMFOCHIBBIKQG-DNVCBOLYSA-N	433.908	1.608	50	20	IDGD	
COCc1c[nH]c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCBr)[C@H]3C2)c1	1786406602	ZXRNWVFXRQEKAD-DZKIICNBSA-N	428.327	1.539	50	20	IDGD	
C[C@@H](NC(=O)c1ccc(F)cc1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]2C1	1787449186	NNNZSDKPOYPMBC-NOTNWKISSA-N	443.878	1.458	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)c1cn2ccc(Cl)cc2n1	1788080512	CZWCKZPYKCXNJG-YUDUHTQSSA-N	441.315	1.181	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccnc4c(O)cccc34)[C@H]2C1	1790499178	QIGRBWOZQHUGFU-UHEFJODHSA-N	447.919	1.788	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)n3cccc3C=O)C[C@@H]21	1791058440	YUFPPRHUEGPTLQ-AUOOEQCUSA-N	440.338	1.625	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(C(C)(C)C)n[nH]3)C[C@@H]21	1791255544	UFLRHXSKASYODG-AYDFFVQHSA-N	426.945	1.554	50	20	IDGD	
CCOC(CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]21)OCC	1791420576	SERXYHIRWBTRSD-XLPNERPQSA-N	439.380	1.992	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCC1CCC1	1793184395	YIKKKVQPQGVPFB-NAMOIKSGSA-N	429.521	1.290	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CC(c2ccccc2)=NO1	1793278809	HNVWHSUFRAPRSV-NZGUISNBSA-N	445.592	1.621	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1=C3c4ccccc4C(=O)N3CC1)C2)[C@@H](F)Cl	1796366054	IQJGOHJOBSZESN-XBCDXLOZSA-N	433.867	1.381	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](O)CCl)C2)C1CC1	1796798521	YCZWOVCTIMSFGZ-QRJUGERDSA-N	429.945	1.528	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ncn(C)c1C(F)(F)F	1797077418	CITPIOZFAVUWGE-CLLJXQQHSA-N	444.458	1.064	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc2c(c1)n(C)c(=O)n2C	1797504848	HKTNHOCRVHKCRA-QKPAOTATSA-N	434.924	1.383	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cn(C)c2ncccc12	1798257069	WDUAJLPVMNBGFN-MUJYYYPQSA-N	426.521	1.198	50	20	IDGD	
CN1CCc2cc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3cnccc3C(=O)NN)ccc21	1798440171	FLZLSDQIPAGJCA-BCDXTJNWSA-N	448.527	1.243	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](COC(C)=O)OC(C)=O	1798476720	IBMFTXWGANCXQX-QRJUGERDSA-N	447.326	1.293	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1[nH]nc3ncccc13)C2	1799275094	KNCVBMBVUOGRJD-IMEWIIRVSA-N	426.304	1.397	50	20	IDGD	
COC(=O)c1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Cl)C3)c([N+](=O)[O-])c1	1799821184	JTHFPWRDYDEPKK-JLUCKKNBSA-N	443.815	1.119	50	20	IDGD	
CC(C)(C)OC(=O)N[C@]1(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](F)Cl)C3)CCOC1	1800139863	DKNNLAVJNRJSJP-IMDDZUEWSA-N	433.908	1.843	50	20	IDGD	
Cc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)Br)nn1C(F)F	1800760448	OKIHXNFUFRTRDY-KQXIARHKSA-N	435.269	1.573	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cn3cc(Cl)ccc3n1)C2	1800978144	MDJMFGXKKULYDA-IFOZYUSPSA-N	441.315	1.445	50	20	IDGD	
CC[C@@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CNC(=O)c1cc(C)on1)C2	1801802572	XKAYBMAXHTXXDV-XJFOESAGSA-N	441.326	1.525	50	20	IDGD	
CC[C@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN1C(=O)CSC1=S)C2	1801806445	KBHHPTRKMCIQCN-USZNOCQGSA-N	448.408	1.658	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc3c1OCCO3)C2	1802336713	VVKZTGCFLWJHAN-MUJYYYPQSA-N	430.505	1.083	50	20	IDGD	
CN1CCc2cc(C(=O)N3CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]3c3cccnc3)ccc21	1803143163	VVIMBDIPIOYXJD-NRSPTQNISA-N	442.947	1.993	50	20	IDGD	
CCS(=O)(=O)N[C@@H](C)C(=O)N1CCCC2(CCN(C(=O)CO[Si](C)(C)C)CC2)C1	1805956133	DDBIWJHQHWHDRW-INIZCTEOSA-N	447.674	1.397	50	20	IDGD	
Cc1cccc(CCC(=O)N2CCCC3(CCN(C(=O)c4cccc(B(O)O)c4)CC3)C2)n1	1806804046	VCFOCVRZBNCEOT-UHFFFAOYSA-N	449.360	1.547	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)CCN2C(=O)C=CC2=O)[C@@H]1c1cccnc1	1808249822	DMSUJZNTTNUEBG-GQIGUUNPSA-N	432.908	1.420	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cc[n+]([O-])cc2)[C@H]1c1cccnc1)[C@@H](F)Br	1808676343	PKIXJLUIRGQTNR-HRCADAONSA-N	437.269	1.725	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1	1809063456	VPYVWWFOZSEDNE-ZWOKBUDYSA-N	441.919	1.957	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)c2ccccc2)[C@@H]1c1cccnc1	1810303560	VGIGOTGFQLGPTE-WIYYLYMNSA-N	444.495	1.714	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)n3)C2)CC1	1810891646	ZKJLDNXGHYSUMI-LLVKDONJSA-N	427.299	1.516	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)CCn2ccnn2)[C@@H]1c1cccnc1	1812867497	IYCSAWVDPUGRNT-YSVLISHTSA-N	435.326	1.553	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)COc2cccnc2)[C@@H]1c1cccnc1	1813028844	WUUDMKXPNVXAOR-XKGZKEIXSA-N	432.908	1.815	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)CCc2cncnc2)[C@@H]1c1cccnc1	1813030769	KZCWDUGFOQYPDM-CMKODMSKSA-N	431.924	1.764	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cccn3c(O)nnc23)[C@@H]1c1cccnc1)C(Cl)Cl	1813080610	URCSZQSZPLHLQZ-GXTWGEPZSA-N	449.298	1.953	50	20	IDGD	
CC(C)(CCl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1	1815350273	NWCRNFGYQIMPEK-CYBMUJFWSA-N	435.742	1.314	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(O)n(C)n2)n[nH]1	1816125184	VPVIEXMXDRZDHS-BXKDBHETSA-N	425.287	1.938	50	20	IDGD	
CC(=O)C[C@@H](C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1	1817479198	JXPJCJOPZPGSCY-ACJLOTCBSA-N	426.282	1.011	50	20	IDGD	
CS(=O)(=O)N1CCC(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)[C@@H](F)Cl)[nH]n2)CC1	1818815058	NZQOAMGHEQTMAU-DZGCQCFKSA-N	449.936	1.608	50	20	IDGD	
CC[C@H](C)[C@H](N)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819402118	NWZOVJBKADKOOH-IWEFOYFVSA-N	442.524	1.088	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@@H](F)Cl)[nH]n1)c1cc(=O)nc2cccnn12	1820144597	KPPSPJYFBPXNLB-BDJLRTHQSA-N	433.831	1.653	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnc(O)[nH]3)sc2C1	1820658764	OMCKUPQRQPIZFN-JGVFFNPUSA-N	428.312	1.829	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2CNC(=O)O2)[nH]n1	1822083880	DJRWCTXZXSKMHC-DLOVCJGASA-N	428.287	1.684	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@](C)(O)C(F)(F)F)[nH]n1	1822369980	KQKDZOXEJYLWMQ-ISOBSLSZSA-N	426.823	1.969	50	20	IDGD	
Cc1n[nH]c(C)c1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1	1822415268	XKDNBHLMFOCGEG-OAHLLOKOSA-N	430.513	1.429	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)C[C@@](C)(O)CC(=O)O)n[nH]1	1822415765	XHPKZUHQFRLRFK-WHWRDJHUSA-N	430.889	1.271	50	20	IDGD	
N#Cc1ccccc1OCC(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1	1823385500	INEAGJQJOJZYIZ-CVEARBPZSA-N	431.880	1.952	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@]2(C)CC2(F)F)n[nH]1	1823399487	SBZORCPWVWBPLD-FZKQIMNGSA-N	426.468	1.820	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCS(C)(=O)=O)CC2	1825646661	BGMPIPCDSMCSLC-IUCAKERBSA-N	438.369	1.273	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H]1[C@H]3C=CS[C@@H]31)CC2	1826089711	MFOWWFOZIMMRKC-KWAZRSOSSA-N	435.575	1.303	50	20	IDGD	
O=C(CCc1ccc(O)nn1)N[C@H]1CCc2nc(NC(=O)C(Cl)Cl)sc2C1	1826103898	XTLCGWLCOYPEOR-VIFPVBQESA-N	430.317	1.987	50	20	IDGD	
CCc1nc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)co1	1827052627	SQZBYLHMUHZLFU-HXUWFJFHSA-N	439.321	1.464	50	20	IDGD	
Cc1ccc(CC(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)o1	1827059779	IWEIQZZLGBTAJC-QFIPXVFZSA-N	438.333	1.744	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@@H](O)CCl)CC3)c1	1827741923	WPJJGUCMOZZPNS-HIFRSBDPSA-N	436.921	1.927	50	20	IDGD	
CCS(=O)(=O)CC(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H](F)Br)CC1	1830375525	DQFFYJSFFPLPPL-UKRRQHHQSA-N	441.363	1.731	50	20	IDGD	
CC(C)=NO[C@H](C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1	1830414476	GEHWXZJOPAZRDA-DYESRHJHSA-N	443.353	1.401	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(F)s3)C2)C1	1830535817	UAAZFYQHZRHTJZ-PXAZEXFGSA-N	449.342	1.988	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2[C@H]3C=CS[C@H]32)CC1	1831152365	HHYDVXDKWVGLJB-PLACYPQZSA-N	440.374	1.475	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(C)nc3O)C2)C1	1831653814	FAGRVDPDBJWVQO-JXFKEZNVSA-N	425.913	1.573	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](CCC)NC(C)=O)C2)C1	1831659483	SLLDOLFJPRKESY-ZWOKBUDYSA-N	431.961	1.155	50	20	IDGD	
O=C(C(Cl)Cl)N1CCOC[C@@]2(C1)CN(C(=O)C13CC(C(F)(F)F)(C1)C3)CCO2	1831704869	JSZRPMYWROXGDM-UYSNPLJNSA-N	445.265	1.979	50	20	IDGD	
Cc1nccn1[C@H](C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1	1831877264	VXPKESCJVDVYJA-XLIONFOSSA-N	446.596	1.745	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)c3cccnc3C(N)=O)CC2)CC1	1833531222	LBRAQLLVOWEODC-GOSISDBHSA-N	449.983	1.773	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)c1cccc2nc[nH]c12	1834988552	OUEGBIGUXMNJCU-SFHVURJKSA-N	433.940	1.348	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)c1ccc2nc[nH]c2c1	1835556516	IOVZFMUEDQLIPU-IBGZPJMESA-N	433.940	1.348	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1)c1cc(CO)on1	1836188913	LZBZOGKRZLBDDD-HNNXBMFYSA-N	447.305	1.043	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCC(OC2CCN(C(=O)C(O)O)CC2)CC1	1836632324	IXZWVGFKHDMXAW-RVDMUPIBSA-N	449.454	1.181	50	20	IDGD	
O=C(c1ccncc1Cl)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836718557	SNLCFIFBLABHGP-KRWDZBQOSA-N	430.332	1.947	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc4cnccc34)CCO2)C1	1837036750	ZEWPIIHETIIXPR-SIKLNZKXSA-N	447.919	1.559	50	20	IDGD	
Cc1nc2sccn2c1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1837143302	CBLVWUUYWAWPPG-GUYCJALGSA-N	430.889	1.309	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(F)n3)CCO2)C1	1837910070	DZVVUXONRBNJCT-UGSOOPFHSA-N	444.301	1.464	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cnn4ncccc34)CC2)CC1	1838058992	NVVBYTHXMWUSOH-GOSISDBHSA-N	449.939	1.595	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)/C=C\C(=O)NC3CC3)CC2)CC1	1838365106	RUIGZRCRPABYAD-XFHJGTJQSA-N	425.957	1.837	50	20	IDGD	
O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)c1[nH]cc3c1CCC3)CCO2	1838452317	YSKBRENCRXCPGH-LJQANCHMSA-N	440.338	1.358	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccc(OC)cc3C#N)CCO2)C1	1839133018	XUUZMRWZJZJKMO-SIKLNZKXSA-N	449.935	1.583	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C=C3\C(=O)Nc4ccccc43)C2)C1	1839145294	CKIGTWXLDXJGBO-APJKMFDXSA-N	447.919	1.496	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)C2)C1	1839147335	NEXRHOJHTPEMCB-VQIMIIECSA-N	443.859	1.821	50	20	IDGD	
C[C@]1(C(=O)N2CCOC[C@@]3(CN(C(=O)[C@H](F)Br)CCO3)C2)CC1(F)F	1839203490	MNXRNVQWOFRXIS-ZLKJLUDKSA-N	429.233	1.179	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(C)n4ccnc4n3)CCO2)C1	1839550328	CGBGHKGHCQXGSB-MGPUTAFESA-N	435.912	1.125	50	20	IDGD	
Cc1nc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)cs1	1840031089	FLXMJJKRXQHYOT-BDJLRTHQSA-N	432.340	1.305	50	20	IDGD	
COc1cccc(Cl)c1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1	1840735939	XRPQZLJATGPKME-AUUYWEPGSA-N	447.315	1.018	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CC2(CCCN2C(=O)[C@@H](C)CBr)C1	1841289645	LRPPQWGTCXPZNC-SOUVJXGZSA-N	427.339	1.976	50	20	IDGD	
C[C@H](CC(N)=O)C(=O)N1CCCC12CN(C(=O)[C@H](Br)Cc1ccccc1)C2	1841658974	RPUILFSUNOIZPY-GDBMZVCRSA-N	436.350	1.708	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)Cc2ncccn2)C1	1842110978	PIUFKDHDJAZFCS-UHFFFAOYSA-N	439.428	1.370	50	20	IDGD	
Cc1ccoc1C(=O)N1CCCC12CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2	1843468057	UKQJXGIQMPEXCR-UHFFFAOYSA-N	439.516	1.751	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC2(CCCN2C(=O)c2ccc3c(c2)n(C)c(=O)n3C)C1	1843733161	CPOPVXZFQFSGKW-CYBMUJFWSA-N	449.349	1.725	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCCC12CN(C(=O)c1ccc(N3CCOCC3)cn1)C2	1845169603	UKSIFQJXUAOVFU-IBGZPJMESA-N	441.359	1.972	50	20	IDGD	
O=C(/C=C/C(=O)N1CC2(CCCN2C(=O)[C@@H](F)Br)C1)NCc1ccco1	1845217985	GUBJDGYHFBBOPL-MBVDDHJVSA-N	428.258	1.346	50	20	IDGD	
Cc1cc(C(=O)N2CCCC23CN(C(=O)CCC(=O)NN(C)C)C3)cc(C)c1C(=O)O	1845574258	BWCXCWNJMDDYCB-UHFFFAOYSA-N	430.505	1.192	50	20	IDGD	
COc1ccc(CNC(=O)CCC(=O)N2CCCC23CN(C(=O)[C@H](F)Cl)C3)cc1	1845822856	SFBNAHPSRNKWFC-SFHVURJKSA-N	425.888	1.829	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)[C@@H](C)n2cccn2)C1	1846618918	IKFKHWGJOAKSJK-CQSZACIVSA-N	441.444	1.795	50	20	IDGD	
COc1ccc(CCNC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc1OC	10036428	SCFPCNVOFVQBFF-UHFFFAOYSA-N	425.445	1.782	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)c2ccc(CCNS(C)(=O)=O)s2)cc1OC	12694165	SRMWZVCXZICAIC-UHFFFAOYSA-N	441.531	1.322	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)CNC(=O)c1ccc(Br)o1	21023652	RIJSGFWVZRFCJV-UHFFFAOYSA-N	430.642	1.895	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2csc(-c3ncccn3)n2)cc1OC	109132494	WMHVXTVBMDBWGH-UHFFFAOYSA-N	443.441	1.235	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)CNC(=O)CC2CCCCC2)c2ccccc2c1=O	109764099	DBOFFVCHVQDLRD-UHFFFAOYSA-N	427.505	1.654	50	20	IDGD	
O=C(NCCC(=O)N1CCN(c2ncccn2)CC1)NNc1ccccc1C(F)(F)F	726710585	HQEILNONKASDPW-UHFFFAOYSA-N	437.426	1.860	50	20	IDGD	
CSCC[C@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)c1ccc2c(c1)OCCO2	727120175	ACFPZSDPCBUATC-ZDUSSCGKSA-N	425.507	1.865	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2sc(NC(C)=O)nc2C)ccc1OC(C)C	727351514	LPRNPYZNQOSRFZ-UHFFFAOYSA-N	442.519	1.829	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)CN(C)C(=O)c2ccc(Br)o2)c1	728206355	JTBQMFKMFCNKPZ-UHFFFAOYSA-N	439.266	1.382	50	20	IDGD	
Cc1ccc(C(=O)NCCC(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)c(O)c1	728210947	BDEGPJURAKTQCU-UHFFFAOYSA-N	432.502	1.405	50	20	IDGD	
CS(=O)(=O)c1ccc(Br)c(C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c1	728796693	NGFLIWPTVDJAQL-UHFFFAOYSA-N	442.247	1.836	50	20	IDGD	
O=C(NCCCOCCc1ccccc1)NNC(=O)C1CCN(c2ncccn2)CC1	728946671	IJZOHEMEHQKQOS-UHFFFAOYSA-N	426.521	1.673	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccccc2)C1	730033929	DRWNJTUGLGWVQM-QGZVFWFLSA-N	431.514	1.573	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)Cc2cccc(NS(C)(=O)=O)c2)cc1	730205715	PMTLXDHHQHGUDR-CQSZACIVSA-N	435.502	1.614	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)c1nnn(-c2ccccc2F)c1C(F)(F)F	730782416	MWDQCWMQLIVUEU-UHFFFAOYSA-N	439.325	1.971	50	20	IDGD	
COC1CCN(C(C)(C)CNC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)CC1	730829482	IZIJFDIYQYXHGM-UHFFFAOYSA-N	430.509	1.411	50	20	IDGD	
CN(C)C(=O)CCN1CCC(NC(=O)NNC(=O)c2ccc(Br)s2)CC1	731498544	XCJJJFGPXYADTK-UHFFFAOYSA-N	446.371	1.397	50	20	IDGD	
COc1ccc(Cn2cc(C(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)cn2)cc1	731593863	CVGAUGHZXAIWDG-UHFFFAOYSA-N	432.440	1.262	50	20	IDGD	
CCOc1ccccc1[C@@H](CC(=O)NNC(=O)CCN1C[C@H](C)O[C@H](C)C1)NC(C)=O	732259610	IHEZXHMAGZBYFE-JTDSTZFVSA-N	434.537	1.299	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2cnc(-c3ccc4c(c3)OCO4)s2)C[C@H](C)O1	732264915	YADWWCITMATHIX-STQMWFEESA-N	432.502	1.799	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C[C@@H](C)O1	732265074	YSRJZVPTMSYKEU-OKILXGFUSA-N	430.465	1.256	50	20	IDGD	
O=C(CNC(=O)c1ccc(Br)s1)NNC(=O)c1cnn(-c2ccccc2)c1	733365227	VZRGDUNTORLRIV-UHFFFAOYSA-N	448.302	1.887	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc2c(c1)nc(CCC(=O)NNc1cnccn1)n2C	734242450	IAEWMIRNNVCFFS-UHFFFAOYSA-N	431.522	1.470	50	20	IDGD	
O=C(NN=Cc1occc1Br)c1cccc(S(=O)(=O)N2CCOCC2)c1	735224059	KVYVEESUQLJBGP-UHFFFAOYSA-N	442.291	1.827	50	20	IDGD	
O=C(NNc1cccnn1)C1CCN(S(=O)(=O)c2ccc3c(c2)OCCCO3)CC1	736702155	FLDHXMBPAYDSEJ-UHFFFAOYSA-N	433.490	1.182	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2cccc(C(=O)NNc3ccnc(N(C)C)n3)c2)C[C@H](C)O1	740104687	PVXSPSDLITYNGL-KBPBESRZSA-N	434.522	1.097	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)CC[S@@](=O)c1ccc2c(c1)OCCO2	740697352	FVJGOQJMKJOBRT-WJOKGBTCSA-N	448.497	1.581	50	20	IDGD	
CS(=O)(=O)[C@H]1CCC[C@@H](NC(=O)NNC(=O)c2ccc(F)cc2Br)C1	741093350	PQBASXXQTXALAR-MNOVXSKESA-N	436.303	1.888	50	20	IDGD	
O=C(CCN1C(=O)[C@H]2[C@H](C1=O)[C@H]1CC[C@H]2O1)NNC(=O)CC12CC3CC(CC(C3)C1)C2	742471286	HDABSBOIJXTYKJ-ICZBJBIMSA-N	429.517	1.293	50	20	IDGD	
CC(C)(C)C(=O)Nc1nccnc1C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	742618965	NLCMFVGJPODSKM-UHFFFAOYSA-N	432.506	1.659	50	20	IDGD	
O=C(Cc1cc(O)nc(S)n1)NNC(=S)NCc1ccc(OC(F)(F)F)cc1	742983642	XWMWIWDRYKLLRB-UHFFFAOYSA-N	433.437	1.608	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@H]2C[C@@H]2c2cccc(F)c2)cc1	743356447	MSHDFTNQJDBDSV-MSOLQXFVSA-N	434.493	1.641	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)N[C@@H]1CC(=O)N([C@@H]2C[C@@H]2c2ccccc2)C1	743510500	XIRFKCKFCGCHGA-JFIYKMOQSA-N	426.448	1.692	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)N[C@@H]1CC(=O)N([C@H]2C[C@@H]2c2ccccc2)C1	743609533	XXKRRZSQXQTVPP-NRSPTQNISA-N	444.495	1.973	50	20	IDGD	
Cc1cccc(NC(=O)NCC(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)c1	744619807	ZFNSMUIWBXSCRR-UHFFFAOYSA-N	447.517	1.281	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)N[C@@H]1CC(=O)N([C@H]2C[C@H]2c2ccccc2)C1	745915377	YOFYESKUEPPBGQ-QYZOEREBSA-N	433.468	1.424	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)c2ccc(F)c(S(=O)(=O)Cc3ncon3)c2)cc1	746096705	XZMOCIOWORXSCF-UHFFFAOYSA-N	448.432	1.331	50	20	IDGD	
Cc1cccc2cc(C(=O)NNC(=O)c3cccc(S(=O)(=O)N4CCOCC4)c3)oc12	747116069	GONHTNOCKPWACG-UHFFFAOYSA-N	443.481	1.837	50	20	IDGD	
CCCN(CCC)S(=O)(=O)NNC(=O)c1cccc(S(=O)(=O)N(CC)CC)c1	747596230	ZUDXUCZMYALZQR-UHFFFAOYSA-N	434.584	1.318	50	20	IDGD	
CCOCCCn1c(NNC(=O)c2[nH]c(C)c(C(N)=O)c2CC)nc2ccccc2c1=O	747887308	ZQCVXVZJBZPZAP-UHFFFAOYSA-N	440.504	1.878	50	20	IDGD	
CCn1c(=O)c(=O)[nH]c2cc(C(=O)NNc3nc(-c4ccccn4)nc4c3CCC4)ccc21	747987703	MSFJNOATFVPXJE-UHFFFAOYSA-N	443.467	1.807	50	20	IDGD	
Cc1cc(C(=O)NNc2ccccc2S(=O)(=O)NC(C)(C)C)nc2nc(O)nc(O)c12	748593867	MVYUJPHGOULCGJ-UHFFFAOYSA-N	446.489	1.578	50	20	IDGD	
CS(=O)(=O)N1CCN(CC(=O)NNc2ccc(Br)cc2Cl)CC1	748776548	UPJWREWVEVMTEB-UHFFFAOYSA-N	425.736	1.123	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CC[C@H](NC(=O)OC(C)(C)C)C[C@H]2C)n1	749476235	WTLQICBCBNLOIO-KGLIPLIRSA-N	425.555	1.519	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)NCC1CCN(CC(=O)NC(C)(C)C)CC1	751110827	HDQPOFLLUBCQPO-UHFFFAOYSA-N	447.580	1.585	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)[C@H]1CC(=O)N(Cc2ccccc2Cl)C1	751209102	KGMGCICXVDICSV-ZDUSSCGKSA-N	434.905	1.327	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CCc2nc3cc(S(=O)(=O)N(C)C)ccc3n2C)o1	752528580	ZIMYKTUXFWSWEY-UHFFFAOYSA-N	433.490	1.119	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2c(F)c(F)cc(F)c2F)c1	753042470	QPTLLUDROMSLNN-UHFFFAOYSA-N	448.398	1.638	50	20	IDGD	
COc1ccc(-n2c(C)cc(/C=C(/C#N)C(=O)NCCCN3CCNC(=O)C3)c2C)cc1	753861714	CUVVVKUFIWNYGA-ZHZULCJRSA-N	435.528	1.948	50	20	IDGD	
O=C(NCCS(=O)(=O)N1CCSCC1)NNc1cc(C(F)(F)F)ccc1F	754637216	BQNGFEFEQYHGEL-UHFFFAOYSA-N	430.449	1.849	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2ccc(F)cc2Br)c(C)o1	754747639	SNTBKROIRQBNKQ-UHFFFAOYSA-N	435.227	1.900	50	20	IDGD	
O=C(NNC(=O)c1cccc(Cl)c1)NC1CCN(S(=O)(=O)C(F)(F)F)CC1	755301505	LHMGIYCHBMWVOK-UHFFFAOYSA-N	428.820	1.598	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)Nc1cccc(S(=O)(=O)N2CCOCC2)c1	755354026	MSQZAKNBBZQLQZ-UHFFFAOYSA-N	448.501	1.112	50	20	IDGD	
CON(C)S(=O)(=O)c1ccc(NC(=O)NNC(=O)COc2ccccc2F)cc1	755534520	MSTSZUCCQSHMOM-UHFFFAOYSA-N	426.426	1.239	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NN=Cc2cc(O)cc(Br)c2O)ccc1Cl	755553690	WKTLILTVQOXHOF-UHFFFAOYSA-N	448.682	1.925	50	20	IDGD	
COC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(NC(=O)NNC(=O)CC3CC3)cc2)C1	755556159	BZLPQGRFIALXLF-CQSZACIVSA-N	438.506	1.213	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccn(C)n2)c1	756294835	RGFAQPSQNYQFCH-UHFFFAOYSA-N	444.473	1.696	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)Nc3ccn(CCN4CCOCC4)n3)cc2C1	756646147	LIQPJUHHNRRWND-CQSZACIVSA-N	432.550	1.868	50	20	IDGD	
NC(=O)c1ccc(NNC(=O)c2cccc(S(=O)(=O)Nc3ccccc3Cl)c2)nn1	757393263	WOXVZJHJGZVNPD-UHFFFAOYSA-N	446.876	1.787	50	20	IDGD	
CCOc1ccc(C(=O)NNS(=O)(=O)c2cccc(F)c2C(=O)OC)cc1OC	757645466	QFRSBNNPPRUTCK-UHFFFAOYSA-N	426.422	1.643	50	20	IDGD	
CNC(=O)Cn1cc(NC(=O)NNC(=O)c2cc(-c3ccco3)nc3ccccc23)cn1	757865842	HGENPFDUUUZICO-UHFFFAOYSA-N	433.428	1.904	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)c1ccc(Br)cc1C(F)(F)F	758054066	NGAZJBXYGQWBAG-ZCFIWIBFSA-N	432.218	1.167	50	20	IDGD	
C[C@H](COc1ccccc1C(F)(F)F)NC(=O)NNC(=O)C(=O)Nc1ccccn1	758715279	UHQLQJIGPYZGHW-LLVKDONJSA-N	425.367	1.837	50	20	IDGD	
CCCC[C@@H](/N=C1/NS(=O)(=O)c2ccccc21)C(=O)NNc1ncccc1[N+](=O)[O-]	759301809	DTWINFZASZYSCQ-CYBMUJFWSA-N	432.462	1.730	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)Cc1cccc(OCC#N)c1	760634213	UFUGAUNFSMKWKR-UHFFFAOYSA-N	431.832	1.798	50	20	IDGD	
C[C@H](C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1)c1cccc([N+](=O)[O-])c1	761401192	PJVSNMQKPKQGKU-VIFPVBQESA-N	426.838	1.460	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)[C@@H](C)S(=O)(=O)c1ccc(F)cc1	762362132	URYCPBUXBXTVPQ-GFCCVEGCSA-N	426.491	1.936	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)[C@@H](C)NS(=O)(=O)c1cccc(C#N)c1	762371551	ZYQLUBBXYZYKCX-CYBMUJFWSA-N	448.526	1.173	50	20	IDGD	
Cc1nn(-c2ccc(Br)cc2)cc1C=NNC(=O)[C@H]1CCS(=O)(=O)C1	763359554	PSIXJQMZDAGEGU-LBPRGKRZSA-N	425.308	1.828	50	20	IDGD	
CC(=O)Nc1nc(C)c(S(=O)(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)s1	763439422	OMORNXLKWBUANV-UHFFFAOYSA-N	435.528	1.024	50	20	IDGD	
O=C(NNC(=O)c1ccc2ccccc2n1)C(=O)Nc1cccc(CN2CCOC2=O)c1	763449921	KPLRHJUFPNPFIH-UHFFFAOYSA-N	433.424	1.587	50	20	IDGD	
CC(C)(C)OC(=O)c1ccccc1NC(=O)C(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	763471195	FHNJKTBBMVTDKY-UHFFFAOYSA-N	428.401	1.950	50	20	IDGD	
O=C(NNC(=O)c1ccccc1O)C(=O)Nc1ccc2c(c1)CCN2C(=O)c1cccnc1	763529755	MJFRCFWENJYMFM-UHFFFAOYSA-N	445.435	1.390	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)ccc1Cl	763614152	ROSQEQYRXPTJHD-UHFFFAOYSA-N	441.831	1.916	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2ccc(CN3CCOC3=O)cc2)c1	763648413	DCIDFNCYIDPPSZ-UHFFFAOYSA-N	440.456	1.421	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(N2CCCC2=O)ccc1F	763657355	KUEKKISMPQSCRF-UHFFFAOYSA-N	444.419	1.126	50	20	IDGD	
CSc1cc2c(cc1NC(=O)C(=O)NNC(=O)COc1ccc(C)c(C)c1)OCCO2	763666113	BAVYZNZTGULRTA-UHFFFAOYSA-N	445.497	1.961	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(N(C)C)c(Cl)c1	763682428	OFGZTZHXRSHMSN-UHFFFAOYSA-N	434.880	1.970	50	20	IDGD	
CS(=O)(=O)c1ccc(F)c(NC(=O)C(=O)NNC(=O)Cc2c[nH]c3ccccc23)c1	763858535	UOLCAQUBBCLGCJ-UHFFFAOYSA-N	432.433	1.039	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccc(N2CCO[C@H](C)C2)cc1	763864880	LTNHPYNWENEPKW-CABCVRRESA-N	444.463	1.604	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)n(Cc2ccccc2)n1	763865278	JVWRHYFIFDTKIE-HNNXBMFYSA-N	439.447	1.932	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccn(Cc2ccncc2)n1	763873490	UKGLUMWNWWGKDU-ZDUSSCGKSA-N	426.408	1.019	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1cccc(CN2CCCC2=O)c1	763873820	WWFSJAODHJBWMS-AWEZNQCLSA-N	442.447	1.502	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cc(CC(C)C)nn2C)cc1	763875790	AUOMOKVERUUHBH-CQSZACIVSA-N	429.477	1.375	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(C#N)ccc2OC(F)F)cc1OC	763903879	WFFCDGGOLYKQNW-UHFFFAOYSA-N	448.382	1.967	50	20	IDGD	
COc1c(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CC[C@@H](C)C3)cccc1C(N)=O	763940358	GQBPHRVFKCCGQL-SNVBAGLBSA-N	430.486	1.380	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C)c(C)c(NC(=O)C(=O)NNC(=O)c2cccn2C)c1	763995539	ISQORRYDDGWYHD-UHFFFAOYSA-N	449.533	1.072	50	20	IDGD	
Cc1cc(Sc2ccccc2)ccc1NC(=O)C(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1	764002266	LALGABSSMUJGAO-CQSZACIVSA-N	447.538	1.667	50	20	IDGD	
CN1CCc2ccc(NC(=O)C(=O)NNC(=O)c3cc(-c4ccccc4)on3)cc2C1=O	764017410	XOKZEXJGTPXNHY-UHFFFAOYSA-N	433.424	1.369	50	20	IDGD	
COC(=O)c1ccc(C(F)(F)F)cc1NC(=O)C(=O)NNC(=O)c1ccccc1OC	764041668	YXQMUBPCLRHBQQ-UHFFFAOYSA-N	439.346	1.900	50	20	IDGD	
CNC(=O)[C@H]1CN(C(=O)C(=O)NNC(=O)c2ccc3ccccc3c2)c2ccccc2O1	764061372	CWEBYVQFEQCSDW-LJQANCHMSA-N	432.436	1.141	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccnn1Cc1ccccc1F	764133664	YOUNXORIYGTWPZ-UHFFFAOYSA-N	425.420	1.408	50	20	IDGD	
CN1CCN(c2ccc(NC(=O)C(=O)NNC(=O)CCc3ccco3)cc2Cl)CC1	764178016	XZTSOFLTHCTAGX-UHFFFAOYSA-N	433.896	1.404	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CCC(C)C)cc1S(=O)(=O)NC(C)(C)C	764198692	FTVSJEXLAGTFKZ-UHFFFAOYSA-N	426.539	1.594	50	20	IDGD	
O=C(CCC1CCCCC1)NNC(=O)C(=O)Nc1ccc(CN2C(=O)CNC2=O)cc1	764219015	YMDURFHVMUTKAV-UHFFFAOYSA-N	429.477	1.185	50	20	IDGD	
Cc1cc(N2CCOCC2)ccc1NC(=O)C(=O)NNC(=O)c1cccc2ncccc12	764252328	DWWVLJAMXFXAPB-UHFFFAOYSA-N	433.468	1.780	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)C(=O)Nc1ccc(Br)cc1	764259802	JRAVGAGJIGJVCJ-UHFFFAOYSA-N	447.293	1.242	50	20	IDGD	
CC(C)(C(=O)NNC(=O)C(=O)Nc1cc2c(cc1[N+](=O)[O-])OCCCO2)c1ccccc1	764313126	JYGJAWKVAFLDKL-UHFFFAOYSA-N	442.428	1.820	50	20	IDGD	
CCS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)cc1	764349143	FJWHQTGAVCTTLM-UHFFFAOYSA-N	425.850	1.239	50	20	IDGD	
COCCOc1ccc(C#N)cc1NC(=O)C(=O)NNC(=O)c1ccc(O)c(Cl)c1	764349183	KSVJWQDHPHECNT-UHFFFAOYSA-N	432.820	1.342	50	20	IDGD	
CS(=O)(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)COCc2ccccc2)c1	764366662	DJFKDGUVLWATDM-UHFFFAOYSA-N	439.877	1.046	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2cccs2)[nH]n1)C(=O)Nc1ccc(-n2cccn2)c(F)c1	764377305	MZSKZGUJFZRMMV-UHFFFAOYSA-N	439.432	1.863	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1cc(CC(C)(C)C)nn1C	764397621	KYCCVXJDYGKUQV-UHFFFAOYSA-N	433.534	1.896	50	20	IDGD	
CC(=NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1)c1ccc(-n2cncn2)cc1	764819329	RFYUTNQFGBUVJS-UHFFFAOYSA-N	431.500	1.566	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)[C@@H]1CC(=O)N(c2ccc3c(c2)CCC3)C1	765311329	VDVYUNBUYDNEJY-QGZVFWFLSA-N	444.532	1.981	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)Cn2ncc3ccc([N+](=O)[O-])cc32)n[nH]1	765592457	MNNOIDXJQDBQIN-UHFFFAOYSA-N	435.400	1.804	50	20	IDGD	
O=C(CCNS(=O)(=O)c1cccs1)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	765608500	XRHCIONBZRZQCK-UHFFFAOYSA-N	437.478	1.407	50	20	IDGD	
Cc1nc(CC(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)c(C)s1	765759809	XFVSAWIRXLDPEI-UHFFFAOYSA-N	435.981	1.921	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1cc(-c2nnc3n2CCCCC3)ccc1F	766265259	ZFOYCGRVODBVRX-UHFFFAOYSA-N	440.439	1.691	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cnn(-c4ccccn4)c3C)CC2)cc1	766651121	ZLXPLSFXLTYVTO-UHFFFAOYSA-N	447.543	1.463	50	20	IDGD	
O=Cc1ccccc1OCC(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	766661576	XGYWSZQRMXIYTI-UHFFFAOYSA-N	444.919	1.497	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)[C@H]3CCCN(S(=O)(=O)CC)C3)n[nH]2)cc1	768268693	RCDKEIWDIBMFIE-INIZCTEOSA-N	433.534	1.462	50	20	IDGD	
C[C@]1(c2ccc(F)c(Cl)c2)NC(=O)N(CC(=O)NNC(=S)NCC2CCC2)C1=O	770227569	NWCWPXRVRVVAPG-GOSISDBHSA-N	441.916	1.542	50	20	IDGD	
CCN(C1CCN(C(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)CC1)S(C)(=O)=O	770659332	QXDQNPBPWZBROY-CYBMUJFWSA-N	446.957	1.594	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N[C@H]1CCO[C@]2(CCOC2)C1	771444144	NGSKCSPXDQHRIT-XAYKYTGQSA-N	442.310	1.885	50	20	IDGD	
CC(=O)N1CCc2ccccc2[C@@H]1CC(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772195757	PZGPKVOMHJQCSP-IBGZPJMESA-N	442.903	1.640	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(OC(F)F)c3cccnc23)c1O	773495954	HQXRALREAPULFW-UHFFFAOYSA-N	446.366	1.950	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccc(C(=O)NC2CC2)cc1	774009538	QGOBECWUSLGBKL-LBPRGKRZSA-N	444.875	1.786	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)NC[C@H]2CC[C@@H](C(=O)N(C)C)O2)c(C)n1-c1ccccc1	775460369	IXFQYIRRECDADL-MJGOQNOKSA-N	427.505	1.674	50	20	IDGD	
CC(C)NC(=O)C(=O)NNS(=O)(=O)c1cc(Cl)ccc1OC[C@H]1CCCCO1	777599774	LHKVCWXTRNRCLH-CYBMUJFWSA-N	433.914	1.122	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)c2cc([N+](=O)[O-])ccc2N2CCOCC2)nc1C	778424688	ZXBHUANLOBPPJM-UHFFFAOYSA-N	430.421	1.463	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)N2C[C@@H](CC(=O)N(C)C)c3cc(Cl)ccc32)nc(C)n1	783324914	SDQUXGGFNJHLIC-CYBMUJFWSA-N	430.896	1.799	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N1CCC2(CC1)COC(=O)N2	784174943	HBCYWAWIUPQSQC-NSHDSACASA-N	441.282	1.532	50	20	IDGD	
CN(NC(=O)c1cc(N2CCOCC2)ccn1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	784502522	UTIZSGUCVFZGIP-UHFFFAOYSA-N	448.524	1.168	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)ccc1Br	785066449	ANIQNCGWYSHHBJ-UHFFFAOYSA-N	446.261	1.434	50	20	IDGD	
COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NNc1c(OC)cccc1S(C)(=O)=O	785331162	PNYMPJHTQKZRNT-UHFFFAOYSA-N	438.418	1.097	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(-n2cccn2)ccc1C	789585978	ICNXMXYPEMKAFU-UHFFFAOYSA-N	437.456	1.744	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)CCOCC(F)(F)C(F)F)c2ccccc2c1=O	790116178	GOQLRVSZYUHPAF-UHFFFAOYSA-N	432.374	1.875	50	20	IDGD	
Cn1nc(SCC(=O)NN=C2CCCc3[nH]c4ccc(Cl)cc4c32)c(=O)n(C)c1=O	790291508	WUEHGFFEFCDDSU-UHFFFAOYSA-N	446.920	1.563	50	20	IDGD	
COc1cccc(Cl)c1CNC(=O)NNC(=O)c1csc(N2CCOCC2)n1	790541408	QMCUZIWBLZUXIB-UHFFFAOYSA-N	425.898	1.786	50	20	IDGD	
O=C(CCOCC(F)(F)C(F)F)N1CCN(S(=O)(=O)CBr)CC1	790851579	KWDWDYLSWQGCRV-UHFFFAOYSA-N	429.230	1.120	50	20	IDGD	
CCS(=O)(=O)c1ccc(CNC(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)s1	792218843	YFVHAOCTWAAFEK-LLVKDONJSA-N	429.495	1.979	50	20	IDGD	
CN(C(=O)OC(C)(C)C)[C@H](C(=O)NNc1nc(-c2cccnc2)no1)c1cnn(C)c1	796342018	LBBDAWZPJHNCMY-AWEZNQCLSA-N	428.453	1.916	50	20	IDGD	
CNC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)c2cccc3ccccc23)c(C)c1	796998108	FHFIYYWPOQVZFX-UHFFFAOYSA-N	434.452	1.673	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H]2CCN(C(=O)Nc3ccccc3)C2)c1	801077910	PCWYQVFLTADEKP-MRXNPFEDSA-N	445.501	1.341	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)c1ccc(S(=O)(=O)N2CCCCCC2)cc1	804952086	DLCKVGAIVRLGEA-UHFFFAOYSA-N	441.517	1.984	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)c1ccc(N2CCCS2(=O)=O)cc1Cl	804952958	ZENRWQATTGBVCU-UHFFFAOYSA-N	433.881	1.613	50	20	IDGD	
O=C1COc2c(cc(Cl)cc2NC(=O)C(=O)NNC(=O)c2cccc3cccnc23)N1	806977802	ZMDNMLYKLIDMPR-UHFFFAOYSA-N	439.815	1.619	50	20	IDGD	
O=C(NCc1cccc(N2CCCS2(=O)=O)c1)NNc1ccc2c(=O)[nH]ccc2c1	807114088	JQLCGKXMBVUJSB-UHFFFAOYSA-N	427.486	1.894	50	20	IDGD	
COCC[S@](=O)Cc1cccc(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2C)c1	807455600	QEQARBOTHVFGRQ-PMERELPUSA-N	434.474	1.880	50	20	IDGD	
Cc1cc([N+](=O)[O-])ccc1NNC(=O)C(=O)Nc1ccccc1S(=O)(=O)C(F)F	807456108	WXLMVQDFLFARHX-UHFFFAOYSA-N	428.373	1.981	50	20	IDGD	
COCC(=O)N1CCc2cc(NC(=O)C(=O)NNc3ccc([N+](=O)[O-])cc3C)ccc21	807456547	OHOHPAATTAIUHJ-UHFFFAOYSA-N	427.417	1.521	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)NCCn2cc(Br)cn2)cc1	807532279	LXEFIYWIGJZLCX-GFCCVEGCSA-N	440.298	1.842	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1ccc2c(c1)SCC(=O)N2	809980196	IXTMMDWEGLOTHK-UHFFFAOYSA-N	433.515	1.407	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)CNS(=O)(=O)c2ccc3ccccc3c2)cc1	810195811	QQBZSSULTHHJOB-UHFFFAOYSA-N	441.509	1.907	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCC[C@@](CO)(Cc3ccccc3)C2)cc1OC	812874086	VBRJDVKEGDBEBB-XMMPIXPASA-N	441.528	1.782	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ncc(C(F)(F)F)s2)o1	812980516	SOXVDGPHCYFMRE-UHFFFAOYSA-N	433.412	1.996	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)NC[C@@H]1C[C@H](F)CN1C(=O)OC(C)(C)C	814352813	IOWUCEXYXLSZLB-RYUDHWBXSA-N	433.481	1.189	50	20	IDGD	
COCc1cc(NC(=O)C(=O)NNC(=O)c2cccc3cccnc23)cc(C(=O)OC)c1	815568331	DFPJYOUYKZGFKF-UHFFFAOYSA-N	436.424	1.568	50	20	IDGD	
O=C(NNc1nc[nH]n1)c1cc(S(=O)(=O)N2CCCCC2)ccc1Br	816632539	NJGBXWCTIFEGEB-UHFFFAOYSA-N	429.300	1.499	50	20	IDGD	
CCOc1ccccc1N1C[C@H](C(=O)NNC(=O)CNc2cccc(OC)c2)CC1=O	825776628	KQVVDPANAYSNMC-OAHLLOKOSA-N	426.473	1.706	50	20	IDGD	
O=C(NN=Cc1ccc(-n2cccn2)cc1)c1cccc(S(=O)(=O)N2CCOCC2)c1	873843842	OCUIFQPZLNBMEW-UHFFFAOYSA-N	439.497	1.657	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccccc1	910836540	ICVBJXWNFMOQHQ-GOSISDBHSA-N	435.477	1.595	50	20	IDGD	
COCC(=O)Nc1cccc(CNC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)c1	914595681	HKHUISVKPXKHQU-UHFFFAOYSA-N	438.444	1.307	50	20	IDGD	
COc1ccc(C=NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c(OC)c1	916258454	ATFVGSKOHMHSKV-UHFFFAOYSA-N	433.486	1.489	50	20	IDGD	
CCN(CC)C(=O)c1ccc(CNC(=O)NNC(=O)c2nnc(O)c3ccccc23)cc1	916389530	KCRXTDBHBSPTSB-UHFFFAOYSA-N	436.472	1.962	50	20	IDGD	
Cc1ccc2c(c1)C(=O)N(CC(=O)OCC(=O)NNC(=O)c1cccc(Cl)c1)C2=O	916524077	AJNMYOOSMYCLNM-UHFFFAOYSA-N	429.816	1.249	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)N[C@H]1CCN2CCCC[C@@H]12	916639259	SFLHWMIWJHIYOO-ROUUACIJSA-N	435.550	1.042	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)[C@H](CC(C)C)N1C(=O)[C@@H]2CC=CC[C@H]2C1=O	917360339	GISVQLHLVNJLPP-ZACQAIPSSA-N	437.500	1.770	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)N2CCN(CC(=O)N(C)C)CC2)c(C)n1C[C@H]1CCCO1	917367048	JDQVYZYEHFIQAG-NNVROAHOSA-N	427.549	1.423	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)CN(C)C(=O)c2ccc(Br)s2)n1	917392273	XKNQBXRUAXPTRS-UHFFFAOYSA-N	428.312	1.244	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)[C@@H]2CCCCN2C(=O)C(C)C)c2ccccc2c1=O	917565091	JMDBRDZZFKBCHV-KRWDZBQOSA-N	427.505	1.605	50	20	IDGD	
C[C@@H](Cc1ccsc1)NC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	919658189	FYFHEGNUBBSILX-AWEZNQCLSA-N	438.579	1.337	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)N[C@H](C)c1ccc(S(=O)(=O)NC)cc1	919779377	QZGFANSGSJDILA-CQSZACIVSA-N	434.518	1.628	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)CN2C(=O)N[C@]3(C[C@@H](C)CC(C)(C)C3)C2=O)cc1	919836508	VFHSCJZIRBSWKR-WNSKOXEYSA-N	444.532	1.912	50	20	IDGD	
O=C(NNC(=O)c1c(-n2cccc2)sc2c1CCSC2)N[C@H]1CCS(=O)(=O)C1	919890024	YLPGJZRQCGPOER-NSHDSACASA-N	440.572	1.459	50	20	IDGD	
O=C(NNC(=O)C1(c2ccc(F)cc2)CCOCC1)c1csc(N2CCOCC2)n1	919972941	KUUCUSOQBSKJBK-UHFFFAOYSA-N	434.493	1.628	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)Nc1ccc2c(c1)C(=O)NC2=O	920933305	LSHOWKPVYPSCQU-SECBINFHSA-N	447.245	1.953	50	20	IDGD	
CN(C)N(C(=O)c1ccc(CS(=O)(=O)c2ccccc2)o1)[C@@H]1CCS(=O)(=O)C1	1115816215	LJYWVPRAUJDEKY-CQSZACIVSA-N	426.516	1.359	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCC[C@@H](c3n[nH]cc3NC(C)=O)C2)cc1OC	1320768766	UHHPURWZNHPECJ-OAHLLOKOSA-N	444.492	1.026	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)[C@H]1CC12CCS(=O)(=O)CC2	1323637854	XQQNRRWVVYMPGC-CYBMUJFWSA-N	429.564	1.421	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)(C)O	1330155111	XAJJNLWTIHBSQL-SMDDNHRTSA-N	429.901	1.919	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2)c1cc(O)nc2ccccc12	1778547126	VXKMPBCZZPLOBZ-JBYIUTFZSA-N	447.919	1.668	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccn3ccnc3c2)C1	1779045663	WDCSNCWTZKTUKD-CBGDNZLLSA-N	434.924	1.716	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1COc3ccccc3O1)CCO2	1779293753	BOWKFVKZGJHSDC-RXVVDRJESA-N	434.565	1.508	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccnc4c3OCO4)C2)C1	1780030143	SOBIWHWSIBIRAZ-PIGZYNQJSA-N	426.267	1.037	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cc([N+](=O)[O-])cc4c3OCC4)CCO2)C1	1781220708	CHPDENXUHLNIPN-OXJNMPFZSA-N	437.880	1.991	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)[C@H](CN)c3ccccc3)CCO2)C1	1781227413	LDAAUXIGZJMEKV-UXPWSPDFSA-N	428.360	1.795	50	20	IDGD	
COc1ncc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)cc1C	1781328716	XCDZFEWSVWJFQW-DYVFJYSZSA-N	430.274	1.533	50	20	IDGD	
O=C(CC12CCCN1CCC2)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781333007	CUHZAJAYSJNPLZ-CRAIPNDOSA-N	432.334	1.525	50	20	IDGD	
O=C(c1cccc2ccnn12)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781333633	PHSGMRLRZKVXNI-RHSMWYFYSA-N	425.258	1.468	50	20	IDGD	
CC(=O)Nc1ccccc1C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781333932	ICAPTCPVEJDALW-MAUKXSAKSA-N	442.285	1.779	50	20	IDGD	
CCOc1ccc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](Cl)COC)C2)nn1	1782173459	CDWYTDZQWUYCCW-AKCHCHLHSA-N	440.928	1.257	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(C)c(C(=O)O)c(C)c3)C2)C1	1782174863	XRTBRDYSWUQZOC-IIBYNOLFSA-N	438.908	1.699	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cc4ncccn4n3)CCO2)C1	1783349094	HESREVRSRUNPRP-FZKQIMNGSA-N	436.310	1.346	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)C(=O)c3cccn3C)CCO2)C1	1783354533	STVKDSYZPDFZLR-FZKQIMNGSA-N	426.311	1.211	50	20	IDGD	
CC(C)[C@H]1CC[C@H](C(=O)N2CC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)CC1	1783375130	MLBMIKAQWLBPPT-DNVFCKCGSA-N	436.597	1.652	50	20	IDGD	
CC(C)c1ccc(CC(=O)N2CC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)cc1	1783431127	VMVAAJPWIZJHCE-XMMPIXPASA-N	444.576	1.555	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cccc4c3NC(=O)C4)CCO2)C1	1783538075	VUGJEPQFYFKXHN-BUXKBTBVSA-N	436.306	1.408	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@H]1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(C)(C)CCl)[C@H]2C1	1783856267	UCPJEIKHCBUFBG-PNKHAZJDSA-N	440.968	1.987	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(Cl)nc(OC)c3)CCO2)C1	1783877121	GCHJSZVNPGQAKC-UGSOOPFHSA-N	432.304	1.441	50	20	IDGD	
Cc1cc2[nH]c(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]4C3)cc2s1	1784092489	OLJLKCXRQJNUEC-APYUEPQZSA-N	425.938	1.731	50	20	IDGD	
O=C(CCc1cncc(C(F)(F)F)c1)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1784295944	AEFINCRQYLDDGU-CRAIPNDOSA-N	449.857	1.463	50	20	IDGD	
CC(=O)NC(C)(C)C(=O)Nc1ccc(C2(NC(=O)CCC(=O)NN(C)C)CCC2)cc1	1786391034	UAASOTFRJNPOLU-UHFFFAOYSA-N	431.537	1.408	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)COc3ccc(F)cc3)C[C@@H]21	1786404140	CTWZEKIZLDZCIC-JQFCIGGWSA-N	443.313	1.969	50	20	IDGD	
O=C1CN(CC(=O)Nc2ccc(C3(NC(=O)CCBr)CCC3)cc2)C(=O)N1	1786682804	ANVNMQPMQGDTLF-UHFFFAOYSA-N	437.294	1.457	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3nnc(C)o3)[C@H]2C1	1787030429	KPAFBTYYDFKJLL-FQUUOJAGSA-N	429.315	1.074	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)c1cnc2c(Cl)cccn12	1787241653	XAHPCEKIWXDSHX-RKLWJJNISA-N	441.315	1.181	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)Nc1ccc(C2(NC(=O)CC[C@@H](N)C(N)=O)CCC2)cc1	1790492567	JLIBPOQBLQHISX-KDOFPFPSSA-N	429.348	1.950	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](Br)CC)[C@H]2C1	1790964752	YSESTTZSEGTQBK-FQKPHLNHSA-N	449.342	1.701	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CC(=O)N(C4CCCC4)C3)C[C@@H]21)C(Cl)Cl	1791292857	TZJWNRAYGKBFQD-XRGAULLZSA-N	446.375	1.561	50	20	IDGD	
Cn1ncc2cc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]4C3)ccc21	1791294877	VKGICVNZPRSNFH-NOLJZWGESA-N	425.316	1.970	50	20	IDGD	
C[C@H](C(=O)Nc1ccc(C2(NC(=O)c3cnccc3C(=O)NN)CCC2)cc1)n1cccn1	1791880029	IBIGWNKNKFUXDC-OAHLLOKOSA-N	447.499	1.891	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C[C@H](N)c1cccnc1	1795681499	FEDBICNJDUCBML-RIUYPTKQSA-N	439.354	1.235	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CO[Si](C)(C)C)C2	1796891662	DFVWQLPPBZHANV-RUNXZISMSA-N	433.585	1.610	50	20	IDGD	
CCCC(=O)N[C@H](C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C(C)=N/NC(=O)c1ccc[nH]1	1796891942	PVPFDYXAWDNRIC-PGDIINEESA-N	444.536	1.063	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1[nH]nc3ccncc13)C2	1796892285	VKULKVJKLHRUFH-SSJPOKSSSA-N	448.487	1.344	50	20	IDGD	
CCOC(=O)c1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CO[Si](C)(C)C)cc1	1797957443	PFMKNSPTMQNERO-OPVJXMOQSA-N	448.592	1.918	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(N(C)C)nc1	1798268641	YXUZGNQENOFLPP-JYYAWHABSA-N	439.354	1.524	50	20	IDGD	
O=C(/C=C/C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](F)Br)C2)NCc1ccco1	1798570114	AYAZGXZFPHRJGS-HHNUNDILSA-N	442.285	1.781	50	20	IDGD	
NC[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Br)c1ccccc1	1799346149	FPJHURJOZMXOTR-YIDVYQOGSA-N	428.302	1.009	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnn3ccccc13)C2)[C@@H](F)Br	1799347296	KYWOGCXEAYIFIS-BAESOJJISA-N	425.258	1.228	50	20	IDGD	
CC(=O)N/C(=C\c1ccco1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2	1799687369	BVMSMBJEPPGQTR-MIPSWPEPSA-N	430.288	1.150	50	20	IDGD	
CCOC(=O)N1CCC(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](Cl)COC)CC1	1802283369	SIYCICZQTCFXEU-YYIAUSFCSA-N	429.945	1.747	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(-c3ncc[nH]3)cc1)C2	1802344207	QJMSDJOGBBMLHL-REPLKXPHSA-N	438.532	1.702	50	20	IDGD	
O=C(CN1CCSCC1)NC[C@@H]1CCN(C(=O)C(Cl)Cl)[C@H]1c1cccnc1	1802448992	MUIAZQQQPDNMSQ-HOCLYGCPSA-N	431.389	1.940	50	20	IDGD	
CC[C@@H](NC(C)=O)C(=O)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@H]1c1cccnc1	1802882298	NOGGUPSJMVHILA-FZKCQIBNSA-N	443.317	1.693	50	20	IDGD	
C#CC(=O)N1CC[C@@H](CNC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)[C@H]1c1cccnc1	1804240886	KXGHYVHQYIZRIO-XYJFISCASA-N	434.924	1.853	50	20	IDGD	
O=C(c1cc(-n2ccnc2)ccn1)N1CCC2(CCCN(C(=O)[C@@H](O)CCl)C2)CC1	1805525526	WXCJMCSATOVFPR-SFHVURJKSA-N	431.924	1.712	50	20	IDGD	
O=C([C@@H](O)CCl)N1CCCC2(CCN(C(=O)[C@@H]3C[C@@]34C(=O)Nc3ccccc34)CC2)C1	1805526328	RBRNKWJOJDHOLV-CEXJFXJFSA-N	445.947	1.727	50	20	IDGD	
Cc1cncc(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)c1	1805767470	QZSKKJBTNZYDSI-UGKGYDQZSA-N	444.300	1.098	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@@H]1c1cccnc1	1808232218	LPIRRNSTKDAABI-FQUUOJAGSA-N	444.305	1.225	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@@H](CNC(=O)c2cnc(O)nc2O)[C@@H]1c1cccnc1	1808276136	RLMFBWRSBBLSPR-ZFWWWQNUSA-N	433.896	1.867	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)c1ccc2nccn2c1	1809415278	WXAYSAQCRSZBJW-WDYCEAGBSA-N	427.892	1.649	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)c3ccn(C(F)F)n3)CC2)C1	1809971378	UOAACHFETCHYRB-UHFFFAOYSA-N	446.263	1.117	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1CCN(C(=O)CN2CCOCC2)[C@H]1c1cccnc1	1810540254	INEKGVPTVQMNCA-RXVVDRJESA-N	434.613	1.271	50	20	IDGD	
CN1C(=O)CC[C@H]1C(=O)N1CC[C@H](CNC(=O)CO[Si](C)(C)C)[C@H]1c1cccnc1	1810545252	WSTUZQJPANAIIR-FUHIMQAGSA-N	432.597	1.560	50	20	IDGD	
O=C(O)c1cnncc1C(=O)NC[C@H]1CCN(C(=O)C(Cl)Cl)[C@H]1c1cccnc1	1810804780	UZMKOMRUECFQDE-RISCZKNCSA-N	438.271	1.693	50	20	IDGD	
C[C@H](C(=O)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1)n1cccc1	1815361999	XVJPOLXYAUPWMZ-CZUORRHYSA-N	438.318	1.111	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2coc(Cl)n2)[nH]n1)c1cccc(B(O)O)c1	1817473089	DTLXZOXPHDRYHX-OAHLLOKOSA-N	443.656	1.351	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@H](O)CCl)CC2)c1cccc2c1OCCO2	1818311728	UUEGNPLQRNEIEM-ZWNOBZJWSA-N	437.905	1.740	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1ccoc1Cl	1820390720	KBWMFKZTDQTGJQ-MRXNPFEDSA-N	442.668	1.956	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)Cn2ccncc2=O)[nH]n1)[C@H](F)Br	1820938147	ZNZODUOHPIVYQT-ABAIWWIYSA-N	441.261	1.349	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)CC[C@@H]2CCOC2)n[nH]1	1823035388	PXSYLWBPJYQTNH-WBVHZDCISA-N	434.541	1.592	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](O)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@H](O)CCl)CC1	1824188191	OCPPAUJCVJQFQT-BZUAXINKSA-N	447.960	1.049	50	20	IDGD	
O=C(Cc1ccncc1)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827056368	FDAOTINZVFGHJJ-JOCHJYFZSA-N	435.333	1.237	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC([C@H]2CCCCN2C(=O)Cn2cncn2)CC1	1827185761	OULYHQAFJRSYBT-GOEBONIOSA-N	426.359	1.929	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H](N)Cc2cscn2)CC1	1827549839	KCOUIQHCMFOKBF-FGTMMUONSA-N	443.013	1.886	50	20	IDGD	
CC(C)n1cnc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)n1	1827863634	JIDJYMCVPTYLAU-GOSISDBHSA-N	447.584	1.465	50	20	IDGD	
CC[C@H](C)[C@H](O)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1	1828923695	UOERVOQHSCUHDS-YSSFQJQWSA-N	445.564	1.325	50	20	IDGD	
O=C(C1CC1)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)[C@H](O)CCl)C2)C1	1829444808	UMWPZWCOJKVEQU-XMSQKQJNSA-N	449.935	1.448	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3Cc4ccccc4CN3)C2)C1	1830358798	ZVTDFEJXIILHBU-AUSIDOKSSA-N	449.979	1.422	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccc(O)cn3)C2)C1	1830370827	ZEXHKGCNHGUTCL-HXUWFJFHSA-N	425.913	1.051	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)C#Cc3ccccc3)C2)C1	1830537569	KMWSNEGZCSQVOI-UWJYYQICSA-N	449.345	1.526	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3cnc4ccccn34)CCO2)C1	1830663854	NQVFXCSIHKVAKZ-DYESRHJHSA-N	434.924	1.351	50	20	IDGD	
CC(C)[C@H]1CC[C@H](C(=O)N2CCOC[C@@]3(CN(C(=O)[C@@H](O)CCl)CCO3)C2)CC1	1830736750	WOPYDCPBUWVSMW-NTLWEQJWSA-N	430.973	1.505	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3snnc3C3CC3)C2)C1	1831647096	QDGUHRNZFRXIIE-LIRRHRJNSA-N	442.969	1.893	50	20	IDGD	
C=CCNC(=O)/C=C\C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H](Cl)COC)CC1	1831827450	YFFSDGWDWJCBAI-MZIIKBMYSA-N	425.957	1.718	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(C(=O)O)ncn2)CC1	1831829004	WYXSSCGXLFTUIX-WMLDXEAASA-N	438.912	1.662	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3ccn4cncc4c3)CC2)CC1)[C@H](O)CCl	1833310142	KONBLKBVJJNMGQ-LJQANCHMSA-N	433.940	1.119	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)COc3cccnn3)CC2)CC1	1833534587	GGJKENXUUYRBDQ-SFHVURJKSA-N	437.972	1.835	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccccn3)CCO2)C1	1833980587	OCNVRUFDKOGSCR-KBXCAEBGSA-N	426.311	1.183	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)c3cncnc3)CC2)CC1	1834234618	ITNRELDQIVSBIY-AWEZNQCLSA-N	438.370	1.693	50	20	IDGD	
Cc1ccn(C)c1C(=O)N1CCOC[C@@]2(CN(C(=O)CCBr)CCO2)C1	1834824017	RDHNXKXDSMFAMX-GOSISDBHSA-N	428.327	1.189	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3[nH]nnc3C)CC2)CC1	1834935714	VISKTJLYQAHVNG-OAHLLOKOSA-N	441.374	1.472	50	20	IDGD	
Cc1noc(C)c1CC(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836714919	CRXCHFCDIVJJII-GOSISDBHSA-N	427.929	1.432	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3coc([Si](C)(C)C)c3)CCO2)C1	1837425163	GPEAKANZQOFYQT-JXFKEZNVSA-N	443.016	1.912	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)/C=N/O[C@@H]3CCCCO3)CCO2)C1	1837525400	NWUZCSBHBBGPDH-HNNRIZOBSA-N	445.944	1.237	50	20	IDGD	
CC(C)=NO[C@H](C)C(=O)N1CCOC[C@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1837714467	HOGGEARNIKNFAH-APWZRJJASA-N	429.590	1.095	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cn3cnc4ccccc43)C2)C1	1839148727	HXGVWMXFTQIVST-IIBYNOLFSA-N	434.924	1.510	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(C)c(C)n3)C2)C1	1840151074	VXHUUTXOAIRUOT-JXFKEZNVSA-N	425.913	1.022	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(OC)c3C)CCO2)C1	1840645220	JJKAIFXTSRBQSQ-UTKZUKDTSA-N	440.924	1.327	50	20	IDGD	
C[C@H]1CCC[C@@H]1C(=O)N1CC2(CCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)C1	1845038858	BDMLENAHWGKQMY-ICSRJNTNSA-N	441.576	1.972	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1ccc(F)nc1F	1847179207	JEZCLBKGDQQCJY-IBSSICKUSA-N	430.415	1.309	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](O)CCl)C[C@@H](F)C1	1847558454	FVLVSYWKVAPUIN-QRJUGERDSA-N	447.935	1.383	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CSCC(=O)O	1848098596	KUPLWOFXKNXNKQ-AVGNSLFASA-N	449.957	1.138	50	20	IDGD	
Nc1nccnc1C(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2Cl)c1	10291372	AOZIKXXSQIMKTH-UHFFFAOYSA-N	446.876	1.588	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)C2CCN(c3nc4ccccc4o3)CC2)C[C@@H](C)O1	10889349	GRHXJRIHMGTMTC-IYBDPMFKSA-N	429.521	1.691	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)[C@H](C)NS(=O)(=O)c2ccc(C)cc2)cc1	18072014	SNTKUAIGNVQHQS-JKSUJKDBSA-N	449.529	1.675	50	20	IDGD	
Cc1oc2nc[nH]c(=O)c2c1C(=O)NNC(=O)c1ccc(CSc2nncn2C)cc1	21291505	BJNQGIPNTNTYEW-UHFFFAOYSA-N	439.457	1.320	50	20	IDGD	
Cc1[nH]c(=O)[nH]c(=O)c1CCC(=O)NNC(=O)c1cc2c(s1)CC[C@@H](C(C)(C)C)C2	27314183	SLFSJQIGYHRVCA-CYBMUJFWSA-N	432.546	1.978	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CCS(=O)(=O)c2ccc(Cl)cc2)cc1OC	28776416	OWSJXMDZSLPRQR-UHFFFAOYSA-N	426.878	1.982	50	20	IDGD	
Cc1oc(C(=O)NNC(=O)c2cc(Cl)ccc2O)cc1S(=O)(=O)N1CCCC1	107929418	GGIQDKPTIFJGHL-UHFFFAOYSA-N	427.866	1.806	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)c2ccc(N3CCOCC3)cc2)c2ccccc2c1=O	109424990	NLNPBIUYZQLGQN-UHFFFAOYSA-N	435.484	1.889	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)c1cccc(CN2CCS(=O)(=O)CC2)c1	116206567	VIJGZOXRUWWHQU-OAHLLOKOSA-N	449.504	1.285	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)cc1	726068686	LEFQWSWDUXEGII-UHFFFAOYSA-N	442.538	1.068	50	20	IDGD	
COC(=O)N1CCC[C@@H](NC(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)C1	726716997	JNJLPEKXTGMMGC-CYBMUJFWSA-N	430.465	1.152	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1cc(C)nc2[nH]nc(C)c12	727003398	ULPSJOWEZAQFSD-UHFFFAOYSA-N	431.836	1.855	50	20	IDGD	
Cc1nc(S(=O)(=O)NNC(=O)[C@H]2Cc3ccccc3CN2Cc2ccccc2)cn1C	727112918	MBSQOTXKRPPXOE-HXUWFJFHSA-N	439.541	1.665	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CCC(=O)Nc2nnc(C3CC3)o2)ccc1OC(C)C	727764752	KQLPXAAQSZVDTK-UHFFFAOYSA-N	431.449	1.923	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)N[C@H](c1nc(C2CC2)no1)C(C)C	727943832	RUOMVSFZYWJJQS-ZDUSSCGKSA-N	449.537	1.890	50	20	IDGD	
COc1ccc(C(=O)N2CCN(C(=O)NNC(=O)c3cccc(C#N)c3)CC2)c(OC)c1	728953394	PGLHMBAZDJUUGL-UHFFFAOYSA-N	437.456	1.388	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)c2ccc3c(c2)C(=O)NC3=O)cc1	729517625	WBRBGDZSPCONMG-UHFFFAOYSA-N	436.453	1.066	50	20	IDGD	
CC(C)N1CCC[C@H](CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)C1	729618357	BTBILPORWYIJJC-OAHLLOKOSA-N	425.555	1.001	50	20	IDGD	
CC(C)N1C(=O)c2ccc(C(=O)NNC(=O)CCc3ccccc3O)cc2S1(=O)=O	730034072	QGBYYOHIUYIVDF-UHFFFAOYSA-N	431.470	1.339	50	20	IDGD	
O=C(NNC(=O)[C@H]1CC(=O)N(c2ccc(F)cc2)C1)C1CCN(c2ncccn2)CC1	730179505	LAOOWCRSECIZRT-HNNXBMFYSA-N	426.452	1.033	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)Nc1ccc(CC(=O)N2CCSCC2)cc1	730898741	AUSNBADQKYVVKF-UHFFFAOYSA-N	444.513	1.742	50	20	IDGD	
COC(=O)c1cc(C(=O)OC)cc(S(=O)(=O)NNC(=O)C(C)(C)c2ccccc2)c1	731180121	RJNXFMRDVRIZDZ-UHFFFAOYSA-N	434.470	1.547	50	20	IDGD	
COc1cc(N2C[C@@H](C(=O)NNC(=O)Cc3ccccc3F)CC2=O)cc(OC)c1OC	731328085	QWXCFFFCMAFIRL-AWEZNQCLSA-N	445.447	1.595	50	20	IDGD	
CCCCn1c(C)cc(/C=C(\C#N)C(=O)N[C@H](C)C(=O)N2CCS(=O)(=O)CC2)c1C	731476641	GXMVOZRUBBAGKM-CXDFQFJYSA-N	434.562	1.574	50	20	IDGD	
O=C(NC[C@@H](O)c1ccc(Cl)cc1Cl)NNC(=O)c1ccc(-n2cnnn2)cc1	732236509	XYXYEQVPRDCYAM-OAHLLOKOSA-N	436.259	1.647	50	20	IDGD	
COc1cc2cc(C(=O)NNC(=O)CCN3C[C@@H](C)O[C@H](C)C3)[nH]c2c(OC)c1OC	732260568	GCXHTGFSDCCXFV-CHWSQXEVSA-N	434.493	1.454	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)CCNC(=O)C23CC4CC(CC(C4)C2)C3)C[C@@H](C)O1	732260583	GMISTMYQAODORN-KEEFIYKFSA-N	434.581	1.356	50	20	IDGD	
Cc1cc(C)c(N2C[C@H](C(=O)NNC(=O)CCN3C[C@@H](C)O[C@H](C)C3)CC2=O)c(C)c1	732261985	PYSIHTXDOUUQLM-GUDVDZBRSA-N	430.549	1.611	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)N[C@@H](Cc1ccccc1)CN1CCOCC1	732476747	VGOZTEQEYCJZQW-IBGZPJMESA-N	436.516	1.530	50	20	IDGD	
CC(C)OCCCn1c(NNC(=O)Cn2ccc([N+](=O)[O-])n2)nc2ccccc2c1=O	733266040	PWPMXNLHCMOWSX-UHFFFAOYSA-N	429.437	1.460	50	20	IDGD	
O=C(COC(=O)c1ccc2nc(C(F)F)[nH]c2c1)NNC(=O)[C@@H]1COc2ccccc2O1	733539300	WBFGNSXAUUNLLP-HNNXBMFYSA-N	446.366	1.645	50	20	IDGD	
N#Cc1ccc(N2C(=O)N[C@H](CCC(=O)NNC(=O)c3cc(Cl)ccc3O)C2=O)cc1	733804738	KXVOMVNHOABRFF-OAHLLOKOSA-N	441.831	1.583	50	20	IDGD	
O=C(NNc1cnccn1)[C@@H]1CCCN(S(=O)(=O)c2ccc(Br)cc2)C1	734245546	OBGJNSWGWMEEOZ-GFCCVEGCSA-N	440.323	1.783	50	20	IDGD	
COc1ccc(CN2CC[C@@H](NC(=O)NNC(=O)COc3cccc(C)c3)C2=O)cc1	734516316	GKKPEPHDKYGUDF-LJQANCHMSA-N	426.473	1.514	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)cc1	734807354	MFFIINILOFXWGQ-UHFFFAOYSA-N	428.511	1.587	50	20	IDGD	
CC(C)Oc1ccc([C@H](O)CNC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1	734855951	UCZKMMBZPAPPFI-GOSISDBHSA-N	425.449	1.127	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)c2ccc(CS(N)(=O)=O)cc2)cc1C	736803320	PRDNUGQGQFZORS-UHFFFAOYSA-N	439.515	1.025	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)COCc1ccccc1)N1CCN(c2ccccc2)CC1	738451294	PDOXWFOFVKVFSB-LJQANCHMSA-N	425.533	1.744	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)NCCNc2nccc(C(F)(F)F)n2)cc1OC	739045912	QIOKTVUOLNSNAF-UHFFFAOYSA-N	442.398	1.959	50	20	IDGD	
COc1ccccc1-n1cc(S(=O)(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cn1	743258670	JBCMDRWXNGEBBQ-UHFFFAOYSA-N	438.469	1.690	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)N[C@@H]1CC(=O)N([C@H]2C[C@H]2c2ccccc2)C1	743700378	BDDPTFXUQGMGJV-YLAKUSLOSA-N	436.468	1.314	50	20	IDGD	
NC(=O)c1cn(CC(=O)NNC(=O)c2cc(Br)ccc2O)c2ccccc12	743734010	YKSBSICLMCZVMU-UHFFFAOYSA-N	431.246	1.670	50	20	IDGD	
O=C(NNC(=O)c1cc(I)ccc1-n1cnnn1)NC1CCCC1	744053239	LBHQSOLXJZGMEP-UHFFFAOYSA-N	441.233	1.154	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])c1	744992886	YRXLRMIYWWNVMW-UHFFFAOYSA-N	448.819	1.291	50	20	IDGD	
CCS(=O)(=O)c1ccc(F)c(C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)c1	745006990	XIIHROAOOHGNEE-UHFFFAOYSA-N	433.417	1.109	50	20	IDGD	
NS(=O)(=O)c1ccc(CCNC(=O)NNC(=O)Nc2ccc(OC(F)F)cc2)cc1	745255215	POPDBDCJEUXLDH-UHFFFAOYSA-N	443.432	1.514	50	20	IDGD	
O=C(COC(=O)[C@H](c1ccccc1F)N1CCOCC1)NNC(=O)c1ccc(Cl)cc1	745499070	QSTAQCUOPYHZQO-IBGZPJMESA-N	449.866	1.857	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCC2(SC)CCOCC2)nc1	745868346	BHNUIJPAXBNSFD-UHFFFAOYSA-N	431.584	1.650	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NC[C@H](C)Oc2ccccc2OC)c2ccccc2c1=O	745901352	HKOUBAXOPUVAKN-AWEZNQCLSA-N	439.472	1.837	50	20	IDGD	
CCn1c(SCC(=O)NNC(=O)Cc2cn3ccccc3n2)nnc1-c1ccco1	746544958	CHINUMYCSQGYCJ-UHFFFAOYSA-N	425.474	1.688	50	20	IDGD	
COc1cc(C)nc(NNC(=O)c2ccc(S(=O)(=O)N3C[C@@H](C)O[C@H](C)C3)cc2)n1	746630607	KLOPNUMOYZPFAL-ZIAGYGMSSA-N	435.506	1.348	50	20	IDGD	
Cn1ccnc(NNC(=O)C2CCN(S(=O)(=O)c3ccc4ccccc4c3)CC2)c1=O	747937343	BZKLNOHUNQDWSW-UHFFFAOYSA-N	441.513	1.478	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)NC[C@@]2(N(C)C)CCSC2)c1	748647124	JXBRNHGAKBXFED-INIZCTEOSA-N	431.356	1.839	50	20	IDGD	
CCO[C@H]1C[C@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)C1(CC)CC	749617589	QBTQOXBXNMEWDD-IRXDYDNUSA-N	440.566	1.865	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)CNC(=O)c2cc(-c3ccccc3)on2)o1	749738533	BSSWFYIDUNKPAZ-UHFFFAOYSA-N	439.472	1.967	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2ccc3c(c2)NC(=O)[C@@H](C)N3C)c2ccccc2c1=O	749866448	OQYPGGVULNTLQN-CYBMUJFWSA-N	448.483	1.658	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NNC(=O)COc2ccccc2F)cc1	750583624	RGQKDIVWUHCVMG-KRWDZBQOSA-N	435.477	1.514	50	20	IDGD	
CCn1cc([C@H]2C[S@@](=O)CCN2C(=O)NNC(=O)c2c(C)nc3ccccn23)cn1	753030529	HXLJBKLLSXNWIH-FOGNVHKLSA-N	429.506	1.019	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H]2C[C@@H](C)N(C3CC3)C2)c1	753943516	PBONWJCPDXZODX-ZBFHGGJFSA-N	437.566	1.286	50	20	IDGD	
CCn1c(=O)nc(O)c2c(C(=O)NNC(=O)Cc3ccccc3OC)cc(C3CC3)nc21	754425901	ZXCFQUYJXMOXNF-UHFFFAOYSA-N	437.456	1.407	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)c1cn(-c2ccccc2)nc1-c1ccccc1)S(C)(=O)=O	754673185	FJGNLFOTAHBFPE-OAHLLOKOSA-N	441.513	1.916	50	20	IDGD	
O=C(NNC(=O)c1cccnc1)Nc1cccc(S(=O)(=O)NC2=NCCCCC2)c1	755496246	SVQQCNRHRDJDGC-UHFFFAOYSA-N	430.490	1.799	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NN=CCCSC)N(S(C)(=O)=O)CC2	755573124	RMXBYGFLNCQXNQ-HNNXBMFYSA-N	429.564	1.808	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1C(=O)NC(C)C	756490557	PLVIOTGBRXENED-UHFFFAOYSA-N	436.472	1.847	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCCc3ccc(S(C)(=O)=O)cc32)cc1OC	756589767	PAFWUBXNWWUQIR-UHFFFAOYSA-N	447.513	1.321	50	20	IDGD	
CCOC(=O)[C@@H](C)NC(=O)c1ccc(NC(=O)NNC(=O)COc2ccccc2F)cc1	756789571	IAXZCSHARSQGTK-CYBMUJFWSA-N	446.435	1.739	50	20	IDGD	
COc1ccccc1N1CC[C@@H](NC(=O)NNC(=O)Cc2nc3ccccc3n2C)C1=O	757285406	HUJQHLXLHXYEMO-OAHLLOKOSA-N	436.472	1.260	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)Nc2ccc(F)c(S(=O)(=O)NC3CC3)c2)c1	757874568	QVRWVEGKGBHQOR-UHFFFAOYSA-N	435.481	1.799	50	20	IDGD	
COC(=O)c1ccccc1CCC(=O)N1CCN(S(=O)(=O)CBr)CC1	758514003	XKFZLQHCXAUYGY-UHFFFAOYSA-N	433.324	1.232	50	20	IDGD	
C[C@H]1CCCCN1S(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccccn2)c1	758834690	QBDRLGDRKQOGKA-AWEZNQCLSA-N	445.501	1.044	50	20	IDGD	
CC1(C)C(=O)N(C[C@@](C)(O)C(=O)OCC(=O)NNC(=O)c2cccs2)c2ccccc21	758885696	XWBGJTQVJHPOGM-OAQYLSRUSA-N	445.497	1.128	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)NC[C@@H]1CN(Cc2ccccc2)CCCO1	759233495	UTJMWEZIIAADAR-QGZVFWFLSA-N	435.525	1.133	50	20	IDGD	
Cc1nn(-c2ccccc2)c2sc(C(=O)NNC(=O)NC[C@@H]3CC[C@@H](C(N)=O)O3)cc12	760204315	QHZSJVASYFQLDM-ZFWWWQNUSA-N	442.501	1.372	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)CN2C(=O)N[C@]3(C[C@H](C)CC(C)(C)C3)C2=O)n1	762899340	BHNXVUDTMUMRMX-SZNDQCEHSA-N	431.541	1.903	50	20	IDGD	
COc1cccc(/C=C(/C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)n2nnnc2C)c1	762936661	FCVBBUBGTQGSQR-NDENLUEZSA-N	444.455	1.840	50	20	IDGD	
Cc1nnnn1/C(=C/c1ccc(F)cc1)C(=O)NNC(=O)c1cc(-c2ccccc2)[nH]n1	762937748	LRQORNLFQRWGJL-YBFXNURJSA-N	432.419	1.970	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(OC)c(OC)c3)[nH]n2)cc1	763147473	HSPUNOIRWVYQCI-UHFFFAOYSA-N	439.428	1.502	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)NC(C)C)cc2)cc1OC	763543769	OVGPUTOYMYSSPC-UHFFFAOYSA-N	428.445	1.242	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)C(=O)Nc1cccc(OCc2cscn2)c1	763559801	VPNQTLWBDBFAEL-UHFFFAOYSA-N	440.437	1.851	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)Nc1ccccc1OCC(F)(F)F	763570800	IAIQGNDFQLRNOR-OAHLLOKOSA-N	439.346	1.554	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)n(-c2ccccc2)n1	763611848	DUZLIILOEBACDB-UHFFFAOYSA-N	429.440	1.971	50	20	IDGD	
CC(C)Oc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1	763717973	DUORYLADAWUYMX-UHFFFAOYSA-N	448.501	1.124	50	20	IDGD	
O=C(NNC(=O)c1cccc(Cl)c1)C(=O)Nc1cccc(S(=O)(=O)NC2CC2)c1	763747523	AIOONAPLXCGUKU-UHFFFAOYSA-N	436.877	1.180	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)C(=O)Nc1ccc(-n2nccn2)nc1	763848981	GCWIXNIZPGMITO-CQSZACIVSA-N	445.439	1.369	50	20	IDGD	
COC(=O)c1cc(C)ccc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1cccc(C)c1C	763852179	VWOSJKBNOKFINS-OAHLLOKOSA-N	427.457	1.952	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)NNC(=O)C(=O)Nc1ccccc1C(=O)N1CCCC1	763865770	VUMURPTWFKTJKN-UHFFFAOYSA-N	433.468	1.733	50	20	IDGD	
CCNC(=O)c1ccc(C)c(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)c1	763867911	YRVBZFPLRAJEJY-CYBMUJFWSA-N	430.436	1.437	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)n1	763886297	RYUGGTVVAZRHRH-HXUWFJFHSA-N	430.468	1.942	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)CC(C)C)c(C(=O)N2CCCCC2)cc1OC	763889111	XLRRDDWVUZRLOG-UHFFFAOYSA-N	434.493	1.462	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(N)=O)c(Cl)c2)cc1OC	763910299	CKBBUJGHUAMTDN-UHFFFAOYSA-N	448.863	1.636	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccn(CC(F)F)n2)ccc1OC(C)C	763921697	NTXVGPIHKSXPIH-UHFFFAOYSA-N	425.392	1.344	50	20	IDGD	
CCN(CC)CCNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2ccccc2C)c1	763956737	WCUWLQZZWRVOEC-UHFFFAOYSA-N	439.516	1.466	50	20	IDGD	
O=C(CN1CCCCCCC1)Nc1ccc(NC(=O)C(=O)NNC(=O)c2ccc[nH]2)cc1	763980344	RHISJQNMPUTPKB-UHFFFAOYSA-N	440.504	1.619	50	20	IDGD	
COCCn1ncc2ccc(NC(=O)C(=O)NNC(=O)c3ccc(Cl)cc3OC)cc21	764011844	KGJYHUWGRYQZLI-UHFFFAOYSA-N	445.863	1.744	50	20	IDGD	
CCCCOc1cccc(NC(=O)C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c1	764076673	FAWJJIKYPCEFAB-UHFFFAOYSA-N	433.486	1.669	50	20	IDGD	
CCCN1C(=O)CCc2cc(NC(=O)C(=O)NNC(=O)Cc3ccccc3OC)ccc21	764135444	GRXQBXCOAUQJRY-UHFFFAOYSA-N	438.484	1.713	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(C#N)c2)cc1OCc1ccncc1	764231961	KPXVHSSHRXBAHJ-UHFFFAOYSA-N	445.435	1.941	50	20	IDGD	
CCNC(=O)c1ccc(C)c(NC(=O)C(=O)NNC(=O)c2cccc(OC(F)F)c2)c1	764259414	HFKBQXJVDOHTDA-UHFFFAOYSA-N	434.399	1.746	50	20	IDGD	
CC(C)(C)c1nsc(NC(=O)C(=O)NNC(=O)c2cc(Br)ccc2O)n1	764280761	SLRGHOPPWCMYNM-UHFFFAOYSA-N	442.295	1.703	50	20	IDGD	
COCC(=O)NNC(=O)C(=O)Nc1ccc(Br)cc1-c1nc(C2CC2)no1	764300377	ZBJBXPHBLAHDBU-UHFFFAOYSA-N	438.238	1.109	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C(=O)N1C[C@@H](C(=O)OC)Oc2ccccc21)c1ccccc1	764330977	ZUYCQUJQFDGEDO-YJBOKZPZSA-N	425.441	1.295	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)C(=O)Nc1cccc(CN2CCCC2=O)c1	764350810	LXEHUTRVHSOMRB-UHFFFAOYSA-N	446.467	1.394	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)C(=O)Nc1cc(F)ccc1OC[C@@H]1CCCO1	764367797	ZUSPAYZFROSHPV-KRWDZBQOSA-N	445.447	1.686	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc4c(c3)ncn4C)n[nH]2)cc1	764385334	XZNUYYPLQQZZGY-UHFFFAOYSA-N	431.456	1.926	50	20	IDGD	
CC(=NNC(=O)c1csc(N2CCOCC2)n1)c1ccc(Cl)c(S(N)(=O)=O)c1	764664397	ACCBQQWHZLCUNC-UHFFFAOYSA-N	443.938	1.435	50	20	IDGD	
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	765315104	AQTUGHUKPCUHFG-KXBFYZLASA-N	430.530	1.555	50	20	IDGD	
COCCS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)cc1	765618849	PIKMNOTUMCJCSR-UHFFFAOYSA-N	446.460	1.711	50	20	IDGD	
Cc1nn(-c2ccccc2)cc1C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765734746	DDRMDLSWMUAXNI-UHFFFAOYSA-N	446.511	1.400	50	20	IDGD	
C[C@H](O)C(=O)N1CCN(C(=O)/C(C#N)=C/c2cn(CCC#N)nc2-c2ccccc2)CC1	766017247	ZQBXNDOIUOPTOL-WFVLPUPGSA-N	432.484	1.422	50	20	IDGD	
COC(=O)c1cc(C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)ccn1	766659623	DJGDMCLWWMUPMM-UHFFFAOYSA-N	445.907	1.100	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2O1)C(=O)Nc1cnc(Cl)c(Br)c1	768239887	QKSMKSJNQKMGIS-GFCCVEGCSA-N	439.653	1.587	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)CCNS(=O)(=O)c1ccccc1F	768611914	KDSKGKMCCSZVHJ-UHFFFAOYSA-N	445.494	1.050	50	20	IDGD	
CCOc1cc(/C=C/C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)ccc1O	768623991	KMEVQRXKMMEZGG-LHUXKHBRSA-N	442.424	1.335	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)[C@@]1(F)CCN(C(=O)OC(C)(C)C)C1	768628875	BLFSCLWIHIWMPB-GOSISDBHSA-N	431.486	1.891	50	20	IDGD	
CS(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)c2ccc(Cl)cc2O)cc1F	771143439	MWOZLBDKZMLFIK-UHFFFAOYSA-N	437.858	1.180	50	20	IDGD	
Cc1cn(-c2ccccc2)nc1C(=O)N1CCN(S(=O)(=O)CBr)CC1	771448381	TYGWUJDVTBICIS-UHFFFAOYSA-N	427.324	1.621	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)[C@@H]1CCCN(C(=O)c2ccccc2OC(F)F)C1	771987640	GHOPILFXEONMPD-QWHCGFSZSA-N	441.431	1.629	50	20	IDGD	
CNC(=O)COc1cccc(CC(=O)NNC(=O)c2cc(-c3cc(C)ccc3C)[nH]n2)c1	772227090	DXJKWVYJKXDVFG-UHFFFAOYSA-N	435.484	1.822	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)Nc1cnn(Cc2nnc3n2CCCC3)c1	772642876	XFWPLUWCOAQINX-UHFFFAOYSA-N	425.409	1.234	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)C[C@H](NC(N)=O)c2cccs2)C1	773418332	TWJPFBYKLAXEHY-STQMWFEESA-N	439.538	1.642	50	20	IDGD	
O=C(NNc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(F)c(N2CCCS2(=O)=O)c1	773644077	YIFQHVUZFHRTRL-UHFFFAOYSA-N	437.409	1.356	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccc(OCCC(N)=O)cc1	774008805	LXNRPESFBPUNGL-LBPRGKRZSA-N	448.863	1.148	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)cc1[N+](=O)[O-]	774010749	ZAJZDYKDMLGQLX-SNVBAGLBSA-N	436.808	1.810	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@H](NC(=O)NNC(=O)C(=O)Nc1ccccn1)C1CCCC1	775120484	MMWHPCWFRSKDEY-AWEZNQCLSA-N	434.497	1.434	50	20	IDGD	
COCCO[C@@H]1COCC[C@@H]1NC(=O)NNC(=O)c1cc(C)n(-c2ccccc2)c1C	777275158	NMTKDSZQDCEVGB-VQTJNVASSA-N	430.505	1.859	50	20	IDGD	
Cc1nn(CC(F)(F)F)c(C)c1[C@H](C)C(=O)NNC(=O)CNC(=O)c1cccnc1	778509454	SWIKTTHNTUFRPC-JTQLQIEISA-N	426.399	1.138	50	20	IDGD	
C[C@H]1CN(Cc2ccc(CNC(=O)NNC(=O)CNC(=O)OC(C)(C)C)cc2)C[C@H](C)O1	778614652	UPABKSFUQCDZEC-HOTGVXAUSA-N	449.552	1.651	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H]1CCC[C@H](NC(=O)NNC(=O)CNC(=O)c2cccs2)C1	782562574	ZDSLXLGHZABUCB-STQMWFEESA-N	439.538	1.644	50	20	IDGD	
CNC(=O)COc1ccc(NC(=O)C(=O)NNc2ncc(C(F)(F)F)cc2Cl)cc1	782853779	IPVXSKWFRAKFFB-UHFFFAOYSA-N	445.785	1.960	50	20	IDGD	
Cc1coc(-c2cccc(NC(=O)C(=O)NNC(=O)Cc3nc4ccccc4n3C)c2)n1	782885125	DWWAQHHQASVHBX-UHFFFAOYSA-N	432.440	1.865	50	20	IDGD	
CCOc1cc(Cl)ccc1NC(=O)C(=O)NNC(=O)Cc1nc2ccccc2n1C	782886468	KULCAMUBQJXWIS-UHFFFAOYSA-N	429.864	1.954	50	20	IDGD	
COC(=O)CNC(=O)c1ccc(NC(=O)C(=O)NNc2ccc(Cl)cc2[N+](=O)[O-])cc1	783289694	RTDMNHWXHFIPHV-UHFFFAOYSA-N	449.807	1.233	50	20	IDGD	
O=C(NNc1ccc(-n2cccn2)nn1)C(=O)Nc1cccnc1OCc1ccccc1	783432975	INPRNVUMCVVIOO-UHFFFAOYSA-N	430.428	1.718	50	20	IDGD	
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)NNC(=O)c1ccc(Cl)cc1OC	783810898	CCUJJVXOLNLSJD-UHFFFAOYSA-N	443.821	1.667	50	20	IDGD	
Cc1ccc(SCC(F)(F)F)c(NC(=O)C(=O)NNC(=O)C(=O)N2CCCC2)c1	784000234	RGGMCSAWCZPSEB-UHFFFAOYSA-N	432.424	1.358	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)C(=O)Nc1cc(Cl)ccc1Br	784005030	XFSSLLWDYWZSIC-UHFFFAOYSA-N	443.641	1.211	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)COCCNC(=O)c3ccccc3)n[nH]2)cc1	784683934	MQQUXFWLEKFQGH-UHFFFAOYSA-N	435.484	1.847	50	20	IDGD	
Cc1ccc(C(=O)NCC2CC2)cc1NC(=O)C(=O)NNC(=O)COCc1ccccc1	785991054	NMSVMLVLZISHBQ-UHFFFAOYSA-N	438.484	1.438	50	20	IDGD	
Cc1nc(Cn2cc(C(=O)NNc3cc(C(F)(F)F)nc(-c4ccccn4)n3)nn2)no1	787885851	HIUKWWXDXCCVHQ-UHFFFAOYSA-N	446.353	1.646	50	20	IDGD	
COC[C@@H](C)n1c(C)cc(/C=C(/C#N)C(=O)NCCCn2c(=O)ccn(C)c2=O)c1C	788219765	GOEBHXMONVMSTQ-BKAYVGFPSA-N	427.505	1.286	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)c(C)cc1C	788330426	GWPZPPLJOMFAPS-CYBMUJFWSA-N	431.420	1.783	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)c1ccc2c(c1)SC1=NS(=O)(=O)CCN12	789114953	HHWZGHPFRAUJAT-UHFFFAOYSA-N	434.474	1.441	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)C(=O)Nc1cc(C2(C)CCCC2)on1	789734899	IWBRLKGNNVRRMY-UHFFFAOYSA-N	437.497	1.897	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N[C@@H](C)c1nnnn1C1CC1	790711726	BJGNPEJSVSTNLX-UWVGGRQHSA-N	438.286	1.629	50	20	IDGD	
O=C(CCCNS(=O)(=O)c1ccc2c(c1)CCCC2)NNc1nc2ccccn2n1	791243483	BREONOFBWRISLN-UHFFFAOYSA-N	428.518	1.810	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)NC(=O)OC(C)(C)C	792265074	UQMBPWFTIZDHAC-KRWDZBQOSA-N	448.568	1.442	50	20	IDGD	
COC(=O)c1ccc(NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c(N(C)C)c1	792418843	NODSMPXTXKLRKM-UHFFFAOYSA-N	434.474	1.409	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)c(F)cc1C	793049973	KSSFXFPXRCJZPV-UHFFFAOYSA-N	441.419	1.287	50	20	IDGD	
O=C(NNC(=O)[C@H]1OCC[C@H]1c1ccccc1)C(=O)Nc1nc(C(F)(F)F)cs1	793067381	JJGYODJZELHGSY-JQWIXIFHSA-N	428.392	1.821	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=S)NCCCCC(F)(F)F)cc1	794965660	GWUCGWXYDRQHFS-UHFFFAOYSA-N	440.513	1.843	50	20	IDGD	
O=C(CN1CCCC[C@H]1COC(=O)N[C@H]1CCOC1)NNC(=O)c1cccc(Cl)c1	796548543	NGMVNYUIASKPMA-IRXDYDNUSA-N	438.912	1.471	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2csc(N3CCOCC3)n2)c(C)cc1C	797034617	NEAWVTYUSSQZTP-UHFFFAOYSA-N	433.490	1.005	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)Cc3ccc([S@@](C)=O)cc3)n[nH]2)cc1OC	797964518	JXMYBYXBTZRGRO-WJOKGBTCSA-N	442.497	1.835	50	20	IDGD	
Cc1ccccc1NC(=O)NNC(=O)[C@@H]1CCCN1C(=O)/C=C\c1ccc(C(N)=O)cc1	798313731	SNASZHRISBHIJI-XGCMIMOYSA-N	435.484	1.951	50	20	IDGD	
NC(=O)c1cc(Br)cc(S(=O)(=O)NNC(=O)c2cc3c(s2)CCC3)c1	799518575	IXRTULWJHKNAQE-UHFFFAOYSA-N	444.332	1.722	50	20	IDGD	
O=C(CNC(=O)c1ccc2c(c1)OCO2)NNC(=O)Nc1ccc(Br)cc1	802000622	WGNZDOZNPXLXMM-UHFFFAOYSA-N	435.234	1.761	50	20	IDGD	
COc1ccc(Cl)c(NC(=O)NNC(=O)C2=NN(c3ccc(F)cc3)[C@H](C(N)=O)C2)c1	802114262	XAKGVDPNUSLNHH-INIZCTEOSA-N	448.842	1.761	50	20	IDGD	
COc1ccc(C2=NO[C@@H](CNC(=O)NNC(=O)Cc3nc4ccccc4n3C)C2)cc1	802366125	BYRJCHLHWBKCKX-MRXNPFEDSA-N	436.472	1.648	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)Nc1ccc(OC(F)F)cc1F	802565693	GIFSKQRPINHPMP-AWEZNQCLSA-N	425.319	1.353	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(NC(=O)NNC(=O)c2ccc(Cl)cc2O)ccc1F	806541641	GYLSQSLTRJPQKM-UHFFFAOYSA-N	430.845	1.902	50	20	IDGD	
COc1cccc([C@H](CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)N(C)C)c1	807006646	SARBSBDEZGOPFE-KRWDZBQOSA-N	448.549	1.235	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)N1CCN([C@H]2CCN(C(=O)OC(C)(C)C)C2)CC1	808769880	DONPPBYXSMOYSX-IRXDYDNUSA-N	425.574	1.195	50	20	IDGD	
COC[C@@]1(CNC(=O)NNC(=O)c2ccc3c(c2)OCCO3)OCCc2ccccc21	811922831	QUPLOYYUEMVHJY-JOCHJYFZSA-N	427.457	1.516	50	20	IDGD	
CCOC(=O)c1cc(COC)cc(S(=O)(=O)NNC(=O)COc2ccccc2O)c1	813665252	JLABFHHLTZXBNN-UHFFFAOYSA-N	438.458	1.104	50	20	IDGD	
COC(=O)c1cc(C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)c[nH]1	815827861	RMVXMPARPUMTNW-UHFFFAOYSA-N	433.896	1.034	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1nc(F)ccc1Br	816827860	IEFCKKVZMXQAKK-UHFFFAOYSA-N	444.286	1.660	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)/C(=C\c2ccc(F)cc2)n2nnnc2C)cc1OC	818013015	WUOUVTOEISFOGN-MHWRWJLKSA-N	426.408	1.597	50	20	IDGD	
O=C(Cc1ccccc1)NCCC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	821708614	YUCRSKDMOUFEMD-UHFFFAOYSA-N	437.544	1.095	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)/C=C\c1ccccc1)C(=O)NNC(=O)c1ccccn1	866597777	FTOYVCYDBOGREO-IFCKCIONSA-N	434.543	1.555	50	20	IDGD	
CC(C)CCC[C@H](C)NC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	915884325	TYSMRRVODMXAEV-INIZCTEOSA-N	426.587	1.859	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)NC[C@@H](c2cccs2)N2CCOCC2)cc1	915894179	WNLFVGMYPPUIEK-KRWDZBQOSA-N	429.502	1.402	50	20	IDGD	
CC(=O)c1ccc(CC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc1	916126707	IIUHYWSQLIAIPV-UHFFFAOYSA-N	429.498	1.677	50	20	IDGD	
O=C(COC(=O)CCC(=O)c1ccc(F)cc1F)NNC(=O)[C@@H]1COc2ccccc2O1	917334297	JSQMHYXXUMSDPT-SFHVURJKSA-N	448.378	1.458	50	20	IDGD	
CCc1ccccc1OCC(=O)NNS(=O)(=O)c1cc(OC)c(OC)c(C(=O)O)c1	917720727	ZIEMPYCUWWVADC-UHFFFAOYSA-N	438.458	1.353	50	20	IDGD	
CCCC(=O)N1CCCC[C@@H]1C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	918142613	IQKRHALRJGUHKA-HXUWFJFHSA-N	429.565	1.527	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)CS(=O)(=O)Nc2ccc(OC(C)C)cc2)cc1	918412806	KFRMRYUAEKEEPS-UHFFFAOYSA-N	435.502	1.750	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)NNC(=O)c2c(C)nc3ccccn23)cc1OC	918776082	ILCUIRKCQATBMG-UHFFFAOYSA-N	426.433	1.339	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CC(c2ccc(Cl)cc2Cl)=NO1)N[C@H]1CCS(=O)(=O)C1	919883669	BVOSPUYNAJZYNY-ZANVPECISA-N	435.289	1.004	50	20	IDGD	
CCN(Cc1ccccc1)C(=O)CNC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	920050795	FJFFVVMRQLLUFS-UHFFFAOYSA-N	432.502	1.083	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)NCc2ccc(C(=O)N3C[C@H](C)O[C@@H](C)C3)cc2)n1	920348684	KFQLXBBDYNQMPJ-IRXDYDNUSA-N	442.520	1.280	50	20	IDGD	
CCOc1ccc(NC(=S)NNC(=O)c2ccc(S(=O)(=O)NCCC#N)cc2)cc1	921160110	FJHQYZPTAXPWPR-UHFFFAOYSA-N	447.542	1.909	50	20	IDGD	
CN1C(=C(C#N)C(=O)COC(=O)c2ncc(C(N)=O)cc2Cl)N(C)c2ccccc21	1116455722	HIFDKLKUPAMADC-UHFFFAOYSA-N	425.832	1.881	50	20	IDGD	
CC1CCN(CCC(=O)NN=C[C@H]2CCCN(C(=O)CNC(=O)OC(C)(C)C)C2)CC1	1116873838	LGHDAOLOXXFXNP-GOSISDBHSA-N	437.585	1.974	50	20	IDGD	
COc1ccc([C@@H]2[C@@H](C(=O)NNC(=O)c3n[nH]c4c3CCCC4)CCC(=O)N2C)cc1	1251882118	QNRQCGXHSGTBIP-OXJNMPFZSA-N	425.489	1.668	50	20	IDGD	
CN(C)CCS(=O)(=O)c1ccccc1C(=O)NNc1cncc(Br)c1	1253950502	SJTDOKIHRDMZCB-UHFFFAOYSA-N	427.324	1.936	50	20	IDGD	
COc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NNc2cncc(Br)c2)cc1	1319759683	CUDLGMUSJBTHAX-JTQLQIEISA-N	429.296	1.663	50	20	IDGD	
CCOc1ccc(C(=O)NCC(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1	1337969628	SUDHHDVSKFFLPN-UHFFFAOYSA-N	448.520	1.610	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)c2n[nH]cc2Br)CC1	1347433846	SAPBRKTYQBQTIQ-UHFFFAOYSA-N	431.291	1.516	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2[nH]nc3ncccc23)C1	1777914233	KMHPOYIVPJJLNL-STXHMFSFSA-N	435.912	1.339	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](N)Cc2cscn2)C1	1777965832	KWIVGPYDAFVOJX-AXVVYFOYSA-N	443.013	1.934	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4ncncc4c3)C2)C1	1778605460	UEAHWPWNVNDMTO-YJYMSZOUSA-N	433.306	1.857	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCN2CCOC2=O)C1	1778782223	OGNWHSTWGVNYPZ-OXQOHEQNSA-N	441.601	1.194	50	20	IDGD	
O=C(/C=C\C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Br)C1)NC1CC1	1780774783	MMIJMYAQVKEYOK-JEWVKGLTSA-N	446.317	1.026	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)CCN3C(=O)c4ccccc4C3=O)CCO2)C1	1781215663	UTUDDOIGXDSNMQ-JTSKRJEESA-N	447.919	1.520	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3c(-c4ccncn4)noc3C)CCO2)C1	1781221088	JKWLGHHDDVWPIE-JLTOFOAXSA-N	433.896	1.901	50	20	IDGD	
Cc1ccn2c(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)[C@@H](O)CCl)C4)cnc2c1	1781398619	ZZNRNNPODGGFKJ-CSODHUTKSA-N	434.924	1.370	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccccc3-n3nccn3)C2)C1	1781834915	RWXWLOVIJFYBLD-NRFANRHFSA-N	431.924	1.976	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(Cl)nn1)C2	1782176254	YSWCKRKSIKIDKD-WPKBUWHJSA-N	431.320	1.511	50	20	IDGD	
CC(C)NC(=O)OC(C)(C)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](C)Br)C2)C1	1783538907	YSHAESGCDMKVOG-SCLBCKFNSA-N	448.358	1.513	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)CCc3c[nH]c4ncccc34)CCO2)C1	1783883862	MDDZSKHPAZMMIX-UWJYYQICSA-N	434.924	1.579	50	20	IDGD	
CCn1nc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCBr)[C@H]3C2)cc1C	1786406076	HCVOQDLJPPKAKN-DZKIICNBSA-N	427.343	1.590	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C[C@@H](N)c3cccnc3)[C@H]2C1	1786929691	FAQFVVCKIVBQMG-OKYOBFRVSA-N	434.613	1.303	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cn3cc(C)cn3)[C@H]2C1	1787116989	BGCCNGOFFVHGHT-JONQDZQNSA-N	427.343	1.345	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccnn3CCOC)[C@H]2C1	1787624876	OMFOONWIUNVSTI-OVWQWFNUSA-N	426.945	1.530	50	20	IDGD	
O=C(CC1CCOCC1)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1	1787918223	MXVZVRZTELDEQO-UHFFFAOYSA-N	436.317	1.931	50	20	IDGD	
Cc1ccc(CCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]3C2)nc1	1789922803	UJLTUPFKCXVGHH-OWIUFQIYSA-N	442.329	1.993	50	20	IDGD	
CCOc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]3C2)nn1	1789924557	MBKRLARNFSMESB-UHXUCMFUSA-N	445.289	1.159	50	20	IDGD	
COc1ccc(C(=O)Nc2ccc(C3(NC(=O)c4cccc(B(O)O)c4)CCC3)cc2)nn1	1789960444	FXFJTLHHMGDDLI-UHFFFAOYSA-N	446.272	1.227	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3c(O)cc(O)cc3O)[C@H]2C1	1790154815	DPYVAKPFRMSEHW-JDFRZJQESA-N	438.553	1.248	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccnc(F)c3)C[C@@H]21	1790957873	BCCGSKWEWVZWMH-XQLPTFJDSA-N	428.302	1.988	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3c(F)cc(OC)cc3F)C[C@@H]21	1791257154	QVVMHFBJBZOKMC-DPYKFYPSSA-N	446.878	1.821	50	20	IDGD	
O=C(CCc1ncc[nH]1)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1	1791757770	MYDHNPJJBHYZOB-UHFFFAOYSA-N	432.289	1.470	50	20	IDGD	
Cc1cnn([C@H](C)C(=O)Nc2ccc(C3(NC(=O)c4cccc(B(O)O)c4)CCC3)cc2)c1	1791843040	ICSNSEDGQSNCNY-QGZVFWFLSA-N	446.316	1.880	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCC(=O)N1CCCC1)C2	1792868674	KBSMLSKRLZCMEK-AFIMGQEJSA-N	444.370	1.010	50	20	IDGD	
CN(C)c1cncc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Br)C3)c1	1794297167	PKFAWCUYFKIOKH-AYRXBEOTSA-N	429.290	1.041	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnn2c(C)cc(C)nc12	1796919291	QKFRIJNQCONADC-MVJTYMMSSA-N	433.940	1.957	50	20	IDGD	
Cc1ccc(OC(C)(C)C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CO[Si](C)(C)C)nc1	1797956139	DFVJKJORMFBBNG-XEMDLRDOSA-N	449.624	1.989	50	20	IDGD	
Cc1cccc2cc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)c3cccc(B(O)O)c3)C4)[nH]c12	1798025075	XSPMNFSYIXQJKP-ACDBMABISA-N	431.301	1.722	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(C#N)c1Cl	1798592798	ZZSXTJSLPYLKFM-IARIHHJXSA-N	426.300	1.669	50	20	IDGD	
COc1ccsc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnccc1C(=O)NN)C2	1799016839	ADGVFXPWYOUOQX-CLLJXQQHSA-N	429.502	1.321	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CCN1C(=O)OC(C)(C)C)C2	1799263307	JTNIDJZVCZJZMW-NPJQDHAYSA-N	429.945	1.603	50	20	IDGD	
C[C@H](Cc1ccncc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Br	1799347235	NCWQWQLOENNIOV-YMILTQATSA-N	428.302	1.540	50	20	IDGD	
CN(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc[nH]n1)C2)NC(=O)NCc1ccccc1	1799866012	VXESHQJHTQCYBN-BCDXTJNWSA-N	439.520	1.008	50	20	IDGD	
COCCCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C#N)=C/c1ccc(F)cc1F	1800332453	MPLMEORIBOWIFA-JFABSOQWSA-N	433.455	1.888	50	20	IDGD	
COc1ccc(F)cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)Br	1800763188	SAVYDJLEZXXFMO-LSSIXWDNSA-N	429.286	1.821	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CCc3ccccc3[C@H]1O)C2	1800970378	DCHGQZFIOVFKQD-BPEACIIKSA-N	436.936	1.126	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1CCN(c3ccccc3)CC1)C2	1800970871	LVOBOYSPZKXOJO-YHELAOLJSA-N	449.979	1.746	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cc(Cl)ccc1OC)C2	1800979596	QIPKTTUHKLNACE-MVWRLGRASA-N	445.343	1.735	50	20	IDGD	
Cc1nccn1CCCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Br)C2	1801310512	CRDQWLSPMWDOLF-JJAZEVLHSA-N	427.343	1.345	50	20	IDGD	
COC(OC)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)CBr)[C@@H]1c1cccnc1	1803344798	WRPIAPBPVPTACC-AEGPPILISA-N	428.327	1.737	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1)c1ccc(O)nn1	1805267431	IRFMBNMSHKSDTL-DYVFJYSZSA-N	434.294	1.682	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H](CNC(=O)c2cc(O)n[nH]2)[C@H]1c1cccnc1	1807284010	ONSOZJLXPHCFRF-AXAPSJFSSA-N	436.310	1.861	50	20	IDGD	
C[C@@H]1CCC[C@@H]1C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1809656373	KAYCDVDRQJOYSK-ZKMOHVOUSA-N	435.333	1.517	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)c1ccc2cccnc2n1	1809724057	WRNSZRGZOXBBOZ-YTQUADARSA-N	439.903	1.944	50	20	IDGD	
CCc1nc(C(=O)N2CCC3(CCCN(C(=O)c4cccc(B(O)O)c4)C3)CC2)co1	1809978091	XAKBYPJMRMFWON-UHFFFAOYSA-N	425.294	1.075	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)c1cccn2cncc12	1809990708	BHLRROHENSCKBA-KFKAGJAMSA-N	427.892	1.649	50	20	IDGD	
Cc1oncc1C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1	1810299573	SMXTVCFYQACSGA-HNAYVOBHSA-N	449.471	1.010	50	20	IDGD	
CCC(C)(C)C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1	1810304517	DRQGZSVLDOQTPO-LPHOPBHVSA-N	438.532	1.836	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2cccc(F)n2)[C@@H]1c1cccnc1	1810769952	XUQRUZAGRCTMRN-IERDGZPVSA-N	442.495	1.308	50	20	IDGD	
N[C@@H](Cc1cscn1)C(=O)N1CCCC2(CCN(C(=O)[C@@H](F)Br)CC2)C1	1810799660	RNOKVHZNVJVNQA-UONOGXRCSA-N	447.374	1.935	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1)c1cc[n+]([O-])cc1	1811190466	KUKWLWXAUFJGOS-WMZOPIPTSA-N	433.306	1.820	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)c2cnnn2C)[C@H]1c1cccnc1	1812773214	AYHQJBBDJFMKJY-YCPHGPKFSA-N	435.326	1.703	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H](CNC(=O)CN2CCCCC2=O)[C@@H]1c1cccnc1	1812976335	YIBGRAPNZIBSKF-GCJKJVERSA-N	446.624	1.951	50	20	IDGD	
Cc1cc(C)n(CCC(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@H]2c2cccnc2)n1	1813303123	DYOVUANLYOTOQI-NSHGMRRFSA-N	433.940	1.591	50	20	IDGD	
CCC[C@H](NC(C)=O)C(=O)NC[C@@H]1CCN(C(=O)[C@H](Cl)COC)[C@H]1c1cccnc1	1814132142	SZUBTGAODXXZER-RDGPPVDQSA-N	438.956	1.646	50	20	IDGD	
C[C@]1(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)CC=CCC1	1815361746	QHVSWVGVLIZHEZ-ZHRRBRCNSA-N	439.346	1.795	50	20	IDGD	
C=CCSCC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1	1817470282	NYTVKIJTQKTQFM-KRWDZBQOSA-N	428.323	1.315	50	20	IDGD	
Cc1cc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@@H](O)CCl)CC3)ncc1[N+](=O)[O-]	1817618544	FVMVBRNYMPBJBZ-RNCFNFMXSA-N	439.881	1.580	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnc(O)[nH]3)sc2C1	1820669812	GOYRZXBHOJLOBY-SFYZADRCSA-N	428.312	1.971	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)CCl)CC2)c1ccc(-n2cccn2)nc1	1820732567	PVOURVITFSOLQI-OCCSQVGLSA-N	446.920	1.549	50	20	IDGD	
C[C@H](Br)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)n2)[nH]n1	1822187648	YLKVMANNRUUECI-GZMMTYOYSA-N	439.270	1.700	50	20	IDGD	
CC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)C1(N3CCN(C)CC3)CC1)CC2	1822849318	HVRGAZZUIWZQOD-KGLIPLIRSA-N	440.013	1.853	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H](O)N2CCOCC2)CC1	1824616940	RIXNBCMEDOOUQS-BBTUJRGHSA-N	429.989	1.664	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)Cc1ccn(C)n1)CC2	1825642484	QZYZCJVHVZMJAF-NXEZZACHSA-N	426.340	1.815	50	20	IDGD	
C[C@@H](C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2)c1ccccc1	1828230986	WWFFXCCJMPNEQF-RDTXWAMCSA-N	449.341	1.852	50	20	IDGD	
C=CCC(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)[C@H](O)CCl)C2)C1	1829350036	YISXMNLAAHDPRG-GCJKJVERSA-N	449.935	1.614	50	20	IDGD	
Cc1c(Cl)cccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1	1830130915	PBVZYWWHFFHWJR-APWZRJJASA-N	431.316	1.318	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccccc3F)C2)C1	1830542758	DBJVRJVOIMWVEA-KUHUBIRLSA-N	443.313	1.927	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)CN(CCO)CCO)CC1	1831483726	VEOVBMXBVUYNAF-RBUKOAKNSA-N	432.005	1.300	50	20	IDGD	
CC[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1)N(CC)CC	1831669350	GYUFUDCIDLUIMI-NQIIRXRSSA-N	443.661	1.415	50	20	IDGD	
O=C(CCc1ccccn1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1833188324	LEVBEMKPGGTFQT-AEFFLSMTSA-N	444.301	1.161	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3ccc(Cl)nc3F)CC2)CC1)[C@H](O)CCl	1833308183	KYKHEOGXEODRGD-OAHLLOKOSA-N	447.338	1.659	50	20	IDGD	
Cn1cc(C(=O)N2CCC(N3CCC(NC(=O)[C@@H](O)CCl)CC3)CC2)c2cccnc21	1833310540	RJLJCNQNZZQBMJ-IBGZPJMESA-N	447.967	1.358	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)C3=NN(C)C(=O)CC3)CC2)CC1	1833529534	CNUPBOBALKFHIE-QGZVFWFLSA-N	439.988	1.574	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC(N2CCC(NC(=O)c3cc(O)ncn3)CC2)CC1	1833554798	YMOVUJXQUSRMIP-UHFFFAOYSA-N	435.601	1.219	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnc(C)nc3)CCO2)C1	1833817059	IJDIZVGBKRDYKT-QAPCUYQASA-N	441.326	1.029	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)s1	1833959372	QUGATDUYCJXSTO-GUYCJALGSA-N	431.352	1.910	50	20	IDGD	
CCCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)C1	1834877384	NOUMFUAXFADHFW-MGPUTAFESA-N	447.960	1.375	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)COc3ccc(C)cc3)CCO2)C1	1835166273	FATJUOPMXKRIIN-RXVVDRJESA-N	440.924	1.084	50	20	IDGD	
O=C(Cc1ccsc1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1836102158	LNSLWMGRDGGTKO-GOEBONIOSA-N	435.315	1.438	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)CNC(=O)c3ccco3)CC2)CC1	1836396099	SFHMRHQIKJHCQI-QGZVFWFLSA-N	438.956	1.598	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnn4cccnc34)CCO2)C1	1836844406	KWWZYFHYUDZSEW-OXQOHEQNSA-N	435.912	1.207	50	20	IDGD	
Cc1ocnc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)CBr)C2)C1	1838199623	LUQQQQLQTZLNEM-PXAZEXFGSA-N	430.299	1.084	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccc(OC)c(F)c3)C2)C1	1839149223	YAYLPUPMRWDPKS-KKSFZXQISA-N	442.915	1.851	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C)C2)C1	1839964459	RVKQRHLSGZBUGG-QFBILLFUSA-N	440.338	1.634	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1	1840034092	AEQMCKGERRIDIX-GLQYFDAESA-N	446.169	1.463	50	20	IDGD	
COCc1c[nH]c(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)c1	1840034822	YAPLBVBGSUFXAZ-FZKQIMNGSA-N	444.326	1.015	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccccc3F)C2)C1	1840151673	KGUGOVCTMYRJCG-JXFKEZNVSA-N	428.888	1.078	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(Cl)c3)C2)C1	1840154132	MCGZQNGUGIWKPG-VQIMIIECSA-N	431.316	1.664	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(F)ccc3OC)CCO2)C1	1840689502	MGBKHKCLCVDVGE-UZLBHIALSA-N	428.888	1.922	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)Cn2ccc(C)n2)C1	1842081404	WXOVTEBRGWHXKU-UHFFFAOYSA-N	441.444	1.542	50	20	IDGD	
O=C(CC[C@@H]1CNc2ccccc2C1)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843011136	VFWCAKXMZLOGMR-SFHVURJKSA-N	447.344	1.248	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)c2cc(-c3ccccc3)no2)C1	1844479687	ZTAGFXAJJCYIPM-UHFFFAOYSA-N	425.489	1.532	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)c2c[nH]nc2C)C1	1844775062	VYDBWJGBTPKRAB-UHFFFAOYSA-N	427.417	1.682	50	20	IDGD	
CN(CC(=O)N1CCCC12CN(C(=O)C1=CCCS1)C2)NC(=O)NCc1ccccc1	1845038180	AWSCXRIBSQXSGY-UHFFFAOYSA-N	443.573	1.557	50	20	IDGD	
Cc1ccc(NCCC(=O)N2CC3(CCCN3C(=O)CCC(=O)NN(C)C)C2)c(C)c1	1846385104	SMZRGZFNQHIOJF-UHFFFAOYSA-N	429.565	1.682	50	20	IDGD	
Cc1cc2nnc(C(=O)N3CC[C@H]4[C@@H]3CCN4C(=O)[C@H](C)CBr)c(C)n2n1	1847501762	WTZNWBAEJDWCMB-SWHYSGLUSA-N	435.326	1.588	50	20	IDGD	
COc1cc(CCNC(=O)NNC(=O)COc2ccccc2F)c([N+](=O)[O-])cc1OC	9750718	FUUOHRLZYMNISF-UHFFFAOYSA-N	436.396	1.703	50	20	IDGD	
CCN(CC)Cc1ccc(CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1	9790493	CUYFTWHIVGIFOR-UHFFFAOYSA-N	446.577	1.966	50	20	IDGD	
COc1ccc(/C=C/C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1OC	10866837	SEBOZYBBXZHLRQ-VQHVLOKHSA-N	429.385	1.630	50	20	IDGD	
CC(=O)N/N=C1\NC(=O)[C@H](CC(=O)Nc2ccc(I)cc2)S1	15231922	HKALANZXNIKSTN-JTQLQIEISA-N	432.243	1.259	50	20	IDGD	
CC(C)NC(=O)Nc1ccccc1C(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	16467067	WORNKTSHMLQAKO-UHFFFAOYSA-N	443.416	1.743	50	20	IDGD	
CSc1nc2nc(C)c(CC(=O)OCC(=O)NNC(=O)c3cccs3)c(C)n2n1	19614588	PGIZTXRAFDLXBJ-UHFFFAOYSA-N	434.503	1.071	50	20	IDGD	
CC(C)(C(=O)NNC(=O)N1CCOCC1)S(=O)(=O)c1ccc(Br)cc1	726164128	ODTNSAHBIFMMEH-UHFFFAOYSA-N	434.312	1.074	50	20	IDGD	
COc1ccc(CN2C[C@H](C(=O)OCC(=O)NNC(=O)c3cccs3)CC2=O)cc1	726683487	UBHHNVWXXPOBMX-CQSZACIVSA-N	431.470	1.110	50	20	IDGD	
Cc1nc(N2CCOCC2)nc(O)c1CCC(=O)NNC(=O)CCCc1ccccc1	727716525	MPJLJHTVTSLYFN-UHFFFAOYSA-N	427.505	1.430	50	20	IDGD	
Cc1nn(C(C)(C)C)c(C)c1C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	728216109	QRSDFBGKEWHWMM-UHFFFAOYSA-N	448.593	1.948	50	20	IDGD	
Cc1nn(Cc2ccccc2Cl)c(Cl)c1C=NNC(=O)[C@H](C)NS(C)(=O)=O	728437200	NCYZUTIISLMRTL-NSHDSACASA-N	432.333	1.934	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)NCCNC(=O)c2cccnc2)c1	728744578	JJYOCOXMFCVLFF-UHFFFAOYSA-N	436.266	1.227	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)N[C@@H](C)[C@@H](C)N2CCOCC2)c2ccccc2c1=O	729624311	RTSHUNAVXJJYDM-JKSUJKDBSA-N	444.536	1.250	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)c1c(F)ccc(S(=O)(=O)NC2CC2)c1F	729837015	GLVPCBCNXSESRX-UHFFFAOYSA-N	449.439	1.436	50	20	IDGD	
CN(c1ccccc1)c1ccc(C=NNC(=O)CSc2nn(C)c(=O)n(C)c2=O)cc1	730570908	NEBMWUOLWAXPCY-UHFFFAOYSA-N	438.513	1.489	50	20	IDGD	
NC(=O)[C@@H]1CCCN(Cc2cccc(CNC(=O)NNC(=O)Cc3ccccc3F)c2)C1	731405761	MVMABQCRASDNSL-LJQANCHMSA-N	441.507	1.596	50	20	IDGD	
Cc1cc(COc2ccc(C=O)cc2)oc1C(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1	731616345	BQYAKJGUZWNQTH-AWEZNQCLSA-N	435.458	1.111	50	20	IDGD	
C[C@@H](NC(=O)CCC(=O)NNC(=O)c1ccccn1)C(=O)c1ccc(Br)cc1	732048616	AQAQAJQQENFZCW-GFCCVEGCSA-N	447.289	1.773	50	20	IDGD	
NC(=O)c1cc(C(=O)NNC(=O)c2cc(F)ccc2Br)nn1-c1ccccc1	732285751	GSOGNJLKHAOLDN-UHFFFAOYSA-N	446.236	1.948	50	20	IDGD	
O=C(NCCN/C(O)=C1/N=CC=CC1=O)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1	732466049	JXDJSLIXXFDPFB-YPKPFQOOSA-N	447.395	1.133	50	20	IDGD	
COc1cc(F)c([C@@H](C)NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1OC	734006691	FUKIUIKRTOIXCJ-LLVKDONJSA-N	429.412	1.524	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)[C@H]1CSCN1C(=O)OC(C)(C)C	734239688	WCEHTZZPXJMXBS-LLVKDONJSA-N	433.531	1.152	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(C(=O)NCC(=O)NNc2ncccc2Cl)cc1	734245678	DTTNLSLNFNPHAV-UHFFFAOYSA-N	439.925	1.639	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)NC3CCN(C[C@@H]4CCCO4)CC3)n[nH]2)cc1	734280256	JMHGWCLQILGZQP-SFHVURJKSA-N	426.521	1.973	50	20	IDGD	
CCOCCCN1CC[C@H](NC(=O)NNC(=O)Cc2nc3ccccc3n2C)[C@H](C)C1	734684399	NPNZGHMHDTWFNA-SJORKVTESA-N	430.553	1.583	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)N[C@H]2CCN(CCN3CCOCC3)C2)c1	734686776	UUEYDCKYVLOLPY-IBGZPJMESA-N	447.580	1.234	50	20	IDGD	
C[C@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	734822303	UMBIGWRDEJOLFJ-LBPRGKRZSA-N	429.518	1.630	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)[C@H]2CN(C(C)=O)c3ccccc3O2)cc1C	736744307	OLFVEVJISHZBMA-MRXNPFEDSA-N	445.497	1.737	50	20	IDGD	
N#CCCn1cc(/C=C(\C#N)C(=O)NC2CCN(CC(N)=O)CC2)c(-c2ccccc2)n1	737778521	NDEBSNCSVRRNRX-QGOAFFKASA-N	431.500	1.437	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)[C@@H]1CS[C@]2(c3ccc(F)cc3)CCC(=O)N12	740852378	XYLXHHSPAQMDLT-YWZLYKJASA-N	436.509	1.169	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)COc1ccccc1C#N)[C@@H]1CN(Cc2ccccc2)CCO1	741426173	QAUMINGSKNRUBG-UTKZUKDTSA-N	437.500	1.557	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=S)N[C@H]2CCOc3ccccc32)ccc1Cl	741478379	YQKVRSUBAYHHOF-ZDUSSCGKSA-N	440.934	1.620	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)CC[S@@](=O)c2ccc3c(c2)OCCO3)o1	742246855	FMCLSUQXDOPYPS-WJOKGBTCSA-N	449.529	1.852	50	20	IDGD	
COCCn1c(SCC(=O)NNC(=O)C(C)(C)C)nc2cc(Cl)ccc2c1=O	742444242	DWVATMPCVIZKGY-UHFFFAOYSA-N	426.926	1.982	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)NCCOc1ncc(C(F)(F)F)cc1Cl	743578242	WOCFDEIMMFEOIC-UHFFFAOYSA-N	449.773	1.486	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc2c(c1)nc(CCC(=O)NNC(=O)NC1CCCC1)n2C	744052938	ZXOMQDXJJJRPKS-UHFFFAOYSA-N	436.538	1.029	50	20	IDGD	
CN(C)[C@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)c1ccccc1	744314444	YZTLDXBCHZXSBR-IBGZPJMESA-N	430.530	1.535	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCCc2ccccc2[N+](=O)[O-])cc1	745880644	JCVKKJPTQWLWPS-UHFFFAOYSA-N	449.489	1.097	50	20	IDGD	
Cc1cc(N2CC[C@@H](NC(=O)NNC(=O)c3ccc(-n4c(C)ccc4C)cc3)C2=O)n(C)n1	745906414	OPKSGUZYZAPACW-LJQANCHMSA-N	449.515	1.886	50	20	IDGD	
Cn1cccc1CNC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	745925666	QSQFRUYCCKUFLP-UHFFFAOYSA-N	441.513	1.648	50	20	IDGD	
Cc1cc(C)nc(SCc2ccc(C(=O)NNC(=O)c3nc(O)nc(O)c3N)cc2)n1	746113036	KOPXIDSOYMMGFC-UHFFFAOYSA-N	441.473	1.244	50	20	IDGD	
Cc1nc2nc(C(F)(F)F)nn2c(C)c1CCC(=O)N([C@@H]1CCS(=O)(=O)C1)N(C)C	746202693	LVFVERUCPWQODL-GFCCVEGCSA-N	448.471	1.185	50	20	IDGD	
O=C(CC12CC3CC(CC(C3)C1)C2)NNC(=O)NCCNS(=O)(=O)c1cccnc1	746326979	YCZBBSGNYOUUSA-UHFFFAOYSA-N	435.550	1.297	50	20	IDGD	
N#Cc1ccc(NNC(=O)c2ccc(S(=O)(=O)N3CCOCC3)o2)cc1C(F)(F)F	746894174	JPLLWLTTXCWRMV-UHFFFAOYSA-N	444.391	1.948	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)CN1CCN(C(=O)OCc2ccccc2)CC1	747345516	OLDVBZSOKUUXKW-UHFFFAOYSA-N	444.463	1.306	50	20	IDGD	
C[C@H](CN(C)C(=O)OC(C)(C)C)C(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	747523398	IYOROEHUQTWGKV-GFCCVEGCSA-N	428.511	1.746	50	20	IDGD	
Cc1nc(Cl)cc(NNC(=O)c2ccc(S(=O)(=O)N3C[C@@H](C)O[C@H](C)C3)cc2)n1	747982923	GBQMMTVNKUEQLR-VXGBXAGGSA-N	439.925	1.993	50	20	IDGD	
O=C(CN1C(=O)[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)NNc1nc(-c2ccccn2)nc2c1CCC2	748338759	HOIGDDIYUZTMDN-MBZVMHRFSA-N	430.468	1.278	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NC[C@]2(N(C)C)CCSC2)c2ccccc2c1=O	748646406	FQKFSOXLZIFCQX-OAQYLSRUSA-N	446.577	1.578	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)NNC(=O)[C@@H]1CCCN1S(=O)(=O)c1cccs1	749162071	VWOPLGTUUAJNJB-INIZCTEOSA-N	432.527	1.773	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)c2cc(S(N)(=O)=O)cc(Cl)c2F)cc1	752288927	YVKCDTGMSJAMCC-UHFFFAOYSA-N	429.857	1.529	50	20	IDGD	
CS(=O)(=O)N1CCN(c2ccc(NC(=O)/C(C#N)=C\c3ccc(F)cc3)cn2)CC1	752302746	LJOUTFGCGQLNNU-VBKFSLOCSA-N	429.477	1.848	50	20	IDGD	
CC[C@H](NC(=O)NNC(=O)c1ccc(COc2ccccc2)o1)C(=O)N1CCOCC1	753057237	MAMCXILMXYGRHY-KRWDZBQOSA-N	430.461	1.440	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)c3cnn4c3C[C@@H](CNC(C)=O)CC4)n[nH]2)cc1	753258473	FXOGBCDBQHXPCA-INIZCTEOSA-N	449.515	1.609	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)[C@@H]2CCCCS2(=O)=O)c2ccccc2c1=O	753981737	RQVGKOOQGJTNLM-INIZCTEOSA-N	434.518	1.315	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)C(C)(C)CN(C)C	754374103	RKSDGVOOABHBDR-HNNXBMFYSA-N	439.582	1.391	50	20	IDGD	
Cc1cc(C)nc(-n2nc(C)cc2NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)n1	755515546	MPOXIXQBXOCSAR-UHFFFAOYSA-N	433.436	1.030	50	20	IDGD	
Cc1ccc(S(C)(=O)=O)cc1NC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	755534880	HBOHWFXYPSBBBA-UHFFFAOYSA-N	425.488	1.269	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)ccc1O)Nc1cccc(N2C(=O)CNC2=O)c1	755996857	ZDXQMJOVSAXMIF-UHFFFAOYSA-N	448.233	1.677	50	20	IDGD	
COc1ccc(C(=O)N(C)C)cc1NC(=O)NNC(=O)CCCNC(=O)OC(C)(C)C	756124248	UECNCTCOGARGFI-UHFFFAOYSA-N	437.497	1.855	50	20	IDGD	
CS(=O)(=O)CCOc1cccc(NC(=O)NNC(=O)COc2ccc(F)cc2)c1	756297594	MIJIXFYFMVHASU-UHFFFAOYSA-N	425.438	1.481	50	20	IDGD	
C#CCOc1ccc(NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1	756478049	BWVCZIUWNCUJOE-UHFFFAOYSA-N	430.486	1.480	50	20	IDGD	
C[C@H]1C[C@H](C)CC2(C1)NC(=O)N(CC(=O)NNC(=O)Cc1c[nH]c3ccccc13)C2=O	756868765	XVDYJVMJOGLGRO-KBPBESRZSA-N	425.489	1.605	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1ccn(-c2ccc(Cl)cc2Cl)n1	757890481	HAXKPORMFUDRCQ-MRVPVSSYSA-N	435.293	1.270	50	20	IDGD	
CCOC(=O)c1cnn2c(C(=O)NNC(=O)[C@H](C)Oc3ccc(OCC)cc3)ccnc12	757987325	CETCITNWAKEXEO-ZDUSSCGKSA-N	441.444	1.533	50	20	IDGD	
O=C(NCC1(c2ccc3c(c2)OCCO3)CCCC1)NNC(=O)C(=O)Nc1ccccn1	758691525	VEABPAMAOVWMAH-UHFFFAOYSA-N	439.472	1.634	50	20	IDGD	
O=C(NNC(=O)C(=O)Nc1ccccn1)N[C@@H]1CCCN(Cc2c(F)cccc2F)C1	758753251	GAKITQXRPKLAAV-CYBMUJFWSA-N	432.431	1.293	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NC[C@]1(Cc2ccc(F)cc2)CCC[C@@H]1O	759691226	BAODJMQRCQUVNO-LAUBAEHRSA-N	448.520	1.721	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)N2CC[C@@H](n3cc(C(=O)OC)nn3)C2)c1C	760675990	IXIDQYUUNVPBMQ-WAFWZSCLSA-N	426.477	1.510	50	20	IDGD	
CC(C)OCCCn1c(NNC(=O)c2ccc3nnc(O)n3c2)nc2ccccc2c1=O	762983248	RCBYZDBAXZNIAW-UHFFFAOYSA-N	437.460	1.717	50	20	IDGD	
Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)C(=O)NNC(=O)c1ccncc1	763461791	DTVAERSCUUOFJU-LJQANCHMSA-N	447.499	1.433	50	20	IDGD	
CCN(CC)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C)c(C)c2)cc1	763667246	SSYQDEBQICDNKC-UHFFFAOYSA-N	440.500	1.950	50	20	IDGD	
CCOC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2cc(OC)cc(OC)c2)cc1	763771513	BPGLOCBZLXJQIJ-UHFFFAOYSA-N	430.417	1.672	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2ccccc2N2CCCC2)c2ccccc2c1=O	763785141	GVKYCMJQZQWAEF-UHFFFAOYSA-N	448.483	1.416	50	20	IDGD	
Cc1ccc(-n2nc(NC(=O)C(=O)NNC(=O)COc3ccccc3C#N)cc2C)cc1	763814084	OOXIBGHHBCWXIK-UHFFFAOYSA-N	432.440	1.526	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cc(OC)c(OC)cc2C)cc1	763861233	NBFYPZAAPLBKLN-CQSZACIVSA-N	445.472	1.964	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccc(OCCc3ccccc3)nc2)n1	763881891	RDZMWEOGQQADCS-UHFFFAOYSA-N	436.472	1.303	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccc(F)cc2)cc1Cl	763921719	VFFORYNVRBWWLS-UHFFFAOYSA-N	437.811	1.360	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3ncn(Cc4ccccc4)n3)cc2C1	763942495	NELVYKNTSQXOQG-CYBMUJFWSA-N	438.513	1.912	50	20	IDGD	
NS(=O)(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCCCC3)c1	763967347	ANXSYDZPEVESDN-UHFFFAOYSA-N	436.515	1.064	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)c(OC[C@@H]2CCCO2)c1	764163798	MLJPMUSXCBUHKQ-OXJNMPFZSA-N	439.468	1.642	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)c(OC[C@H]2CCCO2)c1	764163800	MLJPMUSXCBUHKQ-OXQOHEQNSA-N	439.468	1.642	50	20	IDGD	
COc1ccc(C(=O)N2CCCCCC2)cc1NC(=O)C(=O)NNC(=O)c1ccoc1	764164568	UKQKEXQQYHBDLM-UHFFFAOYSA-N	428.445	1.704	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)c(F)cc1F	764239469	MVZXVFGTCLLBRJ-UHFFFAOYSA-N	430.367	1.492	50	20	IDGD	
Cc1cc(N2CCOCC2)ccc1NC(=O)C(=O)NNC(=O)Cn1ccc2ccccc21	764243681	VVXWBEVPOYPPBB-UHFFFAOYSA-N	435.484	1.572	50	20	IDGD	
Cc1ncsc1C(=O)NNC(=O)C(=O)Nc1ccc(OCCN2CCCCC2)cc1	764246879	SAJMUBFJWOCILU-UHFFFAOYSA-N	431.518	1.716	50	20	IDGD	
Cc1ccc(C(=O)N2CCSCC2)cc1NC(=O)C(=O)NNC(=O)c1scnc1C	764248036	YHASUHPVIUIAQO-UHFFFAOYSA-N	447.542	1.349	50	20	IDGD	
O=C(Cc1ccccn1)NNC(=O)C(=O)Nc1cccc(CSC2CCOCC2)c1	764263221	BPKDEQKDBHOTEU-UHFFFAOYSA-N	428.514	1.822	50	20	IDGD	
CCOCC(=O)NNC(=O)C(=O)Nc1cc(OC)c(NC(=O)c2ccccc2)cc1OC	764318438	XQYOYMVBBCTFHJ-UHFFFAOYSA-N	444.444	1.079	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)c(Cl)c1)C(=O)Nc1ccc(CN2CCOC2=O)cc1	764349072	GLTHOVWIGSJBFP-UHFFFAOYSA-N	432.820	1.398	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)n(Cc2ccccc2)n1	764350812	LYBOJBRJWFLDAC-UHFFFAOYSA-N	443.467	1.825	50	20	IDGD	
Cc1ccc(CN(C)C)cc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	764388397	RQDLQAXKIHRCKQ-UHFFFAOYSA-N	438.463	1.986	50	20	IDGD	
COc1nccnc1NNC(=O)c1nnn(C2CCN(C(=O)OC(C)(C)C)CC2)c1C	764466296	ZFOXATXWKGFQTF-UHFFFAOYSA-N	432.485	1.714	50	20	IDGD	
C[C@@H](CC(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1)C1CCN(C(=O)OC(C)(C)C)CC1	764617404	UJJIVTPWCBZQOW-DZGCQCFKSA-N	431.555	1.242	50	20	IDGD	
CCn1cnc2c1c(=O)n(CC(=O)NN=Cc1ccc(C)nc1)c(=O)n2Cc1ccccc1	764896956	SLIQEXRTTKEAPD-UHFFFAOYSA-N	445.483	1.282	50	20	IDGD	
CN1CCCN(S(=O)(=O)c2cccc(NC(=O)NNC(=O)OC(C)(C)C)c2)CC1	765177301	CRAKKJFIKQABAB-UHFFFAOYSA-N	427.527	1.574	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)Nc3ccc(F)cc3)CC2)cc1	765312484	GEDRLBQVBSULJZ-UHFFFAOYSA-N	449.508	1.293	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)CN1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1	766879318	XYEZHJQCVAFVPQ-LJQANCHMSA-N	427.480	1.720	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)c2ccc3c(c2)nc(O)n3CC(F)(F)F)C[C@@H](C)O1	767822743	OCCPFNIRRIXXRA-VXGBXAGGSA-N	443.426	1.565	50	20	IDGD	
CCNC(=O)N(C)NC(=O)[C@@H]1CCCN1C(=O)NCc1cccc(Br)c1	768409623	IVRZZSPWGMXNDD-AWEZNQCLSA-N	426.315	1.816	50	20	IDGD	
N#C/C(=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)O[C@@H]1CCNC1=O	769952078	VCVBFPAHWSBIQN-RCBBPTIPSA-N	427.848	1.418	50	20	IDGD	
CCN1CCN(c2cccc(NC(=O)C(=O)NNC(=O)Cc3ccccc3F)c2)CC1	770771733	NWWYJHRVBUICKX-UHFFFAOYSA-N	427.480	1.296	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)CCOc3ccc(S(C)(=O)=O)cc3)nc21	770965311	AFWJSJOWGJRTKV-UHFFFAOYSA-N	448.505	1.603	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc(C(=O)O)c(F)cc1Br)c1ccccc1O	771148338	KCLYFWOWTKBVIS-UHFFFAOYSA-N	433.211	1.615	50	20	IDGD	
C[C@@]1(c2ccc(Br)cc2)NC(=O)N(CC(=O)NNC(=O)c2cccnc2)C1=O	771217827	SHCUEMWJXQRFNQ-SFHVURJKSA-N	446.261	1.072	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1	772892656	RKPJZOXUUAEVGM-UHFFFAOYSA-N	442.819	1.511	50	20	IDGD	
COc1cccc(Cn2nccc2NC(=O)C(=O)NNc2nc(C)cc(C)n2)c1OC	773478368	FNHPJTUCDIJAMS-UHFFFAOYSA-N	425.449	1.437	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2ccccc2-n2cc(Br)cn2)n1	773724640	XGSDDKNUOSYGQJ-UHFFFAOYSA-N	432.238	1.515	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2cc(F)c(I)c(F)c2)n1	773731859	WZUNUMWWDWDMKP-UHFFFAOYSA-N	449.155	1.450	50	20	IDGD	
COc1ccc(-n2cnnc2SCC(=O)NNc2cccc(S(C)(=O)=O)c2)cc1	776714534	HGLBDWGMKVXEEE-UHFFFAOYSA-N	433.515	1.915	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CCOC2CN(C(=O)OC(C)(C)C)C2)cc1C	776967803	GGLQQIWGIGQPRT-UHFFFAOYSA-N	434.493	1.415	50	20	IDGD	
CC(=O)c1ccc(C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)c(F)c1	777524148	SHNAZGRPCYORKP-UHFFFAOYSA-N	435.481	1.116	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)[C@@]23CCC(=O)N2c2ccccc2C(=O)N3C2CC2)c1	777838956	IHDLEEHEIGLTIP-XMMPIXPASA-N	447.495	1.655	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNS(=O)(=O)c2ccc3c(c2)OCO3)CC1	777933838	WTJXBOVRCDNJPU-UHFFFAOYSA-N	442.494	1.307	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cc(C)nc(C(F)(F)F)n2)cc1OC	778387999	LEYJJGHBONYTTL-UHFFFAOYSA-N	442.350	1.439	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)c1ccc(S(=O)(=O)C2CCCC2)cc1	778437925	NOMWSRQYTCBMPQ-UHFFFAOYSA-N	425.507	1.689	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@@H](C(=O)NNC(=O)CCCc2ccccc2)[C@@H](C)O)cc1	779515020	RRSXVLHZIZPLTD-OXQOHEQNSA-N	433.530	1.193	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc(C(=O)O)c(F)c(Cl)c1F)c1cccc([N+](=O)[O-])c1	779824835	GTUGWFVHSLBKJK-UHFFFAOYSA-N	435.748	1.848	50	20	IDGD	
N#CCCn1cc(/C=C(/C#N)C(=O)NS(=O)(=O)C[C@@H]2CCCO2)c(-c2ccccc2)n1	781512988	WYUUEMFGPUMWJI-GTVARFKMSA-N	439.497	1.996	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)n(Cc2ccccc2)n1	782893462	IXAMWLJBPMVKKB-UHFFFAOYSA-N	445.483	1.455	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)C(=O)Nc1cccc2ccsc12	782897382	OGXMGFBQBCEHIT-UHFFFAOYSA-N	431.499	1.594	50	20	IDGD	
Cc1cc(N(C)C)cc(C)c1NC(=O)C(=O)NNC(=O)c1csc(N2CCOCC2)n1	782898352	ZQVLVRBKEAXIBH-UHFFFAOYSA-N	446.533	1.062	50	20	IDGD	
Cc1ccc(C)c(NNC(=O)C(=O)Nc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1	783366874	UQSLKQKRCATYTC-UHFFFAOYSA-N	432.502	1.406	50	20	IDGD	
Cc1ccnc(-c2cccc(NC(=O)C(=O)NNC(=O)CNC(=O)c3cccs3)c2)n1	784003557	IJSVZVVUEFDDLV-UHFFFAOYSA-N	438.469	1.029	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1ccccc1C#Cc1ccccc1	784003944	ALDCCCLPZLVUEL-UHFFFAOYSA-N	446.488	1.664	50	20	IDGD	
CC(=O)Nc1cccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)c1C	784213887	QQLRZGPAOYCZLI-UHFFFAOYSA-N	445.501	1.476	50	20	IDGD	
Cc1cc(Br)ccc1NNC(=O)C(=O)Nc1cc(F)cc(S(N)(=O)=O)c1	784415363	VZRHEUJNMVIEBJ-UHFFFAOYSA-N	445.270	1.626	50	20	IDGD	
CCc1cc(NNC(=O)[C@@H]2CC=CC[C@@H]2C(=O)N2CCOCC2)nc(-c2ccccn2)n1	784782620	ZLUHIXDSQUEINF-MSOLQXFVSA-N	436.516	1.985	50	20	IDGD	
CC(C)Oc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)C(=O)NNc1ccc(F)cc1	784786408	RVDCORZKWCTCKK-UHFFFAOYSA-N	438.481	1.945	50	20	IDGD	
O=C(NNc1ccccc1C(F)(F)F)C(=O)Nc1cnn(CCN2CCOCC2)c1	784831898	ZNHWNUMAOPYFAK-UHFFFAOYSA-N	426.399	1.316	50	20	IDGD	
CCOc1cc2c(cc1NC(=O)C(=O)NNc1cccc(S(C)(=O)=O)c1)O[C@H](C)C2	784843551	ANQZSNXQQULWSB-GFCCVEGCSA-N	433.486	1.894	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)Nc1cc(F)ccc1N1CCCCC1	785022898	AJOYUKVHVAMCGA-UHFFFAOYSA-N	445.407	1.830	50	20	IDGD	
COCCOc1cc(C)ccc1NC(=O)C(=O)NNC(=O)c1cc([N+](=O)[O-])ccc1O	785023327	FUAHALHTNZXASE-UHFFFAOYSA-N	432.389	1.034	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)Nc1ccccc1N1CCCCC1	785023452	IZKIYUXBXBKMRE-UHFFFAOYSA-N	427.417	1.690	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)cccc1N1CCNC1=O	787541325	OYYKOKHGXWARSF-UHFFFAOYSA-N	447.455	1.314	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)Nc2cc(C(C)(C)C)nn2-c2ncccn2)c1	789266890	BPCQRQFMGYDMQA-UHFFFAOYSA-N	437.464	1.780	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)Nc1nc([C@H]2C[C@H]3CC[C@H]2C3)cs1	789731685	IHCHXPDWVORTTL-MRHIQRDNSA-N	442.497	1.973	50	20	IDGD	
CCNC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)c1C	789740394	WBTXWVQYPDSGEX-UHFFFAOYSA-N	449.414	1.894	50	20	IDGD	
Cc1nc(S)sc1CC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	790767863	MCGLKHDRKQDUIY-UHFFFAOYSA-N	440.572	1.528	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)N1CCNC(=O)[C@H]1c1ccc(OC(F)(F)F)cc1	792361201	XGJIFGQNQHICHE-MLGOLLRUSA-N	430.427	1.640	50	20	IDGD	
COc1c(NC(=O)C(=O)NNC(=O)CCc2ccco2)cc(Cl)cc1C(=O)N(C)C	793026890	UWRFKYWNLCRROI-UHFFFAOYSA-N	436.852	1.362	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)c2cc(I)ccc2-n2cnnn2)n1	794072132	KXRUNDWKKWYGLK-UHFFFAOYSA-N	449.212	1.045	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)[C@@H]2N(C(=O)OC(C)(C)C)CC2(C)C)n1	796220844	LBPUCMQJEFVEFU-HNNXBMFYSA-N	440.522	1.330	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)CCc2ccccc2O)c(OC)c(C)c1OC	797006924	LMTUSLGKZGIIHH-UHFFFAOYSA-N	431.445	1.445	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NC(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)nc1	797653780	LXZKOEDOEILQNT-UHFFFAOYSA-N	447.452	1.328	50	20	IDGD	
O=C(NNC(=O)c1cn(-c2ccc(Cl)c(Cl)c2)cn1)N[C@@H]1CCS(=O)(=O)C1	797711851	PXDXDXVKBXJMLL-SECBINFHSA-N	432.289	1.310	50	20	IDGD	
COc1cccc(/C=C(\C(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)n2nnnc2C)c1	798310511	ZRQSZNCCFGKTFR-XDHOZWIPSA-N	449.471	1.391	50	20	IDGD	
COc1ccc(-c2nn(CCC#N)cc2/C=C(\C#N)C(=O)NC[C@@](C)(O)CO)cc1OC	801976149	PCDQTUSZWVPVIH-KYIYGJGQSA-N	439.472	1.247	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@@H](C(=O)NNC(=O)Nc2cc(F)cc(F)c2)[C@H](C)O)cc1	802004317	MQUZXJRXQLZGPF-MEDUHNTESA-N	442.444	1.154	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)N=c2cc[nH]cc2)cc1S(=O)(=O)NCc1ccccc1	802026099	STLLJZZREHSTPO-UHFFFAOYSA-N	439.497	1.757	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)c2cnc3c(c2)c(O)nc(=O)n3C)c(OC)cc1Cl	802082164	NSSYFUSXODXBCD-UHFFFAOYSA-N	448.823	1.171	50	20	IDGD	
COc1ccc(C)cc1N1C[C@H](C(=O)NNC(=O)Nc2ccc3c(c2)OCO3)CC1=O	802104668	HYVUMBJZHKIYRH-CYBMUJFWSA-N	426.429	1.938	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)Nc2ccccc2)(S(C)(=O)=O)CC1	803393820	YGIUKLFCWYGXKE-UHFFFAOYSA-N	440.522	1.654	50	20	IDGD	
COc1ccccc1-n1c(C)nnc1SCC(=O)NNc1ccc(-n2ccnc2)nn1	804953556	VAPPQMRZGDWCIV-UHFFFAOYSA-N	437.489	1.795	50	20	IDGD	
CN(C(=O)OC(C)(C)C)[C@H](C(=O)NNc1ccc(-n2ccnc2)nn1)c1cnn(C)c1	804954109	KTEGEPXOCGXHLD-INIZCTEOSA-N	427.469	1.447	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(NC(=O)NNc2cccc(S(C)(=O)=O)c2)ccc1F	806543015	GNLFXOJPUXMNOD-UHFFFAOYSA-N	430.483	1.628	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)Nc1ccc(F)c(S(=O)(=O)N(C)C)c1	806543728	FUQFMYPKNCQCHH-UHFFFAOYSA-N	434.453	1.499	50	20	IDGD	
Cn1ncc(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)c1-c1ccccc1	806976786	MENDEFGGWIKBSJ-UHFFFAOYSA-N	431.250	1.577	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCCc1ccc2c(c1)OCCO2	806991560	KEWVQBJGXCVLLJ-UHFFFAOYSA-N	447.517	1.246	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1cc(Br)c[nH]1)c1cccc(S(N)(=O)=O)c1	807150600	QHJSWODKYQDEFE-QMMMGPOBSA-N	430.284	1.130	50	20	IDGD	
CC[C@H](C)N[C@@H](CNC(=O)NNC(=O)c1csc(N2CCOCC2)n1)c1ccco1	807442297	YEMRSDPQAXTUPQ-KBPBESRZSA-N	436.538	1.646	50	20	IDGD	
Cc1cc([N+](=O)[O-])ccc1NNC(=O)C(=O)Nc1cccc(C(=O)N2CCOCC2)c1C	807456909	KGTAADHFQBPFAB-UHFFFAOYSA-N	441.444	1.766	50	20	IDGD	
CC(C)Oc1ccc([C@H](CNC(=O)NNC(=O)CNC(=O)c2cccs2)N(C)C)cc1	807591941	JTHAMKCVUPQSTF-KRWDZBQOSA-N	447.561	1.898	50	20	IDGD	
CN(C)CCCOc1cnccc1CNC(=O)NNC(=O)c1cnn(-c2ccccc2)c1	808269230	BJYLRYBZQLIHHJ-UHFFFAOYSA-N	437.504	1.742	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)[C@@H]2C[C@H](c3ccccc3)OC2=O)cc1OC	808585637	IEXGACLLEMQFOL-DOTOQJQBSA-N	442.424	1.312	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)CNc2ccccc2C(N)=O)cc1	809578047	HNRUPXVVLACFGR-UHFFFAOYSA-N	439.501	1.079	50	20	IDGD	
CNC(=O)c1cc(Oc2ccc(NC(=O)C(=O)NNC(=O)CCC(C)C)cc2F)ccn1	810386936	XWBGVWQAKGWLPL-UHFFFAOYSA-N	445.451	1.895	50	20	IDGD	
Cc1cc(C)c(C)c(S(=O)(=O)NCC(=O)NNc2cccc(S(C)(=O)=O)c2)c1C	810914608	GYBZGQMWMOGNCC-UHFFFAOYSA-N	439.559	1.745	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)NCc2ccc(OC)c(S(N)(=O)=O)c2)c1C	811542620	AZAZGXQDNJPENG-WOJGMQOQSA-N	446.529	1.631	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)C1(c2cccnc2)CCCC1	813488420	VJVGDOBRJOLAEK-UHFFFAOYSA-N	435.528	1.499	50	20	IDGD	
CS(=O)(=O)CC1CCC(=NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)CC1	814741496	DJZHKCYTMZMYSK-UHFFFAOYSA-N	441.575	1.792	50	20	IDGD	
CNC(=O)Oc1cccc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CC[C@H](C)C3)c1	815567060	NMTYVAJLOXHTEA-NSHDSACASA-N	430.486	1.991	50	20	IDGD	
CCNC(=O)N(C)NC(=O)C(=O)Nc1nnn(Cc2ccc(C(F)(F)F)cc2)c1C	815603796	SFXXPBJQBZYCIF-UHFFFAOYSA-N	427.387	1.285	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)CNC(=O)c2ccc(Br)o2)c1	825796913	OEBXDNHPLZVGKJ-UHFFFAOYSA-N	425.239	1.040	50	20	IDGD	
CN1C(=O)c2ccc(C(=O)NNC(=O)COc3ccc(Br)cc3)cc2C1=O	871022698	IARVLSDWAJZHST-UHFFFAOYSA-N	432.230	1.515	50	20	IDGD	
Cc1ccc(NC(=O)CS[C@H](C)C(=O)NNC(=O)CCN2C[C@@H](C)O[C@H](C)C2)cc1	912920148	WCVMZUDXSMTXMS-BRWVUGGUSA-N	436.578	1.702	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCCN(C)c2ccccc2)cc1	916225906	IAXPYGMUNRKZGD-UHFFFAOYSA-N	433.534	1.082	50	20	IDGD	
C[C@H](CCc1ccc(O)cc1)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	916235233	FIUCACCXQQVOSC-CQSZACIVSA-N	434.518	1.608	50	20	IDGD	
CCN(CC)Cc1cccc(CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)c1	916400679	HTIAFSOGPINEKW-UHFFFAOYSA-N	446.577	1.966	50	20	IDGD	
C[C@H]1C[C@@H](C)CN(CCCNC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)C1	916461202	YEROPTIMIQQRGJ-OYRHEFFESA-N	444.624	1.897	50	20	IDGD	
C[C@@H](Cn1ccnc1)NC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	916623324	NUOVMLIOSSYIPC-ZDUSSCGKSA-N	448.530	1.778	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)NC[C@@]1(N2CCOCC2)CCSC1	916636819	MFLXJOIWBQVZMW-LIRRHRJNSA-N	426.514	1.131	50	20	IDGD	
COc1ccc(S[C@@H](C)C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1	917328247	OGBDBNDSCXMSST-SCLBCKFNSA-N	446.481	1.706	50	20	IDGD	
O=C(CCN1CCOCC1)Nc1cccc(CNC(=O)NNC(=O)c2ccccc2O)c1	918092313	UIUQQJNRJQJVDP-UHFFFAOYSA-N	441.488	1.197	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)NC[C@H](c1ccc(C)cc1)N1CCOCC1	918098560	CJSFAMCIONWWNZ-LJQANCHMSA-N	442.516	1.786	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1	918217674	JUIYUJOZRGUOJF-UHFFFAOYSA-N	432.452	1.580	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)[C@@H](C)Sc2nnnn2C2CC2)c2ccccc2c1=O	918413014	LBIHMDWVHSMGRS-LLVKDONJSA-N	442.505	1.070	50	20	IDGD	
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1ccco1)NNC(=O)c1cccc(Cl)c1	919639930	UFQJFMICSAXNIY-OAHLLOKOSA-N	433.848	1.932	50	20	IDGD	
CC(C)[C@@H](C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)n1nnc(-c2ccccc2)n1	919714536	QCIQVPDWLWUXSS-KRWDZBQOSA-N	442.501	1.402	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CCCNC(=O)c2ccc(F)cc2)cc(OC)c1OC	919806153	ODUSPWDFLKKTDG-UHFFFAOYSA-N	433.436	1.823	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)CNC(=O)c2c[nH]c3ccccc3c2=O)o1	920272313	LVYYQYYSUMHRKL-UHFFFAOYSA-N	439.472	1.154	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)/C(=C\c2ccc(F)cc2)n2nnnc2C)cc1OC	920425661	ONXOWBBKUFMIFS-GZTJUZNOSA-N	440.435	1.987	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)c2cccn(Cc3ccccc3)c2=O)c1	920447357	VFNGIDDOHRXCJQ-UHFFFAOYSA-N	425.466	1.375	50	20	IDGD	
O=C(NNC(=O)c1cncn1-c1ccccc1)c1cccc([N+](=O)[O-])c1N1CCOCC1	1319849774	IGPFJLNIMYQRPQ-UHFFFAOYSA-N	436.428	1.692	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc(F)c(F)c1)NNc1cncc(Br)c1	1320246057	JNIGWEZVLMHWBU-UHFFFAOYSA-N	435.250	1.934	50	20	IDGD	
CC(=O)N1Cc2ccc(NC(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)cc2C1	1321038008	RLCBYTNFOUQKEQ-UHFFFAOYSA-N	445.501	1.266	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc3c[nH]nc3c2)C1	1777884625	VKYNGMGONZGAKU-YRISNDGFSA-N	434.924	1.944	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)[C@H]2SC(=N)NC2=O)C1	1778085126	RHGNYYYDRWTAJM-GSMIOKPBSA-N	444.985	1.320	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc4ncccn4n3)C2)C1	1778464926	BYNMHMRIMMHXMK-ZWKOTPCHSA-N	426.304	1.409	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(Cl)s3)CCO2)C1	1779028294	IRDODUDOQMBSNQ-IBGZPJMESA-N	449.920	1.157	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](C)n3ccccc3=O)C2)C1	1779272518	WNLKVBYVZYPVEC-DOXZYTNZSA-N	440.338	1.413	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cnc(C(F)(F)F)cn1)CCO2	1779296386	QIMBPIBQBSJYNS-QGZVFWFLSA-N	446.502	1.790	50	20	IDGD	
C[C@H](Nc1cnccn1)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@](C)(Cl)CCl)C2)C1	1781229709	IKNSFGNVRAUHHY-DOPJRALCSA-N	430.336	1.343	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc3c[nH]nc13)C2	1782172536	GCOLRIIQPYMPES-CSODHUTKSA-N	434.924	1.944	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(NC(C)=O)o1)C2	1782175361	JCAWCBSVTRENLJ-AKCHCHLHSA-N	441.912	1.619	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3nsnc3NC)CCO2)C1	1783339264	QRKXVSKTRUSQAT-BMIGLBTASA-N	432.344	1.197	50	20	IDGD	
Cc1nc[nH]c1CSCC(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](C)Br)C2)C1	1783533580	AMHCDJYUHCNSLN-SJKOYZFVSA-N	445.383	1.565	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3nn[nH]c3C(F)(F)F)CCO2)C1	1783537097	LLRLNQRASQCTNY-ISVAXAHUSA-N	440.220	1.050	50	20	IDGD	
COc1ccnc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](C)Br)C3)C2)c1OC	1783537473	NUGRIWYGDXQKTQ-KZULUSFZSA-N	442.310	1.326	50	20	IDGD	
Cc1cc(C)n(CCC(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](C)Br)C3)C2)n1	1783539930	PBTWTBFDZZWKSJ-CRAIPNDOSA-N	427.343	1.503	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CC[C@]2(CN(C(=O)[C@@H](F)Br)CCO2)C1	1783854199	JTTMXBGMYIYKRD-HNSFDTNUSA-N	447.301	1.262	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccnc(Br)c3)CCO2)C1	1783878012	UNXXTNMPAIFVGQ-GUYCJALGSA-N	446.729	1.541	50	20	IDGD	
O=C(c1nc2cc([N+](=O)[O-])ccc2[nH]1)N1CCO[C@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783950022	RZVZKWJYNAAANB-KRWDZBQOSA-N	442.259	1.718	50	20	IDGD	
COc1cccc(Cl)c1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]2C1	1784095410	GCMCHYGLSASBJB-DUPGQFARSA-N	431.316	1.542	50	20	IDGD	
CCO/C=C/C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2	1784223306	ASZFFMSQEJGGAA-PGVPZQPASA-N	445.944	1.499	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc4c(c3)CCNCC4)C[C@@H]21	1789865344	RLBRZIAKKWEHAC-CAIZAGQASA-N	434.968	1.381	50	20	IDGD	
CC[S@@](=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]2C1	1789867732	DWDACLMNMINJNL-YNNFZIPTSA-N	427.394	1.361	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]3C2)c(C)n1	1789924670	SFPMEWSYMIEWHS-QCEMKRCNSA-N	428.302	1.982	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)Cn3cncn3)C[C@@H]21	1790960886	SVLCNWBIYPZTAZ-CWVYHPPDSA-N	442.358	1.067	50	20	IDGD	
COc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)CBr)cn1	1792868651	JCAWNRWTTUXFIW-ZIEJDFEHSA-N	426.311	1.324	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cnc2ccccn12	1792934888	WGNPLESCZZFGJL-VLBMKZOESA-N	439.343	1.703	50	20	IDGD	
O=C(Cc1noc2ccccc12)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2	1795765751	MPIBUBCCMXJLSV-YNHQPCIGSA-N	440.269	1.650	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)c1cc(F)cc(Cl)c1	1796190630	SFVPSCLDEOMPFM-REPLKXPHSA-N	430.672	1.725	50	20	IDGD	
COCc1c[nH]c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)CBr)C3)c1	1798507529	XAZKIIISXMNAPB-OEYIWLLWSA-N	428.327	1.395	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCCCn1cccc1	1798560835	XZACBWUMHNKIDP-BCDXTJNWSA-N	438.532	1.609	50	20	IDGD	
Cc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)CBr)C3)n(C(F)F)n1	1798678238	VDZQFTUVROBIMG-ZKCLLBTKSA-N	449.296	1.821	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc([N+](=O)[O-])[nH]1	1798743456	BMRWTFKEYLFNHP-DYNIEEOBSA-N	429.271	1.157	50	20	IDGD	
CCc1ncsc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnccc1C(=O)NN)C2	1799495794	AAGNVQZOCILBGD-CLLJXQQHSA-N	428.518	1.270	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2)c1cccc(N2CCOCC2)c1	1799612309	VQCLWQFSJWYLLX-SCAQPMJSSA-N	442.343	1.530	50	20	IDGD	
Cc1ccn2c(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@H](F)Br)C4)cnc2c1	1800084714	SEKAJHDTFIRPON-VZAMPYOESA-N	439.285	1.536	50	20	IDGD	
N#Cc1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)c(Cl)c1	1800688341	GIYUVLOINXRCLS-BCDXTJNWSA-N	437.692	1.457	50	20	IDGD	
Cc1cc(C)n(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Br)C3)n1	1801247641	RYBQUKRLLMKFRH-OCVGTWLNSA-N	431.306	1.170	50	20	IDGD	
COc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Br)C3)ccc1F	1801711062	GNIWHPUTEUEYBD-BAESOJJISA-N	433.249	1.728	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc(O)c([N+](=O)[O-])c2)[C@H]1c1cccnc1)[C@@H](O)CCl	1803141191	MKYVAYHQBCAUSB-WBAXXEDZSA-N	448.863	1.615	50	20	IDGD	
Cc1cccn2ncc(C(=O)N3CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]3c3cccnc3)c12	1803147349	HCUWTZCJGQCFBO-POAQFYNOSA-N	441.919	1.957	50	20	IDGD	
CC(=O)NC(C)(C)C(=O)NC[C@@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1	1803589828	VPXMETHZUYHLQA-DOTOQJQBSA-N	439.354	1.787	50	20	IDGD	
C=CC[C@H](C(=C)C)C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1807376243	TVBPIYAMXLBKJN-YMPZKCBVSA-N	447.344	1.849	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)c1noc2c1CCCC2	1808021597	PTVNZNOVQYUGRX-QOKNQOGYSA-N	432.908	1.868	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2nccnc2C(N)=O)[C@@H]1c1cccnc1	1808263765	POUFPSWDWGGQLX-JKIFEVAISA-N	430.896	1.308	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@@H](CNC(=O)c2cnc(O)nc2O)[C@H]1c1cccnc1	1808276125	RLMFBWRSBBLSPR-DZGCQCFKSA-N	433.896	1.867	50	20	IDGD	
Cn1ncnc1C(=O)N1CC[C@H](CNC(=O)[C@@](C)(Cl)CCl)[C@@H]1c1cccnc1	1808292638	ZUEGHQSYVXEHMR-GLJUWKHASA-N	425.320	1.766	50	20	IDGD	
O=C(NCCC(=O)N1CC[C@H](CNC(=O)[C@@H](F)Cl)[C@@H]1c1cccnc1)c1ccc[nH]1	1808308505	KPHUXTAVDJGYMI-FHLIZLRMSA-N	435.887	1.770	50	20	IDGD	
CN1N=C(C(=O)N2CCC3(CCCN(C(=O)CCBr)C3)CC2)CCC1=O	1809066437	MKGRNSHDVRZWFF-UHFFFAOYSA-N	427.343	1.611	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2n[nH]cc2[N+](=O)[O-])[C@H]1c1cccnc1	1813032214	VQHHOEWDYGUKLS-WWGRRREGSA-N	436.856	1.286	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)CO[Si](C)(C)C)[C@@H]1c1cccnc1	1813072830	HBDOMUNIXXPEBO-LAUBAEHRSA-N	449.628	1.312	50	20	IDGD	
C[C@H](CBr)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN2CCNC2=N)[nH]n1	1814779990	CLRYJJXHAZTOQV-YPMHNXCESA-N	440.346	1.273	50	20	IDGD	
C[C@@H]1CCC[C@@H]1C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1	1815344053	DMISCMWSQCEBOP-WQVCFCJDSA-N	427.335	1.485	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)C1(F)CCCCC1)CC2)c1ccc(B(O)O)cc1	1815344338	UPUDDHQEDPIRHC-HNNXBMFYSA-N	445.325	1.721	50	20	IDGD	
O=C(CCc1ccoc1)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1	1815361716	OUKGKWMUQPECLX-MRXNPFEDSA-N	439.302	1.275	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@@H](O)c2ccccc2)[nH]n1)c1cccc(B(O)O)c1	1817473454	VEDMAWIVNDHCPO-CTNGQTDRSA-N	448.288	1.129	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2[C@H]3C=CS[C@H]32)[nH]n1)c1ccc(B(O)O)cc1	1817474783	FQQUAHXOGIXJEN-IWKCEXAMSA-N	438.318	1.271	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3ccc4c(c3)CNC4=O)sc2C1	1819373573	FEJMLEPIRZFGMK-GXTWGEPZSA-N	448.932	1.866	50	20	IDGD	
C[C@H](C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@](C)(Cl)CCl)n[nH]1)n1cnnn1	1820869624	XDFQXLYNOHUWGC-XAGWURHQSA-N	429.312	1.886	50	20	IDGD	
CCOC(=O)C1(C(=O)Nc2cc([C@H]3CCCCN3C(=O)[C@@H](Cl)COC)[nH]n2)CC1	1821805240	GRSDQSXRLXZMFI-GXTWGEPZSA-N	426.901	1.999	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](O)CCl)CC2)c1n[nH]c2cccc(F)c12	1824293084	MCSCHTZVQMZVKN-QPUJVOFHSA-N	437.884	1.984	50	20	IDGD	
C=CCOCCCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1	1824499276	NNKNTMSAUKUXGV-JOCHJYFZSA-N	442.365	1.583	50	20	IDGD	
CCOC(=O)C1(C(=O)N[C@@H]2CCc3nc(NC(=O)[C@@H](Cl)COC)sc3C2)CC1	1826004636	PPMKEDZEUQQOKY-MNOVXSKESA-N	429.926	1.652	50	20	IDGD	
O=C(c1ccc(F)cn1)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827055239	VOYYIEFEXXTTGJ-OAQYLSRUSA-N	439.296	1.448	50	20	IDGD	
O=C([C@H]1CCCCO1)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827056021	QLGQXTNURLFVTR-NHCUHLMSSA-N	428.338	1.169	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(Cl)cnc3O)CCO2)C1	1829564271	MTODDLAVBRCGFT-KBXCAEBGSA-N	432.304	1.528	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3nc4ccccc4[nH]3)C2)C1	1830362421	WJLRVCDPADOWQA-OAQYLSRUSA-N	434.924	1.898	50	20	IDGD	
Cc1cnoc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2	1830543147	KMQXMZILFARFIZ-YVEFUNNKSA-N	430.299	1.084	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc4ncccn34)C2)C1	1831647813	YRPIDEZLVILKSD-MGPUTAFESA-N	435.912	1.207	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnn4c3OCCC4)C2)C1	1831653214	BWHVJEGBQIZXQG-OXQOHEQNSA-N	440.928	1.143	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3nnc(C)s3)CCO2)C1	1833014982	APTBLHJHLIFHSR-HNAYVOBHSA-N	444.985	1.643	50	20	IDGD	
Cc1ccncc1CCC(=O)N1CCC(N2CCC(NC(=O)[C@H](O)CCl)CC2)CC1	1833308099	IHDKOECNVJKHQD-HXUWFJFHSA-N	436.984	1.494	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cc(F)c(F)cc3F)CC2)CC1)[C@H](O)CCl	1833313236	BDCHVJGPDISHAH-GOSISDBHSA-N	447.885	1.889	50	20	IDGD	
Cc1ccc(C(=O)N2CCC(N3CCC(NC(=O)[C@@H](O)CCl)CC3)CC2)cc1F	1833313447	GWOWRLJOUWVZCT-IBGZPJMESA-N	425.932	1.919	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC(N2CCC(NC(=O)Cc3cncnc3)CC2)CC1	1833860565	GUHNFMQPSNUYBP-UHFFFAOYSA-N	433.629	1.442	50	20	IDGD	
O=C(Cc1ccc2ccccc2c1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1	1834891266	XGLQABNVKSPHQR-REWPJTCUSA-N	446.931	1.438	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H]3COc4ccccc4O3)CC2)CC1)[C@@H](F)Cl	1835079092	LLQKGQMYGYLEGR-RTBURBONSA-N	439.915	1.932	50	20	IDGD	
CC(C)Cc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)n(C)n1	1836337299	WVJCGXFYGWWFHU-LPHOPBHVSA-N	430.908	1.223	50	20	IDGD	
Cn1cc(C(=O)N2CCC(OC3CCN(C(=O)[C@@H](F)Br)CC3)CC2)cn1	1837467697	MUUVAMJJFPXKME-OAHLLOKOSA-N	431.306	1.723	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccc(F)cc3)C2)C1	1837712352	NHNAGMPFINEPBH-NRFANRHFSA-N	438.572	1.676	50	20	IDGD	
COc1ccnc(C(=O)N2CCOC[C@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)c1	1837715439	QERUEOHQMJKYIG-FQEVSTJZSA-N	437.569	1.012	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccn(C(F)F)n3)CCO2)C1	1838034300	XCRSCPOIIQGORI-ACJLOTCBSA-N	434.871	1.756	50	20	IDGD	
O=C(c1ccc2c(n1)OCCO2)N1CCC(OC2CCN(C(=O)[C@@H](F)Cl)CC2)CC1	1838059323	KEVHCQHDKNZINA-QGZVFWFLSA-N	441.887	1.999	50	20	IDGD	
CCc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](Br)CC)C3)C2)no1	1838129556	VDRFBDRUIIXBNX-KSSFIOAISA-N	444.326	1.481	50	20	IDGD	
CC(=O)N[C@H](C)C(=O)N1CCC(OC2CCN(C(=O)[C@@](C)(Cl)CCl)CC2)CC1	1838638858	NWBFIDKIQDYCIQ-YJYMSZOUSA-N	436.380	1.746	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(F)cc3F)CCO2)C1	1839006830	UOFGVJQPWKDERJ-KPZWWZAWSA-N	447.276	1.818	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](N)c3cccc(Cl)c3)C2)C1	1839144331	VJHLANADEZBTMO-ZWOKBUDYSA-N	444.359	1.814	50	20	IDGD	
Cc1cc(C)n(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)n1	1839150414	LVYOUJGOFCNOMK-RBUKOAKNSA-N	447.363	1.193	50	20	IDGD	
C=CCOCCCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2	1840030277	HOTBCOTWOORCIO-CRAIPNDOSA-N	433.343	1.209	50	20	IDGD	
Cc1ncsc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2	1840030994	BXSYUUOWFVWKHJ-BZNIZROVSA-N	432.340	1.305	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)C(Cl)(Cl)Cl)C2)C1	1840155434	BVGWYHPNAKSNMF-GXFFZTMASA-N	438.135	1.067	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)c1cccs1)CCO2	1840378136	IEWZMEMMJVDHKU-VCBZYWHSSA-N	430.954	1.562	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)[C@@H]2CCCCO2)C1	1841105023	LAUPYCHFKUTKEG-SFHVURJKSA-N	431.445	1.906	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@H]2C[C@H]3C[C@H]3N2C(=O)OC(C)(C)C)C1	1841361954	ICNZZSSOYAKESA-KLHDSHLOSA-N	441.956	1.842	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1ccc(Cl)nn1)C2	1843416119	AWPGNWQXTIVMGX-WSDLNYQXSA-N	429.868	1.081	50	20	IDGD	
COc1cccc2[nH]cc(C(=O)N3CC4(CCCN4C(=O)c4cnccc4C(=O)NN)C3)c12	1844265011	KNBJWOYOQHLCHK-UHFFFAOYSA-N	448.483	1.306	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2cccc(C(F)(F)F)c2)C1	1844917873	ASXNRDGCDVVIIU-UHFFFAOYSA-N	447.417	1.835	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)[C@@H](c2ccc(Cl)cc2)N(C)C)C1	1845844315	DLPQIIPXFOMVAY-HXUWFJFHSA-N	449.983	1.519	50	20	IDGD	
CC(C)(C)OC(=O)N(CC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl)C1CCCC1	1847560724	ZLCAJDYZBPSGFV-ULQDDVLXSA-N	443.972	1.968	50	20	IDGD	
Cc1nnc(NNC(=O)c2ccc3c(=O)n(-c4ccccc4F)c(=S)[nH]c3c2)[nH]c1=O	11548181	ATMRAPVZXJLTRI-UHFFFAOYSA-N	439.432	1.731	50	20	IDGD	
CCOc1ccc(C(=O)CCC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1	16593884	AYJZCRNNYLMUGF-UHFFFAOYSA-N	447.513	1.760	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(CN3CCCCC3)cc2)c1	16594203	DRLRJZFALWKCNO-UHFFFAOYSA-N	444.557	1.998	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2c(C)nc3ccccn23)cc1S(=O)(=O)NC1CC1	17583294	WGOAVGBMXMFUOV-UHFFFAOYSA-N	443.485	1.167	50	20	IDGD	
CCOC(=O)C1=NN(c2ccccc2)[C@@H](C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)C1	727766187	JBUFTSNFKLMTBL-RDTXWAMCSA-N	442.447	1.938	50	20	IDGD	
CSc1nnc(CCCNC(=O)NN[C@]2(C)CCS(=O)(=O)C2)n1C1CCCC1	728133417	FKBLRYFSAYGMMR-QGZVFWFLSA-N	430.600	1.429	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)[C@H]1CCCN1C(=O)c1ccc2c(c1)OCO2	729451971	MCXYWTIHMRVVND-GOSISDBHSA-N	434.452	1.822	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2ccc(C(=O)NNC(=O)Cc3cc[nH]n3)cc2)cc1	730102996	UMXDMSWMSHILEG-UHFFFAOYSA-N	429.458	1.223	50	20	IDGD	
Cc1noc(C)c1CCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	730677540	OUSDFVMJOJFEMA-UHFFFAOYSA-N	435.506	1.263	50	20	IDGD	
Cc1c(C(=O)NNC(=O)Cn2cnc3ccccc32)nnn1-c1ccc2ncccc2c1	731341650	MXHLXPDRBIIYOT-UHFFFAOYSA-N	426.440	1.935	50	20	IDGD	
COCCn1cc(C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c2ccccc21	732333378	VIROECPOTHZKIQ-UHFFFAOYSA-N	440.412	1.814	50	20	IDGD	
CC(C)n1cc(C=NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)cn1	732710891	WSPPEWFDDTURAV-UHFFFAOYSA-N	433.534	1.568	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NCCOC[C@H]2CCCO2)c2ccccc2c1=O	734677502	VXUMVRCKYTVDHU-OAHLLOKOSA-N	431.493	1.336	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)CC(=O)NNC(=O)c2cc(-c3ccccc3)on2)cc1F	734807768	BVYFCWFTWVCIKM-UHFFFAOYSA-N	445.428	1.918	50	20	IDGD	
CCCCS(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)c2ccc(C#N)cc2)cc1	737757980	ZTRWMFCRCCFPKV-UHFFFAOYSA-N	436.515	1.723	50	20	IDGD	
C[C@H](NC(=O)c1ccc(Br)s1)C(=O)NNC(=O)COCc1ccccc1	737926211	BONZWFVMAMALJZ-NSHDSACASA-N	440.319	1.993	50	20	IDGD	
CN(C)N(C(=O)c1ccc(S(=O)(=O)Cc2ccccc2)cc1)[C@H]1CCS(=O)(=O)C1	741176083	OAZSKBQWAKERIL-SFHVURJKSA-N	436.555	1.766	50	20	IDGD	
COc1ccc(S(N)(=O)=O)cc1C(=O)NNC(=O)c1cccc(Br)c1	742771547	ZLNJKKFONDEPDU-UHFFFAOYSA-N	428.264	1.180	50	20	IDGD	
Cn1c(N)c(C(=O)/C(C#N)=C\c2cc(Cl)ccc2OC[C@@H]2CCCO2)c(=O)n(C)c1=O	743248506	VTNJVDNFZVMTSJ-ODDCISTRSA-N	444.875	1.667	50	20	IDGD	
CCc1nsc(N2CCN(C(=O)NNC(=O)c3cccc(OC(F)F)c3)CC2)n1	743587168	DSXUVYUJFDPHQH-UHFFFAOYSA-N	426.449	1.879	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)c2ncoc2-c2ccc3c(c2)OCCO3)cc1	745295870	QXBWUXKFXIKWPA-UHFFFAOYSA-N	448.391	1.602	50	20	IDGD	
CO[C@@]1(C)C[C@@H](NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)C1(C)C	745930207	BMRLATROQSDYRZ-BEFAXECRSA-N	426.539	1.150	50	20	IDGD	
O=C(NNC(=O)N1CCOCC1)c1cccc(NS(=O)(=O)c2ccc(F)c(F)c2)c1	745992496	BVNVBIFFOSSNNO-UHFFFAOYSA-N	440.428	1.452	50	20	IDGD	
O=C(NNC(=O)[C@H]1CN(Cc2nc(O)c3ccccc3n2)CCO1)c1ccc(Cl)nc1	746128547	IIERGBBVLUPSML-OAHLLOKOSA-N	442.863	1.046	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)C2CC(OCc3ccccc3)C2)cc1	746816185	OMCGTWJZEHUXAB-UHFFFAOYSA-N	445.541	1.758	50	20	IDGD	
O=C(CCOc1ccccc1)NNC(=O)Cn1cnc2ccc(Br)cc2c1=O	747177737	OZZFZOLSEJQKDB-UHFFFAOYSA-N	445.273	1.776	50	20	IDGD	
O=C(Cc1ccc(S(=O)(=O)N2CCOCC2)s1)NNc1ccc([N+](=O)[O-])cc1	747985561	CHPNCXIJXMWGPH-UHFFFAOYSA-N	426.476	1.363	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)(F)F)cc1)[C@@H]1CC(=O)N(CC(F)(F)F)C1	748520859	WASQQDVZZXPKED-MRVPVSSYSA-N	433.330	1.834	50	20	IDGD	
C[C@H](C(=O)N(C)CC(=O)NNc1ccccc1S(=O)(=O)NC(C)(C)C)n1cccn1	748594055	OHQDOHHZAJUZDZ-CQSZACIVSA-N	436.538	1.123	50	20	IDGD	
O=C(O)CCC(=O)c1ccc(S(=O)(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1	748671931	YSHWFVQNPNMLRG-UHFFFAOYSA-N	434.426	1.129	50	20	IDGD	
O=C(NNS(=O)(=O)CCCN1C(=O)c2ccccc2C1=O)c1ccc2ccccc2n1	753023061	ZWPBCHAITLNQKK-UHFFFAOYSA-N	438.465	1.485	50	20	IDGD	
C[C@@H](CC(=O)OCc1ccccc1)NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1	753059340	XDWHBQRVECLZDZ-INIZCTEOSA-N	440.504	1.545	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)c2cccc(S(N)(=O)=O)c2C)cc1C	754326749	DOLNWDVUHSNYEX-UHFFFAOYSA-N	439.515	1.193	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2cc(Cl)cnc2N)cc1Br	754749748	XHFMHWZEYSXAEY-UHFFFAOYSA-N	435.687	1.712	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1)c1cnc2[nH]nnc2c1	755202904	PJDCWWFOJVDJPC-HXUWFJFHSA-N	427.468	1.741	50	20	IDGD	
COC(=O)CNC(=O)c1ccc(NC(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)cc1	755545638	JKYXBPPSXDAVIW-GFCCVEGCSA-N	432.408	1.349	50	20	IDGD	
Cc1nnnn1-c1cccc(NC(=O)NNC(=O)COc2ccc(Br)cc2)c1	755755777	JKTKKKXKZNPRQW-UHFFFAOYSA-N	446.265	1.965	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2cccc(N3C(=O)CN(C)C3=O)c2)cc1OC	755990860	FUTGNAZTQGNBMS-UHFFFAOYSA-N	427.417	1.569	50	20	IDGD	
CCOCC(=O)NNC(=O)Nc1cccc(S(=O)(=O)/N=C2\CCCCCN2C)c1	756166419	NLZRIJAIGDQAQC-CJLVFECKSA-N	425.511	1.469	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ncc(C(C)C)s2)nc1	756175897	GXQGLZOCWPNROK-UHFFFAOYSA-N	426.524	1.430	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cccc3c2oc(=O)n3C)c1	756846890	QNIPOTRDPOKTRZ-UHFFFAOYSA-N	446.485	1.237	50	20	IDGD	
C[C@H]1C[C@@H](C)C[C@]2(C1)NC(=O)N(CC(=O)NNC(=S)NCCc1cccs1)C2=O	757634626	WFMPPEZTJAFUBM-DBWKPXFBSA-N	437.591	1.533	50	20	IDGD	
COCc1nc2n(n1)C[C@H](NC(=O)NNC(=O)c1ccc(-n3c(C)ccc3C)cc1)CC2	757789399	RMJAYBTWUMPWIX-QGZVFWFLSA-N	437.504	1.791	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)Nc2c(C)nn([C@@H]3CCS(=O)(=O)C3)c2C)cc1	757872380	XWNNKXGAONIZMQ-OAHLLOKOSA-N	435.506	1.400	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)c2cnn(CCO[C@H]3CCCCO3)c2C)c1	758077748	BZSRNYRVFQFDNS-IBGZPJMESA-N	432.477	1.827	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)N[C@H]2CCCS(=O)(=O)C2)cc(OCC)c1OCC	758664756	XKDLQWWVSAWUOC-AWEZNQCLSA-N	443.522	1.404	50	20	IDGD	
CC1(C)C(=O)N(C[C@@](C)(O)C(=O)NNC(=O)c2cc(Br)c[nH]2)c2ccccc21	760073391	IANFMSQCVJHHOD-LJQANCHMSA-N	449.305	1.614	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)[C@@H]1CC(=O)N(c2c(F)cccc2F)C1	760439005	DGLYKSXYCONIDJ-LLVKDONJSA-N	426.420	1.380	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)c1cccc(CN2CCN(C)CC2)c1	762407657	DDQKYHMZXYSTHH-UHFFFAOYSA-N	428.558	1.996	50	20	IDGD	
O=C(NNC(=O)c1ccc2ccccc2n1)C(=O)Nc1ccc(NC(=O)[C@@H]2CCCO2)cc1	763454980	LQVZJLANWLUIJH-IBGZPJMESA-N	447.451	1.752	50	20	IDGD	
COC(=O)c1ccsc1NC(=O)C(=O)NNC(=O)c1ccccc1Br	763482847	LMAULEMEBMVLRQ-UHFFFAOYSA-N	426.248	1.697	50	20	IDGD	
Cc1cc(Br)c(NC(=O)C(=O)NNC(=O)c2ccccc2O)cc1[N+](=O)[O-]	763530802	ICNHFQXNQAAXGW-UHFFFAOYSA-N	437.206	1.771	50	20	IDGD	
CCOc1cccc(NC(=O)C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c1	763530848	JDQZYHIVGMBUEH-UHFFFAOYSA-N	439.516	1.384	50	20	IDGD	
N#Cc1cccnc1Oc1ccccc1NC(=O)C(=O)NNC(=O)c1ccc2c(c1)OCO2	763549232	UZGWZOKQTMHKHE-UHFFFAOYSA-N	445.391	1.874	50	20	IDGD	
Cc1cc(C)n(-c2cccc(NC(=O)C(=O)NNC(=O)[C@@H]3COc4ccccc4O3)c2)n1	763570344	DQEIRWMMMSCYFD-IBGZPJMESA-N	435.440	1.415	50	20	IDGD	
COC(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)COc2ccccc2OC)c1	763649149	ZPGDDZSEJUIGPR-UHFFFAOYSA-N	435.820	1.300	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(F)c(OC)cc1OC	763683992	FDEQCRJEGNXJGW-UHFFFAOYSA-N	435.408	1.407	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2ccc3oc(N(C)C)nc3c2)c1	763772313	PRGVYDWIUXMFTF-UHFFFAOYSA-N	427.417	1.311	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)C(=O)Nc2ccc(C(F)(F)F)cc2)c2ccccc2c1=O	763790232	GXJIQRZWGXFWAO-UHFFFAOYSA-N	433.346	1.352	50	20	IDGD	
CC(C)(C)NC(=O)c1cccc(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)c1	763808068	UOOBTUKANYGIEA-UHFFFAOYSA-N	437.456	1.251	50	20	IDGD	
COc1ccc2c(C)c(CCC(=O)NNC(=O)CNC(=O)c3cccnc3)c(=O)oc2c1	763818652	NGPIWMILYFNDPJ-UHFFFAOYSA-N	438.440	1.015	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(CCN3CCOCC3)cc2)cc1	763821500	RFYFTUJDHJYRSU-UHFFFAOYSA-N	440.500	1.035	50	20	IDGD	
CCOc1cc2c(cc1[C@@H]1C[C@@H]1C(=O)NNC(=O)CNC(=O)c1cccnc1)O[C@H](C)C2	763825424	WVLJRWFGOKTUOO-SKDZVZGDSA-N	438.484	1.485	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(-n3nnnc3SC)c2)cc1	763830362	CXOATJHKNASTGZ-UHFFFAOYSA-N	425.474	1.346	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1cccc(OC[C@@H]2CCCO2)c1	763863763	BVIBNOBRVRTUOV-PBHICJAKSA-N	445.447	1.937	50	20	IDGD	
COc1ccc(OC(C)C)c(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)c1	764006229	MVBBHEPPJYBWLZ-UHFFFAOYSA-N	429.429	1.653	50	20	IDGD	
CCn1cnnc1-c1ccccc1NC(=O)C(=O)NNC(=O)c1ccc2c(c1)OCCO2	764006945	WDAHPVYSCWBYBJ-UHFFFAOYSA-N	436.428	1.136	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)[C@@H]1CCCN(C(=O)COc2ccccc2)C1	764049587	KKFYVYWLOLZOPP-MRXNPFEDSA-N	443.525	1.949	50	20	IDGD	
CCNC(=O)N1CCc2ccc(NC(=O)C(=O)NNC(=O)c3ccc(Cl)cc3O)cc21	764127080	SULDINCVJOCQSM-UHFFFAOYSA-N	445.863	1.537	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2O1)C(=O)Nc1ccc(OCc2ccccc2)nc1	764165374	XXQFJYPWNNNQPJ-IBGZPJMESA-N	432.436	1.750	50	20	IDGD	
CC(C)CCC(=O)NNC(=O)C(=O)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1	764204553	YKGZBCRUPFFAPW-SFHVURJKSA-N	426.521	1.852	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1)c1ccc(F)cc1	764245655	HWKRIESPHSXTFX-HXUWFJFHSA-N	426.492	1.925	50	20	IDGD	
Cc1ncsc1C(=O)NNC(=O)C(=O)Nc1ccc2nc(N3CCOCC3)sc2c1	764247587	UAXZNWVYUFSIOT-UHFFFAOYSA-N	446.514	1.298	50	20	IDGD	
Cc1nnnn1-c1cc(NC(=O)C(=O)NNC(=O)c2cccc(OC(F)F)c2)ccc1F	764251580	VKHSWKGBGJDPBQ-UHFFFAOYSA-N	449.349	1.111	50	20	IDGD	
Cc1ccc(-n2nc(C(C)(C)C)cc2NC(=O)C(=O)NNC(=O)Cc2cc[nH]n2)c(C)c1	764285328	AHRRFYNMJJRHNE-UHFFFAOYSA-N	437.504	1.838	50	20	IDGD	
CN(Cc1ccccc1NC(=O)C(=O)NNC(=O)Cc1cc[nH]n1)C(=O)OC(C)(C)C	764296942	JITCGEGJYFPULH-UHFFFAOYSA-N	430.465	1.105	50	20	IDGD	
COCC(=O)NNC(=O)C(=O)Nc1ccccc1CN(C)C(=O)c1cc2ccccc2o1	764300457	QGQBUCYLISNEOD-UHFFFAOYSA-N	438.440	1.437	50	20	IDGD	
COc1cc(C(=O)N(C)C)ccc1NC(=O)C(=O)NNC(=O)CCCc1cccs1	764342351	XDFAQEXQHVBQAZ-UHFFFAOYSA-N	432.502	1.567	50	20	IDGD	
Cc1cc(C(=O)NC2CCCCC2)ccc1NC(=O)C(=O)NNC(=O)Cc1ccncc1	764353267	GZZZUVDMVIRJGJ-UHFFFAOYSA-N	437.500	1.781	50	20	IDGD	
O=C(NNC(=O)C(F)(F)Oc1ccccc1)C(=O)Nc1cc(C(F)(F)F)cnc1O	764379406	DOPRUROYXJWUEL-UHFFFAOYSA-N	434.277	1.564	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1)C(=O)N1C[C@@H]2CCCN2c2ccccc21	764387336	KALXAATVGHUMJH-INIZCTEOSA-N	448.458	1.992	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1ccc(CNC(C)=O)cc1	764392593	HMBABACNSPPOAS-UHFFFAOYSA-N	430.486	1.210	50	20	IDGD	
CC(C)CC(Cc1cccc(Cl)c1)=NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C	764818745	UTZRHXBBCWYVQF-UHFFFAOYSA-N	444.923	1.848	50	20	IDGD	
C[C@@H](Oc1cccc(C=NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)c1)C(=O)O	764831312	PXRWPAMKWMULGC-QGZVFWFLSA-N	438.484	1.447	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc1F	765184358	FXWVEMGCNFOXHJ-UHFFFAOYSA-N	448.476	1.643	50	20	IDGD	
C[C@H](C(=O)NNC(=O)c1cc(F)ccc1Br)S(=O)(=O)C1CCOCC1	765407082	XTTKDTNHVPEMFI-SECBINFHSA-N	437.287	1.332	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)[C@@H]2CCCN(C(=O)c3ccncc3)C2)n[nH]1	765600562	SAGQTGCFCTZNKL-MRXNPFEDSA-N	448.483	1.794	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	765756759	PGPPRWYKLUPNBT-UHFFFAOYSA-N	449.964	1.097	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)NCc1cccc(C(=O)NC[C@H]2CCCO2)c1	766893250	GEOYZOVMWYPSCC-QGZVFWFLSA-N	446.529	1.825	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)c1ccccc1S(=O)(=O)CCN(C)C	767162314	XURVCJFDRRDWAS-AWEZNQCLSA-N	437.493	1.390	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)c3ccc(C[C@H]4CC(=O)NC4=O)cc3)n[nH]2)c1	768269573	OPFAOJNKDOBUHC-KRWDZBQOSA-N	445.479	1.974	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)c2ccc(N3NC(=O)CCC3=O)cc2)n[nH]1	768273289	CBMHCDLYEJIVAZ-UHFFFAOYSA-N	448.439	1.318	50	20	IDGD	
CCC(=O)N1CCCC[C@@H]1C(=O)NNC(=O)c1cc(-c2ccc(OC)c(OC)c2)[nH]n1	768276228	IVMZAAMZQUDBFV-MRXNPFEDSA-N	429.477	1.646	50	20	IDGD	
NS(=O)(=O)c1cccc2c(C(=O)NNC(=O)c3cc(Br)c[nH]3)nccc12	768468233	MTDDVNUACBRXBT-UHFFFAOYSA-N	438.263	1.048	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)c3cccc([C@]4(C)NC(=O)NC4=O)c3)n[nH]2)cc1	769282967	QRRWVUHETBDBAA-QHCPKHFHSA-N	446.467	1.769	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)cc([N+](=O)[O-])c1)c1ccc(-n2cnnn2)cc1	770750765	ZATXVPCBEJKEBE-UHFFFAOYSA-N	432.194	1.408	50	20	IDGD	
Cc1cc2c(N3CCC[C@@H]3C(=O)NNC(=O)CCN3C[C@H](C)O[C@@H](C)C3)ncnc2s1	770949215	CCXJDGAHOFATAL-GRDNDAEWSA-N	446.577	1.615	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2n[nH]c(C(C)C)c2[N+](=O)[O-])c2ccccc2c1=O	771228750	PCKDPZGENCPKJP-UHFFFAOYSA-N	427.421	1.636	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)[C@@H]1CC(=O)N(CCOc2ccccc2Cl)C1	772215758	IXBCMHZTPHPEMC-QWHCGFSZSA-N	425.869	1.056	50	20	IDGD	
Cc1cc(C(=O)O)c(O)c(S(=O)(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)c1	773264903	NLTBBNCIGUETNQ-SNVBAGLBSA-N	428.850	1.829	50	20	IDGD	
Cn1nc(-c2cc(F)cc(F)c2)cc1NC(=O)C(=O)NNC(=O)c1ccc2c(c1)OCO2	773510813	JEUUDZLXXAKOCL-UHFFFAOYSA-N	443.366	1.494	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(Br)c(C)n1	773525875	XYCGEWIYTGSNKE-UHFFFAOYSA-N	435.278	1.880	50	20	IDGD	
CC[C@H](C)NS(=O)(=O)c1cccc(NC(=O)C(=O)NNc2ccccc2[N+](=O)[O-])c1	773654463	WLNNKWOJFOMOMD-LBPRGKRZSA-N	435.462	1.753	50	20	IDGD	
CC(C)(C)NS(=O)(=O)Cc1cccc(NC(=O)C(=O)NNc2cccc(C#N)c2)c1	773681353	RSUKDIZRLBRQCV-UHFFFAOYSA-N	429.502	1.858	50	20	IDGD	
N#Cc1ccc(NNC(=O)C(=O)Nc2ccc(S(=O)(=O)N3CCCCC3)cc2)cc1	773701621	NDCQHFVDIUOJHL-UHFFFAOYSA-N	427.486	1.815	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)N2C[C@H](CC(=O)N(C)C)c3cc(Cl)ccc32)n1	773726563	NAIPJAUKDJQIBC-NSHDSACASA-N	432.868	1.190	50	20	IDGD	
C[C@H](NS(=O)(=O)c1ccc(C(N)=O)cc1)C(=O)NNc1ccc(C(F)(F)F)cn1	775257161	DIRJIVAAHHAEHH-VIFPVBQESA-N	431.396	1.009	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)[C@@](N)(c2ccccc2OC)C(F)(F)F)cc1	776106864	CUVAUKFKKOVNCL-SFHVURJKSA-N	426.395	1.680	50	20	IDGD	
CN(NC(=O)c1cc(OC(F)F)n(C)n1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776215179	ZVRQHPCDCOSFES-UHFFFAOYSA-N	432.428	1.271	50	20	IDGD	
O=C(NNC(=O)[C@]1(F)CCN(C(=O)OCc2ccccc2)C1)c1ccc2c(c1)OCO2	776966063	HGYUGMLIMGRGLD-NRFANRHFSA-N	429.404	1.927	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNS(=O)(=O)c1ccc(NC(=O)C(C)(C)C)cc1	777939671	HADPPFFZHQMIAV-UHFFFAOYSA-N	428.511	1.505	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNS(=O)(=O)c1cc(F)c(Br)cc1OC	779836916	KECIAHCBEQWCPR-UHFFFAOYSA-N	440.291	1.211	50	20	IDGD	
NC(=O)c1cccc(C(=O)NNC(=O)c2nc(-c3ccccc3)n(-c3ccccc3)n2)n1	781933187	LLDAVHPLMZJAOH-UHFFFAOYSA-N	427.424	1.503	50	20	IDGD	
O=C(NN=c1cc[nH]cc1)C(=O)Nc1ccc(Cl)c(S(=O)(=O)N2CCCCC2)c1	783378317	FEYDHEQUYKWRGK-UHFFFAOYSA-N	437.909	1.413	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)c(C)c1	785024322	WMPAJNABZKZFCP-UHFFFAOYSA-N	432.389	1.034	50	20	IDGD	
Cc1coc(C)c1C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	785705671	LTVFZEQVELDANM-UHFFFAOYSA-N	435.502	1.311	50	20	IDGD	
O=C(COC(=O)Cc1cc(-c2ccccc2)on1)NNC(=O)[C@@H]1COc2ccccc2O1	785972276	ASTFAIHQPOAVBG-IBGZPJMESA-N	437.408	1.415	50	20	IDGD	
CC[C@H](O[C@@H]1CCC[C@@H](C)C1)C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	786352670	SAWJXDYYIABDDN-OAFZBRQQSA-N	434.489	1.891	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)[C@H]2CCCN(C(=O)NC3CCCC3)C2)c1	786807456	YPDBUOKJGCBTBJ-KRWDZBQOSA-N	441.488	1.227	50	20	IDGD	
COC(=O)CN(CC(=O)NNC(=O)c1cccs1)Cc1cccc(Br)c1	789488997	LYVVAHUOEZRWDU-UHFFFAOYSA-N	440.319	1.947	50	20	IDGD	
Cc1cccc(NS(=O)(=O)c2cc(C(=O)NNC(=O)CN3CCCC3=O)ccc2C)c1	789857899	KURMDZOACRKZIJ-UHFFFAOYSA-N	444.513	1.488	50	20	IDGD	
CCCCn1ncc(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)c1C(C)C	792287262	UVWZWZHRNUKVMO-UHFFFAOYSA-N	425.493	1.783	50	20	IDGD	
COc1c(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)cc(Cl)cc1C(N)=O	793027053	WWTUOQGHDRHMDO-UHFFFAOYSA-N	441.227	1.206	50	20	IDGD	
CC(C)n1nc(C(=O)NNS(=O)(=O)c2ccc(C#N)c(F)c2)c2ccccc2c1=O	793351306	VMXMUDBKLRMONR-UHFFFAOYSA-N	429.433	1.611	50	20	IDGD	
CC(C)(C#N)c1ccc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cc1	793682382	MWLVQQSGJWFPBO-UHFFFAOYSA-N	433.512	1.707	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)NCC2(S(C)(=O)=O)CCC2)N(C)c2ccccc21	793997189	GFWACPVGUPCWGV-UHFFFAOYSA-N	430.530	1.741	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)c1cc(=O)c2ccc(F)cc2o1	794752548	QJAANVWKUDQJCS-UHFFFAOYSA-N	438.459	1.905	50	20	IDGD	
CNS(=O)(=O)N1CCC(C(=O)NNC(=O)c2ccc(OCCC(C)C)cc2)CC1	794765832	ARSDWYHIIHWOCJ-UHFFFAOYSA-N	426.539	1.049	50	20	IDGD	
CN(C(=O)OC(C)(C)C)[C@H](C(=O)NNC(=O)Cn1cnc2ccccc21)c1cnn(C)c1	794766389	GLUYQLHLAPIFTG-SFHVURJKSA-N	441.492	1.525	50	20	IDGD	
COC(=O)C[C@](C)(NCC(=O)NNC(=O)c1cc(Cl)ccc1OC)c1ccccn1	796011260	PQDKHBFTMBHSKF-FQEVSTJZSA-N	434.880	1.573	50	20	IDGD	
Cc1onc(-c2ccc(Cl)c(Cl)c2)c1C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O	798109773	WLUIMWRDNKZCGY-ZETCQYMHSA-N	435.289	1.656	50	20	IDGD	
Cc1onc(-c2ccc(Cl)cc2Cl)c1C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O	798109933	ZSPAVLFKYDUJFI-ZETCQYMHSA-N	435.289	1.656	50	20	IDGD	
CNC(=O)CNC(=O)c1cccc(NC(=O)C(=O)NNc2cc(Cl)cc(Cl)c2)c1	800633726	JRFGOKRXFXYHDA-UHFFFAOYSA-N	438.271	1.551	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)CCn2nnc3ccccc3c2=O)c(OC)cc1Cl	802084348	YNSHROGYNBPIJZ-UHFFFAOYSA-N	446.851	1.705	50	20	IDGD	
C[C@H]1Cc2cc(C(=O)NNC(=O)Nc3ccc4c(c3)OCO4)ccc2N1S(C)(=O)=O	802095687	ASNBVOVSRRZGNC-NSHDSACASA-N	432.458	1.592	50	20	IDGD	
COCCCOc1ccc(CNC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1	804867699	IRLYARUJTPQRFR-UHFFFAOYSA-N	425.449	1.222	50	20	IDGD	
COC(=O)CCSc1ccc([N+](=O)[O-])cc1C(=O)NNc1ccc(-n2ccnc2)nn1	804957459	WVRLXYNLZHUJCU-UHFFFAOYSA-N	443.445	1.983	50	20	IDGD	
Cc1ccc(Br)c(S(=O)(=O)NCCNC(=O)NNc2cccnn2)c1	807564906	ZYYJHQRTGPXJFF-UHFFFAOYSA-N	429.300	1.152	50	20	IDGD	
COc1ccc(CN2CC[C@@H](NC(=O)NNC(=O)c3ccccc3O)C2=O)c(OC)c1	807577956	QHTCYGQTSIEJHJ-MRXNPFEDSA-N	428.445	1.155	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)(F)F)cc1)C(=O)Nc1ccc2c(c1)C(=O)OC2	808937509	FGRCUOUSAKXLDG-UHFFFAOYSA-N	443.359	1.732	50	20	IDGD	
NC(=O)c1ccc(OCC(F)F)c(NC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1	810342959	LSLUTAAFVXRZGG-OAHLLOKOSA-N	436.371	1.422	50	20	IDGD	
CSC1(CNC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)CCN(C)CC1	811942625	FCIKOCSCLCZYCH-UHFFFAOYSA-N	429.568	1.253	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)Cc2ccnc(O)c2Br)cc1	812730577	NWNPBEMJKAOWQT-UHFFFAOYSA-N	429.296	1.486	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2cccc(N3CCCC3)c2)cc1	813033501	WNDNFEYJGRWWRP-UHFFFAOYSA-N	431.518	1.619	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCC[C@]2(O)C[C@H]3CC[C@H]2C3)nc1	813784915	YQJBXYFNIOMUCE-DOXZYTNZSA-N	425.555	1.679	50	20	IDGD	
COC(=O)c1ccc(C=NNC(=O)CN2c3cccc4cccc(c34)S2(=O)=O)n1C	814765343	BOHVZRCZMGVSME-UHFFFAOYSA-N	426.454	1.624	50	20	IDGD	
O=C(NNc1ccccn1)C(=O)Nc1ccc([N+](=O)[O-])c(I)c1	815558108	QNPUVZJPGWTHPS-UHFFFAOYSA-N	427.158	1.676	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(Br)c(C3CC3)n2)c1	815569070	GDBKWFUVNRZAGN-UHFFFAOYSA-N	428.246	1.993	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)c1ccc(CN2CCC(CO)CC2)cc1	817053035	AHGRLIGFHCXESQ-UHFFFAOYSA-N	446.573	1.898	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)CNS(=O)(=O)c1c(C)c(C)cc(C)c1C	913459293	LUOZUHTVKNTOOI-UHFFFAOYSA-N	447.557	1.987	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)NCCN1CCN(Cc2ccccc2)CC1	915902513	WAJZTUOQUGRQNH-UHFFFAOYSA-N	429.496	1.353	50	20	IDGD	
CCc1c(C(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)cnn1C	916147751	BLUIAKFGEZLDKL-UHFFFAOYSA-N	430.472	1.759	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2ccnc(N3CCCC3)c2)c1	916254770	QWQHMQWFUCGDOS-UHFFFAOYSA-N	446.533	1.076	50	20	IDGD	
COc1cc(C=NNC(=O)c2cccc(N(C)C)c2)ccc1OCC(=O)N1CCOCC1	916280410	BRGWWFPITWEGIO-UHFFFAOYSA-N	440.500	1.763	50	20	IDGD	
CCNC(=O)COc1ccc(CNC(=O)NNC(=O)c2c[nH]c3ccccc23)cc1OC	916388620	FIZWGVAALXGRTC-UHFFFAOYSA-N	439.472	1.836	50	20	IDGD	
CCOC(=O)N[C@@H](CNC(=O)NNC(=O)c1csc(N2CCOCC2)n1)CC(C)C	916632325	UUOOIUGUKVNYSR-CYBMUJFWSA-N	442.542	1.085	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)NCc1cccc(CN2CCOCC2)c1	918223422	HBNUVNNYBXEZBH-INIZCTEOSA-N	430.480	1.956	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(=O)n(CC(=O)NNC(=O)Nc2ccccc2C)c1	918691582	CUXLFAZTIAXNKA-UHFFFAOYSA-N	435.506	1.040	50	20	IDGD	
CC(=O)NCCc1ccc(S(=O)(=O)NNC(=O)c2cc(C)nc3ccccc23)s1	918725251	JEJFMUCUUDXAEW-UHFFFAOYSA-N	432.527	1.907	50	20	IDGD	
Cn1cc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)cn1	919792826	JNPWXAXMRXUHSZ-UHFFFAOYSA-N	442.501	1.043	50	20	IDGD	
CC(=O)Nc1ccc(O)c(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1	919807570	XYXLJWNAYFHDEE-UHFFFAOYSA-N	446.485	1.210	50	20	IDGD	
O=C(Cn1c(Cc2ccccc2)nc2ccccc21)NNC(=O)N[C@H]1CCS(=O)(=O)C1	919888459	DAYXIQQXMBZDSN-INIZCTEOSA-N	441.513	1.145	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)c1ccccc1S(=O)(=O)N1CCCCC1	920006515	KTOIITNWNCULJR-UHFFFAOYSA-N	431.514	1.874	50	20	IDGD	
CCOc1ccccc1C(=O)N1CCC[C@H]1C(=O)NNC(=O)COc1ccccc1OC	920423888	HWASQIHLJWELHY-KRWDZBQOSA-N	441.484	1.925	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)c1ccc(C)cc1)C(=O)NNC(=O)NCc1ccco1	920857612	YFOPELHKPXFCGW-MRXNPFEDSA-N	440.547	1.519	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)Nc2cccc(CN3CCC[C@H]3C(N)=O)c2)c1	920930016	DJBXJPXHUFFOMI-IBGZPJMESA-N	441.488	1.620	50	20	IDGD	
Cc1ccc(Cc2cnc(NC(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)s2)cc1F	920932698	FEBBPZYSYRWYGJ-GFCCVEGCSA-N	426.495	1.769	50	20	IDGD	
CN(CC(=O)NNC(=O)c1cncn1-c1ccccc1)C(=O)c1ccc(Br)o1	1317913706	RFHZWPDVTRXXLG-UHFFFAOYSA-N	446.261	1.761	50	20	IDGD	
CN1CCN(C(=O)NNC(=O)c2nn(-c3ccccc3F)cc2Br)CC1	1328622751	SZXKGNPDKRKIHB-UHFFFAOYSA-N	425.262	1.376	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cccc4c3OCCO4)C2)C1	1777839933	IREBDXNXGKMGEQ-YJYMSZOUSA-N	439.306	1.685	50	20	IDGD	
Cn1ncc2cc(C(=O)N3CC[C@@]4(C3)CN(C(=O)[C@@H](F)Br)CCO4)ccc21	1778021553	UFFPGBGEMPPBIY-CRAIPNDOSA-N	439.285	1.707	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3nnc(-c4ccccc4)o3)C2)C1	1779113688	AXHIHSRBZRUKRJ-FOIQADDNSA-N	434.880	1.434	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnn(C)c2Cl)C1	1779929865	FNCWFKHTWBAMAK-PMUMKWKESA-N	433.336	1.455	50	20	IDGD	
CC(C)(C)OC(=O)C(C)(C)CC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1780886693	RNUUROMQRAGFQM-VBKZILBWSA-N	432.945	1.174	50	20	IDGD	
Cc1cccc(C)c1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)C2	1781022837	UTTCYLDUMYOCQU-NTKDMRAZSA-N	444.576	1.804	50	20	IDGD	
CN(C)c1cncc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)c1	1781224135	HYVIOTBCORXHLY-OALUTQOASA-N	429.348	1.827	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)c(O)c1	1781333803	JJKUGKAVOUNWMA-PBHICJAKSA-N	431.258	1.535	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(O)nn1)C2	1781996666	PRUXHQSXVSQETM-CJBNDPTMSA-N	427.299	1.093	50	20	IDGD	
CCn1nc(C)cc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](Cl)COC)C1	1782172959	RYCSEAAPVBYUKN-WRWLIDTKSA-N	426.945	1.593	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccnc3c1OCO3)C2	1782174010	XVZZLYHTNQSXHT-STXHMFSFSA-N	439.896	1.192	50	20	IDGD	
C[C@@H](NC(=O)c1ccccc1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Cl)C2	1783257839	YBNLOYXRVSWRKH-RACNMONISA-N	439.915	1.853	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](C)Oc1ccccn1)CCO2	1783354016	LXSCTNONCCTIPI-ZRGWGRIASA-N	440.338	1.852	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc([N+](=O)[O-])o3)[C@H]2C1	1783364955	VRLCSUNCMKVVKZ-MNXVOIDGSA-N	444.282	1.955	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccncc3C(F)(F)F)C[C@@H]21)[C@@H](O)CCl	1784091210	XGGKQESUKNICQS-LVGORTOPSA-N	435.830	1.293	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCC#N)C[C@@H]21	1785076471	KLTBSPZJCQXVJS-VGWMRTNUSA-N	442.944	1.402	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3nnsc3C3CC3)[C@H]2C1	1787681549	VPEAMLWLFJWTIQ-KKUMJFAQSA-N	438.626	1.860	50	20	IDGD	
O=C(CC(F)(F)C(=O)O)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1	1788569098	QQNRFHTZNLGGCG-UHFFFAOYSA-N	446.215	1.224	50	20	IDGD	
Cn1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Cl)C[C@@H]32)c(C(F)(F)F)n1	1788896433	DJRHHCTVGUHLGU-LKAMGYQZSA-N	426.798	1.567	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3C[C@@H]3F)C[C@@H]21	1789221814	HDZIIIRXUFOOTO-SRLWMKERSA-N	449.435	1.471	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C(=C/c3ccco3)NC(C)=O)[C@H]2C1	1790180599	AATUKSLPHWYZPB-RYNGGPEBSA-N	437.924	1.754	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnnc(Cl)c3)C[C@@H]21	1790960706	BRIYVGJUZTUGFT-PYJNHQTQSA-N	445.745	1.897	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C[C@@H](N)c3cccnc3)C[C@@H]21	1791057457	DEGZDFQNHXZGDK-DWBZUHSKSA-N	439.354	1.235	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cn4ccsc4n3)C[C@@H]21	1791253476	BKDMGTMRHDOZPO-ABHRYQDASA-N	426.926	1.243	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(F)cc(F)c3F)C[C@@H]21	1791256247	JVUBVHLKJJQLKK-CFMVVWHZSA-N	434.842	1.951	50	20	IDGD	
COCCOCCOCCC(=O)Nc1ccc(C2(NC(=O)[C@@H](O)CCl)CCC2)cc1	1791482728	UCSBBEWNTTZSCN-SFHVURJKSA-N	442.940	1.790	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1ccc(C2(NC(=O)c3cc4ncccn4n3)CCC2)cc1	1791601700	PFWPLUXVPQXBGI-UHFFFAOYSA-N	449.515	1.850	50	20	IDGD	
C[C@H](Cn1ccnc1)C(=O)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1	1791869324	WJNTVGOTVRFRAV-QGZVFWFLSA-N	446.316	1.647	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(-c2ccccc2)on1	1792406730	YEHJLNVEVRKXBE-RCJHGTSTSA-N	433.892	1.799	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CNc3ccccc31)C2	1792868313	WBZAUZMBLZSHQU-ARULTKQDSA-N	436.350	1.816	50	20	IDGD	
C[C@H](CBr)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCNC(=O)c1ccc[nH]1)C2	1792987597	VMRYHKPGDIWYBD-APIJFGDWSA-N	439.354	1.804	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CC[C@@H]1CNc2ccccc2C1	1795651078	DSPAWZAAOIYLMB-GASSVWHLSA-N	449.979	1.894	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CS(=O)(=O)c1ccc(C)cc1	1795747169	BUCPQEWIYVXCNH-KYHPRHEASA-N	442.965	1.661	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)c1ccc(OCC2CC2)cc1	1796190602	PCUZIHMVVFMGAD-KOUNCHBCSA-N	448.328	1.721	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Cl)CC1	1796370820	MLQWIOOQGZVFDA-QKPAOTATSA-N	447.935	1.758	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)Nc1nccs1	1796411113	UBTHCJXBFWRFTB-VJTDZRGJSA-N	445.383	1.564	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](O)c1ccco1)C2	1796889579	FXCXRBOSWLLFLC-ZEVQPODASA-N	427.461	1.085	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnc(Cl)nc1)C2	1796889677	MJHSQMIYAOHHIB-FTORJNITSA-N	443.895	1.516	50	20	IDGD	
C[C@@H]1Oc2ccc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)C(Cl)Cl)C4)cc2NC1=O	1798584056	ACTJECHBBFVLOT-BTABJRDXSA-N	442.299	1.413	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](O)CCl)C2	1799219533	PHRMNRAUWXFIRH-OQMKEHIESA-N	439.852	1.372	50	20	IDGD	
C[C@@H](Oc1ccccc1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnccc1C(=O)NN)C2	1800200045	JXWAKBRGMLPAGW-WCXIOVBPSA-N	437.500	1.404	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cc(Cl)ccc1OC	1800407070	VQVGLIXRJGHZHV-QHHYFVSCSA-N	445.343	1.735	50	20	IDGD	
C#CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C#N)=C/c1ccc(Br)cc1)C2	1800455746	PDAXZCMRIQOREN-MAZHBOQJSA-N	428.286	1.579	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(-c2cc[nH]n2)cc1)c1ccc(B(O)O)cc1	1800612370	TUFLBHYMPNSQKR-WKCHPHFGSA-N	444.300	1.322	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C12CC(C(=O)OC)(C1)C2	1800705252	NXUPWGPKUCPOHS-ZCGWNNTKSA-N	443.338	1.093	50	20	IDGD	
CC(C)[C@H]1CC[C@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCC(=O)NN(C)C)CC1	1801012954	OHDDHMHDODMXOS-UGEWPGMYSA-N	436.597	1.411	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CNc2ccc(F)cc2)[C@@H]1c1cccnc1)[C@H](O)CCl	1803138618	LOXVHTWMBGFXOC-QKYXUNIQSA-N	434.899	1.938	50	20	IDGD	
C=CCSCC(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1804173578	XNSDKKUOUCTQMS-GHTZIAJQSA-N	439.346	1.000	50	20	IDGD	
O=C(c1cnn(-c2cccnc2)c1)N1CCC2(CCCN(C(=O)[C@@H](O)CCl)C2)CC1	1805517344	CCCRIYKUQOBOHH-SFHVURJKSA-N	431.924	1.712	50	20	IDGD	
O=C(C1=NN(c2ccccc2)C(=O)C1)N1CCC2(CCCN(C(=O)[C@H](O)CCl)C2)CC1	1805523781	VOJMAVJTCRAIKP-GOSISDBHSA-N	446.935	1.610	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H](CNC(=O)[C@@H]2CCC(=O)N2)[C@@H]1c1cccnc1	1806638616	BLOMHALAVBYELF-AESZEHBQSA-N	437.338	1.540	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)C(C)(F)F)[C@H]1c1cccnc1	1806961707	MORFHRSPFFZUOX-KEXANBGTSA-N	446.458	1.877	50	20	IDGD	
Cc1cncc(CCC(=O)N2CCCC3(CCN(C(=O)CCC(=O)NN(C)C)CC3)C2)c1	1807035981	ILSRUOMRXBQPHP-UHFFFAOYSA-N	443.592	1.927	50	20	IDGD	
Cc1ccc(=O)n(C(C)(C)C(=O)N2CC[C@H](CNC(=O)[C@H](F)Cl)[C@H]2c2cccnc2)n1	1808313599	IIVAONNAFBEQNF-NXHRZFHOSA-N	449.914	1.922	50	20	IDGD	
CC(=O)OC[C@H](OC(C)=O)C(=O)N1CC[C@H](CNC(=O)[C@H](F)Cl)[C@H]1c1cccnc1	1808313810	PUKHSXFNMQEATL-TWMKSMIVSA-N	443.859	1.117	50	20	IDGD	
Cc1c(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)nc2ccccn12	1809078730	ZBPYIXGZUXUYBG-ZWOKBUDYSA-N	441.919	1.957	50	20	IDGD	
Cn1ncc2cc(C(=O)NC[C@@H]3CCN(C(=O)[C@@H](O)CCl)[C@H]3c3cccnc3)ccc21	1809419066	DYDUOBLVCLBQAE-VDGAXYAQSA-N	441.919	1.888	50	20	IDGD	
C=CC[C@H](C(=C)C)C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1810171178	FGJWXZFREANYMK-MZYLBHOOSA-N	447.344	1.849	50	20	IDGD	
CN(C)C(=O)NCC(=O)N1CC[C@H](CNC(=O)CO[Si](C)(C)C)[C@@H]1c1cccnc1	1810537372	DJZBGFHEIGRKSQ-APWZRJJASA-N	435.601	1.210	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)c2cc[n+]([O-])cc2)[C@@H]1c1cccnc1	1811197392	CDWQGLXIERVHTA-JQFCIGGWSA-N	433.306	1.818	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2cnn3c2CCC3)[C@H]1c1cccnc1	1813034217	DYUAJEHXSMHAKR-AYBZRNKSSA-N	431.924	1.798	50	20	IDGD	
Cc1ncccc1C(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1813070304	HBFGLRNWROGYTI-AVRDEDQJSA-N	438.532	1.478	50	20	IDGD	
CN(CC(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](O)CCl)n[nH]1)C(=O)OC(C)(C)C	1814869559	SJORPPZKHIWVEF-KBPBESRZSA-N	443.932	1.868	50	20	IDGD	
N[C@@H](Cc1cscn1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](O)CCl)n[nH]1	1814869830	CPWKTDWQRSTWTL-YUTCNCBUSA-N	426.930	1.028	50	20	IDGD	
CC1=CC[C@@H](C(=O)N[C@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)CC1	1815344214	OJTULCVYHIXIHP-PBHICJAKSA-N	439.346	1.795	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3cnn4ncccc34)sc2C1	1816950233	PHQWEQYVJGHGNA-JQWIXIFHSA-N	434.909	1.665	50	20	IDGD	
C[C@H](C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](F)Cl)sc2C1)[C@H]1SC(=N)NC1=O	1817121909	UIKGWKZXJFFTEO-NAXOPYRSSA-N	433.918	1.392	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)CS(=O)(=O)N3CCCC3)sc2C1	1817276110	QKGPTQGOKQCJDA-NWDGAFQWSA-N	448.998	1.498	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](F)Br)[nH]n1	1818124955	WQJWAZHLHGDGCC-LQJRIPTKSA-N	432.294	1.959	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)CCc3nc(N)n[nH]3)sc2C1	1819552166	QOWAOISNZUJYDJ-ZJUUUORDSA-N	425.946	1.796	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](C)Br)CC2	1820149945	WAUQVDSHPFQNJB-AEJSXWLSSA-N	429.340	1.529	50	20	IDGD	
C[C@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)c3cc[n+]([O-])cc3)sc2C1	1821054643	SHCIJLRHCUGATC-ONGXEEELSA-N	425.308	1.786	50	20	IDGD	
CC[C@@H](Br)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)C2=NNC(=O)C2)[nH]n1	1822085789	DXZWHCWOZAVFBL-SKDRFNHKSA-N	425.287	1.451	50	20	IDGD	
CC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(=O)nc3cccnn13)CC2	1822850141	PETRMNFXTFVAQK-QWRGUYRKSA-N	446.920	1.789	50	20	IDGD	
Cc1ccn2c(C(=O)Nc3nc4c(s3)C[C@H](NC(=O)[C@H](O)CCl)CC4)cnc2c1	1824298907	CBDRUQDXQHBRMF-BXUZGUMPSA-N	433.921	1.925	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnnn1C)CC2	1825440796	FJDDAJHFLKUYQF-BDAKNGLRSA-N	427.328	1.671	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc3nncn3c1)CC2	1826000319	RXHOFDNBLCDWOZ-NEPJUHHUSA-N	434.909	1.665	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](C)Nc1cnccn1)CC2	1826000348	SHMLTLXCXDBHSV-WOPDTQHZSA-N	438.941	1.600	50	20	IDGD	
Cc1cc(C(=O)N[C@@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)cnc1C	1826080429	KKMLTJCBSJKWGJ-OAHLLOKOSA-N	444.561	1.754	50	20	IDGD	
C[C@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)CCBr)CC1)n1cnnn1	1826360059	CMSHWXDQPUKXLU-HIFRSBDPSA-N	427.347	1.639	50	20	IDGD	
O=C(CCn1ccnn1)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](F)Br)CC2	1826878135	VDYHHHDACZMZKA-UFBFGSQYSA-N	431.291	1.427	50	20	IDGD	
Cc1nccnc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827052173	BMWOXPRUUOUORR-HXUWFJFHSA-N	436.321	1.012	50	20	IDGD	
C[C@@H](C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2)n1cccc1C=O	1830357859	MUAHINOLCAPUOR-KKSFZXQISA-N	439.940	1.583	50	20	IDGD	
CN(C)c1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)nc1	1830359250	XXFHQRIPDFIKRA-OAQYLSRUSA-N	438.956	1.483	50	20	IDGD	
O=C(c1c(F)cccc1Cl)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1830731203	HTXUFHGKFLIZBP-RDTXWAMCSA-N	435.279	1.149	50	20	IDGD	
CCC(=O)C(=O)N1CCCC[C@H]1C1CCN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)CC1	1831354595	CKAJILXCUYDKRT-WORIPGKHSA-N	429.521	1.719	50	20	IDGD	
C=CCOCCCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)Br)C2)C1	1831412795	DLCIEJAEQZKMQR-QAPCUYQASA-N	433.343	1.209	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)COc3ccc(O)cc3)C2)C1	1831639124	MHWJEATVGJNZSY-WIYYLYMNSA-N	440.924	1.635	50	20	IDGD	
CNC(=S)NCCC(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H](C)Br)CC1	1831654716	GRJWDRWAPFDIFC-ZFWWWQNUSA-N	447.443	1.874	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)Cc3ccccc3)C2)C1	1831657448	OHSWJOODWRGATN-JQVVWYNYSA-N	438.952	1.454	50	20	IDGD	
O=C(/C=C/c1ccco1)N1CCO[C@]2(COCCN(C(=O)CCBr)C2)C1	1833072735	QQIZSUKFEILBJQ-WHLIDYPQSA-N	427.295	1.534	50	20	IDGD	
C[C@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)[C@@H]3C=CCN3)CC2)CC1	1833263798	SXPKAMGIGGWOIH-PBHICJAKSA-N	427.387	1.117	50	20	IDGD	
O=C(Cc1cnc2ccccn12)NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1833293269	RAMWIXXTYYQQIL-IBGZPJMESA-N	447.967	1.048	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(OC)s3)CCO2)C1	1833426234	YULPVYFZZDWEQU-FZKQIMNGSA-N	432.926	1.081	50	20	IDGD	
Cc1ncsc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)Br)C2)C1	1834269458	ZNFBXIWTNWVRHS-ZBEGNZNMSA-N	432.340	1.305	50	20	IDGD	
Cn1cc(F)cc1C(=O)N1CCOC[C@]2(CN(C(=O)CCBr)CCO2)C1	1834821698	UMQWWWIGJFPCQT-KRWDZBQOSA-N	432.290	1.019	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)COc3ccc(F)cc3)CCO2)C1	1834964216	QFWCHVUZRFUCJY-FXAWDEMLSA-N	428.888	1.678	50	20	IDGD	
C=CC(=O)N[C@@H](C)C(=O)N1CCC(N2CCC(NC(=O)CO[Si](C)(C)C)CC2)CC1	1835836919	CAFDBXUAEJBZGU-INIZCTEOSA-N	438.645	1.100	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC(OC2CCN(C(=O)[C@@H]3CCC(=O)N3)CC2)CC1	1836670150	BBHXZUYJPBPIKI-BBRMVZONSA-N	444.370	1.295	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC(OC2CCN(C(=O)c3cnc(O)[nH]3)CC2)CC1	1836672932	GRQHQGVOFOXFJH-GFCCVEGCSA-N	443.342	1.759	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cncnc3C)CCO2)C1	1838098565	SFEJHZYOPOQGDF-YJBOKZPZSA-N	441.326	1.029	50	20	IDGD	
CCc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](Br)CC)C3)C2)no1	1838129558	VDRFBDRUIIXBNX-RDTXWAMCSA-N	444.326	1.481	50	20	IDGD	
Cc1cc(/C=C/C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)no1	1839154027	ZEAYFZISGBEDHW-DUFJLWIISA-N	446.331	1.689	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnn4cccc(C)c34)CCO2)C1	1839612126	BBFFPOCYKFBHNM-DYESRHJHSA-N	434.924	1.730	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cccc(F)c3)C2)C1	1840032375	WVEGVWDCCOMVTH-KUHUBIRLSA-N	443.313	1.608	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)cc1F	1840034216	FAVIHVZUQTZODX-IFXJQAMLSA-N	443.313	1.988	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3c[nH]c(C(C)(C)C)c3)C2)C1	1840151080	VXOLVQJYXLPYLZ-HRAATJIYSA-N	441.956	1.636	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C(C)=C/c3cccnc3)C2)C1	1840156124	OFTFOGWKWJKWOG-UMWZGDBLSA-N	437.924	1.195	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H](C(=O)N2CC3(CCCN3C(=O)[C@H](O)CCl)C2)[C@@H](F)C1	1841348699	YVLPVPMXELYYJB-QLFBSQMISA-N	447.935	1.385	50	20	IDGD	
CC(C)(C)OC(=O)N1CCCC[C@H](C(=O)N2CC3(CCCN3C(=O)[C@H](O)CCl)C2)C1	1841354799	WRNCISNDODKEFU-JKSUJKDBSA-N	443.972	1.827	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)CCN1CCCCC1)C2	1843415794	NLSQLHLIJHANEJ-JJIBRWJFSA-N	428.537	1.200	50	20	IDGD	
Cc1ccc(=O)n(C(C)(C)C(=O)N2CC3(CCCN3C(=O)[C@H](C)Br)C2)n1	1846177862	PWZXOBTWECOIBZ-ZDUSSCGKSA-N	425.327	1.274	50	20	IDGD	
COCCOCCOCCOCCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)C(C)(C)CCl	1847438429	PSELQUKVROKGIG-ROUUACIJSA-N	448.988	1.540	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NCc2ccccc2S(=O)(=O)N(C)C)cc1C	9811562	ZGBKHMUEVDMIQQ-UHFFFAOYSA-N	434.518	1.463	50	20	IDGD	
Cn1cc([N+](=O)[O-])cc1C(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	16306056	MDVLUAGRPUHHJK-UHFFFAOYSA-N	446.423	1.766	50	20	IDGD	
CCC1CCC2(CC1)NC(=O)N(CC(=O)NNC(=O)COc1ccc(C)c(C)c1)C2=O	17203639	JXKNILCJWAVEEY-UHFFFAOYSA-N	430.505	1.720	50	20	IDGD	
CCc1nnsc1C(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	30058919	UNXDGSXBCLKZBW-UHFFFAOYSA-N	445.526	1.654	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)[C@@H]2CCCN(C(C)=O)C2)c2ccccc2c1=O	115234233	YYKOKTBBHYTOPN-MRXNPFEDSA-N	427.505	1.606	50	20	IDGD	
COCCCNC(=S)N(C)NC(=O)c1cc(S(=O)(=O)N2CCCC2)ccc1Cl	726076850	HAKQUSHZSLQDJM-UHFFFAOYSA-N	448.998	1.612	50	20	IDGD	
CCCC(=O)N1CSC[C@H]1C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	727294195	TWEGYJIIKNXLLP-SFHVURJKSA-N	433.578	1.048	50	20	IDGD	
O=C(COc1ccccc1OCC(F)(F)F)NNC(=O)[C@H]1COc2ccccc2O1	727658765	CRLLLNZUCQZNPY-MRXNPFEDSA-N	426.347	1.994	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NNC(=O)CCCc1ccccc1	727843141	CTIPSDJXCDVXIJ-UHFFFAOYSA-N	446.533	1.286	50	20	IDGD	
CCS(=O)(=O)N1CCC[C@@H](C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)C1	728972011	CIZVKMINSOMGFJ-LLVKDONJSA-N	425.479	1.188	50	20	IDGD	
O=C(NNS(=O)(=O)c1csc(-c2ccc(Cl)cc2)n1)[C@@H]1CCS(=O)(=O)C1	730511911	CHJJDFJGIQBCGR-SNVBAGLBSA-N	435.936	1.208	50	20	IDGD	
CC(C)(C(=O)NNS(=O)(=O)c1ccc(NS(C)(=O)=O)cc1F)c1ccccc1	731180135	SHPVGUGKLISSFC-UHFFFAOYSA-N	429.495	1.485	50	20	IDGD	
O=C(COCC(=O)NNC(=O)NCc1cccc(C(F)(F)F)c1)NCc1cccnc1	731184820	LIHBJCLMCVIHNU-UHFFFAOYSA-N	439.394	1.264	50	20	IDGD	
Cc1c(C(=O)NNC(=O)CNC(=O)c2cccs2)nnn1-c1cccc2cccnc12	731456891	BANZVIXNWVFGQY-UHFFFAOYSA-N	435.469	1.376	50	20	IDGD	
O=S(=O)(CCNS(=O)(=O)c1ccc(CCCCl)cc1)NC[C@H]1CCCCO1	732227669	FOOROKBALMOIFM-MRXNPFEDSA-N	438.999	1.625	50	20	IDGD	
Cc1c(C(=O)NNC(=O)CCN2C[C@H](C)O[C@H](C)C2)nnn1-c1cccc2cnccc12	732260119	BAJAXGUQXPBFTM-GASCZTMLSA-N	437.504	1.384	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)c1cccc(O)c1	732890196	VXKJQLDPHSKWMX-CQSZACIVSA-N	432.502	1.882	50	20	IDGD	
CCc1cc(N2CCC[C@H](NC(=O)NNC(=O)c3ccc4c(c3)OCCO4)C2)ncn1	732913875	GIMJIZBHNXYHDX-INIZCTEOSA-N	426.477	1.423	50	20	IDGD	
O=C(COC(=O)c1ccc2nc(C(F)F)[nH]c2c1)NNC(=O)[C@H]1COc2ccccc2O1	733539301	WBFGNSXAUUNLLP-OAHLLOKOSA-N	446.366	1.645	50	20	IDGD	
O=C(NC[C@@H]1CCCN1Cc1ccccc1)NNC(=O)C1CCN(c2ncccn2)CC1	734169532	YSTBWYCIALIJJY-FQEVSTJZSA-N	437.548	1.688	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)[C@@H]1CC(=O)N(c2ccccc2Cl)C1	734239876	YLNHADMGIKMIMX-GFCCVEGCSA-N	439.900	1.548	50	20	IDGD	
COc1ccc(C2(C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)CCOCC2)cc1	734240076	IYDCGJNJGWOQDK-UHFFFAOYSA-N	436.509	1.599	50	20	IDGD	
O=C(NNc1nccnc1Cl)c1ccc2c(c1)S(=O)(=O)N(C[C@@H]1CCCO1)C2=O	734261508	GUNRVVCKZWQJNN-NSHDSACASA-N	437.865	1.210	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)CN2C(=O)[C@H]3CCCC[C@H]3C2=O)cc1C	736740589	WUSRXPXGBXUFSE-BETUJISGSA-N	435.502	1.098	50	20	IDGD	
Cc1nc(-c2ccccn2)nc(NNC(=O)c2cc(C)c3c(=O)n(C)c(=O)n(C)c3n2)c1C	738543420	PDBNGPCPQACMEG-UHFFFAOYSA-N	446.471	1.166	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1cc(N2CCOC2=O)ccc1F	741662549	RXISZFBVDZXIIU-UHFFFAOYSA-N	449.464	1.459	50	20	IDGD	
NC(=O)Cn1cc(C(=O)NNC(=O)c2ccc(CSc3ccc(Cl)cc3)cc2)nn1	742471006	ZMQVBBDRCVLJQD-UHFFFAOYSA-N	444.904	1.784	50	20	IDGD	
Cc1ccc(S(=O)(=O)c2ccc(NNC(=O)C(C)(C)NS(C)(=O)=O)cc2)cc1	743301048	QYOLXGHXMZHHMH-UHFFFAOYSA-N	425.532	1.599	50	20	IDGD	
C[C@H]1CN(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)CCN1C(=O)OC(C)(C)C	743589234	RHANKMBSPJGQKB-HNNXBMFYSA-N	447.540	1.375	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Cc2cn(C)c3ccccc23)cc1	743845350	KHAMNLJVEYUPGS-UHFFFAOYSA-N	428.514	1.497	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)c2cc3c(=O)n4ccccc4nc3n2C)c1	744577732	XJMRTKPMSFSRHT-UHFFFAOYSA-N	433.424	1.113	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	744620160	GEKJBBNZMNNQMT-UHFFFAOYSA-N	442.538	1.456	50	20	IDGD	
CN(C)CCOc1ccc(CCNC(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)cc1	745803811	WLSWLVBETYBRJD-UHFFFAOYSA-N	431.449	1.428	50	20	IDGD	
NC(=O)N[C@@H](CC(=O)NNC(=O)N1CCOCC1)c1cccc(Oc2ccccc2)c1	745992447	AHMFLOUULMPCBF-SFHVURJKSA-N	427.461	1.651	50	20	IDGD	
Cc1noc(C(F)(F)F)c1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	746093246	LMTHNLPRGBNBBR-UHFFFAOYSA-N	446.407	1.861	50	20	IDGD	
Cc1nc2c(c(O)nn2C)c(C)c1CCC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	746123418	PLJZGJSCXMJSKH-UHFFFAOYSA-N	445.501	1.088	50	20	IDGD	
Cc1nc(-c2cccnc2)nc(O)c1CCC(=O)NNC(=O)Cc1cn2ccccc2n1	746641710	SIBNFTBAGKTWJR-UHFFFAOYSA-N	431.456	1.523	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)c2cnn(CC(=O)NC3CCCCC3)c2)cc1	746679001	ZGMSOVRADXVXNO-UHFFFAOYSA-N	428.493	1.214	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(Cl)c(C(=O)NNc2cccc([N+](=O)[O-])c2)c1	748006525	SXEWCDOPSTWCRF-UHFFFAOYSA-N	428.854	1.930	50	20	IDGD	
O=C(CCC(=O)N1CCN(S(=O)(=O)c2ccccc2)CC1)NNc1cccc(F)c1	748090447	UOCDCMHDTOIWRE-UHFFFAOYSA-N	434.493	1.582	50	20	IDGD	
O=C(CCN1C(=O)[C@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O)NNc1ccc(Br)cc1F	748204009	YTGAGDPGMYBAKK-UXOAXIEHSA-N	426.242	1.584	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)CCn3cnc4ccccc43)cc2)CC1	748624452	WIPDUJRMWCWKFN-UHFFFAOYSA-N	442.545	1.506	50	20	IDGD	
CCn1c(NNC(=O)[C@H]2CCCN2C(=O)c2ccc3c(c2)OCO3)nc2ccccc2c1=O	749566992	BKLSFJCHHOWTIE-QGZVFWFLSA-N	449.467	1.893	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cc(Br)c[nH]2)cc1S(=O)(=O)N(C)C	750843736	NVBIGKRXYXGIPS-UHFFFAOYSA-N	445.295	1.111	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(OCC(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)C1	750956716	BIKSGUOJMLHAEP-UHFFFAOYSA-N	441.868	1.280	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCCn2c(O)nc3ccccc32)cc(OC)c1OC	751999293	ITDGFVJQTOAZBW-UHFFFAOYSA-N	429.433	1.412	50	20	IDGD	
CNS(=O)(=O)c1cccc(NC(=O)[C@@H](C)NC(=O)/C(C#N)=C/c2ccc(F)cc2)c1	752056098	CUOXTKVBRLAFIB-QQFZQELXSA-N	430.461	1.784	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2ccc(C)c(C(=O)O)c2C)cc(OC)c1OC	753770164	NUGFCNUXQBSCJC-UHFFFAOYSA-N	438.458	1.651	50	20	IDGD	
O=C(CN1CCOC[C@H]1C[C@H](O)c1cccs1)NNC(=O)c1cccc([N+](=O)[O-])c1	753858767	JAIPILLQJRLQLM-CVEARBPZSA-N	434.474	1.242	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2cc(Br)c[nH]2)cc1-n1nnnc1C	756318263	GKIKISULCJSMDZ-UHFFFAOYSA-N	435.242	1.536	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)Nc2ccc3c(c2)oc(=O)n3C)c2ccccc2c1=O	756361156	GBJKOFZUAJYHJD-UHFFFAOYSA-N	436.428	1.889	50	20	IDGD	
COc1ccc(S(=O)(=O)NC(C)(C)C)cc1NC(=O)NNC(=O)Cc1ccncc1	756671300	BMZFQXJBXQLEHD-UHFFFAOYSA-N	435.506	1.562	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)N[C@H]2CCN(C(=O)CCc3ccccc3)C2)cc1	757273333	KKIIQIKCUGOVDT-SFHVURJKSA-N	440.500	1.638	50	20	IDGD	
CCOC(=O)c1cnn2c(C(=O)NNC(=O)[C@@H](C)Oc3ccc(OCC)cc3)ccnc12	757987323	CETCITNWAKEXEO-CYBMUJFWSA-N	441.444	1.533	50	20	IDGD	
O=C(NNc1nc(O)c2ccccc2n1)C1CCN(S(=O)(=O)c2cccnc2)CC1	758310955	PCVQMXCOXQYXOD-UHFFFAOYSA-N	428.474	1.274	50	20	IDGD	
CCS(=O)(=O)N1CCC(CNC(=O)NNC(=O)CSc2ccc(Cl)cc2)CC1	758743213	MSJOCTXWDSXCQY-UHFFFAOYSA-N	448.998	1.824	50	20	IDGD	
O=C(Cn1c(COc2ccccc2)nc2ccccc21)NNC(=O)C(=O)Nc1ccccn1	758828061	PPFZCAKJBSXXTH-UHFFFAOYSA-N	444.451	1.796	50	20	IDGD	
C[C@@H](O)C[C@H](CNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)c1ccccc1	759610392	KZHPCUBHWLJHCT-VQIMIIECSA-N	426.521	1.578	50	20	IDGD	
CC(=O)N1CCc2cc(C(=O)OCC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)ccc21	760958495	LZVMCNDZNAFRMU-UHFFFAOYSA-N	426.385	1.122	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)CCNC(=O)[C@@H]2CCCN2C(=O)OC(C)(C)C)cc1	761040802	LVCAYJAUPQTOSN-KRWDZBQOSA-N	447.536	1.460	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)C(=O)NC1CC1)c1nc(-c2ccc(Br)cc2)no1	761792074	OOMIRLOTSLYAAA-MRVPVSSYSA-N	437.254	1.169	50	20	IDGD	
Cc1cnn(-c2ccc(NC(=O)C(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)cc2F)c1	763442133	LRTQJBUMAFYCOL-UHFFFAOYSA-N	426.364	1.628	50	20	IDGD	
CN1C(=O)CCc2cc(NC(=O)C(=O)NNC(=O)c3ccccc3Br)ccc21	763482134	DLMMIJRKGTYXBG-UHFFFAOYSA-N	445.273	1.758	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)N1CC2(CCC2)c2c(F)cccc21	763569700	AKBXPSGGLXZYCN-KRWDZBQOSA-N	425.416	1.581	50	20	IDGD	
CC(C)Cn1ncc(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1C(C)C	763574611	GLTHLVGRCAAFDZ-QGZVFWFLSA-N	429.477	1.588	50	20	IDGD	
COC(=O)c1cc(Cl)cc(NC(=O)C(=O)NNC(=O)COc2ccc(OC)cc2)c1	763660367	APBOGMVIUSQRBC-UHFFFAOYSA-N	435.820	1.300	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cc(N3CCOC3=O)ccc2C)cc1	763661891	QPCHHKQTBJLPJU-UHFFFAOYSA-N	442.428	1.125	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2ccccc2C(=O)N2CCCC2)c1	763668146	JYDCAQXJGDTXPR-UHFFFAOYSA-N	438.484	1.704	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(C)nn1Cc1ccccc1	763711368	IPJDUTHFQHPVRH-UHFFFAOYSA-N	435.484	1.967	50	20	IDGD	
CCn1cnnc1-c1cccc(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)c1	763746002	NQJLVSSSDGUOSU-UHFFFAOYSA-N	447.499	1.504	50	20	IDGD	
Cc1ccn(-c2ccccc2NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)n1	763864494	JWKUOEXSZAYAMC-AWEZNQCLSA-N	425.420	1.873	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1cccc(Cn2cncn2)c1	763873838	ZGXJQXMIDRCVDW-ZDUSSCGKSA-N	426.408	1.019	50	20	IDGD	
C[C@H]1Oc2ccc(NC(=O)C(=O)NNC(=O)CCSc3ccc(F)cc3)cc2NC1=O	763895024	JXRGUDDTEJJZOH-LLVKDONJSA-N	446.460	1.813	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3cccnc3N3CCOCC3)cc2C1	763943828	UWFREODBVYXJGZ-ZDUSSCGKSA-N	443.529	1.504	50	20	IDGD	
CCNC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2OC)cc1	764019593	QLSGNRVHXDMGRA-UHFFFAOYSA-N	448.863	1.263	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)c(F)cc1F	764126613	NIEKIBWQJSBBKO-UHFFFAOYSA-N	427.747	1.510	50	20	IDGD	
CCNC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)CCc2ccc(OC)cc2)c1	764131501	KDSQBTKJSBFQEC-UHFFFAOYSA-N	427.461	1.555	50	20	IDGD	
COC(=O)c1cc(C(C)C)ccc1NC(=O)C(=O)NNC(=O)[C@@H]1Cc2ccccc2O1	764169595	WZRPIYKKORWFFU-SFHVURJKSA-N	425.441	1.686	50	20	IDGD	
CCCc1c(NC(=O)C(=O)NNC(=O)c2cccc(C#N)c2)cnn1-c1cc(C)ccn1	764241584	BKBDPDJZMKCUFP-UHFFFAOYSA-N	431.456	1.800	50	20	IDGD	
O=C(NNC(=O)c1cc(F)ccc1Br)C(=O)Nc1ccccc1-n1cncn1	764271122	VOILIGZXEGSNIV-UHFFFAOYSA-N	447.224	1.569	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1)C(=O)Nc1ccnn1-c1ccncc1	764386800	CWOYONBOUCVCRF-UHFFFAOYSA-N	434.391	1.196	50	20	IDGD	
COC(=O)c1ccsc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	764389094	WWMMAXQLCKCTIM-UHFFFAOYSA-N	431.405	1.464	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)C(=O)Nc1ccc(O[C@@H]2CCOC2)cc1	764402059	XDMDVLHCDMHTPH-OAHLLOKOSA-N	431.470	1.438	50	20	IDGD	
COc1nccnc1NNC(=O)c1ccc(OS(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1	764482368	VLHLFBAMHSXMQG-UHFFFAOYSA-N	445.413	1.918	50	20	IDGD	
C[C@H](NS(=O)(=O)c1ccc(Cl)cc1)C(=O)NNC(=O)CSc1ccccc1O	765248985	YIVMPDUIAHJTBR-NSHDSACASA-N	443.934	1.652	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccc(C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)o1	765321659	FCWNOSMPKDXHBG-UHFFFAOYSA-N	446.526	1.422	50	20	IDGD	
CON(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)c1	765616973	CBWUYEOJNCVKAM-UHFFFAOYSA-N	447.448	1.473	50	20	IDGD	
C=CCNS(=O)(=O)c1cc(C(=O)NNc2ccccc2S(C)(=O)=O)ccc1F	766664195	ZAEGVYITJSUHCG-UHFFFAOYSA-N	427.479	1.450	50	20	IDGD	
CC/C=C(\C)C(=O)N1CSC[C@@H]1C(=O)OCC(=O)NNC(=O)Cc1ccccc1C	767335038	RHHFMNMCCSFERA-SXKJYUOZSA-N	433.530	1.486	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=S)Nc1ccccn1	768579332	YHOULJBRBHQNOE-UHFFFAOYSA-N	449.558	1.053	50	20	IDGD	
CCOC(=O)NNC(=O)Nc1ccc(CC(=O)N2CCN(c3ncccn3)CC2)cc1	769949225	LATCCMMABLHJSC-UHFFFAOYSA-N	427.465	1.151	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cccc(OCC(F)(F)F)c2)c1	770124315	GPKCEZWOGZOBGO-UHFFFAOYSA-N	445.419	1.953	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)NCCN1C(=O)[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O	770545094	KRXRIEVYEWUQDY-AVVLXZEZSA-N	446.891	1.245	50	20	IDGD	
CCOc1ccc(C(=O)CCC(=O)NNc2nc(O)c3cnn(C)c3n2)cc1OCC	770975386	WDNIHJPHHZAEJZ-UHFFFAOYSA-N	428.449	1.973	50	20	IDGD	
CCc1cccc(C)c1NC(=S)NNC(=O)C/N=C1/NS(=O)(=O)c2ccccc21	771242598	IPSUFIWAXOUGCJ-UHFFFAOYSA-N	431.543	1.614	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNS(=O)(=O)c1ccccc1C(F)(F)F	771604576	LKQDGPMPXPHWJJ-UHFFFAOYSA-N	435.811	1.985	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1cc(S(=O)(=O)N2CCCCC2)ccc1C	771876861	ZDRJKZDDRHPYHY-AWEZNQCLSA-N	425.507	1.272	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)c1sccc1S(=O)(=O)N1CCCC1	771969897	SNTJFGBZALENTE-GFCCVEGCSA-N	431.536	1.271	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)C[C@@H]1CSCCN1C(=O)OC(C)(C)C	772207097	LZNBHTHVJOWCDM-ZIAGYGMSSA-N	431.555	1.854	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)[C@H]1CC(=O)N(CCOc2ccccc2Cl)C1	772215759	IXBCMHZTPHPEMC-STQMWFEESA-N	425.869	1.056	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@H]2CC(=O)N(C3CCCCC3)C2)c2ccccc2c1=O	772553014	ZTVNBRXEXRDRID-AWEZNQCLSA-N	440.504	1.294	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)Nc1cnn(Cc2nnc3n2CCCC3)c1	772636835	XEZMSBLMNGAHHQ-UHFFFAOYSA-N	434.464	1.282	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C1=NN(c2ccccc2)[C@@H](C(N)=O)C1	772970395	BVMZEROGIHFZGH-SJKOYZFVSA-N	429.864	1.375	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1cccc(-c2ncc3n2CCCC3)c1	773544870	FPSUWZPCAVMBSD-CQSZACIVSA-N	429.477	1.024	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)N[C@@H](CS(C)(=O)=O)c1ccccc1	774281194	VGLRWIXQVAIVRS-INIZCTEOSA-N	435.502	1.580	50	20	IDGD	
Cc1nn([C@H]2CCS(=O)(=O)C2)c(C)c1NC(=O)NNc1cccc(S(C)(=O)=O)c1	776478859	MKNCVJKJBMIRTD-AWEZNQCLSA-N	441.535	1.412	50	20	IDGD	
CC(=O)N1CCN(Cc2ccccc2NC(=O)C(=O)NNc2cccc([N+](=O)[O-])c2)CC1	782117714	OZBPXQZTXBTRMJ-UHFFFAOYSA-N	440.460	1.341	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C(=O)Nc2ccccc2OC(F)(F)F)nc2ccccc21	782888223	UVCLWOOBSGLFOT-UHFFFAOYSA-N	435.362	1.801	50	20	IDGD	
O=C(NNc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1ccccc1CN1CCNC1=O	783291764	VANAIGKUNSWWML-UHFFFAOYSA-N	432.824	1.855	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2cccc(C[S@@](=O)c3ccccc3)c2)CCS(=O)(=O)C1	783426044	FOQMANKMKALNSD-AFJIDDCJSA-N	449.554	1.131	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)[C@@H]1C[C@H]2CC[C@H]1C2	783457082	IIJOLYMDXLBWNQ-JENIJYKNSA-N	435.546	1.224	50	20	IDGD	
O=C1C[C@H](Cc2ccc(NC(=O)C(=O)NNc3ccc(Br)cn3)cc2)C(=O)N1	784344820	BDFNQQCKHIOVNT-NSHDSACASA-N	446.261	1.131	50	20	IDGD	
Cn1c(=O)n(C)c2cc(NC(=O)C(=O)NNc3ccc(F)cc3Br)ccc21	784803603	QQFAGNXTFLHJCR-UHFFFAOYSA-N	436.241	1.860	50	20	IDGD	
COc1cccc(NNC(=O)C(=O)Nc2cc(S(=O)(=O)C(F)(F)F)ccc2OC)n1	784845763	HPGNLEBRGPJJCD-UHFFFAOYSA-N	448.379	1.474	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)c(Br)c1	785023392	HDDQSCPVTFYWPW-UHFFFAOYSA-N	437.206	1.771	50	20	IDGD	
CC(=O)N1CCN(Cc2ccccc2NC(=O)C(=O)NNc2cc(F)c(F)c(F)c2)CC1	785082528	AUEBHTXTTUKFOJ-UHFFFAOYSA-N	449.433	1.850	50	20	IDGD	
CNS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2cc(C(F)(F)F)ccc2F)cc1	785167350	UFZIVWUNEBVTND-UHFFFAOYSA-N	434.371	1.834	50	20	IDGD	
CC[C@]1(C)Oc2ccc(NC(=O)C(=O)NNC(=O)c3cncc(NC(C)=O)c3)cc2O1	785990246	DBDPRYIIXWDSBW-HXUWFJFHSA-N	427.417	1.337	50	20	IDGD	
C[C@@H]1[C@@H](C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)CCN1C(=O)OC(C)(C)C	786257414	VSWRALPQNSIVPD-DOMZBBRYSA-N	425.507	1.497	50	20	IDGD	
O=C(CCC(=O)Nc1ccc2nc(O)[nH]c2n1)NNC(=O)c1cccc(C(F)(F)F)c1	787885313	ANUPIVHAWRTPBU-UHFFFAOYSA-N	436.350	1.862	50	20	IDGD	
CCn1c(CCC(=O)NNC(=O)c2cccn2C)nc2cc(S(=O)(=O)N(C)C)ccc21	787928784	ZYKSGYYRRSWCIN-UHFFFAOYSA-N	446.533	1.039	50	20	IDGD	
O=C(CC/N=C1/NS(=O)(=O)c2ccccc21)NNc1nnc(-c2ccccn2)s1	788566912	UUAQQSWWOYLHKH-UHFFFAOYSA-N	429.487	1.172	50	20	IDGD	
COc1nc(Br)ccc1NC(=O)C(=O)NNC(=O)C(C)(C)c1ccccc1	789585855	JFOYTKHDKNZSDL-UHFFFAOYSA-N	435.278	1.916	50	20	IDGD	
CN(C)NC(=O)Nc1cccc(NC(=O)c2ccccc2S(=O)(=O)N2CCOCC2)c1	791271971	CPVRBWMDXBRSLQ-UHFFFAOYSA-N	447.517	1.558	50	20	IDGD	
COc1cccc(C2=NO[C@@H](C(=O)NNc3ccc(S(=O)(=O)NC4CC4)cc3)C2)c1	792125729	WFLBOVMOZLATLH-LJQANCHMSA-N	430.486	1.772	50	20	IDGD	
COc1ccc(OC)c(C2=NO[C@H](C(=O)NNC(=O)CNc3ccccc3OC)C2)c1	792628379	HVAMOUZWYRQMFV-IBGZPJMESA-N	428.445	1.465	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)[C@](C)(O)Cn1cc(C(F)(F)F)ccc1=O	792632896	GKSZZUZKJBFZQF-GOSISDBHSA-N	427.379	1.017	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1ccc(-n2ccc(C)n2)cc1	793053145	NVTXPDRPAAWLRC-UHFFFAOYSA-N	443.485	1.675	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Cc2c(C)nn(CC)c2C)c1	794195418	HRZMFHZFKUCXJW-UHFFFAOYSA-N	435.550	1.554	50	20	IDGD	
CNS(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)c2cccc3ccccc23)cc1C	794590934	WLJPLDIVFGWHLV-UHFFFAOYSA-N	433.511	1.680	50	20	IDGD	
Cc1cccc(C(=O)NNS(=O)(=O)c2cc3c(cc2Br)CCC(=O)N3)n1	794599826	PPBXBTRYKBWCKZ-UHFFFAOYSA-N	439.291	1.661	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNC(=O)C(=O)Nc1cccc2ccsc12	797369436	WYPFBLHUTXNTDT-UHFFFAOYSA-N	426.454	1.914	50	20	IDGD	
COc1coc(C(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)cc1=O	798842415	CKVUIDLLZSGUQO-UHFFFAOYSA-N	449.466	1.586	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNS(=O)(=O)c1cc(Cl)cc(C(N)=O)c1	799124226	NMVFZDMCQFYITM-UHFFFAOYSA-N	434.902	1.053	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)N[C@H]3CCC[C@@H]3CNS(C)(=O)=O)n[nH]2)cc1	800749093	RZDXYHBINFVXNR-CABCVRRESA-N	434.522	1.047	50	20	IDGD	
CS(=O)(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)NNC(=O)Nc1ccccc1	801984889	NFDKCDGVRDOEPS-KRWDZBQOSA-N	448.501	1.569	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=O)Nc2cc(F)cc(F)c2)n(C)c1	802003300	LOVPTRADCGUYIT-UHFFFAOYSA-N	429.449	1.800	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](OCC(=O)NNC(=O)Nc2ccc3c(c2)OCO3)C1	802104952	MZPMWOFFZPAMLP-CQSZACIVSA-N	436.465	1.984	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)c2cnn(CCN(C)C)c2-c2ccccc2)C[C@@H](C)O1	806340026	MPDUEORQWMTQKI-QZTJIDSGSA-N	442.564	1.372	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)NC2C[C@@H]3CC[C@H](C2)N3CC(=O)N(C)C)c2ccccc2n1	807514714	NFTXIMSSVQLMLM-ALOPSCKCSA-N	438.532	1.571	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)NCc1ccncc1OC[C@@H]1CCOC1	807616972	ZCBHUJNIVDRTLG-OAHLLOKOSA-N	430.461	1.415	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C[C@H]2CN(C(=O)OC(C)(C)C)CCO2)cc1	812730955	HFDBUURZCMOXKX-HNNXBMFYSA-N	442.538	1.406	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)N[C@H]1CC(=O)N(c2ccccc2F)C1	812930326	LCOANZAZVANQKZ-ZDUSSCGKSA-N	437.472	1.566	50	20	IDGD	
Cc1noc2nc(C3CC3)cc(C(=O)NNC(=O)c3ccc(Cl)c(S(N)(=O)=O)c3)c12	813537613	VKNPAARAOQZDAP-UHFFFAOYSA-N	449.876	1.784	50	20	IDGD	
NS(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2ccc(Br)s2)s1	813542735	HOEWYRVJJWGWGC-UHFFFAOYSA-N	439.338	1.364	50	20	IDGD	
CC(C)CC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)NNC(=O)Nc1ccc(OC(F)F)cc1	813575940	HVFVPUOKCIQAFB-HNNXBMFYSA-N	438.435	1.937	50	20	IDGD	
COCCN(C)NC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(Br)s2)C1	816562137	ABVIGVCZDIVOTR-LLVKDONJSA-N	440.385	1.521	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1ccc(O)c(C(=O)NNC(=O)[C@H]2CCCO2)c1	817215925	AVMHYDHCBOHVTD-QGZVFWFLSA-N	435.458	1.142	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)[C@H]2CCCN2c2ncnc3ccccc23)c2ccccc2c1=O	832810471	DFTQSHWFKAMQPK-GOSISDBHSA-N	443.467	1.307	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)CNS(=O)(=O)c2ccc3ccccc3c2)c(C)c1	913164889	XEOCJSPEBGQYRX-UHFFFAOYSA-N	440.525	1.994	50	20	IDGD	
Cc1ccc(Cl)cc1S(=O)(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	914688938	OEMRPEMODXWKSI-UHFFFAOYSA-N	438.314	1.573	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@@H](Cc2ccc(F)cc2)n2nnnc2C)cc1OC	915685658	IMGUXYMOKKNXQD-MRXNPFEDSA-N	428.424	1.383	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NCc1ccc(C(=O)N2CCOCC2)cc1	916249029	VBAZCIRLUIZGQG-OAHLLOKOSA-N	444.463	1.596	50	20	IDGD	
O=C(CCn1nnc2ccccc2c1=O)NNC(=O)c1ccc(F)cc1Br	918340166	DHWVBFJJZAYELU-UHFFFAOYSA-N	434.225	1.544	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)CCc2nc(O)c3cnn(-c4ccccc4)c3n2)c1O	919755746	ZBKRQVGGPUOIME-UHFFFAOYSA-N	448.439	1.629	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)CSCc2cc(=O)n3ccsc3n2)o1	920248333	ACHCTOYPQPUIMS-UHFFFAOYSA-N	449.558	1.885	50	20	IDGD	
Cc1cc(COc2ccc(C(=O)NNC(=O)C(=O)NC(C)C)cc2Br)no1	921304594	XRYNWIKBYATFIR-UHFFFAOYSA-N	439.266	1.610	50	20	IDGD	
C[C@@H](c1ccncc1)N1CCC(NC(=O)NNC(=O)c2nnc(O)c3ccccc23)CC1	1116345847	AGBHXHVAYWPPMC-AWEZNQCLSA-N	435.488	1.900	50	20	IDGD	
CCC(CC)C(=O)N1CCC(NC(=O)NNC(=O)c2nnc(O)c3ccccc23)CC1	1319301703	NVRSKSCLFCIQOQ-UHFFFAOYSA-N	428.493	1.707	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)[C@@H]3CC34CCS(=O)(=O)CC4)n[nH]2)cc1OC	1324892352	HBQDOUVZJSGCPW-ZDUSSCGKSA-N	448.501	1.070	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)CCc3ccc(OC)cc3F)C2)C1	1778286556	BYLXHKDKBTXMJR-LAUBAEHRSA-N	442.915	1.851	50	20	IDGD	
O=C(c1cccn2cncc12)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1778686536	REUPGDXPCXPNMZ-YOEHRIQHSA-N	425.258	1.468	50	20	IDGD	
O=C(/C=N/O[C@@H]1CCCCO1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1779104693	FXSOBVGMPJWPFR-AUGFZUQUSA-N	436.278	1.036	50	20	IDGD	
C[C@@H](C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CO[Si](C)(C)C)C2)N1C[C@H]2C[C@H]2C1	1779249917	ILCLUICHKUIAFM-FEEZOJJESA-N	437.657	1.692	50	20	IDGD	
Cc1cnc2c(C(=O)N3CCO[C@]4(CCN(C(=O)CO[Si](C)(C)C)C4)C3)cnn2c1	1779296792	FRXOBUWVYNUOBC-FQEVSTJZSA-N	431.569	1.333	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(Cl)ncn3)C2)C1	1779819356	XOGIVGWVFZGSCF-ZBEGNZNMSA-N	431.718	1.747	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)c3cccc(C#N)c3)C2)C1	1780597850	VHPIKECMKRQONE-LRULAXNGSA-N	448.483	1.136	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2)c1ccc(O)c([N+](=O)[O-])c1	1780873097	FMFUMNUVTHRJDU-FRQCXROJSA-N	441.868	1.028	50	20	IDGD	
CCOc1c(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](Cl)CC)C3)C2)cnc2c1cnn2C	1781217446	IPBGAYNGXJYOIH-IIBYNOLFSA-N	449.939	1.828	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)c3nccc4nc[nH]c34)CCO2)C1	1781227388	KUYRQFDWTLBVSZ-QZTJIDSGSA-N	426.304	1.638	50	20	IDGD	
O=C([C@H](F)Br)N1CC[C@]2(C1)CN(C(=O)C1(Br)CC1)CCO2	1781332936	KOMSUEAZWCLYTQ-CABZTGNLSA-N	428.096	1.434	50	20	IDGD	
O=C1Cc2cccc(C(=O)N3CCO[C@]4(CCN(C(=O)[C@H](F)Br)C4)C3)c2N1	1781333047	LGTVWBXWXAIPOW-YJBOKZPZSA-N	440.269	1.315	50	20	IDGD	
O=C(c1c(F)ccc(O)c1F)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1781932394	NKLKZXDWZLZSCI-XJKSGUPXSA-N	437.212	1.804	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C[C@@H](N)c1cccnc1)C2	1782170713	UTDFQKWNUXDVLN-NEYJZJCJSA-N	438.956	1.239	50	20	IDGD	
Cn1cccc1C(=O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@](C)(Cl)CCl)C2	1782611064	XVOHJQNKKXUGTM-CDHQVMDDSA-N	444.359	1.958	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc4nccn4c3)CCO2)C1	1783347132	ACFQCORSYXBCMV-BEFAXECRSA-N	435.322	1.951	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)CSCc3[nH]cnc3C)CCO2)C1	1783877922	RZRKWQDEWXZAOR-KDOFPFPSSA-N	430.958	1.035	50	20	IDGD	
CN(C)c1cccc(OCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]3C2)c1	1787443743	BYFCWRQRXSDZEN-UHEFJODHSA-N	427.904	1.646	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C3CCN(c4ccccn4)CC3)C[C@@H]21)[C@H](F)Cl	1787449712	VTDBERYYYQMQML-DWRORGKVSA-N	438.931	1.812	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)c1ccn2nccc2c1	1788444627	LRUDQXXNEFPWPI-XIRDDKMYSA-N	435.322	1.713	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccn4ccnc34)C[C@@H]21	1788764231	FILYXNIFLNFUBM-SZMVWBNQSA-N	430.581	1.779	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)c1cc(Cl)cc(Cl)n1	1789047415	TXIBGVWASJDQDK-RETIQXCHSA-N	436.723	1.581	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3cnccn3)C[C@@H]21	1789872975	MVXVCIRANZNPAQ-FJXLLPKBSA-N	429.348	1.625	50	20	IDGD	
Cc1nccnc1C(=O)Nc1ccc(C2(NC(=O)c3cnccc3C(=O)NN)CCC2)cc1	1789896727	PSCXLJSAFIXXLT-UHFFFAOYSA-N	445.483	1.845	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccn(C(F)F)n3)C[C@@H]21)[C@H](F)Br	1789924433	DAIFMFHURIWKIE-QSFUFRPTSA-N	439.232	1.562	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cnccn3)C[C@@H]21	1790958309	OYHWUJDDNUCQQD-HNKHHVNMSA-N	425.327	1.172	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccnc(OC)c3)C[C@@H]21	1790960697	QFDILICZZXHRPK-VGWMRTNUSA-N	440.338	1.857	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnn4c3CCC4)C[C@@H]21	1790964645	VXDNCCRXPVFXLO-QEWYBTABSA-N	439.354	1.596	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CC(c4ccccc4)=NO3)C[C@@H]21	1791249810	QJROEWDLJSDWEE-GCLMUHHRSA-N	449.935	1.413	50	20	IDGD	
C[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]2C1	1791292277	MPXRIHKKESLBCC-CYDGBPFRSA-N	438.352	1.683	50	20	IDGD	
O=C(CCc1cnccn1)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1	1791895926	OLEOMZMPQDDENF-UHFFFAOYSA-N	444.300	1.537	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3cc(F)ccc3F)[C@H]2C1	1792136489	ITSKGMONTJOHED-RPZXMPESSA-N	430.879	1.741	50	20	IDGD	
C[C@@H](NC(=O)c1ccccc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(C)(C)CCl	1792786829	XHOKNLBUCOLKSR-NRSFXHEJSA-N	435.952	1.660	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nc(-c3ccccc3)ns1)C2)[C@@H](O)CCl	1792977140	RJJZMKSQVXYUBS-XGUBFFRZSA-N	436.921	1.008	50	20	IDGD	
COc1ncccc1CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2	1794094396	GIZVBBGNNJHGFO-OCVGTWLNSA-N	444.301	1.303	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)c1cc(Cl)cc(Cl)n1	1796191843	FIZNULQWESTCPT-MUJYYYPQSA-N	448.115	1.634	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cn1cc(Cl)cn1)C2	1796892198	MFTFCUPCRBFOBV-XMOXNHLCSA-N	445.911	1.309	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2ccccc2o1	1796969136	NKHVMGZRGXCWSY-VPTLXERWSA-N	428.489	1.009	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2cccn2cn1	1797101928	JTYBGKMVKKSINK-IARIHHJXSA-N	435.322	1.711	50	20	IDGD	
CCn1nc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C3)cc1C	1798920654	WXLZRRNBWHXQIU-GSWMANSFSA-N	439.520	1.597	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CC(C)(C)C(=O)OC(C)(C)C	1799042468	UNSVKFKRGPMJMO-IVSAIRAKSA-N	446.972	1.588	50	20	IDGD	
Cc1c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](F)Br)C3)cn2[nH]cnc(=O)c12	1799155095	ZZGGDBHGRKFRMY-FBKDDSFISA-N	440.273	1.273	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1Cc3ccccc3C1)C2)[C@@H](F)Br	1799349657	ALXWLBANHAOFFS-YYIAUSFCSA-N	425.298	1.682	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(NC(=O)C2CC2)cc1	1799441901	AFBRPKJWVQSCIS-NBMJBFSESA-N	449.935	1.492	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccccc1C(N)=O	1799622662	JELIMXVHYNZPKB-JFILPPLUSA-N	438.322	1.020	50	20	IDGD	
Cc1c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](F)Br)cn2[nH]cnc(=O)c12	1800161402	VROSYIGQTUOCQK-MIJXAVMKSA-N	440.273	1.273	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc2c(c1)C(=O)CC2)c1ccc(B(O)O)cc1	1800968774	GOHJAXSSAPHBNF-ACDBMABISA-N	432.285	1.061	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/c1ccc(OC)cc1F)C2	1800981654	QARPSNAQWVEXCJ-KQLBXHFXSA-N	440.899	1.691	50	20	IDGD	
CS(=O)(=O)CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C(C#N)=C/c1ccc(F)cc1F	1801437534	OGNMPBYUFOJTHK-RMWXTBGQSA-N	437.468	1.555	50	20	IDGD	
COc1cccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)Br)C3)c1C	1801652928	KRGIKRNGKKQDFO-VWPFQQQWSA-N	425.323	1.990	50	20	IDGD	
COc1cccc(/C=C/C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)c1	1801846893	AKXKFYSYGSIPNX-KXXXJKOBSA-N	449.511	1.659	50	20	IDGD	
N#Cc1ccc(CC(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)cc1	1803137455	PXZYDCIBKASCSY-DYXWJJEUSA-N	426.904	1.801	50	20	IDGD	
O=C([C@H](O)CCl)N1CCCC2(CCN(C(=O)[C@H]3ON=C(c4ccccc4)O3)CC2)C1	1805522151	FXPWVCCSFIZPMI-OXQOHEQNSA-N	435.908	1.552	50	20	IDGD	
CC(C)=CCCC(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1807373142	NGWKONIVGBMFBA-OFNKIYASSA-N	435.333	1.827	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)c1cccc2nc[nH]c12	1808002271	TVGFUIANRILYRT-YJLNNSPDSA-N	427.892	1.877	50	20	IDGD	
O=C1CC[C@H](C(=O)N2CC[C@H](CNC(=O)[C@H](F)Br)[C@H]2c2cccnc2)N1	1808662284	XHPZADGMAVQGGP-GBOPCIDUSA-N	427.274	1.057	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)N1CC[C@H](CNC(=O)[C@H](F)Br)[C@@H]1c1cccnc1	1808668955	TXSYSRNWLMFYFQ-OYNZBZHQSA-N	441.301	1.469	50	20	IDGD	
Nc1n[nH]c(CCC(=O)NC[C@H]2CCN(C(=O)C(Cl)Cl)[C@@H]2c2cccnc2)n1	1810156827	LCKQGYIEELYZLT-BXUZGUMPSA-N	426.308	1.224	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1)c1ccnnc1O	1811222537	MOJPWHBDSCOFMI-CZUORRHYSA-N	434.294	1.682	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H](CNC(=O)c2c[nH]c(=O)cn2)[C@H]1c1cccnc1	1811450281	SHKFFRMDCDMRMF-DNVCBOLYSA-N	429.553	1.336	50	20	IDGD	
C=CCSCC(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1813069716	AWUOXAJIBFNAQO-UTKZUKDTSA-N	433.578	1.380	50	20	IDGD	
Cc1ncsc1C(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1813070379	IGWSFPZQOXVWNT-LPHOPBHVSA-N	444.561	1.539	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1)c1cccn2c(O)nnc12	1817964398	ANMZOPLKAOJKBY-OLZOCXBDSA-N	433.856	1.064	50	20	IDGD	
Cc1cc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)cc(O)n1	1818051797	WCZDFHKFKPTDCM-SFHVURJKSA-N	449.276	1.118	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cn4ncccc4n3)sc2C1	1818466503	QVTUIZOGXRJQJW-GHMZBOCLSA-N	434.909	1.665	50	20	IDGD	
C[Si](C)(C)OCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(=O)n1O)CC2	1820160872	IICOSMHCTXOQTL-LLVKDONJSA-N	436.566	1.619	50	20	IDGD	
C[C@H](Br)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)C[C@](C)(O)CC(=O)O)[nH]n1	1822191964	OVESZRZLEAQOMC-ZMNCSTGQSA-N	445.314	1.801	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cncc(O)c2)[nH]n1	1822416541	HBOXNCIYQKDVDJ-MRXNPFEDSA-N	429.481	1.189	50	20	IDGD	
O=C(O)CSCC(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1	1823014247	RBLAHTDEJFUTHN-KSBSHMNSSA-N	440.316	1.563	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)C2CC(=O)C2)n[nH]1	1823405976	KOQZVDGYCYWQGH-KZKMUKRCSA-N	439.476	1.515	50	20	IDGD	
CC(C)(C)[C@@H](O)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1	1824133013	JHWMXNKJEXQKQJ-PMACEKPBSA-N	430.354	1.007	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](C)Br)sc2C1	1825642338	PRIJMAKBFCEZHU-BBBLOLIVSA-N	429.340	1.529	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(OC)nn1)CC2	1826003791	SUXXGAWTSKZGGE-ZJUUUORDSA-N	425.898	1.421	50	20	IDGD	
N[C@@H](Cc1cscn1)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H](O)CCl)CC1	1827546022	WSCPCGHGSXKTJD-ULQDDVLXSA-N	428.986	1.232	50	20	IDGD	
O=C1NCCn2nc(C(=O)N3CCC([C@H]4CCCCN4C(=O)[C@@H](F)Cl)CC3)cc21	1827607143	QWVHPTZAQNARDH-GDBMZVCRSA-N	425.892	1.394	50	20	IDGD	
CC(=O)Nc1cc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)[C@H](O)CCl)CC2)ccn1	1827975559	SJCLPLZTNSNHOB-ZWKOTPCHSA-N	436.940	1.873	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)on1	1830537795	OVNVHJFBWXSEAH-PXAZEXFGSA-N	430.299	1.084	50	20	IDGD	
Cc1cc2[nH]c(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)[C@H](O)CCl)CCO4)cc2s1	1830736613	VFJNKOCYKQWNKC-DNVCBOLYSA-N	441.937	1.208	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnn4cc(C)cnc34)C2)C1	1831651419	PJNKCRZVNVTOPL-DYESRHJHSA-N	449.939	1.515	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H](N)Cc2cscn2)CC1	1831833108	LEDPZWBEDSBNNR-BZSNNMDCSA-N	443.013	1.886	50	20	IDGD	
O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)C[C@H]1CCCCO1)CCO2	1832340988	PJBSMHMKNIAYFY-CRAIPNDOSA-N	433.343	1.187	50	20	IDGD	
C[C@@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)c3nccn3C)CC2)CC1	1833262226	KSPKGVHKHLZOLO-AWEZNQCLSA-N	440.386	1.636	50	20	IDGD	
CC(C)N[C@@H](C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)CCl)CC2)CC1)C(C)C	1833310804	SYMITLZXSUUPLY-RTBURBONSA-N	431.021	1.180	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3c(F)cncc3F)CC2)CC1)[C@@H](O)CCl	1833312740	ZOONQELOYLNPTG-INIZCTEOSA-N	430.883	1.145	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccn(C(C)(C)C)n3)CCO2)C1	1833582696	MHOPJDPJUUHCGD-OAQYLSRUSA-N	440.972	1.973	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccns3)CCO2)C1	1833769979	ATTRIXPCOPAHSW-LRDDRELGSA-N	432.340	1.244	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3ncc[nH]3)CC2)CC1	1834034357	SYENWZIEYTZHQM-OAHLLOKOSA-N	426.359	1.768	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnc(C)cn3)CCO2)C1	1834087132	BYTKNYYEWOHWPB-KSSFIOAISA-N	441.326	1.029	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)Cc3nnc(C)s3)CC2)CC1	1834854129	QEBBSNLSQUIUBV-MRXNPFEDSA-N	444.001	1.214	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)N2CCC(N3CCC(NC(=O)[C@H](F)Cl)CC3)CC2)n1	1835078772	WIMUJYDAAHZFOJ-SFHVURJKSA-N	439.919	1.760	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3ccncn3)CC2)CC1	1835146920	OVPPCGPFOBPKSQ-MRXNPFEDSA-N	438.370	1.835	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3ccc4nonc4c3)CC2)CC1	1835322807	XFGDTWXZMQRWER-KRWDZBQOSA-N	449.939	1.662	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](N)c1cccc(Cl)c1)CCO2	1835733289	LQOLPIRQAIOTRF-SQGPQFPESA-N	444.359	1.814	50	20	IDGD	
C=C[C@@H](O)C(C)(C)C(=O)N1CCC(N2CCC(NC(=O)CO[Si](C)(C)C)CC2)CC1	1835837005	JRIACYFFIGWNQU-LJQANCHMSA-N	439.673	1.983	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)CCc3cccnc3)C2)C1	1837711399	GNHJLELNRAADJI-NRFANRHFSA-N	435.597	1.322	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)CCC(F)(F)F)C2)C1	1837711809	REFWWECHOFXFEN-INIZCTEOSA-N	426.508	1.637	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC(OC2CCN(C(=O)[C@@H](N)c3ccccn3)CC2)CC1	1837873475	NTDMAXRDFXGYBM-NRFANRHFSA-N	448.640	1.932	50	20	IDGD	
Cc1noc(C)c1CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2	1839150655	SSVKCNULSYXGIQ-RTBURBONSA-N	448.347	1.527	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnc4ccc(F)cn34)CCO2)C1	1839592546	MHIBAJHAYPGYFB-QRWLVFNGSA-N	438.887	1.561	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ocnc3C)C2)C1	1839963849	YKSYXMRJUMOULV-CXAGYDPISA-N	430.299	1.227	50	20	IDGD	
Cc1nc(C)c(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)s1	1840031517	SHQZYQIRXXKYMN-APPDUMDISA-N	446.367	1.613	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC2(CCCN2C(=O)C(F)(F)C(F)(F)C(=O)O)C1	1841828007	UBQWUJGHADIUOZ-MRVPVSSYSA-N	433.196	1.719	50	20	IDGD	
CCn1c(-n2nc(C(=O)N3CCCC34CN(C(=O)[C@@H](F)Cl)C4)cc2C)cccc1=O	1843133695	YCVCGUMGOGMYNO-QGZVFWFLSA-N	435.887	1.714	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC2(CCCN2C(=O)c2cnc(O)nc2O)C1	1843353324	CZPPWLYYGHKLII-AWNIVKPZSA-N	441.394	1.590	50	20	IDGD	
CC(C)(C)OC(=O)N1CC2(CC[C@H](C(=O)N3CC4(CCCN4C(=O)[C@H](F)Cl)C3)O2)C1	1843361484	KFIFKXHHKTXPCY-KGLIPLIRSA-N	445.919	1.893	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)c2cc(Br)cs2)C1	1843445564	CANIRZIRCGBIQF-UHFFFAOYSA-N	449.135	1.321	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)N2CCCC23CN(C(=O)[C@H](O)CCl)C3)CC1	1843931120	LJMIVWJOFLSRAW-JKSUJKDBSA-N	443.972	1.827	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)Cc1ccncc1)C2	1844692972	IFDUVOXTDMGXBT-UHFFFAOYSA-N	438.440	1.975	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)N1CCCC12CN(C(=O)c1cccc(B(O)O)c1)C2	1844982813	OCHLNMXVAMEYDV-UHFFFAOYSA-N	428.681	1.159	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCCC12CN(C(=O)[C@H](O)CNC(=O)OC(C)(C)C)C2	1846068676	HPDSAUKVRRNJAQ-CHWSQXEVSA-N	448.358	1.249	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCCC12CN(C(=O)c1cc3n(n1)CCCN(C)C3)C2	1846072301	QYZMWTNYXWRUSR-OAHLLOKOSA-N	438.370	1.709	50	20	IDGD	
CC(=O)N[C@@H](Cc1cccc(F)c1)C(=O)N1CC2(CCCN2C(=O)C(Cl)Cl)C1	1846389511	WWJZEUGDIFEHOW-HNNXBMFYSA-N	430.307	1.880	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NC[C@@H](c1cccs1)N(C)C	9755638	FIYKNCKUFOHZOI-ZDUSSCGKSA-N	438.579	1.597	50	20	IDGD	
CC(C)NC(=O)Nc1ccccc1C(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	16467062	JKNCVAVAEZOCGZ-UHFFFAOYSA-N	443.416	1.743	50	20	IDGD	
CC(C)[C@@H](NS(=O)(=O)c1ccc2ccccc2c1)C(=O)NNC(=O)c1ccncc1	725870021	YJHWCSMQAMAGTM-LJQANCHMSA-N	426.498	1.999	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)NCc2cccc(C(=O)NCCN(C)C)c2)cc1	727603843	GTDKTPQBZAPQIS-UHFFFAOYSA-N	443.573	1.909	50	20	IDGD	
CN(C)N(C(=O)c1cc(F)ccc1I)[C@H]1CCS(=O)(=O)C1	728161417	IILSPKOKMIHEAA-JTQLQIEISA-N	426.251	1.536	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)N[C@@H]2CCN(c3ccc(Br)cc3)C2)n1	728754970	GDEBCVGVILNJLS-OAHLLOKOSA-N	435.326	1.872	50	20	IDGD	
Cc1cc(C)n(-c2ccc(CC(=O)NNC(=O)C3CCN(c4ncccn4)CC3)cc2)n1	728845542	LYGKYJXDOLKHRY-UHFFFAOYSA-N	433.516	1.886	50	20	IDGD	
C[C@H](CC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)S(=O)(=O)c1ccc(F)cc1	729182030	CGOBPDWLJPKMQA-CQSZACIVSA-N	449.508	1.232	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)c1ccc(Cl)c(NC(=O)c2cccs2)c1	729275995	UVJHFGYWNBZCCW-SECBINFHSA-N	444.922	1.353	50	20	IDGD	
CCS(=O)(=O)N[C@@H](CCSC)C(=O)NNC(=O)c1ccc(Br)s1	730514948	FXXWABVMSRATEY-QMMMGPOBSA-N	444.398	1.333	50	20	IDGD	
Cc1cc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)COc3ccccc3O)c2)no1	730836672	UYMSYQNEURASPU-UHFFFAOYSA-N	446.441	1.329	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)nnn1-c1cccc2c1CCN(C)C2	731457931	RTYZOKVXLXRTII-UHFFFAOYSA-N	435.444	1.547	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)NCCS(=O)(=O)NCC1CCC1	731760913	HNRFAFNKSKARGZ-HNNXBMFYSA-N	448.545	1.657	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)CNC(=O)N3CCc4ccccc4C3)n[nH]2)cc1	732272234	OOZMLPXWLOUBBM-UHFFFAOYSA-N	432.484	1.914	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NC[C@@H](C)N(C)Cc2ccccc2)c2ccccc2c1=O	732469654	JQMDUFQTSOXWEZ-MRXNPFEDSA-N	436.516	1.881	50	20	IDGD	
COC(=O)c1cc(OC(=O)C2CCN(S(=O)(=O)c3cccnc3)CC2)ccc1[N+](=O)[O-]	732653146	HMDSGLZXQZJGAM-UHFFFAOYSA-N	449.441	1.783	50	20	IDGD	
CCC(CC)N1C[C@@H](C(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)CC1=O	734825341	ZAAIYLLEQKHVGN-AWEZNQCLSA-N	439.557	1.753	50	20	IDGD	
O=C(NNC(=S)Nc1ccc2c(c1)OCO2)c1cccc(S(=O)(=O)N2CCCC2)c1	735233625	JOGCLQCOWCRPOX-UHFFFAOYSA-N	448.526	1.831	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)COc1ccccc1Cc1ccccc1)CN1CCOCC1	739050231	UHZUKHFSHONQIL-IBGZPJMESA-N	440.544	1.955	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)c2cn([C@@H]3CCS(=O)(=O)C3)nc2C(C)C)cc1C	742472934	YKTFCJGTMBOCCK-MRXNPFEDSA-N	448.545	1.823	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NNc2ccc(Cl)nc2)o1	743816885	WPIVTDCNGGVGGT-LBPRGKRZSA-N	442.881	1.801	50	20	IDGD	
O=C(COC(=O)c1cc(N2CCOC2=O)ccc1F)NNC(=O)c1ccc([N+](=O)[O-])cc1	745131892	ZOZUIBXKCBEKIO-UHFFFAOYSA-N	446.347	1.309	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)c1cccc(-n2cccn2)c1	745928072	TWYDHGSKFCBAGP-MRXNPFEDSA-N	434.504	1.970	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)c3cc(CO)on3)c2)cc1	748014822	OGWJEAZJWNKENK-UHFFFAOYSA-N	446.441	1.051	50	20	IDGD	
O=C(COC(=O)c1c(F)c(F)cc(F)c1F)NNC(=O)[C@H]1COc2ccccc2O1	748218751	JYHOSWWPINAOAN-GFCCVEGCSA-N	428.294	1.387	50	20	IDGD	
Cc1c(Br)cc(S(=O)(=O)NNC(=O)c2cccc(C#N)c2)cc1C(=O)O	748644212	VDCVNJIPBXNYRL-UHFFFAOYSA-N	438.259	1.951	50	20	IDGD	
CCn1cc(S(=O)(=O)NNC(=O)c2nn(CCC(C)C)c(=O)c3ccccc23)cn1	748790801	NNLMRLCMXQSVNG-UHFFFAOYSA-N	432.506	1.282	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(\C#N)C(=O)OCC(=O)N2CCCC[C@@H]2C(N)=O)c1C	749010244	JSVHFVMACDKXBU-CCYNLUHQSA-N	430.505	1.629	50	20	IDGD	
O=C(NNc1nc(Br)cn2ccnc12)C1CCN(C(=O)N2CCCC2)CC1	750243731	OEOAPIRCJAMKPH-UHFFFAOYSA-N	436.314	1.863	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(NC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)C1	751794589	JYEXBYIZLUEVRK-UHFFFAOYSA-N	427.483	1.045	50	20	IDGD	
CCn1c(CCC(=O)NNC(=O)c2ccc(C)o2)nc2cc(S(=O)(=O)N(C)C)ccc21	752522862	GCAJSZFRGAOHMG-UHFFFAOYSA-N	447.517	1.602	50	20	IDGD	
C#CCOCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccc(OC)cc2)c1	753383551	SKJKCXFMLIKDOF-UHFFFAOYSA-N	446.485	1.090	50	20	IDGD	
O=C(COC(=O)Cc1cc(Cl)cc2c1OCC2)NNC(=O)c1cccc([N+](=O)[O-])c1	755094101	SQDQMZUAKMHPFX-UHFFFAOYSA-N	433.804	1.730	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCO[C@H](CCc3ccccc3)C2)cc1OC	755260805	FRDIKUVARHTFDE-LJQANCHMSA-N	427.501	1.798	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(NC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)c1	755365930	GDTWVGGGXYVXKR-UHFFFAOYSA-N	444.473	1.295	50	20	IDGD	
Cc1ccc(F)c(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c1	755411179	RXGVPWGKWBHLLI-UHFFFAOYSA-N	436.465	1.622	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2ccc(NC(=O)NNC(=O)Cc3cccnc3)cc2)C[C@H](C)O1	755425015	YHVIPKBSFHAVPE-GJZGRUSLSA-N	447.517	1.275	50	20	IDGD	
CCNC(=O)c1ccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c(C)c1	756084460	JVVKUIKQJJKVAW-UHFFFAOYSA-N	447.517	1.462	50	20	IDGD	
COc1ccc(C(=O)N2CCN(C)CC2)cc1NC(=O)NNC(=O)c1ccc(C#N)cc1	756249060	SSGDHJMRDFSMHZ-UHFFFAOYSA-N	436.472	1.421	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)NNC(=O)COc2ccc(C#N)cc2)cc1C	756516174	RDUMRKCKWOXGPW-UHFFFAOYSA-N	431.474	1.860	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccnc(OCC(F)(F)F)c2)c1	757924802	AQKOFQFQAKUFAV-UHFFFAOYSA-N	432.380	1.893	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)N[C@@H]2CN(C(=O)OC(C)(C)C)C[C@H]2C#N)cc1C	758752104	LVWQSDMTOXWFQN-GDBMZVCRSA-N	444.492	1.331	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)NCc1ccc(S(C)(=O)=O)c(Cl)c1	758856915	YSVHEGDVLYLDAH-UHFFFAOYSA-N	441.893	1.662	50	20	IDGD	
CCNS(=O)(=O)c1ccc(CC(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)cc1	759852717	KFODFTUWIICUQP-UHFFFAOYSA-N	447.521	1.271	50	20	IDGD	
CCCN(CC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)C[C@H]1COc2ccccc2O1	762260722	ZMWNMXUJVYHVMI-KRWDZBQOSA-N	428.445	1.908	50	20	IDGD	
CCC(=O)N1CC[C@@H](NC(=O)NNC(=O)COc2ccc(OCc3ccccc3)cc2)C1	762380108	VPZYOEGRPYJRJO-GOSISDBHSA-N	440.500	1.986	50	20	IDGD	
O=C(NNc1nccc(N2CCOCC2)n1)[C@@H]1CCCN(C(=O)c2ccc(Cl)cc2)C1	762855361	NFJXTKJGTPCKBW-MRXNPFEDSA-N	444.923	1.962	50	20	IDGD	
Cc1c(C(=O)O)cc(Cl)cc1S(=O)(=O)NNC(=O)c1ccc2c(c1)OCCO2	763417639	YHYPJSZVUWSAMI-UHFFFAOYSA-N	426.834	1.741	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)C(=O)Nc1cccn(Cc2ccccc2)c1=O	763558975	PNMFAFDVBZEDAP-UHFFFAOYSA-N	434.408	1.025	50	20	IDGD	
CCS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2cc(C)cc(C)c2)cc1	763647769	PEMGENGYOSQPSC-UHFFFAOYSA-N	433.486	1.262	50	20	IDGD	
COc1ccc(OC(F)F)c(NC(=O)C(=O)NNC(=O)COc2ccccc2F)c1	763678410	FFCZNYTYEJBZPB-UHFFFAOYSA-N	427.335	1.601	50	20	IDGD	
CCOC(=O)/C=C\c1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2F)cc1	763682071	WKXYKVPPIDEBDQ-XFXZXTDPSA-N	429.404	1.567	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)C(=O)Nc1cnn(-c2ccccc2Cl)c1	763683142	UFMLZOQABMSFAV-UHFFFAOYSA-N	431.811	1.830	50	20	IDGD	
O=C(NNC(=O)c1cccc(Cl)c1)C(=O)Nc1ccc(C(=O)N2CCOCC2)cc1	763747906	HQRBPBUHURKQLE-UHFFFAOYSA-N	430.848	1.212	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(NC(=O)OC(C)(C)C)nc2)c1	763754431	PZOGUQMLOGUJBH-UHFFFAOYSA-N	442.476	1.894	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2cccc3c2CCCC3)c2ccccc2c1=O	763785670	KVCKKFIFZPQDSK-UHFFFAOYSA-N	433.468	1.695	50	20	IDGD	
Cc1ccc2cccc(NC(=O)C(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)c2n1	763786498	OPTYNDIVMNMHDJ-UHFFFAOYSA-N	430.424	1.190	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccc(N2CCOCC2)c(F)c1	763858466	SOVJIKLUXKSZHV-CYBMUJFWSA-N	448.426	1.355	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccn(Cc2ccccc2)n1	763865835	RGMUIGYYXJOVOR-AWEZNQCLSA-N	425.420	1.624	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccccc2C[S@](C)=O)cc1	763867179	SLCXEWDRXYZINQ-PSKUBERUSA-N	447.513	1.517	50	20	IDGD	
C=CCNC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccc(Cl)cc2)cc1	763931932	MENAJMHDZJVCHI-UHFFFAOYSA-N	429.864	1.976	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)C(=O)Nc1ccccc1OC(F)(F)F	763948209	IGGRNCCODYVVBC-UHFFFAOYSA-N	449.345	1.876	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)C(=O)Nc1cc(N2CCCS2(=O)=O)ccc1F	763959817	JZKYJAZQKOIHAL-UHFFFAOYSA-N	434.449	1.074	50	20	IDGD	
COCCOCc1cccc(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)c1	763996885	SMLYRTFKXCBFOD-UHFFFAOYSA-N	439.266	1.340	50	20	IDGD	
C=CCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)on2)cc1	764016190	IVDZHXSJXMTVQA-UHFFFAOYSA-N	433.424	1.657	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1cccc(I)c1	764040844	NTNILSBYQPTNRL-UHFFFAOYSA-N	439.209	1.700	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1cccc(OCC(=O)N2CCCC2)c1	764041113	RBKTXXZPUPOCID-UHFFFAOYSA-N	440.456	1.096	50	20	IDGD	
CCCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2OC)cc1Cl	764043727	UNBHURAOYXVWRT-UHFFFAOYSA-N	432.864	1.888	50	20	IDGD	
COc1ccc(COCc2cccc(NC(=O)C(=O)NNC(=O)c3cc(C)[nH]n3)c2)cc1	764106323	IYSJQBMPLHXJDB-UHFFFAOYSA-N	437.456	1.843	50	20	IDGD	
O=C(CCc1ccco1)NNC(=O)C(=O)Nc1ccc(-c2nnc3n2CCCCC3)cc1	764168293	AXTHJWMCUTYATO-UHFFFAOYSA-N	436.472	1.983	50	20	IDGD	
O=C(CC1CCCC1)NNC(=O)C(=O)Nc1ccc2c(c1)CCN2C(=O)c1cccnc1	764183113	BKHGYXSWKNCVDM-UHFFFAOYSA-N	435.484	1.951	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)C(=O)Nc1cc(Cl)cc(Cl)c1	764267549	XQLDHHOTUBEOFZ-UHFFFAOYSA-N	437.287	1.786	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1ccnn1-c1cccc(Cl)c1	764278066	QJXWYCGKOMBCDP-UHFFFAOYSA-N	429.820	1.396	50	20	IDGD	
Cc1cccc(C(=O)N2CCCC2)c1NC(=O)C(=O)NNC(=O)COc1ccccc1O	764278175	UHHAEQDVEWGTAY-UHFFFAOYSA-N	440.456	1.102	50	20	IDGD	
Cc1cnn(-c2ccc(C(N)=O)cc2NC(=O)C(=O)NNC(=O)c2cc3ccccc3o2)c1	764331046	NCOJZGUIMAWRSX-UHFFFAOYSA-N	446.423	1.426	50	20	IDGD	
CCNS(=O)(=O)c1ccc(CNC(=O)NNC(=O)COc2cc(C)cc(C)c2)cc1	764374957	SUDOEOHAISVTAY-UHFFFAOYSA-N	434.518	1.511	50	20	IDGD	
COc1cc(OC)cc(OCCNC(=O)NNC(=O)c2nnc(O)c3ccccc23)c1	764375611	YKIPXIRGVGPKFE-UHFFFAOYSA-N	427.417	1.376	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(N(C)C)c(NC(=O)NNc2nccnc2OC)c1	764592098	MWLCQQMXAQJPJJ-UHFFFAOYSA-N	437.526	1.730	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)[C@H]1CC(=O)N(c2ccc(Cl)c(F)c2)C1	766432167	VRVDPSHLUURDTO-JTQLQIEISA-N	438.868	1.471	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)Cc3sc(S)nc3C)CC2)cc1	766639998	CKHGMNSCXPKJFQ-UHFFFAOYSA-N	433.603	1.556	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	766659901	IJANIXHGVDWBDB-UHFFFAOYSA-N	439.944	1.130	50	20	IDGD	
Cc1c(C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)nnn1Cc1ccc(F)cc1	767832476	BSXAZJDTGMXBAA-UHFFFAOYSA-N	444.492	1.972	50	20	IDGD	
O=C(NNC(=O)c1cc(Cl)ccc1O)C(=O)Nc1cc(C2CC2)nn1-c1ncccn1	768236873	FOGRWEUWNAPJKB-UHFFFAOYSA-N	441.835	1.298	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)CCN1C(=O)[C@@H](C)Oc2ccccc21	768629050	DQRRKGCFVOFVOD-CYBMUJFWSA-N	433.486	1.746	50	20	IDGD	
CC/C=C(/C)C(=O)N1CSC[C@@H]1C(=O)NNc1c(OC)cccc1S(C)(=O)=O	768630518	SYYNEKVTHTXRJK-FFXRNRBCSA-N	427.548	1.800	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)Nc1cnn(-c2ncccn2)c1	770037774	CIGZQKVQEZNWGA-UHFFFAOYSA-N	430.494	1.888	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)N2CCN(CC(=O)NNC(=O)c3cccs3)CC2)c1	770727527	FSHQDRYQUSQRNQ-UHFFFAOYSA-N	430.530	1.349	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(C(=O)NNc2nc(-c3ccccn3)nc3c2CCC3)cn1	771738349	ZJAIYXSCVWEGSE-UHFFFAOYSA-N	439.501	1.430	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1ccc(I)c([N+](=O)[O-])c1	772084437	UWMRWWNYAHZURP-SSDOTTSWSA-N	435.174	1.302	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)CNC(=O)c1c(Cl)cccc1[N+](=O)[O-]	772106287	PBNCGGHCIVTFJU-JTQLQIEISA-N	428.829	1.103	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)CCNS(=O)(=O)c1cccs1	772997443	VCIREYQPYUNGGF-NSHDSACASA-N	431.923	1.685	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)C(=O)Nc2ccc(S(=O)(=O)N3CCC[C@@H](C)C3)cc2)n1	773478279	OAPCUGGKSWEORL-CYBMUJFWSA-N	446.533	1.596	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2cc(C)c(Br)cn2)c1	773525327	NDCHRZFLJOQCLI-UHFFFAOYSA-N	435.278	1.934	50	20	IDGD	
O=C(NNc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(CN2C(=O)CSC2=O)cc1	773643372	PMIVRYCSKZYUIQ-UHFFFAOYSA-N	429.414	1.872	50	20	IDGD	
O=C(NNc1ccc(C(F)(F)F)cn1)C(=O)Nc1ccc2nc3n(c(=O)c2c1)CCC3	773675431	LDRVCFQWRXNAEB-UHFFFAOYSA-N	432.362	1.838	50	20	IDGD	
Cc1ccc(I)cc1NC(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1	775863274	PGSZUFBUJXTOMB-SECBINFHSA-N	437.259	1.187	50	20	IDGD	
CCc1cc(C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)cc(O)n1	778379400	JOZQUBRSDPCOGX-UHFFFAOYSA-N	431.924	1.582	50	20	IDGD	
COc1ccc(C(=O)NNc2cc(Cl)ccn2)cc1S(=O)(=O)N1CCOCC1	778446891	JJCUGWOUOVKPKN-UHFFFAOYSA-N	426.882	1.521	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NCC(=O)NNc2cc(Cl)ccn2)c1	778447193	XNIHLSUUYNQTRX-UHFFFAOYSA-N	439.925	1.639	50	20	IDGD	
Nc1cccc([N+](=O)[O-])c1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	779491261	LRYZCPTZHBLJEV-UHFFFAOYSA-N	433.446	1.036	50	20	IDGD	
O=C(NCC1CCN(CC(F)(F)F)CC1)NNC(=O)C1CCN(c2ncccn2)CC1	780627809	IISQWVRZQWWEOK-UHFFFAOYSA-N	443.474	1.298	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)NCC2CCN(CC(F)(F)F)CC2)nc2ccccc21	780630566	IWLNMGKCYKVKJK-UHFFFAOYSA-N	426.443	1.721	50	20	IDGD	
CCNC(=O)N(C)NC(=O)c1ccc(OS(=O)(=O)c2cc([N+](=O)[O-])ccc2C)cc1	780711939	LWHREUQLWAYILU-UHFFFAOYSA-N	436.446	1.977	50	20	IDGD	
Cn1ncc(NC(=O)C(=O)NNC(=O)CSc2ccc(Cl)cc2)c1C(F)(F)F	782120969	NRYGSZLPRNIZSC-UHFFFAOYSA-N	435.815	1.971	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)NCc1ccc(N2CCOC2=O)cc1	783312207	CCYYZPBMKOSCPQ-UHFFFAOYSA-N	429.389	1.461	50	20	IDGD	
O=C(NNC(=O)c1cccc2nn[nH]c12)c1nn(Cc2ccccc2)c(=O)c2ccccc12	783507978	LCSTUVQCJOXGAX-UHFFFAOYSA-N	439.435	1.791	50	20	IDGD	
O=C(NNc1ccc(Br)cn1)C(=O)Nc1ccc(S(=O)(=O)C(F)F)cc1	784339275	FZJQTPPHHUOFFQ-UHFFFAOYSA-N	449.233	1.922	50	20	IDGD	
NS(=O)(=O)c1cccc(NC(=O)C(=O)NNc2ccc(F)cc2Br)c1	784802518	JOOGGDCEOWDIEM-UHFFFAOYSA-N	431.243	1.317	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)C(=O)Nc2ccc3c(c2)C(=O)N(CC2CC2)C3=O)c1	784853207	BGAIIJYXFDDUJG-UHFFFAOYSA-N	436.424	1.561	50	20	IDGD	
O=C(NNc1ccc(C(F)(F)F)nn1)C(=O)Nc1ccc(CCN2CCOCC2)cc1	784891440	PFXKTQHPRBZSJG-UHFFFAOYSA-N	438.410	1.452	50	20	IDGD	
CC[C@]1(C)Oc2ccc(NC(=O)C(=O)NNC(=O)COc3ccccc3OC)cc2O1	785991389	REBKPYCUYPHODV-OAQYLSRUSA-N	429.429	1.758	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)[C@@H]1CCN(C(=O)OC(C)(C)C)[C@H]1C	786378912	SCVOPAABNNDCFE-DOTOQJQBSA-N	433.505	1.874	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)[C@H]2CCCN(C(=O)NC3CCCC3)C2)c1	786808455	LDNHGQITVBRFFE-KRWDZBQOSA-N	430.505	1.663	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2F)cc1C(=O)N(C)C(C)C	787540752	FBOLICNATIKBGL-UHFFFAOYSA-N	444.463	1.779	50	20	IDGD	
COc1cc(C)c(S(=O)(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)cc1Cl	788493671	QPSLTHOBDHIEDP-UHFFFAOYSA-N	446.312	1.936	50	20	IDGD	
O=C(NCC1CC1)NNS(=O)(=O)c1cccc(S(=O)(=O)N2CCCCCC2)c1	790392710	WXNVGKXABNBGBG-UHFFFAOYSA-N	430.552	1.154	50	20	IDGD	
COc1cc(C(F)(F)F)ncc1NC(=O)C(=O)NNC(=O)COc1ccc(C)c(C)c1	792267427	FYVNLFZARWSETH-UHFFFAOYSA-N	440.378	1.891	50	20	IDGD	
CCOc1ccc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)COC(F)F)cc2)cc1	794753560	VXYKZAUMRDOQJG-UHFFFAOYSA-N	443.428	1.886	50	20	IDGD	
CCC(=NNC(=O)CNC(=O)c1cccs1)c1ccc(Cl)c(S(=O)(=O)NC)c1	794857908	ZHGSITDLSALIJS-UHFFFAOYSA-N	442.950	1.970	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)[C@@H]2CCc3cc(C)ccc3O2)cc1OC	796296227	BMUPXLRKAQGIAS-SFHVURJKSA-N	428.441	1.710	50	20	IDGD	
Cn1cc(-c2cc(F)ccc2NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)cn1	797004739	LVLAUIHNSCWDPM-UHFFFAOYSA-N	434.431	1.967	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)N[C@@H]1COc2cc(F)c(Br)cc21	799912357	WGFYLVXMYNMDRV-LLVKDONJSA-N	441.213	1.375	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)Nc2nnn(CCOc3ccc(F)cc3)c2C)c1O	801823914	GUXUTXLAKXPCEW-UHFFFAOYSA-N	444.423	1.985	50	20	IDGD	
COC[C@H](C)n1c(SCC(=O)NNC(=O)N=c2cc[nH]cc2)nnc1-c1ccccc1	802034089	ACWLMTDBADEQRU-AWEZNQCLSA-N	441.517	1.914	50	20	IDGD	
COC(=O)N(C)NC(=O)CC[C@@H](Cc1ccc(Cl)cc1)C(=O)NN(C)C(=O)OC	804123699	PDNRCYIAZANNAZ-ZDUSSCGKSA-N	428.873	1.738	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)NC2CC2)cc1)NNc1ccc(-n2ccnc2)nn1	804957902	XEVANEVSDCSLQM-UHFFFAOYSA-N	427.490	1.179	50	20	IDGD	
O=C(NNc1ccc(C(F)(F)F)nn1)C(=O)Nc1ccc(F)c(N2CCCNC2=O)c1	807013860	JBIMXDWGFYFYLE-UHFFFAOYSA-N	441.345	1.636	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)NCC3(S(C)(=O)=O)CCCC3)nc21	807535838	LQLGVXJWWUQOBW-UHFFFAOYSA-N	425.515	1.270	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)C(=O)OC3)cc1OC	808934412	DHIQBXYYCDWCNF-UHFFFAOYSA-N	427.413	1.554	50	20	IDGD	
COC(=O)c1c(F)ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)c1C	810386289	SUEDIKMKNOZTJI-NSHDSACASA-N	435.383	1.613	50	20	IDGD	
COc1ccc(S(=O)(=O)NCC(=O)NNc2nc(C(F)(F)F)cs2)cc1OC	810497498	ZPAMSLUJBLDBEP-UHFFFAOYSA-N	440.425	1.601	50	20	IDGD	
Cn1cc(C=NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c(C(F)F)n1	812223428	YFSWYBDDIZHRHK-UHFFFAOYSA-N	427.433	1.143	50	20	IDGD	
O=C(CCc1ncccn1)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	812452981	NNXXSSVQBYPCRK-UHFFFAOYSA-N	439.497	1.349	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)c2ccc(=O)n(-c3ccccc3F)n2)cc1	812731316	FLGRVFQZBMYVTO-UHFFFAOYSA-N	431.449	1.379	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCc2ccc3cnn(C)c3c2)nc1	813169630	PWVBBESNKWUCPJ-UHFFFAOYSA-N	431.522	1.825	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)[C@H](O)c3ccc(Cl)cc3)cc2)CC1	813495396	ZGSMXENWMVHKBA-GOSISDBHSA-N	438.937	1.453	50	20	IDGD	
N#Cc1ccccc1Oc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2CCc3nncn3C2)cc1	815691820	BVYPGUUZCQFZKP-HNNXBMFYSA-N	445.439	1.291	50	20	IDGD	
C[C@@H](C(=O)N1CCN(S(=O)(=O)CBr)CC1)[C@@H]1OCCc2sccc21	815964992	ZBTLLKLLFPIXKB-RISCZKNCSA-N	437.381	1.824	50	20	IDGD	
O=C(COC(=O)c1cccc(CN2C(=O)CNC2=O)c1)NNC(=O)c1cccc(Cl)c1	825411522	XDMJBHNIINDHHX-UHFFFAOYSA-N	444.831	1.010	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	843446206	CELSNILRFZPUDY-SJKOYZFVSA-N	434.832	1.638	50	20	IDGD	
Cn1nnnc1Sc1ccc([N+](=O)[O-])cc1C(=O)NNC(=O)c1ccc(Cl)cc1	912633028	XZVVWMJRBHKOPX-UHFFFAOYSA-N	433.837	1.998	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)[C@H](CC(C)C)N2C(=O)[C@@H]3CC=CC[C@H]3C2=O)cc1	913431303	CZHUGUPZAPZQAL-QRVBRYPASA-N	426.517	1.920	50	20	IDGD	
CC(=O)c1cccc(S(=O)(=O)NCC(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)c1	913489459	VDSSMBDMZNRRHT-UHFFFAOYSA-N	433.530	1.531	50	20	IDGD	
N#C/C(=C\c1cn(CCC(N)=O)nc1-c1cccc(Br)c1)C(=O)OCCO	914057712	YECQRCDJSHAVAN-MDWZMJQESA-N	433.262	1.630	50	20	IDGD	
CC(=O)N1CCN(CCNC(=O)/C(C#N)=C/c2cc(C)n(C[C@@H]3CCCO3)c2C)CC1	915624773	QHGBCIRKZLOFJL-AMUNLKFJSA-N	427.549	1.471	50	20	IDGD	
Cc1ccc(-n2nc(C)c(CC(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)c2C)cc1Cl	915832396	YHMYMMDEPCXQPO-AWEZNQCLSA-N	438.937	1.576	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cc(C3CC3)n(C(C)(C)C)n2)cc1	916736428	PTFQQURANAYOHT-UHFFFAOYSA-N	447.561	1.906	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)[C@H](C)S(=O)(=O)c1ccc(F)cc1	917918123	WWQUHMVZUMNUTD-ZDUSSCGKSA-N	432.477	1.748	50	20	IDGD	
CC[C@H](NC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)c1ccccc1OCC(=O)NC	918220885	CVGGYJYNJOTYRT-INIZCTEOSA-N	429.433	1.815	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCc2ccccc2)cc1C(=O)NNC(=O)NCC(F)(F)F	918707340	XXNVVNOGKORFRA-UHFFFAOYSA-N	444.435	1.980	50	20	IDGD	
COc1cccc(/C=C(/C#N)C(=O)OCC(=O)NCc2ccc(S(C)(=O)=O)cc2)c1	918977371	WDWCYSMUWVSZPW-YVLHZVERSA-N	428.466	1.865	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)CN1C(=O)Cn2c(cc3ccccc32)C1=O	920275182	NJFFJSZBINEGNP-CYBMUJFWSA-N	438.415	1.378	50	20	IDGD	
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC(=NNC(=O)c2nnc(-c3ccccc3)o2)CC1	920384963	HUIRDDTYKSRRPG-UHFFFAOYSA-N	443.489	1.647	50	20	IDGD	
C[C@@H](CC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1)n1ccnc1	920422605	FBCBJIGTQBASFV-INIZCTEOSA-N	441.513	1.774	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)NCc1cccc(C(=O)N2CCOCC2)c1	920811090	BJGWVXUPVLZSSD-UHFFFAOYSA-N	442.472	1.077	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)Nc1cccc(CN2CCC[C@@H]2C(N)=O)c1	920932699	BCXWHAWMCQTGLC-IFXJQAMLSA-N	443.479	1.896	50	20	IDGD	
C[C@@H](OC[C@H]1CCCCO1)C(=O)NNC(=O)c1ccc(CSc2nncn2C)cc1	921165804	YELOQUSHRFJTAT-RHSMWYFYSA-N	433.534	1.843	50	20	IDGD	
C[C@@H]1CN(C[C@@H](C)C(=O)NN=Cc2c(Br)cc(C(=O)O)n2C)C[C@@H](C)O1	1116077155	OMXZYWJZDCYYTQ-IJLUTSLNSA-N	429.315	1.681	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCC(=O)NNc2ccc(Br)nc2)cc1	1261203345	XBRWUTPMTOZPRI-UHFFFAOYSA-N	429.296	1.664	50	20	IDGD	
CC(C)(C=NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12)S(C)(=O)=O	1319491820	YBVHQAXWVDKWFH-UHFFFAOYSA-N	426.498	1.984	50	20	IDGD	
CN1CCN(c2cc(CNC(=O)NNC(=O)c3cncn3-c3ccccc3)ccn2)CC1	1321724935	JEOSDIHCBITZIA-UHFFFAOYSA-N	434.504	1.163	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(F)(F)[C@@H](C(=O)NNC(=O)c2n[nH]c3c2CCCC3)C1	1321919355	WYMVFNQSSSNYED-GFCCVEGCSA-N	427.452	1.942	50	20	IDGD	
Cc1ccc(-n2c(NNC(=O)[C@H](C)N3C(=O)CCC3=O)nc3ccccc3c2=O)c(C)c1	1322793770	GQUHIDNSAAFTID-HNNXBMFYSA-N	433.468	1.983	50	20	IDGD	
CCn1nc(C(=O)NN=Cc2c(Br)cc(C(=O)O)n2C)c2ccccc2c1=O	1322944392	OECGWCKNAKHEMM-UHFFFAOYSA-N	446.261	1.980	50	20	IDGD	
COC(=O)C(=O)NNC(=O)N[C@@H]1CCCN(c2c(C)cc(Br)cc2C)C1	1323090666	ZZGIWWYEZVSKJJ-CYBMUJFWSA-N	427.299	1.538	50	20	IDGD	
C[C@H](OC1CCCCC1)C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	1328575354	IZHVCUPYGCRZJM-HNNXBMFYSA-N	425.555	1.199	50	20	IDGD	
C[C@@H]1CCC[C@H]1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnccc1C(=O)NN)C2	1778896265	CRNSMHPBOWKCOA-ZYFHCTRVSA-N	443.548	1.249	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@]2(C1)CN(C(=O)Cn1cnc3ccccc31)CCO2	1779301019	FUKGKVKEJMBHAF-OAQYLSRUSA-N	430.581	1.718	50	20	IDGD	
C=C[C@@H](O)C(C)(C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)Br)C2	1779339208	GVCCFMMTZOISQX-NRTGNBEESA-N	431.371	1.857	50	20	IDGD	
Cc1nccnc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)Br)C2	1779874707	HMMMCPKFKAZTSG-RVZJWNSFSA-N	425.327	1.696	50	20	IDGD	
C/C=C(\C)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1	1780098074	AXKCHKYTMQXDNV-JTJFFURRSA-N	431.445	1.930	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)c3cc4ncccn4n3)CCO2)C1	1781229763	JDWHZOVUSNYAIQ-ROUUACIJSA-N	426.304	1.409	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)COc2ccc(O)nn2)C1	1781493853	RQNIADUCDYKATF-IQUTYRLHSA-N	426.901	1.092	50	20	IDGD	
O=C(c1ccccc1N1CCCCC1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1782025950	HWDZQBQPNXVEAB-SIKLNZKXSA-N	435.952	1.720	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)ccc1F)C2	1782179957	XPXLKBPBXHDIGO-XAUMDUMWSA-N	428.888	1.913	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cn1cnc3ccccc31)C2	1782180396	ZPXGVLQDTWBIOQ-DKZVUGQWSA-N	448.951	1.804	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(CCN(C(=O)c3n[nH]c4cccc(F)c34)C2)C1	1782482401	LJHRYBDJWZQGBJ-HXUWFJFHSA-N	434.544	1.997	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C=C(/C)C(=O)O)C1	1783161658	DRQPAGVELKRLFG-VBCUROGJSA-N	431.327	1.705	50	20	IDGD	
O=C([C@H](F)Br)N1CCO[C@@]2(CCN(C(=O)[C@H](O)Cc3ccccc3)C2)C1	1783339782	NCLHJVVPARZIQN-RVKKMQEKSA-N	429.286	1.110	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cc(COC)c[nH]3)CCO2)C1	1783352776	SRFBBKYGWUCKBN-RDTXWAMCSA-N	428.327	1.778	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](C)NC(=O)OC(C)(C)C)CCO2	1783529219	SUNDHWYKVVKZTL-ZJNRKIDTSA-N	448.358	1.513	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)Cc3cccc(Cl)n3)CCO2)C1	1783531690	BBLSCCRKWUIZQG-SJCJKPOMSA-N	430.730	1.891	50	20	IDGD	
CC(C)Cc1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](C)Br)C3)C2)n(C)n1	1783532392	HOCMNWBSWQCAMX-IFXJQAMLSA-N	441.370	1.846	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3nn[nH]c3C(F)(F)F)CCO2)C1	1783537092	LLRLNQRASQCTNY-AMIZOPFISA-N	440.220	1.050	50	20	IDGD	
COC(=O)N(CC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Cl)CCO2)Cc1ccccc1	1783693076	XQPPSTKCEHDTHV-YLJYHZDGSA-N	441.887	1.619	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)Cc3ccc(C(=O)OC)cc3)CCO2)C1	1783879470	VFLFMPWYSOZRAY-UWJYYQICSA-N	438.908	1.099	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cc3ccoc3s1)CCO2	1783933715	FFWKNKZLPWVBEU-HXUWFJFHSA-N	434.518	1.311	50	20	IDGD	
CC[C@@H](C(=O)N1CCO[C@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1)c1ccccc1	1783936363	MGBOGWRWOUXSCL-XXBNENTESA-N	430.549	1.383	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)c(Cl)c1	1785032880	CSGMOMARXHXKNJ-JOCHJYFZSA-N	442.708	1.086	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(Cl)nc3F)[C@H]2C1	1785490326	UEPYYWFEXOLRAX-DEQVHRJGSA-N	434.295	1.721	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ncc(Cl)cn3)C[C@@H]21	1786404225	LHDKUPOGIXYYST-DRZSPHRISA-N	431.718	1.508	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CC3CCOCC3)[C@H]2C1	1786735372	KUCHRXQRVZBZGY-HJWJTTGWSA-N	431.371	1.814	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3c[nH]c4nccc-4c3)[C@H]2C1	1787332799	VFLKHOIYWZNMDV-XTBFLFJDSA-N	435.322	1.891	50	20	IDGD	
Cc1ccc(-n2ccnn2)c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]3C2)c1	1787449574	HZAYUOUMMDWPDX-IKICRFKJSA-N	435.887	1.703	50	20	IDGD	
O=C(NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1)C(=O)c1ccco1	1788144914	CNUDPBBHCIIBAH-UHFFFAOYSA-N	432.241	1.590	50	20	IDGD	
CCc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)Br)C[C@@H]32)n(C)n1	1788946229	PGZOIYMBRJMPDI-DSPQJCBJSA-N	427.343	1.359	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnn(C)c3Cl)[C@H]2C1	1789083598	UIPYOFFKEWFWOX-UKJIMTQDSA-N	433.734	1.450	50	20	IDGD	
C[C@@H]1Oc2ccc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)[C@@H](F)Cl)C[C@@H]43)cc2NC1=O	1789261857	DQPBFWKMCFERRA-KMNSEVKQSA-N	439.871	1.534	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1ccc(C2(NC(=O)[C@H](O)c3ccco3)CCC2)cc1	1789519957	TYXNBUQDDLONDS-LJQANCHMSA-N	449.467	1.759	50	20	IDGD	
COCCn1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]3C2)n1	1789865689	BXYYASUEAYHDHM-PWDMQXDWSA-N	447.363	1.359	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]2C1	1789871496	CSOADBYOAYZJOP-VSBZFQJLSA-N	430.170	1.986	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C=C/C3CCCCC3)[C@H]2C1	1789901800	APOYCOMHUAYMAU-VGZMHKMPSA-N	434.581	1.476	50	20	IDGD	
CCOC(=O)/C=C/C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](Br)CC)[C@H]2C1	1790961185	LBSUQTOWUIZKCI-JDENUTSSSA-N	431.327	1.259	50	20	IDGD	
C[C@@H](Cn1cccn1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]2C1	1791056960	JFRFYEPNDVRZHL-QRJUGERDSA-N	427.343	1.282	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCOCCOCCOC)[C@H]2C1	1791134496	PYADQKCRQFZVEZ-XSLAGTTESA-N	434.961	1.053	50	20	IDGD	
COc1cccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)CBr)C3)n1	1793983801	IFDVQGWIBKSQQH-ZUMXRPEOSA-N	440.338	1.253	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc2cccnc12	1797330344	QXHFVFWYPFWHTI-BJWYYQGGSA-N	444.495	1.799	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C=C1\C(=O)Nc2ccccc21	1797658955	UWWVUGQTYUZFHE-WFCLCVJDSA-N	443.576	1.463	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(C(C)(C)C)n[nH]1	1798132252	DRYIIECNHAEKFA-JFILPPLUSA-N	441.370	1.941	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccn(C(F)F)n1	1798160967	QIZVLBLLVOOWOC-KQXIARHKSA-N	435.269	1.512	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc3cc[nH]c13)C2	1798440367	KLVUSYVVELFHTJ-MUJYYYPQSA-N	432.484	1.732	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(OC)c(OC)c1	1798895546	XDMDZTRKRWFITN-KRXQYRFLSA-N	426.897	1.161	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](NC(C)=O)c1ccc(F)cc1	1799054130	QBSVEDBPIRJJEX-CGHHPOIWSA-N	439.915	1.610	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1c(F)cccc1F	1799533207	RCDJDDMEZAKPKF-CLLJXQQHSA-N	429.427	1.529	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1cccc(F)c1[N+](=O)[O-]	1799633618	FGMBMIGNGPQHDY-XSPYEYLBSA-N	448.220	1.628	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1n[nH]c2cccc(F)c12	1800079472	ALPANDXVSGSISR-YPSFTXJRSA-N	443.248	1.596	50	20	IDGD	
O=C(CN1C(=O)CSC1=S)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](F)Br	1800165524	RIBNLJFXYPUHSU-NHRVJRKFSA-N	438.344	1.175	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](O)Cc1ccccc1	1800635856	KGMDYEMXQUSSJL-WFNPHZEWSA-N	429.344	1.416	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CC13CCCN1CCC3)C2	1800759915	QHJACMUJCLXRBC-MPTYRVRUSA-N	428.371	1.378	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc([N+](=O)[O-])cc1F)C2	1800759922	QLAXMSJQUYDPAN-ZVXAKGHKSA-N	444.257	1.721	50	20	IDGD	
COc1cccc2[nH]cc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)CCC(=O)NN(C)C)C4)c12	1801033693	IJFYYLYIBDUIOC-MUJYYYPQSA-N	441.532	1.801	50	20	IDGD	
COc1cccc(CC(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]2c2cccnc2)n1	1803136367	PKSWXBVIEREZKN-WRWLIDTKSA-N	432.908	1.333	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2cncc(F)c2)[C@H]1c1cccnc1	1805849612	LFIDMYIPGHQLCN-IIBYNOLFSA-N	442.495	1.308	50	20	IDGD	
CN[C@H](CC(=O)N1CC[C@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]1c1cccnc1)C(=O)O	1808294924	CWQCWVSYANPHJD-UMHPPVOVSA-N	445.347	1.386	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)C(C)(F)F)[C@@H]1c1cccnc1	1808414482	JESIEOUDLIHSPO-PSOMGPDVSA-N	446.458	1.877	50	20	IDGD	
C/C(=C/C(=O)N1CC[C@H](CNC(=O)[C@@H](F)Br)[C@H]1c1cccnc1)C(=O)O	1808681484	UBMKBVSDAJPGJF-KMYBKLTQSA-N	428.258	1.809	50	20	IDGD	
Cc1ocnc1C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1	1811081024	VRIANOWELVZOID-HNAYVOBHSA-N	449.471	1.010	50	20	IDGD	
CCOc1ccc(C(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)nn1	1811622867	PSKOUWOSDRLIBG-YXJHDRRASA-N	433.896	1.190	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)nc1	1813069779	BUPDRRFABVMNHU-XMSQKQJNSA-N	438.532	1.478	50	20	IDGD	
C[C@@]1(C(=O)N[C@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)CC1(F)F	1815362033	ZGYKWIMQORDDJY-SGTLLEGYSA-N	435.261	1.094	50	20	IDGD	
Cc1nscc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1	1816263662	NVWRDPNUHKDBOX-HNNXBMFYSA-N	433.538	1.854	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](O)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](F)Cl)sc2C1	1817128484	LXKAVIIRHSXUTQ-LIEFSGRHSA-N	436.893	1.433	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(F)c[nH]2)[nH]n1	1819404799	ZRVRXEVOOKESOV-INIZCTEOSA-N	440.439	1.495	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CN2CC(=O)NC2=O)[nH]n1	1820862894	WKUFSWGSDYIXCM-DIFFPNOSSA-N	445.307	1.190	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(=O)n2O)[nH]n1)[C@H](F)Br	1820931080	FTGHZKHOEIARHK-HZMBPMFUSA-N	442.245	1.805	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CN2CCNC2=N)[nH]n1	1822182875	DWMNLHSXMOUHLE-ZYHUDNBSSA-N	426.319	1.025	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(=O)n3[nH]cnc3n2)CC1	1824011091	MWKZVYKHAOHOAR-INIZCTEOSA-N	448.955	1.916	50	20	IDGD	
C[C@H](NC(=O)c1ccccn1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](F)Cl)CC2	1824548735	KDWBDTCAFNUFMG-PKFCDNJMSA-N	439.900	1.803	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@H](C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@@H](O)CCl)CC3)C1	1825973637	AHSTTYDDYWTOAY-OPDFLTKYSA-N	443.953	1.634	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H]2CCOC2)CC1	1827679826	WNJDJHHVGVWVSS-BAGDKLQBSA-N	443.548	1.777	50	20	IDGD	
Cc1c(C(=O)N2CCCC[C@H]2C2CCN(C(=O)[C@H](O)CCl)CC2)cn2[nH]cnc(=O)c12	1829598057	QLRSAYAEKOHYQB-DLBZAZTESA-N	449.939	1.164	50	20	IDGD	
CN1CCC(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)CC1	1829894613	QHJRLMJXFYKLER-RBUKOAKNSA-N	436.380	1.021	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)COc3ccc(O)cc3)CCO2)C1	1830345657	CJDKHHADGJMHNW-FXAWDEMLSA-N	426.897	1.245	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CCCCC1(F)F)CCO2	1831726430	KRDGPXKNZVPRQM-RVKKMQEKSA-N	438.899	1.522	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3noc(C)c3C)CCO2)C1	1831984213	FKKPWCYXSAZQLT-KBXCAEBGSA-N	444.326	1.535	50	20	IDGD	
Cc1cc(CC(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)no1	1832129468	DZZDNQXAERBXDA-OAQYLSRUSA-N	439.321	1.139	50	20	IDGD	
O=C(/C=C/c1ccc(F)cc1F)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1	1832132462	UARKCOLOVBEAEC-ZEYJBVPASA-N	444.862	1.034	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnnc(Cl)c3)CCO2)C1	1833204896	STIXVGBEGBEGBH-GOSISDBHSA-N	431.320	1.465	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)C3CCC(F)(F)CC3)CC2)CC1)[C@H](O)CCl	1833306497	UFZAEYHFIPUTKJ-QGZVFWFLSA-N	435.943	1.983	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H]3CNc4ccccc43)CC2)CC1)[C@H](O)CCl	1833308856	AZXYLOQTRPOMDH-AZUAARDMSA-N	434.968	1.367	50	20	IDGD	
Cc1cnc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)s1	1833804504	ZNCVMQYZDWQTCX-IRXDYDNUSA-N	436.361	1.758	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCC(N2CCC(NC(=O)c3cc(O)nc(O)c3)CC2)CC1	1834985329	JPYXYNZZROSHBA-UHFFFAOYSA-N	438.956	1.943	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccc(Cl)cc3)CCO2)C1	1835062279	GNUGOTWFIWNTOQ-FXAWDEMLSA-N	445.343	1.593	50	20	IDGD	
CC1(C(=O)N2CCC(N3CCC(NC(=O)c4cnccc4C(=O)NN)CC3)CC2)CCC1	1835734458	JWPRQZGEKGSYIH-UHFFFAOYSA-N	442.564	1.061	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3c(F)cccc3F)CCO2)C1	1838864284	XHKWGAVSNQWQKY-KPZWWZAWSA-N	447.276	1.818	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3nccc(Cl)c3OC)C2)C1	1839146385	NXMJOBIOVAXOSZ-ORAYPTAESA-N	446.331	1.831	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)c3ccccc3Cl)C2)C1	1839148469	AFAVNHFKRRCIDW-XAUMDUMWSA-N	445.343	1.847	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)/C=C/c3cnc(C)s3)C2)C1	1839148504	ANXQDCYATBGKLM-QDYBUIJZSA-N	427.954	1.939	50	20	IDGD	
O=C(C(Cl)Cl)N1CCOC[C@]2(C1)CN(C(=O)C(F)(F)c1ccco1)CCO2	1839691619	DDPJAIRJRCZJJV-HNNXBMFYSA-N	427.231	1.632	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccnn3CC)C2)C1	1839963155	BICOKHCIYOZDQG-KSSFIOAISA-N	443.342	1.147	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3c[nH]c(C)c3)C2)C1	1839964158	ITJFGCCHHAVXMM-MAUKXSAKSA-N	428.327	1.567	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ncoc3C)C2)C1	1839966248	ZBJSOPPTVWIZOY-SUMWQHHRSA-N	430.299	1.227	50	20	IDGD	
Cc1ccc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)cn1	1840031301	LQYFBNKRPAJZSZ-BEFAXECRSA-N	440.338	1.172	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3CC4(CCC4)C3)C2)C1	1840035969	BNHGVBNEORKPSO-LIRRHRJNSA-N	429.355	1.807	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4ccoc4c3)C2)C1	1840155323	XVTYENHGHIUSQL-DYESRHJHSA-N	436.892	1.757	50	20	IDGD	
C[C@H](C(=O)N1CCOC[C@]2(CN(C(=O)C(Cl)Cl)CCO2)C1)n1cccc1C=O	1840188016	JZWYQPVQDSITFB-FZKQIMNGSA-N	432.304	1.122	50	20	IDGD	
CO[C@@H](C(=O)N1CCOC[C@@]2(CN(C(=O)C(Cl)Cl)CCO2)C1)c1ccccc1	1840188027	KLUJPAHSUGDJGC-BEFAXECRSA-N	431.316	1.634	50	20	IDGD	
CCSc1ncccc1C(=O)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843013021	ZCOBDKMIKSPSEP-UHFFFAOYSA-N	425.319	1.004	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1ccc3c(cnn3C)c1)C2	1843416034	RPWXFUDJRJENGH-CVKSISIWSA-N	447.499	1.524	50	20	IDGD	
C[C@H](Sc1cccs1)C(=O)N1CCCC12CN(C(=O)c1cccc(B(O)O)c1)C2	1844167984	XMDFRXXNAOCNIR-AWEZNQCLSA-N	430.360	1.426	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)c1ccc(=O)oc1)C2	1844692442	XVSNXIVOTUKFGT-UHFFFAOYSA-N	441.396	1.604	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@H]2CCC(=O)N2C(=O)OC(C)(C)C)C1	1846485945	ZUJGYLFGTYGFOF-KGLIPLIRSA-N	443.928	1.370	50	20	IDGD	
C#CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)[C@@H](Cl)COC)C2	1847068923	IXPHXGQFBPXVLW-GJZGRUSLSA-N	427.929	1.360	50	20	IDGD	
O=C(c1cnn2c(-c3cccs3)ccnc12)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl	1847560597	XQHDMTGYRTWDJQ-DZKIICNBSA-N	445.932	1.873	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)COCc2nc3ccccc3s2)c1	16594097	SBWOXBLGZAZEOZ-UHFFFAOYSA-N	448.526	1.524	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2ccc(C(F)(F)F)nc2)cc1	26353986	BWQFJORPINCWDH-UHFFFAOYSA-N	430.408	1.491	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cccc(C[S@@](C)=O)c2)cc1OC	105487653	ZNUHYCODEMENNA-PMERELPUSA-N	434.470	1.200	50	20	IDGD	
O=C(CCn1cc[nH]c(=O)c1=O)NNC(=O)c1ccc(COc2ccc(Cl)cc2)cc1	116704108	QXRJKYIVHHIYQB-UHFFFAOYSA-N	442.859	1.620	50	20	IDGD	
O=C(COC(=O)Cc1cccc(Br)c1)NNC(=O)c1ccc([N+](=O)[O-])cc1	725983796	KCRSRKVWTIHCQL-UHFFFAOYSA-N	436.218	1.904	50	20	IDGD	
Cn1nc(C(=O)NNC(=S)Nc2ccc3c(c2)OCCCO3)c2ccccc2c1=O	727270123	CIMJKXNQPJZKCV-UHFFFAOYSA-N	425.470	1.726	50	20	IDGD	
O=C(NCc1cccc(C(=O)N2CCOCC2)c1)NNC(=O)c1cccc(OC(F)F)c1	728597754	PSTNFCFNNDGJKB-UHFFFAOYSA-N	448.426	1.905	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)Cc2cccnc2)ccc1OCC(=O)N1CCCCC1	728851000	HGLLHOOHUJLSRO-UHFFFAOYSA-N	440.500	1.875	50	20	IDGD	
COCCCNC(=O)[C@@H](C)N1CCN(C(=O)NNC(=O)c2ccc3ccccc3c2)CC1	728946041	WMQHVBDDLSOZTN-QGZVFWFLSA-N	441.532	1.353	50	20	IDGD	
CCN(C)Cc1cccc(CNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1	729051310	QVUFNQIRWGKDLE-UHFFFAOYSA-N	425.537	1.675	50	20	IDGD	
COc1ccnc(NNC(=O)c2ccc(S(=O)(=O)N(C)C)c(Br)c2)n1	729312916	JZXUOAZBLZEUBU-UHFFFAOYSA-N	430.284	1.255	50	20	IDGD	
NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NNC(=O)Cn3ccc4ccccc43)cc2)C1	729507070	NTUIMLBQXRHEGW-IBGZPJMESA-N	448.527	1.874	50	20	IDGD	
COC(=O)c1ccc(S(=O)(=O)NNC(=O)c2cccc3ncccc23)c([N+](=O)[O-])c1	730204460	WVVWRCIXNSZYSG-UHFFFAOYSA-N	430.398	1.553	50	20	IDGD	
COC(=O)c1ccc(COc2ccccc2C=NNC(=O)[C@H]2CCS(=O)(=O)C2)cc1	730575772	HSYQMCOITGEHLV-SFHVURJKSA-N	430.482	1.937	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)[C@@H]1CC(=O)N(c2cccc(Br)c2)C1	730781582	SWRHSZIMHJZYGP-GFCCVEGCSA-N	448.273	1.734	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)Cc2ccccc2F)cc1S(=O)(=O)N1CCOCC1	731328406	HSDHVJZMXNMQED-UHFFFAOYSA-N	435.477	1.159	50	20	IDGD	
CNC(=O)NNC(=O)c1nnn(-c2cccc3c2CCN(Cc2ccccc2F)C3)c1C	731472873	NVPTVLMJYFMSMO-UHFFFAOYSA-N	437.479	1.847	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)N1CCN(c2nn3cc(-c4ccc(F)cc4)nc3s2)CC1	731847994	BRQDQTMTUREHAS-ZDUSSCGKSA-N	445.524	1.665	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)N1CCN(S(=O)(=O)c2ccccc2Cl)CC1	731849337	WODRXOBYHGUPOF-CQSZACIVSA-N	430.958	1.228	50	20	IDGD	
CCS(=O)(=O)N1CCC(C(=O)NNC(=O)c2ccc(OC)c(Br)c2)CC1	732033597	SIVQUOSRDYKDAA-UHFFFAOYSA-N	448.339	1.280	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C[C@@H](C)O1	732259886	ZLTZGZMQKKKLEP-LMMKCTJWSA-N	448.564	1.769	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)CN1C(=O)CCc2ccccc21	732375089	YCNXITCEWBMJEK-UHFFFAOYSA-N	445.859	1.632	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NC[C@@H](OC)C(F)(F)F)c2ccccc2c1=O	733658844	NUIXZPOONJUGML-CYBMUJFWSA-N	429.399	1.718	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N2CC(n3ccnc3)C2)cc1	733985990	RZKOESNNZLJUHT-YVLHZVERSA-N	445.483	1.621	50	20	IDGD	
Cc1cc(C)c(N2C[C@@H](C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)CC2=O)c(C)c1	734239105	HGGGFAXDNLUNLP-INIZCTEOSA-N	447.536	1.820	50	20	IDGD	
C[C@@H](NC(=O)c1ccc(Cl)cc1)C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C	734241916	MYJMTBRPXYWKGV-LLVKDONJSA-N	427.889	1.313	50	20	IDGD	
Cc1csc(=O)n1CCC(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	734825734	NTBJSWVKYPRXHQ-UHFFFAOYSA-N	427.527	1.338	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNc1ccc(Cl)nn1	735687134	SMRLZVVLCGZSKF-UHFFFAOYSA-N	425.898	1.227	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2cccc(C(=O)NNc3ccc(Cl)nn3)c2)C[C@@H](C)O1	735688795	VPSADJZAFMLOAH-TXEJJXNPSA-N	425.898	1.685	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)c2ccc(N3CCCS3(=O)=O)cc2Cl)c1O	736672335	HWWCCUHVSCZUFS-UHFFFAOYSA-N	439.877	1.669	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)N[C@@H](CNC(=O)OC(C)(C)C)C2CC2)c2ccccc2c1=O	741436715	VUMNEUMMNDPCSI-HNNXBMFYSA-N	444.492	1.181	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)N2CCN(CC[S@@](C)=O)CC2)N(C)c2ccccc21	742184722	ZMQXHRBDFPNHQD-WJOKGBTCSA-N	443.573	1.180	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)c1c[nH]nc1-c1cccc(OC(F)F)c1	742611958	GQFBRCOOSVSEEC-UHFFFAOYSA-N	435.412	1.931	50	20	IDGD	
CNS(=O)(=O)c1cccc(CNC(=O)NNC(=O)c2cccc(Br)c2)c1	743536322	MPWBVFFAOVYEOP-UHFFFAOYSA-N	441.307	1.501	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21	743742582	ZTBPVNBBVZHWQB-UHFFFAOYSA-N	444.473	1.612	50	20	IDGD	
CC(=O)NCC(=O)N1CCc2cc(C(=O)NNC(=O)Nc3ccc(N(C)C)cc3)ccc21	743828421	KGUVDOURDFOLNE-UHFFFAOYSA-N	438.488	1.244	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)cc1	743829735	CJQAZDKGWYTLEV-UHFFFAOYSA-N	444.429	1.651	50	20	IDGD	
CCN(C(=O)[C@H](C)OC(=O)/C(C#N)=C/c1cc(C#N)n(C)c1C)[C@H]1CCS(=O)(=O)C1	744633060	SYOQHVSSDAASMC-HZHYTTQRSA-N	432.502	1.079	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1ccn(-c2ccccc2N)n1	745060384	HODQAEXNRVYENU-UHFFFAOYSA-N	443.847	1.735	50	20	IDGD	
CCOCC(=O)NNC(=O)N[C@H](c1ccc(OC)cc1)c1cccc(S(C)(=O)=O)c1	745914266	JSSWUGPAKFUCCC-LJQANCHMSA-N	435.502	1.555	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)[C@@H]1CCCN1C(=O)Nc1ccc2c(c1)OCCO2	746238533	NBLLODHUIZMVEW-KRWDZBQOSA-N	442.447	1.983	50	20	IDGD	
CC(=NNC(=O)Cc1ccncc1)c1ccc(S(=O)(=O)N2CCC(C(=O)O)CC2)cc1	747646781	YEARCOJEYLMRHN-UHFFFAOYSA-N	444.513	1.650	50	20	IDGD	
CC(C)CS(=O)(=O)CCC(=O)NNc1ccc(S(=O)(=O)Nc2nccs2)cc1	747942619	BRNAJVMOFFNIPZ-UHFFFAOYSA-N	446.576	1.848	50	20	IDGD	
COc1cc(OC)cc(N2CC[C@H](NC(=O)NNC(=O)COc3ccccc3F)C2)c1	748661488	KHXHTGHQCWGPFD-AWEZNQCLSA-N	432.452	1.831	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCN(C2=NC[C@H](C)S2)CC1	750840607	SNYXZFOPEWJFDC-LBPRGKRZSA-N	425.942	1.219	50	20	IDGD	
O=C(NCc1nccn1CCc1ccccc1)NNC(=O)C1CCN(c2ncccn2)CC1	751606310	DJDBGLWJKIBWPL-UHFFFAOYSA-N	448.531	1.663	50	20	IDGD	
COc1ccccc1-c1noc([C@@H](C)NCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)n1	755039050	HWGGJYDFOLMQGI-GFCCVEGCSA-N	440.416	1.765	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)NNC(=O)c2ccc(Br)cc2Cl)co1	755859018	QJPLMABPWABLIO-UHFFFAOYSA-N	436.671	1.678	50	20	IDGD	
O=C(NNC(=O)c1cc2c(s1)CCCCC2)Nc1ccn(CC(=O)N2CCOCC2)n1	756660337	VVDQRPIFRJRHPY-UHFFFAOYSA-N	446.533	1.539	50	20	IDGD	
C[C@@H]1C[C@@H](C)CC2(C1)NC(=O)N(CC(=O)NNC(=O)c1cc(-c3ccccc3)[nH]n1)C2=O	757634541	UDCZFMMWVSRHBD-ZIAGYGMSSA-N	438.488	1.584	50	20	IDGD	
Cc1ccc(CNC(=O)NNC(=O)CNC(=O)c2cccs2)c(O[C@@H]2CCOC2)c1	758862981	UWXSOEQSYYAVMB-OAHLLOKOSA-N	432.502	1.485	50	20	IDGD	
CC1(C)C(=O)N(C[C@@](C)(O)C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c2ccccc21	760041717	ZRHVIBJIDWHOFA-OAQYLSRUSA-N	426.429	1.431	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)C(C)(C)NC(=O)C(F)(F)F)cc1	760054311	UMWIPSRDOMGUPU-UHFFFAOYSA-N	444.439	1.326	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccnn1Cc1ccc(F)cc1	760278545	YZYMHXFJAFCOIL-CYBMUJFWSA-N	443.410	1.763	50	20	IDGD	
CCC(=O)NNC(=O)C(=O)Nc1ccc(CC(=O)N2CCN(c3ccccc3)CC2)cc1	763437986	KSMHFAQHCHXIEY-UHFFFAOYSA-N	437.500	1.074	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1c(F)cccc1Br	763472601	ZUXBTFIGQIOWEW-UHFFFAOYSA-N	425.170	1.896	50	20	IDGD	
O=C(NNC(=O)c1ccccc1Br)C(=O)Nc1ccnn1-c1ccncc1	763483632	UKIBXWWHOXHGRV-UHFFFAOYSA-N	429.234	1.430	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)cc1F	763538910	GHWNRIKJXCXBTA-UHFFFAOYSA-N	435.408	1.650	50	20	IDGD	
COC(=O)[C@H](C)Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)cc1	763550535	CRKPHSMOFHFSPF-GFCCVEGCSA-N	427.413	1.167	50	20	IDGD	
COc1ccc(NC(C)=O)cc1NC(=O)C(=O)NNC(=O)COc1cc(C)cc(C)c1	763651245	ZASFWMHAVJQAPD-UHFFFAOYSA-N	428.445	1.435	50	20	IDGD	
CCOC(=O)c1cc(C)sc1NC(=O)C(=O)NNC(=O)COc1ccc(C#N)cc1	763674960	RFYRANHRKMOVLS-UHFFFAOYSA-N	430.442	1.270	50	20	IDGD	
CS(=O)(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)c1	763728328	SKUHIJHTEUMTKX-UHFFFAOYSA-N	433.530	1.534	50	20	IDGD	
O=C(NNC(=O)c1cccc(Cl)c1)C(=O)Nc1ccc(CC(=O)N2CCOCC2)cc1	763752076	BZRSHIVJFZRUFZ-UHFFFAOYSA-N	444.875	1.141	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2ccc(F)cc2OC(F)F)c1	763774897	JANXQDIMMPCNRP-UHFFFAOYSA-N	427.335	1.844	50	20	IDGD	
CCOc1ccc(C#N)cc1NC(=O)C(=O)NNC(=O)c1nn(CC)c(=O)c2ccccc12	763785604	JTJTWBDHZJHXIF-UHFFFAOYSA-N	448.439	1.086	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(F)cc2C(=O)OC)cc1	763860666	JWIZCLFBXZLVJD-LBPRGKRZSA-N	447.419	1.564	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)C(=O)N(C)CC2	763863732	BLLJUFLALKWOKG-LBPRGKRZSA-N	428.420	1.007	50	20	IDGD	
COC(=O)c1cc(C(C)(C)C)sc1NC(=O)C(=O)NNC(=O)Cn1nc(C)cc1C	763893241	QWRXTQMFQJOBFZ-UHFFFAOYSA-N	435.506	1.432	50	20	IDGD	
CC(=O)NCc1ccc(NC(=O)C(=O)NNC(=O)CCSc2ccc(F)cc2)cc1	763894351	AQJQLVIEVIYBGU-UHFFFAOYSA-N	432.477	1.730	50	20	IDGD	
CO[C@@H](C)C(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)CSc2ccc(C)cc2)c1	763898645	ZXYYKRWNAOOBGH-AWEZNQCLSA-N	444.513	1.847	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)C(=O)Nc1cccc(CN2CCCCC2)c1	763917071	OQVYDFKBBYPJPW-UHFFFAOYSA-N	448.487	1.048	50	20	IDGD	
COCCn1nc(C)c(NC(=O)C(=O)NNC(=O)c2ccc(OC(C)C)c(OC)c2)c1C	763922033	SAIIAGUYSOYTKC-UHFFFAOYSA-N	447.492	1.342	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)C(=O)Nc1cccnc1N1CCCCC1	763948202	ICOBTBAQBBVXJK-UHFFFAOYSA-N	449.471	1.363	50	20	IDGD	
CC(C)(C)c1cc(NC(=O)C(=O)NNC(=O)c2cnccn2)n(-c2ccc(F)cc2)n1	764023955	GYKPQPKHEHHWEY-UHFFFAOYSA-N	425.424	1.499	50	20	IDGD	
CC(C)CCOc1cccc(NC(=O)C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c1	764076566	BBGPGAIWQFREAQ-UHFFFAOYSA-N	447.513	1.915	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2cc(F)ccc2N2CCCCC2)c1O	764131655	REZNMWGAQQVGJF-UHFFFAOYSA-N	430.436	1.930	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccccc2OCc2cscn2)c1O	764132715	PXMCAVYMFWTHNM-UHFFFAOYSA-N	442.453	1.836	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccn(Cc3ccccc3)n2)o1	764138268	FXVFFIGRMPUSKY-UHFFFAOYSA-N	438.488	1.766	50	20	IDGD	
CC[C@H](C)NS(=O)(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2ccc(C#N)cc2)c1	764183542	ZVTKFVGMLYDJSK-ZDUSSCGKSA-N	443.485	1.035	50	20	IDGD	
Cc1ncsc1C(=O)NNC(=O)C(=O)Nc1ccc(OCc2noc(C3CC3)n2)cc1	764246532	JXHNSKKVGJZHDZ-UHFFFAOYSA-N	442.457	1.691	50	20	IDGD	
COC(=O)[C@@H]1CN(C(=O)C(=O)NNC(=O)c2cccc(OC(F)F)c2)c2ccccc2O1	764260340	VNUOPOCCNVGSHP-HNNXBMFYSA-N	449.366	1.016	50	20	IDGD	
CCOC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1	764351459	RTMMSTCHYHHWOF-UHFFFAOYSA-N	436.428	1.840	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)C(=O)Nc1cccc2c1CN(c1ccccn1)C2	764367716	LEHRAABVDDWMIB-UHFFFAOYSA-N	445.479	1.905	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1	764398173	DTUDXJHVNKTHSD-CQSZACIVSA-N	426.429	1.488	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)CCc2cncc3ccccc23)cc1	765326819	LXQSTAJNOADFBL-UHFFFAOYSA-N	440.525	1.944	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3ccc(-n4cccc4)nc3)CC2)cc1	765747811	HLCGOERWQIJPSU-UHFFFAOYSA-N	432.528	1.760	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1	766262362	XZMBXCLSNKREKM-MRXNPFEDSA-N	436.476	1.211	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCO[C@H](c3ccc(OC(F)F)cc3)C2)n1	766266248	IHPQSDFLXLEZDC-HNNXBMFYSA-N	440.472	1.816	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)NC1CCN([C@H]2CCCC[C@@H]2O)CC1	767936656	AMNREUKCMRIXGK-GJZGRUSLSA-N	428.331	1.489	50	20	IDGD	
CC(C)(C)[C@H](Br)C(=O)N(CCCN1CCOCC1)[C@H]1CCS(=O)(=O)C1	768032465	BCOGPKZLKODBHG-LSDHHAIUSA-N	439.416	1.534	50	20	IDGD	
COc1ccc(NNC(=O)CCC/N=C2/NS(=O)(=O)c3ccccc32)c([N+](=O)[O-])c1	768327973	MDOCZANYAIBDPO-UHFFFAOYSA-N	433.446	1.565	50	20	IDGD	
C[C@H]1CCC[C@H]1CC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	768964177	CEASIXOUHFRYDJ-WMZOPIPTSA-N	437.562	1.614	50	20	IDGD	
CSCCNC(=S)NNC(=O)c1nnn(-c2cccc(Br)c2)c1C	769768456	ANKFNYDYQKYTOS-UHFFFAOYSA-N	429.369	1.810	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)c3ccc(S(=O)(=O)NC4CC4)cc3)nc21	770969775	VXGCRSRZYHZWPM-UHFFFAOYSA-N	445.505	1.485	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNS(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-]	771609266	ZBNYNCMRHZPHEG-UHFFFAOYSA-N	447.256	1.528	50	20	IDGD	
COc1cc(C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)ccc1OC(C)=O	772019774	RKMKLAQKOUFWMX-UHFFFAOYSA-N	431.357	1.147	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)[C@H]1CCCN(Cc2cccnc2)C1	772885061	UHOVUNFNDXGXOK-KRWDZBQOSA-N	429.908	1.411	50	20	IDGD	
C[C@@H]1NC(C(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)=NN(c2ccccc2)C1=O	772963968	MSONKTFETDDOCF-QWHCGFSZSA-N	429.864	1.593	50	20	IDGD	
Cn1cc(Br)cc(NC(=O)C(=O)NNc2ncc(Cl)cc2Cl)c1=O	773677686	MUXKKZVELUSJQI-UHFFFAOYSA-N	435.065	1.931	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(NC(=O)C(=O)NNc2c(F)cccc2F)ccc1Cl	773713625	MHTWAAHNMIGKMR-UHFFFAOYSA-N	432.836	1.950	50	20	IDGD	
O=C(NNc1ncccn1)C(=O)Nc1cccc(CS(=O)(=O)c2ccc(F)cc2F)c1	773718218	BOPGXBNKCBOFTC-UHFFFAOYSA-N	447.423	1.811	50	20	IDGD	
O=C(NNc1ccc(C(F)(F)F)cc1)C(=O)Nc1cccc(CN2C(=O)CNC2=O)c1	773767027	HLYROMCALMTXEL-UHFFFAOYSA-N	435.362	1.839	50	20	IDGD	
Nc1nc(Cl)cc(NNC(=O)c2ccc(F)c(S(=O)(=O)N3CCCCC3)c2)n1	773862568	XQORDEBCHGMLQN-UHFFFAOYSA-N	428.877	1.783	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)NC(=O)[C@H](C)O2	774008470	JBXTZEKAPZUGIG-QWRGUYRKSA-N	446.847	1.613	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1cccnc1N1CCOCC1	774009054	NIDOAKCKIPJMKM-ZDUSSCGKSA-N	447.879	1.125	50	20	IDGD	
CC[C@@H](NCC(=O)NNC(=O)c1ccc(OC)c(OC)c1)c1ccc2c(c1)OCCO2	775203460	RWWHAKNXJDMDDO-MRXNPFEDSA-N	429.473	1.977	50	20	IDGD	
Cc1nn([C@H]2CCS(=O)(=O)C2)c(C)c1C=NNC(=O)CCNC(=O)OC(C)(C)C	779807700	KVUJEZPADCGWPL-AWEZNQCLSA-N	427.527	1.224	50	20	IDGD	
CSCCCCCCNC(=S)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	782190674	DXHMBZRCJWTMLN-UHFFFAOYSA-N	432.637	1.969	50	20	IDGD	
O=C(NNC(=O)N1CCC[C@H](n2ccc(C(F)(F)F)n2)C1)c1ccc(-n2cnnn2)cc1	782493595	QMBNQURJLKKAMB-AWEZNQCLSA-N	449.397	1.569	50	20	IDGD	
O=C(NNc1ccc(-n2cccn2)nn1)C(=O)Nc1ccc2nc(-c3ccccn3)oc2c1	783433655	XAMGHZUUCUJMAO-UHFFFAOYSA-N	441.411	1.947	50	20	IDGD	
Cc1nn(CC(C)C)c(C)c1S(=O)(=O)NNC(=O)C1CCN(c2ncccn2)CC1	783827090	ONFYPVQQFRKQBQ-UHFFFAOYSA-N	435.554	1.172	50	20	IDGD	
CC(C)n1cc2cc(NC(=O)C(=O)NNC(=O)CNC(=O)c3cccs3)ccc2n1	784003499	HKHGULSHISPSJF-UHFFFAOYSA-N	428.474	1.195	50	20	IDGD	
Cc1c(Cl)cc(NC(=O)C(=O)NNC(=O)CNC(=O)c2cccs2)cc1Cl	784005373	XTPIASMFPIKTAA-UHFFFAOYSA-N	429.285	1.879	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)[C@@H]1CC=CC[C@H]1C(=O)N1CCOCC1	784395086	XIZOZBXTCGSXCP-RTBURBONSA-N	448.545	1.012	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CC=CC[C@H]1C(=O)N1CCOCC1)c1cc(-c2cccs2)[nH]n1	784456279	LROUMACTUQDEHM-ZIAGYGMSSA-N	429.502	1.340	50	20	IDGD	
CCc1c(C(=O)NNC(=O)Cc2nc3ccccc3n2C)nnn1Cc1ccc(F)cc1	784675082	NLRQKEMPWOBEDV-UHFFFAOYSA-N	435.463	1.918	50	20	IDGD	
CC[C@H](C)NS(=O)(=O)c1cccc(NC(=O)C(=O)NNc2ccc(Cl)nn2)c1	784790397	ZCRWBRYFWBSVJW-JTQLQIEISA-N	426.886	1.289	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNc2ccnc(Br)c2)c(C)c1	784837534	WVGRFHLQTREUSZ-UHFFFAOYSA-N	437.250	1.786	50	20	IDGD	
CN1CCCCC/C1=N/S(=O)(=O)c1cccc(NC(=O)C(=O)NNc2cccnn2)c1	784862960	QWKILIMAAPLWGT-UQQQWYQISA-N	445.505	1.151	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)C(=O)Nc3cc(C(N)=O)ccc3C)n[nH]2)c1	785125218	BRKSOOHMGGQCES-UHFFFAOYSA-N	434.456	1.501	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1cc(CC(C)(C)C)nn1C	785338825	OKTINBIJHUNXID-UHFFFAOYSA-N	437.522	1.503	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNS(=O)(=O)c1cc(Cl)ccc1OCC1CCC1	786721327	CNDIOIGIDVPBGK-UHFFFAOYSA-N	441.893	1.851	50	20	IDGD	
CC(C)CN1C[C@H]2CN(C(=O)NNC(=O)[C@@H](C)Oc3cccc(Cl)c3)CCN2C1=O	787872197	GMCFIVYKFSAXLF-GDBMZVCRSA-N	437.928	1.926	50	20	IDGD	
CN1CCN(c2ccc(NC(=O)C(=O)NNc3cnccn3)cc2Br)CC1	787892469	ACSIXSCALIHWOF-UHFFFAOYSA-N	434.298	1.073	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)c(C)cc1C	788333899	QJBNCHFWCWCAIK-UHFFFAOYSA-N	435.383	1.848	50	20	IDGD	
Cc1nnnn1[C@H](Cc1ccc(F)cc1)C(=O)NNc1nnc(-c2ccccn2)s1	788554879	CQCIQYQNDUQJKH-OAHLLOKOSA-N	425.453	1.961	50	20	IDGD	
CCOC(=O)C1(CC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)CCC1	788756560	MEHMPYOMTYCXAK-UHFFFAOYSA-N	437.518	1.356	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1cccc2c1OCC[C@@H]2N(C)C	789740870	JWJMVQCQQBGDPR-UGSOOPFHSA-N	444.463	1.764	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1nc([C@@H]2C[C@H]3CC[C@H]2C3)cs1	789756901	HVIFHBIZCUYJOW-SDDRHHMPSA-N	447.542	1.624	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)c3nc(Br)ccc3Br)nc21	790639029	GEEOJMCNCVCUGD-UHFFFAOYSA-N	443.059	1.746	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)[C@H]2CCN(CC(F)(F)F)C2)cc1	792015426	WGOHCYGBZBVJKS-AWEZNQCLSA-N	442.467	1.753	50	20	IDGD	
CN(C)N(C(=O)c1cccc(-c2cnc3nc(O)n(C)c3c2)c1)[C@H]1CCS(=O)(=O)C1	792851494	XHHZCTYCSSYADQ-INIZCTEOSA-N	429.502	1.447	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)nc1Br	793024192	BDDLQLLNQMKQHB-UHFFFAOYSA-N	427.642	1.911	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1)C(=O)Nc1cccc(F)n1	793027168	YZIXYSJXPFHGJU-IBGZPJMESA-N	447.470	1.934	50	20	IDGD	
C[C@@H](CNC(=O)OC(C)(C)C)C(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	796514649	DYVSGFCIXXENTP-ZDUSSCGKSA-N	443.545	1.877	50	20	IDGD	
O=C(NNC(=O)c1ccc2ccccc2n1)C(=O)Nc1ccc(F)c(N2CCOC2=O)c1	796992564	WUTCFTOXARTXJT-UHFFFAOYSA-N	437.387	1.730	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN1C(=O)OCc1ccccc1)c1nnc(O)c2ccccc12	797701360	MFOJHEJZHRAVBG-QGZVFWFLSA-N	435.440	1.898	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)[C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])o2)cc1	802123754	SPZJNEGBJBAOJE-CQSZACIVSA-N	430.421	1.711	50	20	IDGD	
Cc1cc([N+](=O)[O-])ccc1NNC(=O)C1CCN(S(=O)(=O)c2cn(C)c(C)n2)CC1	805382248	BGGHDZNFDZZRGA-UHFFFAOYSA-N	436.494	1.489	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)Nc1ccc(C(=O)N2CCOCC2)c(F)c1	806440933	HOYZMTVEHJQHPI-UHFFFAOYSA-N	426.412	1.422	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)NC2C[C@@H]3CC[C@H](C2)N3CC(=O)N(C)C)c1C	807514705	NDQRWCWGKYSVPG-QBUWPKIASA-N	445.564	1.485	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)CNS(=O)(=O)c2ccc(Cl)c(Cl)c2)c1O	810190880	BPLZBVNBHWZZPW-UHFFFAOYSA-N	448.284	1.447	50	20	IDGD	
CC(C)CC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	810318094	PCWWYHPQXBFYTK-SFHVURJKSA-N	448.549	1.067	50	20	IDGD	
COC(=O)c1c(F)ccc(NC(=O)C(=O)NNC(=O)Cc2c[nH]c3ccccc23)c1F	810386346	VSIPOGBCDKSLCN-UHFFFAOYSA-N	430.367	1.561	50	20	IDGD	
CCCS(=O)(=O)Nc1cccc(C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)c1	812729801	VDOBORQHZAGKQW-UHFFFAOYSA-N	440.547	1.846	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)Nc2ccccc2CN2C(=O)CCC2=O)cc1	812927287	XCZYIOGZOUYTNH-UHFFFAOYSA-N	445.501	1.735	50	20	IDGD	
COC[C@@]1(C(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)CCN(C(=O)OC(C)(C)C)C1	813373835	JGURYFQCGQXWTL-JOCHJYFZSA-N	448.520	1.663	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)N[C@H]1CCN(c2ccccc2F)C1	813854360	ZPFHTWSLVTUIBB-ZDUSSCGKSA-N	434.497	1.342	50	20	IDGD	
C[C@H](Oc1ccccc1NC(=O)C(=O)NNC(=O)[C@H]1CCc2nncn2C1)c1ccccc1	815692477	RTJPXARNOGQLHI-RDJZCZTQSA-N	448.483	1.767	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1ccc(OC(F)F)cc1	815751705	KVPQSOIJTPUZEJ-UHFFFAOYSA-N	428.417	1.620	50	20	IDGD	
O=C(Cc1csc(-c2ccc(C(F)(F)F)cc2)n1)NNC(=O)[C@H]1CCS(=O)(=O)C1	818854260	ZEYOBMUUEZBXDH-NSHDSACASA-N	447.460	1.954	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)CCNC(=O)c2ccc(Br)cc2)cc1	913429756	YMLMUEZWPCLWPI-UHFFFAOYSA-N	449.305	1.837	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)cc1	914781561	KYXQERNVMSMWMN-UHFFFAOYSA-N	445.476	1.606	50	20	IDGD	
COc1cccc(C[C@H](C(=O)NNC(=O)c2cc(Br)c[nH]2)n2nnnc2C)c1	915686140	OPADHKCNFDSHLY-OAHLLOKOSA-N	448.281	1.326	50	20	IDGD	
CC(=NNC(=O)COc1ccc(C)cc1)c1ccc(S(=O)(=O)N2CCOCC2)cc1	916326880	WJYBWXCINOWWSF-UHFFFAOYSA-N	431.514	1.935	50	20	IDGD	
CC(=NNC(=O)c1nn(-c2ccccc2)cc1O)c1ccc(S(=O)(=O)N(C)C)cc1	916354824	JPTKPUPEKKOFCM-UHFFFAOYSA-N	427.486	1.982	50	20	IDGD	
CN1CCN(Cc2ccc(CNC(=O)NNC(=O)c3nnc(O)c4ccccc34)cc2)CC1	916388018	QGZZLNRVSRXHRG-UHFFFAOYSA-N	449.515	1.227	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NCc2ccccc2CN2CCCC2=O)c2ccccc2c1=O	916413449	DROXAMUZZKWPED-UHFFFAOYSA-N	448.483	1.200	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)N[C@H]3CCCc4occc43)nc2)CC1	916576229	PVSFKTZBRRHZHJ-INIZCTEOSA-N	434.522	1.314	50	20	IDGD	
COc1ccc(F)cc1[C@H](C)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	916590830	HUEYCKDYKBHQEI-LBPRGKRZSA-N	438.481	1.790	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2cccc(N3CCOC3=O)c2)c1	919658785	JNKFFOXZVLMVKV-UHFFFAOYSA-N	432.458	1.191	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)CN2C(=O)N[C@]3(C[C@@H](C)CC(C)(C)C3)C2=O)c1O	919756799	MCLKRQVYOIHREX-QKVFXAPYSA-N	432.477	1.299	50	20	IDGD	
C[C@@H](COc1ccc(F)cc1F)NC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	919922363	UXAICPSQABJFDO-NSHDSACASA-N	427.429	1.780	50	20	IDGD	
CCC(=O)N[C@H](C)C(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccc(C)cc2C)c1	920401025	PZPUCUJVEXSRLM-OAHLLOKOSA-N	446.529	1.780	50	20	IDGD	
O=C(NNC(=O)c1n[nH]cc1I)c1cc(-c2cccs2)[nH]n1	1116648349	AMSUMCQBTOLDAJ-UHFFFAOYSA-N	428.215	1.541	50	20	IDGD	
CCOc1ccccc1C(=O)N1CCC[C@H]1C(=O)NNC(=O)c1n[nH]c2c1CCCC2	1317820585	BZKWZALLZUZHGG-KRWDZBQOSA-N	425.489	1.753	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@](C)(C(=O)N2CC[C@@]3(CN(C(=O)[C@@H](F)Cl)CCO3)C2)C1	1778179569	QWOSUHHYLRLCHL-VOBQZIQPSA-N	447.935	1.998	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCc2nc(N)n[nH]2)C1	1779241485	PEYBQUBWIZPACH-OCBCSQNSSA-N	447.367	1.070	50	20	IDGD	
COc1ccc2[nH]cc(C(=O)N3CC[C@@]4(CN(C(=O)CO[Si](C)(C)C)CCO4)C3)c2n1	1780046255	VPNCEUSSUGVYDI-OAQYLSRUSA-N	446.580	1.867	50	20	IDGD	
CSCC[C@@H](O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@](C)(Cl)CCl)C1	1780714893	KJOMKJBVNPGLLO-DTTOXWODSA-N	441.421	1.851	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)c3nc4ccc(F)cn4n3)CCO2)C1	1781232601	LRDTZMMYPJKJJO-ZWKOTPCHSA-N	444.294	1.548	50	20	IDGD	
C[C@@H](Cc1ccco1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCC(=O)NN(C)C)C1	1782214416	QGLYBHFDQSRIOM-GEQKSPFYSA-N	448.564	1.345	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2	1783399945	LYZMPVTTXKCZII-QZTJIDSGSA-N	438.352	1.577	50	20	IDGD	
Cn1ncc(Br)c1C(=O)N1CCO[C@@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783947837	JRMCDTWYXMJJTP-CQSZACIVSA-N	440.125	1.430	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3COc4ccccc4O3)[C@H]2C1	1785043589	MOGDNMHDKXXITD-UNTXSKPGSA-N	438.908	1.060	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(S(C)(=O)=O)c(F)c3)C2)C1	1785227336	JOGVLDFJVSXJTO-KUHUBIRLSA-N	446.928	1.690	50	20	IDGD	
C[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCBr)[C@H]2C1)N1C[C@H]2C[C@H]2C1	1786406535	XBBBVDZAOYRSJY-LTAJLKHCSA-N	428.371	1.091	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)c3ccccc3)[C@H]2C1	1786672343	ZKZJHYGGVVIEOJ-RXBWTVHKSA-N	429.344	1.936	50	20	IDGD	
C=CC[C@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)[C@H]2C1	1787507780	SLXFJQKDGAVFNK-BQRDVNJZSA-N	429.521	1.312	50	20	IDGD	
C[C@H](Oc1ccccn1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]2C1	1789926927	LIGQGCJJDOOBQL-YGJAXBLXSA-N	444.301	1.519	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3C[C@H]4CC[C@@H]3O4)[C@H]2C1	1791089733	DHHMCGORYODJIU-YDLMYCGBSA-N	429.355	1.707	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cncn3-c3ccncc3)C[C@@H]21	1791252950	ZPOVOHDPXCHWLX-XPYUAMARSA-N	447.923	1.114	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4ncncc4c3)C[C@@H]21	1791253798	GTWORWSZVWYVIK-RMRDIRSESA-N	432.908	1.477	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)NC(=O)OC(C)(C)C)C2	1793452622	DMDCPDAGKAVOTM-IBEHDNSVSA-N	431.961	1.897	50	20	IDGD	
CC(C)(C)OC(=O)NC(C)(C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2	1793629451	UIRWCWLRPCXLOP-ZSBIGDGJSA-N	438.352	1.683	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnc(N(C)C)o1	1794603144	WZDOKMZUYDBUEJ-GFQSEFKGSA-N	429.315	1.117	50	20	IDGD	
C=CCC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Cl	1796367422	INJCBULANIZVML-JKJDWNRSSA-N	447.935	1.970	50	20	IDGD	
Cc1cc(NC(=O)CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CCBr)C3)no1	1796867660	MQGPZVJLHJOBKW-CLLJXQQHSA-N	427.299	1.735	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1c[nH]c2ncccc12	1796876942	QZTDZNHIYXMCEC-DJBIQUGXSA-N	425.258	1.457	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cn(C(C)(C)C)nn1	1798705756	JIMFCCWERDULNC-GUIRCDHDSA-N	442.358	1.267	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nnsc1C1CC1)C2	1799275517	UOKWSZQWXVYYDZ-UZTWBRENSA-N	433.361	1.855	50	20	IDGD	
COc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Br)c(O)c1	1799349351	XJGOQCBHDYMDMM-ANGCBRKESA-N	431.258	1.295	50	20	IDGD	
CC(C)[C@H](CNC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2	1800918833	MOGVYQNYDYYVKS-XFIYOXNOSA-N	449.951	1.907	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(OC)ccc1Cl)C2	1800982626	HQHKYBXOCDUMNY-CZAMWMTLSA-N	431.316	1.806	50	20	IDGD	
COC[C@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1CN(C(=O)OC(C)(C)C)C1)C2	1802273145	LGHBZGXNZLSZTA-FZKCQIBNSA-N	429.945	1.745	50	20	IDGD	
CC(=O)N[C@H](C)C(=O)N1CC[C@H](CNC(=O)[C@@H](C)CBr)[C@H]1c1cccnc1	1803015372	MAPHHSIUJTZDBH-NSNWQYSKSA-N	439.354	1.643	50	20	IDGD	
CCCNC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)[C@H](Cl)COC)[C@H]1c1cccnc1	1803449220	ZGEHMGQTXNFDPS-QKLQHJQFSA-N	438.956	1.648	50	20	IDGD	
Cc1noc(C)c1CC(=O)N1CCCC2(CCN(C(=O)c3cccc(B(O)O)c3)CC2)C1	1806762703	ZSJJCOPXXYCDAC-UHFFFAOYSA-N	439.321	1.059	50	20	IDGD	
Cc1nnc(CC(=O)NC[C@H]2CCN(C(=O)CO[Si](C)(C)C)[C@H]2c2cccnc2)o1	1807470835	MERJVKNYOSGMNB-UZLBHIALSA-N	431.569	1.873	50	20	IDGD	
Cn1ccc(CC(=O)NC[C@@H]2CCN(C(=O)CCBr)[C@@H]2c2cccnc2)n1	1807512044	BXIBCCNXNZEJCJ-HNAYVOBHSA-N	434.338	1.849	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)[C@@H](N)Cc2cccnc2)[C@@H]1c1cccnc1	1808362588	GXIYUBOCCODDLO-FYQPLNBISA-N	445.951	1.306	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CCn2ccnn2)[C@H]1c1cccnc1)[C@@H](F)Br	1808681547	VSRPKQJFJVDSBZ-CWRNSKLLSA-N	439.289	1.460	50	20	IDGD	
Cc1cc2nnc(C(=O)NC[C@@H]3CCN(C(=O)[C@H](F)Cl)[C@@H]3c3cccnc3)c(C)n2n1	1809185393	FQJVCTBBTYEUDO-QGTPRVQTSA-N	445.886	1.990	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC2(CCCN(C(=O)Cc3ccccc3)C2)CC1	1809211752	LYQWMCPLCRVZOM-UHFFFAOYSA-N	435.528	1.773	50	20	IDGD	
CCC1(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)CCC1	1809647529	QMLXNNNNRQSLHX-TZIWHRDSSA-N	435.333	1.661	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)c3cnccc3F)CC2)C1	1809966886	MGHHRDPNXWHEBD-UHFFFAOYSA-N	425.269	1.059	50	20	IDGD	
CCc1nc(C(=O)NC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)co1	1811013117	HCTWTUZFGJFHHF-HRAATJIYSA-N	442.520	1.325	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)c2cc(CO)on2)[C@H]1c1cccnc1	1811590938	CWYVCFXZRKUUKM-DETPVDSQSA-N	437.294	1.665	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)CN2CCCC2=O)[C@@H]1c1cccnc1	1812864888	QSLFVIWIPUVLKE-DHSIGJKJSA-N	437.338	1.493	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2cnccc2F)[C@@H]1c1cccnc1	1813070869	LRKUNOHLCFEUDD-IIBYNOLFSA-N	442.495	1.308	50	20	IDGD	
O=C(CN1C(=O)CSC1=S)N[C@@H]1CCc2nc(NC(=O)[C@H](F)Cl)sc2C1	1817132774	SCHNZFCUGAVSRN-KBUNVGBDSA-N	436.943	1.450	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@@H](F)Br)[nH]n1)c1cnc(O)nc1O	1818021536	YUPXPJFBTLLTJF-MWLCHTKSSA-N	443.233	1.607	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H]2CCCO2)[nH]n1	1818111919	PIDJPMDAXGALMY-URTUHSACSA-N	441.492	1.715	50	20	IDGD	
Cc1ccnc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)c1	1818190383	HUSSIZBUPKBXKQ-LJQANCHMSA-N	433.277	1.413	50	20	IDGD	
C[Si](C)(C)OCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CN1CCCCC1=O)CC2	1820169118	PSQZINBOVUDWFT-ZDUSSCGKSA-N	438.626	1.919	50	20	IDGD	
Cc1n[nH]c(C)c1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCC(=O)NN(C)C)CC2	1820317524	JZWJGZKHURNIIV-GFCCVEGCSA-N	433.538	1.082	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)c3ccccc3F)sc2C1	1821858981	CAONALRZSZMAHQ-LBPRGKRZSA-N	433.509	1.881	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](C)O)n[nH]1	1822175664	KWOSTPRWRXJWQS-MEDUHNTESA-N	445.432	1.930	50	20	IDGD	
C[C@H](C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1)N1C[C@H]2C[C@H]2C1	1822416087	NPVBAMIDDNVBNJ-CBZIJGRNSA-N	445.568	1.115	50	20	IDGD	
CO[C@@H](C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[nH]n1	1822450315	OPIZYLSPDKQTEE-WJROLRPUSA-N	429.481	1.571	50	20	IDGD	
CCS(=O)(=O)CC(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1	1822998333	CFBQIFGUVSZPGJ-WRWORJQWSA-N	442.332	1.180	50	20	IDGD	
CCNC(=S)NCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)C(C)(C)CCl)CC2	1824492900	PLRSSQUOBPHVMC-SNVBAGLBSA-N	432.015	1.804	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CC(F)(F)C(=O)O)CC2	1825642498	WITIJAKAASQYFF-RNFRBKRXSA-N	440.266	1.949	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](C)n1ccccc1=O)CC2	1826000595	YBYYTDPPPIWHHX-XQQFMLRXSA-N	438.937	1.732	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC([C@H]2CCCCN2C(=O)CN2CCOCC2)CC1	1826714277	NTDQMFUHZXLGKV-FUHWJXTLSA-N	444.414	1.969	50	20	IDGD	
C[C@@]1(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2ccc(B(O)O)cc2)CC3)CC=CCC1	1827221564	SDAIHAYQTUYPPT-OPAMFIHVSA-N	439.346	1.795	50	20	IDGD	
CC1CCN(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)CC1	1830353639	IEJWMQCXBCQGQZ-NRFANRHFSA-N	429.989	1.440	50	20	IDGD	
CC[C@H](C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2)N(CC)CC	1830354446	YZNVFTBDEMHGKC-DYESRHJHSA-N	432.005	1.828	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc4nc[nH]c34)C2)C1	1830358038	OKTBMDZSYTUSSC-NRFANRHFSA-N	434.924	1.898	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3=COCCC3)C2)C1	1830544463	YWWUJVFGQGODQB-KSSFIOAISA-N	431.327	1.168	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2cnc[nH]2)CC1	1832102408	MZHNRVXFLUTNNB-ZLQZBKBYSA-N	430.553	1.416	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)COc3cccnc3)CCO2)C1	1832679625	BJOBBHKHLDYWJW-MOPGFXCFSA-N	446.331	1.153	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)Cc3cccc(F)c3)CC2)CC1)[C@@H](O)CCl	1833308996	HZTYJBHCCQBXOD-IBGZPJMESA-N	425.932	1.540	50	20	IDGD	
COc1cc(C#N)cc(C(=O)N2CCC(N3CCC(NC(=O)[C@@H](O)CCl)CC3)CC2)c1	1833312668	VZOWAZUECXJPFM-FQEVSTJZSA-N	448.951	1.352	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(Cl)s3)CCO2)C1	1834059312	UIHANLNILAKOMU-YVEFUNNKSA-N	437.345	1.725	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCC(N2CCC(NC(=O)c3ccc(O)nn3)CC2)CC1	1834071071	PHVFZNKSMOXJKJ-IBGZPJMESA-N	444.363	1.604	50	20	IDGD	
O=C(COCc1ccccc1)NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1834608162	AQMHSAUBTFNMMF-FQEVSTJZSA-N	437.968	1.375	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@]3(CN(C(=O)CCBr)CCO3)C2)c(F)c1	1834824144	SUDUQTXLUNSMMV-IBGZPJMESA-N	443.313	1.989	50	20	IDGD	
O=C(/C=N/O[C@H]1CCCCO1)NC1CCN(C2CCN(C(=O)[C@@H](F)Cl)CC2)CC1	1835767600	GJSBEWDSHIZMFG-VTLOZCKBSA-N	432.924	1.621	50	20	IDGD	
CC(C)N(C)CC(=O)N1CCC(N2CCC(NC(=O)CO[Si](C)(C)C)CC2)CC1	1835838047	ZQYWATHLGBWMFQ-UHFFFAOYSA-N	426.678	1.750	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3ccc[nH]3)CCO2)C1	1836018139	XBVBUZSJRYKMDP-RDTXWAMCSA-N	428.327	1.187	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)Cc1cccs1)CCO2	1836089561	SYGHCHOMAXQEJF-LJQANCHMSA-N	426.611	1.599	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3cccs3)CCO2)C1	1836092058	OJRXUHAYBRTHIG-QAPCUYQASA-N	445.379	1.921	50	20	IDGD	
CCC(=O)N[C@@H](C)C(=O)N1CCC(OC2CCN(C(=O)CO[Si](C)(C)C)CC2)CC1	1836819078	YARRAUSRGDDIHX-INIZCTEOSA-N	441.645	1.751	50	20	IDGD	
Cc1nc2sccn2c1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1837143301	CBLVWUUYWAWPPG-DYVFJYSZSA-N	430.889	1.309	50	20	IDGD	
CCc1nc(C(=O)N2CCO[C@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)co1	1838135402	LKJKJFDBBVVCHY-IBGZPJMESA-N	425.558	1.159	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CC34CCCN3CCC4)CCO2)C1	1839118814	QWBOQIJPHAMHQU-DYESRHJHSA-N	427.973	1.479	50	20	IDGD	
CCCCC[C@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1	1839905811	XXJDALJXVPXVGW-PGRDOPGGSA-N	440.585	1.032	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccccc3O)CCO2)C1	1839909215	ZMEJEYJQAJSQJX-WOJBJXKFSA-N	445.343	1.627	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1CCCSC1)CCO2	1840865384	YSBUUYUYNHLMGE-VQIMIIECSA-N	430.643	1.438	50	20	IDGD	
CCc1nc2ccc(Cl)cn2c1C(=O)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1	1841351643	ZJQSLEIRDNISOF-AWEZNQCLSA-N	425.316	1.967	50	20	IDGD	
COC(=O)C[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)[C@H](F)Cl)C1	1843366825	SBVMGVJGCBVVOV-YPMHNXCESA-N	435.880	1.181	50	20	IDGD	
Cc1ccn2c(=O)c(C(=O)N3CCCC34CN(C(=O)[C@H](C)CBr)C4)cnc2c1	1843786335	AAQYJVOXUNSKBA-CQSZACIVSA-N	447.333	1.851	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)c2ncoc2C)C1	1844555198	VEOQNKSOEPTDBZ-UHFFFAOYSA-N	428.401	1.947	50	20	IDGD	
N#Cc1ccc(C(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)c(Cl)c1	1845488273	SCKPONBSVGOQAM-UHFFFAOYSA-N	438.875	1.341	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)COc1ccc(O)cc1	1847433434	VCTBRJCOGLJPIG-XLXMKANJSA-N	439.472	1.107	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CCc1cnc[nH]1	1848166727	IKCKKLPWAQNJCW-ROUUACIJSA-N	441.444	1.691	50	20	IDGD	
O=C(CNS(=O)(=O)c1cccs1)NNC(=O)COc1ccccc1-c1ccccc1	106029445	QTOIWTLTFCKIQR-UHFFFAOYSA-N	445.522	1.920	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)CNC(=O)c2cnc3ccccc3c2O)c1C	107526993	FNFISBQQIPQLMI-OAHLLOKOSA-N	436.468	1.902	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)/C=C\c1ccccc1)C(=O)NNC(=S)NC(C)(C)C	726136499	GPLFGYZTCPVEMQ-BMOGTNHUSA-N	444.648	1.992	50	20	IDGD	
O=C(NNC(=O)[C@@H]1C[C@H]2CCCC[C@H]2N1C(=O)c1ccc(F)cc1F)C(=O)N1CCCC1	726160902	NGIDUCMFSFZHJU-XWIAVFTESA-N	448.470	1.508	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)NCc2c[nH]nc2C)cc1	728191252	WAOCAFGFLNMQLZ-CXUHLZMHSA-N	433.472	1.689	50	20	IDGD	
C[C@H]1C[C@@H](C)CN(c2ccc(C(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)cc2[N+](=O)[O-])C1	728369896	WBPFIUUBACUVRE-VNHYZAJKSA-N	438.506	1.273	50	20	IDGD	
CCCN(CCC)C(=O)c1cccc(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c1	728513366	YUXYPWRYCTXCGQ-UHFFFAOYSA-N	435.488	1.999	50	20	IDGD	
O=C(CN1CCN(CC(=O)NC2CCCCC2)CC1)NNC(=O)c1ccccc1Cl	728572665	BIGAJNQYLZBGFQ-UHFFFAOYSA-N	435.956	1.168	50	20	IDGD	
O=C(CCCc1ccc2c(c1)CC(=O)N2)NNC(=O)CCN1CCN(c2ccccc2)CC1	729296876	KBDRTAGBHOXYSH-UHFFFAOYSA-N	449.555	1.864	50	20	IDGD	
CCN1CCC[C@H]1CN1C[C@@H](C(=O)NNC(=O)CSc2ccc(Cl)cc2)CC1=O	729626330	CBPOSYSLUFOULP-HOCLYGCPSA-N	438.981	1.912	50	20	IDGD	
CCn1c(NNC(=O)CSc2nnnn2CC(F)(F)F)nc2ccccc2c1=O	729965303	BMLYGZSHSDAFDC-UHFFFAOYSA-N	428.400	1.201	50	20	IDGD	
O=C(CNC(=O)NCc1ccc([N+](=O)[O-])cc1)NNC(=O)c1cccc(C(F)(F)F)c1	729971004	AQGHMJCRWMCBPO-UHFFFAOYSA-N	439.350	1.874	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1ccc(N2CCOCC2)c(F)c1	730206162	UAIVBCFVEMZEKB-UHFFFAOYSA-N	449.508	1.339	50	20	IDGD	
CN(CC(=O)NNC(=O)COc1ccccc1O)C(=O)c1ccc(Br)o1	730782926	XYYBOSJKWODDOD-UHFFFAOYSA-N	426.223	1.046	50	20	IDGD	
O=C(COc1ccccc1O)NNS(=O)(=O)c1cc(Br)cc([N+](=O)[O-])c1	731217132	VSENCIPUBAYKTG-UHFFFAOYSA-N	446.235	1.451	50	20	IDGD	
COc1ccc(-c2nn(CCC#N)cc2/C=C(\C#N)C(=O)NCc2nc[nH]n2)cc1OC	732116582	WGTAVNXKLFGOOT-OVCLIPMQSA-N	432.444	1.822	50	20	IDGD	
Cn1nnnc1SCCC(=O)NNc1cc(C(F)(F)F)nc(-c2cccnc2)n1	734257577	GHCSJWVVNRHVNO-UHFFFAOYSA-N	425.400	1.706	50	20	IDGD	
COc1ccc(CN2CC[C@H](NC(=O)NNC(=O)[C@H](C)Oc3ccc(F)cc3)C2=O)cc1	734682491	AZENGMNGRORFLS-LIRRHRJNSA-N	444.463	1.733	50	20	IDGD	
CCc1nc(C(=O)OCC(=O)NNC(=O)Cc2nc(C)cs2)nn1-c1ccccc1	735546934	DGSOSFUYZSPZIJ-UHFFFAOYSA-N	428.474	1.142	50	20	IDGD	
Cc1cc(NNC(=O)CN(C)S(=O)(=O)c2ccc(Br)cc2)nc(C)n1	736718027	CHMRRWCWSLASKI-UHFFFAOYSA-N	428.312	1.620	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)c1ccc(F)c(S(=O)(=O)N2CCCCC2)c1	737634847	OLFXJNIDUVNILS-UHFFFAOYSA-N	449.504	1.978	50	20	IDGD	
O=C(CC[S@@](=O)c1ccc2c(c1)OCCO2)NNC(=O)c1ccc2ccccc2n1	740748906	CXCIRDUIYDTVIL-SSEXGKCCSA-N	425.466	1.965	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)COc1ccc(F)cc1)[C@H]1CN(Cc2ccccc2)CCO1	741436002	SSXMNBPRDZATSW-OXJNMPFZSA-N	430.480	1.824	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)[C@H](C)NC(=O)c2cc3c(C)nn(C)c3s2)c1	742033185	JSELBEIWIPJCFO-ZDUSSCGKSA-N	429.502	1.596	50	20	IDGD	
Cc1nn(C)c2sc(C(=O)N[C@H](C)C(=O)NNC(=O)c3ccc4c(c3)OCCO4)cc12	742041970	XTSGBHHZKFTODL-LLVKDONJSA-N	443.485	1.294	50	20	IDGD	
O=C(COCC(=O)NNc1c(F)cc(F)cc1Br)NCc1cccnc1	742108461	SLBSKIVIWUOLPB-UHFFFAOYSA-N	429.221	1.898	50	20	IDGD	
Cc1noc(C)c1S(=O)(=O)NC1(C(=O)NNC(=O)c2cccc(N(C)C)c2)CCCC1	742240209	LCHVINYUAFVSDF-UHFFFAOYSA-N	449.533	1.410	50	20	IDGD	
CC(C)c1nn([C@@H]2CCS(=O)(=O)C2)cc1C(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	742463227	PGCYOISUQTUMCL-CQSZACIVSA-N	435.462	1.349	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)cc(NC(C)=O)c1OC	742472063	JSZPQRFHAYYUJQ-UHFFFAOYSA-N	447.444	1.763	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)N(C)CCCC(=O)NNc2ncnc3[nH]cnc23)cc1	743472731	DNMDBFSKXRFBPH-UHFFFAOYSA-N	431.478	1.100	50	20	IDGD	
COc1cccc(O[C@H](C)CNC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)c1	743509617	IEYGFPXUIATNRV-CYBMUJFWSA-N	449.533	1.708	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)c2c[nH]cc2-c2ccc3c(c2)OCCO3)cc1	745300333	WIEJPWWTLHYHKJ-UHFFFAOYSA-N	446.419	1.943	50	20	IDGD	
CCOCC(=O)NNC(=O)N[C@@H](c1ccc(OC)cc1)c1cccc(S(C)(=O)=O)c1	745914265	JSSWUGPAKFUCCC-IBGZPJMESA-N	435.502	1.555	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)C(C)(C)NC(=O)Nc2ccccc2)c1	746093089	BVVHESWXPDZXFH-UHFFFAOYSA-N	447.517	1.298	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)C1CCN(C(=O)c2ccc(F)cc2F)CC1	746553957	SVWAMCVVOWVAAB-UHFFFAOYSA-N	441.438	1.855	50	20	IDGD	
COc1cc(C)nc(NNC(=O)c2cn(C3CCN(C(=O)OC(C)(C)C)CC3)nn2)n1	746631072	TWBUZFRJWAKWQX-UHFFFAOYSA-N	432.485	1.714	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)c2ccc(Cl)cc2F)cc1	747621234	QQLGKROWWFGQGV-UHFFFAOYSA-N	435.886	1.353	50	20	IDGD	
CCOCC(=O)NNC(=O)N[C@H](CNS(=O)(=O)c1ccc(C)cc1C)c1ccccc1	747952937	FAKIONFEJFQCRC-GOSISDBHSA-N	448.545	1.690	50	20	IDGD	
O=C(NNc1cccc([N+](=O)[O-])c1)c1ccc2c(c1)S(=O)(=O)N(C[C@@H]1CCCO1)C2=O	747995051	MHMNSTNFPBYAEL-HNNXBMFYSA-N	446.441	1.675	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)[C@H]2CC(=O)N(c3cn[nH]c3)C2)cc(OCC)c1OCC	748524838	ZZCRMSBYGSXHLB-AWEZNQCLSA-N	445.476	1.420	50	20	IDGD	
Cc1cc(C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)cc(S(N)(=O)=O)c1C	748609957	GKOCXFWAOMYYTE-UHFFFAOYSA-N	433.458	1.704	50	20	IDGD	
NS(=O)(=O)Cc1cccc(C(=O)NNC(=O)c2ccc(COc3ccccc3)o2)c1	749403950	UDKWGJRJAVSODF-UHFFFAOYSA-N	429.454	1.722	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)c1nnn(-c2ccc(F)cc2)c1C(F)(F)F	751199719	QZIHDTVVHXZLHI-UHFFFAOYSA-N	440.313	1.209	50	20	IDGD	
CC(=O)N1CCN(c2ccc(C(=O)NNC(=S)N[C@@H](C)C3CC3)cc2[N+](=O)[O-])CC1	751617504	BGDKBMJFWJFQDD-LBPRGKRZSA-N	434.522	1.171	50	20	IDGD	
COc1cc(C(=O)NCC(=O)NNc2nc3ccccc3c(=O)n2C)ccc1OC(F)F	752909422	VRVZQWHTUYADQX-UHFFFAOYSA-N	447.398	1.417	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2cc(N)cc(Br)c2)n1	753393912	UNQXOSLVGGIBRE-UHFFFAOYSA-N	427.280	1.343	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)NC2CCN(S(=O)(=O)C3CC3)CC2)c1C	753789457	MDRKNTQSCPAMJX-QGOAFFKASA-N	434.562	1.731	50	20	IDGD	
CC(=O)NC[C@H]1CCn2ncc(C(=O)NNc3nc(-c4ccccn4)nc4c3CCC4)c2C1	754245753	LCLONFOYKLISCL-HNNXBMFYSA-N	446.515	1.679	50	20	IDGD	
Cc1cc(C)c(S(=O)(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)cc1[N+](=O)[O-]	755020725	VVGLUJILNHOIQA-UHFFFAOYSA-N	430.483	1.826	50	20	IDGD	
COC(=O)CNC(=O)Cc1ccc(NC(=O)NNC(=O)COc2ccc(C)c(C)c2)cc1	755863289	AUYFDIMAZBXCTD-UHFFFAOYSA-N	442.472	1.367	50	20	IDGD	
CNC(=O)Cn1ccc2ccc(NC(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)cc21	756757438	BXIKHJXHRJAKSI-UHFFFAOYSA-N	446.508	1.845	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)Nc1ncn(CC(=O)N(C)C)n1	756769273	DKZZLPDZECVFHK-UHFFFAOYSA-N	428.478	1.265	50	20	IDGD	
Cn1cc(C#N)c(NC(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)n1	756870773	LUZVDUVWIWZHQH-UHFFFAOYSA-N	445.486	1.621	50	20	IDGD	
CS(=O)(=O)Cc1cc(F)ccc1NC(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	757677094	FWGWORJJCPSPMZ-UHFFFAOYSA-N	447.448	1.728	50	20	IDGD	
CS(=O)(=O)CCc1ccc(NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1	757747506	AOTGUMGLVKISLM-UHFFFAOYSA-N	439.515	1.144	50	20	IDGD	
O=C(CCNc1ncc(C(F)(F)F)cc1Cl)NNC(=O)C(=O)Nc1ccccn1	758839917	GRRYAXPNVQADNQ-UHFFFAOYSA-N	430.774	1.737	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCc2nnc(C(C)(C)C)s2)c2ccccc2c1=O	758878564	FHCQVYLTZDRBBC-UHFFFAOYSA-N	429.506	1.710	50	20	IDGD	
CC[C@@H]1CN(CC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)CCN1Cc1ccccc1	759892140	VLXPZMFENGJHEC-LJQANCHMSA-N	425.489	1.952	50	20	IDGD	
Cn1c(NNC(=O)[C@](C)(O)CN2C(=O)C(C)(C)c3ccccc32)nc2ccccc2c1=O	760328833	IRVBERCJZMMPIH-HSZRJFAPSA-N	435.484	1.452	50	20	IDGD	
CCC1CCC2(CC1)NC(=O)N(CC(=O)NNC(=O)CSc1ccccc1OC)C2=O	762362350	YFLDVWAHTVZQDO-UHFFFAOYSA-N	448.545	1.826	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(OC(F)(F)F)cc1Br)N1CCOCC1	762472523	UDXCYXLJJYSVSR-UHFFFAOYSA-N	448.217	1.583	50	20	IDGD	
CCOc1ccc(OCc2ccc(C(=O)NNC(=O)[C@@H]3CN4CCCN3CC4)cc2)cc1	763337119	DSZCLVBIEDCHFG-QFIPXVFZSA-N	438.528	1.815	50	20	IDGD	
CC(C)(C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1	763470929	AUMYOHKSNYGIAB-UHFFFAOYSA-N	427.417	1.523	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)C(=O)Nc1ccccc1OC[C@@H]1CCCCO1	763550368	DTWXXTCVUJSWTH-HNNXBMFYSA-N	441.440	1.763	50	20	IDGD	
Cc1ccc(NC(=O)C2CC2)cc1NC(=O)C(=O)NNC(=O)[C@H]1COc2ccccc2O1	763570592	GQRDAZFUHHLCAO-GOSISDBHSA-N	438.440	1.269	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)Nc1ccn(-c2ccccc2Cl)n1	763571009	KABPINCYTMPYKV-MRXNPFEDSA-N	441.831	1.452	50	20	IDGD	
COCCCOc1cccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)c1	763615237	YURINESJZFIOHM-UHFFFAOYSA-N	437.456	1.892	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cccnc2N2CCOCC2)c2ccccc2n1	763615261	MMUIQIWPGILLFY-UHFFFAOYSA-N	434.456	1.175	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2ccc(Cl)c(C(=O)N(C)C)c2)c1	763665852	PNPQNWVSNGZMJY-UHFFFAOYSA-N	446.891	1.824	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2ccc(Cl)cc2C)c2ccccc2c1=O	763787376	YUCGSVLIDYPJDI-UHFFFAOYSA-N	427.848	1.778	50	20	IDGD	
Cc1ccc(F)c(NC(=O)C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1	763796614	REOIEFGKCDYFRX-UHFFFAOYSA-N	448.476	1.318	50	20	IDGD	
CCOC(=O)/C=C\c1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)cc1	763812021	BEXTUDYQROWKKK-XFXZXTDPSA-N	436.424	1.299	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccc(CN2CCCC2=O)cc1	763865840	RMDHJCWEMJUGSR-CQSZACIVSA-N	442.447	1.502	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccnn2Cc2ccccc2)cc1	763876539	GUTCUCXDHQHXTM-MRXNPFEDSA-N	449.467	1.687	50	20	IDGD	
COc1ncc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCCCCC3)cc1C(N)=O	763911831	OKVBUHLDYKLHKU-UHFFFAOYSA-N	445.501	1.309	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)cnn1-c1ccccc1	763995206	OIZHICLANOGWMU-UHFFFAOYSA-N	431.250	1.671	50	20	IDGD	
Cc1cc(I)ccc1NC(=O)C(=O)NNC(=O)c1cccn1C	763999602	VNXZPPXKIFMWFY-UHFFFAOYSA-N	426.214	1.338	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)c2cnccn2)sc2c1CCCS2	764030631	DUBIILKRSYXIDR-UHFFFAOYSA-N	435.487	1.153	50	20	IDGD	
CC(=O)N(Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)nc2)cc1)C1CC1	764099546	BCNLCXIXRJKZAR-UHFFFAOYSA-N	429.864	1.646	50	20	IDGD	
O=C(CC(F)(F)F)NNC(=O)C(=O)Nc1ccc(CC(=O)N2CCc3ccccc32)cc1	764113465	ZQXOCZKHLNXOTC-UHFFFAOYSA-N	448.401	1.857	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2ccc3c(c2)NC(=O)CS3)cc1	764126160	FZLOBSNRSJETAS-UHFFFAOYSA-N	428.470	1.458	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2cccc(NC(=O)[C@H](C)OC)c2)cc1	764128113	ZPPIQPQJEKXKOP-AWEZNQCLSA-N	442.472	1.387	50	20	IDGD	
C[C@@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3ccc(C#N)cc3)cc2F)C[C@@H](C)O1	764177329	OOUYIFWVGMCLDW-ZIAGYGMSSA-N	439.447	1.711	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1ccc2c(c1)OC1(CCCC1)O2	764278046	PXMULZLVCRQHHY-UHFFFAOYSA-N	427.413	1.599	50	20	IDGD	
Cc1cc(-c2nc3cc(F)ccc3n2C)ccc1NC(=O)C(=O)NNC(=O)Cc1cc[nH]n1	764285326	AFRXQWDPSFUKMF-UHFFFAOYSA-N	449.446	1.740	50	20	IDGD	
CS(=O)(=O)c1c(Cl)cccc1NC(=O)C(=O)NNC(=O)c1cc2ccccc2o1	764341375	GKMCLERPWDTPMB-UHFFFAOYSA-N	435.845	1.889	50	20	IDGD	
CN1CCCN(c2ccc(NC(=O)C(=O)NNC(=O)c3cc4ccccc4o3)cc2)CC1	764343299	TTWKVHVIVQIYQA-UHFFFAOYSA-N	435.484	1.974	50	20	IDGD	
CC(=O)N(Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)cc1)C1CC1	764349992	WUCKIETVAHUKEQ-UHFFFAOYSA-N	444.875	1.956	50	20	IDGD	
C[S@@](=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)cc1F	764387238	GWSLVDWAXMKRCH-WJOKGBTCSA-N	447.423	1.492	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1ccccc1-n1cncn1	764396879	CYKNVJBGQXRFIN-UHFFFAOYSA-N	426.458	1.154	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(-c2cn3ccccc3n2)cc1	764398810	XELAHHOQFFMIDU-AWEZNQCLSA-N	425.445	1.139	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(Br)cc1C(C)C	764399899	NIGVXFGLMLYMMQ-LLVKDONJSA-N	430.299	1.710	50	20	IDGD	
O=C(CO)NNC(=O)C(=O)Nc1ccc(Oc2ccccc2Br)c(Cl)c1	764422137	PYRBBNMHJAXZRV-UHFFFAOYSA-N	442.653	1.973	50	20	IDGD	
CC(C)(C)OC(=O)N1CCO[C@@H](C(=O)NNC(=O)c2cccc(Br)c2)C1	765487138	FEKCQPDPUVPSFK-CYBMUJFWSA-N	428.283	1.846	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)c2cn(Cc3cccc(F)c3)nn2)n[nH]1	765598830	BDKUSNDSFXFKAY-UHFFFAOYSA-N	435.419	1.939	50	20	IDGD	
COc1ccc(OC)c(C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)c1	765753000	UEQCLJFPXPIZGJ-UHFFFAOYSA-N	446.935	1.936	50	20	IDGD	
COc1cccc(CC(=O)N2CCc3ccc(NC(=O)C(=O)NNc4cnccn4)cc32)c1	766258554	HTOXCDNDXZZASE-UHFFFAOYSA-N	446.467	1.699	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NC2C[C@@H](C)O[C@H](C)C2)c1	768120139	AHIJLXBKVGBDQO-ZIAGYGMSSA-N	426.539	1.617	50	20	IDGD	
CCCS(=O)(=O)N1CCCC[C@@H]1C(=O)NNC(=O)c1cc(-c2ccccc2OC)[nH]n1	768273934	KWUGCSUDSXQBDZ-QGZVFWFLSA-N	449.533	1.441	50	20	IDGD	
CCc1nc(C(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)nn1-c1ccccc1F	772194757	DEVSDERNTKGWSJ-UHFFFAOYSA-N	444.854	1.700	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)c1ccc(N2CCC(O)CC2)cc1	772892826	TYWUHAQYYIPEFR-UHFFFAOYSA-N	430.892	1.379	50	20	IDGD	
C[C@H]1CN(C(=O)c2ccc(NC(=O)C(=O)NNc3ccc([N+](=O)[O-])cc3)cc2)C[C@@H](C)O1	773643703	FGKKGQGZBPTBRI-OKILXGFUSA-N	441.444	1.926	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@@H]2CCc3cc(O)ccc3C2)cc1	775083837	ZKAVOEDALJMVOH-QGZVFWFLSA-N	446.529	1.209	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@H]2CCC[C@@H]2OC)c1	775461236	UXEJKXVFRVEXEG-WBVHZDCISA-N	426.539	1.476	50	20	IDGD	
CCOC(=O)N1CCC[C@H]([C@H](C)NC(=O)NNC(=O)Cc2nc3ccccc3n2C)C1	777266718	QHDWVBWJZQJYJS-GJZGRUSLSA-N	430.509	1.703	50	20	IDGD	
COc1cc(OC)c(Cn2nccc2NC(=O)NNC(=O)c2c[nH]nc2C)c(OC)c1	779482742	LVNHTTUUPXSADK-UHFFFAOYSA-N	429.437	1.455	50	20	IDGD	
CCCCCCOc1ccc(C(=O)NNC(=O)NCC2CN(S(C)(=O)=O)C2)cc1	779696140	CPWVESQSXHKOIL-UHFFFAOYSA-N	426.539	1.481	50	20	IDGD	
COc1cccc(-c2noc(SCC(=O)NNC(=O)[C@@H]3COc4ccccc4O3)n2)c1	781070427	IEWUWIUQZZGSCB-INIZCTEOSA-N	442.453	1.825	50	20	IDGD	
Cc1cc(C)cc(NNC(=O)C(=O)Nc2ccc(N3CCN(C(=O)C4CC4)CC3)nc2)c1	783359050	IFTGLJSBPNDUCY-UHFFFAOYSA-N	436.516	1.839	50	20	IDGD	
CSc1nc(O)nc(C)c1C(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	783705280	VRTYCDIETZGAKO-UHFFFAOYSA-N	440.526	1.462	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NN=C2CCOc3c2cc(F)cc3[N+](=O)[O-])c1	783798273	FGNPNLCIOBBIKC-UHFFFAOYSA-N	436.421	1.901	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1ccc(Cl)c2cccnc12	784003504	HMWZOBBIMZQSSX-UHFFFAOYSA-N	431.861	1.466	50	20	IDGD	
CN(C)C(=O)COc1cccc(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2Cl)c1	784381879	OODJKARUNOYPEY-UHFFFAOYSA-N	435.824	1.797	50	20	IDGD	
Cc1cc2c(cc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)C(F)F)cc1)OCO2	784833929	TWXPHSOZKRCDFJ-UHFFFAOYSA-N	427.385	1.802	50	20	IDGD	
CC[C@@]1(C)Oc2ccc(NC(=O)C(=O)NNC(=O)c3cc([N+](=O)[O-])ccc3O)cc2O1	785993336	DCLLEPCSBUGSMJ-IBGZPJMESA-N	430.373	1.598	50	20	IDGD	
CN(C)[C@@H]1CCOc2c(NC(=O)C(=O)NNC(=O)c3ccc4c(c3)OCO4)cccc21	789729849	JXFJLIKYXHUUAV-OAHLLOKOSA-N	426.429	1.200	50	20	IDGD	
CC(C)Oc1cc(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)ccc1C(N)=O	789731682	FURJZLRNSZGLDC-UHFFFAOYSA-N	448.863	1.391	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)c1nc(Br)ccc1Br	790561447	NXESSQDGZSDBMW-UHFFFAOYSA-N	446.055	1.391	50	20	IDGD	
CS(=O)(=O)N1CCc2c(NC(=O)C(=O)NNc3cccc(F)c3[N+](=O)[O-])cccc21	790996808	GBJSUPHSANGEDJ-UHFFFAOYSA-N	437.409	1.138	50	20	IDGD	
COc1ccc(OC)c(C2=NO[C@@H](C(=O)NNC(=O)[C@@H]3COc4ccccc4O3)C2)c1	791450958	ZOJWGNLJLSJYGB-MOPGFXCFSA-N	427.413	1.184	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3ncccc3Br)CC2)cc1	793680592	FQBNVBUTGDUDRC-UHFFFAOYSA-N	446.349	1.731	50	20	IDGD	
COC(=O)c1cc(F)c(Br)cc1NC(=O)C(=O)NNC(=O)OC(C)(C)C	797011541	KZVAMCOZHSOXNC-UHFFFAOYSA-N	434.218	1.869	50	20	IDGD	
Cc1cc(O[C@H]2CCN(C)C2=O)ccc1NC(=O)NNC(=O)COc1ccccc1O	799240555	JMKLABJEILVPMA-SFHVURJKSA-N	428.445	1.542	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)C2CCN(C(=O)N(C)C)CC2)c(OC)cc1Cl	802083352	IXDBVFYAKKULIM-UHFFFAOYSA-N	427.889	1.904	50	20	IDGD	
COc1ccc(C2=NO[C@@H](CNC(=O)NNC(=O)c3cc([N+](=O)[O-])ccc3O)C2)cc1C	802357900	XHKDPIKEWXUOPS-CQSZACIVSA-N	443.416	1.755	50	20	IDGD	
COc1cccc(C2(C(=O)OCC(=O)NNC(=O)[C@H]3COc4ccccc4O3)CC2)c1	803791579	DBJPRPXOSROIJI-GOSISDBHSA-N	426.425	1.257	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2c(C)c(C(F)(F)F)nn2C)c2ccccc2c1=O	806422744	CSFKVZPQSDKOOS-UHFFFAOYSA-N	437.382	1.944	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)nn1-c1ccc(F)cc1F	808933597	PRNVYNFYPOCHMB-UHFFFAOYSA-N	444.354	1.767	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)CNS(=O)(=O)c1c(C)c(C)cc(C)c1C	810193102	COIBBHCDYMGGDW-UHFFFAOYSA-N	433.530	1.597	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2cc(N(C)C)ncn2)c1	810220035	OMOXCZWKQRDEDR-UHFFFAOYSA-N	435.510	1.040	50	20	IDGD	
CN(C(=O)OC(C)(C)C)c1ccc(C(=O)NNC(=O)CNC(=O)c2cccnc2)s1	810572451	SDRGYYAVDVHYOB-UHFFFAOYSA-N	433.490	1.705	50	20	IDGD	
COC(=O)Cc1occ(C)c1C(=O)NNC(=O)c1cc(-c2ccc(OC)c(OC)c2)[nH]n1	810584681	VJMQTVLKKJCTNL-UHFFFAOYSA-N	442.428	1.786	50	20	IDGD	
CC(=O)Nc1cc(NC(C)=O)cc(C(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)c1	812499861	NEXAHZWHMDOGEW-UHFFFAOYSA-N	446.847	1.875	50	20	IDGD	
C=CCNS(=O)(=O)c1cccc(C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)c1	812729945	XBYCHMCRSDNGFU-UHFFFAOYSA-N	438.531	1.158	50	20	IDGD	
O=C(NNC(=S)NC1CCC1)c1cc(S(=O)(=O)NCc2ccccc2)ccc1O	814190691	BUGLMRYHBMSNFA-UHFFFAOYSA-N	434.543	1.532	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)c2c(C)nc3ccccn23)cc1)[C@@H]1C[C@@H]1C	815564378	HJJNHRKRIIZKFK-SCLBCKFNSA-N	448.483	1.804	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNc2cccc(Cl)n2)cc(S(C)(=O)=O)c1	815728252	WTZBCLIJGRGUKI-UHFFFAOYSA-N	440.865	1.397	50	20	IDGD	
Cc1ccc(-n2cnnc2SCC(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1	876481376	YMJRNPCBEIYHAF-UHFFFAOYSA-N	425.470	1.900	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)CCNS(=O)(=O)/C=C/c1ccccc1	913463221	XUHIPHWQRWCSOR-FYWRMAATSA-N	431.514	1.756	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)COc1cccc([N+](=O)[O-])c1	914909527	RLMBEWGZZRGULF-UHFFFAOYSA-N	437.792	1.640	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)C1(c2ccccc2)CCOCC1	915188733	NDTYMZCHZWTGAQ-UHFFFAOYSA-N	430.530	1.798	50	20	IDGD	
CC1=NN(c2ccc(C(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)cc2)CC1	915356821	ZLRHWBOVGFQWTB-UHFFFAOYSA-N	429.502	1.598	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)NCc2ccc(N3CCN(C)CC3)nc2)c1	916247304	ONBRXXHYOCCUJE-UHFFFAOYSA-N	426.521	1.360	50	20	IDGD	
CN(CC(=O)NNC(=O)[C@H]1COc2ccccc2O1)C(=O)c1ccc(Br)o1	917390788	JMHBFYOAIFZOEK-CYBMUJFWSA-N	438.234	1.102	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc([N+](=O)[O-])c(Br)c1)c1ccc2c(c1)OCO2	918145503	BIQXJYAULZUMGC-UHFFFAOYSA-N	444.219	1.709	50	20	IDGD	
O=C(CN1CCC(NC(=O)Nc2ccccc2)CC1)NNC(=O)c1ccc([N+](=O)[O-])cc1	919802830	AKIYQYGKVYSRPL-UHFFFAOYSA-N	440.460	1.642	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)c2ccc(S(=O)(=O)NCCC#N)cc2)cc1	919835868	SIVFGCIQSUOUPH-UHFFFAOYSA-N	430.486	1.281	50	20	IDGD	
O=C(CN1c2cccc3cccc(c23)S1(=O)=O)NN=Cc1cc2c(cc1O)OCO2	920368074	GFBNMNILCGFXMN-UHFFFAOYSA-N	425.422	1.933	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)CSc2nc3ccccc3[nH]2)cc1	1116432815	LTSOPYBVLVWZHI-UHFFFAOYSA-N	447.542	1.432	50	20	IDGD	
O=C(NNC(=O)c1cncn1-c1ccccc1)NC1CCN([C@@H]2CCCC[C@@H]2O)CC1	1324087207	KAQCANIFWHLUAQ-QUCCMNQESA-N	426.521	1.584	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@H](C)C(=O)NNC(=O)[C@@H]1CCCCN1S(C)(=O)=O	1337223243	RRFBRPIUGFTECQ-HIFRSBDPSA-N	431.942	1.686	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4c(c3)n(C)c(=O)n4C)C2)C1	1777864946	QXMKJRIFTUQTBR-AOMKIAJQSA-N	448.951	1.728	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](N)Cc2cccnc2)C1	1778053627	OOWGUADAKBMZDY-PSHVLCQKSA-N	436.984	1.873	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc3n(n2)CCC3)C1	1779123563	IONVBJYLKQPCGM-VVFCZOMOSA-N	439.354	1.740	50	20	IDGD	
C[C@H](C(=O)N1CC[C@@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1)N1CSCSC1	1779148299	XSWFJIYJPKWXTN-CRAIPNDOSA-N	447.699	1.711	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cn(C(C)(C)C)nn2)C1	1780195204	PRSHJUYTVHGDDC-AKCHCHLHSA-N	441.960	1.414	50	20	IDGD	
COc1cnc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](F)Br)C2)cn1	1780771969	XKSLIDGCYCLEGP-HACGYAERSA-N	445.289	1.303	50	20	IDGD	
CC(=O)N(C)[C@@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Br)C1	1780773786	WMJJIQYRGXQLNW-ZCTGUTNYSA-N	436.322	1.058	50	20	IDGD	
CC(C)c1nc(CC(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)no1	1781325577	FUDGKZLGJIRRKC-CZUORRHYSA-N	433.278	1.256	50	20	IDGD	
C[C@H](Oc1ccccn1)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781335056	ROVHFLJFTKGFEL-JDFRZJQESA-N	430.274	1.369	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](NC(C)=O)C(C)(C)C)C2	1782172483	VUODDAWNKQZCAS-BIZBXSGISA-N	445.988	1.305	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Br)C2	1782177950	BLKYUMIHCZSFFQ-OZTPJHRESA-N	429.714	1.445	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3n[nH]c4ccc(C#N)cc34)C2)C1	1782198881	XRGAUIGRVAEHNJ-BUXKBTBVSA-N	446.305	1.661	50	20	IDGD	
Cc1cc2cc(C(=O)N3CC[C@@]4(CN(C(=O)CCC(=O)NN(C)C)CCO4)C3)ccc2[nH]1	1782540737	QTVLFXVDTFNQMG-HSZRJFAPSA-N	441.532	1.293	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc4n(n3)CCCN(C)C4)C2)C1	1782559017	MDKXEEHDQDEFRR-LAUBAEHRSA-N	437.972	1.570	50	20	IDGD	
O=C([C@H](F)Cl)N1CCO[C@@]2(CCN(C(=O)[C@H]3Cc4[nH]nc(C(F)(F)F)c4C3)C2)C1	1782847013	KJPPSPUAJOOUTF-SULUZNBOSA-N	438.809	1.508	50	20	IDGD	
C/C=C(/C)C(=O)N1CC[C@@]2(C1)CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)CCO2	1783081769	SHVDXZSQTZAMIB-ITJNAYANSA-N	431.445	1.930	50	20	IDGD	
C=C(C(=O)N1CC[C@]2(C1)CN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)CCO2)C(F)(F)F	1783205175	NHDZFKHNDOXOTK-VQXFCIMOSA-N	441.410	1.069	50	20	IDGD	
COc1cccc(OC)c1C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](C)Br)C2)C1	1783536260	FRIRDAVGMMNEBO-DJJJIMSYSA-N	441.322	1.931	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cnc4ccc(F)cn34)CCO2)C1	1783538123	WICAOVNFNRYZBY-KPZWWZAWSA-N	439.285	1.700	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)Cc3ccc(OC)c(O)c3)CCO2)C1	1783867749	AEMNOHBMECFAHX-FOIQADDNSA-N	426.897	1.027	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cc(-c4ccccc4)[nH]n3)CCO2)C1	1783882327	QEOSRAJMUJPWML-IIBYNOLFSA-N	432.908	1.774	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]3C2)nc1	1783965508	MNHXIMJGZNAPKC-RMRKRWHISA-N	440.338	1.715	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)CCCn3ccnc3C)C2)C1	1784411942	MIAZYSVNYAOOEA-QFBILLFUSA-N	441.370	1.975	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(Cl)nn3)C[C@@H]21	1786406579	YRZPXRDQEBNRJJ-GVXVVHGQSA-N	431.718	1.508	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC1(c2ccc(NC(=O)C(=O)c3ccco3)cc2)CCC1	1786753106	DGTXZFVGEDZNBP-UHFFFAOYSA-N	447.451	1.909	50	20	IDGD	
C[C@H](Nc1cccnc1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)Br)C[C@@H]21	1786866457	WXEYZPFMGFTQRV-HZRXROBNSA-N	439.354	1.645	50	20	IDGD	
Cc1nnc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CO[Si](C)(C)C)C[C@@H]32)s1	1787057200	MCWNPJGUIUALKV-KKUMJFAQSA-N	426.615	1.220	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]3C2)cc1NC(C)=O	1787448187	XKDIAOMPYNLNPV-DFEHZGFQSA-N	441.887	1.781	50	20	IDGD	
Cc1cc2nnc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)C(Cl)Cl)C[C@@H]43)c(C)n2n1	1787911589	WHOUZLQJWIGXRY-AVGNSLFASA-N	441.319	1.138	50	20	IDGD	
O=C(/C=N/N1CCCCC1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21	1788603970	DLOWYWRNZAUJDN-LOOQHYCCSA-N	433.322	1.128	50	20	IDGD	
COc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]32)nn1	1789103700	FNDCWHKKTQVTQA-XBPIAWKYSA-N	431.320	1.315	50	20	IDGD	
C[C@H]1Oc2ccc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)[C@@H](F)Cl)C[C@@H]43)cc2NC1=O	1789261859	DQPBFWKMCFERRA-QYTYKYCBSA-N	439.871	1.534	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(NC(C)=O)c(O)c3)C[C@@H]21	1789864923	DVAVOFPOIYASQF-GGXPGOJBSA-N	437.924	1.961	50	20	IDGD	
Cc1ccc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Cl)C[C@@H]32)cc1[N+](=O)[O-]	1789910811	RSJGMPRKZSSVQF-ILXVDBEPSA-N	427.860	1.960	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4nncn4c3)C[C@@H]21)[C@@H](F)Br	1789926159	PCVQADMSVBOLIR-PWNZVWSESA-N	440.273	1.013	50	20	IDGD	
CO[C@@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C(C#N)=C/c3ccc(F)cc3F)[C@H]2C1	1790695055	AJYFHPNMBYGGRA-FKUVSKKCSA-N	433.455	1.886	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4ccccc4o3)C[C@@H]21	1791291034	JBIFLCVOOYUNEK-ZWOKBUDYSA-N	442.516	1.399	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1ccc(C2(NC(=O)C(=O)c3cccn3C)CCC2)cc1	1791603281	ODFZEPAGVHWGLE-UHFFFAOYSA-N	439.516	1.715	50	20	IDGD	
CCC[C@H](NC(C)=O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)Br)C[C@@H]21	1792189463	VMTSSUJWUBHLNI-YDMUCJKGSA-N	432.359	1.054	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1cc(Cl)cnc1O	1792390389	XWDPJVOOUACQGZ-IWXIMVSXSA-N	436.665	1.334	50	20	IDGD	
COc1cccc(N2C[C@H](C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)[C@H](O)CCl)C4)CC2=O)c1	1792483463	HJIBKVCCIIEZMD-PVTMFURFSA-N	449.935	1.286	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3occ(Cl)c3c1)C2)[C@H](O)CCl	1792981433	ZSMCHIIGBONNMM-DJZPMSPPSA-N	427.284	1.889	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](O)CNC(=O)OC(C)(C)C)C2	1793677545	PFZHOMSLKDIERQ-YIDVYQOGSA-N	431.961	1.918	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)COCc1ccc(C)c(C)c1	1796471808	KJFVPUZUUSRMBL-RCLSDMTESA-N	438.952	1.663	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccn2c(O)nnc12	1796727971	MFSPVFZAPUZOFX-GFQSEFKGSA-N	436.310	1.860	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc2ncccc2c1)c1ccc(B(O)O)cc1	1797323997	FHGYFDOCGOAHGD-WKCHPHFGSA-N	429.285	1.480	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(OC)cc(OC)c1F	1798548087	ZADSZNYUAHENMF-ABXQLRGKSA-N	444.887	1.300	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccnn1	1798737291	BUJRHBRWDWNJLS-QDMKHBRRSA-N	439.428	1.876	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@](C)(Cl)CCl	1799279370	LIVSUSKTEQUZFF-NKSTYXRASA-N	430.170	1.986	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccc(C)c([N+](=O)[O-])c1	1799331628	SROGBSLQFGHESP-YYAJDYIMSA-N	439.896	1.289	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1c(F)cccc1F)C2)[C@@H](F)Br	1799348976	SXDBZFSLTADHNJ-GYHMKYFYSA-N	435.240	1.787	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)c1cccc(Br)c1F	1799500208	GVLDLJJSJVVLDO-FJHTZYQYSA-N	449.704	1.391	50	20	IDGD	
CCN(CC)[C@@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)c1ccccc1	1800300717	QZNPUGJYSGQOQE-LJDSDSDDSA-N	437.968	1.259	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nn(C)c3c1CCC3)C2	1800640591	AMKQQYSHJXNUIH-LMWOUKEDSA-N	439.354	1.286	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C(=O)c1ccc(Cl)cc1)C2	1802334032	GFWWNCBQFBBZSE-BJWYYQGGSA-N	434.924	1.534	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnc(C(C)(C)C)cn1)C2	1802336563	MUGILENQEHIWAI-MUJYYYPQSA-N	430.553	1.399	50	20	IDGD	
CCNC(=S)NCC(=O)N1CC[C@@H](CNC(=O)C(C)(C)CCl)[C@H]1c1cccnc1	1802904903	PANOGQPYJHOJGG-DOTOQJQBSA-N	440.013	1.836	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc3cccnc3n2)[C@@H]1c1cccnc1)[C@H](O)CCl	1803142856	LDNQRNDJAMOKIX-QXAKKESOSA-N	439.903	1.944	50	20	IDGD	
NC(=O)c1ccc(C(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)cc1	1803145609	FFMYVUQEYZJVPB-SQNIBIBYSA-N	430.892	1.100	50	20	IDGD	
CCS(=O)(=O)CC(=O)N1CCCC2(CCN(C(=O)[C@@H](F)Br)CC2)C1	1805969682	PWOUTSFZEKMMCE-CYBMUJFWSA-N	427.336	1.343	50	20	IDGD	
CCS(=O)(=O)CC(=O)N1CCCC2(CCN(C(=O)[C@@](C)(Cl)CCl)CC2)C1	1805969748	UJVIJFSJBCQGJX-INIZCTEOSA-N	427.394	1.889	50	20	IDGD	
CC[C@@H](NC(C)=O)C(=O)N1CC[C@H](CNC(=O)CCBr)[C@@H]1c1cccnc1	1806337429	HUVITGLUMAZQNB-NUJGCVRESA-N	439.354	1.787	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC2(CCCN(C(=O)C3=NN(C)C(=O)CC3)C2)CC1	1806629447	XTIKQVQYDQBMKO-AWEZNQCLSA-N	441.370	1.999	50	20	IDGD	
N[C@H](C(=O)NC[C@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1)c1ccccn1	1807161516	GARITWYLNWZPGZ-MNEFBYGVSA-N	446.349	1.967	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)Cn2ccccc2=O)[C@@H]1c1cccnc1	1807442328	NYILGSUQKKSZBZ-UWVAXJGDSA-N	432.908	1.203	50	20	IDGD	
CC(=O)NCCC(=O)N1CC[C@H](CNC(=O)[C@@](C)(Cl)CCl)[C@@H]1c1cccnc1	1808318307	UQAMMKRTJJCDKA-AYBZRNKSSA-N	429.348	1.850	50	20	IDGD	
CCS(=O)(=O)N[C@@H](C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)C(Cl)Cl)[nH]n1	1815167868	KNZSCRSLNHAWEC-GXSJLCMTSA-N	440.353	1.533	50	20	IDGD	
CC(=O)N(C)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](F)Br)[nH]n1	1815582898	JRNHVUVWAQCNCN-SWLSCSKDSA-N	432.294	1.961	50	20	IDGD	
Cc1ccoc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2	1817415947	VLSXPRJHUWTZCH-CQSZACIVSA-N	425.275	1.264	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)CCBr)[nH]n1)c1cccc(B(O)O)c1	1817473197	LMVFIVMVDSYLTE-HNNXBMFYSA-N	449.114	1.180	50	20	IDGD	
CN1CCN(C2(C(=O)N3CCCC[C@@H]3c3cc(NC(=O)[C@@H](F)Cl)n[nH]3)CC2)CC1	1818041143	BVWXTBBPIHTSJO-GDBMZVCRSA-N	426.924	1.716	50	20	IDGD	
C[Si](C)(C)OCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)CNC(=O)C(F)(F)F)[nH]n1	1819597238	MUEPZWFJUKXEMB-LBPRGKRZSA-N	449.506	1.932	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@H](F)Cl)[nH]n1)c1cc(=O)nc2cccnn12	1820144601	KPPSPJYFBPXNLB-ZBEGNZNMSA-N	433.831	1.653	50	20	IDGD	
CCc1cc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@@H](Cl)COC)CC3)n(C)n1	1820636484	LEBZJVUWXXMVSV-NEPJUHHUSA-N	425.942	1.919	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@H](F)Cl)CC2)c1cc(=O)nc2cccnn12	1821265396	XTBUEYCHAKROGS-CLAHSXSESA-N	436.856	1.306	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnn3c2OCCC3)n[nH]1	1821434941	XAWPTZJFXRWXIT-ZFWWWQNUSA-N	436.900	1.948	50	20	IDGD	
CCS(=O)(=O)N[C@H](C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)C(Cl)Cl)n[nH]1	1822419364	WWKFWYLZRUWEIF-MWLCHTKSSA-N	440.353	1.533	50	20	IDGD	
Cc1nnc(CCC(=O)N2CCCC[C@@H]2C2CCN(C(=O)[C@H](O)CCl)CC2)s1	1825226018	LVPNTWKDIYELNM-HZPDHXFCSA-N	428.986	1.999	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](N)Cc1cccnc1)CC2	1825999264	SNRSSEGJNMGPNR-MCIONIFRSA-N	437.953	1.274	50	20	IDGD	
O=C([C@H]1CCCSC1)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827055480	YUXQCTLTICZKCN-PZJWPPBQSA-N	444.406	1.743	50	20	IDGD	
O=C([C@@H]1C[C@]1(F)Cl)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827060725	YHIDALPHTMNLFR-WAOWUJCRSA-N	436.720	1.524	50	20	IDGD	
Cc1cnoc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1	1829550209	CCMNWRYVYOCCRO-SFHVURJKSA-N	440.504	1.529	50	20	IDGD	
O=C(c1cc(-c2ccccc2)on1)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1	1829589620	VFECQIQVPDQXFB-DYESRHJHSA-N	449.891	1.011	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccn4ccnc4c3)C2)C1	1830361713	AZWXQXQMCZJVOA-NRFANRHFSA-N	434.924	1.669	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4ncccn4n3)C2)C1	1830362004	IFJMFOANYRGYQY-FQEVSTJZSA-N	435.912	1.064	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(CC)n(C)n3)C2)C1	1831653710	CXNVYJCKEMYQQD-OXJNMPFZSA-N	426.945	1.460	50	20	IDGD	
CCc1cc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)n[nH]1	1831871180	MQOFLWBGPKUTBF-IBGZPJMESA-N	432.569	1.578	50	20	IDGD	
CN1Cc2ccccc2C[C@@H]1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1832468834	SILBPZGRBVLPFO-LQWHRVPQSA-N	439.915	1.034	50	20	IDGD	
Cc1ccsc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)Br)C2)C1	1833948572	QSOCNDUYPQWUGT-SUMWQHHRSA-N	431.352	1.910	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)c3ccccc3)CC2)CC1	1834586080	SWWPFVYEHVOEMI-WOJBJXKFSA-N	437.968	1.545	50	20	IDGD	
Cc1csc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCBr)CCO3)C2)c1	1834818678	BOVRAXDGIQGAAU-QGZVFWFLSA-N	431.352	1.912	50	20	IDGD	
C=C[C@@H](O)C(C)(C)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1835717274	OXEIGUUQVNKNES-HZPDHXFCSA-N	448.377	1.822	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccnc(OC)c3F)CCO2)C1	1836237919	OJYKSFFNFDQBRE-KUHUBIRLSA-N	429.876	1.317	50	20	IDGD	
O=C(C/N=C/c1ccco1)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836717019	DXAULGMVMBJPRY-ZFJBLLOBSA-N	425.913	1.297	50	20	IDGD	
O=C(c1cccn2ccnc12)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836717269	REPVEMSANBIKFZ-SFHVURJKSA-N	434.924	1.546	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4c[nH]nc4c3)C2)C1	1837711722	OIUCECKANCAGPR-OAQYLSRUSA-N	446.580	1.484	50	20	IDGD	
O=C(c1cc2n(n1)CCCO2)N1CCC(OC2CCN(C(=O)[C@@H](F)Cl)CC2)CC1	1838082874	RIKDZYHNZVTYSN-QGZVFWFLSA-N	428.892	1.812	50	20	IDGD	
O=C(COc1ccc(O)nn1)N1CCC(OC2CCN(C(=O)[C@@H](F)Cl)CC2)CC1	1838085202	YKWBIHGFKBUEKE-QGZVFWFLSA-N	430.864	1.094	50	20	IDGD	
CN1CCC[C@H](C(=O)N2CCO[C@]3(COCCN(C(=O)[C@](C)(Cl)CCl)C3)C2)C1	1839067214	JHKFWFSEAQRHJB-KFKAGJAMSA-N	436.380	1.021	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3c(C)noc3C)C2)C1	1839142744	YRVKEMZYSRJGBV-XLIONFOSSA-N	427.929	1.698	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cncc4cnccc34)C2)C1	1839146220	LQZADEPWCUJJFS-WIYYLYMNSA-N	432.908	1.717	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCBr)C2)C1	1839150910	BUZKFIXKZXIAAM-HUUCEWRRSA-N	446.169	1.464	50	20	IDGD	
CCn1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)n1	1839150971	DJKYYPWTAGGPEH-ZWKOTPCHSA-N	433.336	1.209	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)n(C)n1	1839151230	LJTQIQVHQKRWNM-ROUUACIJSA-N	433.336	1.035	50	20	IDGD	
Cc1nccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)n1	1839152587	FAPHAXCKVLBWBT-QZTJIDSGSA-N	431.320	1.091	50	20	IDGD	
CCc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](Br)CC)CCO3)n[nH]1	1839964469	SLUYGDOIVXZILM-KBXCAEBGSA-N	443.342	1.216	50	20	IDGD	
Cc1ccc(F)cc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2	1840030657	RSZGTWPMYHSBMF-AUUYWEPGSA-N	443.313	1.988	50	20	IDGD	
Cc1ccc(F)c(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)c1	1840035658	ZMZAUJSAQIANMY-LIRRHRJNSA-N	443.313	1.988	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3cccc(C)c3)C2)C1	1840149999	DKXDOHRKINSAPH-UGKGYDQZSA-N	438.952	1.638	50	20	IDGD	
O=C(CCc1cccc(O)c1)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840190898	UBWGXFXQEQAVPC-LJQANCHMSA-N	431.316	1.585	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3cc(F)ccc3OC)CCO2)C1	1840250748	MMCGQJGOHGUXJW-UWJYYQICSA-N	442.915	1.851	50	20	IDGD	
O=C(CCc1cccc(O)c1)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1840268158	KFDOFVIQCWIDPE-LJQANCHMSA-N	431.316	1.585	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H]1CC(=O)N1CCCC12CN(C(=O)[C@@H](O)CCl)C2	1841777156	ZENMSCUFWJGCEC-CABCVRRESA-N	429.945	1.579	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)c2ccc(Cl)nc2Cl)C1	1844421843	AVBOONMKMMORMI-UHFFFAOYSA-N	434.088	1.199	50	20	IDGD	
O=C1C[C@@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)CCBr)CN1C1CCCC1	1848039057	KZFBQGSNWQTVSV-KBMXLJTQSA-N	426.355	1.764	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)CCCNS(=O)(=O)c1ccc(F)cc1	14842279	YMYGWCTZUIFZPS-UHFFFAOYSA-N	433.465	1.302	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1cn(-c2ccccc2)nc1-c1cccs1	15639436	LPCBGFJSVDPDQY-CYBMUJFWSA-N	430.511	1.797	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2sc3nc4n(c(=O)c3c2C)CCC4)cc1	15813587	GXEMMNDCEIVEIO-UHFFFAOYSA-N	425.470	1.421	50	20	IDGD	
Cc1[nH]c(=S)sc1CC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	17517149	DWKRCEMBFSDOEG-UHFFFAOYSA-N	440.572	1.902	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1ccc(-c2ccccn2)[nH]c1=O	115855815	AEDKSAMZMDNGOU-UHFFFAOYSA-N	440.485	1.113	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)N1CCC(C(=O)c2ccc(Cl)cc2)CC1	725871812	RBHBYACMSJSUNL-UHFFFAOYSA-N	432.864	1.999	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)CNC(=O)NCc2ccc(Cl)cc2)c1	727368920	RAFDZBBFEQFXIT-UHFFFAOYSA-N	438.893	1.004	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)CCNS(=O)(=O)c2ccccc2)cc1F	727500420	XUPROEZUWXWDLC-UHFFFAOYSA-N	426.495	1.521	50	20	IDGD	
CCCCC(=O)N1CSC[C@H]1C(=O)NNC(=O)c1nn(CC)c(=O)c2ccccc12	728018145	HLMGNHKJPILSPJ-HNNXBMFYSA-N	431.518	1.269	50	20	IDGD	
C[C@@H]1CCC[C@@H]1NC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	729624724	XWSXNMGHAXOKFS-QAPCUYQASA-N	438.550	1.159	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)CNC(=O)c2ccc(Br)o2)cn1	729692868	WFUCJMPWGIVUTC-UHFFFAOYSA-N	428.268	1.193	50	20	IDGD	
CC(C)(C)OC(=O)Nc1cc(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)ccc1F	730536825	WBUFUHNMYHPYPH-LLVKDONJSA-N	430.458	1.304	50	20	IDGD	
Cc1ccc([C@@H](CNC(=O)NNC(=O)COc2ccccc2O)N2CCOCC2)cc1	730905417	XPTPJMKSVSLIGZ-GOSISDBHSA-N	428.489	1.483	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)[C@@H](CCSC)NS(=O)(=O)c1ccccc1	731494598	XGQFDDHJOINEFT-MRXNPFEDSA-N	437.543	1.556	50	20	IDGD	
O=C(CCSc1ccc(F)cc1)NNC(=O)CN1C(=O)COc2ccc([N+](=O)[O-])cc21	731837185	KYEORHYRZUHQJR-UHFFFAOYSA-N	448.432	1.789	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1	731957684	WSZWQLISZIMUMV-SMDDNHRTSA-N	446.441	1.248	50	20	IDGD	
Cc1cccc(-n2c(C)cc(/C=C(/C#N)C(=O)N3CCN(S(N)(=O)=O)CC3)c2C)c1	732067831	IBPSSKDOEHBDOT-UYRXBGFRSA-N	427.530	1.657	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2ccccc2NS(C)(=O)=O)cc1Br	732176619	VTPOUOCBQDQIQC-UHFFFAOYSA-N	442.291	1.904	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)C[C@@H](C)O1	732261361	CGPDOEOARMOTLP-BETUJISGSA-N	433.490	1.979	50	20	IDGD	
Cc1ccc(-c2nnc(S)n2CCC(=O)NNC(=O)CCN2C[C@H](C)O[C@H](C)C2)cc1	732263750	OJHHQLCHDAFEJR-IYBDPMFKSA-N	446.577	1.579	50	20	IDGD	
C[C@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)NNc2ccccc2S(C)(=O)=O)C1=O	732301557	DDCMPRPBEKDTDK-LJQANCHMSA-N	434.449	1.140	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)CC[C@@H]1NC(=O)N(c2ccc(C#N)cc2)C1=O	733758808	WQHRXMWPSHQIMW-KRWDZBQOSA-N	435.440	1.162	50	20	IDGD	
CC(C)(C(=O)NNC(=O)CC[C@@H]1NC(=O)N(c2ccc(C#N)cc2)C1=O)c1ccccc1	733760945	LTYVRXCBKYBTSE-SFHVURJKSA-N	433.468	1.888	50	20	IDGD	
COc1ccc(CN2CC[C@@H](NC(=O)NNC(=O)COc3ccccc3F)C2=O)cc1	734516011	CQWPKTOOBMHAME-QGZVFWFLSA-N	430.436	1.345	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)NC2CCN(S(=O)(=O)Cc3ccccc3)CC2)c1	735513023	MIKXKHQJYQRDEI-UHFFFAOYSA-N	441.513	1.497	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)C2CCN(c3cnccn3)CC2)cc1C	736774592	GATFMRVEIQFUIG-UHFFFAOYSA-N	431.518	1.630	50	20	IDGD	
C[C@@H](CCC(C)(C)C)NC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	737062020	YASTVYAQGBKACP-HNNXBMFYSA-N	426.587	1.859	50	20	IDGD	
O=C(COc1ccccc1O)NNS(=O)(=O)c1cccc(I)c1	739959253	RQMXZTXPIUJKNI-UHFFFAOYSA-N	448.238	1.385	50	20	IDGD	
C[C@H]1CS(=O)(=O)CCN1C(=O)NNC(=O)[C@@H](C)Oc1cccc(Br)c1	740026489	YJCRDSFVFTXDFO-WDEREUQCSA-N	434.312	1.076	50	20	IDGD	
CN(CC(=O)NNC(=O)c1ccc(F)cc1)C[C@@H](O)COc1ccccc1C(F)(F)F	741799705	PCOSFQCVOSLFOX-OAHLLOKOSA-N	443.397	1.977	50	20	IDGD	
O=C(COc1ccccc1O)NNS(=O)(=O)c1c(Cl)cc(Cl)cc1[N+](=O)[O-]	742291561	BSHQKEFGRQVMPD-UHFFFAOYSA-N	436.229	1.996	50	20	IDGD	
Cc1c(F)cccc1S(=O)(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	743251596	AHJQEOLWICGCTJ-UHFFFAOYSA-N	441.506	1.542	50	20	IDGD	
CNS(=O)(=O)c1cccc(CNC(=O)NNC(=O)Nc2ccc(OC(F)F)cc2)c1	743536784	OYHPPCMBYPXLOW-UHFFFAOYSA-N	443.432	1.732	50	20	IDGD	
CN(C)CCOc1ccc(CNC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)cc1	743551874	UPZPHXZMGWKKSC-UHFFFAOYSA-N	449.533	1.566	50	20	IDGD	
CC(C)NC(=O)C(=O)NNC(=O)c1ccc(Cl)c(S(=O)(=O)N2CCC[C@@H](C)C2)c1	744446501	BBOGXBIQPDQMNU-GFCCVEGCSA-N	444.941	1.046	50	20	IDGD	
CCSCC[C@H](C)NC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	745923231	PBVNWEORKIMJJX-AWEZNQCLSA-N	430.600	1.176	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)c2cnn(CC(=O)NC3CCCCC3)c2)c1	746580240	SVZDUNUWAIBGHG-UHFFFAOYSA-N	429.477	1.424	50	20	IDGD	
CC(C)NS(=O)(=O)c1cccc(CNC(=O)NNC(=O)Cc2cn3ccccc3n2)c1	746749784	GLOFGWALPSLBPK-UHFFFAOYSA-N	444.517	1.094	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)[C@@H](C)C1CC1)N(S(C)(=O)=O)CC2	747934097	BXUSPVSBYQYOEQ-LRDDRELGSA-N	439.534	1.146	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)N[C@H](C)c1cc2c(cc1Br)OCCO2	748616579	CZJBUYZVMSLGCE-MNOVXSKESA-N	446.298	1.663	50	20	IDGD	
Cc1cc(S(=O)(=O)NNC(=O)c2cc(Br)c[nH]2)ccc1OCC(=O)O	748691822	UVBBHEZAXRWSKV-UHFFFAOYSA-N	432.252	1.172	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H]2C[C@@H](OC)C2(C)C)c1	753549702	HKSKJVPFQXWIDN-JKSUJKDBSA-N	426.539	1.475	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNS(=O)(=O)c2cc(C(=O)O)cc(C)c2Cl)cc1C	753769942	LLJUVPQAXNUJIG-UHFFFAOYSA-N	439.877	1.912	50	20	IDGD	
CCOC(=O)[C@@H](NCC(=O)NNC(=O)c1cc(Cl)ccc1OC)[C@@H]1CCCOC1	754261192	JOXSRVFYVBSYPF-PXAZEXFGSA-N	427.885	1.058	50	20	IDGD	
CS(=O)(=O)c1cccc(NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c1	755556724	JYHAHJZCTGPOLA-UHFFFAOYSA-N	445.545	1.455	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)Nc1cc2c(cc1Cl)OCCO2	755574065	FYWIAWRZMANQOV-UHFFFAOYSA-N	432.868	1.971	50	20	IDGD	
O=C(CCc1ccccc1)NNC(=O)Nc1ccc(NC(=O)CN2CCOCC2)cc1	755600751	VMGMDYMVUDKIFT-UHFFFAOYSA-N	425.489	1.743	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)Nc1cc(N2CCCS2(=O)=O)ccc1F	756154214	CUESBOBZMCIKNZ-UHFFFAOYSA-N	436.465	1.857	50	20	IDGD	
CN1CCOc2ccc(NC(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)cc21	756851752	UQVQKYGKJBUDJG-UHFFFAOYSA-N	433.490	1.232	50	20	IDGD	
COCC(=O)NNC(=O)Nc1ccc(I)cc1Br	756870353	BEFDPENZKWNQGR-UHFFFAOYSA-N	428.024	1.853	50	20	IDGD	
CCCCOc1ccc(C(=O)NNS(=O)(=O)c2cn(CC)nc2[N+](=O)[O-])cc1OC	756929928	MPZZHWXJDHUCCX-UHFFFAOYSA-N	441.466	1.622	50	20	IDGD	
COC(=O)c1cc(NC(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc(S(C)(=O)=O)c1	757673730	ICLJLBGAPZGTSX-UHFFFAOYSA-N	449.441	1.114	50	20	IDGD	
O=C(NNC(=O)c1ccc(OCc2cn3ccccc3n2)cc1)C(=O)Nc1ccccn1	758830357	AAQNLHFVTHATSJ-UHFFFAOYSA-N	430.424	1.708	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1)c1cncc(F)c1	759109273	MTTUNKLOLFWQRS-UHFFFAOYSA-N	428.445	1.774	50	20	IDGD	
CC1(C)C(=O)N(C[C@@](C)(O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)c2ccccc21	760084326	GSOUZFGDQDGRRZ-HSZRJFAPSA-N	439.468	1.294	50	20	IDGD	
COc1ccc2c(c1)OC[C@H]2CC(=O)OCC(=O)NNC(=O)c1ccc(OC)c(OC)c1	760621585	YDCSYJNANNBZSS-CQSZACIVSA-N	444.440	1.583	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)c1ccc(I)c(O)c1	760905509	FVSLIPULYNBSLK-UHFFFAOYSA-N	436.209	1.648	50	20	IDGD	
O=C(NCCC[C@@H]1CCCCO1)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	761036487	NZQJBSHSJMBLBW-KRWDZBQOSA-N	438.550	1.764	50	20	IDGD	
Cc1nc2ccc(C(=O)NNc3ncccc3S(=O)(=O)N3CCN(C)CC3)cc2s1	762871446	PSAPKHZBDGYMNQ-UHFFFAOYSA-N	446.558	1.693	50	20	IDGD	
O=C(NNC(=O)c1ccn(C2CCCC2)n1)c1cccc(S(=O)(=O)N2CCOCC2)c1	763108618	MRSSRJUKXCSYKK-UHFFFAOYSA-N	447.517	1.094	50	20	IDGD	
CSc1nnnn1-c1cccc(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3n2)c1	763451027	UDMCUCXNOPNXQQ-UHFFFAOYSA-N	448.468	1.332	50	20	IDGD	
CCOC(=O)C(C)(C)n1cc(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3n2)cn1	763467975	XWJAEJUECHVGNU-UHFFFAOYSA-N	438.444	1.129	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(-n3cccn3)c(F)c2)cc1OC	763543174	MGDFXQALDCAIHN-UHFFFAOYSA-N	427.392	1.428	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)C(=O)Nc2ccc(-n3nccn3)cc2)c1	763594175	HLVAYFYQSYUUMB-UHFFFAOYSA-N	436.472	1.864	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)C(=O)Nc2ccccc2S(C)(=O)=O)c1	763600180	DETDZYVUDYCBHU-UHFFFAOYSA-N	447.513	1.687	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2cnn(-c3ccccc3F)c2)c1	763645735	YQVKVGGMIXAHNO-UHFFFAOYSA-N	425.420	1.793	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccccc2N2CCOC2=O)cc1C	763664658	DPXGUZXONOEQEY-UHFFFAOYSA-N	426.429	1.425	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNC(=O)C(=O)N=c2cc[nH]c(C(=O)N(C)C)c2)cc1	763766734	CJTQUDZNHIXSMW-UHFFFAOYSA-N	441.488	1.030	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(C)nc2N(C)C)cc1	763861563	QTHJIZGJZJXRRW-CQSZACIVSA-N	429.477	1.408	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccc(N2CCOC2=O)cc1	763867955	ZEZGBFXWWFDIMC-GFCCVEGCSA-N	430.392	1.336	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cccc(N(C)C(C)=O)c2)cc1	763872041	JKQPJNNCZBFNOI-CQSZACIVSA-N	440.456	1.425	50	20	IDGD	
NC(=O)c1ccc(F)c(NC(=O)C(=O)NNC(=O)c2ccc(COc3ccccc3)o2)c1	763950341	TYPARNAWDPSBAX-UHFFFAOYSA-N	440.387	1.496	50	20	IDGD	
COC(=O)c1cc(OC)c(OC)c(OC)c1NC(=O)C(=O)NNC(=O)c1ccccc1C	763958827	ZADLVUMOZDKTPN-UHFFFAOYSA-N	445.428	1.207	50	20	IDGD	
COCCOCc1cccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)c1	764004736	SQORCXGJVQNGMF-UHFFFAOYSA-N	429.429	1.021	50	20	IDGD	
O=C(Cc1ccsc1)NNC(=O)C(=O)Nc1ccc(N2CCOCC2)c2ccncc12	764035736	RSYPYEDGSCEBCN-UHFFFAOYSA-N	439.497	1.462	50	20	IDGD	
CN(C(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)CC(F)(F)F)cc1)c1ccccc1	764114493	CLRMNWTUDNVDFM-UHFFFAOYSA-N	436.390	1.930	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1O)C(=O)Nc1ccc(CN2CCCC2=O)cc1	764116976	LEAQMSZOBRXLGY-UHFFFAOYSA-N	430.848	1.568	50	20	IDGD	
CCOc1cc2c(cc1NC(=O)C(=O)NNC(=O)[C@H]1Cc3ccccc3O1)O[C@@H](C)C2	764151415	IMLKLFQYQYOPKC-HXPMCKFVSA-N	425.441	1.498	50	20	IDGD	
CC(C)OC(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)c1	764154348	PNWRGBGTVZDNKJ-QGZVFWFLSA-N	445.859	1.995	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2O1)C(=O)Nc1cccc(-c2noc(C3CC3)n2)c1	764169054	SPMNCBFIBWKJNM-KRWDZBQOSA-N	433.424	1.704	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(C#N)cc2)cc1I	764176230	ABTVFZVEJFYEFY-UHFFFAOYSA-N	448.220	1.871	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)C(=O)Nc1cccnc1N1CCCCC1	764204533	XWHKIIPHSJVUFW-UHFFFAOYSA-N	448.524	1.463	50	20	IDGD	
CCN(C(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)c2c[nH]nc2C)cc1)c1ccccc1	764297841	GWWZNEFVNJGPFF-UHFFFAOYSA-N	448.483	1.713	50	20	IDGD	
CCOCC(=O)NNC(=O)C(=O)Nc1ccc(-c2nc3cc(F)ccc3n2C)cc1C	764317255	HJULUABGHGNIHS-UHFFFAOYSA-N	427.436	1.810	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)C(=O)Nc1ccc(S(=O)(=O)NC(C)C)cc1)c1ccccc1	764328528	PSXLEXHVQNNIEN-GOSISDBHSA-N	446.529	1.653	50	20	IDGD	
Cc1cc(N2CCOCC2)ccc1NC(=O)C(=O)NNC(=O)c1ccc(O)c(Cl)c1	764349287	HYMHZZGZUAQWJV-UHFFFAOYSA-N	432.864	1.590	50	20	IDGD	
Cn1ccnc1-c1cccc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)c1	764379792	KUFMOQSCHBLXQH-UHFFFAOYSA-N	429.383	1.845	50	20	IDGD	
CNC(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(C)c(C)c3)[nH]n2)cc1	764387940	NHWLYHKJRQRDEL-UHFFFAOYSA-N	448.483	1.382	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)C(=O)Nc1cccc(CCN2CCCC2)c1	764404295	HPLZQRCSHVWYPM-UHFFFAOYSA-N	442.541	1.909	50	20	IDGD	
Cn1nc2c(c1C(=O)NNC(=O)c1ccc(S(=O)(=O)N3CCCC3)cc1)CCCC2	764544778	MTFVMGOFMYYNFG-UHFFFAOYSA-N	431.518	1.158	50	20	IDGD	
O=C(CCS(=O)(=O)c1ccc2c(c1)CCC2)NNC(=O)CSc1ccccc1O	765248364	HFULYRUFAHIVIZ-UHFFFAOYSA-N	434.539	1.984	50	20	IDGD	
CS(=O)(=O)N1CCCc2cc(C(=O)NNC(=O)c3cc(-c4cccs4)[nH]n3)ccc21	765569208	WAXMSFAEJXKVBQ-UHFFFAOYSA-N	445.526	1.925	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)CNC(=O)CC3CCCCC3)CC2)cc1	765748289	LMVQQZGNRPZKFY-UHFFFAOYSA-N	443.592	1.347	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3coc(C4CCOCC4)n3)CC2)cc1	768069331	BCXXEKBVRZKRAR-UHFFFAOYSA-N	441.532	1.456	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)c3ccc([C@]4(C)NC(=O)NC4=O)cc3)n[nH]2)cc1C	768255668	HQQTYIRAFZGOAS-QHCPKHFHSA-N	446.467	1.823	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)c2ccc(-n3ncc(C#N)c3N)cc2)n[nH]1	768273228	ALOUYTAMVKHRSI-UHFFFAOYSA-N	442.439	1.800	50	20	IDGD	
COC(=O)[C@H]1CCC[C@@H](C(=O)NNC(=O)c2cc(-c3ccc(OC)c(OC)c3)[nH]n2)C1	768275634	DMPPWPKIMJJAQL-KGLIPLIRSA-N	430.461	1.834	50	20	IDGD	
COc1ccc(NNC(=O)C[C@H](C)/N=C2/NS(=O)(=O)c3ccccc32)c([N+](=O)[O-])c1	768338124	GHSCFFMLCRABLP-NSHDSACASA-N	433.446	1.564	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@@H]2[C@H]3Cc4ccccc4[C@@H]32)c1	769151306	PTZWLZREVKPFRE-QRVBRYPASA-N	428.514	1.467	50	20	IDGD	
Cc1noc(C)c1S(=O)(=O)NCC(=O)NNC(=O)CCSc1ccc(F)cc1	769487028	IPSHPUHOXVTPNL-UHFFFAOYSA-N	430.483	1.039	50	20	IDGD	
Cc1cc(Br)ccc1S(=O)(=O)NNC(=O)CNC(=O)c1cccs1	769864199	CWALQQGAPPHQSJ-UHFFFAOYSA-N	432.321	1.559	50	20	IDGD	
O=C(COC(=O)c1ncoc1-c1ccc(F)cc1)NNC(=O)[C@H]1COc2ccccc2O1	770471095	DFOKIRYWIPNXHP-MRXNPFEDSA-N	441.371	1.625	50	20	IDGD	
CCNC(=O)N(C)NC(=O)c1cc(S(=O)(=O)N2CCCC2)ccc1Br	770549079	KQPWZGAGFDUDPH-UHFFFAOYSA-N	433.328	1.540	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)CCn3cnc4sc5c(c4c3=O)CCCC5)nc21	770979541	IAZPVNNWPFNMHY-UHFFFAOYSA-N	440.489	1.253	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)[C@@H]3CC(=O)N(c4cc(Cl)cc(Cl)c4)C3)nc21	770992038	UZAUNIMXMXTAOQ-MRVPVSSYSA-N	436.259	1.872	50	20	IDGD	
COc1ccccc1[C@@]1(C)NC(=O)N(CC(=O)NNC(=O)c2cc(Cl)ccc2O)C1=O	771537465	GQXOQBNBKCYARU-HXUWFJFHSA-N	446.847	1.282	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)N2CCO[C@@H](CN3C(=O)c4ccccc4C3=O)C2)cc(C#N)n1C	771790397	HDBPCALQGIIGOS-IISPMBILSA-N	443.463	1.636	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)c1ncccc1OCC(F)(F)F	772897870	NCFMGDYPAWIYTG-UHFFFAOYSA-N	430.770	1.754	50	20	IDGD	
O=C(Cc1ccc([N+](=O)[O-])cc1Cl)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772899242	ZRACKUJWEQPICM-UHFFFAOYSA-N	425.228	1.908	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)CN1C(=O)N[C@](C)(c2ccccc2)C1=O	772971182	JZQNTTWBGPCBES-LRTDBIEQSA-N	444.875	1.722	50	20	IDGD	
CC(=O)N1CCN(Cc2ccc(NC(=O)C(=O)NNc3cnc4ccccc4n3)cc2)CC1	773722567	IDMUASUMJDIMLZ-UHFFFAOYSA-N	447.499	1.376	50	20	IDGD	
COC(=O)c1cc(F)ccc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1cccc(Cl)c1	774008314	GDBINTUXXHAVAZ-SNVBAGLBSA-N	437.811	1.819	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)C1=CCCCCC1	775766822	FWQFWCTVPIGQEY-UHFFFAOYSA-N	435.546	1.678	50	20	IDGD	
O=C(CCSc1ccc(F)cc1)NNC(=O)N[C@H]1CCO[C@@]2(CCS(=O)(=O)C2)C1	776077187	SFRRRJJNBHMPII-KSSFIOAISA-N	445.538	1.375	50	20	IDGD	
O=C(NC[C@H]1COC2(CCCCCC2)O1)NNC(=O)C1CCN(c2ncccn2)CC1	776907085	KKEXFMVVZCIWFY-KRWDZBQOSA-N	432.525	1.489	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)NCc2ccccc2CN2CC[C@@H](O)C2)cc1	781835213	QYUHMXHMZCQZGU-HXUWFJFHSA-N	426.521	1.855	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2ccc(C)c(S(=O)(=O)NC(C)(C)C)c2)nc1	782144830	CRTJNPBXTJFYBS-UHFFFAOYSA-N	435.506	1.557	50	20	IDGD	
COCC(=O)N1CCc2cc(NC(=O)C(=O)NNc3nccc4sccc34)ccc21	783438963	GDYPCPVQECKHIH-UHFFFAOYSA-N	425.470	1.914	50	20	IDGD	
Cc1cc(N2CCCC[C@H]2C)ccc1NC(=O)C(=O)NNC(=O)CNC(=O)c1ccco1	784003034	ZWBOOISSPSJFQK-OAHLLOKOSA-N	441.488	1.483	50	20	IDGD	
CCn1nnnc1-c1cccc(NC(=O)C(=O)NNc2ccc(Br)nc2)c1	784806438	GDWIJZLWOKWFOU-UHFFFAOYSA-N	431.254	1.599	50	20	IDGD	
O=C(NNc1ccc(F)c(F)c1F)C(=O)Nc1cccc(N2CCCS2(=O)=O)c1	784806884	MVLIJMAMRPMRHW-UHFFFAOYSA-N	428.392	1.726	50	20	IDGD	
O=C(NNc1ncccc1Cl)C(=O)N1C[C@@H](C(=O)N2CCCCC2)Oc2ccccc21	784819795	VCQGFCZOMPSKFU-KRWDZBQOSA-N	443.891	1.985	50	20	IDGD	
COc1ccc(C(=O)N2CCOCC2)cc1NC(=O)C(=O)NNc1ccc(Cl)nc1	784871097	AUJRJARALNAPGB-UHFFFAOYSA-N	433.852	1.298	50	20	IDGD	
Cc1ccc(F)c(NNC(=O)C(=O)Nc2cnn(CC(=O)N3C[C@H](C)O[C@@H](C)C3)c2)c1	784885365	SIFCYKBRDVNFPA-KBPBESRZSA-N	432.456	1.048	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)ccc1Br	785060814	NTAFXKLZFHMISW-UHFFFAOYSA-N	430.262	1.734	50	20	IDGD	
COC(=O)c1sccc1NC(=O)C(=O)NNC(=O)c1cc(-c2cc(C)ccc2C)[nH]n1	785126156	JZOHYMHMGKDSTP-UHFFFAOYSA-N	441.469	1.941	50	20	IDGD	
CC(C)(C)OC(=O)NCc1cccc(C(=O)NNC(=O)CNC(=O)c2cccs2)c1	786855754	CMNVWYABXXQZLZ-UHFFFAOYSA-N	432.502	1.964	50	20	IDGD	
CCN(C(=O)c1cc(NC(=O)C(=O)NNC(=O)c2c[nH]nc2C)ccc1Cl)C(C)C	787542707	PGORLXNPZKCCGP-UHFFFAOYSA-N	434.884	1.642	50	20	IDGD	
Cc1ccc(S(=O)(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)c(Cl)n1	788679647	XSBPWBMFOGSUQL-UHFFFAOYSA-N	447.945	1.841	50	20	IDGD	
COc1cc(NNC(=O)[C@@H](NS(=O)(=O)c2ccc(C)cc2)[C@@H](C)O)ccc1Cl	790179474	RHNSFDKFGYJAKX-PXAZEXFGSA-N	427.910	1.828	50	20	IDGD	
COCCNC(=O)CN1CCN(C(=O)/C(C#N)=C/c2cc(C)n([C@@H](C)COC)c2C)CC1	790445218	PBKVLOPOXNNTIQ-LANLRWRYSA-N	445.564	1.126	50	20	IDGD	
CS(=O)(=O)c1cc(CNC(=O)NNC(=O)Cc2cccnc2)cc(C(F)(F)F)c1	790708903	KKTOSZHARATDEU-UHFFFAOYSA-N	430.408	1.577	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)[C@@H]2CC(c3cc(OC)ccc3OC)=NO2)cc1	791543100	RPBCTPUVDMUXKT-FQEVSTJZSA-N	427.457	1.986	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@@H](C(=O)NNC(=O)c2cccc(Cl)c2)[C@@H](C)O)cc1	792120466	RTZLAVSLWJZCQN-MLGOLLRUSA-N	425.894	1.137	50	20	IDGD	
CN(C[C@H]1CCCN(C(=O)NNC(=O)c2cccc(Br)c2)C1)S(C)(=O)=O	805159397	GHMYAKIALMXKKF-GFCCVEGCSA-N	447.355	1.407	50	20	IDGD	
COC(=O)CC[C@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)c1ccc(Cl)cc1O	806536030	FPHJLZZQCSNKMN-LBPRGKRZSA-N	429.857	1.653	50	20	IDGD	
CNS(=O)(=O)c1cc(NC(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)ccc1F	806544413	DTJHYKMBTWDSRZ-ZDUSSCGKSA-N	438.481	1.971	50	20	IDGD	
CCN(C)C(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2cccc(OC(F)F)c2)c1	806978429	AZQCXMVEKCUPMK-UHFFFAOYSA-N	434.399	1.780	50	20	IDGD	
O=C(CCCC(=O)c1ccc2c(c1)OCCO2)NNc1nccc(N2CCOCC2)n1	807076189	WIQCNYBJVIMVQH-UHFFFAOYSA-N	427.461	1.581	50	20	IDGD	
CN1CCC(Oc2ccc(CNC(=O)NNC(=O)COc3ccccc3C#N)cc2)CC1	807254573	DRHYTRWLBRNVSJ-UHFFFAOYSA-N	437.500	1.941	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)N1CCN([C@@H]2CCN(C(=O)OC(C)(C)C)C2)CC1	808187827	MCHHOKKUOIRMSJ-QGZVFWFLSA-N	431.537	1.976	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2cnn(-c3ccc(F)cc3)c2C(F)(F)F)n1	810388304	UUJFMRPKVVAWMG-UHFFFAOYSA-N	439.329	1.911	50	20	IDGD	
C[C@H](CN1CCOCC1)C(=O)NN=Cc1cc(I)cc([N+](=O)[O-])c1	811635464	YKYNPQJJTOCJML-LLVKDONJSA-N	446.245	1.618	50	20	IDGD	
COCc1cc(Cl)cc(S(=O)(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1	811683193	QZZMQBLWVRPFQR-UHFFFAOYSA-N	439.925	1.503	50	20	IDGD	
CCc1ccccc1N1C[C@@H](C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)CC1=O	812731925	NNTZLGIXHNCWPC-INIZCTEOSA-N	430.530	1.996	50	20	IDGD	
CN(C)c1ccc(C2(C(=O)OCC(=O)NNC(=O)[C@H]3COc4ccccc4O3)CC2)cc1	815304117	KNLUNTLEBOOIGI-LJQANCHMSA-N	439.468	1.315	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1nnn(Cc2ccccc2F)c1C	815568350	DPEZVBXNIVPUER-UHFFFAOYSA-N	440.435	1.111	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)CS[C@H]2CCS(=O)(=O)C2)c1	818745989	NWRJHTSGUYUELA-JTQLQIEISA-N	437.337	1.599	50	20	IDGD	
C[C@@H]1CN(S(=O)(=O)c2cc(C(=O)NNC(=O)CC3CC3)ccc2Cl)C[C@@H](C)O1	819104989	VCQLXYJYBWBTMT-VXGBXAGGSA-N	429.926	1.699	50	20	IDGD	
Cc1c(NC(=O)[C@@H](C)SCC(=O)NNc2ncccn2)c(=O)n(-c2ccccc2)n1C	913044407	WLISUWKUGNFXJI-CQSZACIVSA-N	441.517	1.478	50	20	IDGD	
C=CCNC(=S)NNC(=O)c1ccc(OC)c(S(=O)(=O)N[C@H]2CCCC[C@@H]2C)c1	913435541	WTCBAMXPCCZVKT-ZFWWWQNUSA-N	440.591	1.847	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)[C@H]2CC(=O)N(C3CCCCC3)C2)c2ccccc2c1=O	914829659	JVVZDSJRHBZAAO-HNNXBMFYSA-N	439.516	1.920	50	20	IDGD	
Cn1cc(S(=O)(=O)N2CCCCC2)cc1C(=O)NNC(=O)c1ccc2ccccc2n1	914846082	VBMWDWKLFKNNHR-UHFFFAOYSA-N	441.513	1.823	50	20	IDGD	
CN(C)S(=O)(=O)c1c[nH]c(C(=O)NNC(=O)Cc2nc(-c3ccccc3)cs2)c1	915065369	PTLVJMZDYPWLAU-UHFFFAOYSA-N	433.515	1.392	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)CNS(=O)(=O)c1cccs1	915188672	JVVKTAZSXDLQMA-CYBMUJFWSA-N	433.511	1.795	50	20	IDGD	
CCC(=O)N[C@H](C)C(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2OC)c1	916142286	FYWVACZLRKUMOZ-CYBMUJFWSA-N	448.501	1.172	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)NCc2cccc(NS(C)(=O)=O)c2)c1C	916246327	DQAVHKREPSWMJP-HNNXBMFYSA-N	434.518	1.973	50	20	IDGD	
COC(=O)c1cccc(S(=O)(=O)NNC(=O)c2ccc(F)cc2Br)c1	917754763	GUTXFIWUPFTXMT-UHFFFAOYSA-N	431.239	1.998	50	20	IDGD	
CCNC(=O)COc1cccc(CNC(=O)NNC(=O)c2cc(OC)cc(OC)c2)c1	918090517	GLCXHJWOSPGRHF-UHFFFAOYSA-N	430.461	1.363	50	20	IDGD	
CS(=O)(=O)c1cc(S(=O)(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)ccc1F	918754281	QTXKXRJHWXHADX-UHFFFAOYSA-N	430.523	1.755	50	20	IDGD	
Cc1ccc(-n2ccnc2SCC(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)cc1C	919886424	WTXQGYPTHCVSBH-AWEZNQCLSA-N	437.547	1.099	50	20	IDGD	
O=C(NNC(=O)c1cc2c(s1)CCC2)c1cc(S(=O)(=O)N2CCSCC2)c[nH]1	921018762	BRUXHNASINWNHQ-UHFFFAOYSA-N	440.572	1.377	50	20	IDGD	
CS(=O)(=O)Nc1cccc(F)c1CNC(=O)NNC(=O)Cn1ccc2ccccc21	1116246657	WQUVPDLSURXSOY-UHFFFAOYSA-N	433.465	1.683	50	20	IDGD	
CCc1nn(C)c(OC)c1CNC(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1	1116456607	XNXJSBHZBLADMR-UHFFFAOYSA-N	438.529	1.469	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)c1cn(-c2ccc(Br)cc2)nn1	1317813356	DMVMVNSBZOCPIA-UHFFFAOYSA-N	445.277	1.912	50	20	IDGD	
CS(=O)(=O)Nc1ccc(O)c(C(=O)NNC(=O)c2ccc(Br)cc2)c1	1319780481	ASXKQIPTTIEROI-UHFFFAOYSA-N	428.264	1.601	50	20	IDGD	
Cc1cc(S(=O)(=O)NCCNC(=O)NNC(=O)c2ccccc2Cl)c(C)s1	1322773101	OOSGMVOBHINZSR-UHFFFAOYSA-N	430.939	1.941	50	20	IDGD	
COc1cc(C)c(Br)cc1S(=O)(=O)NNC(=O)c1n[nH]c2c1CCCC2	1323496318	MJUNQNDBFJBNNW-UHFFFAOYSA-N	443.323	1.991	50	20	IDGD	
C[C@H]1CCc2c(C(=O)N3CC[C@@]4(CN(C(=O)CCBr)CCO4)C3)n[nH]c21	1777850291	LHJSIUHPTJNOOT-KPZWWZAWSA-N	425.327	1.688	50	20	IDGD	
COc1ccc2nc(C(=O)N3CC[C@]4(C3)CN(C(=O)[C@H](O)CCl)CCO4)ccc2c1	1777891995	TWHDSXNTZOWNPT-NQIIRXRSSA-N	433.892	1.287	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc3nccn3c2)C1	1778704219	KBWCUCYTCVKYFJ-CBGDNZLLSA-N	434.924	1.716	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](C)Nc3cnccn3)C2)C1	1779062834	WRYISLBHZFZHLC-QWQRMKEZSA-N	440.342	1.280	50	20	IDGD	
C=C(Oc1ccccc1O)C(=O)N1CCO[C@]2(CCN(C(=O)CO[Si](C)(C)C)C2)C1	1779295377	LABAHHLZIKTHMN-NRFANRHFSA-N	434.565	1.966	50	20	IDGD	
CN1CCCn2nc(C(=O)N3CCO[C@@]4(CCN(C(=O)CO[Si](C)(C)C)C4)C3)cc2C1	1779299173	PHLYZPWDDAZYBP-OAQYLSRUSA-N	449.628	1.014	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3c(-c4ccncn4)noc3C)C2)C1	1780052128	PJISFRFRICKSPP-VBKZILBWSA-N	449.895	1.137	50	20	IDGD	
O=C(c1ccc(OC(F)F)cc1F)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1780140205	SCLSCOPWOXBAAZ-KDOFPFPSSA-N	436.814	1.470	50	20	IDGD	
CC(=O)N(C)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@](C)(Cl)CCl)C1	1780707980	ZEZRMKMORVRNFH-ATZDWAIDSA-N	436.380	1.605	50	20	IDGD	
COc1ccc(CC(=O)N2CC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)c(C#N)c1	1781177379	WRPSLIVWGIMXRG-IBGZPJMESA-N	426.300	1.743	50	20	IDGD	
CN(C)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)[C@](C)(Cl)CCl)C2)C1	1781228439	OOWJWDGODOBLNS-RTBURBONSA-N	429.348	1.827	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc4nn[nH]c4c3)CCO2)C1	1781233219	RKJDRKWSJWGKOG-ROUUACIJSA-N	426.304	1.638	50	20	IDGD	
COCC(=O)N1CCO[C@]2(CCN(C(=O)/C(C#N)=C/c3ccc(Br)cc3)C2)C1	1782869512	DJQZZQCAFXKHNA-NXZBIGBUSA-N	448.317	1.832	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)C(=O)c3cccn3C)C2)C1	1784606718	LIPKHMKTSVOBBO-UGSOOPFHSA-N	426.311	1.069	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(CCN(C(=O)c3cccc4c3CCCC4)C2)C1	1785091755	GTJDYYURUOCZDX-RUZDIDTESA-N	448.328	1.003	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1(c2ccc(NC(=O)[C@@H](O)CCl)cc2)CCC1	1786132096	IRRREHGINICAGP-ROCQKPIASA-N	445.907	1.854	50	20	IDGD	
CCc1[nH]nc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](Cl)COC)C[C@@H]32)c1Cl	1787133392	OEMJHSMJLGXAQI-MNXVOIDGSA-N	433.336	1.473	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc4ccccn34)[C@H]2C1	1787932465	RMOXGGVRHHDTLY-JKQORVJESA-N	449.349	1.959	50	20	IDGD	
Cc1nccc(C(=O)NC2(c3ccc(NC(=O)c4cccc(B(O)O)c4)cc3)CCC2)n1	1788145622	JFRYRTJUYDXJBN-UHFFFAOYSA-N	430.273	1.526	50	20	IDGD	
CC(C)(C)n1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]3C2)nn1	1789870507	KKWFOPWSOQRQHH-NGOJXBLDSA-N	446.379	1.863	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)Nc1ccc(C2(NC(=O)CC[C@H](N)C(N)=O)CCC2)cc1	1790492568	JLIBPOQBLQHISX-KSSFIOAISA-N	429.348	1.950	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](N)c3ccccn3)C[C@@H]21	1790961878	SJAZQQDUFLCTBE-CUINURIISA-N	439.354	1.235	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](N)c3ccccn3)C[C@@H]21	1790961887	SJAZQQDUFLCTBE-QZLJAVCYSA-N	439.354	1.235	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc(Cl)nc1)C2	1792867159	ZAOVEVSUUXUDKC-FOUMNBMASA-N	431.718	1.364	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Cl)C3)C[C@@H]2C[C@@H]21	1792995196	FAJFJHNLERGVGG-SNEOULSLSA-N	445.919	1.508	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@@H](C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](O)CCl)C3)C[C@H]2C[C@H]21	1793129127	KCPJBXKFWXFARO-OCWHGYOISA-N	441.956	1.622	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1ccc2ncccc2c1	1793859052	IGNVVUQFCNVPIE-ACDBMABISA-N	437.544	1.789	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(C)(C)C)C2	1793881092	OMGDYXXUUUFZLJ-XGUBFFRZSA-N	431.961	1.754	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CNc2ccccc21	1795624073	BDTFTMXNJRDBRI-RZXDWDHASA-N	436.350	1.959	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](CCN)NC(=O)OC(C)(C)C	1796031167	ZIRUFDHORITREH-YIDVYQOGSA-N	446.976	1.121	50	20	IDGD	
O=C(CCCc1ccccc1F)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1	1796189748	VEYFDUBBIIDDNL-WKCHPHFGSA-N	438.308	1.780	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc2scnc2c1	1798157231	KVIFRPXLXVGJBO-MUJYYYPQSA-N	429.546	1.921	50	20	IDGD	
COc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Br)C3)ccc1C	1798971007	LMQBPFAONIPTSR-OCVGTWLNSA-N	429.286	1.897	50	20	IDGD	
COc1ccc([C@H](O)C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Br)cc1	1799343158	OQQGAXRJESKQHE-PTNZTPPNSA-N	445.285	1.009	50	20	IDGD	
CC[C@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1O)C2	1800073582	SYZKQXMNYUXXLK-FQMQPWHVSA-N	443.972	1.870	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(OC(F)F)cc1)c1cccc(B(O)O)c1	1800473552	BODBNJGEUGTLFC-BCDXTJNWSA-N	444.243	1.533	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nnsc1C1CC1)C2	1800757732	PCHNVUFUOLFRLX-KXGXSXBTSA-N	429.340	1.402	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCCNC(=O)OC(C)(C)C	1802122408	NLHHZRDHSMBHDE-JYYAWHABSA-N	431.961	1.898	50	20	IDGD	
CC(C)(CCl)C(=O)NC[C@@H]1CCN(C(=O)Cn2ccncc2=O)[C@@H]1c1cccnc1	1802904735	NSMDSMIJXIATIM-QFBILLFUSA-N	431.924	1.609	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)/C=C/c2ccoc2)[C@H]1c1cccnc1	1804320326	SMWZVNQSCNNVKO-FDTLDTTQSA-N	439.516	1.767	50	20	IDGD	
O=C(C1CCC2(CC1)OCCO2)N1CCC2(CCCN(C(=O)[C@H](O)CCl)C2)CC1	1805526516	UGAARGKEUVIDGT-QGZVFWFLSA-N	428.957	1.751	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC2(CCCN(C(=O)C(F)(F)C(F)F)C2)CC1	1806497951	PZJFXUMDIFVMRP-UHFFFAOYSA-N	445.417	1.430	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)c1nccc2[nH]ccc12	1808087230	RXAGUFWPKCGXED-POZUXBRTSA-N	427.892	1.877	50	20	IDGD	
CN(C)C(=O)NCC(=O)N1CC[C@H](CNC(=O)[C@@H](F)Br)[C@@H]1c1cccnc1	1808649263	LYLTWHMPHZLFSH-VHDGCEQUSA-N	444.305	1.049	50	20	IDGD	
O=C([C@H](O)CCl)N1CC[C@H](CNC(=O)C2(Br)CC2)[C@H]1c1cccnc1	1808695668	TXLLNYBUEZQGGF-MGPQQGTHSA-N	430.730	1.615	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1	1810305180	IYKKCLGGPCHPCR-WBAXXEDZSA-N	444.923	1.417	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2cnn3c2OCCC3)[C@H]1c1cccnc1	1812120423	WLTPFPHCRATDLP-RYQLBKOJSA-N	447.923	1.634	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2cnncc2C(=O)O)[C@H]1c1cccnc1	1813031975	STWIBAHKFNEQMR-COXVUDFISA-N	447.879	1.143	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2cccn2C)[C@@H]1c1cccnc1	1813069708	ASIBAHQBLTZQTC-DYESRHJHSA-N	426.521	1.113	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(=O)n4[nH]cnc4n3)sc2C1	1815330256	MIWDQGZBGPCGQY-RKDXNWHRSA-N	435.897	1.117	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3[nH]nc4ncccc34)sc2C1	1816874487	NEXUCHUEBVRXPE-ONGXEEELSA-N	434.909	1.894	50	20	IDGD	
Cc1ccoc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2	1817415776	NCBLQLMKXRYDJZ-CQSZACIVSA-N	425.275	1.264	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](O)CCl)CC2)c1cc(N2CCCC2)ccn1	1817576718	FGQDNUKNFSKSPX-LRDDRELGSA-N	449.964	1.964	50	20	IDGD	
CN1CCN(C2(C(=O)N3CCCC[C@H]3c3cc(NC(=O)[C@H](F)Cl)n[nH]3)CC2)CC1	1818041148	BVWXTBBPIHTSJO-HOCLYGCPSA-N	426.924	1.716	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](F)Br)n[nH]1	1820935443	MMMULBXENBROPF-OLUVUFQESA-N	430.278	1.783	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccn3c(O)nnc23)[nH]n1	1822369508	OLRDTVDJYLYUQA-TZMCWYRMSA-N	447.883	1.718	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)C(O)O)CC1	1824022043	CSNGFYNJNQEIFS-GJZGRUSLSA-N	447.960	1.049	50	20	IDGD	
O=C([C@@H](O)CCl)N1CCC([C@H]2CCCCN2C(=O)Cn2cc([N+](=O)[O-])cn2)CC1	1825125819	XVQNGZVWEVYMDX-CVEARBPZSA-N	427.889	1.011	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCN1CCOC1=O)CC2	1826000258	QBVJQFCSJYVNTL-GHMZBOCLSA-N	430.914	1.151	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccccc1C(N)=O)CC2	1826006612	KSYINVRCSXHEKE-GWCFXTLKSA-N	436.921	1.722	50	20	IDGD	
COc1ccc(C(=O)N[C@@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)nc1	1826085836	DIIKXSXJJUHTJN-GFCCVEGCSA-N	446.533	1.146	50	20	IDGD	
N#Cc1ccc(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)cc1	1829635811	QFLUMPLLTATASK-FQEVSTJZSA-N	440.327	1.751	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cscn3)C2)C1	1830538998	YDFUULFOCIUEHN-SUMWQHHRSA-N	446.367	1.173	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3CC=CCC3)C2)C1	1830543328	PYLONSZEOWEGFX-TXPKVOOTSA-N	429.355	1.830	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)n3cccc3)C2)C1	1830545902	ODETZOHXUCZMQA-MDZRGWNJSA-N	442.354	1.537	50	20	IDGD	
Cc1ccc2[nH]c(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)[C@@H](O)CCl)CCO4)cc2c1	1830728578	VKTVGARPJJTJTE-GHTZIAJQSA-N	435.908	1.146	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)Nc3nccs3)C2)C1	1831645583	CMTDPYUXOJZDFN-DOXZYTNZSA-N	444.985	1.807	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3Cc4ccccc4CN3)C2)C1	1831647680	YBHBPFWUXWHXEK-JTAQYXEDSA-N	449.979	1.565	50	20	IDGD	
COc1ccccc1CC(=O)N1CCC(N2CCC(NC(=O)[C@H](O)CCl)CC2)CC1	1833312319	PUBPYWOBTDJINK-LJQANCHMSA-N	437.968	1.409	50	20	IDGD	
CN(C)c1cccc(C(=O)N2CCC(N3CCC(NC(=O)[C@@H](O)CCl)CC3)CC2)c1	1833313220	ADTPBQRPOQDPIY-FQEVSTJZSA-N	436.984	1.538	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)nc1	1834379422	XSIWHYIQHWLTQB-PBHICJAKSA-N	430.274	1.151	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)C3CC4(CCC4)C3)C2)C1	1834826795	WDOFMVRSHXFSDD-IBGZPJMESA-N	429.355	1.808	50	20	IDGD	
CCc1ccnc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)c1	1836360038	DPHFWSUPXFWWLU-KUHUBIRLSA-N	440.338	1.497	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H]3Cc4ccccc4CN3)CCO2)C1	1836485010	KZQAJQYQAUZTCK-XQBPLPMBSA-N	435.952	1.175	50	20	IDGD	
Nc1ccccc1/C=C/C(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836716898	WWVASHHEFDWKBB-RRFGBZISSA-N	435.952	1.880	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc4c(c3)CC(=O)N4)CCO2)C1	1836784488	KOEIYVFYQHXMLP-JOCHJYFZSA-N	449.935	1.516	50	20	IDGD	
O=C(c1cc2c(s1)CCCC2)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1	1836875509	HHYIWGVJTIELCR-MGPUTAFESA-N	442.965	1.297	50	20	IDGD	
O=C(c1n[nH]c2c(F)cccc12)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1837058077	XIMAOBBNVMBWLU-QAPCUYQASA-N	428.823	1.306	50	20	IDGD	
C[C@@H](Nc1ccccc1)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1837341238	CFGOGGAAUMMZDD-KUHUBIRLSA-N	430.332	1.747	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)c3cn(C)cn3)CC2)CC1	1837551632	QHNIUVVEELIVMB-ZDUSSCGKSA-N	427.343	1.816	50	20	IDGD	
O=C(c1ccc2c(n1)OCCO2)N1CCC(OC2CCN(C(=O)[C@H](F)Cl)CC2)CC1	1838059322	KEVHCQHDKNZINA-KRWDZBQOSA-N	441.887	1.999	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](OC(C)=O)C(C)C)CC2)CC1	1838360965	IQPIPCWGXKPWRU-OALUTQOASA-N	446.972	1.827	50	20	IDGD	
COc1c(Cl)ccnc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1838727979	CNNRIHHYDXMQHG-PBHICJAKSA-N	436.267	1.348	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(F)cc3)CCO2)C1	1838956373	HFNAEOZQFKKLML-FZKQIMNGSA-N	429.286	1.679	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(Cl)nc(OC)c3)C2)C1	1839145929	ICGSKBJEOMCFEA-LIRRHRJNSA-N	446.331	1.831	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)c3ccco3)C2)C1	1839149349	CLYPOBXQQZMWOZ-JLSDUUJJSA-N	435.304	1.006	50	20	IDGD	
Cc1c(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)cnn1C	1839151182	KGGOTOLSRXLATG-ROUUACIJSA-N	433.336	1.035	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)C/N=C/c3ccco3)C2)C1	1839153652	NHJXQHJYNCMMRY-JBWYVXEHSA-N	446.331	1.391	50	20	IDGD	
CNc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)cc1	1839198888	FHLMZORBKHYOPC-MAUKXSAKSA-N	444.301	1.489	50	20	IDGD	
COC(=O)Nc1cccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)c1	1839244908	QEMXJYFXFDXZQI-HNAYVOBHSA-N	443.859	1.469	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(C)n4ccnc4n3)CCO2)C1	1839546704	DQQZENSWUMUOCA-IERDGZPVSA-N	449.939	1.515	50	20	IDGD	
CCc1nc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)co1	1840033532	IHICUIJXYNJZTC-SJCJKPOMSA-N	430.299	1.090	50	20	IDGD	
Cc1ccc(O)c(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)c1	1840034275	GRDZEDNVYMBJMG-AUUYWEPGSA-N	441.322	1.554	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4cccc(C)c4[nH]3)C2)C1	1840153396	NENPVSBSXIJRPH-VGSWGCGISA-N	449.935	1.800	50	20	IDGD	
CSc1ccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)cc1	1840302733	IHLVYHZAQXPWQW-PKOBYXMFSA-N	430.929	1.942	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)COc3ccccc3C#N)CCO2)C1	1840818779	WYFOIDFICMAMEU-AVRDEDQJSA-N	449.935	1.801	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](O)[C@](C)(C(=O)N2CCCC23CN(C(=O)[C@@H](F)Cl)C3)C1	1841030575	KOWJTCOTHZOTPO-IQUTYRLHSA-N	447.935	1.732	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC2(CCCN2C(=O)c2ccc(S(C)(=O)=O)cn2)C1	1842255346	PBBFUAQFJUZCLY-UHFFFAOYSA-N	425.583	1.154	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)c2nccn2C)C1	1842512454	SIKBIOWDEYQDJH-UHFFFAOYSA-N	427.417	1.384	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)C13CC(C(F)(F)F)(C1)C3)C2	1844263527	NNKUXZNERDLWRZ-UHFFFAOYSA-N	437.422	1.235	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@H]1CC(=O)N(Cc3ccccc3)C1)C2	1846360647	XFIIQXHCGTUKOJ-QZTJIDSGSA-N	433.936	1.492	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)c1n[nH]c3cc(Cl)ccc13)C2	1846385043	NUSFALSOTCZTHS-UHFFFAOYSA-N	432.912	1.406	50	20	IDGD	
Cn1cc(S(=O)(=O)N2CCCCC2)cc1C(=O)NCCSSCCC(=O)O	2088601321	COEJCHVFZJPVEL-UHFFFAOYSA-N	435.593	1.786	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@H]1CC(=O)Nc2cc(F)ccc21	10292122	OYOUHRYUEBWKQF-ZDUSSCGKSA-N	433.465	1.314	50	20	IDGD	
CN(C)c1ccc([N+](=O)[O-])cc1C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	15314707	UJKBWTPCHQMDAX-UHFFFAOYSA-N	440.504	1.634	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)CCNC(=O)OC(C)(C)C)cc1	21291252	CRWDVEYDWNAJIG-UHFFFAOYSA-N	434.522	1.783	50	20	IDGD	
CCCC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCN(Cc3ccccc3)CC2)cc1	21971245	LPASSYCKOQWTOY-UHFFFAOYSA-N	444.557	1.754	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2cccc(C[S@](C)=O)c2)c2ccccc2c1=O	25954694	PDVRNCQDANDPLS-SSEXGKCCSA-N	426.498	1.760	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)ccc1N1CCNC1=O	108787952	ABARLPLMHNHLDX-UHFFFAOYSA-N	448.483	1.890	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)CNC(=O)c1ccco1)[C@H]1CCCN(C(=O)OC(C)(C)C)C1	726271888	XZCUPEGFCGVGRA-KGLIPLIRSA-N	437.497	1.375	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)CNC(=O)CCC2CCCC2)c2ccccc2c1=O	726523353	JSVWZCNIYNIYRJ-UHFFFAOYSA-N	427.505	1.654	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)N[C@H](c1ccccc1)[C@H]1CCCO1	726711880	KTKZFVGGLBZJDD-IAGOWNOFSA-N	431.518	1.844	50	20	IDGD	
Cc1cc(C)cc(N2CC[C@H](C(=O)OCC(=O)NNC(=O)Cc3nc(C)cs3)C2=O)c1	728728784	AYVYIYTZRDWOSG-INIZCTEOSA-N	444.513	1.355	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)c1sccc1S(=O)(=O)N1CCCCC1	730777818	DTCQUBLRPJCRME-UHFFFAOYSA-N	439.515	1.468	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@@H]2CCOc3ccccc32)c1	731284560	AEWPDPUHDZQQFC-HNNXBMFYSA-N	432.502	1.447	50	20	IDGD	
CCOCCCn1c(NNC(=O)CCc2c(C)nc(O)nc2O)nc2ccccc2c1=O	733268619	QUAZSMFYSZWKHL-UHFFFAOYSA-N	442.476	1.409	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)NCc2ccnc(OC3CCOCC3)c2)cc1C	733653730	LCKNIVFEBXLCRC-UHFFFAOYSA-N	441.488	1.725	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2c(F)cccc2NC(C)=O)cc1OC	734194730	DSBNOGYUGCXGLE-UHFFFAOYSA-N	433.392	1.419	50	20	IDGD	
CC(C)n1nc(C(=O)NNS(=O)(=O)c2ccc(C#N)cc2F)c2ccccc2c1=O	739669990	BCLSGFLYHMTTBU-UHFFFAOYSA-N	429.433	1.611	50	20	IDGD	
CCCC[C@@H](/N=C1/NS(=O)(=O)c2ccccc21)C(=O)NNc1ccnc(N(C)C)n1	740103465	QPHSDRMQCCKYIQ-CQSZACIVSA-N	431.522	1.283	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)cc1NC(=O)Nc1ccccc1	741214573	YIKQYUFXKMQRAH-INIZCTEOSA-N	445.501	1.770	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(CC(=O)NNc2ccc(Br)cc2)C(=O)C1	741282357	NTWKHVIZWCIYPB-UHFFFAOYSA-N	427.299	1.972	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2sccc2C)c1	741647697	JMFGXJBSEFZVDO-UHFFFAOYSA-N	431.561	1.710	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NNC(=O)c2cccc(Br)c2)cc1	742769843	RHKWJCAESPXWCR-LBPRGKRZSA-N	440.319	1.886	50	20	IDGD	
COC(=O)c1ccc(COc2ccc(C=NNC(=O)Cc3cc(O)nc(O)n3)cc2)cc1	743445548	AAGXSAGHFQRUJP-UHFFFAOYSA-N	436.424	1.946	50	20	IDGD	
O=C(Cc1ccc(Cl)cc1)NNC(=O)N[C@H]1CC(=O)N(CCOc2ccccc2)C1	743638276	ROOKWTKOZGJDBR-KRWDZBQOSA-N	430.892	1.893	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)C2=NN(Cc3ccccc3)C(=O)CC2)c1	744783929	LDERJHKHLZHNIK-UHFFFAOYSA-N	433.424	1.041	50	20	IDGD	
CC(=O)c1cccc(O[C@@H](C)C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)c1	745107566	HSQNKHWYRBEOCW-INIZCTEOSA-N	447.513	1.433	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)NCCN2CCOC(C)(C)C2)cc1Cl	745792364	CRRLDRUCHXGVRU-UHFFFAOYSA-N	429.905	1.804	50	20	IDGD	
O=C(CCNS(=O)(=O)c1cccc(Cl)c1)NNC(=O)Cc1cn2ccccc2n1	746642137	VNAVIQLWWKTVBG-UHFFFAOYSA-N	435.893	1.046	50	20	IDGD	
CCOc1ccc(-c2nnc(S)n2CCC(=O)NNC(=O)Cc2ccncc2)cc1	747428549	QOPNTKRDDPKDHX-UHFFFAOYSA-N	426.502	1.808	50	20	IDGD	
O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)NNC(=O)c1ccc(Br)cc1Cl	747867818	UBNHGRMSCIHZRV-UHFFFAOYSA-N	429.614	1.634	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2C[C@H](CC(=O)N(C)C)c3cc(Cl)ccc32)n1	749445437	RRAFLNZBTUWSJI-ZDUSSCGKSA-N	449.964	1.877	50	20	IDGD	
Cc1oc2ncn(C)c(=O)c2c1C(=O)NNC(=O)COc1ccc(Br)cc1	750600592	WYCNJODJSXGDDY-UHFFFAOYSA-N	435.234	1.437	50	20	IDGD	
O=C(CCNC(=O)C1CCCCC1)NNC(=O)CCN1CCN(c2ccccc2)CC1	751043113	JAUXWRCYTUQRPH-UHFFFAOYSA-N	429.565	1.433	50	20	IDGD	
Cc1ccc(CNC(=O)NNC(=O)c2nnc(O)c3ccccc23)c(N2CCOCC2)c1	753948329	XUEDNHNYWARZOQ-UHFFFAOYSA-N	436.472	1.625	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)cc1OCc1ccncc1	755664862	AVAKJNBLROGWHR-AWEZNQCLSA-N	434.474	1.257	50	20	IDGD	
COCC[S@](=O)Cc1cccc(NC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1	756613940	RVGYVVYJQKBAMX-PBYQXAPXSA-N	433.486	1.574	50	20	IDGD	
CCOC(=O)[C@@H](C)NC(=O)c1ccc(NC(=O)NNC(=O)c2cccc(C#N)c2)cc1F	756818766	PPMJEWPDNDNNGN-GFCCVEGCSA-N	441.419	1.845	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)Nc1cc(C2CC2)nn1[C@@H]1CCS(=O)(=O)C1	756857976	ZIQCFLZFAIOKMM-OAHLLOKOSA-N	435.481	1.655	50	20	IDGD	
O=C(NN=c1cc[nH]cc1Cl)[C@@H]1CCCN1S(=O)(=O)c1cccc([N+](=O)[O-])c1	757420019	GKGKSQUYUMKTPQ-HNNXBMFYSA-N	425.854	1.362	50	20	IDGD	
Cc1nn([C@@H]2CCS(=O)(=O)C2)c(C)c1NC(=O)NNC(=O)c1ccc2c(c1)OCO2	757872213	WLZAESFYAKUYLK-CYBMUJFWSA-N	435.462	1.055	50	20	IDGD	
Cn1cnc(C(=O)NNC(=O)CCN2CCN(C(c3ccccc3)c3ccccc3)CC2)c1	758055564	RALPIEFTQIIUAT-UHFFFAOYSA-N	446.555	1.978	50	20	IDGD	
O=C(c1nn(-c2ccccc2)cc1O)N1CCN(S(=O)(=O)CBr)CC1	758522429	HYDZCPFHJDIPRA-UHFFFAOYSA-N	429.296	1.018	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)C(=O)Nc1ccccn1)[C@H]1CCCN(C(=O)OC(C)(C)C)C1	758748499	NXBGSQMRRSXUCK-KBPBESRZSA-N	434.497	1.386	50	20	IDGD	
CN(NC(=O)c1nnc2ccccc2c1O)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758781954	JKRPMWGUVOLWDC-UHFFFAOYSA-N	430.465	1.585	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)NC[C@@H]1CN(Cc2ccccc2)CCCO1	759029129	PRIKPSBVLDTDMM-OAQYLSRUSA-N	426.517	1.825	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)[C@@H]2CCCN2C(=O)/C=C\c2ccc(C(N)=O)cc2)nc1	759729466	VJVWNQKVYCWEDN-KOJMWDNASA-N	437.456	1.115	50	20	IDGD	
CC1(C)C(=O)N(C[C@@](C)(O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c2ccccc21	760329796	QFLRUUJTCHURSM-XMMPIXPASA-N	447.495	1.709	50	20	IDGD	
CS(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)c2cccc(OC(F)F)c2)cc1F	760361789	AEWQELQXSDHKNG-UHFFFAOYSA-N	438.405	1.454	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)NCC1(NS(C)(=O)=O)CCCCC1	761654012	OFKRXHDBAIYAPT-UHFFFAOYSA-N	444.579	1.370	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNS(=O)(=O)c1ccc(C(=O)N2CCCC2)c(F)c1	763416612	NPMUEDOAVJNIDJ-UHFFFAOYSA-N	445.476	1.641	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)ccc1C	763439965	ZFNYTHYOVKZPJM-UHFFFAOYSA-N	429.495	1.396	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cc(F)cc(F)c2OC)cc(OC)c1OC	763540717	YQBDTVJUFUTHRW-UHFFFAOYSA-N	439.371	1.399	50	20	IDGD	
C[C@H](Cn1ncc2ccccc2c1=O)NC(=O)NNC(=O)CCCNC(=O)OC(C)(C)C	763555405	UXBGUWYCQYGXPP-CQSZACIVSA-N	446.508	1.420	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)C(=O)Nc2cccc(-n3cnnn3)c2)c1	763597638	QSAJUKPQZIQRNW-UHFFFAOYSA-N	437.460	1.259	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(NC(=O)OC(C)(C)C)nc2)c1	763619318	SCEGYOHRMDXKMC-UHFFFAOYSA-N	443.460	1.902	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2cccc(CN3CCOC3=O)c2)c1	763772043	KXXHPVXBFRRWTO-UHFFFAOYSA-N	442.428	1.056	50	20	IDGD	
O=C(NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)C(=O)Nc1cccc(F)c1	763796429	DJPMFEYMERSVTQ-UHFFFAOYSA-N	434.449	1.010	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)COc2ccc(C)cc2)ccc1N1CCCC1=O	763820922	NCWMGLJJPPMLBW-UHFFFAOYSA-N	440.456	1.295	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(F)c(C(=O)N(C)C)c2)c1C	763840586	MVSXTQQCCBGEAZ-CQSZACIVSA-N	444.463	1.698	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)ccc1C(=O)N(C)C	763867994	ZOLNNRXYTDSURQ-ZDUSSCGKSA-N	430.436	1.389	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccc(NC(=O)c3ccco3)c(C)c2)n1	763892665	HBWVRJFWJMGFKW-UHFFFAOYSA-N	438.444	1.440	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(C(N)=O)cc2F)ccc1OC(C)C	763915683	DKDGWHZQSGVMFW-UHFFFAOYSA-N	432.408	1.120	50	20	IDGD	
CCNC(=O)N1CCc2ccc(NC(=O)C(=O)NNC(=O)Cc3ccc(F)cc3)cc21	763919648	WQWPMSHQKCNLJL-UHFFFAOYSA-N	427.436	1.246	50	20	IDGD	
CC(C)n1ncc2cc(NC(=O)C(=O)NNC(=O)c3nn(-c4ccccc4)cc3O)ccc21	763943238	AJKDPJYIZJPCHK-UHFFFAOYSA-N	447.455	1.908	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3ccc4c(c3)OCC(=O)N4)cc2C1	763944259	YDLFNOCWVYJBSL-JTQLQIEISA-N	428.470	1.604	50	20	IDGD	
COc1ccc2cc(NC(=O)C(=O)NNC(=O)c3cc(Br)c[nH]3)ccc2n1	763994879	IPPHBUPYFVBPEE-UHFFFAOYSA-N	432.234	1.734	50	20	IDGD	
COCCOCc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2OC)c1	764010831	DTYSXYXFLJBGCT-UHFFFAOYSA-N	435.864	1.911	50	20	IDGD	
CC(C)Oc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c(F)c1	764078625	YPVXFJNIMWCLNP-UHFFFAOYSA-N	437.449	1.416	50	20	IDGD	
CN1Cc2ccc(NC(=O)C(=O)NNC(=O)c3ccc(F)cc3Br)cc2C1	764086333	QVPATLCTHAYBSE-UHFFFAOYSA-N	435.253	1.933	50	20	IDGD	
COC(=O)CCOc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)cc1	764116249	CMNSWSGLZWDEQQ-UHFFFAOYSA-N	435.820	1.387	50	20	IDGD	
CCOC(=O)c1cc(F)c(F)cc1NC(=O)C(=O)NNC(=O)Cc1ccccc1OC	764135249	FBVOZHIHXJONOD-UHFFFAOYSA-N	435.383	1.479	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)CCCc3ccccc3)cn2)C[C@H](C)O1	764225115	YJBXMNNOZSLMRZ-IRXDYDNUSA-N	439.516	1.804	50	20	IDGD	
CCOC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)cc1	764239038	BHRZWDHJTMPBRD-UHFFFAOYSA-N	438.440	1.369	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)ccc1NC(C)=O	764369348	DBFDZUXFVSELDW-UHFFFAOYSA-N	436.371	1.411	50	20	IDGD	
CC(=O)N1CCCc2cc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc3ccccc3)ccc21	764371149	YFHYUMSDBILDBB-UHFFFAOYSA-N	446.410	1.743	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NCc1cccc(Br)c1O	764771204	UWOIUVOFYPCFOU-UHFFFAOYSA-N	427.280	1.477	50	20	IDGD	
COc1cccc(OCC(=O)NNC(=O)c2cc(-c3ccc(OC)c(OC)c3)[nH]n2)c1	765598449	KUQPFRAODWBQDP-UHFFFAOYSA-N	426.429	1.943	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)c2ccc3c(c2)NC(=O)[C@H](C)N3C)n[nH]1	765600728	TTZZORIFXKJVDH-LBPRGKRZSA-N	434.456	1.937	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cccc(-n4cccn4)n3)CC2)cc1	765748415	DCWWWLIPEKWZRA-UHFFFAOYSA-N	433.516	1.155	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)CN1CCN(Cc2nc(-c3ccccc3)no2)CC1	766848857	MOLKIBISYKPFLH-UHFFFAOYSA-N	448.527	1.553	50	20	IDGD	
COCCN(CCNC(=O)NNC(=O)c1ccc2c(c1)OCCO2)C(=O)OC(C)(C)C	767302278	MUVBAGTZQGJWFX-UHFFFAOYSA-N	438.481	1.285	50	20	IDGD	
C[C@@](O)(C1CCN(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)CC1)C(F)(F)F	767330391	RTSUHXQSYKOCNI-GOSISDBHSA-N	444.458	1.459	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C[C@H]1CN(Cc2ccccc2)CCO1	768636976	APBXNGRIFAEWQW-KRWDZBQOSA-N	433.530	1.833	50	20	IDGD	
O=S(=O)(/C=C/c1cccc(Cl)c1)N1CCN(S(=O)(=O)CBr)CC1	768889481	BOVSFGTWUHGVDK-RUDMXATFSA-N	443.772	1.940	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)c1cc(O)nc(C2CC2)c1	771417332	ZZSMNMSGVAEKPN-UHFFFAOYSA-N	443.935	1.897	50	20	IDGD	
CNC(=O)COc1cccc(CC(=O)NNC(=O)NCc2cccc(C(F)(F)F)c2)c1	772221052	KACSOEKIEGZLSL-UHFFFAOYSA-N	438.406	1.903	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)[C@](C)(O)CN1Cc2ccccc2C1=O	772968109	CHELTAPWLNMADH-LRTDBIEQSA-N	431.876	1.662	50	20	IDGD	
CCC(=O)N1CC[C@H](C(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)C1	773265633	NHWREIZUVXGDFW-IBGZPJMESA-N	447.499	1.408	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2ccc(S(=O)(=O)N3CCCCCC3)cc2)n1	773727303	VRLQHLACHISFLF-UHFFFAOYSA-N	448.505	1.132	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccc(NC(=O)NNC(=O)Cn2ccc3ccccc32)nc1	776062736	JLDPJSLXISCBKG-UHFFFAOYSA-N	444.517	1.966	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@@H](C)C2CN(C(=O)OC(C)(C)C)C2)c2ccccc2c1=O	776315829	ZEODPNJXIZPOBD-ZDUSSCGKSA-N	443.504	1.680	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)N1CCN(c2nnc(C(F)(F)F)s2)CC1	776876487	HGWIGKMYHWMZQO-UHFFFAOYSA-N	430.412	1.742	50	20	IDGD	
CC(C)(C)OC(=O)NCC(F)(F)CNC(=O)NNC(=O)Cc1cn2ccccc2n1	777672400	HFKFFXQJBDFWTK-UHFFFAOYSA-N	426.424	1.367	50	20	IDGD	
CN1C(=O)C[C@@H](C(=O)NNC(=O)CNC(=O)OC(C)(C)C)[C@H]1c1ccc(Cl)c(F)c1	778443479	UAMBHLYKTJCGMX-BDJLRTHQSA-N	442.875	1.671	50	20	IDGD	
COCC(=O)N1CCc2cc(NC(=O)C(=O)NNC(=O)c3ccc(C)c(F)c3)ccc21	778727279	XHUWUKCOAWZTKP-UHFFFAOYSA-N	428.420	1.069	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ccccc2OC(F)(F)F)cc1S(N)(=O)=O	778803712	QWTBORJLBFIWEV-UHFFFAOYSA-N	432.380	1.623	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H]1C(=O)NNC(=O)COc1ccc(Br)cc1	780156426	PNNMWCYRHOYZBQ-CYBMUJFWSA-N	428.283	1.985	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1S(=O)(=O)NNC(=O)c1cccc(OC(F)F)c1	780387743	POPXTCIEWJISIK-UHFFFAOYSA-N	449.457	1.162	50	20	IDGD	
CCNC(=O)N(C)NC(=O)c1ccc(OC)c(S(=O)(=O)N[C@H]2CCCC[C@@H]2C)c1	780711483	LWLKNHJOMSVYHJ-ZFWWWQNUSA-N	426.539	1.858	50	20	IDGD	
CC(C)(C)OC(=O)N1Cc2ccc(CNC(=O)NNC(=O)C(=O)N3CCCC3)cc2C1	780773222	CXNIDVYZQLMBSC-UHFFFAOYSA-N	431.493	1.390	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)[C@H]1CCCN(C2CCC2)C1	781404135	PNRYSWHTRRSQAR-AEFFLSMTSA-N	429.569	1.676	50	20	IDGD	
CCOC(=O)CNC(=O)[C@H]1COCCN1CCP(=O)(c1ccccc1)c1ccccc1	781904572	GEJVFENWXKEVBG-OAQYLSRUSA-N	444.468	1.381	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)CCC(=O)N3CC(F)(F)F)o1	782125183	WYEZUZJLOVFKJX-UHFFFAOYSA-N	438.362	1.829	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(NC(=O)C(=O)NNc2ccc(OC)cn2)ccc1C	782145819	QYOLZVQFVGSUGZ-UHFFFAOYSA-N	435.506	1.511	50	20	IDGD	
O=C(NNc1ncncc1Cl)C(=O)Nc1ccc(F)cc1I	782159443	KQLULZIYVQPVAI-UHFFFAOYSA-N	435.584	1.956	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccc(Cl)c(F)c2)nc1	783263687	JMQJVVSQXAIJNU-UHFFFAOYSA-N	429.861	1.643	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NN=Cc2cn(Cc3cccnc3)nn2)cc1	783790437	VKZXXBMVQFQVLK-UHFFFAOYSA-N	433.501	1.906	50	20	IDGD	
CC(C)CCOc1cccc(NC(=O)C(=O)NNC(=O)CNC(=O)c2cccs2)c1	784004853	LMCAYRDBCOWZND-UHFFFAOYSA-N	432.502	1.689	50	20	IDGD	
NC(=O)[C@@H](Cc1ccc(C(F)(F)F)cc1)NNC(=O)C1CCN(c2ncccn2)CC1	784065124	NKYSCECCMMSRCU-MRXNPFEDSA-N	436.438	1.429	50	20	IDGD	
Cc1nn(C(C)(C)C)cc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	784592909	QKXWPVDQLWIHON-UHFFFAOYSA-N	449.533	1.042	50	20	IDGD	
O=C(NNc1cccnc1Cl)C(=O)Nc1ccc(CC(=O)N2CCSCC2)cc1	784842007	GWNANEATWFIBIR-UHFFFAOYSA-N	433.921	1.935	50	20	IDGD	
CS(=O)(=O)CCOc1cccc(NC(=O)C(=O)NNc2ccc(C#N)c(Cl)c2)c1	785093345	PHUVOOUSKRZPNP-UHFFFAOYSA-N	436.877	1.717	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc4c(c3)NC(=O)CC4)n[nH]2)c1	785125857	HZSWIIQNTWOSCH-UHFFFAOYSA-N	446.467	1.978	50	20	IDGD	
CNS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2nc3ccc(OC)cc3cc2C)cc1	785163695	HSUVMJNNQRQNPM-UHFFFAOYSA-N	443.485	1.542	50	20	IDGD	
CNC(=O)[C@@H]1CN(C(=O)C(=O)NNc2nc3ccc(OC)cc3cc2C)c2ccccc2O1	785164881	ZVGAMAGAQGBBLL-IBGZPJMESA-N	449.467	1.535	50	20	IDGD	
CSc1nsc(NC(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)n1	785861186	PLMPULQZZVIBND-UHFFFAOYSA-N	431.544	1.901	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNC(=O)c2cc(N3CCNC(=O)C3)ccn2)cc1	786688473	LPCANHFCHVCHAL-UHFFFAOYSA-N	425.489	1.518	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1OC(C)C	787542499	KYMFFAFNOLMIHE-UHFFFAOYSA-N	440.504	1.575	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2scnc2C)cc1C(=O)N1CCCCC1	787542530	MMWBMUIEXIGQIE-UHFFFAOYSA-N	429.502	1.786	50	20	IDGD	
Cc1cc(F)c(Br)cc1NC(=O)C(=O)NNC(=O)[C@H]1Cc2ccccc2O1	789583987	AQAGQMGKBPWWJQ-OAHLLOKOSA-N	436.237	1.986	50	20	IDGD	
CN(C)[C@H]1CCOc2c(NC(=O)C(=O)NNC(=O)C(F)(F)Oc3ccccc3)cccc21	789738242	BWCILDPJSRTWSF-INIZCTEOSA-N	448.426	1.830	50	20	IDGD	
O=S(=O)(CBr)N1CCN(S(=O)(=O)c2cc(Cl)ccc2F)CC1	790265674	SJMXEAQLIATIIE-UHFFFAOYSA-N	435.724	1.468	50	20	IDGD	
COc1cc(Cl)c(S(=O)(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)cc1OC	790336465	QDSSZIBDEJWEIS-UHFFFAOYSA-N	431.810	1.594	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)Nc2cnc3c(c2)c(=O)n(C)c(=O)n3C)c1C	790558478	JAPOTIMFWRPFCB-CXUHLZMHSA-N	436.472	1.243	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1cc([C@@H]2CCCOC2)nn1C	790952978	YRJDOCNHPBDDQS-CHWSQXEVSA-N	433.440	1.007	50	20	IDGD	
O=C(Cn1c(=O)ccn(Cc2ccccc2)c1=O)NNC(=O)c1cc2ccccc2cc1O	792515861	DYRIFSNMQUGOBZ-UHFFFAOYSA-N	444.447	1.378	50	20	IDGD	
CSSCCNC(=O)C(=O)Nc1ccc(C(=O)NCC(=O)N(C)C)c(Cl)c1	793081794	TULZZCOYNDSMJK-UHFFFAOYSA-N	432.955	1.224	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)c2cccc(C(=O)NNC(=O)c3cccc(C)n3)c2)n1	794082051	WFRYRAWJHXZMQJ-UHFFFAOYSA-N	432.440	1.243	50	20	IDGD	
CC(C)[C@@H](C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1)n1nnc(-c2ccccc2)n1	794717273	LDRJKPRTECSNCI-SFHVURJKSA-N	443.533	1.931	50	20	IDGD	
O=C(NC[C@@H]1CCC(F)(F)C1)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	797554024	NVEYLISJQDABMG-CYBMUJFWSA-N	430.477	1.851	50	20	IDGD	
Cc1cc(O[C@H]2CCN(C)C2=O)ccc1NC(=O)C(=O)NNC(=O)c1c[nH]c2ccccc12	799257924	WJRFFSCUBWIPEG-IBGZPJMESA-N	449.467	1.486	50	20	IDGD	
CCn1cnc2c1c(=O)n(CC(=O)NN=C(C)c1cnoc1C)c(=O)n2Cc1ccccc1	799473124	WICODHQDLYPPGF-UHFFFAOYSA-N	449.471	1.265	50	20	IDGD	
COc1ccc(Cl)c(NC(=O)NNC(=O)c2ccc(S(=O)(=O)N(C)C)nc2)c1	802108855	ZKNZQMPKQNJBPO-UHFFFAOYSA-N	427.870	1.460	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N(C)C[C@@H](C)OC)cc1	804839152	YJVSNPRPGDSNNO-QAEAHILHSA-N	425.489	1.834	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)c1cccc(S(=O)(=O)NCc2ccco2)c1	804956687	DAZOPZVULMQFNA-UHFFFAOYSA-N	439.457	1.491	50	20	IDGD	
CCCNS(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)c2c[nH]c3ccccc23)cc1	808068972	NCDQQSBRPSQPQY-UHFFFAOYSA-N	436.515	1.480	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)Nc3cnnn3C)c2)cc1	809908837	GNXMZBZQKYQEKQ-UHFFFAOYSA-N	445.461	1.091	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(Br)cc1)NNc1ccc([N+](=O)[O-])cc1	810573137	MKICJGBPHYZKTB-UHFFFAOYSA-N	429.252	1.779	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@H]2NC(=O)NNC(=O)C(=O)Nc1ccccn1	813808948	OYCLPEVVOJNUSS-CYBMUJFWSA-N	432.481	1.140	50	20	IDGD	
CN(CCOc1ccc(S(N)(=O)=O)cc1)C(=O)NNC(=O)Cn1ccc2ccccc21	814298693	OMMMQUNQJRALHW-UHFFFAOYSA-N	445.501	1.040	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2CCc3nncn3C2)c(OCc2ccccc2)c1	815692515	SPDKAEJEBYEEPW-QGZVFWFLSA-N	448.483	1.514	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)C[C@@H](c1nccn1C)C(F)(F)F	816828038	PGGFSSHHCPHBAB-NSHDSACASA-N	446.455	1.519	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)c2cc(S(=O)(=O)N(C)C)c[nH]2)c1	818756733	JYYIGNXYJOIWGF-UHFFFAOYSA-N	445.295	1.571	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)CN2C(=O)N[C@]3(C[C@H](C)CC(C)(C)C3)C2=O)c1	864001594	QAIAUHVRZKUQGA-CMJOXMDJSA-N	444.532	1.966	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@@H]2CC(=O)N(c3ccc(F)c([N+](=O)[O-])c3)C2)cc1OC	913120936	SFVVXWZGCGAHQV-GFCCVEGCSA-N	446.391	1.565	50	20	IDGD	
Cc1c(C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cnn1-c1ccc(F)cc1	914628006	JBTJWOSIKXGGJQ-UHFFFAOYSA-N	441.375	1.846	50	20	IDGD	
CNS(=O)(=O)c1ccc(C(=O)NNC(=O)C2=S=C3CC[C@H](C(C)(C)C)CC3=C2)o1	915064396	MFBCZAOXJFLIGT-LBPRGKRZSA-N	439.559	1.813	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)NCCN1CCN(Cc2ccccc2)CC1	915901322	HITZMRXRUUYXKO-UHFFFAOYSA-N	439.560	1.776	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)n[nH]2)cc1	916110261	TYGXXHZFUUSJGL-UHFFFAOYSA-N	441.513	1.964	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Cn2cnc3ccccc32)ccc1OCC(=O)NC(C)C	916111550	UBGNTHNPIXUOQH-UHFFFAOYSA-N	439.472	1.410	50	20	IDGD	
Cc1nn([C@@H]2CCS(=O)(=O)C2)c(Cl)c1C=NNC(=O)[C@@H](C)CN1CCCCC1	916364547	PDHCSPLWUSIKNW-DZGCQCFKSA-N	429.974	1.777	50	20	IDGD	
CCNS(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)c1	917918748	CZGCWYLYAASNKO-LLVKDONJSA-N	427.429	1.492	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@@H]2CCCCN2C(=O)c2ccco2)c2ccccc2c1=O	918409230	HIEWGSAHDHUFSF-INIZCTEOSA-N	437.456	1.465	50	20	IDGD	
CC(=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O)c1ccc(OCC(F)(F)F)cc1	920479751	RLYGKNGWBGYMHK-UHFFFAOYSA-N	445.423	1.053	50	20	IDGD	
CC(C)Oc1cccc(CC(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)c1	921023041	UHNCADPNOBTCOK-UHFFFAOYSA-N	425.894	1.778	50	20	IDGD	
O=C(NNC(=O)[C@@H](Cc1ccccc1)NC(=O)c1cccnc1)c1ccc2c(c1)OCCO2	921304260	UDZZTBBEINKVEM-LJQANCHMSA-N	446.463	1.655	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2ccc(NC(=O)CN3CCOCC3)cc2)cc1	1323814882	AFRNIPAPCDDEIF-UHFFFAOYSA-N	427.461	1.432	50	20	IDGD	
C[C@H](CNC(=O)OC(C)(C)C)NC(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1	1324015231	FDXGEMNEKWHIGT-CYBMUJFWSA-N	443.545	1.877	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3nc4ccccc4n(C)c3=O)C2)C1	1777886909	LEYJKPORAHXRLN-NYHFZMIOSA-N	446.935	1.785	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnc4sc(C)cn4c3=O)C2)C1	1777988966	FLIXNWOYXXGKGS-IFXJQAMLSA-N	438.937	1.525	50	20	IDGD	
O=C([C@H](O)CCl)N1CCO[C@]2(CCN(C(=O)[C@@H]3C[C@H]3c3ccc(Cl)cc3)C2)C1	1778185988	APHRODUGZRNOIT-XLSPSMHOSA-N	427.328	1.873	50	20	IDGD	
O=C(c1ccc2[nH]ccc2n1)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1778491434	UNADJCQDVXORLO-PBHICJAKSA-N	425.258	1.697	50	20	IDGD	
O=C1NCc2cc(C(=O)N3CC[C@@]4(C3)CN(C(=O)[C@H](F)Br)CCO4)ccc21	1778725810	LHPNBQRBSRYGCU-KBXCAEBGSA-N	440.269	1.064	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)C#CC3(O)CCCCC3)C2)C1	1779062334	LTKKWRGNNLSLPQ-OXJNMPFZSA-N	441.366	1.546	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)/C=N/O[C@H]3CCCCO3)C2)C1	1779105077	IGGCAUSHPWYHRF-IMUBYKMJSA-N	446.342	1.519	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Cl)CCO2	1780097711	FSWZUOXWHMBSBI-YJBOKZPZSA-N	443.815	1.498	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3nn(C)c(C)c3Br)CCO2)C1	1781219454	ZIFPJEAARQBFRI-PXAZEXFGSA-N	447.761	1.952	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)c3[nH]nc4ncccc34)CCO2)C1	1781226788	ACQSIXVPHCRPHG-MSOLQXFVSA-N	426.304	1.638	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)/C=N/O[C@H]3CCCCO3)CCO2)C1	1781229477	DPTBMJRMAOJJSS-ACJPLXPYSA-N	436.336	1.582	50	20	IDGD	
CCOc1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)nn1	1781230928	BEMCTCFHOMNWMW-ZWKOTPCHSA-N	431.320	1.555	50	20	IDGD	
C[C@H](Oc1ccccc1)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781333728	ISKPXSFQJWMJAW-YEWWUXTCSA-N	429.286	1.974	50	20	IDGD	
Cc1ncc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](C)Br)C2)cn1	1781996324	GEVCDGNUJRLKKW-WBHUJUFNSA-N	425.327	1.696	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)Br)C2	1782180114	SFABIHYYQDNTGM-BRXULGCHSA-N	425.751	1.538	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4nn[nH]c4c3)C2)C1	1782583308	FICDCNGHQRVEMT-ACJLOTCBSA-N	436.310	1.575	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)Cc3cnc4ccccn34)CCO2)C1	1783341902	FFCMCBSOMQTFIM-UZLBHIALSA-N	449.349	1.880	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)C3CCC4(CC3)OCCO4)CCO2)C1	1783537149	QIXSDPINPAGLCU-KDOFPFPSSA-N	445.354	1.533	50	20	IDGD	
Cc1cc(C)n(CCC(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](C)Br)C3)C2)n1	1783539945	PBTWTBFDZZWKSJ-YJBOKZPZSA-N	427.343	1.503	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](C)NC(=O)OC(C)(C)C)CCO2	1783540173	SUNDHWYKVVKZTL-JCGVRSQUSA-N	448.358	1.513	50	20	IDGD	
O=C([C@@H]1CCc2ccccc2O1)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1783845556	MIQSUXGXJGRERP-TXPKVOOTSA-N	441.297	1.901	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)C[C@@H]3CNc4ccccc4O3)CCO2)C1	1783877841	RCURDGKUVVDOKC-XFQAVAEZSA-N	437.924	1.333	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cccc(-c4cnccn4)c3)CCO2)C1	1783883679	XTYRVQSYCNSYRM-XMSQKQJNSA-N	444.919	1.841	50	20	IDGD	
CCN(CC)C[C@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]2C1	1783974643	UIIAHPMWGCHVJF-FPSMNIFISA-N	446.430	1.975	50	20	IDGD	
CCc1[nH]nc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)CBr)C[C@@H]32)c1F	1785790427	RRMMVZCXDSIMAT-UHXUPSOCSA-N	445.333	1.736	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3(C)CCCC3)C[C@@H]21	1787507316	OSNYJIBAJSMSOZ-BODMQJBDSA-N	443.548	1.680	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])[nH]3)CCC2)cc1)c1ccc(B(O)O)cc1	1788144597	SCKLFJCDDKTSCM-UHFFFAOYSA-N	448.244	1.664	50	20	IDGD	
COc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Cl)C[C@@H]32)cc1NC(C)=O	1789277854	SVEDCGFQTXHVJN-USJZOSNVSA-N	441.887	1.781	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(C)(C)OC(=O)NC(C)C)[C@H]2C1	1789753043	RQYHRJMVNGWNGL-JONQDZQNSA-N	447.960	1.133	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4c(c3)NC(=O)CO4)C[C@@H]21	1789863099	CROUMWWBLWVYND-AFIMGQEJSA-N	435.908	1.628	50	20	IDGD	
COCc1c[nH]c(C(=O)Nc2ccc(C3(NC(=O)c4cccc(B(O)O)c4)CCC3)cc2)c1	1790039186	XWGRUKOFJILNDD-UHFFFAOYSA-N	447.300	1.902	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)[C@@H](O)N3CCOCC3)CCC2)cc1)[C@@H](F)Br	1790536628	VOUZJIJGFYQMDH-RHSMWYFYSA-N	444.301	1.462	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](OC(C)=O)C(C)C)C[C@@H]21	1790960462	IINMRZDNLGPNEM-KSWRQPAISA-N	447.370	1.727	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cn4ccsc4n3)C[C@@H]21	1791055700	FDPPYIRTIVSSGP-UHXUPSOCSA-N	441.351	1.773	50	20	IDGD	
COc1ccnc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]3C2)c1	1791058924	MIBFXLPZGISWSB-DSPQJCBJSA-N	426.311	1.467	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)NNc1ccccc1	1792511994	YSXOBTLAJABAKJ-SVZOTFJBSA-N	439.354	1.365	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1nc[nH]n1)C2	1794142852	YNRLOQFJDYQECZ-RNJOBUHISA-N	426.905	1.189	50	20	IDGD	
CC(C)c1nc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)co1	1794582239	CUDUQSOKKKKGNC-BTTYYORXSA-N	426.477	1.362	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C=C/c1ccccc1N	1795650762	DWWBHVFHHYWJCL-CFBXBJJBSA-N	436.350	1.903	50	20	IDGD	
COc1c(Cl)cccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1	1796190530	IKIATCUZEQWGPT-BJWYYQGGSA-N	442.708	1.594	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnoc1	1796526649	KKDAYWJBAHUTHU-ZSBFGKGUSA-N	444.400	1.025	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnc2ccccn12	1796951301	KJVGHMJJFSTRMQ-ZJOBFFGXSA-N	435.322	1.569	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1Cc2ccccc2O1	1797825010	LDEIHHTYCBXJJW-KSQXUGCOSA-N	449.511	1.762	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)COc1cc(Cl)ccn1	1797905907	LSMWUJAWWNYWBM-HBCWATKFSA-N	441.988	1.555	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(F)c(F)cc1F)C2	1798442125	YBLBXPDKJSYBOV-ZSBIGDGJSA-N	447.417	1.668	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(Cl)nn1	1798715466	UXBKWALEJQFWNK-BQELMUNXSA-N	443.895	1.516	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc(-c3ccccn3)nc1)C2	1799264798	VRMBHGXVTGSLDF-DFGXFYAUSA-N	429.908	1.759	50	20	IDGD	
O=C(C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Br)c1ccc(Cl)cc1	1799342284	HHKWWNMJPBABBZ-NDPMZMCLSA-N	447.688	1.803	50	20	IDGD	
Cc1ccn2c(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@H](F)Br)cnc2c1	1799347560	RYVMBJSERYFBDK-VZAMPYOESA-N	439.285	1.536	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)Br	1800761635	DDASGFXVDQXRAR-SVNGYHJRSA-N	426.149	1.533	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nc3cc([N+](=O)[O-])ccc3[nH]1)C2)C(Cl)Cl	1801016762	NQRMWAMBPHRWKN-YFKFIEJBSA-N	442.259	1.478	50	20	IDGD	
O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2	1802082508	OWYIGCCGZCQFQW-RKOYIMIHSA-N	431.272	1.210	50	20	IDGD	
COc1nccc(C(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]2c2cccnc2)c1F	1803139082	SLEPOVSRXLVVOO-FRFSOERESA-N	436.871	1.544	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cnc3ccccc3n2)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803139252	MYEBTVZQGJEKMN-RYGJVYDSSA-N	439.903	1.944	50	20	IDGD	
CN(C)c1ccc(C(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)nc1	1803140058	ALRFNTVSUVNHGO-AYOQOUSVSA-N	431.924	1.462	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cc3ccccn3n2)[C@@H]1c1cccnc1)[C@H](O)CCl	1803140118	YHKCJEOKFIHHMY-KFKAGJAMSA-N	427.892	1.649	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]2c2cccnc2)cc1	1803146758	PUHQBXSISGXHRY-MISYRCLQSA-N	444.919	1.959	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)[C@H](C)NS(=O)(=O)CC)[C@H]1c1cccnc1	1803507159	NRAHMOHNFVAAGH-PQEBFOHHSA-N	444.985	1.433	50	20	IDGD	
CCS(=O)(=O)CC(=O)NC[C@@H]1CCN(C(=O)CO[Si](C)(C)C)[C@H]1c1cccnc1	1803513210	OXKPRCWGRSJULQ-LPHOPBHVSA-N	441.626	1.374	50	20	IDGD	
N=C(N)SCCC(=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@@H]1c1cccnc1	1807128785	GWDBHNDOLAFKRE-IACUBPJLSA-N	446.346	1.795	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1CCN(C(=O)c2cc(O)ncn2)[C@H]1c1cccnc1	1810540746	PWIMXPZPIKEPSJ-KXBFYZLASA-N	429.553	1.748	50	20	IDGD	
C=CCC(F)(F)C(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1812671450	GDYCKRDRKKVCCO-VQIMIIECSA-N	437.491	1.672	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2ccc(F)nc2)[C@H]1c1cccnc1	1813074270	SLELNUPTDIEKOX-IERDGZPVSA-N	442.495	1.308	50	20	IDGD	
Cc1ccc(CC(=O)Nc2nc3c(s2)C[C@@H](NC(=O)CCC(=O)NN(C)C)CC3)cc1	1813988770	BWJFFPSKSVLITH-INIZCTEOSA-N	443.573	1.979	50	20	IDGD	
C[C@H](CBr)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](C)n2cnnn2)[nH]n1	1814783431	OLQUREQKKNEZHY-MDZLAQPJSA-N	439.318	1.681	50	20	IDGD	
O=C(CCC(F)(F)F)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1817094396	FTFPIHIAAMOQRJ-OAHLLOKOSA-N	438.215	1.738	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)CS(=O)(=O)N3CCCC3)sc2C1	1817276312	QKGPTQGOKQCJDA-VXGBXAGGSA-N	448.998	1.498	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1	1817471991	AMFBPPIJVRKYHO-QGZVFWFLSA-N	444.373	1.247	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2coc(Cl)n2)[nH]n1)c1cccc(B(O)O)c1	1817473088	DTLXZOXPHDRYHX-HNNXBMFYSA-N	443.656	1.351	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1ccc(O)cc1	1820578976	SEHSUDJOMRROPG-LJQANCHMSA-N	434.261	1.415	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1)c1cc2cccnc2nc1O	1821423439	IVHNWWGMFKVPLU-GJZGRUSLSA-N	444.879	1.964	50	20	IDGD	
CC[C@@H](Br)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H]2CCC(=O)N2)[nH]n1	1822088622	WVQILIYRYDNZCB-NQBHXWOUSA-N	426.315	1.854	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)ccc2F)[nH]n1	1822415705	QVZOYWCBBUQLFB-QGZVFWFLSA-N	446.483	1.933	50	20	IDGD	
Cc1ccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)c(O)c1	1823148532	UVJKTRJWVRZVIL-IBGZPJMESA-N	448.288	1.723	50	20	IDGD	
CC[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)C1=NNC(=O)C1)CC2	1825445842	JOFAJRDXMXLIIE-HTQZYQBOSA-N	428.312	1.105	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)/C=C\C(=O)NC1CC1)CC2	1825642505	QOYOWIUBLOHVFO-HPJPHGGJSA-N	441.351	1.673	50	20	IDGD	
O=C([C@@H]1[C@@H]2C=CS[C@@H]12)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827053467	QKUWRZRCLBRKNZ-UWHLTILDSA-N	440.374	1.475	50	20	IDGD	
O=C(C1CCSCC1)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827060013	LYKLWGORKKRLLN-NRFANRHFSA-N	444.406	1.743	50	20	IDGD	
CC[C@@H](NC(N)=O)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CCBr)CC1	1827560636	WLHBZNYEGWVUEI-CABCVRRESA-N	431.375	1.838	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(F)n2)CC1	1829229459	IKWOOAWHSLWFHG-SFHVURJKSA-N	433.528	1.827	50	20	IDGD	
C[C@H](O)C(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)[C@@H](F)Cl)C2)C1	1829325278	GJJYIDXZMJJEKF-YYFZDKIDSA-N	441.887	1.354	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)c2ccc(O)cc2)CC1	1830041810	RWOOUIQERLKLID-JOCHJYFZSA-N	436.317	1.619	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccccc3F)C2)C1	1830542754	DBJVRJVOIMWVEA-AUUYWEPGSA-N	443.313	1.927	50	20	IDGD	
O=C([C@H](O)CCl)N1CCC([C@H]2CCCCN2C(=O)c2c(O)cc(O)cc2O)CC1	1830642453	DGCJQSMYDWFCFE-RHSMWYFYSA-N	426.897	1.636	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C)n4ccnc4n3)C2)C1	1831654243	RRFWVVFQRPYSKD-KKSFZXQISA-N	449.939	1.515	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)OC(=O)OCC)C2)C1	1831658604	XZLLVKHOXYKSQP-VCBZYWHSSA-N	434.917	1.412	50	20	IDGD	
O=C(c1cnc(-c2ccccn2)nc1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1833292178	WURYRDPGRQGMPG-JXFKEZNVSA-N	449.870	1.143	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(NC(C)=O)n3)CCO2)C1	1833338502	OBAZKCMIQPLTPI-FOIQADDNSA-N	438.912	1.127	50	20	IDGD	
C[C@@H](CS(C)(=O)=O)C(=O)NC1CCN(C2CCN(C(=O)C(Cl)Cl)CC2)CC1	1833484101	CLIUNDHNMUFMRI-LBPRGKRZSA-N	442.409	1.042	50	20	IDGD	
O=C(CCc1cnc[nH]1)NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1	1833788709	YMCWBOCOTUANGZ-KRWDZBQOSA-N	444.349	1.604	50	20	IDGD	
Cc1nscc1C(=O)N1CCOC[C@@]2(CN(C(=O)CCBr)CCO2)C1	1834819382	PGBRFLKMSYSDIB-MRXNPFEDSA-N	432.340	1.307	50	20	IDGD	
Cc1cc(CC(=O)N2CCC(N3CCC(NC(=O)CO[Si](C)(C)C)CC3)CC2)on1	1835834883	DOKXDKKTHWNVQG-UHFFFAOYSA-N	436.629	1.949	50	20	IDGD	
CC[C@@H](C(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)N(CC)CC	1836713540	GGBKQERWXSKHJX-OALUTQOASA-N	432.005	1.705	50	20	IDGD	
COc1ccc(C(=O)N2CCC(OC3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)c(O)c1	1836718229	LUFPMYYDVPEICW-IBGZPJMESA-N	440.924	1.613	50	20	IDGD	
CCOC(=O)C(C)(C)C(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836720122	JLYHZEVXVYSCSU-MRXNPFEDSA-N	432.945	1.174	50	20	IDGD	
O=C(c1cc(-c2ccccc2)no1)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1	1837994522	QFOPLIPUXGENAC-UWJYYQICSA-N	449.891	1.011	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@H](C)n3cncn3)CC2)CC1	1838787227	VSCOBJVVBAZRPD-YOEHRIQHSA-N	427.933	1.092	50	20	IDGD	
CCCc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](Cl)COC)C3)C2)cc1	1839016770	ZHZFTQAKRPRFMF-KNQAVFIVSA-N	438.952	1.963	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)c(O)n1	1839153407	HMVFMRNXQSIMHJ-RTBURBONSA-N	446.331	1.402	50	20	IDGD	
Cc1nc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)ccc1F	1839197635	CMZCHYQJMQBSIS-YOEHRIQHSA-N	448.264	1.290	50	20	IDGD	
CC1=CC[C@H](C(=O)N2CCOC[C@]3(CN(C(=O)[C@H](F)Br)CCO3)C2)CC1	1839201085	RACQMECEXGGAHR-RLFYNMQTSA-N	433.318	1.880	50	20	IDGD	
CC[C@H](O)C(=O)N1CCOC[C@]2(CN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)CCO2)C1	1839741802	BNYBLHWVBYOCMK-VVMXEWNRSA-N	449.454	1.099	50	20	IDGD	
CCc1ncsc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)Br)CCO2	1840034876	ZTJGDWHNHHOAKZ-YVEFUNNKSA-N	446.367	1.559	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3c(C)cccc3F)C2)C1	1840155520	ACOSRAHNPCXHEI-QRWLVFNGSA-N	428.888	1.458	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CC[C@@H]3CCOC3)CCO2)C1	1840590554	SKVRSCPSGBAKAX-DAYGRLMNSA-N	433.343	1.043	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@](C)(O)C[C@H]1C(=O)N1CC2(CCCN2C(=O)[C@@H](F)Cl)C1	1843366894	WPLNMZNPXUWHFL-VEVIJQCQSA-N	433.908	1.485	50	20	IDGD	
CC(=O)N(C)[C@@H](C)C(=O)N1CCCC12CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)C2	1843429147	JPHAFMJQCJUJPW-VEJKBTLKSA-N	430.455	1.942	50	20	IDGD	
CCCc1onc(C)c1C(=O)N1CC2(CCCN2C(=O)c2cnccc2C(=O)NN)C1	1844264074	AXYZMPXQFMZYDK-UHFFFAOYSA-N	426.477	1.065	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)c2cc(-c3cccs3)on2)C1	1844474600	QXQYRPJBHLWHFZ-UHFFFAOYSA-N	431.518	1.593	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)[C@@H]1[C@H]3Sc4ccccc4[C@H]31)C2	1846385111	TWLFVLPNRWDVBM-UFYCRDLUSA-N	428.558	1.451	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](C)CBr	1847498968	VSNMXVKKVKTQBG-MMHMZYEKSA-N	438.326	1.353	50	20	IDGD	
O=C(NCc1ccccc1Cn1cccn1)NNC(=O)c1nn(-c2ccccc2)cc1O	10369907	RXBLNRVEHRSOFL-UHFFFAOYSA-N	431.456	1.967	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNS(=O)(=O)c2ccc3c(c2)CC(=O)N3C)cc1	12969447	VLDRWNCFFIOJJY-CYBMUJFWSA-N	433.486	1.381	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)CCCNS(=O)(=O)c2ccc(F)cc2)c1	15925817	CRCUZSQNVLCIIT-UHFFFAOYSA-N	439.465	1.363	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(NC(=O)C3CC3)cc2)cc1OC	25099355	MTLISCHYZYEMBT-UHFFFAOYSA-N	441.440	1.670	50	20	IDGD	
C[C@H]1CN(CCNC(=O)NNC(=O)COc2ccc(OCc3ccccc3)cc2)CCO1	726256057	NDIAKUYKADYFSW-SFHVURJKSA-N	442.516	1.696	50	20	IDGD	
COCC[C@@H](C)NC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	726260254	ABXHWNALGSUSRE-OAHLLOKOSA-N	434.518	1.534	50	20	IDGD	
COc1ccc(CCNC(=O)NNC(=O)CNC(=O)c2cccs2)cc1OC(F)F	726270683	XNSGMIZZUBOGFU-UHFFFAOYSA-N	442.444	1.661	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc([C@@H](C)NCC(=O)NNC(=O)c2cccs2)cc1	727239108	DEDOKDSSSOWFAU-CQSZACIVSA-N	438.575	1.890	50	20	IDGD	
C=CCOc1c(Br)cc(C=NNC(=O)[C@@H](C)NS(C)(=O)=O)cc1OC	728434984	SCHKENPSYXCEBM-SNVBAGLBSA-N	434.312	1.410	50	20	IDGD	
CCN1C(=O)c2ccc(C(=O)NNC(=O)c3cccc(OC(F)F)c3)cc2S1(=O)=O	728486320	VKZLYLLQEXJICE-UHFFFAOYSA-N	439.396	1.527	50	20	IDGD	
CC(=O)NCC(=O)N1CCC[C@@H]1C(=O)NNC(=O)c1cc2c(s1)CC[C@@H](C(C)(C)C)C2	728512753	JAYBCADHAOUDRL-HZPDHXFCSA-N	448.589	1.787	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)[C@@H]2CCCN2c2ncnc3sccc23)c1	728600912	ZFTXIEHPELUKEI-INIZCTEOSA-N	426.502	1.928	50	20	IDGD	
CC(=O)N1CCc2ccccc2[C@@H]1CC(=O)NNC(=O)C1CCN(c2ncccn2)CC1	728847777	OUSKAVLIKUDDDG-FQEVSTJZSA-N	436.516	1.376	50	20	IDGD	
C[C@@H](C(=O)N(C)CC(=O)NNC(=O)c1ccc(Br)cc1Cl)n1cccn1	728869796	CTUAAMNELMLZLH-JTQLQIEISA-N	442.701	1.780	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)c1ccc(C)cc1)C(=O)NNC(=O)c1cccc(C#N)c1	728873561	ZPDBMHDXKADDSK-SFHVURJKSA-N	446.554	1.728	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)[C@@H]1CCN(c2ccc3c(c2)OCCO3)C1=O	730514873	NSHVXLKZJTVKMY-GUYCJALGSA-N	443.431	1.565	50	20	IDGD	
O=C(CC[C@H]1NC(=O)N(c2ccc(Cl)cc2)C1=O)NNC(=O)c1cccc([N+](=O)[O-])c1	730736906	YVXFAOCQAIWIBJ-OAHLLOKOSA-N	445.819	1.914	50	20	IDGD	
O=C(NCCCN1C(=O)CNC1=O)NNC(=O)c1cc(-c2ccccc2)nc2ccccc12	731117903	LYPMFBAOCYOQDD-UHFFFAOYSA-N	446.467	1.788	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)OCCN(C)S(=O)(=O)N(C)C)c(C)n1C[C@@H]1CCCO1	731143965	HQYYHSZGNDKOKW-OVCORXIESA-N	438.550	1.472	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2ccc(Cl)cc2O)nnn1-c1ccc2c(c1)OCCO2	731457512	TWDYDVJXKSCTME-UHFFFAOYSA-N	429.820	1.781	50	20	IDGD	
O=C(NCCS(=O)(=O)NCC1CCC1)NNC(=O)c1ccc(Br)s1	731680927	ZKITXOHKYFXUDN-UHFFFAOYSA-N	439.357	1.174	50	20	IDGD	
Cc1nn([C@H]2CCS(=O)(=O)C2)c2nc(C3CC3)cc(C(=O)NNC(=O)C3CCC3)c12	732143267	ZBAWOFKTYKCYNW-AWEZNQCLSA-N	431.518	1.538	50	20	IDGD	
CC(C)N(C)S(=O)(=O)c1cccc(C(=O)NNc2nc3ccccc3c(=O)n2C)c1	733260701	OWMXJGRLDPIXMF-UHFFFAOYSA-N	429.502	1.719	50	20	IDGD	
CN(c1ccc(CNC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1)S(C)(=O)=O	733348866	RQGGMMXGQDPUKY-UHFFFAOYSA-N	442.501	1.412	50	20	IDGD	
Cc1ccc(CN2C[C@H](C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)CC2=O)cc1	734241539	IEKGJNYBHSAVQN-MRXNPFEDSA-N	433.509	1.199	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc(Br)cc1)NNc1nccnc1Cl	734261030	KLKNCVHEQUAAEL-UHFFFAOYSA-N	434.703	1.704	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)c2cccc(OC(F)F)c2)cc1C(=O)N(C)C	734415876	DMWRKAQQUVUINO-UHFFFAOYSA-N	443.428	1.622	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc2c(c1)nc(CCC(=O)NNc1ccc(Cl)nn1)n2C	735686891	KIXOJMBRASROAZ-UHFFFAOYSA-N	437.913	1.343	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)CS(=O)(=O)c1cccc(Br)c1	737922749	BJUINGFZZNYHKI-UHFFFAOYSA-N	441.303	1.587	50	20	IDGD	
CC(C)[C@@H](C(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)N1C[C@@H](C)O[C@H](C)C1	741018875	CZBOMKFPTJSWDF-LBTNJELSSA-N	436.465	1.033	50	20	IDGD	
CS(=O)(=O)NCCNC(=S)NNC(=O)Nc1ccc(Br)cc1Cl	741856675	RDMWSNYLZLWIRY-UHFFFAOYSA-N	444.764	1.152	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)c2cnc(O)c(Br)c2)c2ccccc2c1=O	742034753	PBLLNLUEIPXKLV-UHFFFAOYSA-N	446.261	1.915	50	20	IDGD	
O=C(CN1C(=O)[C@@H]2[C@@H](C1=O)[C@H]1C=C[C@H]2C1)NNC(=O)NCc1cccc(C(F)(F)F)c1	742458113	UGRJAZVCMGYXGC-APYUEPQZSA-N	436.390	1.343	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)[C@@H]2CCCN(c3ncnc4sccc34)C2)C[C@@H](C)O1	743291252	OUOJKAZSYHIGKF-BZUAXINKSA-N	446.577	1.554	50	20	IDGD	
COc1ccc(S(N)(=O)=O)cc1C(=O)NNC(=O)Nc1ccc(OC(F)F)cc1	743831996	CLUBPTULWHFIBU-UHFFFAOYSA-N	430.389	1.411	50	20	IDGD	
CCCCn1c(N)c(N(C)CC(=O)NNC(=O)c2cc(C)c(CC)s2)c(O)nc1=O	744384950	CVRCJFSIWYCJHG-UHFFFAOYSA-N	436.538	1.161	50	20	IDGD	
COC(=O)c1ccccc1C=NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	744555191	IJQVWUIFPBMOGA-UHFFFAOYSA-N	431.470	1.258	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)C2CCN(C(=O)Nc3ccccc3)CC2)c1	744569875	CIVQDUPDUCSJDF-UHFFFAOYSA-N	449.467	1.807	50	20	IDGD	
CCCN(C(=O)[C@H](C)OC(=O)/C(C#N)=C/c1cc(C#N)n(C)c1C)[C@@H]1CCS(=O)(=O)C1	744630948	CETAGCFGYOXCKA-MNIKTFFBSA-N	446.529	1.470	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)[C@@H]2CCCN(C(=O)Cc3ccccc3)C2)c1	744700258	HEPRFBCTFODGNO-HXUWFJFHSA-N	437.496	1.781	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])c1	745049426	CDUKHDWXQCJZEE-UHFFFAOYSA-N	446.803	1.893	50	20	IDGD	
Cc1nn(C)c2sc(C(=O)N[C@H](C)C(=O)OCC(=O)NNC(=O)c3ccccc3)cc12	745269735	CZIALURJQCBYDW-GFCCVEGCSA-N	443.485	1.066	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCCN1C(=O)c1ccc(O)nn1)c1cc(-c2ccccc2)on1	746108415	SBTDQBKIUXRTNB-INIZCTEOSA-N	436.428	1.293	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCC(C(=O)NNc3cc(Cl)nc(C)n3)CC2)cc1	748336862	ZWJLDGMHXSPNRA-UHFFFAOYSA-N	439.925	1.991	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCn2ccnc2C1)c1cccc(S(=O)(=O)N2CCCCC2)c1	749176772	UMLFUUMTWOQWOM-INIZCTEOSA-N	431.518	1.081	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)N2CCN(CCn3cncn3)CC2)c(C)n1C[C@H]1CCCO1	749397657	QKYIQIJGSZCEMH-WCCCRJGXSA-N	437.548	1.627	50	20	IDGD	
O=C(Cn1cnc2ccccc21)NNC(=O)[C@H]1CCCN1C(=O)c1ccc2c(c1)OCO2	749562130	VVHSPCHBIFCDSI-QGZVFWFLSA-N	435.440	1.217	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)oc1C	751142817	RWLWOHMTHARTSM-UHFFFAOYSA-N	448.457	1.289	50	20	IDGD	
Cc1cc(S(N)(=O)=O)cc(C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)c1C	752146021	HOKSIVUNVUBKQG-UHFFFAOYSA-N	438.456	1.878	50	20	IDGD	
COC(=O)c1c(Br)ccc(NC(=O)C(=O)NNC(=O)C2CCCC2)c1C	753841461	SHTNQGMKRLYJIC-UHFFFAOYSA-N	426.267	1.820	50	20	IDGD	
N#C/C(=C/c1ccc(O)cc1)C(=O)OCC(=O)NCC1(N2CCOCC2)CCCCC1	754545816	LFKHIPVSWAOJOQ-RGEXLXHISA-N	427.501	1.994	50	20	IDGD	
O=C(CCCOc1ccc(I)cc1)NNC(=O)Cc1cc[nH]n1	755269503	QVGJFQRNDTVFPY-UHFFFAOYSA-N	428.230	1.563	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(C(=O)NNC(=O)COc2ccc(Br)cc2)co1	755408216	UMXBDBGPDLCLRA-UHFFFAOYSA-N	446.279	1.132	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3c(F)cc(C#N)cc3F)cc2)CC1	755778020	VJKDKWSKBNLFIS-UHFFFAOYSA-N	435.456	1.529	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)Nc1ccc(N2C[C@H]3CC[C@H]2C3)cc1	756199270	PKOMCHJRCUTFOU-WFASDCNBSA-N	439.428	1.689	50	20	IDGD	
COCCS(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@H](C)Oc2ccccc2F)cc1	756555675	UNKHMRXOMYQDHK-ZDUSSCGKSA-N	439.465	1.866	50	20	IDGD	
CNS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2cc(Br)ccc2O)cc1	756639662	BOMGUYMAHJORGG-UHFFFAOYSA-N	443.279	1.529	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCCCO[C@@H]1CCOC1	756915837	CKMVOJFCKJAMHW-IUODEOHRSA-N	430.299	1.742	50	20	IDGD	
Cn1c(=O)oc2c(C(=O)NNC(=O)NC3CCN(C(=O)OC(C)(C)C)CC3)cccc21	757005907	YDHYWZYTRANYIU-UHFFFAOYSA-N	433.465	1.475	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1cccc(OCc2cccc(Cl)c2)c1	758046342	HKXGLXINGSQUSX-LBPRGKRZSA-N	425.894	1.618	50	20	IDGD	
O=C(NC[C@H](c1cccc(Cl)c1)N1CCCC1)NNC(=O)C(=O)Nc1ccccn1	758683079	GCMIUMXVQVJVKP-MRXNPFEDSA-N	430.896	1.841	50	20	IDGD	
Cc1csc([C@@H](C)CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)n1	758688703	OXFBJMIHYSTZFO-NSHDSACASA-N	425.536	1.450	50	20	IDGD	
O=C(C[C@@H](NC(=O)c1ccccc1)c1ccccc1)NNC(=O)C(=O)Nc1ccccn1	758828858	WUFPSXZFUFBDCC-GOSISDBHSA-N	431.452	1.729	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)c1cn(CC2(C)COC2)nn1	758997334	ZFEJSSVSCZNEHS-NSHDSACASA-N	438.282	1.306	50	20	IDGD	
CCNS(=O)(=O)c1ccc(CC(=O)NNc2nc3ccccc3c(=O)n2CC)cc1	759416858	XVHYZBPECVGUIT-UHFFFAOYSA-N	429.502	1.400	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)[C@@H]2CCCN(S(=O)(=O)c3ccc(F)cc3)C2)nc1	759730459	HZIZJCIOZKPKOK-CQSZACIVSA-N	436.465	1.551	50	20	IDGD	
Cc1cc(S(C)(=O)=O)cc(C(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)c1C	759789543	YVZYDNWDOWQRQJ-UHFFFAOYSA-N	439.515	1.577	50	20	IDGD	
CC(=O)Nc1cc(C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc(C(F)(F)F)c1	760275792	RNXPALGANYVDLB-UHFFFAOYSA-N	447.373	1.986	50	20	IDGD	
Cn1cc(-n2cc(C(=O)NNC(=O)c3ccc(COc4ccccc4)o3)ccc2=O)cn1	760795146	XFBWCCIBNDVJGP-UHFFFAOYSA-N	433.424	1.818	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)NCCc2ccn(C)n2)cc1	760967050	SFULKXRDWXOOME-LGMDPLHJSA-N	447.499	1.433	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C[C@@H]1CN(C(=O)OC(C)(C)C)CCO1	761626966	PPJZHRGBWHJOKF-CQSZACIVSA-N	439.534	1.961	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H]1[C@@H]1COCCC1=NNC(=O)CNC(=O)c1cccnc1	762433877	JRIVKTIEZRBKNY-SJLPKXTDSA-N	445.520	1.720	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)CNc3ccccc3[N+](=O)[O-])n[nH]2)cc1OC	763149204	PBEJBIPOVFCLHZ-UHFFFAOYSA-N	440.416	1.875	50	20	IDGD	
Cc1nnnn1[C@H](Cc1cccc(F)c1)C(=O)NNC(=O)c1cc(-c2cccs2)[nH]n1	763159361	WYUJBKLQYSCBCS-MRXNPFEDSA-N	440.464	1.817	50	20	IDGD	
C[S@@](=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc3ccccc3cc2O)cc1F	763523558	UHZDOIQBSYLLCV-SSEXGKCCSA-N	429.429	1.822	50	20	IDGD	
CCOC(=O)c1cc(F)c(F)cc1NC(=O)C(=O)NNC(=O)[C@H]1COc2ccccc2O1	763571353	MLXYSRJVIMVRHP-MRXNPFEDSA-N	449.366	1.067	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)Nc1c(F)c(F)c(F)c(F)c1F	763571846	PCHDZHVJWYKAIG-QMMMGPOBSA-N	431.273	1.308	50	20	IDGD	
CCOc1cc2c(cc1NC(=O)C(=O)NNC(=O)[C@H]1COc3ccccc3O1)O[C@@H](C)C2	763574878	LEYYMAQNFGDWGA-HXPMCKFVSA-N	441.440	1.335	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)C(=O)Nc2ccc(-n3cncn3)nc2)c1	763600577	GDMNTMMAZZUNFR-UHFFFAOYSA-N	437.460	1.259	50	20	IDGD	
Cc1cn(-c2ccccc2)nc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccccc2)[nH]n1	763615307	ZYQKWYLOGVETCX-UHFFFAOYSA-N	429.440	1.971	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2cc(C#N)ccc2OC(C)C)c1	763773607	ZLUWVGYRLSNZCM-UHFFFAOYSA-N	426.429	1.762	50	20	IDGD	
Cc1ccc(CN(C)C)cc1NC(=O)C(=O)NNC(=O)COc1ccccc1[N+](=O)[O-]	763802741	GLDTVHFBFJCPGU-UHFFFAOYSA-N	429.433	1.130	50	20	IDGD	
Cc1cc(Br)ncc1NC(=O)C(=O)NNC(=O)COc1ccc(F)cc1	763841215	OZFQNZMFMILKJW-UHFFFAOYSA-N	425.214	1.457	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)C(=O)Nc1cccc2c1CN(c1ccccn1)C2	763841928	VDIFNDHUSJBNKY-UHFFFAOYSA-N	449.442	1.906	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cccc(-n3cccn3)c2)cc1	763860479	HJEZKMRBTPLZDQ-HNNXBMFYSA-N	437.456	1.824	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccccc2-n2ccnn2)cc1	763861278	NJVYKYNNNNKCCM-AWEZNQCLSA-N	438.444	1.219	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cccnc2-n2cccn2)cc1	763877158	HYRZWISSKQZFQW-AWEZNQCLSA-N	436.428	1.023	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C)c(C)c(NC(=O)C(=O)NNC(=O)CC(C)C)c1	763888536	OHBFVONFENCMLD-UHFFFAOYSA-N	426.539	1.466	50	20	IDGD	
CCOc1cc(NC(=O)C(=O)NNC(=O)c2cc(Br)cn2C)ccc1OC	764002498	NFARECYMMLNIHG-UHFFFAOYSA-N	439.266	1.595	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(Br)cn2C)cc1C	764004363	FFTLRVCISQRDKJ-UHFFFAOYSA-N	437.250	1.282	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2ccc3oc(N(C)C)nc3c2)cc1	764124555	KNWDTFIUBZTSSF-UHFFFAOYSA-N	425.445	1.621	50	20	IDGD	
O=C(NNC(=O)c1ccoc1)C(=O)Nc1cc(-c2nnc3n2CCCCC3)ccc1F	764159473	XCTQBSYAYWNFCF-UHFFFAOYSA-N	426.408	1.803	50	20	IDGD	
COc1cc(Br)c(NC(=O)C(=O)NNC(=O)c2ccc(C#N)cc2)cc1OC	764182574	OKKFJTUQRMGVPK-UHFFFAOYSA-N	447.245	1.738	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)C(=O)Nc1ccc(Br)cc1	764204025	RHLMGKUKOBFMQU-UHFFFAOYSA-N	443.298	1.840	50	20	IDGD	
CON(C)S(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)CCC2CCCCC2)cc1	764212361	XYXMJSVAOCZSOG-UHFFFAOYSA-N	440.522	1.315	50	20	IDGD	
CC(C)Oc1ccccc1NC(=O)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	764268170	YNMDGLROPVZQEH-UHFFFAOYSA-N	426.477	1.266	50	20	IDGD	
Cc1nc(SCC(=O)NNC(=O)CNC(=O)c2cccnc2)c2c(C)c(C)sc2n1	764341825	LDBNKUHVXAZQGV-UHFFFAOYSA-N	444.542	1.681	50	20	IDGD	
Cc1nn(Cc2ccccc2Cl)c(C)c1C(=O)NNC(=O)CNC(=O)c1cccnc1	764342032	CCWAQNADDWVOND-UHFFFAOYSA-N	440.891	1.788	50	20	IDGD	
O=C(NNC(=O)C(F)(F)Oc1ccccc1)C(=O)Nc1cncc(Br)c1	764379781	KEXPISFTFHBBFJ-UHFFFAOYSA-N	429.177	1.602	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)c1cncc(I)c1	765317607	QOHIAWRISOJENI-UHFFFAOYSA-N	448.261	1.752	50	20	IDGD	
CCC1(CC)[C@@H](NC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)C[C@@H]1OC	765635265	QJMYUDMSJIVIBG-KBPBESRZSA-N	425.555	1.826	50	20	IDGD	
Cc1nc(C(C)(C)C)sc1C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765734660	BVCIQWXEVZNDFZ-UHFFFAOYSA-N	443.573	1.968	50	20	IDGD	
Cn1nc2c(c1C(=O)NNC(=O)CN1CCN(Cc3ccccc3Cl)CC1)CCCC2	766660505	MWPBKVXHIIKSLU-UHFFFAOYSA-N	444.967	1.531	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NCC(=O)NNc1ccc(C(F)(F)F)cc1[N+](=O)[O-]	766753712	GOKPOLQZYPPNMQ-UHFFFAOYSA-N	435.359	1.698	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)c1ccc(S(=O)(=O)C(F)F)cc1	767236561	PHXMCMPXZOOHCH-UHFFFAOYSA-N	440.424	1.538	50	20	IDGD	
O=S(=O)(CBr)N1CCN(S(=O)(=O)c2ccc(-n3cccc3)cc2)CC1	767851832	VWWZJXKYMLEZMP-UHFFFAOYSA-N	448.364	1.466	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](OCC(=O)NNC(=O)Cc2cn3ccccc3n2)C1	768194228	ZPZLDOCTGRASSQ-INIZCTEOSA-N	431.493	1.440	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](Cc1cn(Cc2ccccc2)cn1)C(=O)NNC(=O)C(C)(C)O	768245634	WRNZLAKRDWZZPF-KRWDZBQOSA-N	445.520	1.286	50	20	IDGD	
O=C(NCCn1cc([N+](=O)[O-])cn1)NNC(=O)c1ccc(Br)cc1Cl	768527494	YCROPOJMDUUMCB-UHFFFAOYSA-N	431.634	1.851	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)CCn1nc(O)c2ccccc2c1=O	768637556	IILCPXBZWOSXNX-UHFFFAOYSA-N	432.458	1.048	50	20	IDGD	
CCCCS(=O)(=O)N1CCC[C@H]1C(=O)NNc1nc(O)c2cnn(C(C)(C)C)c2n1	770965816	NUXBXGZWZZMJLS-ZDUSSCGKSA-N	439.542	1.324	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)[C@H]3CC(=O)N(c4cc(Cl)cc(Cl)c4)C3)nc21	770992048	UZAUNIMXMXTAOQ-QMMMGPOBSA-N	436.259	1.872	50	20	IDGD	
COc1ccc(C)cc1[C@]1(C)NC(=O)N(CC(=O)NNc2ccccc2[N+](=O)[O-])C1=O	771217971	VXDOMTOSPUNFHD-FQEVSTJZSA-N	427.417	1.822	50	20	IDGD	
CCc1c(C(=O)NNC(=O)CCN2C[C@H](C)O[C@H](C)C2)cnn1-c1ccc(OC)cc1	771712888	IGOOUWWAIJYPBD-IYBDPMFKSA-N	429.521	1.704	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)C[C@@H](NC(=O)c1ccc(O)cc1)c1ccccc1	772001121	AVKYCLVYCVOVBZ-KBXCAEBGSA-N	427.457	1.743	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)Nc2ccc(N3CCOCC3)cn2)cc1	772402121	FURMZGUXHFQNLH-OAHLLOKOSA-N	429.477	1.937	50	20	IDGD	
CCN(CC)C(=O)N1CCC(C(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)CC1	772905522	OFIILBXNRQLJQO-UHFFFAOYSA-N	437.928	1.277	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccc2c(c1)CCC(=O)N2CC1CC1	773498918	FLEJPVJCXKJOSK-UHFFFAOYSA-N	438.459	1.844	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2)cc1OCC(=O)NC1CC1	773643593	CRLNCVVZEISQLT-UHFFFAOYSA-N	443.416	1.343	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNc2ncccn2)cc1S(=O)(=O)N1CCCCC1	773724913	XKBOOMDAQAQOJI-UHFFFAOYSA-N	448.505	1.132	50	20	IDGD	
Cc1cc(S(N)(=O)=O)ccc1CNC(=O)NNC(=O)Cc1ccc2ccccc2c1	775211745	JTHAHFZQSXLIRP-UHFFFAOYSA-N	426.498	1.869	50	20	IDGD	
Cc1cc(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)nn1[C@@H](C)C1CC1	777425834	LRGFRAZQLIDKAI-INIZCTEOSA-N	446.577	1.856	50	20	IDGD	
O=C(CN1C(=O)[C@@H]2[C@@H](C1=O)[C@H]1C=C[C@H]2C1)NNc1ccc([N+](=O)[O-])cc1Br	779140236	FWRWRWVBDNHPOZ-DMAMZFHHSA-N	435.234	1.608	50	20	IDGD	
O=C(NNC(=O)[C@H](O)[C@@H](O)c1nc2ccccc2s1)c1cc(-c2cccs2)[nH]n1	779539424	DBNIMIVELRKKFJ-HUUCEWRRSA-N	429.483	1.603	50	20	IDGD	
CCOCCCn1c(NNC(=O)c2c[nH]nc2-c2cnn(C)c2)nc2ccccc2c1=O	780694906	MKAUAYCGEMNICJ-UHFFFAOYSA-N	436.476	1.704	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)c1cccc(NS(=O)(=O)C(F)(F)F)c1	782537354	HNWHOLDBTHVFGJ-CQSZACIVSA-N	445.375	1.549	50	20	IDGD	
O=C(NNC(=O)C(=O)NC1CC1)C(=O)Nc1ccccc1S[C@@H](Cl)C(F)(F)F	782966593	OOBPNWWLHVRHBV-CQSZACIVSA-N	438.815	1.270	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)COCCNC(=O)c2ccccc2)n[nH]1	784685441	XMRLODVKAXGIPR-UHFFFAOYSA-N	437.456	1.293	50	20	IDGD	
Cc1cc(C(=O)N2CCSCC2)ccc1NC(=O)C(=O)NNc1ccc(Cl)nn1	784789524	HCYMROPDWFBHQC-UHFFFAOYSA-N	434.909	1.709	50	20	IDGD	
O=C(NNc1ccc(Br)nc1)C(=O)Nc1cccc(-c2nnnn2C2CC2)c1	784809573	SQOLMNUYNYASJS-UHFFFAOYSA-N	443.265	1.914	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2cc(F)c(F)cc2F)cc1S(=O)(=O)NC1CC1	784891880	JIVATFMWKWZHAV-UHFFFAOYSA-N	442.419	1.935	50	20	IDGD	
Cn1ccnc(NNC(=O)C(=O)Nc2cccc(COc3ccc(CC#N)cc3)c2)c1=O	785090644	VXUIMMNRFNDOMM-UHFFFAOYSA-N	432.440	1.507	50	20	IDGD	
NC(=O)c1cc(NC(=O)C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)ccc1F	785100151	SAPZVLZPLHELRY-UHFFFAOYSA-N	435.362	1.177	50	20	IDGD	
O=C(CCC(=O)Nc1ccc2nc(O)[nH]c2n1)NNC(=O)c1cnn(-c2ccccc2)c1	787884352	HFVKVERMKBRTNU-UHFFFAOYSA-N	434.416	1.029	50	20	IDGD	
Cc1nc2c(C(N)=O)cnn2c(C)c1CCC(=O)Nc1cccc(NC(=O)NN(C)C)c1	788253895	LIVSGNMEHLCBQA-UHFFFAOYSA-N	438.492	1.614	50	20	IDGD	
COc1cc(C(=O)NCC(=O)NNc2nnc(-c3ccccn3)s2)cc(OC)c1OC	788566484	HKGWCBMKOLZTKL-UHFFFAOYSA-N	444.473	1.499	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)Cn2c(CS(C)(=O)=O)nc3ccccc32)cc1	788750297	DLAONXHTSOJXAY-UHFFFAOYSA-N	446.554	1.829	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)N[C@@H]2CCCN(c3ccc(Cl)cc3Cl)C2=O)cn1	788916348	JHLGYPVHCRLETE-CYBMUJFWSA-N	425.276	1.867	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2ccc(Br)nc2OC)n1	789594113	KFFBXNBKMXXTDX-UHFFFAOYSA-N	438.286	1.571	50	20	IDGD	
COCCNC(=O)CN1CCN(C(=O)/C(C#N)=C\c2cc(C)n([C@@H](C)COC)c2C)CC1	790445222	PBKVLOPOXNNTIQ-PKIWBCANSA-N	445.564	1.126	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)Cc2ccccn2)cc(N2CCN(C(C)C)CC2)c1	792269388	RMAGLZLDTYDMCT-UHFFFAOYSA-N	438.532	1.249	50	20	IDGD	
C[C@](O)(Cn1cc(C(F)(F)F)ccc1=O)C(=O)NNC(=O)c1cc2ccccc2cc1O	792630278	USGUTRAIILJZON-FQEVSTJZSA-N	449.385	1.938	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCC1(S(C)(=O)=O)CCC1	792782074	YULDMTSBXZPQEE-NSHDSACASA-N	448.339	1.514	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NC[C@@H]2CCCN(C(C)=O)C2)cc1Br	792932829	UYZMEMSNFVVRMM-LBPRGKRZSA-N	427.299	1.660	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNS(=O)(=O)c1ccc(C(=O)O)cc1Cl	794599024	SNDADKCCIKBOLS-UHFFFAOYSA-N	441.849	1.274	50	20	IDGD	
Cc1nnc(COCC(=O)NNC(=O)c2ccc(CSc3nncn3C)cc2)s1	794759286	ISPIPPYQHAQHAZ-UHFFFAOYSA-N	433.519	1.245	50	20	IDGD	
Cc1ccc([C@@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)cc1	797711356	JQLLDYZCDDFOMK-HUUCEWRRSA-N	440.522	1.078	50	20	IDGD	
O=C(COC(=O)CN1C(=O)NC2(CCCC2)C1=O)NN=C(c1ccccc1)c1ccccc1	800060634	VPPQBCOQNLOPSH-UHFFFAOYSA-N	448.479	1.963	50	20	IDGD	
O=C(NC[C@@H](O)c1cccc(Br)c1)NNC(=O)c1ccc(-n2cnnn2)cc1	801737219	APJNALYXSXMXRC-OAHLLOKOSA-N	446.265	1.102	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)[C@@H]2CC(=O)N(c3ccc(OC)cc3OC)C2)cc1	802057329	PQHBUTCRVPTDES-CYBMUJFWSA-N	428.445	1.918	50	20	IDGD	
Cc1cc(F)cc2c(=O)c(C(=O)NNC(=O)Nc3ccc(S(C)(=O)=O)cc3)c[nH]c12	804656773	RIHDWZQKJVYZQN-UHFFFAOYSA-N	432.433	1.846	50	20	IDGD	
C=CCOc1ccc(CNC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)cc1	804867786	KIKZBTGLYMOFGO-UHFFFAOYSA-N	431.518	1.997	50	20	IDGD	
CCS(=O)(=O)NCCNC(=O)NNc1ccc(-c2cccc(C(F)(F)F)c2)nn1	805076478	WISCVAYSXJSQGB-UHFFFAOYSA-N	432.428	1.728	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)Nc1cccc(C(=O)NC)c1Br	806735754	MLNQVLXEARAJDH-UHFFFAOYSA-N	431.287	1.751	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)(F)F)cc1)[C@@H]1CCCN1C(=O)C(F)(F)F	807120205	CVPMQWHDTSHPBV-JTQLQIEISA-N	433.330	1.977	50	20	IDGD	
CCc1ccccc1OCC(=O)NNS(=O)(=O)c1nc(C)n(C)c1Br	808069079	NOJYIKMLDFBFDH-UHFFFAOYSA-N	431.312	1.442	50	20	IDGD	
CCOC(=O)c1ccc(NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1C	812723386	LQOUPXKHMCKOPM-UHFFFAOYSA-N	447.513	1.950	50	20	IDGD	
CC(=NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1)c1ccc(C)nc1C	814877620	STSFMFRFIJCUSK-UHFFFAOYSA-N	443.573	1.854	50	20	IDGD	
Cc1ccc(-c2cncc(F)c2)cc1NC(=O)C(=O)NNC(=O)[C@@H]1CCc2nncn2C1	815691513	SFHRJNHDZGSKRZ-CQSZACIVSA-N	437.435	1.136	50	20	IDGD	
O=C(Nc1ccc(O)c(C(=O)NNC(=O)[C@H]2CCc3nncn3C2)c1)OCC(F)(F)F	816873404	GKIVFBRJTBIFIK-VIFPVBQESA-N	442.354	1.118	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)Cn2c3ccccc3c(=O)c3ccccc32)C[C@@H](C)O1	844263645	BVZIFNRNYBZLEK-IAGOWNOFSA-N	436.512	1.801	50	20	IDGD	
O=C(CNS(=O)(=O)c1cc(C(F)(F)F)ccc1Cl)NNC(=O)c1cccnc1	913109570	ZSNJTRDIXLUMHT-UHFFFAOYSA-N	436.799	1.493	50	20	IDGD	
COCCN1C[C@@H](C(=O)NNC(=O)COc2ccc(-c3ccc(C#N)cc3)cc2)CC1=O	914459168	IQOCSHXSFQWSMM-IBGZPJMESA-N	436.468	1.246	50	20	IDGD	
CCOc1ccccc1C(=O)N1CCC[C@@H]1C(=O)NNC(=O)Cc1nc2ccccc2n1C	914781537	KEQIVDIHZDAVKN-LJQANCHMSA-N	449.511	1.967	50	20	IDGD	
C[C@H]1CCCN([C@@H](C)CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)C1	916450281	ISDDCAHQNRXAHI-GJZGRUSLSA-N	425.555	1.001	50	20	IDGD	
O=C(NCCN1CCN(c2ccc(F)cc2)CC1)NNC(=O)c1cccc([N+](=O)[O-])c1	916513552	CDTBCAQEDDKGNC-UHFFFAOYSA-N	430.440	1.500	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CCNS(=O)(=O)c2ccc(C(C)C)cc2)cc1	916830673	OOGVARGMZJRVCB-UHFFFAOYSA-N	446.529	1.573	50	20	IDGD	
C[C@H](CN1CCCC1=O)NC(=O)NNC(=O)COc1ccc(OCc2ccccc2)cc1	918100094	NILAWAZYDJEVSP-QGZVFWFLSA-N	440.500	1.986	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2ccc(F)cc2Br)ccc1OCC(N)=O	918340268	HRXUBXLQAMFCIB-UHFFFAOYSA-N	440.225	1.536	50	20	IDGD	
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1ccco1)NNC(=O)c1cccc(Cl)c1	919639929	UFQJFMICSAXNIY-HNNXBMFYSA-N	433.848	1.932	50	20	IDGD	
O=C(CN1CCC(NC(=O)NC2CCCCC2)CC1)NNC(=O)c1ccc([N+](=O)[O-])cc1	919802905	HWGNRAFWMFKSPR-UHFFFAOYSA-N	446.508	1.452	50	20	IDGD	
Cc1sc(=O)n(CC(=O)NNC(=O)c2ccc(CSc3nncn3C)cc2)c1C	919811200	NNVPAIRPGLEOJU-UHFFFAOYSA-N	432.531	1.409	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)c2cc(Cl)c(OCC(N)=O)c(OC)c2)cc1	919836203	DDXMORSBIDVMNB-UHFFFAOYSA-N	435.864	1.615	50	20	IDGD	
CC[C@H](NC(=O)NNC(=O)Cc1ccccc1OC)c1ccccc1OCC(=O)NC	919907715	KLTGPPQUNUOSNW-KRWDZBQOSA-N	428.489	1.844	50	20	IDGD	
Cc1c([C@@H](C)NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cnn1C	1317882280	DIWMZBJUFMICLU-CYBMUJFWSA-N	434.522	1.218	50	20	IDGD	
O=C(NC[C@@H]1CC(=O)N(Cc2ccccc2)C1)NNC(=O)c1cncn1-c1ccccc1	1319527219	MSQRPEZCOHJKFA-SFHVURJKSA-N	432.484	1.865	50	20	IDGD	
C[C@@H]1CN(C(=O)Cn2cc(NC(=O)NNC(=O)c3ccccc3Cl)cn2)C[C@@H](C)O1	1320132703	LAIZJPKNWBVAEU-CHWSQXEVSA-N	434.884	1.639	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(CCN(C(=O)c3cnnc4ccccc34)C2)C1	1777724687	AYCNVRDPEQEZQJ-OAQYLSRUSA-N	428.565	1.925	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4cnccc4c3)C2)C1	1777862795	KPYMMTSFDDMVSZ-QHCPKHFHSA-N	439.516	1.051	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H]1ON=C(c3ccccc3)O1)C2)[C@H](F)Cl	1778029539	CCLOAIXPHCWLMC-HRYATBACSA-N	439.871	1.769	50	20	IDGD	
CC(C)(C)c1cc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)[nH]n1	1779575745	UPOPOQWIJVLHLE-CXAGYDPISA-N	431.306	1.841	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3nn[nH]c3C(F)(F)F)C2)C1	1780365873	SQISZOVVWKHYPV-SDBXPKJASA-N	440.220	1.050	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3nn(C)c(C)c3Br)C2)C1	1780368306	IOARMIISXGUNPQ-SJKOYZFVSA-N	447.761	1.952	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(CO)on1)C2	1780715116	MWSSQKKBWRSMDP-ZTFGCOKTSA-N	434.320	1.531	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)ccc1O)C2)[C@H](F)Br	1780777186	SQDPRKIDVPHAGE-RVKKMQEKSA-N	445.285	1.916	50	20	IDGD	
O=C(c1ccc2c(c1)OCO2)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781330469	XRWJJFZXQQHXRN-RHSMWYFYSA-N	429.242	1.549	50	20	IDGD	
CC(C)(C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1)c1ccccn1	1781333888	HDEZPAVMXCWZCS-KDOFPFPSSA-N	428.302	1.880	50	20	IDGD	
O=C(c1ccc([N+](=O)[O-])cc1F)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1781554070	OXSMPDIEGXFTIN-XJKSGUPXSA-N	448.220	1.868	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccn3cncc3c1)C2	1782175667	OSRJNPXUJHJLRQ-WAOWUJCRSA-N	434.924	1.716	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc4cccnn4c3)C2)C1	1782381170	UAXAPOCMGQMXEG-AUUYWEPGSA-N	435.322	1.809	50	20	IDGD	
C[C@]1(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cccc(B(O)O)c2)C3)CC=CCC1	1782722117	WQBJRHDSBXIPFO-FGCOXFRFSA-N	440.349	1.240	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cnc(OC)c(F)c3)CCO2)C1	1783344943	UUYXNMJEUNNUBC-ACJLOTCBSA-N	444.301	1.846	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(=O)ccn3C)CCO2)C1	1783352084	MYNXBBROCMFIGY-KDOFPFPSSA-N	426.311	1.002	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cnc4ccccc4n3)CCO2)C1	1783534412	JGKJJFNUWYVOER-DJJJIMSYSA-N	433.306	1.857	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)COc3ccccc3F)CCO2)C1	1783538205	AIYKRBYINMEPFA-SCLBCKFNSA-N	429.286	1.818	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)n3ccnc3)C[C@@H]21	1783964460	UEFRPWSUIGNYBJ-YXMSTPNBSA-N	427.343	1.455	50	20	IDGD	
CC(C)(C)OC(=O)N1C(=O)CC[C@@H]1C(=O)N1CC[C@@]2(CN(C(=O)[C@H](F)Cl)CCO2)C1	1784193001	ULZIEGNCRJQTTI-UHYGZKCKSA-N	447.891	1.277	50	20	IDGD	
COC(=O)NCC(=O)N1CC[C@@]2(C1)CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)CCO2	1784263389	RATFRFYRWDFYIL-JTVVXKTLSA-N	448.426	1.058	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccn(C)c3=O)[C@H]2C1	1784733785	LPILLSLIYJIVAU-HNKHHVNMSA-N	440.338	1.152	50	20	IDGD	
COCCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)[C@H]2C1	1785076458	IWLQNPSLDXTCJG-VGWMRTNUSA-N	447.960	1.135	50	20	IDGD	
COCCCC(=O)Nc1ccc(C2(NC(=O)c3cnccc3C(=O)NN)CCC2)cc1	1786046569	ZIAVOKFMGCHVQT-UHFFFAOYSA-N	425.489	1.859	50	20	IDGD	
CC(=O)O[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)Br)C[C@@H]21)C(C)C	1788479114	CLOVVIUVSLKIIJ-AKSVOJBYSA-N	433.343	1.337	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3CC[C@H]4CCC(=O)N4C3)[C@H]2C1	1789770226	LRCZXBSRPMBFHL-QQCJEOGWSA-N	425.957	1.385	50	20	IDGD	
COc1ncccc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]2C1	1789866803	YOTZPBPDIZTJPG-XPVILTJLSA-N	430.332	1.920	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cccc(Cl)n3)C[C@@H]21)[C@@H](F)Br	1789922244	IVXMYYWAYTWPSQ-RKOGSIPDSA-N	448.720	1.948	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C=C/c3cnc[nH]3)[C@H]2C1	1791501981	SDCPOCMJQUSKEQ-WMUZAFSRSA-N	425.327	1.434	50	20	IDGD	
COc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](O)CCl)C[C@@H]32)cc(OC)c1C	1792045205	FHLCIJHCQNIGMT-AMVTXUCVSA-N	440.924	1.205	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H]1C[C@H](C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Cl)C[C@@H]32)C1	1792223894	NULZMJORSYYJGU-OJFNHCPVSA-N	447.935	1.804	50	20	IDGD	
Cn1c(=O)n(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C(C)(C)CCl)c2ccccc21	1792782800	FNWJDYZCIAFYCK-CCWDJLKJSA-N	448.951	1.195	50	20	IDGD	
CC(C)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnn(-c3cccnc3)c1)C2	1792784924	WOFDEWBGUIQPND-ALXJQNPVSA-N	431.924	1.736	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccn3cncc13)C2	1792870306	BPKFANOJJHENQK-ZJOBFFGXSA-N	435.322	1.569	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CCc2ccoc2C1	1793124003	NTSDFNOXNUQOGL-MOVJQLJTSA-N	425.323	1.758	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(=C/c1ccco1)NC(C)=O)C2	1793451582	CYEKPZBMYPUWIW-KPNYYRNQSA-N	437.924	1.754	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnco1	1793564795	OHTHQPIGSZDGHD-IVWMJMPLSA-N	444.400	1.025	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1c(F)ccc(F)c1F)c1ccc(B(O)O)cc1	1793881766	QCTOYSSNGQFEAQ-MUJYYYPQSA-N	446.234	1.278	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1ccc2c(c1)CCC2	1794102824	AHSAGLQXGZSUGQ-WKCHPHFGSA-N	426.561	1.729	50	20	IDGD	
O=C(CN1C(=O)CSC1=S)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCBr	1795495628	IELKBHOMYIGEHR-JGPRNRPPSA-N	434.381	1.270	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@]1(F)CCCCC1(F)F)C2	1796189051	QIGKNXZHBSWREI-CLWJZODNSA-N	438.255	1.536	50	20	IDGD	
O=C(C[C@H]1OCCc2ccccc21)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1	1796190058	TXEDEJZRVDHOOA-ADYITMSISA-N	448.328	1.322	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(CCN2CCCC2)nc1)[C@@H](O)CCl	1796961445	MSJFRCLTODMOAL-YRPNKDGESA-N	434.968	1.571	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnc2snnc2c1	1798507731	RHQAACCRESQHFM-MGAJZRQESA-N	440.323	1.073	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2)c1ccc([N+](=O)[O-])c2c1OCO2	1798627269	HEBRWRBNGKIDRP-BZBKMWRSSA-N	446.243	1.330	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccn3nccc13)C2)[C@H](F)Br	1799346570	CXIKRUGFOYXQPA-JLUCKKNBSA-N	425.258	1.228	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2)c1ccc(-c2ccc(O)nn2)cc1	1799840229	NOSORKHCZTVFTJ-DACLVMHWSA-N	434.855	1.587	50	20	IDGD	
CC[C@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](NC(=O)c1ccccc1)[C@@H](C)O)C2	1800067936	UBTZLLFUYUARJS-MATIZBOZSA-N	435.952	1.821	50	20	IDGD	
COc1cc(C)c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CCC(=O)NN(C)C)C3)cc1OC	1800625522	AIKNNZXYLHTJDG-BJWYYQGGSA-N	446.548	1.637	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@](C)(O)C(F)(F)F)C2	1800640126	KSBTUPITQPAOFT-KKSJPVRNSA-N	431.249	1.063	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(N(C)C)cn1)C2	1800757445	GCDGZYSFLQHVQW-NFFDBFGFSA-N	425.327	1.134	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(N3C(=O)C=CC3=O)cc1)C2	1802284398	RCSHSCOAEAIMLK-BZZMCLGOSA-N	445.903	1.622	50	20	IDGD	
CC(C)(CCl)C(=O)NC[C@H]1CCN(C(=O)CN2C(=O)C=CC2=O)[C@H]1c1cccnc1	1802902500	OVVPLAVBJXUTKJ-BEFAXECRSA-N	432.908	1.277	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cc3n(n2)CCCC3)[C@@H]1c1cccnc1)[C@H](O)CCl	1803143181	WFXFMGROVGQVQW-KFKAGJAMSA-N	431.924	1.534	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)CN2CCOC2=O)[C@H]1c1cccnc1	1803338285	BMCOJCXGANOYFY-DUVNUKRYSA-N	439.310	1.323	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)C(C)(C)CNC(C)=O)[C@H]1c1cccnc1	1803720280	MMGPEZPHCBCEBC-FGTMMUONSA-N	438.956	1.504	50	20	IDGD	
CC(=O)N(C)CCC(=O)N1CC[C@H](CNC(=O)CCBr)[C@H]1c1cccnc1	1806343279	TZBINBGCLREYAZ-VQIMIIECSA-N	439.354	1.741	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccccc2O)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807360336	AGLFXEDXDXTSLF-AVRDEDQJSA-N	445.284	1.100	50	20	IDGD	
Cc1ccccc1C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1807360753	LXTGZNXWDMRYAS-NFBKMPQASA-N	443.312	1.703	50	20	IDGD	
Cc1cccnc1C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1807366965	WJBMRLJFXPNMAG-SIKLNZKXSA-N	444.300	1.098	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)c(C)o1	1807369420	JFMWAIUZGUETGZ-SIKLNZKXSA-N	447.300	1.605	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)c1ccn(C(F)F)n1	1810904743	FXFLSYPWKLHQMQ-NWANDNLSSA-N	427.839	1.593	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@@H]1c1cccnc1)c1c[nH]c(=O)cn1	1811457796	ZQZCVQYUOLSPPA-NILFDRSVSA-N	438.257	1.175	50	20	IDGD	
Cc1ccccc1C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1811775549	CZPAHTXGTUAMBA-NZQKXSOJSA-N	443.312	1.703	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)CC(N)=O)[C@H]1c1cccnc1	1812865417	OTPFNFLYQVENKV-DUPGQFARSA-N	425.327	1.382	50	20	IDGD	
CCCNC(=O)CCC(=O)N1CC[C@H](CNC(=O)[C@@H](Cl)COC)[C@H]1c1cccnc1	1813028699	UGSNOOPZGPGJTD-FUHIMQAGSA-N	438.956	1.648	50	20	IDGD	
CC(=O)C[C@H](C)C(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1813075243	YPYXXWBLMZFDOD-UQASEVPWSA-N	431.537	1.076	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)[C@H]1CCc2nc[nH]c2C1	1813322587	JJUUUSOIBAVHON-JECZMYCTSA-N	431.924	1.215	50	20	IDGD	
C[C@@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1)C1(O)CCC1	1814428979	RGQNOTRBOOFUJS-HOCLYGCPSA-N	434.541	1.326	50	20	IDGD	
N#Cc1ccccc1OCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](O)CCl)n[nH]1	1814875505	BCCLKJCVFWGFOS-CVEARBPZSA-N	431.880	1.952	50	20	IDGD	
Cc1ncccc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1816392121	VDBXHTLGWMDMKA-IBGZPJMESA-N	433.277	1.413	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)CC(F)(F)C(=O)O)sc2C1	1817095574	JLNQYFKLFJYBIZ-HTQZYQBOSA-N	425.841	1.419	50	20	IDGD	
C[C@H](NC(=O)c1cnccn1)C(=O)N[C@H]1CCc2nc(NC(=O)[C@H](F)Cl)sc2C1	1817125495	PNQUPRJTIBFWIR-RVBZMBCESA-N	440.888	1.198	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)c3nc[nH]c3[N+](=O)[O-])sc2C1	1817205393	LTXVTMDDMDAETL-RQJHMYQMSA-N	443.283	1.784	50	20	IDGD	
COC1(CC(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)CCC1	1817480050	ZUGYDXIAFPBOHK-SFHVURJKSA-N	440.309	1.355	50	20	IDGD	
COCCn1ccc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@H](Cl)COC)CC3)n1	1817618090	KFSSACUFLUSYMX-NWDGAFQWSA-N	441.941	1.466	50	20	IDGD	
CC(C)OCC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819400218	FBIFVLYRLIKRJO-INIZCTEOSA-N	429.481	1.139	50	20	IDGD	
COCCCC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819401864	WHRICQWSRWBXJJ-INIZCTEOSA-N	429.481	1.141	50	20	IDGD	
Cc1ccoc1C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1	1819797114	LNOCXBSCLJAIBR-LLVKDONJSA-N	440.485	1.583	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](F)Br)[nH]n1)c1c[nH]c(=O)cn1	1820247457	FKYOCVNEZFPGLK-GXFFZTMASA-N	427.234	1.489	50	20	IDGD	
O=C1CC[C@H](C(=O)N2CCCC[C@H]2c2cc(NC(=O)[C@H](F)Br)n[nH]2)CN1	1820934698	OZOSRMWCYJEETO-CHIMOYNISA-N	430.278	1.619	50	20	IDGD	
CNC(=S)NCCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](F)Br)n[nH]1	1820934980	DWSUFBASWNUKBK-MFKMUULPSA-N	449.350	1.576	50	20	IDGD	
O=C(Cc1ncccn1)N[C@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1	1823001686	JDEVLVMBRHOZKO-ISVAXAHUSA-N	428.287	1.778	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)Cc3c(C)n[nH]c3C)sc2C1	1823131836	CIISPYVKJVBNGZ-WCQYABFASA-N	425.942	1.892	50	20	IDGD	
C[C@H](C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCBr)CC2)n1ccnn1	1824683189	MZZDOYHDMOWVKT-NXEZZACHSA-N	427.328	1.693	50	20	IDGD	
O=C(NCC(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@H](O)CCl)CC1)c1cccnc1	1825087858	KOFMBHJAFNCSLT-ZWKOTPCHSA-N	436.940	1.031	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H]1CCC(=O)N1)CC2	1825445255	QORJBGJQLPWDAA-YWVKMMECSA-N	429.340	1.507	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H](N)CCC(N)=O)CC1	1826822475	MTCHOSBKVIIJJP-HRCADAONSA-N	445.402	1.372	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)C(O)O)CC1	1829637029	JFQYWUFTUJZRSR-QGZVFWFLSA-N	449.460	1.064	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4ccnn4c3)C2)C1	1830365073	AMKRVNHWDBMDIS-OAQYLSRUSA-N	434.924	1.669	50	20	IDGD	
Cc1ncc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)s1	1830370060	HIYMZPLOKSNBPO-LJQANCHMSA-N	429.970	1.715	50	20	IDGD	
CN(C)C(=O)NCC(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H](F)Br)CC1	1830378169	CJZONRLKBJHQHO-ZFWWWQNUSA-N	435.338	1.568	50	20	IDGD	
COc1c(Cl)cccc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1830738120	MAHBWCBRXMDNOC-BEFAXECRSA-N	447.315	1.018	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)[C@@H]2C[C@H]3CC[C@@H]2O3)CC1	1831681067	UAZOTNJRVCJRPM-YSFYHYPLSA-N	440.349	1.167	50	20	IDGD	
C=C[C@@H](O)C(C)(C)C(=O)N1CCC([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1	1831873114	AJLXEDQWYWJXDI-RTBURBONSA-N	436.597	1.552	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1	1831875199	VJNRWIMOCLPPMT-DLBZAZTESA-N	430.977	1.233	50	20	IDGD	
O=C(CN1CCc2sccc2C1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1832584437	BPXSETOTQKVFNB-PKOBYXMFSA-N	445.944	1.097	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cccc4[nH]ncc34)CC2)CC1)[C@H](O)CCl	1833310856	VYLNORUYHOEZNQ-LJQANCHMSA-N	433.940	1.348	50	20	IDGD	
O=C(c1coc(Cl)n1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1833557111	DKRHJHAAWBVHJX-YGRLFVJLSA-N	440.653	1.089	50	20	IDGD	
Cc1nc(CC(=O)N2CCOC[C@@]3(CN(C(=O)CCBr)CCO3)C2)cs1	1834819109	HDAHOSOSEJARPA-QGZVFWFLSA-N	446.367	1.235	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCBr)CCO3)C2)c(C)o1	1834819115	HOSHZMNAHJSGMC-GOSISDBHSA-N	429.311	1.751	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)C(=O)Nc3cccnc3)CC2)CC1	1836396696	JHQXJUGPSOGTAE-GOSISDBHSA-N	435.956	1.609	50	20	IDGD	
O=C(c1c(O)cc(O)cc1O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836717726	IAPZEOKRGZVXOG-QGZVFWFLSA-N	442.896	1.015	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnn4cccnc34)CCO2)C1	1836843582	QCZSCHRUZYSRBW-HXUWFJFHSA-N	435.912	1.064	50	20	IDGD	
Cn1cccc(C(=O)N2CCC(OC3CCN(C(=O)C(Cl)Cl)CC3)CC2)c1=O	1836969996	AFQIZPNPFLJJHN-UHFFFAOYSA-N	430.332	1.801	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3c(C)nc4sccn34)CCO2)C1	1837145533	XPMHGCSVNYPWDJ-LIRRHRJNSA-N	440.953	1.792	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)[C@H](C)NC(C)=O)CC2)CC1	1838755844	VEOWOWKPTGOWKL-SUMWQHHRSA-N	446.386	1.683	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(-c4ccccn4)[nH]n3)C2)C1	1839145890	HFNQAIVSTFQDBR-BTYIYWSLSA-N	447.923	1.559	50	20	IDGD	
C=CCC(CC=C)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839199346	UQJGDQLVWMYMHD-QAPCUYQASA-N	433.318	1.902	50	20	IDGD	
COc1ccc(F)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)c1OC	1839374934	QDNPTKNGVGIAQW-LPHOPBHVSA-N	448.850	1.447	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccoc3C)C2)C1	1839963589	PIEUQIFWGKTDLF-QAPCUYQASA-N	429.311	1.832	50	20	IDGD	
C=CCC(F)(F)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](Br)CC)CCO2)C1	1839966927	UNQJHSSCRWOVTJ-CZUORRHYSA-N	439.297	1.828	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3cccnc3)C2)C1	1840031727	ANTXEHPKXASMFB-HNAYVOBHSA-N	440.338	1.254	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)/C=C/c3ccccc3)C2)C1	1840032082	NJUNZLUEQXMUHC-BATQEMGPSA-N	437.334	1.940	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)n(C(F)F)n1	1840189088	VPTSLMODKXFQCP-MRXNPFEDSA-N	441.262	1.460	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3cc(C)on3)CCO2)C1	1840369670	KJTDBOHQUZZERJ-QAPCUYQASA-N	444.326	1.155	50	20	IDGD	
CC(C)N1CCC[C@H]1C(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1840580890	NYPVKBSVKYSIAD-UWJYYQICSA-N	429.989	1.581	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)c1	1840729556	SEZMBQODZGZEFP-VQIMIIECSA-N	427.860	1.249	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC12CN(C(=O)[C@H](C)NC(=O)c1ccccn1)C2	1841289401	YSNDDOYZIXTINL-KGLIPLIRSA-N	437.338	1.434	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)c2ccc(OC(F)F)cc2F)C1	1844711965	OSEIXXWPZFLFBG-UHFFFAOYSA-N	448.206	1.238	50	20	IDGD	
CC(=O)N[C@@H](C(=O)N1CC2(CCCN2C(=O)[C@H](F)Br)C1)c1ccc(F)cc1	1845218915	KHGIKLJODGKFNJ-CABCVRRESA-N	444.276	1.897	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@H]1C[C@@H]3C[C@@H]3N1C(=O)OC(C)(C)C)C2	1846360497	PGULBBMVQVAKKQ-VGWMRTNUSA-N	441.956	1.842	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)c1csc(Br)n1)C2	1846384743	CMGCQYHOBBWVHO-UHFFFAOYSA-N	444.355	1.096	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H]1CCc2nc(O)nc(O)c2C1	1848217419	LBGJDBXDTFMMPM-FSTCNJTKSA-N	443.331	1.431	50	20	IDGD	
CCCC(=O)NNC(=O)Cn1c(=O)c2c(ncn2CC(C)C)n(Cc2ccccc2)c1=O	10161516	CODIAQJLXSBEDH-UHFFFAOYSA-N	440.504	1.012	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CCn2c(=O)n(C)c3ccccc32)ccc1OC(C)C	14325429	UCSCDPYCZCDSRP-UHFFFAOYSA-N	426.473	1.987	50	20	IDGD	
O=C(CN1CCCN(S(=O)(=O)c2ccc(F)cc2)CC1)NNC(=O)c1cccs1	15102249	HMCCJDRPKJQFNM-UHFFFAOYSA-N	440.522	1.045	50	20	IDGD	
CC(C)(C)NC(=S)NNC(=O)C1CCN(c2ccc3nnc(C(F)(F)F)n3n2)CC1	28716920	ZVHLHHSMKAJSQL-UHFFFAOYSA-N	444.487	1.653	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCN(CCc2ccccc2)CC1	29157124	POYSGQZIIIPIFF-UHFFFAOYSA-N	430.936	1.970	50	20	IDGD	
CS(=O)(=O)N1CCC[C@@H]1C(=O)NNC(=O)CCCOc1ccc(Cl)cc1Cl	105113738	BKPZBEUNSGPWFQ-CYBMUJFWSA-N	438.333	1.724	50	20	IDGD	
C[C@@H]1CCCC[C@]12NC(=O)N(CC(=O)NNc1ccc(S(=O)(=O)NC3CC3)cc1)C2=O	726867221	BCVPDIFQXYAYPV-XCLFUZPHSA-N	449.533	1.071	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@@H]2CCCN2c2ccc(C#N)cc2)c2ccccc2c1=O	728170445	MVBAMZRKDXCWIY-IBGZPJMESA-N	430.468	1.718	50	20	IDGD	
CCCCn1c(C)cc(/C=C(\C#N)C(=O)N2CCN(CC(=O)NCCOC)CC2)c1C	728197792	CGXPQUUFZRMDNT-RCCKNPSSSA-N	429.565	1.719	50	20	IDGD	
CC(C)CC(=O)NNS(=O)(=O)c1ccc(S(=O)(=O)N2C[C@H](C)C[C@@H](C)C2)cc1	728261213	OVSCSFNJVUQDIW-HUUCEWRRSA-N	431.580	1.709	50	20	IDGD	
CC(C)Cn1nc(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c2ccccc2c1=O	728845403	JWAJYGWVALJIBA-UHFFFAOYSA-N	449.515	1.520	50	20	IDGD	
Cc1nn(-c2ccc(F)cc2)c2sc(C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)cc12	729275324	NHFGXFSSKUCGQL-JTQLQIEISA-N	439.494	1.233	50	20	IDGD	
C=C(C)CN1CCC(NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)CC1	730067288	VXUNJQCIGHDSNX-UHFFFAOYSA-N	428.581	1.570	50	20	IDGD	
CC(C)COc1cn(-c2ccccc2)nc1C(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1	730774474	UEJYPIQIIDKFBE-AWEZNQCLSA-N	435.506	1.038	50	20	IDGD	
CN(CC(=O)NNC(=O)COc1ccccc1O)C(=O)c1ccc(Br)s1	730779725	JRBLFMKKCFRJOJ-UHFFFAOYSA-N	442.291	1.515	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)[C@@H]1CCCN(C(=O)CCOc2ccccc2)C1	730779987	HIFGTFLRJXQOCQ-QGZVFWFLSA-N	441.484	1.626	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCCCN2CCCCC2=O)cc1Br	732246829	UKYRYHBEKUFBIO-UHFFFAOYSA-N	427.299	1.804	50	20	IDGD	
Cc1c(C(=O)NNC(=O)CCN2C[C@H](C)O[C@H](C)C2)nnn1-c1cccc2cccnc12	732260872	IRGALEZWOOTAJK-GASCZTMLSA-N	437.504	1.384	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@@H]2C(=O)NNc2ccccc2S(C)(=O)=O)s1	732303131	FEPQPOBTAKKTTI-CQSZACIVSA-N	443.572	1.756	50	20	IDGD	
CCCCN(C)CCNC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	732891839	HBILEZXNHVCROG-UHFFFAOYSA-N	425.555	1.147	50	20	IDGD	
O=C(CSc1cccs1)Nc1ccc(C(=O)NNC(=O)C(=O)N2CCCC2)cc1	735272141	UIXDDBPWPXPISG-UHFFFAOYSA-N	432.527	1.862	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@@H](NC(=O)NNC(=O)c1nn(-c2ccccc2)cc1O)C1CC1	741282196	UEUFLSGWITVUSH-OAHLLOKOSA-N	444.492	1.825	50	20	IDGD	
CCN1C[C@H](CN(C)CC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)Oc2ccccc21	741617232	UKTPTDOFXMEHNE-KRWDZBQOSA-N	427.461	1.575	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)CCCN(C)C2=NS(=O)(=O)c3ccccc32)cc1	741887185	HNPKNCYFVIJPPI-UHFFFAOYSA-N	428.514	1.871	50	20	IDGD	
CCn1cnc2c1c(=O)n(CC(=O)NN=Cc1occc1C)c(=O)n2Cc1ccccc1	743427781	ZLPGQBMNANRGCY-UHFFFAOYSA-N	434.456	1.480	50	20	IDGD	
COc1ccc2c(c1)OCC[C@@H]2NC(=O)NNC(=O)c1csc(N2CCOCC2)n1	743509328	BKHHVKSYNPYQLA-AWEZNQCLSA-N	433.490	1.456	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@@H]2CC(=O)N(c3ccc(F)cc3)C2)cc1	743830894	MMTUWFVDRGPVDM-GFCCVEGCSA-N	434.449	1.435	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)c2cc([N+](=O)[O-])ccc2N2CCOCC2)c1	744556996	IIMVDUXIOQRSSW-UHFFFAOYSA-N	442.428	1.358	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1cnc(-c2ccccc2)nc1	744621213	VHSIGZUTKYKJLL-UHFFFAOYSA-N	439.497	1.921	50	20	IDGD	
CC(=NNC(=O)c1cn(C)c2ccccc12)c1ccc(S(=O)(=O)N2CCNCC2)cc1	744780973	WUIOFTYIRAAHPF-UHFFFAOYSA-N	439.541	1.926	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12)[C@@H]1CCOC1	745862314	UZSIZDXMAPFXFZ-DOTOQJQBSA-N	435.484	1.814	50	20	IDGD	
Cc1cc(N2CC[C@@H](NC(=O)NNC(=O)Nc3ccc(OC(F)F)cc3)C2=O)n(C)n1	745906907	WXYOQVBMOLZGSV-CYBMUJFWSA-N	437.407	1.471	50	20	IDGD	
Cc1nc(SCC(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)n[nH]1	746110704	GCRUWFVOHGSKAY-UHFFFAOYSA-N	449.500	1.368	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)NCC(=O)NNC(=O)[C@@H](CC)c2ccccc2)cc1	746248596	SXYWJTSJASQTAJ-SFHVURJKSA-N	447.513	1.483	50	20	IDGD	
O=C(CCCN1C(=O)CCC1=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1	747778643	JYVLVTGKIXWBJS-OAQYLSRUSA-N	448.523	1.690	50	20	IDGD	
CCOc1ccc(N2C(=O)/C(=C/NNC(=O)C(=O)N3CCCC3)c3ccccc3C2=O)cc1	748208226	LXLAWSWLDLHJSN-HMMYKYKNSA-N	448.479	1.856	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)CCOc3ccc(F)cc3)cc2)CC1	748610127	CDGNRXOEWANQLQ-UHFFFAOYSA-N	436.509	1.674	50	20	IDGD	
O=C(CC1CCCC1)NNC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1	749942910	MCZXKOHZCHQAGH-HNNXBMFYSA-N	438.506	1.723	50	20	IDGD	
O=C(O)CCC(=O)c1ccc(S(=O)(=O)NNC(=O)c2cccc3cccnc23)cc1	751211763	DKARPRSCINDHAR-UHFFFAOYSA-N	427.438	1.906	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)NCc2cncn2C)cc1	752957062	WBXFJCOTUJNZEI-SXGWCWSVSA-N	433.472	1.391	50	20	IDGD	
CCc1cc(Br)ccc1NNC(=O)[C@@H]1CC(=O)N([C@@H]2CCS(=O)(=O)C2)C1	753175468	KFSDOOIZCVPQEB-TZMCWYRMSA-N	444.351	1.490	50	20	IDGD	
Cc1ccc(C)c(SCc2nc(=O)c3c(C)c(C(=O)NNC(=O)CO)sc3[nH]2)c1	753442604	JIJBYJKLFOOYBP-UHFFFAOYSA-N	432.527	1.955	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN[C@@H](C)[C@H]2CCCN(C(=O)OC(C)(C)C)C2)n1	754319497	QRAOIRGOIIRWRE-GJZGRUSLSA-N	439.582	1.767	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)Nc1cccc(S(=O)(=O)N2CCOCC2)c1	755354064	NAGVZBZJQOQNCH-UHFFFAOYSA-N	434.474	1.183	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)Nc1ccc(S(=O)(=O)N2C[C@@H](C)C[C@@H](C)C2)cc1	755420957	OSDOTXGMPCICCY-BETUJISGSA-N	434.522	1.851	50	20	IDGD	
COC(=O)CNC(=O)Cc1ccc(NC(=O)NNC(=O)c2ccc(Cl)cc2OC)cc1	755863367	GLHYMZSYOKASGD-UHFFFAOYSA-N	448.863	1.647	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c(Cl)cc1F	755955704	RHQIMBWZIMJTPT-UHFFFAOYSA-N	431.785	1.797	50	20	IDGD	
CCOC(=O)N1CCN(S(=O)(=O)NNC(=O)c2c(Cl)cccc2Cl)CC1	755973304	KCWQIQNSBJJKRA-UHFFFAOYSA-N	425.294	1.247	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)NNc2ccccc2S(=O)(=O)NC(C)(C)C)co1	756011756	BBKZQOIUGAIQET-UHFFFAOYSA-N	430.508	1.021	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)Nc1ncc(Cc2ccccc2)s1	756163220	GMPPLMQIBHBGHO-KRWDZBQOSA-N	438.465	1.660	50	20	IDGD	
CC(=O)N1CCCc2cc(NC(=O)NNC(=O)C3CCN(c4ncccn4)CC3)ccc21	756282224	ZCUADKSPBDZADM-UHFFFAOYSA-N	437.504	1.845	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)Nc2cc(S(=O)(=O)NC)ccc2C)o1	756528567	UPHVMTJIGQTYOZ-UHFFFAOYSA-N	437.522	1.804	50	20	IDGD	
COc1ccccc1N1CC[C@H](NC(=O)NNC(=O)c2ccc3c(c2)OCCO3)C1=O	757288213	WALGURJSJOZYFQ-AWEZNQCLSA-N	426.429	1.216	50	20	IDGD	
CN1C(=O)CC[C@H](C(=O)NNc2ccc(C(N)=O)nn2)[C@H]1c1ccc(C(F)(F)F)cc1	757404270	OARYPLAWKHQACM-BLLLJJGKSA-N	436.394	1.647	50	20	IDGD	
Cn1cc(Br)cc(NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c1=O	757600079	QJVZTAFPUONVIT-UHFFFAOYSA-N	443.279	1.018	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)CN2C(=O)N[C@]3(C[C@@H](C)C[C@@H](C)C3)C2=O)cc1	757640326	UQEQNEPFZITDKD-YEZVWNJWSA-N	430.505	1.522	50	20	IDGD	
C=CCCOCCNC(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	757682137	LPBBXVUDAZMJNE-UHFFFAOYSA-N	435.484	1.982	50	20	IDGD	
O=C(CN1C(=O)c2cc(Br)ccc2S1(=O)=O)NNC(=O)c1cccs1	757746169	QKNZWINVFDVCLK-UHFFFAOYSA-N	444.288	1.116	50	20	IDGD	
Cc1oc(-c2ccc(Cl)c(Cl)c2)nc1C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O	758050291	ANJOKDMBQYJNOK-ZETCQYMHSA-N	435.289	1.656	50	20	IDGD	
CCCC(=O)N1CSC[C@@H]1C(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758787838	WNCJRPWFTPYYKK-CQSZACIVSA-N	443.570	1.324	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cn(C)c(=O)c3ccccc23)cc1OC	759085386	NNQUEBZZDIEEEK-UHFFFAOYSA-N	439.424	1.174	50	20	IDGD	
CCc1ccc(-c2noc([C@@H](C)NC(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)n2)cc1	760718575	VUTBJRZLJGEBHC-CYBMUJFWSA-N	447.459	1.980	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1cnn(C)c1)c1nc(-c2ccc(Br)cc2)no1	760881456	KSQRUHHZSRMJFB-VIFPVBQESA-N	434.254	1.938	50	20	IDGD	
CCn1c(=O)n(CC)c2nc(NC(=O)CCC(=O)NNC(=O)c3ccc(C)o3)ccc21	761179992	OMBJVPNMJREIIQ-UHFFFAOYSA-N	428.449	1.319	50	20	IDGD	
O=C(NN=Cc1cnc(C2OCCO2)s1)c1cccc(S(=O)(=O)N2CCCC2)c1	761743558	CMGSMYGYGNBVSP-UHFFFAOYSA-N	436.515	1.737	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)N[C@@H]1CC[C@@H]2SCCS[C@H]21	762526384	DVQMTPUMXANXAR-DYEKYZERSA-N	443.620	1.612	50	20	IDGD	
O=S(=O)(CBr)N1CCN(S(=O)(=O)C2=Cc3ccccc3CC2)CC1	763206729	WNKIOZXXFKZDCM-UHFFFAOYSA-N	435.365	1.603	50	20	IDGD	
COCCOc1ccc(Br)cc1NC(=O)C(=O)NNC(=O)c1ccccn1	763466055	CZKXJFHGWXHTJR-UHFFFAOYSA-N	437.250	1.269	50	20	IDGD	
CN(c1ccc(CNC(=O)NNC(=O)CSc2ccccc2O)cc1)S(C)(=O)=O	763503069	QTCLJODQNKKCPX-UHFFFAOYSA-N	438.531	1.411	50	20	IDGD	
COc1cccc(-c2nsc(NC(=O)C(=O)NNC(=O)c3ccc4c(c3)OCO4)n2)c1	763552006	UYBUCTXIJVEFND-UHFFFAOYSA-N	441.425	1.342	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)[nH]n1)C(=O)Nc1cnn(-c2ccccc2F)c1	763601508	RSWWNBBMPHOHEL-UHFFFAOYSA-N	433.403	1.801	50	20	IDGD	
COCCn1ccc2ccc(NC(=O)C(=O)NNC(=O)COc3ccccc3OC)cc21	763657811	RYFBNJRBGFMHED-UHFFFAOYSA-N	440.456	1.461	50	20	IDGD	
O=C(COc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1cccc(CN2CCOC2=O)c1	763685534	CKDNBGFZBFKQGX-UHFFFAOYSA-N	446.847	1.457	50	20	IDGD	
O=C(COc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1ccnn1CCc1ccccc1	763694451	JHKRPNQCBXKSQT-UHFFFAOYSA-N	441.875	1.944	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2cccc(Cl)c2)c(=O)n(-c2ccccc2)n1C	763748627	WHAADFJSXAWMKN-UHFFFAOYSA-N	427.848	1.538	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2cc(OC)ccc2OC(C)C)c1	763774799	GGJJROGHXJUWMU-UHFFFAOYSA-N	431.445	1.899	50	20	IDGD	
CC[C@@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)cc1	763806939	JTMNWZSIJLQOBH-CQSZACIVSA-N	437.456	1.251	50	20	IDGD	
CC(C)C(=O)NNC(=O)C(=O)Nc1cccc(S(=O)(=O)/N=C2\CCCCCN2C)c1	763821560	SVDLPCNFQKQMRW-XQNSMLJCSA-N	437.522	1.022	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)CSc2ccc(C)cc2)cc1	763890785	GNJIWMKIPSZKTD-UHFFFAOYSA-N	431.470	1.425	50	20	IDGD	
CSCc1ccccc1NC(=O)C(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	763944050	KYPZFMLXZYMXRA-UHFFFAOYSA-N	425.470	1.841	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)C(=O)Nc1ccc(OC(F)F)c(F)c1	763945078	UXOMKBKZCGTBGV-UHFFFAOYSA-N	449.345	1.718	50	20	IDGD	
Cc1cc(N2CCOCC2)ccc1NC(=O)C(=O)NNC(=O)c1ccc2c(c1)OCCO2	764004724	SLCODHFNTKUCGO-UHFFFAOYSA-N	440.456	1.003	50	20	IDGD	
COC(=O)CCc1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)on2)cc1	764016746	MFARIBBOVBUVJC-UHFFFAOYSA-N	436.424	1.847	50	20	IDGD	
CN(C)C(=O)COc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3c2)cc1	764061594	JKNHYUYLEATTGW-UHFFFAOYSA-N	434.452	1.707	50	20	IDGD	
O=C(NNC(=O)c1cccc(Br)c1)C(=O)Nc1ncn(C2CCCCC2)n1	764062925	GFZGNRPVJNFCED-UHFFFAOYSA-N	435.282	1.946	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3c2)cc1-n1cnnn1	764067804	YGYJAIGXVPSYMH-UHFFFAOYSA-N	431.412	1.224	50	20	IDGD	
NC(=O)CCSc1ccccc1NC(=O)C(=O)NNC(=O)c1ccc(Cl)cc1O	764127399	VIXGJCGMUMSSIK-UHFFFAOYSA-N	436.877	1.413	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccccc2C(=O)N2CCCCC2)c1O	764131071	FBPSZOCOYWSWHI-UHFFFAOYSA-N	440.456	1.427	50	20	IDGD	
C[C@H](c1ccc(NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)cc1)N1CCOCC1	764170138	ZKVMHRNXRKMWJN-FOIQADDNSA-N	438.484	1.169	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2O)c(OC[C@H]2CCCO2)c1	764275747	SYBLYRRREBRNCH-OAHLLOKOSA-N	443.456	1.423	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2O)cc1OC1CCCC1	764278040	PRECESBFCSIRTC-UHFFFAOYSA-N	443.456	1.887	50	20	IDGD	
C[C@@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)Cc3ccccc3F)cc2F)C[C@@H](C)O1	764313267	JSVIGQRPCMYJQO-ZIAGYGMSSA-N	446.454	1.907	50	20	IDGD	
CCOCC(=O)NNC(=O)C(=O)Nc1ccc(CC(=O)N(CC)c2ccccc2)cc1	764317761	RAQNPGNZMGQUFE-UHFFFAOYSA-N	426.473	1.405	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C(=O)Nc1c(C)n(C)n(-c2ccccc2)c1=O)c1ccccc1	764329249	VSQUFKWVPVYDIW-SFHVURJKSA-N	435.484	1.764	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2cccs2)[nH]n1)C(=O)Nc1ccn(Cc2ccccc2)n1	764383279	ZOGXDXKIVWYGSL-UHFFFAOYSA-N	435.469	1.783	50	20	IDGD	
O=C1C[C@@H](Cc2ccc(NC(=O)C(=O)NNC(=O)c3ccc(Cl)cc3F)cc2)C(=O)N1	764410937	WYNTUMNTKMSCOX-LLVKDONJSA-N	446.822	1.084	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COCCO1)C(=O)Nc1ccc(OCc2ccccc2Cl)cc1	764434605	QTYXCKHPKDTGAC-KRWDZBQOSA-N	433.848	1.420	50	20	IDGD	
N#CCCNS(=O)(=O)c1ccc(C(=O)NNC(=O)CSc2ccccc2O)cc1	765249690	NXRUSJKREZZBRZ-UHFFFAOYSA-N	434.499	1.137	50	20	IDGD	
CCOC(=O)NNC(=O)C(=O)Nc1ccc(C)c(S(=O)(=O)N2CCCCCC2)c1	765405841	VBGJXFOUUZCYKE-UHFFFAOYSA-N	426.495	1.276	50	20	IDGD	
CCCn1ncc(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)c1C1CC1	765530160	JHFYIQSAZXENRB-UHFFFAOYSA-N	425.898	1.546	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)CNC(=O)Nc3ccccc3)n[nH]2)cc1OC	765597299	RCUMMKFNRWWMTB-UHFFFAOYSA-N	438.444	1.677	50	20	IDGD	
O=C(CCCOc1ccccc1F)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765736010	NRLITHCSBBCJAG-UHFFFAOYSA-N	442.491	1.590	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)N[C@H]1CCO[C@H](C2CC2)C1	765905958	RATFQEWVXIRGDP-WMZOPIPTSA-N	436.534	1.373	50	20	IDGD	
CC(C)(C)[C@H](Br)C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	766751950	YNWXHOISAGFMQM-TZMCWYRMSA-N	429.267	1.327	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1ccc2c(c1)C(C)(C)C(=O)N2	768929189	FIJOSVMHDXBXOC-UHFFFAOYSA-N	429.502	1.593	50	20	IDGD	
CN1C(=O)C[C@H](NC(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)[C@H]1c1ccc(Cl)cc1	768985793	DHRROPAITBCRMD-WMLDXEAASA-N	447.835	1.870	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1cc2c(cc1Br)CCC2	773544621	AGXLHLDVTIOOSA-UHFFFAOYSA-N	448.273	1.808	50	20	IDGD	
CNC(=O)c1cc(Oc2ccccc2NC(=O)C(=O)NNc2nccc(OC)n2)ccn1	773724456	ODQVPBPQICDLMR-UHFFFAOYSA-N	437.416	1.114	50	20	IDGD	
CC[C@H](NCC(=O)NNC(=O)c1ccc(F)cc1)c1ccccc1OCC(=O)N(C)C	775061427	VVKPLVOIJIKEHD-SFHVURJKSA-N	430.480	1.795	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2ccc(-c3cncnc3)cc2F)n1	775099033	ACFQKNHTBQHCGO-UHFFFAOYSA-N	429.433	1.595	50	20	IDGD	
Cc1cccc2c(=O)c(C(=O)NNc3ccccc3S(=O)(=O)N3CCOCC3)c[nH]c12	776165009	ISPXSNATIUQPMC-UHFFFAOYSA-N	442.497	1.614	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2cccc(Cl)c2O)CC1	776231443	HCDAKHGHBZMGED-UHFFFAOYSA-N	425.898	1.134	50	20	IDGD	
CCOc1ccc(C(=O)NCC(=O)NNc2cccc(S(C)(=O)=O)c2)cc1OCC	776537680	MLVKXISZEMBZJO-UHFFFAOYSA-N	435.502	1.761	50	20	IDGD	
COc1cccc([C@@H]2[C@@H](C(=O)NNC(=O)COc3ccc(C#N)cc3)CC(=O)N2C2CC2)c1	776558189	NHWJYUMPBMFBRQ-NZQKXSOJSA-N	448.479	1.845	50	20	IDGD	
Cc1cc(C)c(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1Br	777141211	ILWIEFVIZAYXKK-MRXNPFEDSA-N	448.273	1.992	50	20	IDGD	
Cc1cc(F)c([N+](=O)[O-])cc1S(=O)(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	777936991	HNXMAGLIJQKWQS-UHFFFAOYSA-N	444.828	1.322	50	20	IDGD	
CNC(=O)[C@@H]1CN(C(=O)C(=O)Nc2ccccc2S[C@H](Cl)C(F)(F)F)CCO1	782005837	YADYUTQKEKNZPE-BONVTDFDSA-N	439.843	1.818	50	20	IDGD	
O=C(NNc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1ccc(C(=O)N2CCOCC2)cc1	783290854	GIFIYXMVYYAXGA-UHFFFAOYSA-N	447.835	1.802	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ccc(-n3cccn3)nn2)c(OC[C@@H]2CCCO2)c1	783436721	ORYWOFWJCQLJNP-HNNXBMFYSA-N	437.460	1.610	50	20	IDGD	
CC(C)(C)c1ncc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)cn1	784213473	NNRXHYXMUGIZRH-UHFFFAOYSA-N	432.506	1.297	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ccc(C#N)c(C(F)(F)F)c2)cc1S(N)(=O)=O	784237237	QBBMUTNAMQHLCC-UHFFFAOYSA-N	441.391	1.615	50	20	IDGD	
CNS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccc(Br)cc2C)cc1	784413806	DABLAQOLQFTZIR-UHFFFAOYSA-N	441.307	1.747	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2nc(-c3ccc(Cl)cc3)no2)cn1	784794378	CRQGMCHPOTUJAC-UHFFFAOYSA-N	436.837	1.270	50	20	IDGD	
COCCOc1ncccc1NC(=O)C(=O)NNc1nc(-c2ccc(Cl)cc2)no1	784795810	WCXSVGZWTLBCCM-UHFFFAOYSA-N	432.824	1.892	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2ccc(N3CCOCC3)c(F)c2)n1	785230394	BDRGHTDQNOADDI-UHFFFAOYSA-N	431.472	1.380	50	20	IDGD	
Cc1ccc(N2CCNC2=O)cc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccc(F)cc1	787544557	UNGHMUYLPFDGMA-ZDUSSCGKSA-N	443.435	1.217	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)C(=O)Nc1ccc(Oc2ccccc2F)nc1	787570611	NNZDTCJCHWZHEB-UHFFFAOYSA-N	448.414	1.989	50	20	IDGD	
CC(C)CC(=O)NNC(=O)C(=O)Nc1ccc(N2CCN(C)CC2)c(Br)c1	787889474	OTARRLABQNUWJC-UHFFFAOYSA-N	440.342	1.333	50	20	IDGD	
CCCc1csc(NC(=O)C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)n1	789750052	ZXTUIZURHWOYOI-UHFFFAOYSA-N	438.535	1.097	50	20	IDGD	
Cc1ccn(C[C@@](C)(O)C(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)c(=O)c1	790901779	PIBZFVGVFVFLPL-MRXNPFEDSA-N	433.408	1.345	50	20	IDGD	
Cc1cc(C(=O)O)cc(S(=O)(=O)NNC(=O)CNC(=O)OCc2ccccc2)c1C	794598953	PPWSNMQJCPOVGL-UHFFFAOYSA-N	435.458	1.238	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(OC(F)F)cc2OC(F)F)n1	797371196	QWAKJVVULUCJGF-UHFFFAOYSA-N	430.314	1.993	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)N[C@H]1CCN(C(=O)Nc2ccccc2)C1	801077890	OQZFQKMMGXEMIP-MAUKXSAKSA-N	425.445	1.463	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)C(=O)Nc1ccc(OCC(F)(F)F)c(F)c1	807428620	FPQQXRRNHAMAOE-UHFFFAOYSA-N	439.329	1.824	50	20	IDGD	
C[C@@H]1CSC[C@H]1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	807478604	VCHFVBAQAUWROF-CZUORRHYSA-N	426.564	1.557	50	20	IDGD	
COC(=O)c1cn(-c2cccc(NC(=O)NNC(=O)Cc3c[nH]c4ccccc34)c2)nn1	812981658	GHUFXCDRQGVRHF-UHFFFAOYSA-N	433.428	1.931	50	20	IDGD	
O=C(NNC(=O)c1cnn2c1OCCC2)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	814266266	AMWADKRWCLXUBP-UHFFFAOYSA-N	444.455	1.442	50	20	IDGD	
O=C(NNC(=O)c1cn2c(Br)cnc2s1)c1ccc(-n2cnnn2)cc1	814760341	KEIBFAMOELDMPU-UHFFFAOYSA-N	433.251	1.209	50	20	IDGD	
COCCN(C)NC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(Br)s2)C1	816562138	ABVIGVCZDIVOTR-NSHDSACASA-N	440.385	1.521	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)C[C@@H](c2nccn2C)C(F)(F)F)c1	816810496	NTMCHRHGGHOCBO-ZDUSSCGKSA-N	447.439	1.168	50	20	IDGD	
COCCCNC(=S)N(C)NC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccccc1	837643400	BZWOBIHBOHXJGO-MRXNPFEDSA-N	428.580	1.104	50	20	IDGD	
O=C(CNS(=O)(=O)c1c(F)cccc1F)NNC(=S)NCCc1cccs1	838823617	SQUSDIUXSKHFBV-UHFFFAOYSA-N	434.515	1.043	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)c1ccc2c(c1)C(=O)N(C[C@@H]1CCCO1)C2=O	864020002	GJPMPGVLYUIUME-AWEZNQCLSA-N	441.415	1.441	50	20	IDGD	
N#Cc1ccc(-c2ccc(OCC(=O)NNC(=O)c3cccc(OCC(N)=O)c3)cc2)cc1	912985664	QWXBXHZPPNAPBM-UHFFFAOYSA-N	444.447	1.929	50	20	IDGD	
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC(=NNC(=O)c2cc(-c3ccccc3)[nH]n2)CC1	914554769	QXVNKYFGLNURKA-UHFFFAOYSA-N	441.517	1.987	50	20	IDGD	
O=C(NNC(=O)C1CCN(C(=O)c2cccnc2)CC1)c1nn(-c2ccccc2)cc1O	914603985	IGGURTKJGUIPIZ-UHFFFAOYSA-N	434.456	1.286	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)c(C)n1-c1ccccn1	914846310	FPZOTAZVGRTLHC-UHFFFAOYSA-N	447.904	1.865	50	20	IDGD	
CC(=NNC(=O)[C@H](C)Oc1ccccc1F)c1ccc(S(=O)(=O)NCC(=O)O)cc1	916335899	SJQMKYWZHIFUGI-ZDUSSCGKSA-N	437.449	1.496	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccc(Cl)c(C(N)=O)c2)c1	916382112	QDUXEBAQXUTBKB-UHFFFAOYSA-N	439.881	1.156	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)NCc2ccc(-n3cncn3)nc2)cc1OC	916395096	BSKHLFHFFHEOAV-UHFFFAOYSA-N	425.449	1.604	50	20	IDGD	
O=C(NCc1ccc(-n2cncn2)nc1)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1	916395270	PVMFNZGONSOHJK-UHFFFAOYSA-N	441.395	1.782	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCc2cccc(CN3CCCC3=O)c2)cc1OC	916415028	IGHQRUTUNSXZFH-UHFFFAOYSA-N	426.473	1.970	50	20	IDGD	
C[C@H]1CCCN(CCNC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)C1	916452224	CGMMQUQMMOASKH-INIZCTEOSA-N	437.566	1.147	50	20	IDGD	
COc1ccccc1NC(=S)NNC(=O)CCC(=O)N1CC(=O)Nc2ccccc21	916559465	FKBPULFSXBWECB-UHFFFAOYSA-N	427.486	1.778	50	20	IDGD	
O=C(NNC(=O)C1(S(=O)(=O)c2ccc(Cl)cc2)CC1)[C@@H]1COc2ccccc2O1	919689810	CTHQIUDWFKQTBI-INIZCTEOSA-N	436.873	1.634	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)NCc2ccc(N3CCO[C@H](C)C3)nc2)cc1	919903030	KKEBRDZSCNXXGG-MRXNPFEDSA-N	427.505	1.779	50	20	IDGD	
CN1C(=C(C#N)C(=O)COC(=O)CN2C(=O)[C@@H]3CCCC[C@H]3C2=O)N(C)c2ccccc21	921956088	DDGOCUYUDOPUAM-HUUCEWRRSA-N	436.468	1.595	50	20	IDGD	
O=C(Cn1c(=O)oc2cc([N+](=O)[O-])ccc21)NNC(=O)c1ccc(Br)cc1	1321404474	HGSHHHJYORAECJ-UHFFFAOYSA-N	435.190	1.726	50	20	IDGD	
CC(C)(C)OC(=O)Nc1cccc(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)n1	1321593256	ZGCRRGRIIIZQEX-UHFFFAOYSA-N	448.505	1.797	50	20	IDGD	
Cc1ncc(C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)c(C2CC2)n1	1322586032	PPCCCLZVZFGDFB-UHFFFAOYSA-N	442.951	1.895	50	20	IDGD	
CN(CCNC(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1)CC(F)(F)F	1322968822	ILVVMPXDTRRDQE-UHFFFAOYSA-N	425.452	1.458	50	20	IDGD	
C[C@@H](OC1CCCCC1)C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	1328575357	IZHVCUPYGCRZJM-OAHLLOKOSA-N	425.555	1.199	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccsc1)C2	1779371096	MNPJDZGEBAFTFJ-DYESRHJHSA-N	443.529	1.188	50	20	IDGD	
CCc1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](C)Br)C3)nn1C	1779910860	FKNHNQWHLJIBTG-URKNILKWSA-N	441.370	1.893	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(CN(C(=O)CC(C)(C)O)CCO2)C1	1780097287	VVNUBFSWLBMUPQ-NRFANRHFSA-N	449.460	1.125	50	20	IDGD	
Cc1n[nH]cc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)CBr)C2	1780144386	SCPKTQJPBUPCNE-WBHUJUFNSA-N	427.343	1.877	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)/C=C/C3CCCC3)C2)C1	1781277608	HIVJAVYTAPBWAE-CUPKIGNSSA-N	441.532	1.697	50	20	IDGD	
O=C1NCc2cc(C(=O)N3CCO[C@]4(CCN(C(=O)[C@H](F)Br)C4)C3)ccc21	1781331314	IFVDIQQFKAUTLU-KSSFIOAISA-N	440.269	1.064	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)Br)C2	1782180116	SFABIHYYQDNTGM-VPWBDBDCSA-N	425.751	1.538	50	20	IDGD	
N#Cc1ccc2[nH]nc(C(=O)N3CC[C@]4(CN(C(=O)CCBr)CCO4)C3)c2c1	1782194108	CLXIZSIMZFWYKJ-IBGZPJMESA-N	446.305	1.663	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cccn4nccc34)C2)C1	1782335311	CWRICBUZFKXQIU-HNAYVOBHSA-N	435.322	1.951	50	20	IDGD	
C[C@@H](Cn1ccnc1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Br)C2	1782548372	HPOIOFZZMYCVRF-LUXYFRNMSA-N	445.333	1.724	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@@]2(C1)CN(C(=O)C1CC(O)C1)CCO2	1782862328	RWYMYJYOPUWBRE-OZEUVNNHSA-N	431.439	1.473	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)C1(Br)CC1)CCO2	1783354204	WNAYVMTZGIQTRF-FZMZJTMJSA-N	438.160	1.917	50	20	IDGD	
COc1ccc(OCC(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](C)Br)C3)C2)cc1	1783527405	BRIRYRLXUAFADF-LIRRHRJNSA-N	441.322	1.687	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)COCc3ccccc3)CCO2)C1	1783533426	VKUVRSNZTJLSRZ-BEFAXECRSA-N	425.323	1.817	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cn4ccsc4n3)CCO2)C1	1783534791	ZHXUZCZNJIIFGE-MEDUHNTESA-N	427.324	1.623	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)CCc3cncc(OC)c3)CCO2)C1	1783873820	VGVFZETUVXAMCA-FXAWDEMLSA-N	425.913	1.107	50	20	IDGD	
CC#C[C@@H](CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]2C1)c1ccc(O)cc1	1784096510	YYGHRMJIGHPYRQ-XYYCENQHSA-N	448.947	1.469	50	20	IDGD	
C[C@@H](CBr)C(=O)Nc1ccc(C2(NC(=O)CC[C@@H](N)C(N)=O)CCC2)cc1	1786069144	MAVXEAKPPRXOMG-SWLSCSKDSA-N	439.354	1.744	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CSc3ncccn3)[C@H]2C1	1787074460	UHGDKXHCXUQIMC-JYJNAYRXSA-N	438.626	1.400	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(N4CCOCC4)n3)C[C@@H]21)[C@@H](F)Cl	1787446817	DXJRQWZFERXZKP-ILXVDBEPSA-N	440.903	1.046	50	20	IDGD	
O=C(Cc1ncccn1)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1	1788145362	ZZZOJQCKTVFLPP-UHFFFAOYSA-N	430.273	1.147	50	20	IDGD	
Cc1n[nH]c(C)c1CC(=O)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1	1788150556	XHLVIBWBXSMQAV-UHFFFAOYSA-N	446.316	1.697	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc4cccnc4[nH]3)[C@H]2C1	1788371674	PTNKACYRMWKTRY-DSRCVFDASA-N	435.322	1.940	50	20	IDGD	
COC[C@H](NC(C)=O)C(=O)Nc1ccc(C2(NC(=O)[C@@H](F)Br)CCC2)cc1	1789660315	RBJLJTPZPWFTMR-LSDHHAIUSA-N	444.301	1.962	50	20	IDGD	
COC[C@H](Cl)C(=O)NC1(c2ccc(NC(=O)[C@@H](COC)NC(C)=O)cc2)CCC1	1789661202	IAKLUEBJIOXKSH-DLBZAZTESA-N	425.913	1.525	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCn3c(=O)oc4ccccc43)C[C@@H]21	1789858981	UEJGASOUDNDJKN-FPXQBCRKSA-N	449.935	1.982	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccnc4ncccc34)[C@H]2C1	1790403021	HXQNYNYSCXWOEA-RUGDWHBFSA-N	432.908	1.477	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@](C)(O)C(F)(F)F)C[C@@H]21	1790958510	RVXAULRIZGIKMR-IAGXKZSMSA-N	445.276	1.453	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(Cl)cnc3O)C[C@@H]21	1791250251	CCLVAGMCNAYUDW-HJPIBITLSA-N	432.304	1.288	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)CBr)C2	1792866555	FZUMVQCFQDGZSR-RXGFPQBGSA-N	440.176	1.638	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccn3cncc3c1)C2	1792870384	GARWWLDXRKPFGI-JJAZEVLHSA-N	435.322	1.569	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ncccc1-c1ccccc1)C2)[C@@H](O)CCl	1792978425	VFRWLYDHIWAAPL-NBMJBFSESA-N	429.904	1.552	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CCN1C(=O)OC(C)(C)C	1793865614	AVSUZZHUZFEPTP-JKJDWNRSSA-N	429.945	1.888	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CC(=O)N(C2CCCC2)C1	1794030879	FKQHQKZOTUWAFJ-AGTSVGGPSA-N	425.957	1.670	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1(c2ccc(F)cc2)CC1	1794046947	NCHHSKQZQIDUGI-REPLKXPHSA-N	430.524	1.869	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(C)(F)F	1795471965	FUJDQMWEICIAME-RNJOBUHISA-N	439.887	1.363	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)c1ccccc1	1795812769	UGRZMTFMFVIOKC-BPBAZMLESA-N	437.500	1.492	50	20	IDGD	
C[C@@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Cl	1796371319	VGBCTJGCDVMZOD-CMZRPVNOSA-N	441.887	1.425	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](N)Cc1cscn1	1796748333	WPGZVZIJJBEGMN-KLLKFSIISA-N	429.384	1.825	50	20	IDGD	
C[C@@H]1Oc2ccc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@@H](F)Cl)C4)cc2NC1=O	1798583333	ZUZYNIOYYXRKQA-QUEVIFFYSA-N	425.844	1.144	50	20	IDGD	
COc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Br)C3)c(C)c1	1799024473	CSTSAHLVHJCTGF-NOXHYTERSA-N	429.286	1.897	50	20	IDGD	
COc1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](O)CCl)C3)nc1Br	1799071262	OLJVHJABVHNPOY-NOHGZBONSA-N	446.729	1.704	50	20	IDGD	
C[C@@H](Oc1ccccn1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Br	1799351910	GBDCAFPMHGMYIC-AMVBZWJASA-N	430.274	1.129	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1c(F)cc(OC)cc1F	1799593477	XLXKYAFZMUMMSN-QTFJUKGGSA-N	432.851	1.430	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccccc1C(N)=O	1799625336	RVYCAINMLJSQIC-CVGJEZRXSA-N	428.316	1.225	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(Cl)cc1	1799677757	MINCVODOIQLUDF-MUJYYYPQSA-N	427.892	1.904	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)Oc1ccccc1	1800624992	XRISSRSVKLMCSO-JGFGOLAASA-N	425.323	1.827	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(Cl)cnc1O)C2	1800754074	DMEJRTWZKGCWPR-XHSYRHOGSA-N	432.702	1.427	50	20	IDGD	
COc1cc(F)c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)Br)c(F)c1	1800759944	SNHLKGWFXHRZIE-OJLPPKNESA-N	447.276	1.960	50	20	IDGD	
COc1cccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)Br)c1C	1800762569	DJGZSVPUDLUERV-JNNRSPCRSA-N	439.350	1.919	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cn3cc(Cl)ccc3n1)C2	1800978143	MDJMFGXKKULYDA-DMVWFOPNSA-N	441.315	1.445	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CNC(=O)C1	1801678076	BQUAWEDFOKIKKJ-MIRJSDFSSA-N	428.439	1.646	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)c1cc(Cl)c(Cl)cc1F	1801862253	DVAKZTPWUVEUGY-QTGCHDBNSA-N	439.698	1.935	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)nn1C(F)F	1803140352	DJTSMPTWTLNOMJ-KBMXLJTQSA-N	441.866	1.901	50	20	IDGD	
N#Cc1cc(CC(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]2c2cccnc2)ccc1F	1803141947	WDQXDRKJOJTINF-OZOXKJRCSA-N	444.894	1.941	50	20	IDGD	
C[C@H](Oc1ccccn1)C(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]1c1cccnc1	1803146298	NBAKLDXUTLYYIV-KNIMUDFMSA-N	432.908	1.550	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC2(CCN(C(=O)CN3CCOC3=O)CC2)C1	1805383475	LPPSVLGXKOYZFU-AWEZNQCLSA-N	430.343	1.701	50	20	IDGD	
C[C@H]1CC[C@H](C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)CC1	1807367858	NMJFCUCDKUNIHQ-HGPLWSSJSA-N	449.360	1.907	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)n1cccc1	1807373801	GSEFVCPSNVXXSM-NQSCKRDGSA-N	446.316	1.144	50	20	IDGD	
Cc1noc(CC(=O)NC[C@@H]2CCN(C(=O)[C@@H](F)Br)[C@@H]2c2cccnc2)n1	1807525497	UYBJVXRFIYSWPM-APHBMKBZSA-N	440.273	1.712	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H](CNC(=O)CCN2CCOC2=O)[C@@H]1c1cccnc1	1809532625	NMOHKMPRSUFXRU-XLIONFOSSA-N	448.596	1.781	50	20	IDGD	
Cc1nccn1CC(=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@@H]1c1cccnc1	1812406560	ICHHHVHITGHRJU-USXIJHARSA-N	438.301	1.983	50	20	IDGD	
C=CCNC(=O)/C=C\C(=O)N1CC[C@H](CNC(=O)[C@H](Cl)COC)[C@H]1c1cccnc1	1813028136	LMFYYIUGWRWCHU-BNAAHYRBSA-N	434.924	1.200	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)C23CC(C(=O)OC)(C2)C3)[C@H]1c1cccnc1	1813032498	CPNINVYMKALYGS-CTHIEXCLSA-N	449.935	1.685	50	20	IDGD	
CN[C@H](CC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](C)CBr)n[nH]1)C(=O)O	1814779971	BRNXOCURQASMLM-CYZMBNFOSA-N	444.330	1.496	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@H](F)Cl)CC2)c1cc(=O)nc2sccn12	1821153468	SPQZCAJQEOKYDQ-KRTXAFLBSA-N	441.897	1.973	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1)c1cc(O)cc([N+](=O)[O-])c1	1821263027	ZBUWAIIPAJPSRF-HUUCEWRRSA-N	437.840	1.929	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(C(=O)O)ncn2)[nH]n1	1822367835	SUDPLWOHACJHTC-QMTHXVAHSA-N	436.856	1.458	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H]2CCCS2(=O)=O)[nH]n1	1822377684	YLSLSHQAXRIHAP-YUTCNCBUSA-N	432.930	1.233	50	20	IDGD	
O=C(c1nc(O)n2c1CCCC2)N1CCC([C@@H]2CCCCN2C(=O)[C@H](O)CCl)CC1	1824186969	WTBYXIJYFQRNEB-DOTOQJQBSA-N	438.956	1.758	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)[C@H]3CNC(=O)C3)sc2C1	1825203217	HRWFKEGQURBDPP-UTLUCORTSA-N	429.340	1.365	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnc(O)[nH]1)CC2	1825450756	VUANVYBLDGBMQO-YUMQZZPRSA-N	428.312	1.971	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(=O)cco2)CC1	1826230778	RGRUTGBTTCNOAC-SFHVURJKSA-N	432.521	1.246	50	20	IDGD	
Cc1ncncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1	1829358042	QQUJRYNVULXHGR-OAQYLSRUSA-N	436.321	1.012	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CN2CCS(=O)(=O)CC2)CC1	1830303540	OEDPLNFAMPRVQA-QZTJIDSGSA-N	448.029	1.354	50	20	IDGD	
O=C(c1cc(Cl)ccc1F)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1830719405	CSQRLHVURHKXTP-QAPCUYQASA-N	435.279	1.149	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](NC(C)=O)C(C)(C)C)CCO2	1831095068	FZNMAMVMIQBVOJ-FTRWYGJKSA-N	431.961	1.011	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC([C@H]2CCCCN2C(=O)Cn2ccncc2=O)CC1	1831107312	IUCYFCRDYCNUBK-GOEBONIOSA-N	439.354	1.646	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(COC)c[nH]3)C2)C1	1831653874	FYCGEXPNGFDRHA-OXQOHEQNSA-N	427.929	1.639	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc4nccn34)C2)C1	1831654075	PYKPEEHDLZSFPA-IERDGZPVSA-N	434.924	1.812	50	20	IDGD	
COc1cc(C#N)cc(C(=O)N2CCC(N3CCC(NC(=O)[C@H](O)CCl)CC3)CC2)c1	1833312669	VZOWAZUECXJPFM-HXUWFJFHSA-N	448.951	1.352	50	20	IDGD	
C=CCO[C@H](C)C(=O)NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1	1833473580	KLONAKWJWCGDND-OAHLLOKOSA-N	430.387	1.934	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cncn3-c3ccncc3)CCO2)C1	1833654272	FDXLRBZVJPQGBL-LAUBAEHRSA-N	447.923	1.355	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)CCC3CCC3)CC2)CC1)c1cccc(B(O)O)c1	1834800111	WHRGRTMEDZCZFK-UHFFFAOYSA-N	441.381	1.132	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)CC3CCC3)CC2)CC1	1835737248	AJVNVQBCDADGLH-UHFFFAOYSA-N	442.564	1.061	50	20	IDGD	
O=C(Cc1cccnc1Cl)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836715340	QJTQPFPBZMJNAH-KRWDZBQOSA-N	444.359	1.876	50	20	IDGD	
Cn1cnc(C(=O)N2CCC(OC3CCN(C(=O)CCBr)CC3)CC2)n1	1837380341	LXHSEPGFFFPDBP-UHFFFAOYSA-N	428.331	1.212	50	20	IDGD	
C[Si](C)(C)c1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)co1	1837424360	VGFPSBADPZINKH-MAUKXSAKSA-N	432.952	1.429	50	20	IDGD	
CCN(CC)C[C@@H](C)C(=O)N1CCOC[C@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1837716036	YJSMGXDEJVNNBG-NQIIRXRSSA-N	443.661	1.272	50	20	IDGD	
COCCn1ccc(C(=O)N2CCC(OC3CCN(C(=O)[C@@H](F)Cl)CC3)CC2)n1	1838083211	CNIMZGQAPZXCJD-QGZVFWFLSA-N	430.908	1.676	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cncc4cnccc34)CCO2)C1	1838465387	VJBLINRLCIAXPW-NQIIRXRSSA-N	432.908	1.717	50	20	IDGD	
Cc1nc(C)c(C(=O)N2CCC(OC3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)o1	1838470065	DJVCCJUCZRYBQD-UHFFFAOYSA-N	449.552	1.277	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(-c4cccnc4)[nH]n3)C2)C1	1839145359	FISAZFRAEKNPQB-IERDGZPVSA-N	447.923	1.559	50	20	IDGD	
O=C([C@@H]1CCCSC1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839203199	CYAABXBCBPZQGO-DVOMOZLQSA-N	439.347	1.277	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(C)cc(OC)c3)CCO2)C1	1839256789	PSPULRHCVQGYEJ-GHTZIAJQSA-N	440.924	1.327	50	20	IDGD	
Cn1cc2cc(C(=O)N3CCO[C@]4(COCCN(C(=O)C(C)(C)CCl)C4)C3)ccc2n1	1839503501	PSTRJKKCKGUYAI-JOCHJYFZSA-N	448.951	1.908	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc4nn[nH]c4c3)CCO2)C1	1839628312	YWOUDWZLAASCOB-HXUWFJFHSA-N	435.912	1.293	50	20	IDGD	
CC(C)=NO[C@H](C)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](C)Br)CCO2)C1	1840034421	KVBNOWRXDXOUGX-JJRVBVJISA-N	434.331	1.027	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H](C)CC(C)=O)CCO2)C1	1840133016	RWWKPZRILQZVAT-DHSIGJKJSA-N	433.343	1.232	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3ccc(C#N)cc3)C2)C1	1840149659	WPKZULSFOCTGQT-DENIHFKCSA-N	449.935	1.201	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3c[nH]c4ncccc34)CCO2)C1	1840870520	NHFAILKWAWQNHX-GCJKJVERSA-N	448.951	1.969	50	20	IDGD	
Cn1nc(C(=O)N2CCCC23CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C3)cc1O	1842190796	SSEIXAKPQQGWBX-ZDUSSCGKSA-N	441.916	1.075	50	20	IDGD	
O=C(c1ccc(-c2cccnc2)cc1)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843014574	ALDPFOFRWRQNCV-UHFFFAOYSA-N	441.296	1.559	50	20	IDGD	
COc1cc(N2CCC(C(=O)N3CC4(CCCN4C(=O)[C@H](F)Cl)C3)CC2)ncn1	1843361425	GCDQXDZRKYACLA-INIZCTEOSA-N	425.892	1.439	50	20	IDGD	
O=C1CCc2ccc(C(=O)N3CC4(CCCN4C(=O)[C@H](F)Br)C3)nc2N1	1845217164	ITETUCCCIKTGHW-ZDUSSCGKSA-N	425.258	1.474	50	20	IDGD	
O=C(OCc1ccccc1)N1CC(C(=O)N2CCCC23CN(C(=O)[C@H](O)CCl)C3)C1	1845947752	WIBXSUPQXKBRRU-QGZVFWFLSA-N	435.908	1.058	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)/C=C/C(=O)NCc1ccccc1	1847542014	WEGCLNNKBSYGIS-FCTQOEHPSA-N	434.334	1.844	50	20	IDGD	
O=C(c1ccoc1I)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl	1847559603	IXUHKALJQIGCSF-GARJFASQSA-N	438.649	1.299	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)C1CCC(O)CC1	1848098492	GCEYBWZKFCOECA-YOTSKQKMSA-N	443.972	1.871	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)CNC(=O)c2ccc(F)cc2F)c2ccccc2c1=O	11148203	YHQAXHIQRJMMIV-UHFFFAOYSA-N	443.410	1.276	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)CCc2nc3cc(S(=O)(=O)N(C)C)ccc3n2C)n1	11261654	WEUUOBKBYKKHHK-UHFFFAOYSA-N	431.522	1.306	50	20	IDGD	
CON(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)c1	20909599	IWKUQCKPEBSCAJ-LBPRGKRZSA-N	425.438	1.236	50	20	IDGD	
O=C(CCc1nc(-c2cccs2)no1)NNC(=O)c1csc(N2CCOCC2)n1	24291748	MGHAKQABVAISGX-UHFFFAOYSA-N	434.503	1.485	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)c1ccc(CN2C(=O)CCC2=O)cc1	110434380	DHVUYNLSUNRPSD-UHFFFAOYSA-N	442.497	1.533	50	20	IDGD	
O=C(COC(=O)/C=C\c1ccc2ccccc2n1)NNC(=O)[C@H]1COc2ccccc2O1	212364351	IRQBAJOZHZOQCB-ZCPJJFRWSA-N	433.420	1.779	50	20	IDGD	
CC(C)[C@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	727116119	XOBJHXGWVZMKGF-ZDUSSCGKSA-N	448.929	1.298	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNS(=O)(=O)c1ccc(N2CCCS2(=O)=O)cc1	729667722	WMHDDQHQIZZOCC-UHFFFAOYSA-N	448.526	1.191	50	20	IDGD	
Cc1ccc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)Cc3cc[nH]n3)cc2)cc1C	730091822	YDTMUNYISIGZBP-UHFFFAOYSA-N	427.486	1.831	50	20	IDGD	
O=C(NCCC(=O)N1CCN(c2ccccc2)CC1)NNC(=O)c1cccc2ncccc12	730125865	PVVDZEZJODDMPK-UHFFFAOYSA-N	446.511	1.918	50	20	IDGD	
O=C(COC(=O)c1cccc(Br)c1O)NNC(=O)c1ccc([N+](=O)[O-])cc1	730368727	YWSRMYUJMUPTQU-UHFFFAOYSA-N	438.190	1.681	50	20	IDGD	
CS(=O)(=O)c1cc(C(=O)NNC(=O)COc2ccccc2O)ccc1Br	730778180	DCEIGVDZQSXSFK-UHFFFAOYSA-N	443.275	1.398	50	20	IDGD	
CCOC(=O)/C(C#N)=C\Nc1cc(S(=O)(=O)N2CCOCC2)ccc1N(CC)CC	730940455	DOKPBWSDQJOLSN-NXVVXOECSA-N	436.534	1.936	50	20	IDGD	
COc1ncnc(OC)c1C(=O)NNC(=O)[C@H](C)Oc1cccc(Br)c1	732052724	ZFEKFPMHOOXSSL-VIFPVBQESA-N	425.239	1.485	50	20	IDGD	
CC(=O)NCCNC(=O)CCC(=O)NNc1ccc(Br)cc1C(F)(F)F	732291151	RQRQNVDMCAXHBF-UHFFFAOYSA-N	439.232	1.944	50	20	IDGD	
COc1ccc(N2C[C@@H](C(=O)NNc3nc4ccccc4c(=O)n3C)CC2=O)c(OC)c1	733263492	FWZAWEQOXVPBGY-ZDUSSCGKSA-N	437.456	1.447	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)N[C@@H]2CCC[C@@H](C(=O)N(C)C)C2)nc1	734221606	NMSUMDQSNIBJEX-HUUCEWRRSA-N	440.570	1.385	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCC2Cc3ccccc3C2)cc1	735384573	JNCLXUWLTZQINE-UHFFFAOYSA-N	430.530	1.361	50	20	IDGD	
O=C(NNC(=O)c1cc(OCC(F)(F)F)ccc1OCC(F)(F)F)C(=O)NC1CC1	737779176	ZOJXLGDFJGFZSQ-UHFFFAOYSA-N	443.300	1.608	50	20	IDGD	
CN(CC(C)(C)C)C(=O)c1cccc(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c1	741658589	ASVXBAPECBJFRH-UHFFFAOYSA-N	435.488	1.855	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)c2cc(=O)n(-c3nc(C)cc(C)n3)[nH]2)cc1OC	741741193	OYAOZAAYQUKSMR-UHFFFAOYSA-N	426.433	1.055	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)c1ccc(N2CCCS2(=O)=O)cc1C	743294148	RVWZQCNZLMCNFH-UHFFFAOYSA-N	432.502	1.417	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)NCc1ccccc1OCCN1CCOCC1	744868931	KSOQXZUGTLDPBN-UHFFFAOYSA-N	446.479	1.446	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)Cc2coc3cc(F)ccc23)CC1	748320868	JELWFWLQDIYJPR-UHFFFAOYSA-N	447.492	1.589	50	20	IDGD	
Cc1ccc(CNC(=O)NCC(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)cc1	748610972	XXONJRBCYYJJGD-UHFFFAOYSA-N	426.445	1.934	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)NCC2CCN(S(C)(=O)=O)CC2)c(C)n1C[C@H]1CCCO1	748668353	YMTDFTHMKSAPHQ-GUBQRQEFSA-N	448.589	1.979	50	20	IDGD	
O=C(NNC(=O)c1csc(-c2cccc(C(F)(F)F)c2)n1)N[C@H]1CCS(=O)(=O)C1	751363522	XJZSEXVBKWMNJZ-NSHDSACASA-N	448.448	1.960	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2ccc(C(=O)NNC(=S)N[C@H](C)C3CC3)cc2)C[C@@H](C)O1	751619250	LVGAKPUAJYIURX-HZSPNIEDSA-N	440.591	1.392	50	20	IDGD	
C[C@H](NC(=S)NNC(=O)C1CCN(S(=O)(=O)c2ccc(C#N)cc2)CC1)C1CC1	751620498	WBDUIZLZLKYHSS-ZDUSSCGKSA-N	435.575	1.253	50	20	IDGD	
COc1cc(OC)cc(N2C[C@@H](C(=O)NNc3ccccc3S(C)(=O)=O)CC2=O)c1	752800135	KFADFMHTVKFWGM-ZDUSSCGKSA-N	433.486	1.604	50	20	IDGD	
Cn1c(NNC(=O)CCNS(=O)(=O)c2ccccc2Cl)nc2ccccc2c1=O	752909304	VCAPPOLYSUDQSY-UHFFFAOYSA-N	435.893	1.399	50	20	IDGD	
Cc1nc(N2CCN(C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)CC2)sc1C	754109624	JMJAVGQXSFKTJY-UHFFFAOYSA-N	444.565	1.329	50	20	IDGD	
COCCS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2cc(OC)cc(OC)c2)cc1	756551709	LCDOQFOSVSHSTB-UHFFFAOYSA-N	437.474	1.590	50	20	IDGD	
CS(=O)(=O)Nc1ccc(NC(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1Cl	756707507	IBEMXTDMSGYUEU-UHFFFAOYSA-N	440.865	1.949	50	20	IDGD	
O=C(COC(=O)C(F)(F)c1c(F)cccc1F)NNC(=O)[C@@H]1COc2ccccc2O1	757827900	OJYNYYGSQOIPQE-AWEZNQCLSA-N	442.321	1.587	50	20	IDGD	
Cc1cc(C(=O)N2CCOCC2)ccc1NC(=O)NNC(=O)COc1ccccc1F	757830826	LHRHDGBSIXPUIX-UHFFFAOYSA-N	430.436	1.838	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)COc2ccccc2O)cc1S(=O)(=O)NC1CC1	757876127	YQCYXRIDGPGXIH-UHFFFAOYSA-N	434.474	1.373	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cnn(CCO[C@@H]3CCCCO3)c2C)cc1OC	758052314	BJMPNYJMNUSORG-LJQANCHMSA-N	432.477	1.827	50	20	IDGD	
COc1ccc(C(C)(C)C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1OC	758134318	KGQORGHUQSQLDI-UHFFFAOYSA-N	445.428	1.894	50	20	IDGD	
Cc1cc([N+](=O)[O-])c(C)c(S(=O)(=O)NNC(=O)c2csc(N3CCOCC3)n2)c1	758148717	QNPBMLFLFDOMIC-UHFFFAOYSA-N	441.491	1.128	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](CNC(=O)NNC(=O)C(=O)Nc1ccccn1)c1ccccc1	758811345	ABZSGUXBLPFEGV-OAHLLOKOSA-N	442.476	1.617	50	20	IDGD	
O=C(NC[C@]1(Cc2ccc(F)cc2)CCC[C@@H]1O)NNC(=O)C(=O)Nc1ccccn1	759690973	YKLFKQRVOCHQOK-HRAATJIYSA-N	429.452	1.264	50	20	IDGD	
COc1cccc(/C=C(\C#N)C(=O)OCC(=O)Nc2cc(S(N)(=O)=O)ccc2OC)c1	759871854	NKCGBBULVVDKLS-RIYZIHGNSA-N	445.453	1.440	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CN2CCCN1CC2)c1cn(-c2ccccc2)nc1-c1ccccc1	763263373	AFZDCPDZVKQBQN-NRFANRHFSA-N	430.512	1.690	50	20	IDGD	
CC(C)(C)[C@@H]1CCC2=S=C(C(=O)NNC(=O)c3ccnc4c(C(N)=O)cnn34)C=C2C1	763467438	VSRKKGSZJVMDRO-GFCCVEGCSA-N	440.529	1.453	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccccc1-n1nc(C)nc1C	763656358	AUIXHVHIDIVOML-UHFFFAOYSA-N	438.444	1.058	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2cccc(N3CCCNC3=O)c2)c1	763668019	FYCRFFXOFIYEEL-UHFFFAOYSA-N	439.472	1.388	50	20	IDGD	
COC(=O)c1cc(OC)ccc1NC(=O)C(=O)NNC(=O)COc1ccc(C)c(C)c1	763678874	FDGXRJQSXVMUFX-UHFFFAOYSA-N	429.429	1.264	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2c3c(nn2-c2ccccc2)CCC3)cc1	763679579	OEYWNPRHAOWWEF-UHFFFAOYSA-N	444.451	1.398	50	20	IDGD	
Cn1c(=O)oc2cc(NC(=O)C(=O)NNC(=O)CC34CC5CC(CC(C5)C3)C4)ccc21	763738719	WWVFBANQUZCJJE-UHFFFAOYSA-N	426.473	1.824	50	20	IDGD	
COc1cc(OC)c(OC)cc1NC(=O)C(=O)NNC(=O)CN1CCCc2ccccc21	763745788	KURJIGUTLMKQNU-UHFFFAOYSA-N	442.472	1.251	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cc(NC(=O)C(=O)NNC(=O)C(C)C)ccc1C	763820588	LEWJYNGBBUUXHL-UHFFFAOYSA-N	448.501	1.546	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(N3CCNC3=O)ccc2Cl)cc1	763829497	BKOBBIICFPMJCY-UHFFFAOYSA-N	429.864	1.832	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)c(OC)c1OC	763849565	KFOVGKYUPARVTI-LLVKDONJSA-N	435.408	1.405	50	20	IDGD	
CON(C)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)cc1	763856253	GHONMTACBXFQRI-GFCCVEGCSA-N	432.408	1.013	50	20	IDGD	
Cc1cc(C(=O)NC(C)C)ccc1NC(=O)C(=O)NNC(=O)Cc1c[nH]c2ccccc12	763860075	AQHFARKEMUKICF-UHFFFAOYSA-N	435.484	1.943	50	20	IDGD	
COc1cc(C(=O)N(C)C)ccc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccc(F)cc1	763871992	JHZRGQJQMKFEDJ-LBPRGKRZSA-N	446.435	1.090	50	20	IDGD	
COC(=O)c1ccc(OC)cc1NC(=O)C(=O)NNC(=O)CCSc1ccc(F)cc1	763904151	XLHBOTIBZKZMAJ-UHFFFAOYSA-N	449.460	1.889	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccccc2C(=O)OC)cc1OC	763912414	ZOUHYXDQMIITCD-UHFFFAOYSA-N	429.429	1.670	50	20	IDGD	
COc1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	763945081	VCLIRFPUCUFESW-UHFFFAOYSA-N	429.820	1.640	50	20	IDGD	
CNS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3c2)cc1	764067860	ZRCCSBVATBJKJR-UHFFFAOYSA-N	426.454	1.148	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccn(-c4ccccc4)n3)n[nH]2)cc1	764110233	GTCPHCWBTCBLAZ-UHFFFAOYSA-N	429.440	1.971	50	20	IDGD	
O=C(CC(F)(F)F)NNC(=O)C(=O)Nc1nc2cc3c(cc2s1)OC(F)(F)O3	764116919	PISGHMXTJNTKAS-UHFFFAOYSA-N	426.279	1.656	50	20	IDGD	
CCN(CC)CCOc1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)cc1	764170152	ZXOCVLVYWQDCOV-FQEVSTJZSA-N	440.500	1.497	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)N2C[C@H](CC(=O)N(C)C)c3cc(Cl)ccc32)o1	764370529	DOOQUBJWWKKPIY-LBPRGKRZSA-N	432.864	1.611	50	20	IDGD	
CNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2F)cc1Cl	764410718	OKGIRNMECNWBOG-UHFFFAOYSA-N	427.219	1.892	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)c2ccc(=O)n(-c3ccccc3F)n2)cc1	765529088	FJQXQNPJBLIEEZ-AWEZNQCLSA-N	440.431	1.999	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1ccc(OC2CCC2)cc1	765737373	YLWQNKMSTFPMIR-UHFFFAOYSA-N	436.512	1.837	50	20	IDGD	
COc1ccc(I)c(NC(=O)C(=O)NNc2nccnc2OC)c1	766269615	DFZKIDCMUMYMMF-UHFFFAOYSA-N	443.201	1.180	50	20	IDGD	
CC(C)c1cc(C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)n(C)n1	766661736	YOPFFCJVTZWFBY-UHFFFAOYSA-N	432.956	1.776	50	20	IDGD	
CCCn1cc(C(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)nn1	766778220	QFEJNAKDCGUIBS-UHFFFAOYSA-N	431.460	1.465	50	20	IDGD	
O=C(NNc1ccc(-n2cccn2)nn1)N[C@@H]1CC(=O)N(c2ccc(Cl)c(F)c2)C1	766870741	PPFIUBSJZYLHKV-LLVKDONJSA-N	430.831	1.886	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)[C@@H]1CSCN1C(=O)CC(C)(C)C	767334967	PLLLBXZCNNBLCS-INIZCTEOSA-N	435.546	1.566	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)CN2C(=O)N[C@@]3(CCCC(C)(C)C3)C2=O)cc1	768568405	FPHQEJOMBVHMEV-OAQYLSRUSA-N	430.509	1.796	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)[C@@H](C)S(=O)(=O)c1ccc(F)cc1	768639327	OVGSMUSGXMRPKK-LLVKDONJSA-N	430.479	1.543	50	20	IDGD	
COCCCNC(=S)N(C)NC(=O)c1cccc(N2C(=O)c3ccccc3C2=O)c1	768736616	BTNKIGLZFGDHRT-UHFFFAOYSA-N	426.498	1.975	50	20	IDGD	
N#Cc1ccc(OC2CCC(NC(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)CC2)nc1	769028829	GDWAEOCALOTWHT-UHFFFAOYSA-N	447.459	1.263	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)N[C@@H]2CCN(C(=O)OCC)C2)c2ccccc2c1=O	771393937	SKWYYQDVRYOAMM-CQSZACIVSA-N	444.492	1.371	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)N[C@H]1CC(=O)N(c2c(F)cccc2F)C1	771435364	QZWHFFOKUWRBEO-VIFPVBQESA-N	435.343	1.328	50	20	IDGD	
CN(CCCNC(=S)NNC(=O)C(=O)NCc1ccc(Cl)cc1)c1ccccc1	771541393	KNIYBDDAKWQVCB-UHFFFAOYSA-N	433.965	1.978	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N[C@@H](C)c2nnc(C)o2)cc1	771568798	YTXBLQOCRFSMPG-RKPNYOAGSA-N	449.471	1.910	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)[C@H]1CCCN1C(=O)c1ccc2c(c1)OCO2	772066627	ZLOMKYHPEPHHEI-DZGCQCFKSA-N	433.461	1.145	50	20	IDGD	
Cc1ccc(CN2C(=O)CC[C@H]2C(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)cc1	772883433	AIGJNMUUEYXJHD-SFHVURJKSA-N	442.903	1.603	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2ccc(-c3nnc4n3CCCCCC4)cc2)n1	773730674	KKVDWVQFNJHLID-UHFFFAOYSA-N	436.476	1.942	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)cc1NC(C)=O	774002546	RJBNHLOWVJALEF-LLVKDONJSA-N	448.863	1.860	50	20	IDGD	
Cn1cc(S(=O)(=O)NNC(=O)c2cccc(Cl)c2)cc1C(=O)NCC(F)(F)F	775668982	BMDYWTAINHAHFX-UHFFFAOYSA-N	438.815	1.594	50	20	IDGD	
C[C@@H](C(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1)n1nnnc1C(C)(C)C	776202686	VUAYJUVNGVNFMG-ZDUSSCGKSA-N	438.533	1.167	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)[C@H](Cc2ccccc2)NC(=O)c2cccnc2)c1	776533803	LQSHPTIWZOBNTO-FQEVSTJZSA-N	438.509	1.970	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(CC(=O)N2CCN(S(=O)(=O)CBr)CC2)C1	777777066	DHHBNHVHJYHKEH-UHFFFAOYSA-N	440.360	1.070	50	20	IDGD	
CN(NC(=O)c1ccc(NS(=O)(=O)c2ccc(Br)s2)cc1)C(N)=O	778417215	QAFPPPCNZSUNRT-UHFFFAOYSA-N	433.309	1.967	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)NCCNS(=O)(=O)c2cccc(Cl)c2)c1	780819100	ZEIPOTJALWKQOU-UHFFFAOYSA-N	426.882	1.731	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(C(=O)NNC(=O)CCNC(=O)OC(C)(C)C)cc1	780971267	MLZHGSCSBMQDHR-UHFFFAOYSA-N	442.538	1.393	50	20	IDGD	
Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)C(=O)NN[C@]1(C)CCS(=O)(=O)C1	783427940	UVDNRHMQWGLVBI-OAQYLSRUSA-N	442.497	1.796	50	20	IDGD	
O=C(Cc1cc(O)nc(O)n1)NN=Cc1ncc(Br)cc1Br	783851060	YXCTWQFBUCOSNK-UHFFFAOYSA-N	431.044	1.501	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)C(=O)Nc1cccc(NC(=O)c2ccccc2)c1	784003066	POSJKHNJNNTCOB-UHFFFAOYSA-N	449.423	1.048	50	20	IDGD	
CCNC(=O)COc1ccc(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2Cl)cc1	784391487	KSBRRRDHPQVBFX-UHFFFAOYSA-N	435.824	1.845	50	20	IDGD	
O=C(NNc1ccc(OC(F)(F)F)cc1)C(=O)Nc1cccnc1N1CCOCC1	784802160	UFJONVXKGZTPSR-UHFFFAOYSA-N	425.367	1.899	50	20	IDGD	
O=C1C[C@@H](Cc2ccc(NC(=O)C(=O)NNc3ccc(Br)nc3)cc2)C(=O)N1	784813031	QFAUMBBWEVEYCF-LLVKDONJSA-N	446.261	1.131	50	20	IDGD	
COc1cccc(NNC(=O)C(=O)Nc2cccc(F)c2I)n1	784846117	KZASUHPUABSABJ-UHFFFAOYSA-N	430.177	1.916	50	20	IDGD	
Cc1ccc(F)c(NNC(=O)C(=O)Nc2ccc(CC(=O)N3CCN(C)CC3)cc2)c1	784885361	SFMCVMRPTMCWLJ-UHFFFAOYSA-N	427.480	1.532	50	20	IDGD	
CCOC(=O)C(C)(C)n1cc(NC(=O)C(=O)NNc2nc(C(F)(F)F)cs2)cn1	785147756	RGEMQDMBPSWPAC-UHFFFAOYSA-N	434.400	1.738	50	20	IDGD	
COc1cc(CC(=O)NNC(=O)COc2ccc(Br)cc2)cc(OC)c1O	789869364	NOLICSFTFACMQG-UHFFFAOYSA-N	439.262	1.941	50	20	IDGD	
O=C(Cc1cc(F)c(Cl)cc1[N+](=O)[O-])NNC(=O)C1CCN(c2ncccn2)CC1	790553813	IMPHUZGKWALKAC-UHFFFAOYSA-N	436.831	1.784	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)NCc2cc(C(F)(F)F)cc(S(C)(=O)=O)c2)n1	790847425	VATSWDSDZHEWFR-UHFFFAOYSA-N	430.408	1.957	50	20	IDGD	
CSCCONC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	793433878	PMMITQVNFPGKFP-UHFFFAOYSA-N	438.531	1.404	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)c3cccc(C)n3)CC2)c(C)c1	794081691	PCMQNQPIKCAPDT-UHFFFAOYSA-N	430.530	1.869	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2cccc(C#N)c2)cc(Br)cc1[N+](=O)[O-]	797535974	URJFNRBUAGNHSN-UHFFFAOYSA-N	446.217	1.937	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)CC(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)cc1F	798307663	DQVNQSLROMOJSW-UHFFFAOYSA-N	449.460	1.205	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNS(=O)(=O)c2ccc(C(=O)N(C)C)cc2)cc1	799519153	PSGMTEYKGSRHRR-CQSZACIVSA-N	435.502	1.564	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)NCCNS(=O)(=O)c2ccc(Cl)cc2F)c1	799666610	NXDVGDFHACIZSS-UHFFFAOYSA-N	444.872	1.870	50	20	IDGD	
CC1(C)CN(Cc2ccccc2)CC[C@H]1NC(=O)NNC(=O)CNC(=O)c1ccco1	801006155	SGKWNESISZSZQB-GOSISDBHSA-N	427.505	1.641	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(CS(=O)(=O)C(F)F)cc2)cc1	801108302	KLYXOBRNDAALLY-UHFFFAOYSA-N	425.413	1.532	50	20	IDGD	
CCCN(C(=O)CCC(=O)C(C#N)=C1N(C)c2ccccc2N1C)[C@H]1CC(=O)N(C)C1=O	801508664	XZARUGSPKJDFKK-SFHVURJKSA-N	437.500	1.653	50	20	IDGD	
CCC1(CC)NC(=O)N(CC(=O)NNC(=O)Nc2ccc(Br)cc2)C1=O	801999106	UFWFSTFOFFAKAS-UHFFFAOYSA-N	426.271	1.712	50	20	IDGD	
COc1ccc(C2=NO[C@@H](CNC(=O)NNC(=O)COc3ccc(F)cc3)C2)cc1F	802348310	ULCQZOFCTBSXJF-OAHLLOKOSA-N	434.399	1.876	50	20	IDGD	
CC(C)CC(=O)NNC(=O)NC[C@@H](N1CCN(C(=O)OC(C)(C)C)CC1)C(F)(F)F	802466407	YCOZBWSWNQQUID-CYBMUJFWSA-N	439.479	1.847	50	20	IDGD	
COC(=O)c1c(F)cc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)on2)cc1F	802566429	PNORBGSTQYSMDP-UHFFFAOYSA-N	444.350	1.806	50	20	IDGD	
C[C@H](C(=O)NNC(=O)c1csc(N2CCOCC2)n1)n1ccc2ccccc2c1=O	806338954	VUQYDWAEFUFZSY-CYBMUJFWSA-N	427.486	1.317	50	20	IDGD	
CC(C)CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)NNC(=O)c1cc(-c2cccs2)[nH]n1	810584258	BIHCFGLJRFFWTK-CQSZACIVSA-N	429.506	1.396	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(Br)cc1)NNc1ncnc2ccsc12	810594716	NHQFEUIQWJGSCO-UHFFFAOYSA-N	442.320	1.875	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)CNS(=O)(=O)c1ccc(C)c(C)c1	810791636	LAXRDSFSHNHNPM-UHFFFAOYSA-N	437.543	1.530	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCc2nnc(C)s2)c1	812484819	AQIYVLQFZMWDHU-UHFFFAOYSA-N	440.551	1.064	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)c2nccn3c(Br)cnc23)cc1	812730727	UMRFYCOIMLWTBQ-UHFFFAOYSA-N	439.295	1.499	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)Nc2ccc(CCS(C)(=O)=O)cc2)cc1	812955579	KIKWUDHFUYVBLB-UHFFFAOYSA-N	440.547	1.673	50	20	IDGD	
CCC(=NNC(=O)Cn1c(=O)c2c(ncn2CC)n(Cc2ccccc2)c1=O)c1ccco1	814745964	LRIKHXMESYMJMF-UHFFFAOYSA-N	448.483	1.951	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2nnn(CCOc3ccc(F)cc3)c2C)nc(C)n1	815587842	VIHWMPMDBSSTAI-UHFFFAOYSA-N	428.428	1.293	50	20	IDGD	
Cn1ncc(I)c1C(=O)NNC(=O)c1cnn(-c2ccccc2)c1	815599997	IGLXTAMSQMHUQW-UHFFFAOYSA-N	436.213	1.285	50	20	IDGD	
N#CCCSc1ccc(C(F)(F)F)cc1NC(=O)C(=O)NNC(=O)[C@H]1CCCO1	815778794	GGDUIKPPSBQMHJ-GFCCVEGCSA-N	430.408	1.976	50	20	IDGD	
COC(=O)c1ccc(C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)[nH]1	815827783	OFWPIDGSFMWMNJ-UHFFFAOYSA-N	433.896	1.034	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(/C#N)C(=O)OCC(=O)NC2CCN(C(C)=O)CC2)c1C	897620469	OXVLVVYADIVZDA-VBNMEBLOSA-N	444.532	1.890	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)C1CCCC1)N(S(C)(=O)=O)CC2	913161253	GACSTXNFRDYNCH-INIZCTEOSA-N	439.534	1.290	50	20	IDGD	
CCCc1ccc(N2C[C@@H](C(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)CC2=O)cc1	914279603	ALTDOJFESXSUEP-INIZCTEOSA-N	447.495	1.700	50	20	IDGD	
COc1nn(C)c2nc(C)c(CCC(=O)NNC(=O)[C@H]3COc4ccccc4O3)c(C)c12	914747936	WTRBZCCLMGSSJZ-QGZVFWFLSA-N	439.472	1.514	50	20	IDGD	
O=C(Cn1cnc2ccccc21)NNC(=O)C1CCN(C(=O)COc2ccccc2)CC1	914846477	LROCWGFOFCKVKU-UHFFFAOYSA-N	435.484	1.501	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)[C@@H](Cc2ccc(F)cc2)n2nnnc2C)c1	915695592	VDHGKNFFYXEGRJ-LJQANCHMSA-N	426.452	1.748	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)N[C@H](C)c2cccc(S(N)(=O)=O)c2)c1C	916196647	BUZCJHNPNQGPAV-HUUCEWRRSA-N	434.518	1.810	50	20	IDGD	
CO[C@H](CNC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1)c1ccccc1	916271785	CJDGRWFGFCBBRD-GOSISDBHSA-N	434.518	1.334	50	20	IDGD	
O=C(NCCNS(=O)(=O)c1cccc(Cl)c1)NNC(=O)c1cccc(Cl)c1	916294694	FNWZUQZPUFEWDF-UHFFFAOYSA-N	431.301	1.916	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNS(=O)(=O)c2cc(F)ccc2[N+](=O)[O-])cc1	917725389	NODHZBZSMJRUFO-NSHDSACASA-N	427.410	1.910	50	20	IDGD	
CCCC(=O)N1CCC[C@@H](C(=O)OCC(=O)NNC(=O)c2ccc(OC)c(OC)c2)C1	919613274	CEABWAHFYFIJOT-OAHLLOKOSA-N	435.477	1.047	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)NCCS(=O)(=O)c1ccc(Cl)cc1	919785886	MMQJXNSCOYJOQT-UHFFFAOYSA-N	429.857	1.662	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)c1csc(N2CCOCC2)n1)COCc1ccccc1	919799491	PCXPEXPFNMJXSU-OAHLLOKOSA-N	433.534	1.777	50	20	IDGD	
C[C@@H]1CN(Cc2cccc(CNC(=O)NNC(=O)[C@H]3COc4ccccc4O3)c2)CCO1	920236723	GBSZIBWEIQJQKW-IIBYNOLFSA-N	440.500	1.578	50	20	IDGD	
O=C(NNc1ncccn1)c1cc(S(=O)(=O)N2CCCCC2)ccc1N1CCOCC1	920447502	JPHLFXLUONWJDB-UHFFFAOYSA-N	446.533	1.245	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)NCc2cccc(C(F)(F)F)c2)ccc1O	921296984	APYJVCDQUDDULL-UHFFFAOYSA-N	447.391	1.890	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)c1cc([N+](=O)[O-])ccc1N1CCOCC1	934898732	ODCSRCGPZPSAFY-UHFFFAOYSA-N	438.400	1.155	50	20	IDGD	
CS(=O)(=O)Nc1cccc(F)c1CNC(=O)NNC(=O)c1cnn(-c2ccccc2)c1	1319050373	IAJMMUYXYOOLPK-UHFFFAOYSA-N	446.464	1.527	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)COCCNC(=O)c2ccccc2)CC1	1320154609	UBHURHHFZMQCCT-UHFFFAOYSA-N	448.520	1.228	50	20	IDGD	
CC[C@@H](N=c1nn[nH]n1-c1ccccc1)C(=O)NNC(=O)Nc1ccc(OC(F)F)cc1	1340043102	RYPPGURRSJQHAG-OAHLLOKOSA-N	446.418	1.729	50	20	IDGD	
O=C(NCc1cccc(OCC(F)(F)F)n1)NNC(=O)c1nnc(O)c2ccccc12	1344003310	QHIGXGCWZXWBEF-UHFFFAOYSA-N	436.350	1.816	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3nn(C)c4c3CCC4)C2)C1	1777963964	ATOFERRKKFGBTP-XIKOKIGWSA-N	425.327	1.136	50	20	IDGD	
COc1ccc2c(/C=C/C(=O)N3CC[C@@]4(C3)CN(C(=O)[C@H](O)CCl)CCO4)c[nH]c2c1	1778118866	YOUUYMWSEVFIGV-YEWIQJOJSA-N	447.919	1.619	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cccn4cncc34)C2)C1	1778688837	QMNZFFQCJMOKRX-BEFAXECRSA-N	435.322	1.951	50	20	IDGD	
Cn1ncc(C(=O)N2CCO[C@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)c1C(F)(F)F	1779295678	AFTCEJFWRGNHOI-KRWDZBQOSA-N	448.518	1.734	50	20	IDGD	
C[C@@H]1CCC[C@H]1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1	1779372210	BQZLQAGCEQQZAO-ZYFHCTRVSA-N	443.548	1.249	50	20	IDGD	
O=C(c1cc(Br)ccc1O)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1780556687	NPXVPNLKNKFOFH-YOEHRIQHSA-N	447.713	1.198	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](N)Cc1cscn1)C2	1780702497	JDHGWKUPVCKAPK-YYAJDYIMSA-N	428.986	1.544	50	20	IDGD	
Cn1c(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](F)Br)C2)cccc1=O	1780770827	DXMBFMPXRKGICN-DDUZABMNSA-N	444.301	1.203	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](NC(C)=O)c3ccc(F)cc3)C2)C1	1780910709	LVVHZYLMBYRFCS-LVCYWYKZSA-N	439.915	1.850	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2)c1cc(O)c(O)c(Cl)c1	1781119134	ALFIXMXKIHDCGU-QMTMVMCOSA-N	447.315	1.478	50	20	IDGD	
O=C(CCc1ccc(F)cc1)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2	1782028076	BOVOMLNXMVUURG-DBXWQHBBSA-N	426.916	1.872	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccnc4ncccc34)C2)C1	1782342211	SXECHTCIIGYDRJ-BFUOFWGJSA-N	433.306	1.857	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCn2cncn2)C1	1782452847	TTWUVPLXPAKRND-ZTFGCOKTSA-N	432.352	1.418	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cn4ncccc4n3)CCO2)C1	1783347997	RHWARAHLDJHPRD-SCLBCKFNSA-N	436.310	1.346	50	20	IDGD	
O=C(C(Cl)Cl)N1CC[C@]2(C1)CN(C(=O)[C@@H]1ON=C(c3ccccc3)O1)CCO2	1783946114	IMTBQGCQDGCCJW-ROUUACIJSA-N	428.272	1.355	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)c1cnc(OCF)cn1	1785685957	IOSFFULXJQQDPR-OBJOEFQTSA-N	445.289	1.161	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3n[nH]c(C4CC4)c3F)C[C@@H]21	1786400871	CDROKSFVBBLSQH-AVGNSLFASA-N	443.317	1.805	50	20	IDGD	
Cc1nnc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Br)C[C@@H]32)s1	1787057626	FSSRFLQTMHFEGS-AYGWYOGXSA-N	435.319	1.059	50	20	IDGD	
C=CC[C@@H](C(=C)C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21	1788524476	GKEGXVRCWMGFCU-FVCZOJIISA-N	441.532	1.047	50	20	IDGD	
CN(C)c1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]3C2)cn1	1789870257	BFORUJMRMTUUGF-ULMVMLMRSA-N	443.375	1.977	50	20	IDGD	
Cn1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]3C2)c(C(F)F)n1	1791294829	PPZLYDINOYUHFU-QXEWZRGKSA-N	425.263	1.755	50	20	IDGD	
CCOC(CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)CBr)C[C@@H]21)OCC	1791417422	DIIMWHCRVITDFU-VGWMRTNUSA-N	449.386	1.786	50	20	IDGD	
CC(C)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCNC(=O)c1ccccc1)C2	1792786147	QYFGFHFMSBEWCV-IZZQQSIFSA-N	435.952	1.661	50	20	IDGD	
Cc1ccc2c(/C=C/C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@@H](O)CCl)c[nH]c2c1	1792983550	OHAWDRQKELWQFW-RNNGLFPASA-N	431.920	1.679	50	20	IDGD	
COC[C@H](C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN(C)NC(=O)NCc1ccccc1)C2	1793672789	VARVXDBTUBQWKE-FFGOWVMKSA-N	445.564	1.253	50	20	IDGD	
Cc1ccc(OCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)Br)C3)cc1	1795308068	AIZQCIVFZMTTPX-ZXFNITATSA-N	425.323	1.747	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)n1cccc1C=O	1795752072	FMQBVKHMMZGMTO-IPVBOJNNSA-N	426.311	1.235	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)c1c(F)ccnc1Cl	1796190775	KWBQBWMTNCALHE-QDMKHBRRSA-N	431.660	1.120	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1Cc2ccccc2O1	1797226867	DPYUQVLVPJPYAJ-JAPOXJDPSA-N	437.334	1.753	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCNC(=O)c1ccccc1)C2	1797959424	QVQMYPOOBIIWOD-RMFSNUHRSA-N	447.608	1.248	50	20	IDGD	
Cn1nc(C(F)(F)F)cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(C)(C)CCl)C2	1798187035	DKUQJRHWWKBBAN-GNXNZQSNSA-N	436.862	1.907	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(-n2cccn2)nc1	1798212916	JKGHMRCFFVKZNW-XEMDLRDOSA-N	443.580	1.322	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cc1ccc3c(c1)CCO3)C2	1798442753	BRKXFNODYNIDHC-BCDXTJNWSA-N	449.511	1.115	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1CC(O)C1)C2	1799219292	IYWDFGUPAHLSAW-ZTPJQAPRSA-N	431.445	1.543	50	20	IDGD	
COc1ccc(F)c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Br)c1	1799352327	QLLWXQYSLJNNKQ-ANGCBRKESA-N	433.249	1.728	50	20	IDGD	
CCN(CC)C[C@@H](C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)CBr)C2	1800218284	NQUKZWYHCWRCOB-NNXHMXCWSA-N	432.403	1.585	50	20	IDGD	
COc1ccc([C@@H](O)C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)Br)cc1	1800753998	CJIMNDRQGCNDIK-BQHCWPDZSA-N	441.322	1.102	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1cccc(C#N)c1)C2	1800754215	JFJIWEOPOQTSLS-KUZCPNRJSA-N	434.334	1.864	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CCc2nc[nH]c2C1	1801270782	SGKDLZSENGYFTJ-NLIDSEJHSA-N	439.354	1.278	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1Cc2ccccc2N1	1801410940	YOORIFZRMFOSMG-ZCHQYYIMSA-N	448.527	1.795	50	20	IDGD	
COc1ccc(F)cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2	1801727957	HJLVNXUFIKVQCL-ANGCBRKESA-N	433.249	1.728	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)c1cc(F)ccc1C(F)(F)F	1801861741	WIPOZCZGHIJDFZ-ANGCBRKESA-N	438.805	1.647	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(CO)c(F)c1	1801898817	JJDKVEWLBDCZKF-FIUQPQMISA-N	443.313	1.552	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](O)CCl)C2	1801995529	WWKZQQZAZFPDEX-JKJDWNRSSA-N	429.945	1.624	50	20	IDGD	
CC(C)(CCl)C(=O)NC[C@@H]1CCN(C(=O)[C@H]2CCCS2(=O)=O)[C@H]1c1cccnc1	1802901996	IJFDDZXFQQZYOY-BBWFWOEESA-N	441.981	1.930	50	20	IDGD	
COCCOCC(=O)N1CC[C@H](CNC(=O)[C@H](C)CBr)[C@H]1c1cccnc1	1803007379	CAKBGUXDTWAACZ-QGPMSJSTSA-N	442.354	1.781	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2nccnc2OC)[C@@H]1c1cccnc1	1804979806	CPGSWJZQGXHBEL-VYDXJSESSA-N	433.896	1.454	50	20	IDGD	
C[C@H](O)C(=O)N1CCC2(CCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)CC1	1806760974	SAULEKUJBWBLHQ-GJZGRUSLSA-N	431.961	1.731	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)CCc2cnn(C)c2)[C@@H]1c1cccnc1	1807430928	DQQRUIUEYKDHBO-HBFSDRIKSA-N	433.940	1.708	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1CCN(C(=O)[C@@H]2CCC(=O)N2)[C@H]1c1cccnc1	1808296572	SCGWNIVGEBFRFR-PWDMQXDWSA-N	427.332	1.602	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@H]1CCN(C(=O)[C@@H]2C[C@H](O)CN2)[C@@H]1c1cccnc1	1808306146	ZJMGQFQDVJMRMB-TVEAVKIZSA-N	429.348	1.047	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)Cn2nccn2)[C@H]1c1cccnc1	1808959397	DYNAKUYRVLUCIO-YQQAZPJKSA-N	435.326	1.553	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@@H](O)C(=O)N1CCC2(CCCN(C(=O)[C@@H](F)Cl)C2)CC1	1810902579	KUFVBWHPLLUBJF-ZIAGYGMSSA-N	435.924	1.638	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)c2c[nH]c(=O)cn2)[C@H]1c1cccnc1	1811458030	FJTPXWTXYCRCJH-GRDNDAEWSA-N	448.321	1.658	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)CCC(N)=O)[C@H]1c1cccnc1	1812779267	QWLFIGMZEWZMDY-ZQIUZPCESA-N	425.327	1.526	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)CN2CCCCC2=O)[C@@H]1c1cccnc1	1812976013	APVGYXTXFHKZRN-UWVAXJGDSA-N	436.940	1.354	50	20	IDGD	
CC1=C(C(=O)N2CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)CCO1	1813069871	AKQPSPMFBKJFKB-UTKZUKDTSA-N	429.521	1.155	50	20	IDGD	
NC(=O)c1ncccc1C(=O)N1CC[C@@H](CNC(=O)C(Cl)Cl)[C@H]1c1cccnc1	1813078658	VGBODKDKHNMUTL-SWLSCSKDSA-N	436.299	1.699	50	20	IDGD	
C[C@H](C(=O)NC[C@@H]1CCN(C(=O)CO[Si](C)(C)C)[C@@H]1c1cccnc1)n1cncn1	1813402464	QRMDXVCDEWOPCL-HHXXYDBFSA-N	430.585	1.792	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)[C@H]2CCCS2)[C@H]1c1cccnc1	1813615322	FPTLPPZUKPHYAZ-MBOZVWFJSA-N	433.578	1.356	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)CSC(=N)N)sc2C1	1814730864	WKNLGHQGEPXGEU-SFYZADRCSA-N	434.385	1.855	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)/C=N/O[C@@H]2CCCCO2)[nH]n1)[C@H](O)CCl	1814872715	KAVKKAWMROTBOP-VAUGABELSA-N	427.889	1.531	50	20	IDGD	
COCCOCCOCCC(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](O)CCl)n[nH]1	1814877730	JMEYOYJFHLQGPV-JKSUJKDBSA-N	446.932	1.071	50	20	IDGD	
O=C(/C=C/c1cccnc1)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1815960055	NKZNUKQFKKLCDY-SQUSKLHYSA-N	445.288	1.504	50	20	IDGD	
Cc1ccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)nc1	1816542994	HCLSECIMLSPQSP-QGZVFWFLSA-N	427.509	1.792	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1	1817470198	KXKVLLPPADBXNW-RDJZCZTQSA-N	432.717	1.803	50	20	IDGD	
Cc1c(C(=O)N2CCCC[C@H]2c2cc(NC(=O)[C@@H](F)Cl)n[nH]2)cn2[nH]cnc(=O)c12	1818041663	UFVGGZQVSQQFHP-SWLSCSKDSA-N	435.847	1.894	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CC(C)(C)O)[nH]n1	1818112236	XKFOZNVUXDWVHG-CBFMJHRQSA-N	443.508	1.697	50	20	IDGD	
CC(C)CCC(=O)N[C@@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1	1819800945	VOUPXVVKHXHUTE-GFCCVEGCSA-N	430.534	1.804	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1)c1nn[nH]c1C(F)(F)F	1820323574	PVTSTWYJIUNVEY-RKDXNWHRSA-N	435.794	1.452	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1ccccc1F	1820409451	WZLWKXKETCDNCA-IBGZPJMESA-N	436.252	1.848	50	20	IDGD	
COC(=O)C1(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@H](C)Br)CC3)CC1	1825281906	LVDOJJXGYFQAMX-IUCAKERBSA-N	430.324	1.792	50	20	IDGD	
Cc1noc(CC(=O)N[C@@H]2CCc3nc(NC(=O)[C@@H](C)Br)sc3C2)n1	1825642876	WHROSTCUDXEZRQ-VXNVDRBHSA-N	428.312	1.773	50	20	IDGD	
COc1ncccc1C(=O)N[C@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1	1826080413	JGEHCPWYRPTKOU-LBPRGKRZSA-N	446.533	1.146	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CN(C)C)CC1	1826426482	YFIAHBNNOQWAQN-JWGRYVKWSA-N	430.553	1.302	50	20	IDGD	
CC(=O)C(C)(C)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827055531	BGWWCCDCNGYXQQ-HXUWFJFHSA-N	428.338	1.215	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3noc4c3CCCC4)C2)C1	1830358455	VQKJHIPUCCMQDO-NRFANRHFSA-N	439.940	1.888	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C#CC3(O)CCCCC3)C2)C1	1831650908	MDWXEVJZWWNEAI-PGRDOPGGSA-N	440.968	1.549	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2c[nH]c(=O)cn2)CC1	1831661396	QRKGBQYMXASIKL-WFASDCNBSA-N	425.327	1.787	50	20	IDGD	
C=C[C@H](O)C(C)(C)C(=O)N1CCC([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1	1831873108	AJLXEDQWYWJXDI-MOPGFXCFSA-N	436.597	1.552	50	20	IDGD	
C[C@@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)c3ncn(C)n3)CC2)CC1	1833262547	UYCIBDVKVSCYSB-ZDUSSCGKSA-N	441.374	1.031	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)C(F)(F)C(F)F)CC2)CC1	1833649778	UUWXYQXFWWMROL-CYBMUJFWSA-N	431.858	1.712	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3sc(C)nc3C)CCO2)C1	1834079409	KEBHEQPOLYAZNB-KSSFIOAISA-N	431.942	1.084	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC(N2CCC(NC(=O)CN3CCCCC3)CC2)CC1	1834613036	CXSFXFCMTQCMSM-UHFFFAOYSA-N	438.689	1.895	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)c1ccn2ccnc2c1	1835573068	IOUMFNSLARQTIS-GOSISDBHSA-N	433.940	1.119	50	20	IDGD	
CC(C)(C)CC(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1	1835736975	OJYXPTZAWOKHEU-UHFFFAOYSA-N	444.580	1.307	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC1CCN(C2CCN(C(=O)c3ccncn3)CC2)CC1	1836398552	UBWWPWHCLAXELH-LJQANCHMSA-N	428.364	1.898	50	20	IDGD	
O=C([C@H](O)CCl)N1CCC(OC2CCN(C(=O)[C@@H]3Cc4ccccc4N3)CC2)CC1	1836719369	QKXPGUYZLLZTCE-VQTJNVASSA-N	435.952	1.622	50	20	IDGD	
N#Cc1ccccc1OCC(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836720120	JFRRPIYVBBSTHX-LJQANCHMSA-N	449.935	1.535	50	20	IDGD	
O=C(Cc1cnccn1)N1CCC(OC2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1836775187	HNOTYTKVLDIHKI-QGZVFWFLSA-N	443.317	1.708	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)c3ccnc(F)c3)CC2)CC1	1836975014	OPIATSQEYWJEQE-UHFFFAOYSA-N	449.527	1.206	50	20	IDGD	
Cc1cccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)c1	1838940740	WVHIYHQQUWRFSX-MAUKXSAKSA-N	429.286	1.756	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)OC(=O)NC(C)C)CCO2	1839073722	CXJHMJSHLIUPKG-MGPUTAFESA-N	447.960	1.373	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3cccnc3OC)C2)C1	1839142682	VWUPSZLSMKJZOM-DYESRHJHSA-N	439.940	1.497	50	20	IDGD	
Cc1nc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)cs1	1839197939	NICBICRHMRSILJ-WFASDCNBSA-N	436.303	1.212	50	20	IDGD	
O=C(C[C@@H]1CCCCO1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839198988	PSNRINWWYJHEQC-JLJPHGGASA-N	437.306	1.093	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3c(C)n[nH]c3C)CCO2)C1	1839238315	GMPFMQIBGOGBKL-XLIONFOSSA-N	426.945	1.433	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCBr)C3)C2)ccc1F	1839319264	APPZKKSIWZQVKJ-LJQANCHMSA-N	443.313	1.989	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cccc3nccn13)CCO2	1839552197	NAHDUTILFQQXET-NRFANRHFSA-N	446.580	1.256	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ncoc3C)C2)C1	1839966247	ZBJSOPPTVWIZOY-GUYCJALGSA-N	430.299	1.227	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)/C=C/c3cccc(C)n3)C2)C1	1840149722	YWIDHBXYFCDGMX-ZETQTWJXSA-N	437.924	1.113	50	20	IDGD	
O=C(CCOc1ccccc1)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840187917	FBGSESOWPWNDBS-IBGZPJMESA-N	431.316	1.716	50	20	IDGD	
O=C(Cc1cc(F)ccc1F)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840190121	GHSYSMRUEGUCQA-GOSISDBHSA-N	437.270	1.767	50	20	IDGD	
CSc1ccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)cc1	1840302054	RXCJRBUGVYRDLJ-YLJYHZDGSA-N	442.965	1.007	50	20	IDGD	
O=C([C@H](F)Br)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CCCS1)CCO2	1840578701	BAQSBGYLWYEILB-TYNCELHUSA-N	425.320	1.029	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)c2ncc(Cl)cc2Cl)C1	1840999066	FROPXKPALHUAJF-UHFFFAOYSA-N	434.088	1.199	50	20	IDGD	
N#C/C(=C\c1ccc(Br)cc1)C(=O)N1CC2(CCCN2C(=O)C#CC(=O)O)C1	1846196805	RWRPJMACIRDOTB-XNTDXEJSSA-N	442.269	1.647	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)CCc2ccc(F)cc2)C1	1846209732	LWFMBQARXKEJDY-UHFFFAOYSA-N	425.464	1.274	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@H](C)NC(=O)c2ccc(Cl)cc2)cc(OC)c1OC	26687297	KHUUOALVZQCKHY-NSHDSACASA-N	435.864	1.945	50	20	IDGD	
Cc1sc2ncn(CCC(=O)NNC(=O)COc3ccc(C#N)cc3)c(=O)c2c1C	26693977	HYOCWNVBXOPHHM-UHFFFAOYSA-N	425.470	1.563	50	20	IDGD	
CC(C)(C)C1CCC2(CC1)NC(=O)N(CC(=O)NNC(=O)COc1ccc(F)cc1)C2=O	29459863	QNEZUASRTMEASV-UHFFFAOYSA-N	448.495	1.879	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)c2ccc(CC)c(S(=O)(=O)N3CCOCC3)c2)cc1	105855012	BTCXIIMRHPNHBE-UHFFFAOYSA-N	445.541	1.907	50	20	IDGD	
O=C(CC12C[C@H]3C[C@@H](CC(Br)(C3)C1)C2)NNC(=O)[C@@H]1CCS(=O)(=O)C1	302771755	ZGTIWIGOHSFREX-ZBVBZRCCSA-N	433.368	1.693	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cccn2C)cc1S(=O)(=O)N[C@H]1CCCC[C@H]1C	726540527	GXDCLDGQUPFRHR-ZBFHGGJFSA-N	448.545	1.966	50	20	IDGD	
COC(=O)N1CCC[C@H](NC(=O)NNC(=O)COc2ccc(Br)cc2)C1	726620257	VVJHYAPGNXAPHT-LBPRGKRZSA-N	429.271	1.389	50	20	IDGD	
COc1ccc(S(N)(=O)=O)cc1C(=O)NNC(=S)Nc1ccc(OC(C)C)cc1	727497338	NEDXFXXJFWRJDF-UHFFFAOYSA-N	438.531	1.761	50	20	IDGD	
Cc1nn(C)c(=O)c(C(=O)NNC(=O)COc2ccc(OCc3ccccc3)cc2)c1C	728160381	KPAARXBNKWJHHQ-UHFFFAOYSA-N	436.468	1.816	50	20	IDGD	
O=C(COC(=O)c1oc2ccccc2c1CO)NNC(=O)[C@@H]1COc2ccccc2O1	728344994	VLTCIDKDVKDFJW-KRWDZBQOSA-N	426.381	1.069	50	20	IDGD	
COc1ccc(CCC(=O)N2CCN(C(=O)NNC(=O)c3ccccc3OC)CC2)cc1	731500423	CSJXIMOEYOEBFZ-UHFFFAOYSA-N	440.500	1.835	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)NC2CCN(CCS(C)(=O)=O)CC2)c1C	731648830	VFRLKOUWTPYCRF-RGEXLXHISA-N	436.578	1.284	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NCc1ccc(OCCN2CCCC2)cc1	732244313	CWDJFEWVDTWBTP-UHFFFAOYSA-N	445.545	1.483	50	20	IDGD	
CCCS(=O)(=O)Nc1ccc(C(=O)NNC(=O)CCN2C[C@@H](C)O[C@H](C)C2)cc1	732262748	WAFHRLIPWASPAU-HUUCEWRRSA-N	426.539	1.099	50	20	IDGD	
Cn1c(N)c(C(=O)/C(C#N)=C\c2c(-c3ccccc3)nc3ccccn23)c(=O)n(C)c1=O	732578578	ROIGLZYPZLQAEO-QINSGFPZSA-N	426.436	1.771	50	20	IDGD	
CC(C)(C(=O)NNC(=O)NCC1CCN(S(=O)(=O)C(F)F)CC1)c1ccccc1	732997942	DJHKHURDIZTUGG-UHFFFAOYSA-N	432.493	1.559	50	20	IDGD	
CC(C)OCCCn1c(NNC(=O)c2cccc(-n3cnnn3)c2)nc2ccccc2c1=O	733265732	JHYYDCMUHZRZKL-UHFFFAOYSA-N	448.487	1.944	50	20	IDGD	
COc1cc(CCNC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)ccc1O	734219611	WJBHMSIVQPKAPF-UHFFFAOYSA-N	435.506	1.189	50	20	IDGD	
C[C@H](OC[C@H]1CCCCO1)C(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	734824840	JYVAKZZCVDDILW-GOEBONIOSA-N	428.530	1.691	50	20	IDGD	
Cc1ccccc1O[C@H](C)C(=O)N1CCN(CC(=O)NNC(=O)c2ccc(F)cc2)CC1	736620265	BNQOUBMAHYZCKL-QGZVFWFLSA-N	442.491	1.507	50	20	IDGD	
CN(C)c1nccc(NNC(=O)c2ccc(S(=O)(=O)NCc3cccs3)cc2)n1	740107026	ACPJMEFYGUTFKF-UHFFFAOYSA-N	432.531	1.840	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)[C@@H]1C[C@H]2CCCC[C@H]2N1C(=O)c1ccccc1	740853078	SVLQJXAQORBAHT-QRQLOZEOSA-N	428.533	1.912	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN(C(=O)COc2ccccc2)C1)c1ccc2c(c1)OCO2	741207426	XPUWSJBPXJTWFI-INIZCTEOSA-N	425.441	1.494	50	20	IDGD	
O=C(CN1C(=O)NC2(CCCC2)C1=O)NNC(=O)NCc1cccc(C(F)(F)F)c1	742457723	OFSGLYYMRNBVAM-UHFFFAOYSA-N	427.383	1.400	50	20	IDGD	
C[C@H](C(=O)NNc1c(F)cc(F)cc1Br)N1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O	744368536	ZTFLBMUEFZVRAZ-MNDVRHQKSA-N	444.232	1.721	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccc(Cl)cc3F)CC2)c1	744397049	YFCDWUZWFKXDSR-UHFFFAOYSA-N	443.866	1.570	50	20	IDGD	
O=C(CN1CCn2c(CCc3ccccc3)nnc2C1)NNC(=O)c1cccc(Cl)c1	746472492	QSRPFFJUGBFRQF-UHFFFAOYSA-N	438.919	1.994	50	20	IDGD	
COc1cc(C)nc(NNC(=O)[C@@H]2CCCN(S(=O)(=O)c3ccc(C)s3)C2)n1	746626111	WEMZUAGAOZKYBW-CYBMUJFWSA-N	425.536	1.708	50	20	IDGD	
COC(=O)Cc1cc(=O)n(-c2ccc(C(=O)NNC(=O)CCOc3ccccc3)cc2)[nH]1	747177429	AYCYGFMQPOYDET-UHFFFAOYSA-N	438.440	1.111	50	20	IDGD	
Cc1ccc(N(C)S(=O)(=O)c2cccc(C(=O)NNC(=O)C(=O)N3CCCC3)c2)cc1	748247386	ZHYMAAIWGKTEDF-UHFFFAOYSA-N	444.513	1.204	50	20	IDGD	
O=C(NNC(=O)[C@H]1CC12CCOCC2)c1cccc(S(=O)(=O)NCc2ccccc2)c1	748527246	KZIGJEYTILDPQP-LJQANCHMSA-N	443.525	1.743	50	20	IDGD	
O=C(COC(=O)c1ccc(C(=O)c2cc[nH]c2)cc1)NNC(=O)[C@@H]1COc2ccccc2O1	748902271	DPKUKJZTAHHPOK-IBGZPJMESA-N	449.419	1.390	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@@H]2CCC[C@@H]([S@](=O)CC)C2)c2ccccc2c1=O	750670839	NEWRFGKMOWDIOS-PWRODJMOSA-N	433.534	1.440	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NC[C@H]2CCC[C@@]23NC(=O)N(C)C3=O)ccc1OC(C)C	752023260	KIVCHLGIFPDWLG-SPLOXXLWSA-N	447.492	1.147	50	20	IDGD	
Cc1nn(-c2ccccc2)c(C)c1[C@H]1OCC[C@@H]1C(=O)NNC(=O)C(=O)N1CCCC1	752945742	VOUQJNZHEZXROY-HKUYNNGSSA-N	425.489	1.337	50	20	IDGD	
CO[C@@H]1C[C@@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)C1(C)C	753554937	FEDNZTKRJZIOGN-IAGOWNOFSA-N	438.550	1.619	50	20	IDGD	
C[C@H](CS(=O)(=O)c1ccc(F)cc1)C(=O)NNC(=O)c1cnn(-c2ccccc2)c1	755310717	SHXOWQNYUWOXNO-CQSZACIVSA-N	430.461	1.882	50	20	IDGD	
CN(CC(=O)OCC(=O)NNC(=O)c1ccc(Cl)cc1)C(=O)OCc1ccccc1	755690970	GFKWOWUIJIBSKE-UHFFFAOYSA-N	433.848	1.913	50	20	IDGD	
COC(=O)Nc1cccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1	756000937	NBXUYJMUHYJPPA-UHFFFAOYSA-N	435.462	1.582	50	20	IDGD	
NC(=O)c1ccc(F)c(NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c1	756066615	OMEUSERCBQGDNT-UHFFFAOYSA-N	428.468	1.290	50	20	IDGD	
COC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2ccccc2C)c1Br	756156048	ZVTFGKJSTHERQL-UHFFFAOYSA-N	434.246	1.944	50	20	IDGD	
CN(C1CCCCC1)S(=O)(=O)c1ccccc1NC(=O)NNC(=O)c1cnccn1	756563896	PKPNIFZJIJQVRH-UHFFFAOYSA-N	432.506	1.896	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2ccc(O)c(Cl)c2)cc1	756783714	HRUFVXZQGDXEOX-UHFFFAOYSA-N	442.881	1.437	50	20	IDGD	
Cn1cc(Br)cc(NC(=O)NNC(=O)c2cc(Br)c[nH]2)c1=O	757597983	KGDSVBGRWUNURP-UHFFFAOYSA-N	433.060	1.705	50	20	IDGD	
Cn1cc(-c2cccc(C(=O)N3CCN(S(=O)(=O)CBr)CC3)c2)cn1	758534852	KIMXKLIQWFOMAD-UHFFFAOYSA-N	427.324	1.527	50	20	IDGD	
O=C(NCc1cccc(Cn2cnc3ccccc32)c1)NNC(=O)C(=O)Nc1ccccn1	758736846	KLCUTFZCODDHNQ-UHFFFAOYSA-N	443.467	1.949	50	20	IDGD	
CN(NC(=O)c1ccc2c(c1)CCC(=O)N2)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758782621	UFEGDMXGBIDCRU-UHFFFAOYSA-N	431.493	1.821	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)C2CCN(S(=O)(=O)c3ccccc3F)CC2)nc1	759725605	UCHWPVIHFDVCEC-UHFFFAOYSA-N	436.465	1.551	50	20	IDGD	
CCn1c(=O)n(CC)c2nc(NC(=O)CCC(=O)NNC(=O)c3ccccc3C)ccc21	760211930	UFHLPYNYPYBICQ-UHFFFAOYSA-N	438.488	1.726	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)NC2CCCCC2)c(OC)c1	761267302	QDXVFIRBHJOHDV-UHFFFAOYSA-N	434.540	1.282	50	20	IDGD	
C[C@H](C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1)c1cccc([N+](=O)[O-])c1	762087392	OVQZGFSHUOMNOI-INIZCTEOSA-N	439.472	1.304	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)c2ccc(OC)c(S(=O)(=O)N3CCCC3)c2)n1	762912787	LNQAVIVLENINQM-UHFFFAOYSA-N	448.549	1.873	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)C(=O)Nc1cccc(-c2noc(C3CC3)n2)c1	763442054	KUZRBUKXTWMBEP-UHFFFAOYSA-N	436.384	1.922	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(-n2cnc3ccccc32)nc1	763467837	TXAMNCYQKGEOPS-UHFFFAOYSA-N	445.395	1.728	50	20	IDGD	
Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)C(=O)NNC(=O)c1ccccn1	763468274	VXSFQJSDGGVYIC-SFHVURJKSA-N	447.499	1.433	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cccnc2)c(OCC(F)(F)F)c1	763489234	XQYQDSPWKJNSTK-UHFFFAOYSA-N	440.334	1.209	50	20	IDGD	
CCOC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)cc1	763538625	FFAICXZDQSXXHD-UHFFFAOYSA-N	445.428	1.289	50	20	IDGD	
COC(=O)c1cc(OC)c(OC)cc1NC(=O)C(=O)NNC(=O)c1c[nH]c2ccccc12	763540534	HQFIDPHAZUCCOJ-UHFFFAOYSA-N	440.412	1.371	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)ccc1C(=O)NC(C)C	763547498	CMSMBCLMMOVASM-UHFFFAOYSA-N	426.429	1.262	50	20	IDGD	
COC(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)COc2cc(C)cc(C)c2)c1	763643248	AHOBBTBHSHRVRS-UHFFFAOYSA-N	433.848	1.908	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2ccccc2C(=O)N2CCCC2)c1	763647186	KPIKSQMDIIWPMA-UHFFFAOYSA-N	438.484	1.704	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)C(=O)Nc1ccc(C(F)(F)F)cc1	763802783	GUYVVYGDSIPZEV-UHFFFAOYSA-N	426.307	1.779	50	20	IDGD	
COCCOc1ncccc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1cccc(C)c1C	763839357	FVAWDHAPYWFUPJ-HNNXBMFYSA-N	430.461	1.277	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)oc(=O)n2C	763855340	VNPFFQFXDBSIGI-ZDUSSCGKSA-N	448.435	1.838	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccccc1O[C@@H]1CCOC1	763866626	XBJRFUFOKRHXPR-UONOGXRCSA-N	431.420	1.547	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccnn1CCc1ccccc1	763871220	FLTVXIFULZGWGP-OAHLLOKOSA-N	439.447	1.818	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cncc(Br)c2)cc1	763877970	NEJSBHLDFNNKNX-LLVKDONJSA-N	449.261	1.600	50	20	IDGD	
CCOC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccc(F)cc2)cc1C#N	763920001	XSSNTKHCVXVELY-UHFFFAOYSA-N	427.392	1.594	50	20	IDGD	
C[C@@H]1CCC2=S=C(C(=O)NNC(=O)C(=O)Nc3ccc(-c4ncon4)cc3)C=C2C1	763941279	KEYZYBBXKKEYIN-LLVKDONJSA-N	425.470	1.661	50	20	IDGD	
CCOc1ccc(OC)cc1NC(=O)C(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	763945352	WWXHSGWWCNZQFA-UHFFFAOYSA-N	439.428	1.385	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1ccc(OCC(F)(F)F)nc1	764003799	JKKWRHXCAIHSEA-UHFFFAOYSA-N	440.334	1.194	50	20	IDGD	
COC(=O)c1ccc(C(F)(F)F)cc1NC(=O)C(=O)NNC(=O)c1ccc(C)cc1O	764104741	DXPBZZHEKOBJML-UHFFFAOYSA-N	439.346	1.906	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1cccn(Cc2ccccc2)c1=O	764138636	GDOJOHPNEULJOV-UHFFFAOYSA-N	434.452	1.234	50	20	IDGD	
C[C@H](c1cccc(NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)c1)N1CCOCC1	764152366	DKSRJVHRUOFRMC-FOIQADDNSA-N	438.484	1.169	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2O1)C(=O)Nc1cccc(OCc2cscn2)c1	764164443	PPINXPCRKZYGRJ-SFHVURJKSA-N	438.465	1.812	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)C(=O)Nc1ccc(-n2nccc2C(F)(F)F)cc1	764268195	ZMABPXBYNYGYHA-UHFFFAOYSA-N	432.362	1.615	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)C(=O)Nc1ccc(-c2nnc3n2CCCCCC3)cc1	764296619	BWYVZRJOLOQLPZ-UHFFFAOYSA-N	436.476	1.493	50	20	IDGD	
CCc1cc(NNC(=O)c2cc(S(=O)(=O)NCCOC)c[nH]2)nc(-c2ccccn2)n1	764322662	SUVQVWNXBMWGKD-UHFFFAOYSA-N	445.505	1.111	50	20	IDGD	
CC(C)(C)OC(=O)Nc1ccc(C(=O)NNC(=O)CNC(=O)c2cccnc2)c(O)c1	764341301	FWBZGEKVBXYHAU-UHFFFAOYSA-N	429.433	1.325	50	20	IDGD	
C[C@@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)COCc3ccccc3)cc2)CCO1	764365863	FYFGRRIJVPQNLU-MRXNPFEDSA-N	426.473	1.214	50	20	IDGD	
C#CCOc1ccc(F)cc1NC(=O)C(=O)NNC(=O)c1cc(-c2cccs2)[nH]n1	764382725	QNPKUKQLDHAUIN-UHFFFAOYSA-N	427.417	1.689	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2cccs2)[nH]n1)C(=O)Nc1cnc(-c2ccccc2)nc1	764384926	MYYAZCONQMYEHW-UHFFFAOYSA-N	433.453	1.995	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1cccc(C#N)c1)C(=O)NNC(=O)c1cc(-c2ccccc2)on1	764635085	ISSLYPNLDKDDJQ-CYBMUJFWSA-N	439.453	1.341	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)c3cc(C)ccc3F)CC2)cc1	765727765	IDIQEYANNCLUIP-UHFFFAOYSA-N	448.520	1.210	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1cccc(OC(F)F)c1	765733960	TVOOBKLHCDIWJV-UHFFFAOYSA-N	432.427	1.507	50	20	IDGD	
O=C(/C=C/c1cncc(F)c1)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	766660342	KHLUTUGPGOEEFU-AATRIKPKSA-N	431.899	1.853	50	20	IDGD	
CC(=O)N[C@@H](C(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1)C1CCCC1	766664846	WBLFUAZCTZMNBC-OAQYLSRUSA-N	449.983	1.300	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)c1ccc(-n2ncc(C#N)c2N)cc1	767290719	IIDZAWRHFUISNO-UHFFFAOYSA-N	432.440	1.182	50	20	IDGD	
COc1ccc(-c2ncc(C(=O)NNC(=O)CNC(=O)c3cccnc3)s2)cc1OC	768233530	SVBRFXCBMYZOKN-UHFFFAOYSA-N	441.469	1.413	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)c(Cl)c1)C(=O)Nc1cc(C2CC2)nn1-c1ncccn1	768241774	JCXKNNIHOZJMPC-UHFFFAOYSA-N	441.835	1.298	50	20	IDGD	
O=C(NNc1ccc([N+](=O)[O-])cc1)c1ccc2c(c1)S(=O)(=O)N(C[C@H]1CCCO1)C2=O	768255318	NRENXDHPPPBJHZ-OAHLLOKOSA-N	446.441	1.675	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)[C@H]3CCCN3C(=O)Cc3ccccc3)nc21	770965678	MPWNPOBTYHCLSD-MRXNPFEDSA-N	437.504	1.964	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)N[C@@H]2CCO[C@@]3(CCOC3)C2)nc1	771435343	QUYIYOHAUMRTQF-KDOFPFPSSA-N	427.527	1.076	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2O)cc1	771861423	XNARYCBKLGKLCA-UHFFFAOYSA-N	428.430	1.796	50	20	IDGD	
O=C(Cc1ccsc1)NNC(=O)C(=O)Nc1ccc(I)cn1	773535964	XRJVQBIZDSZKRL-UHFFFAOYSA-N	430.227	1.076	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)NCCc2cncn2C)cc1	773823029	HKQVMKSWQXMWGL-GZTJUZNOSA-N	447.499	1.433	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccnn2C)c1	775753586	UBDUCTCVAIEQPH-UHFFFAOYSA-N	444.473	1.696	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)F)cc1)Nc1ccnn1[C@H]1CCS(=O)(=O)C1	776052965	CDCUTVVQGRLLBU-NSHDSACASA-N	449.461	1.388	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)c2cc(S(N)(=O)=O)ccc2Br)c1	776537486	JOVMHNWLOWXNHS-UHFFFAOYSA-N	448.320	1.257	50	20	IDGD	
O=C(CSc1ccc(F)c(F)c1)N1CCN(S(=O)(=O)CBr)CC1	777836319	ILIRHAAFYUHRQL-UHFFFAOYSA-N	429.308	1.883	50	20	IDGD	
Cn1cc(S(=O)(=O)N2CCOCC2)cc1C(=O)NNc1ccccc1OC(F)(F)F	779209292	KCWIRVVOQLCXDU-UHFFFAOYSA-N	448.423	1.702	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@@H](C(=O)NNC(=O)c2ccc3ccccc3c2)[C@@H](C)O)cc1	779500089	LEIULDDZNIBAJP-FOIQADDNSA-N	441.509	1.637	50	20	IDGD	
CCOC(=O)N1CCC([C@H](C)NC(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)CC1	779675483	XCMWMXCNYCAPJE-HNNXBMFYSA-N	433.509	1.829	50	20	IDGD	
O=C(NCC[C@@H]1CCCCO1)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	780906040	BVDAWKYXCNZRIC-KRWDZBQOSA-N	438.550	1.764	50	20	IDGD	
C[C@H]1C[C@H](C(=O)NNc2ncncc2Cl)[C@H](C(=O)NNc2ncncc2Cl)C1	781835923	BWPOSBFLHIMZRS-OWUUHHOZSA-N	425.280	1.822	50	20	IDGD	
COc1ccc(Br)c(C(=O)NCCCNS(=O)(=O)CBr)c1	782439465	KZUABTSRFLEKGC-UHFFFAOYSA-N	444.145	1.849	50	20	IDGD	
Cc1ccc(C(=O)NC2CC2)cc1NC(=O)C(=O)NNC(=O)Cc1nc2ccccc2n1C	782884634	GZUJBPCJEMPIGN-UHFFFAOYSA-N	448.483	1.103	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNc2ncccc2C(F)(F)F)cc1	783119940	MKJOXFSUFRLMCE-UHFFFAOYSA-N	431.396	1.944	50	20	IDGD	
Cc1cc(C)cc(NNC(=O)C(=O)Nc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1	783359407	OOMNJTMHQFIZTG-UHFFFAOYSA-N	432.502	1.406	50	20	IDGD	
C#CCOc1ccc(F)cc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	784210520	SEVOOLPJVFPCHM-UHFFFAOYSA-N	446.460	1.360	50	20	IDGD	
Cc1nc(Br)ccc1NC(=O)C(=O)NNc1cccc(S(C)(=O)=O)c1	784838972	BYQVYZCHPSEOAR-UHFFFAOYSA-N	427.280	1.638	50	20	IDGD	
O=C(NNc1cc(Cl)ccn1)C(=O)Nc1ccccc1OCC(=O)N1CCOCC1	784860437	FWNZKEDKJJDGMU-UHFFFAOYSA-N	433.852	1.054	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)COc1cccc(I)c1	785280989	ATVRLRBKHQNYJC-LLVKDONJSA-N	448.257	1.795	50	20	IDGD	
COC(=O)c1scc(C)c1NC(=O)C(=O)NNc1c(OC)cccc1S(C)(=O)=O	785330083	DISRMDYYLORIAD-UHFFFAOYSA-N	441.487	1.337	50	20	IDGD	
COCCOc1ccc(F)cc1S(=O)(=O)NNC(=O)C(=O)Nc1ccc(C)c(C)c1	786724744	QNUVLBYEUCXKRX-UHFFFAOYSA-N	439.465	1.416	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN1C1CC1)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	786825357	CSTDUDMKRPJNPJ-HXUWFJFHSA-N	431.500	1.776	50	20	IDGD	
Cn1c(=O)nc(O)c2c(C(=O)NNc3nnc(-c4ccccn4)s3)cc(C3CC3)nc21	788566400	DKGPWHCVKFQBMO-UHFFFAOYSA-N	436.457	1.582	50	20	IDGD	
CC[C@@H](C)C(=O)NNC(=O)C(=O)Nc1cc(Br)cc(C(=O)N2CCCC2)c1	790952755	UTHUZFDDZPGCAK-LLVKDONJSA-N	439.310	1.817	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)c2cc(NS(C)(=O)=O)cc(C(F)(F)F)c2)c1O	792633150	PGBQTNCEIJQHEY-UHFFFAOYSA-N	447.391	1.866	50	20	IDGD	
COc1cc(CC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)ccc1C	793029280	SOAIOHHDCBZSMY-UHFFFAOYSA-N	431.514	1.792	50	20	IDGD	
C[C@]1(C(=O)NNC(=O)CNC(=O)c2cccnc2)CCN(C(=O)OCc2ccccc2)C1	795180863	FPWRGPYKSNPJKV-QFIPXVFZSA-N	439.472	1.008	50	20	IDGD	
CC(C)Oc1ccc(NC(=O)NNC(=O)CNC(=O)OCc2ccccc2)cc1C(N)=O	797677196	LLNARDDVUKQSOM-UHFFFAOYSA-N	443.460	1.652	50	20	IDGD	
CN(CCO)S(=O)(=O)c1ccc(C(=O)NNc2ccc(Br)c(F)c2)cc1	798339849	KBZSTVVPLPCHAV-UHFFFAOYSA-N	446.298	1.958	50	20	IDGD	
COCc1nc(C(=O)NNC(=O)CNC(=O)c2cccnc2)c(-c2ccccc2)s1	799841354	QKSSVMSIQQSJKW-UHFFFAOYSA-N	425.470	1.543	50	20	IDGD	
CCOC(=O)C1=NN(c2ccccc2)[C@H](C(=O)NNC(=O)Nc2ccc3c(c2)OCO3)C1	802105845	IPIKAIBBKCNMOY-INIZCTEOSA-N	439.428	1.766	50	20	IDGD	
COc1ccc(Cl)c(NC(=O)NNC(=O)c2ccc(CN3C(=O)CNC3=O)cc2)c1	802108417	NQKZXMLKFCATKR-UHFFFAOYSA-N	431.836	1.867	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)NC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1	802329897	OFKXTIGBEFLWAR-OAHLLOKOSA-N	426.429	1.230	50	20	IDGD	
C[C@@](O)(CSc1cccc(F)c1)C(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	803397243	RHTMCUANOYUJNW-GOSISDBHSA-N	441.506	1.925	50	20	IDGD	
O=C(NNc1ccc2c(=O)[nH]ccc2c1)c1ccc(F)c(S(=O)(=O)N2CCOCC2)c1	803431488	AHWPNMXXAQIYKQ-UHFFFAOYSA-N	446.460	1.445	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)C(=O)Nc1cccc(Cl)c1OCC(F)F	807004804	VZZAFCOPNJXQER-UHFFFAOYSA-N	444.778	1.093	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2c(C)nc3ccccn23)cc2[nH]ccc12	808934453	GGEFGWRJYFWDQR-UHFFFAOYSA-N	434.412	1.310	50	20	IDGD	
O=C(COC(=O)C1(S(=O)(=O)c2ccc(Cl)cc2)CC1)NNC(=O)c1ccccc1	812746478	BIFYSWPPSPEMNL-UHFFFAOYSA-N	436.873	1.651	50	20	IDGD	
COC(=O)c1cn(-c2cccc(NC(=O)NNC(=O)c3cnn(-c4ccccc4)c3)c2)nn1	812977918	WTNNZSYTWTZDST-UHFFFAOYSA-N	446.427	1.706	50	20	IDGD	
CCOC(=O)Nc1scnc1C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	813363623	NPYZEXIPRZCMPS-UHFFFAOYSA-N	446.533	1.685	50	20	IDGD	
CCNC(=O)NNC(=O)[C@@H]1C[C@@H](O)CN1C(=O)OCC1c2ccccc2-c2ccccc21	813424665	SWBRBOXPVIXTCJ-VLIAUNLRSA-N	438.484	1.721	50	20	IDGD	
CNC(=O)CCOc1ccc(NC(=O)NNc2ccccc2S(=O)(=O)N(C)C)cc1	814633758	JWTTYYDLIAFMSN-UHFFFAOYSA-N	435.506	1.600	50	20	IDGD	
CCOc1nc2ccc(C(=O)OCC(=O)NNC(=O)c3ccc(OC)c(OC)c3)cc2[nH]1	815442563	QDNZLWVRNZAOMC-UHFFFAOYSA-N	442.428	1.597	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1c[nH]nc1-c1ccccc1	815751810	OZTBGLWDVSJPGN-UHFFFAOYSA-N	428.474	1.409	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCO1)C(=O)Nc1cccc(COCCOc2ccccc2)c1	815778304	KYJRKDOCANTGHX-LJQANCHMSA-N	427.457	1.547	50	20	IDGD	
COC(=O)c1ccc(C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)n1C	815826850	CUMVYQLKJZQMIB-UHFFFAOYSA-N	447.923	1.044	50	20	IDGD	
Cn1ncc(C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)c1I	815887655	PABPKIKFQNEVLF-UHFFFAOYSA-N	442.242	1.551	50	20	IDGD	
Cc1nnnn1/C(=C\c1ccc(F)cc1)C(=O)NNC(=O)[C@@H](C)Oc1ccccc1F	818029942	RQDJIPZOHODQME-ZSAINHDTSA-N	428.399	1.873	50	20	IDGD	
Cc1cccc(-n2ncc(C(=O)NNC(=O)c3csc(N4CCOCC4)n3)c2C)c1	828750106	NPSLWNDKCBYXNP-UHFFFAOYSA-N	426.502	1.857	50	20	IDGD	
C[C@H](NS(=O)(=O)c1ccc(Cl)cc1)C(=O)OCC(=O)NNC(=O)c1cccs1	834694861	LDBDUEIAAONYIP-JTQLQIEISA-N	445.906	1.073	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)CNS(=O)(=O)c2cccc(F)c2)c(C)n1-c1ccccc1	913419479	NYBJEDKWOCEQRP-UHFFFAOYSA-N	444.488	1.973	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)N2CCN(C(=O)NNC(=O)c3ccccc3)CC2)cc1	913632688	PHWYOKMSADSHBR-UHFFFAOYSA-N	430.486	1.250	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N[C@@H](CCSC)C(=O)NNC(=O)C2CCCC2)cc1	914849123	POUNGYPWUPUZOR-KRWDZBQOSA-N	443.591	1.823	50	20	IDGD	
CCOc1ccc(/C=C(/C#N)C(=O)N2CCN(c3ccc(S(N)(=O)=O)cc3)CC2)cc1	915290778	QZCDSWHAOAJMOL-SDXDJHTJSA-N	440.525	1.988	50	20	IDGD	
CCCC[C@H](CC)CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	915879176	CXBZLHHCIAXLEE-INIZCTEOSA-N	440.566	1.868	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@H]2CC2(Cl)Cl)c1	915908504	RSPUZTUUFGADCL-GFCCVEGCSA-N	437.349	1.855	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCCSCc2ccccc2C#N)c1	915927182	OIHARYVCFXAGTK-UHFFFAOYSA-N	432.527	1.839	50	20	IDGD	
CS(=O)(=O)NCCNC(=O)NNC(=O)CCCOc1ccc(Cl)cc1Cl	916294844	IVSVJLKPTNSLBC-UHFFFAOYSA-N	427.310	1.032	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)CN(C)C(=O)c1ccc(Br)o1	917390471	LNDPBEDPJXRDPS-SNVBAGLBSA-N	442.241	1.868	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)c3nc(S(C)(=O)=O)n4ccccc34)cc2C1	920274914	HTYKZIVAHQYGFN-LLVKDONJSA-N	432.527	1.999	50	20	IDGD	
O=C(NNc1cccc(Br)c1)C1=NN([C@H]2CCS(=O)(=O)C2)C(=O)CC1	932478667	IXEAUDRJTMGHPW-LBPRGKRZSA-N	429.296	1.058	50	20	IDGD	
CN(CCO)S(=O)(=O)c1ccc(C(=O)NNc2ccc(OCC(F)(F)F)cc2)cc1	1325107538	JACVGAFRYDXFJN-UHFFFAOYSA-N	447.435	1.997	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCCNS(=O)(=O)c2ccc(Cl)s2)cc1	1335451429	QHYXNXMHVIUBLG-UHFFFAOYSA-N	432.911	1.333	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)[C@@H]1CC12CCS(=O)(=O)CC2	1340640293	ZGUBPAUQLAWSKE-ZDUSSCGKSA-N	431.308	1.190	50	20	IDGD	
COc1ccc2c(/C=C/C(=O)N3CC[C@@]4(C3)CN(C(=O)[C@@H](O)CCl)CCO4)c[nH]c2c1	1778118860	YOUUYMWSEVFIGV-FESIQLCVSA-N	447.919	1.619	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnc4[nH]ncc4c3)C2)C1	1778413321	OYNTWBSSUHWBDW-KZULUSFZSA-N	436.310	1.432	50	20	IDGD	
C/C(=C\c1ccc(C)o1)C(=O)N1CC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1	1779155783	HMLIICRJWZQXJS-ANCZKMTESA-N	432.521	1.194	50	20	IDGD	
Cc1nc2sccn2c1C(=O)N1CCO[C@@]2(CCN(C(=O)CO[Si](C)(C)C)C2)C1	1779297202	VLSBYTSRDYTQJZ-LJQANCHMSA-N	436.610	1.999	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)c3cc4cc[nH]c4cc3F)C2)C1	1780161731	CCJBBTDRTBNOLF-JOCHJYFZSA-N	445.495	1.124	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(OC)n(C)n2)C1	1780241545	TYBJYQMXCHNVLH-AKCHCHLHSA-N	426.945	1.964	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCn1ccnn1)C2	1780714346	AQJBOHISEGZICW-FHLIZLRMSA-N	432.352	1.418	50	20	IDGD	
C[C@H](Cn1cccn1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Br)C1	1780770998	OTEQXYNIAUHOBK-ZXFNITATSA-N	445.333	1.724	50	20	IDGD	
O=C(c1n[nH]c2ccccc12)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781331356	IYVWZOSMWCHKKQ-PBHICJAKSA-N	425.258	1.697	50	20	IDGD	
O=C(c1cc2cn[nH]c2cn1)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781331517	MBZJRNCZYRVNFY-CZUORRHYSA-N	426.246	1.092	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)n2ccnn2)C1	1781552141	JFWRVJVAFGFMLB-ZOMKSWQUSA-N	428.331	1.136	50	20	IDGD	
C[C@H](Cc1ccc(F)cc1)C(=O)N1CC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1	1782928612	JOQRZCVHGNUPEK-UZUQRXQVSA-N	448.539	1.207	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cnnc(Cl)c3)CCO2)C1	1783345196	YGZKAYZGZLKAPF-LRDDRELGSA-N	431.718	1.747	50	20	IDGD	
CCCC(=O)N[C@H](C)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](Br)CC)C2)C1	1783348932	DIVVESWBVVUWKJ-GLJUWKHASA-N	432.359	1.295	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3c(O)cc(O)cc3O)CCO2)C1	1783353476	OUDOIQLXNWGGES-SGTLLEGYSA-N	443.294	1.420	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)C3=NO[C@@H](c4ccccc4)C3)CCO2)C1	1783874032	BLHSQVMZRKNDLW-CDXJDZJCSA-N	435.908	1.588	50	20	IDGD	
O=C(c1nnc(-c2ccccc2)o1)N1CCO[C@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783946826	UNSNPLCBCCRYAF-SFHVURJKSA-N	425.272	1.984	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccncc3F)C[C@@H]21	1783965273	GPFSFIMIRCRQJK-DSPQJCBJSA-N	428.302	1.845	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(=O)n3C)C[C@@H]21	1783969014	IHVBNYRIZQIAGU-HOSILWTGSA-N	440.338	1.010	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(OC)nc3)[C@H]2C1	1784764747	LLQHYWPNIJOFQR-VGWMRTNUSA-N	440.338	1.857	50	20	IDGD	
COc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]32)n(C)n1	1785615451	LYBVXAWZVRUFSK-MMNXLFCMSA-N	433.336	1.258	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ncc(Cl)cn3)[C@H]2C1	1785821027	LBACJKCZILOQJJ-PYERRIOISA-N	435.739	1.960	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc4sccn4c3)[C@H]2C1	1787275051	BFKOGENMUUJKQO-TUUVXOQKSA-N	425.938	1.848	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ncccc3Br)C[C@@H]21)[C@H](F)Cl	1787448077	UFXJZDVCJIQZCD-WRZDFSGXSA-N	434.693	1.972	50	20	IDGD	
Cc1noc(C)c1CC(=O)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1	1788144898	AGUXBGHOYSCYPR-UHFFFAOYSA-N	447.300	1.962	50	20	IDGD	
Cc1ncc(C(=O)NC2(c3ccc(NC(=O)c4cnccc4C(=O)NN)cc3)CCC2)[nH]1	1789519905	QNWSFTXORRVVPA-UHFFFAOYSA-N	433.472	1.778	50	20	IDGD	
Cc1nn(C)c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]3C2)c1F	1789922351	KULFIAULMKMIAD-AYGWYOGXSA-N	435.269	1.151	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]3C2)cc1O	1789923342	GQKMQECYKCLYNY-DARAHFNDSA-N	429.286	1.984	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)NC(=O)OC(C)(C)C)[C@H]2C1	1790173594	DSWATPQEWDNCCW-JBXGNFEISA-N	447.960	1.217	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)Cc3ccccc3)[C@H]2C1	1790957042	PIJCXLWMRVXZLY-SOADLSRISA-N	443.371	1.806	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4n(n3)CCC4)C[C@@H]21	1790960343	BXZNDHJCUMUFOX-QEWYBTABSA-N	439.354	1.596	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]2C1	1791063641	OMJZYTZUIPVQCG-MOLYVOAJSA-N	440.176	1.923	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4nccnc4c3)C[C@@H]21	1791253539	DOAZIHWVEBSPSB-FPXQBCRKSA-N	432.908	1.477	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(C)n(C(F)F)n3)C[C@@H]21	1791254214	QEMXQBVXOOOHTA-ABHRYQDASA-N	434.871	1.434	50	20	IDGD	
CCC[C@H](NC(C)=O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](Br)CC)C[C@@H]21	1792188408	GFSIUTNAZMZNMP-WOYTXXSLSA-N	446.386	1.444	50	20	IDGD	
CC(C)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2	1792786578	QRBTZSAYQLDVAZ-ZYBHWSPSSA-N	438.908	1.671	50	20	IDGD	
Cc1c(F)ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)CBr)c1N	1792867796	LDDUBZTVFWZMFP-AKENFEQQSA-N	442.329	1.951	50	20	IDGD	
CCOC(=O)O[C@@H](C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)CBr	1792872127	NDMPUIGXWIPRLG-YHQUGGNUSA-N	435.315	1.169	50	20	IDGD	
CN(C)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2	1794470081	ANURQSFQMBIDSN-FVCICTRLSA-N	425.327	1.136	50	20	IDGD	
C=CCCc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](Cl)COC)C3)c(O)n1	1794490941	PIBUPWVWTFDZQT-DACLVMHWSA-N	437.924	1.363	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](CN)c1ccccc1	1795676009	XDVJOKSQYYJWMA-WFNPHZEWSA-N	428.360	1.555	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1n[nH]c2c1CC[C@H]2C	1796973445	CQXZWQLCDKPIPX-XRHZXQNYSA-N	425.327	1.446	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cn(C)c2ncccc12	1797577573	MDAXVPFSEWTQFD-DLTLXFJOSA-N	449.349	1.950	50	20	IDGD	
O=C(C#CC1(O)CCCCC1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2	1797781551	PCEHKRRJRIVDKP-JLVBRIDZSA-N	427.339	1.060	50	20	IDGD	
COc1ccnc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)CBr)C3)c1	1798102170	NLKKSEJEKHWNHV-JFILPPLUSA-N	426.311	1.324	50	20	IDGD	
CSc1ncccc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2	1798330221	YDLLSTCCAGQBNO-JJLQDPRZSA-N	428.352	1.792	50	20	IDGD	
Cn1ncc2c(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3cnccc3C(=O)NN)cccc21	1798440523	ODDYNCOEKOCHCQ-QDMKHBRRSA-N	447.499	1.137	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)COc1ccccc1F)C2	1798442832	INBQPRQXGNKHSF-QDMKHBRRSA-N	441.463	1.155	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cncnc1)C2	1799220098	OHSSDAZHBKLFNP-MUJYYYPQSA-N	439.428	1.876	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(S(C)(=O)=O)ccc1F)C2	1799271805	CEYKUBIFADNXIR-DJZPMSPPSA-N	446.928	1.450	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(-c2cnco2)c1	1799647539	FFBOCNNFPBSHQK-ZMMAXQRCSA-N	433.892	1.799	50	20	IDGD	
CC(C)(C)CCCCCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2	1800668533	DODIWGURFAXFHA-HATOLVCRSA-N	444.381	1.566	50	20	IDGD	
O=C(CCc1cccc(O)c1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2	1801125207	HAIDIKPUOIQBAR-RMHZUWNSSA-N	429.286	1.605	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](O)CCl)C2	1801995530	WWKZQQZAZFPDEX-QRJUGERDSA-N	429.945	1.624	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)c2cc(O)ncn2)[C@H]1c1cccnc1	1803741504	ICVXXFCRSLWNEP-DETPVDSQSA-N	434.294	1.680	50	20	IDGD	
O=C(CCBr)NC[C@@H]1CCN(C(=O)Cc2ncccn2)[C@H]1c1cccnc1	1806341768	HFPQBYUWTZVSKG-KXBFYZLASA-N	432.322	1.905	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)CCc2cncnc2)[C@@H]1c1cccnc1	1807507587	GFZYKQKDAFTULA-HBFSDRIKSA-N	431.924	1.764	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H](CNC(=O)Cn2nccn2)[C@@H]1c1cccnc1	1808959394	DYNAKUYRVLUCIO-VYDXJSESSA-N	435.326	1.553	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)[C@@H](O)NC(=O)OCC)[C@H]1c1cccnc1	1810089506	JOFPTUBGMOPZJW-KYHPRHEASA-N	440.928	1.559	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@H]1CCN(C(=O)CN2CCOCC2)[C@@H]1c1cccnc1	1810540257	INEKGVPTVQMNCA-WIYYLYMNSA-N	434.613	1.271	50	20	IDGD	
COc1ccc(C(=O)NC[C@H]2CCN(C(=O)CCBr)[C@H]2c2cccnc2)nn1	1811205213	HWZFCYAPRXQXIS-KDOFPFPSSA-N	448.321	1.985	50	20	IDGD	
CC(=O)C(C)(C)C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1813069550	ZRMZLIGZUAAOCC-YLJYHZDGSA-N	431.537	1.076	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)CCn2ccnn2)[C@H]1c1cccnc1	1813435434	GPHYIDLYPYLMOW-YSVLISHTSA-N	435.326	1.553	50	20	IDGD	
CC(C)[C@@H](S)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1815243269	IQLCNNFXCIYQFK-NVXWUHKLSA-N	445.549	1.669	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)C[C@H](NC)C(=O)O)n[nH]1	1817368078	GWACFLNQPCOARC-WCFLWFBJSA-N	444.330	1.638	50	20	IDGD	
CC(=O)N1CCN(CC(=O)N2CCCC[C@H]2c2cc(NC(=O)[C@H](F)Cl)n[nH]2)CC1	1818039359	RWULLNIWPSUZAP-YOEHRIQHSA-N	428.896	1.100	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)Cn2cccc([N+](=O)[O-])c2=O)[nH]n1)[C@H](F)Cl	1818043212	IDNXZTQFQHOMQV-ABAIWWIYSA-N	440.819	1.706	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](COC(C)=O)OC(C)=O)sc2C1	1819861397	FIJTZEBAIAFRKQ-SGMGOOAPSA-N	445.925	1.567	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CN2CC(=O)NC2=O)[nH]n1	1820862896	WKUFSWGSDYIXCM-PIGZYNQJSA-N	445.307	1.190	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(F)c[nH]2)n[nH]1	1822238875	ZXQFCDKKNKTSKM-MRXNPFEDSA-N	440.439	1.495	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](N)Cc2cscn2)[nH]n1	1822368496	GBSXFEVUIJSOTH-VNHYZAJKSA-N	440.957	1.682	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H]2C[C@@]2(F)Cl)n[nH]1	1822503974	IAAQHJPTJPQMJJ-TVZGQMOCSA-N	449.874	1.639	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](O)CCl)CC2)c1cnc2c(c1)CCNCC2	1824635406	JWVUGFYGUHHUII-BBRMVZONSA-N	449.964	1.052	50	20	IDGD	
C=CCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCN2C(=O)OCc1ccccc1	1828551976	YLTSHQAEMJHEIF-GCJKJVERSA-N	449.935	1.614	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H](N)CCC(N)=O)CC1	1830316270	HLNXQIHNZDVZOW-QMTMVMCOSA-N	435.396	1.435	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)C3CCSCC3)C2)C1	1830545563	KWZLZYLGWKKTEZ-KBXCAEBGSA-N	449.411	1.617	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(OC)nc3)C2)C1	1831641205	XCGJEQXSGNQLLU-UZLBHIALSA-N	425.913	1.568	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cn3nc(C)cc3C)CCO2)C1	1833035354	BWCDHIRVZCVUPT-FXAWDEMLSA-N	426.945	1.364	50	20	IDGD	
COc1ccc(C(=O)N2CCC(N3CCC(NC(=O)[C@H](O)CCl)CC3)CC2)c(O)c1	1833313243	BQJFXCFFVLEMBT-LJQANCHMSA-N	439.940	1.186	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1)c1cccnc1	1834134818	GTMUHPMOULEVKJ-INIZCTEOSA-N	427.318	1.957	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CC(F)(F)F)CCO2)C1	1835336214	BLUFUVAYZYAATF-FZMZJTMJSA-N	431.249	1.569	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1)[C@H]1CCC=CO1	1835723161	XXOYVHSFXRRKBX-CVEARBPZSA-N	432.334	1.941	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)C(=O)Nc3cccnc3)CC2)CC1	1835803462	RLXDAMYPAYTBLS-SFHVURJKSA-N	435.956	1.609	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)C3CCC(CO)CC3)C2)C1	1837710132	KEJMAYWWCDDEMS-WIXQSORDSA-N	442.629	1.093	50	20	IDGD	
CSCC[C@@H](O)C(=O)N1CCC(OC2CCN(C(=O)CO[Si](C)(C)C)CC2)CC1	1838431973	HHOABLUMIXDWHY-GOSISDBHSA-N	446.686	1.951	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@H]3CCCN(C)C3)CC2)CC1	1838617699	ZTYYVUVRGDULHA-LPHOPBHVSA-N	429.989	1.581	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3c(F)cccc3F)CCO2)C1	1838864101	LSYJQPCRXFQUAQ-YJYMSZOUSA-N	432.851	1.289	50	20	IDGD	
O=C(c1cccc(F)c1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1838911278	JXBGJNMCBQGRIF-RHSMWYFYSA-N	433.249	1.586	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnn4c3CCC4)C2)C1	1839154716	VJRBBYGBSCSAPB-RBUKOAKNSA-N	445.347	1.136	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2	1839155379	RXHQLKZWPUPSLY-CQDKDKBSSA-N	446.169	1.463	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3CCSCC3)C2)C1	1839156258	JWNBBJJWYQUBMV-QZTJIDSGSA-N	439.405	1.822	50	20	IDGD	
O=C([C@H](F)Br)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)c3ccccc3)C2)C1	1839198626	LIGVRGROEHABJE-RVKKMQEKSA-N	447.276	1.844	50	20	IDGD	
Cc1cc(/C=C/C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)no1	1839200383	JPJNQDDYGSHOGZ-LUQLLCLNSA-N	446.273	1.143	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3coc(C)n3)C2)C1	1839963175	CBEDJFZJSRPBFK-GUYCJALGSA-N	430.299	1.227	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)C(C)(F)F)C2)C1	1840030635	QZZMHTGKICSUAW-SJKOYZFVSA-N	441.313	1.908	50	20	IDGD	
CNc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)cc1	1840032286	UAZBYRIWPARTAD-IFXJQAMLSA-N	440.338	1.582	50	20	IDGD	
Cc1cc(F)ccc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)Br)CCO2	1840036017	CIMSQONSFGOMHB-IFXJQAMLSA-N	443.313	1.988	50	20	IDGD	
CCc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](Cl)COC)CCO3)cc(C)n1	1840152769	SLTBNBVYNYOJNI-GHTZIAJQSA-N	439.940	1.276	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(F)cc(F)c3)C2)C1	1840154002	HVQMDKLLTPJFCA-LPHOPBHVSA-N	432.851	1.289	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@H]2C=C[C@H](NC(=O)OC(C)(C)C)C2)C1	1841922112	KRININJMBRNDCZ-PMPSAXMXSA-N	441.956	1.913	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCCC12CN(C(=O)c1cnc(N)s1)C2	1841924415	JTWBETGLZZZIBO-NSHDSACASA-N	443.957	1.674	50	20	IDGD	
CN(CC(=O)N1CC2(CCCN2C(=O)c2ccncc2)C1)NC(=O)NCc1ccccc1	1842396556	QDLWUTFQXROXQT-UHFFFAOYSA-N	436.516	1.245	50	20	IDGD	
COc1cc(C(=O)N2CCCC23CN(C(=O)[C@@H](C)Br)C3)c([N+](=O)[O-])cc1O	1844738159	PEKKKWSSYPMKKJ-SNVBAGLBSA-N	442.266	1.909	50	20	IDGD	
O=C([C@H]1CC(=O)N(C2CCCC2)C1)N1CC2(CCCN2C(=O)[C@@H](F)Br)C1	1845216511	UEBHZPRLQSPVMN-SWLSCSKDSA-N	430.318	1.671	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@H]2CCCN2C(=O)OC(C)(C)C)C1	1846202453	JOVBDQVLNWNJKF-GJZGRUSLSA-N	429.945	1.843	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC2(CCCN2C(=O)CCOCCOCCOC)C1	1846249404	JSKJLUKQIYLLLV-HNNXBMFYSA-N	435.359	1.433	50	20	IDGD	
C=CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)[C@H](Cl)COC)C1	1846360548	SNPPXWAUIDEQSN-CABCVRRESA-N	429.945	1.913	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@H](Cc1cccc(F)c1)NC(C)=O)C2	1846365668	NMJBZDUDKBTBNX-MSOLQXFVSA-N	439.915	1.330	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CCc1cccnc1C	1848120326	QIDJZJOPFYEDSM-FMEPYYHXSA-N	436.516	1.658	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)c2ccccc2c1=O	14708210	YZRZFWLKEMTKGB-UHFFFAOYSA-N	440.456	1.907	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc2[nH]c(=O)c(=O)[nH]c2c1)c1cc2c(s1)CCCCC2	23371802	PDPJWYMNNPLVGJ-UHFFFAOYSA-N	434.499	1.170	50	20	IDGD	
CC(=O)N[C@@H](C)C(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccc(C)cc2C)c1	28616013	YJFBTNUIVOMGPT-AWEZNQCLSA-N	432.502	1.390	50	20	IDGD	
C[C@H](NC(=O)c1ccc(Br)s1)C(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	108110443	GMHIHBPQCSZWFZ-QMMMGPOBSA-N	441.263	1.998	50	20	IDGD	
Cc1cc(C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)ccc1N1CCNC1=O	110887622	UAHOOLAXUBWMPW-UHFFFAOYSA-N	429.502	1.722	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)CCN3S(C)(=O)=O)cc1C	726281399	QAAOGSYZIHFFLM-UHFFFAOYSA-N	430.486	1.025	50	20	IDGD	
COc1cc(C(=O)NNC(=S)Nc2ccc(OC(C)C)cc2)ccc1OCC(N)=O	727494878	FMEHDNOSNNFEDU-UHFFFAOYSA-N	432.502	1.978	50	20	IDGD	
CC(C)Oc1ccc(NC(=S)NNC(=O)c2cnc3c(c2)c(=O)n(C)c(=O)n3C)cc1	727500646	XRHDNFJJANTXRT-UHFFFAOYSA-N	442.501	1.051	50	20	IDGD	
COc1ccccc1C(=O)N[C@H](CCS(C)(=O)=O)C(=O)NNc1cc(C)ccc1C	728058812	ONWCICSMPDEMAW-QGZVFWFLSA-N	433.530	1.988	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)Cc2ccc(S(N)(=O)=O)s2)c1	728527989	WLDSYBLUEYPXQB-UHFFFAOYSA-N	448.320	1.170	50	20	IDGD	
Cc1nc2[nH]n(C)c(=O)c2c(C)c1CC(=O)NNC(=O)c1ccc(Br)s1	730104607	VAEPAYVHOOGFGS-UHFFFAOYSA-N	438.307	1.706	50	20	IDGD	
C[C@@H](NC(=O)NN[C@]1(C)CCS(=O)(=O)C1)c1cc(F)ccc1N1CCC(O)CC1	730677358	IFZFLDDGLHUIGA-BFUOFWGJSA-N	428.530	1.229	50	20	IDGD	
Cn1c(=O)c2ccc(C(=O)NNc3nc(-c4ccc(Cl)cc4)no3)nc2n(C)c1=O	732976947	SZRJFFSMVAYIPI-UHFFFAOYSA-N	427.808	1.093	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)Cn1c(O)nc2ccccc2c1=O	734250693	FLBAZMITMJEIFC-UHFFFAOYSA-N	445.501	1.322	50	20	IDGD	
CCCn1nc(C(=O)NNS(=O)(=O)CCOc2ccc(F)cc2)c2ccccc2c1=O	736418199	AEFJGHGLKYFTHS-UHFFFAOYSA-N	448.476	1.589	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)[C@H](C)N2C(=O)[C@H]3CCCC[C@@H]3C2=O)cc1C	736758021	RWOZWZCIVWFMCJ-IHRRRGAJSA-N	449.529	1.487	50	20	IDGD	
CN(CC(=O)NNC(=O)Cn1ccc2ccccc21)S(=O)(=O)c1cccc([N+](=O)[O-])c1	737542966	PMGKPUWBIIMDHC-UHFFFAOYSA-N	445.457	1.018	50	20	IDGD	
COc1ccccc1-c1nn(C)cc1C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	740657334	BWFLVHRDLMOAQE-UHFFFAOYSA-N	435.488	1.563	50	20	IDGD	
CC[C@H]1CCC[C@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)C1	741093027	JNBXPZMBXCGZBT-RDJZCZTQSA-N	438.550	1.620	50	20	IDGD	
Cc1nn(CCCl)c(C)c1C(=O)NC1CCN(S(=O)(=O)c2cnn(C)c2)CC1	741204503	JQGCSQNKDRXJRA-UHFFFAOYSA-N	428.946	1.055	50	20	IDGD	
COc1ccc(-c2n[nH]c(CNC(=O)NNC(=O)c3cnn(-c4ccccc4)c3)n2)cc1	741416592	RCPJHYXZWQBJHI-UHFFFAOYSA-N	432.444	1.810	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)[C@@H](c1ccc(Cl)cc1Cl)N1CCOCC1	742696877	DIALCCTXHLLLSM-MRXNPFEDSA-N	445.347	1.819	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCCCOC2CCOCC2)cc1Br	743606387	YSZCZRSDYAAFTB-UHFFFAOYSA-N	430.299	1.987	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CN2CCC[C@@H](NS(=O)(=O)c3cccc(F)c3)C2)c1	744397146	BUXSCHWVDZDFFP-GOSISDBHSA-N	448.520	1.338	50	20	IDGD	
CCO[C@H](C)c1noc(CN2CCN(CC(=O)NNC(=O)c3cccc(C)c3)CC2)n1	744412047	MNHHGWWUUFFMGZ-MRXNPFEDSA-N	430.509	1.054	50	20	IDGD	
CC(C)C(=O)N1CCC(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)CC1	744621856	RQAKWMGPIUKFEX-UHFFFAOYSA-N	438.550	1.045	50	20	IDGD	
O=C(NCCC(=O)N1CCN(c2ncccn2)CC1)NNC(=O)c1cccc2ccccc12	745795805	JNBDATNPELYHKA-UHFFFAOYSA-N	447.499	1.313	50	20	IDGD	
O=C(NNC(=O)N1CCOCC1)c1ccccc1SCc1nnnn1-c1ccccc1	745988199	VKIUTBUQNWUQQI-UHFFFAOYSA-N	439.501	1.641	50	20	IDGD	
CCOC(=O)C1(C(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)CC1	746102969	BVGTXCMUNAKEDY-UHFFFAOYSA-N	437.499	1.653	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2ccc3ccccc3c2)cc(S(N)(=O)=O)cc1[N+](=O)[O-]	746132095	LRXRUDPTIXPLFX-UHFFFAOYSA-N	428.426	1.779	50	20	IDGD	
Cc1nc2ccc(C(=O)OCC(=O)NNC(=O)[C@@H]3COc4ccccc4O3)cc2nc1C	746177328	BSSCHOUOSAAGIV-IBGZPJMESA-N	436.424	1.391	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)NCCc2ncc[nH]2)cc1	746243582	XSUIXRSMIBFWOR-FOWTUZBSSA-N	433.472	1.423	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)NCC(=O)N1CCC(Cc2ccccc2)CC1	746775530	GFGXKLMXMHNKKX-UHFFFAOYSA-N	449.511	1.749	50	20	IDGD	
COc1cc(OC)cc(C(=O)N2CCC(C(=O)NNC(=O)Cc3ccncc3)CC2)c1	747324791	OXCGVPOMGZYBGT-UHFFFAOYSA-N	426.473	1.341	50	20	IDGD	
COC(=O)c1cn(CC(=O)NNc2nc3ccccc3c(=O)n2-c2cccc(C)c2C)nn1	747392573	JIDIGLSZZGOVGB-UHFFFAOYSA-N	447.455	1.524	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)CN2C(=O)CCOc3ccccc32)cc1	747533729	QGBWNSMGKIAXAM-OAHLLOKOSA-N	427.457	1.816	50	20	IDGD	
COc1ccc(CN2C(=O)c3ccccc3C2=O)cc1C(=O)NNC(=O)c1cccn1C	747599371	UNMYJWLJDFPQAV-UHFFFAOYSA-N	432.436	1.905	50	20	IDGD	
CCOc1ccc(S(=O)(=O)Nc2ccc(C(=O)NNc3nccn(C)c3=O)cc2)cc1	747943272	TXXHWMFGSGTTSN-UHFFFAOYSA-N	443.485	1.737	50	20	IDGD	
COc1cc(NC(=O)c2ccccc2)c(C(=O)NNC(=O)C(=O)N2CCCC2)cc1OC	748247890	ZCDMSUIAEGUMMW-UHFFFAOYSA-N	440.456	1.340	50	20	IDGD	
CS(=O)(=O)N1CCC(CNC(=O)NNC(=O)c2cc3c(s2)CCCCC3)CC1	748826991	APRXWFZSOKYDRV-UHFFFAOYSA-N	428.580	1.633	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)CNC(=O)CC1CCCCC1	748908334	QKVXGIXAWSZYQY-UHFFFAOYSA-N	439.896	1.739	50	20	IDGD	
C[C@H](Cn1cncn1)NC(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	749211197	LJVNRZWVIWQYOR-OAHLLOKOSA-N	446.475	1.013	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)C2(c3cccc(F)c3)CCC2)CC1	749536747	VLWCOKMHDQWFJG-UHFFFAOYSA-N	447.536	1.722	50	20	IDGD	
O=C(COC(=O)CCc1nnc(-c2ccccc2)o1)NNC(=O)c1cccc([N+](=O)[O-])c1	750492551	PUTDBLLVWVRMQS-UHFFFAOYSA-N	439.384	1.582	50	20	IDGD	
CSc1cccc(N2C[C@H](C(=O)NNC(=O)CNC(=O)c3cccs3)CC2=O)c1	751208170	ACHDSUAIIQQKJN-GFCCVEGCSA-N	432.527	1.400	50	20	IDGD	
CCOC(=O)[C@@H]1Cc2cc(S(=O)(=O)NNC(=O)c3cc4c(s3)CCC4)ccc2O1	751539437	YOPIREWWMZJULF-HNNXBMFYSA-N	436.511	1.727	50	20	IDGD	
COc1cc(OC)cc(N2C[C@H](C(=O)NNC(=O)COc3ccc(C)c(C)c3)CC2=O)c1	752399765	VYERWYQSWJAQJF-MRXNPFEDSA-N	441.484	1.900	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2ccc(COc3ccccc3)o2)cccc1S(N)(=O)=O	753908565	YKTJGRKQNPUUBI-UHFFFAOYSA-N	429.454	1.889	50	20	IDGD	
CCCCN(C)S(=O)(=O)c1ccc(NC(=O)NNC(=O)Cn2nc(C)cc2C)cc1	755452626	LHMMEDWOYIZFDB-UHFFFAOYSA-N	436.538	1.773	50	20	IDGD	
CCCCNS(=O)(=O)c1cccc(NC(=O)NNC(=O)c2cncc(NC(C)=O)c2)c1	755536669	QTIIBYDCSIPRQW-UHFFFAOYSA-N	448.505	1.585	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NN=CC1CCOCC1)N(S(C)(=O)=O)CC2	755573415	VUKKEBNNFTXGNX-QGZVFWFLSA-N	439.534	1.481	50	20	IDGD	
CCNC(=O)COc1cccc(NC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)c1	755656479	NJMNJORQPNJPCV-UHFFFAOYSA-N	438.444	1.559	50	20	IDGD	
Cc1nc2c(C(N)=O)cnn2c(C)c1CCC(=O)NNc1nc(C(F)(F)F)cs1	755855813	DWJCBCHRIFCWCS-UHFFFAOYSA-N	427.412	1.996	50	20	IDGD	
COC(=O)CNC(=O)Cc1ccc(NC(=O)NNC(=O)Cc2c[nH]c3ccccc23)cc1	755863812	VHBDPHSAIISLEY-UHFFFAOYSA-N	437.456	1.395	50	20	IDGD	
CCOc1ccc(C(=O)NNS(=O)(=O)c2cc(F)c(F)c(C(=O)OC)c2)cc1OC	755954459	BEWRPBWCPOPEGI-UHFFFAOYSA-N	444.412	1.782	50	20	IDGD	
COCCOc1c(Cl)cccc1NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	756246062	RUGFXRNUPBGDNJ-UHFFFAOYSA-N	431.840	1.807	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)Nc1ccc(CS(C)(=O)=O)cc1	756269103	LZVZMMLGGLVFIF-UHFFFAOYSA-N	428.511	1.689	50	20	IDGD	
CS(=O)(=O)CCOc1cccc(NC(=O)NNC(=O)COc2ccccc2F)c1	756296600	AYHCEXYCPUTXOM-UHFFFAOYSA-N	425.438	1.481	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1-n1nnnc1C	756322314	WWMTVIAKPZSPCR-UHFFFAOYSA-N	433.432	1.632	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)Nc2cc(F)cc(S(N)(=O)=O)c2)cc1	756516140	QOJSSNGJGUTFFG-LLVKDONJSA-N	438.437	1.296	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CN2CCCC[C@H]2C(=O)Nc2ccc3c(c2)CCO3)c1	756601616	PZCZMCMMOLHRKA-FQEVSTJZSA-N	447.495	1.747	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Nc2ccn(CCN3CCOCC3)n2)ccc1OC(C)C	756646128	KTUYVCUXTBMSDK-UHFFFAOYSA-N	446.508	1.478	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)Nc2ccc(NS(C)(=O)=O)c(Cl)c2)cc1	756706328	MESONKLRNPVPLN-UHFFFAOYSA-N	442.881	1.952	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)N[C@@H]1CCN(C(=O)CCc2ccccc2)C1	757285338	HVDMWOQRUWTGFK-GOSISDBHSA-N	428.464	1.769	50	20	IDGD	
CN(c1ccccc1)S(=O)(=O)c1ccc(C(=O)NNc2ccc(C(N)=O)nn2)cc1	757400155	QCBKIFIYJDIDBP-UHFFFAOYSA-N	426.458	1.158	50	20	IDGD	
Cc1nc(N2CCOCC2)ccc1NC(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	757733237	NHVRHLLHWLGQFJ-UHFFFAOYSA-N	437.460	1.584	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@H](NC(=O)NNC(=O)COc2ccccc2C#N)[C@H](C#N)C1	758775076	VRVIURCPHLDQJA-HUUCEWRRSA-N	428.449	1.027	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)NC[C@H]1CN(Cc2ccccc2)CCCO1	759029124	PRIKPSBVLDTDMM-NRFANRHFSA-N	426.517	1.825	50	20	IDGD	
COCCS(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2cc3c(s2)CCC3)cc1	759276862	CEQBRRHAMBJRAP-UHFFFAOYSA-N	437.543	1.801	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1ccc(-n2ccnn2)cc1	760703957	STJFCDBFFULQBF-UHFFFAOYSA-N	429.820	1.547	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCCC(=O)NNC(=O)Cc1ccc(F)cc1	760799438	NVTHZVPTEKFZMM-MRXNPFEDSA-N	436.484	1.421	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCCC(=O)NNC(=O)c1ccc(C#N)cc1	760808757	LDJOCCCZFSXPCD-INIZCTEOSA-N	429.477	1.225	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)Cn1cnc(-c2ccccc2)n1	761571200	JTUINBXULIICSB-UHFFFAOYSA-N	443.847	1.612	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)NCCCN1C(=O)NC2(CCCC2)C1=O	761639944	CLVFSOOGAOCOOY-UHFFFAOYSA-N	449.533	1.372	50	20	IDGD	
C[C@@H]1CN(C(=O)CCC(=O)C(C#N)=C2N(C)c3ccccc3N2C)CCS(=O)(=O)C1	762670593	IHCGBRGBVBWLKF-OAHLLOKOSA-N	430.530	1.550	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)c2ccc3c(c2)S(=O)(=O)N(C(C)C)C3=O)n1	762906129	KRVDGQNTBKLRPI-UHFFFAOYSA-N	432.506	1.633	50	20	IDGD	
Cc1ccc(Oc2ccc(NC(=O)C(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)cc2)nn1	763444661	ZAQAZZLSTJDPCC-UHFFFAOYSA-N	436.384	1.885	50	20	IDGD	
CCOC(=O)c1cc(CC)sc1NC(=O)C(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	763446353	ROGNRGVEOBEIGO-UHFFFAOYSA-N	434.430	1.795	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)C(=O)Nc1ccc(-n2cnc3ccccc32)nc1	763547561	DSSDVCYMLFYFRJ-UHFFFAOYSA-N	444.407	1.549	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)Nc1ccnn1CCc1ccccc1	763569724	BEBYYIOYILRPJX-SFHVURJKSA-N	435.440	1.052	50	20	IDGD	
NC(=O)c1cc(NC(=O)C(=O)NNC(=O)COc2cccc(C(F)(F)F)c2)ccc1F	763639731	QXWIGJRXLSQFMK-UHFFFAOYSA-N	442.325	1.108	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2ccc3nc4n(c(=O)c3c2)CCC4)c1	763644823	NLPYJLMNZGBFTJ-UHFFFAOYSA-N	449.467	1.124	50	20	IDGD	
COC(=O)c1c(C2CC2)csc1NC(=O)C(=O)NNC(=O)COc1ccc(C)cc1	763808549	COVRQCLVQJQSTB-UHFFFAOYSA-N	431.470	1.885	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)C(=O)Nc1cccc(Oc2cnccn2)c1	763841809	UHYXOJFRRNBFCE-UHFFFAOYSA-N	425.376	1.573	50	20	IDGD	
CS(=O)(=O)c1c(Cl)cccc1NC(=O)C(=O)NNC(=O)COc1ccc(F)cc1	763842193	WKPMWCQCACWXBN-UHFFFAOYSA-N	443.840	1.048	50	20	IDGD	
Cc1nc(-c2ccccc2NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)no1	763873470	TYJPGWUOZRXNPP-LLVKDONJSA-N	427.392	1.738	50	20	IDGD	
C#CCOc1ccc(F)cc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccc(C(C)=O)cc1	763878296	OPHXSPAVTHDZST-AWEZNQCLSA-N	441.415	1.594	50	20	IDGD	
COC(=O)c1ccsc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccc(C(C)=O)cc1	763879486	WWVLSXDHTKMCFC-NSHDSACASA-N	433.442	1.291	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(-n3ccnc3)nc2)ccc1OC(C)C	763921789	OQGXZBAXNADJET-UHFFFAOYSA-N	438.444	1.463	50	20	IDGD	
NC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ccc(Br)s2)ccc1F	763940575	JSDBWUSRGVIDFY-UHFFFAOYSA-N	429.227	1.148	50	20	IDGD	
Cc1ccc(C(N)=O)cc1NC(=O)C(=O)NNC(=O)c1ccc(COc2ccccc2)o1	763956064	UCURILSJIXAQRG-UHFFFAOYSA-N	436.424	1.666	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)Nc1cccc(OCCF)c1	764004651	KQGYBJIVLCZNKE-UHFFFAOYSA-N	427.230	1.536	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1cccc(CS(=O)(=O)C(C)(C)C)c1	764049515	ZXVUYJRINMPRHS-UHFFFAOYSA-N	447.513	1.808	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc(C(=O)NC4CC4)cc3)n[nH]2)cc1	764109864	CLHGIRKVLVMDKD-UHFFFAOYSA-N	446.467	1.677	50	20	IDGD	
COc1ccc(Cn2nccc2NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)cc1	764124456	HRKQDECUUJKBMI-UHFFFAOYSA-N	443.847	1.699	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2O1)C(=O)Nc1cccc(OCc2cccnc2)c1	764155300	XWNLMRKVJWGFOD-FQEVSTJZSA-N	432.436	1.750	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)C(=O)Nc1ccc(Cl)c(Cl)c1	764260982	VNORTFGEXPFJNL-UHFFFAOYSA-N	437.287	1.786	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)N1CC2(CCCC2)c2c(F)cccc21	764275152	JWPSGHNBIVDXQX-UHFFFAOYSA-N	427.432	1.916	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)C(=O)Nc1cccc(-c2noc(C3CC3)n2)c1	764367692	KTHXGFDXLUWCCH-UHFFFAOYSA-N	435.440	1.917	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C[C@H]1CN(C(=O)OC(C)(C)C)CCO1	764565217	ZQMNSZGXFWGTCI-CJNGLKHVSA-N	425.457	1.766	50	20	IDGD	
C[C@H](Cc1ccc(F)c(Br)c1)C(=O)NNC(=O)CNC(=O)c1cccnc1	765507259	BTIHZPIJBCMYCZ-LLVKDONJSA-N	437.269	1.739	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)c3cnn(-c4ccc(O)nn4)c3C)n[nH]2)cc1	765570592	BTHJNZWMXYNRDR-UHFFFAOYSA-N	432.444	1.704	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)c3ccc(CNS(C)(=O)=O)o3)n[nH]2)cc1	765571866	REXQMCHOQZTQSI-UHFFFAOYSA-N	431.474	1.356	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)CCCN2C(=O)c3ccccc3C2=O)n[nH]1	765588945	VUULTZICZQZRCH-UHFFFAOYSA-N	447.451	1.923	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)CCc3c(C)nn(C)c3C)n[nH]2)cc1OC	765597750	WVOMTBTUEFQSEK-UHFFFAOYSA-N	426.477	1.838	50	20	IDGD	
CC(=O)N1c2ccccc2C[C@H]1C(=O)NNC(=O)CN1CCN(Cc2ccc(C)cc2)CC1	765748434	DKVPRSPULMRDGI-QHCPKHFHSA-N	449.555	1.238	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)ccc1O)c1ccc(=O)n(-c2ccccc2F)n1	766198649	PCPHOLMOOOCANV-UHFFFAOYSA-N	447.220	1.915	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)CO[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	767852606	JSMZCCYYNWIUEJ-OAHLLOKOSA-N	436.509	1.671	50	20	IDGD	
COc1ccc2c(c1)OC[C@H](NC(=O)NNC(=O)c1sc(N3CCOCC3)nc1C)C2	768105625	NZOOLCFZVGVFDT-CQSZACIVSA-N	447.517	1.244	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)ccc1OC(C)C	768229398	BGMYPCZCKSEOCC-GOSISDBHSA-N	429.429	1.408	50	20	IDGD	
Cc1cc(Br)ccc1C(=O)N1CCC[C@H](C(=O)NNC(=O)C(C)(C)O)C1	768245459	AYDSMXHYSFXCTH-LBPRGKRZSA-N	426.311	1.528	50	20	IDGD	
CN1CCN([C@H](C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)c2ccccc2)CC1	768277102	RSECBRAAJLPCLH-NRFANRHFSA-N	436.491	1.966	50	20	IDGD	
CCC(CC)N1C[C@H](C(=O)NNC(=O)c2cc(-c3ccc(OC)c(OC)c3)[nH]n2)CC1=O	768277560	QHKMZFGWNRYRQH-CQSZACIVSA-N	443.504	1.892	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccc2c1CCN2C(C)=O	769255994	MWPSFXJFFZZYSN-UHFFFAOYSA-N	440.456	1.159	50	20	IDGD	
CSCCNC(=S)NNC(=O)Cn1cnc2sc(-c3ccccc3)cc2c1=O	769767430	KUHCPFZFBZRUOI-UHFFFAOYSA-N	433.584	1.983	50	20	IDGD	
CCN1CCN(c2ccc(CNC(=O)NNc3nc(O)c4cnn(C)c4n3)cc2F)CC1	770383371	GKPHGNHWMMNEFQ-UHFFFAOYSA-N	443.487	1.176	50	20	IDGD	
CS(=O)(=O)c1cc(S(=O)(=O)NNC(=O)c2c[nH]c3ccccc23)c(Cl)s1	770635551	RTKYKVYXBFENCP-UHFFFAOYSA-N	433.920	1.910	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)c1ccc2c(c1)C[C@@H](C)N2S(C)(=O)=O	771967892	ITMFHCZSZRYSSB-CHWSQXEVSA-N	425.507	1.136	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)Cc1cccc(NS(C)(=O)=O)c1	772964513	RXUGQBVXOOYPQD-LBPRGKRZSA-N	425.894	1.869	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)N[C@H]1CCCN(CC(F)(F)F)C1=O	772973187	GWONALPLSKSDPR-QMMMGPOBSA-N	426.193	1.275	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cn(C)nc3C(F)(F)F)n[nH]2)cc1	773545886	KJQOMQQKSHQFJA-UHFFFAOYSA-N	449.393	1.791	50	20	IDGD	
Cc1nn([C@@H]2CCS(=O)(=O)C2)c(C)c1NC(=O)C(=O)NNc1cccc(Cl)c1C	773771245	QHOGLGGKTAGQKD-CYBMUJFWSA-N	439.925	1.903	50	20	IDGD	
CC[C@@H]1Oc2cc([C@H](C)NCC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)ccc2NC1=O	775462637	BDWORYVPBYMAHX-SJCJKPOMSA-N	441.444	1.816	50	20	IDGD	
CO[C@](C)(C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1)c1ccccc1	776149882	YVRCNAZQCRJCNA-FQEVSTJZSA-N	433.534	1.023	50	20	IDGD	
CN(NC(=O)CN1Cc2ccccc2C1=O)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776204727	FBCPUWNJDINQTJ-UHFFFAOYSA-N	431.493	1.278	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)N[C@H]1CCN(c2ccc(Cl)cc2)C1	776320485	PLUNJPHZSJCGBI-KRWDZBQOSA-N	443.939	1.956	50	20	IDGD	
CCCc1nc(C)c(NC(=O)C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)s1	777140907	DWUQZZXYFASDHV-UHFFFAOYSA-N	428.474	1.695	50	20	IDGD	
O=C(c1ccc(Br)cc1)N1CCN(S(=O)(=O)CBr)CC1	777777518	LDJHCXHTLYFOFU-UHFFFAOYSA-N	426.130	1.889	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N2CC[C@H](O)[C@H](C)C2)cc1	779270030	RWJDKDNFIHTCEC-ZPLXFCHRSA-N	437.500	1.570	50	20	IDGD	
COc1ccc(Cn2nccc2NC(=O)NNC(=O)Cc2ccncc2)c(OC)c1OC	779460367	RUDJHOKPWWXHEJ-UHFFFAOYSA-N	440.460	1.748	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)N[C@H]1CCCN(c2ccc(C#N)cc2)C1=O	780893996	IHYJWMCAVJXLPT-KSSFIOAISA-N	439.447	1.991	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C(=O)Nc2ccc(OC3CCCC3)nc2)nc2ccccc21	782884001	DNYJLVVCRPFKGL-UHFFFAOYSA-N	436.472	1.618	50	20	IDGD	
CCOCCCNC(=O)c1cccc(NC(=O)C(=O)NNc2ncnc3ccsc23)c1	783261640	HEZXVVFWJMXJRU-UHFFFAOYSA-N	442.501	1.930	50	20	IDGD	
Cc1ccc(CN(C)C)cc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)NC(C)C)cn1	783263204	IILROWOACYVEQG-UHFFFAOYSA-N	448.549	1.220	50	20	IDGD	
CCOC(=O)c1cc(CC)sc1NC(=O)C(=O)NNc1ccc(-n2cccn2)nn1	783436306	KCFVXFMSRYUJEW-UHFFFAOYSA-N	429.462	1.545	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)C(=O)Nc1ccccc1OCC1CC1	784215971	KMBGEWJYWHRCRZ-UHFFFAOYSA-N	444.513	1.998	50	20	IDGD	
O=C(NNc1ccc(Br)cn1)C(=O)Nc1ccccc1C(=O)N1CCOCC1	784341118	KPNLOAKKAPREIR-UHFFFAOYSA-N	448.277	1.398	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)F)cc1)[C@H]1CC=CC[C@H]1C(=O)N1CCOCC1	784445755	ATQAMVUFMURJFI-JKSUJKDBSA-N	443.472	1.567	50	20	IDGD	
CCN1CCN(C(=O)Cc2ccc(NC(=O)C(=O)NNc3ncccc3Cl)cc2)CC1	784815712	YCEAYLZMJTXTFW-UHFFFAOYSA-N	444.923	1.523	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)C(=O)Nc2cccc(OC[C@@H]3CCCO3)c2)c1	784839185	GGJCECDQBYSECV-KRWDZBQOSA-N	433.486	1.730	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)n(-c2ccccc2C)n1	785023900	PLNCXSPQVWFGSN-UHFFFAOYSA-N	438.400	1.503	50	20	IDGD	
Cc1cccc(NC(=O)C(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)c1Br	785023957	RWJQMFWTNGCJCJ-UHFFFAOYSA-N	437.206	1.771	50	20	IDGD	
COc1cc(OC)c(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)cc1Cl	785060037	GDJYITCWZLJXRX-UHFFFAOYSA-N	431.836	1.334	50	20	IDGD	
Cc1cn(-c2c(F)cccc2F)nc1C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C	786984894	GSTUMDNSNSFHQW-UHFFFAOYSA-N	438.435	1.928	50	20	IDGD	
CCOC(=O)[C@@](C)(CNC(=O)NNC(=O)c1ccc2c(c1)OCCO2)c1ccccc1	787311722	YSGOOQBOFIZBIZ-QFIPXVFZSA-N	427.457	1.923	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc(Cl)c(S(C)(=O)=O)c1	788331942	VOYOLKKZNDFVJK-UHFFFAOYSA-N	425.850	1.152	50	20	IDGD	
COc1c(C)cnc(Cn2cnc(NC(=O)C(=O)NNC(=O)c3ccccc3C)n2)c1C	789731385	GNGBACLNEBLHHD-UHFFFAOYSA-N	437.460	1.055	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)c1ccn(CC(F)F)n1	789992192	VEKKOSIIULRZNE-UHFFFAOYSA-N	440.882	1.380	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)CCc1ccccc1NC(=O)OC(C)(C)C	790641674	HRAIENCVPHMBBY-GFCCVEGCSA-N	428.511	1.051	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(C(F)(F)F)c(OC)c1	790950986	ATDDHLZIDCGIPA-UHFFFAOYSA-N	441.362	1.888	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CCN2CCN(C(=O)OC(C)(C)C)CC2)cc1OC	792013820	XTYXSYDDAAZNRD-UHFFFAOYSA-N	436.509	1.408	50	20	IDGD	
Cc1cc(=O)c(C(=O)OCC(=O)NNC(=O)c2cccs2)nn1-c1ccccc1F	792028686	GDAJQRXDEQTCTL-UHFFFAOYSA-N	430.417	1.360	50	20	IDGD	
CC(C)(C(=O)NNC(=O)[C@](C)(O)Cn1cc(C(F)(F)F)ccc1=O)c1ccccc1	792160601	ZCBLOKDLRJOCIE-LJQANCHMSA-N	425.407	1.743	50	20	IDGD	
Cc1ccc(F)c(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)c1Br	797002695	QSQXNDGZHDZWRM-ZDUSSCGKSA-N	436.237	1.986	50	20	IDGD	
C=CCNC(=S)NNC(=O)[C@]12CCC(=O)N1c1ccccc1C(=O)N2Cc1ccccc1	798304990	PRMFARXLNFZSBP-QHCPKHFHSA-N	449.536	1.847	50	20	IDGD	
Cc1ccccc1NC(=O)NNC(=O)c1cc(S(=O)(=O)NCCCN(C)C)ccc1C	798312554	GCNPSDGZGKGCHT-UHFFFAOYSA-N	447.561	2.000	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NC2CCN(c3nccs3)CC2)nc1	798509313	KOLQCEOWIXFTOF-UHFFFAOYSA-N	439.567	1.520	50	20	IDGD	
CC(C)(C(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1)c1csc(-c2cccs2)n1	800454787	YORSIYRWZZAIJJ-JTQLQIEISA-N	428.561	1.667	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)N[C@@H]1CCCC12CCOCC2	800739386	CDDIIFBAKZWMMK-HXUWFJFHSA-N	429.565	1.878	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2S(=O)(=O)N2CCCCC2)cc1	801108228	IYWHSFYOZISIET-UHFFFAOYSA-N	444.513	1.569	50	20	IDGD	
O=C(OCc1ccccc1)N1CC[C@](F)(C(=O)NNc2ccc(-n3ccnc3)nn2)C1	804954226	BXAOMOZREWVJAN-HXUWFJFHSA-N	425.424	1.856	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1nc(C2CCOCC2)cs1	806974826	UXNJJQOLVMZGBV-UHFFFAOYSA-N	429.458	1.074	50	20	IDGD	
COC[C@]1(CNC(=O)NNc2ccc(-n3cccn3)nn2)CCCN1C(=O)OC(C)(C)C	807550079	CUZZGNKAQZGVPF-HXUWFJFHSA-N	446.512	1.705	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)NCc2ccncc2OC[C@@H]2CCOC2)cc1C	807616192	PMAUFXLKLLIXHX-MRXNPFEDSA-N	441.488	1.583	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)COc1ccccc1C#N)c1ccc(N2CCCNC2=O)cc1	813238106	BHDVKJVRVJZJOD-OAHLLOKOSA-N	436.472	1.948	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NN=C2CCN(C(=O)OCC(C)C)CC2)cc1	814731735	ZTCZEHHTAHZUTH-UHFFFAOYSA-N	438.550	1.976	50	20	IDGD	
CCOC(=O)[C@@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNc2cccc(Cl)n2)cc1	815726159	RHTHBXVXHUBAJP-LLVKDONJSA-N	433.852	1.498	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1ccc2c(c1)CCCC(=O)N2	815751647	IJFJSTIEOAYJJJ-UHFFFAOYSA-N	445.501	1.294	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2cn(Cc3ccccc3)nn2)c2ccccc2c1=O	818838299	NOAYJMOCGIJNMI-UHFFFAOYSA-N	431.456	1.521	50	20	IDGD	
O=C(NN=Cc1c(N2CCOCC2)nc2ccccn2c1=O)c1ccc2ccccc2n1	873830285	CEWOEBRBBLUWBD-UHFFFAOYSA-N	428.452	1.843	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)CCC(=O)N1CCOCC1	912886318	ANHSISMDDRLVRW-GFCCVEGCSA-N	428.283	1.003	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)COc2ccc(C(=O)c3ccccc3)cc2)C[C@@H](C)O1	912919893	SOVLNECQBZEPKW-HDICACEKSA-N	439.512	1.943	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCCN(C(=O)c3ccc(F)cc3)CC2)n1	913146771	NUNKVGIKIPIRCM-UHFFFAOYSA-N	433.509	1.129	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCc2ccc(NC(C)=O)cc2)nc1	916251050	ZEJJWSNVXKJBGM-UHFFFAOYSA-N	434.522	1.897	50	20	IDGD	
C=CCNC(=S)NNC(=O)c1ccc(CNS(=O)(=O)c2ccc(C(C)=O)cc2)cc1	916559643	XOMRRBICUZPDQZ-UHFFFAOYSA-N	446.554	1.663	50	20	IDGD	
CCCc1noc(CCCC(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)n1	917919523	QKCLRPRWLNMMDL-UHFFFAOYSA-N	429.886	1.107	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)COc1ccc(C#N)cc1)c1ccc(S(=O)(=O)N(C)C)cc1	918105691	UBEANZUMIUNFIO-CQSZACIVSA-N	445.501	1.279	50	20	IDGD	
O=C(CCCN1C(=O)c2ccc(Br)cc2C1=O)NNC(=O)c1ccncc1	920087874	IAZMOADFFIXBCZ-UHFFFAOYSA-N	431.246	1.682	50	20	IDGD	
CCOc1ccc(C(CC)=NNC(=O)CSc2nn(C)c(=O)n(C)c2=O)cc1OCC	920826219	BCERVTCHJOLHPM-UHFFFAOYSA-N	449.533	1.299	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2cccc(N3CCOC3=O)c2)c2ccccc2c1=O	920928437	ADBLJFXGWARWOU-UHFFFAOYSA-N	436.428	1.840	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)Nc2ccccc2CN2C(=O)CNC2=O)cc1	920940361	DKXODXZZHRVBIR-UHFFFAOYSA-N	425.445	1.533	50	20	IDGD	
CCOC(=O)C1CCC(NC(=O)NNC(=O)c2nn(CC)c(=O)c3ccccc23)CC1	921122399	IIWJSULRKDUBOU-UHFFFAOYSA-N	429.477	1.482	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(NC(=S)NNC(=O)c2nnc(O)c3ccccc23)c1	1115812372	FQIRIMBLOJDXKQ-UHFFFAOYSA-N	446.514	1.217	50	20	IDGD	
C[C@H]1CN(C[C@H](C)C(=O)NN=Cc2c(Br)cc(C(=O)O)n2C)C[C@@H](C)O1	1116077157	OMXZYWJZDCYYTQ-SDDRHHMPSA-N	429.315	1.681	50	20	IDGD	
O=C(NNS(=O)(=O)c1c(F)cccc1Br)c1ccc2c(c1)OCCO2	1116265166	MKSSKDDTXKTDMB-UHFFFAOYSA-N	431.239	1.983	50	20	IDGD	
CC[C@]1(C(=O)NNC(=O)CCN2C[C@H](C)O[C@@H](C)C2)CCN(C(=O)OC(C)(C)C)C1	1116344173	IEWWYBGOMHRTOF-QYWGDWMGSA-N	426.558	1.670	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@@H]2CCCCN2Cc2cccnc2)c2ccccc2c1=O	1318393516	CZNXWQNSRLERAZ-IBGZPJMESA-N	434.500	1.627	50	20	IDGD	
CCOC(=O)N1CCC(NC(=O)CCCNC(=O)NNc2ccc(C(C)(C)C)nn2)CC1	1339260062	XGPKFFIHYYTQPJ-UHFFFAOYSA-N	449.556	1.918	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@]1(C)C[C@H]1C)C2	1778092869	SVELAOYPQJNJEH-WLIUMLBMSA-N	443.548	1.680	50	20	IDGD	
O=C(c1c[nH]c2cnccc12)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1778753523	POHKYBACVSOYAX-PBHICJAKSA-N	425.258	1.697	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cccc3c1NC(=O)C3=O)CCO2	1779297278	ZRLPZFRPBCIBRL-OAQYLSRUSA-N	445.548	1.116	50	20	IDGD	
COC(=O)CCCCCC(=O)N1CCO[C@]2(CCN(C(=O)CO[Si](C)(C)C)C2)C1	1779301871	XDXBZNHHNZWLKS-FQEVSTJZSA-N	428.602	1.791	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnn(C)c3Cl)C2)C1	1779863863	WPBFVTFMGYNSPQ-BLLLJJGKSA-N	433.734	1.691	50	20	IDGD	
Cc1cc(C)cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C3)c1	1780407696	WHCQFBSYORVKQH-HYBUGGRVSA-N	444.576	1.804	50	20	IDGD	
Cc1cnc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](F)Br)C2)cn1	1780771142	SVVJOSYHSDKTNK-JKIFEVAISA-N	429.290	1.603	50	20	IDGD	
Cc1n[nH]c(C)c1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Br)C1	1780774642	FUQDSAZJBAUYGU-SUYBPPKGSA-N	431.306	1.845	50	20	IDGD	
O=C(CCCn1c(O)nc2ccccc21)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Cl)CCO2	1780919495	DSFTXNLBWSAKAC-XLIONFOSSA-N	438.887	1.886	50	20	IDGD	
COCCn1nccc1C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@](C)(Cl)CCl)C2)C1	1781229955	NGBMBJJDESGDIB-ROUUACIJSA-N	433.336	1.209	50	20	IDGD	
O=C(c1cc(Cl)cnc1O)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781325220	FMIRKELBAAYPNP-ABAIWWIYSA-N	436.665	1.575	50	20	IDGD	
O=C(c1ccc2nc[nH]c2c1)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781330896	AQDGADOCXKBNNF-RHSMWYFYSA-N	425.258	1.697	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)nc(O)c1)C2	1781997951	LIHLSDINKPRYNX-AEDCBLDQSA-N	442.310	1.404	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C(=O)c2ccc(C)cc2)C1	1782097776	KIYPESBBFOTUIZ-NJNPRVFISA-N	436.936	1.945	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1n[nH]c3c1CCCC3)C2	1782172543	GMAUPNJCHKKLKY-LUQKVYGDSA-N	438.956	1.670	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H]2CCNC(=O)C2)C1	1782268960	HYZFQDUJMPUXKU-WTVLQJKYSA-N	434.364	1.263	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)C3(O)CCC3)[C@H]2C1	1783516162	MNEBOFRANQXWQZ-QXKUPLGCSA-N	431.371	1.691	50	20	IDGD	
Cc1c(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](C)Br)C3)C2)nc2ccccn12	1783535063	XCKVUFUOHSSENN-YJYMSZOUSA-N	435.322	1.870	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc1Cl	1783933319	UQNLDHNCHHBQDZ-OAQYLSRUSA-N	436.940	1.465	50	20	IDGD	
C[C@H](Cc1ccc(F)cc1)C(=O)N1CCO[C@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1	1783936999	MUYKLIDKCONHBO-HXOBKFHXSA-N	448.539	1.207	50	20	IDGD	
Cc1ccc(/C=C/C(=O)N2CCO[C@@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)s1	1783938076	RROZIWPTNMZHMW-HSTAZWAASA-N	434.562	1.273	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc([N+](=O)[O-])c(OC)c3)C2)C1	1785182546	ILDFJBSVQHYLCI-LIRRHRJNSA-N	441.868	1.301	50	20	IDGD	
CC(C)Oc1ccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)cc1C#N	1785192643	JPZWLVFHIVSWHK-DYESRHJHSA-N	435.908	1.389	50	20	IDGD	
C[C@@H]1[C@H](C(=O)N2CC[C@]3(CN(C(=O)[C@@H](F)Cl)CCO3)C2)CCN1C(=O)OC(C)(C)C	1785745282	WOLIQFUCQKOMKV-RDNQGFKOSA-N	447.935	1.996	50	20	IDGD	
Cc1noc(C)c1CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCBr)[C@H]2C1	1786400958	ITKDIFMJAGFHMU-XIRDDKMYSA-N	442.354	1.989	50	20	IDGD	
O=C(COc1ccccc1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21	1786484833	ALRUNOXSORRHBT-NZUILWFCSA-N	429.286	1.736	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc4nc(C)ccc4o3)[C@H]2C1	1787158661	VSTXERIGMFBFCB-XLPNERPQSA-N	435.908	1.983	50	20	IDGD	
C[C@H](Nc1nccs1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CO[Si](C)(C)C)C[C@@H]21	1787487108	QYAYIDVWYUTUMT-VGWMRTNUSA-N	440.642	1.775	50	20	IDGD	
Cc1nnc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]3C2)s1	1788764025	FWTCTUJLYMXFFB-KKUMJFAQSA-N	426.615	1.220	50	20	IDGD	
COc1cc(C(=O)Nc2ccc(C3(NC(=O)c4cccc(B(O)O)c4)CCC3)cc2)ccn1	1789772101	YIKWFURYDCOGNQ-UHFFFAOYSA-N	445.284	1.832	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)Cc3ccccc3)C[C@@H]21	1789871835	KWQHBUWMCGPGIH-CURYNPBISA-N	443.371	1.806	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)Nc1ccc(C2(NC(=O)[C@@H](N)CCC(N)=O)CCC2)cc1	1790492810	OUTVNHLUMSXEAW-KBXCAEBGSA-N	429.348	1.950	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)COc3ccc(OC)cc3)C[C@@H]21	1791249251	GHSCNRWFCYPCSC-QZHFEQFPSA-N	440.924	1.308	50	20	IDGD	
CC(C)n1nc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]3C2)cc1C(=O)O	1791294069	FOYIPHUXZJODEN-MJVIPROJSA-N	447.319	1.559	50	20	IDGD	
Cc1nccn1[C@@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]21	1791705263	UPYAPDGUKIICKN-RWBKLUSOSA-N	431.364	1.969	50	20	IDGD	
CCOc1ncccc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnccc1C(=O)NN)C2	1792423179	FDVNTYGIJKQTAL-QDMKHBRRSA-N	438.488	1.044	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COC1CCCCC1)C2	1792867024	RXYHJODEVPNMPG-ZXFNITATSA-N	431.371	1.956	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1Cc3ccccc3O1)C2	1792870256	AQSCNMTYHPNETM-IVFVNLKQSA-N	437.334	1.611	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/c1cccc(C(F)(F)F)c1)C2)[C@H](O)CCl	1792975790	XMBVTSHKRNSLFX-YJCYCJFJSA-N	446.853	1.908	50	20	IDGD	
COC(=O)[C@H]1CC[C@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@](C)(Cl)CCl)C3)CC1	1793608999	HXJSLGBBXQCGJY-NOYYPJHYSA-N	449.375	1.792	50	20	IDGD	
C[C@H](Nc1cccnc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@](C)(Cl)CCl)C2	1795605661	JOSWZMUASBRAQD-MABMQTIPSA-N	429.348	1.708	50	20	IDGD	
CCC[C@@H](NC(C)=O)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C(C)=N/NC(=O)c1ccc[nH]1	1796893207	RLLFPGRGJPHLSW-NZDARZTISA-N	444.536	1.063	50	20	IDGD	
CCn1nc(C(C)C)cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCC(=O)NN(C)C)C2	1799470377	CPIQKERNCVKUKC-BJWYYQGGSA-N	432.569	1.651	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H](O)[C@H](C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](F)Cl)C3)C1	1799981956	QXKRPJJFZIMDIK-ZAQNNHEOSA-N	433.908	1.387	50	20	IDGD	
O=C(Cn1cccc([N+](=O)[O-])c1=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](F)Br	1800161344	FKTFQRANFRPAGT-MIJXAVMKSA-N	445.245	1.085	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(N(C)C)cn1)C2	1800639308	NPGLPFRNCXWTEL-YXPYIKCWSA-N	439.354	1.524	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1n[nH]c3c1CC[C@@H]3C)C2	1800641228	SIVCNDNJUHSUAT-VOZNZKSSSA-N	439.354	1.836	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(OC)ccn1)C2	1800642106	XGARXAVIKRGGOS-FAXLKDOZSA-N	426.311	1.467	50	20	IDGD	
CC(=O)Nc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)Br)ccn1	1800757716	OYUCYDYCIBCFIY-BWPSIRRCSA-N	439.310	1.027	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(N3CCCC3)ccn1)C2	1800978178	NVFMPHIYRIXBSQ-LORHWOILSA-N	436.940	1.139	50	20	IDGD	
C[C@@H](Sc1ccccc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCC(=O)NN(C)C	1801010548	FSBGGXSAIDLKRG-PZTGFMGMSA-N	448.589	1.130	50	20	IDGD	
O=C1C[C@H](C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](Br)Cc2ccccc2)C3)CN1	1801678842	IWSUVERGOXPDBH-IECFSIQFSA-N	448.361	1.767	50	20	IDGD	
CC[C@@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccnn1CCOC)C2	1801802535	ZUWWPTTVLMKNGV-LXTVHRRPSA-N	427.343	1.955	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CS(=O)(=O)c1ccc(C)cc1)C2	1802274260	VXFRBHSHNVHCOS-KYHPRHEASA-N	442.965	1.661	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)C2(Br)CC2)[C@H]1c1cccnc1)[C@@H](O)CCl	1803141284	NYDXMTKIFTXPRX-IHRRRGAJSA-N	430.730	1.615	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cnn3cccnc23)[C@H]1c1cccnc1)[C@@H](O)CCl	1803143303	ZSFAFJYAZWRHGD-XIRDDKMYSA-N	428.880	1.044	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1	1803147820	MDLJRQBTZIXSPN-QPSCCSFWSA-N	432.746	1.861	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)[C@@H](C)CC(N)=O)[C@@H]1c1cccnc1	1803672725	UYWLWSJOQHSDQL-GMZLATJGSA-N	425.327	1.382	50	20	IDGD	
O=C(NCC(=O)N1CCC2(CCCN(C(=O)[C@H](O)CCl)C2)CC1)c1cccs1	1805517299	ATOABONSCJSHIW-CQSZACIVSA-N	427.954	1.309	50	20	IDGD	
Cc1cc(C(=O)NC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)no1	1805840057	YRPVDDWQDIBQMK-OXJNMPFZSA-N	428.493	1.071	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC2(CCCN(C(=O)c3ccnc(Cl)c3)C2)CC1	1808361633	QUWRAICKVCHFDW-UHFFFAOYSA-N	441.724	1.573	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)[C@H](F)Cl)[C@@H]1c1cccnc1	1808416704	CYLJKDUSZMIFRH-NPGBFABQSA-N	448.886	1.756	50	20	IDGD	
CC[C@@H](NC(C)=O)C(=O)N1CC[C@H](CNC(=O)[C@H](F)Br)[C@H]1c1cccnc1	1808649487	SIAMPOJQHKGDSD-FPCVCCKLSA-N	443.317	1.693	50	20	IDGD	
CC[C@@H](C(=O)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1)N(CC)CC	1809978275	YRRCHPWWYXXIMB-NRFANRHFSA-N	443.397	1.332	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1CCN(C(=O)CN2CCCCC2=O)[C@@H]1c1cccnc1	1810547322	DSJRSLCHJBWCPL-PGRDOPGGSA-N	446.624	1.951	50	20	IDGD	
C[C@H](Nc1ccccn1)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1	1810569697	QQDJRQFSUVIKDN-XPYUAMARSA-N	431.924	1.583	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)c2ccc[nH]2)[C@H]1c1cccnc1	1810619479	KOZNJQQGJUQQKP-PFWGCWTJSA-N	447.499	1.863	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CO)C(=O)N1CCCC2(CCN(C(=O)[C@@H](F)Cl)CC2)C1	1810789091	LEVHDAAIBGFHNZ-UONOGXRCSA-N	435.924	1.638	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2nccnc2C(N)=O)[C@H]1c1cccnc1	1811182441	NXHCKOIZJSLDJX-RLFYNMQTSA-N	444.923	1.698	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2cnn3cccnc23)[C@H]1c1cccnc1	1813029941	BGAUPBBIIBNYAJ-NJAFHUGGSA-N	442.907	1.698	50	20	IDGD	
CC/C=C(\C)C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1	1813703914	YWHZCJBZDYJNIG-JOICGQAWSA-N	436.516	1.756	50	20	IDGD	
CC(C)(CCl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1814693942	KUNCIWHTWAVHJQ-INIZCTEOSA-N	432.717	1.660	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)CC2CCOCC2)[nH]n1)c1ccc(B(O)O)cc1	1817470977	AYUCLVBAHLVZJW-LJQANCHMSA-N	440.309	1.212	50	20	IDGD	
Cc1cc(C)nc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)c1	1817725904	KILBCIZNGCTCGK-FQEVSTJZSA-N	447.304	1.721	50	20	IDGD	
C[C@H](NC(=O)c1cnccn1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](F)Cl)[nH]n1	1819514618	QRZUXDMYPAQSIO-XEGUGMAKSA-N	437.863	1.545	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H]3CCC=CO3)sc2C1	1819733269	RAFKJGNGXMKTHW-NHYWBVRUSA-N	442.501	1.060	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1)c1cc(-n2ccnc2)ccn1	1820341242	CRISWOBMHXEFGX-IAGOWNOFSA-N	443.895	1.896	50	20	IDGD	
N#Cc1cccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)c1	1820484181	QSCHZWHHJHMFJI-FQEVSTJZSA-N	443.272	1.581	50	20	IDGD	
Cc1nnc(CC(=O)N2CCCC[C@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)s1	1822413916	HDQPDYJMGIZCTA-AWEZNQCLSA-N	448.553	1.177	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)C(Cl)Cl)n[nH]1	1822423787	LCFKFFLZRPCTKG-GFCCVEGCSA-N	440.291	1.518	50	20	IDGD	
COc1ccc(CC(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@H](O)CCl)CC3)c(C#N)c1	1822805590	YXJCQWUUAQNVLU-XJKSGUPXSA-N	448.932	1.778	50	20	IDGD	
CC(=O)N/C(C)=C/C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1	1823008838	HROUCFWFAARHNT-YNYHHFAJSA-N	433.303	1.786	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H]3CCC(=O)N3C)sc2C1	1823043056	QCMQABVLBRXSMB-NHCYSSNCSA-N	443.367	1.707	50	20	IDGD	
Cc1[nH]nc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)c1F	1825607097	YQDCSEXMLUSWSH-SFHVURJKSA-N	442.300	1.084	50	20	IDGD	
O=C1NCCCn2nc(C(=O)N3CCC([C@H]4CCCCN4C(=O)[C@@H](F)Cl)CC3)cc21	1827609999	ZXWNTEYQFSAAKF-NVXWUHKLSA-N	439.919	1.784	50	20	IDGD	
Cc1ncc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)s1	1827964590	OFWJEXDANOUCGE-LJQANCHMSA-N	441.362	1.678	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CCN2CCOC2=O)CC1	1828386279	OTXNWHAZDUTWFC-IRXDYDNUSA-N	429.945	1.702	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)COC(=O)C(F)(F)F)CC1	1828834245	DIJZPIPOKHGAAB-KGLIPLIRSA-N	442.862	1.965	50	20	IDGD	
CC(=O)N[C@H](C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2)C(C)(C)C	1830353404	BHLTWXHSIICSHF-IIBYNOLFSA-N	445.988	1.259	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc4c[nH]nc34)C2)C1	1830357759	KCEMYKCHOQASDE-OAQYLSRUSA-N	434.924	1.898	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCc2ccc(O)nn2)CC1	1831834967	LSVOFMLZXQRKNG-QZTJIDSGSA-N	438.956	1.988	50	20	IDGD	
Cc1nn(C)c(C)c1C(=O)N1CCC([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1	1831870376	AJTHBCHGOQPZPL-LJQANCHMSA-N	446.596	1.643	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)CC2CCOCC2)CC1	1831871872	XYGSAUYHXJIGRF-FQEVSTJZSA-N	436.597	1.796	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)C1CCC(CO)CC1)CCO2	1832521965	PQLOJGDGFBFYEW-WIXQSORDSA-N	442.629	1.093	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3ccc4cnccc4n3)CC2)CC1)[C@@H](O)CCl	1833310000	GIWWOBRWHZMGQS-FQEVSTJZSA-N	445.951	1.415	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)Cc3ccc4c(c3)CCO4)CC2)CC1)[C@H](O)CCl	1833311879	GFMWWPZSOVCRLV-HXUWFJFHSA-N	449.979	1.335	50	20	IDGD	
Cc1cccc(C(=O)N2CCO[C@]3(COCCN(C(=O)CCBr)C3)C2)n1	1834045077	ICEJORJAIILGLZ-SFHVURJKSA-N	426.311	1.245	50	20	IDGD	
CCC1(C(=O)N2CCC(N3CCC(NC(=O)CCBr)CC3)CC2)COC1	1834424124	IGUGVTVJLYJPBZ-UHFFFAOYSA-N	430.387	1.770	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCC(N2CCC(NC(=O)[C@H]3CCC(=O)N3)CC2)CC1	1834589553	GDYYGEJFWWFFGV-BEFAXECRSA-N	433.380	1.073	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](C)N3C[C@H]4C[C@H]4C3)CC2)CC1	1835676417	DAZIZPMTKZUMNT-WWNBULGVSA-N	441.016	1.152	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1)c1ccc(CO)o1	1835929268	RLNUVRYMIGYEBY-MRXNPFEDSA-N	446.317	1.648	50	20	IDGD	
O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)Cc1ccc(F)cn1)CCO2	1836031530	ZWBKLJAVHDMFSO-GOSISDBHSA-N	444.301	1.005	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1nccc3occc13)CCO2	1836291805	GKIMVJMATSLRJY-NRFANRHFSA-N	447.564	1.749	50	20	IDGD	
O=C(c1ccc(C(F)(F)F)[nH]1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1837764504	CEERLHFOVDRXGA-SWLSCSKDSA-N	427.782	1.638	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(CO)o3)CCO2)C1	1837971769	HRNVXYJICFUSTK-KSSFIOAISA-N	445.310	1.015	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)c3cc(CO)on3)CC2)CC1	1838558097	DSGIJDABMVESHU-LBPRGKRZSA-N	444.326	1.563	50	20	IDGD	
C[C@]1(C(=O)N2CCC(OC3CCN(C(=O)[C@H](F)Br)CC3)CC2)CCCN1	1838632446	XQLLIOAWSRVESP-MAUKXSAKSA-N	434.350	1.818	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3CCC4(CC3)OCCO4)C2)C1	1839147843	DSVPHPCPWRNIOB-YLJYHZDGSA-N	444.956	1.394	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccccc3NC(C)=O)C2)C1	1839148992	PPFSVTXBRYHRPJ-DYESRHJHSA-N	437.924	1.732	50	20	IDGD	
O=C([C@H]1CCC(F)(F)C1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839196956	AHTFXENMEPYGEO-HUBLWGQQSA-N	443.260	1.569	50	20	IDGD	
COc1cccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)c1	1839201522	ABMYUBDJILCEMP-CRAIPNDOSA-N	445.285	1.456	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(C)cc(F)c3F)CCO2)C1	1839459386	QGWCYHYUQLLIFZ-FOIQADDNSA-N	446.878	1.597	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1[C@H]3C=CS[C@H]31)CCO2	1839694890	VPULATLGUMYYEB-DWJZYCCASA-N	445.379	1.349	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3F)C2)C1	1840032006	KUMIAUAYOQZAIU-SJCJKPOMSA-N	430.274	1.074	50	20	IDGD	
N#Cc1ccccc1OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840190274	NPXIWMNEJUTWKM-LJQANCHMSA-N	442.299	1.197	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)n1cccc1)CCO2	1840355043	RHLNPNFPLFEFOB-RLFYNMQTSA-N	428.327	1.289	50	20	IDGD	
Cn1cnc(C(=O)N2CCCC23CN(C(=O)[C@@H](Br)Cc2ccccc2)C3)n1	1842355633	MSFMKDXGZIGWSS-HNNXBMFYSA-N	432.322	1.638	50	20	IDGD	
CC[C@@H](C)[C@@H](N)C(=O)N1CCCC12CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1842888738	AEKVNHBLPZNJBX-QLFBSQMISA-N	430.977	1.695	50	20	IDGD	
COC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)CCBr)C2	1843382004	AHPARTUSPNJUMJ-CYBMUJFWSA-N	448.358	1.515	50	20	IDGD	
N#Cc1ccc(CCC(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)cc1	1844263366	WLJHATJAPPOCEV-UHFFFAOYSA-N	432.484	1.007	50	20	IDGD	
CC#CC[C@H](C(=O)N1CCCC12CN(C(=O)c1cccc(B(O)O)c1)C2)c1ccccc1	1844334911	AUYKUTGYLFMKDN-QFIPXVFZSA-N	430.313	1.381	50	20	IDGD	
CC[C@H](C)[C@@H](O)C(=O)N1CC2(CCCN2C(=O)c2cc([N+](=O)[O-])ccc2OC(C)=O)C1	1844692015	YGTJHPMDWXIYHM-SCLBCKFNSA-N	433.461	1.744	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2ccc(C(F)(F)F)cc2)C1	1844948047	YZPVFKVYXSGRBP-UHFFFAOYSA-N	447.417	1.835	50	20	IDGD	
C[C@@H]1CCC[C@H]1C(=O)N1CC2(CCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)C1	1845038860	BDMLENAHWGKQMY-UYAOXDASSA-N	441.576	1.972	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC2(CCCN2C(=O)[C@@H]2CC[C@H]3CCC(=O)N3C2)C1	1845068851	UDTBGSBPURDPDM-KFWWJZLASA-N	426.355	1.622	50	20	IDGD	
CCOC(=O)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)[C@@H](Cl)CC)C1	1845168723	WIMMCCFQBPCVQH-KBPBESRZSA-N	445.944	1.664	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@H](NC(=O)OC(C)(C)C)C1CC1)C2	1846362014	CFSSCQJNYREVGE-CABCVRRESA-N	429.945	1.747	50	20	IDGD	
CC(C)[C@@H](CC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl)NC(=O)OC(C)(C)C	1847563424	IMGZZXCGVJOHBZ-UGUYLWEFSA-N	431.961	1.727	50	20	IDGD	
Cc1nn2cc(CC(=O)N3CC[C@H]4[C@@H]3CCN4C(=O)CCBr)nc2s1	1847976539	PHOQVLGSMKMFGW-STQMWFEESA-N	426.340	1.629	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CCc1ccnc(C)c1	1848115396	QHLFYIAETAOKGJ-FMEPYYHXSA-N	436.516	1.658	50	20	IDGD	
COc1cc(C(=O)NNC(=S)Nc2cc(C)ccc2C)cc(OC)c1OCC(N)=O	15665138	FSNKQGXMLZTLFQ-UHFFFAOYSA-N	432.502	1.816	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)CCn2c(=O)[nH]c(=O)c3ccccc32)cc1	18071868	HWIGFVBGLWXKTH-CQSZACIVSA-N	440.456	1.094	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)Nc2ccc(S(N)(=O)=O)cc2)c2ccccc2c1=O	18178441	DVBIWJNTXCNBJF-UHFFFAOYSA-N	444.473	1.091	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)CN2C(=O)N[C@](C)(C3CC3)C2=O)cc1OC	24288203	WYIPEUPROKRCNB-OAQYLSRUSA-N	432.477	1.356	50	20	IDGD	
CCN(Cc1ccccc1)C(=O)CNC(=O)NNC(=O)c1cc(OC)c(OC)c(OC)c1	115810354	XRDXKCRAHOTSSW-UHFFFAOYSA-N	444.488	1.705	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCN(c2ccc(C#N)cc2F)CC1	725803866	RWYUFMJQFPIJBA-UHFFFAOYSA-N	445.882	1.943	50	20	IDGD	
Cc1cc(C)c(NC(=O)CN(C)C(=O)NNC(=O)CNC(=O)c2cccs2)c(C)c1	725873377	YBWMCRUXPRRWMN-UHFFFAOYSA-N	431.518	1.714	50	20	IDGD	
O=C(CN1C(=O)Cn2c(cc3ccccc32)C1=O)NNC(=O)c1cc(Cl)ccc1O	725881770	XQUYJJBPNCUIHW-UHFFFAOYSA-N	426.816	1.444	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)c1ccc(-n2ncc(C#N)c2N)cc1	727241193	HFHOIAZFXRORPY-UHFFFAOYSA-N	428.456	1.699	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@@H](C(=O)NNC(=S)NCC3CCC3)C2)s1	727865996	JXCPYTPUNOYVLR-CQSZACIVSA-N	430.621	1.753	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)c2cc(F)ccc2Br)cc1	728550996	SKTMDBGERCXQSO-UHFFFAOYSA-N	444.282	1.913	50	20	IDGD	
O=C(NNC(=O)N1CCO[C@H](c2cccc(F)c2)C1)C1CCN(c2ncccn2)CC1	728961667	KQNPHIYJRDWFST-SFHVURJKSA-N	428.468	1.646	50	20	IDGD	
CC[C@@H](NC(=O)NNC(=O)Cn1ccc2ccccc21)c1cccc(S(N)(=O)=O)c1	729499961	CGTSOINIXOZLBW-QGZVFWFLSA-N	429.502	1.770	50	20	IDGD	
CCCCC(=O)N1CSC[C@@H]1C(=O)OCC(=O)NNC(=O)c1ccc(Cl)cc1	730329623	AAEQBLQXNAEDEK-CQSZACIVSA-N	427.910	1.736	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2ccc(OCC(N)=O)cc2)cc1Br	732445023	WUOUAIIKBHOXCJ-UHFFFAOYSA-N	437.250	1.788	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)c1cc(=O)c2cc(Br)ccc2[nH]1	732949224	GYPHEDJONBFUGA-KRWDZBQOSA-N	444.241	1.892	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)NCCn2cccn2)cc1	734126143	VATLXOWFWPBHOT-GHRIWEEISA-N	433.472	1.354	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)N[C@@H]3CCN(C4CCN(C)CC4)C3)n[nH]2)cc1	734282730	CGSZZAJADRMEFE-QGZVFWFLSA-N	425.537	1.498	50	20	IDGD	
O=C(COC(=O)c1cccc(CN2CCOCC2)c1)NNC(=O)c1cccc(Cl)c1	741334513	NUJQMOXAQCRAQI-UHFFFAOYSA-N	431.876	1.790	50	20	IDGD	
O=C(NNc1ccc(Cl)nc1)[C@@H]1CCCN1S(=O)(=O)c1cccc([N+](=O)[O-])c1	743817978	JOADFIADJKUENL-AWEZNQCLSA-N	425.854	1.940	50	20	IDGD	
Cc1c(/C=C(\C#N)C(=O)O[C@H](C)C(=O)N2CCN(C(=O)c3ccco3)CC2)cc(C#N)n1C	744633844	ZZDNQADVNDKAGV-YCPFAOKUSA-N	449.467	1.621	50	20	IDGD	
COc1cc(OC)c(CCNC(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)c(OC)c1	745809969	DSDRQHKOYAUGJE-UHFFFAOYSA-N	434.405	1.513	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)CSCc2cscn2)c1	746782071	SCZRGBNKEIZWFX-UHFFFAOYSA-N	442.588	1.868	50	20	IDGD	
Cc1c(C(=O)O)cc(Br)cc1S(=O)(=O)NNC(=O)NCc1ccco1	747609442	SDHCKAXXQDZNSY-UHFFFAOYSA-N	432.252	1.741	50	20	IDGD	
COc1cc(S(=O)(=O)NNC(=O)c2cccc(OC)c2O)ccc1Br	747609792	UKCYDRMNIXSILR-UHFFFAOYSA-N	431.264	1.795	50	20	IDGD	
COc1cc(NC(=O)c2ccccc2)c(C(=O)NNC(=O)C(=O)NC(C)C)cc1OC	747625746	FGDDITJUAQMPBQ-UHFFFAOYSA-N	428.445	1.242	50	20	IDGD	
O=C(COC(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1)NNC(=O)c1ccc(Cl)cc1	747682974	RSTTZXIJNLYBLR-UHFFFAOYSA-N	444.791	1.447	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NCCc3ccc(F)cc3)cc2)CC1	747824887	UUOXSZMIBMFWRL-UHFFFAOYSA-N	435.525	1.631	50	20	IDGD	
C[C@H](C(=O)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1)N1C(=O)NC2(CCCC2)C1=O	748520547	RPDGPKGHXADXCS-SNVBAGLBSA-N	448.423	1.676	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1CC(CC(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1)C2	748529349	OIWBTMWXRIHWER-KKUMJFAQSA-N	444.554	1.072	50	20	IDGD	
COc1ccccc1C(=O)N[C@@H](CCS(C)(=O)=O)C(=O)NNc1ccc(F)cc1C	748551251	FFFGONXVWYEGPS-KRWDZBQOSA-N	437.493	1.819	50	20	IDGD	
O=C(O)Cc1ccc(S(=O)(=O)NNC(=O)c2ccc(F)cc2Br)cc1	748639989	JYHZTAIXVNMPMX-UHFFFAOYSA-N	431.239	1.839	50	20	IDGD	
CNS(=O)(=O)c1csc(C(=O)NNC(=O)COc2ccc(Br)cc2)c1	748690729	AUBCARATCULZHP-UHFFFAOYSA-N	448.320	1.259	50	20	IDGD	
CNS(=O)(=O)[C@H]1CCN(C(=O)NNC(=O)c2ccc(Br)cc2Cl)C1	749818569	AFSWUCSTYHUGEJ-VIFPVBQESA-N	439.719	1.080	50	20	IDGD	
COc1ccccc1N1CC[C@H](CNC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])C1	750330919	MWYPIQXYNUCLGF-OAHLLOKOSA-N	443.460	1.839	50	20	IDGD	
O=C(COC(=O)c1cccc(C(F)(F)F)c1F)NNC(=O)[C@H]1COc2ccccc2O1	750981345	QIEABONDLOOUJT-CQSZACIVSA-N	442.321	1.989	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@@H](C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)C1	751060719	KRSZZCBDTPTHGX-HZPDHXFCSA-N	438.550	1.045	50	20	IDGD	
COc1cc(-n2cccc2)c(Cl)cc1C(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1	751360336	CIVIKTMHJLMYNR-LLVKDONJSA-N	426.882	1.270	50	20	IDGD	
O=C(NCc1c(F)c(F)cc(F)c1F)NNC(=O)c1csc(N2CCOCC2)n1	753043540	VSDFQMBEDLYSPP-UHFFFAOYSA-N	433.387	1.680	50	20	IDGD	
Cc1oc(C(=O)NNC(=O)c2cc(F)ccc2Br)cc1S(=O)(=O)N(C)C	753607912	HXVWDMQBAKNDAR-UHFFFAOYSA-N	448.270	1.815	50	20	IDGD	
CCn1nccc1C=NNC(=O)C[C@@H]1c2cc(OC)c(OC)cc2CCN1S(C)(=O)=O	753689148	BEJJBBCARAEBSU-QGZVFWFLSA-N	449.533	1.319	50	20	IDGD	
O=C(NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)N[C@@H]1[C@H]2CCO[C@H]2C12CCC2	754675450	OBJHVMVXPFAJCA-KZNAEPCWSA-N	448.545	1.373	50	20	IDGD	
CCOc1ccccc1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	755405687	OONCXFIXOWYPCJ-UHFFFAOYSA-N	448.501	1.573	50	20	IDGD	
CCS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)cc1	755599967	PJIMUYPJOXIBEV-UHFFFAOYSA-N	437.474	1.973	50	20	IDGD	
C[C@H]1C[C@@H](C)C[C@]2(C1)NC(=O)N(CC(=O)NNC(=O)[C@H](C)Oc1ccccc1F)C2=O	756866542	DTYWZFWXQVIHIX-RZNKXZLBSA-N	434.468	1.487	50	20	IDGD	
Cc1cc(C#N)ccc1Oc1ccc(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)cc1	756923305	YDWXLUFBEBZKIC-MRXNPFEDSA-N	428.470	1.790	50	20	IDGD	
CN(c1ccccc1NC(=O)NNC(=O)c1cnn(-c2ccccc2)c1)S(C)(=O)=O	757661763	QWZNXOVTGFXQRJ-UHFFFAOYSA-N	428.474	1.735	50	20	IDGD	
COc1c(NC(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)cccc1C(N)=O	757996227	FQNFTAWRBOJBEK-UHFFFAOYSA-N	438.444	1.551	50	20	IDGD	
COc1cn(-c2ccccc2)nc1C(=O)N1CCN(S(=O)(=O)CBr)CC1	758534421	GQLGHKIFGSVCMP-UHFFFAOYSA-N	443.323	1.321	50	20	IDGD	
CC(C)(C)c1nnc(CNC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)s1	758875664	OYMCEHARJRCUJK-UHFFFAOYSA-N	426.524	1.775	50	20	IDGD	
CS(=O)(=O)c1ccc(CNC(=O)NNC(=O)COc2ccccc2C#N)cc1Cl	759390828	VXEDSIBBTINMKV-UHFFFAOYSA-N	436.877	1.525	50	20	IDGD	
CCNS(=O)(=O)c1ccc(CC(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)cc1	759391360	KKOHRNFCORWBEO-UHFFFAOYSA-N	433.515	1.440	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)[C@H]2CCCN(S(=O)(=O)Cc3ccccc3)C2)nc1	759728710	HMYAAMJIAFXPMS-KRWDZBQOSA-N	432.502	1.553	50	20	IDGD	
Cc1noc(C[C@@H](NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c2ccccc2)n1	759875079	MTDNPIACZBJMFV-QGZVFWFLSA-N	443.485	1.710	50	20	IDGD	
CCn1c(=O)n(CC)c2nc(NC(=O)CCC(=O)NNC(=O)c3cc(C)oc3C)ccc21	760209715	LPVWFVVYEPLFCA-UHFFFAOYSA-N	442.476	1.628	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)N[C@@H]1CCN(Cc2ccccc2)C1=O	761674318	YUPIWSUIIXMILJ-MRXNPFEDSA-N	428.514	1.919	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)CN2C(=O)N[C@@](C)(c3ccc(F)cc3)C2=O)n1	762910100	WPOBAMOLOKPKNX-FQEVSTJZSA-N	429.456	1.372	50	20	IDGD	
CN(C)C(=O)COc1cccc(CNC(=O)NNC(=O)CSc2ccccc2O)c1	763463202	QDPLTNRKHSHGBN-UHFFFAOYSA-N	432.502	1.482	50	20	IDGD	
CNC(=O)c1ccc(OC)c(NC(=O)C(=O)NNC(=O)c2cc(C)nc3ccccc23)c1	763617102	SSVZKJJEFPARNU-UHFFFAOYSA-N	435.440	1.311	50	20	IDGD	
CCc1cc(O)nc(-c2cccc(NC(=O)C(=O)NNC(=O)COc3cccc(C)c3)c2)n1	763622292	BLMQJKJRHYKJGE-UHFFFAOYSA-N	449.467	1.885	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2ccccc2N2C[C@@H](C)O[C@H](C)C2)c1	763623791	NIIFABKYSCVYIC-IAGOWNOFSA-N	440.500	1.774	50	20	IDGD	
COC(=O)c1ccsc1NC(=O)C(=O)NNC(=O)COc1cccc(C(F)(F)F)c1	763640896	RAIWTKNEHQLCSV-UHFFFAOYSA-N	445.375	1.718	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)C(=O)N2CCc3ccc(Br)cc32)cc1	763675394	VNDVBZXCVWBCAD-UHFFFAOYSA-N	443.257	1.436	50	20	IDGD	
Cc1ccccc1-n1nccc1NC(=O)C(=O)NNC(=O)COc1ccc(Cl)cc1	763687021	YRFSNDPQEKZRCV-UHFFFAOYSA-N	427.848	1.999	50	20	IDGD	
O=C(CN1CCCc2ccccc21)NNC(=O)C(=O)Nc1cccc(CN2CCCC2=O)c1	763746443	VOWCXGUCPHOOAR-UHFFFAOYSA-N	449.511	1.348	50	20	IDGD	
CCCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cccc(N(C)C)c2)cc1Cl	763753126	FUUVRJSELSWYBJ-UHFFFAOYSA-N	445.907	1.946	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2ccnn2Cc2cccc(C)c2)c1	763775206	OBUCAMGIGAKYHI-UHFFFAOYSA-N	437.456	1.657	50	20	IDGD	
Cc1cc(C)nc(-n2nc(C(=O)OCC(=O)NNC(=O)c3cccc(C#N)c3)cc2C)n1	763778361	JKZJJGFKMXXRKP-UHFFFAOYSA-N	433.428	1.077	50	20	IDGD	
C=CCN(CC=C)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)Cn2nc(C)cc2C)cc1	763891612	PXCQCZALGXUVSS-UHFFFAOYSA-N	438.488	1.100	50	20	IDGD	
O=C(CCSc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccc(-n2nccn2)nc1	763902600	OMEWJUURLLDQJR-UHFFFAOYSA-N	429.437	1.070	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)cc1[N+](=O)[O-]	763999275	UTXNWELPCREONE-UHFFFAOYSA-N	426.183	1.094	50	20	IDGD	
Cc1nc(-c2ccccc2NC(=O)C(=O)NNC(=O)c2cc(Br)cn2C)no1	764004649	KLWGDTUENQCEEJ-UHFFFAOYSA-N	447.249	1.546	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc(S(=O)(=O)C2CCCC2)cc1	764040839	NNQWJOWNIBHLBE-UHFFFAOYSA-N	445.497	1.811	50	20	IDGD	
CCCCNS(=O)(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2ccccc2OC)c1	764041355	SFTGFOXTYRSWQC-UHFFFAOYSA-N	448.501	1.173	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccc(N2CCOCC2)c(C)c1	764138391	CUVJFWJSYQOTEL-UHFFFAOYSA-N	426.473	1.169	50	20	IDGD	
C[C@H](C(=O)NNc1c(F)cc(C(=O)NC2CC2)cc1F)N1C(=O)NC2(CCCC2)C1=O	764334611	NETNJUNXGWJOJH-SNVBAGLBSA-N	435.431	1.553	50	20	IDGD	
Cc1nc(CCNC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)sc1C	764373479	MGKYTOGFOLSTHA-UHFFFAOYSA-N	430.578	1.845	50	20	IDGD	
Cc1cc(S(C)(=O)=O)ccc1NC(=O)C(=O)NNC(=O)c1cc(-c2cccs2)[nH]n1	764383232	YSYSOTAALHZYRM-UHFFFAOYSA-N	447.498	1.250	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3nc4c(s3)COCC4)n[nH]2)cc1	764385352	YSTPAWGGNSLGDB-UHFFFAOYSA-N	440.485	1.568	50	20	IDGD	
CCn1nnnc1-c1cccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2F)c1	764409942	BUEDWWHWUMBYKE-UHFFFAOYSA-N	431.815	1.552	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2cncc(NC(C)=O)c2)cc(OC)c1C(C)C	764433153	KURUSKBNBIBVMO-UHFFFAOYSA-N	443.460	1.580	50	20	IDGD	
CN(CC(=O)NNc1ccc(S(=O)(=O)Nc2nccs2)cc1)[C@H]1CCSC1	764494058	KJMFTQHUAMVUGI-ZDUSSCGKSA-N	427.577	1.824	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNS(=O)(=O)c2cccc3nonc23)cc1	765025501	LUMPCEJLUJUXJF-UHFFFAOYSA-N	445.486	1.267	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CC(F)F)C(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	766075119	JAJLJDSRFUILET-LBPRGKRZSA-N	439.419	1.887	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(=CC(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)C1	766150800	YPJKDLMVIPKPAO-UHFFFAOYSA-N	434.405	1.076	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1cccc(-c2nnc3n2CCCCC3)c1C	766261449	ZXEFWNDVMKKEOF-UHFFFAOYSA-N	436.476	1.860	50	20	IDGD	
CCC(=O)N1CCC[C@H](C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)C1	766664923	XSUJPSDYLFTZSK-SFHVURJKSA-N	449.983	1.254	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)c3cccc(S(=O)(=O)Cc4ccccc4)c3)nc21	770971420	IZEUZGXOKSUYOV-UHFFFAOYSA-N	438.469	1.800	50	20	IDGD	
O=C(Cn1cc(Br)c(O)nc1=O)NNc1ccc(Br)c(F)c1	771678575	ILPJRNILYZDNDC-UHFFFAOYSA-N	436.035	1.756	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)c2cccc(-c3cnc4nc(O)n(C)c4c3)c2)c1	771826362	OHHRZIOKQFUUBS-UHFFFAOYSA-N	445.439	1.769	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1cccc(S(=O)(=O)NCc2cccs2)c1	771901243	HOCUDNFPZBTWQZ-GFCCVEGCSA-N	439.515	1.329	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)[C@H]1CC(=O)N(c2ccccc2Br)C1	771986270	VWHXXULRGJSLHQ-MNOVXSKESA-N	426.267	1.291	50	20	IDGD	
CC(C)(C)NS(=O)(=O)Cc1cccc(NC(=O)C(=O)NNc2ccc(C#N)cc2)c1	773697910	XLBZRJMNIPCVJH-UHFFFAOYSA-N	429.502	1.858	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)Nc3ccnn3[C@@H]3CCS(=O)(=O)C3)n[nH]2)cc1	776060373	WQVNKVIPCBKPTH-CQSZACIVSA-N	443.489	1.408	50	20	IDGD	
CS(=O)(=O)CCOc1cccc(NC(=O)NNc2cccc(S(C)(=O)=O)c2)c1	776468950	HFITZUYLMXOYBI-UHFFFAOYSA-N	427.504	1.662	50	20	IDGD	
COC(=O)N1CCC([C@@H](C)NC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)CC1	776921365	KVBRIMVTKSWPNU-CYBMUJFWSA-N	430.465	1.389	50	20	IDGD	
CCOC(=O)N1CCC[C@H]([C@@H](C)NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)C1	776929909	GXDVKUQJXBPHAU-HIFRSBDPSA-N	440.522	1.291	50	20	IDGD	
O=C1CN(S(=O)(=O)c2cccc(C(=O)NNc3ccc4ccccc4n3)c2)CCN1	777468332	VRYLBFWTVVZRPX-UHFFFAOYSA-N	425.470	1.112	50	20	IDGD	
CCOC(=O)c1sc([C@H](C)NC(=O)NNC(=O)CNC(=O)OC(C)(C)C)nc1C	778701100	KYLFRFPHLHDRCO-JTQLQIEISA-N	429.499	1.544	50	20	IDGD	
C[C@@H](NC(=O)OC(C)(C)C)[C@@H]1CCN(CC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)C1	778973906	BMASWZGYBKGGAT-UKRRQHHQSA-N	435.481	1.591	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)c1cccc(NS(=O)(=O)C(F)(F)F)c1	782551642	AXBNCKOWBOUDRW-UHFFFAOYSA-N	431.392	1.926	50	20	IDGD	
C[C@@H](Sc1ccccc1)c1ccc(NC(=O)C(=O)NNC(=O)C(=O)NC2CC2)cc1	782966516	NMMKFRVDNGBGIM-CYBMUJFWSA-N	426.498	1.904	50	20	IDGD	
CCc1ccc(NC(=O)C(=O)NNc2ncccc2C(F)(F)F)cc1S(N)(=O)=O	783118370	PQKDNKJQFSRVQF-UHFFFAOYSA-N	431.396	1.392	50	20	IDGD	
Cc1ccc(NNC(=O)C(=O)Nc2ccc3c(ccn3CC(=O)N3CCOCC3)c2)cc1	783345032	QNHUXIKYFOEFKG-UHFFFAOYSA-N	435.484	1.890	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2ccc(-n3cccn3)nn2)nn1-c1cccc(Cl)c1	783432816	DSEXIRTXMLEUHC-UHFFFAOYSA-N	437.851	1.892	50	20	IDGD	
Cn1c(=O)ccn(CC(=O)NS(=O)(=O)c2ccc(S(F)(F)(F)(F)F)cc2)c1=O	783463914	XFORLICHWFYYCA-UHFFFAOYSA-N	449.379	1.710	50	20	IDGD	
Cn1c(C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)cc2c(=O)n3ccccc3nc21	784456264	LEVGEEBIVXCLMF-UHFFFAOYSA-N	445.414	1.790	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)C(=O)Nc2ccc(C(=O)NCC(F)(F)F)cc2)c1	784851739	NDPJPGZITRQXLX-UHFFFAOYSA-N	438.362	1.847	50	20	IDGD	
O=C(NNc1cccnn1)C(=O)Nc1ccc(OCCN2C(=O)c3ccccc3C2=O)cc1	784858545	PYPKQGBBAIVXSE-UHFFFAOYSA-N	446.423	1.233	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)Nc1ccnn1-c1ccc(Cl)cc1	785023924	QFJWEAGUDZIZTJ-UHFFFAOYSA-N	444.791	1.539	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2cc(F)cc(OC)c2)cc1	785241106	BUWFZIFSMINZDX-UHFFFAOYSA-N	438.481	1.947	50	20	IDGD	
Cn1nccc1COCC(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	785767597	KHJKCIBXGWYVKL-UHFFFAOYSA-N	446.471	1.100	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN1C1CC1)c1nn(Cc2ccccc2)c(=O)c2ccccc12	786638967	KQSCEVOEEKJZIT-FQEVSTJZSA-N	431.496	1.833	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCc2ccc(F)c(F)c2)c1	786829749	AATVHOBNKHELKL-UHFFFAOYSA-N	426.445	1.402	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc(C)c(C(=O)N(C)C(C)C)c1	787543313	HTPJJYOKSKYTKC-UHFFFAOYSA-N	426.473	1.884	50	20	IDGD	
Cc1cn(-c2c(F)cccc2F)nc1C(=O)OCC(=O)NNC(=O)c1ccc(C#N)cc1	787836013	VBYDYYWZCXMKKU-UHFFFAOYSA-N	439.378	1.949	50	20	IDGD	
NS(=O)(=O)c1ccccc1NNC(=O)c1ccc(=O)n(Cc2ccccc2Cl)c1	788229413	XAMKKGPEYHIQAU-UHFFFAOYSA-N	432.889	1.954	50	20	IDGD	
O=C(NNC(=O)c1cc(F)ccc1Br)C(=O)Nc1cccc(N2CCC2=O)c1	790952936	UNBVLJLRNHBAJL-UHFFFAOYSA-N	449.236	1.725	50	20	IDGD	
CCOc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NNc1cccc(F)c1[N+](=O)[O-]	790994396	WMPDVRMGJRHMNM-UHFFFAOYSA-N	433.396	1.916	50	20	IDGD	
CCc1c(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)cnn1C(CC)CC	792267041	DZKWDFDIWAKCNY-UHFFFAOYSA-N	426.477	1.843	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc(Cc2nnc3n2CCC3)cc1	792268231	FXUIEUCZDCHSKO-UHFFFAOYSA-N	434.456	1.223	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)cc(-n2cccn2)c1	792355333	FYDUFODZCDGRFN-UHFFFAOYSA-N	441.469	1.465	50	20	IDGD	
CC(=O)NC[C@H]1CCn2ncc(C(=O)NNC(=O)[C@@H](C)Oc3ccc4ccccc4c3)c2C1	792736023	DYIRIIDRHGOYME-WBVHZDCISA-N	449.511	1.963	50	20	IDGD	
COCCOC1CCC(C(=O)N2CCN(S(=O)(=O)CBr)CC2)CC1	793775279	KHXMKTVUTYEBSP-UHFFFAOYSA-N	427.361	1.035	50	20	IDGD	
CNS(=O)(=O)N1CCC(C(=O)NNC(=O)c2cc3c(s2)CCCCCC3)CC1	794784179	LJHXGQXXAPZAKZ-UHFFFAOYSA-N	428.580	1.344	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)[C@H]1CN(C(=O)OC(C)(C)C)CCO1	795169443	PVXOUJGVEMPFKD-CQSZACIVSA-N	428.511	1.016	50	20	IDGD	
COc1cc(OC)c(NC(=O)C(=O)NNC(=O)c2cccc(C)n2)cc1Br	797371202	RAANTRKFHPMGGS-UHFFFAOYSA-N	437.250	1.569	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@@H]2C(=O)NNC(=O)CCNC(=O)OC(C)(C)C)cc1	799102464	DCRCZZGWWUPBEF-MRXNPFEDSA-N	434.493	1.362	50	20	IDGD	
COC(=O)c1cccc(NC(=O)C(=O)NNC(=O)COc2ccccc2F)c1OC(C)C	799258055	YVTDUHPBJOTFMR-UHFFFAOYSA-N	447.419	1.564	50	20	IDGD	
O=C(CO)NNC(=O)C(=O)Nc1ccc(Oc2cccc(F)c2)c(Br)c1	799835184	MVCYXRAFLNGZEH-UHFFFAOYSA-N	426.198	1.459	50	20	IDGD	
CCc1cccc(C)c1NNC(=O)C(=O)Nc1c(C)nn([C@H]2CCS(=O)(=O)C2)c1C	799842391	DSRUGZXDNCTAMT-INIZCTEOSA-N	433.534	1.812	50	20	IDGD	
O=C(Cc1ccccn1)NNC(=O)C(=O)Nc1ccc(F)cc1OCCC(F)(F)F	800623501	QFCZFVZXGUVSFW-UHFFFAOYSA-N	428.342	1.881	50	20	IDGD	
COC(=O)[C@@H]1C[C@@H]2[C@H](CC[C@H](C)N2CC(=O)NNC(=O)c2cc(Cl)ccc2OC)O1	801601290	LRMSFKSVYQESIU-ISGYEWALSA-N	439.896	1.293	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)[C@H]2CCCN2C(=O)C(F)(F)F)n[nH]1	807084444	LMUIZQFDYZYFRP-CYBMUJFWSA-N	425.367	1.400	50	20	IDGD	
C[C@@H]1CN(c2ccc(NC(=O)C(=O)NNc3nccnc3C3CCC3)cn2)C[C@@H](C)O1	807460336	OAMIPHDKCHFDKI-ZIAGYGMSSA-N	425.493	1.835	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc2ccccc2c1)NNC(=O)c1ccc(Cl)cc1O	810176870	ALIDVDHQLWBQOY-UHFFFAOYSA-N	433.873	1.938	50	20	IDGD	
CC(C)Nc1ccc(S(=O)(=O)NCC(=O)NNc2ccc(Cl)nn2)cc1[N+](=O)[O-]	810420076	ZVTFSUBAWTYJSM-UHFFFAOYSA-N	443.873	1.280	50	20	IDGD	
Cc1cc(SC(C)(C)C)ccc1NC(=O)C(=O)NNC(=O)[C@@H]1CCc2nncn2C1	815691463	RBPROFOAJPCWMP-CYBMUJFWSA-N	430.534	1.826	50	20	IDGD	
CCOC(=O)c1ccc(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)nc1	815734631	QNERDEUHMZOBAN-UHFFFAOYSA-N	434.474	1.036	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)[C@@H]2CN(Cc3ccccc3)CCO2)C1	816510028	KQOATOOZBXXBMW-OALUTQOASA-N	446.548	1.682	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)[C@H]2CN(Cc3ccccc3)CCO2)C1	816510029	KQOATOOZBXXBMW-RBUKOAKNSA-N	446.548	1.682	50	20	IDGD	
COc1ccc([N+](=O)[O-])cc1NS(=O)(=O)c1cc(C(=O)NNC(C)=O)ccc1OC	913173188	ASMAEKLPSVWQON-UHFFFAOYSA-N	438.418	1.194	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)CN2C(=O)c3ccccc3N3C(=O)CC[C@]23C)cc1	914830510	ZIOVHBXPEKSKKE-HSZRJFAPSA-N	436.468	1.520	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NCc3ccc(Cl)cc3)nc2)CC1	915879470	ZHAACJNCYMJAQS-UHFFFAOYSA-N	438.941	1.497	50	20	IDGD	
O=C(NCCN1CCOCC1)NNC(=O)c1cn(-c2ccccc2)nc1-c1ccccc1	915884992	ZJSOPYDYDWULNT-UHFFFAOYSA-N	434.500	1.816	50	20	IDGD	
CC1CCN(CCCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)CC1	916194848	DGZVSJKRLVIYTL-UHFFFAOYSA-N	425.555	1.003	50	20	IDGD	
COc1cc(CCNC(=O)NNc2ccc(-n3cccn3)nn2)c([N+](=O)[O-])cc1OC	916218818	GUMQBAVIXQXCQW-UHFFFAOYSA-N	428.409	1.457	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCCCOc2ccccc2F)c2ccccc2c1=O	916222446	DKCKSTIWDKBRJU-UHFFFAOYSA-N	427.436	1.969	50	20	IDGD	
COc1ccc(C(C)=NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1OC	916259181	YFZIBXHQJAUVTA-UHFFFAOYSA-N	447.513	1.879	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)NCCNS(=O)(=O)c2ccccc2)c2ccccc2n1	916294704	FWNLRQFDHGHIKF-UHFFFAOYSA-N	427.486	1.466	50	20	IDGD	
CCN(CC)C(=O)c1ccc(CNC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1	916388933	FABBQMDIDAJRJA-UHFFFAOYSA-N	446.529	1.716	50	20	IDGD	
CC[C@H](C)NS(=O)(=O)c1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)cc1	916562207	NCPQYNAZSPUEMU-HNNXBMFYSA-N	446.529	1.780	50	20	IDGD	
C[C@H](Cn1ccnc1)NC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	916623323	NUOVMLIOSSYIPC-CYBMUJFWSA-N	448.530	1.778	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)NCC(=O)NNC(=O)Cc2ccc3ccccc3c2)cc1	917196481	UOMRPMGTFPCZGI-UHFFFAOYSA-N	439.493	1.711	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)[C@@H](C)S(=O)(=O)c1ccc(F)cc1	917918122	WWQUHMVZUMNUTD-CYBMUJFWSA-N	432.477	1.748	50	20	IDGD	
CC(C)Oc1ccc(NS(=O)(=O)CC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1	918399801	WFJKHECOWYMLAV-UHFFFAOYSA-N	436.446	1.585	50	20	IDGD	
C[C@@H](Sc1nnnn1C1CC1)C(=O)NNC(=O)c1ccc(F)cc1Br	918645356	GQDWCXAYJRTALP-SSDOTTSWSA-N	429.275	1.851	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)c2cc(NS(C)(=O)=O)ccc2O)cc1	919806609	KJYTZHUOULJTDG-GFCCVEGCSA-N	437.474	1.391	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)NCc1ccc(CS(=O)(=O)NC(C)C)cc1	919898908	HQCGCACNALCKOM-UHFFFAOYSA-N	448.545	1.596	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)[C@@H](Cc2cccc(OC)c2)n2nnnc2C)cc1	920012278	LIABYVYEVOZMGY-HXUWFJFHSA-N	438.488	1.563	50	20	IDGD	
COCCCn1c(S)nc2cc(C(=O)NNC(=O)NCc3ccco3)ccc2c1=O	920858286	HSNQOHONPOQZKP-UHFFFAOYSA-N	431.474	1.459	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)cn1	1115852439	NUGFWBHOOFUMFD-UHFFFAOYSA-N	432.502	1.730	50	20	IDGD	
C[C@]12CCC(=O)N1c1ccccc1C(=O)N2CC(=O)NNC(=O)c1n[nH]c2c1CCCC2	1248613228	YTGRQHYFFHRUKE-JOCHJYFZSA-N	436.472	1.049	50	20	IDGD	
CCOC(Cn1cc(C(=O)NNC(=O)c2ccc(Br)cc2)nn1)OCC	1251519729	SGCPYTALRNYFLQ-UHFFFAOYSA-N	426.271	1.515	50	20	IDGD	
O=C(COC(=O)CCc1ccc2c(c1)CCO2)NNC(=O)[C@@H]1COc2ccccc2O1	1252827610	YTJWOOQELGXESQ-IBGZPJMESA-N	426.425	1.085	50	20	IDGD	
CCS(=O)(=O)c1cccc(NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c1	1320118845	RSCVRYOEALCUAQ-UHFFFAOYSA-N	425.488	1.350	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)NC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1	1326098790	UKEOVWVQADSRQG-YQQQUEKLSA-N	439.516	1.926	50	20	IDGD	
O=C1Cc2cc(C(=O)N3CC[C@]4(C3)CN(C(=O)[C@H](F)Br)CCO4)ccc2N1	1778392672	IKIJYWPMAWMGIJ-YJBOKZPZSA-N	440.269	1.315	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc4cn[nH]c4cn3)C2)C1	1778770598	ZALDYIIGWVOYRX-XIKOKIGWSA-N	436.310	1.432	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc(CO)o2)C1	1779706546	NTDAYVSDLLUNKT-URKNILKWSA-N	443.338	1.930	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H]2CC=CCC2)C1	1780679499	COUGPMOUFDOHNH-XKDCRVNJSA-N	441.532	1.169	50	20	IDGD	
CC(=O)N/C(C)=C/C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@](C)(Cl)CCl)C1	1780716729	NVBOFGXMKOYGRV-IZECBSCFSA-N	434.364	1.777	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](F)Br)C3)C2)c(O)c1	1781333810	JJKUGKAVOUNWMA-YOEHRIQHSA-N	431.258	1.535	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(CCN(C(=O)c3ccccc3-n3nccn3)C2)C1	1781839754	NMELQRJUOPBQHX-NRFANRHFSA-N	443.580	1.562	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1c(C)noc1N)C2	1781899745	FJLVPCWSXXGITR-VEVIJQCQSA-N	443.342	1.866	50	20	IDGD	
O=C(COc1ccccc1F)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2	1781905217	LXZAJETUMSLLTP-XAUMDUMWSA-N	428.888	1.318	50	20	IDGD	
COCc1oncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](Cl)COC)C1	1782172374	ANXNOUVWPCHQSC-ZSZQSSIHSA-N	429.901	1.202	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3nc4cc([N+](=O)[O-])ccc4[nH]3)C2)C1	1782187320	YULPVHFPBQEYLU-YJYMSZOUSA-N	435.868	1.932	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cnn4c(C)cc(C)nc34)CCO2)C1	1783874302	GNQFYJVFXRVSBR-OXJNMPFZSA-N	435.912	1.043	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(C)nc4ccc(O)cc34)CCO2)C1	1783875340	PVPSVHWBGAFXIK-GCJKJVERSA-N	447.919	1.946	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H]1CCC[C@@H](C(=O)OC)C1)CCO2	1783879211	PRLYVGBLZJKJHF-QOIOWGMHSA-N	430.929	1.050	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CCCN(C)C3)C[C@@H]21	1783971683	DYKISZGMIUOVQE-XAJHFOFHSA-N	430.387	1.339	50	20	IDGD	
COC(=O)Nc1cccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]3C2)c1	1784093454	ZNALMAOMALMDRQ-LLLHUVSDSA-N	439.896	1.058	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3c[nH]c4ncccc34)C[C@@H]21)[C@@H](O)CCl	1784097236	WSNLAAPVIBEEQZ-DKIMLUQUSA-N	434.924	1.075	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCNC(=O)c3ccc[nH]3)C[C@@H]21	1784616395	SYGRKWQJOFZITI-OVWQWFNUSA-N	438.956	1.522	50	20	IDGD	
COc1nccnc1C(=O)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1	1787087539	YPDFNWFCMZRELL-UHFFFAOYSA-N	446.272	1.227	50	20	IDGD	
COc1nccnc1C(=O)Nc1ccc(C2(NC(=O)CCC(=O)NN(C)C)CCC2)cc1	1787092084	DDWFDVMOZAIYME-UHFFFAOYSA-N	440.504	1.606	50	20	IDGD	
CCc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](Br)CC)C[C@@H]32)n[nH]1	1787169770	PSNAQHSPFUCQMM-PCBIJLKTSA-N	427.343	1.739	50	20	IDGD	
C[C@@H](NC(=O)c1ccccc1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]2C1	1787451475	SMGIDMITROEFPY-VFTHGPRRSA-N	425.888	1.319	50	20	IDGD	
COc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCBr)C[C@@H]32)ccn1	1788905452	QDEVNGFKZZRWMF-KKUMJFAQSA-N	426.311	1.469	50	20	IDGD	
C[C@H](NC(=O)c1ccc(F)cc1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21	1789695223	WARJPPOOXBVEJT-VCQFHVMDSA-N	443.878	1.458	50	20	IDGD	
C/C=C/C=C\C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C[C@@H]21	1790821765	OBCCQBFOPSEHLT-IUDORELMSA-N	427.505	1.232	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)c3ccccc3)C[C@@H]21	1790961470	LRQCJJLQKCXLSL-IECFSIQFSA-N	439.350	1.873	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](O)c1ccccc1	1795377484	SSVGESPYIWSSQG-RKOFLFEYSA-N	425.323	1.341	50	20	IDGD	
O=C(CNc1ccc(F)cc1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2	1795542194	JBUYMFOQDITOIM-IVWMJMPLSA-N	428.302	1.612	50	20	IDGD	
O=C(Cn1ccc2c(F)cccc21)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1	1796189711	QIDZMYBUPADCAB-REPLKXPHSA-N	449.291	1.412	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)c1cc(C(F)(F)F)ccn1	1796191896	MNVYHJKUXXZTPP-BJWYYQGGSA-N	447.222	1.346	50	20	IDGD	
CC[C@@H](CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Cl)NC(=O)OC(C)(C)C	1796367734	RTSZQDHUVOHZCO-KUCCMMOJSA-N	435.924	1.804	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc3nc[nH]c13)C2	1796892205	NHLNZNCUERNULH-CWNKPHDYSA-N	447.499	1.949	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1nccc3[nH]ccc13)C2	1796892212	OFOIWOWEHULWGT-CWNKPHDYSA-N	447.499	1.949	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cn2ccc(Cl)cc2n1	1797108253	PUUVEUHFRUBYSS-DMVWFOPNSA-N	441.315	1.445	50	20	IDGD	
CN(CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CC1(F)F)NC(=O)NCc1ccccc1	1797736230	FAJHHIBJKHGLAI-MHORFTMASA-N	449.502	1.626	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cc1ccc(F)cc1)C2	1798439191	NMINDGZHYCLSFW-BJWYYQGGSA-N	425.464	1.319	50	20	IDGD	
C/C(=C\c1cccnc1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnccc1C(=O)NN	1798443650	SAYBPNKBSKKZPJ-XOXKHUMBSA-N	434.500	1.435	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccncc1Cl	1798744829	XZCVMBZSDBQGSI-CLLJXQQHSA-N	428.880	1.299	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cn1ccc3sccc3c1=O)C2	1799263462	MBBCEZSAGIWEON-ZFHGCVPZSA-N	437.949	1.670	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnn3ccccc13)C2)[C@H](F)Br	1799347298	KYWOGCXEAYIFIS-JLUCKKNBSA-N	425.258	1.228	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CCOC1	1801517643	RLVGZONAXOENJN-ULNPWSCNSA-N	431.439	1.498	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CCC(=O)NN(C)C)c1	1802344049	NBNZWACDDFYCQG-REPLKXPHSA-N	429.521	1.270	50	20	IDGD	
Cc1nnc(CCC(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)s1	1803142412	WRFUFXDGMSNGMO-RVKKMQEKSA-N	437.953	1.480	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cc3cccnn3c2)[C@H]1c1cccnc1)[C@@H](O)CCl	1803148853	XXXLMVCROIGMQS-SNRMKQJTSA-N	427.892	1.649	50	20	IDGD	
O=C(Cc1cccnc1Cl)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1	1804357970	ACJPVRMKNUEFCG-XYJFISCASA-N	437.327	1.978	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC2(CCCN(C(=O)C3(C)COC3)C2)CC1	1805028254	WSFUZFSZEOLFSC-LFVJCYFKSA-N	429.521	1.388	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC2(CCN(C(=O)CCn3cncn3)CC2)C1	1805388875	DFJBTBDVIASECU-HNNXBMFYSA-N	426.359	1.930	50	20	IDGD	
N[C@H](C(=O)N1CC[C@@H](CNC(=O)CCBr)[C@H]1c1cccnc1)c1ccccn1	1806341169	ZIZUVDQUKGEYKQ-ZYSHUDEJSA-N	446.349	1.967	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC2(CCCN(C(=O)Cn3nnc4ccccc43)C2)CC1	1806513980	ZOMLFVNGYKPBAL-MRXNPFEDSA-N	433.940	1.916	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC2(CCCN(C(=O)c3cc(C(=O)O)ncn3)C2)CC1	1807577012	MOZIVFPSPPDVTD-GFCCVEGCSA-N	439.310	1.803	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)Cc2ccccn2)[C@H]1c1cccnc1	1807655674	LCVGHHAGAGIFDQ-WZONZLPQSA-N	438.532	1.098	50	20	IDGD	
O=C(/C=C/C1CCCC1)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1808482470	XPMLEUPSBSWUOY-HFXZDLCHSA-N	447.344	1.827	50	20	IDGD	
CC(=O)C(=O)N1CCCC2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)CC2)C1	1808992294	LNWRWPPBBBOJCU-UHFFFAOYSA-N	443.548	1.153	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2cnn3ccncc23)[C@@H]1c1cccnc1	1809390158	WVHRTSHJNSMKFJ-AYBZRNKSSA-N	442.907	1.698	50	20	IDGD	
CC(C)/C=C/C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1	1810309354	QLHMAZVCUOKPAH-RAIXIZIVSA-N	436.516	1.612	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)CSc2ncccn2)[C@H]1c1cccnc1	1813031823	SVFRQRKVWNWGAU-BQFCYCMXSA-N	449.964	1.924	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CN2CCCCC2=O)[C@@H]1c1cccnc1)C(Cl)Cl	1813081768	ZZXHTNYUKCNGOX-WMLDXEAASA-N	427.332	1.904	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)CSCC(=O)O)[C@@H]1c1cccnc1	1813088704	LSWVIXOEBWMZNF-GHJWDPDVSA-N	444.351	1.689	50	20	IDGD	
CCOC(=O)C(C)(C)C(=O)NC[C@@H]1CCN(C(=O)[C@H](Cl)COC)[C@@H]1c1cccnc1	1814174766	YTPGWDBEHWGDLO-GVDBMIGSSA-N	439.940	1.931	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)CNCP(=O)(O)O)sc2C1	1814763719	ZYNUHZPKSDPCRH-ZJUUUORDSA-N	438.874	1.187	50	20	IDGD	
CN1CCCn2nc(C(=O)N3CCCC[C@@H]3c3cc(NC(=O)[C@@H](O)CCl)n[nH]3)cc2C1	1814875074	NULHBBUGBITKAX-SJORKVTESA-N	449.943	1.347	50	20	IDGD	
Cc1ncccc1C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1	1815339966	XYPJSWCGXOAKND-OAHLLOKOSA-N	436.302	1.066	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CC(F)(F)F)n[nH]1	1817102237	CRHWRQGTFYQRIQ-CYBMUJFWSA-N	439.398	1.667	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(=O)n3[nH]cnc3n2)n[nH]1	1817467308	MYXNBHXNTGBCRV-GXFFZTMASA-N	432.872	1.464	50	20	IDGD	
Cc1ccnc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cnccc3C(=O)NN)n[nH]2)c1	1819402960	POPDQHRBYVGDIG-SFHVURJKSA-N	448.487	1.731	50	20	IDGD	
CCc1cc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)no1	1819887217	OSQVZDMLKVPIQL-SFHVURJKSA-N	437.265	1.260	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1)c1ccccc1-n1nccn1	1821203624	CZWYLLKLQOQJFE-IRXDYDNUSA-N	443.895	1.896	50	20	IDGD	
COC1(CC(=O)N2CCCC[C@@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)CCC1	1822417773	NOHMBMBZYMFRKF-MRXNPFEDSA-N	434.541	1.734	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CN2C(=O)C=CC2=O)n[nH]1	1822531480	HWOOXEYKKNILEP-PWSUYJOCSA-N	438.282	1.110	50	20	IDGD	
CC(=O)NCC(C)(C)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1	1822998918	KVBBLERAENNDJX-BXKDBHETSA-N	449.346	1.908	50	20	IDGD	
O=C1C[C@H](C(=O)N[C@H]2CCc3nc(NC(=O)[C@@H](F)Br)sc3C2)CCN1	1823014393	VQSAETSQYFHECR-RGNHYFCHSA-N	433.303	1.272	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC([C@H]2CCCCN2C(=O)CC[C@H](N)C(N)=O)CC1	1826936681	ZBIKJBFCXBXOCV-DLBZAZTESA-N	426.634	1.050	50	20	IDGD	
CC(=O)Nc1cc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)[C@@H](O)CCl)CC2)ccn1	1827975557	SJCLPLZTNSNHOB-ROUUACIJSA-N	436.940	1.873	50	20	IDGD	
O=C1C[C@H](C(=O)N2CCC([C@H]3CCCCN3C(=O)[C@@H](F)Br)CC2)CCN1	1830381745	MUWRPDJBCMARLZ-IIAWOOMASA-N	432.334	1.823	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H]3CC=CCC3)CCO2)C1	1830568139	NSQDBYFSFAXYFF-MDZRGWNJSA-N	429.355	1.973	50	20	IDGD	
C[C@@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)c3cncn3C)CC2)CC1	1833262552	VCUDHRUCHGBHGK-AWEZNQCLSA-N	440.386	1.636	50	20	IDGD	
O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)c1coc(Cl)n1)CCO2	1833552790	GLUGYLBGEGDSEZ-OAHLLOKOSA-N	436.690	1.183	50	20	IDGD	
Cc1csc(C(=O)NC2CCN(C3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)c1	1833567270	RCMOJYAKEHONCU-UHFFFAOYSA-N	449.621	1.615	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnn(-c4cccnc4)c3)CCO2)C1	1833621450	IUTZXDGYRTUUMY-NQIIRXRSSA-N	447.923	1.355	50	20	IDGD	
O=C(CCc1cnc[nH]1)NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1	1833788063	YGRLNZAACDPTBB-UHFFFAOYSA-N	440.386	1.699	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)Cn3nc(C)cc3C)CC2)CC1	1833838655	FPXXLDHZGYOOOH-LJQANCHMSA-N	439.988	1.325	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3ncccn3)CC2)CC1	1834234544	SRVPWSMHVQDHKK-INIZCTEOSA-N	438.370	1.835	50	20	IDGD	
N#Cc1ccc(C(=O)N2CCOC[C@]3(CN(C(=O)CCBr)CCO3)C2)cc1	1834823843	NAYZOSBSELZUCS-IBGZPJMESA-N	436.306	1.413	50	20	IDGD	
C=C(C(=O)N1CCOC[C@]2(CN(C(=O)CCBr)CCO2)C1)C(F)(F)F	1834824920	PGUHLRQJZLLFJK-AWEZNQCLSA-N	429.233	1.346	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnccc3F)CCO2)C1	1836317797	BUFJQIXVQAEKAQ-QZTJIDSGSA-N	434.295	1.527	50	20	IDGD	
Cc1ncccc1C(=O)N1CCC(OC2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1	1837432334	YLVZNGXGUOCBMF-UHFFFAOYSA-N	445.564	1.375	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3nc(O)n4c3CCCC4)CCO2)C1	1837759125	QSZMROHDWSFJDA-VBKZILBWSA-N	440.928	1.012	50	20	IDGD	
O=C(CCn1ccnn1)N1CCC(OC2CCN(C(=O)[C@H](F)Br)CC2)CC1	1838648132	JVVLUBRJXAIQSE-INIZCTEOSA-N	446.321	1.357	50	20	IDGD	
Cc1ccc(OC(C)(C)C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)nc1	1839052850	PYVXOYFIGXJZKG-OXJNMPFZSA-N	443.903	1.538	50	20	IDGD	
Cc1ccn(C)c1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839201719	HKRIOUBEXRIHDI-RHSMWYFYSA-N	432.290	1.094	50	20	IDGD	
O=C(c1cccc(F)c1[N+](=O)[O-])N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1839356791	KRVZVBARZVGBPX-RHSMWYFYSA-N	433.795	1.338	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(F)n3)C2)C1	1840033405	CIOWZFRTYODOIT-SJKOYZFVSA-N	430.274	1.074	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccccc3OC)C2)C1	1840153711	ACUWHRCZQUKOOT-OXJNMPFZSA-N	426.897	1.019	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)c3cccs3)C2)C1	1840156534	USCVGRJKGOPNEU-YZVOILCLSA-N	430.954	1.562	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@]1(C)CC1(F)F)CCO2	1840829375	BTFFRXSEDRUEML-VBNZEHGJSA-N	439.297	1.662	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@@H](C)C(=O)N2CCCC23CN(C(=O)[C@H](F)Cl)C3)cc1	1841368957	PQGHBWAERMLTAH-ZFWWWQNUSA-N	431.917	1.400	50	20	IDGD	
COC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)[C@@H](C)Br)C2	1843383315	NTGXWPOYTMZFHX-CHWSQXEVSA-N	448.358	1.513	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC2(CCCN2C(=O)Cn2cccc([N+](=O)[O-])c2=O)C1	1845825003	CWWSRCRYIMQBCJ-MRXNPFEDSA-N	431.276	1.196	50	20	IDGD	
CC(C)(C)c1ccc(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2cnccc2C(=O)NN)cn1	1847192965	QLVMDTIHINOVIL-ROUUACIJSA-N	436.516	1.507	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NN[C@@H](C(=O)NC2CC2)c2ccc(F)cc2)cc1	10834534	MJMNGJDJCKWQGN-HXUWFJFHSA-N	448.520	1.395	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)[C@@H]1CCCN(C(=O)c2ccc(F)cc2)C1	12611125	ONTCYAXFCYEPHC-MRXNPFEDSA-N	429.448	1.913	50	20	IDGD	
CCCn1c(=O)n(CCC(=O)NNC(=O)c2n[nH]c(=O)c3ccccc23)c2ccccc21	16231322	ZNCQPXOGZYPJMP-UHFFFAOYSA-N	434.456	1.301	50	20	IDGD	
C=CCOc1ccc(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1OC	25437802	XSPYHLQCBKJRGM-UHFFFAOYSA-N	439.877	1.636	50	20	IDGD	
CCNS(=O)(=O)c1ccc(C)c(C(=O)OCC(=O)NNC(=O)c2ccc(C)cc2)c1	26152010	XZRSTUFMIGPTJK-UHFFFAOYSA-N	433.486	1.220	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCCO[C@@H]1CCCC[C@H]1C	117322262	QBFRMVDIENRNKG-UKRRQHHQSA-N	425.555	1.827	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCCOc2ccc3c(c2)OCO3)cc(OC)c1OC	117324999	ZAVWQJNALIXTQT-UHFFFAOYSA-N	433.417	1.464	50	20	IDGD	
CC(C)C[C@@H](C(=O)NNC(=O)c1ccc2c(c1)OCO2)N1C(=O)[C@H]2CC=CC[C@H]2C1=O	197984211	NTWTXTRQOFWHFO-XHSDSOJGSA-N	427.457	1.542	50	20	IDGD	
CCC[C@H](NC(=O)NCc1ccc(F)cc1)C(=O)NNC(=O)CNC(=O)c1cccs1	725741924	VWNZAUKKQKQDQB-HNNXBMFYSA-N	449.508	1.433	50	20	IDGD	
COc1cc(CN(C)C(=O)NNC(=O)CNC(=O)c2cccs2)ccc1OC(F)F	725871891	LUNFQHMXCMEVIL-UHFFFAOYSA-N	442.444	1.961	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)N1CCCN(C(=O)c2cccc(F)c2)CC1	725872874	RWFSGQMABHWFKO-UHFFFAOYSA-N	447.492	1.206	50	20	IDGD	
O=C(NNC(=O)c1cc(S(=O)(=O)NC2CC2)ccc1Br)c1ccc[nH]1	726630917	VDOGSJFGSORTGS-UHFFFAOYSA-N	427.280	1.293	50	20	IDGD	
CNS(=O)(=O)c1cccc([C@H](C)NC(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)c1	727608614	BHUVWCYTAFLUHJ-STQMWFEESA-N	438.481	1.593	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNS(=O)(=O)c2cccc3c2COC3=O)c1	728508611	VXICPZOEDWCVLM-UHFFFAOYSA-N	441.259	1.751	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)Cn2cc(C(N)=O)c3ccccc32)c1	728526477	WTLRVNCHKAUUDX-UHFFFAOYSA-N	445.273	1.973	50	20	IDGD	
Cc1ccc(C)c(S(=O)(=O)N2CCN(C(=O)NNC(=O)c3cccc(C#N)c3)CC2)c1	728955148	ZICKLNXWWQIPRC-UHFFFAOYSA-N	441.513	1.536	50	20	IDGD	
O=C(NNC(=O)N1CCc2c(cnn2-c2ccccc2)C1)C1CCN(c2ncccn2)CC1	728960417	YKEDEQRWXBZQKS-UHFFFAOYSA-N	446.515	1.678	50	20	IDGD	
Cc1[nH]c2ccnn2c(=O)c1CC(=O)NNC(=O)COc1ccccc1-c1ccccc1	729167017	DZBDSSLAAHMVSE-UHFFFAOYSA-N	431.452	1.767	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)c2cc(S(=O)(=O)N3CCC[C@H](C)C3)cn2C)cc1	730274019	JOOYSKBXDALSHB-INIZCTEOSA-N	447.561	1.627	50	20	IDGD	
COc1cccc(-n2c(C)nnc2SCC(=O)NNC(=O)COc2ccccc2O)c1	730782697	SICXEHYLVWKMOU-UHFFFAOYSA-N	443.485	1.608	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCC(C)(C)N2CCC(OC)CC2)cc(OC)c1OC	730821834	RNOXSYCZRDJBRL-UHFFFAOYSA-N	438.525	1.546	50	20	IDGD	
COC(=O)[C@@H](NCC(=O)NNC(=O)c1cc(Cl)ccc1OC)c1ccc(OC)cc1	731032035	BWJKVUPELBJQAB-SFHVURJKSA-N	435.864	1.622	50	20	IDGD	
O=C(NNc1nc(-c2ccccc2)no1)[C@@H]1CCCC[C@H]1C(=O)N[C@H]1CCS(=O)(=O)C1	732111532	AOTZMTGZDHFNQA-ARFHVFGLSA-N	447.517	1.289	50	20	IDGD	
O=C(Cc1ccc2ccccc2c1)NNC(=O)NCCS(=O)(=O)NC[C@H]1CCCCO1	732473801	BNMOCRQACXVWDP-LJQANCHMSA-N	448.545	1.201	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)NCc1ccc(N(C)S(C)(=O)=O)cc1	732475310	BDQRFUDZPMSARZ-UHFFFAOYSA-N	434.518	1.554	50	20	IDGD	
CC(=O)N(c1nc(/C=C(\C#N)C(=O)Nc2ccc(S(N)(=O)=O)cc2)cs1)C1CC1	734306804	SWLHHOLFQGKWBF-XYOKQWHBSA-N	431.499	1.851	50	20	IDGD	
COc1ccc(S(=O)(=O)C[C@H](C)C(=O)NNC(=O)COc2cc(C)ccc2C)cc1	735029009	PVCXVOZOIBRQLB-INIZCTEOSA-N	434.514	1.948	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2cc3ccccc3nc2O)CC1	735116884	JQKSYNQXKNGABU-UHFFFAOYSA-N	442.501	1.028	50	20	IDGD	
O=C(NNC(=O)c1cc2occc2s1)c1cccc(S(=O)(=O)N2CCOCC2)c1	735988975	OSOFTALZYWSNHX-UHFFFAOYSA-N	435.483	1.590	50	20	IDGD	
Cc1cc(NNC(=O)CCc2nc3cc(S(=O)(=O)N(C)C)ccc3n2C)nc(C)n1	736719062	UWLRVDQVVBYCSL-UHFFFAOYSA-N	431.522	1.306	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1cc(C(=O)NNC(=O)COCc2ccccc2)ccc1F	737635160	SYILBLLZTJEEHR-UHFFFAOYSA-N	437.493	1.880	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)C1CCN(C(=O)COc2ccccc2)CC1	737637194	QYICYRPVDLTAIC-UHFFFAOYSA-N	425.485	1.668	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NC[C@@H](C)CN2CCOCC2)cc1Br	739060005	VVNNJBBKZORFTL-GFCCVEGCSA-N	429.315	1.370	50	20	IDGD	
Cc1nc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c2ccccn12	741207011	IODCZADSTMWRMQ-UHFFFAOYSA-N	427.486	1.502	50	20	IDGD	
COC(=O)c1cc(Cl)cc(S(=O)(=O)NNC(=O)c2nnc(-c3ccccc3)o2)c1	741654562	YPPMFWSARXVVHF-UHFFFAOYSA-N	436.833	1.800	50	20	IDGD	
CC(C)(C)OC(=O)N(CC(=O)NNC(=O)c1nnc(O)c2ccccc12)C[C@H]1CCCO1	742034808	WOSPALCCVIHKEI-CYBMUJFWSA-N	445.476	1.513	50	20	IDGD	
C[C@H](CC(=O)NNC(=O)[C@@H](C)Oc1ccccc1F)/N=C1/NS(=O)(=O)c2ccccc21	742478964	XZMWSQGGSOFYGW-CHWSQXEVSA-N	448.476	1.258	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)c2cn(Cc3ccccn3)nn2)c1	742632411	XLIXCVQGXDNHEJ-UHFFFAOYSA-N	431.250	1.567	50	20	IDGD	
Cc1ccc(S(=O)(=O)NNC(=O)c2cccn2C)cc1S(=O)(=O)N1CCCCC1	743251495	RFJCOJCKSJCGOE-UHFFFAOYSA-N	440.547	1.131	50	20	IDGD	
CC(=O)N[C@H](CC(=O)NNC(=O)CCN1C[C@H](C)O[C@H](C)C1)c1ccc(F)cc1F	743291548	QVMHEEAFKQTYAR-FHSNZYRGSA-N	426.464	1.179	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)c1ccc(Cl)c(N2CCNC2=O)c1	743293387	YAWOQICZXQYAOL-UHFFFAOYSA-N	440.847	1.836	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc(Br)s1)C1CC1	743738051	RSWAPTBKQQSUOH-SNVBAGLBSA-N	436.353	1.611	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1ccc(N2CCOC2=O)cc1	744619728	WEEOYGCRASQDIV-UHFFFAOYSA-N	446.485	1.421	50	20	IDGD	
C=CCNS(=O)(=O)c1cc(C(=O)OCC(=O)NNC(=O)c2cccc(C)c2)ccc1F	744688409	RLTWASRRKAKCTP-UHFFFAOYSA-N	449.460	1.216	50	20	IDGD	
CCO[C@H](C)c1ncc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)s1	745449680	SAZVUIFGYLZQOI-BXUZGUMPSA-N	435.458	1.385	50	20	IDGD	
C[C@@H](O)[C@H](NC(=O)C(C)(C)C)C(=O)OCC(=O)C(C#N)=C1N(C)c2ccccc2N1C	745700937	IDGAEQITVLDXDD-ACJLOTCBSA-N	428.489	1.332	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)N[C@@H]2CC(=O)N(CCOc3ccccc3)C2)c1	745847630	PRCAUSDTSRIPEO-GOSISDBHSA-N	440.500	1.693	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN1C(=O)NCc1cccc(Br)c1)c1ccncc1	746091918	OCNAENMAQNXMDA-INIZCTEOSA-N	446.305	1.979	50	20	IDGD	
NS(=O)(=O)c1ccc(C(=O)NNC(=O)CCCc2ccccc2)cc1Br	748081247	UMQXXKPNJXRGIB-UHFFFAOYSA-N	440.319	1.880	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)NCC(=O)Nc1ccc(Br)cc1C	748613943	FQQHJIYUBAFHNG-LLVKDONJSA-N	431.287	1.078	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNS(=O)(=O)c2cc(C(=O)OC)cs2)cc1	749150569	ARXJDMXPXKLIEF-NSHDSACASA-N	428.488	1.710	50	20	IDGD	
O=C(NNC(=O)c1cccc(-n2nccc2C(F)(F)F)c1)c1ccc(-n2cnnn2)cc1	749161158	JRRBYPMGOUTCQJ-UHFFFAOYSA-N	442.361	1.942	50	20	IDGD	
NS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccc(F)cc2Br)cc1	749267629	OJKRURYTNHUJHM-UHFFFAOYSA-N	431.243	1.317	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)[C@@H]1CCCN1C(=O)c1ccc2c(c1)OCO2	749468447	DIPKVWOMBFRRNK-CJNGLKHVSA-N	443.431	1.774	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(Cl)cc2)cc1	750202489	FYZXOUDNCJQPSW-UHFFFAOYSA-N	426.882	1.822	50	20	IDGD	
COc1ccc(N2C[C@H](C(=O)NNc3nc(Br)cn4ccnc34)CC2=O)cc1	750247050	QGSJIBMINNPCRF-LLVKDONJSA-N	445.277	1.997	50	20	IDGD	
CCOC(=O)c1sc(CNC(=O)NNC(=O)c2cc(Br)c[nH]2)nc1C	750268364	QVTVGTDMBSGWOO-UHFFFAOYSA-N	430.284	1.863	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)NNC(=O)c2cc3c(s2)CC[C@@H](C)C3)ccc1F	752399079	FOOCURYDSSQCIN-SNVBAGLBSA-N	425.507	1.995	50	20	IDGD	
CC(=O)NC[C@@H]1CCn2ncc(C(=O)NNC(=O)c3cccc(Br)c3)c2C1	753133682	BNEGCBMLQCVSPC-GFCCVEGCSA-N	434.294	1.419	50	20	IDGD	
CCOc1ccc(NC(=S)NNC(=O)c2cc(S(=O)(=O)N(C)C)oc2C)cc1	753328002	LYKDANXUMDVXSP-UHFFFAOYSA-N	426.520	1.868	50	20	IDGD	
O=C(CN1CCOC[C@H]1C[C@@H](O)c1cccs1)NNC(=O)c1cccc([N+](=O)[O-])c1	753858773	JAIPILLQJRLQLM-HZPDHXFCSA-N	434.474	1.242	50	20	IDGD	
N#Cc1cc(Br)cc(S(=O)(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c1	754262279	YKNJLBZQFGRWIW-UHFFFAOYSA-N	425.220	1.852	50	20	IDGD	
COc1cc([N+](=O)[O-])ccc1C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	755314066	WBJQNWKLLNADSZ-UHFFFAOYSA-N	448.457	1.463	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1	755512760	PVFSLDBCKNPCOA-UHFFFAOYSA-N	434.474	1.611	50	20	IDGD	
CCn1ccnc1C=NNC(=O)C[C@H]1c2cc(OC)c(OC)cc2CCN1S(C)(=O)=O	755571924	HJRPYLASPYWRDI-INIZCTEOSA-N	449.533	1.319	50	20	IDGD	
CN1CCN(C(=O)c2ccccc2NC(=O)NNC(=O)[C@H]2COc3ccccc3O2)CC1	755622966	LPHPOLURVDQVFN-LJQANCHMSA-N	439.472	1.067	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)Nc1ccc2c(ccn2CC(=O)N2CCOCC2)c1	756294913	WEPBAOATOHJTAL-UHFFFAOYSA-N	436.472	1.291	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2nnc(O)c3ccccc23)cc1-n1nnnc1C	756321363	SUXJJTOBNBYPSE-UHFFFAOYSA-N	435.404	1.095	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)Nc3cc(F)cc(S(N)(=O)=O)c3)n[nH]2)cc1	756517576	XCEMAZTYCKGAAO-UHFFFAOYSA-N	432.437	1.638	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2ccc(C[C@H]3CC(=O)NC3=O)cc2)cc1OC	756815525	LVFQHZAYFLVNLN-AWEZNQCLSA-N	426.429	1.376	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)Nc1ccc(C[C@@H]2CC(=O)NC2=O)cc1	756815940	PLAQWVRETKLPBN-GXTWGEPZSA-N	428.420	1.651	50	20	IDGD	
CCOc1ccc(C(=O)N2CCCCC2)cc1NC(=O)NNC(=O)[C@H](C)OCCOC	756885970	QKEXUAWKHSSPAN-HNNXBMFYSA-N	436.509	1.916	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)Nc1ccc(C(=O)NC2CCOCC2)cc1	757619427	PIKMGZOZYOJOPP-IBGZPJMESA-N	440.456	1.588	50	20	IDGD	
O=C(c1csc(Nc2ccccn2)n1)N1CCN(S(=O)(=O)CBr)CC1	758513295	SULUTOHNAUEOFO-UHFFFAOYSA-N	446.352	1.722	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)NC[C@@H]2CC(=O)N(Cc3ccccc3)C2)c1	758980933	QKTIPWPMOBYWCM-INIZCTEOSA-N	426.473	1.697	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C(=O)Nc2cnccc2-c2ccccc2)nc2ccccc21	760307063	JMAILKAIYGNRAD-UHFFFAOYSA-N	428.452	1.964	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2c(C)nn(CC(F)F)c2C)cc1OC	760824764	KZHYBXOQOYURAY-UHFFFAOYSA-N	440.403	1.400	50	20	IDGD	
COc1cc(C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc2c1O[C@H](C)C2	761066912	REYIYOJVGDSBBA-LLVKDONJSA-N	429.385	1.545	50	20	IDGD	
O=C1CSc2ccc(NC(=O)C(=O)NNC(=O)c3ccccc3Br)cc2N1	763482837	LDVWCWSGJARITL-UHFFFAOYSA-N	449.286	1.893	50	20	IDGD	
CN(C)CCNC(=O)c1cccc(CNC(=O)NNC(=O)CSc2ccccc2O)c1	763497484	SLZZUPWDRPZIGE-UHFFFAOYSA-N	445.545	1.306	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccc(Br)c1C	763656444	BRHUAYLZVBGSPJ-UHFFFAOYSA-N	436.262	1.931	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2cnn(-c3ccccc3F)c2)c1	763772924	QZGGWFCOQMRPAH-UHFFFAOYSA-N	427.392	1.428	50	20	IDGD	
Cc1ccn(-c2ccccc2NC(=O)C(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])n1	763804628	UYAKPNKEHWBIHC-UHFFFAOYSA-N	438.400	1.254	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)c(OC)c1OC	763841021	NFTZLLDCPAMCBX-CQSZACIVSA-N	445.472	1.883	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)Cc2c[nH]c3ccccc23)c(OC)c1OC	763858679	VWGQZKROMBDZKT-UHFFFAOYSA-N	426.429	1.522	50	20	IDGD	
CN(C)c1nnc(-c2ccc(NC(=O)C(=O)NNC(=O)Cc3c[nH]c4ccccc34)cc2)o1	763865086	IOKXVXZEVLJBNC-UHFFFAOYSA-N	447.455	1.613	50	20	IDGD	
O=C(Cc1ccsc1)NNC(=O)C(=O)Nc1cc2c(cc1Br)OCCO2	764034837	KQBYVSONCXOMGM-UHFFFAOYSA-N	440.275	1.610	50	20	IDGD	
CCOC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2OC)cc1C#N	764041506	VSPYTCRZOOPOLV-UHFFFAOYSA-N	425.401	1.535	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cc(I)ccc2Cl)n[nH]1	764106661	OTOCNCWOELVKOP-UHFFFAOYSA-N	447.620	1.376	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1O)C(=O)Nc1ccc(-n2cncn2)c(Cl)c1	764126590	MTXLPNYJMUXCHI-UHFFFAOYSA-N	435.227	1.679	50	20	IDGD	
COCCn1ncc2ccc(NC(=O)C(=O)NNC(=O)Cc3ccccc3OC)cc21	764135432	GIDBSNSECKICFV-UHFFFAOYSA-N	425.445	1.020	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2c[nH]nc2-c2ccccn2)o1	764139605	XUSWCXWCPDZWMN-UHFFFAOYSA-N	425.449	1.306	50	20	IDGD	
CC(C)(C)CC(=O)NNC(=O)C(=O)Nc1ccc2c(ccn2CCN2CCOCC2)c1	764199736	STCVXFJFCNPUJH-UHFFFAOYSA-N	429.521	1.496	50	20	IDGD	
COc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NNC(=O)CCCc1ccccc1	764223508	FDXBGPOQFIKODE-UHFFFAOYSA-N	426.473	1.506	50	20	IDGD	
CS(=O)(=O)Cc1cc(F)ccc1NC(=O)C(=O)NNC(=O)CCCc1ccccc1	764225146	YXLSYCOBACVOMF-UHFFFAOYSA-N	435.477	1.479	50	20	IDGD	
CCN(CC)CCn1ccc2cc(NC(=O)C(=O)NNC(=O)Cc3cccnc3)ccc21	764264038	OJJSAUMJUUKJAV-UHFFFAOYSA-N	436.516	1.707	50	20	IDGD	
COc1cc(C#N)ccc1Oc1ccc(NC(=O)C(=O)NNC(=O)c2c[nH]nc2C)cc1	764297302	NQPALQDTLUIJLL-UHFFFAOYSA-N	434.412	1.790	50	20	IDGD	
CCS(=O)(=O)N1CCC(C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)CC1	764333929	ONTAXQKRTKBPLQ-UHFFFAOYSA-N	430.477	1.362	50	20	IDGD	
COC(=O)c1ccc(OC)cc1NC(=O)C(=O)NNC(=O)c1cnn(-c2ccccc2)c1	764352083	ZSCLGWBWPQHASS-UHFFFAOYSA-N	437.412	1.067	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2ccc3nccnc3c2)n[nH]1	764376827	IPKWDAJHNYYHGZ-UHFFFAOYSA-N	431.412	1.428	50	20	IDGD	
CCc1cccc2c1N(C(=O)C(=O)NNC(=O)c1cc(-c3ccccc3OC)[nH]n1)CC2	764377829	QUVDPSFDWBYEKP-UHFFFAOYSA-N	433.468	1.998	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)C(=O)Nc1cccc(-c2nnc3n2CCCCC3)c1	764389588	SZHJZIPCNGWROC-UHFFFAOYSA-N	433.472	1.775	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COCCO1)C(=O)Nc1cccc(Sc2ccc(Cl)cc2)c1	764425013	MJFDOOJINWOFMV-INIZCTEOSA-N	435.889	1.993	50	20	IDGD	
CC(C)NC(=O)C(=O)NNC(=O)CSc1nnc(-c2ccco2)n1-c1ccccc1	764606302	HGRVEZKODVBRFW-UHFFFAOYSA-N	428.474	1.291	50	20	IDGD	
Cn1c(=O)c2c(ncn2CC(=O)NN=C2CCc3c2ccc(Cl)c3Cl)n(C)c1=O	764818986	YHAQZHYSKLJDIR-UHFFFAOYSA-N	435.271	1.207	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)CCc3nc(-c4ncccn4)no3)n[nH]2)c1	765580965	IFXFGBULJYDXRT-UHFFFAOYSA-N	432.444	1.927	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1c(C)cc(N(C)C)cc1C	766258692	IOHHIXUSCVNZQM-UHFFFAOYSA-N	428.489	1.933	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3c(C)nc(C(C)C)nc3O)CC2)cc1	766651094	ZBDOBPRVXPMBKL-UHFFFAOYSA-N	440.548	1.501	50	20	IDGD	
Cn1ncc(C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)c1C1CC1	766660809	RTRMZIFTWPSGAB-UHFFFAOYSA-N	430.940	1.530	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)CCc1nnc(-c2ccsc2)o1	767278151	AIFUXEUVJGICHF-UHFFFAOYSA-N	428.470	1.972	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)C[C@H](C)NC(=O)C3CCCC3)n[nH]2)cc1OC	768277540	QGZOUNKDLWOZDT-ZDUSSCGKSA-N	443.504	1.940	50	20	IDGD	
O=C1C[C@@H](Cc2ccc(C(=O)NNC(=O)c3cc(-c4ccc(F)cc4)[nH]n3)cc2)C(=O)N1	768278561	HYXNMMBDYIULDR-OAHLLOKOSA-N	435.415	1.496	50	20	IDGD	
CCOC(=O)c1[nH]c(C)c(S(=O)(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)c1C	768495949	HWWKIHAKYABMHS-UHFFFAOYSA-N	436.490	1.373	50	20	IDGD	
CNS(=O)(=O)c1ccc(CCC(=O)NNc2c(OC)cccc2S(C)(=O)=O)cc1	768630140	TXGNPAZAJCKXFI-UHFFFAOYSA-N	441.531	1.083	50	20	IDGD	
CSCCNC(=S)NNC(=O)Cn1cnc2ccc(Br)cc2c1=O	769778045	LYRQXFFSOXIYQO-UHFFFAOYSA-N	430.353	1.017	50	20	IDGD	
CN(C)C(=O)c1ccc(CNC(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)cc1	770341410	MZGDXCPCDBQXPJ-UHFFFAOYSA-N	426.481	1.815	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1ccc(-c2nc[nH]n2)cc1	771390440	AQJOQZUFGIXSAO-UHFFFAOYSA-N	428.474	1.250	50	20	IDGD	
Cc1noc(C)c1S(=O)(=O)N1CCC(C(=O)NNc2ccc(F)c([N+](=O)[O-])c2)CC1	771596708	ZBYPVSRDJCUIEO-UHFFFAOYSA-N	441.441	1.883	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)[C@H]1CCCCN1C(=O)c1ccccc1	772883514	BXUMONAECDIGOQ-GOSISDBHSA-N	442.903	1.799	50	20	IDGD	
CCNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)c1	774008907	MPIIXVAWDRNMME-GFCCVEGCSA-N	432.864	1.643	50	20	IDGD	
Cc1cc(CNC(=O)NNC(=O)Nc2ccc(OC(F)F)cc2)ccc1S(N)(=O)=O	775224446	KQAZSEFZDWRRQQ-UHFFFAOYSA-N	443.432	1.780	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cc(NC(=O)NNC(=O)CN(C)C)ccc1C	775459056	PXBZOKUHVUHYOQ-UHFFFAOYSA-N	435.506	1.519	50	20	IDGD	
COc1cc([C@@H](NC(=O)NNC(=O)Cc2cc[nH]n2)C(F)(F)F)cc(OC)c1OC	775997340	AEFMFWWUAJCIIZ-OAHLLOKOSA-N	431.371	1.612	50	20	IDGD	
N#C/C(=C/c1ccc(O)cc1)C(=O)NCc1ccc(S(=O)(=O)N2CCOCC2)cc1	776603263	JWSGJQOWBYPQGR-AQTBWJFISA-N	427.482	1.636	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(N2CCOC2=O)c([N+](=O)[O-])c1)c1cccc(Cl)c1	777598046	ZKWHIOOHJGRNBJ-UHFFFAOYSA-N	440.821	1.828	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)[C@@H]1CCCN(C(=O)c2ccc(Cl)cc2)C1	778442762	DRNJBIJRZJCWRH-CQSZACIVSA-N	438.912	1.864	50	20	IDGD	
Cc1cc(F)c2nc(O)cc(C(=O)OCC(=O)NNC(=O)Cc3nc(C)cs3)c2c1	778871130	SZPXFAUCJGQVRY-UHFFFAOYSA-N	432.433	1.700	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2ccc(C(=O)N3C[C@H](C)O[C@H](C)C3)cc2)nc1	782148339	LGCLVJIHKHPMKW-OKILXGFUSA-N	427.461	1.421	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ncncc2Cl)cc1S(=O)(=O)NC(C)(C)C	782166330	RQUBPCRZZYMHND-UHFFFAOYSA-N	440.913	1.597	50	20	IDGD	
O=C(NNc1ccc(Br)cc1)C(=O)Nc1cccc(CN2C(=O)CNC2=O)c1	783010152	XUFJIQWYZFAYKS-UHFFFAOYSA-N	446.261	1.583	50	20	IDGD	
COC(=O)CN1CCN(c2ccc(NC(=O)C(=O)NNc3cc(C)ccc3C)cc2)CC1	783366637	MKWKLMAXLJVLMO-UHFFFAOYSA-N	439.516	1.680	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2cc(Cl)ccc2Cl)n([C@@H]2CCS(=O)(=O)C2)n1	783369199	GQINKNGJDOQCKX-LLVKDONJSA-N	446.316	1.940	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2cc(NC(=O)CN3CCCC[C@H]3C)ccc2F)ncn1	783948433	NNDMHDKAVDNHEA-CQSZACIVSA-N	443.483	1.819	50	20	IDGD	
O=C1C[C@H](Cc2ccc(NC(=O)C(=O)NNc3ccc(OC(F)F)cc3)cc2)C(=O)N1	784318382	OJSVAQUAJQYJEA-LBPRGKRZSA-N	432.383	1.575	50	20	IDGD	
CCOC(=O)[C@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNc2cc(Cl)ccn2)cc1	784860324	ACGFXJHMXSWMHO-NSHDSACASA-N	433.852	1.498	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)c(OC)cc1Cl	785023884	OUXUAERXVVGBLN-UHFFFAOYSA-N	438.780	1.371	50	20	IDGD	
Cn1ccnc(NNC(=O)C(=O)Nc2cc(C(F)(F)F)ccc2N2CCCCC2)c1=O	785085817	GHSHLPKPZIRBCG-UHFFFAOYSA-N	438.410	1.871	50	20	IDGD	
CCNC(=O)Nc1ccc(C)c(NC(=O)C(=O)NNC(=O)Cc2ccccc2OC)c1	787542859	SDOKLNZDJNEUJC-UHFFFAOYSA-N	427.461	1.474	50	20	IDGD	
Cn1nc([C@H]2CCCOC2)cc1NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	790553920	JRYHJBUEOZIGNV-LBPRGKRZSA-N	425.449	1.028	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)nc1Br	793021573	FGZBYCXUMMFMEL-JTQLQIEISA-N	439.241	1.845	50	20	IDGD	
Cc1ncc(S(=O)(=O)NNC(=O)c2ccc(CSc3nncn3C)cc2)cc1C#N	793350232	JCMUEKGLVUWTEY-UHFFFAOYSA-N	443.514	1.306	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CS(=O)(=O)Cc2ccc(Br)cc2)n1	794078294	WZURJTUHJZRRAJ-UHFFFAOYSA-N	426.292	1.529	50	20	IDGD	
Cc1cccc(C(=O)NNS(=O)(=O)c2cc(Br)c(C)c(C(=O)O)c2)n1	794600649	GABMHYGLFJBREE-UHFFFAOYSA-N	428.264	1.782	50	20	IDGD	
CC(=O)N[C@@](C)(C(=O)NNc1ccc(C(F)(F)F)nn1)c1ccc(S(C)(=O)=O)cc1	797747008	CIKFPMHJIIBBNI-MRXNPFEDSA-N	445.423	1.394	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@@H]2C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1	798391450	HBPCFNQKBGQVGQ-GOSISDBHSA-N	445.497	1.165	50	20	IDGD	
NC(=O)[C@H]1CN(S(=O)(=O)c2ccc(OCCBr)cc2)c2ccccc2O1	799520236	PMEJVKQFDWCPCP-MRXNPFEDSA-N	441.303	1.902	50	20	IDGD	
COc1ccc(S(=O)(=O)C[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(C)cc2)cc1	801110442	AXIACAQNMJGBGF-CQSZACIVSA-N	433.486	1.200	50	20	IDGD	
CN1C(=C(C#N)C(=O)COC(=O)[C@H]2COCCN2CC(F)(F)F)N(C)c2ccccc21	801340827	NWIAWSGYAOURJT-MRXNPFEDSA-N	438.406	1.683	50	20	IDGD	
CS(=O)(=O)NC1CC(NC(=O)/C(C#N)=C\c2cn(CCC#N)nc2-c2ccccc2)C1	801464309	VHPCBFGVWFPAEK-YBEGLDIGSA-N	438.513	1.567	50	20	IDGD	
C[C@@H](Sc1ccccc1C(=O)OCC(=O)NNC(=O)c1ccc(C#N)cc1)C(N)=O	801486959	NTIHVVDQNXLXSM-GFCCVEGCSA-N	426.454	1.142	50	20	IDGD	
CC(C)[C@@H](NC(=O)c1ccc(Cl)s1)C(=O)NNC(=O)CCN1C[C@@H](C)O[C@H](C)C1	801599934	IFTGXRHADNHDJO-PBFPGSCMSA-N	444.985	1.803	50	20	IDGD	
COc1ccc(Cl)c(NC(=O)NNC(=O)C2=NN(c3ccc(F)cc3)[C@@H](C(N)=O)C2)c1	802114263	XAKGVDPNUSLNHH-MRXNPFEDSA-N	448.842	1.761	50	20	IDGD	
Cc1ccc(C(=O)NNc2ccc3c(=O)[nH]ccc3c2)cc1S(=O)(=O)N1CCOCC1	803427547	SSYVYIAAEXPCGM-UHFFFAOYSA-N	442.497	1.614	50	20	IDGD	
CSC[C@@H](C(=O)NNc1ccc(-n2ccnc2)nn1)N1C(=O)[C@H]2CCCC[C@H]2C1=O	804955938	ZGCUZIGCJTXITE-MJBXVCDLSA-N	429.506	1.012	50	20	IDGD	
CNC(=O)c1cc(Oc2ccc(NC(=O)C(=O)NNC(=O)c3ccoc3)cc2F)ccn1	810386503	CVHSZDGXUFLWLX-UHFFFAOYSA-N	441.375	1.365	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)[C@@]2(c3ccccc3)CNC(=O)C2)cc1C	811239304	VYYSMTITRYLRQI-OAQYLSRUSA-N	429.498	1.381	50	20	IDGD	
Cc1cnn(C)c1S(=O)(=O)NC(=O)/C(C#N)=C\c1cc(C)n(C[C@@H]2CCCO2)c1C	813992120	UFQZPUKCXQADCD-XUKORKDYSA-N	431.518	1.738	50	20	IDGD	
O=C(COCc1ccccc1)NNS(=O)(=O)CCCCN1C(=O)c2ccccc2C1=O	814211896	UOVCXRCNCSBCQB-UHFFFAOYSA-N	445.497	1.230	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NN=C2CCCc3c2ccc(=O)n3C)c1	814690153	WCTVHTQTUOXNFK-UHFFFAOYSA-N	430.530	1.886	50	20	IDGD	
CCOC(=O)c1ccsc1NC(=O)C(=O)NNc1ccccc1S(=O)(=O)N(C)C	815752386	PXFPQJYIYBVNEP-UHFFFAOYSA-N	440.503	1.257	50	20	IDGD	
O=C(CN1CCCCCCC1)Nc1ccc(NC(=O)C(=O)NNc2ncncc2F)cc1	815764496	JWVWHKBGTCRWOO-UHFFFAOYSA-N	443.483	1.902	50	20	IDGD	
CCC[C@@H](NC(=O)NCc1ccc(F)cc1)C(=O)NNC(=O)COc1ccc(C#N)cc1	835348695	AIQIADGPCICKLC-LJQANCHMSA-N	441.463	1.892	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(\C#N)C(=O)O[C@@H](C)C(=O)N2CCN(C(C)=O)CC2)c1C	853647611	BIJUKLDXATVEAV-KQOXESIYSA-N	444.532	1.842	50	20	IDGD	
Cc1cccc([C@H](CC(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)NC(N)=O)c1	914645884	TWBRMHVPYOKFTF-INIZCTEOSA-N	432.864	1.752	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)o1	914749812	MFBMNMBCCRJRIB-UHFFFAOYSA-N	445.501	1.437	50	20	IDGD	
CCOC(=O)Cc1csc(NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)n1	915054265	UBDCNSLQPMKJER-UHFFFAOYSA-N	426.476	1.119	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)NC[C@H](c2cccs2)N2CCOCC2)cc1	915894181	WNLFVGMYPPUIEK-QGZVFWFLSA-N	429.502	1.402	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCCCOC1CCCCC1	916201108	DIKGACKDCIODMP-UHFFFAOYSA-N	425.555	1.972	50	20	IDGD	
O=C(NN=Cc1c(N2CCCCC2)nc2ccccn2c1=O)[C@H]1COc2ccccc2O1	916292081	PHGWDQCKXYRLHC-LJQANCHMSA-N	433.468	1.975	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NCc2ccc(N3CCO[C@@H](C)C3)nc2)cc1	916392860	NSAGSUWFRRCCAT-HNNXBMFYSA-N	429.477	1.225	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NC[C@H]2CCN(C3CC3)C2)c2ccccc2c1=O	916580292	ZBTBQMOVKZSJDW-OAHLLOKOSA-N	426.521	1.625	50	20	IDGD	
O=C(NCc1ccc(S(=O)(=O)NC[C@@H]2CCCO2)cc1)NNc1cncc(Cl)n1	916649713	QFNPUKFUPHLLFU-ZDUSSCGKSA-N	440.913	1.414	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NCCOC)c(C(=O)NNC(=O)C(C)(C)C)c1	917182690	UQKNEMRDMLESNI-UHFFFAOYSA-N	428.555	1.583	50	20	IDGD	
CC[C@H](C)NC(=O)CCNC(=O)NNC(=O)[C@H](C)Oc1cccc(Br)c1	918085418	VEIAYOUSLBDJLD-RYUDHWBXSA-N	429.315	1.852	50	20	IDGD	
Cc1sc2ncnc(SCCC(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)c2c1C	919694277	SQXZNAQLHUXMJN-LLVKDONJSA-N	428.561	1.372	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)NCc2ccccc2S(=O)(=O)N(C)C)cc1	919901969	XWJJULRGQYCGHI-UHFFFAOYSA-N	434.518	1.409	50	20	IDGD	
O=C(CNC(=O)[C@H]1c2ccccc2C(=O)N1Cc1ccccc1)NNC(=O)c1ccccc1	920250225	CFBXKWSVALOPSX-JOCHJYFZSA-N	442.475	1.961	50	20	IDGD	
Cc1cc(C(=O)NNS(=O)(=O)c2ccc(F)c(S(C)(=O)=O)c2)c2ccccc2n1	920309306	UHKZBCPEWCRNBH-UHFFFAOYSA-N	437.474	1.709	50	20	IDGD	
C#CCNC(=O)/C(C#N)=C\c1cn(CCC(N)=O)nc1-c1ccc(Br)cc1	920848313	AFNSRUZGXZUNBD-UVTDQMKNSA-N	426.274	1.844	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)c2cccc3c2OCCO3)cc1	921299592	ZCRXXHKCMXDAGE-UHFFFAOYSA-N	425.470	1.953	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@H]2CCCCN2Cc2cccnc2)cc1	1256692496	QLYUTMALZCGTQS-GOSISDBHSA-N	431.518	1.693	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)N[C@@H](C)c2cnn(C)c2C)c2ccccc2c1=O	1317868007	MIJRCRVWYVCCEH-ZDUSSCGKSA-N	425.493	1.944	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCc2ccc3c(c2)CCC3)cc1	1321732054	HEWVGZOWRIAUCN-UHFFFAOYSA-N	430.530	1.635	50	20	IDGD	
O=C(NNS(=O)(=O)c1c(F)cccc1Br)[C@H]1COc2ccccc2O1	1340314860	FBVCUVFLBWMHNY-CYBMUJFWSA-N	431.239	1.738	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cccc4c3NC(=O)C4=O)C2)C1	1778708283	ZBDYIEMKAMOMDJ-NRFANRHFSA-N	433.892	1.530	50	20	IDGD	
Cc1cc(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](F)Br)C2)nn1C	1780770224	IRLOJHIWHRZOBV-QGPMSJSTSA-N	445.333	1.475	50	20	IDGD	
Cn1nc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)c2c1CCC2	1781230647	XYPNQNLXNMRVAS-OALUTQOASA-N	429.348	1.589	50	20	IDGD	
C=C(CC(=O)OCC)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2	1781264267	RKEIVTSGQUXPKO-KBXCAEBGSA-N	431.327	1.357	50	20	IDGD	
O=C(COc1ccc(O)cc1)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781326250	VOESQDOMLLTMOI-RDJZCZTQSA-N	431.258	1.291	50	20	IDGD	
CN(C)c1cncc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](F)Br)C3)C2)c1	1781326326	NHPICTNSYMKVHT-YOEHRIQHSA-N	429.290	1.282	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(F)c1)C2	1782212133	JHUWWVZTUSAOPZ-XMSQKQJNSA-N	434.512	1.326	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)CCc3ccc(F)c(F)c3)CCO2)C1	1783869214	OLHPKADFMZYOJG-QRWLVFNGSA-N	430.879	1.981	50	20	IDGD	
O=C(CSc1ccncc1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21	1785160686	QGKYKKORILCTSX-PCBIJLKTSA-N	446.342	1.844	50	20	IDGD	
COc1cccc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Br)C[C@@H]32)n1	1785199590	NKSIWFXAZACILQ-PLNCSYRRSA-N	444.301	1.303	50	20	IDGD	
COc1nccnc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)CBr)C[C@@H]21	1785646319	KKJXCAKJPLYUHE-XUXIUFHCSA-N	441.326	1.110	50	20	IDGD	
CCC(=O)N[C@H](C)C(=O)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1	1786293293	BXJVXULHWOYOJA-OAHLLOKOSA-N	437.305	1.029	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)Cc3ccccc3)C[C@@H]21	1786406993	AGIPXWNNUCPOPG-XSLAGTTESA-N	439.350	1.355	50	20	IDGD	
CCn1nccc1C(=O)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1	1787505162	YEWJKNUJXIUJCJ-UHFFFAOYSA-N	432.289	1.644	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1ccc(C2(NC(=O)[C@@H]3C=CCN3)CCC2)cc1	1788646013	SEHGPZNHOIRGFV-UEYIPHHSSA-N	434.500	1.783	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)Cc3ccccc3)C[C@@H]21	1788763459	FBKVNBIUTXQEDZ-MUGJNUQGSA-N	434.609	1.421	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CC3CCOCC3)C[C@@H]21	1790961988	UDASFANSIKYWQO-NXOAAHMSSA-N	431.371	1.956	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)COc3cccnn3)[C@H]2C1	1791602332	ALXUHEDFCJLKCX-NUXNZHGMSA-N	431.320	1.071	50	20	IDGD	
Cc1cc(Br)ccc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](O)CCl	1792980176	MTVPDRANEGILSB-VZAMPYOESA-N	445.741	1.560	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCCc1ccncc1	1794408711	NHTKSGVVSHGNDW-BCDXTJNWSA-N	436.516	1.355	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COc1cc(Cl)ccn1)C2	1795115747	KOQSZPWLRNRXRY-DPIQGUFMSA-N	446.729	1.488	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](CN)c1ccccc1	1795676995	WEQVKCCQKYGACJ-CWQOZTLDSA-N	438.366	1.492	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](Br)Cc1ccccc1)C2)c1nc[nH]n1	1796032570	SVWQUFPZTBSJDZ-QKPAOTATSA-N	448.321	1.014	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)c1ncc(Cl)cc1Cl	1796185762	LSTGKPQAVRDTNO-MUJYYYPQSA-N	448.115	1.634	50	20	IDGD	
COc1c(C)cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)cc1C	1796189475	RCOYXFYPYQUBNZ-WKCHPHFGSA-N	436.317	1.557	50	20	IDGD	
C[C@H](CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2)NC(=O)OC(C)(C)C	1796390020	CHOHKFDAPJYRFV-NRWUCQMLSA-N	438.352	1.683	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(Cl)ncn1)C2	1796891676	FUFYJJCSSARTFO-SIENDBQGSA-N	443.895	1.516	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cn(C)c2ncccc12	1797574241	QVZMCSOSJUCDNC-ZJOBFFGXSA-N	449.349	1.808	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(=O)c1ccc(Cl)cc1)C2	1797953846	JOUBTNARXFFMIP-JLVBRIDZSA-N	438.984	1.964	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnccc1Cl	1798674904	RDXXUDJLSSMQAW-CLLJXQQHSA-N	428.880	1.299	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3cnccc3n1)C2)[C@@H](F)Br	1799346766	AGHKVXRQCLAEQR-NOXHYTERSA-N	437.269	1.524	50	20	IDGD	
C[C@H](Nc1nccs1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Br	1799347573	QFSMBMAQIVJKLM-HHHUOAJASA-N	435.319	1.224	50	20	IDGD	
O=C([C@@H](F)Br)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1(Br)CC1	1799360070	GJCNPRMZMFVMNY-UTINFBMNSA-N	428.096	1.194	50	20	IDGD	
CC[C@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](CCO)NC(=O)OC(C)(C)C)C2	1800067682	LWEANJWTBPZFBX-XFIYOXNOSA-N	431.961	1.918	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccn3c(O)nnc13)C2	1800078635	DZHYGSOYUYNRPW-DBYGNECLSA-N	426.304	1.923	50	20	IDGD	
C[C@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2)[S@](=O)c1ccccc1	1800217487	WCJMOFXZSPPKGI-ZMHWZDQNSA-N	433.357	1.576	50	20	IDGD	
CCc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](Br)CC)n(C)n1	1800642033	SJHGCLXENDLHCF-LMWOUKEDSA-N	427.343	1.359	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(N(C)C)nc1)C2	1800760163	FNJMEFBCAXNMIG-OEYIWLLWSA-N	425.327	1.134	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)c1ccccc1Cl)C2	1800762592	DUKAYRQPMDSDQZ-ZTJZGAFRSA-N	445.741	1.746	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)NC(=O)OC(C)(C)C	1800863486	ZGWUENNTUWKZRI-RBGFHDKUSA-N	431.961	1.897	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C(C#N)=C/c1ccc(F)cc1F	1801436715	XHDBDHTXBXGQEW-ZPLALWFASA-N	445.470	1.957	50	20	IDGD	
C=CCC(CC=C)C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1803082071	NICHMTPVDRQSMV-JTHBVZDNSA-N	447.344	1.849	50	20	IDGD	
COc1cccc(CC(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)n1	1803136363	PKSWXBVIEREZKN-SYNHAJSKSA-N	432.908	1.333	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc3c[nH]nc3c2)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803139712	UFJCQQQMZAIWJV-YTQUADARSA-N	427.892	1.877	50	20	IDGD	
Cn1ccc(C(=O)NC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)c1	1805287597	BEFLYOWHDZCZNN-OXJNMPFZSA-N	447.499	1.052	50	20	IDGD	
Cn1cnc(C(=O)N2CCC3(CCCN(C(=O)[C@@H](O)CCl)C3)CC2)c1C(F)(F)F	1805523766	VDTLCNIOYUHEPP-LBPRGKRZSA-N	436.862	1.883	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@@H](CNC(=O)CN)[C@H]1c1cccnc1	1807041695	IRCZVOIMPLYTJA-ODCFXIRZSA-N	425.439	1.931	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC2(CCCN(C(=O)c3ccno3)C2)CC1	1808324393	QEJGLTQDUPPYTO-BUVRLJJBSA-N	426.477	1.653	50	20	IDGD	
Cc1cc(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)cn1C	1808724674	WGJYHEXFTOAPBZ-DENIHFKCSA-N	446.316	1.042	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)c1ccc2nonc2c1	1809126440	DMUBUCICFYGHGT-QGTPRVQTSA-N	429.864	1.537	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)c1ccc(O)c([N+](=O)[O-])c1	1810690306	DZIKJDATVGKTCX-QGTPRVQTSA-N	448.863	1.615	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@@H](CNC(=O)CN2C(=O)C=CC2=O)[C@H]1c1cccnc1	1813175996	NUMYNKVUQURPAA-HNAYVOBHSA-N	432.908	1.277	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@H](O)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](F)Cl)[nH]n1	1814795641	GTQDSGYUQMVHHQ-OBJOEFQTSA-N	447.895	1.822	50	20	IDGD	
CC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[nH]n1	1816813034	WLRJLAHOIABUDF-PTZPRWATSA-N	441.492	1.905	50	20	IDGD	
C[C@@H]1CC[C@H](C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)[nH]n2)O1	1818873850	QHUYKPHWTPCXDT-CSMYWGQOSA-N	441.492	1.282	50	20	IDGD	
CC(=O)N1CCN(CC(=O)Nc2cc([C@@H]3CCCCN3C(=O)[C@H](F)Cl)[nH]n2)CC1	1818965804	YGKDHVFIHYDKQD-YOEHRIQHSA-N	428.896	1.100	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@H](O)CCl)CC2)c1n[nH]c2c(F)cccc12	1819228052	OIHGMZOINGMRLL-PRHODGIISA-N	437.884	1.984	50	20	IDGD	
CCC[C@H](NC(C)=O)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1	1822418171	VUXCGTIOORKLPP-RDJZCZTQSA-N	449.556	1.080	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2csnn2)CC1	1824662375	CHKGEFCXZMUCCO-QGZVFWFLSA-N	443.533	1.084	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(O)nc(O)n1)CC2	1825641495	OSHZNBJZULSIFK-BQBZGAKWSA-N	442.295	1.354	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)no1	1826049255	UBOORAKDSCSDAP-HXUWFJFHSA-N	425.294	1.210	50	20	IDGD	
CC(C)=NO[C@H](C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827052658	VLEPEZWPAQGHLI-UTKZUKDTSA-N	443.353	1.401	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](O)CCl)CC2	1827968977	DXUPOBSJMUADAX-CMPLNLGQSA-N	446.957	1.570	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)CN2CCN(C)CC2)CC1	1828444724	LULMWVPBMAXPCV-RTBURBONSA-N	429.005	1.107	50	20	IDGD	
Nc1n[nH]c(CCC(=O)N2CCCC[C@@H]2C2CCN(C(=O)[C@@H](F)Br)CC2)n1	1828805280	SKAKSAMPPYNZGL-IUODEOHRSA-N	445.337	1.630	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(C(F)F)no3)C2)C1	1830358640	YSOZYMXEATWEON-SFHVURJKSA-N	435.855	1.947	50	20	IDGD	
CCc1[nH]nc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)c1F	1830359202	WGCPDOBSSQSOJE-IBGZPJMESA-N	430.908	1.446	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)CC3CCOCC3)C2)C1	1830537828	PZVMETDUBISBBF-DNVCBOLYSA-N	447.370	1.291	50	20	IDGD	
C/C(=C\c1ccc(C)o1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1830732088	UPSGWONONDFZSK-MDIGLQKYSA-N	426.897	1.047	50	20	IDGD	
Cc1ccc(/C=C/C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)s1	1830738593	QJXIOENLHAOHBT-CHYGHELMSA-N	428.938	1.126	50	20	IDGD	
Cc1cccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)n1	1830923208	YBPJRDSXKVOOMW-HNAYVOBHSA-N	440.338	1.172	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(C)n4ccnc4n3)C2)C1	1831654235	RRFWVVFQRPYSKD-HRAATJIYSA-N	449.939	1.515	50	20	IDGD	
Cc1csc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)c1	1831782012	ICCIEEIJSGBNJZ-GUYCJALGSA-N	431.352	1.910	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@H](N)c2ccccn2)CC1	1831870844	GONMIWRRVLSTTP-SIKLNZKXSA-N	444.580	1.074	50	20	IDGD	
Cc1nc(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](C)Br)CC3)CC2)co1	1834205294	KNRBHWUFLGQGCE-GFCCVEGCSA-N	427.343	1.952	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)c3cc(Cl)ccn3)C2)C1	1834823078	HVENPFUYUKJOQN-QGZVFWFLSA-N	446.729	1.590	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cnc4[nH]ncc4c3)CC2)CC1	1835526500	KEKYVLKCXFCYBG-SFHVURJKSA-N	448.955	1.397	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)c1cc2cnccc2[nH]1	1835611636	TUJOPMGCJXGMDD-IBGZPJMESA-N	433.940	1.348	50	20	IDGD	
C[C@H](C(=O)N1CCC(N2CCC(NC(=O)[C@@H](F)Br)CC2)CC1)n1cncn1	1836414255	BGHPCYKVMDHYHH-IUODEOHRSA-N	445.337	1.101	50	20	IDGD	
Cc1nc(N)sc1C(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836716530	AGTAIAFSKOVKLJ-AWEZNQCLSA-N	430.958	1.246	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)c3cc(O)ncn3)CC2)CC1	1836941954	OKHBFYXJCRIQEP-LBPRGKRZSA-N	441.326	1.578	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3n[nH]c4ccc(F)cc34)CCO2)C1	1837043038	OXVVOWRXMOYLDX-MGPUTAFESA-N	438.887	1.789	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3c[nH]c4cnccc34)CCO2)C1	1837173598	ZXOVTBMSBHLDLJ-NRFANRHFSA-N	434.924	1.898	50	20	IDGD	
C[C@H](Sc1cccs1)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1	1837226693	JCDSQMVRDNHWKQ-IYOUNJFTSA-N	448.994	1.285	50	20	IDGD	
Cc1cnn([C@@H](C)C(=O)N2CCOC[C@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)c1	1837718074	XDYGJIKJWRGIQC-PXNSSMCTSA-N	438.601	1.060	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cnc(N)s3)CC2)CC1	1837901179	PYUJCSIBWVQTPW-CQSZACIVSA-N	430.958	1.591	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)Cc3cnc[nH]3)CC2)CC1	1838072009	HIFNBHVXYDWGPB-CYBMUJFWSA-N	427.343	1.734	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cccc(OC)n3)C2)C1	1839142127	FKEQBUUDRUUPML-UZLBHIALSA-N	425.913	1.107	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3COc4ccccc4O3)C2)C1	1839142464	PWPRNDSWAKPYSO-UQASEVPWSA-N	438.908	1.300	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(F)cnc3Cl)C2)C1	1839145438	HROLRQMCZZGCMK-KBXCAEBGSA-N	434.295	1.962	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3cn[nH]c3)C2)C1	1839150485	NUKXSTXUNAGSRP-QZTJIDSGSA-N	433.336	1.035	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCBr)C2)C1	1839150908	BUZKFIXKZXIAAM-CABCVRRESA-N	446.169	1.464	50	20	IDGD	
O=C([C@H](F)Br)N1CCO[C@]2(COCCN(C(=O)C3(C(F)(F)F)CC3)C2)C1	1839200593	KUKLNSJVKCJIFK-GXFFZTMASA-N	447.223	1.476	50	20	IDGD	
O=C(c1[nH]cc2c1CCC2)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839201006	UWIVMGZGHBRVML-QAPCUYQASA-N	444.301	1.264	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3[nH]cc4c3CCC4)C2)C1	1840034226	FEQHVPVKTZCNMA-YJYMSZOUSA-N	440.338	1.357	50	20	IDGD	
CCOc1ccccc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](Cl)COC)CCO2	1840154200	PCHPVUIAZFXMAU-UWJYYQICSA-N	440.924	1.409	50	20	IDGD	
Cc1ccccc1NCC(=O)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840188209	WNGKMDHHUATSLB-IBGZPJMESA-N	430.332	1.667	50	20	IDGD	
COc1cccc(Cl)c1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1	1840735942	XRPQZLJATGPKME-LIRRHRJNSA-N	447.315	1.018	50	20	IDGD	
O=C(c1cn2cccc(Br)c2n1)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1	1841353148	GVIDUEAZOUVEHG-CYBMUJFWSA-N	441.713	1.514	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@H](CCO)NC(=O)OC(C)(C)C)C2	1841665910	AISOLFGQKZNWTP-LSDHHAIUSA-N	431.961	1.873	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)CSc2ccccc2)C1	1842728110	XCAJMYCLCWJWNT-UHFFFAOYSA-N	425.514	1.294	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)[C@@H]1CCc3ccoc3C1)C2	1843415272	HKDMSHGTMXPYIJ-SCELWYEFSA-N	437.500	1.722	50	20	IDGD	
Cn1c(=O)n(C)c2cc(C(=O)N3CCCC34CN(C(=O)[C@](C)(Cl)CCl)C4)ccc21	1843734650	XESFYOZUOKPXGU-LJQANCHMSA-N	439.343	1.930	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)c1cc(C)no1)C2	1844692077	DIABNVQTVHWLFQ-UHFFFAOYSA-N	428.401	1.947	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1ccc2c(n1)NC(=O)CC2	1847498010	AJBNSFMWAAIVIG-UGFHNGPFSA-N	435.322	1.813	50	20	IDGD	
CSc1ccc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1[N+](=O)[O-]	9620463	QNSNKVIIGUDGDD-HNNXBMFYSA-N	447.425	1.461	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCC(C)(C)N2C[C@H](C)O[C@H](C)C2)cc(OC)c1OC	10368879	ZLNKSJNTJBEUCX-OKILXGFUSA-N	438.525	1.544	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c2ccccc2c1=O	15314506	GAYDQHLSQWIBRD-UHFFFAOYSA-N	448.527	1.390	50	20	IDGD	
CNS(=O)(=O)c1ccc(C)c(C(=O)NNC(=O)c2ccc(OC(C)C)c(OC)c2)c1	27238669	NKEOHBDNEXECBQ-UHFFFAOYSA-N	435.502	1.774	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc3[nH]c(C(F)F)nc3c2)c1	110742916	GIMKAADGVRKLJH-UHFFFAOYSA-N	437.428	1.826	50	20	IDGD	
CC[C@@H](C)C(=O)N1Cc2ccccc2C[C@H]1C(=O)NNC(=O)CNC(=O)c1cccs1	725739862	NUHLHBUTWGLEBH-PBHICJAKSA-N	442.541	1.625	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCC(C(=O)Nc3ccc(F)cc3)CC2)n1	726184156	KXWIGGJVJZBMLG-UHFFFAOYSA-N	433.509	1.631	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)CCOc3ccc(S(N)(=O)=O)cc3)cc2C1	726382548	VKBNHHOVOSYALM-GFCCVEGCSA-N	437.543	1.750	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)NCc1cccc(C(=O)NCCN(C)C)c1	727480145	VYGBGOGHCMNIDM-UHFFFAOYSA-N	437.504	1.078	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)N[C@H](C)c1cccc(S(=O)(=O)N(C)C)c1	727610876	VXBJZXDWYYOMQX-CYBMUJFWSA-N	444.517	1.598	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H]2CCCOC2)c1	727723464	YLRRJBPXHBGEPB-HNNXBMFYSA-N	433.486	1.684	50	20	IDGD	
COc1ccc(CCNC(=O)NNC(=O)c2c(C)nc3ccccn23)c(OC)c1OC	727843397	JGZNWCWERLGIJV-UHFFFAOYSA-N	427.461	1.855	50	20	IDGD	
O=C1Cc2cc(S(=O)(=O)NNC(=O)c3cc(F)ccc3Br)ccc2N1	728510485	ZZRWTHZMVQITBT-UHFFFAOYSA-N	428.239	1.706	50	20	IDGD	
Cc1ccc(N2C[C@@H](C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)CC2=O)cc1F	728846010	UGWUHEHKLDQJNB-INIZCTEOSA-N	440.479	1.341	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Cc2c[nH]c3cccc(C)c23)cc1	728856335	YCWLONZTHRQLOU-UHFFFAOYSA-N	428.514	1.795	50	20	IDGD	
CC[C@H](C)NC(=O)CN1CCN(C(=O)NNC(=O)c2cc3c(s2)CC[C@H](C)C3)CC1	728944630	IADXJPAQQGXGEW-GJZGRUSLSA-N	435.594	1.760	50	20	IDGD	
CCS(=O)(=O)N1CCC[C@H](C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)C1	728972016	CIZVKMINSOMGFJ-NSHDSACASA-N	425.479	1.188	50	20	IDGD	
O=C(Cc1cc[nH]n1)NNC(=O)c1ccc(NS(=O)(=O)c2ccc(F)c(F)c2)cc1	730091506	CRNFVWVINURTMA-UHFFFAOYSA-N	435.412	1.492	50	20	IDGD	
O=C(CCCS(=O)(=O)c1ccc(Br)cc1)NNC(=O)N1CCOCC1	731004793	JHCINVCNOZOALC-UHFFFAOYSA-N	434.312	1.076	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)Nc1ccc(S(=O)(=O)C[C@H]2CCCO2)cc1	731401055	JWEAFIQAFBPAEG-OAHLLOKOSA-N	449.485	1.577	50	20	IDGD	
CC(=O)Nc1ccc(NS(C)(=O)=O)c(C(=O)NNC(=O)Cc2c[nH]c3ccccc23)c1	731433362	BLBZFIWJWKGZFH-UHFFFAOYSA-N	443.485	1.502	50	20	IDGD	
CC(C)c1nc(C#N)c(NNC(=O)[C@@H]2CCCC[C@@H]2C(=O)N[C@H]2CCS(=O)(=O)C2)o1	731620824	OSCVZBHTPJADLJ-MELADBBJSA-N	437.522	1.222	50	20	IDGD	
COc1ccc(Br)c(C(=O)NCCCNC(=O)NNC(=O)C(C)(C)C)c1	731685321	YBAZAVPHROLICD-UHFFFAOYSA-N	429.315	1.954	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2ccc3c(c2)C(=O)OC3)cc1Br	732048549	NQGNETINBKTKQP-UHFFFAOYSA-N	441.259	1.751	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)[C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)c1	732050279	QMRNCGPQZLCIMH-CQSZACIVSA-N	432.458	1.796	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(\C#N)C(=O)NNC(=O)CCN2C[C@H](C)O[C@@H](C)C2)c1C	732262197	RPJBQRPSGDDEHT-OXERXCCXSA-N	445.564	1.866	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)[C@@H]1CCCN(C(=O)c2ccc3n[nH]cc3c2)C1	732303445	DZJVRFPNXBHFAH-OAHLLOKOSA-N	441.513	1.962	50	20	IDGD	
CC1CCC(N2C[C@@H](C(=O)OCC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)CC2=O)CC1	732346012	LEJJQLZXHKVPAB-SIWZUTFBSA-N	446.460	1.326	50	20	IDGD	
C[C@H](c1nc(-c2cccs2)no1)N1CCN(CC(=O)NNC(=O)c2cccs2)CC1	732984424	SHSNRKFUMWNFTP-CYBMUJFWSA-N	446.558	1.999	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)N2CCN([C@H]3CCN(c4ccccc4)C3=O)CC2)cc1	732995059	LGCOMZJPCNSAQW-FQEVSTJZSA-N	432.484	1.336	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(N2CCCC2=O)cc1)c1cnn(-c2ccccc2)c1	733122923	ISPGLOMRGMTGHR-UHFFFAOYSA-N	425.470	1.622	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)NCCN2CCN(C(=O)C3CCCCC3)CC2)cc1	733344222	GEQPHACZFGYPKM-UHFFFAOYSA-N	426.521	1.227	50	20	IDGD	
CCS(=O)(=O)CC(C)=NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	733745758	UHXCHPQQSHMUIP-UHFFFAOYSA-N	437.543	1.706	50	20	IDGD	
COc1ccc([C@@H]2[C@H](C(=O)NNC(=O)COc3ccccc3O)CCC(=O)N2C)cc1	734433288	CDOLEUTXXJAQPT-IIBYNOLFSA-N	427.457	1.537	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)COc2cccc(Cl)c2C)cc1	736066934	ZBWPZJMWQPUYNH-UHFFFAOYSA-N	439.921	1.804	50	20	IDGD	
Cc1nn(C)cc1[C@H](C)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	739033396	BTSRWAAVXNXBRT-ZDUSSCGKSA-N	434.522	1.218	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)cc1NC(=O)NC(C)(C)C	740819283	ZJIDYMPOHUMNAY-CYBMUJFWSA-N	425.511	1.046	50	20	IDGD	
O=C(COC(=O)c1ccc(SCCCO)cc1)NNC(=O)[C@H]1COc2ccccc2O1	740978144	SDALZVQNEUXTAA-GOSISDBHSA-N	446.481	1.305	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNS(=O)(=O)c2cccc(-c3nnnn3C)c2)cc1	742025598	OTEARPPZDYUWSE-UHFFFAOYSA-N	444.517	1.925	50	20	IDGD	
Cc1cc(N2CC[C@H](NC(=O)NNC(=O)c3cccc(Br)c3)C2=O)n(C)n1	743688038	UPSGALDIFDRATF-ZDUSSCGKSA-N	435.282	1.241	50	20	IDGD	
CCS(=O)(=O)NCc1ccc(C(=O)NNC(=S)NCCc2cccs2)cc1	743822557	OGHVGCHFLAZECD-UHFFFAOYSA-N	426.589	1.539	50	20	IDGD	
O=C(CCC(=O)N1CCOCC1)NNC(=O)Nc1ccc(Br)cc1Cl	743831550	RWPDDRDGDUMNGJ-UHFFFAOYSA-N	433.690	1.894	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)CNC(=O)c2ccc(C(F)(F)F)cc2)cc1	744564350	JYDYECYCVAWKRK-UHFFFAOYSA-N	448.357	1.311	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N(C)C)cc1S(=O)(=O)NCc1ccc(Cl)cc1	746003933	WTHTVWHCRBMYBE-UHFFFAOYSA-N	440.909	1.743	50	20	IDGD	
C[C@H](C(=O)NNC(=O)CSc1ccc(Cl)cc1)N1C(=O)[C@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O	746093718	LOXOLCJWPPXCBS-CEMKBHKYSA-N	437.905	1.130	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCn3c(CCc4ccccc4)nnc3C2)n1	746471820	NIHPXNZVZRLTQJ-UHFFFAOYSA-N	439.545	1.034	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)NCc1nnc2ccc(C(F)(F)F)cn12	746739467	BMALLECDHQZTDG-UHFFFAOYSA-N	432.366	1.469	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)[C@@H]1CCCN(C(=O)c2ccccc2OC(F)F)C1	747324835	KQNZLCSCUDOVRX-OAHLLOKOSA-N	432.427	1.925	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)CS(=O)(=O)Nc1ccc(N2CCCCC2)cc1	747429191	GNSLPROQNIWKBQ-UHFFFAOYSA-N	431.518	1.204	50	20	IDGD	
O=C(CN1CCC[C@@H](CN2CCN(c3ccccn3)CC2)C1)NNC(=O)c1ccccc1	748319348	UUCRVPHEOYGREN-FQEVSTJZSA-N	436.560	1.377	50	20	IDGD	
Cc1cccc(N2CCN(S(=O)(=O)CC(=O)NNc3cc(Cl)nc(C)n3)CC2)c1	748335521	OMBSMHCUVGKSTH-UHFFFAOYSA-N	438.941	1.342	50	20	IDGD	
O=C(CCN/C(O)=C1\N=CC=CC1=O)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1	748523646	YALIQBODUJFHMV-CCEZHUSRSA-N	432.380	1.340	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)Cn3cc4ccccc4n3)cc2)CC1	748623318	MFWFQCULQVIQRL-UHFFFAOYSA-N	428.518	1.116	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N(C)C[C@@H]2CCOC2)cc1	749433603	WDCLNFMCHGHNRN-GYKGCMEESA-N	437.500	1.836	50	20	IDGD	
CCN(CC(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccc(OC)cc2)c1)C1CC1	749568591	PEYZFOQSYXPBKA-UHFFFAOYSA-N	446.529	1.741	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc3nc(O)n(C)c3c2)c1	751539107	PXVGAMRPIVZJST-UHFFFAOYSA-N	445.501	1.384	50	20	IDGD	
CN(c1ccccc1)S(=O)(=O)c1cccc(NC(=O)NNC(=O)Cc2cc[nH]n2)c1	755411071	ZPTHQXYXHJEQML-UHFFFAOYSA-N	428.474	1.630	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCOCC2)cc1NC(=O)NNC(=O)c1ccccc1C	755412059	OSONVXFRXFPUQS-UHFFFAOYSA-N	448.501	1.491	50	20	IDGD	
CN1CCN(C(=O)c2ccccc2NC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)CC1	755621355	CARONWUNRJDEGC-UHFFFAOYSA-N	447.499	1.726	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN2CCN([C@@H](C)C(=O)N3CCCC3)CC2)cc1C	756050101	XELBYKRPRCTCGX-INIZCTEOSA-N	435.594	1.008	50	20	IDGD	
NC(=O)CCNC(=O)c1cccc(NC(=O)NNC(=O)c2ccccc2Br)c1	756390525	ILOXNTFQJPNQGP-UHFFFAOYSA-N	448.277	1.521	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN(C)[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1OC	756543732	MIWWURPHYKFFGQ-OAHLLOKOSA-N	436.509	1.406	50	20	IDGD	
CNS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2ccc(Br)s2)cc1	756641416	VTVLJAWWXGJAED-UHFFFAOYSA-N	433.309	1.885	50	20	IDGD	
Cc1c(NC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cccc1S(=O)(=O)NC1CC1	756704278	GFBMUMQPIWNXEQ-UHFFFAOYSA-N	433.446	1.810	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)Nc2ccc(C[C@@H]3CC(=O)NC3=O)cc2)o1	756814140	CXPIGLXBUVZTBA-OAHLLOKOSA-N	441.488	1.793	50	20	IDGD	
COC(=O)c1cc(NC(=O)NNC(=O)c2ccc(Cl)nc2)cc(S(C)(=O)=O)c1	757674940	YHFBZRSEIUWUQW-UHFFFAOYSA-N	426.838	1.392	50	20	IDGD	
Cc1nn([C@@H]2CCS(=O)(=O)C2)c(C)c1NC(=O)NNC(=O)c1ccc2c(c1)OCCO2	757871268	HYGSSSALYIJWTM-CQSZACIVSA-N	449.489	1.097	50	20	IDGD	
CN(Cc1ccco1)Cc1ccccc1CNC(=O)NNC(=O)C(=O)Nc1ccccn1	758803518	KJGGHYMQJQBTNR-UHFFFAOYSA-N	436.472	1.776	50	20	IDGD	
CC(=O)N[C@H](CC(=O)NNC(=O)C(=O)Nc1ccccn1)c1ccc(Br)cc1	758829342	YESYHMONFAFNOD-CQSZACIVSA-N	448.277	1.198	50	20	IDGD	
COC(=O)c1cccc(CC(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)c1	759606910	CEICRLQKBHTEBE-UHFFFAOYSA-N	438.528	1.289	50	20	IDGD	
C[C@@H](CO)CCCNC(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	759635772	XBHULDHZTQHAHG-MRXNPFEDSA-N	437.500	1.797	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN2CC[C@H](N3CC(=O)Nc4ccccc43)C2)cc1C	759895961	APWNYRCRMYRBMK-HNNXBMFYSA-N	441.557	1.913	50	20	IDGD	
COc1ccc(C(=O)NNc2ncc(F)cn2)cc1S(=O)(=O)NCc1ccccn1	760914839	YBUREMBENVECHJ-UHFFFAOYSA-N	432.437	1.255	50	20	IDGD	
COc1ccc(S(=O)(=O)NC(C)(C)C)cc1NC(=O)C(=O)NNC(=O)c1ccccc1	763419276	BABFHGQUMGYITC-UHFFFAOYSA-N	448.501	1.172	50	20	IDGD	
COCCn1ncc2ccc(NC(=O)C(=O)NNC(=O)c3ccc4ccccc4n3)cc21	763449916	KHINMDMAGYCCON-UHFFFAOYSA-N	432.440	1.631	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2C)cc(OC)c1OC	763540465	VNHULLGAKJLWAI-UHFFFAOYSA-N	432.389	1.329	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)C(=O)Nc2cnn(C)c2C)cc(OCC)c1OCC	763542587	HBHVYCLYOSWOHS-UHFFFAOYSA-N	433.465	1.324	50	20	IDGD	
CC(=O)Nc1cc(NC(=O)C(=O)NNC(=O)COc2cc(C)cc(C)c2)c(F)cc1F	763644331	IKBVKWGSYPVGPX-UHFFFAOYSA-N	434.399	1.705	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccnc(OCC(F)(F)F)c2)cc1C	763681460	XSSNJWWCBIFSMW-UHFFFAOYSA-N	440.378	1.804	50	20	IDGD	
COC(=O)CCc1ccc(NC(=O)C(=O)NNC(=O)c2cc(OC)cc(OC)c2)cc1	763774283	AEWLGASBYHTCAQ-UHFFFAOYSA-N	429.429	1.209	50	20	IDGD	
CC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)cc1	763790369	ISOAPKFCXYECRR-UHFFFAOYSA-N	435.440	1.580	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(Cl)c(C(=O)NC3CC3)c2)cc1	763810089	ZRZJWGUFCDYYQO-UHFFFAOYSA-N	444.875	1.706	50	20	IDGD	
CN(C)CCn1ncc(C(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1-c1ccccc1	763919837	ODEGHXHMFQFOQT-HXUWFJFHSA-N	435.484	1.713	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)Nc1cccnc1OCC(F)F	764002772	RVIVRYNXGOQHTM-UHFFFAOYSA-N	446.208	1.226	50	20	IDGD	
COc1cc(C)c(NC(=O)C(=O)NNC(=O)c2cc(Br)cn2C)cc1OC	764004264	ARVDEVVDRTYPSE-UHFFFAOYSA-N	439.266	1.513	50	20	IDGD	
CC[C@H](C)C(=O)NNC(=O)C(=O)Nc1cccc(S(=O)(=O)N(C)c2ccccc2)c1	764082595	DYBWIXLXABCILP-AWEZNQCLSA-N	432.502	1.644	50	20	IDGD	
O=C1C[C@H](c2cccc(NC(=O)C(=O)NNC(=O)Cc3ccc4ccccc4c3)c2)CN1	764084229	IXXBXSYFRLZQSI-IBGZPJMESA-N	430.464	1.772	50	20	IDGD	
C[C@@H]1CN(Cc2ccccc2NC(=O)C(=O)NNC(=O)c2ccc(Cl)nc2)C[C@@H](C)O1	764099928	DUOCPZWDKMKBBZ-ZIAGYGMSSA-N	445.907	1.744	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cnc3c(cnn3C(C)C)c2)o1	764139758	ZTVWNQZCVAJIFW-UHFFFAOYSA-N	441.492	1.847	50	20	IDGD	
CCOC(=O)c1ccn(-c2ccccc2NC(=O)C(=O)NNC(=O)CCc2ccco2)n1	764178041	ZBONRORECXQHRN-UHFFFAOYSA-N	439.428	1.361	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2O)nn1-c1ccccc1Cl	764276858	CXIRHONJIDCXRG-UHFFFAOYSA-N	443.847	1.705	50	20	IDGD	
CC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2cc(Br)ccc2O)cc1C	764280002	KPAKSDQMUIDRFK-UHFFFAOYSA-N	449.261	1.821	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)C(=O)Nc1ccnn1-c1cccc(Cl)c1	764281603	ZRSKLQJJAIGEKH-UHFFFAOYSA-N	427.848	1.950	50	20	IDGD	
Cc1cc(S(N)(=O)=O)cc(NC(=O)C(=O)NNC(=O)c2cc3ccccc3o2)c1C	764331745	ZDRWBYFQNTYBSS-UHFFFAOYSA-N	430.442	1.097	50	20	IDGD	
CC(=O)Nc1cc(NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)ccc1C	764382629	NPHFZQPDPFMEPA-UHFFFAOYSA-N	426.458	1.805	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1cnc2c(cnn2C(C)C)c1	764397383	HYRHWNPLZZDPFI-UHFFFAOYSA-N	442.501	1.899	50	20	IDGD	
CN(C)CCOc1ccc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)cc1	764403864	DXMJVTUVUVWIBP-UHFFFAOYSA-N	432.502	1.211	50	20	IDGD	
C[C@H]1CN(C(=O)OC(C)(C)C)CC[C@H]1NC(=O)NNC(=O)c1nnc(O)c2ccccc12	764562952	FBPVEEAAXVDTGQ-SWLSCSKDSA-N	444.492	1.925	50	20	IDGD	
COC(=O)c1ccc(C(=O)NNC(=O)c2cc(-c3ccc(OC)c(OC)c3)[nH]n2)cn1	765596717	KMKIPSDFIJPQOP-UHFFFAOYSA-N	425.401	1.350	50	20	IDGD	
C[C@@H](OC[C@@H]1CCCO1)C(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	766663365	KGUSZCLQIAQVRT-APWZRJJASA-N	438.956	1.189	50	20	IDGD	
Cc1ncc(C(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)c(N)n1	769470919	VEPKOWMRACUKQC-UHFFFAOYSA-N	432.487	1.304	50	20	IDGD	
C[C@H]1C[C@H](NC(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)CCO1	770356477	WPVSTGGTVVYWBJ-HNAYVOBHSA-N	435.488	1.900	50	20	IDGD	
COc1cccc(-c2noc([C@@H](C)NC(=O)NNc3nc(O)c4cnn(C)c4n3)n2)c1	770400638	QSESPXVROGFRGY-SECBINFHSA-N	425.409	1.515	50	20	IDGD	
COCCC(=O)N1CCC(NC(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)CC1	770544731	SMUDVGMBSKWHNW-CYBMUJFWSA-N	426.901	1.465	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)[C@@H]3CS[C@@]4(c5ccc(F)cc5)CCC(=O)N34)nc21	770973599	NMHWFPANYLZXAC-ORAYPTAESA-N	443.464	1.242	50	20	IDGD	
O=C(NNC(=O)c1c(F)ccc(F)c1F)c1ccc(S(=O)(=O)N2CCCC2)cc1	771884065	WFWPNPDBAYRCIK-UHFFFAOYSA-N	427.404	1.963	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCCNC(=O)NNC(=O)COc2ccc(C)c(C)c2)s1	772629528	BONSRABDBPNAAG-UHFFFAOYSA-N	440.547	1.361	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)Nc2cnn(Cc3nnc4n3CCCC4)c2)cc1	772639478	HFFGSUONJHDXBN-UHFFFAOYSA-N	438.492	1.653	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1cc(-c2cc(F)cc(F)c2)nn1C	773535332	UAHYZMRZGATEJB-UHFFFAOYSA-N	429.383	1.774	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1cccc(C(=O)N(C)C)c1	774003230	VQJOKALCISHCMH-LBPRGKRZSA-N	432.864	1.595	50	20	IDGD	
CC(C)NC(=O)Nc1ccccc1C(=O)N1CCN(S(=O)(=O)CBr)CC1	777836877	MBOUCFJOYPXEIB-UHFFFAOYSA-N	447.355	1.657	50	20	IDGD	
Nc1c(Cl)c(Cl)nc(C(=O)NNS(=O)(=O)c2ccc3c(c2)OCO3)c1Cl	777913600	OADBOONBGJXYBW-UHFFFAOYSA-N	439.664	1.976	50	20	IDGD	
Cc1c(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cnn1C1CCCCC1	781305083	GXYSASLLIHIPMI-IBGZPJMESA-N	442.472	1.841	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)NCc2ccccc2CN2CC[C@H](O)C2)nc2ccccc21	781952993	IHNBYRZYWIOXME-SFHVURJKSA-N	436.516	1.213	50	20	IDGD	
CN1CCC[C@H](N(C)C(=O)c2ccc(NC(=O)C(=O)NNc3ncncc3Cl)cc2)C1	782166671	UEQNDWLVUWMSPE-HNNXBMFYSA-N	445.911	1.378	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)C(C)C)cc1NC(=O)C(=O)NNc1cncc(Cl)n1	783260075	VUXMCLOSIMXWJS-UHFFFAOYSA-N	440.913	1.549	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2cc(Cl)ccc2OCCS(C)(=O)=O)nc(C)n1	783324316	GUJXJWWLLZWVGL-UHFFFAOYSA-N	441.897	1.252	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)[C@@H]3CO[C@@H](C)C3)c2)cc1	784142987	DBRYMQUNLVRONG-ZFWWWQNUSA-N	433.486	1.682	50	20	IDGD	
COC(=O)Cc1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)cc1	784835904	ZKYWRLJZAJSWKI-UHFFFAOYSA-N	441.412	1.480	50	20	IDGD	
Cc1nc(Br)ccc1NC(=O)C(=O)NNC(=O)Cc1cn2ccccc2n1	785060647	IXQKBDAYFPAJPF-UHFFFAOYSA-N	431.250	1.129	50	20	IDGD	
CS(=O)(=O)N1CCN(c2ccc(NC(=O)/C(C#N)=C/c3ccc(O)cc3)cn2)CC1	787348858	UIEMXRDGKADKDU-FOWTUZBSSA-N	427.486	1.414	50	20	IDGD	
CCCCN1C(=O)CC[C@@H](C(=O)NNC(=O)N2CCN(C)CC2)[C@H]1c1ccc(OC)cc1	788168836	FNGNWVJOUFKEQD-TZIWHRDSSA-N	445.564	1.763	50	20	IDGD	
O=C(NNC(=O)c1nc2cccnc2s1)c1ccc(S(=O)(=O)N2CCCC2)cc1	788265561	NQTFMKYBCGCLRH-UHFFFAOYSA-N	431.499	1.551	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1nc([C@H]2C[C@H]3CC[C@H]2C3)cs1	789734077	ATBBPBDQGIMPBN-AVGNSLFASA-N	430.486	1.917	50	20	IDGD	
CCNC(=O)Nc1cccc(NC(=O)C(=O)NNc2nccc(N(CC)CC)n2)c1C	789771062	UXMGJAFWOYRDJB-UHFFFAOYSA-N	428.497	1.854	50	20	IDGD	
CN(C[C@@H]1C[C@H](F)CN1C(=O)NNC(=O)CNC(=O)c1ccco1)C(=O)OC(C)(C)C	790692957	SNNIQUVRVYFJNF-STQMWFEESA-N	441.460	1.030	50	20	IDGD	
Cc1cc(C(=O)N2CCOCC2)ccc1NC(=O)C(=O)NNc1cccc(F)c1[N+](=O)[O-]	790999969	IGOZMLOVGFHZSD-UHFFFAOYSA-N	445.407	1.597	50	20	IDGD	
O=C(CC1OCCO1)NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2Cl)c1	792773782	XJXDTKCDYIDQSC-UHFFFAOYSA-N	439.877	1.665	50	20	IDGD	
CSC[C@H](C)C(=O)N1CCC(C(=O)NNc2ccccc2S(=O)(=O)N(C)C)CC1	795181042	GVETZCUFTWSKHY-AWEZNQCLSA-N	442.607	1.618	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cc3c(OC)ccc(F)c3[nH]2)cc1OC	796202565	RKBIWLNHHBALKH-UHFFFAOYSA-N	445.403	1.951	50	20	IDGD	
CCOc1ccccc1CN1CCN(CC(=O)NNC(=O)Cc2nc(C)cs2)[C@H](C)C1	799345240	WFGVPGCNDUPYTG-QGZVFWFLSA-N	445.589	1.746	50	20	IDGD	
CC(C)Oc1ncccc1C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	806781739	FIJKSJAEIRIMRS-UHFFFAOYSA-N	433.534	1.562	50	20	IDGD	
Cc1cc([N+](=O)[O-])ccc1NNC(=O)CNS(=O)(=O)c1ccc2c(c1)OCCCO2	807776850	GDJQKDUCGAVLKD-UHFFFAOYSA-N	436.446	1.486	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NNC(=O)c2cc(N3CCOCC3)ccn2)C1	808011304	SBMZUMZXWXWFSM-OAHLLOKOSA-N	433.509	1.326	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccccn2)c(C(=O)NCC(F)(F)F)cc1F	810385416	RYOXYKGRROASCK-UHFFFAOYSA-N	441.341	1.221	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cccc3c2OCC(=O)N3)c1C	810386246	RKCVKONGRYSGHN-ZDUSSCGKSA-N	426.429	1.188	50	20	IDGD	
N#Cc1ncn(-c2ccccc2NC(=O)C(=O)NNc2ccc(Br)cc2)n1	810391319	CAEAUEJEZRQQAE-UHFFFAOYSA-N	426.234	1.983	50	20	IDGD	
C[C@H]1CCCN(c2cc(C(=O)OCC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)ccn2)C1	812653748	PBSCRZPCZJGOLX-AWEZNQCLSA-N	441.444	1.844	50	20	IDGD	
COc1cc(Cl)cc(C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)c1	814210217	AWQVEXXTOUJSRE-UHFFFAOYSA-N	425.894	1.739	50	20	IDGD	
CCOc1ccc(S(=O)(=O)Nc2ccc(C(=O)NN=Cc3cnn(C)n3)cc2)cc1	814697002	UFMONRZNXBRGSE-UHFFFAOYSA-N	428.474	1.779	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NN=Cc1cccnc1Cl	814711123	XFIIPWPXOXQIQZ-UHFFFAOYSA-N	436.921	1.839	50	20	IDGD	
CCOc1ccc(OCc2ccc(C(=O)NNC(=O)CCn3ncn(C)c3=O)cc2)cc1	814716782	ROKNWUFLTBXSRL-UHFFFAOYSA-N	439.472	1.411	50	20	IDGD	
COCc1cc(NC(=O)C(=O)NNC(=O)COc2cc(C)ccc2C)cc(C(=O)OC)c1	815565499	QNFXGWVZVUGFIQ-UHFFFAOYSA-N	443.456	1.401	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)C(=O)Nc2cc(C)cn(C)c2=O)c1	815865928	JPGFLJLHEXIVDH-UHFFFAOYSA-N	437.250	1.325	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNS(=O)(=O)c3ccc4[nH]c(=O)c(=O)[nH]c4c3)cc2C1	817854455	OPLRTEVLYFMQRN-VIFPVBQESA-N	434.499	1.026	50	20	IDGD	
O=C(CC1CC1)NNC(=O)c1ccccc1NS(=O)(=O)c1ccc2nc(O)[nH]c2c1	819117836	GARCEAXZVUFTMU-UHFFFAOYSA-N	429.458	1.630	50	20	IDGD	
Cc1cc2ncc(C(=O)NNC(=O)c3ccc(S(=O)(=O)N4CCCC4)cc3)c(C)n2n1	849164216	IFJDBOWVZUMHBR-UHFFFAOYSA-N	442.501	1.205	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc2c(c1)nc(CCC(=O)NNc1ncccn1)n2C	913043859	BGUFUMJYASNLKN-UHFFFAOYSA-N	431.522	1.470	50	20	IDGD	
Cc1ccn2c(=O)c(C(=O)NNC(=O)COc3ccc(Br)cc3)cnc2c1	915635460	DKCHQFKKJMVPPX-UHFFFAOYSA-N	431.246	1.605	50	20	IDGD	
C[C@@H](CCc1ccccc1)NC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	915884246	VNPYHUBDFRASNE-KRWDZBQOSA-N	446.577	1.665	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)COCc2ccc(OC)cc2)c1	916096150	ITRFRWSBXDIORG-UHFFFAOYSA-N	449.529	1.704	50	20	IDGD	
O=C(NCc1nnc2ccc(C(F)(F)F)cn12)NNC(=O)[C@H]1COc2ccccc2O1	916222410	CHBFNDXBRFFZJP-CYBMUJFWSA-N	436.350	1.419	50	20	IDGD	
CCC(CC)[C@H](CNC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)N1CCOCC1	916256388	UTANXXNNKIYBAE-SFHVURJKSA-N	440.566	1.171	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2ccc(OC3CCCC3)nc2)c1	916396338	LKOXDFFIRVSONJ-UHFFFAOYSA-N	432.502	1.951	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCCCN2C[C@@H](C)C[C@H](C)C2)c2ccccc2c1=O	916461160	WLKDRFCNEPHXLG-HOTGVXAUSA-N	428.537	1.728	50	20	IDGD	
CCCOc1ccc(C(=O)NNS(=O)(=O)c2n[nH]c(C)c2C(=O)OCC)cc1OC	917727759	OVSSBLXUJJLDTL-UHFFFAOYSA-N	440.478	1.316	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNS(=O)(=O)c2cc(C(=O)O)cc3c2CCC3)cc1C	917728842	QYOZUNYISCDJJP-UHFFFAOYSA-N	431.470	1.439	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNS(=O)(=O)c2ccc3c(c2)CCCC(=O)N3)cc1C	917728865	RQZKNANOSZPLER-UHFFFAOYSA-N	430.486	1.526	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2sccc2Br)c1	917737969	VPJIVCLXAXTQQD-UHFFFAOYSA-N	439.334	1.537	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)c1c(F)cccc1F	918100919	DUHFMQSIPUDELH-NSHDSACASA-N	426.445	1.920	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CCN2CCCS2(=O)=O)ccc1OCCC(C)C	918204568	KINJFMVPHIFVDT-UHFFFAOYSA-N	427.523	1.307	50	20	IDGD	
CC(C)[C@@H](Oc1ccccc1C#N)C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	918277599	IWZWOUQRPATAFZ-LJQANCHMSA-N	444.513	1.673	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)CCNS(=O)(=O)c2ccc(C(C)=O)cc2)cc1	919836637	ZKRUUUSFWYCNFK-UHFFFAOYSA-N	447.513	1.346	50	20	IDGD	
Cc1ccc(C)c(-n2ccnc2SCC(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)c1	919884299	HSQGEVBAQBPAEY-CQSZACIVSA-N	437.547	1.099	50	20	IDGD	
C[C@H](OC[C@H]1CCCO1)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	921018701	ANYZIMKJHFUDEM-DOTOQJQBSA-N	439.534	1.206	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)c2cn(Cc3cccs3)nn2)CC1	1116151802	JETNHLQLUACGEE-UHFFFAOYSA-N	434.522	1.796	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@H]2CCCN2C(=O)c2ccc(OC)cc2OC)cc1	1317814344	WJYMDQORIKWLGW-GOSISDBHSA-N	427.457	1.778	50	20	IDGD	
O=C(NNC(=O)[C@H]1CC(=O)N(c2ccccc2Br)C1)c1n[nH]c2c1CCCC2	1317814706	DVOZQRUSNRYREP-NSHDSACASA-N	446.305	1.865	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1ccc(Cn2cccc2)cc1	1319288933	FMPBXOGIDCYUSK-UHFFFAOYSA-N	445.523	1.755	50	20	IDGD	
O=C(NCc1cccc(CN2CCOCC2)c1)NNC(=O)c1cncn1-c1ccccc1	1319301649	MALUUOXBUBHVKW-UHFFFAOYSA-N	434.500	1.849	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc3c(cn2)OCCC3)c1	1320857045	BRDSSEGRHVMPFH-UHFFFAOYSA-N	432.502	1.512	50	20	IDGD	
O=C(NNC(=O)c1ccc(Br)cc1)Nc1cccc(CN2C(=O)CNC2=O)c1	1321024698	UMTXYGXGDPTSBF-UHFFFAOYSA-N	446.261	1.967	50	20	IDGD	
CCOc1ncccc1CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(CC)CC)c1	1321724969	KCQXGBQABLKMIC-UHFFFAOYSA-N	449.533	1.655	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNS(=O)(=O)c1cnc2c(cnn2C)c1	1324179395	VVBYOUQFRLNFIK-ZDUSSCGKSA-N	425.470	1.899	50	20	IDGD	
Cc1nn([C@H]2CCS(=O)(=O)C2)c2nc(C3CC3)cc(C(=O)NNc3ncccn3)c12	1337271198	BOMIMLNDCJOMDT-ZDUSSCGKSA-N	427.490	1.524	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4nc(CO)[nH]c4c3)C2)C1	1777703921	JCIANEZOGBLAJM-OAQYLSRUSA-N	446.580	1.350	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)C3CN(C(=O)OC(C)(C)C)C3)C2)C1	1778124409	MIJCJVFOPPCLTH-MGPUTAFESA-N	429.945	1.701	50	20	IDGD	
O=C(c1c[nH]c2cccc(Cl)c12)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1778752360	SULFCRAMSQFTQV-KXBFYZLASA-N	426.300	1.865	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cn3cc(F)ccc3n1)CCO2	1779296903	LKCBIBIOCQIYGO-FQEVSTJZSA-N	434.544	1.768	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(C1)CN(C(=O)C1(C)CC1)CCO2	1780097322	XFYIPNQXKRUJHT-OAQYLSRUSA-N	431.445	1.764	50	20	IDGD	
COc1ccc(CC(=O)N2CC[C@@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)c(C#N)c1	1781173952	YJFRTHXLNOJGGN-QFIPXVFZSA-N	445.592	1.791	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)c3cnc4ncccn34)CCO2)C1	1781229118	CCPUNPQWRMSGNV-ZWKOTPCHSA-N	426.304	1.409	50	20	IDGD	
CN(C)c1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](F)Br)C3)C2)nc1	1781328378	PFASUPCMTVEDHL-YOEHRIQHSA-N	429.290	1.282	50	20	IDGD	
C[C@H](Cc1ccncc1)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781335100	VSCIPYBPAQTREG-XUWXXGDYSA-N	428.302	1.781	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)Cc3c(C)n[nH]c3C)C2)C1	1781433619	PKSSWXPYSCBFIT-QAPCUYQASA-N	427.343	1.572	50	20	IDGD	
Cc1cccc(Cl)c1C(=O)N1CC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1	1781723487	PKFXNMMDFRIQBF-JOCHJYFZSA-N	442.708	1.086	50	20	IDGD	
CCC(=O)N[C@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)Br)C1	1781997396	UUCZSFKYTVFDCC-HNSFDTNUSA-N	432.359	1.198	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1ccc(F)cn1)C2	1782170230	CNBZGXWZFNDFCR-SQGPQFPESA-N	427.904	1.531	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cn4c(F)cccc4n3)C2)C1	1782373933	ZYYPZEKDEISVBV-KPZWWZAWSA-N	439.285	1.700	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3n[nH]c4cccc(F)c34)C2)C1	1782485189	IQADFGUGYLGWJK-VOJFVSQTSA-N	439.285	1.929	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)COc3ccccc3F)C2)C1	1783360720	NVYJPHZGTZSBHV-FZKQIMNGSA-N	429.286	1.818	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)Cc3cnc4ccccn34)CCO2)C1	1783528109	JYNPWWMATNEPGZ-LIRRHRJNSA-N	435.322	1.490	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cnn4cccc(F)c34)CCO2)C1	1783537971	VBXLWFIHECOWSQ-XIKOKIGWSA-N	439.285	1.700	50	20	IDGD	
COC(=O)CCCCCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1784051570	TWHGUUDMASXKHQ-NVXWUHKLSA-N	437.306	1.630	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(N4C(=O)C=CC4=O)cc3)C2)C1	1785222389	BBBFINOGHQDMSQ-VGOFRKELSA-N	445.903	1.577	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(Cl)nc(OC)c3)[C@H]2C1	1789045001	UDTGMAMEAPJHSH-MXAVVETBSA-N	446.331	1.591	50	20	IDGD	
CCOC(=O)N[C@@H](O)C(=O)Nc1ccc(C2(NC(=O)[C@H](F)Br)CCC2)cc1	1789407116	WXDNEGKGZOGQOJ-WFASDCNBSA-N	446.273	1.876	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CSc3ncccn3)C[C@@H]21	1789866102	MATDASIYYJHEQF-WZTLGTBRSA-N	447.388	1.785	50	20	IDGD	
O=C1CSc2ncc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)[C@@H](F)Cl)C[C@@H]43)cc2N1	1790454556	CUASAHAYUCMEQV-YARBFKLUSA-N	442.900	1.254	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](N)c3ccccn3)C[C@@H]21	1790961881	SJAZQQDUFLCTBE-GFISCPRKSA-N	439.354	1.235	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3C[C@H]3c3ccccc3)[C@H]2C1	1791211077	VAMBNHVLSJRNFF-WHZJULEDSA-N	442.560	1.143	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1ccc(C2(NC(=O)[C@@H]3CCCS3(=O)=O)CCC2)cc1	1791571013	IPVXRHQJNWMGOK-HOTGVXAUSA-N	428.938	1.952	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@H]2[C@H](C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)[C@H](O)CCl)[C@@H]2C1	1793116893	YGHYJQUNXRHETR-FPDCHNRVSA-N	441.956	1.337	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(-c2ccco2)no1	1796129032	DKAKNCYOSPDJIR-OVZMXSCWSA-N	438.278	1.921	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1cc(C(F)(F)F)c[nH]1	1796546777	GNNBBCGJNGALIF-IWXIMVSXSA-N	442.207	1.927	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cc1cc(C)n(C)n1)C2	1796890614	ANTTZBRIHDKEQL-MIXIEYOXSA-N	439.520	1.043	50	20	IDGD	
CNCCCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O	1799218092	XGAQKWFGDPSSBZ-MUJYYYPQSA-N	432.477	1.772	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnn3ccncc13)C2	1799274775	AXBOWXMKBFOGOS-ABXQLRGKSA-N	426.304	1.169	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc3ccccn13)C2	1799275372	QLYKUXOZNQJFPK-UESRRSCYSA-N	425.316	1.774	50	20	IDGD	
C=C(Oc1ccccc1O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Br	1799347569	PYONXKCIRGKQCP-VZAMPYOESA-N	443.269	1.565	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc([N+](=O)[O-])[nH]1	1799478741	KRIZBFMRRHFLBW-BQELMUNXSA-N	441.448	1.309	50	20	IDGD	
CCOc1cccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Br)C3)c1O	1799755796	PJIHPWNXUKTRDH-YHYOWMERSA-N	445.285	1.685	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnn2c1CCC2	1799965748	SRSNFZPEAXWHGT-LMWOUKEDSA-N	425.327	1.206	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3cccnn3c1)C2	1800642992	IABCENRBPULDJM-YALNPMBYSA-N	435.322	1.711	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Oc1ccccn1)C2	1800643966	ALVFLSAKDBMLQF-OWVAZHOYSA-N	440.338	1.612	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(OC)cc1OC)C2	1800979194	WHMATWXHMIUNJV-ZDFLXESQSA-N	426.897	1.161	50	20	IDGD	
C[C@H](CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCC(=O)NN(C)C)c1ccccc1	1801012591	BBOQRVVBDHZCGU-YQYRJILISA-N	430.549	1.143	50	20	IDGD	
C[C@@H]1[C@@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Cl)C3)CCN1C(=O)OC(C)(C)C	1802259194	YHVAVXCJFVDUNU-OWDFPOFWSA-N	447.935	1.756	50	20	IDGD	
Cc1cnn(CC(=O)N2CC[C@H](CNC(=O)[C@H](F)Br)[C@@H]2c2cccnc2)c1	1808662888	SKRWQWQPCVKGPO-PVAVHDDUSA-N	438.301	1.983	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)c1ccc2nccnc2c1	1809384827	ONACXZXIDSZHNW-VDGAXYAQSA-N	439.903	1.944	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@H](CNC(=O)CCc2nc(N)n[nH]2)[C@H]1c1cccnc1	1810153045	VDVWYOLMOAFYAY-HNAYVOBHSA-N	445.600	1.272	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2ccc(OC)nn2)[C@@H]1c1cccnc1	1811210633	YOIHXKGPWULOPC-VKJFTORMSA-N	433.896	1.454	50	20	IDGD	
Cn1ccc(=O)cc1C(=O)NC[C@H]1CCN(C(=O)CO[Si](C)(C)C)[C@H]1c1cccnc1	1811369071	KDWOGFBHRUECET-UTKZUKDTSA-N	442.592	1.951	50	20	IDGD	
Cc1cc(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)n(C(F)F)n1	1811520982	NZEJHGRWSJETEL-CWRNSKLLSA-N	441.866	1.901	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2cccnc2C(N)=O)[C@H]1c1cccnc1	1813027798	DGRAFCMWHCRCNW-ZVZYQTTQSA-N	445.907	1.149	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2nccnc2OC)[C@H]1c1cccnc1	1813029848	ZKCTYGBZXNLOGJ-VYDXJSESSA-N	433.896	1.454	50	20	IDGD	
COCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CC2	1813734556	HKJMTHSDBOVNQL-JQWIXIFHSA-N	446.957	1.834	50	20	IDGD	
CSCC(C)(C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1815265696	RYLWNFBXNYDMSG-KRWDZBQOSA-N	444.366	1.785	50	20	IDGD	
CCC[C@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(=O)n3[nH]cnc3n2)[nH]n1	1815317845	KDIXYWQOWWXQAQ-SMDDNHRTSA-N	446.899	1.854	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)C1CCCCC1)CC2)c1ccc(B(O)O)cc1	1815339718	MZSFVDMLKIJPGS-MRXNPFEDSA-N	427.335	1.629	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)[C@@H](O)c1ccccc1	1817075641	LRTDFUAJWXTGRK-CTNGQTDRSA-N	448.288	1.129	50	20	IDGD	
C[C@H](NC(=O)c1cnccn1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](F)Cl)[nH]n1	1819514616	QRZUXDMYPAQSIO-PSOPSSQASA-N	437.863	1.545	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CN(CCO)CCO)n[nH]1	1822022403	DDZJPDCIHWRLCF-GDBMZVCRSA-N	429.949	1.096	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H]2CCCSC2)[nH]n1	1822418295	ZFAQTBMCKUMUFM-HOCLYGCPSA-N	436.582	1.918	50	20	IDGD	
Cc1nccn1[C@H](C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1	1822883137	DICSSEXUEIFWMM-PBHICJAKSA-N	444.540	1.541	50	20	IDGD	
CC(=O)N/C(C)=C/C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](C)Br)CC2	1824477311	BFXNRKIEVZQVDF-XHCRCFASSA-N	429.340	1.878	50	20	IDGD	
C=CCO[C@@H](C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1	1824507245	KCPFUVCYWYAZGD-JXFKEZNVSA-N	443.548	1.510	50	20	IDGD	
CC(=O)N[C@H](C)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](C)CBr)CC2	1825210942	DQVJSVPZKBKLLS-IQJOONFLSA-N	431.356	1.611	50	20	IDGD	
O=C(CCn1cncn1)Nc1nc2c(s1)C[C@H](NC(=O)CCBr)CC2	1826604167	NGFNEOADMBIDAG-SNVBAGLBSA-N	427.328	1.522	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CN2CCN(C)CC2)CC1	1828444718	LULMWVPBMAXPCV-MOPGFXCFSA-N	429.005	1.107	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)COc3ccc(O)cc3)CCO2)C1	1830339463	SONWZMQQERDATJ-RXVVDRJESA-N	440.924	1.635	50	20	IDGD	
C=C(CC(=O)OCC)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830363837	NMWGKKNLQGQTCK-HXUWFJFHSA-N	430.929	1.217	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccn(C(F)F)n3)C2)C1	1831651158	NQTOTLCOIRMCME-ACJLOTCBSA-N	434.871	1.756	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(OC)nc3)CCO2)C1	1831945820	QYNRELQHRLQFNU-OXQOHEQNSA-N	425.913	1.568	50	20	IDGD	
Cc1cc(C)n(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@](C)(Cl)CCl)C3)C2)n1	1833040293	CCLWAYGQMBQETP-MOPGFXCFSA-N	447.363	1.193	50	20	IDGD	
Cc1noc(C)c1CCC(=O)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1833068240	FWWGKYVYSZAXAK-GOSISDBHSA-N	434.320	1.484	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)CS[C@@H]3CCCCO3)CC2)CC1)[C@H](O)CCl	1833311793	DZSSNOSQERTVDX-IEBWSBKVSA-N	448.029	1.418	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cnccc3Cl)CC2)CC1)[C@H](O)CCl	1833312384	MFYLRNYLEDLMEE-QGZVFWFLSA-N	429.348	1.520	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H]3C[C@@H]3c3ccccc3)CC2)CC1)[C@H](O)CCl	1833312877	JXVSBXVCRZGDAC-NJDAHSKKSA-N	433.980	1.961	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)N1CCC(N2CCC(NC(=O)[C@H](Cl)CCC)CC2)CC1	1833533880	UCTDBHGUJRXUEX-CRAIPNDOSA-N	426.989	1.656	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)COc3cccnc3)CC2)CC1	1833760464	RZJDNFLRGDOXIM-IBGZPJMESA-N	438.956	1.286	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1)c1ccc(=O)oc1	1834339938	FZTHXJVBKWXXSE-INIZCTEOSA-N	444.301	1.516	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)CSC(=N)N)CC2)CC1	1834656130	AQXXDOMWHGGNMR-AWEZNQCLSA-N	448.431	1.358	50	20	IDGD	
CC(=O)Nc1cc(C(=O)N2CCC(N3CCC(NC(=O)[C@@H](F)Cl)CC3)CC2)ccn1	1835079561	FYFQTFLLJBMNIW-GOSISDBHSA-N	439.919	1.760	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cn3cc(Cl)cn3)CCO2)C1	1835969419	IAFXIBPAZYCHSB-MAUKXSAKSA-N	433.336	1.400	50	20	IDGD	
COCCOCC(=O)N1CCC(OC2CCN(C(=O)[C@@H](C)CBr)CC2)CC1	1836671242	RVBZQRLZSWBHBC-HNNXBMFYSA-N	449.386	1.679	50	20	IDGD	
CO[C@@H](C(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1)c1ccccc1	1836716877	VZUZNQYHZPABDZ-WOJBJXKFSA-N	438.952	1.972	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@H]3CCNC(=O)C3)CC2)CC1	1836922751	POHMMRRCGSIULL-MAUKXSAKSA-N	427.973	1.919	50	20	IDGD	
COc1ccc(C(=O)N2CCOC[C@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)cc1	1837714505	JJWMJQJFAXDWMK-NRFANRHFSA-N	436.581	1.617	50	20	IDGD	
O=C(COc1ccc(O)nn1)N1CCC(OC2CCN(C(=O)[C@H](F)Cl)CC2)CC1	1838085201	YKWBIHGFKBUEKE-KRWDZBQOSA-N	430.864	1.094	50	20	IDGD	
O=C(c1cnc(O)[nH]1)N1CCC(OC2CCN(C(=O)[C@H](F)Br)CC2)CC1	1838477339	QAFCLGUGQLOWLN-ZDUSSCGKSA-N	433.278	1.418	50	20	IDGD	
O=C(c1ccc(F)cc1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839201535	AKDRLSVBBOEAJE-RHSMWYFYSA-N	433.249	1.586	50	20	IDGD	
CC(C)n1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)n1	1839201985	PMVOZRIOCWWRJV-YOEHRIQHSA-N	447.305	1.225	50	20	IDGD	
O=C(c1onc2ccccc12)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1839547875	TWQQPYSZBVQRMH-SFHVURJKSA-N	428.272	1.702	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4ccoc4s3)C2)C1	1840151660	JRWZEANBDOUHMV-LIRRHRJNSA-N	442.921	1.818	50	20	IDGD	
C[C@@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)CCBr)C2)C1)c1ccccn1	1840500538	JCDAUNYJLCZKDK-DNVCBOLYSA-N	440.338	1.427	50	20	IDGD	
C[C@@H]1[C@H](C(=O)N2CC3(CCCN3C(=O)[C@@H](O)CCl)C2)CCN1C(=O)OC(C)(C)C	1841354499	FBJHAIQTBUGLIJ-KFWWJZLASA-N	429.945	1.435	50	20	IDGD	
COc1cc(Cl)cc(C(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)c1	1844265605	UZKHNMNZJGWZKW-UHFFFAOYSA-N	443.891	1.478	50	20	IDGD	
O=C([C@H](F)Br)N1CC2(CCCN2C(=O)c2ccc([N+](=O)[O-])c3c2OCO3)C1	1844758479	QLFMAKGOPUPGPG-ZDUSSCGKSA-N	444.213	1.831	50	20	IDGD	
CC(=O)N[C@@H](C(=O)N1CC2(CCCN2C(=O)[C@@H](F)Br)C1)c1ccc(F)cc1	1845218917	KHGIKLJODGKFNJ-HUUCEWRRSA-N	444.276	1.897	50	20	IDGD	
COc1cc(Cl)ccc1CC(=O)N1CCCC12CN(C(=O)c1ccc(B(O)O)cc1)C2	1845890632	MHCQBDNMXLZQEE-UHFFFAOYSA-N	442.708	1.088	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](CC(=O)N2CCCC23CN(C(=O)[C@H](O)CCl)C3)C1	1846471801	MYVVURHDDYTPOA-HUUCEWRRSA-N	429.945	1.437	50	20	IDGD	
CC(C)/C=C/C(=O)N1CCCC12CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2	1846755533	OCWNGPRVAXMKGQ-ZHACJKMWSA-N	427.549	1.748	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CCCC[C@H]1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl	1847567829	FFJBFYFDOMVPHP-UHDSXZAQSA-N	443.972	1.871	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)C[C@@H]1OCCc2ccccc21	1847755759	AVBREXGCFNKSEH-UFYCRDLUSA-N	428.533	1.265	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)ccc1OC(C)C	15902050	OQSJULDQQOKYNF-UHFFFAOYSA-N	449.529	1.873	50	20	IDGD	
CSc1cccc(N2C[C@H](C(=O)NNC(=O)[C@H]3COc4ccccc4O3)CC2=O)c1	26974274	HOCSSXHDLOVVGL-FZKQIMNGSA-N	427.482	1.749	50	20	IDGD	
CC(=O)c1cccc(S(=O)(=O)NCCC(=O)NNC(=O)CCCc2ccccc2)c1	727860318	FIHOEOBEVDZJSX-UHFFFAOYSA-N	431.514	1.728	50	20	IDGD	
CCCOc1cn(-c2ccccc2)nc1C(=O)NNC(=O)CNC(=O)c1cccs1	728473511	NFDUKTIASNVVRP-UHFFFAOYSA-N	427.486	1.914	50	20	IDGD	
COC(=O)Nc1cccc(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)c1	728512627	VAGIISMNSWFILC-UHFFFAOYSA-N	426.838	1.241	50	20	IDGD	
O=C(CCCC[C@@H]1SC[C@H]2NC(=O)N[C@H]21)NNC(=O)c1cccc(OC(F)F)c1	728543922	NYIRNHWCTGYUFX-VNHYZAJKSA-N	428.461	1.775	50	20	IDGD	
COc1ccc(CN(C)C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1OC	728957886	LAYDRUWPBFWWGZ-UHFFFAOYSA-N	428.493	1.583	50	20	IDGD	
CCOc1ccccc1OS(=O)(=O)c1cccc(C(=O)NNC(=O)c2cnn[nH]2)c1	729455598	NGYTXXLGGLFAGA-UHFFFAOYSA-N	431.430	1.046	50	20	IDGD	
N#Cc1nc(C2CC2)oc1N1CCN(C(=O)NNC(=O)Cn2ccc3ccccc32)CC1	729506408	ACKRANSZCMVSFN-UHFFFAOYSA-N	433.472	1.941	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NC[C@H]2CCCN(C(C)C)C2)nc1	729618756	HXBWWLSSSDZQRV-MRXNPFEDSA-N	426.587	1.859	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)c(OC)c1	729951680	SBINCOFDNWUARN-UHFFFAOYSA-N	444.400	1.761	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)[C@H](C)N1CCN(c2ccc(F)cc2)CC1	731863858	HQNZLABPIILWFU-KRWDZBQOSA-N	444.507	1.961	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2cc(C(=O)O)n(C)c2)cc1Br	732048522	MNZRMYPPWBZDIW-UHFFFAOYSA-N	432.252	1.118	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)N2CCC(CS(N)(=O)=O)CC2)c(C)n1C[C@H]1CCCO1	732071486	HFWRYWIUZVEFIK-PYIVIEQSSA-N	434.562	1.718	50	20	IDGD	
CC(C)C[C@@H](C(=O)NNc1ccccc1S(C)(=O)=O)N1C(=O)[C@H]2CC=CC[C@H]2C1=O	732305271	GHKCKKCVYVMXQM-UXLLHSPISA-N	433.530	1.899	50	20	IDGD	
C[C@@H]1Cc2cc(C(=O)NNC(=O)c3cnn(-c4ccccc4)c3)ccc2N1S(C)(=O)=O	733110013	NEWLROVGFNGBCD-CQSZACIVSA-N	439.497	1.658	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)NCCC(=O)Nc1ccccc1	733653548	JVXXLURFXANWTM-UHFFFAOYSA-N	438.532	1.558	50	20	IDGD	
CN1CCCN(CCCNC(=O)CCC(=O)C(C#N)=C2N(C)c3ccccc3N2C)CC1	733882339	HYETYUVXVJMCPA-UHFFFAOYSA-N	438.576	1.801	50	20	IDGD	
CC[C@@H](OC1CCCC1)C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	735117711	GUWDHFYSNVZYOW-MRXNPFEDSA-N	425.555	1.199	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)Cc1ccc(S(=O)(=O)N2CCCCC2)cc1	737637199	RRXISECWDYIWTK-UHFFFAOYSA-N	445.541	1.768	50	20	IDGD	
COCC(=O)N[C@H](C(=O)NNC(=O)c1cc2c(C)nn(-c3ccccc3)c2s1)C(C)C	741171313	XXLCLDJWOKSYJI-SFHVURJKSA-N	443.529	1.944	50	20	IDGD	
O=C(CN1CCN(C(=O)c2cc3occc3s2)CC1)NNC(=O)c1ccc(F)cc1	741255900	NOIRKQUYDIKINJ-UHFFFAOYSA-N	430.461	1.852	50	20	IDGD	
C[C@H](CC(=O)NNc1nc(-c2cccnc2)no1)/N=C1/NS(=O)(=O)c2ccccc21	742657425	BXQVNPIUVXEJMJ-LLVKDONJSA-N	427.446	1.092	50	20	IDGD	
CN(CCCOc1cccc(S(C)(=O)=O)c1)CC(=O)NNC(=O)c1ccc(C#N)cc1	744394941	MSZFAKULXTTWGR-UHFFFAOYSA-N	444.513	1.124	50	20	IDGD	
Cc1cc(C)n(-c2ccc(CC(=O)OCC(=O)NNC(=O)c3cccc(C#N)c3)cc2)n1	744757652	CSHJTWVGIDRRIE-UHFFFAOYSA-N	431.452	1.908	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)CCSc2ccc3c(c2)OCCO3)c1	745068562	HNSUZJGMMLZNNS-UHFFFAOYSA-N	441.465	1.816	50	20	IDGD	
CC(C)=CC(=O)NCc1ccc(C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)cc1	745634025	YLEAEQSEDAZZDF-UHFFFAOYSA-N	434.452	1.759	50	20	IDGD	
CN(C)C(=O)[C@H]1CCC[C@H](NC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)C1	745824639	KNZXMFVJIHXWOK-JSGCOSHPSA-N	425.511	1.073	50	20	IDGD	
CCN1CCN(C[C@H](C)CNC(=O)NNC(=O)c2cc(-c3ccc(C)cc3)[nH]n2)CC1	745861606	NERMYAWPTSCEFT-QGZVFWFLSA-N	427.553	1.603	50	20	IDGD	
CO[C@]1(C)C[C@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)C1(C)C	745934874	CWKIUNFOUOAYSB-OXJNMPFZSA-N	438.550	1.619	50	20	IDGD	
O=C(NNC(=O)N1CCOCC1)c1cccc(NC(=O)c2ccc(Br)o2)c1	745986148	KZBWULNHLMOZHL-UHFFFAOYSA-N	437.250	1.981	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)[C@H]1CN(Cc2nc(O)c3ccccc3n2)CCO1)c1ccccc1	746247813	PJSWIURTTGEREP-YLJYHZDGSA-N	449.511	1.877	50	20	IDGD	
COc1cc(C)nc(NNC(=O)[C@@H]2CCCCN2S(=O)(=O)c2ccc(C(C)=O)cc2)n1	746633450	UUOWKTUHAFEBGU-KRWDZBQOSA-N	447.517	1.683	50	20	IDGD	
C[C@H](CS(C)(=O)=O)C(=O)NNC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1	746823163	VXSUGFBGEJLCJX-CQSZACIVSA-N	427.486	1.376	50	20	IDGD	
COC(=O)/C=C1/SCC(=O)N1CCCOC(=O)/C(C#N)=C\c1cc(C#N)n(C)c1C	748862095	AAGRCGFGWQVTPM-SLNHCAPKSA-N	428.470	1.635	50	20	IDGD	
O=C(NNC(=O)N1CCN([C@H]2C[C@H]3CC[C@H]2C3)CC1)C1CCN(c2ncccn2)CC1	749111571	MGRUZDXNBANKQA-WDSOQIARSA-N	427.553	1.240	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)N[C@@H]1CCN(c2cccc(Cl)c2)C1=O	750277401	VRXVLWGAQXGXIT-CYBMUJFWSA-N	435.893	1.267	50	20	IDGD	
COc1cccc2c1OCC(C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1)=C2	751294242	OLXGZSANDQXXNY-UHFFFAOYSA-N	437.861	1.233	50	20	IDGD	
COc1cc(OC)cc(N2C[C@@H](C(=O)NNC(=S)NCCc3cccs3)CC2=O)c1	752519652	BBFSHTQREQTGEY-ZDUSSCGKSA-N	448.570	1.856	50	20	IDGD	
O=C(NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)NNC(=O)c1cc2ccccc2o1	754230562	ZIVKDMWILDPQIG-UHFFFAOYSA-N	432.414	1.759	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cn(C)nc2C(F)F)c1	754828042	ZAANHCTWOVDUQU-UHFFFAOYSA-N	429.449	1.463	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)NC2CCN(S(=O)(=O)C(F)(F)F)CC2)c1	755086197	NUESOIUZZRNJGN-UHFFFAOYSA-N	438.428	1.018	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)cc1NC(=O)OC(C)(C)C	755694301	PTRMQBUJJINNCU-LLVKDONJSA-N	442.494	1.630	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)NC2CCN(S(=O)(=O)C(C)(C)C)CC2)cc1	755897927	JWRRJMCQGZQVPF-UHFFFAOYSA-N	440.566	1.551	50	20	IDGD	
CN1CCC/C1=N\S(=O)(=O)c1cccc(NC(=O)NNC(=O)Cc2ccncc2)c1	756028237	CEBKAHNXHYOHIU-JJIBRWJFSA-N	430.490	1.290	50	20	IDGD	
NC(=O)c1ccc(F)c(NC(=O)NNC(=O)COc2ccc(Br)cc2)c1	756066409	LECLIHYZMPXZIE-UHFFFAOYSA-N	425.214	1.919	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)ccc1N1C(=O)CCC1=O	756553078	FBIZAHDJDDCJAQ-UHFFFAOYSA-N	444.469	1.518	50	20	IDGD	
CNS(=O)(=O)c1ccc(NC(=O)NNC(=O)COc2cccc(C(F)(F)F)c2)cc1	756639682	CCYQBIXKRJQHGW-UHFFFAOYSA-N	446.407	1.845	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccn(CCC#N)n2)c1	756653012	DJPQXMWNSNYUCO-UHFFFAOYSA-N	433.494	1.294	50	20	IDGD	
O=C(NNC(=O)c1cc2c(s1)CCC2)Nc1ccccc1OCC(=O)N1CCOCC1	756874594	SRIIBCYKVILVJM-UHFFFAOYSA-N	444.513	1.941	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)Nc1cccc(F)c1I	757779214	APCWPBSGJUDFGL-ZETCQYMHSA-N	441.222	1.018	50	20	IDGD	
COc1cc(CNC(=O)NNC(=O)C(=O)Nc2ccccn2)ccc1OCC(F)(F)F	758683778	GTPBCNRICFWGNO-UHFFFAOYSA-N	441.366	1.500	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)[C@H]1CCCN(C(=O)c2ccncc2)C1	761632279	AUWALUXCVWVNBL-INIZCTEOSA-N	428.514	1.882	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)N[C@@H]1CCCN(c2ccccc2F)C1=O	761816405	MWRPATRVMZNXFL-CQSZACIVSA-N	431.380	1.579	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)[C@H](C)N1C(=O)c2ccc(C)cc2C1=O	762404915	NCFGZUVTJRCMJT-ZDUSSCGKSA-N	427.482	1.928	50	20	IDGD	
CCOc1cc(C=NNC(=O)CNC(=O)c2cccnc2)ccc1O[C@@H](C)C(=O)N(C)C	763192558	HOHZQYLCGHJODC-HNNXBMFYSA-N	441.488	1.216	50	20	IDGD	
O=C(NNC(=O)c1cccc(C2OCCO2)c1)c1ccc(S(=O)(=O)N2CCCC2)cc1	763272384	IIRWBZSJHGUVGL-UHFFFAOYSA-N	445.497	1.591	50	20	IDGD	
O=C(NNC(=O)c1ccncc1)C(=O)Nc1cc(-c2nnc3n2CCCCC3)ccc1F	763462005	HECMZHZUXKDDBK-UHFFFAOYSA-N	437.435	1.605	50	20	IDGD	
Cc1cc(C)n(-c2ccc(NC(=O)C(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)cc2F)n1	763470788	OZOYSYVMKAKUPL-UHFFFAOYSA-N	440.391	1.936	50	20	IDGD	
CNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)CCCOc2ccc(Cl)cc2C)c1	763501682	RDUVOMXPFZTYDJ-UHFFFAOYSA-N	446.891	1.953	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(OC[C@H]3CCCO3)cc2)cc1OC	763544264	UDLUJYQIUHMQHE-QGZVFWFLSA-N	443.456	1.661	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)[nH]n1)C(=O)Nc1ccccc1O[C@@H]1CCOC1	763603587	DNZRELVUFFGDQY-OAHLLOKOSA-N	435.440	1.644	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2ccccc2O[C@H]2CCOC2)c1	763666027	UWQSMNFUCPKLFH-INIZCTEOSA-N	427.457	1.636	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)C(=O)Nc1cc(Br)ccc1F	763679769	CSAFIXPGBNDYGR-UHFFFAOYSA-N	428.189	1.892	50	20	IDGD	
Cc1cc2cc(NC(=O)C(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)ccc2[nH]1	763718779	MKIBKNXQKLDNLS-UHFFFAOYSA-N	443.485	1.126	50	20	IDGD	
Cc1ccc(O[C@@H](C)C(=O)NNC(=O)CNC(=O)c2cccnc2)c(Br)c1	763818994	UHBJJXVHEGQBJI-LBPRGKRZSA-N	435.278	1.497	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(CN3CCOC3=O)cc2)cc1	763821528	SCHJRWHKRNGPFM-UHFFFAOYSA-N	426.429	1.112	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1cncc(Br)c1	763865930	SXVKFOLFGVWBGX-VIFPVBQESA-N	425.214	1.537	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(C)c(NC(C)=O)c2)cc1	763867473	VGAYRPKKNAYABL-CQSZACIVSA-N	442.472	1.906	50	20	IDGD	
COC(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(C(C)=O)cc2)cc1	763873735	YIZODHWMBXJMFJ-AWEZNQCLSA-N	441.440	1.158	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)C(=O)Nc1cc(N2CCNC2=O)ccc1Cl	763919451	UAZALDVZDIKYHU-UHFFFAOYSA-N	433.827	1.337	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1ccc(N2CCOCC2)c(C)c1	764013266	YTBDAHMVOHMFEN-UHFFFAOYSA-N	446.891	1.893	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2cccc(CC(F)(F)F)c2)c1	764077030	GQUYISGCHLXXCD-UHFFFAOYSA-N	443.403	1.595	50	20	IDGD	
C[C@@H](c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)nc2)cc1)N1CCOCC1	764102413	ZAILTPWEEMRFBO-ZDUSSCGKSA-N	431.880	1.528	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2ccc(Oc3cccnc3)nc2)cc1	764128028	YFOIPVGNOCIXOR-UHFFFAOYSA-N	435.440	1.996	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2ccc(C(=O)N(C)C)cc2OC)cc1	764131276	JXOIMVNARMCFEO-UHFFFAOYSA-N	442.472	1.124	50	20	IDGD	
CCN1CCC(n2nccc2NC(=O)C(=O)NNC(=O)CCCc2ccccc2)CC1	764224997	VXXIOTUTXOKEKB-UHFFFAOYSA-N	426.521	1.649	50	20	IDGD	
NC(=O)COc1cccc(NC(=O)C(=O)NNC(=O)c2c(Cl)cccc2Cl)c1	764225915	CUBQPWGQPGTROC-UHFFFAOYSA-N	425.228	1.257	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)C(=O)Nc1cc(F)c(N2CCCC2)c(F)c1	764288459	GWKCTXLDMBMFEX-UHFFFAOYSA-N	432.427	1.989	50	20	IDGD	
CCN1CCC[C@@H]1CN1C[C@H](C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)CC1=O	764332937	BISXGAOWVDXOMU-GDBMZVCRSA-N	449.502	1.633	50	20	IDGD	
Cn1nc(C2CCCC2)cc1NC(=O)C(=O)NNC(=O)c1cc(-c2cccs2)[nH]n1	764377997	URCLFPNYJZSWKX-UHFFFAOYSA-N	427.490	1.929	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2cccs2)[nH]n1)C(=O)Nc1ccc(Cn2cncn2)cc1	764382585	LWWHLYWHKURRAH-UHFFFAOYSA-N	436.457	1.178	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc(-n4cnnn4)cc3)n[nH]2)cc1C	764386407	HXKPVTSBXXLBDV-UHFFFAOYSA-N	445.443	1.069	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1)C(=O)Nc1cccc2c1OCCO2	764389139	XSMZOWYXZQXGEQ-UHFFFAOYSA-N	425.376	1.387	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)C2CCCC2)cc(Br)c1F	764662424	JSVMXQSQKFJRCF-UHFFFAOYSA-N	430.230	1.651	50	20	IDGD	
CC(C)(C)OC(=O)N1CCO[C@H](C(=O)NNC(=O)c2ccc(F)cc2Br)C1	764940669	TYEXRCOTOIVQFX-ZDUSSCGKSA-N	446.273	1.985	50	20	IDGD	
Cc1nnnn1/C(=C/c1ccccc1)C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C	765313307	KJIIKHNCBWHVQC-DTQAZKPQSA-N	429.481	1.432	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)NCCCN1CCN(Cc2ccccc2)CC1	765682396	LLTWMCJBUFJRIZ-UHFFFAOYSA-N	445.589	1.924	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1cc(Cl)cc(Br)c1OC	766261705	HLCPWTZZQBMDJC-UHFFFAOYSA-N	430.646	1.992	50	20	IDGD	
CCOc1ccc(NC(=O)CN2CCN([C@@H](C)C(=O)NNC(=O)CC(C)C)CC2)cc1	767058936	QMMLUERBYMARIN-KRWDZBQOSA-N	433.553	1.223	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)c1ccc2c(c1)NC(=O)[C@@H](C)S2	767230994	FFDJHHGAFQRSEL-CYBMUJFWSA-N	427.482	1.975	50	20	IDGD	
C[C@H](NS(=O)(=O)c1cccc(C#N)c1)C(=O)NNC(=O)c1cc(-c2ccccc2)[nH]n1	767822544	CZSZLCDGOZUUSM-ZDUSSCGKSA-N	438.469	1.076	50	20	IDGD	
CCOc1ccnc(N2CCCN(CC(=O)NNC(=O)c3cccc(Cl)c3)CC2)n1	767913115	VADCKRYIARGVMX-UHFFFAOYSA-N	432.912	1.502	50	20	IDGD	
COc1ccc2c(c1)OC[C@@H](NC(=O)NNC(=O)c1cc(OC)c(OC)c(OC)c1)C2	768105478	MEDAYGSYQKJMIS-AWEZNQCLSA-N	431.445	1.669	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)nc1Cl	768278690	VVJFDMPINIBMRT-UHFFFAOYSA-N	431.924	1.631	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNS(=O)(=O)c2ccc(C(=O)O)cc2Cl)cc1C	768498128	VBEDVMFKAGKASX-UHFFFAOYSA-N	425.850	1.603	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)c2cc(Br)c(C)n(C)c2=O)cc1	768937320	TXMKEWYDCJASMU-UHFFFAOYSA-N	436.262	1.383	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)C(=O)Nc1cnn(-c2ccccc2)c1C(F)(F)F	769265103	JNFWYMXIARGFPV-UHFFFAOYSA-N	432.362	1.615	50	20	IDGD	
C[C@H](C(=O)NNc1ccnc(N(C)C)n1)N1C(=O)c2ccc(Br)cc2C1=O	769649807	GEAITGQGGNOZFC-SECBINFHSA-N	433.266	1.433	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)N[C@H]1CCCN(c2ccn(C)n2)C1=O	770567241	ITKFJUGBJVEIGE-DOMZBBRYSA-N	434.884	1.367	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)[C@H]3CC(=O)N(c4ccccc4F)C3)nc21	770968545	KPJFSZWJSLOXRS-NSHDSACASA-N	427.440	1.922	50	20	IDGD	
Cc1cccc(-c2nnc(S)n2CCC(=O)NNc2nc(O)c3cnn(C)c3n2)c1	770981748	BPNGQGOABJEKFY-UHFFFAOYSA-N	425.478	1.458	50	20	IDGD	
O=C(Cn1cc(C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)cn1)NC1CCCC1	772450205	NFWDAKWGEFOYCV-UHFFFAOYSA-N	446.533	1.140	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NNC(=O)c2ccccc2S(C)(=O)=O)C1	773418549	KCSNPNVGPLEOMA-CYBMUJFWSA-N	425.507	1.498	50	20	IDGD	
CCCCOc1ccc(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)cn1	773494270	QFOBOSUQPVBJNV-UHFFFAOYSA-N	425.489	1.799	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2ccc(Br)c(C)n2)c1	773522864	AWCUTFHIXQLZIZ-UHFFFAOYSA-N	435.278	1.934	50	20	IDGD	
NC(=O)c1ccc(C(=O)NNC(=O)COc2ccc(Br)cc2)nc1Cl	774314780	DFMAMYIHAAFEKP-UHFFFAOYSA-N	427.642	1.436	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)[C@@H]2CC(C)C[C@H]2C(=O)NNC(=O)c2cc(C)oc2C)c(C)o1	775764876	GYNMTCIBNQPBMN-QZTJIDSGSA-N	444.488	1.991	50	20	IDGD	
CCOC(=O)N1CCC[C@H]([C@@H](C)NC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])C1	777262388	OBJHSNYEWTUDFY-KGLIPLIRSA-N	437.453	1.561	50	20	IDGD	
COc1ccc(N2CCN(C(=O)/C=C/C(=O)NNC(=O)c3ccccc3OC)CC2)cc1	778269134	QPFFKQYXURFGHF-VAWYXSNFSA-N	438.484	1.370	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N2CC[C@H](O)[C@@H](C)C2)cc1	779270019	RWJDKDNFIHTCEC-BMDJHNSPSA-N	437.500	1.570	50	20	IDGD	
Cc1cc(Br)cc(S(=O)(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)c1	780393718	KECHXMJIKSFISK-UHFFFAOYSA-N	430.236	1.995	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1)NNc1ncncc1Cl	781806318	XRPLNSYYRWFOIP-UHFFFAOYSA-N	425.776	1.450	50	20	IDGD	
Cc1oc(-c2cccc(C(F)(F)F)c2)nc1C(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1	782208256	GGNVZBOVNUFXKL-NSHDSACASA-N	431.392	1.865	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NN=c3sc4ccccc4n3C)cn2)C[C@H](C)O1	783349375	HWXKRFODIJMHTI-KBPBESRZSA-N	440.529	1.819	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2cc(C(F)(F)F)cc(C(F)(F)F)c2)CCS(=O)(=O)C1	783426834	OQRSATTYWSTFPE-ZDUSSCGKSA-N	447.357	1.861	50	20	IDGD	
CCOC(=O)C(C)(C)n1cc(NC(=O)C(=O)NNc2ccc(Br)nc2)cn1	784806657	NDJPGSOSRWWDMW-UHFFFAOYSA-N	439.270	1.421	50	20	IDGD	
O=C(NNc1ccc(Br)nc1)C(=O)Nc1ccn(CCc2ccncc2)n1	784808753	DJBCATWGLGSULO-UHFFFAOYSA-N	430.266	1.760	50	20	IDGD	
COC(=O)c1cc(F)c(F)cc1NC(=O)C(=O)NNc1ccnc(Br)c1	784837428	RQGHYYVAGVBLMY-UHFFFAOYSA-N	429.177	1.991	50	20	IDGD	
NS(=O)(=O)c1cccc(NC(=O)C(=O)NNc2ccc(Br)cc2Cl)c1	784840950	QQGQFILJQHGHFQ-UHFFFAOYSA-N	447.698	1.832	50	20	IDGD	
CN1CCN(C(=O)Cc2ccc(NC(=O)C(=O)NNc3cc(F)c(F)cc3F)cc2)CC1	784891769	BYGMBSUGBZECJC-UHFFFAOYSA-N	449.433	1.502	50	20	IDGD	
CN(C)c1nccc(NNC(=O)C(=O)Nc2cccc(OCC(=O)Nc3ccccc3)c2)n1	784970641	KNLFXLJPQFBNRU-UHFFFAOYSA-N	449.471	1.642	50	20	IDGD	
Cc1cc2c(cc1C)[C@H](C(=O)OCC(=O)NNC(=O)[C@H]1COc3ccccc3O1)CO2	786955496	FCYREFRJBGKKDX-DNVCBOLYSA-N	426.425	1.310	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)NCC(=O)NNc2nnc(-c3ccccn3)s2)cc1	788592830	WDULAXRHTGTVNU-UHFFFAOYSA-N	432.487	1.224	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)N[C@@H](C)C(=O)N(C)CC)c2ccccc2c1=O	788892459	LKPCIRVZZUYRLQ-AWEZNQCLSA-N	430.509	1.398	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@@H]2CC23CN(C(=O)OC(C)(C)C)C3)c2ccccc2c1=O	789133429	JBFDUGJUVGFWAJ-HNNXBMFYSA-N	441.488	1.434	50	20	IDGD	
CN(Cc1ccccc1NC(=O)C(=O)NN[C@@]1(C)CCS(=O)(=O)C1)c1ccccc1	789751208	STYLFDDDMYWUSH-NRFANRHFSA-N	430.530	1.460	50	20	IDGD	
CC(C)[C@H](NC(=O)C(F)(F)F)C(=O)NNc1ccccc1S(=O)(=O)NC(C)(C)C	790001422	ZJGDBWLYIMMVKL-ZDUSSCGKSA-N	438.472	1.910	50	20	IDGD	
Cc1c(C(=O)NNC(=O)CCNC(=O)OC(C)(C)C)nnn1Cc1ccc(F)cc1F	792432476	XMMKYIPNFOORGD-UHFFFAOYSA-N	438.435	1.589	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(Br)cc([N+](=O)[O-])c2)cc1	793024266	CTMVWFNAHWFXOZ-UHFFFAOYSA-N	432.190	1.629	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)c3csc(CCNC(=O)OC(C)(C)C)n3)nc21	793500524	JJWNZODLKVXDHZ-UHFFFAOYSA-N	434.482	1.350	50	20	IDGD	
C[C@](O)(CN1C(=O)NC2(CCCC2)C1=O)C(=O)NNc1ccc(F)cc1Br	793709101	MZBKXVSOOYTFPZ-INIZCTEOSA-N	443.273	1.647	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H](C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)C[C@H]2C[C@H]21	796038586	UCAGNWNIYJUSPZ-YUELXQCFSA-N	448.432	1.297	50	20	IDGD	
CCn1ncc(NC(=O)C(=O)NNC(=O)COc2cc(C)ccc2C)c1C(F)(F)F	799257864	SXZKRWLARWMXOW-UHFFFAOYSA-N	427.383	1.704	50	20	IDGD	
CCCCNS(=O)(=O)c1ccc(C)c(NC(=O)C(=O)NNc2ccc(Cl)nn2)c1	799834703	QOLXKCPUZRLHMF-UHFFFAOYSA-N	440.913	1.599	50	20	IDGD	
N#Cc1cc(S(=O)(=O)NNC(=O)c2ccc3c(c2)OCCO3)ccc1C(F)(F)F	799916947	NKCVWPFTRHGBBN-UHFFFAOYSA-N	427.360	1.972	50	20	IDGD	
CC(=O)N1CCN(S(=O)(=O)c2cc(C(=O)NNc3cccc(C#N)c3)ccc2F)CC1	801176286	FHEXTQGSJPRDON-UHFFFAOYSA-N	445.476	1.307	50	20	IDGD	
Cc1ccc(F)c(-n2cc(O)c(C(=O)OCC(=O)NNC(=O)Cc3nc(C)cs3)n2)c1	801415796	CWTRXUOQTROGHT-UHFFFAOYSA-N	447.448	1.337	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)Nc1ccc(F)c(N2CCCNC2=O)c1	806804959	OVOYKLWMQYPXLK-KRWDZBQOSA-N	429.408	1.738	50	20	IDGD	
Cc1ccc2c(c1)C(=O)N(CC(=O)NNC(=O)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1)C2=O	808010668	HKHSZKXIBONMAL-CQSZACIVSA-N	444.488	1.386	50	20	IDGD	
COC(=O)C[C@@H](C)CC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	809545506	MAZYUZVJAMMNAO-AWEZNQCLSA-N	425.507	1.212	50	20	IDGD	
Cc1cccc2c1OC[C@H](NC(=O)NNC(=O)c1sc(N3CCOCC3)nc1C)C2	812641797	PLGAJAISOJLRPR-OAHLLOKOSA-N	431.518	1.544	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNc2ccc(-n3cccn3)nn2)cc1)[C@H]1C[C@@H]1C	815589720	BLBFYEVHIQZFNQ-GUYCJALGSA-N	434.460	1.505	50	20	IDGD	
Cc1cc(-n2cccn2)ccc1NC(=O)C(=O)NNc1ccccc1S(=O)(=O)N(C)C	815752410	QUEPDAVUGLKBKM-UHFFFAOYSA-N	442.501	1.513	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccccc1	863998886	WTMXEQARJWJUGP-KRWDZBQOSA-N	447.513	1.465	50	20	IDGD	
O=C(c1cccc(NS(=O)(=O)c2ccc3c(c2)OCCCO3)c1)N1CC[C@@H](B(O)O)C1	864234175	ODFPHCAASFEAAQ-OAHLLOKOSA-N	446.290	1.338	50	20	IDGD	
Cc1c(/C=C(\C#N)C(=O)OCC(=O)Nc2sc3c(c2C(N)=O)CCC3)cc(C#N)n1C	913287126	UJUVMPFBWJWPMF-AWNIVKPZSA-N	437.481	1.943	50	20	IDGD	
Cc1ccc(OCCC(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1C	913395243	ALQJIRJCEDWYRK-IBGZPJMESA-N	428.441	1.603	50	20	IDGD	
C[C@@]12CCC(=O)N1c1ccccc1C(=O)N2CC(=O)NNC(=O)COc1ccccc1F	914829689	LUVIRDSQCQMKBA-QFIPXVFZSA-N	440.431	1.351	50	20	IDGD	
Cn1cc(S(=O)(=O)N2CCCCC2)cc1C(=O)NNC(=O)COc1ccc(F)cc1	914846725	SMVCQPSUVKTKTG-UHFFFAOYSA-N	438.481	1.179	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)Cn2cc(Br)ccc2=O)cc1	914864135	VRWODSPVTGHCLI-GFCCVEGCSA-N	438.278	1.624	50	20	IDGD	
CN(CC(=O)NNC(=O)NC1CCCCC1)S(=O)(=O)c1ccc(Br)cc1	915595755	ZZQKQSKKMXSLIX-UHFFFAOYSA-N	447.355	1.733	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)COc1ccccc1[N+](=O)[O-])c1ccc(-n2cncn2)cc1	915922384	MWSGHDVOWSKVEG-CYBMUJFWSA-N	425.405	1.646	50	20	IDGD	
CN(C)N(C(=O)c1cccc(NC(=O)[C@@H]2Cc3ccccc3O2)c1)[C@H]1CCS(=O)(=O)C1	916373910	RZGGOGQOPAZPRG-ICSRJNTNSA-N	443.525	1.735	50	20	IDGD	
CCOCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2OC)c1	916374611	QEFDSWKENBQQSK-UHFFFAOYSA-N	436.490	1.477	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2ccc(N(C)C)nc2)c1	916444577	YBVYMJSXDHEPAQ-UHFFFAOYSA-N	448.549	1.322	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)N[C@@H]1CCN2CCC[C@@H]2C1	916572898	FTCUZWUQYXSHNO-IAGOWNOFSA-N	435.550	1.042	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)NCCc2cnn(C)c2)c2ccccc2c1=O	916595201	RSVUNPSIKAJVRR-UHFFFAOYSA-N	425.493	1.507	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc(S(=O)(=O)N(C)C)ccc2Cl)cc1	916830765	VJOZGEOEWSKSSB-UHFFFAOYSA-N	438.893	1.298	50	20	IDGD	
CCCn1nc(C(=O)NNS(=O)(=O)c2csc(C(=O)O)c2)c2ccccc2c1=O	917721624	ATPMSXMJACUYIA-UHFFFAOYSA-N	436.471	1.190	50	20	IDGD	
COC(=O)[C@H](C)Sc1ccccc1C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	917925847	NEYVHSNCQVKSBC-LBPRGKRZSA-N	426.458	1.391	50	20	IDGD	
CN(C)N(C(=O)[C@H]1CCCN(C(=O)CCOc2ccccc2)C1)[C@@H]1CCS(=O)(=O)C1	918557331	WUAKSQDVFCKKDD-ZWKOTPCHSA-N	437.562	1.186	50	20	IDGD	
Cc1[nH]c2ccc(Br)cc2c1CC(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1	919886019	PGACAIBRHHBYNX-LLVKDONJSA-N	443.323	1.299	50	20	IDGD	
COCCCNC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1ccc(F)c(C)c1	920862821	PGFLIVXTBCOJGY-UHFFFAOYSA-N	438.481	1.915	50	20	IDGD	
C[C@H]1CN(Cc2csc(NC(=O)NNC(=O)c3ccc4c(c3)OCO4)n2)C[C@@H](C)O1	920932546	NSJOOCLJKCBMJE-TXEJJXNPSA-N	433.490	1.948	50	20	IDGD	
CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)NNC(=O)c1cc(OC)c(OC)c(OC)c1	921295828	XOSIGELQLOGHSN-UHFFFAOYSA-N	439.446	1.806	50	20	IDGD	
CC(C)[C@@H](C(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)N1C(=O)c2ccccc2C1=O	933601812	MRZWJGQUTHRVEH-SFHVURJKSA-N	447.451	1.015	50	20	IDGD	
Cc1sc(=O)n(CCC(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)c1C	1116085245	YNHUPXJECQROTQ-UHFFFAOYSA-N	426.539	1.711	50	20	IDGD	
C[C@H](COCC(F)(F)F)NC(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1	1116093287	QGRZMKSZYISFMD-LLVKDONJSA-N	426.436	1.931	50	20	IDGD	
CN(C)C(=O)c1ccc(CNC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)cc1	1116166671	LNUHEGGIHAEAKK-UHFFFAOYSA-N	433.490	1.328	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cnn(-c3ccncc3)c2C)cc1OC	1116407561	ORPNMQSUANLFON-UHFFFAOYSA-N	439.428	1.211	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)Cc2ccc(S(=O)(=O)CCO)cc2)c(Cl)c1	1116936648	MDKSQWDYTQNSEA-UHFFFAOYSA-N	425.894	1.810	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1ccccc1N1CCCC1=O	1317724086	LPVPKFNXOUDBHH-UHFFFAOYSA-N	429.502	1.490	50	20	IDGD	
O=C(CN1CCN(C(=O)OCc2ccccc2)CC1)NNC(=O)c1n[nH]c2c1CCCC2	1318896540	JYOQQPJLDPORDG-UHFFFAOYSA-N	440.504	1.004	50	20	IDGD	
O=C(c1cc2c(F)cc(F)cc2[nH]1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1777795370	UUMWVCXTNJCDHH-QFBILLFUSA-N	427.835	1.489	50	20	IDGD	
O=C(c1ccc2ncncc2c1)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1778603757	FXMVXTDMZWDEBV-YJBOKZPZSA-N	437.269	1.764	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)COC(=O)C(F)(F)F)C1	1779278856	CNZRMOHBSFAJGC-HWWQOWPSSA-N	428.835	1.623	50	20	IDGD	
Cc1cc2nc(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)[C@@H](O)CCl)C4)[nH]c2cc1C	1779295555	IVHUOUPJMVHFTJ-NJNPRVFISA-N	448.951	1.907	50	20	IDGD	
CC1(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cnccc3C(=O)NN)C2)CCCC1	1779371313	OBQQWASSCAVBSD-WZONZLPQSA-N	443.548	1.393	50	20	IDGD	
COc1cc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)cc(Cl)n1	1779796561	POEHTFLSVYCLNX-DIFFPNOSSA-N	446.729	1.971	50	20	IDGD	
COc1cccc(OC)c1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1780541615	ANJJNKRHAUGMIJ-CRAIPNDOSA-N	445.285	1.838	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2)c1ccc(-n2cccn2)cc1	1780972040	UDNLMSARRSASRH-WOIUINJBSA-N	446.935	1.600	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(CCN(C(=O)c3cnc4ccc(F)cn34)C2)C1	1782461128	UCQJFUKFNUFQEU-SFHVURJKSA-N	439.285	1.702	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccc4c(c3)OCCO4)CCO2)C1	1783534878	QMRVTIBLBWVIKW-ORAYPTAESA-N	439.306	1.685	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3nc(O)n4c3CCCC4)CCO2)C1	1783537623	PMYFMLMHUMXMRP-KZULUSFZSA-N	441.326	1.152	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)Cc1ccccc1)CCO2	1783539593	MDPUUSXFZWCGAY-URLQWDBASA-N	425.323	1.203	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)/C=C/c3cc(F)cc(OC)c3)CCO2)C1	1783879552	XDKYAHOMNZVCHA-BSDDYQGESA-N	440.899	1.931	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cc4cccnc4nc3O)CCO2)C1	1783880968	IVSYJGMVHLMPEB-FOIQADDNSA-N	434.880	1.033	50	20	IDGD	
Cc1c(C(=O)N2CCO[C@@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)oc2ccccc12	1783934661	KFLOLGHLPVLEIC-HSZRJFAPSA-N	442.516	1.558	50	20	IDGD	
Cc1oc(C(C)(C)C)cc1C(=O)N1CCO[C@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1	1783936895	WZXNKILFFGFIJO-QHCPKHFHSA-N	448.564	1.702	50	20	IDGD	
CC[S@@](=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]2C1	1783966297	DMAVUYXXCGIYKM-YCTKJRKISA-N	437.400	1.156	50	20	IDGD	
Cc1cc(C)n2ccc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]4C3)c2n1	1784093017	ZKNGKDFFXSTMIJ-OWLYRPNTSA-N	434.924	1.144	50	20	IDGD	
Cc1nn(C)c(C)c1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)CBr)C[C@@H]21	1784699623	RFZKRTQKYDFWFM-DDWPSWQVSA-N	441.370	1.661	50	20	IDGD	
C#CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@]2(CN(C(=O)C(Cl)Cl)CCO2)C1	1785575768	CMRJNKNYKZDGBR-ORAYPTAESA-N	448.347	1.537	50	20	IDGD	
CC(C)(C)OC(=O)NCC(C)(C)C(=O)N1CC[C@@]2(CN(C(=O)[C@@H](F)Cl)CCO2)C1	1785737314	ZEFOEMFNMSKPDU-BFUOFWGJSA-N	435.924	1.902	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](N)c3ccccn3)[C@H]2C1	1786869658	CEKHEZOXHPDQHJ-RMVLQADPSA-N	429.348	1.297	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)c1cccc2nc[nH]c12	1787298404	WGAYDMVZDXZZRC-YLUJIRGKSA-N	439.285	1.847	50	20	IDGD	
CN(C)c1cccc(OCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]3C2)c1	1787443741	BYFCWRQRXSDZEN-LZLXCTOHSA-N	427.904	1.646	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]2C1)[S@](=O)c1ccccc1	1787450678	TVZCJJVBDQJBQR-ZBCAILASSA-N	430.929	1.697	50	20	IDGD	
C=C(CC(=O)OCC)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](Br)CC)C[C@@H]21	1789891622	KDBDXDKBWLMQGO-VGWMRTNUSA-N	445.354	1.649	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)CBr)C[C@@H]21	1790605649	SVKUYGYDVWMYSX-AICCOOGYSA-N	449.342	1.559	50	20	IDGD	
COc1ccc(OCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)Br)C3)cc1	1792725922	JCNQEWDOCMAJMM-ZUMXRPEOSA-N	441.322	1.447	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)COC1CCCCC1	1792786209	AXUYNKKYHOFFFN-ZXFNITATSA-N	431.371	1.956	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(Br)ccc1F)C2)[C@@H](O)CCl	1792974883	GGENDVDDCSFFPT-OWLDWWDNSA-N	449.704	1.391	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(=O)nc3sccn13)C2	1793449308	YHRJWPGJORLWMT-ZWUHOBOKSA-N	438.937	1.367	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)no1)C2	1794142656	XGKODDZAJCYSLU-RNJOBUHISA-N	442.900	1.764	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(C)n(C)n1	1795080616	FGXQUKJHLMLXPI-YDOXXCSQSA-N	425.493	1.114	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCBr)c1nc(O)n2c1CCCC2	1795493384	KNRGWDLWHNOHNN-CLLJXQQHSA-N	425.327	1.962	50	20	IDGD	
Cc1c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](O)CCl)C3)[nH]c2c(Cl)cccc12	1796264494	DWAYDXHCHYRWSW-RBNVPPIJSA-N	440.327	1.933	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2c(c1)SCC(=O)N2	1796293615	IVACARPEKNHOIM-KYZVSKTDSA-N	437.949	1.951	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CN(Cc3ccccc3)CCO1)C2)[C@H](F)Cl	1796365063	PPOUQXKWMMADCH-ZRSRNVLSSA-N	439.915	1.011	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc2c1cnn2C	1797089758	LUZYPUKXGNIIEA-JRATXPSKSA-N	435.322	1.560	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2cc(F)c(F)cc2[nH]1	1797339480	WKHRQCVTQFCTQJ-SJBDTSRBSA-N	441.862	1.903	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)c1cc(Cl)sc1Cl	1798294474	ZOKKSYRKSVMAOJ-UJYYTQATSA-N	427.737	1.858	50	20	IDGD	
CC(=O)OC[C@@H](OC(C)=O)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@](C)(Cl)CCl)C2	1798475356	ZNAPAVJOGDQJNM-VTWRMFPLSA-N	437.320	1.356	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccc2ncnn2c1	1799083888	ARJXCJAPTJXTKF-CSHUHZATSA-N	440.331	1.098	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CC(=O)Nc1ccc(F)cc1)C2	1799269317	XGCJBEVVLVQNCD-AODNKKSCSA-N	425.888	1.761	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1cccc2ccnn12	1799904539	WTGZIGMZTCROMU-JLUCKKNBSA-N	425.258	1.228	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1Cc2[nH]nc(C(F)(F)F)c2C1	1800320345	CTCCDJLQXJXVHN-RXHHHXIQSA-N	448.873	1.750	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(-c2cnco2)c1	1800547594	DDVYSGUVUOCANC-REPLKXPHSA-N	439.516	1.966	50	20	IDGD	
COc1ncc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)Br)cc1C	1800757727	JBSOKGMDGYYYFX-REBRKWNGSA-N	426.311	1.385	50	20	IDGD	
CC(=O)N[C@@H](C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2	1801682715	UPYDLRHOTKIKIQ-KSYCFECVSA-N	446.460	1.297	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1c(F)ccnc1Cl)C2	1802332461	DAEHGJRBWVSHFF-CLLJXQQHSA-N	425.892	1.499	50	20	IDGD	
COc1cc(C#N)cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CCC(=O)NN(C)C)c1	1802336322	JYTRZFVNMRRIFM-BCDXTJNWSA-N	427.505	1.192	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cnn3ncccc23)[C@H]1c1cccnc1)[C@@H](O)CCl	1803139536	QMFQBQLFJWMTGJ-WBAXXEDZSA-N	428.880	1.044	50	20	IDGD	
CN(CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=COCC1)NC(=O)NCc1ccccc1	1803289772	OLGMFPDEAVSUSK-ACDBMABISA-N	441.532	1.275	50	20	IDGD	
Cn1ccc(C(=O)NC[C@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)c1	1805287599	BEFLYOWHDZCZNN-OXQOHEQNSA-N	447.499	1.052	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2cnc(N(C)C)o2)[C@H]1c1cccnc1	1805345682	IUGHZHCTAGBKEC-HLLBOEOZSA-N	435.912	1.709	50	20	IDGD	
O=C(c1ccc(-n2cnnc2)cc1)N1CCC2(CCCN(C(=O)[C@@H](O)CCl)C2)CC1	1805519427	PNRXBKVGHBKBHG-SFHVURJKSA-N	431.924	1.712	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@@H](CNC(=O)[C@H]2CCC(=O)N2)[C@@H]1c1cccnc1	1806818196	BBKZPLLVOUYEJH-JWDQPFGJSA-N	437.338	1.397	50	20	IDGD	
Cc1ccc(CC(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)o1	1807368496	UINYVENRWMDMLH-XXBNENTESA-N	447.300	1.225	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)Cc2ccccc2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1	1807371467	VLYGAKIGGCCTIZ-QPPBQGQZSA-N	443.312	1.324	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1CCN(C(=O)[C@@H]2CNC(=O)C2)[C@H]1c1cccnc1	1808317796	KPSICLWJZZMDKC-PWDMQXDWSA-N	427.332	1.460	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)c1cn2cc(F)ccc2n1	1809848231	QSTJLRKLVSRWCN-UCLAIMLFSA-N	445.882	1.788	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)CCc2cnccn2)[C@H]1c1cccnc1	1813032886	GYSRMRRRZOEKRX-QRFRQXIXSA-N	431.924	1.764	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)[C@H]2CCCCO2)[C@H]1c1cccnc1	1813068363	LKJZZHRVWHEURJ-UEXGIBASSA-N	431.537	1.030	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H](CNC(=O)CCn2cncn2)[C@H]1c1cccnc1	1813321760	PDUGSDAFXSDWCB-SOLBZPMBSA-N	449.353	1.943	50	20	IDGD	
C#CCCC(=O)NC[C@H]1CCN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@H]1c1cccnc1	1814103232	IFTXLMILMMZIBG-BFZLZUEVSA-N	434.500	1.635	50	20	IDGD	
N[C@@H](Cc1cscn1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](O)CCl)n[nH]1	1814869827	CPWKTDWQRSTWTL-FPMFFAJLSA-N	426.930	1.028	50	20	IDGD	
O=C(CC1CCCC1)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1	1815339920	URPHYLWTHNIMMK-MRXNPFEDSA-N	427.335	1.629	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2nccs2)[nH]n1)c1ccc(B(O)O)cc1	1817470751	GMSJCHVFPYGHCE-HNNXBMFYSA-N	425.279	1.166	50	20	IDGD	
CCO/C=C/C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819404403	IUZKAJICMUGMFZ-OJXHRBAXSA-N	427.465	1.264	50	20	IDGD	
COc1cc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)ccn1	1819786419	RTFYTZNMMVSPSS-MRXNPFEDSA-N	443.508	1.492	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)C1=CCCC1)CC2	1819795799	SAGRBLAHIDXSAI-GFCCVEGCSA-N	426.502	1.478	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCN2CCN(C)CC2)[nH]n1	1822368323	HHVSJLZFASYTNY-NVXWUHKLSA-N	440.976	1.293	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CNC(=O)c2ccco2)[nH]n1	1822368526	JBTJKVHMEHEFJJ-TZMCWYRMSA-N	437.884	1.679	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](C)CS(C)(=O)=O)[nH]n1	1822369486	GUQDSJZQCKSVFI-SGMGOOAPSA-N	434.946	1.336	50	20	IDGD	
Cc1nnsc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1	1822413969	JKOPQYVLJLGLSQ-ZDUSSCGKSA-N	434.526	1.249	50	20	IDGD	
CC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CNC(=O)C(F)(F)F)CC2	1822856857	WHHDSSFIGTZFSU-SFYZADRCSA-N	426.848	1.751	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CN2CCOCC2)CC1	1824092345	CKGOMFSTSBMIQC-WMZOPIPTSA-N	444.414	1.969	50	20	IDGD	
Cc1c(C(=O)N2CCC([C@H]3CCCCN3C(=O)[C@H](O)CCl)CC2)cn2[nH]cnc(=O)c12	1824186612	UGUKORUIZSCDAS-IAGOWNOFSA-N	449.939	1.164	50	20	IDGD	
CN1CCCn2nc(C(=O)Nc3nc4c(s3)C[C@H](NC(=O)[C@@H](F)Cl)CC4)cc2C1	1824381415	DQPQEHVHQFEBSG-MEBBXXQBSA-N	440.932	1.935	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@H](C(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@H](O)CCl)CC3)C1	1825973635	AHSTTYDDYWTOAY-FMCLSXCISA-N	443.953	1.634	50	20	IDGD	
Cc1nocc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1	1826042763	BUIVZBATFRCLNZ-IBGZPJMESA-N	440.504	1.529	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cnoc2)CC1	1827751221	KNMYSIBHPVEGGG-SFHVURJKSA-N	426.477	1.220	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(Cl)cc3F)CCO2)C1	1830090332	SWBFLQHNQSOQFP-HNAYVOBHSA-N	449.306	1.803	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CC[C@@H](N)C(N)=O)CC1	1830315779	DTKMGEUIDMRAJD-CLCXKQKWSA-N	435.396	1.435	50	20	IDGD	
CC(C)[C@H](C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2)c1ccccc1	1830719344	CCEBJYLCKCCYMV-CNNODRBYSA-N	438.952	1.482	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](NC(C)=O)C(C)(C)C)CCO2	1831082178	DPGGOEADMXBFQB-FVJLSDCUSA-N	445.988	1.401	50	20	IDGD	
C=CCO[C@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)CBr)C2)C1	1831419002	JBUUCYDDHCOLDN-HDMKZQKVSA-N	433.343	1.065	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cn3nc(C)cc3C)C2)C1	1831640600	NZGCTGVTCBUVTP-XLIONFOSSA-N	426.945	1.364	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)Cc2ccccc2O)CC1	1831875076	RBXKQZRHXXQFCD-FQEVSTJZSA-N	444.576	1.927	50	20	IDGD	
C=CCSCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)CBr)C2)C1	1832446965	NMVYJASWLUCZTH-RHSMWYFYSA-N	435.384	1.393	50	20	IDGD	
COCC1(C(=O)NC2CCN(C3CCN(C(=O)[C@H](F)Br)CC3)CC2)CC1	1833462707	VYHLHJRFVJCADX-HNNXBMFYSA-N	434.350	1.675	50	20	IDGD	
Cc1nnc(CCC(=O)NC2CCN(C3CCN(C(=O)[C@H](F)Cl)CC3)CC2)s1	1833832529	RDYAKQHEFKFMQB-KRWDZBQOSA-N	431.965	1.885	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccn3C)CCO2)C1	1833905419	LKZZSSDCRDAQOT-RDTXWAMCSA-N	428.327	1.126	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cc(=O)cco3)CC2)CC1	1834345187	OASCWSVFIVALCY-QGZVFWFLSA-N	425.913	1.079	50	20	IDGD	
C=CCOCCCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)CCBr)CCO2	1834819522	QLIFESAFJLZENP-GOSISDBHSA-N	433.343	1.211	50	20	IDGD	
N#CCCC(=O)N1CCO[C@]2(COCCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1	1835361979	ASJFGNZWVAZMPP-IHSQGBLNSA-N	444.438	1.632	50	20	IDGD	
C[C@@H](C(=O)NC1CCN(C2CCN(C(=O)C(Cl)Cl)CC2)CC1)n1ccccc1=O	1835825097	TUYHQOBOHSIBMQ-AWEZNQCLSA-N	443.375	1.785	50	20	IDGD	
CC(C)(C)[C@H](O)C(=O)N1CCC(N2CCC(NC(=O)CO[Si](C)(C)C)CC2)CC1	1835835371	XKRFAOUTDYEWTB-LJQANCHMSA-N	427.662	1.817	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3cncnc3)CCO2)C1	1836053173	WAEIZSFFIKUBNU-MOPGFXCFSA-N	445.347	1.102	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)[C@@]3(C)CCCN3)CC2)CC1	1836384999	QSRAKNRZONWPJN-IFXJQAMLSA-N	429.403	1.484	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3ccccc3C(N)=O)CC2)CC1	1836450590	OHKWXKYDZVKKAC-IBGZPJMESA-N	434.968	1.988	50	20	IDGD	
Cc1ccc(CCC(=O)N2CCC(OC3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)cn1	1836714877	ADGBURDFUCENGG-FQEVSTJZSA-N	437.968	1.921	50	20	IDGD	
O=C([C@@H](O)CCl)N1CCC(OC2CCN(C(=O)C(F)(F)c3ccco3)CC2)CC1	1836719537	WFXQECWUGHBIJP-HNNXBMFYSA-N	434.867	1.970	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CCC[C@@H]1C)CCO2	1836741041	IPZLUTNAPOSCSK-MKSNKDDYSA-N	431.371	1.910	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3coc([Si](C)(C)C)c3)CCO2)C1	1837425167	GPEAKANZQOFYQT-OXJNMPFZSA-N	443.016	1.912	50	20	IDGD	
CCc1ccnc(C(=O)N2CCOC[C@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)c1	1837711823	RRPIUBUQYQAMKE-NRFANRHFSA-N	435.597	1.566	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccn4nccc4c3)C2)C1	1837713356	YUBYZWOPGINZQA-NRFANRHFSA-N	446.580	1.256	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)CC(F)(F)F)CC2)CC1	1837789017	LMMCBZFQLOXANO-UHFFFAOYSA-N	436.475	1.310	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(F)ccc3F)CCO2)C1	1838860442	HUOCXGIXAJLXFF-BEFAXECRSA-N	432.851	1.289	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3c(F)cccc3F)CCO2)C1	1838864099	LSYJQPCRXFQUAQ-DJJJIMSYSA-N	432.851	1.289	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3coc([Si](C)(C)C)c3)C2)C1	1839145616	NNECOKQGLBRAQJ-OXJNMPFZSA-N	443.016	1.912	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cc(F)ccc3OC)C2)C1	1839148763	JAJRWIRKXMMLAM-UTKZUKDTSA-N	442.915	1.851	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(O)cc3F)CCO2)C1	1839317551	IUNZHZRINGPCTP-KZULUSFZSA-N	445.285	1.385	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3CC(F)(F)C3)C2)C1	1839961633	CXLHYZFXRZSVGJ-CZUORRHYSA-N	439.297	1.662	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnoc3C3CC3)C2)C1	1840032017	LJHFCFYRRWZRFD-KPZWWZAWSA-N	442.310	1.405	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cscc3OC)C2)C1	1840152338	FSWHCEYAEHYNDF-RDTXWAMCSA-N	432.926	1.081	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(CC#N)cc3)C2)C1	1840154878	IMVUIPXRAMIVHE-WIYYLYMNSA-N	435.908	1.076	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)C2CN(C(=O)c3ccccc3OC)C2)C1	1841249319	SASTUHZRYASAEN-QGZVFWFLSA-N	449.935	1.224	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@H](O)CC(=O)N1CC2(CCCN2C(=O)CCBr)C1	1842638730	BRIXPQQHDGCMPO-CYBMUJFWSA-N	448.358	1.251	50	20	IDGD	
Cc1nc2cc(C(=O)N3CC4(CCCN4C(=O)c4ccc(B(O)O)cc4)C3)ccc2s1	1843011260	LCTNULXHSXFHHJ-UHFFFAOYSA-N	435.314	1.415	50	20	IDGD	
O=C(c1ccc(OC(F)(F)F)cc1)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843011888	GSKCRKIGLUXBMM-UHFFFAOYSA-N	448.206	1.396	50	20	IDGD	
O=C(c1cc(F)c(F)c(Cl)c1)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843012712	MRRRKFIJAVLFQB-UHFFFAOYSA-N	434.635	1.429	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)c2[nH]nnc2C)C1	1843160519	JHMVVRGOSAABFG-UHFFFAOYSA-N	428.405	1.077	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)CNc1ccccc1C)C2	1843415875	XEYJLKFKHZXUOV-YZSQISJMSA-N	436.516	1.744	50	20	IDGD	
CC(C)(C)c1ccc(C(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)cn1	1844263347	URPJDISNBAXMAV-UHFFFAOYSA-N	436.516	1.508	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC2(CCCN2C(=O)c2ccc(N3C(=O)C=CC3=O)cc2)C1	1846891326	RHJWDBQOIBMIPJ-CYBMUJFWSA-N	446.301	1.716	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@](F)(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](O)CCl)C1	1847559970	WCZAOSJFSHJOCU-PJHJGJPPSA-N	433.908	1.137	50	20	IDGD	
COCC1(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2cc([N+](=O)[O-])ccc2OC(C)=O)CC1	1847800646	KRWIFTKEFFOFSS-IRXDYDNUSA-N	431.445	1.762	50	20	IDGD	
C=C1c2ccccc2C(=O)N1[C@H](C)C(=O)NNC(=O)c1csc(N2CCOCC2)n1	10292233	IJFNGZALJYKKTC-CYBMUJFWSA-N	427.486	1.256	50	20	IDGD	
CCn1c(=O)n(CC(=O)NNC(=O)COc2ccc(Br)cc2)c2ccccc21	12614010	CFERLVDGWVJFLT-UHFFFAOYSA-N	447.289	1.812	50	20	IDGD	
O=C(NNC(=O)C1CCN(S(=O)(=O)c2ccc(F)c(F)c2)CC1)c1ccccc1F	15794700	ORXJWGZRBWBMOA-UHFFFAOYSA-N	441.431	1.966	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc(Cl)ccc1Cl)c1csc(N2CCOCC2)n1	16098538	GXKPNPOZACNAOK-UHFFFAOYSA-N	437.330	1.910	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)[C@H]2CCCN(S(=O)(=O)c3ccc(F)cc3)C2)cc1	17113315	LLDYJFKJRSVDJU-INIZCTEOSA-N	449.504	1.761	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccccc1OC(F)(F)F)c1ccc(-n2cnnn2)cc1	23394023	KKOSNRNXMGFBAA-UHFFFAOYSA-N	428.352	1.184	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1	26752546	PNZZSKFPDRNUJW-UHFFFAOYSA-N	425.470	1.953	50	20	IDGD	
CC(C)NC(=O)Nc1cccc(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)c1	46670460	YMPNRRRPKBJORE-UHFFFAOYSA-N	432.506	1.584	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)[C@@H]1CCN(c2cc(Cl)ccc2Cl)C1=O	725740349	DNLKXIVQDKRUML-NSHDSACASA-N	439.255	1.517	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NC[C@@H](c1ccc(F)cc1)N1CCOCC1	726084776	UOEBFARXGFVKJN-INIZCTEOSA-N	449.508	1.021	50	20	IDGD	
CN(C)C(=O)[C@H]1CCCN1CCCNC(=O)NNC(=O)Cc1cccc2ccccc12	726278803	YYDFALAMRJVTBJ-HXUWFJFHSA-N	425.533	1.655	50	20	IDGD	
N#C/C(=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)OCCn1cncn1	727179958	JZBIWFYKMAYOJQ-OQLLNIDSSA-N	439.863	1.821	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)CCc2ccc(S(N)(=O)=O)cc2)cc1F	727500361	WBLSLNIPCFASTL-UHFFFAOYSA-N	426.495	1.432	50	20	IDGD	
O=C(CCCc1ccccc1)NNC(=O)CCNS(=O)(=O)c1ccc(F)c(F)c1	727741483	TXDGMISESXZSRP-UHFFFAOYSA-N	425.457	1.804	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2)c1cc2c(s1)CCC2	728261134	OBMPCFAWFYJBKE-UHFFFAOYSA-N	425.444	1.540	50	20	IDGD	
CC(=O)N(c1cccc(Cl)c1)c1nc(C=NNC(=O)[C@H](C)NS(C)(=O)=O)cs1	728436067	KMFRZNJTOSYIEW-JTQLQIEISA-N	443.938	1.869	50	20	IDGD	
CSc1nc(C)c(CCC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c(C)n1	728847746	NTDYWLWNSLVDTN-UHFFFAOYSA-N	429.550	1.602	50	20	IDGD	
CCc1ccc(NS(=O)(=O)c2cc(C(=O)NNC(=O)c3cnn[nH]3)ccc2OC)cc1	729455698	UWECZQJURLTZPJ-UHFFFAOYSA-N	444.473	1.251	50	20	IDGD	
NC(=O)C1CCN(c2ncccc2CNC(=O)NNC(=O)Cn2ccc3ccccc32)CC1	729500720	XZEMECAWTLJLBH-UHFFFAOYSA-N	449.515	1.269	50	20	IDGD	
CCCNC(=O)CCCC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	729510342	YZKPQSWAQQBHKS-UHFFFAOYSA-N	438.550	1.319	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNc2nc(-c3cccnc3)no2)sc1Br	729534444	UHXUBDRVFIQILL-UHFFFAOYSA-N	445.280	1.360	50	20	IDGD	
O=C(NNC(=O)c1cccc2ncccc12)c1ccccc1S(=O)(=O)N1CCOCC1	730226195	AJAHPDPCHBKWMY-UHFFFAOYSA-N	440.481	1.331	50	20	IDGD	
COc1ccccc1C[C@@H](C)CC(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	730656844	ZKEQWFWEVNDMSP-QRWLVFNGSA-N	442.468	1.795	50	20	IDGD	
O=C1NC(=O)C2(CCC(C(=O)NNC(=O)c3cc(F)ccc3Br)CC2)N1	731475008	JQVZCWNYOMHUJS-UHFFFAOYSA-N	427.230	1.118	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCCN1CCSCC1	732892197	VHAXPAZXEANNDU-GFCCVEGCSA-N	431.356	1.596	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)/C(=C\c1ccco1)NC(=O)c1ccccc1	732952457	XOILSSOALDZWQM-CPNJWEJPSA-N	443.423	1.487	50	20	IDGD	
CCN1CCC[C@@H]1CN1C[C@@H](C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)CC1=O	733362608	TYGCLUUOYDGONA-DZGCQCFKSA-N	444.504	1.459	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)C[C@H]2OCCc3ccccc32)cc1	734417036	HEPCWKBTCQHZPD-LJQANCHMSA-N	431.514	1.467	50	20	IDGD	
CCSc1cc(C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)ccn1	735118860	YZHMSSJAMMEGDB-UHFFFAOYSA-N	436.563	1.282	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2ccnc(N3CCCCC3)n2)c2ccccc2c1=O	739475236	NYYQQOUAHJHAEO-UHFFFAOYSA-N	435.488	1.662	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)[C@@H]2CCCN(C(=O)COc3ccccc3)C2)cn1	741305930	UCGBPSDZJQNTNE-OAHLLOKOSA-N	443.529	1.725	50	20	IDGD	
CCn1c(NNC(=O)CCCC[C@@H]2SC[C@@H]3NC(=O)N[C@@H]23)nc2ccccc2c1=O	742275991	SYLVOAXHRQWFLC-YQQAZPJKSA-N	430.534	1.585	50	20	IDGD	
C[C@@H]1C[C@H](NC(=O)NNC(=O)c2ccc(Br)s2)C(=O)N1c1cnn(C)c1	743518786	UJZFPLOPIBYLDO-SCZZXKLOSA-N	441.311	1.382	50	20	IDGD	
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCC(=O)NNC(=O)c1cccc(C#N)c1	744473335	FGXJLNHEABVJSI-FQEVSTJZSA-N	447.451	1.091	50	20	IDGD	
Cc1nc(COc2ccc(C(=O)OCC(=O)NNC(=O)c3ccc(C#N)cc3)cc2)no1	744531694	KKKBGWSRIIGUQA-UHFFFAOYSA-N	435.396	1.447	50	20	IDGD	
CC(C)[C@@H](NC(=O)c1cccs1)C(=O)OCC(=O)NNC(=O)c1ccc(C#N)cc1	744612842	SESXWCXIEFUHBV-QGZVFWFLSA-N	428.470	1.379	50	20	IDGD	
COc1cc(/C=C\C(=O)NNC(=O)N2CCOCC2)ccc1OCc1c(C)noc1C	745995809	CKJBDPFZMRDDPI-ALCCZGGFSA-N	430.461	1.965	50	20	IDGD	
CCS(=O)(=O)CCOc1ccc(S(=O)(=O)NNC(=O)c2cccc(Cl)c2)cc1	746352809	WKJKVXHAAWDKKP-UHFFFAOYSA-N	446.934	1.777	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NN=Cc2cccc(O[C@H](C)C(=O)O)c2)cc1	746679428	RODBIUPOGUMUEX-OAHLLOKOSA-N	433.486	1.618	50	20	IDGD	
C[C@@H]1C[C@@H](C)CN(C(=O)CN2CCN(C(=O)NNC(=O)c3ccc(C#N)cc3)CC2)C1	747102148	ANOZGFXOVGMBQZ-IAGOWNOFSA-N	426.521	1.035	50	20	IDGD	
O=C(NCCc1cccs1)NNS(=O)(=O)c1ccc(C(=O)O)c(Br)c1	747608914	MDYCVNOKBAWXDA-UHFFFAOYSA-N	448.320	1.944	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)NCCCN2CCN(c3ccncc3)CC2)c1	748344373	VFJQJQGITOVACA-UHFFFAOYSA-N	425.537	1.304	50	20	IDGD	
O=C(NCCNC(=O)c1cccc(Br)c1)NNc1ccc(-n2cccn2)nn1	750331178	RIJIZOOFVMJQNZ-UHFFFAOYSA-N	445.281	1.481	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)Cc2cn3cc(Cl)cc(Cl)c3n2)c2ccccc2c1=O	750658216	CWPYKNGIUMZQRR-UHFFFAOYSA-N	445.266	1.892	50	20	IDGD	
Cc1cccc(-n2cc(C(=O)NNC(=O)CCN3CCN(c4ccccc4)CC3)nn2)c1	751043098	IVRNLPBBWHAFGX-UHFFFAOYSA-N	433.516	1.549	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)[C@H]1CCCN(C(=O)c2ccc(F)cc2)C1	751208964	JETKSNMYQVDHKN-AWEZNQCLSA-N	432.477	1.317	50	20	IDGD	
CCn1c(NNC(=O)CCNS(=O)(=O)/C=C\c2ccccc2)nc2ccccc2c1=O	751883860	WCDCSTZHFUCOAI-SQFISAMPSA-N	441.513	1.840	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)N[C@@H]2CCN(Cc3ccc(C#N)cc3)C2=O)cc1	753291498	WYRLIKUHABHECI-HXUWFJFHSA-N	435.484	1.631	50	20	IDGD	
O=C(COC(=O)Cc1cc(F)cc2c1OCOC2)NNC(=O)c1cccc([N+](=O)[O-])c1	753876950	COMSEOKAQWXRFQ-UHFFFAOYSA-N	433.348	1.147	50	20	IDGD	
CCOC(=O)[C@@H](NCC(=O)NNC(=O)c1cc(Cl)ccc1OC)[C@H]1CCCOC1	754261195	JOXSRVFYVBSYPF-SJCJKPOMSA-N	427.885	1.058	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1nnc(SCc2ccc(F)cc2)s1	755417731	PZCIGSZQAMTALL-QMMMGPOBSA-N	448.527	1.060	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1cnn(C)c1)C(=O)NNc1ccc(C(F)(F)F)cc1[N+](=O)[O-]	755682345	NDRQGCWYYRLBME-MRVPVSSYSA-N	436.372	1.157	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)Nc1cccc(N2CCS(=O)(=O)CC2)c1	756208292	XQNMDVPUUQKPLI-UHFFFAOYSA-N	446.529	1.716	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)Nc1cccc(C[S@@](=O)c2ccccc2)c1	756591106	PMAFQHNVPAMNDB-OHZJNBGDSA-N	435.527	1.582	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccc(F)cc2OCC#N)c1	757683260	SVTZPMVVLWWXOZ-UHFFFAOYSA-N	435.437	1.445	50	20	IDGD	
O=C(NNC(=S)NC[C@H]1CCCCO1)c1ccc(S(=O)(=O)N2CCCC2)cc1	758174955	JFSBYXLJGPXDLY-OAHLLOKOSA-N	426.564	1.149	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)NC[C@H]1CC(=O)N(Cc2ccccc2)C1	758651066	AUCPAKFCCPDHGF-QGZVFWFLSA-N	426.473	1.453	50	20	IDGD	
O=C(NNC(=O)c1cccc(NS(=O)(=O)c2cccs2)c1)C(=O)Nc1ccccn1	758829712	HHKDOQILDFTRKI-UHFFFAOYSA-N	445.482	1.344	50	20	IDGD	
C[C@H](C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1)c1cccc([N+](=O)[O-])c1	761971418	AXZAMSMVKKXEHG-AWEZNQCLSA-N	434.474	1.863	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)c2ccncc2)sc2c1CCSC2	763463372	CKGYJLLAYHUAQV-UHFFFAOYSA-N	434.499	1.509	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C)c(C)c(NC(=O)C(=O)NNC(=O)c2ccncc2)c1	763465039	VCOFUGRFQJSHEH-UHFFFAOYSA-N	447.517	1.129	50	20	IDGD	
COC(=O)c1cccc(C#Cc2cccc(NC(=O)C(=O)NNC(=O)c3ccncc3)c2)c1	763466316	MANVWPHMPLALGV-UHFFFAOYSA-N	442.431	1.668	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(NC(C)=O)ccc2Cl)cc1OC	763544580	ZHJGCVXAQPJFIX-UHFFFAOYSA-N	434.836	1.715	50	20	IDGD	
CCC[C@H](C(=O)NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1)C(C)C	763589746	OIZPJEVCDFKUTE-IBGZPJMESA-N	438.594	1.521	50	20	IDGD	
C[C@H]1COCCN1c1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)cc1	763599902	AKRDEOWLHGWOEF-HNNXBMFYSA-N	448.483	1.702	50	20	IDGD	
CCOC(=O)c1c(F)cccc1NC(=O)C(=O)NNC(=O)COc1ccccc1CC	763716446	GRVHKHCAPSXVFY-UHFFFAOYSA-N	431.420	1.730	50	20	IDGD	
O=C(NNC(=O)[C@H]1C[C@@]12CCOC2)c1cccc(S(=O)(=O)NCc2ccccc2)c1	763728757	QYSWHLGYFDJLMC-WIYYLYMNSA-N	429.498	1.353	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)C(=O)Nc2cccc(Cl)c2S(C)(=O)=O)c1	763760379	LIMMZBMIWXHZQQ-UHFFFAOYSA-N	438.893	1.209	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)C(=O)Nc1c(F)cccc1Br	763790250	HFNDJGICDGOWRP-UHFFFAOYSA-N	448.208	1.637	50	20	IDGD	
CCN(CC)Cc1cccc(NC(=O)C(=O)NNC(=O)c2nnc(O)c3ccccc23)c1	763791800	YSEDJGXJEVTTLW-UHFFFAOYSA-N	436.472	1.577	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)C(=O)Nc2ccc(C)nc2C)c2ccccc2c1=O	763801082	DLDQXLJEBIBWIX-UHFFFAOYSA-N	436.472	1.608	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)cc1OC(C)C	763807127	KYFZKSGSEZJOMX-UHFFFAOYSA-N	426.429	1.519	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccnn1CCc1ccccc1	763871219	FLTVXIFULZGWGP-HNNXBMFYSA-N	439.447	1.818	50	20	IDGD	
CCN(c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1)C(C)C	763916587	HDLXEXDWXXUJOB-UHFFFAOYSA-N	436.476	1.297	50	20	IDGD	
COc1ccc(CN(C)C)cc1NC(=O)C(=O)NNC(=O)c1ccc(Cl)cc1OC	764013114	VCDQYRIKJKVOOG-UHFFFAOYSA-N	434.880	1.819	50	20	IDGD	
CC[C@@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(C(=O)NCc2ccccn2)c(Cl)c1	764082457	NZQQIRMDZRXXQV-GFCCVEGCSA-N	431.880	1.797	50	20	IDGD	
CNS(=O)(=O)c1cc(NC(=O)C(=O)NNC(=O)CCCc2ccccc2)ccc1C	764226321	KIGDRGKEULDICR-UHFFFAOYSA-N	432.502	1.012	50	20	IDGD	
CCOc1cc(F)ccc1NC(=O)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	764265831	FTXJRSSYFSKXRI-UHFFFAOYSA-N	430.440	1.017	50	20	IDGD	
CCCn1ccc2ccc(NC(=O)C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)cc21	764265989	HUVMECOMEVRYAR-UHFFFAOYSA-N	449.515	1.844	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)C(=O)Nc1ccc(N2CCCC2=O)c(F)c1	764366608	NSRHMIAWNDNBQY-UHFFFAOYSA-N	428.420	1.255	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)C(=O)Nc1cccc(F)c1I	764386136	QWZFRGCXLAUPLM-UHFFFAOYSA-N	442.188	1.533	50	20	IDGD	
CS(=O)(=O)Cc1noc(NC(=O)NNC(=O)c2ccc(COc3ccccc3)o2)n1	765243417	PUBVHJOZADQBHS-UHFFFAOYSA-N	435.418	1.253	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)CNC(=O)N1CCc2ccccc2C1	765311556	YAYVSVYTUSHTJE-UHFFFAOYSA-N	433.509	1.207	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)c3cc(S(=O)(=O)N(C)C)c[nH]3)n[nH]2)c1	765582557	WOMPZVPLMZFVCJ-UHFFFAOYSA-N	430.490	1.347	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)cc1	765607545	QFXRLNMQBIBYCJ-UHFFFAOYSA-N	445.476	1.977	50	20	IDGD	
COc1ccc2[nH]cc(CC(=O)NNC(=O)CN3CCN(Cc4ccc(C)cc4)CC3)c2c1	765749449	NUZPNSHQVHXESW-UHFFFAOYSA-N	449.555	1.993	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)[C@H]1COc2ccccc21	765757207	ADUHSBKTHMYHGS-IBGZPJMESA-N	428.920	1.781	50	20	IDGD	
O=C(NNc1cnccn1)C(=O)Nc1ccc(-c2csc(N3CCOCC3)n2)cc1	766260954	YQUFYAIAUXWTFV-UHFFFAOYSA-N	425.474	1.519	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)c1ccc(N2C(=O)CCC2=O)c([N+](=O)[O-])c1	766351318	MWRVNVXKPZMFSO-LLVKDONJSA-N	444.375	1.616	50	20	IDGD	
Nc1cc(C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)cc(Cl)n1	766660345	KJLXATZDHPPXDR-UHFFFAOYSA-N	437.331	1.549	50	20	IDGD	
CNc1snc(C)c1C(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	766664984	ZUXCXXAUYQUJDA-UHFFFAOYSA-N	436.969	1.725	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2	767948892	QJXJJWINMOGSFB-UHFFFAOYSA-N	427.549	1.860	50	20	IDGD	
CCOC(Cn1cc(C(=O)NNC(=O)c2cc(-c3cc(C)ccc3C)[nH]n2)nn1)OCC	768264759	MFPQVAQRHQARJQ-UHFFFAOYSA-N	441.492	1.759	50	20	IDGD	
CC[C@@H]1CCCC[C@@H]1OCC(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	768712314	PNQQEQAVFFHEMG-SJORKVTESA-N	439.582	1.446	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NC[C@@H]2[C@H]3Cc4ccccc4[C@@H]32)cc1	769151911	QYPBYWCFIZHORP-SBHAEUEKSA-N	442.541	1.532	50	20	IDGD	
CCc1c(C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)cnn1-c1ccccc1OC	769180703	IDAGRIRLUMKDQD-UHFFFAOYSA-N	447.451	1.933	50	20	IDGD	
COC(=O)c1[nH]c(C)c(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)c1C	769247312	HNDILWPJZDACPC-UHFFFAOYSA-N	436.490	1.196	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)C(=O)Nc1cnn(-c2ccccc2)c1C(F)(F)F	769264255	CSAGRVIFXPCIEG-UHFFFAOYSA-N	432.362	1.994	50	20	IDGD	
COCCCS(=O)(=O)NCC(=O)NNC(=O)c1ccc(-c2ccc(F)cc2)s1	770135784	VYAUCYDYTGOXEX-UHFFFAOYSA-N	429.495	1.271	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)c2cc(F)ccc2Br)cn1	770233588	QJCCQDLCWSUYEX-UHFFFAOYSA-N	445.270	1.308	50	20	IDGD	
CSCCNC(=S)NNC(=O)[C@@H]1CS[C@@]2(c3ccc(F)cc3)CCC(=O)N12	770241169	VUQTWVBLARLEBY-SUMWQHHRSA-N	428.580	1.575	50	20	IDGD	
CSCCNC(=S)NNC(=O)c1cccnc1SCc1ccc(C(N)=O)cc1	770245572	FVLZQGLZLVJXFE-UHFFFAOYSA-N	435.600	1.945	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)Nc1cccc(C(=O)NCCC(N)=O)c1	770418815	GXBCFNNUKRUMPY-LBPRGKRZSA-N	447.879	1.565	50	20	IDGD	
Cc1cc(Br)c(F)cc1NC(=O)C(=O)NNC(=O)[C@@H]1Cc2ccccc2O1	770771072	GKNUWEHDJUJSGW-HNNXBMFYSA-N	436.237	1.986	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)c3ccccc3CN3CCOCC3)nc21	770956954	XXCZUSNYKZJIBX-UHFFFAOYSA-N	425.493	1.876	50	20	IDGD	
C[C@H]1CN(C(=O)OC(C)(C)C)[C@H](C)CN1C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	771904793	MWYZDEZNBHFBOM-UONOGXRCSA-N	444.496	1.346	50	20	IDGD	
C[C@H]1CN(c2ccnc(C(=O)NNc3ccc(S(=O)(=O)NC4CC4)cc3)c2)C[C@@H](C)O1	772174486	CGFNPYMODQIDDP-GASCZTMLSA-N	445.545	1.893	50	20	IDGD	
CNC(=O)COc1cccc(CC(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)c1	772227116	FKPQQUFXJBORRD-UHFFFAOYSA-N	425.420	1.344	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)Cn1cc(Br)ccc1=O	772963365	JAPTUEHRJXGUNR-JTQLQIEISA-N	428.670	1.879	50	20	IDGD	
CCCC(=O)N1CSC[C@H]1C(=O)NNC(=O)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	773420829	PNTPPEWXCPOXKN-KGLIPLIRSA-N	428.555	1.483	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(N3C[C@H](C)O[C@H](C)C3)nc2)cc1F	773886442	WNGZJPMHTPMDGL-OKILXGFUSA-N	429.452	1.542	50	20	IDGD	
COC(=O)c1csc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)c1	774009567	REPUOXKGUNULOJ-VIFPVBQESA-N	425.850	1.742	50	20	IDGD	
COC(=O)[C@H](C)n1cccc1C=NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	774590098	WBUJHAUWRVAQDV-HNNXBMFYSA-N	432.502	1.771	50	20	IDGD	
COc1ccc(SC)c(OC)c1C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C	775747168	UKDRGQYWJKNLSJ-UHFFFAOYSA-N	428.511	1.894	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(Cl)c(C(=O)NNc2cccc(S(C)(=O)=O)c2)c1	776527124	LKMOVVOYMUUXSO-UHFFFAOYSA-N	431.923	1.751	50	20	IDGD	
COc1ccc([C@H](CNC(=O)NNc2cccc(S(C)(=O)=O)c2)N2CCOCC2)cc1	776608975	VKWNGOUSZVUFQT-FQEVSTJZSA-N	448.545	1.798	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)[C@@]1(F)CCN(C(=O)OCc2ccccc2)C1	776873049	LVJZLHSQKGFCQU-HXUWFJFHSA-N	448.476	1.376	50	20	IDGD	
CCOC(=O)N1CCC[C@H]([C@H](C)NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)C1	776929913	GXDVKUQJXBPHAU-ZFWWWQNUSA-N	440.522	1.291	50	20	IDGD	
O=C([C@@H]1SCCc2sccc21)N1CCN(S(=O)(=O)CBr)CC1	777779629	OZGRKJMUAPOKQL-GFCCVEGCSA-N	425.395	1.905	50	20	IDGD	
Cc1c(C(=O)NN(C)C(N)=O)nnn1-c1cccc2c1CCN(Cc1ccccc1F)C2	778415414	VFHXSHWDKHXSOV-UHFFFAOYSA-N	437.479	1.928	50	20	IDGD	
CCOC(=O)N1CCC([C@H](C)NC(=O)NNC(=O)Cc2nc3ccccc3n2C)CC1	779668371	AZTZGOOWMPFAOY-AWEZNQCLSA-N	430.509	1.703	50	20	IDGD	
Cc1ccc(CNC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)c(N2CCCC2)n1	781384674	DCVZTJGOWQNTFD-UHFFFAOYSA-N	446.533	1.930	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)N2C[C@@H](CC(=O)N(C)C)c3cc(Cl)ccc32)nc1	782143166	WKEBBXUFXJXXIO-GFCCVEGCSA-N	431.880	1.795	50	20	IDGD	
CC[C@H](C)n1ncc(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)c1C1CC1	782892586	DSRUHXLEHWXKPD-ZDUSSCGKSA-N	437.504	1.947	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)ccc1OC(C)C	783264940	UJQDILBFPIOPAR-UHFFFAOYSA-N	449.533	1.946	50	20	IDGD	
CCOC(=O)c1c(CC(C)C)csc1NC(=O)C(=O)NN[C@]1(C)CCS(=O)(=O)C1	783427056	PQAZORYCBXVQRU-GOSISDBHSA-N	445.563	1.260	50	20	IDGD	
COC(=O)CCSc1cccc(NC(=O)C(=O)NNc2ccc(-n3cccn3)nn2)c1	783433531	VPTMXBBRWWJGIC-UHFFFAOYSA-N	441.473	1.399	50	20	IDGD	
Cc1cc(Br)ccc1NNC(=O)C(=O)Nc1cc(-n2cnnn2)ccc1F	784414635	RREDNSSWYFPBRY-UHFFFAOYSA-N	434.229	1.954	50	20	IDGD	
COc1cc(Br)c(NC(=O)C(=O)NNc2nccnc2Cl)cc1OC	784780891	RWQKAAHEIHUPHL-UHFFFAOYSA-N	430.646	1.992	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2cccc(C(F)(F)F)n2)cc1S(=O)(=O)N(C)C	784952853	UBNUJJWNTFAGJH-UHFFFAOYSA-N	445.423	1.741	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H]2CCCN(C3CCCCC3)C2=O)c1	785923019	JREWNJJRNPPRFG-QGZVFWFLSA-N	436.534	1.358	50	20	IDGD	
COC(=O)CCc1cccc(NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)c1	786416632	HMBRWHJYOMLCTF-UHFFFAOYSA-N	441.469	1.644	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2ccc(NC(=O)COC(=O)/C(C#N)=C\C3CC3)cc2)C[C@@H](C)O1	786672252	ZWTJGDADCLJNDR-LAHQVWKISA-N	447.513	1.826	50	20	IDGD	
COC[C@@H](C)n1c(C)cc(/C=C(/C#N)C(=O)N2CCN(c3cnc(O)nc3N)CC2)c1C	788156011	WWZXFGNZDWZYFK-YQYFLZKSSA-N	439.520	1.646	50	20	IDGD	
COC(=O)COc1ccc(C=NNC(=O)C(=O)Nc2ccc(C)c(C)c2)cc1[N+](=O)[O-]	788701070	BGMMOWXGECJMET-UHFFFAOYSA-N	428.401	1.852	50	20	IDGD	
CN(NS(=O)(=O)CC1(C#N)CCCCC1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	788917232	UHUBVNOEJDHGNA-UHFFFAOYSA-N	443.570	1.899	50	20	IDGD	
CC[C@@H]1CCc2nc(NC(=O)C(=O)NNC(=O)[C@@H]3COc4ccccc4O3)sc2C1	789731197	BFKNKQWLDFUGPP-ABAIWWIYSA-N	430.486	1.584	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)C(=O)Nc2nc([C@H]3C[C@H]4CC[C@H]3C4)cs2)c1	789738657	GUZKLSMGODIXCR-HUBLWGQQSA-N	442.501	1.800	50	20	IDGD	
Cc1onc(-c2ccc(C(F)(F)F)cc2)c1C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O	792317381	UXVLYPMGILYNAU-MRVPVSSYSA-N	434.396	1.368	50	20	IDGD	
CCOCC(=O)NNC(=O)C(=O)Nc1ccc(OC(F)(F)F)c(Br)c1	792356426	PPEOWQGLFKWJMN-UHFFFAOYSA-N	428.161	1.470	50	20	IDGD	
Cc1cccnc1NNC(=O)C(=O)N1CCc2cc(S(=O)(=O)N3CCCCC3)ccc21	792375577	KGNMRDJYHORITN-UHFFFAOYSA-N	443.529	1.597	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc(O)cc2)n(-c2nc3ccccc3s2)n1	793034470	FJEAUUPJRCRYAH-UHFFFAOYSA-N	436.453	1.896	50	20	IDGD	
CN(CC(N)=O)C(=O)c1cccc(NC(=O)C(=O)NNc2cc(Cl)cc(Cl)c2)c1	793052980	ACJKGJBFBNNXNE-UHFFFAOYSA-N	438.271	1.633	50	20	IDGD	
C[C@](O)(CN1C(=O)NC2(CCCC2)C1=O)C(=O)NNc1ccccc1Br	793709825	URKWOTMGZDYLSC-INIZCTEOSA-N	425.283	1.508	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)c1cc(Cn2cccn2)on1	794180640	MOGKYUHDWOWORQ-LLVKDONJSA-N	434.250	1.910	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1)c1ccc2c(c1)OCO2	794394431	XSQOOOXOAHAFLU-MRXNPFEDSA-N	438.484	1.124	50	20	IDGD	
CN(C(=O)OC(C)(C)C)[C@@H](C(=O)NNc1nc(-c2cccnc2)no1)c1cnn(C)c1	796342019	LBBDAWZPJHNCMY-CQSZACIVSA-N	428.453	1.916	50	20	IDGD	
Cn1c(=NNC(=O)c2ccc(S(=O)(=O)NC[C@H]3CCCO3)cc2)sc2ccccc21	798304042	BYQTUOAWDZYDSW-OAHLLOKOSA-N	446.554	1.943	50	20	IDGD	
C=CCNC(=S)NNC(=O)[C@@H]1CCCN1C(=O)NCc1cccc(Br)c1	798305324	XIQJLXULJRCJKX-AWEZNQCLSA-N	440.367	1.804	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)c1ccc(S(C)(=O)=O)c([N+](=O)[O-])c1	801180504	IGITWHIXTGWPFI-UHFFFAOYSA-N	439.471	1.560	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1	801427586	XMHTXNKFVNINJM-HXUWFJFHSA-N	441.484	1.673	50	20	IDGD	
Cc1nc(Cn2nnc(C(=O)NNC(=O)Nc3ccc(Br)cc3)c2C)no1	801995083	XULACJOEIOGFBM-UHFFFAOYSA-N	435.242	1.555	50	20	IDGD	
CC1(C)C(=O)N(C[C@](C)(O)C(=O)NNC(=O)Nc2ccc3c(c2)OCO3)c2ccccc21	802099428	RBTCGLGIIKPYMW-QFIPXVFZSA-N	440.456	1.643	50	20	IDGD	
O=C(NNC(=O)[C@H]1CS[C@H](Cc2ccccc2F)C(=O)N1)Nc1ccc2c(c1)OCO2	802102647	ARKCEFVOJJHCKB-RHSMWYFYSA-N	446.460	1.550	50	20	IDGD	
Cc1nc(C(F)(F)F)ccc1NC(=O)C(=O)NNC(=O)c1cc(Br)c[nH]1	802566327	JJUMXRHFSBALCT-UHFFFAOYSA-N	434.172	1.899	50	20	IDGD	
O=C(c1cscc1Br)N1CCN(S(=O)(=O)CBr)CC1	803038155	NVOHULDAYCCXET-UHFFFAOYSA-N	432.159	1.951	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N[C@@H](C)c2n[nH]c(C)n2)cc1	804812662	RCOPJTLTDRLSQK-RKPNYOAGSA-N	448.487	1.645	50	20	IDGD	
CN(C)S(=O)(=O)C[C@H](NC(=O)NNC(=O)c1cccc(OC(F)F)c1)C(F)(F)F	805066329	YSQQONJQSUUGBB-JTQLQIEISA-N	448.370	1.054	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1cc(F)c(Br)c(Cl)c1	806721287	FZEOHHBFVXZBIO-YFKPBYRVSA-N	431.671	1.332	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2ccc(-n3ccnc3)nn2)n(-c2ccc(Cl)cc2)n1	807428786	KSGSWBFKURFTCD-UHFFFAOYSA-N	437.851	1.892	50	20	IDGD	
COC(=O)c1c(F)cccc1NNC(=O)c1cc(NC(C)=O)ccc1NS(C)(=O)=O	808028772	MSJYTJUKRULIGD-UHFFFAOYSA-N	438.437	1.699	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)CNS(=O)(=O)c1cc(C(F)(F)F)ccc1Cl	810364240	RFHPNPIFARJTJG-UHFFFAOYSA-N	439.803	1.130	50	20	IDGD	
O=C(Cc1ccccn1)NNC(=O)C(=O)Nc1ccc(-n2ccc(C(F)(F)F)n2)cc1	810387270	NGKDOEXXTJVPIA-UHFFFAOYSA-N	432.362	1.615	50	20	IDGD	
COC(=O)c1ccccc1NNC(=O)CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1	810891249	JLASFQNSAAPHRJ-UHFFFAOYSA-N	447.391	1.793	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)Cc2cncn2Cc2ccccc2)n1	811327901	FKDOPKCHPDSHKH-UHFFFAOYSA-N	427.486	1.172	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)c2c[nH]nc2-c2ccc3c(c2)OCCO3)cc1	812728701	WFIMCSPIJZULIY-UHFFFAOYSA-N	443.485	1.855	50	20	IDGD	
Cc1cc(CNC(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)nc(N2CCCC2)n1	814412766	RYYSBVWENNTHCP-UHFFFAOYSA-N	435.529	1.521	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc([C@@H]3CCOC3)cc2)cc1	815566032	HEUIVOKJNXOQLM-CRAIPNDOSA-N	439.468	1.947	50	20	IDGD	
Cc1nc(Cn2nnc(NC(=O)C(=O)NNc3cc(Cl)ccc3Cl)c2C)no1	815589349	PRRBNQAKAXAGEF-UHFFFAOYSA-N	425.236	1.715	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(NC(=O)C(=O)NNc2ncncc2F)ccc1Cl	815765163	HWCGKODFLIMDEI-UHFFFAOYSA-N	444.876	1.381	50	20	IDGD	
CC(C)[C@H](NC(=O)C(F)(F)F)C(=O)NNC(=O)[C@H]1CCCN(C(=O)OC(C)(C)C)C1	816509838	DGJKWPLGSQCFFY-RYUDHWBXSA-N	438.447	1.484	50	20	IDGD	
COC(=O)c1cc(NNC(=O)c2cc(S(=O)(=O)N3CCSCC3)c[nH]2)ccc1C	816689982	DJPIAURJYXXKIG-UHFFFAOYSA-N	438.531	1.604	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@@H]12	817053455	SFUDWIYCUOUDIQ-GRDNDAEWSA-N	441.579	1.106	50	20	IDGD	
N#Cc1cc(F)ccc1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	818377459	FFSVOYDYSDMFDQ-UHFFFAOYSA-N	447.448	1.185	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)N2CCC(O)(c3nn[nH]n3)CC2)c(C)n1C[C@@H]1CCCO1	819615091	WLIVLYUKOOAFBJ-RLGUWMIQSA-N	425.493	1.214	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)CNS(=O)(=O)c2c(C)c(C)cc(C)c2C)cc1	913431595	WQPUGAYBSGTTFK-UHFFFAOYSA-N	432.546	1.767	50	20	IDGD	
COc1ccc(-n2nnc(C(=O)OCC(=O)NNC(=O)c3ccc(Cl)cc3)c2C)cc1	915402444	RKGFRUSIOJWOKS-UHFFFAOYSA-N	443.847	1.856	50	20	IDGD	
O=C(NN=Cc1c(N2CCCCC2)nc2ccccn2c1=O)c1ccc(-n2cnnn2)cc1	916352548	XSLIKVHEMWGVFJ-UHFFFAOYSA-N	443.471	1.424	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)NC[C@H](C)N2CCN(c3ccccc3)CC2)c1	916515069	ZVLKXUCVQDPLRH-IBGZPJMESA-N	425.533	1.915	50	20	IDGD	
CCOc1ccc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1[N+](=O)[O-]	916655447	ZUWFJSWPKFVXMW-QGZVFWFLSA-N	445.384	1.138	50	20	IDGD	
CC(C)(C)C(=O)NNC(=O)C1CCN(S(=O)(=O)c2ccc3c(c2)OCCO3)CC1	917180149	FXNKKGHZVKZQBV-UHFFFAOYSA-N	425.507	1.052	50	20	IDGD	
COc1c(F)cc(CC(=O)NNC(=O)Cc2ccc3ccccc3c2)cc1S(N)(=O)=O	917197825	NVPAPTYEPWZFJH-UHFFFAOYSA-N	445.472	1.568	50	20	IDGD	
Cc1ccc(C(=O)CCC(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)s1	917235825	XMIZCUQEEGGNOA-INIZCTEOSA-N	432.454	1.550	50	20	IDGD	
O=C(NNC(=O)c1ccc2ccccc2c1)c1ccc(S(=O)(=O)N2CCOCC2)cc1	918108585	GCTBFZKNBNAXLG-UHFFFAOYSA-N	439.493	1.936	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(N2CCOCC2)c(C(=O)NNC(=O)C(C)(C)C)c1	920473383	LVIQKXGVQOALHF-UHFFFAOYSA-N	440.566	1.361	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc(F)c(F)c1)NNC(=O)NCCc1cccs1	920888943	FBIXLUMOFTUTEB-UHFFFAOYSA-N	432.474	1.268	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)Nc2ccccc2CN2C(=O)CNC2=O)c1	920930941	WPZRHARNPNZALR-UHFFFAOYSA-N	425.445	1.587	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)NNC(=O)c2cccc(OC)c2O)cc1OC	920937884	GQIHQONZMRMLIH-UHFFFAOYSA-N	438.462	1.638	50	20	IDGD	
O=C(NNC(=O)c1cnn2ccncc12)c1ccccc1NS(=O)(=O)c1cccs1	1116759710	LKFSDQXGSILKPG-UHFFFAOYSA-N	442.482	1.666	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)NNC(=O)c2ccc(OC)cc2)cc(S(C)(=O)=O)c1	1254736799	LBOQVNHITBRFIL-UHFFFAOYSA-N	435.458	1.742	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)Cc2csc(NC(=O)c3ccccc3)n2)C[C@@H](C)O1	1317782256	MDABXOIXRKVKPQ-HUUCEWRRSA-N	445.545	1.585	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N2CCC[C@@H](C(=O)NC3CC3)C2)cc1Br	1318440250	TXSZKLCBQNLQLL-GFCCVEGCSA-N	439.310	1.803	50	20	IDGD	
O=C(CN1CCC([C@H]2C(=O)Nc3ccccc32)CC1)NNC(=O)c1ccc([N+](=O)[O-])cc1	1319926327	CMLDXKRVUPWLEP-HXUWFJFHSA-N	437.456	1.804	50	20	IDGD	
CCCCN(C)C(=O)c1ccccc1S(=O)(=O)NNC(=O)c1n[nH]c2c1CCCC2	1322625415	JOUHXJBYDQRFPX-UHFFFAOYSA-N	433.534	1.784	50	20	IDGD	
CCCS(=O)(=O)N1CCC(NC(=O)NNC(=O)c2ccc(Br)cc2)CC1	1332477276	KYPBJNCTOHCYOF-UHFFFAOYSA-N	447.355	1.597	50	20	IDGD	
Cc1nc(N(C)C)sc1C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	1336820513	UMAWEBYGJPJXMV-UHFFFAOYSA-N	438.579	1.211	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CS[C@@]2(c3ccc(F)cc3)CCC(=O)N12)c1n[nH]c2c1CCCC2	1337156127	QZRFZTFTJIOJLX-HRAATJIYSA-N	443.504	1.779	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4c(c3)NC(=O)CO4)C2)C1	1778570591	CVDCGDFBYJCLJT-QVKFZJNVSA-N	435.908	1.869	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2nc3ncccn3n2)C1	1778584480	MJDGATCZFALSGA-JLTOFOAXSA-N	434.928	1.517	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cn1ccccc1=O)C2	1779543617	LWBMTWNNULJSDR-DYESRHJHSA-N	435.597	1.214	50	20	IDGD	
Cc1ccn(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@](C)(Cl)CCl)C2)n1	1780710465	WAEUHKUZUOTKBX-AYOQOUSVSA-N	431.364	1.942	50	20	IDGD	
CN(C)c1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)nc1	1781228609	VRXOMFVXGIQUIO-OALUTQOASA-N	429.348	1.827	50	20	IDGD	
O=C1Cc2cc(C(=O)N3CCO[C@]4(CCN(C(=O)[C@H](F)Br)C4)C3)ccc2N1	1781329508	GRHREKBAWGVNOY-YJBOKZPZSA-N	440.269	1.315	50	20	IDGD	
O=C(c1cccc2[nH]ncc12)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781331411	QCXLNPBZZYNTRP-PBHICJAKSA-N	425.258	1.697	50	20	IDGD	
O=C(c1cccn2nccc12)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781332001	CQNXQEBCULFUNN-PBHICJAKSA-N	425.258	1.468	50	20	IDGD	
C#CCO[C@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](Br)CC)C1	1781897102	AMKFGYRTXPNWSN-YYAJDYIMSA-N	429.355	1.712	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](Br)CC)C2)C1	1783354633	DHJQLDVIFBEKTI-IGCXYCKISA-N	435.315	1.551	50	20	IDGD	
COC(=O)C12CC(C(=O)N3CC[C@@]4(CN(C(=O)[C@H](C)CBr)CCO4)C3)(C1)C2	1783440208	AFXMAKAQXFYAOP-GPIZFROPSA-N	443.338	1.191	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)CCc3ccc(OC)cc3F)CCO2)C1	1783874512	ICCAGJUKAWATEJ-UWJYYQICSA-N	442.915	1.851	50	20	IDGD	
Cn1cnc(C(=O)N2CCO[C@]3(CCN(C(=O)C(Cl)Cl)C3)C2)c1C(F)(F)F	1783945661	QMLFEWZOWWQBHL-AWEZNQCLSA-N	429.226	1.686	50	20	IDGD	
O=C(C(Cl)Cl)N1CC[C@@]2(C1)CN(C(=O)[C@H]1C[C@@]13C(=O)Nc1ccccc13)CCO2	1783950052	KDOUIXXWGOCUKC-GBLZOACLSA-N	438.311	1.530	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ncc(Cl)cn3)C[C@@H]21	1783968630	DEGGXAQQTPTCDS-XWUBHJNHSA-N	445.745	1.754	50	20	IDGD	
Cc1cnn([C@@H](C)C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]3C2)c1	1783973546	BVRBLURKTBMZTC-WOYTXXSLSA-N	441.370	1.763	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ncccc3-c3ccccc3)C[C@@H]21)[C@H](O)CCl	1784090718	LOJCTIPTEBPACO-FFGOWVMKSA-N	443.931	1.942	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(-c4cccnc4)cc3)C[C@@H]21)[C@H](O)CCl	1784092039	DOUPWQPLVLRFQV-BURNTYAHSA-N	443.931	1.942	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4sccc4c3O)C[C@@H]21)[C@H](O)CCl	1784092232	KZGFCJDIGRBSLG-KSYCFECVSA-N	438.933	1.800	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]3C2)cc1Cl	1784095469	IPONFMCRNDNJIW-LBEHMCEESA-N	431.316	1.542	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)c3ccccc3C3CC3)C2)C1	1784951537	FZSYAOZXHPEPCX-QHCPKHFHSA-N	428.533	1.381	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3ccnc(OC)c3)[C@H]2C1	1785104802	DAZLTFKZIVQSOZ-FJIDUMEYSA-N	439.940	1.256	50	20	IDGD	
Cc1cncc(CCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Br)C[C@@H]32)c1	1785288547	BBZRYCMHKGUMDV-OVWQWFNUSA-N	442.329	1.993	50	20	IDGD	
C/C(=C/C(=O)N1CC[C@@]2(C1)CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)CCO2)C(=O)O	1785416717	HNUOCBNPMOZQDZ-NOHVTVLTSA-N	445.422	1.733	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NC1(c2ccc(NC(=O)[C@H](O)CCl)cc2)CCC1	1786129294	KGCFWBZHXRHJIQ-QGZVFWFLSA-N	430.892	1.545	50	20	IDGD	
Nc1ncc(C(=O)Nc2ccc(C3(NC(=O)c4cccc(B(O)O)c4)CCC3)cc2)s1	1788097422	ZCKFKIVWBFXDCT-UHFFFAOYSA-N	436.302	1.467	50	20	IDGD	
CCOc1cnc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]3C2)cn1	1789922016	BGSVEFUFFJPKLO-TZQJONAQSA-N	445.289	1.159	50	20	IDGD	
CC(=O)O[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]2C1)C(C)C	1791055925	KSPRNEVPAZQCAB-DGVSKKNDSA-N	433.343	1.337	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3ccc(O)cn3)[C@H]2C1	1791711546	LSGVWRJFXCUDCI-KNPMLCFXSA-N	426.311	1.093	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CC1CCN(C)CC1)C2	1792866782	IJFONKQKOPXWIE-NYCLONFESA-N	430.387	1.339	50	20	IDGD	
Cc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)CBr)cc(O)n1	1792867903	KRRNSAUOIWFVDW-BWPSIRRCSA-N	426.311	1.330	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H]1C=C[C@@H](C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](O)CCl)C1	1793111027	XZWOIURDMXKSTF-VRXFMZDNSA-N	441.956	1.694	50	20	IDGD	
Cc1cccc(C)c1N1C[C@@H](C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](O)CCl)C3)CC1=O	1794130196	YJYPYBLGQYPPRT-QXCZDIPSSA-N	447.963	1.894	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)c1ccc2c(c1)C(=O)CC2	1796189345	AWDKISOANOAOSV-ACDBMABISA-N	432.285	1.061	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)c1cccc2ccncc12	1796192969	FWCFEHPUDHTJKU-ACDBMABISA-N	429.285	1.480	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1[nH]nc2ccncc12	1796213243	SJRFYDQPWXFITM-MSNRECKUSA-N	426.304	1.397	50	20	IDGD	
Cc1ccn2ncc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)CCBr)C4)c2c1	1796270956	AUMVWAMOFXRBGX-ZSBFGKGUSA-N	435.322	1.631	50	20	IDGD	
CC(C)(C)OC(=O)N1C(=O)CC[C@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Cl	1796368106	CJRXVDUDYLUSJX-XXUMUBMXSA-N	447.891	1.037	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(OC)ccn1	1798108867	LQBNXRZWQISKBW-FAXLKDOZSA-N	426.311	1.467	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CNC(=O)c1cc(C)on1	1798511117	GBLQVHZVONXJSR-CRWXNKLISA-N	441.326	1.525	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc([N+](=O)[O-])cc2c1OCC2	1798520555	YWRNNAAVEIHMEU-RMHZUWNSSA-N	437.880	1.750	50	20	IDGD	
O=C(/C=C/C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Br)c1cccs1	1799347347	NKUPPMJZNIREOG-YDMSQTBBSA-N	445.310	1.767	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(Cl)c(O)cc1O)C2	1800760018	XTSFOGZPVQRNHH-KFRQHLNQSA-N	447.713	1.738	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(C#N)cc1Cl)C2	1800977006	FOPJJIWCXIUDNC-RMHZUWNSSA-N	426.300	1.669	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Sc1ccccn1)C2	1800980929	HMUZDXUSYDFIPR-LFYQSXPISA-N	427.954	1.406	50	20	IDGD	
Cc1ncc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)CBr)C3)s1	1801329630	WRCOXPPJBPZOFJ-VFFTVRQLSA-N	430.368	1.615	50	20	IDGD	
CC[C@@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CNC(=O)c1cccnc1)C2	1801797775	CNKTYAFKVUKPTM-QKPAOTATSA-N	437.338	1.623	50	20	IDGD	
CN(CCCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2)C(=O)OC(C)(C)C	1802132517	AHYAZMSYSVXXEM-OCVGTWLNSA-N	435.924	1.758	50	20	IDGD	
Cc1nc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CCC(=O)NN(C)C)c(C(F)(F)F)o1	1802333239	QKKZXRYVFYIGEH-CLLJXQQHSA-N	445.442	1.627	50	20	IDGD	
CCSc1cccnc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCC(=O)NN(C)C	1802337115	RQHVFUBTBWIEQA-MUJYYYPQSA-N	433.578	1.818	50	20	IDGD	
O=C([C@H]1CC(=O)N(C2CCCC2)C1)N1CCCC2(CCN(C(=O)[C@@H](O)CCl)CC2)C1	1806604158	MRQSKSPVSGJKPT-WMZOPIPTSA-N	439.984	1.608	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)c1n[nH]c2c1CCCC2	1808041060	RAAZHULQAYNJJP-FNHZYXHNSA-N	431.924	1.603	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)[C@@H](N)Cc2cccnc2)[C@H]1c1cccnc1	1808362592	GXIYUBOCCODDLO-LWYYNNOASA-N	445.951	1.306	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)[C@H](C)N2C[C@H]3C[C@H]3C2)[C@@H]1c1cccnc1	1810162860	PXMXMEPETMXLGR-LBCBGTHCSA-N	434.968	1.681	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@H]1c1cccnc1	1810527281	BHHDSTWEVOHQIE-SHPPOPEUSA-N	441.301	1.469	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC2(CCCN(C(=O)c3cnc(O)nc3O)C2)CC1	1810861090	IMNLIWWZWFKAIK-GFCCVEGCSA-N	441.326	1.764	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)[C@H](C)n2cncn2)[C@@H]1c1cccnc1	1812866945	BDIWMGCINGOHKZ-DARAHFNDSA-N	435.326	1.724	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)[C@@H]2CC=CCC2)[C@H]1c1cccnc1	1813068404	MJXGRSSFJUYNMK-LZNRXBQRSA-N	427.549	1.817	50	20	IDGD	
CC(C)[C@H](S)C(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1813069090	UZCXVONTEVTVMF-DBVUQKKJSA-N	435.594	1.415	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)C1CC(F)(F)C1)CC2)c1ccc(B(O)O)cc1	1815336056	ZBRQSBQFDNOAMM-ZDUSSCGKSA-N	435.261	1.094	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)CSc3ncccn3)sc2C1	1815635976	ZUKWDBPFEWJSSR-QWRGUYRKSA-N	441.966	1.891	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1ccc(F)cn1	1816587469	IOHXGTYNMMEJNU-SFHVURJKSA-N	437.240	1.243	50	20	IDGD	
COc1nccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)[C@H](O)CCl)[nH]n2)c1F	1817664103	GOFIGJCKZWQKSF-QWHCGFSZSA-N	425.848	1.858	50	20	IDGD	
Cn1cc(F)cc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1818385147	NTIQSXGNUGYUCA-QGZVFWFLSA-N	439.256	1.187	50	20	IDGD	
O=C(N[C@H]1CCc2nc(NC(=O)C3(F)CCCCC3)sc2C1)c1ccc(B(O)O)cc1	1818743182	BIVUEGFYRIWSLB-HNNXBMFYSA-N	445.325	1.721	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)C3(C(F)(F)F)CC3)sc2C1	1818849617	KRPLSPQMKBHDSD-JTQLQIEISA-N	447.483	1.771	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](C)Br)[nH]n1	1819355684	WCSDFHNJNUSIBV-DMDPSCGWSA-N	443.346	1.893	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@H](F)Br)[nH]n1)c1cc(CO)on1	1820350453	JNKDDDPVJZLFLH-YPMHNXCESA-N	430.234	1.886	50	20	IDGD	
Cn1ccc(=O)cc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CO[Si](C)(C)C)CC2	1821311673	MPZAHWYRXMVRQB-LBPRGKRZSA-N	434.594	1.919	50	20	IDGD	
C=CCC(F)(F)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1821985059	AUTXLFAAKFQPGM-INIZCTEOSA-N	432.236	1.607	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CC[C@@H](N)C(N)=O)[nH]n1	1822088402	UPOCINVNOHUFEG-DMDPSCGWSA-N	443.346	1.168	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1cc([C@H]2CCCCN2C(=O)Cn2ccncc2=O)[nH]n1	1822188715	NBBLWUDEKYUUCX-DGCLKSJQSA-N	437.298	1.442	50	20	IDGD	
Cc1cc(CC(=O)N2CCCC[C@@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)n[nH]1	1822415407	ZEOVZLXWPAPJLM-MRXNPFEDSA-N	430.513	1.049	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CNC(=O)C(F)(F)F)n[nH]1	1822444187	KVIHDLUVPXLKHN-ONGXEEELSA-N	439.822	1.334	50	20	IDGD	
Cn1c(C(=O)N[C@@H]2CCc3nc(NC(=O)[C@@H](F)Br)sc3C2)cccc1=O	1823001331	CUKHVAJBMAKUQM-AMIZOPFISA-N	443.298	1.758	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](C)n3ccnn3)sc2C1	1824680515	ZNCIGPYSHSHODB-MXWKQRLJSA-N	441.355	1.939	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)CCBr)CC1	1826360572	OTVMAVZSJIVXMP-INIZCTEOSA-N	445.402	1.764	50	20	IDGD	
CN1CCN(CC(=O)N2CCCC[C@@H]2C2CCN(C(=O)[C@H](F)Br)CC2)CC1	1828442342	JUFGQIPPYVUUQZ-AEFFLSMTSA-N	447.393	1.544	50	20	IDGD	
O=C([C@H](O)CCl)N1CCC([C@H]2CCCCN2C(=O)c2nn[nH]c2C(F)(F)F)CC1	1829790920	YAPSWJLDUYRGDS-VXGBXAGGSA-N	437.850	1.657	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3c[nH]c4ncccc34)C2)C1	1830362198	NTFHKFFXUFTYHM-OAQYLSRUSA-N	434.924	1.898	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H]2[C@H]3SC=C[C@H]32)CC1	1831159173	HQGGPUQKGGUSFC-PZBISTMVSA-N	434.606	1.854	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H](O)CCl)CC1	1831578706	SBRYIFHBKNXPQW-HZPDHXFCSA-N	431.961	1.731	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccnc3S)C2)C1	1831638661	GBMDGGFDBIVFCQ-BEFAXECRSA-N	427.954	1.848	50	20	IDGD	
COc1nccnc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1	1831871384	CJMZWIBCRYUSQD-KRWDZBQOSA-N	446.552	1.092	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3ccccn3)CCO2)C1	1833190551	NHARPXKSFMTHGG-BEFAXECRSA-N	440.338	1.254	50	20	IDGD	
CO[C@@H](C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)CCl)CC2)CC1)c1ccccc1	1833309011	IVMHEALCWNWYAA-WOJBJXKFSA-N	437.968	1.545	50	20	IDGD	
COc1ccc(F)cc1C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)CCl)CC2)CC1	1833312750	BBSFZBWWJOKWKF-GOSISDBHSA-N	441.931	1.619	50	20	IDGD	
CCc1ncccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)CCBr)C2)C1	1833514517	OKZHARVQFBJAFD-LJQANCHMSA-N	440.338	1.499	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)Cn3ccc(C)n3)CC2)CC1	1833855494	RPOAPCUMLGLVTM-SFHVURJKSA-N	425.961	1.017	50	20	IDGD	
Cc1ncccc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1	1834039665	JQFAVPFRKAIBNK-RBUKOAKNSA-N	430.332	1.696	50	20	IDGD	
CC[C@@H](C)[C@H](O)C(=O)N1CCC(N2CCC(NC(=O)CCBr)CC2)CC1	1834422314	GKECPUAKRGSIMM-KDOFPFPSSA-N	432.403	1.750	50	20	IDGD	
Cc1nnc(CC(=O)NC2CCN(C3CCN(C(=O)C(C)(C)CCl)CC3)CC2)o1	1834831353	QRFMNUWSWAHSIH-UHFFFAOYSA-N	425.961	1.757	50	20	IDGD	
O=C(COCc1ccccc1)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1835370235	NEYDYKVQPZIJOA-IBGZPJMESA-N	431.316	1.463	50	20	IDGD	
CC(C)N[C@@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1)C(C)C	1835893058	PQLXNWHKDCHMDE-UTKZUKDTSA-N	432.005	1.730	50	20	IDGD	
Cn1nncc1C(=O)N1CCC(OC2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1837231495	RHDDLYULIQLMKY-CQSZACIVSA-N	432.294	1.118	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3oc(C)nc3C)CCO2)C1	1838007522	GRGSFIAPJXHLEM-KDOFPFPSSA-N	444.326	1.535	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(N(C)C)cc3)CCO2)C1	1838964305	YRXKZEVSQYVFRZ-NQIIRXRSSA-N	439.940	1.076	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(O)ccc3O)C2)C1	1839154244	IEXGALUDQOJDJQ-RBUKOAKNSA-N	447.315	1.404	50	20	IDGD	
O=C(c1ccc(O)cc1F)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839201742	HZISFEJJQVIXPZ-PBHICJAKSA-N	449.248	1.292	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc4cccnn4c3)CCO2)C1	1839559512	LZVQIDDATASGHF-GHTZIAJQSA-N	434.924	1.812	50	20	IDGD	
C[C@H](CC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1)Oc1ccccc1	1839746976	GBWVJVIVKRDVEL-BPAFIMBUSA-N	428.888	1.835	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)c(O)c1	1840036887	RVEJBKYUQWBWMC-KUHUBIRLSA-N	441.322	1.554	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](CC(=O)N1CCCC12CN(C(=O)[C@H](O)CCl)C2)C1CC1	1841409920	WEPXXMUOUYNRBC-HUUCEWRRSA-N	429.945	1.483	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)CC[C@@H]2CNc3ccccc3C2)C1	1842955245	NVJSYJJYVNFGKM-SFHVURJKSA-N	447.344	1.248	50	20	IDGD	
CC1(C)CCc2cccc(C(=O)N3CCCC34CN(C(=O)c3ccc(B(O)O)cc3)C4)c2O1	1843298437	AQCUFWFLMYFWBP-UHFFFAOYSA-N	448.328	1.601	50	20	IDGD	
C[C@H](Br)C(=O)N1CC2(CCCN2C(=O)c2ccccc2C(=O)OCCO)C1	1844719786	DGGIVAHRDHFMRJ-ZDUSSCGKSA-N	439.306	1.436	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)c2ccnc3c(O)cccc23)C1	1845703630	UQIBGFSNGOENEG-UHFFFAOYSA-N	425.489	1.130	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC12CN(C(=O)[C@@H]1CC(=O)N(C3CCCC3)C1)C2	1846175812	UDZDBJUCBYFHKD-ZIAGYGMSSA-N	426.355	1.764	50	20	IDGD	
CC(C)c1nn2ccccc2c1C(=O)N1CC2(CCCN2C(=O)CCC(=O)NN(C)C)C1	1846384506	AQYXSSRZAMJKMS-UHFFFAOYSA-N	440.548	1.648	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cccc2c1NC(=O)C2=O	1847501500	RBKMULVAULIDGL-BPNCWPANSA-N	434.290	1.668	50	20	IDGD	
O=C(c1ncn(-c2cccc(F)c2)n1)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](F)Br	1848311281	MYLBMLKUMLDIBX-IHRRRGAJSA-N	440.248	1.912	50	20	IDGD	
Cn1c(SCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)nnc1-c1cccs1	10710258	WTTOTIOEHKFUFZ-CYBMUJFWSA-N	431.499	1.623	50	20	IDGD	
CCCn1nc(C(=O)NNS(=O)(=O)c2cc([N+](=O)[O-])ccc2C)c2ccccc2c1=O	16095538	IFPSJGRBRALYPZ-UHFFFAOYSA-N	445.457	1.646	50	20	IDGD	
CON(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)c2cc(-c3ccccc3)on2)cc1	28793426	QNKCRTQPKOADMK-UHFFFAOYSA-N	430.442	1.598	50	20	IDGD	
CCc1ccc(N2C[C@@H](C(=O)OCC(=O)NNC(=O)Cc3nc(C)cs3)CC2=O)cc1	105214567	LQUIFLGQTQJDGY-HNNXBMFYSA-N	444.513	1.300	50	20	IDGD	
Cc1ccc(S(=O)(=O)NC[C@H]2CCCN(CC(=O)NNC(=O)c3ccccc3)C2)cc1	725811904	JNJXRVDFUCYNJX-GOSISDBHSA-N	444.557	1.447	50	20	IDGD	
O=C(COC(=O)c1cc([N+](=O)[O-])cc2c1OCCO2)NNC(=O)c1ccc(Cl)cc1	727566616	FYBRIGYTADIDCO-UHFFFAOYSA-N	435.776	1.637	50	20	IDGD	
O=C(CCCc1ccccc1)NNC(=O)CCNS(=O)(=O)c1cccc([N+](=O)[O-])c1	727740660	GYBKUVHRFQLTBG-UHFFFAOYSA-N	434.474	1.434	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(/C#N)C(=O)NCCCN2CCC[C@@H](C(N)=O)C2)c1C	728077402	IQABOSSMGNSPHR-JGIOMMJSSA-N	429.565	1.923	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)c1	728213367	YYXXQBABHFXXKY-KRWDZBQOSA-N	432.546	1.842	50	20	IDGD	
O=C(NCc1ccc(OCCOc2ccc(Cl)cc2)cc1)NNC(=O)C(=O)NC1CC1	728218477	CRBKOBROVPIFEP-UHFFFAOYSA-N	446.891	1.907	50	20	IDGD	
CCOc1ccccc1[C@@H](CC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)NC(C)=O	728264172	AZPOSONOQNRJAA-GOSISDBHSA-N	437.460	1.090	50	20	IDGD	
O=C1CCc2cc(S(=O)(=O)NNC(=O)c3cccc(OC(F)F)c3)c(F)cc2N1	728510401	IPZPMYWNNHZXPG-UHFFFAOYSA-N	429.376	1.935	50	20	IDGD	
C=CCNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cccc(OC(F)F)c2)cc1	728546017	XGSTUUFPOTVIGA-UHFFFAOYSA-N	425.413	1.827	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)c2ccc3c(c2)C[C@@H](C)N3S(C)(=O)=O)cn1	729693296	RUUZNOMIICBRBP-LLVKDONJSA-N	435.531	1.432	50	20	IDGD	
Cc1ccc(NNC(=O)NCCCCCC(=O)N2CCN(C(=O)CC(C)C)CC2)nn1	730025988	WEHBPQXCJOPHGL-UHFFFAOYSA-N	433.557	1.688	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)Cc1csc(NC(=O)c2ccccc2)n1	730778674	STCUQBUSBBFEGX-UHFFFAOYSA-N	426.454	1.870	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)Nc1cccc(OCC(=O)N2CCCC2)c1	730896998	HRLSYJPFBZMLCX-UHFFFAOYSA-N	428.445	1.625	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)c1ccc(OC)c(S(=O)(=O)N2CCCC2)c1	731491770	VOWHDEUMSVEBBS-UHFFFAOYSA-N	433.486	1.563	50	20	IDGD	
O=C(CCNC(=O)N1CCc2ccccc2C1)NNC(=O)c1nnc(O)c2ccccc12	732257034	BYFYCUVPFVPRLJ-UHFFFAOYSA-N	434.456	1.254	50	20	IDGD	
COc1ccc([C@@H]2[C@H](C(=O)NNC(=O)CNC(=O)c3cccs3)CCC(=O)N2C)cc1	734321511	IKADREZDARAQOA-DNVCBOLYSA-N	444.513	1.244	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cc(O)nc3ccc(F)cc23)cc1	737767143	RCJAWDXAJFZRLS-UHFFFAOYSA-N	446.460	1.470	50	20	IDGD	
CC(C)[C@H](C(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)N1C[C@@H](C)O[C@H](C)C1	741018871	CZBOMKFPTJSWDF-HBUWYVDXSA-N	436.465	1.033	50	20	IDGD	
O=C(CNC(=O)NCc1ccc([N+](=O)[O-])cc1)NNC(=O)C(F)(F)Oc1ccccc1	741709217	CPVIBYOITYJMMV-UHFFFAOYSA-N	437.359	1.213	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(N3CC=CC3)cc2)cc1OC	741742829	FWIYCMLFTUEEGK-UHFFFAOYSA-N	425.441	1.698	50	20	IDGD	
CC(C)(C)OC(=O)N(CC(=O)NNC(=O)COc1ccc(F)cc1)C[C@H]1CCCO1	742035022	VSGFBZDSHKQBQF-MRXNPFEDSA-N	425.457	1.768	50	20	IDGD	
Cc1ccccc1-n1c(SCC(=O)NNC(=O)C(C)(C)C)nnc1N1CCOCC1	742451592	UYJTWFORYBTHTC-UHFFFAOYSA-N	432.550	1.698	50	20	IDGD	
C[C@H]1CN(CC(=O)NNC(=O)c2ccccc2)CCN1C(=O)Cc1cccc(Cl)c1	744419088	LPTJWMJXUUKHOT-INIZCTEOSA-N	428.920	1.876	50	20	IDGD	
CCS(=O)(=O)NCc1ccc(C(=O)OCC(=O)NNC(=O)c2cccc(C)c2)cc1	745141331	QHQPBCGBWUXXQS-UHFFFAOYSA-N	433.486	1.052	50	20	IDGD	
Cc1cc(C)nc(-n2nc(C)c(CC(=O)NNC(=O)Cc3cn4ccccc4n3)c2C)n1	746556440	WGHHVVIKCBLDTN-UHFFFAOYSA-N	432.488	1.476	50	20	IDGD	
CN(Cc1ccccc1Br)C(=O)CCNC(=O)NNC(=O)Cc1ccncc1	747581298	MUCYABQMKLLJDL-UHFFFAOYSA-N	448.321	1.766	50	20	IDGD	
NC(=O)[C@H]1CN(C(=O)C(=O)Nc2ccccc2S[C@H](Cl)C(F)(F)F)CCO1	748001592	MOQUFHHSZUWTSX-OTYXRUKQSA-N	425.816	1.557	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)c1cc(S(=O)(=O)N2CCC2)ccc1Cl	748691229	LUIJLMZSFZOCDD-UHFFFAOYSA-N	441.868	1.714	50	20	IDGD	
C[C@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1)c1cnn(C)c1	749865129	XKLJOJJTSYHBQE-HNNXBMFYSA-N	441.513	1.463	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)c1nnn(-c2ccccc2F)c1C(F)(F)F	751199661	PECBRSUDLRKXIK-UHFFFAOYSA-N	440.313	1.209	50	20	IDGD	
Cc1cc(S(N)(=O)=O)cc(C(=O)NNC(=O)c2cc(Br)ccc2O)c1C	752623268	ABONLIANSPXWQX-UHFFFAOYSA-N	442.291	1.494	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NN=Cc1ccc(O)c(F)c1	755490728	QAMDWKICLPFGIX-UHFFFAOYSA-N	435.477	1.635	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)Nc1ccc(OCC(F)(F)F)nc1	755873572	WGCPMGIUHADVSX-UHFFFAOYSA-N	439.398	1.882	50	20	IDGD	
COCCS(=O)(=O)c1ccc(NC(=O)NNC(=O)Cn2ccc3ccccc32)cc1	756551861	LFDRLJNTTPTCLS-UHFFFAOYSA-N	430.486	1.914	50	20	IDGD	
COCCNC(=O)Cn1cc(NC(=O)NNC(=O)c2cc3c(s2)CC[C@@H](C)C3)cn1	756836437	AMFZWQVZBXXSPJ-GFCCVEGCSA-N	434.522	1.299	50	20	IDGD	
Cc1c(C(=O)NNC(=O)Cc2nc3ccccc3n2C)cnn1CCO[C@H]1CCCCO1	758078148	IQVOTPVPCZPDGX-NRFANRHFSA-N	440.504	1.625	50	20	IDGD	
C[C@@H](Oc1ccc(F)c(F)c1)C(=O)N1CCN(S(=O)(=O)CBr)CC1	758522407	HKXVUSPQAXAXHH-SNVBAGLBSA-N	427.267	1.559	50	20	IDGD	
O=C(c1cc(Br)cs1)N1CCN(S(=O)(=O)CBr)CC1	758535482	OVYUPRCXZUCRBV-UHFFFAOYSA-N	432.159	1.951	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccccn2)ccc1NS(=O)(=O)C(F)(F)F	758826883	HMCAVRHDIBKRIJ-UHFFFAOYSA-N	445.379	1.051	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1Br)C(=O)NNC(=O)C(=O)Nc1ccccn1	758837422	BFVZKSHEDOLRLA-VIFPVBQESA-N	425.214	1.537	50	20	IDGD	
CC1(Cn2cc(C(=O)NNC(=O)c3ccc(Br)cc3Cl)nn2)COC1	759068394	HREZMMQDDCOQEF-UHFFFAOYSA-N	428.674	1.805	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)[C@@H]2CCCN2C(=O)OC(C)(C)C)n1	759710479	SXXWBERCETYRAH-LBPRGKRZSA-N	426.495	1.084	50	20	IDGD	
Cc1ccnc(-n2nccc2NC(=O)C(=O)NNC(=O)c2ccc(Br)s2)c1	760277812	SQUKTJDPMDOQSR-UHFFFAOYSA-N	449.290	1.799	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2c(C)cc(Cl)cc2[N+](=O)[O-])n1	760777925	IFSYJGYUVDYYNR-UHFFFAOYSA-N	426.838	1.868	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)NCc1ccc(N2CCO[C@H](C)C2)nc1	761659516	NHNWDPPKBMVQIY-OAHLLOKOSA-N	445.545	1.938	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	763392899	VYDOZZDKFYOYAI-INIZCTEOSA-N	449.508	1.643	50	20	IDGD	
COC(=O)c1c(F)ccc(S(=O)(=O)NNC(=O)CSc2ccccc2O)c1F	763409497	IDQFHIYNRVZSFK-UHFFFAOYSA-N	432.426	1.559	50	20	IDGD	
Cc1c(C(=O)O)cc(Cl)cc1S(=O)(=O)NNC(=O)[C@H]1COc2ccccc2O1	763417528	XSRFNEJEECVDMC-CQSZACIVSA-N	426.834	1.496	50	20	IDGD	
Cn1ccnc1Sc1ccc(NC(=O)C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1	763446393	SGVOGZFZXBPAKU-UHFFFAOYSA-N	440.441	1.879	50	20	IDGD	
CCN(c1ccc(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1)C(C)C	763572185	PWPRQVUCUOGZFX-LJQANCHMSA-N	426.473	1.847	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1OCC(F)F	763573371	ZSJXBYMIHHHPSK-MRXNPFEDSA-N	435.383	1.565	50	20	IDGD	
Cc1ccnc(-c2ccc(NC(=O)C(=O)NNC(=O)c3c(C)nc4ccccn34)cc2)n1	763630073	WDGYWJMQJXIJEJ-UHFFFAOYSA-N	429.440	1.808	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(NC(=O)c3ccoc3)c2)cc1	763674172	MXVJMNNUTJLZJH-UHFFFAOYSA-N	447.407	1.568	50	20	IDGD	
O=C(NNC(=O)c1cc2c(s1)CCC2)C(=O)Nc1cc(F)cc(N2CCOCC2)c1	763782409	UAVWKGNVNQKPEO-UHFFFAOYSA-N	432.477	1.612	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccn(-c3ccncc3)n2)cc1	763866317	OQXOCHBBDQOTFG-AWEZNQCLSA-N	438.444	1.219	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)C(=O)Nc1cccc(C#N)c1	763881576	GEVJFJDJSYUEGC-NSHDSACASA-N	431.246	1.874	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2cc(Cl)ccc2N2CCCCC2)n1	763883117	XZECAPNJYWESPR-UHFFFAOYSA-N	432.912	1.930	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CC(C)C)cc1S(=O)(=O)N1CCCCCC1	763888117	GDPQEZPTRIKWRI-UHFFFAOYSA-N	438.550	1.692	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)Cc2ccc(Cl)cc2)ccc1N1CCOCC1	763937098	WNIJTFOCDJYEIV-UHFFFAOYSA-N	430.892	1.814	50	20	IDGD	
C[S@@](=O)Cc1ccccc1NC(=O)C(=O)NNC(=O)c1ccc(Br)s1	763938392	DXWYNMPLXMEJGZ-RUZDIDTESA-N	444.332	1.789	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)C(=O)Nc1cccc(C(=O)Nc2ccc(Cl)cn2)c1	763998449	INXZBBSMEKCWJM-UHFFFAOYSA-N	440.847	1.726	50	20	IDGD	
CCCCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2OC)cc1	764048755	UDEUVTDVJHLPSV-UHFFFAOYSA-N	448.501	1.637	50	20	IDGD	
COC(=O)c1cc(C)ccc1NC(=O)C(=O)NNC(=O)c1cccc(Br)c1	764063511	QDEMRRGLAQGGTG-UHFFFAOYSA-N	434.246	1.944	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)ccc1C(F)(F)F	764078330	QVOZKEJFFHUAPO-UHFFFAOYSA-N	443.403	1.817	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2cccc(CN3CCOC3=O)c2)cc1	764128099	ZFWSVBCKXGYIKM-UHFFFAOYSA-N	440.456	1.366	50	20	IDGD	
CCN1CCC(n2nccc2NC(=O)C(=O)NNC(=O)CCc2ccc(OC)cc2)CC1	764132435	VIIDWRDWXRQPGB-UHFFFAOYSA-N	442.520	1.267	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(F)c2C(=O)OC)o1	764139077	NPWIZFZDZUISOD-UHFFFAOYSA-N	434.424	1.447	50	20	IDGD	
Cc1n[nH]c(C)c1[C@H](C)CC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	764140737	XEFGOGSJKKYIRU-CQSZACIVSA-N	434.566	1.600	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CC2CC2)cc1S(=O)(=O)N1CCCCCC1	764142776	KIAFIEOSSYKYRK-UHFFFAOYSA-N	436.534	1.446	50	20	IDGD	
CCC(=O)Nc1ccc(Cl)c(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)c1	764155053	VZUKWWPBPYGULR-INIZCTEOSA-N	430.848	1.778	50	20	IDGD	
O=C(CCc1ccco1)NNC(=O)C(=O)Nc1ccc(CN2C(=O)CCCC2=O)cc1	764168847	HFWLBZJJTWWZIT-UHFFFAOYSA-N	426.429	1.037	50	20	IDGD	
COc1ccc(-c2cc(NC(=O)C(=O)NNC(=O)CN(C)C)ccc2OC(F)F)cc1	764210373	BWOJPZODIIOKQZ-UHFFFAOYSA-N	436.415	1.611	50	20	IDGD	
CN(C)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)cc1Cl	764239997	XECGKENOQOWERH-UHFFFAOYSA-N	441.875	1.783	50	20	IDGD	
CC(C)NC(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)Cc2ccccc2F)c1	764320184	WHSITYGWJWBPOP-UHFFFAOYSA-N	434.855	1.946	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)C(=O)Nc1ccc(Cl)cc1C(=O)N1CCCC1	764352953	FTQSPNPCGWQSKQ-UHFFFAOYSA-N	429.864	1.300	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1ccn(-c2ccccc2)n1	764393469	OHOTVXMMPADYMO-UHFFFAOYSA-N	425.470	1.759	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1ccccc1Nc1ccc(F)cc1F	764399587	KOPDJZOANOJHLA-GFCCVEGCSA-N	436.415	1.846	50	20	IDGD	
COc1ccc(C(C)=NNC(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)c2ccccc12	764817071	MZEDYDHNWYTKKA-UHFFFAOYSA-N	434.456	1.136	50	20	IDGD	
CCS(=O)(=O)Nc1ccccc1C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C	765310488	HTLLKUJOKJTUIQ-UHFFFAOYSA-N	428.511	1.514	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cncn3-c3ccccc3)CC2)cc1	766647321	DKCKTKHADOKIMR-UHFFFAOYSA-N	432.528	1.760	50	20	IDGD	
C[C@](O)(Cc1ccccc1)C(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	766664762	SHJYJLALTDROJP-QHCPKHFHSA-N	444.963	1.599	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(Br)c(C(=O)N2CC=C(C#N)CC2)c1	767156103	FIJYQJVBTGYTQE-UHFFFAOYSA-N	428.308	1.670	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)C(=O)Nc2cnc(Cl)c(Br)c2)c1	768237282	JEEBJZOQQMPHPB-UHFFFAOYSA-N	440.685	1.963	50	20	IDGD	
COCCOc1ccccc1N1CCN(CC(=O)NNC(=O)c2ccccc2Cl)CC1	768552090	PZDGOECHGUQAIQ-UHFFFAOYSA-N	446.935	1.948	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)CS[C@H](C)C(=O)Nc1cc(C)on1	768636334	RXVFVSPEMGCMNA-LLVKDONJSA-N	442.519	1.599	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)NCC[S@](=O)Cc3ccccc3)nc21	770402546	YOGRKLJMJLIQLD-PMERELPUSA-N	431.522	1.862	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)CSc1nc(O)cc(C(F)(F)F)c1C#N	771904290	RHNFAZDXYHETMQ-SECBINFHSA-N	448.423	1.895	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NNC(=O)[C@H]2CC(=O)N(Cc3ccccc3)C2)C1	773422676	XNNNVLNHGKLEKN-MSOLQXFVSA-N	444.532	1.830	50	20	IDGD	
C#CCOc1ccccc1NC(=O)C(=O)NNC(=O)c1ccc(OC(C)C)c(OC)c1	773500719	WSEAHVSPEFMIEB-UHFFFAOYSA-N	425.441	1.894	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)C(=O)NCC2	774008045	DTUZSJYYLTUANM-NSHDSACASA-N	430.848	1.179	50	20	IDGD	
C[C@@H]1CN(CCOc2ccc(CCNC(=O)NNC(=O)c3cnn(C)c3)cc2)C[C@H]1C	774772903	OPMMLLAVNYRWPF-IAGOWNOFSA-N	428.537	1.573	50	20	IDGD	
C[C@@H](NCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)c1ccc(N2CCOC2=O)cc1	775262728	RMSRLIJUXCAPBX-CYBMUJFWSA-N	427.417	1.663	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)Nc3ccnn3[C@@H]3CCS(=O)(=O)C3)cc2C1	776053457	CRBSUIUZLCLOJA-WCQYABFASA-N	437.547	1.896	50	20	IDGD	
CCn1cc(-c2n[nH]cc2C(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)cn1	778859518	MKMQCHGTPJZBNH-UHFFFAOYSA-N	446.512	1.637	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C(=O)Nc2ccc(F)cc2Br)nc2ccccc21	782888418	XGTLCMSUCHCOTO-UHFFFAOYSA-N	448.252	1.804	50	20	IDGD	
CC[C@H](C)Sc1ccc(NC(=O)C(=O)NNC(=O)CNC(=O)c2ccco2)c(C)c1	784003821	BSRKJNYIMCPDBX-ZDUSSCGKSA-N	432.502	1.995	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)C(=O)Nc1ccccc1-n1cccn1	784207749	GLRNBQMHJTYZMY-UHFFFAOYSA-N	440.485	1.395	50	20	IDGD	
O=C(CN1CCCCCC1)Nc1ccc(NC(=O)C(=O)NNc2ncc(F)cn2)cc1	784955183	DODHVHDCOFRXJZ-UHFFFAOYSA-N	429.456	1.512	50	20	IDGD	
COc1cc(C#N)ccc1NC(=O)C(=O)NNc1c(F)cc(C(=O)NC2CC2)cc1F	785099775	KIZREOFZKCDZMY-UHFFFAOYSA-N	429.383	1.819	50	20	IDGD	
N#C/C(=C\C1CC1)C(=O)OCC(=O)N1CCN(S(=O)(=O)c2c(F)cccc2F)CC1	786679124	KBNAIJVGOQUMQI-GXDHUFHOSA-N	439.440	1.201	50	20	IDGD	
CC(C)CN(C(=O)COC(=O)/C(C#N)=C\C1CC1)c1c(O)nc(=O)n(CC(C)C)c1N	786681392	USIPBHXUJAUTBI-CHHVJCJISA-N	431.493	1.579	50	20	IDGD	
CS(=O)(=O)c1cc(NC(=O)C(=O)NNc2ncnc3ccsc23)ccc1Cl	788336785	DQKNUPPTVICXPQ-UHFFFAOYSA-N	425.879	1.830	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)[C@H]1CCC(=O)c2cccn21	788763822	ZHAMPOBFJGXZBK-LJQANCHMSA-N	443.935	1.624	50	20	IDGD	
O=C(CSc1nnc(O)nc1O)NN=Cc1cccc(I)c1	788976521	ZZBXQUDIDAHEEV-UHFFFAOYSA-N	431.215	1.130	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)C(=O)Nc1nc2c(s1)CCC2	789731397	DSICEPRZSSMPPC-UHFFFAOYSA-N	439.291	1.559	50	20	IDGD	
Cc1nnc(-c2cccc(NC(=O)C(=O)NNC(=O)[C@H]3OCC[C@H]3c3ccccc3)c2)o1	789810964	AXNJLNBJJYSHCB-ROUUACIJSA-N	435.440	1.704	50	20	IDGD	
Cc1c(C(=O)NNC(=O)Cc2nc3ccccc3n2C)nnn1Cc1ccc(F)cc1F	790118408	OSKNLKBHDDGQAY-UHFFFAOYSA-N	439.426	1.803	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc2c(c1)OCCCO2)NNc1cccc(F)c1[N+](=O)[O-]	791075185	CFHMLZCXWPQTLA-UHFFFAOYSA-N	440.409	1.317	50	20	IDGD	
CC(=O)c1cccc(S(=O)(=O)NCC(=O)NNC(=O)c2cc3ccccc3cc2O)c1	792516918	RBBCDNWRMGJQFB-UHFFFAOYSA-N	441.465	1.488	50	20	IDGD	
Cc1nc2ccc(C(=O)NNC(=O)c3cccc(S(=O)(=O)N4CCCC4)c3)cc2n1C	792772741	ARTZNVFQOZHZSK-UHFFFAOYSA-N	441.513	1.741	50	20	IDGD	
Cc1ccc([C@@]2(C)NC(=O)N(CC(=O)NNC(=O)CNc3ccc(C)cc3C)C2=O)cc1	793136260	UZDUGPIRUCLSLE-HSZRJFAPSA-N	437.500	1.638	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)c2cnn(CCO)c2-c2ccccc2)cc1	801318751	NTKKXYLBDAWTTN-UHFFFAOYSA-N	433.424	1.032	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@H]1CC(C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)=NO1	802428041	LPUBKLCFACGKMP-CYBMUJFWSA-N	444.448	1.009	50	20	IDGD	
CCOC(=O)c1c(NC(=O)NNc2ccc(-n3ccnc3)nn2)c(C#N)cn1CCOC	806419683	XQRHUEOHEUXVHR-UHFFFAOYSA-N	439.436	1.307	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2csc(-c3ccccc3)n2)c1	806976935	ZSBBJSGEVBEORR-UHFFFAOYSA-N	444.494	1.613	50	20	IDGD	
CC(C)(C)OC(=O)c1ccc(NC(=O)C(=O)NNc2ccc(-n3ccnc3)nn2)c(F)c1	807428359	BWQDVYSTPNVIOK-UHFFFAOYSA-N	441.423	1.839	50	20	IDGD	
COCCN1C(=O)CCc2cc(NC(=O)C(=O)NNc3ccc([N+](=O)[O-])cc3C)ccc21	807455996	RPBCQYUFMKLIBJ-UHFFFAOYSA-N	441.444	1.911	50	20	IDGD	
O=C(NC[C@@H]1CCCSC1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	807595492	VFDKZQHRKLEXNB-AWEZNQCLSA-N	426.564	1.558	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)OCc2nnc3n(C)c(=O)c4ccccc4n23)cc(C#N)n1C	809302450	AAAGVNAFDOQBHH-NVNXTCNLSA-N	427.424	1.750	50	20	IDGD	
COC(=O)c1cc(Br)cc(C(=O)NNC(=O)CCN2C[C@H](C)O[C@H](C)C2)c1	812451594	IOYAAKHICJOFKT-TXEJJXNPSA-N	442.310	1.496	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)COc1ccc(Cl)c(F)c1	814735625	CAPUIPZSDDNKJV-UHFFFAOYSA-N	428.873	1.921	50	20	IDGD	
N#Cc1cc(NC(=O)C(=O)NNc2ccc(-n3cccn3)nn2)ccc1Br	815590522	YVNWMCZSVCKDQA-UHFFFAOYSA-N	427.222	1.378	50	20	IDGD	
Cc1nc(-c2cccc(NC(=O)C(=O)NNC(=O)[C@@H]3CCc4nncn4C3)c2)cs1	815692723	ZJQKFQQHBJQPQT-CYBMUJFWSA-N	425.474	1.059	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2ncncc2F)c(C(=O)NCC(F)(F)F)cc1F	815766199	QMYJHQKOXHEEHV-UHFFFAOYSA-N	432.309	1.437	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)C(=O)Nc2cc(C(N)=O)ccc2C)c1	815866177	RJXAXAWBDGKZBT-UHFFFAOYSA-N	449.261	1.725	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NN=Cc1c(N2CCOCC2)nc2ccccn2c1=O	874082430	QFSDYJHQQDIMHP-OAHLLOKOSA-N	439.447	1.588	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)CNS(=O)(=O)c2ccc3ccccc3c2)cc1	913429767	ZHCJOOKZAHMOBW-UHFFFAOYSA-N	442.497	1.386	50	20	IDGD	
O=C(COC(=O)c1ccc(=O)n(-c2ccc(F)cc2)n1)NNC(=O)c1cccc(Cl)c1	915027138	XBKIRXRLVDMMCG-UHFFFAOYSA-N	444.806	1.643	50	20	IDGD	
CCCCOCCCNC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	915887907	BSKOKRQGAGXGFT-UHFFFAOYSA-N	426.539	1.622	50	20	IDGD	
CN(C)c1ccc([C@@H](CNC(=O)NNC(=O)C(=O)NC2CC2)c2c[nH]c3ccccc23)cc1	915889387	BKMUHPWIYFYDJS-LJQANCHMSA-N	448.527	1.975	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cnn1C(C)(C)C	916029988	LKTRDIRUTPINDI-UHFFFAOYSA-N	433.534	1.806	50	20	IDGD	
O=C(NCCCN1CCCCC1)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	916195734	GISNZZYDTJSHRJ-UHFFFAOYSA-N	437.566	1.291	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCCOc2ccc3c(c2)OCO3)c2ccccc2c1=O	916647144	MUSJDAOWDPXXCC-UHFFFAOYSA-N	439.428	1.168	50	20	IDGD	
CC(=O)Nc1ccc(S[C@H](C)C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1	917387892	PVHHVMWFMZWTTI-GFCCVEGCSA-N	439.497	1.834	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)CN(C)C(=O)c1ccc(Br)o1	917391712	DMMKXDZIOTZDAR-JTQLQIEISA-N	442.241	1.868	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NCCNC(=O)c2ccc(Br)cc2)cc1	918140829	BKNACDHSWUMVMU-UHFFFAOYSA-N	449.305	1.897	50	20	IDGD	
CS(=O)(=O)Nc1cccc2c1CCN(CC(=O)NNC(=O)c1cccc(Cl)c1)C2	918740609	SXXXKKOKRMHGKP-UHFFFAOYSA-N	436.921	1.531	50	20	IDGD	
C[C@H]1CN(Cc2ccc(C(=O)OCC(=O)NNC(=O)c3ccccc3)cc2)C[C@H](C)O1	919264186	IOXFYBWQMLPNDV-IRXDYDNUSA-N	425.485	1.914	50	20	IDGD	
CN(Cc1csc(Br)c1)C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	920049239	IQIQZPMBAHBPRJ-UHFFFAOYSA-N	436.295	1.973	50	20	IDGD	
O=[N+]([O-])c1cccc(S(=O)(=O)NCCNS(=O)(=O)c2ccc(CCCl)cc2)c1	921196986	WZAHMPLNDQTLFC-UHFFFAOYSA-N	447.922	1.633	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)cc(OC)c1OC	921273698	OJLARIYUHFUEGK-UHFFFAOYSA-N	441.400	1.881	50	20	IDGD	
CN1CCN(Cc2cccc(CNC(=O)NNC(=O)Cc3cn4ccccc4n3)c2)CC1	1252438702	QBGDZABZUNGDCD-UHFFFAOYSA-N	435.532	1.155	50	20	IDGD	
CN(C(=O)OC(C)(C)C)[C@@H](C(=O)NNC(=O)c1n[nH]c2c1CCCC2)c1cnn(C)c1	1257406155	YWJPMTVQMVULEQ-MRXNPFEDSA-N	431.497	1.391	50	20	IDGD	
Cc1ccn(-c2cccc(C(=O)NNC(=O)c3ccc(Cl)c(S(N)(=O)=O)c3)c2)n1	1318243478	YGFQKNKNCLJCOY-UHFFFAOYSA-N	433.877	1.556	50	20	IDGD	
NS(=O)(=O)c1cc(Cl)c(F)c(C(=O)NNC(=O)c2cncn2-c2ccccc2)c1	1319798462	KIJSQNBXHVJLTA-UHFFFAOYSA-N	437.840	1.387	50	20	IDGD	
Cn1ccc(NNC(=O)c2cc(S(=O)(=O)N3CCCC3)ccc2Br)n1	1320949694	WEOHXGIHKBFSDW-UHFFFAOYSA-N	428.312	1.724	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)c2ccccc2Cl)c(OC)c1	1324528124	LODYNJIQDBKPNQ-UHFFFAOYSA-N	447.922	1.734	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)NCc2cccc(OCC(F)(F)F)n2)nc2ccccc21	1324829503	WMCYUXUPIYBWQM-UHFFFAOYSA-N	436.394	1.983	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C=C/C1CC1)C2	1778091814	RQGCXJVSSOOTKK-QBNLMINVSA-N	441.532	1.601	50	20	IDGD	
CC(=O)O[C@@H](C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)Br)C2)C(C)C	1779210770	HHJOQTCCUSRIJQ-GKDNMFGBSA-N	447.370	1.871	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(CCN(C(=O)c3nc(O)n4c3CCCC4)C2)C1	1779348323	UWXVSYZVIAVYFH-FQEVSTJZSA-N	436.585	1.220	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CN1CCSCC1)C2	1779538981	SQVZQPWQILGWET-YLJYHZDGSA-N	443.686	1.401	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCc1cnc[nH]1)C2)[C@@H](F)Br	1780770931	LIHFYHOLCAVUMV-FRFSOERESA-N	431.306	1.547	50	20	IDGD	
O=C(c1cn2cc(F)ccc2n1)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781331424	KGTJRDJXTWTVDP-WMLDXEAASA-N	443.248	1.607	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)c(O)c1OC	1781829558	IUZPIOHXRMVQPW-GOSISDBHSA-N	433.288	1.657	50	20	IDGD	
Cc1cccn2ncc(C(=O)N3CC[C@@]4(C3)CN(C(=O)[C@@H](F)Br)CCO4)c12	1782522164	UUPODZOWAGSLOW-CRAIPNDOSA-N	439.285	1.777	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@@]2(C1)CN(C(=O)c1ncon1)CCO2	1782867946	WCJTZOXVFQKIBW-CDXDBMBRSA-N	429.383	1.398	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](C)Cn1ccnc1)CCO2	1783354916	YPGFMTBKMXWPOB-VKJFTORMSA-N	427.343	1.523	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc(F)cc3Cl)C[C@@H]21)[C@@H](O)CCl	1784085222	DHMSLHQHEDJWCV-CSFVBSKPSA-N	433.307	1.601	50	20	IDGD	
CSc1ccc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]3C2)cc1	1784095456	ILDDUUWYBBHIRL-OWLYRPNTSA-N	426.966	1.530	50	20	IDGD	
CC(C)n1nc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)C(Cl)Cl)C[C@@H]32)cc1C(=O)O	1785719791	HSFAJZILULSGIY-MJVIPROJSA-N	447.319	1.559	50	20	IDGD	
Nc1c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Cl)C[C@@H]32)sc2nccnc12	1786951484	FZJINWDEDBUAKQ-QSDJMHMYSA-N	427.889	1.401	50	20	IDGD	
CCCCC[C@@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1	1788609835	MJCOGTLZUKAMRE-LPWQTFTOSA-N	445.564	1.495	50	20	IDGD	
CCCNC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]2C1	1788762381	UIVYTPKDOSAVDR-ULQDDVLXSA-N	427.618	1.124	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]2C1)n1ccccc1=O	1789926376	VVQJLJGHQFJQSK-BLDNINTCSA-N	444.301	1.080	50	20	IDGD	
COC1(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)CBr)C[C@@H]32)CCC1	1791849692	ZQPBOKOCWYYJMT-UGUYLWEFSA-N	431.371	1.956	50	20	IDGD	
O=C(CCNC(=O)c1ccccc1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21	1792120863	UWMFITPMEKFZQR-OVWQWFNUSA-N	425.888	1.321	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN(C(=O)OC(C)(C)C)C1CC1	1792637556	VIJWVTJZXGNATN-KPEUIFRASA-N	443.972	1.993	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nccc3nc[nH]c13)C2	1792868072	OKJZKNALELTEPV-FMSGJZPZSA-N	436.310	1.192	50	20	IDGD	
Cc1onc(-c2ccccc2)c1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](O)CCl	1792975896	BZGONVMREBECMD-DFGXFYAUSA-N	433.892	1.453	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1C[C@@H]1c1ccc(F)c(F)c1	1793047733	CUXOYVZEVNNXFF-NWBCRBGPSA-N	442.890	1.912	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3cccnc3nc1O)C2	1793453277	DVNHPAUQMXTNOM-FSDCSDTHSA-N	432.908	1.946	50	20	IDGD	
C[C@H](S)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1793879282	VUCQNYAWSGMEJU-HPCHECBXSA-N	435.974	1.026	50	20	IDGD	
COc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCBr)c(O)c1	1795114894	JCPGPLGRXMCDEG-DPIQGUFMSA-N	427.295	1.389	50	20	IDGD	
O=C(COc1ccc(F)cc1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2	1795199095	XTYLWIAQACVNOD-IVWMJMPLSA-N	429.286	1.579	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1n[nH]c2c1CCCC2	1796161875	BUMYTQNWTYJAMG-JFILPPLUSA-N	439.354	1.523	50	20	IDGD	
O=C(C#Cc1ccc(Cl)cc1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1	1796188012	UHZDSVNDVKUUEY-WKCHPHFGSA-N	436.704	1.323	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@](C)(Cl)CCl)C2	1796892828	XLKSCCJVQXBNPU-ZGXUYQBDSA-N	442.347	1.995	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc2c(c1)CCN2C	1797547542	JTEBMWKWVIPOHZ-REPLKXPHSA-N	427.549	1.304	50	20	IDGD	
COc1nc(C)ccc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)CBr)C2	1798244848	QULAJJQXGCVUHY-OEYIWLLWSA-N	440.338	1.633	50	20	IDGD	
CCOc1ccsc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnccc1C(=O)NN	1798439882	KPTAKEVUIYAIBX-BTTYYORXSA-N	443.529	1.711	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@](C)(Cl)CCl	1799273527	JTGOJTCRIBKRRO-HJHSNUOESA-N	430.170	1.843	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3ncccn3n1)C2	1799277114	RYNLXWUJBGONDS-ABXQLRGKSA-N	426.304	1.169	50	20	IDGD	
COC(=O)[C@H]1CC[C@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Br)CC1	1799344782	VOLLINZORMHODV-SOAFEQHCSA-N	449.317	1.246	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1c(F)cccc1Cl)c1ccc(B(O)O)cc1	1799540341	RTUHZQPFULVNOV-MUJYYYPQSA-N	430.672	1.725	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1n[nH]c2cc(Cl)ccc12)[C@H](O)CCl	1799847520	ZCSPHLXFGYUORU-IPJQOSJUSA-N	425.316	1.997	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)COCCOCCOCCOC)C2	1800073838	AIUPSAOVCYDQPZ-XMTFNYHQSA-N	434.961	1.338	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](NC(C)=O)C(C)(C)C)C2	1800637590	DSBVBAUZSOZFHV-YIDVYQOGSA-N	446.386	1.300	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(F)cc([N+](=O)[O-])c1)C2	1800759739	FLIDPNUPEYLUHJ-ADGXKJENSA-N	444.257	1.721	50	20	IDGD	
O=C(CCBr)NC[C@@H]1CCN(C(=O)c2cccc(=O)n2O)[C@@H]1c1cccnc1	1806340015	XNBMNVPDGGSHLY-KBXCAEBGSA-N	449.305	1.585	50	20	IDGD	
CCS(=O)(=O)CC(=O)N1CC[C@H](CNC(=O)CCBr)[C@H]1c1cccnc1	1806342315	MIMLQTWFNKQIJP-RHSMWYFYSA-N	446.367	1.307	50	20	IDGD	
CCOCC(=O)NC[C@@H]1CCN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@@H]1c1cccnc1	1806502788	SAULLFQZRDQXKA-YVIKVBFHSA-N	440.504	1.258	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC2(CCCN(C(=O)c3cccc(=O)n3O)C2)CC1	1807558100	KIVZKUMMWWLRIU-ZDUSSCGKSA-N	426.311	1.714	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H](CNC(=O)[C@H](F)Cl)[C@@H]1c1cccnc1)[C@H]1SC(=N)NC1=O	1808313556	ZWEIQGZARGRXRO-BQQXIIOZSA-N	441.916	1.424	50	20	IDGD	
C[C@H](C(=O)NC[C@@H]1CCN(C(=O)[C@H](F)Cl)[C@@H]1c1cccnc1)[C@@H]1SC(=N)NC1=O	1808403494	WTYUBBAPJUEKLR-HNGSFYKJSA-N	441.916	1.424	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CN2CCOC2=O)[C@H]1c1cccnc1)[C@H](F)Br	1808649547	SYQHFQTVHNFDTB-QEJZJMRPSA-N	443.273	1.230	50	20	IDGD	
O=C(CCc1ccccc1)N1CCCC2(CCN(C(=O)c3ccc(B(O)O)cc3)CC2)C1	1809080993	ULMHFYCYTKPOIR-UHFFFAOYSA-N	434.345	1.844	50	20	IDGD	
C[C@@H]1CCC[C@@H]1C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1809656370	KAYCDVDRQJOYSK-JJJJLYANSA-N	435.333	1.517	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2cc(OC)n(C)n2)[C@@H]1c1cccnc1	1813033803	ZZNXHMPHGSUBDI-RVKKMQEKSA-N	435.912	1.397	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)Cc2ccncc2)[C@@H]1c1cccnc1	1813073290	OGOIQWXEXJPMQO-AUSIDOKSSA-N	438.532	1.098	50	20	IDGD	
O=C1Nc2c(cccc2C(=O)N2CCCC[C@@H]2c2cc(NC(=O)[C@@H](O)CCl)n[nH]2)C1=O	1814872305	GWJGTASMOFAKGC-KGLIPLIRSA-N	445.863	1.450	50	20	IDGD	
CC(C)C1(C(=O)N[C@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)CCC1	1815347878	VHNAFBHFAHGFJW-INIZCTEOSA-N	441.362	1.875	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1)c1cncn1-c1ccncc1	1816220602	UWSNWUNNFBNOCD-RDJZCZTQSA-N	443.895	1.896	50	20	IDGD	
CC(C)(CCl)C(=O)N[C@H]1CCc2nc(NC(=O)c3cc(O)nc(O)n3)sc2C1	1817098966	MTJOUBUCCAZJDH-QMMMGPOBSA-N	425.898	1.835	50	20	IDGD	
O=C(CN1CCCC1=O)Nc1cc([C@@H]2CCCCN2C(=O)CCBr)[nH]n1	1817156736	NXJKWIHUYFIKAX-ZDUSSCGKSA-N	426.315	1.809	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)C1=COCC1)CC2	1817283042	ROSRIGAJIRBVHV-BTIIEKFUSA-N	442.501	1.493	50	20	IDGD	
COC[C@H](NC(C)=O)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)C(C)(C)CCl)[nH]n1	1819605652	FKAXDQHRZMGDOP-GJZGRUSLSA-N	427.933	1.818	50	20	IDGD	
CCc1cc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)n(C)n1	1819835899	LOQTZCJDKKOZOT-MRXNPFEDSA-N	444.540	1.385	50	20	IDGD	
Cc1cc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)c(C)n1C	1820059255	LTLZMNXVYATWIP-FQEVSTJZSA-N	449.320	1.665	50	20	IDGD	
CCS(=O)(=O)CC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](F)Br)n[nH]1	1820931391	OKJUNEHTDVORCG-ZWNOBZJWSA-N	439.307	1.527	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H]2CCCS2(=O)=O)n[nH]1	1821835347	DAJMFLQSGVYLAR-DRZSPHRISA-N	447.355	1.762	50	20	IDGD	
Cc1ccc(CC(=O)N2CCCC[C@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)cn1	1822410691	PLRNZEFXWSVNLC-SFHVURJKSA-N	441.536	1.721	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)CC2CCOCC2)[nH]n1	1822413347	SLBYPNSDNMZGHF-KRWDZBQOSA-N	434.541	1.592	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CN2CCOCC2)CC1	1824092342	CKGOMFSTSBMIQC-SJLPKXTDSA-N	444.414	1.969	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCC([C@H]2CCCCN2C(=O)CN2C(=O)CNC2=O)CC1	1824904964	VUBJTPSKJVNBBA-KUHUBIRLSA-N	447.363	1.394	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)Cc1c(C)n[nH]c1C)CC2	1826007182	TUJDEURKBVFGKB-AAEUAGOBSA-N	425.942	1.892	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H]1[C@H]3C=CS[C@H]31)CC2	1826089712	MFOWWFOZIMMRKC-LMCLETFFSA-N	435.575	1.303	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCCC[C@H]1C1CCN(C(=O)CC[C@H](N)C(N)=O)CC1	1829102285	NBOXJEZHXNQFGN-IRXDYDNUSA-N	426.634	1.050	50	20	IDGD	
Cc1cccc2cc(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)[C@@H](O)CCl)CCO4)[nH]c12	1830732130	VFMYKZFOMQYPJA-LAUBAEHRSA-N	435.908	1.146	50	20	IDGD	
C[C@@H](Cn1ccnc1)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1	1832227637	SAMBZRRIICJHOS-ICSRJNTNSA-N	446.596	1.512	50	20	IDGD	
C[C@@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)[C@H]3CCCO3)CC2)CC1	1833263201	FRLQEEJMVUUEJI-WMLDXEAASA-N	430.387	1.768	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cc4cnccc4[nH]3)CC2)CC1)[C@@H](O)CCl	1833310746	ZQHGPJPNLNMQGO-IBGZPJMESA-N	433.940	1.348	50	20	IDGD	
CC(C)n1nccc1C(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)CCl)CC2)CC1	1833311917	FSNHVMCGFNXJBB-SFHVURJKSA-N	425.961	1.249	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ncc(OC)cc3F)CCO2)C1	1833630077	WZKGMNZMQVQKIV-FOIQADDNSA-N	443.903	1.707	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ncc(Cl)cn3)CCO2)C1	1833783083	LOXXABIURWMONN-SFHVURJKSA-N	431.320	1.465	50	20	IDGD	
Cc1nc(C)c(C(=O)N2CCOC[C@@]3(CN(C(=O)CCBr)CCO3)C2)s1	1834818829	CMRYOHJSMSLQIR-QGZVFWFLSA-N	446.367	1.615	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3nc4ccccn4n3)CCO2)C1	1836392225	IOOVARCNBZGWFH-FQEVSTJZSA-N	435.912	1.064	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC(OC2CCN(C(=O)COCCO)CC2)CC1	1836672896	FOAIEIHZMDVGCN-CQSZACIVSA-N	435.359	1.025	50	20	IDGD	
Cn1ncc(C(=O)N2CCC(OC3CCN(C(=O)[C@H](O)CCl)CC3)CC2)c1Cl	1836718666	YPQLXFZEBTXKIK-OAHLLOKOSA-N	433.336	1.285	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(OC)ccc3F)C2)C1	1839148497	AKSIGCFUMGZMQW-UZLBHIALSA-N	428.888	1.922	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C=N/N3CCCCC3)C2)C1	1839153106	BEQLOXPRHSANKY-DNYNIURUSA-N	449.379	1.151	50	20	IDGD	
Cc1n[nH]c(C)c1CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2	1839154237	HXDSANLRVCBISD-RTBURBONSA-N	447.363	1.262	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(C)cc3F)CCO2)C1	1839260933	LKKKGQPMLGFTET-UZLBHIALSA-N	428.888	1.458	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)C(=O)c3ccccc3)C2)C1	1840031953	HRGHVRAMQUZMQC-AUUYWEPGSA-N	439.306	1.109	50	20	IDGD	
Cc1ccc(F)c(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)c1	1840035657	ZMZAUJSAQIANMY-KUHUBIRLSA-N	443.313	1.988	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)cc1Cl	1840731341	JRUOGGAYZPFEIB-DNVCBOLYSA-N	447.315	1.018	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC12CN(C(=O)c1ccc3c(c1)n(C)c(=O)n3C)C2	1841287632	YQEKKNSWDXBPOW-CYBMUJFWSA-N	449.349	1.725	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H](C(=O)N2CCCC23CN(C(=O)[C@H](O)CCl)C3)[C@@H](F)C1	1841516252	UZGZDFRGENBRHR-QLFBSQMISA-N	447.935	1.385	50	20	IDGD	
Cn1ncc(Br)c1C(=O)N1CC2(CCCN2C(=O)CCBr)C1	1842638313	KSPJGDSYPLYDRW-UHFFFAOYSA-N	434.132	1.785	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1cn(C)nc1C(F)F)C2	1843416019	ONZZBQGNKNHZMK-WYMPLXKRSA-N	447.446	1.309	50	20	IDGD	
C#CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)[C@@H](F)Br)C1	1845220805	OVXHOVSKKOFCPS-CHWSQXEVSA-N	446.317	1.797	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)c2ccc3sccc3c2O)C1	1845660813	DHBKWQONYUKZAU-UHFFFAOYSA-N	430.530	1.797	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)C2(c3ccc(Cl)cc3)CC2)C1	1845917627	LLPCJDONAXQYMK-UHFFFAOYSA-N	432.952	1.948	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H]2OC[C@@H](C(=O)N3CCCC34CN(C(=O)[C@@H](F)Cl)C4)[C@H]2C1	1846161239	IMUACXWGEPQVHN-KBUPBQIOSA-N	445.919	1.606	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC12CN(C(=O)[C@H]1CC(=O)N(C3CCCC3)C1)C2	1846175809	UDZDBJUCBYFHKD-KBPBESRZSA-N	426.355	1.764	50	20	IDGD	
C[C@H](C(=O)N1CCCC12CN(C(=O)[C@H](Br)Cc1ccccc1)C2)n1cnnn1	1846648343	WKHWGEVHLMWFQR-GDBMZVCRSA-N	447.337	1.444	50	20	IDGD	
CC(C)(C)OC(=O)N1CC=C(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](O)CCl)CC1	1847567949	GPEHGYQRPWUIIV-HRCADAONSA-N	427.929	1.355	50	20	IDGD	
Cc1nn2cc(CC(=O)N3CC[C@H]4[C@@H]3CCN4C(=O)[C@H](F)Br)nc2s1	1847977436	XTACBDUBVPLOOA-GVXVVHGQSA-N	430.303	1.534	50	20	IDGD	
Cc1cc(NC(=O)[C@H](C)SCC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)no1	10158684	NMAFDHIGOXZCPH-LBPRGKRZSA-N	444.473	1.396	50	20	IDGD	
CCn1c(NNC(=O)c2ccc(CCNS(C)(=O)=O)s2)nc2ccccc2c1=O	11163388	JPJHYLIBACLBSL-UHFFFAOYSA-N	435.531	1.327	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2ccc(Cn3cncn3)cc2)c2ccccc2c1=O	11652071	OVTXTHLECLCUFG-UHFFFAOYSA-N	431.456	1.521	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NN[C@H](C(=O)N(C)C)c2ccccc2)c1	15467768	NZLQYIYFIIBOHN-IBGZPJMESA-N	432.546	1.781	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)c1ccc2c(=O)n(-c3ccccc3)c(=O)[nH]c2c1	16203741	QHJSCUGLTRRDFF-UHFFFAOYSA-N	432.411	1.822	50	20	IDGD	
CON(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)c1	24297484	VTKAEIFVOKFNGI-LBPRGKRZSA-N	425.438	1.236	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CC[C@@H](NC(=O)Nc3ccc(F)cc3)C2)n1	726187501	YOAFRDJKAUWZDB-OAHLLOKOSA-N	434.497	1.177	50	20	IDGD	
N#C/C(=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)NCCn1cncn1	726535922	ISKVCHVRCMPLHY-OQLLNIDSSA-N	438.879	1.394	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)COc1ccc(C2SCCCS2)cc1	729275549	PQXWRLHSUNJTQD-LLVKDONJSA-N	433.577	1.019	50	20	IDGD	
CC[C@@H](N=c1nn[nH]n1-c1ccccc1)C(=O)NNC(=O)c1cc(-c2ccccc2)[nH]n1	729283782	LMVHXBWOKPRCMC-MRXNPFEDSA-N	431.460	1.126	50	20	IDGD	
Cc1ccc(C)c(S(=O)(=O)NCCC(=O)NNC(=O)Cn2ccc3ccccc32)c1	729450062	LSRCRYPLKHSQAI-UHFFFAOYSA-N	428.514	1.774	50	20	IDGD	
N#C/C(=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)N1CCO[C@@H](C#N)C1	729979277	DDWIRQOERWIVNH-DWCFMXGVSA-N	438.875	1.737	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NC2CCN(CCC(=O)N(C)C)CC2)ccc1OC(C)C	731502532	KISMALBFTIOXML-UHFFFAOYSA-N	449.552	1.369	50	20	IDGD	
COc1ccc(Cn2cc(C(=O)NNC(=O)c3nn(-c4ccccc4)cc3O)cn2)cc1	731687751	QEZUGTBZNCXPHJ-UHFFFAOYSA-N	432.440	1.906	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)[C@@H](c1ccccc1)N1CCN(C)CC1	732053444	BQKRGAVCFIABFI-HSZRJFAPSA-N	434.544	1.735	50	20	IDGD	
Cc1ccc(C(=O)N2CCC[C@H](C(=O)NNC(=O)CCN3C[C@H](C)O[C@@H](C)C3)C2)cc1	732261704	OPWCAZNCGWMCQP-BJLQDIEVSA-N	430.549	1.494	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2cn(-c3ccccc3C(F)(F)F)nn2)C[C@@H](C)O1	732263136	KSAFPRDBHVUFBC-BETUJISGSA-N	440.426	1.546	50	20	IDGD	
Cn1c(N)c(C(=O)/C(C#N)=C\c2ccc(Br)c([N+](=O)[O-])c2)c(=O)n(C)c1=O	732578064	BXPISHGXRULEKA-UITAMQMPSA-N	434.206	1.127	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)N2CCN([C@@H]3CCN(c4ccccc4)C3=O)CC2)cc1	732995060	LGCOMZJPCNSAQW-HXUWFJFHSA-N	432.484	1.336	50	20	IDGD	
C[C@@H](NC(=O)NN[C@]1(C)CCS(=O)(=O)C1)c1ccc(NC(=O)c2ccncc2)cc1	733848644	SBFLMQLYACFTJV-JLTOFOAXSA-N	431.518	1.776	50	20	IDGD	
O=C(NNC(=S)Nc1ccc2c(c1)OCO2)c1ccc(S(=O)(=O)N2CCCC2)cc1	735234331	HCHPIXKUYMGZGZ-UHFFFAOYSA-N	448.526	1.831	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)CC(C)(C)NC(=O)OC(C)(C)C)c2ccccc2c1=O	739678886	MNMLOOTUONRDCY-UHFFFAOYSA-N	431.493	1.871	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)[C@H]2CN(Cc3ccccc3)CCO2)cc1C	741379931	AXXHJCGSGQRQCI-QGZVFWFLSA-N	445.541	1.824	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CSc2nnc(-c3ccccc3Cl)n2N)c1	741841167	HRFGHKFVOHDPLV-UHFFFAOYSA-N	427.877	1.737	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNS(=O)(=O)c2cc(C)c(F)c(C)c2)cc1	742025528	OBDLDANSFBBJMB-UHFFFAOYSA-N	443.522	1.381	50	20	IDGD	
CC(C)NC(=O)C(=O)NNS(=O)(=O)c1ccc(Br)c(C(F)(F)F)c1	743251395	PBJILDQEAHIRGK-UHFFFAOYSA-N	432.218	1.302	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)N[C@H]3CCCN(c4ccn(C)n4)C3=O)cc2C1	743512892	ZTRGFLYIDFHWHE-JSGCOSHPSA-N	430.534	1.746	50	20	IDGD	
CC(C)(C)C(=O)NNC(=O)CN1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1	744382805	AOPRPJHFIYMOHN-UHFFFAOYSA-N	431.415	1.929	50	20	IDGD	
CN(CC(=O)NNC(=O)c1cccc(C#N)c1)CC(=O)Nc1ccc(Br)cn1	744396618	MOMDHNWZLIAIHE-UHFFFAOYSA-N	445.277	1.047	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)c2cc(Cl)c3c(c2)OCCCO3)c1	744585687	FSQLYRSDBIOKBI-UHFFFAOYSA-N	429.816	1.991	50	20	IDGD	
Cc1ccc(Br)cc1C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	745254215	RUPGPIUJQKMRKB-MRXNPFEDSA-N	449.257	1.902	50	20	IDGD	
O=C(COC(=O)Cc1ccn(-c2ccc(F)cc2)n1)NNC(=O)c1ccc([N+](=O)[O-])cc1	745422947	YFEVVDSNUNCMOY-UHFFFAOYSA-N	441.375	1.467	50	20	IDGD	
CN(C)c1ccc(C(=O)c2ccccc2C(=O)NNC(=O)N2CCOCC2)cc1[N+](=O)[O-]	745987910	LVZSNPNWCXMQTA-UHFFFAOYSA-N	441.444	1.578	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cc(C)c3c(O)nc(O)nc3n2)cc1Br	746248226	AYZHCYZQQYQMCE-UHFFFAOYSA-N	448.233	1.590	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)N[C@@H]2CCCN(CC(F)(F)F)C2=O)cc1C	746339609	QBHNWKIBABQHKS-CYBMUJFWSA-N	429.399	1.126	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)Cn1c(S)nnc1-c1ccc(Cl)cc1	746640374	BPAJDIWHCFZGGN-UHFFFAOYSA-N	441.904	1.925	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)N[C@H]1CCN(c2ccc(Cl)cc2)C1=O	746768309	CWGKAYISOFNCAG-INIZCTEOSA-N	426.864	1.666	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)N2CCN(C(C)(C)C(N)=O)CC2)c(C)n1C[C@@H]1CCCO1	747921609	ZFDCRGIURLOTHC-ACSPXDACSA-N	427.549	1.599	50	20	IDGD	
Cc1cc(=O)c(C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)nn1-c1ccccc1[N+](=O)[O-]	748278925	DWMVGBDVLJEBOC-GOSISDBHSA-N	435.396	1.214	50	20	IDGD	
CCOC(=O)C1CCN(S(=O)(=O)NNC(=O)c2cc3c(s2)CC[C@H](C)C3)CC1	748673598	CPIJZIHIOLORCH-LBPRGKRZSA-N	429.564	1.627	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NC2CCN(C(=O)CC(C)C)CC2)c2ccccc2c1=O	749197384	IIEWXEDQBAECLX-UHFFFAOYSA-N	442.520	1.398	50	20	IDGD	
O=C(COC(=O)c1occc1Br)NNC(=O)[C@@H]1COc2ccccc2O1	751699987	HSZPJJMUZQWPLN-LBPRGKRZSA-N	425.191	1.186	50	20	IDGD	
CCc1ccccc1-n1cc(O)c(C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)n1	752793315	MPPJJDAJEQJRBU-UHFFFAOYSA-N	432.440	1.462	50	20	IDGD	
CC(=O)NC[C@@H]1CCn2ncc(C(=O)NNC(=O)c3cc(-c4ccc(F)cc4)[nH]n3)c2C1	753258784	KPSVSSIEPHRTEQ-CYBMUJFWSA-N	439.451	1.186	50	20	IDGD	
CSCC[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)NNc1cc(Cl)nc(N)n1	753458233	XVBDIUNLDASTMS-LLVKDONJSA-N	439.885	1.615	50	20	IDGD	
CCc1nn(C)c(CC)c1CNC(=O)NNC(=O)c1nn(CC)c(=O)c2ccccc12	755085682	WGMSUQSVWVXGAM-UHFFFAOYSA-N	425.493	1.419	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)N[C@H]1CCN(c2c(F)cccc2F)C1=O	755166396	PAPBUVXTCZJUBF-KRWDZBQOSA-N	440.410	1.900	50	20	IDGD	
C[C@H](NC(=O)OC(C)(C)C)[C@@H](C)C(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	755365720	BLCSZFSFOPNYDL-NEPJUHHUSA-N	428.511	1.792	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCc2cn(-c3ccccc3)nn2)nc1	756071107	HKXPAGAFVHHCDW-UHFFFAOYSA-N	430.494	1.175	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2OC)c2ccccc2c1=O	756414472	RELZFYUKVDPQBZ-UHFFFAOYSA-N	425.401	1.798	50	20	IDGD	
CNS(=O)(=O)c1ccc(C)c(NC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)c1	756523741	CKPACTAJANQRIR-UHFFFAOYSA-N	444.473	1.261	50	20	IDGD	
O=C(COc1ccc(Cl)cc1)NNC(=O)Nc1ccc(C[C@@H]2CC(=O)NC2=O)cc1	756815633	OCSWIRIBGIIMTO-CYBMUJFWSA-N	430.848	1.777	50	20	IDGD	
CC(C)Oc1cc(Br)cc(NC(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)c1	756865820	LPAGKEBGDFDUHT-VIFPVBQESA-N	437.316	1.327	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)C(F)(F)c2c(F)cccc2F)ccc1Cl	756866905	IEDDSRJYBCZAMB-UHFFFAOYSA-N	439.774	1.819	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)C(C)(C)CNC(=O)OC(C)(C)C)c1	756901803	SLJCXKJUVHSRIG-UHFFFAOYSA-N	442.538	1.249	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2cc(Br)c[nH]2)cnn1CCO[C@@H]1CCCCO1	758140495	UDTQUJHWSBFFEJ-OAHLLOKOSA-N	440.298	1.900	50	20	IDGD	
O=C(NC[C@@H](c1ccccc1Cl)N1CCOCC1)NNC(=O)C(=O)Nc1ccccn1	758683285	HEMKDPCUDKSIPE-INIZCTEOSA-N	446.895	1.077	50	20	IDGD	
O=C(CCc1ccc(O)cc1)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	760920008	XQWMPOUWXUQZTP-UHFFFAOYSA-N	430.936	1.943	50	20	IDGD	
CCS(=O)(=O)Nc1cc(OC)ccc1S(=O)(=O)NNC(=O)c1cc(C)oc1C	761266200	FJVMWDLFLNOGRV-UHFFFAOYSA-N	431.492	1.290	50	20	IDGD	
CC[C@H](NC(=O)NNC(=O)C(=O)Nc1ccccn1)[C@@H]1CN(Cc2ccccc2)CCO1	761789626	HKCJYQQBKQSCOZ-ROUUACIJSA-N	440.504	1.030	50	20	IDGD	
C[C@H](NS(=O)(=O)c1ccc(C(N)=O)cc1)C(=O)NNc1ccccc1C(F)(F)F	763021419	RIGKLSDHFDCUPF-JTQLQIEISA-N	430.408	1.614	50	20	IDGD	
O=C(CSc1ccccc1O)NNS(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2	763410985	DGUKUBCSQAJJJM-UHFFFAOYSA-N	441.443	1.173	50	20	IDGD	
O=C(NNC(=O)c1ccc2ccccc2n1)C(=O)Nc1ccc(C(=O)N2CCCC2)cc1	763450688	RVQAUPQOBGIBAN-UHFFFAOYSA-N	431.452	1.871	50	20	IDGD	
CCS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc3ccccc3cc2O)cc1	763521593	GPYXJXNBERGYEH-UHFFFAOYSA-N	441.465	1.739	50	20	IDGD	
Cc1nnnn1-c1cccc(NC(=O)C(=O)NNC(=O)c2cc3ccccc3cc2O)c1	763522805	QXKQVAPXNWJEBZ-UHFFFAOYSA-N	431.412	1.229	50	20	IDGD	
O=C(NNC(=O)c1cc2ccccc2cc1O)C(=O)Nc1ccccc1Cn1cncn1	763525718	BYJRPOPTORTBPB-UHFFFAOYSA-N	430.424	1.585	50	20	IDGD	
CCn1nnnc1-c1cccc(NC(=O)C(=O)NNC(=O)c2cc(C)nc3ccccc23)c1	763617323	XLADQIAIZSDNGI-UHFFFAOYSA-N	444.455	1.616	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(OC)cc2C(F)(F)F)cc1	763662710	ZQOODQKJCMGFGB-UHFFFAOYSA-N	441.362	1.888	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2ccc(C)c(S(C)(=O)=O)c2)c1	763669240	VOTBINIKCNQAIK-UHFFFAOYSA-N	433.486	1.180	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc2oc(N(C)C)nc2c1	763683205	WUNRFXCHWVFTGT-UHFFFAOYSA-N	441.444	1.457	50	20	IDGD	
O=C(CN1CCCc2ccccc21)NNC(=O)C(=O)Nc1cccc(N2CCCC2=O)c1	763746483	XYFCAHXFPSXKPI-UHFFFAOYSA-N	435.484	1.352	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccnn1-c1ccc(Cl)cc1	763809161	RYTDWDPMIOKMNM-UHFFFAOYSA-N	438.831	1.562	50	20	IDGD	
CC[C@@H](Cc1ccccc1Br)C(=O)NNC(=O)CNC(=O)c1cccnc1	763820558	MPXXIHPFESFBSW-ZDUSSCGKSA-N	433.306	1.990	50	20	IDGD	
CCc1nnc(-c2cccc(NC(=O)C(=O)NNC(=O)COc3ccc(F)cc3)c2)o1	763838724	BSOFDLBDMQOXFM-UHFFFAOYSA-N	427.392	1.603	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccn(Cc2ccccc2)n1	763865836	RGMUIGYYXJOVOR-CQSZACIVSA-N	425.420	1.624	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1cnn(Cc2ccccn2)c1	763870708	BSFAGEJNGUYKJP-CYBMUJFWSA-N	426.408	1.019	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)NC(=O)CS2	763871595	HSBKEZUACYRFLZ-SNVBAGLBSA-N	432.433	1.423	50	20	IDGD	
CC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)Cn2nc(C)cc2C)c(C(F)(F)F)c1	763881560	ONGZYDAXFFQTLT-UHFFFAOYSA-N	440.382	1.263	50	20	IDGD	
CC(C)(C)n1cc(C#N)c(NC(=O)C(=O)NNC(=O)CCSc2ccc(F)cc2)n1	763895073	KUSYXQYSIVXJNV-UHFFFAOYSA-N	432.481	1.917	50	20	IDGD	
CC[C@H](C)n1nc(NC(=O)C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc1C	763944073	LGTFMFMMFRXERH-LBPRGKRZSA-N	425.449	1.454	50	20	IDGD	
O=C(NNC(=O)c1cc(Cl)ccc1O)C(=O)Nc1ccc(OCC(F)(F)F)nc1	763978038	CWUWZOXNDWUJOL-UHFFFAOYSA-N	432.742	1.781	50	20	IDGD	
CCOC(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)c1	763995786	LUBWQRGEWYHILA-UHFFFAOYSA-N	437.250	1.283	50	20	IDGD	
O=C(Cc1ccsc1)NNC(=O)C(=O)Nc1ccc(CC(=O)N2CCSCC2)cc1	764033545	HYFBCGDSZHETRP-UHFFFAOYSA-N	446.554	1.195	50	20	IDGD	
O=C(NNC(=O)c1cccc(C(F)(F)F)c1)C(=O)Nc1cccc(N2CCNC2=O)c1	764040615	NSNVTBTUEXAIDM-UHFFFAOYSA-N	435.362	1.635	50	20	IDGD	
CS(=O)(=O)NCc1ccc(NC(=O)C(=O)NNC(=O)c2cccc3ccccc23)cc1	764058657	TXZYQIRSAUYFAU-UHFFFAOYSA-N	440.481	1.289	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)nc1)C(=O)Nc1ccc(F)c(-n2nnnc2C2CC2)c1	764101704	UGSYNTFRPKXIRT-UHFFFAOYSA-N	444.814	1.127	50	20	IDGD	
CCOc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NNC(=O)c1ccc(Cl)cc1O	764125043	QPHFOQBZFGHFHH-UHFFFAOYSA-N	448.863	1.546	50	20	IDGD	
O=C(CCc1ccco1)NNC(=O)C(=O)Nc1ccc(CCC(=O)N2CCCC2)cc1	764178008	XUDOVXQVJJXGFP-UHFFFAOYSA-N	426.473	1.553	50	20	IDGD	
COc1c(Cl)cccc1NC(=O)C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C	764203343	LDNXIXYGADIXCH-UHFFFAOYSA-N	428.873	1.739	50	20	IDGD	
CC(C)(C(=O)NNC(=O)C(=O)Nc1ccc(NC(=O)[C@H]2CCCO2)cc1)c1ccccc1	764302629	OJLQMLUXLDUNGB-GOSISDBHSA-N	438.484	1.868	50	20	IDGD	
O=C(CCC(=O)N1CCN(c2ccccc2)CC1)NNC(=O)NCCc1cccs1	765119861	DOFFEFLBFGEJBZ-UHFFFAOYSA-N	429.546	1.750	50	20	IDGD	
CCOC(=O)NNC(=O)C(=O)Nc1ccc(S(=O)(=O)N(C)Cc2ccccc2)cc1	765394838	FLPABSPFVHNTAR-UHFFFAOYSA-N	434.474	1.223	50	20	IDGD	
Cc1cccc(C)c1NC(=O)C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	765728635	NLZMRRUZHOOANX-UHFFFAOYSA-N	432.502	1.406	50	20	IDGD	
COC(=O)Nc1cccc(C(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)c1	765753943	GBKFKSKQRYKYDA-UHFFFAOYSA-N	439.516	1.752	50	20	IDGD	
NC(=S)c1ccc(C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)cc1	765757382	DNONJWMZFZVHIQ-UHFFFAOYSA-N	445.976	1.553	50	20	IDGD	
COC(=O)c1c(C)[nH]c(C(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)c1C	766648242	JANOCMVNWOJLEE-UHFFFAOYSA-N	441.532	1.305	50	20	IDGD	
O=C(NNC(=O)c1c[nH]nc1-c1c(F)cccc1F)c1csc(N2CCOCC2)n1	767822415	KKQMMXUXPISXMM-UHFFFAOYSA-N	434.428	1.723	50	20	IDGD	
Cc1ccc2ncccc2c1S(=O)(=O)N1CCN(S(=O)(=O)CBr)CC1	767849410	DVEOZRXHCXVUOL-UHFFFAOYSA-N	448.364	1.532	50	20	IDGD	
CCOC(=O)N[C@H](C(=O)NNC(=O)c1cc(-c2ccc(OC)c(OC)c2)[nH]n1)C(C)C	768276537	KLICNYQWMVXIDZ-KRWDZBQOSA-N	433.465	1.626	50	20	IDGD	
COCCOc1ccccc1N1CCN(CC(=O)NNC(=O)c2ccc(C#N)cc2)CC1	768553784	ZIXDGTQWXSOJRI-UHFFFAOYSA-N	437.500	1.167	50	20	IDGD	
CS(=O)(=O)c1cc(S(=O)(=O)NNC(=O)c2ccc3ccccc3n2)c(Cl)s1	770636829	TZXVSRZDJMDPSS-UHFFFAOYSA-N	445.931	1.977	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNS(=O)(=O)c1cc(F)ccc1Br	771903251	OZGBXHHHVVAYIX-UHFFFAOYSA-N	436.284	1.389	50	20	IDGD	
C[C@H]1Oc2c(cccc2C(=O)NNC(=O)[C@H]2CCCN(C(=O)OC(C)(C)C)C2)NC1=O	773412036	TTXSWDCAVKCEAA-OLZOCXBDSA-N	432.477	1.814	50	20	IDGD	
Nc1nc(Cl)cc(NNC(=O)C2CCN(S(=O)(=O)c3cc(F)ccc3F)CC2)n1	779376478	NTSLUYJUUNFCHH-UHFFFAOYSA-N	446.867	1.534	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2c(C(=O)N3CCOCC3)oc3ccccc23)nc1	782146087	WWAIPYFQBYEZSE-UHFFFAOYSA-N	439.428	1.391	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)cc1)C(=O)Nc1ccn(-c2cccc(C(F)(F)F)c2)n1	782833889	MVBWZAQWSACYEB-UHFFFAOYSA-N	433.346	1.996	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2c(C)cc(C)cc2C)cc1	783367721	BCTOOYPLDVPYNX-UHFFFAOYSA-N	434.518	1.618	50	20	IDGD	
CN(Cc1ccccc1)c1ccc(NC(=O)C(=O)NN[C@]2(C)CCS(=O)(=O)C2)cc1	783424951	GVPSMLSLEFQAPS-OAQYLSRUSA-N	430.530	1.460	50	20	IDGD	
O=C(NNc1ccc(-n2cccn2)nn1)C(=O)Nc1cc(CC2CC2)nn1-c1ccccc1	783432925	IDMYWEYQLZNNDC-UHFFFAOYSA-N	443.471	1.882	50	20	IDGD	
O=C(NNc1ccccc1C(F)(F)F)C(=O)Nc1ccn(CCN2CCOCC2)n1	784821225	MVVFUQOWYOURGI-UHFFFAOYSA-N	426.399	1.316	50	20	IDGD	
Cc1ccnc(-n2nc(C)cc2NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c1	786068710	GSQYEIUYFOBSTL-UHFFFAOYSA-N	432.444	1.598	50	20	IDGD	
C[C@@H]1CC(C)(C)C[C@]2(C1)NC(=O)N(CC(=O)NNc1ccc(-n3ccnc3)nn1)C2=O	788177738	MBLHQQHKBIJNNR-XCLFUZPHSA-N	426.481	1.242	50	20	IDGD	
CN(C)[C@H]1CCOc2c(NC(=O)C(=O)NNc3ccc(S(C)(=O)=O)cc3)cccc21	789746213	JFRDUSGPNPGZKG-KRWDZBQOSA-N	432.502	1.557	50	20	IDGD	
CN(C1CCCCC1)S(=O)(=O)c1ccc(C(=O)NNC(=O)CN2CCCC2=O)cc1	789857280	CIDLKQROMLNZQN-UHFFFAOYSA-N	436.534	1.023	50	20	IDGD	
COc1cccc(NNC(=O)[C@H]2[C@H](C)CC(=O)C[C@H]2C(=O)NNc2cccc(OC)n2)n1	791141834	XHNYWNVSHLFBKG-TVZGQMOCSA-N	442.476	1.312	50	20	IDGD	
C[C@](O)(Cn1cc(C(F)(F)F)ccc1=O)C(=O)NNC(=O)c1ccc2ccccc2n1	792003941	CPRSIWATRPONHT-IBGZPJMESA-N	434.374	1.628	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)NCCOc2ccc(S(=O)(=O)C(F)(F)F)cc2)n1	793026766	KHEFSAZPAIHZSH-UHFFFAOYSA-N	446.407	1.707	50	20	IDGD	
O=C(CCc1cncnc1)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	794209381	BQQKVZBVIYWOFX-UHFFFAOYSA-N	431.499	1.733	50	20	IDGD	
Cc1noc(C)c1C(C)(C)C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	798111066	WKRNINIHPBWBSP-UHFFFAOYSA-N	436.538	1.043	50	20	IDGD	
CC(C)(C(=O)NNC(=O)NCC(F)(F)F)S(=O)(=O)c1ccc(Br)cc1	798315952	GCFLVYXWFDGAFL-UHFFFAOYSA-N	446.245	1.894	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(O[C@H]3CCN(C)C3=O)cc2C)cc1	799258420	CHLHICMWPFMYPV-IBGZPJMESA-N	438.484	1.567	50	20	IDGD	
Cc1cc(O[C@H]2CCN(C)C2=O)ccc1NC(=O)C(=O)NNc1ccccc1[N+](=O)[O-]	799259537	BPGBWQVMQUVILU-KRWDZBQOSA-N	427.417	1.595	50	20	IDGD	
O=C(NNC(=O)c1cc(S(=O)(=O)N2CCSCC2)c[nH]1)Nc1ccc(Cl)cc1	802022572	CWGQUOPCSKPWTG-UHFFFAOYSA-N	443.938	1.872	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=O)N=c2cc[nH]cc2)ccc1Cl	802030173	YVJDRCUNPIBGIC-UHFFFAOYSA-N	425.898	1.654	50	20	IDGD	
O=C(NC[C@@H](O)c1ccc(C(F)(F)F)cc1)NNC(=O)c1ccc(-n2cnnn2)cc1	804867872	NBQJGOUFWJPRGL-OAHLLOKOSA-N	435.366	1.359	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1nc(C2CCOCC2)cs1	806973855	MGVOIHLNTBAQPO-UHFFFAOYSA-N	448.501	1.601	50	20	IDGD	
COCCNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2cccc3cccnc23)c1	806977441	JQLBXRIXOZMQRP-UHFFFAOYSA-N	435.440	1.011	50	20	IDGD	
Cc1ccc(-c2csc(NC(=O)C(=O)NNC(=O)CNC(=O)c3cccs3)n2)s1	807004264	JIXVAPVDAQQWAV-UHFFFAOYSA-N	449.539	1.757	50	20	IDGD	
O=C(NCc1cc(Cl)c2c(c1)OCCCO2)NNC(=O)c1ccc(-n2cnnn2)cc1	807017550	MOODHWOEKQXRRE-UHFFFAOYSA-N	443.851	1.621	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)[C@H]1CCCC12OCCO2	807092371	CMQSYFACSXEZPG-QGZVFWFLSA-N	436.940	1.148	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)C(=O)Nc1ccc(OCCc2ccccc2)nc1	807429153	MPTZSMSHWBINRA-UHFFFAOYSA-N	444.455	1.761	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)NCCCN1C(=O)c2ccccc2C1=O	807494953	SAIAHPODOIFUCP-UHFFFAOYSA-N	440.456	1.481	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc2c(c1)OCCCO2)NNc1ccc2c(=O)[nH]ccc2c1	807503639	DEVGFQXGYDZHPY-UHFFFAOYSA-N	444.469	1.111	50	20	IDGD	
CCCS(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)c2cn(C)c3ccccc23)cc1	808071256	ULRMYEDYAAPLGQ-UHFFFAOYSA-N	435.527	1.985	50	20	IDGD	
O=C(NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)Nc1ccc2c(c1)C(=O)OC2	808883907	OVHCNNIBFNJDJT-UHFFFAOYSA-N	444.469	1.608	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)Nc3cnnn3C)c2)c(C)c1	809910521	UHQGAAHGJMWEIP-UHFFFAOYSA-N	443.489	1.699	50	20	IDGD	
COC(=O)CCCc1nnc(NC(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)s1	812945416	CRJXAKDPHUQXOF-UHFFFAOYSA-N	442.523	1.433	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)C(C)(C)c2ccccc2[N+](=O)[O-])cc1	814100475	KTOKJJDHVOIXGU-UHFFFAOYSA-N	448.501	1.649	50	20	IDGD	
CN1CCN(c2ncc(C=NNC(=O)[C@@H]3CCCN(C(=O)OC(C)(C)C)C3)cn2)CC1	814973204	DTJCEYFUWCQVRO-QGZVFWFLSA-N	431.541	1.326	50	20	IDGD	
Cc1ccc(-c2ncco2)cc1NC(=O)C(=O)NNc1ccccc1S(=O)(=O)N(C)C	815752112	CQQYHQYFIQVWEA-UHFFFAOYSA-N	443.485	1.982	50	20	IDGD	
NC(=O)c1ncn2c(C(=O)NNC(=O)c3cc4c(s3)CCC4)cc(-c3ccco3)nc12	913081406	NKVKHVIHIPXZQJ-UHFFFAOYSA-N	436.453	1.713	50	20	IDGD	
C[C@]12CCC(=O)N1c1ccccc1C(=O)N2CC(=O)NNC(=O)Cc1c[nH]c2ccccc12	913557501	BVAIXDPBNZESEY-XMMPIXPASA-N	445.479	1.857	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)c2ccc3c(c2)OCCO3)c1	914720411	AJJXXIARTUMJHB-UHFFFAOYSA-N	437.449	1.358	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)[C@@H]2CC(=O)N(C(C)(C)C)C2)cc1	914747674	CZSXEBUOGDSZNX-OAHLLOKOSA-N	430.534	1.515	50	20	IDGD	
COc1cc(C)c(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c(C)c1	914845627	DSDGQMYKAHRIGQ-UHFFFAOYSA-N	441.531	1.186	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)NCCN2CCS(=O)(=O)CC2)c(C)n1C[C@H]1CCCO1	915264201	OFTAHXOSTXGYEU-UMSHPIDHSA-N	434.562	1.038	50	20	IDGD	
CC(=NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)c1ccccc1O	915915145	PXKLPESKQFLHHF-UHFFFAOYSA-N	431.514	1.886	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NN=Cc1c[nH]nc1C)N(S(C)(=O)=O)CC2	915951760	NUIRFTZTCHEXHA-INIZCTEOSA-N	435.506	1.135	50	20	IDGD	
CN(C)N(C(=O)[C@@H]1CCN(c2ccccc2Br)C1=O)[C@@H]1CCS(=O)(=O)C1	916109923	OYGYMHIPWJTJDK-CHWSQXEVSA-N	444.351	1.294	50	20	IDGD	
CC(C)Oc1ccc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1	916374090	ALBNNBRISVFWLV-UHFFFAOYSA-N	434.518	1.868	50	20	IDGD	
O=C(CCCOc1ccc(Cl)cc1Cl)NNC(=O)NC[C@H]1CCS(=O)(=O)C1	916375999	RWZVYXCXYZCQOM-LLVKDONJSA-N	438.333	1.918	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NC[C@@H](c2ccccc2)N2CCOCC2)cc1	916509049	JTDXETJEJDPMFZ-FQEVSTJZSA-N	428.489	1.478	50	20	IDGD	
O=C(NCCC1CCCCC1)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	916520393	JZZOKZAQYDGWJH-UHFFFAOYSA-N	438.550	1.622	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NCc2cnn(Cc3ccccc3)c2)c2ccccc2c1=O	916580294	ZGUSKESWVOOCDY-UHFFFAOYSA-N	431.456	1.323	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCC(C(=O)N3CCC[C@H](C)C3)CC2)cc1OC	917106100	QRGKTKNPVLJGIJ-INIZCTEOSA-N	446.548	1.435	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)N[C@H](C)c2ccc(S(=O)(=O)N(C)C)cc2)cc1	918103135	AHXVZFPFCJGYFK-OAHLLOKOSA-N	434.518	1.716	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)CCNS(=O)(=O)c2cc(C)ccc2C)cc1	919832867	LBZGWDAUULTGBH-UHFFFAOYSA-N	433.530	1.761	50	20	IDGD	
O=C(CCc1nc2ccccc2n1-c1ccccc1)NNC(=O)N[C@@H]1CCS(=O)(=O)C1	919886229	RHUPIMKICAPBCD-OAHLLOKOSA-N	441.513	1.476	50	20	IDGD	
CCc1ccccc1OCC(=O)NNS(=O)(=O)c1ccc(NS(C)(=O)=O)cc1F	919954488	NAFIRKXTIXIHGH-UHFFFAOYSA-N	445.494	1.148	50	20	IDGD	
CC(=NNC(=O)N[C@@H]1CCS(=O)(=O)C1)c1ccc(S(=O)(=O)C2CCCC2)cc1	920384210	JIITUMDSQJJLKH-OAHLLOKOSA-N	427.548	1.613	50	20	IDGD	
CC(C)[C@@H](C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)N1C[C@@H](C)O[C@H](C)C1	921203191	TXDWDWUCEKFBTQ-VIZSFHNOSA-N	445.608	1.480	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)Cn2cc(C(N)=O)c3ccccc32)CC1	1251914302	FDXODKVQNRJMAF-UHFFFAOYSA-N	443.504	1.535	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCC(=O)NNC(=O)Cc2c[nH]c3ccccc23)cc1	1317738083	SJORDQVBVVEBGZ-UHFFFAOYSA-N	430.486	1.235	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)NCc2ccccc2NS(C)(=O)=O)cc1OC	1323298514	YFGYVYREJGSHTJ-UHFFFAOYSA-N	436.490	1.610	50	20	IDGD	
Cn1ncc2cc(C(=O)N3CC[C@]4(CN(C(=O)CCBr)CCO4)C3)ccc21	1778017881	IMZAYJDYAXJWHH-IBGZPJMESA-N	435.322	1.802	50	20	IDGD	
Cn1ncc2c(C(=O)N3CC[C@]4(CN(C(=O)CO[Si](C)(C)C)CCO4)C3)cccc21	1778029065	NWHYVVGBOOYWCC-NRFANRHFSA-N	430.581	1.868	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCN2CCOC2=O)C1	1778784279	YDSRCZGALHSTJM-HBUWYVDXSA-N	446.342	1.126	50	20	IDGD	
CCCC(=O)N[C@H](C)C(=O)N1CC[C@@]2(CN(C(=O)[C@H](Br)CC)CCO2)C1	1779259078	XFPPUNXQZUQURV-LBTNJELSSA-N	432.359	1.295	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc4cccnn4n3)C2)C1	1779961354	ARJQVLBUBPSSFU-KBXCAEBGSA-N	436.310	1.346	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3[nH]cnc3-c3cccnc3)C2)C1	1780057075	KVZSUIMRKKUFBR-DJJJIMSYSA-N	448.321	1.699	50	20	IDGD	
C#CCCC(=O)N1CCO[C@@]2(CCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1	1780099022	PJOOOTNYTAXNSG-NRFANRHFSA-N	429.429	1.377	50	20	IDGD	
CCOc1ccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](Br)CC)CCO3)nn1	1780429098	BLAOIGRGRLXJMO-SCLBCKFNSA-N	441.326	1.492	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(OC)c(OC)c3)C2)C1	1780659502	WUVLHBWANBRTIR-MGPUTAFESA-N	426.897	1.401	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)c3nc4ccc(F)cn4n3)CCO2)C1	1781232600	LRDTZMMYPJKJJO-ROUUACIJSA-N	444.294	1.548	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](Cl)COC)C2	1781516469	NHQAJRHJERSGPG-NXEZDXNNSA-N	434.917	1.316	50	20	IDGD	
CC1=CC[C@H](C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CCC(=O)NN(C)C)C2)CC1	1782214122	DPHQIAMJGLKMQD-YCRNBWNJSA-N	434.581	1.620	50	20	IDGD	
C[C@H](O)C(=O)N1CC[C@@]2(CN(C(=O)/C(C#N)=C/c3ccc(Br)cc3)CCO2)C1	1783527311	YCYDSPRYYUBRIP-HBHISVEPSA-N	448.317	1.567	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)C[C@@H]21	1783965888	WLDVZWSVKKCICG-IMIFBBOLSA-N	442.310	1.117	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21)[C@H]1CC(=O)N(C2CCCC2)C1	1784967872	PJJUNCWWKHAOID-XRDYDQJJSA-N	429.920	1.292	50	20	IDGD	
C[C@@H](Nc1ccccn1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCBr)[C@H]2C1	1786406045	FHNRMCXNBXDVPB-UGUYLWEFSA-N	439.354	1.647	50	20	IDGD	
O=C(CN1CCCCC1)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1	1787895682	UUUUYPYBKCRIMR-UHFFFAOYSA-N	435.333	1.600	50	20	IDGD	
Cn1c(C(=O)NC2(c3ccc(NC(=O)c4cccc(B(O)O)c4)cc3)CCC2)cccc1=O	1788145897	CDNKXGKDTILHEI-UHFFFAOYSA-N	445.284	1.127	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccn4ccnc34)[C@H]2C1	1788364488	VGZXASFFGRHMIZ-OTRWWLKZSA-N	449.349	1.959	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4c(c3)CNC4=O)[C@H]2C1	1788440388	FFGCIDNEBYAXPM-WBAXXEDZSA-N	433.936	1.788	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)c1ccc2ncnn2c1	1788451501	MZCWCNBYUSXIEC-PWNZVWSESA-N	440.273	1.013	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21)c1nn[nH]c1C(F)(F)F	1789360545	WVLLBWBFFSXJFA-FXQIFTODSA-N	430.214	1.221	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1ccc(C2(NC(=O)c3cnsn3)CCC2)cc1	1789521033	AEQKZIBFMCHFEV-UHFFFAOYSA-N	437.485	1.598	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1ccc(C2(NC(=O)c3cc(O)no3)CCC2)cc1	1789521056	MIGOXCIUKRBTFI-UHFFFAOYSA-N	436.428	1.440	50	20	IDGD	
COc1ncc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]3C2)cc1C	1791058044	NRBDTJAUZRMHST-VRKREXBASA-N	440.338	1.775	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3CCC[C@H](C(=O)OC)C3)[C@H]2C1	1791245345	IOZQZSPNZMCHCF-PXOUGSPUSA-N	428.957	1.963	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(Cl)cnc1O)C2	1792866514	BYPGNCOXSKCEAQ-DYNIEEOBSA-N	446.729	1.675	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CC(=O)N(Cc2ccccc2)C1	1793208770	LIQVSZWTLOAOTI-XLIFZOOWSA-N	447.963	1.642	50	20	IDGD	
COc1ccc([C@@H]2C[C@@H]2C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)cc1	1793521734	ZYKICHAMQMWIRD-QWCYLASJSA-N	448.328	1.431	50	20	IDGD	
COc1ccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](O)CCl)C3)c(Cl)c1	1793861920	LAAGIGSFMIILEW-ZDFLXESQSA-N	431.316	1.080	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCn1c(=O)oc2ccccc21	1794257170	XTQBIPJPJVXXJX-FZKCQIBNSA-N	435.908	1.877	50	20	IDGD	
Cn1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C3)n1	1795154690	UMWUIKXCYZDAKQ-FQLMCAECSA-N	439.944	1.804	50	20	IDGD	
Cc1nc(N)sc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)CBr)C2	1795665583	NLXRRLHLRLOJEY-IXLVHKGHSA-N	431.356	1.268	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](CO)NC(=O)OC(C)(C)C	1796738104	XSUDWKXSMZALKM-JKJDWNRSSA-N	431.961	1.918	50	20	IDGD	
COc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCBr)C3)cc(Cl)n1	1798288075	BBZCABWXLRRUHZ-DRXBFXEBSA-N	446.729	1.732	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COc1ccc(C(=O)OC)cc1)C2	1799273916	VJQLJFOGGKGCAW-HIRMHNASSA-N	438.908	1.459	50	20	IDGD	
COc1ccc(OCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@](C)(Cl)CCl)cc1	1799274081	ZFDSHMROLHFVFK-ZZXMYQEDSA-N	445.343	1.900	50	20	IDGD	
O=C(C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Br)c1ccc(Cl)cc1	1799342286	HHKWWNMJPBABBZ-WJNVRWDZSA-N	447.688	1.803	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CNc3ccccc31)C2)[C@H](F)Br	1799346444	QRHUIOXBVFQNEM-PDGPNTQRSA-N	426.286	1.476	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)ccc1O	1799789382	UYEIUKXJQHCYRK-LSSIXWDNSA-N	427.295	1.332	50	20	IDGD	
C[C@@H](NC=O)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](Br)Cc1ccccc1)C2	1800098894	VCNXLFZWCSDDSR-LHKMKVQPSA-N	436.350	1.765	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1n[nH]c3c1CC[C@H]3C)C2	1800641226	SIVCNDNJUHSUAT-APLFDDQLSA-N	439.354	1.836	50	20	IDGD	
CCCc1onc(C)c1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)Br	1800757690	OGYZRQHKPXLWEO-VFFTVRQLSA-N	428.327	1.922	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1scnc1C(F)(F)F)C2	1800975686	RFEJUGBOIZUHBH-VLEAKVRGSA-N	441.859	1.619	50	20	IDGD	
Cn1ncc(Br)c1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(Cl)Cl	1801014731	ACMRBVVAWSHMLQ-DIYOJNKTSA-N	440.125	1.190	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(OC)c(C)c(OC)c1	1801836698	ZMAGSLVQLMTTLL-YYAJDYIMSA-N	440.924	1.469	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Cl)C3)C[C@H]2C[C@H]21	1802136304	FAJFJHNLERGVGG-GBIHRFPISA-N	445.919	1.508	50	20	IDGD	
COc1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CCC(=O)NN(C)C)c(Cl)c1	1802344109	OHMDJKFIEBYOKR-QDMKHBRRSA-N	436.940	1.973	50	20	IDGD	
COc1cc(F)ccc1CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCC(=O)NN(C)C	1802344243	SQEHMGHURUYAOR-BCDXTJNWSA-N	434.512	1.388	50	20	IDGD	
C#CCO[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@@H]1c1cccnc1	1803549645	CHYMHOLKYDJPHP-BVUBDWEXSA-N	426.286	1.816	50	20	IDGD	
CC(C)[C@H](S)C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1803598107	JOYYVXUWGCDYGD-RLLQIKCJSA-N	441.362	1.035	50	20	IDGD	
O=C(CCc1ccco1)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1804584253	ILJXBZBXTYWJJF-WMZHIEFXSA-N	447.300	1.307	50	20	IDGD	
O=C([C@H](O)CCl)N1CCCC2(CCN(C(=O)[C@H]3CC(=O)N(C4CCCC4)C3)CC2)C1	1805517396	HARBSGVTFMWQGW-FUHWJXTLSA-N	439.984	1.608	50	20	IDGD	
O=C(CCBr)NC[C@@H]1CCN(C(=O)Cn2ccncc2=O)[C@@H]1c1cccnc1	1806346494	ISJLSUYNIHTNOR-HNAYVOBHSA-N	448.321	1.129	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)nc1	1807369658	RKHQVXLTIGSPJB-DENIHFKCSA-N	444.300	1.098	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)c1nccc2nc[nH]c12	1808129937	YDBGZXFNABQETG-JOQOYGCGSA-N	428.880	1.272	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@H]1c1cccnc1	1808431152	IAZONOSNWVMHPZ-MEYUZBJRSA-N	443.317	1.645	50	20	IDGD	
Cc1ccn(CC(=O)N2CC[C@H](CNC(=O)[C@H](F)Br)[C@@H]2c2cccnc2)n1	1808650811	FZDNZBYDOSSSSR-PVAVHDDUSA-N	438.301	1.983	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)CN2CCN(C)CC2)[C@H]1c1cccnc1	1809598327	JNPYOIYNCZUUCJ-IRFCIJBXSA-N	436.000	1.742	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)CC(N)=O)[C@H]1c1cccnc1	1812774244	NHIJSYHENKSXNI-QEWYBTABSA-N	439.354	1.772	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2ccc3nn[nH]c3c2)[C@@H]1c1cccnc1	1813034199	DSDJQFXLUWGPCJ-JTDSTZFVSA-N	442.907	1.926	50	20	IDGD	
O=C(Cc1cccs1)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2	1815589950	SVFQTCSFBRUPTG-CQSZACIVSA-N	441.343	1.353	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](C)CBr)CC2	1817010511	JXORKYZHEITJHQ-AEJSXWLSSA-N	446.371	1.533	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnc[nH]1)CC2	1817277290	PGXMMHWAEDGODO-VCEHOBFASA-N	440.489	1.226	50	20	IDGD	
Cc1cnc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)s1	1817470882	KMSJEOFEKFWZIT-INIZCTEOSA-N	439.306	1.474	50	20	IDGD	
Cn1ncc2c(C(=O)Nc3nc4c(s3)C[C@@H](NC(=O)[C@@H](O)CCl)CC4)cccc21	1818552881	IYDLDTPMACFJLA-BONVTDFDSA-N	433.921	1.855	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)c3c[nH]c(=O)cn3)sc2C1	1821474064	IBOHYBUSCFBMNH-RKDXNWHRSA-N	440.323	1.626	50	20	IDGD	
COc1ccccc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCC(=O)NN(C)C)CC2	1821927386	CDBBGGBEWSCGGU-ZDUSSCGKSA-N	445.545	1.751	50	20	IDGD	
CNC(=S)NCCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](Cl)COC)n[nH]1	1822369149	DAWSUCRXPATQAT-WCQYABFASA-N	430.962	1.140	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2nc3ncccn3n2)[nH]n1	1822371440	WKAKZSPAECXGDN-YPMHNXCESA-N	432.872	1.407	50	20	IDGD	
CCS(=O)(=O)CC(=O)N[C@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1	1822998327	CFBQIFGUVSZPGJ-CPCISQLKSA-N	442.332	1.180	50	20	IDGD	
O=C(c1ccc2c(n1)OCCO2)N1CCC([C@H]2CCCCN2C(=O)[C@@H](O)CCl)CC1	1824182474	DIBCAIDEYWGZEY-SJORKVTESA-N	437.924	1.686	50	20	IDGD	
CC[C@H](C)[C@H](O)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1	1824548413	OZDIIZLAJIXVLD-DQLDELGASA-N	430.354	1.007	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(O)n(C)n1)CC2	1825445384	UYOMJGDUFZYUKW-IUCAKERBSA-N	442.339	1.982	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCN1CCOC1=O)CC2	1826000260	QBVJQFCSJYVNTL-QWRGUYRKSA-N	430.914	1.151	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCN(C)C)CC1	1827680701	FJRYJVSBJHUZEU-GGVNPZCGSA-N	444.580	1.692	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccnc3S)CCO2)C1	1829800442	YJLAZGZAKVYIQF-SJCJKPOMSA-N	444.351	1.224	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cc(C3CC3)on1)CCO2	1830197624	VKRBULKKKCMKJD-FQEVSTJZSA-N	437.569	1.474	50	20	IDGD	
C[C@]1(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CCCN1	1830272482	KPUWCGSBYYGVQM-WMZHIEFXSA-N	442.564	1.061	50	20	IDGD	
COc1cc(C#N)cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)c1	1830364687	PSFLTXHEXANOJK-JOCHJYFZSA-N	449.935	1.902	50	20	IDGD	
CN1CCN(CC(=O)N2CCC([C@H]3CCCCN3C(=O)[C@@H](F)Br)CC2)CC1	1830378436	NMYQDOVSIHKUDI-SJLPKXTDSA-N	447.393	1.544	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3CCCN3C(C)C)C2)C1	1831659786	VQLTXZALKNKXEB-LQWHRVPQSA-N	429.989	1.723	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnc(O)nc2O)CC1	1831832782	IPPVMIMUYMGCPQ-GJZGRUSLSA-N	426.901	1.375	50	20	IDGD	
CCO/C=C/C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1	1832049270	KVUKPNICQZVDKP-JNMQVBFRSA-N	429.521	1.469	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC([C@H]2CCCCN2C(=O)C2CN(C)C2)CC1	1832426555	RLBAZHAFJCYHGZ-UVPCLOGWSA-N	442.564	1.302	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)CC[C@@H]2CCOC2)CC1	1832450882	ATHJOAPLEUIPIX-GCJKJVERSA-N	442.365	1.416	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)C(C)(C)NC(C)=O)CC2)CC1	1833529703	GXJLTWNADKYCDJ-GOSISDBHSA-N	429.005	1.880	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cncn3-c3ccncc3)CCO2)C1	1833654274	FDXLRBZVJPQGBL-UWJYYQICSA-N	447.923	1.355	50	20	IDGD	
Cc1ncc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@](C)(Cl)CCl)C3)C2)cn1	1833814633	DBIZKOMBYGMWQV-QZTJIDSGSA-N	431.320	1.091	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)Cc3cncnc3)CC2)CC1	1833862490	FJBAIMPBYMREFJ-CQSZACIVSA-N	438.370	1.374	50	20	IDGD	
Cc1ncsc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)CBr)C2)C1	1834261972	OCWBOOFKSQEDTL-PXAZEXFGSA-N	446.367	1.553	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccccc3F)CCO2)C1	1835008006	KONKYFDYNZYQNX-KUHUBIRLSA-N	443.313	1.608	50	20	IDGD	
Cc1nc[nH]c1C(=O)NC1CCN(C2CCN(C(=O)[C@H](C)Br)CC2)CC1	1835193183	HKUSXZONUDZGJA-LBPRGKRZSA-N	426.359	1.687	50	20	IDGD	
CCc1cc(C(=O)N2CCC(N3CCC(NC(=O)[C@@H](F)Br)CC3)CC2)n[nH]1	1836412299	CZKCQUCTNGSAPR-MRXNPFEDSA-N	444.349	1.848	50	20	IDGD	
C[C@H](Cc1ccncc1)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836718754	CPNBXKBQADVUBI-UZLBHIALSA-N	437.968	1.859	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc4n(n3)CCCC4)CCO2)C1	1836973847	IUFIMYMMLSEBHE-OAQYLSRUSA-N	438.956	1.554	50	20	IDGD	
C[C@@H](C(=O)N1CCC(OC2CCN(C(=O)CCBr)CC2)CC1)n1cnnn1	1837654783	WBSNPPGHUXTJJN-ZDUSSCGKSA-N	443.346	1.018	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(Cl)cn3)CCO2)C1	1837899826	VOCPRGUBDHQTBC-SJKOYZFVSA-N	446.729	1.588	50	20	IDGD	
O=C(O)c1cnncc1C(=O)N1CCC(OC2CCN(C(=O)C(Cl)Cl)CC2)CC1	1838464105	WUXLXRXRWRRCOU-UHFFFAOYSA-N	445.303	1.591	50	20	IDGD	
Cc1ccc(O)c(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)c1	1838893817	RKJLDKHPCCCTGA-MAUKXSAKSA-N	445.285	1.461	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(F)c3F)CCO2)C1	1839000102	STNWISUVUODVFM-LIRRHRJNSA-N	432.851	1.289	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3CC(F)(F)C3)C2)C1	1839150023	YDBOSFQUZAXCQC-HZPDHXFCSA-N	429.291	1.724	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(Cl)c(F)c3)CCO2)C1	1839272488	QIQHIONVDBHNPK-BEFAXECRSA-N	449.306	1.803	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)C(C)=O)C2)C1	1839961658	DUJSBYWSBINXPY-RDTXWAMCSA-N	433.343	1.232	50	20	IDGD	
CC(C)n1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)n1	1840034534	OJESPYLHQOLSPK-RDTXWAMCSA-N	443.342	1.317	50	20	IDGD	
Cc1cccnc1CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840186909	WZOWHAOLBGACFS-LJQANCHMSA-N	430.332	1.583	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(C)cc(Cl)c3)CCO2)C1	1840699598	OYGPAXCZDQYZCT-PXNSSMCTSA-N	445.343	1.972	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)cc1Cl	1840731339	JRUOGGAYZPFEIB-BEFAXECRSA-N	447.315	1.018	50	20	IDGD	
O=C([C@H](O)CCl)N1CCOC[C@@]2(C1)CN(C(=O)C13CC(c4ccccc4)(C1)C3)CCO2	1840952460	HZSAVUQGGBFZGC-BKAOJLMESA-N	448.947	1.164	50	20	IDGD	
COc1ccc(/C=C(\C)C(=O)N2CC3(CCCN3C(=O)c3cccc(B(O)O)c3)C2)cc1	1843014810	DXGRMQQSXGJHBX-GHRIWEEISA-N	434.301	1.296	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@](C)(O)C[C@H]1C(=O)N1CC2(CCCN2C(=O)[C@@H](F)Cl)C1	1843366892	WPLNMZNPXUWHFL-JCGVRSQUSA-N	433.908	1.485	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2cnc3ccccc3n2)C1	1843620700	CIRDWCBTNVSOHR-JFLMPSFJSA-N	445.483	1.581	50	20	IDGD	
Cn1cnc(C(=O)N2CC3(CCCN3C(=O)[C@H](F)Br)C2)c1C(F)(F)F	1845217551	GMXWXWZPZCIRAE-JTQLQIEISA-N	427.196	1.946	50	20	IDGD	
C[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl	1847558414	DJVSUXAVFXRKBG-QXKUPLGCSA-N	429.945	1.291	50	20	IDGD	
CC(=O)N[C@@H](CC(=O)NNC(=O)c1csc(N2CCOCC2)n1)c1ccc(C)cc1	10292317	CYXZIJRGQOGHFL-INIZCTEOSA-N	431.518	1.317	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc2c(c1)nc(CCC(=O)NNC(=O)CC(C)C)n2C	21904036	AZVFTZSPOLHQEJ-UHFFFAOYSA-N	437.566	1.730	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)CN1C(=O)N[C@@](C)(c2ccc(F)cc2)C1=O	23750560	QSHLPAREZDUBII-GTJPDFRWSA-N	446.410	1.347	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)c1ccc2c(=O)n3c(nc2c1)CCCCC3	26972934	WAROYVKHUTUTCA-LJQANCHMSA-N	434.452	1.724	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CCn2nnc3ccccc3c2=O)ccc1OC(C)C	27238377	XIBCUYSMSJUGOU-UHFFFAOYSA-N	425.445	1.439	50	20	IDGD	
Cc1cc(NC(=O)[C@@H](C)SCC(=O)NNC(=O)c2cc(Br)c[nH]2)no1	28717794	OEYZQGYAEBGKNI-MRVPVSSYSA-N	430.284	1.595	50	20	IDGD	
C[C@@H]1CC(C)(C)C[C@@]2(C1)NC(=O)N(CC(=O)NNC(=O)c1ccc3c(c1)OCCO3)C2=O	105279427	AHCZKRUTKLSMJK-MCMMXHMISA-N	444.488	1.356	50	20	IDGD	
Cc1nc(O)cc(-c2ccc(NC(=O)NNC(=O)CNC(=O)c3cccs3)cc2)n1	725858311	ILTFWTSXOBOCER-UHFFFAOYSA-N	426.458	1.802	50	20	IDGD	
CC(C)CC(=O)N[C@@H](C(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)c1ccccc1	727365840	ZAWCPCHEFLYRDY-LJQANCHMSA-N	435.484	1.598	50	20	IDGD	
Cn1nc(Br)c2c(=O)n(CC(=O)NNc3nc(-c4ccccc4)no3)cnc21	728079653	SLYMMFDQURYPHP-UHFFFAOYSA-N	445.237	1.086	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CC[C@@H](C(F)(F)F)NC1=O)c1cc(F)ccc1Br	728550065	XPECTJPQWCNGIV-XCBNKYQSSA-N	426.164	1.806	50	20	IDGD	
COc1ccccc1[C@H](C)CC(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	728658132	GKSDHIAIQXKTEU-AUUYWEPGSA-N	428.441	1.719	50	20	IDGD	
CCOC(=O)C1=NN(c2ccccc2)[C@H](C(=O)NNC(=O)CNc2ccc(OC)cc2)C1	728713561	WYJYJUOQZKPOIO-IBGZPJMESA-N	439.472	1.453	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)NCCc2ccc(OCCN(C)C)cc2)cc1C	729616219	QWUCSHIXGMKQJY-UHFFFAOYSA-N	441.532	1.755	50	20	IDGD	
O=C(COC(=O)Cc1ccccc1Br)NNC(=O)c1ccc([N+](=O)[O-])cc1	729731749	GELSEJKHNIXMBB-UHFFFAOYSA-N	436.218	1.904	50	20	IDGD	
COc1cc(C=NNC(=O)C(=O)Nc2ccc(C)c(C)c2)cc(OC)c1OCC(N)=O	730550760	HPDUVUNVQACFQZ-UHFFFAOYSA-N	428.445	1.274	50	20	IDGD	
CCCc1c(C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)nnn1-c1cccc(Cl)c1	731571532	DKDOATKXGSCRPW-NSHDSACASA-N	425.898	1.069	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])C[C@@H](C)O1	732264209	REDZSVCTQMCGPU-TXEJJXNPSA-N	448.398	1.796	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)N[C@@H]2CCN(c3ccccc3F)C2=O)cc1C	732892954	KEHZLGCPBSBPPJ-MRXNPFEDSA-N	427.436	1.517	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)CC[C@@H]2NC(=O)N(c3ccc(C#N)cc3)C2=O)cc1C	733774393	NPDBFJWZAKEHMA-IBGZPJMESA-N	449.467	1.607	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)CNC(=O)Cc1cccc2ccccc12	734262465	JYXPTCZVSAOHMU-UHFFFAOYSA-N	443.504	1.354	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)C2(c3cccc(F)c3)CC2)CC1	735116676	BOOYSBMNEZWCJV-UHFFFAOYSA-N	433.509	1.332	50	20	IDGD	
CC[C@@H]1CCCCN1CCNC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	737065634	BQKUJYQYTPVASB-HXUWFJFHSA-N	430.597	1.794	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)NCCN1CCN(c2ccc(F)cc2)CC1	738456788	LZHPKJXOONTIEI-UHFFFAOYSA-N	429.496	1.495	50	20	IDGD	
CC(C)(C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1)c1ccc([N+](=O)[O-])cc1	740394720	LMXVPNKNYXTNGR-QGZVFWFLSA-N	443.412	1.403	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)n1	741330725	RVACEOBHBAXQKE-INIZCTEOSA-N	448.520	1.736	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1)N1CCCC1=O	741745893	IUMWTGLTNLOKEH-IBGZPJMESA-N	447.499	1.550	50	20	IDGD	
O=C(Cc1ccc(NS(=O)(=O)c2ccc(F)cc2)cc1)NNc1ncnc2[nH]cnc12	743471322	ZVTTUQIXHHTWRD-UHFFFAOYSA-N	441.448	1.979	50	20	IDGD	
CC(C)[C@@H](NC(=O)c1cccs1)C(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	743831423	WPSSPYAQMMJUSC-OAHLLOKOSA-N	438.531	1.759	50	20	IDGD	
CCn1c(CCNC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)nc2ccccc21	744305586	DASLHKANPCYEKI-UHFFFAOYSA-N	429.502	1.646	50	20	IDGD	
COc1ccc(CCC(=O)N2CCN(CC(=O)NNC(=O)c3ccc(C#N)cc3)CC2)cc1	744391211	UCVYIDMDDHZFPE-UHFFFAOYSA-N	449.511	1.105	50	20	IDGD	
Cn1c(O)nc2cc(C(=O)NNc3ccccc3S(=O)(=O)N3CCOCC3)ccc21	744620065	BGBKOJYERUTBRP-UHFFFAOYSA-N	431.474	1.057	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)NCCCOC2CCOCC2)c1	745845541	QKGAEFQOTXQBDT-UHFFFAOYSA-N	430.299	1.987	50	20	IDGD	
Cc1cc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)N3CCOCC3)cc2)ccc1F	745992498	BZDKXYJZDJKSEK-UHFFFAOYSA-N	436.465	1.622	50	20	IDGD	
O=C(COC(=O)COc1ccc([N+](=O)[O-])c(F)c1)NNC(=O)c1cccc(Cl)c1	746606720	ZGFDWXDLMQKQLR-UHFFFAOYSA-N	425.756	1.771	50	20	IDGD	
COc1cc(OC)cc([C@@H](NC(=O)NNc2nc(C)cc(OC)n2)c2nccn2C)c1	746747141	LIXFRKVSNODNGJ-QGZVFWFLSA-N	427.465	1.960	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)NC[C@H](c1cccc(F)c1)N1CCOCC1	746755594	GKYOJYXOJVRAGB-LJQANCHMSA-N	440.479	1.420	50	20	IDGD	
NC(=O)C[C@@H]1CCCN(C(=O)NNC(=O)[C@H]2Cc3ccccc3CN2Cc2ccccc2)C1	747497830	BMHXIIXQJWEDGM-SIKLNZKXSA-N	449.555	1.942	50	20	IDGD	
CCOCCCn1c(NNC(=O)[C@H]2CC(=O)N(c3cn[nH]c3)C2)nc2ccccc2c1=O	748851740	LHFIYUKJZBUXAU-AWEZNQCLSA-N	439.476	1.042	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1)N[C@@H]1CC(=O)N(C2CC2)C1	750656271	WWGCHZIKNOGTMY-IFMALSPDSA-N	447.539	1.707	50	20	IDGD	
CN1CC[C@@H](C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c2ccccc21	750712989	BVYNRVIKWHANBU-LJQANCHMSA-N	442.541	1.856	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)[C@H]2CCCN(C(=O)[C@@H](C)CC)C2)c2ccccc2c1=O	751052899	BLTZADCSOINDNH-HOTGVXAUSA-N	441.532	1.852	50	20	IDGD	
Cc1noc(C)c1[C@@H](C)CNC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	752700007	LKRDXUGGPCVSRQ-INIZCTEOSA-N	428.537	1.938	50	20	IDGD	
CCc1cc(Br)ccc1NNC(=O)[C@H]1CC(=O)N(CCN2CCOCC2)C1	753184224	CRYSOJGFOBJEQM-HNNXBMFYSA-N	439.354	1.635	50	20	IDGD	
COC(=O)c1cc2c(cc1NC(=O)C(=O)NNC(=O)Cc1cccc3ccccc13)OCO2	753840743	MZEXOZCMXGJLFH-UHFFFAOYSA-N	449.419	1.684	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)NNC(=O)NC1CCN(S(=O)(=O)C2CC2)CC1	753968214	SOKFSSCLASRACS-UHFFFAOYSA-N	429.930	1.310	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2ccncc2)cc1S(=O)(=O)N1CCCCC1	755412869	IPIOBUYYVFUTEV-UHFFFAOYSA-N	433.490	1.731	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccc(N3CCCC3=O)cc2)c1	755471621	HRPPUHSYAJVFLI-UHFFFAOYSA-N	445.501	1.530	50	20	IDGD	
COc1cc(C=NNC(=O)CN2CCCc3ccccc32)c([N+](=O)[O-])cc1OCC(=O)O	755519404	VCFPHIRQGBIPEE-UHFFFAOYSA-N	442.428	1.970	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)Nc2cccc(S(C)(=O)=O)c2)n[nH]1	755557422	KXNITFXGYYBMNE-UHFFFAOYSA-N	429.458	1.955	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)Nc2ccccc2S(C)(=O)=O)n[nH]1	755584408	AMIPCUBLJQJDIW-UHFFFAOYSA-N	429.458	1.955	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)Nc1cccc(C(=O)N2CCOCC2)c1	755926775	OOAZYCALYWKQKJ-GOSISDBHSA-N	426.429	1.152	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)Nc1ccc(C(=O)NCCc2ccccc2)cc1	756186665	LQRQSFAPZAIZNU-QGZVFWFLSA-N	444.513	1.247	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)c1	756207503	QYYUNLVRQGFNST-UHFFFAOYSA-N	432.502	1.462	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)Nc2ccc(CN3C(=O)CSC3=O)cc2)cc1	756301596	WSVUVCFDEUKVKD-UHFFFAOYSA-N	439.453	1.985	50	20	IDGD	
COCC[S@](=O)Cc1cccc(NC(=O)NNC(=O)c2nnc(O)c3ccccc23)c1	756608469	CFMIKNAODHQWCL-HKBQPEDESA-N	443.485	1.697	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)Nc1cnn(CC(=O)N2C[C@H](C)O[C@@H](C)C2)c1)c1ccccc1	756839710	SCQOTNMQKLEZFK-BXWFABGCSA-N	442.520	1.865	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)Nc1cc(Br)cn(C)c1=O	757590106	FOCZTCDSGLCKLW-UHFFFAOYSA-N	425.239	1.388	50	20	IDGD	
CN1Cc2ccccc2[C@@H](NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)C1	757736074	MNICMPAUIXPWJX-QFIPXVFZSA-N	436.560	1.716	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)Nc2c(C)nn([C@@H]3CCS(=O)(=O)C3)c2C)c1	757871240	FWXFPTZUOLUTLN-MRXNPFEDSA-N	449.533	1.708	50	20	IDGD	
CC(C)n1ncc(C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)c1N	758364350	XHGZGFVAOLIYLW-UHFFFAOYSA-N	433.944	1.278	50	20	IDGD	
CC(=O)N[C@@H](CC(=O)N1CCN(S(=O)(=O)CBr)CC1)c1ccc(C)cc1	758527072	GAMXSBZDHAJFIR-INIZCTEOSA-N	446.367	1.389	50	20	IDGD	
O=C(CCCc1nc(-c2ccc(Cl)cc2)no1)NNC(=O)C(=O)Nc1ccccn1	758841856	WAXGKICJILQEBY-UHFFFAOYSA-N	428.836	1.894	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)C(=O)c2ccc(Cl)s2)cc1	760052403	DMEZIFKPIFLUMH-UHFFFAOYSA-N	429.907	1.361	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)C(=O)NC1CC1)c1nc(-c2ccc(Br)cc2)no1	761792075	OOMIRLOTSLYAAA-QMMMGPOBSA-N	437.254	1.169	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)N2CCC[C@H](n3cc(C(=O)OC)nn3)C2)c1C	762728532	PLYYHDFACXVDHV-LOHYDARVSA-N	440.504	1.900	50	20	IDGD	
C[C@H](NS(=O)(=O)c1ccc(C(N)=O)cc1)C(=O)NNC(=O)c1ccc2ccccc2c1	763025584	UHOMVHADAWCXDP-ZDUSSCGKSA-N	440.481	1.067	50	20	IDGD	
COCCOc1ccc(C(F)(F)F)cc1NC(=O)C(=O)NNC(=O)c1ccccc1O	763530200	STUIFZNKFUAWDH-UHFFFAOYSA-N	441.362	1.836	50	20	IDGD	
COC(=O)c1c(C2CC2)csc1NC(=O)C(=O)NNC(=O)[C@@H]1COc2ccccc2O1	763574867	KVFFBBNCHUDIFO-AWEZNQCLSA-N	445.453	1.338	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cnccc2-c2cccc(F)c2)cc1	763680474	FIGGYPSAXVTKRS-UHFFFAOYSA-N	433.399	1.924	50	20	IDGD	
Cn1nc2c(c1NC(=O)C(=O)NNC(=O)COc1ccccc1Cc1ccccc1)CCC2	763718889	QMNAJLLHYOYHOB-UHFFFAOYSA-N	447.495	1.665	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)C(=O)Nc1ccc(F)cc1OCC(F)F	763791569	VVVXSVYXABSSCE-UHFFFAOYSA-N	449.345	1.518	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)C(=O)Nc1ccc(-n2cccn2)c(F)c1	763806141	ZWCHSVUASHJMIW-UHFFFAOYSA-N	442.363	1.085	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccc(Cl)c1-n1cccn1	763806855	FSQLTYHTZQUZBO-UHFFFAOYSA-N	438.831	1.562	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)N(C)C)cc2)cc1	763860435	GYJJCMFRXVJWMW-CQSZACIVSA-N	442.472	1.341	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(C(C)=O)cc2)c(OC)c1	763872611	OZIJUEMSIQZZMA-CYBMUJFWSA-N	429.429	1.460	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)nc(C)n3C)cc1	763876506	FYZBQOATRSCWFO-CYBMUJFWSA-N	437.456	1.638	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)C(=O)Nc1ccn(CCC#N)n1	763882502	JMHPNLCGUPSUMV-NSHDSACASA-N	449.265	1.113	50	20	IDGD	
COc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NNC(=O)CSc1ccc(C)cc1	763897840	HAAHFOWLPXVROZ-UHFFFAOYSA-N	444.513	1.584	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3ccc(OCCC(N)=O)cc3)cc2C1	763938126	ANADMMUNOKZBDQ-GFCCVEGCSA-N	444.513	1.527	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)C(=O)Nc1cccc(C(F)(F)F)c1	763947935	FWKJTEDYFJQCOS-UHFFFAOYSA-N	433.346	1.996	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)C(=O)Nc1ccc(SC2CCCC2)cc1	764001890	GMGUCDNGDJROBU-LBPRGKRZSA-N	425.532	1.242	50	20	IDGD	
CC(C)OCc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1	764076514	AOTBJHPLOVEWRY-UHFFFAOYSA-N	433.486	1.415	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cccc(OCCNC(=O)OC(C)(C)C)c2)n[nH]1	764097545	FOJMMRUOMBBXIT-UHFFFAOYSA-N	446.464	1.021	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(C#N)cc2)cc1OCC(F)(F)F	764181915	IRMXHTIXTGBGIU-UHFFFAOYSA-N	436.346	1.908	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)CCc2ccccc2)c(OC)c(OC)c1	764186075	VAIAZLJKUFUUHW-UHFFFAOYSA-N	429.429	1.209	50	20	IDGD	
COC(=O)c1ccc(-n2cc(C)cn2)c(NC(=O)C(=O)NNC(=O)c2cccc(C#N)c2)c1	764234840	LJOCWJRVKDKGHL-UHFFFAOYSA-N	446.423	1.239	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1ccccc1C#Cc1ccccc1	764275118	JKRRONCCWAMMJI-UHFFFAOYSA-N	429.432	1.957	50	20	IDGD	
Cc1cc(C(=O)N2CCCC2)ccc1NC(=O)C(=O)NNC(=O)Cc1ccccc1F	764314353	UWMASSJHMWBUAH-UHFFFAOYSA-N	426.448	1.699	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)C(=O)Nc2ccc(F)c(NC(=O)C3CCCCC3)c2)cn1	764362890	JZYJDWDRCNUYNB-UHFFFAOYSA-N	430.440	1.478	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)[C@H](C)NS(=O)(=O)c2ccc(C#N)cc2)cc1	764566727	OJCYLOUASHBIGJ-AWEZNQCLSA-N	432.527	1.473	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNS(=O)(=O)c1cc2c3c(c1)CC(=O)N3CCC2	764932544	OGKRRMUTMVCISY-UHFFFAOYSA-N	445.497	1.309	50	20	IDGD	
COc1cc2c(cc1OC)CN(C(=O)CCC(=O)NNC(=O)NCc1ccco1)CC2	765119015	KIZRYUCWNTWEOF-UHFFFAOYSA-N	430.461	1.492	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)[C@H]2CC(=O)N(Cc3ccccc3)C2)n[nH]1	765598744	DDHINSRERKZJJO-INIZCTEOSA-N	433.468	1.895	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCC2(N3CCOCC3)CC2)ccc1OCCC(C)C	765642854	XFJYCSOUSHMEST-UHFFFAOYSA-N	434.537	1.929	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)c1cc(I)cc([N+](=O)[O-])c1	765811867	PNASCCQEUSRWNY-UHFFFAOYSA-N	426.170	1.598	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@@H](C)OC[C@H]3CCCCO3)CC2)cc1	766650955	YCIGFBPABCGNNV-TZIWHRDSSA-N	432.565	1.234	50	20	IDGD	
CC(C)(C)N1C[C@H](C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)CC1=O	766663354	KFGYNIQZCMTLIY-QGZVFWFLSA-N	449.983	1.252	50	20	IDGD	
CCOc1ccc(NC(=S)NNC(=O)CNC(=O)CNC(=O)OC(C)(C)C)cc1	767147429	AXJZWJPURHBTSR-UHFFFAOYSA-N	425.511	1.044	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2ccnn2C2CCCC2)CC1	768092972	FHSMOWHMUCQRLL-UHFFFAOYSA-N	433.538	1.086	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C)c(NC(=O)CCN(C)C)c2)cc1	768236458	CMXCEBVDRGLJOZ-UHFFFAOYSA-N	439.516	1.847	50	20	IDGD	
CCN1CCC[C@H]1CN1C[C@H](C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)CC1=O	768279295	MBNUGRCJNNGIGH-WBVHZDCISA-N	442.495	1.310	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)Sc1nnc(-c2cc(-c3ccc(OC)cc3)[nH]n2)n1N	768451836	KIHFFRMAJBPRCG-JTQLQIEISA-N	430.494	1.096	50	20	IDGD	
O=C(CCc1ccccc1O)NNS(=O)(=O)c1sc(C(=O)O)cc1Br	769633789	PDTITXJTBYVUIM-UHFFFAOYSA-N	449.304	1.857	50	20	IDGD	
O=C(NNC(=O)c1ccc(N2CCCc3ccccc32)cc1)N[C@H]1CCS(=O)(=O)C1	770156894	LAYUCZMGOMHVOX-KRWDZBQOSA-N	428.514	1.902	50	20	IDGD	
CSCCNC(=S)NNC(=O)[C@H]1CS[C@@]2(c3ccc(F)cc3)CCC(=O)N12	770241166	VUQTWVBLARLEBY-CXAGYDPISA-N	428.580	1.575	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)NNC(=O)c1cc(Br)c[nH]1	770480971	MMZZITKEYGOOEL-QMMMGPOBSA-N	444.673	1.873	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2c(F)cccc2Cl)cc1	770812157	GYSDLWGTHMPJDD-UHFFFAOYSA-N	444.872	1.486	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)c3ccc(=O)n(Cc4ccccc4)n3)nc21	770967731	SMOBPKUAEXFBEQ-UHFFFAOYSA-N	434.460	1.649	50	20	IDGD	
COc1ccccc1N1C[C@@H](C(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)CC1=O	770968247	UBTIWIQMHGKVLQ-LBPRGKRZSA-N	439.476	1.792	50	20	IDGD	
Cc1ccc(C(=O)NNS(=O)(=O)c2cc(C(=O)O)c(F)cc2Br)c(O)c1	771142453	JXEQLACMXOEOCG-UHFFFAOYSA-N	447.238	1.924	50	20	IDGD	
Cc1ccccc1[C@@H](CC(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1)NC(N)=O	772195601	AADVDRPCCNXANJ-MRXNPFEDSA-N	431.880	1.212	50	20	IDGD	
CC(C)c1nccnc1NNC(=O)CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1	772815137	JLOHVTHWPBFWEI-UHFFFAOYSA-N	433.412	1.920	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)N1CCO[C@@H](CNC(=O)OC(C)(C)C)C1	773130039	AMVMFMMJSIXQDW-AWEZNQCLSA-N	432.481	1.223	50	20	IDGD	
Cc1nc(-c2ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc3cccc(Cl)c3)cc2)n[nH]1	774002170	NMDWCXYFARMTNH-NSHDSACASA-N	442.863	1.987	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cc(OC)c1	775403524	NZVCDCPQNNQPFE-UHFFFAOYSA-N	441.488	1.315	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@@H]2CCC[C@H]2OC)c1	775461233	UXEJKXVFRVEXEG-DOTOQJQBSA-N	426.539	1.476	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)[C@@H]2CCCCN2S(=O)(=O)c2ccccc2)c1	776540249	STSORSLBRQPBJZ-SFHVURJKSA-N	437.543	1.777	50	20	IDGD	
Cc1cc(Br)cc(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)c1	777142086	XGCCHPOTFLMVHY-UHFFFAOYSA-N	431.246	1.794	50	20	IDGD	
Cc1cc2c(cc1C)C(=NNC(=O)Cn1cnc3c1c(=O)n(C)c(=O)n3C)CCS2	777443002	MFXANYNNCYYNGI-UHFFFAOYSA-N	426.502	1.067	50	20	IDGD	
COC(=O)Nc1ccc(S(=O)(=O)NNC(=O)c2cn(C)c3ccccc23)cc1[N+](=O)[O-]	777599185	OOKAEQYYFKFPAO-UHFFFAOYSA-N	447.429	1.888	50	20	IDGD	
O=C(NNC(=O)[C@@]12CCC(=O)N1c1ccccc1C(=O)N2C1CC1)c1cccc([N+](=O)[O-])c1	777838376	YBCLYODXKFJZAM-JOCHJYFZSA-N	449.423	1.497	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)[C@@H]2CCCCN2S(=O)(=O)c2ccccc2)nc1C	778421613	OMXFLOHLNHZJMD-KRWDZBQOSA-N	447.517	1.648	50	20	IDGD	
O=C1Cc2cc(NC(=O)C(=O)NNc3ccc([N+](=O)[O-])cc3Br)ccc2N1	778754082	WPGXLNJIAOLYMC-UHFFFAOYSA-N	434.206	1.934	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)[C@H](C)NC(=O)CC(C)(C)C)n[nH]2)cc1OC	779040757	LKFYPPBWOFRRTM-LBPRGKRZSA-N	431.493	1.796	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)c2cnn(Cc3ccc(OC)c(OC)c3)c2)nc1C	779056804	XMKCQZPUSMNMKI-UHFFFAOYSA-N	440.460	1.981	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)N[C@@H]2CCCN(c3ccc(C#N)cc3)C2=O)cc1	780895359	ZJEXYRUXRCAKGL-LJQANCHMSA-N	432.440	1.335	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(C(=O)NNc2ncncc2Cl)cc1Br	781830334	UMLAHYUKFMDPSY-UHFFFAOYSA-N	434.703	1.900	50	20	IDGD	
O=S(=O)(CBr)NCCCCCCNS(=O)(=O)CBr	782473137	UWAXJGIDSTUVOS-UHFFFAOYSA-N	430.184	1.090	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(N2CCOCC2)c(NC(=O)NNC(=O)C(C)C)c1	782537388	JJXGSFSOLNWBOJ-UHFFFAOYSA-N	441.554	1.362	50	20	IDGD	
CCN1CC[C@@H](NC(=O)NNC(=O)C(=O)N2CCCC2)[C@H]1c1cc(F)c(F)c(F)c1	782760063	OKOZRTVQPRQZTC-GDBMZVCRSA-N	427.427	1.192	50	20	IDGD	
CCN(CC)C(=O)COc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(O)cc2)c1	782835710	CIZGHGUZMZCGNR-UHFFFAOYSA-N	428.445	1.039	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)CCC2	782897162	VHCGWYBJLSLRKT-UHFFFAOYSA-N	429.502	1.177	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NN[C@]2(C)CCS(=O)(=O)C2)cc1OC1CCCC1	783427366	RTUGBBUNOOXPOX-LJQANCHMSA-N	425.507	1.153	50	20	IDGD	
CC[C@H](C)NS(=O)(=O)Cc1cccc(NC(=O)C(=O)NNc2ccc(Cl)nn2)c1	784786309	PDRPBAALHNNMMO-NSHDSACASA-N	440.913	1.430	50	20	IDGD	
COc1cccc(NNC(=O)C(=O)Nc2ccc3c(c2)CCN3C(=O)c2cccnc2)n1	784844411	WETVJXOEFWZMEA-UHFFFAOYSA-N	432.440	1.770	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)C(=O)Nc2cc(C(=O)OC)ccc2N2CCCC2)c1	784854344	WKLKNBRJNBUZBH-UHFFFAOYSA-N	440.456	1.942	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)cc1O	791243773	RASJPDZTEIWLTB-UHFFFAOYSA-N	447.513	1.115	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)CN2CCN([C@H](C#N)c3cccc(Cl)c3)CC2)cc1	791625591	SFERDAHTGSHWGF-HXUWFJFHSA-N	436.903	1.855	50	20	IDGD	
COc1cc(C(F)(F)F)ncc1NC(=O)C(=O)NNC(=O)Cn1ccc2ccccc21	792268338	MDSVQWSKSSWUMD-UHFFFAOYSA-N	435.362	1.850	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)NNC(=O)[C@@H](C)Oc2cccc(Br)c2)n1	792780811	SNENGSGSWOXUBW-LLVKDONJSA-N	436.266	1.595	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1cccc(Br)n1	793054027	RNYBZVOKIXWVIT-UHFFFAOYSA-N	443.279	1.338	50	20	IDGD	
Cc1cc(Cn2nnc(C(=O)NNC(=O)COc3ccc(Br)cc3)c2C)on1	794208941	CEZUINARYZBFPS-UHFFFAOYSA-N	449.265	1.534	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)c1ccc(Cl)c(S(C)(=O)=O)c1	795161333	MOLVKUGTSYLPCN-UHFFFAOYSA-N	431.923	1.751	50	20	IDGD	
Cc1cc(NC(=O)[C@@H](C)SCC(=O)NNc2ccccc2S(=O)(=O)N(C)C)no1	795177871	SKXWAWQZHHKNIL-GFCCVEGCSA-N	441.535	1.437	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)CNC(=O)c2c[nH]c3ccccc3c2=O)c2ccccc2n1	799008065	LYCKFOGPBAPXFR-UHFFFAOYSA-N	429.436	1.576	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2c(F)ccc([N+](=O)[O-])c2C)cc1OC	800623143	HUNLEWWELMLWHC-UHFFFAOYSA-N	434.380	1.849	50	20	IDGD	
COc1ccc(-n2cnnc2SCC(=O)NNC(=O)C(=O)Nc2ccc(C)cc2)cc1	801109082	FNJZCOVFMQEOPF-UHFFFAOYSA-N	440.485	1.463	50	20	IDGD	
O=C(CCNS(=O)(=O)/C=C\c1ccccc1)NNC(=O)Nc1ccc2c(c1)OCO2	802100697	YLTWQWRZDNYOIC-LUAWRHEFSA-N	432.458	1.548	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)CC[C@H]2NC(=O)N(c3ccc(C#N)cc3)C2=O)cc1	802117633	WVYIKQBVISXJMT-GOSISDBHSA-N	449.471	1.682	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)[C@@H](O)c1cccc(C(F)(F)F)c1	802998547	LTNWNNIJLJEJOS-AWEZNQCLSA-N	429.782	1.856	50	20	IDGD	
CCCN(NC(=O)[C@H]1CC(=O)N(c2cccc(S(N)(=O)=O)c2)C1)C(=O)OC(C)(C)C	804594783	RAONWNYMKVKNKT-ZDUSSCGKSA-N	440.522	1.365	50	20	IDGD	
CN(Cc1nc(-c2cccs2)no1)C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	804868123	WQXXAMDHCOYDIL-UHFFFAOYSA-N	425.434	1.260	50	20	IDGD	
CS(=O)(=O)Nc1cc(C(=O)NNc2ccc(-n3ccnc3)nn2)cc(C(F)(F)F)c1	804953406	OPYBVDZVTHTNBN-UHFFFAOYSA-N	441.395	1.810	50	20	IDGD	
CNS(=O)(=O)c1cc(NC(=O)NNC(=O)c2cc(OC)cc(OC)c2)ccc1F	806544656	LDSXJKSOEJOMCR-UHFFFAOYSA-N	426.426	1.218	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCC[C@H](C)C2)cc1	807369308	RTTDXTHLEHPEQC-HNNXBMFYSA-N	441.550	1.657	50	20	IDGD	
CC(=O)c1cccc(S(=O)(=O)NCC(=O)NNC(=O)c2cccc3ncccc23)c1	810360120	DSLDJFPTVMCDBO-UHFFFAOYSA-N	426.454	1.177	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)CNS(=O)(=O)c3cccc(F)c3)n[nH]2)c1	810583712	GFUJUANFWHHBLA-UHFFFAOYSA-N	445.476	1.572	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)c2c(I)cnn2C)c1C	814102832	QWNWKCLXRYGGCS-NSHDSACASA-N	442.257	1.870	50	20	IDGD	
O=C(NNc1cccc(Cl)n1)C(=O)N1C[C@@H](C(=O)N2CCCCC2)Oc2ccccc21	815728101	SFNQNOWSVBNCSG-INIZCTEOSA-N	443.891	1.985	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)/C=C\C(=O)Nc1ccc2n[nH]cc2c1	817053777	GDARBXNYFQZOQN-KTKRTIGZSA-N	428.474	1.451	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1cn(Cc2ccccc2)nn1	817737458	LFROUTILTPLWPZ-UHFFFAOYSA-N	443.847	1.606	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)c1cccc(OC[C@@H]2CCCO2)c1	844256636	DJWVUXZRBNAZBX-INIZCTEOSA-N	432.502	1.612	50	20	IDGD	
O=C(COc1ccc(Oc2ccccn2)cc1)NNC(=O)c1ccc(-n2cnnn2)cc1	894394293	KWMQGPLACSDDTF-UHFFFAOYSA-N	431.412	1.690	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)Cc1ccc(S(=O)(=O)N2CCCCC2)cc1	910775091	BJZVXHFNFKVMCU-UHFFFAOYSA-N	449.504	1.769	50	20	IDGD	
CC[C@H](C)NC(=O)CN1CCN(C(=O)/C(C#N)=C/c2cc(C)n(CCOC)c2C)CC1	913017804	YDWSFUAMIGOSPJ-JPOGYNCRSA-N	429.565	1.717	50	20	IDGD	
COc1ccccc1NC(=S)NNC(=O)[C@H]1CC(=O)N(c2ccc3c(c2)OCCO3)C1	913440918	HLEOINYCVHTXND-ZDUSSCGKSA-N	442.497	1.837	50	20	IDGD	
CN1CCN(c2cc(CNC(=O)NNC(=O)CCSc3ccc(F)cc3)ccn2)CC1	916389835	GGJNVGCFUVNDNE-UHFFFAOYSA-N	446.552	1.985	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1	916734381	JVFPEJZYYVXHJQ-UHFFFAOYSA-N	430.446	1.752	50	20	IDGD	
O=C(CC(F)(F)F)NNC(=O)c1ccc(Cl)c(S(=O)(=O)NC[C@H]2CCCO2)c1	918363853	DPKMTCLPEXSIOT-SNVBAGLBSA-N	443.831	1.511	50	20	IDGD	
CCCCS(=O)(=O)N1CCC(C(=O)OCC(=O)NNC(=O)c2ccc(C)cc2)CC1	919362173	RPRWKOSBANAQTE-UHFFFAOYSA-N	439.534	1.141	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@H](C)Cn2cccn2)c1	919778469	CITMXRHOSFDRBF-HNNXBMFYSA-N	436.538	1.194	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)c1cc(S(=O)(=O)N(C)C(C)C)ccc1F	920007146	DEFZPLDNQLKULW-UHFFFAOYSA-N	437.493	1.867	50	20	IDGD	
CN(C)C(=O)CCNC(=O)/C(C#N)=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	920850859	FBAYDKJJTVKBJT-RVDMUPIBSA-N	442.907	1.580	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)Nc1nc(CN2C[C@H](C)O[C@H](C)C2)cs1	920930483	KEUJNNFAPHQPCI-OKILXGFUSA-N	449.533	1.993	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(CC(=O)NNC(=O)c2ccc(Br)cc2)CC1	1261847362	SWELOBCAXIZUGZ-UHFFFAOYSA-N	441.326	1.763	50	20	IDGD	
COC(=O)C1(c2ccc(S(=O)(=O)NNC(=O)c3cncn3-c3ccccc3)cc2)CC1	1319954348	LCOVTPSDXTWUDW-UHFFFAOYSA-N	440.481	1.700	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CN2CCN(C(=O)Nc3ccc(Cl)cc3)CC2)c1	1320309236	UMZPWGZNOJNWOW-UHFFFAOYSA-N	440.891	1.822	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4ncnn4c3)C2)C1	1778735511	ARMHMTCZBLOSOD-UGSOOPFHSA-N	436.310	1.204	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(-c4ccccn4)[nH]n3)C2)C1	1779632269	YOMSJYWTQWTFIO-XOBRGWDASA-N	433.896	1.169	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)c1ccoc1Cl	1780258096	WHZIFPQOMWZSHY-DYESRHJHSA-N	446.696	1.054	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)N1CCO[C@@]2(CCN(C(=O)[C@](C)(Cl)CCl)C2)C1	1781231776	FHICZSDNDQPJPU-MSOLQXFVSA-N	438.352	1.577	50	20	IDGD	
O=C(COc1ccc(F)cc1)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781328653	VJBZZEAYWAEZEP-RDJZCZTQSA-N	433.249	1.725	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2)c1n[nH]c2cccc(F)c12	1781391515	UTIXICIKOLMTOG-STXHMFSFSA-N	438.887	1.429	50	20	IDGD	
O=C(c1ccc(Br)cc1O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1781522085	AGNUKANYWDOVRA-WMLDXEAASA-N	447.713	1.198	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2)[C@H]1CCc2ccccc2C1	1781937180	XZZKACHILXZIKS-XFGYDDDFSA-N	434.964	1.905	50	20	IDGD	
COc1cc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](F)Cl)CCO3)c(F)c(OC)c1F	1781950301	FLZQMMASBKOOFT-CRAIPNDOSA-N	436.814	1.960	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCc1cncnc1)C2	1781998225	PQMSBPZQJMCGJF-ZSZQSSIHSA-N	439.354	1.707	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(O)nc(O)c3)CCO2)C1	1783343509	VBOPSTWKFDAGDL-PXAZEXFGSA-N	428.283	1.110	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)Cn3nc(C)cc3C)CCO2)C1	1783344091	MZUVKAWHRCALBO-MAUKXSAKSA-N	427.343	1.503	50	20	IDGD	
CCOc1ccsc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](Cl)COC)C[C@@H]21	1783396646	UXEZGPIEZAHCEX-AYDFFVQHSA-N	430.954	1.994	50	20	IDGD	
COc1ccc(Cl)cc1CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]2C1	1784094983	XXJONTYGXNWDPL-RPZXMPESSA-N	445.343	1.471	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H]3CCc4nc[nH]c4C3)C2)C1	1784353054	SJDWSQPWYODPJH-TYILLQQXSA-N	439.354	1.518	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3n[nH]c(C4CC4)c3F)[C@H]2C1	1785768395	WSFSJGYDVZJCSA-BQUFFADESA-N	443.317	1.803	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(C(F)(F)F)nc3)[C@H]2C1	1786099577	OZQUHSIPCDOFHD-AJNGGQMLSA-N	449.857	1.948	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN3CCCCC3)[C@H]2C1	1786715459	UUVJDOTVCIRJHN-NXOAAHMSSA-N	430.387	1.626	50	20	IDGD	
Cc1nnsc1C(=O)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1	1788756880	BINNKKNMSRXEPU-UHFFFAOYSA-N	436.302	1.588	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccn(CC)n3)C[C@@H]21	1790961640	SOUVIRFKYXMXJO-AYDFFVQHSA-N	427.343	1.670	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4cnccc4[nH]3)C[C@@H]21	1791056163	PGCVFTMTDJKCPN-NVNVUAJTSA-N	435.322	1.940	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3coc([Si](C)(C)C)c3)C[C@@H]21	1791255049	BNXRTVHKDJNBPZ-LLLHUVSDSA-N	443.016	1.672	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](CCO)NC(=O)OC(C)(C)C	1793250843	HYSBJRXNSQOBKJ-QRJUGERDSA-N	431.961	1.918	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)COc1ccc(Cl)c(F)c1	1793294635	FHCDBYTVWXDKJO-TYYYEBLRSA-N	449.306	1.701	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cn1nc(C)cc1C	1794123298	QCBPTPDGLWFTNM-IVSAIRAKSA-N	427.343	1.263	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccno1	1794737097	NMJQSKISDGWLCU-XFMPKHEZSA-N	442.900	1.010	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc(F)cc1F)C2	1795116396	FYFRETKQPKLEEB-IVWMJMPLSA-N	431.277	1.882	50	20	IDGD	
Cc1nc2ccncc2cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1	1796189032	OCZMIOIMEBTMEU-ACDBMABISA-N	444.300	1.184	50	20	IDGD	
C[C@@H](C#N)c1cccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)c1	1796190692	ZFBGCRFDBHWEKD-RWXMBLCBSA-N	431.301	1.559	50	20	IDGD	
Cn1cnc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)C(C)(C)CCl)C3)c1C(F)(F)F	1796601774	JDXFDOZXADAKKY-ZSBIGDGJSA-N	436.862	1.907	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc3ccnn13)C2	1796893532	FMIBMWXCCGSSGM-SSYSSCGSSA-N	447.499	1.720	50	20	IDGD	
Cc1ccn2c(=O)c(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)C(C)(C)CCl)C4)cnc2c1	1797065988	XJWUGTQDYGMHGG-JLVBRIDZSA-N	446.935	1.471	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cccc([N+](=O)[O-])c1)C2	1797952771	AWGOAFMZQAQRIK-CWPLJXCYSA-N	435.553	1.578	50	20	IDGD	
COc1nc(C)ccc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2	1798249797	VFHKDVVHJOHVCK-ZMJPVWNMSA-N	430.274	1.292	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](NC(C)=O)c1ccc(F)cc1)C2	1799269378	YGZIKAGCAHZKKB-PTIUUAQKSA-N	439.915	1.610	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCCNC(=O)OC(C)(C)C)C2	1799273862	RPVYRPAOVRWPEL-JYYAWHABSA-N	431.961	1.898	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCOc1ccccc1)C2)[C@H](F)Br	1799347738	RIYFRXFEJSIEMM-RMHZUWNSSA-N	429.286	1.736	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(-n2cccn2)cc1	1799601078	SSULZUHFGNZSBG-UKBAYJJMSA-N	432.908	1.329	50	20	IDGD	
CC#C[C@H](CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](Cl)COC)c1ccc(O)cc1	1800981815	SGUPVUULPOKUAJ-FHZCGSGISA-N	448.947	1.733	50	20	IDGD	
CC#C[C@H](CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)c1ccc(O)cc1	1801055970	UXJCJZMYSZTCDB-VAVQPMOSSA-N	434.920	1.079	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCC(=O)NN(C)C	1802336712	VSQTZWPUKVIDMT-BJWYYQGGSA-N	426.521	1.268	50	20	IDGD	
COc1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CCC(=O)NN(C)C)ccc1[N+](=O)[O-]	1802343352	BNSXSJYRQHKSPB-MUJYYYPQSA-N	447.492	1.228	50	20	IDGD	
N=C(N)SCCC(=O)N1CC[C@@H](CNC(=O)CCBr)[C@@H]1c1cccnc1	1806340864	PASPNQFYUXXSIY-BBRMVZONSA-N	442.383	1.889	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]1c1cccnc1)n1cnnn1	1808317709	ZJYPNPWXURRPOU-DRRHNWJESA-N	440.335	1.571	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)C(C)(F)F)[C@H]1c1cccnc1	1808414479	JESIEOUDLIHSPO-KNRTUPFFSA-N	446.458	1.877	50	20	IDGD	
CCC(=O)C(=O)N1CC[C@H](CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@H]1c1cccnc1	1808416104	DRVCWKPAGMBQCS-JMBUVSEHSA-N	438.488	1.201	50	20	IDGD	
Cc1cc(C(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@H]2c2cccnc2)ncc1[N+](=O)[O-]	1808659563	LIOFBGIVOLJUKN-QGTPRVQTSA-N	447.879	1.613	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCC2(CCCN(C(=O)CNC(=N)N)C2)CC1	1809697587	ZPDHJCBGUXRXNY-MHWRWJLKSA-N	444.486	1.586	50	20	IDGD	
COc1ccc(C(=O)NC[C@@H]2CCN(C(=O)CCBr)[C@H]2c2cccnc2)nn1	1811205214	HWZFCYAPRXQXIS-KSSFIOAISA-N	448.321	1.985	50	20	IDGD	
COC(=O)C1(C(=O)NC[C@@H]2CCN(C(=O)CO[Si](C)(C)C)[C@H]2c2cccnc2)CC1	1812689466	FLBYRVSAPUHYGB-WMZOPIPTSA-N	433.581	1.892	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H](CNC(=O)CCn2cncn2)[C@@H]1c1cccnc1	1813316864	YDCUVXRHAVFPGN-KYJSFNMBSA-N	449.353	1.800	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)C23CC(C2)C3)[C@H]1c1cccnc1	1813644440	KFYSQYVFGJGFIL-ARTHDXMKSA-N	434.500	1.200	50	20	IDGD	
CN1CCN(CCC(=O)Nc2nc3c(s2)C[C@@H](NC(=O)C(Cl)Cl)CC3)CC1	1814586520	SLKLZZRJLNUBOV-NSHDSACASA-N	434.393	1.496	50	20	IDGD	
Cc1nc2ncccn2c1C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](O)CCl)n[nH]1	1814871292	LXVVQYFPBVKABW-UONOGXRCSA-N	431.884	1.666	50	20	IDGD	
O=C(CCC(F)(F)F)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1	1815354929	XMRYLFVEBCTLRB-LBPRGKRZSA-N	441.240	1.391	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnc(N)s2)n[nH]1	1817417785	NXPBQNHOQSETOF-LBPRGKRZSA-N	434.526	1.127	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@@H]2CCCSC2)[nH]n1)c1ccc(B(O)O)cc1	1817475050	KHMCWJDSBCQUSI-CRAIPNDOSA-N	442.350	1.539	50	20	IDGD	
Cc1nc[nH]c1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1818272378	NXHUGTYXSYRYBG-OAHLLOKOSA-N	437.464	1.059	50	20	IDGD	
CC(C)/C=C/C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819404409	JCXSIVANHOQXHR-DKRLNXSXSA-N	425.493	1.926	50	20	IDGD	
CC(C)[C@H](S)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1	1819793138	LKBALAQXKBFEGS-BMIGLBTASA-N	448.574	1.322	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)C2CN(C)C2)n[nH]1	1822999785	VAQQGJFFUDUVFB-PDERCVKFSA-N	440.508	1.097	50	20	IDGD	
CC[C@@H](NC(C)=O)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](C)Br)sc2C1	1825635959	NEJDBWJGVPGGRA-JMJZKYOTSA-N	431.356	1.753	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(=O)n1O)CC2	1825637162	TUZMMKZUMVDQHK-RKDXNWHRSA-N	441.307	1.551	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cn(C(C)(C)C)nn1)CC2	1826004133	XILYXOJOWCNEGY-MNOVXSKESA-N	440.957	1.969	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2n[nH]cc2[N+](=O)[O-])CC1	1829163786	NMGQIVYQZATDMW-KBPBESRZSA-N	427.889	1.805	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C4CC4)on3)C2)C1	1830353905	MFQHMHOBWHVZCC-HXUWFJFHSA-N	425.913	1.887	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H]2CCC(=O)NC2)CC1	1831649749	NGABTZQKULAJTE-CWRNSKLLSA-N	428.371	1.916	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccn4cncc34)C2)C1	1831650396	HENZZPHSZCBFRV-UTKZUKDTSA-N	434.924	1.812	50	20	IDGD	
CC(=O)C[C@@H](C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1	1831798432	BVNRTTBNYLTYJG-IIBYNOLFSA-N	428.338	1.215	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)[C@H]2CC[C@H](O)CC2)CC1	1831997273	QUOPBNHGTMHSOH-VAMGGRTRSA-N	436.597	1.530	50	20	IDGD	
CC(C)(C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)CCl)CC2)CC1)c1ccccn1	1833313050	RSBCQYXAMHQWRP-GOSISDBHSA-N	436.984	1.531	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1)c1cccnc1	1834134819	GTMUHPMOULEVKJ-MRXNPFEDSA-N	427.318	1.957	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@](C)(Cl)CCl)C3)C2)nc1	1834379008	MOQHKPPPWCZDDY-MOPGFXCFSA-N	430.332	1.696	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)Cn3cc(C)cn3)CC2)CC1	1834894661	KDUZPUZPJHOMJU-SFHVURJKSA-N	425.961	1.017	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccc(F)cn3)CCO2)C1	1836028191	UXDDUIUBUBSQFU-FQEVSTJZSA-N	427.904	1.485	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)C/N=C/c3ccco3)CCO2)C1	1837566738	JNWUEFIORDGASU-BVWGDMACSA-N	446.331	1.391	50	20	IDGD	
O=C(CCBr)N1CCC(OC2CCN(C(=O)Cc3cc[nH]n3)CC2)CC1	1837655049	NODCHDRJERXGBW-UHFFFAOYSA-N	427.343	1.736	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCC(OC2CCN(C(=O)C3=NNC(=O)C3)CC2)CC1	1838379800	CYSLGZZZHITWIQ-SFHVURJKSA-N	433.336	1.097	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)c3ccnnc3O)CC2)CC1	1838516098	YUJCNIRNZNJPFT-LBPRGKRZSA-N	441.326	1.578	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3c(C)nc4sccn34)C2)C1	1839146218	WUMZKROSVYGIPH-AUUYWEPGSA-N	440.953	1.792	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(NC(C)=O)cc3)C2)C1	1839148646	FIYBCHHYVQJVOH-NQIIRXRSSA-N	437.924	1.732	50	20	IDGD	
CC(C)(C)[C@@H](O)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2	1839150387	KYBUNEQMRGFTBE-KKXDTOCCSA-N	425.353	1.086	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cncc(O)c3)C2)C1	1839155634	ZOTMKMSVFUYHFV-ZWKOTPCHSA-N	432.304	1.094	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@]2(C(=O)N3CC4(CCCN4C(=O)[C@@H](O)CCl)C3)C[C@@H]2C1	1841353498	AHKMOCLQQVVCJT-WIEQDCTASA-N	441.956	1.437	50	20	IDGD	
CC(=O)C(C)(C)C(=O)N1CCCC12CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1841511174	KBPVWCJSYGLGOG-AWEZNQCLSA-N	429.945	1.937	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)COc2cccc3ccccc23)C1	1841880928	GDFAVZZNNGWCNQ-UHFFFAOYSA-N	444.296	1.416	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCCC12CN(C(=O)c1ccc(CO)o1)C2	1841924614	HEGMWMYKEHYKKE-AWEZNQCLSA-N	441.912	1.721	50	20	IDGD	
Cn1c(C(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)cc2ccccc21	1844264130	IEEHENFPYZEJMM-UHFFFAOYSA-N	432.484	1.308	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)c2cc[n+]([O-])cc2)C1	1844598866	ICTWQTOSDABFEV-UHFFFAOYSA-N	440.412	1.284	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC12CN(C(=O)C1CN(C(=O)OC(C)(C)C)C1)C2	1846177519	UNPBXQZIYOTPOX-GFCCVEGCSA-N	430.343	1.840	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@H]1C[C@@H]3C[C@@H]3N1C(=O)OC(C)(C)C)C2	1846360494	PGULBBMVQVAKKQ-FZKCQIBNSA-N	441.956	1.842	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)Cc1n[nH]c3cc(Cl)ccc13)C2	1846385543	RRQJSZSMZOCOCF-UHFFFAOYSA-N	446.939	1.335	50	20	IDGD	
CC(=O)Nc1ccc(Cl)c(C(=O)N2CC3(CCCN3C(=O)CCC(=O)NN(C)C)C2)c1	1846386492	ROBLRGQWTCDBDX-UHFFFAOYSA-N	449.939	1.488	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](O)CCl)C[C@@H](F)C1	1847558826	FVLVSYWKVAPUIN-XFIYOXNOSA-N	447.935	1.383	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCc2ccc(N3CCOCC3)nc2)cc(OC)c1OC	9810156	ACSDPWIJHATPDI-UHFFFAOYSA-N	445.476	1.088	50	20	IDGD	
COc1cccc(-c2nn(Cc3ccccc3)cc2C(=O)NNC(=O)C(=O)NC2CC2)c1	10213717	MJDMZWLULQLKRJ-UHFFFAOYSA-N	433.468	1.647	50	20	IDGD	
O=C(CN1CCN(S(=O)(=O)c2ccc(Cl)cc2)CC1)NNC(=O)c1cccs1	15410567	LVZZPELZGAQVQR-UHFFFAOYSA-N	442.950	1.169	50	20	IDGD	
Cc1nn(Cc2ccccc2)c(Cl)c1C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	23787474	PZLLDNGKENHBJL-UHFFFAOYSA-N	436.863	1.944	50	20	IDGD	
C[S@@](=O)Cc1cccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1	26561406	YGFSEFQKOUDBNO-LJAQVGFWSA-N	449.554	1.424	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(CNC(=O)NNC(=O)COc2ccccc2C#N)CC1	726266703	PNILSSFLTJCGIP-UHFFFAOYSA-N	431.493	1.915	50	20	IDGD	
O=C(NNc1nc(-c2ccncc2)no1)[C@H]1CCCN(S(=O)(=O)c2ccccc2)C1	726377194	OMWMWSWZMOVNEU-HNNXBMFYSA-N	428.474	1.676	50	20	IDGD	
CC(=O)N1c2ccccc2C[C@H]1C(=O)NNC(=O)COc1ccc(Br)cc1	726496764	JEDXIBQSLBQACK-KRWDZBQOSA-N	432.274	1.953	50	20	IDGD	
CC(C)NC(=O)CNC(=S)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1	727278460	VNPLAHRTUSJOHF-HXUWFJFHSA-N	439.585	1.633	50	20	IDGD	
C#Cc1cccc(NC(=S)NNC(=O)CCS(=O)(=O)c2ccc3c(c2)OCCO3)c1	727498480	VPDLGPLHWUFNTB-UHFFFAOYSA-N	445.522	1.621	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CNC(=O)c2cccs2)cc1I	727994958	MVOGYWHGWBMWPR-UHFFFAOYSA-N	443.266	1.852	50	20	IDGD	
CN(C)N(C(=O)C1CCN(c2ccc(C(F)(F)F)cn2)CC1)[C@H]1CCS(=O)(=O)C1	728180388	ZTRYNGVBVPBDFR-HNNXBMFYSA-N	434.484	1.809	50	20	IDGD	
COCCNC(=O)CN1CCN(C(=O)/C(C#N)=C/c2cc(C)n(CC(C)C)c2C)CC1	728199503	VQMSPBZGYSEKOC-FYJGNVAPSA-N	429.565	1.575	50	20	IDGD	
CC[C@H](C)NC(=O)CN1CCN(C(=O)NNC(=O)c2cc3c(s2)CC[C@@H](C)C3)CC1	728944629	IADXJPAQQGXGEW-CABCVRRESA-N	435.594	1.760	50	20	IDGD	
C[C@H](CC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)S(=O)(=O)c1ccc(F)cc1	729176975	PHCNXMGJGMCAPB-GFCCVEGCSA-N	442.490	1.243	50	20	IDGD	
CN(C[C@H]1CCN(CC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)C1)C(=O)OC(C)(C)C	729478738	ZHCMBUHXYPVMCW-CQSZACIVSA-N	435.481	1.545	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)N2CCN([C@H]3CCC[C@@H]3O)CC2)N(C)c2ccccc21	730083402	KPRQJVAHJAUNEK-UNMCSNQZSA-N	437.544	1.715	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)N[C@H]1CCN(c2ccc(F)cc2F)C1	730142893	ZFXZCYPFIJONOZ-INIZCTEOSA-N	445.474	1.581	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2)c1cccc2ncccc12	730204201	VVWPQUFIVSNNLJ-UHFFFAOYSA-N	430.398	1.538	50	20	IDGD	
O=C(CC[C@H]1NC(=O)N(c2ccc(Cl)cc2)C1=O)NNC(=O)COc1ccc(F)cc1	730767685	IDPRZTNAXZDTOW-MRXNPFEDSA-N	448.838	1.911	50	20	IDGD	
Cc1cc(C(=O)OCC(=O)C(C#N)=C2N(C)c3ccccc3N2C)ccc1S(N)(=O)=O	730892253	VCNUXAYIWWNPHX-UHFFFAOYSA-N	440.481	1.690	50	20	IDGD	
CCOC(=O)C1=NN(c2ccccc2)[C@H](C(=O)NNC(=O)COc2ccc(F)cc2)C1	731185438	ISRZVOASVMUCMJ-SFHVURJKSA-N	428.420	1.550	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)c1nnn(-c2cccc3c2CCN(C)C3)c1C	731494224	UOHYXBZLJNZYOH-UHFFFAOYSA-N	448.527	1.966	50	20	IDGD	
Cc1cc(COc2ccc(C=O)cc2)oc1C(=O)NNC(=O)CNC(=O)c1ccco1	731625988	WDYIXWQMNNGWEA-UHFFFAOYSA-N	425.397	1.764	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)[C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])o2)cc1	731978371	QMKKXUAVIAXZGG-OAHLLOKOSA-N	430.417	1.581	50	20	IDGD	
O=C(NCc1ccc(Br)cc1F)NNC(=O)c1ccc(-n2cnnn2)cc1	732236033	NKLJMIGNUZVZAZ-UHFFFAOYSA-N	434.229	1.708	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)[C@@H]3CCC(=O)N3)c2)c(C)c1	732259660	VBQPSHWSTXXVSF-KRWDZBQOSA-N	430.486	1.144	50	20	IDGD	
CCOc1cc(/C=C(/C#N)C(=O)c2c(N)n(C)c(=O)n(C)c2=O)ccc1OCC(C)C	732578721	PAWZZFZDDUQFTI-DHDCSXOGSA-N	426.473	1.890	50	20	IDGD	
C[C@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)NNC(=O)NCc2ccc(Cl)cc2)C1=O	733003541	BQFQLBVPWSHVAW-HXUWFJFHSA-N	447.854	1.777	50	20	IDGD	
CC[C@H](C)C(=O)N1Cc2ccccc2C[C@H]1C(=O)OCC(=O)NNC(=O)c1ccccc1	733532476	ZWCDWLKWZOORMN-JXFKEZNVSA-N	437.496	1.990	50	20	IDGD	
CCc1cc(NNC(=O)C2=NN(c3ccc(F)cc3)[C@H](C(N)=O)C2)nc(-c2ccccn2)n1	734356758	JQHXCOSRLDXRAY-SFHVURJKSA-N	448.462	1.803	50	20	IDGD	
CCc1nn(C)c(Cl)c1C=NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	734744304	LABYVDJNVBHNLA-UHFFFAOYSA-N	439.925	1.421	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2ccc(Cl)cc2F)CC1	735117615	ZKQFTVCZXRWRLX-UHFFFAOYSA-N	427.889	1.567	50	20	IDGD	
Cn1cc(C(=O)NNS(=O)(=O)c2cc(Br)ccc2Br)cn1	735460941	BCJDIXOEDBNKMP-UHFFFAOYSA-N	438.101	1.568	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)CCn2c(C)c(C)sc2=O)cc1C	736829282	PGSLYMJSYYRDAH-UHFFFAOYSA-N	425.532	1.853	50	20	IDGD	
C[C@@H]1CC(C)(C)C[C@@]2(C1)NC(=O)N(CC(=O)NNC(=O)COCc1ccccc1)C2=O	737636109	BXFDNDZFUJUVBE-IVZQSRNASA-N	430.505	1.487	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)C(=O)C1)NNC(=O)c1cccc([N+](=O)[O-])c1	738339186	HEIOXQKLCQJZLL-UHFFFAOYSA-N	445.863	1.354	50	20	IDGD	
CC(C)NS(=O)(=O)Cc1ccc(CNC(=O)NNC(=O)COCc2ccccc2)cc1	738459953	JDQWKEKVDRPONR-UHFFFAOYSA-N	448.545	1.562	50	20	IDGD	
CC(C)N(C)S(=O)(=O)c1ccc(CNC(=O)NNC(=O)COCc2ccccc2)cc1	738462503	ZRMHKFVCCPHNJL-UHFFFAOYSA-N	448.545	1.763	50	20	IDGD	
CC(=NNC(=O)[C@H]1COc2ccccc2O1)c1cccc(S(=O)(=O)N2CCOCC2)c1	739399337	CKDXAHWIXPMYHE-HXUWFJFHSA-N	445.497	1.388	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)[C@H]2CCN(c3cccc(Cl)c3)C2=O)nc2ccccc21	742034604	QOAHWIKFTCWSER-OAHLLOKOSA-N	425.876	1.970	50	20	IDGD	
CN(C[C@@H]1CCCN1C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)C(=O)OC(C)(C)C	743512545	WDBPEJVPMYPTCU-INIZCTEOSA-N	444.496	1.348	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CN2CCN([C@H](CO)c3ccc(Cl)cc3)CC2)c1	744399309	ITSCHXYLSAUDDM-HXUWFJFHSA-N	430.936	1.761	50	20	IDGD	
CCCNC(=O)c1cccc(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)c1	744620240	HNOJPGFXDGVAOK-UHFFFAOYSA-N	446.529	1.604	50	20	IDGD	
CCN(CC)CCN1C(=O)C(=NNC(=O)[C@H](C)CN2C[C@H](C)O[C@H](C)C2)c2ccccc21	744762187	OPHMFWSNNSFYIX-QRVBRYPASA-N	443.592	1.941	50	20	IDGD	
COC(=O)COc1ccc(C(C)=NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1	744998901	HBYXJZNSVVSQAZ-UHFFFAOYSA-N	447.513	1.708	50	20	IDGD	
C[C@H](CNC(=O)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1)CN1CCN(C)CC1	745863758	XCIARDIUEWMHAJ-CYBMUJFWSA-N	437.488	1.490	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)CCc1c(C)nc2c(c(O)nn2C)c1C	746095127	YYNOBFHFEMGLDT-UHFFFAOYSA-N	441.488	1.848	50	20	IDGD	
COc1ccc2c(c1)OC[C@H](C(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)C2	747528150	QVKNNJMXNVLOLS-CQSZACIVSA-N	429.385	1.159	50	20	IDGD	
Cc1nc(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)nn1-c1ccccc1C(C)C	749563207	JUUCKFBSXJRZGU-UHFFFAOYSA-N	431.460	1.750	50	20	IDGD	
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)NNC(=O)CNC(=O)c1cccs1	749588888	PDKWJSVPHRSTLL-DOTOQJQBSA-N	429.546	1.719	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2cccc(C(=O)NNC(=O)CCc3ccccc3)c2)C[C@H](C)O1	749803641	GSBQJVXJRWDHQG-IRXDYDNUSA-N	445.541	1.878	50	20	IDGD	
Cn1cccc1C(=O)NN=C1C(=O)N(Cc2ncon2)c2ccc(Br)cc21	750933438	HBVAZZAJUGVQEA-UHFFFAOYSA-N	429.234	1.852	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NN=C1C(=O)Nc2c(I)cccc21	750936775	ILZDCTICGUXGJM-UHFFFAOYSA-N	438.181	1.087	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNS(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1	751281638	GCYSPMWZUVWLOI-UHFFFAOYSA-N	425.772	1.691	50	20	IDGD	
CC[C@H](C)C(=O)N1Cc2ccccc2C[C@@H]1C(=O)NNC(=O)[C@@H]1COc2ccccc2O1	751291896	YQWREXFRINGNDE-KLHJMIIUSA-N	437.496	1.973	50	20	IDGD	
O=C(NNC(=O)[C@H]1CC(=O)N(CCOc2ccccc2Cl)C1)c1ccc2c(c1)OCO2	751540508	KNZABJBUTIRZLM-AWEZNQCLSA-N	445.859	1.757	50	20	IDGD	
CC(C)C[C@@H](C(=O)NNc1nc2ccccc2c(=O)n1C)N1C(=O)[C@H]2CC=CC[C@H]2C1=O	752907907	PARXJDXYGGXNEF-DAYGRLMNSA-N	437.500	1.743	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCc2ccc([S@](C)=O)cc2)c2ccccc2c1=O	753036082	AEVTZMVMTYQSKQ-PMERELPUSA-N	427.486	1.298	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)N[C@H]1CCN(Cc2ccc(C#N)cc2)C1=O	753736995	AKGBUVHANKJNFS-LIRRHRJNSA-N	439.447	1.596	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)nc2)c(C)c([N+](=O)[O-])c1	753840655	KYXFGANDOWDPQE-UHFFFAOYSA-N	435.780	1.138	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1	754186925	YJYCIVFZTAZADW-UHFFFAOYSA-N	445.457	1.354	50	20	IDGD	
Cc1nccc(NCc2cccc(C(=O)OCC(=O)NNC(=O)c3ccc(C#N)cc3)c2)n1	754951801	OONMJXFBZKSTGC-UHFFFAOYSA-N	444.451	1.887	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Cc2cc[nH]n2)cc1S(=O)(=O)N[C@@H]1CCCC[C@@H]1C	755268798	IAWPTSLNXUMLEY-XJKSGUPXSA-N	449.533	1.279	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1S(=O)(=O)N(C)C	755392997	OYEYDVBLTNVEBO-UHFFFAOYSA-N	442.501	1.898	50	20	IDGD	
COC(=O)CCNC(=O)c1ccc(NC(=O)NNC(=O)Cn2ccc3ccccc32)cc1	755604450	RAZSKFJDXQZDOM-UHFFFAOYSA-N	437.456	1.787	50	20	IDGD	
COC(=O)c1ccc(NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc1	755829425	WOASBNIBQSHNKW-UHFFFAOYSA-N	446.485	1.724	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)Nc2cccc(S(=O)(=O)NC3CC3)c2C)cc1	756704450	ICYLCYFAMYTCII-UHFFFAOYSA-N	448.501	1.676	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)Nc1ccc(C(=O)N2CCOCC2)cc1C	757830206	IOMOAYOBFFYUGA-UHFFFAOYSA-N	442.472	1.708	50	20	IDGD	
Cc1nc(C(=O)NNC(=O)C(=O)Nc2ccccn2)nn1-c1c(Cl)cccc1Cl	758839776	QMMYDWDYMYNIKN-UHFFFAOYSA-N	434.243	1.677	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)CNC(=O)c1cccs1)c1nc(-c2ccccc2)no1	760313363	ZCNAXVGJBYQASI-LBPRGKRZSA-N	428.474	1.662	50	20	IDGD	
Cc1cc(S(=O)(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc(C(=O)O)c1C	760342662	IPFPBDWWHTXUMD-UHFFFAOYSA-N	426.472	1.028	50	20	IDGD	
CCC(=O)c1ccc(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)cc1	761543748	YUBUKCWSPRNRDU-UHFFFAOYSA-N	430.530	1.972	50	20	IDGD	
COC(=O)c1ccc(N2CCCC2)c(NC(=O)C(=O)NNC(=O)c2ccccc2O)c1	763530613	YDMOYSMBCJDTNF-UHFFFAOYSA-N	426.429	1.179	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)nc(C)n3C)cc(OC)c1OC	763541901	BWMHAMBECAHQSU-UHFFFAOYSA-N	441.444	1.307	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(S(C)(=O)=O)c(C(F)F)c2)c(C)o1	763584155	VETPTZYTTUYHNH-UHFFFAOYSA-N	429.401	1.637	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(-n3nc(C)cc3C)nc2)cc1	763658825	DLZXTVFUVUZUQP-UHFFFAOYSA-N	438.444	1.058	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2ccc(CN3CCCC3=O)cc2)c1	763665374	HISLQCBAVJAGPY-UHFFFAOYSA-N	438.484	1.591	50	20	IDGD	
Cc1ccn(C)c(=O)c1NC(=O)C(=O)NNC(=O)COc1ccccc1Cc1ccccc1	763717822	AIPPHPXDYFYVFN-UHFFFAOYSA-N	448.479	1.449	50	20	IDGD	
CC(C)n1ncc2cc(NC(=O)C(=O)NNC(=O)COc3ccccc3[N+](=O)[O-])ccc21	763804937	XYKQIUJEUSCUCR-UHFFFAOYSA-N	440.416	1.690	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)C(=O)Nc1cccc(-c2ncco2)c1	763804950	PLZNWPFYCOBKEM-UHFFFAOYSA-N	425.357	1.415	50	20	IDGD	
Cc1noc(C)c1NC(=O)C(=O)NNC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1	763805014	QQGGUWQLHZWRHJ-UHFFFAOYSA-N	445.439	1.939	50	20	IDGD	
CN(C)c1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)COc1ccccc1[N+](=O)[O-]	763807749	GAHRHRCMDRKWSJ-UHFFFAOYSA-N	435.824	1.479	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)C(=O)Nc1cccc(OC[C@@H]2CCCO2)c1	763840680	WIMRSMLNFNBZKY-SFHVURJKSA-N	431.420	1.548	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)Cc2c[nH]c3ccccc23)cc1C(=O)NC(C)C	763865727	SPUULGRWZDYYPU-UHFFFAOYSA-N	435.484	1.943	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1cccc(-c2nccn2C)c1	763874040	YWCZDIZCPPDRAR-CYBMUJFWSA-N	425.420	1.780	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)Cn2nc(C)cc2C)c(OC[C@@H]2CCCO2)c1	763892792	KTQQATMEDOCOPJ-INIZCTEOSA-N	429.477	1.152	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc(N2CCN(C)CC2)c(Cl)c1	763958178	QVJSPRDJCZRPHJ-UHFFFAOYSA-N	429.908	1.800	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)Nc1ccccc1OC(F)F	764005142	VMYBNBCUGWBFHZ-UHFFFAOYSA-N	431.193	1.789	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1ccc(Br)nc1	764010621	BHQJJPDGSDSKRB-UHFFFAOYSA-N	427.642	1.906	50	20	IDGD	
CC[C@H](C)NS(=O)(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2ccccc2OC)c1	764049182	WBDQQLVQCFKRHV-ZDUSSCGKSA-N	448.501	1.172	50	20	IDGD	
CS(=O)(=O)c1c(F)cc(NC(=O)C(=O)NNC(=O)CCC2CCCCC2)cc1F	764211972	VMCNSSKGKJIVFY-UHFFFAOYSA-N	431.461	1.815	50	20	IDGD	
CCCS(=O)(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2cccc(C#N)c2)c1	764234575	GSSQFOYQRYHGTE-UHFFFAOYSA-N	429.458	1.110	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)Cc2ccccn2)sc2c1CCSC2	764266775	LDMQQYHVZUWEBU-UHFFFAOYSA-N	448.526	1.438	50	20	IDGD	
O=C(NNC(=O)c1cc2ccccc2o1)C(=O)Nc1ccc(N2C(=O)CCCC2=O)cc1	764331971	LGACPSLJAMETCA-UHFFFAOYSA-N	434.408	1.876	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)C(=O)Nc1cc(Cl)ccc1N1CCSCC1	764353911	MCAKWZVPIJJRJT-UHFFFAOYSA-N	433.921	1.617	50	20	IDGD	
CN(Cc1cccc(NC(=O)C(=O)NNC(=O)Cc2ccncc2)c1)C(=O)OC(C)(C)C	764355891	KYLBJIRQFXSMBE-UHFFFAOYSA-N	441.488	1.777	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COCc2ccccc2)n(-c2ccccc2F)n1	764363928	WVUICZTWRRXCMN-UHFFFAOYSA-N	425.420	1.623	50	20	IDGD	
CC(=O)N(Cc1ccc(NC(=O)C(=O)NNC(=O)COCc2ccccc2)cc1)C1CC1	764368027	SDTYWTNNKLBLLE-UHFFFAOYSA-N	438.484	1.500	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)NC2CC2)cc1)NNC(=O)CSc1ccccc1O	765249111	KCOGNTAGMPXFNQ-UHFFFAOYSA-N	449.554	1.705	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)[C@@H]2CC(=O)N(Cc3ccccc3)C2)n[nH]1	765598745	DDHINSRERKZJJO-MRXNPFEDSA-N	433.468	1.895	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)c1cccc2[nH]ncc12	766663779	NRBXAQHQXQFRTD-UHFFFAOYSA-N	426.908	1.795	50	20	IDGD	
COc1cc2c(cc1NC(=O)C(=O)NNC(=O)CCc1ccccc1O)NC(=O)CC2	768243783	XLVAPHXXASRTIR-UHFFFAOYSA-N	426.429	1.004	50	20	IDGD	
O=C(NNS(=O)(=O)c1cncc(Cl)c1)c1ccc(S(=O)(=O)N2CCCC2)cc1	768267769	DOFZWNKAJPFYTI-UHFFFAOYSA-N	444.922	1.143	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)/C=C\c1ccccc1)C(=O)NNC(=O)c1cc(C)[nH]n1	768277367	JUQDKCARDVJQIO-ZHUYAKLQSA-N	437.547	1.191	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)c1cccc(S(=O)(=O)NC2CC2)c1	768639740	VCMHKMJIHGFYJY-UHFFFAOYSA-N	439.515	1.296	50	20	IDGD	
Cc1nc(-c2ccccn2)nc(NNC(=O)c2cc(S(=O)(=O)N(C)C)ccc2O)c1C	768711583	FZQHFQPMQMPKDA-UHFFFAOYSA-N	442.501	1.868	50	20	IDGD	
CCC[C@](C)(O)C(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2OC)c1	770745822	HVASUOBKTGYSDY-FQEVSTJZSA-N	435.502	1.808	50	20	IDGD	
Cc1nn(C)c2sc(C(=O)N[C@H](C)C(=O)O[C@@H](C)C(=O)NNC(=O)CC(C)C)cc12	772152189	AGKQDWBCLYLDEL-NEPJUHHUSA-N	437.522	1.187	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)c1ccc(I)c(O)c1	772322703	XGIHOIJUZHRPPF-VIFPVBQESA-N	434.230	1.736	50	20	IDGD	
Cn1c(=O)n(CCC(=O)NNC(=O)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)c2ccccc21	773419417	VRDZIKFHRGQWGG-OAHLLOKOSA-N	445.520	1.525	50	20	IDGD	
Cn1cc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)c(C(F)(F)F)n1	773546780	QRIHXLGYQJINGG-UHFFFAOYSA-N	439.329	1.368	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2cccc(COc3ccc4c(c3)OCO4)c2)n1	773724203	OAOJMJCQLVRULK-UHFFFAOYSA-N	437.412	1.875	50	20	IDGD	
CC(C)c1nccnc1NNC(=O)C(=O)Nc1ccc(N2CCNC(=O)C2)c(Cl)c1	774000525	XTJMDFWQDSJGEC-UHFFFAOYSA-N	431.884	1.271	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1cnn(CC(F)(F)F)c1	774001596	IPXQTYFFAXDEGO-SECBINFHSA-N	433.774	1.652	50	20	IDGD	
Nc1ccc(C(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)nc1Br	775073788	MRUVTBASOLPLIH-UHFFFAOYSA-N	427.642	1.698	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H]2CCc3cc(O)ccc3C2)c1	775086394	SUFQHTLDWGOQJE-INIZCTEOSA-N	432.502	1.144	50	20	IDGD	
COCC[C@@H](NC(=O)NNC(=O)c1sc(N2CCOCC2)nc1C)c1ccc(C)o1	778589214	PPNDHKARBCXCEQ-CQSZACIVSA-N	437.522	1.911	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)c2ccc(OC)c(-n3cnnn3)c2)cc1OC	781587338	WXRWDBZRDLQVQR-UHFFFAOYSA-N	426.433	1.543	50	20	IDGD	
CC1(NC(=O)OC(C)(C)C)CCN(CC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)CC1	781980716	QRUQJLGEWJISEE-UHFFFAOYSA-N	435.481	1.735	50	20	IDGD	
CC(C)Cn1cc(C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)cn1	782016285	ZTVYBKCYIQCNFC-UHFFFAOYSA-N	432.956	1.771	50	20	IDGD	
COCCn1cc(C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)c(C)n1	782555735	KZHCJSAAHGCSQW-UHFFFAOYSA-N	448.955	1.070	50	20	IDGD	
Cc1ccc(C)c(NNC(=O)C(=O)N2C[C@@H](C(=O)N3CCOCC3)Oc3ccccc32)c1	783366842	RKZHOPNJGLXINF-FQEVSTJZSA-N	438.484	1.400	50	20	IDGD	
Cc1csc(Sc2ccc(NC(=O)C(=O)NNC(=O)C(=O)N3CCCC3)cc2)n1	784000032	SBPKNXWREFUVAD-UHFFFAOYSA-N	433.515	1.311	50	20	IDGD	
Cn1c(=O)oc2cc(NC(=O)C(=O)NNc3nc(-c4ccc(Cl)cc4)no3)ccc21	784800267	YMEVAEWDVFQFPB-UHFFFAOYSA-N	428.792	1.917	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ccc(Cl)nc2)c(C)c1S(=O)(=O)NC1CC1	784869813	NBRBZFGFNXISSK-UHFFFAOYSA-N	437.909	1.874	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1cccnc1-c1cnn(C)c1	786415104	WVRNMCGJJYHILO-GFCCVEGCSA-N	426.408	1.175	50	20	IDGD	
C[C@H](O)C(=O)NNC(=O)c1ccc(NS(=O)(=O)c2ccc(Br)cc2)cc1	786682937	MZJZMUBIQLPVOK-JTQLQIEISA-N	442.291	1.392	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)NCc1ccc(S(C)(=O)=O)s1	786878889	DZZBEVBBIBJZEB-UHFFFAOYSA-N	429.545	1.783	50	20	IDGD	
CCOC(CCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)OCC	786917346	VQKZNBIQCHOJMS-UHFFFAOYSA-N	442.538	1.204	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)[C@H]1CCc2nccn2C1	787127073	QILZSBJODJIXDR-KRWDZBQOSA-N	430.940	1.064	50	20	IDGD	
O=C(NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1)NOC[C@H]1CCOC1	788325121	GECKYZGVSVKIBZ-LBPRGKRZSA-N	440.503	1.461	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2O1)C(=O)Nc1ccc(Cl)cc1-n1cccn1	788334556	XMZKWSYYECTVAH-QGZVFWFLSA-N	425.832	1.615	50	20	IDGD	
COCCOc1cc(OC)ccc1C(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	788493889	XTAPVPLQEGGHDW-UHFFFAOYSA-N	426.429	1.042	50	20	IDGD	
O=C(NNc1nnc(-c2ccccn2)s1)C1CCN(S(=O)(=O)c2cccnc2)CC1	788558372	LJFDXRWISKJJIQ-UHFFFAOYSA-N	445.530	1.539	50	20	IDGD	
CN(NS(=O)(=O)c1csc([N+](=O)[O-])c1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	788914424	CJHDADHUYFOQDY-UHFFFAOYSA-N	449.511	1.454	50	20	IDGD	
C[C@H](C(=O)NNC(=O)Cc1ccc(F)cc1)[C@H](C)C(=O)NNC(=O)Cc1ccc(F)cc1	790125762	TVGKWDRKFIDJGZ-KBPBESRZSA-N	446.454	1.317	50	20	IDGD	
O=C(CCc1cncnc1)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	794181885	CPSDRCDSMLYABG-UHFFFAOYSA-N	428.452	1.629	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1C	797535265	KHOBBXNRDWIRAH-UHFFFAOYSA-N	436.222	1.769	50	20	IDGD	
O=C(NNC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1)C(=O)Nc1cncc(F)c1	799258380	AQNMJEHCPNPGBG-UHFFFAOYSA-N	445.414	1.868	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ccc(C#N)cc2C(F)(F)F)cc1-n1cnnn1	799840050	FKZURIGRJDYPLC-UHFFFAOYSA-N	446.349	1.643	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)NCCCNC(=O)/C=C\c2ccccc2)cc1C	800761425	XSIIYJKWAJQAHQ-BENRWUELSA-N	437.500	1.792	50	20	IDGD	
O=C(COC(=O)c1cnn(CCO)c1-c1ccccc1)NNC(=O)c1cccc(Cl)c1	801318073	JZDKASPNMWIHQH-UHFFFAOYSA-N	442.859	1.814	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3cncc(-n4ccnn4)c3)n[nH]2)cc1OC	801935043	VLNSENBXICECJY-UHFFFAOYSA-N	434.416	1.144	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2cc(F)cc(F)c2)cc1S(=O)(=O)NC1CC1	802001414	VMOVYOMAKMNNHK-UHFFFAOYSA-N	440.428	1.881	50	20	IDGD	
CC[C@@H](C)[C@H](NC(=O)N1CCCC1)C(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	802064565	VSOZOCFJBYRPSQ-CJNGLKHVSA-N	439.538	1.463	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(NC(=O)CC(F)(F)F)cc2)cc1	802567463	VWGUSBNVBJCJEM-UHFFFAOYSA-N	433.346	1.849	50	20	IDGD	
C=CCNS(=O)(=O)c1cc(C(=O)NNc2cccc(F)c2C(=O)OC)ccc1F	808029997	SNOREZXYRWOOQZ-UHFFFAOYSA-N	425.413	1.973	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2ccc3c(c2)C(C)(C)CO3)cc1	809983818	OICBHXIUMRUWGL-UHFFFAOYSA-N	431.514	1.747	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)CNS(=O)(=O)c3ccc(Cl)cc3)n[nH]2)cc1	810147727	PWNCWPRKWLBCAL-UHFFFAOYSA-N	447.904	1.778	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(Br)s1)NNc1cnc2ccccc2n1	811462026	SGNZWJLADUBBGN-UHFFFAOYSA-N	442.320	1.875	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)CNS(=O)(=O)c1cccc(F)c1	811462764	YFQHQYWKKPLZIX-LLVKDONJSA-N	429.857	1.372	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)[C@H](C)NC(=O)c1cccs1	812861936	MHMIXGMCSONRDU-JTQLQIEISA-N	439.877	1.533	50	20	IDGD	
COc1cc(C)c(NC(=O)C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)cc1OC	813033571	ZVYTWIKITOAJDH-UHFFFAOYSA-N	436.490	1.344	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)NCC[C@]1(O)C[C@H]2CC[C@H]1C2	813785951	IKPJELBIPSBIHN-YDHSSHFGSA-N	429.565	1.470	50	20	IDGD	
COc1cc(Br)cc(C=NNC(=O)Nc2ccc(S(N)(=O)=O)cc2)c1O	814970006	RTVCJQHXEZIECJ-UHFFFAOYSA-N	443.279	1.966	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)c2cccc(N(C)C)c2)cc1)[C@@H]1C[C@@H]1C	815565362	LROIWXDFRRZFIT-VBKZILBWSA-N	437.500	1.914	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cccn2C)cc1S(=O)(=O)C1CCCC1	815567812	MWKOAUQZQGFMLU-UHFFFAOYSA-N	432.502	1.450	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1cccnc1Br	815751893	SYUFCGUWTZVEBF-UHFFFAOYSA-N	442.295	1.176	50	20	IDGD	
COc1cccc(/C=C(/C(=O)NNC(=O)COc2cc(C)cc(C)c2)n2nnnc2C)c1	818022665	KUSPSWSQCZPFMZ-NDENLUEZSA-N	436.472	1.831	50	20	IDGD	
CC(C)[C@H](NS(=O)(=O)c1ccc2c(c1)OCCCO2)C(=O)NNC(=O)c1ccncc1	865910497	CHIYLZOJCXRPPD-SFHVURJKSA-N	448.501	1.007	50	20	IDGD	
CC(C)CNS(=O)(=O)c1ccc(C(=O)NNC(=O)Cc2nc3ccccc3n2C)cc1	914748234	PLECVLRPQJFESY-UHFFFAOYSA-N	443.529	1.511	50	20	IDGD	
COc1c(F)cc(CC(=O)NNC(=O)Cc2ccc(Cl)cc2)cc1S(N)(=O)=O	915596593	FOUIJODCZAGNID-UHFFFAOYSA-N	429.857	1.068	50	20	IDGD	
Cc1ccc(NC(=S)NNC(=O)c2ccc(S(=O)(=O)N3CCOCC3)o2)cc1C	915597961	DAMYDEMWUOQGEF-UHFFFAOYSA-N	438.531	1.549	50	20	IDGD	
COCc1cccc(CNC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1	916426042	DCOHURRZRJATQZ-UHFFFAOYSA-N	446.529	1.762	50	20	IDGD	
CCOC(=O)c1c(S(=O)(=O)NNC(=O)[C@H](C)Oc2ccc(OCC)cc2)n[nH]c1C	917725250	JNLJTEIZEFKJDZ-LBPRGKRZSA-N	440.478	1.071	50	20	IDGD	
C[C@H](NC(=O)c1ccc(Br)s1)C(=O)NNC(=O)COc1ccc(F)cc1	917917596	YNJSPNJBACEVQU-VIFPVBQESA-N	444.282	1.994	50	20	IDGD	
Cc1cc(NC(=O)CN2CCN(C(=O)NNC(=O)c3ccc4ccccc4c3)CC2)no1	918013721	PIJFRYIVQMASIX-UHFFFAOYSA-N	436.472	1.747	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)NCc2ccccc2OCC(=O)NC[C@H]2CCCO2)n1	918217821	LQWPFUQEACUTTQ-QGZVFWFLSA-N	428.493	1.594	50	20	IDGD	
Cc1onc(-c2c(F)cccc2Cl)c1C(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1	919885782	RCLLQTUILOKEBR-VIFPVBQESA-N	430.845	1.574	50	20	IDGD	
NC(=O)[C@@H]1CCCN1Cc1cccc(NC(=O)NNC(=O)COc2ccc(F)cc2)c1	920930428	MVQQHYKVOQCDRE-SFHVURJKSA-N	429.452	1.507	50	20	IDGD	
O=C(NC[C@H](c1cccc(F)c1)N1CCOCC1)NNC(=O)c1ccc2c(c1)OCCO2	921199408	KTGASWKALHIOOT-GOSISDBHSA-N	444.463	1.614	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)NCc1cccnc1N1CCN(C)CC1	921247557	HHLDTXHCKWNROU-HNNXBMFYSA-N	430.484	1.270	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)c2cc(S(=O)(=O)N(C)C)ccc2F)c1	929086546	NBOVYIIVXUMJOY-UHFFFAOYSA-N	425.438	1.168	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)CSCc2cccs2)CC1	1251902270	HPHPFYHWRFLLQU-UHFFFAOYSA-N	441.604	1.456	50	20	IDGD	
COc1cccc(/C=C(/C(=O)NNC(=O)c2cncn2-c2ccccc2)n2nnnc2C)c1	1318012812	DZSBICOLUIAELG-UNOMPAQXSA-N	444.455	1.635	50	20	IDGD	
Nc1cnnc(NNC(=O)C2(NS(=O)(=O)c3cccc(F)c3)CCCCC2)c1Cl	1319779580	QJPBQTCTSNCMBW-UHFFFAOYSA-N	442.904	1.976	50	20	IDGD	
CC/C=C(/C)C(=O)N1CSC[C@@H]1C(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	1322746270	JWMAZYSCDFUYDY-HYMFSAHRSA-N	440.547	1.501	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)/C=C/c3cc(C)on3)C2)C1	1779132940	YSVBIPLFWNEGDN-BWZQFPAASA-N	426.311	2.000	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ncccc3C(F)(F)F)C2)C1	1779717662	NSDMEWDGKJJIND-CXAGYDPISA-N	435.830	1.798	50	20	IDGD	
COc1cccc(OC)c1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](C)Br)CCO2	1780541878	KYVSMZDVRSUPLQ-DJJJIMSYSA-N	441.322	1.931	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1nnc3cc(C)nn3c1C)C2	1780702754	RJMVZLPJXVWLPA-GCKMJXCFSA-N	448.955	1.886	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C=C\C(=O)NC1CC1)C2	1780712549	RAPNPZADDAYKLV-NQOROCTESA-N	446.375	1.571	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](F)Br)C2)cc(O)n1	1780773740	VIJLQTFFZOAOMH-QIIPPGSGSA-N	444.301	1.914	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C=C/c1cnc[nH]1)C2)[C@@H](F)Br	1780777666	XIGMFDNNLXHAMX-RJZPRWFTSA-N	429.290	1.627	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)[C@@H](N)Cc3cccnc3)CCO2)C1	1781230624	XNJUFQPTKUYETA-KFKAGJAMSA-N	429.348	1.018	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cn4cccnc4n3)CCO2)C1	1783349229	KGDRUXBQBDFYRJ-FZKQIMNGSA-N	436.310	1.346	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)Cc3cccc(Cl)n3)CCO2)C1	1783531693	BBLSCCRKWUIZQG-YVEFUNNKSA-N	430.730	1.891	50	20	IDGD	
CC(=O)Nc1cc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](C)Br)C3)C2)ccn1	1783535039	WAOMRVICTLJHKY-XIKOKIGWSA-N	439.310	1.267	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(-n4cccn4)nc3)CCO2)C1	1783538038	SAKOXLHGUGNKOM-IFXJQAMLSA-N	448.321	1.494	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(Br)cn3)CCO2)C1	1783877951	SFLRYYCTNHKBRF-GUYCJALGSA-N	446.729	1.541	50	20	IDGD	
O=C(c1cnc2c(c1)CCNCC2)N1CCO[C@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783950567	YHQVCZZOZYXDIQ-IBGZPJMESA-N	427.332	1.017	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)nc4ccccc34)C[C@@H]21)[C@@H](O)CCl	1784090980	SGDBCGOGHFLTSV-FRJURHEUSA-N	433.892	1.133	50	20	IDGD	
CCS(=O)(=O)N[C@H](C)C(=O)NC1(c2ccc(NC(=O)[C@H](O)CCl)cc2)CCC1	1786129457	MZHVNGMQPITWGW-IUODEOHRSA-N	431.942	1.048	50	20	IDGD	
COCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](Br)Cc3ccccc3)C[C@@H]21	1786496239	DMVXNAZWRBSTNU-XSLAGTTESA-N	439.350	1.619	50	20	IDGD	
CS(=O)(=O)c1ccc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Cl)C[C@@H]32)cc1	1786700755	ZPMSQDUVDJSTIC-MBGYTDRXSA-N	446.928	1.147	50	20	IDGD	
NC(=O)CC[C@H](N)C(=O)NC1(c2ccc(NC(=O)CCBr)cc2)CCC1	1787672908	NCROOTIXMICBQJ-AWEZNQCLSA-N	425.327	1.498	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3ccc(O)nn3)C[C@@H]21	1789872670	YBXWCENFVBKHHZ-XPVILTJLSA-N	445.347	1.331	50	20	IDGD	
CCN1CCC(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]3C2)CC1	1789873263	YKMWXZAJHIIADK-BOSXTWCSSA-N	434.408	1.934	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)c1c(O)cc(O)cc1O	1790156760	YOYHPGCRZPSXCT-LGRMDKJXSA-N	447.257	1.087	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc4ncccc4[nH]3)[C@H]2C1	1790336884	JYKQXAKPTKZIPP-MRHIQRDNSA-N	435.322	1.940	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](Cl)COC)[C@H]2C1	1791257364	BZFCOYWUMXRPTD-QNSTZXKLSA-N	425.751	1.393	50	20	IDGD	
C[C@@H](CBr)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(C(=O)O)ncn1)C2	1792988930	IYDQZLLWAQTLRP-YFKTTZPYSA-N	425.283	1.458	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H](F)C[C@H]1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCl	1793112154	GOPMRNILQNSIPV-VJQRDGCPSA-N	447.935	1.572	50	20	IDGD	
CCCNC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](Br)CC)C2	1793259149	BBRAJCVLAXNRAV-LOUJCGABSA-N	432.359	1.056	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cncnc1	1794822559	VXCKTHYSPWSGKT-JNIOACBCSA-N	439.422	1.565	50	20	IDGD	
Cc1ccc(CCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)s1	1796190199	ZWIITBXHIKYSBR-REPLKXPHSA-N	426.347	1.621	50	20	IDGD	
CC(C)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(Cl)c2nncn2c1	1797688394	MPBJDDRCTFXQSO-AGGWBTHJSA-N	440.331	1.851	50	20	IDGD	
CCOc1ncccc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@](C)(Cl)CCl	1799273338	DGJFVOUIXQINMF-QPWUGHHJSA-N	430.332	1.920	50	20	IDGD	
CC[C@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(-n3c(O)nnc3O)cc1)C2	1800072986	IZQIIXKBGIMRES-UKMLZYKCSA-N	433.896	1.948	50	20	IDGD	
C[C@@H](NC=O)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](Br)Cc1ccccc1	1801570298	IEECOAQXPLEUAW-SOVHRIKKSA-N	436.350	1.765	50	20	IDGD	
O=C(Cc1cc(F)ccc1F)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2	1801975858	LTZLOYUKHHPWRX-OXUXUCFPSA-N	435.240	1.787	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C12CC(c3ccccc3)(C1)C2	1802218396	YMDURFXIBWHWAI-KYFMYTABSA-N	432.948	1.952	50	20	IDGD	
COC[C@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cc1cn3nc(C)sc3n1)C2	1802270464	RLEQKWARPOLGPC-ATGSNQNLSA-N	425.942	1.534	50	20	IDGD	
COC[C@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](CCN)NC(=O)OC(C)(C)C)C2	1802273949	TUWVRZMHXRFCBT-XFIYOXNOSA-N	446.976	1.121	50	20	IDGD	
C=CCC(CC=C)C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1803081771	HJZHPZSUJCLHPL-JTHBVZDNSA-N	447.344	1.849	50	20	IDGD	
CC(=O)N1CCN(CC(=O)N2CCC3(CCCN(C(=O)C(C)(C)CCl)C3)CC2)CC1	1805263077	ZWKOPEJLCFYVRF-UHFFFAOYSA-N	441.016	1.647	50	20	IDGD	
NC(=O)c1ncccc1C(=O)N1CCCC2(CCN(C(=O)[C@H](F)Br)CC2)C1	1807382316	SOZMZWNEBFZOPN-AWEZNQCLSA-N	441.301	1.716	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC2(CCCN(C(=O)c3coc(Cl)n3)C2)CC1	1807626102	DOILDGXNHKENQI-UHFFFAOYSA-N	446.895	1.485	50	20	IDGD	
CC(C)=CCCC(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1807972341	GQCDSIALNRXMRW-NFBKMPQASA-N	435.333	1.827	50	20	IDGD	
CN(C)C(=O)NCC(=O)N1CC[C@H](CNC(=O)[C@@](C)(Cl)CCl)[C@@H]1c1cccnc1	1808290189	QLPPHZDJTSVLCW-ALKREAHSSA-N	444.363	1.595	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)c1cccc2c1OCC2	1808998505	PCAFYDFYRVDRGJ-YTQUADARSA-N	429.904	1.936	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)c1ccc2c(c1)CNC2=O	1810035563	NAJUFPVEEIOZLU-ZYSHUDEJSA-N	442.903	1.244	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)c1cccc2ccnn12	1812084451	DCYPITSGJKYIEW-KFKAGJAMSA-N	427.892	1.649	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)c2ncnn2C)[C@H]1c1cccnc1	1812775063	PQZAAJLWXQNQLH-ILXRZTDVSA-N	435.326	1.703	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)/C=C/c2cnccn2)[C@@H]1c1cccnc1	1813033805	SJDVGIVHNOSVMM-BXZJJLIQSA-N	429.908	1.845	50	20	IDGD	
N#CC1(C(=O)NC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)CCC1	1814052106	NQNVYODRJQKZRG-LPHOPBHVSA-N	447.499	1.094	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H]3CCC(=O)N3)sc2C1	1814422403	HDLYIOJVMMYKTQ-FXPVBKGRSA-N	429.340	1.507	50	20	IDGD	
CC(=O)C(C)(C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1815077387	POKUSVSIJXPKOV-QGZVFWFLSA-N	426.282	1.011	50	20	IDGD	
O=C(Cc1cccs1)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(B(O)O)cc1)CC2	1815589949	SVFQTCSFBRUPTG-AWEZNQCLSA-N	441.343	1.353	50	20	IDGD	
CC(C)CNC(=O)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](C)Br)CC2	1817331010	WUEPYZNJDLLLQX-ZJUUUORDSA-N	431.356	1.611	50	20	IDGD	
CC(C)[C@@H](S)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1	1817470234	MYWMFPDAPLODTH-SJLPKXTDSA-N	430.339	1.350	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2C=CCN2)[nH]n1	1818112210	WJUIHKWKCKSWCK-XDOPTBNASA-N	438.492	1.064	50	20	IDGD	
COCCn1nccc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](Cl)COC)[nH]n1	1818251515	OMFZRAKYFYXGEZ-UKRRQHHQSA-N	438.916	1.812	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@H]1CCc2nc(NC(=O)[C@H]3CCC=CO3)sc2C1	1819733270	RAFKJGNGXMKTHW-XHDPSFHLSA-N	442.501	1.060	50	20	IDGD	
Cc1c[nH]cc1C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1	1819797693	XWKAVBPLXIIRJQ-LLVKDONJSA-N	439.501	1.318	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)Cc2ccc(F)cn2)[nH]n1	1822413925	HMHNVNGXQFUEMA-QGZVFWFLSA-N	445.499	1.552	50	20	IDGD	
COC(=O)C1(C(=O)N[C@H]2CCc3nc(NC(=O)[C@H](F)Br)sc3C2)CC1	1823009025	JGDMTTODKIDWBJ-XVKPBYJWSA-N	434.287	1.699	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(=O)n3[nH]nnc3n2)CC1	1824012424	ARLHQYXKLOQECB-OAHLLOKOSA-N	449.943	1.311	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CN2CC(=O)NC2=O)CC1	1824973494	STBPQMAQXMHMOS-IFXJQAMLSA-N	447.363	1.394	50	20	IDGD	
Cc1noc(C)c1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1	1825858723	MMAPEVMYZAVYCJ-HXUWFJFHSA-N	439.321	1.518	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](O)Cc1ccccc1)CC2	1826004409	JAGDRGBASJCVKB-DZKIICNBSA-N	437.949	1.913	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1c3c(nn1C)CCC3)CC2	1826004649	PXCCGMHKJFZNLA-PWSUYJOCSA-N	437.953	1.845	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)Cc1ccccc1F)CC2	1826085318	MRRBNBSETCIQBZ-CQSZACIVSA-N	447.536	1.810	50	20	IDGD	
CCn1nccc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1	1826097638	KDCNSMWOOLAKKE-HXUWFJFHSA-N	438.337	1.130	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)[C@@H]2CCC=CO2)CC1	1828892137	FZSBFWCHZBIIGF-RTWAWAEBSA-N	426.322	1.292	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](O)N2CCOCC2)CC1	1828974384	RUMRQXXUPHBRTA-QILLFSRXSA-N	446.386	1.040	50	20	IDGD	
O=C(c1cc(-c2ccccc2)on1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1829590175	DVWMDJYNEARHPQ-XLIONFOSSA-N	437.855	1.946	50	20	IDGD	
COc1ccnc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)[C@H](O)CCl)CC2)c1OC	1829852761	DMOHUGAIXAMPGF-HZPDHXFCSA-N	439.940	1.932	50	20	IDGD	
C[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1)c1ccc(Cl)cc1	1830259678	XWMQJNJTIQWFFG-JNAXZKDPSA-N	445.343	1.500	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3c(F)cncc3F)C2)C1	1830365322	WMYHIMUCKBJGTB-LJQANCHMSA-N	431.867	1.695	50	20	IDGD	
C=CCOCCCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1831412079	CBTSSZXPTFHBOM-WBVHZDCISA-N	437.306	1.116	50	20	IDGD	
CC[C@@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)CCBr)C2)C1)N(CC)CC	1831663854	NCLKNSXHWFXCQD-QFBILLFUSA-N	448.402	1.348	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](C)n2cnnn2)CC1	1832287914	SYNFMGYZVDWUSF-FMKPAKJESA-N	441.374	1.885	50	20	IDGD	
CC(C)c1nc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)no1	1832783106	HSYZHROZXAVCOH-FQEVSTJZSA-N	442.944	1.457	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](CC)NC(C)=O)CC2)CC1	1833093881	OECIPCRYIVEIER-RTBURBONSA-N	429.005	1.880	50	20	IDGD	
CCNC(=O)N[C@@H](C)C(=O)N1CCC(N2CCC(NC(=O)C(C)(C)CCl)CC2)CC1	1833214519	FHOMGCBDXHGWMA-HNNXBMFYSA-N	444.020	1.531	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3c(F)ccnc3Cl)CCO2)C1	1833252915	AOSMUJKGMBTUOC-SGTLLEGYSA-N	434.295	1.962	50	20	IDGD	
Cc1ccc2oc(C(=O)N3CCC(N4CCC(NC(=O)[C@H](O)CCl)CC4)CC3)cc2n1	1833310237	DZEKKIKWHXVZQX-GOSISDBHSA-N	448.951	1.921	50	20	IDGD	
C#CCO[C@@H](C)C(=O)NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1	1833463282	FBGFHQKSMXPUOK-HNNXBMFYSA-N	428.371	1.381	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccnc3C)CCO2)C1	1834043388	WAROZWAOPLMSQQ-VQIMIIECSA-N	440.338	1.634	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCBr)CCO3)C2)cn1	1834819420	QNLRDCQNMZAQEH-GOSISDBHSA-N	426.311	1.245	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccc(Cl)cc3)CCO2)C1	1835062281	GNUGOTWFIWNTOQ-XLIONFOSSA-N	445.343	1.593	50	20	IDGD	
C[C@@H](Nc1cccnc1)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](F)Cl)CC2)CC1	1835080301	OUMRGVXXAFZWEJ-RDTXWAMCSA-N	425.936	1.988	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)c1cn2ccccc2n1	1835300041	FNBGNBMUQQVHJM-GOSISDBHSA-N	433.940	1.119	50	20	IDGD	
Cc1cc(CC(=O)NC2CCN(C3CCN(C(=O)[C@H](F)Br)CC3)CC2)n[nH]1	1835788805	RBVBAEMZKFSLID-KRWDZBQOSA-N	444.349	1.523	50	20	IDGD	
CCOc1cccc(C(=O)NC2CCN(C3CCN(C(=O)[C@H](O)CCl)CC3)CC2)c1	1836325621	RTEHMDFUKMMXCZ-HXUWFJFHSA-N	437.968	1.870	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)[C@H]3CCCN(C)C3)CC2)CC1	1836352540	YUIJWACJFYEKFJ-HOTGVXAUSA-N	443.430	1.683	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cc(Cl)ncn3)CC2)CC1	1838500503	IQJCPLOGIHCRTI-HNNXBMFYSA-N	445.347	1.996	50	20	IDGD	
CC(=O)N[C@H](C)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](C)Br)CC2)CC1	1838753842	DPPYLGPKYRHTCO-CHWSQXEVSA-N	432.359	1.293	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)cn1C	1839153456	YWFLPVYOYZNGFW-RBUKOAKNSA-N	432.348	1.640	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1840030435	MKEZLKYPZGYSRA-MLGOLLRUSA-N	425.751	1.491	50	20	IDGD	
Cc1ccnc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)c1	1840033247	YPDQLJRLENAXBR-KBXCAEBGSA-N	426.311	1.243	50	20	IDGD	
N#Cc1ccc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)cc1	1840187404	YFNFOLZHLJLHJN-LJQANCHMSA-N	426.300	1.361	50	20	IDGD	
COc1ccc(Br)cc1C(=O)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1	1841352771	MGJXPHREMYDUNG-ZDUSSCGKSA-N	431.714	1.874	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)[C@H]1Cc3ccccc3CN1)C2	1843416077	WHLFKOBOMCQNOA-CSWGWEJPSA-N	448.527	1.038	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1c(F)cncc1F)C2	1843416317	WHRLXSDZDZTEIE-BRJLIKDPSA-N	430.415	1.311	50	20	IDGD	
CN(CC(=O)N1CCCC12CN(C(=O)[C@H]1CC1(F)F)C2)NC(=O)NCc1ccccc1	1845038876	CFNOTLVONFBRNS-MRXNPFEDSA-N	435.475	1.191	50	20	IDGD	
CC(C)(C)OC(=O)NCCOCC(=O)N1CCCC12CN(C(=O)CCBr)C2	1845154043	OYNQSZXUICNEBN-UHFFFAOYSA-N	448.358	1.516	50	20	IDGD	
CN(C)C(=O)C(=O)N1CC2(CCCN2C(=O)/C(C#N)=C/c2ccc(Br)cc2)C1	1845872603	FRQJBSQEMRXPMQ-XNTDXEJSSA-N	445.317	1.648	50	20	IDGD	
CCOC(=O)N1CCC(C(=O)N2CCCC23CN(C(=O)[C@H](C)Br)C3)CC1	1846978463	RTCLDGMQWRTOLJ-ZDUSSCGKSA-N	430.343	1.842	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H]2C[C@H]2C[C@@H]1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl	1847568713	JESFOQQMYHZWSY-OSLXHZNNSA-N	427.929	1.186	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1ccncc1O	1848099201	FUUDMKFLXTVLDR-KKUMJFAQSA-N	438.912	1.735	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CCc1cn[nH]c1	1848192464	VRCLHQDNMRVIJS-ROUUACIJSA-N	441.444	1.691	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)[C@H]2CCCN(S(=O)(=O)c3ccc(F)cc3)C2)c1	17252275	JNDWJWZESCRRNS-INIZCTEOSA-N	448.520	1.754	50	20	IDGD	
COc1ccc(-c2n[nH]c(=S)n2CC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1	17395213	SWXVBBFSCPSXPH-UHFFFAOYSA-N	428.430	1.986	50	20	IDGD	
Cc1ccc(-n2cnnc2SCC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1C	22887012	DZOQQGGDRSRFNO-UHFFFAOYSA-N	449.500	1.413	50	20	IDGD	
O=C(NNC(=O)c1ccccc1NS(=O)(=O)c1cccc([N+](=O)[O-])c1)c1ccccn1	109088386	WLBICYWLWMQPIY-UHFFFAOYSA-N	441.425	1.865	50	20	IDGD	
CCOC(=O)C1=NN(c2ccccc2)[C@@H](C(=O)NNC(=O)CNc2ccccc2OC)C1	110970498	XTJCXSPVRDIGAU-GOSISDBHSA-N	439.472	1.453	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)c3ccc(F)c(NS(C)(=O)=O)c3)n[nH]2)cc1	725886075	FTESTQPFKDWKHY-UHFFFAOYSA-N	431.449	1.971	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1)NNC(=O)c1ccccc1O	725904359	VFRFZCKVCYKVRT-UHFFFAOYSA-N	433.364	1.030	50	20	IDGD	
COCCCN1CCC(NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)CC1	727030902	DFBARVQWQYRRIK-UHFFFAOYSA-N	446.596	1.030	50	20	IDGD	
O=C(COC(=O)c1cc([N+](=O)[O-])cc2c1OCCO2)NNC(=O)c1cccc(Cl)c1	727565010	IUPXDBPIHSENCQ-UHFFFAOYSA-N	435.776	1.637	50	20	IDGD	
O=C(CCCCc1ccc(I)cc1)NNC(=O)C(=O)NC1CC1	727728541	QTXBCDSLZWNHTC-UHFFFAOYSA-N	429.258	1.430	50	20	IDGD	
CN(C)C(=O)c1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1	728177080	SUBNBFIRFAVMLZ-UHFFFAOYSA-N	444.513	1.248	50	20	IDGD	
Cc1nn(CC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)c(C)c1Cl	728216105	QOKMAFOLDKCRHU-UHFFFAOYSA-N	440.957	1.233	50	20	IDGD	
CC1(C)NC(=O)N(CCCC(=O)NNC(=O)c2cc(F)ccc2Br)C1=O	728549312	BZPLCJODHPHRFU-UHFFFAOYSA-N	429.246	1.460	50	20	IDGD	
COc1cc(C)c(S(=O)(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1OC	728854443	VVQTVFWTZARPRY-UHFFFAOYSA-N	435.506	1.028	50	20	IDGD	
CC(C)NC(=O)C(=O)NNC(=O)c1nc(C(C)C)n(-c2c(Cl)cccc2Cl)n1	728858081	FCMWGFYPXIYHSW-UHFFFAOYSA-N	427.292	1.983	50	20	IDGD	
CC[C@H](C)NC(=O)CN1CCN(C(=O)NNC(=O)c2cccc(OC(F)F)c2)CC1	728953588	IAHQFQUBHIXDPX-ZDUSSCGKSA-N	427.452	1.175	50	20	IDGD	
COCCOc1cn(-c2ccccc2)nc1C(=O)NNC(=O)c1cc(OC)cc(OC)c1	729300601	TVMPBWPYAMVPPZ-UHFFFAOYSA-N	440.456	1.990	50	20	IDGD	
O=C(NNC(=O)N1CCCO[C@H](c2ccccc2)C1)c1csc(N2CCOCC2)n1	729856826	IPFSUAKOGCBDQT-KRWDZBQOSA-N	431.518	1.798	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)c2cc(S(=O)(=O)N3CCC[C@@H](C)C3)cn2C)c1	730206716	ZWKGCKADCRSOEW-MRXNPFEDSA-N	448.545	1.594	50	20	IDGD	
Cc1nc2cc(O)nn2c(C)c1CC(=O)OCC(=O)NNC(=O)c1ccc(Cl)cc1	731448387	ITUFMUWKJQLXTE-UHFFFAOYSA-N	431.836	1.252	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)N1CCN(CC(=O)N2C[C@H](C)C[C@@H](C)C2)CC1	731501034	XSQKTXQPRYQURU-IAGOWNOFSA-N	431.537	1.172	50	20	IDGD	
O=C(CCN1CCN(C(=O)[C@@H]2CCCO2)CC1)NNC(=O)Cc1cccc2ccccc12	731843166	YNXDRQVQVIMORM-NRFANRHFSA-N	438.528	1.243	50	20	IDGD	
O=C(CCN1CCN(C(=O)[C@@H]2CCCO2)CC1)NNC(=O)C12CC3CC(CC(C3)C1)C2	731960046	XHCWFMYZFPMMSC-HJGBXLFDSA-N	432.565	1.064	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)NCCNS(=O)(=O)c1cccc([N+](=O)[O-])c1)c1ccccc1	732455476	MZHRXWHQPOSHNZ-QGZVFWFLSA-N	449.489	1.397	50	20	IDGD	
CC(C)(C)OC(=O)NCc1nc(C(=O)OCC(=O)NNC(=O)c2ccccc2)cs1	732871259	YQOFVXNWCPDUSL-UHFFFAOYSA-N	434.474	1.786	50	20	IDGD	
Cc1cccc(N2C(=O)N[C@H](CCC(=O)NNC(=O)c3cnn(-c4ccccc4)c3)C2=O)c1	733108240	CBDYMFRAFVBLBZ-LJQANCHMSA-N	446.467	1.847	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)c1cnn(-c2ccccc2)c1)N1CCN(c2ccc(F)cc2)CC1	733365217	VWRRYPFCWNBWEL-KRWDZBQOSA-N	436.491	1.983	50	20	IDGD	
Cn1c(NNC(=O)[C@@H]2C[C@@H](O)CN2C(=O)OCc2ccccc2)nc2ccccc2c1=O	733365815	STKTZGHLRWXPOH-QAPCUYQASA-N	437.456	1.149	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NC[C@H](C)Oc2ccccc2)cc1	733850540	VZJQMUAXSOJPQO-INIZCTEOSA-N	434.518	1.413	50	20	IDGD	
CC(C)N1CC[C@@H](NC(=O)NNC(=O)[C@H]2Cc3ccccc3CN2Cc2ccccc2)C1=O	734168669	ZXDWJFNVRHQPDF-FGZHOGPDSA-N	449.555	1.953	50	20	IDGD	
C[C@H](NC(=O)C1CCCCC1)C(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	734825441	FRSDKZYOBDAKIE-AWEZNQCLSA-N	439.557	1.801	50	20	IDGD	
COCCOc1ccc(-n2nc(C)c(C(=O)NNC(=O)c3cccc(OC)c3O)n2)cc1	735115351	XXUDBPAOZNHQIX-UHFFFAOYSA-N	441.444	1.390	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)CSc1nnc(-c2ccc(Cl)cc2)o1	740850829	BAIKTCXGZWDUFB-UHFFFAOYSA-N	425.898	1.934	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)c2ccc(C[C@H]3CC(=O)NC3=O)cc2)cc1	741144114	FNMNKEHBZRZDDP-YOEHRIQHSA-N	439.468	1.519	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)CCN1CCN(c2ccccn2)CC1	741144449	SKNJZZOYGJADDT-UHFFFAOYSA-N	427.505	1.219	50	20	IDGD	
COC(=O)c1cc(Cl)cc(S(=O)(=O)NNC(=O)c2ccc(OC)c(OC)c2)c1	741648884	PVFDSBUVVVDIEE-UHFFFAOYSA-N	428.850	1.767	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(NC(=S)NNC(=O)c2cc([N+](=O)[O-])ccc2O)c1	743059699	ODLOIQMKQVPAKF-UHFFFAOYSA-N	439.475	1.182	50	20	IDGD	
Cc1ccc(S(=O)(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)c(Br)c1	743268620	AWOJRSNCPVFMHC-UHFFFAOYSA-N	430.236	1.995	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2C[C@]23CCCc2ccccc23)c1	743283757	FIVLKVYYYMJFRY-UGKGYDQZSA-N	427.526	1.992	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)CCCNC(=O)c2ccc(F)cc2F)c1	744519076	YODZBMRRJPGFCX-UHFFFAOYSA-N	433.411	1.788	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)N[C@@H](CN1CCOCC1)c1ccccc1	745359426	KTJZPDOVLGBVKX-KRWDZBQOSA-N	429.433	1.318	50	20	IDGD	
CC(=NNC(=O)N1CCOCC1)c1ccc(S(=O)(=O)N2CCCC[C@H]2C(=O)O)cc1	745591178	RVSPVOBHANTJAE-KRWDZBQOSA-N	438.506	1.080	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@@H]2C[C@]2(C)c2ccccc2)cc1	745858145	XYOAIDZFFDRZEW-WIYYLYMNSA-N	430.530	1.676	50	20	IDGD	
Cc1nnc(SCC(=O)NNC(=O)Cc2cn3ccccc3n2)n1Cc1ccccc1	746642531	ZEIIWMNIRYXTKF-UHFFFAOYSA-N	435.513	1.765	50	20	IDGD	
Cc1cc(C)nc(SCc2ccc(C(=O)NNC(=O)[C@@H](C)CS(C)(=O)=O)cc2)n1	746826302	SCZHHOWRENQYAA-LBPRGKRZSA-N	436.559	1.827	50	20	IDGD	
O=C(COC(=O)CC[C@H]1Cc2ccccc2NC1=O)NNC(=O)c1cccc([N+](=O)[O-])c1	746922606	KDRKCCJIAQESCS-HNNXBMFYSA-N	440.412	1.490	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)CCSc3ccccn3)cc2)CC1	748618485	CXLFXGSDXOAVOZ-UHFFFAOYSA-N	435.575	1.643	50	20	IDGD	
Cn1c(=O)n(CCC(=O)NNc2nc(Br)cn3ccnc23)c2ccccc21	750250597	WBJHLPYMQHWSNX-UHFFFAOYSA-N	430.266	1.679	50	20	IDGD	
CCn1cc(Br)cc1C(=O)NNC(=O)c1csc(N2CCOCC2)n1	750662871	HXWXRSOJWFWFRC-UHFFFAOYSA-N	428.312	1.638	50	20	IDGD	
Cc1nnc2n1C[C@H](C(=O)NNC(=O)[C@H]1Cc3ccccc3CN1Cc1ccccc1)CC2	750728695	YEITWSHQIMNZOE-FGZHOGPDSA-N	444.539	1.923	50	20	IDGD	
CCN(CC)CCN1C(=O)C(=NNC(=O)CNC(=O)c2cccs2)c2ccccc21	750948860	YFENWYISCOPEBL-UHFFFAOYSA-N	427.530	1.687	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)N[C@@H]2CCN(c3cccc(Cl)c3)C2)c2ccccc2c1=O	751103541	QYZWYHNVPFZTMT-CQSZACIVSA-N	440.891	1.810	50	20	IDGD	
O=C(O)c1ccc(O)c(S(=O)(=O)NNC(=O)c2cc(F)ccc2Br)c1	751212348	DZFSODPQTXCVIW-UHFFFAOYSA-N	433.211	1.615	50	20	IDGD	
CCOc1ccccc1C(F)(F)C(=O)OCC(=O)NNC(=O)Cc1nc(C)cs1	753484610	CZRTYWBSDTVIGE-UHFFFAOYSA-N	427.429	1.875	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cccc(OC(C)C)n2)c1	754826248	LEDGAJLFUXAXBJ-UHFFFAOYSA-N	434.518	1.974	50	20	IDGD	
O=C(CCNS(=O)(=O)c1cccc([N+](=O)[O-])c1)NNc1nc(C(F)(F)F)cs1	755859754	JUOFPPIKAFDQKY-UHFFFAOYSA-N	439.397	1.882	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2nnc(C(C)(C)C)s2)c1	756155559	RSWQNONIQVCGSJ-UHFFFAOYSA-N	426.524	1.552	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)Nc1cccc(OCCS(C)(=O)=O)c1	756297021	FSJKNGYDAWRZOL-ZDUSSCGKSA-N	439.465	1.869	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2ccc(CNC(=O)OC)cc2)c2ccccc2c1=O	756609873	FRGOGSOLMRBAGG-UHFFFAOYSA-N	438.444	1.739	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)Nc2cc(S(=O)(=O)N(C)C)ccc2F)cc1	756684417	OBDQFCUKEDEWJA-UHFFFAOYSA-N	440.453	1.316	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2cc(C3CCCCC3)[nH]n2)ccc1Cl	758076330	SEDDXAULLBRBNN-UHFFFAOYSA-N	425.898	1.833	50	20	IDGD	
C[C@@H](COc1ccccc1C(F)(F)F)NC(=O)NNC(=O)C(=O)Nc1ccccn1	758715281	UHQLQJIGPYZGHW-NSHDSACASA-N	425.367	1.837	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cc(Br)cn2)cc1)C(=O)Nc1ccccn1	758826821	FNNGHCMGGVCFGB-UHFFFAOYSA-N	429.234	1.430	50	20	IDGD	
CCS(=O)(=O)c1cccc(S(=O)(=O)NNC(=O)c2cc(Br)c[nH]2)c1	760341031	YLIWNRYTPFLIEB-UHFFFAOYSA-N	436.309	1.194	50	20	IDGD	
C[C@H]1CN(Cc2ccccc2)C[C@H](C)C1NC(=O)NNC(=O)CNC(=O)c1cccs1	761789331	GFAUHNDUDPRLSX-HOTGVXAUSA-N	443.573	1.965	50	20	IDGD	
Cn1nccc1CCNC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	763161284	JONLGYTUFBFKEA-UHFFFAOYSA-N	448.530	1.469	50	20	IDGD	
Cc1cc(C(=O)N2CCCC2)ccc1NC(=O)C(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	763467323	BZLQLEYVEZENOK-UHFFFAOYSA-N	439.428	1.539	50	20	IDGD	
O=C1C[C@@H](c2cccc(NC(=O)C(=O)NNC(=O)c3cc4ccccc4cc3O)c2)CN1	763522644	NQLHFLOICYKAJW-MRXNPFEDSA-N	432.436	1.549	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2O)cc1S(=O)(=O)NC(C)(C)C	763529976	ZWJDSHBSPTZGFR-UHFFFAOYSA-N	448.501	1.177	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1cc(C#N)ccc1OC(F)F	763628816	MNBXNSKDLAKXCC-UHFFFAOYSA-N	428.355	1.516	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2ccccc2SCCC(N)=O)c1	763630326	JVYMZPZWSVCSIO-UHFFFAOYSA-N	430.486	1.127	50	20	IDGD	
CC(C)CC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)cc1	763678154	DWXLFNKDEKXLJE-UHFFFAOYSA-N	437.456	1.708	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(C(=O)N(C)C)c(Cl)c1	763717489	VSCATEKNWOFWNY-UHFFFAOYSA-N	446.891	1.769	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)Cc2c(C)nn(CC(F)(F)F)c2C)n1	763828142	NBNGOBNJMBPIRC-UHFFFAOYSA-N	447.439	1.303	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cccc(-c3nncn3C)c2)c1C	763842232	XQYITFGNPAASAA-HNNXBMFYSA-N	436.472	1.652	50	20	IDGD	
C#CCOc1ccc(F)cc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccc(C(C)=O)cc1	763878297	OPHXSPAVTHDZST-CQSZACIVSA-N	441.415	1.594	50	20	IDGD	
Cc1cc(C(=O)N2CCSCC2)ccc1NC(=O)C(=O)NNC(=O)c1ccccc1C	763957587	FLRIVVXYNYNDJP-UHFFFAOYSA-N	440.525	1.892	50	20	IDGD	
CC(C)(C)OC(=O)N1CCc2ccc(NC(=O)C(=O)NNC(=O)c3cnccn3)cc2C1	764023907	GFONSWWSAOBQGJ-UHFFFAOYSA-N	440.460	1.170	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(C(=O)NC(C)C)ccc2Cl)c(O)c1	764109891	DARFJDGMLBEHFC-UHFFFAOYSA-N	432.864	1.892	50	20	IDGD	
NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(F)ccc2Br)cc1F	764278013	PUPIVWVNALJINH-UHFFFAOYSA-N	441.188	1.226	50	20	IDGD	
O=C(NNC(=O)c1cc(F)ccc1Br)C(=O)Nc1ccc(-n2ccnc2)nc1	764278616	UGPQTVLHWRVAJO-UHFFFAOYSA-N	447.224	1.569	50	20	IDGD	
CCN1CCN(Cc2ccc(NC(=O)C(=O)NNC(=O)c3cc4ccccc4o3)cc2)CC1	764330908	HESGJLJKGYQOMG-UHFFFAOYSA-N	449.511	1.970	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)C(=O)Nc1ccc(NS(=O)(=O)CC)cc1)c1ccccc1	764332322	QDAKGYWVLFOODQ-QGZVFWFLSA-N	432.502	1.728	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CNC(=O)c2cccnc2)cc1NC(=O)NC(C)(C)C	764342890	JLRQKUZGQYDXFM-UHFFFAOYSA-N	426.477	1.501	50	20	IDGD	
C[C@H]1COCCN1c1ccc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1	764344032	XZSHDDGSFKELKM-INIZCTEOSA-N	448.483	1.497	50	20	IDGD	
COC(=O)c1cc2cc(NC(=O)C(=O)NNC(=O)CSc3ccccc3O)ccc2o1	764401659	PRJDPKBPRJDAKE-UHFFFAOYSA-N	443.437	1.803	50	20	IDGD	
C[C@@H]1CN(c2ccc(C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)cn2)C[C@@H](C)O1	765322051	GJHFZPFUEOBNND-HUUCEWRRSA-N	435.525	1.761	50	20	IDGD	
C=CCNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)cc1	765571865	RETLEELDOBLELY-UHFFFAOYSA-N	431.499	1.677	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)COc3c(C)nn(C)c3C)n[nH]2)cc1OC	765596247	HXSMKXLTNZEHNE-UHFFFAOYSA-N	428.449	1.284	50	20	IDGD	
Cc1cc(C)cc(OCCC(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)c1	765738666	MJHRBOLTPUTLNK-UHFFFAOYSA-N	438.528	1.678	50	20	IDGD	
O=C(CCSc1ccccc1)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765738684	MQAYLVZAYFXJNO-UHFFFAOYSA-N	426.542	1.774	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1	766264791	OVHHRDOAWUSWJS-UHFFFAOYSA-N	448.505	1.132	50	20	IDGD	
CC(C)CN1N=C(C(=O)NNC(=O)c2ccc(CSc3nncn3C)cc2)CCC1=O	766630239	GFWPOEDGVXLAGS-UHFFFAOYSA-N	443.533	1.503	50	20	IDGD	
COc1cccc(C[C@H](C(=O)NNc2ccccc2S(C)(=O)=O)n2nnnc2C)c1	766664304	ZSPDNQGYMSBDFB-QGZVFWFLSA-N	430.490	1.321	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)c1ccc(=O)n(-c2cccc(F)c2)c1	767367905	XCMHRKCBGAUKCV-UHFFFAOYSA-N	437.427	1.832	50	20	IDGD	
COc1cc2c(cc1OC)CN(C(=O)CCC(=O)NNC(=O)CNc1ccccc1)CC2	767840993	VESKDCOZBIJLKF-UHFFFAOYSA-N	440.500	1.628	50	20	IDGD	
CCN1CCC[C@H]1CN1C[C@@H](C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)CC1=O	768279283	MBNUGRCJNNGIGH-RDJZCZTQSA-N	442.495	1.310	50	20	IDGD	
C[C@@]1(c2cccc(C(=O)NNC(=O)c3ccc(F)cc3Br)c2)NC(=O)NC1=O	768957323	FIUXYBQJLBKVLY-SFHVURJKSA-N	449.236	1.718	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)NC2CCN([C@@H]3CCC[C@@H]3O)CC2)cc1OC	769157424	VGLFIYNRWTZQII-MSOLQXFVSA-N	434.537	1.806	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)Nc1ccccc1CS(C)(=O)=O	769234316	USYMJNABGNTALP-UHFFFAOYSA-N	427.504	1.792	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)Cn3cnc4sc(-c5ccccc5)cc4c3=O)nc21	770970711	CMVHOOWYVBZGSX-UHFFFAOYSA-N	448.468	1.651	50	20	IDGD	
C[C@@]1(c2ccc(Br)cc2)NC(=O)N(CC(=O)NNC(=O)c2ccccc2)C1=O	771217095	RSSXIAFPMCVGFH-IBGZPJMESA-N	445.273	1.677	50	20	IDGD	
O=C(NNC(=O)c1coc(C2CCOCC2)n1)c1ccc(S(=O)(=O)N2CCCC2)cc1	771608284	HTATWSCRFLMHHE-UHFFFAOYSA-N	448.501	1.428	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)[C@@H]1CCN(c2cccc(Br)c2)C1=O	772033702	VORXQEAIBHRRIH-ZWNOBZJWSA-N	426.267	1.291	50	20	IDGD	
CC(C)[C@H]1C[C@H](NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)CCO1	772619767	NOYCYVVJVDTWEZ-SJLPKXTDSA-N	438.550	1.619	50	20	IDGD	
Cc1nc2[nH]n(C)c(=O)c2c(C)c1CC(=O)NNC(=O)[C@@H](C)Oc1cccc(Cl)c1	772998924	RMAQFFNUYXBLGK-GFCCVEGCSA-N	431.880	1.689	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(NC(=O)C(=O)NNc2ncc(Cl)cc2Cl)c1	773679283	DZMQMEDJAHKFRU-UHFFFAOYSA-N	432.289	1.721	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)nn1C	775913210	BWFHZNJALHCNEZ-UHFFFAOYSA-N	447.459	1.597	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)[nH]n1)Nc1ccnn1[C@H]1CCS(=O)(=O)C1	776058969	MWKIOECPJWRYIT-ZDUSSCGKSA-N	429.462	1.099	50	20	IDGD	
COC(=O)N1CCC([C@H](C)NC(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)CC1	776845348	XLAVLAYCLLVDPU-LBPRGKRZSA-N	438.481	1.523	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(OCC(F)(F)F)nc1)c1ccc2c(c1)OCCO2	777915248	QZBAFCHBVWJWHQ-UHFFFAOYSA-N	433.364	1.417	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN[C@H](c2nc(-c3nc[nH]n3)no2)C(C)C)cc1C	778139108	AQSUAOJBNBSOJO-AWEZNQCLSA-N	432.510	1.535	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc2c(cc1F)NC(=O)CC2	778707847	XGFVCVXZWFQEQG-UHFFFAOYSA-N	428.420	1.438	50	20	IDGD	
CCNC(=O)N(C)NC(=O)c1cc(I)ccc1N1CCOCC1	779059724	CDFYYDRCLDKEOR-UHFFFAOYSA-N	432.262	1.434	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)c1cn(-c2cccc(Cl)c2)nn1	781393590	WKCVZGCHHNCPQE-UHFFFAOYSA-N	427.848	1.776	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2ccccc2-c2ccno2)cc(OC)c1OC	782250112	UEERWXKXOMUEGV-UHFFFAOYSA-N	433.442	1.991	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccc3c(c2)OCCCO3)nc1	783265765	XFMPOLBPINMXNA-UHFFFAOYSA-N	449.489	1.011	50	20	IDGD	
CCN(CC)CCNC(=O)c1cccc(NC(=O)C(=O)NNc2cc(C)nc(C)n2)c1	783324304	GCBGTJHVRBMFDM-UHFFFAOYSA-N	427.509	1.247	50	20	IDGD	
Cc1ccc(NNC(=O)C(=O)Nc2cc(NC(=O)CN3CCCC[C@H]3C)ccc2F)nn1	783950070	JVQMWLCPGKBDOZ-CQSZACIVSA-N	443.483	1.819	50	20	IDGD	
CN1CCN(C(=O)Cc2ccc(NC(=O)C(=O)NNc3ccc(Cl)c(F)c3)cc2)CC1	785179237	YZAVVYLGZBIWOX-UHFFFAOYSA-N	447.898	1.877	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)[C@@H](C)C1CN(C(=O)OC(C)(C)C)C1	786988773	JNPZOCRBDFWQAS-HNNXBMFYSA-N	433.505	1.731	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)[C@H]1CC(=O)N(C2CC2)[C@@H]1c1cccc(OC)c1	788164953	WMIOCDNXPNJNMG-PKOBYXMFSA-N	433.505	1.684	50	20	IDGD	
NS(=O)(=O)c1ccccc1NNC(=O)c1cc(Br)c2c(c1)OCCO2	788230244	KTDUHHPPKUPFII-UHFFFAOYSA-N	428.264	1.625	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)C(C)(C)COc1cc(Cl)cc(Cl)c1	792317490	VENBXLRPLVISOA-VIFPVBQESA-N	426.322	1.484	50	20	IDGD	
CC[C@@H](C)CC[C@@H](O)CC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	792774053	MOMGWRHTZITSJT-NVXWUHKLSA-N	425.551	1.809	50	20	IDGD	
CN(C)N(C(=O)c1cccc(NS(=O)(=O)C(F)(F)F)c1)[C@H]1CCS(=O)(=O)C1	792853473	DVXKZMMVISPBGO-LBPRGKRZSA-N	429.442	1.054	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)nc1Br	793021574	FGZBYCXUMMFMEL-SNVBAGLBSA-N	439.241	1.845	50	20	IDGD	
COc1c(NC(=O)C(=O)NNC(=O)c2cc3ccccc3o2)cc(Cl)cc1C(N)=O	793027755	ZGGAJFKDKFKXKB-UHFFFAOYSA-N	430.804	1.593	50	20	IDGD	
COC(=O)CN1CCN(c2ccc(NC(=O)C(=O)NCCSSC)cc2)CC1	793078696	QFTFSOZFKADAAH-UHFFFAOYSA-N	426.564	1.048	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNC(=O)NNC(=O)c1ccc2ccccc2n1	793216548	FQLAZRHIDNIPKL-UHFFFAOYSA-N	436.428	1.136	50	20	IDGD	
CC(C)N(C)c1cccc(NC(=O)C(=O)NNC(=O)CNC(=O)OCc2ccccc2)c1	797369427	WECVHVIJKPCFJQ-UHFFFAOYSA-N	441.488	1.544	50	20	IDGD	
Cc1ccc(N2CCOCC2)cc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccccc2)on1	797536267	YHDZHIMTZKNSPL-UHFFFAOYSA-N	449.467	1.886	50	20	IDGD	
N#Cc1ccc(NNC(=O)C(=O)Nc2cnn(CC(=O)NC3CC3)c2)c(C(F)(F)F)c1	799840300	IGNOPNYQWHRHPM-UHFFFAOYSA-N	435.366	1.134	50	20	IDGD	
Cc1c(I)cc([N+](=O)[O-])cc1C(=O)NNC(=O)N=c1cc[nH]cc1	802029946	SIAACFYVKZLGBV-UHFFFAOYSA-N	441.185	1.791	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)CN2CCN(C(=O)OCc3ccccc3)CC2)cc1	802054259	DXLRHFVGMNPQMT-UHFFFAOYSA-N	441.488	1.802	50	20	IDGD	
COc1ccccc1-c1nn(C)cc1C(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	802065658	HHZLUEHUUWMIHD-UHFFFAOYSA-N	443.485	1.966	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@@H]2CCCN2C(=O)c2ccccc2O)cc1	802068030	XEBNTLVZDXGYON-INIZCTEOSA-N	446.485	1.253	50	20	IDGD	
COc1cccc(C[C@H](C(=O)NNC(=O)Nc2ccc(N(C)C)cc2)n2nnnc2C)c1	802120343	PZZGLUIRQFNOGF-LJQANCHMSA-N	438.492	1.693	50	20	IDGD	
O=C(CCn1c(=O)oc2cc(S(=O)(=O)N3CCCC3)ccc21)NNc1ncccc1F	804212998	HBDAHATXQDPREX-UHFFFAOYSA-N	449.464	1.447	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCn3c(C4CCCC4)nnc3[C@@H]2C)cc1OC	805789497	DBXIKDZEHIKBAW-AWEZNQCLSA-N	442.520	1.791	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(NC(=O)NNC(=O)c2ccc(O)c(Cl)c2)ccc1F	806541689	IEWCXYQVGLKFSX-UHFFFAOYSA-N	430.845	1.902	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1c[nH]c2c(F)cc(F)cc2c1=O	806791382	DNFJFHXBNNBLJQ-UHFFFAOYSA-N	428.399	1.274	50	20	IDGD	
Cc1cccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)N3CCN(C)CC3)c2)c1	807382396	BJUXGLIGALQQBO-UHFFFAOYSA-N	431.518	1.398	50	20	IDGD	
Cc1cc([N+](=O)[O-])ccc1NNC(=O)C(=O)Nc1ccc2oc(=O)n(CCN(C)C)c2c1	807456041	UHFMILGYUGRCJK-UHFFFAOYSA-N	442.432	1.455	50	20	IDGD	
C[C@H]1C(=O)Nc2cc(C(=O)NNC(=O)[C@@H]3CCCN(C(=O)OC(C)(C)C)C3)ccc2N1C	808011258	RNRNBWMWJQPNAW-DZGCQCFKSA-N	445.520	1.872	50	20	IDGD	
CCOC(=O)C(=O)c1cc(S(=O)(=O)NNC(=O)c2cccc3ccccc23)cn1C	808094666	XFKFJHXWCVQXNG-UHFFFAOYSA-N	429.454	1.547	50	20	IDGD	
CCOC(=O)c1ccc(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)cc1	810342092	WOEUPPRMECWLDY-UHFFFAOYSA-N	446.529	1.556	50	20	IDGD	
COC(=O)Cc1occ(C)c1C(=O)NNC(=O)CN1CCN(Cc2ccc(C)cc2)CC1	810593628	DQPJDPWNSKESIC-UHFFFAOYSA-N	442.516	1.191	50	20	IDGD	
Cc1cccc2c1OC[C@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)C2	812639298	GRUOJNZKIFSQSW-MRXNPFEDSA-N	432.502	1.193	50	20	IDGD	
CC(C)COC(=O)N1CCC(C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)CC1	812730658	QTDPDTAFLLDCKY-UHFFFAOYSA-N	426.539	1.885	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc([C@H]3CCOC3)cc2)cc1	815566034	HEUIVOKJNXOQLM-QAPCUYQASA-N	439.468	1.947	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCc2nncn2C1)C(=O)Nc1ccc(COc2ccccc2)cc1	815691078	DYKRLXMXXNRZRN-MRXNPFEDSA-N	434.456	1.206	50	20	IDGD	
CN(C)c1ccc(C2(C(=O)N3CCN(S(=O)(=O)CBr)CC3)CC2)cc1	815964790	SJMIHHLXVVDCPR-UHFFFAOYSA-N	430.368	1.611	50	20	IDGD	
COCCCOc1ccc(C(=O)NNC(=O)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)cn1	816510215	PIGXFNAGWWIFIA-MRXNPFEDSA-N	436.509	1.905	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C[C@@](O)(c2nccn2C)C(F)(F)F)cc1OC	818652764	MMRGOZNYHXWZMG-QGZVFWFLSA-N	430.383	1.429	50	20	IDGD	
O=C(CN1C(=O)[C@H]2CCCC[C@@H]2C1=O)NNC(=O)c1ccc(COc2ccccc2)o1	913234620	JZAIXCIMRIFAAV-IRXDYDNUSA-N	425.441	1.795	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)c1ccccc1F)C(=O)NNC(=O)c1ccccc1C	913263982	SSBQAROCBGZLLM-MRXNPFEDSA-N	439.534	1.995	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)c1cccc(CN2C(=O)CSC2=O)c1	913476910	NZFIXRJTBZWYFI-UHFFFAOYSA-N	428.470	1.764	50	20	IDGD	
CCOC(=O)c1cnn(-c2ccc(C(=O)N([C@H]3CCS(=O)(=O)C3)N(C)C)cc2)c1C	915141655	UWVZKEAFPJBTRV-KRWDZBQOSA-N	434.518	1.463	50	20	IDGD	
CCN(CC)CCNC(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	915879396	HHQPLNODGNWOGP-UHFFFAOYSA-N	436.516	1.731	50	20	IDGD	
COc1ccc([C@H](CNC(=O)NNc2nc(C)cc(C)n2)N2CCOCC2)cc1OC	915895522	OLSFEVDLFOSQTP-KRWDZBQOSA-N	430.509	1.810	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)NCCNS(=O)(=O)c1ccccc1	916294029	STBJIAGXMVNOJI-UHFFFAOYSA-N	426.882	1.271	50	20	IDGD	
CS(=O)(=O)NCCc1ccc(C(=O)NNC(=O)Cc2ccc3ccccc3c2)cc1	917195764	XHMMNTAZPHZRLL-UHFFFAOYSA-N	425.510	1.935	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1cn(C)nc1C(F)(F)F	919464042	WWPIVSIVYKNLCZ-UHFFFAOYSA-N	434.758	1.719	50	20	IDGD	
CCCOc1c(Cl)cc(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)cc1OCC	919883417	CTGYCVRRYPRMPT-GFCCVEGCSA-N	433.914	1.659	50	20	IDGD	
COc1ccc(NC(C)=O)cc1S(=O)(=O)NNC(=O)c1nnc(-c2ccccc2)o1	919961751	OGRLGLFPYFUWLJ-UHFFFAOYSA-N	431.430	1.327	50	20	IDGD	
CC[C@@H](C)[C@H](C)NC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	920048527	JGFIQVCEQYAGDZ-CVEARBPZSA-N	440.566	1.405	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)[C@@H]1CCCN1C(=O)Cc1ccccc1	920288817	ZBAGMNHFCHPXGI-FQEVSTJZSA-N	433.512	1.980	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H](C)OC[C@H]2CCCO2)c1	921020116	RPEPMEZTVKRUHE-GOEBONIOSA-N	427.523	1.062	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)N[C@@H]2CCO[C@@]3(CCSC3)C2)cc1	1116307626	XZXPCDRWNKIFIA-DYVFJYSZSA-N	428.536	1.481	50	20	IDGD	
CNS(=O)(=O)c1ccc(CC(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)cc1	1320157299	QURYSIUSUTZUFO-UHFFFAOYSA-N	438.456	1.451	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)C2(c3cccc(C#N)c3)CC2)cc1	1322768764	NOTFHWPXNKEIEA-UHFFFAOYSA-N	426.498	1.366	50	20	IDGD	
COc1ccc2nc(C(=O)N3CC[C@@]4(C3)CN(C(=O)[C@@H](O)CCl)CCO4)ccc2c1	1777891992	TWHDSXNTZOWNPT-GHTZIAJQSA-N	433.892	1.287	50	20	IDGD	
C[C@H](NC(=O)c1ccccn1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Cl)C1	1778030860	ZFYFZQYVEWQJNC-NCLAMWEWSA-N	440.903	1.248	50	20	IDGD	
COc1cc(OC)cc(C(=O)N2CC[C@]3(CN(C(=O)CCBr)CCO3)C2)c1	1780657173	MZAFWESKKDWNCS-IBGZPJMESA-N	441.322	1.932	50	20	IDGD	
NC[C@H](N)C(=O)N1CCO[C@]2(CCN(C(=O)CCCCCCCCCCCl)C2)C1	1781150112	BWIHAQLGYPRMOM-RXVVDRJESA-N	431.021	1.852	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)[C@H]3COc4ccccc4O3)CCO2)C1	1781225571	ZZMXPRGBULPZDV-UXPWSPDFSA-N	443.327	1.893	50	20	IDGD	
O=C(c1nc2ccc(F)cn2n1)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781335320	XNRAJCSDQAGNRR-BLLLJJGKSA-N	444.236	1.002	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(CCN(C(=O)c3ccc(O)c([N+](=O)[O-])c3)C2)C1	1781539579	ZKTFRJZEEDGVTM-KRWDZBQOSA-N	442.266	1.529	50	20	IDGD	
Cc1cnc2c(C(=O)N3CC[C@H]4OCCC[C@@]4(CNC(=O)C(Cl)Cl)C3)cnn2c1	1782217944	DEMGHZMIOBYNJI-AUUYWEPGSA-N	440.331	1.969	50	20	IDGD	
CSCC[C@H](O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@](C)(Cl)CCl)C2	1782232281	FHXYEPMHJUFZDX-IHETXDGRSA-N	441.421	1.851	50	20	IDGD	
COc1ccccc1CC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1783328094	BICBFXIVFCWQDF-FUHWJXTLSA-N	429.286	1.758	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3nccnc3OC)CCO2)C1	1783342524	AWPYVNKQSKUTFP-PXAZEXFGSA-N	427.299	1.102	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H]3C[C@@]34C(=O)Nc3ccccc34)C2)C1	1783548091	XNYYESGUNWTTNM-QDGJQWLKSA-N	431.920	1.744	50	20	IDGD	
CC(C)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCC(=O)N3CCCC3)C[C@@H]21	1783845857	FUMUZPFAEUVUOB-ULQDDVLXSA-N	427.973	1.634	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cc(N4CCCC4)ccn3)CCO2)C1	1783873997	BBTIAAREFYJZNJ-LAUBAEHRSA-N	436.940	1.379	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(=O)c3ccco3)C[C@@H]21	1783970326	WAPZUDFIHDSCQQ-OSFYFWSMSA-N	427.295	1.473	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3[C@H]4C=CS[C@@H]43)C[C@@H]21	1783975121	ZYLGLLLICLTHCU-SBXGDREPSA-N	429.380	1.872	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)c3ccccc3)[C@H]2C1	1784908229	USBMRCMYCKKYKY-RYLXDESZSA-N	434.512	1.050	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnn(-c4cccnc4)c3)[C@H]2C1	1785731589	HIIWRIGYFSITJD-FZDIXFNVSA-N	431.924	1.878	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(F)(F)F)[C@H]2C1	1786005245	WPXNWXBFKWKAFH-YUDUHTQSSA-N	449.857	1.948	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc4cn[nH]c4cn3)[C@H]2C1	1788467297	RMEHWYKUYUQRNT-HMSCVONGSA-N	440.331	1.788	50	20	IDGD	
Cn1cc(F)cc1C(=O)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1	1788850461	YCDFDICXNFLYIC-UHFFFAOYSA-N	435.264	1.906	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc[n+]([O-])cc3)[C@H]2C1	1789098462	XIAAGSDOLHREMS-JONQDZQNSA-N	426.311	1.087	50	20	IDGD	
Cc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Br)C[C@@H]32)c(C)n1C	1789121620	DEUXCLRWZNBCTF-TUUVXOQKSA-N	430.318	1.926	50	20	IDGD	
O=C(NC1(c2ccc(NC(=O)c3cc4n(n3)CCC4)cc2)CCC1)c1ccc(B(O)O)cc1	1789353182	XLNIDMZABIPVGD-UHFFFAOYSA-N	444.300	1.571	50	20	IDGD	
COC[C@@H](C)C(=O)NC1(c2ccc(NC(=O)c3cnccc3C(=O)NN)cc2)CCC1	1789519843	LMDMSSHXWOXIQB-CQSZACIVSA-N	425.489	1.715	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]3C2)cn1	1789868501	GYHMLHFFBGSDGG-XLPNERPQSA-N	430.332	1.920	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3CCC[C@H](C(=O)OC)C3)[C@H]2C1	1791245346	IOZQZSPNZMCHCF-QQCJEOGWSA-N	428.957	1.963	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC1(c2ccc(NC(=O)C[C@](C)(O)CC(=O)O)cc2)CCC1	1791596631	UBSKPFCPSVFBFN-BEFAXECRSA-N	426.897	1.990	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(C)s1	1794631739	HBLRSMPZYIRYLD-SNOXVSQISA-N	443.529	1.394	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ncn(-c3ccccc3)n1)C2	1795114447	KQGJQEGYYCQDND-XOIINTDNSA-N	448.321	1.256	50	20	IDGD	
Cn1c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)ccc1C(F)(F)F	1796189128	ZFFVYKQGTCLVHY-MUJYYYPQSA-N	449.238	1.289	50	20	IDGD	
COc1ccc(F)cc1CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1	1796190512	HGMFIWVOWYXIGT-ACDBMABISA-N	440.280	1.009	50	20	IDGD	
CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Cl	1796367100	XWXHSNOCQIHFEG-OXUXUCFPSA-N	428.848	1.398	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)c1cc(Br)cs1	1796485985	NOSUKSBMYYSYMH-PKCZLINISA-N	437.743	1.314	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1noc(C)c1C)C2	1796890975	RMPXUAINORUQTM-VFMVUTOHSA-N	426.477	1.677	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1c(F)ccc(O)c1F	1799727657	ABBCYBPLPMVYOI-NVIQENEESA-N	437.212	1.564	50	20	IDGD	
CCCC(=O)N[C@@H](C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](Br)CC	1800641863	KWMZTRIHRQQVPR-HAFSJTIUSA-N	432.359	1.054	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/c1cc(C)on1)C2	1800642125	YDQBOOPSSQHUAM-XZERZOKQSA-N	426.311	1.759	50	20	IDGD	
COc1cc(F)ccc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2	1801646056	IVQLNKSLKJLWMV-DPIQGUFMSA-N	429.286	1.823	50	20	IDGD	
Cc1cc(C(=O)NCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](C)Br)no1	1801963963	VCSVRAQALHLXPH-RVMXOQNASA-N	427.299	1.134	50	20	IDGD	
CC(C)(CCl)C(=O)NC[C@@H]1CCN(C(=O)C[C@@](C)(O)CC(=O)O)[C@H]1c1cccnc1	1802901257	APUDBLXXDAQNCR-UQASEVPWSA-N	439.940	1.968	50	20	IDGD	
CC(=O)N[C@H](Cc1cccc(F)c1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](O)CCl)C2	1804215513	BLUCESWOCNKXPB-ZRSRNVLSSA-N	439.915	1.111	50	20	IDGD	
O=C1CC[C@H](C(=O)NC[C@@H]2CCN(C(=O)[C@@H](F)Br)[C@@H]2c2cccnc2)N1	1806815179	OYMTZNFPSNQDBB-CTHBEMJXSA-N	427.274	1.057	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CCc2ccoc2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807363856	BVFCWGYICCPUDV-REWPJTCUSA-N	447.300	1.307	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1807366913	VXEJFXIYJTXDHB-IEBWSBKVSA-N	443.740	1.346	50	20	IDGD	
Cc1cscc1C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1807373851	CSQAYVJYEMFZCI-NQIIRXRSSA-N	449.341	1.765	50	20	IDGD	
COc1ccc(CC(=O)N2CCCC3(CCN(C(=O)CCC(=O)NN(C)C)CC3)C2)cc1	1809273710	FNYUVXMLAHJNGH-UHFFFAOYSA-N	444.576	1.842	50	20	IDGD	
CN1CCN(CC(=O)NC[C@@H]2CCN(C(=O)C(C)(C)CCl)[C@@H]2c2cccnc2)CC1	1809599295	MZZUHQGNTCMRNU-AZUAARDMSA-N	436.000	1.600	50	20	IDGD	
CCc1ccnc(C(=O)N2CCCC3(CCN(C(=O)CCC(=O)NN(C)C)CC3)C2)c1	1810397145	FIFSQYYDHBXBKO-UHFFFAOYSA-N	429.565	1.862	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H](CNC(=O)c2ccnnc2O)[C@H]1c1cccnc1	1811228294	CPHJYFSNMTVRJT-CRAIPNDOSA-N	429.553	1.748	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)Cc2ccncc2)[C@@H]1c1cccnc1	1813073297	OGOIQWXEXJPMQO-WMZHIEFXSA-N	438.532	1.098	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)CCn2cncn2)[C@H]1c1cccnc1	1813321003	HXBBMKCLONRQNN-YSVLISHTSA-N	435.326	1.553	50	20	IDGD	
C=CCC(F)(F)C(=O)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1	1815360734	YBRFBLRQEYZNRW-ZDUSSCGKSA-N	435.261	1.260	50	20	IDGD	
Cc1ncsc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1816492090	SPINKMBXFSFMGJ-INIZCTEOSA-N	439.306	1.474	50	20	IDGD	
CCC1(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cccc(B(O)O)c2)CC3)CCC1	1818860844	FPVLZIMYYRVTBH-HNNXBMFYSA-N	427.335	1.629	50	20	IDGD	
N#Cc1c[nH]c(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cnccc3C(=O)NN)n[nH]2)c1	1819403336	FNZBEJNXVRSOID-KRWDZBQOSA-N	447.459	1.228	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H]1C[C@H]1C1CC1)CC2	1819789937	AIPIRXHPYSBSDA-XBFCOCLRSA-N	440.529	1.414	50	20	IDGD	
C=CC(=O)N[C@@H](C)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCBr)CC2	1820141345	UADCVPQZCCHOSK-VHSXEESVSA-N	429.340	1.531	50	20	IDGD	
Cc1ccc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cccc(B(O)O)c2)CC3)cc1	1822265751	TXLXWMHQTXHDBY-KRWDZBQOSA-N	435.314	1.671	50	20	IDGD	
O=C(N[C@H]1CCc2nc(NC(=O)[C@H]3CC=CCC3)sc2C1)c1cccc(B(O)O)c1	1822787372	ZXLAZNZICIZVBM-BBRMVZONSA-N	425.319	1.405	50	20	IDGD	
O=C(CN1C(=O)CSC1=S)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](F)Cl)[nH]n1	1823497138	ADMIIFRNHSTIJL-ZANVPECISA-N	433.918	1.797	50	20	IDGD	
O=C1CCc2ccc(C(=O)N3CCC([C@@H]4CCCCN4C(=O)[C@@H](O)CCl)CC3)nc2N1	1824182533	FLIXSBBCWIGBIH-ROUUACIJSA-N	448.951	1.799	50	20	IDGD	
CC(C)=NO[C@H](C)C(=O)N[C@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1	1826088355	DYUBLASGUMAZKB-OLZOCXBDSA-N	438.554	1.229	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H]1CCCSC1)CC2	1826092034	JDXYEAZZBMISEU-CHWSQXEVSA-N	439.607	1.571	50	20	IDGD	
O=C(c1cccc(O)n1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827051252	QPFDGYCLOCSFKC-FQEVSTJZSA-N	437.305	1.014	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC([C@@H]2CCCCN2C(=O)C2=NNC(=O)C2)CC1	1828863084	HLCNIUUZKQJLNV-ZFWWWQNUSA-N	427.343	1.656	50	20	IDGD	
N#Cc1c[nH]c(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)c1	1829776377	RTMWLJHLDVOLSJ-OAQYLSRUSA-N	434.305	1.113	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccn4cncc4c3)C2)C1	1830362352	RQIARWPOYIOZFF-NRFANRHFSA-N	434.924	1.669	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cn3cnc4ccccc43)C2)C1	1830369904	FGNYXQPUTBYJLA-JOCHJYFZSA-N	448.951	1.758	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)COc3cccnc3)C2)C1	1831640582	NSPMTRNUYLLGRG-YLJYHZDGSA-N	425.913	1.324	50	20	IDGD	
O=C(Cc1cc([N+](=O)[O-])ccc1F)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1832430252	ZRHNIORVBRLXHJ-FUHWJXTLSA-N	447.822	1.267	50	20	IDGD	
CCN(C)[C@@H](C)C(=O)N1CCC(N2CCC(NC(=O)[C@H](C)CBr)CC2)CC1	1833265006	UXSCYMBBKGSYLP-CVEARBPZSA-N	445.446	1.929	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@@](C)(O)C(F)(F)F)CC2)CC1	1833641801	PCVNQCHRZHGXKO-WMLDXEAASA-N	443.894	1.125	50	20	IDGD	
Cc1ccccc1OCC(=O)NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1834533750	YNBZWZCLLHFELC-LJQANCHMSA-N	437.968	1.545	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](O)c3ccccc3)CCO2)C1	1835299168	BMNVOAKSRGCUHN-UXPWSPDFSA-N	445.343	1.413	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cc4cccn4cn3)CC2)CC1	1835423890	PWDATWNARYLVKE-LJQANCHMSA-N	447.967	1.773	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CNC(C)(C)C)CCO2)C1	1835619592	FBWVTASLCINLAM-KSSFIOAISA-N	434.375	1.004	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)Nc1cccnc1)CCO2	1835684057	CDTMDMDXPDTGPJ-MMOPVJDHSA-N	438.956	1.746	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3ccc(C)nc3O)CC2)CC1	1836151584	MSJJPOJTAGMBMA-SFHVURJKSA-N	438.956	1.535	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccnc(OC)c3F)CCO2)C1	1836233944	GUXVPYBPNHTACT-FOIQADDNSA-N	443.903	1.707	50	20	IDGD	
CCOC(=O)O[C@@H](C)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836719488	UEXCIXXTXOBAAE-BBRMVZONSA-N	434.917	1.146	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc4sccc4[nH]3)CCO2)C1	1837132577	FSINEEMHEMRNDO-BFUOFWGJSA-N	441.937	1.553	50	20	IDGD	
C=C[C@H](O)C(C)(C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](Br)CC)C2)C1	1837403392	SIFBBNPXLGWOKL-DOXZYTNZSA-N	447.370	1.189	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(C(F)F)no3)C2)C1	1837711992	YOPBTQCDJRDDGO-GOSISDBHSA-N	447.511	1.534	50	20	IDGD	
CN(C)c1ccc(C(=O)N2CCOC[C@@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)cc1	1837714453	HCWULJPDIMPXEE-JOCHJYFZSA-N	449.624	1.674	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3ccc4ncnn4c3)CC2)CC1	1838351720	LUFSMGDSZYAUQI-SFHVURJKSA-N	449.939	1.595	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@]3(C)CC3(F)F)C2)C1	1839156385	NYZQHZNDEYPNOZ-OWCLPIDISA-N	429.291	1.724	50	20	IDGD	
CCc1noc(C)c1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839200895	RSYISEHBFIUHPU-RHSMWYFYSA-N	448.289	1.306	50	20	IDGD	
O=C([C@H]1[C@H]2SC=C[C@H]21)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839202354	CGSABOQOMMNEHW-AWYNBESOSA-N	435.315	1.008	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)/C=C/C3CCCC3)C2)C1	1840034346	INJDLYRLXKDASL-YFKVXENWSA-N	429.355	1.973	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3ccoc3)C2)C1	1840036889	RWEGHSVMJPTIEF-KBXCAEBGSA-N	429.311	1.452	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(F)c(OC)c3)C2)C1	1840155773	DFRCOQLIPIQETP-YWZLYKJASA-N	444.887	1.158	50	20	IDGD	
O=C(Cc1cc(F)cc(F)c1)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840188186	UIAOATRDNJDHCD-SFHVURJKSA-N	437.270	1.767	50	20	IDGD	
Cc1cc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)CBr)C3)C2)no1	1840366399	JVJHBPQOFJAXRG-ACJLOTCBSA-N	444.326	1.013	50	20	IDGD	
C[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1)c1ccccn1	1840503004	KSYJABHWWYYSDG-LAUBAEHRSA-N	435.597	1.493	50	20	IDGD	
O=C(Cc1cc(F)ccc1[N+](=O)[O-])N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1840887228	BJKHEFUJHJRXTG-FUHWJXTLSA-N	447.822	1.267	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H](C(=O)N2CCCC23CN(C(=O)[C@@H](O)CCl)C3)C[C@@H]2C[C@@H]21	1841359789	VTWFTRZPIVGCKY-AJNGGQMLSA-N	427.929	1.187	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@](C)(O)C[C@H]1C(=O)N1CC2(CCCN2C(=O)[C@H](F)Cl)C1	1843366893	WPLNMZNPXUWHFL-LXIYXOSZSA-N	433.908	1.485	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)C1	1845039112	FSQRQWIWICRZAN-QGZVFWFLSA-N	435.956	1.553	50	20	IDGD	
O=C(c1cccc(N2CCOCC2)n1)N1CC2(CCCN2C(=O)[C@@H](F)Br)C1	1845217770	ULIWKEPRNKBGOC-OAHLLOKOSA-N	441.301	1.426	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)c1cnc(Cl)c(Cl)c1)C2	1846385303	OCKLGILKOSBWFX-UHFFFAOYSA-N	428.320	1.578	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CN(C)NC(=O)NCc1ccccc1	1847868786	HQCZQDCNFGRLRJ-FHWLQOOXSA-N	449.983	1.942	50	20	IDGD	
CCn1c(NNC(=O)c2cccc(S(=O)(=O)NC3CC3)c2)nc2ccccc2c1=O	11159143	ULAHXGMAVBEHJX-UHFFFAOYSA-N	427.486	1.614	50	20	IDGD	
CCCn1nc(C(=O)NNS(=O)(=O)c2cc(OC)ccc2OC)c2ccccc2c1=O	16095582	JAWGHMQVNYIBSF-UHFFFAOYSA-N	446.485	1.447	50	20	IDGD	
CON(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)cc1	19203589	ZMDKQRLQNHXVSI-OAHLLOKOSA-N	435.502	1.714	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccc(C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)o1	46670035	DHXAKGYYVBNUCH-UHFFFAOYSA-N	447.473	1.323	50	20	IDGD	
CCN(CC)C(=O)c1ccc(CNC(=O)NNC(=O)CNC(=O)c2cccs2)cc1	725874184	WKSWYKWGUVJEPG-UHFFFAOYSA-N	431.518	1.491	50	20	IDGD	
O=C(NNC(=S)NCCc1ccc2c(c1)OCCO2)c1csc(N2CCOCC2)n1	726745569	SUBHYBJNGGSZMA-UHFFFAOYSA-N	449.558	1.103	50	20	IDGD	
Cc1ccccc1NC(=O)NNC(=O)Cn1cnc2c(c(Br)nn2C)c1=O	727175702	FJODOHIHRCJXKE-UHFFFAOYSA-N	434.254	1.054	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)Cc2ccc(C(=O)NNC(=O)c3ccn(C)n3)cc2)cc1	727363744	AXVUFDJFASJKDD-UHFFFAOYSA-N	441.513	1.624	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNS(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2	728259822	KICLTBXMVJCNJD-UHFFFAOYSA-N	443.821	1.651	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)F)cc1)c1c[nH]n2c1nc(=O)c1ccccc12	728972866	UPUDJVXECWIMRU-UHFFFAOYSA-N	433.396	1.929	50	20	IDGD	
COc1cccc(/C=C(/C#N)C(=O)O[C@H](C)C(=O)Nc2cccc(S(N)(=O)=O)c2)c1	729272098	RHYNJQGQAROXTM-MLJKTZRHSA-N	429.454	1.820	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)[C@@H]1C[C@@H](O)CN1C(=O)OCc1ccccc1	729526125	TXTLKIGKDFJBEI-MSOLQXFVSA-N	427.457	1.157	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2ccc(OCC(=O)O)c(Cl)c2)c(OC)c1	729963465	FRHVCDJELNMGRG-UHFFFAOYSA-N	444.849	1.444	50	20	IDGD	
CCN1CCN(c2ccc(CNC(=O)NNc3ccc(-n4cccn4)nn3)cc2F)CC1	730132947	JIOQGGYKYYDFAZ-UHFFFAOYSA-N	439.499	1.770	50	20	IDGD	
Cc1ccc(-c2nnn(CC(=O)OCC(=O)NNC(=O)c3cccc(Cl)c3)n2)cc1	730471097	QUFFJOLSVVSFCB-UHFFFAOYSA-N	428.836	1.306	50	20	IDGD	
COc1cc2c(cc1OC)CN(C(=O)CCCNC(=O)NNc1ccc(C)nn1)CC2	731045883	JKMDBVPDZHMOPZ-UHFFFAOYSA-N	428.493	1.793	50	20	IDGD	
CC(C)(CNC(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccccc1)NS(C)(=O)=O	731651319	DFAHYDCNWNQPSB-ATVHPVEESA-N	440.529	1.815	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)NNC(=O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])o1	731874183	CXKXSKATTMMOLK-OAHLLOKOSA-N	425.401	1.664	50	20	IDGD	
CCCS(=O)(=O)Nc1cccc(C(=O)NNC(=O)CCN2C[C@H](C)O[C@H](C)C2)c1	732260710	GQJNXIXGBIOTHH-GASCZTMLSA-N	426.539	1.099	50	20	IDGD	
CNS(=O)(=O)[C@@H]1CCCN(C(=O)CCC(=O)C(C#N)=C2N(C)c3ccccc3N2C)C1	733275572	HWLGFQZRFIPVKH-OAHLLOKOSA-N	445.545	1.197	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)CCC(=O)N1CCC(c2ccccc2)=N1	734241056	AVMSGVIFQCOLNB-UHFFFAOYSA-N	446.508	1.258	50	20	IDGD	
Cc1cccc2c(=O)n(CC(=O)NNc3ccccc3S(=O)(=O)NC(C)(C)C)cnc12	734252373	QBNRQVWFYPSQKI-UHFFFAOYSA-N	443.529	1.925	50	20	IDGD	
O=C(NNc1ccc(F)cc1Br)N[C@@H]1CCN(CCN2CCOCC2)C1	734685512	GANPZXREMQCSML-CQSZACIVSA-N	430.322	1.621	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)[C@H](Cc2ccccc2)n2nnnc2C)cc1	735630508	ILXWNUZJTFKPNZ-YWZLYKJASA-N	438.488	1.779	50	20	IDGD	
O=C(NCCc1cccs1)NNC(=O)[C@H]1CCCN(C(=O)COc2ccccc2)C1	741212562	QVZBPVPMRCYAHU-INIZCTEOSA-N	430.530	1.939	50	20	IDGD	
CCOC(=O)c1ccc(NC(=S)NNC(=O)Nc2ccc(S(N)(=O)=O)cc2)cc1	741869566	AUWBRABJLXCDPW-UHFFFAOYSA-N	437.503	1.534	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cccc(CN3CCN(C)CC3)c2)cc(OC)c1OC	742241529	LPVBDMPVNMTVOQ-UHFFFAOYSA-N	442.516	1.535	50	20	IDGD	
C=CCNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cccc(Br)c2)cc1	742768732	FVNIANRKYJCHND-UHFFFAOYSA-N	438.303	1.988	50	20	IDGD	
CC(=O)N1CCCc2ccc(S(=O)(=O)NNC(=O)c3cc([N+](=O)[O-])ccc3O)cc21	743268346	MVVWKVZQXDTNAJ-UHFFFAOYSA-N	434.430	1.223	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)C2CCN(S(C)(=O)=O)CC2)cc1Cl	743837021	XXPACTUAUKHXRM-UHFFFAOYSA-N	434.902	1.182	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN(C)[C@H](C)c2cccc(S(N)(=O)=O)c2)cc1C	744396316	GZFRPPCNELTRAD-CYBMUJFWSA-N	438.575	1.720	50	20	IDGD	
C[C@H]1C[C@@H](NC(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)CCN1C	745855282	USZNYKTWHZFDBO-WMZOPIPTSA-N	448.527	1.872	50	20	IDGD	
NC(=O)CC[C@H](C(=O)NNc1ccc(Cl)cc1[N+](=O)[O-])N1C(=O)c2ccccc2C1=O	746129549	JQCPDEKTVGQUAU-CQSZACIVSA-N	445.819	1.622	50	20	IDGD	
CN(C)C(=O)CS(=O)(=O)c1ccc(C(=O)NNC(=O)c2ccc(Cl)cc2F)cc1	747329081	BIULYRWOEMGGFO-UHFFFAOYSA-N	441.868	1.416	50	20	IDGD	
C[C@@H](c1ccccc1)[C@@](C)(O)C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	748620573	RCUHUJHFQKJFGW-HTAPYJJXSA-N	446.573	1.621	50	20	IDGD	
Cc1ccsc1[C@@H]1C[C@H]1C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	749239808	FKNPMCHDANKMLW-HUUCEWRRSA-N	435.575	1.634	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNS(=O)(=O)c1ccc(Cl)cc1C(F)(F)F	751283611	YKKMLXPTTNGYEC-UHFFFAOYSA-N	425.772	1.691	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)COc1ccc(OCc2ccccc2)cc1)S(C)(=O)=O	754672537	BUBRTOVUCXCXTR-HNNXBMFYSA-N	435.502	1.408	50	20	IDGD	
CCCn1nc(C(=O)NN=Cc2cnc(N3CCN(C)CC3)nc2)c2ccccc2c1=O	755547556	YVGCYPDPAZGTPH-UHFFFAOYSA-N	434.504	1.112	50	20	IDGD	
Cc1cccc(C(=O)N2CCCC2)c1NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	755646528	LENJZHDMAVASEZ-UHFFFAOYSA-N	434.460	1.673	50	20	IDGD	
Cc1cccc(-n2nc(C(C)(C)C)cc2NC(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)c1	755748107	PSNDRNFTNCGARV-CYBMUJFWSA-N	436.538	1.569	50	20	IDGD	
CN(C(=O)c1ccccc1NC(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1)C1CCCCC1	756117497	BWEIXPYDXFUUDK-CQSZACIVSA-N	436.534	1.679	50	20	IDGD	
COC(=O)N(C)c1ccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1	756207422	OVRBZSMNWPYEJY-UHFFFAOYSA-N	449.489	1.606	50	20	IDGD	
COC(=O)CN1CCN(c2ccc(NC(=O)NNC(=O)c3ccccc3OC)cc2)CC1	756393911	TWFLCKZPNBMDPX-UHFFFAOYSA-N	441.488	1.457	50	20	IDGD	
CS(=O)(=O)Nc1ccc(NC(=O)NNC(=O)c2cc(Br)ccc2O)cc1	756706425	MYLZKRTUWLZYOW-UHFFFAOYSA-N	443.279	1.993	50	20	IDGD	
CCOC(=O)[C@@H](C)NC(=O)c1ccc(NC(=O)NNC(=O)COc2cccc(C)c2)cc1	756792149	ZHFLNULZFDHPHT-OAHLLOKOSA-N	442.472	1.908	50	20	IDGD	
CCCc1c(NC(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)cnn1-c1cccc(F)c1	758015433	ZUEYYAZISDPBFF-LLVKDONJSA-N	426.474	1.054	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN(C)Cc2cc(Br)cn2C)cc1OC	758824613	AZJHFTBAGNLUTQ-UHFFFAOYSA-N	439.310	1.698	50	20	IDGD	
CC(=O)N1CCN(c2ccc(C(=O)NNc3ncccc3[N+](=O)[O-])cc2[N+](=O)[O-])CC1	759285495	IQRRNCFZQWSXLC-UHFFFAOYSA-N	429.393	1.323	50	20	IDGD	
NC(=O)c1cc(C(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)co1	759376269	URTXFZZPDXDALX-UHFFFAOYSA-N	431.408	1.212	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H](C)C[C@H]2CCOC2)c1	760193329	KCLFNVVHUWYCSY-LSDHHAIUSA-N	426.539	1.476	50	20	IDGD	
COc1ccccc1C(=O)NNS(=O)(=O)c1ccc(Br)c([N+](=O)[O-])c1	760355183	ITFZLRQCVXAILK-UHFFFAOYSA-N	430.236	1.989	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@H](CCC(N)=O)C(=O)NNc2c(F)cccc2F)cc1C	760462758	HSABIEYUOIVCBE-MRXNPFEDSA-N	440.472	1.637	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)cc1OC	762905081	CTARZUYYFHBZPU-UHFFFAOYSA-N	442.384	1.711	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)/C(C#N)=C/c2cc(C#N)n(C)c2C)n[nH]1	763150953	CSIJSNZSKFTEBH-OVCLIPMQSA-N	429.440	1.972	50	20	IDGD	
Cc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NNC(=O)c1cc2ccccc2cc1O	763528668	XBTVJFGAVUHIKS-UHFFFAOYSA-N	434.452	1.955	50	20	IDGD	
CCOC(=O)c1cc(C)sc1NC(=O)C(=O)NNC(=O)[C@@H]1COc2ccccc2O1	763573589	TWGYDGAVMNEQAK-AWEZNQCLSA-N	433.442	1.159	50	20	IDGD	
COC(=O)c1c(F)cccc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccccc2)[nH]n1	763603976	GAZCTXZCMRDALQ-UHFFFAOYSA-N	425.376	1.402	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2cc(N3CCCC3=O)ccc2F)c1	763624314	VTXZFYBXJHDJAY-UHFFFAOYSA-N	428.420	1.426	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(C)nc2Br)cc1	763658865	FWTAJMYCKUAGTN-UHFFFAOYSA-N	437.250	1.326	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(N3CCCNC3=O)c2)cc1C	763666499	GTFJYPXYBBPAID-UHFFFAOYSA-N	439.472	1.388	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)C(=O)Nc1cccc2c1CN(c1ccccn1)C2	763683352	ZKSBZHCQWITWRR-UHFFFAOYSA-N	449.442	1.906	50	20	IDGD	
CN1CCN(C(=O)c2ccccc2NC(=O)C(=O)NNC(=O)c2cccc(Cl)c2)CC1	763752792	QYFWIYQGLRMITK-UHFFFAOYSA-N	443.891	1.127	50	20	IDGD	
CCc1nnc(-c2ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc3ccc(F)cc3)cc2)o1	763873653	XBHANBQDCOTGTM-LBPRGKRZSA-N	441.419	1.992	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccc(-n3nc(C)cc3C)c(F)c2)n1	763890577	BZLBZJSLGXHXMY-UHFFFAOYSA-N	427.440	1.228	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)C2=C(C)N(C)c3ncnn3[C@H]2C)c2ccccc2c1=O	763928858	RZIFBEXVPURDBL-ZDUSSCGKSA-N	436.476	1.144	50	20	IDGD	
Cc1nccn1-c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Br)s2)cn1	763942426	ZNSOYRLNFMPIET-UHFFFAOYSA-N	449.290	1.799	50	20	IDGD	
C#CCOc1ccc(F)cc1NC(=O)C(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	763943348	GDJSHHXTEXBQPB-UHFFFAOYSA-N	437.387	1.129	50	20	IDGD	
Cc1cc(C)n(-c2ccc(NC(=O)C(=O)NNC(=O)c3cc(-c4ccccc4)on3)cn2)n1	764004414	VMAMTRQRUAYTFF-UHFFFAOYSA-N	445.439	1.939	50	20	IDGD	
CCc1nc2cc(NC(=O)C(=O)NNC(=O)c3cc(Br)cn3C)ccc2o1	764004835	OLOBQPNTWJOVSD-UHFFFAOYSA-N	434.250	1.891	50	20	IDGD	
COc1ccc(OC(F)F)c(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)c1	764005340	WTXHEWIDRJCQEM-UHFFFAOYSA-N	437.355	1.468	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccsc2)cc1Cl	764024227	CDIYTOSLCNOXHX-UHFFFAOYSA-N	425.850	1.282	50	20	IDGD	
O=C(NNC(=O)c1cccc(C(F)(F)F)c1)C(=O)Nc1cnn(C[C@@H]2CCCO2)c1	764041188	WKYXVKDDTPDUQR-AWEZNQCLSA-N	425.367	1.481	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)nc1)C(=O)Nc1ccc(-c2nnc3n2CCCC3)cc1	764100957	MWGHYCWXQHGYMU-UHFFFAOYSA-N	439.863	1.730	50	20	IDGD	
CCS(=O)(=O)c1cccc(CC(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)c1	764110270	HGCLFPJMRBTERU-UHFFFAOYSA-N	432.506	1.766	50	20	IDGD	
COC(=O)c1ccc(C)c(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(C)cc3)[nH]n2)c1	764110477	KHEGQFDSKWNTQO-UHFFFAOYSA-N	435.440	1.880	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(C)cc3)[nH]n2)cc1	764111750	PWYNXHPJBCTCGQ-UHFFFAOYSA-N	437.456	1.810	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(Cn3cccn3)c2)o1	764139611	XXYZDBRPYQDIRO-UHFFFAOYSA-N	438.488	1.766	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3ccc(C#N)cc3)cc2F)C[C@H](C)O1	764177324	OOUYIFWVGMCLDW-KBPBESRZSA-N	439.447	1.711	50	20	IDGD	
O=C(CC1CCCC1)NNC(=O)C(=O)Nc1cc(Br)cnc1-n1cccn1	764184021	LXDNRRCVEZGTAR-UHFFFAOYSA-N	435.282	1.696	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)C(=O)Nc1ccc(-c2n[nH]c(-c3ccccc3)n2)cc1	764297005	LTKSELOSKKVPLP-UHFFFAOYSA-N	430.428	1.570	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)C(=O)Nc1ccc(CNS(C)(=O)=O)cc1)c1ccccc1	764327971	IECXORQXECLXIW-QGZVFWFLSA-N	432.502	1.016	50	20	IDGD	
C[C@H]1Cc2ccccc2N1Cc1ccoc1C(=O)NNC(=O)CNC(=O)c1cccnc1	764343323	OPIKZUOEEWHQPD-HNNXBMFYSA-N	433.468	1.817	50	20	IDGD	
C[C@H](c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)cc1)N1CCOCC1	764349764	VFLJQHAKWOHCLE-CYBMUJFWSA-N	446.891	1.839	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2cccs2)[nH]n1)C(=O)Nc1cccc(N2CCCC2=O)c1	764382591	MCUQIXUVOLEHSB-UHFFFAOYSA-N	438.469	1.665	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3ccnc(-n4cccn4)c3)n[nH]2)cc1OC	765597791	XJFNWJRAIXGOPE-UHFFFAOYSA-N	433.428	1.749	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)ccc1[N+](=O)[O-]	765755328	PAYKPNILJBYRCT-UHFFFAOYSA-N	441.488	1.491	50	20	IDGD	
C[C@H](C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1)n1cnc2ccccc21	766641613	ICUCYOFRUHUIIC-QGZVFWFLSA-N	434.500	1.203	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)[C@@H](c1ccccc1)n1cccn1	766647868	WYGKAYRZLSIDPG-JOCHJYFZSA-N	446.511	1.078	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)CN1CCCCCCC1=O	766664475	QZUAEJHKTBBXIL-UHFFFAOYSA-N	449.983	1.398	50	20	IDGD	
COCc1c(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)cnn1-c1ccccc1	767294494	CLZPEJNXDWOWNX-UHFFFAOYSA-N	442.501	1.387	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)CN1C(=O)COc2ccc(Cl)cc21	768644497	CSSJJWWIPYKRJK-UHFFFAOYSA-N	439.877	1.621	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)c2cccc([C@]3(C)NC(=O)NC3=O)c2)cc1OC	768928984	ACBXOVQJOYOEIL-QFIPXVFZSA-N	440.456	1.613	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)c1cc(S(=O)(=O)Nc2ccccc2Cl)ccc1O	769783489	XPFJRHFLMMDWRT-UHFFFAOYSA-N	449.876	1.953	50	20	IDGD	
C[C@H](NC(=O)NNc1nc(O)c2cnn(C)c2n1)c1ccc(OCC(=O)NC2CC2)cc1	770340021	HBWBYGRJZLNRBF-NSHDSACASA-N	440.464	1.114	50	20	IDGD	
C[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)CCN1C(=O)NNC(=O)CNC(=O)c1cccs1	771977451	KIFSNAITRIJKMU-OLZOCXBDSA-N	439.538	1.596	50	20	IDGD	
COc1ccc(C(=O)O)cc1S(=O)(=O)NNC(=O)[C@@H](C)Oc1cccc(Cl)c1	773251060	HYPBLRBTWYIROR-SNVBAGLBSA-N	428.850	1.824	50	20	IDGD	
COc1cc(SC)ccc1NC(=O)C(=O)NNC(=O)c1cc(OC)c(OC)c(OC)c1	773512729	SLJNWESEZVMBRL-UHFFFAOYSA-N	449.485	1.843	50	20	IDGD	
CCN1CCN(Cc2ccc(NC(=O)C(=O)NNc3ccccc3[N+](=O)[O-])cc2)CC1	773650195	FDRSDLXTBDMQPY-UHFFFAOYSA-N	426.477	1.814	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2ccc(C(=O)N3CCCC[C@H]3C)cc2C)n1	773725977	DFPAGVRCGAEUJF-CQSZACIVSA-N	426.477	1.890	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)N2C[C@@H](CC(=O)N(C)C)c3cc(Cl)ccc32)n1	773726559	NAIPJAUKDJQIBC-LLVKDONJSA-N	432.868	1.190	50	20	IDGD	
C=CCOc1cccnc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N(CC)CC)c1	775134948	AFOXLSZHXKBIJF-UHFFFAOYSA-N	432.502	1.752	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)NCC(=O)NNc2ccc(C(F)(F)F)cn2)cc1	775243903	YFTJMAKKWJORDL-UHFFFAOYSA-N	446.407	1.699	50	20	IDGD	
COc1ccnc(NNC(=O)Nc2ccc(N3CCOCC3)cc2N2CCOCC2)n1	775452817	NXQCXWWEFDOKHH-UHFFFAOYSA-N	429.481	1.307	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)c2cnc(O)c([N+](=O)[O-])c2)c2ccccc2c1=O	776323733	QNOHSJYXVSIDJE-UHFFFAOYSA-N	440.416	1.670	50	20	IDGD	
O=C(CN1CCNC(=O)[C@@H]1c1ccccc1Br)NNC(=O)c1ccccc1	777716285	HLDHVYLWZLBCMK-KRWDZBQOSA-N	431.290	1.383	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCC(=NNC(=O)CNC(=O)OC(C)(C)C)CC2)cc1	777903665	CUXLVLXAGHOZQP-UHFFFAOYSA-N	440.522	1.477	50	20	IDGD	
CCOC(=O)c1sc2[nH]c(CSCCC(=O)NN(C)C(N)=O)nc(=O)c2c1C	778412964	YHLKRMWSAVCDDD-UHFFFAOYSA-N	427.508	1.135	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(/C#N)C(=O)NS(=O)(=O)c2c(C)nn(C)c2OC)c1C	778852617	OLUHRSBVMFQZLE-OLWAXZHHSA-N	449.533	1.775	50	20	IDGD	
CCOc1cc(Cl)ccc1C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	778903507	WRHIDRAVHRDSCU-UHFFFAOYSA-N	444.919	1.958	50	20	IDGD	
C[C@H](C(=O)N(C)CC(=O)NNc1ccc([N+](=O)[O-])cc1Br)n1cccn1	779146292	VBMAZRWBTNSTRI-SNVBAGLBSA-N	425.243	1.717	50	20	IDGD	
CC(C)(C)c1ccc(Cn2nccc2NC(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)cc1	779461206	FZECFWQHKOIVAC-HNNXBMFYSA-N	433.534	1.816	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)[C@H](O)[C@@H](O)c1nc2ccccc2s1	779539217	BZKGTAJSVCXWKY-HUUCEWRRSA-N	438.506	1.143	50	20	IDGD	
CCn1cc(CC(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)cn1	780299607	RZXMKWSTWXUWPG-UHFFFAOYSA-N	430.472	1.609	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)NCc2ccccc2CN2CC[C@@H](O)C2)nc2ccccc21	781952990	IHNBYRZYWIOXME-GOSISDBHSA-N	436.516	1.213	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)nc1Br	782025450	FSGHPLYNCUCQLT-UHFFFAOYSA-N	431.287	1.919	50	20	IDGD	
COCCCOc1ccccc1NC(=O)C(=O)NNC(=O)Cc1nc2ccccc2n1C	782884528	BIOWLALPLYVHON-UHFFFAOYSA-N	439.472	1.317	50	20	IDGD	
CSCc1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)cc1	783262125	BHPDYDWILMXVDL-UHFFFAOYSA-N	437.547	1.713	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCCCC2)cc1NC(=O)C(=O)NN(C)c1ccccc1	783434284	HGBIYBUSHWWTAJ-UHFFFAOYSA-N	446.529	1.976	50	20	IDGD	
CC(=NNC(=O)CNC(=O)c1cccnc1)[C@@H]1CN(C(=O)OCc2ccccc2)CCO1	783854140	MMOMVBMZVDIOBS-IBGZPJMESA-N	439.472	1.341	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)C(=O)Nc1ccc(OC2CCCC2)c(Cl)c1	784003449	XCNKETWPPVQTCI-UHFFFAOYSA-N	448.863	1.770	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)F)cc1)C(=O)Nc1cccnc1-n1cccn1	784834903	BLUVADPKCUDKOU-UHFFFAOYSA-N	436.400	1.345	50	20	IDGD	
CCN(CC)CCNC(=O)c1cccc(NC(=O)C(=O)NNc2cccnc2Cl)c1	784839065	IWSIEXATAGSASI-UHFFFAOYSA-N	432.912	1.888	50	20	IDGD	
CC(C)n1ncc2ccc(NC(=O)C(=O)NNC(=O)c3cc([N+](=O)[O-])ccc3O)cc21	785023465	JJDYOGLUUYXRPQ-UHFFFAOYSA-N	426.389	1.631	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccn(CC(F)(F)F)n3)n[nH]2)c1	785125827	HVMAZPOQSHYBBO-UHFFFAOYSA-N	449.393	1.852	50	20	IDGD	
C[C@@H]1[C@H](C(=O)NNC(=O)c2csc(N3CCOCC3)n2)CCN1C(=O)OC(C)(C)C	786258010	XMDLKNNZSHLKFH-CHWSQXEVSA-N	439.538	1.386	50	20	IDGD	
COc1ccc(OC)c([C@@H]2C[C@@H]2C(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)c1	788102112	UTAMFZFOXDQUDV-RDJZCZTQSA-N	431.876	1.925	50	20	IDGD	
O=C(COC(=O)c1ccc(O[C@H]2CCOC2)cc1)NNC(=O)c1ccc([N+](=O)[O-])cc1	789201044	PRSXYWGCMJHZGX-KRWDZBQOSA-N	429.385	1.381	50	20	IDGD	
O=C(NNC(=O)N1CCC[C@H](N2CCCS2(=O)=O)C1)c1cccc(Br)c1	789840961	YZFZQDGJHUISOX-AWEZNQCLSA-N	445.339	1.303	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccc(OC)cc2)c1)[C@@H](C)O	790070489	UMADUDIMLSDJTO-FZKQIMNGSA-N	435.502	1.664	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@H]2CCS(=O)(=O)c3ccccc32)cc(OC)c1OC	790112354	OFFJHGKLMUNMDK-AWEZNQCLSA-N	434.470	1.435	50	20	IDGD	
COCCNC(=O)CN1CCN(C(=O)/C(C#N)=C/c2cc(C)n([C@H](C)COC)c2C)CC1	790445211	PBKVLOPOXNNTIQ-KOMLCTQHSA-N	445.564	1.126	50	20	IDGD	
O=C(NNc1cccc(F)c1[N+](=O)[O-])c1ccc(S(=O)(=O)NC[C@H]2CCCO2)cc1	790585131	BXBOJROJFFPTIJ-CYBMUJFWSA-N	438.437	1.948	50	20	IDGD	
CCN(C(=O)OC(C)(C)C)[C@H](C)CNC(=O)NNC(=O)c1nnc(O)c2ccccc12	792315457	AJZGLXWDAKXVNB-GFCCVEGCSA-N	432.481	1.925	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ncccc2C)cc1S(=O)(=O)N1CCCCC1	792376613	XIIDTYHCEXTLQQ-UHFFFAOYSA-N	447.517	1.655	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)Cn1cc(Br)ccc1=O	795169241	JWAWKMKQDBFKMM-UHFFFAOYSA-N	429.296	1.004	50	20	IDGD	
O=C(NNc1cc(F)c(F)cc1F)C(=O)Nc1cc(S(=O)(=O)N2CCCC2)ccn1	797080478	AATQXWNFHCHPFI-UHFFFAOYSA-N	443.407	1.365	50	20	IDGD	
COc1cc(Cl)ccc1NC(=O)C(=O)NNC(=O)CNC(=O)OCc1ccccc1	797368544	DECUHJQPPMGJNT-UHFFFAOYSA-N	434.836	1.361	50	20	IDGD	
O=C(CCc1ccccc1)NNC(=O)NCCNS(=O)(=O)c1ccc(F)cc1F	799676178	WDSXSRFLCUQUEA-UHFFFAOYSA-N	426.445	1.206	50	20	IDGD	
O=C(NC[C@H](c1ccc(F)cc1)N1CCOCC1)NNc1ccc(-n2ccnc2)nn1	804859289	PWSOHDSHSUNCTF-QGZVFWFLSA-N	426.456	1.501	50	20	IDGD	
CC(C)NS(=O)(=O)c1cccc(CNC(=O)NNc2ccc(-n3ccnc3)nn2)c1	804894577	JTHRPRFBHRWYMN-UHFFFAOYSA-N	430.494	1.175	50	20	IDGD	
CC(C)(C)c1ncc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cn1	806342364	JAQBOEGXQZRKGW-UHFFFAOYSA-N	431.518	1.633	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)Nc1ccc(F)c(N2CCCNC2=O)c1	806807366	YKLIFWIUSRACTF-UHFFFAOYSA-N	446.395	1.885	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cc(C)ns3)n[nH]2)cc1OC	806978586	BFVPZSDASJNQIV-UHFFFAOYSA-N	430.446	1.259	50	20	IDGD	
Cc1cc(C(F)(F)F)ncc1NC(=O)C(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	810384529	LZVQJOPJWODNQX-UHFFFAOYSA-N	448.361	1.700	50	20	IDGD	
O=C(NNC(=O)c1ccncc1)C(=O)Nc1cnn(-c2ccc(F)cc2)c1C(F)(F)F	810385378	PZARFJGHPBOWSK-UHFFFAOYSA-N	436.325	1.825	50	20	IDGD	
C=CCNC(=S)NNC(=O)C1CCN(c2ccc3nnc(C(F)(F)F)n3n2)CC1	810450643	QDKNCZHAUISGSD-UHFFFAOYSA-N	428.444	1.041	50	20	IDGD	
NC(=O)N1CCC(=NNC(=O)c2cc(S(=O)(=O)NCc3ccccc3)ccc2O)CC1	812454400	LGCOTXYJWZTSIU-UHFFFAOYSA-N	445.501	1.131	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2ccc(NNC(=O)[C@@H](O)C(C)C)c([N+](=O)[O-])c2)cc1	813363434	XMEHYKKEXLFCQL-KRWDZBQOSA-N	438.462	1.864	50	20	IDGD	
O=C(C[C@H]1CCCC(=O)N1)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	813366471	MSOPVSOFKWXLBV-MRXNPFEDSA-N	433.468	1.265	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2nnn(Cc3ccccc3F)c2C)n1	815611828	URHNYJWCMSNJHR-UHFFFAOYSA-N	441.471	1.492	50	20	IDGD	
CN(C)CCc1ccc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)N(C)C)cc1	815751841	QQSRRRBAJNWWOA-UHFFFAOYSA-N	433.534	1.123	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(OCC(=O)NNc2ncncc2F)c([N+](=O)[O-])c1	817083066	VFRSGAKBOBPVOB-UHFFFAOYSA-N	442.429	1.077	50	20	IDGD	
CC(=O)N[C@H](CC(=O)NNC(=O)N1CCN(C)CC1)c1ccc(Br)cc1	819721472	UMCDJRSOQHHDBG-OAHLLOKOSA-N	426.315	1.005	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)c1sccc1S(=O)(=O)N1CCCC1	822443695	ZYQDSPCRAZARSO-UHFFFAOYSA-N	427.479	1.512	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)[C@@]23CCC(=O)N2CCS3)cc(OCC)c1OCC	844263682	BSUWDVQGFKXODC-FQEVSTJZSA-N	437.518	1.709	50	20	IDGD	
COc1ccc2c(CC(=O)OCC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)coc2c1	849157405	VVCIVFLZHAZRFZ-UHFFFAOYSA-N	427.369	1.897	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)c2ccc(C(=O)OC)nc2)c2ccccc2c1=O	871398008	BYAYXYYLKAUBPS-UHFFFAOYSA-N	437.456	1.843	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)CN2C(=O)N[C@](C)(c3ccc4ccccc4c3)C2=O)n1	913025923	WPCHOHWUGVWWGW-HSZRJFAPSA-N	448.483	1.268	50	20	IDGD	
Cc1ccc(C(=O)N2CCC[C@@H](C(=O)OCC(=O)NNC(=O)c3cccs3)C2)cc1	914999474	BJKVHTMBYWEHBN-MRXNPFEDSA-N	429.498	1.913	50	20	IDGD	
NS(=O)(=O)c1ccc(C(=O)OCC(=O)NN=C(c2ccccc2)c2ccccc2)o1	915038080	TYMUPWKFMFUWQQ-UHFFFAOYSA-N	427.438	1.653	50	20	IDGD	
CNS(=O)(=O)c1ccc(C(=O)OCC(=O)C(C#N)=C2N(C)c3ccccc3N2C)o1	915421604	ZXJQXAIBLKMGRL-UHFFFAOYSA-N	430.442	1.235	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)CSCC(=O)Nc1cc(C)on1	915775493	DNLVXIRFXVZRPD-UHFFFAOYSA-N	430.490	1.414	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1cccc(Cn2ccnc2)c1	916143172	YMAAMEZLEQBJIV-UHFFFAOYSA-N	426.502	1.608	50	20	IDGD	
C[C@@H]1CC(C)(C)C[C@@]2(C1)NC(=O)N(CC(=O)NNC(=O)c1ccc(Cl)cc1O)C2=O	918358026	UDBKCFSNVUAUKY-BIBXISHDSA-N	436.896	1.943	50	20	IDGD	
O=C(COC(=O)c1nc(NCc2ccco2)ncc1Cl)NNC(=O)c1ccccc1	919116645	GYAPYNJBKSIKAG-UHFFFAOYSA-N	429.820	1.953	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cc(NS(C)(=O)=O)ccc2O)ccc1OC(C)C	919809978	PAGDZTRXFGGZPK-UHFFFAOYSA-N	437.474	1.634	50	20	IDGD	
Cc1ccc(Cn2nc(C)c(C(=O)NNC(=O)N[C@H]3CCS(=O)(=O)C3)c2Cl)cc1	919884415	ITXAYSJNKYMVIS-AWEZNQCLSA-N	439.925	1.333	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2nnc(-c3ccccc3)s2)c1	920931406	OEXVWPHYMJXJRZ-UHFFFAOYSA-N	446.514	1.922	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2nc(C(F)(F)F)cs2)c1	920931649	ZQKBYTKMJFYPGN-UHFFFAOYSA-N	437.425	1.879	50	20	IDGD	
COc1cc(OCC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)ccc1[N+](=O)[O-]	921074790	ZRYQTUKLTWGREZ-UHFFFAOYSA-N	427.373	1.335	50	20	IDGD	
O=C1CCc2cc(S(=O)(=O)NNC(=O)c3cncn3-c3ccccc3)c(F)cc2N1	1115863940	QFJRMHIQHNSMEX-UHFFFAOYSA-N	429.433	1.519	50	20	IDGD	
O=C(CSc1ccccc1[N+](=O)[O-])NNC(=O)Cn1cc(C(F)(F)F)ccc1=O	1118217002	VNTKQKNDSYPZAM-UHFFFAOYSA-N	430.364	1.715	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NN=C[C@H](C#N)C(C)C)N(S(C)(=O)=O)CC2	1319380779	LIMRYOLRQXPCMY-DOTOQJQBSA-N	436.534	1.850	50	20	IDGD	
C[C@@H]1C(=O)Nc2cc(C(=O)NNC(=O)C3CCN(C(=O)OC(C)(C)C)CC3)ccc2N1C	1331185602	TZQOFKQDAPPHSL-CYBMUJFWSA-N	445.520	1.872	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2cc(=NCc3ccccc3)cc[nH]2)c2ccccc2c1=O	1350747181	HNECOKZPXRMSEP-UHFFFAOYSA-N	442.479	1.920	50	20	IDGD	
COC(C)(C)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1	1780095279	OHGSVIWXINZHBA-NRFANRHFSA-N	449.460	1.389	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C=C/C2CCCC2)C1	1780749645	VISUMJQYWFBMST-QNDZLASUSA-N	434.581	1.620	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](NC(C)=O)c3ccc(F)cc3)C2)C1	1780915147	LVVHZYLMBYRFCS-DBXWQHBBSA-N	439.915	1.850	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(Cl)Cl)C2)c1c(O)cc(O)cc1O	1781028714	GTEIZZJMJOAMDG-FZKQIMNGSA-N	433.288	1.735	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(CCN(C(=O)[C@H]3CC[C@H]4CCC(=O)N4C3)C2)C1	1781053126	NMFIGLQTIKOLFQ-YZVOILCLSA-N	442.354	1.002	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(C(N)=O)cc3)CCO2)C1	1781233953	PAORADIRYISRKG-RBUKOAKNSA-N	428.316	1.465	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)C3(Br)CC3)C2)C1	1781347894	NLYFKZHSTWDMQJ-FZMZJTMJSA-N	438.160	1.917	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(C)(C)NCCC#N)C2	1782170698	TYYJFVKLWBORMS-JXXFODFXSA-N	428.961	1.036	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cc4n(n3)CCCC4)CCO2)C1	1783534709	YDXIPHBROLAHBE-FZKQIMNGSA-N	425.327	1.446	50	20	IDGD	
CC(C)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc4c3NC(=O)C4=O)C[C@@H]21	1783851564	DAXCNEKYXACEGP-RCBQFDQVSA-N	447.919	1.680	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cnc(C(F)(F)F)cn3)CCO2)C1	1783874208	ANBQROXGKIFMCK-BDJLRTHQSA-N	436.818	1.193	50	20	IDGD	
Cc1nn(C)c(C)c1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21	1784702556	FTELYXZMGOHVKS-PWNZVWSESA-N	431.306	1.321	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CC(=O)OC(C)(C)C)[C@H]2C1	1784781425	KHIYVDLAQXZHSH-XUXIUFHCSA-N	433.343	1.481	50	20	IDGD	
COc1ccc(F)cc1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1785025124	RVLPWFOGYSFXHJ-YOEHRIQHSA-N	433.249	1.968	50	20	IDGD	
CC(=O)Nc1ccccc1C(=O)N1CC[C@@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1785099850	KJALYQLUIQEEHB-OAQYLSRUSA-N	433.581	1.940	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)N1CC[C@]2(C1)CN(C(=O)CO[Si](C)(C)C)CCO2	1785336602	IDCJMKDMJSZCME-FQEVSTJZSA-N	443.617	1.583	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4ccccc4o3)C[C@@H]21)c1ccc(B(O)O)cc1	1786979669	JHLAUIKGZDNDBK-JLMWRMLUSA-N	448.284	1.020	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)n3cccc3C=O)[C@H]2C1	1786994865	LCOYQUVZBKOHPM-JBJRXJHCSA-N	440.338	1.625	50	20	IDGD	
C[C@H](Nc1cnccn1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CO[Si](C)(C)C)C[C@@H]21	1788628070	SINLBKDQTZRVNZ-QAETUUGQSA-N	435.601	1.108	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccnc(Cl)n3)[C@H]2C1	1788877583	CMWXIEXFGBUCQU-FMSGJZPZSA-N	445.745	1.897	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ncccc3F)[C@H]2C1	1789056923	BLAXEOFIOYNFGK-ABHRYQDASA-N	428.302	1.988	50	20	IDGD	
CC(C)n1nccc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]2C1	1791058621	AAPASPRYKPJMGM-HOSILWTGSA-N	427.343	1.841	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(F)c(F)c3OC)C[C@@H]21	1791256610	CZIOESBXBQCJCL-ZIEJDFEHSA-N	446.878	1.821	50	20	IDGD	
O=C([C@H](F)Br)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1(c2ccccc2)CC1	1792525399	FYIQOXHJAQAZKI-XRGAULLZSA-N	425.298	1.998	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](CCO)NC(=O)OC(C)(C)C	1793250020	NZPJIXJUGOVLFR-XFIYOXNOSA-N	447.960	1.154	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc[nH]1)C2	1793880093	OFTRWMLRXDHTCQ-XRGAULLZSA-N	440.928	1.350	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1c[nH]c2ccc(C)cc12	1793970823	BGLTYENMDHQUDP-HPNQWNLUSA-N	433.936	1.862	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)c1cccc2cccnc12	1796190912	AXZLFBVNFYNKAT-ACDBMABISA-N	429.285	1.480	50	20	IDGD	
C[C@@H](C#N)c1cccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)c1	1796192324	AGQVXGCACIMQPH-RWXMBLCBSA-N	431.301	1.559	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1c[nH]c2nccc-2c1	1796193632	OGFQMKNUACBNRW-KSYCFECVSA-N	435.322	1.749	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc2c1OC(C)(C)C2	1796262592	NAPJPGDDYGMSRN-CYGHRXIMSA-N	436.936	1.857	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cc1ccc(C#N)cc1)C2	1796889844	VAPFDAUKKTZPOA-SXRZSVBQSA-N	446.511	1.873	50	20	IDGD	
CCCC(=O)N[C@@H](C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](Br)CC)C2	1797929621	PLDNXQKUPCEBKW-HAFSJTIUSA-N	432.359	1.054	50	20	IDGD	
CC(C)(C)c1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)[nH]n1	1798811298	PFVZAYCQPPJJNJ-BTTYYORXSA-N	439.520	1.271	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H](C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](F)Cl)C3)[C@@H](O)C1	1799981954	QXKRPJJFZIMDIK-JLZCTACVSA-N	433.908	1.387	50	20	IDGD	
C[C@H](N[C@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)C1CC1)c1ccccc1	1800345249	NHUAUWRNDYDHOH-FHYBNVNPSA-N	449.979	1.305	50	20	IDGD	
Cc1cccc2c(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@H](C)Br)n[nH]c12	1800762115	NZNXOPPDEVFTJB-JFILPPLUSA-N	435.322	1.858	50	20	IDGD	
COC[C@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(OC)c(OC)c1O)C2	1802280216	LJIJEOXRPFIUNJ-XFMPKHEZSA-N	426.897	1.915	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H]1CC(c3ccccc3)=NO1)C2	1802334986	VEITVFMFTXDPDJ-AJYBTWMASA-N	441.532	1.191	50	20	IDGD	
COc1cccc(CC(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)c1	1803138193	HHVIIIFDZCQWBF-QFUCXCTJSA-N	431.920	1.938	50	20	IDGD	
Cc1ccn2ncc(C(=O)N3CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]3c3cccnc3)c2c1	1803139659	SKCDJLIPFBKEGK-NSISKUIASA-N	441.919	1.957	50	20	IDGD	
N#Cc1cc(CC(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)ccc1F	1803141949	WDQXDRKJOJTINF-PBEJRMEISA-N	444.894	1.941	50	20	IDGD	
Cn1nc(C(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)c2c1CCC2	1803143220	XEYQDJJGEFRVAY-BJZITVGISA-N	431.924	1.223	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC2(CCCN(C(=O)CCC(=O)N3CCCC3)C2)CC1	1806653973	LYTLAKIKZUEHNJ-QGZVFWFLSA-N	427.973	1.874	50	20	IDGD	
CC(=O)N[C@H](C)C(=O)NC[C@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1	1812649027	WWQUNTYPRSDINQ-VMGRFDJRSA-N	425.327	1.397	50	20	IDGD	
COC[C@H](NC(C)=O)C(=O)N1CC[C@@H](CNC(=O)C(Cl)Cl)[C@@H]1c1cccnc1	1813078019	MUWCRROHMGZRJK-KKUMJFAQSA-N	431.320	1.042	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)[C@@H](C)n2cncn2)[C@@H]1c1cccnc1	1813403022	CYPRKOSJZIKZSF-XNISGKROSA-N	435.326	1.724	50	20	IDGD	
CC(C)(CCl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1814693962	LSTIUVGXBBGWMG-INIZCTEOSA-N	432.717	1.660	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@H]1CCc2nc(NC(=O)CN3CCNC3=N)sc2C1	1814927627	INKLQDRSAWDTPS-XXFAHNHDSA-N	433.365	1.131	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H]1C[C@H]1C1CC1)CC2)c1cccc(B(O)O)c1	1815350430	VQCBRSWKIDFBRI-OWCLPIDISA-N	425.319	1.095	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@H](O)c2ccccc2)[nH]n1)c1cccc(B(O)O)c1	1817473456	VEDMAWIVNDHCPO-PZJWPPBQSA-N	448.288	1.129	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(CO)on2)n[nH]1	1820348876	KMLZBUYGNRRCIN-TVQRCGJNSA-N	426.271	1.979	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](O)CCl)CC2)c1cc(-c2cccnc2)[nH]n1	1820607206	BLXGSHDVOSYHLC-XHDPSFHLSA-N	446.920	1.754	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](F)Br)n[nH]1	1820935442	MMMULBXENBROPF-GLXFQSAKSA-N	430.278	1.783	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](F)Br)n[nH]1	1820937354	QHXKFTIPOOFINH-IAQYHMDHSA-N	447.309	1.465	50	20	IDGD	
C[C@H](Br)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN2CCOC2=O)[nH]n1	1822183380	BVWCJPKSXGWJTL-JQWIXIFHSA-N	428.287	1.637	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](C)Br)n[nH]1	1822189614	WOHWDTOLQOMSFJ-NQBHXWOUSA-N	426.315	1.876	50	20	IDGD	
O=C(CNC(=O)C(F)(F)F)Nc1cc([C@H]2CCCCN2C(=O)C(Cl)Cl)[nH]n1	1822444256	OKEYHAYLBCGECR-MRVPVSSYSA-N	430.214	1.884	50	20	IDGD	
CCO/C=C/C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1822603675	HIFYSQHAZPLMLZ-OJXHRBAXSA-N	427.465	1.264	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H]2CCOC2)n[nH]1	1822952868	XLRNTTOZMRSKHQ-HTCGYUKTSA-N	441.492	1.572	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](O)Cc3ccccc3)sc2C1	1825440415	ZJGHYKWASNBBTO-YCPHGPKFSA-N	437.949	1.913	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)COCCOC)CC2	1825444982	HNBNDANZADTWQI-QWRGUYRKSA-N	434.356	1.892	50	20	IDGD	
CC[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1[nH]nnc1C)CC2	1825446999	NMRKBYONMKGIAX-DTWKUNHWSA-N	427.328	1.969	50	20	IDGD	
C=CCO[C@@H](C)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827049188	PKYHIXYSDVTSMS-LAUBAEHRSA-N	428.338	1.191	50	20	IDGD	
N#Cc1c[nH]c(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)c1	1827052400	IBIXOBQTJZSFHO-OAQYLSRUSA-N	434.305	1.113	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CCBr)CC1	1827560639	WLHBZNYEGWVUEI-GJZGRUSLSA-N	431.375	1.838	50	20	IDGD	
C[C@H](NNc1ccccc1)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1829814903	URVVZLZLVGXBRZ-LIRRHRJNSA-N	445.347	1.252	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CC=CCC3)C2)C1	1830533536	PYLONSZEOWEGFX-FRQCXROJSA-N	429.355	1.830	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2CCCS2(=O)=O)CC1	1831286227	STHMDJIGBWMADG-ULQDDVLXSA-N	434.986	1.437	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCC(=O)N3CCCC3)C2)C1	1831639765	DRRQBLSMAHIOED-UTKZUKDTSA-N	443.972	1.253	50	20	IDGD	
CCNC(=S)NCC(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H](C)Br)CC1	1831655767	AOQSIPYYYJLUBN-ZFWWWQNUSA-N	447.443	1.874	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cnc(N)s2)CC1	1831870655	BOFTWJVYQGLTFM-OAHLLOKOSA-N	436.582	1.332	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(=O)oc2)CC1	1831872390	TWSYNYAEFFZZDO-SFHVURJKSA-N	432.521	1.246	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3cccnc3Cl)CCO2)C1	1832720719	OSGLGWXVGCJVMQ-DNVCBOLYSA-N	430.332	1.751	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)c1cccnc1S	1833080030	NFUMDDWMCBUVLS-MRXNPFEDSA-N	426.970	1.155	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccnc(C(F)F)c3)CCO2)C1	1833324060	MFUCFWSHNCEVPD-LIRRHRJNSA-N	447.866	1.343	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3c[nH]c(C(C)(C)C)c3)CCO2)C1	1833382495	BFKXTCPELVYDKG-KKSFZXQISA-N	441.956	1.636	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCC(N2CCC(NC(=O)c3ccnnc3)CC2)CC1	1834142088	QFXBTEYOPLKIAZ-IBGZPJMESA-N	428.364	1.898	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCC(N2CCC(NC(=O)c3cc(O)nc(O)n3)CC2)CC1	1835075721	HANAIUXDMGNELJ-UHFFFAOYSA-N	439.944	1.338	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@H](C)N(C)C(C)=O)CC2)CC1	1835120395	BIXMDQUJGJLBMC-KXBFYZLASA-N	429.005	1.832	50	20	IDGD	
Cc1cscc1C(=O)NC1CCN(C2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1	1835176083	VOQNEVARACWZFG-UHFFFAOYSA-N	449.621	1.615	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3cccs3)CCO2)C1	1836092056	OJRXUHAYBRTHIG-CRAIPNDOSA-N	445.379	1.921	50	20	IDGD	
CCn1nc(C)cc1C(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836717550	FLJMMRIXNYJSBT-GOSISDBHSA-N	426.945	1.423	50	20	IDGD	
Cn1ncc(C(=O)N2CCC(OC3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)c1Cl	1836718665	YPQLXFZEBTXKIK-HNNXBMFYSA-N	433.336	1.285	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)CN3C(=O)C=CC3=O)CC2)CC1	1836922177	JSBWOFBGFYCNJO-QGZVFWFLSA-N	439.940	1.318	50	20	IDGD	
O=C(c1cc(O)ncn1)N1CCC(OC2CCN(C(=O)[C@H](F)Br)CC2)CC1	1836940592	IXFNKLCPMYHNCO-HNNXBMFYSA-N	445.289	1.485	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(OC2CCN(C(=O)C3(C)CC3)CC2)CC1	1837597080	YNSZZRUCQWAVCV-PCLIKHOPSA-N	443.548	1.919	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)c3cccnn3)CC2)CC1	1838453506	LZPQFWHNPFHCSB-ZDUSSCGKSA-N	425.327	1.872	50	20	IDGD	
CCN1CCC(C(=O)N2CCC(OC3CCN(C(=O)[C@@H](Cl)COC)CC3)CC2)CC1	1838785830	IUCMDVCYOSZPLZ-FQEVSTJZSA-N	444.016	1.971	50	20	IDGD	
O=C(Cc1c(F)cccc1F)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1838996126	CCZWLQHWVMTJLB-SFHVURJKSA-N	437.270	1.767	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3cccc(OC)n3)C2)C1	1839142419	NVIZJYBDTUGPIW-LAUBAEHRSA-N	439.940	1.497	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cn(C(C)(C)C)nn3)C2)C1	1839146097	KBQHAIYTJTZFMC-LIRRHRJNSA-N	427.933	1.121	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCCn3cccc3)C2)C1	1839154946	DFDQALMGNNAUIF-PMACEKPBSA-N	446.375	1.961	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3ccc(C)cc3)CCO2)C1	1839939394	QWADPFGFHOVOMW-UGKGYDQZSA-N	438.952	1.638	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccccn3)C2)C1	1839964621	XMUPDGDFBMORTE-APWZRJJASA-N	440.338	1.254	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)c2ccccc2OC(F)(F)F)C1	1841155761	LDKXKPJVSSONRT-UHFFFAOYSA-N	442.438	1.775	50	20	IDGD	
C[C@H]1CC[C@@H](C(=O)N2CC3(CCCN3C(=O)[C@@H](O)CCl)C2)CN1C(=O)OC(C)(C)C	1841354801	WRPOVLPVYRIEFA-XHSDSOJGSA-N	443.972	1.825	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)C23CC(C(F)(F)F)(C2)C3)C1	1841683981	JGGIMKWPMALIDG-UHFFFAOYSA-N	437.422	1.235	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](CCO)C(=O)N1CC2(CCCN2C(=O)CCBr)C1	1842637179	MMZZLLWKFSGFOP-CYBMUJFWSA-N	448.358	1.251	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2ccccc2C(F)(F)F)C1	1844886695	FJBASIWBSFGSIW-UHFFFAOYSA-N	447.417	1.835	50	20	IDGD	
O=C(c1cn2ccc(Br)cc2n1)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl	1847559605	PLIAUYQRCXTTJQ-MELADBBJSA-N	441.713	1.512	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CCn2c(=O)n(C)c3ccccc32)cc(OC)c1OC	14279177	TUBDOFBHNLXBDO-UHFFFAOYSA-N	428.445	1.217	50	20	IDGD	
O=C(COC(=O)[C@@H]1COc2ccc(Cl)cc2C1)NNC(=O)c1cccc([N+](=O)[O-])c1	16796716	HVAACMIATVBLOR-ZDUSSCGKSA-N	433.804	1.804	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2cccc(C(F)(F)F)c2)c1C(F)(F)F)C(=O)NC1CC1	71842301	PWDTYTSHVUIGLE-UHFFFAOYSA-N	449.311	1.950	50	20	IDGD	
COc1cccc(CC(=O)N2CCN(CC(=O)NNC(=O)c3ccccc3Cl)CC2)c1	109231177	HBFYQCABMRJZOU-UHFFFAOYSA-N	444.919	1.497	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NC[C@H]1CCN(c2ccc(Cl)cc2)C1	726245429	OAVIGTFVPVBPOM-CYBMUJFWSA-N	435.937	1.988	50	20	IDGD	
Cc1noc(CNC(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)n1	727230702	OZWYMUZNFZETIU-UHFFFAOYSA-N	433.428	1.280	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)NCCNC(=O)c2cccs2)c1	728743873	FIXUZZUXDIBLLX-UHFFFAOYSA-N	441.307	1.893	50	20	IDGD	
CCCc1c(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)[nH]c(C)c1C(=O)OC	728890564	WDROAZWPRFZUSH-UHFFFAOYSA-N	428.493	1.530	50	20	IDGD	
CS(=O)(=O)N1CCc2cc(C(=O)NNc3ccc(S(=O)(=O)C(F)F)cc3)ccc21	728974109	FGEYFGMGYWPCKC-UHFFFAOYSA-N	445.469	1.762	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2ccc(NNC(=O)[C@@H]3CCOC3)c([N+](=O)[O-])c2)cc1	729295512	ZKEWOBOYMXPWQI-GFCCVEGCSA-N	436.446	1.884	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2cc(F)ccc2N2CCOCC2)c2ccccc2c1=O	730767996	WAFBYPGUDMFTQG-UHFFFAOYSA-N	439.447	1.467	50	20	IDGD	
CSCC[C@H](C(=O)NNc1nc(-c2cccnc2)no1)N1C(=O)[C@H]2CCCC[C@H]2C1=O	732110807	OPLJAHMDZFDLEW-QLFBSQMISA-N	444.517	1.872	50	20	IDGD	
CCc1cc(N2CCC[C@H](NC(=O)NNC(=O)Cc3nc4ccccc4n3C)C2)ncn1	732914171	MJOZNJBFZHBNDT-INIZCTEOSA-N	436.520	1.468	50	20	IDGD	
CCc1cc(N2CCC[C@H](NC(=O)NNC(=O)[C@@H](C)Oc3ccc(F)cc3)C2)ncn1	732914491	QTHCFRPOICSWSH-PBHICJAKSA-N	430.484	1.945	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)C2CCS(=O)(=O)CC2)c2ccccc2c1=O	732949228	HACDYRZXVNFNQE-UHFFFAOYSA-N	434.518	1.173	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)NCCNC(=O)c1c(F)cccc1F	733043304	UNOYOULHWMTWGG-UHFFFAOYSA-N	437.359	1.012	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc21)c1cccc(S(=O)(=O)N2CCCCC2)c1	733252105	DKSXAIHPFCFVDU-GOSISDBHSA-N	429.498	1.798	50	20	IDGD	
Cc1noc(C)c1[C@@H](C)NC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	733849960	OYDIAYOJDISWSU-GFCCVEGCSA-N	437.526	1.010	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)c1ccc(Cl)c(N2CCCC2=O)c1	734239993	GVGNORWHVQYGKZ-UHFFFAOYSA-N	439.900	1.936	50	20	IDGD	
C[C@@H](Sc1nncn1C)C(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	734825416	FJTNOHKXCCYDHO-LLVKDONJSA-N	427.531	1.026	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)c(-c2ccncc2)n1	734825459	GJSHGOWXUWNDHV-UHFFFAOYSA-N	443.508	1.826	50	20	IDGD	
Cc1cc2ccccc2n1CC(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	735117163	CEGXZVNKNYKUQY-UHFFFAOYSA-N	442.545	1.424	50	20	IDGD	
CC[C@@H](Cc1cccc(Br)c1)C(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1	735271380	BKXOVGYVKSKUIG-JSGCOSHPSA-N	432.340	1.535	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)N[C@H](C)CN1CCN(c2ccccn2)CC1	735587799	XXELRRZZGSLHEN-GOSISDBHSA-N	440.548	1.564	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(N2CCOCC2)c(C(=O)NNc2c(F)cccc2F)c1	735698404	GVEPDMJSGVZPAJ-UHFFFAOYSA-N	440.472	1.809	50	20	IDGD	
NC(=O)[C@@H]1CCCN1Cc1cccc(NC(=O)NNC(=O)COCc2ccccc2)c1	738438934	BHYCJMOULBJKEG-IBGZPJMESA-N	425.489	1.506	50	20	IDGD	
O=C(COCc1ccccc1)NNS(=O)(=O)c1cccc(I)c1	739672300	UFKSZCFQCASLQZ-UHFFFAOYSA-N	446.266	1.818	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)[C@@H]1CC(=O)N(Cc2cccc(C(F)(F)F)c2)C1	740851261	WVIQBXSOXPBZTB-CYBMUJFWSA-N	442.438	1.506	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2)C(F)(F)Oc1ccccc1	741651528	KMGLGOKAFFBSIO-UHFFFAOYSA-N	445.356	1.347	50	20	IDGD	
O=C(CN1CCC(C(=O)Nc2ccc(O)cc2)CC1)NNC(=O)c1cccc([N+](=O)[O-])c1	741777180	FABNKQDDGVQMCW-UHFFFAOYSA-N	441.444	1.412	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NC[C@H](c2ccco2)N2CCCC2)cc1	742710449	DGEQOGHKIBFKOM-MRXNPFEDSA-N	435.506	1.856	50	20	IDGD	
O=C(CN1C(=O)[C@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O)NNc1ccc(Br)cc1Cl	743334986	KLLXEQPKAVJKER-RFHZTLPTSA-N	428.670	1.708	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NNC(=O)c2cccc(Br)c2)cc1OC	743522040	WJJRYLXSLYGQNT-UHFFFAOYSA-N	437.250	1.755	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)[C@@H](Cc2cccc(F)c2)n2nnnc2C)c1	745017052	DAZPNGVFEAKKQM-GOSISDBHSA-N	440.435	1.217	50	20	IDGD	
COc1ccccc1N1CCC(NC(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)CC1	745786650	LBKFBNQZHZJHDG-UHFFFAOYSA-N	429.433	1.922	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)NCCNS(=O)(=O)c2cccnc2)c1	746326557	RTQBKLBMVZQVNM-UHFFFAOYSA-N	449.533	1.201	50	20	IDGD	
C[C@@H](Nc1ccc(C(=O)NNC(=O)C(=O)N2CCCC2)cc1[N+](=O)[O-])c1ccccn1	748240378	UWBQVIXNTDRBSV-CYBMUJFWSA-N	426.433	1.546	50	20	IDGD	
COc1ccc(-c2nn(-c3ccccc3)cc2CC(=O)NNC(=O)C(=O)N2CCCC2)cc1	748246342	WZUGCSJJULYHOS-UHFFFAOYSA-N	447.495	1.860	50	20	IDGD	
NC(=O)c1ccc(OCCC(=O)NNC(=O)COc2ccc(Br)cc2)cc1	748690952	HHPVALILMOYFKS-UHFFFAOYSA-N	436.262	1.543	50	20	IDGD	
CCCn1c(CCC(=O)NNC(=O)CC2CCCC2)nc2cc(S(N)(=O)=O)ccc21	749950881	OHRUFJCVMAVEDR-UHFFFAOYSA-N	435.550	1.754	50	20	IDGD	
COC(=O)c1ccc(Cl)cc1S(=O)(=O)NNC(=O)[C@H]1COc2ccccc2O1	751267804	ZKRNQSPDUXZTMM-CQSZACIVSA-N	426.834	1.276	50	20	IDGD	
COC(=O)[C@H](NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)c1cccc(C#N)c1	751447601	ZZKBHSYCBQAYAA-LJQANCHMSA-N	442.497	1.491	50	20	IDGD	
C[C@@H](NC(=S)NNC(=O)C1CCN(S(=O)(=O)c2cccnc2Cl)CC1)C1CC1	751617569	JKEPGJFSUPAZON-LLVKDONJSA-N	445.998	1.430	50	20	IDGD	
CCCn1c(CCC(=O)NNC(=O)c2ncccc2C)nc2cc(S(N)(=O)=O)ccc21	752234591	BTCMIDGHWCWFDY-UHFFFAOYSA-N	444.517	1.191	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2ccc(C)o2)cc1OCC	752779280	HVHPFKMZDQDJNG-UHFFFAOYSA-N	425.463	1.125	50	20	IDGD	
C[C@@H](C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1)c1ccc(S(C)(=O)=O)cc1	753294176	PJQOUSKNRWSLJA-CYBMUJFWSA-N	437.543	1.778	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)NC2CCN(S(=O)(=O)C3CC3)CC2)c(Cl)c1	753967868	RFMBQDAZAMLGCC-UHFFFAOYSA-N	429.930	1.941	50	20	IDGD	
O=C(Cc1cc[nH]n1)NNC(=O)c1sccc1S(=O)(=O)NCc1cccs1	755285382	AVLLCMCHJOUXAS-UHFFFAOYSA-N	425.517	1.015	50	20	IDGD	
CN1CCC2(CC1)CC(=NNC(=O)CSc1nnc(O)nc1O)c1ccccc1O2	755618129	FNVSMSMGVDPSGR-UHFFFAOYSA-N	430.490	1.142	50	20	IDGD	
Cc1cc(C(=O)N2CCCC2)ccc1NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	756275042	UVMGIAUVBAMOOJ-UHFFFAOYSA-N	434.460	1.673	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)Nc1cccc(C[S@@](=O)Cc2ccccc2)c1	756595832	ZEOTTWHXMRQPLD-ADKRDUOOSA-N	449.554	1.723	50	20	IDGD	
CC(C)OC(=O)NCc1ccc(NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1	756608977	LWFIIMZMCSMBJS-UHFFFAOYSA-N	438.448	1.763	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2cccc(N(C)C)c2)cc1	756783983	JQEKGEUFNRUCJT-UHFFFAOYSA-N	435.506	1.144	50	20	IDGD	
CCc1csc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)n1	756812836	AUOSMBVNYAXAGE-UHFFFAOYSA-N	439.519	1.193	50	20	IDGD	
Cc1nn([C@H]2CCS(=O)(=O)C2)c(C)c1NC(=O)NNC(=O)c1cccc(N(C)C)c1	757870869	AXBRLZOYDZLZOL-INIZCTEOSA-N	434.522	1.392	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)[C@H](Sc1ccc(F)c(F)c1)c1ccccc1	758035874	ODEGYRWZVFXURB-MEDUHNTESA-N	443.497	1.883	50	20	IDGD	
COC(=O)c1ccccc1CCC(=O)NNC(=O)c1sc(N2CCOCC2)nc1C	758079554	NSLWOAWIKMQKQT-UHFFFAOYSA-N	432.502	1.469	50	20	IDGD	
O=C(COc1ccc(OCc2ccccc2)cc1)NNC(=O)N[C@@H]1CCCS(=O)(=O)C1	758659386	UDKIJZFDWMFTDJ-QGZVFWFLSA-N	447.513	1.552	50	20	IDGD	
O=C(CNC(=O)c1ccc(Oc2ccccc2)cc1)NNC(=O)C(=O)Nc1ccccn1	758908916	WJAQJIYEYQNXGC-UHFFFAOYSA-N	433.424	1.390	50	20	IDGD	
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)NNc1ncnc2ccsc12	760173951	YXLFXIMMMGWQMF-AWEZNQCLSA-N	428.474	1.695	50	20	IDGD	
Cc1csc([C@](O)(CC(=O)NNC(=O)CCNC(=O)OC(C)(C)C)C(F)(F)F)n1	760437911	LRIQNWWRQCBBNX-OAHLLOKOSA-N	440.444	1.654	50	20	IDGD	
C[C@@H](Sc1ccccn1)C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	762540126	NDLOHZFIDCGUQF-CQSZACIVSA-N	436.563	1.037	50	20	IDGD	
CC(C)S(=O)(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c1	763467292	AYFIFFXEVJBRQI-UHFFFAOYSA-N	448.457	1.318	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1cc(F)c(N2CCCC2)c(F)c1	763471514	USBASZNCOZVSAV-UHFFFAOYSA-N	433.371	1.873	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)[nH]n1)C(=O)Nc1cccc(N2CCNC2=O)c1	763605667	PRGMBWYUVBLUNP-UHFFFAOYSA-N	433.428	1.006	50	20	IDGD	
C=CCNC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)COc2cc(C)cc(C)c2)cc1	763644779	MFGWWBODERYDCC-UHFFFAOYSA-N	439.472	1.776	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)COc2ccc(C)c(C)c2)cc(OC)c1OC	763679195	IGJYCMCCUZHLJO-UHFFFAOYSA-N	431.445	1.494	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)nn1-c1cccc(F)c1	763807933	SAIFNKUGVGASDE-UHFFFAOYSA-N	436.403	1.356	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(C(=O)NC3CCCC3)cc2)cc1	763821514	RLCATQTZGVBKGF-UHFFFAOYSA-N	438.484	1.832	50	20	IDGD	
Cc1ccc(I)cc1C(=O)NNC(=O)CNC(=O)c1cccnc1	763823408	BBADWBHHFFVKMD-UHFFFAOYSA-N	438.225	1.186	50	20	IDGD	
CCCn1ccc2ccc(NC(=O)C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)cc21	763917328	UTXXNUUZBASEPP-UHFFFAOYSA-N	432.444	1.427	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)Nc1cccc(-c2ncco2)c1	764003115	YUKVVQIJZAXDLR-UHFFFAOYSA-N	432.234	1.842	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1cccn(Cc2ccc(C)cc2)c1=O	764047544	HKCDVNPVAQLCGC-UHFFFAOYSA-N	434.452	1.613	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc([C@H](C)NC(=O)OC(C)(C)C)cc2)n[nH]1	764106305	HXFMRZMODXYZRR-LBPRGKRZSA-N	430.465	1.704	50	20	IDGD	
CCOC(=O)c1cc(CC)sc1NC(=O)C(=O)NNC(=O)[C@H]1Cc2ccccc2O1	764154460	QSGXPWHBKPIVGE-OAHLLOKOSA-N	431.470	1.577	50	20	IDGD	
CN(C)CCCOc1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)cc1	764166380	BNRVSMREPQYQBO-IBGZPJMESA-N	426.473	1.107	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1cccc(NC(=O)C(=O)NNC(=O)CCc2ccco2)c1	764167224	WLBOJAMAFLWPHW-UHFFFAOYSA-N	436.490	1.075	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(-c3nnc4n3CCCC4)cc2)c1	764242420	QMIZSTADHCXZAS-UHFFFAOYSA-N	429.440	1.553	50	20	IDGD	
CN(C)CCCOc1ccc(NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)cc1	764243793	ZTAWVDTZOQLOOZ-UHFFFAOYSA-N	437.500	1.758	50	20	IDGD	
CC(=O)N1CCCc2cc(NC(=O)C(=O)NNC(=O)c3cccc4ncccc34)ccc21	764252104	BMBJHALTNWBMHA-UHFFFAOYSA-N	431.452	1.934	50	20	IDGD	
CS(=O)(=O)c1ccc(F)c(NC(=O)C(=O)NNC(=O)c2cccc(OC(F)F)c2)c1	764259834	PBHCKCRWUHYUNO-UHFFFAOYSA-N	445.375	1.230	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)N(C)CC3)cc1Br	764326573	NGRRKWUGSAXSIE-UHFFFAOYSA-N	447.289	1.850	50	20	IDGD	
Cc1cn(-c2ccccc2)nc1NC(=O)C(=O)NNC(=O)c1cnn(-c2ccccc2)c1	764345958	ODQFQJHLBMKCBT-UHFFFAOYSA-N	429.440	1.766	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)cc1	764389045	WZVITAMXTMPEJV-UHFFFAOYSA-N	425.376	1.402	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1ccc(O[C@@H]2CCOC2)cc1	764393858	SDLDEBIAMSKFNQ-MRXNPFEDSA-N	445.497	1.741	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)[C@H](C)NS(=O)(=O)c2cccc(C#N)c2)cc1C	764525556	VSBMAZVQEHHZFR-HNNXBMFYSA-N	430.486	1.068	50	20	IDGD	
CCS(=O)(=O)c1cccc(CC(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)c1	764621973	UKKRVNXBVRCMLH-UHFFFAOYSA-N	438.889	1.681	50	20	IDGD	
C[C@H](Oc1cccc(C=NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)c1)C(=O)O	764831309	PXRWPAMKWMULGC-KRWDZBQOSA-N	438.484	1.447	50	20	IDGD	
CC(=O)Nc1cc(S(=O)(=O)NNC(=O)c2ccc(Br)s2)ccc1O	765034446	LQXVXEUBCVSNQT-UHFFFAOYSA-N	434.293	1.798	50	20	IDGD	
CC[C@H]1CCCC[C@H]1OCC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1	766339061	NADILMITTFPLBO-FUHWJXTLSA-N	425.551	1.748	50	20	IDGD	
COc1cccc(OCCN2CCN(CC(=O)NNC(=O)c3ccc(C)cc3)CC2)c1	767045764	AGNVCYBHEDIVQF-UHFFFAOYSA-N	426.517	1.461	50	20	IDGD	
CC1(CNC(=O)/C(C#N)=C\c2cn(CCC(N)=O)nc2-c2ccc(Cl)cc2)OCCO1	769021824	CVXRTWXXQRGZDV-GDNBJRDFSA-N	443.891	1.865	50	20	IDGD	
NS(=O)(=O)c1cccc(NC(=O)COC(=O)[C@@]23CC[C@@H](C[C@@H]2Br)C3)c1	769983742	WZLOJYSURKBAIV-YNZJMPHRSA-N	431.308	1.769	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)c3ccc4c(c3)C(=O)N(Cc3ccco3)C4=O)nc21	770970418	YFRPNVWGKONPHF-UHFFFAOYSA-N	433.384	1.215	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@@H](C(=O)NNc2ccnc(Br)c2)[C@@H](C)O)cc1	771551679	HEZHTBBSXDJVJX-IAQYHMDHSA-N	443.323	1.324	50	20	IDGD	
Cc1cc([N+](=O)[O-])cc(S(=O)(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)c1C	771607661	POKZFOOQWUDJNR-UHFFFAOYSA-N	440.865	1.491	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C[C@@](O)(c1nccn1C)C(F)(F)F	772994963	MKVTZPZRPVKPDI-QLJPJBMISA-N	434.802	1.828	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccnn3-c3ccc(C)nn3)n[nH]2)cc1	773495561	CKJXZLRHMNZEGT-UHFFFAOYSA-N	445.443	1.069	50	20	IDGD	
COc1cc(C)c(NC(=O)C(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)cc1C	773513786	XVLQMNKSGUKKDW-UHFFFAOYSA-N	431.445	1.738	50	20	IDGD	
COc1cc(SC)ccc1NC(=O)C(=O)NNC(=O)CN1CCCc2ccccc21	773521133	BSVLNBUZCXDKRU-UHFFFAOYSA-N	428.514	1.956	50	20	IDGD	
Nc1nc(Cl)cc(NNC(=O)[C@@H]2CCCN2C(=O)Nc2ccc3c(c2)OCCO3)n1	773866301	SUPHIKRNVUWSHP-NSHDSACASA-N	433.856	1.623	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN[C@@H]2CCN(Cc3ccccc3)C[C@H]2C)cc1OC	775689893	NBWGZQAJDRRAOB-YLJYHZDGSA-N	440.544	1.965	50	20	IDGD	
CO[C@@H](c1ccccc1F)[C@H](C)NC(=O)NNC(=O)c1csc(N2CCOCC2)n1	775712551	CZJBMCZATGWUFM-BLLLJJGKSA-N	437.497	1.839	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)N[C@@H](c1ccccc1OC(F)F)C(F)(F)F	776003046	WIKKAEKYVIZIPJ-XVKPBYJWSA-N	448.370	1.160	50	20	IDGD	
CN(NC(=O)c1ccnc(O[C@H]2CCOC2)c1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776202435	TWUREYJADBFHJP-INIZCTEOSA-N	449.508	1.499	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)[C@@]1(F)CCN(C(=O)OCc2ccccc2)C1	777390950	DLTMTNYYBZYSFQ-OAQYLSRUSA-N	431.420	1.669	50	20	IDGD	
COc1cccc(C(=O)N2CCN(S(=O)(=O)CBr)CC2)c1OC(F)F	777833151	SZTRSLRIHGWHHR-UHFFFAOYSA-N	443.266	1.737	50	20	IDGD	
O=C(NNc1nc(-c2ccccc2)no1)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(F)cc1	780652286	XTUSSRNJIFKNAM-ZBFHGGJFSA-N	447.448	1.143	50	20	IDGD	
COc1cccc(NNC(=O)c2ccc(Br)c(S(=O)(=O)N(C)C)c2)n1	781025428	ORUNYHDJEVIADS-UHFFFAOYSA-N	429.296	1.860	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)NCc2ccccc2CN2CC[C@H](O)C2)cc1OC	781833021	JDIURYWBOUICLV-IBGZPJMESA-N	442.516	1.805	50	20	IDGD	
CC(=O)N1CCN(Cc2ccccc2NC(=O)NNC(=O)c2ccc3c(c2)OCO3)CC1	782079250	WCXPLYLSKMMTGE-UHFFFAOYSA-N	439.472	1.546	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(CNC(=O)NNC(=O)CSc2ccccc2O)c1	782539118	QFXGQHJCGDJRED-UHFFFAOYSA-N	438.531	1.265	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccccc2CCN(C)C)c1C	782701283	CBZPCVGLSAVKFT-QGZVFWFLSA-N	426.517	1.961	50	20	IDGD	
CCN1CCN(C(=O)Cc2ccc(NC(=O)C(=O)NNc3ccc(F)cc3F)cc2)CC1	783340138	OHEXQSSNLWHYIN-UHFFFAOYSA-N	445.470	1.753	50	20	IDGD	
CN(Cc1ccccc1)S(=O)(=O)c1ccc(NC(=O)C(=O)NN=c2cc[nH]cc2)cc1	783378764	MYSGHDQAPLAUFU-UHFFFAOYSA-N	439.497	1.406	50	20	IDGD	
O=C(NNc1ccc(Cl)nn1)C(=O)Nc1ccn(-c2ncccc2C(F)(F)F)n1	784789754	OUWAMMIQTAVPRM-UHFFFAOYSA-N	426.746	1.811	50	20	IDGD	
CCN1CCN(C(=O)c2ccc(NC(=O)C(=O)NNc3ccc(F)c(F)c3F)cc2)CC1	784811087	NPHHJRNSTAQVMP-UHFFFAOYSA-N	449.433	1.963	50	20	IDGD	
Cn1ccnc(NNC(=O)C(=O)Nc2ccccc2COc2ccc(CC#N)cc2)c1=O	785089837	GWAHOHDQZJJSDT-UHFFFAOYSA-N	432.440	1.507	50	20	IDGD	
Cn1ccnc(NNC(=O)C(=O)Nc2ccc3c(c2)CCCN3C(=O)OC(C)(C)C)c1=O	785090672	WKXFVLZJNPAFRO-UHFFFAOYSA-N	442.476	1.550	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1cnn(-c2ccccc2)c1	785330757	LIPSLQAEOQYQJF-UHFFFAOYSA-N	429.458	1.366	50	20	IDGD	
CC[C@@]1(C)Oc2ccc(NC(=O)C(=O)NNC(=O)COc3ccccc3OC)cc2O1	785991387	REBKPYCUYPHODV-NRFANRHFSA-N	429.429	1.758	50	20	IDGD	
COc1cc(C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)cnc1Br	786749351	FHFVALLJTTUAIL-UHFFFAOYSA-N	433.218	1.342	50	20	IDGD	
COc1ccc(C(=O)NCCN2CCN(C(=O)/C(C#N)=C\c3ccc(O)cc3)CC2)cc1	787343053	XTGHAJULYOSQDV-SILNSSARSA-N	434.496	1.882	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2c(C)nn(C)c2-n2ccnc2C)c2ccccc2c1=O	788261609	AGWWSXQXTQMECQ-UHFFFAOYSA-N	434.460	1.027	50	20	IDGD	
C[C@@]1(NNC(=O)N[C@H]2CCCN(c3ccc(Cl)cc3Cl)C2=O)CCS(=O)(=O)C1	788916927	RVVAMMYYPXUCMJ-SUMWQHHRSA-N	449.360	1.870	50	20	IDGD	
CC(C)(C)OC(=O)Nc1ccccc1CCC(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1	790483228	FSQCDCVSDJWOBB-AWEZNQCLSA-N	425.507	1.548	50	20	IDGD	
CCc1nn(C)c(CC)c1CC(=O)NNC(=O)c1cc(-c2ccc(OC)c(OC)c2)[nH]n1	790830481	PYTIVFIDSKCIAS-UHFFFAOYSA-N	440.504	1.956	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cccc(N3CCC3=O)c2)cc1	790952318	QUYUUTIVKLWFIL-CQSZACIVSA-N	438.440	1.179	50	20	IDGD	
CN(C)NC(=O)Nc1cccc(NC(=O)CCS(=O)(=O)c2ccc3c(c2)OCCO3)c1	791273391	USVBEJNXZKFYRT-UHFFFAOYSA-N	448.501	1.858	50	20	IDGD	
C[C@@](O)(Cn1cc(C(F)(F)F)ccc1=O)C(=O)NNC(=O)c1ccc2ccccc2n1	792003943	CPRSIWATRPONHT-LJQANCHMSA-N	434.374	1.628	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)cc(Cl)c1F	792269387	YJPAYFARJZRUMZ-UHFFFAOYSA-N	448.794	1.302	50	20	IDGD	
CN1CCCN(S(=O)(=O)c2cccc(NC(=O)NNc3nc4ccccn4n3)c2)CC1	792293978	DTDXOKLZEJWTIO-UHFFFAOYSA-N	444.521	1.204	50	20	IDGD	
O=C(Cc1ccc(I)cc1)NNC(=O)[C@@H]1COc2ccccc2O1	792564489	WTXAAVNHONXUOS-HNNXBMFYSA-N	438.221	1.821	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCN(C)[C@H](Cc3ccccc3)C2)cc1OC	792938222	BWZLZCWVXBZTBD-LJQANCHMSA-N	426.517	1.324	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccc2ccn(C)c(=O)c2c1	793022605	YRDPZVQKDWBAEQ-GFCCVEGCSA-N	426.404	1.231	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)[C@H]2CCCCN2Cc2ccccn2)n1	795607457	OXNWGMFTIUHPFA-MRXNPFEDSA-N	431.518	1.134	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2cc(C)cc(C)c2)cc1OC	796992982	ZCNPSKBAOYGQLR-UHFFFAOYSA-N	429.429	1.264	50	20	IDGD	
CCn1ncc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)c1C(F)(F)F	799258853	NXMVQXXMKOSLBK-VIFPVBQESA-N	431.346	1.614	50	20	IDGD	
CSC[C@@H](C)C(=O)N1CCC(C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)CC1	799407535	VJYDOZHOSDSTTC-KGLIPLIRSA-N	425.526	1.978	50	20	IDGD	
N#Cc1cc(S(=O)(=O)NNC(=O)[C@@H]2COc3ccccc3O2)ccc1C(F)(F)F	799914368	LWEBOUFAVNUJBR-HNNXBMFYSA-N	427.360	1.727	50	20	IDGD	
O=C(N=c1cc[nH]cc1)NNC(=O)[C@@H]1CCC(=O)N1Cc1ccc(Br)cc1	802035143	BIIPUUCZMIZRNT-HNNXBMFYSA-N	432.278	1.610	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2ccc3c(c2)S(=O)(=O)N(C2CC2)C3=O)cc1	802063329	YXVGJXMJAVHNGM-UHFFFAOYSA-N	430.442	1.469	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C(=O)Nc2nc(Cc3ccccc3)cs2)nc2ccccc21	806992721	LBUNNEKDFGWCTG-UHFFFAOYSA-N	448.508	1.949	50	20	IDGD	
C[C@]1(C2CC2)NC(=O)N(c2cccc(CNC(=O)NNc3nc4ccccn4n3)c2)C1=O	807238122	UIGWUUPUTBKMAC-OAQYLSRUSA-N	434.460	1.781	50	20	IDGD	
COc1ccc(NNC(=O)CNS(=O)(=O)c2ccc(NC(C)C)c([N+](=O)[O-])c2)cc1	810345397	GURMRMRRXXEKQU-UHFFFAOYSA-N	437.478	1.845	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(OCCCCl)cc2)CC1)N[C@@H]1CCS(=O)(=O)C1	811465450	FNEMKYILNXYDKM-GOSISDBHSA-N	443.997	1.115	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)c2cc([N+](=O)[O-])ccc2N2CCOCC2)cc1	812730922	GFQDVTNEYBZAEI-UHFFFAOYSA-N	449.489	1.439	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)Cc3nnc(C)o3)c2)c(C)c1	813363371	IJPDEZPDOUGSKF-UHFFFAOYSA-N	443.485	1.799	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2c(I)cnn2C)cc1C	814252505	ABTAEVJPKZCMKI-UHFFFAOYSA-N	441.229	1.041	50	20	IDGD	
CN(C/C=C/C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)CC(F)(F)F	814361851	HDCNDXGYXJLDSK-VMPITWQZSA-N	427.471	1.396	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)ccn1C(C)C	814698618	LPHMWCSRNOKNNG-UHFFFAOYSA-N	434.518	1.473	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cn(Cc3ccccc3)nn2)c1C	815566000	GGTXWMKSEHRELV-MRXNPFEDSA-N	436.472	1.497	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cc(Br)ccc2O)cn2ccnc12	815569296	NYGDHBVMOOIEER-UHFFFAOYSA-N	432.234	1.511	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCc2nncn2C1)C(=O)Nc1ccccc1-c1c(F)cccc1F	815691904	FEYSRFZSHZPJGN-GFCCVEGCSA-N	440.410	1.572	50	20	IDGD	
CSC[C@H](C(=O)NNC(=O)COc1cc(C)ccc1C)N1C(=O)[C@H]2CCCC[C@H]2C1=O	864002815	QLMJSTMGQRHUML-IXDOHACOSA-N	447.557	1.736	50	20	IDGD	
O=C(CN1CCN(Cc2cccc3cccnc23)CC1)NNC(=O)c1ccc([N+](=O)[O-])cc1	897330101	GPINSWNVPLMKAH-UHFFFAOYSA-N	448.483	1.722	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)Cc2ccc(S(N)(=O)=O)s2)cc1OC	915189021	SJEXNHMAIQGVAT-UHFFFAOYSA-N	441.531	1.587	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)[C@@H]2CC(=O)N(C(CC)CC)C2)c2ccccc2c1=O	915619847	QEJRTYFVEJNOBI-CQSZACIVSA-N	427.505	1.605	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)NCC(C)(C)N2CCOCC2)c2ccccc2c1=O	915894848	VTSGJCAKRBVSJG-UHFFFAOYSA-N	430.509	1.032	50	20	IDGD	
CCc1ccc([C@H](CNC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)N(C)C)cc1	915902463	VASMWOMRKGDWCA-IBGZPJMESA-N	432.546	1.899	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)NC2CCN(S(C)(=O)=O)CC2)c1	916237683	CBCNIOWCMXQTSR-UHFFFAOYSA-N	426.539	1.252	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCc1nncn1-c1ccccc1	916580677	PPAMKTRLVJESQF-UHFFFAOYSA-N	442.505	1.013	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NCc2csc(Br)c2)c2ccccc2c1=O	916626360	ZNXRSESSMOEGOM-UHFFFAOYSA-N	436.291	1.902	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)c1cnc2nc(O)nc(O)c2c1	916735544	YXGGCCSFQXHJTC-QMMMGPOBSA-N	448.233	1.427	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)[C@@H](C)NS(=O)(=O)c2cccs2)cc1	917917998	ISXYZZASWQJYMO-CHWSQXEVSA-N	441.531	1.429	50	20	IDGD	
CCOc1ccc(C(=O)NNS(=O)(=O)c2ccc([C@H](C)NC(C)=O)s2)cc1OC	918399973	WONIQOGBHBZJQX-NSHDSACASA-N	441.531	1.976	50	20	IDGD	
O=C(COC(=O)CNC(=O)c1ccc(F)c(F)c1)NNC(=O)c1cccc(Cl)c1	919616590	XUHWYUPWJYVGAZ-UHFFFAOYSA-N	425.775	1.352	50	20	IDGD	
O=C(NNC(=O)c1ccc2nc(O)oc2c1)c1cccc(S(=O)(=O)N2CCCCC2)c1	919807458	MNKDPYRFFZFORM-UHFFFAOYSA-N	444.469	1.783	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)[C@@H]2CCCN2C(=O)/C=C\c2ccc(C(N)=O)cc2)cc1	920023255	YMBYYNOFTCXRCO-VHNWJRSRSA-N	434.496	1.813	50	20	IDGD	
C[C@]1(NNC(=O)NC[C@@H]2CCN(c3cccc(Br)c3)C2)CCS(=O)(=O)C1	920049167	RJINZYCHOKXTLB-GUYCJALGSA-N	445.383	1.656	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)NCc2cccc(C(=O)N3CCOCC3)c2)c1	920812334	WKXBPOVHVWTTLK-UHFFFAOYSA-N	440.500	1.685	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)c2cccc(C(=O)NC)n2)cc(OCC)c1OCC	1323919008	CXSHYQUAQIJOKQ-UHFFFAOYSA-N	430.461	1.712	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN1C(=O)c1ccc2c(c1)OCO2)c1cncn1-c1ccccc1	1325093774	LHCNNZVJDMKORN-QGZVFWFLSA-N	447.451	1.667	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2ccc(S(=O)(=O)C(F)(F)F)cc2)cc1	1325942568	NKVDPABTRAETTD-UHFFFAOYSA-N	438.405	1.612	50	20	IDGD	
C[C@@H](O)CNS(=O)(=O)c1ccc(C(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)cc1	1335673763	MPTWFGIAZKTOIA-BUBBNXEVSA-N	435.546	1.323	50	20	IDGD	
Cc1c(C(=O)N2CC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)oc2ccccc12	1777751511	RSSSICFTXRJDOA-QHCPKHFHSA-N	442.516	1.558	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cn4ccc(Cl)cc4n3)C2)C1	1778063126	XFDPFBDJWTUXBQ-KUHUBIRLSA-N	441.315	1.685	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(OC)ccn2)C1	1779704244	NYPNYFALVDYKDD-WRWLIDTKSA-N	425.913	1.472	50	20	IDGD	
CC(C)NC(=O)OC(C)(C)C(=O)N1CC[C@@]2(CN(C(=O)[C@@H](C)Br)CCO2)C1	1781023903	PUVRRUFPMJSGKR-FZKQIMNGSA-N	448.358	1.513	50	20	IDGD	
C[C@H](Nc1ccccn1)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781331911	RTXJKGYKGWEHIC-JDFRZJQESA-N	429.290	1.402	50	20	IDGD	
CC(=O)Nc1ccccc1C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781333933	ICAPTCPVEJDALW-QAPCUYQASA-N	442.285	1.779	50	20	IDGD	
COc1ccc(F)cc1C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781335632	XYCJOHWZLCSXNU-RHSMWYFYSA-N	433.249	1.968	50	20	IDGD	
CC(=O)N/C(C)=C/C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)CBr)C2	1781457629	IVVXTLFKNVTVMK-KCWWTWOMSA-N	444.370	1.571	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Br)C2	1782003842	WUGHNKPHEVXPPI-ICUOPCATSA-N	444.139	1.974	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C=C/c1ccoc1)C2	1782209550	ZAOKZGQCMDBGTK-ZJHAOYMUSA-N	432.521	1.180	50	20	IDGD	
C[C@@]1(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2ccc(B(O)O)cc2)C3)CC=CCC1	1782722073	VSYWIXILNBETNW-AGILITTLSA-N	440.349	1.240	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)c1ccc(F)nc1F	1783384476	UCENGGYONFNHNI-KYVBTAMFSA-N	436.228	1.644	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2	1783399947	LYZMPVTTXKCZII-ZWKOTPCHSA-N	438.352	1.577	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)C[C@@H](C)NC(=O)OC(C)(C)C)CCO2)C1	1783876027	QTTPZCSEFFLGGM-SIFCLUCFSA-N	447.960	1.373	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(C#N)cc3Cl)CCO2)C1	1783882546	ZYELIWBJAUUSMH-QFBILLFUSA-N	426.300	1.909	50	20	IDGD	
O=C([C@@H]1CCCN1Cc1ccccc1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1784239051	PBVGIMSELLVQPM-CNNODRBYSA-N	435.952	1.081	50	20	IDGD	
Cc1cc(C)n(CCC(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)n1	1784319265	NDULHPYYPDQMAU-KUHUBIRLSA-N	441.370	1.751	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(C)(C)NC(C)=O)[C@H]2C1	1784530851	VMTHTWKRRZFNLU-XQLPTFJDSA-N	432.359	1.054	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3nnc(C)s3)[C@H]2C1	1785326525	FVYJDDRBAIEARZ-AJNGGQMLSA-N	430.958	1.013	50	20	IDGD	
C[C@@H](Oc1ccccn1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCBr)[C@H]2C1	1786407670	HDJHYFINXMIADT-UGUYLWEFSA-N	440.338	1.614	50	20	IDGD	
COc1ccc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]3C2)c([N+](=O)[O-])c1	1787448990	JRAVHXZBCYGWRD-WIRVQXDCSA-N	443.859	1.660	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)c1cnn2ccncc12	1788032628	ZXORPQKKRWBXLB-NOLJZWGESA-N	436.310	1.108	50	20	IDGD	
COc1ccc(C(=O)Nc2ccc(C3(NC(=O)c4ccc(B(O)O)cc4)CCC3)cc2)nc1	1788860501	AXCLEYLREASKII-UHFFFAOYSA-N	445.284	1.832	50	20	IDGD	
Cc1cc(C)n(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]3C2)n1	1789921990	AJFNEGHSYGRQIK-RZLSGREXSA-N	431.306	1.170	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CNc4ccccc43)C[C@@H]21)[C@H](F)Br	1789922269	HGXHWOZVOXWHFJ-PRIPBFSGSA-N	440.313	1.866	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(-n4cccn4)cc3)[C@H]2C1	1790111463	VYBCUPDIXVCRKG-LEAZDLGRSA-N	446.935	1.719	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cn3cnc4ccccc43)[C@H]2C1	1791179566	ZFEJLWZBIXTHBT-XSWJXKHESA-N	449.349	1.799	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3CC=CC[C@H]3C(=O)OC)[C@H]2C1	1791236838	YVHQNAABFPTJFD-IZPLOLCNSA-N	426.941	1.739	50	20	IDGD	
COC(=O)CCCCCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)Br)C[C@@H]21	1791353429	CGAOWUVUGNXERR-UGUYLWEFSA-N	447.370	1.873	50	20	IDGD	
O=C(Cc1ccc(O)cn1)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21	1791709452	KFLYABDGJSXLCH-RCBQFDQVSA-N	426.311	1.094	50	20	IDGD	
CCN1CCC(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]32)CC1	1792296476	WFWHJKNDJSPIRF-OGNFBWPZSA-N	434.408	1.934	50	20	IDGD	
COC(=O)c1ccc(OCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Cl)C[C@@H]32)cc1	1792340176	QKQMIJURUBGJOR-MBGYTDRXSA-N	442.871	1.366	50	20	IDGD	
COc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](O)CCl)C3)c(Cl)c1OC	1792683184	BIJRVSRCIHWVID-DDFXLWFNSA-N	447.315	1.160	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2	1792873981	IGIVCPJDMBINED-KAMPLNKDSA-N	430.112	1.298	50	20	IDGD	
C[C@@H](CBr)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccn3c(O)nnc13)C2	1792987887	HJCLKSHVOPOXBE-RVMXOQNASA-N	436.310	1.718	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ncn(C(C)C)n1	1796635517	ZYCNTTNBDAAVSD-CRWXNKLISA-N	428.331	1.236	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C=N/O[C@@H]1CCCCO1	1797810755	WJTRRUIFELXZEA-ZOHGXAGCSA-N	446.342	1.136	50	20	IDGD	
CCc1noc(C)c1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnccc1C(=O)NN)C2	1798861004	CRSUKDVRGDCJMK-BTTYYORXSA-N	426.477	1.110	50	20	IDGD	
CO[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Br)c1ccccc1	1799346109	CEILKHPMWGLFQQ-YIDVYQOGSA-N	429.286	1.654	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)COc1ccccc1F	1800647275	AZBAHCFXOVHVGX-AHXJXLJNSA-N	443.313	1.968	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)Oc1ccccn1	1801368753	IMCHPUONTBKRAJ-JBXGNFEISA-N	440.338	1.612	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc2c1CCCC2	1801776452	SQYVCJKYEFSKDY-FEJSZKPUSA-N	442.560	1.142	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(N2C(=O)C=CC2=O)cc1	1803883654	GLWQSFOSDLOCSZ-RANZSIQMSA-N	445.903	1.622	50	20	IDGD	
CN[C@H](CC(=O)NC[C@@H]1CCN(C(=O)CO[Si](C)(C)C)[C@@H]1c1cccnc1)C(=O)O	1807204657	NMHQHZAODIJORL-FRQCXROJSA-N	436.585	1.002	50	20	IDGD	
C[C@@H]1C[C@]1(C)C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1	1807772276	IVTXCOZQHMOTTH-RNRVAENMSA-N	436.516	1.446	50	20	IDGD	
Cc1ccc(C(=O)N2CCCC3(CCN(C(=O)c4cccc(B(O)O)c4)CC3)C2)s1	1808084984	IJLDCZCAHBOVFZ-UHFFFAOYSA-N	426.347	1.895	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2cnn3ncccc23)[C@@H]1c1cccnc1	1808175824	PTJAQNDGOFKCIS-AYBZRNKSSA-N	442.907	1.698	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC2(CCCN(C(=O)Cc3ccccn3)C2)CC1	1810193167	QBUULWDTCKMVCG-UHFFFAOYSA-N	436.516	1.168	50	20	IDGD	
CC(C)(C)CC(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1	1810298408	IBYUFZJAJWEQCR-UZLBHIALSA-N	438.532	1.836	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)C[C@](C)(O)CC(=O)O)[C@@H]1c1cccnc1	1813067411	GWZRNWXCBOXFIP-QIJLZVCCSA-N	425.913	1.721	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2ccccc2F)[C@H]1c1cccnc1	1813072681	IYAPYGKDDPSNPA-VGSWGCGISA-N	441.507	1.913	50	20	IDGD	
O=C1C[C@H](C(=O)NC[C@@H]2CCN(C(=O)CCBr)[C@@H]2c2cccnc2)CCN1	1813133736	OAOWDRSXEJJGBC-QIIPPGSGSA-N	437.338	1.399	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)CSC(=N)N)sc2C1	1814730835	WKNLGHQGEPXGEU-JGVFFNPUSA-N	434.385	1.855	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)[C@@H](O)CCl)n[nH]2)nc2nccn12	1814874885	IOOXRTBPLWFCLV-CABCVRRESA-N	431.884	1.666	50	20	IDGD	
Cc1ncoc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1816538715	ZOIKQYIIHMVMPD-HNNXBMFYSA-N	438.448	1.324	50	20	IDGD	
Cc1ccn2ncc(C(=O)Nc3nc4c(s3)C[C@@H](NC(=O)[C@H](O)CCl)CC4)c2c1	1816930609	AYAJNDBMNBKFGW-XHDPSFHLSA-N	433.921	1.925	50	20	IDGD	
CO/C=C(\C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1819277759	BZPIKDLLSZQTIN-PCUGXKRQSA-N	427.465	1.264	50	20	IDGD	
CN[C@@H](CC(=O)N1CCCC[C@H]1c1cc(NC(=O)CO[Si](C)(C)C)n[nH]1)C(=O)O	1819593458	ILHOGKAGXUFJJE-KBPBESRZSA-N	425.562	1.316	50	20	IDGD	
C[Si](C)(C)OCC(=O)Nc1cc([C@H]2CCCCN2C(=O)CN2C(=O)C=CC2=O)[nH]n1	1819597208	LMQSFHHCNBUVHT-CQSZACIVSA-N	433.541	1.178	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cccs1)CC2	1819795224	KNYISKWIRGGWEX-SNVBAGLBSA-N	442.526	1.743	50	20	IDGD	
C[Si](C)(C)OCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)Cn1ccccc1=O)CC2	1820162807	RKPVKPHWTXLLLG-CYBMUJFWSA-N	434.594	1.769	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc(O)cc2)n[nH]1	1820579902	SXQXPEUWYJNUOV-QGZVFWFLSA-N	428.493	1.794	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](F)Br)n[nH]1	1820934780	AXCYQBRSBLVNCH-SUZMYJTESA-N	447.309	1.800	50	20	IDGD	
CN(C)C(=O)NCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](F)Br)n[nH]1	1820934862	RCNGJMRDERPPEU-MFKMUULPSA-N	433.282	1.364	50	20	IDGD	
NC(=O)c1nccnc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)C(Cl)Cl)CC2	1821042459	IXHLAAPPQKQUCJ-ZCFIWIBFSA-N	429.289	1.062	50	20	IDGD	
C[C@H](Br)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCc2nc(N)n[nH]2)[nH]n1	1822189500	UBNNZYUMAOUUQC-ONGXEEELSA-N	439.318	1.518	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2nc[nH]c2[N+](=O)[O-])[nH]n1	1822367847	BIKIWNPWKFDOFY-MWLCHTKSSA-N	425.833	1.601	50	20	IDGD	
O=C(N[C@@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1)c1c[nH]c(=O)cn1	1823006829	IWSSAPDGXIBVEP-KBUNVGBDSA-N	430.259	1.143	50	20	IDGD	
O=C(O)CSCC(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1	1823014244	RBLAHTDEJFUTHN-KBUNVGBDSA-N	440.316	1.563	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1	1823356633	UWHSKELNYWHGRZ-KGLIPLIRSA-N	443.932	1.916	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)CC2CCC2)n[nH]1	1823430526	XDZMEVFQLDHUMO-KRWDZBQOSA-N	425.493	1.904	50	20	IDGD	
CC[C@H](C)[C@@H](N)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1	1826842866	LNWLXUYPQAJPKY-CWFSZBLJSA-N	444.580	1.292	50	20	IDGD	
Cc1cc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)ccn1	1827058222	SNEYGXBYBGEKKL-JOCHJYFZSA-N	435.333	1.617	50	20	IDGD	
O=C(C1CCC(O)CC1)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827060250	CPGYUYSYTLSCGP-UDJZJCJKSA-N	442.365	1.151	50	20	IDGD	
O=C1NCCCn2nc(C(=O)N3CCC([C@@H]4CCCCN4C(=O)[C@@H](F)Cl)CC3)cc21	1827609997	ZXWNTEYQFSAAKF-DOTOQJQBSA-N	439.919	1.784	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1	1828923854	CPJOFMAJAJKZBW-ZWKOTPCHSA-N	435.956	1.936	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)CC(F)(F)F)CC1	1828925646	OKEGXFNUWAYMCW-INIZCTEOSA-N	441.454	1.871	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)COc3ccc(O)cc3)CCO2)C1	1830345663	CJDKHHADGJMHNW-YLJYHZDGSA-N	426.897	1.245	50	20	IDGD	
Cc1nnc(CCC(=O)N2CCOC[C@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)s1	1830358008	KKPKRPMNUNLYIZ-IBGZPJMESA-N	444.985	1.501	50	20	IDGD	
COc1ncc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)cc1C	1830358558	DQMSNNIUAKHQBI-NRFANRHFSA-N	439.940	1.734	50	20	IDGD	
CC(C)=NO[C@H](C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1	1830419261	NRJJUXVORPECFY-MJGOQNOKSA-N	437.585	1.780	50	20	IDGD	
Cc1onc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)c1C	1830535561	QEYHSXBOUQGOML-KPZWWZAWSA-N	444.326	1.392	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cccs3)C2)C1	1830538345	CFKWQLVTEQCLSH-KSSFIOAISA-N	445.379	1.778	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(F)c[nH]3)C2)C1	1830544387	XBVVZNGFQUANCP-SJKOYZFVSA-N	432.290	1.255	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(F)nc3F)C2)C1	1831640016	WUEUXCQFIBFGHY-KUHUBIRLSA-N	431.867	1.837	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](CC)N(CC)CC)C2)C1	1831640113	IYVNYYFXLKOEMN-BBTUJRGHSA-N	432.005	1.971	50	20	IDGD	
Cc1ncncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1	1831873244	FLCYAZXPVKYVTB-LJQANCHMSA-N	430.553	1.391	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3ccc(Cl)nc3F)CC2)CC1)[C@@H](O)CCl	1833308182	KYKHEOGXEODRGD-HNNXBMFYSA-N	447.338	1.659	50	20	IDGD	
CCc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)cn1	1833893939	SMIXMGBHGSTRTM-KUHUBIRLSA-N	440.338	1.497	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cn(C)nc3OC)CC2)CC1	1834082659	NKTWKZJRJWPJLA-KRWDZBQOSA-N	425.961	1.631	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3ccc(-n4cnnc4)cc3)CC2)CC1)[C@H](F)Cl	1835080472	WGUIPYIMQOZVJF-IBGZPJMESA-N	448.930	1.987	50	20	IDGD	
C[C@H](Oc1ccccn1)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](F)Cl)CC2)CC1	1835082764	DYJORTSVKYGIEH-KBXCAEBGSA-N	426.920	1.955	50	20	IDGD	
O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)CC1CCOCC1)CCO2	1835418326	GKHQAUKOGICDQX-SFHVURJKSA-N	433.343	1.045	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccc(F)cn3)CCO2)C1	1836035780	HOSJXKAPAKLUSL-UGSOOPFHSA-N	444.301	1.003	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)CCN3CCOCC3)CC2)CC1	1836395775	MFKSGZWLMRYRPP-LJQANCHMSA-N	429.005	1.298	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)CNC(=O)C(F)(F)F)CC2)CC1	1836397600	JVUKFIPLGXSEBR-CQSZACIVSA-N	440.894	1.254	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@H](C)N(C)C(C)=O)CC2)CC1	1838106566	AFGBEGDKSVVGOT-KSSFIOAISA-N	431.961	1.106	50	20	IDGD	
N#Cc1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)c1Cl	1838596394	XBXJBTLSBQMMRB-QAPCUYQASA-N	430.263	1.816	50	20	IDGD	
C[C@H](C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2)N1C[C@H]2C[C@H]2C1	1839153101	AZLZZEQMWPJNAG-WVPQZDDBSA-N	448.391	1.019	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc4[nH]c(C)cc4c3)CCO2)C1	1839616647	HHXMNMKTOKUYKT-AVRDEDQJSA-N	449.935	1.800	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(F)cn3)C2)C1	1839963871	ZEAPLYCRRWDKQZ-KSSFIOAISA-N	444.301	1.464	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)c1ccccn1)CCO2	1840504057	FBAGJCPKBKNSMF-ZRGWGRIASA-N	440.338	1.425	50	20	IDGD	
O=C(CCc1ccoc1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1840516451	RGTCXYCONRSEAA-RDJZCZTQSA-N	433.274	1.359	50	20	IDGD	
Cc1nn(C)cc1C(=O)N1CCCC12CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1841716937	IPQMGERWECZVQP-HNNXBMFYSA-N	439.944	1.678	50	20	IDGD	
CN1CCC[C@H]1C(=O)N1CCCC12CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1841769406	MMYOXKIAWNFNGV-GJZGRUSLSA-N	428.961	1.416	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)C2(O)CCN(C(=O)OC(C)(C)C)CC2)C1	1841789860	SZSHGNYXQZVRBR-HNNXBMFYSA-N	443.972	1.969	50	20	IDGD	
O=C([C@@H]1[C@@H]2Sc3ccccc3[C@H]21)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843011632	XSGRJQDTJOAVHO-SLFFLAALSA-N	434.326	1.071	50	20	IDGD	
C=C[C@@H](O)C(C)(C)C(=O)N1CCCC12CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2	1844237783	MSTSCXZMVHVIPT-GOSISDBHSA-N	445.472	1.910	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC2(CCCN2C(=O)[C@@]2(C)CCCN2)C1	1845118644	AINDFFNXFQCZMI-IFXJQAMLSA-N	428.961	1.464	50	20	IDGD	
C[C@H](NC(=O)c1ccccc1)C(=O)N1CC2(CCCN2C(=O)[C@H](F)Br)C1	1845220694	IQJKYYLOIVVZHV-JSGCOSHPSA-N	426.286	1.699	50	20	IDGD	
CS(=O)(=O)CCC(=O)N1CC2(CCCN2C(=O)/C(C#N)=C/c2ccc(F)cc2F)C1	1845871943	IATOYGKXPUHBBB-OQLLNIDSSA-N	437.468	1.510	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cnc(C)[nH]1	1847910995	MMIOHYFWLJAPQG-IRXDYDNUSA-N	427.417	1.681	50	20	IDGD	
Cc1nn(-c2cccc(C(F)(F)F)c2)c(C)c1C(=O)C(=O)NNC(=O)C(=O)NC1CC1	10215256	XNOBWQVBYGVJDM-UHFFFAOYSA-N	437.378	1.117	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN(C)Cc2cc(OC)c(OC)cc2C)cc1OC	24804086	PAHZWLITWZVMLU-UHFFFAOYSA-N	431.489	1.922	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)c1cc(S(=O)(=O)N(CC)CC)cn1C	105261095	GVVITWHNEUQEEF-UHFFFAOYSA-N	436.534	1.458	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCC[C@H](N(C)C(=O)OC(C)(C)C)C2)n1	725813959	SLGSEASKYYPZHO-AWEZNQCLSA-N	425.555	1.473	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)N1CCN(c2ncc(Cl)cc2Cl)CC1	725870256	FDORGEFWQWQEDT-UHFFFAOYSA-N	441.275	1.274	50	20	IDGD	
CCOc1ccc(C(=O)NCC(=O)NNc2nc(-c3ccncc3)no2)cc1OCC	726377152	LXACMSOLAZOTHF-UHFFFAOYSA-N	426.433	1.802	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)on1)Nc1ccc(CN2C(=O)CNC2=O)cc1	726873326	AVBRJHNKOGAUEY-UHFFFAOYSA-N	434.412	1.860	50	20	IDGD	
COc1cccc2c1OC[C@@H](NC(=O)NNC(=O)c1sc(N3CCOCC3)nc1C)C2	728398870	KSIUWTARWFUMOU-AWEZNQCLSA-N	447.517	1.244	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccccc1)NNc1ccc(S(=O)(=O)C(F)F)cc1	728975926	FPOOTDPPODZRMD-UHFFFAOYSA-N	433.458	1.495	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)NCCc2nnc(S)n2C)N(C)c2ccccc21	729255866	HNOAUTBFADZLPA-UHFFFAOYSA-N	425.518	1.433	50	20	IDGD	
CC[C@H](N=c1nn[nH]n1-c1ccccc1)C(=O)NNC(=O)c1cc2c(s1)CC[C@@H](C)C2	729282335	RRHHQZLSRCTYMU-CJNGLKHVSA-N	439.545	1.922	50	20	IDGD	
Cc1c(/C=C(\C#N)C(=O)NCCCCN2CCN(c3ncccn3)CC2)cc(C#N)n1C	729378419	RKIBRMOHSZNEOM-XSFVSMFZSA-N	432.532	1.621	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCCC(=O)NNC(=O)Cn2ccc3ccccc32)cc1C	729448136	FATBDGHAFKQAJH-UHFFFAOYSA-N	428.514	1.774	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccccc2)C1	729450658	KAQYWZUPMBXBAG-GOSISDBHSA-N	440.525	1.890	50	20	IDGD	
CS(=O)(=O)Nc1cccc(CC(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)c1	730284391	KTRKWTOTOOWPNJ-UHFFFAOYSA-N	433.458	1.740	50	20	IDGD	
Cc1ccc(-n2nc(C(=O)NNC(=O)CNC(=O)c3ccco3)c3c2CCC3)c(F)c1	730488233	HQXCAGSYBXOWKT-UHFFFAOYSA-N	425.420	1.593	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCN(c2ccc3c(c2)OCCO3)C1=O)c1ccc([N+](=O)[O-])cc1	730512786	XDKLPEQGKJZBQP-OAHLLOKOSA-N	426.385	1.180	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)c1ccc(S(=O)(=O)N2CCCCCC2)cc1	730782623	QSMBEKYRAGFGNI-UHFFFAOYSA-N	447.513	1.797	50	20	IDGD	
O=C(CNC(=O)c1c(Cl)cccc1[N+](=O)[O-])NNC(=O)Cn1ccc2ccccc21	731052097	FHQDKISSBVOSKF-UHFFFAOYSA-N	429.820	1.780	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCCOc2ccc([N+](=O)[O-])cc2)cc(OC)c1OC	731679572	PCHKJKYLYBRUFW-UHFFFAOYSA-N	434.405	1.644	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)NCCCN1CCN(c2ncccn2)CC1)c1ccccc1	732238562	OAUVQRXPOHAKGK-LJQANCHMSA-N	425.537	1.513	50	20	IDGD	
Cc1ccc(-n2cnnc2SCC(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)cc1	734240757	YJSCRRUWBJNQQP-UHFFFAOYSA-N	449.537	1.523	50	20	IDGD	
CC(=O)N1CCc2ccccc2[C@@H]1CC(=O)NNC(=O)NCCNC(=O)OC(C)(C)C	734242143	VIUYELKXFSBGKD-KRWDZBQOSA-N	433.509	1.378	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNS(=O)(=O)c2ccc3c(c2)COC3)CC1	734807603	XCNSYMVJGPHFPF-UHFFFAOYSA-N	440.522	1.609	50	20	IDGD	
CC(=O)NCc1ccc(C(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)cc1	734826179	ZZARFJUYUZSTLT-UHFFFAOYSA-N	433.509	1.666	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccccc2CNC(=O)NNc2cccc([N+](=O)[O-])c2)CC1	735189997	JWSORZUXYFASML-UHFFFAOYSA-N	448.505	1.357	50	20	IDGD	
COc1cc(-c2noc(CCC(=O)NNC(=O)c3cnn(C)c3)n2)cc(Cl)c1OC	735444179	GDGFTBJWTDBSCQ-UHFFFAOYSA-N	434.840	1.535	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)c2ccc(I)c(Br)c2)cn1	735445855	CLXORNZIJTYEEL-UHFFFAOYSA-N	449.046	1.862	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CSc2nnc(-n3nc(C)cc3C)n2N)cc1C	735979318	IAFWUDHSKGYDQW-UHFFFAOYSA-N	434.551	1.280	50	20	IDGD	
CCCC[C@H](/N=C1/NS(=O)(=O)c2ccccc21)C(=O)NNc1ncnc2[nH]cnc12	740746117	KGOLXLKANONWKP-LBPRGKRZSA-N	428.478	1.094	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)N[C@@H]2[C@H]3CCO[C@@H]3C2(C)C)c2ccccc2c1=O	741426239	QLWPUGNSVMAZGL-NXHRZFHOSA-N	427.505	1.954	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CSc2nnc(-c3ccc(Cl)cc3)n2N)c1	741846555	CQKONIJEMXZHFU-UHFFFAOYSA-N	427.877	1.737	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2cccc(-c3nnnn3C)c2)ccc1OC(C)C	742025387	FMUWCFBTOQCDBB-UHFFFAOYSA-N	446.489	1.296	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)N[C@@H]1CC(=O)N([C@@H]2C[C@H]2c2ccccc2)C1	743508951	VIWTURGORWRGNF-IJEWVQPXSA-N	446.305	1.878	50	20	IDGD	
CCOc1cc([N+](=O)[O-])c(C(=O)OCC(=O)NNC(=O)c2cccc(C)c2)cc1OC	744521699	RWZJKNVCURMRDS-UHFFFAOYSA-N	431.401	1.929	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1cccc(N2CCCC2=O)c1	744622288	ZKVKFBGUUCCPTQ-UHFFFAOYSA-N	444.513	1.591	50	20	IDGD	
COc1ccc(Br)c(C(=O)OCC(=O)NNC(=O)c2cccc(C)c2)c1N	745290650	LUOCCBPWPJFPIZ-UHFFFAOYSA-N	436.262	1.966	50	20	IDGD	
O=C(COC(=O)[C@H]1SCCc2ccccc21)NNC(=O)[C@H]1COc2ccccc2O1	745472209	GYWRVHSZAMXCDU-MJGOQNOKSA-N	428.466	1.548	50	20	IDGD	
COC(C)(C)CNC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	745889272	DXWSDKKTBUGRGD-UHFFFAOYSA-N	434.518	1.534	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)c2cc(S(=O)(=O)N3CCCC3)ccc2O)cc1	745990167	MHHKAZGZQVEPBM-UHFFFAOYSA-N	447.513	1.579	50	20	IDGD	
O=C(NNC(=O)N1CCOCC1)c1ccc(S(=O)(=O)Nc2ccccc2Cl)cc1	745995816	CTXGBFVCXMSPBZ-UHFFFAOYSA-N	438.893	1.827	50	20	IDGD	
COCc1nc(OC)c2c(C)c(C(=O)NNC(=O)Cc3cn4ccccc4n3)sc2n1	746641182	NGTYPPRLJPNPDI-UHFFFAOYSA-N	440.485	1.806	50	20	IDGD	
Cc1cccc(C)c1NCC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	746688159	CTACSQPDEHOHRL-UHFFFAOYSA-N	431.562	1.795	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCCCCC2)cc1C(=O)NNC(=O)Cc1ccncc1	747324514	GTGYJWKDPALSHI-UHFFFAOYSA-N	446.529	1.659	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Cc2ccncc2)cc1S(=O)(=O)N1CCCCCC1	747324800	PHLGZDIIGDEJQF-UHFFFAOYSA-N	446.529	1.659	50	20	IDGD	
CN1CC(=O)N(CC(=O)NNC(=O)c2ccc(COc3ccc(Cl)cc3)cc2)C1=O	747471814	XYOJBTIZHBWMJN-UHFFFAOYSA-N	430.848	1.574	50	20	IDGD	
O=C(C[C@@H]1C=CS(=O)(=O)C1)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1	747786970	GMLVGCYJEHMZJL-GHTZIAJQSA-N	439.537	1.709	50	20	IDGD	
O=C(NNc1ccccc1Br)C1=NN([C@@H]2CCS(=O)(=O)C2)C(=O)CC1	748058652	SVIYEXJFHROTFC-SNVBAGLBSA-N	429.296	1.058	50	20	IDGD	
COc1cc(OC)cc(N2CC[C@@H](NC(=O)NNC(=O)c3ccc(OC)c(OC)c3)C2)c1	748662030	PMHCRTMUAPZROO-OAHLLOKOSA-N	444.488	1.944	50	20	IDGD	
CS(=O)(=O)N1CCC(CNC(=O)NNC(=O)CSc2ccc(Cl)cc2)CC1	749017535	NXAFWUUBXBNSEK-UHFFFAOYSA-N	434.971	1.434	50	20	IDGD	
CNS(=O)(=O)[C@H]1CCN(C(=O)/C(C#N)=C/c2cn(CCC#N)nc2-c2ccccc2)C1	750515935	KFHYPPDDNNDERO-WPNIOXTASA-N	438.513	1.521	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)c1cnc2n1CCCC2	750789096	QONKBHJDOHLZKT-UHFFFAOYSA-N	430.940	1.452	50	20	IDGD	
Cc1cccc(-n2cc(C(=O)NNC(=O)c3sc(N4CCOCC4)nc3C)nn2)c1	751294783	RPTPFPWSPDXWMR-UHFFFAOYSA-N	427.490	1.252	50	20	IDGD	
COc1cc(OC)cc(N2C[C@H](C(=O)NNC(=O)c3cccc(N(C)C)c3)CC2=O)c1	752267544	FJXLWYVYOSNMTN-OAHLLOKOSA-N	426.473	1.584	50	20	IDGD	
CNC(=O)[C@@H](C)NC(=O)/C(C#N)=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	752748418	YZLMRXNQJYUFGQ-ZMTLZGASSA-N	428.880	1.237	50	20	IDGD	
C[C@H](CC(=O)OCc1ccccc1)NC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	753133207	XLMLOCMCRGFUHW-CQSZACIVSA-N	448.501	1.948	50	20	IDGD	
Cc1cnc2c(S(=O)(=O)N3CCN(C(=O)NNC(=O)C4CCCC4)CC3)cccc2c1	753356862	SSBVWIRUYLYNAX-UHFFFAOYSA-N	445.545	1.781	50	20	IDGD	
COC(=O)c1cc2c(cc1NC(=O)C(=O)NNC(=O)c1ccc(Cl)cc1OC)OCO2	753841835	UWHYWKHZXSTZDQ-UHFFFAOYSA-N	449.803	1.264	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1ccccc1S[C@@H](Cl)C(F)(F)F	755612928	FNWJGOBFXJODNQ-WRWORJQWSA-N	448.876	1.996	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NN=Cc3cc(F)cc(F)c3)CC2)cc1	755786819	BVPMUEKMNJHUME-UHFFFAOYSA-N	436.484	1.730	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)Nc1ccc(CN2CCCC2=O)cc1	755940355	SEMVVOUGHQIVKN-UHFFFAOYSA-N	437.504	1.668	50	20	IDGD	
CC(C)CNC(=O)c1ccc(NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1	756016400	YNMRXEJAONMSTH-UHFFFAOYSA-N	432.502	1.942	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2cccc(-c3nccn3C)c2)c1	756363529	GYGNAWZJADVHLO-UHFFFAOYSA-N	442.501	1.804	50	20	IDGD	
CCOC(=O)[C@H](C)NC(=O)c1ccc(NC(=O)NNC(=O)COc2cccc(C)c2)cc1	756792148	ZHFLNULZFDHPHT-HNNXBMFYSA-N	442.472	1.908	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)c1cncc(I)c1	756863058	DWQYUTVOCSXTMB-UHFFFAOYSA-N	427.198	1.535	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)Nc2ccc(-n3ncn(C)c3=O)cc2)o1	757864261	XGWJWALOELJUFB-UHFFFAOYSA-N	427.465	1.472	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)Nc1cnc2c(c1)C[C@H](NC(=O)OC(C)(C)C)CC2	757928734	KKZOXNDKRCGHHL-CYBMUJFWSA-N	429.481	1.962	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)N[C@@H]2CN(C(=O)OC(C)(C)C)C[C@@H]2C#N)cc1C	758752117	LVWQSDMTOXWFQN-GOEBONIOSA-N	444.492	1.331	50	20	IDGD	
O=C(NNc1ncccc1[N+](=O)[O-])C1CCN(S(=O)(=O)c2cccnc2Cl)CC1	759292192	PJCJYYHHABXFSA-UHFFFAOYSA-N	440.869	1.582	50	20	IDGD	
Cn1cnnc1SCC(=O)Nc1cccc(C(=O)NNc2ncccc2[N+](=O)[O-])c1	759297399	NCWGCRRJUXWVDC-UHFFFAOYSA-N	428.434	1.606	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)[C@@H]1CC(=O)N(c2ccc(F)cc2F)C1	760439383	DXDSKGRACSYYHT-LLVKDONJSA-N	426.420	1.380	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cn(C)c(=O)c4ccccc34)CC2)cc1	760447496	DSZPGGPBZRMWJO-UHFFFAOYSA-N	447.539	1.426	50	20	IDGD	
CCOCCOc1ccc(Br)cc1NC(=O)C(=O)NNC(=O)C(C)(C)C	761073270	SWAWXYAYNNBIAI-UHFFFAOYSA-N	430.299	1.996	50	20	IDGD	
Cc1cc(-c2noc([C@H](C)NC(=O)NNC(=O)C(=O)Nc3ccccn3)n2)ccc1F	761789887	FRRSLRBUVCMIJE-NSHDSACASA-N	427.396	1.609	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)C(=O)Nc1cccc(F)c1	763511941	KHKBKVGIVKOOJY-UHFFFAOYSA-N	434.449	1.010	50	20	IDGD	
CCN1CCN(c2ccc(NC(=O)C(=O)NNC(=O)c3c[nH]c4ccccc34)cc2)CC1	763535449	DGWSEBHPLJMVBU-UHFFFAOYSA-N	434.500	1.710	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1ccc(C(N)=O)cc1)C(=O)NNc1c(Cl)cccc1Cl	763610384	FEXAFOORDRBDDM-SECBINFHSA-N	431.301	1.902	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)COc2cccc(C)c2)cc1N1CCOC1=O	763623802	HRXOGQCWOVYJCU-UHFFFAOYSA-N	442.428	1.125	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(OC[C@H]3CCCO3)c2)cc1	763658733	ARGGMEMQXKFKNU-LJQANCHMSA-N	443.456	1.418	50	20	IDGD	
CCCNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)c1	763728968	SKWTYPYUOPAMJH-UHFFFAOYSA-N	437.500	1.365	50	20	IDGD	
CC(C)N(C)c1ccc(NC(=O)C(=O)NNC(=O)c2nnc(O)c3ccccc23)cc1F	763790587	LSJRUNCPNZQVPG-UHFFFAOYSA-N	440.435	1.719	50	20	IDGD	
CC(C)CCn1nc(C(=O)NNC(=O)C(=O)Nc2ccc(C#N)cc2)c2ccccc2c1=O	763844255	YBZZEJFLOTXZKI-UHFFFAOYSA-N	446.467	1.714	50	20	IDGD	
Cc1ccc(C(=O)NC2CC2)cc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccccc1F	763866572	WHVVJMRZAFLHKR-CYBMUJFWSA-N	442.447	1.580	50	20	IDGD	
O=C(CCSc1ccc(F)cc1)NNC(=O)C(=O)Nc1cccnc1-n1cncn1	763895169	LVNFGYHKVSGFDH-UHFFFAOYSA-N	429.437	1.070	50	20	IDGD	
CC(C)(C)Oc1cc(F)ccc1NC(=O)C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	763916588	HDXJTHDIRNQJPG-UHFFFAOYSA-N	441.423	1.378	50	20	IDGD	
CC(C)c1nc2cc(NC(=O)C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)ccc2o1	763921804	PAMGNTWIUADQQA-UHFFFAOYSA-N	434.416	1.327	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3ccc4c(c3)C(=O)NCC4)cc2C1	763939346	DAPYZKMABMAMDT-NSHDSACASA-N	426.498	1.559	50	20	IDGD	
O=C(NNC(=O)c1cc2c(s1)CCCCC2)C(=O)Nc1cnn(C[C@@H]2CCCO2)c1	763961484	GHJFJEAFCFDNLK-HNNXBMFYSA-N	431.518	1.792	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)C(=O)Nc1ccc(C(=O)NCc2ccccc2F)cc1	763992766	ILMVZTGWLXNUFU-UHFFFAOYSA-N	437.431	1.494	50	20	IDGD	
CCCN1Cc2cccc(NC(=O)C(=O)NNC(=O)c3cc(Br)c[nH]3)c2C1	763995995	SVVLITMNJJEDRM-UHFFFAOYSA-N	434.294	1.903	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1ccc(N2CCOC[C@H]2C)cc1	764012467	RTCCVHWHZKKTPK-CYBMUJFWSA-N	446.891	1.973	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)on2)c(F)cc1F	764016910	PRRARDQNHKFNGD-UHFFFAOYSA-N	444.350	1.806	50	20	IDGD	
CC[C@@H](C)C(=O)NNC(=O)C(=O)Nc1cc(F)c(F)cc1I	764085169	ZVYLMUDUTXBNHP-ZCFIWIBFSA-N	425.173	1.701	50	20	IDGD	
CS(=O)(=O)CCc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)cc1	764125367	VRXKXZOUMQPKDK-UHFFFAOYSA-N	439.877	1.032	50	20	IDGD	
Cc1ccc(C(=O)N2CCSCC2)cc1NC(=O)C(=O)NNC(=O)CCc1ccco1	764169720	RCNWKOOSHCJNCU-UHFFFAOYSA-N	444.513	1.496	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CC(C)(C)C)cc1S(=O)(=O)N1CCCCC1	764201917	HNCAOPRPZYIFJV-UHFFFAOYSA-N	438.550	1.692	50	20	IDGD	
CNC(=O)Cn1ccc2ccc(NC(=O)C(=O)NNC(=O)Cn3ccc4ccccc43)cc21	764239069	DAGNSKADPGLISN-UHFFFAOYSA-N	446.467	1.128	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)C(=O)Nc1ccc(S(=O)(=O)C(F)F)cc1	764289506	VRJXCBSVJBGNKW-UHFFFAOYSA-N	441.412	1.107	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)C(=O)Nc1cccc(S(=O)(=O)NC)c1C)c1ccccc1	764330805	YHBWBHMOWHVIDY-OAHLLOKOSA-N	432.502	1.183	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)C(=O)Nc1ccc(C(=O)NC2CC2)cc1	764394222	PXDLZIXHZOMFCZ-UHFFFAOYSA-N	428.470	1.163	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1cccc(C#N)c1)C(=O)NNC(=O)c1c(Cl)cccc1Cl	765413526	ZRSIXDGVZGTTKV-SNVBAGLBSA-N	441.296	1.993	50	20	IDGD	
O=C(NCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNc1ncnc2ccsc12	765632127	XSSSFDWGFUARAU-UHFFFAOYSA-N	448.530	1.539	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)[C@H](C)c3ccc(C)o3)CC2)cc1	765730098	TZILBQWAIDVKCV-QGZVFWFLSA-N	448.545	1.154	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)CSc3nncn3C(C)C)CC2)cc1	766640376	GCVMPRDRSGMHGV-UHFFFAOYSA-N	445.593	1.225	50	20	IDGD	
CC(=O)Nc1cc(NC(C)=O)cc(C(=O)OCC(=O)NNC(=O)Cc2ccccc2C)c1	767276501	YEZSBJOFLVCZCA-UHFFFAOYSA-N	440.456	1.459	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NN=Cc1cncs1)N(S(C)(=O)=O)CC2	767766878	YRQDFKRLOQVZIY-OAHLLOKOSA-N	438.531	1.560	50	20	IDGD	
CC(C)(C)OCc1cc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)no1	770244095	GYOVPVPQBJLBHC-UHFFFAOYSA-N	443.504	1.209	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccnn1-c1cccc(F)c1	770775230	XWYKJEVNMZECKJ-UHFFFAOYSA-N	427.392	1.185	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(C)(C)N2C(=O)c3ccccc3C2=O)o1	771267914	XMSAAMKCQZNEQR-UHFFFAOYSA-N	426.473	1.957	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc2nc(Cl)sc2c1)c1ccc(-n2cnnn2)cc1	772861138	KYWKJEIHPCWWOC-UHFFFAOYSA-N	435.878	1.549	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H]1CCC[C@H]1C(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772888874	NIQONUYYEHCROE-CABCVRRESA-N	438.912	1.797	50	20	IDGD	
O=C(NNC(=O)N1CCS(=O)(=O)c2ccccc2C1)c1cccc(OC(F)F)c1	773274792	WYVMVIIWTXQRPE-UHFFFAOYSA-N	425.413	1.932	50	20	IDGD	
Cc1nc2ncnn2c(C)c1CCC(=O)NNC(=O)[C@H]1CCCN(C(=O)OC(C)(C)C)C1	773413151	GUJZBDHNFWAGKK-HNNXBMFYSA-N	445.524	1.468	50	20	IDGD	
CCC(CC)[C@@H](C(=O)NNC(=O)[C@H]1CCCN(C(=O)OC(C)(C)C)C1)N1CCOCC1	773413737	IVBWACMENGACER-ROUUACIJSA-N	440.585	1.918	50	20	IDGD	
C[C@H](NCC(=O)NNC(=O)c1ccc(F)cc1)c1ccc(OCC(=O)NC2CC2)cc1	774964184	SBECQBYFEQITJH-AWEZNQCLSA-N	428.464	1.595	50	20	IDGD	
O=C(NNC(=O)c1cnccn1)Nc1ccc(OCCN2C(=O)c3ccccc3C2=O)cc1	775872951	YLGBQGBXWRMILP-UHFFFAOYSA-N	446.423	1.618	50	20	IDGD	
CC(C)(C)NC(=O)CN1CCC(CNC(=O)NNc2cccc(S(C)(=O)=O)c2)CC1	776626831	ATFFMVVVIUJTJE-UHFFFAOYSA-N	439.582	1.343	50	20	IDGD	
Cc1nnc(-c2ccc(C(=O)N3CCN(S(=O)(=O)CBr)CC3)cc2)o1	777779312	JHWXBAUQLHPXHM-UHFFFAOYSA-N	429.296	1.485	50	20	IDGD	
CC[C@H](C)n1nc(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)cc1C	778392335	LYHHCIXWLZLGRG-HNNXBMFYSA-N	434.566	1.856	50	20	IDGD	
COc1cc(Br)c(F)cc1S(=O)(=O)NNC(=O)c1cccc(OC)c1O	779833114	ANHVHUBNCXNNER-UHFFFAOYSA-N	449.254	1.934	50	20	IDGD	
COc1cccc(NNC(=O)[C@H]2CCCCN2S(=O)(=O)c2ccc([N+](=O)[O-])cc2)n1	780771862	FKVFYFQCHKGGDX-OAHLLOKOSA-N	435.462	1.685	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COc2ccc(Br)cc2)cc1-n1cnnn1	781559788	SEMGGFYTGDMDCQ-UHFFFAOYSA-N	447.249	1.273	50	20	IDGD	
O=C(CN1CCC[C@@H](S(=O)(=O)NC2CCCC2)C1)NNC(=O)c1ccccc1Cl	782056361	SJBXBALJMMIZNG-OAHLLOKOSA-N	442.969	1.427	50	20	IDGD	
CN1C(=O)COc2ccc(NC(=O)C(=O)NNC(=O)c3ccc(Cl)cc3Cl)cc21	782925108	GIMQVFWQAVZIOB-UHFFFAOYSA-N	437.239	1.748	50	20	IDGD	
O=C(NNC(=O)C(=O)NC1CC1)C(=O)Nc1ccc(Oc2ccnc3ccccc23)cc1	782965757	JUHGMOBBGVFMCP-UHFFFAOYSA-N	433.424	1.392	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)N2C[C@H](C(=O)N3CCCCC3)Oc3ccccc32)nc(C)n1	783324338	HVQVTYKNXAIEJC-GOSISDBHSA-N	438.488	1.343	50	20	IDGD	
CC(=NNC(=O)CNC(=O)c1cccnc1)[C@H]1CN(C(=O)OCc2ccccc2)CCO1	783854141	MMOMVBMZVDIOBS-LJQANCHMSA-N	439.472	1.341	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCCN(c2ncccc2F)CC1	784399883	GNYZYERAWDJBEV-UHFFFAOYSA-N	435.887	1.856	50	20	IDGD	
CO[C@@H]1Cc2ccc(NC(=O)C(=O)NNc3ccc(S(=O)(=O)C(F)F)cc3)cc2C1	784833597	OKHXWUCQVYHRAH-OAHLLOKOSA-N	439.440	1.878	50	20	IDGD	
Cc1cc(Oc2ncccn2)ccc1NC(=O)C(=O)NNC(=O)Cc1cn2ccccc2n1	785060637	ITOFDILZPXTRQO-UHFFFAOYSA-N	445.439	1.554	50	20	IDGD	
CC(=O)N1CC(C(=O)NNC(=O)c2cccc(S(=O)(=O)Nc3ccc(C)cc3C)c2)C1	788493897	YCDHQEUNLLIBMO-UHFFFAOYSA-N	444.513	1.344	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)[C@H]1CC12CN(C(=O)OC(C)(C)C)C2	789182316	LPRFHNYFCSQITF-GFCCVEGCSA-N	427.502	1.099	50	20	IDGD	
O=C(CNS(=O)(=O)c1cccc(F)c1)NNC(=O)c1cc2c(s1)CCCCC2	789721613	IRMIJAPWMCPGFQ-UHFFFAOYSA-N	425.507	1.896	50	20	IDGD	
CCNC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)COc2ccccc2F)c1C	789732334	PGGRLQADBADXNP-UHFFFAOYSA-N	431.424	1.440	50	20	IDGD	
CC(C)Oc1cc(NC(=O)C(=O)NNC(=O)CCOc2ccccc2)ccc1C(N)=O	789735988	XLWNUYXHPFLFCK-UHFFFAOYSA-N	428.445	1.128	50	20	IDGD	
Cc1cc2nc(C)c(CCC(=O)NNC(=O)c3nn(-c4ccccc4)cc3O)c(C)n2n1	789852599	HGTLECWEXXVXHM-UHFFFAOYSA-N	433.472	1.940	50	20	IDGD	
C[C@]1(C2CC2)NC(=O)N(c2ccc(CNC(=O)NNC(=O)Cc3ccncc3)cc2)C1=O	790893798	CHKGAKBALSMDDE-JOCHJYFZSA-N	436.472	1.380	50	20	IDGD	
COC[C@@H](C)n1c(C)cc(/C=C(\C#N)C(=O)N2CCN(C(=O)C(=O)NC(C)C)CC2)c1C	790903407	CRNJABCGCWWTSN-XNHPLOEXSA-N	443.548	1.415	50	20	IDGD	
O=C(NNc1nc2ccccn2n1)C1CCN(S(=O)(=O)/C=C\c2ccccc2)CC1	791248014	GTRDHXOWQUTJAP-PTNGSMBKSA-N	426.502	1.885	50	20	IDGD	
COc1cc(C(F)(F)F)ncc1NC(=O)C(=O)NNC(=O)c1ccc2c(c1)OCCO2	792268955	MWUYIARRTXMHIL-UHFFFAOYSA-N	440.334	1.280	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNc2ccc(-n3cccn3)nn2)cc(Cl)c1F	792278301	SSXLTXYMSQBJKO-UHFFFAOYSA-N	433.787	1.323	50	20	IDGD	
O=C(NNc1nc2ccccn2n1)C(=O)Nc1ccc2c(c1)CCC(=O)N2CC(F)(F)F	792391986	NYXMTCGQVRCPNV-UHFFFAOYSA-N	447.377	1.653	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNC(=O)c1ccc2c(O)nc(S)nc2c1	795658990	QIYAGSRTDGSBDF-UHFFFAOYSA-N	427.442	1.312	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc(Br)cnc2N(C)C)cc1C	798308109	PTEOYEAJFQZBJV-UHFFFAOYSA-N	434.294	1.927	50	20	IDGD	
CCn1ncc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c1C(F)(F)F	799259084	NSSGHJPWSIBYNQ-UHFFFAOYSA-N	435.366	1.507	50	20	IDGD	
COc1ncc(NS(=O)(=O)c2ccc(OCCBr)cc2)cc1C(N)=O	799536942	KKOAUCPXEPLMLP-UHFFFAOYSA-N	430.280	1.764	50	20	IDGD	
Cn1c(=O)ccn(CC(=O)NNc2c(Br)cccc2Br)c1=O	801505145	OEQHCTDVOWZMMP-UHFFFAOYSA-N	432.072	1.215	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1cccs1)C(=O)NNC(=O)Nc1ccc(OC(F)F)cc1	802043639	KSXYWIVCYOWXBV-SECBINFHSA-N	434.446	1.869	50	20	IDGD	
C[C@H](CCNS(=O)(=O)c1ccccc1)NC(=O)NNc1cccc(S(C)(=O)=O)c1	802527708	KJVMNVYIQLKVSE-CQSZACIVSA-N	440.547	1.473	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)CSc1nnc2ccccn12	802654486	KANIGBWPYZFHTJ-UHFFFAOYSA-N	436.291	1.810	50	20	IDGD	
O=C(NNc1ccc2c(=O)[nH]ccc2c1)[C@@H]1CN(Cc2nc(O)c3ccccc3n2)CCO1	803432132	KGAKWBDMVARSAG-IBGZPJMESA-N	446.467	1.521	50	20	IDGD	
CSCC[C@@H](C(=O)NNc1ccc(-n2ccnc2)nn1)N1C(=O)c2ccccc2C1=O	804956885	HSNDEQGIRUVYLR-HNNXBMFYSA-N	437.485	1.523	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)NC[C@H](N1CCOCC1)C(F)(F)F	805369486	YKPPQWRUXQHSEQ-RISCZKNCSA-N	438.834	1.701	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(F)c(C(C)=O)c2)cc1	806975353	UWYKRBRKZZIIHV-ZDUSSCGKSA-N	431.420	1.980	50	20	IDGD	
COCc1cnc(NC(=O)C(=O)NNC(=O)c2ccc(COc3ccccc3)o2)s1	806975474	ADCZQXMBALVIGY-UHFFFAOYSA-N	430.442	1.861	50	20	IDGD	
CC(=O)c1cccc(S(=O)(=O)NCC(=O)NNC(=O)c2ccc(Cl)cc2F)c1	810468834	XMJNATRJTZPDKX-UHFFFAOYSA-N	427.841	1.421	50	20	IDGD	
CC(C)CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)NNc1nc(Br)cn2ccnc12	810485149	WLIKXHYNGPJOSV-GFCCVEGCSA-N	449.313	1.432	50	20	IDGD	
COc1ccccc1N1C[C@@H](C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)CC1=O	812730482	KQNSRRUJAOZVRV-AWEZNQCLSA-N	432.502	1.442	50	20	IDGD	
CCC(=O)Nc1ccc(C)c(NC(=O)C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)c1	813033309	NBHZJCNDANVVLZ-UHFFFAOYSA-N	447.517	1.676	50	20	IDGD	
Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	813033686	GQIVPYRVACPTOH-UHFFFAOYSA-N	435.462	1.544	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)c2c(I)cnn2C)c1	814103477	NGRZYCXFNPHMNX-UHFFFAOYSA-N	430.202	1.117	50	20	IDGD	
CN(C)c1cc(Br)cc(C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c1	814364561	HJSVVVMYQJOILH-UHFFFAOYSA-N	444.289	1.837	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCc2cncn2C1)c1ccccc1NS(=O)(=O)c1cccs1	816830925	ZFGQMVLBTPZOJR-ZDUSSCGKSA-N	445.526	1.769	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)CN(C)C(=O)[C@H](C)n2cccn2)c1	818750387	JAFDORPDBXBLMJ-NSHDSACASA-N	438.282	1.595	50	20	IDGD	
CC(=O)N(C)CC(=O)NNC(=O)c1ccc(CN(C)S(=O)(=O)c2ccc(C)cc2)cc1	914747897	SYXMHQKIGBGQIH-UHFFFAOYSA-N	446.529	1.055	50	20	IDGD	
CCNC(=O)COc1ccc(C=NNC(=O)c2csc(N3CCOCC3)n2)cc1OC	916337555	KADIWYOQABUCKY-UHFFFAOYSA-N	447.517	1.267	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NC[C@@H]2CCN(CC(F)(F)F)C2)nc1	916577752	FIURURACSHVXGA-LBPRGKRZSA-N	438.476	1.279	50	20	IDGD	
COc1cc(CNC(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)ccc1OCC(N)=O	916640298	CJBOOQOZPBEQMA-HNNXBMFYSA-N	444.488	1.474	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)C(C)(C)C)CC2)o1	917180743	UDAFWAMXHZJRCV-UHFFFAOYSA-N	429.495	1.051	50	20	IDGD	
CN(C)S(=O)(=O)c1c[nH]c(C(=O)NNC(=O)c2ccc(F)cc2Br)c1	918342254	TUIQNYXKOACXNO-UHFFFAOYSA-N	433.259	1.241	50	20	IDGD	
Cn1c(=O)c2cc(C(=O)NNC(=O)c3cc4c(s3)CCCCCC4)n(C)c2n(C)c1=O	919692108	CIGBPCVGAZFEDB-UHFFFAOYSA-N	443.529	1.371	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1ccccc1OCc1ccc(Cl)cc1	920297605	KDXNRBOYXWOLOB-LBPRGKRZSA-N	425.894	1.618	50	20	IDGD	
O=C(CN1CCCC1=O)NNC(=O)[C@@H]1CCCN(C(=O)c2ccc(Cl)c(Cl)c2)C1	920436085	VPLGKSSLOPOVGM-CYBMUJFWSA-N	441.315	1.615	50	20	IDGD	
COc1ccc(C)cc1-n1ccc(C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)n1	920878333	HXFMMIAZWOIQML-UHFFFAOYSA-N	428.470	1.668	50	20	IDGD	
CCN(CC)C[C@@H](C)NC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	921121728	PDXGVGWQOJMJJS-OAHLLOKOSA-N	425.555	1.145	50	20	IDGD	
O=C(NNC(=O)c1n[nH]c2c1CCCC2)c1ccc(Br)cc1-n1cncn1	1323054340	YJLUDYNQDOTXBT-UHFFFAOYSA-N	430.266	1.707	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@@H]2COc3ccc(F)cc3C2)cc1	1323110422	AXMZICOMFFUPEM-HNNXBMFYSA-N	435.477	1.153	50	20	IDGD	
Cc1c(C(=O)NNc2nccn(C)c2=O)nnn1C1CCN(C(=O)OC(C)(C)C)CC1	1330776686	IRSLFUXPINDPSF-UHFFFAOYSA-N	432.485	1.009	50	20	IDGD	
CSC[C@@H](C)C(=O)N1CCC(C(=O)NNC(=O)c2nnc(O)c3ccccc23)CC1	1344573397	BHSBUZLSNUVGQJ-GFCCVEGCSA-N	431.518	1.334	50	20	IDGD	
CC[C@H](C)CC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1	1779371086	BTJNKKJYKLSOAA-QXATTWAWSA-N	431.537	1.249	50	20	IDGD	
Cc1cc(CC(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](C)Br)C3)n[nH]1	1779463979	KQQIQHMDMWGDTD-DDUZABMNSA-N	427.343	1.558	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(OC)n(C)n3)C2)C1	1780436341	PCQGOEKALZUABZ-SJKOYZFVSA-N	429.315	1.046	50	20	IDGD	
COc1cccc(OC)c1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](C)Br)CCO2	1780541879	KYVSMZDVRSUPLQ-ORAYPTAESA-N	441.322	1.931	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)[C@@H](N)Cc3cscn3)CCO2)C1	1781227042	FXTREVNTVKFDJV-RRQGHBQHSA-N	435.377	1.079	50	20	IDGD	
C[C@@H](CC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2)Oc1ccccc1	1781602425	WPIGHJBNSRSKNO-OSGXGRJZSA-N	438.952	1.958	50	20	IDGD	
COC(=O)C1(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](C)CBr)C3)CC1	1781811375	ZLZKNKUYCOEMON-PMUMKWKESA-N	445.354	1.485	50	20	IDGD	
O=C(c1c(F)ccc(O)c1F)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1781932392	NKLKZXDWZLZSCI-CJNGLKHVSA-N	437.212	1.804	50	20	IDGD	
CC(=O)NC(C)(C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)Br)C1	1781997410	VABFSEFIKCCHPZ-RVZJWNSFSA-N	432.359	1.198	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(CO)o1)C2	1781997749	HCMOORMOCVHXIN-CDHAZOANSA-N	429.311	1.683	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cccc4ccnn34)C2)C1	1782228825	WYWRVFWLWMCWQJ-BEFAXECRSA-N	435.322	1.951	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](O)Cc3ccccc3)C2)C1	1783335824	CTPFGXYTPKCKMR-OXFYSEKESA-N	439.350	1.451	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)CCc3ccc(OC)cc3F)CCO2)C1	1783874508	ICCAGJUKAWATEJ-LAUBAEHRSA-N	442.915	1.851	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cc4ccc(OC)cc4[nH]3)CCO2)C1	1783875194	OSEYRCGUZXUQRE-IERDGZPVSA-N	435.908	1.874	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)Cc3cc(F)ccc3OC)CCO2)C1	1783878314	CWMBJAIAWWVQDL-UZLBHIALSA-N	428.888	1.461	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H]1CCN1C(=O)OC(C)(C)C)CCO2	1783882255	XAMSFKFQBAAPHL-SXGZJXTBSA-N	445.944	1.080	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](C)S)C2)C1	1783899861	WUCYCXJNTZEQPD-CWTRNNRKSA-N	437.474	1.282	50	20	IDGD	
O=C(c1cc(Cl)c2nncn2c1)N1CCO[C@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783946840	VACSWYICUMKSKF-INIZCTEOSA-N	432.695	1.630	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)CCc3cccc(O)c3)C2)C1	1784127169	OBXASTDWFKBESW-KUHUBIRLSA-N	425.323	1.938	50	20	IDGD	
CC[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CO[Si](C)(C)C)C[C@@H]21)N(CC)CC	1784626396	DJMUDNLHBZLOKN-OKYOBFRVSA-N	427.662	1.938	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3cncc(OC)c3)[C@H]2C1	1785269296	WJOLEYICPOZFOU-KANFNMMFSA-N	439.940	1.256	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CNC(=O)c3cccs3)[C@H]2C1	1785330850	WWMCLNHMTGWBFA-KKUMJFAQSA-N	441.981	1.723	50	20	IDGD	
CN(C)c1cncc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCBr)C[C@@H]32)c1	1785552834	MNPRADXQBWGCEK-JQFCIGGWSA-N	439.354	1.526	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(O)nc(Cl)c3)[C@H]2C1	1785694725	XHIVYJKMNBUYBP-PYJNHQTQSA-N	432.304	1.288	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc(C)cn3)[C@H]2C1	1785990769	CMQVUIAJAHTRJP-AYDFFVQHSA-N	425.327	1.552	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]3C2)C1	1787447106	LEYFJFWSNFWMTP-QXKUPLGCSA-N	447.935	1.758	50	20	IDGD	
Cc1nnsc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)CBr)C[C@@H]21	1787630140	WISQSODXZKKPND-IXOXFDKPSA-N	431.356	1.471	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnn4c(C)cc(C)nc34)[C@H]2C1	1787910375	UVOWCXPZQQEFGG-DKIMLUQUSA-N	449.939	1.193	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3n[nH]c4c3CC[C@H]4C)[C@H]2C1	1787953309	PDPFCHZKWQQROF-SQLGEJSKSA-N	439.354	1.836	50	20	IDGD	
O=C(CCc1ncc[nH]1)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1	1788149479	XJDGTWFSHQTFAP-UHFFFAOYSA-N	432.289	1.470	50	20	IDGD	
C/C(=C\c1ccc(C)o1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]21	1788688641	ZTLKBLBHCVGHCI-LWLDRSOZSA-N	446.548	1.344	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(=O)nc4cccnn34)[C@H]2C1	1789197799	GTMRFICALKHKIH-JKQORVJESA-N	447.923	1.090	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CC(c4ccccc4)=NN3)C[C@@H]21	1789865274	OVZFOJYNHLMZNA-GCLMUHHRSA-N	432.952	1.750	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnn4cccc(F)c34)C[C@@H]21)C(Cl)Cl	1791296386	QZCIZYJTNXCQDJ-JKOKRWQUSA-N	429.279	1.870	50	20	IDGD	
CC(C)(CCl)C(=O)NC1(c2ccc(NC(=O)CN(CCO)CCO)cc2)CCC1	1791323819	GEEGDGVSDFUVGV-UHFFFAOYSA-N	425.957	1.672	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CSc1ccncc1)C2	1792868808	QBMMPFVPZNRXJN-VWPFQQQWSA-N	442.379	1.794	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CC(C)C	1795102308	KFVYKWGIRWIJNA-YVWYUNDQSA-N	433.461	1.769	50	20	IDGD	
O=C(C[C@H]1OCCc2ccccc21)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1	1796187929	MOBINXXZLMWSKF-ADYITMSISA-N	448.328	1.322	50	20	IDGD	
O=C(CCc1c[nH]c2ncccc12)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1	1796189541	ACAWFJCDGNPDJS-ACDBMABISA-N	446.316	1.127	50	20	IDGD	
C[C@@H](Sc1ccccc1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1	1796190077	UNULQGPCPHLVIG-GEALJGNFSA-N	438.358	1.799	50	20	IDGD	
Cn1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Br)C3)c(C(F)F)n1	1796702749	VCEIVHHJMHYTNR-NUODRBITSA-N	439.232	1.251	50	20	IDGD	
CCn1nccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C(C)=N/NC(=O)c1ccc[nH]1	1796889761	GFTHNELBSOHNBF-BDHJUDLHSA-N	425.493	1.289	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1n[nH]c2ccc(F)cc12	1797480872	LMDQXMSVTLMZFZ-NWIKQPOISA-N	443.248	1.596	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1(C(F)(F)F)CC1	1797887300	DLVKVNDQELWEKA-ZSBIGDGJSA-N	425.411	1.279	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1n[nH]c2c1CCc1ncccc1-2)[C@H](O)CCl	1799164982	HACVLZYWHAAMMQ-IPJQOSJUSA-N	429.908	1.422	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C[C@@H](N)c1cccnc1)C2	1799275039	LTTBBJMGLRMUGM-VLKZTRAZSA-N	429.348	1.297	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnn3cccnc13)C2	1800640931	MKJNSFLXAZGLDT-NEBZKDRISA-N	436.310	1.106	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1c(F)cccc1F)C2	1800760220	JBXOZQSTCBTFIO-YXPOGWMNSA-N	431.277	1.880	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1n[nH]c3cccc(F)c13)C2	1800761969	KUVIBNJAPSZUAP-ZVXAKGHKSA-N	439.285	1.689	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2	1801293938	UVMILHJOFXLWNF-GNUOBCGASA-N	447.492	1.320	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)c1ccc(F)cc1C(F)(F)F	1801852262	QQKIJSNYZUXMHT-OWLDWWDNSA-N	438.805	1.647	50	20	IDGD	
CCOc1ncccc1C(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1	1802314116	PZUMVGNVOIYIRO-SZMVWBNQSA-N	432.908	1.795	50	20	IDGD	
O=C(CCBr)NC[C@H]1CCN(C(=O)Cn2ccccc2=O)[C@@H]1c1cccnc1	1806340249	ASABJFKFGKLEQN-OXQOHEQNSA-N	447.333	1.734	50	20	IDGD	
CC(C)CNC(=O)C(=O)N1CC[C@@H](CNC(=O)CCBr)[C@@H]1c1cccnc1	1806340602	HLJDOPRDSOICLG-RDJZCZTQSA-N	439.354	1.645	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)Cc2ccccc2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1	1807371472	VLYGAKIGGCCTIZ-XUZZJYLKSA-N	443.312	1.324	50	20	IDGD	
O=C1CC[C@@H](C(=O)N2CC[C@H](CNC(=O)[C@@H](F)Br)[C@H]2c2cccnc2)N1	1808662277	XHPZADGMAVQGGP-AYRXBEOTSA-N	427.274	1.057	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)CO[Si](C)(C)C)[C@@H]1c1cccnc1	1810237553	ZVFXGFNPIWORHV-HHXXYDBFSA-N	449.628	1.647	50	20	IDGD	
CCOC(=O)c1cc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)[C@H](O)CCl)n[nH]2)ccn1	1814873537	PCVGFAOYJFJSBT-JKSUJKDBSA-N	449.895	1.887	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1cscn1	1816486022	HCKSMTBVZPEQDX-MRXNPFEDSA-N	425.279	1.166	50	20	IDGD	
CC[C@H](C)[C@@H](N)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819402119	NWZOVJBKADKOOH-ULFGMLNVSA-N	442.524	1.088	50	20	IDGD	
O=C1C[C@H](C(=O)N2CCCC[C@@H]2c2cc(NC(=O)[C@@H](F)Br)n[nH]2)CCN1	1820936926	IFWZZGZUGQNFGG-GLXFQSAKSA-N	430.278	1.619	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H]2CCCS2(=O)=O)n[nH]1	1821835704	JUDLVENDQQJUDM-UBHSHLNASA-N	432.930	1.233	50	20	IDGD	
CN1C(=O)CC[C@H]1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@](C)(Cl)CCl)CC2	1823051896	TXZJILQGMZGCAH-LTHLMHMASA-N	433.361	1.912	50	20	IDGD	
O=C(c1c(O)cc(O)cc1O)N1CCC([C@H]2CCCCN2C(=O)[C@@H](O)CCl)CC1	1824188059	MTRVJICJELGHAX-PBHICJAKSA-N	426.897	1.636	50	20	IDGD	
CCS(=O)(=O)CC(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H](C)Br)CC1	1824468650	FMHGZULQRRGGRM-DZGCQCFKSA-N	437.400	1.824	50	20	IDGD	
Cc1cnc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)s1	1825692821	SPFFPQVRSMKMPI-LJQANCHMSA-N	441.362	1.678	50	20	IDGD	
CNc1nsnc1C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](Cl)COC)sc2C1	1825991304	IRFXUTMCCIXQCG-YUMQZZPRSA-N	430.943	1.516	50	20	IDGD	
O=C(Cc1cccc([N+](=O)[O-])c1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1829622355	UGRSPKASNJMKKM-AEFFLSMTSA-N	429.832	1.128	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(O)cc2)CC1	1830045307	FJFHWOBTUODTHB-HXUWFJFHSA-N	430.549	1.999	50	20	IDGD	
Cc1ccn2ncc(C(=O)N3CCOC[C@]4(C3)CN(C(=O)C(C)(C)CCl)CCO4)c2c1	1830357969	NVTBKUJOIYGOTH-QFIPXVFZSA-N	448.951	1.978	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2CCCO2)CC1	1831620954	LAIKEDZYPHZXGP-TZPGLHDLSA-N	443.548	1.919	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)C[C@@H]2CCCCO2)CC1	1831871665	WAOMKGBDJDENHV-VQTJNVASSA-N	436.597	1.938	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(F)s3)CCO2)C1	1833218265	ASECJRZBVPZKJJ-BDJLRTHQSA-N	435.315	1.741	50	20	IDGD	
Cn1ccc(C(=O)NC2CCN(C3CCN(C(=O)CCBr)CC3)CC2)n1	1834216089	HORSZHSAMYCZQH-UHFFFAOYSA-N	426.359	1.390	50	20	IDGD	
C=CC(=O)N[C@@H](C)C(=O)NC1CCN(C2CCN(C(=O)[C@](C)(Cl)CCl)CC2)CC1	1835833102	VJGYVYXSTXHACF-VBKZILBWSA-N	447.407	1.485	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(CO)o3)CCO2)C1	1837971767	HRNVXYJICFUSTK-KDOFPFPSSA-N	445.310	1.015	50	20	IDGD	
CCc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@](C)(Cl)CCl)C3)C2)n(C)n1	1838044855	HICFQZLLRSWJCB-MOPGFXCFSA-N	447.363	1.289	50	20	IDGD	
O=C(Cc1ccc2ncnn2c1)N1CCC(OC2CCN(C(=O)[C@@H](F)Cl)CC2)CC1	1838084250	RZKKEPYVOCDHSS-LJQANCHMSA-N	437.903	1.805	50	20	IDGD	
O=C([C@H](F)Cl)N1CCOC[C@@]2(C1)CN(C(=O)C1(c3ccc(F)c(F)c3)CC1)CCO2	1839042474	YMBJRJXHOXWKSM-QFBILLFUSA-N	446.853	1.987	50	20	IDGD	
Cc1nc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)ccc1F	1839197632	CMZCHYQJMQBSIS-PBHICJAKSA-N	448.264	1.290	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(F)c(C)c3)CCO2)C1	1839321753	SBCJIPYEYVWGRS-UZLBHIALSA-N	428.888	1.458	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccnc(F)c3)C2)C1	1839962919	VHYQNMWHJJGBBX-KSSFIOAISA-N	444.301	1.464	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(C#N)c[nH]3)C2)C1	1839966004	RICAWWVSCCSEJC-RDTXWAMCSA-N	439.310	1.130	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc([N+](=O)[O-])o3)C2)C1	1840029374	BYRLXFSIDNUOFT-BZNIZROVSA-N	446.254	1.041	50	20	IDGD	
Cc1cnc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)s1	1840031183	HYZOISXQYOWWOK-MLGOLLRUSA-N	432.340	1.305	50	20	IDGD	
O=C(c1c(F)ccnc1Cl)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840186347	KCWXOGHBMOIENU-INIZCTEOSA-N	440.686	1.748	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CCc3nc[nH]c3C1)CCO2	1840361259	URXLBSNHHPKZBC-QYWGDWMGSA-N	438.956	1.379	50	20	IDGD	
Cc1cccc(C)c1N1C[C@@H](C(=O)N2CC3(CCCN3C(=O)[C@@H](O)CCl)C2)CC1=O	1841350327	VNZSXBLQTNEYCM-IRXDYDNUSA-N	433.936	1.459	50	20	IDGD	
Cn1cc(NC(=O)OC(C)(C)C)cc1C(=O)N1CCCC12CN(C(=O)[C@H](O)CCl)C2	1842233822	NZKOGXWEJFZNIA-OAHLLOKOSA-N	440.928	1.789	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1cccc(F)c1Cl)C2	1844264774	GTDFHTYTNLERTJ-UHFFFAOYSA-N	431.855	1.608	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)c1cc(F)c(F)c(Cl)c1)C2	1846386216	OBROUQLGUYXOAG-UHFFFAOYSA-N	428.867	1.808	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)C(=O)NC1CC1	9889474	LGKZLNPGZMOMJA-UHFFFAOYSA-N	443.382	1.256	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNc2nnc(C)c(=O)[nH]2)c1	10899208	JKJDITWYPPGLBO-UHFFFAOYSA-N	430.446	1.040	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)Cn2nc(-c3ccccc3)oc2=O)cc1	16496409	NYWZQCJQVQHLHD-AWEZNQCLSA-N	426.429	1.517	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)CCCCCNS(=O)(=O)c2ccc3c(c2)OCCO3)n1	22235700	UXHDSTBWZLDOAK-UHFFFAOYSA-N	449.533	1.847	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)c1ccc(OCC(N)=O)cc1	24312751	OUAAYEYUUCPEQS-LLVKDONJSA-N	436.262	1.542	50	20	IDGD	
O=C(Cn1ccccc1=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	45824699	NKDMKETYFDQTQK-UHFFFAOYSA-N	432.483	1.172	50	20	IDGD	
N#CCCN(C(=O)CCC(=O)NNC(=O)c1n[nH]c(=O)c2ccccc12)c1ccccc1	111191485	FNNGNGZBVCEHQS-UHFFFAOYSA-N	432.440	1.411	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)CNC(=O)c1cccs1)c1ccc(NC(=O)C2CC2)cc1	725874077	XBDYSVTUHPKRNE-LBPRGKRZSA-N	429.502	1.918	50	20	IDGD	
CCN(CCNC(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1)C1CC1	726281279	JVLZVQCNHCQACY-UHFFFAOYSA-N	448.531	1.817	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)CNC(=O)c1ccc(C#N)cc1	726979122	BQZZDKGOJRALIS-LBPRGKRZSA-N	445.273	1.665	50	20	IDGD	
C[C@@]1(NNC(=O)NCc2cccc(C(=O)OCc3ccccc3)c2)CCS(=O)(=O)C1	727604090	OCWNCCRDGURMIE-OAQYLSRUSA-N	431.514	1.925	50	20	IDGD	
CN(C)c1ccc(C=NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1F	727650515	LCOQEHBMGWUDET-UHFFFAOYSA-N	434.493	1.677	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)N[C@@H](CN1CCN(C)CC1)c1ccccc1	727946361	WZCLVEBGNVFDLR-XLIONFOSSA-N	443.523	1.912	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)NC(C)C)c(Br)cc1Cl	728263361	XCIKEUIORCRGPN-UHFFFAOYSA-N	428.692	1.790	50	20	IDGD	
COc1cc(C(=O)NNC(=O)N[C@H](C)c2ccc3c(c2)CC(=O)N3C)cc(OC)c1OC	728302461	PILNCEQHWONEPY-GFCCVEGCSA-N	442.472	1.937	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNS(=O)(=O)c1cc(C(F)(F)F)ccc1F	728506916	KADRWWFYKZXCII-UHFFFAOYSA-N	425.385	1.646	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)CNC(=O)NCc2ccco2)c1	728525855	IEBMWKMYORYYOP-UHFFFAOYSA-N	425.239	1.311	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCCCN2CCCCC2=O)nc1	730132340	ILBJKYCYSRDQIC-UHFFFAOYSA-N	426.543	1.141	50	20	IDGD	
Cc1cccc(N2C(=O)N[C@H](CCC(=O)NNC(=O)COc3ccccc3O)C2=O)c1	730781380	LKKFMKXHRNZZOY-OAHLLOKOSA-N	426.429	1.132	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)c1ccccc1S(=O)(=O)N1CCCCC1	730781922	CGLDPBQYJAWCAZ-UHFFFAOYSA-N	433.486	1.407	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)[C@H](CCSC)N1C(=O)[C@H]2CCCC[C@@H]2C1=O	731491142	CQHPEWVHFGCDAM-DZKIICNBSA-N	433.530	1.753	50	20	IDGD	
O=C(COc1ccc(OCc2ccccc2)cc1)NNC(=O)C1CCS(=O)(=O)CC1	732932288	QNJYWMSHOVFQEU-UHFFFAOYSA-N	432.498	1.617	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N[C@H](C)c2nncn2C)cc1	733132854	XWMBNFUGSKMRMY-KWZJRMENSA-N	448.487	1.347	50	20	IDGD	
CSCC[C@H](NC(=O)Cc1ccccc1)C(=O)NNc1nc2ccccc2c(=O)n1C	733261161	MBAHWEFZPPFWEL-SFHVURJKSA-N	439.541	1.857	50	20	IDGD	
CCc1ccc(NS(=O)(=O)c2cc(C(=O)NNC(=O)CN(C)C)ccc2OC)cc1	733359542	JPSFAHMVMKEMFW-UHFFFAOYSA-N	434.518	1.381	50	20	IDGD	
CCS(=O)(=O)C[C@H](C)NC(=O)NNC(=O)[C@@H](C)Oc1cccc(Br)c1	733660310	OIWQYEKYUKOASK-WDEREUQCSA-N	436.328	1.370	50	20	IDGD	
O=C1NC(=O)C2(CCC(C(=O)NNc3cc(C(F)(F)F)nc(-c4cccnc4)n3)CC2)N1	734259583	RYMWNKFPNRHCIH-UHFFFAOYSA-N	449.393	1.769	50	20	IDGD	
COC[C@H]1CCN(C(=O)/C(C#N)=C\c2cn(CCC(N)=O)nc2-c2ccc(OC)cc2)C1	739757107	OJNFKZJDWZINKO-GYXHFJGISA-N	437.500	1.836	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)C1(c2ccc(Br)cc2)CCOCC1	740851339	ZPPDCPCWAHZHQE-UHFFFAOYSA-N	440.338	1.950	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)Cn2cnc3c(oc4ccccc43)c2=O)cc1	744583809	KWHVPVROQKPNDY-UHFFFAOYSA-N	445.391	1.019	50	20	IDGD	
COc1cc(C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)cc(NC(C)=O)c1OC	745439902	WHTKIUKYFUDGAL-UHFFFAOYSA-N	440.412	1.152	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1)[C@H]1CCOC1	745861339	KHQDYTTVZBHVAT-STQMWFEESA-N	438.531	1.918	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)NC[C@H](c1cccc(Cl)c1)N1CCOCC1	748627815	LUTDRCYHITXIBL-RHSMWYFYSA-N	428.917	1.095	50	20	IDGD	
CS(=O)(=O)c1cc(C(=O)NNC(=O)c2ccc3c(c2)OCO3)ccc1Br	749160587	LTAMHHLKXMWCEV-UHFFFAOYSA-N	441.259	1.656	50	20	IDGD	
C#CCNS(=O)(=O)c1cccc(C(=O)NNc2nc(Br)cn3ccnc23)c1	750243686	MACLGAVDPVWLPA-UHFFFAOYSA-N	449.290	1.160	50	20	IDGD	
C[C@@H]1C(=O)Nc2cc(C(=O)OCC(=O)NNC(=O)c3cccc(Cl)c3)ccc2N1C	750570666	BIUHLGRUBFAIOF-LLVKDONJSA-N	430.848	1.735	50	20	IDGD	
C[C@H](NC(=S)NNC(=O)c1ccc(S(=O)(=O)NC[C@@H]2CCCO2)cc1)C1CC1	751620658	XOEXWZWFYNTERH-WFASDCNBSA-N	426.564	1.051	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NCc2cnc(N(C)C)n2C)c2ccccc2c1=O	751808004	ZATXFXGQXOIKSI-UHFFFAOYSA-N	440.508	1.140	50	20	IDGD	
COc1cc(NC(=O)CNC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc(OC)c1	752015768	ZRDQZGGJBUGWTQ-UHFFFAOYSA-N	438.444	1.472	50	20	IDGD	
COC1CCC(CCNC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)CC1	754136071	VCMOWPVJKWSXRD-UHFFFAOYSA-N	425.555	1.827	50	20	IDGD	
CCS(=O)(=O)N1CCC(CNC(=O)/C(C#N)=C\c2cc(C)n(CCOC)c2C)CC1	754752425	LGNLWIWYXBOSCC-MOSHPQCFSA-N	436.578	1.836	50	20	IDGD	
O=C(CSc1nnc(-c2ccco2)n1Cc1ccco1)NNC(=O)Cc1cc[nH]n1	755279606	PHOMHIBGQGDBCY-UHFFFAOYSA-N	427.446	1.385	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)Nc1ccc(-n2cnnn2)cc1	755434174	GVVCHYDDIYYIBY-UHFFFAOYSA-N	435.492	1.027	50	20	IDGD	
CNS(=O)(=O)c1cc(NC(=O)NNC(=O)c2cccc(OC(F)F)c2)ccc1C	755513903	FBSSFVJCMZLINP-UHFFFAOYSA-N	428.417	1.971	50	20	IDGD	
COc1cccc(-c2nc(C)c(C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)[nH]2)c1	755858912	OUDTUMZJROYZMJ-UHFFFAOYSA-N	435.488	1.861	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NC1CCN(S(=O)(=O)C(C)(C)C)CC1	755896690	VCLRMRLWZXGYJO-CYBMUJFWSA-N	444.529	1.516	50	20	IDGD	
COc1ccc(-n2cc(CNC(=O)NNC(=O)c3nnc(O)c4ccccc34)nn2)cc1	756071570	VRZTWRUFGCSUKF-UHFFFAOYSA-N	434.416	1.069	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCCN(C(C)=O)c3ccccc32)cc1OC	756603222	DFXOCUAFFGYQQG-UHFFFAOYSA-N	426.473	1.728	50	20	IDGD	
CCn1nnnc1-c1cccc(NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c1	756687552	VMNALGYIDYOHNZ-UHFFFAOYSA-N	433.432	1.073	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)Nc3ccn(CCS(C)(=O)=O)n3)n[nH]2)cc1	756763380	ZSRYTCLLFZXENB-UHFFFAOYSA-N	431.478	1.093	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)COc2ccccc2C#N)cc1NS(C)(=O)=O	756781379	CAFLKDWZNCZGTJ-UHFFFAOYSA-N	433.446	1.170	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@@](C)(O)CN2Cc3ccccc3C2=O)ccc1OC(C)C	756797621	QOXQXQZWLRMAPX-QHCPKHFHSA-N	441.484	1.650	50	20	IDGD	
NC(=O)c1ccc(NC(=O)NNC(=O)COc2ccc(Br)cc2)c(F)c1	756820807	LRHQFRJSYMMFEA-UHFFFAOYSA-N	425.214	1.919	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)Nc1ccc(C(=O)NC2CCOCC2)cc1	757621565	PWDXMSSHKCRAIZ-UHFFFAOYSA-N	426.429	1.791	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)Nc1cnn(-c2ccc(C(F)(F)F)cc2)c1	757747169	GJHSMUFFFQPQRZ-SNVBAGLBSA-N	431.396	1.479	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)CCc1ncc(-c2ccc(Cl)cc2Cl)o1	758035212	KFJOPMGYNABEAY-SECBINFHSA-N	449.316	1.666	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@H](C#N)[C@@H](NC(=O)NNC(=O)CSc2ccccc2O)C1	758758025	HZIZOAVVLWRYNM-OLZOCXBDSA-N	435.506	1.574	50	20	IDGD	
COCCS(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2c(C)nc3ccccn23)cc1	758854434	NRBMMXNHFSDHTC-UHFFFAOYSA-N	445.501	1.207	50	20	IDGD	
C[C@H](O)C[C@H](CNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)c1ccccc1	759610391	KZHPCUBHWLJHCT-QFBILLFUSA-N	426.521	1.578	50	20	IDGD	
CN1CCN(CC(=O)NNC(=O)c2ccc(COc3ccc(Cl)cc3)cc2)CC1=O	763284006	OGDBZILICOAUID-UHFFFAOYSA-N	430.892	1.454	50	20	IDGD	
O=C(NC[C@H]1CCCO1)Nc1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2)cc1	763424579	BXXIXIPDMUYABN-QGZVFWFLSA-N	425.445	1.387	50	20	IDGD	
COCCOc1ccc(C(F)(F)F)cc1NC(=O)C(=O)NNC(=O)c1ccccn1	763465604	BCHARRQYISWMMH-UHFFFAOYSA-N	426.351	1.525	50	20	IDGD	
COc1cccc(-c2cc(NC(=O)C(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)n(C)n2)c1	763472051	SDJFBIJMRDQISQ-UHFFFAOYSA-N	438.400	1.404	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)NCc1ccnc(OC2CCOCC2)c1	763505955	CADWSLSPUOGKQI-UHFFFAOYSA-N	432.502	1.968	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c(C)c1	763510099	YMGGUWWRQGKADI-UHFFFAOYSA-N	444.513	1.488	50	20	IDGD	
O=C(NNC(=O)c1cc2ccccc2cc1O)C(=O)Nc1ccnn1Cc1ccccn1	763518255	SGJLTBXYIPUDMT-UHFFFAOYSA-N	430.424	1.585	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3ccccc3O)cc2F)C[C@@H](C)O1	763530400	UUMRHAUUHDWPMQ-BETUJISGSA-N	430.436	1.545	50	20	IDGD	
CCNC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(OC)c(OC)c2)c1	763551926	UKDGVOLISHQRRT-UHFFFAOYSA-N	429.433	1.245	50	20	IDGD	
COC(=O)[C@@H](C)Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)cc1	763613277	LNAQMGLWKHITFJ-AWEZNQCLSA-N	449.467	1.828	50	20	IDGD	
COC(=O)c1cc(Cl)ccc1NC(=O)C(=O)NNC(=O)COc1cc(C)ccc1C	763664953	OKPRXZPMBYHKEH-UHFFFAOYSA-N	433.848	1.908	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2cccn(Cc3ccccc3)c2=O)c1	763665466	VDAWGKWOPIRVEH-UHFFFAOYSA-N	448.479	1.678	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2ccc(C(=O)NC(C)C)c(C)c2)c1	763667862	DHTRQCBVSWJVNX-UHFFFAOYSA-N	440.500	1.915	50	20	IDGD	
O=C(NNC(=O)c1cccc(Cl)c1)C(=O)Nc1cc(N2CCNC2=O)ccc1Cl	763748261	PTFGKOMPRNIKHF-UHFFFAOYSA-N	436.255	1.923	50	20	IDGD	
CCOc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NNC(=O)c1cccc(N(C)C)c1	763761008	YBQKHGBVTUVZTL-UHFFFAOYSA-N	441.488	1.253	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2cccc(N3CCCCC3=O)c2)c1	763772046	KZTKAWLQBIOPKQ-UHFFFAOYSA-N	440.456	1.620	50	20	IDGD	
CCc1ccc(CC)c(NC(=O)C(=O)NNC(=O)c2nn(CC)c(=O)c3ccccc23)c1	763785110	FIGHUZPECXNMQG-UHFFFAOYSA-N	435.484	1.941	50	20	IDGD	
Cc1cnc(O)n1-c1ccccc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccccc1F	763864204	GXSDTGBZUZOWJJ-ZDUSSCGKSA-N	441.419	1.579	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)C(=O)Nc1cnn(-c2ncccn2)c1	763901140	LLGMZYZXTAYMDT-UHFFFAOYSA-N	448.468	1.494	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccn(CC(F)(F)F)n2)ccc1OC(C)C	763916707	SXUXAGFOVAMCGL-UHFFFAOYSA-N	443.382	1.641	50	20	IDGD	
CC1CCN(c2ccc(NC(=O)C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)cc2)CC1	763917193	RGFFCAYRJIRXSI-UHFFFAOYSA-N	448.487	1.298	50	20	IDGD	
CC(C)n1ncc2cc(NC(=O)C(=O)NNC(=O)c3nn(-c4ccccc4)cc3O)cnc21	763948415	JTFQDPKLLMATEG-UHFFFAOYSA-N	448.443	1.303	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)C(=O)Nc1cccc(S(=O)(=O)NC2CC2)c1C	763957866	MVXVNFVHCCCMOJ-UHFFFAOYSA-N	430.486	1.144	50	20	IDGD	
CN(C(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cccn2C)cc1)C1CCCCC1	763992935	KMUFXPHVEPKGIR-UHFFFAOYSA-N	425.489	1.830	50	20	IDGD	
CC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1Cl	764003707	ICKDBBPZBDFCOH-UHFFFAOYSA-N	432.820	1.469	50	20	IDGD	
CN(C)C1CCN(c2ccc(NC(=O)C(=O)NNC(=O)Cc3ccsc3)cc2F)CC1	764035093	SNGKGWWCQTVRMA-UHFFFAOYSA-N	447.536	1.746	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccccc2S(=O)(=O)C(F)F)c(O)c1	764109871	CQHPTSHUCLLAMH-UHFFFAOYSA-N	427.385	1.097	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(C)cc3)[nH]n2)cn1C	764110405	JBQMCQMSDBPHRC-UHFFFAOYSA-N	438.444	1.300	50	20	IDGD	
CSc1nnnn1-c1cccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)c1	764127071	SJQRKPNSTRFNLC-UHFFFAOYSA-N	447.864	1.143	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(=O)n(Cc3ccccc3)c2)c1O	764131751	NIKONSRTTMMOPD-UHFFFAOYSA-N	436.424	1.011	50	20	IDGD	
O=C(CCCc1ccccc1)NNC(=O)C(=O)Nc1ccc(S(=O)(=O)NC2CC2)cc1	764224324	QKMABQOBUKZZBM-UHFFFAOYSA-N	444.513	1.236	50	20	IDGD	
C[C@@H]1COCCN1c1ccc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)cc1	764394146	OOVKXTORMAHCOT-CQSZACIVSA-N	444.513	1.496	50	20	IDGD	
Cc1nc(CC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)c(C)s1	764461198	BQQUYYFPGMUQPP-UHFFFAOYSA-N	436.559	1.938	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CC[C@]3(CCN(C(=O)OC(C)(C)C)C3)C2)n1	765030695	IAPJFTFWDFYMDW-FQEVSTJZSA-N	437.566	1.474	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3nnc4ccccc4c3O)CC2)cc1	766640297	FMFOBDPNPJAQDQ-UHFFFAOYSA-N	434.500	1.223	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)Cc1csc(N2CCCC2=O)n1	767273799	IGVKRSIYFLTPNP-UHFFFAOYSA-N	430.486	1.054	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C(=O)Nc1cc(C2CC2)nn1-c1ncccn1)c1ccccc1	768241832	LNDRZHUCSSUWCZ-INIZCTEOSA-N	433.472	1.819	50	20	IDGD	
COc1cc(C(=O)NNC(=O)N[C@H]2CCO[C@@]3(CCSC3)C2)cc(OC)c1OC	768516291	KILOLHZHMVPPIF-DJJJIMSYSA-N	425.507	1.711	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(C)c(C(=O)NNc2ccnc(Br)c2)c1	771547288	NOGZOFQGAHDNAI-UHFFFAOYSA-N	443.323	1.834	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1ccc(NC2=NS(=O)(=O)c3ccccc32)cc1	771854128	MNCIVABTNRGYGU-GFCCVEGCSA-N	444.469	1.350	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)c1ccc(S(=O)(=O)N2CCCCC2)cc1	771893403	JDGBCFGXKSQDAF-HNNXBMFYSA-N	439.534	1.600	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)[C@@H]1CC(=O)N(c2ccccc2F)C1	772196931	BPOXDHYXUBNCAT-CYBMUJFWSA-N	432.839	1.296	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)CCn1nc(O)c2ccccc2c1=O	772997414	UVUMPCFAAAKLDQ-GFCCVEGCSA-N	430.848	1.761	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)[C@@H]3CCCC3(C)C)CC2)cc1	773388359	CPCUNZBDHIRNBR-SFHVURJKSA-N	436.578	1.275	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NNC(=O)CCN2C(=O)COc3ccccc32)C1	773411856	AWLSGWWQPOWQOE-OAHLLOKOSA-N	446.504	1.597	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)c2ccc(=O)n(-c3ccccc3)n2)C1	773413163	HGNLEXOSBJIVTR-HNNXBMFYSA-N	441.488	1.641	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NNC(=O)Cn2c(=O)cnc3ccccc32)C1	773418665	LAXVPUWHVKJSCE-CQSZACIVSA-N	429.477	1.191	50	20	IDGD	
COc1cc(C)c(NC(=O)C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc1F	773499861	MTQDSDFUGNSONI-UHFFFAOYSA-N	427.392	1.434	50	20	IDGD	
O=C(NNc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cccc(OCC(=O)N2CCCC2)c1	773645185	XPTZDOKDSYEIBE-UHFFFAOYSA-N	427.417	1.678	50	20	IDGD	
COC(=O)[C@@H]1CCCCN1C(=O)c1cccc(NC(=O)C(=O)NNc2ccc(C#N)cc2)c1	773692275	BYAUBUABVYDFOJ-IBGZPJMESA-N	449.467	1.808	50	20	IDGD	
C#C[C@H](NC(=O)NNC(=O)c1nn(CCCCC)c(=O)c2ccccc12)[C@@H]1CCCO1	776226216	DWYNFOIKBONMLT-ROUUACIJSA-N	425.489	1.712	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)c1cn(-c2cccc(Cl)c2F)nn1	776345698	WWJMRBZOWUSMSS-UHFFFAOYSA-N	441.851	1.529	50	20	IDGD	
CN(C)C(=O)COc1ccccc1C(F)(F)C(=O)NNC(=O)COc1ccccc1F	778523859	HLIZPYNEJZBIST-UHFFFAOYSA-N	439.390	1.611	50	20	IDGD	
C[C@](O)(CC(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1)c1ccccc1	780983928	QUMOPUFRCAZFKN-QHCPKHFHSA-N	444.963	1.903	50	20	IDGD	
CCC1(C(=O)NNC(=O)CCN2C[C@@H](C)O[C@H](C)C2)CCN(C(=O)c2ccccc2)CC1	781415075	DTJHPRGEGKEMGU-RTBURBONSA-N	444.576	1.966	50	20	IDGD	
O=C(NCc1ccccc1CN1CC[C@H](O)C1)NNC(=O)c1ccc2c(c1)OCCO2	781835713	VRJKAFSDLHIFBB-SFHVURJKSA-N	426.473	1.169	50	20	IDGD	
NC(=O)CCOc1ccccc1NC(=O)C(=O)NNC(=O)c1ccc(Cl)cc1Cl	782927669	WBUTWZZQPIXYEB-UHFFFAOYSA-N	439.255	1.647	50	20	IDGD	
CS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2cccc(-c3n[nH]c(C4CC4)n3)c2)cc1	783073488	YQOPHKJGJOMKML-UHFFFAOYSA-N	440.485	1.834	50	20	IDGD	
CC(C)N1CCN(c2cccc(NC(=O)C(=O)NNc3ccc(-n4cccn4)nn3)c2)CC1	783436710	OFHCDISKVUQKAX-UHFFFAOYSA-N	449.519	1.275	50	20	IDGD	
O=C(NNC(=O)N1CC[C@@H](Oc2cccc(F)c2)C1)c1csc(N2CCOCC2)n1	784170176	BTMYSPNBBZIOJG-OAHLLOKOSA-N	435.481	1.627	50	20	IDGD	
O=C(NNC(=O)N1CC[C@@H](Oc2cccc(F)c2)C1)C1CCN(c2ncccn2)CC1	784291550	VKBSGDLVWTVBCL-GOSISDBHSA-N	428.468	1.726	50	20	IDGD	
CN(C)CC1CCN(c2ccc(NC(=O)C(=O)NNc3ccc(Cl)nn3)cc2)CC1	784785541	AHFBCPQVGLLDGB-UHFFFAOYSA-N	431.928	1.990	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1C(=O)N(C)C(C)C	786065134	KKZXOGMBCXVFDK-UHFFFAOYSA-N	436.476	1.918	50	20	IDGD	
N#C/C(=C/c1ccc(O)cc1)C(=O)NC1CN(S(=O)(=O)c2ccc3c(c2)OCCO3)C1	787500090	QIKSRTVNEXQSMT-DHDCSXOGSA-N	441.465	1.260	50	20	IDGD	
COc1ccc(OC)c([C@@H]2C[C@H]2C(=O)OCC(=O)NNC(=O)Cc2nc(C)cs2)c1	788201915	RIPWLOKCQZVVCA-DZGCQCFKSA-N	433.486	1.506	50	20	IDGD	
CSC[C@H](C(=O)NNc1nnc(-c2ccccn2)s1)N1C(=O)[C@H]2CCCC[C@H]2C1=O	788563961	YLIMIEARNMOSNL-MBNYWOFBSA-N	446.558	1.950	50	20	IDGD	
CN(NS(=O)(=O)c1c(F)cccc1F)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	788917761	UYQLQMAPDCTGNA-UHFFFAOYSA-N	434.465	1.763	50	20	IDGD	
CC(C)(C)OC(=O)N1CC2(C[C@H]2C(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)C1	789210378	MDAFULCGTXZGET-AWEZNQCLSA-N	436.896	1.361	50	20	IDGD	
COc1cc(C(F)(F)F)ncc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccc(F)cc1	792269346	QTVGJUKKLUBJIA-VIFPVBQESA-N	444.341	1.802	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)c2cccc(NN3C(=O)[C@H]4CC=CC[C@H]4C3=O)c2)c1	793417627	DEHFWZBGYWHOPJ-KDURUIRLSA-N	429.436	1.911	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CN(Cc2ccccc2)CCC1(F)F)c1ccc(-n2cnnn2)cc1	794783825	JYIYFOWACHFYBG-SFHVURJKSA-N	441.442	1.581	50	20	IDGD	
Cn1ncc2c1C[C@@H](C(=O)NNc1ccc(S(=O)(=O)Nc3nccs3)cc1)CC2	799101528	NQLWYDFXZWKUMN-LBPRGKRZSA-N	432.531	1.926	50	20	IDGD	
NS(=O)(=O)Cc1cccc(CNC(=O)NNC(=O)c2cccc(Br)c2)c1	799934994	APAMXAULEBHMEB-UHFFFAOYSA-N	441.307	1.382	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NCc2cnn(CCOC)c2)c2ccccc2c1=O	800734574	SPZCHMUOPMRZIK-UHFFFAOYSA-N	441.492	1.184	50	20	IDGD	
O=C(Cn1[nH]cc2c(=O)ncnc1-2)NNc1c(Br)cccc1Br	801500513	ROYXUSRLUUDKNW-UHFFFAOYSA-N	442.071	1.740	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)[C@H]2CCCCN2S(C)(=O)=O)cc1Cl	802075269	PGODEWBBHKGTSW-GFCCVEGCSA-N	434.902	1.324	50	20	IDGD	
CN(C)c1nc(O)cc(C(=O)NNc2ccc(S(=O)(=O)Nc3nccs3)cc2)n1	802554118	NRXFTDVBDZYUIW-UHFFFAOYSA-N	435.491	1.262	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNS(=O)(=O)c1cc(S(C)(=O)=O)ccc1OC	802720995	QYJDQVOZWWDYIF-UHFFFAOYSA-N	448.906	1.384	50	20	IDGD	
CNS(=O)(=O)N1CCC(C(=O)NNC(=O)Nc2ccc(-c3ccccc3)cc2)CC1	803195664	MYPQBOCWDNGVSZ-UHFFFAOYSA-N	431.518	1.683	50	20	IDGD	
O=C(COC(=O)c1cc(=O)c2ccc(F)cc2o1)NNC(=O)c1ccc([N+](=O)[O-])cc1	803926762	AKTRYGWCKPQJHI-UHFFFAOYSA-N	429.316	1.458	50	20	IDGD	
COCCc1ccnc(NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1	806660198	AKLNZELERINSHG-UHFFFAOYSA-N	447.517	1.522	50	20	IDGD	
C[C@@H]1CCCN(S(=O)(=O)c2ccc(NC(=O)C(=O)NNc3ncccc3F)cc2)C1	807301700	FTYOZFUYOGTNCI-CYBMUJFWSA-N	435.481	1.723	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)C1CCN(S(=O)(=O)c2ccccc2)CC1	807371574	LIFYDLQITCIPCO-UHFFFAOYSA-N	427.523	1.024	50	20	IDGD	
CSC1(CNC(=O)NNC(=O)COc2ccc(Br)cc2)CCN(C)CC1	811944662	ZDCUXUQKEQNDNC-UHFFFAOYSA-N	445.383	1.986	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)CNC(=O)c2cc(-c3ccccc3)on2)cc1	812729522	ODBQRBHDQCTTTN-UHFFFAOYSA-N	443.485	1.465	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)[C@H](CCS(C)(=O)=O)c2ccccc2)cc1	812732833	TVBSRZZVMZYQKX-GOSISDBHSA-N	439.559	1.599	50	20	IDGD	
Cc1cnn(C)c1S(=O)(=O)NC(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccccc1	813988976	SWBHHDGUCZBCKF-BOPFTXTBSA-N	449.496	1.918	50	20	IDGD	
O=C(NNS(=O)(=O)CCCCN1C(=O)c2ccccc2C1=O)c1cc2c(s1)CCC2	814209989	IYDICCIFAOQSGK-UHFFFAOYSA-N	447.538	1.877	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(NC(=O)NNc2ccccc2S(=O)(=O)N(C)C)c1	814484362	SMEOIKVSHKYRQV-UHFFFAOYSA-N	441.535	1.336	50	20	IDGD	
COc1cc(C=NNC(=O)Nc2ccc(S(N)(=O)=O)cc2)ccc1OC(=O)C1CC1	814964450	USEJOQPUBOSJPN-UHFFFAOYSA-N	432.458	1.814	50	20	IDGD	
CCNC(=O)COc1ccc(C=NNC(=O)Nc2ccc(S(N)(=O)=O)cc2)cc1OC	814965561	ONBZMWJETSTGGN-UHFFFAOYSA-N	449.489	1.013	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1ccc(OC(F)(F)F)cc1	815751722	LNGZIPOMRSRIEH-UHFFFAOYSA-N	446.407	1.917	50	20	IDGD	
Cc1ccn(-c2ccccc2NC(=O)C(=O)NNc2ccccc2S(=O)(=O)N(C)C)n1	815751804	OVDKRLMMGHRBHS-UHFFFAOYSA-N	442.501	1.513	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCO1)C(=O)Nc1ccc(C(=O)NCc2ccccc2F)cc1	815780437	XHFYPVHVYZJWKV-QGZVFWFLSA-N	428.420	1.021	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)CSCC(=O)N2CCCCC2)c2ccccc2c1=O	824060477	RJAIZIFZGWXESG-UHFFFAOYSA-N	445.545	1.484	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)c2ccc(OC)c(S(=O)(=O)NC3CC3)c2)c1	825805697	NMAYUEVAHQAOSS-UHFFFAOYSA-N	448.501	1.018	50	20	IDGD	
CC[C@@H](C)[C@@H](C(=O)OCC(=O)NNC(=O)c1cccs1)N1C(=O)c2ccccc2C1=O	844205818	ZJXHTOQPTPRJEH-PXAZEXFGSA-N	443.481	1.763	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccc(Br)c(C(=O)N2CC[C@@H](B(O)O)C2)c1	864234939	ZWJNROZOHYASPX-SNVBAGLBSA-N	433.133	1.215	50	20	IDGD	
CN1CC[C@@H](C(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)CC1=O	907727873	VRIMUQIZZRJBSL-GOSISDBHSA-N	433.472	1.018	50	20	IDGD	
CS(=O)(=O)Nc1cccc(C(=O)NNC(=O)COc2ccc(Br)cc2)c1	913457923	VVFIHFCCRCXBKA-UHFFFAOYSA-N	442.291	1.661	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(S(=O)(=O)NCC3CC3)c2)cc1C	914595117	WXKUVVWOJWVIJF-UHFFFAOYSA-N	444.513	1.391	50	20	IDGD	
CC(C)C(=O)Nc1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1	914748070	FLWAHTVSFLHLDT-UHFFFAOYSA-N	432.502	1.606	50	20	IDGD	
O=C(NNC(=O)C1CCCC1)c1cc(I)ccc1-n1cnnn1	914842843	RKLZYZXETCTKCT-UHFFFAOYSA-N	426.218	1.218	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)C1=NN(Cc2ccc(F)cc2)C(=O)CC1	916124666	UCQYEGQHJVKBQA-UHFFFAOYSA-N	436.403	1.414	50	20	IDGD	
CC(C)CS(=O)(=O)CC(=O)NNC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1	916128094	KUCREUGOAGQTBA-UHFFFAOYSA-N	441.513	1.766	50	20	IDGD	
Cn1ncc2c1CCC[C@H]2NC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	916604744	OGQHPNCIQPLWMW-QGZVFWFLSA-N	446.533	1.226	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)CN(C)c1ncnc2[nH]cnc12	917922612	ZPSYMBPMOQPRKE-SNVBAGLBSA-N	448.281	1.167	50	20	IDGD	
CC(C)C[C@H](/N=C1/NS(=O)(=O)c2ccccc21)C(=O)NNC(=O)c1ccc(Cl)nc1	918599442	FHDBVCXUPLIYBM-AWEZNQCLSA-N	449.920	1.649	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Nc2cc(-n3cnnn3)ccc2C)cc(OC)c1OC	919896870	KEERKZJOBSJPAG-UHFFFAOYSA-N	427.421	1.463	50	20	IDGD	
CC(=O)N1CCN(S(=O)(=O)c2ccc(C(=O)NNc3ccccc3Cl)cc2)CC1	920089477	LOABVTDYXWBUDZ-UHFFFAOYSA-N	436.921	1.950	50	20	IDGD	
Cc1ccc(-n2c(N(C)C)nc(C=NNC(=O)N[C@@H]3CCS(=O)(=O)C3)c2Cl)cc1	920384000	ILUXQCBVXSOMOA-CYBMUJFWSA-N	438.941	1.720	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@@H]2CCCN2C(=O)/C=C\c2ccc(C(N)=O)cc2)cc1	1115888308	HFPCZAHKRCIHTJ-JCKYIPBCSA-N	436.468	1.260	50	20	IDGD	
C[C@@H]1CCc2nc(NC(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)sc2C1	1116587185	JMUUMSJJMVJXIQ-LLVKDONJSA-N	437.547	1.985	50	20	IDGD	
COc1ccc(CC(=O)O)cc1S(=O)(=O)NNC(=O)c1ccc(Br)cc1	1251237396	PADBGPNGAXOMNK-UHFFFAOYSA-N	443.275	1.708	50	20	IDGD	
CSCC[C@@H](NC(=O)Cc1ccccc1)C(=O)NNC(=O)c1n[nH]c2c1CCCC2	1251801507	MQMJWKYCXODQNW-QGZVFWFLSA-N	429.546	1.530	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)c1ccc(C)cc1)C(=O)NNc1nncc(N)c1Cl	1319220661	UKFIRNOUCDGCPZ-ZDUSSCGKSA-N	444.970	1.564	50	20	IDGD	
O=C(NNC(=O)c1nc(C2CC2)n(-c2ccccc2)n1)c1csc(N2CCOCC2)n1	1321415260	SYEHGWXOIPMBCU-UHFFFAOYSA-N	439.501	1.513	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)Cc2nnc(O)c3ccccc23)CC1	1321904940	BGQDHKQFHIOGSJ-UHFFFAOYSA-N	429.477	1.672	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)c2ccn(-c3ccncc3)n2)cc1	1322041830	VEGCTHPPSBYOAJ-UHFFFAOYSA-N	434.485	1.763	50	20	IDGD	
Cc1cccc(-n2c(NNC(=O)[C@H](C)N3C(=O)CCC3=O)nc3ccccc3c2=O)c1C	1322793380	BAVXARYCEFQPEO-HNNXBMFYSA-N	433.468	1.983	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)c2cnnn2-c2cccc(F)c2)CC1	1326758285	HHHQSMHJCSHQIZ-UHFFFAOYSA-N	432.456	1.815	50	20	IDGD	
Nc1cnnc(NNC(=O)C2CCN(S(=O)(=O)/C=C\c3ccccc3)CC2)c1Cl	1333803712	GYMTUFUCCNVIEC-FLIBITNWSA-N	436.925	1.868	50	20	IDGD	
CCn1c(=O)c(C(=O)/C(C#N)=C\c2cccnc2N(C)C)c(N)n(Cc2ccccc2)c1=O	1342253043	DQTVDHQRCJGTFO-AQTBWJFISA-N	444.495	1.911	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1cn(-c2ccccc2)nc1-c1ccccc1)c1nnnn1C	1521196965	HDTJPOLMDHXQEM-AWEZNQCLSA-N	431.460	1.768	50	20	IDGD	
C[C@@H]1CCc2c(C(=O)N3CC[C@]4(C3)CN(C(=O)[C@H](F)Br)CCO4)n[nH]c21	1777851831	BUKIOLRIAXGOQF-SEHCQNQUSA-N	429.290	1.593	50	20	IDGD	
O=C(c1ccc([N+](=O)[O-])c2c1OCO2)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Cl)CCO2	1780235076	NFLRPMPXMLIWAL-YOEHRIQHSA-N	429.788	1.301	50	20	IDGD	
CC(=O)N[C@H](C(=O)N1CC[C@]2(CN(C(=O)[C@@H](F)Cl)CCO2)C1)c1ccc(F)cc1	1780908944	POZZXJHNLGDKHR-FRQCXROJSA-N	429.851	1.367	50	20	IDGD	
O=C(c1cnnc2ccccc12)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781330187	SROYLMQKILNWGC-MAUKXSAKSA-N	437.269	1.764	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(OC)c(OC)c3O)C2)C1	1781828851	AEHAMMWCRBHSPU-XOBRGWDASA-N	442.896	1.107	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CN1CCCCC1=O)C2	1782002224	OMGGOSJSDWRNDR-SPYBWZPUSA-N	444.370	1.296	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)C3CCC4(CC3)OCCO4)C2)C1	1782944270	RKNGMAYGKYFOFN-KBXCAEBGSA-N	445.354	1.533	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3nccnc3OC)CCO2)C1	1783342529	AWPYVNKQSKUTFP-SJKOYZFVSA-N	427.299	1.102	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cn(C)c4ncccc34)CCO2)C1	1783534720	YFNFEMYREQZLDA-YJYMSZOUSA-N	435.322	1.800	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)CCO2)C1	1783536231	FQNJCUVEMVZKOF-PIGZYNQJSA-N	444.257	1.961	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](C)NC(=O)OC(C)(C)C)CCO2	1783540180	SUNDHWYKVVKZTL-VFVRVIDISA-N	448.358	1.513	50	20	IDGD	
Cc1nn(C)c(C)c1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]2C1	1783968498	ARNMDHVQNFSOQO-MEYUZBJRSA-N	441.370	1.661	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3CC[C@@H](C(=O)OC)C3)[C@H]2C1	1784075244	FSOKFFSEGRXXGW-ZMSHIADSSA-N	428.957	1.963	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)Cc3ccc(C(=O)OC)cc3)C2)C1	1784162275	YUXJVHHIKVSAQW-UWJYYQICSA-N	438.908	1.099	50	20	IDGD	
O=C(CCc1ccc(F)nc1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21	1785234908	VNZROAFWVDLJOF-WSMBLCCSSA-N	446.292	1.824	50	20	IDGD	
C#CCCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)CCO2	1785424035	OUAYKWIXAAPBQB-OAQYLSRUSA-N	429.429	1.377	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)C3CCSCC3)C2)C1	1785635795	MFNRDRNZHQCIFV-CPOKCXMASA-N	447.561	1.094	50	20	IDGD	
CC(C)N1CCC[C@H]1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCBr)[C@H]2C1	1786407666	GVNKZIIKWYULNF-QAETUUGQSA-N	430.387	1.624	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(C4CC4)cc3)C[C@@H]21)c1cccc(B(O)O)c1	1786985291	ZQTOHBPUMAGUHJ-PMVMPFDFSA-N	448.328	1.151	50	20	IDGD	
CC(=O)c1cc(C(=O)Nc2ccc(C3(NC(=O)CCC(=O)NN(C)C)CCC3)cc2)n[nH]1	1787226273	SSQIQBSEGIREML-UHFFFAOYSA-N	440.504	1.733	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3nccc4nc[nH]c34)[C@H]2C1	1787355494	ZORPGWJAJVSKJW-DZKIICNBSA-N	431.569	1.403	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21)c1ccc(N2CCOCC2)cc1	1787546367	KEDFHHXYRHMFQO-WNHJNPCNSA-N	439.915	1.651	50	20	IDGD	
O=C(CCBr)Nc1ccc(C2(NC(=O)C[C@H]3NC(=O)NC3=O)CCC2)cc1	1787670473	WIJSFPFTDXPGEM-CYBMUJFWSA-N	437.294	1.504	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4cnccc4n3)[C@H]2C1	1787891100	ZYUDRZFJSBFTGU-GGXPGOJBSA-N	432.908	1.477	50	20	IDGD	
CC(=O)Nc1ccc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Cl)C[C@@H]32)cc1	1788190185	VSHCSJKLXIBHBE-PCODUJHASA-N	425.888	1.702	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]3C2)c(O)n1	1789924749	UVRRZKSNNQUJNX-DOERSZECSA-N	430.274	1.379	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCCn3cccc3)C[C@@H]21)[C@@H](F)Br	1789926946	LUQMMNVVCXHNSR-QBYUYEEZSA-N	430.318	1.939	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3noc(C)n3)C[C@@H]21	1790961785	UTNXPXWDDUARID-FQUUOJAGSA-N	429.315	1.074	50	20	IDGD	
CC(=O)N[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)Br)[C@H]2C1)C(C)(C)C	1791055067	HXHDQBGEPDAJIT-VLVIQNCWSA-N	446.386	1.300	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(C(N)=O)cc3)[C@H]2C1	1791896761	IACBXCXJOMUGIH-DDWPSWQVSA-N	438.322	1.162	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCl)C1CC1	1793107058	MXQMCQOCJJUZEN-ZHCJQAHYSA-N	443.972	1.918	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1n[nH]c2c1CCCC2	1796164473	ANHDFXMDQBIRND-FJHTZYQYSA-N	429.290	1.182	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](Br)Cc1ccccc1)C2)c1cn[nH]c1	1796573969	KWSQRLRADYNDKZ-XMTFNYHQSA-N	447.333	1.619	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](C)[C@H]1SC(=N)NC1=O	1796874267	NNVUCDIAPZKJFZ-HDLKOFKZSA-N	445.383	1.458	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc3cncn3c1)C2	1796892564	QIMWMGUWZUAMBV-MVUGMWCJSA-N	447.499	1.720	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc2c1NC(=O)C2=O	1798209484	ALKPWRFYDYYOIO-BTTYYORXSA-N	429.549	1.925	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1n[nH]c2c1CCc1ncccc1-2	1798477171	GSKFJDAIIQMKTM-ZDFLXESQSA-N	443.935	1.791	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(C)nn1C(F)F	1798682213	YQIGNAQGAVFOGJ-OPDFLTKYSA-N	449.296	1.963	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1nn(C)c(C)c1Br	1798715589	JGJVTCMOWSBKPK-GFQSEFKGSA-N	447.761	1.712	50	20	IDGD	
COc1ccccc1CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Br	1799346485	AHMVYGYWMIENFE-DLTLXFJOSA-N	429.286	1.518	50	20	IDGD	
CC(=O)N1CCN(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@](C)(Cl)CCl)CC1	1800082679	SZRQAUYKTZIGCL-YYAJDYIMSA-N	433.380	1.025	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3n(n1)CCC3)C2	1800641991	PTXITMQLKOAQGG-LMWOUKEDSA-N	425.327	1.206	50	20	IDGD	
COc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)Br)cc1OC	1800760188	GRIFXPQZXJLRGR-MBMVNNNZSA-N	441.322	1.690	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc3c(c1)CCCO3)C2	1800978023	JPQNHDCHQIPECP-NYUBLWNDSA-N	436.936	1.398	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)c1cc(Cl)cnc1O	1802331706	YQQZDQDCRNFOEH-RCBQFDQVSA-N	439.299	1.755	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccnc1OCC1CC1)C2	1802333060	LMBDUIGOPFUCFO-BCDXTJNWSA-N	443.548	1.495	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccncc1C(F)(F)F)C2	1802335943	BPMHOYSOJNEIDP-BTTYYORXSA-N	441.454	1.725	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc3c(c1)CCCC3=O)C2	1802336644	RQJXDUXXDFVHBP-REPLKXPHSA-N	440.544	1.830	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cncc3cnccc23)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803140009	AYTMBVAXKKFUTH-RYGJVYDSSA-N	439.903	1.944	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@H](CNC(=O)Cc2ncccn2)[C@@H]1c1cccnc1	1804693767	XCHPRTZIMRGUDU-UWJYYQICSA-N	427.581	1.972	50	20	IDGD	
Cc1nscc1C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1805192981	MYAUIRVOZQJZRK-OXJNMPFZSA-N	444.561	1.539	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)/C=C/c2ccco2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807365466	XUJWXXXFUHFEJU-OITNKYAQSA-N	445.284	1.387	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)CCc2ccc[nH]2)[C@H]1c1cccnc1	1807464123	TWUKRICDFAVBND-FDDCHVKYSA-N	440.548	1.421	50	20	IDGD	
CCOCC(=O)N1CC[C@H](CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@H]1c1cccnc1	1808413465	BBDZPDNIIYBDCL-MFWRVWTKSA-N	440.504	1.258	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)c1ccc(O)c([N+](=O)[O-])c1	1810690299	DZIKJDATVGKTCX-JCGIZDLHSA-N	448.863	1.615	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)c1cc2cccnn2c1	1812187124	MMJBGEXKRVDNNJ-ZYSHUDEJSA-N	427.892	1.649	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2cc3n(n2)CCC3)[C@@H]1c1cccnc1	1813031009	IQJSHBWMZYFKBN-HHXXYDBFSA-N	431.924	1.798	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)[C@H]2CCC=CO2)[C@H]1c1cccnc1	1813074528	UCYZOAOZNHWQCT-UEXGIBASSA-N	429.521	1.153	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H]1CC=CCC1)CC2)c1cccc(B(O)O)c1	1815349990	BTKQZBCXEOGEJM-CZUORRHYSA-N	425.319	1.405	50	20	IDGD	
CCc1ccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)cn1	1816324284	UIKNVKGWUPQNQK-HXUWFJFHSA-N	447.304	1.667	50	20	IDGD	
CC(=O)Nc1cc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@@H](O)CCl)CC3)ccn1	1817904031	AZZDPANIZOXROI-AAEUAGOBSA-N	437.909	1.322	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H]2CCCO2)[nH]n1	1818113536	PIDJPMDAXGALMY-CUPNELQNSA-N	441.492	1.715	50	20	IDGD	
Cc1ccoc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819403015	SIYPBFNLFFHXAG-INIZCTEOSA-N	437.460	1.929	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc(F)nc2)n[nH]1	1819695940	FUEJPBJCEIXQCI-OAHLLOKOSA-N	431.472	1.623	50	20	IDGD	
CN1N=C(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)[C@H](F)Br)n[nH]2)CCC1=O	1820932209	ZIFCNSKDNIVGAO-RISCZKNCSA-N	443.277	1.701	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1)c1ccc(O)c([N+](=O)[O-])c1	1821042158	ISCMWBXOLMBWKQ-SWLSCSKDSA-N	437.840	1.929	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])o2)[nH]n1	1822412235	OJXANAFLECCLAR-CYBMUJFWSA-N	447.452	1.590	50	20	IDGD	
C[C@H](C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](F)Br)[nH]n1)n1cncn1	1822768425	GCURNWCTMKVLOX-IRUJWGPZSA-N	428.266	1.945	50	20	IDGD	
Cc1cccn2ncc(C(=O)Nc3nc4c(s3)C[C@H](NC(=O)[C@H](O)CCl)CC4)c12	1824335143	QFBWMJDVGUFEHN-BXUZGUMPSA-N	433.921	1.925	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc3c(c1)CNC3=O)CC2	1826000228	OTZKQEKAFQFOHR-OCCSQVGLSA-N	448.932	1.866	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCN1CCOC1=O)CC2	1826000261	QBVJQFCSJYVNTL-WDEREUQCSA-N	430.914	1.151	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1n[nH]cc1[N+](=O)[O-])CC2	1826003387	KSQHGBFOVOULCX-SFYZADRCSA-N	428.858	1.254	50	20	IDGD	
O=C(Cc1cscn1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827053202	XTXJGOBHYNQSSS-FQEVSTJZSA-N	441.362	1.299	50	20	IDGD	
Cc1ccc(CC(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2ccc(B(O)O)cc2)CC3)o1	1827080179	FPLRMBQXRXHUDM-OAHLLOKOSA-N	439.302	1.193	50	20	IDGD	
O=C1NCc2cc(C(=O)N3CCCC[C@H]3C3CCN(C(=O)[C@@H](O)CCl)CC3)ccc21	1828722818	FZMPNYPZOBGLHA-OALUTQOASA-N	433.936	1.763	50	20	IDGD	
N#Cc1c[nH]c(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)c1	1829776640	WWOACUFZPRYCML-OAQYLSRUSA-N	434.305	1.113	50	20	IDGD	
O=C(c1ccc(Cl)cc1F)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1	1830080397	XHDSPVYTVMGSQJ-CRAIPNDOSA-N	435.279	1.149	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(=O)c4ccccc4o3)CCO2)C1	1830312978	VFGIANSQOXIZGR-OPAMFIHVSA-N	448.903	1.880	50	20	IDGD	
CCOc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)nn1	1830364398	IQHPBXSHUSVULZ-HXUWFJFHSA-N	440.928	1.210	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H]2CCC(=O)NC2)CC1	1831649754	NGABTZQKULAJTE-NUEKZKHPSA-N	428.371	1.916	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc4ccnn34)C2)C1	1831654570	VISKYSAZRMKXLX-UTKZUKDTSA-N	434.924	1.812	50	20	IDGD	
COc1ncccc1CCC(=O)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1833005235	XTJRTTLRSBLBKT-IBGZPJMESA-N	446.331	1.283	50	20	IDGD	
Cc1cc(C)n(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@](C)(Cl)CCl)C3)C2)n1	1833040296	CCLWAYGQMBQETP-RTBURBONSA-N	447.363	1.193	50	20	IDGD	
N#Cc1ccc(CCC(=O)N2CCC(N3CCC(NC(=O)[C@@H](O)CCl)CC3)CC2)cc1	1833307048	LTNMTGXEIDPZPZ-NRFANRHFSA-N	446.979	1.662	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)C3=NN(C)C(=O)CC3)CC2)CC1	1833689306	BABRXUIBZJOBIS-INIZCTEOSA-N	425.961	1.184	50	20	IDGD	
COc1ccc(C(=O)NC2CCN(C3CCN(C(=O)[C@H](O)CCl)CC3)CC2)s1	1833946597	KRTRSYPPFRMTJN-OAHLLOKOSA-N	429.970	1.542	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3ccc4cncn4c3)CC2)CC1	1835618458	XIUJYDNUJMQHKS-HXUWFJFHSA-N	447.967	1.773	50	20	IDGD	
Cc1nnsc1C(=O)N1CCC(N2CCC(NC(=O)CO[Si](C)(C)C)CC2)CC1	1835837425	HFJXPYOCUYCLPW-UHFFFAOYSA-N	439.658	1.883	50	20	IDGD	
C#CCO[C@@H](C)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](F)Br)CC2)CC1	1836413383	FBNHHFYWUPMGDP-XJKSGUPXSA-N	432.334	1.287	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc4c(c3)CNC4=O)CCO2)C1	1837152503	QBUDFHGKDIILES-LAUBAEHRSA-N	435.908	1.017	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3nccc4[nH]ccc34)C2)C1	1837711312	CZXJWXLITQQVEC-OAQYLSRUSA-N	446.580	1.484	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3nc4ccccn4n3)CC2)CC1	1838020986	CQORHRHWXZFFSU-QGZVFWFLSA-N	449.939	1.595	50	20	IDGD	
CCc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)nn1C	1838271771	XYQHAQSNFCFKDS-FQEVSTJZSA-N	426.945	1.318	50	20	IDGD	
CC(C)n1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)n1	1838790196	POIQTSXJJMYYGV-KDOFPFPSSA-N	443.342	1.317	50	20	IDGD	
CCn1nc(C(C)C)cc1C(=O)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1838813661	WHGQGSOGZIXZHD-LJQANCHMSA-N	447.363	1.900	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)nn1C	1839150872	AHJGORHZDAJCGU-MSOLQXFVSA-N	433.336	1.035	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccccc3)C2)C1	1839966042	SMOZUSIYVZFSRL-LPHOPBHVSA-N	425.323	1.930	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(F)c(C)cc3F)C2)C1	1840155935	GLXAECBYNPHVPS-MGPUTAFESA-N	446.878	1.597	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(F)(F)Cl)CCO2	1840283215	QEAGSQNSNORKKG-ZWNOBZJWSA-N	433.677	1.305	50	20	IDGD	
O=C([C@@H](F)Cl)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)c1ccccc1Cl)CCO2	1840317214	OLAZHBFVOLASPP-IIDMSEBBSA-N	435.279	1.364	50	20	IDGD	
O=C([C@@H]1CCCS1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1840578699	BAQSBGYLWYEILB-HUBLWGQQSA-N	425.320	1.029	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC2(CCCN2C(=O)c2ccc(=O)oc2)C1	1842575213	ZEFXUBRVTUBIFA-AWEZNQCLSA-N	439.896	1.589	50	20	IDGD	
CCn1nc(C(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)c2ccccc21	1843183492	JNPAKTQHLNDOFS-UHFFFAOYSA-N	447.499	1.186	50	20	IDGD	
CC1(C)Cc2cccc(C(=O)N3CC4(CCCN4C(=O)c4cnccc4C(=O)NN)C3)c2O1	1844264077	BAGSGSQHIJWEKF-UHFFFAOYSA-N	449.511	1.529	50	20	IDGD	
Cc1ccc(SCC(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)cc1	1844264277	AUTCABVTBOCYFV-UHFFFAOYSA-N	439.541	1.603	50	20	IDGD	
Cc1cc2[nH]c(C(=O)N3CC4(CCCN4C(=O)c4cnccc4C(=O)NN)C3)cc2s1	1844265129	WTHIIIYISZQOMM-UHFFFAOYSA-N	438.513	1.667	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)C1(CNC(=O)OC(C)(C)C)CC1	1847302394	NEVFHEZSHJJUIC-ILXRZTDVSA-N	429.945	1.747	50	20	IDGD	
CC(C)(C)OC(=O)N1CC2(CC2)C[C@H]1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl	1847558321	KQAMBEOTZIZUQF-VGWMRTNUSA-N	441.956	1.578	50	20	IDGD	
COc1cn(-c2ccccc2)nc1C(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	17599379	KHXLMUAKSGADJX-UHFFFAOYSA-N	439.384	1.407	50	20	IDGD	
CN1C(=C(C#N)C(=O)COC(=O)c2ccc(N3CCOCC3)nc2)N(C)c2ccccc21	22887149	PVRKWPZDYKJBRW-UHFFFAOYSA-N	433.468	1.965	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)CCn3cncn3)c2)c(C)c1	23447528	LOCYRXIALCCTEN-UHFFFAOYSA-N	442.501	1.547	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)c1cccc(S(=O)(=O)NC2CC2)c1	24123459	ZXSIFLQLBCQTNC-UHFFFAOYSA-N	427.280	1.293	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1cnc2c(cnn2C(C)C)c1	25955498	FSBXHGPRFUGNFP-UHFFFAOYSA-N	429.506	1.689	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(-c3ccco3)[nH]n2)c1	28272150	NCTMYCAJSGFBOD-UHFFFAOYSA-N	431.474	1.775	50	20	IDGD	
CCCCCCNC(=O)[C@H]1CCCN(C(=O)NNC(=O)CNC(=O)c2cccs2)C1	725873432	NNTVGYMNMMPMCQ-HNNXBMFYSA-N	437.566	1.627	50	20	IDGD	
CC(C)(CNC(=O)NNC(=O)CNC(=O)c1cccs1)N1CCc2ccccc2C1	726097643	NAVVQBRQQQNORI-UHFFFAOYSA-N	429.546	1.645	50	20	IDGD	
COc1ccc(CN2C[C@@H](C(=O)NNC(=O)c3cc(Br)c[nH]3)CC2=O)cc1	726523966	JAOTXTPNOUCGIM-LBPRGKRZSA-N	435.278	1.596	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)CSCC(=O)c2ccc(Cl)cc2)c2ccccc2c1=O	726883806	KWJPIUDXNRDZSM-UHFFFAOYSA-N	444.900	1.964	50	20	IDGD	
C[C@H](CC(=O)NNC(=O)c1ccc(CSc2nncn2C)cc1)NC(=O)C1CCCC1	727098521	CEWZKHRCGNLAKP-CQSZACIVSA-N	444.561	1.953	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)C[C@H](C)NC(=O)C2CCCC2)c2ccccc2c1=O	727098623	DQFDIBHCAFCLAH-AWEZNQCLSA-N	427.505	1.653	50	20	IDGD	
CNS(=O)(=O)c1cccc([C@H](C)NC(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)c1	727608613	BHUVWCYTAFLUHJ-QWHCGFSZSA-N	438.481	1.593	50	20	IDGD	
NS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2c(Cl)cccc2Cl)cc1	727860487	BGKONJVDUGKYLZ-UHFFFAOYSA-N	431.257	1.041	50	20	IDGD	
O=C(COC(=O)Cc1c[nH]c2cc(F)ccc12)NNC(=O)[C@H]1COc2ccccc2O1	728344861	RBLMKHPZCXAUNU-GOSISDBHSA-N	427.388	1.380	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)[C@@H]2CCCCN2S(C)(=O)=O)c1	728529970	WUOLDCAOXKFXPS-ZDUSSCGKSA-N	434.312	1.033	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CC[C@H](C(F)(F)F)NC1=O)c1cc(F)ccc1Br	728550061	XPECTJPQWCNGIV-GMSGAONNSA-N	426.164	1.806	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3cccc(C(=O)N(C)C)c3)cc2)CC1	728606400	HIUFCHBEHCYVNG-UHFFFAOYSA-N	445.545	1.081	50	20	IDGD	
O=C(NNC(=O)c1cnc2n(c1=O)CCS2)c1ccc(Br)cc1Cl	728869894	HWWAAUAFEMXYGR-UHFFFAOYSA-N	429.683	1.840	50	20	IDGD	
CCC[C@](C)(NC(=O)OC(C)(C)C)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	728889781	FDUHWLAKKYQGQU-NRFANRHFSA-N	434.541	1.924	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)Cc1c(C)nc(-c2ncccn2)nc1O	729282716	GMWBVRGNMDTANQ-UHFFFAOYSA-N	438.444	1.115	50	20	IDGD	
CC1(C)CN(CC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)CCN1Cc1ccccc1	729481624	VKNGMCUCXAIHHU-UHFFFAOYSA-N	425.489	1.952	50	20	IDGD	
N#Cc1cnn(-c2ccc(C(=O)NNc3ccc(S(=O)(=O)NC4CC4)cc3)cc2)c1N	729531679	OAVLLCRYCBXVDI-UHFFFAOYSA-N	437.485	1.524	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)Cc2c(C)nc3cc(O)nn3c2C)c1	729533542	NQYZIPRLEZAZHH-UHFFFAOYSA-N	448.277	1.827	50	20	IDGD	
COc1ccnc(NNC(=O)CC2(CC(=O)NNc3nccc(OC)n3)CCCC2)n1	729838974	VWSLRMDNLCPEBA-UHFFFAOYSA-N	430.469	1.211	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CS[C@H](Cc2ccccc2F)C(=O)N1)c1cccc2ncccc12	730226522	OIDHZPMJDZPJMU-RBUKOAKNSA-N	438.484	1.978	50	20	IDGD	
Cc1oc(-c2ccco2)nc1CC(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	732334625	BBLOWRDDYNRQFN-UHFFFAOYSA-N	428.357	1.698	50	20	IDGD	
C[C@H]1Cc2ccccc2N1Cc1occc1C(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1	732755161	PIJQPQOXGCGZPU-DZGCQCFKSA-N	432.502	1.362	50	20	IDGD	
COc1cccc(C[C@H](C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)n2nnnc2C)c1	733107059	UOMSMCLACRPMIH-HXUWFJFHSA-N	446.471	1.421	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)Nc1nc(CN2CCOCC2)cs1	733332929	SUZOOGORFQIYCP-UHFFFAOYSA-N	427.490	1.628	50	20	IDGD	
O=C(NC[C@H](c1ccccc1)N1CCOCC1)NNC(=O)c1cnn(-c2ccccc2)c1	733338727	JQVJRNFXWTUKBD-OAQYLSRUSA-N	434.500	1.890	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	733521130	PIMQQLTTZAQAEK-AWEZNQCLSA-N	436.421	1.299	50	20	IDGD	
Cc1cc(NNC(=O)CNC(=O)[C@@H]2c3ccccc3C(=O)N2Cc2ccccc2)ncn1	734254568	QTTXQGVCPGKHST-NRFANRHFSA-N	430.468	1.742	50	20	IDGD	
O=C(Cn1nnc2ccccc2c1=O)NNc1cc(C(F)(F)F)nc(-c2cccnc2)n1	734257767	PEVBDMAPOYPJCG-UHFFFAOYSA-N	442.361	1.806	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNS(=O)(=O)c1c(C)nn(C(C)C)c1C	734418504	JNBMFXYBHLHGPK-UHFFFAOYSA-N	442.567	1.306	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)CCn2ccc3ccccc32)CC1	735118004	MJHTXRFCJZDXHS-UHFFFAOYSA-N	442.545	1.506	50	20	IDGD	
CC(=O)NCC(=O)N1CCc2cc(C(=O)NNC(=O)c3cc(C)nc4ccccc34)ccc21	735704214	TXFXMQSVCLYTFI-UHFFFAOYSA-N	445.479	1.643	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)NC[C@H](c1ccc(F)cc1)N1CCOCC1	738447982	RXCXQQZOEPRYAG-HXUWFJFHSA-N	430.480	1.746	50	20	IDGD	
Cc1cc(S(=O)(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc(C)c1F	742025734	HZLRZVHSDGGZQQ-UHFFFAOYSA-N	435.886	1.367	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNS(=O)(=O)c2ccc(C(=O)O)cc2F)c1	743257594	MXLQVYFJKCMPMN-UHFFFAOYSA-N	447.238	1.918	50	20	IDGD	
C[C@H](CN1CCN(c2ccccc2)CC1)NC(=O)NNC(=O)c1ccc2c(c1)OCCO2	743633347	MHLYRLHGSIIUBG-QGZVFWFLSA-N	439.516	1.613	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)c2sc(S(N)(=O)=O)cc2C)cc1Cl	743834506	IZGIOKIDUNIKHS-UHFFFAOYSA-N	448.910	1.841	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)CN2CCN(C(=O)c3c(F)cccc3F)CC2)cc1	744396042	BWJVDAAXWPQDSK-UHFFFAOYSA-N	427.411	1.055	50	20	IDGD	
CCCS(=O)(=O)Nc1cccc(C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)c1	744548549	WCJVUGISKKTTQI-UHFFFAOYSA-N	444.469	1.328	50	20	IDGD	
Cc1cc(-n2cncn2)ccc1C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	744621691	YRJUXUXZRYMTDN-UHFFFAOYSA-N	442.501	1.354	50	20	IDGD	
Cc1c(C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)nnn1-c1ccccc1Cl	744956426	MMVNXLPWCAVMQV-UHFFFAOYSA-N	438.831	1.719	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)CCNC(=O)N2CCc3ccccc3C2)c1	745057324	JTQIRWDYWMMFEE-UHFFFAOYSA-N	449.467	1.020	50	20	IDGD	
CC[C@@H]1Oc2cc([C@H](C)NC(=O)NNC(=O)CNC(=O)c3cccs3)ccc2NC1=O	745929303	BXFHJTFODZEHIW-FZMZJTMJSA-N	445.501	1.679	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)c1ccc2c(c1)C(=O)N(C[C@H]1CCCO1)C2=O	746556373	UUELVWDTBNJCTK-MRXNPFEDSA-N	447.451	1.113	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)c1cnn(CC(=O)NC2CCCCC2)c1	746575951	CAIJWTOHHNGODN-AWEZNQCLSA-N	431.468	1.700	50	20	IDGD	
O=C(NCc1ccco1)NNC(=O)c1ccc([N+](=O)[O-])cc1I	751372008	QEGIJYBXDRQAGV-UHFFFAOYSA-N	430.158	1.937	50	20	IDGD	
COCCN(C)S(=O)(=O)[C@H]1CCCN(C(=O)/C(C#N)=C\c2cc(C#N)n(C)c2C)C1	754708550	IFGBIVNNYYEUOJ-DDYRAIOVSA-N	433.534	1.011	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2ccc(C(=O)N(C)C)cc2)cc1	755445902	KPNISUAKDFUNKG-UHFFFAOYSA-N	447.517	1.170	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c(OC[C@@H]2CCCO2)c1	756205247	QAYWLTJSQMPJQU-KRWDZBQOSA-N	437.460	1.995	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)Nc2cc(F)cc(S(N)(=O)=O)c2)cc1	756514109	DXZRKCQRADCBPE-LLVKDONJSA-N	440.453	1.492	50	20	IDGD	
CC[C@H]1CN(CC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)CC[C@H]1NC(=O)OC(C)(C)C	757111074	QCSVIHXIDOCBQT-WMLDXEAASA-N	449.508	1.981	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)N[C@H]2CCN(C(=O)CCc3ccccc3)C2)nc2ccccc21	757273221	JJEFYJVBNNNZQM-SFHVURJKSA-N	448.527	1.680	50	20	IDGD	
CN1C(=O)CC[C@H](C(=O)NNc2ccc(C(N)=O)nn2)[C@@H]1c1ccc(C(F)(F)F)cc1	757404272	OARYPLAWKHQACM-LRDDRELGSA-N	436.394	1.647	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccc(-c3ccccc3)nn2)c1	757660322	CQFXDQJZDFTSTM-UHFFFAOYSA-N	440.485	1.860	50	20	IDGD	
C[C@@H]1C[C@@H](NC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])CN1Cc1ccccc1	757769033	VICJQFZCHJUHHS-NVXWUHKLSA-N	427.461	1.967	50	20	IDGD	
CCS(=O)(=O)N1CCC(CNC(=O)NNC(=O)c2ccc(Cl)cc2OC)CC1	758741070	CAQMHIUHNCOJJB-UHFFFAOYSA-N	432.930	1.354	50	20	IDGD	
O=C(NCCOc1cccc(C(F)(F)F)n1)NNC(=O)[C@@H]1COc2ccccc2O1	758949978	XFFUFWJRGNYTPS-ZDUSSCGKSA-N	426.351	1.650	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NC[C@@H]2CN(Cc3ccccc3)CCCO2)cc1	759341260	FNRHHBVGMOJBNL-OAQYLSRUSA-N	442.516	1.696	50	20	IDGD	
CN(Cc1ccccc1)S(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)C(C)(C)C)cc1	761071312	BYFCVGQXTQRTDR-UHFFFAOYSA-N	446.529	1.639	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(OCc2ccccc2)nc1	763441694	HFCGQXRPSCPZDB-UHFFFAOYSA-N	435.396	1.969	50	20	IDGD	
CC(=O)N(C)c1cccc(NC(=O)C(=O)NNC(=O)c2ccccc2Br)c1	763483433	SGDCBHRFWFPKSM-UHFFFAOYSA-N	433.262	1.832	50	20	IDGD	
CCc1ncsc1NC(=O)C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	763530257	GWYDUTNJNMXQCR-UHFFFAOYSA-N	430.534	1.004	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2c[nH]c3ccccc23)cccc1C(=O)N1CCOCC1	763536948	YEUZDVWFKKUBLV-UHFFFAOYSA-N	449.467	1.348	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)Nc1cnccc1-c1cccc(F)c1	763571648	NPFSLEDZFZKYQD-LJQANCHMSA-N	436.399	1.814	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)Nc1cccc(OCc2cccnc2)c1	763573826	USKOZMYHANDOFX-HXUWFJFHSA-N	448.435	1.587	50	20	IDGD	
CC(C)Cn1ncc(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1C(C)C	763574610	GLTHLVGRCAAFDZ-KRWDZBQOSA-N	429.477	1.588	50	20	IDGD	
Cn1nc(C2CCCCC2)cc1NC(=O)C(=O)NNC(=O)[C@H]1COc2ccccc2O1	763579461	VIRNYPXNBUPBNF-QGZVFWFLSA-N	427.461	1.394	50	20	IDGD	
CN(C)C(=O)c1cccc(NC(=O)C(=O)NNC(=O)COc2ccc(C(C)(C)C)cc2)c1	763594570	JHGXZLJBBPDMJH-UHFFFAOYSA-N	440.500	1.851	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(-n3nccn3)nc2)c(C)n1-c1ccccc1	763600289	DYFFDQJUBUYHRC-UHFFFAOYSA-N	444.455	1.470	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(N3CCOCC3)c(F)c2)c1	763625005	QLDAYSMBDOGBFC-UHFFFAOYSA-N	430.436	1.136	50	20	IDGD	
COc1ccc(OC(F)F)c(NC(=O)C(=O)NNC(=O)c2c(C)nc3ccccn23)c1	763627808	DSHCFLNUVZGDCX-UHFFFAOYSA-N	433.371	1.652	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccnn1-c1ccccc1C	763682681	TYYPEEBTFIXVQL-UHFFFAOYSA-N	437.456	1.744	50	20	IDGD	
Cc1cnn(-c2ccc(NC(=O)C(=O)NNC(=O)COc3ccc(C#N)cc3)cc2F)c1	763682797	ZSVDLXZIURGBBC-UHFFFAOYSA-N	436.403	1.356	50	20	IDGD	
O=C(COc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1ccn(Cc2ccncc2)n1	763686670	PCJQNMQEVXFBKF-UHFFFAOYSA-N	428.836	1.145	50	20	IDGD	
CC(C)(C)Cc1nc(-c2ccc(C(=O)NNC(=O)CNC(=O)c3cccnc3)cc2)no1	763826145	WUTPPACZNKWQSY-UHFFFAOYSA-N	436.472	1.911	50	20	IDGD	
CSc1cc2c(cc1NC(=O)C(=O)NNC(=O)COc1ccc(F)cc1)OCCO2	763840864	ZOLGOAZJULGGIP-UHFFFAOYSA-N	435.433	1.484	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)C(=O)Nc1ccn(CCC#N)n1	763882497	JMHPNLCGUPSUMV-LLVKDONJSA-N	449.265	1.113	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccc(C(=O)N3CCC(C)CC3)cc2)n1	763884312	FIOXHWVBBLQGSR-UHFFFAOYSA-N	440.504	1.158	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2cccc(C(=O)Nc3ccccc3)c2C)n1	763886334	UGNLHPXUMOVIPU-UHFFFAOYSA-N	448.483	1.847	50	20	IDGD	
COCCOc1ncccc1NC(=O)C(=O)NNC(=O)c1ccc(Br)s1	763941666	ROGXJRNJUHSCND-UHFFFAOYSA-N	443.279	1.331	50	20	IDGD	
CCOc1cc(Br)c(NC(=O)C(=O)NNC(=O)c2ccc[nH]2)cc1OCC	763981096	UJQJDQODAKEKHU-UHFFFAOYSA-N	439.266	1.974	50	20	IDGD	
COc1cc(OC)c(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)cc1Cl	763996217	WSPKLHAGKRGZFJ-UHFFFAOYSA-N	445.657	1.848	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)C(=O)Nc1cccc(N2C(=O)c3ccccc3C2=O)c1	763999052	MLPYAOAOYBWYOR-UHFFFAOYSA-N	431.408	1.225	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1ncn(Cc2ccccc2)n1	764013042	WBKUOPFPOVMUSI-UHFFFAOYSA-N	428.836	1.388	50	20	IDGD	
COC(=O)N(C)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2OC)cc1	764013224	YGSQCTANYWIEMP-UHFFFAOYSA-N	434.836	1.951	50	20	IDGD	
CC[C@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)CCc2ccc(OC)cc2)cc1	764126556	IUEPNIBDZAYAGM-HNNXBMFYSA-N	440.500	1.942	50	20	IDGD	
O=C(CCCc1ccccc1)NNC(=O)C(=O)Nc1cnn(CC(=O)NC2CCCC2)c1	764224319	QHYVPTOSTIDOOJ-UHFFFAOYSA-N	440.504	1.051	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3cccc(C#N)c3)cc2F)C[C@H](C)O1	764234821	KTLBTYDNMCCPKN-KBPBESRZSA-N	439.447	1.711	50	20	IDGD	
CC(C)(C)NC(=O)c1ccccc1NC(=O)C(=O)NNC(=O)Cn1ccc2ccccc21	764243066	LFNRIYQDBWRCPX-UHFFFAOYSA-N	435.484	1.956	50	20	IDGD	
CC(C)(C(=O)NNC(=O)C(=O)Nc1cc(S(C)(=O)=O)ccc1Cl)c1ccccc1	764308538	DHPGVLPFOQDQMI-UHFFFAOYSA-N	437.905	1.807	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cccnc2Cl)cc1Br	764327009	SRHIOIDMFHNSJP-UHFFFAOYSA-N	427.642	1.906	50	20	IDGD	
COc1ccc2cc(NC(=O)C(=O)NNC(=O)c3cnn(-c4ccccc4)c3)ccc2n1	764342224	DOLKVXNQPDSIAK-UHFFFAOYSA-N	430.424	1.829	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1cc(C(C)C)nn1-c1ccc(C)cc1	764398154	DOMUVYOCJVNQMM-HNNXBMFYSA-N	431.493	1.442	50	20	IDGD	
O=C(Cc1csc2nccn12)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	764545294	UBNVPSAYTYNRDC-UHFFFAOYSA-N	433.515	1.184	50	20	IDGD	
CC(C)(C)CC(=O)N1CSC[C@@H]1C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C	765322070	GMPCGCCLMMFFTH-CYBMUJFWSA-N	430.571	1.776	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(CNC(=O)NNc2ncnc3ccsc23)cc1	765662612	TXAQTPBLZXPJIN-UHFFFAOYSA-N	436.519	1.442	50	20	IDGD	
O=C(COc1ccc(F)cc1Cl)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765734280	XNLNNCFJIJMWSH-UHFFFAOYSA-N	448.882	1.463	50	20	IDGD	
O=C(CCSc1ccccc1F)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765736385	QNAMIGBPVKUDBM-UHFFFAOYSA-N	444.532	1.913	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)COc1cccc(N2CCCC2=O)c1	767264704	FKHMWQVSPOVLHD-UHFFFAOYSA-N	439.468	1.434	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)c2ccc(N3C(=O)CCC3=O)c([N+](=O)[O-])c2)c1	767415105	NOKPJFCQAWRVFW-UHFFFAOYSA-N	440.412	1.705	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)c2cccc(-c3nc[nH]n3)c2)CC1	767540840	QHOIQOMDHKCEMV-UHFFFAOYSA-N	429.481	1.815	50	20	IDGD	
CC(Cc1ccncc1)=NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1	767790614	DJCRTOCBSRCBDX-UHFFFAOYSA-N	429.546	1.431	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2ccc3c(c2)nc(O)n3CC(F)(F)F)C[C@@H](C)O1	767822741	OCCPFNIRRIXXRA-TXEJJXNPSA-N	443.426	1.565	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1cnc(Cl)c(Br)c1	768231760	HTVYNFPXIDQKND-UHFFFAOYSA-N	442.613	1.805	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)CCc3nnc(C(C)C)o3)n[nH]2)cc1OC	768280299	YFYNXNQFRHHBBI-UHFFFAOYSA-N	428.449	1.994	50	20	IDGD	
COc1ccc(NNC(=O)CCCNS(=O)(=O)c2ccc(F)cc2)c([N+](=O)[O-])c1	768338935	RNEFJUCVTRDMCU-UHFFFAOYSA-N	426.426	1.944	50	20	IDGD	
CSCCNC(=S)NNC(=O)c1sc2nc3n(c(=O)c2c1C)CCCCC3	769769502	VABYJPAETJIKJJ-UHFFFAOYSA-N	425.605	1.965	50	20	IDGD	
Cn1c(CNC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)nc2cccc(Cl)c21	773136857	VPEATOIVCFXNGO-UHFFFAOYSA-N	425.840	1.347	50	20	IDGD	
COc1cc([C@@H](C)NCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc(OC)c1OC	774962034	UBISGNNITMMQBT-GFCCVEGCSA-N	432.433	1.732	50	20	IDGD	
CN(NC(=O)C[C@@H]1Oc2ccccc2NC1=O)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776200749	AHUBPEWFKBYOTB-INIZCTEOSA-N	447.492	1.412	50	20	IDGD	
CN(C(=O)OC(C)(C)C)[C@H](C(=O)NNc1nc(-c2ccncc2)no1)c1cnn(C)c1	776343362	DODSSMYQKMALRF-AWEZNQCLSA-N	428.453	1.916	50	20	IDGD	
CC(C)N1C(=O)C[C@@H](C(=O)NNC(=O)C(=O)N2CCCC2)[C@H]1c1ccc(Cl)c(F)c1	776472939	FRKHGCLGWZWDGQ-CXAGYDPISA-N	438.887	1.547	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)[C@@H]2CC(=O)N(c3ccc(OCC)cc3)C2)nc1C	778422164	KLKAROJAFUWAFX-CQSZACIVSA-N	427.461	1.857	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)[C@@H](NS(=O)(=O)c2ccc(C)cc2)C(C)C)nc1C	778425894	HQXSNDAZPVZAOJ-KRWDZBQOSA-N	449.533	1.716	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)CCn2c(S)nc3ccccc3c2=O)nc1C	778429093	HYOBOTHTVMHRGR-UHFFFAOYSA-N	428.474	1.494	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)Nc2ccc(NC(=O)CN3CCOCC3)cc2)c1	780470959	FSFRFBDBRPCFGX-UHFFFAOYSA-N	427.461	1.893	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNS(=O)(=O)c1cc(F)cc(C(=O)OC)c1	782249582	MGOWIBLCAZVMOU-UHFFFAOYSA-N	426.422	1.400	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)cc1)C(=O)Nc1ccc(OC(F)F)cc1OC(F)F	782832593	PGHIPAWXLKFXQI-UHFFFAOYSA-N	431.298	1.995	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccc(OCC3CC3)cc2)nc1	783262146	BKPFGZRMHCXJDG-UHFFFAOYSA-N	447.517	1.639	50	20	IDGD	
O=C(NNc1ccc(-n2cccn2)nn1)C(=O)Nc1ccc(C(=O)Nc2ccccc2)cc1	783433183	NEJAVRLAWKPDTO-UHFFFAOYSA-N	442.439	1.996	50	20	IDGD	
COC(=O)[C@@H](Cc1ccc(F)cc1)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	783571045	IZKHWAAIRAYOLP-LJQANCHMSA-N	449.504	1.629	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1cccc(SC(F)F)c1	784005402	ZBVMPYXEYYLDDJ-UHFFFAOYSA-N	428.442	1.579	50	20	IDGD	
O=C(NNc1cccnn1)C(=O)Nc1ccc(Cl)c(S(=O)(=O)N2CCCCC2)c1	784858632	RXECPFDGQNUULP-UHFFFAOYSA-N	438.897	1.386	50	20	IDGD	
Cc1ccc(F)c(NNC(=O)C(=O)Nc2cccc(S(=O)(=O)N3CCN(C)CC3)c2)c1	784884343	VCPYFHIMKZOCSF-UHFFFAOYSA-N	449.508	1.152	50	20	IDGD	
O=C(NNc1ncc(F)cn1)C(=O)Nc1ccc(Cl)c(S(=O)(=O)N2CCCC2)c1	784950330	YGIQFWSHXLYFSO-UHFFFAOYSA-N	442.860	1.135	50	20	IDGD	
CN(C)c1nccc(NNC(=O)C(=O)Nc2cccc3c2CCN3C(=O)OC(C)(C)C)n1	784970226	UOIWTZLIWSDJQC-UHFFFAOYSA-N	441.492	1.922	50	20	IDGD	
COCCCOc1cccc(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)c1	785068183	VSOJPTYQFOYBIX-UHFFFAOYSA-N	425.445	1.078	50	20	IDGD	
O=C(NNc1cc(F)c(F)c(F)c1)C(=O)Nc1cccc(N2CCCS2(=O)=O)c1	785083463	NMAKOLBGQAUSBB-UHFFFAOYSA-N	428.392	1.726	50	20	IDGD	
Cn1nc(-c2ccsc2)cc1NC(=O)C(=O)NNC(=O)Cc1nc2ccccc2n1C	787556341	GXTZAEDUTJAOCL-UHFFFAOYSA-N	437.485	1.364	50	20	IDGD	
COc1ccc(F)c(C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)c1OC	788145411	UYZXJVGOFGMQQW-UHFFFAOYSA-N	439.465	1.233	50	20	IDGD	
CCc1nc(NC(=O)C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)sc1C	789749004	GQHIJGKNKKQSJA-UHFFFAOYSA-N	438.535	1.015	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)[C@H](C)NC(=O)c1ccc(Br)s1	790063307	HIVGFSGVDGBBDA-VIFPVBQESA-N	436.328	1.566	50	20	IDGD	
CC(C)(C)n1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)nn1	790103285	FNOCLKNYCNCNBX-UHFFFAOYSA-N	434.522	1.283	50	20	IDGD	
COCC[S@](=O)Cc1cccc(NC(=O)C(=O)NNc2cccc(F)c2[N+](=O)[O-])c1	790999223	PMDGPVNINRJRPR-PMERELPUSA-N	438.437	1.711	50	20	IDGD	
COc1ccc(OC)c(C2=NO[C@@H](C(=O)NNC(=O)COc3ccccc3OC)C2)c1	792015048	SEOCGXLARKOSOF-LJQANCHMSA-N	429.429	1.432	50	20	IDGD	
Cc1cc(S(=O)(=O)NNC(=O)CNC(=O)OCc2ccccc2)cc(C(=O)O)c1C	794598433	FKBRHFZFPCIFBG-UHFFFAOYSA-N	435.458	1.238	50	20	IDGD	
CCOC(=O)c1cc(S(=O)(=O)NNC(=O)c2cnn(-c3ccccc3)c2)ccc1C	795325285	LRLBLEMYCZQVEX-UHFFFAOYSA-N	428.470	1.981	50	20	IDGD	
Cc1nc2cc(F)c(F)cc2n1CC(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	796007246	GVBVMTMLIPSSNK-UHFFFAOYSA-N	447.354	1.536	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CNC(=O)OCc2ccccc2)c2cccnc12	797368844	HXWCPKJVQXRECD-UHFFFAOYSA-N	435.440	1.556	50	20	IDGD	
COCC(=O)Nc1ccc(NC(=O)NNC(=O)CNC(=O)OCc2ccccc2)cc1	797612340	BAJPYVBMHKFSFI-UHFFFAOYSA-N	429.433	1.351	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCCCNC(=O)/C=C/c2ccccc2)c1	800072904	MIFCBCOOGIDOEC-VAWYXSNFSA-N	444.513	1.254	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)[C@H]1CS[C@@H](Cc2ccccc2F)C(=O)N1	804951426	ROGGUNISLSFJAM-CABCVRRESA-N	427.465	1.087	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)[C@H]1CCCN(C(=O)c2ccc3n[nH]cc3c2)C1	804958913	RVYUEELCVCFZJX-HNNXBMFYSA-N	431.460	1.534	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNc2nccc(OC)n2)c(C)cc1Br	806983738	DXUADWDGNXQCON-UHFFFAOYSA-N	438.238	1.425	50	20	IDGD	
C[C@H]1CSC[C@H]1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	807478608	VCHFVBAQAUWROF-XJKSGUPXSA-N	426.564	1.557	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)NCCn2cc(Br)cn2)cc1	807532282	LXEFIYWIGJZLCX-LBPRGKRZSA-N	440.298	1.842	50	20	IDGD	
COC(=O)c1c(F)ccc(NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)c1F	810387489	YCVJXGFWUPSQIW-UHFFFAOYSA-N	427.747	1.510	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3c[nH]nc3-c3ccccn3)CC2)cc1	810593861	LKMJLELCEASRPR-UHFFFAOYSA-N	433.516	1.359	50	20	IDGD	
COc1ccc(C[C@](C)(O)CNC(=O)NNC(=O)Cn2ccc3ccccc32)cc1OC	811875302	BGNHZAKKMXKUFK-QHCPKHFHSA-N	440.500	1.983	50	20	IDGD	
CN(CCOc1ccc(S(N)(=O)=O)cc1)S(=O)(=O)c1ccc(CCCl)cc1	814283128	BLSLKSHLGYTQRA-UHFFFAOYSA-N	432.951	1.815	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)Nc1ccc([C@@H]2CCOC2)cc1	815567808	MTIANJJJXKUBSP-GFCCVEGCSA-N	435.278	1.691	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2ccc(N(C(C)=O)C3CC3)cc2)cc1	815568482	JVKYNEDRTUSVQY-UHFFFAOYSA-N	438.484	1.929	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)CCCC[C@@H]1SC[C@H]2NC(=O)N[C@H]21	817053456	SFUDWIYCUOUDIQ-JKIFEVAISA-N	441.579	1.106	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)Nc2ccc(C(=O)NCCC(N)=O)cc2)c1C	817112775	ASZLUZCLSGZOQB-CPNJWEJPSA-N	437.500	1.902	50	20	IDGD	
Cc1c(NC(=O)CSCC(=O)NNC(=O)CC2CC2)c(=O)n(-c2ccccc2)n1C	819122472	BXSXGWGFNGSOHM-UHFFFAOYSA-N	431.518	1.104	50	20	IDGD	
CCn1c(NNC(=O)CN(C)S(=O)(=O)c2ccc(C)c(C)c2)nc2ccccc2c1=O	880073367	BIJGWPFICJZWKX-UHFFFAOYSA-N	443.529	1.797	50	20	IDGD	
Cn1ccc(C(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)cc1=O	912999524	MIJAQMZZQQUOGY-UHFFFAOYSA-N	429.440	1.162	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)CN2C(=O)[C@@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2=O)cc1OC	913069851	SIUHETYSPRWPAC-AFHBHXEDSA-N	441.484	1.442	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)COc2cccc([N+](=O)[O-])c2)cc1	914747821	OHEJZGKXKJRFLS-UHFFFAOYSA-N	442.457	1.856	50	20	IDGD	
COc1ccnc(NNC(=O)c2ccc(OC)c(S(=O)(=O)N3CCCCCC3)c2)n1	914763108	NIZITCRCPOXSTE-UHFFFAOYSA-N	435.506	1.815	50	20	IDGD	
CC(C)(C)c1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)[nH]n1	915686232	ZOXHQSSQTDLMDA-UHFFFAOYSA-N	433.534	1.957	50	20	IDGD	
CCCCS(=O)(=O)N1CCC(C(=O)NNC(=O)c2cc(OC)cc(OC)c2)CC1	916034698	BTZZYNSQBKWOCL-UHFFFAOYSA-N	427.523	1.307	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)NCc2ccccc2S(=O)(=O)N(C)C)c2ccccc2n1	916237598	FIRHMTVBBIATHS-UHFFFAOYSA-N	441.513	1.938	50	20	IDGD	
CCN(CC)[C@H](CNC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)Cc1ccccc1	916443400	PMCFXBYNFDDFHS-FQEVSTJZSA-N	436.520	1.559	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CCNS(=O)(=O)/C=C/c2ccccc2)cc1C	916562105	LKWACWJESGOTNP-ACCUITESSA-N	444.513	1.370	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NC[C@H](c2ccc(C)cc2)N2CCOCC2)cc1	918099559	UCPKUSNXQRWJMS-OAQYLSRUSA-N	442.516	1.786	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(C(=O)CNC(=O)NNC(=O)c2ccc(Cl)cc2)CC1	918138447	RQXGWPJTFNTSMI-UHFFFAOYSA-N	439.900	1.363	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NC[C@@H](C)CN2CCCC2)c2ccccc2c1=O	918224081	XULVVZUBBZEUTK-MRXNPFEDSA-N	428.537	1.873	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)Nc2cccc(S(N)(=O)=O)c2)N(C)c2ccccc21	919686476	PTIOEMNINODWTA-UHFFFAOYSA-N	439.497	1.943	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1)c1ccccc1	919806962	XGDWPQLSXYEXME-HNNXBMFYSA-N	432.458	1.457	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)[C@H](CCSC)N1C(=O)[C@H]2CCCC[C@@H]2C1=O	920006369	JCFOZIUWGLOEQL-ULQDDVLXSA-N	447.557	1.682	50	20	IDGD	
O=C(NCc1cccc(NC(=O)[C@@H]2CCCO2)c1)NNC(=O)c1ccc2c(c1)OCCO2	920238423	WVWYVMZIEJIGTA-SFHVURJKSA-N	440.456	1.720	50	20	IDGD	
CS(=O)(=O)N1CCC[C@@H](NC(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)C1	920239256	ZGEUYCOHTAWEHF-LLVKDONJSA-N	444.457	1.030	50	20	IDGD	
CSC[C@@H](C(=O)NNC(=O)NCCc1cccs1)N1C(=O)[C@H]2CCCC[C@H]2C1=O	920860472	FHCUWQVUGBGXAJ-ZNMIVQPWSA-N	438.575	1.528	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)Nc2cccc(CN3C(=O)CNC3=O)c2)c1	920930992	ZOGKFDUMZODKJY-UHFFFAOYSA-N	425.445	1.587	50	20	IDGD	
Cc1nc(-c2ccc(Cl)s2)sc1C(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1	921030292	MUKDUHGOEPTGIJ-MRVPVSSYSA-N	434.952	1.965	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CNS(=O)(=O)c2cccc(Br)c2)cc1	1115813379	IZMIWHKSECMVAK-UHFFFAOYSA-N	442.291	1.197	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1ccc(COc2ccccc2)o1)C(=O)NCC(F)(F)F	1317934888	CMAALXKRHGSXNE-LLVKDONJSA-N	428.367	1.870	50	20	IDGD	
CN1CCN(c2ccccc2CNC(=O)NNC(=O)CSc2ccccc2O)CC1	1320376426	PAIDGVDWTXQSRF-UHFFFAOYSA-N	429.546	1.767	50	20	IDGD	
Cn1ccc(NNC(=O)c2ccc(NC(=O)C[C@H]3SC(N4CCCC4)=NC3=O)cc2)n1	1320948481	GRQHPLNSQOSCIT-OAHLLOKOSA-N	441.517	1.599	50	20	IDGD	
Cc1cc([C@@H](C)NC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)c(C)o1	1324500146	LPQVHGRCBFYQIQ-CQSZACIVSA-N	436.538	1.615	50	20	IDGD	
Cc1nn(C)c(C)c1S(=O)(=O)N[C@@H](C)C(=O)NNc1cncc(Br)c1	1335935379	SLCDWSLCAXBNRE-VIFPVBQESA-N	431.316	1.005	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Cl)C1	1778026490	VWTXHAYVPINFRT-RHJVYHOCSA-N	441.891	1.169	50	20	IDGD	
O=C(c1cc2cnccc2[nH]1)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1778678174	SBXHJNPOPUHHQM-WMLDXEAASA-N	425.258	1.697	50	20	IDGD	
Cc1nc2ncccn2c1C(=O)N1CCO[C@]2(CCN(C(=O)CO[Si](C)(C)C)C2)C1	1779296864	IYUSLFLORNHIAW-FQEVSTJZSA-N	431.569	1.333	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cccc(C(F)(F)F)n3)C2)C1	1779514394	CPTMTPDJZTWVOZ-YVEFUNNKSA-N	435.830	1.798	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)COc1cccnn1)C2	1780714357	BGIXLHDSBGILMR-MDASCCDHSA-N	445.347	1.606	50	20	IDGD	
CC(=O)N[C@@H](C(=O)N1CC[C@@]2(CN(C(=O)[C@H](F)Cl)CCO2)C1)c1cccc(Cl)c1	1780930256	PRVGXXSQBHQODP-GJYPPUQNSA-N	446.306	1.882	50	20	IDGD	
Cc1ccc(C(=O)C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](F)Br)C3)C2)cc1	1781334126	MJEXIYARAXVPET-MAUKXSAKSA-N	427.270	1.698	50	20	IDGD	
O=C(c1ccc(-c2cccnc2)cc1)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1781448051	DRRRBAPJOORXGZ-UGKGYDQZSA-N	429.904	1.792	50	20	IDGD	
CCOc1c(F)cc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)cc1Cl	1781848429	JUTRYPMLACXISB-KXBFYZLASA-N	449.306	1.921	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)Nc1cccnc1)C2	1782170393	KJHJDKINUHGFIP-NWUWZPLHSA-N	438.956	1.650	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C=C/c2cnc[nH]2)C1	1782433469	YCTAOZNTVLQEIS-XCACBCFESA-N	425.327	1.720	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)c1ccc([N+](=O)[O-])o1	1783363824	VASKVCKKHUXGEE-LKAMGYQZSA-N	434.218	1.472	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H]2[C@@H](C1)[C@@H]2C(=O)N1CC[C@]2(CN(C(=O)[C@@H](F)Cl)CCO2)C1	1783502186	MXPDOFWFPXGDLF-HOJQFNHUSA-N	445.919	1.464	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)CN(C)C(=O)OC(C)(C)C)CCO2)C1	1783532127	DLUXDNRFBUOXPI-SCLBCKFNSA-N	448.358	1.467	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H]2C[C@@]21C(=O)N1CC[C@]2(CN(C(=O)[C@H](F)Cl)CCO2)C1	1783553832	FPQQELRLWBKRHZ-NIHZBZNOSA-N	445.919	1.750	50	20	IDGD	
COC(=O)N(CC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Cl)CCO2)Cc1ccccc1	1783693070	XQPPSTKCEHDTHV-FXAWDEMLSA-N	441.887	1.619	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)CCCC(=O)OC(C)(C)C)CCO2)C1	1783872070	ZYPAGOQECFDKDM-FOIQADDNSA-N	432.945	1.582	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc([N+](=O)[O-])cc3F)CCO2)C1	1783881331	RPBXTRUDMYJKCC-KDOFPFPSSA-N	429.832	1.431	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cc3ccsc3[nH]1)CCO2	1783937299	RITZBQXTZULZQB-HXUWFJFHSA-N	433.534	1.046	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(-c4cnccn4)c3)C[C@@H]21)[C@@H](O)CCl	1784091568	XWJNKJBMAIXIPS-ZULIPRJHSA-N	444.919	1.337	50	20	IDGD	
Cc1nccn1CCCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2	1784405834	GJJQSQMYBOLJPE-HNAYVOBHSA-N	441.370	1.833	50	20	IDGD	
Cc1ccc(C)c(C(=O)N2CC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c1	1784972346	BMDWTAJIYMANTA-QHCPKHFHSA-N	437.500	1.059	50	20	IDGD	
Cc1cc(C)c(C(=O)N2CC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c(C)c1	1784988889	BFHLCOSTWZLFGI-HSZRJFAPSA-N	430.549	1.428	50	20	IDGD	
Cn1c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]32)cccc1=O	1785871126	MYENSHVDQLKMJY-VODUFIJXSA-N	430.332	1.215	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CC#N)[C@H]2C1	1786367345	JWYVZWVKEVKWAP-OWQGQXMQSA-N	430.417	1.027	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccnc3OCC3CC3)C[C@@H]21)[C@H](F)Cl	1787444340	VGSKZFHEHIALLS-HJWJTTGWSA-N	425.888	1.998	50	20	IDGD	
Cc1noc(N)c1C(=O)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1	1788009304	VWUDUULECKRBHJ-UHFFFAOYSA-N	434.261	1.307	50	20	IDGD	
Cc1nc(CC(=O)NC2(c3ccc(NC(=O)c4ccc(B(O)O)cc4)cc3)CCC2)no1	1788140445	YCXCDHNKEMUCSK-UHFFFAOYSA-N	434.261	1.048	50	20	IDGD	
Cc1cc(C(=O)NC2(c3ccc(NC(=O)c4ccc(B(O)O)cc4)cc3)CCC2)cc(O)n1	1788141122	MGXCDULXSGGAJO-UHFFFAOYSA-N	445.284	1.837	50	20	IDGD	
CC[S@@](=O)CCC(=O)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1	1789420303	RNLYAVQXGFQCBA-WJOKGBTCSA-N	442.346	1.273	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3ccccc3O)[C@H]2C1	1790900030	ISSWVHCERZJDOP-DYWXZXKOSA-N	425.323	1.698	50	20	IDGD	
CCC[C@@H](NC(C)=O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)Br)[C@H]2C1	1791064790	KROXJHCNEAJHMP-WGIXJMRHSA-N	432.359	1.054	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(C)(C)CCl)C[C@@H]21	1791230601	ZRIZGNXNUNNMNL-JCECYMMASA-N	440.968	1.987	50	20	IDGD	
C[C@@H](C(=O)NC1(c2ccc(NC(=O)CCC(=O)NN(C)C)cc2)CCC1)n1ccnn1	1791602500	IIAXDVNKPSPTPP-HNNXBMFYSA-N	427.509	1.346	50	20	IDGD	
CC[C@H](O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](Br)Cc1ccccc1)C2	1792864865	DMPADPZMPVZNCN-ADHGMGHFSA-N	439.350	1.353	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CCc3nc[nH]c3C1)C2	1792871954	FSUBJIYHEXBVSG-TVRNETQVSA-N	439.354	1.135	50	20	IDGD	
O=C(Cc1ccc(Cl)cc1[N+](=O)[O-])N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2	1792943070	AMLHRNNNJJALEK-OXUXUCFPSA-N	434.251	1.915	50	20	IDGD	
CCOC(=O)c1c(CCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](O)CCl)c[nH]c1C	1793107710	VPRNHLCYXVJKAG-YYIAUSFCSA-N	439.940	1.670	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1noc(C(C)C)n1	1794002927	IKUCAYHUSJYCIA-OQMKEHIESA-N	443.342	1.499	50	20	IDGD	
C[C@@H](Nc1cccnc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2	1795606225	WBYKFCLYJJWVNS-GGUBGCTKSA-N	429.290	1.162	50	20	IDGD	
C[C@@H]1[C@@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Cl)CCN1C(=O)OC(C)(C)C	1796370887	OJHLHBAXVJXANQ-XMEMRUQMSA-N	447.935	1.756	50	20	IDGD	
O=C1CN(c2cccc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)[C@H](F)Cl)n2)CCCN1	1796804164	MYCVQCWVYBCDOB-AHXJXLJNSA-N	437.903	1.194	50	20	IDGD	
CCOC(=O)c1ncn2c1CC[C@H](C(=O)N[C@@H]1C[C@@H]3CC[C@H](C1)N3C(=O)[C@@H](F)Cl)C2	1796811266	MOJVBLUBSDCEKR-JEJJNBGPSA-N	440.903	1.795	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cn3ccccc3n1)C2	1796892501	INDILTFZGNYGHD-CKFWPPNZSA-N	447.499	1.720	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnc2ncccn12	1797555390	ZLBLCPKOCFSPTF-LCFLCXBCSA-N	448.487	1.115	50	20	IDGD	
COc1cc(OC)cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Br)C3)c1	1798898687	JZKFOKQVJJDUHW-NOXHYTERSA-N	445.285	1.598	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CN(Cc3ccccc3)CCO1)C2	1799267910	HXTRQPLNYQRORN-SSTJLMRISA-N	449.979	1.494	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccnc3c1OCO3)C2	1799277887	VARGMRXEYMQHTB-ZSMOCIRGSA-N	430.288	1.250	50	20	IDGD	
COc1ccccc1CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Br	1799346487	AHMVYGYWMIENFE-RMHZUWNSSA-N	429.286	1.518	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnnc3ccccc13)C2)[C@H](F)Br	1799347802	TUCWUYSYGAHZIK-OJXGSEEGSA-N	437.269	1.524	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc(F)cc1F)C2	1800761930	JSBVBKHDGBUEGK-AKENFEQQSA-N	431.277	1.880	50	20	IDGD	
COc1ccc(/C=C(\C)C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)cc1	1801377699	RFDGHMYTRIFYGD-FSTFLSAYSA-N	448.328	1.730	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H]1CCC(=O)N1)C2	1801437730	XFYHQBCJVCZEOQ-HDAOGJMZSA-N	428.439	1.789	50	20	IDGD	
Cc1ccn(CC(=O)NC[C@@H]2CCN(C(=O)[C@@H](F)Br)[C@@H]2c2cccnc2)n1	1804623854	RBXOOJXXJSTNBY-USXIJHARSA-N	438.301	1.983	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC2(CCCN(C(=O)c3ccc(F)cn3)C2)CC1	1808716031	AGJDTQTXQXJWIH-UHFFFAOYSA-N	425.269	1.059	50	20	IDGD	
Cc1c[nH]cc1C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1	1810301938	DYPSUDSADNXTRV-JXFKEZNVSA-N	447.499	1.350	50	20	IDGD	
Cc1cccn2ncc(C(=O)NC[C@@H]3CCN(C(=O)[C@@H](O)CCl)[C@@H]3c3cccnc3)c12	1812268223	XKKUFHNNJDUEOL-XKGZKEIXSA-N	441.919	1.957	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2ccc([N+](=O)[O-])[nH]2)[C@H]1c1cccnc1	1813032719	LJCQXACJNRQONV-KEYYUXOJSA-N	435.868	1.891	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)CCN2CCOC2=O)[C@H]1c1cccnc1)C(Cl)Cl	1813079280	WXFMGWRCQCKCOT-HIFRSBDPSA-N	429.304	1.733	50	20	IDGD	
COCCCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1814747223	FYFXXPYRJJDWQH-INIZCTEOSA-N	429.481	1.141	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCN(C)C)n[nH]1	1817142270	IBKVVZNTFZGXBH-ZZQPOVDQSA-N	442.524	1.488	50	20	IDGD	
CC[C@H](NC)C(=O)N[C@H]1CCc2nc(NC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)sc2C1	1817280237	QUDBCFHQLADLJH-IJWZPVHRSA-N	445.549	1.187	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCBr)CC2	1817297067	VDLGOSCPRHVAQV-KOLCDFICSA-N	431.356	1.707	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccncn2)[nH]n1	1818111821	JXJLZKFIPHOVSO-FCLYZYNOSA-N	449.475	1.640	50	20	IDGD	
C=CCC(F)(F)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819403879	KVFNFKIQWZVSSA-OAHLLOKOSA-N	447.446	1.926	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1)c1ccc(O)c([N+](=O)[O-])c1	1821042156	ISCMWBXOLMBWKQ-IUODEOHRSA-N	437.840	1.929	50	20	IDGD	
N#Cc1ccc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cccc(B(O)O)c2)CC3)cc1	1822163609	ZUTJQFZVOPHDNW-KRWDZBQOSA-N	446.297	1.234	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(O)cc3)sc2C1	1822239120	DPDIOKRPUKUHFC-CYBMUJFWSA-N	431.518	1.448	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)C[C@@H]2NC(=O)NC2=O)CC1	1824011677	ZKPSVXGLZRLWGR-GJZGRUSLSA-N	426.945	1.469	50	20	IDGD	
COC(=O)[C@@H]1CC[C@H](C(=O)N2CCCC[C@H]2C2CCN(C(=O)[C@H](O)CCl)CC2)C1	1824172581	QQRCYUQSZQGLQV-XWTMOSNGSA-N	428.957	1.795	50	20	IDGD	
Cc1cc(NC(=O)CC(=O)N2CCC([C@@H]3CCCCN3C(=O)[C@@H](O)CCl)CC2)no1	1824182440	CEDSRXVGNNUUKL-HOTGVXAUSA-N	440.928	1.531	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CN1CCN(C)CC1)CC2	1825642555	XCGXAQZZTZSEPV-NWDGAFQWSA-N	444.399	1.086	50	20	IDGD	
Cc1ncc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)cn1	1825703982	XZZXVVFEFXDVOK-LJQANCHMSA-N	430.553	1.391	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccccc1C(N)=O)CC2	1826006613	KSYINVRCSXHEKE-GXFFZTMASA-N	436.921	1.722	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@H]1CCc2nc(NC(=O)C(F)(F)Cl)sc2C1	1826395483	MXSPMQANUHYGBN-ZETCQYMHSA-N	444.851	1.199	50	20	IDGD	
CN[C@H](CC(=O)N1CCCC[C@H]1C1CCN(C(=O)CO[Si](C)(C)C)CC1)C(=O)O	1826947056	SBBBDFFUPMWFBG-SJORKVTESA-N	427.618	1.520	50	20	IDGD	
Cc1ccc2nc(C(=O)N3CCOC[C@]4(C3)CN(C(=O)[C@@H](O)CCl)CCO4)ccc2c1	1830727833	HQMDHOZZCJRCEC-UGKGYDQZSA-N	447.919	1.213	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc(OC)c(C)c3)C2)C1	1831643960	MHZCDSPHXXABOP-DYESRHJHSA-N	439.940	1.876	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)Nc3nccs3)C2)C1	1831645588	CMTDPYUXOJZDFN-YZVOILCLSA-N	444.985	1.807	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)C2=NN(C)C(=O)CC2)CC1	1831828657	STIUTKAPRGUJDB-WBVHZDCISA-N	426.945	1.468	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(C#N)c[nH]2)CC1	1831873235	FENSNRXIRPQLKG-IBGZPJMESA-N	428.537	1.493	50	20	IDGD	
Cc1ncc(CC(=O)N2CCCC[C@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)s1	1832180604	YJGJXBMIBASXCZ-IBGZPJMESA-N	449.621	1.987	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H]3Cc4ccccc4O3)CC2)CC1)[C@@H](O)CCl	1833309850	BHMNRFSPIUMEDI-ICSRJNTNSA-N	435.952	1.161	50	20	IDGD	
CC(C)(C)n1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)n1	1833590029	BNIJQJQULNJWHS-SFHVURJKSA-N	433.336	1.512	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)c3ccnnc3)CC2)CC1	1834140492	MXYVHLBRIWSMAF-CQSZACIVSA-N	438.370	1.693	50	20	IDGD	
CC(=O)NC1CCN(C2CCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)CC2)CC1	1834551268	BRBDQZWWGWHLLS-UHFFFAOYSA-N	432.477	1.725	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)CN3CCOCC3)CC2)CC1	1834619034	ATRQCNYUNGXQOJ-LJQANCHMSA-N	429.005	1.298	50	20	IDGD	
COc1ccc(C(=O)N2CCOC[C@]3(CN(C(=O)CCBr)CCO3)C2)s1	1834818891	FQHNAXIREGJZPV-KRWDZBQOSA-N	447.351	1.612	50	20	IDGD	
COc1ccccc1C(=O)N1CCOC[C@@]2(CN(C(=O)CCBr)CCO2)C1	1834823722	FNZFICOLVZPKHR-LJQANCHMSA-N	441.322	1.550	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3nccc4nc[nH]c34)CC2)CC1	1835029051	JKODWYMZMNJBRC-MRXNPFEDSA-N	448.955	1.397	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cccn(C(F)F)c3=O)CC2)CC1)[C@H](F)Cl	1835083973	CQALFYBVEKSXEK-HNNXBMFYSA-N	448.873	1.963	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)c3cnc4ncccn34)CC2)CC1	1836394238	OKPXPSYGDSINQM-QGZVFWFLSA-N	432.956	1.932	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)CN3CCOC3=O)CC2)CC1	1836787763	GOGJASXUWPDIPK-CYBMUJFWSA-N	446.342	1.221	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4c(c3)COC4)C2)C1	1837713314	VOGFBCAAALJAEZ-JOCHJYFZSA-N	448.592	1.638	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc4ccnn34)C2)C1	1837715648	BWWQQRRGNCVGEM-OAQYLSRUSA-N	446.580	1.256	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)Cn3nccn3)CC2)CC1	1838655614	QRUDIMKOQQYQFH-ZDUSSCGKSA-N	428.331	1.060	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@H](C)n3ccnn3)CC2)CC1	1838730380	OQNYHMUDIPBZDQ-WMLDXEAASA-N	427.933	1.092	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3Cc4ccccc4CN3C)C2)C1	1839142057	CRELMGSZPBFZDI-MIZPHKNDSA-N	449.979	1.517	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)c(O)n1	1839153403	HMVFMRNXQSIMHJ-OALUTQOASA-N	446.331	1.402	50	20	IDGD	
O=C(c1ccc2occc2c1O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1839564368	INRKIKJUAOQHIB-QFBILLFUSA-N	426.828	1.743	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccn(C)c3)C2)C1	1839963894	ZUWYNXFFHMZJCF-MAUKXSAKSA-N	428.327	1.269	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(F)c3)C2)C1	1840034753	WOOYFAVYARPWKN-SCLBCKFNSA-N	429.286	1.679	50	20	IDGD	
Cc1ccn2c(C(=O)N3CCOC[C@]4(C3)CN(C(=O)C(Cl)Cl)CCO4)cnc2c1	1840189675	GCFMTIJCNDYSBK-IBGZPJMESA-N	441.315	1.516	50	20	IDGD	
C[C@H](Oc1cccnc1)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1840450214	VRHNMZBEZNRBCJ-KKSFZXQISA-N	439.940	1.570	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)c(Cl)c1	1840733623	LDZZKIRDGBTJJS-APWZRJJASA-N	447.315	1.018	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)COc2ccc(Cl)c(F)c2)C1	1841567233	FGEBUECMOQJZTM-UHFFFAOYSA-N	440.903	1.434	50	20	IDGD	
O=C(Cc1ccc2ccccc2c1)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843010771	BVYBQRPLFYMDQD-UHFFFAOYSA-N	428.297	1.579	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1cccc(F)c1F)C2	1843416530	VKAANQVGTNHVLU-DHRITJCHSA-N	429.427	1.916	50	20	IDGD	
Cc1ccn2c(=O)c(C(=O)N3CCCC34CN(C(=O)CCBr)C4)cnc2c1	1843786915	NNRQZPBJDHLKOW-UHFFFAOYSA-N	433.306	1.605	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)C2(C)CN(C(=O)OC(C)(C)C)C2)C1	1843948756	VYYLZNZSUBRKNU-AWEZNQCLSA-N	429.945	1.701	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)c1nc3c(=O)[nH]c4ccccc4n3n1)C2	1845165163	YDLRDORIIVGHRH-LBPRGKRZSA-N	428.880	1.405	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CO)C(=O)N1CC2(CCCN2C(=O)[C@](C)(Cl)CCl)C1	1845170278	IQCZHLFIQKIMFH-YVEFUNNKSA-N	438.352	1.312	50	20	IDGD	
CC(C)(C)OC(=O)NCC[C@@H](O)C(=O)N1CCCC12CN(C(=O)C(C)(C)CCl)C2	1845220572	AAMITTYUDYAOEI-CQSZACIVSA-N	431.961	1.731	50	20	IDGD	
O=C1CC[C@@H](C(=O)N2CC3(CCCN3C(=O)[C@@H](Br)Cc3ccccc3)C2)N1	1845940685	DTZRGIAIKSGJHJ-HOTGVXAUSA-N	434.334	1.475	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCCC12CN(C(=O)c1nc3ccccc3n(C)c1=O)C2	1846070698	YZPRCJRBZPFMGV-CYBMUJFWSA-N	447.333	1.924	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H]2C[C@@]21C(=O)N1CCCC12CN(C(=O)[C@@H](O)CCl)C2	1846187590	FZWUGINLYIGDSK-CKNLXJGOSA-N	427.929	1.189	50	20	IDGD	
COc1ccc(C(=O)N2CCCC23CN(C(=O)c2ccc(B(O)O)cc2)C3)cc1Cl	1846845012	ZBNBMBOOTOJODB-UHFFFAOYSA-N	428.681	1.159	50	20	IDGD	
O=C1CC[C@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](Br)Cc2ccccc2)CN1	1847323866	BPFPJRCKIVSBQD-MHORFTMASA-N	448.361	1.721	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl)C1CC1	1847557511	DOBIDVZUICRGSU-VGWMRTNUSA-N	429.945	1.481	50	20	IDGD	
CCn1c(SCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)nnc1-c1ccco1	8619955	KGTPONMZQALSRB-OAHLLOKOSA-N	429.458	1.638	50	20	IDGD	
O=C(CC[C@@H]1Cc2ccccc2NC1=O)NNC(=O)c1csc(N2CCOCC2)n1	11332004	DMYDAXHUJKLNOI-CQSZACIVSA-N	429.502	1.332	50	20	IDGD	
O=C(COC(=O)CCc1cnn(-c2ccccc2)c1)NNC(=O)c1cccc([N+](=O)[O-])c1	16257721	IBJOSZCLDIDMBB-UHFFFAOYSA-N	437.412	1.718	50	20	IDGD	
COc1ccccc1-n1nnnc1SCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	16485385	FIDANLRZTUFZMV-UHFFFAOYSA-N	429.418	1.132	50	20	IDGD	
CC(C)(C)NC(=S)NNC(=O)c1cc(S(=O)(=O)NC2CC2)ccc1Br	28716460	BSFKTYMKVKPPHG-UHFFFAOYSA-N	449.396	1.797	50	20	IDGD	
COC[C@@H](C)n1c(C)cc(/C=C(/C#N)C(=O)N2CCN(CC(=O)NC3CC3)CC2)c1C	105283703	AMHUTLUZBJKTHO-SYERDGIWSA-N	427.549	1.642	50	20	IDGD	
O=C(CCC1CCCC1)NCC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	726521727	PDAJDSSJFYHDJO-UHFFFAOYSA-N	429.565	1.433	50	20	IDGD	
O=C(CC(F)(F)F)NNC(=O)NCCCNC(=O)c1ccc(Br)cc1	726711105	HCCDCYDWIWHNRF-UHFFFAOYSA-N	425.205	1.852	50	20	IDGD	
CNS(=O)(=O)c1cccc([C@@H](C)NC(=O)NNC(=O)COc2ccc(C)c(C)c2)c1	727607315	BJXKTDOUMZCRIT-OAHLLOKOSA-N	434.518	1.682	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)c1cc(N2CCCC2=O)cc(C(F)(F)F)c1	728241500	RMQKEPPODFLMMB-UHFFFAOYSA-N	438.362	1.616	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1cc([N+](=O)[O-])ccc1NCc1ccccc1	728384014	BTVFVHAMHVUDQN-CQSZACIVSA-N	432.458	1.403	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNS(=O)(=O)c2ccc3c(c2)C(=O)OC3)c1	728508209	KVKWMAMCAGMKKF-UHFFFAOYSA-N	441.259	1.751	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NCc2ccc(CN3CCC(O)CC3)cc2)cc1	729621559	OKQLQAFXWKEJAG-UHFFFAOYSA-N	426.517	1.861	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)N[C@@H]3CCc4ccc(F)cc43)nc2)CC1	730130105	AHYQDEVEAHTXLK-GOSISDBHSA-N	448.524	1.470	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)CNC(=O)N1CCc2ccccc2C1	731863792	FKBKURBOPGRGFY-UHFFFAOYSA-N	426.473	1.379	50	20	IDGD	
O=C(COC(=O)C1CCC2(CC1)NC(=O)NC2=O)NN=C(c1ccccc1)c1ccccc1	732351187	WXHCYAFGVFQJPE-UHFFFAOYSA-N	448.479	1.867	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CN(CC(C)C)c2c(O)nc(=O)n(CC(C)C)c2N)cc1	733793650	OPRLTGXKDAGPDJ-UHFFFAOYSA-N	444.536	1.419	50	20	IDGD	
O=C(NNc1cnnc2ccccc12)[C@H]1CCCN1S(=O)(=O)c1cccc([N+](=O)[O-])c1	733808929	OBTXSJVFFOXZEY-GOSISDBHSA-N	442.457	1.834	50	20	IDGD	
O=C(NNC(=O)C(=O)N1CCCC1)N[C@H]1CCN(c2cccc(OC(F)(F)F)c2)C1	734067345	KCKOWZJYJKKJOY-LBPRGKRZSA-N	429.399	1.117	50	20	IDGD	
COCCCNC(=O)NNC(=O)[C@@H]1CCC(=O)N(C)[C@@H]1c1ccc(C(F)(F)F)cc1	734427104	AQXRWAMBSWETDC-GDBMZVCRSA-N	430.427	1.982	50	20	IDGD	
Cc1cccc(-n2cc(C(=O)NNC(=O)NC3CCN(C(=O)OC(C)(C)C)CC3)nn2)c1	734825312	AOAKGXUFTLICEM-UHFFFAOYSA-N	443.508	1.919	50	20	IDGD	
CC(=O)N1CCCc2ccc(S(=O)(=O)NNC(=O)c3cnn(-c4ccccc4)c3)cc21	736063156	KXYXALMSOLSPKA-UHFFFAOYSA-N	439.497	1.795	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)NC2CCN(C[C@@H]3CCOC3)CC2)cc1	737055714	FEWVWJNWFOWLDI-IRXDYDNUSA-N	434.537	1.684	50	20	IDGD	
NS(=O)(=O)CCCNC(=O)C(=O)Nc1ccccc1S[C@@H](Cl)C(F)(F)F	737254138	KLQOITIVZOUOJK-GFCCVEGCSA-N	433.861	1.639	50	20	IDGD	
CC[C@H](C)c1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)C(C)(C)C)CC2)cc1	744382938	DKWWPQKHOKPFRO-INIZCTEOSA-N	438.594	1.700	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)c1cc(S(N)(=O)=O)c(Br)s1	744469813	IYIFLHXSVLFBSO-UHFFFAOYSA-N	448.320	1.170	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)O[C@H](C)C(=O)N(C)C)cc1	746159811	MQXSMRHXVODJDT-DSQDWWTGSA-N	439.472	1.361	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)c1ccc(F)c(S(=O)(=O)Cc2ncon2)c1	746238712	QOQVDMNUZXWLHA-UHFFFAOYSA-N	436.396	1.325	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCN(C(=O)OC(C)(C)C)CC2(C)C)n1	746481463	RSHFUACUBFSULO-UHFFFAOYSA-N	425.555	1.473	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)c1cnn(CC(=O)NC2CCCCC2)c1	746579639	KOXRKEYBGVIYKH-UHFFFAOYSA-N	443.504	1.571	50	20	IDGD	
COC(=O)c1ccsc1N1CC[C@@H](NC(=O)NNC(=O)c2c[nH]c3ccccc23)C1=O	746780190	MWQOPULFYGXBLE-OAHLLOKOSA-N	441.469	1.766	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCCCc2nc3ccccc3[nH]2)c2ccccc2c1=O	749347716	ZDNYKFXVLMHJSH-UHFFFAOYSA-N	433.472	1.870	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@H](C)N2C(=O)[C@H]3CCCC[C@@H]3C2=O)cc(OC)c1OC	750548054	NWGWKWZKRIPSEF-UBHSHLNASA-N	433.461	1.037	50	20	IDGD	
CCOCCNC(=S)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	750972205	CHIGSARTZKDPLX-UHFFFAOYSA-N	428.561	1.694	50	20	IDGD	
CC(C)(C)NC(=O)CN1CCC(CNC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)CC1	751112764	ZZIWPQJFLUOEBJ-UHFFFAOYSA-N	434.497	1.166	50	20	IDGD	
Nc1cc(C(=O)OCC(=O)NNC(=O)c2cccs2)ccc1I	751700877	PZJUOPGOBJKOSD-UHFFFAOYSA-N	445.238	1.553	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1ccc2nc(O)n(C)c2c1	751862812	JDXRYEOADSAWPL-UHFFFAOYSA-N	432.820	1.559	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3ccc4nc(O)n(C)c4c3)CC2)cc1	752127986	VMXPTRZPMMWHMX-UHFFFAOYSA-N	436.516	1.166	50	20	IDGD	
COc1cc(OC)cc(N2C[C@H](C(=O)NNC(=O)COc3ccc(F)cc3)CC2=O)c1	752399043	PASIEOAEDQVZJJ-CYBMUJFWSA-N	431.420	1.422	50	20	IDGD	
Cc1cc(Cl)c(S(=O)(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1[N+](=O)[O-]	753067995	KBCXBERAVUYAEO-UHFFFAOYSA-N	437.825	1.156	50	20	IDGD	
COc1ccc([C@H]2[C@@H](C(=O)NNC(=O)CO)CCC(=O)N2c2ccc(C)cc2)cc1OC	753442281	CVZUUCHDJYJPAN-JTSKRJEESA-N	441.484	1.636	50	20	IDGD	
CS(=O)(=O)N1CC[C@H](CNC(=O)NNc2c(F)cc(F)cc2Br)C1	753661275	PNFZKBTVOJGAQA-MRVPVSSYSA-N	427.271	1.635	50	20	IDGD	
Cc1ncc(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)s1	754742147	ZJIFCQXFEBCSOG-UHFFFAOYSA-N	444.560	1.249	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)Cc2ccncc2)cc1S(=O)(=O)N1CCCCC1	755392642	JZMUDXGDWCTLQW-UHFFFAOYSA-N	431.518	1.960	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccn(-c3ccccc3)n2)c1	755481515	HLPGNVAHGVOWFW-UHFFFAOYSA-N	428.474	1.589	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)Nc2cccc(OCC(=O)N3CCCC3)c2)cc1	755659420	ZTXWVOLGLCIOOO-UHFFFAOYSA-N	437.456	1.791	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)Nc1ccc(CC(=O)N2CCOCC2)cc1	755861217	CENZYKTYEWVHOQ-UHFFFAOYSA-N	435.484	1.896	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2cccc(C(=O)N3CCOCC3)c2)c1	755933606	MAVRFMHNVODMFA-UHFFFAOYSA-N	446.485	1.029	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCc2cn(-c3ccccc3)nn2)c2ccccc2c1=O	756071144	IARWDTQGXMUIRQ-UHFFFAOYSA-N	432.444	1.141	50	20	IDGD	
CCCc1cnc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)s1	756174870	BDPIRJGZXVFLTI-UHFFFAOYSA-N	426.524	1.259	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)N[C@@H](C)c2ccc(-n3ccnn3)cc2)nc1	756758931	ULSMGGIKIUALEH-AWEZNQCLSA-N	444.521	1.736	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NN=Cc2cc(O)c(O)c(Br)c2)ccc1Cl	757564378	SLMYBOMIWASNPG-UHFFFAOYSA-N	448.682	1.925	50	20	IDGD	
CCn1cc(C(=O)NNC(=O)CNC(=O)c2cccs2)c(=O)c2cc(Cl)ccc21	757972328	ZEIOPPAGTVHYDZ-UHFFFAOYSA-N	432.889	1.927	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)[C@@]1(Cc2ccc(Cl)cc2)C[C@H]2CC[C@H]1C2	758048799	WSJJIERWNRIULZ-MOMAJJCNSA-N	427.954	1.774	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)C(=O)Nc1ccccn1)Oc1ccccc1Br	758833165	KDARLRSSHSHYDN-NSHDSACASA-N	436.266	1.581	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NCc2ccc(S(C)(=O)=O)c(Cl)c2)cc1	759394990	BZQAVKOWBRQSFY-UHFFFAOYSA-N	441.893	1.662	50	20	IDGD	
C[C@H]1CN(Cc2ccccc2)C[C@H](C)C1NC(=O)NNC(=O)CNC(=O)c1ccco1	761790149	KNWZRRSULYKGGH-HOTGVXAUSA-N	427.505	1.496	50	20	IDGD	
Cc1ccc(CC(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)c(Cl)c1	762539756	KHHFRZNPWFJXOD-UHFFFAOYSA-N	437.953	1.665	50	20	IDGD	
CNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc3ccccc3cc2O)cc1Cl	763525721	CDQWRYUYONKKKG-UHFFFAOYSA-N	440.843	1.958	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)N2C[C@@H](C)Oc3ccccc32)cc(OC)c1OC	763540301	SKTISLYVYJZOSO-GFCCVEGCSA-N	429.429	1.288	50	20	IDGD	
O=C1CCCc2cc(NC(=O)C(=O)NNC(=O)c3cc(-c4ccccc4)[nH]n3)ccc2N1	763604923	PYJAAIIZVVTZKP-UHFFFAOYSA-N	432.440	1.751	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(-c2nccs2)cc1	763658621	ZASUKZVUSDKPSO-UHFFFAOYSA-N	426.454	1.984	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2ccc(N3CCO[C@H](C)C3)cc2)c1	763668107	ISEIXGWZGCPUJI-QGZVFWFLSA-N	440.500	1.693	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)CSc2ccc(Cl)cc2)cc1	763734533	LZKHTVXTRLUJAY-UHFFFAOYSA-N	441.918	1.622	50	20	IDGD	
CCN1CCN(c2ccc(NC(=O)C(=O)NNC(=O)c3cccc(Cl)c3)cc2)CC1	763748576	UQBUPUJGOQDBII-UHFFFAOYSA-N	429.908	1.882	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)C(=O)Nc2c(C)noc2C)c2ccccc2c1=O	763821013	QEDICKOZVNNMSE-UHFFFAOYSA-N	440.460	1.591	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(-n3cccn3)nc2)cc1	763862554	XZAAZCAZEGQPRG-AWEZNQCLSA-N	438.444	1.219	50	20	IDGD	
COCCOc1ccc(F)cc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccc(F)cc1	763865157	IZRPUDMWGWVIBI-LBPRGKRZSA-N	437.399	1.543	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccnn2Cc2ccccc2)cc1	763876538	GUTCUCXDHQHXTM-INIZCTEOSA-N	449.467	1.687	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)C(=O)Nc1ccn(CCN(C)C)n1	763900196	HDEBBYRJXFBOME-UHFFFAOYSA-N	441.517	1.276	50	20	IDGD	
NC(=O)CCSc1ccccc1NC(=O)C(=O)NNC(=O)Cc1ccc(Cl)cc1	763937150	XSGBXOFKKNAZQO-UHFFFAOYSA-N	434.905	1.636	50	20	IDGD	
CCN(CC)CCNC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ccc[nH]2)ccc1Cl	763980794	MVVVFBSSZPHDHF-UHFFFAOYSA-N	448.911	1.139	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1ccc(-n2cccn2)c(F)c1	764005454	YLZOVRFAQWJHJP-UHFFFAOYSA-N	425.376	1.182	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1ccc2oc(N(C)C)nc2c1	764010608	AVZFLVUYFNUEQF-UHFFFAOYSA-N	431.836	1.956	50	20	IDGD	
N#Cc1ccc(Cn2cnc(NC(=O)C(=O)NNC(=O)c3cccc4ccccc34)n2)cc1	764047144	BCKKMJTZFBWYEB-UHFFFAOYSA-N	439.435	1.751	50	20	IDGD	
CC[C@@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)cc1	764127063	SATQHSQUUOYOQC-LLVKDONJSA-N	432.864	1.974	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccccc2OC)cc1Cl	764133159	UKRPAYWSOLYHHO-UHFFFAOYSA-N	449.847	1.229	50	20	IDGD	
Cc1nc(COc2ccc(NC(=O)C(=O)NNC(=O)CCOc3ccccc3)cc2)no1	764161055	NOHVSZKUZAKVDK-UHFFFAOYSA-N	439.428	1.512	50	20	IDGD	
Cc1ccc(C(=O)NCC(F)(F)F)cc1NC(=O)C(=O)NNC(=O)CCc1ccco1	764171178	GOWLSMCKFJCWEB-UHFFFAOYSA-N	440.378	1.599	50	20	IDGD	
CCn1c(=O)n(CC)c2nc(NC(=O)CCC(=O)NNc3nccnc3Cl)ccc21	764280296	SVYROEXSUCHNQN-UHFFFAOYSA-N	432.872	1.543	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C(=O)Nc1cc(S(N)(=O)=O)cc(C)c1C)c1ccccc1	764329904	QOWHKEZZEDEKBI-INIZCTEOSA-N	432.502	1.231	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(S(=O)(=O)N3CCCCC3)cc2)o1	764367687	KTXRFIGCIBTVKK-UHFFFAOYSA-N	434.474	1.162	50	20	IDGD	
CCC(CC)NC(=O)[C@H]1CN(C(=O)C(=O)NNC(=O)c2ccc(C)o2)c2ccccc2O1	764372176	PQTLRXXNNDXNHZ-GOSISDBHSA-N	442.472	1.448	50	20	IDGD	
O=C(NNC(=O)C(F)(F)Oc1ccccc1)C(=O)Nc1ccc(-n2cncn2)c(F)c1	764379770	JVBOMKHYQVWXQD-UHFFFAOYSA-N	434.334	1.164	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1)C(=O)Nc1cccc(-n2cccn2)c1	764389117	ZJQGPHMGTWWHOE-UHFFFAOYSA-N	433.403	1.801	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1ccc(C(=O)N(C)C)c(C)c1	764397093	FPZNDWRIAKAFFK-UHFFFAOYSA-N	444.513	1.584	50	20	IDGD	
CCNC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2F)cc1	764410421	GCKFQLUJGREPHA-UHFFFAOYSA-N	436.827	1.394	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNS(=O)(=O)c3ccccc3[N+](=O)[O-])CC2)cc1	765126063	HCKDRUQKJZATTO-UHFFFAOYSA-N	447.517	1.031	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNS(=O)(=O)c3ccc(Cl)s3)CC2)cc1	765126109	IHQCSQHHXRHMHS-UHFFFAOYSA-N	442.994	1.837	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)Cc3ccc4c(c3)OCCO4)n[nH]2)cc1OC	765602899	ZWIQTZUGSHYNAQ-UHFFFAOYSA-N	438.440	1.869	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)NC[C@@H]1CCCCN1C1CC1	765665293	ZZUXQGXMYGCQTD-NRFANRHFSA-N	428.581	1.546	50	20	IDGD	
N#Cc1cc(Cl)nc(NNC(=O)c2sccc2S(=O)(=O)N2CCOCC2)c1	768702184	RIUDXSGVKZLVPQ-UHFFFAOYSA-N	427.895	1.446	50	20	IDGD	
CSCCNC(=S)NNC(=O)c1ccc(F)c(S(=O)(=O)N2CCCCC2)c1	769767532	OYANXMWAMYYMCK-UHFFFAOYSA-N	434.584	1.472	50	20	IDGD	
Cc1cc2c(N3CCC[C@H]3C(=O)OCC(=O)NNC(=O)c3ccccc3)ncnc2s1	770184069	OXWSDDNINYBFOV-INIZCTEOSA-N	439.497	1.973	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)N[C@@H]3CCCN(c4ncccn4)C3)nc21	770348519	ZXMKHRNHAJZPNG-GFCCVEGCSA-N	426.485	1.372	50	20	IDGD	
O=C(NCc1nnnn1CC1CC1)NNC(=O)c1ccc(Br)cc1Cl	770387253	DWECZSIGSVRKQV-UHFFFAOYSA-N	428.678	1.643	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)[C@@H]3CCN(c4ccc(F)cc4)C3=O)nc21	770966575	SCRBYAACBPBORG-ZDUSSCGKSA-N	427.440	1.922	50	20	IDGD	
COc1ccccc1[C@]1(C)NC(=O)N(CC(=O)NNC(=O)NCCc2cccs2)C1=O	771249060	CYCVZUZOYVDZJK-FQEVSTJZSA-N	445.501	1.097	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)C1CCN(C(=O)c2ccccc2)CC1	772195452	MNHBQYHERQXDDT-UHFFFAOYSA-N	442.903	1.656	50	20	IDGD	
COc1ccc(NC(=O)c2cccc(NC(=O)C(=O)NNc3nc(C)cc(C)n3)c2)cn1	773482230	MCVQQMQASNBCHV-UHFFFAOYSA-N	435.444	1.831	50	20	IDGD	
Cc1ccc(-n2nccc2NC(=O)C(=O)NNC(=O)CSc2ccc(Cl)cc2)nn1	773493646	FTEBHMCFCRDABP-UHFFFAOYSA-N	445.892	1.502	50	20	IDGD	
COC(=O)c1cc(OC)c(OC)c(OC)c1NC(=O)C(=O)NNc1nccnc1C(C)C	773997288	GUSHZIJEISVXLY-UHFFFAOYSA-N	447.448	1.494	50	20	IDGD	
CN(NC(=O)c1csc(-c2cnccn2)n1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776205779	OJFZVALUSVQTTH-UHFFFAOYSA-N	447.521	1.849	50	20	IDGD	
C[C@@H]1CCN(C(=O)OC(C)(C)C)[C@@H](C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)C1	778296259	VCKCHTMPEBKDQX-CZUORRHYSA-N	443.504	1.730	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)CN2C(=O)N[C@@](C)(c3ccc(F)cc3)C2=O)nc1C	778429295	JTMTWBLCAJOPFA-FQEVSTJZSA-N	444.423	1.011	50	20	IDGD	
C[C@@H]1CCN(C(=O)OC(C)(C)C)[C@@H](C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)C1	778458252	ILLZDGXCVOAPDP-CZUORRHYSA-N	439.534	1.887	50	20	IDGD	
CCOc1cc(Cl)ccc1C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	778894058	SUYZPOMVHBZFJV-QGZVFWFLSA-N	434.832	1.883	50	20	IDGD	
Nc1nc(Cl)cc(NNC(=O)CCn2cnc3ccc(Br)cc3c2=O)n1	779375322	UJPWYRKXSFSEMJ-UHFFFAOYSA-N	438.673	1.718	50	20	IDGD	
O=C(NNC(=O)c1noc2c1CCCCC2)c1ccc(S(=O)(=O)N2CCCC2)cc1	780171845	QPMNQXADIDSBHD-UHFFFAOYSA-N	432.502	1.803	50	20	IDGD	
COc1cccc(C(=O)c2ccc(C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)cc2)c1	780173637	MENRFLZKHOAPQQ-UHFFFAOYSA-N	442.435	1.977	50	20	IDGD	
CC(=O)Nc1ccc(C)c(C(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)c1	780925057	ANFLKDXJECLTAN-UHFFFAOYSA-N	437.544	1.841	50	20	IDGD	
CC(C)[C@H]1CN(CC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)CCN1C(=O)OC(C)(C)C	781989597	VBYNXJJECQYOSN-QGZVFWFLSA-N	449.508	1.933	50	20	IDGD	
CCCCNS(=O)(=O)c1cccc(NC(=O)C(=O)NNc2cncc(Cl)n2)c1	783259791	MZWHOYZULDCKAM-UHFFFAOYSA-N	426.886	1.290	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NN[C@H](Cc2ccc(F)cc2)C(N)=O)c1	784061297	OFURKGKAJHSTDK-GOSISDBHSA-N	436.509	1.187	50	20	IDGD	
Cc1c(NNC(=O)C(=O)Nc2ccc(C[C@@H]3CC(=O)NC3=O)cc2)cccc1[N+](=O)[O-]	784357630	GNZUZILLSNZGFJ-CYBMUJFWSA-N	425.401	1.190	50	20	IDGD	
Cn1cnn(-c2ccc(NC(=O)C(=O)NNc3ccc(F)cc3Br)cc2)c1=O	784803883	XGDPYCAVSNNXLS-UHFFFAOYSA-N	449.240	1.554	50	20	IDGD	
CCNC(=O)N(C)NC(=O)C(=O)Nc1ccc(=O)n(Cc2ccc(Cl)c(Cl)c2)c1	784914822	AOJLRDHYJQOZBS-UHFFFAOYSA-N	440.287	1.834	50	20	IDGD	
COc1ccc(C(=O)N2CCCCCC2)cc1NC(=O)C(=O)NNc1ncc(F)cn1	784956934	NDXBBZXFSRIGPC-UHFFFAOYSA-N	430.440	1.722	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1F	789744460	QQLTZYQHGFULAR-UHFFFAOYSA-N	437.493	1.543	50	20	IDGD	
CC(=O)N1CCc2ccc(S(=O)(=O)NNC(=O)c3c(C)nc4ccccn34)cc2CC1	790046106	WDTVITXWECKUQZ-UHFFFAOYSA-N	441.513	1.213	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)c1cccc(S(=O)(=O)NC2CCCC2)c1	790063184	FNSRHUASLHGHTK-UHFFFAOYSA-N	427.523	1.458	50	20	IDGD	
C#Cc1ccc(C=NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)cc1	792631816	MXDKAUQZQHUFNM-UHFFFAOYSA-N	425.510	1.772	50	20	IDGD	
Cn1ccc2ccc(NC(=O)C(=O)NNC(=O)c3cccc(OC(F)F)c3)cc2c1=O	793024476	FGWQEVKNXJUHKL-UHFFFAOYSA-N	430.367	1.540	50	20	IDGD	
CCCCCn1nc(C(=O)NNS(=O)(=O)c2cnn(C)c2C)c2ccccc2c1=O	793350003	CBMYOYPNWXLQAG-UHFFFAOYSA-N	432.506	1.252	50	20	IDGD	
Cc1cc(Br)ccc1NNC(=O)[C@@](C)(O)CN1C(=O)NC2(CCCC2)C1=O	793711014	UOQVNILNZPPXEM-KRWDZBQOSA-N	439.310	1.816	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)cc1OC	796989267	CRQQJNVPOHRXQY-UHFFFAOYSA-N	429.473	1.784	50	20	IDGD	
Cc1ccc(N2CCOCC2)cc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccccc2)[nH]n1	797535548	NQEYXXSNNQELGS-UHFFFAOYSA-N	448.483	1.621	50	20	IDGD	
Cc1onc(-c2ccc(Cl)c(Cl)c2)c1C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O	798109772	WLUIMWRDNKZCGY-SSDOTTSWSA-N	435.289	1.656	50	20	IDGD	
CCc1csc(CC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)n1	801102544	WSZZTTQNQPEGKQ-UHFFFAOYSA-N	436.559	1.884	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CSCc2cc(=O)n3ccsc3n2)cc1	801106839	IWXVOCNFFVBMSO-UHFFFAOYSA-N	431.499	1.084	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)c2c(C)oc3ncn(C)c(=O)c23)cc1Cl	802076350	ZNUKCFTWJSQJCN-UHFFFAOYSA-N	435.824	1.972	50	20	IDGD	
NC(=O)CC[C@@H](NC(=O)CCC1CCCC1)C(=O)NNC(=O)Nc1ccc2c(c1)OCO2	802104524	FPXIGHPVOUXWOB-OAHLLOKOSA-N	447.492	1.289	50	20	IDGD	
O=C(COc1cccc(C(F)(F)F)c1)NNC(=O)C(=O)N1CCc2cc(F)ccc21	802565715	HJSNCFPCEKDYLP-UHFFFAOYSA-N	425.338	1.960	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCC(C(=O)NNc3cccc(F)n3)CC2)cc1OC	804772557	MLUDXRRSRONTIV-UHFFFAOYSA-N	438.481	1.782	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)Nc1cc(C2CC2)nn1[C@H]1CCS(=O)(=O)C1	806328122	CKAHGYJYSYCZQC-ZDUSSCGKSA-N	443.493	1.244	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1ccc(C#N)c(Br)c1	806973528	QDTMPJGPHYSURK-UHFFFAOYSA-N	441.245	1.677	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)C(=O)Nc1cc2c(cc1Br)CCC2	807428384	COHNCUNWUCOEKJ-UHFFFAOYSA-N	442.277	1.995	50	20	IDGD	
O=C(NCc1ccncc1OC[C@@H]1CCOC1)NNC(=O)[C@H]1COc2ccccc2O1	807615195	OUPOHQMHMRQGCR-AUUYWEPGSA-N	428.445	1.167	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1ccccc1-n1cnc(C#N)n1	810384830	QJYUHXAJEJRTLA-UHFFFAOYSA-N	439.819	1.201	50	20	IDGD	
COc1cc(C)nc(NNC(=O)CNS(=O)(=O)c2ccc(OC(F)(F)F)cc2)n1	810464925	BIKPEESZNXWJON-UHFFFAOYSA-N	435.384	1.114	50	20	IDGD	
CC(=O)c1cccc(S(=O)(=O)NCC(=O)NNc2ccnc(Br)c2)c1	811124148	XZPKBUOEBWEOLF-UHFFFAOYSA-N	427.280	1.468	50	20	IDGD	
Nc1cc(Cl)cc(Cl)c1C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	811322373	ULVLMVKZNZGYEC-AWEZNQCLSA-N	440.239	1.720	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)C1CCN(c2noc3ccc(Cl)cc23)CC1	815227960	MOXDPHINTNZCMM-UHFFFAOYSA-N	445.863	1.868	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)cc(OC)c1C	815563541	GNMNSKDJRRVUEE-UHFFFAOYSA-N	447.444	1.438	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)C(=O)Nc1ccn(-c2ccc(Br)cc2)n1	815569557	YRFABFJNOUNFLN-UHFFFAOYSA-N	432.238	1.066	50	20	IDGD	
COC(=O)c1cc(OC)c(OC)c(OC)c1NC(=O)C(=O)NNc1cccc(Cl)n1	815727978	ORHYDRJRHSOECV-UHFFFAOYSA-N	438.824	1.629	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)NC[C@H](CO)Cc2cnn(C)c2)c(C)n1C[C@H]1CCCO1	819666445	RLFYCQVMEFFQRS-KSZRNKAMSA-N	425.533	1.892	50	20	IDGD	
CC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)OCC(=O)NNC(=O)c1ccc(C)cc1	848951997	NNQNUBZHHCOIBI-HXUWFJFHSA-N	436.468	1.528	50	20	IDGD	
COc1ccccc1[C@@H](NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)c1nccn1C	914598284	WPQQUTUQKPNKLT-GOSISDBHSA-N	447.459	1.138	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)c2c(O)nn(C)c2n1	915190608	NXODMGVQEYYVTK-UHFFFAOYSA-N	435.444	1.348	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NN=Cc2ccccc2N2CCO[C@@H](C)C2)cc1	915945487	VKTVPYYEXJMJIZ-SFHVURJKSA-N	444.557	1.991	50	20	IDGD	
CCC(CC)[C@H](CNC(=O)NNC(=O)c1cc(Br)c[nH]1)N1CCOCC1	916255700	DRKKRJKETNQHOV-HNNXBMFYSA-N	430.347	1.858	50	20	IDGD	
C#CCNS(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(-c3ccc(C)cc3)[nH]n2)c1	917178114	LCTUUYCCWZKWOR-UHFFFAOYSA-N	437.481	1.371	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2nnn(-c3ccc(C)cc3)c2C)cc(OC)c1OC	917542532	YTOZZYUZZSKCBY-UHFFFAOYSA-N	425.445	1.985	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2ccc(CCCl)cc2)c1	917720240	ULGCYRNPAVPHRW-UHFFFAOYSA-N	445.950	1.342	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cccc(CN3CCCC3)c2)cc1	920082019	JYQJEKSITNRRMD-UHFFFAOYSA-N	444.557	1.673	50	20	IDGD	
CN1CCC(NC(=S)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)CC1	920306804	NZQNHACAXUZXEK-UHFFFAOYSA-N	439.607	1.064	50	20	IDGD	
Cc1nc2ccc(S(=O)(=O)NNC(=O)c3sc(N4CCOCC4)nc3C)cc2o1	1116682702	FYHWEVRFPCZMPB-UHFFFAOYSA-N	437.503	1.361	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(C(=O)NNC(=O)c2ccc(Br)cc2)ccc1F	1248696146	JLLVWEJIMVDFHH-UHFFFAOYSA-N	444.282	1.913	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)N1CCC([C@@H]2C(=O)Nc3ccccc32)CC1	1251506705	BACDAIZOKQHLSF-SFHVURJKSA-N	441.513	1.667	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1ccc(OCC2CC2)nc1	1318879106	WFMWWBYWKQAYNW-UHFFFAOYSA-N	432.502	1.648	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NN=Cc3ccc4c(c3)CCC4)CC2)cc1	1323974314	LWSLYUKAWGHZHX-UHFFFAOYSA-N	440.569	1.940	50	20	IDGD	
CC1(C)CCc2nc(O)c(C(=O)NNC(=O)c3csc(N4CCOCC4)n3)cc2C1	1324248740	ZGDRDCKLXPRCPY-UHFFFAOYSA-N	431.518	1.670	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3cn4ccsc4n3)C2)C1	1778623554	IVXJDZYHCUSABC-PXAZEXFGSA-N	441.351	1.870	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cn4ccsc4n3)C2)C1	1778623563	IVXJDZYHCUSABC-YVEFUNNKSA-N	441.351	1.870	50	20	IDGD	
CCOCCC(=O)N1CCO[C@@]2(CCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1	1780099146	UXMHXASKTDKHPE-NRFANRHFSA-N	449.460	1.390	50	20	IDGD	
COc1ccc([C@H](O)C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)cc1	1781226137	VSJDGTDWADLCAK-VDGAXYAQSA-N	445.343	1.795	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Cl)C2)[C@H]1C[C@@]12C(=O)Nc1ccccc12	1781980677	XKXNRKDUPSYWBQ-LTAPKTKJSA-N	449.910	1.945	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnc4c(c3)CCNCC4)C2)C1	1782728598	ZRPSKAUIRTZDRZ-GCJKJVERSA-N	434.968	1.621	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)CNC(=O)OC(C)(C)C)C2)C1	1783395199	ZKTGAAOTHABBQA-ACJLOTCBSA-N	448.358	1.372	50	20	IDGD	
O=C(C(Cl)Cl)N1CCO[C@]2(CCN(C(=O)[C@H]3C[C@@]34C(=O)Nc3ccccc34)C2)C1	1783499342	GLOIBTYAPYUGCL-CWVNLOTRSA-N	438.311	1.530	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(O)c([N+](=O)[O-])c3)CCO2)C1	1783537546	ONAODYVCVRYKDN-PIGZYNQJSA-N	442.266	1.527	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ncccc3C(F)(F)F)CCO2)C1	1783876850	AYKJLBYQOWMOKE-GUYCJALGSA-N	435.830	1.798	50	20	IDGD	
CCc1nc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]3C2)co1	1783970142	NTVZPQLZVXXTQW-ABHRYQDASA-N	428.327	1.861	50	20	IDGD	
Cc1cc(CCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Br)C[C@@H]32)ccn1	1785120732	ZVCGVRREUJWCBJ-NBOOPKSLSA-N	442.329	1.993	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3n[nH]c(C)c3F)[C@H]2C1	1785764788	AFWZWTKBWFCBAH-CYDGBPFRSA-N	431.306	1.624	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(N4CCOCC4)n3)C[C@@H]21)[C@H](F)Cl	1787446816	DXJRQWZFERXZKP-DNUAJFIVSA-N	440.903	1.046	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ncn(-c4ccccc4)n3)[C@H]2C1	1787584399	CNWQASGKUPACSW-DKIMLUQUSA-N	447.923	1.114	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)c1cc(Cl)ncn1	1789058368	CGSUIBCSBBXORC-PZEZNAACSA-N	435.681	1.414	50	20	IDGD	
C#CCO[C@H](C)C(=O)NC1(c2ccc(NC(=O)c3cnccc3C(=O)NN)cc2)CCC1	1789519878	OVNSHAQJYIBFAJ-OAHLLOKOSA-N	435.484	1.471	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]3C2)nc1	1789923076	RVHHGBOAGIKPOE-HQRZJTNHSA-N	430.274	1.374	50	20	IDGD	
CC[C@@H](O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C(C#N)=C/c3ccc(F)cc3F)[C@H]2C1	1790693573	KPVKXUBWQTXEKY-LEUCMJNISA-N	433.455	1.622	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@](C)(O)C(F)(F)F)C[C@@H]21	1791055208	OFGWLOAOFZWLIJ-MMROJZCPSA-N	431.249	1.063	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCCn3ccnc3C)C[C@@H]21	1791256197	HKCLIFUOISPFPP-FJIDUMEYSA-N	426.945	1.205	50	20	IDGD	
C[C@H](C(=O)NC1(c2ccc(NC(=O)CCC(=O)NN(C)C)cc2)CCC1)N1C[C@H]2C[C@@H]2C1	1791601100	LXWYEAHNHWNXQJ-KZNAEPCWSA-N	441.576	1.834	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CCCN(Cc3ccccc3)C1)C2)[C@@H](O)CCl	1792975415	QVHWPDCFVXOWQG-WHZJULEDSA-N	449.979	1.088	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1(c3ccc(F)c(F)c3)CC1)C2)[C@H](O)CCl	1792979101	UKSOFPPWACQGMD-CZAMWMTLSA-N	428.863	1.186	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCc1ccc(F)nc1	1794021049	RTPNEOVXIVVKBQ-QOIYZWAUSA-N	432.323	1.979	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2)c1cc(Br)ncc1F	1796620909	AMGLKHIOMRFTRI-XXHBBNRNSA-N	438.656	1.721	50	20	IDGD	
Cc1cc(NC(=O)CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](C)CBr)C3)no1	1796866110	HERUDRKPEBEQPX-DEQVHRJGSA-N	441.326	1.981	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3cnccc3n1)C2	1797955790	CNBJYADKZHPNSW-CWPLJXCYSA-N	428.565	1.685	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c(c1)CC(=O)N3)C2	1797956870	IKZOAUWCXXBKOV-CWPLJXCYSA-N	431.565	1.236	50	20	IDGD	
Cc1nc(F)ccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnccc1C(=O)NN	1798439730	AORLVPDBWVKQHL-BTTYYORXSA-N	426.452	1.093	50	20	IDGD	
Cc1cccnc1CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnccc1C(=O)NN	1798440844	ZDLDPRRBMAMPQI-BJWYYQGGSA-N	436.516	1.273	50	20	IDGD	
O=C([C@H](O)CCl)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1(c2ccc(F)c(F)c2)CC1	1799063587	SZIPDHGRHZBKJC-CZAMWMTLSA-N	428.863	1.186	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(CCN3CCCC3)nc1)C2	1799270102	QAAZICGUYOCFLU-KOUHRCEDSA-N	448.995	1.941	50	20	IDGD	
COc1cc(C)cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)Br)C3)c1	1799451445	HGVNSDXXERMICL-JJAZEVLHSA-N	425.323	1.990	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc3n(n1)CCNC3=O)C2	1800079180	OEBGRJQEHHEVEE-QPSSLKIMSA-N	428.320	1.115	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3n(n1)CCCC3)C2	1800758978	BDUUREDRXKGQJQ-NFFDBFGFSA-N	425.327	1.206	50	20	IDGD	
COC(=O)[C@H]1CCC[C@@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CO[Si](C)(C)C)C3)C1	1800966168	NQPHMTAGGGTADI-OYNZLANYSA-N	440.613	1.407	50	20	IDGD	
C[C@@H]1Oc2ccc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)C(Cl)Cl)cc2NC1=O	1801016402	IVWCTLUOTMFEPX-BTABJRDXSA-N	442.299	1.413	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCn1c(=O)oc3ccccc31)C2	1802273868	NRTPQLMKCMVMMT-QKPAOTATSA-N	435.908	1.877	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1c(Br)cnn1C)C2	1802274245	WFBAUFGTIANUFM-LSCVPOLPSA-N	433.734	1.688	50	20	IDGD	
COc1cccc(CC(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)n1	1803136360	PKSWXBVIEREZKN-OXFYSEKESA-N	432.908	1.333	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cccc3c2OCC3)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803139069	KBEBKOJMCVTCQD-YTQUADARSA-N	429.904	1.936	50	20	IDGD	
CC(C)c1nc(CC(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)no1	1804404635	AJAQOXVBQWVVJE-HDMKZQKVSA-N	435.912	1.436	50	20	IDGD	
O=C(Cc1cncnc1)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@H]1c1cccnc1	1804651206	QIPAOWSDQWVVRS-BHYGNILZSA-N	436.285	1.811	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@@H](CNC(=O)c2ncnn2C)[C@H]1c1cccnc1	1805273098	LKUXALNWXZGXOG-VHDGCEQUSA-N	435.326	1.561	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCCC2(CCN(C(=O)c3cnccc3C(=O)NN)CC2)C1	1806164857	LLDWFDQQMOTDHA-QGZVFWFLSA-N	435.956	1.937	50	20	IDGD	
Cc1ccsc1C(=O)N1CCCC2(CCN(C(=O)c3ccc(B(O)O)cc3)CC2)C1	1808078722	CPNVGRYLDXXHLQ-UHFFFAOYSA-N	426.347	1.895	50	20	IDGD	
Cc1cc(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)ncc1[N+](=O)[O-]	1808659560	LIOFBGIVOLJUKN-JCGIZDLHSA-N	447.879	1.613	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H](CNC(=O)Cn2nccn2)[C@H]1c1cccnc1	1808920941	YRSGEIKHAMKVPG-FRFSOERESA-N	435.326	1.410	50	20	IDGD	
O=C(CC1CCOCC1)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1	1809968369	WKUXGOAAXLLLQW-UHFFFAOYSA-N	428.338	1.028	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)c3cc4ccoc4cn3)CC2)C1	1809979981	DJRLWBFNUDIFDI-UHFFFAOYSA-N	447.300	1.666	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1CCN(C(=O)CCSC(=N)N)[C@@H]1c1cccnc1	1810542537	ZPRZJGNIXAMUGJ-MAUKXSAKSA-N	437.642	1.956	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H](CNC(=O)c2nccnc2C(N)=O)[C@@H]1c1cccnc1	1811183605	UYVKBJWZNNSXTP-PBHICJAKSA-N	444.923	1.555	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)[C@H](Cl)COC)[C@H]1c1cccnc1	1812368209	YHOKHOUAXNCOAA-XBVQOTNRSA-N	441.912	1.903	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2cnn3ncccc23)[C@@H]1c1cccnc1	1813031201	PDBPFBAMJPPGKP-HHXXYDBFSA-N	442.907	1.698	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)cn1	1813069791	BWOZHIAHYPODNA-PGRDOPGGSA-N	438.532	1.478	50	20	IDGD	
C[C@@H](Cn1cccn1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1	1816017348	KWZBHEYZTRUBNE-RDJZCZTQSA-N	444.540	1.308	50	20	IDGD	
CCc1ccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)cn1	1816323827	CRKPLYBKWSFHAP-HXUWFJFHSA-N	447.304	1.667	50	20	IDGD	
O=C(N[C@@H]1CCc2nc(NC(=O)[C@H](F)Cl)sc2C1)c1cc(=O)nc2sccn12	1817125443	OJZIMZGABNYHDL-KRTXAFLBSA-N	441.897	1.973	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](N)Cc3cccnc3)sc2C1	1817192597	QDDJBCSPEFHCOC-MCIONIFRSA-N	437.953	1.274	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3cnc4ncccn34)sc2C1	1818439753	ARGVNRKHBCSATK-QWRGUYRKSA-N	434.909	1.665	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](O)CCl)CC2)c1ccc2c(c1)CNC2=O	1819362759	FWWZHVAWRPKKQQ-FZMZJTMJSA-N	434.905	1.212	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)C1=CCCS1)CC2	1819794109	ZONJFMPBXAXLOX-SNVBAGLBSA-N	444.542	1.388	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)CO[Si](C)(C)C)sc2C1	1820168681	JOWCOCXTPFEETN-GFCCVEGCSA-N	441.630	1.280	50	20	IDGD	
CC(C)c1cc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)CCC(=O)NN(C)C)CC3)n[nH]1	1821551710	PHRWDXTUNRWCLR-LBPRGKRZSA-N	447.565	1.588	50	20	IDGD	
C[C@H](Br)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2CCC(=O)NC2)[nH]n1	1822184246	DCOIAPUSQBDEEP-LOWVWBTDSA-N	426.315	1.711	50	20	IDGD	
CNc1nsnc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](Cl)COC)n[nH]1	1822366895	MXLPZDFJVCNJAL-KOLCDFICSA-N	427.918	1.863	50	20	IDGD	
Cc1cn(CC(=O)N2CCCC[C@@H]2c2cc(NC(=O)C(Cl)Cl)n[nH]2)c(=O)nc1O	1822423154	ORTTXAGFZJPZRG-LLVKDONJSA-N	443.291	1.476	50	20	IDGD	
CN1N=C(C(=O)N[C@@H]2CCc3nc(NC(=O)[C@@](C)(Cl)CCl)sc3C2)CCC1=O	1822861014	UEWVAKPKYZTLLU-XLFHBGCDSA-N	446.360	1.900	50	20	IDGD	
Cc1cc(CC(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)on1	1825016720	XECGWLSPJJIQSW-OAQYLSRUSA-N	439.321	1.139	50	20	IDGD	
COc1nn(C)cc1C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](C)Br)sc2C1	1825637148	SXZRWKJYXQGXNK-RKDXNWHRSA-N	442.339	1.894	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)Cc2ccccc2)CC1	1826461792	RVEHRRMBOLTYQN-HSZRJFAPSA-N	434.345	1.842	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)CSc3nc[nH]n3)sc2C1	1826676039	XJCJLBSTSSGKOP-IUCAKERBSA-N	430.943	1.219	50	20	IDGD	
C[C@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1)n1ccnc1	1827048857	APVVCHAMVQIBOR-DYESRHJHSA-N	438.337	1.057	50	20	IDGD	
CN1CCC[C@H](C(=O)N2CCCC[C@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)C1	1830184208	IQCHHYBVLXXKDH-PMACEKPBSA-N	435.613	1.321	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)COc3ccc(OC)cc3)CCO2)C1	1830243456	CIHCKBUIFHYVIS-NQIIRXRSSA-N	440.924	1.548	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H](C)N2CCN(C)CC2)CC1	1831833387	NMMXEEFPKZKOLK-MISYRCLQSA-N	443.032	1.496	50	20	IDGD	
Cc1cc(/C=C/C(=O)N2CCC([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)no1	1831873193	CJCDHEDJRMIFNI-FHVRUZERSA-N	445.564	1.989	50	20	IDGD	
C[C@@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)CCBr)CC1)n1cnnn1	1832284977	KFLFTWRJDDHDMP-ZFWWWQNUSA-N	427.347	1.639	50	20	IDGD	
CC(C)(CCl)C(=O)NC1CCN(C2CCN(C(=O)CCN3CCOCC3)CC2)CC1	1833214415	ZXLNSBDSWXOHMF-UHFFFAOYSA-N	443.032	1.545	50	20	IDGD	
CC(=O)NC(C)(C)C(=O)NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1	1833487576	VQDQKJVQLQVKMG-UHFFFAOYSA-N	445.402	1.258	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnc(OCF)cn3)CCO2)C1	1833567086	GNTJNKURKOQRRS-AUUYWEPGSA-N	444.891	1.260	50	20	IDGD	
Cn1c(C(=O)NC2CCN(C3CCN(C(=O)[C@H](O)CCl)CC3)CC2)cc2ccccc21	1835271135	ZNSCBTATBSBSSJ-OAQYLSRUSA-N	446.979	1.963	50	20	IDGD	
CC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)[C@H]3CCCS3(=O)=O)CC2)CC1	1836397147	AUBMDZDXXHMKKO-DLBZAZTESA-N	434.002	1.153	50	20	IDGD	
O=C(COc1ccc(O)cc1)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836619321	QYEZPOVZBSTULK-LJQANCHMSA-N	440.924	1.369	50	20	IDGD	
C[C@H](C(=O)N1CCC(OC2CCN(C(=O)C(C)(C)CCl)CC2)CC1)n1cnnn1	1836625051	HLGWDFUSKMMFQS-CQSZACIVSA-N	426.949	1.498	50	20	IDGD	
CCc1noc(C)c1C(=O)N1CCOC[C@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1837715561	XORFULGHCVDAPP-FQEVSTJZSA-N	439.585	1.467	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1	1838637515	XCJWRZCBQAYDDT-QGZVFWFLSA-N	430.977	1.375	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)cc1F	1838916373	PEYXZZKHEGPKRB-KUHUBIRLSA-N	443.313	1.988	50	20	IDGD	
Cc1ncsc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839198228	XFVHYUIMPYASKN-WFASDCNBSA-N	436.303	1.212	50	20	IDGD	
CC(C)c1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)on1	1839202073	UGXNGJJYDGZDJS-YOEHRIQHSA-N	448.289	1.559	50	20	IDGD	
C[C@H]1CC[C@H](C(=O)N2CCOC[C@]3(CN(C(=O)[C@@H](F)Br)CCO3)C2)CC1	1839203468	LWPVUAPKWDLLGO-ATNYBXOESA-N	435.334	1.960	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3[C@@H]4C=CS[C@@H]34)C2)C1	1839966683	MISKWBCQELRTKT-PQHDGLIZSA-N	445.379	1.491	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CC3(OC)CCC3)C2)C1	1839967586	QXHWKOKFJZIDCF-KXBFYZLASA-N	447.370	1.576	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C=C/c3ccco3)C2)C1	1840031084	FKDROXHNDKJTTL-FHWYHTKLSA-N	427.295	1.533	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)COc3ccccc3)C2)C1	1840031782	BZTTUZZWGSGPBA-DNVCBOLYSA-N	441.322	1.305	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc4ccoc34)C2)C1	1840154753	FNKNVBXTBRUURF-UTKZUKDTSA-N	436.892	1.757	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(F)c3Cl)C2)C1	1840155028	NMYJPKQAJPADEF-IFXJQAMLSA-N	449.306	1.803	50	20	IDGD	
O=C(c1nn(-c2ccccc2)c2c1COC2)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1	1841350808	YQPUUWYHWUXORP-QGZVFWFLSA-N	430.892	1.319	50	20	IDGD	
CC(C)[C@H](C(=O)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1)c1ccc(F)cc1	1843012373	IXVZGFIZUQVNCJ-NRFANRHFSA-N	438.308	1.762	50	20	IDGD	
Cc1oc2cc(O)ccc2c1C(=O)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843014095	WWJVXUXNWZBVMR-UHFFFAOYSA-N	434.257	1.257	50	20	IDGD	
CN(Cc1ccc2c(c1)OCCO2)C(=O)NNC(=O)c1csc(N2CCOCC2)n1	9789918	VOLCEIARDBIMIH-UHFFFAOYSA-N	433.490	1.237	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)N1CCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)CC1	9796666	ITQHSAZPCDZCOM-UHFFFAOYSA-N	447.473	1.264	50	20	IDGD	
O=C(CCn1c(=O)[nH]c(=O)c2ccccc21)NNC(=O)Cc1nc(-c2ccccc2)cs1	10600626	FXRYELLAECGWMG-UHFFFAOYSA-N	449.492	1.594	50	20	IDGD	
CCn1c(NNC(=O)[C@H](C)NS(=O)(=O)c2ccc(Cl)cc2)nc2ccccc2c1=O	11159660	ZDEVSRRNIWTGFI-LBPRGKRZSA-N	449.920	1.880	50	20	IDGD	
COc1cc(C(=O)NNC(=O)COc2ccc(C#N)cc2)c([N+](=O)[O-])cc1OC(F)F	26693912	WAKFBWZOCJZGPK-UHFFFAOYSA-N	436.327	1.916	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1	110429439	OSPSDZOEXFMXRV-UHFFFAOYSA-N	442.457	1.978	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccccc1	725739713	MPNURJHXKUFCHH-SFHVURJKSA-N	434.452	1.198	50	20	IDGD	
COc1ccc(CNC(=O)NNC(=O)CNC(=O)c2ccco2)cc1Br	726192215	UTJLXASHBBRLNY-UHFFFAOYSA-N	425.239	1.311	50	20	IDGD	
CC(=O)N1CCN(c2ccccc2CNC(=O)NNC(=O)c2c(C)nc3ccccn23)CC1	726273626	HLPXGTXMVQXHAS-UHFFFAOYSA-N	449.515	1.455	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc2c(c1)CCCC2)NNc1nc(-c2ccncc2)no1	726376110	DULFSYSAFLABGL-UHFFFAOYSA-N	442.501	1.822	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=S)NCc2ccc(S(N)(=O)=O)cc2)cc1OC	726444408	KMZDVVHYFRJUMM-UHFFFAOYSA-N	438.531	1.050	50	20	IDGD	
Cc1cc(C(=O)N2CCC[C@H]2C(=O)NNC(=O)c2ccc3c(c2)OCO3)ccc1[N+](=O)[O-]	726521837	WEWYIPBPNMDAHK-INIZCTEOSA-N	440.412	1.698	50	20	IDGD	
CS(=O)(=O)Cc1c(C(=O)NNC(=O)COc2ccc(C#N)cc2)oc2ccccc12	726523727	VGEJRVCNGXYONP-UHFFFAOYSA-N	427.438	1.689	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)NCC(=O)N2CCc3ccccc3C2)cc1	726714148	DLSDKSBGXPLPID-MRXNPFEDSA-N	440.500	1.768	50	20	IDGD	
COc1cc(C(=O)NNC(=S)NCCc2ccc3c(c2)OCCO3)cc(OC)c1OC	726745237	BPEBIOZSIBGPFA-UHFFFAOYSA-N	447.513	1.835	50	20	IDGD	
O=C(NNC(=O)[C@@H]1C[C@@H](O)CN1C(=O)OCc1ccccc1)c1cccc([N+](=O)[O-])c1	727765239	OWJZCFOUMNWJFH-SJORKVTESA-N	428.401	1.128	50	20	IDGD	
C[C@@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)NNc2nc(-c3cccnc3)no2)C1=O	728076952	OWCUHQRNPPUTNA-IBGZPJMESA-N	425.380	1.181	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NNC(=O)c1cccc(C#N)c1	728942275	NVRHNVIIYMYIJO-NSHDSACASA-N	446.261	1.763	50	20	IDGD	
CC[C@@H](NC(=O)NNC(=O)c1ccc2c(c1)OCCO2)c1cccc(S(N)(=O)=O)c1	729230786	NWBNPCNWNQHDHU-OAHLLOKOSA-N	434.474	1.201	50	20	IDGD	
Cc1ccccc1NC(=O)NNC(=O)NCCCCN1CCN(c2ncccn2)CC1	729232023	CBWAIXSLILPKOW-UHFFFAOYSA-N	426.525	1.723	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](CCC(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1ccccc1	729303765	ZMAOPTLOMWJQBT-HZPDHXFCSA-N	439.534	1.615	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)c2ccc(S(=O)(=O)CCCC#N)cc2)cn1	729691504	BEIYEMBBDLUHIB-UHFFFAOYSA-N	433.515	1.799	50	20	IDGD	
O=C(NNC(=O)c1ccsc1NC(=O)c1ccc(Cl)cc1O)C(=O)N1CCCC1	730215246	CUSKRIQDBZSSFS-UHFFFAOYSA-N	436.877	1.743	50	20	IDGD	
CC(C)c1[nH]nc(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1Br	730285398	OYOATZQJEDUHPX-UHFFFAOYSA-N	436.314	1.763	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)NCc1ccc(CS(=O)(=O)NC(C)C)cc1	731497285	AMBHQSAMNSLLEJ-UHFFFAOYSA-N	434.518	1.667	50	20	IDGD	
CC(C)S(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c1	731972535	YMUXDMPTYHDWCV-UHFFFAOYSA-N	442.490	1.486	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNS(=O)(=O)c2cccc(F)c2F)CC1	734807471	REUQOZZEWGRSQM-UHFFFAOYSA-N	434.465	1.857	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)c2ccccc2CN2CCOCC2)c2ccccc2c1=O	740748894	CJZCVWWKVWNSIJ-UHFFFAOYSA-N	449.511	1.884	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)c2ccc(N3CCCS3(=O)=O)cc2C)cc1	741545639	CMXUWXZTWQWOBS-UHFFFAOYSA-N	431.514	1.937	50	20	IDGD	
Cc1cc(N2CCCS2(=O)=O)ccc1C(=O)NNC(=O)c1cnn(-c2ccccc2)c1	741563533	SMYSFMLAVXIGRG-UHFFFAOYSA-N	439.497	1.795	50	20	IDGD	
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)NNC(=O)c1cccc(Br)c1	743263323	CLORDLJOGSXNMH-UHFFFAOYSA-N	430.236	1.989	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)N[C@@H]1CC(=O)N([C@H]2C[C@H]2c2ccccc2)C1	743508316	NKWMFCFMYKAYKW-SQNIBIBYSA-N	432.484	1.744	50	20	IDGD	
O=C(NNC(=O)N1CCC(C(=O)NC2CCCCC2)CC1)c1ccc(-n2cnnn2)cc1	744277735	HDHWTMQRNNAZRJ-UHFFFAOYSA-N	440.508	1.178	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)CN2CCC(NC(=O)NC3CCCCC3)CC2)cc1	744391484	VMHUSIWWWCMLRB-UHFFFAOYSA-N	426.521	1.416	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)COc2ccc(N3CCCC3=O)cc2)cc1	744521530	VSDARYVTHSIDOG-UHFFFAOYSA-N	436.424	1.068	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)c2ccc(S(=O)(=O)NC(C)C)cc2)c1	744556821	SPZZAPRPMPYDBH-UHFFFAOYSA-N	433.486	1.300	50	20	IDGD	
COc1cccc(COCC(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)c1	744619815	ZRLBIAYYMHONFT-UHFFFAOYSA-N	435.502	1.376	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)COc2ccc([N+](=O)[O-])c(F)c2)c2ccccc2c1=O	745835309	CDEQQPPEXBZBIA-UHFFFAOYSA-N	429.364	1.304	50	20	IDGD	
CS[C@H]1CC[C@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)C1	745896123	GRTXVEYZIDYZEA-GJZGRUSLSA-N	426.564	1.699	50	20	IDGD	
C[C@@H](c1ccccc1)[C@@](C)(O)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	747348548	MWCPKFVWZUXSHT-KSFYIVLOSA-N	445.541	1.787	50	20	IDGD	
CC(=O)c1ccc(NC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)cc1	747825225	YDFDWKKMLLAUPJ-UHFFFAOYSA-N	431.518	1.974	50	20	IDGD	
Cn1ccnc(NNC(=O)c2cc(-c3cccnc3)nc3c2cnn3Cc2ccco2)c1=O	747938188	RCOJKDZGZASNTB-UHFFFAOYSA-N	442.439	1.985	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)cc1Cl	748639362	AUJBQZVEJXGZQW-UHFFFAOYSA-N	438.893	1.863	50	20	IDGD	
CC[C@H](Nc1c([N+](=O)[O-])c(C)nn1C)C(=O)NNC(=O)c1cc(-c2ccc(C)cc2)[nH]n1	749529297	GJNYFPRAMGYIOW-AWEZNQCLSA-N	440.464	1.987	50	20	IDGD	
O=C(NNC(=O)C1(C(=O)NC2CC2)CC1)[C@@H]1Cc2ccccc2CN1Cc1ccccc1	749942393	XUEPNCSTCNDQGE-NRFANRHFSA-N	432.524	1.820	50	20	IDGD	
O=C(NNC(=O)c1ccc(F)c(F)c1F)c1cccc(S(=O)(=O)N2CCCC2)c1	750604882	NLSHXJBKLUUKEA-UHFFFAOYSA-N	427.404	1.963	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2ccc(CN3CCCC3)cc2)cc1	752833188	OJBBNVPVEQLYMN-UHFFFAOYSA-N	444.557	1.673	50	20	IDGD	
CS(=O)(=O)N1CC[C@H](CNC(=O)NNC(=O)Nc2ccc(-c3ccccc3)cc2)C1	753094500	VTYDKPLNZLHBBY-OAHLLOKOSA-N	431.518	1.971	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)N[C@@H]2CCN(Cc3ccc(C#N)cc3)C2=O)c1	753733501	QRRJKQUHAGDOPU-GOSISDBHSA-N	427.486	1.389	50	20	IDGD	
NS(=O)(=O)c1ccc2c(c1)oc(=O)n2CC(=O)NNc1cc(C(F)(F)F)ccc1F	754149572	YNIYABVUSSOSJN-UHFFFAOYSA-N	448.354	1.543	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2ccc(C)c(S(=O)(=O)N(C)C)c2)cc1OC	755394999	XUTXGIUWBJQOMQ-UHFFFAOYSA-N	436.490	1.729	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)Nc1ccc(C(=O)NCc2ccccc2F)cc1	755957624	XPBWDRWBQRWRSD-HNNXBMFYSA-N	448.476	1.343	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)COc1ccccc1[N+](=O)[O-])c1ccc(-n2ccnn2)cc1	756760657	XNPTYWHBPMKFAY-CYBMUJFWSA-N	425.405	1.646	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)c2ccc3c(c2)OCO3)ccc1S(=O)(=O)N(C)C	757775329	HXYAWIAKIQUJCN-UHFFFAOYSA-N	436.446	1.141	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)Nc2ccc3nc(N4CCOCC4)oc3c2)c1O	757778146	YUKQJBYSQLIJSY-UHFFFAOYSA-N	427.417	1.845	50	20	IDGD	
Cc1ccc(-c2nc(C(=O)N3CCN(S(=O)(=O)CBr)CC3)cs2)n1C	758527536	MFULCEJMJHUPPJ-UHFFFAOYSA-N	447.380	1.897	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@H](C#N)[C@@H](NC(=O)NNC(=O)c2nnc(O)c3ccccc23)C1	758761468	QZZYJNZPKAXUMQ-RISCZKNCSA-N	441.448	1.038	50	20	IDGD	
CC(C)(C)C(=O)NNC(=O)C(=O)Nc1cccc(S(=O)(=O)NC2=NCCCCC2)c1	761071985	HRWSYKMUBWXVNI-UHFFFAOYSA-N	437.522	1.069	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)NCc1ccccc1CN1CCOCC1	763461046	QIPCDBMDVJHSAQ-UHFFFAOYSA-N	430.530	1.847	50	20	IDGD	
O=C(NNC(=O)c1ccccc1Br)C(=O)Nc1ccc(N2CCOCC2)cc1	763483090	MOGYCGNHPCFPQV-UHFFFAOYSA-N	447.289	1.685	50	20	IDGD	
CN(C)C(=O)c1cc(NC(=O)C(=O)NNC(=O)COc2ccc(C(C)(C)C)cc2)ccn1	763600202	ODEBHDLAUQUCPF-UHFFFAOYSA-N	441.488	1.246	50	20	IDGD	
Cc1nc(C)n(-c2ccccc2NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)n1	763603643	FNXQHAXLVDCHER-UHFFFAOYSA-N	444.455	1.674	50	20	IDGD	
C[C@H](NS(=O)(=O)c1ccc(C(N)=O)cc1)C(=O)NNc1c(Cl)cccc1Cl	763610387	FEXAFOORDRBDDM-VIFPVBQESA-N	431.301	1.902	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(-n2cncn2)c(Cl)c1	763661444	BOQRBUCBNHESOS-UHFFFAOYSA-N	444.835	1.094	50	20	IDGD	
COc1cc(C)c(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)cc1OC	763746504	ZAWBYBWZLTVSJJ-UHFFFAOYSA-N	426.473	1.551	50	20	IDGD	
CCOC(=O)c1cc(C)sc1NC(=O)C(=O)NNC(=O)COc1ccccc1C#N	763808786	QQJZBCBLJSGUKA-UHFFFAOYSA-N	430.442	1.270	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1cc2c(cc1Cl)OCCO2	763849843	KWEIAJOTNURZHZ-SNVBAGLBSA-N	437.811	1.804	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccc(N2CCOC[C@@H]2C)cc1	763852341	WRLOELAUXZYGJX-GJZGRUSLSA-N	444.463	1.604	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccc(Cn2cncn2)cc1	763872252	LSJCRUUUBYHCMF-CYBMUJFWSA-N	426.408	1.019	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(N(C)C)c(C)c2)cc1	763875747	ABFDYVDDERHDGM-HNNXBMFYSA-N	426.473	1.817	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)Cc2ccc(Cl)cc2)cc1C(=O)OC	763932426	PILKJGDTRGCGLD-UHFFFAOYSA-N	447.831	1.242	50	20	IDGD	
Cc1nc(-c2ccccc2NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)no1	763996235	XTAZEUGMYHPZQW-UHFFFAOYSA-N	433.222	1.535	50	20	IDGD	
O=C(NNC(=O)c1ccc(F)cc1Br)C(=O)Nc1cnn(-c2ccccn2)c1	764086883	VJJKESSSDABICM-UHFFFAOYSA-N	447.224	1.569	50	20	IDGD	
COC(=O)c1cccc(C#Cc2cccc(NC(=O)C(=O)NNC(=O)c3cc(C)[nH]n3)c2)c1	764098027	IZLIJEHTYYNHLO-UHFFFAOYSA-N	445.435	1.304	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2ccc(-n3nc(C)cc3C)nc2)cc1	764128023	YENFNVNUNGISFT-UHFFFAOYSA-N	436.472	1.611	50	20	IDGD	
CC(=O)Nc1cc(NC(=O)C(=O)NNC(=O)c2cccc3cccnc23)c(F)cc1F	764144768	QUKVDOGCLKNIPU-UHFFFAOYSA-N	427.367	1.871	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2O1)C(=O)Nc1ccc(-c2n[nH]c(C3CC3)n2)cc1	764164892	UTGZIQPEFBLPMU-QGZVFWFLSA-N	432.440	1.439	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1cc(Br)ccc1F	764275148	JWOCLCWXTQZOGL-UHFFFAOYSA-N	426.198	1.459	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(NC(=O)[C@H](C)OC)c2)c(OC)c1	764283778	FYYKXCBKIMPOIX-LBPRGKRZSA-N	444.444	1.077	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2c[nH]nc2C)cc1NC(=O)OC(C)(C)C	764295215	KNAOJIQCOFMFFL-UHFFFAOYSA-N	432.437	1.473	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C(=O)Nc1ccc(NC(=O)CCN(C)C)cc1)c1ccccc1	764328407	FHNDLWGTCOZBCX-IBGZPJMESA-N	439.516	1.857	50	20	IDGD	
CCS(=O)(=O)c1cc(F)ccc1NC(=O)C(=O)NNC(=O)c1ccc(O)c(Cl)c1	764345485	GFXHJPFJZGOAOR-UHFFFAOYSA-N	443.840	1.378	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccccc3CC(=O)OC)n[nH]2)cc1	764384612	GJDFRIZWTJRZBE-UHFFFAOYSA-N	449.467	1.754	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1)C(=O)Nc1ccc2c(c1)OCCO2	764387613	LMLPTRJYPIENKU-UHFFFAOYSA-N	425.376	1.387	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@H]3Cc4ccccc4C(=O)O3)CC2)cc1	765749711	QYHCHSGYUUMDRB-OAQYLSRUSA-N	436.512	1.042	50	20	IDGD	
CCn1nc(C(=O)NN=C(CNS(C)(=O)=O)c2ccccc2)c2ccccc2c1=O	766689220	RXBIZQSUSCZESL-UHFFFAOYSA-N	427.486	1.100	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)CN1CCN(C(=O)Cc2c[nH]c3ccccc23)CC1	766854113	PTIMMJCPYQFEAF-UHFFFAOYSA-N	447.539	1.553	50	20	IDGD	
CN(C)CCS(=O)(=O)c1ccccc1C(=O)NNC(=O)c1ccc(Cl)cc1F	767646191	KZFVMHLRKXGLKH-UHFFFAOYSA-N	427.885	1.889	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)oc1C	767729465	PUAIXHRJWNPJLX-UHFFFAOYSA-N	435.502	1.311	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1)C(=O)Nc1cncnc1	768239851	PFDISAMDZVVARA-HXUWFJFHSA-N	430.468	1.190	50	20	IDGD	
CC1(C)CCC[C@]2(C1)NC(=O)N(CC(=O)NNC(=O)c1cnn(-c3ccccc3)c1)C2=O	768569369	QBSBDCIQVBAMMR-JOCHJYFZSA-N	438.488	1.524	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)Nc1cccnc1-n1cncn1	769995147	ZJSNKFGLKORUQE-UHFFFAOYSA-N	430.494	1.888	50	20	IDGD	
CCCCn1cc(C(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)c(C)n1	770245457	MNNGENIAMXZISK-UHFFFAOYSA-N	426.565	1.879	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)Nc1ccnn1[C@@H]1CCS(=O)(=O)C1	770759248	NPDCZDOXTIEQRR-WCQYABFASA-N	441.897	1.516	50	20	IDGD	
Cc1ccn(CC(=O)NNC(=O)c2nc(-c3ccccc3)n(-c3ccccc3)n2)c(=O)c1	770813740	PKYPCRVRCJMXMH-UHFFFAOYSA-N	428.452	1.866	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1ccc(C(N)=O)cc1)C(=O)NNc1cccc(C(F)(F)F)c1	770968653	NYMDOCKSBNJBFI-SNVBAGLBSA-N	430.408	1.614	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1cc(S(=O)(=O)N(C)C(C)C)ccc1Cl	771873537	HHVGAMJAHKNXQH-NSHDSACASA-N	433.914	1.472	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)CN1C(=O)c2ccccc2N2C(=O)CC[C@@]12C	771986173	VFFBGAYSOILUJQ-PEBXRYMYSA-N	444.488	1.111	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)c1nc(S(C)(=O)=O)n2ccccc12	772971815	OQOXXYQXQOMVKC-NSHDSACASA-N	436.877	1.620	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccn(-c2ccncc2)n1	774009436	PPQKZABLQQAMKL-LBPRGKRZSA-N	428.836	1.474	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(Br)c(C(=O)NCCCSC#N)c1	774298369	QGZOHICCUZNTFR-UHFFFAOYSA-N	436.353	1.708	50	20	IDGD	
Cc1cc(S(N)(=O)=O)ccc1CNC(=O)NNC(=O)NCc1ccc(Cl)cc1	775213426	WBGOQOXUJPRHLN-UHFFFAOYSA-N	425.898	1.509	50	20	IDGD	
COc1ccccc1[C@@](N)(C(=O)NNC(=O)CCNC(=O)OC(C)(C)C)C(F)(F)F	776196667	UNQGUFXHYUJWKG-QGZVFWFLSA-N	434.415	1.474	50	20	IDGD	
COC(=O)CCNC(=O)c1ccc(NC(=O)NNc2cccc(S(C)(=O)=O)c2)cc1	776465999	KLQBQDPLUFRRQR-UHFFFAOYSA-N	434.474	1.532	50	20	IDGD	
O=C(COc1cccc(C(F)(F)F)c1)N1CCN(S(=O)(=O)CBr)CC1	777833137	STEKSCGRLBEWPT-UHFFFAOYSA-N	445.257	1.911	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NN/C=C1/C(=O)N(c2ccccn2)C(=O)c2ccccc21	777869342	IWYDOOKJLSTFLK-FOWTUZBSSA-N	437.456	1.755	50	20	IDGD	
COc1ccccc1N(C)S(=O)(=O)c1ccc(Cl)c(C(=O)NN(C)C(N)=O)c1	778415717	NRQACPQBRBQQTJ-UHFFFAOYSA-N	426.882	1.829	50	20	IDGD	
Cc1c(C(=O)NNC(=O)CNC(=O)OC(C)(C)C)nnn1-c1cccc2cccnc12	778442667	YVHXJJGXCMCDMX-UHFFFAOYSA-N	425.449	1.410	50	20	IDGD	
O=C(NCc1ccccc1CN1CC[C@H](O)C1)NNC(=O)c1cccc(OC(F)F)c1	781801133	NRFOXOOKYAESPF-KRWDZBQOSA-N	434.443	1.999	50	20	IDGD	
O=C(NNc1ccc(OC(F)F)cc1)C(=O)Nc1cccc(Cn2cccnc2=O)c1	784311963	FVESVNAJXXWFDL-UHFFFAOYSA-N	429.383	1.975	50	20	IDGD	
CN(C)C1CCN(c2ccc(NC(=O)C(=O)NNc3nccnc3Cl)cc2F)CC1	784776409	ICVUYLCJYBQCEU-UHFFFAOYSA-N	435.891	1.881	50	20	IDGD	
O=C(NC[C@@H]1CCCO1)Nc1ccc(NC(=O)C(=O)NNc2cccc([N+](=O)[O-])c2)cc1	784828218	NSEQMUQFDAYDNG-KRWDZBQOSA-N	442.432	1.977	50	20	IDGD	
COC(=O)c1ccccc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)C(F)F)cc1	784833990	WWDGZQIJNDAIAM-UHFFFAOYSA-N	427.385	1.551	50	20	IDGD	
CCNC(=O)N(C)NC(=O)C(=O)Nc1ccc(CCn2cc(Br)cn2)cc1	784915440	NSQWHPVECYGHBR-UHFFFAOYSA-N	437.298	1.519	50	20	IDGD	
Cc1cc(OCc2cccc(F)c2)ccc1NC(=O)C(=O)NNc1nccn(C)c1=O	785086544	RQJMBHFPOXJGBQ-UHFFFAOYSA-N	425.420	1.889	50	20	IDGD	
CCCc1c(NC(=O)C(=O)NNC(=O)c2ccc(C#N)cc2)cnn1-c1cccc(C#N)c1	785990100	BYSNHNPSJSTXOU-UHFFFAOYSA-N	441.451	1.968	50	20	IDGD	
CCOC(=O)c1cnn(C)c1NC(=O)C(=O)NNC(=O)c1c(Cl)cccc1Cl	786417486	QRLBMHLMWXXQFV-UHFFFAOYSA-N	428.232	1.303	50	20	IDGD	
CCS(=O)(=O)CCn1cc(C)c(NC(=O)NNC(=O)COc2cc(C)ccc2C)n1	786733729	UBNCLGGMZQMAGT-UHFFFAOYSA-N	437.522	1.475	50	20	IDGD	
Cn1cc(S(=O)(=O)N2CCCCC2)cc1C(=O)NNc1nnc(-c2ccccn2)s1	788563996	YVXRBEBJJZIJDI-UHFFFAOYSA-N	447.546	1.870	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCC(F)(F)c2ccccc2)c1	788849430	VQJQIQTWJFCZOB-UHFFFAOYSA-N	426.445	1.673	50	20	IDGD	
Cc1cc(F)cc(-n2cc(C(=O)OCC(=O)NNC(=O)c3cccc(Cl)c3)nn2)c1	789058437	OECSVIBOWJOWLG-UHFFFAOYSA-N	431.811	1.986	50	20	IDGD	
O=C(COC(=O)c1ccc(O[C@@H]2CCOC2)cc1)NNC(=O)c1ccc([N+](=O)[O-])cc1	789201045	PRSXYWGCMJHZGX-QGZVFWFLSA-N	429.385	1.381	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cc([C@@H]3CCCO3)nn2C)cc1	789741003	MHZOCXAISJAVNM-GUYCJALGSA-N	443.460	1.028	50	20	IDGD	
CC(=O)N1CCc2ccc(S(=O)(=O)NNC(=O)Cn3ccc4ccccc43)cc2CC1	790054144	VCWRNQVQOAXTFO-UHFFFAOYSA-N	440.525	1.598	50	20	IDGD	
O=C(NNc1nc2ccccn2n1)C(=O)Nc1cccc(F)c1I	792393184	FCZRRWCLPSTJPZ-UHFFFAOYSA-N	440.176	1.555	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNC(=O)NCc1nc(Cc2ccccc2)no1	792933104	VQXDTQWUDLCLGO-UHFFFAOYSA-N	438.444	1.417	50	20	IDGD	
CN(CC(=O)NNC(=O)NCc1ccco1)c1cc(Br)ccc1[N+](=O)[O-]	795585906	BEQQCMZSJIKVBT-UHFFFAOYSA-N	426.227	1.917	50	20	IDGD	
CCCS(=O)(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2cccc(C)n2)c1C	797371015	NQWCSWUGJMYAKX-UHFFFAOYSA-N	433.490	1.250	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)[C@@H]2CCc3cnn(C)c3C2)cc1	798825849	RSABIEYHHZHUET-OAHLLOKOSA-N	425.518	1.407	50	20	IDGD	
N#Cc1cc(NC(=O)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)ccc1OC(F)(F)F	799833854	DXJWMMMMGGJKGA-UHFFFAOYSA-N	437.290	1.765	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)[C@H](NC(N)=O)C(C)(C)C)c2ccccc2c1=O	800316079	QPFKIFYHLUGMPZ-INIZCTEOSA-N	430.509	1.431	50	20	IDGD	
CN(CCc1cccc([N+](=O)[O-])c1)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	801012889	ADMFVZZEVJXOBE-UHFFFAOYSA-N	427.465	1.517	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(NS(=O)(=O)C(F)(F)F)c2)cc1	801110005	KYKWANLXERVZDC-UHFFFAOYSA-N	444.391	1.656	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)NC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1	802332732	OYXCTYWXBKDRAL-OAHLLOKOSA-N	442.497	1.943	50	20	IDGD	
O=C(COC(=O)[C@@H]1CCCN(C(=O)c2ccncc2)C1)NNC(=O)c1ccc(Cl)cc1	803491755	BCBAVOSREYKOLL-MRXNPFEDSA-N	444.875	1.592	50	20	IDGD	
Cc1cc([N+](=O)[O-])ccc1NNC(=O)[C@@H]1CN(Cc2nc(O)c3ccccc3n2)CCO1	805375930	ZSGCAMZPDRGWCA-SFHVURJKSA-N	438.444	1.896	50	20	IDGD	
COCCCS(=O)(=O)c1ccc(NC(=O)NNc2ccc(-n3ccnc3)nn2)cc1	806380864	IXLRLTYFSOHLIG-UHFFFAOYSA-N	431.478	1.621	50	20	IDGD	
O=C1COc2c(cc(Cl)cc2NC(=O)NNC(=O)c2nnc(O)c3ccccc23)N1	806754816	CSQQOISRPBLVKH-UHFFFAOYSA-N	428.792	1.786	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)Nc2cc(Cl)cc3c2OCC(=O)N3)c2ccccc2c1=O	806755228	MNIMYYSYZNALRG-UHFFFAOYSA-N	442.819	1.384	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ccncc2)c(C)cc1Br	806972137	IUIOHZFBWNKHAK-UHFFFAOYSA-N	435.234	1.339	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)C(=O)Nc1ccc(F)c(N2CCCNC2=O)c1	806973418	AHVQZHSITOAQJP-UHFFFAOYSA-N	447.398	1.049	50	20	IDGD	
CCN(CC)CC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2ccccc2C)c1	806975487	AZALYGZHOADWGO-UHFFFAOYSA-N	425.489	1.675	50	20	IDGD	
CN1CCN(C(=O)NNC(=O)CSc2nnc(C3CC3)n2Cc2ccccc2)CC1	807381903	ODIUVFUWMIGSQJ-UHFFFAOYSA-N	429.550	1.284	50	20	IDGD	
CN1CCN(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCc4ccccc43)c2)CC1	807382176	AEMQITWTPOEQAE-UHFFFAOYSA-N	443.529	1.040	50	20	IDGD	
CC(C)(C)OC(=O)Cc1ccccc1NC(=O)C(=O)NNc1ccc(-n2ccnc2)nn1	807428357	BVFYIMBCYFKJJV-UHFFFAOYSA-N	437.460	1.628	50	20	IDGD	
Cc1cc([N+](=O)[O-])ccc1NNC(=O)C(=O)Nc1ccc(F)c(-n2nnnc2C2CC2)c1	807457109	QFDDLSGEQGMWAU-UHFFFAOYSA-N	440.395	1.977	50	20	IDGD	
CCc1nnc(NC(=O)[C@@H](C)[C@H](C)NC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)s1	807565528	MYRPJLBSKYHCHR-UWVGGRQHSA-N	435.466	1.616	50	20	IDGD	
CCc1nnc(NC(=O)[C@@H](C)[C@H](C)NC(=O)NNC(=O)COc2ccc(C)cc2)s1	807565569	NHQSZMFYPHJXFN-STQMWFEESA-N	434.522	1.781	50	20	IDGD	
COCC(C)(C)CCCNC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1	807583247	ODBWSMWBSWGUKQ-UHFFFAOYSA-N	428.555	1.399	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)N1CCN([C@H]2CCN(C(=O)OC(C)(C)C)C2)CC1	808268621	UMIPOEOEYCINIH-INIZCTEOSA-N	447.536	1.677	50	20	IDGD	
CSc1ccc(-c2nsc(NC(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)n2)cc1	809932457	YJCDMRRGYSOICX-JTQLQIEISA-N	427.533	1.514	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc(Br)c([N+](=O)[O-])c1	810384852	QPEHPPVJZSOGIH-UHFFFAOYSA-N	437.206	1.766	50	20	IDGD	
NC(=O)c1ccc(OCC(F)F)c(NC(=O)C(=O)NNC(=O)c2cc3ccccc3o2)c1	810387096	FOSJNSBYXYGKRD-UHFFFAOYSA-N	446.366	1.575	50	20	IDGD	
O=C(NNS(=O)(=O)CCCN1C(=O)c2ccccc2C1=O)c1cccc2cccnc12	811684323	ZNLZRQTUADIFPC-UHFFFAOYSA-N	438.465	1.485	50	20	IDGD	
COc1cccc(C2(CNC(=O)NNC(=O)c3sc(N4CCOCC4)nc3C)CC2)c1	811851482	FZGJXUMYBMCTLV-UHFFFAOYSA-N	445.545	1.973	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)c2cc([N+](=O)[O-])cc(S(C)(=O)=O)c2)cc1	812728945	GBPHTMFLZLDJKF-UHFFFAOYSA-N	442.475	1.006	50	20	IDGD	
CC/C=C(/C)C(=O)N1CSC[C@H]1C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	812730382	GUUFDZPMKIOLJZ-DZNGUJDPSA-N	426.564	1.638	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@@H]2NC(=O)NNC(=O)COc1ccccc1O	813802791	SPBACJWOXLUCEK-INIZCTEOSA-N	434.493	1.891	50	20	IDGD	
CC(=NNC(=O)[C@H](C)CN1CCOCC1)c1cc(Br)ccc1OCC(=O)O	814762859	MNTHKBQJHZYHID-GFCCVEGCSA-N	442.310	1.721	50	20	IDGD	
C[C@@H]1SCCC1=NNC(=O)C[C@H](C(=O)NN=C1CCS[C@H]1C)N1CCOCC1	814855813	UJWYZPPXVPEKHW-HEHGZKQESA-N	427.596	1.073	50	20	IDGD	
COC(=O)C(C)(C)c1csc(NC(=O)C(=O)NNc2cccc(F)c2[N+](=O)[O-])n1	815629193	XAGBHTRTFUKWKT-UHFFFAOYSA-N	425.398	1.723	50	20	IDGD	
CCCN1C(=O)c2ccccc2N2C(=O)CC[C@@]12C(=O)NNC(=O)NCC(F)(F)F	816565395	NTOCLPNJOKWTMD-QGZVFWFLSA-N	427.383	1.268	50	20	IDGD	
Cn1nncc1NNC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(Br)cc2)C1	816770999	UVPMNLFALRZJND-NSHDSACASA-N	443.327	1.122	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)CN2C(=O)N[C@@](C)(c3ccc(F)cc3)C2=O)cc1	818431483	NVVWQZKZRFUXMO-NRFANRHFSA-N	428.420	1.128	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)CS[C@@H]2CCS(=O)(=O)C2)c1	818745990	NWRJHTSGUYUELA-SNVBAGLBSA-N	437.337	1.599	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)[C@H]2CC(=O)N(c3cc(C)ccc3OC)C2)cc1	825529271	FNMHEOXRUOGMNT-HNNXBMFYSA-N	426.473	1.625	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)N2CCN(CC(=O)NC(C)C)CC2)c(C)n1C[C@@H]1CCCO1	843328387	LUZRRHSHXIEGSY-JFLYLQGUSA-N	441.576	1.860	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)c2nn(CC(C)C)c(=O)c3ccccc23)cc1	848977898	HTDYYOQXHYVBFO-UHFFFAOYSA-N	436.468	1.979	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1cc(C(=O)N2CC[C@@H](B(O)O)C2)ccc1Br	864234852	XGQOSIRSXZNAQV-LLVKDONJSA-N	433.133	1.215	50	20	IDGD	
Cc1nn(C)c2sc(C(=O)OCC(=O)NNC(=O)[C@H]3COc4ccccc4O3)cc12	878443446	IIDMSTOLSJJAAO-CQSZACIVSA-N	430.442	1.087	50	20	IDGD	
Cc1cc(C)c(C)c(S(=O)(=O)NCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c1C	912764410	GNGAGYWSVQQNNF-UHFFFAOYSA-N	434.474	1.568	50	20	IDGD	
CC(=O)NCC(=O)NNC(=O)CCN1CCN(C(c2ccccc2)c2ccccc2)CC1	913481938	PZRTWTODUBXPSC-UHFFFAOYSA-N	437.544	1.067	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCOCC3)o2)cc1	914751479	CXGMYNUPOUIPIS-UHFFFAOYSA-N	439.515	1.162	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)c1ccc(=O)n(Cc2ccccc2)n1	915775588	HZFRAUUQCHCFKT-UHFFFAOYSA-N	430.468	1.665	50	20	IDGD	
Cc1occc1C(=O)Nc1nc(CC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cs1	915806725	URSISNQUGUPRQP-MRXNPFEDSA-N	442.453	1.827	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)sc(C)c1C	916562522	VABPOFRNENDSPN-UHFFFAOYSA-N	444.469	1.578	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N[C@H](CCSC)C(=O)NNC(=O)C(C)(C)C)cc1	917181634	XYIROFQKVYSLGF-OAHLLOKOSA-N	431.580	1.679	50	20	IDGD	
O=C(CNC(=O)c1c[nH]c2ccccc2c1=O)NNC(=O)Cc1cccc2ccccc12	917993424	FKZMSKYZGNBIIU-UHFFFAOYSA-N	428.448	1.801	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCc2cccc(Cn3cccn3)c2)c2ccccc2c1=O	918131778	MJXSRVDLFLLMMV-UHFFFAOYSA-N	445.483	1.805	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NC2CCN(c3ccccc3)CC2)c1	919785133	ZZRJOWXNGFJTJD-UHFFFAOYSA-N	445.545	1.550	50	20	IDGD	
CC(=O)N1CCc2cc(S(=O)(=O)NNC(=O)c3nnc(-c4ccccc4)o3)ccc21	919961561	CIYKMBLGMNOBBC-UHFFFAOYSA-N	427.442	1.269	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N[C@@H](C)Cn2cncn2)cc1	920851672	MSCDOGSYNPWODE-ZUZCKIMGSA-N	448.487	1.137	50	20	IDGD	
N#C/C(=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)NC[C@@H]1COCCO1	920854914	UOTSAKAAVPUZNZ-IKFRKZOMSA-N	443.891	1.517	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)[C@@H]1COc2ccccc2O1)c1ccc(N2CCOC2=O)cc1	920972474	WHIZYFPTECGLMY-ACJLOTCBSA-N	426.429	1.875	50	20	IDGD	
CC[C@@]1(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)CCN(C(=O)OC(C)(C)C)C1	1116334952	FJXFQVZIXAIOIK-JOCHJYFZSA-N	446.552	1.878	50	20	IDGD	
CN(C)C(=O)Nc1ccc(CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1	1321502090	ZRNKYOWSLMECMU-UHFFFAOYSA-N	447.521	1.217	50	20	IDGD	
COc1cc(C=NNC(=O)CN2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)ccc1F	1335666279	KOYYHOWYMAMQGD-UHFFFAOYSA-N	448.520	1.599	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2nc3ccccn3n2)C1	1777816956	VHFQBMBAKCSTFV-STXHMFSFSA-N	435.912	1.111	50	20	IDGD	
Cn1cccc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@](C)(Cl)CCl)C2)c1=O	1780707155	QAIWPIBDBCGBMF-UIAACRFSSA-N	444.359	1.749	50	20	IDGD	
CC(=O)N/C(C)=C/C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Br)C1	1780777208	TVZBHDYRESYJQY-PAKQUKTESA-N	434.306	1.231	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)CNC(=O)c3cccs3)CCO2)C1	1781225252	UTVRRRHXPSATPD-QZTJIDSGSA-N	448.372	1.544	50	20	IDGD	
O=C(c1cnc(Cl)s1)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781332341	XPPSQPXFLLLDIU-TVQRCGJNSA-N	426.695	1.931	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc4cccnn4c3)C2)C1	1782387768	BATRZCJXVBEOBC-VQIMIIECSA-N	435.322	1.951	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cc(Cl)ncn3)CCO2)C1	1783353551	XMPZAPMEHNDZOX-MEDUHNTESA-N	431.718	1.747	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN3CCSCC3)[C@H]2C1	1783496264	BRDGHFPMVJQQSK-UGUYLWEFSA-N	448.427	1.046	50	20	IDGD	
COc1ccc(CC(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](C)Br)C3)C2)cc1O	1783529412	UFWKOFCZMNFDDH-YJYMSZOUSA-N	441.322	1.557	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CC3CCN(C)CC3)C[C@@H]21	1783964155	LLTNSEARXQYLOE-UBDQQSCGSA-N	444.414	1.729	50	20	IDGD	
CC(C)(C(=O)N1CC[C@@]2(CN(C(=O)[C@@H](F)Br)CCO2)C1)c1ccccn1	1784276111	LTGBARCNNVIZDZ-RDTXWAMCSA-N	428.302	1.880	50	20	IDGD	
C[C@](O)(C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]21)C(F)(F)F	1784875997	OMYVXDXDYUCCHL-HKWCOGSCSA-N	435.270	1.516	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(N4CCOCC4)cn3)C[C@@H]21)[C@@H](F)Cl	1787444409	ZTEVLYPFEHDJFX-QXRTWZOPSA-N	440.903	1.046	50	20	IDGD	
CC(C)n1cnc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]32)n1	1787671075	HTVXLTFGLOGEOZ-NUXNZHGMSA-N	432.352	1.689	50	20	IDGD	
COc1cccc(C(=O)NC2(c3ccc(NC(=O)c4cccc(B(O)O)c4)cc3)CCC2)n1	1788145896	CCKQMAAOCJLQQA-UHFFFAOYSA-N	445.284	1.832	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3ccc(F)nc3)C[C@@H]21)[C@H](F)Br	1789922045	CSNYCEIHHHSLPJ-WSMBLCCSSA-N	446.292	1.824	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3cnn(C)c3)[C@H]2C1	1791670407	LQFMFEABJOFLHN-VGWMRTNUSA-N	427.343	1.116	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)n3ccnc3C)[C@H]2C1	1791707477	DQUXSMURHZYHNC-SRQBIAJPSA-N	441.370	1.906	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)c1cc2ccc(Cl)cc2[nH]1	1792415263	SVBWJCNGNDRQLV-LZDSYCOUSA-N	426.300	1.624	50	20	IDGD	
CC(C)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCN1Cc3ccccc3C1=O)C2	1792782865	IQQPPOPMATXLCJ-XEMDLRDOSA-N	447.963	1.887	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H]1C=C[C@@H](C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](O)CCl)C3)C1	1794138251	WBSIFNNGYNXQMO-VRXFMZDNSA-N	441.956	1.694	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCBr	1795117080	LQKIZEIUPXXOQC-SVZOTFJBSA-N	443.338	1.116	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)c1cc(-c2ccccc2)[nH]n1	1796188604	ZAALMULCRQGNEL-ACDBMABISA-N	444.300	1.322	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](C)[C@@H]1SC(=N)NC1=O	1796876782	FIBNOYCRTNHFKI-QKFSQAGISA-N	445.383	1.601	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnc2[nH]ncc2c1	1797998601	ZRBUORRVVZSOCJ-GTNWXXIDSA-N	448.487	1.344	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(Cl)nc1F)C2	1798440823	WVQKHJOAXQUSKO-ZSBIGDGJSA-N	446.870	1.438	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc(OC)c(C)c1)C2	1800638959	DQAKEMXJYQDZIB-QKPAOTATSA-N	440.338	1.775	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(=O)c1ccc(C)cc1)C2	1800644322	PKPDJWCTWQYSJG-YYIAUSFCSA-N	437.334	1.941	50	20	IDGD	
COc1cccc2[nH]cc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)c3ccc(B(O)O)cc3)C4)c12	1801032132	KAWDBZPDZQUEDB-BCDXTJNWSA-N	447.300	1.422	50	20	IDGD	
COc1ccc(COCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)C(Cl)Cl)C3)cc1	1801108231	QISDQJLBRNQJRW-XOIINTDNSA-N	431.316	1.605	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C=C/c1ccc(F)cc1F)C2	1802335028	WMBHFKLXLZNSMY-DTUWPTEXSA-N	434.487	1.989	50	20	IDGD	
O=C1Cc2cccc(C(=O)N3CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]3c3cccnc3)c2N1	1803146364	AOOURBOKANHFHZ-MDYRTPRTSA-N	442.903	1.496	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2cc(=O)n3[nH]cnc3n2)[C@H]1c1cccnc1	1808260836	YNVMZAAFVJXRSS-KEYYUXOJSA-N	443.895	1.150	50	20	IDGD	
Cc1ncsc1C(=O)N1CCCC2(CCN(C(=O)c3cccc(B(O)O)c3)CC2)C1	1808457679	SYYLJSMUYIEYFT-UHFFFAOYSA-N	427.335	1.290	50	20	IDGD	
C=C1CC(C(=O)N2CC[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)C1	1810295680	VFCYOHMMECWCBP-JXFKEZNVSA-N	434.500	1.366	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)NC[C@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1	1810527310	PFMKHPVVZGDVCX-SIIHOXLZSA-N	437.338	1.563	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1ccc(F)cc1	1811900229	LXLTTZQEJPIBJR-KNQAVFIVSA-N	447.275	1.534	50	20	IDGD	
C[C@H](C(=O)NC[C@@H]1CCN(C(=O)CO[Si](C)(C)C)[C@@H]1c1cccnc1)n1ccnn1	1812398363	CYDATXPHCBVLOL-HHXXYDBFSA-N	430.585	1.792	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2ccc(C#N)cc2)[C@@H]1c1cccnc1	1813072364	GQYIAPOQONTIEJ-NZQKXSOJSA-N	448.527	1.646	50	20	IDGD	
C[C@H](Cn1cncn1)C(=O)N1CC[C@H](CNC(=O)C(Cl)Cl)[C@H]1c1cccnc1	1813077419	INTAJYASEHCQSL-BPLDGKMQSA-N	425.320	1.819	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)c2cccn3c(O)nnc23)[C@H]1c1cccnc1)C(Cl)Cl	1813080617	URCSZQSZPLHLQZ-OCCSQVGLSA-N	449.298	1.953	50	20	IDGD	
CCc1ccc(C(=O)N[C@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)cc1	1815343587	BLPPZEWPXPCAMW-SFHVURJKSA-N	449.341	1.925	50	20	IDGD	
Cc1nn(C)cc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1	1815412628	YMLGXJWUEMBCJA-MRXNPFEDSA-N	430.513	1.131	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](N)CCC(N)=O)n[nH]1	1817246108	WFXMJEQSHJYZEG-GMXVVIOVSA-N	443.346	1.026	50	20	IDGD	
C=C[C@H](O)C(C)(C)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCC(=O)NN(C)C)CC2	1819720258	DVPWMAVYCHOWEP-DOMZBBRYSA-N	437.566	1.001	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc(CO)o2)n[nH]1	1819780166	XQWNTLSVPGDOEB-HNNXBMFYSA-N	432.481	1.174	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@H](O)CCl)CC2)c1cc(-c2ccncc2)[nH]n1	1820586115	ITEOYNGRMRFQCT-IAQYHMDHSA-N	446.920	1.754	50	20	IDGD	
O=C(CCc1ccoc1)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1822918313	FEUWBCFABRWGNH-LJQANCHMSA-N	436.277	1.621	50	20	IDGD	
COc1nccnc1C(=O)N[C@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1	1823001517	HHUAMHAQASJQCU-CPCISQLKSA-N	444.286	1.858	50	20	IDGD	
CN[C@H](CC(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@](C)(Cl)CCl)CC1)C(=O)O	1826946807	ZTWFVDQRILSQLA-ZRGWGRIASA-N	436.380	1.905	50	20	IDGD	
Cc1ncc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)cn1	1827050370	PHRDTBICBSWJAZ-NRFANRHFSA-N	436.321	1.012	50	20	IDGD	
O=C(CC1CCOCC1)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827050674	CMJAPPYDDGNXEO-JOCHJYFZSA-N	442.365	1.416	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)n2)CC1	1827602120	BQPCNFCMBRBTQR-RISCZKNCSA-N	441.326	1.905	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cn4ccsc4n3)C2)C1	1830361708	AXUVZTGNXKPTMD-IBGZPJMESA-N	440.953	1.731	50	20	IDGD	
CCCC(=O)N[C@@H](C)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830364504	MLQXQSAHVQNLMM-YWZLYKJASA-N	431.961	1.013	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccn3C)C2)C1	1830537342	DHZBCFRXKKUCFA-KDOFPFPSSA-N	428.327	1.126	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CCCS3)C2)C1	1830545422	IYHDEUOHVVEBQP-CPUCHLNUSA-N	435.384	1.369	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ncc(Cl)cn3)C2)C1	1831644077	NNMCJZRWKQUPRT-KBXCAEBGSA-N	431.320	1.608	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCCn3ccnc3)C2)C1	1831656399	FCCIMGVQEPFRIZ-PXNSSMCTSA-N	426.945	1.527	50	20	IDGD	
Cc1cc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@](C)(Cl)CCl)C3)C2)on1	1832571707	ZXTSEOMEQLPOMA-MSOLQXFVSA-N	434.320	1.218	50	20	IDGD	
CC(C)c1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)no1	1834497297	QMEQCEVPTYJMFD-FQEVSTJZSA-N	439.585	1.720	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)CC3CCOCC3)CCO2)C1	1835416522	VWADVPDHQUEZIA-DNVCBOLYSA-N	447.370	1.291	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCC(N2CCC(NC(=O)c3ccnnc3O)CC2)CC1	1836063285	PEWHNCYYQNFANP-LJQANCHMSA-N	444.363	1.604	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC(OC2CCN(C(=O)C3CC(O)C3)CC2)CC1	1836670780	SYBGCKGHHALHPL-NFOMZHRRSA-N	431.371	1.787	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)C(F)(F)C(F)F)C2)C1	1837709914	AXFSBDCCFZRWJB-HNNXBMFYSA-N	430.471	1.195	50	20	IDGD	
O=C(c1cnn2c1OCCC2)N1CCC(OC2CCN(C(=O)[C@H](F)Cl)CC2)CC1	1838084679	HKZNRSUPVVXLED-INIZCTEOSA-N	428.892	1.812	50	20	IDGD	
Cc1nc(F)ccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1	1838267692	BABKURLNKSDGIA-MOPGFXCFSA-N	448.322	1.835	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(F)cc3)CCO2)C1	1838953694	KVGNVLWCHBDFKH-AUUYWEPGSA-N	443.313	1.927	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)Oc3ccccn3)C2)C1	1839149245	ZBWDNMMQLZJHIM-GQIGUUNPSA-N	425.913	1.323	50	20	IDGD	
CCc1noc(C)c1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2	1839153813	SMRFBHSOWCHENN-RTBURBONSA-N	448.347	1.852	50	20	IDGD	
O=C(CCc1cccnc1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839198673	AHXVYFXHFPKXLS-AEFFLSMTSA-N	444.301	1.161	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)cc1O	1839267237	OVIWAVRFILJFQD-CRAIPNDOSA-N	445.285	1.461	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc(C)cn3)C2)C1	1839963431	KAAIXLXGCIMSLV-KBXCAEBGSA-N	441.326	1.029	50	20	IDGD	
CCc1cnc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](Cl)COC)CCO3)s1	1840153189	GZHAQKPEBYNTHW-KBXCAEBGSA-N	431.942	1.029	50	20	IDGD	
Cc1ncc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)CCBr)C3)C2)s1	1840398613	RGMPAIWQNJLOKB-QGZVFWFLSA-N	446.367	1.235	50	20	IDGD	
O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)CCc1ccoc1)CCO2	1840514392	WCZZPXCRHKRGFO-GOSISDBHSA-N	429.311	1.454	50	20	IDGD	
O=C(c1ccc2c(c1)CCCO2)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1840660871	FYMHGNBTRDDKOG-FQEVSTJZSA-N	443.327	1.885	50	20	IDGD	
O=C(c1ccc(N2C(=O)C=CC2=O)cc1)N1CC2(CCCN2C(=O)CCBr)C1	1842639376	ICVMWFVNFAIZMB-UHFFFAOYSA-N	446.301	1.718	50	20	IDGD	
O=C(Cc1cc2cccnc2cc1F)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843014447	KFGFVGZENDZJQC-UHFFFAOYSA-N	447.275	1.113	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)Cc1ccc3ccccc3c1)C2	1844263856	CDQXHCYFMVHDPA-UHFFFAOYSA-N	443.507	1.898	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)c1ncccc1C(F)(F)F)C2	1846385293	MUMAYVINHRHUGQ-UHFFFAOYSA-N	427.427	1.290	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1nc(-c2cccs2)n(-c2ccc(F)cc2)n1	11002962	UODMKRDDWXPAGU-LLVKDONJSA-N	449.489	1.331	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(C(=O)NNC(=O)COc2ccc(C#N)cc2)cc1	15889036	DGHMQPBJXHBXQV-UHFFFAOYSA-N	430.486	1.429	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(C(=O)NNC(=O)COc2cc(C)ccc2C)cc1	28659701	OADWBOBIMHOVPE-UHFFFAOYSA-N	435.502	1.068	50	20	IDGD	
COc1cc(NC(=O)[C@H]2C[C@H]2C)c(C(=O)NNC(=O)CNC(=O)c2ccco2)cc1OC	725740220	CWMWZVJEXIVBDJ-NEPJUHHUSA-N	444.444	1.082	50	20	IDGD	
Cc1cc(C)n2nc(NC(=O)NNC(=O)c3nn(C(C)C)c(=O)c4ccccc34)nc2n1	725853198	NGKUFGKTXCREBV-UHFFFAOYSA-N	435.448	1.498	50	20	IDGD	
O=C(NNC(=O)c1cc(Cl)ccc1O)c1cccc(CN2CCS(=O)(=O)CC2)c1	725881013	PUEUVKMZCNLYMZ-UHFFFAOYSA-N	437.905	1.351	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)[C@@H](C)N2C(=O)NC3(CCCC3)C2=O)c1	726496656	DUNYBSRACVPHBS-OAHLLOKOSA-N	430.505	1.898	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)NC[C@H](c2cccc(Cl)c2)N2CCOCC2)n1	727034039	FQIMFDVHHVBECZ-GOSISDBHSA-N	434.928	1.557	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N2CCCO[C@@H](C)C2)cc1	727400019	SNACCCKXZXDBRE-IQFISFIMSA-N	437.500	1.978	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)[C@H]1CC(=O)N(Cc2ccccc2)C1	728209522	DRFYTUSSUYNTJI-INIZCTEOSA-N	428.514	1.619	50	20	IDGD	
CON(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)c2cccc(OC(F)F)c2)cc1	728487174	VRCSSABUCNZMJG-UHFFFAOYSA-N	429.401	1.545	50	20	IDGD	
Cc1nc2ccccc2n1CCCNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1	728947476	XYMCSBDNHCEVFK-UHFFFAOYSA-N	436.520	1.772	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)N2CCN(S(=O)(=O)c3cccc(Cl)c3)CC2)c1	728954945	UPVRMYMYRGXAJM-UHFFFAOYSA-N	447.904	1.573	50	20	IDGD	
Cc1cccc(-c2nnc(-c3ccc(C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)cc3)o2)c1	729275960	TZOBEZRVGUELFI-ZDUSSCGKSA-N	443.485	1.411	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2sccc2OC(F)F)ccc1Cl	729300139	LBLMDXTVMPPXQI-UHFFFAOYSA-N	425.822	1.725	50	20	IDGD	
CC(=NNC(=O)c1ccc(C#N)cc1)c1cccc(N(S(C)(=O)=O)S(C)(=O)=O)c1	729819846	SDWFTKDKTRDADA-UHFFFAOYSA-N	434.499	1.438	50	20	IDGD	
COc1cc(C=NNC(=O)c2cc(Br)c[nH]2)cc(OC)c1OCC(N)=O	730550869	MOONBPZXDJKGFR-UHFFFAOYSA-N	425.239	1.422	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NNC(=O)COc2ccccc2O)s1	730779116	UHLXFIMLEQDZFY-ZDUSSCGKSA-N	439.515	1.142	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCCN(C(=O)CC3CCCC3)CC2)cc1OC	730808184	CKWRRUCNQYBVCY-UHFFFAOYSA-N	446.548	1.579	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])cc1	731102552	PUNQWHAJRVVIST-UHFFFAOYSA-N	448.819	1.291	50	20	IDGD	
C[C@H]1CCC[C@H](NC(=O)CN2CCN(C(=O)NNC(=O)c3ccc(C#N)cc3)CC2)C1	731223407	ZIVZQAZXXZRHSO-LPHOPBHVSA-N	426.521	1.225	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)c1cc(Br)c[nH]1)N1CCN(c2ccc(F)cc2)CC1	731866759	ZCHSPDAKFAZLON-LBPRGKRZSA-N	438.301	1.888	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2cc(Br)c[nH]2)c(F)cc1F	732046125	RVHHQNQRJFOAIK-UHFFFAOYSA-N	438.206	1.465	50	20	IDGD	
CN(C)CC(=O)NNC(=O)CSc1nnc(-c2ccccc2F)n1-c1ccccc1	733360926	JHVXEXWLVUQRNJ-UHFFFAOYSA-N	428.493	1.875	50	20	IDGD	
CC(=O)[C@H]1CC(C(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)=NN1c1ccccc1	733533047	GMAJKMJBGISQIF-GOSISDBHSA-N	442.859	1.868	50	20	IDGD	
COc1ccc(-n2nnc(C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)c2C)cc1	734239384	BHHSCQIVSXYTBE-UHFFFAOYSA-N	433.469	1.053	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)CCN1C(=O)c2ccccc2C1=O	734250605	AASCHBFMOHPCGD-UHFFFAOYSA-N	444.513	1.893	50	20	IDGD	
CS(=O)(=O)N1CCC(C(=O)NNc2cc(C(F)(F)F)nc(-c3cccnc3)n2)CC1	734257072	BQIJKTJDLBMXNF-UHFFFAOYSA-N	444.439	1.672	50	20	IDGD	
CCc1cc(NNC(=O)C2=CN3CCS(=O)(=O)N=C3C=C2)nc(-c2ccccn2)n1	734355045	ZAKVEPRGRPORSS-UHFFFAOYSA-N	425.474	1.042	50	20	IDGD	
COc1ccc(S(=O)(=O)C[C@H](C)C(=O)NNC(=O)c2cc(Br)c[nH]2)cc1	735030790	KLWHSYJAGOTGCS-JTQLQIEISA-N	444.307	1.657	50	20	IDGD	
O=C(CCSc1ccc2c(c1)OCCO2)NNC(=O)C1CCN(c2ncccn2)CC1	737544112	IJXHPOCWYYZJGM-UHFFFAOYSA-N	443.529	1.794	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)c1ccccc1F)C(=O)NNc1ccnc(N(C)C)n1	740118130	QTXLZEVYPUSGFF-CYBMUJFWSA-N	442.542	1.225	50	20	IDGD	
COc1ccc(-c2n[nH]c(CNC(=O)NNC(=O)c3nnc(O)c4ccccc34)n2)cc1	741413008	FIGNCHBNWBVXRW-UHFFFAOYSA-N	434.416	1.273	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)Nc2cnn(CC(=O)N3C[C@H](C)O[C@H](C)C3)c2)cc(C#N)n1C	741726066	JUMNFPNFWMZWEJ-FPPXEGAQSA-N	435.488	1.583	50	20	IDGD	
Cc1nc(-c2ccccc2)oc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	741742464	HDWRECQRBREWKX-UHFFFAOYSA-N	428.470	1.975	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2nc(Cl)c(Cl)c(N)c2Cl)c[nH]1	743249727	LMVYVBZOSNNQLF-UHFFFAOYSA-N	442.668	1.362	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NC2CCN(CC(F)(F)F)CC2)c2ccccc2c1=O	743356113	DJRQEORXNRLJDC-UHFFFAOYSA-N	440.426	1.387	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)n[nH]1	743829647	ZFSWHTMWRGWOGI-UHFFFAOYSA-N	429.458	1.955	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CN2CCN(Cc3nc4ccccc4s3)CC2)c1	744383646	VRNVWDQJQPXZPG-UHFFFAOYSA-N	434.525	1.747	50	20	IDGD	
C[C@@H]1Oc2ccccc2O[C@H]1C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	744620376	CITMHDRZUDNWQO-IFXJQAMLSA-N	433.486	1.379	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(CNC(=O)C3CCCC3)cc2)cc1	744945917	RTBNRYSDMUOOAL-UHFFFAOYSA-N	448.479	1.983	50	20	IDGD	
CC(C)(C)OC(=O)CCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	745837024	VYRMQEDLYRCFHC-UHFFFAOYSA-N	440.522	1.147	50	20	IDGD	
COc1cc(NC(=O)Cc2cccs2)c(C(=O)NNC(=O)N2CCOCC2)cc1OC	745986257	PUKUHUGWKIZGAY-UHFFFAOYSA-N	448.501	1.633	50	20	IDGD	
CN(C)[C@H](C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)c1c(F)cccc1Cl	746123966	VPPZZLOWKMAHOC-INIZCTEOSA-N	427.885	1.947	50	20	IDGD	
Cc1ccc(NC(=O)N2CCN(CC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)CC2)cc1	746478765	MDUGAKQFSLEKBK-UHFFFAOYSA-N	440.460	1.514	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1F)c1ccc(S(=O)(=O)N2CCOCC2)cc1	747331067	REMWHJWVTMWTNJ-UHFFFAOYSA-N	441.868	1.575	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)NCc1ccc(S(=O)(=O)N2CCCCC2)cc1	747491240	RPOFEDZQUXVVLD-UHFFFAOYSA-N	431.518	1.329	50	20	IDGD	
COc1cc(N2C[C@@H](C(=O)NNc3cc(Cl)nc(C)n3)CC2=O)cc(OC)c1OC	747982137	RJVQJFXIURUQJW-NSHDSACASA-N	435.868	1.960	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2C[C@@H](CC(=O)N(C)C)c3cc(Cl)ccc32)n1	749445436	RRAFLNZBTUWSJI-CYBMUJFWSA-N	449.964	1.877	50	20	IDGD	
CNS(=O)(=O)C[C@H]1CCCN1C(=O)CCC(=O)C(C#N)=C1N(C)c2ccccc2N1C	749519419	ZGTUEPSWVCOLNE-OAHLLOKOSA-N	445.545	1.197	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)N[C@H]1CCN(CCCc2ccccc2)C1=O	750662606	XSXOUQCYGZYGPW-SFHVURJKSA-N	448.483	1.513	50	20	IDGD	
C[C@@]1(c2ccc(C(=O)NNc3nc(Br)cn4ccnc34)cc2)NC(=O)NC1=O	751069891	DZJDZOVONZQKMM-KRWDZBQOSA-N	444.249	1.303	50	20	IDGD	
Cc1c(C(=O)NNC(=O)CNC(=O)c2ccco2)sc2nc3n(c(=O)c12)CCCCC3	751206593	JQYGAWFFIAIJRU-UHFFFAOYSA-N	443.485	1.277	50	20	IDGD	
CS(=O)(=O)Nc1cc2ccccc2cc1C(=O)NNC(=O)CNC(=O)c1cccs1	751209850	VMXUSTLFAMCDBT-UHFFFAOYSA-N	446.510	1.464	50	20	IDGD	
COc1ccc(CCN2C[C@@H](C(=O)NNC(=S)N[C@@H](C)C3CC3)CC2=O)cc1OC	751616810	JZNAHZOXDRPOFC-BBRMVZONSA-N	434.562	1.389	50	20	IDGD	
C[C@]1(NNC(=O)N[C@@H]2CC(=O)N(c3cccc(C(F)(F)F)c3)C2)CCS(=O)(=O)C1	753035444	WORMUMUQLPKBKH-WBMJQRKESA-N	434.440	1.192	50	20	IDGD	
CN(CCS(C)(=O)=O)C(=O)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1	753041493	OUADNLQOROHICO-FQEVSTJZSA-N	444.557	1.331	50	20	IDGD	
COC(=O)c1coc(S(=O)(=O)NNC(=O)c2nc(Cl)c(Cl)c(N)c2Cl)c1	753949911	UTBXEWLUGFSSPB-UHFFFAOYSA-N	443.652	1.627	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)c([N+](=O)[O-])c1)c1cccc(S(=O)(=O)N2CCCC2)c1	754830659	SEPBJMIWXSMXNK-UHFFFAOYSA-N	434.430	1.160	50	20	IDGD	
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC[C@@H](C(=O)NNc2ccc(C(F)(F)F)nn2)C1	755193485	GCQYRMYNKQZIDT-LLVKDONJSA-N	447.443	1.379	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1	755361055	SRIUPWGVULYBAV-SFHVURJKSA-N	448.501	1.710	50	20	IDGD	
COCC(C)(C)C(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2OC)c1	755382533	VQUQHOPVTWPENS-UHFFFAOYSA-N	435.502	1.930	50	20	IDGD	
CC(C)N(C)S(=O)(=O)c1ccc(NC(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1	755451059	IUCNWQJVEVVZSD-UHFFFAOYSA-N	448.501	1.953	50	20	IDGD	
CN(C)CCOc1cccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1	755927174	ROEBXFCWZWIHFZ-UHFFFAOYSA-N	449.533	1.344	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)Nc1cccc(Cn2nc3ccccn3c2=O)c1	755938582	VDBLELQKEVDMBE-UHFFFAOYSA-N	447.411	1.919	50	20	IDGD	
CN1CCCCC/C1=N/S(=O)(=O)c1ccc(NC(=O)NNC(=O)c2cnn(C)c2)cc1	756112747	FUKGSPVUJNRLIA-ULJHMMPZSA-N	447.521	1.480	50	20	IDGD	
CNC(=O)COc1ccc(NC(=O)NNC(=O)c2cc(-c3ccccc3OC)[nH]n2)cc1	756440661	FVSHUJPBNLSXIL-UHFFFAOYSA-N	438.444	1.677	50	20	IDGD	
N#CCCn1ccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)n1	756652787	ASAYJBUJWXUHLA-UHFFFAOYSA-N	431.478	1.048	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)n(C2CCN(C)CC2)n1	756891155	DUGJLWNQVYDELK-UHFFFAOYSA-N	438.492	1.172	50	20	IDGD	
CCN1CCN(C(=O)Cc2ccc(NC(=O)NNC(=O)Cn3nc(C)cc3C)cc2)CC1	757578283	CSPCYQBRGNHOHY-UHFFFAOYSA-N	441.536	1.059	50	20	IDGD	
O=C(c1cnn(-c2ccccc2F)c1)N1CCN(S(=O)(=O)CBr)CC1	758516675	FHQDKIUSKKWMHY-UHFFFAOYSA-N	431.287	1.451	50	20	IDGD	
COc1ccc(C[C@@H](C)C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1	758567003	BYRZJRIAAISQPC-AUUYWEPGSA-N	428.441	1.404	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCC[C@@H]([C@H](C)NC(=O)OC(C)(C)C)C2)n1	758780773	UITVVFWLVMIBAW-LSDHHAIUSA-N	439.582	1.767	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)[C@@](C)(O)CN1C(=O)C(C)(C)c2ccccc21	760064664	BLNFHGSKLJEKEI-FATZIPQQSA-N	443.475	1.816	50	20	IDGD	
CCc1ccc(C(=O)NNS(=O)(=O)c2ccc(OC)cc2NS(=O)(=O)CC)cc1	761266218	FVNLYZDTKSEGFP-UHFFFAOYSA-N	441.531	1.643	50	20	IDGD	
COc1ccc2c(c1)[C@@H](C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1)CC2	762872094	XFPVCNAKXWLONS-KRWDZBQOSA-N	445.545	1.199	50	20	IDGD	
CC(C)C(=O)N1CCCC[C@@H]1C(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	763283026	PPVMCGULTMIIKC-MRXNPFEDSA-N	439.557	1.659	50	20	IDGD	
CCN(CC)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1	763445448	HRLHWADBFMIYKC-UHFFFAOYSA-N	427.417	1.477	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)cc2)CCO1	763467357	CPXKBMPSKGHNQL-ZDUSSCGKSA-N	427.417	1.220	50	20	IDGD	
COc1ccc(C)cc1NC(=O)C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	763529939	DFYJNFKQSFMKLZ-UHFFFAOYSA-N	439.516	1.302	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccnn2Cc2ccc(C)o2)cc1OC	763544410	XJDNWAVHKRBYTM-UHFFFAOYSA-N	427.417	1.250	50	20	IDGD	
CC(C)CC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)cc1	763557638	CIFDPNHLUDLAKP-UHFFFAOYSA-N	426.429	1.800	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)Nc1ccc2c(c1)nc1n2CCCCC1	763571323	MABMGTJTFNMARC-IBGZPJMESA-N	449.467	1.689	50	20	IDGD	
CCCOC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1	763572909	VSKZHDWJIMVTEW-QGZVFWFLSA-N	427.413	1.179	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(NC(C)=O)c(Cl)c2)cc1	763663463	JBQVANIIJDPTLJ-UHFFFAOYSA-N	434.836	1.472	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F	763681260	OHLLYOJGAUMFKK-UHFFFAOYSA-N	442.306	1.500	50	20	IDGD	
CNC(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)CC23CC4CC(CC(C4)C2)C3)cc1	763734259	JWEZJAFQHMTNPN-UHFFFAOYSA-N	426.517	1.668	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)C(=O)Nc1ccc2c(cnn2C(F)F)c1	763804944	YKGUDEGMTNFUGU-UHFFFAOYSA-N	448.342	1.505	50	20	IDGD	
CC[C@H](Cc1ccccc1Br)C(=O)NNC(=O)CNC(=O)c1cccnc1	763820555	MPXXIHPFESFBSW-CYBMUJFWSA-N	433.306	1.990	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cccc(CS(C)(=O)=O)c2)c1C	763840228	JOBAMGDHEFSPMI-HNNXBMFYSA-N	447.513	1.401	50	20	IDGD	
CC(C)(C)OC(=O)Cc1ccccc1NC(=O)C(=O)NNC(=O)COc1ccc(F)cc1	763842348	ZLAKAUKUSTULNC-UHFFFAOYSA-N	445.447	1.875	50	20	IDGD	
CNC(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)c1	763849849	LALSUJQVKUATBD-SNVBAGLBSA-N	436.827	1.392	50	20	IDGD	
Cc1ccc(Cn2nccc2NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)o1	763849919	MOSUCQIBMOXEDD-CYBMUJFWSA-N	429.408	1.525	50	20	IDGD	
COC(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)c1	763866003	MYZDDSVSPMPGFO-SNVBAGLBSA-N	437.811	1.819	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccccc1O[C@@H]1CCOC1	763867340	UUQSRHULVMVLOR-XJKSGUPXSA-N	431.420	1.547	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)cc1F	763870683	BGPINGPENYUAOV-GFCCVEGCSA-N	437.399	1.543	50	20	IDGD	
CCOC(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)CSc2ccc(C)cc2)c1	763891975	SZGXPADFUVCGRU-UHFFFAOYSA-N	429.498	1.979	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)C(=O)Nc1ccc(F)c(C(N)=O)c1	763903232	PYTJCCBKHCHILZ-UHFFFAOYSA-N	441.444	1.756	50	20	IDGD	
COC(=O)CNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cccc3ccccc23)cc1	764050873	IENJEFUYOLZJEU-UHFFFAOYSA-N	448.435	1.142	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)CC(F)(F)F)c2ccccc12	764116693	OBTIJPBUECDPDZ-UHFFFAOYSA-N	427.335	1.430	50	20	IDGD	
C[C@@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3ccc(Cl)cc3O)cc2)CCO1	764127699	YNVHSMVHZKTSPE-GFCCVEGCSA-N	432.864	1.670	50	20	IDGD	
CC(C)CCC(=O)NNC(=O)C(=O)Nc1ccc(S(=O)(=O)N2CCC(C)CC2)cc1	764200426	ZVIVTBGZAJLLOZ-UHFFFAOYSA-N	438.550	1.629	50	20	IDGD	
Cc1ncsc1C(=O)NNC(=O)C(=O)Nc1cccc(-c2nnc3n2CCCCC3)c1	764247615	UPAKVLQTNQKKBU-UHFFFAOYSA-N	439.501	1.836	50	20	IDGD	
COc1ccc(NC(C)=O)cc1NC(=O)C(=O)NNC(=O)c1cccc(OC(F)F)c1	764251248	SRUHTVOVZAUPEG-UHFFFAOYSA-N	436.371	1.655	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl	764266475	KAKKHGBVWHNNKK-UHFFFAOYSA-N	447.839	1.041	50	20	IDGD	
C[C@@H](c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)cc1)N1CCOCC1	764349765	VFLJQHAKWOHCLE-ZDUSSCGKSA-N	446.891	1.839	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)C(=O)Nc1c(F)c(F)c(F)c(F)c1F	764350624	GWTXRCMRXZJGNL-UHFFFAOYSA-N	439.300	1.968	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2cccs2)[nH]n1)C(=O)Nc1cncc(Br)c1	764382352	HPPJWHYBXDKDSQ-UHFFFAOYSA-N	435.263	1.695	50	20	IDGD	
CCOC(=O)c1ccn(-c2ccccc2NC(=O)C(=O)NNC(=O)Cc2ccccc2C)n1	764411056	HCTXWZIWVQGEPK-UHFFFAOYSA-N	449.467	1.686	50	20	IDGD	
CCOCCCNC(=S)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	764519599	RNTSQMHJBQOGDI-UHFFFAOYSA-N	428.002	1.380	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)[C@H](C)NS(=O)(=O)c3cccc(C#N)c3)cc2C1	764571802	KLSOKKLEIDGWLY-STQMWFEESA-N	446.554	1.873	50	20	IDGD	
CC(=NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1)c1ccc(N2CCOC2=O)cc1	764829377	WCQGJKOXBWNETJ-UHFFFAOYSA-N	449.511	1.941	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)[C@@H]1CCCN(C(=O)c2ccccc2)C1	765310711	KQQKDJGDQNDWFF-QGZVFWFLSA-N	432.521	1.991	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCC[C@@H](c2n[nH]c(C3CC3)n2)C1	766256118	IYSJZNJAPJDLJA-CYBMUJFWSA-N	432.912	1.985	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cc(C)nc4cc(C)nn34)CC2)cc1	766639450	AFDONHJSBUZPJN-UHFFFAOYSA-N	435.532	1.233	50	20	IDGD	
COC(=O)N(C)CCCC(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	766663321	KADXBOJTGOSQEO-UHFFFAOYSA-N	439.944	1.083	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)c1c(F)ccc(S(=O)(=O)NC2CC2)c1F	766663701	UZLZYGDSZJONEC-UHFFFAOYSA-N	445.469	1.566	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NC2CCN([C@@H]3CCC[C@@H]3O)CC2)cc(OC)c1OC	767927285	JYVXJEWQUYISCF-CVEARBPZSA-N	436.509	1.034	50	20	IDGD	
O=C(CCS(=O)(=O)c1ccc2c(c1)OCCCO2)NNC(=S)Nc1ccccn1	768584475	QJRYEKDKKCAZPV-UHFFFAOYSA-N	436.515	1.425	50	20	IDGD	
C[C@@]1(c2ccc(F)c(Cl)c2)NC(=O)N(CC(=O)NNC(=O)c2ccccc2F)C1=O	769728986	QWWLPVJEQCTAPH-IBGZPJMESA-N	436.802	1.846	50	20	IDGD	
CCS(=O)(=O)N1CCC(NC(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)CC1	770129653	SCSDNMBNLHCRSZ-GFCCVEGCSA-N	432.930	1.252	50	20	IDGD	
COc1ccc(-n2nc(C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)cc2C)cc1	770757859	ORCACZBTNVETMU-UHFFFAOYSA-N	432.481	1.658	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)c3cc4c(cc3[N+](=O)[O-])OCCO4)nc21	770969152	SILLLMBWLRKLFG-UHFFFAOYSA-N	429.393	1.723	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)C1CCN(C(=O)c2cc(OC)cc(OC)c2)CC1	772015472	GWZJCIUMLWUAKH-CYBMUJFWSA-N	435.477	1.045	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)[C@H]1C[C@@H]1c1ccc2c(c1)OCCO2	772194766	DJEUTTUVOHMOJU-CVEARBPZSA-N	429.860	1.679	50	20	IDGD	
Cc1cc(C(=O)NCC(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)ccc1[N+](=O)[O-]	772967881	BZTJRBGZKRPDFU-LBPRGKRZSA-N	434.836	1.901	50	20	IDGD	
CCN(CC)CCn1ccc2cc(NC(=O)C(=O)NNc3nccc(OC)n3)ccc21	773726767	QXQYSYGEYDQPCM-UHFFFAOYSA-N	425.493	1.864	50	20	IDGD	
COC(=O)[C@@H](C)n1cccc1C=NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	774590099	WBUJHAUWRVAQDV-OAHLLOKOSA-N	432.502	1.771	50	20	IDGD	
CO[C@H](c1ccccc1F)[C@H](C)NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	776078322	YKHLVSSCMPZJSG-SGTLLEGYSA-N	427.436	1.793	50	20	IDGD	
CC(C)CS(=O)(=O)N1CCC(NC(=O)NNC(=O)c2cc3c(s2)CCC3)CC1	777765162	GZIGUMKRPVMANN-UHFFFAOYSA-N	428.580	1.631	50	20	IDGD	
COc1cc(C=NNC(=O)CNC(=O)OC(C)(C)C)cc(I)c1O	777900768	UFXWSNLSHBIZCQ-UHFFFAOYSA-N	449.245	1.980	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)/C(=C\c2cccc(OC)c2)n2nnnc2C)nc1C	778427593	COVFCIVMJYECEN-LICLKQGHSA-N	438.448	1.407	50	20	IDGD	
CC1(C)C[C@@H](NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)C(C)(C)O1	779380438	SNJAYUGXOGASTL-MRXNPFEDSA-N	438.550	1.761	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)[C@@H](O)[C@H](O)c1nc2ccccc2s1	779491539	QLKOGMHUPHCYDH-OALUTQOASA-N	439.497	1.450	50	20	IDGD	
Cn1cnc(-c2ccc(C(=O)NNC(=O)c3ccc(CSc4nncn4C)cc3)cc2)n1	779867595	WBARPTQYNCSDHL-UHFFFAOYSA-N	448.512	1.978	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cc(F)ccc2Br)cc1-n1cnnn1	781685035	SVKPASGJMMDABU-UHFFFAOYSA-N	435.213	1.647	50	20	IDGD	
CCOc1cc(N2CCOC(C)(C)C2)ccc1NC(=O)C(=O)NNC(=O)c1ccncc1	782121591	QSVIJYHUTLNFOL-UHFFFAOYSA-N	441.488	1.495	50	20	IDGD	
Cc1cc(-c2ncccc2NC(=O)C(=O)NNC(=O)COc2ccccc2O)cs1	782702494	NZULPOWEVNJQGY-UHFFFAOYSA-N	426.454	1.989	50	20	IDGD	
CNS(=O)(=O)c1cc(NC(=O)C(=O)NNc2ncccc2C(F)(F)F)ccc1C	783112282	MKUUDSGLVHJPKM-UHFFFAOYSA-N	431.396	1.399	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNc2cncc(Cl)n2)cccc1S(=O)(=O)NC(C)(C)C	783258971	SBTDTRNYFZCKBE-UHFFFAOYSA-N	440.913	1.597	50	20	IDGD	
Cc1ccccc1NC(=O)NNC(=O)C(=O)Nc1ccc(F)c(S(=O)(=O)NC2CC2)c1	783417397	QNKNCJJWQVSJIG-UHFFFAOYSA-N	449.464	1.366	50	20	IDGD	
COC(=O)CCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)Nc2ccccc2C)cc1	783417606	WQUVDWCEPYYGCK-UHFFFAOYSA-N	441.444	1.079	50	20	IDGD	
COC(=O)CN1CCN(c2ccc(NC(=O)C(=O)NNc3ccc(F)cc3C)cc2)CC1	783446124	HKPTZCIBEGTDFS-UHFFFAOYSA-N	443.479	1.511	50	20	IDGD	
CN(C)c1ccc(S(=O)(=O)N2CCCCC2)cc1NC(=O)C(=O)NNc1ccccn1	784794232	JTEPNAMQWRFHKS-UHFFFAOYSA-N	446.533	1.404	50	20	IDGD	
CCCN(CCC)C(=O)c1ccc(NC(=O)C(=O)NNc2ccnc(N(C)C)n2)cc1	784970637	KMFMMXDYPZBBQQ-UHFFFAOYSA-N	427.509	1.887	50	20	IDGD	
CC[C@H](C)n1ncc(NC(=O)C(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)c1C1CC1	785023911	PXVZXRDLYUXLEI-JTQLQIEISA-N	430.421	1.745	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)Cc2ccc(C(=O)NNC(=O)c3cnn(C)n3)cc2)cc1	785684557	NEAIVSJKKRUSKF-UHFFFAOYSA-N	442.501	1.019	50	20	IDGD	
CCS(=O)(=O)CCn1cc(C)c(NC(=O)NNC(=O)c2ccc(Cl)cc2OC)n1	786714042	XPTOODVYYPYGAM-UHFFFAOYSA-N	443.913	1.755	50	20	IDGD	
C=CCN(C)S(=O)(=O)c1ccc(NC(=O)NNC(=O)C(C)(OCC)OCC)cc1	787993832	DWKLNGPIWGBSPS-UHFFFAOYSA-N	428.511	1.435	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)CC2CCC3(CC2)OCCO3)ccc1Cl	788083164	NUBMAJYSSKCKGQ-UHFFFAOYSA-N	431.898	1.072	50	20	IDGD	
Cc1nc(C)n(-c2ccccc2NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)n1	789812047	IPMPSBHHKUMKEV-PXNSSMCTSA-N	448.483	1.543	50	20	IDGD	
CCc1[nH]nc(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)c1Br	789871108	MQORQQUKMYMLDO-UHFFFAOYSA-N	429.300	1.103	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c1C	790060718	JQLQHCANMVSHKS-SFQUDFHCSA-N	448.483	1.366	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)c1cc(S(=O)(=O)N(CC)CC)ccc1C	790063900	RBAWYWODMKYERH-UHFFFAOYSA-N	429.539	1.576	50	20	IDGD	
COC(=O)c1cc(C=NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)cn1C	790141493	JTZKIVAHUHJUJG-UHFFFAOYSA-N	432.502	1.750	50	20	IDGD	
Cc1onc(-c2ccc(C(F)(F)F)cc2)c1C(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1	790218122	GUBNJHKFJSJCJU-LLVKDONJSA-N	431.392	1.865	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(CCNC(=O)NNc2nc3ccccn3n2)s1	790289015	BHMPGPBARZRWKW-UHFFFAOYSA-N	437.551	1.690	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)COc2ccccc2F)cccc1NC(=O)N(C)C	792352701	GSNUMTSGHSVUKG-UHFFFAOYSA-N	431.424	1.393	50	20	IDGD	
COc1c(NC(=O)C(=O)NNC(=O)c2ccc(O)cc2)cc(Cl)cc1C(=O)N(C)C	793035776	QSBIKVZCKJZOBJ-UHFFFAOYSA-N	434.836	1.156	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CNC(=O)OCc2ccccc2)cc(NC(C)=O)c1OC	794069366	GJSYUTAKVLHWLP-UHFFFAOYSA-N	444.444	1.350	50	20	IDGD	
Cc1nn(Cc2ccccc2)c(N)c1C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	794718075	WLPKTRTUOBQYCE-UHFFFAOYSA-N	428.518	1.829	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)C(C)(C)c2ccccc2[N+](=O)[O-])cc1OC	796440264	WJSJKQIRHQMRBG-UHFFFAOYSA-N	445.428	1.894	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNC(=O)C(=O)Nc1csc2ccccc12	797368009	GNXCUJOTKOTMJI-UHFFFAOYSA-N	426.454	1.914	50	20	IDGD	
Cc1ccccc1NC(=O)NNC(=O)[C@H]1CCCN1S(=O)(=O)c1cccc([N+](=O)[O-])c1	798310854	XFTPOWIERZVAEH-QGZVFWFLSA-N	447.473	1.909	50	20	IDGD	
COCCCn1c(S)nc2cc(C(=O)NNC(=O)NCC(F)(F)F)ccc2c1=O	798315879	DQYZXVBUFXARPQ-UHFFFAOYSA-N	433.412	1.228	50	20	IDGD	
O=C(/C=C/c1ccccc1)NCCCNC(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	800069632	AAAQKIGBMVOWEW-OUKQBFOZSA-N	448.483	1.742	50	20	IDGD	
C[C@@H](Sc1ccccc1C(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1)C(N)=O	801182293	KFUCAIKDPGZEOI-LLVKDONJSA-N	434.905	1.383	50	20	IDGD	
COc1cc(OC)cc(C2(F)CCN(C(=O)NNC(=O)CNC(=O)c3ccco3)CC2)c1	801749415	XLBWWRYJMDHIHL-UHFFFAOYSA-N	448.451	1.728	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cnc(C3CC3)nc2N)c1	806305851	AFMVBAAIOBZXQX-UHFFFAOYSA-N	432.506	1.042	50	20	IDGD	
CCOC(=O)[C@H](C)NC(=O)c1ccc(NC(=O)NNc2ccc(-n3ccnc3)nn2)cc1	806311472	RGKULLJHZFZMOG-ZDUSSCGKSA-N	438.448	1.492	50	20	IDGD	
CCOC(=O)C(C)(C)c1csc(NC(=O)C(=O)NNC(=O)c2ccc(CC)cc2)n1	806974882	XVRIGQCSNNZQFT-UHFFFAOYSA-N	432.502	1.946	50	20	IDGD	
COc1ccc(Cn2nccc2NC(=O)C(=O)NNc2ncccc2F)c(OC)c1OC	807300505	DXHUVXRCVSRDMP-UHFFFAOYSA-N	444.423	1.573	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCC2CCN(C(=O)OC)CC2)nc1	807523446	IAENEJSDYPHKTL-UHFFFAOYSA-N	442.542	1.217	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCCCn2cc(Br)cn2)c(OC)c1	807613786	PSYHCFVRYMGAFG-UHFFFAOYSA-N	426.271	1.697	50	20	IDGD	
COc1ccc(CNC(=O)NNC(=O)c2cccc3cccnc23)cc1S(N)(=O)=O	808256656	MNQIHROSVOHMQL-UHFFFAOYSA-N	429.458	1.035	50	20	IDGD	
C=C[C@@](C)(O)CC(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2OC)c1	809980172	IFAPJPDVHYVTNW-HXUWFJFHSA-N	433.486	1.584	50	20	IDGD	
COCC1(C(=O)NNc2ccc(S(=O)(=O)Nc3nccs3)cc2)CCOCC1	810468984	HCIMFERRXITUFO-UHFFFAOYSA-N	426.520	1.830	50	20	IDGD	
CCNC(=O)c1ccc(C)c(NC(=O)C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)c1	813033908	QVEPJWISBNLKLA-UHFFFAOYSA-N	447.517	1.077	50	20	IDGD	
O=C(CCOc1ccccc1)NNC(=O)C1(S(=O)(=O)c2ccccc2)CCOCC1	813429878	JKFYDFMTJCJQRA-UHFFFAOYSA-N	432.498	1.626	50	20	IDGD	
C[C@@H](Cc1cnc2ccccc2n1)C(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	815467250	TUYTYYHJHJSXTL-ZDUSSCGKSA-N	437.412	1.721	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)[C@H](O)[C@H](O)c1nc2ccccc2s1	825477587	RPVCNMDNWJWHDG-MSOLQXFVSA-N	431.470	1.316	50	20	IDGD	
COc1cccc(C(=O)N2CCN(CC(=O)NNC(=O)c3cccc(Cl)c3)CC2)c1	912886541	YOOAEQKZQJFEPE-UHFFFAOYSA-N	430.892	1.568	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)c2cc(-c3ccco3)nc3c(C(N)=O)ncn23)c1	913081476	QPOBTFCVHZAZCY-UHFFFAOYSA-N	448.439	1.545	50	20	IDGD	
O=C(CN1CCCN(C(=O)c2ccc(F)cc2)CC1)NNC(=O)c1ccc([N+](=O)[O-])cc1	913146525	ALFFOGBIFITAQI-UHFFFAOYSA-N	443.435	1.343	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)NCCc3ccc(S(N)(=O)=O)cc3)n[nH]2)cc1	915883750	HFWOELHSBHGSNA-UHFFFAOYSA-N	442.501	1.219	50	20	IDGD	
COc1ccccc1NCC(=O)NN=C(C)c1ccc(S(=O)(=O)N2CCOCC2)cc1	915919601	CCVUGIYEKBBKKD-UHFFFAOYSA-N	446.529	1.668	50	20	IDGD	
CCn1cnc2c1c(=O)n(CC(=O)NN=C(C)c1ccc(C)o1)c(=O)n2Cc1ccccc1	916332142	PGUZENVLFVNXKJ-UHFFFAOYSA-N	448.483	1.870	50	20	IDGD	
CC(C)(C)n1cc(C(=O)C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cn1	916726872	YGPHOULDGDUSMO-UHFFFAOYSA-N	447.517	1.067	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N[C@H](C)CN1CCCC1=O	918099844	BZBCKURQXFLOKX-NEPJUHHUSA-N	427.299	1.558	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCCC(=O)NC2CCCCC2)c2ccccc2c1=O	918125847	WHTFYOFAZJDKDD-UHFFFAOYSA-N	428.493	1.199	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)[C@H]2CCN(c3ccc(Cl)cc3)C2=O)c2ccccc2c1=O	919692554	PQHZIGCEIJVEKJ-MRXNPFEDSA-N	439.859	1.401	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)NCc2ccc(S(=O)(=O)N(C)C(C)C)cc2)c1	920235372	PSFTXVQJOGRFET-UHFFFAOYSA-N	448.545	1.933	50	20	IDGD	
CCCNC(=O)CNC(=O)/C(C#N)=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	920852514	QKIVAJLLJKAUNM-XNTDXEJSSA-N	442.907	1.628	50	20	IDGD	
C[C@]1(NNC(=O)NCc2ccc(-n3ccc(C(F)(F)F)n3)cc2)CCS(=O)(=O)C1	920920580	NWMQMTVRRYMLTH-INIZCTEOSA-N	431.440	1.772	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(NC(=S)NNC(=O)c2cncn2-c2ccccc2)c1	1317723602	BUGAGMBFLUYKNA-UHFFFAOYSA-N	444.542	1.754	50	20	IDGD	
NC(=O)[C@@H]1CCCN(c2ccc(C(=O)NNC(=O)c3cc(-c4cccs4)[nH]n3)cc2)C1	1324046842	ACNFFUHLNKSGET-CQSZACIVSA-N	438.513	1.915	50	20	IDGD	
CCC[C@H](C)C(=O)NCCNC(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1	1324442745	BLDCVPSSBJYEPB-AWEZNQCLSA-N	427.546	1.516	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)[C@H]1CC12CCS(=O)(=O)CC2	1325808875	XTVMERMAHQIUQX-BXUZGUMPSA-N	445.335	1.579	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4occc4c3)C2)C1	1777944836	CYNSJIMRRYOCGD-QHCPKHFHSA-N	449.467	1.189	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H]1CC(=O)N(C3CCCC3)C1)C2)[C@H](F)Cl	1778021945	FCGCWMVOOZICMV-DJXDEVDJSA-N	443.947	1.826	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)C#CC3(O)CCCCC3)C2)C1	1779067688	XGSCGERIIPPEAC-KXBFYZLASA-N	427.339	1.298	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](COC(C)=O)OC(C)=O)C1	1779404921	NYTYLVJZZFWAIN-AXVVYFOYSA-N	446.928	1.013	50	20	IDGD	
CC(=O)N[C@@H](C(=O)N1CC[C@]2(CN(C(=O)[C@@H](F)Cl)CCO2)C1)c1ccc(F)cc1	1780914846	POZZXJHNLGDKHR-GPMSIDNRSA-N	429.851	1.367	50	20	IDGD	
COc1ccnc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@](C)(Cl)CCl)C3)C2)c1OC	1781232477	UYIKHOWCQCIVKS-RTBURBONSA-N	446.331	1.779	50	20	IDGD	
CCSc1ncccc1C(=O)N1CCO[C@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1	1783932705	AHWYMNYATRMVJP-NRFANRHFSA-N	449.577	1.010	50	20	IDGD	
CSc1ccc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]3C2)cc1	1784095454	ILDDUUWYBBHIRL-DKIMLUQUSA-N	426.966	1.530	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](C)Sc3ccccn3)C2)C1	1784417383	GZQODMJZKLTIRB-ZRGWGRIASA-N	427.954	1.646	50	20	IDGD	
CC(C)(C)OC(=O)CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CO[Si](C)(C)C)C[C@@H]21	1784778857	HBIYTODVJIVRES-JYJNAYRXSA-N	428.602	1.549	50	20	IDGD	
C[C@@H](Cn1cccn1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)CBr)C[C@@H]21	1785435864	CJLZKNYBYFUFFN-WOYTXXSLSA-N	441.370	1.530	50	20	IDGD	
CN(CCCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Cl)CCO2)C(=O)OC(C)(C)C	1785585363	BMVXCSLTXOQWCB-KXBFYZLASA-N	435.924	1.998	50	20	IDGD	
Cc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)CBr)C[C@@H]32)n(C)n1	1786024512	NJALTKWZDWHIMO-DSRCVFDASA-N	427.343	1.353	50	20	IDGD	
CCCCC[C@@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2C1	1786983074	HUQRRWLFFIJBFU-LGYWMIHWSA-N	430.354	1.176	50	20	IDGD	
Cc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Br)C[C@@H]32)cc(O)n1	1787458222	MTUBCAWWRUCAAT-GZCFXPHUSA-N	430.274	1.379	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(C)(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Cl)C[C@@H]32)C1	1788222327	XOWJVIKGPYMQGE-AJNGGQMLSA-N	447.935	1.758	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)c1cnn(Cc2ccccc2)c1	1788926060	SDWGCZHCFRGNJJ-LEAZDLGRSA-N	446.935	1.124	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3CC[C@@H]4CCC(=O)N4C3)[C@H]2C1	1789766936	RJXRLTZNZIMUNL-WKULXVSPSA-N	439.984	1.632	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccnc4c(O)cccc34)[C@H]2C1	1790499177	QIGRBWOZQHUGFU-KUZCPNRJSA-N	447.919	1.788	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3c(C)n[nH]c3C)C[C@@H]21	1790960378	DHSWLIYHOVVNBO-AJNGGQMLSA-N	427.343	1.793	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(-c4ncc[nH]4)cc3)C[C@@H]21	1791256165	GNPXQRUAPOBYSY-OKYOBFRVSA-N	446.935	1.924	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3ON=C(c4ccccc4)O3)C[C@@H]21)C(Cl)Cl	1791298464	ZFRFJHYUXMLTJB-WFTHSTBKSA-N	442.299	1.505	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1	1791567712	FXAJYXOHTJPVPT-SFHVURJKSA-N	430.697	1.368	50	20	IDGD	
COc1c(Cl)cccc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21	1792023951	KPBQFBDJAGBGLX-MZGVZZPPSA-N	431.316	1.542	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C=C/C(=O)NCc1ccccc1	1792938743	ZRMUFOXUQNYZAN-GXZUIMCBSA-N	447.963	1.856	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)c1c[nH]c(-c2ccc(F)cc2)c1	1794435788	HWKDYIFASCTZOR-WTLGNFPFSA-N	435.883	1.624	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc([N+](=O)[O-])cc1F)C2	1795115081	GLBJNVLUFHJVFY-CULMDFNYSA-N	444.257	1.722	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)c1ccc(Cl)cc1F	1796189750	VMWWKQMAGYZRFH-BJWYYQGGSA-N	430.672	1.725	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)c1ccc2cc(O)ccc2n1	1796190940	GNHVBQQSXMRADT-REPLKXPHSA-N	445.284	1.186	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1Cc2ccccc2CN1	1796327182	KUSOKQIMWXHLNK-JTJHWIPRSA-N	431.609	1.142	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnc(C)s1)C2	1796892486	HDSZSQCLNHICFE-LSOZKBPJSA-N	428.518	1.837	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C#CC1(O)CCCCC1	1797785693	WXJOREASKBFWMI-MPTYRVRUSA-N	427.339	1.058	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1cc(F)ccn1)C2	1800757531	PRZVYDACSGFIRM-KOFHJDLBSA-N	428.302	1.526	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c(c1)CCN3C)C2	1800758415	ZAXZTMPEAWLHRI-PTOXDTDZSA-N	436.350	1.666	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc(F)cc1Cl)C2	1800974114	LGIVALSMLLQASU-ZDFLXESQSA-N	433.307	1.865	50	20	IDGD	
C[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(Cl)Cl)[S@](=O)c1ccccc1	1801016540	HRCSNXPNPVFFIZ-ZMHWZDQNSA-N	433.357	1.576	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)n1ccnc1C	1801459161	ZUOFKAKXHZQNQW-GZFHQYITSA-N	427.343	1.516	50	20	IDGD	
CC(C)Oc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](O)CCl)C3)cc1C#N	1801846772	YNFYQPWAEYWRPU-ZMMAXQRCSA-N	435.908	1.148	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccccc1C(=O)OCCO)C2	1802278950	DWASKTNXPKNYQZ-BASYENTBSA-N	438.908	1.341	50	20	IDGD	
CC(=O)N[C@H](C(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]1c1cccnc1)C(C)(C)C	1803136128	OCHZSRAGYAAACZ-BRSBDYLESA-N	438.956	1.238	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc3c[nH]nc3c2)[C@@H]1c1cccnc1)[C@H](O)CCl	1803139709	UFJCQQQMZAIWJV-QXAKKESOSA-N	427.892	1.877	50	20	IDGD	
CC(=O)C(C)(C)C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1803405164	CRFLATARLIBISU-FXAWDEMLSA-N	431.537	1.076	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)CS(=O)(=O)CC)[C@H]1c1cccnc1	1803510081	PPFILHMYWVJVAE-XYJFISCASA-N	429.970	1.930	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)/C=C/c2ccoc2)[C@H]1c1cccnc1	1804320331	SMWZVNQSCNNVKO-ROZBWVADSA-N	439.516	1.767	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)C[C@@H]2NC(=O)NC2=O)[C@H]1c1cccnc1	1804341647	LBDSDXCYOPJJPT-WBTNSWJXSA-N	435.912	1.093	50	20	IDGD	
C=CCC(F)(F)C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1807367165	QYMJJHFEASIANM-PKOBYXMFSA-N	443.259	1.292	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2cnncc2C(=O)O)[C@@H]1c1cccnc1	1808264437	YCTHZXJKRJKEOM-XOKHGSTOSA-N	431.880	1.907	50	20	IDGD	
CC(=O)N[C@H](C)C(=O)N1CC[C@H](CNC(=O)[C@](C)(Cl)CCl)[C@@H]1c1cccnc1	1808317994	PUQGJTBUMXWIEQ-ZSKVKKPNSA-N	429.348	1.848	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC2(CCCN(C(=O)c3cocn3)C2)CC1	1808746443	IGDSGSNFAOXBLM-BUVRLJJBSA-N	426.477	1.653	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)c1cc2cccnc2[nH]1	1809895322	FTVQPOPHDNGZAV-SZMVWBNQSA-N	427.892	1.877	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2ccc(F)nc2)[C@H]1c1cccnc1	1810700900	IYJDBKOOQRDOBY-IIBYNOLFSA-N	442.495	1.308	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H](CNC(=O)[C@@H]2CNC(=O)C2)[C@H]1c1cccnc1	1812635453	IVAMSUKIIWYFFF-JJAZEVLHSA-N	437.338	1.255	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)n2ccccc2=O)[C@H]1c1cccnc1	1813031457	OCCKEZFKSWWGME-HYJFEMIMSA-N	446.935	1.764	50	20	IDGD	
Cc1ncccc1C(=O)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1	1815354955	JCGHEWACOMNRNN-HNNXBMFYSA-N	436.302	1.066	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1cnoc1C1CC1	1816655657	IVXWGXBVKLYANG-SFHVURJKSA-N	449.276	1.575	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1	1816728259	CWHNQJKXDNKUHV-APPZFPTMSA-N	441.307	1.959	50	20	IDGD	
CC(C)(CCl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(O)nc(O)n3)sc2C1	1817098964	MTJOUBUCCAZJDH-MRVPVSSYSA-N	425.898	1.835	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@@H](O)c2ccccc2)[nH]n1)c1ccc(B(O)O)cc1	1817471025	COAKBBRUJJUGNE-CTNGQTDRSA-N	448.288	1.129	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1)c1cccn(C(F)F)c1=O	1819636792	SNPZNFJQJZVOHJ-STQMWFEESA-N	443.838	1.872	50	20	IDGD	
C[Si](C)(C)OCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)Cn1ccncc1=O)CC2	1820169753	XNJFPRQICUSIPI-LBPRGKRZSA-N	435.582	1.164	50	20	IDGD	
C[C@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1)n1cccn1	1822802409	GNHFCDDCKSGXTH-ZBFHGGJFSA-N	430.513	1.233	50	20	IDGD	
CC[S@](=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1	1823006363	AATFINAULWGKHY-RSOXTKTDSA-N	440.360	1.904	50	20	IDGD	
CCC[C@H](NC(C)=O)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](Cl)COC)[nH]n1	1823441896	CHWIJPUIVQPIFL-YCPHGPKFSA-N	427.933	1.960	50	20	IDGD	
C[C@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](C)n3ccnn3)sc2C1	1824692154	BIGXMBWKQIDNBX-AEJSXWLSSA-N	427.328	1.691	50	20	IDGD	
C=CCC(F)(F)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2	1825250436	MMXQQIRIGYRNTR-ZDUSSCGKSA-N	435.261	1.260	50	20	IDGD	
CCOC(=O)C(C)(C)C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](Cl)COC)sc2C1	1826009346	RZVHPAVVMVSCJQ-QWRGUYRKSA-N	431.942	1.898	50	20	IDGD	
Cc1cc(C)nc(C(=O)N[C@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)c1	1826085437	UAOINTVOIOXGQP-AWEZNQCLSA-N	444.561	1.754	50	20	IDGD	
O=C([C@H](O)CCl)N1CCC([C@H]2CCCCN2C(=O)c2ccc3c(n2)OCCO3)CC1	1827531920	STBALJNLQDBGJQ-IAGOWNOFSA-N	437.924	1.686	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(F)c[nH]2)CC1	1828925618	NDFSKQCPMUHENU-LJQANCHMSA-N	442.495	1.699	50	20	IDGD	
CCOc1ncccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](Cl)CC)C2)C1	1829542476	ZKRMPHUBFODQBL-JXFKEZNVSA-N	425.913	1.568	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc4[nH]ncc4c3)C2)C1	1830362202	NZSJRNVZKZSULO-HXUWFJFHSA-N	435.912	1.293	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830366294	OJOWLLXUMLYUPC-HXUWFJFHSA-N	447.960	1.233	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C1(c3ccc(O)cc3)CC1)CCO2	1830811751	XFZVBTGBJJXHCT-NQIIRXRSSA-N	436.936	1.898	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(CC)nn3C)C2)C1	1831651524	QKENUUWSSVIUQL-UZLBHIALSA-N	426.945	1.460	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccnc(OC)c3)C2)C1	1831652076	WAEJAFAIHLZFSV-UZLBHIALSA-N	425.913	1.568	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3(Br)CC3)C2)C1	1831654054	PSTJSIWHIHQPFR-BBRMVZONSA-N	437.762	1.778	50	20	IDGD	
O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)c1ncc(F)cc1F)CCO2	1831960333	SSWRNMWLHKJCGQ-KRWDZBQOSA-N	448.264	1.215	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cc4n(n3)CCCC4)CC2)CC1)[C@H](O)CCl	1833310273	OQYIEOFTBWIYLM-LJQANCHMSA-N	437.972	1.004	50	20	IDGD	
CCOc1ccccc1C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)CCl)CC2)CC1	1833313757	PTUNQXMUYXVUJP-LJQANCHMSA-N	437.968	1.870	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)CNC(=O)c3cccnc3)CC2)CC1	1833771658	JCWKOPHTONYJSO-IBGZPJMESA-N	449.983	1.400	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3conc3C)CCO2)C1	1834340168	JJMNEADSEVDZOL-RHSMWYFYSA-N	430.299	1.227	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cncs3)CCO2)C1	1834470220	DLEIGODEEIXAOW-MLGOLLRUSA-N	432.340	1.387	50	20	IDGD	
Cc1nc2ncccn2c1C(=O)N1CCC(N2CCC(NC(=O)[C@@H](F)Cl)CC2)CC1	1835080830	XUWBFERSFNLYNV-QGZVFWFLSA-N	436.919	1.757	50	20	IDGD	
C[C@H](C(=O)N1CCC(N2CCC(NC(=O)CO[Si](C)(C)C)CC2)CC1)C1(O)CCC1	1835835208	USRAQEMJQLKNDF-QGZVFWFLSA-N	439.673	1.961	50	20	IDGD	
O=C(CCc1c[nH]c2ccccc12)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1	1836104863	WQJUMABYFXTBBB-DENIHFKCSA-N	449.935	1.157	50	20	IDGD	
O=C(Cc1ccc2c(c1)CCCO2)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1836680087	QHDAWAYLZYBMPV-PZJWPPBQSA-N	440.899	1.545	50	20	IDGD	
Cc1cc2nc(C(=O)N3CCO[C@]4(COCCN(C(=O)[C@@H](F)Cl)C4)C3)[nH]c2cc1C	1837345930	QQKJCLHEESSTQM-UZLBHIALSA-N	438.887	1.784	50	20	IDGD	
COC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)[C@@H](C)Br)CC2)CC1	1837663755	XBQZNKNUWVTNDT-CYBMUJFWSA-N	433.343	1.722	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)C[C@@H]3CCCCO3)C2)C1	1837709932	BBRSAMGPPIULQA-PXNSSMCTSA-N	428.602	1.254	50	20	IDGD	
C[C@H](C(=O)N1CCC(OC2CCN(C(=O)[C@@H](F)Cl)CC2)CC1)[C@@H]1SC(=N)NC1=O	1838083511	UPALSBYHBUCGAF-LEWSCRJBSA-N	448.948	1.322	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccccc3NC(C)=O)C2)C1	1839148994	PPFSVTXBRYHRPJ-UTKZUKDTSA-N	437.924	1.732	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)ccn1	1839201133	WULCHWZBLFWILD-YOEHRIQHSA-N	430.274	1.151	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(C)cc(C#N)c3)CCO2)C1	1839454194	ZSGHNBBNUNMQBL-RXVVDRJESA-N	435.908	1.191	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3[C@H]4SC=C[C@H]43)C2)C1	1840035018	DFKDVFPWJAOYQX-JEJJNBGPSA-N	431.352	1.101	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(C)cc3Cl)C2)C1	1840155962	GNQMEULQEOGSCP-FXAWDEMLSA-N	445.343	1.972	50	20	IDGD	
O=C(c1ccc2cnccc2n1)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840187519	GRMNTDAUDXSUBE-IBGZPJMESA-N	439.299	1.504	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)/C=C/c3cnc(C)s3)CCO2)C1	1840520274	XELFNZBQFRUHKZ-QDYBUIJZSA-N	427.954	1.939	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)c(O)c1	1840670718	RYFCTAUPUDBXQD-CRAIPNDOSA-N	445.285	1.461	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1ccc3n[nH]cc3c1)C2	1843415850	UMCDMBBVWVMTGB-AFUMVMLFSA-N	433.472	1.514	50	20	IDGD	
O=C(OCc1ccccc1)N1CC(C(=O)N2CCCC23CN(C(=O)[C@@H](O)CCl)C3)C1	1845947751	WIBXSUPQXKBRRU-KRWDZBQOSA-N	435.908	1.058	50	20	IDGD	
CC(=O)N[C@@H](C)C(=O)N1CCCC12CN(C(=O)[C@H](Br)Cc1ccccc1)C2	1846006261	LKRRZCMEKFENJW-WMLDXEAASA-N	436.350	1.721	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC12CN(C(=O)c1cc(=O)nc3sccn13)C2	1846177906	SAHFTIAISKREKW-SNVBAGLBSA-N	425.308	1.356	50	20	IDGD	
O=C(c1cn2ccc(Br)cc2n1)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl	1847559596	PLIAUYQRCXTTJQ-IHRRRGAJSA-N	441.713	1.512	50	20	IDGD	
O=C(CSc1ccc(F)cc1F)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cccc(B(O)O)c1	1847768878	KOJZDRCJNCTQIM-ROUUACIJSA-N	446.284	1.252	50	20	IDGD	
COc1ccc(CC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2ccc(B(O)O)cc2)c(Cl)c1	1848086601	RSKVBHWRRYFXSD-PMACEKPBSA-N	442.708	1.087	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)CC[C@@H]1Cc2ccccc2NC1=O	14324739	HLLBPEILSNVVQD-OAHLLOKOSA-N	443.529	1.640	50	20	IDGD	
O=C(CCCOc1ccccc1)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	21894510	QWSBIFKJLINAGR-UHFFFAOYSA-N	447.513	1.328	50	20	IDGD	
O=C(NNC(=O)c1cc2c(s1)CCCCCC2)C1=CC=CN2CCS(=O)(=O)N=C12	45748854	XRBUMWCTHYTZRA-UHFFFAOYSA-N	434.543	1.666	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)c2cc(S(=O)(=O)N3CCSCC3)c[nH]2)c2ccccc21	109205324	WEGQLOXVTVWUTG-UHFFFAOYSA-N	447.542	1.319	50	20	IDGD	
O=C(NCc1cccc(C(F)(F)F)c1)NNC(=O)[C@@H]1CC[C@@H](C(F)(F)F)NC1=O	195718465	LWVYBUBEYQZMAT-MNOVXSKESA-N	426.317	1.993	50	20	IDGD	
C[C@H]1CCC[C@H](C)N1C(=O)COc1ccc(C(=O)NNC(=O)CN2CCCC2=O)cc1	726088251	VZZHWSXRHAXRPM-HOTGVXAUSA-N	430.505	1.238	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)NCc1ccc(-n2cnc3ccccc32)cc1	726249749	KKGQGRDASUHIDD-UHFFFAOYSA-N	432.440	1.879	50	20	IDGD	
COc1ccc(-c2nn(CCC#N)cc2/C=C(\C#N)C(=O)N[C@H]2CC(=O)N(C)C2)cc1OC	726537037	IVPGYNUJMOWQJY-WBNHJWIASA-N	448.483	1.735	50	20	IDGD	
COCCNC(=O)CN1CCN(C(=O)/C(C#N)=C\c2cc(C)n(CC(C)C)c2C)CC1	728199501	VQMSPBZGYSEKOC-BKUYFWCQSA-N	429.565	1.575	50	20	IDGD	
COc1cccc(/C=C(/C(=O)NNC(=O)Cn2ccc3ccccc32)n2nnnc2C)c1	729451427	URDGEGVMOGYNAN-MOSHPQCFSA-N	431.456	1.791	50	20	IDGD	
O=C(NNC(=O)[C@@H]1C[C@@H](O)CN1C(=O)OCc1ccccc1)c1cccc(OC(F)F)c1	729533519	MZWJMWIQSLPXQR-WBVHZDCISA-N	449.410	1.821	50	20	IDGD	
COc1cc(Cl)c(S(=O)(=O)NNC(=O)CNC(=O)c2cccs2)cc1Cl	729836622	RTSZTFFVXUQBOU-UHFFFAOYSA-N	438.314	1.803	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cnc3ccc(C)cn3c2=O)cc1Br	732036081	UPNXHZSUTFFTLP-UHFFFAOYSA-N	431.246	1.849	50	20	IDGD	
O=C(N[C@H]1CCS(=O)(=O)C1)[C@H]1CCCC[C@H]1C(=O)NNc1nc(-c2ccccc2)no1	732111535	AOTZMTGZDHFNQA-HRCADAONSA-N	447.517	1.289	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)C[C@@H](C)O1	732261062	JUZPCMGAOGZSPG-CHWSQXEVSA-N	433.490	1.979	50	20	IDGD	
Cc1nc(CN2CCN(C(=O)CCC(=O)C(C#N)=C3N(C)c4ccccc4N3C)CC2)no1	732767043	SCCVCXCYFHIDAH-UHFFFAOYSA-N	449.515	1.693	50	20	IDGD	
CS(=O)(=O)Nc1cc2ccccc2cc1C(=O)NNC(=O)[C@@H]1COc2ccccc2O1	732923309	VGMSEJIAQKUTCZ-IBGZPJMESA-N	441.465	1.812	50	20	IDGD	
CCOCCCn1c(NNC(=O)CNC(=O)c2ccc(C#N)cc2)nc2ccccc2c1=O	733365449	LFSDNYZILQQZCE-UHFFFAOYSA-N	448.483	1.568	50	20	IDGD	
O=C(CNC(=O)c1ccc(Br)cc1)NNC(=O)c1cnn(-c2ccccc2)c1	733370578	JIBNBJFCWIBPGG-UHFFFAOYSA-N	442.273	1.826	50	20	IDGD	
Cc1nn(C)c(C)c1C(=NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)C(F)(F)F	733907991	YRPFCVRIZXMZTG-UHFFFAOYSA-N	431.440	1.984	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)CCc1nc(-c2nc[nH]n2)no1	734251856	PVTDUMAMNDOCSN-UHFFFAOYSA-N	434.482	1.007	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNS(=O)(=O)c1ccc2c(c1)C(=O)NCC2	734807243	WNYHUAANYCUZDE-AWEZNQCLSA-N	439.493	1.903	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])c2ccccc2c1=O	735028186	IWIHNBFDJNHSLD-UHFFFAOYSA-N	445.819	1.725	50	20	IDGD	
CC(=NNC(=O)COCc1ccccc1)c1ccc(S(=O)(=O)N2CCNCC2)cc1	737433540	HALGNRCIUYBWFL-UHFFFAOYSA-N	430.530	1.338	50	20	IDGD	
COCCS(=O)(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccc(C)cc2C)c1	737750354	DHISTUOZHCSMQT-UHFFFAOYSA-N	441.531	1.315	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)NCCCOC[C@H]1CCOC1	740921221	YDPNHDMJVCHKTL-CYBMUJFWSA-N	430.299	1.602	50	20	IDGD	
COc1ccc(-c2n[nH]c(CNC(=O)NNC(=O)c3cc(OC)cc(OC)c3)n2)cc1	741416635	SFWCFHLTOIJONR-UHFFFAOYSA-N	426.433	1.642	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)c3ccc(C[C@H]4CC(=O)NC4=O)cc3)n[nH]2)cc1	743309654	PFFOTXVGFICAPQ-KRWDZBQOSA-N	431.452	1.665	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)N[C@@H]1CC(=O)N([C@@H]2C[C@@H]2c2ccccc2)C1	743700376	BDDPTFXUQGMGJV-VIPLHTEESA-N	436.468	1.314	50	20	IDGD	
O=C(NNS(=O)(=O)c1cccc(-n2cnnn2)c1)c1ccc(F)cc1Br	743730025	WUHSFVMZUDNZRP-UHFFFAOYSA-N	441.242	1.187	50	20	IDGD	
CN(C)C(=O)c1cccc(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)c1	744620562	KRLLLBKKQSHUPV-UHFFFAOYSA-N	432.502	1.166	50	20	IDGD	
O=C(NNC(=O)N1CCOCC1)c1ccccc1NS(=O)(=O)c1cccc([N+](=O)[O-])c1	745991999	QDPVJEPOESUNLH-UHFFFAOYSA-N	449.445	1.082	50	20	IDGD	
O=C(CCOc1ccccc1)NNC(=O)[C@H]1CS[C@@H](Cc2ccccc2F)C(=O)N1	747179218	AWGVQACQHVGCPF-MSOLQXFVSA-N	431.489	1.585	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cccn2C)cc1S(=O)(=O)N1CCCCCC1	747599160	OVSYMUPXCMYAGX-UHFFFAOYSA-N	434.518	1.673	50	20	IDGD	
NS(=O)(=O)c1ccc(C(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)s1	748520880	WXGWPTLBJZDNEF-UHFFFAOYSA-N	429.423	1.446	50	20	IDGD	
C[C@H](C(=O)N(C)CC(=O)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1)n1cccn1	748522767	FUSIHYPLTATOEF-LLVKDONJSA-N	433.412	1.339	50	20	IDGD	
COc1cc(OC)cc(N2CC[C@H](NC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)C2)c1	748661647	MNKRBUMZEXHAEY-AWEZNQCLSA-N	429.433	1.835	50	20	IDGD	
O=C(CCN1CCN(c2ccccn2)CC1)NNc1c(F)cc(C(=O)NC2CC2)cc1F	748829719	ULETXIYLFDBNIH-UHFFFAOYSA-N	444.486	1.907	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(\C#N)C(=O)N2CCC(O)(CN3CCOCC3)CC2)c1C	752740556	OLUBVDPCUHCALV-KWJZBXMYSA-N	444.576	1.905	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)NCCCC#N)c2)cc1	753265514	ZRMZXXPKZUGSPZ-UHFFFAOYSA-N	431.474	1.744	50	20	IDGD	
CCCC[C@@H](NC(=O)[C@H](C)NC(=O)C(C)(C)C)C(=O)NNC(=O)c1ccc2c(c1)OCO2	755038025	IPWILCRBWUMJGQ-DZGCQCFKSA-N	448.520	1.402	50	20	IDGD	
CCc1c(C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cnn1CC(C)C	755398752	NXKISNQONWEAGL-UHFFFAOYSA-N	435.550	1.492	50	20	IDGD	
CCCCNS(=O)(=O)c1cccc(NC(=O)NNC(=O)COc2ccccc2C#N)c1	755537883	ZMSADFAWEHBJSN-UHFFFAOYSA-N	445.501	1.868	50	20	IDGD	
O=C(NN=Cc1cc(O)cc(Br)c1O)c1csc(N2CCOCC2)n1	755562091	GAHRORLRMGSCBW-UHFFFAOYSA-N	427.280	1.917	50	20	IDGD	
COc1ccc(C(=O)N2CCOCC2)cc1NC(=O)NNC(=O)c1ccc(Cl)cc1O	756259712	ZNYDZNRTMCZHHP-UHFFFAOYSA-N	448.863	1.993	50	20	IDGD	
O=C(CN(Cc1ccccc1O)C[C@H]1CCCO1)NNC(=O)c1cccc([N+](=O)[O-])c1	756337958	ZUWTWMKARZMIAR-GOSISDBHSA-N	428.445	1.743	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)Nc2ccccc2SCCC(N)=O)c2ccccc2c1=O	756360030	FKAALIXDIVJBMR-UHFFFAOYSA-N	440.485	1.368	50	20	IDGD	
CCCNS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2ccc(OC)c(OC)c2)cc1	756775852	LVCRLSRDOIAROA-UHFFFAOYSA-N	436.490	1.859	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)Nc1cc(C2CC2)nn1[C@H]1CCS(=O)(=O)C1	756856545	RZZJNMWQJGOLDY-AWEZNQCLSA-N	435.481	1.655	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)Cc2ccn(-c3ccccc3)n2)ccc1Cl	756899743	OBGDQVQLTUWSFT-UHFFFAOYSA-N	433.877	1.177	50	20	IDGD	
C[C@@H]1C[C@H](NC(=O)NNC(=O)c2csc(N3CCOCC3)n2)CN1Cc1ccccc1	757722127	JPHADHFSPGWWLD-WBVHZDCISA-N	444.561	1.587	50	20	IDGD	
Cc1nn([C@H]2CCS(=O)(=O)C2)c(C)c1NC(=O)NNC(=O)c1c(C)nc2ccccn12	757870848	AUCJUIDRYGDIBT-AWEZNQCLSA-N	445.505	1.282	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCCOc2cccc(C(F)(F)F)n2)c1	758950015	XRPHTYNFEBQDEU-UHFFFAOYSA-N	446.407	1.527	50	20	IDGD	
C[C@@H](CCS(C)(=O)=O)NC(=O)NNC(=O)[C@H](C)Oc1cccc(Br)c1	761995509	ZEKRMUUJAHXCIL-QWRGUYRKSA-N	436.328	1.370	50	20	IDGD	
CCC(=O)N1CC[C@H](NC(=O)NNC(=O)[C@@H](C)Oc2cccc(Br)c2)C1	762081718	HZRLIWPIZXTDEU-YPMHNXCESA-N	427.299	1.558	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)cc1[N+](=O)[O-]	763541743	AVOKEPXCRIEXIY-UHFFFAOYSA-N	448.388	1.029	50	20	IDGD	
Cc1ccc(Br)c(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1	763574014	WVOJUVFOQKAQSR-HNNXBMFYSA-N	434.246	1.683	50	20	IDGD	
COc1cccc(Cn2nccc2NC(=O)C(=O)NNC(=O)c2cc(C)oc2C)c1OC	763587058	SVSINGKTAOYVFD-UHFFFAOYSA-N	441.444	1.558	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)c2cccc(N(C)C)c2)sc2c1CCC2	763759848	DNGRGZQVMQRWPK-UHFFFAOYSA-N	444.513	1.879	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccccc2S(C)(=O)=O)c1C	763841258	PNDRBUZHHRWLOX-AWEZNQCLSA-N	433.486	1.260	50	20	IDGD	
Cc1nnc(-c2ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc3ccccc3F)cc2)o1	763855908	CEPGIQZYJSVXBX-LLVKDONJSA-N	427.392	1.738	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)c(OCCN(C)C)c1	763870748	CDQKNNYPSKCXDE-HNNXBMFYSA-N	446.479	1.628	50	20	IDGD	
CC(=O)NCc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(C(C)=O)cc2)cc1	763877578	LOWORRXIASXOKM-CQSZACIVSA-N	440.456	1.079	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3ccn(Cc4ccccn4)n3)cc2C1	763941970	ZSIGLBPSEJFQAC-ZDUSSCGKSA-N	438.513	1.912	50	20	IDGD	
CN(C)c1ncncc1NC(=O)C(=O)NNC(=O)c1ccc(-c2ccc(F)cc2)s1	763975375	GPWRDPPQOBHWLS-UHFFFAOYSA-N	428.449	1.810	50	20	IDGD	
COc1cccc(COc2cccc(NC(=O)C(=O)NNC(=O)c3cnccn3)c2C)c1	764031857	NQTBBKMBWIVWBE-UHFFFAOYSA-N	435.440	1.772	50	20	IDGD	
O=C(NNC(=O)c1cccc(Br)c1)C(=O)Nc1ccc2c(c1)C(=O)NCC2	764063600	UMMPEDMVWICVFJ-UHFFFAOYSA-N	431.246	1.135	50	20	IDGD	
CCOC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(C)cc3)[nH]n2)cc1	764110143	FTHYWEFSTQCCJL-UHFFFAOYSA-N	435.440	1.962	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccccc2N2C[C@@H](C)O[C@H](C)C2)c(O)c1	764110589	RBYVPCRDRKMARE-HUUCEWRRSA-N	426.473	1.714	50	20	IDGD	
CCN(CC)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)CCc2ccc(OC)cc2)cc1	764128096	ZEVFLUUJYAYEFK-UHFFFAOYSA-N	440.500	1.896	50	20	IDGD	
O=C(NNC(=O)c1cc(F)ccc1Br)C(=O)Nc1cnn(-c2ccccc2)n1	764276763	FPTIEGJMPVOIBD-UHFFFAOYSA-N	447.224	1.569	50	20	IDGD	
CNS(=O)(=O)c1cc(NC(=O)C(=O)NNC(=O)CCCc2cccs2)ccc1C	764335897	VRIPAGOMTOFJOK-UHFFFAOYSA-N	438.531	1.073	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)C(=O)Nc1cccc(C(=O)N2CCc3ccccc32)c1	764354504	USRKPIRVWIYSPN-UHFFFAOYSA-N	443.463	1.613	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(S(=O)(=O)N3CCCCCC3)cc2)o1	764372044	VHAGKLOTKCBLDV-UHFFFAOYSA-N	448.501	1.552	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCN([C@H](C)c3ccsc3)CC2)cc1OC	765074238	CQXAWNRFWPSQLV-OAHLLOKOSA-N	432.546	1.905	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ccc(C)nn2)c(I)c1	765707552	JKHAOMLUASUOPO-UHFFFAOYSA-N	427.202	1.480	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(\C#N)C(=O)N2CCN(C(=O)[C@H]3CCCN3C)CC2)c1C	766332312	AZQPYHDVHGCAEI-ZNRPDEDHSA-N	441.576	1.984	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@H]3Cc4cc(F)ccc4O3)CC2)cc1	766646644	ULGJUIWIERIIID-OAQYLSRUSA-N	426.492	1.403	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@@H]3CCN(C4CCCCC4)C3)CC2)cc1	766651018	YSASKKZCQIEOQP-JOCHJYFZSA-N	441.620	1.915	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)CN(C)CC(=O)Nc1ccc(Br)cn1	766877160	ADHBMHMFYAPXHB-UHFFFAOYSA-N	448.321	1.413	50	20	IDGD	
COC(=O)c1ccc(C(C)=NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1	767743160	GLVSGWUHNHJTDF-UHFFFAOYSA-N	445.497	1.648	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)[C@@H](C)NS(=O)(=O)c2ccc(C#N)cc2)cc1	767889322	LLIOCCSXYXHEBZ-CQSZACIVSA-N	430.486	1.014	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1ccc(F)cc1C(=O)N(C)C	768239294	JAWXAEOUKBZEOF-UHFFFAOYSA-N	436.827	1.589	50	20	IDGD	
CCCCS(=O)(=O)N1CCC(C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)CC1	768260775	NWEHAYCZVCAHJY-UHFFFAOYSA-N	439.563	1.741	50	20	IDGD	
COc1ccc(OC)c(-n2nnnc2SCC(=O)NNC(=O)Cc2ccccc2C)c1	768354996	HOVBMHLYMBPRBD-UHFFFAOYSA-N	442.501	1.470	50	20	IDGD	
CN1C(=O)C[C@H](NC(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)[C@@H]1c1ccc(Cl)cc1	768985795	DHRROPAITBCRMD-YOEHRIQHSA-N	447.835	1.870	50	20	IDGD	
COc1ccc(NNC(=O)c2cc(NC(C)=O)ccc2NS(C)(=O)=O)c([N+](=O)[O-])c1	769307690	PZVNDGMZJYRQGB-UHFFFAOYSA-N	437.434	1.690	50	20	IDGD	
CSCCNC(=S)NNC(=O)Cc1ccc(NS(=O)(=O)c2cccs2)cc1	769767720	UCUHDKNAPHJMJI-UHFFFAOYSA-N	444.629	1.950	50	20	IDGD	
COCC(=O)Nc1cccc(CNC(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)c1	770341927	PAFIMEWWFITXQZ-UHFFFAOYSA-N	442.480	1.698	50	20	IDGD	
COc1ccc(NC(=O)CSCC(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1	770392070	RJTKGDSRMWXACO-UHFFFAOYSA-N	431.470	1.599	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCCCC(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1C	770428135	UMTOQGGZELEZQN-UHFFFAOYSA-N	447.513	1.594	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)c3cccc([C@]4(C)NC(=O)NC4=O)c3)nc21	770964867	FZUQMAKMXZOXOQ-FQEVSTJZSA-N	438.448	1.098	50	20	IDGD	
CCCS(=O)(=O)N1CCCC[C@@H]1C(=O)NNc1nc(O)c2cnn(C(C)(C)C)c2n1	770965638	LSVZPGWPUWXJOC-CYBMUJFWSA-N	439.542	1.324	50	20	IDGD	
COc1ccc([C@H](OC)[C@H](C)NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1	771906779	XLBQTHMAPOCNQT-SCLBCKFNSA-N	425.449	1.391	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)c1ccccc1	771914367	QFYTWJBWYJZEGJ-QGZVFWFLSA-N	445.541	1.591	50	20	IDGD	
C[C@@H](NCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)c1cccc(N2CCCC2=O)c1	775278029	GSMZCRMBFWZFPG-CQSZACIVSA-N	425.445	1.833	50	20	IDGD	
CCOC(=O)c1c(NC(=O)NNC(=O)c2ccc3c(c2)OCO3)c(C#N)cn1CCOC	775765983	RKWFKJMWUHJOCK-UHFFFAOYSA-N	443.416	1.378	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)C1CCN(C(=O)OCc2ccccc2)CC1	778435917	BEMZJQQWKQXZSL-UHFFFAOYSA-N	434.493	1.707	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2cnn([C@H](C)C3CC3)c2)n[nH]1	778712725	HCVVOMNTIYBLDJ-GFCCVEGCSA-N	437.460	1.653	50	20	IDGD	
COc1cccc([C@@H]2[C@@H](NC(=O)NNC(=O)C(=O)Nc3ccccn3)CCN2C2CC2)c1	779400385	NOZUNAIQNJQYGU-PKOBYXMFSA-N	438.488	1.337	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)[C@H]2CC(=O)N(c3ccc(F)c(C)c3)C2)cc1	780180173	GJDLIXCRLRIBFW-INIZCTEOSA-N	427.432	1.800	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@]2(C[C@H]2C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)C1	781285903	NUCKSPINOXMMLX-KSFYIVLOSA-N	442.472	1.510	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1csc(N2CCOCC2)n1)[C@@H]1CCCN(C2CCC2)C1	781399809	HSGRREQWNCGQBX-HUUCEWRRSA-N	436.582	1.577	50	20	IDGD	
COC(=O)N(C)c1ccc(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)cc1	782885769	IEPSQYPBBKGMBW-UHFFFAOYSA-N	438.444	1.105	50	20	IDGD	
CS(=O)(=O)c1cccc(Oc2ccc(NC(=O)C(=O)NN=c3cc[nH]cc3)cc2)c1	783369724	BWTOVLNYQJHAQM-UHFFFAOYSA-N	426.454	1.781	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)CCS(=O)(=O)C1	783427174	MHWOGMXLJIICCQ-FQEVSTJZSA-N	445.501	1.467	50	20	IDGD	
COc1cccc(NNC(=O)C(=O)Nc2cccc(CN(C)C(=O)C(F)(F)F)c2)n1	784843306	LTJPJZHMRMZHOI-UHFFFAOYSA-N	425.367	1.693	50	20	IDGD	
O=C(NNc1cccnn1)C(=O)Nc1cc(Br)cnc1OCC(F)(F)F	784858436	MKZVRTTXEZDDFA-UHFFFAOYSA-N	435.160	1.657	50	20	IDGD	
CCNS(=O)(=O)c1ccc2c(c1)N(C(=O)C(=O)NNc1cc(F)c(F)cc1F)CC2	784891889	JXOHFXFWZKJDMS-UHFFFAOYSA-N	442.419	1.435	50	20	IDGD	
CS(=O)(=O)CCc1ccc(NC(=O)C(=O)NNc2cccc(C(F)(F)F)n2)cc1	784951821	VLRSCBGUXPVKEG-UHFFFAOYSA-N	430.408	1.769	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCC(=O)c2ccccc21)c1cccc(S(=O)(=O)N2CCCC2)c1	785669297	AYCJTKVWGVTIPB-IBGZPJMESA-N	441.509	1.992	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)[C@H]2CCCN2C(=O)C(F)(F)F)cc1C	786574219	AMQFQUUMROEVNJ-SNVBAGLBSA-N	435.424	1.476	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(N2CCNC2=O)ccc1C	787542051	ZBRCQRQCRHVWFQ-UHFFFAOYSA-N	439.472	1.252	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ncnc3ccsc23)cc1C(=O)N1CCOCC1	787554460	BNLLTROEJPOCGS-UHFFFAOYSA-N	440.485	1.554	50	20	IDGD	
CC(C)[C@H](CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)c1ccnn1C	788318724	JLZZIAPSWPTTBD-INIZCTEOSA-N	436.538	1.054	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)c(C)cc1C	788330428	GWPZPPLJOMFAPS-ZDUSSCGKSA-N	431.420	1.783	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)[C@H]1CCC(=O)c2cccn21	788762593	RGDSMEBLAUZSLZ-LJQANCHMSA-N	443.935	1.624	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)[C@@H](CCS(C)(=O)=O)c2ccccc2)c1	789110082	VZWRMWNLVHDQDW-SFHVURJKSA-N	432.498	1.518	50	20	IDGD	
CN(C)[C@@H]1CCOc2c(NC(=O)C(=O)NNC(=O)COc3ccc(F)cc3)cccc21	789740350	FPKUNLRNAFNRGH-QGZVFWFLSA-N	430.436	1.376	50	20	IDGD	
O=C(NNC(=O)N1CCC(C(=O)c2ccc(F)cc2)CC1)c1ccc(-n2cnnn2)cc1	789829405	LOBUUVZFOIKEBY-UHFFFAOYSA-N	437.435	1.751	50	20	IDGD	
CC(=O)c1cc(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)ccc1C	790000712	KDVBUYPNACKNTL-UHFFFAOYSA-N	430.530	1.891	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)Cn2ccc3ccccc3c2=O)c2ccccc2c1=O	790472477	HVYKRWONAQUOJS-UHFFFAOYSA-N	431.452	1.583	50	20	IDGD	
C[C@@](O)(Cn1cc(C(F)(F)F)ccc1=O)C(=O)NNC(=O)c1ccc(Cl)cc1F	792212693	BXPDGSLRWYIFTO-MRXNPFEDSA-N	435.761	1.872	50	20	IDGD	
CCN1CCN(Cc2ccc(NC(=O)C(=O)NNc3ccc4c(=O)[nH]ccc4c3)cc2)CC1	793065073	IHUHUFWLHADJBL-UHFFFAOYSA-N	448.527	1.747	50	20	IDGD	
Cc1ncc(S(=O)(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)cc1C#N	793350207	HXOFGZMZDOLIHV-UHFFFAOYSA-N	426.458	1.176	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN([C@@H]2CCN(CC(=O)NNC(=O)c3cccs3)C2)CC1	796618792	WTHKXHAUIOSXFV-OAHLLOKOSA-N	437.566	1.136	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)CSc2ccc(C)cc2)cc1OC	797000647	ULRWTWOXWIQTQQ-UHFFFAOYSA-N	431.470	1.668	50	20	IDGD	
COC(=O)c1n[nH]c2ccc(NC(=O)NNC(=O)CNC(=O)OCc3ccccc3)cc12	797626504	LDDJJZIZIOVYCP-UHFFFAOYSA-N	440.416	1.429	50	20	IDGD	
Cc1ccc(-n2cnnc2)c(C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)c1	797792936	RQCUAHUGQSGJPV-UHFFFAOYSA-N	431.456	1.941	50	20	IDGD	
Cn1ncc2c1C[C@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)N3CCCCC3)c1)CC2	798823321	KLOFDRWLKXGUIY-MRXNPFEDSA-N	445.545	1.161	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)N[C@@H](Cn1ccccc1=O)c1ccccc1	799856762	FCRJGOGQSVQQKH-IBGZPJMESA-N	444.455	1.210	50	20	IDGD	
CCOc1ccccc1C(=O)N1CCC[C@@H]1C(=O)NNC(=O)C(=O)Nc1ccc(C)cc1	801108242	JOIGHWHQXWEBLF-GOSISDBHSA-N	438.484	1.784	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NCC(=O)NNC(=O)Nc2ccccc2)c1	801988088	KDDQKYGZYNGWIV-UHFFFAOYSA-N	447.517	1.300	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Nc2cc(F)cc(F)c2)cc(Cl)c1OCC(N)=O	802006359	IHFDQLQPWDOBBT-UHFFFAOYSA-N	428.779	1.957	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@H]2CCCC[C@@H]2C(=O)N2CCCC2)cc1	802063863	RIQSZXDLNHGPNE-IRXDYDNUSA-N	436.534	1.672	50	20	IDGD	
COc1ccc(C2=NO[C@@H](CNC(=O)NNC(=O)COc3ccccc3OC)C2)cc1	802358785	DBHHNJHWBSRSOL-MRXNPFEDSA-N	428.445	1.606	50	20	IDGD	
O=C(Cc1ccc(S(=O)(=O)CC(F)(F)F)cc1)NNc1ccc(-n2ccnc2)nn1	804956396	LUOQQVJEVKLKCS-UHFFFAOYSA-N	440.407	1.684	50	20	IDGD	
N#Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1Br	806972726	IZKRTPUCQAFMRM-HNNXBMFYSA-N	445.229	1.247	50	20	IDGD	
COCCNC(=O)c1cccc(NC(=O)C(=O)NNc2ccc(Br)nc2)c1	807011845	IIDRFRADFHMJLF-UHFFFAOYSA-N	436.266	1.302	50	20	IDGD	
COc1cccnc1CC(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	807093985	RTIBJLMZFPIRKM-UHFFFAOYSA-N	431.924	1.251	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)CNS(=O)(=O)c3ccc(C)cc3)n[nH]2)cc1	810147130	FSSVGEUIZZFWJG-UHFFFAOYSA-N	427.486	1.433	50	20	IDGD	
NC(=O)c1ccc(OCC(F)F)c(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2)c1	810385014	JXBYMHLUIHMMET-UHFFFAOYSA-N	440.790	1.483	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)[C@@]2(COC)CCN(C(=O)OC(C)(C)C)C2)nc1C	810933511	YYPHGUXHSGJLSD-FQEVSTJZSA-N	437.497	1.678	50	20	IDGD	
O=C(NNS(=O)(=O)CCCN1C(=O)c2ccccc2C1=O)c1ccc(Cl)cc1F	811688203	VWSYGZKPYKOELK-UHFFFAOYSA-N	439.852	1.730	50	20	IDGD	
COC(=O)c1cc(Br)cc(C(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1	812447731	OWAVSKGEEHJHID-OAHLLOKOSA-N	435.230	1.837	50	20	IDGD	
Cc1sc2ncn(CCC(=O)NNc3ccc(S(=O)(=O)N(C)C)cc3)c(=O)c2c1C	812728607	RJKVNQFUFGXBFQ-UHFFFAOYSA-N	449.558	1.859	50	20	IDGD	
O=C1CN(Cc2cccc(NC(=O)C(=O)NNc3ccccc3Br)c2)CCN1	812983489	TVDUHZGQGRIXOJ-UHFFFAOYSA-N	446.305	1.463	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)c2c(C)nc3ccccn23)cc1)[C@H]1C[C@H]1C	815564376	HJJNHRKRIIZKFK-ACJLOTCBSA-N	448.483	1.804	50	20	IDGD	
CC(C)C(=O)Nc1cccc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)N(C)C)c1	815752340	OBOMRCKCNHTRNV-UHFFFAOYSA-N	447.517	1.613	50	20	IDGD	
COC(=O)c1cccc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)N(C)C)c1C	815752463	TWNDNKLMZIIVPX-UHFFFAOYSA-N	434.474	1.114	50	20	IDGD	
CCOc1ccc(NNC(=O)C(=O)Nc2ccccc2CN2CCN(C(C)=O)CC2)cc1	815816751	LDFBRQXSFPMTPP-UHFFFAOYSA-N	439.516	1.831	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)C(=O)Nc2ccnn2CC2CC2)c1	815866075	NSVKONINTNNNMP-UHFFFAOYSA-N	436.266	1.924	50	20	IDGD	
COC(=O)c1cc(NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)ccc1C	816688403	PHELTIJEHWSPNB-UHFFFAOYSA-N	433.486	1.559	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)c1ccc(CS(=O)(=O)C(F)F)cc1	817052124	VOHYPZUKRYEEAJ-UHFFFAOYSA-N	447.485	1.831	50	20	IDGD	
Cc1nc(CSc2ccc(C(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)cc2)cs1	818028281	BVQIWMLOGGMOCD-CYBMUJFWSA-N	425.557	1.940	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)CSCC(=O)N2CCOCC2)c1	818745647	LONODZYQLRNUEM-UHFFFAOYSA-N	446.323	1.271	50	20	IDGD	
CCS(=O)(=O)N[C@H](CCSC)C(=O)NNC(=O)CSc1ccc(Cl)cc1	818825943	ZWKFCATZXGIYAI-CYBMUJFWSA-N	440.012	1.641	50	20	IDGD	
CCS(=O)(=O)N1CCC(C(=O)NNC(=O)Cc2ccc(F)cc2)(c2ccccc2)CC1	849201944	GRXNOBLGMFJQFV-UHFFFAOYSA-N	447.532	1.899	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)[C@H](CSC)N1C(=O)[C@@H]2CCCC[C@H]2C1=O	864001341	YEOILBVSDCGZNZ-KFWWJZLASA-N	449.529	1.128	50	20	IDGD	
CC(C)[C@@H](NC(=O)NCc1ccccc1)C(=O)NNC(=O)c1ccc2c(c1)OCCO2	900253548	DDWVHASHCWAKDA-LJQANCHMSA-N	426.473	1.743	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)CNC(=O)c2ccc(Br)cc2)cc1	913429622	NRQJKRPFPQAAQU-UHFFFAOYSA-N	435.278	1.447	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)c1csc(N2CCOCC2)n1)N1CCc2ccccc2C1	914533165	CIVLSQARSYQQKJ-HNNXBMFYSA-N	444.561	1.371	50	20	IDGD	
Cc1nn(C)c2[nH]c(=O)c(CCC(=O)NNC(=O)[C@@H](C)Oc3ccc(F)cc3)c(C)c12	914846638	PRWVZYGGRCWLGD-CYBMUJFWSA-N	429.452	1.565	50	20	IDGD	
COc1ccc(S(=O)(=O)N[C@H](C)C(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)cc1	915788041	RIVIGPVIHYJQTA-CVEARBPZSA-N	449.529	1.594	50	20	IDGD	
NS(=O)(=O)c1ccc(CNC(=O)NNC(=O)CCSc2ccc(F)cc2)s1	915906274	WXLPDVHXKLVFJQ-UHFFFAOYSA-N	432.524	1.547	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2ccc(N3CCCC3)nc2)c1	916388711	GMPVMRWOVZAMSY-UHFFFAOYSA-N	446.533	1.076	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)NCc2ccnc(N3CCN(C)CC3)c2)c1	916389962	KBIATEXBPBFAPT-UHFFFAOYSA-N	426.521	1.360	50	20	IDGD	
CCCC[C@@H](/N=C1/NS(=O)(=O)c2ccccc21)C(=O)NNC(=O)c1ccc(Cl)nc1	917253484	NZVAWDCCRKHABM-CQSZACIVSA-N	449.920	1.794	50	20	IDGD	
Cc1cc(C)nc(SCc2ccc(C(=O)NNC(=O)CS(=O)(=O)C(C)C)cc2)n1	917539673	AUZKWSSQSNVBSQ-UHFFFAOYSA-N	436.559	1.970	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@@H](C)CN2CCCC2)c1	918221601	ZHNGQIBFCFFMKL-MRXNPFEDSA-N	439.582	1.393	50	20	IDGD	
CS(=O)(=O)Nc1cc(F)ccc1C(=O)OCC(=O)NNC(=O)c1cccc(Cl)c1	919340653	FIIROWFDZYZXHI-UHFFFAOYSA-N	443.840	1.469	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C1CCN(S(=O)(=O)c2ccccc2F)CC1	919820322	SWIGGUNIRRTTCX-UHFFFAOYSA-N	449.504	1.625	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@H](C)CN2CCC[C@H](C)C2)cc1	919914482	HKYBTNYKMXOEFA-DLBZAZTESA-N	439.582	1.066	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)Nc1ccccc1CN1C(=O)CNC1=O	920933297	SMDZQNGMFSWRFJ-UHFFFAOYSA-N	435.238	1.296	50	20	IDGD	
CN1C(=C(C#N)C(=O)COC(=O)CN2C(=O)[C@H]3CCCC[C@@H]3C2=O)N(C)c2ccccc21	921956060	DDGOCUYUDOPUAM-GJZGRUSLSA-N	436.468	1.595	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)c1cn(-c2ccc(Br)cc2)nn1	1318325668	DHXDNIUOSJJXMI-UHFFFAOYSA-N	432.234	1.575	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)NCCN2C(=O)Cc3ccccc32)CC1	1318920276	NNLZHHFTVQKEBR-UHFFFAOYSA-N	445.520	1.553	50	20	IDGD	
CS(=O)(=O)Cc1ccc(Cl)cc1S(=O)(=O)NNC(=O)c1n[nH]c2c1CCCC2	1319909648	NGKCTPYVJQAVMR-UHFFFAOYSA-N	446.938	1.110	50	20	IDGD	
CCOC(=O)c1ncc(C(=O)NNC(=O)[C@H]2CCCN(C(=O)OC(C)(C)C)C2)s1	1324276392	YCJBZYKMKDRQPS-NSHDSACASA-N	426.495	1.728	50	20	IDGD	
Cc1nc(CSCC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cs1	1337056422	ACBWGUDVCQHJEC-UHFFFAOYSA-N	428.561	1.396	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)NCc2n[nH]cc2Br)CC1	1339359635	JIXPWMREDDKWJP-UHFFFAOYSA-N	445.318	1.650	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccc3c(c2)C(=O)OC3)c1	1346967841	RRHBXDHFRICGPR-UHFFFAOYSA-N	446.485	1.854	50	20	IDGD	
Cn1nc(C(=O)N2CC[C@@]3(CN(C(=O)CCBr)CCO3)C2)c2c1CCC2	1777959509	DZJVTHNWMJBXGF-GOSISDBHSA-N	425.327	1.137	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnc4cc(C)ccn4c3=O)C2)C1	1777999411	ZROZLMDAIDFORU-IERDGZPVSA-N	432.908	1.464	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)cc([N+](=O)[O-])c1)C2)[C@H](F)Cl	1778027922	DULFMQNVGNYQSM-RVKKMQEKSA-N	429.832	1.962	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc3c(c2)OCO3)C1	1778441489	FHDIVMBLWBCVPS-RRMPHLOHSA-N	438.908	1.797	50	20	IDGD	
COc1ccnc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)c1	1779535100	NGMILNKEWSJFAK-SCLBCKFNSA-N	426.311	1.565	50	20	IDGD	
CCc1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)CO[Si](C)(C)C)C3)nn1C	1779910097	XUYBJZNUSXSFAJ-WIYYLYMNSA-N	436.629	1.962	50	20	IDGD	
COc1cc(C(=O)N2CC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)c([N+](=O)[O-])cc1O	1780198379	XLHPRGHVSVRYHS-KRWDZBQOSA-N	448.259	1.556	50	20	IDGD	
CC(C)NC(=O)OC(C)(C)C(=O)N1CC[C@]2(CN(C(=O)CCBr)CCO2)C1	1781020622	ZCQNJCUTNSYVDH-SFHVURJKSA-N	448.358	1.515	50	20	IDGD	
COc1ccc(CC(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](F)Br)C3)C2)cc1	1781328690	WJJZYVWUGNLHLN-WMZOPIPTSA-N	429.286	1.758	50	20	IDGD	
O=C(c1cnn2cccc(F)c12)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781335050	VEWZAWKFHBIFIA-PBHICJAKSA-N	443.248	1.607	50	20	IDGD	
COC(=O)C1(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](F)Br)C3)CC1	1781812254	VNJATBGTHVCBOD-BFQNTYOBSA-N	435.290	1.144	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(C#N)cc3Cl)C2)C1	1781972625	IWIFHFLUEMNLKK-LPHOPBHVSA-N	426.300	1.909	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)Cc2cnn(C)c2)C1	1782590525	PCTHTYOAKSIKJI-DDUZABMNSA-N	427.343	1.260	50	20	IDGD	
COc1cc(Cl)ccc1CC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1782897745	SDVUYDCVEFLBJU-KXBFYZLASA-N	431.316	1.321	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ncc(F)cc3F)CCO2)C1	1783342506	JGYILXGBEQNBHV-SJKOYZFVSA-N	432.265	1.977	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)CN3CCCCC3=O)CCO2)C1	1783354571	CLTGEYZJUHELPO-KSSFIOAISA-N	430.343	1.002	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccn(C(C)(C)C)n3)CCO2)C1	1783531714	BURJPVKHFHQNMP-SCLBCKFNSA-N	427.343	1.865	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](C)Nc1ccccn1)CCO2	1783534335	SOIVLVHSNOXIGV-PMUMKWKESA-N	425.327	1.495	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H]1CC[C@H](C(=O)OC)CC1)CCO2	1783870893	JDIQLQUKPIVJOY-ZKNHNOBHSA-N	430.929	1.050	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(OC)c(OC)c3)CCO2)C1	1783882808	RWIPXOULLFCOGD-YWZLYKJASA-N	426.897	1.401	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)C(C)(C)Oc1ccc(C)cn1)CCO2	1783883739	YFOXDJAFPXZPRT-KKSFZXQISA-N	439.940	1.631	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccccc3OC(F)F)C[C@@H]21)[C@@H](O)CCl	1784095386	DPRLWCCTRQQDLG-PCBIJLKTSA-N	432.851	1.481	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3nc[nH]c3[N+](=O)[O-])[C@H]2C1	1787478128	UDCFRLMBCPUUBU-YPIXOSSWSA-N	434.280	1.148	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1ccc(C2(NC(=O)c3nc[nH]n3)CCC2)cc1	1788648200	UMNUDJHJEHTWNY-UVHMKAGCSA-N	434.460	1.686	50	20	IDGD	
C[C@H](Nc1cnccn1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]2C1	1789870778	VOAVUEFOJSEQTD-OSBUWBMXSA-N	444.363	1.493	50	20	IDGD	
NC(=O)c1ccccc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]2C1	1789923413	LRANZSQGCJARRT-HJPIBITLSA-N	442.285	1.069	50	20	IDGD	
COC[C@H](NC(C)=O)C(=O)NC1(c2ccc(NC(=O)[C@H](F)Br)cc2)CCC1	1790535796	FULFYTFMIQPBIA-GJZGRUSLSA-N	444.301	1.962	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cncc(O)c3)C[C@@H]21	1790963466	CBEXPZWFRHJEIV-DDWPSWQVSA-N	426.311	1.554	50	20	IDGD	
O=C(CCCn1ccnc1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21	1791567236	FULHKRMPKUCYJR-YXWQFLTLSA-N	431.306	1.334	50	20	IDGD	
Cc1nccn1CC(=O)NC1(c2ccc(NC(=O)CCC(=O)NN(C)C)cc2)CCC1	1791602540	LQEJQWMLMCCJMS-UHFFFAOYSA-N	426.521	1.699	50	20	IDGD	
Cc1cc2nnc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)C(C)(C)CCl)c(C)n2n1	1792782094	RGXFBLXHVIOUQS-XOIINTDNSA-N	434.928	1.209	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/c1ccccc1N)C2	1792867856	NCSOTNCWXCQVRI-QNSTWFABSA-N	436.350	1.903	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)[C@@H]1COc2ccccc2O1	1793842473	LXUYWUMKXYZFDE-WZLNRYEVSA-N	443.269	1.107	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CCc3ccoc3C1)C2	1795113335	YQMBUPASOVWCAF-AFIMGQEJSA-N	425.323	1.759	50	20	IDGD	
CC(C)[C@H](CNC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Cl	1796368167	FEYGEEHQIMQBOT-QRJUGERDSA-N	449.951	1.907	50	20	IDGD	
CN(C)c1cccc(OCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CO[Si](C)(C)C)c1	1797952808	MCHFNQAHTOPBNO-FAQVEIGNSA-N	449.624	1.573	50	20	IDGD	
Cn1ncc2cc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)CO[Si](C)(C)C)ccc21	1797955781	BCIZYZJAYJALJK-XEMDLRDOSA-N	430.581	1.628	50	20	IDGD	
CCOc1ccccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnccc1C(=O)NN	1798440060	XZLNKBUUXXGQDR-MUJYYYPQSA-N	437.500	1.649	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H]1CCc3ccccc3C1)C2	1798443145	WKPLUDGDHFVHMD-HAGHYFMRSA-N	447.539	1.742	50	20	IDGD	
COc1c(Cl)ccnc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CO[Si](C)(C)C)C2	1798688847	HVSSCPOADTUPGX-YWVIFJGQSA-N	441.988	1.798	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc([N+](=O)[O-])cc1F)C2	1799271746	BELVVFWJUZKWHO-HRJSJKBJSA-N	427.860	1.883	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1=COCC1)C2)[C@@H](Br)Cc1ccccc1	1800435681	CMDIIWQYGCIMGH-RDGPPVDQSA-N	449.345	1.886	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccnc3c1OCO3)C2	1800642011	QRJHVFYKVRROEV-ZMJPVWNMSA-N	440.294	1.187	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccc2c(c1)CCO2	1800689983	SAYATVOCVGEREG-MNDZRTMASA-N	441.355	1.990	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN1CCOCC1)C2	1801437041	FDDICJCDBVSKKX-ZCZGSMFASA-N	444.482	1.842	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1CN(C(=O)OC(C)(C)C)C1)C2	1802273148	LGHBZGXNZLSZTA-QKPAOTATSA-N	429.945	1.745	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc3ncncc3c2)[C@H]1c1cccnc1)[C@@H](O)CCl	1803143287	YWRSXUHXMKXBHI-VDGAXYAQSA-N	439.903	1.944	50	20	IDGD	
Cn1ccc(=O)cc1C(=O)N1CC[C@H](CNC(=O)CCBr)[C@H]1c1cccnc1	1806343243	OKLXZXXKZACUEL-DNVCBOLYSA-N	447.333	1.885	50	20	IDGD	
Cc1nscc1C(=O)N1CCCC2(CCN(C(=O)c3cnccc3C(=O)NN)CC2)C1	1807851895	GZIILYZRMNUQJO-UHFFFAOYSA-N	442.545	1.609	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1	1807998165	IZYXZOVVAJUSMA-QIIPPGSGSA-N	434.880	1.461	50	20	IDGD	
Cc1ccnc(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)c1	1808534271	ZQHOZCSDCCMRRL-UGKGYDQZSA-N	444.300	1.098	50	20	IDGD	
Cc1ccncc1C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1808785521	WGAOHSSELMAPOM-SIKLNZKXSA-N	444.300	1.098	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](Cl)COC)[C@@H]1c1cccnc1	1810238747	ILFGTOLCDVMLOK-BSWAZPDLSA-N	439.944	1.049	50	20	IDGD	
CC1=C(C(=O)N2CCCC3(CCN(C(=O)c4cnccc4C(=O)NN)CC3)C2)CCO1	1810281888	KAFZBPQDEOLVHO-UHFFFAOYSA-N	427.505	1.224	50	20	IDGD	
Cc1cc[nH]c1C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1	1810298062	GDBSXYAZZOZSJS-OXQOHEQNSA-N	447.499	1.350	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)c2ccc[nH]2)[C@@H]1c1cccnc1	1810303551	VDAHZDCXPJJSML-HNAYVOBHSA-N	433.472	1.042	50	20	IDGD	
CC(C)CNC(=O)C(=O)N1CC[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]1c1cccnc1	1810542761	XXQOKQUNYNOHBB-PKOBYXMFSA-N	434.613	1.711	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)c2cc[n+]([O-])cc2)[C@H]1c1cccnc1	1812866777	KJMWDUVTGSWNJS-JQFCIGGWSA-N	433.306	1.818	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)Cc2ccc(O)cn2)[C@@H]1c1cccnc1	1813033457	NTOBQGLLTITMBL-ZAAXVRCTSA-N	432.908	1.685	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)on1	1813070397	ILXBWKMBSDPZBS-OXQOHEQNSA-N	428.493	1.071	50	20	IDGD	
CC(C)/C=C/C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1	1813695003	XTKUUKCBNXLXPZ-QNIGJGFBSA-N	436.516	1.612	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)CC2CCC2)[C@@H]1c1cccnc1	1814118273	MNCBVGGNAKTVJG-UTKZUKDTSA-N	436.516	1.590	50	20	IDGD	
C[C@H](CBr)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](C)CC(N)=O)[nH]n1	1814779703	VJMCJPLIXPVBGO-DMDPSCGWSA-N	428.331	1.944	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cncn2-c2ccncc2)[nH]n1)[C@H](O)CCl	1814869216	LVUWRZZBYQHMMA-NVXWUHKLSA-N	443.895	1.896	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@H]1CCCSC1)CC2)c1cccc(B(O)O)c1	1815362004	XYQFRSGRKUQKKX-ZFWWWQNUSA-N	445.375	1.192	50	20	IDGD	
Cc1nnc(CC(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@H](F)Br)CC3)o1	1815491165	HNIQEPKVLVFMPV-MADCSZMMSA-N	432.275	1.680	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(=O)n3[nH]cnc3n2)n[nH]1	1817466748	LTVXMXIOECJPDF-SMDDNHRTSA-N	446.899	1.854	50	20	IDGD	
O=C(Cc1cccnc1)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1817621142	UBERNNMIHNUXEH-LJQANCHMSA-N	433.277	1.033	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@H](F)Br)[nH]n1)c1cc(O)nc(O)n1	1818031474	HBDSUPXJFAVYCY-CABZTGNLSA-N	443.233	1.607	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](O)NC(=O)OCC)n[nH]1	1819238369	UQXSZWFBLOMFKD-RBOXIYTFSA-N	429.905	1.874	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1CCc2nc(NC(=O)CCc3nc(N)n[nH]3)sc2C1	1819560221	UZHJCGJTWVVXIV-VPTHRUTESA-N	446.364	1.625	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCBr)CC2	1820141346	UADCVPQZCCHOSK-ZJUUUORDSA-N	429.340	1.531	50	20	IDGD	
CC(C)CNC(=O)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](F)Br)n[nH]1	1820931847	AHGVUQPSLYOOIM-YPMHNXCESA-N	432.294	1.865	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2CNC(=O)O2)CC1	1824569578	PNXXQKJJROUTRI-SNPRPXQTSA-N	430.343	1.746	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CN2CC(=O)NC2=O)CC1	1824967095	LSXYLGIPTXKZDR-HOTGVXAUSA-N	426.945	1.565	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)C1=NN(C)C(=O)CC1)CC2	1825636655	YGOBDVIZVJZHGW-RKDXNWHRSA-N	442.339	1.447	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](C)n1ccnn1)CC2	1825647692	VEUVCEMTHHATAX-AEJSXWLSSA-N	427.328	1.691	50	20	IDGD	
C#CCCCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnccc1C(=O)NN)CC2	1826038897	AMYMGTGTWAEHAE-GFCCVEGCSA-N	426.502	1.171	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)CCn3ccnn3)sc2C1	1826879861	VZNUEGMSJXFENM-QWRGUYRKSA-N	441.355	1.910	50	20	IDGD	
O=C(c1ccsc1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827050686	CVCYZIAETNCYFE-FQEVSTJZSA-N	426.347	1.975	50	20	IDGD	
CC(C)(C)[C@@H](O)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827055505	AHMTZEIAFHIFJQ-UXHICEINSA-N	430.354	1.007	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(F)nc3)C2)C1	1830539174	DNPJLJOISFSSQI-UGSOOPFHSA-N	444.301	1.322	50	20	IDGD	
CC(=O)N[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1)C(C)(C)C	1831083621	SETJOKRDYLRXSG-IERDGZPVSA-N	445.988	1.259	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CNC(=O)N(C)C)CC1	1831651099	WVDLLTXJMYLLCY-DZGCQCFKSA-N	431.375	1.661	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H](C)Br)CC1	1831652854	KSSBBFORAZFAJO-QEJZJMRPSA-N	431.375	1.836	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@H](F)Br)CC1	1831874799	WDNVAQUEXHNJPF-YOEHRIQHSA-N	449.365	1.670	50	20	IDGD	
COc1ccsc1C(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)CCl)CC2)CC1	1833311780	DSRKXEMCRREIAH-HNNXBMFYSA-N	429.970	1.542	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@H]3CCCCN3C)CC2)CC1	1836725451	CIZJCIJZYUSCIJ-RBUKOAKNSA-N	429.989	1.723	50	20	IDGD	
CC[C@H](C)CC(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1	1836792238	LIYCTVGIZKHABQ-KRWDZBQOSA-N	430.354	1.415	50	20	IDGD	
CC(C)CCC(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1	1837921573	PLETWZWSKLCLBH-UHFFFAOYSA-N	430.354	1.415	50	20	IDGD	
CCc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)n(C)n1	1838039066	PJLMNLZTTRGUNF-HXUWFJFHSA-N	426.945	1.318	50	20	IDGD	
COCc1c[nH]c(C(=O)N2CCO[C@@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)c1	1838514622	IYSAYIQTJKFZAW-HXUWFJFHSA-N	439.585	1.083	50	20	IDGD	
CCc1ncsc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](Cl)COC)C2)C1	1838838931	HTIYLMYLNNZELZ-ACJLOTCBSA-N	431.942	1.029	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(O)c(OC)c3)CCO2)C1	1838972661	OTTZTOYUILYBJQ-IERDGZPVSA-N	440.924	1.878	50	20	IDGD	
O=C(c1cccnc1S)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839197078	HPDYVZFAYFLAGJ-BLLLJJGKSA-N	448.314	1.131	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)ccc1O	1839309913	UZIDPNNAINPGNL-AUUYWEPGSA-N	441.322	1.554	50	20	IDGD	
CCCc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](Cl)COC)CCO3)cc1	1840154451	XDARZOBXGKZTAE-SIKLNZKXSA-N	438.952	1.963	50	20	IDGD	
CSc1cccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)c1O	1840189055	SYKOTSKFZVIMPP-GOSISDBHSA-N	449.356	1.988	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)C3CCSCC3)CCO2)C1	1840925685	ACYMLCGQLWFDFE-YJBOKZPZSA-N	449.411	1.760	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)COc2cccc3ccccc23)C1	1841880986	LPGPZMOAFAMNNQ-UHFFFAOYSA-N	444.296	1.416	50	20	IDGD	
Cc1cc(C(=O)N2CC3(CCCN3C(=O)CN(C)NC(=O)NCc3ccccc3)C2)c[nH]1	1845039068	ZKHPNIUQPAMLKJ-UHFFFAOYSA-N	438.532	1.486	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)NC(=O)OC(C)(C)C	1847500673	LEEBMABUCPHNQB-VOAKCMCISA-N	434.331	1.062	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](O)CCl)[C@@H](F)C1	1847556280	GWIUQTOZCBVKIW-OLMNGRFOSA-N	447.935	1.383	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CCN1C(=O)c2ccccc2C1=O	1848085562	RGAREFRDVXFJNV-ROUUACIJSA-N	443.576	1.726	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2n[nH]c(=O)c3ccccc23)c([N+](=O)[O-])cc1OC(F)F	11543596	CWMYBSLHRXPULF-UHFFFAOYSA-N	449.326	1.516	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ccc3nnc(C(F)(F)F)n3n2)CC1)c1ccncc1	11762982	WIMTZCMMDNYUJW-UHFFFAOYSA-N	434.382	1.216	50	20	IDGD	
C[C@@H]1CN(S(=O)(=O)c2cccc(C(=O)NNC(=O)Cc3ccc(F)cc3)c2)C[C@@H](C)O1	15529019	RWCLXCQIMZZUOJ-HUUCEWRRSA-N	449.504	1.627	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NNC(=O)COc2ccc(C)c(C)c2)cc1	17203736	DUJWZKHWMPCZPO-FQEVSTJZSA-N	445.541	1.991	50	20	IDGD	
COC(=O)c1cccc(S(=O)(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)c1	24259061	AXBQVQNGXVSAEO-UHFFFAOYSA-N	444.469	1.387	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCC2CCN(S(C)(=O)=O)CC2)ccc1OC(C)C	109814751	WILVCCUJQXHDNA-UHFFFAOYSA-N	442.538	1.098	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(CNC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)CC1	725860085	JVPPYHRHNMRFIL-UHFFFAOYSA-N	444.496	1.253	50	20	IDGD	
CC(C)c1ccccc1NC(=S)NNC(=O)c1cc2c(=O)n(C)c(=O)n(C)c2n1C	727172507	HMQXFOJDGGAQGF-UHFFFAOYSA-N	428.518	1.331	50	20	IDGD	
CN(C)CCNC(=O)c1cccc(CNC(=O)NNC(=O)Cc2c[nH]c3ccccc23)c1	727603731	CEOKXVVNHZRRNH-UHFFFAOYSA-N	436.516	1.532	50	20	IDGD	
C[C@H](NC(=O)OCc1ccccc1)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	728889760	PFWCHTXXWSKJRA-HNNXBMFYSA-N	426.477	1.155	50	20	IDGD	
CC[C@H](C)NC(=O)CN1CCN(C(=O)NNC(=O)c2ccc(Br)s2)CC1	728941880	DLOFIYHCBCNLLX-NSHDSACASA-N	446.371	1.397	50	20	IDGD	
O=C(NCc1ccccc1-c1ccc(Cn2ccnc2)cc1)NNC(=O)C(=O)NC1CC1	729054809	LZLHJNFDQDBVEI-UHFFFAOYSA-N	432.484	1.707	50	20	IDGD	
Cc1ccc(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c(F)c1	729662632	NJQLEEHCVZHGKI-UHFFFAOYSA-N	441.506	1.542	50	20	IDGD	
CCCCC(=O)N1CSC[C@H]1C(=O)OCC(=O)NNC(=O)c1cccc(Cl)c1	730329718	MQEGCLOSNOPHBI-AWEZNQCLSA-N	427.910	1.736	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)c3c[nH]nc3C)cc2)cc1	732083948	ADDBWMDLQFQHEU-UHFFFAOYSA-N	441.469	1.796	50	20	IDGD	
C[C@@H]1CC(C)(C)C[C@]2(C1)NC(=O)N(CC(=O)NNc1ccccc1S(C)(=O)=O)C2=O	732302888	SQQBCMURRHWYHW-XCLFUZPHSA-N	436.534	1.670	50	20	IDGD	
O=C(NNc1ccccc1[N+](=O)[O-])[C@H]1CCCN1S(=O)(=O)c1cccc([N+](=O)[O-])c1	732951536	NTZBRHAJPXMOFV-MRXNPFEDSA-N	435.418	1.799	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN1C(=O)c1ccc2c(c1)OCO2)c1cnn(-c2ccccc2)c1	733108424	PYHSAKHEYYHLRK-GOSISDBHSA-N	447.451	1.667	50	20	IDGD	
CC(=O)N[C@H](CC(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)c1c(F)cccc1F	734239485	PQUUEHZMLVVBCT-CQSZACIVSA-N	443.451	1.387	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1	734240955	XRRVNJOBCWYHGS-MRXNPFEDSA-N	437.516	1.893	50	20	IDGD	
CSC[C@@H](C(=O)NNC(=O)COCc1ccccc1)N1C(=O)[C@H]2CCCC[C@H]2C1=O	737636617	SYBMWHNPTFSMKS-BBWFWOEESA-N	433.530	1.257	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CN2CCN(Cc3nc(O)c4ccccc4n3)CC2)cc1	738299959	RQMDYKLIUQEXLZ-UHFFFAOYSA-N	434.500	1.223	50	20	IDGD	
O=C(COC(=O)CNC(=O)N1CCc2ccccc2C1)NNC(=O)c1cccc(Cl)c1	740976636	ZRXKXMOQMFRKCS-UHFFFAOYSA-N	444.875	1.412	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)c2ccc3c(c2)NC(=O)CCN3C)c2ccccc2c1=O	741743208	NSYWLRGOYLJOPT-UHFFFAOYSA-N	448.483	1.831	50	20	IDGD	
CN(CC(=O)NNC(=O)c1cc(Br)ccc1O)S(=O)(=O)c1ccccc1	743730452	YLQSORTWCAXFGZ-UHFFFAOYSA-N	442.291	1.236	50	20	IDGD	
CCN(CC)CCN1C(=O)C(=NNC(=O)[C@@H](C)CN2C[C@H](C)O[C@H](C)C2)c2ccccc21	744762183	OPHMFWSNNSFYIX-GBESFXJTSA-N	443.592	1.941	50	20	IDGD	
C[C@H](NC(=O)OC(C)(C)C)C(Cc1ccccc1)=NNC(=O)[C@@H](C)NS(C)(=O)=O	746576804	RAKGKLROUNRPIJ-UONOGXRCSA-N	426.539	1.552	50	20	IDGD	
Cn1ccnc1[C@](O)(CCNC(=O)NNC(=O)c1ccc(Cl)cc1F)C(F)(F)F	747500571	KECNDZXLXSQBEO-OAHLLOKOSA-N	437.781	1.997	50	20	IDGD	
COc1cc(CN2CCN(CC(=O)NNC(=O)c3ccc(C)cc3)CC2)cc(OC)c1	747845402	WYISBOMBQLWLDC-UHFFFAOYSA-N	426.517	1.591	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccc(F)cc2)cc1O)c1csc(N2CCOCC2)n1	748011907	HQZIQCKEAHFUIG-UHFFFAOYSA-N	432.437	1.085	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NC[C@]2(N(C)C)CCSC2)nc1	748646506	GTOCFBQZORAQFG-QGZVFWFLSA-N	430.600	1.176	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)c3ccnn3C)c2)cc1	748831318	OTTNZTUNRRVJAJ-UHFFFAOYSA-N	429.458	1.304	50	20	IDGD	
COCCCOc1ccc(C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)cc1	749866150	HUCADRGIBWEZPE-UHFFFAOYSA-N	434.518	1.778	50	20	IDGD	
O=C(CCn1cnc2ccccc2c1=O)NNc1nc(Br)cn2ccnc12	750247631	PMPQDAKPRHBOKB-UHFFFAOYSA-N	428.250	1.735	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)N[C@@H]1CCN(CCCc2ccccc2)C1=O	750659547	HUGMBSZRPZHSFZ-QGZVFWFLSA-N	441.444	1.478	50	20	IDGD	
C[C@H](NC(=S)NNC(=O)c1ccc(S(=O)(=O)NC[C@H]2CCCO2)cc1)C1CC1	751620657	XOEXWZWFYNTERH-SWLSCSKDSA-N	426.564	1.051	50	20	IDGD	
O=C(NN=C[C@H]1CCOc2ccccc21)c1cccc(S(=O)(=O)N2CCOCC2)c1	752157238	KIDXWAVOQIVZAR-QGZVFWFLSA-N	429.498	1.989	50	20	IDGD	
CCc1cc(Br)ccc1NNC(=O)C(=O)Nc1ccc(S(N)(=O)=O)cc1	753505786	OTBBGTFCWVBRLM-UHFFFAOYSA-N	441.307	1.741	50	20	IDGD	
Cc1sc2ccc(Cl)cc2c1S(=O)(=O)NNC(=O)[C@H](C)NS(C)(=O)=O	753981466	HSSGWOXLTLMMCG-ZETCQYMHSA-N	425.941	1.110	50	20	IDGD	
C[C@H]1CCC[C@H](C)C1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	754925823	FDSRSNGYNIQVEH-GJZGRUSLSA-N	438.550	1.476	50	20	IDGD	
O=C(C[C@H]1CCCCO1)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	755036640	ZMOCYHBVYKNEEN-GOSISDBHSA-N	431.514	1.885	50	20	IDGD	
O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)NNC(=O)Cc1cc[nH]n1	755286454	KVQMPFWDLJWNIP-RAXLEYEMSA-N	435.556	1.843	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)c1cccc(I)c1O	755298257	UVQFENKBHQGIRO-UHFFFAOYSA-N	428.182	1.542	50	20	IDGD	
O=C(NNC(=O)c1ccncc1)Nc1ccc(Cl)c(S(=O)(=O)N2CCOCC2)c1	755361619	MPBJYMBVNJFEAM-UHFFFAOYSA-N	439.881	1.222	50	20	IDGD	
CCN(CC)C(=O)c1ccc(NC(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)cc1Cl	755644241	MYYSBMBUGDDJMK-NSHDSACASA-N	430.914	1.409	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)NCc2cn(-c3ccccc3)nn2)c2ccccc2c1=O	756072573	SIOHRHJVKGNGJS-UHFFFAOYSA-N	446.471	1.702	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)Nc2ccc(S(=O)(=O)/N=C3\CCCN3C)cc2)c(O)c1	756078091	PHTQROOCLHWHBX-HKOYGPOVSA-N	445.501	1.980	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1NS(C)(=O)=O	756515234	FNCWLVCXLZRQFT-UHFFFAOYSA-N	444.473	1.080	50	20	IDGD	
CNS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)cc1	756640624	PAKIBVQDMOLJDN-UHFFFAOYSA-N	438.462	1.087	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Nc2cnn(CC(=O)N(C)C)c2)ccc1OCCC(C)C	756794871	BCSJZIOQMLJNSE-UHFFFAOYSA-N	446.508	1.871	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)NCc1cc2c(cc1OC(F)F)OCO2	756958588	FPHMODPIHAGHFX-UHFFFAOYSA-N	433.371	1.738	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)Nc2c(C)nn([C@@H]3CCS(=O)(=O)C3)c2C)cc1	757870839	AMMSGKOYQRBBHU-MRXNPFEDSA-N	449.533	1.654	50	20	IDGD	
O=C(c1c[nH]c2cccc([N+](=O)[O-])c12)N1CCN(S(=O)(=O)CBr)CC1	758517204	HYSLZSQMZVRPGO-UHFFFAOYSA-N	431.268	1.516	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1cc(Br)nn1C	758806962	JLLXNBNKFKJMHO-UHFFFAOYSA-N	445.657	1.463	50	20	IDGD	
CCCCn1ncc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1CC	758909743	TZVNKEXTJBHRAR-SFHVURJKSA-N	430.461	1.390	50	20	IDGD	
N#CCCn1ncc(C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)c1-c1ccccc1	759080443	WATUDZUJTWISFH-UHFFFAOYSA-N	442.435	1.953	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)NCCOc2ccc(C(F)(F)F)cn2)nc2ccccc21	761779246	OVOZJSGUMVXHET-UHFFFAOYSA-N	436.394	1.939	50	20	IDGD	
CS(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)CSc2ccccc2O)c(F)c1	763413611	UQTGDYXUCLWLLZ-UHFFFAOYSA-N	449.507	1.005	50	20	IDGD	
O=C(NNC(=O)c1ccncc1)C(=O)Nc1cc(Br)ccc1-n1cccn1	763463408	DDLFGBUHCRRQMZ-UHFFFAOYSA-N	429.234	1.430	50	20	IDGD	
CC(C)(C)OC(=O)N1CCc2cc(NC(=O)C(=O)NNC(=O)c3cccnc3)ccc21	763492292	SZZFYOBQESZFJF-UHFFFAOYSA-N	425.445	1.779	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)C(=O)Nc2cccc(-n3ccnn3)c2)c1	763595757	DBWZPFGOIATSSF-UHFFFAOYSA-N	436.472	1.864	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(CN3CCCCC3=O)c2)c1	763624205	UGCQGTPSBYJAGX-UHFFFAOYSA-N	438.484	1.672	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)cnn1-c1ccccc1	763685539	XIPCWHBGHQVDNA-UHFFFAOYSA-N	427.848	1.999	50	20	IDGD	
O=C(NNC(=O)c1cccc(Cl)c1)C(=O)Nc1cccc(OCC(=O)N2CCCC2)c1	763747965	KMHOLEPYIYJMJT-UHFFFAOYSA-N	444.875	1.741	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)C(=O)Nc1ccc(OCC(F)(F)F)cc1	763790299	HQQONRZOVNKVRP-UHFFFAOYSA-N	449.345	1.676	50	20	IDGD	
CC(C)n1cc2cc(NC(=O)C(=O)NNC(=O)COc3ccccc3[N+](=O)[O-])ccc2n1	763803276	KTIZYDVWQWVHDU-UHFFFAOYSA-N	440.416	1.690	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(OCC3CCOCC3)cc2)cc1	763811226	HFNFMEIBZBBXLY-UHFFFAOYSA-N	441.484	1.965	50	20	IDGD	
Cc1cc(C(=O)N2CCCC2)ccc1NC(=O)C(=O)NNC(=O)COc1ccc(F)cc1	763837287	DQRGXJKIMPGQDA-UHFFFAOYSA-N	442.447	1.535	50	20	IDGD	
CCc1nnc(-c2ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc3ccccc3F)cc2)o1	763856932	IYLFUZWZPZXNKR-GFCCVEGCSA-N	441.419	1.992	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1cc(F)cc(N2CCOCC2)c1	763865894	SMQIGCJVHOTIGU-ZDUSSCGKSA-N	448.426	1.355	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)NC(=O)[C@@H](C)O2	763873519	VEKGBBYUVRTLCV-MNOVXSKESA-N	430.392	1.099	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccc(N2CCCC2=O)c(F)c1	763873905	XWTXYNUAZPIVSC-LBPRGKRZSA-N	446.410	1.645	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)OC[C@H]2COC(=O)O2)cc1	763892687	REXOMVNUOKBXBI-QHIITQONSA-N	440.412	1.420	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)C(=O)Nc1csc(-c2ccccn2)n1	763995777	QMWXMKCQBMBILK-UHFFFAOYSA-N	435.263	1.695	50	20	IDGD	
Cc1cc(I)ccc1NC(=O)C(=O)NNC(=O)Cc1ccsc1	764024431	GTKYCCGFYNEHOC-UHFFFAOYSA-N	443.266	1.990	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2ccc(F)c(C(=O)N(C)C)c2)cc1	764125368	VTICMVDAGONWTJ-UHFFFAOYSA-N	430.436	1.255	50	20	IDGD	
CCOc1ccc(C(=O)N2CCCCC2)cc1NC(=O)C(=O)NNC(=O)c1ccoc1	764158607	IFGSUNJUHOKRAX-UHFFFAOYSA-N	428.445	1.704	50	20	IDGD	
C[C@@H]1CCCCN1C(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(C#N)cc2)cc1	764181435	CQPIFTLGTAGXLG-OAHLLOKOSA-N	433.468	1.973	50	20	IDGD	
Cc1cn(-c2ccccc2)nc1NC(=O)C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C	764204726	SRRWMYDGVPLQCI-UHFFFAOYSA-N	444.492	1.572	50	20	IDGD	
COc1cc(C(=O)N(C)C)ccc1NC(=O)C(=O)NNC(=O)Cn1ccc2ccccc21	764239744	RRBKCWWDAXIVDG-UHFFFAOYSA-N	437.456	1.138	50	20	IDGD	
O=C(Cc1ccccn1)NNC(=O)C(=O)Nc1cnn(-c2cccc(C(F)(F)F)c2)c1	764266400	DGECCPNCEGVVDT-UHFFFAOYSA-N	432.362	1.615	50	20	IDGD	
CSc1cc2c(cc1NC(=O)C(=O)NNC(=O)COc1ccccc1O)OCCO2	764276772	BGRSMODVDIFSQA-UHFFFAOYSA-N	433.442	1.050	50	20	IDGD	
CCOc1ccc(C#N)cc1NC(=O)C(=O)NNC(=O)CSc1ccccc1OC	764399129	ZSDVSWONWGQPKP-UHFFFAOYSA-N	428.470	1.844	50	20	IDGD	
CC(=O)c1ccc(NC(=S)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cc1	764519378	QPFJLFLOJYXJJA-UHFFFAOYSA-N	439.541	1.665	50	20	IDGD	
Cc1ccc(S(=O)(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cc1C	765119113	QARNPCSZZLETED-UHFFFAOYSA-N	430.530	1.071	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)/C=C/c3ccccc3)CC2)cc1	765730915	YCUJLQJRKHWMCH-FMIVXFBMSA-N	442.541	1.162	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)CNC(=O)CCC3CCCC3)CC2)cc1	765748742	GLNGMBHPRPPIMX-UHFFFAOYSA-N	443.592	1.347	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2cccc(OC)c2[N+](=O)[O-])c2ccccc2c1=O	766347802	AROKAVAJLMDGFF-UHFFFAOYSA-N	425.401	1.798	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)[C@H]1CCN(c2ccc(F)cc2)C1=O	767309398	ZFACCTPSTIGTEW-SFHVURJKSA-N	427.432	1.420	50	20	IDGD	
CC(=O)N1CCN(c2ccc(C(=O)NNc3ccc([N+](=O)[O-])cc3)cc2[N+](=O)[O-])CC1	768245938	BLZGEKQYHRVNFP-UHFFFAOYSA-N	428.405	1.928	50	20	IDGD	
CC(C)(O)C(=O)NNC(=O)c1ccc2c(=O)n(Cc3ccccc3Cl)c(S)nc2c1	768247968	QTUZTLITFSNEBY-UHFFFAOYSA-N	446.916	1.919	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)c2ccc(C)c(NS(C)(=O)=O)c2)n[nH]1	768274005	MNVPCMPTOAVDFJ-UHFFFAOYSA-N	443.485	1.840	50	20	IDGD	
Cn1cc(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)c(-c2cccs2)n1	768417368	NEFRFRJAYFTAJR-UHFFFAOYSA-N	447.542	1.926	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)[C@@H]1CCCN1C(=O)Cc1ccccc1	768613748	YDGYOJUVEALATR-INIZCTEOSA-N	431.514	1.776	50	20	IDGD	
COc1ccc(C)cc1N1C[C@@H](C(=O)NNc2c(OC)cccc2S(C)(=O)=O)CC1=O	768634444	KAXUWRCWGUVVHT-AWEZNQCLSA-N	447.513	1.912	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)N[C@@H]2CCO[C@]3(CCSC3)C2)nc1	769239743	MOPVXHBZNZVDAB-CXAGYDPISA-N	429.568	1.449	50	20	IDGD	
C[C@H](CBr)COC(=O)[C@H](C)NC(=O)c1ccc(S(=O)(=O)N(C)C)cc1	770337598	SPAZZUKNKLOOQB-NEPJUHHUSA-N	435.340	1.629	50	20	IDGD	
CC(C)(C)C(=O)NCCc1ccc(S(=O)(=O)NNC(=O)NCc2ccco2)s1	770631586	HSNHDCWWABWBOE-UHFFFAOYSA-N	428.536	1.739	50	20	IDGD	
COC(=O)c1cn([C@@H]2CCN(C(=O)NNC(=O)[C@H](C)Oc3cccc(Cl)c3)C2)nn1	770648494	RNHMJZYKLCCDGD-WCQYABFASA-N	436.856	1.173	50	20	IDGD	
CCN1CCN(c2cccc(NC(=O)C(=O)NNC(=O)c3cc(Cl)ccc3O)c2)CC1	770772288	VCHYCKYLZBAUEM-UHFFFAOYSA-N	445.907	1.587	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)CCC(=O)c1ccc(I)cc1	771838534	LLTKDOOESHRYLX-SNVBAGLBSA-N	446.241	1.743	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)N[C@@H]1CCCN(CC(F)(F)F)C1=O	772973186	GWONALPLSKSDPR-MRVPVSSYSA-N	426.193	1.275	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2O1)C(=O)Nc1ccc(OC(F)F)c2cccnc12	773495410	BAIFYAIWYFHYOY-INIZCTEOSA-N	442.378	1.926	50	20	IDGD	
O=C(NNc1c(F)cccc1F)C(=O)Nc1ccc(N2CCN(C(=O)C3CC3)CC2)nc1	773708465	DDGVAMHJFILTKC-UHFFFAOYSA-N	444.442	1.500	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1cccc(C(=O)NC2CC2)c1	774009509	POGMJJBVNCCQGA-LBPRGKRZSA-N	444.875	1.786	50	20	IDGD	
CC[C@H]1Oc2cc([C@@H](C)NCC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)ccc2NC1=O	775463340	KHRQQOFPLOKEBV-SJKOYZFVSA-N	441.444	1.816	50	20	IDGD	
Nc1nc(Cl)cc(NNC(=O)Nc2cccc(Cn3nc4ccccn4c3=O)c2)n1	776298378	LOSQBERRLSMWNM-UHFFFAOYSA-N	425.840	1.719	50	20	IDGD	
COC(=O)Nc1ccc(S(=O)(=O)NNC(=O)CCOc2ccccc2)cc1[N+](=O)[O-]	777619618	MARAJHFINQCKKH-UHFFFAOYSA-N	438.418	1.552	50	20	IDGD	
C[C@@H](NC(=O)c1ccc(Br)s1)C(=O)NNC(=O)CNC(=O)OC(C)(C)C	778443395	PJYMJLJDXGSITB-MRVPVSSYSA-N	449.327	1.301	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)[C@H]1CCN(Cc2ccccc2)C1	778588881	MHKVCPJMMATUMN-LPHOPBHVSA-N	434.504	1.517	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cc3c(cc2F)NC(=O)CC3)cc1OC	778706584	XDIHOTVKYWYXGT-UHFFFAOYSA-N	430.392	1.127	50	20	IDGD	
COc1cccc(NNC(=O)c2ccc(Cl)c(S(=O)(=O)NC[C@H]3CCCO3)c2)n1	780772063	RUYPYDLMHVNIHL-CYBMUJFWSA-N	440.909	1.958	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN1c1ccccc1)c1cccc(S(=O)(=O)N2CCCC2)c1	780850628	IMSJPXOXDORQLG-FQEVSTJZSA-N	442.541	1.901	50	20	IDGD	
COc1cccc(C(=O)c2ccc(C(=O)NNC(=O)CNC(=O)c3cccnc3)cc2)c1	781031522	TXOWMOLONVBNCL-UHFFFAOYSA-N	432.436	1.512	50	20	IDGD	
CCn1c(CCC(=O)NNc2ccc(OC)cn2)nc2cc(S(=O)(=O)N(C)C)ccc21	781519921	VOBGMKPLQKJOCB-UHFFFAOYSA-N	446.533	1.786	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)C(=O)N1CCc2c(Cl)cccc21	782897445	OXWCAPJMKLVLCH-UHFFFAOYSA-N	449.920	1.292	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccc(OC(F)F)cc2)nc1	783263794	LGGOGRZBQFZGLI-UHFFFAOYSA-N	443.432	1.452	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1ccc2nc(C(F)F)[nH]c2c1	784005007	OCJLPGFBYQBGEP-UHFFFAOYSA-N	436.400	1.078	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NCCCc1nc(-c2ccc(F)cc2)no1	784261854	BUHBCQCBPBRXEZ-UHFFFAOYSA-N	446.464	1.630	50	20	IDGD	
Cc1c(NNC(=O)C(=O)Nc2cccc(OCC(=O)N3CCCC3)c2)cccc1[N+](=O)[O-]	784350222	DRPHIYHXWBIWKW-UHFFFAOYSA-N	441.444	1.986	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)F)cc1)[C@H]1CC=CC[C@@H]1C(=O)N1CCOCC1	784445749	ATQAMVUFMURJFI-HOTGVXAUSA-N	443.472	1.567	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)c2cnc(OCC3CC3)c(Cl)c2)c2ccccc2c1=O	785014695	YLPASRRORYKCEN-UHFFFAOYSA-N	427.848	1.846	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2nccn(C)c2=O)nn1-c1ccc(Cl)c(Cl)c1	785089630	DGDINPAVLXXHMJ-UHFFFAOYSA-N	436.259	1.663	50	20	IDGD	
CNC(=O)Cn1ccc2ccc(NC(=O)C(=O)NNc3nc(C(F)(F)F)cs3)cc21	785147277	CLKCRJFRXNGNES-UHFFFAOYSA-N	440.407	1.944	50	20	IDGD	
COC[C@@H](C)n1ccc(NC(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)n1	785865108	VVJHKGOUIBEHEJ-CQSZACIVSA-N	439.517	1.732	50	20	IDGD	
O=C(CN1CCCN(c2nnc(C(F)(F)F)s2)CC1)NNC(=O)c1ccc(F)cc1	786444634	ONLZMZGIZXKYAW-UHFFFAOYSA-N	446.430	1.669	50	20	IDGD	
CN(C)[C@H]1CCOc2c(NC(=O)C(=O)NNC(=O)COCc3ccccc3)cccc21	789739731	QCYWYGXOKLPBNM-SFHVURJKSA-N	426.473	1.375	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)C(=O)Nc1nc2c(s1)CCCC2	789759158	XMZVWIGTTIJMGR-UHFFFAOYSA-N	435.531	1.544	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)[C@H]2CC(c3cccnc3)=NO2)c2ccccc2c1=O	790119665	SZRQXCFTEHLMIE-LJQANCHMSA-N	448.483	1.936	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2cc([C@H]3CCCOC3)nn2C)c2ccccc2c1=O	790544996	AVHBKYLSZAJPKW-ZDUSSCGKSA-N	439.476	1.510	50	20	IDGD	
O=C(NNc1nc2ccccn2n1)[C@H]1CCCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1	791243862	SFSSUUPTBDQERQ-ZDUSSCGKSA-N	445.461	1.182	50	20	IDGD	
CCS(=O)(=O)c1ccc(CNC(=O)NNC(=O)[C@H](C)Oc2ccccc2F)s1	792218846	YFVHAOCTWAAFEK-NSHDSACASA-N	429.495	1.979	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)C(=O)Nc1c2c(nn1-c1ccc(Cl)cc1)CCC2	792267208	WXRPUQGDPKNBQF-UHFFFAOYSA-N	438.875	1.738	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2C(=O)O1)c1ccc(S(=O)(=O)N2CCCC2)cc1	793026617	IPRSTCMYNJSMQM-SFHVURJKSA-N	443.481	1.014	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NCCSSC)cc1S(=O)(=O)N1CCCCC1	793077440	AAFAKFBSSKUCOS-UHFFFAOYSA-N	447.604	1.936	50	20	IDGD	
C[C@]1(C(=O)NNC(=O)CNC(=O)c2ccco2)CCN(C(=O)OCc2ccccc2)C1	793338873	WQVUERCAKYESML-NRFANRHFSA-N	428.445	1.206	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3ccc4nc(C)n(C)c4c3)CC2)cc1	793680916	HLTOUWCCURXFQP-UHFFFAOYSA-N	434.544	1.769	50	20	IDGD	
CNS(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)c2cc(C)nc3ccccc23)cc1C	794578773	NELSHWPRRRUUMX-UHFFFAOYSA-N	448.526	1.383	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)CCc2ccc(OC)cc2)cc1OC	797000261	ALADKNKSNUUUKS-UHFFFAOYSA-N	429.429	1.209	50	20	IDGD	
Cn1ccnc(NNC(=O)C(=O)Nc2cc(C(F)(F)F)ccc2Br)c1=O	797092339	GPYWNYMKJSJMSY-UHFFFAOYSA-N	434.172	1.643	50	20	IDGD	
CCCCN(C)S(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cccc(C)n2)cc1	797369635	BYSJOXDQLUFSPJ-UHFFFAOYSA-N	447.517	1.210	50	20	IDGD	
COc1ccc([C@H]2[C@@H](C(=O)NNC(=O)C(=O)Nc3ccc(C)c(C)c3)CC(=O)N2C)cc1	798309004	SUUBIQKBPVNFNY-ICSRJNTNSA-N	438.484	1.618	50	20	IDGD	
C[C@H]1[C@H](NC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])CC(=O)N1Cc1ccccc1	798530726	SBKNTFDOJFALLJ-GOEBONIOSA-N	441.444	1.494	50	20	IDGD	
CC(C)(C(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1)N1CCOCC1	801145844	JAEXEDMLYMNYNW-JOCHJYFZSA-N	436.556	1.872	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2nn(-c3ccccc3[N+](=O)[O-])c(C)cc2=O)cc1	802061935	AMDFNFAXVYKNGP-UHFFFAOYSA-N	438.400	1.924	50	20	IDGD	
O=C(NNC(=O)C1=CN2CCS(=O)(=O)N=C2C=C1)Nc1ccc(Cl)cc1Cl	802087995	HXHVJTSVGGSIKF-UHFFFAOYSA-N	430.273	1.644	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)CCC/N=C2/NS(=O)(=O)c3ccccc32)cc1	802121803	QGICIRCLJGTIAQ-UHFFFAOYSA-N	444.517	1.424	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NC[C@H]2CC(c3ccc(OC)c(F)c3)=NO2)cc1	802342671	LVFUVAWUBKTHMW-MRXNPFEDSA-N	446.435	1.745	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)[C@H]1CCCN(S(=O)(=O)Cc2ccccc2)C1	804956432	NCYLYKOPYSTMRX-KRWDZBQOSA-N	441.517	1.347	50	20	IDGD	
CC(C)(C(=O)OCC(=O)NNC(=O)c1cccs1)S(=O)(=O)c1ccc(Cl)cc1	805705413	GLFIRHWFUYYJID-UHFFFAOYSA-N	444.918	1.958	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NCCC2(O)CCOCC2)c2ccccc2c1=O	807448108	GMXFEZQSEYPDDG-UHFFFAOYSA-N	431.493	1.072	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)N2CCN(c3ccccc3)CC2)cc1	812447252	KKKQAEKIEUPCQJ-QGZVFWFLSA-N	440.500	1.349	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)C(=O)Nc1ccc(Cl)c(F)c1	813508921	NFGQNUVFVVYUKE-UHFFFAOYSA-N	427.219	1.535	50	20	IDGD	
NS(=O)(=O)c1ccc(NC(=O)NN=C2C(=O)Nc3cc(Br)ccc32)cc1	814967879	DMASDKZMGHQVRB-UHFFFAOYSA-N	438.263	1.574	50	20	IDGD	
CN1CCN([C@@H](C(=O)NNc2ccccc2S(=O)(=O)N(C)C)c2ccccc2)CC1	817052636	KAKIIYKNMGCKJB-HXUWFJFHSA-N	431.562	1.369	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)c1cc(F)ccc1NS(C)(=O)=O	817053707	CQRZGKKSLKICLV-UHFFFAOYSA-N	430.483	1.204	50	20	IDGD	
COc1cccc(/C=C(\C(=O)OCC(=O)NNC(=O)c2cccs2)n2nnnc2C)c1	818158509	HVGXHKUXDYXOGP-XNTDXEJSSA-N	442.457	1.054	50	20	IDGD	
Cn1cc(C=NNC(=O)c2nc(-c3ccccc3)n(-c3ccccc3)n2)c(=O)n(C)c1=O	839397129	XYROJHRJSBESFC-UHFFFAOYSA-N	429.440	1.096	50	20	IDGD	
CC(C)[C@@H](NS(=O)(=O)c1ccc2c(c1)OCCCO2)C(=O)NNC(=O)c1ccncc1	865910495	CHIYLZOJCXRPPD-GOSISDBHSA-N	448.501	1.007	50	20	IDGD	
CCN1CCc2nc3ccccc3c(C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)c2C1	894382262	ZVBJDNHCHZQEBQ-UHFFFAOYSA-N	442.483	1.663	50	20	IDGD	
CC(=O)NNC(=O)COc1ccc(N(C)S(=O)(=O)c2ccc(NC(C)=O)cc2)cc1	912693607	HDGIZCFISHRCOF-UHFFFAOYSA-N	434.474	1.016	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)c2cn(-c3ccccc3Br)nn2)cc1	914832402	ZQPWYPSVALBKBO-UHFFFAOYSA-N	445.277	1.912	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@H]2C(=O)NNC(=O)COc2cccc(C)c2)c(OC)c1	915059538	BCRLRWIUCFLYBU-IBGZPJMESA-N	441.484	1.843	50	20	IDGD	
CN(CC(=O)NNC(=O)c1cc2c(s1)CCCCCC2)S(=O)(=O)c1cccnc1	915109651	NRMDXXKKXSFQCA-UHFFFAOYSA-N	436.559	1.884	50	20	IDGD	
COCCNS(=O)(=O)c1cccc(C(=O)NNC(=S)Nc2ccccc2OC)c1	915598506	YDDVMKOEKCUDNB-UHFFFAOYSA-N	438.531	1.251	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)NCCCN2C(=O)NC3(CCCC3)C2=O)c1C	915906169	OTQXZIPWWHNUGR-MRXNPFEDSA-N	445.520	1.656	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)N[C@@H](CN1CCOCC1)c1ccccc1	916213611	FINAOSFJURSTKR-JXFKEZNVSA-N	430.480	1.997	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)NCCCN1CCN(C)C[C@@H]1c1ccccc1	916484633	DDKAJODVLWZVQZ-HXUWFJFHSA-N	449.559	1.966	50	20	IDGD	
COC(=O)c1ccccc1S(=O)(=O)N1CCC(C(=O)NNC(=O)C(C)(C)C)CC1	917180110	DKLUZIWOOLLDBE-UHFFFAOYSA-N	425.507	1.067	50	20	IDGD	
CN(C)C(=O)COc1cccc(CNC(=O)NNC(=O)c2ccc3c(c2)OCCO3)c1	918223427	HCZWGIVBGMLPRQ-UHFFFAOYSA-N	428.445	1.069	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)NCCS(=O)(=O)c2ccc(Cl)cc2)c1	919786612	XTUXNPONUDAWMB-UHFFFAOYSA-N	441.893	1.775	50	20	IDGD	
O=C(NNC(=O)c1cccc(NC(=O)c2ccc(F)cc2)c1)N[C@@H]1CCS(=O)(=O)C1	919883465	AKLPKUXKNLYPAW-MRXNPFEDSA-N	434.449	1.209	50	20	IDGD	
COc1cc(C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)cc(Cl)c1OCC(C)C	919886026	SQTZMUBFWOXHTB-LBPRGKRZSA-N	433.914	1.515	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)NCc1ccc(CN2CCN(C)CC2)cc1	919903872	XVVINXZGYZBSHQ-UHFFFAOYSA-N	425.533	1.516	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)Cc2c(C)nc(-c3cccnc3)nc2O)o1	920248895	TTXRDKLQWLBBSF-UHFFFAOYSA-N	438.488	1.991	50	20	IDGD	
CCOC(=O)CNC(=O)/C(C#N)=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	920853660	DJXKPTZZMAOTTQ-NTEUORMPSA-N	429.864	1.665	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCCN2CCCC2)c1	1248695974	AXYIYJCPZKMXAU-UHFFFAOYSA-N	425.555	1.147	50	20	IDGD	
CC(C)NC(=S)NNC(=O)c1cc(I)ccc1N1CCOCC1	1324217285	VKYHSUADFKHXMI-UHFFFAOYSA-N	448.330	1.645	50	20	IDGD	
CCN1C(=O)c2ccc(C(=O)NNc3cncc(Br)c3)cc2S1(=O)=O	1324494131	QBACRYINFGKEAU-UHFFFAOYSA-N	425.264	1.765	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2ccc(Br)cc2)cnc1C	1330192112	NBQWKIFBOLNXKZ-UHFFFAOYSA-N	428.264	1.562	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2nc[nH]c2[N+](=O)[O-])C1	1778063335	KDDDFLATGRNYLE-LYOVBCGYSA-N	444.286	1.229	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnn4cccnc34)C2)C1	1778444971	AFCZHMXTQNAJBI-KSSFIOAISA-N	436.310	1.346	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H]2Cc3ccccc3O2)C1	1778840599	MQPGFTYWBLYQKZ-ITBLURSFSA-N	436.936	1.758	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)COC(=O)C(F)(F)F)C2)C1	1778894593	LZMNREYBHFWQHT-IINYFYTJSA-N	445.232	1.095	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cccc3c1NC(=O)C3=O)CCO2	1779297277	ZRLPZFRPBCIBRL-NRFANRHFSA-N	445.548	1.116	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccnnc2O)C1	1779965497	RKSDWICHMQXUSP-JEBQAFNWSA-N	431.320	1.546	50	20	IDGD	
COc1cc(OC)cc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)c1	1780663036	SHVNWSKUIBPCHH-MAUKXSAKSA-N	445.285	1.838	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H]1Cc3[nH]nc(C(F)(F)F)c3C1)CCO2	1781220398	ZPUAWUBFZMFFCA-YNKQFZHNSA-N	448.873	1.991	50	20	IDGD	
CCN(C)[C@@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)CBr)C2	1781451341	WZERAKTTXINGLD-YYAJDYIMSA-N	432.403	1.872	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)n2ccnn2)C1	1781551720	CUFNCLBQUUZGGI-BASYENTBSA-N	442.358	1.527	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1ncccn1)C2	1781901815	XRABXAPUGLFFLI-QMTMVMCOSA-N	439.354	1.707	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@]1(C)CCCN1)C2	1781903220	PFWYVBMDDOSEIW-OSGQAZFXSA-N	430.387	1.816	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H]3Cc4[nH]nc(C(F)(F)F)c4C3)C2)C1	1782847627	AYULPLBHLBHQOB-YNKQFZHNSA-N	448.873	1.991	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cnn(C)c3Cl)CCO2)C1	1783350741	BLXUEIOUVCHHST-LRDDRELGSA-N	433.734	1.691	50	20	IDGD	
CC(C)[C@H](C(=O)N1CCO[C@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1)c1ccccc1	1783933210	RUTFULQCEVAROR-UPVQGACJSA-N	444.576	1.629	50	20	IDGD	
O=C(C(Cl)Cl)N1CC[C@]2(C1)CN(C(=O)[C@H]1CCc3ccccc3[C@@H]1O)CCO2	1783943314	VTYJBAGMMVVHOP-FTRWYGJKSA-N	427.328	1.916	50	20	IDGD	
Cc1noc(C)c1CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)CBr)C[C@@H]21	1785077247	DAFQFRYFFMYCSL-GQGQLFGLSA-N	442.354	1.845	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3cc(C)no3)[C@H]2C1	1785092300	YNBAPRHGNQRNER-TUUVXOQKSA-N	428.327	1.679	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3cccnc3Cl)[C@H]2C1	1785170152	NLILNSPGDGLRDT-VGWMRTNUSA-N	430.332	1.511	50	20	IDGD	
Cc1ncc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)CBr)C[C@@H]32)cn1	1785830915	SRNBGPIYXQHADJ-XTBFLFJDSA-N	425.327	1.409	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)N3C[C@H]4C[C@H]4C3)[C@H]2C1	1788516898	RVTPXIAJFOORHC-LSLQXUBYSA-N	442.398	1.480	50	20	IDGD	
CC(C)[C@@H](O)C(=O)NC1(c2ccc(NC(=O)c3cnccc3C(=O)NN)cc2)CCC1	1789519780	KMPYUANVQXQUKO-GOSISDBHSA-N	425.489	1.450	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3n[nH]cc3[N+](=O)[O-])C[C@@H]21	1789870790	WCFYWLYODRUKRE-ZZTKVPBPSA-N	434.280	1.148	50	20	IDGD	
C=C(CC(=O)OCC)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)CBr)C[C@@H]21	1789890641	ZWTIAIPXBZNNDB-VGWMRTNUSA-N	445.354	1.507	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3Cc4ccccc4N3)C[C@@H]21)[C@@H](F)Br	1789924915	HQYFZXCPIUMOIQ-XPYWIHLFSA-N	440.313	1.693	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)c1cccc2nccn12	1790417016	RNUJSAIDQPRXBG-DUPGQFARSA-N	439.285	1.618	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CC[C@@H]3CCOC3)C[C@@H]21	1790964283	WGAQIEVIFUEKGX-XAJHFOFHSA-N	431.371	1.956	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc([N+](=O)[O-])o3)C[C@@H]21	1791054491	KDRYNKHVCXHBBI-ZPFDUUQYSA-N	430.255	1.565	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccn4nccc4c3)C[C@@H]21	1791056127	OMCZWTPKZJQEPS-QCPWZWHMSA-N	435.322	1.711	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)c1cc(F)c(F)c(Cl)c1	1792042717	ZJNLCIKRVHTXJZ-NDMCHQMPSA-N	437.270	1.811	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1(C)CCC1	1792446053	PFZWVHRIFPUETD-FZKCQIBNSA-N	443.972	1.898	50	20	IDGD	
COc1ccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)CBr)cc1	1792868433	YAQZKOORRYSMLI-JNNRSPCRSA-N	439.350	1.858	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)[C@@H]1CCc2ccoc2C1	1793121156	TUSJSGOZKMZLIX-QUEVPRLRSA-N	429.286	1.665	50	20	IDGD	
CC(C)[C@@H](O)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1793229578	JOOXUMODRUENAP-XFIYOXNOSA-N	431.961	1.774	50	20	IDGD	
CC(C)/C=C/C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1793882690	RXYHNYCSMCXHJG-HMUZGSGMSA-N	443.972	1.920	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@](C)(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Cl)C1	1796365435	SAMLBXUGWJEXPQ-YJVQVXSTSA-N	447.935	1.758	50	20	IDGD	
CCn1nc(C)cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2	1796595117	ZBPSXJKAUJMURZ-GSWMANSFSA-N	439.520	1.597	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)CBr)C2	1796837810	IFXVXMAJBPMIDF-JJAZEVLHSA-N	449.349	1.877	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@](C)(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Cl)C3)C1	1797181403	YYZCZJPDGBSQKO-YJVQVXSTSA-N	447.935	1.758	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1nc2ccccc2n(C)c1=O	1797524038	PNERXYZZMWRECJ-YIYPIFLZSA-N	447.333	1.969	50	20	IDGD	
N#Cc1cccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)c1Cl	1799301782	RVAFYJRTUMUCML-BCDXTJNWSA-N	437.692	1.457	50	20	IDGD	
C[C@H](Cc1ccncc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2	1800192814	FBITWZAVPOTKFE-JZYAIQKZSA-N	428.302	1.540	50	20	IDGD	
COc1ccnc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)Br)c1OC	1800760256	LDUSWTXHMYWVCT-NRWUCQMLSA-N	442.310	1.085	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(N2CCCOC2=O)cc1)[C@@H](O)CCl	1800786875	YEIXOBCJOZMFRY-RANZSIQMSA-N	435.908	1.885	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cccc(C(F)(F)F)n1)C2	1800973982	JQDSNPGYPWDGBK-IFOZYUSPSA-N	449.857	1.486	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(S(C)(=O)=O)c(F)c1	1801870887	XWTVYYJQPBGULM-LOUJCGABSA-N	446.928	1.450	50	20	IDGD	
CN(CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C12CC(C1)C2)NC(=O)NCc1ccccc1	1803376898	GYVPMPDLFMPQPV-SWCZIZIJSA-N	439.560	1.771	50	20	IDGD	
O=C(/C=C/c1ccco1)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1804616860	ZUOMIGKZDCDLRN-GJOLYLAISA-N	445.284	1.387	50	20	IDGD	
O=C(Cc1ncccn1)NC[C@@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1	1804689354	ODVIILFCAWFKSI-HNAYVOBHSA-N	432.322	1.905	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC2(CCCN(C(=O)CN3CCOC3=O)C2)CC1	1805760280	RYZMIBIZCLYCIJ-CQSZACIVSA-N	430.343	1.701	50	20	IDGD	
O=C(/C=C\C(=O)N1CC[C@H](CNC(=O)CCBr)[C@H]1c1cccnc1)NC1CC1	1806344477	ZVASNPGSJNSWHD-JTTZZOPQSA-N	449.349	1.707	50	20	IDGD	
Cc1nc(C(=O)N2CCCC3(CCN(C(=O)[C@H](F)Br)CC3)C2)c(=O)[nH]c1C	1807464916	MOXXCEJCSUFGQQ-AWEZNQCLSA-N	443.317	1.922	50	20	IDGD	
CC(C)=CCCC(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1807971928	BXNMPMRSSJZWPG-OFNKIYASSA-N	435.333	1.827	50	20	IDGD	
C[C@H](Cc1ccncc1)C(=O)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1	1809980900	ZCBXSOFXGZIHIS-LJQANCHMSA-N	449.360	1.485	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)C(=O)Nc2cccnc2)[C@H]1c1cccnc1	1810466327	YNSLTASVVBWPCK-RYQLBKOJSA-N	445.907	1.375	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1cccc(F)c1	1811800263	KSESSBCITKDUOH-KNQAVFIVSA-N	447.275	1.534	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)COc2ccc(O)nn2)[C@H]1c1cccnc1	1812353325	VFBBEUNWGRQLTH-ZRGWGRIASA-N	433.896	1.679	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)CSC(=N)N)[C@H]1c1cccnc1	1812775551	ACZXHPBDZNVACL-IPYPFGDCSA-N	442.383	1.888	50	20	IDGD	
C=CCC(F)(F)C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1813074013	NSOIOBCIUALFPE-APWZRJJASA-N	437.491	1.672	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCCC[C@H]1c1cc(NC(=O)C(O)O)n[nH]1	1814712670	VLLMCCNVVJOJPF-MZTACXPWSA-N	431.399	1.598	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1ccnc(F)c1	1815418905	HNAGQTXXXDNIMJ-KRWDZBQOSA-N	437.240	1.243	50	20	IDGD	
Cc1noc(C)c1CC(=O)Nc1cc([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1	1815709877	VEBYAUXFEVEUGW-QGZVFWFLSA-N	445.524	1.622	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)CN3CCN(C)CC3)sc2C1	1818796501	RMZDZFUQKCIRKS-ZIAGYGMSSA-N	428.002	1.710	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)C3=NNC(=O)C3)sc2C1	1819672987	FOXSNXSFEAYPLA-YUMQZZPRSA-N	428.312	1.105	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CC[C@H](N)C(N)=O)[nH]n1	1820864506	BUTQAEGWWGMLFE-BFCNOCSMSA-N	433.340	1.231	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](F)Cl)CC2)c1cc(=O)nc2sccn12	1821153461	SPQZCAJQEOKYDQ-JMCQJSRRSA-N	441.897	1.973	50	20	IDGD	
O=C(CC[C@H]1CCOC1)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1823028988	WASPHTXBCDVISH-KXBFYZLASA-N	440.309	1.212	50	20	IDGD	
CC(C)=NO[C@H](C)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCC(=O)NN(C)C)CC2	1823088403	BVSPAEICWQAJRI-CHWSQXEVSA-N	438.554	1.229	50	20	IDGD	
CN(CC(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H](O)CCl)CC1)C(=O)c1ccccc1	1824381640	RDDATMFKXPKCQN-WOJBJXKFSA-N	449.979	1.978	50	20	IDGD	
O=C(COc1ccc(O)nn1)Nc1nc2c(s1)C[C@@H](NC(=O)C(Cl)Cl)CC2	1824562804	YFGBHNAAMNFTSZ-ZETCQYMHSA-N	432.289	1.433	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)CN2C(=O)CNC2=O)CC1	1824899331	REYSXCLFIIJSOO-JKSUJKDBSA-N	426.945	1.565	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CN2CC(=O)NC2=O)CC1	1824967091	LSXYLGIPTXKZDR-CVEARBPZSA-N	426.945	1.565	50	20	IDGD	
COc1cc(C(=O)N[C@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)ccn1	1826087647	HGQTXQYYZWAVEF-ZDUSSCGKSA-N	446.533	1.146	50	20	IDGD	
Cc1nc(C)c(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)o1	1827051805	GLGGKJQLXZSUPO-HXUWFJFHSA-N	439.321	1.518	50	20	IDGD	
C[C@H]1CC[C@H](C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2cccc(B(O)O)c2)CC3)CC1	1827153160	BJHVUZHBOSCZCI-CKEIUWERSA-N	441.362	1.875	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)c2ccc(O)nc2)CC1	1829723621	RUPZUTJXUBYPCJ-HXUWFJFHSA-N	437.305	1.014	50	20	IDGD	
COc1nccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)c1F	1830357523	DWPFJGKGHNRXFY-HXUWFJFHSA-N	443.903	1.564	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)C[C@H]3CCCCO3)C2)C1	1830535530	QCLSQFIETJIWFN-MDZRGWNJSA-N	447.370	1.433	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)n1ccnc1)CCO2	1830985822	RUJKACVRVKHHPN-VKJFTORMSA-N	443.342	1.074	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)C(C)=O)CCO2	1831130976	RMOKEWJFIWFYII-RDTXWAMCSA-N	433.343	1.232	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)N3C[C@H]4C[C@H]4C3)C2)C1	1831650872	LPJIOCLLHHBTGA-CURYNPBISA-N	427.973	1.191	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1	1831655853	AHHHMYWLNCIFOB-GOEBONIOSA-N	445.402	1.763	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)Cc2ccncc2)CC1	1831874431	PFAWUPRGZYWLTH-HXUWFJFHSA-N	429.565	1.617	50	20	IDGD	
N#Cc1ccccc1OCC(=O)N1CCC(N2CCC(NC(=O)[C@H](O)CCl)CC2)CC1	1833313859	WURSKUVBRZFARO-LJQANCHMSA-N	448.951	1.108	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)CCN(C)C(C)=O)CC2)CC1	1833529486	BRLRNPHPSDFUDM-IBGZPJMESA-N	429.005	1.834	50	20	IDGD	
CC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)Cc3nnc(C)s3)CC2)CC1	1836396120	VATVOOBZTYCUAY-INIZCTEOSA-N	428.002	1.978	50	20	IDGD	
Cc1cc(CC(=O)N2CCC(N3CCC(NC(=O)[C@@H](F)Br)CC3)CC2)no1	1836414641	VKKYEKXPNZYKFY-QGZVFWFLSA-N	445.333	1.788	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)CN3CCC(C)CC3)CC2)CC1	1836806046	WSXJXYCOYCMJMP-FQEVSTJZSA-N	444.016	1.971	50	20	IDGD	
C=CCSCC(=O)N1CCC(OC2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1	1837072167	BRVZSAVJOLSTIC-UHFFFAOYSA-N	440.610	1.277	50	20	IDGD	
O=C1CC[C@H](C(=O)N2CCC(OC3CCN(C(=O)CCBr)CC3)CC2)N1	1837651697	FLLFAIUAQLSTIF-OAHLLOKOSA-N	430.343	1.049	50	20	IDGD	
O=C(c1cc(Cl)cc2nn[nH]c12)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1838618635	CWBHFCOZXOGQBE-YOEHRIQHSA-N	446.266	1.216	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(C#N)c[nH]3)CCO2)C1	1838738916	GDNFPJVKDKXSTJ-MSOLQXFVSA-N	429.304	1.193	50	20	IDGD	
Cc1ccn(C)c1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1	1838821169	ARWUPFCCULDVLF-RTBURBONSA-N	432.348	1.640	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)cc1	1838966849	SXVWJFOTZWHMKD-OAQYLSRUSA-N	436.581	1.617	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(F)c3F)CCO2)C1	1839000274	XCIARHHFSRMMIM-SGTLLEGYSA-N	447.276	1.818	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)COc3cc(Cl)ccn3)C2)C1	1839145442	HXOWBRXANOZHNG-BEFAXECRSA-N	446.331	1.588	50	20	IDGD	
O=C(c1ccc(O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839201776	JCHVIULFKRGFTC-WMLDXEAASA-N	431.258	1.153	50	20	IDGD	
O=C1CCc2ccc(C(=O)N3CCO[C@@]4(COCCN(C(=O)[C@H](F)Cl)C4)C3)cc2N1	1839609168	UHXPNDLUUNSBOG-PXNSSMCTSA-N	439.871	1.176	50	20	IDGD	
C=C(C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)CBr)C2)C1)C(F)(F)F	1839891070	JWVPBXUNUNFCGL-ABAIWWIYSA-N	443.260	1.592	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccoc3C)C2)C1	1839963587	PIEUQIFWGKTDLF-CRAIPNDOSA-N	429.311	1.832	50	20	IDGD	
Cc1nc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)cs1	1840031091	FLXMJJKRXQHYOT-MEDUHNTESA-N	432.340	1.305	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)Cc1ccco1)CCO2	1840472331	BXFWXOMTXFIUAK-VCBZYWHSSA-N	443.338	1.698	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC2(CCCN2C(=O)CN2CCCC2)C1	1841090930	UPYPKAAEHLLNCZ-HNNXBMFYSA-N	428.961	1.418	50	20	IDGD	
O=C(c1cnc2ccc(Cl)cc2c1)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843014620	GZRPFIRWTHQZMH-UHFFFAOYSA-N	449.703	1.699	50	20	IDGD	
CC(C)(C)OC(=O)N1CC2(CC[C@@H](C(=O)N3CC4(CCCN4C(=O)[C@@H](F)Cl)C3)O2)C1	1843361485	KFIFKXHHKTXPCY-UONOGXRCSA-N	445.919	1.893	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2cccn3ccnc23)C1	1844082097	DPRBFIAQWPZYFD-MFKUBSTISA-N	433.472	1.285	50	20	IDGD	
CCOC(=O)N1CCC(C(=O)N2CC3(CCCN3C(=O)[C@H](F)Br)C2)CC1	1845220670	GVIYYNWSJXDDQX-ZDUSSCGKSA-N	434.306	1.749	50	20	IDGD	
C[C@@H](NC(=O)c1ccccc1)C(=O)N1CC2(CCCN2C(=O)[C@@H](F)Br)C1	1845220696	IQJKYYLOIVVZHV-TZMCWYRMSA-N	426.286	1.699	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)C2(Br)CC2)C1	1845225458	HYUKPLHJJITAIE-CIAFOILYSA-N	436.310	1.251	50	20	IDGD	
COC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)[C@H](C)Br)C1	1846176739	AEJMGPSGRCVTEW-QWHCGFSZSA-N	448.358	1.513	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H](C(=O)N2CCCC23CN(C(=O)[C@H](O)CCl)C3)C[C@H]2C[C@H]21	1847079982	VTWFTRZPIVGCKY-APIJFGDWSA-N	427.929	1.187	50	20	IDGD	
N#Cc1ccc(CCC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1	12606482	LDVQJFQIAQMFJB-UHFFFAOYSA-N	426.498	1.737	50	20	IDGD	
CCOc1ccc(N2C[C@@H](C(=O)NNC(=O)COc3ccccc3OC)CC2=O)cc1	15884721	NGOJXDQCISWIHB-HNNXBMFYSA-N	427.457	1.673	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)[C@H]1CC(=O)N(c2ccc3c(c2)OCCO3)C1	15889455	DKVOKNOXBNEXAP-ZDUSSCGKSA-N	429.404	1.176	50	20	IDGD	
O=C(CCn1c(-c2cccs2)n[nH]c1=S)NNC(=O)c1n[nH]c(=O)c2ccccc12	17195660	MUVZKWXRAQBYIT-UHFFFAOYSA-N	441.498	1.757	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)c2ccc3c(=O)n(C)c(S)nc3c2)cc1	18071807	BGZBBSTYPUTGHM-LBPRGKRZSA-N	442.497	1.849	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1ccc(C)c(C(=O)NNc2nnc(C)c(O)n2)c1	23311111	LCPWWFNWZNLUIE-UHFFFAOYSA-N	444.473	1.760	50	20	IDGD	
CC(=O)c1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)s1	28028088	JKDBRHSBDNVVJD-UHFFFAOYSA-N	437.499	1.046	50	20	IDGD	
CCC1(CC)NC(=O)N(CC(=O)NNC(=O)c2sc(-c3ccccc3)nc2C)C1=O	115095072	ITIPKPQYMSAYJH-UHFFFAOYSA-N	429.502	1.990	50	20	IDGD	
COCCCNC(=S)N(C)NC(=O)c1ccc(S(=O)(=O)N2CCCCC2)cc1	726076502	UQQLIMYDJPKSAU-UHFFFAOYSA-N	428.580	1.349	50	20	IDGD	
CCS(=O)(=O)N1CCC(C(=O)NNC(=O)[C@H](C)Oc2c(C)cc(Cl)cc2C)CC1	726199033	ZPTXIQPICDXKSG-AWEZNQCLSA-N	445.969	1.933	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NCc2ccc([C@]3(C)NC(=O)NC3=O)cc2)cc1C	726281934	GQNWIPALEXIIGM-QFIPXVFZSA-N	439.472	1.267	50	20	IDGD	
O=C(CCCc1ccccc1)NNC(=O)c1cc(S(=O)(=O)N2CCOCC2)ccc1F	727717101	UXOHQYYSIFLIJY-UHFFFAOYSA-N	449.504	1.631	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCc1ccc(OCC#N)cc1	727843184	DYPYMSQXSSVBDT-UHFFFAOYSA-N	430.490	1.335	50	20	IDGD	
COc1ccc(C(=O)NNC(=S)NCC2CCC2)cc1S(=O)(=O)N1CCCC1	727867131	QMVUVITVCDLRBW-UHFFFAOYSA-N	426.564	1.389	50	20	IDGD	
Cc1c(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)cccc1[N+](=O)[O-]	728213289	IQBRJWFAHHFULW-UHFFFAOYSA-N	433.490	1.596	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)Nc2cccc(C(=O)NCCC(N)=O)c2)c1C	728491783	BCNXMUUWCBYADH-XDHOZWIPSA-N	437.500	1.902	50	20	IDGD	
CC[C@@H](NC(=O)NNC(=O)c1cc(Br)c[nH]1)c1cccc(S(N)(=O)=O)c1	729221522	RWXWFJONWXTFTJ-GFCCVEGCSA-N	444.311	1.520	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)[C@H]2CSCN2C(=O)c2ccc(Cl)cc2)cc1	729297839	IKLHEFOXBLTKPS-QGZVFWFLSA-N	444.900	1.953	50	20	IDGD	
CCCCCn1nc(C(=O)NNS(=O)(=O)c2c(C)nn(C)c2C)c2ccccc2c1=O	731052673	GAPPYVKNJPTWAH-UHFFFAOYSA-N	446.533	1.560	50	20	IDGD	
Cc1c(C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)nnn1-c1cccc2ncccc12	731327220	RJVQLVYDFKOPNQ-IBGZPJMESA-N	430.424	1.725	50	20	IDGD	
CCCC[C@@H](/N=C1/NS(=O)(=O)c2ccccc21)C(=O)NNC(=O)c1ccccc1OC	731493975	FKCOFMNJUQBZEM-MRXNPFEDSA-N	444.513	1.754	50	20	IDGD	
COc1cccc(CC(=O)N2CCN(C(=O)NNC(=O)c3ccccc3OC)CC2)c1	731500854	RHLUACXNQLDOQJ-UHFFFAOYSA-N	426.473	1.445	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@H]2CC(c3cc(F)ccc3F)=NO2)c2ccccc2c1=O	732653740	GWHYQSOQMWDRAL-QGZVFWFLSA-N	441.394	1.649	50	20	IDGD	
COc1cccc(/C=C(/C(=O)NNc2nc3ccccc3c(=O)n2C)n2nnnc2C)c1	733264130	XRIDVBOEBGEEAR-PDGQHHTCSA-N	432.444	1.378	50	20	IDGD	
Cn1c(NNC(=O)CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])nc2ccccc2c1=O	733365975	WDCNDPAYLHAAPP-UHFFFAOYSA-N	430.808	1.368	50	20	IDGD	
C[C@@]1(CNC(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)CCOC1	733653004	BGTHLUPGBHJMGW-QHCPKHFHSA-N	435.484	1.815	50	20	IDGD	
Cc1nc(S(=O)(=O)N2CCC(C(=O)NNc3cnnc4ccccc34)CC2)cn1C	733809022	SGTANKLEFKUKOA-UHFFFAOYSA-N	429.506	1.216	50	20	IDGD	
COCCN1C(=O)c2ccc(C(=O)NNc3nccc4sccc34)cc2S1(=O)=O	734248211	HRKLYSZXOUCLGE-UHFFFAOYSA-N	432.483	1.844	50	20	IDGD	
CC(C)CN1C[C@@H](C(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)CC1=O	734820947	BHIULAHUISYRQU-AWEZNQCLSA-N	425.530	1.221	50	20	IDGD	
COC(=O)[C@@H](NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)c1cccc(Cl)c1	735507637	NCONHESPQZBNSP-INIZCTEOSA-N	425.894	1.739	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@@H](Cc2ccccc2)n2nnnc2C)cc(OC)c1OC	735629882	CFEGPXKKBBRYOL-MRXNPFEDSA-N	440.460	1.252	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)CCn2cnc3ccccc3c2=O)cc1C	736754430	NFIMNSDGSBUKHU-UHFFFAOYSA-N	442.497	1.723	50	20	IDGD	
CCCc1c(C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)nnn1-c1ccc(C(C)(C)C)cc1	741521518	LCJGJKQKTCVBSV-AWEZNQCLSA-N	447.561	1.713	50	20	IDGD	
Cc1ccc(CN2C[C@H](C(=O)OCC(=O)NNC(=O)c3cccc(C#N)c3)CC2=O)cc1	741832040	OXLVXQDVXJJQAI-LJQANCHMSA-N	434.452	1.220	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)Nc2ncn(CC(=O)N(C)C)n2)c(C)n1C[C@H]1CCCO1	741971888	XDKQDCASEMIKKQ-JIARHERNSA-N	425.493	1.509	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N[C@@H]2CC(=O)N([C@@H]3C[C@@H]3c3ccccc3)C2)cc1OC	743521334	PRAXUQVHOCWDSA-KZNAEPCWSA-N	438.484	1.805	50	20	IDGD	
O=C(NC[C@@H]1CCS(=O)(=O)C1)NNC(=O)Nc1ccc(Br)cc1Cl	743530647	OLJHQDWFZZGEGF-QMMMGPOBSA-N	439.719	1.873	50	20	IDGD	
CN(C)C(=O)CS(=O)(=O)c1ccc(C(=O)NNC(=O)Nc2ccc(N(C)C)cc2)cc1	743827249	AOYRGYLTQJOLGY-UHFFFAOYSA-N	447.517	1.081	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)CNC(=O)Cc2cccc3ccccc23)c1	744506005	SCSIPFOIKBBQTH-UHFFFAOYSA-N	433.464	1.811	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)c2cccc(S(=O)(=O)CC(F)F)c2)c1	744996673	OMERZLHHUOMCPE-UHFFFAOYSA-N	440.424	1.652	50	20	IDGD	
O=C(COC(=O)c1ccnc(OCC(F)(F)F)c1)NNC(=O)c1cccc([N+](=O)[O-])c1	745113252	GJOMMIPQMGMSHW-UHFFFAOYSA-N	442.306	1.549	50	20	IDGD	
O=C(NNC(=O)c1ccc2ncccc2c1)c1cccc(S(=O)(=O)N2CCOCC2)c1	745477563	YQGFTGMGBZCRJQ-UHFFFAOYSA-N	440.481	1.331	50	20	IDGD	
COc1cc(/C=C/C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)cc(OC)c1O	745511728	KILFVIVWHNCOKN-VMPITWQZSA-N	425.397	1.299	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NC[C@@H](C)Oc2cccc(C)c2)cc1	745875572	HOCSJFCZQDOCNF-QGZVFWFLSA-N	448.545	1.722	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1noc(-c2cccc(F)c2)n1	746332941	UFAUHOFADPMFAD-UHFFFAOYSA-N	447.448	1.654	50	20	IDGD	
O=C(CCOc1ccccc1)NNC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccccc1	747179409	UAULWFCEPWQCRO-LJQANCHMSA-N	431.514	1.846	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNS(=O)(=O)c2ccc3c(c2)n(C)c(=O)n3C)cc1	747692460	NSRPEVFVCJZSGR-CYBMUJFWSA-N	448.501	1.053	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1ccc(C(=O)c2cc[nH]c2)cc1	748688871	CTECENGCZKBEFP-UHFFFAOYSA-N	439.497	1.922	50	20	IDGD	
CC(C)CCn1nc(C(=O)NNS(=O)(=O)c2cnc(C(C)C)[nH]2)c2ccccc2c1=O	748790789	MKEJNGBYUVSZIS-UHFFFAOYSA-N	446.533	1.912	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)NCCn2ccnc2C)c2ccccc2c1=O	749216831	ZDCYWCLEIPDIOO-UHFFFAOYSA-N	425.493	1.736	50	20	IDGD	
NC(=O)c1cccc(OCCC(=O)NNC(=O)COc2ccc(Br)cc2)c1	751296900	DYALNHGBXDJJLK-UHFFFAOYSA-N	436.262	1.543	50	20	IDGD	
O=C(CCc1ccc(F)cc1F)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	752127152	IXWBPEYLTDOGRF-UHFFFAOYSA-N	430.455	1.503	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)[C@H](C)c1ccc(S(C)(=O)=O)cc1	753276634	PIYVCIGNLLLHEQ-CQSZACIVSA-N	428.514	1.953	50	20	IDGD	
Cc1cc(C(=O)NNc2cc(C(F)(F)F)ccc2F)nc2c1c(=O)n(C)c(=O)n2C	754147727	CIYXMQCWIWCTGK-UHFFFAOYSA-N	425.342	1.855	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)Cc2ccc(I)cc2)C[C@H](C)O1	754174817	XZIHKXZUQNUEHJ-STQMWFEESA-N	445.301	1.480	50	20	IDGD	
O=C(NNC(=O)c1ccccc1O)Nc1ccc2c(ccn2CC(=O)N2CCOCC2)c1	756294895	UYLYDFRKSVVONJ-UHFFFAOYSA-N	437.456	1.672	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2cccc([S@](C)=O)c2)cc1	756527458	SHYYTAITLVRGTK-NDEPHWFRSA-N	438.531	1.206	50	20	IDGD	
O=C(CSc1ccc(Cl)cc1)NNC(=O)Nc1cnn(CCN2CCOCC2)c1	756827233	QUABTONZYOHVJS-UHFFFAOYSA-N	438.941	1.814	50	20	IDGD	
COc1cc([N+](=O)[O-])ccc1C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	756874384	BXGNRNGGQPBJGG-UHFFFAOYSA-N	449.489	1.296	50	20	IDGD	
COc1ncnc(N(C)C)c1NC(=O)NNC(=O)COc1cccc(C(F)(F)F)c1	757709177	NRJMOKRHJLSWOU-UHFFFAOYSA-N	428.371	1.802	50	20	IDGD	
O=C(c1cccc(Br)n1)N1CCN(S(=O)(=O)CBr)CC1	758512641	OIRKRWDBMMHUEK-UHFFFAOYSA-N	427.118	1.284	50	20	IDGD	
CN(NC(=O)[C@H]1CC(=O)N(C2CCCC2)C1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758786470	MTDMPOHFMVGFEC-HNNXBMFYSA-N	437.541	1.413	50	20	IDGD	
C[C@H](NC(=O)OC(C)(C)C)[C@@H]1CCCN(CC(=O)NNC(=O)c2ccc(C#N)cc2)C1	758797556	IJAHZOIJYBKXSQ-MAUKXSAKSA-N	429.521	1.944	50	20	IDGD	
Cc1onc(-c2ccncc2)c1C(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	759571505	OTEQQOLSKWJJJH-UHFFFAOYSA-N	425.357	1.571	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)N[C@@H]1CCC[C@H]2OCC[C@@H]12	761796578	YJXXQEYMAUDMMV-RCCFBDPRSA-N	436.534	1.373	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H]2COc3ccc(Cl)cc32)c1	762359191	UIAVHHBDEDEFSJ-OAHLLOKOSA-N	438.893	1.668	50	20	IDGD	
CC(=O)N1CCc2ccc(S(=O)(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)cc21	763439985	ZOZJDGMUXSUGJF-UHFFFAOYSA-N	440.522	1.210	50	20	IDGD	
COC(=O)c1ccc(OCc2ccccc2)c(NC(=O)C(=O)NNC(=O)c2ccncc2)c1	763462111	JWTGSJLLYQTBAK-UHFFFAOYSA-N	448.435	1.847	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2F)c(C)c1S(=O)(=O)NC1CC1	763555514	HFFSOGWWIRWBHC-UHFFFAOYSA-N	448.476	1.283	50	20	IDGD	
O=C(NNC(=O)c1ccccc1F)C(=O)Nc1ccc(F)cc1I	763567797	DUABMITVPAXLKW-UHFFFAOYSA-N	445.163	1.969	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2cc(S(C)(=O)=O)ccc2C)c1	763669640	XUHGQCQWLQLHHS-UHFFFAOYSA-N	433.486	1.180	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2F)cc1Cl	763681841	RAQFRKZRMGFQTE-UHFFFAOYSA-N	439.827	1.669	50	20	IDGD	
Cc1nc(COc2ccc(F)cc2)sc1C(=O)NNC(=O)CNC(=O)c1cccnc1	763815584	YLCGGQRTASEZEJ-UHFFFAOYSA-N	443.460	1.756	50	20	IDGD	
CCOC(=O)/C=C\c1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)cc1	763872872	PODNBRHFKQBBMZ-CNTYAEFGSA-N	443.431	1.955	50	20	IDGD	
COC(=O)c1cc(F)c(F)cc1NC(=O)C(=O)NNC(=O)CSc1ccc(C)cc1	763898163	MHHISVHYABCDTK-UHFFFAOYSA-N	437.424	1.938	50	20	IDGD	
CCn1nnnc1-c1cccc(NC(=O)C(=O)NNC(=O)Cc2ccc(Cl)cc2)c1	763936388	IUESAWQAAQVLNV-UHFFFAOYSA-N	427.852	1.342	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)on1)C(=O)Nc1ccccc1N1CCOC1=O	764003812	OVBGAZXDABQPCM-UHFFFAOYSA-N	435.396	1.698	50	20	IDGD	
COC(=O)CSCc1cccc(NC(=O)C(=O)NNC(=O)c2cccc(OC)c2O)c1	764133976	ZLPPVNUCXXOJOF-UHFFFAOYSA-N	447.469	1.207	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)CCc2ccccc2O)cc1Cl	764281191	LWUQBPJSDAWDAF-UHFFFAOYSA-N	435.864	1.790	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)C(=O)N1C[C@@H](CC(=O)N(C)C)c2cc(Cl)ccc21	764388909	KUOUWJQXIQMCKB-CYBMUJFWSA-N	443.891	1.413	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1F)C(=O)Nc1ccc(CN2CCOC2=O)cc1	764410643	LFYFGISFPKULNI-UHFFFAOYSA-N	434.811	1.831	50	20	IDGD	
CCOc1ccc(Oc2ccc(NC(=O)C(=O)NNC(=O)[C@H]3COCCO3)cc2)cc1	764433328	MKIILFCRELUQBF-GOSISDBHSA-N	429.429	1.379	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)N[C@@H]1CCN(c2ccc(Cl)c(F)c2)C1=O	764517001	ZYIJDVUPCVNWSX-CQSZACIVSA-N	436.827	1.699	50	20	IDGD	
COc1cccc(-c2cc(C(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)n[nH]2)c1	764528206	OZOWHLNPGPQQKM-UHFFFAOYSA-N	443.485	1.410	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cc(-c4ccncc4)on3)CC2)cc1	765748157	JQVLDCJIBKWZMJ-UHFFFAOYSA-N	434.500	1.624	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)c1ccccc1[N+](=O)[O-]	765750650	CIKMPIXZGGCBBZ-UHFFFAOYSA-N	431.880	1.827	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1ccc(C(=O)NCc2ccccc2F)cc1	766264031	DEFVASDPYRVANO-UHFFFAOYSA-N	438.419	1.636	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)CCC(=O)Nc1ccc2nc(O)[nH]c2n1	767162303	XLTUXHNRDWCPQM-JTQLQIEISA-N	430.396	1.136	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)c1cc(N2CCOC2=O)ccc1F	767343142	DELYZTOWWBHXAY-UHFFFAOYSA-N	429.404	1.638	50	20	IDGD	
CN1CCN(C(=O)CN2CCC(N(C)C(=O)[C@@H](Br)C(C)(C)C)CC2)CC1	767978441	DKEWRRKZZOYMPB-QGZVFWFLSA-N	431.419	1.493	50	20	IDGD	
O=C(NNC(=O)c1cc(N2CCNC2=O)ccc1F)c1cc(-c2ccc(F)cc2)[nH]n1	768288949	JVJXUNMCSLLAJX-UHFFFAOYSA-N	426.383	1.959	50	20	IDGD	
Cc1cn(-c2ccccc2)nc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	770211527	FPYQQOUNLOWWCK-UHFFFAOYSA-N	427.486	1.506	50	20	IDGD	
CCC1CCC2(CC1)NC(=O)N(CC(=O)NNC(=O)c1ccc3c(c1)OCCO3)C2=O	770392011	PZRXOVMWWWBCMR-UHFFFAOYSA-N	430.461	1.110	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)COc1ccccc1Cc1ccccc1)[C@H]1CN(C)CCO1	770434924	IQPZBJGRFCISFU-LAUBAEHRSA-N	426.517	1.706	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@H]2CC(=O)N(c3c(F)cccc3F)C2)cc(OC)c1OC	770573044	OMAGQAPTCHRWFY-LBPRGKRZSA-N	449.410	1.805	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)c3cccc(NC(=O)[C@@H]4Cc5ccccc5O4)c3)nc21	770988741	ANSSTRMYTGQCKC-KRWDZBQOSA-N	445.439	1.768	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)C[C@@H]1CSCCN1C(=O)OC(C)(C)C	772207096	LZNBHTHVJOWCDM-UONOGXRCSA-N	431.555	1.854	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccn(CC(F)(F)F)n1	774006189	BYCKJBWRYHYPIE-SECBINFHSA-N	433.774	1.652	50	20	IDGD	
CNC(=O)c1ccc(C)c(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)c1	774010196	VTPNEWBWOQRSHJ-GFCCVEGCSA-N	432.864	1.561	50	20	IDGD	
Cn1cc([C@@H](NCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c2ccc(F)cc2)cn1	774352897	QVMJMIKCIQMDQO-IBGZPJMESA-N	426.408	1.608	50	20	IDGD	
C[C@@H](NCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)c1ccc(N2CCOCC2)cc1	775259291	REHQIGHVZCNAQQ-OAHLLOKOSA-N	427.461	1.543	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NC[C@@H]2COC3(CCCCCC3)O2)cc1	776954553	LPVQJECKBQOUKP-OAHLLOKOSA-N	440.522	1.892	50	20	IDGD	
O=C(NNC(=O)[C@H](F)Cc1ccccc1)c1cccc(S(=O)(=O)N2CCOCC2)c1	777880663	HAGUGBUMCPIEEX-GOSISDBHSA-N	435.477	1.049	50	20	IDGD	
CC(C)(C)Oc1ccc(CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)cn1	778589221	PTHZLGYFOJGMMS-UHFFFAOYSA-N	434.522	1.696	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)cc1C	778898614	DNLBMAUQRYBOOM-UHFFFAOYSA-N	435.414	1.874	50	20	IDGD	
O=C(NNc1ccccc1OC(F)(F)F)C1=NN([C@@H]2CCS(=O)(=O)C2)C(=O)CC1	779208691	DIYHUBPMXBRZSR-SNVBAGLBSA-N	434.396	1.194	50	20	IDGD	
O=C(NNc1ccnc(F)c1)C1CCN(S(=O)(=O)c2ccc3c(c2)OCCO3)CC1	781365201	BZNMPWHVSBCIFV-UHFFFAOYSA-N	436.465	1.536	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@@H](C)C#N)c1	781948586	BRKWZBQZMLAQKO-ZDUSSCGKSA-N	431.474	1.600	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)C(=O)NNc1ccc(F)cc1C	783449280	HZYSXHMHXRBACH-UHFFFAOYSA-N	438.481	1.865	50	20	IDGD	
CC(C)(C)OC(=O)N1CCc2[nH]nc(C(=O)NNc3nc(-c4ccncc4)no3)c2C1	783595659	FJBSKAAFRODCNJ-UHFFFAOYSA-N	426.437	1.905	50	20	IDGD	
COC(=O)Nc1cccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)c1	784210654	YXDLXHJQCHMCOW-UHFFFAOYSA-N	447.473	1.387	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)[C@@H]1CC=CC[C@@H]1C(=O)N1CCOCC1	784395083	XIZOZBXTCGSXCP-MOPGFXCFSA-N	448.545	1.012	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)Nc1nc(-c2ccccc2)cs1	785022989	FOOQIOXVARAXEX-UHFFFAOYSA-N	427.398	1.824	50	20	IDGD	
CSc1nnnn1-c1cccc(NC(=O)C(=O)NNc2nc(C(F)(F)F)cs2)c1	785147244	BUYHNFHSAUKVGJ-UHFFFAOYSA-N	444.424	1.941	50	20	IDGD	
Cc1ccc(N2CCNC2=O)cc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccccc2)[nH]n1	787540587	AUMFQRNFIBLAIG-UHFFFAOYSA-N	447.455	1.314	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)CC(=O)N3C)cc1OC	789741423	SYBPGSUKSCGQBS-UHFFFAOYSA-N	440.456	1.403	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Cn2c(CS(C)(=O)=O)nc3ccccc32)cc1OC	790083200	RDPAFYKRAQXRHR-UHFFFAOYSA-N	446.485	1.059	50	20	IDGD	
CCS(=O)(=O)c1ccc([C@@H](C)NC(=O)NNC(=O)CNC(=O)c2cccs2)cc1	790691164	IFCHQNGWZWTAHE-GFCCVEGCSA-N	438.531	1.363	50	20	IDGD	
COCC(=O)NNC(=O)C(=O)Nc1ccc(C)c(Oc2ncccc2Br)c1	790952671	PRYMIYLXDBPKKM-UHFFFAOYSA-N	437.250	1.677	50	20	IDGD	
COc1cccc(NNC(=O)[C@H]2[C@@H](C)CC(=O)C[C@H]2C(=O)NNc2cccc(OC)n2)n1	791141832	XHNYWNVSHLFBKG-CFZJUORYSA-N	442.476	1.312	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)CCN2CCN(C(=O)OC(C)(C)C)CC2)c1	792014500	IYTCOEYRYRNFDF-UHFFFAOYSA-N	434.537	1.772	50	20	IDGD	
CC(C)(C)c1cc(NC(=O)C(=O)NNC(=O)Cc2ccccn2)n(-c2ccc(C#N)cc2)n1	793027148	VUMFKWRPIOAAMB-UHFFFAOYSA-N	445.483	1.765	50	20	IDGD	
CC(C)(C)OC(=O)N1CCOC[C@@H]1CC(=O)NNC(=O)c1cc(-c2ccccc2)[nH]n1	794762351	LFLWICVSKOYXFW-HNNXBMFYSA-N	429.477	1.864	50	20	IDGD	
CCOc1cc(N2CCN(CC(=O)NNC(=O)c3ccccc3)CC2)ccc1[N+](=O)[O-]	796462627	BQUHSOQDCOKQRH-UHFFFAOYSA-N	427.461	1.577	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1cc(=O)c2ccc(F)cc2o1	796842475	ZWNAMGLRQFQOCY-UHFFFAOYSA-N	447.444	1.710	50	20	IDGD	
CC(C)Oc1c(N)cccc1C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	798702316	USNWZFFFFFANQU-KRWDZBQOSA-N	429.429	1.200	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1ccncc1C(F)(F)F	800693412	PSUQWUQUPCETEO-UHFFFAOYSA-N	435.406	1.319	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)c2nn(-c3ccc(F)cc3F)cc2O)cc1	801415138	XVAKFRRVRCEASI-UHFFFAOYSA-N	441.350	1.346	50	20	IDGD	
Cc1c(NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)nnn1Cc1ccccc1F	801804968	RHXFGFAYCBRZDL-UHFFFAOYSA-N	446.464	1.644	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)CN2C(=O)[C@@H]3[C@@H](C2=O)[C@H]2C=C[C@H]3C2)cc1Cl	802077626	WVFAJHWNOKZRAC-QEWLZKHVSA-N	448.863	1.317	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)Cc3cncn3C)c2)c(C)c1	806331410	LMTIRIBUJZZWNR-UHFFFAOYSA-N	441.513	1.841	50	20	IDGD	
CNS(=O)(=O)c1cc(NC(=O)NNC(=O)c2ccc(OC)c(OC)c2)ccc1F	806545369	UBZQAWMOJJUWAQ-UHFFFAOYSA-N	426.426	1.218	50	20	IDGD	
Cc1cc(=O)c(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)cn1C1CC1	806974130	WFHIDIRKGZOQSW-UHFFFAOYSA-N	432.502	1.269	50	20	IDGD	
CN1CCC(Oc2ccc(CNC(=O)NNC(=O)c3cc([N+](=O)[O-])ccc3O)cc2)CC1	807256631	YNQJRYXXEQAWPP-UHFFFAOYSA-N	443.460	1.918	50	20	IDGD	
COC(=O)c1cc(Br)c(F)cc1NC(=O)C(=O)NNc1cccc(F)n1	807392391	NHFSLQPFLRBLDW-UHFFFAOYSA-N	429.177	1.991	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@H]2C[C@@H](c3ccccc3)OC2=O)cc1	809557824	HOSQFLQECQJYOV-MSOLQXFVSA-N	445.497	1.067	50	20	IDGD	
COC(=O)c1cc(C=NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)on1	814709875	HYQHNLMSMIVTMP-UHFFFAOYSA-N	442.453	1.704	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)c1cc(S(=O)(=O)N(C)C)ccc1Cl	825615120	IZFNNORZGOYARM-UHFFFAOYSA-N	440.909	1.472	50	20	IDGD	
CC(=O)Nc1cccc([C@@H](C)NC(=O)NNC(=O)c2csc(N3CCOCC3)n2)c1	913628101	VSPZDUGHKVPUAS-GFCCVEGCSA-N	432.506	1.643	50	20	IDGD	
COc1ccc([C@H](CNC(=O)NNC(=O)COc2ccccc2C#N)N(C)C)cc1OC	915897599	HRHKJURDJGOAPC-KRWDZBQOSA-N	441.488	1.588	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)C2CCN(CC(F)(F)F)CC2)c2ccccc2c1=O	916124966	AIBLROQYXIAWQM-UHFFFAOYSA-N	439.438	1.842	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)Cc2ccc(-n3cccn3)cc2)ccc1Cl	916133271	BPLVUVCFKPSJPC-UHFFFAOYSA-N	433.877	1.177	50	20	IDGD	
COc1ccccc1[C@@H](NC(=O)NNC(=O)c1ccc2c(c1)OCCO2)c1nccn1C	916227087	MJCUJMPEUAWQKD-LJQANCHMSA-N	437.456	1.934	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)Nc2ccc(F)c(C(N)=O)c2)c2ccccc2c1=O	916376341	KBUPWZYAUFWHFN-UHFFFAOYSA-N	440.435	1.901	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)NCc1ccnc(N2CCN(C)CC2)c1	916390421	PNLQOXRHRDUGNM-UHFFFAOYSA-N	442.520	1.142	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NC2CCC3(CC2)OCCO3)nc1	916412471	HCCNSSSVBSJKBX-UHFFFAOYSA-N	427.527	1.424	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)NC[C@H](c1ccccc1)N1CCOCC1	916509410	NYWQWJQLQXTCDS-LJQANCHMSA-N	442.516	1.868	50	20	IDGD	
O=C(CN1CCN(C(=O)CCC2CCCCC2)CC1)NNC(=O)c1cccc([N+](=O)[O-])c1	917406374	ZTOXNHWLLDMXIG-UHFFFAOYSA-N	445.520	1.861	50	20	IDGD	
CCN(CCCNC(=O)NNC(=O)[C@H](C)Oc1ccc2ccccc2c1)S(C)(=O)=O	918119128	MHLXOSNDSFYBTD-HNNXBMFYSA-N	436.534	1.609	50	20	IDGD	
COc1cc(CNC(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)ccc1OCCO	918229072	WIVBUVYYPIEPEY-MRXNPFEDSA-N	431.489	1.981	50	20	IDGD	
CCCS(=O)(=O)N1CCC(NC(=O)/C(C#N)=C\c2cc(C)n(CCOC)c2C)CC1	918573799	OPAXZQBQNFBERK-RGEXLXHISA-N	436.578	1.979	50	20	IDGD	
O=C(NNC(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1)N[C@@H]1CCS(=O)(=O)C1	919889630	QGIOEXIUTSACJF-CQSZACIVSA-N	433.446	1.470	50	20	IDGD	
CC(=NNC(=O)N[C@H]1CCS(=O)(=O)C1)c1ccc(OCC(=O)N2CCCCC2)cc1	920383506	FPBMUQPDIXKTCL-KRWDZBQOSA-N	436.534	1.288	50	20	IDGD	
C[C@@H]1CN(S(=O)(=O)c2cccc(C(=O)NNC(=O)NCc3ccco3)c2)C[C@@H](C)O1	920857403	HVOLUGRDUCEJRZ-ZIAGYGMSSA-N	436.490	1.222	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc2ccccc2c1)NNC(=O)c1n[nH]c2c1CCCC2	1317737445	XIRYSVNPKUECRQ-UHFFFAOYSA-N	427.486	1.181	50	20	IDGD	
C[C@@H](OC1CCCCC1)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	1318546360	MVIOBASJIIMILW-OAHLLOKOSA-N	439.534	1.206	50	20	IDGD	
O=C(COC(=O)C1(Sc2ccccc2)CC1)NNC(=O)[C@H]1COc2ccccc2O1	1319639117	MIWKYFJOACVDAU-QGZVFWFLSA-N	428.466	1.842	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)ccc1N1CCCC1=O	1321011678	VHTVXTRAFHYYTO-UHFFFAOYSA-N	434.456	1.835	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccccc1S(=O)(=O)N1CCCC1)c1ccccc1Cl	1338303101	VWLVRHMPDQAZLD-UHFFFAOYSA-N	443.934	1.748	50	20	IDGD	
Cc1cn2c(=O)c(C(=O)N3CC[C@@]4(C3)CN(C(=O)[C@H](F)Cl)CCO4)cnc2s1	1777991619	WMDJGWHZFQVYPS-YVEFUNNKSA-N	428.873	1.042	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)c3ccccc3Cl)CCO2)C1	1779032623	OYZIIGOYVQSINH-NRFANRHFSA-N	443.891	1.096	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(Cl)nc(OC)c3)C2)C1	1779794468	LQAQNCIVJVYNSN-ACJLOTCBSA-N	432.304	1.441	50	20	IDGD	
CC[S@@](=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@](C)(Cl)CCl)C1	1780711799	DEERLKTWTWEOFU-RYTKRTQFSA-N	441.421	1.895	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](F)Br)C2)c(O)n1	1780774002	RKKRDQXHYPGMFY-QWQRMKEZSA-N	444.301	1.914	50	20	IDGD	
CC1=NN(c2ccc(C(=O)N3CC[C@]4(C3)CN(C(=O)[C@@H](F)Cl)CCO4)cc2)C(=O)C1	1780795797	JGQWOOLROLQLPP-XLIONFOSSA-N	436.871	1.777	50	20	IDGD	
CC(=O)O[C@@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)Br)C1)C(C)C	1781997806	JEWCGUZUZYQCBZ-GKDNMFGBSA-N	447.370	1.871	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)Cc1ccccc1)C2)C(Cl)Cl	1782221496	WTBBNCBWJNYFKH-RZQQEMMASA-N	429.344	1.908	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)Cc3cccc4ncccc34)CCO2)C1	1783871803	VWFDQRQRNPNAMN-PGRDOPGGSA-N	431.920	1.861	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(F)c(F)c3OC)CCO2)C1	1783879887	BIVVSZCQRGLDNQ-DJJJIMSYSA-N	432.851	1.671	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cc(Cl)c(O)cc3O)CCO2)C1	1783880323	HCMJBAJKWCQZBI-SCLBCKFNSA-N	433.288	1.449	50	20	IDGD	
C[C@H](Sc1ccccc1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]2C1	1784083957	IHFRKFSNSSXETH-XWJBARJFSA-N	426.966	1.747	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)c3ccccc3)[C@H]2C1	1784908227	USBMRCMYCKKYKY-NTLWEQJWSA-N	434.512	1.050	50	20	IDGD	
CN(C)C(=O)c1cccc(C(=O)N2CC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)c1	1785286131	WNBLLFUEQIGEAL-IBGZPJMESA-N	428.316	1.636	50	20	IDGD	
Cc1ccc2nc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)[C@H](O)CCl)C[C@@H]43)sc2c1	1786262003	OHRQMXZYZMSEBB-UGQVUOCMSA-N	437.949	1.798	50	20	IDGD	
Cc1nc(N)sc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21	1786915254	UWODOAISGAPYPM-SRVKXCTJSA-N	431.356	1.412	50	20	IDGD	
O=C(Cn1cc(Cl)cn1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21	1787003356	NXEFGRWQWGXOSG-HVTMNAMFSA-N	437.697	1.207	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)c1cn2ncccc2n1	1788015459	MKEZPBXOIKOVFH-YDHLFZDLSA-N	436.310	1.108	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]2C1	1789921238	DDRTWWFMHZVIRM-HTFCKZLJSA-N	444.139	1.688	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C/N=C/c3ccco3)C[C@@H]21)[C@H](F)Br	1789926349	UFLQNWZHQKMEME-NNPXLFLASA-N	430.274	1.369	50	20	IDGD	
COc1cc(C(=O)Nc2ccc(C3(NC(=O)CCC(=O)NN(C)C)CCC3)cc2)nn1C	1790197086	XDNVHEJDKDWLPQ-UHFFFAOYSA-N	442.520	1.549	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](Cl)COC)C[C@@H]21	1790963561	IJFZJUPXZGWDID-YHQUGGNUSA-N	425.751	1.393	50	20	IDGD	
C[C@H](O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](Br)Cc3ccccc3)C[C@@H]21	1791053855	UWSTVIHTIHMTRD-FUJDEKNSSA-N	439.350	1.353	50	20	IDGD	
Cc1noc(C)c1CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)Br)[C@H]2C1	1791055236	PHRACYJGUWOFHR-NZBMOFRJSA-N	428.327	1.597	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnnc4ccccc34)C[C@@H]21	1791255008	YXSKXTBIPMEXQA-KUZCPNRJSA-N	432.908	1.477	50	20	IDGD	
CCC(=O)N[C@H](C)C(=O)NC1(c2ccc(NC(=O)CCC(=O)NN(C)C)cc2)CCC1	1791599549	LJGXMHMIRSKCGY-OAHLLOKOSA-N	431.537	1.408	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCl)c1ccc(-c2ccc(O)nn2)cc1	1793114539	HUOSYGPXWKRQBK-KYHPRHEASA-N	430.892	1.701	50	20	IDGD	
CC(C)N1CCC(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)Br)C3)CC1	1793800041	KDEBCSCLCCQYEY-LLLHUVSDSA-N	430.387	1.480	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cccc(Cl)n1	1794193809	JDQJJUSQUZICDU-KOFHJDLBSA-N	444.757	1.898	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)n1cccc1C=O	1795752600	SJGMSYCPWZGJCH-QZLJAVCYSA-N	440.338	1.625	50	20	IDGD	
C[C@@H](Sc1cccs1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1	1796188791	RFKLXAXNDUQVQF-NKGKWGDASA-N	444.387	1.861	50	20	IDGD	
C[C@H](Sc1ccccc1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1	1796190079	UNULQGPCPHLVIG-QLIIJSOBSA-N	438.358	1.799	50	20	IDGD	
C=C[C@@H](O)C(C)(C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C(C)=N/NC(=O)c1ccc[nH]1	1796891635	BWPDMHMNRYNVPI-JTLQTOQASA-N	429.521	1.332	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnc(Cl)c(Cl)c1)c1cccc(B(O)O)c1	1798759647	ZSPQCRDGHVSPEH-MUJYYYPQSA-N	448.115	1.634	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(OC)cc1O	1798835401	DRJRDASORYRDGD-DJZPMSPPSA-N	441.322	1.778	50	20	IDGD	
CC(C)N1CCC(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@](C)(Cl)CCl)CC1	1799273984	OBCJTZYXCZHMKV-AXVVYFOYSA-N	434.408	1.933	50	20	IDGD	
C[C@@H](Nc1ccccn1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@](C)(Cl)CCl	1799275684	AFTAEBMWXKNDTR-HUYPOWGKSA-N	429.348	1.708	50	20	IDGD	
C[C@H](Oc1ccccn1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Br	1799351914	GBDCAFPMHGMYIC-ZZVJUGKHSA-N	430.274	1.129	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)C(C)(C)CCl)C3)cc1O	1799847016	MLRNWLBELPXKFD-JLVBRIDZSA-N	437.924	1.819	50	20	IDGD	
COCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C#N)=C/c1ccc(Br)cc1	1800333620	BWBARVQJHQCGFY-SQABCVSLSA-N	448.317	1.592	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)N1C[C@H]3C[C@@H]3C1)C2	1800641984	PIHFAEHZYRDNPK-YDLMYCGBSA-N	428.371	1.090	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1cccc([N+](=O)[O-])c1)C2	1800970800	KAYXWCMSFKVVQT-HIRMHNASSA-N	439.896	1.371	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cc3ccccn3n2)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803140126	YHKCJEOKFIHHMY-ZYSHUDEJSA-N	427.892	1.649	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2n[nH]c3ccccc23)[C@H]1c1cccnc1)[C@H](O)CCl	1803143027	RDVLQJWKJFBECT-YJLNNSPDSA-N	427.892	1.877	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)Cc2cc(C)n(C)n2)[C@@H]1c1cccnc1	1803293106	UCSGSVZEIWCEGO-KPFFTGBYSA-N	433.940	1.626	50	20	IDGD	
COc1ncc(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)cc1C	1806097089	NXFVMQDGYNBIEM-RYQLBKOJSA-N	432.908	1.713	50	20	IDGD	
O=C(CCBr)NC[C@@H]1CCN(C(=O)c2ccc(O)nn2)[C@@H]1c1cccnc1	1806339196	JPUDPUBNHLKORC-SUMWQHHRSA-N	434.294	1.682	50	20	IDGD	
CN[C@H](CC(=O)NC[C@@H]1CCN(C(=O)CO[Si](C)(C)C)[C@H]1c1cccnc1)C(=O)O	1807204647	NMHQHZAODIJORL-FCEWJHQRSA-N	436.585	1.002	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CCC(F)(F)F)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807362740	ITLFKUGFHGUWRI-LPHOPBHVSA-N	449.238	1.424	50	20	IDGD	
O=C(CCc1ccc[nH]1)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1807458833	CFVSGQIFHXJOBE-AUSIDOKSSA-N	446.316	1.042	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CN2CCCC2)[C@H]1c1cccnc1)[C@H](F)Br	1808648996	HDAIKOAOZILBAN-XIRDDKMYSA-N	427.318	1.874	50	20	IDGD	
Cc1cnoc1C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1	1810302884	NWICXSIUUBBXPS-MAUKXSAKSA-N	449.471	1.010	50	20	IDGD	
CC[C@@H](NC(C)=O)C(=O)N1CC[C@H](CNC(=O)CO[Si](C)(C)C)[C@H]1c1cccnc1	1810537866	QHGUOQIJAPXYOY-QWFCFKBJSA-N	434.613	1.854	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H](CNC(=O)c2n[nH]cc2[N+](=O)[O-])[C@@H]1c1cccnc1	1810640854	VQJHKEOJBQMXPW-KDOFPFPSSA-N	446.540	1.884	50	20	IDGD	
Cc1cc(C(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@H]2c2cccnc2)nn1C(F)F	1811510149	MWDHPFPLTAVGLW-IMJJTQAJSA-N	441.866	1.901	50	20	IDGD	
CCOC(=O)/C=C/C(=O)N1CC[C@H](CNC(=O)[C@H](C)Br)[C@H]1c1cccnc1	1812864020	JLUIOMGBKOLGOM-WEXMYYECSA-N	438.322	1.990	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)Cc2cccs2)[C@H]1c1cccnc1	1813070091	DGOSITRJHVDBCH-VGSWGCGISA-N	443.573	1.765	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@H]1c1cccnc1)[C@@H]1[C@H]2COC[C@H]21	1813659497	MNXKYQHZCYFIHT-UGYDUONOSA-N	426.286	1.670	50	20	IDGD	
COC1(CC(=O)NC[C@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)CCC1	1813676713	XXDHCRVYBMWCBC-XMSQKQJNSA-N	445.564	1.420	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1)[C@@H]1COc2ccccc2O1	1815672131	JTTRUVONIVNYAK-VBQJREDUSA-N	434.880	1.842	50	20	IDGD	
Cc1cc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)CCC(=O)NN(C)C)CC3)cc(O)n1	1817157923	LUGNFWYXWLZTHL-ZDUSSCGKSA-N	446.533	1.151	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)CN)n[nH]1	1817242404	SZFZPZAZYLLVFV-HNNXBMFYSA-N	430.421	1.508	50	20	IDGD	
Cc1ccc(CC(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)o1	1817474912	ITNAOEURHWDTFK-LJQANCHMSA-N	436.277	1.540	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)Cc2ccccn2)[nH]n1)c1cccc(B(O)O)c1	1817475135	KVRRYJFADQLMLN-LJQANCHMSA-N	433.277	1.033	50	20	IDGD	
Cc1cc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)cn1C	1818298379	GZQIDVSKMVGZIS-IBGZPJMESA-N	435.293	1.356	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@@H](F)Br)[nH]n1)c1ccnnc1O	1820054213	VWYKTCHDWWVUIK-ZYHUDNBSSA-N	427.234	1.902	50	20	IDGD	
CCOC(=O)c1cc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)[C@H](O)CCl)[nH]n2)ccn1	1820297266	MYXRITFZJAEMBX-JKSUJKDBSA-N	449.895	1.887	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H]2CCC(=O)N2C)[nH]n1	1822190677	UQOAVRAZCQJCAJ-RTXFEEFZSA-N	426.315	1.806	50	20	IDGD	
C[C@@H](C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1)n1ccnc1	1822411967	GELNLCUBWKZFBQ-HOCLYGCPSA-N	430.513	1.233	50	20	IDGD	
O=C(Cc1cnccn1)N[C@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1	1822998257	BAKKLXOJPDDDDX-ISVAXAHUSA-N	428.287	1.778	50	20	IDGD	
O=C(NCC(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)CC1)c1cccnc1	1824179567	UISXVKPJAGQEDO-ROUUACIJSA-N	436.940	1.031	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)Cc1c(C)nn(C)c1C)CC2	1826009140	MKGUDLUZUKPFKE-GXTWGEPZSA-N	439.969	1.902	50	20	IDGD	
CCC[C@H](NC(C)=O)C(=O)N[C@H]1CCc2nc(NC(=O)[C@H](Cl)COC)sc2C1	1826009581	VAHYTKXZBDDFLJ-SCRDCRAPSA-N	430.958	1.614	50	20	IDGD	
Cc1ccc(C(=O)N[C@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)nc1	1826080425	JTXQBXNTGDLQBM-ZDUSSCGKSA-N	430.534	1.445	50	20	IDGD	
COc1cccc(C(=O)N[C@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)c1	1826088320	DJBSQZPVSSQBHE-AWEZNQCLSA-N	445.545	1.751	50	20	IDGD	
CC(C)=NO[C@@H](C)C(=O)N[C@@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1	1826088358	DYUBLASGUMAZKB-QWHCGFSZSA-N	438.554	1.229	50	20	IDGD	
Cc1cnn([C@H](C)C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)CCC(=O)NN(C)C)CC3)c1	1826752983	WJQLZAAOGBRBPU-KGLIPLIRSA-N	447.565	1.194	50	20	IDGD	
O=C1NCc2cc(C(=O)N3CCCC[C@H]3C3CCN(C(=O)[C@H](O)CCl)CC3)ccc21	1828722819	FZMPNYPZOBGLHA-RBUKOAKNSA-N	433.936	1.763	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC([C@H]2CCCCN2C(=O)CCc2nc(N)n[nH]2)CC1	1828806958	UAVLCNBEISXCBY-TZMCWYRMSA-N	441.374	1.723	50	20	IDGD	
O=C(C1CC1)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)[C@@H](O)CCl)C2)C1	1829444795	UMWPZWCOJKVEQU-AVRDEDQJSA-N	449.935	1.448	50	20	IDGD	
CSCC(C)(C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)Br)C2)C1	1831539537	RMIBGYXSVBOGLG-SUMWQHHRSA-N	437.400	1.615	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)N3C[C@@H]4C[C@H]4C3)C2)C1	1831650885	LPJIOCLLHHBTGA-SOADLSRISA-N	427.973	1.191	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCN2CCN(C)CC2)CC1	1831830022	HDDDQXVMDXZQJH-WOJBJXKFSA-N	443.032	1.497	50	20	IDGD	
C[C@@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1)c1ccccn1	1832330539	UDPHGIGHVUQUJQ-JPYJTQIMSA-N	449.360	1.798	50	20	IDGD	
COc1nccc(C(=O)N2CCC(N3CCC(NC(=O)[C@@H](O)CCl)CC3)CC2)c1F	1833310191	BMZYKEBFEBYNLW-INIZCTEOSA-N	442.919	1.014	50	20	IDGD	
COc1ccc(C(=O)N2CCC(N3CCC(NC(=O)[C@@H](O)CCl)CC3)CC2)c(F)c1	1833313685	NAZXVZGMJSKMTK-IBGZPJMESA-N	441.931	1.619	50	20	IDGD	
CC(=O)NC(C)(C)C(=O)NC1CCN(C2CCN(C(=O)[C@H](C)Br)CC2)CC1	1833486861	CHNTXOFMSSWKGY-ZDUSSCGKSA-N	445.402	1.256	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC(N2CCC(NC(=O)Cc3ncccn3)CC2)CC1	1833877153	PMBBXKWVUKQINA-UHFFFAOYSA-N	433.629	1.442	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3ncnn3C)CC2)CC1	1834076663	VPRFGSSGAMCCSK-HNNXBMFYSA-N	441.374	1.174	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CCC(F)(F)F)CCO2)C1	1835329017	KIXOYUWSWCQNBW-RISCZKNCSA-N	431.249	1.569	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCC(N2CCC(NC(=O)C(=O)Nc3cccnc3)CC2)CC1	1835802433	PMHNABJXRLTZFA-UHFFFAOYSA-N	449.983	1.857	50	20	IDGD	
O=C(c1cn2cc(F)ccc2n1)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1836961818	BNQRLXFHCMMACZ-SFHVURJKSA-N	445.278	1.347	50	20	IDGD	
O=C(CS[C@@H]1CCCCO1)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1837510634	OXLSKRHUXVEQBJ-RHSMWYFYSA-N	441.377	1.506	50	20	IDGD	
Cc1nc(C(=O)N2CCOC[C@@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)cs1	1837712365	NQQJBXAEKATDJY-GOSISDBHSA-N	427.599	1.373	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)Cc3ccn(C)n3)CC2)CC1	1837948933	DWJQJGZRHZXCMT-GOSISDBHSA-N	426.945	1.215	50	20	IDGD	
COc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)ccc1O	1838972860	YCYZAGRXZWMIDR-NRFANRHFSA-N	440.924	1.736	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(NC(C)=O)o3)C2)C1	1839146425	ZAGPFLNWMVUDGZ-IFXJQAMLSA-N	427.885	1.325	50	20	IDGD	
CC(C)O[C@H](C)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2	1839153171	CQFVQQLFGSMCBG-OLMNPRSZSA-N	425.353	1.493	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(O)c(C)c3)CCO2)C1	1839309772	SGUOYYSDBPZDST-OXJNMPFZSA-N	426.897	1.024	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3ccccc3)C2)C1	1840032142	OLTAPPOWRQTHCA-OXJNMPFZSA-N	439.350	1.859	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3nc(C)sc3C)C2)C1	1840150865	SIHWPYUJULJDBK-DNVCBOLYSA-N	445.969	1.013	50	20	IDGD	
CC(C)(C)OC(=O)N1CC2(CC2)C[C@H]1C(=O)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1	1841348122	LODWWLSYNMIRAO-GJZGRUSLSA-N	441.956	1.579	50	20	IDGD	
O=C([C@@H]1CCc2cccc(Cl)c21)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843012253	UASBJWNKVPPNFS-GOSISDBHSA-N	438.720	1.567	50	20	IDGD	
CCc1nn(C)c(C(=O)N2CCCC23CN(C(=O)[C@H](O)CCl)C3)c1Br	1843147371	IBCVFJOAXRARQK-LLVKDONJSA-N	433.734	1.162	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)[C@H](C)Nc1nccs1)C2	1843416059	UMONKQRMSPEHNC-NYATXJBFSA-N	443.533	1.281	50	20	IDGD	
Cc1ccc(=O)n(C(C)(C)C(=O)N2CCCC23CN(C(=O)[C@H](C)Br)C3)n1	1844354683	LQVHOSPVVRTTSF-ZDUSSCGKSA-N	425.327	1.274	50	20	IDGD	
CC[C@H](C)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)[C@H](O)CCl)C2	1845150562	IGQAZCQGYDZJTA-RRFJBIMHSA-N	431.961	1.729	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)[C@@H]2Cc3ccccc3N2)C1	1845853999	NMEBNYUMJHJWSF-CRXVIZHGSA-N	434.500	1.361	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC12CN(C(=O)C1(F)CN(C(=O)OC(C)(C)C)C1)C2	1846180165	QKJQEGPQYLHECJ-LBPRGKRZSA-N	448.333	1.932	50	20	IDGD	
CC(C)[C@H](CC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl)NC(=O)OC(C)(C)C	1847563432	IMGZZXCGVJOHBZ-YHUYYLMFSA-N	431.961	1.727	50	20	IDGD	
COc1ccc(CC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1OC	5199570	MCDLFESZKAKBHN-UHFFFAOYSA-N	426.517	1.606	50	20	IDGD	
O=C(NNC(=O)c1ccc(COc2ccccc2)o1)C1=CN2CCS(=O)(=O)N=C2C=C1	15810077	PPWMVZWLHZCFBJ-UHFFFAOYSA-N	442.453	1.117	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)c1nnn(-c2cccc([N+](=O)[O-])c2)c1C	24346692	WFTCKWYJAXEISG-UHFFFAOYSA-N	440.416	1.723	50	20	IDGD	
COc1cc(CNC(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)cc(OC)c1OC	115410642	WHPJMMGUCNKMDD-UHFFFAOYSA-N	449.460	1.882	50	20	IDGD	
O=C(NNC(=O)c1csc(-c2ccc3c(c2)OCO3)n1)c1ccc(-n2cnnn2)cc1	726523625	XYTQCLQUUCOYAY-UHFFFAOYSA-N	435.425	1.589	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)Cn2ncc3ccccc3c2=O)c1	728528006	XJFRZXGPTRGLAB-UHFFFAOYSA-N	431.246	1.629	50	20	IDGD	
COc1ccc(Cn2ncc3cc(C(=O)NNC(=O)Cc4cccnc4)cnc32)c(OC)c1	728851273	VDOCAZQRNRMZTD-UHFFFAOYSA-N	446.467	1.896	50	20	IDGD	
Cc1nn(Cc2ccccc2Cl)c(Cl)c1C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O	729276549	GOKJWFSDYZBBHB-JTQLQIEISA-N	448.332	1.245	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)NCc1cccc(C(=O)NC[C@@H]2CCCO2)c1	730902456	GJEQEXXUEIVGPB-KRWDZBQOSA-N	442.472	1.210	50	20	IDGD	
Cc1nc(-c2c(C)c(C)nn(C)c2=O)sc1C(=O)NNC(=O)CNc1ccccc1	731223759	LXYVZNLVQSVNKO-UHFFFAOYSA-N	426.502	1.702	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NC[C@@H]2CCOc3ccccc32)cc1	731284714	GEPPOBSNEKVRNF-INIZCTEOSA-N	446.529	1.512	50	20	IDGD	
COc1ccc(CCN2C[C@@H](C(=O)NNC(=O)Cc3ccccc3F)CC2=O)cc1OC	731328739	DPPJXKZTUQUERV-KRWDZBQOSA-N	443.475	1.624	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)c1sccc1S(=O)(=O)N1CCOCC1)c1ccccc1	731999948	AUMNUYUERFRHLI-HNNXBMFYSA-N	437.543	1.724	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@H]2CC(=O)N(CC(F)(F)F)C2)cc1Br	732035453	DTSKRJNKYWEMIX-VIFPVBQESA-N	438.200	1.630	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CNC(=O)NC2CCCCC2)cc1Br	732175592	LWMFPUSQGFJVNT-UHFFFAOYSA-N	427.299	1.851	50	20	IDGD	
CN1CCN(C[C@@H](NC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c2ccccc2)CC1	733351183	SZHUYPHWWNIRBS-JOCHJYFZSA-N	447.543	1.805	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)[C@@H]1CCCN(S(=O)(=O)Cc2ccccc2)C1	737629695	VCXKMECTXBUBPX-HXUWFJFHSA-N	445.541	1.593	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)N[C@@H]2CCC[C@H](S(C)(=O)=O)C2)cc1OC	741093630	AZTJGYCCOGCIGY-CABCVRRESA-N	427.523	1.784	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)c2ccc(OC)c(N3CCNC3=O)c2)cc1	742037585	ZAGWTELMIWPURX-CQSZACIVSA-N	442.472	1.852	50	20	IDGD	
C[C@H](CC(=O)NNC(=O)c1c[nH]c2ccccc12)/N=C1/NS(=O)(=O)c2ccccc21	742487045	IXZMWALUZPVGDJ-GFCCVEGCSA-N	425.470	1.446	50	20	IDGD	
O=C1C[C@H](Cc2ccc(C(=O)NNC(=O)c3ccc(Br)s3)cc2)C(=O)N1	743291517	QHSLZTIPTCUMOG-NSHDSACASA-N	436.287	1.791	50	20	IDGD	
NS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2c(F)cc(F)cc2Br)cc1	743701443	URUISBWRVRVEQI-UHFFFAOYSA-N	449.233	1.457	50	20	IDGD	
CC(=O)CCc1ccc(O[C@@H](C)C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1	745045244	DARVQPZMNKJGPU-HNNXBMFYSA-N	432.498	1.840	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)N[C@@H]2C[C@@H](C)N(c3ccccc3)C2=O)nc1	745882501	OYMMTINSHUYFIR-RHSMWYFYSA-N	446.533	1.588	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN(C)[C@@H]1CCCC[C@H]1S(C)(=O)=O	746469919	FDCRXWNNPHDGKP-GDBMZVCRSA-N	431.942	1.397	50	20	IDGD	
CC(=O)N1CC[C@](C)(C(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)C1	746815876	GWBOTVSTROJRRA-DEOSSOPVSA-N	447.495	1.464	50	20	IDGD	
Cc1cc(C)nc(SCc2ccc(C(=O)NNC(=O)[C@@H]3CCCN3C(N)=O)cc2)n1	747352300	ASGKOSUHXREDTJ-INIZCTEOSA-N	428.518	1.690	50	20	IDGD	
NC(=O)C[C@@H]1CCCN(C(=O)NNC(=O)[C@@H]2Cc3ccccc3CN2Cc2ccccc2)C1	747497832	BMHXIIXQJWEDGM-UGKGYDQZSA-N	449.555	1.942	50	20	IDGD	
C[C@H](c1ccc([S@](C)=O)cc1)N(C)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	747500972	OINPGSUBHBWGBM-QLCIJSRNSA-N	444.561	1.864	50	20	IDGD	
CNC(=O)NNS(=O)(=O)c1c(Br)cc(C(=O)O)cc1Br	747608723	KKGLBBUMBJNFIJ-UHFFFAOYSA-N	431.062	1.032	50	20	IDGD	
COc1ccccc1C(=O)NNS(=O)(=O)c1ccc(C(=O)O)c(Br)c1	747616236	OBJRHRVASXEFKF-UHFFFAOYSA-N	429.248	1.779	50	20	IDGD	
CCc1nc(C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)nn1-c1ccccc1Cl	748173473	JINBJLKEGZHITO-UHFFFAOYSA-N	447.904	1.961	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)CSc3ccc(O)cc3)cc2)CC1	748618366	CDOJHUZCPCQJKS-UHFFFAOYSA-N	436.559	1.564	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCCN(C)Cc2ccc(F)cc2)cc(OC)c1OC	748978163	XCBJRQQATIUJPA-UHFFFAOYSA-N	434.468	1.928	50	20	IDGD	
N#CCNC(=O)/C(C#N)=C\c1cn(CCC(N)=O)nc1-c1cccc(Br)c1	749608238	BEVFJVLZUXAQAL-JYRVWZFOSA-N	427.262	1.735	50	20	IDGD	
COc1ccc2c(c1)CC[C@@H](NC(=O)NNC(=O)c1sc(N3CCOCC3)nc1C)C2	753288108	SQYLTSYABXHWFX-MRXNPFEDSA-N	445.545	1.798	50	20	IDGD	
COC(=O)c1c(Br)ccc(NC(=O)C(=O)NNC(=O)c2cccnc2)c1C	753839181	GYRAVHZFKNITQM-UHFFFAOYSA-N	435.234	1.339	50	20	IDGD	
C[C@H]1C[C@@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)CN1C1CC1	753943795	QQEAEIBAXPABRX-GOEBONIOSA-N	435.550	1.040	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)N[C@H]1CCO[C@H](c2ccc(F)cc2)C1	754135990	SVPUVQKWOSKMQJ-RDJZCZTQSA-N	449.508	1.983	50	20	IDGD	
O=C(COC(=O)c1scnc1Br)NNC(=O)[C@@H]1COc2ccccc2O1	754967702	GYVNIVKKJXWUQE-JTQLQIEISA-N	442.247	1.050	50	20	IDGD	
CCOc1ccccc1OS(=O)(=O)c1cccc(C(=O)NNC(=O)Cc2cc[nH]n2)c1	755280829	CKMXTALBCMGEOM-UHFFFAOYSA-N	444.469	1.580	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCCCCC2)cc1NC(=O)NNC(=O)c1cnccn1	755419681	HCFJQYKANWXSDA-UHFFFAOYSA-N	448.505	1.516	50	20	IDGD	
COC(=O)CCNC(=O)c1ccc(NC(=O)NNC(=O)c2c(C)nc3ccccn23)cc1	755604071	OFNFZMDPWNCHIE-UHFFFAOYSA-N	438.444	1.402	50	20	IDGD	
CS(=O)(=O)CCOc1cccc(NC(=O)NNC(=O)Cc2c[nH]c3ccccc23)c1	756296324	AHPJBTNZZNLQIB-UHFFFAOYSA-N	430.486	1.987	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)c2nnc(O)c3ccccc23)ccc1N1C(=O)CCC1=O	756557119	QVWSVXIYHNXBKL-UHFFFAOYSA-N	434.412	1.764	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)CN1C(=O)NC2(C[C@@H](C)C[C@H](C)C2)C1=O	757629181	QBBRIHWVEQTSTB-GJZGRUSLSA-N	430.505	1.522	50	20	IDGD	
O=C(NC[C@@H](O)c1cc2ccccc2s1)NNC(=O)c1csc(N2CCOCC2)n1	757723687	UOADOGRXNSNECH-CQSZACIVSA-N	447.542	1.872	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)Nc1ccc(N2CCOCC2)nc1C	757732467	GINHATHIULXGAG-UHFFFAOYSA-N	429.477	1.857	50	20	IDGD	
COCC(=O)NNC(=O)Nc1sc(-c2ccccc2)c(C)c1C(=O)N1CCOCC1	757739518	NQHIPILPVOAJBQ-UHFFFAOYSA-N	432.502	1.995	50	20	IDGD	
CCOC(=O)Cc1nnc(NC(=O)NNC(=O)CSc2ccccc2OC)s1	757753511	FXUIRHPFUQKNOQ-UHFFFAOYSA-N	425.492	1.597	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3ccc(F)cc3[N+](=O)[O-])cc2)CC1	758291552	CETMBIJYZCDNDA-UHFFFAOYSA-N	437.453	1.427	50	20	IDGD	
CC(C)n1ncc(C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)c1N	758361769	MGWBKYHPVZKLGY-UHFFFAOYSA-N	433.944	1.278	50	20	IDGD	
CCc1ccc(S(C)(=O)=O)cc1C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	759018895	DBZJUPKNQASHLW-UHFFFAOYSA-N	431.518	1.120	50	20	IDGD	
O=C(NC[C@@]1(Cc2ccc(F)cc2)CCC[C@H]1O)NNC(=O)C(=O)Nc1ccccn1	759690974	YKLFKQRVOCHQOK-IERDGZPVSA-N	429.452	1.264	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NNc2ccc(C(=O)OC)cn2)ccc1OC	759729030	AQDLMIVNBRTJEM-UHFFFAOYSA-N	436.490	1.664	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N(C)CC2(O)CCC2)cc1	760076648	KFLBMVIHZOIHQE-SFQUDFHCSA-N	437.500	1.714	50	20	IDGD	
Cc1ccc(CN2C[C@H](C(=O)OCC(=O)NNC(=O)Cc3nc(C)cs3)CC2=O)cc1	760166273	DEUNJAHCBYQOAR-MRXNPFEDSA-N	444.513	1.042	50	20	IDGD	
O=C(NNC(=O)c1ccc2ccccc2n1)C(=O)Nc1ccc(=O)n(Cc2ccccc2)c1	763454939	KMISJKAVTRXLCL-UHFFFAOYSA-N	441.447	1.845	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)[C@H]2CC23CCN(C(=O)OC(C)(C)C)CC3)C[C@@H](C)O1	763467992	ZUFVPUVGICBNDV-BRWVUGGUSA-N	438.569	1.670	50	20	IDGD	
C[C@@H]1Oc2ccc(NC(=O)C(=O)NNC(=O)c3ccccc3Br)cc2NC1=O	763484370	YCCRUCGCZVUCIL-VIFPVBQESA-N	447.245	1.568	50	20	IDGD	
COC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)cc1	763538627	FFYXEBUVALZOIR-UHFFFAOYSA-N	446.416	1.290	50	20	IDGD	
CS(=O)(=O)c1c(Cl)cccc1NC(=O)C(=O)NNC(=O)c1c[nH]c2ccccc12	763541477	UIXHSPUUTAUJNW-UHFFFAOYSA-N	434.861	1.625	50	20	IDGD	
CC[C@@H](C)n1ncc(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1C1CC1	763570206	DFXWLPZILQLMAL-PXAZEXFGSA-N	427.461	1.657	50	20	IDGD	
CCOC(=O)/C=C/c1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1	763572461	RKJSNSJNYHYQCP-PEKVBPLLSA-N	439.424	1.189	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)cc1NC(C)=O	763600995	MFXALSZLTLCPMF-UHFFFAOYSA-N	436.428	1.443	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1)C(=O)Nc1ccsc1	763613358	MSFWNRSHEKBXNU-UHFFFAOYSA-N	447.480	1.850	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(Cl)c(C[S@](C)=O)c2)c1	763630843	OMWAEIXCDWACGS-LJAQVGFWSA-N	437.905	1.692	50	20	IDGD	
CNC(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)COc2ccc(C)c(C)c2)c1	763664912	NFHYABOYHCSKTR-UHFFFAOYSA-N	432.864	1.481	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1c(F)c(F)c(F)c(F)c1F	763679700	CNBQWGGOSPVSGK-UHFFFAOYSA-N	447.316	1.946	50	20	IDGD	
Cc1ccc(C(N)=O)cc1NC(=O)C(=O)NNC(=O)COc1ccc(Br)cc1	763695814	YCSVNCOUBUZLTO-UHFFFAOYSA-N	449.261	1.021	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2ccc(C)cc2OCCN(C)C)c1	763774326	BXKBRAHVLBYAQT-UHFFFAOYSA-N	444.488	1.352	50	20	IDGD	
CC(C)(C)c1ccc(C(=O)NNC(=O)C(=O)Nc2ncn(Cc3ccc(C#N)cc3)n2)cc1	763795000	JSCSVINODFVCDW-UHFFFAOYSA-N	445.483	1.895	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccc(N2CCOCC2)c(F)c1	763858467	SOVJIKLUXKSZHV-ZDUSSCGKSA-N	448.426	1.355	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)Cc2ccc(CC(=O)NNc3nc(C)cc(C)n3)cc2)n1	763873043	RXFSBLXQMGOTOK-UHFFFAOYSA-N	434.504	1.872	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(-n3ccnc3)nc2)cc1	763878340	OXMLUWBBWQKRLD-CQSZACIVSA-N	436.428	1.023	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccc(SCc3cccnc3)cc2)n1	763893506	WEZKSKVQOLQPHF-UHFFFAOYSA-N	438.513	1.973	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(C#N)ccc2OC)cc1OC	763910968	IXYXTZALQUDAKU-UHFFFAOYSA-N	426.429	1.764	50	20	IDGD	
CC(=O)NCc1ccc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CC[C@H](C)C3)cc1	763940394	HIDBFUJXFFSNFP-LBPRGKRZSA-N	428.514	1.909	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3cccc(N4CCNC4=O)c3)cc2C1	763943910	VTWUFDBFKMYSCV-GFCCVEGCSA-N	441.513	1.802	50	20	IDGD	
Cc1c(CSC(C)C)cccc1NC(=O)C(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1	764001645	BROLCUDZCXPJNC-AWEZNQCLSA-N	427.548	1.157	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1cc(S(C)(=O)=O)ccc1C	764011551	IQYXSBNUMGZBST-UHFFFAOYSA-N	439.877	1.460	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc(CCN2CCSCC2)cc1	764042439	KCBGHXVCNQKJSJ-UHFFFAOYSA-N	442.541	1.686	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c(O)c(Br)c1)C(=O)N1CCCC1	764068025	KRTFLIUQMLDIEX-UHFFFAOYSA-N	435.072	1.301	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2cccc(-c3noc(C4CC4)n3)c2)c1O	764130503	JHYQRAGBKBNIKF-UHFFFAOYSA-N	437.412	1.728	50	20	IDGD	
CCCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)Cc2ccccc2OC)cc1Cl	764131113	DVFMROWJJIISQO-UHFFFAOYSA-N	446.891	1.817	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2O1)C(=O)Nc1ccnc(Sc2ccccn2)c1	764168069	NONIJYLMVAMVIQ-INIZCTEOSA-N	435.465	1.717	50	20	IDGD	
COCCS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)CCC2CCCCC2)cc1	764217338	FCDFAPPPLDPLPA-UHFFFAOYSA-N	439.534	1.553	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)C(=O)Nc1nc2cc3c(cc2s1)OC(F)(F)O3	764268056	DONALHZMBPQBCI-UHFFFAOYSA-N	435.368	1.341	50	20	IDGD	
CCn1cnnc1-c1ccccc1NC(=O)C(=O)NNC(=O)c1ccc(O)c(Cl)c1	764349392	MKEVPNBXGUBESU-UHFFFAOYSA-N	428.836	1.724	50	20	IDGD	
COCCc1ccc(Oc2ccc(NC(=O)C(=O)NNC(=O)c3cnn(C)c3)cc2)cc1	764358380	CFRSPRVETRKZDL-UHFFFAOYSA-N	437.456	1.801	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(C(=O)NC2CCCCC2)cc1C	764399599	KSKRJTQFPSSGEZ-OAHLLOKOSA-N	448.520	1.195	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COCCO1)C(=O)Nc1ccc(OC(F)F)c(Cc2ccccc2)c1	764425733	RSYFKBWQLNPAHZ-KRWDZBQOSA-N	449.410	1.380	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)C(=O)Nc2cnn(-c3cc(C)ccc3C)c2C)c1	764432574	GNZMGYNWOVFWEG-UHFFFAOYSA-N	449.471	1.551	50	20	IDGD	
CS(=O)(=O)c1cc(C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)cc([N+](=O)[O-])c1	765569237	WYVQSZAOMCPVKC-UHFFFAOYSA-N	435.443	1.525	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(C(=O)CNC(=O)NNc2ncnc3ccsc23)CC1	765731336	ZNXPPTVQZYXSJJ-UHFFFAOYSA-N	435.510	1.397	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cc4c(nc3O)CCCC4)CC2)cc1	766650598	XFSIMZBIHJCBCI-UHFFFAOYSA-N	437.544	1.553	50	20	IDGD	
CCOc1ccc(/C=C(\C#N)C(=O)N2CCN(S(=O)(=O)c3cn(C)c(C)n3)CC2)cc1	766743294	GNGYIOBDXBNRSY-QGOAFFKASA-N	443.529	1.567	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)c2ccc(N3C(=O)CCC3=O)c([N+](=O)[O-])c2)cc1	767428862	PDRQCAVFIHTESH-UHFFFAOYSA-N	426.385	1.397	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)c1csc(-c2ncccc2F)n1	768280828	XGMYUFJJQDMEKM-UHFFFAOYSA-N	434.478	1.712	50	20	IDGD	
O=C(NNc1ncnc2ccsc12)c1cccc(S(=O)(=O)NC[C@H]2CCCO2)c1	768290290	GJBFVWXIXOEMIW-CYBMUJFWSA-N	433.515	1.906	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)CCC(=O)c1ccc2c(c1)CCC(=O)N2	768731920	WLEGDRKNYLZYPN-UHFFFAOYSA-N	432.477	1.596	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)CN2C(=O)COc3ccccc32)C1	769685486	MIEBMJGMHNOBTL-AWEZNQCLSA-N	432.477	1.207	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@H](C)C(=O)NNC(=O)c1ccc(S(N)(=O)=O)cn1	769738911	PHFVMNJHKOFRLJ-LLVKDONJSA-N	426.882	1.228	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)CCn3cnc4sccc4c3=O)nc21	770966056	QMSMPTIZWOUOHK-UHFFFAOYSA-N	428.478	1.592	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)[C@H](C)NS(=O)(=O)c3cccs3)n[nH]2)c1	771045197	MPFUTJKLAGMGPM-ZDUSSCGKSA-N	447.542	1.883	50	20	IDGD	
Cc1ccncc1[C@@H](C)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	771438884	IAUWIAYNBDGNCZ-OAHLLOKOSA-N	431.518	1.880	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)[C@H]1CC(=O)N(c2ccc(Br)c(C)c2)C1	771995277	QWLHFKSLZJWKHP-NEPJUHHUSA-N	440.294	1.600	50	20	IDGD	
COc1cccc(-c2cc(C(=O)NNC(=O)C(=O)NCc3ccc(Cl)cc3)n[nH]2)c1	772181825	FWYMFBTVFNKSER-UHFFFAOYSA-N	427.848	1.816	50	20	IDGD	
CNC(=O)COc1cccc(CC(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)c1	772364036	RADLOUMRJMTXMT-UHFFFAOYSA-N	433.848	1.012	50	20	IDGD	
CC(C)[C@H](C(=O)NNC(=O)COc1ccc(Br)cc1)N1CCCS1(=O)=O	772630630	MLQQNZODPBLGRB-OAHLLOKOSA-N	448.339	1.035	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2ccc(C(=O)N3CCCCC3)c(Cl)c2)n1	773724579	SVERVLUDRUEZAO-UHFFFAOYSA-N	432.868	1.847	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)N(C)C(=O)CO2	774000984	BMOBAHFAKQDVME-NSHDSACASA-N	446.847	1.249	50	20	IDGD	
C[C@H]1C[C@@H](C(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)CCO1	776338949	PZQSQAUJZPQUMT-YJBOKZPZSA-N	431.514	1.741	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccc(C(=O)NNc2cccc(S(C)(=O)=O)c2)cc1	776535894	FVUYDJWUCMPPDN-UHFFFAOYSA-N	425.532	1.924	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)NC[C@@H]2COC3(CCOCC3)O2)cc1OC	776935772	AGVOMPJFGZWHSY-MRXNPFEDSA-N	437.493	1.740	50	20	IDGD	
O=C(NNS(=O)(=O)c1c(Cl)ccnc1Cl)C1CCN(c2ncccn2)CC1	777932561	GOGMYBVNVOZBTG-UHFFFAOYSA-N	431.305	1.405	50	20	IDGD	
COCC(=O)N1CCc2cc(NC(=O)C(=O)NNC(=O)Cc3c[nH]c4ccccc34)ccc21	778707943	SLGHGBOBKGJEIU-UHFFFAOYSA-N	449.467	1.032	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)n1	781718565	JTOWFPHECKRHQD-UHFFFAOYSA-N	444.372	1.508	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)C(=O)Nc1cccc2ccccc12	782897148	UXYKZSWOXVIJMI-UHFFFAOYSA-N	439.497	1.841	50	20	IDGD	
CC(C)OCCCCNC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	783322613	CBFSCMMIUCUUTN-UHFFFAOYSA-N	426.539	1.620	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2ccc(-n3cccn3)cc2C(F)(F)F)CCS(=O)(=O)C1	783426065	FPTCLJNHTSAUTB-INIZCTEOSA-N	445.423	1.028	50	20	IDGD	
Cc1ccc(NNC(=O)C(=O)Nc2ccc(S(=O)(=O)N3CCC[C@H](C)C3)cc2)nn1	783953679	VQZMLGXPNZWIFE-ZDUSSCGKSA-N	432.506	1.287	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)cccc1[N+](=O)[O-]	784836262	VDRKMXQOPDQVJK-UHFFFAOYSA-N	428.373	1.981	50	20	IDGD	
CC(C)(C)NC(=O)c1ccccc1NC(=O)C(=O)NNC(=O)Cc1cn2ccccc2n1	785067787	NTGRYPLDJKNTHB-UHFFFAOYSA-N	436.472	1.191	50	20	IDGD	
N#Cc1ccc(NNC(=O)C(=O)Nc2ccc(C(=O)N3CCOCC3)cc2)cc1Cl	785086471	PULNKHMTQUERPF-UHFFFAOYSA-N	427.848	1.766	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)C(=O)Nc3cc(C)nn3CCC#N)n[nH]2)c1	785125045	ADCCZAGQZWBUMP-UHFFFAOYSA-N	434.460	1.512	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)Cc2cccnc2)cc1S(=O)(=O)N1CCCC1	786125764	MQKNCDQNFAVHJT-UHFFFAOYSA-N	433.490	1.270	50	20	IDGD	
C[C@@H]1CN(S(=O)(=O)c2ccc(NC(=O)COC(=O)/C(C#N)=C/C3CC3)cc2)C[C@@H](C)O1	786672258	ZWTJGDADCLJNDR-SDAHTHQCSA-N	447.513	1.826	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])c(C)c1	788158399	HWKIPKJVYJIKJA-MRXNPFEDSA-N	436.465	1.444	50	20	IDGD	
Cc1c(Br)cc(C=NNC(=O)[C@H](C)NS(C)(=O)=O)cc1Br	789003577	BDQIARUZLSDPSL-QMMMGPOBSA-N	441.145	1.908	50	20	IDGD	
O=C(NC[C@@H](Cc1cccc(F)c1)C(=O)N1CCOCC1)NNc1nc2ccccn2n1	789311899	VXFMQXKFJOTEQF-MRXNPFEDSA-N	441.467	1.212	50	20	IDGD	
COC[C@H](NC(=O)NNC(=O)[C@@H](C)Oc1cccc(Br)c1)[C@H]1CCCO1	789335686	SYDDSMIPLIEWEH-BYCMXARLSA-N	430.299	1.741	50	20	IDGD	
CC(C)Oc1cc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)ccc1C(N)=O	789739328	NAJCPIGPVBWYRH-UHFFFAOYSA-N	446.485	1.157	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)Cn1ccc2ccccc2c1=O	790483241	KDIQSRGRCRCWCP-UHFFFAOYSA-N	427.486	1.064	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2cc([C@H]3CCCOC3)nn2C)c1	790952869	WYBGCYWTZRVSRK-HNNXBMFYSA-N	429.477	1.096	50	20	IDGD	
CCNc1ccc(Cl)cc1C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	791533044	AXIJOBIYWPNWGH-KRWDZBQOSA-N	433.848	1.916	50	20	IDGD	
O=C(NNC(=O)C1CCC(O)CC1)c1cccc(S(=O)(=O)NCc2ccccc2)c1	792014553	KGXDYQIJBVQQNO-UHFFFAOYSA-N	431.514	1.477	50	20	IDGD	
O=C(CCCc1ccccc1)NNC(=O)C(=O)Nc1ccc(Cc2nnc3n2CCC3)cc1	792269437	UCPYRTRZMYSFMI-UHFFFAOYSA-N	446.511	1.924	50	20	IDGD	
CC(C)(C)OC(=O)Nc1cnc(C(=O)NNC(=O)CNC(=O)OCc2ccccc2)cn1	794066352	YOKSOLVJVCZKBY-UHFFFAOYSA-N	444.448	1.511	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)[C@@H]2[C@H]3CN(C(=O)OC(C)(C)C)C[C@H]32)n[nH]1	794393403	ODKBLJBVNCTXCS-UOIKSKOESA-N	441.488	1.959	50	20	IDGD	
C[C@]1(C(=O)NNc2nccc(N3CCOCC3)n2)CCN(C(=O)OCc2ccccc2)C1	795173007	CWAHRTHILPGUME-QFIPXVFZSA-N	440.504	1.805	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@@H]2C(=O)NNC(=O)c2nnc(O)c3ccccc23)cc1	798829851	LJTQUEWQYUDZAB-QGZVFWFLSA-N	435.440	1.410	50	20	IDGD	
CCn1ncc(NC(=O)C(=O)NNC(=O)COc2ccc(OC)cc2)c1C(F)(F)F	799256921	BCRXAVHXWXYMQG-UHFFFAOYSA-N	429.355	1.095	50	20	IDGD	
CCOc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NNC(=O)COc1ccc(Cl)cc1	799257890	VBZMJWLSLIALOW-UHFFFAOYSA-N	436.808	1.812	50	20	IDGD	
CN1C(=O)COc2cc(NC(=O)C(=O)NNC(=O)c3cccc(C(F)(F)F)c3)ccc21	799259058	SKUVTSBGRPMFJG-UHFFFAOYSA-N	436.346	1.460	50	20	IDGD	
CN1C(=O)COc2cc(NC(=O)C(=O)NNC(=O)c3c(Cl)cccc3Cl)ccc21	799259121	OWGAYFONVLKDLL-UHFFFAOYSA-N	437.239	1.748	50	20	IDGD	
O=C(NNC(=O)N1CCC(S(=O)(=O)N2CCCC2)CC1)c1cccc(OC(F)F)c1	799915771	GKCBISZPFPJSCQ-UHFFFAOYSA-N	446.476	1.532	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)[C@@H]2CCN(c3ccc4c(c3)OCCO4)C2=O)cc1	802063027	QVDJHVJBGLWTLK-INIZCTEOSA-N	426.429	1.672	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccc2nccnc2c1Br	806976024	ZRHCBNIHFFCEGV-UHFFFAOYSA-N	446.236	1.860	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)nc1)C(=O)Nc1ccc(F)cc1OC1CCOCC1	806976475	QPPWLYMCGDZKPG-UHFFFAOYSA-N	436.827	1.832	50	20	IDGD	
CS(=O)(=O)c1cc(C(=O)NNc2nc(Br)cn3ccnc23)ccc1F	807014773	LFALSUCQOVHLSM-UHFFFAOYSA-N	428.243	1.791	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)C(=O)N1CCc2ccc(Br)cc21	807428789	KUSINWGHFMMZGN-UHFFFAOYSA-N	428.250	1.457	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@@H]2CCCSC2)c1	807595745	ZVIAKCXWORHLSS-AWEZNQCLSA-N	428.580	1.804	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NCc2ccncc2OC[C@H]2CCOC2)cc1	807615795	XLHUWAKQPNADOK-HNNXBMFYSA-N	430.461	1.415	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2ccc(C(F)F)cc2)c1	808068705	FWMFEWFSYIIKKM-UHFFFAOYSA-N	433.458	1.498	50	20	IDGD	
CC(=O)c1cccc(S(=O)(=O)NCC(=O)NNC(=O)Cc2ccc3ccccc3c2)c1	810151130	UGMGXKUNOQSIKD-UHFFFAOYSA-N	439.493	1.711	50	20	IDGD	
CC(C)OCCCn1c(NNC(=O)[C@H]2CCc3nnn(C)c3C2)nc2ccccc2c1=O	810350519	QAVJFASXPDHJHE-HNNXBMFYSA-N	439.520	1.588	50	20	IDGD	
O=C(COC(=O)C1(N2C(=O)c3ccccc3C2=O)CCCC1)NNC(=O)c1ccccc1	815440851	YAWDEBNEKQTKPC-UHFFFAOYSA-N	435.436	1.600	50	20	IDGD	
COC(=O)c1cccc(C#Cc2cccc(NC(=O)C(=O)NNc3ncncc3F)c2)c1	815765582	WFKWGNCTUINKEP-UHFFFAOYSA-N	433.399	1.884	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)C(=O)Nc2ccc3c(c2)C(=O)OC3)c1	815865918	JFSLUCVEGIKHHM-UHFFFAOYSA-N	448.229	1.988	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)c2ccc3c(c2)NC(=O)CNC3=O)c(OC)cc1Cl	816597629	ZQZBKOSZXCUPSJ-UHFFFAOYSA-N	447.835	1.506	50	20	IDGD	
Cc1ccc(S(=O)(=O)Oc2ccc(S(=O)(=O)N3CC[C@H](B(O)O)C3)cc2)cc1	864231449	NGKVWOMFIPQBSF-AWEZNQCLSA-N	425.293	1.000	50	20	IDGD	
O=C(NNC(=O)[C@H]1CS[C@@H](Cc2ccccc2F)C(=O)N1)c1c[nH]c2ccccc12	896280619	GPRMGPQOWSJNFD-MSOLQXFVSA-N	426.473	1.911	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccccc1C(F)(F)F)NNC(=O)COc1ccccc1F	913455166	OOFIMEWXPKUJSR-UHFFFAOYSA-N	449.382	1.349	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)c2ccccc2c1=O	915190841	OTPPLOBZIGDABF-UHFFFAOYSA-N	433.384	1.102	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)NCCCN1C(=O)NC2(CCCC2)C1=O	915906150	MTCNEWHDQJKDCG-ZDUSSCGKSA-N	435.456	1.178	50	20	IDGD	
O=C(CN(Cc1ccccc1)S(=O)(=O)c1ccc(Cl)cc1)NNC(=O)c1cn[nH]c1	916144538	DBSMFFADTUAZDV-UHFFFAOYSA-N	447.904	1.715	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)N[C@H](CCSC)c2nnc3ccccn23)cc1	916224258	XXFPQJSQOJKXCO-MRXNPFEDSA-N	444.517	1.942	50	20	IDGD	
C[C@@H]1CCCN([C@H](C)CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)C1	916450282	ISDDCAHQNRXAHI-HUUCEWRRSA-N	425.555	1.001	50	20	IDGD	
Cc1cc(C(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)cc(S(N)(=O)=O)c1C	917244423	YYGJTVBZMOMXFN-UHFFFAOYSA-N	439.877	1.222	50	20	IDGD	
N#Cc1ccc(S(=O)(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1Cl	917724497	ZXVGGJZPGXKQHA-UHFFFAOYSA-N	427.895	1.128	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)cc1	917912481	YNNXNORJFFBTHS-UHFFFAOYSA-N	445.457	1.466	50	20	IDGD	
COc1cc([C@@H](C)NC(=O)NNC(=O)C(=O)NC2CC2)ccc1OCc1ccccc1	918232642	LOYUIRQAYUGJSH-CQSZACIVSA-N	426.473	1.944	50	20	IDGD	
O=C(CN1C(=O)[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)NNC(=O)c1ccc(F)cc1Br	918339972	YDNKZRUFQJLNLU-WDQYXFPCSA-N	436.237	1.156	50	20	IDGD	
Cc1oc(C(=O)OCC(=O)NNC(=O)c2cccs2)cc1S(=O)(=O)N1CCCC1	919286029	ZIWQUMCYTJIGHJ-UHFFFAOYSA-N	441.487	1.052	50	20	IDGD	
CCCn1c(C)cc(/C=C(/C#N)C(=O)NS(=O)(=O)N2CCC(C(=O)OC)CC2)c1C	919669331	RWHPZCANIOJFRW-PDGQHHTCSA-N	436.534	1.668	50	20	IDGD	
Cc1cccc(Oc2ccc(S(=O)(=O)NNC(=O)N[C@@H]3CCS(=O)(=O)C3)cc2)c1	919961254	YLQYGBNJHYBNPM-CQSZACIVSA-N	439.515	1.467	50	20	IDGD	
NC(=O)c1ccc(/C=C/C(=O)N2CCC[C@@H]2C(=O)NNC(=O)c2ccc(Cl)nc2)cc1	920037735	UHULOZHENHNSHA-ZWIJEDICSA-N	441.875	1.299	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)/C(=C\c1ccc(F)cc1)n1nnnc1C	920423466	WNUWTYCDAPXHIE-XDHOZWIPSA-N	448.462	1.878	50	20	IDGD	
C=C(Br)CNC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	921124628	DFNSJQTYFGLGAZ-UHFFFAOYSA-N	431.312	1.324	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@H](C(C)C)N1C[C@H](C)O[C@H](C)C1	921202944	MEKJZGQOTKFVID-LZWOXQAQSA-N	439.582	1.183	50	20	IDGD	
COC(=O)C[C@@H](NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)c1ccc(C)cc1	1318286455	KBGMTQFTIPDLDZ-GOSISDBHSA-N	440.504	1.636	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2OC(F)F)CC1)NNC(=O)c1ccccc1	1319903491	CNZQRVZVUUZPKT-UHFFFAOYSA-N	432.427	1.507	50	20	IDGD	
NC(=O)[C@H]1CCCN(c2ccc(C(=O)NNC(=O)c3cc(-c4cccs4)[nH]n3)cc2)C1	1324046839	ACNFFUHLNKSGET-AWEZNQCLSA-N	438.513	1.915	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)[C@@]3(F)CCOC3)c2)cc1	1326636505	OOXBOEQXEHGETC-LJQANCHMSA-N	437.449	1.386	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CC(=O)Nc2cc(C)on2)C1	1778075059	WKIYRHBTNKUYFQ-BXTJHSDWSA-N	440.928	1.843	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)Cn3c(=O)n(C)c4ccccc43)C2)C1	1778161575	HXMKKUUJGSJXGM-OPAMFIHVSA-N	448.951	1.577	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)COc3cc(Cl)ccn3)C2)C1	1779231890	BVXPSDMYARLTEV-SJCJKPOMSA-N	446.729	1.727	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@]2(C1)CN(C(=O)c1ccc3c(c1)CNC3=O)CCO2	1779297131	SLBOKWMAKSOLCX-NRFANRHFSA-N	431.565	1.225	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccnn1CCOC)C2	1780702289	BHTWUYPFHNSDDG-XAUMDUMWSA-N	426.945	1.674	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(C)cc3)C2)C1	1780769985	LDVKRULLKOUYGD-VAHWYXDJSA-N	437.500	1.573	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)c3cccc4c3NC(=O)C4)CCO2)C1	1781232211	HVTJPPXSGOXMJS-PMACEKPBSA-N	440.327	1.861	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(F)nc3F)CCO2)C1	1783340477	YMLHPEWJINFETG-YVEFUNNKSA-N	432.265	1.977	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)C(C)(C)CNC(C)=O)CCO2	1783343484	NJAOJALYGIGPNR-KSSFIOAISA-N	432.359	1.152	50	20	IDGD	
CC(C)c1nc(CC(=O)N2CCO[C@]3(CCN(C(=O)[C@H](C)Br)C3)C2)no1	1783529334	IMBITAWWOSYFRK-YVEFUNNKSA-N	429.315	1.349	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)CCC(=O)N3CCCC3)CCO2)C1	1783530232	VPXMINAAQSDLLT-RDTXWAMCSA-N	430.343	1.002	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3n[nH]c4c(F)cccc34)CCO2)C1	1783533723	GFDODHSFEIYUTF-BBATYDOGSA-N	439.285	1.929	50	20	IDGD	
O=C(OCCO)c1ccccc1C(=O)N1CCO[C@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783948093	BJOFVYZRWGIEOI-IBGZPJMESA-N	445.299	1.083	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3nccnc3OC)[C@H]2C1	1785652305	QADRNLPBMCPXMT-XUXIUFHCSA-N	441.326	1.252	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccoc3C)[C@H]2C1	1786015663	PBTRJERVNUBISD-MQLVQPQLSA-N	441.488	1.315	50	20	IDGD	
O=C(CCc1cccnc1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21	1787108021	RJEPKVJLEJSFLI-QBYUYEEZSA-N	428.302	1.684	50	20	IDGD	
CC(=O)O[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]21)C(C)C	1788480735	YLRXRQGMDDOJLA-ZAHIEGGZSA-N	437.364	1.790	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21)c1cccn(C(F)F)c1=O	1788800019	HBUIIHTUANZODC-DLOVCJGASA-N	438.258	1.640	50	20	IDGD	
C[C@H]1Oc2ccc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)[C@H](F)Cl)C[C@@H]43)cc2NC1=O	1789261858	DQPBFWKMCFERRA-OELWXQPESA-N	439.871	1.534	50	20	IDGD	
C[C@H](C(=O)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1)N1C[C@H]2C[C@H]2C1	1789440442	DCFHSSQKXJCOBL-QRQLOZEOSA-N	447.344	1.454	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc4ccnn34)C[C@@H]21)[C@H](F)Br	1789923651	ZQOIQCYMIGJLCT-MZGVZZPPSA-N	439.285	1.618	50	20	IDGD	
Cc1nccn1CCCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]2C1	1791064617	ATKVUVAEMSXCQP-IWCQGFGOSA-N	441.370	1.735	50	20	IDGD	
CC(=O)N(C)[C@@H](C)C(=O)NC1(c2ccc(NC(=O)CCC(=O)NN(C)C)cc2)CCC1	1791599982	OEAVQCFUNXLIKE-HNNXBMFYSA-N	431.537	1.360	50	20	IDGD	
O=C(Cc1ccc(Br)nc1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCl	1793115279	HKQPJRKVEBGOJM-XJFOESAGSA-N	430.730	1.625	50	20	IDGD	
CC(C)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CC(=O)N(C2CCCC2)C1	1793775421	HHDPBNXBZPKZRD-GGXPGOJBSA-N	439.984	1.632	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nnsc1C1CC1)C2	1795114479	OAJIPEAQBIATGG-PTEHBNRSSA-N	429.340	1.404	50	20	IDGD	
COc1nccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)Br)C3)c1F	1795911582	LNNZZAYYYAIIDX-DYNIEEOBSA-N	430.274	1.216	50	20	IDGD	
O=C(Cc1ccccc1Cl)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1	1796187319	XTRBDKBENOKROE-REPLKXPHSA-N	426.709	1.514	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1[nH]nc2ncccc12	1796219595	IYQFZZOLYNXEEI-ZMJPVWNMSA-N	436.310	1.335	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H]1CCCCN1C)C2	1796889784	RGMFSXSJIFECRT-HPQGMATESA-N	428.537	1.243	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnc2ncccn12	1797029838	NMXURBDYNQFKAR-QVHKTLOISA-N	436.310	1.106	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CN(Cc2ccccc2)CCO1	1797853295	CDLLCIOCPUUZNF-XNTOXWQXSA-N	449.979	1.779	50	20	IDGD	
O=C(CCBr)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc2c1NC(=O)C2=O	1798207678	FVHOSYLLRUBTLY-ZSBIGDGJSA-N	434.290	1.858	50	20	IDGD	
C[C@@H](Nc1cccnc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@](C)(Cl)CCl	1799275044	LUUDWXCRSMEUJA-TWAUDHPGSA-N	429.348	1.708	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](F)Br	1800156793	BHEOORBJHZZACD-QVHKTLOISA-N	427.274	1.140	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1Cc2ccccc2N1	1800315055	OUIVLTQLDGFVFT-CNGORYIKSA-N	436.350	1.644	50	20	IDGD	
COCCOCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C#N)=C/c1ccc(F)cc1F	1800332387	GGWAUCSEMYQZAW-RNCDSHHQSA-N	449.454	1.124	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c[nH]c3ncccc13)C2	1800641280	WOVPAYJDLOSRQU-NOXHYTERSA-N	435.322	1.940	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CCCO1	1800731331	BYBHFXHDIOCOQY-DRZPZYELSA-N	431.439	1.640	50	20	IDGD	
CC(C)(C)OC(=O)NC(C)(C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(Cl)Cl	1801015619	QQEUQONINMCCBZ-ZSBIGDGJSA-N	438.352	1.683	50	20	IDGD	
O=C(CCc1cccc(O)c1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2	1801123188	FJSBBKVAIKLCQC-CCWDJLKJSA-N	425.323	1.699	50	20	IDGD	
CCOC(=O)O[C@@H](C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2	1801293934	UVMILHJOFXLWNF-CJDYHMCNSA-N	447.492	1.320	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)COCCNC(=O)OC(C)(C)C)C2	1802283861	QUSSCLSSIQXLJR-QKPAOTATSA-N	447.960	1.420	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)C(C)(C)C#N)[C@H]1c1cccnc1	1802686493	LCNNFRKTFYOFSG-WXBYGLBUSA-N	449.515	1.771	50	20	IDGD	
Cn1nncc1C(=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@H]1c1cccnc1	1804750647	XTPURDCUJJRTTR-FPMFFAJLSA-N	425.262	1.220	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@H](CNC(=O)CN2CCCC2=O)[C@H]1c1cccnc1	1806923723	DKFPOTYEKZAAJL-CVAIRZPRSA-N	441.359	1.946	50	20	IDGD	
CN1CCN(C2(C(=O)NC[C@@H]3CCN(C(=O)[C@H](F)Cl)[C@@H]3c3cccnc3)CC2)CC1	1807943416	ZMJNZEFJLIVBKX-KSZLIROESA-N	437.947	1.402	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)c1c[nH]c2nccc-2c1	1808077839	ROXLFVALYLSTCD-SZMVWBNQSA-N	427.892	1.829	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2nc3ncccn3n2)[C@H]1c1cccnc1	1808265238	LDALVLRCKMMEGQ-PMPSAXMXSA-N	427.896	1.856	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1CCN(C(=O)c2cc(O)ncn2)[C@@H]1c1cccnc1	1810540743	PWIMXPZPIKEPSJ-HNAYVOBHSA-N	429.553	1.748	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)Cc2ccn(C)n2)[C@H]1c1cccnc1	1812864570	PZNMGRGCPJTNQF-JOQOYGCGSA-N	434.338	1.847	50	20	IDGD	
CCc1cc(C(=O)N2CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)no1	1813074052	QMWRXQUEHPSPTC-KKSFZXQISA-N	442.520	1.325	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)[C@H]2CC[C@H](O)CC2)[C@@H]1c1cccnc1	1813075038	WXQVZHQUXOOEAW-JLEJFLCFSA-N	445.564	1.012	50	20	IDGD	
C[C@H](C(=O)NC[C@H]1CCN(C(=O)CO[Si](C)(C)C)[C@@H]1c1cccnc1)n1cncn1	1813402468	QRMDXVCDEWOPCL-SZVBFZGTSA-N	430.585	1.792	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCc2nc(NC(=O)CN)sc2C1	1814785201	HTTIRJSSGNKDIH-SNVBAGLBSA-N	433.446	1.161	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cnn(-c3cccnc3)c2)[nH]n1)[C@H](O)CCl	1814869480	QJNSBTBUUJBGSI-IAGOWNOFSA-N	443.895	1.896	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](C)CC(N)=O)n[nH]1	1815291553	OOLUMCPDWHVSJZ-NQBHXWOUSA-N	428.331	1.944	50	20	IDGD	
O=C(CSc1ncccn1)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)CCl)CC2	1815624072	YJGAHIULFYMPQY-KOLCDFICSA-N	427.939	1.237	50	20	IDGD	
C[C@@]1(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)CC1(F)F	1817474952	IAVAKKCHCFWNRK-KXBFYZLASA-N	432.236	1.441	50	20	IDGD	
Nc1n[nH]c(CCC(=O)Nc2cc([C@@H]3CCCCN3C(=O)[C@@H](F)Br)[nH]n2)n1	1819286199	NIYOKYYEWVAZGJ-TVQRCGJNSA-N	443.281	1.425	50	20	IDGD	
O=C(/C=C\C(=O)NC1CC1)Nc1nc2c(s1)C[C@@H](NC(=O)CCBr)CC2	1819525863	ABYDPXDMUTWILC-GZTOBOFZSA-N	441.351	1.675	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](C)n3ccccc3=O)sc2C1	1820130879	LWZNUCHLAZUYSG-UPJWGTAASA-N	438.937	1.732	50	20	IDGD	
CN1N=C(C(=O)N[C@@H]2CCc3nc(NC(=O)[C@](C)(Cl)CCl)sc3C2)CCC1=O	1822861012	UEWVAKPKYZTLLU-VVVCHXIZSA-N	446.360	1.900	50	20	IDGD	
CCOCCC(=O)Nc1cc([C@H]2CCCCN2C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[nH]n1	1822930799	KTAZTWQDVSXPDC-PTZPRWATSA-N	443.508	1.962	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnccc1F)CC2	1826085416	RTGOAGDUVFCFON-NSHDSACASA-N	434.497	1.276	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccnc3S)CCO2)C1	1829798913	RCIIJLVJVRTWID-QZTJIDSGSA-N	448.372	1.677	50	20	IDGD	
Cc1cc(/C=C/C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)no1	1830364670	OKBZVKDVEWKCHK-SGSXCFNPSA-N	425.913	1.718	50	20	IDGD	
Cc1ccc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)o1	1830545425	JHGNHJCRCFPYJH-AUUYWEPGSA-N	443.338	1.618	50	20	IDGD	
COc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)cc1Cl	1830738754	UQEWXEANNPAZLD-KXBFYZLASA-N	447.315	1.018	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cn(C)nc3C(F)F)C2)C1	1831645842	DVDKKOPBIAZLLN-LIRRHRJNSA-N	448.898	1.835	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1	1831874426	JFAXPFGUMRODAK-HOCLYGCPSA-N	445.402	1.763	50	20	IDGD	
COc1ccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)cc1C	1832093964	NJMYEHAGWBAGLH-FQEVSTJZSA-N	445.343	1.806	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cc(F)cc(F)c3F)CC2)CC1)[C@H](O)CCl	1833313029	QZKPQFLTXKYSTB-QGZVFWFLSA-N	447.885	1.889	50	20	IDGD	
COc1ncccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1	1834131223	STWXQNKOGIJSKR-OALUTQOASA-N	446.331	1.397	50	20	IDGD	
Cc1ncsc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1	1834267869	KKVKRXJZZNUYOB-SJORKVTESA-N	436.361	1.758	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)C[C@@H](N)c3cccnc3)CCO2)C1	1835824969	NDIWZALBMZUULT-DYESRHJHSA-N	438.956	1.193	50	20	IDGD	
C[C@H](Cn1cccn1)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836715739	YLZGKDBMOZVPIY-QAPCUYQASA-N	426.945	1.118	50	20	IDGD	
CCn1nccc1C(=O)N1CCC(OC2CCN(C(=O)[C@@H](Cl)COC)CC2)CC1	1837543951	UEKJDUSNDZWSBH-KRWDZBQOSA-N	426.945	1.769	50	20	IDGD	
O=C(c1cc2cc[nH]c2cc1F)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1838571744	AXEFJPGNEKBJIK-LPHOPBHVSA-N	427.835	1.911	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCBr)C3)C2)cc1	1838981442	FWEVMYMVOLVVIK-LJQANCHMSA-N	425.323	1.850	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3c(F)ccc(O)c3F)CCO2)C1	1839411796	KKQLKKLVGUEWQD-BUXKBTBVSA-N	432.851	1.758	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc4ccoc34)CCO2)C1	1839588161	POGXJLJDGRNZBC-DYESRHJHSA-N	436.892	1.757	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3ccccc3C)CCO2)C1	1839942994	SSNUOHVXXVSVTQ-KNQAVFIVSA-N	438.952	1.638	50	20	IDGD	
C[C@H](Nc1cccnc1)C(=O)N1CCOC[C@@]2(CN(C(=O)C(Cl)Cl)CCO2)C1	1840188070	MBCWYYORQRLHHC-UGSOOPFHSA-N	431.320	1.142	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccc(OC)c(F)c3)CCO2)C1	1840526131	ABHFJHLQBKIHQM-IIBYNOLFSA-N	442.915	1.851	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)COc3ccccc3C#N)CCO2)C1	1840820364	LXGHKIQPLDXUNS-LAUBAEHRSA-N	435.908	1.411	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)Cc2c(F)cccc2Cl)C1	1841206119	KLYQWSVBLYCKKI-UHFFFAOYSA-N	430.672	1.219	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)CC[C@H]2CNc3ccccc3C2)C1	1842957908	RVRPJDIGILEYJZ-GOSISDBHSA-N	441.576	1.627	50	20	IDGD	
O=C([C@H]1C[C@H]1c1ccc(Cl)cc1)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843011341	UCUJPIZIDVRGGM-PMACEKPBSA-N	438.720	1.641	50	20	IDGD	
O=C(Cc1ccc(F)cc1Cl)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843013078	GISLGHJYCLNMFT-UHFFFAOYSA-N	430.672	1.219	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)Cc2cc(F)cc(F)c2)C1	1843075654	FMOHHAHHHOEPLB-UHFFFAOYSA-N	429.427	1.023	50	20	IDGD	
CC(C)Oc1ccc(C(=O)N2CCCC23CN(C(=O)CCC(=O)NN(C)C)C3)c(F)c1	1845526612	JPIDWMYLFGMSKR-UHFFFAOYSA-N	434.512	1.803	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCCC12CN(C(=O)CN1CCOC1=O)C2	1845870319	ARNYXHMMLUIMIJ-OVCLIPMQSA-N	430.411	1.527	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC12CN(C(=O)c1ccc3c(c1)n(C)c(=O)n3C)C2	1846176928	NKGLXFXVUSAUNU-LBPRGKRZSA-N	435.322	1.477	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC12CN(C(=O)Cn1c(=O)n(C)c3ccccc31)C2	1846177246	FPXGEJYHAGDLOC-ZDUSSCGKSA-N	435.322	1.327	50	20	IDGD	
Cc1sc2ncn(CCC(=O)OCC(=O)NNC(=O)c3cccs3)c(=O)c2c1C	23565482	QSOLMXLIXNUJDV-UHFFFAOYSA-N	434.499	1.531	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)N2CCN(C[C@@H]3CCCO3)CC2)N(C)c2ccccc21	109110386	NNOINEZGNWYDML-SFHVURJKSA-N	437.544	1.980	50	20	IDGD	
O=C(NNc1nc(-c2ccncc2)no1)[C@@H]1CCCN(S(=O)(=O)c2ccc(F)cc2)C1	110375183	PVXRKRKSHKOFKQ-CQSZACIVSA-N	446.464	1.815	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(\C#N)C(=O)N2CCN(CC(=O)N3CCCC3)CC2)c1C	206012093	PIMKSZIDODSFJS-KWJZBXMYSA-N	441.576	1.986	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)c2sccc2S(=O)(=O)Nc2cnn(C)c2)c(O)c1	725887946	BZIUNZRSGAZOFZ-UHFFFAOYSA-N	435.487	1.371	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NC1CCN(c2ccc(C#N)cn2)CC1	727605608	QJUZPZUUYSEGSG-AWEZNQCLSA-N	426.452	1.859	50	20	IDGD	
C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)cc2[N+](=O)[O-])C1	728369893	WBPFIUUBACUVRE-NFAWXSAZSA-N	438.506	1.273	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cccnc2OCC(C)C)cc1	728511484	PLHIQNWWKQUJGB-UHFFFAOYSA-N	434.518	1.507	50	20	IDGD	
O=C(CN1C(=O)NC2(CCCC2)C1=O)NNC(=O)c1ccc(Br)cc1Cl	728832491	NKDXBSSZZUCTFX-UHFFFAOYSA-N	443.685	1.728	50	20	IDGD	
CC(=O)[C@H]1CC(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)=NN1c1ccccc1	728846503	OFUAGERADJIPNW-LJQANCHMSA-N	435.488	1.064	50	20	IDGD	
CCOC(=O)Cc1csc(NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)n1	728938652	LTAUTHPRSCZBPF-UHFFFAOYSA-N	433.494	1.108	50	20	IDGD	
CC(C)c1c(C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)cnn1-c1ccc(Cl)cc1	729276704	KVRRLTZYVMWSBQ-NSHDSACASA-N	427.914	1.348	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1)N(C)C1CC1	729618107	ZXHFJXOSJHPLCR-INIZCTEOSA-N	448.531	1.815	50	20	IDGD	
COC(=O)c1ccc(COc2ccc(C=NNC(=O)[C@@H]3CCS(=O)(=O)C3)cc2)cc1	730576496	QYZMDHUTYHZSFY-GOSISDBHSA-N	430.482	1.937	50	20	IDGD	
COC(=O)N[C@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)C(C)C	730997287	PIRBXEOBTXYBEW-INIZCTEOSA-N	440.522	1.003	50	20	IDGD	
CC(C)c1ccc(-n2ccnc2SCC(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)cc1	732307848	PENIIWJSENTHLT-OAHLLOKOSA-N	436.559	1.670	50	20	IDGD	
O=C(Cc1cccc2ccccc12)NNC(=O)NCCS(=O)(=O)NC[C@@H]1CCCCO1	732474188	JQTTYMHIBONXFT-SFHVURJKSA-N	448.545	1.201	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2cc(Br)cc(C)c2N)n1	733016389	BZQOIHLXYROFDI-UHFFFAOYSA-N	441.307	1.652	50	20	IDGD	
O=C(COC(=O)c1cc(Cl)nc(N2CCCC2)c1)NNC(=O)c1ccc([N+](=O)[O-])cc1	733021356	IKFBDTGMXPYJAL-UHFFFAOYSA-N	447.835	1.861	50	20	IDGD	
CCOCCCN1CC[C@H](NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)[C@@H](C)C1	734682533	BXDIBUMYSFFOOB-YJBOKZPZSA-N	444.536	1.015	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc2c(c1)C(=O)NCC2)c1cc(F)ccc1Br	734807393	NLDKUMGOXUJDRK-UHFFFAOYSA-N	442.266	1.497	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)CN2CCN(c3ccccn3)CC2)cc1C	741038851	GYTIUJBSIPTEEY-UHFFFAOYSA-N	445.545	1.140	50	20	IDGD	
CC(C)(NS(C)(=O)=O)C(=O)NNC(=O)c1cn(-c2ccccc2)nc1-c1ccccc1	742040601	QGTUZDZNKGFORK-UHFFFAOYSA-N	441.513	1.628	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)Cc1ccc(NC(=O)C2CC2)cc1	742476600	BBMUTXWJUXSYEA-UHFFFAOYSA-N	443.529	1.640	50	20	IDGD	
CN(CCc1ccccn1)C(=O)CNC(=O)NNC(=O)Nc1ccc(OC(F)F)cc1	743584056	ZFXQQOXCUIJLGU-UHFFFAOYSA-N	436.419	1.720	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)N[C@@H](C)[C@@H](C)N2CCOCC2)cc1Cl	743627060	RTKAFLJXMHPIAR-NWDGAFQWSA-N	429.905	1.802	50	20	IDGD	
N#Cc1ccc(CS(=O)(=O)CC(=O)NNC(=O)Nc2ccc(OC(F)F)cc2)cc1	743832854	DAFAKMGHORGHOH-UHFFFAOYSA-N	438.412	1.927	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)CNC(=O)c2ccc(Cl)c(Cl)c2)c1	744564418	LZJULFFTQMTOLH-UHFFFAOYSA-N	449.250	1.599	50	20	IDGD	
Cc1ccn(-c2ccc(C(=O)NNc3ccccc3S(=O)(=O)N3CCOCC3)cc2)n1	744622515	WNHPATUTIUZDIR-UHFFFAOYSA-N	441.513	1.959	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)NCc1cc(Br)c(OC)c(OC)c1	748625526	SIQWNNHZIQWRRN-JTQLQIEISA-N	434.287	1.348	50	20	IDGD	
COc1ccc(-c2cnc(CCC(=O)NNC(=O)CNC(=O)c3cccs3)o2)cc1	751212071	ONBLXUMAUFMSMM-UHFFFAOYSA-N	428.470	1.922	50	20	IDGD	
CCSc1ccc(CC(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cc1	752127172	JKJVRMULOQFWJD-UHFFFAOYSA-N	440.569	1.947	50	20	IDGD	
COC[C@@H](C)n1c(C)cc(/C=C(/C#N)C(=O)N2CCC(O)(CN3CCOCC3)CC2)c1C	752740555	OLUBVDPCUHCALV-HBEGMLAUSA-N	444.576	1.905	50	20	IDGD	
CCn1cc([C@H]2C[S@@](=O)CCN2C(=O)NNC(=O)c2cccc(OC(F)F)c2)cn1	753130507	MICCTJMJIHIHAM-FOGNVHKLSA-N	441.460	1.664	50	20	IDGD	
O=C(NNC(=O)N1CCO[C@H](CCc2ccccc2)C1)C1CCN(c2ncccn2)CC1	754187427	TWSLFXMXCCPHDF-HXUWFJFHSA-N	438.532	1.767	50	20	IDGD	
O=C(CCc1cccc([N+](=O)[O-])c1)NNC(=O)CCN1CCN(c2ccccc2)CC1	755058497	GCPJOMNDHDKLRN-UHFFFAOYSA-N	425.489	1.887	50	20	IDGD	
COc1ccc(S(=O)(=O)NC2CC2)cc1NC(=O)NNC(=O)c1ccccc1OC	755614731	RRUCVHLDXRUQLW-UHFFFAOYSA-N	434.474	1.611	50	20	IDGD	
CC(C)CC(=O)NNC(=O)Nc1ccc(CC(=O)N2CCN(c3ncccn3)CC2)cc1	755692408	PKKXSDQMJQVQTM-UHFFFAOYSA-N	439.520	1.567	50	20	IDGD	
Cc1nc(-c2ccccc2NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)no1	755958270	SWELMVWTYCGFIN-UHFFFAOYSA-N	444.473	1.762	50	20	IDGD	
CN1CCC/C1=N\S(=O)(=O)c1cccc(NC(=O)NNC(=O)Cc2cccnc2)c1	756033658	ZGPZZWQCJFYXND-JJIBRWJFSA-N	430.490	1.290	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)N[C@H]2CCN(c3c(F)cccc3F)C2=O)cc1	756212871	SLQAIXJCIWINJU-INIZCTEOSA-N	434.399	1.488	50	20	IDGD	
O=C(NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)Nc1nnc(C(F)F)s1	756220732	VELYPDYQPMICGL-UHFFFAOYSA-N	446.461	1.727	50	20	IDGD	
COC(=O)CCCc1nnc(NC(=O)NNC(=O)COc2ccc(Cl)cc2)s1	756683835	IVGQJPMKKPDDQA-UHFFFAOYSA-N	427.870	1.919	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)CN2C(=O)NC3(C[C@H](C)C[C@@H](C)C3)C2=O)c1C	756866722	FGTHSTDKROPCMT-CKEIUWERSA-N	444.532	1.965	50	20	IDGD	
COc1ncnc(N(C)C)c1NC(=O)NNC(=O)c1ccc(F)cc1Br	757708614	IDIUPHUQHUIVMH-UHFFFAOYSA-N	427.234	1.919	50	20	IDGD	
COCCCS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1	757822004	FCVDTPFBGZZUTN-UHFFFAOYSA-N	449.485	1.735	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)N[C@@H]2CN(C(=O)OC(C)(C)C)C[C@@H]2C#N)nc2ccccc21	758771000	MXJYINFNNGEXBX-DZGCQCFKSA-N	441.492	1.205	50	20	IDGD	
O=C(N=c1cc[nH]cc1I)NNC(=O)c1cccc([N+](=O)[O-])c1	760033475	HQNJUYFFQYBZNP-UHFFFAOYSA-N	427.158	1.483	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)C(=O)Nc1ccnn1Cc1ccc(F)cc1	760277667	OTLJWASSAKMVRR-UHFFFAOYSA-N	449.240	1.561	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1ccnn1-c1nc(C)cc(C)n1	760277759	QMYMMHLJNLVSFY-UHFFFAOYSA-N	443.851	1.341	50	20	IDGD	
O=C(NNc1ncc(F)cn1)c1ccc(Cl)c(S(=O)(=O)NC[C@H]2CCCO2)c1	760905499	JHJRYVAUWLBONT-GFCCVEGCSA-N	429.861	1.483	50	20	IDGD	
Cc1ccc(C(=O)NNS(=O)(=O)c2cc(Br)cc(C(=O)O)c2)c(O)c1	762468464	XASOUUSNKGKQBW-UHFFFAOYSA-N	429.248	1.785	50	20	IDGD	
COCCn1nc(C)c(NC(=O)C(=O)NNC(=O)c2ccccc2Br)c1C	763482856	LTNBUCZIZBPUKT-UHFFFAOYSA-N	438.282	1.309	50	20	IDGD	
CCOc1ccccc1NC(=O)C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	763529941	DHNRVGUYYQYGEG-UHFFFAOYSA-N	439.516	1.384	50	20	IDGD	
O=C(NNC(=O)c1c[nH]c2ccccc12)C(=O)Nc1cccc(-c2nnnn2C2CC2)c1	763539866	AOSJGELTJGMLJM-UHFFFAOYSA-N	430.428	1.556	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(N3CCOC3=O)c2C)cc1OC	763543222	MVKAVWARGYOVMU-UHFFFAOYSA-N	442.428	1.369	50	20	IDGD	
Cc1nn(-c2ccc(C#N)cc2)c(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)c1C	763550580	GEVLCHQCLKOHDC-UHFFFAOYSA-N	446.423	1.489	50	20	IDGD	
COCCCOc1ccccc1NC(=O)C(=O)NNC(=O)[C@H]1COc2ccccc2O1	763574326	YWXDYZORGOUQRH-GOSISDBHSA-N	429.429	1.028	50	20	IDGD	
CC[C@H](C)n1ncc(NC(=O)C(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])c1C1CC1	763802383	DJPJTTUVNRXRSP-LBPRGKRZSA-N	444.448	1.805	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)C(=O)Nc1cccc(CCN2CCCC2)c1	763839307	DSJPYBWNWQQJLO-UHFFFAOYSA-N	428.464	1.629	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)Cc2c[nH]c3ccccc23)c(Br)n1	763859227	ZHRGUDWLZWAIQC-UHFFFAOYSA-N	430.262	1.962	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccc(C(=O)NC(C)(C)C)cc1	763865457	QGJCQLKAMANMDR-CYBMUJFWSA-N	444.463	1.907	50	20	IDGD	
COCC[S@](=O)Cc1cccc(NC(=O)C(=O)NNC(=O)Cc2ccc(F)cc2)c1	763918299	BDNDNPCQKKIGKJ-PMERELPUSA-N	435.477	1.049	50	20	IDGD	
CC(C)(C)S(=O)(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)Cc2ccc(F)cc2)c1	763932921	VSYCBHGOBKAKJP-UHFFFAOYSA-N	449.504	1.868	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)Nc1cc2c(cc1Cl)OCO2	764003128	YWHOMJPVQJZLSA-UHFFFAOYSA-N	443.641	1.569	50	20	IDGD	
O=C(NNC(=O)c1cccc(C(F)(F)F)c1)C(=O)Nc1ccn(CCc2ccncc2)n1	764037159	JHGMWHQUSCBVCN-UHFFFAOYSA-N	446.389	1.939	50	20	IDGD	
C[C@H]1C[C@@H](C)C[C@]2(C1)NC(=O)N(CC(=O)NNC(=O)CSc1ccccc1O)C2=O	764045262	HJXNTEYSTKNAOA-NXCRSVRDSA-N	434.518	1.378	50	20	IDGD	
CCNC(=O)N1CCc2ccc(NC(=O)C(=O)NNC(=O)c3cccc4ncccc34)cc21	764258323	ZCCAWQPDLWBHPF-UHFFFAOYSA-N	446.467	1.727	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C(=O)Nc1ccc(OCC(=O)OC)cc1C)c1ccccc1	764332621	VSHDTEZTPVQQOB-KRWDZBQOSA-N	427.457	1.827	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)c(Cl)c1)C(=O)Nc1ccccc1C(=O)N1CCCC1	764349737	UMLPFAXMGWAQCR-UHFFFAOYSA-N	430.848	1.681	50	20	IDGD	
CCCN(CCC)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)Cc2ccncc2)cc1	764354775	WVZQAXQKHZMQKB-UHFFFAOYSA-N	425.489	1.672	50	20	IDGD	
CO[C@H](C)C(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)c1	764401178	NKJHBOABFUUYIH-GFCCVEGCSA-N	446.485	1.244	50	20	IDGD	
CCOC(=O)/C=C/c1ccc(NC(=O)C(=O)NNC(=O)c2cncc(NC(C)=O)c2)cc1	764432622	HOZOPLSDOSWQSL-RMKNXTFCSA-N	439.428	1.016	50	20	IDGD	
NC(=O)COc1ccc(C=NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)cc1	764841939	VMRCAZZDNUAXKO-UHFFFAOYSA-N	443.935	1.472	50	20	IDGD	
COc1cc2c(cc1OC)CN(C(=O)CCC(=O)NNC(=O)Cc1cccnc1)CC2	765418931	DOLNUHKNSPKJOI-UHFFFAOYSA-N	426.473	1.154	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)[C@H]1CCCN(C(=O)c2ccccc2)C1	767340385	QKDCXSWGHCOIJB-FQEVSTJZSA-N	437.496	1.781	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)N1CCNC(=O)[C@H]1c1ccccc1Br	767731926	KOCNMCUQRFNTNB-MLGOLLRUSA-N	425.327	1.504	50	20	IDGD	
COc1cc2c(cc1NC(=O)C(=O)NNC(=O)c1cc3ccccc3cc1O)NC(=O)CC2	768234017	QJOLTBAIBSWDBU-UHFFFAOYSA-N	448.435	1.838	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)CNC(=O)c1ccc(Br)cc1	771867947	NDQKSPURDLSZKL-NSHDSACASA-N	428.283	1.304	50	20	IDGD	
CC(=O)N1CCN(S(=O)(=O)c2ccc(C(=O)NNc3nccnc3C(C)C)cc2)CC1	772834904	ZURIYMXOWBLSDD-UHFFFAOYSA-N	446.533	1.210	50	20	IDGD	
CC1CCC(NS(=O)(=O)CC(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)CC1	772968688	SIGCZGWRRTXLFF-OWYJLGKBSA-N	431.942	1.753	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NNC(=O)c2ccc(N3CCNC3=O)cc2)C1	773416562	CETGIURHTUEDFJ-OAHLLOKOSA-N	431.493	1.624	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)[C@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1S(C)(=O)=O	773420984	YXOKIGJGHMGUOU-HNNXBMFYSA-N	439.534	1.807	50	20	IDGD	
Cn1nc(CCNC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)c2ccccc21	773473638	NNVFMMKNGQUKJG-UHFFFAOYSA-N	430.490	1.555	50	20	IDGD	
CN1CCN(C(=O)c2ccc(NC(=O)C(=O)NNc3cnc4ccccc4n3)cc2)CC1	773717100	XTACHESHFKTGIU-UHFFFAOYSA-N	433.472	1.099	50	20	IDGD	
Cc1c(Cl)cccc1NNC(=O)C(=O)Nc1cnn(CC(=O)N2C[C@@H](C)O[C@H](C)C2)c1	773768141	KUXIVDRMAIVBLC-CHWSQXEVSA-N	448.911	1.563	50	20	IDGD	
COc1ccccc1C(=O)NNS(=O)(=O)c1ccccc1S(=O)(=O)N1CCCC1	775281220	MPZJHVAOYRIYBZ-UHFFFAOYSA-N	439.515	1.103	50	20	IDGD	
Cn1cc([C@H](NC(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)c2ccc(F)cc2)cn1	776196763	JTGPSBDNEXPLKJ-QGZVFWFLSA-N	428.380	1.907	50	20	IDGD	
CC(CCn1cccn1)=NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	776758399	LFJXETKLYHUYPK-UHFFFAOYSA-N	433.534	1.419	50	20	IDGD	
CC(C)(C)OC(=O)NC(C)(C)C(=O)N1CCN(S(=O)(=O)CBr)CC1	777832663	QFJNMXYCQDGDDZ-UHFFFAOYSA-N	428.349	1.116	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)NCCc1nc(-c2ccc(Cl)cc2)no1	778662942	WXSRCOMDKAJVRM-UHFFFAOYSA-N	438.872	1.788	50	20	IDGD	
COCCN1C(=O)CCc2cc(NC(=O)C(=O)NNC(=O)c3ccc(Cl)nc3)ccc21	778712799	ITHWSFYMNOXVDF-UHFFFAOYSA-N	445.863	1.060	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)C(=O)Nc1cc(Cl)ccc1OC[C@@H]1CCOC1	778713932	OFQIANVHWWIRAE-CQSZACIVSA-N	432.864	1.479	50	20	IDGD	
CO[C@@]1(C(F)(F)F)CCCN(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)C1	780947092	RBZRALVZIMXWQJ-HNNXBMFYSA-N	437.444	1.377	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(C(=O)CCC(=O)NNc3ccnc(F)c3)CC2)cc1	781361932	AQQMPDXXRJHHTN-UHFFFAOYSA-N	449.508	1.286	50	20	IDGD	
CS(=O)(=O)N1CCc2c(NC(=O)C(=O)NNc3nc4ccccc4s3)cccc21	782814696	VPEXYTOEWFQBDV-UHFFFAOYSA-N	431.499	1.700	50	20	IDGD	
Cc1ccc(Cl)c(NC(=O)C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)c1	782896303	FHTWVDGIJIXFAZ-UHFFFAOYSA-N	437.909	1.650	50	20	IDGD	
O=C(NNC(=O)C(=O)N1CCCC1)C(=O)Nc1ccccc1Nc1c(F)cccc1F	784000194	QBSHQGBSDJWMFS-UHFFFAOYSA-N	431.399	1.417	50	20	IDGD	
COc1ccc2c(c1)CCN(C(=O)NNC(=O)c1csc(N3CCOCC3)n1)CC2	784060900	KKGKCDLYSJTWNF-UHFFFAOYSA-N	431.518	1.444	50	20	IDGD	
Cc1cc(N2CCC(NC(=O)NNc3nc(O)c4cnn(C(C)(C)C)c4n3)CC2)n[nH]1	784659072	RQKYRBIRGOFQQU-UHFFFAOYSA-N	428.501	1.614	50	20	IDGD	
COc1ncnc(N(C)C)c1NC(=O)C(=O)NNc1ccc(F)cc1Br	784803986	YEPXTVJOBGXNMO-UHFFFAOYSA-N	427.234	1.535	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(NC(=O)C(=O)NNc2ccc(Cl)nc2)ccc1Cl	784869892	RPUYNLGQOHKGSS-UHFFFAOYSA-N	432.289	1.721	50	20	IDGD	
Cn1ccnc(NNC(=O)C(=O)Nc2cnccc2-c2ccc(C(F)(F)F)cc2)c1=O	785090581	TVWHASANVYLIOR-UHFFFAOYSA-N	432.362	1.943	50	20	IDGD	
N#Cc1ccc(NNC(=O)C(=O)Nc2cccc(N3CCCS3(=O)=O)c2)cc1Cl	785095010	NVHXVSGEMKVSRY-UHFFFAOYSA-N	433.877	1.833	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2nn(-c3cccc(F)c3)cc2O)c2ccccc2c1=O	785688400	BICHFYPYQIFIIL-UHFFFAOYSA-N	436.403	1.522	50	20	IDGD	
Cc1ccc(C(=O)NCC2CC2)cc1NC(=O)C(=O)NNC(=O)COc1ccccc1C#N	785990356	FEYDFGNMUZJDAT-UHFFFAOYSA-N	449.467	1.171	50	20	IDGD	
Cc1ccc(N2CCNC2=O)cc1NC(=O)NNC(=O)COc1ccccc1[N+](=O)[O-]	786242280	GLAQRJUXICXZPW-UHFFFAOYSA-N	428.405	1.665	50	20	IDGD	
Cc1ccc(-n2cc(NC(=O)C(=O)NNC(=O)[C@H]3COc4ccccc4O3)cn2)c(C)c1	786414380	MWMLCQXEOQUWBE-LJQANCHMSA-N	435.440	1.415	50	20	IDGD	
CN1CCN(c2ccc(NC(=O)C(=O)NNc3ccccn3)cc2Br)CC1	787894593	OMFZMPUZJZPFJU-UHFFFAOYSA-N	433.310	1.678	50	20	IDGD	
C=CCn1c(S)nc2cc(C(=O)NNc3ccccc3S(N)(=O)=O)ccc2c1=O	788229827	DGYQJLLMPMONEA-UHFFFAOYSA-N	431.499	1.276	50	20	IDGD	
CN(NS(=O)(=O)c1ccc([N+](=O)[O-])cc1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	788914824	GKNLSGKNTKRTBT-UHFFFAOYSA-N	443.482	1.393	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cnnn2-c2cccc(F)c2)cc1OC	789106530	ZLIZBFBCIQEVNZ-UHFFFAOYSA-N	443.391	1.042	50	20	IDGD	
O=C(NNC(=O)N1CCC[C@H](N2CCCS2(=O)=O)C1)c1c(Cl)cccc1Cl	789839738	MGZRUQAHXSZPSH-NSHDSACASA-N	435.333	1.848	50	20	IDGD	
COC(=O)c1cc(Cl)cc(S(=O)(=O)NNC(=O)COCc2ccccc2)c1OC	790068288	HJPAWPZWQPLVCY-UHFFFAOYSA-N	442.877	1.662	50	20	IDGD	
C[C@@H]1CC(=O)C[C@@H](C(=O)NNC(=O)OC(C)(C)C)[C@@H]1C(=O)NNC(=O)OC(C)(C)C	791123799	KFWDIJCLQMYZHE-RAIGVLPGSA-N	428.486	1.330	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)C1=C(C)N(C)c2ncnn2[C@H]1C	791462090	FEGXLSUJSIKQLW-NSHDSACASA-N	448.867	1.229	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)CCN2CCN(C(=O)OC(C)(C)C)CC2)c1	792015438	WVFFRYXKSDGMRJ-UHFFFAOYSA-N	434.537	1.772	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3C[C@@H](C)O[C@H](C)C3)c2)n1	794074618	CPVXIGOTJQIYIL-HUUCEWRRSA-N	432.502	1.263	50	20	IDGD	
COC(=O)c1cc(F)cc(NC(=O)C(=O)NNC(=O)Cc2c[nH]c3ccccc23)c1F	796989658	JJZOCVNVCHXDPJ-UHFFFAOYSA-N	430.367	1.561	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(F)c(N2CCOC2=O)c1	796991891	RGNDIHQFKYNIBG-UHFFFAOYSA-N	431.336	1.090	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc(S(=O)(=O)NC(C)C)ccc2F)cc1	801105531	GSIMVUHRGVYHJX-UHFFFAOYSA-N	436.465	1.221	50	20	IDGD	
O=C(CCCN1C(=O)CNC1=O)NNc1c(Br)cccc1Br	801502169	AOENEAZBEPBRLP-UHFFFAOYSA-N	434.088	1.987	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)[C@@](C)(O)Cn2cc(C(F)(F)F)ccc2=O)cc1	802060192	BCINOOUHZCWTFK-KRWDZBQOSA-N	428.367	1.480	50	20	IDGD	
N#Cc1ccc(N2CC[C@@H](C(=O)NNC(=O)c3csc(N4CCOCC4)n3)C2)c(F)c1	804169185	QSSJBOJLPLVTJD-CQSZACIVSA-N	444.492	1.278	50	20	IDGD	
O=C(NNC(=O)c1ccc2oc(O)nc2c1)c1cccc(S(=O)(=O)N2CCCCC2)c1	805153967	IEMLPEHYGIKBAC-UHFFFAOYSA-N	444.469	1.783	50	20	IDGD	
CCc1nnc(NC(=O)[C@H](C)[C@@H](C)NC(=O)NNC(=O)c2cccc(N(C)C)c2)s1	805878242	GRRQULOZILVWPQ-VXGBXAGGSA-N	433.538	1.774	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2cnc(C3CCCC3)nc2N)c2ccccc2c1=O	806300376	LFIYEBPDLWKPTP-UHFFFAOYSA-N	435.488	1.911	50	20	IDGD	
CN1CCN(C(=O)c2ccc(CNC(=O)NNc3ccc4c(=O)[nH]ccc4c3)cc2)CC1	806379925	ZUNQBAKATNRYBB-UHFFFAOYSA-N	434.500	1.742	50	20	IDGD	
CCCCN1C(=O)C[C@H](C(=O)NNC(=O)N2CCN(C)CC2)[C@@H]1c1ccc(OC)cc1	807379312	WZUNQXMTTFRULD-ICSRJNTNSA-N	431.537	1.373	50	20	IDGD	
CC(C)(C(=O)NNC(=O)COc1ccc(C#N)cc1)S(=O)(=O)c1ccc(Cl)cc1	807550706	JFVAFKROTIIJSR-UHFFFAOYSA-N	435.889	1.990	50	20	IDGD	
CO[C@H](C)c1nsc(NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)n1	809924631	RBYCRKRCULYHHS-CQSZACIVSA-N	433.538	1.611	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNS(=O)(=O)c1cnc2onc(-c3ccccc3)c2c1	811694177	PDKLSFWKJIZECG-UHFFFAOYSA-N	447.473	1.724	50	20	IDGD	
CCOCc1nc([C@@H](C)NC(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)no1	812564160	NYSOZNCSSREMAO-LLVKDONJSA-N	427.487	1.075	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)CCNC(=O)c2n[nH]c3ccccc23)cc1	812729839	VULCAXGZHADMHD-UHFFFAOYSA-N	430.490	1.076	50	20	IDGD	
O=C1CN(Cc2cccc(NC(=O)C(=O)NNc3ccc(OC(F)F)cc3)c2)CCN1	812985222	MQHFEFJOIBTUBV-UHFFFAOYSA-N	433.415	1.302	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)C1(S(=O)(=O)c2ccc(F)cc2)CCCCC1	813462509	WPGBAEQHXMJVRD-UHFFFAOYSA-N	441.525	1.755	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)N3CCN([C@@H](C)C(=O)NC4CC4)CC3)cc2C1	813496835	SUUIAEDKLYWPEO-KBPBESRZSA-N	433.578	1.512	50	20	IDGD	
O=C(NCc1cccc(NC(=O)c2ccncc2)c1)NNC(=O)[C@@H]1CCc2nncn2C1	814281700	VCQFYQMPEHNTRQ-MRXNPFEDSA-N	434.460	1.018	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@H](C)C(=O)NNC(=O)c1nnn(-c2ccn(C)n2)c1C	814366060	BHJWHFQRQUOLTL-CYBMUJFWSA-N	431.884	1.808	50	20	IDGD	
COCCN(C)NC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(Br)cc2)C1	816561789	LTIYMADRJZMQKT-CYBMUJFWSA-N	434.356	1.459	50	20	IDGD	
Cc1nn(Cc2ccc(C(=O)NNC(=O)[C@@H]3CCc4nncn4C3)cc2)c(C)c1[N+](=O)[O-]	816875515	BPDHCZKQTNUGHP-MRXNPFEDSA-N	438.448	1.072	50	20	IDGD	
Cc1nnnn1[C@H](Cc1ccccc1)C(=O)NNc1ccccc1S(=O)(=O)N(C)C	817051311	JTOZZVREINAQPA-QGZVFWFLSA-N	429.506	1.159	50	20	IDGD	
Cc1ccccc1OCCCC(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	875623953	YFYMPFWTHLALLH-LJQANCHMSA-N	428.441	1.685	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1cnn(-c2ccccc2F)c1C(F)(F)F	912505982	LIAZMVKLQYGPPD-SECBINFHSA-N	434.371	1.226	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)CCCNS(=O)(=O)c1ccc2c(c1)OCCO2	913262810	KXRIXWAENQJENV-UHFFFAOYSA-N	433.486	1.286	50	20	IDGD	
CC(=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O)c1ccc(-c2ccccc2F)s1	914773292	CCHKDSXMULSJMV-UHFFFAOYSA-N	447.517	1.979	50	20	IDGD	
Cn1cc(S(=O)(=O)N2CCCCC2)cc1C(=O)NN=c1sc2ccccc2n1C	914837702	RQRYXHBNSZHEAO-UHFFFAOYSA-N	433.559	1.999	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NN=Cc1ccccc1[N+](=O)[O-]	915913535	AZSBEAGGSJHMQE-UHFFFAOYSA-N	446.485	1.699	50	20	IDGD	
C[C@H](NC(=O)C1CCCC1)C(=O)NNC(=O)c1ccc(CSc2nncn2C)cc1	916102387	JWVYGWZPWUMPIA-ZDUSSCGKSA-N	430.534	1.563	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NN=C1CCS(=O)(=O)c2ccccc21	916272140	ZDKWXSFOWRYFJY-UHFFFAOYSA-N	426.542	1.897	50	20	IDGD	
Cc1cc(C)n(-c2ccc(CNC(=O)NNC(=O)c3nnc(O)c4ccccc34)cn2)n1	916419748	RNHYWVXDUDDZSN-UHFFFAOYSA-N	432.444	1.677	50	20	IDGD	
C[C@@H](Cn1cccn1)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	916463498	MIXDTQMBQFWQME-HNNXBMFYSA-N	434.522	1.090	50	20	IDGD	
COc1cc([C@H](C)NC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc(OC)c1OC	916483791	XLWOEOKQGQMSDR-SGTLLEGYSA-N	431.445	1.944	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)N[C@@H]1CCN2CCC[C@@H]2C1	916573904	SJAWTPOYGCKQIE-QZTJIDSGSA-N	449.577	1.432	50	20	IDGD	
C[C@H](CC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)CC(C)(C)C	916726585	OQBOOOZBUDNTNR-OAHLLOKOSA-N	425.551	1.931	50	20	IDGD	
O=C(NCCOc1cccc(Br)c1)NNC(=O)c1ccc(-n2cnnn2)cc1	918138274	PLIOCBQKTYWEPM-UHFFFAOYSA-N	446.265	1.448	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cccn2Cc2cccs2)cc1	918201910	WAQZEMFWNKLBLP-UHFFFAOYSA-N	446.554	1.988	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)c(C)n1CCC(C)C	919889167	KDOZBIAZSOCIMD-DAIOKFOQSA-N	435.550	1.576	50	20	IDGD	
O=C(NNS(=O)(=O)c1c(Cl)cc(Cl)cc1Cl)N[C@H]1CCS(=O)(=O)C1	919961296	ZVWXEXMJHSVVBE-ZETCQYMHSA-N	436.726	1.326	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)c2nc(S(C)(=O)=O)n3ccccc23)c1C	920274590	SWGLDVXDTMVGNX-CQSZACIVSA-N	430.486	1.583	50	20	IDGD	
CCC(CC)[C@@H](C(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1)N1CCOCC1	1116134511	AJDKHGMARCKYIO-SFHVURJKSA-N	440.585	1.918	50	20	IDGD	
NS(=O)(=O)c1ccc(Br)c(C(=O)NNC(=O)c2ccccc2Cl)c1	1317698512	NAOOUWTXQWEDCE-UHFFFAOYSA-N	432.683	1.825	50	20	IDGD	
Cc1nn([C@@H]2CCS(=O)(=O)C2)c(C)c1C=NNC(=O)c1nnc(-c2ccccc2)o1	1317992694	FXCNBIIQFXDPDS-OAHLLOKOSA-N	428.474	1.673	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2n[nH]c3c2CCCC3)nc1I	1319556128	CCGJYDMAWPZHPO-UHFFFAOYSA-N	441.229	1.372	50	20	IDGD	
Cn1cc([C@@H](NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c2ccccc2)cn1	1320064551	KWQBLEMCSMPBMO-IBGZPJMESA-N	434.504	1.547	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(I)c(C(=O)NNc2cccnn2)c1	1323743691	IWDHCHPJYLIQBP-UHFFFAOYSA-N	447.258	1.088	50	20	IDGD	
CCCn1nc(C(=O)NNS(=O)(=O)c2ccc3nc(C)oc3c2)c2ccccc2c1=O	1324178983	OASKVIWPUPYXKI-UHFFFAOYSA-N	441.469	1.879	50	20	IDGD	
Cc1ncc(Br)c(C(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)n1	1338985876	XBGVAQZGECKJPQ-UHFFFAOYSA-N	427.642	1.819	50	20	IDGD	
COC(=O)[C@@H]1CC[C@H](C(=O)N2CCO[C@@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)C1	1779295156	ZBPGXSYUAGMZIN-RZQQEMMASA-N	426.586	1.257	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1ON=C(c3ccccc3)O1)CCO2	1779296853	IFILVRZJDJRJLF-SFTDATJTSA-N	447.564	1.403	50	20	IDGD	
C[C@@H](NC(=O)c1ccccc1)C(=O)N1CCO[C@]2(CCN(C(=O)CO[Si](C)(C)C)C2)C1	1779300147	PAINNTMJMFTSQR-VGSWGCGISA-N	447.608	1.486	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)/C=C/C(=O)NCc3ccccc3)CCO2)C1	1781211516	WUWCMOSEXNFHDR-LNRPMLKFSA-N	433.936	1.706	50	20	IDGD	
COc1cc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](F)Cl)CCO3)c(F)c(OC)c1F	1781950304	FLZQMMASBKOOFT-YJBOKZPZSA-N	436.814	1.960	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCCn1ccnc1)C2	1782002546	RELFENCPZCQLOE-GPMSIDNRSA-N	441.370	1.961	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1ccc(C#N)cc1)C2	1782167267	JYOYSZMRTYJYJQ-NNMXDRDESA-N	433.936	1.868	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)[C@@H](O)c3ccccc3)CCO2)C1	1783343928	XAOARCIYVPGEQF-GJYPPUQNSA-N	425.323	1.723	50	20	IDGD	
Cc1cnc2c(C(=O)N3CCO[C@@]4(CCN(C(=O)[C@@H](C)Br)C4)C3)cnn2c1	1783534194	RCUWOBPICREJKB-FZKQIMNGSA-N	436.310	1.265	50	20	IDGD	
O=C(/C=C/c1cc(F)c(F)c(F)c1)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1783716807	VAWSVFCYTYECCK-HXKYGNDQSA-N	432.826	1.547	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)C3=NO[C@@H](c4ccccc4)C3)CCO2)C1	1783874035	BLHSQVMZRKNDLW-YRISNDGFSA-N	435.908	1.588	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cncc(F)c3)C[C@@H]21	1783967111	BRTMHENMATVREA-KNPMLCFXSA-N	428.302	1.845	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C3(c4ccc(Cl)cc4)CC3)C[C@@H]21)[C@H](O)CCl	1784094916	VAZBSLFSONYRJE-RUGDWHBFSA-N	441.355	1.951	50	20	IDGD	
Cc1cccc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)CBr)C[C@@H]32)n1	1784220786	BZWIDBNVKHRXGJ-IKICRFKJSA-N	438.366	1.943	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(OC)c(C)c(OC)c3)C2)C1	1785177977	GSTFXYFSGMLRJK-IIBYNOLFSA-N	440.924	1.710	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(C(=O)O)n(C(C)C)n3)[C@H]2C1	1785717011	FNFZMWZZVYUEJW-WSMBLCCSSA-N	440.928	1.773	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4nc[nH]c4c3)C[C@@H]21	1786406839	JZKUIIXQBNNQSY-ZQIUZPCESA-N	435.322	1.941	50	20	IDGD	
C[C@H](C(=O)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1)N1C[C@H]2C[C@@H]2C1	1788145560	CLGCWRFCZMJVPS-BHIYHBOVSA-N	447.344	1.454	50	20	IDGD	
CC[S@@](=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]2C1	1789867727	DWDACLMNMINJNL-LRRKKCTGSA-N	427.394	1.361	50	20	IDGD	
CCOC(CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]2C1)OCC	1789873305	UDHVBFZKSBQPDM-XMDUPGNXSA-N	439.380	1.992	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(F)nc3F)C[C@@H]21)[C@H](F)Br	1789921108	SQTFMJSTVQDZQY-DJFWLOJKSA-N	436.228	1.644	50	20	IDGD	
CCOC(=O)O[C@@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)Br)C[C@@H]21	1790610640	SBCLORUJEAVSFK-PEDHHIEDSA-N	435.315	1.311	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CO[Si](C)(C)C)C[C@@H]21	1790961255	XQDAOFYTLFPOJS-AJNGGQMLSA-N	435.435	1.991	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3CCC(CO)CC3)C[C@@H]21	1791055156	LKVSBYNDGWTCAH-VCUUKQMESA-N	431.371	1.548	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C[C@H](N)c3cccnc3)C[C@@H]21	1791057463	DEGZDFQNHXZGDK-SRQBIAJPSA-N	439.354	1.235	50	20	IDGD	
Cc1cc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)CBr)C[C@@H]32)no1	1791530828	GMHLEESQYYUFTC-MZGVZZPPSA-N	428.327	1.536	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C=C/c3cnc(C)s3)[C@H]2C1	1791736953	ZLPRYEQAOLASEI-OQSFXPJBSA-N	427.954	1.698	50	20	IDGD	
CC[C@H](NC(=O)OC(C)(C)C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Cl)C[C@@H]21	1792128539	CYDJOXKUPSYKPF-YYFQZIEXSA-N	435.924	1.804	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(-c2ccccc2)on1	1792406731	YEHJLNVEVRKXBE-YYAJDYIMSA-N	433.892	1.799	50	20	IDGD	
COC(=O)[C@H]1CCC[C@@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C(C)(C)CCl)C1	1792785651	NSBNEOGNCYVILW-BPKGMFCQSA-N	428.957	1.820	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccn(C(C)(C)C)n1)C2	1792870574	SAAOXIYMSMAMAU-HGTKMLMNSA-N	441.370	1.872	50	20	IDGD	
COc1ccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)Br)C3)cc1C	1793654760	PAQFOBBOCUFITN-AMVTXUCVSA-N	439.350	1.919	50	20	IDGD	
CC(C)(CCl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1CCc2nc(O)nc(O)c2C1	1794382738	CDGVUTZDQQBGCY-FQUUOJAGSA-N	436.940	1.896	50	20	IDGD	
C[C@H](CN)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](Br)Cc1ccccc1)C2	1795514561	DREJJLMTZCVQDL-SOVHRIKKSA-N	438.366	1.177	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1ccc(F)c(F)c1)c1cccc(B(O)O)c1	1795710589	FDTIHKYCOTVYSI-BCDXTJNWSA-N	428.244	1.139	50	20	IDGD	
COc1cccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)c1F	1796192374	FCQHUEKDPDBUMG-BJWYYQGGSA-N	426.253	1.080	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(F)(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Cl)C1	1796370959	PRCAURLMGDPRJW-RNJOBUHISA-N	437.871	1.069	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2)c1cc(-n2ccnc2)ccn1	1798727349	ZVIQQWDWMHCARJ-ZSBFGKGUSA-N	448.321	1.256	50	20	IDGD	
Cc1nccn1CCCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@](C)(Cl)CCl	1799278628	RLMFRDHXXNIIDG-LORHWOILSA-N	431.364	1.798	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)OC(C)(C)C)C2	1800078088	HQKVWBGKMBKAIQ-KHMAMNHCSA-N	444.960	1.411	50	20	IDGD	
C=C(CC(=O)OCC)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](Br)CC	1800642531	NLYSTSCGCJMRST-HLPPOEQASA-N	431.327	1.259	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3cccnc3nc1O)C2	1800762683	YEYFDQRFSXFTIW-DNVSUFBTSA-N	449.305	1.322	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(F)(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Cl)C3)C1	1802198162	CGKXZSQLKGKLLZ-YVECIDJPSA-N	437.871	1.069	50	20	IDGD	
C[C@H](Sc1ccccn1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCC(=O)NN(C)C	1802340047	ZRHFPOGYZGDXPY-NXOAAHMSSA-N	433.578	1.573	50	20	IDGD	
C[C@H](NNc1ccccc1)C(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]1c1cccnc1	1803138101	WJBFIPGPQVLNNY-ZSXHRAQDSA-N	445.951	1.692	50	20	IDGD	
C[C@]1(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)CC=CCC1	1807368686	XCANPKAYKUFCMY-HOKHCIIBSA-N	447.344	1.827	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)C(Cl)Cl)[C@@H]1c1cccnc1)c1nc2ncccn2n1	1809237094	LILGXDHNDWLYQZ-QWHCGFSZSA-N	434.287	1.643	50	20	IDGD	
Cc1nc(CC(=O)N2CC[C@H](CNC(=O)[C@@H](C)Br)[C@@H]2c2cccnc2)no1	1812865216	MVTIVHDLRXJTEX-ZLENFMNRSA-N	436.310	1.805	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)CCc2cnn(C)c2)[C@H]1c1cccnc1	1813032904	ZBVDGEXZNDEDSQ-HBFSDRIKSA-N	433.940	1.708	50	20	IDGD	
CCOC(=O)C(C)(C)C(=O)N1CC[C@H](CNC(=O)[C@@H](Cl)COC)[C@H]1c1cccnc1	1813036985	AAYQLNLGWYYIMB-IXDOHACOSA-N	439.940	1.931	50	20	IDGD	
Cc1cncc(C(=O)N2CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)c1	1813070362	ICTFAIJHVAUOFD-PGRDOPGGSA-N	438.532	1.478	50	20	IDGD	
COc1nn(C)cc1C(=O)N1CC[C@H](CNC(=O)C(Cl)Cl)[C@@H]1c1cccnc1	1813077282	IPMSHGDZWPMAMD-OCCSQVGLSA-N	426.304	1.947	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)[C@H]3CCC(=O)N3)sc2C1	1814410617	HDLYIOJVMMYKTQ-ATZCPNFKSA-N	429.340	1.507	50	20	IDGD	
O=C(CN1CCCC1=O)Nc1nc2c(s1)C[C@H](NC(=O)CCBr)CC2	1814590000	DMZSSAILBONTFL-SNVBAGLBSA-N	429.340	1.463	50	20	IDGD	
CNc1ccc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)CCC(=O)NN(C)C)CC3)cc1	1814880811	CAQQZZIZLYQIDX-HNNXBMFYSA-N	444.561	1.784	50	20	IDGD	
C[C@H](C(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1)n1cccc1	1815347681	KJTKQZFIGYOCBP-CJNGLKHVSA-N	438.318	1.111	50	20	IDGD	
C=C(C(=O)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1)C(F)(F)F	1815360060	KPNXPUOCTCZYMA-GFCCVEGCSA-N	439.224	1.167	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnn4ncccc34)sc2C1	1816950234	PHQWEQYVJGHGNA-PWSUYJOCSA-N	434.909	1.665	50	20	IDGD	
O=C(CS(=O)(=O)N1CCCC1)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](F)Cl)CC2	1817271472	DEWKMHSXGFBSTA-ZANVPECISA-N	438.934	1.015	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)CCl)CC2)c1snnc1C1CC1	1817831238	CWFUFQCCEPDLCV-SCZZXKLOSA-N	427.939	1.698	50	20	IDGD	
Cc1nc2ncccn2c1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1	1818667982	UBHVQNHEMNLRFI-KBPBESRZSA-N	431.884	1.666	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](C)Cn3cncn3)sc2C1	1820077586	TVSVBASGHQICFH-OUAUKWLOSA-N	441.355	1.766	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)ncn2)[nH]n1)[C@@H](F)Br	1820931701	SJEGMVXWQZFINW-GXFFZTMASA-N	427.234	1.902	50	20	IDGD	
CC(=O)N[C@H](C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](C)CBr)[nH]n1	1821967887	ZWBXRHJJGAECFJ-WDMOLILDSA-N	428.331	1.957	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@](C)(O)C(F)(F)F)[nH]n1	1822410956	UBGIIMDEUYXQLK-SJKOYZFVSA-N	448.446	1.088	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](C)N3CCN(C)CC3)sc2C1	1822693192	PFGPQKANRKAVEF-MJBXVCDLSA-N	428.002	1.708	50	20	IDGD	
N[C@H](C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1)c1ccccn1	1823002280	CCRZKUVMYGTUTI-OXHMUOHRSA-N	442.314	1.841	50	20	IDGD	
COCC1(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1	1824483281	GRLJNOWTIAVPHH-LJQANCHMSA-N	443.548	1.345	50	20	IDGD	
CCNC(=S)NCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](C)Br)CC2	1824509378	MDOONBDDRBQYOB-BDAKNGLRSA-N	448.412	1.323	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](C)NC(C)=O)sc2C1	1825226674	LHZKHDWRWYAHEL-GDPRMGEGSA-N	431.356	1.753	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cncs2)CC1	1826133201	CCFFISBVTQWKLP-KRWDZBQOSA-N	442.545	1.689	50	20	IDGD	
O=C([C@@H]1CCCSC1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827055478	YUXQCTLTICZKCN-CTNGQTDRSA-N	444.406	1.743	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ncccn2)CC1	1828925223	IOGVBENHTVBOID-GOSISDBHSA-N	437.504	1.022	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)C[C@@H]3CCCCO3)C2)C1	1830535526	QCLSQFIETJIWFN-GJYPPUQNSA-N	447.370	1.433	50	20	IDGD	
Cc1ccc(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)cc1F	1831308655	DXKWUWZUTNDCSZ-RXVVDRJESA-N	442.915	1.123	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccn3c(O)nnc23)CC1	1831832717	HHTNUKYWHCAULD-SJORKVTESA-N	449.939	1.922	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnccc2F)CC1	1831871231	NPJJOEHSBUNZHP-IBGZPJMESA-N	433.528	1.827	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)CCCn2ccnc2)CC1	1831877428	XHCTWFJYGPYNLA-FQEVSTJZSA-N	446.596	1.656	50	20	IDGD	
C[C@@]1(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1(F)F	1832801656	DKOTZRUQHOGYLO-RXVVDRJESA-N	434.292	1.645	50	20	IDGD	
CC(C)(CCl)C(=O)NC1CCN(C2CCN(C(=O)COc3cccnn3)CC2)CC1	1833216187	XKUZGXRPXVUXIB-UHFFFAOYSA-N	437.972	1.692	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3c(F)ccc(O)c3F)CC2)CC1)[C@H](O)CCl	1833312495	WGQFLLWFGBIWHC-MRXNPFEDSA-N	445.894	1.455	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3n[nH]c(C4CC4)c3F)CCO2)C1	1833685220	WKZKHSQLHZFYCP-ORAYPTAESA-N	428.892	1.514	50	20	IDGD	
COc1cccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)c1	1835035326	PIPISSLKYNMVCD-IBGZPJMESA-N	431.316	1.498	50	20	IDGD	
O=C(c1ccc(C(F)(F)F)[nH]1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1837764502	CEERLHFOVDRXGA-DOMZBBRYSA-N	427.782	1.638	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCC(OC2CCN(C(=O)[C@H]3CCC(=O)N3)CC2)CC1	1837782667	FDUGUVDKMUYDOZ-DNVCBOLYSA-N	434.364	1.500	50	20	IDGD	
CCc1cc(C(=O)N2CCC(OC3CCN(C(=O)[C@@H](Cl)COC)CC3)CC2)nn1C	1838503747	IXQWFWROKOIWSZ-SFHVURJKSA-N	440.972	1.849	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(C#N)cc(OC)c3)CCO2)C1	1838584797	HCHJGOODLQZXQC-NQIIRXRSSA-N	435.908	1.654	50	20	IDGD	
C[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1)[S@](=O)c1ccccc1	1839672449	KLNUIWJGCHKHFW-NPERMYIRSA-N	446.928	1.174	50	20	IDGD	
Cc1ccc(C(=O)C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)cc1	1840190878	SFXXDNSJCJUJQH-LJQANCHMSA-N	429.300	1.438	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@H]2C[C@H]3C[C@H]3N2C(=O)OC(C)(C)C)C1	1841361955	ICNZZSSOYAKESA-QKPAOTATSA-N	441.956	1.842	50	20	IDGD	
CC(=O)NC(C)(C)C(=O)N1CCCC12CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)C2	1841622598	WTOMQOMUUWFIMU-CXUHLZMHSA-N	430.455	1.990	50	20	IDGD	
Cc1nn2cc(CC(=O)N3CCCC34CN(C(=O)[C@@H](F)Br)C4)nc2s1	1841787571	TWPCWZCLRGFVLV-GFCCVEGCSA-N	430.303	1.536	50	20	IDGD	
Cc1n[nH]c(C)c1C(=O)N1CC2(CCCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C1	1841924681	PTFUCWCDBQKKPK-AWEZNQCLSA-N	439.944	1.976	50	20	IDGD	
CN(CC(=O)N1CC2(CCCN2C(=O)c2cccn2C)C1)NC(=O)NCc1ccccc1	1842363649	WSMXWOJAQRTDSH-UHFFFAOYSA-N	438.532	1.188	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)CCc2c[nH]c3ccccc23)C1	1843070036	BGAYIZUZWZGYCI-UHFFFAOYSA-N	431.301	1.298	50	20	IDGD	
Cc1cn2c(=O)c(C(=O)N3CCCC34CN(C(=O)[C@H](F)Br)C4)cnc2s1	1843785483	GVTNOLNDUUFPQU-NSHDSACASA-N	443.298	1.572	50	20	IDGD	
COc1ccc(C(=O)N2CCCC23CN(C(=O)[C@H](O)CCl)C3)nc1Br	1844612724	VIXUSTCJGMXWNU-LLVKDONJSA-N	432.702	1.269	50	20	IDGD	
O=C([C@@H](Br)Cc1ccccc1)N1CC2(CCCN2C(=O)CCn2ccnn2)C1	1846623936	POEUDYGXEUCGRC-KRWDZBQOSA-N	446.349	1.878	50	20	IDGD	
C/C(=C\c1cccs1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cnccc1C(=O)NN	1847244507	FFVWQYKZXTWLJY-NTLDXJMESA-N	425.514	1.666	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](O)CCl)CC1	1847558304	BMALSZLYGZEOIL-QAETUUGQSA-N	443.972	1.825	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CCCC[C@H]1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl	1847567825	FFJBFYFDOMVPHP-NRKLIOEPSA-N	443.972	1.871	50	20	IDGD	
CCn1nccc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1848095809	QHGUZXYESJGLQS-KKUMJFAQSA-N	439.944	1.851	50	20	IDGD	
C[C@H]1Cc2cc(C(=O)NNC(=S)NCCc3cccs3)ccc2N1S(C)(=O)=O	11519587	ONTOGDSZWRLZHF-LBPRGKRZSA-N	438.600	1.810	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@H](C)Oc2ccc(Cl)cc2)cc1	17406563	SSIKCYBWTKWKCM-AWEZNQCLSA-N	439.921	1.884	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CSc2nnnn2-c2ccccc2OC)cc1OC	21161436	RWHIVYOXRPAEIP-UHFFFAOYSA-N	444.473	1.241	50	20	IDGD	
Cn1cc(S(N)(=O)=O)cc1C(=O)NNC(=O)COc1ccccc1Cc1ccccc1	21303184	UADSIQZZHBDFFO-UHFFFAOYSA-N	442.497	1.103	50	20	IDGD	
O=C(NCCc1ccc(Br)s1)NNC(=O)c1ccc(-n2cnnn2)cc1	22878089	VCFMQWVRQOXBTM-UHFFFAOYSA-N	436.295	1.673	50	20	IDGD	
Cc1sc2ncn(CCC(=O)OCC(=O)NNC(=O)c3ccccc3)c(=O)c2c1C	23565458	UCRWAQLKIPGQPQ-UHFFFAOYSA-N	428.470	1.469	50	20	IDGD	
O=C(CN1CCN(Cc2ccc3c(c2)OCCO3)CC1)NNC(=O)c1ccccc1Cl	26842981	NEYZHZSHYINXDW-UHFFFAOYSA-N	444.919	1.690	50	20	IDGD	
CCN1CCN(c2ccc(F)cc2[C@@H](C)NC(=O)NN[C@]2(C)CCS(=O)(=O)C2)CC1	726279673	QTWBUAQRVYHBLQ-FOIQADDNSA-N	441.573	1.410	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2ccc(-n3ncc(C#N)c3N)cc2)cc(OC)c1OC	727241163	FBUOTAFQFYVGJU-UHFFFAOYSA-N	436.428	1.427	50	20	IDGD	
CC/C=C(/C)C(=O)N1CSC[C@@H]1C(=O)NNC(=O)c1nn(CC)c(=O)c2ccccc12	728018980	ZBKDGDMQMDHBNO-LPDYGMJQSA-N	443.529	1.435	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)N2CCN(C(=O)c3ccc4nc[nH]c4c3)CC2)cc(C#N)n1C	728190084	BICISAOYXWKXLF-NVMNQCDNSA-N	427.468	1.973	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(OC)c(C(=O)NNC(=O)CNc2ccc(C)cc2)c1	728204791	PVFQSIBCYYEBFL-UHFFFAOYSA-N	448.545	1.907	50	20	IDGD	
COc1cccc2c1OC[C@H](NC(=O)NNc1ccc(S(=O)(=O)NC(C)C)cn1)C2	728398246	CKVXFQXURHBHHU-CQSZACIVSA-N	435.506	1.407	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNS(=O)(=O)c2ccc3c(c2)CC(=O)N3)c1	728508189	JWFWPCJXRWEWPN-UHFFFAOYSA-N	440.275	1.576	50	20	IDGD	
CS(=O)(=O)c1cc(S(=O)(=O)NNC(=O)c2cccc(OC(F)F)c2)ccc1F	728510559	NVTXGLNLXJPFAR-UHFFFAOYSA-N	438.405	1.454	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(n2cc(C(=O)NNC(=O)c3cccc(C#N)c3)nn2)CC1	728826611	QSMKBTUFUPHZNX-UHFFFAOYSA-N	439.476	1.797	50	20	IDGD	
N#Cc1cccc(C(=O)NNS(=O)(=O)c2ccc(Br)cc2[N+](=O)[O-])c1	728854637	OHXDQUJPZQMNOF-UHFFFAOYSA-N	425.220	1.852	50	20	IDGD	
Cc1[nH]c2ccnn2c(=O)c1CC(=O)NNC(=O)[C@@H](C)Oc1cccc(Br)c1	729282002	IWPXAIJZKALBGE-LLVKDONJSA-N	448.277	1.251	50	20	IDGD	
Cc1nc(N2CCOCC2)nc(O)c1CCC(=O)NNC(=O)Cn1ccc2ccccc21	729450317	VUXMVRGKXRJBFH-UHFFFAOYSA-N	438.488	1.062	50	20	IDGD	
O=C(CNC(=O)c1ccc(Br)cc1)NNC(=O)Cn1ccc2ccccc21	729691600	HKXNQLWRHLGKAN-UHFFFAOYSA-N	429.274	1.981	50	20	IDGD	
COc1ccccc1C/C(C)=C\C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	730343108	CXFSLFOICRZGSH-NLBZTSMMSA-N	440.452	1.715	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)NCc1cccc(NC(=O)[C@@H]2CCCO2)c1	730825776	WYWYGIRXNGLVAF-SFHVURJKSA-N	428.445	1.419	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)NCc1cccnc1N1CCC(C(N)=O)CC1)c1ccccc1	732246078	MDMLALFPRMRZJX-IBGZPJMESA-N	438.532	1.808	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2cccc(OCC(N)=O)c2)cc1Br	732444670	QJDKLOQJOMYZFD-UHFFFAOYSA-N	437.250	1.788	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN(C)[C@@H]1CCN(CC(F)(F)F)C1=O	732815128	VVHQEMLRGSWFNZ-GFCCVEGCSA-N	436.818	1.205	50	20	IDGD	
C#CCNS(=O)(=O)c1ccc(C(=O)NNc2cc(CC)nc(-c3ccccn3)n2)cc1	734356488	CNHJEZRLIGAJNL-UHFFFAOYSA-N	436.497	1.769	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNS(=O)(=O)c2cc(F)cc(F)c2)CC1	734806975	DNAAJHOBGPROMB-UHFFFAOYSA-N	434.465	1.857	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)CC(=O)NNC(=O)c2ccc3ccccc3n2)cc1F	734807562	VWICGSBOZBVTAI-UHFFFAOYSA-N	429.429	1.811	50	20	IDGD	
CCS(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=O)COc2ccccc2OC)c1	735647074	UCDSNWXQQCUKTE-UHFFFAOYSA-N	426.878	1.982	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)CN2C(=O)[C@H]3CCCC[C@@H]3C2=O)cc1C	736740595	WUSRXPXGBXUFSE-STQMWFEESA-N	435.502	1.098	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)Cc1ccc(S(=O)(=O)CC(F)(F)F)cc1	737629748	WXMHAMJNZYRBCM-UHFFFAOYSA-N	444.431	1.929	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)nn1	737767414	YXRNIFJTJLBRLL-UHFFFAOYSA-N	441.469	1.039	50	20	IDGD	
COc1ccc(S(=O)(=O)NCCC(=O)NNc2cccc(C(F)(F)F)n2)cc1OC	740140008	GHYMSZXZGPHFDW-UHFFFAOYSA-N	448.423	1.929	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)COc1ccccc1O)[C@H]1CN(Cc2ccccc2)CCO1	741276623	AFRVJVGASHNUCK-OXJNMPFZSA-N	428.489	1.391	50	20	IDGD	
COc1ccc(-c2n[nH]c(CNC(=O)NNC(=O)COc3ccccc3OC)n2)cc1	741420168	YEPNAKTVTLJMPT-UHFFFAOYSA-N	426.433	1.398	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2cnc3ccsc3c2)CC1	743419623	NPZAJCZMRIISEG-UHFFFAOYSA-N	432.531	1.384	50	20	IDGD	
Cc1ccccc1[C@@H]1CN(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)CCO1	743510407	WGCQBJVPKAFCNE-KRWDZBQOSA-N	431.518	1.716	50	20	IDGD	
O=C(NNC(=O)N1CCC(CN2CCOCC2)CC1)c1cccc(Br)c1	743685413	CAWSMMHFDQSXEV-UHFFFAOYSA-N	425.327	1.848	50	20	IDGD	
COc1ccccc1-c1noc([C@H](C)NC(=O)NNC(=O)COc2ccccc2O)n1	743705406	SWWLBTIKDHPJMI-LBPRGKRZSA-N	427.417	1.921	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)c1	743738000	OVCCBDJDHQMZGD-UHFFFAOYSA-N	445.457	1.261	50	20	IDGD	
C[C@@H](NC(=O)c1ccc(Cl)cc1)C(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	743829460	QOPWJAKVWXYMBO-LLVKDONJSA-N	438.893	1.715	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CCC[C@H]1C(=O)OCC(=O)NNC(=O)c1ccc(C#N)cc1	745075487	XOWFNMHHNHAEQC-HZPDHXFCSA-N	430.461	1.556	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H]1CC(=O)OCC(=O)NNC(=O)c1ccc(C#N)cc1	745457650	HBHLKFYPBIRVLK-INIZCTEOSA-N	430.461	1.652	50	20	IDGD	
COc1ccc(N(C)S(=O)(=O)c2cccc(C(=O)NNC(=O)N3CCOCC3)c2)cc1	745992686	IGVUOCWMHGQGCQ-UHFFFAOYSA-N	448.501	1.207	50	20	IDGD	
O=C(NNc1nc(-c2ccncc2)no1)[C@@H]1CN(Cc2nc(O)c3ccccc3n2)CCO1	746202351	XIFLVIUUUXJZHP-INIZCTEOSA-N	448.443	1.125	50	20	IDGD	
COc1ccc([C@@H](CNC(=O)NNC(=O)Cc2cn3ccccc3n2)N(C)C)cc1OC	746741942	DOSYBVULBIXCSG-QGZVFWFLSA-N	440.504	1.527	50	20	IDGD	
O=C(CN1CCN(C(=O)OCc2ccccc2)CC1)NNC(=O)c1ccc2c(c1)OCO2	747348395	JVZRTIUFXZQEAY-UHFFFAOYSA-N	440.456	1.131	50	20	IDGD	
Cc1nc(Cl)cc(NNC(=O)c2cc(S(N)(=O)=O)c(Br)s2)n1	748336217	URLQAFCRWQPNGD-UHFFFAOYSA-N	426.705	1.667	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@H](Cc2c[nH]c3cc(F)ccc23)NC(C)=O)cc1OC	749331040	CMXRVYCCCDHEAT-SFHVURJKSA-N	442.447	1.833	50	20	IDGD	
O=C(COC(=O)C[C@H](O)c1ccc(Cl)cc1)NNC(=O)[C@H]1COc2ccccc2O1	750368914	CJZVQYJNQGTSDC-WMLDXEAASA-N	434.832	1.294	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)[C@@H]1CCn2cncc2C1	750915412	WAXXRERNTUFHDG-MRXNPFEDSA-N	430.940	1.064	50	20	IDGD	
CCCn1nc(C(=O)NNS(=O)(=O)c2cc(C(=O)OC)c(C)o2)c2ccccc2c1=O	751143327	YTCMTBMEGIBWKZ-UHFFFAOYSA-N	448.457	1.118	50	20	IDGD	
COc1ccc([C@]2(C)NC(=O)N(CC(=O)Oc3ccc([N+](=O)[O-])cc3OC)C2=O)cc1	751173271	APMPHFFXZQCYQF-FQEVSTJZSA-N	429.385	1.985	50	20	IDGD	
CCOc1ccc(C(=O)NNS(=O)(=O)c2cc(C(=O)O)c(C)cc2F)cc1OC	753767960	CPXJSWTVYMAGEH-UHFFFAOYSA-N	426.422	1.863	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)C(=O)Nc2cnn(-c3ccccc3)c2C(C)C)c1	753841089	ONXZGNAAJLWUEJ-UHFFFAOYSA-N	449.471	1.749	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)Nc1ccc(NC(=O)CN2CCOCC2)cc1	755600755	VPHHVGKCNPSSSU-UHFFFAOYSA-N	441.488	1.361	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1cccc(COCC(F)(F)C(F)F)c1	755965368	YJXXUTSPKNHDOR-VIFPVBQESA-N	444.407	1.194	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)Nc1ccccc1CS(C)(=O)=O	756268490	ATFHPPAQXQVVSY-UHFFFAOYSA-N	428.511	1.689	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)Nc1cnn(-c2ccccc2S(C)(=O)=O)c1	756704503	GGJMJFLOAOBTSA-UHFFFAOYSA-N	429.458	1.751	50	20	IDGD	
C[C@H](CS(=O)(=O)c1ccc(F)cc1)C(=O)OCC(=O)NNC(=O)c1cccc(C#N)c1	756715900	ZOKSUQXNOHNCAR-CYBMUJFWSA-N	447.444	1.112	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Nc2ccc(OC)c(-n3cnnn3)c2)ccc1OC(C)C	756747072	MUBLYPIWUKXEAA-UHFFFAOYSA-N	441.448	1.933	50	20	IDGD	
C[C@H]1CN(C2CC2)C[C@@H]1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	757792229	WJKXOHAGRXOUDC-KXBFYZLASA-N	449.577	1.288	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)Nc1cnc2c(c1)CN(C(=O)OC(C)(C)C)CC2	757895754	LGUCRBVAOQNUKP-ZDUSSCGKSA-N	437.497	1.579	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)[C@H](Sc1cc(F)ccc1F)c1ccccc1	758029418	KSDIACOSBLAIAC-BDJLRTHQSA-N	443.497	1.883	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NC[C@@H](C)CC1(C)OCCO1	758856127	WJXKBCLTKPVUKP-LBPRGKRZSA-N	427.527	1.021	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)NC[C@@H]1CC(=O)N(Cc2ccccc2)C1	759683543	NXZFJEQPWCPFFH-SFHVURJKSA-N	440.500	1.843	50	20	IDGD	
CCc1ccc(-c2noc([C@H](C)NC(=O)NNC(=O)CNC(=O)c3ccco3)n2)cc1	760753190	XQMIHBWXJAOAMX-LBPRGKRZSA-N	426.433	1.713	50	20	IDGD	
CC(C)(C)C(=O)NNC(=O)C(=O)Nc1ccc(Cl)c(S(=O)(=O)N2CCCCC2)c1	761072364	MBUVXBUDQHXUCK-UHFFFAOYSA-N	444.941	1.647	50	20	IDGD	
O=C(NNc1ccc(OC(F)(F)F)cc1)C1=NN([C@H]2CCS(=O)(=O)C2)C(=O)CC1	761590530	AZGOCZGHCYVUEG-NSHDSACASA-N	434.396	1.194	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)[C@H](C)NC(=O)c1n[nH]c2ccccc12	762361365	NLKNGWCUDJEJES-LBPRGKRZSA-N	427.486	1.630	50	20	IDGD	
C[C@H](O)c1cn(CC(=O)NNC(=O)[C@H]2Cc3ccccc3CN2Cc2ccccc2)nn1	763032953	PHMNUYMNXHWUJX-HRAATJIYSA-N	434.500	1.106	50	20	IDGD	
O=C(COC/C=C/c1ccccc1)NNc1ccccc1S(=O)(=O)N1CCOCC1	763432419	HNPMBFURDVQBOS-RMKNXTFCSA-N	431.514	1.881	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)Nc1cccc(Oc2ccccn2)c1	763574447	BGOULQCZNUJLTK-GOSISDBHSA-N	434.408	1.800	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2cccc(-c3nnnn3C3CC3)c2)c1	763648996	HSULFNUUALAPPR-UHFFFAOYSA-N	449.471	1.457	50	20	IDGD	
COC(=O)Nc1cc(NC(=O)C(=O)NNC(=O)COc2ccc(OC)cc2)ccc1F	763660838	HQVNUKDKOQVVKG-UHFFFAOYSA-N	434.380	1.178	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccsc2C(=O)OC)cc1	763862167	VHBFCVOSHVAHIA-NSHDSACASA-N	435.458	1.487	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1ccnn1-c1cccc(Cl)c1	764006071	KHDHPQQYTUZTBM-UHFFFAOYSA-N	441.831	1.697	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1cccc(CS(C)(=O)=O)c1	764011474	HJFSHNWBVMDBTH-UHFFFAOYSA-N	439.877	1.293	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1ccc(C(=O)N2CCCC2)cc1	764012213	OJDQJXRCHMFRON-UHFFFAOYSA-N	444.875	1.984	50	20	IDGD	
O=C(NNC(=O)c1cnccn1)C(=O)Nc1cc([N+](=O)[O-])ccc1Sc1cccs1	764024244	JLESYLQEYOZYSU-UHFFFAOYSA-N	444.454	1.997	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(N(C)C(C)=O)c2)o1	764138191	FAXGYELSZWQNCM-UHFFFAOYSA-N	429.477	1.504	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2O1)C(=O)Nc1cc(F)ccc1OCC(F)(F)F	764151932	AQSPZWDGXGAQNP-HNNXBMFYSA-N	441.337	1.856	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)c2cccc(C#N)c2)sc2c1CCC2	764241824	KXOVWXZJLPVZJR-UHFFFAOYSA-N	426.454	1.685	50	20	IDGD	
Cc1ncsc1C(=O)NNC(=O)C(=O)Nc1ccc(N(C)C2CCN(C)CC2)cc1	764245459	GQNJTLCHIKMCIS-UHFFFAOYSA-N	430.534	1.382	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)C(=O)Nc1cc(N2CCCC2=O)ccc1Cl	764279241	ZYNRLHOQKCBZON-UHFFFAOYSA-N	444.875	1.891	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2nc(C(C)(C)C)ns2)n[nH]1	764377882	ROMIZSVCWPNBEE-UHFFFAOYSA-N	443.489	1.634	50	20	IDGD	
CC(C)(C)NC(=O)c1ccccc1NC(=O)C(=O)NNC(=O)C(F)(F)Oc1ccccc1	764380118	OWFZGCAWESKKGJ-UHFFFAOYSA-N	448.426	1.973	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(C(=O)N2CCC[C@H](C)C2)cc1C	764398608	HNEDDMAOWKXKEI-HOCLYGCPSA-N	448.520	1.005	50	20	IDGD	
COC(=O)c1cc(Cl)cc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)c1	764400027	FHEGCWUMOZLKLB-UHFFFAOYSA-N	437.861	1.710	50	20	IDGD	
O=C(CCC(=O)N1CCN(c2ccccc2)CC1)NNC(=O)COc1ccccc1F	764526379	XUFLWOMJWKLQPR-UHFFFAOYSA-N	428.464	1.481	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)CCc3nc(C(C)C)no3)CC2)cc1	765749624	ZKKBGBPWXQMNCE-UHFFFAOYSA-N	428.537	1.399	50	20	IDGD	
CC(C)c1nnc(CCC(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)o1	766660507	MWSIKSQOYXFRLA-UHFFFAOYSA-N	448.955	1.744	50	20	IDGD	
COC(=O)c1ccc(N2CCN(CC(=O)NNC(=O)Cc3ccccc3C)[C@@H](C)C2)cc1	766863311	OJWWBBFADZJAEO-SFHVURJKSA-N	438.528	1.682	50	20	IDGD	
CCOc1ccc(NS(=O)(=O)c2ccc(C)c(C(=O)NNC(=O)C(C)(C)O)c2)cc1	768262083	SFLSTMZSUNTTKR-UHFFFAOYSA-N	435.502	1.726	50	20	IDGD	
Cc1nc2c(c(O)nn2C)c(C)c1CC(=O)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	768275736	CLBLHZCOWUGSSV-UHFFFAOYSA-N	437.435	1.824	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NC2CCN([C@@H]3CCC[C@@H]3O)CC2)ccc1OC(C)C	769152361	DTGLIZPUFMEBON-MSOLQXFVSA-N	434.537	1.804	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)N[C@H]2CCO[C@]3(CCSC3)C2)nc1	769235043	CULFKFISEZUYDO-KBXCAEBGSA-N	443.595	1.793	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)NCc1ccc(Br)cc1N1CCOCC1	770416156	CPYSFPROBOMHRB-UHFFFAOYSA-N	448.321	1.754	50	20	IDGD	
Cc1cc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c(C(F)(F)F)o1	770478885	RMSZDWAPGRZRNH-ZDUSSCGKSA-N	428.319	1.751	50	20	IDGD	
CCN1CCN(c2cccc(NC(=O)C(=O)NNC(=O)CCCc3cccs3)c2)CC1	770771673	LXTSQCVLAQVHIU-UHFFFAOYSA-N	443.573	1.999	50	20	IDGD	
COC(=O)[C@H]1CCCCN1C(=O)c1cccc(NC(=O)C(=O)NNc2cccc(C#N)c2)c1	773689137	VPPYIQZYFIPPGH-LJQANCHMSA-N	449.467	1.808	50	20	IDGD	
CC[C@H](C)NS(=O)(=O)c1cccc(NC(=O)C(=O)NNc2cnc3ccccc3n2)c1	773718224	JXWBSKNWZVCGOZ-ZDUSSCGKSA-N	442.501	1.788	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)c1ccc(C(N)=O)c(Cl)n1	774327325	OMEHXTAYOFPZLC-MRVPVSSYSA-N	441.669	1.825	50	20	IDGD	
COc1ccc(C(=O)NNc2cccc(S(C)(=O)=O)c2)cc1S(=O)(=O)NC1CC1	776526052	LMLNFTLZGKNWDL-UHFFFAOYSA-N	439.515	1.296	50	20	IDGD	
Cc1ccnc2c(S(=O)(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)cccc12	777596496	VJJOTNINPHPKJF-UHFFFAOYSA-N	448.526	1.417	50	20	IDGD	
Cc1noc(-c2ccccc2C(=O)N2CCN(S(=O)(=O)CBr)CC2)n1	777831699	HPDOYFZMIUVXMK-UHFFFAOYSA-N	429.296	1.485	50	20	IDGD	
CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N1CCN(S(=O)(=O)CBr)CC1	777837568	NWVVOSWWMLPCBO-UHFFFAOYSA-N	435.300	1.101	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(N2CCC(C)CC2)c(C(=O)NN(C)C(N)=O)c1	778411553	DIADQYJFBITRGA-UHFFFAOYSA-N	425.555	1.609	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)NCCOc1ccc(Br)cc1	778636354	HGAJNVKQOHDGEP-UHFFFAOYSA-N	431.287	1.683	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)Nc1cc(C(F)(F)F)ccc1N1CCOCC1	779352025	ZYQMCZIDWYPALG-GFCCVEGCSA-N	434.415	1.746	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)[C@@H]2CC(=O)N(c3ccc(F)c(C)c3)C2)c1	780183768	VVPPSXBFDIUYFE-MRXNPFEDSA-N	427.432	1.800	50	20	IDGD	
CC(=O)N1CCN(c2cccc(NC(=O)NNC(=O)COc3ccc(F)cc3)c2)CC1	782080625	WNXBDNKMSJCBGS-UHFFFAOYSA-N	429.452	1.726	50	20	IDGD	
COC(=O)c1scc(C)c1NC(=O)C(=O)NNC(=O)c1ccc(Cl)cc1OC	782120445	ITIQQUPKCXIZDR-UHFFFAOYSA-N	425.850	1.905	50	20	IDGD	
CCN1CCN(c2ccc(Cl)cc2NC(=O)C(=O)NNc2ccc(OC)cn2)CC1	782144855	FPKJXDZMMAXWQE-UHFFFAOYSA-N	432.912	1.967	50	20	IDGD	
CC(C)(C=NNC(=O)Cc1csc(N2CCOCC2)n1)N1C(=O)c2ccccc2C1=O	782177613	QIPRCLCYPNUYNT-UHFFFAOYSA-N	441.513	1.699	50	20	IDGD	
CC(C)N(C)C(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)c2ccc(O)cc2)c1	782832245	WZDNWGIWLBKJCU-UHFFFAOYSA-N	432.864	1.926	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C(=O)Nc2ccc(Br)cc2F)nc2ccccc21	782885308	JFSBAGFVHMXMRQ-UHFFFAOYSA-N	448.252	1.804	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C(=O)Nc2ccc3nc(C(F)F)[nH]c3c2)nc2ccccc21	782888050	RUAQMCVZRLFMEP-UHFFFAOYSA-N	441.398	1.716	50	20	IDGD	
COCCOc1ccc(F)cc1NC(=O)C(=O)NNC(=O)Cc1nc2ccccc2n1C	782893653	KMMLUIITQQWRLI-UHFFFAOYSA-N	443.435	1.066	50	20	IDGD	
CC(C)Oc1ccccc1NC(=O)C(=O)NNC(=O)c1csc(N2CCOCC2)n1	782896079	BKTKEYUCMSNTFW-UHFFFAOYSA-N	433.490	1.167	50	20	IDGD	
CN(C)C1(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)CCC1	783004818	MBTZWARIOZNKOG-UHFFFAOYSA-N	437.566	1.290	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNc2ncnc3ccsc23)ccc1N1CCCC1=O	783255673	UWQFRPCGXVNVGM-UHFFFAOYSA-N	426.458	1.909	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](n2cc(C(=O)NNC(=O)Cc3cccnc3)cn2)C1	784647718	UVTYSPCDAOAMRI-QGZVFWFLSA-N	428.493	1.854	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNc2nccnc2Cl)cccc1C(=O)N1CCSCC1	784781081	XFPSQYSOYUMWQS-UHFFFAOYSA-N	434.909	1.709	50	20	IDGD	
COc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)C(=O)NNc1cccnc1Cl	784849464	SHIIZPBZBFCEKG-UHFFFAOYSA-N	427.870	1.076	50	20	IDGD	
CCNC(=O)N(C)NC(=O)C(=O)Nc1ccc(Cl)c(C(=O)NCCN(CC)CC)c1	784916657	AMBJDXMPCIEMTJ-UHFFFAOYSA-N	440.932	1.043	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)Nc1ccc(OC[C@@H]2CCCO2)cc1	785023480	NHBVPSMKSDAZHR-HNNXBMFYSA-N	444.400	1.258	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@H]3CN(C)C(=O)c4ccccc43)CC2)cc1	785182210	KWQIXACGVGEJOZ-QFIPXVFZSA-N	449.555	1.129	50	20	IDGD	
CCCNC(=O)[C@H]1CN(C(=O)C(=O)NNc2cc(F)cc(OC)c2)c2ccccc2O1	785236915	KHCILOOVYYELIG-GOSISDBHSA-N	430.436	1.598	50	20	IDGD	
C[C@@H]1[C@H](C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)CCN1C(=O)OC(C)(C)C	786251648	OUIIZVVLBGLWFG-GDBMZVCRSA-N	432.525	1.486	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)N[C@H]2CCCN(Cc3ccc(F)cc3F)C2=O)cc1	786973117	HNLRBXARKMKGCX-SFHVURJKSA-N	427.411	1.972	50	20	IDGD	
CCNC(=O)Nc1ccc(C)c(NC(=O)C(=O)NNC(=O)COc2ccccc2OC)c1	787540664	CPDWQYVWHOODMN-UHFFFAOYSA-N	443.460	1.310	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1)NNc1nnc(-c2ccccn2)s1	788558577	QCNAHXATMHULAG-UHFFFAOYSA-N	449.474	1.320	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1cc(-c2ccc(F)cc2F)nn1C	789732572	WGGPRUWMEMHVAQ-UHFFFAOYSA-N	429.383	1.774	50	20	IDGD	
O=C(NNc1nc2ccccn2n1)C1CCN(S(=O)(=O)c2ccc(F)c(F)c2)CC1	791245338	VQHJKAYEGWGYAI-UHFFFAOYSA-N	436.444	1.552	50	20	IDGD	
CC(=O)NC[C@@H]1CCn2ncc(C(=O)NNC(=O)CC34CC5CC(CC(C5)C3)C4)c2C1	792734724	AFPKOLJRIUBLOJ-LRYXAPPNSA-N	427.549	1.949	50	20	IDGD	
CCOC(=O)c1nn(C)cc1/C=C(\C#N)C(=O)Nc1c(C)n(C)n(-c2ccccc2)c1=O	792865305	DCLVQMXKMWJGFU-RVDMUPIBSA-N	434.456	1.940	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNC(=O)NNC(=O)c1cccc2ncccc12	793228194	ZSIAKUSBXQKNTK-UHFFFAOYSA-N	436.428	1.136	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2cscc2Br)ccc1Cl	794782569	YOKZEULIFYACCM-UHFFFAOYSA-N	438.712	1.886	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1cc(NS(C)(=O)=O)cc(C(F)(F)F)c1	795782609	NTPQOHNQZQHOMB-MRVPVSSYSA-N	425.385	1.180	50	20	IDGD	
CNC(=O)COc1ccc(NC(=O)C(=O)NNc2ccc(Br)cc2)c(C)c1	797042310	DBKGVBBOECPWJL-UHFFFAOYSA-N	435.278	1.964	50	20	IDGD	
Cc1ccc(N2CCOCC2)cc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccc(F)cc1	797535293	LFVMTYAEKMGLQR-OAHLLOKOSA-N	444.463	1.524	50	20	IDGD	
Cn1c(=NNC(=O)CNS(=O)(=O)c2ccc3c(c2)OCCCO3)sc2ccccc21	798304210	WWNCJFMIRKKAGE-UHFFFAOYSA-N	448.526	1.312	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(S(=O)(=O)NNC(=O)c2ccccc2O)c1	800831981	RWVVYEZVTBQGNL-UHFFFAOYSA-N	427.504	1.046	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1)Nc1ccccc1	801991822	YBJGCSQHCJHCIR-QGZVFWFLSA-N	447.473	1.991	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)[C@H](C)S(=O)(=O)C2CCOCC2)c(OC)cc1Cl	802082309	QEMKERFIHSFGMR-JTQLQIEISA-N	449.913	1.492	50	20	IDGD	
COC(=O)c1c(F)cc(NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)cc1F	802567255	LXLSGYKMDKDCMR-UHFFFAOYSA-N	427.747	1.510	50	20	IDGD	
C[C@]1(C2CC2)NC(=O)N(CC(=O)NNC(=O)Cc2nc(-c3ccccc3)cs2)C1=O	802580209	RMBDBZLHAAHAMF-HXUWFJFHSA-N	427.486	1.221	50	20	IDGD	
O=C(NNc1nccnc1C1CCC1)c1ccc(F)c(S(=O)(=O)N2CCOCC2)c1	805462677	PAAABFVCILQWND-UHFFFAOYSA-N	435.481	1.661	50	20	IDGD	
CCc1nnc(NC(=O)[C@H](C)[C@H](C)NC(=O)NNC(=O)COc2ccccc2O)s1	805880621	ICHHMJVRQVLDSA-MNOVXSKESA-N	436.494	1.179	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)c2ccc(C(N)=O)c(Cl)n2)c1	806785361	JVPIIKTZLZDQDT-UHFFFAOYSA-N	427.642	1.680	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ncccc2F)cc1S(=O)(=O)N1CCCCC1	807302454	VIGRUDSEYANEDY-UHFFFAOYSA-N	435.481	1.786	50	20	IDGD	
CC(C)[C@@H](NC(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12)c1nncn1C	807431592	HGNDZNSENXSNQA-OAHLLOKOSA-N	426.481	1.447	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)c1nccn1-c1ccccc1	807583660	FUFPDNZWOZDDLW-CQSZACIVSA-N	431.456	1.824	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(Cl)ncc2Br)c1	810107180	YWKPMMDGWAMEFE-UHFFFAOYSA-N	432.683	1.976	50	20	IDGD	
CC[C@@]1(CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)OCCc2ccccc21	811851697	NYEAXTDQZGJOBA-NRFANRHFSA-N	445.545	1.802	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)[C@@H](C)NC(=O)c1cccs1	812861937	MHMIXGMCSONRDU-SNVBAGLBSA-N	439.877	1.533	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NC[C@@H]2C[C@H](F)CN2C(=O)OC(C)(C)C)c(OC)c1	813816265	OVNLLOYFFRTEBD-STQMWFEESA-N	440.472	1.995	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCc2nncn2C1)C(=O)Nc1ccc(Cl)cc1-c1ccccc1	815692463	RNDCHAJSZLLQLH-CQSZACIVSA-N	438.875	1.947	50	20	IDGD	
Cc1nn(Cc2ccccc2)c(N)c1C(=O)NNc1ccccc1S(=O)(=O)N(C)C	817054148	VPQYNBADEXKNIW-UHFFFAOYSA-N	428.518	1.829	50	20	IDGD	
COc1ccc(N2C(=O)/C(=C\NNC(=O)CCN(C)C)c3ccccc3C2=O)cc1OC	912745976	XNQQJMHIQVCNSM-JXAWBTAJSA-N	438.484	1.804	50	20	IDGD	
C=CCNC(=S)NNC(=O)c1ccc(OC)c(S(=O)(=O)N[C@@H]2CCCC[C@H]2C)c1	913435540	WTCBAMXPCCZVKT-UKRRQHHQSA-N	440.591	1.847	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)CCNS(=O)(=O)c1cccnc1	914612787	WYPYMELHKPGRTK-UHFFFAOYSA-N	445.526	1.643	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)N[C@@H](CN1CCOCC1)c1ccccc1	916216387	HBSQSTCYNDZFLF-IBGZPJMESA-N	442.516	1.868	50	20	IDGD	
N#Cc1cccnc1NCCNC(=O)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1	916640349	VFHGGGAVXOCBGJ-UHFFFAOYSA-N	428.396	1.985	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@H](C)N2CCCCC2)c1	918121541	SVSBRRJWSHUFDO-INIZCTEOSA-N	439.582	1.536	50	20	IDGD	
Cc1ccccc1OCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	918127895	ADZRSQZYHLKQDM-UHFFFAOYSA-N	446.529	1.803	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCC(NC(=O)Nc3ccccc3)CC2)n1	919803874	XGCVCCVHDUMFSM-UHFFFAOYSA-N	430.534	1.428	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2F)c1C(F)(F)F)N[C@@H]1CCS(=O)(=O)C1	919889593	PHDKMKVJKYXRJH-SECBINFHSA-N	449.386	1.161	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)[C@H]2CS[C@H](Cc3ccccc3F)C(=O)N2)cc1	920212652	FRSXQOLFAXJPBL-RTBURBONSA-N	445.516	1.757	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)N[C@H]2CCCN(S(C)(=O)=O)C2)c(C)n1-c1ccccc1	920238708	JKBORGMCANAODK-INIZCTEOSA-N	433.534	1.462	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)c1ccc(N2CCOCC2)cc1	920921832	VCZABVLDMVZYEV-HNNXBMFYSA-N	436.476	1.204	50	20	IDGD	
COCCN1C(=O)/C(=C/NNC(=O)c2ccc(-n3c(C)ccc3C)cc2)C(=O)NC1=S	920978091	UKNMNYCXRHYNDU-SFQUDFHCSA-N	441.513	1.102	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)c2ccccc2S(=O)(=O)N2CCCCC2)c1	929086608	YRVQRWMNICZJPM-UHFFFAOYSA-N	447.513	1.953	50	20	IDGD	
CN(C(=O)OC(C)(C)C)[C@@H](C(=O)NNC(=O)Nc1ccc2c(c1)OCO2)c1cnn(C)c1	1116936364	FGGLUCOYCJBJCL-MRXNPFEDSA-N	446.464	1.910	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)CCc2nc(-c3ccccc3)no2)n1	1317710583	YWNCHBUOBYTNRE-UHFFFAOYSA-N	429.458	1.367	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2cc(Br)ccc2[N+](=O)[O-])cc1	1317918658	YXMQOHOVMULMNU-UHFFFAOYSA-N	430.236	1.989	50	20	IDGD	
COC(=O)c1ccc(S(=O)(=O)NNC(=O)c2cncn2-c2ccccc2)cc1OC	1321332988	WMQOPUJOCRIXTP-UHFFFAOYSA-N	430.442	1.291	50	20	IDGD	
C[C@H](COc1ccccc1F)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	1321958447	SNAGGVZIPHZNKV-CYBMUJFWSA-N	438.481	1.488	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)N[C@@H](C)COc1ccccc1F	1337782721	XNQAKGKBBGOMBY-LBPRGKRZSA-N	437.497	1.839	50	20	IDGD	
COC(=O)c1ccc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](F)Cl)C2)cn1	1778026482	VWJWTAAGAZKXIS-SPYBWZPUSA-N	427.860	1.530	50	20	IDGD	
COCCn1ccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)C(Cl)Cl)C3)n1	1778246133	FZEWNYGMSUJAGF-RDTXWAMCSA-N	433.336	1.461	50	20	IDGD	
Cc1ccc(C(=O)NCC(=O)N2CCO[C@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)cc1	1779299795	DOIMMIXTNACWPT-QFIPXVFZSA-N	447.608	1.406	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](N)Cc1cscn1)C2	1780702495	JDHGWKUPVCKAPK-YIOZNXECSA-N	428.986	1.544	50	20	IDGD	
O=C(C(Cl)Cl)N1CCO[C@]2(CCN(C(=O)C3CCN(c4ccccn4)CC3)C2)C1	1780963060	YMDKKXNFUVGHBJ-FQEVSTJZSA-N	441.359	1.932	50	20	IDGD	
O=C(c1cccc2nccn12)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781332183	DRRHKHXCCGVSAI-WMLDXEAASA-N	425.258	1.468	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1nc3ccc(F)cn3n1)C2)C(Cl)Cl	1782221466	UTYATLSZZFBQNZ-KZULUSFZSA-N	444.294	1.800	50	20	IDGD	
O=C1CSc2ncc(C(=O)N3CC[C@]4(C3)CN(C(=O)C(Cl)Cl)CCO4)cc2N1	1782423514	DJIKAHSBSFBRGA-KRWDZBQOSA-N	445.328	1.373	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(CCN(C(=O)c3cnc4ccc(F)cn34)C2)C1	1782463373	HLIZWDYNAZXFEX-HXUWFJFHSA-N	434.544	1.768	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)Cc3ccc(Cl)cc3OC)C2)C1	1782904042	NJSISZVMEJYGFM-JXFKEZNVSA-N	445.343	1.975	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)c1cc(Cl)cnc1O	1783399287	GBIZJWLARZIRPC-BPNCWPANSA-N	446.729	1.819	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(CCN(C(=O)[C@H]3CCCO3)C2)C1	1783480934	DPNOTOXSFWUAKF-NQIIRXRSSA-N	447.444	1.143	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](O)c1ccccc1Cl)CCO2	1783878193	BSBSAMNDNVCNNJ-FCEWJHQRSA-N	431.316	1.457	50	20	IDGD	
Cc1ccc(CCC(=O)N2CCO[C@@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc1	1783937478	SFYCXXDOHZPTAO-HSZRJFAPSA-N	430.549	1.131	50	20	IDGD	
Cc1ccccc1CCC(=O)N1CCO[C@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1	1783937920	YLTZWRDTBWOHSF-QHCPKHFHSA-N	430.549	1.131	50	20	IDGD	
Cc1cccc(C(=O)N2CC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)c1Cl	1785028203	JDHBYECLAJBUAU-JOCHJYFZSA-N	442.708	1.086	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](N)c3cccc(Cl)c3)[C@H]2C1	1786886391	WDLSLUAIIHLFCA-PEJOBZMASA-N	444.359	1.573	50	20	IDGD	
Cn1nc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Br)C[C@@H]32)c2c1CCC2	1788020856	HDGHHVPJDZPIOJ-YLUJIRGKSA-N	443.317	1.193	50	20	IDGD	
Cc1cn2c(=O)c(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)[C@H](F)Cl)C[C@@H]43)cnc2s1	1788036171	QYCLYNHMALZLLJ-PYJNHQTQSA-N	442.900	1.192	50	20	IDGD	
Cc1cc(C(=O)Nc2ccc(C3(NC(=O)c4cccc(B(O)O)c4)CCC3)cc2)cc(O)n1	1788592855	UZKBJHYGRSJUMO-UHFFFAOYSA-N	445.284	1.837	50	20	IDGD	
Cc1nn(C)c(C)c1CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]2C1	1789926616	DJGKLWJKGIPLSN-QEWYBTABSA-N	445.333	1.250	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccnc(Cl)n1)C2	1792870623	GXRAHYNMBAEJRN-KQXIARHKSA-N	431.718	1.364	50	20	IDGD	
CCc1noc(C)c1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)CBr	1792870935	MSDYVOXXJAAOFL-VFFTVRQLSA-N	428.327	1.780	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCl)C1CC1	1793107050	MXQMCQOCJJUZEN-JJTUDDRGSA-N	443.972	1.918	50	20	IDGD	
Cn1c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](O)CCl)cc2c[nH]c3nccc-3c21	1793113830	UEMZVIGHCCZBPI-LOUJCGABSA-N	429.908	1.858	50	20	IDGD	
C[C@H](NC(=O)c1ccc(F)cc1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCl	1793115782	XUUSUGGEKPTJMW-WZYMBKROSA-N	425.888	1.182	50	20	IDGD	
COc1cncc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Br)C3)c1	1794056050	WVMGUZVJSIMVEO-RMHZUWNSSA-N	444.301	1.303	50	20	IDGD	
CC(=O)Nc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCBr)ccn1	1795114433	IGTUGNZHEIHDOH-XOIINTDNSA-N	439.310	1.028	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1ccccc1Cl)c1ccc(B(O)O)cc1	1795627342	JHQMJJZSDWUANM-REPLKXPHSA-N	426.709	1.514	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCN1CCCCC1	1795705030	BGLABQMCGPYNHQ-PNFLAOTCSA-N	442.564	1.635	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cn3cc(F)ccc3n1)C2	1797956901	LWIURKQNVDSTJF-HBCWATKFSA-N	434.544	1.528	50	20	IDGD	
C[C@H](NC(=O)c1cnccn1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@](C)(Cl)CCl)C2	1798551068	DLVJTJWGOWOQNU-ROOHJGOOSA-N	442.347	1.469	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1c(OC)cccc1OC	1798828233	KEDGDUPKBVAHHW-KYZVSKTDSA-N	426.897	1.161	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(S(C)(=O)=O)ccc1F)C2	1799271809	CEYKUBIFADNXIR-RBNVPPIJSA-N	446.928	1.450	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1[C@@H](O)CCN1Cc1ccccc1	1800299117	GIRSIDIFMNJXDT-WMDQAZIPSA-N	449.979	1.229	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)Nc1cnccn1)C2	1800641962	OCCZGZZCJUECBC-HAFSJTIUSA-N	440.342	1.040	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc3c1NC(=O)C3)C2	1800761654	DPBOMPZEZFOZJF-YGSHXTJESA-N	436.306	1.168	50	20	IDGD	
COc1cccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)Br)c1F	1800764153	XAINYPISTJLKBY-LSSIXWDNSA-N	429.286	1.821	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H](O)C[C@H]1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](F)Cl)C2	1802028172	GIIOVXXJQBHRCG-ZAQNNHEOSA-N	433.908	1.529	50	20	IDGD	
C[C@@H](NC(=O)c1ccccc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2	1802115077	DDRQOAJBSMYSPY-REBRKWNGSA-N	428.316	1.198	50	20	IDGD	
Cc1ncccc1C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1805494328	BPUSFUXNTSIIAP-DENIHFKCSA-N	444.300	1.098	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H](CNC(=O)CS(C)(=O)=O)[C@@H]1c1cccnc1	1806768614	JUYTZZSEWGCKJY-KMFMINBZSA-N	436.361	1.368	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H](CNC(=O)[C@H]2CCC(=O)N2)[C@@H]1c1cccnc1	1806814504	FQRVGPKBTWEIPF-ZLHSVIROSA-N	427.332	1.602	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)CN2CCOCC2)[C@@H]1c1cccnc1	1806913066	PPNNQCXPQRLBIT-LESCRADOSA-N	439.354	1.203	50	20	IDGD	
O=C(c1cnc(-c2ccccn2)nc1)N1CCCC2(CCN(C(=O)[C@@H](O)CCl)CC2)C1	1807357679	JCVWLLLQPVFIEC-SFHVURJKSA-N	443.935	1.983	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)c1ccc2cncn2c1	1810007409	UUIDWUVLEVGUGL-KFKAGJAMSA-N	427.892	1.649	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H](CNC(=O)[C@H](O)N2CCOCC2)[C@@H]1c1cccnc1	1810350312	XXGCSRGVTQLZRA-AOIWGVFYSA-N	438.956	1.003	50	20	IDGD	
CCOCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1)CC2	1813778288	KSAZJHJMXIDJPK-ZFILKEQLSA-N	432.506	1.226	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)cc1	1813888041	JWMIRLQSXFWYBE-YSIASYRMSA-N	444.919	1.959	50	20	IDGD	
C[C@@H]1CCC[C@H]1C(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1	1815344052	DMISCMWSQCEBOP-UHOFOFEASA-N	427.335	1.485	50	20	IDGD	
Cc1ccc(CC(=O)N[C@@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)o1	1815361399	DHOMGGVOAPIWCE-OAHLLOKOSA-N	439.302	1.193	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnoc2C2CC2)n[nH]1	1816659662	ZCABMPYVWDHCKE-MRXNPFEDSA-N	443.508	1.954	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2coc(Cl)n2)[nH]n1)c1ccc(B(O)O)cc1	1817470878	KGKUNYDSTYXXAD-HNNXBMFYSA-N	443.656	1.351	50	20	IDGD	
Cc1ccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)c(O)n1	1820267665	YIVDJSJORTZUPF-INIZCTEOSA-N	443.508	1.498	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CN2CCCCC2=O)[nH]n1	1822373913	ARCXVEYLZMFAGF-UKRRQHHQSA-N	425.917	1.668	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CNC(=O)N(C)C)CC1	1823881406	AVCRCGMICUVWKG-HIFRSBDPSA-N	431.375	1.661	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCS(C)(=O)=O)CC2	1825646663	BGMPIPCDSMCSLC-RKDXNWHRSA-N	438.369	1.273	50	20	IDGD	
CCn1nc(C)cc1C(=O)N[C@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1	1826085124	FSOMTNCOKOJTJY-ZDUSSCGKSA-N	447.565	1.267	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@H]1CCc2nc(NC(=O)CN3C(=O)C=CC3=O)sc2C1	1826319870	TVQNKDNTNOVTAG-HUTHGQBESA-N	445.328	1.216	50	20	IDGD	
C[C@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)COc3cccnn3)sc2C1	1826765061	HXJCZIAOAWMASX-UWVGGRQHSA-N	440.323	1.708	50	20	IDGD	
N#Cc1c[nH]c(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)c1	1827056266	CMMZKRPLGOTTEH-NRFANRHFSA-N	434.305	1.113	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CN2CCS(=O)(=O)CC2)CC1	1830303542	OEDPLNFAMPRVQA-ROUUACIJSA-N	448.029	1.354	50	20	IDGD	
C[C@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1)n1cccn1	1832235859	JOOIYUUVWIDBKM-DYESRHJHSA-N	438.337	1.057	50	20	IDGD	
C[C@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)[C@H]3CCCO3)CC2)CC1	1833263199	FRLQEEJMVUUEJI-RHSMWYFYSA-N	430.387	1.768	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3ccc(O)c(F)c3)CC2)CC1)[C@H](O)CCl	1833313258	CQTPUUOCEXYHHP-GOSISDBHSA-N	427.904	1.316	50	20	IDGD	
Cc1cnc(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](F)Br)CC3)CC2)cn1	1834162628	CHBZCUCKOMYLJR-MRXNPFEDSA-N	442.333	1.661	50	20	IDGD	
Cc1cc(C)nc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCBr)CCO3)C2)c1	1834822538	UDCCIDWECGMIIK-LJQANCHMSA-N	440.338	1.553	50	20	IDGD	
Cc1cc(NC(=O)CC(=O)NC2CCN(C3CCN(C(=O)[C@H](F)Cl)CC3)CC2)no1	1835107592	DRTOUFLOYQBOHT-SFHVURJKSA-N	443.907	1.418	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)C(Cl)Cl)CC2)CC1)c1n[nH]cc1[N+](=O)[O-]	1835869232	GJJTXOUSICJDKL-UHFFFAOYSA-N	433.296	1.307	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1)c1ccncc1O	1835877937	RBLURBRMWGCFBE-INIZCTEOSA-N	443.317	1.663	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1CCC=CO1)CCO2	1837418626	IMFBDCPSQVZRBQ-RLFYNMQTSA-N	431.327	1.309	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)cc(O)n1	1837711604	LRHFNAKRGZBAOE-HXUWFJFHSA-N	437.569	1.017	50	20	IDGD	
C[C@H](Nc1ccccn1)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1837738182	OYICQEYSSVKZCW-KKSFZXQISA-N	438.956	1.603	50	20	IDGD	
O=C(c1cccc(C(F)(F)F)n1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1837931970	AQUKGTSANNKFBB-XJKSGUPXSA-N	439.793	1.705	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccnn3-c3ccccc3)C2)C1	1839145065	SIBZCUIQJAZJJA-XMSQKQJNSA-N	446.935	1.960	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccc(OC)cc3C#N)C2)C1	1839146920	AMPPVKCRPLJANY-DENIHFKCSA-N	449.935	1.583	50	20	IDGD	
C=C(C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2)C(F)(F)F	1839203105	ZWRJUZWOYCMXFP-MFKMUULPSA-N	433.196	1.252	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)CCBr)C3)C2)c(F)c1	1839259324	NLUCHKGSRSDMON-IBGZPJMESA-N	443.313	1.989	50	20	IDGD	
Cc1cccnc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)Br)CCO2	1840030525	OMVMSUFEGPCGGB-KBXCAEBGSA-N	426.311	1.243	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3ccoc3)C2)C1	1840036891	RWEGHSVMJPTIEF-KSSFIOAISA-N	429.311	1.452	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc4ccn(C)c34)C2)C1	1840152753	RZROHTDFVNSGHN-AVRDEDQJSA-N	449.935	1.502	50	20	IDGD	
O=C(c1csc2c1CCCO2)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840187783	WTKUJACOKYKXDT-GOSISDBHSA-N	449.356	1.947	50	20	IDGD	
O=C(c1cc(F)cnc1Cl)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840188973	OORICZXEELQNLQ-INIZCTEOSA-N	440.686	1.748	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CCc3ccccc31)CCO2	1840260648	WCXZBUXBMIETQR-CNNODRBYSA-N	436.936	1.427	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)N2CCO[C@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)c1	1840730921	RRPILOIVFLWKPJ-LJQANCHMSA-N	444.315	1.519	50	20	IDGD	
O=C([C@H](F)Br)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CCCSC1)CCO2	1840865304	MVYSHZKLRGUNML-HEHGZKQESA-N	439.347	1.277	50	20	IDGD	
CN(CC(=O)N1CC2(CCCN2C(=O)C2CC(F)(F)C2)C1)NC(=O)NCc1ccccc1	1841123080	XBHGHOKPNVJPJL-UHFFFAOYSA-N	449.502	1.581	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC12CN(C(=O)c1cc(=O)nc3sccn13)C2	1841287750	DLEUFZGHQKFQER-LLVKDONJSA-N	439.335	1.604	50	20	IDGD	
CC[C@@H](C)[C@@H](O)C(=O)N1CCCC12CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1841630077	NTPQVGPWKFRJFM-QLFBSQMISA-N	431.961	1.729	50	20	IDGD	
COCCOCCOCCC(=O)N1CCCC12CN(C(=O)[C@H](C)CBr)C2	1846247852	JYXJIFQOJPKFLL-OAHLLOKOSA-N	435.359	1.291	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)/C=C/c2cnc(C)s2)C1	1846678012	BUSTULJHEVFCOF-WDTMVEHESA-N	440.529	1.802	50	20	IDGD	
O=C(c1cc(Br)ccc1[N+](=O)[O-])N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl	1847561855	JDTOCVKUCUQQCU-IHRRRGAJSA-N	446.685	1.772	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)NCCc3ccc(S(N)(=O)=O)cc3)cc2C1	9794348	JRIFAFWAAMEERP-LBPRGKRZSA-N	436.559	1.707	50	20	IDGD	
CCn1c(SCC(=O)NNC(=O)COc2ccccc2OC)nnc1-c1ccco1	15879406	JQGFUKHODHMZRJ-UHFFFAOYSA-N	431.474	1.885	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@@H]2CCCCN2S(=O)(=O)c2ccccc2)cc1OC	22083982	HOXCPZUGLBNXMM-KRWDZBQOSA-N	447.513	1.708	50	20	IDGD	
O=C(NNC(=O)C1C[C@@H]2CCC[C@H](C1)C2=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	28665145	KJGZUJACQIMSCN-SJPCQFCGSA-N	433.530	1.628	50	20	IDGD	
CCn1c(=O)[nH]c2cc(C(=O)NNC(=O)c3ccc(Br)s3)ccc2c1=O	108064099	ANFBGPZOIMMYLU-UHFFFAOYSA-N	437.275	1.609	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCC(CN(C)Cc3ccccc3)CC2)n1	110917852	GAYRGLXMNMIXQP-UHFFFAOYSA-N	429.590	1.985	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCCc2ccn(-c3ccccc3)n2)c2ccccc2c1=O	726253066	OMQFNJCJJISUJP-UHFFFAOYSA-N	445.483	1.789	50	20	IDGD	
O=C(NNC(=S)NCCc1cccnc1)c1cccc(S(=O)(=O)N2CCCCC2)c1	727691710	BFUYTCSWIDUGTN-UHFFFAOYSA-N	447.586	1.608	50	20	IDGD	
O=C(NNC(=O)N1CCOCC1)c1ccc(Cl)cc1NS(=O)(=O)c1ccccc1	727801478	GRBXFTNVFIKLKR-UHFFFAOYSA-N	438.893	1.827	50	20	IDGD	
CCOc1cc([N+](=O)[O-])c(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1OC	728847414	DPTKVUHNSPTZMT-UHFFFAOYSA-N	444.448	1.470	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)[C@H]2CS[C@H](Cc3ccccc3F)C(=O)N2)cn1	729691987	GULIDHUIXGRTPJ-HUUCEWRRSA-N	449.533	1.390	50	20	IDGD	
CCOc1ccc(N2C[C@H](C(=O)NNC(=S)Nc3ccc(OC)nc3)CC2=O)cc1	729693377	WHVKWTWSOGOWJI-CYBMUJFWSA-N	429.502	1.860	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)[C@@H]1CCN(c2ccc3c(c2)OCCO3)C1=O	730515607	VTPUYSYFTRYTMJ-ZFWWWQNUSA-N	443.431	1.565	50	20	IDGD	
O=C(COC(=O)c1cc(F)ccc1N1CCOCC1)NNC(=O)c1ccc(Cl)cc1	730862507	QOPQBUXVIVHHDE-UHFFFAOYSA-N	435.839	1.934	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)[C@@H](C)Oc1cccc(Br)c1)c1nnc2n1CCC2	730937453	QHDMMQPWIIGEQO-WDEREUQCSA-N	437.298	1.846	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)CNC(=O)c1c(Cl)cccc1[N+](=O)[O-]	731051251	XUIQUVISJKSJEP-JTQLQIEISA-N	438.799	1.732	50	20	IDGD	
COC[C@@H](C)n1c(C)cc(/C=C(/C#N)C(=O)OCCN(C)S(=O)(=O)N(C)C)c1C	731144447	GRSHUCOSWLDXQG-JQFNYASXSA-N	426.539	1.501	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)c1ccc(S(=O)(=O)NC[C@@H]2CCCO2)cc1	731494049	LZAVUJTVFHSCCD-HNNXBMFYSA-N	433.486	1.227	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)N1CCN(C(=O)COc2ccc(F)cc2)CC1	731499788	GTJYDPVKKGHYMY-UHFFFAOYSA-N	430.436	1.412	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)c2cn(-c3cccc([N+](=O)[O-])c3)nn2)cc1F	731500661	HMSWWXSGDGTSDV-UHFFFAOYSA-N	431.409	1.955	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccco2)c1	731501340	PRICHFCCZAEMAD-UHFFFAOYSA-N	429.454	1.842	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)o1	733108556	RULRJYXVQHIQTE-UHFFFAOYSA-N	431.474	1.617	50	20	IDGD	
COc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1	733170301	WVGVJFACHGPTBL-AWEZNQCLSA-N	443.485	1.009	50	20	IDGD	
CC(C)N(C)S(=O)(=O)c1ccc(C(=O)NNc2nc3ccccc3c(=O)n2C)cc1	733261013	GXSGTGUCIIDCFX-UHFFFAOYSA-N	429.502	1.719	50	20	IDGD	
CN1C(=C(C#N)C(=O)COC(=O)CN2CC(=O)Nc3ccccc32)N(C)c2ccccc21	733611561	OBZNPBWEHJPVLY-UHFFFAOYSA-N	431.452	1.879	50	20	IDGD	
O=C(CN(Cc1ccccc1)S(=O)(=O)c1ccc(Cl)cc1)NNC(=O)C1=COCC1	734119559	DEULHXDGFHRCPK-UHFFFAOYSA-N	449.916	1.983	50	20	IDGD	
COc1ccc([C@H]2[C@H](C(=O)NNC(=O)CNC(=O)c3cccs3)CCC(=O)N2C)cc1	734321507	IKADREZDARAQOA-BEFAXECRSA-N	444.513	1.244	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)c2ccc(N3CCOC3=O)cc2)CC1	734825130	VOYIFSOJKAGYRF-UHFFFAOYSA-N	447.492	1.987	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(CCC(=O)NNC(=O)c2cnn(C)c2)c2ccccc2)cc1	735443908	JKIQGIWQEGHRFN-UHFFFAOYSA-N	441.513	1.775	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCc2cccc(-n3cncn3)c2)nc1	735584417	KJBZFLSGPHPCHB-UHFFFAOYSA-N	444.521	1.519	50	20	IDGD	
O=C(CCN1C(=O)CCc2ccccc21)NNc1ccc(S(=O)(=O)NC2CC2)cc1	737830346	IIVQAVMLEWBQLG-UHFFFAOYSA-N	428.514	1.940	50	20	IDGD	
COc1cccc(OCCCNC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)c1	738501654	YUOFRPVGWOVKMX-UHFFFAOYSA-N	425.445	2.000	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCc2n[nH]cc2Br)nc1	739019646	DYSQJSQTQBJXED-UHFFFAOYSA-N	446.331	1.424	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)N[C@@H](C)[C@H]1CN(Cc2ccccc2)CCO1	741284687	YEGFYWSLCAKMHQ-LAUBAEHRSA-N	426.517	1.858	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1ccnc(OCC(F)(F)F)c1	741661731	GMHRJQPIINVAEK-UHFFFAOYSA-N	445.423	1.699	50	20	IDGD	
Cc1nn(C)c(C)c1C[C@@H](C)C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	743334934	OTKOYNBAUXIOPH-OAHLLOKOSA-N	448.593	1.295	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)[C@H](C)N2C(=O)[C@H]3[C@H](C2=O)[C@H]2CC[C@H]3O2)c1	744352177	ULEMCRIHBIDMSO-ULRWWZNNSA-N	443.500	1.196	50	20	IDGD	
CCCCN1C(=O)CC[C@@H](C(=O)NNC(=O)C(=O)NC(C)C)[C@@H]1c1ccc(OC)cc1	744447097	XGBRQTGQOPFGFF-MJGOQNOKSA-N	432.521	1.447	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)c1	746306355	CIHGDBUFWWASII-ZDUSSCGKSA-N	446.445	1.076	50	20	IDGD	
COC(=O)c1cc(Br)cc(S(=O)(=O)NNC(=O)c2ccc(Cl)nc2)c1	747605980	MMIKHWZNGJYXAI-UHFFFAOYSA-N	448.682	1.907	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)c2ccc(C(=O)NNc3nccn(C)c3=O)cc2)cc1	747941724	MZNMQQBTFBHYTG-UHFFFAOYSA-N	427.486	1.671	50	20	IDGD	
CNS(=O)(=O)c1csc(C(=O)NNC(=O)c2cc(F)ccc2Br)c1	748708365	LTKKKFWZEMGKFG-UHFFFAOYSA-N	436.284	1.633	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)CNS(=O)(=O)c2ccc(Cl)s2)cc1OC	749837775	LFHMXLXVTSZGAX-UHFFFAOYSA-N	447.922	1.548	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)c1ccc(-n2cc(Br)cn2)cc1	751200970	DBDPUURNAPJUKB-UHFFFAOYSA-N	432.234	1.419	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cc(S(N)(=O)=O)cc(Cl)c2F)cc1OC	752267612	DELQGPUXURSTJD-UHFFFAOYSA-N	431.829	1.219	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)N[C@H]2CCCN(Cc3ccccn3)C2=O)c1	753289173	JYDPVQFVJJUWHH-SFHVURJKSA-N	427.461	1.234	50	20	IDGD	
C[C@@H]1CN(S(=O)(=O)c2ccc(NC(=O)NNC(=O)Cc3cccnc3)cc2)C[C@@H](C)O1	755425021	YHVIPKBSFHAVPE-HUUCEWRRSA-N	447.517	1.275	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1csc([C@H]2CCCO2)n1	755936312	BBCNCAGVWRHJMI-OAHLLOKOSA-N	438.531	1.772	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)Nc1ccc(CCN2CCOCC2)cc1	756164444	KTRMAHMAVRCDNJ-UHFFFAOYSA-N	428.489	1.802	50	20	IDGD	
O=C(Cc1ccc(NC(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)cc1)Nc1ccccc1F	756339767	HPFCBNGUKRSKBK-CQSZACIVSA-N	448.476	1.594	50	20	IDGD	
CC(C)C[C@@H](C(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)N1CCCCC1=O	756578388	SSMSQXKDOWYXNZ-INIZCTEOSA-N	434.449	1.326	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(F)c(NC(=O)NNC(=O)c2ccc(O)c(Cl)c2)c1	756686237	UTBSCYHKBUIZLC-UHFFFAOYSA-N	430.845	1.902	50	20	IDGD	
CC(C)CC1(CNC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)CCC1	757265563	JRPAHRZPUAKMPB-UHFFFAOYSA-N	438.598	1.860	50	20	IDGD	
NC(=O)c1ccc(NNC(=O)CCc2nc(-c3cc(Br)cs3)no2)nn1	757393475	YRCGWVNPGRWROO-UHFFFAOYSA-N	438.267	1.525	50	20	IDGD	
Cc1nn([C@@H]2CCS(=O)(=O)C2)c(C)c1NC(=O)NNC(=O)c1cccc2ncccc12	757871073	DBJWRPYHDQVSHB-CQSZACIVSA-N	442.501	1.874	50	20	IDGD	
CCc1nnc(C)cc1C(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	759393307	UBPBPMHHFZQMPR-UHFFFAOYSA-N	430.940	1.580	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)NC[C@H]2CC(=O)N(Cc3ccccc3)C2)cc1C	759683579	OJVKMGJSFXWNBH-GOSISDBHSA-N	437.500	1.621	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)CS(=O)(=O)c2cccc(Br)c2)nc1	759721661	PWYGLKACSSWESL-UHFFFAOYSA-N	428.264	1.548	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)NCc2cn3cc(Br)cc(C)c3n2)n1	760146164	IIDOUKGTLXHYIZ-UHFFFAOYSA-N	434.298	1.749	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Cn2nc(C)cc2C)cc1I	763136815	GTOUFQUJZZYHOG-UHFFFAOYSA-N	428.230	1.574	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)[C@@H](C)Sc3nnnn3C3CC3)n[nH]2)c1	763173725	CEDDSFPKCZPSCE-GFCCVEGCSA-N	426.506	1.957	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2cc(C)c(F)c(C(=O)O)c2)cc(OC)c1OC	763275376	XKMCIBPAHIYLMZ-UHFFFAOYSA-N	442.421	1.481	50	20	IDGD	
COc1ccc2c(c1)[C@@H](C(=O)OCC(=O)NNC(=O)c1ccc(OC)c(OC)c1)CC2	763456189	ZABIRYJURYPORJ-INIZCTEOSA-N	428.441	1.747	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)C(=O)Nc2ccc(OCC(N)=O)cc2)c1	763596379	GNAYQCCDIHYMFT-UHFFFAOYSA-N	442.472	1.147	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)NC(=O)CS3)c2ccccc2n1	763616447	MFRNHCKASFYLDB-UHFFFAOYSA-N	435.465	1.987	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(NC(=O)C2CC2)nc1	763716942	PMPVOEGPLHMKCY-UHFFFAOYSA-N	425.445	1.157	50	20	IDGD	
CN(C)C(=O)c1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)COc1ccccc1C#N	763806283	APNUIUXVVJFYCN-UHFFFAOYSA-N	443.847	1.078	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccccc2S(=O)(=O)C(C)C)cc1	763808729	FBQVRVBATUGPQJ-UHFFFAOYSA-N	433.486	1.342	50	20	IDGD	
Cc1cc(NC(=O)c2ccco2)sc1C(=O)NNC(=O)CNC(=O)c1cccnc1	763823102	ALCSZIBRBWETGN-UHFFFAOYSA-N	427.442	1.488	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cnn(C)c2C(F)F)cc1	763861477	PVWZVRAHKVFJEO-JTQLQIEISA-N	425.392	1.310	50	20	IDGD	
CO[C@@H](C)C(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)c1	763867021	YHXYVJMXYXMLFE-STQMWFEESA-N	446.435	1.353	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cnn(-c3ccccc3)c2)cc1	763878725	TVPDCZLXDHOUAH-OAHLLOKOSA-N	435.440	1.628	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccccc2CC(=O)OC(C)(C)C)n1	763892011	UFMGVORIGWXLEN-UHFFFAOYSA-N	429.477	1.170	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2cc(C3CCC3)nn2-c2ccccc2)n1	763892214	BHPZPYQLWKOTIS-UHFFFAOYSA-N	435.488	1.739	50	20	IDGD	
CC(C)C[C@@H](C)n1nccc1NC(=O)C(=O)NNC(=O)c1cc(Br)cn1C	764004700	LREFIQKZDHEREL-LLVKDONJSA-N	439.314	1.991	50	20	IDGD	
CSc1nnnn1-c1cccc(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3c2)c1	764067586	VCWJREQJLMRCMO-UHFFFAOYSA-N	447.480	1.937	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(CN3C(=O)CSC3=O)cc2)c(O)c1	764105586	VXWWVPFTDZCBSW-UHFFFAOYSA-N	442.453	1.296	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)c2cc(C)[nH]n2)sc2c1CCSC2	764105899	BNFGTOUPSUYMIY-UHFFFAOYSA-N	437.503	1.145	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccnn2Cc2cccc(Cl)c2Cl)n[nH]1	764107072	XPVBKPLVXKJCBY-UHFFFAOYSA-N	436.259	1.669	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccn(-c3ncccc3C(F)(F)F)n2)c(O)c1	764109234	IRQJNCDBLKTCQK-UHFFFAOYSA-N	448.361	1.700	50	20	IDGD	
COc1ccc(NC(=O)c2cccc(NC(=O)C(=O)NNC(=O)CC(F)(F)F)c2)cn1	764115631	BOTPWKZRTZVTBE-UHFFFAOYSA-N	439.350	1.381	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2cc3c(cc2SC)OCCO3)cc1	764127133	ONZNSVGPIWCPPC-UHFFFAOYSA-N	445.497	1.907	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)OC)c(C)c2)o1	764138979	MVKPALMLGRIULF-UHFFFAOYSA-N	430.461	1.616	50	20	IDGD	
O=C(NNC(=O)c1ccoc1)C(=O)Nc1cccc(CS(=O)(=O)c2ccccc2)c1	764159430	WTKQUXLGNXTCJM-UHFFFAOYSA-N	427.438	1.653	50	20	IDGD	
CC(C)S(=O)(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)c1	764170142	ZOOSUJBJUOGOLL-GOSISDBHSA-N	445.497	1.099	50	20	IDGD	
C[C@H]1CCC[C@@H](C)N1C(=O)c1cc(Cl)ccc1NC(=O)C(=O)NNC(=O)CN(C)C	764203048	FFPBCBQMZSAIAC-BETUJISGSA-N	437.928	1.391	50	20	IDGD	
CCCS(=O)(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2cccc(C#N)c2)c1C	764241640	DEUYQXCFBGPONX-UHFFFAOYSA-N	443.485	1.418	50	20	IDGD	
CCOc1cc2c(cc1NC(=O)C(=O)NNC(=O)COc1ccccc1O)O[C@H](C)C2	764280589	QCDDHGSFNKPEPS-GFCCVEGCSA-N	429.429	1.279	50	20	IDGD	
CN1CCCN(c2ccc(NC(=O)C(=O)NNC(=O)Cc3ccccc3F)cc2)CC1	764319653	RAIKLOSVMCMRBC-UHFFFAOYSA-N	427.480	1.296	50	20	IDGD	
COC(=O)c1cc(OC)ccc1NC(=O)C(=O)NNC(=O)CSc1ccccc1OC	764393624	JOYAIHXDHQKWDU-UHFFFAOYSA-N	447.469	1.369	50	20	IDGD	
Cn1c(=O)c2c(ncn2CC(=O)NN=C2CCSc3ccc(Cl)cc32)n(C)c1=O	764813540	ZTDKBGRIPOUEKT-UHFFFAOYSA-N	432.893	1.103	50	20	IDGD	
O=C(CCC(=O)N1CCN(c2ncccn2)CC1)NNC(=O)c1ccc2ccccc2c1	764922427	XHHUENHMAZWMMW-UHFFFAOYSA-N	432.484	1.520	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)c2ccc(=O)n(Cc3ccccc3)n2)n[nH]1	765595165	GASKELHDNOWTAN-UHFFFAOYSA-N	444.451	1.765	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)Cn2cccc(C(F)(F)F)c2=O)n[nH]1	765601810	UXDBLYQBVBRZRS-UHFFFAOYSA-N	435.362	1.727	50	20	IDGD	
CCO[C@@H](C)c1ncc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)s1	765736170	PIGYOMFQMKLIBU-HNNXBMFYSA-N	445.545	1.460	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cnn(-c4ccccc4)n3)CC2)cc1	765747832	IGFBKAIEUQFIDQ-UHFFFAOYSA-N	433.516	1.155	50	20	IDGD	
O=C(CCNC(=O)c1ccco1)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	765759504	URHWJRMKMKIVQX-UHFFFAOYSA-N	447.923	1.018	50	20	IDGD	
CCc1nn(C)c(CC)c1S(=O)(=O)NNC(=O)c1cc(OC)ccc1Br	766321440	NKMYELZYGRQISV-UHFFFAOYSA-N	445.339	1.939	50	20	IDGD	
CC(=O)Nc1ccccc1CC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	766328991	QICXYCQSSQQTQP-UHFFFAOYSA-N	444.513	1.433	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cc(=O)c4ccccc4o3)CC2)cc1	766649419	OPUKIJOQAAOTAH-UHFFFAOYSA-N	434.496	1.680	50	20	IDGD	
COC(=O)[C@H](c1cccc(Cl)c1)N1CCN([C@@H](C)C(=O)NNC(=O)CC(C)C)CC1	766974198	ZLUJWCWQBMNQEB-KXBFYZLASA-N	438.956	1.754	50	20	IDGD	
N#Cc1cc(Cl)ccc1S(=O)(=O)N1CCN(S(=O)(=O)CBr)CC1	767851686	SOWLQUPAZMZBQJ-UHFFFAOYSA-N	442.744	1.200	50	20	IDGD	
Cn1ccnc(NNC(=O)CSc2nnc(-c3ccco3)n2Cc2ccco2)c1=O	768203749	HWJVYMVDGBZSMG-UHFFFAOYSA-N	427.446	1.509	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNS(=O)(=O)c2cncc(Cl)c2)CC1	768272496	QDCAUYWCICJLTD-UHFFFAOYSA-N	433.918	1.627	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)CSc1nnc(-c2ccco2)n1CCC(N)=O	768290147	RJCUBVYJGHEVGP-UHFFFAOYSA-N	442.501	1.204	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)Cc1csc(NC(=O)C(C)C)n1	768637982	DKEAIUYNJVIBQR-UHFFFAOYSA-N	426.520	1.836	50	20	IDGD	
O=C(COC(=O)c1cc(Br)ncc1[N+](=O)[O-])NNC(=O)c1cccs1	769826019	POTPFZKIAFMURR-UHFFFAOYSA-N	429.208	1.432	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCN(C[C@H](C)CBr)CC2)cc1[N+](=O)[O-]	770645599	JPBYLMYOCIQBRJ-GFCCVEGCSA-N	436.328	1.941	50	20	IDGD	
Cc1nc(N2CCOCC2)nc(O)c1CCC(=O)NNc1ccnc(Br)c1	771552363	PXCWYFYGQHEQBS-UHFFFAOYSA-N	437.298	1.561	50	20	IDGD	
COc1ccc(-c2nn(CCC#N)cc2/C=C(/C#N)C(=O)NCCn2ncnn2)cc1OC	771582778	NQJCGNPUPLOBGR-YBEGLDIGSA-N	447.459	1.191	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1c(Br)ccc(Br)c1N	772136713	RWAFQGYOBOKQEJ-LURJTMIESA-N	437.088	1.897	50	20	IDGD	
CN(C)C(=O)Nc1ccc(C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)c(Cl)c1	772338604	AMHPMALKPZVGGY-UHFFFAOYSA-N	443.847	1.923	50	20	IDGD	
Cc1cc(C[C@@H](C)NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)n(-c2ccccc2)n1	772973363	JXDQSLDPNJIKBN-OAHLLOKOSA-N	445.487	1.732	50	20	IDGD	
O=C1CN(c2ccc(NC(=O)C(=O)NNc3ccccc3[N+](=O)[O-])cc2Cl)CCN1	773653600	CJZZSPZTFVUTDL-UHFFFAOYSA-N	432.824	1.266	50	20	IDGD	
C[C@@H]1CCCCN1CC(=O)Nc1ccc(F)c(NC(=O)C(=O)NNc2ncccn2)c1	773720398	YATJATLTOXCZGY-CYBMUJFWSA-N	429.456	1.510	50	20	IDGD	
COc1ncc(/C=C/C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)cn1	773763257	OLGLLBRJHBLDDT-CMDGGOBGSA-N	445.501	1.134	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)Cc2sc(N)nc2-c2ccccc2)n1	775880702	RNYSRXADEKQXDA-UHFFFAOYSA-N	445.526	1.633	50	20	IDGD	
Cc1cccc(NC(=O)N2CCC[C@H](C(=O)NNC(=O)CNC(=O)OC(C)(C)C)C2)c1	778440174	BSUOUONCZZVHCP-HNNXBMFYSA-N	433.509	1.911	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(C(=O)NNc2ccc([N+](=O)[O-])cc2Br)o1	779144526	AOKCGIDCGDPBGR-UHFFFAOYSA-N	433.240	1.958	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)[C@H]2CCN2C(=O)OC(C)(C)C)c2ccccc2c1=O	780172297	XAPHSJPUJXDQOK-OAHLLOKOSA-N	429.477	1.748	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)[C@H]1CC(c2ccccc2[N+](=O)[O-])=NO1	781962038	KSBORFUQLNEFRP-GOSISDBHSA-N	445.457	1.672	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)C(=O)Nc1ccc(C(C)(C)C)cc1	782898022	WMPHXQWNKCFYJU-UHFFFAOYSA-N	445.545	1.985	50	20	IDGD	
CC(C)n1nnnc1-c1ccc(NC(=O)NNC(=O)COc2ccccc2O)cc1F	783093073	QUVAVRTTXBGXPY-UHFFFAOYSA-N	429.412	1.997	50	20	IDGD	
CSc1nnnn1-c1cccc(NC(=O)C(=O)NNc2ncnc3ccsc23)c1	783255341	SCCGYVHFYWOPOJ-UHFFFAOYSA-N	427.475	1.471	50	20	IDGD	
CO[C@@H](C)C(=O)Nc1cccc(NC(=O)C(=O)NN=c2sc3ccccc3n2C)c1	783352576	ZJSJUHKMLSHLHT-LBPRGKRZSA-N	427.486	1.784	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)CNC(=O)c2ccco2)ccc1Oc1cccnc1	784004013	GQRKCZRMABPYKA-UHFFFAOYSA-N	437.412	1.291	50	20	IDGD	
O=C(NNc1ccc(Br)cn1)C(=O)Nc1ccc(N2CCOCC2)c(F)c1	784341528	PADFLUQIVNPQOE-UHFFFAOYSA-N	438.257	1.902	50	20	IDGD	
CCOC(=O)[C@@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNc2cccc([N+](=O)[O-])c2)cc1	784832069	YNRXRGKQUZUZOX-GFCCVEGCSA-N	443.416	1.358	50	20	IDGD	
COC(=O)c1ccc(-n2cc(C)cn2)c(NC(=O)C(=O)NNc2cccc([N+](=O)[O-])c2)c1	784834742	PZKWRSVYCPXCLA-UHFFFAOYSA-N	438.400	1.957	50	20	IDGD	
CCC(=O)Nc1ccc(Cl)c(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)c1	785067782	NMZPVKBKZOAHTR-UHFFFAOYSA-N	442.863	1.665	50	20	IDGD	
O=C(COC(=O)[C@H]1[C@H](C(F)(F)F)[C@H]2CC[C@H]1O2)NNC(=O)c1cccc([N+](=O)[O-])c1	785809304	YQFLQIVNGCDAPY-HBJVGIJOSA-N	431.323	1.255	50	20	IDGD	
CC[C@@H]1CCc2nc(NC(=O)C(=O)NNC(=O)COc3ccc(OC)cc3)sc2C1	789731879	JDGOSEMTEOAXMZ-GFCCVEGCSA-N	432.502	1.832	50	20	IDGD	
CCOc1ccc(NS(=O)(=O)c2ccc3nc(O)cc(C(=O)NNC(C)=O)c3c2)cc1	789815740	FKXNPOSDKXBEFY-UHFFFAOYSA-N	444.469	1.921	50	20	IDGD	
CCc1c(NC(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)cnn1-c1ccc(Cl)cc1	792489810	ZUSDIMBIEKFRIO-JTQLQIEISA-N	428.902	1.179	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)c2cn(C3CCN(C(=O)OC(C)(C)C)CC3)nn2)n1	794071333	CPGRLBIBTVTEPE-UHFFFAOYSA-N	429.481	1.628	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H]2CN(CC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)CC[C@@H]21	795099298	MLKJPTUGNFBULM-WBVHZDCISA-N	447.492	1.687	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)Cn1c(C)nc2cc(F)c(F)cc21	796010382	VQAFODNYVAUDCX-UHFFFAOYSA-N	430.411	1.865	50	20	IDGD	
CCn1cc(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)c(C(F)(F)F)n1	797904694	QNMMWBLSOXIVCB-UHFFFAOYSA-N	447.439	1.700	50	20	IDGD	
COCCCNC(=S)N(C)NC(=O)c1occc1CS(=O)(=O)c1ccccc1	798149311	NBJROLFYXCZEGX-UHFFFAOYSA-N	425.532	1.741	50	20	IDGD	
O=C1N[C@H]2CCN(C(=O)NNC(=O)c3ccc(Br)cc3Cl)C[C@@H]2CO1	798530901	WAZQWVYRIKMFFL-PELKAZGASA-N	431.674	1.887	50	20	IDGD	
COC(=O)c1cccc(NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c1OC(C)C	799248407	KSORRYXJTLDGIS-UHFFFAOYSA-N	439.432	1.703	50	20	IDGD	
Cc1ccc(-c2ccnn2C)cc1NC(=O)C(=O)NNc1cccc(S(C)(=O)=O)c1	799258323	YTMXEWCFMAGQJS-UHFFFAOYSA-N	427.486	1.881	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)c2nnn(CCOc3ccc(F)cc3)c2C)c1	799857913	IBFSTZNCTNJNHP-UHFFFAOYSA-N	443.435	1.897	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CC[C@@](C)(CNC(=O)OC(C)(C)C)C2)n1	801572512	JIUXDAMPJYKURF-IBGZPJMESA-N	425.555	1.378	50	20	IDGD	
COc1cc(C(=O)NCC(=O)NNC(=O)Nc2ccc(Cl)cc2)cc(OC)c1OC	802016573	GXTICMLNUHFYAI-UHFFFAOYSA-N	436.852	1.949	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)[C@H]2CCN(c3ccc4c(c3)OCCO4)C2=O)cc1	802123649	UHCPOTOQDYAQPT-QGZVFWFLSA-N	439.472	1.730	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(OC(F)F)nc2)o1	802566689	BHHMSVQOXXVSIY-UHFFFAOYSA-N	425.392	1.518	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCC(=O)NNC(=O)Cc2nc(-c3ccccc3)cs2)cc1	802581624	WXUMBSHGGLJZRS-UHFFFAOYSA-N	444.538	1.787	50	20	IDGD	
COCCOc1ccc(-n2nc(C)c(C(=O)NNc3ccc(-n4ccnc4)nn3)n2)cc1	804953888	BVPIKBAYPWATRX-UHFFFAOYSA-N	435.448	1.334	50	20	IDGD	
Cc1cc(I)cc(NC(=O)C(=O)NNc2ccnc(N(C)C)n2)c1	807019015	SBZNTFXSSAVQFX-UHFFFAOYSA-N	440.245	1.537	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)[C@@H]1CCN(c2ccccc2Br)C1=O	807371614	OQTLTWGUFZITEN-LBPRGKRZSA-N	442.310	1.739	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2ccc(-n3ccnc3)nn2)ccc1N1CCSCC1	807429260	QLTNOCJJVJSLCW-UHFFFAOYSA-N	438.517	1.606	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)CNC(=O)c2ccc(Br)o2)cc1	812726610	ITEBCFXZTCVPFN-UHFFFAOYSA-N	445.295	1.166	50	20	IDGD	
CN1CCC(CC(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)CC1	813366975	QZZKJCJMUMPISW-UHFFFAOYSA-N	433.512	1.938	50	20	IDGD	
CC(C)n1ncc2cc(NC(=O)C(=O)NNc3ccccc3S(=O)(=O)N(C)C)cnc21	815751886	SLOQNTAEPJQNOL-UHFFFAOYSA-N	445.505	1.344	50	20	IDGD	
Cn1ncc(I)c1C(=O)NNc1nnc(-c2ccccn2)s1	816419113	HVXUQBDMARKHSV-UHFFFAOYSA-N	427.231	1.695	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)[C@@H]1CCCN1C(=O)c1ccccc1OC(F)F	819727547	HGCIEQPLHHIGCG-AWEZNQCLSA-N	443.447	1.829	50	20	IDGD	
CCOc1ccc(N2C[C@@H](C(=O)NNC(=O)CNc3ccccc3OC)CC2=O)cc1	825649301	KSVFUJHHPUCFNU-HNNXBMFYSA-N	426.473	1.706	50	20	IDGD	
CCC[C@H](NC(=O)NCc1ccc(F)cc1)C(=O)NNC(=O)COc1ccc(C#N)cc1	835348692	AIQIADGPCICKLC-IBGZPJMESA-N	441.463	1.892	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(Br)cc1)NNC(=O)Cc1ccc(F)cc1	913155472	WRNPPDNHAKPTPL-UHFFFAOYSA-N	444.282	1.257	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)CCS(=O)(=O)C2CCCC2)c2ccccc2c1=O	915696184	OKLXYIRCLPFQAI-UHFFFAOYSA-N	434.518	1.315	50	20	IDGD	
CCS(=O)(=O)NCCNC(=O)C(=O)Nc1ccccc1S[C@H](Cl)C(F)(F)F	915774890	BPXTZRNGADTLPU-ZDUSSCGKSA-N	447.888	1.900	50	20	IDGD	
Cc1cccc([C@H](CNC(=O)NNC(=O)[C@H]2COc3ccccc3O2)N2CCOCC2)c1	916435366	AESRMOURPHCJKL-GHTZIAJQSA-N	440.500	1.539	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)N1CCc2ccccc2C1	916605083	OSNBNDPISAKMFA-OAHLLOKOSA-N	434.500	1.324	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)c2cnn(C(C)(C)C)c2)c1	916726303	IGUZWROLZBUESO-UHFFFAOYSA-N	449.533	1.313	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C[C@](O)(c3nccn3C)C(F)(F)F)n[nH]2)cc1	917178407	KMQWUHKCOZZFKJ-SFHVURJKSA-N	436.394	1.720	50	20	IDGD	
O=C(Cc1ccc2ccccc2c1)NNC(=O)C1CCN(c2ccc3nncn3n2)CC1	917198062	XKLAMODUAZQEKL-UHFFFAOYSA-N	429.484	1.884	50	20	IDGD	
CCOc1ccc(NC(=S)NNC(=O)c2ccc3c(c2)S(=O)(=O)N(CC)C3=O)cc1	917524825	DXKLJAWSNIFNNF-UHFFFAOYSA-N	448.526	1.881	50	20	IDGD	
COc1cc(C=NNC(=O)Cc2csc(N3CCOCC3)n2)ccc1OC(=O)C1CC1	917566417	MVQYITSIQOOXIN-UHFFFAOYSA-N	444.513	1.997	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)NCCC(=O)N2CCN(C)CC2)c(C)n1C[C@H]1CCCO1	918695926	GRMUWBPGNAYKLF-OKPNHQCWSA-N	427.549	1.471	50	20	IDGD	
C[C@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(C(=O)NNC(=O)NCC(F)(F)F)cc2)C1	918707098	RDROAORQDZNDGT-TXEJJXNPSA-N	436.456	1.860	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(-c3ccccn3)nc2O)c1	920276231	SCCKDZOXVQTQMW-UHFFFAOYSA-N	441.469	1.174	50	20	IDGD	
O=C(COC(=O)c1ccc(-n2cccn2)c(F)c1)NNC(=O)[C@H]1COc2ccccc2O1	1321596853	SDHQKTPKYTYFGH-GOSISDBHSA-N	440.387	1.156	50	20	IDGD	
COc1cc(Cl)c(Br)cc1C(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1	1321919404	YPQDIWLBIMISHG-ZETCQYMHSA-N	425.688	1.307	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4nonc4c3)C2)C1	1777721497	KBAXQKZHKXAWNT-FZKQIMNGSA-N	437.294	1.840	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4nccn4c3)C2)C1	1778016927	XVUIOGAURNCPTG-BEFAXECRSA-N	435.322	1.951	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(O)n1)C2)[C@@H](F)Br	1780771590	MQZUMZLXNUJRDI-SUYBPPKGSA-N	430.274	1.605	50	20	IDGD	
Cc1cc(NC(=O)CC(=O)N2CCO[C@@]3(CCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)no1	1781229528	IJDKZUBWUJBJID-ROUUACIJSA-N	447.319	1.378	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)Cc3ccc4ncnn4c3)CCO2)C1	1781232841	ZATICAHHZXUMGG-MOPGFXCFSA-N	440.331	1.338	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@](C)(O)C(F)(F)F)C2	1781997426	VWGFCZKWIIEZEW-RBDSIQFVSA-N	445.276	1.597	50	20	IDGD	
CC(=O)C(=O)N1CCO[C@]2(CCN(C(=O)/C(C#N)=C/c3ccc(Br)cc3)C2)C1	1782869541	FDXQUNWENVKUBQ-QGRTWZNFSA-N	446.301	1.775	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)[C@@H](O)Cc3ccccc3)CCO2)C1	1783355846	YILOJXLBDHFEER-ABSDTBQOSA-N	439.350	1.593	50	20	IDGD	
O=C(CCc1ccc(F)c(F)c1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21	1783799454	HCHOPOGKFSLWGC-USJZOSNVSA-N	430.879	1.477	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)COc3cccc(Cl)c3)[C@H]2C1	1783806431	IAQMKEZRCGVVFF-RUGDWHBFSA-N	445.343	1.952	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(C1)CN(C(=O)C1(NC(=O)OC(C)(C)C)CC1)CCO2	1783883935	NIWLHXOSZXUPFZ-IFXJQAMLSA-N	445.944	1.127	50	20	IDGD	
COc1ccc([C@@H]2C[C@@H]2C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]3C2)cc1	1784085045	BQAQQPSXKQSMSH-YFFHVDCVSA-N	436.936	1.378	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccn(CC)n3)[C@H]2C1	1786174578	OVQGIWJMIZHREZ-AYDFFVQHSA-N	427.343	1.670	50	20	IDGD	
C[C@H](Br)C(=O)NC1(c2ccc(NC(=O)[C@@H](N)CCC(N)=O)cc2)CCC1	1787978165	OCVKUDCGYDTYLM-FZMZJTMJSA-N	425.327	1.497	50	20	IDGD	
Nc1ncc(C(=O)NC2(c3ccc(NC(=O)c4cccc(B(O)O)c4)cc3)CCC2)s1	1788143531	BSTCKSFNIQNHKI-UHFFFAOYSA-N	436.302	1.467	50	20	IDGD	
O=C(C[C@@H]1CNc2ccccc2O1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21	1788552040	OEPCXWHGXYZBRU-XYKJDMJCSA-N	425.888	1.764	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]2C1	1788762396	VBVQMTQGEZEJRY-AJNGGQMLSA-N	435.435	1.849	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CC(=O)N(C4CCCC4)C3)C[C@@H]21	1789859103	YSTSCUMVCUWQAK-BVRUVYRISA-N	439.984	1.775	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]2C1	1789925244	CSXHUEACIBKWPC-ZJQBRPOHSA-N	425.371	1.508	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/c3cnc[nH]3)C[C@@H]21	1790963918	OJJUFIUBBADMST-SNXWUPKKSA-N	425.327	1.576	50	20	IDGD	
Cc1ccc([C@H](C)C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]3C2)cc1	1791293265	QQVHRLLTGZZPEO-VMXMFDLUSA-N	444.576	1.451	50	20	IDGD	
Cc1ccc(/C=C/C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]3C2)s1	1791293322	VLOJWMKDJOXSPL-BFKPZHMHSA-N	448.589	1.422	50	20	IDGD	
Cc1nnc(CC(=O)NC2(c3ccc(NC(=O)CCC(=O)NN(C)C)cc3)CCC2)o1	1791600217	UTDNLQSCICQVBJ-UHFFFAOYSA-N	428.493	1.428	50	20	IDGD	
CCOC(=O)C(C)(C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)Br)C[C@@H]21	1792228169	BLRWNAFXGZCHLO-RFGFWPKPSA-N	433.343	1.339	50	20	IDGD	
COc1ccc(OCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CCC(=O)NN(C)C)C3)cc1	1792802591	BUAZTZVDKQKWHE-BJWYYQGGSA-N	432.521	1.085	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nn(C)c3c1CCC3)C2	1792868365	VWNQPPSIKGSNGE-JFILPPLUSA-N	439.354	1.143	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](O)CCl)C1	1793116776	TYWMDLFGHMWLJN-UUAJXVIYSA-N	443.972	1.871	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cncc(N(C)C)c1	1794296700	LVMTZCSWHBNGOI-OEYIWLLWSA-N	425.327	1.134	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCBr	1795113202	NMFNRRICGSYEEV-HNCHTBHHSA-N	426.149	1.392	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)c1cccnc1-c1cccc(F)c1	1796034000	WTZYGNKWDRTMDT-WTLGNFPFSA-N	447.894	1.691	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnc2cc(Cl)ccn12	1796059077	CDLXLQXBVUMFMF-IFOZYUSPSA-N	441.315	1.445	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H]2C[C@]21C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Cl	1796369548	YVFCOYSHJHMNGM-CMVVLZHBSA-N	445.919	1.510	50	20	IDGD	
COc1ccc2oc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)c3cccc(B(O)O)c3)C4)cc2c1	1798002152	XPPKVSLBOJKOMB-REPLKXPHSA-N	448.284	1.687	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2sccc2[nH]1	1798203620	ZKWVYWAFDKRYJE-CLLJXQQHSA-N	438.513	1.794	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(-c2cnco2)c1	1799647538	FFBOCNNFPBSHQK-SFNKJDCFSA-N	433.892	1.799	50	20	IDGD	
Cn1cc2cc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)CCBr)C4)ccc2n1	1799912157	ZEAMNDADWIVPKP-JLVBRIDZSA-N	435.322	1.562	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1(N2CCN(C)CC2)CC1	1799975706	ADZBFCYMYUEXRQ-NXOAAHMSSA-N	441.414	1.436	50	20	IDGD	
O=C1CCc2ccc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)[C@H](F)Br)nc2N1	1800158875	DRVWYUAQCVMKHA-OXIQGZBJSA-N	439.285	1.909	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc([N+](=O)[O-])[nH]1)C2	1800642437	HXALCNDNHNKYIM-MIJXAVMKSA-N	429.271	1.300	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/C(=O)c1cccs1)C2	1800756757	DMVCSQBFZQXYPA-FNWDTHLHSA-N	441.347	1.860	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(OC(F)F)cn1)C2	1800758391	WHBHEYOORNNMRV-NJBDSQKTSA-N	448.264	1.670	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc2occc2c1O)c1cccc(B(O)O)c1	1801048822	SMOVZGBMYCRNHU-BJWYYQGGSA-N	434.257	1.384	50	20	IDGD	
CNC(=O)CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](Br)Cc1ccccc1	1801568074	QSVQZUWQSUHJMB-YYIAUSFCSA-N	436.350	1.767	50	20	IDGD	
C[C@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](C)[C@H]1SC(=N)NC1=O)C2	1801961177	FXXQDFUZTWMCCM-IQMQYZSSSA-N	431.356	1.210	50	20	IDGD	
C[C@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](O)NC(=O)OC(C)(C)C)C2	1801965334	HCJNJQSPVLEVNN-BYNIDDHOSA-N	434.331	1.251	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cccn3cncc23)[C@H]1c1cccnc1)[C@H](O)CCl	1803142681	GYGBYHLTQKJTFI-IPELMVKDSA-N	427.892	1.649	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cn3cc(F)ccc3n2)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803143258	XXBCSTIQQOSUGS-UCLAIMLFSA-N	445.882	1.788	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]1c1cccnc1	1803145807	IGYJVHARHXLIGO-RHQZKXFESA-N	449.935	1.443	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)C#CC2CC2)[C@H]1c1cccnc1	1803451032	PQNVPCXJBGAQPU-AKTXGKLESA-N	446.511	1.635	50	20	IDGD	
Cc1ncccc1CCC(=O)N1CCCC2(CCN(C(=O)CCC(=O)NN(C)C)CC2)C1	1806819236	XTGUQXLTHUIZCY-UHFFFAOYSA-N	443.592	1.927	50	20	IDGD	
NC(=O)c1ncccc1C(=O)N1CCCC2(CCN(C(=O)[C@@H](F)Br)CC2)C1	1807382317	SOZMZWNEBFZOPN-CQSZACIVSA-N	441.301	1.716	50	20	IDGD	
Cc1noc(CC(=O)NC[C@H]2CCN(C(=O)CCBr)[C@@H]2c2cccnc2)n1	1807523141	VNUJPWXYMYQJAA-RDTXWAMCSA-N	436.310	1.807	50	20	IDGD	
CC(=O)NCCC(=O)N1CC[C@H](CNC(=O)[C@H](F)Br)[C@H]1c1cccnc1	1808678332	HPFSCFSNLGQJDH-BMFZPTHFSA-N	429.290	1.304	50	20	IDGD	
CSCC[C@H](O)C(=O)N1CC[C@H](CNC(=O)[C@H](F)Br)[C@H]1c1cccnc1	1808678994	SMZKUCDKDNEVNF-BARDWOONSA-N	448.358	1.892	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)c1cnn2ccccc12	1809068462	DFCZJHONMCTHRB-SNRMKQJTSA-N	427.892	1.649	50	20	IDGD	
COc1ccc(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)c(O)c1	1811749778	HYEGZXAYUVRQTD-JVPBZIDWSA-N	433.892	1.715	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)C(Cl)Cl)[C@H]1c1cccnc1)[C@@H]1CCCS1(=O)=O	1812497860	CAJSRVQOOITSIH-IHRRRGAJSA-N	434.345	1.468	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)N1CC[C@H](CNC(=O)[C@@H](Cl)COC)[C@@H]1c1cccnc1	1813034787	XSSSAWICLCJYKK-SIXLDLHFSA-N	441.912	1.903	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)CCc2ccco2)[C@@H]1c1cccnc1	1813070348	HYXYZWAEJJLTQG-WZONZLPQSA-N	441.532	1.686	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2ccc(O)cc2)[C@@H]1c1cccnc1	1813072770	KFUPRXRLVQSAMU-PGRDOPGGSA-N	439.516	1.480	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CNCP(=O)(O)O)n[nH]1	1817232155	NIOSFMNEEUKEBB-WCQYABFASA-N	435.849	1.534	50	20	IDGD	
CC(C)CNC(=O)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](C)CBr)CC2	1817319932	CNOHJWAXSYAGHO-WDEREUQCSA-N	445.383	1.858	50	20	IDGD	
CC(C)O[C@H](C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1819504103	ODJXHSSFUHJNSY-KDOFPFPSSA-N	428.298	1.209	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](F)Br)[nH]n1)c1cc(CO)on1	1820350452	JNKDDDPVJZLFLH-WCQYABFASA-N	430.234	1.886	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H]2C[C@H]2F)n[nH]1	1820778114	WECNMUMNUGJOBS-MEGIBFAXSA-N	429.456	1.894	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H]2CNC(=O)C2)n[nH]1	1821955899	XKNGXYIESWVBPN-NTZNESFSSA-N	426.315	1.569	50	20	IDGD	
CCOC(=O)N[C@H](O)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](C)Br)n[nH]1	1822188701	HVKKXDGMMWEVJB-NURSFMCSSA-N	446.302	1.250	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CN2CCSCC2)[nH]n1	1822367118	NOKVGEKYPZMRJR-DZGCQCFKSA-N	429.974	1.704	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)Cc2ccc3ncnn3c2)[nH]n1	1822374668	ZFUUAWVXQNZUPH-ZBFHGGJFSA-N	445.911	1.941	50	20	IDGD	
O=C([C@@H]1CC(c2ccccc2)=NN1)N1CCC([C@@H]2CCCCN2C(=O)[C@H](O)CCl)CC1	1824187917	LJTJPDAOYTZQOL-PCCBWWKXSA-N	446.979	1.972	50	20	IDGD	
Cc1cc(C(=O)N[C@@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)cc(O)n1	1826086249	OKDQOCKLFNYMOA-CYBMUJFWSA-N	446.533	1.151	50	20	IDGD	
O=C(c1ccc(O)cc1)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827056834	XREJRAOYWPPNOF-QFIPXVFZSA-N	436.317	1.619	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)CNC(=O)c2ccco2)CC1	1827185588	RKRUMNNRXFUKMN-IAGOWNOFSA-N	439.940	1.883	50	20	IDGD	
Cc1ccc(C(=O)C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)cc1	1830369832	CAHXKCCPOWSNOV-QFIPXVFZSA-N	436.936	1.899	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cncc(N(C)C)c3)C2)C1	1831644339	VRKOLTCQXPYXFP-RXVVDRJESA-N	438.956	1.625	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(C)nc3O)C2)C1	1831653819	FAGRVDPDBJWVQO-UZLBHIALSA-N	425.913	1.573	50	20	IDGD	
CCNC(=S)NCC(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H](Cl)COC)CC1	1831834753	HMLGGPPIPFYRGB-JKSUJKDBSA-N	433.018	1.344	50	20	IDGD	
O=C(Cc1cc([N+](=O)[O-])ccc1F)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1832430254	ZRHNIORVBRLXHJ-SJLPKXTDSA-N	447.822	1.267	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cnn4ccccc34)CC2)CC1)[C@H](O)CCl	1833310039	GRDOAHKWZAIPAL-LJQANCHMSA-N	433.940	1.119	50	20	IDGD	
Cc1ccc(CCC(=O)NC2CCN(C3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)cn1	1833804364	VVMFIXAMRLPHNK-FQEVSTJZSA-N	436.984	1.494	50	20	IDGD	
Cc1nocc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)CBr)C2)C1	1834332315	KTZISDKWJUUOPC-SJCJKPOMSA-N	430.299	1.084	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)NC(=O)OCC)CC2)CC1	1835642765	QYIRSQIVBHCUPS-AEFFLSMTSA-N	446.976	1.030	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)[C@H]3C[C@H]3C3CC3)CC2)CC1	1836662356	ZANNMUXYBBFPOB-PMACEKPBSA-N	434.581	1.404	50	20	IDGD	
O=C(c1c(F)ccc(O)c1F)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836718277	TYSPATJFHWZKEL-MRXNPFEDSA-N	446.878	1.882	50	20	IDGD	
Cc1nc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)sc1C	1838412120	VGGVYLFZWXRQFY-PIGZYNQJSA-N	446.367	1.613	50	20	IDGD	
C[C@H](Cn1cncn1)C(=O)N1CCC(OC2CCN(C(=O)C(Cl)Cl)CC2)CC1	1838421398	QCZPEJLWYUTNGA-CYBMUJFWSA-N	432.352	1.717	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)c3cc(F)c[nH]3)CC2)CC1	1838777089	AGWLAGGIAFJEQV-UHFFFAOYSA-N	437.516	1.139	50	20	IDGD	
CC(C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2	1839150029	AEQFMFOSELQNLT-ZWKOTPCHSA-N	425.353	1.494	50	20	IDGD	
Cc1cccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)c1F	1839197444	WOVMWWAAHPCGKY-QAPCUYQASA-N	447.276	1.895	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccccc3O)CCO2)C1	1839909438	LNYLXJYNTYPKQW-AUUYWEPGSA-N	441.322	1.175	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)C3(C#N)CCC3)C2)C1	1839967643	STJPNQXMKZXZFX-RDTXWAMCSA-N	428.327	1.310	50	20	IDGD	
C=CCOCCCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2	1840030279	HOTBCOTWOORCIO-QAPCUYQASA-N	433.343	1.209	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)COC3CCCCC3)C2)C1	1840030446	MSCCYYSCJZMRHN-DNVCBOLYSA-N	447.370	1.576	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3c(F)cccc3F)C2)C1	1840034431	LAIQXMWBRFGBMT-KPZWWZAWSA-N	447.276	1.818	50	20	IDGD	
O=C(CNc1ccc(F)cc1)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840187880	CIBBGPPHFWVOFC-SFHVURJKSA-N	434.295	1.498	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3c(C)cc(C)cc3C)CCO2)C1	1840673569	IVKCNTPZXCWDRX-PGRDOPGGSA-N	438.952	1.936	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@H]1C(=O)N1CC2(CCCN2C(=O)[C@@H](C)CBr)C1	1841289644	LRPPQWGTCXPZNC-RRFJBIMHSA-N	427.339	1.976	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)[C@H]2CNc3ccccc32)C1	1842933957	LBHRBEPIDBXDGN-AEIQVQRHSA-N	434.500	1.533	50	20	IDGD	
CC1(C)Cc2cccc(C(=O)N3CC4(CCCN4C(=O)c4cccc(B(O)O)c4)C3)c2O1	1843013706	CGRODJJGFXKGDD-UHFFFAOYSA-N	434.301	1.211	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2cc(C(F)(F)F)c[nH]2)C1	1843486374	BRYPODGJICTJIE-UHFFFAOYSA-N	436.394	1.163	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC2(CCCN2C(=O)c2ccc3c(c2)n(C)c(=O)n3C)C1	1843733162	CPOPVXZFQFSGKW-ZDUSSCGKSA-N	449.349	1.725	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)c1cc(CO)on1)C2	1844692880	VABTVMQLVSTAOG-UHFFFAOYSA-N	444.400	1.131	50	20	IDGD	
CCOc1ccc(Cl)cc1C(=O)N1CCCC12CN(C(=O)c1cccc(B(O)O)c1)C2	1845394381	UVJXIAFYNLKDTL-UHFFFAOYSA-N	442.708	1.549	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCCC12CN(C(=O)Cn1cccc([N+](=O)[O-])c1=O)C2	1846072020	BNDGACWHNLQCLM-GFCCVEGCSA-N	441.282	1.133	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCCC12CN(C(=O)CN1C(=O)CSC1=S)C2	1846073073	KITPTUHBCGCUTC-SNVBAGLBSA-N	434.381	1.224	50	20	IDGD	
CC[C@H](C)[C@@H](O)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O	1847831228	DHEWTGDEFKOFFF-SJIKZXFPSA-N	433.461	1.743	50	20	IDGD	
CN(C)C(=O)[C@@H](NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)c1ccccc1	15474789	NEFIKQQNXUWJEJ-IBGZPJMESA-N	430.530	1.535	50	20	IDGD	
CC[C@H](C)[C@@H](C(=O)OCC(=O)NNC(=O)c1cccs1)N1C(=O)c2ccccc2C1=O	18362849	ZJXHTOQPTPRJEH-SJCJKPOMSA-N	443.481	1.763	50	20	IDGD	
CC(C)(C)C(=O)NCC(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	22737182	UDCLUALGJHSWMX-UHFFFAOYSA-N	435.488	1.312	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@@H]1CCCN(Cc2ccccc2)C1	108709619	BFQPPSHQKXYCKK-GOSISDBHSA-N	443.573	1.961	50	20	IDGD	
C[C@H]1CN(CCNC(=O)NNC(=O)COc2ccccc2Cc2ccccc2)CCO1	726256008	MOBMYYCZQXGDIT-SFHVURJKSA-N	426.517	1.707	50	20	IDGD	
O=C(NNC(=O)c1ccc[nH]1)c1cccc(NS(=O)(=O)c2ccc3c(c2)OCCO3)c1	726629600	JVZVIVCYJCNRMQ-UHFFFAOYSA-N	442.453	1.662	50	20	IDGD	
CCNS(=O)(=O)c1ccc(C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)cc1	726862139	DDATZPVTBLWVKP-UHFFFAOYSA-N	438.531	1.182	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)[C@@H]2CCCN(C(=O)c3ccc4n[nH]cc4c3)C2)cc1	728204511	SGSRTCOZDVKKJH-QGZVFWFLSA-N	434.500	1.983	50	20	IDGD	
Cc1c(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)oc2c1C(=O)CCC2	728325960	HVERTFPICYNFQF-MRXNPFEDSA-N	428.397	1.251	50	20	IDGD	
O=C(COC(=O)c1ccc(-n2cccc2)cc1O)NNC(=O)[C@@H]1COc2ccccc2O1	728362400	NGTIDTNXCNFTQY-IBGZPJMESA-N	437.408	1.327	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NC2CC(c3ccccc3)C2)cc1	728400908	WGBDRHDTILSLQS-UHFFFAOYSA-N	430.530	1.892	50	20	IDGD	
CN(CC(=O)NNC(=O)c1ccc(CSc2nncn2C)cc1)C(=O)OC(C)(C)C	728712738	CIJFLBZWAOZACC-UHFFFAOYSA-N	434.522	1.735	50	20	IDGD	
Cn1ccnc1CNC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	728752137	CLFVYKVVMQBTKB-UHFFFAOYSA-N	442.501	1.043	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)Cc3cccnc3)CC2)c(C)c1	728855655	JRAGOFPEVQFKTR-UHFFFAOYSA-N	430.530	1.489	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCN(c2ccc(Cl)cc2)C1=O)C1CCN(c2ncccn2)CC1	728890743	ZEMYEMVOEDBIQM-KRWDZBQOSA-N	442.907	1.547	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1ccc2c(O)nc(S)nc2c1	728983811	RIARSYJUQAXCBR-UHFFFAOYSA-N	425.474	1.092	50	20	IDGD	
O=C(COC(=O)[C@@H]1CC(=O)N(c2ccc(F)cc2)C1)NNC(=O)c1cccc(Cl)c1	730367789	KRJVOEXNRIWSQG-CYBMUJFWSA-N	433.823	1.836	50	20	IDGD	
COc1ccc2nc(Cl)ccc2c1S(=O)(=O)NNC(=O)COc1ccccc1O	730811988	IVVVXDMRFNFLHX-UHFFFAOYSA-N	437.861	1.991	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)N1CCN(CC(=O)Nc2ccc(F)cc2)CC1	731500449	FFHIXVZKEUPQKM-UHFFFAOYSA-N	429.452	1.445	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2nc(-c3ccccc3)n(-c3ccccc3)n2)ccc1=O	732053961	MSZZJVAPQUMMGC-UHFFFAOYSA-N	429.440	1.586	50	20	IDGD	
CCCNC(=O)NNC(=O)CCC(=O)N[C@@H](C)C(=O)c1ccc(Br)cc1	732063472	WYXMBWIUBHQVLK-NSHDSACASA-N	427.299	1.657	50	20	IDGD	
C[S@](=O)CCCNC(=O)/C(C#N)=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	732111968	BWQMYGQSFCWDBP-XIEWPBCPSA-N	447.948	1.871	50	20	IDGD	
CC[C@H]1CCCN(C(C)(C)CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)C1	732235344	AJBOBTGVNXWNNA-HNNXBMFYSA-N	438.598	1.824	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2oc3ccccc3c2CS(C)(=O)=O)C[C@H](C)O1	732260108	AVWKVBFRUMJFEL-KBPBESRZSA-N	437.518	1.238	50	20	IDGD	
Cc1c(/C=C(\C#N)C(=O)NCC2CCN(S(=O)(=O)C(F)F)CC2)cc(C#N)n1C	732971549	RHZGIWHKQQJBKX-VIZOYTHASA-N	425.461	1.493	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)N[C@H]3CCN(CCN4CCOCC4)C3)cc2C1	734686739	TUHIQNSMLZEOQY-RDJZCZTQSA-N	435.594	1.223	50	20	IDGD	
NC(=O)c1ccc(N2CCN(C(=O)NNC(=O)c3cc(Br)c[nH]3)CC2)cc1	735512906	RBHIQYLKPJXKDW-UHFFFAOYSA-N	435.282	1.053	50	20	IDGD	
CCc1cc(NNC(=O)c2cc(NS(C)(=O)=O)ccc2O)nc(-c2ccccn2)n1	738537851	ABZNKSMUGXFXAG-UHFFFAOYSA-N	428.474	1.935	50	20	IDGD	
Cc1cc(C=NNC(=O)C[C@H](C(=O)NN=Cc2cc(C)[nH]c2C)N2CCOCC2)c(C)[nH]1	741765711	CAIXEONUSFOFEN-HXUWFJFHSA-N	441.536	1.268	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NN=C2CCS(=O)(=O)c3ccc(F)cc32)cc1	741770139	FGQHCTMLPPGIEN-UHFFFAOYSA-N	425.463	1.932	50	20	IDGD	
O=C(CS[C@@H]1CCS(=O)(=O)C1)NNC(=O)NCc1cccc(C(F)(F)F)c1	742459736	WKJPLWBOHXQELO-GFCCVEGCSA-N	425.454	1.456	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)c2cn([C@H]3CCS(=O)(=O)C3)nc2C(C)C)c1	742471876	KSJZSJVEYAJKKD-HNNXBMFYSA-N	434.518	1.515	50	20	IDGD	
CCc1ccc([C@H](COC)NC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)o1	743635741	WDKYNELYQXNVMX-AWEZNQCLSA-N	437.522	1.775	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1csc(-c2ccccn2)n1	744620869	PQRVQGLQRAZZKW-UHFFFAOYSA-N	445.526	1.983	50	20	IDGD	
CNc1ccc(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-]	744621178	UEGPSDBVNVPHFA-UHFFFAOYSA-N	435.462	1.414	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)c1cc(Cl)ccc1Cl)C(=O)NNC(=O)N(C)C	746012797	LREOTPMADOKJNO-NSHDSACASA-N	443.378	1.696	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)C2CCN(C)CC2)c1	746093979	WGCBOIXNRJCEDQ-UHFFFAOYSA-N	446.529	1.599	50	20	IDGD	
O=C(CCN1CCN(c2ccccn2)CC1)NNc1ccc(S(=O)(=O)NC2CC2)cc1	746200308	HKLKRRRLWCLSTA-UHFFFAOYSA-N	444.561	1.178	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)[C@H]1CCCN(c2ncnc3sccc23)C1	746556375	UXBIXNYNGZUXPA-AWEZNQCLSA-N	435.513	1.946	50	20	IDGD	
CSCC[C@H](C(=O)NNC(=O)CCOc1ccccc1)N1C(=O)[C@@H]2CCCC[C@H]2C1=O	747179400	SBIWTONOHQJMHU-KZNAEPCWSA-N	447.557	1.900	50	20	IDGD	
O=C(CCOc1ccccc1)NNC(=O)NCc1cccc(C(=O)NC[C@H]2CCCO2)c1	747304959	NBJNNNBRYYOAPX-HXUWFJFHSA-N	440.500	1.895	50	20	IDGD	
O=C(CCn1cnc2ccc(Br)cc2c1=O)NNC(=O)Cc1ccncc1	747324707	JGKUQKSTHXMERW-UHFFFAOYSA-N	430.262	1.334	50	20	IDGD	
COc1ccc(C(=O)NNc2nccn(C)c2=O)cc1S(=O)(=O)N1C[C@H](C)C[C@@H](C)C1	747945727	PGWXRIQCOWFBDP-ZIAGYGMSSA-N	449.533	1.212	50	20	IDGD	
O=C(NNc1nc(-c2ccccn2)nc2c1CCC2)[C@H]1CC(=O)N(Cc2ccccn2)C1	748341042	MCRUNZODMHNLGM-HNNXBMFYSA-N	429.484	1.914	50	20	IDGD	
C[C@]1(c2ccc(C(=O)NNC(=O)CSc3ccc(Cl)cc3)cc2)NC(=O)NC1=O	748516709	JOKPTFYWQQIHNX-LJQANCHMSA-N	432.889	1.948	50	20	IDGD	
O=C(Cn1nnc2ccccc2c1=O)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1	748521305	LSAIDZMKFUFKOH-UHFFFAOYSA-N	427.364	1.228	50	20	IDGD	
CC(C)CCn1nc(C(=O)NNS(=O)(=O)C[C@H]2CCCCO2)c2ccccc2c1=O	748790316	CIJYKQSXQLHJGD-OAHLLOKOSA-N	436.534	1.576	50	20	IDGD	
O=C(NC1CC1)c1cc(F)c(NNC(=O)[C@]2(O)CCN(Cc3ccccc3)C2)c(F)c1	748829775	VFKKCCXDZNVHIW-QFIPXVFZSA-N	430.455	1.937	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1C[C@@H](NC(C)=O)Cc2ccccc21	749549125	ATRZFCNHCRNWGS-INIZCTEOSA-N	430.892	1.677	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H](C)Cc2ccncc2)c1	749621775	SVCRTYGLIYIMHK-OAHLLOKOSA-N	433.534	1.687	50	20	IDGD	
C[C@H]1C[C@H](NC(=O)NNC(=O)CNC(=O)c2cccs2)CCN1Cc1ccccc1	751098316	GADRMQZQCFUBCG-DOTOQJQBSA-N	429.546	1.861	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)[C@@H]1CC(=O)N(CCOc2ccccc2Cl)C1	751988732	SRFLJXSLEFWVKR-QGZVFWFLSA-N	445.903	1.932	50	20	IDGD	
N#Cc1ccc(CN2CC[C@@H](NC(=O)NNC(=O)c3ccc4c(c3)OCCO4)C2=O)cc1	753290768	GWIKCXKCKVZWHK-QGZVFWFLSA-N	435.440	1.075	50	20	IDGD	
COC(=O)c1cc2c(cc1NC(=O)C(=O)NNc1ncc(Cl)cc1Cl)OCO2	753842612	UKJITRZMXUNXBP-UHFFFAOYSA-N	427.200	1.986	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)Nc2cccc(S(=O)(=O)NC3=NCCCCC3)c2)cn1	755493625	CCFIJBBAKUEHGP-UHFFFAOYSA-N	433.494	1.137	50	20	IDGD	
COC(=O)CCNC(=O)c1ccc(NC(=O)NNC(=O)[C@H](C)Oc2ccccc2F)cc1	755602615	GFFRJIAWQUNWKX-ZDUSSCGKSA-N	446.435	1.739	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)Nc2ccc(CC(=O)N3CCOCC3)cc2)cc1	755862548	SASKYEAVJMTTOB-UHFFFAOYSA-N	440.500	1.882	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)N[C@H]2CCN(c3ncccc3F)C2)nc1	756160414	PDVOIDKNOXDJQR-ZDUSSCGKSA-N	437.501	1.207	50	20	IDGD	
COCCS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2ccc(OC)c(OC)c2)cc1	756556975	YTVSQTPGUJQIBA-UHFFFAOYSA-N	437.474	1.590	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2cccs2)[nH]n1)Nc1cnn(CCN2CCOCC2)c1	756827325	RUCFAFJLZNBXRS-UHFFFAOYSA-N	430.494	1.133	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)N[C@@H]1CCN(C(=O)CCc2ccccc2)C1	757275428	OSCCDDXZHBGRHQ-OAHLLOKOSA-N	441.444	1.478	50	20	IDGD	
CCCn1nc(C(=O)NNS(=O)(=O)c2c(F)cc(C#N)cc2F)c2ccccc2c1=O	757647107	XGLDUFZOLQPCPX-UHFFFAOYSA-N	447.423	1.580	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)c1cccnc1I	757719936	QXCNSHAUCGVNFU-UHFFFAOYSA-N	449.208	1.652	50	20	IDGD	
CCn1nccc1NC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	757903146	OSGMHXRNFYLOAL-UHFFFAOYSA-N	442.501	1.848	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)c1cnn(CCO[C@H]2CCCCO2)c1C	758060939	PYAWWBLKFMMCEX-FQEVSTJZSA-N	432.477	1.583	50	20	IDGD	
CS(=O)(=O)N1CCc2c(NC(=O)NNC(=O)COc3ccccc3[N+](=O)[O-])cccc21	758296233	LCIUMBFTECQOLL-UHFFFAOYSA-N	449.445	1.149	50	20	IDGD	
C[C@@H](CC(=O)N1CCN(S(=O)(=O)CBr)CC1)NC(=O)C1CCCCC1	758527425	KGABQIPAKZUNGL-ZDUSSCGKSA-N	438.388	1.288	50	20	IDGD	
CC(C)(C)OC(=O)NC1(CNC(=O)NNC(=O)C(=O)Nc2ccccn2)CCCCC1	758736932	BOUJYKSJHIUOAI-UHFFFAOYSA-N	434.497	1.578	50	20	IDGD	
C[C@@H](Nc1ccc(C(=O)NNC(=O)C(=O)Nc2ccccn2)cc1[N+](=O)[O-])c1ccccn1	758833677	OMQSMVDKZLMKCZ-CYBMUJFWSA-N	449.427	1.958	50	20	IDGD	
N#CCc1ccc(C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)cc1	759605683	LMDAONWGERJZSQ-UHFFFAOYSA-N	425.920	1.985	50	20	IDGD	
CN(C)CCOc1cc(CNC(=O)NNC(=O)c2ccc(Br)s2)ccn1	762530597	ZJJNHIWIIXAEQX-UHFFFAOYSA-N	442.339	1.990	50	20	IDGD	
O=C(NNC(=O)c1ccccc1)C(=O)Nc1ccc2nc(N3CCOCC3)sc2c1	763426263	VLCSASRLFWINMM-UHFFFAOYSA-N	425.470	1.533	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)cc1[N+](=O)[O-]	763439254	KABWZUYXYGKUQI-UHFFFAOYSA-N	432.455	1.218	50	20	IDGD	
COC(=O)c1ccc(OC(C)C)c(NC(=O)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c1	763470933	AVOPFYYOQNVYMW-UHFFFAOYSA-N	444.400	1.568	50	20	IDGD	
C[C@H](CN1CCN(c2ccccn2)CC1)NC(=O)NNC(=O)CSc1ccccc1O	763511676	DDJZKIPDHPEDNQ-MRXNPFEDSA-N	444.561	1.420	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)N3CCOCC3)cc2C)c(C)o1	763577554	WYPIBGDSOYVTLQ-UHFFFAOYSA-N	428.445	1.077	50	20	IDGD	
Cn1ccnc1-c1csc(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)n1	763694367	GDXJPTCTAWQZMX-UHFFFAOYSA-N	434.865	1.362	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2ccc(N3CCCC3)c(F)c2)c1	763775182	MRWVTAPWLMYKOT-UHFFFAOYSA-N	430.436	1.843	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)cc1Cl	763839025	XMSVBZGHZBGJIV-UHFFFAOYSA-N	439.827	1.669	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(Cl)c(C(N)=O)c2)c1C	763851157	QYSNYUALHAMEFW-LBPRGKRZSA-N	432.864	1.609	50	20	IDGD	
COC(=O)c1[nH]c(C)cc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccc2ccccc2c1	763855382	VYXLQAOCKWSITG-ZDUSSCGKSA-N	438.440	1.816	50	20	IDGD	
COC(=O)Cc1ccccc1NC(=O)C(=O)NNC(=O)c1cc2c(s1)CC[C@H](C)C2	763942429	MWLLBLDHIQOWOB-LBPRGKRZSA-N	429.498	1.988	50	20	IDGD	
CC[C@@H](C)NS(=O)(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)c2ccccc2C)c1	763962966	WBQIBMNAAKJGSI-OAHLLOKOSA-N	446.529	1.613	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc[nH]2)cc1S(=O)(=O)N1CCCCCC1	763979154	IUGQVQRXTUIOOJ-UHFFFAOYSA-N	447.517	1.288	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ccc[nH]2)ccc1Cl	763980051	SOFCAMVPZBMFNT-UHFFFAOYSA-N	441.897	1.098	50	20	IDGD	
Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)C(=O)NNC(=O)C1CCCC1	764066163	IPMUFEKUYCJEKN-LJQANCHMSA-N	438.532	1.915	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(N3CCN(C(C)C)CC3)c2)c(O)c1	764110623	SASIKDWXFOMDKN-UHFFFAOYSA-N	439.516	1.631	50	20	IDGD	
CC(=O)Nc1cc(NC(=O)C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)ccc1C	764203743	BZBCPBRLLIAEDB-UHFFFAOYSA-N	435.481	1.344	50	20	IDGD	
CN(C)CC(=O)NNC(=O)C(=O)Nc1ccc(Oc2cccc(Br)c2)nc1	764204358	MMBZSFCHFRSVIT-UHFFFAOYSA-N	436.266	1.284	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)CCCc2ccccc2)cc1-n1nnnc1C	764224264	MSNFWJRTUZTOEH-UHFFFAOYSA-N	437.460	1.088	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)C(=O)Nc1ccc(F)cc1I	764354350	QXJVWTDEQFRXNO-UHFFFAOYSA-N	442.188	1.154	50	20	IDGD	
CN(C)C(=O)c1ccccc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	764387925	OGUDDGFZGOVNGS-UHFFFAOYSA-N	438.419	1.317	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1F)C(=O)Nc1ccccc1S(=O)(=O)C(F)F	764411239	UDQPMLMEWUAUBE-UHFFFAOYSA-N	449.794	1.875	50	20	IDGD	
O=C(CCC(=O)N1CCN(c2ccccc2)CC1)NNC(=O)COc1ccc(F)cc1	764552343	LYMGLTVICSLVKH-UHFFFAOYSA-N	428.464	1.481	50	20	IDGD	
O=C(NNC(=O)[C@@H](O)c1cc(Cl)cc(Cl)c1)c1csc(N2CCOCC2)n1	764604623	NCAYEYQRVOEWAU-ZDUSSCGKSA-N	431.301	1.781	50	20	IDGD	
Cc1nn(C)c(=O)c(C(=O)NNC(=O)[C@@H]2Cc3ccccc3CN2Cc2ccccc2)c1C	764938132	YHMGEPYJAXGEEK-NRFANRHFSA-N	445.523	1.785	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCCNC(=O)NNc2ccccc2S(C)(=O)=O)cc1	765646125	RYQPIJTUESOOEQ-UHFFFAOYSA-N	426.520	1.003	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cc(Br)c(C)nc2O)cc(OC)c1OC	765973513	IXOQCRSXXAAALD-UHFFFAOYSA-N	440.250	1.959	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)N[C@@H](c2ccc(Cl)cc2)[C@H]2CN(C)CCO2)n1	766320658	QOKXJMKQQOWGTO-MJGOQNOKSA-N	434.928	1.556	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cn(C)nc3-c3cccnc3)CC2)cc1	766647248	CDCATJPEVDLAGW-UHFFFAOYSA-N	447.543	1.369	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)[C@H]1CSCN1C(=O)CC(C)(C)C	767334968	PLLLBXZCNNBLCS-MRXNPFEDSA-N	435.546	1.566	50	20	IDGD	
CC(=O)Nc1ccccc1CC(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	768206471	LPUDKZKBFOAPPE-UHFFFAOYSA-N	433.509	1.823	50	20	IDGD	
CCOc1cc(/C=C\C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)ccc1O	768622629	GPCZEAZZWIMOKO-WMZJFQQLSA-N	429.385	1.717	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C1=NN(Cc2ccc(F)cc2)C(=O)CC1	768634021	AVSIGRUTAKKJEU-UHFFFAOYSA-N	448.476	1.860	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)c2cccc([C@@]3(C)NC(=O)NC3=O)c2)cc1OC	768928983	ACBXOVQJOYOEIL-JOCHJYFZSA-N	440.456	1.613	50	20	IDGD	
O=C(COC(=O)C1CCC(C(F)(F)F)CC1)NNC(=O)[C@@H]1COc2ccccc2O1	769439859	LWEYSORKSIKEDU-QOZQQMKHSA-N	430.379	1.886	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(N2CCOCC2)c(NC(=O)NNc2cnccn2)c1	769924731	FBCSANQEVFNUET-UHFFFAOYSA-N	449.537	1.492	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)[C@@H]2CCN(C(=O)OCc3ccccc3)C2)C[C@@H](C)O1	770110959	QEMVSLUCUUHZAO-ZIFCJYIRSA-N	432.521	1.292	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccnn1-c1cccc(F)c1	770775263	ZEYAEFDNFRNCMU-UHFFFAOYSA-N	441.419	1.575	50	20	IDGD	
CCCOc1cccc(CC(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)c1	771018727	YBERTKXWZCDRRC-UHFFFAOYSA-N	447.561	1.492	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)N[C@H]1CC(=O)N(c2c(F)cccc2F)C1	771436207	UWFVBHGHZXYFTR-ZDUSSCGKSA-N	448.426	1.878	50	20	IDGD	
Cc1cccc(S(=O)(=O)NNC(=O)CNC(=O)c2cccs2)c1Br	771902584	MTGFARUBJCUVNW-UHFFFAOYSA-N	432.321	1.559	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)[C@@H]1CSCN1C(=O)c1ccc(Cl)cc1	772095585	KPUJOKGTKDXELN-DOMZBBRYSA-N	441.937	1.980	50	20	IDGD	
CCCCNC(=O)NNC(=O)c1c[nH]c2ccc(I)cc2c1=O	772624731	MTJIYZGDFZPSCP-UHFFFAOYSA-N	428.230	1.877	50	20	IDGD	
CCCS(=O)(=O)N1CCCC[C@H]1C(=O)NNC(=O)[C@H](C)Oc1cccc(Cl)c1	772969647	OGWIMGXZADAPBZ-BBRMVZONSA-N	431.942	1.849	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)C(=O)Nc2ccnn2[C@@H]2CCN(Cc3ccccc3)C2)n1	773475494	XMQGEFHGWWHBQI-GOSISDBHSA-N	434.504	1.819	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNc2nccc(OC)n2)sc2c1CCSC2	773723842	HCSSUMDATZVFIX-UHFFFAOYSA-N	437.503	1.595	50	20	IDGD	
O=C(CN1CCOCC1)Nc1ccc(NC(=O)C(=O)NNc2cccc(Cl)c2)cc1	773745008	HKQKERZQRREQFP-UHFFFAOYSA-N	431.880	1.693	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccccc1C[S@@](C)=O	774003574	XRHLJNFJNDGCLP-XETJZTBLSA-N	437.905	1.772	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)NC[C@H]1CC[C@H](C(=O)N(C)C)O1	774664359	VKAFQMSINVTJAV-HUUCEWRRSA-N	431.518	1.698	50	20	IDGD	
CO[C@@H]1[C@@H](C)[C@@H](NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)C1(C)C	776067639	UBHBRMLJSRREAR-IAOVAPTHSA-N	438.550	1.475	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(OCC(=O)NNC(=O)COc2ccccc2F)CC1	777085100	BNMKJHIYHMVBMP-UHFFFAOYSA-N	425.457	1.768	50	20	IDGD	
Cc1cc2ccccc2nc1NNC(=O)[C@H](C)NS(=O)(=O)c1ccc(C(N)=O)cc1	777478961	PJEUELLLFIDIGK-ZDUSSCGKSA-N	427.486	1.452	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(OCC(F)(F)F)nc1)c1nnc(-c2ccccc2)o1	777922045	BBXDXJJWFXCANJ-UHFFFAOYSA-N	443.363	1.696	50	20	IDGD	
CC[C@H](C)C(=O)N1Cc2ccccc2C[C@H]1C(=O)NNC(=O)CNC(=O)OC(C)(C)C	778441023	HMTKQQYAHLQHDM-YOEHRIQHSA-N	432.521	1.658	50	20	IDGD	
CC(C)(C)OC(=O)NCc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(C#N)cc2)cc1	778712913	LYXCHIYZHBXZSS-UHFFFAOYSA-N	437.456	1.983	50	20	IDGD	
CC(C)(C)OC(=O)N1CC=C(CNC(=O)NNC(=O)c2ccc3c(c2)OCCO3)CC1	779680061	JCAXYILOFRFDML-UHFFFAOYSA-N	432.477	1.969	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3noc4c3CCCCC4)cc2)CC1	780950804	NIJZORODKLEHMS-UHFFFAOYSA-N	433.534	1.637	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)N[C@@H]1CCCN(C(=O)OC(C)(C)C)CC1	781020797	LUYJGDOIORWBAJ-CYBMUJFWSA-N	429.518	1.631	50	20	IDGD	
O=C(NNc1ncncc1Cl)[C@@H]1CCCN1S(=O)(=O)c1cccc([N+](=O)[O-])c1	781830216	RBIKZZOANBKUPL-ZDUSSCGKSA-N	426.842	1.335	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)cc1)C(=O)Nc1ccc(OCc2noc(C3CC3)n2)cc1	782830869	NEAMTTSSOCSZNG-UHFFFAOYSA-N	437.412	1.631	50	20	IDGD	
Cc1ccccc1NC(=O)NNC(=O)C(=O)Nc1ccc(CN2C(=O)CCCC2=O)cc1	783410691	GLBAYQQUPITWFX-UHFFFAOYSA-N	437.456	1.826	50	20	IDGD	
NC(=O)C1CCN(Cc2cccc(NC(=O)C(=O)NNc3cccc([N+](=O)[O-])c3)c2)CC1	784831428	MGRIERLDKNEXEU-UHFFFAOYSA-N	440.460	1.374	50	20	IDGD	
CCOC(=O)[C@@](C)(CNC(=O)NNC(=O)CNC(=O)c1cccs1)c1ccccc1	787263466	VTLMHSBQCDNHFI-FQEVSTJZSA-N	432.502	1.329	50	20	IDGD	
CN1CCN(c2ccc(NC(=O)C(=O)NNC(=O)CC3CC3)cc2Br)CC1	787889803	SBWUXGWLPFPWLY-UHFFFAOYSA-N	438.326	1.087	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=S)NCCc3ccc(F)cc3)CC2)cc1	789274032	ONBSUFVPWYIZDZ-UHFFFAOYSA-N	443.592	1.990	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)c1ccn(CC(F)F)n1	789989307	AGVGUDQBOXWWLX-UHFFFAOYSA-N	440.882	1.380	50	20	IDGD	
O=C(NNc1cccc(F)c1[N+](=O)[O-])C(=O)Nc1ccccc1C(=O)N1CCOCC1	790994160	ROVPVOVOEPNVCA-UHFFFAOYSA-N	431.380	1.288	50	20	IDGD	
COCCCNC(=O)NNS(=O)(=O)c1ccc(C)c(I)c1	793380310	GHZVKVFQCGYINL-UHFFFAOYSA-N	427.264	1.129	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNS(=O)(=O)c2ccc(S(C)(=O)=O)nc2)cc1	794575911	BUDYIKPNIIDMDP-UHFFFAOYSA-N	441.531	1.533	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)COc1cccc(N2CCCC2=O)c1	795168970	HHTXCCVPNYQCOM-UHFFFAOYSA-N	432.502	1.586	50	20	IDGD	
CCn1nnnc1-c1cccc(NC(=O)NNC(=O)CNC(=O)OCc2ccccc2)c1	797628740	ULHAZYZCYBHHIG-UHFFFAOYSA-N	438.448	1.439	50	20	IDGD	
O=C(NNc1cc([N+](=O)[O-])ccc1Br)C1=CN2CCS(=O)(=O)N=C2C=C1	800617222	AOGMLVYFJAAYOH-UHFFFAOYSA-N	442.251	1.298	50	20	IDGD	
C[C@@H](CCNS(=O)(=O)c1ccccc1)NC(=O)NNC(=O)Cn1ccc2ccccc21	801749728	RBKWGQLVLIEIOA-INIZCTEOSA-N	443.529	1.729	50	20	IDGD	
O=C(CCCNS(=O)(=O)c1ccc2c(c1)OCCO2)NNc1nccnc1C1CCC1	805464322	HKTQFWOCBSXPDJ-UHFFFAOYSA-N	447.517	1.717	50	20	IDGD	
COC(=O)c1cc(C)c(NC(=O)C(=O)NNC(=O)COc2ccccc2O)c(Cl)c1	806978848	LXHQEGAJLHHIJA-UHFFFAOYSA-N	435.820	1.306	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NCc1ccncc1OC[C@H]1CCOC1	807614841	ADDDEONDZPJZFT-CABCVRRESA-N	432.452	1.934	50	20	IDGD	
CCc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NNC(=O)c1cc(Br)cn1C	810385018	URYJULCJBUELSX-UHFFFAOYSA-N	438.238	1.658	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cc(C)n(C3CCCCC3)n2)cc1	810385317	RIADWBPRANTJBB-UHFFFAOYSA-N	429.477	1.870	50	20	IDGD	
CCc1cc(NNC(=O)CNS(=O)(=O)c2ccc(C#N)cc2)nc(-c2ccccn2)n1	810385619	WSCWZAIKDWKMCA-UHFFFAOYSA-N	437.485	1.394	50	20	IDGD	
CCOC(=O)c1ccc(NNC(=O)CNS(=O)(=O)c2cccc(C(C)=O)c2)cc1C	812720818	PSOPXIFOJIRYJS-UHFFFAOYSA-N	433.486	1.796	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)nn1-c1ccccc1	813033260	LIHHZOFHEVRCLI-UHFFFAOYSA-N	442.501	1.513	50	20	IDGD	
COC(=O)N1CCN(c2ccc(NC(=O)C(=O)NNc3cc(C)ccc3F)cn2)CC1	815602989	PSHFILSACZJDDR-UHFFFAOYSA-N	430.440	1.499	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)/C(=C\c2ccc(F)cc2)n2nnnc2C)c1	818025568	ZVNRMRQXVUFWEM-QGMBQPNBSA-N	426.408	1.597	50	20	IDGD	
CC[C@H](C)NS(=O)(=O)c1ccc(C(=O)NNC(=O)CNc2ccc(OC)cc2)cc1	825550122	YNPGPGSKIVLVNI-AWEZNQCLSA-N	434.518	1.645	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCCN(C(=O)c3cccc(F)c3)CC2)n1	913204046	XEDGTRMIUIYHHG-UHFFFAOYSA-N	433.509	1.129	50	20	IDGD	
COC(=O)c1ccc(Cl)c(S(=O)(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)c1	914563243	UYUKLNYKUHVXEU-UHFFFAOYSA-N	439.877	1.692	50	20	IDGD	
CN1CCN([C@@H](CNC(=O)NNC(=O)COc2ccc(C#N)cc2)c2cccs2)CC1	915900981	ASRAVXJIGYELBJ-SFHVURJKSA-N	442.545	1.318	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCc2ccc(Cn3cccn3)cc2)c2ccccc2c1=O	916223011	UXMBGFVGQJZANQ-UHFFFAOYSA-N	445.483	1.805	50	20	IDGD	
Cc1nc2scc(C)n2c1C=NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	916258535	DIBIEDPSNUOXIL-UHFFFAOYSA-N	447.542	1.797	50	20	IDGD	
CNS(=O)(=O)c1cccc(CNC(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)c1	916485611	CPWOGOQFQIAIEM-OAHLLOKOSA-N	434.518	1.509	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)NC[C@H](c1ccccc1)N1CCOCC1	916509416	OBYTYFRRQAIDMI-VQIMIIECSA-N	430.480	1.997	50	20	IDGD	
CCCn1nc(C(=O)NNS(=O)(=O)c2ccc3nc(O)[nH]c3c2)c2ccccc2c1=O	916646315	HXIWOQDAWJPIFC-UHFFFAOYSA-N	442.457	1.012	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1F)c1cccc(S(=O)(=O)N2CCCC2)c1	917392268	VPWRWYLPECUFIS-UHFFFAOYSA-N	436.421	1.593	50	20	IDGD	
CC(C)n1nc(C(=O)NNS(=O)(=O)c2ccc3c(c2)C(=O)OC3)c2ccccc2c1=O	917722523	XHZRJYWNVCLETL-UHFFFAOYSA-N	442.453	1.271	50	20	IDGD	
Cc1ccc([C@H](CNC(=O)NNC(=O)COc2ccccc2C#N)N2CCOCC2)cc1	918099216	MQUOAEVABFWLLP-FQEVSTJZSA-N	437.500	1.649	50	20	IDGD	
O=C(CCC(=O)c1ccc(-c2ccccc2)cc1)NNC(=O)N[C@H]1CCS(=O)(=O)C1	919885714	QUXFOPSNSQMCPM-SFHVURJKSA-N	429.498	1.834	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H]2CCCN2C(=O)Cc2ccccc2)c1	920220793	ZJFJWYVNQHDUQX-GOSISDBHSA-N	429.498	1.085	50	20	IDGD	
Cc1cc(CNC(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)no1	920235314	NNOQTRIWTBEWCG-UHFFFAOYSA-N	435.487	1.990	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)c1cccc(N2CCCC2=O)c1	920979832	YEFBDEJMNIMDEI-CQSZACIVSA-N	434.460	1.494	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCC[C@@H]1CN1C[C@H](C)O[C@H](C)C1	921192854	COJONGHEEUVDHL-HLLBOEOZSA-N	438.956	1.683	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H](C)NC(=O)OC(C)(C)C)c1	921298610	DIDFMWIKWGUKDC-CYBMUJFWSA-N	442.538	1.391	50	20	IDGD	
C[C@@H]1CCCN(C(=O)CCNC(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)C1	1263757889	IRPUAAQWIRDAOY-OAHLLOKOSA-N	439.557	1.613	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)c2n[nH]c3c2CCCC3)cc1N1CCCS1(=O)=O	1320130185	JMCJWRYHBPQVHX-UHFFFAOYSA-N	432.506	1.603	50	20	IDGD	
CC/C=C(\C)C(=O)N1CSC[C@@H]1C(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	1322746268	JWMAZYSCDFUYDY-FDYAIDJWSA-N	440.547	1.501	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](C)N3C[C@H]4C[C@H]4C3)C2)C1	1778867011	YNVIIWQAGINHPQ-NAHJCDBISA-N	428.371	1.330	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C=C\C(=O)NC2CC2)C1	1779225040	IKMNSABAFHJJDA-RXPVHBRLSA-N	425.957	1.600	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)COc3cc(Cl)ccn3)C2)C1	1779231722	FFLRNZRNZBOLIG-RDTXWAMCSA-N	432.304	1.198	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2)c1cc(F)cnc1Cl	1779639026	AKATUQOYTNEXLG-PMUMKWKESA-N	434.295	1.601	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(C1)CN(C(=O)C1CCC1)CCO2	1780097015	NBWUXNRKNXIKBK-OAQYLSRUSA-N	431.445	1.764	50	20	IDGD	
Cc1ncncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Br)C1	1780773341	ANABLCJJYJVJEU-CKEIUWERSA-N	429.290	1.603	50	20	IDGD	
C[C@@H](Cn1ccnc1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Br)C1	1780776645	CATWPYVXCAJTEC-LUXYFRNMSA-N	445.333	1.724	50	20	IDGD	
O=C(Cc1cnc2ccccn12)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781325646	PFZZMGWVKWSWPA-AEFFLSMTSA-N	439.285	1.397	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](F)Br)C3)C2)cc1OC	1781332904	CHUUXCSTLXPUPH-YJBOKZPZSA-N	445.285	1.838	50	20	IDGD	
O=C(c1ccc([N+](=O)[O-])cc1F)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1781554069	OXSMPDIEGXFTIN-CZUORRHYSA-N	448.220	1.868	50	20	IDGD	
C[C@@H](CC(=O)N1CC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1)c1ccccc1	1783287421	VNGDAEJELJJXKL-MBSDFSHPSA-N	430.549	1.383	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](O)Cc3ccccc3)C2)C1	1783342057	ZVBWCBGYQVYZBA-VDGAXYAQSA-N	429.344	1.656	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cncc4cnccc34)CCO2)C1	1783535629	AXGGHUZXZIOOEB-ORAYPTAESA-N	433.306	1.857	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)CN3CCc4sccc4C3)CCO2)C1	1783874193	ZQWCSNODDIDWOB-OXQOHEQNSA-N	441.981	1.190	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)COCc3ccc(OC)cc3)CCO2)C1	1783879434	SVQDFBISDDHEAK-WIYYLYMNSA-N	440.924	1.296	50	20	IDGD	
COc1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)C(Cl)Cl)C3)C2)c([N+](=O)[O-])cc1O	1783948350	LJNXWNMMCWSUMN-QGZVFWFLSA-N	448.259	1.556	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)n3cccn3)C[C@@H]21	1783974433	NUZJXDFTKDBROY-OWYFMNJBSA-N	427.343	1.455	50	20	IDGD	
COC(=O)[C@@H]1CC[C@@H](C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)C(C)(C)CCl)C[C@@H]32)C1	1784075610	JFJDCPVLOAPOQG-NRKLIOEPSA-N	428.957	1.820	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccnc(Br)c3)C[C@@H]21)[C@@H](O)CCl	1784091564	XLELKNVVRSTKPN-XUXIUFHCSA-N	446.729	1.037	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H]3CCOC3)C2)C1	1784722130	IQQLGBOXXMFYAW-QVKFZJNVSA-N	447.444	1.000	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCn3c(=O)oc4ccccc43)C[C@@H]21)[C@H](F)Cl	1787443768	CJVLDXGWBLRHTE-YFPWBOGZSA-N	439.871	1.499	50	20	IDGD	
Cc1nc2cccc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)[C@@H](O)CCl)C[C@@H]43)c2s1	1787869395	ZKABVMIDXSPBIY-CSFVBSKPSA-N	437.949	1.798	50	20	IDGD	
Cc1noc(N)c1C(=O)Nc1ccc(C2(NC(=O)CCC(=O)NN(C)C)CCC2)cc1	1788013974	RFOBDSZSSBRBMF-UHFFFAOYSA-N	428.493	1.686	50	20	IDGD	
Cc1n[nH]c(C)c1CC(=O)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1	1788144262	BJVWRCXDAXQMDP-UHFFFAOYSA-N	446.316	1.697	50	20	IDGD	
CC[S@@](=O)CCC(=O)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1	1788145580	FCOWBWQENKNEPV-WJOKGBTCSA-N	442.346	1.273	50	20	IDGD	
COc1cnc(C(=O)NC2(c3ccc(NC(=O)c4cccc(B(O)O)c4)cc3)CCC2)cn1	1788145996	PEMKWHHPRFSNQD-UHFFFAOYSA-N	446.272	1.227	50	20	IDGD	
C=C[C@@H](O)C(C)(C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)CBr)C[C@@H]21	1788570271	PRJXMRDJZRVWLW-UVPYHEFZSA-N	431.371	1.570	50	20	IDGD	
CC(C)c1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]3C2)n[nH]1	1789924729	TVTOJJANTUKIEG-GVARAGBVSA-N	431.306	1.817	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnn4c3OCCC4)[C@H]2C1	1790372043	QVNRYBVWPOKPIS-XIRDDKMYSA-N	436.585	1.110	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(C4CC4)on3)C[C@@H]21	1791054470	IUDVXQQMDFLBPH-SDPXSBNPSA-N	426.311	1.929	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)COc3ccccc3F)C[C@@H]21	1791063421	IGOBPOQLZODVJN-WSMBLCCSSA-N	443.313	1.968	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3cccnc3OC)C[C@@H]21	1791252220	DTOXCPKLSDVUBE-XSLAGTTESA-N	439.940	1.256	50	20	IDGD	
CC(C)(C)OC(=O)NC1(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C(C)(C)CCl)CC1	1792786839	YODKNNKDYPQEKH-QDMKHBRRSA-N	443.972	1.898	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccnc1S)C2	1792866793	JDHXGDUMRKDGEW-NRWUCQMLSA-N	428.352	1.605	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccccc1F)C2	1792867604	GZVXESPPKONYLK-FRQROOTJSA-N	427.314	1.989	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cn(C)nc1C(F)F)C2	1792867973	MFJKMIHSYGPOAB-HNCHTBHHSA-N	449.296	1.592	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cnc2ccccn12	1792930451	AJMDQSCNHSFLNG-ZTENYAIWSA-N	449.349	1.497	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(=O)c1ccc(Cl)cc1	1792948821	ZOPMXBWMAVWKML-OCVGTWLNSA-N	429.300	1.366	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(OC(F)(F)F)cc1)C2)[C@H](O)CCl	1792980971	XQQNNRXZVIVEGN-AYRXBEOTSA-N	436.814	1.388	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1scnc1C1CC1)c1ccc(B(O)O)cc1	1794843918	FYUAHZZDXQKXPD-BJWYYQGGSA-N	425.319	1.266	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1Cc2ccccc2CN1	1796326769	XXPPOOMQSMQIPN-RPCVNMKUSA-N	436.350	1.074	50	20	IDGD	
C[Si](C)(C)C#CCCCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc(B(O)O)c1)C2	1798417447	IRKAIFIJDYDSAI-WKCHPHFGSA-N	440.425	1.669	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1nc3ccccc3o1)C2	1798443133	VMYKXDFZZDSKPV-BTTYYORXSA-N	434.456	1.392	50	20	IDGD	
Cc1ccc(=O)n(C(C)(C)C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](C)Br)C3)n1	1798587539	TWIUQDUOBZBWCY-APIJFGDWSA-N	439.354	1.708	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CCc3ccccc3O1)C2)[C@@H](F)Br	1799352400	UPTLVQFQIMHWFG-QMPXSYISSA-N	441.297	1.660	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1cc(F)c(F)cc1F	1799515132	QWKVUGFUGWJBDN-QYOFDKIESA-N	439.203	1.998	50	20	IDGD	
CC(=O)N[C@@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](O)CCl)C2)c1cccc(Cl)c1	1799836519	OZMNEKRSPVKQJQ-FLXSYLCISA-N	442.343	1.755	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ncon1)C2	1800333286	CIJGKRMNZOLJCJ-UJLMUCCTSA-N	429.383	1.158	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnn(C(C)(C)C)c1)C2	1800757261	CATYZUYRKHPZHF-MHEUCROKSA-N	427.343	1.625	50	20	IDGD	
C[C@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCC(=O)NN(C)C)N1CSCSC1	1802337206	JTMPECKUQGIBJC-LVQVYYBASA-N	443.639	1.041	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1coc([Si](C)(C)C)c1)C2	1802337506	MZVOGLOTHZSTRS-BJWYYQGGSA-N	434.613	1.450	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1[C@H]2COC[C@H]21	1803391682	LZGZAOZVDZPAOZ-DKGRAKJVSA-N	441.956	1.649	50	20	IDGD	
Cc1ccc(F)cc1C(=O)N1CCCC2(CCN(C(=O)c3cccc(B(O)O)c3)CC2)C1	1805056930	DXQCAAWDSNLGSP-UHFFFAOYSA-N	438.308	1.973	50	20	IDGD	
CN1CCCn2nc(C(=O)N3CC[C@H](CNC(=O)[C@@H](F)Cl)[C@H]3c3cccnc3)cc2C1	1808322953	ZIVAQLDZFXJHDA-ATZDWAIDSA-N	448.930	1.968	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC2(CCCN(C(=O)c3[nH]nc4ncccc34)C2)CC1	1810670433	MVCGBJBSGCWXBX-UHFFFAOYSA-N	441.536	1.176	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2ccnc3c2OCO3)[C@@H]1c1cccnc1	1811316060	QJCMLZGRMWQRQM-PVAVHDDUSA-N	446.891	1.779	50	20	IDGD	
CC[C@@H](NC(C)=O)C(=O)N1CC[C@H](CNC(=O)[C@@H](C)Br)[C@H]1c1cccnc1	1812864546	WBLWXELPJCVNQA-BASLNEPJSA-N	439.354	1.786	50	20	IDGD	
COC(=O)CCCCCC(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1	1813137740	GGDXGTNFAQFQME-QKLQHJQFSA-N	439.940	1.811	50	20	IDGD	
C[C@H](Cc1ccccn1)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1	1813287804	XFWSYKOJRWKVQE-DJABAAGCSA-N	430.936	1.961	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(-n3cnnc3)cc2)[nH]n1)[C@@H](O)CCl	1814869837	CVZOSWGUYRGFHG-IRXDYDNUSA-N	443.895	1.896	50	20	IDGD	
N=C(N)SCCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](F)Br)CC2	1814950616	FBNFUBULHZWNRH-WKEGUHRASA-N	438.348	1.762	50	20	IDGD	
C[C@H](C(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1)c1ccccc1	1815347750	NIAUMAASHMIPMI-KSSFIOAISA-N	449.341	1.852	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ncc(Cl)cn2)n[nH]1	1816280046	HWJISGCHTCEQTJ-CQSZACIVSA-N	448.915	1.532	50	20	IDGD	
Cc1c(C(=O)N[C@@H]2CCc3nc(NC(=O)[C@H](F)Cl)sc3C2)cn2[nH]cnc(=O)c12	1817125327	LCPJVYJMXZWULC-OQPBUACISA-N	438.872	1.548	50	20	IDGD	
Cc1cc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)CCC(=O)NN(C)C)CC3)cc(O)n1	1817157920	LUGNFWYXWLZTHL-CYBMUJFWSA-N	446.533	1.151	50	20	IDGD	
Cc1cccnc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1	1817470213	LVXSZMZLOBAOOZ-SFHVURJKSA-N	433.277	1.413	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccccc2O)[nH]n1)c1ccc(B(O)O)cc1	1817470793	HJSBGUOMBUITOT-GOSISDBHSA-N	434.261	1.415	50	20	IDGD	
C[C@@]1(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)CC1(F)F	1817474943	IAVAKKCHCFWNRK-BEFAXECRSA-N	432.236	1.441	50	20	IDGD	
CCN(CC)C[C@@H](C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1	1821680136	OEGIXWLFKIPROW-SJLPKXTDSA-N	449.600	1.753	50	20	IDGD	
Cc1ccn(C)c1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCC(=O)NN(C)C)CC2	1821735728	SIUJRMZJTCCULV-ZDUSSCGKSA-N	432.550	1.389	50	20	IDGD	
O=C(NCCC(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H](O)CCl)CC1)c1ccc[nH]1	1824180690	LUVFEXVYRXUMJK-MSOLQXFVSA-N	438.956	1.354	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CSCC(=O)OC)CC1	1824518135	YUAUGSTVICPFEE-HOTGVXAUSA-N	434.986	1.766	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2nc(C)c(C)[nH]c2=O)CC1	1825448516	JMAGCAWLWCHDOO-DLBZAZTESA-N	438.956	1.874	50	20	IDGD	
O=C(c1n[nH]c2c1CS(=O)(=O)C2)N1CCC([C@@H]2CCCCN2C(=O)[C@H](F)Cl)CC1	1827607581	IEDRUUBMXCKZSF-HOCLYGCPSA-N	446.932	1.606	50	20	IDGD	
CC(=O)OC[C@H](OC(C)=O)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](F)Cl)CC1	1827609618	VTLPSJHCYHYONZ-YESZJQIVSA-N	434.892	1.635	50	20	IDGD	
CC(=O)C(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)[C@H](F)Cl)C2)C1	1828792142	MLBVFPXEERKBSM-OXJNMPFZSA-N	439.871	1.562	50	20	IDGD	
O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CCC(F)(F)C1)CCO2	1829645629	DURAWQWQXLDPAD-CJNGLKHVSA-N	439.297	1.663	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)C[C@@H]2NC(=O)NC2=O)CC1	1830314246	UTLGARPPMCBUMM-NJSLBKSFSA-N	447.363	1.441	50	20	IDGD	
Cc1ccn(C)c1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)CBr)CCO2	1830542764	DPNKNMVPKZHYIQ-DNVCBOLYSA-N	442.354	1.435	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccncc3)C2)C1	1830543403	RAVRTSBSUIPFLF-DNVCBOLYSA-N	440.338	1.112	50	20	IDGD	
CN1CCCC[C@H]1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1	1830773029	OTYCXUOYVHFNDX-SNRMKQJTSA-N	436.380	1.163	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)CBr)C2)C1	1831639343	QOHVKBFMBKLKAL-ZQIUZPCESA-N	439.778	1.881	50	20	IDGD	
Cc1cccnc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)CBr)C2)C1	1831820602	BWEABKHAGCHKRE-DNVCBOLYSA-N	440.338	1.491	50	20	IDGD	
C[C@H](Cn1ccnc1)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1	1831876948	NTBQOGSXDHNEKL-QUCCMNQESA-N	446.596	1.512	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3ccc(F)nc3)CCO2)C1	1832837738	QNFJSIMLFUOIQO-JXFKEZNVSA-N	427.904	1.627	50	20	IDGD	
Cc1ccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)CCBr)C3)C2)cn1	1833130419	YKTKQDUYLKVEHE-IBGZPJMESA-N	440.338	1.174	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3c(F)ccnc3Cl)CCO2)C1	1833252917	AOSMUJKGMBTUOC-XIKOKIGWSA-N	434.295	1.962	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cccc4ccnn34)CC2)CC1)[C@@H](O)CCl	1833312032	IXTGEWJNCQVOEW-IBGZPJMESA-N	433.940	1.119	50	20	IDGD	
C[C@H](Oc1ccccn1)C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)CCl)CC2)CC1	1833312859	JAWPMCPSDYXNET-MAUKXSAKSA-N	438.956	1.020	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3c(C)nn(C)c3C)CC2)CC1	1833573177	BVPVTQNUYIKERW-SFHVURJKSA-N	439.988	1.476	50	20	IDGD	
Cc1nnc(CCC(=O)N2CCC(N3CCC(NC(=O)[C@@H](F)Cl)CC3)CC2)s1	1835078497	JFUABCPYNGQMRO-QGZVFWFLSA-N	431.965	1.885	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H]3CC(c4ccccc4)=NN3)CC2)CC1)[C@H](F)Cl	1835081710	ZWGCSPRHJKPCGH-PMACEKPBSA-N	449.958	1.859	50	20	IDGD	
COc1nccc(C(=O)N2CCO[C@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)c1F	1836232763	CQAHHICGYSLEDS-HXUWFJFHSA-N	443.903	1.564	50	20	IDGD	
C[C@H](C(=O)N1CCC(N2CCC(NC(=O)[C@H](F)Br)CC2)CC1)n1ccnn1	1836413509	GDQFWYYBSTZTSP-DOMZBBRYSA-N	445.337	1.101	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3noc4c3CCCC4)CCO2)C1	1836429527	HJERBPHQKLLMKZ-MGPUTAFESA-N	425.913	1.641	50	20	IDGD	
O=C([C@H](O)CCl)N1CCC(OC2CCN(C(=O)C3(Br)CC3)CC2)CC1	1836717390	DGKJRFMNRPNKRK-CQSZACIVSA-N	437.762	1.512	50	20	IDGD	
C[C@H](Cn1ccnc1)C(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836720015	GURBXYZPDFPLRV-CRAIPNDOSA-N	426.945	1.118	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@H]3CCCCN3C)CC2)CC1	1836725452	CIZJCIJZYUSCIJ-RTBURBONSA-N	429.989	1.723	50	20	IDGD	
Cc1[nH]ccc1C(=O)N1CCC(OC2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1	1838154488	LVYXLCGADHXGCX-UHFFFAOYSA-N	433.553	1.308	50	20	IDGD	
COc1cc(OC)c(F)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)c1	1838552365	CHNGRRTUCVIYNM-LPHOPBHVSA-N	448.850	1.447	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)c3cc(CO)on3)CC2)CC1	1838558096	DSGIJDABMVESHU-GFCCVEGCSA-N	444.326	1.563	50	20	IDGD	
Cc1ccn(C)c1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1	1838821168	ARWUPFCCULDVLF-RBUKOAKNSA-N	432.348	1.640	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnn(-c4cccnc4)c3)C2)C1	1839143095	LEVNMALOTCXUPX-NQIIRXRSSA-N	447.923	1.355	50	20	IDGD	
C=CCOCCCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2	1839150482	NTXKYFLIDMCQHB-RBUKOAKNSA-N	437.364	1.662	50	20	IDGD	
COc1cccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)c1	1839201525	ABMYUBDJILCEMP-YJBOKZPZSA-N	445.285	1.456	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)cc(C)c1C(=O)O	1839480400	GCHJRQCVCIZEDI-OXJNMPFZSA-N	442.871	1.606	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(C)cn3)C2)C1	1839963504	MNTOKSNISSXZLH-DNVCBOLYSA-N	440.338	1.634	50	20	IDGD	
Cc1nc(F)ccc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2	1840034484	NHTURJDJBQOAOI-KZULUSFZSA-N	444.301	1.383	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(F)c3F)C2)C1	1840034570	PRYKNDOLOKUYHG-XIKOKIGWSA-N	447.276	1.818	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(F)c3)C2)C1	1840034752	WOOYFAVYARPWKN-FZKQIMNGSA-N	429.286	1.679	50	20	IDGD	
C/C(=C\c1cccnc1)C(=O)N1CCO[C@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1	1840413652	RBKUXHPRZQSBRT-JMOSNPTESA-N	447.608	1.793	50	20	IDGD	
CC(C)C1(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)CCC1	1840613396	XMIGFPQWIZMMCS-YOEHRIQHSA-N	435.334	1.960	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)Cc1ccc(F)cc1Cl)C2	1844263406	ARHPMQHYXSVLCY-UHFFFAOYSA-N	445.882	1.537	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)c2cc(O)no2)C1	1844516779	XWNPEGZFQJSLTL-UHFFFAOYSA-N	430.373	1.345	50	20	IDGD	
Cc1nocc1C(=O)N1CC2(CCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)C1	1845038609	YSTYTVVXIONTJS-UHFFFAOYSA-N	440.504	1.146	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@]1(NC(=O)OC(C)(C)C)CCOC1)C2	1846364047	USCACJSZSWGCQA-JLTOFOAXSA-N	445.944	1.127	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](C)C1(O)CCC1	1847255508	FCQDXRPJBLCOCI-KKXDTOCCSA-N	445.472	1.887	50	20	IDGD	
COc1ccccc1C(=O)N1CC(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)C(Cl)Cl)C1	1847456604	CJSPEKZQYVIKHB-GJZGRUSLSA-N	440.327	1.773	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2cnn(Cc3ccccc3)c2)ccc1Cl	14895668	AZIYJFUYKKVGQT-UHFFFAOYSA-N	433.877	1.307	50	20	IDGD	
O=C(NNC(=O)c1c[nH]c2ccccc12)c1cccc(S(=O)(=O)NC[C@@H]2CCCO2)c1	21901187	LXSJIRAJTHPXLJ-HNNXBMFYSA-N	442.497	1.700	50	20	IDGD	
CSC[C@@H](C(=O)NNc1nc(-c2ccncc2)no1)N1C(=O)[C@H]2CCCC[C@H]2C1=O	728073321	FLYNFVNKRCDHPR-MJBXVCDLSA-N	430.490	1.482	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)c1ccc(=O)n(-c2ccc(F)cc2)n1	728209620	JIQRIHIOAWTPBE-UHFFFAOYSA-N	443.460	1.569	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2cc(Br)cnc2Cl)n1	728733217	JALNCGKQJMFGDJ-UHFFFAOYSA-N	447.698	1.809	50	20	IDGD	
C[C@@H](C(=O)NC1CC1)N1CCN(C(=O)NNC(=O)c2ccc(Br)s2)CC1	728942038	IILWGMQMXNBADC-JTQLQIEISA-N	444.355	1.150	50	20	IDGD	
CC(=O)N1C[C@H](C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)Oc2ccccc21	728974137	GGQXFUYMXJVFDM-MRXNPFEDSA-N	425.413	1.940	50	20	IDGD	
O=C(CCc1ccccc1)NNC(=O)NCCCCN1CCN(c2ncccn2)CC1	729232709	JTCLMXYDOTUIIS-UHFFFAOYSA-N	425.537	1.342	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CCc2ccccc2O)ccc1OCC(=O)NC(C)C	730032852	JNJPBNJVYDPHPJ-UHFFFAOYSA-N	429.473	1.698	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)[C@@H]2CCN(c3ccc4c(c3)OCCO4)C2=O)cc1	730515157	QCMCYPXTEYVETH-KRWDZBQOSA-N	425.441	1.346	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)c1nccnc1C(=O)NCc1ccc(F)cc1	730779842	KSHVSXOVRSMXNU-UHFFFAOYSA-N	439.403	1.091	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccccc2)C1	732301945	ORDWAGCZGWVINY-OAHLLOKOSA-N	437.543	1.634	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)N[C@@H](Cc1ccccc1)CN1CCOCC1	732476311	DFTOSNFHQHAHSP-PXNSSMCTSA-N	444.507	1.867	50	20	IDGD	
CCc1cc(N2CCC[C@@H](NC(=O)NNC(=O)COc3ccccc3OC)C2)ncn1	732913858	DDQRCVVNIIMGJG-MRXNPFEDSA-N	428.493	1.426	50	20	IDGD	
O=C(CN1C(=O)c2ccccc2S1(=O)=O)NNc1nc(-c2ccc(Cl)cc2)no1	732977713	WGRDXRNMHHUAIX-UHFFFAOYSA-N	433.833	1.678	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)NCC2CCN(S(=O)(=O)C(F)F)CC2)cc1	733041317	BWFCAZDLFOIKNC-UHFFFAOYSA-N	448.492	1.223	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)NCc2ccnc(OC3CCOCC3)c2)nc2ccccc21	733654831	WNBPUEUHAZTJCH-UHFFFAOYSA-N	438.488	1.599	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)Cc1c(C)nc2c(c(O)nn2C)c1C	733775004	WEXIVGDVHICKDJ-UHFFFAOYSA-N	435.488	1.593	50	20	IDGD	
Cc1c(C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)oc2c1C(=O)CCC2	735118260	PACLYJKNTFNXAJ-UHFFFAOYSA-N	447.517	1.195	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)N[C@@H]2CCN(c3ccc(Cl)cc3)C2=O)cc1	740484520	XEABFFUCRCLQHD-QGZVFWFLSA-N	427.848	1.726	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2cccc(C(=O)NNS(=O)(=O)N(C)C)c2)c(C)c1	742026121	YPQUQSGCQXKQMI-UHFFFAOYSA-N	426.520	1.145	50	20	IDGD	
Cc1nn(C)c2sc(C(=O)N[C@@H](C)C(=O)NNC(=O)[C@H](C)Oc3ccc(F)cc3)cc12	742036129	FNZUVSADRXBEAT-RYUDHWBXSA-N	447.492	1.816	50	20	IDGD	
COc1cc(C=NNC(=O)Cc2cc(O)nc(O)n2)ccc1OCc1c(C)noc1C	743445932	JXWRGMQOOQXQAQ-UHFFFAOYSA-N	427.417	1.773	50	20	IDGD	
COC(=O)c1cn(CC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)c2ccccc12	743830470	FQERNYYMTQLLFA-UHFFFAOYSA-N	444.469	1.684	50	20	IDGD	
C[C@@H]1CN(CC(=O)NNC(=O)c2ccccc2)CCN1C(=O)Cc1cccc(Cl)c1	744419089	LPTJWMJXUUKHOT-MRXNPFEDSA-N	428.920	1.876	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)/C(=C\c2ccc(F)cc2)n2nnnc2C)c1	744539301	SMWDUYGWQZKCEW-WOJGMQOQSA-N	438.419	1.432	50	20	IDGD	
CCOC(=O)[C@@H]1CCCN(C(=O)[C@H](C)OC(=O)/C(C#N)=C/c2cc(C#N)n(C)c2C)C1	744632037	IXOKMNFVVLCZQZ-DGMFMNFASA-N	426.473	1.846	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)[C@H](c2ccccc2)N2CCC(O)CC2)c1	744964470	SNSBAMGENBXOOL-NRFANRHFSA-N	425.485	1.497	50	20	IDGD	
CSc1nc(C2CC2)nc(C)c1C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	746219665	SVTWCMVONZVAIZ-UHFFFAOYSA-N	427.534	1.852	50	20	IDGD	
O=C(COCc1ccccc1)NNS(=O)(=O)c1ccc([N+](=O)[O-])cc1Br	746598137	FRIIYZCZXDHMSN-UHFFFAOYSA-N	444.263	1.884	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)NCc2csc(N(C)C)n2)c2ccccc2c1=O	747588696	ICVGMKYAJACYNM-UHFFFAOYSA-N	429.506	1.644	50	20	IDGD	
O=C(CSc1ncccc1C(=O)NNC(=O)c1ccc[nH]1)Nc1ccc2c(c1)OCO2	747662943	CMTWIPNXCSJZGT-UHFFFAOYSA-N	439.453	1.944	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cccc(N3CC=CC3)c2)cc1OC	747711807	BARHKFUCLHXXPW-UHFFFAOYSA-N	425.441	1.698	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)N[C@@H]1CCN(c2ccc(Br)cc2)C1	748629745	DOTGFEQDENDTGV-TZMCWYRMSA-N	429.315	1.410	50	20	IDGD	
O=C(NNC(=O)c1cc2ccccc2o1)c1cccc(S(=O)(=O)NC[C@@H]2CCCO2)c1	749546059	SYKPWJAEYOIMHE-INIZCTEOSA-N	443.481	1.965	50	20	IDGD	
O=C(NNc1nc(Br)cn2ccnc12)[C@H]1CC(=O)N(Cc2ccccn2)C1	750243706	MUMUBLXUUNEYTE-NSHDSACASA-N	430.266	1.379	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=S)N[C@@H](C)C3CC3)CC2)cc1C	751620183	GTKBCZSFNYHAEN-HNNXBMFYSA-N	438.619	1.998	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)c2csc(Cc3ccc(N)cc3)n2)cc1	751945968	TWBCRFIGNCFFNF-UHFFFAOYSA-N	435.465	1.806	50	20	IDGD	
O=C(CCc1ccccc1)NNC(=O)NCCNS(=O)(=O)c1ccc(Cl)s1	752688949	LCXDCNRZZJDNGR-UHFFFAOYSA-N	430.939	1.643	50	20	IDGD	
CC(CN1C(=O)CCC1=O)=NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	754910451	OFDPDZQCGAKMDZ-UHFFFAOYSA-N	442.497	1.420	50	20	IDGD	
O=C(NNC(=O)c1cccc(Cl)c1)Nc1cccc(S(=O)(=O)N2CCOCC2)c1	755355026	WSJFFFXWSOCSTC-UHFFFAOYSA-N	438.893	1.827	50	20	IDGD	
COC(=O)CNC(=O)Cc1ccc(NC(=O)NNC(=O)COc2cccc(C)c2)cc1	755862032	LPXZAKWJPHZIJM-UHFFFAOYSA-N	428.445	1.058	50	20	IDGD	
O=C1CN(c2ccc(NC(=O)NNC(=O)[C@H]3COc4ccccc4O3)cc2Cl)CCN1	755937312	FZGPZUUSYXWTNR-QGZVFWFLSA-N	445.863	1.269	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)Nc2cccc(C(=O)NC(C)(C)C)c2)c2ccccc2c1=O	755965039	WIZOQARSQNSILN-UHFFFAOYSA-N	436.472	1.928	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(C(=O)NNC(=S)Nc2cccc(Br)c2)co1	756128457	ZTIASOHPDRWIHS-UHFFFAOYSA-N	447.336	1.924	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1ccc(N2C[C@H]3CC[C@H]2C3)cc1	756156037	ZOZRHVXGVHYRJN-KSSFIOAISA-N	436.468	1.846	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)OCC(=O)C(C#N)=C2N(C)c3ccccc3N2C)co1	756405875	RKCRBHANCMVHHY-UHFFFAOYSA-N	430.442	1.235	50	20	IDGD	
O=C(NNC(=O)c1c(Cl)cccc1Cl)Nc1ccn(CCN2CCOCC2)n1	756646164	LRDHHHJYHNSBNC-UHFFFAOYSA-N	427.292	1.989	50	20	IDGD	
N#CCCn1ccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)n1	756654604	LBRRAVFZDGJIRK-UHFFFAOYSA-N	445.505	1.438	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)Nc1cccn(Cc2ccc(F)cc2)c1=O	757655014	FQXJDMOSRHGABH-UHFFFAOYSA-N	448.418	1.478	50	20	IDGD	
O=C(NCC12CCC(CC1)C2)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	757704683	PVMGWFXCMZJLGJ-UHFFFAOYSA-N	436.534	1.232	50	20	IDGD	
CC(=O)N1CC[C@@H](NC(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)c2ccccc21	757789281	RWTQLEZDCDBOAD-QGZVFWFLSA-N	446.533	1.892	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)Nc1ccc(F)c(S(=O)(=O)NC2CC2)c1	757874387	NASBWUUTUXXGBM-UHFFFAOYSA-N	437.409	1.641	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)c2ccc3c(c2)CCC(=O)N3C)c2ccccc2c1=O	758070560	DSMURTYODZHMFD-UHFFFAOYSA-N	433.468	1.961	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)CCc2cccc(OC(C)(C)C)n2)c1	758367887	QXZXPLPLVIHGIX-UHFFFAOYSA-N	448.545	1.903	50	20	IDGD	
O=C(NNC(=O)c1ccc(F)cc1I)C(=O)Nc1ccccn1	758841292	WDQFIKZRVMRSHR-UHFFFAOYSA-N	428.161	1.225	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)ccc1Cl	759109142	LDLDKDNIPYSJEC-UHFFFAOYSA-N	437.905	1.744	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)NC[C@H]1CSCCN1Cc1ccccc1	759199258	MONBAWJXECFAEZ-KRWDZBQOSA-N	430.530	1.719	50	20	IDGD	
COc1cc(Br)c(N)c(C(=O)OCC(=O)NNC(=O)c2cccs2)c1	759312703	FKWBDFDSGSCSTG-UHFFFAOYSA-N	428.264	1.719	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)[C@H]2CC(=O)N(CCOc3ccccc3Cl)C2)nc1	759738130	MVDIFFKNZGRULR-AWEZNQCLSA-N	432.864	1.892	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)CSCC(F)(F)F)c1	761191639	HRTPEXSRKLEYTD-UHFFFAOYSA-N	427.470	1.774	50	20	IDGD	
O=C(CCCN1C(=O)CNC1=O)NNC(=O)c1cn(-c2ccccc2)nc1-c1ccccc1	761769546	XBOBUEFTKJAOOW-UHFFFAOYSA-N	446.467	1.632	50	20	IDGD	
CC(=O)N1c2ccc(S(=O)(=O)NNC(=O)CSc3ccccc3O)cc2C[C@@H]1C	763412692	NIDPEXCENBCBQK-LBPRGKRZSA-N	435.527	1.792	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(-n3ccnc3C)nc2)c2ccccc2n1	763615172	LJAYJYZGGXURFR-UHFFFAOYSA-N	429.440	1.832	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2c(C)nc3ccccn23)ccc1Cl	763625540	TYMKUIJDADITDL-UHFFFAOYSA-N	443.847	1.873	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(N3CCOC[C@H]3C)cc2)cc1	763659412	NQKMASPOMCBJNJ-OAHLLOKOSA-N	442.472	1.085	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)C(=O)Nc1ccc2c(c1)COC2	763693829	FNQIEOIOXACKSV-UHFFFAOYSA-N	434.246	1.644	50	20	IDGD	
COc1cc(OC)c(Cn2nccc2NC(=O)C(=O)NNC(=O)CC(C)C)c(OC)c1	763889116	XVGIDOXSGDHKJZ-UHFFFAOYSA-N	433.465	1.089	50	20	IDGD	
CC(=O)N1CCc2cc(NC(=O)C(=O)NNC(=O)CSc3ccc(C)cc3)ccc21	763898418	UMTMEEVNAHIVHH-UHFFFAOYSA-N	426.498	1.782	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2sc(-c3ccccc3)nc2C)cn1C	763902842	YMFIVQRHKJUNHV-UHFFFAOYSA-N	441.469	1.643	50	20	IDGD	
O=C(NNC(=O)c1cc(Cl)ccc1O)C(=O)Nc1cc(F)cc(N2CCOCC2)c1	763974755	XIXJHTXYUOSIPH-UHFFFAOYSA-N	436.827	1.421	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)cc(OC)c1OC	763996679	FKOQJLYBMNIIII-UHFFFAOYSA-N	441.238	1.203	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)c2cccn2C)sc2c1CCCS2	763998476	KHIJAVPFPWUCJG-UHFFFAOYSA-N	436.515	1.701	50	20	IDGD	
CCOc1cc2c(cc1NC(=O)C(=O)NNC(=O)c1ccc3c(c1)OCCO3)O[C@@H](C)C2	764003495	FFJJSLUMFSBARX-LBPRGKRZSA-N	441.440	1.580	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1ccc2c(c1)nc1n2CCCCC1	764005956	GVUUPWQIIMMPCE-UHFFFAOYSA-N	449.467	1.934	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)on1)C(=O)Nc1ccn(CCc2ccncc2)n1	764016925	PVNLDQUCZQDGAP-UHFFFAOYSA-N	445.439	1.576	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)nc1)C(=O)Nc1ccc(OCC(F)(F)C(F)F)nc1	764099798	SZAFXZLQFVGRDZ-UHFFFAOYSA-N	449.748	1.809	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)N1CCc2ccc(Br)cc21	764132997	SIIBYKDMIANEEA-UHFFFAOYSA-N	432.274	1.737	50	20	IDGD	
CCS(=O)(=O)c1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)CCc1ccccc1	764193910	WPBDJAJSNJDMDP-UHFFFAOYSA-N	437.905	1.852	50	20	IDGD	
O=C(Cc1ccccn1)NNC(=O)C(=O)Nc1ccc(-c2nnc3n2CCCCCC3)cc1	764263767	IWKNQKAAUNKWQN-UHFFFAOYSA-N	447.499	1.785	50	20	IDGD	
C[C@@H]1C[C@@H](C)CN(C(=O)c2ccccc2NC(=O)C(=O)NNC(=O)Cc2ccccn2)C1	764264796	UNAQHSWENWGOGO-HZPDHXFCSA-N	437.500	1.528	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)Cc2cccnc2)sc2c1CCSC2	764268306	QPYPVVNVXPXPRN-UHFFFAOYSA-N	448.526	1.438	50	20	IDGD	
CCN(CC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)CC1CCN(c2ccccn2)CC1	764280831	UOGDLQBJCPHGPZ-UHFFFAOYSA-N	440.504	1.989	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)CCc2ccccc2O)ccc1N1CCCC1=O	764288748	LVRVBWADRMWLPZ-UHFFFAOYSA-N	440.456	1.246	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)C(=O)Nc1ccnn1Cc1ccccc1Br	764297963	JUSGNMPBPMMCFZ-UHFFFAOYSA-N	446.265	1.125	50	20	IDGD	
COc1ccccc1COc1cccc(NC(=O)C(=O)NNC(=O)c2cnn(C)c2)c1C	764362811	IRRSZEGBDKTBJW-UHFFFAOYSA-N	437.456	1.716	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1ccc(NC(=O)C2CC2)nc1	764392880	MKORJNNLIKAUHG-UHFFFAOYSA-N	443.485	1.317	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1	764401884	YWTHSMPZRLUEQL-QMMMGPOBSA-N	445.316	1.862	50	20	IDGD	
O=C(NNC(=O)[C@H]1COCCO1)C(=O)Nc1ccccc1SC[C@H]1CC1(Cl)Cl	764430049	RDCSPSKPGBUPMZ-ZYHUDNBSSA-N	448.328	1.474	50	20	IDGD	
CCOc1ccc([N+](=O)[O-])cc1C=NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	764826913	CKQPTIIEMDPMJB-UHFFFAOYSA-N	439.472	1.902	50	20	IDGD	
Cc1cccc(N2C(=O)N[C@H](CCC(=O)NNC(=O)CSc3ccccc3O)C2=O)c1	765250407	RUBXKFLYVZXYQQ-OAHLLOKOSA-N	442.497	1.845	50	20	IDGD	
Cc1cc(Br)oc1C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765734653	BQMCRVUTFROULZ-UHFFFAOYSA-N	449.305	1.570	50	20	IDGD	
CCOC(=O)N1CCC[C@@H](C(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)C1	765753152	BFZWWNWCYCXGNY-HXUWFJFHSA-N	445.564	1.129	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNS(=O)(=O)c3ccc(C#N)c(C)c3)CC2)cc1	766549376	UUSDWYAXZSQHSU-UHFFFAOYSA-N	441.557	1.302	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)CN1CCCCCCC1=O	766659923	JMTZXTZTQRUHQD-UHFFFAOYSA-N	449.983	1.398	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2cccc3ccsc23)CC1	768712727	SLQFWAYDRGUZTR-UHFFFAOYSA-N	431.543	1.989	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)NC2CCN([C@@H]3CCCC[C@@H]3O)CC2)cc1C	769165480	FARWAWANTRSPGI-MOPGFXCFSA-N	431.537	1.340	50	20	IDGD	
CCc1c(C(=O)NNC(=O)CNC(=O)c2cccs2)cnn1-c1ccc(OC)cc1	769909798	FTXMZZOWUDHQNM-UHFFFAOYSA-N	427.486	1.696	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(N)cc2C(F)(F)F)cc1OC	770057578	MKUBQAYMGVHQKZ-UHFFFAOYSA-N	441.362	1.923	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCCC(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1C	770363721	FTYARCOOWKXMTR-UHFFFAOYSA-N	433.486	1.204	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)NCC(=O)N(C)CCc1ccccn1	770503336	LFSDIYVGABVPNZ-CQSZACIVSA-N	433.896	1.534	50	20	IDGD	
CC(=O)N[C@@H](CC(=O)NNc1nc(O)c2cnn(C)c2n1)c1ccc(Br)cc1	770983906	RUDRCZZVHGWNGJ-ZDUSSCGKSA-N	448.281	1.542	50	20	IDGD	
O=C(C[C@H](O)c1cccc(F)c1)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	772809213	FTKMKCHOZNAANK-FQEVSTJZSA-N	448.926	1.868	50	20	IDGD	
O=C(NNc1ccc(C(F)(F)F)cc1)C(=O)Nc1cnn(Cc2nnc3n2CCCC3)c1	773583261	XNUYAKIFNVABSW-UHFFFAOYSA-N	448.409	1.960	50	20	IDGD	
CC(C)c1nccnc1NNC(=O)C(=O)Nc1cccc(S(=O)(=O)NC(C)(C)C)c1	774000147	PELGNZHRKUNFHU-UHFFFAOYSA-N	434.522	1.759	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)Nc2cc(OC)n(C)n2)cc1	775076903	RLFWGXSUCWPYGO-GDNBJRDFSA-N	449.471	1.722	50	20	IDGD	
O=C(c1cccnc1N1CCCCC1)N1CCN(S(=O)(=O)CBr)CC1	777831446	AOTURCKNPNKOMO-UHFFFAOYSA-N	431.356	1.512	50	20	IDGD	
COc1ccc(Cn2cc(C(=O)NNc3nc4ccccc4c(=O)n3C)cn2)cc1OC	778834924	AKGLWGBREPZSNU-UHFFFAOYSA-N	434.456	1.952	50	20	IDGD	
O=C(NNc1ccccc1OC(F)(F)F)Nc1ccn(CC(=O)N2CCOCC2)n1	779427471	YGPKYIWVZDAVPE-UHFFFAOYSA-N	428.371	1.789	50	20	IDGD	
N#CC1=CCN(CC(=O)N2CCN(S(=O)(=O)c3ccc4c(c3)CCCC4)CC2)CC1	779591821	VZLXHRCDCKZIRD-UHFFFAOYSA-N	428.558	1.554	50	20	IDGD	
COc1cccc(NNC(=O)CCNS(=O)(=O)c2ccc(Br)cc2)n1	780772429	MPIWMPCEQUZAKI-UHFFFAOYSA-N	429.296	1.664	50	20	IDGD	
Cc1cc(C(=O)N2CCSCC2)ccc1NC(=O)C(=O)NNc1ncncc1Cl	782159263	GHVJKGLXGPFNQJ-UHFFFAOYSA-N	434.909	1.709	50	20	IDGD	
NC(=O)COc1ccc(NC(=O)C(=O)NNc2ncc(C(F)(F)F)cc2Cl)cc1	782852880	LWFPDQZTPBFWRN-UHFFFAOYSA-N	431.758	1.700	50	20	IDGD	
CNS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2Cl)cc1	782925571	KQAIUMLNBDVFSF-UHFFFAOYSA-N	445.284	1.301	50	20	IDGD	
CN(C)C(=O)COc1cccc(NC(=O)C(=O)NNc2ccccc2Br)c1	782984281	KXJADQZDJMFNKC-UHFFFAOYSA-N	435.278	1.998	50	20	IDGD	
CCCCN(C)S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2cncc(Cl)n2)cc1	783266071	MPSVHCQQKIDJGY-UHFFFAOYSA-N	440.913	1.632	50	20	IDGD	
C[C@@H]1CN(S(=O)(=O)c2ccc(NC(=O)C(=O)NN(C)c3ccccc3)cc2)C[C@@H](C)O1	783434398	LEBPHEWDRRYBFE-HZPDHXFCSA-N	446.529	1.591	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2cccnc2Cl)cc1OCC(=O)NC1CC1	784839251	SLMNVKVLWXEZAL-UHFFFAOYSA-N	433.852	1.483	50	20	IDGD	
CCN1CCN(C(=O)c2ccc(NC(=O)C(=O)NNc3ccc(Cl)nc3)cc2)CC1	784870425	SADGCFSSKCSKKB-UHFFFAOYSA-N	430.896	1.595	50	20	IDGD	
O=C(NNc1c(Cl)cc(F)cc1Cl)C(=O)Nc1cnn(CCN2CCOCC2)c1	784878427	RHSOBUNXCDNQQP-UHFFFAOYSA-N	445.282	1.743	50	20	IDGD	
CN(C)c1nccc(NNC(=O)C(=O)Nc2cc(C(=O)N3CCCCC3)ccc2Cl)n1	784969921	CVXIPOGKQYVJDH-UHFFFAOYSA-N	445.911	1.904	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)[C@@H]1[C@H]2CC[C@@H](O2)[C@@H]1C(F)(F)F	785597103	GIRWAIJTYADEMW-XOUADPBQSA-N	449.451	1.507	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN1C1CC1)c1nn(Cc2ccccc2)c(=O)c2ccccc12	786638971	KQSCEVOEEKJZIT-HXUWFJFHSA-N	431.496	1.833	50	20	IDGD	
C[C@H]1CCCCN1S(=O)(=O)c1ccc(C(=O)NNc2ccc(-n3ccnc3)nn2)cc1	788180757	FXQXEUJOVPUIDO-HNNXBMFYSA-N	441.517	1.982	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)N[C@H]2CCCN(c3ccc(Cl)cc3Cl)C2=O)cn1	788916351	JHLGYPVHCRLETE-ZDUSSCGKSA-N	425.276	1.867	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)N[C@@H]1CCCN(c2ccc(Cl)cc2Cl)C1=O	788917279	UVCSPXHELSERCM-BXUZGUMPSA-N	447.319	1.871	50	20	IDGD	
CC1(C)COc2c(C(=O)OCC(=O)NNC(=O)[C@H]3COc4ccccc4O3)cccc21	789244962	JWTNZQJJWWWTOZ-QGZVFWFLSA-N	426.425	1.501	50	20	IDGD	
CCCCOc1ccc(C(=O)NNS(=O)(=O)c2cnn(CC(F)F)c2)cc1OC	790044677	FVSSOWDJTZHXOF-UHFFFAOYSA-N	432.449	1.959	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2ncccc2Br)cc1	792804269	OXPPSYQRKRQJFE-UHFFFAOYSA-N	441.307	1.234	50	20	IDGD	
C=C(CBr)COC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1	795520627	HZWIVNLGQHTRMW-UHFFFAOYSA-N	431.352	1.796	50	20	IDGD	
CC(C)O[C@H](C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1)c1ccccc1	796416331	JHRSZKDSCIYGBN-ICSRJNTNSA-N	428.441	1.683	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2ccc(OC(F)F)c(C(F)(F)F)c2)CCS(=O)(=O)C1	797054768	LMECHMHWYTWMNZ-AWEZNQCLSA-N	445.366	1.443	50	20	IDGD	
CCOc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NNC(=O)c1ccc2c(c1)OCCO2	799258725	KKOUXGJHWFXSND-UHFFFAOYSA-N	430.373	1.164	50	20	IDGD	
CSC[C@H](C)C(=O)N1CCC(C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)CC1	799298047	SVZVZTVYZQKPKK-UONOGXRCSA-N	425.526	1.978	50	20	IDGD	
N#CC1(c2ccccn2)CCN(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)CC1	799857303	STXURULAYIHCDJ-UHFFFAOYSA-N	441.517	1.286	50	20	IDGD	
Cc1ccccc1-n1c(C)cc(/C=C(/C#N)C(=O)NCCC(=O)NS(C)(=O)=O)c1C	800552040	YEEOUXNIBOHRLP-PDGQHHTCSA-N	428.514	1.892	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)c2ccnc3c2nnn3C)c2ccccc2c1=O	801082502	XQFSODPNGLQMDT-UHFFFAOYSA-N	434.460	1.338	50	20	IDGD	
CC(C)CNS(=O)(=O)c1ccc(C(=O)NNC(=O)Nc2ccc3c(c2)OCO3)cc1	802105769	FNYQMLFMSCGRJH-UHFFFAOYSA-N	434.474	1.816	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ccccn2)c(C)cc1Br	806972398	UVROPLOUQKPPSU-UHFFFAOYSA-N	435.234	1.339	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1nc(-c2ccc(F)cc2)cs1	806974509	LCLDNKLKDGGTBY-UHFFFAOYSA-N	439.428	1.986	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)[C@H]1C[C@H](c2ccccc2)OC1=O	809539106	YRIRUDLNWBGNPR-NHCUHLMSSA-N	436.512	1.651	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(Br)cc1)NN=c1cc[nH]c2ccccc12	810361304	LHTUBQMCZCTWER-UHFFFAOYSA-N	435.303	1.841	50	20	IDGD	
COC(=O)c1c(F)ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2F)c1F	810384660	IJJZCEINIIHBJF-UHFFFAOYSA-N	425.319	1.055	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)CCC(C)C)c(C(=O)NCC(F)(F)F)cc1F	810386537	FVXKSPQHVIKWML-UHFFFAOYSA-N	434.390	1.948	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)c1ccc(S(=O)(=O)NCCOC)cc1	811261524	WXMYPFJJOUTPIP-UHFFFAOYSA-N	435.502	1.014	50	20	IDGD	
CCCCN(C)C[C@H](C)NC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1	812456608	LPKRRNMNBBOWNA-INIZCTEOSA-N	427.571	1.066	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2ncc(Cl)cc2C)c2ccccc2c1=O	812979455	UQGOMXFZKJFDSH-UHFFFAOYSA-N	428.836	1.173	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1ccc2c(C)nn(C)c2c1	812979905	GJSSTDHMXGNGFT-UHFFFAOYSA-N	427.486	1.769	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)NC[C@H]2CCCS(=O)(=O)C2)N(C)c2ccccc21	813629656	ZCXFPMUKRZOJQH-OAHLLOKOSA-N	430.530	1.598	50	20	IDGD	
Cn1ncc(I)c1C(=O)NNC(=O)c1cc(Br)c[nH]1	814103131	WWHSFYPTAOIWIV-UHFFFAOYSA-N	438.023	1.190	50	20	IDGD	
COCc1cc(NC(=O)C(=O)NNC(=O)CCc2ccccc2O)cc(C(=O)OC)c1	815569403	RXQBWOLOIULQJX-UHFFFAOYSA-N	429.429	1.044	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)NCC(=O)NCCN2CCCCCC2)c1C	817157587	KDJGRUNYNOGNIM-RCCKNPSSSA-N	429.565	1.767	50	20	IDGD	
CCOC(=O)N1CCC[C@H](C(=O)NNC(=O)COc2ccc(Br)cc2)C1	912895904	YHPOHQOBSGZMGG-LBPRGKRZSA-N	428.283	1.844	50	20	IDGD	
COc1ccc([N+](=O)[O-])cc1NS(=O)(=O)c1ccc(F)c(C(=O)NNC(C)=O)c1	913173296	LJDZCCCBJMFPMY-UHFFFAOYSA-N	426.382	1.324	50	20	IDGD	
Cc1nnc(NNC(=O)c2ccc(S(=O)(=O)NCCc3cccs3)cc2)nc1O	914832349	WDKLYONKYNZXQK-UHFFFAOYSA-N	434.503	1.225	50	20	IDGD	
Cc1cc(Cl)ccc1OCCCC(=O)NNC(=O)c1cc(S(=O)(=O)N(C)C)c[nH]1	915063768	KWSFDTOIANFGOT-UHFFFAOYSA-N	442.925	1.847	50	20	IDGD	
CCNC(=O)CNC(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccc(OC)c(OC)c1	916161976	YLOFBZOUAVKFAN-YBEGLDIGSA-N	436.472	1.640	50	20	IDGD	
CCN1CCN(Cc2ccccc2CNC(=O)NNC(=O)Cn2nc(C)cc2C)CC1	916419897	LAWWNAXQMKQCEE-UHFFFAOYSA-N	427.553	1.168	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)N[C@@H](C)CN2CCOCC2)c2ccccc2c1=O	916471069	ZRMJMIODMMDSJF-INIZCTEOSA-N	444.536	1.251	50	20	IDGD	
CCS(=O)(=O)N(C)CCCNC(=O)NNC(=O)[C@H](C)Oc1ccc2ccccc2c1	916580320	MPHSRNVMWVLMHZ-HNNXBMFYSA-N	436.534	1.609	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CCNS(=O)(=O)/C=C/c2ccccc2)cc1	916830779	WOXJFOJDDIYKAN-WYMLVPIESA-N	430.486	1.061	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCCN(c3ccccc3C#N)CC2)cc1OC	917114170	UBYPHRKAOTVHSQ-UHFFFAOYSA-N	437.500	1.549	50	20	IDGD	
Cc1ccc(S(=O)(=O)Oc2ccc(S(=O)(=O)NNC(=O)c3cnccn3)cc2)cc1	917732070	LGOLKVQLAQLEMG-UHFFFAOYSA-N	448.482	1.176	50	20	IDGD	
Cn1nnnc1SCCC(=O)NNC(=O)COc1ccc(-c2ccc(C#N)cc2)cc1	917907932	AKTPVDPSJISWCQ-UHFFFAOYSA-N	437.485	1.457	50	20	IDGD	
Cc1ccc([C@@H](CNC(=O)NNC(=O)COc2ccc(C#N)cc2)N2CCOCC2)cc1	918099664	YKGWMKUDLDIFBN-OAQYLSRUSA-N	437.500	1.649	50	20	IDGD	
O=C(CS(=O)(=O)Cc1cccc(Br)c1)NNC(=O)c1ccccc1F	919826587	BYDLRSHUWGZERG-UHFFFAOYSA-N	429.267	1.964	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)NC[C@H](c1cccs1)N1CCN(C)CC1	919902433	DYDWXVZEXRIQPI-QGZVFWFLSA-N	431.562	1.618	50	20	IDGD	
O=C(CNC(=O)[C@H]1c2ccccc2C(=O)N1Cc1ccccc1)NNC(=O)c1cccnc1	920273965	GRPQKGUHYVFZFH-OAQYLSRUSA-N	443.463	1.356	50	20	IDGD	
CCCCN1C(=O)CC[C@@H](C(=O)NNC(=O)CN2CCCC2=O)[C@@H]1c1ccccc1OC	920435576	JXHILNPIXQHTPD-VGSWGCGISA-N	444.532	1.545	50	20	IDGD	
COC(=O)c1cc(Br)c(S(=O)(=O)NNC(=O)c2ccc(OC)cc2)s1	1116688924	ALEHGCKQLOIIIW-UHFFFAOYSA-N	449.304	1.929	50	20	IDGD	
CNC(=O)c1cccc(C(=O)NNC(=O)c2nc(-c3ccccc3)n(-c3ccccc3)n2)n1	1252999904	GMWYUMUFRWMIGF-UHFFFAOYSA-N	441.451	1.764	50	20	IDGD	
Nc1cnnc(NNC(=O)NCCNC(=O)c2cccc(Br)c2)c1Cl	1319216714	AJJCLNARZRNFTK-UHFFFAOYSA-N	428.678	1.531	50	20	IDGD	
CSc1ncc(Br)c(C(=O)NNC(=O)c2ccc3c(c2)OCCO3)n1	1347191008	BDXSMMBECUHTTH-UHFFFAOYSA-N	425.264	1.807	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1)c1nnnn1C	1348020112	WUHFDWBBWGZJHQ-BEFAXECRSA-N	434.504	1.229	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnn4cccnc34)C2)C1	1778444968	AFCZHMXTQNAJBI-KBXCAEBGSA-N	436.310	1.346	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CO[Si](C)(C)C)C2	1779535054	ZQNVSCQOSQDNAP-JXXFODFXSA-N	425.602	1.043	50	20	IDGD	
COc1cccc2[nH]cc(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)[C@H](O)CCl)C4)c12	1781322211	QHUOEEXLUICMAQ-RADWXHQJSA-N	449.935	1.904	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cn3ccsc3n1)C2	1782175090	DDJNDZJYKQTCPR-ZXYWRSMDSA-N	440.953	1.777	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C(Cl)Cl)C1)n1ccccc1=O	1782218053	OEVKVMNRWBBBMX-PJIJBLCYSA-N	430.332	1.727	50	20	IDGD	
O=C(c1cccc2ccnn12)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1782228465	AESPQZWNNOCHRJ-PBHICJAKSA-N	425.258	1.468	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4ccnn4c3)C2)C1	1782404991	OVUMQLZBDKGWBV-APWZRJJASA-N	435.322	1.951	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnc4c(c3)CCNCC4)C2)C1	1782728600	ZRPSKAUIRTZDRZ-PGRDOPGGSA-N	434.968	1.621	50	20	IDGD	
C[C@H](CC(=O)N1CC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2)c1ccccc1	1783278808	ADKTUHJWYQVATM-KOSHJBKYSA-N	436.317	1.004	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cnn4cccnc34)CCO2)C1	1783350006	XZOMMNSYYDFEGU-RDTXWAMCSA-N	436.310	1.346	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccnc(OC)c3)CCO2)C1	1783350092	ZYIVCYMPNRCQQT-KDOFPFPSSA-N	426.311	1.707	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cc(COC)c[nH]3)CCO2)C1	1783352768	SRFBBKYGWUCKBN-KBXCAEBGSA-N	428.327	1.778	50	20	IDGD	
CCOc1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](Br)CC)C3)C2)nn1	1783353702	ZGAKVGHGUZYFAD-FZKQIMNGSA-N	441.326	1.492	50	20	IDGD	
COC(=O)CCCCCC(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](C)Br)C2)C1	1783539442	JAFDNCROLXVYLL-KSSFIOAISA-N	433.343	1.723	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)[C@@H](C)CNC(=O)OC(C)(C)C)CCO2)C1	1783870462	CGXFPGIMTPMYLG-BXTJHSDWSA-N	447.960	1.231	50	20	IDGD	
CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](Cl)COC)CCO2	1785347618	AFKQRSXOYRQBHQ-QEEYODRMSA-N	447.960	1.373	50	20	IDGD	
COc1cc(F)ccc1CC(=O)N1CC[C@@]2(CN(C(=O)CCBr)CCO2)C1	1785656346	UYDWDYBCSVJOMN-IBGZPJMESA-N	443.313	1.992	50	20	IDGD	
CC[C@@H](C)[C@H](O)C(=O)Nc1ccc(C2(NC(=O)c3cnccc3C(=O)NN)CCC2)cc1	1786401906	ZWJVADLMMUAFRA-KUHUBIRLSA-N	439.516	1.840	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)COCc3ccccc3)C[C@@H]21	1786404184	HQDCEMASVDWLSQ-BZSNNMDCSA-N	439.350	1.968	50	20	IDGD	
CC(C)(C)NCC(=O)Nc1ccc(C2(NC(=O)c3cnccc3C(=O)NN)CCC2)cc1	1788005282	PRCLHQPKCKEGEX-UHFFFAOYSA-N	438.532	1.821	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1ccc(C2(NC(=O)[C@H](C)NC=O)CCC2)cc1	1788645387	GUFFUNCOBMKSDZ-TXLFSUKISA-N	438.488	1.389	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@](C)(O)C(F)(F)F)C[C@@H]21	1789868307	BAFROPZMLUAQHU-LYEQHPFYSA-N	435.270	1.516	50	20	IDGD	
CCN(CC)C[C@@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)Br)C[C@@H]21	1790606043	WKBUFMIIIBKECQ-NRKLIOEPSA-N	432.403	1.727	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(=O)c3cccn3C)C[C@@H]21	1790964206	UHSYFNANMCPJTH-YXWQFLTLSA-N	440.338	1.361	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3cc(F)ccn3)C[C@@H]21	1791252394	JLVYSWAHPVBBKC-RUGDWHBFSA-N	427.904	1.387	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]2C1)[S@](=O)c1ccccc1	1791295875	JXJQTICQPJNATN-GYQHDJBKSA-N	447.384	1.966	50	20	IDGD	
CC(=O)N/C(=C\c1ccco1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]2C1	1791296591	BGCVEUZXZWRBOF-UJAJJJNPSA-N	444.315	1.540	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c(O)cc(O)cc1O)C2	1792874372	OANQOIYKKWTYEV-OJLPPKNESA-N	443.294	1.038	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1n[nH]c3c(Cl)cccc13)C2)[C@H](O)CCl	1792980550	SPLSURSMGJSUDP-RDBQEKCUSA-N	427.288	1.019	50	20	IDGD	
CC(=O)N[C@@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)CBr)C2)C(C)(C)C	1793190148	GSSKOAMNNZROOS-JZYAIQKZSA-N	446.386	1.158	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](O)CCl)C2)C1CC1	1793211254	FFLOTHGPRDRDGB-JJTUDDRGSA-N	443.972	1.918	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1noc(C)c1C	1793815293	FINVWEJDKNJIAN-VFMVUTOHSA-N	426.477	1.677	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2)c1ncn(-c2cccc(F)c2)n1	1794288569	BYZKEBXOAPKAHN-GNXNZQSNSA-N	442.278	1.413	50	20	IDGD	
COc1cccc(-c2cc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@H](O)CCl)C4)c[nH]2)c1	1794301530	AYWIDLJOFKLTEF-WOUAJJJCSA-N	447.919	1.493	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1sccc1C	1794627197	QWHUTYAGZCVWIZ-AMFOTSNXSA-N	443.529	1.394	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccnc1CS(C)(=O)=O	1794721867	IAXXZDUWPSBBJT-FQLMCAECSA-N	427.954	1.895	50	20	IDGD	
Cn1cnc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)/C(C#N)=C/c2ccc(F)cc2F)C3)c1	1794904923	BBWCGRBSXVTHER-QYFXKUKHSA-N	441.438	1.509	50	20	IDGD	
Cc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCBr)cc(C)c1O	1795116864	BJBMZNFYQDVVJG-SCAQPMJSSA-N	425.323	1.997	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)c1ccnc2c(O)cccc12	1796189463	PSLVTXAJAHBANU-BCDXTJNWSA-N	445.284	1.186	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccsc1)C2	1796441221	MIFWNVCXWUZFRV-OEDQRSTHSA-N	429.502	1.085	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cn(C(C)(C)C)nn1	1798708428	CSHMBLZWNUIOSE-XFMPKHEZSA-N	442.358	1.410	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc([N+](=O)[O-])c(OC)c1)C2	1799271021	IUWCRAKUDOBSTL-LOUJCGABSA-N	425.869	1.824	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)[S@@](=O)c1ccccc1)C2	1799272418	QHTFOIHCJSFEOA-YPJWYIRZSA-N	426.966	1.790	50	20	IDGD	
COc1ccccc1OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Br	1799343343	SJXRBQTZMVFXQY-LZDSYCOUSA-N	445.285	1.354	50	20	IDGD	
CN1CCN(C2(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)[C@](C)(Cl)CCl)C4)CC2)CC1	1799978136	NJEKKBSYPCUQSC-YYAJDYIMSA-N	431.408	1.641	50	20	IDGD	
CC[C@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](O)CCNC(=O)OC(C)(C)C)C2	1800074901	IQEZZMCPFBLYHU-XFIYOXNOSA-N	431.961	1.918	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CC13CCCN1CCC3)C2	1800642268	AKETXFUJABWMNV-DFGXFYAUSA-N	442.398	1.768	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3ccoc3s1)C2	1801011670	XYJZNAOZJKGDIF-ZSBFGKGUSA-N	434.518	1.071	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1CCN(C(=O)[C@H](C)n2cncn2)[C@H]1c1cccnc1	1803017203	CBOSYVXBXDUKLP-OHFALNGGSA-N	449.353	1.971	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2ccc(F)s2)[C@@H]1c1cccnc1	1804736371	JETRUYPJNYHMFO-QRWLVFNGSA-N	447.536	1.975	50	20	IDGD	
O=C(CCBr)NC[C@H]1CCN(C(=O)Cc2ncccn2)[C@H]1c1cccnc1	1806341765	HFPQBYUWTZVSKG-BEFAXECRSA-N	432.322	1.905	50	20	IDGD	
COCCC(=O)N1CC[C@@H](CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@@H]1c1cccnc1	1808415595	ZDRRKRBBRGAIPE-QGJUGNDFSA-N	440.504	1.258	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](F)Cl)[C@@H]1c1cccnc1)c1cc2n(n1)CCCNC2=O	1809678896	KMXHKTFKWMBJIN-IAOVAPTHSA-N	448.886	1.266	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@H]1CCN(C(=O)CN2CCCC2=O)[C@H]1c1cccnc1	1810542024	VILSCWYMVFIBKX-UTKZUKDTSA-N	432.597	1.561	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1)c1cc(CO)on1	1811589576	JYXFCRPXAVLSLC-CXAGYDPISA-N	437.294	1.667	50	20	IDGD	
Cc1noc(CC(=O)N2CC[C@H](CNC(=O)[C@H](C)Br)[C@@H]2c2cccnc2)n1	1812865373	XCRVNKDMRCCIFC-KHIZAZIESA-N	436.310	1.805	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)Cn2cccn2)[C@@H]1c1cccnc1	1813028512	RPMFRCGGUOMTBZ-DSLXNQLJSA-N	433.940	1.874	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)CSc2ncccn2)[C@@H]1c1cccnc1	1813031835	SVFRQRKVWNWGAU-XYJFISCASA-N	449.964	1.924	50	20	IDGD	
Cc1ccc(CC(=O)N2CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)o1	1813072483	CEPHFLBTPCJXRO-MBSDFSHPSA-N	441.532	1.605	50	20	IDGD	
COc1nn(C)cc1C(=O)N1CC[C@H](CNC(=O)C(Cl)Cl)[C@H]1c1cccnc1	1813077284	IPMSHGDZWPMAMD-TZMCWYRMSA-N	426.304	1.947	50	20	IDGD	
CC(C)[C@H](S)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1815243270	IQLCNNFXCIYQFK-RDJZCZTQSA-N	445.549	1.669	50	20	IDGD	
CCC[C@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](O)N2CCOCC2)[nH]n1	1815319336	IGWJNTSDLHFEAV-JOQOYGCGSA-N	427.933	1.460	50	20	IDGD	
CC[C@@H](C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1)N(CC)CC	1815333420	MJKYAXYVROMLDP-ZWKOTPCHSA-N	449.600	1.895	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1ccnc(F)c1	1815418601	AKYWYQIDQLTKJF-KRWDZBQOSA-N	437.240	1.243	50	20	IDGD	
O=C(CCBr)Nc1cc([C@@H]2CCCCN2C(=O)CN2CCOCC2)[nH]n1	1816782840	YWAVCOYYGADJCC-AWEZNQCLSA-N	428.331	1.519	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)Cc2ccccc2O)[nH]n1)c1ccc(B(O)O)cc1	1817475980	YELUZRJDXWXTBQ-LJQANCHMSA-N	448.288	1.344	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3nc4ncccn4n3)sc2C1	1818310383	NDOAZNOONUGNFV-NXEZZACHSA-N	435.897	1.060	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)CCl)CC2)c1cccc2c1OCCO2	1818311727	UUEGNPLQRNEIEM-MFKMUULPSA-N	437.905	1.740	50	20	IDGD	
O=C(N[C@H]1CCc2nc(NC(=O)C3(F)CCCCC3)sc2C1)c1cccc(B(O)O)c1	1818743695	VEZVNOVCVPXUHH-HNNXBMFYSA-N	445.325	1.721	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)Cc2ccccc2)[nH]n1	1819402261	XGOSMQVSBWUGKD-IBGZPJMESA-N	447.499	1.957	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](O)CCl)CC2)c1c(F)ccc(O)c1F	1823632682	DPASHRFMUDQWMD-CPCISQLKSA-N	431.848	1.952	50	20	IDGD	
O=C(c1cnc(OCF)cn1)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)CC1	1824180401	HJNBSAXELAKNPV-HOTGVXAUSA-N	428.892	1.615	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc([N+](=O)[O-])[nH]1)CC2	1826004312	ZCBJFXPDLDATLW-DTWKUNHWSA-N	427.870	1.859	50	20	IDGD	
C[C@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1)n1cccc1	1827055475	YMXPDMLUOIEUDU-GCJKJVERSA-N	437.349	1.662	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)CCc2cccnc2)CC1	1827218475	RPSCEGCNUXVVLU-QHCPKHFHSA-N	449.360	1.628	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@H]2C[C@@H](O)C2)CC1	1827680609	RHKCZAOGYZYWDP-WBJNETPZSA-N	443.548	1.511	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)CN)C2)C1	1829221867	YSRVHDUBTHUTFV-UWJYYQICSA-N	436.940	1.415	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cnc4ccccn34)C2)C1	1830354298	WINMWDWESHJWCZ-JOCHJYFZSA-N	448.951	1.598	50	20	IDGD	
CC[C@@H](O)C(=O)N1CCO[C@]2(COCCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1	1830526774	LUDBUFGQEFBOPB-ALNQAOQGSA-N	449.454	1.099	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(NC(C)=O)o3)C2)C1	1831651981	VKYHJWKOGJIWEN-FOIQADDNSA-N	441.912	1.716	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C)n4ccnc4n3)C2)C1	1831654237	RRFWVVFQRPYSKD-IERDGZPVSA-N	449.939	1.515	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H](O)CCl)CC1	1831814251	XYKXOUKLECVLAD-WJFTUGDTSA-N	440.968	1.961	50	20	IDGD	
C[C@@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)[C@@H]3CCCO3)CC2)CC1	1833265957	FRLQEEJMVUUEJI-YOEHRIQHSA-N	430.387	1.768	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)C(C)C)CC2)CC1	1833350179	TUJBJZQDYSCJHM-IAGOWNOFSA-N	432.403	1.748	50	20	IDGD	
Cc1ncccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1834039997	XBDUVAWQDRMOBY-PBHICJAKSA-N	430.274	1.151	50	20	IDGD	
O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)c1cncc(F)c1)CCO2	1834354582	NRRIGWPKHBSUMG-QGZVFWFLSA-N	430.274	1.076	50	20	IDGD	
CCOc1cnc(C(=O)N2CCC(N3CCC(NC(=O)[C@H](F)Cl)CC3)CC2)cn1	1835078729	UIATWISGQJWPDE-KRWDZBQOSA-N	427.908	1.595	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cnn4cccnc34)CC2)CC1	1835536574	SPFZBXNZNZXFBJ-SFHVURJKSA-N	448.955	1.168	50	20	IDGD	
O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)Cc1ccsc1)CCO2	1836097163	VXSQZINPDSVSRY-KRWDZBQOSA-N	431.352	1.532	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)n3ccccc3=O)CC2)CC1	1836396877	ODEWGYGPCKYJCN-VQIMIIECSA-N	436.984	1.998	50	20	IDGD	
C[C@@H](C(=O)N1CCC(N2CCC(NC(=O)[C@@H](F)Br)CC2)CC1)n1ccnn1	1836413517	GDQFWYYBSTZTSP-SWLSCSKDSA-N	445.337	1.101	50	20	IDGD	
CC(=O)N[C@H](C(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)C(C)(C)C	1836713331	DQNGPFBNELPNOM-ZWKOTPCHSA-N	445.988	1.136	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc4ncncc4c3)CCO2)C1	1837026024	PBCKJUDFPMFPOV-UTKZUKDTSA-N	432.908	1.717	50	20	IDGD	
C[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1)N1CSCSC1	1837573006	SRZSTHSYNGGZIX-DVOMOZLQSA-N	441.978	1.020	50	20	IDGD	
CCc1cnc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](Cl)COC)C3)C2)s1	1837726217	XXCOQMKRPCCLMM-RDTXWAMCSA-N	431.942	1.029	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)CSc3nc[nH]n3)CC2)CC1	1838787537	XGKMXQWDFQUOEI-HNNXBMFYSA-N	445.973	1.149	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccc(OC)cc3C#N)C2)C1	1839146921	AMPPVKCRPLJANY-KNQAVFIVSA-N	449.935	1.583	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CC=CC[C@H]3C(=O)OC)C2)C1	1839148565	BTWGYNHBYAQWAX-VWXURSGXSA-N	442.940	1.216	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(-n4cccn4)cc3)CCO2)C1	1839337277	ABMACCPMMLCLGA-UGKGYDQZSA-N	446.935	1.960	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(CO)o3)C2)C1	1839964818	DPSTXDYXNQYFTH-KDOFPFPSSA-N	445.310	1.015	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(Cl)ccn3)C2)C1	1840153324	KDYJSVBTWHNYHY-RDTXWAMCSA-N	432.304	1.059	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(C)c(O)c3)C2)C1	1840154792	GYSPVMVPPMRDNH-OXJNMPFZSA-N	426.897	1.024	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(F)cc3C)C2)C1	1840156912	XXQJGGONHXQUNG-XLIONFOSSA-N	428.888	1.458	50	20	IDGD	
CN(C)c1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)cc1	1840189406	PMDKSRYKJSSGSD-LJQANCHMSA-N	430.332	1.626	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC2(CCCN2C(=O)c2cccnc2CS(C)(=O)=O)C1	1842241210	XARKXEJVLAOXRG-QGZVFWFLSA-N	448.372	1.680	50	20	IDGD	
O=C(COc1cccc2ccccc12)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843013201	UGNOSNKRWQVUDN-UHFFFAOYSA-N	444.296	1.416	50	20	IDGD	
CN1CCCn2nc(C(=O)N3CCCC34CN(C(=O)[C@@](C)(Cl)CCl)C4)cc2C1	1845727277	IHMBFMLFBCXYKL-SFHVURJKSA-N	428.364	1.772	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCCC(=O)NNC(=O)c2cc(Cl)ccc2O)cc1	10600758	WUEHCVQOJUNMNZ-UHFFFAOYSA-N	441.893	1.574	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)[C@@]23CCC(=O)N2c2ccccc2S3)cc1	10671025	CQTSBASUMSKYQR-NRFANRHFSA-N	425.466	1.928	50	20	IDGD	
CCN(c1ccccc1)S(=O)(=O)c1ccc(C(=O)NNc2nnc(C)c(=O)[nH]2)cc1	11548081	KCJBWWQYRGSXEP-UHFFFAOYSA-N	428.474	1.445	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C(C)C)c2)cc1OC	15793113	UAVDPOYFZQRPKY-UHFFFAOYSA-N	435.502	1.808	50	20	IDGD	
Cc1cc(C)c(S(=O)(=O)N2CCC(C(=O)NNC(=O)c3ccccn3)CC2)c(C)c1	17328328	MBYVROCVFLWLRO-UHFFFAOYSA-N	430.530	1.869	50	20	IDGD	
Nn1c(SCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)nnc1-c1ccc(F)cc1	21165567	ZVWQJUNKZZYOKB-UHFFFAOYSA-N	431.409	1.260	50	20	IDGD	
CCCOc1ccc(C(=O)NNS(=O)(=O)c2ccc3c(c2)oc(=O)n3C)cc1OC	22903357	UPIIWCHITWQJNT-UHFFFAOYSA-N	435.458	1.552	50	20	IDGD	
CCOc1ccc(-n2ncc(C(=O)NNC(=O)c3nnc(O)c4ccccc34)c2C)nn1	23688520	CRRGYOPGUXEHSU-UHFFFAOYSA-N	434.416	1.093	50	20	IDGD	
COCCCNC(=S)N(C)NC(=O)c1ccc(S(=O)(=O)N2CCCC[C@@H]2C)cc1	726077316	WDCNODIHVLWHKH-HNNXBMFYSA-N	442.607	1.737	50	20	IDGD	
C[C@@H]1CN(Cc2cccc(CNC(=O)NNC(=O)CNC(=O)c3cccs3)c2)CCO1	726241964	QHNISQVGHKTBHL-OAHLLOKOSA-N	445.545	1.229	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)F)cc1)Nc1cccc(N2C(=O)CNC2=O)c1	726877774	WUZXRKSBSRKJNY-UHFFFAOYSA-N	439.400	1.888	50	20	IDGD	
Cc1cc(C)nc(SCc2ccc(C(=O)NNC(=O)CCN3C(=O)CCC3=O)cc2)n1	727943142	XMPMTNNNNWXZEE-UHFFFAOYSA-N	441.513	1.686	50	20	IDGD	
COc1cc(OC)cc(C(=O)NCC(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)c1	728210258	LBSQFTCYYHNDBV-UHFFFAOYSA-N	448.501	1.018	50	20	IDGD	
COc1ccc(CC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)cc1OC	728213082	DSVBQPOAQMXOGU-UHFFFAOYSA-N	448.545	1.326	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)N2CCN(S(=O)(=O)c3ccc(C#N)cc3)CC2)cc(C#N)n1C	728218872	DARYNXDQXVOTDN-ODLFYWEKSA-N	448.508	1.517	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCc2ccco2)cc1C(=O)NNC(=O)Cc1cccnc1	728893891	XHDWFIHEHHJSSU-UHFFFAOYSA-N	428.470	1.465	50	20	IDGD	
CC(C)NS(=O)(=O)CCNC(=O)NNC(=O)c1ccc(Br)cc1Cl	728954464	FNJFQLPXSPZQQE-UHFFFAOYSA-N	441.735	1.374	50	20	IDGD	
Cn1ccnc1[C@@](O)(CCNC(=O)NNC(=O)Cn1ccc2ccccc21)C(F)(F)F	729496007	DMUFWOZUXSDTPH-SFHVURJKSA-N	438.410	1.545	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)c2cccc(S(=O)(=O)NC3CCCC3)c2)cn1	729692611	XBQWCGZOXNPBKZ-UHFFFAOYSA-N	449.558	1.943	50	20	IDGD	
COc1ccc(N2C[C@@H](C(=O)NNC(=S)Nc3ccc(OC)nc3)CC2=O)c(OC)c1	729693453	ZMGHEQFKMARXJH-LBPRGKRZSA-N	445.501	1.478	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)C2(NC(=O)OC(C)(C)C)CCCC2)n1	729747627	HUSMIGWKXRIEIV-UHFFFAOYSA-N	440.522	1.522	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)CNC(=O)c1ccco1)c1cc(F)ccc1N1CCC(O)CC1	730677929	NHSNRLYPUJTAAE-CYBMUJFWSA-N	447.467	1.201	50	20	IDGD	
Cc1nnsc1C(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	731518097	XUORUVAGJLCEEJ-UHFFFAOYSA-N	431.499	1.400	50	20	IDGD	
CS(=O)(=O)CCN1CCC(NC(=O)NNC(=O)c2c(Cl)cccc2Cl)CC1	731683818	JGVXGLRTONTTSO-UHFFFAOYSA-N	437.349	1.446	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)CN2C(=O)CCc3ccccc32)c2ccccc2c1=O	731959280	HDDKWLXNZLNMTI-UHFFFAOYSA-N	433.468	1.547	50	20	IDGD	
O=C(NCCN/C(O)=C1/N=CC=CC1=O)NNC(=O)c1ccc(F)cc1Br	732465728	JIYNVXHUWBTKJZ-SQFISAMPSA-N	440.229	1.059	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)N[C@H]2CCCN(c3cc(N4CCOCC4)ncn3)C2)n1	732913984	JEIBJEFTMDJIJB-INIZCTEOSA-N	427.513	1.015	50	20	IDGD	
Cc1ccc(S(=O)(=O)c2ccc(NNC(=O)[C@H]3CCCN3S(C)(=O)=O)cc2)cc1	733040216	INOUPIQBCIBKQX-GOSISDBHSA-N	437.543	1.695	50	20	IDGD	
C#CCNC(=O)CN1CCCN(C(=O)/C(C#N)=C/c2cc(C)n([C@H](C)COC)c2C)CC1	733150510	LMCVYJSOZQSPQH-VZMFNRANSA-N	439.560	1.503	50	20	IDGD	
Cn1c(NNC(=O)CCCNS(=O)(=O)c2ccc(F)cc2)nc2ccccc2c1=O	733366008	XIKCENIQCFCJCD-UHFFFAOYSA-N	433.465	1.274	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)N[C@@H]2CCN(c3ccc(C(F)(F)F)cc3)C2=O)n1	733850554	ILXFMDQHGQNYBC-OAHLLOKOSA-N	438.410	1.655	50	20	IDGD	
CCOC(=O)N1[C@H](c2ccc(C)o2)CC[C@@H]1C(=O)NNC(=O)CNC(=O)c1cccs1	736483001	WNMYAAPWRVHCGQ-UONOGXRCSA-N	448.501	1.889	50	20	IDGD	
CSCC[C@@H](C(=O)NNC(=O)COCc1ccccc1)N1C(=O)c2ccccc2C1=O	737629364	NUHURYRENNMBJK-SFHVURJKSA-N	441.509	1.769	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)CCC(C)(C)NC(=O)OC(C)(C)C)c2ccccc2c1=O	737765635	IJIFEPZHLMHUCY-UHFFFAOYSA-N	431.493	1.778	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)NCCC(=O)NNc2cccc(C(F)(F)F)n2)cc1	740141397	ANVBLLOPALRURK-UHFFFAOYSA-N	445.423	1.871	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1ccc2c(c1)OCCO2)[C@@H]1CN(Cc2ccccc2)CCO1	741285233	ZMMDBOWFVKJYKJ-KKSFZXQISA-N	440.500	1.691	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)NCC2CCN(S(=O)(=O)C(F)F)CC2)cc1	743625595	DVMWZLAUNLVCRZ-UHFFFAOYSA-N	448.496	1.353	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)CN1C(=O)Cn2c(cc3ccccc32)C1=O	743848334	XSSBSWFNVXWAIO-UHFFFAOYSA-N	440.843	1.747	50	20	IDGD	
COc1ccc(OC)c(CN2CCN(CC(=O)NNC(=O)c3cccc(C#N)c3)CC2)c1	744383261	LHIPAUWZWZXJRD-UHFFFAOYSA-N	437.500	1.154	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CN2CCCN(S(=O)(=O)c3ccc(F)cc3)CC2)c1	744384179	HOTNYLYCKFGUMJ-UHFFFAOYSA-N	448.520	1.292	50	20	IDGD	
CC1CCC(N2C[C@@H](C(=O)OCC(=O)NNC(=O)c3cccc(C#N)c3)CC2=O)CC1	744999653	ZZPFHHGVIKRNCN-GMXGEUMGSA-N	426.473	1.290	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)[C@H](c2cccc(F)c2)N2CCOCC2)cc1	745423523	IBLXKWKZXMOBQI-FQEVSTJZSA-N	429.448	1.512	50	20	IDGD	
COc1cc(C=NNC(=O)Cc2nc3ccccc3n2C)cc(Cl)c1OCC(N)=O	745988626	FKRLQIBDUSGGGL-UHFFFAOYSA-N	429.864	1.792	50	20	IDGD	
C[C@H](C=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O)c1cccc(Br)c1	747629669	KLEIHHDIGNEHHU-SNVBAGLBSA-N	440.323	1.239	50	20	IDGD	
O=C(CSc1nnc(-c2ccc3ccccc3c2)o1)NNC(=O)C(=O)N1CCCC1	748239949	NSWQPFZXFSDBIH-UHFFFAOYSA-N	425.470	1.752	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)C(=O)N3CCCC3)c2)cc1	748246056	DVGODLGPMQQCJI-UHFFFAOYSA-N	430.486	1.179	50	20	IDGD	
Cc1ccc(S(=O)(=O)Nc2ccccc2F)cc1C(=O)NNC(=O)C(=O)N1CCCC1	748247314	XNZMGVBTQCTCKK-UHFFFAOYSA-N	448.476	1.318	50	20	IDGD	
COc1ccccc1C(=O)NNS(=O)(=O)c1ccc(NS(=O)(=O)C(C)C)c(F)c1	749772992	VLAPYMLFHKJOSD-UHFFFAOYSA-N	445.494	1.608	50	20	IDGD	
O=C(CCN1C(=O)NC2(CCCC2)C1=O)NNc1nc(Br)cn2ccnc12	750244169	XWXNZTZGSNADAQ-UHFFFAOYSA-N	436.270	1.190	50	20	IDGD	
COC(=O)c1ccc(S(=O)(=O)NNC(=O)c2nnc(-c3ccccc3)o2)c(Cl)c1	751269829	FVPWLHRYUXAJNI-UHFFFAOYSA-N	436.833	1.800	50	20	IDGD	
CC(=O)N1CCC[C@H](C(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)C1	754801903	DKNFWPIMKOBGGQ-FQEVSTJZSA-N	447.499	1.408	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)Nc1ncc(Cc2cc(F)cc(F)c2)s1	755480217	UDPPVOJOCPKKOK-JTQLQIEISA-N	430.458	1.600	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)Nc1ccc(CC(=O)N2CCOCC2)cc1	755862106	MVKBPWBAMJLOBA-UHFFFAOYSA-N	426.473	1.492	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2nnc(C(F)F)s2)cc1	756219287	FYZDTBRYSNODTI-UHFFFAOYSA-N	434.450	1.258	50	20	IDGD	
CCN1CCN(C(=O)c2ccc(NC(=O)NNC(=O)Cc3ccccc3OC)cc2)CC1	756253134	PEUIFMRIBJAYMU-UHFFFAOYSA-N	439.516	1.868	50	20	IDGD	
C#CCOc1cccc(NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)c1	756479201	JAJSZLUQPNICKG-UHFFFAOYSA-N	430.486	1.480	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1cccc(CSC2CCOCC2)c1	756605833	UVUHMGWWGGJNCI-GFCCVEGCSA-N	430.552	1.189	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)[C@](C)(O)CN3Cc4ccccc4C3=O)n[nH]2)cc1	756878292	GXANLHCZTNGIEQ-XMMPIXPASA-N	447.495	1.807	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N2CCO[C@@H]([C@@H]3CCCO3)C2)cc1Br	756937630	YEOWSOOZLNYZAX-LSDHHAIUSA-N	428.283	1.692	50	20	IDGD	
COC(=O)CCSc1cccc(NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c1	757776783	QUWASAFVCQRSIK-UHFFFAOYSA-N	441.473	1.784	50	20	IDGD	
CS(=O)(=O)CCn1cccc(NC(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)c1=O	757780951	ODDZRRLKWPFJGK-UHFFFAOYSA-N	436.534	1.262	50	20	IDGD	
CC(C)Cn1cnc2c1c(=O)n(CC(=O)NN=C[C@@H]1C[C@@H]1C)c(=O)n2Cc1ccccc1	758366657	SBHSZHJINJXKSX-WMZOPIPTSA-N	436.516	1.822	50	20	IDGD	
COc1ccc(CN2CCC(CNC(=O)NNC(=O)C(=O)Nc3ccccn3)CC2)cc1	758726625	REZOCXJCFYOUDN-UHFFFAOYSA-N	440.504	1.271	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)NC[C@H]1CN(Cc2ccccc2)CCCO1	758851198	BGNWYFPEYKYINN-IBGZPJMESA-N	436.516	1.878	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)N=c2cc[nH]cc2I)cc1C	760029942	QBUIZUSNAMXQRC-UHFFFAOYSA-N	440.241	1.957	50	20	IDGD	
Cc1nc2ccnn2c(C)c1C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	762002528	CTTNZVQWZOCLTD-UHFFFAOYSA-N	443.533	1.039	50	20	IDGD	
CCn1c(O)nc2cc(C(=O)NNC(=O)CSc3ccccc3OC)ccc2c1=O	762351371	VVRZSFKWHXVSEE-UHFFFAOYSA-N	428.470	1.684	50	20	IDGD	
CC[C@H](Nc1c([N+](=O)[O-])c(C)nn1C)C(=O)NNC(=O)CSc1ccccc1OC	762360525	DVTBLDZIOOVFJO-LBPRGKRZSA-N	436.494	1.776	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNS(=O)(=O)c1ccc2c(c1)CCCC(=O)N2	763439956	ZBLBXWYTNKTQKN-UHFFFAOYSA-N	440.522	1.576	50	20	IDGD	
O=C(NNC(=O)c1c[nH]c2ccccc12)C(=O)Nc1ccc(=O)n(Cc2ccccc2)c1	763535393	SDZQBHFFSVYVNF-UHFFFAOYSA-N	429.436	1.778	50	20	IDGD	
Cc1noc(COc2ccc(NC(=O)C(=O)NNC(=O)c3ccc4c(c3)OCO4)cc2)n1	763548624	OJDNICDHNGCWDR-UHFFFAOYSA-N	439.384	1.085	50	20	IDGD	
Cc1cc(C(=O)NCC(C)C)ccc1NC(=O)C(=O)NNC(=O)c1ccc2c(c1)OCO2	763551420	NUAHTACLAAAUIA-UHFFFAOYSA-N	440.456	1.509	50	20	IDGD	
N#CCCSc1ccccc1NC(=O)C(=O)NNC(=O)[C@H]1COc2ccccc2O1	763575400	TYYVKTYVJXYDLF-MRXNPFEDSA-N	426.454	1.618	50	20	IDGD	
COC(=O)[C@@H](C)Cc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)cc1	763695797	XJGUHFBZLCWYGL-ZDUSSCGKSA-N	447.875	1.857	50	20	IDGD	
CN(C)CCOc1cccc(NC(=O)C(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)c1	763723971	UQMPAVFDZATSTN-UHFFFAOYSA-N	428.533	1.929	50	20	IDGD	
O=C(CC12CC3CC(CC(C3)C1)C2)NNC(=O)C(=O)Nc1cnn(C[C@@H]2CCCO2)c1	763736951	NJBSHTYHONFVQQ-CONPEVPGSA-N	429.521	1.755	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cccc(Br)n2)cc1OC	763775624	IRTYVWSKSFNLOQ-UHFFFAOYSA-N	438.234	1.479	50	20	IDGD	
CCOC(=O)c1c(F)cccc1NC(=O)C(=O)NNC(=O)COc1ccccc1C#N	763812891	JBHXLLNVRXYHFG-UHFFFAOYSA-N	428.376	1.039	50	20	IDGD	
C[C@@H](c1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)cc1)N1CCOCC1	763838391	UCELDRZPGQQOCK-HNNXBMFYSA-N	444.463	1.384	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ncn(Cc3ccccc3)n2)c1C	763851099	QPNLBITUFXJTMF-INIZCTEOSA-N	436.472	1.497	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ncn(C3CCCCC3)n2)c1C	763851319	SAABAESEQVBZOK-HNNXBMFYSA-N	428.493	1.954	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc([S@@](C)=O)c(F)c2)cc1	763873014	REXHVEFPKMIKID-ZDUYTPDQSA-N	449.460	1.319	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cnn(-c3ccccn3)c2)ccc1OC(C)C	763916606	PNZOMXGLVMSPJO-UHFFFAOYSA-N	438.444	1.463	50	20	IDGD	
Cn1cccc(NC(=O)C(=O)NNC(=O)c2ccc(Br)cc2Cl)c1=O	764058201	MLTXJBLBEGAJBU-UHFFFAOYSA-N	427.642	1.201	50	20	IDGD	
O=C(NNC(=O)c1cccc(Br)c1)C(=O)Nc1cccc(N2CCOC2=O)c1	764063231	LPGRZSOKRAFSHP-UHFFFAOYSA-N	447.245	1.805	50	20	IDGD	
C[C@H]1C[C@H](C)CN(C(=O)c2ccccc2NC(=O)C(=O)NNC(=O)Cc2cccnc2)C1	764268635	OBMZJLWXFIJECC-HOTGVXAUSA-N	437.500	1.528	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cc(Br)ccc2O)n(C(C)(C)C)n1	764281028	VZYXQEJRNZZQJZ-UHFFFAOYSA-N	438.282	1.814	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(OC)c(Br)c2)c(C)n1	764326484	KGSSRVPQROTIDF-UHFFFAOYSA-N	437.250	1.569	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)C(=O)Nc1ccc(C)cc1OCC(=O)N(C)C)c1ccccc1	764330733	XAVYBBTUSXPAAF-QGZVFWFLSA-N	440.500	1.742	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H]1CCc2ncc(NC(=O)C(=O)NNC(=O)C3CCC3)cc2C1	764334649	IBJJHABAPNUWET-AWEZNQCLSA-N	431.493	1.350	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)CN(Cc1ccco1)c1cccc(Cl)c1	764345797	WFUMKQSVCIFABO-UHFFFAOYSA-N	441.875	1.912	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)NC2(c3ncon3)CCOCC2)N(C)c2ccccc21	764367335	VCWYVLFGAWZLEU-UHFFFAOYSA-N	436.472	1.862	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2cccc(-n3ccnc3)c2)n[nH]1	764378252	WYKBAVNBFDQPKD-UHFFFAOYSA-N	445.439	1.671	50	20	IDGD	
C=CCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)cc1	764380391	ZANFXUAMIDFMCM-UHFFFAOYSA-N	432.383	1.360	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)c1ccc(Cl)c(S(C)(=O)=O)c1	765316965	GBRCQYWGCPYNCR-UHFFFAOYSA-N	433.914	1.809	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NN=Cc3c(C)nc4sc(C)nn34)CC2)cc1	765581764	ADEMZSJKAKCFPI-UHFFFAOYSA-N	425.562	1.984	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)Cc3ccc(-n4cnnn4)cc3)n[nH]2)cc1OC	765597593	UTMJUQLDSSGHPT-UHFFFAOYSA-N	448.443	1.073	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1csc2c1CCCC2	765738085	IFMIKARKHHMFTQ-UHFFFAOYSA-N	426.542	1.846	50	20	IDGD	
CCCn1nc(C(=O)NNS(=O)(=O)c2ccc(C#N)cc2OC)c2ccccc2c1=O	766355642	ZFTXZIGELXMNJL-UHFFFAOYSA-N	441.469	1.310	50	20	IDGD	
Cc1ccc([N+](=O)[O-])c(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)c1	766636768	URHAUIGCDJDVDD-UHFFFAOYSA-N	425.445	1.122	50	20	IDGD	
Cc1onc(-c2ccccc2)c1C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	766640738	FPOIAXQZQWFHJF-UHFFFAOYSA-N	447.495	1.869	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)[C@H]2C[C@@H]2c2cc(F)c(F)c(F)c2)n1	766781344	OKNBRRPQDHGXEJ-MNOVXSKESA-N	427.404	1.906	50	20	IDGD	
Cc1cc(S(=O)(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc([N+](=O)[O-])c1F	768266490	DESNQBIECMBNKL-UHFFFAOYSA-N	431.423	1.069	50	20	IDGD	
Cc1c(Br)cc(C(=O)OCC(=O)NNC(=O)c2cccs2)c(=O)n1C	768941746	NYHSVYAGCVQEFR-UHFFFAOYSA-N	428.264	1.136	50	20	IDGD	
Cc1cnn(Cc2ccccc2F)c1NC(=O)C(=O)NNC(=O)Cc1ccccc1F	769264716	GCKDWDZAWIMTLA-UHFFFAOYSA-N	427.411	1.847	50	20	IDGD	
CC(=O)c1cccc(OCc2cc(C(=O)NNC(=O)CNC(=O)c3cccs3)no2)c1	770718288	IYWCNDANWSWHHK-UHFFFAOYSA-N	442.453	1.709	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2ccc(OC(F)F)cn2)cc1	771861459	YNJNVBJMMUTALK-UHFFFAOYSA-N	428.417	1.073	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)ncc1Br	773526671	ARODDQXMXUALTD-UHFFFAOYSA-N	435.234	1.323	50	20	IDGD	
O=C(NNc1cnc2ccccc2n1)C(=O)Nc1ccc(S(=O)(=O)N2CCCC2)cc1	773716725	OFARFCIACLDDLM-UHFFFAOYSA-N	440.485	1.496	50	20	IDGD	
Cc1cc2ccccc2nc1NNC(=O)c1cc(S(N)(=O)=O)ccc1N1CCOCC1	777476927	VBBQRVGTXVCOOM-UHFFFAOYSA-N	441.513	1.784	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)/C=C\C(=O)Nc2ccc3n[nH]cc3c2)c2ccccc2c1=O	778526859	BVSQZNNLOOHPMY-KTKRTIGZSA-N	445.439	1.249	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)/C=C/c3ccc(O)c(O)c3)cc2)CC1	779535876	FSHXDHAZPXPWGQ-YCRREMRBSA-N	432.502	1.190	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1	780795799	RXJBDKVHFDAWFI-UHFFFAOYSA-N	447.513	1.570	50	20	IDGD	
Cn1nc(Br)cc1C=NNC(=O)CN1c2cccc3cccc(c23)S1(=O)=O	782171377	XDGYNFUFYMWJNO-UHFFFAOYSA-N	448.302	1.995	50	20	IDGD	
O=C(NNC(=O)C(=O)NC1CC1)C(=O)Nc1ccccc1SC[C@@H]1CC1(Cl)Cl	782965936	JVOPPLQXTBBBOX-VIFPVBQESA-N	445.328	1.337	50	20	IDGD	
O=C(NNc1cncc(Cl)n1)C(=O)Nc1ccn(-c2ncccc2C(F)(F)F)n1	783259357	BSXMICNQXISFMJ-UHFFFAOYSA-N	426.746	1.811	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ccc(-n3cccn3)nn2)c(-c2nc(C3CC3)no2)c1	783433157	LRCGJAJLIWFNOR-UHFFFAOYSA-N	445.443	1.980	50	20	IDGD	
O=C(NNc1ccc(-n2cccn2)nn1)C(=O)Nc1cccc(OCc2cccnc2)c1	783435934	CXTQHJGKFXKJAC-UHFFFAOYSA-N	430.428	1.718	50	20	IDGD	
O=C(NNc1cccc([N+](=O)[O-])c1)C(=O)Nc1cccc(S(=O)(=O)N2CCCC2)c1	784829548	UBHIJNUZRFCPQK-UHFFFAOYSA-N	433.446	1.461	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)C(=O)Nc2ccc(-c3n[nH]c(C4CC4)n3)cc2)c1	784840656	DACZIYHYROCSKZ-UHFFFAOYSA-N	440.485	1.834	50	20	IDGD	
COc1cccc(NNC(=O)C(=O)Nc2ccc(C(=O)N3CCSCC3)cc2C)n1	784843269	KBNKZZZWJVKEPH-UHFFFAOYSA-N	429.502	1.669	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)c(OC)cc1Cl	785060659	JCLRNCNAWBXUKP-UHFFFAOYSA-N	431.836	1.334	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)C(=O)N1CCc2c1cccc2C(F)(F)F	785060752	LHWNJJLBGQXMQL-UHFFFAOYSA-N	431.374	1.632	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1cccc(NC(=O)C2CC2)c1	785331270	RLLMBFWELQGNTQ-UHFFFAOYSA-N	446.485	1.529	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNS(=O)(=O)c1ccc(C(=O)OC)cc1OC	785480231	FEIGLMLPKRTULQ-UHFFFAOYSA-N	438.458	1.269	50	20	IDGD	
Cn1cc(-c2ncccc2NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)cn1	786413518	BACOBKQBAVAYCW-UHFFFAOYSA-N	430.428	1.272	50	20	IDGD	
C[C@@H](OC(=O)/C(C#N)=C/C1CC1)C(=O)Nc1cccc(S(=O)(=O)N2CCOCC2)c1	786679123	WYFASRYWMIRRSM-DSQDWWTGSA-N	433.486	1.438	50	20	IDGD	
O=C(Cc1ccccc1CO)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	786829402	QSZZSYRXDAUUTH-UHFFFAOYSA-N	442.479	1.884	50	20	IDGD	
CC(C)OCCCn1c(NNC(=O)[C@@H]2CCC[C@H](C(N)=O)C2)nc2ccccc2c1=O	786979246	KNAFUCVKSGZTEP-JKSUJKDBSA-N	429.521	1.946	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ccnc(F)c2)cc1S(=O)(=O)N1CCCC1	787563322	YLFRBQQCASMWOZ-UHFFFAOYSA-N	437.453	1.096	50	20	IDGD	
COC(=O)NCCc1ccc(S(=O)(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)s1	788049436	YUTNYTWFVOAPCU-UHFFFAOYSA-N	428.448	1.178	50	20	IDGD	
NS(=O)(=O)c1cccc2c(C(=O)NNc3nnc(-c4ccccn4)s3)nccc12	788566565	DVLDRYUERVMSAB-UHFFFAOYSA-N	427.471	1.553	50	20	IDGD	
COc1cncc(C(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)n1	790111271	CLVRHILNTYBMFQ-UHFFFAOYSA-N	430.424	1.318	50	20	IDGD	
Cc1ccn(C[C@](C)(O)C(=O)NNC(=O)[C@H](C)Oc2c(C)cc(Cl)cc2C)c(=O)c1	790483078	IBMNRBDZMKYPPO-BTYIYWSLSA-N	435.908	1.793	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(CCC(=O)NNC(=O)Cc2c[nH]c3ccccc23)CC1	792024302	ZBEZZLAWXODUTB-UHFFFAOYSA-N	429.521	1.801	50	20	IDGD	
CC[C@@H](C)n1ncc(NC(=O)C(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)c1C	792264580	TVPSJTCEKQBGBX-LLVKDONJSA-N	433.465	1.588	50	20	IDGD	
CC(C)Cc1ncc(NC(=O)C(=O)NNC(=O)COc2cccc(C(F)(F)F)c2)cn1	792352731	HYGWXEKARBJWHJ-UHFFFAOYSA-N	439.394	1.859	50	20	IDGD	
CC(=O)NC[C@H]1CCn2ncc(C(=O)NNC(=O)c3ccc(Br)s3)c2C1	792736290	ITOHJJLIRUGVAB-JTQLQIEISA-N	440.323	1.480	50	20	IDGD	
CC[C@H](C)[C@@H](OC)C(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	792789080	HUPHPOPHINZNHI-HNAYVOBHSA-N	433.530	1.987	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)C(=O)Nc3cnc(CC4CC4)nc3)n[nH]2)c1	793050048	LOYGEJSUOANPHO-UHFFFAOYSA-N	433.472	1.836	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)N2CCN(S(=O)(=O)c3cccc(Cl)c3)CC2)n1	793227442	SWXBHSOWKFWLMS-UHFFFAOYSA-N	437.909	1.404	50	20	IDGD	
COc1cccc(C2(C(=O)NNC(=O)c3ccc(S(=O)(=O)N4CCCC4)cc3)CC2)c1	794776623	ZXERCXLHMXGHPG-UHFFFAOYSA-N	443.525	1.973	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@H]2CN(C(=O)NNC(=O)CNC(=O)c3cccs3)C[C@@H]2C1	796535347	ZQRJXJRNTFOJND-BETUJISGSA-N	437.522	1.017	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2cc3c(cc2Br)OCCO3)n1	797370534	OKZCLLZKDNKDAY-UHFFFAOYSA-N	435.234	1.323	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)NCC(=O)NN=c2sc3ccccc3n2C)cc1	798304127	MSZUVKYCPAPCPQ-UHFFFAOYSA-N	433.515	1.109	50	20	IDGD	
COc1ccccc1-n1ncc(C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)c1C	798794523	RBDWCKINOYOVOV-UHFFFAOYSA-N	433.424	1.679	50	20	IDGD	
Cc1ccc(-c2ccnn2C)cc1NC(=O)C(=O)NNC(=O)[C@H]1COc2ccccc2O1	799257725	RANRZRLJCBKEIH-LJQANCHMSA-N	435.440	1.321	50	20	IDGD	
COC(=O)c1cc(C=NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)n(C)c1C	800806839	IBVNDHRHXJZAFS-UHFFFAOYSA-N	432.502	1.669	50	20	IDGD	
CN(C)S(=O)(=O)C[C@@H](NC(=O)NNC(=O)Cc1ccc2ccccc2c1)C(F)(F)F	805769097	JTXWIOUPZJXKIF-OAHLLOKOSA-N	446.451	1.535	50	20	IDGD	
CCCCNS(=O)(=O)c1cccc(NC(=O)NNc2ccc(-n3ccnc3)nn2)c1	806171827	YMTWQHMKXCPZRJ-UHFFFAOYSA-N	430.494	1.889	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)Nc1ccccc1S(=O)(=O)N1CCCCC1	806246776	YBDKSACFAZPSCU-UHFFFAOYSA-N	442.505	1.986	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)Nc1cccc2cc(Br)cnc12	806562206	FABXSWNAYVALRT-JTQLQIEISA-N	427.280	1.585	50	20	IDGD	
COCCCOc1ccc(CNC(=O)NNC(=O)c2nnc(O)c3ccccc23)cc1	807428221	ZUPCOYIZSCCOOW-UHFFFAOYSA-N	425.445	1.895	50	20	IDGD	
CN(CCn1cc(Br)cn1)C(=O)NNC(=O)c1cc(Br)c[nH]1	808188796	XWZSWPSHVXZFQE-UHFFFAOYSA-N	434.092	1.723	50	20	IDGD	
Cc1nc(-c2cccc(NC(=O)C(=O)NNc3ccc(S(=O)(=O)N(C)C)cc3)c2)no1	813033658	FDYRGYWQSJWUHL-UHFFFAOYSA-N	444.473	1.377	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccc(N3CCCC3=O)cc2)cc1	813033842	NWSYNOPXUHBAHM-UHFFFAOYSA-N	445.501	1.146	50	20	IDGD	
CC(=NNC(=O)CSc1nnc(O)nc1O)c1nnn(-c2cccc(Cl)c2)c1C	814785052	XRBHOHWTYFGJSR-UHFFFAOYSA-N	434.869	1.458	50	20	IDGD	
Cc1nnc(NNC(=O)c2ccc(Cl)c(S(=O)(=O)N3CCC[C@@H](C)C3)c2)nc1O	817276899	SSBSCUXPKPGAGT-SNVBAGLBSA-N	440.913	1.717	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCCN(Cc3ccc(F)cc3)CC2)cc1OC	841412179	YDLIRDGCAGSZCL-UHFFFAOYSA-N	444.507	1.812	50	20	IDGD	
CS(=O)(=O)CC[C@@H](Cc1cccc(Br)c1)C(=O)N1CC[C@H](B(O)O)C1	864234878	XUGOGIJTAPQHMK-KBPBESRZSA-N	432.145	1.118	50	20	IDGD	
Nc1nc(Cl)c(C=NNC(=O)COc2ccc(Cl)cc2)c(N2CCOCC2)n1	873986376	DGLHTAFRFWWERM-UHFFFAOYSA-N	425.276	1.731	50	20	IDGD	
O=C(COC(=O)C1(c2cccc(F)c2)CCC1)NNC(=O)[C@@H]1COc2ccccc2O1	875614387	QVMABJXGMQVJAZ-SFHVURJKSA-N	428.416	1.778	50	20	IDGD	
COc1ccc(S(=O)(=O)N[C@H](C)C(=O)NNC(=O)CSc2ccc(C)cc2)cc1	913033447	QRIQSLNMSVUYES-CQSZACIVSA-N	437.543	1.610	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(/C#N)C(=O)O[C@@H](C)C(=O)N2CCC(C(N)=O)CC2)c1C	913150538	WWTBYVVQDDUZID-SFTHAYLZSA-N	444.532	1.875	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)c1sccc1-n1cnnn1	916140129	BSEZRNSZZFDEQF-SECBINFHSA-N	437.279	1.715	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)NCc2nnc3ccc(C(F)(F)F)cn23)nc2ccccc21	916222398	BXXYZNKNDNBGPJ-UHFFFAOYSA-N	446.393	1.708	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NN=C(C)c1ccc[nH]1)N(S(C)(=O)=O)CC2	916355780	MHXKTVFMCCJEAE-QGZVFWFLSA-N	434.518	1.821	50	20	IDGD	
C[C@@H](Cn1cccn1)NC(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	916462484	BMFKRYOCSRSEHQ-INIZCTEOSA-N	445.483	1.674	50	20	IDGD	
CC(=NNC(=O)Cn1nc(C)cc1C)c1ccc(S(=O)(=O)N(C)CCCC(=O)O)cc1	916542685	VIDJQDXXOAUSBX-UHFFFAOYSA-N	449.533	1.526	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CCC(=O)c2ccc3c(c2)OCCO3)cc1C	916562427	QORONAIFUUHMMS-UHFFFAOYSA-N	425.441	1.824	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)N[C@H]1CCCc2occc21	916576036	FFFCTVBFKMGJKP-KRWDZBQOSA-N	448.501	1.322	50	20	IDGD	
O=C(NCCCS(=O)(=O)Cc1ccccc1)NNC(=O)c1cc(Br)c[nH]1	916577164	MNCAFBPZJIKXTJ-UHFFFAOYSA-N	443.323	1.726	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(CN3CCCCC3)o2)c1	916628390	MIGMKDGSKWROIB-UHFFFAOYSA-N	434.518	1.591	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@H](C)c2ccc(C#N)cc2)cc1	916633128	KJKARHUOYLYVAK-OAHLLOKOSA-N	429.502	1.579	50	20	IDGD	
CC(C)CS(=O)(=O)CCC(=O)NNC(=O)c1ccc(CSc2nncn2C)cc1	917021892	YUECLGJMHBGUIP-UHFFFAOYSA-N	439.563	1.329	50	20	IDGD	
C[C@@H](NC(=O)NNc1ccc(-n2cccn2)nn1)c1ccc(S(=O)(=O)N(C)C)cc1	918106026	VUGYAXOEIHQHEH-CYBMUJFWSA-N	430.494	1.300	50	20	IDGD	
COc1c(F)cc(CC(=O)NNc2ccc(Br)cc2)cc1S(N)(=O)=O	918319815	ASIZQZBWMLBGQB-UHFFFAOYSA-N	432.271	1.930	50	20	IDGD	
C[C@H]1CN(Cc2ccc(C(=O)OCC(=O)NNC(=O)c3cccs3)cc2)C[C@@H](C)O1	919269370	XVCKJQXPOGXIMS-GASCZTMLSA-N	431.514	1.975	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)Nc1cccc(CN2C(=O)CNC2=O)c1	920934081	AAQLPQCEQSUOBA-UHFFFAOYSA-N	431.836	1.867	50	20	IDGD	
Cc1ncc(Br)c(C(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)n1	1320860460	SVKAWIUCBXOWPP-UHFFFAOYSA-N	442.314	1.956	50	20	IDGD	
N#Cc1ccc(N2CCC[C@@H](NC(=O)NNC(=O)c3cncn3-c3ccccc3)C2=O)cc1	1342037950	SSDGLCKHOPHVMO-LJQANCHMSA-N	443.467	1.884	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(Cl)Cl)C2)c1cn2cccnc2n1	1778988451	DWWTXDBJMCKMEK-FZKQIMNGSA-N	426.304	1.661	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1nc[nH]c1[N+](=O)[O-])C2)[C@H](F)Br	1780773231	HSWWJXLGLZZPRF-BPYAMOTFSA-N	448.249	1.136	50	20	IDGD	
CCc1cc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](F)Br)C2)n(C)n1	1780773970	QLTFJDPDMZDNSO-RVKKMQEKSA-N	445.333	1.801	50	20	IDGD	
O=C(/C=C\C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Br)C1)NC1CC1	1780774785	MMIJMYAQVKEYOK-MDWWKSDDSA-N	446.317	1.026	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)Cn3nnc4ccccc43)CCO2)C1	1781224703	NFLHHUGFHIGDMG-RTBURBONSA-N	440.331	1.498	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)c3[nH]nc4ccncc34)CCO2)C1	1781228185	YYEQMOCEDPEANC-ZWKOTPCHSA-N	426.304	1.638	50	20	IDGD	
Cc1cc(C)n(CCC(=O)N2CCO[C@@]3(CCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)n1	1781233873	OCTPISGOBBMUPF-OALUTQOASA-N	431.364	1.956	50	20	IDGD	
O=C(/C=C/c1ccc([N+](=O)[O-])o1)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781325778	QVZAKVYUJYTCQP-HCYPVFRNSA-N	446.229	1.721	50	20	IDGD	
O=C(c1cnc2ccccc2n1)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781329963	OSWWUDLEQNFCCQ-MAUKXSAKSA-N	437.269	1.764	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1cnccn1)C2	1781897806	QCLGTNZWOFDGQF-FRQCXROJSA-N	439.354	1.707	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc3ncccn3n1)C2	1782175115	FEVBXITXJXETQO-YYFZDKIDSA-N	435.912	1.111	50	20	IDGD	
CN1CCCn2nc(C(=O)N3CC[C@]4(C3)CN(C(=O)C(C)(C)CCl)CCO4)cc2C1	1782558431	JJYSWLZQTQBJNP-NRFANRHFSA-N	437.972	1.427	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CC2(O)CCC2)C1	1782783145	YFDRVBKPSRFKSS-IIDMSEBBSA-N	431.371	1.979	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)Cc3ccccc3O)C2)C1	1783231144	YAOLBZUXPFFYKB-LIRRHRJNSA-N	425.323	1.796	50	20	IDGD	
CCCNC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](Br)CC)C2)C1	1783344280	SERAFESSQABEQP-KDOFPFPSSA-N	432.359	1.296	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cc(O)nc(Cl)c3)CCO2)C1	1783532358	MMGHISDYLLTVPR-QLJPJBMISA-N	432.702	1.668	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](C)Nc1nccs1)CCO2	1783534999	UYAUYSIVDSWUIK-OZVIIMIRSA-N	431.356	1.557	50	20	IDGD	
CC(C)[C@H](C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2)c1ccc(F)cc1	1783732377	XDKXMQLHWWIPIA-BBTUJRGHSA-N	426.916	1.995	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(Cl)ncn3)C[C@@H]21	1783970321	RTBWEFFLMGLERE-UHXUPSOCSA-N	445.745	1.754	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(C)(C)C(C)(F)F)[C@H]2C1	1784639032	XTEVRNKWCXKQLH-KKUMJFAQSA-N	432.512	1.021	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccnc(F)c3)[C@H]2C1	1784739985	ZWRZXOHJCCQOPL-XQLPTFJDSA-N	428.302	1.988	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C[C@@H]3CCCCO3)[C@H]2C1	1784957198	KBFYGNPVUVDLKC-XAJHFOFHSA-N	431.371	1.956	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnn(-c4cccnc4)c3)[C@H]2C1	1785731385	MZAJCESQJJJPNL-FZDIXFNVSA-N	447.923	1.114	50	20	IDGD	
CC(C)(NCCC#N)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCBr)[C@H]2C1	1786405815	CUQOAXRVUALACA-KKUMJFAQSA-N	429.359	1.033	50	20	IDGD	
CC(=O)O[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)CBr)C[C@@H]21)C(C)C	1788477291	QQSZIQFDQCDPLB-YYESSZKYSA-N	447.370	1.585	50	20	IDGD	
CN(C)c1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCBr)C[C@@H]32)cn1	1789025577	FUMKVEUVXPVLSA-JYJNAYRXSA-N	439.354	1.526	50	20	IDGD	
Cc1cnn([C@@H](C)C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]3C2)c1	1789872485	GICACCYMNHNKMK-GMHRPJKWSA-N	431.364	1.969	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(F)nc3)C[C@@H]21	1790960755	ROHSYRYZHRUPAV-AJNGGQMLSA-N	428.302	1.988	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C=C/c3cccc(OC)c3)[C@H]2C1	1791001710	ZETJHSPVUQWAHP-FSIFMMIXSA-N	436.936	1.942	50	20	IDGD	
Cc1ccc2c(/C=C/C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@H](O)CCl)c[nH]c2c1	1792983549	OHAWDRQKELWQFW-IBZOKRPOSA-N	431.920	1.679	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCl)[C@H]1CN(Cc2ccccc2)CCO1	1793111293	BOELJCDAHSMPJU-LJDSDSDDSA-N	435.952	1.125	50	20	IDGD	
CS(=O)(=O)c1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](O)CCl)cc1F	1793117832	GVAFYQNIVZMTDQ-XFMPKHEZSA-N	432.901	1.081	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCNC(=O)c1ccc[nH]1	1794308906	KIUORPIELNNCDY-XGUBFFRZSA-N	439.354	1.946	50	20	IDGD	
CCc1[nH]nc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)CBr)C3)c1F	1794512123	BBWRZCAXGNZXKL-NJBDSQKTSA-N	431.306	1.345	50	20	IDGD	
Cc1ccc2nc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3cccc(B(O)O)c3)sc2c1	1796190746	HEQMRQCGWYMDQW-BCDXTJNWSA-N	449.341	1.850	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)c1ccc(OC(F)F)cc1	1796191775	VVSLEOWBDVJIFV-BCDXTJNWSA-N	444.243	1.533	50	20	IDGD	
CC[C@H](CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Cl)NC(=O)OC(C)(C)C	1796367736	RTSZQDHUVOHZCO-STGWMILLSA-N	435.924	1.804	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2)c1cc(Br)ncc1F	1796620908	AMGLKHIOMRFTRI-PTYMLPSESA-N	438.656	1.721	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1csc(N)n1)C2	1796892140	KSGFBICSGLNBCK-PNEZKNQNSA-N	429.506	1.111	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](O)[C@@H](C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](F)Cl)C3)C1	1797684038	MLWREEXVTNFBEH-KARBZBNUSA-N	447.935	1.777	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NO[C@@H](c2ccccc2)C1)c1ccc(B(O)O)cc1	1797752179	UGVAAPUPKKQCRY-XAPVIXHLSA-N	447.300	1.136	50	20	IDGD	
COc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Br)c(F)c1	1799348178	BKYAWEQXLYEUGR-ANGCBRKESA-N	433.249	1.728	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)CN(CC)CC	1800225962	LOBQAKNOQYMMSW-UHDSXZAQSA-N	432.403	1.727	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C#CC1(O)CCCCC1)C2	1800758987	BPIMDGFBNRVDPL-MPTYRVRUSA-N	427.339	1.058	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CS[C@H]1CCCCO1)C2	1800759204	KSXULLXIBPQGKO-XYTFPVCRSA-N	435.384	1.619	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H]1[C@@H](O)CCN1Cc1ccccc1)C2	1802283936	JHDSJXKKSURLOL-ZPLOVTKXSA-N	449.979	1.514	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cc(Cl)cnc2O)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803138124	XIDHSCZLDGKHCR-VBNZEHGJSA-N	439.299	1.755	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2ccc(F)s2)[C@H]1c1cccnc1	1804736368	JETRUYPJNYHMFO-MGPUTAFESA-N	447.536	1.975	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1cccs1	1805385714	UUDDNBIKWFEOFB-PXNSSMCTSA-N	435.314	1.456	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCCC2(CCN(C(=O)c3cc4n(n3)CCNC4=O)CC2)C1	1806156316	QBIILQXZUYHNOS-OAHLLOKOSA-N	435.956	1.879	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)C2CC(F)(F)C2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807360158	OREOTJPPYUASOC-VQIMIIECSA-N	443.259	1.126	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)c1nc2ccccn2n1	1807928238	HTRGCSKZFSETJJ-UXLLHSPISA-N	428.880	1.044	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)C3CCSCC3)CC2)C1	1809978321	PLSLBYXBGVWLQJ-UHFFFAOYSA-N	430.379	1.354	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)[C@H](OC(C)=O)C(C)C)[C@@H]1c1cccnc1	1813030867	GUVRACFYCSVNHS-INDMIFKZSA-N	439.940	1.929	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@H]1CCc2nc(NC(=O)CN3CCOCC3)sc2C1	1814567304	TXKWMNOCCBUKHU-ZDUSSCGKSA-N	426.615	1.239	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)C(F)(F)C(F)(F)C(=O)O)[nH]n1)[C@H](O)CCl	1814867558	NICBXWXUZLWKGF-RKDXNWHRSA-N	444.769	1.357	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](O)CCl)n[nH]1	1814871228	LFYGNVTVMFJYQV-IJLMDXODSA-N	449.899	1.136	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CC[C@H](N)C(N)=O)n[nH]1	1817359975	SNAKHXZXEXVWGD-BFCNOCSMSA-N	433.340	1.231	50	20	IDGD	
Cc1cnc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)s1	1817470883	KMSJEOFEKFWZIT-MRXNPFEDSA-N	439.306	1.474	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc(F)cn2)[nH]n1)c1cccc(B(O)O)c1	1817473466	VMDXQQSVIIBPLY-GOSISDBHSA-N	437.240	1.243	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1)[C@H]1Cc2ccccc2CN1	1818045280	VCJXRMOOJWPYLG-FGTMMUONSA-N	431.924	1.716	50	20	IDGD	
Cc1cc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)cn1C	1818302536	IBBQSNOLROPRHX-QGZVFWFLSA-N	429.525	1.736	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1)c1cnc2snnc2c1	1820150774	PSGFQAPCCCNZMA-OLZOCXBDSA-N	435.897	1.715	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@H]1CCc2nc(NC(=O)c3ccc[nH]3)sc2C1	1820279925	RJTGYCJDFZWMIJ-ZVYABZQBSA-N	439.501	1.831	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1ccoc1Cl	1820390687	KAWAKQASMQDXJQ-MRXNPFEDSA-N	442.668	1.956	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(O)ccc2O)n[nH]1	1821320293	YOTDKWWCLMOOOD-INIZCTEOSA-N	444.492	1.500	50	20	IDGD	
CC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](O)NC(=O)OC(C)(C)C)CC2	1822856044	SIADDAGGXUNYSG-FTGAXOIBSA-N	446.957	1.916	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnn3ccncc13)CC2	1826000639	ZFQKKUFOOFVQPE-ZYHUDNBSSA-N	434.909	1.665	50	20	IDGD	
CCc1cc(C(=O)N[C@@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)nn1C	1826088143	SLQKXZFBXMDAFG-GFCCVEGCSA-N	447.565	1.038	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccon2)CC1	1826147234	BQZMQISXGONQET-SFHVURJKSA-N	426.477	1.220	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827055947	PEZDDEYVEBERBK-LJQANCHMSA-N	434.773	1.865	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc(OCF)cn3)C2)C1	1830357996	JRKLFAMQPPFWRI-IBGZPJMESA-N	444.891	1.117	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3Cc4ccccc4N3)C2)C1	1830366736	VFWCZNBRQKWGAR-PGRDOPGGSA-N	435.952	1.745	50	20	IDGD	
O=C(CCCCCCCCCCCl)N1CCOC[C@@]2(C1)CN(C(=O)C(O)O)CCO2	1830401265	QNKGUWMIRIDJQF-OAQYLSRUSA-N	448.988	1.503	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3ccc[nH]3)C2)C1	1830538712	NOCMTNSRBAUNIG-DNVCBOLYSA-N	442.354	1.435	50	20	IDGD	
CC(C)[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1)c1ccccc1	1830838402	QFIOTHSDNHWSKD-XQBPLPMBSA-N	438.952	1.482	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc(OC)c(F)c3)C2)C1	1831644218	RNXCNPVJWYLWLZ-MGPUTAFESA-N	443.903	1.707	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H]2[C@H]3C=CS[C@H]32)CC1	1831874572	KIBKVHSDCKIKPO-DEPWHIHDSA-N	434.606	1.854	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)C(Cl)Cl)CC1	1831879079	SPACTOIQKOUNGS-MRXNPFEDSA-N	427.137	1.403	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)C3CC(O)C3)CC2)CC1	1833274997	UZRNBIUUCSPRIA-CBCUQQMYSA-N	430.387	1.360	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cc4cnccc4[nH]3)CC2)CC1)[C@H](O)CCl	1833310748	ZQHGPJPNLNMQGO-LJQANCHMSA-N	433.940	1.348	50	20	IDGD	
CN1CCCC[C@H]1C(=O)NC1CCN(C2CCN(C(=O)CO[Si](C)(C)C)CC2)CC1	1833320816	OMTHAZYAXXCXKF-FQEVSTJZSA-N	438.689	1.894	50	20	IDGD	
O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)c1coc(Cl)n1)CCO2	1833552789	GLUGYLBGEGDSEZ-HNNXBMFYSA-N	436.690	1.183	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)c3cc[nH]n3)CC2)CC1	1833560061	YCBGDSDHCIKPRY-CYBMUJFWSA-N	426.359	1.626	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1)c1ccncc1	1834138828	UPTLJGOXHJKZGV-MRXNPFEDSA-N	427.318	1.957	50	20	IDGD	
CC(C)N[C@H](C(=O)N1CCOC[C@@]2(CN(C(=O)CCBr)CCO2)C1)C(C)C	1834822574	WEWKOWKKPLWKMX-PKOBYXMFSA-N	448.402	1.250	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cnn4ccccc34)C2)C1	1837712963	BEJLFTPXVBFYPM-OAQYLSRUSA-N	446.580	1.256	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)CCN3CCOCC3)CC2)CC1	1837815334	ABJDZOISYARMRN-LJQANCHMSA-N	429.989	1.725	50	20	IDGD	
COc1cc(C#N)cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)c1	1838581848	SEJQPCHQFRCRSV-QFBILLFUSA-N	425.844	1.171	50	20	IDGD	
CC(=O)N/C(C)=C/C(=O)N1CCC(OC2CCN(C(=O)[C@H](C)Br)CC2)CC1	1838721217	MCQSNMSLQRCULZ-FNDVETGQSA-N	444.370	1.808	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccn(C(C)(C)C)n3)C2)C1	1839143145	MMLMVCAWOLNNOV-YWZLYKJASA-N	426.945	1.726	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(C=O)s3)C2)C1	1839151670	ABWAQMOOSSICKI-ROUUACIJSA-N	449.356	1.867	50	20	IDGD	
Cc1ccc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)cn1	1839197533	AHNVGLWNUNZJNI-FUHWJXTLSA-N	444.301	1.079	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc4nccn34)CCO2)C1	1839549902	VIGQZFNRZNAGGI-IIBYNOLFSA-N	434.924	1.812	50	20	IDGD	
Cc1cc(C)n2ccc(C(=O)N3CCO[C@@]4(COCCN(C(=O)[C@H](F)Cl)C4)C3)c2n1	1839626783	UTLGXTBOAHEJHQ-JXFKEZNVSA-N	438.887	1.556	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccc(F)cn3)C2)C1	1840031913	GTGZDJDCFLAZJJ-ACJLOTCBSA-N	444.301	1.003	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)COC3CCCCC3)C2)C1	1840149572	SWONRQIJRRGPCE-PXNSSMCTSA-N	432.945	1.046	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)C3CCSCC3)CCO2)C1	1840922369	IEYMVHGFZHKREB-KDOFPFPSSA-N	449.411	1.617	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)CCOCCOCCOCCOC)C2	1841668875	CALNXIPYOSCELG-GOSISDBHSA-N	448.988	1.684	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)c2cccc(N3CCCNC(=O)C3)n2)C1	1842304902	AKZPXEYPUVPSID-HNNXBMFYSA-N	433.940	1.242	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)c2cnccn2)C1	1842383801	ZWVMVEQBDWFXIT-UHFFFAOYSA-N	425.401	1.441	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)CCc2ccccc2Cl)C1	1842754156	XVTCMLXDCGHECH-UHFFFAOYSA-N	441.919	1.788	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1cnc3ccccn13)C2	1843415955	HPNRSSHHFUUYJI-MFKUBSTISA-N	433.472	1.285	50	20	IDGD	
COc1ccc(Cl)cc1CC(=O)N1CC2(CCCN2C(=O)CCC(=O)NN(C)C)C1	1846385983	RGTWIOCOFKCERC-UHFFFAOYSA-N	436.940	1.468	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H]1COCCN1C(=O)OC(C)(C)C	1847946203	PYBSVUJPANDDPC-YHUYYLMFSA-N	429.945	1.842	50	20	IDGD	
Cc1nccc(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)n1	1848100111	NMFACFKNDOVPSP-JYJNAYRXSA-N	437.928	1.733	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)CCNS(=O)(=O)c2ccc(C)c(C)c2)cc1	9351509	DSBUVVPYTFLFPG-UHFFFAOYSA-N	447.513	1.285	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)c1ccc(F)cc1	17359583	FAGZCTGOYNBHPD-UHFFFAOYSA-N	435.477	1.240	50	20	IDGD	
Cc1cc(Cl)ccc1OCCCC(=O)NNC(=O)C1CCN(S(C)(=O)=O)CC1	22137446	JKXYXOKJRKVODS-UHFFFAOYSA-N	431.942	1.626	50	20	IDGD	
O=C(NNS(=O)(=O)c1cccc(S(=O)(=O)NC2CC2)c1)c1ccc2ccccc2n1	26154036	TYRTWWWZHACSCP-UHFFFAOYSA-N	446.510	1.299	50	20	IDGD	
C#CCNS(=O)(=O)c1cccc(C(=O)NNC(=O)CC23CC4CC(CC(C4)C2)C3)c1	26772881	HHXFHSDRBOWYRQ-UHFFFAOYSA-N	429.542	1.966	50	20	IDGD	
CC(C)CC(=O)N[C@@H](C(=O)NNC(=O)c1csc(N2CCOCC2)n1)c1ccccc1	110577442	GEVQTVHSHOVBII-GOSISDBHSA-N	445.545	1.644	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)NC(C)C)cc1S(=O)(=O)Nc1ccc(C)cc1	726614485	RDGKEFKZGNFBOE-UHFFFAOYSA-N	448.501	1.090	50	20	IDGD	
COc1cc(CC(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)cc(OC)c1OC	726867963	YBWAWUVBWMWNHB-UHFFFAOYSA-N	435.502	1.839	50	20	IDGD	
CN(C)CC(=O)N1CCN(C(=O)/C(C#N)=C\c2cn(CCC#N)nc2-c2ccccc2)CC1	728203673	ZHTSYFXBKHWJOF-HKWRFOASSA-N	445.527	1.603	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)CCCNC(=O)C(C)(C)C)cc2)CC1	728214930	VATTWYZPZVPEIZ-UHFFFAOYSA-N	439.582	1.008	50	20	IDGD	
CCOC(=O)c1ccc(Br)c(S(=O)(=O)NNC(=O)NCCCOC)c1	728507345	QNJFGGPFIUGKHF-UHFFFAOYSA-N	438.300	1.155	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc2c(c1)OCCO2)c1cc(F)ccc1Br	728509250	AAYJINYHJGHTKS-UHFFFAOYSA-N	431.239	1.983	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@H]2CCCCN2C(=O)c2ccccc2)c2ccccc2c1=O	729300857	XTHOWUDWIJWVDV-LJQANCHMSA-N	447.495	1.872	50	20	IDGD	
Cc1cc(C(=O)N2CCC[C@@H]2C(=O)NNC(=O)CNc2ccccc2)ccc1[N+](=O)[O-]	729513872	VVWIYDVHTLTHLJ-GOSISDBHSA-N	425.445	1.767	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCCC2)cc1)NNC(=O)CCc1ccccc1O	730034535	YTXQNGLHHGNAGC-UHFFFAOYSA-N	445.541	1.890	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)[C@@H]2CCCN(S(=O)(=O)Cc3ccccc3)C2)cc1	730539154	KQLMTLWXDKFIJH-LJQANCHMSA-N	426.498	1.561	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(OC)c(C(=O)NNC(=O)Cc2ccccc2F)c1	731328919	PZMCBDDWVBNNJQ-UHFFFAOYSA-N	437.493	1.869	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)c1cccc(S(=O)(=O)NCc2ccco2)c1	731371643	JYMRMJGWYIUNHP-UHFFFAOYSA-N	431.445	1.901	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2cnn(Cc3ccc(OC)cc3)c2)c2ccccc2c1=O	731593842	BVMOQVWZOMVMPA-UHFFFAOYSA-N	446.467	1.745	50	20	IDGD	
Cc1nc(CN2CCC(C(=O)NNC(=O)c3nnc(O)c4ccccc34)CC2)cs1	731597611	FRWFHCJIJZIOBW-UHFFFAOYSA-N	426.502	1.774	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)c1ccc2c(c1)S(=O)(=O)N(CCOC)C2=O)c1ccccc1	731997803	YGJQMMFAQYEIEX-MRXNPFEDSA-N	445.497	1.432	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1cccc(O)c1	732889613	RNDHFSAFNMSPCT-AWEZNQCLSA-N	448.501	1.118	50	20	IDGD	
O=C(CCCc1ccccc1)NNC(=O)NCC1CCN(S(=O)(=O)C(F)F)CC1	732995136	UWAFGHOACYHRGG-UHFFFAOYSA-N	432.493	1.604	50	20	IDGD	
CN1C(=O)C(=O)N(CC(=O)NNC(=O)c2ccc(COc3ccc(Cl)cc3)cc2)C1=O	733086663	PWYXKGKUXAFAKL-UHFFFAOYSA-N	444.831	1.101	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@@H](OC)C(F)(F)F)c1	733662064	XZGOVXJDRNZLGE-CYBMUJFWSA-N	440.444	1.238	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)N[C@H]2CCN(C(C)C)C2=O)cc(OCC)c1OCC	734217707	BGSNPLWKNJGHAZ-HNNXBMFYSA-N	436.509	1.836	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)C[C@@H]3OCCc4ccccc43)cc2)CC1	734548309	CRIIFRPEWJSRIE-NRFANRHFSA-N	444.557	1.770	50	20	IDGD	
CCc1c(C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)[nH]c(C)c1C(C)=O	735118925	ZOYGEBMEZJDIIJ-UHFFFAOYSA-N	448.549	1.176	50	20	IDGD	
C[C@H](Oc1cccnc1)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	735459756	FCVGAHLKFPWVRP-HNNXBMFYSA-N	432.502	1.485	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)c1cccc(S(=O)(=O)NC2CCCC2)c1	737636799	ZKTKDNOZIOPJNK-UHFFFAOYSA-N	431.514	1.885	50	20	IDGD	
CN(CC(=O)NNC(=O)c1cn(C)c2ccccc12)S(=O)(=O)c1cccc([N+](=O)[O-])c1	737774192	WQYFHRMOOKZTTD-UHFFFAOYSA-N	445.457	1.168	50	20	IDGD	
CC(C)CNC(=O)N1CCC[C@@H](CC(=O)NNC(=O)c2nnc(O)c3ccccc23)C1	741207790	RAXWUUDMRPZEIZ-AWEZNQCLSA-N	428.493	1.564	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@H](C)C(=O)NNC(=O)CN1C(=O)[C@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O	742477016	CJRGWMCQLVEEBC-RGTXSCMUSA-N	449.891	1.034	50	20	IDGD	
CC(=O)NCCc1ccc(S(=O)(=O)NNC(=O)c2cccc(Br)c2)s1	743264554	YMEHJJHGFYAKKI-UHFFFAOYSA-N	446.348	1.813	50	20	IDGD	
COCCn1cc(C=NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)cn1	743421654	FFIJWVZKNHVHGE-UHFFFAOYSA-N	441.513	1.772	50	20	IDGD	
Cc1ccc(N2CC[C@H](NC(=O)NNC(=O)c3csc(N4CCOCC4)n3)C2=O)cc1	743509857	MATUEDQSSGFMBV-HNNXBMFYSA-N	444.517	1.038	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)c1nc(-c2cccc(F)c2)no1	743511937	QAJBVGBZNYIZDO-NSHDSACASA-N	437.395	1.557	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)C(=O)Nc1ccc(C#N)c(Cl)c1	743741769	JQAIHRSGKLXFCY-UHFFFAOYSA-N	448.892	1.213	50	20	IDGD	
C[C@H](NC(=O)OC(C)(C)C)C1CCN(CC(=O)NNC(=O)c2ccc(C#N)cc2)CC1	744398645	WZRWBVPRVJHZMK-HNNXBMFYSA-N	429.521	1.944	50	20	IDGD	
COc1ccc(O[C@H](C)CNC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1	745898925	FWVIGSJSKHMTMC-CYBMUJFWSA-N	425.445	1.354	50	20	IDGD	
CN(C)C(=O)NNC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(Br)cc2)C1	746006250	ZRUPAGHAPSHOHS-NSHDSACASA-N	433.328	1.152	50	20	IDGD	
Cc1nn(C)c2sc(C(=O)N[C@H](C)C(=O)NNC(=O)Cc3cn4ccccc4n3)cc12	746637013	KCOUNESOGCEUTN-GFCCVEGCSA-N	439.501	1.099	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)C1CCN(S(=O)(=O)c2ccc3c(c2)CCC3)CC1	747319249	JPPPRCOGSANYDN-UHFFFAOYSA-N	442.541	1.361	50	20	IDGD	
Cc1occc1C(=O)NCC(=O)NNc1ccc(S(=O)(=O)Nc2nccs2)cc1	747942999	MCTNSYXHBUFJSM-UHFFFAOYSA-N	435.487	1.718	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@](F)(C(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)C1	748209242	IYBVGUKFEWTWSI-LJQANCHMSA-N	443.859	1.993	50	20	IDGD	
CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	749323276	OZZHHEPYDZAEIB-GOSISDBHSA-N	427.392	1.724	50	20	IDGD	
O=C(COC(=O)Cn1nc(-c2ccc(F)cc2)oc1=O)NNC(=O)c1cccc(Cl)c1	749726017	WIFDFEMQFNGFCX-UHFFFAOYSA-N	448.794	1.300	50	20	IDGD	
O=C(CCN1C(=O)[C@H]2CCCC[C@@H]2C1=O)NNc1nc(Br)cn2ccnc12	750244117	VXKSUKLZGITCPU-QWRGUYRKSA-N	435.282	1.500	50	20	IDGD	
Cc1nnc2n1C[C@H](C(=O)NNC(=O)COc1ccc(OCc3ccccc3)cc1)CC2	750713028	BXXBJTABPRGJBW-GOSISDBHSA-N	435.484	1.954	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)[C@@H]1CCCN(C(=O)c2cccc3ccccc23)C1	751205040	VQGMGUPXKDLNBR-QGZVFWFLSA-N	448.479	1.862	50	20	IDGD	
O=C(NNC(=O)c1c[nH]c2ccccc12)c1cccc(CN2CCS(=O)(=O)CC2)c1	751296280	CLPCAKXAQFXWNP-UHFFFAOYSA-N	426.498	1.473	50	20	IDGD	
CCN(CC)S(=O)(=O)CC(=O)NNc1ccc(S(=O)(=O)c2ccc(C)cc2)cc1	753411788	UFMIGBIKMMYGFC-UHFFFAOYSA-N	439.559	1.943	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCOC[C@H]2C[C@@H](O)c2cccs2)cc1OC	753867206	JRWOLSXZFPTGNS-HZPDHXFCSA-N	449.529	1.351	50	20	IDGD	
Nc1ncc(Cl)cc1S(=O)(=O)NNC(=O)c1nc(Cl)c(Cl)c(N)c1Cl	754742076	WSBRPTVJERJGSS-UHFFFAOYSA-N	446.103	1.878	50	20	IDGD	
O=C(NNc1ccc(C(F)(F)F)nn1)c1sccc1S(=O)(=O)N1CCOCC1	755194999	WHCMPSPCZUXTDL-UHFFFAOYSA-N	437.425	1.335	50	20	IDGD	
COc1ccc2c(c1)C=C(C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1)CO2	755428361	QXPSRRBTANVLSX-UHFFFAOYSA-N	445.497	1.635	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)Nc1ccc(N2CCCS2(=O)=O)cc1	755594689	RZMVGLFBAXEJHH-UHFFFAOYSA-N	448.501	1.857	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)Nc1cccc(COc2ccc3c(c2)OCO3)c1	755964985	VEILUVIFMXREBJ-CQSZACIVSA-N	447.469	1.582	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)NNC(=O)c1ccc(C)cc1O	756674391	RYWHBNRFLQNFPH-UHFFFAOYSA-N	436.490	1.816	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N[C@@H](C)c2cn[nH]c2)cc1	757573393	DANIOWCUXCAIQU-CIKBWMHTSA-N	433.472	1.942	50	20	IDGD	
CS(=O)(=O)CCn1cccc(NC(=O)NNC(=O)c2cc(-c3ccccc3)on2)c1=O	757780460	IZZZELRVIXTLRC-UHFFFAOYSA-N	445.457	1.014	50	20	IDGD	
CC[C@@H](C)NS(=O)(=O)Cc1cccc(NC(=O)NNC(=O)Cn2nc(C)cc2C)c1	757804488	XCYFEIFNHIYUNY-CYBMUJFWSA-N	436.538	1.571	50	20	IDGD	
C[C@@H](CC(=O)N1CCN(S(=O)(=O)CBr)CC1)NC(=O)c1ccccc1	758522797	KCSRQFCNYCTUDK-ZDUSSCGKSA-N	432.340	1.021	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)CC[C@H]2NC(=O)N(c3ccc(Cl)cc3)C2=O)nc1	759739973	QGNLISBWCQWGJW-CQSZACIVSA-N	431.836	1.870	50	20	IDGD	
CCCc1c(NC(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)cnn1-c1ccc(F)cc1	760130289	CYWLLQMIGGJFEM-LLVKDONJSA-N	426.474	1.054	50	20	IDGD	
C[C@H](NC(=O)OC(C)(C)C)[C@@H]1CN(C(=O)NNC(=O)COCc2ccccc2)CCO1	760775444	GGOHTPYAMQDWMO-RDJZCZTQSA-N	436.509	1.558	50	20	IDGD	
C[C@H]1CN(Cc2ccccc2)C[C@@H](C)[C@@H]1NC(=O)NNC(=O)CNC(=O)c1cccs1	761789333	GFAUHNDUDPRLSX-IGOJGBNBSA-N	443.573	1.965	50	20	IDGD	
Cc1nc(C(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)c(=O)[nH]c1C	763272406	JHPICDLIVRPKNO-UHFFFAOYSA-N	444.455	1.163	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)c2ccncc2)sc2c1CC[C@H](C)C2	763461688	AHKCAEUTIXSALW-NSHDSACASA-N	430.486	1.844	50	20	IDGD	
O=C(NNC(=O)c1ccncc1)C(=O)Nc1cccc(-c2cn(Cc3ccccc3)nn2)c1	763465427	ZWIAYWIQZIMHGG-UHFFFAOYSA-N	441.451	1.788	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)Nc1ccc(Cl)c(OC(F)F)c1	763579570	YVLGKKSIVSHVAK-CQSZACIVSA-N	441.774	1.867	50	20	IDGD	
C[C@@H](c1ccccc1)n1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)n1	763675685	YQQVEHOMWDBRMT-HNNXBMFYSA-N	432.440	1.529	50	20	IDGD	
CCCc1cc(NC(=O)C(=O)NNC(=O)COc2ccc(Br)cc2)n(C)n1	763693271	DREKUISRIIZXMI-UHFFFAOYSA-N	438.282	1.300	50	20	IDGD	
O=C(NNC(=O)c1cccc(Cl)c1)C(=O)Nc1ccc(N2C(=O)CCCC2=O)cc1	763753366	UIWHAUSFWYWTEC-UHFFFAOYSA-N	428.832	1.783	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2cccc(SC)c2C)c2ccccc2c1=O	763785132	GELDLECSVOLVEH-UHFFFAOYSA-N	439.497	1.846	50	20	IDGD	
C[C@H](c1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)cc1)N1CCOCC1	763838395	UCELDRZPGQQOCK-OAHLLOKOSA-N	444.463	1.384	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)cc1S(C)(=O)=O	763849184	JTZUJQUONOHHBJ-OAHLLOKOSA-N	447.513	1.569	50	20	IDGD	
COc1ccc(Cn2nccc2NC(=O)C(=O)NNC(=O)Cc2c[nH]c3ccccc23)cc1	763865147	KHMGEHBNKCOOOH-UHFFFAOYSA-N	446.467	1.750	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccnn2-c2ccccc2C)cc1	763873740	YKLUJZVQQVDEOY-MRXNPFEDSA-N	449.467	1.937	50	20	IDGD	
CCOC(=O)c1c(C2CC2)csc1NC(=O)C(=O)NNC(=O)Cn1nc(C)cc1C	763893770	ZTAJNGYAPNCSAJ-UHFFFAOYSA-N	433.490	1.402	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)C(=O)Nc1cnccc1-c1cccc(F)c1	763917287	SXVCKGPJIYMBJS-UHFFFAOYSA-N	446.402	1.263	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccc(F)cc2)cc1N1CCCS1(=O)=O	763921949	YKWGBSFSJSSWOH-UHFFFAOYSA-N	448.476	1.003	50	20	IDGD	
COc1ccc(C(C)(C)C)cc1NC(=O)C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	763922367	WLCCRVZCVXEUTM-UHFFFAOYSA-N	437.460	1.368	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc(C(=O)N2C[C@@H](C)O[C@H](C)C2)cc1	763955959	IROMEYZHUDNNBD-HZPDHXFCSA-N	438.484	1.644	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1cccc(S(C)(=O)=O)c1	764011554	IUZDRZGHJHXOHA-UHFFFAOYSA-N	425.850	1.152	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(N3CCCC3)c(F)c2)c1	764078350	RKRKHEKUFFLTJB-UHFFFAOYSA-N	448.476	1.229	50	20	IDGD	
COCCCn1ccc(NC(=O)C(=O)NNC(=O)c2ccc(F)cc2Br)n1	764084161	FCRWOJHFPISJRB-UHFFFAOYSA-N	442.245	1.221	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2O1)C(=O)Nc1cccc(Cl)c1-n1cccn1	764169106	UGXBYYNDCWSWRK-INIZCTEOSA-N	425.832	1.615	50	20	IDGD	
CCN1CCN(C(=O)c2ccc(NC(=O)C(=O)NNC(=O)CC3CCCC3)cc2)CC1	764183622	GOWNVNDZNRNMQH-UHFFFAOYSA-N	429.521	1.131	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3cccc4ncccc34)cn2)C[C@H](C)O1	764258080	USGBCHOHYAXXLK-GJZGRUSLSA-N	448.483	1.643	50	20	IDGD	
CN(C)c1nc2cc(NC(=O)C(=O)NNC(=O)c3cccc(OC(F)F)c3)ccc2o1	764260460	ZFZNFHYMQHWHLK-UHFFFAOYSA-N	433.371	1.895	50	20	IDGD	
CC(C)OC(=O)c1c(NC(=O)C(=O)NNC(=O)Cc2ccncc2)sc2c1CCCC2	764354718	WDHNYSXOZSOGDL-UHFFFAOYSA-N	444.513	1.916	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=S)Nc1ccc(Cl)nc1	764512279	AOOYIFDEWZPNMI-UHFFFAOYSA-N	432.937	1.511	50	20	IDGD	
Cc1ccsc1S(=O)(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	765119325	OMLJBOVADTXGFP-UHFFFAOYSA-N	442.994	1.837	50	20	IDGD	
CC(C)(C)OC(=O)NNC(=O)C(=O)Nc1cnc2c(c1)CN(C(=O)OC(C)(C)C)CC2	765392880	NAAMASXNQYLOPC-UHFFFAOYSA-N	435.481	1.869	50	20	IDGD	
CC(C)(C)OC(=O)NNC(=O)C(=O)Nc1ccc(Cl)c(S(=O)(=O)N2CCCC2)c1	765393397	PTJCQMOMUMBQPZ-UHFFFAOYSA-N	446.913	1.619	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)NNC(=O)c2cc(-c3cc(C)ccc3C)[nH]n2)ccc1F	765581651	PPXGJSAATPDBGG-UHFFFAOYSA-N	445.476	1.816	50	20	IDGD	
COc1ccc(CC(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)cc1F	765756398	WEJFPPXCKVEXEK-UHFFFAOYSA-N	428.508	1.650	50	20	IDGD	
C[C@H](Oc1cccnc1)C(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	765757536	VCZYEVOPMWDPEB-INIZCTEOSA-N	431.924	1.468	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3ccc(-n4ccnc4)nc3)CC2)cc1	766648268	JAWMVPQUIXKZRZ-UHFFFAOYSA-N	433.516	1.155	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1ncn(-c2ccccc2)n1	768417955	PEUNTGCPRRURAZ-UHFFFAOYSA-N	428.474	1.045	50	20	IDGD	
CCc1nn(C)cc1/C=C(\C#N)C(=O)c1c(N)n(Cc2ccccc2)c(=O)n(CC)c1=O	770568479	FGSSONPBZFNVLM-LFIBNONCSA-N	432.484	1.746	50	20	IDGD	
C[C@H](NS(=O)(=O)c1cccc(C(F)(F)F)c1)C(=O)NNc1ncnc2[nH]cnc12	771022760	NZCFFFMAKXYYEJ-QMMMGPOBSA-N	429.384	1.182	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1cn(CCC#N)nc1-c1ccc([N+](=O)[O-])cc1	772051047	AMGNKMGKFMFHDU-GFCCVEGCSA-N	428.405	1.475	50	20	IDGD	
CC1(C)CC(=O)c2cc(C(=O)NNC(=O)C(=O)NCc3ccc(Cl)cc3)c(O)nc2C1	772904442	HKOVOCHJDDODFZ-UHFFFAOYSA-N	444.875	1.673	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)[C@@H](CC)N2CCO[C@H](CC)C2)c2ccccc2c1=O	773714889	YKAYSVAHOVXJJO-CRAIPNDOSA-N	429.521	1.457	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)CCC(=O)N2C	774002506	QMDROKOFUUUOGI-LBPRGKRZSA-N	444.875	1.802	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc(Cl)n1	777403180	WJHUPKROBZBOMO-UHFFFAOYSA-N	438.893	1.139	50	20	IDGD	
COc1ccccc1-c1noc([C@H](C)NC(=O)NNC(=O)CNC(=O)OC(C)(C)C)n1	778681395	BKKHWNDYWOJAID-NSHDSACASA-N	434.453	1.661	50	20	IDGD	
COCCN1C(=O)CCc2cc(NC(=O)C(=O)NNC(=O)c3ccccc3F)ccc21	778705328	AHDVONJCPDZJAS-UHFFFAOYSA-N	428.420	1.151	50	20	IDGD	
CC(C)c1ccc(-n2c(NNC(=O)CN3CCN(C)C(=O)C3)nc3ccccc3c2=O)cc1	780695899	VXPFHDBHSOFKCD-UHFFFAOYSA-N	448.527	1.726	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)[C@@H]1CCCN(C2CCC2)C1	781404181	PNRYSWHTRRSQAR-FUHWJXTLSA-N	429.569	1.676	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2ccc([N+](=O)[O-])cc2OC)c2ccccc2c1=O	782075026	QWRSPCATYIISQE-UHFFFAOYSA-N	426.389	1.800	50	20	IDGD	
C[C@H]1CN(Cc2cccc(NC(=O)C(=O)NNC(=O)c3ccc(O)cc3)c2)C[C@@H](C)O1	782838001	WDESIVAZONIUCQ-GASCZTMLSA-N	426.473	1.401	50	20	IDGD	
COc1c(NC(=O)C(=O)NNc2ncc(C(F)(F)F)cc2Cl)cccc1C(N)=O	782854553	TYPBWXDBBUXHPX-UHFFFAOYSA-N	431.758	1.943	50	20	IDGD	
CNS(=O)(=O)c1ccc2c(c1)N(C(=O)C(=O)NNc1ncccc1C(F)(F)F)CC2	783121742	WIGUYUKKNYTVPH-UHFFFAOYSA-N	443.407	1.041	50	20	IDGD	
CN(Cc1ccccc1NC(=O)C(=O)NN[C@]1(C)CCS(=O)(=O)C1)C1CCCCC1	783427230	NKRWFCVSOIQIQG-OAQYLSRUSA-N	436.578	1.588	50	20	IDGD	
O=C(NNc1ccc(-n2cccn2)nn1)C(=O)Nc1cc(F)ccc1OC[C@@H]1CCCO1	783432823	FGCMYILSCMYUAE-AWEZNQCLSA-N	441.423	1.441	50	20	IDGD	
CC1CCN(c2cccc(NC(=O)C(=O)NNC(=O)CNC(=O)c3cccs3)c2)CC1	784005117	PFAZIRDIILHJQM-UHFFFAOYSA-N	443.529	1.500	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1cccc(-c2ncco2)c1	785330851	NELDSPDTEOWEPS-UHFFFAOYSA-N	430.442	1.836	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)c2ccc(F)c(S(C)(=O)=O)c2)n[nH]1	786482786	PYRKRJFLKSMDPZ-UHFFFAOYSA-N	432.433	1.703	50	20	IDGD	
CCS(=O)(=O)CCn1cc(C)c(NC(=O)NNC(=O)c2ccc(OC)cc2OC)n1	786718040	RJWJYKRIAIUING-UHFFFAOYSA-N	439.494	1.110	50	20	IDGD	
CCS(=O)(=O)CCn1cc(C)c(NC(=O)C(=O)NNc2ccccc2C(F)(F)F)n1	787540524	KXTAJXAIHUTSBQ-UHFFFAOYSA-N	447.439	1.727	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccn(C3CCN(C)CC3)n2)c1C	787542583	BGNLMPDVDRJOQS-INIZCTEOSA-N	442.520	1.320	50	20	IDGD	
Cn1c(=O)ccc2ccc(NC(=O)C(=O)NNC(=O)c3ccccc3Br)cc21	787545842	WATGALYWIYVBEE-UHFFFAOYSA-N	443.257	1.701	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NN=Cc3cc4ccccc4[nH]3)CC2)cc1	788435853	YSGGCBORFAPZPA-UHFFFAOYSA-N	439.541	1.933	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)nnn1CC1CCCC1	788719675	KNBXXIQLEOEJRU-UHFFFAOYSA-N	440.913	1.152	50	20	IDGD	
CSC1(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)CCC1	789289544	KZBXNBAIZKGNBU-UHFFFAOYSA-N	426.564	1.701	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)C(=O)Nc1cccc2c1OC(C)(C)C2	789584856	RWPLVHHCGHWMPB-UHFFFAOYSA-N	434.493	1.791	50	20	IDGD	
COc1cc(NNC(=O)C(=O)Nc2ccc(C[C@@H]3CC(=O)NC3=O)cc2)ccc1Cl	789795909	ITKKCIGMRFZTNJ-GFCCVEGCSA-N	430.848	1.636	50	20	IDGD	
COC(=O)Cc1cc(=O)n(-c2ccc(C(=O)NNc3cccc(F)c3[N+](=O)[O-])cc2)[nH]1	791148106	PDNFIVBEYFNVQL-UHFFFAOYSA-N	429.364	1.685	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)[C@H](OC)C3CC3)c2)cc1	792013894	ZUYGQRVGZBZUNA-GOSISDBHSA-N	433.486	1.682	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@H]3CCN(CC(F)(F)F)C3)CC2)cc1	792236975	DTQSBMOPIVCWBH-SFHVURJKSA-N	441.498	1.144	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cc3c[nH]nc3cc2C)cc1	792268235	FYPZXYIPSSKBDO-CYBMUJFWSA-N	425.445	1.823	50	20	IDGD	
COc1cc(C(F)(F)F)ncc1NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1	792509469	FZLONKYADFXIMM-UHFFFAOYSA-N	439.398	1.968	50	20	IDGD	
CN(C[C@@H]1C[C@H](F)CN1CC(=O)NNC(=O)c1cccc(C#N)c1)C(=O)OC(C)(C)C	792918988	COIBUXINNHZUQD-IRXDYDNUSA-N	433.484	1.599	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2cc(Cl)cc(C(N)=O)c2OC)cc1	793025717	LVDSVPDXWUOKDZ-UHFFFAOYSA-N	448.863	1.175	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CNC(=O)OCc2ccccc2)c([N+](=O)[O-])cc1OC	794072302	TWGIFEKQLBLTTI-UHFFFAOYSA-N	432.389	1.299	50	20	IDGD	
O=C(CN1CCCC[C@H]1COC(=O)N[C@@H]1CCOC1)NNC(=O)c1ccccc1Cl	796549596	OORJRSSJRVZHHI-CABCVRRESA-N	438.912	1.471	50	20	IDGD	
CCNC(=O)N(C)c1cccc(NC(=O)C(=O)NNC(=O)COCc2ccccc2)c1	797005410	FETSRPADLCJTBK-UHFFFAOYSA-N	427.461	1.155	50	20	IDGD	
CC(C)[C@@H](C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1)c1cccnc1	798110633	NNGCBXMDESWWDH-GOSISDBHSA-N	432.550	1.296	50	20	IDGD	
CSC[C@H](C)C(=O)N1CCC(C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)CC1	799337805	QRAKXRRZJPWSJR-HNNXBMFYSA-N	429.546	1.871	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2ccc3c(c2)OCCO3)nnn1CCOc1ccc(F)cc1	799865555	RXAVSBJFPKHWGU-UHFFFAOYSA-N	441.419	1.651	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@@]1(C)CCN(CC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)C1	801573769	OKJMJPPJXGFMAK-HXUWFJFHSA-N	435.481	1.593	50	20	IDGD	
Cc1cc(C)cc(N2CC[C@@H](C(=O)NNC(=O)Nc3ccc(S(C)(=O)=O)cc3)C2=O)c1	802068048	XWVHPTSDHIUSQS-SFHVURJKSA-N	444.513	1.913	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)[C@@H]2CC(=O)N(Cc3ccccn3)C2)c(OC)cc1Cl	802080037	LWBQZKMVUZCOIR-GFCCVEGCSA-N	447.879	1.954	50	20	IDGD	
COc1ccc(Cl)c(NC(=O)NNC(=O)c2cc(S(=O)(=O)N(C)C)ccc2O)c1	802107444	AIKGDMFPXSRUON-UHFFFAOYSA-N	442.881	1.771	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)CCCS(=O)(=O)c1ccc(Cl)cc1	803054207	MMRFTJAMUMVQMC-UHFFFAOYSA-N	433.914	1.566	50	20	IDGD	
O=C(NNc1ccc2c(=O)[nH]ccc2c1)c1ccc(S(=O)(=O)NC[C@H]2CCCO2)cc1	803430870	PGHFRUOKEUOJIL-QGZVFWFLSA-N	442.497	1.742	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNc2ccc(-c3cccc(C(F)(F)F)c3)nn2)ccn1	804211410	PUELMTRGRXJBQW-UHFFFAOYSA-N	438.391	1.962	50	20	IDGD	
Cc1cc(I)cc(NC(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)c1	806683855	NLBYXECLKYAEKE-SECBINFHSA-N	437.259	1.187	50	20	IDGD	
CCC(C)(C)[C@H]1CCc2nc(NC(=O)C(=O)NNC(=O)C(=O)N3CCCC3)sc2C1	807004990	ZTWJXVIYRSXSIZ-LBPRGKRZSA-N	435.550	1.393	50	20	IDGD	
CC(=O)c1cc(NC(=O)C(=O)NNC(=O)CNC(=O)OCc2ccccc2)ccc1F	807069544	CQUYNQVFBHADBV-UHFFFAOYSA-N	430.392	1.041	50	20	IDGD	
COC(=O)c1cccc(NC(=O)C(=O)NNc2ccc(-n3ccnc3)nn2)c1OC(C)C	807429633	SYUDGHJLGHNNRY-UHFFFAOYSA-N	439.432	1.318	50	20	IDGD	
O=C(NCCCn1cc(Br)cn1)NNC(=O)c1nnc(O)c2ccccc12	807610883	NCMHHDVUGCAQEY-UHFFFAOYSA-N	434.254	1.329	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2F)nn1-c1ccc(F)cc1F	808934595	MWJIWUWVNKNQGH-UHFFFAOYSA-N	447.373	1.763	50	20	IDGD	
O=C1O[C@@H](c2ccccc2)C[C@@H]1C(=O)N1CCN(S(=O)(=O)CBr)CC1	809750495	YASWGIJMYGHIGU-ZIAGYGMSSA-N	431.308	1.117	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc4nc(C)nn4c3)n[nH]2)c1	810399034	LPNIQCGIKSCVIM-UHFFFAOYSA-N	432.444	1.444	50	20	IDGD	
CCOC(=O)Cc1nnc(NC(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)s1	812956498	QZGSXDFYXABZEC-UHFFFAOYSA-N	428.496	1.043	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1ccc2c(C)nn(C)c2c1	812988568	GCOAQMAUQJEPPU-UHFFFAOYSA-N	431.474	1.376	50	20	IDGD	
CC(C)C(=O)N[C@@H](CO)C(=O)NNC(=O)c1ccc(COc2ccc(Cl)cc2)cc1	813367031	UBIXEPNGZNXMGW-SFHVURJKSA-N	433.892	1.813	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)C1(S(=O)(=O)c2ccccc2)CCOCC1	813486913	CTQSYNPIBPZRAH-UHFFFAOYSA-N	438.527	1.556	50	20	IDGD	
CC(C)(C)C(=O)NNC(=O)C(=O)Nc1ccc([N+](=O)[O-])c(I)c1	815551524	XJABJALVMHHEMV-UHFFFAOYSA-N	434.190	1.331	50	20	IDGD	
COc1cc(F)c(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)N(C)C)cc1OC	815752380	PUAIUQPXRWINKR-UHFFFAOYSA-N	440.453	1.175	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)CCCN2C(=O)CN(C)C2=O)c1	818767129	CTJGKOOETRBOSS-UHFFFAOYSA-N	427.255	1.353	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2ccccn2)cc1S(=O)(=O)NCc1ccccn1	912770532	TWRRYUSIRCTDSV-UHFFFAOYSA-N	441.469	1.039	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)Cn1cc(Br)ccc1=O	914876717	IIJRXKIYJIAZBD-UHFFFAOYSA-N	432.278	1.371	50	20	IDGD	
COc1cccc([C@H](CNC(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)N(C)C)c1	915901070	FFPONGTUGDJFIA-IBGZPJMESA-N	427.505	1.884	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)c2cc(Cl)c(-n3cnnn3)cc2OC)c1	916034921	OQCYLQIIVWFCCT-UHFFFAOYSA-N	432.824	1.416	50	20	IDGD	
CCS(=O)(=O)N1CCC(NC(=O)NNC(=O)[C@H](C)Oc2ccc3ccccc3c2)CC1	916260188	RQYWUQIQLUYRDA-HNNXBMFYSA-N	448.545	1.752	50	20	IDGD	
CN1CCN(Cc2ccc(CNC(=O)NNC(=O)c3cc(Br)c[nH]3)cc2)CC1	916387840	HXLZPPUDUISVBY-UHFFFAOYSA-N	449.353	1.669	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)NCCCN1CCN(C)C[C@H]1c1ccccc1	916484632	DDKAJODVLWZVQZ-FQEVSTJZSA-N	449.559	1.966	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)NCCNS(=O)(=O)Cc2ccccc2)cc1	916516569	GOCVUJSFRPDJPE-UHFFFAOYSA-N	436.559	1.537	50	20	IDGD	
N#Cc1ccc(NCCNC(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)nc1	916520650	KNLFJDXKWFUIHX-UHFFFAOYSA-N	428.396	1.985	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)CN(C)C(=O)c1ccc(Br)o1	917390470	LNDPBEDPJXRDPS-JTQLQIEISA-N	442.241	1.868	50	20	IDGD	
CCN1C(=O)c2ccc(C(=O)NNC(=O)[C@@H](C)Oc3ccccc3F)cc2S1(=O)=O	917519000	FVVSUVQJUGFIJM-LLVKDONJSA-N	435.433	1.219	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2cccc(OCC(=O)OC)c2)c2ccccc2c1=O	917565320	NJRZMVRFMMAUPM-UHFFFAOYSA-N	438.440	1.433	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3C[C@@H](C)O[C@H](C)C3)cc2)c(O)c1	918340964	HCUZXICSYJCHJG-HUUCEWRRSA-N	447.513	1.573	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)c1ccc2c(=O)n(CC)c(O)nc2c1	919689260	GSHXSQUZPHJFGX-UHFFFAOYSA-N	434.456	1.495	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)[C@H]1CS[C@]2(C)CCC(=O)N12	920768395	MFWGETYMZJWKJM-MNRXQERYSA-N	442.335	1.818	50	20	IDGD	
CCn1cc(NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)ccc1=O	920930699	UAIHMNJSURIQCD-UHFFFAOYSA-N	433.490	1.119	50	20	IDGD	
CCOc1ccc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)[C@@H]3CCOC3)cc2)cc1	921203039	PDXOYBQVRBBNAC-OAHLLOKOSA-N	433.486	1.684	50	20	IDGD	
CCn1c(NNC(=O)c2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)nc2ccccc2c1=O	1115884069	FQWUTNRGZKNXHS-MRXNPFEDSA-N	434.500	1.875	50	20	IDGD	
O=C(COC(=O)C(F)(F)c1ccc(Cl)cc1)NNC(=O)[C@H]1COc2ccccc2O1	1115978668	XOQJBYKIMPERSA-OAHLLOKOSA-N	440.786	1.962	50	20	IDGD	
CC(=O)NC[C@H]1CCn2ncc(C(=O)NNc3nc(Br)cn4ccnc34)c2C1	1116776846	UCPYNTKUTPSAPE-NSHDSACASA-N	447.297	1.144	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCCOc2ccc3c(c2)CCC3)c2ccccc2c1=O	1251150540	HMTAHHWJEXWNGZ-UHFFFAOYSA-N	435.484	1.928	50	20	IDGD	
Cc1ccc(CN2CC[C@@H](NC(=O)NNC(=O)c3cncn3-c3ccccc3)C2=O)cc1	1320701933	NBDMOTQQSJOTDY-LJQANCHMSA-N	432.484	1.926	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2ccc(NS(=O)(=O)C(C)C)c(F)c2)cc1	1340952453	SPUFCZGTAGCCJX-UHFFFAOYSA-N	445.494	1.608	50	20	IDGD	
CCCNC(=O)[C@H](C)NC(=O)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1	1341770823	YLJMYVSOJLQJHK-UWJYYQICSA-N	437.544	1.859	50	20	IDGD	
Cc1nc2sccn2c1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2	1778721618	KCWVJBPDBIVNKT-PIGZYNQJSA-N	441.351	1.931	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)c1ccoc1Cl	1780257164	IXGALKFUPYRYQZ-DYESRHJHSA-N	446.696	1.054	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H]2CCCN(C)C2)C1	1780575878	CHJFMQFUJRLQHB-WFXMFSGNSA-N	430.387	1.626	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCNC(=O)OC(C)(C)C)CCO2	1781216901	QDCYUJVKEYTYIO-BXTJHSDWSA-N	447.960	1.109	50	20	IDGD	
O=C(CCCc1ccncc1)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781327135	XIHHSSMLYZRUMM-WMZOPIPTSA-N	428.302	1.925	50	20	IDGD	
COc1ccc(Cl)cc1CC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1782976549	RMXKDUVITWDQHP-HNAYVOBHSA-N	431.316	1.321	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(N(C)C)cn3)CCO2)C1	1783343516	JNJFAVFOGKHXGY-DNVCBOLYSA-N	439.354	1.765	50	20	IDGD	
COc1ccccc1OCC(=O)N1CCO[C@]2(CCN(C(=O)[C@H](C)Br)C2)C1	1783527532	CPOUPMMENMCLDP-IFXJQAMLSA-N	441.322	1.687	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](C)Br)C2)C1	1783539897	OUQITABOCFUYRD-MJVIPROJSA-N	426.149	1.773	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)C3=Cc4ccccc4NC(=O)C3)CCO2)C1	1783881125	JFUVKTIVFZTGLN-VGSWGCGISA-N	447.919	1.496	50	20	IDGD	
CCCOc1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc1	1783934585	DMXVWIIVYNYMCM-HSZRJFAPSA-N	446.548	1.292	50	20	IDGD	
Cc1cnn([C@H](C)C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]3C2)c1	1783973531	BVRBLURKTBMZTC-QEOTZNIISA-N	441.370	1.763	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](C)n3ccnc3C)C2)C1	1784638958	IIRUSJMTVZZYKY-YEWWUXTCSA-N	427.343	1.756	50	20	IDGD	
Cc1nc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Br)C[C@@H]32)c(C)s1	1785414114	IRSZVOYQZRNOSJ-DUPGQFARSA-N	448.358	1.973	50	20	IDGD	
C[C@@H](Cn1cccn1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]21	1785442150	MYXSVYYCGRIOSS-GMHRPJKWSA-N	431.364	1.735	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC1(c2ccc(NC(=O)c3cnsn3)cc2)CCC1	1787099317	JRCYNYKPOZJVKA-UHFFFAOYSA-N	437.485	1.598	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC1(c2ccc(NC(=O)c3cc4n(n3)CCNC4=O)cc2)CCC1	1787572829	MIFHXWFPGOSSBT-OAHLLOKOSA-N	445.907	1.628	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4cc[nH]c4c3)[C@H]2C1	1787834512	RENNGXSNXPYDQC-BJLQDIEVSA-N	441.532	1.134	50	20	IDGD	
CCOc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Br)C[C@@H]32)nn1	1789396505	IGMCKEKTNCKANC-UHXUCMFUSA-N	445.289	1.159	50	20	IDGD	
COc1ccc(C(=O)Nc2ccc(C3(NC(=O)CCC(=O)NN(C)C)CCC3)cc2)nn1	1789963789	WKERNDGZBASRQE-UHFFFAOYSA-N	440.504	1.606	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3COc4ccccc4O3)C[C@@H]21	1791252560	MQXOJRZJTGRFAR-UNTXSKPGSA-N	438.908	1.060	50	20	IDGD	
CO[C@@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C[C@@H]21	1791323193	VDRJGGYWTBADEQ-FKUVSKKCSA-N	433.455	1.886	50	20	IDGD	
CN1CCC(C(=O)NC2(c3ccc(NC(=O)CCC(=O)NN(C)C)cc3)CCC2)CC1	1791595586	JISFUUJXUBQEAB-UHFFFAOYSA-N	429.565	1.835	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1ccc(C2(NC(=O)c3cc4cccnn4n3)CCC2)cc1	1791601185	TZSPUMRLDOWVQU-UHFFFAOYSA-N	449.515	1.850	50	20	IDGD	
C[C@]1(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)CC=CCC1	1791776409	HERCCGCBSGHSNQ-RJZVVRIISA-N	441.532	1.025	50	20	IDGD	
Cc1ccc(OCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)CBr)cc1	1792867864	NJZBAZNFDMAFQD-OAFZBRQQSA-N	439.350	1.994	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnccc1N(C)C)C2	1792870790	UVRDGNAPCOUUCT-VWPFQQQWSA-N	439.354	1.382	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3occ(Cl)c3c1)C2)[C@@H](O)CCl	1792981434	ZSMCHIIGBONNMM-RBNVPPIJSA-N	427.284	1.889	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1nccc2[nH]ccc12	1796208350	RUKDKSWKVIZRLM-FJHTZYQYSA-N	425.258	1.457	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cncn1-c1ccncc1)C2	1797954564	WKQHSAKTDBQKOY-CWPLJXCYSA-N	443.580	1.322	50	20	IDGD	
Cc1cccc(CCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)c1	1798439579	JVPWXQMUINWWAN-REPLKXPHSA-N	435.528	1.878	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@]1(C)C[C@H]1C)C2	1798524552	GFWGCWCUJUHOGJ-JLXCYSRLSA-N	445.472	1.769	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(C(F)(F)F)n1)c1ccc(B(O)O)cc1	1798768308	NMSUNLRIXBUVIW-MUJYYYPQSA-N	447.222	1.346	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccnc(C(F)F)c1)C2)[C@@H](F)Br	1799347413	KCIXHLQIPSWJHV-LYIQGSDWSA-N	436.228	1.913	50	20	IDGD	
COc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Br)c(O)c1	1799349352	XJGOQCBHDYMDMM-OWLDWWDNSA-N	431.258	1.295	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2ncccc2[nH]1	1799895179	KISWZYGSKIOCOT-LKQDWFRTSA-N	435.322	1.940	50	20	IDGD	
CC(C)[C@H](CNC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2	1800918832	MOGVYQNYDYYVKS-QRJUGERDSA-N	449.951	1.907	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1ccc(OC)cc1F)C2	1800978060	KOMGJOULSXEAND-MQJTVSLUSA-N	442.915	1.610	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c(F)cccc1Cl)C2	1801011845	KJZTZHUVBCTKMJ-DBWKPXFBSA-N	440.903	1.055	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cnc3ccccn23)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803138540	CFYPARKMCXVEFL-VDZJLULYSA-N	427.892	1.649	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC2(CCN(C(=O)CCN3CCOCC3)CC2)C1	1805383813	WVQLZMLDRXGYHX-KRWDZBQOSA-N	444.414	1.971	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)cn1	1807369713	SEUAQVGMXRDZDG-UGKGYDQZSA-N	444.300	1.098	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)Cc2cccs2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1	1807370894	MUFIVUBMWXSWOR-XMSQKQJNSA-N	449.341	1.385	50	20	IDGD	
C[C@H](Nc1nccs1)C(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1	1808381827	VHDCIUHKQHVICB-HNKHHVNMSA-N	437.953	1.644	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)c1nc2ccccc2[nH]1	1809035650	HJECMFFFXXHQLW-WBAXXEDZSA-N	427.892	1.877	50	20	IDGD	
Cc1ccc(CC(=O)N2CCC3(CCCN(C(=O)c4ccc(B(O)O)cc4)C3)CC2)cc1	1809967808	KVXQKKKOFRKYFT-UHFFFAOYSA-N	434.345	1.762	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)CNC(=O)c2cc(C)on2)[C@@H]1c1cccnc1	1810379367	JOWBRTZOJUEEOT-BXWFABGCSA-N	447.923	1.831	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@H]1CCN(C(=O)c2cc[n+]([O-])cc2)[C@@H]1c1cccnc1	1810543953	IBEGVGNEMDTHBG-UYAOXDASSA-N	428.565	1.886	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC2(CCCN(C(=O)[C@H](F)Cl)C2)CC1	1810901501	UAIZWOVIVLRWRI-LUILSVGHSA-N	425.892	1.886	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)Cn2cc(Cl)cn2)[C@@H]1c1cccnc1	1813030860	MXEFDHIWTQNSQO-UWWQBHOKSA-N	440.331	1.891	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)o1	1813067694	BMKQZCKDKNRPQV-DYESRHJHSA-N	427.505	1.676	50	20	IDGD	
CCOC(=O)N[C@@H](O)C(=O)N1CCCC[C@H]1c1cc(NC(=O)C(C)(C)CCl)n[nH]1	1814697093	LYEBVKVNKPWIAY-JSGCOSHPSA-N	429.905	1.731	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccccc2-n2nccn2)[nH]n1)[C@H](O)CCl	1814873280	UKYDPPLPGKNCKT-DLBZAZTESA-N	443.895	1.896	50	20	IDGD	
CC(C)(CCl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(=O)n4[nH]cnc4n3)sc2C1	1815324476	WZGSVFGIPMOILA-SECBINFHSA-N	449.924	1.365	50	20	IDGD	
CC(C)=CCCC(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1	1815343758	NOBFVOUIKQDUDK-INIZCTEOSA-N	427.335	1.795	50	20	IDGD	
Cc1ccc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)nc1	1815354807	GIFILSBXEKDVOU-HNNXBMFYSA-N	436.302	1.066	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](O)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](F)Cl)n[nH]1	1818042295	XMQVCLQOUZQRLM-ZKYQVNSYSA-N	433.868	1.779	50	20	IDGD	
COC[C@@H](C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)n[nH]1	1818110528	JIFRGTHQMRQUPL-HKEVHVOCSA-N	443.508	1.818	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](F)Br)[nH]n1	1818124953	WQJWAZHLHGDGCC-IUPBHXKESA-N	432.294	1.959	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H]3CC3(F)F)sc2C1	1818679830	XUCOBOKZHRWWGO-LDYMZIIASA-N	436.444	1.023	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1ncccc1F	1819971762	GFCQVSBNMOOIDW-KRWDZBQOSA-N	437.240	1.243	50	20	IDGD	
CCc1cc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)CCC(=O)NN(C)C)CC3)no1	1820743581	DRJPFQLMKRECJD-LLVKDONJSA-N	434.522	1.292	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)/C=C/c2cnc[nH]2)[nH]n1	1822416831	QOJVLGVHDDZPQD-YXMGTMDOSA-N	428.497	1.211	50	20	IDGD	
CC(C)(C#N)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1	1823885729	IEFAKTNZHGWMKT-GOSISDBHSA-N	426.521	1.468	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(C)n4ccnc4n3)sc2C1	1824118850	KEHRPNXJQMKKOW-NEPJUHHUSA-N	448.936	1.974	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)CN(C)C(=O)C(=O)O)sc2C1	1824668714	ZUGPKOWRFQLZHH-ZJUUUORDSA-N	430.914	1.006	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H]3CCCS3(=O)=O)sc2C1	1824933528	FXILVVGXAFLOLQ-RISCZKNCSA-N	445.639	1.484	50	20	IDGD	
Cc1noc(C)c1CC(=O)N1CCCC[C@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1	1825012026	BVGGJJXWTCZYEV-FQEVSTJZSA-N	447.580	1.827	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(OC)nn1C)CC2	1825994069	PUPDDWJONFTQFW-ZJUUUORDSA-N	427.914	1.365	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(O)nc(O)c1)CC2	1825998866	NOKKCZKBDBUOEU-VHSXEESVSA-N	426.882	1.429	50	20	IDGD	
O=C(C(Cl)Cl)N1CCC([C@H]2CCCCN2C(=O)CNCP(=O)(O)O)CC1	1826808227	QPKNHMBKQXJALR-GFCCVEGCSA-N	430.269	1.135	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)Cc3c(C)nn(C)c3C)sc2C1	1826849580	WWDRSQXWCLHZBD-OCCSQVGLSA-N	439.969	1.902	50	20	IDGD	
O=C(CCc1ccc[nH]1)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827055008	RNJXCCUPIWURGT-QFIPXVFZSA-N	437.349	1.561	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CNC(=O)c2ccco2)CC1	1827185596	RKRUMNNRXFUKMN-SJORKVTESA-N	439.940	1.883	50	20	IDGD	
CCc1cc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)n(C)n1	1829327651	ZHIBZOBVLVYKOV-LJQANCHMSA-N	446.596	1.589	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccnc3S)CCO2)C1	1829791713	IYZNSQCCZMDTKN-HNAYVOBHSA-N	427.954	1.848	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4c(c3)CC(=O)N4)C2)C1	1830362192	NSBSSTQLFGRGIS-JOCHJYFZSA-N	449.935	1.516	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4cccnn4n3)C2)C1	1831654028	HLLKHAQZOGNALM-UZLBHIALSA-N	435.912	1.207	50	20	IDGD	
Cc1ncc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)cn1	1831872413	VKOKEQVIZKYHFI-IBGZPJMESA-N	430.553	1.391	50	20	IDGD	
O=C(/C=C\c1c[nH]c2ccccc12)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1	1832732700	VTBLRBWIDCDDCG-JCHZHDRDSA-N	447.919	1.237	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@]3(F)CCCC=C3F)CC2)CC1)[C@@H](O)CCl	1833313617	NCUGNEDMVRKSDZ-JXFKEZNVSA-N	433.927	1.903	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)C(C)C)CC2)CC1	1833350174	TUJBJZQDYSCJHM-DLBZAZTESA-N	432.403	1.748	50	20	IDGD	
CC(=O)c1cc(C(=O)NC2CCN(C3CCN(C(=O)CO[Si](C)(C)C)CC3)CC2)n[nH]1	1834066614	ZBUXEHBFLOIGGE-UHFFFAOYSA-N	449.628	1.649	50	20	IDGD	
Cc1ccn(CC(=O)N2CCC(N3CCC(NC(=O)CCBr)CC3)CC2)n1	1834422282	BDUHIRGEJQSYHW-UHFFFAOYSA-N	440.386	1.548	50	20	IDGD	
O=C([C@@H](O)CCl)N1CCC(N2CCC(NC(=O)C3(C(F)(F)F)CCC3)CC2)CC1	1834643864	ZEFOHSJOYDSQBX-HNNXBMFYSA-N	439.906	1.890	50	20	IDGD	
Cc1cc(C)n(CCC(=O)N2CCC(N3CCC(NC(=O)[C@H](F)Cl)CC3)CC2)n1	1835083931	ZYQRABDLCNUXBD-IBGZPJMESA-N	427.952	1.996	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3cc(F)cc(F)c3)CCO2)C1	1836123619	UXRKKWJRGTXNGN-YLJYHZDGSA-N	446.878	1.218	50	20	IDGD	
COc1cc(C(=O)NC2CCN(C3CCN(C(=O)C(C)(C)CCl)CC3)CC2)nn1C	1836201701	XSDIECNGXPQIHS-UHFFFAOYSA-N	439.988	1.879	50	20	IDGD	
CC[C@H](Br)C(=O)NC1CCN(C2CCN(C(=O)Cn3cccn3)CC2)CC1	1836541882	LPEIGPLAGAIKPG-KRWDZBQOSA-N	440.386	1.628	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(NC(C)=O)o3)CCO2)C1	1837453038	AVXWSDOEMRHLGW-IFXJQAMLSA-N	427.885	1.325	50	20	IDGD	
CC(C)O[C@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)CBr)C2)C1	1837592557	WBPZIZYPQXLNIF-IIDMSEBBSA-N	435.359	1.287	50	20	IDGD	
Cc1ccsc1C(=O)N1CCOC[C@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1837711987	BNFBUZWCVTXAAD-IBGZPJMESA-N	426.611	1.978	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCC(OC2CCN(C(=O)c3cc(O)n[nH]3)CC2)CC1	1837902658	DQDYMZXGXDDIKU-SFHVURJKSA-N	433.336	1.964	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(CO)o3)CCO2)C1	1837970226	GNRLAFUQWMETDH-ZWKOTPCHSA-N	435.304	1.078	50	20	IDGD	
C[C@@H](C(=O)N1CCC(OC2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1)n1cccc1	1838789192	KKLXELLCORYNRO-SFHVURJKSA-N	447.580	1.421	50	20	IDGD	
CCc1ccnc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)c1	1839199687	RWXGWQGPDXQVTG-MAUKXSAKSA-N	444.301	1.405	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)cc1F	1839202222	XXAIKURJGGXPPV-CRAIPNDOSA-N	447.276	1.895	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C)ccc3F)C2)C1	1840155197	RXUIBBIZLJVPQK-OXQOHEQNSA-N	428.888	1.458	50	20	IDGD	
O=C(c1ccnc(C(F)F)c1)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840186307	HWYHZWKWZMTUKO-KRWDZBQOSA-N	438.258	1.893	50	20	IDGD	
Cn1ncc2cc(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)C(Cl)Cl)CCO4)ccc21	1840188518	NXHOKWXQUKARQW-LJQANCHMSA-N	441.315	1.447	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)c1	1840730920	RRPILOIVFLWKPJ-IBGZPJMESA-N	444.315	1.519	50	20	IDGD	
Cc1cc2nnc(C(=O)N3CC4(CCCN4C(=O)[C@H](C)CBr)C3)c(C)n2n1	1841287396	KSDHRRVSRJHLMN-LLVKDONJSA-N	435.326	1.589	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)c1ccc(CO)o1)C2	1844692795	LJVKTVPEMKKSMY-UHFFFAOYSA-N	443.412	1.736	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)C1(NC(=O)OCc3ccccc3)CC1)C2	1846362751	UGJRUYNRWNNXPD-KRWDZBQOSA-N	449.935	1.903	50	20	IDGD	
COc1ccccc1C(=O)N1CC(C(=O)N2CC3(CCCN3C(=O)C(Cl)Cl)C2)C1	1846386618	HVLQHYZIBPMYBB-UHFFFAOYSA-N	440.327	1.774	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](O)CCl)C[C@H]2C[C@H]21	1847568709	JESFOQQMYHZWSY-HLZFJGBKSA-N	427.929	1.186	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@@H](C)C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](F)Cl)cc1	1847582273	SCOPUOWLIAESFF-QCEMKRCNSA-N	431.917	1.398	50	20	IDGD	
O=C(COC(=O)c1ccccc1I)NNC(=O)c1cccs1	11438253	HBUZCVLWLZKSQQ-UHFFFAOYSA-N	430.223	1.971	50	20	IDGD	
O=C(COC(=O)Cc1cc(Cl)c2c(c1)OCCO2)NNC(=O)c1cccc([N+](=O)[O-])c1	12961462	RCMWHZIBONVGOK-UHFFFAOYSA-N	449.803	1.566	50	20	IDGD	
Cc1cc(OCC(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)ccc1Cl	16072674	WMLDHTRBADAIFB-UHFFFAOYSA-N	432.285	1.789	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)NC[C@@H]2CCCO2)c1)c1cccc([N+](=O)[O-])c1	21898199	GLYPAGJIPXVACH-INIZCTEOSA-N	448.457	1.127	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)CN1C(=O)N[C@](C)(c2ccc(F)cc2)C1=O	23750569	QSHLPAREZDUBII-XUSGNXJCSA-N	446.410	1.347	50	20	IDGD	
O=C(COC(=O)CCNC(=O)c1ccc([N+](=O)[O-])cc1)NNC(=O)c1ccc(Cl)cc1	28803185	OJLNOZANIICEDZ-UHFFFAOYSA-N	448.819	1.373	50	20	IDGD	
O=C(COC(=O)c1ccc2c(=O)n3c(nc2c1)CCCCC3)NNC(=O)c1cccs1	104357445	ZENFEVGKBXDCLS-UHFFFAOYSA-N	440.481	1.802	50	20	IDGD	
COc1ccc(C(C)=NNC(=O)CN2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)cc1	254647303	XUCOCUBZFYRNGV-UHFFFAOYSA-N	444.557	1.850	50	20	IDGD	
CC(C)NC(=O)C(=O)NNC(=O)[C@@H]1C[C@H]2CCCC[C@@H]2N1C(=O)c1cccc(Cl)c1	726157340	SVOPTKVTGXNKHS-COXVUDFISA-N	434.924	1.785	50	20	IDGD	
CNS(=O)(=O)c1cccc([C@@H](C)NC(=O)NNC(=O)COc2cc(C)ccc2C)c1	727608844	XVLOWQKNDZGKOE-OAHLLOKOSA-N	434.518	1.682	50	20	IDGD	
CSC[C@H](C(=O)NNc1nc(-c2ccncc2)no1)N1C(=O)[C@H]2CCCC[C@H]2C1=O	728073318	FLYNFVNKRCDHPR-HZSPNIEDSA-N	430.490	1.482	50	20	IDGD	
Cc1ccc([N+](=O)[O-])cc1C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	728215889	KZHQWMOPTUYGLQ-UHFFFAOYSA-N	433.490	1.596	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc(F)c(F)c1)NNC(=O)c1cccc(OC(F)F)c1	728545424	HNTFNMPSPXSAFJ-UHFFFAOYSA-N	449.382	1.696	50	20	IDGD	
O=C(NNC(=O)[C@]12CCC(=O)N1c1ccccc1S2)C1CCN(c2ncccn2)CC1	728847400	DDEGDEMZSZYLSN-OAQYLSRUSA-N	438.513	1.469	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@@H]2CCc3c(C)cccc32)cc1	729621087	CLHCFUDAPRJVRU-LJQANCHMSA-N	430.530	1.942	50	20	IDGD	
CON(C)S(=O)(=O)c1ccc(C(=O)NNC(=S)Nc2ccc(N(C)C)cc2)cc1	729689619	OSWFYDSGSIJAOK-UHFFFAOYSA-N	437.547	1.566	50	20	IDGD	
O=C(COC(=O)Cc1ccccc1C(F)(F)F)NNC(=O)[C@H]1COc2ccccc2O1	729763930	XMCJJYIHBGGFGS-MRXNPFEDSA-N	438.358	1.779	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(CCNC(=O)NNC(=O)C(C)(C)c2ccccc2)CC1	731284439	TXBVYKVSKKKVMP-UHFFFAOYSA-N	433.553	1.847	50	20	IDGD	
Cc1noc(C)c1S(=O)(=O)N1CCC(C(=O)NNC(=O)Cc2ccccc2F)CC1	731328328	ADUNYNOAVDPPMC-UHFFFAOYSA-N	438.481	1.221	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)NCCNS(=O)(=O)c1cccc(Cl)c1	731358830	JHOIFKNFJGHKFD-UHFFFAOYSA-N	428.873	1.331	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CNC(=O)N2CCc3ccccc3C2)cc(OC)c1OC	731865291	AOTYKSJPPXYWEY-UHFFFAOYSA-N	442.472	1.241	50	20	IDGD	
Cc1sc2nc(CCC(=O)NNC(=O)CCN3C[C@@H](C)O[C@H](C)C3)nc(O)c2c1C	732261628	FEAJCJUNLQEKJT-VXGBXAGGSA-N	435.550	1.593	50	20	IDGD	
CCOC(=O)/C(C#N)=C/NCC1CCN(S(=O)(=O)c2ccc(OC)c(OC)c2)CC1	732951144	MHWHUENOZZHPIY-JQIJEIRASA-N	437.518	1.665	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)NCc2cc(S(N)(=O)=O)ccc2F)c1C	734551406	WKDWIPHOEQSVCC-CXUHLZMHSA-N	434.493	1.761	50	20	IDGD	
COc1ccc([C@@H]2[C@H](C(=O)NNC(=O)COCc3ccccc3)CCC(=O)N2C)cc1	737634931	QHQBLMJUZMIBMS-DENIHFKCSA-N	425.485	1.969	50	20	IDGD	
Cc1cc(C(=O)NNC(=S)Nc2ccccc2C(C)C)nc2c1c(=O)n(C)c(=O)n2C	738526350	IVBIUYJAXKQLNZ-UHFFFAOYSA-N	440.529	1.695	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)COc1ccccc1Cc1ccccc1)CN1CCOCC1	739050232	UHZUKHFSHONQIL-LJQANCHMSA-N	440.544	1.955	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(O)nc3cc(F)ccc23)c1	739678538	CYYCCFXRQGHXHU-UHFFFAOYSA-N	432.433	1.405	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2ccc(F)c(COCCOC)c2)c2ccccc2c1=O	742034588	QGODIEBFLNCBNI-UHFFFAOYSA-N	442.447	1.793	50	20	IDGD	
CC(=O)N[C@H](Cc1c[nH]c2ccc(Br)cc12)C(=O)NNC(=O)c1cccn1C	742036048	BKWYWNPGWJJNKW-MRXNPFEDSA-N	446.305	1.777	50	20	IDGD	
Cc1nn(C)c(C)c1S(=O)(=O)N[C@@H](C)C(=O)NNc1ccc(Cl)cc1[N+](=O)[O-]	742047987	IITNKYOSILVWQP-VIFPVBQESA-N	430.874	1.409	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)[C@H](C)n2nnc(-c3ccccc3)n2)c2ccccc2c1=O	742474058	AKWVKSHBTAXCNC-AWEZNQCLSA-N	446.471	1.482	50	20	IDGD	
CC(=O)N1CCc2ccc(S(=O)(=O)NNC(=O)c3cccc(Br)c3)cc21	743264509	WPNUIJJWXZSEGU-UHFFFAOYSA-N	438.303	1.981	50	20	IDGD	
CCN(CC1CCN(c2ccccn2)CC1)C(=O)NNC(=O)CNC(=O)c1ccco1	743577073	LYVDXTLELRXBRF-UHFFFAOYSA-N	428.493	1.384	50	20	IDGD	
COc1cc(CCC(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)cc(OC)c1	744618766	AZNDEYOTCIRQIW-UHFFFAOYSA-N	449.529	1.801	50	20	IDGD	
CCC1CCC2(CC1)NC(=O)N(CC(=O)OCC(=O)NNC(=O)c1cccc(C)c1)C2=O	744619935	AOPPLRNJPRUUCT-UHFFFAOYSA-N	444.488	1.190	50	20	IDGD	
Cc1cc(C)n(Cc2cccc(C(=O)NNC(=O)c3csc(N4CCOCC4)n3)c2)n1	745485027	HBVQNCQWPVNSLM-UHFFFAOYSA-N	440.529	1.916	50	20	IDGD	
N#CCCn1cc(/C=C(/C#N)C(=O)NCC(=O)NCCO)c(-c2ccc(Cl)cc2)n1	746227481	ZWZLQYDMMFSKRQ-GDNBJRDFSA-N	426.864	1.249	50	20	IDGD	
COc1cc(C=NNC(=O)CCOc2ccccc2)ccc1OCC(=O)N1CCOCC1	747059424	QNHKZYBJLQWXPO-UHFFFAOYSA-N	441.484	1.852	50	20	IDGD	
C[C@@]12CCC(=O)N1c1ccccc1C(=O)N2CC(=O)NNC(=O)c1cccc2cccnc12	747472519	QXFSXUKCLXTPHZ-DEOSSOPVSA-N	443.463	1.995	50	20	IDGD	
Cn1cc(C=NNC(=O)[C@@H]2Cc3ccccc3CN2Cc2ccccc2)c(=O)n(C)c1=O	747614103	GLQHOHWWGWBAAS-NRFANRHFSA-N	431.496	1.161	50	20	IDGD	
CC(C)CCn1nc(C(=O)NN=C2CCN(S(C)(=O)=O)CC2)c2ccccc2c1=O	747627482	FVBQQAXNWNTDPG-UHFFFAOYSA-N	433.534	1.584	50	20	IDGD	
O=C(NNC(=O)c1cccc(-n2nccc2C(F)(F)F)c1)N[C@@H]1CCS(=O)(=O)C1	749173078	GSNJCOOJCRCTFF-LLVKDONJSA-N	431.396	1.022	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)OCC(=O)N2CCCC[C@@H]2C(N)=O)c(C)n1C[C@H]1CCCO1	749221612	RQYFJYUJTHKBQD-XFVDGSDISA-N	442.516	1.601	50	20	IDGD	
CS(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)c2cc3ccccc3o2)c(F)c1	749867345	UQTKDZHZMNAGFL-UHFFFAOYSA-N	427.435	1.567	50	20	IDGD	
O=C(NCCNS(=O)(=O)c1ccc(Cl)s1)NNC(=O)c1ccc([N+](=O)[O-])cc1	752689361	RPEJZJGGJARGGO-UHFFFAOYSA-N	447.882	1.232	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)N[C@H]2CCN(c3ncccc3F)C2)cc1	756156513	SLQAOBCUFHCUNW-CABCVRRESA-N	431.468	1.996	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)NNC(=O)c2ccc(Cl)nc2)cc1OC	756183229	YCTGGKLXQBMWMF-UHFFFAOYSA-N	427.870	1.972	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)Nc2ccc(F)c(-n3nnnc3C)c2)cc1	756335672	KOPWYTHSZSZJHD-GFCCVEGCSA-N	441.423	1.933	50	20	IDGD	
CN1CCCN(S(=O)(=O)c2cccc(NC(=O)NNC(=O)c3ccccc3O)c2)CC1	756357003	BFYNMLGNSCEXRI-UHFFFAOYSA-N	447.517	1.185	50	20	IDGD	
COC(=O)c1ccc(NC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1C(=O)OC	756818693	UDHOATQOKRHLDD-MRXNPFEDSA-N	429.385	1.253	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)Nc2cnn(CC(=O)N3C[C@@H](C)O[C@H](C)C3)c2)cc1	756839735	SSAXIRGPHKTDCU-HZPDHXFCSA-N	444.492	1.059	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)Nc2c(-c3cnn(C)c3)nc3ccccn23)cc1	757662131	DGTNHGPKEUUUBN-UHFFFAOYSA-N	435.444	1.975	50	20	IDGD	
NC(=O)c1cccc(NC(=O)NNC(=O)c2nc(-c3ccccc3)n(-c3ccccc3)n2)n1	757738940	XZBPXYVWGXETPZ-UHFFFAOYSA-N	442.439	1.895	50	20	IDGD	
COCCCS(=O)(=O)c1ccc(NC(=O)NNC(=O)COc2ccccc2F)cc1	757823367	QIBYSMLZZBFJSK-UHFFFAOYSA-N	439.465	1.868	50	20	IDGD	
O=C(Cc1cnn(-c2ccccc2)c1)N1CCN(S(=O)(=O)CBr)CC1	758534120	CCLWVMVLMVAPMM-UHFFFAOYSA-N	427.324	1.241	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@H](C#N)[C@@H](NC(=O)NNC(=O)c2ccc3c(c2)OCCO3)C1	758759360	LHDDJHZRPMRLCG-KGLIPLIRSA-N	431.449	1.161	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)N[C@@H]1Cc2cccc(O)c2C1	759486015	CPVANRKGIUVGEF-MRXNPFEDSA-N	444.513	1.288	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2cccc(OCC(F)F)n2)c2ccccc2c1=O	760232721	DIJKEUREGRTWPN-UHFFFAOYSA-N	431.399	1.920	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)c1cc(F)c(O)c(F)c1	762621122	DLVGGFYOZQTQOH-UHFFFAOYSA-N	438.862	1.903	50	20	IDGD	
O=C(O)COc1ccc(C=NNC(=O)CNC(=O)c2cccnc2)cc1Br	763195469	LSXYDCOCVJVUSZ-UHFFFAOYSA-N	435.234	1.188	50	20	IDGD	
Cc1c(Br)cc(C(=O)O)cc1S(=O)(=O)NNC(=O)Cc1cccnc1	763279954	GHWFJEJSJBDTAM-UHFFFAOYSA-N	428.264	1.403	50	20	IDGD	
CC1=NC(c2ccc(NC(=O)C(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)cc2)=S=C1	763446861	XVJDJXQPNWQBDR-UHFFFAOYSA-N	425.426	1.482	50	20	IDGD	
CC(C)(C)OC(=O)NCCOc1ccc(NC(=O)C(=O)NNC(=O)c2ccncc2)cc1	763462015	HQBANGJQDOWDSI-UHFFFAOYSA-N	443.460	1.385	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)CCCOc2ccc(Cl)cc2Cl)cnn1C	763505195	IIDHNXQWGCIFOW-UHFFFAOYSA-N	428.276	1.980	50	20	IDGD	
O=C(COc1ccccc1-c1ccccc1)NNC(=O)C(=O)Nc1ccn(CC(F)F)n1	763643973	MLWKDFLAXCBDDM-UHFFFAOYSA-N	443.410	1.980	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2ccccc2SCCC(N)=O)c1	763649885	ZYSFQNOIDHEYNT-UHFFFAOYSA-N	444.513	1.436	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccccc2SCCC#N)cc1	763659497	PBUGKNDDDJWSIK-UHFFFAOYSA-N	428.470	1.866	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(N3CCOCC3)cc2C)cc1C	763666187	CZLJUJQDHAOELP-UHFFFAOYSA-N	440.500	1.613	50	20	IDGD	
CCOC(=O)c1c(C)csc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccccc1F	763855858	BTQVFCTTYXGHCV-LLVKDONJSA-N	437.449	1.926	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cc(C(=O)OC)ccc2F)cc1	763865065	HRRTVSNCWQAKRK-GFCCVEGCSA-N	447.419	1.564	50	20	IDGD	
CC(C)n1cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(Br)c2)cn1	763882857	MFAQQKZARIEPQO-LLVKDONJSA-N	438.282	1.780	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)C(=O)Nc2ccc(OCCC(N)=O)cc2)cc1	763891246	NTHLHMIDNODIJC-UHFFFAOYSA-N	430.486	1.127	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cnn(CC(C)C)c2CC)cc1OC	763903751	STWHLDPPPRFIDW-UHFFFAOYSA-N	431.493	1.909	50	20	IDGD	
CCN(CC)C(=O)COc1ccc(NC(=O)C(=O)NNC(=O)c2cccn2C)cc1Cl	763994121	WUIWWQUOZQKKRD-UHFFFAOYSA-N	449.895	1.325	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cnn(CC(F)(F)F)c3)n[nH]2)cc1	764110856	LWDSDPLVYRWEHU-UHFFFAOYSA-N	435.366	1.544	50	20	IDGD	
O=C(CC(F)(F)F)NNC(=O)C(=O)Nc1ccnn1Cc1ccccc1Br	764116004	IBSXHSLVOOSAEE-UHFFFAOYSA-N	448.199	1.732	50	20	IDGD	
O=C(CC(F)(F)F)NNC(=O)C(=O)Nc1ccc2c(ccn2CCN2CCOCC2)c1	764116065	JLFWVBNSTOENPG-UHFFFAOYSA-N	441.410	1.012	50	20	IDGD	
CC(C)CCC(=O)NNC(=O)C(=O)Nc1cnc2c(c1)C[C@@H](NC(=O)OC(C)(C)C)CC2	764202233	ABVVEMHBERHPJR-HNNXBMFYSA-N	447.536	1.986	50	20	IDGD	
Cc1ccc(C(=O)NC2CC2)cc1NC(=O)C(=O)NNC(=O)Cn1ccc2ccccc21	764239781	ULQWRZFDPZNHHF-UHFFFAOYSA-N	433.468	1.628	50	20	IDGD	
O=C(Cc1ccccn1)NNC(=O)C(=O)Nc1ccccc1-n1cc(Br)cn1	764267270	QOYLXQBBTLFKBE-UHFFFAOYSA-N	443.261	1.358	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)Cc2ccccc2F)cccc1C(=O)N1CCCC1	764314097	SFASJLXYASAUBV-UHFFFAOYSA-N	426.448	1.699	50	20	IDGD	
Cc1nc(N2CCOCC2)ccc1NC(=O)C(=O)NNC(=O)CCCc1cccs1	764341608	PMSKSUMMRJFKOV-UHFFFAOYSA-N	431.518	1.397	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)ccc1C(=O)N(C)C	764377967	UFLJKSBLNAUHCA-UHFFFAOYSA-N	440.485	1.548	50	20	IDGD	
N#CCOc1cc(F)ccc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	764388614	UFCANQMYWJCLPO-UHFFFAOYSA-N	440.366	1.657	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)CCc3nnc(C(C)C)o3)CC2)cc1	766641794	MQQZYUUGGZCWRV-UHFFFAOYSA-N	428.537	1.399	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(Br)s1)NNc1ncnc2ccsc12	766680550	MKKAXVXMPQPEPC-UHFFFAOYSA-N	448.349	1.937	50	20	IDGD	
COc1cccc(-c2cc(C(=O)OCC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)n[nH]2)c1	767600699	IFCRUAZASKDRRK-UHFFFAOYSA-N	439.384	1.612	50	20	IDGD	
CCn1c(O)nc2cc(C(=O)NNC(=O)c3cc(-c4ccccc4OC)[nH]n3)ccc2c1=O	768273292	CDRICHDCZPEFAD-UHFFFAOYSA-N	448.439	1.596	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)[C@]1(F)CCN(C(=O)OC(C)(C)C)C1	768628882	BLFSCLWIHIWMPB-SFHVURJKSA-N	431.486	1.891	50	20	IDGD	
CCn1c(O)nc2cc(C(=O)NNc3nc(O)c4cnn(C(C)(C)C)c4n3)ccc2c1=O	770967200	ZQQMCMPDYZYGBT-UHFFFAOYSA-N	438.448	1.479	50	20	IDGD	
COc1ccc(-c2nnc(SCC(=O)NNc3nc(O)c4cnn(C)c4n3)o2)cc1	770972869	KAACCJIIOYYYDS-UHFFFAOYSA-N	428.434	1.363	50	20	IDGD	
Cc1ccc(C(=O)NNc2nc(O)c3cnn(C)c3n2)cc1S(=O)(=O)N1CCCCC1	770983513	MMTDKWZTSIGEKX-UHFFFAOYSA-N	445.505	1.309	50	20	IDGD	
O=C(CN1C(=O)[C@H]2CCCC[C@H]2C1=O)NNC(=S)Nc1cccc(Br)c1	770993525	QEWIIQSCSAXDCB-BETUJISGSA-N	439.335	1.942	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3c(C)cccc3[N+](=O)[O-])CC2)cc1	772384616	GSIAWQGJEAOFTK-UHFFFAOYSA-N	425.489	1.790	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NCC2CCN(c3ccncc3)CC2)c2ccccc2c1=O	772611348	FAKDJYRBRXWKAP-UHFFFAOYSA-N	435.488	1.189	50	20	IDGD	
O=C(Cc1ccc(Cl)cc1)NNC(=O)Nc1cnn(Cc2nnc3n2CCCC3)c1	772636230	LCLHUWKUVZFFKG-UHFFFAOYSA-N	428.884	1.908	50	20	IDGD	
COc1cc(OC)cc(C(=O)NCC(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)c1	772995841	PAGWBFYLOFLRLE-GFCCVEGCSA-N	435.864	1.702	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)C[C@H]2Oc3ccccc3NC2=O)C1	773411762	QYDHHILBUVFAKX-XJKSGUPXSA-N	432.477	1.571	50	20	IDGD	
C=CCOc1cccnc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	775135079	CXDBVTQGWLCRSQ-UHFFFAOYSA-N	430.486	1.506	50	20	IDGD	
NC(=O)CC[C@@H](C(=O)NNc1ncc(Cl)cc1Cl)N1C(=O)c2ccccc2C1=O	775275473	ITOOCNWBIOODMD-ZDUSSCGKSA-N	436.255	1.762	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)Nc2ccc(C[C@H]3NC(=O)NC3=O)cc2)c1	775703215	NVHMWINELFENTD-QGZVFWFLSA-N	425.445	1.286	50	20	IDGD	
CN(NC(=O)Cc1cccc(OCC#N)c1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776201528	JIYDIMVEUDLPAM-UHFFFAOYSA-N	431.493	1.767	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2[nH]cnc2C(=O)c2ccccc2)c2ccccc2c1=O	776315379	TYRICTXZTYVYQU-UHFFFAOYSA-N	430.424	1.445	50	20	IDGD	
CC(C)N1C(=O)C[C@@H](C(=O)NNc2ccc(C(N)=O)nn2)[C@@H]1c1ccc(Cl)c(F)c1	776488403	NONVBTAFJXCBOY-DIFFPNOSSA-N	434.859	1.809	50	20	IDGD	
CCOC(=O)N1CCC[C@@H]([C@H](C)NC(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)C1	777263870	BPHHTVKDXZQBTH-JKSUJKDBSA-N	433.509	1.829	50	20	IDGD	
COc1ccc(Cn2cc(C(=O)NNC(=O)c3c(C)nc4ccccn34)cn2)cc1OC	778318520	QJSPVJNKUBZAEN-UHFFFAOYSA-N	434.456	1.980	50	20	IDGD	
O=C(NN=c1cc[nH]cc1)C(=O)Nc1cccc(Oc2ncc(Br)cn2)c1	783370088	JWLRAMXXMZECLR-UHFFFAOYSA-N	429.234	1.930	50	20	IDGD	
NC(=O)Cc1ccc(NC(=O)C(=O)NNc2c(F)cc(F)cc2Br)cc1	785010481	DBISUGMHPUISTN-UHFFFAOYSA-N	427.205	1.837	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)cc1Br	785067162	HTHNTMJXGMCJRC-UHFFFAOYSA-N	430.262	1.734	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2ccc(OC)c(NS(C)(=O)=O)c2)cc1Cl	785116031	BDMHIGICHGGDQP-UHFFFAOYSA-N	442.881	1.811	50	20	IDGD	
Cc1cc2ccc(Cl)cc2nc1NNC(=O)C(=O)N=c1cc[nH]c(C(=O)N(C)C)c1	785164215	ASKJDEHBJWLHPP-UHFFFAOYSA-N	426.864	1.797	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)cc1O	785439170	LSQVSZZPZPCKSB-UHFFFAOYSA-N	428.470	1.513	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cccc3c2OCC3(C)C)cc1OC	789244349	LFQLMHJFHZACKK-UHFFFAOYSA-N	428.441	1.992	50	20	IDGD	
COC(=O)CCc1cccc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)c1	789821475	TYLPHIIQHDNPOQ-ICSRJNTNSA-N	439.468	1.451	50	20	IDGD	
O=C(NNc1nccnc1Cl)C(=O)Nc1ccc2c(c1)N(CC(F)F)C(=O)CS2	793048481	GHENGGXSMFCGOM-UHFFFAOYSA-N	442.835	1.916	50	20	IDGD	
CC(=O)c1cccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)c3cccc(C)n3)CC2)c1	794082085	XGUILWUSEIFDFC-UHFFFAOYSA-N	444.513	1.455	50	20	IDGD	
Cc1cccc(CC2(O)CCN(CC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)CC2)c1	796490130	BOBBSEFYFAPEFL-UHFFFAOYSA-N	426.473	1.734	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN[C@@H]2[C@@H](C)CCN(C(=O)OC(C)(C)C)[C@H]2C)n1	796649856	IQBLEQMDFYDCKF-XAYKYTGQSA-N	439.582	1.765	50	20	IDGD	
CCn1ncc2cc(C(=O)NNc3ccccc3S(=O)(=O)N3CCOCC3)c(C)nc21	799652772	SQSLKXLAWOBFNA-UHFFFAOYSA-N	444.517	1.537	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2CSCN2C(=O)c2ccc(Cl)cc2)cc1	801109288	JMKHDIGAQKTBFM-INIZCTEOSA-N	446.916	1.950	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1cccc(NN2C(=O)[C@H]3CC=CC[C@@H]3C2=O)c1	801882250	XQRABDPAGFXXQM-RCBQFDQVSA-N	428.445	1.067	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(/C#N)C(=O)NS(=O)(=O)[C@H](C)[C@@H](C)C(=O)OC)c1C	802163939	TZMMEKKSKRCBLO-TZOSCCHESA-N	439.534	1.863	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(NC(=O)C(=O)NNc2nccc3sccc23)ccc1F	807002415	XLKJIXHTIKRFMO-UHFFFAOYSA-N	437.478	1.768	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CNS(=O)(=O)c2ccc(OC(F)(F)F)cc2)c1	810346748	HVJAXLFHNQZGIC-UHFFFAOYSA-N	442.375	1.196	50	20	IDGD	
COc1ccc(-n2nnc(C(=O)NNc3ccc(S(=O)(=O)N(C)C)cc3)c2C)cc1	812726295	ASEBGIFQICFRPE-UHFFFAOYSA-N	430.490	1.592	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2ccc(NNC(=O)c3cncn3C)c([N+](=O)[O-])c2)cc1	813362555	DRARPQOSUUTUHO-UHFFFAOYSA-N	446.445	1.895	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)COc2ccc(Cl)c(F)c2)cc1	814723447	GAWUHQLABVNXSS-UHFFFAOYSA-N	443.884	1.634	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccc(N(C(C)=O)[C@H]2C[C@@H]2C)cc1	815568552	MHMNDBCGZXJGJS-LIRRHRJNSA-N	438.484	1.785	50	20	IDGD	
COC(=O)N1CCN(c2ccc(NC(=O)C(=O)NNc3ccc(Cl)nc3)cn2)CC1	815601716	CTVCINZRSXRZRL-UHFFFAOYSA-N	433.856	1.100	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl	815751470	AMEGCQVDMFNTOD-UHFFFAOYSA-N	441.853	1.580	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)[C@@H]2CC(=O)N(c3ccc(C)c(F)c3)C2)n1	844514258	VLGZZEDPEUCJEC-CYBMUJFWSA-N	448.476	1.185	50	20	IDGD	
O=C(c1ccc(Cl)c(S(=O)(=O)N2CCc3ccccc32)c1)N1CC[C@H](B(O)O)C1	864234710	UKYBTHAOHRMJJH-HNNXBMFYSA-N	434.710	1.780	50	20	IDGD	
COc1ccccc1OCC(=O)NN=Cc1c(N2CCOCC2)nc2ccccn2c1=O	864237090	JAKGJQHJHZGADP-UHFFFAOYSA-N	437.456	1.069	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)[C@@H]2Cc3ccccc3CN2C(C)=O)cc1	912608287	XBQNQLWGMXRUMU-VFNWGFHPSA-N	425.485	1.973	50	20	IDGD	
O=C(CNS(=O)(=O)c1cc(C(F)(F)F)ccc1Cl)NNC(=O)c1ccccn1	912770469	JHAYDJBGDBEFSH-UHFFFAOYSA-N	436.799	1.493	50	20	IDGD	
CN(C)[C@H](CNC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)c1ccccc1Cl	915904227	VMWKLRNQIXUZJU-QGZVFWFLSA-N	442.907	1.834	50	20	IDGD	
C[C@H](CN1CCOCC1)NC(=O)NNC(=O)COc1ccc(OCc2ccccc2)cc1	916470474	LSBUVSCYFWVBBU-GOSISDBHSA-N	442.516	1.696	50	20	IDGD	
Cn1c(N)c(C(=O)/C(C#N)=C/c2cccc(OCc3cccc(C#N)c3)c2)c(=O)n(C)c1=O	917623379	MJGFZDGQLPVTFE-VCHYOVAHSA-N	441.447	1.907	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNS(=O)(=O)CCc2ccccc2)cc1	917717804	YISVSROGYPKPOP-UHFFFAOYSA-N	431.543	1.914	50	20	IDGD	
CC(=O)N[C@@H](C)c1ccc(S(=O)(=O)NNC(=O)[C@@H]2COc3ccccc3O2)s1	918399375	NCLYMILKPVVYKB-HZMBPMFUSA-N	425.488	1.095	50	20	IDGD	
CCCC(=O)N1CCCC[C@@H]1C(=O)OCC(=O)NNC(=O)c1ccc(OC)c(OC)c1	919617978	WCQMUUSJOOLRHO-OAHLLOKOSA-N	435.477	1.189	50	20	IDGD	
O=C(NN=Cc1cc(Br)ccc1OC(F)F)N[C@@H]1CCS(=O)(=O)C1	920384975	SPSAWBXRPAMJQT-SNVBAGLBSA-N	426.239	1.871	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)NCc2cccc(OCCN3CCOCC3)c2)c1	920838364	KNPZFLKMCMDPOO-UHFFFAOYSA-N	441.532	1.608	50	20	IDGD	
Cc1nn(C(F)F)c(C)c1CC(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	920884997	WRNUUHIBMHTQBR-UHFFFAOYSA-N	435.840	1.200	50	20	IDGD	
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC[C@H](C(=O)NNC(=O)c2ccccc2Cl)C1	1115988422	ZJCQLKMZKOWEBP-ZDUSSCGKSA-N	439.925	1.542	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCN(c2ccc3c(c2)OCCO3)C1=O)c1cncn1-c1ccccc1	1116007841	INDCKHLVLFQFLX-QGZVFWFLSA-N	447.451	1.458	50	20	IDGD	
N#Cc1ccc(N2CCC(NC(=O)NNC(=O)c3cncn3-c3ccccc3)CC2)nc1	1318228191	JNASHAWVXFIWOL-UHFFFAOYSA-N	430.472	1.752	50	20	IDGD	
C[C@@H]1CN(S(=O)(=O)c2cc(C(=O)NNc3ccn(C)n3)ccc2Cl)C[C@@H](C)O1	1321105208	MMMQVODHYJLMQS-VXGBXAGGSA-N	427.914	1.628	50	20	IDGD	
CCCCC(=O)N1CSC[C@@H]1C(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1	1339204554	LEKPEGJWGZWJIA-OAHLLOKOSA-N	442.582	1.873	50	20	IDGD	
Cc1cccc2c(=O)n(CC(=O)NNC(=O)C3CCN(C(=O)OC(C)(C)C)CC3)cnc12	1339205077	RAXGISQTJKILLS-UHFFFAOYSA-N	443.504	1.499	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)Cn3c(=O)n(C)c4ccccc43)C2)C1	1778161577	HXMKKUUJGSJXGM-ZHRRBRCNSA-N	448.951	1.577	50	20	IDGD	
Cc1cscc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2	1778221730	CIDNNPKYURAAJO-DENIHFKCSA-N	442.346	1.178	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(CCN(C(=O)COc3cc(Cl)ccn3)C2)C1	1779229839	LJQKIALGKCPJSZ-LJQANCHMSA-N	441.988	1.795	50	20	IDGD	
C=C[C@@H](O)C(C)(C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CO[Si](C)(C)C)C1	1779545531	VUARAULFWZHROY-CBGDNZLLSA-N	426.630	1.925	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnc4snnc4c3)C2)C1	1780071619	IFTKFPPOIJPJLR-QLJPJBMISA-N	440.323	1.313	50	20	IDGD	
COc1cc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)ccc1O	1780745471	CBIRZZYRNAYXDB-DJJJIMSYSA-N	441.322	1.875	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2c(O)cc(O)cc2O)C1	1781029011	NKHNXMBGQMSHMD-GQWAEJPESA-N	442.896	1.185	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)[C@H]3CCc4nc[nH]c4C3)CCO2)C1	1781231876	BBHHBKCGABSXCB-FASAQXTFSA-N	429.348	1.581	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(C)(C)C(C)(F)F)C2	1782209383	LFFNAOHMMIAMDA-QVKFZJNVSA-N	446.539	1.555	50	20	IDGD	
CSCC[C@H](O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)Br)C2	1782232162	ZPKMIKGRWDTJLF-SZOQZIPDSA-N	437.400	1.398	50	20	IDGD	
O=C(C(Cl)Cl)N1CC[C@]2(C1)CN(C(=O)[C@H]1CCc3ccccc3[C@H]1O)CCO2	1783943328	VTYJBAGMMVVHOP-YRNRMSPPSA-N	427.328	1.916	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](O)c3ccccc3Cl)C2)C1	1784251677	OQBZVURQUGTNPF-CDHAZOANSA-N	445.741	1.987	50	20	IDGD	
NC[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)c1ccccc1	1786924245	GWGQIXNRYHCBNJ-QUSNUVHPSA-N	442.329	1.399	50	20	IDGD	
CC(C)c1nn2ccccc2c1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21	1787256852	INQRZTJFUBBQFO-LAQRGFTBSA-N	448.951	1.651	50	20	IDGD	
COCc1oncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21	1787722351	AKCMCBZJHUMDGO-HVTMNAMFSA-N	434.262	1.105	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4c(c3)NC(=O)CO4)[C@H]2C1	1788362601	VDEGNASOIFIOMU-AFIMGQEJSA-N	435.908	1.628	50	20	IDGD	
CC(=O)N[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Cl)C[C@@H]21)c1ccc(F)cc1	1789696057	HNELCQCVXJWLTA-PEJOBZMASA-N	443.878	1.517	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)c1cccn2nccc12	1790399857	NOZDJQPYOSORSS-MZGVZZPPSA-N	439.285	1.618	50	20	IDGD	
COc1cccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](C)Br)[C@H]3C2)n1	1791057166	OIRJTJGWIBLMMC-ABHRYQDASA-N	426.311	1.467	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCCn3ccnc3C)[C@H]2C1	1791572416	MCKAWCSAPUGIJM-FJIDUMEYSA-N	426.945	1.205	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1ccc(C2(NC(=O)[C@@H]3CCNC(=O)C3)CCC2)cc1	1791602666	YNLSXBKTSLYFJM-OAHLLOKOSA-N	429.521	1.020	50	20	IDGD	
COC(=O)[C@@H]1CC[C@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CO[Si](C)(C)C)C3)C1	1792969886	RFBHAMRNPKHPKN-WXQHOCMDSA-N	426.586	1.017	50	20	IDGD	
C[C@H](CBr)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1(N3CCN(C)CC3)CC1)C2	1792991458	IABWYSAFMXXKCU-WCXIOVBPSA-N	441.414	1.436	50	20	IDGD	
CC[C@@H](C)[C@H](O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)C2	1793398808	CMGDSCSLMYAOOO-JIOGVWDZSA-N	447.482	1.868	50	20	IDGD	
COc1ccc(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CCC(=O)NN(C)C)C3)cc1C	1793894619	HBKHMWPQVFWRFR-REPLKXPHSA-N	430.549	1.557	50	20	IDGD	
Cc1nc(C)c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)CBr)C3)s1	1794696518	UOWLKJCBKSCGFB-WTDIUWLJSA-N	430.368	1.994	50	20	IDGD	
O=C(/C=C/c1ccc(F)cc1F)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1	1796187958	POGGKQKWGYAXJO-BXKBSFEHSA-N	440.255	1.610	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1nc2cc(C)c(C)cc2[nH]1	1797672603	MDGNXMFQTDIHBG-KRXQYRFLSA-N	434.924	1.637	50	20	IDGD	
C=C(Oc1ccccc1O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Br	1799347567	PYONXKCIRGKQCP-NOXHYTERSA-N	443.269	1.565	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCc1cnc2[nH]ccc2c1	1800846595	PBQUFSZOEKCHHZ-PTOXDTDZSA-N	449.349	1.869	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Br)C2	1800960794	JIZLYELZZYYQMJ-OWDFPOFWSA-N	443.338	1.115	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(C)nn1-c1ccccc1)C2	1800975967	ZWSSBHATPCFNQX-YNVMFWSZSA-N	446.935	1.638	50	20	IDGD	
C[C@H](NC(=O)c1ccccc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(Cl)Cl	1801021012	DSVJIEUGZFGYCB-MHEUCROKSA-N	428.316	1.198	50	20	IDGD	
C[C@H](Oc1cccnc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@](C)(Cl)CCl)C2	1801404602	XWRDXJUAOPQMQI-WXZWTWHISA-N	430.332	1.675	50	20	IDGD	
O=C(CCc1c[nH]c2ncccc12)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2	1802065478	DDYFRMZZVXGDOM-CCWDJLKJSA-N	449.349	1.870	50	20	IDGD	
CO[C@@H](C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN(C)NC(=O)NCc1ccccc1)C2	1802388601	FAKPAULFQKUBNW-KANFNMMFSA-N	431.537	1.006	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@H]1CCN(C(=O)Cn2nccn2)[C@@H]1c1cccnc1	1803015794	OQKGRZZACNISFA-FRFSOERESA-N	435.326	1.410	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)[C@@H]1CC=CCC1	1803026602	QLIVTIMXWSBZGO-NQSCKRDGSA-N	433.317	1.437	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CCc2ccc(F)nc2)[C@@H]1c1cccnc1)[C@H](O)CCl	1803135550	FBUNSMVCLXOGMP-SQGPQFPESA-N	434.899	1.854	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)CCN2C(=O)C=CC2=O)[C@H]1c1cccnc1	1803920193	UOQYACXLSWIXIM-TWOQFEAHSA-N	432.908	1.420	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC2(CCCN(C(=O)c3ccc(F)nc3F)C2)CC1	1804684114	GDISVWJSYLYFOC-UHFFFAOYSA-N	437.491	1.578	50	20	IDGD	
Cc1cncc(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)c1	1807363846	OVPKBMVACKSWJG-DENIHFKCSA-N	444.300	1.098	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H]2C[C@]2(F)Cl)[C@H]1c1cccnc1)c1cccc(B(O)O)c1	1807373302	AWCIFHTWZYCOAB-QUJKESNLSA-N	445.687	1.006	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)CNC(=O)C(F)(F)F)[C@@H]1c1cccnc1	1808277309	BMRWJOMWIUEEMV-VNHYZAJKSA-N	434.846	1.783	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)N1CC[C@H](CNC(=O)[C@](C)(Cl)CCl)[C@@H]1c1cccnc1	1808302932	MXHZKSCIYMPBLB-MMMWYMCRSA-N	444.363	1.771	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC2(CCCN(C(=O)c3cc(C)no3)C2)CC1	1808412170	KLKPDNVYWUFBPF-LFVJCYFKSA-N	440.504	1.962	50	20	IDGD	
CC(C)CNC(=O)C(=O)N1CC[C@H](CNC(=O)[C@H](F)Br)[C@@H]1c1cccnc1	1808661725	CXTNOXAKMZYRCA-ILXRZTDVSA-N	443.317	1.550	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC2(CCCN(C(=O)[C@H]3CNc4ccccc43)C2)CC1	1809809280	MDGFVPGHDTWINP-IBGZPJMESA-N	441.576	1.800	50	20	IDGD	
O=C(Cc1ccsc1)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1	1809966595	HORVWIXMVIWPRC-UHFFFAOYSA-N	426.347	1.515	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2cc3n(n2)CCC3)[C@@H]1c1cccnc1	1813031014	IQJSHBWMZYFKBN-VDZJLULYSA-N	431.924	1.798	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2cnn3c2CCC3)[C@@H]1c1cccnc1	1813034218	DYUAJEHXSMHAKR-HHXXYDBFSA-N	431.924	1.798	50	20	IDGD	
O=C(C#Cc1ccccc1)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1	1815339986	YZMAHQUOBYWQPQ-SFHVURJKSA-N	445.309	1.100	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@](C)(O)C(F)(F)F)n[nH]1	1815533962	UKTKXUOEFBOALA-SJKOYZFVSA-N	448.446	1.088	50	20	IDGD	
O=C(CNC(=O)c1ccco1)Nc1nc2c(s1)C[C@H](NC(=O)C(Cl)Cl)CC2	1815656534	VWMFRXYHIWFBFC-MRVPVSSYSA-N	431.301	1.882	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1nccs1	1816568952	UUNSAGLUYKTMLM-HNNXBMFYSA-N	425.279	1.166	50	20	IDGD	
C[C@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](F)Cl)[nH]n1)[C@H]1SC(=N)NC1=O	1818099688	YXNHQZMSDGCKGB-DFJQSBMWSA-N	430.893	1.739	50	20	IDGD	
CCN(C)[C@@H](C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819404105	YMSXZAQSUIDJPR-SUMWQHHRSA-N	442.524	1.054	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)Cn1ccncc1=O)CC2	1822869280	HXAWXOBHHBTCIF-QGHHPUGFSA-N	444.344	1.548	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1	1823003795	MEYUFSABDSGNLS-MHYGZLNHSA-N	436.307	1.193	50	20	IDGD	
COC[C@H](C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1	1824606240	YAANCCHELYFPMK-KXBFYZLASA-N	431.537	1.201	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCSC(=N)N)CC2	1825642978	XMCLNIDPCSJQRI-YUMQZZPRSA-N	434.385	1.855	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H]1CC[C@@H](C(=O)OC)C1)CC2	1825994412	LEDJWRWIOHJACN-LOWDOPEQSA-N	443.953	1.898	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](C)Cn3ccnc3)sc2C1	1826833524	AWHDUFZMHXVTMI-XQQFMLRXSA-N	425.942	1.842	50	20	IDGD	
Cn1cc(CC(=O)Nc2nc3c(s2)C[C@@H](NC(=O)CCBr)CC3)cn1	1826936842	VUPQRDZLPAQOCD-NSHDSACASA-N	426.340	1.816	50	20	IDGD	
Cc1cc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)CC2)on1	1828925218	IHJGZKZLRGNLBY-GOSISDBHSA-N	440.504	1.529	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc4c3NC(=O)C4)C2)C1	1830366303	OVRRSLJWTOEQEF-QFIPXVFZSA-N	449.935	1.516	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cncs3)C2)C1	1830537555	KFDRJGJMKBIDLN-BLLLJJGKSA-N	432.340	1.244	50	20	IDGD	
COc1ccc(Cl)c(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)c1	1830738358	NWMUSHXDYKGVFE-LPHOPBHVSA-N	447.315	1.018	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(O)nc(O)n2)CC1	1831652897	MGNUVGMHWYIUIU-BXUZGUMPSA-N	441.326	1.905	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CSCC(=O)OC)CC1	1831828967	WGICANJPAHVKKU-HZPDHXFCSA-N	434.986	1.766	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CSc2nc[nH]n2)CC1	1832151614	FSILZNZKFBNFQV-CABCVRRESA-N	429.974	1.770	50	20	IDGD	
Cc1ccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)cn1	1833132380	BFRRGFIYWQEXOQ-VQTJNVASSA-N	444.359	1.625	50	20	IDGD	
CN1CCN(CC(=O)N2CCC(N3CCC(NC(=O)C(C)(C)CCl)CC3)CC2)CC1	1833214863	SUVDQAGOEURRAH-UHFFFAOYSA-N	442.048	1.070	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)C3(Br)CC3)CC2)CC1)[C@H](O)CCl	1833313590	MBWAGSZDGCALHY-CQSZACIVSA-N	436.778	1.085	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccnc3C)CCO2)C1	1834043387	WAROZWAOPLMSQQ-QFBILLFUSA-N	440.338	1.634	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cncc(F)c3)CC2)CC1	1834256823	FQEJEIAHVXYUJT-SFHVURJKSA-N	426.920	1.660	50	20	IDGD	
CC(C)c1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)no1	1834498826	KYNLPEXECISUSI-WMLDXEAASA-N	448.289	1.559	50	20	IDGD	
O=C(CCc1cccs1)N1CCOC[C@@]2(C1)CN(C(=O)CCBr)CCO2	1834819227	KRRRYRQGPJFNCR-GOSISDBHSA-N	445.379	1.922	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3nc4ccccn4n3)CC2)CC1	1834969842	TZVIFNQHVDWQJO-KRWDZBQOSA-N	432.956	1.932	50	20	IDGD	
CN(C)c1ccc(C(=O)NC2CCN(C3CCN(C(=O)[C@H](O)CCl)CC3)CC2)cc1	1836294785	OCXIJPVWUPLGPC-HXUWFJFHSA-N	436.984	1.538	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)[C@@H]3CCCN(C)C3)CC2)CC1	1836352543	YUIJWACJFYEKFJ-JKSUJKDBSA-N	443.430	1.683	50	20	IDGD	
O=C(C1=NO[C@H](c2ccccc2)C1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1836587278	IDNBBGWISQGRRQ-ABSDTBQOSA-N	439.871	1.495	50	20	IDGD	
O=C(Cc1ccc2c(c1)CCCO2)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1836680086	QHDAWAYLZYBMPV-FPOVZHCZSA-N	440.899	1.545	50	20	IDGD	
O=C([C@H](F)Br)N1CCOC[C@]2(C1)CN(C(=O)C1(C(F)(F)F)CC1)CCO2	1836719667	OVEBSRNEFDASNB-GWCFXTLKSA-N	447.223	1.476	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccc(C#N)cc3)C2)C1	1837709286	WZNBDRHZIAPMLT-JOCHJYFZSA-N	445.592	1.409	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3[nH]cc4c3CCC4)C2)C1	1837715304	IAHZNQYVSFBDTI-OAQYLSRUSA-N	435.597	1.425	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(F)cnc3Cl)CCO2)C1	1837859522	HMSLOSSQBSRWAV-KSSFIOAISA-N	434.295	1.962	50	20	IDGD	
C=CC[C@@H](C)C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1	1837920161	OZFZVRHGRMDZNR-QGZVFWFLSA-N	428.338	1.191	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3sccc3Cl)CCO2)C1	1838228002	XXFMXMFUZWYRPY-GUYCJALGSA-N	437.345	1.725	50	20	IDGD	
C=C(C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2)C(F)(F)F	1839155256	PNFJCJOCFDYKQT-LSDHHAIUSA-N	433.254	1.798	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(O)ccc3F)CCO2)C1	1839296819	YJPXRHADTQVDQZ-KPZWWZAWSA-N	445.285	1.385	50	20	IDGD	
Cc1ccc(CCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)cn1	1840186642	RUVHALUDDCXNCK-LJQANCHMSA-N	430.332	1.583	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(C)cc3Cl)CCO2)C1	1840697390	VDMBUZVZLAJHTA-PXNSSMCTSA-N	445.343	1.972	50	20	IDGD	
Cc1cccc(C)c1N1C[C@H](C(=O)N2CC3(CCCN3C(=O)[C@@H](O)CCl)C2)CC1=O	1841350328	VNZSXBLQTNEYCM-SJORKVTESA-N	433.936	1.459	50	20	IDGD	
O=C(c1ccc(Cl)nc1Cl)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843014159	DXTDMXAXLLKETM-UHFFFAOYSA-N	434.088	1.199	50	20	IDGD	
CCOC(=O)c1cc(C(=O)N2CCCC23CN(C(=O)[C@@H](F)Br)C3)ccn1	1844791619	OUAJQYGYAIIZRR-CYBMUJFWSA-N	428.258	1.766	50	20	IDGD	
CN(CC(=O)N1CCCC12CN(C(=O)[C@H]1CC=CCC1)C2)NC(=O)NCc1ccccc1	1845039206	RDTPRJMJRJEYBY-FQEVSTJZSA-N	439.560	1.892	50	20	IDGD	
Cn1c(=O)n(C)c2cc(C(=O)N3CC4(CCCN4C(=O)[C@@](C)(Cl)CCl)C3)ccc21	1845170799	ONFVHRTUBYBZFI-IBGZPJMESA-N	439.343	1.930	50	20	IDGD	
O=C([C@@H](Br)Cc1ccccc1)N1CC2(CCCN2C(=O)Cn2nccn2)C1	1845266365	CKQSOPZYHOVILM-INIZCTEOSA-N	432.322	1.488	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H]2CC[C@@H](C2)[C@H]1C(=O)N1CCCC12CN(C(=O)[C@@H](O)CCl)C2	1846143378	YTGXTTBSBKLGNB-VGWMRTNUSA-N	441.956	1.578	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)Cn1c(=O)n(C)c2ccccc21	14372626	HLKUIKHWXVZPPC-LBPRGKRZSA-N	447.289	1.717	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccccc1Cl)NNC(=S)NCCc1cccs1	21125024	WMITWYPRRVBPFU-UHFFFAOYSA-N	447.007	1.808	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(C(=O)NNC(=S)Nc2cccc(C)c2C)cc1	28615889	CLSNEBZNXQJCBH-UHFFFAOYSA-N	436.559	1.860	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@H](CC(C)C)N2C(=O)[C@H]3CC=CC[C@H]3C2=O)cc1OC	197983879	NFQFVVXGLMHCER-BBWFWOEESA-N	443.500	1.831	50	20	IDGD	
COc1ccc(/C=C\C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1OC	209351608	QMXMXPMVQFJPKE-IBHIWXBSSA-N	442.424	1.248	50	20	IDGD	
CC(=O)c1cccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c1	726871416	PVISEBOYBMLZRY-UHFFFAOYSA-N	446.485	1.377	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)NC[C@H](c1cccc(Cl)c1)N1CCOCC1	726980179	PEIPCGIBDUAPLG-MRXNPFEDSA-N	449.895	1.067	50	20	IDGD	
CSCC[C@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	727116357	VNYDVLJKGBOKJG-AWEZNQCLSA-N	435.510	1.070	50	20	IDGD	
CN(C)N(C(=O)[C@@H]1CCCN(C(=O)c2ccc(Cl)cc2)C1)[C@@H]1CCS(=O)(=O)C1	728176901	OYATVDDKVBKSEA-NVXWUHKLSA-N	427.954	1.685	50	20	IDGD	
CCCNC(=O)NNS(=O)(=O)c1ccc(S(=O)(=O)N2C[C@@H](C)C[C@H](C)C2)cc1	728262592	HBFPXTFNJJREKB-KBPBESRZSA-N	432.568	1.256	50	20	IDGD	
COc1ccc(CCNC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)cc1F	728302755	TVSHGSYQVBMWRW-UHFFFAOYSA-N	437.497	1.623	50	20	IDGD	
CCOC(=O)C1=NN(c2ccccc2)[C@H](C(=O)NNC(=O)c2c(C)nc3ccccn23)C1	728712896	IFPOVCDCTYHKGS-KRWDZBQOSA-N	434.456	1.602	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)[C@@H]1CS[C@H](Cc2ccccc2F)C(=O)N1	729450932	AZQHHWDVNJYXIM-PKOBYXMFSA-N	440.500	1.771	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)CCc2c(C)nc3[nH]n(C)c(=O)c3c2C)c1	729511358	MEPZOKSXDAFJTC-UHFFFAOYSA-N	427.461	1.289	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)[C@@H]1CCN(c2ccc3c(c2)OCCO3)C1=O	730512637	OODKGQFOYYBCFE-HNNXBMFYSA-N	441.440	1.046	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NC(=O)NNC(=O)COc2ccccc2O)cc1	730893944	VTQPRSRJISDARR-UHFFFAOYSA-N	436.490	1.654	50	20	IDGD	
CN(c1ccc(CNC(=O)NNC(=O)c2cccc3ncccc23)cc1)S(C)(=O)=O	732256836	QNVFURVORFXFEC-UHFFFAOYSA-N	427.486	1.775	50	20	IDGD	
COc1ccc([C@@]2(C)NC(=O)N(CC(=O)NNc3ccc(Br)nc3)C2=O)cc1	732838561	HAJBSWYEGFIMQM-GOSISDBHSA-N	448.277	1.763	50	20	IDGD	
O=C(NNc1nccnc1Cl)[C@@H]1CCCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1	734261318	OIDXZDSLHMPSIH-LLVKDONJSA-N	440.869	1.582	50	20	IDGD	
COc1ccc(CN2CC[C@@H](NC(=O)NNC(=O)[C@H](C)Oc3ccccc3F)C2=O)cc1	734685815	VVTUNGLASPTDKY-KBXCAEBGSA-N	444.463	1.733	50	20	IDGD	
C[C@H](CC(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1)NC(=O)C1CCCC1	734822434	WBWQUBLVJQBSFN-CQSZACIVSA-N	439.557	1.801	50	20	IDGD	
Cc1cc(F)ccc1N1CCC[C@@H](NC(=O)NNC(=O)CNC(=O)c2cccs2)C1	735326506	OOXVMPWCORUCCL-OAHLLOKOSA-N	433.509	1.925	50	20	IDGD	
Cc1cc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)c3cnn(C)c3)cc2)ccc1F	735471129	QDNPUJAEIZPQSF-UHFFFAOYSA-N	431.449	1.743	50	20	IDGD	
CSCC[C@H](C(=O)NNC(=O)COCc1ccccc1)N1C(=O)[C@H]2CCCC[C@@H]2C1=O	737634837	OERVBRCYIRMYLQ-OKZBNKHCSA-N	447.557	1.648	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H]1CCC[C@H]1C(=O)NNC(=O)c1csc(N2CCOCC2)n1	739679855	DPIKSWYHARLERO-OLZOCXBDSA-N	439.538	1.434	50	20	IDGD	
COc1ccc(-c2n[nH]c(CNC(=O)NNC(=O)c3nn(-c4ccccc4)cc3O)n2)cc1	741418331	OEGAIOYANWTQGC-UHFFFAOYSA-N	448.443	1.516	50	20	IDGD	
NC(=O)CS(=O)(=O)c1ccc(C(=O)NNC(=O)CSc2ccc(Cl)cc2)cc1	742471646	IGHMDXAEFLMIQA-UHFFFAOYSA-N	441.918	1.152	50	20	IDGD	
COc1ccccc1O[C@H](C)CNC(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	743692370	XYIPYHUPSJCORL-CQSZACIVSA-N	425.445	1.998	50	20	IDGD	
NC(=O)[C@H]1CCCN(CCCNC(=O)NNc2c(F)cc(F)cc2Br)C1	745831215	UHRDDFWRPNJWDE-JTQLQIEISA-N	434.285	1.941	50	20	IDGD	
Cc1sc2nc(CS[C@@H](C)C(=O)NNC(=O)N3CCOCC3)nc(O)c2c1C	745992083	UMZHVIANYXCLQE-NSHDSACASA-N	425.536	1.708	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)[C@H]1CN(Cc2nc(O)c3ccccc3n2)CCO1	746097856	BXYWQCNXXXLGEX-GOSISDBHSA-N	439.447	1.065	50	20	IDGD	
C=CCOc1cn(-c2ccccc2)nc1C(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	746578475	WYHYHYUMOSGPLH-UHFFFAOYSA-N	444.451	1.759	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)N[C@H](Cc1ccccc1)CN1CCOCC1	746764932	LRFAYZODVSVNLH-LJQANCHMSA-N	436.516	1.151	50	20	IDGD	
O=C(COC(=O)c1cnn(CC(=O)NC2CCCCC2)c1)NNC(=O)c1cccs1	747016322	IFRITRUOBHCKBB-UHFFFAOYSA-N	433.490	1.012	50	20	IDGD	
C[C@H](c1ccccc1)[C@@](C)(O)C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	747413610	UDWHZMRMTCYZAS-IIBYNOLFSA-N	433.530	1.705	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNS(=O)(=O)c2ccc(NC(C)=O)c(Cl)c2)c1	748640732	YULQBNHCAYSTEO-UHFFFAOYSA-N	427.866	1.939	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)CCOc2ccc(C(N)=O)cc2)c2ccccc2c1=O	748689307	LVGVYTZLPWVFEE-UHFFFAOYSA-N	437.456	1.306	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)[C@@H]2CCCN2S(=O)(=O)c2cccs2)nc2ccccc21	749161113	UPBLEKZNULKRLL-HNNXBMFYSA-N	447.542	1.178	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)[C@H]1CCCN1C(=O)c1ccc2c(c1)OCO2	749563825	QUOZDCWWFOUDMS-OAHLLOKOSA-N	435.440	1.437	50	20	IDGD	
O=C(CCNC(=O)NC12CC3CC(CC(C3)C1)C2)NNC(=O)CNC(=O)c1cccs1	751210537	HCGBJDQQHIUFPA-UHFFFAOYSA-N	447.561	1.283	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)c1cccc(N2C(=O)c3ccccc3C2=O)c1	751211360	QRPGDUXFWVQUFF-UHFFFAOYSA-N	448.460	1.740	50	20	IDGD	
O=C(NCCc1cccs1)NNC(=O)c1cccc(CN2CCS(=O)(=O)CC2)c1	751372012	QJXWOMBRPOKWKH-UHFFFAOYSA-N	436.559	1.165	50	20	IDGD	
COc1cc(Br)ccc1CCCNC(=O)NNC(=O)C(=O)N1CCCC1	753383089	MGFYNQLUAIDWFW-UHFFFAOYSA-N	427.299	1.343	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CSc2ccc(Cl)cc2)sc1S(N)(=O)=O	754183587	SQLMPWJIAOUEBO-UHFFFAOYSA-N	435.936	1.611	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)n([C@H]2CCS(=O)(=O)C2)n1	755529134	CEQCLYRRGAJGNM-HOTGVXAUSA-N	449.533	1.788	50	20	IDGD	
Cc1ccnc(NNC(=O)CCC(=O)N2CCN(S(=O)(=O)c3ccccc3)CC2)c1	755853834	INACTBIOQWXNIL-UHFFFAOYSA-N	431.518	1.146	50	20	IDGD	
COC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2cccc(C#N)c2)c1Br	756155672	QMKSUWUPWHEAET-UHFFFAOYSA-N	445.229	1.507	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)Nc2ccc(S(=O)(=O)NCC(F)(F)F)cc2)n1	756641624	XLVLXGWHEAORCN-UHFFFAOYSA-N	448.427	1.193	50	20	IDGD	
COC(=O)c1cc(NC(=O)NNC(=O)c2cncc(NC(C)=O)c2)c(OC)c(OC)c1	756741486	FPUKHTKNERFWIB-UHFFFAOYSA-N	431.405	1.310	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)c2cncc(I)c2)nc2ccccc21	756864832	XZWRESQUPJGRCH-UHFFFAOYSA-N	435.225	1.577	50	20	IDGD	
NC(=O)c1ccc(NNC(=O)C2CCN(C(=O)c3ccc(Br)cc3)CC2)nn1	757407874	MMBYBNXHXFCGTO-UHFFFAOYSA-N	447.293	1.334	50	20	IDGD	
CCN1CCN(C(=O)Cc2ccc(NC(=O)NNC(=O)c3ccccc3O)cc2)CC1	757580694	IGFNMWSCTUJTFP-UHFFFAOYSA-N	425.489	1.565	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)c1ccccc1-c1ncc(-c2ccccc2F)o1	758039151	IATVFUQUHRHIBL-GFCCVEGCSA-N	446.460	1.846	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cnn1CCO[C@@H]1CCCCO1	759104990	ZAILKQLJDANHGQ-HXUWFJFHSA-N	438.488	1.995	50	20	IDGD	
O=C(NC[C@@H]1CN(Cc2ccccc2)CCCO1)NNC(=O)[C@@H]1COc2ccccc2O1	759233497	UUNPRLZITBHTQT-NQIIRXRSSA-N	440.500	1.448	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NC[C@@H](C[C@H](C)O)c2ccccc2)nc1	759610506	MDTKCZWEKVVEFA-DOTOQJQBSA-N	435.550	1.949	50	20	IDGD	
NC(=O)[C@H]1CC[C@@H](CNC(=O)NNC(=O)c2cc(-c3ccccc3)nc3ccccc23)O1	760204301	QGKFQZRXJCGQLY-MGPUTAFESA-N	433.468	1.879	50	20	IDGD	
O=C(NC1CC1)N[C@@H]1CCN(C(=O)NNC(=O)c2ccc(COc3ccccc3)o2)C1	760655875	JVXTWAWTIIMKEO-OAHLLOKOSA-N	427.461	1.749	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2ccc(NNC(=O)c3cncnc3)c([N+](=O)[O-])c2)cc1	760801073	UCGOOZXBIOBCIE-UHFFFAOYSA-N	444.429	1.951	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)[C@H]1CC(=O)N(c2ccccc2OC)C1	761633874	OGYLJELXHCRVMC-AWEZNQCLSA-N	429.498	1.996	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)NC1CCN(C2CCN(C)CC2)CC1	761675202	SCSFDKYUKCQJKY-UHFFFAOYSA-N	435.594	1.676	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNS(=O)(=O)c1cnc(Cl)c(F)c1	761937147	KXVMRZUNTNZWTG-UHFFFAOYSA-N	435.890	1.099	50	20	IDGD	
CC(C)n1nc(C(=O)NNS(=O)(=O)c2cnc(Cl)c(F)c2)c2ccccc2c1=O	761937217	LTUKEOURNOENRP-UHFFFAOYSA-N	439.856	1.788	50	20	IDGD	
CC(=O)N1CCCc2cc(S(=O)(=O)NNC(=O)CSc3ccccc3O)ccc21	763410268	LYCMLBQEWJNBTQ-UHFFFAOYSA-N	435.527	1.793	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CNc2ccccc2)nc1I	763496508	HLCILAFXYMEDBZ-UHFFFAOYSA-N	426.214	1.568	50	20	IDGD	
CON(C)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc3ccccc3cc2O)cc1	763526469	GMODSQRNIIXCPK-UHFFFAOYSA-N	436.424	1.579	50	20	IDGD	
CCN1CCN(c2ccc(NC(=O)C(=O)NNC(=O)c3ccccc3F)c(C)c2)CC1	763561143	JRPNGOVLCSOSSY-UHFFFAOYSA-N	427.480	1.676	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2nn(C3CCCCC3)cc2C)cc1	763659320	LTLFOBXMDYAIEL-UHFFFAOYSA-N	429.477	1.870	50	20	IDGD	
Cc1nc(-c2cccc(NC(=O)C(=O)NNC(=O)COc3ccc(Cl)cc3)c2)n[nH]1	763683929	CXFGYNFIEXPHPB-UHFFFAOYSA-N	428.836	1.598	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2nc(-c3ccccc3)n(-c3ccccc3)n2)cnn1C	763804648	OAPUEKRNQOODGN-UHFFFAOYSA-N	444.455	1.376	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccc([C@@H](C)N3CCOCC3)c2)cc1	763810084	ZOWXQZNUVYJFLN-QGZVFWFLSA-N	440.500	1.553	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)C(=O)Nc1ccc(-n2nccn2)nc1	763848980	GCWIXNIZPGMITO-AWEZNQCLSA-N	445.439	1.369	50	20	IDGD	
CCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(OCC)cc2)cc1	763861850	REPKGOBBCKEVKN-AWEZNQCLSA-N	442.472	1.388	50	20	IDGD	
CNC(=O)CCOc1ccc(NC(=O)C(=O)NNC(=O)CSc2ccc(C)cc2)cc1	763897034	SMFABOYUPYVYIC-UHFFFAOYSA-N	444.513	1.388	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccccc2C(=O)N(C)C)cc1OC	763911640	IWWPUIKXLPGTGZ-UHFFFAOYSA-N	442.472	1.586	50	20	IDGD	
COC(=O)c1c(NC(=O)C(=O)NNC(=O)Cc2ccc(F)cc2)sc2c1CCCC2	763919836	ZAYMZTZOJVSCBC-UHFFFAOYSA-N	433.461	1.881	50	20	IDGD	
Cc1ccc(S(C)(=O)=O)cc1NC(=O)C(=O)NNC(=O)c1cccc2ccccc12	764050181	BBIBXANNEGDWNO-UHFFFAOYSA-N	425.466	1.951	50	20	IDGD	
COc1ncncc1NC(=O)C(=O)NNC(=O)c1ccc(Br)cc1Cl	764059658	WASUDPQQZHHQTN-UHFFFAOYSA-N	428.630	1.301	50	20	IDGD	
O=C(NNC(=O)c1cccc(Br)c1)C(=O)Nc1cnn(-c2ccccn2)c1	764063688	WFTOXWSBGPAZDV-UHFFFAOYSA-N	429.234	1.430	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cc(C(=O)N3C[C@@H](C)C[C@H](C)C3)ccc2C)n[nH]1	764106597	NBHGKSSLBUHJRO-STQMWFEESA-N	440.504	1.544	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1cccc(COCc2ccco2)c1	764274719	BSQSZHKXUHEDIQ-UHFFFAOYSA-N	439.424	1.867	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1c(F)cccc1Br	764277616	KXKAJPIDTXUXTR-UHFFFAOYSA-N	426.198	1.459	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1C(=O)NC(C)C	764346081	SJUIOUBZLKNVSB-UHFFFAOYSA-N	448.483	1.719	50	20	IDGD	
COc1ccc(C#N)cc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccccc2OC)[nH]n1	764376484	DUXZMGGGJREMIL-UHFFFAOYSA-N	434.412	1.365	50	20	IDGD	
Cc1cnc(O)n1-c1ccccc1NC(=O)C(=O)NNC(=O)CSc1ccccc1O	764403876	FPUHRJYJUSSYBR-UHFFFAOYSA-N	441.469	1.470	50	20	IDGD	
CCn1c(=O)n(CC)c2nc(NC(=O)CCC(=O)NNc3ncccc3[N+](=O)[O-])ccc21	764589056	MXYFPLDHXYKSER-UHFFFAOYSA-N	442.436	1.403	50	20	IDGD	
CC(=NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1)c1cccc(C#N)c1	764817537	FTEIGMHXZPSMDL-UHFFFAOYSA-N	439.541	1.713	50	20	IDGD	
Cc1ccc(S(=O)(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)c(C)c1	765117994	HYAHUWWDTJBUOQ-UHFFFAOYSA-N	430.530	1.071	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@@H]3Oc4ccccc4O[C@@H]3C)CC2)cc1	766647455	FEXLABPPGKKDKT-WZONZLPQSA-N	438.528	1.489	50	20	IDGD	
CC(C)n1ccc(CC(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)n1	766663662	LJTSCFQEXNPNCB-UHFFFAOYSA-N	432.956	1.625	50	20	IDGD	
NS(=O)(=O)c1ccc(OCCSCC(=O)NNc2ncnc3ccsc23)cc1	766670557	RARMGSWZEVJLRM-UHFFFAOYSA-N	439.544	1.594	50	20	IDGD	
CC(C)(C)[C@H](Br)C(=O)NCCS(=O)(=O)N1CCN(c2ccccn2)CC1	767030457	BMAUODHJPRHIFG-OAHLLOKOSA-N	447.399	1.459	50	20	IDGD	
C[C@@]1(c2cccc(C(=O)NNC(=O)c3cc(Br)ccc3O)c2)NC(=O)NC1=O	769147187	NXBBYXIHWJVICN-SFHVURJKSA-N	447.245	1.284	50	20	IDGD	
CN(C)C(=O)COc1ccc(C(F)(F)C(=O)NNC(=O)COc2ccc(C#N)cc2)cc1	769352629	FSVLMQOOCAPWCV-UHFFFAOYSA-N	446.410	1.343	50	20	IDGD	
CS(=O)(=O)c1ccc(C(=O)NNC(=O)COCc2ccccc2)cc1Br	769741947	PQXCOKYURLUXLR-UHFFFAOYSA-N	441.303	1.830	50	20	IDGD	
COc1cc(OC)c2cc(CCCNC(=O)NNc3nc(O)c4cnn(C)c4n3)[nH]c2c1	770407532	CTFTZWSQOAMQEB-UHFFFAOYSA-N	440.464	1.826	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCOC[C@@H]2CC(=O)c2ccccc2)cc1OC	770664944	NJQISKJCHITBBD-SFHVURJKSA-N	441.484	1.439	50	20	IDGD	
C[C@H](C(=O)NNc1nc(O)c2cnn(C(C)(C)C)c2n1)N1C(=O)[C@H]2CCCC[C@@H]2C1=O	770958046	GWCIWSCMGRKBHC-WOPDTQHZSA-N	429.481	1.294	50	20	IDGD	
Cc1cc(C(=O)NNc2nc(O)c3cnn(C)c3n2)ccc1NS(=O)(=O)C(F)(F)F	770971981	NPLGQWVYWVAPML-UHFFFAOYSA-N	445.383	1.396	50	20	IDGD	
Cc1ccc(-c2nnc(S)n2CCC(=O)NNc2nc(O)c3cnn(C)c3n2)cc1	770972894	WPXSYHOGVDARDT-UHFFFAOYSA-N	425.478	1.458	50	20	IDGD	
COc1ccc(-c2nn(CCC#N)cc2/C=C(\C#N)C(=O)NCCn2ncnn2)cc1OC	771582776	NQJCGNPUPLOBGR-MHWRWJLKSA-N	447.459	1.191	50	20	IDGD	
Cc1ccc(S(=O)(=O)n2ccc(C(=O)O[C@@H](C)C(=O)NNC(=O)CC(C)C)c2)cc1	772138483	VOAIWVXGQQCHDD-HNNXBMFYSA-N	435.502	1.772	50	20	IDGD	
CC[C@H](C)NS(=O)(=O)Cc1cccc(NC(=O)C(=O)NNc2nccnc2C(C)C)c1	773992290	HWJNUFRMUCLDJR-AWEZNQCLSA-N	448.549	1.900	50	20	IDGD	
Cc1ccc(S(=O)(=O)C[C@@H](C)NC(=O)NNC(=O)COc2ccc(C#N)cc2)cc1	776197395	ZMDXKBZWUZDZJI-OAHLLOKOSA-N	430.486	1.438	50	20	IDGD	
CC(C)N(CC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)Cc1nc(O)c2ccccc2n1	776222181	HUAISNQYJKLMMZ-UHFFFAOYSA-N	438.444	1.915	50	20	IDGD	
COc1ccccc1[C@@]1(C)NC(=O)N(CC(=O)NNc2cccc(S(C)(=O)=O)c2)C1=O	776541092	GTASCOYTJNGXBN-HXUWFJFHSA-N	446.485	1.009	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H](CC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)C1	777790489	YEPNLMVMWGTLMT-HNNXBMFYSA-N	432.525	1.488	50	20	IDGD	
O=C(CN1C(=O)[C@@H]2CCCC[C@H]2C1=O)NNc1ccc([N+](=O)[O-])cc1Br	779136872	SBHOKAVLJURQBS-GHMZBOCLSA-N	425.239	1.976	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)CN2C(=O)c3cccc([N+](=O)[O-])c3C2=O)cc1Cl	782801026	GAZYEYTXPCMSDA-UHFFFAOYSA-N	432.776	1.774	50	20	IDGD	
COc1ccc(OC(F)F)c(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)c1	782893655	KPBFSLCDKYTFAE-UHFFFAOYSA-N	447.398	1.512	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2ccc(CC(=O)N3CCN(C)CC3)cc2)cc1	783036924	KCOLVHFUCOPLHW-UHFFFAOYSA-N	425.489	1.094	50	20	IDGD	
Cc1ccccc1NC(=O)NNC(=O)C(=O)Nc1ccc(S(=O)(=O)N2CCCC2)cc1	783415961	MJDKQHYFJJWCPV-UHFFFAOYSA-N	445.501	1.571	50	20	IDGD	
Cc1cc(F)ccc1NNC(=O)C(=O)Nc1ccccc1OCC(=O)N1CCOCC1	783449465	QDBNMOMCFYXJBO-UHFFFAOYSA-N	430.436	1.454	50	20	IDGD	
NC(=O)Cn1cc(C(=O)NS(=O)(=O)c2ccc(S(F)(F)(F)(F)F)cc2)nn1	783462104	ZLARBMPRMNSZKX-UHFFFAOYSA-N	435.356	1.540	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CNC(=O)c2cccs2)cc1OCCC(C)C	784003289	DLFWCAUZVJVMMT-UHFFFAOYSA-N	446.529	1.997	50	20	IDGD	
CC(C)(C)c1nc2cc(NC(=O)C(=O)NNC(=O)CNC(=O)c3cccs3)ccc2o1	784004965	MGSKXXKIDHQTLC-UHFFFAOYSA-N	443.485	1.703	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(OC(C)C)c(NC(=O)C(=O)NNc2ccccn2)c1	784797893	JBMRLBUUAXJPRP-UHFFFAOYSA-N	449.533	1.981	50	20	IDGD	
COC(=O)c1cc2cc(NC(=O)C(=O)NNC(=O)Cc3cn4ccccc4n3)ccc2o1	785068069	SOVUZMQXHRTERN-UHFFFAOYSA-N	435.396	1.196	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H]2CCOc3c(F)cccc32)c1	785973102	OUYCHFXSEZXMFQ-INIZCTEOSA-N	436.465	1.544	50	20	IDGD	
N#C/C(=C\C1CC1)C(=O)OCC(=O)N1CCN(S(=O)(=O)c2ccc3c(c2)CCC3)CC1	786673602	ILVIZHTUVSJYEP-XDHOZWIPSA-N	443.525	1.411	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)c1cccn2c(I)cnc12	788164847	VCUKPYOFLVKPJP-UHFFFAOYSA-N	446.245	1.489	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)[C@@H]1CC(=O)N(C2CC2)[C@@H]1c1cccc(OC)c1	788164951	WMIOCDNXPNJNMG-IEBWSBKVSA-N	433.505	1.684	50	20	IDGD	
N#Cc1ccc(S(=O)(=O)NNC(=O)CNC(=O)c2cccs2)cc1Br	788490861	FJZHLNOCMMDXQD-UHFFFAOYSA-N	443.304	1.122	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)Nc1ccnn1-c1nc(C)cc(C)n1	789315311	WGFISVTXXRSUGL-UHFFFAOYSA-N	431.478	1.840	50	20	IDGD	
COC[C@H](NC(=O)NNC(=O)[C@H](C)Oc1cccc(Br)c1)[C@H]1CCCO1	789335691	SYDDSMIPLIEWEH-TUKIKUTGSA-N	430.299	1.741	50	20	IDGD	
CCn1nnnc1-c1cccc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)c1	789813891	XKSSUUDLZPRTRL-ROUUACIJSA-N	449.471	1.019	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)[C@H]1CC(=O)c2ccccc21	789813969	LQLKMDGXZARADC-IBGZPJMESA-N	440.931	1.975	50	20	IDGD	
CC(=NNC(=O)N1CCN(C)CC1)c1ccc(S(=O)(=O)NCc2ccc(F)cc2)cc1	790176816	ULJZPOLMLBNREB-UHFFFAOYSA-N	447.536	1.985	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)/C=C/c1ccccc1)C(=O)NNc1nc2ccccn2n1	791253201	QZGCYFCPDGKJLU-WSYSLRRZSA-N	446.558	1.884	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(Cc3nnc4n3CCC4)cc2)cc1F	792274193	SRJFEKVNLDFVIG-UHFFFAOYSA-N	436.447	1.662	50	20	IDGD	
CCc1c(NC(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)cnn1-c1cccc(Cl)c1	792486626	BGPJSOJPMPOAMZ-NSHDSACASA-N	425.898	1.676	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)[C@@H]2COCCN2C2CCCC2)c1	793414359	RDSOEPLEWFIKCL-INIZCTEOSA-N	426.311	1.862	50	20	IDGD	
CCOC(=O)c1ccc(OC)c(S(=O)(=O)NNC(=O)COc2ccccc2CC)c1	795280482	INJBMJJRAAMADP-UHFFFAOYSA-N	436.486	1.823	50	20	IDGD	
C[C@H]1[C@@H](NCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)[C@H](C)CCN1C(=O)OC(C)(C)C	796644374	KNDHIZCOSWEBKS-GLJUWKHASA-N	449.508	1.979	50	20	IDGD	
COc1cc(SC)ccc1NC(=O)C(=O)NNC(=O)CNC(=O)OCc1ccccc1	797369467	YQMSPWXTACDOKB-UHFFFAOYSA-N	446.485	1.429	50	20	IDGD	
N#Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)nc2)ccc1OC(F)(F)F	799835632	WMOAGSYWPFBGCN-UHFFFAOYSA-N	427.726	1.905	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)N[C@@H]2CCCN(C(=O)Cc3ccccc3)C2)c1	802475420	JCECMAMCHNYAKF-GOSISDBHSA-N	430.530	1.950	50	20	IDGD	
C[C@@H](CCNS(=O)(=O)c1ccccc1)NC(=O)NNC(=O)COc1ccccc1C#N	802526655	DWAOELFPVMNFBS-HNNXBMFYSA-N	445.501	1.025	50	20	IDGD	
COCCNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2OC)c1	806977101	VVHFVNQFVVEHCC-UHFFFAOYSA-N	448.863	1.125	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)Cc2cccnc2)c(C)cc1Br	806979182	UYZSURDKWIAHBR-UHFFFAOYSA-N	449.261	1.268	50	20	IDGD	
COc1ccc(S(=O)(=O)NC(C)(C)C)cc1NC(=O)C(=O)NNc1cccc(F)n1	807391123	GMGFDWKTCZKLPW-UHFFFAOYSA-N	439.469	1.388	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)NCCCn2cc(Br)cn2)cc1C	807612263	PZAUDIXNORDXBY-UHFFFAOYSA-N	437.298	1.622	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NN=Cc1c(N(C)C)n(C)c(=O)n(C)c1=O	807956575	QGXKKPPZOYTMJC-UHFFFAOYSA-N	426.502	1.346	50	20	IDGD	
CC(C)CC(=O)NNS(=O)(=O)c1cc(Cl)c(OCC(=O)N(C)C)c(Cl)c1	808069690	GCPDYFDGTRSTMR-UHFFFAOYSA-N	426.322	1.816	50	20	IDGD	
COC[C@]1(C(=O)NNC(=O)Cn2cnc3ccccc32)CCN(C(=O)OC(C)(C)C)C1	809983364	HXOVNZMEFZNFMM-NRFANRHFSA-N	431.493	1.457	50	20	IDGD	
O=C(CNS(=O)(=O)c1cccc(Br)c1)NNc1cnnc2ccccc12	810404729	WDIJIVIMUKJUIO-UHFFFAOYSA-N	436.291	1.814	50	20	IDGD	
NC(=O)c1ccc(OCC(F)F)c(NC(=O)C(=O)NNc2cccc(F)c2[N+](=O)[O-])c1	810407227	BBSAAHVLZMCWNE-UHFFFAOYSA-N	441.322	1.559	50	20	IDGD	
COC(=O)c1cn(-c2cccc(NC(=O)C(=O)NNc3ccc(Cl)c(OC)c3)c2)nn1	812991389	GZOSNWQOSJUNQP-UHFFFAOYSA-N	444.835	1.798	50	20	IDGD	
Cc1cccc(C(C)C)c1NNC(=O)C(=O)Nc1cnn(CC(=O)N2CCOCC2)c1	813048259	QAYNCEBIMQLWOW-UHFFFAOYSA-N	428.493	1.256	50	20	IDGD	
COC(=O)C12CCC(C(=O)NNC(=O)c3sc(N4CCOCC4)nc3C)(CC1)CC2	814365892	YFSKUURWGPBOBA-UHFFFAOYSA-N	436.534	1.563	50	20	IDGD	
CCOC(=O)c1ccn(-c2ccccc2NC(=O)NNC(=O)[C@H]2CCc3nncn3C2)n1	814635387	ZBBXALWQMJHEEH-ZDUSSCGKSA-N	438.448	1.056	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CC(C)(C)O[C@@](C)(C(F)(F)F)C2)cc1OC	815146022	KXJSFWFZRJKENH-GOSISDBHSA-N	433.427	1.897	50	20	IDGD	
COCc1cc(NC(=O)C(=O)NNC(=O)Cc2ccc(Cl)cc2)cc(C(=O)OC)c1	815566778	FKIGQZPTRILZFN-UHFFFAOYSA-N	433.848	1.602	50	20	IDGD	
COc1ccc(C(=O)N2CCOCC2)cc1NC(=O)C(=O)NNc1cccc(Cl)n1	815727429	XVIGQFQPPXXPBU-UHFFFAOYSA-N	433.852	1.298	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)N1CCN(CC(=O)Nc2ccccc2)CC1	817937596	SPTIDPOUWNBVLQ-UHFFFAOYSA-N	435.488	1.253	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNS(=O)(=O)c1cc(C(=O)O)cc(C(=O)O)c1	832188038	RPVCWDQTYDSHJT-UHFFFAOYSA-N	428.806	1.368	50	20	IDGD	
O=C(CNS(=O)(=O)c1cccc(F)c1)NNC(=O)c1ccc(Br)s1	913161154	AUGIQPDFPDGGGO-UHFFFAOYSA-N	436.284	1.389	50	20	IDGD	
CN1CCc2nc3ccccc3c(C(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)c2C1	915164678	NERSJMHYZLSJOW-UHFFFAOYSA-N	438.509	1.701	50	20	IDGD	
CC1CCN(C[C@H](C)C(=O)NNC(=S)Nc2cccc(S(=O)(=O)N(C)C)c2)CC1	916117641	FYCQRABJYSRNBV-HNNXBMFYSA-N	441.623	1.623	50	20	IDGD	
CC(C)N1C(=O)c2ccc(C(=O)NNC(=O)[C@H](C)Oc3ccc(F)cc3)cc2S1(=O)=O	916746484	QMABRNRUZVUSOW-LBPRGKRZSA-N	449.460	1.607	50	20	IDGD	
COc1ccc(CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1[N+](=O)[O-]	918019240	ZOUBSLCGECRLGT-UHFFFAOYSA-N	436.450	1.041	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCSC(F)(F)F)c1	918219154	CTTKSBMIBYWVMM-UHFFFAOYSA-N	442.485	1.914	50	20	IDGD	
O=C(CC12CC3CC(CC(C3)C1)C2)NNC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	918779153	CNCILUDGIZCFGB-UHFFFAOYSA-N	438.492	1.244	50	20	IDGD	
O=C(CS(=O)(=O)Cc1cccc(Br)c1)NNC(=O)c1ccc(Cl)nc1	919844336	IPUMGCQLTQTNBA-UHFFFAOYSA-N	446.710	1.874	50	20	IDGD	
O=C(CC12C[C@H]3C[C@@H](CC(Br)(C3)C1)C2)NNC(=O)N[C@@H]1CCS(=O)(=O)C1	919886444	SXLQVMVWFKRCOU-ZBVBZRCCSA-N	448.383	1.628	50	20	IDGD	
CNS(=O)(=O)Cc1ccc(CNC(=O)NNC(=O)CCc2ccc(OC)cc2)cc1	919899870	XXBOPRJRMQVGBF-UHFFFAOYSA-N	434.518	1.208	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)N2CCC[C@@H]2C(=O)NNC(=O)OC(C)(C)C)o1	920402222	OTIJEDLULDPONS-LLVKDONJSA-N	431.467	1.165	50	20	IDGD	
CCCCNC(=O)NNC(=O)c1ccc(Cl)c(S(=O)(=O)N2C[C@@H](C)O[C@H](C)C2)c1	920765079	STGHFEQPNMRXJC-CHWSQXEVSA-N	446.957	1.882	50	20	IDGD	
C[C@@H]1CN(Cc2csc(NC(=O)NNC(=O)[C@H]3COc4ccccc4O3)n2)C[C@@H](C)O1	920932983	ZAAFIGKTQCULLN-PBFPGSCMSA-N	447.517	1.745	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)n(-c2ccc(C(F)(F)F)cn2)n1	920933009	JVGVALMACCUHFI-JTQLQIEISA-N	446.411	1.182	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)NCCCOCC(F)(F)F)CC1	1318570857	PECAXISFCJVYCC-UHFFFAOYSA-N	426.436	1.933	50	20	IDGD	
CC1(C)C(=O)N(C[C@](C)(O)C(=O)NNC(=O)c2n[nH]c3c2CCCC3)c2ccccc21	1321126458	FUJYICXEHNGGEZ-QFIPXVFZSA-N	425.489	1.125	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H]1CC(c3ccccc3)=NN1)C2)[C@H](F)Cl	1778027930	CZMCNRHNCFTRCL-TWFHAPMSSA-N	436.915	1.801	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc4cccn4cn3)C2)C1	1778051648	NTYWYNBGUVZXFG-KXBFYZLASA-N	435.322	1.951	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccn4ccnc4c3)C2)C1	1778564640	OZQDGWZAVWJUPT-IFXJQAMLSA-N	435.322	1.809	50	20	IDGD	
O=C(c1cn2ccsc2n1)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1778628494	HNDUZAOEROVTNW-ABAIWWIYSA-N	431.287	1.530	50	20	IDGD	
Cn1ccc2c(O)ncc(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)[C@@H](F)Cl)C4)c21	1779996568	GPEQZFFSSORCSG-AKCHCHLHSA-N	438.887	1.941	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](F)Cl)CCO3)cc1NC(C)=O	1780211852	UTBJOXZDKWSOFB-VQIMIIECSA-N	427.860	1.632	50	20	IDGD	
CC(=O)c1cc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@](C)(Cl)CCl)C2)n[nH]1	1780710524	ZVSNUBDZBKQLBJ-ATZDWAIDSA-N	445.347	1.976	50	20	IDGD	
CN(C)c1cncc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@](C)(Cl)CCl)C3)C2)c1	1781224132	HYVIOTBCORXHLY-MOPGFXCFSA-N	429.348	1.827	50	20	IDGD	
CCOc1cccc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)c1O	1781979125	NFTDGDRBRAANGH-QAPCUYQASA-N	445.285	1.925	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccn(C(F)F)n3)CCO2)C1	1783349521	MPORLPPJRRSTPQ-ZBEGNZNMSA-N	435.269	1.895	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H]2C[C@]21C(=O)N1CC[C@@]2(CN(C(=O)[C@@H](F)Cl)CCO2)C1	1783684290	FPQQELRLWBKRHZ-TUGJPZLJSA-N	445.919	1.750	50	20	IDGD	
CC(=O)N[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(C)(C)CCl)[C@H]2C1)C(C)(C)C	1783847215	HFKHNOCDTJNLAH-QAETUUGQSA-N	429.989	1.782	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(C)nn3C)[C@H]2C1	1786029115	GEBHRYXQMWRNTL-YXWQFLTLSA-N	427.343	1.495	50	20	IDGD	
COc1cc(C(=O)Nc2ccc(C3(NC(=O)c4cccc(B(O)O)c4)CCC3)cc2)n(C)n1	1787066143	CMSNXLUKTQWGOK-UHFFFAOYSA-N	448.288	1.170	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3nc[nH]c3[N+](=O)[O-])[C@H]2C1	1787480291	OWUVIRBKNADMGY-YFKTTZPYSA-N	444.286	1.085	50	20	IDGD	
O=C(CCBr)Nc1ccc(C2(NC(=O)C[C@@H]3NC(=O)NC3=O)CCC2)cc1	1787670476	WIJSFPFTDXPGEM-ZDUSSCGKSA-N	437.294	1.504	50	20	IDGD	
O=C(CCN1CCCCC1)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1	1787787259	PJVYAAABEMTXTR-UHFFFAOYSA-N	449.360	1.990	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc4ccccn34)[C@H]2C1	1787942064	GSGVJPSWJJOHCD-HOSILWTGSA-N	435.322	1.711	50	20	IDGD	
Cc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](O)CCl)C[C@@H]32)c2cc(O)ccc2n1	1788279327	SSYXHYLIZXNKPU-KGUHOSCRSA-N	447.919	1.442	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccn4cncc34)[C@H]2C1	1788422938	ADTGROHLAKULOK-IEZWGBDMSA-N	430.581	1.779	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)c1csc(C(F)(F)F)n1	1789022226	YVJBVEBGNJJYNK-QSFUFRPTSA-N	441.859	1.355	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccccc3-n3nccn3)C[C@@H]21	1789866508	LUZLJPYJYQNKJO-RMRDIRSESA-N	431.924	1.878	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(O)ccc3F)[C@H]2C1	1790054356	CMPOXFSZZCPITL-KHJVZFFJSA-N	429.286	1.908	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CCCCN3C)C[C@@H]21	1790958563	VFQYHYYOANWIBC-KSWRQPAISA-N	430.387	1.624	50	20	IDGD	
C[C@H](NC(=O)c1ccccn1)C(=O)Nc1ccc(C2(NC(=O)[C@H](O)CCl)CCC2)cc1	1791046727	UMLWXSBCAHHIKS-KBXCAEBGSA-N	444.919	1.934	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(N(C)C)cn3)C[C@@H]21	1791056854	GEDJYPYPMINIRD-HPZZRFSDSA-N	439.354	1.524	50	20	IDGD	
CCN1CCC(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]3C2)CC1	1791065194	SBBGQLCPYYHXSI-IWCQGFGOSA-N	430.387	1.481	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc(C(C)(C)C)cn3)C[C@@H]21	1791254310	NTVHGXMLTKWFNI-JKQORVJESA-N	438.956	1.621	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4cccnc4nc3O)C[C@@H]21	1791256813	IPEQHSXMHMMVQZ-HJWJTTGWSA-N	448.907	1.183	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC1(c2ccc(NC(=O)CN(CCO)CCO)cc2)CCC1	1791329221	PRDDNVMNYOHEFU-UHFFFAOYSA-N	437.613	1.259	50	20	IDGD	
CCC[C@H](NC(C)=O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CO[Si](C)(C)C)C[C@@H]21	1792186558	QAYAIMXHPDALRK-XSLAGTTESA-N	427.618	1.122	50	20	IDGD	
C[C@@H](Sc1ccccc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCC(=O)NN(C)C)C2	1793239039	KGHCJUCIYJPNBN-PZTGFMGMSA-N	448.589	1.130	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CCC[C@@H](C(=O)OC)C1)C2	1793453428	ZPUWINAAODZQJE-BLONOQDTSA-N	428.957	1.963	50	20	IDGD	
CC(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1793879860	PWUOUSBGNCXCCJ-IVSAIRAKSA-N	447.960	1.133	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cccnc1Cl	1793953745	FNLZSWSKDYFHBK-JLVBRIDZSA-N	425.989	1.719	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC=C(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](O)CCl)C3)C1	1794133623	LCYAYKMPSPMECX-YYIAUSFCSA-N	441.956	1.792	50	20	IDGD	
CC(C)(C)n1ncc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](O)CCl)C3)c1Cl	1794430333	UBXRHTWJCZJLDD-XCCSTKFXSA-N	433.336	1.094	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cccc([N+](=O)[O-])c1)C2	1795113899	SLZRVXHJBPWCNT-ZSBFGKGUSA-N	440.294	1.512	50	20	IDGD	
COc1cc(OC)c(F)c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](O)CCl)C3)c1F	1795927508	NSGCRMZKSLDOFI-WRWGMCAJSA-N	432.851	1.834	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc2c[nH]nc12	1796181476	VCFLQVHWLKFFQW-OCVGTWLNSA-N	435.322	1.940	50	20	IDGD	
COc1ccc(F)c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)c1	1796192888	WAKDQZGKSOXYIG-BJWYYQGGSA-N	426.253	1.080	50	20	IDGD	
COc1ccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Cl)c([N+](=O)[O-])c1	1796367446	IVSGKFXYXSIYMT-CZAMWMTLSA-N	429.832	1.270	50	20	IDGD	
Cc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CO[Si](C)(C)C)C3)ncc1[N+](=O)[O-]	1796602765	VRNWQWYZXKBKKD-ZSBFGKGUSA-N	436.541	1.353	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C/N=C/c1ccco1)C2	1796891959	RCTDROYWLPGINO-YOGHELERSA-N	438.488	1.471	50	20	IDGD	
C[C@H](Nc1cnccn1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@](C)(Cl)CCl)C2	1797780641	QODCESNFQLNVQT-OZNCCCKXSA-N	430.336	1.103	50	20	IDGD	
COc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CO[Si](C)(C)C)cc(Cl)n1	1797957313	GWPOINNPQMSXGC-ZSBFGKGUSA-N	441.988	1.798	50	20	IDGD	
COc1ccc(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)cc1	1798439129	FUMDTADUZJIPAW-BJWYYQGGSA-N	437.500	1.188	50	20	IDGD	
C[C@H](NC(=O)c1cnccn1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CO[Si](C)(C)C	1798627387	GWJDCZVDYXRVPF-JONQDZQNSA-N	433.585	1.085	50	20	IDGD	
CCOC(=O)c1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)C(Cl)Cl)C3)cc1	1799789560	JPEGPMOOQSYAIB-QDMKHBRRSA-N	429.300	1.870	50	20	IDGD	
CC(=O)N[C@@](C)(C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](O)CCl)C2)c1ccccc1F	1800239268	WPTIIPMMOWZRPP-TZRWPXCGSA-N	439.915	1.415	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccnc(Cl)n1)C2	1800642055	UBHTWALMUAJBSN-NOHGZBONSA-N	431.718	1.507	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc(F)c(C#N)c1)C2	1800759752	FZJKTTQSPYGVPT-ZKRNXSKHSA-N	438.297	1.613	50	20	IDGD	
Cc1cc(C)n2ccc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)CCC(=O)NN(C)C)C4)c2n1	1801195867	HUIYMZGYJPJNCP-BCDXTJNWSA-N	440.548	1.576	50	20	IDGD	
C[C@H](Cc1ccccn1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2	1801226959	XFUKTOVLBDFWKL-QUEVPRLRSA-N	428.302	1.540	50	20	IDGD	
O=C(Cn1cnnn1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](Br)Cc1ccccc1	1801568531	ZIWCFEFJICASCW-YVSFHVDLSA-N	447.337	1.318	50	20	IDGD	
COc1cc(C)ccc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)Br)C2	1801707561	NBQBFALRRHVMAJ-ZJOBFFGXSA-N	425.323	1.990	50	20	IDGD	
C#CC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2	1802126518	IDWSNEOGFMMMMM-AIEDFZFUSA-N	431.892	1.027	50	20	IDGD	
COc1ccc2[nH]cc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)CCC(=O)NN(C)C)c2n1	1802336181	FTCNADUUFVPXEW-QDMKHBRRSA-N	442.520	1.196	50	20	IDGD	
Cc1nc2sccn2c1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCC(=O)NN(C)C	1802337956	YAAROIQFQYMXJS-QDMKHBRRSA-N	432.550	1.329	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(F)cc(F)c1F)c1ccc(B(O)O)cc1	1803690722	ZEQNWULQNGKOFZ-MUJYYYPQSA-N	432.207	1.349	50	20	IDGD	
NC(=O)c1ncccc1C(=O)NC[C@@H]1CCN(C(=O)C(Cl)Cl)[C@@H]1c1cccnc1	1804817412	ULZUKQSLODJHGC-SWLSCSKDSA-N	436.299	1.699	50	20	IDGD	
Cc1ncccc1C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1805496021	OUZONPQMWPAXBK-SIKLNZKXSA-N	444.300	1.098	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)/C=C/C2CCCC2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1	1807374326	YUFAAFHCVPDRPR-LSCLZPPHSA-N	447.344	1.827	50	20	IDGD	
O=C(O)CSCC(=O)N1CC[C@H](CNC(=O)[C@@H](F)Br)[C@H]1c1cccnc1	1808677975	DZKRDOKEEKVPDG-KCPJHIHWSA-N	448.314	1.596	50	20	IDGD	
Cc1ccncc1C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1808785522	WGAOHSSELMAPOM-UGKGYDQZSA-N	444.300	1.098	50	20	IDGD	
Cc1cc2nnc(C(=O)NC[C@@H]3CCN(C(=O)[C@@H](F)Cl)[C@H]3c3cccnc3)c(C)n2n1	1809185392	FQJVCTBBTYEUDO-JCGIZDLHSA-N	445.886	1.990	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)[C@H](C)N2C[C@@H]3C[C@H]3C2)[C@@H]1c1cccnc1	1810162861	PXMXMEPETMXLGR-PYNNRZRQSA-N	434.968	1.681	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2ccc(O)cc2)[C@H]1c1cccnc1	1811934726	IGBAWJXNJLGBEV-PGRDOPGGSA-N	439.516	1.480	50	20	IDGD	
Cc1nscc1C(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1813071061	OKOOPQBIXHLERM-OXJNMPFZSA-N	444.561	1.539	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)C(=O)c2cccn2C)[C@H]1c1cccnc1	1813478295	GXSDSMQPLMHUHX-SOLBZPMBSA-N	432.908	1.563	50	20	IDGD	
CC(C)(CCl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1	1815335589	GTDSCZDRQZVFTB-CYBMUJFWSA-N	435.742	1.314	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ncc[nH]2)[nH]n1	1818111387	IKZPPOHEHCDNLF-FCUAXUHVSA-N	437.464	1.573	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](O)CCl)CC2)c1ccc2cnccc2n1	1818189259	RESQAYRNZJMRIP-XHDPSFHLSA-N	431.905	1.912	50	20	IDGD	
C[C@@H]1C[C@]1(C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819403824	HXOJLOXBFWVJEU-FFUDGTDTSA-N	425.493	1.760	50	20	IDGD	
C[Si](C)(C)OCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCN1CCOC1=O)CC2	1820165875	VELOCPQLHIPZHD-GFCCVEGCSA-N	440.598	1.749	50	20	IDGD	
N#Cc1ccc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2cccc(B(O)O)c2)CC3)cc1	1822163612	ZUTJQFZVOPHDNW-QGZVFWFLSA-N	446.297	1.234	50	20	IDGD	
C[C@H](Br)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)n(C)n2)[nH]n1	1822186104	GJOPNTFNHXTVBT-JOYOIKCWSA-N	425.287	1.938	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3cc(C)n4ccnc4n3)sc2C1	1824118851	KEHRPNXJQMKKOW-NWDGAFQWSA-N	448.936	1.974	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](C)Br)sc2C1	1825641585	PRWFVKRBOCBJKR-VGMNWLOBSA-N	432.344	1.285	50	20	IDGD	
O=C(CCc1ccco1)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827056055	ONRHCASTQIOAJL-QFIPXVFZSA-N	438.333	1.826	50	20	IDGD	
Cc1oncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1	1828925701	PLEHIBDKLISBCP-LJQANCHMSA-N	440.504	1.529	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1	1830307578	HDLDSZFBISISLC-ZWKOTPCHSA-N	435.956	1.936	50	20	IDGD	
CCc1oncc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)CBr)CCO2	1830537999	TVNCFWTZLGEQSC-ACJLOTCBSA-N	444.326	1.338	50	20	IDGD	
C=CCO[C@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](Br)CC)C2)C1	1831434515	YNKAAJWJXJCTOL-RVKKMQEKSA-N	433.343	1.207	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4c(c3)OCO4)C2)C1	1831645893	FEBUIXBBFOORAN-HRAATJIYSA-N	438.908	1.893	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(O)nc(O)n2)CC1	1831652899	MGNUVGMHWYIUIU-RISCZKNCSA-N	441.326	1.905	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCS(C)(=O)=O)CC1	1831656063	DQZFQHATDCAOIM-UKRRQHHQSA-N	437.400	1.824	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](C)CBr)C3)C2)o1	1831785963	PHQXVILYDLUWRQ-SCLBCKFNSA-N	429.311	1.689	50	20	IDGD	
C[C@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1)c1ccccn1	1832328134	KXIOGUDENWHSMV-MBSDFSHPSA-N	449.360	1.798	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)C[C@H]3CCCCO3)CCO2)C1	1832347274	TYKFVGWOLLHOGH-AYOQOUSVSA-N	437.364	1.638	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CSc3ccncc3)CCO2)C1	1832709559	LAPQYYGBZHJJOO-VQIMIIECSA-N	427.954	1.648	50	20	IDGD	
COc1cncc(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)c1	1832914894	GXGJZTVNIMZGNS-HKUYNNGSSA-N	429.876	1.014	50	20	IDGD	
Cn1cc(C(=O)N2CCC(N3CCC(NC(=O)[C@H](O)CCl)CC3)CC2)c(C(F)F)n1	1833309907	DJTSREHOJUGYSU-OAHLLOKOSA-N	447.914	1.143	50	20	IDGD	
CCN(CC)C[C@H](C)C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)CCl)CC2)CC1	1833311651	BOKWUCBNUYBAPZ-QFBILLFUSA-N	431.021	1.136	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)C1CCC(F)(F)CC1	1833381855	FNFKZHLAQGXGQA-KRWDZBQOSA-N	435.943	1.983	50	20	IDGD	
CC(C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)C1	1834727687	ASVOKEJGDOXKNY-MGPUTAFESA-N	447.960	1.231	50	20	IDGD	
O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)Cc1ccccc1)CCO2	1834992770	HRTLYJANKVWCDY-LJQANCHMSA-N	425.323	1.471	50	20	IDGD	
CC(=O)Nc1cc(C(=O)N2CCC(N3CCC(NC(=O)[C@H](F)Cl)CC3)CC2)ccn1	1835079562	FYFQTFLLJBMNIW-SFHVURJKSA-N	439.919	1.760	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)C#Cc3ccccc3)CCO2)C1	1835101982	MKZJWLUCKXWROF-LEWJYISDSA-N	439.339	1.731	50	20	IDGD	
Cc1cnoc1C(=O)NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1	1836070379	AHPWQTXWLAWZRA-HNNXBMFYSA-N	431.306	1.859	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@H](C)N3CCN(C)CC3)CC2)CC1	1836375122	XNKLRIPWQLISNY-PXNSSMCTSA-N	442.048	1.211	50	20	IDGD	
O=C(c1csc2c1CCCO2)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1836388928	LDANVQHDZWZVSJ-RDTXWAMCSA-N	432.901	1.678	50	20	IDGD	
CCS(=O)(=O)CC(=O)N1CCC(OC2CCN(C(=O)C(C)(C)CCl)CC2)CC1	1836622107	VDKZBGPCAQECAJ-UHFFFAOYSA-N	437.002	1.685	50	20	IDGD	
Cc1cccc2[nH]c(C(=O)N3CCO[C@]4(COCCN(C(=O)[C@H](O)CCl)C4)C3)cc12	1836912668	GTJBBUNMSDTMFX-WIYYLYMNSA-N	435.908	1.146	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(Cl)cc3)CCO2)C1	1838960235	CADIYWVDOBZAGS-LPHOPBHVSA-N	431.316	1.664	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cncn3-c3ccncc3)C2)C1	1839142769	AHBPWQSKVNMCSM-UWJYYQICSA-N	447.923	1.355	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc([N+](=O)[O-])cc3F)C2)C1	1839147404	PKZKQANEKVPQML-HNAYVOBHSA-N	443.859	1.821	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3ccccn3)C2)C1	1839150801	XUZDGDPDCRJAAK-UXHICEINSA-N	444.359	1.707	50	20	IDGD	
CCc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)cn1	1839151445	RRLORGRXNFPHSF-UXHICEINSA-N	444.359	1.950	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C=N/N3CCCCC3)C2)C1	1839153108	BEQLOXPRHSANKY-IYVWXJGLSA-N	449.379	1.151	50	20	IDGD	
O=C(CCCC(F)(F)F)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839198456	DUKXGRWHQCUQLG-GXTWGEPZSA-N	449.239	1.866	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)c(F)c1	1839201553	ASEOLSQZMDZHTQ-YJBOKZPZSA-N	447.276	1.895	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(-n4cncn4)c3)CCO2)C1	1839437012	ALWHNXFRROBBHT-GHTZIAJQSA-N	447.923	1.355	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccccc3O)CCO2)C1	1839909439	LNYLXJYNTYPKQW-IFXJQAMLSA-N	441.322	1.175	50	20	IDGD	
Cc1ccc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)cc1	1840031880	FSLZELIIUALGJX-UZLBHIALSA-N	439.350	1.777	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ncccc3F)C2)C1	1840034656	SCGSLYOPXCRBCK-SJCJKPOMSA-N	430.274	1.074	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4cnccc4c3)C2)C1	1840152455	IZPKHLGDUMZQLS-DENIHFKCSA-N	447.919	1.559	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1C[C@@]1(F)Cl)CCO2	1840248230	YNWYSHBSVDFPBS-GVARAGBVSA-N	427.698	1.151	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@H]2CC(=O)N(c3cccc(OC)c3)C2)C1	1841009802	LVROYFZIFUAYBA-QAPCUYQASA-N	449.935	1.505	50	20	IDGD	
Cc1nnsc1C(=O)N1CCCC12CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1843511003	HRUAAFJEAHCTLX-LBPRGKRZSA-N	443.957	1.796	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@]1(F)CCN(C(=O)OC(C)(C)C)C1)C2	1846362516	JBAUFAANLZWGFC-VBKZILBWSA-N	447.935	1.793	50	20	IDGD	
O=C([C@H](Br)Cc1ccccc1)N1CC2(CCCN2C(=O)CCn2ccnn2)C1	1846623937	POEUDYGXEUCGRC-QGZVFWFLSA-N	446.349	1.878	50	20	IDGD	
Cc1cc(F)c(C(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)cc1F	1846823404	DZWUDMMOTMQHBO-UHFFFAOYSA-N	429.427	1.403	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)C2(F)CN(C(=O)OC(C)(C)C)C2)C1	1847131649	AXRBAAZFUCOIMX-ZDUSSCGKSA-N	433.908	1.403	50	20	IDGD	
C=CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](Cl)COC	1847942334	SHNXRVIIEKFUKW-FZKCQIBNSA-N	429.945	1.911	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)Cn2c(=O)n(CC)c3ccccc32)cc1	10752833	VRQLIZBTOUIHDG-HNNXBMFYSA-N	426.473	1.837	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)OCC(=O)NNC(=O)c2cccs2)c1	10927275	QKWFUOHOFUWKBU-UHFFFAOYSA-N	439.515	1.397	50	20	IDGD	
CCOc1ccccc1N1C[C@@H](C(=O)NNC(=O)COc2ccccc2OC)CC1=O	15879301	QJHYTJDNULKBEV-HNNXBMFYSA-N	427.457	1.673	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc1OC	15948324	FQWSEPLMZPXJSJ-UHFFFAOYSA-N	433.486	1.563	50	20	IDGD	
CNS(=O)(=O)c1ccc(C(=O)NNC(=O)[C@@H](C)Oc2ccc3ccccc3c2)cc1	18053702	DJXUPKZHCCCBSW-CQSZACIVSA-N	427.482	1.976	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CN2CCN(Cc3nc(-c4ccc(C)cc4)no3)CC2)cc1	22842282	JTFUYPVRIGQZSM-UHFFFAOYSA-N	448.527	1.932	50	20	IDGD	
COc1ccccc1C(=O)NCC(=O)OCC(=O)C(C#N)=C1N(C)c2ccccc2N1C	28221280	OKYYSYXDRPVXCA-UHFFFAOYSA-N	434.452	1.859	50	20	IDGD	
CSc1nc2nc(C)c(CC(=O)NNC(=O)COc3ccc(C)c(C)c3)c(C)n2n1	104948009	VRWVVEJNCWPURF-UHFFFAOYSA-N	428.518	1.849	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cnn(-c3ccccn3)c2C)cc1OC	106096614	GZDXYEBLQSOLAY-UHFFFAOYSA-N	439.428	1.211	50	20	IDGD	
O=C(NNC(=O)c1c[nH]c2ccccc12)c1cc(S(=O)(=O)N2CCSCC2)c[nH]1	109205250	CXRSXODVLUIRFO-UHFFFAOYSA-N	433.515	1.308	50	20	IDGD	
CCOC(=O)c1ccc(N2CCCN(CC(=O)NNC(=O)c3ccc(C)cc3)CC2)nc1	725799442	UNKGHAZLGGVSDQ-UHFFFAOYSA-N	439.516	1.540	50	20	IDGD	
C=CCc1cc(CNC(=O)NNC(=O)CNC(=O)c2cccs2)cc(OC)c1OC	725873906	UROBSEPWUNTGLI-UHFFFAOYSA-N	432.502	1.754	50	20	IDGD	
CN(C)C(=O)[C@@H]1CCCN1CCCNC(=O)NNC(=O)CSc1ccc(Cl)cc1	726277968	TVYCVOHXDUKYNL-INIZCTEOSA-N	441.985	1.705	50	20	IDGD	
C[C@H]1CCCN(S(=O)(=O)c2ccc(C(=O)N([C@@H]3CCS(=O)(=O)C3)N(C)C)cc2)C1	728179340	JTJWKHMQWXOAEQ-DOTOQJQBSA-N	443.591	1.213	50	20	IDGD	
CC/C=C(\C)C(=O)N1CSC[C@@H]1C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	728211927	MGOVJXMMASQGIM-RRQFRJBNSA-N	438.575	1.828	50	20	IDGD	
Cc1cccc(-n2c(C)cc(/C=C(\C#N)C(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)c2C)c1	728382359	IMAMQFKGQNZTGI-WAKXPGHKSA-N	440.525	1.892	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)c2nnc(O)c3ccccc23)ccc1OCC(=O)OC	728511855	DMSLINXFCXIOCB-UHFFFAOYSA-N	440.412	1.361	50	20	IDGD	
O=C(Cn1nc(-c2ccccc2)oc1=O)NNC(=O)c1cc(F)ccc1Br	728550188	YALUBOCFZUPGSP-UHFFFAOYSA-N	435.209	1.866	50	20	IDGD	
C[C@@]1(c2ccc(CNC(=O)NNC(=O)c3cccc(OC(F)F)c3)cc2)NC(=O)NC1=O	728751308	QAUFMFSDVSXXIN-FQEVSTJZSA-N	447.398	1.487	50	20	IDGD	
CSCC[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)NNC(=O)c1cccc(C#N)c1	728871781	DRHWZPXHILQMJF-KRWDZBQOSA-N	441.469	1.779	50	20	IDGD	
COCCCn1c(S)nc2cc(C(=O)NNC(=O)Cc3cccnc3)ccc2c1=O	728892126	NXOBKYKFAOUIIX-UHFFFAOYSA-N	427.486	1.120	50	20	IDGD	
COc1ccc(N2CCN(CCCNC(=O)NNC(=O)Cc3cccnc3)CC2)cc1	728956996	GFGPFYNBXPLWAD-UHFFFAOYSA-N	426.521	1.175	50	20	IDGD	
CN(CCCC(=O)NNC(=O)CCc1ccccc1O)S(=O)(=O)c1ccc(F)cc1	730034199	ARBXHSSZOQSVRV-UHFFFAOYSA-N	437.493	1.712	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H](CCNC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)C1	730141221	SBVXKMFLJDOVMC-CQSZACIVSA-N	444.496	1.253	50	20	IDGD	
O=C(/C=C/c1ccc(I)o1)NNC(=O)COc1ccccc1O	730782121	HYDNSNNTJBCDKP-SOFGYWHQSA-N	428.182	1.829	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)NC1CCN(CC(=O)N(C)C)CC1	731761756	BZJBEEVXGYCZHJ-INIZCTEOSA-N	441.532	1.490	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)N1CCN(CC(=O)Nc2ccc(OC(F)(F)F)cc2)CC1	731848479	FVNZHXBWGWKDOS-ZDUSSCGKSA-N	445.442	1.087	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2ccc(-c3nc(=O)o[nH]3)cc2)cc1Br	732306301	XRWAWTTYXXJGQI-UHFFFAOYSA-N	433.218	1.876	50	20	IDGD	
C[C@@H]1Cc2ccccc2N1C(=O)[C@@H]1CCCC[C@@H]1C(=O)NNC(=O)C(=O)N1CCCC1	732755090	ODYCIGIUWIRKAP-BPQIPLTHSA-N	426.517	1.540	50	20	IDGD	
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC(=NNC(=O)c2ccc(O)c(Cl)c2)CC1	734093584	NKEHWKSLMZHBDZ-UHFFFAOYSA-N	425.898	1.956	50	20	IDGD	
COc1ccc([C@H]2[C@H](C(=O)NNC(=O)COCc3ccccc3)CCC(=O)N2C)cc1	737634933	QHQBLMJUZMIBMS-KNQAVFIVSA-N	425.485	1.969	50	20	IDGD	
CC(=O)N[C@H](CC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)c1ccc(F)cc1F	741559508	WBTYBYGSHNCXQA-GOSISDBHSA-N	446.458	1.386	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)NCCCN2C(=O)NC3(CCCCC3)C2=O)cc1	743523887	UCZSKQGXTGCJDZ-UHFFFAOYSA-N	445.524	1.733	50	20	IDGD	
O=C(NNC(=O)c1cccc(Br)c1)NNC(=O)c1ccc2c(c1)OCCO2	743687160	KFSREHAUJBZOMY-UHFFFAOYSA-N	435.234	1.509	50	20	IDGD	
CC(=O)N1C[C@@H](C(=O)NNC(=O)c2cc(Br)ccc2O)Oc2ccccc21	743731939	DMAPCTVDXXMYGM-INIZCTEOSA-N	434.246	1.730	50	20	IDGD	
CC(=NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)c1ccc2c(c1)NC(=O)CO2	744729267	QTNGDCPLUSYNSL-UHFFFAOYSA-N	442.497	1.956	50	20	IDGD	
Cc1ccc(F)c(NC(=S)NNC(=O)Cn2c(=O)ccn(Cc3ccccc3)c2=O)c1	745205056	WZQPDCQBMSPVGZ-UHFFFAOYSA-N	441.488	1.524	50	20	IDGD	
O=C(CSCc1cc(=O)n2ccsc2n1)NNC(=O)Cc1cn2ccccc2n1	746545772	VPLDWMQPMKKLOL-UHFFFAOYSA-N	428.499	1.027	50	20	IDGD	
Cc1nn(C)c(C)c1S(=O)(=O)N[C@H](C)C(=O)NNc1ccc(C#N)c(C(F)(F)F)c1	746888905	IITKKEUSJGSTKI-SNVBAGLBSA-N	444.439	1.738	50	20	IDGD	
CCOC(=O)NNS(=O)(=O)c1c(Br)cc(C(=O)O)cc1Br	747595517	POKOOMMMHXYNPU-UHFFFAOYSA-N	446.073	1.849	50	20	IDGD	
Cn1ccnc(NNC(=O)c2cccc(S(=O)(=O)N3CCc4sccc4C3)c2)c1=O	747937531	HNNLABOBHBWEPA-UHFFFAOYSA-N	445.526	1.346	50	20	IDGD	
COc1cc(OC)cc(N2CC[C@H](NC(=O)NNC(=O)COc3ccc(F)cc3)C2=O)c1	747956181	SUVFVRSVARNGFZ-SFHVURJKSA-N	446.435	1.358	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNc3cccc([N+](=O)[O-])c3)CC2)cc1	748002756	XCFUDDPDKDHUGU-UHFFFAOYSA-N	433.490	1.353	50	20	IDGD	
CN(C(=O)CNC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)C1CCCCC1	748663623	CBTGEMYNNPBJCY-UHFFFAOYSA-N	444.580	1.320	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@@H]1CCCN(Cc2cccnc2)C1	749160945	HNHVWJZYWDXBDI-QGZVFWFLSA-N	444.561	1.356	50	20	IDGD	
CCCOc1ccc(-c2nc(C(=O)NNC(=O)N[C@H]3CCS(=O)(=O)C3)cs2)cc1	749847228	BKNCYJBWTZFMPI-ZDUSSCGKSA-N	438.531	1.730	50	20	IDGD	
Cc1nn(Cc2ccc(F)cc2)c(Cl)c1C(=O)NNC(=O)CNC(=O)c1ccco1	751204878	RHQNMHOJCJZYPZ-UHFFFAOYSA-N	433.827	1.816	50	20	IDGD	
CN(C)C(=O)COC1CN(C(=O)/C(C#N)=C\c2cn(CCC#N)nc2-c2ccccc2)C1	752740316	OEHSMJAAZMTTFE-WQRHYEAKSA-N	432.484	1.686	50	20	IDGD	
CC(C)N1CC(=NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)[C@@H](C)C1	754256663	YHPWIDURCTUKHJ-KRWDZBQOSA-N	436.578	1.472	50	20	IDGD	
O=C(COC(=O)c1cc2cc(F)ccc2oc1=O)NNC(=O)[C@H]1COc2ccccc2O1	754592825	DFOQMDPSAGAKFY-QGZVFWFLSA-N	442.355	1.076	50	20	IDGD	
Cc1ccc(-n2nc(Br)cc2C(=O)NNC(=O)CNC(=O)c2ccco2)cc1	755267983	RLFJDFDLYHJPND-UHFFFAOYSA-N	446.261	1.727	50	20	IDGD	
O=C(NNC(=O)c1cccnc1)Nc1ccc(Cl)c(S(=O)(=O)N2CCOCC2)c1	755360863	HPDVAJMDDQMYGX-UHFFFAOYSA-N	439.881	1.222	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)NNC(=O)COc2ccccc2-c2ccccc2)co1	755396939	IUPDQJAFIRGFKX-UHFFFAOYSA-N	429.454	1.695	50	20	IDGD	
CON(C)S(=O)(=O)c1ccc(NC(=O)NNC(=O)COc2cc(C)ccc2C)cc1	755533989	DVQMKQPTUQAGKY-UHFFFAOYSA-N	436.490	1.717	50	20	IDGD	
CN1CC(=O)N(c2cccc(NC(=O)NNC(=O)c3cnn(-c4ccccc4)c3)c2)C1=O	755991798	LDAJHJIDHJIIPS-UHFFFAOYSA-N	433.428	1.737	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c(OCCN(C)C)c1	756674299	PKERBPLRNAEQBS-UHFFFAOYSA-N	434.518	1.805	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)Nc1ccn(CCS(C)(=O)=O)n1	756758003	DLBPOHGRZYTKJE-CQSZACIVSA-N	445.501	1.701	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)Nc2ccn(CCS(C)(=O)=O)n2)cc1OC	756761502	QEGSWBZHDOZRBJ-UHFFFAOYSA-N	439.494	1.192	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)[C@](C)(O)CN3Cc4ccccc4C3=O)nc21	756830531	LDZHFRRGDQSCSZ-OAQYLSRUSA-N	439.476	1.137	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)N[C@@H]1CCN(c2ccccc2OC)C1=O	757287822	SPKIFZMOVVPHEP-MRXNPFEDSA-N	426.473	1.772	50	20	IDGD	
CC[C@@H](Cc1ccccc1Br)C(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1	758156562	ATZYWTFSHCVTGW-AAEUAGOBSA-N	432.340	1.535	50	20	IDGD	
C[C@@H]1OC(C)(C)N(C(=O)OC(C)(C)C)[C@@H]1CNC(=O)NN[C@]1(C)CCS(=O)(=O)C1	762323903	ARXRIWGVKGYHOO-VEVIJQCQSA-N	434.559	1.128	50	20	IDGD	
CCOc1cc(C(=O)N(C)C)ccc1NC(=O)C(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	763471144	DGIYVNVFSKXANX-UHFFFAOYSA-N	443.416	1.095	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)NNC(=O)c1cccc(Br)c1	763522825	GRTIBWWCGPMXJA-UHFFFAOYSA-N	439.291	1.922	50	20	IDGD	
CN(C)C(=O)C[C@H]1CN(C(=O)C(=O)NNC(=O)c2ccccc2F)c2ccc(Cl)cc21	763557131	WDIZCGRJDWAJMX-LBPRGKRZSA-N	446.866	1.849	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2cc(N3CCOC3=O)ccc2C)c1	763664756	FRLDZYGZSUTCHE-UHFFFAOYSA-N	440.456	1.733	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccnc(Oc3ccccc3)c2)cc1	763680752	QHKPVRGNXUHSCN-UHFFFAOYSA-N	431.408	1.910	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(CN(C)C)ccc1C	763681335	JOKLQZWNLBNVPQ-UHFFFAOYSA-N	428.489	1.620	50	20	IDGD	
O=C(COc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1ccc(CN2CCCC2=O)cc1	763686983	XYQRALAMTABFIV-UHFFFAOYSA-N	444.875	1.627	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2cccc3c2CCCC3)c1	763719037	UEDKDYJTGYJROT-UHFFFAOYSA-N	444.513	1.215	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2cccc(NC(=O)[C@H](C)OC)c2)c1	763772564	MVHJBADZBFFLNV-LBPRGKRZSA-N	444.444	1.077	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2ccc(N(C)C)cc2C)c2ccccc2c1=O	763787370	YSFPLVUOEPMACK-UHFFFAOYSA-N	436.472	1.191	50	20	IDGD	
COCCOc1c(Cl)cccc1NC(=O)C(=O)NNC(=O)COc1ccc(F)cc1	763838175	PDOHNUFRTOWMOC-UHFFFAOYSA-N	439.827	1.669	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)CCC(=O)N2C	763850977	RJUMAACWYRYOJD-LBPRGKRZSA-N	428.420	1.288	50	20	IDGD	
CC(C)n1nnnc1-c1ccccc1NC(=O)C(=O)NNC(=O)Cc1c[nH]c2ccccc12	763864602	FGOSKZSQAQWNJB-UHFFFAOYSA-N	446.471	1.731	50	20	IDGD	
C[C@H]1COCCN1c1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)cc1	763865181	JEEMDTLHRPVGET-LSDHHAIUSA-N	444.463	1.604	50	20	IDGD	
CCOC(=O)c1cn(C)nc1NC(=O)C(=O)NNC(=O)CCSc1ccc(F)cc1	763895681	OSLVWRSHRBEWOV-UHFFFAOYSA-N	437.453	1.004	50	20	IDGD	
CCCS(=O)(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)Cc2ccc(F)cc2)c1	763918986	NYOCRWHQPCDTFU-UHFFFAOYSA-N	436.465	1.306	50	20	IDGD	
O=C(NNC(=O)c1cccc(Br)c1)C(=O)Nc1ccc(-n2cccn2)nc1	764059753	YQRRPZNCABHJIH-UHFFFAOYSA-N	429.234	1.430	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(Cl)ccc2C(=O)N2CCCC2)c(O)c1	764111509	XJGURMPBFPCXOH-UHFFFAOYSA-N	444.875	1.990	50	20	IDGD	
CN1CCN(c2ccc(NC(=O)C(=O)NNC(=O)c3ccc(C#N)cc3)cc2Cl)CC1	764182551	OACJMPWRDGGCEV-UHFFFAOYSA-N	440.891	1.363	50	20	IDGD	
CC(=O)N(Cc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccccc2F)cc1)C(C)C	764320512	ZNUHWLDZELRXLF-UHFFFAOYSA-N	428.464	1.911	50	20	IDGD	
Cn1cnnc1-c1cccc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)c1	764379833	MBOFDWSOMGLQNH-UHFFFAOYSA-N	430.371	1.240	50	20	IDGD	
CC(C)CCn1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)n1	764388982	VPKPXMYNZNQDAT-UHFFFAOYSA-N	427.440	1.858	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)cccc1N1CCOC1=O	764395071	ZHNXPJSSJZKBRK-UHFFFAOYSA-N	444.469	1.535	50	20	IDGD	
COC(=O)NNC(=O)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)[C@H]2C[C@H]3CC[C@H]2C3)cc1	765375746	IOQBRTUFOHRYFE-WFGGJUAMSA-N	438.506	1.115	50	20	IDGD	
Cn1ncc(C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)c1C(F)F	766662756	FSSNMAFQHFMFHH-UHFFFAOYSA-N	440.882	1.590	50	20	IDGD	
CCOC(=O)c1cnc(C)c(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c1	767189947	SRXRMRRKPQMUTF-UHFFFAOYSA-N	439.516	1.540	50	20	IDGD	
O=S(=O)(CBr)NC[C@@H](NS(=O)(=O)CBr)C1CCCC1	767541175	PORFRCHHKDUOSP-SECBINFHSA-N	442.195	1.089	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)c1c[nH]c2c(OC(F)(F)F)cccc2c1=O	767809057	AQQWVFKPAQSYIL-UHFFFAOYSA-N	438.318	1.211	50	20	IDGD	
Cc1cc(N2CCC[C@@H](NC(=O)NNC(=O)c3cnn(C)c3)C2=O)ccc1Br	768431427	UAWQWQPVLVZVPM-OAHLLOKOSA-N	449.309	1.631	50	20	IDGD	
CCCn1c(C)cc(/C=C(\C#N)C(=O)N2CCN(S(=O)(=O)c3nc[nH]n3)CC2)c1C	768728095	BHRTYLJZVFDMJN-GZTJUZNOSA-N	431.522	1.073	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)c1cccnc1I	768737142	LKQQJVXXRPMVGN-UHFFFAOYSA-N	447.254	1.855	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)Cc1ccccc1I	772207372	NEXWWTSCBHRXAD-LLVKDONJSA-N	432.258	1.959	50	20	IDGD	
COc1c(C)cc(C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)cc1C	774305533	VCTACWYYTHWYNJ-UHFFFAOYSA-N	433.534	1.400	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(-n3cnc4ccccc43)nc2)cc1	775021369	SAZGWVSWQPHNSW-UHFFFAOYSA-N	440.419	1.910	50	20	IDGD	
C#C[C@@H](NC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1)[C@H]1CCCO1	776228640	AWLPHMDKZPFDKH-GDBMZVCRSA-N	448.526	1.674	50	20	IDGD	
Cc1nn(C)c2sc(C(=O)N[C@H](C)C(=O)NNc3cccc(S(C)(=O)=O)c3)cc12	776528420	UVETZNQPRSAVIY-LLVKDONJSA-N	435.531	1.608	50	20	IDGD	
CC(=O)c1cccc(OCc2cc(C(=O)NNC(=O)CNC(=O)OC(C)(C)C)no2)c1	778432947	DNVHQNXGRMEAGK-UHFFFAOYSA-N	432.433	1.742	50	20	IDGD	
COCc1ccccc1S(=O)(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12	778555926	FLSOCRANYGNZBR-UHFFFAOYSA-N	430.486	1.747	50	20	IDGD	
CS(=O)(=O)CCn1ccc(NC(=O)NNc2ccc([N+](=O)[O-])cc2Br)n1	779435402	OKLKRZMKTKZMFN-UHFFFAOYSA-N	447.271	1.747	50	20	IDGD	
Cc1cc(C(=O)N2CCC(C)CC2)ccc1NC(=O)C(=O)NNC(=O)c1ccc(O)cc1	782829937	AAISNSJOYPOLBI-UHFFFAOYSA-N	438.484	1.972	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C(=O)Nc2c(F)cccc2Br)nc2ccccc21	782887096	OAFINUPFFKNLLE-UHFFFAOYSA-N	448.252	1.804	50	20	IDGD	
CCCN(CCC)C(=O)c1ccc(NC(=O)C(=O)NN[C@]2(C)CCS(=O)(=O)C2)cc1	783425324	BYGHRGRPYWVKMT-HXUWFJFHSA-N	438.550	1.085	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1ccc(F)c(C(F)(F)F)c1	784003888	QZMYCPGSUWYDDS-UHFFFAOYSA-N	432.355	1.422	50	20	IDGD	
NC(=O)[C@@H](Cc1ccc(C(F)(F)F)cc1)NNC(=O)COc1ccccc1[N+](=O)[O-]	784061983	XHBWCERHTZMQMO-CYBMUJFWSA-N	426.351	1.710	50	20	IDGD	
CC(C)COc1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)cn1	784213486	NVRWZLPEEYVQGQ-UHFFFAOYSA-N	447.517	1.639	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)[C@H]2CC=CC[C@H]2C(=O)N2CCOCC2)cc1OC	784297600	YOXULQRMFJZROO-DLBZAZTESA-N	431.489	1.296	50	20	IDGD	
O=C(NNc1nccnc1Cl)C(=O)Nc1ccccc1S(=O)(=O)N1CCCCC1	784776435	IIWTWRLXSHJAQO-UHFFFAOYSA-N	438.897	1.386	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1cnc(C2CC2)nc1	784832711	DPKWRSNYCYXFQP-UHFFFAOYSA-N	432.506	1.513	50	20	IDGD	
CCOC(=O)[C@@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNc2cccnc2Cl)cc1	784848199	GZHXBNWULWAKPM-LLVKDONJSA-N	433.852	1.498	50	20	IDGD	
CNC(=O)c1cccc(NC(=O)C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)c1	785099797	KWAZMOOLBFTMIV-UHFFFAOYSA-N	431.399	1.298	50	20	IDGD	
COC(=O)c1ccsc1NC(=O)C(=O)NNc1c(OC)cccc1S(C)(=O)=O	785329866	AHKOQZMOQQSZLV-UHFFFAOYSA-N	427.460	1.029	50	20	IDGD	
O=C(NNC(=O)C(F)(F)C1(O)CCCC1)c1cccc(S(=O)(=O)N2CCCCC2)c1	785669515	DDUJTUWSAQTEAI-UHFFFAOYSA-N	445.488	1.563	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc1N1CCNC1=O	786358981	WAPPINPHHKBTTA-UHFFFAOYSA-N	435.444	1.882	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc2c(c1)CCCC2)NNc1ccc(-n2ccnc2)nn1	788173600	AHXUXNGLPQXLDL-UHFFFAOYSA-N	441.517	1.353	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)c1nc(Br)ccc1Br	790662825	HUGYYWMAYPXQJC-UHFFFAOYSA-N	436.104	1.672	50	20	IDGD	
CN1CCCC(C)(C)[C@@H]1CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	790897418	WIXXBOGUARRWJF-INIZCTEOSA-N	425.555	1.001	50	20	IDGD	
CO[C@@H]1CCOc2c(NC(=O)C(=O)NNC(=O)c3cnn(-c4ccccc4)c3)cccc21	790951633	FWRXPNSVDGORGA-GOSISDBHSA-N	435.440	1.742	50	20	IDGD	
CCS(=O)(=O)c1ccc(CNC(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)s1	792224439	UWCIFMBEEHHXKM-NSHDSACASA-N	429.495	1.979	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)[C@@H]1CC(=O)N(c2ccc(F)cc2F)C1	795177414	MQJZUZVRRUUQKR-GFCCVEGCSA-N	438.456	1.711	50	20	IDGD	
COCCNC(=O)c1cccc(S(=O)(=O)NNC(=O)c2ccc(Cl)cc2F)c1	795333907	RIWKESIPZMLKCS-UHFFFAOYSA-N	429.857	1.479	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H](Cc2cccc(F)c2)n2nnnc2C)cc1C	798308192	SPPUGZQQTOPCDV-SFHVURJKSA-N	439.451	1.307	50	20	IDGD	
COc1cc(C=NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)ccc1C#N	799464686	IQUCNAVGYLDGOS-UHFFFAOYSA-N	428.470	1.352	50	20	IDGD	
O=C(NNC(=O)C(=O)Nc1ccccn1)N[C@@H]1CCOc2c(Br)cccc21	800735077	KCQYBQGBGQAIFB-GFCCVEGCSA-N	434.250	1.637	50	20	IDGD	
Cc1cccc(N2CCN(S(=O)(=O)CC(=O)NNC(=O)Nc3ccccc3)CC2)c1	801987703	UMDWOYAKAXOUFM-UHFFFAOYSA-N	431.518	1.300	50	20	IDGD	
O=C(CCn1nnc2ccccc2c1=O)NNC(=O)Nc1ccc(Br)cc1	801996204	BQULHAQMESWDGQ-UHFFFAOYSA-N	431.250	1.797	50	20	IDGD	
O=C(NNC(=O)c1ccc(S(=O)(=O)N2CCOCC2)o1)Nc1cc(F)cc(F)c1	802001448	WURYTUOVDBIYON-UHFFFAOYSA-N	430.389	1.045	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)Cc2c(C)[nH]c3ccnn3c2=O)c(OC)cc1Cl	802083533	LXZFPKNBTDPILV-UHFFFAOYSA-N	434.840	1.397	50	20	IDGD	
CN(C)S(=O)(=O)C[C@H](NC(=O)NN=c1sc2ccccc2n1C)C(F)(F)F	805767555	LGFKRXUNVIKJEI-NSHDSACASA-N	425.458	1.177	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2ccc3ccccc3c2)cc1	810164668	MBWMTGDRFWEOTH-UHFFFAOYSA-N	440.481	1.538	50	20	IDGD	
CC(C)Nc1ccc(S(=O)(=O)NCC(=O)NNC(=O)CC2CCCC2)cc1[N+](=O)[O-]	810282280	QTZQNUOXWNOHER-UHFFFAOYSA-N	441.510	1.421	50	20	IDGD	
NC(=O)c1ccc(OCC(F)F)c(NC(=O)NNC(=O)COc2ccc(F)cc2)c1	810341734	QCSMAJRTKOLMMI-UHFFFAOYSA-N	426.351	1.800	50	20	IDGD	
NC(=O)c1ccc(NC(=O)C(=O)NNc2ncnc3ccsc23)c(OCC(F)F)c1	810392497	WNDNLVQVCQBVBG-UHFFFAOYSA-N	436.400	1.516	50	20	IDGD	
O=C(NCCc1cn[nH]c1)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	812523094	SWWUMFQEARIIFZ-UHFFFAOYSA-N	431.456	1.355	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NCc2csc(COC)n2)c2ccccc2c1=O	812552336	ZCPAQBKDPXMRQW-UHFFFAOYSA-N	444.517	1.944	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)N[C@H](CN1CCOCC1)c1ccc(C)cc1	813492092	IZHOQWBBHAKCKJ-LJQANCHMSA-N	442.516	1.786	50	20	IDGD	
O=C(COC(=O)c1cn2c(Br)cnc2s1)NNC(=O)c1cccs1	815370910	CDSCPNKJKFLNQD-UHFFFAOYSA-N	429.277	1.838	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2cccn2C)nnn1Cc1ccc(C(F)(F)F)cc1	815567796	MLFLYCAWMGGFGC-UHFFFAOYSA-N	449.393	1.392	50	20	IDGD	
Cc1nn(C)c2ncc(C(=O)NNC(=O)c3ccc(S(=O)(=O)N4CCCC4)cc3)cc12	818500587	WISKCJFDROVNCF-UHFFFAOYSA-N	442.501	1.136	50	20	IDGD	
O=C(NNC(=O)c1sccc1S(=O)(=O)N1CCOCC1)c1ccc2ccccc2n1	818515265	PHKGKYVTSXQZON-UHFFFAOYSA-N	446.510	1.392	50	20	IDGD	
Cc1ccc(N2C[C@@H](C(=O)OCC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)CC2=O)cc1	849123006	PVZCJJYLKRVWFD-HNNXBMFYSA-N	440.412	1.261	50	20	IDGD	
Cc1cc(C)nc(-n2nc(C)c(CC(=O)OCC(=O)NNC(=O)c3cccs3)c2C)n1	914654316	CFQLJPMTYKFAKW-UHFFFAOYSA-N	442.501	1.504	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)CCCN1C(=O)CCC1=O	915616579	BYIRUXITGKZUMS-NSHDSACASA-N	426.267	1.293	50	20	IDGD	
COc1cccc(C[C@H](C(=O)NNC(=O)c2ccc(OC)c(OC)c2)n2nnnc2C)c1	915685851	OJFMNJZYXBRAKA-QGZVFWFLSA-N	440.460	1.252	50	20	IDGD	
COc1ccccc1[C@H](NC(=O)NNC(=O)c1ccc2c(c1)OCCO2)c1nccn1C	916227086	MJCUJMPEUAWQKD-IBGZPJMESA-N	437.456	1.934	50	20	IDGD	
CC(C)NS(=O)(=O)Cc1ccccc1CNC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	916228911	PESXCDCXYWUXIV-UHFFFAOYSA-N	449.489	1.567	50	20	IDGD	
O=C(NCCc1cccc2cccnc12)NNC(=O)c1csc(N2CCOCC2)n1	916240823	QBDNSXHHGKYUOS-UHFFFAOYSA-N	426.502	1.715	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)NCC1(NS(C)(=O)=O)CCCCC1	916253974	WNOPFKODUBFQLQ-ZDUSSCGKSA-N	430.502	1.176	50	20	IDGD	
Cc1nn([C@H]2CCS(=O)(=O)C2)c(Cl)c1C=NNC(=O)COc1ccc(F)cc1	916331232	JKLVKSZDRGBWIM-ZDUSSCGKSA-N	428.873	1.873	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)Cc1nc2ccccc2n1C)N1CCN(c2ccccc2)CC1	916514834	PDPJWWUVOFFCIW-GOSISDBHSA-N	449.559	1.657	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)CN2C(=O)N[C@]3(CCCC[C@H]3C)C2=O)o1	920272336	MYXANJUHPCMQTH-SZNDQCEHSA-N	433.509	1.383	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N[C@H](C)Cn2cccn2)cc1	920853411	CHNYRDZHJUSAFH-UWCCDQBKSA-N	447.499	1.742	50	20	IDGD	
CCOCCOc1ccc(Br)cc1C=NNC(=O)[C@@H]1CCS(=O)(=O)C1	921258211	APJNNOULOMFMDE-GFCCVEGCSA-N	433.324	1.749	50	20	IDGD	
COCc1cccc(S(=O)(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)c1	1116088757	XUJYEQGMBAHMNO-UHFFFAOYSA-N	427.523	1.790	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)c1ncc(C(N)=O)cc1Cl	1319398945	LIKGUJAXWRVKMB-QMMMGPOBSA-N	441.669	1.825	50	20	IDGD	
Cc1cccc(N2N=C(C(=O)NNc3ccc(S(=O)(=O)N(C)C)cc3)CCC2=O)c1	1324102950	UZGLAKFQNHKHDX-UHFFFAOYSA-N	429.502	1.871	50	20	IDGD	
Cc1cc([C@H](C)NC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)c(C)o1	1324500145	LPQVHGRCBFYQIQ-AWEZNQCLSA-N	436.538	1.615	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)Cn2c(=O)oc3ccccc32)CC1	1328548841	IRWSJIKBDQXVFS-UHFFFAOYSA-N	433.465	1.324	50	20	IDGD	
CC(=O)N[C@H](Cc1c[nH]c2ccc(Br)cc12)C(=O)NNC(=S)NC(C)C	1329554751	GNSAAECVLKKILF-OAHLLOKOSA-N	440.367	1.881	50	20	IDGD	
CC(=O)N1Cc2ccccc2C[C@H]1C(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1	1339205485	ZXGFNOITDKYHDD-IBGZPJMESA-N	444.532	1.754	50	20	IDGD	
Cc1c(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](O)CCl)C3)nc2ccccn12	1778493884	RRTMKZBIRCUOND-GCKMJXCFSA-N	434.924	1.370	50	20	IDGD	
Cc1cc2nnc(C(=O)N3CCO[C@]4(CCN(C(=O)CO[Si](C)(C)C)C4)C3)c(C)n2n1	1779295342	JLMCDERBPAKQRX-FQEVSTJZSA-N	446.584	1.036	50	20	IDGD	
CCc1cc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](Br)CC)CCO3)nn1C	1779832181	CDAQERBSEMCSDM-KDOFPFPSSA-N	427.343	1.600	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(C#N)cc(OC)c2)C1	1780091416	NNIRNMVNUYVVAI-WOIUINJBSA-N	449.935	1.948	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(O)nc1)C2)[C@@H](F)Br	1780773972	QNVQQBWHFRWXPH-SUYBPPKGSA-N	430.274	1.605	50	20	IDGD	
C[C@H](Nc1ccccn1)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@](C)(Cl)CCl)C2)C1	1781230335	RACVGIIKROAUJY-KYNGSXCRSA-N	429.348	1.948	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)[C@H](O)Cc3ccccc3)CCO2)C1	1781233053	PHRCZBXRZHPHMV-LSTHTHJFSA-N	429.344	1.656	50	20	IDGD	
C[C@H](Oc1ccccn1)C(=O)N1CCO[C@]2(CCN(C(=O)[C@](C)(Cl)CCl)C2)C1	1781234610	XCXDNKADCGXZMD-GDIGMMSISA-N	430.332	1.915	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccncn1)C2	1781899917	DGDOXYHHBHZEQA-JCKWVBRZSA-N	425.327	1.778	50	20	IDGD	
COC(OC)C(=O)N1CCO[C@@]2(CCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1	1782861820	KUXXBHUVPMAPQV-ZVYZCIRASA-N	435.427	1.321	50	20	IDGD	
Cc1ccc(C)c(CC(=O)N2CC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c1	1783291870	DEDGQLUFBPSDIX-HSZRJFAPSA-N	430.549	1.049	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3c(C)nn(C)c3C)CCO2)C1	1783344541	UNKCAYKGEABJHH-RDTXWAMCSA-N	427.343	1.654	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)CNC(=O)OC(C)(C)C)CCO2)C1	1783354811	GBWDTQWHVGNXJX-FZKQIMNGSA-N	448.358	1.515	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cc(Cl)cnc3O)CCO2)C1	1783528426	NRUPLHCTLRJVON-QLJPJBMISA-N	432.702	1.668	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H]1CCc3ccccc3[C@@H]1O)CCO2	1783870527	CSWPBVXDYMNELM-OZIGNCPNSA-N	436.936	1.366	50	20	IDGD	
O=C(CCc1cnc2ccccc2c1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21	1783900875	UCDRUEKXLGLYKS-MMKMLUHNSA-N	445.947	1.747	50	20	IDGD	
Cc1n[nH]c(C)c1CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]2C1	1783972822	QHKOZOOLONIQTK-GQGQLFGLSA-N	441.370	1.580	50	20	IDGD	
Cc1nccn1CCCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2	1784412016	PMSMSEGDFPBZOG-KDOFPFPSSA-N	427.343	1.585	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](C)Oc3cccnc3)C2)C1	1784539708	NOZAVRKMHCQGDO-SPYBWZPUSA-N	440.338	1.710	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)c1ncc(F)cc1F	1784768364	WFTIIAKLVCCOJV-VWBVRBGYSA-N	436.228	1.644	50	20	IDGD	
C[C@@H](Cn1cccn1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]21	1785442152	MYXSVYYCGRIOSS-SIBFUHKCSA-N	431.364	1.735	50	20	IDGD	
CCC[C@H](NC(C)=O)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](Br)CC)CCO2	1785446376	GCPCQYHJIBDLMS-RVKKMQEKSA-N	432.359	1.295	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)c1nnsc1C1CC1	1787679858	QQFAUMCCJJKVGM-RMIALFOJSA-N	447.330	1.699	50	20	IDGD	
Cc1cc2nc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)[C@@H](O)CCl)C[C@@H]43)[nH]c2cc1C	1788545591	YPWIUKRUUSKLMV-USJZOSNVSA-N	434.924	1.373	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CNc4ccccc43)C[C@@H]21)[C@@H](F)Br	1789922264	HGXHWOZVOXWHFJ-LPZDXIQQSA-N	440.313	1.866	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(-n4cncn4)c3)[C@H]2C1	1790249165	UICQEAMFPFOKQT-WNHJNPCNSA-N	447.923	1.114	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc4cc[nH]c34)C[C@@H]21	1791291554	ZGFMWPSFHSMJGY-WDSOQIARSA-N	441.532	1.134	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cn4c(F)cccc4n3)C[C@@H]21)C(Cl)Cl	1791296295	PPJAPHONIHNXDV-GVXVVHGQSA-N	429.279	1.870	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]3C2)n(C(F)F)n1	1791296670	SLBALIQYZKYAGS-NHCYSSNCSA-N	425.263	1.984	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)COc1ccc(O)cc1	1792774068	IMWMCSAAEWTKHR-ZUMXRPEOSA-N	441.322	1.392	50	20	IDGD	
Cn1c(=O)c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C(C)(C)CCl)nc2ccccc21	1792782264	ZIEULAQYIMKFQH-XOIINTDNSA-N	446.935	1.402	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2)[C@@H]1CC(c2ccccc2)=NO1	1793281496	WVQREDMPTXCYHY-XRGAULLZSA-N	426.300	1.573	50	20	IDGD	
Cc1nc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)CBr)C3)c(C)s1	1794178783	UCTQGJXXVWFWRF-MJRMRKOOSA-N	444.395	1.923	50	20	IDGD	
O=C(CCBr)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCNC(=O)c1ccc[nH]1	1794306705	CHXBSDCZOLGCKF-BTTYYORXSA-N	425.327	1.558	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccno1	1794741537	ZXDPNFLVLOLKNX-ODLYAQKHSA-N	428.395	1.763	50	20	IDGD	
Cc1ccc(-c2ncccc2C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](O)CCl)C3)cc1	1796006153	OIQWZPNLYOOXBY-HNJRGHQBSA-N	443.931	1.860	50	20	IDGD	
O=C(Cc1ccc(F)cc1Cl)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1	1796187952	OVRUCIORRWVRET-REPLKXPHSA-N	444.699	1.653	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)c1cc(-c2ccco2)no1	1796191110	ZYECPBVZCRESHF-BJWYYQGGSA-N	435.245	1.180	50	20	IDGD	
Cc1c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)nc2ccccn12	1797364038	NDWPMGWTEYAYAZ-MUJYYYPQSA-N	447.499	1.207	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(-c2ccccc2)[nH]n1	1798667103	WRBWAQVDAUVKKN-RCJHGTSTSA-N	432.908	1.534	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(C(N)=O)cc1)C2	1799278528	MBMOFSDHTVJMGJ-YGTYGHESSA-N	428.316	1.225	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@](C)(Cl)CCl	1799278601	PQZOFWAMSXLCRH-BVWVXVDMSA-N	447.359	1.568	50	20	IDGD	
N#Cc1ccc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Br)cc1	1799342009	CSGRBNCVHSBDFL-CYGHRXIMSA-N	438.297	1.771	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)N1C[C@H]3C[C@H]3C1)C2	1800641982	PIHFAEHZYRDNPK-PCEZLPAMSA-N	428.371	1.090	50	20	IDGD	
COc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)Br)c(O)c1	1800760580	USVVCXDZQNZPHB-LSSIXWDNSA-N	427.295	1.387	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc([N+](=O)[O-])c(OC)c1	1801839107	UVFOJWPWIQVDNH-UMPJEAMMSA-N	441.868	1.060	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)c2cnc[nH]2)[C@H]1c1cccnc1	1805571102	FSOTVUBNZDFTQE-XJYZCQQUSA-N	448.487	1.258	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1CCN(C(=O)c2cccc(=O)n2O)[C@@H]1c1cccnc1	1810541221	SSBSHEGVAYXMQD-OXJNMPFZSA-N	444.564	1.652	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H]3CCC(=O)N3)sc2C1	1814061513	HDLYIOJVMMYKTQ-YWVKMMECSA-N	429.340	1.507	50	20	IDGD	
COC(C)(C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1814513631	RDSPPPHQMNIVPA-HNNXBMFYSA-N	429.481	1.139	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)CNCP(=O)(O)O)sc2C1	1814763712	ZYNUHZPKSDPCRH-UWVGGRQHSA-N	438.874	1.187	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cnc(OCF)cn2)[nH]n1)[C@H](O)CCl	1814869597	USQOEKKVPNNXJW-QWHCGFSZSA-N	426.836	1.411	50	20	IDGD	
CC(C)NC(=O)OC(C)(C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](O)CCl)n[nH]1	1814872561	LPNBLIONCPQUSA-ZIAGYGMSSA-N	443.932	1.915	50	20	IDGD	
O=C(/C=C/c1cccnc1)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1	1815350227	LAVWENMNNCJTOJ-NADMHLTPSA-N	448.313	1.157	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)Cn2cnnn2)n[nH]1	1817617686	YZBLLZCVSKCINI-ZYHUDNBSSA-N	425.291	1.262	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CO)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](F)Cl)n[nH]1	1818037242	HDBSHMKSGODSEU-OBJOEFQTSA-N	447.895	1.822	50	20	IDGD	
O=C(/C=C\C(=O)NC1CC1)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](F)Br)[nH]n1	1819271996	MSZSBKIFCNADFO-VLZSXYJSSA-N	442.289	1.927	50	20	IDGD	
CCc1noc(C)c1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCC(=O)NN(C)C)CC2	1820654458	IFUVCLVYVDXBFV-GFCCVEGCSA-N	448.549	1.601	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1)C1CCC2(CC1)OCCO2	1821819611	RQNGPTSYZZWBIU-HZPDHXFCSA-N	440.928	1.935	50	20	IDGD	
Cn1ccc(CC(=O)N[C@@H]2CCc3nc(NC(=O)[C@H](F)Br)sc3C2)n1	1823003497	LLRYUCSYNICRCF-OQPBUACISA-N	430.303	1.722	50	20	IDGD	
CCNC(=S)NCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCBr)CC2	1824498508	BWILDKYZHDVZJF-VIFPVBQESA-N	448.412	1.324	50	20	IDGD	
Cc1nccn1CC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](F)Br)CC2	1824710165	VNEMFAZIEGLBTA-ZANVPECISA-N	430.303	1.951	50	20	IDGD	
CC(C)(C)OCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1	1824893597	IAJNWMMJRKEBQK-FQEVSTJZSA-N	430.354	1.415	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](C)O)sc2C1	1825623963	KCZLSSHEGJHIBH-GXSJLCMTSA-N	448.457	1.583	50	20	IDGD	
O=C1CCc2ccc(C(=O)N3CCCC[C@@H]3C3CCN(C(=O)[C@H](O)CCl)CC3)nc2N1	1827394679	TUGHXXPEYONVCB-QZTJIDSGSA-N	448.951	1.799	50	20	IDGD	
CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](F)Cl)CC1	1827615723	GWEMBIYHFRSWEN-FGTMMUONSA-N	441.935	1.611	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H]2CNC(=O)O2)CC1	1831546063	CJWZXODFGJWKGC-ILXRZTDVSA-N	430.343	1.888	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)Cn3cccn3)C2)C1	1831644463	YBODUHWXGYKIQG-UWVAXJGDSA-N	426.945	1.383	50	20	IDGD	
C=C(CC(=O)OCC)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](Cl)CCC)CCO2	1831653536	HNYFQALXOYSYLL-UZLBHIALSA-N	430.929	1.360	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3ccc(F)nc3)CCO2)C1	1832831533	XHGJEYOKBBBTTI-OAQYLSRUSA-N	441.931	1.875	50	20	IDGD	
Cc1ncc(/C=C/C(=O)N2CCC(N3CCC(NC(=O)[C@H](O)CCl)CC3)CC2)s1	1833313023	QQQGQBOKMZPMRH-ZMUQKWFASA-N	440.997	1.636	50	20	IDGD	
CC(C)(C)[C@H](O)C(=O)N1CCC(N2CCC(NC(=O)CCBr)CC2)CC1	1834421705	TUYOEBJKYYOBAC-QGZVFWFLSA-N	432.403	1.750	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1)[C@@H]1CC1(F)F	1835450667	PJIYSEKIETTXKU-QWHCGFSZSA-N	426.277	1.904	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](CN)c1ccccc1)CCO2	1835818769	QLGHGLNOTXRFKN-SIKLNZKXSA-N	449.624	1.037	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)CCC(=O)N3CCCC3)CC2)CC1	1836394902	IZPKISKXUXUBGD-LJQANCHMSA-N	441.016	1.978	50	20	IDGD	
COC(=O)[C@@H]1CC[C@H](C(=O)N2CCC(OC3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)C1	1836711544	RZFZWLUVZRRVJY-DAYGRLMNSA-N	444.956	1.174	50	20	IDGD	
COc1cccc(CC(=O)N2CCC(OC3CCN(C(=O)[C@H](O)CCl)CC3)CC2)c1	1836716771	PUWIACXOOGKOAU-HXUWFJFHSA-N	438.952	1.836	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cc3cnccc3[nH]1)CCO2	1837102451	MYHXAQZUCNQDFN-NRFANRHFSA-N	446.580	1.484	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)Cn3ccc(C)n3)CC2)CC1	1837193070	LMEHXUJTDJLTAP-SFHVURJKSA-N	426.945	1.444	50	20	IDGD	
O=C(c1ccc(Cl)nc1Cl)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1837825644	SZJHVCFSWIOXAE-WBMJQRKESA-N	440.686	1.993	50	20	IDGD	
O=C(c1cc(-c2ccncc2)[nH]n1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1838011221	NJUNGTLLAQFRGM-QFBILLFUSA-N	437.859	1.076	50	20	IDGD	
C[C@H](C(=O)N1CCC(OC2CCN(C(=O)[C@@H](F)Br)CC2)CC1)n1ccnn1	1838648150	JYFPQWQWVGXYJO-IUODEOHRSA-N	446.321	1.528	50	20	IDGD	
Cn1cc(CC(=O)N2CCC(OC3CCN(C(=O)[C@H](F)Br)CC3)CC2)cn1	1838648533	XTZPUFQRLHHFNP-KRWDZBQOSA-N	445.333	1.652	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@H](C)Cn3ccnc3)CC2)CC1	1838786077	KAZCAUAWDYQYEV-APWZRJJASA-N	440.972	1.772	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccccc3NC(C)=O)C2)C1	1839148995	PPFSVTXBRYHRPJ-UWJYYQICSA-N	437.924	1.732	50	20	IDGD	
CCc1ccnc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)c1	1839152237	RNVMSVCKGIXTJG-UXHICEINSA-N	444.359	1.950	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)s1	1839198183	WNHKXXWGNQJJKJ-XJKSGUPXSA-N	435.315	1.817	50	20	IDGD	
Cc1ncsc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839198227	XFVHYUIMPYASKN-SWLSCSKDSA-N	436.303	1.212	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839199414	WHKYSXRGGSRCNG-HUBLWGQQSA-N	429.714	1.541	50	20	IDGD	
O=C(Cc1ccc([N+](=O)[O-])cc1F)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1839788368	DAKQHNMUVQNIPR-SJLPKXTDSA-N	447.822	1.267	50	20	IDGD	
Cc1csc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)c1	1840030831	XZTHXMOKXDKHIE-GUYCJALGSA-N	431.352	1.910	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C=C/c3cccc(O)c3)C2)C1	1840155983	LTXFJZIRNLSZCT-DPTMFGANSA-N	438.908	1.116	50	20	IDGD	
O=C(C(Cl)Cl)N1CCO[C@]2(COCCN(C(=O)[C@H]3COc4ccccc4O3)C2)C1	1840186229	BVUFJGRTFIPHJY-BEFAXECRSA-N	445.299	1.087	50	20	IDGD	
C[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)CCBr)C2)C1)n1cccc1	1840350680	PKQWEQGPYGMUDV-CRAIPNDOSA-N	428.327	1.291	50	20	IDGD	
C[C@H](Sc1ccccn1)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1840390671	FKFZOFRXGZRTIE-YEWWUXTCSA-N	431.917	1.553	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H]1C(=O)N1CCCC12CN(C(=O)[C@@H](F)Br)C2	1841766988	XZYZWFGZQXDYQT-VXGBXAGGSA-N	434.306	1.890	50	20	IDGD	
Cc1noc(-c2ccccc2)c1C(=O)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843013773	LNMKJAPMMJKQJW-UHFFFAOYSA-N	445.284	1.461	50	20	IDGD	
CCCCN1C(=O)c2ccc(C(=O)OCC(=O)NNC(=O)c3cccs3)cc2C1=O	9451885	IXCZOEIYKKLWAD-UHFFFAOYSA-N	429.454	1.762	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)c2ccc3c(c2)C[C@@H](C)N3S(C)(=O)=O)cc1C	14843465	JOCNYDMDLKFGSN-OAHLLOKOSA-N	431.514	1.854	50	20	IDGD	
CCOc1cc(/C=C(\C#N)C(=O)c2c(N)n(C)c(=O)n(C)c2=O)ccc1OCC(C)C	16881466	PAWZZFZDDUQFTI-OQLLNIDSSA-N	426.473	1.890	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNS(=O)(=O)c3ccc(S(N)(=O)=O)cc3)cc2C1	18995911	RCVPHGRBRXLACH-SNVBAGLBSA-N	429.545	1.144	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)c2ccc(N)c([N+](=O)[O-])c2)cc1	21290966	ZQDNMYYANQGHRQ-UHFFFAOYSA-N	427.446	1.673	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)CN2C(=O)[C@H](C)Oc3ccccc32)cc1	115402105	QDXSDONXXLVKLU-GJZGRUSLSA-N	427.457	1.814	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)Cn3cc(Br)ccc3=O)[nH]n2)cc1	195677881	WUGNOLHCUJIAQG-UHFFFAOYSA-N	430.262	1.771	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)CN1C(=O)N[C@]2(C[C@H](C)CC(C)(C)C2)C1=O	585675230	OEZPAQUKGLCREN-QLEMLULZSA-N	448.495	1.877	50	20	IDGD	
N#Cc1cccc(OCc2ccoc2C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c1	726523223	LGDNKZCWAVYRQK-UHFFFAOYSA-N	429.396	1.781	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccc(F)cc2F)CC1)NNC(=O)c1ccc([N+](=O)[O-])cc1	726972041	TWSCKBSHUWVSHS-UHFFFAOYSA-N	447.398	1.092	50	20	IDGD	
CC(C)c1ccccc1NC(=S)NNC(=O)[C@H]1CC(=O)N([C@@H]2CCS(=O)(=O)C2)C1	727171859	OHWDSXSBGQOLII-UONOGXRCSA-N	438.575	1.163	50	20	IDGD	
CCOc1ccc(OCC)c(NC(=S)NNC(=O)CN2C(=O)[C@H]3CCCC[C@H]3C2=O)c1	727496105	CSMXPYARIQDTQQ-GASCZTMLSA-N	448.545	1.977	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)CSCC(=O)Nc2cc(C)on2)cc1F	727499115	IBYGKGBAKXTJAL-UHFFFAOYSA-N	427.483	1.820	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)Nc2cnn(CCN3CCOCC3)c2)c1C	728538038	AFRXXUBMEXXWQE-DEDYPNTBSA-N	426.521	1.826	50	20	IDGD	
O=C(NNC(=O)C1(C(=O)NC2CC2)CCC1)c1cccc(S(=O)(=O)N2CCCCC2)c1	729295881	PTIGXLUPRDJFDP-UHFFFAOYSA-N	448.545	1.071	50	20	IDGD	
CC(C)(C)CC(=O)N1CSC[C@H]1C(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	730081519	SKPPKUXJLLQDQW-AWEZNQCLSA-N	431.518	1.677	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)NCc2nnnn2-c2ccccc2)c2ccccc2c1=O	730672211	CSNQNHACAXRGFO-UHFFFAOYSA-N	447.459	1.097	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)N1CCCN(S(=O)(=O)c2ccc(F)cc2)CC1	731848244	CXJUOXVCWTZAPM-HNNXBMFYSA-N	428.530	1.104	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)[C@@H](C)N2CCC(Cc3ccccc3)CC2)C[C@@H](C)O1	732261059	AHISNFYPMMMPNQ-HSALFYBXSA-N	430.593	1.976	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NC[C@@H]2CCc3ccccc32)cc1	732468702	COFFFOPYTGCEMZ-KRWDZBQOSA-N	430.530	1.676	50	20	IDGD	
CNC(=O)CCCNC(=O)/C(C#N)=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	733167093	SZUDLSCUZBSKKH-PTNGSMBKSA-N	442.907	1.628	50	20	IDGD	
C[C@H](OCc1ccccc1)C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	735118025	NDIPDUFNBPOMTL-INIZCTEOSA-N	433.534	1.066	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)C1CCN(c2ncnc3sc(C)c(C)c23)CC1	740851403	DBKHJFWFZZFLGV-UHFFFAOYSA-N	446.577	1.977	50	20	IDGD	
CN(C)C(=O)CS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cccc3ccccc23)cc1	741954365	HBHXHXWVJPNCGK-UHFFFAOYSA-N	439.493	1.777	50	20	IDGD	
Cn1nnnc1-c1cccc(S(=O)(=O)NNC(=O)c2ccc(Br)s2)c1	742026559	RUZCXKBBIJFEDB-UHFFFAOYSA-N	443.308	1.324	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NC[C@H](C)Oc1ccc(F)cc1	743509962	OCHVHHHTLNXZLO-LBPRGKRZSA-N	437.497	1.839	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CN2CCN(c3oc(-c4ccco4)nc3C#N)CC2)c1	744387298	WXJRREQOUZRXDD-UHFFFAOYSA-N	445.439	1.261	50	20	IDGD	
Cc1noc(-c2ccccc2C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)n1	745259682	UQZBKMKYSSIGNT-UHFFFAOYSA-N	425.357	1.571	50	20	IDGD	
Cn1ccnc1[C@@](O)(CCNC(=O)NNC(=O)c1cccc2cccnc12)C(F)(F)F	747463834	VKUXJBIKMWXAHY-SFHVURJKSA-N	436.394	1.753	50	20	IDGD	
NC(=O)C[C@H]1CCCN(C(=O)NNC(=O)[C@H]2Cc3ccccc3CN2Cc2ccccc2)C1	747497825	BMHXIIXQJWEDGM-DENIHFKCSA-N	449.555	1.942	50	20	IDGD	
CCCn1nc(C)c(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)c1C	748618847	ICUKVPGYXKSXOZ-UHFFFAOYSA-N	434.566	1.603	50	20	IDGD	
Cc1nc(S(=O)(=O)N2CCC(C(=O)NNc3ccc(OC(F)F)cc3)CC2)cn1C	748644852	WXKYYDFPDRCETL-UHFFFAOYSA-N	443.476	1.874	50	20	IDGD	
Cc1c(NNC(=O)[C@@H]2CN(Cc3nc(O)c4ccccc4n3)CCO2)cccc1[N+](=O)[O-]	748693391	LXAQAEJUGQTFGJ-SFHVURJKSA-N	438.444	1.896	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCC[C@@H](CNC(=O)c3ccccc3)C2)n1	748835829	MNUZPQHPXRDSPF-INIZCTEOSA-N	429.546	1.283	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)[C@H]2CCCN2C(=O)c2ccc3c(c2)OCO3)cc1	749506211	YEUVXJFPMYWZOV-GOSISDBHSA-N	439.468	1.809	50	20	IDGD	
O=C(NNc1nc(Br)cn2ccnc12)[C@H]1CCCN(C(=O)N2CCCC2)C1	750247222	MTYPZMXNRRVVAD-LBPRGKRZSA-N	436.314	1.863	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)COc1ccc(Oc2ccccn2)cc1	751209877	WRTZAKZWRVFREI-UHFFFAOYSA-N	426.454	1.892	50	20	IDGD	
C[C@H](NC(=S)NNC(=O)c1cn(C2CCN(C(=O)OC(C)(C)C)CC2)nn1)C1CC1	751617170	HLUVEFRKJGLRIW-LBPRGKRZSA-N	437.570	1.758	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3ccccc3-n3ccnn3)CC2)cc1	752579611	UFOZQVOWNIHUJK-UHFFFAOYSA-N	433.516	1.155	50	20	IDGD	
C[C@@H](NC(=O)/C(C#N)=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)c1nc[nH]n1	752637707	LINHKLVBFWRALQ-UGMNDJHYSA-N	438.879	1.981	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)NCCNS(=O)(=O)c2ccc(Cl)s2)c1	752689324	QUPNXTOJNQJZLV-UHFFFAOYSA-N	445.954	1.390	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)CN(C)C2=NS(=O)(=O)c3ccccc32)c2ccccc2n1	753117338	KUHHDVYDSHFOHC-UHFFFAOYSA-N	437.481	1.385	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)NC[C@@H]2CCN(S(C)(=O)=O)C2)c(C)n1C[C@@H]1CCCO1	753130442	YVCKRQHWKOLYRF-NFKQLHPUSA-N	434.562	1.589	50	20	IDGD	
C[C@H](Oc1c(I)cc(Cl)c2cccnc12)C(=O)NNC(=O)CO	753443172	UAZGBRLMVVTXJW-ZETCQYMHSA-N	449.632	1.400	50	20	IDGD	
C[C@@H](C(=O)OCC(=O)NNC(=O)c1ccc(C#N)cc1)c1ccc(S(C)(=O)=O)cc1	753481827	BNOKTGUNPMJQLY-CYBMUJFWSA-N	429.454	1.070	50	20	IDGD	
CCS(=O)(=O)c1ccc(NC(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)cc1	755597034	AAZLKNZJKBDFAX-UHFFFAOYSA-N	428.511	1.938	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)Nc1cc(N2CCCC2=O)ccc1F	756126422	XLUUXNBZGVOACG-UHFFFAOYSA-N	441.467	1.812	50	20	IDGD	
C#CCOc1cccc(NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1	756478884	GGNGUCIVBDLMHL-UHFFFAOYSA-N	442.497	1.950	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(F)c(NC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c1	756686535	WBCGSQOLWBBSJF-UHFFFAOYSA-N	446.464	1.728	50	20	IDGD	
CS(=O)(=O)CCn1ccc(NC(=O)NNC(=O)COc2cccc(C(F)(F)F)c2)n1	756757534	BXVDFHHEAIWILU-UHFFFAOYSA-N	449.411	1.178	50	20	IDGD	
COCc1nc2n(n1)C[C@@H](NC(=O)NNC(=O)COc1cc(C)ccc1C(C)C)CC2	757795291	LRMORXXWBQFBFP-HNNXBMFYSA-N	430.509	1.581	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)Nc2ccc(-n3ncn(C)c3=O)cc2)cc1OC	757861943	CLLJGRYJXJMUSN-UHFFFAOYSA-N	426.433	1.445	50	20	IDGD	
Cc1cnn(-c2ccc(C(N)=O)cc2NC(=O)NNc2cccc(S(C)(=O)=O)c2)c1	757877144	VPBGOMBXOGDSPL-UHFFFAOYSA-N	428.474	1.832	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1ccnc(Br)c1	758255847	LGUJQWQRWFPUPA-UHFFFAOYSA-N	441.307	1.622	50	20	IDGD	
CC[C@@H](NC(=O)NNC(=O)Cn1nc(C)cc1C)[C@H]1CN(Cc2ccccc2)CCO1	761796510	YBTVOVITMASKJF-WOJBJXKFSA-N	428.537	1.510	50	20	IDGD	
O=C(COC(=O)c1c[nH]c2cccc([N+](=O)[O-])c12)NNC(=O)[C@H]1COc2ccccc2O1	762905518	ZBOWBPHWBSYOKK-MRXNPFEDSA-N	440.368	1.220	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)c2cn(CCOc3ccc(C=O)cc3Cl)nn2)cc1	763316898	PJDXKMXZIAPRSQ-UHFFFAOYSA-N	438.831	1.769	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc(OC)c1O	763379168	UXMANFYULVMKPN-UHFFFAOYSA-N	449.485	1.269	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(Br)cc1F	763472578	YWIBFPLIMGLUHN-UHFFFAOYSA-N	425.170	1.896	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)n([C@@H]2C[C@H]3CC[C@H]2C3)n1	763472591	ZMTUJZZUJLAIAB-HEHGZKQESA-N	426.433	1.861	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)C(=O)Nc1ccc(F)c(F)c1F	763531592	PJTKDZWAHVRIPW-UHFFFAOYSA-N	449.433	1.402	50	20	IDGD	
O=C(NNC(=O)c1c[nH]c2ccccc12)C(=O)Nc1cc(N2CCNC2=O)ccc1Cl	763541543	WALXDJXTXXQGJR-UHFFFAOYSA-N	440.847	1.751	50	20	IDGD	
CNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)COc2cc(C)ccc2C(C)C)c1	763597249	LNKWNWMVGZTJHL-UHFFFAOYSA-N	426.473	1.643	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)[nH]n1)C(=O)Nc1ccnc(OCC(F)(F)F)c1	763612476	JCCLRMDLWVPDAH-UHFFFAOYSA-N	448.361	1.813	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)[nH]n1)C(=O)Nc1ccccc1CN1CCNC1=O	763613361	MTRLDAYPSXLKDJ-UHFFFAOYSA-N	447.455	1.002	50	20	IDGD	
O=C(COc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1ncn(Cc2ccccc2)n1	763686049	JWSFNGMCFAEXQV-UHFFFAOYSA-N	428.836	1.145	50	20	IDGD	
CC(C)(C)n1cc(NC(=O)C(=O)NNC(=O)COc2ccc(Br)cc2)cn1	763695413	UGKIMSHLTIBACN-UHFFFAOYSA-N	438.282	1.566	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(CN2CCOC2=O)cc1	763716799	MVDFYSCCRVETID-UHFFFAOYSA-N	440.456	1.366	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)C(=O)Nc1cc2c(cc1Cl)OCO2	763789805	DVBXFRLZEHYNMH-UHFFFAOYSA-N	429.776	1.117	50	20	IDGD	
CCOc1cc2c(cc1NC(=O)C(=O)NNC(=O)COc1ccc(C)cc1)O[C@@H](C)C2	763812468	GNDFUMJRFUGOCD-AWEZNQCLSA-N	427.457	1.882	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)CNC(=O)c2cccnc2)c2cc(Br)ccc2n1	763818398	LHSZOPJMKCHNQS-UHFFFAOYSA-N	442.273	1.892	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)n(C2CCOCC2)n1	763851740	FRYRHJLIEZBBTI-MRXNPFEDSA-N	443.504	1.713	50	20	IDGD	
CNC(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)Cc2c[nH]c3ccccc23)c1	763858677	VWDTZGWXMPFOHQ-UHFFFAOYSA-N	427.848	1.510	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cccc3c2OCCC3=O)cc1	763859447	BEGLKOZUEQADGE-CYBMUJFWSA-N	441.440	1.604	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cnn(Cc3ccncc3)c2)cc1OC	763904506	ZJRVYVUREUOUKI-UHFFFAOYSA-N	438.444	1.133	50	20	IDGD	
Cc1coc(-c2ccc(C)c(NC(=O)C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)c2)n1	763916207	CZQVBUSMGOSMAK-UHFFFAOYSA-N	446.427	1.334	50	20	IDGD	
Cc1cccc(NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)c1C(=O)N1CCCC1	763978040	CXDLZUNJUWOYPN-UHFFFAOYSA-N	444.875	1.990	50	20	IDGD	
O=C(NNC(=O)c1ccc[nH]1)C(=O)Nc1ccc(CCn2nnc(-c3ccccc3)n2)cc1	763980735	ZSTNFNVYUWAQME-UHFFFAOYSA-N	444.455	1.311	50	20	IDGD	
Cc1cc(C)nc(Sc2ccc(NC(=O)C(=O)NNC(=O)c3cc(C)[nH]n3)cc2)n1	764108177	FHRSUGUECUERCE-UHFFFAOYSA-N	425.474	1.676	50	20	IDGD	
CNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)cc1Cl	764127473	VYARPBCWEWCVDP-UHFFFAOYSA-N	425.228	1.458	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(C(=O)NC)ccc2Cl)o1	764139551	UYIPBSHASHRAHF-UHFFFAOYSA-N	449.895	1.534	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccccc2F)cc1N1CCOC1=O	764319092	JSXXNVDYPSBQEJ-UHFFFAOYSA-N	430.392	1.120	50	20	IDGD	
COc1ccccc1NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)Cc2ccncc2)cc1	764352822	DUFLPSVCNILTHG-UHFFFAOYSA-N	447.451	1.671	50	20	IDGD	
CCNS(=O)(=O)c1ccc(CNC(=O)NNC(=O)COc2ccc(C)c(C)c2)cc1	764372976	GPYVLQXXABZLRQ-UHFFFAOYSA-N	434.518	1.511	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2F)cc(OC)c1OC	764410695	NSYUEDZVYMSLEE-UHFFFAOYSA-N	425.800	1.905	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@H]2C(=O)NNc1nccc(N2CCOCC2)n1	764655824	MMTCENDREMHRJH-HNNXBMFYSA-N	432.525	1.794	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)c1ccc(=O)n(-c2ccccc2F)n1	765530116	IRXAHCHGWSPYAL-UHFFFAOYSA-N	434.431	1.745	50	20	IDGD	
C[C@H]1CN(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)[C@@H](C)CN1Cc1ccccc1	766517498	GVUHHLBIIRKWDD-IRXDYDNUSA-N	434.504	1.612	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)C1CCC(C(F)(F)F)CC1	768073556	WJJIEJXFPGYVLA-UHFFFAOYSA-N	440.466	1.961	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)c2c[nH]nc2-c2c(F)cccc2F)cc1	768144791	VEDSICFHAKOONO-UHFFFAOYSA-N	425.351	1.845	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)CN1C(=O)N[C@@](C)(c2ccccc2)C1=O	768613736	XXVJREZKERFDMP-FQEVSTJZSA-N	446.485	1.009	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2csc(-c3ncccc3F)n2)n1	768663028	IXMQGFLGWKJBCR-UHFFFAOYSA-N	435.462	1.656	50	20	IDGD	
COCCCNC(=S)N(C)NC(=O)CCc1c(C)nc2nc(C(F)(F)F)nn2c1C	768732134	ADPJBLKVWNLGDD-UHFFFAOYSA-N	447.487	1.567	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)NC1CCN([C@H]2CCCC[C@@H]2O)CC1	769159649	DYNUFGDBBVBZCK-ROUUACIJSA-N	442.520	1.290	50	20	IDGD	
Cc1cnn(Cc2ccccc2F)c1NC(=O)C(=O)NNC(=O)c1cccc(N(C)C)c1	769266056	LMHHOUCRAJDFLG-UHFFFAOYSA-N	438.463	1.845	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)N[C@H]2CC(=O)N(c3c(F)cccc3F)C2)cc1	771434776	PKCBHKCAFATXSK-ZDUSSCGKSA-N	429.383	1.351	50	20	IDGD	
C[C@@]1(c2ccc(F)c(Cl)c2)NC(=O)N(CC(=O)NNc2ncnc3[nH]cnc23)C1=O	771737444	QFICSMUHLPVHDB-KRWDZBQOSA-N	432.803	1.056	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1ccc(S(=O)(=O)N(C)c2ccccc2)cc1	771870834	QOHOPTMVNSQVMZ-CQSZACIVSA-N	433.486	1.614	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)c1cc(Br)ccc1Br	771940710	QCZRKIOWJHCSHC-ZETCQYMHSA-N	440.113	1.407	50	20	IDGD	
C[C@H]1CN(C(=O)OC(C)(C)C)[C@H](C)CN1C(=O)NNC(=O)CNC(=O)c1cccs1	771955725	BUWZPKVFEXEFEJ-QWHCGFSZSA-N	439.538	1.548	50	20	IDGD	
CCCCN1C(=O)c2ccccc2N2C(=O)CC[C@]12C(=O)O[C@H](C)C(=O)NNC(=O)CC	771965999	MEPJLRFNCBMRDB-PEBXRYMYSA-N	444.488	1.255	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)C1(c2ccc(Br)cc2)CCOCC1	772070262	VOXZNWNNMKGIJF-GFCCVEGCSA-N	427.295	1.986	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)Nc2cnn(Cc3nnc4n3CCCC4)c2)c1	772636658	UMKZMLDDTGHGMP-UHFFFAOYSA-N	440.464	1.343	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)[C@H](c1ccccc1)N1CCCCC1=O	772885069	UMEFFWRVLOABDL-IBGZPJMESA-N	442.903	1.857	50	20	IDGD	
C=CC(=O)NCc1ccc(C(=O)NNC(=O)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1	773410605	DRYGRAIIAOAUBE-QGZVFWFLSA-N	430.505	1.897	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NCc2ccc(OC(F)F)cn2)cc1	775222909	VBZZJQGUYHLLML-UHFFFAOYSA-N	429.405	1.622	50	20	IDGD	
O=C(CN1CCCC[C@@H]1C(=O)Nc1ccc2c(c1)CCO2)NNC(=O)c1cccs1	777618711	BZWRMWPCSFKZBV-MRXNPFEDSA-N	428.514	1.937	50	20	IDGD	
Cc1c(C(=O)NNC(=O)CNC(=O)OC(C)(C)C)nnn1-c1cccc2ncccc12	778438753	XGIYXQMSPPVZSB-UHFFFAOYSA-N	425.449	1.410	50	20	IDGD	
COc1cccc2[nH]cc(CC(=O)N3CCN(S(=O)(=O)CBr)CC3)c12	778976370	WQDHWTYPEKLFEE-UHFFFAOYSA-N	430.324	1.545	50	20	IDGD	
COc1ccc(Cn2cc(C(=O)NNC(=O)CNC(=O)OC(C)(C)C)cn2)cc1OC	779056649	HEYPEYZSJOYLNR-UHFFFAOYSA-N	433.465	1.234	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)[C@@H](O)[C@H](O)c1nc2ccccc2s1	779539216	BZKGTAJSVCXWKY-GJZGRUSLSA-N	438.506	1.143	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)N[C@H]2CCn3ccnc3C2)c2ccccc2c1=O	779666602	TXOQPHBMLRFEMO-HNNXBMFYSA-N	437.504	1.742	50	20	IDGD	
CC(C)(C)[C@@H]1CCc2sc(C(=O)NNC(=O)NCCNC(=O)c3cc[nH]n3)cc2C1	780881118	ZXPCNQYBGCRIRH-CYBMUJFWSA-N	432.550	1.996	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2ccc(C)c(S(=O)(=O)NC3CC3)c2C)nc1	782145158	FVQZZKPLWIPIGK-UHFFFAOYSA-N	433.490	1.230	50	20	IDGD	
O=S(=O)(CBr)N1CCCN(S(=O)(=O)c2ccc(Cl)s2)CC1	782435208	VXCJBBOIDSBFRT-UHFFFAOYSA-N	437.790	1.780	50	20	IDGD	
CN(C)C(=O)COc1ccc(NC(=O)C(=O)NN=c2sc3ccccc3n2C)cc1	783352129	YSYZJJUALIARGY-UHFFFAOYSA-N	427.486	1.277	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNc2cccc3c2CCCC3)ccc1S(=O)(=O)N(C)C	783451278	MKYIBJOFJGKVQK-UHFFFAOYSA-N	446.529	1.906	50	20	IDGD	
COc1ccc(C#N)cc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	784212604	CAGYHKNUBATZJG-UHFFFAOYSA-N	429.458	1.089	50	20	IDGD	
CCN1CCC(n2nccc2NC(=O)C(=O)NNc2ccc(Br)cn2)CC1	784340030	UARBJLMSTDLVPN-UHFFFAOYSA-N	436.314	1.779	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNc2ccc(Cl)nn2)cccc1S(=O)(=O)NC(C)(C)C	784794273	YAJYSKXLWIRECP-UHFFFAOYSA-N	440.913	1.597	50	20	IDGD	
Cc1cc(C(=O)N2CCC[C@H](C)C2)ccc1NC(=O)C(=O)NNc1ccnc(N(C)C)n1	784970995	PARAUWZAVQYTIT-AWEZNQCLSA-N	439.520	1.805	50	20	IDGD	
CC(C)CNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)cc1	785067810	PCIOVKVUTZHXNH-UHFFFAOYSA-N	436.472	1.049	50	20	IDGD	
N#CCOc1cccc(NC(=O)C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)c1	785100135	RCQVOSLVSLLNFO-UHFFFAOYSA-N	429.383	1.841	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2cccc(-n3nnnc3SC)c2)n1	785225744	JZZKHDVGYQIZDQ-UHFFFAOYSA-N	442.509	1.102	50	20	IDGD	
COc1cc(F)cc(NNC(=O)C(=O)Nc2ccc(Cl)c(S(=O)(=O)N(C)C)c2)c1	785236225	BARZOGLGWCREES-UHFFFAOYSA-N	444.872	1.820	50	20	IDGD	
Cc1ccc(C(=O)NCC2CC2)cc1NC(=O)C(=O)NNC(=O)c1ccc2c(c1)OCO2	785988001	IPBLDSCAEVCUQF-UHFFFAOYSA-N	438.440	1.263	50	20	IDGD	
CCNC(=O)Nc1ccc(C)c(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1	787540618	BMZSLMOOJQDTRZ-QGZVFWFLSA-N	441.444	1.062	50	20	IDGD	
CC(C)CN1C[C@@H]2CN(C(=O)NNC(=O)[C@@H](C)Oc3cccc(Cl)c3)CCN2C1=O	787872207	GMCFIVYKFSAXLF-ZBFHGGJFSA-N	437.928	1.926	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C2CCN(c3oc(C)nc3C#N)CC2)cc(OC)c1OC	788621753	VQWFSOADSVVRJU-UHFFFAOYSA-N	443.460	1.558	50	20	IDGD	
CN(C)[C@H]1CCOc2c(NC(=O)C(=O)NNC(=O)COc3ccc(C#N)cc3)cccc21	789732634	RCWDFCPSJREITG-SFHVURJKSA-N	437.456	1.108	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)C(=O)Nc2cc(-c3ccco3)nn2C(C)C)c1	789740081	SQESNWXJKUCXSX-UHFFFAOYSA-N	439.432	1.477	50	20	IDGD	
CC(C)Oc1cc(NC(=O)C(=O)NNC(=O)Cc2ccc(Cl)cc2)ccc1C(N)=O	789741456	VCCYKDDHVYVXOF-UHFFFAOYSA-N	432.864	1.555	50	20	IDGD	
COc1cc(NNC(=O)C(=O)Nc2cnn(CC(=O)NC3CCCC3)c2)ccc1Cl	789795758	FICPBOABZWXXPY-UHFFFAOYSA-N	434.884	1.686	50	20	IDGD	
CN(C)CCC(=O)Nc1ccc(NC(=O)C(=O)NNc2ccc3c(=O)[nH]ccc3c2)cc1	793070001	KUPHWWVDYUQDQM-UHFFFAOYSA-N	436.472	1.500	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2c(-c3cccnc3)noc2C)cc1	794766960	NYRDRYPRHDRYMK-UHFFFAOYSA-N	443.485	1.435	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN[C@@H](C)c2ccc(Br)cn2)cc1OC	796498678	PGFAQWFQZYDOCN-NSHDSACASA-N	437.294	1.973	50	20	IDGD	
CCc1cccc(CC)c1NC(=O)C(=O)NNC(=O)CNC(=O)OCc1ccccc1	797369464	YNHAMCKIOXFKJG-UHFFFAOYSA-N	426.473	1.824	50	20	IDGD	
COCCOc1ccc(C(F)(F)F)cc1NC(=O)C(=O)NNC(=O)c1cccc(C)n1	797371518	WRHFULJSJFRKAW-UHFFFAOYSA-N	440.378	1.834	50	20	IDGD	
CC(=O)N[C@@](C)(C(=O)NNC(=O)CCCc1ccccc1)c1ccc(S(C)(=O)=O)cc1	797445410	YECFACLSTOCIDL-JOCHJYFZSA-N	445.541	1.612	50	20	IDGD	
Cc1onc(-c2cccc(Cl)c2Cl)c1C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O	798109371	QJTOIAMDWXIGBE-ZETCQYMHSA-N	435.289	1.656	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)c2ccc(S(N)(=O)=O)c(Br)c2)c1	798337390	ODUGDXLEUITPEW-UHFFFAOYSA-N	448.320	1.257	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@H]2C(=O)NNC(=O)c2nnc(O)c3ccccc23)cc1	798829850	LJTQUEWQYUDZAB-KRWDZBQOSA-N	435.440	1.410	50	20	IDGD	
Cc1cc(Cl)nc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1	800732313	RPNVXCJMOYZMEL-UHFFFAOYSA-N	425.898	1.438	50	20	IDGD	
CS(=O)(=O)c1ccc(C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)cc1[N+](=O)[O-]	801175973	MOINMYPQNSKVES-UHFFFAOYSA-N	449.413	1.752	50	20	IDGD	
COCc1c(C(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)cnn1-c1ccccc1	802067619	XGVDAVORIMVVOG-UHFFFAOYSA-N	443.485	1.889	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)[C@H]2CCCCN2S(C)(=O)=O)c(OC)cc1Cl	802084932	PQRUNJZFDBEEHH-GFCCVEGCSA-N	434.902	1.324	50	20	IDGD	
O=C(CNC(=O)NNc1cncc(Cl)n1)Nc1ccc(I)cc1	807242774	WSMVAWJBWISCRK-UHFFFAOYSA-N	446.636	1.999	50	20	IDGD	
NC(=O)C[C@H]1CCN(C(=O)NNC(=O)[C@H]2Cc3ccccc3CN2Cc2ccccc2)C1	808256048	KBUCGGOXSPLIMQ-WIYYLYMNSA-N	435.528	1.552	50	20	IDGD	
CCc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NNC(=O)CNC(=O)OCc1ccccc1	810408431	GNYJZSUJPWHWOO-UHFFFAOYSA-N	443.416	1.170	50	20	IDGD	
CC1(C)COc2ccc(C(=O)NNC(=O)CN3CCN(C(=O)c4ccccc4)CC3)cc21	810594264	YYYABWSGJFOKAV-UHFFFAOYSA-N	436.512	1.576	50	20	IDGD	
CC(=NNC(=O)COc1ccccc1O)c1ccc(S(=O)(=O)NCCCN(C)C)cc1	814951592	KUWUEDFBSCRNSL-UHFFFAOYSA-N	448.545	1.541	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)NC(C)(C)C)cn2ccnc12	815558397	BLKSQSUZKAUYQH-UHFFFAOYSA-N	444.517	1.801	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)C(=O)Nc2ccc(-c3ccncc3)c(C)c2)c1	815570866	NVXOBFFKUMVZIO-UHFFFAOYSA-N	432.440	1.810	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)CNC(=O)c2cccs2)ccc1-c1ccncc1	815593142	CSBHJCRIUFORDV-UHFFFAOYSA-N	437.481	1.634	50	20	IDGD	
CCCC(=O)Nc1ccc(Cl)c(NC(=O)C(=O)NNC(=O)[C@H]2CCc3nncn3C2)c1	815692411	QJZRAGDWFZRKCJ-NSHDSACASA-N	447.883	1.019	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C2CCN([C@H]3CCSC3)CC2)c2ccccc2c1=O	816805935	MXCFGLSIVUBSAU-HNNXBMFYSA-N	429.546	1.395	50	20	IDGD	
Cc1cc(=O)c(C(=O)NNc2ccccc2S(=O)(=O)N(C)C)nn1-c1ccccc1	817053425	QQPGIAOPDSAIIA-UHFFFAOYSA-N	427.486	1.548	50	20	IDGD	
CNC(=O)[C@H](C)NC(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccc(OC)c(OC)c1	817055496	YMXPXJZZIWHPOA-FBKCMUNRSA-N	436.472	1.639	50	20	IDGD	
CSC[C@H](C(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)N1C(=O)[C@H]2CCCC[C@H]2C1=O	866751504	YREJYEYVYHOOOM-QLFBSQMISA-N	434.474	1.263	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc1NS(C)(=O)=O	907440648	KQBOFJBZIYWEIM-UHFFFAOYSA-N	429.458	1.333	50	20	IDGD	
Cc1c(NC(=O)CSCC(=O)NNc2ncccn2)c(=O)n(-c2ccccc2)n1C	913044223	BNBIYEQWCXYGHZ-UHFFFAOYSA-N	427.490	1.089	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(NC(=S)NNC(=O)COc2ccc(C#N)cc2)c1	913445816	SPUBIEZVJGLIJB-UHFFFAOYSA-N	433.515	1.205	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1cn(-c2ccccc2)nn1	914945445	KIOBVAPFUWTKAV-UHFFFAOYSA-N	429.820	1.547	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)COc1ccc(OCc2ccccc2)cc1)N1C(=O)CCC1=O	915671438	ZEWDBPOTDVGLMN-HNNXBMFYSA-N	425.441	1.329	50	20	IDGD	
Cc1ccc2nc(COc3ccccc3C(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)cn2c1	915831985	DZAGGSCUHRFZGR-OAHLLOKOSA-N	442.497	1.417	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)NCc1ccc(C(=O)N2CCOCC2)cc1	916248667	LPRHLWICKRRLGA-OAHLLOKOSA-N	444.463	1.596	50	20	IDGD	
CC(=NNC(=O)C(=O)NN=C(C)c1ccc2c(c1)OCCO2)c1ccc2c(c1)OCCO2	916266500	XYPVIILRFMTGNJ-UHFFFAOYSA-N	438.440	1.610	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)NCc2ccnc(OCC(F)(F)F)c2)nc2ccccc21	916396917	NMZWBHQBHGBBGG-UHFFFAOYSA-N	436.394	1.983	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)NCc1cccnc1OCC(F)(F)F	916397117	GJKGEVXQGBUWTM-UHFFFAOYSA-N	443.338	1.840	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@@H](C(=O)NNC(=O)COCc3ccccc3)C2)cc1	916559977	AVCPVAJLUMCEPH-LJQANCHMSA-N	445.541	1.760	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)c3ccc(C)cc3O)CC2)cc1	918338841	OCBUFSNLHJVRLU-UHFFFAOYSA-N	447.513	1.571	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@H]1CCCCN1C(=O)c1ccco1	918421851	YMUOAZAGBNRGHP-CQSZACIVSA-N	447.517	1.337	50	20	IDGD	
COCCOc1cc2c(cc1/C=C(/C#N)C(=O)Nc1ccc(S(N)(=O)=O)cc1)OCO2	920754726	CDHOIXUAGHWGPW-ZSOIEALJSA-N	445.453	1.634	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)c1	921281587	PTSYKDAYECHOQH-UHFFFAOYSA-N	429.414	1.259	50	20	IDGD	
C[S@](=O)c1ccc(C=NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1	1116209497	PFUKIERASBTKTM-NDEPHWFRSA-N	435.527	1.209	50	20	IDGD	
Cc1cccc2nc(C(=O)NNc3ccc(S(=O)(=O)N4CCN(C)CC4)cc3)cn12	1322437783	YCGAOSUOXCRYJC-UHFFFAOYSA-N	428.518	1.336	50	20	IDGD	
O=C(CC[S@@](=O)c1ccc2c(c1)OCCO2)NNC(=O)c1cncn1-c1ccccc1	1323390933	NLKVZJQEDGRNGF-WJOKGBTCSA-N	440.481	1.602	50	20	IDGD	
CS(=O)(=O)c1ccc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](F)Cl)C2)nc1	1778023865	GVMZRIIIUGIDEA-IIDMSEBBSA-N	447.916	1.147	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4c(c3)CC(=O)N4)C2)C1	1778393459	LFQVLDYWNRMPDB-NRFANRHFSA-N	431.565	1.476	50	20	IDGD	
O=C(c1n[nH]c2cc(Cl)ccc12)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1778659909	JRSKWWUPFHZSDM-KDOFPFPSSA-N	427.288	1.260	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc4ncsc4[nH]3)C2)C1	1779341139	JDQXPPNELRVREF-MGPLVRAMSA-N	427.324	1.851	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2)c1cc(F)cnc1Cl	1779639022	AKATUQOYTNEXLG-HBUWYVDXSA-N	434.295	1.601	50	20	IDGD	
Cc1cc(F)cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C3)c1	1780894985	LGPVYWAXYQBHBY-AUSIDOKSSA-N	448.539	1.635	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)c3cc4cn[nH]c4cn3)CCO2)C1	1781229243	AYPDJBXYPZPRLY-QZTJIDSGSA-N	426.304	1.638	50	20	IDGD	
Cn1nc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@](C)(Cl)CCl)C3)C2)c2c1CCC2	1781230652	XYPNQNLXNMRVAS-RTBURBONSA-N	429.348	1.589	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)c3nn[nH]c3C(F)(F)F)CCO2)C1	1781232050	SMKKJKIEKOFSDA-UONOGXRCSA-N	444.241	1.503	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1cncnc1)C2	1781996399	HIHJATYKKHQINI-JCKWVBRZSA-N	425.327	1.316	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccn3cncc13)C2	1782175702	PHVOHLWCWYNSTJ-HGHGUNKESA-N	434.924	1.716	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H]2CCCOC2)C1	1783211148	XHTQPEPUJDXYRV-YKTARERQSA-N	431.371	1.958	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccnc(OC)c3F)CCO2)C1	1783342774	OKRIZGCCAHXQFK-SCLBCKFNSA-N	444.301	1.846	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](C)Nc1nccs1)CCO2	1783347777	ONOCVDRWGWLFKX-IIYDPXPESA-N	445.383	1.947	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)CC(F)(F)C(=O)O)CCO2)C1	1783347999	RLRQSQYDWABXGQ-HZMBPMFUSA-N	427.242	1.100	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)Cc3cccc([N+](=O)[O-])c3)CCO2)C1	1783527233	ALKQUCAKCBSILG-FZKQIMNGSA-N	440.294	1.751	50	20	IDGD	
C=CCCc1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](Cl)COC)C3)C2)c(O)n1	1783873475	PBNXWVMUKBEACY-DYESRHJHSA-N	437.924	1.603	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccc(C#N)cc1Cl)CCO2	1783934795	MWGBYBWGOMOTNC-OAQYLSRUSA-N	447.923	1.028	50	20	IDGD	
CCCC(=O)N[C@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]2C1	1783966959	NBCUOANYQOWGEJ-QRJUGERDSA-N	446.386	1.302	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ncccc3Br)C[C@@H]21)[C@H](O)CCl	1784090790	BKSCTAATLSQRSF-VTPLQMEGSA-N	446.729	1.037	50	20	IDGD	
O=C(C[C@H]1OCCc2ccccc21)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21	1784395628	XMDMLRSOWUESQT-XCZFOBESSA-N	436.936	1.270	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(F)(F)C(F)(F)C(=O)O)[C@H]2C1	1784913779	PWJDIKHBKQRHQK-DCAQKATOSA-N	446.825	1.586	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)CNC(=O)c3ccc(C)cc3)C2)C1	1785560962	MVRKFOPJJRMAGJ-AVRDEDQJSA-N	435.952	1.962	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4cn[nH]c4cn3)C[C@@H]21	1786407339	WZWDROCIASHDKO-RBOXIYTFSA-N	436.310	1.336	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CC(=O)N(C4CCCC4)C3)C[C@@H]21)[C@H](F)Cl	1787444405	ZNPUBRSCICJMAG-XRDYDQJJSA-N	429.920	1.292	50	20	IDGD	
CCCc1onc(C)c1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](Cl)COC)C[C@@H]21	1787655397	SFTHDBGDPOAVIZ-MPTYRVRUSA-N	427.929	1.783	50	20	IDGD	
Cc1ncncc1C(=O)NC1(c2ccc(NC(=O)c3cnccc3C(=O)NN)cc2)CCC1	1789521222	UJVQSAUJLYVFMQ-UHFFFAOYSA-N	445.483	1.845	50	20	IDGD	
Cc1cc(C(=O)NCC(=O)Nc2ccc(C3(NC(=O)[C@H](O)CCl)CCC3)cc2)no1	1789567923	QBBGGGSXRGVNOT-MRXNPFEDSA-N	434.880	1.447	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/C(=O)NCc3ccccc3)C[C@@H]21	1789857974	ONQQGSJEAZLJJK-ROVTZRPGSA-N	447.963	1.856	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)C[C@@H]21	1790961408	JVXIXTXFHZINDO-PYJNHQTQSA-N	442.310	1.260	50	20	IDGD	
CCOC(=O)N[C@H](O)C(=O)NC1(c2ccc(NC(=O)[C@H](C)Br)cc2)CCC1	1791434058	DAJUXSLQJULLFC-XHDPSFHLSA-N	442.310	1.968	50	20	IDGD	
N#Cc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](O)CCl)cc(C(F)(F)F)c1	1792980892	WFIZFVPSTMSJDD-XRGAULLZSA-N	445.825	1.380	50	20	IDGD	
CC(C)(C)OC(=O)N1CC2(C[C@@H]2C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](O)CCl)C1	1793116045	FXMDVBYJODJHCB-JKJDWNRSSA-N	441.956	1.481	50	20	IDGD	
COc1ccc([C@@H]2C[C@H]2C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)cc1	1793521683	XTNNOKJRPOUYJY-XLGPZGCCSA-N	448.328	1.431	50	20	IDGD	
COc1cccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)Br)C3)n1	1793989206	YGZDJIXFXRCGBS-KOFHJDLBSA-N	426.311	1.006	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1cc([N+](=O)[O-])ccc1F	1794062679	CBGYZWZRZQYRSG-MUJYYYPQSA-N	449.483	1.288	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1CCCC1	1795026380	GAFDPJKMWSEPIF-CWPLJXCYSA-N	445.472	1.914	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCBr)c1cc(=O)nc2cccnn12	1795494383	VOSPTYNCUCCJLG-CLLJXQQHSA-N	434.294	1.126	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2n[nH]cc2c1	1796150026	HEEMHYWLGLBYPW-JYYAWHABSA-N	435.322	1.940	50	20	IDGD	
C[C@H](C#N)c1cccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)c1	1796190693	ZFBGCRFDBHWEKD-ZHHJKBAOSA-N	431.301	1.559	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@H](O)C[C@H]1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](F)Cl	1796806239	ZCQAHFWUYKHBPA-IWTMDLJTSA-N	433.908	1.529	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnn2ccncc12	1797062294	UNLGNSBEIGJIDO-FAXLKDOZSA-N	436.310	1.106	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(-c2ccccn2)[nH]n1	1798171815	LNHRVJBEXLIIJK-YVWYUNDQSA-N	443.580	1.526	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc3nccnc3c1)C2	1798440572	QLXDZXMMPOJWJP-MUJYYYPQSA-N	445.483	1.194	50	20	IDGD	
CC(C)c1csc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)n1	1798440672	IJVBPNBXPNYLDR-BTTYYORXSA-N	442.545	1.831	50	20	IDGD	
CSc1ncccc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(B(O)O)cc1)C2	1799012759	NKKLFEDGBAHEKP-BJWYYQGGSA-N	425.319	1.049	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccn3cncc3c1)C2	1799276272	IQEIVBAMVSXBKS-QHHYFVSCSA-N	425.316	1.774	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3n[nH]cc3c1)C2)[C@@H](F)Br	1799346318	PCJLKUOJVFUXRN-AYRXBEOTSA-N	425.258	1.457	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)c1c[nH]c2c(Cl)cccc12	1800055188	XZAKJCJYFDSPAA-OJXGSEEGSA-N	426.300	1.624	50	20	IDGD	
CC(C)[C@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)c1ccc(F)cc1	1800878314	DFXJZZUSAGTXOG-XWCCPHMRSA-N	426.916	1.755	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)Br)C3)C1	1800967346	OVRXOXZURVEIBV-GTDBDLECSA-N	445.354	1.339	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ncccc1Br)C2	1800976946	MOVNTRWKGFLJCE-XCCSTKFXSA-N	446.729	1.301	50	20	IDGD	
COc1cccc(CC(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]2c2cccnc2)c1	1803138197	HHVIIIFDZCQWBF-YFVAEKQCSA-N	431.920	1.938	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)CN2C(=O)CNC2=O)[C@@H]1c1cccnc1	1803686499	OEMQNEBZCGQPLI-RVKKMQEKSA-N	435.912	1.047	50	20	IDGD	
COc1cccc(CCC(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)n1	1804430124	NFSJCAFTSJOCEP-DJPFJPOOSA-N	446.935	1.724	50	20	IDGD	
O=C(/C=C/c1ccc(O)c(O)c1O)N1CCC2(CCCN(C(=O)[C@H](O)CCl)C2)CC1	1805529013	FOSMIOQFCYYJJT-LLCTXKFZSA-N	438.908	1.648	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)CCC#N)[C@H]1c1cccnc1	1806863957	UPJYOULTRXQZFF-YQNFXTCNSA-N	435.488	1.525	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H](CNC(=O)CN)[C@H]1c1cccnc1	1807036914	OJJMEZGFPKWMMW-FOIQADDNSA-N	441.444	1.193	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)Cc2ccccc2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807363840	OVGQNFRQUKYSNN-ZJSXRUAMSA-N	443.312	1.324	50	20	IDGD	
Cn1c(C(=O)N2CCCC3(CCN(C(=O)[C@@H](F)Br)CC3)C2)cccc1=O	1807992778	ODJKQUWEMRGDHF-OAHLLOKOSA-N	428.302	1.921	50	20	IDGD	
CCC(=O)N[C@H](C)C(=O)N1CC[C@H](CNC(=O)[C@H](F)Br)[C@@H]1c1cccnc1	1808649192	LFOGALZYQKSXHE-OYNZBZHQSA-N	443.317	1.693	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)c1cnn2cccnc12	1809736327	CUUBPFOOPNGTLT-USXIJHARSA-N	428.880	1.044	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)c3ccc(F)cc3F)CC2)C1	1809969322	CWAHQFLOYOCIFH-UHFFFAOYSA-N	442.271	1.803	50	20	IDGD	
O=C(c1ccc(F)c(F)c1)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1	1809969558	JXCWROATTMWUSB-UHFFFAOYSA-N	442.271	1.803	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1CCN(C(=O)COc2cccnn2)[C@H]1c1cccnc1	1810547815	IYWUCZHLNFALEV-UWJYYQICSA-N	443.580	1.808	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@H](CNC(=O)CN2CCCCC2=O)[C@@H]1c1cccnc1	1812976320	YIBGRAPNZIBSKF-AVRDEDQJSA-N	446.624	1.951	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H]2CCCS2(=O)=O)[C@@H]1c1cccnc1)C(Cl)Cl	1813081728	ZKPMCLMDUFHMKQ-MELADBBJSA-N	434.345	1.468	50	20	IDGD	
CC(C)(C)[C@H](O)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1814822855	PAWXQOPIUJJVSI-DOTOQJQBSA-N	443.508	1.121	50	20	IDGD	
O=C(NCCC(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](O)CCl)n[nH]1)c1ccccc1	1814875795	IRYHXDKVJVCRFG-IRXDYDNUSA-N	447.923	1.822	50	20	IDGD	
Cc1nn(C)cc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1	1815412627	YMLGXJWUEMBCJA-INIZCTEOSA-N	430.513	1.131	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnoc1)CC2	1817279746	BGSSQQLCMYMZKA-LUKCILAXSA-N	441.473	1.491	50	20	IDGD	
CSCC(C)(C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1	1817470423	QUYAUFIJPZZNLL-QGZVFWFLSA-N	444.366	1.785	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CO)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](F)Cl)n[nH]1	1818037244	HDBSHMKSGODSEU-SCRDCRAPSA-N	447.895	1.822	50	20	IDGD	
COC[C@H](NC(C)=O)C(=O)N[C@@H]1CCc2nc(NC(=O)CO[Si](C)(C)C)sc2C1	1820165590	KNOXNEMDAFXRBB-OCCSQVGLSA-N	442.614	1.058	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@H]1CCc2nc(NC(=O)c3ccc[nH]3)sc2C1	1820283591	VWZUQFFUBWIRKM-JTQLQIEISA-N	425.474	1.009	50	20	IDGD	
O=C(N[C@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1)c1cc(CO)on1	1823006411	FGBFNMMIQUAGHD-KGFZYKRKSA-N	433.259	1.540	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H]2CCCCO2)CC1	1823818739	NIEUYLKXECYRSX-UXHICEINSA-N	443.548	1.488	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)CN2CCS(=O)(=O)CC2)CC1	1824977567	XWYBNIYDORAPCT-QZTJIDSGSA-N	448.029	1.354	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)C(O)O)CC1	1825005540	HYINFANTRKHZAD-GJZGRUSLSA-N	447.960	1.049	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(C)n3ccnc3n1)CC2	1826003856	ADHYPULAUVCDJQ-RYUDHWBXSA-N	448.936	1.974	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](F)Br)CC2	1826005949	BRBKZBKORCOFPC-MATHAZKKSA-N	428.711	1.999	50	20	IDGD	
Cc1ncc(C(=O)N[C@@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)s1	1826086200	MKBHVAAFOFCQLA-LLVKDONJSA-N	436.563	1.507	50	20	IDGD	
O=C(Cn1cc([N+](=O)[O-])cn1)N[C@@H]1CCc2nc(NC(=O)C(Cl)Cl)sc2C1	1826093243	JRKHHUOHJYBAPY-SSDOTTSWSA-N	433.277	1.664	50	20	IDGD	
COC1(CC(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)CCC1	1827060319	XJQQRCDIUPBWDY-NRFANRHFSA-N	442.365	1.559	50	20	IDGD	
O=C(N[C@H]1CCc2nc(NC(=O)C3CC4(CCC4)C3)sc2C1)c1cccc(B(O)O)c1	1827369419	OGGDPIWBHCXSKZ-INIZCTEOSA-N	439.346	1.629	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@H]2CCCO2)CC1	1828925098	DHKOKLBFNCUWSV-RBUKOAKNSA-N	429.521	1.097	50	20	IDGD	
CC(C)c1ccc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)cc1	1830734944	BEJTYRVOOGNDAN-SIKLNZKXSA-N	438.952	1.409	50	20	IDGD	
CCNC(=S)NCC(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H](Cl)COC)CC1	1831093342	LLTJEFGJHMUAIT-HOTGVXAUSA-N	433.018	1.344	50	20	IDGD	
Cc1n[nH]c(C)c1CC(=O)N1CCC([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1	1831873917	FUKCXGQUSRNAPN-FQEVSTJZSA-N	446.596	1.562	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)/C=C/c3ccoc3)CCO2)C1	1832652277	FANHTBKTYYFIRM-HLPXUMPJSA-N	441.322	1.923	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3noc(C(C)C)n3)CCO2)C1	1832792194	XNPYNUQQGCEOPW-LIRRHRJNSA-N	428.917	1.209	50	20	IDGD	
O=C(CCc1ccc(F)nc1)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1832837908	IUUZENHHRGRAMO-GOSISDBHSA-N	434.295	1.413	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cc(F)ccc3F)CC2)CC1)[C@H](O)CCl	1833313260	CRFBJWHRUOIMNO-GOSISDBHSA-N	429.895	1.750	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCC(N2CCC(NC(=O)CN3CCCC3=O)CC2)CC1	1834623764	OJZRAFXGJKGXNK-UHFFFAOYSA-N	426.989	1.445	50	20	IDGD	
N[C@@H](CC(=O)NC1CCN(C2CCN(C(=O)[C@H](F)Cl)CC2)CC1)c1cccnc1	1834762167	BLISBNWUJXRBBW-HKUYNNGSSA-N	425.936	1.578	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)c3ccccc3O)C2)C1	1834819539	VGIGUVVCDTYMLU-SFHVURJKSA-N	427.295	1.247	50	20	IDGD	
CC[C@@H](C(=O)N1CCOC[C@@]2(CN(C(=O)CCBr)CCO2)C1)N(CC)CC	1834819785	UXSJQERDFQRZHJ-QFBILLFUSA-N	448.402	1.348	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cnc(O)nc3O)CC2)CC1	1835069651	SHOZGMMVXADQJE-MRXNPFEDSA-N	439.944	1.481	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)C(=O)NCC(C)C)CC2)CC1	1835126746	GFSIKJWYQUOMJL-SFHVURJKSA-N	429.005	1.738	50	20	IDGD	
Cc1ccc(OCC(=O)N2CCO[C@@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)cc1	1835166985	VSPTUNOOFMVOQS-IBGZPJMESA-N	431.316	1.634	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ncccc3F)CCO2)C1	1838250802	UZJINYJENTWSBP-MSOLQXFVSA-N	434.295	1.527	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)/C=C\C(=O)NC3CC3)CC2)CC1	1838365287	YXJIHECJHOTCTC-XDXAGZTOSA-N	441.956	1.074	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3[nH]cnc3-c3cccnc3)C2)C1	1839145852	FRCJNVIJNKQBFR-IIBYNOLFSA-N	447.923	1.559	50	20	IDGD	
O=C(c1c(F)ccc(O)c1F)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1839412117	DLQIKVABMCSUOV-KRWDZBQOSA-N	439.242	1.544	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3c(F)cncc3F)C2)C1	1840033641	MCRCVEHBWPFIAI-GTNSWQLSSA-N	448.264	1.213	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](CC(=O)N2CC3(CCCN3C(=O)[C@H](O)CCl)C2)C1	1841354232	OYMRULSTOZMSCZ-HUUCEWRRSA-N	429.945	1.437	50	20	IDGD	
Cc1ccn(CC(=O)N2CCCC23CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C3)n1	1842080213	OGJQANWCUKCCFX-HNNXBMFYSA-N	439.944	1.527	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)c2csc(N)n2)C1	1842964868	CJYWRAYQSDPHED-UHFFFAOYSA-N	445.457	1.690	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)c2ccc(CO)o2)C1	1844468662	LJWZJMXSDCNQSH-UHFFFAOYSA-N	443.412	1.736	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)c1ccc(O)cn1)C2	1844692360	OOIOXJQJHBAORQ-UHFFFAOYSA-N	440.412	1.752	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)c2cc([N+](=O)[O-])ccc2OC(C)=O)C1	1844693363	WGFRRGCZSLQLEA-HNNXBMFYSA-N	439.852	1.591	50	20	IDGD	
C=CCC(F)(F)C(=O)N1CCCC12CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2	1846012365	PWIJCODHYHNWQB-UHFFFAOYSA-N	449.502	1.747	50	20	IDGD	
O=C(CCBr)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1	1847038756	ASNYVFRQQDJRTR-HWKANZROSA-N	425.279	1.805	50	20	IDGD	
Cc1ccc(NC(=S)NNC(=O)CCc2c(C)nc(N3CCOCC3)[nH]c2=O)c(C)c1	14308650	ZVBPHRFUVQUYQD-UHFFFAOYSA-N	444.561	1.482	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1	15885350	VSFWVWYKHCKPLP-UHFFFAOYSA-N	433.486	1.320	50	20	IDGD	
Cn1cc([N+](=O)[O-])cc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	16305853	LHDBBNYATVMJSS-UHFFFAOYSA-N	435.462	1.183	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)CNC(=O)c2ccc(O)cc2)cc1	727484568	NTZWXYUPRIUSII-UHFFFAOYSA-N	440.485	1.004	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)N[C@H](C)c1cccc(S(=O)(=O)N(C)C)c1	727610695	SVXFMDKEXXBMSB-CQSZACIVSA-N	434.518	1.580	50	20	IDGD	
O=C(NNC(=O)c1ccc2ccccc2c1)NNC(=O)C1CCN(c2ncccn2)CC1	728945840	MQUYXVDQOKBJDT-UHFFFAOYSA-N	433.472	1.522	50	20	IDGD	
O=C(NCc1ccccc1Br)NNC(=O)C1CCN(c2ncccn2)CC1	728952537	XGLMMGWDMAHRSW-UHFFFAOYSA-N	433.310	1.986	50	20	IDGD	
CC(C)c1c(C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)cnn1-c1cccc(Cl)c1	729276589	HVCAIGWJEPPNDV-LLVKDONJSA-N	427.914	1.348	50	20	IDGD	
CC1(C)CC(=O)c2cc(C(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)c(O)nc2C1	730276434	MDNBASPUYCLMDT-UHFFFAOYSA-N	431.470	1.421	50	20	IDGD	
Cc1ccc(S(=O)(=O)c2ccc(NNC(=O)Cn3[nH]cc4c(=O)ncnc3-4)cc2)cc1	730588503	ZVZGKEBCNQPHSM-UHFFFAOYSA-N	438.469	1.356	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)c1ccc2c(=O)n(-c3ccccc3)c(O)nc2c1	730778854	OGHWTHOZIZGEPY-UHFFFAOYSA-N	446.419	1.637	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NN=C1CCS(=O)(=O)c2cc(F)c(F)cc21	731923927	KIKOTJQYJGFESG-UHFFFAOYSA-N	425.369	1.950	50	20	IDGD	
COCCN1C[C@H](C(=O)NNc2nc3ccccc3c(=O)n2-c2ccc(C)cc2C)CC1=O	733264690	DNRPOTLZOGRZFU-QGZVFWFLSA-N	449.511	1.941	50	20	IDGD	
CCC[C@H](C)C(=O)NNC(=O)C[C@@H]1c2cc(OC)c(OC)cc2CCN1S(C)(=O)=O	733358192	QDQASAKTUYKPHI-XJKSGUPXSA-N	441.550	1.536	50	20	IDGD	
CC(C)OCCCn1c(NNC(=O)c2cc([N+](=O)[O-])cnc2O)nc2ccccc2c1=O	733362661	VNOBVIBHGVATNE-UHFFFAOYSA-N	442.432	1.977	50	20	IDGD	
COc1ccc([C@@H]2[C@H](C(=O)NNC(=O)c3nnc(O)c4ccccc34)CCC(=O)N2C)cc1	734417006	GPMATRJSVZEYCT-YLJYHZDGSA-N	449.467	1.715	50	20	IDGD	
CC(C)[C@@H](NS(=O)(=O)c1ccc2ccccc2c1)C(=O)NNC(=O)c1cnn(C)c1	735471028	JULSSJKILPMSOE-GOSISDBHSA-N	429.502	1.337	50	20	IDGD	
COc1ccc(C(=O)N2CCC(NC(=O)NNC(=O)Cc3cccnc3)CC2)cc1OC	735761460	QHIJLRPOUALJEJ-UHFFFAOYSA-N	441.488	1.277	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)CSc1nnc(-c2ccccc2C)n1CC	740851511	IXRJAHLQIKEDGJ-UHFFFAOYSA-N	432.550	1.818	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)c1ccc(Cl)c(S(=O)(=O)NC(C)(C)C)c1	740853218	YPSQSTGAOVYPMB-UHFFFAOYSA-N	446.957	1.483	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc2oc(=O)[nH]c2cc1Cl)c1nnc(-c2ccccc2)o1	743254668	ROMNQIHEHZFDJI-UHFFFAOYSA-N	435.805	1.448	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)NCc2ccc(C(=O)N3CCOCC3)cc2)cc1	743523926	UOFFNDQWTQERML-UHFFFAOYSA-N	440.504	1.761	50	20	IDGD	
O=C(NNC(=O)N1CCN(S(=O)(=O)Cc2ccon2)CC1)c1ccc2ccccc2c1	743540384	PAUXQMAHOCOPGH-UHFFFAOYSA-N	443.485	1.330	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)C[C@@](O)(c2ccc(C)o2)C(F)(F)F)n1	744660398	UCTKUDNGBYHWJB-MRXNPFEDSA-N	449.407	1.426	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)CNC(=O)NCc2ccc(Cl)cc2)cc1	744940968	GZQNISWQTPBTKZ-UHFFFAOYSA-N	443.847	1.015	50	20	IDGD	
O=C(NCc1ccc(N2CCSCC2)cc1)NNC(=O)c1cc([N+](=O)[O-])ccc1O	745592958	OFJZXWVAHBNZOZ-UHFFFAOYSA-N	431.474	1.998	50	20	IDGD	
O=C(NNC(=O)N[C@H]1CCN(CCN2CCOCC2)C1)Nc1ccc(OC(F)F)cc1	745828788	VTSXFVXZAXFXHU-HNNXBMFYSA-N	442.467	1.030	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)c2cc(S(=O)(=O)N3CCCC3)ccc2O)cc1	745989523	UOPLVHTVDLPPQJ-UHFFFAOYSA-N	448.501	1.058	50	20	IDGD	
O=C(NCCNS(=O)(=O)c1ccccc1[N+](=O)[O-])NNc1cc(F)c(F)c(F)c1	746768629	HAMARUBEQHQBSJ-UHFFFAOYSA-N	433.368	1.617	50	20	IDGD	
COc1cc(C(C)=NNC(=O)[C@@H](C)CN2C[C@H](C)O[C@H](C)C2)ccc1S(C)(=O)=O	747042504	QQTJZJMTESOGHK-SOUVJXGZSA-N	425.551	1.684	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)NC2CCN(C3CCN(C)CC3)CC2)c1C	747990539	SLNPQZVQTSVERF-GOSISDBHSA-N	431.581	1.960	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2nn(-c3ccc(F)cc3F)cc2O)cc(OC)c1OC	748012415	IXXPKRFLQHYVCF-UHFFFAOYSA-N	448.382	1.957	50	20	IDGD	
Cc1ccc(OCC(=O)N2CCN(C(=O)NNC(=O)CCOc3ccccc3)CC2)cc1	748826093	JPIISSWYGQWCFE-UHFFFAOYSA-N	440.500	1.728	50	20	IDGD	
O=C(CNc1ccccc1)NNC(=O)CN1CCN(C(=O)OCc2ccccc2)CC1	751058506	BZAPAQHOGZTHIH-UHFFFAOYSA-N	425.489	1.200	50	20	IDGD	
O=C(CCS(=O)(=O)c1ccc(Cl)cc1)NNC(=O)CNC(=O)c1cccs1	751211567	STZQDDJPWQUWGL-UHFFFAOYSA-N	429.907	1.143	50	20	IDGD	
CCOCCC1(CNC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)CC1	752687602	SLHYRBHGEMWSFW-UHFFFAOYSA-N	426.539	1.153	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)N[C@@H]2CCCN(Cc3ccccn3)C2=O)cc1OC	753291090	VBUUNFQNNYIHSM-QGZVFWFLSA-N	441.488	1.624	50	20	IDGD	
N#Cc1ccc(NNC(=O)[C@@H](CCC(N)=O)N2C(=O)c3ccccc3C2=O)cc1Cl	753322137	AXBXJAVHPLCXSL-MRXNPFEDSA-N	425.832	1.585	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H]2C[C@H](C)N(C3CC3)C2)c1	753943515	PBONWJCPDXZODX-HOCLYGCPSA-N	437.566	1.286	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)N[C@H]1CCO[C@@H](c2ccc(F)cc2)C1	754135988	SVPUVQKWOSKMQJ-DOTOQJQBSA-N	449.508	1.983	50	20	IDGD	
CNS(=O)(=O)c1cc(NC(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)ccc1C	755513814	DRFAJLNMCWUGIN-UHFFFAOYSA-N	434.503	1.821	50	20	IDGD	
Cn1c(=O)c2cc(NC(=O)NNC(=O)C34CC5CC(CC(C5)C3)C4)cnc2n(C)c1=O	755848997	QYEPRFCPASNSGJ-UHFFFAOYSA-N	426.477	1.001	50	20	IDGD	
Cc1nn(C)c(C)c1S(=O)(=O)N[C@@H](C)C(=O)NNc1nc(C(F)(F)F)cs1	755852839	OGEUGDYDZZBBJZ-ZETCQYMHSA-N	426.446	1.322	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)Nc2cccc(C(=O)N3CCOCC3)c2C)c1O	756184929	SKAKKYBJJIBKEJ-UHFFFAOYSA-N	428.445	1.648	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccc(-c3cc[nH]n3)cc2)c1	756513845	RZICZMJRCZJMMK-UHFFFAOYSA-N	428.474	1.794	50	20	IDGD	
CNS(=O)(=O)c1ccc(C)c(NC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c1	756527917	RXIFUSKADFAQQB-UHFFFAOYSA-N	428.474	1.555	50	20	IDGD	
Cc1cc(S(N)(=O)=O)cc(NC(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)c1C	756639354	XLJWLHAULTWZRV-UHFFFAOYSA-N	443.526	1.408	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)Cc2c[nH]c3ccccc23)cc1NS(C)(=O)=O	756782053	LEWZDJSSUNCKEA-UHFFFAOYSA-N	431.474	1.943	50	20	IDGD	
CCOC(=O)[C@H](C)NC(=O)c1ccc(NC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1	756791049	SUPLDVLXEDTINX-LBPRGKRZSA-N	443.416	1.743	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@@H](C)C(=O)NNC(=O)Nc1cnn(CC(=O)N(C)C)c1	756796055	ISVULKVLSWYTFZ-ZDUSSCGKSA-N	436.900	1.862	50	20	IDGD	
C[C@@H]1CN(C(=O)Cn2cc(NC(=O)NNC(=O)Cc3ccccc3F)cn2)C[C@@H](C)O1	756840182	ULXXDJDELRVCDI-ZIAGYGMSSA-N	432.456	1.053	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)c2ccc3c(c2)OCO3)cc1S(=O)(=O)NC1CC1	757873693	KALNIAIFIRDGMZ-UHFFFAOYSA-N	432.458	1.631	50	20	IDGD	
CS(=O)(=O)N1CCc2c(NC(=O)NNC(=O)COc3ccc(C#N)cc3)cccc21	758296361	NGDNIQSMSXOEAM-UHFFFAOYSA-N	429.458	1.112	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)Cc3cccc(OCC#N)c3)CC2)cc1	760407318	ZPXIIXXVTWHVPB-UHFFFAOYSA-N	435.528	1.405	50	20	IDGD	
CC[C@H](NC(=O)NNc1ccc(-n2cccn2)nn1)[C@@H]1CN(Cc2ccccc2)CCO1	761795856	XLPDSQUOWWDUJW-OALUTQOASA-N	436.520	1.968	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)N[C@@H]2CCCN(c3ccccc3F)C2=O)c1	761822415	ZIOVLDMDAHATTI-QGZVFWFLSA-N	430.436	1.983	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)Cn2cnc3ccc(Br)cc3c2=O)n1	762913622	UOZXDWGNTLOUEB-UHFFFAOYSA-N	446.309	1.939	50	20	IDGD	
COC(=O)c1csc(NC(=O)C(=O)NNC(=O)c2ccccc2Br)c1	763481912	ALVHTVMHQRYRKS-UHFFFAOYSA-N	426.248	1.697	50	20	IDGD	
C[C@@H]1CN(Cc2ccccc2NC(=O)C(=O)NNC(=O)c2ccccc2O)C[C@@H](C)O1	763529734	LSRZCLSTZPLDNX-HUUCEWRRSA-N	426.473	1.401	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(F)c(Cl)c2)cc(OC)c1OC	763540089	QPEIFLXRVIQRHE-UHFFFAOYSA-N	425.800	1.905	50	20	IDGD	
C=CCNC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(OC)c(OC)c2)cc1	763543772	OZIWNPCZWFDPDD-UHFFFAOYSA-N	441.444	1.411	50	20	IDGD	
CC(C)n1ncc2cc(NC(=O)C(=O)NNC(=O)c3cc(-c4ccccc4)[nH]n3)cnc21	763602393	ZYFHXTBLRBWKFJ-UHFFFAOYSA-N	432.444	1.802	50	20	IDGD	
CC(C)CNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)cc1	763604195	HGMAZDVJYGCBSU-UHFFFAOYSA-N	448.483	1.862	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(N3C[C@H](C)O[C@@H](C)C3)nc2)c1	763629686	GKFDGTQTUZQQSO-HOTGVXAUSA-N	441.488	1.169	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(CC(C)(C)C)nn1C	763680831	BSGYUMKDEAVHIA-UHFFFAOYSA-N	431.493	1.572	50	20	IDGD	
COCCn1ncc2ccc(NC(=O)C(=O)NNC(=O)C34CC5CC(CC(C5)C3)C4)cc21	763728265	PIEXHYXZYDVJFL-UHFFFAOYSA-N	439.516	1.985	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)c(OC)c1OC	763729381	XSIOMEQILJBMLE-UHFFFAOYSA-N	442.472	1.251	50	20	IDGD	
CNC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)CC23CC4CC(CC(C4)C2)C3)cc1	763731403	ATQHPKCMLZEEDX-UHFFFAOYSA-N	442.516	1.504	50	20	IDGD	
O=C(NNC(=O)c1cccc(Cl)c1)C(=O)Nc1ccc(CN2C(=O)CCC2=O)cc1	763749774	DPAAOFFDHQFJQI-UHFFFAOYSA-N	428.832	1.389	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)C(=O)Nc2c3c(nn2-c2ccccc2)CCC3)c1	763758210	KNNXIFDONXJFIE-UHFFFAOYSA-N	432.484	1.827	50	20	IDGD	
CCS(=O)(=O)c1cccc(CC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)c1	763764718	UHIPGWOGALOZLV-UHFFFAOYSA-N	439.515	1.279	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2cc3c(cc2F)CCC(=O)N3)c1	763775087	KUHWCYWSSTVQLL-UHFFFAOYSA-N	430.392	1.127	50	20	IDGD	
CN(C)CC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCC3)cc1	763783316	LIMZKBOBFUOQAR-UHFFFAOYSA-N	429.502	1.137	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccc2oc(N(C)C)nc2c1	763864347	BCZACKBKFZPRLV-NSHDSACASA-N	429.408	1.586	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cc(CC(C)(C)C)nn2C)cc1	763873024	RIRZXTYHQCKYHT-CQSZACIVSA-N	443.504	1.765	50	20	IDGD	
CCOC(=O)c1c(CC(C)C)csc1NC(=O)C(=O)NNC(=O)Cn1nc(C)cc1C	763884900	HEWIJASFAJEOLB-UHFFFAOYSA-N	449.533	1.723	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=O)CSc2ccccc2O)n(C)c1	764045098	BILAWAPICSGITN-UHFFFAOYSA-N	440.547	1.315	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2cc(Br)ccc2F)c1O	764131407	GFBGNLWDFQRQQB-UHFFFAOYSA-N	426.198	1.702	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2O1)C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F	764169573	WWHIQSHKNCKYPT-AWEZNQCLSA-N	436.327	1.286	50	20	IDGD	
CN1CCN(Cc2cccc(NC(=O)C(=O)NNC(=O)C(C)(C)c3ccccc3)c2)CC1	764309625	RUMXUFOAMZYVMZ-UHFFFAOYSA-N	437.544	1.498	50	20	IDGD	
O=C(NNC(=O)C(F)(F)Oc1ccccc1)C(=O)Nc1cccc(Cn2cccn2)c1	764377943	FCICWIRJGDAZFX-UHFFFAOYSA-N	429.383	1.689	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(Sc2nc(C)cc(C)n2)cc1	764397685	LYYWQKHVUKQLRQ-AWEZNQCLSA-N	447.517	1.382	50	20	IDGD	
CCOc1nccc(C)c1C(=O)NNC(=O)c1cccc(S(=O)(=O)N(CC)CC)c1	765184586	ITFVXLROBGHXQI-UHFFFAOYSA-N	434.518	1.894	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)c2ccc(=O)n(-c3ccccc3F)n2)cc1OC	765543842	WGQRBGKWHHUHRD-UHFFFAOYSA-N	426.404	1.854	50	20	IDGD	
CNC(=O)[C@@H]1CCC[C@@H]1NC(=O)NNC(=O)[C@H](C)Oc1cccc(Br)c1	765649958	XMVXSUMKPGQPKM-GDLCADMTSA-N	427.299	1.462	50	20	IDGD	
Cc1noc(Cl)c1CCC(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	766640761	GDJPUSYXBFIALW-UHFFFAOYSA-N	433.896	1.174	50	20	IDGD	
COc1ccc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c(C)c1	767136063	XBMMNQIGVBNJEI-UHFFFAOYSA-N	446.529	1.932	50	20	IDGD	
Cc1nn(-c2ccccc2)c2sc(C(=O)NNC(=O)NC[C@H]3CCCS3(=O)=O)cc12	767172855	FABXDIQCJUKBFH-CQSZACIVSA-N	447.542	1.917	50	20	IDGD	
O=C(COc1ccccc1-c1ccccc1)NNC(=O)NCCS(=O)(=O)CC1CC1	767234175	NBBSGFDOHIPMMR-UHFFFAOYSA-N	431.514	1.888	50	20	IDGD	
Cc1ccc(S(N)(=O)=O)c(C(=O)NNC(=O)NCc2cccc(C(F)(F)F)c2)c1	767340086	ZPODOUWOFZKUGB-UHFFFAOYSA-N	430.408	1.805	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](OCC(=O)NNC(=O)c2nnc(O)c3ccccc23)C1	767730092	VIGSRZRLJDWYDY-CYBMUJFWSA-N	445.476	1.513	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2cccc(-c3cc[nH]n3)c2)c1	767919027	BAXXOLXFXHLBQH-UHFFFAOYSA-N	428.474	1.794	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)c3cc(NS(C)(=O)=O)ccc3O)n[nH]2)cc1	768269876	QNUQQFYSXAQKFZ-UHFFFAOYSA-N	443.485	1.791	50	20	IDGD	
CC(C)[C@H](NC(=O)OC(C)(C)C)C(=O)NCC(=O)NNC(=O)c1ccc(Cl)cc1F	768423342	ZOFJMDXSPAQHAM-HNNXBMFYSA-N	444.891	1.906	50	20	IDGD	
CN(C)C(=O)COc1ccc(C(F)(F)C(=O)NNC(=O)c2ccc3c(c2)OCO3)cc1	769353764	INRPWJVHLICPSI-UHFFFAOYSA-N	435.383	1.435	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)Nc1ccc(-n2ncn(C)c2=O)cc1	770628954	HRULLXMKIQQFDZ-GFCCVEGCSA-N	430.852	1.845	50	20	IDGD	
COC(=O)c1ccnc(NC(=O)NNC(=O)c2cc(-c3ccc(OC)c(OC)c3)[nH]n2)c1	770678116	CLHINYGJSQTTOI-UHFFFAOYSA-N	440.416	1.742	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)COc3ccc4c(c3)CCC(=O)N4)nc21	770969751	VNEQJUVENAVUDB-UHFFFAOYSA-N	425.449	1.694	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1cc(C2CC2)nc2c1c(O)nc(=O)n2CC(C)C	771992315	DRAQBWQVEWFBFO-NSHDSACASA-N	445.476	1.133	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)CCC[S@@](=O)c1ccc(Br)cc1	772135524	HKWYXKJFDNZYED-SSINHNECSA-N	433.324	1.826	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)c1cn([C@@H]2CCS(=O)(=O)C2)nc1C(C)C	772160811	FPOBVGMSOBOPEK-UONOGXRCSA-N	442.538	1.105	50	20	IDGD	
Cc1cc(F)ccc1-n1cc(C(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)nn1	772195883	SNXMECAGMIBALV-UHFFFAOYSA-N	430.827	1.446	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)[C@@H]1CCN(C(=O)OCc2ccccc2)C1	772283391	MPMUFXFPJAICBJ-MRXNPFEDSA-N	449.508	1.500	50	20	IDGD	
C[C@@H]1C[C@H](NC(=O)NNC(=O)Cc2cn3ccccc3n2)CCN1C(=O)OC(C)(C)C	772465587	WIYZIWKHQOQQAX-HUUCEWRRSA-N	430.509	1.995	50	20	IDGD	
CC(C)[C@H](C(=O)NNC(=O)COc1ccccc1-c1ccccc1)N1CCCS1(=O)=O	772629668	DNFCEIHRBXIMCY-OAQYLSRUSA-N	445.541	1.940	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)[C@H]1CCCN(C(=O)OC(C)(C)C)C1)n1nnc(-c2ccccc2)n1	773412243	USAHRBMNLOFAQB-HOCLYGCPSA-N	443.508	1.696	50	20	IDGD	
Nc1nc(Cl)cc(NNC(=O)CCCNS(=O)(=O)c2ccc3c(c2)CCCC3)n1	773861700	PUVPJQVXNPRYLV-UHFFFAOYSA-N	438.941	1.793	50	20	IDGD	
COCCN1C(=O)CCc2cc(NC(=O)C(=O)NNc3nccnc3C(C)C)ccc21	773992852	NJMCQQZIFQZFJW-UHFFFAOYSA-N	426.477	1.607	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)cc1NC(C)=O	774002548	RJBNHLOWVJALEF-NSHDSACASA-N	448.863	1.860	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)Nc2ccc(C[C@@H]3NC(=O)NC3=O)cc2)cc1	775699389	AQTBKCGTOWGJAO-KRWDZBQOSA-N	425.445	1.231	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)NCCCN2CCN(c3ccncc3)CC2)c1	776619168	RXLWBAXVHWPPPW-UHFFFAOYSA-N	432.550	1.324	50	20	IDGD	
CC1(C)C[C@H](NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)C(C)(C)O1	779380437	SNJAYUGXOGASTL-INIZCTEOSA-N	438.550	1.761	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)[C@@H]2CCCN2C(=O)/C=C\c2ccc(C(N)=O)cc2)c1	780793522	YTMJYIWYIQNOMD-ADYPVZHUSA-N	436.468	1.720	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2cccc(F)c2I)nc1	782146088	WWJVDXJJQDBJKZ-UHFFFAOYSA-N	430.177	1.916	50	20	IDGD	
NC(=O)COc1cccc(NC(=O)C(=O)NNc2ncc(C(F)(F)F)cc2Cl)c1	782854117	NCKBAOBLPBMSJC-UHFFFAOYSA-N	431.758	1.700	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)ccc1Cl	782894913	XUUUYCNHDQDPNR-UHFFFAOYSA-N	443.847	1.342	50	20	IDGD	
CNS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccc(Br)cc2)cc1	783006419	SQMXQELTXOACDN-UHFFFAOYSA-N	427.280	1.439	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)c2cc(Br)c(F)cc2N)cc1	783214792	KPWSNUAVQGTTFJ-UHFFFAOYSA-N	435.209	1.660	50	20	IDGD	
Cc1ccc(C(=O)Nc2ccccc2)cc1NC(=O)C(=O)NN[C@]1(C)CCS(=O)(=O)C1	783428109	TXMPMIJPXTZNSM-OAQYLSRUSA-N	444.513	1.384	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(OCC(F)F)cc1)c1csc(N2CCOCC2)n1	783805290	IQAJMICCJMTUFY-UHFFFAOYSA-N	448.473	1.247	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2cnc3c(c2)C[C@H](NC(=O)OC(C)(C)C)CC3)ncn1	783947619	AZINUTBSCPZNLL-CQSZACIVSA-N	441.492	1.644	50	20	IDGD	
Cc1ccc(NNC(=O)C(=O)Nc2cc(F)c(F)cc2I)nn1	783951923	LOEGHONNWDYMMK-UHFFFAOYSA-N	433.156	1.750	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CNC(=O)c2cccs2)cc1Br	784005167	RTKRESHNYZURFC-UHFFFAOYSA-N	439.291	1.335	50	20	IDGD	
CN1CCC/C1=N/S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccc(F)cc2)cc1	784784017	IPDSMHBBTNXFFA-ULJHMMPZSA-N	433.465	1.720	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2nccn(C)c2=O)nn1-c1ccc(Cl)cc1Cl	785089876	HNGVIEOMFNUDKY-UHFFFAOYSA-N	436.259	1.663	50	20	IDGD	
COc1cncc(C(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)n1	790112987	BGSRBVQEDOGQLE-UHFFFAOYSA-N	441.469	1.039	50	20	IDGD	
CN(C)N(C(=O)C[C@@H](NC(=O)c1ccc(O)cc1)c1ccccc1)[C@@H]1CCS(=O)(=O)C1	792853630	FZQKYRBQWLLASS-UYAOXDASSA-N	445.541	1.746	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)Cc1ccc(S(=O)(=O)N(C)C)cc1	793750671	SRHFEEPAHVIJNU-UHFFFAOYSA-N	437.543	1.428	50	20	IDGD	
COCCOC1CCC(C(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)CC1	793813456	JGIXNTMVQBEOSU-UHFFFAOYSA-N	442.557	1.844	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)C(=O)Nc2cccc3c2CCO3)c2ccccc2c1=O	796989246	BNLSMESBCGKBLC-UHFFFAOYSA-N	449.467	1.531	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)C(=O)Nc1ccc(OCC(=O)NC)cc1C)c1ccccc1	797005211	APCAYANHIBENDU-QGZVFWFLSA-N	426.473	1.400	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)CNC(=O)OCc2ccccc2)nn1[C@H](C)C1CC1	797369017	LZBJGDCFIKTMTP-CQSZACIVSA-N	442.476	1.175	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@@H]2C(=O)NNc2nccc(N3CCOCC3)n2)cc1	799101641	PRIJVZQXDWMRQT-QGZVFWFLSA-N	426.477	1.070	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)C1CCN(C(=O)[C@H](C)CSC)CC1	799408273	RFNQRFRLHWHMNV-OAHLLOKOSA-N	445.589	1.984	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)N[C@@H](C)CCNS(=O)(=O)c1ccccc1	801738548	RGHIMRRIZSGOHX-AWEZNQCLSA-N	444.517	1.344	50	20	IDGD	
CCCN(NC(=O)[C@H](CCC(N)=O)N1C(=O)c2ccccc2C1=O)C(=O)OC(C)(C)C	804594997	CSJJUMAHSVZYIO-HNNXBMFYSA-N	432.477	1.595	50	20	IDGD	
CN(CCCN(C)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1)Cc1ccco1	805067710	AJISRWARVFUDPJ-UHFFFAOYSA-N	429.525	1.481	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)C(=O)Nc1cccc(F)c1Cl	806972813	MOLFFQYIWULBJW-UHFFFAOYSA-N	447.898	1.777	50	20	IDGD	
COC(=O)c1c(C)csc1NC(=O)C(=O)NNC(=O)[C@H]1OCC[C@H]1c1ccccc1	807068187	GJUFENJHVVAUJR-ZFWWWQNUSA-N	431.470	1.502	50	20	IDGD	
CCOc1cc(C(=O)N(C)C)ccc1NC(=O)C(=O)NNc1nccnc1C1CCC1	807460308	NEIGSUGIXWZKED-UHFFFAOYSA-N	426.477	1.926	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)N[C@@H]1CCCN(C(=O)CCC(F)(F)F)C1	807574002	CURJLQIFDCUXEW-GFCCVEGCSA-N	432.399	1.435	50	20	IDGD	
O=C(NNC(=O)c1cc(F)ccc1Br)C(=O)Nc1ccc2c(c1)C(=O)OC2	808934895	CJGUWPZSYTWXBA-UHFFFAOYSA-N	436.193	1.658	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)NCC(=O)NNc2nc(-c3ccccc3)no2)cc1	810340163	ZZAUXOCSXDLSBR-UHFFFAOYSA-N	430.446	1.117	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)N[C@H]2CC(=O)N(c3ccccc3F)C2)cc1OC	812931695	IUJXYWDEGZDJIX-AWEZNQCLSA-N	430.436	1.983	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)Cc1cn2ccccc2n1)c1ccc(N2CCCNC2=O)cc1	812940832	DSZCHXFPTJRIPP-HNNXBMFYSA-N	435.488	1.888	50	20	IDGD	
CC1(C)NC(=O)N(c2cccc(NC(=O)NNC(=O)c3ccc4c(c3)OCCO4)c2)C1=O	812973092	VDZTVJHKZFGGKX-UHFFFAOYSA-N	439.428	1.759	50	20	IDGD	
CC(C)(C)Oc1ccc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)nc1	814316903	KMXTVZBZHZAANJ-UHFFFAOYSA-N	439.516	1.478	50	20	IDGD	
COCC(Cc1ccccc1)=NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	814689033	STQOUUHFHHYMQI-UHFFFAOYSA-N	431.514	1.682	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)C2CCC(OC[C@H]3CCCO3)CC2)n1	815346950	QYRRMZIIYDZPMT-UYSNPLJNSA-N	439.534	1.439	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNc2cccc(S(C)(=O)=O)c2)cc1)[C@H]1C[C@H]1C	815558625	JAUROJUWQVCORJ-YJYMSZOUSA-N	444.513	1.933	50	20	IDGD	
O=C(NNC(=O)c1ccncc1)C(=O)Nc1ccc2c(c1)N(C(=O)Cc1ccccc1)CC2	815563676	KUBUSQAANCOAFY-UHFFFAOYSA-N	443.463	1.613	50	20	IDGD	
CCOC(=O)c1nc(NC(=O)C(=O)NNC(=O)CCC2CCCCC2)sc1C(C)=O	815569041	DSKMAJOHJGRWNX-UHFFFAOYSA-N	438.506	1.969	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)C1CCC(OC[C@H]2CCCO2)CC1	815622306	RFJSMHMQENHKIH-UYSNPLJNSA-N	428.530	1.596	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1ccc(SC(F)F)nc1	815750473	BRHFCQOWVMVNPV-UHFFFAOYSA-N	445.473	1.728	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)c1cnn(C)c1I	815886623	CDEFVRLCRVGFAB-UHFFFAOYSA-N	446.270	1.587	50	20	IDGD	
COCCCNC(=S)N(C)NC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(C)s2)C1	849167787	VAWKPKSTTCIYOC-AWEZNQCLSA-N	448.636	1.331	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)c1ccc2c(c1)C(=O)N(C[C@H]1CCCO1)C2=O	864020003	GJPMPGVLYUIUME-CQSZACIVSA-N	441.415	1.441	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)CCS(=O)(=O)c2ccc3c(c2)OCCO3)cc1	901413188	NLZJFIXDCARLEY-UHFFFAOYSA-N	434.470	1.156	50	20	IDGD	
COc1ccc(/C=C(\C#N)C(=O)O[C@H](C(=O)N[C@]2(C)CCS(=O)(=O)C2)C(C)C)cc1	913229085	FJZPVSNOHXFDJA-TYVVZUGMSA-N	434.514	1.863	50	20	IDGD	
CN(C)N(C(=O)[C@H]1CC(=O)N(c2cccc(Br)c2)C1)[C@H]1CCS(=O)(=O)C1	914437345	HSJKPMJABXPWEP-WFASDCNBSA-N	444.351	1.294	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)c(C)n1Cc1ccccn1	915188615	DMWIKYUQRRCVME-UHFFFAOYSA-N	440.529	1.916	50	20	IDGD	
CC(C)n1ncc2cc(/C=C\C(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)c(=O)[nH]c21	915197329	RIYULNFDVPENFB-FPLPWBNLSA-N	443.485	1.183	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)CCNS(=O)(=O)/C=C\c1ccccc1	915789079	GLGKIUKPUCZCKR-IKESIWSLSA-N	435.477	1.721	50	20	IDGD	
NS(=O)(=O)c1ccc(CCNC(=O)NNC(=O)c2ccc(Cl)cc2Cl)cc1	915883668	CKLOGOXYAUQKSU-UHFFFAOYSA-N	431.301	1.828	50	20	IDGD	
O=C(NCc1ccc(OCC(F)(F)F)nc1)NNC(=O)[C@@H]1COc2ccccc2O1	916397585	FDNDTYWUAGVFOD-AWEZNQCLSA-N	426.351	1.693	50	20	IDGD	
CCn1nc(C(=O)NN=Cc2c(C)nn3c(=O)c4ccccc4[nH]c23)c2ccccc2c1=O	918709702	SCVBLLFRVFGJRO-UHFFFAOYSA-N	441.451	1.978	50	20	IDGD	
C[C@H](NC(=O)COC(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccccc1)C(=O)N(C)C	918805321	SPWRDWMHMDBBRC-IQFISFIMSA-N	448.483	1.507	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)N[C@@H]1CCCOc2ccc(F)cc21	919792130	OYZPYLVTYJOEIC-CQSZACIVSA-N	435.481	1.977	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NCc2cccc(CN3CCO[C@@H](C)C3)c2)cc1	920237461	JSNKRSMLNHBTOU-KRWDZBQOSA-N	442.516	1.825	50	20	IDGD	
COc1cccc(/C=C(\C(=O)NNC(=O)Cc2c[nH]c3ccccc23)n2nnnc2C)c1	920422330	SMLMBHSUFZYZGX-RGVLZGJSSA-N	431.456	1.860	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)c1cnc2c(c1)c(C1CC1)nn2-c1ccccc1	1115871234	ZLFHYLQOVUMVAX-AWEZNQCLSA-N	439.497	1.494	50	20	IDGD	
COc1cccc(NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c1Br	1116660097	UDWHSQSIJUETCW-UHFFFAOYSA-N	432.238	1.900	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2nc(C)ncc2Br)cc(OC)c1OC	1320673808	AKQNAFGYHYYTCJ-UHFFFAOYSA-N	425.239	1.648	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H]1CC(c3ccccc3)=NO1)CCO2	1779294665	WICQTNPHKPOWHT-KNQAVFIVSA-N	445.592	1.861	50	20	IDGD	
O=C(CCCCn1cccc1)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2	1779481994	PUDYFFOZBZNWST-WAOWUJCRSA-N	425.957	1.772	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)Cn3ccc4sccc4c3=O)CCO2)C1	1781215107	HZEQWRPGRIGEAS-MGPUTAFESA-N	437.949	1.910	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cnc4c(c3)NC(=O)CS4)CCO2)C1	1781219986	UHCBXOAHMWQCBJ-BFUOFWGJSA-N	438.937	1.587	50	20	IDGD	
Cc1nn(C)c(C)c1CC(=O)N1CCO[C@]2(CCN(C(=O)[C@@](C)(Cl)CCl)C2)C1	1781231961	BZVUFOQJVNPTBY-RBUKOAKNSA-N	431.364	1.646	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)c3ccccc3C(N)=O)CCO2)C1	1781234697	PXAVZOMLIODYKN-MOPGFXCFSA-N	428.316	1.465	50	20	IDGD	
COc1ccc(CC(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](F)Br)C3)C2)cc1O	1781325682	PPYPSJQIQVKKBO-WMZOPIPTSA-N	445.285	1.464	50	20	IDGD	
CCc1cc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](Cl)COC)C2)n(C)n1	1782175595	OCXCWDUKPXTXKD-WRWLIDTKSA-N	426.945	1.364	50	20	IDGD	
Cc1cccc(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CCC(=O)NN(C)C)C2)c1	1782210796	MJOMYRXKFMHTLP-HYBUGGRVSA-N	444.576	1.424	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(N(C)C)nc3)CCO2)C1	1783536695	ILFFIAROJYLNET-ACJLOTCBSA-N	425.327	1.375	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)/C=C/c3ccc([N+](=O)[O-])o3)CCO2)C1	1783870679	FLRMBEIEBKPBOU-MEGZMVCVSA-N	427.841	1.285	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)CCc3c[nH]c4ncccc34)CCO2)C1	1783883859	MDDZSKHPAZMMIX-LAUBAEHRSA-N	434.924	1.579	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc(N(C)C)o3)C[C@@H]21	1783969859	QEOLCWZYWBAJLT-RFGFWPKPSA-N	443.342	1.365	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](C)n3cccc3)C2)C1	1784327452	XJDIVQFCJRQEJZ-KTUMRIBQSA-N	440.504	1.013	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@]3(C)CC=CCC3)C2)C1	1784752354	IBZRURPPSFNAEF-ZILGIFHJSA-N	441.532	1.697	50	20	IDGD	
Cc1ccc(C(=O)NCC(=O)N2CC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)cc1	1785566684	PAKZISVUHRJQDR-IBGZPJMESA-N	428.316	1.358	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccn4c(O)nnc34)[C@H]2C1	1787385017	SRMYFFHRDPMMJZ-TUUVXOQKSA-N	435.912	1.436	50	20	IDGD	
Cc1noc(-c2ccccc2)c1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21	1787535839	WGUHVBBFAYPUSB-FJIDUMEYSA-N	447.919	1.843	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Cl)C[C@@H]21)c1ncccc1Br	1788961173	NNVNGFCFLPSFQQ-JYYRZZBQSA-N	434.693	1.972	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc4cccnc4nc3O)[C@H]2C1	1790365567	QSOMFVSTJPYDNH-HJWJTTGWSA-N	432.908	1.946	50	20	IDGD	
CN1CCC[C@@H](C(=O)Nc2ccc(C3(NC(=O)CCC(=O)NN(C)C)CCC3)cc2)C1	1790395238	AGKLWYCSLPMSNO-QGZVFWFLSA-N	429.565	1.835	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(F)c3[N+](=O)[O-])C[C@@H]21	1791256622	DMIPXLMJGGDLSO-ZIEJDFEHSA-N	443.859	1.581	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4cc[nH]c4c3)C[C@@H]21	1791291466	WACWTVVPMHNKRJ-BJLQDIEVSA-N	441.532	1.134	50	20	IDGD	
Cc1cc2nnc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]4C3)c(C)n2n1	1791294823	OMIGVUWNJCYBNQ-AVGNSLFASA-N	441.319	1.138	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1ccc(C2(NC(=O)[C@@H](COC)NC(C)=O)CCC2)cc1	1791569380	TWRNOLANSYFGBG-DLBZAZTESA-N	425.913	1.525	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(C(N)=O)cc3)[C@H]2C1	1791895157	ZPVIKZVDFVGJJW-BZSNNMDCSA-N	433.581	1.230	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3ccc(F)cc3OC)[C@H]2C1	1792305727	RKLRKICELLBULR-XPYUAMARSA-N	442.915	1.610	50	20	IDGD	
Cc1ccn2c(=O)c(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)C(C)(C)CCl)cnc2c1	1792782727	AIAVLGDGQLMJCJ-JLVBRIDZSA-N	446.935	1.471	50	20	IDGD	
Cc1nc(N)sc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)CBr	1792867654	IOKGMMNZVQFTLH-KXGXSXBTSA-N	431.356	1.268	50	20	IDGD	
Cc1nc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)CBr)cs1	1792870839	WNIRNHHZMGMFRA-YGSHXTJESA-N	430.368	1.615	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3n(n1)CCCN(C)C3)C2	1793453661	OWGOANNDHPFTIG-HIRMHNASSA-N	437.972	1.329	50	20	IDGD	
Cc1cncc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)CBr)C3)c1	1794073122	MCKWJSOSGRXPPR-VYCZESIESA-N	438.366	1.943	50	20	IDGD	
CC(C)(C)n1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Br)C3)cn1	1794350230	KYUACUWFLQFRGQ-CRWXNKLISA-N	431.306	1.532	50	20	IDGD	
COc1cnc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Br)C3)c(F)c1	1794452480	QFMNMAWTVCQKGE-XSPYEYLBSA-N	434.237	1.123	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1n[nH]c(C2CC2)c1F	1794483700	VXVCGLXODQCXBP-GFQSEFKGSA-N	443.317	1.803	50	20	IDGD	
O=C(CC[C@@H]1CNc2ccccc2C1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2	1795647815	VIMOESIBVKSVJE-IIWNNQTBSA-N	435.952	1.240	50	20	IDGD	
CNCCCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2	1796040474	GVODJZLRPYBZTI-MUJYYYPQSA-N	432.477	1.772	50	20	IDGD	
C[C@@H](NNc1ccccc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Br	1799341937	AQSPDBMTGOVOOZ-CNRIWFPOSA-N	443.317	1.272	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnccc1N(C)C)C2	1800638871	BOJMKKRZMVAYCJ-YXPYIKCWSA-N	439.354	1.524	50	20	IDGD	
COc1ccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)Br)cc1F	1800762840	GNPJUVGJYBESLZ-NASWQRNTSA-N	443.313	1.750	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cn3c(Cl)cccc3n1)C2	1800978310	RSBAGRALEQDGRM-LKQDWFRTSA-N	441.315	1.445	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nccc(Cl)c1OC)C2	1800979022	OENFZRYSTPDBGN-XCCSTKFXSA-N	432.304	1.201	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CC(c3ccccc3)=NN1)C2)C(Cl)Cl	1801016501	GFYBPDOEMDQPLR-OCVGTWLNSA-N	425.316	1.146	50	20	IDGD	
COc1ccc(CCC(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)cn1	1803136396	QALMOVVEFBSLPL-LQWHRVPQSA-N	446.935	1.724	50	20	IDGD	
CC(=O)N(C)CCC(=O)NC[C@@H]1CCN(C(=O)CO[Si](C)(C)C)[C@H]1c1cccnc1	1804069734	KVCYKQNDJJSMCY-RXVVDRJESA-N	434.613	1.807	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2cn(C)nc2OC)[C@@H]1c1cccnc1	1805308899	WPBBTIGOJAZHJF-PVAVHDDUSA-N	435.912	1.397	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)Br)[C@H]1c1cccnc1	1808435845	ZQFSUPHKJGASFK-OMNBBPDLSA-N	439.354	1.738	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc[n+]([O-])c2)[C@@H]1c1cccnc1)[C@@H](F)Br	1808650676	BZOQRVOBQWOJBZ-NUEKZKHPSA-N	437.269	1.725	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)C2CCCC2)[C@H]1c1cccnc1	1810298599	KGHYNBYDODJZDG-XLIONFOSSA-N	436.516	1.590	50	20	IDGD	
CNC(=S)NCCC(=O)NC[C@@H]1CCN(C(=O)C(C)(C)CCl)[C@H]1c1cccnc1	1810308099	IZKSLKWHWCRIMT-RDJZCZTQSA-N	440.013	1.836	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)[C@@H](O)N2CCOCC2)[C@H]1c1cccnc1	1810349915	VJWJQVIAXGUXTB-BMQTXXJKSA-N	438.956	1.146	50	20	IDGD	
COC[C@H](NC(C)=O)C(=O)NC[C@H]1CCN(C(=O)C(Cl)Cl)[C@@H]1c1cccnc1	1810564229	KBHPBYXPHDKEGS-QLFBSQMISA-N	431.320	1.042	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2cnn3c2OCCC3)[C@H]1c1cccnc1	1812120421	WLTPFPHCRATDLP-BPQIPLTHSA-N	447.923	1.634	50	20	IDGD	
CC(=O)NCCC(=O)NC[C@@H]1CCN(C(=O)[C@H](C)Br)[C@@H]1c1cccnc1	1812663379	JZIPOVINJFDEFA-YLQAJVPDSA-N	425.327	1.397	50	20	IDGD	
Cn1cc(CC(=O)NC[C@H]2CCN(C(=O)CO[Si](C)(C)C)[C@@H]2c2cccnc2)cn1	1813457138	JXDOSMIWWUPDPK-WIYYLYMNSA-N	429.597	1.915	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)CC[C@@H]2CCOC2)[C@H]1c1cccnc1	1813629904	KLQPQIRYYWTKRZ-LYHRCORUSA-N	445.564	1.277	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)CSc3ncccn3)sc2C1	1815635970	ZUKWDBPFEWJSSR-GHMZBOCLSA-N	441.966	1.891	50	20	IDGD	
C=CCC(F)(F)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1	1817477204	PCWTVETXFGJHRY-MRXNPFEDSA-N	432.236	1.607	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](COC)NC(C)=O)n[nH]1	1819606176	SEWABLFTTPWJMW-CWRNSKLLSA-N	427.933	1.960	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1)c1cccn(C(F)F)c1=O	1819636791	SNPZNFJQJZVOHJ-QWHCGFSZSA-N	443.838	1.872	50	20	IDGD	
CN(CC(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@](C)(Cl)CCl)n[nH]1)C(=O)C(=O)O	1820869486	WFLNWLYYTXUJCW-APPDUMDISA-N	448.307	1.181	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](F)Br)n[nH]1	1820937357	QHXKFTIPOOFINH-XHDPSFHLSA-N	447.309	1.465	50	20	IDGD	
CC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)Cn1cc([N+](=O)[O-])cn1)CC2	1822840703	BUSMBXUVFZDFLB-GXSJLCMTSA-N	426.886	1.877	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCS(C)(=O)=O)n[nH]1	1822967585	RRTFRITYLDPYBT-WCQYABFASA-N	449.371	1.868	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)C[C@@H]2NC(=O)NC2=O)CC1	1824011679	ZKPSVXGLZRLWGR-LSDHHAIUSA-N	426.945	1.469	50	20	IDGD	
O=C(NCCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H](O)CCl)CC1)c1ccc[nH]1	1825160223	YXCMTHURHOAVCD-QZTJIDSGSA-N	438.956	1.354	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)CSCC(=O)O)sc2C1	1826119367	WIDPJUDARZLYOG-SFYZADRCSA-N	436.353	1.656	50	20	IDGD	
CCc1oncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2	1830538003	TVNCFWTZLGEQSC-SCLBCKFNSA-N	444.326	1.338	50	20	IDGD	
C[C@H](Sc1cccs1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1830730552	BFQYKAPLEBLJOX-SUNYJGFJSA-N	448.994	1.285	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](NC(C)C)C(C)C)C2)C1	1831646916	PBNDSIOCJYAKEI-BBTUJRGHSA-N	432.005	1.873	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)Nc3ccccn3)C2)C1	1831650819	LGMQEMDDNOIQEL-XGHQBKJUSA-N	438.956	1.746	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CN2CCOCC2)CC1	1831651242	RPMQJTPPXXMRLV-DOTOQJQBSA-N	430.387	1.722	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3c(C)n[nH]c3C)C2)C1	1831654485	UCOGSDRDQFTJGM-PXNSSMCTSA-N	426.945	1.433	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cn3cnc4ccccc43)C2)C1	1831657320	MYNRJDBUNXTGQD-HTAPYJJXSA-N	448.951	1.900	50	20	IDGD	
Cc1cccnc1C(=O)N1CCO[C@@]2(COCCN(C(=O)CCBr)C2)C1	1831826104	ZPYHMOLMNYSGOB-GOSISDBHSA-N	426.311	1.245	50	20	IDGD	
CN1CCC(CC(=O)N2CCC([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)CC1	1831869574	KDHCIZDWCLPDEQ-NRFANRHFSA-N	449.640	1.711	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCC(=O)N3CCCC3)CCO2)C1	1832418902	QUOPFKKMSMDLSA-UTKZUKDTSA-N	443.972	1.253	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)CC2(O)CCC2)CC1	1832460344	IEYNXSHFJBQOEC-LJQANCHMSA-N	443.548	1.224	50	20	IDGD	
Cc1ccc(CCC(=O)N2CCO[C@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)nc1	1832989417	DPOKUWISTJIAFA-JOCHJYFZSA-N	449.624	1.631	50	20	IDGD	
CC(C)(C)NCC(=O)NC1CCN(C2CCN(C(=O)CO[Si](C)(C)C)CC2)CC1	1834696628	ICNFHDVZDGLOQE-UHFFFAOYSA-N	426.678	1.798	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccccc3)CCO2)C1	1834998932	AYANTKFBVDGVSF-BEFAXECRSA-N	425.323	1.469	50	20	IDGD	
O=C(Cc1noc2ccccc12)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1835983051	IKFSSAUUKYKFBD-LJQANCHMSA-N	442.299	1.630	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)c3ncon3)CC2)CC1	1836044542	ZKOHOJOMFHOTGF-LBPRGKRZSA-N	428.331	1.286	50	20	IDGD	
C#CCO[C@H](C)C(=O)N1CCC(OC2CCN(C(=O)CCBr)CC2)CC1	1836856882	ARXLJVDOSIFJSO-OAHLLOKOSA-N	429.355	1.808	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3nc4ccccc4[nH]3)C2)C1	1837713171	LMSHUHOMBKVFRB-OAQYLSRUSA-N	446.580	1.484	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc4ccnn34)C2)C1	1837715647	BWWQQRRGNCVGEM-NRFANRHFSA-N	446.580	1.256	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(=O)c3ccc(Cl)cc3)C2)C1	1839141795	SQRUYONXRPLECI-UZLBHIALSA-N	443.327	1.997	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CC[C@H](C(=O)OC)CC3)C2)C1	1839142016	BQSSVPNMZNIADC-BZLDKRAPSA-N	444.956	1.440	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc4c3OCCO4)C2)C1	1839145111	VEVBKFXJBBTKEB-IERDGZPVSA-N	438.908	1.545	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(OC)c(OC)c3)C2)C1	1839146698	SUPKNUKKEHFFSZ-IIBYNOLFSA-N	440.924	1.791	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(O)nc3)C2)C1	1839153831	SWLTYLABVWPYAE-QZTJIDSGSA-N	432.304	1.094	50	20	IDGD	
C=CCC(F)(F)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](Br)CC)C2)C1	1839890502	DFOQIIFCKAOVOU-BBRMVZONSA-N	439.297	1.828	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccc(F)cc3F)CCO2)C1	1839980116	ZIRQWDHILLOUSS-OXJNMPFZSA-N	446.878	1.218	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(O)c(F)c3)C2)C1	1840035397	PXMVHJXYDZGFMD-SGTLLEGYSA-N	445.285	1.385	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)NC(=O)OC(C)(C)C)CCO2	1840089065	KTLXNOSLLYSMKC-QEEYODRMSA-N	447.960	1.373	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CCc3ccccc3O1)CCO2	1840137992	FVTGPRWZVJBXQN-JLMWRMLUSA-N	436.936	1.854	50	20	IDGD	
O=C(c1ccn2ccnc2c1)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840188474	LWTUCMMZMQKWDU-SFHVURJKSA-N	427.288	1.208	50	20	IDGD	
COc1cccc(OC)c1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840188832	FUPXHAPGNJYXSI-LJQANCHMSA-N	447.315	1.578	50	20	IDGD	
COc1cccc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)c1C	1840190950	XBNOBQDRJBCGOP-HXUWFJFHSA-N	445.343	1.806	50	20	IDGD	
Cn1ncnc1C(=O)N1CCCC12CN(C(=O)[C@@H](Br)Cc1ccccc1)C2	1842343305	FWBISIQKXGGGMI-HNNXBMFYSA-N	432.322	1.638	50	20	IDGD	
O=C(c1c[nH]c2c(Cl)cccc12)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843012230	QOWWOABBWBFVQI-UHFFFAOYSA-N	437.692	1.632	50	20	IDGD	
COc1cc(C(=O)N2CCCC23CN(C(=O)[C@@H](O)CCl)C3)nn1-c1ccccc1F	1843184779	AUSHMNKPKGGHEP-INIZCTEOSA-N	436.871	1.437	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)Cc1ccc(F)cc1)C2	1843415690	AYEKKJYTTXLARX-MFKUBSTISA-N	425.464	1.706	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)[C@H](C)n1ccnc1C)C2	1843417324	WOZGYRUQVOOSOR-BGHCKBSUSA-N	425.493	1.090	50	20	IDGD	
Cc1ccc(CCC(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)c(C)n1	1844265414	ZEPGIWZAHIZJLU-UHFFFAOYSA-N	436.516	1.147	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)CCc2c[nH]c3ccc(F)cc23)C1	1846253201	YDRYXSWVYXHBHD-UHFFFAOYSA-N	443.523	1.816	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H](F)C[C@@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](O)CCl)C1	1847558819	FVLVSYWKVAPUIN-RBGFHDKUSA-N	447.935	1.383	50	20	IDGD	
O=C(Cc1ccc(Br)c(F)c1)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl	1847563980	SRWMZDVWKOKDPS-KKUMJFAQSA-N	433.705	1.932	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)[C@@H]2CC(=O)N(c3ccc4c(c3)OCCO4)C2)c1	15886062	QWRHKIHKMCPJIN-MRXNPFEDSA-N	439.468	1.654	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@H](C)NC(=O)OCc2ccccc2)c2ccccc2c1=O	17191018	NXJJFSXZOYPERC-AWEZNQCLSA-N	437.456	1.492	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)CCc2c(C)nc(SC)nc2C)c2ccccc2c1=O	20908261	AFQLUPCMZPKFLP-UHFFFAOYSA-N	440.529	1.939	50	20	IDGD	
C=CCNS(=O)(=O)c1cc(C(=O)NNC(=O)COc2ccc(C)c(C)c2)ccc1F	106097799	BQRFSUPQPRDRPV-UHFFFAOYSA-N	435.477	1.747	50	20	IDGD	
COc1cccc(OCC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1	117385924	WOVDDOQGZUKZIX-UHFFFAOYSA-N	433.486	1.320	50	20	IDGD	
O=C(NNc1nc(-c2ccncc2)no1)C1CCN(S(=O)(=O)c2cccnc2)CC1	726369741	FPFGOALDDIADHL-UHFFFAOYSA-N	429.462	1.071	50	20	IDGD	
CN(C)CC(C)(C)CNC(=S)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	727065544	LHRRWNAKQMUKIC-UHFFFAOYSA-N	441.623	1.168	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NN=Cc1cc(Br)cc(Br)c1O	728436582	QYMODAZRWKMSOC-LURJTMIESA-N	443.117	1.305	50	20	IDGD	
CCOC(=O)C1=NN(c2ccccc2)[C@H](C(=O)NNC(=O)c2cccc(OC)c2O)C1	728714704	OYRXUWXNPIPHSM-INIZCTEOSA-N	426.429	1.360	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NCCCN2CCCCC2=O)c2ccccc2c1=O	730129241	LQXPABRPEHQCAN-UHFFFAOYSA-N	442.520	1.543	50	20	IDGD	
O=C(NCc1nnnn1-c1ccccc1)NNC(=O)c1ccc(COc2ccccc2)o1	730578402	OBAUCFJRDSRJBJ-UHFFFAOYSA-N	433.428	1.979	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)N1CCN(S(=O)(=O)c2ccc3ccccc3c2)CC1	731848988	QCYPGHRIYOZXBP-KRWDZBQOSA-N	446.573	1.728	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)[C@H]1CCCN(S(=O)(=O)c2c(C)n[nH]c2C)C1)c1ccccc1	732132911	KLRBXNDEFOVRTM-ZWKOTPCHSA-N	447.561	1.768	50	20	IDGD	
C[C@@H](Oc1ccccc1Br)C(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	732750278	LYJZGALPGMAXCM-LLVKDONJSA-N	445.273	1.925	50	20	IDGD	
O=C(NNC(=O)c1ccc(Oc2ccc(F)c(F)c2)cc1)N[C@@H]1CCS(=O)(=O)C1	732755248	REUYIRXHSUXSJC-GFCCVEGCSA-N	425.413	1.888	50	20	IDGD	
C[C@@H](c1cccnc1)N1CCN(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)CC1	734162328	CPBROPUMOIQSBS-HNNXBMFYSA-N	445.549	1.108	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)N[C@@H]1CCCN(c2ccccc2)C1	734516294	FXJOLVCNZMHMCO-OAHLLOKOSA-N	430.534	1.593	50	20	IDGD	
COc1ccc(CN2CC[C@H](NC(=O)NNC(=O)c3cnn(-c4ccccc4)c3)C2=O)cc1	734531587	NJGGNTMIDNPYKA-FQEVSTJZSA-N	448.483	1.626	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCc2cccc(-n3cncn3)c2)cc(OC)c1OC	735511058	BTIKWHIXNDJKCX-UHFFFAOYSA-N	426.433	1.437	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)N[C@H](C)CN1CCN(c2ccccn2)CC1	735519978	WVCPWPBBDODPSZ-MRXNPFEDSA-N	436.520	1.192	50	20	IDGD	
CC(C)(C)[C@@H]1OCCC[C@H]1CNC(=O)NNC(=O)c1csc(N2CCOCC2)n1	735677368	DZCHZMSIWRIMEA-DZGCQCFKSA-N	425.555	1.765	50	20	IDGD	
CCCOc1ccc(C(=O)NNS(=O)(=O)c2ccc(C(=O)O)cc2F)cc1OC	743250569	GHVQWHGNZHSRMZ-UHFFFAOYSA-N	426.422	1.945	50	20	IDGD	
O=C(CSC[C@H]1CCCCO1)NNc1ccccc1S(=O)(=O)N1CCOCC1	744620016	DSNBGPLYKHTIRV-OAHLLOKOSA-N	429.564	1.453	50	20	IDGD	
CC/C=C(/C)C(=O)N1CSC[C@@H]1C(=O)OCC(=O)NNC(=O)c1ccc(C#N)cc1	744972272	LFZNRAUEZNNBER-RWFSNQMCSA-N	430.486	1.120	50	20	IDGD	
O=C(NNC(=O)c1c[nH]c2ccccc12)c1cc(S(=O)(=O)N2CCCC2)ccc1O	745991502	WANDBUVNOWBCTR-UHFFFAOYSA-N	428.470	1.733	50	20	IDGD	
CCCNC(=O)NNC(=O)[C@@H]1CCCN1C(=O)NCc1cccc(Br)c1	746171556	WKFUVHJVPKPOTE-AWEZNQCLSA-N	426.315	1.864	50	20	IDGD	
CC(C)CNC(=S)NNC(=O)c1cc(S(=O)(=O)NCc2ccccc2)ccc1O	747714737	HTMQXMIKWSOLJO-UHFFFAOYSA-N	436.559	1.636	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)c2ccccc2c1=O	749341679	ALCPBCSCYHXMQC-UHFFFAOYSA-N	432.481	1.446	50	20	IDGD	
O=C(CCOc1ccccc1)NNC(=O)[C@H]1CCCN1C(=O)c1ccc2c(c1)OCO2	749598506	CAAGMOZEJSOZBM-QGZVFWFLSA-N	425.441	1.636	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H](C)Cc2ccncc2)c1	749621773	SVCRTYGLIYIMHK-HNNXBMFYSA-N	433.534	1.687	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@H]2CCN(C)c3ccccc32)cc1	750712859	BOACGKNHTWVGEM-SFHVURJKSA-N	430.530	1.387	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)c1cc(S(N)(=O)=O)cc(C)c1C	751549737	YNKFBEHKOOTHQA-UHFFFAOYSA-N	429.502	1.324	50	20	IDGD	
Cc1cc(O)cc(=O)n1CCC(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12	754239801	FQWPUGXMSNCIDN-UHFFFAOYSA-N	425.445	1.004	50	20	IDGD	
C[C@](O)(C(=O)NNC(=O)C1CCN(c2ncccn2)CC1)c1cccc(C(F)(F)F)c1	754851518	RPEGARXQFKAZLN-LJQANCHMSA-N	437.422	1.767	50	20	IDGD	
CN1C(=O)C[C@@H](NC(=O)NNC(=O)C(=O)Nc2ccccn2)[C@@H]1c1ccc(Cl)c(F)c1	755087312	KTSZIZBIBHNIFR-CJNGLKHVSA-N	448.842	1.115	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)Nc3ccc(-n4cnnn4)cc3)n[nH]2)cc1OC	755438048	FBCGCHAHEYNILC-UHFFFAOYSA-N	449.431	1.536	50	20	IDGD	
COC(=O)CNC(=O)Cc1ccc(NC(=O)NNC(=O)Cc2ccc(Cl)cc2)cc1	755863461	LGSGJJFIGLZYRS-UHFFFAOYSA-N	432.864	1.567	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN2CCN(Cc3noc(C(C)(C)C)n3)CC2)cc1C	755946476	LDOWIIORQXKBAY-UHFFFAOYSA-N	448.593	1.878	50	20	IDGD	
COc1ccc(C(=O)N2CCOCC2)cc1NC(=O)NNC(=O)c1ccc2c(c1)OCO2	756258319	RJHBWGXFXTVAMC-UHFFFAOYSA-N	442.428	1.363	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2ccc(S(=O)(=O)N(C)C3CC3)cc2)cc1OC	756402645	NHWFTBHMFXLBKE-UHFFFAOYSA-N	448.501	1.953	50	20	IDGD	
CN(C)Cc1ccc(C(N)=O)cc1NC(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	756827799	YNXBDEKHIPMZEM-UHFFFAOYSA-N	437.460	1.205	50	20	IDGD	
CC(C)CN1C(=O)C(=NNC(=O)[C@H](C)NS(C)(=O)=O)c2cc(Br)ccc21	756889926	QKIRXHIPNJILTI-JTQLQIEISA-N	445.339	1.210	50	20	IDGD	
COc1ccccc1N1CC[C@H](NC(=O)NNC(=O)c2nnc(O)c3ccccc23)C1=O	757289506	BGPABFRYHKPHRS-AWEZNQCLSA-N	436.428	1.094	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)[C@@H](Sc1ccc(F)cc1)c1ccccc1	758049231	YRIJIAOGNVMTIY-LRDDRELGSA-N	425.507	1.744	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)c1cccnc1I	758420148	BVEXXXXEBDWPNJ-UHFFFAOYSA-N	429.239	1.945	50	20	IDGD	
O=C(c1cccc(Cn2ccnc2)c1)N1CCN(S(=O)(=O)CBr)CC1	758534809	JIPKVJQIMWERQQ-UHFFFAOYSA-N	427.324	1.371	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)C(=O)N(Cc1ccccc1)C2=O)C(=O)Nc1ccccn1	758838858	AEMDIZNMWUUISA-UHFFFAOYSA-N	443.419	1.278	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)c1cnc2nccnc2c1	759391406	KSILGKJNOXTBSW-UHFFFAOYSA-N	439.907	1.257	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)C(C)(C)NC(=O)C(F)(F)F	760068054	YPMMRQDASLCSFE-QMMMGPOBSA-N	440.216	1.821	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)CC[C@H]2CCN(C(=O)OC(C)(C)C)C2)C[C@@H](C)O1	760119359	HIVSIAGTCRCEBQ-BBWFWOEESA-N	426.558	1.670	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)N[C@@H]2CCOC[C@@H]2OCC)c2ccccc2c1=O	760132125	OWNKPWHFFMZISQ-MSOLQXFVSA-N	445.520	1.725	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)CCNC(=O)[C@@H]2CCCN2C(=O)OC(C)(C)C)c1	760797528	BJTWORCMXJLDSP-KRWDZBQOSA-N	447.536	1.419	50	20	IDGD	
COc1ccc(CN2C[C@@H](C(=O)NNC(=O)CSc3ccccc3OC)CC2=O)cc1	761636564	LRLZMOZCKJLKCU-INIZCTEOSA-N	443.525	1.992	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)nc2ccccc21	761806593	QCMBLFQATSJEPN-SFHVURJKSA-N	434.500	1.637	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)NC[C@@H]1[C@H](C)OC(C)(C)N1C(=O)OC(C)(C)C	762332021	UOFLXURSHVEUEI-BFHYXJOUSA-N	432.518	1.129	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NN=Cc1c(Cl)nc(N)nc1N1CCOCC1	763378247	DKASVKMSWAXDAP-UHFFFAOYSA-N	441.920	1.304	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)NC[C@@]1(N2CCOCC2)CCSC1	763476773	OTQWGUZQDZOGDW-SFHVURJKSA-N	426.564	1.023	50	20	IDGD	
O=C(COc1ccccc1Br)NNC(=O)C1CCN(c2ncccn2)CC1	763571808	FNBRMKVUKCGWDG-UHFFFAOYSA-N	434.294	1.682	50	20	IDGD	
Cc1cc(C(=O)NC(C)C)ccc1NC(=O)C(=O)NNC(=O)COc1ccc(C#N)cc1	763675269	UKZPNMXFODBVLB-UHFFFAOYSA-N	437.456	1.170	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)C(=O)Nc1ccnc(OCC(F)(F)F)c1	763679848	DORNWFFNLHNXCN-UHFFFAOYSA-N	430.314	1.327	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc3c(c2)nc2n3CCCCC2)cc1	763682138	RPFBFTWZVNLCPI-UHFFFAOYSA-N	446.467	1.799	50	20	IDGD	
CN1CCN(C(=O)c2ccc(NC(=O)C(=O)NNC(=O)c3cccc(Cl)c3)cc2)CC1	763748094	WPSMZXMEGSRNQM-UHFFFAOYSA-N	443.891	1.127	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)C1CCN(C(=O)c2ccc(Cl)s2)CC1	763815071	SAIMHWDDBXGMPM-UHFFFAOYSA-N	449.920	1.226	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cc(C(=O)OC)cs2)cc1	763861852	RFHBBFIYNQDGLM-LLVKDONJSA-N	435.458	1.487	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccccc2N(C)C(C)=O)cc1	763861892	SWGSNBFXIRHISE-AWEZNQCLSA-N	442.472	1.621	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2nn(C(C)(C)C)cc2C#N)cc1	763879606	ZQASFHYUUMWVRG-CYBMUJFWSA-N	440.460	1.266	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)C(=O)Nc1c(F)cccc1-n1cccn1	763950136	TTZIIPZZJASGBX-UHFFFAOYSA-N	449.402	1.302	50	20	IDGD	
CS(=O)(=O)CCc1ccc(NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)cc1	763977515	UZCVTLZSOPRLAI-UHFFFAOYSA-N	439.877	1.032	50	20	IDGD	
CC[C@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1	764007052	YHTMXVSEOZUHQO-ZDUSSCGKSA-N	440.456	1.386	50	20	IDGD	
CCn1nnnc1-c1cccc(NC(=O)C(=O)NNC(=O)Cc2cccc3ccccc23)c1	764037491	XZEHCCLYSCXHRN-UHFFFAOYSA-N	443.467	1.842	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)CN1C(=O)N[C@@]2(CCc3ccccc32)C1=O	764042674	LJFQHYIDAHTOBE-OAQYLSRUSA-N	440.481	1.025	50	20	IDGD	
Cc1cc(N2CCCC2)ccc1NC(=O)C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	764077217	JHFOEMJENRBJJP-UHFFFAOYSA-N	444.513	1.398	50	20	IDGD	
CCCOc1cc(C)ccc1NC(=O)C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	764078676	ZTUDRWNWNPZJRN-UHFFFAOYSA-N	433.486	1.587	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)N3CCCC[C@H]3C)c(Cl)c2)n[nH]1	764109398	SYQKYQGZCWZTRF-GFCCVEGCSA-N	446.895	1.786	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(-n3cncn3)c(Cl)c2)c1O	764131439	OXQBXVMCNOLYGY-UHFFFAOYSA-N	430.808	1.035	50	20	IDGD	
O=C(NNC(=O)c1cccc(OC(F)F)c1)C(=O)Nc1ccc(Cn2cncn2)cc1	764251614	VYRYYKDBHOEQHR-UHFFFAOYSA-N	430.371	1.328	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@H]2C)ccc1NC(=O)C(=O)NNC(=O)Cc1cccnc1	764268401	LYHWAOIWHANOHT-MRXNPFEDSA-N	437.500	1.733	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1cc(C2CCCC2)nn1-c1ccccc1	764398118	OTPULXYYFXGYMK-HNNXBMFYSA-N	443.504	1.667	50	20	IDGD	
COCCn1ccc2ccc(NC(=O)C(=O)NNC(=O)CSc3ccccc3O)cc21	764400854	JKSYWHSLUQZGQO-UHFFFAOYSA-N	442.497	1.872	50	20	IDGD	
CC(C)NC(=O)C(=O)NNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	764631995	KTEKRXRCLRRNNH-INIZCTEOSA-N	431.493	1.276	50	20	IDGD	
Cn1c(=O)c2c(ncn2CC(=O)NN=Cc2ccc(-c3ccccc3F)s2)n(C)c1=O	764816355	JESDLJCMWCOJFY-UHFFFAOYSA-N	440.460	1.452	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)[C@H]1CCCN(C(=O)NC2CCCC2)C1	765317537	PAVNBCJHMGKGPT-HNNXBMFYSA-N	439.557	1.803	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)c3cc(S(N)(=O)=O)ccc3F)n[nH]2)c1	765582940	ZTXRYUPCLYAXIV-UHFFFAOYSA-N	431.449	1.555	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)/C=C/c3ccsc3)CC2)cc1	765728591	MAKRMAIGSCGGCR-QPJJXVBHSA-N	448.570	1.224	50	20	IDGD	
CC(C)C[C@@H](NC(=O)OCc1ccccc1)C(=O)NNC(=O)C(=O)Nc1ccccn1	767349981	AZTCVDQEZGNPRL-MRXNPFEDSA-N	427.461	1.509	50	20	IDGD	
N#Cc1ccc(N2CCN(C(=O)NNC(=O)CNC(=O)c3ccco3)CC2)c(Cl)c1	767798549	HTNMOHQNMBYPGQ-UHFFFAOYSA-N	430.852	1.097	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cc3c(cc2F)NC(=O)CC3)cc1OC	768116762	JLYQIDKGMZVQSR-UHFFFAOYSA-N	445.403	1.346	50	20	IDGD	
COCCN(CC(=O)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1)C(=O)OC(C)(C)C	768289155	OWZKVVHIGLBFOB-UHFFFAOYSA-N	435.456	1.860	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCCn1cc([N+](=O)[O-])cn1	768517101	ROIXARMXNCOGKB-SNVBAGLBSA-N	441.242	1.352	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)c(C(C)(C)C)n1	768938997	XJSGNPWTIUCUBL-UHFFFAOYSA-N	447.561	1.967	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)NC3CCN(C(=O)c4ccco4)CC3)nc21	770339901	FQHSXYSRTVRXSD-UHFFFAOYSA-N	442.480	1.811	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cn(C)nc2-c2ccccc2)cc1OC	772161614	CVQPEYPMHONWTI-UHFFFAOYSA-N	438.440	1.722	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NNC(=O)CNC(=O)c2cc3ccccc3[nH]2)C1	773411790	RJUWBCYBQBBZCC-OAHLLOKOSA-N	443.504	1.692	50	20	IDGD	
CC(C)NC(=O)N1CCC[C@H]1C(=O)NNC(=O)[C@H]1CCCN(C(=O)OC(C)(C)C)C1	773420179	WYWSTXPPNMSYOK-GJZGRUSLSA-N	425.530	1.363	50	20	IDGD	
O=C(Nc1ccc(S(F)(F)(F)(F)F)cc1)C(=O)N1CCN2C(=O)C(=O)NC[C@@H]2C1	773707504	ASOYQPNRVWACSB-SNVBAGLBSA-N	442.366	1.452	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)N[C@H]2CCO[C@@]3(CCS(=O)(=O)C3)C2)c(Cl)c1	776076577	NFBGIYDVVWBHJN-SJCJKPOMSA-N	430.914	1.720	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)c1	776540054	PLGDUDDDCWTJSD-UHFFFAOYSA-N	434.430	1.830	50	20	IDGD	
COc1cc(C(=O)CCC(=O)NNc2nc(O)c3cnn(C)c3n2)cc(OC)c1OC	777400004	QYPCWGOEOKHISK-UHFFFAOYSA-N	430.421	1.201	50	20	IDGD	
O=C(CN1CCNC(=O)[C@H]1c1ccc(C(F)(F)F)cc1)NNC(=O)c1cccs1	777713497	JKEYVDLHGJQVQO-OAHLLOKOSA-N	426.420	1.701	50	20	IDGD	
COC(=O)Cc1cccc(C(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)c1	777798114	VAHGXUVFTTUXPD-UHFFFAOYSA-N	434.493	1.746	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)cc(OC)c1OC	778234809	NFVFHQVSNHJXBY-UHFFFAOYSA-N	438.462	1.974	50	20	IDGD	
C[C@H]1CCN(C(=O)OC(C)(C)C)[C@H](C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)C1	778298897	DBJQFNPCOPKJTI-BBRMVZONSA-N	429.481	1.459	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)c2cc(S(=O)(=O)N(C)C)cn2C)cc1F	778673399	AXOFPRQKMBHQDO-UHFFFAOYSA-N	429.499	1.055	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2COCCO2)cc1OCc1cccc(Cl)c1	778710531	IFJUDPGNAQSWQJ-SFHVURJKSA-N	447.875	1.729	50	20	IDGD	
CC(C)(C)OC(=O)N1CC=C(CNC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])CC1	779677897	XGEJOQHEVYSBJY-UHFFFAOYSA-N	449.464	1.871	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)CN2C(=O)N[C@](C)(c3ccccc3OC)C2=O)c1	780793012	PIFICQQYURPSEA-OAQYLSRUSA-N	426.429	1.392	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)C[C@H](C)NS(=O)(=O)c2cccnc2Cl)c1	781035039	WWLGXVZDVVFCEL-NSHDSACASA-N	426.882	1.722	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)ccc1F	782121503	PHAAKTSPFQSRSC-UHFFFAOYSA-N	443.479	1.133	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C(=O)Nc2cnn(-c3ccccc3F)c2)nc2ccccc21	782894137	MKBFUVXIHAPMCM-UHFFFAOYSA-N	435.419	1.227	50	20	IDGD	
C[C@H]1CN(C(=O)Cn2cc(NC(=O)C(=O)NNc3ccc(Cl)cc3)cn2)C[C@H](C)O1	783336005	DFVHSRUVTLVRCF-STQMWFEESA-N	434.884	1.254	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)C(=O)Nc1ccc(OCC2CCCCC2)cc1	784001670	ARQCQBQWGVGSHJ-UHFFFAOYSA-N	442.472	1.755	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1cccc(OC2CCCC2)c1	784004987	MVSHOCSCJNCVJR-UHFFFAOYSA-N	430.486	1.585	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)c2cn(Cc3noc(C)n3)nn2)cc1OC	784741071	LGJGSZWVQWHXLE-UHFFFAOYSA-N	429.437	1.280	50	20	IDGD	
O=C1CN(c2ccc(NC(=O)C(=O)NNc3cc(C(F)(F)F)ccc3F)cn2)CCN1	785166759	KMQYSJQAXYHKCD-UHFFFAOYSA-N	440.357	1.258	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2ccc(OCc3nc(C)no3)cc2)n1	785231205	FRJLYRSLXULUPN-UHFFFAOYSA-N	440.464	1.675	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1ccnn1-c1cccc(F)c1	785330415	GZWOLVKWMYAJPM-UHFFFAOYSA-N	447.448	1.505	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1cccc(N2CCCC2=O)c1	785331183	PQAGPZIHQFNQKS-UHFFFAOYSA-N	446.485	1.307	50	20	IDGD	
C[C@H]1[C@H](C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)CCN1C(=O)OC(C)(C)C	786368533	LYIZIPRSMAOVFR-XJKSGUPXSA-N	430.461	1.508	50	20	IDGD	
Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)NNC(=O)CNC(=O)OC(C)(C)C	786540572	BLCGDTVNGUKJDZ-UHFFFAOYSA-N	431.243	1.951	50	20	IDGD	
Cc1ccc(NC(=O)COC(=O)/C(C#N)=C\C2CC2)cc1S(=O)(=O)N1CCOCC1	786680815	NRWUYOZJJQNZKH-YBEGLDIGSA-N	433.486	1.358	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)C(=O)Nc1ccc(Oc2ccccc2F)nc1	787554797	HZNCRIPLUWBTGG-UHFFFAOYSA-N	441.375	1.122	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCc2ccccc2)cc1C(=O)NNC(=O)N1CCN(C)CC1	788166505	OAJQMOGRTZRNLD-UHFFFAOYSA-N	445.545	1.075	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C2CCN(c3oc(C)nc3C#N)CC2)c2ccccc2c1=O	788620258	BQOHFACBVSLZPT-UHFFFAOYSA-N	449.471	1.262	50	20	IDGD	
CCNC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)COc2ccc(C)cc2)c1C	789733036	UUUOKCAXWORBHM-UHFFFAOYSA-N	427.461	1.610	50	20	IDGD	
O=C(NNS(=O)(=O)c1cccc(S(=O)(=O)N2CCCCCC2)c1)NC1CCCC1	790391376	IKBRUUNEZDAXJX-UHFFFAOYSA-N	444.579	1.686	50	20	IDGD	
CC(C)(COc1cc(Cl)cc(Cl)c1)C(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1	790489360	BQFAVVHMVXYSDW-LBPRGKRZSA-N	438.333	1.916	50	20	IDGD	
CC(C)NC(=O)NC1(C(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)CCCCC1	792294788	PRFDQOIBJIPWQS-UHFFFAOYSA-N	437.928	1.514	50	20	IDGD	
Cc1ccc2c(c1)CC[C@@H](C(=O)NNC(=O)c1ccc(S(=O)(=O)N3CCCC3)cc1)O2	792805580	KKEJWSPTKJRAAL-FQEVSTJZSA-N	443.525	1.934	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(N(C)C)c(NC(=O)C(=O)NCCSSC)c1	793078676	PNESINXZLAEXPZ-UHFFFAOYSA-N	448.636	1.849	50	20	IDGD	
CSCCNC(=S)NNC(=O)c1cccc(NN2C(=O)[C@H]3CC=CC[C@H]3C2=O)c1	793764043	FWDWYDYZSMEOFV-GASCZTMLSA-N	433.559	1.437	50	20	IDGD	
CCOC(=O)c1cc(Br)cc(S(=O)(=O)NNC(=O)c2cccc(C)n2)c1	794598625	KEKZIBKMQUYPSK-UHFFFAOYSA-N	442.291	1.953	50	20	IDGD	
CCNC(=O)N(C)c1cccc(NC(=O)C(=O)NNC(=O)COc2cccc(C)c2)c1	796992675	VKOHTACAXCVFSP-UHFFFAOYSA-N	427.461	1.326	50	20	IDGD	
CNC(=O)COc1ccc(NC(=O)C(=O)NN=c2sc3ccccc3n2C)c(C)c1	797048083	ZVJONJWQVUCRKI-UHFFFAOYSA-N	427.486	1.244	50	20	IDGD	
COC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2cc(OC)cc(OC)c2)c1C	798041999	JPBYDFPJISDJFL-UHFFFAOYSA-N	430.417	1.590	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cnn3cc(Br)cnc23)cc1C	798307883	IQNXYSVOAPRJSH-UHFFFAOYSA-N	431.250	1.508	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2nn(-c3cccc(C)c3C)cc2O)n1	801419151	YBFAZVKGTDTGBF-UHFFFAOYSA-N	443.485	1.507	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)c1ccccc1S[C@@H](C)C(N)=O	801490349	LINXLTPQRSFRAV-AWEZNQCLSA-N	429.498	1.508	50	20	IDGD	
CCCCS(=O)(=O)NCC(=O)NNC(=O)Nc1ccc(Br)cc1Cl	802039924	BDVGBXCBWAICMA-UHFFFAOYSA-N	441.735	1.975	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)[C@](C)(O)Cn2c(C)cccc2=O)c(OC)cc1Cl	802078303	LFSINABKQUXHBE-LJQANCHMSA-N	438.868	1.431	50	20	IDGD	
COc1ccc(Cl)c(NC(=O)NNC(=O)C2=NN(c3ccccc3)[C@@H](C(N)=O)C2)c1	802111703	POMIKRVXELVZGN-MRXNPFEDSA-N	430.852	1.622	50	20	IDGD	
COc1cc(C)nc(NNC(=O)NCCNS(=O)(=O)c2ccc(F)cc2Cl)n1	802433059	MJBPCBOAGSAMOR-UHFFFAOYSA-N	432.865	1.191	50	20	IDGD	
O=C(CN1C(=O)N[C@@]2(CCc3ccccc32)C1=O)NNC(=O)c1cc(Cl)ccc1O	802586165	WCHAMPRYUIKUSI-HXUWFJFHSA-N	428.832	1.200	50	20	IDGD	
CC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)ccc1F	806979360	RJPMFFMQTRTXFI-UHFFFAOYSA-N	427.367	1.957	50	20	IDGD	
COC(=O)c1cc(Br)c(OC)cc1NC(=O)C(=O)NNc1ccnc(F)c1	807013691	ZPTHDSXBTPQCEF-UHFFFAOYSA-N	441.213	1.860	50	20	IDGD	
C[C@H]1CSC[C@@H]1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	807478597	VCHFVBAQAUWROF-BBRMVZONSA-N	426.564	1.557	50	20	IDGD	
CC(C)Oc1ccc([C@H](CNC(=O)NNC(=O)CNC(=O)c2ccco2)N(C)C)cc1	807589872	ZCYAOOVLRIAMNW-KRWDZBQOSA-N	431.493	1.430	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)NCc2ccncc2OC[C@@H]2CCOC2)cc1	807615223	FYRXMPBGJAHFEY-MRXNPFEDSA-N	425.445	1.278	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCCC[C@H]2COC(=O)NC2CC2)cc1OC	810038272	QRLQLOOHXHIJQY-INIZCTEOSA-N	434.493	1.208	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2cc(C)c(F)cc2C(=O)NCC(F)(F)F)nc(C)n1	810393227	OASCLSSIHQKFSE-UHFFFAOYSA-N	442.373	1.915	50	20	IDGD	
COC(=O)Cc1cccc(S(=O)(=O)NNC(=O)c2ccc(OC(C)C)c(OC)c2)c1	811677655	FWXUUNDCPWZGLE-UHFFFAOYSA-N	436.486	1.821	50	20	IDGD	
Cc1nn(C)c2cc(NC(=O)C(=O)NNC(=O)c3cc(Br)cn3C)ccc12	812979522	WGMTZQPGMDEXSC-UHFFFAOYSA-N	433.266	1.382	50	20	IDGD	
CCOC(=O)c1ccccc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	813033941	SDDMWQXDACYCCQ-UHFFFAOYSA-N	434.474	1.195	50	20	IDGD	
COc1cc(CNC(=O)NNC(=O)c2cc(Br)c[nH]2)cc(OC)c1OC	813533286	SMXAPRYBOZGSPW-UHFFFAOYSA-N	427.255	1.947	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N1CC[C@H](CS(C)(=O)=O)C1	814271472	MXYAZGDQIMDMKZ-NEPJUHHUSA-N	448.339	1.324	50	20	IDGD	
O=C(NNc1cccnn1)C(=O)Nc1ccc([N+](=O)[O-])c(I)c1	815601752	DYMWWTKIVDPPQS-UHFFFAOYSA-N	428.146	1.071	50	20	IDGD	
Cc1ccc([C@](O)(CC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)C(F)(F)F)o1	818645912	GSFWIMYJLKRBPK-GOSISDBHSA-N	438.362	1.436	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)N2CCN(C(=O)CN3CCOCC3)CC2)c(C)n1CC(C)C	827867300	VXDJOLXTBLBMFT-HYARGMPZSA-N	441.576	1.671	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)c1csc(N2CCOCC2)n1)N1CCc2ccccc2C1	914533166	CIVLSQARSYQQKJ-OAHLLOKOSA-N	444.561	1.371	50	20	IDGD	
CCOC(=O)c1cnn(-c2ccc(C(=O)N([C@@H]3CCS(=O)(=O)C3)N(C)C)cc2)c1C	915141661	UWVZKEAFPJBTRV-QGZVFWFLSA-N	434.518	1.463	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)Cn1cnc2ccc(Br)cc2c1=O	915597181	SKHCDNGOPVLWDP-UHFFFAOYSA-N	433.237	1.688	50	20	IDGD	
CC(C)NC(=O)C(=O)NNC(=O)c1cccc(NC(=O)c2ccc(Br)o2)c1	916041057	VJWRWCCNRQADDU-UHFFFAOYSA-N	437.250	1.580	50	20	IDGD	
Cc1cc(=O)oc2cc(OCC(=O)NNC(=O)C3CCN(c4ncccn4)CC3)ccc12	916111607	OUGSBHCYYFVCTD-UHFFFAOYSA-N	437.456	1.334	50	20	IDGD	
O=C(NCCNS(=O)(=O)c1cccc(Cl)c1)NNC(=O)c1cc2c(s1)CCC2	916295195	MLRKAZOZSWMXFF-UHFFFAOYSA-N	442.950	1.813	50	20	IDGD	
CC(=NNC(=O)COc1ccc(C#N)cc1)c1ccc(S(=O)(=O)N2CCNCC2)cc1	916300230	UJGVFBJVQVMEJC-UHFFFAOYSA-N	441.513	1.071	50	20	IDGD	
CCCC(=O)Nc1cccc(CNC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c1	916514025	MPABRUZGAAHABW-UHFFFAOYSA-N	432.502	1.973	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CC(=O)N(C2CCCC2)C1)c1cccc(S(=O)(=O)N2CCCC2)c1	916556386	YDGYGEROQMYHBV-MRXNPFEDSA-N	448.545	1.023	50	20	IDGD	
CN(C)N(C(=O)[C@@H]1CC(=O)N(c2cc(Cl)cc(Cl)c2)C1)[C@@H]1CCS(=O)(=O)C1	919988103	LETGBHXMCYJOMB-BXUZGUMPSA-N	434.345	1.839	50	20	IDGD	
O=C(NC[C@H](c1cccc(F)c1)N1CCOCC1)NNc1ccc(-n2cccn2)nn1	921248010	PHRFMJFGCZBGNL-QGZVFWFLSA-N	426.456	1.501	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)c1cccc(N2CCNC2=O)c1	1248688181	MCHALOGMAPTMLX-UHFFFAOYSA-N	433.262	1.819	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNS(=O)(=O)c2ccc3c(c2)C(=O)OC3)CC1	1318903053	FTAKNCBXGSPTMH-UHFFFAOYSA-N	439.490	1.314	50	20	IDGD	
O=C(NNS(=O)(=O)c1cnc(Cl)cc1Cl)C1CCN(c2ncccn2)CC1	1319994082	OEQQOFTYZPEZTL-UHFFFAOYSA-N	431.305	1.405	50	20	IDGD	
Cn1nc(C(C)(C)C)cc1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	1320236478	ZDHOZJZHWVQFDW-UHFFFAOYSA-N	448.549	1.969	50	20	IDGD	
CSC1(CNC(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)CCN(C)CC1	1323986228	RJINULKUABZQCH-UHFFFAOYSA-N	443.614	1.791	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cnc3ccccc3n1)CCO2	1779295409	NAUOJVAYHAFWJG-NRFANRHFSA-N	428.565	1.925	50	20	IDGD	
O=C(c1nc(O)n2c1CCCC2)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1779348677	ZPQMMXYASDHOIW-SUMWQHHRSA-N	445.289	1.059	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cn3[nH]cnc(=O)c3c1C)C2	1780706531	WXHRFINRZXHGTB-WHSLLNHNSA-N	449.939	1.476	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)ccc1O)C2)[C@@H](F)Br	1780777184	SQDPRKIDVPHAGE-IIDMSEBBSA-N	445.285	1.916	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(OC)c(OC)c3O)CCO2)C1	1781216261	BYRIHHFDHOIMKM-XOBRGWDASA-N	426.897	1.870	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)[C@@H](CN)c3ccccc3)CCO2)C1	1781227414	LDAAUXIGZJMEKV-VDGAXYAQSA-N	428.360	1.795	50	20	IDGD	
COc1cccnc1CCC(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781325414	CWRDUXQHTAJSPT-SJLPKXTDSA-N	444.301	1.543	50	20	IDGD	
Cc1ccc(CCC(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)nc1	1781325735	IDZQNKYMIFYQEO-SJLPKXTDSA-N	428.302	1.843	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(CCN(C(=O)c3c(F)ccc(O)c3F)C2)C1	1781929808	KQKSVBVUXDPKAL-KRWDZBQOSA-N	433.249	1.899	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ncc(OC)cc1F)C2	1782170829	AJGVGXKBAJIIKO-AKCHCHLHSA-N	443.903	1.611	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1ccc3ncnn3c1)C2)C(Cl)Cl	1782219321	RICMZUDVHNZLDW-AUUYWEPGSA-N	440.331	1.589	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cnnc(Cl)c3)CCO2)C1	1783345199	YGZKAYZGZLKAPF-MLGOLLRUSA-N	431.718	1.747	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)CNC(=O)OC(C)(C)C)C2)C1	1783401303	MCZLWSVOKVRWKC-SJCJKPOMSA-N	434.331	1.124	50	20	IDGD	
C[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)CBr)C[C@@H]21)C1(O)CCC1	1783509650	VRQQJSCICAEHDR-QRJUGERDSA-N	431.371	1.548	50	20	IDGD	
COc1cccc(CCC(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](C)Br)C3)C2)n1	1783529206	GOOPEZBGCWGQIM-KUHUBIRLSA-N	440.338	1.636	50	20	IDGD	
COc1ccc(CCC(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](C)Br)C3)C2)cn1	1783529284	HJFJUQHTUZJDDE-LIRRHRJNSA-N	440.338	1.636	50	20	IDGD	
COc1ccc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)C(Cl)Cl)C[C@@H]32)cc1O	1783786468	ZOCYXDOXAWVSMB-XEZPLFJOSA-N	431.316	1.727	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(C(F)(F)F)nc3)CCO2)C1	1783877156	VQRIUJGJXHHTJD-GUYCJALGSA-N	435.830	1.798	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(OC)c(N(C)C)c3)CCO2)C1	1783880545	JYLCMIWLYSJQFA-KKSFZXQISA-N	439.940	1.459	50	20	IDGD	
CN(C)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21	1785757198	PTQGRECSPCIFIH-QRTARXTBSA-N	439.354	1.526	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)c3ccccc3)[C@H]2C1	1786664849	ZAZPGWKNXFJVRU-QSGXVVIFSA-N	439.350	1.731	50	20	IDGD	
COc1cccc(C(=O)Nc2ccc(C3(NC(=O)c4cccc(B(O)O)c4)CCC3)cc2)n1	1787199132	HQRKHKVHRQBDOA-UHFFFAOYSA-N	445.284	1.832	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3(F)CCCCC3)[C@H]2C1	1788167917	PURMHRUBQCSNGO-ULQDDVLXSA-N	426.533	1.012	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)Cn3cncn3)[C@H]2C1	1788728014	XJGVMFADNLIMDI-CWVYHPPDSA-N	442.358	1.067	50	20	IDGD	
CC(C)(C)n1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Br)C[C@@H]32)nn1	1789356166	CTZIISQYFYOOCW-AUZPSNTRSA-N	446.321	1.317	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)ccc3O)C[C@@H]21	1789871750	IYTHYVKTLAYUKS-FUELBLBUSA-N	431.316	1.927	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc(F)cn3)C[C@@H]21)[C@H](F)Br	1789923110	YNNQUQOWTZHEMV-CFMVVWHZSA-N	432.265	1.433	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccn4nccc34)C[C@@H]21)[C@H](F)Br	1789925554	RDJNRLNVGHSHCE-MZGVZZPPSA-N	439.285	1.618	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3c(F)cc(OC)cc3F)[C@H]2C1	1790106013	SUDQQSGXUPOOFT-DPYKFYPSSA-N	446.878	1.821	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)c1ccccc1N1CCCCC1	1790254928	PJVQXROAUVVPOY-YRLHULLVSA-N	449.979	1.870	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc4ccc(F)cn34)C[C@@H]21	1791257295	XEHLJUFLNGXBRA-QEWYBTABSA-N	438.887	1.321	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1ccc(C2(NC(=O)c3cccc(=O)n3C)CCC2)cc1	1791599751	UIIKFWGNHNCECN-UHFFFAOYSA-N	439.516	1.506	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(F)cc3OC)[C@H]2C1	1791886781	UQTDXVIQMAINKQ-PTOXDTDZSA-N	428.888	1.681	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccc(C#N)cc1	1792556343	HOLAUQRUUABNJC-KUZCPNRJSA-N	434.334	1.721	50	20	IDGD	
CC(C)N[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)CBr)C(C)C	1792867781	KVHSHGIEOHTLBO-NQNKBUKLSA-N	432.403	1.630	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCl)C1=C2c3ccccc3C(=O)N2CC1	1793113461	KZASJWNGASIRQW-AHXJXLJNSA-N	429.904	1.495	50	20	IDGD	
CC(C)N1CCC(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Br)C3)CC1	1793799673	SCMWAOSMQXFOOE-FZKCQIBNSA-N	434.350	1.387	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ncccn1)C2	1794141101	KSRHZEREFVMMHR-XGUBFFRZSA-N	437.928	1.861	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cncn1C	1795206368	NCPHXMKOYISPHN-QDMKHBRRSA-N	441.444	1.819	50	20	IDGD	
Cc1ccc(=O)n(C(C)(C)C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CCBr)n1	1795493315	BQHPTJQCLICWOR-QDMKHBRRSA-N	439.354	1.710	50	20	IDGD	
Cc1ccccc1NCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnccc1C(=O)NN)C2	1796151959	PFNWKBZFEHNULU-BJWYYQGGSA-N	436.516	1.357	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cn(C)nc1C(F)F	1796705166	HUJQAQSHFHGIKT-MWGHHZFTSA-N	435.269	1.344	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](C)N1C[C@H]3C[C@@H]3C1)C2	1796892057	XMLFBKLOJDHTSF-NYYKCLMLSA-N	440.548	1.099	50	20	IDGD	
Cn1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Br)C3)c2cccnc21	1797577888	JTLVNHCRYNOVJL-BAESOJJISA-N	439.285	1.467	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(C(F)(F)F)[nH]1)c1cccc(B(O)O)c1	1798663890	UZPZMSVRTKMUDN-QDMKHBRRSA-N	435.211	1.279	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3n(n1)CCCO3)C2	1799277133	SCRNEYTYNSBMNN-ABXQLRGKSA-N	431.320	1.105	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CCc3ccoc3C1)C2)[C@@H](F)Br	1799343143	OOCPYHKMACZWKG-CNRIWFPOSA-N	429.286	1.665	50	20	IDGD	
Cc1cc(Br)ccc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2	1799499264	NKQAEETVGCRGKG-VZAMPYOESA-N	445.741	1.560	50	20	IDGD	
Cc1ccc(C)n1-c1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](O)CCl)C3)cc1	1799620545	ZQLMLIVAKUSVRR-YHELAOLJSA-N	445.947	1.897	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COCc1ccccc1)C2	1800755990	CULJTYAWOTWWNF-NYCLONFESA-N	425.323	1.576	50	20	IDGD	
C[C@H](CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(B(O)O)cc1)C2)Oc1ccccc1	1801450509	ZENKRFFFRYVNNH-RZXSNQJFSA-N	436.317	1.476	50	20	IDGD	
C[C@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](C)[C@@H]1SC(=N)NC1=O)C2	1801961191	FXXQDFUZTWMCCM-UQPICLANSA-N	431.356	1.210	50	20	IDGD	
COc1ccc2[nH]cc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)CCC(=O)NN(C)C)c2c1	1802337058	FBEZLVFCPXLMKJ-MUJYYYPQSA-N	441.532	1.801	50	20	IDGD	
CC(=O)NCCC(=O)N1CC[C@H](CNC(=O)[C@H](C)CBr)[C@@H]1c1cccnc1	1803013759	ACUMEWXASCJLRC-QBIMZIAESA-N	439.354	1.645	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cc3cccnn3c2)[C@H]1c1cccnc1)[C@H](O)CCl	1803148849	XXXLMVCROIGMQS-IPELMVKDSA-N	427.892	1.649	50	20	IDGD	
COCCOCC(=O)NC[C@@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1	1806757869	VYXWCLWYDNAODL-MAUKXSAKSA-N	428.327	1.535	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CC2CCCC2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1	1807371656	WZEHDWOOKWAIJA-REWPJTCUSA-N	435.333	1.661	50	20	IDGD	
Cc1c[nH]cc1C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1807375526	PVRYLPUYXRCQHX-NQIIRXRSSA-N	432.289	1.031	50	20	IDGD	
Cc1noc(C)c1C(=O)N1CCCC2(CCN(C(=O)c3ccc(B(O)O)cc3)CC2)C1	1808220440	WNXCCFUZSFQRCS-UHFFFAOYSA-N	425.294	1.130	50	20	IDGD	
C#CCCC(=O)N1CC[C@@H](CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@@H]1c1cccnc1	1808420879	ATPIYQFDQXWARO-YCYMQERHSA-N	434.500	1.635	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)COCCO)[C@H]1c1cccnc1	1808626980	APVLVHOAEMRUPW-YQQAZPJKSA-N	428.327	1.270	50	20	IDGD	
Cc1noc(CC(=O)N2CC[C@H](CNC(=O)[C@@H](F)Br)[C@H]2c2cccnc2)n1	1808661371	KAMPMMCXRUNADH-DAXOMENPSA-N	440.273	1.712	50	20	IDGD	
O=C(/C=C/c1ccsc1)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1	1809969645	YSURWWLBZRKESE-FARCUNLSSA-N	438.358	1.986	50	20	IDGD	
CCc1ncccc1C(=O)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1	1809974859	CDDVQRMGQKGYFV-UHFFFAOYSA-N	435.333	1.482	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H](CNC(=O)C2=NNC(=O)C2)[C@H]1c1cccnc1	1810224171	CBHYYZMKRJUPCF-DVOMOZLQSA-N	436.310	1.137	50	20	IDGD	
C[C@H](Cn1cncn1)C(=O)NC[C@H]1CCN(C(=O)CO[Si](C)(C)C)[C@H]1c1cccnc1	1810476045	BLFXWQBJTUXXLB-POAQFYNOSA-N	444.612	1.867	50	20	IDGD	
COc1cc(C(=O)N2CC[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]2c2cccnc2)n(C)n1	1810541885	WUOGCWUZSAKEEU-OXJNMPFZSA-N	445.596	1.995	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)CCn2cncn2)[C@H]1c1cccnc1	1812778761	LNDPVOICOGEKQA-BQFCYCMXSA-N	449.353	1.943	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1	1812808437	PCUNHYPWOROQRB-ZOBUZTSGSA-N	440.928	1.212	50	20	IDGD	
CCc1nc(C(=O)N2CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)co1	1813074608	UOVVYOJQHUBHGJ-IIBYNOLFSA-N	442.520	1.325	50	20	IDGD	
Cn1cc(CC(=O)NC[C@@H]2CCN(C(=O)[C@@H](F)Br)[C@@H]2c2cccnc2)cn1	1813458815	AEJLHVMEXSFMAK-USXIJHARSA-N	438.301	1.754	50	20	IDGD	
Cn1cc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)[C@@H](O)CCl)n[nH]2)c(C(F)F)n1	1814871022	HZBMMDQUPHPJIY-RYUDHWBXSA-N	430.843	1.986	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2nc(O)n3c2CCCC3)[nH]n1)[C@H](O)CCl	1814872349	HDEWEEGDICDORT-GXTWGEPZSA-N	436.900	1.554	50	20	IDGD	
C[C@H]1CC[C@H](C(=O)N[C@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)CC1	1815361570	KIKFKQZIGVZVMI-ZQIUZPCESA-N	441.362	1.875	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H]2C[C@@H]2F)n[nH]1	1815513650	WECNMUMNUGJOBS-SGZUGYNTSA-N	429.456	1.894	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccno2)n[nH]1	1816440396	LNQOCZOGYOEPGI-ZWGXDWAISA-N	438.448	1.838	50	20	IDGD	
CNC(=S)NCCC(=O)N1CCCC[C@H]1c1cc(NC(=O)CCBr)n[nH]1	1816781860	HNGOWQFISJSTRZ-LBPRGKRZSA-N	445.387	1.671	50	20	IDGD	
CC[S@](=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCBr)CC2	1819508030	LYSQJCKPSMJFJT-JUZXBQNTSA-N	436.397	1.999	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2coc(Cl)n2)[nH]n1	1822410938	STBSMNOFNGBVTB-ZDUSSCGKSA-N	437.888	1.730	50	20	IDGD	
O=C(CCN1CCOCC1)N[C@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1	1823002799	GJFOZCMPDUMOBG-IINYFYTJSA-N	449.346	1.468	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CN2CC(=O)NC2=O)CC1	1824973500	STBPQMAQXMHMOS-LIRRHRJNSA-N	447.363	1.394	50	20	IDGD	
Cn1ccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)c1	1825724947	YWMHHZKFTXVERX-HXUWFJFHSA-N	438.532	1.571	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1nc(C)c(C)[nH]c1=O)CC2	1825992994	BUNYFXXEMZELJW-WDEREUQCSA-N	439.925	1.323	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H]1C[C@]1(F)Cl)CC2	1826090136	WPQYIODXFCNAKP-VHCOLVSPSA-N	431.921	1.353	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](C)n3cnnn3)sc2C1	1826985026	PNFJZAMUEHCIBQ-XHNCKOQMSA-N	428.316	1.086	50	20	IDGD	
CN1CCCC[C@@H]1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827056439	ZRESNRXZXQJSHN-FCHUYYIVSA-N	441.381	1.084	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H](F)Br)CC1	1827566447	GGQFYZIJNJCHSJ-BFHYXJOUSA-N	435.338	1.744	50	20	IDGD	
CCOC(=O)N[C@@H](O)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CO[Si](C)(C)C)CC1	1828760548	CPMYDQXQWGRGAW-WMZOPIPTSA-N	443.617	1.522	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](O)N2CCOCC2)CC1	1828969641	WYEZGRADQILAIY-AZUAARDMSA-N	441.645	1.108	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)CN2CC(=O)NC2=O)CC1	1829097239	FFKXHSOWLXVJAM-MRXNPFEDSA-N	438.601	1.009	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(=O)n3[nH]cnc3n2)CC1	1830305868	FEHOKBGFBCJXKN-GDBMZVCRSA-N	434.928	1.668	50	20	IDGD	
CN[C@H](CC(=O)N1CCC([C@H]2CCCCN2C(=O)[C@](C)(Cl)CCl)CC1)C(=O)O	1830317645	WQBKIJUJADHSJF-SPYBWZPUSA-N	436.380	1.905	50	20	IDGD	
C=C(C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)CBr)CCO2)C(F)(F)F	1830544501	ZTLPUMOVZWECMN-ABAIWWIYSA-N	443.260	1.592	50	20	IDGD	
O=C(CCCc1ccccc1F)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1830719487	DZIGPAYFPUVTBD-RXVVDRJESA-N	442.915	1.205	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)Oc3ccccn3)C2)C1	1831657420	OGJSQVOEDZQKAQ-FIKGOQFSSA-N	439.940	1.713	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CN2CCN(C)CC2)CC1	1831830535	DUQPQBYIDUZMND-OALUTQOASA-N	429.005	1.107	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(F)(F)C(F)F)CCO2	1832183864	XZGOCXIQXZOWRF-IINYFYTJSA-N	449.239	1.374	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cc(C4CC4)on3)CC2)CC1	1833179454	YDPKRDVCDFEZDR-KRWDZBQOSA-N	438.956	1.991	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnccc3N(C)C)CCO2)C1	1833660413	ZDNBZXCFFVZFRK-UWJYYQICSA-N	438.956	1.625	50	20	IDGD	
C[C@H](Cc1ccco1)C(=O)N1CCOC[C@@]2(CN(C(=O)CCBr)CCO2)C1	1834826687	TWMJEDZTEHASSW-DNVCBOLYSA-N	443.338	1.700	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3nnc(C)s3)CCO2)C1	1836076633	MJQBTYLQABMUIN-KBXCAEBGSA-N	430.958	1.253	50	20	IDGD	
CC[C@H](NC(C)=O)C(=O)N1CCC(OC2CCN(C(=O)CO[Si](C)(C)C)CC2)CC1	1836578120	KGBXRAZEUUSEFU-IBGZPJMESA-N	441.645	1.751	50	20	IDGD	
O=C(c1nccc2nc[nH]c12)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836717799	KJGMGRYLEXYBIF-MRXNPFEDSA-N	435.912	1.170	50	20	IDGD	
O=C(c1cnc(Cl)c(Cl)c1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1837915405	GKYDQPFZFSYYMN-BLLLJJGKSA-N	440.686	1.993	50	20	IDGD	
CS(=O)(=O)CCC(=O)N1CCC(OC2CCN(C(=O)C(Cl)Cl)CC2)CC1	1838790989	RSYWQPMULWKEEY-UHFFFAOYSA-N	429.366	1.223	50	20	IDGD	
COc1cccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)c1	1838929399	LOFCQVRXZZVBML-LIRRHRJNSA-N	441.322	1.549	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3snnc3C3CC3)C2)C1	1839144917	OHXVYTGRIUEGAK-FZKQIMNGSA-N	428.942	1.503	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCCn3ccnc3)C2)C1	1839154908	BQBPGAVDSWTFLE-RBUKOAKNSA-N	447.363	1.356	50	20	IDGD	
C=C[C@H](O)C(C)(C)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H](Br)CC)CCO2)C1	1839965001	KNPAKIMNHISJEI-DOXZYTNZSA-N	447.370	1.189	50	20	IDGD	
O=C(c1cc2sccn2c1)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840187506	FTSAOOXYVCSRFP-QGZVFWFLSA-N	432.329	1.875	50	20	IDGD	
O=C(c1ccc2nccn2c1)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840188516	NWEKCTIKMYWUDS-SFHVURJKSA-N	427.288	1.208	50	20	IDGD	
O=C(C(Cl)Cl)N1CCO[C@@]2(COCCN(C(=O)C3Cc4ccccc4C3)C2)C1	1840190484	ZSNBWRQISJOFTN-HXUWFJFHSA-N	427.328	1.662	50	20	IDGD	
C[C@@H](Sc1ccccn1)C(=O)N1CCOC[C@@]2(CN(C(=O)C(Cl)Cl)CCO2)C1	1840190731	KHYFUOOWTUSWTM-ACJLOTCBSA-N	448.372	1.822	50	20	IDGD	
C[C@H](Br)C(=O)N1CC2(CCCN2C(=O)c2cccnc2CS(C)(=O)=O)C1	1842241325	IMEOPJANUOMYHS-LBPRGKRZSA-N	444.351	1.227	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H]1CCC(=O)N1CCCC12CN(C(=O)[C@H](O)CCl)C2	1843949332	PCKZLIOHBHBNSC-HZPDHXFCSA-N	443.972	1.969	50	20	IDGD	
O=C1CSc2ncc(C(=O)N3CCCC34CN(C(=O)[C@H](F)Br)C4)cc2N1	1845670050	SRQAHGSGEUJHSD-LBPRGKRZSA-N	443.298	1.633	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)/C=C/c2cccc(O)c2)C1	1846039010	RBWYXOQBHIREKS-IVTGQKOESA-N	435.484	1.743	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)CCc2nc(-c3ccncc3)no2)c2ccccc2c1=O	14222470	JHEBCFDRAYIUBU-UHFFFAOYSA-N	447.455	1.816	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(C(=O)NNC(=O)c2ccccc2F)ccc1Br	15794688	HZPLKCPFFCKSFB-UHFFFAOYSA-N	444.282	1.913	50	20	IDGD	
Cn1ccnc1SCc1ccc(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)o1	105833825	YXAYOKNHWXQYQI-UHFFFAOYSA-N	448.530	1.673	50	20	IDGD	
Cc1nc2cc(F)ccc2cc1C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	115377926	VFDDTPLKMHGDMV-LJQANCHMSA-N	439.399	1.827	50	20	IDGD	
O=C(NNc1nc(-c2ccncc2)no1)[C@@H]1CCCN(S(=O)(=O)c2ccccc2)C1	726377195	OMWMWSWZMOVNEU-OAHLLOKOSA-N	428.474	1.676	50	20	IDGD	
Cn1c(SCC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)nnc1-c1cccs1	726767912	CAZZXCLTRCVOGF-UHFFFAOYSA-N	441.502	1.073	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cn1	726892153	FYUDBMVQWBASGE-UHFFFAOYSA-N	435.531	1.506	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)NCc2cccc(CS(N)(=O)=O)c2)c1C	727109660	GDVHNCOFMNQRNS-JAIQZWGSSA-N	430.530	1.763	50	20	IDGD	
O=C(CCC/N=C1/NS(=O)(=O)c2ccccc21)NNC(=O)CCCc1ccccc1	727741290	NUPGBZHKQJVNHI-UHFFFAOYSA-N	428.514	1.676	50	20	IDGD	
CC(=O)Nc1ccc(NS(C)(=O)=O)c(C(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)c1	728150697	BNJWEHYPPNAKHD-UHFFFAOYSA-N	448.545	1.994	50	20	IDGD	
CCCCNC(=O)NNS(=O)(=O)c1ccc(S(=O)(=O)N2C[C@@H](C)C[C@H](C)C2)cc1	728263260	WIFWXMQRJDLCRW-GJZGRUSLSA-N	446.595	1.646	50	20	IDGD	
O=C(CCc1nc2ccccc2n1-c1ccccc1)NNC(=O)[C@@H]1CCS(=O)(=O)C1	728370743	BFZRLBWGUKVKTG-OAHLLOKOSA-N	426.498	1.540	50	20	IDGD	
O=C(NNc1ccc(Cl)cc1Cl)C(=O)Nc1cnn(CCN2CCOCC2)c1	728535363	HBHYVDBSIOHXTR-UHFFFAOYSA-N	427.292	1.604	50	20	IDGD	
COc1cc(CC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc(OC)c1OC	728844650	ADYXBLYNMYYMBV-UHFFFAOYSA-N	429.477	1.109	50	20	IDGD	
NC(=O)c1csc(C(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)c1	729298428	GIIZXLPJHLGCTQ-UHFFFAOYSA-N	447.476	1.680	50	20	IDGD	
O=C(COc1ccccc1Cc1ccccc1)NNC(=O)NC[C@H]1CN2CCC[C@@H]2CO1	729620139	WKYZHQWOCFPCGL-RTWAWAEBSA-N	438.528	1.850	50	20	IDGD	
Cc1cc(C)n(CC(=O)NN=C2CCS(=O)(=O)c3ccc(Br)cc32)n1	729817333	YXBVKERTAXUTHP-UHFFFAOYSA-N	425.308	1.960	50	20	IDGD	
Cn1nc(SCC(=O)NN=Cc2c(OC(F)F)ccc3ccccc23)c(=O)n(C)c1=O	730569105	NLCJAWVIOOUBGC-UHFFFAOYSA-N	449.439	1.476	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)NC[C@@H](c1ccccc1Cl)N1CCOCC1	730820390	HGGSKYWNBMXICL-KRWDZBQOSA-N	448.907	1.828	50	20	IDGD	
O=C(COC(=O)c1csc(-c2ccoc2)n1)NNC(=O)[C@H]1COc2ccccc2O1	731090809	IRRFHKCYGDKXFP-OAHLLOKOSA-N	429.410	1.547	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNS(=O)(=O)c2cccc(C(=O)OC)c2C)cc1	731181635	URTYNOGUZCINOT-CQSZACIVSA-N	436.486	1.957	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)Cc1ccccc1F)N1C(=O)c2ccc(Br)cc2C1=O	731330252	GMXSKRUFBHWBNJ-JTQLQIEISA-N	448.248	1.963	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(C)s2)C1	731491764	VABZUXVBVDOSRQ-CQSZACIVSA-N	437.543	1.927	50	20	IDGD	
CN(C)C(=O)CN1CCC(NC(=O)NNC(=O)c2ccc(Br)s2)CC1	731762148	GDKHQQCZUDSLHB-UHFFFAOYSA-N	432.344	1.007	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)C2CCN(C(=O)OCc3ccccc3)CC2)C[C@@H](C)O1	732262058	IIAWSXANGVALNM-HDICACEKSA-N	446.548	1.682	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cnn(-c3ccccc3C)c2)cc1OC	732682775	QEFROACOGPUCJF-UHFFFAOYSA-N	438.440	1.816	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCCC(=O)Nc2ccccc2)nc1	733653309	FSILHZPGGXKTGS-UHFFFAOYSA-N	434.522	1.767	50	20	IDGD	
C#CCOc1ccccc1CNC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1	734217082	CCKQXFUUUXWZLE-UHFFFAOYSA-N	444.513	1.158	50	20	IDGD	
Cn1ncc2c(O)nc(CCC(=O)NNc3ccccc3S(=O)(=O)NC(C)(C)C)nc21	734251864	QISDQKXDCZVBMY-UHFFFAOYSA-N	447.521	1.222	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NCC(=O)NNc2cc(F)c(F)cc2F)c1	734552655	ZLBGMBXJSVKMAV-UHFFFAOYSA-N	430.408	1.227	50	20	IDGD	
C[C@@H]1CCCC[C@@H]1OCC(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	735117564	XQZMTQHIPXSLIT-CVEARBPZSA-N	425.555	1.056	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)c2ccc(-n3cnnn3)c(C)c2)cc1C	736774672	HASQEWILAQNMHS-UHFFFAOYSA-N	428.474	1.521	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccccc2)C1	737637081	MEYYIVKLYUKXDE-GOSISDBHSA-N	431.514	1.452	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)CC[S@](=O)c2ccc3c(c2)OCCO3)cc1C	740749346	VUGCULHJGJSWBQ-PMERELPUSA-N	432.498	1.799	50	20	IDGD	
O=C(NCc1cccc(C(F)(F)F)c1)NNC(=O)[C@@H]1CC(=O)N(Cc2ccccn2)C1	742452805	GDMZRRBKXWPCDW-CQSZACIVSA-N	435.406	1.980	50	20	IDGD	
O=C(CCN1C(=O)[C@H]2[C@H](C1=O)[C@H]1CC[C@H]2O1)NNC(=O)c1c(Cl)cccc1Cl	742626880	ALYSDQQNRGOLHC-YIKOMLBNSA-N	426.256	1.307	50	20	IDGD	
CCn1cnc2c1c(=O)n(CC(=O)NN=Cc1ccc(C#N)o1)c(=O)n2Cc1ccccc1	743427313	MQARQDXXCCOIIP-UHFFFAOYSA-N	445.439	1.043	50	20	IDGD	
CCc1cccc(NC(=O)CNC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)c1	745789373	JLSWLWUYJSYQFB-UHFFFAOYSA-N	433.490	1.627	50	20	IDGD	
CCN1CCN(C[C@@H](C)CNC(=O)NNC(=O)CCSc2ccc(F)cc2)CC1	745862470	JZBVMSZRWVEWAG-INIZCTEOSA-N	425.574	1.912	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)c2cc(S(=O)(=O)N3CCCC3)ccc2O)c1	745991263	UJBHHRMDXZXXHG-UHFFFAOYSA-N	449.485	1.269	50	20	IDGD	
Cc1ccc(C)c(S(=O)(=O)Nc2cccc(C(=O)NNC(=O)N3CCOCC3)c2)c1	745992506	CGCZGSBSSAKIBE-UHFFFAOYSA-N	432.502	1.791	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)c1ccccc1Cn1cccn1	746092274	IBINNOAJURTLRT-UHFFFAOYSA-N	432.528	1.905	50	20	IDGD	
O=C(NNC(=O)[C@H](O)c1ccccc1)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	746110766	JYEVPZGQHWTVNT-HXUWFJFHSA-N	428.452	1.883	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2ccc(Cl)cc2F)cc1S(=O)(=O)N(C)C	747330129	RHJKCZMLCFOFJJ-UHFFFAOYSA-N	429.857	1.813	50	20	IDGD	
O=C(Cc1ccc(Cl)cc1)NNC(=O)CN1CCN(C(=O)OCc2ccccc2)CC1	747348895	XNAAENZIJKRWGW-UHFFFAOYSA-N	444.919	1.984	50	20	IDGD	
COc1ccc2c(c1)OC[C@@H](C(=O)NNC(=O)CCN1CCN(c3ccccc3)CC1)C2	747366092	AOQMEAGCNVEJPE-IBGZPJMESA-N	438.528	1.606	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)c1ccc(NS(=O)(=O)C(F)(F)F)c(C)c1	747402229	PZODLMBPSXYGSI-UHFFFAOYSA-N	438.428	1.322	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NC2CCN(CCOC(C)C)CC2)nc1	747590707	MTKFTVMAOGRVPM-UHFFFAOYSA-N	442.586	1.284	50	20	IDGD	
C[C@@]1(c2ccc(C(=O)NNC(=O)c3ccc(COc4ccccc4)o3)cc2)NC(=O)NC1=O	748011496	DPUKBVIUYKCDKR-QHCPKHFHSA-N	448.435	1.988	50	20	IDGD	
Cn1c(=O)nc(O)c2cc(C(=O)NNc3ccc(S(=O)(=O)C(F)(F)F)cc3)cnc21	748521499	UFXMARQTZYFZCE-UHFFFAOYSA-N	443.363	1.085	50	20	IDGD	
CCOC(=O)C1CCN(S(=O)(=O)NNC(=O)c2cc(C)n(-c3ccccc3)c2C)CC1	748674197	NAMCESGORVCCEF-UHFFFAOYSA-N	448.545	1.848	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@@H](CCC#N)c2ccccc2)cc1	749222539	SXYDGTDNVNAEJI-IBGZPJMESA-N	443.529	1.991	50	20	IDGD	
CC[C@H](NC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)c1nnc2n1CCCCC2	749580396	SZSUJSJKAPTGMF-HNNXBMFYSA-N	434.522	1.503	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)N[C@@H]1CCN(CCCc2ccccc2)C1=O	750290442	BUZCBPLSEBBWST-LJQANCHMSA-N	434.500	1.441	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCn2cncc2C1)c1nn(Cc2ccccc2)c(=O)c2ccccc12	750828239	QNHDOAXAEQPZJZ-KRWDZBQOSA-N	442.479	1.665	50	20	IDGD	
Cc1ccc(C(=O)N2CCC[C@@H](C(=O)NNC(=O)CNC(=O)c3cccs3)C2)cc1	751208634	HQDXNDSOLNQYLT-MRXNPFEDSA-N	428.514	1.486	50	20	IDGD	
COC(=O)c1cc2c(cc1NC(=O)C(=O)NNC(=O)CCCc1cccs1)OCO2	753841488	STVDXJFGSNFLDD-UHFFFAOYSA-N	433.442	1.372	50	20	IDGD	
Cc1nc(N2CCOCC2)nc(O)c1CCC(=O)NNc1ccc(C(F)(F)F)nn1	755198527	SVANGIFTCBJJMY-UHFFFAOYSA-N	427.387	1.212	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3csc([C@@H]4CCCO4)n3)CC2)cc1	756003713	SHWUTVHQAKQNDX-IBGZPJMESA-N	443.573	1.882	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN2CCN([C@H](C)C(=O)N3CCCC3)CC2)cc1C	756050105	XELBYKRPRCTCGX-MRXNPFEDSA-N	435.594	1.008	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccc(N3CCOCC3)c(F)c2)c1	756335158	ACBNZBAEDTXYAB-UHFFFAOYSA-N	436.465	1.532	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)Nc2cnn(C[C@H]3CCCO3)c2)c2ccccc2c1=O	756737701	YBPCLSZOMWOAAK-OAHLLOKOSA-N	439.476	1.819	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)[C@](C)(O)CN2Cc3ccccc3C2=O)cc1OC	756798629	ZWIDOCLCLLVBFR-JOCHJYFZSA-N	427.457	1.262	50	20	IDGD	
O=C1C[C@H](Cc2ccc(NC(=O)NNC(=O)c3nnc(O)c4ccccc34)cc2)C(=O)N1	756815863	ORMXEKHDSNRHTN-LBPRGKRZSA-N	434.412	1.007	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Nc2cc(C)nn2C2CCN(C)CC2)cc(OC)c1OC	756896806	SKZJGIOYYVXJLW-UHFFFAOYSA-N	446.508	1.951	50	20	IDGD	
CC(C)(C)OC(=O)NCC1(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)CCCC1	756903272	AIJMEELPVKSXEF-UHFFFAOYSA-N	429.481	1.508	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)NCc1cc2c(cc1OC(F)F)OCO2	756916964	KLEXGQQGCMJVFJ-UHFFFAOYSA-N	439.371	1.935	50	20	IDGD	
CC1CCN(c2ccc(NC(=O)CCC(=O)NNc3ccc(C(N)=O)nn3)cc2)CC1	757398643	KNZPYDMZXZLENG-UHFFFAOYSA-N	425.493	1.674	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCCC[C@H]2C)cc1C(=O)NNc1ccc(C(N)=O)nn1	757402185	JRNUEZTZGIEKDT-CYBMUJFWSA-N	432.506	1.204	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)N[C@H]2CN(C)Cc3ccccc32)nc1	757730401	DHLGGRQRLLADPA-SFHVURJKSA-N	432.550	1.925	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](CCC(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)C1	758714450	ATESZCTYPLXURV-HNNXBMFYSA-N	444.488	1.900	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)NCCOc2cccc(C(F)(F)F)n2)nc2ccccc21	759622579	MZOZPAGRVRXTJW-UHFFFAOYSA-N	436.394	1.939	50	20	IDGD	
O=C(COC(=O)c1ccc(I)c(O)c1)NNC(=O)c1cccs1	760820756	XIKPQGMDVJVSLO-UHFFFAOYSA-N	446.222	1.676	50	20	IDGD	
Cn1cc(C=NNC(=O)CNC(=O)c2cccnc2)c(-c2ccc3c(c2)OCCCO3)n1	763193580	ATMJJIQROWEAIV-UHFFFAOYSA-N	434.456	1.524	50	20	IDGD	
Cc1cc(F)c(S(=O)(=O)N2CCN(S(=O)(=O)CBr)CC2)cc1F	763205774	FPOFNCJZUVNHTD-UHFFFAOYSA-N	433.296	1.262	50	20	IDGD	
COC(=O)CSCc1cccc(NC(=O)C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c1	763445782	KTZMKPGXYAFDMB-UHFFFAOYSA-N	446.441	1.401	50	20	IDGD	
COC(=O)C(C)(C)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1	763446303	QNIJNBXQJFZQTK-UHFFFAOYSA-N	428.401	1.445	50	20	IDGD	
Cc1ccc(S(C)(=O)=O)cc1NC(=O)C(=O)NNC(=O)c1cc2ccccc2cc1O	763522654	NUILXSWQTKNZRG-UHFFFAOYSA-N	441.465	1.657	50	20	IDGD	
Cc1cc(N2CCSCC2)ccc1NC(=O)C(=O)NNC(=O)COc1ccc(F)cc1	763839346	KCCJTBVAAMORHO-UHFFFAOYSA-N	446.504	1.852	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cc(C)nn2C(C)(C)C)cc1	763860732	LEGPGUVYVJTZGJ-CQSZACIVSA-N	431.493	1.899	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccc(O[C@H]2CCOC2)cc1	763864452	JNGPLWCSPOXAIG-BBRMVZONSA-N	431.420	1.547	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)C(=O)Nc2ccccc2N2CCOC2=O)cc1	763890490	ALIMRMHHJIAZTJ-UHFFFAOYSA-N	428.470	1.830	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2nc(-c3nccn3C)cs2)cc1OC	763902806	QOHQJYVDLILVHC-UHFFFAOYSA-N	444.473	1.351	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc(C(=O)N2CCC(C)CC2)cc1	764042809	MOVXRRQIPBUYEE-UHFFFAOYSA-N	438.484	1.967	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(Br)c2)cn1	764063031	JLFQOKSVKTWLOS-UHFFFAOYSA-N	437.250	1.269	50	20	IDGD	
O=C(NNC(=O)c1cccc(Br)c1)C(=O)Nc1ccc(-n2nccn2)cc1	764063204	KPACQRKJSGHDPR-UHFFFAOYSA-N	429.234	1.430	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2ccc(N3CCOC[C@@H]3C)cc2)cc1	764124734	OONCSETWSZRQDN-INIZCTEOSA-N	440.500	1.639	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)NC(C)C)c(C)c2)c1O	764132740	QFQPTPRFWQEIHY-UHFFFAOYSA-N	428.445	1.247	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1cnn(-c2cnc3ccccc3n2)c1	764136399	PZRZENMXJRTBEV-UHFFFAOYSA-N	445.439	1.153	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2O1)C(=O)Nc1ccn(-c2ccccc2Cl)n1	764164734	SPJIYXUQANRSOB-MRXNPFEDSA-N	425.832	1.615	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)C(=O)Nc1ccc(C(=O)N(C)C2CCCCC2)cc1	764298132	OJXVSWBROQDLCB-UHFFFAOYSA-N	426.477	1.523	50	20	IDGD	
CCN1CCC[C@H]1CN1C[C@H](C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)CC1=O	764332945	BISXGAOWVDXOMU-ZBFHGGJFSA-N	449.502	1.633	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)cc1N1CCOC1=O	764355469	BJIIYTXHMFLWSR-UHFFFAOYSA-N	432.820	1.710	50	20	IDGD	
COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NNC(=O)c1cc(-c2cccs2)[nH]n1	764382630	NPWNNHMNTONPKV-UHFFFAOYSA-N	430.402	1.455	50	20	IDGD	
CCOC(=O)c1cnn2c(C(=O)NNC(=O)c3cccc(Br)c3)ccnc12	764408284	KZMKIAAYFAVUAB-UHFFFAOYSA-N	432.234	1.743	50	20	IDGD	
COc1cc(C)ccc1Oc1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2COCCO2)cc1F	764426654	VQQZWDPNKUMGDN-SFHVURJKSA-N	447.419	1.436	50	20	IDGD	
CC(=O)Nc1cc(NC(C)=O)cc(C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)c1	765321651	DWDRGMMNBCXXNS-UHFFFAOYSA-N	435.481	1.669	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C2CCN(S(=O)(=O)c3ccc4ccccc4c3)CC2)n[nH]1	765586482	XDRJMODPSVHFNQ-UHFFFAOYSA-N	441.513	1.733	50	20	IDGD	
O=C(NNc1cnccn1)C(=O)Nc1ccc(CCn2cc(Br)cn2)cc1	766256287	GFAIRTJTQLDWHR-UHFFFAOYSA-N	430.266	1.760	50	20	IDGD	
CCCn1cc(C(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)nn1	766556428	VESIWFFXJZEKOX-UHFFFAOYSA-N	431.456	1.521	50	20	IDGD	
COC(=O)[C@H]1CCC[C@H](C(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)C1	766642411	HODHNXXDBRSTST-PMACEKPBSA-N	430.549	1.239	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)C[C@H](C)n3nc(C)cc3C)CC2)cc1	766650963	YEGBELYPJFLAPD-FQEVSTJZSA-N	426.565	1.725	50	20	IDGD	
NC(=O)c1ccc(/C=C/C(=O)N2CCC[C@H]2C(=O)NNc2ncnc3ccsc23)cc1	766671381	JDRVRPUDKOYFGB-WHWKNOJMSA-N	436.497	1.938	50	20	IDGD	
COC(=O)[C@H](NNC(=O)c1ccc(-n2cnnn2)cc1)c1cccc(Br)c1	766723736	DYMYVGRDDCWPSI-OAHLLOKOSA-N	431.250	1.574	50	20	IDGD	
CCCCn1c(C)cc(/C=C(/C#N)C(=O)N2CCN(S(=O)(=O)c3nc[nH]n3)CC2)c1C	768724512	ATFDKJXKYZELAE-PDGQHHTCSA-N	445.549	1.463	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)C(=O)Nc1cnn(-c2ccccc2)c1C(F)(F)F	769267353	QZYYDCKRELOVEQ-UHFFFAOYSA-N	432.362	1.615	50	20	IDGD	
COc1ccc(NC(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)cc1-n1cnnn1	770040759	SGQLVVMJACRDAS-UHFFFAOYSA-N	439.404	1.816	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3ccoc3Br)cc2)CC1	770424425	LQOYEQGVWZRSPO-UHFFFAOYSA-N	443.323	1.735	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCCC(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)cc1	770965054	GLSOZBAYBFRBLW-UHFFFAOYSA-N	447.521	1.407	50	20	IDGD	
C[C@]1(c2ccc(Br)cc2)NC(=O)N(CC(=O)NNC(=O)c2ccncc2)C1=O	771216329	OFUCQPAGBKNUDC-GOSISDBHSA-N	446.261	1.072	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1cccc(S(=O)(=O)N2C[C@@H](C)C[C@@H](C)C2)c1	771886865	DRHPAMMPCIXZCQ-ZNMIVQPWSA-N	439.534	1.456	50	20	IDGD	
COc1cccc(/C=C(/C(=O)O[C@H](C)C(=O)NNC(=O)CC(C)C)n2nnnc2C)c1	771922854	PWLLDCZVXYJCLY-GPLLRDDGSA-N	430.465	1.113	50	20	IDGD	
CN(C)C(=O)Nc1ccc(C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)c(Cl)c1	772342687	AAFRDXGXMDXQMC-UHFFFAOYSA-N	443.847	1.923	50	20	IDGD	
O=C(C[C@@H](O)c1cccc(F)c1)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	772555170	MDOYMMGPPQZWKM-LJQANCHMSA-N	449.504	1.885	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)CN1C(=O)c2cccc([N+](=O)[O-])c2C1=O	772955121	PSJONXLVIBBQDE-SNVBAGLBSA-N	446.803	1.459	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)c1ccc(S(=O)(=O)N(C)C)nc1	772965838	ZNULEEZWDKBLSU-LLVKDONJSA-N	426.882	1.214	50	20	IDGD	
COc1cc(SC)ccc1NC(=O)C(=O)NNC(=O)COc1ccccc1[N+](=O)[O-]	773526233	ZEQCLMCZFFSJGW-UHFFFAOYSA-N	434.430	1.490	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2cc(C(F)(F)F)ccc2N2CCOCC2)n1	773731731	UMRBJMKDBHINJT-UHFFFAOYSA-N	440.382	1.422	50	20	IDGD	
CN(C)C(=O)[C@@H]1CC[C@H](CNC(=O)NNC(=O)c2ccc(F)cc2Br)O1	775462225	WWJJAPOZRCEDJL-MFKMUULPSA-N	431.262	1.168	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2ccc3c(c2)OCO3)nc1	776061800	OKUHFOVGKRYMSD-UHFFFAOYSA-N	435.462	1.354	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc(Cl)cc(C(F)(F)F)c1)N[C@H]1CCS(=O)(=O)C1	777614881	TZXFMHDQHKBALX-VIFPVBQESA-N	435.833	1.038	50	20	IDGD	
COc1cc(C=NNC(=O)CNC(=O)c2ccco2)c([N+](=O)[O-])cc1OCC(F)F	778540832	WFYNRIMADHYABB-UHFFFAOYSA-N	426.332	1.720	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2ccc3nc(N4CCOCC4)sc3c2)nc(C)n1	783324717	MOROEMXERWEURI-UHFFFAOYSA-N	427.490	1.622	50	20	IDGD	
CC(C)(C)OC(=O)Cc1ccccc1NC(=O)C(=O)NNc1ccc(-n2cccn2)nn1	783433705	ZNGGUUILGPTYBQ-UHFFFAOYSA-N	437.460	1.628	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)CNC(=O)c2cccs2)cccc1C(F)(F)F	784004238	UTCYBZXMJLMXEV-UHFFFAOYSA-N	428.392	1.591	50	20	IDGD	
CCCNS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2cccc(C(F)(F)F)n2)cc1	784959121	RUDPYZHELVFYKH-UHFFFAOYSA-N	445.423	1.871	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNc2ccnc(N(C)C)n2)cccc1-c1nnc2n1CCCCC2	784968808	FPPBBTHNUWSXCQ-UHFFFAOYSA-N	449.519	1.918	50	20	IDGD	
CN(C)c1nccc(NNC(=O)C(=O)Nc2ccnn2Cc2ccc(C(F)(F)F)cc2)n1	784969427	LZYJNLYDOJJRMJ-UHFFFAOYSA-N	448.409	1.888	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)C(=O)Nc1cccc(C#Cc2ccccn2)c1	785060747	KWHLOWKBXZOSLO-UHFFFAOYSA-N	438.447	1.458	50	20	IDGD	
COc1ccc2nc(NNC(=O)C(=O)Nc3ccnn3-c3ccc(C)nn3)c(C)cc2c1	785163595	FYZNZZVAPYPZLX-UHFFFAOYSA-N	432.444	1.918	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@@H]3CN(C)C(=O)c4ccccc43)CC2)cc1	785182208	KWQIXACGVGEJOZ-JOCHJYFZSA-N	449.555	1.129	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCOCC2)cc1NC(=O)COC(=O)/C(C#N)=C/C1CC1	786676778	UOPWJFJGRGRSAZ-XNTDXEJSSA-N	449.485	1.058	50	20	IDGD	
Cc1cn(-c2c(F)cccc2F)nc1C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	786896978	NOIWHOATSFACPB-UHFFFAOYSA-N	441.442	1.927	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1cc(N2CCNC2=O)ccc1C	787545051	ZTCATDPGEOUMBM-UHFFFAOYSA-N	445.863	1.586	50	20	IDGD	
NS(=O)(=O)c1ccccc1NNC(=O)Cn1c(S)nnc1-c1ccc(Cl)cc1	788224064	RABZJDQTYPSSOV-UHFFFAOYSA-N	438.922	1.678	50	20	IDGD	
COc1cc(NNC(=O)NCCNS(=O)(=O)c2ccc([N+](=O)[O-])cc2)ccc1Cl	788901235	PUYIWBUCKHQPLL-UHFFFAOYSA-N	443.869	1.861	50	20	IDGD	
Cc1cc(C)nc(-n2nccc2NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)n1	789306026	MKGRKVPHFVQBHJ-UHFFFAOYSA-N	436.480	1.138	50	20	IDGD	
CCc1csc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(OC)c(OC)c3)[nH]n2)n1	789739424	NYRVLLRHJANONR-UHFFFAOYSA-N	444.473	1.513	50	20	IDGD	
COC(=O)c1ccc(/C=C(\C#N)C(=O)c2c(N)n(C)c(=O)n(C)c2=O)c(Br)c1	790587070	PCTYINHAWFDTOR-IZZDOVSWSA-N	447.245	1.005	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)OCc2nc(N)nc(N(C)C)n2)c(C)n1C[C@@H]1CCCO1	791150347	MFMSJFKAFZYSAQ-STKCSNAVSA-N	425.493	1.768	50	20	IDGD	
COC(=O)c1c(NC(=O)C(=O)NNc2nc3ccccn3n2)sc2c1CCCCC2	792395945	WKPRZPYHYXJPHL-UHFFFAOYSA-N	428.474	1.928	50	20	IDGD	
CSCCONC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	793419571	TYQUGPJWPYSTDE-UHFFFAOYSA-N	430.533	1.788	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CCn2cnc3ccc(Br)cc3c2=O)n1	794076200	NQTBYBPPXWQWPN-UHFFFAOYSA-N	430.262	1.714	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)C1CCN(c2ccc(C#N)cc2F)CC1	796481701	IIFSNPRZHBZEQL-UHFFFAOYSA-N	448.499	1.769	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccccc2CN2C[C@@H](C)O[C@H](C)C2)n1	797369721	GFCMOTMBCBTNTJ-HZPDHXFCSA-N	425.489	1.399	50	20	IDGD	
CC1=C(C(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)[C@H](C)n2ncnc2N1C	798981310	GPTWVWOHEXYETD-JTQLQIEISA-N	430.412	2.000	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)c1ccc(Br)c(OC(F)(F)F)c1	800806990	OYCMZIVAZLPBIC-QMMMGPOBSA-N	445.213	1.543	50	20	IDGD	
CC(=O)N1CCN(S(=O)(=O)c2cc(C(=O)NNc3ccccc3F)ccc2F)CC1	801176698	PMTJEYBMFYAMEP-UHFFFAOYSA-N	438.456	1.575	50	20	IDGD	
Cn1cc(C(=O)NNc2c(Br)cccc2Br)c(=O)n(C)c1=O	801504294	WMXWPSLIIAHWTR-UHFFFAOYSA-N	432.072	1.366	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ncc(COC)s2)c1	806607037	QTOJDOZCDFVGLT-UHFFFAOYSA-N	441.535	1.787	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)C(=O)Nc1ccccc1I	807428452	GEBLAGXXDLIJSC-UHFFFAOYSA-N	449.212	1.349	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNS(=O)(=O)CC2(C(=O)OC)CCCC2)cc1	811678750	ZAKLLNBGALVLRA-AWEZNQCLSA-N	428.507	1.537	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)[C@@H](CC(F)F)NC(=O)OC(C)(C)C)cc1	812732057	QLWGPDLKVDSLQA-CYBMUJFWSA-N	436.481	1.929	50	20	IDGD	
CC(C)n1ncc2cc(NC(=O)C(=O)NNc3ccc(S(=O)(=O)N(C)C)cc3)cnc21	813033623	CCTAZEAAAIMZMU-UHFFFAOYSA-N	445.505	1.344	50	20	IDGD	
O=C(NNS(=O)(=O)CCCCN1C(=O)c2ccccc2C1=O)c1ccc([N+](=O)[O-])cc1	814210229	MXQOQFVEZHASJY-UHFFFAOYSA-N	446.441	1.235	50	20	IDGD	
O=C(COC(=O)c1ccccc1NC(=O)C1CC1)NNC(=O)[C@H]1COc2ccccc2O1	815516534	SNAQACIJIWPWGR-GOSISDBHSA-N	439.424	1.179	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)COCc2ccccc2)cc1)[C@@H]1C[C@H]1C	815570058	PLSROJDWJOUGHV-FOIQADDNSA-N	438.484	1.751	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCc2nncn2C1)C(=O)Nc1ccc(-c2ccc(Cl)s2)nc1	815692914	FQPZOHUXEDAINB-JTQLQIEISA-N	445.892	1.404	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCc2cncn2C1)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	816830973	ANTOWLROVVJCBR-LJQANCHMSA-N	442.483	1.609	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)c1cnn(CCO)c1-c1ccccc1	817053422	QNEXWKYMTRRUOR-UHFFFAOYSA-N	429.502	1.550	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN1c1ncnc2ccccc12)c1nnc(O)c2ccccc12	832811178	QTZBTVSVXUGFCK-KRWDZBQOSA-N	429.440	1.709	50	20	IDGD	
COC(=O)NNC(=O)c1ccc(OC)c(S(=O)(=O)NCc2ccc(Cl)cc2)c1	913176812	XLCBOEZYIZWPAU-UHFFFAOYSA-N	427.866	1.828	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)NCC(=O)NNC(=S)Nc2ccc(C)cc2C)cc1	913428350	FCDBPVOJDVLMKC-UHFFFAOYSA-N	434.543	1.802	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)c1ccccc1)C(=O)NNC(=O)NC1CCCCC1	913451397	VWCZPPHVOVKAAR-INIZCTEOSA-N	428.580	1.750	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CSc2n[nH]c(-c3ccccc3O)n2)cc1OC	914866743	LCPYSGWVPLVBNY-UHFFFAOYSA-N	429.458	1.748	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C2=NN(Cc3ccccc3)C(=O)CC2)cc(OC)c1OC	915684722	ASBCUXUIVRWMGF-UHFFFAOYSA-N	440.456	1.652	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)CNC(=O)c1cc(OC)cc(OC)c1	915776235	GUQLENMWIXDINR-UHFFFAOYSA-N	439.472	1.193	50	20	IDGD	
Cn1ccnc1[C@](O)(CCNC(=O)NNC(=O)COc1ccc(F)cc1)C(F)(F)F	916377867	GAFLSDUQPTVYQO-MRXNPFEDSA-N	433.362	1.109	50	20	IDGD	
CCCNC(=O)CN1CCC(NC(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)CC1	916518729	IJQRDEZJLLGMSA-QGZVFWFLSA-N	433.553	1.392	50	20	IDGD	
CC(C)NC(=O)C(=O)NNC(=O)[C@H]1CCC(=O)N(Cc2ccccc2)[C@@H]1c1ccccc1	917622103	IZMXHMMSTSGMRP-PZJWPPBQSA-N	436.512	1.839	50	20	IDGD	
CCS(=O)(=O)N1CCC[C@@H](C(=O)NNC(=O)[C@@H](C)Oc2ccc3ccccc3c2)C1	918549429	SDFNDORGUZLHGE-CRAIPNDOSA-N	433.530	1.816	50	20	IDGD	
COC(=O)CN(C)C(=O)/C(C#N)=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	920853250	MUMWTIYLTSRYPC-NTEUORMPSA-N	429.864	1.617	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)Nc2cccc(CN3CCC[C@@H]3C(N)=O)c2)c1	920930997	ZYOYJGBKUIMQJC-LJQANCHMSA-N	439.516	1.985	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1O)c1cc(S(=O)(=O)N2CCSCC2)c[nH]1	921075610	CACRJWAPTJUZQI-UHFFFAOYSA-N	444.922	1.186	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCCNS(=O)(=O)c2ccc(F)cc2Cl)cc1	1116951233	ARJUINVZHUUJHC-UHFFFAOYSA-N	444.872	1.410	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cc(C)n(CC3CC3)c2C)cc1	1318257316	HFBGJCVSAGZWHC-UHFFFAOYSA-N	432.546	1.905	50	20	IDGD	
Nc1cnnc(NNC(=O)N[C@@H]2CCCN(Cc3ccc(F)cc3F)C2=O)c1Cl	1343421741	MXHZXIPOIJLLMK-CYBMUJFWSA-N	425.827	1.808	50	20	IDGD	
N[C@@H](Cc1cscn1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(Cl)Cl)C2	1777968440	VIQKDQVQCUQMII-OGHNNQOOSA-N	435.377	1.331	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cn3ccccc3n2)C1	1778478585	NWTIVDAVVHUUDN-QLVMHMETSA-N	434.924	1.716	50	20	IDGD	
Cc1cnc2c(C(=O)N3CC[C@]4(C3)CN(C(=O)[C@@H](C)Br)CCO4)cnn2c1	1778529037	XGEFXUJTOKAKHS-ACJLOTCBSA-N	436.310	1.265	50	20	IDGD	
Cc1cc2nnc(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)[C@H](F)Cl)C4)c(C)n2n1	1778561415	SVYSGBXHMGQMHZ-ACWOFJMJSA-N	438.891	1.403	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2)c1n[nH]c2c(F)cccc12	1779094554	QHHBFKRVFOLDMN-STXHMFSFSA-N	438.887	1.429	50	20	IDGD	
CCc1cc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)n(C)n1	1779622678	XWOWYTIWLIQBIO-FZKQIMNGSA-N	427.343	1.457	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cccc(-c4cnccn4)c3)C2)C1	1780186281	HVJMNLWDNYPJAY-AVRDEDQJSA-N	444.919	1.841	50	20	IDGD	
C[C@H](C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(C)(C)CCl)C2)N1CCN(C)CC1	1780636875	PVYLAHMFAOGJRZ-JBYIUTFZSA-N	443.032	1.401	50	20	IDGD	
CCC(=O)N[C@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Br)C1	1780770199	HTLALQYLJWSFQD-CTWCOEIASA-N	436.322	1.106	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1nc[nH]c1[N+](=O)[O-])C2)[C@@H](F)Br	1780773232	HSWWJXLGLZZPRF-XDMRBOTDSA-N	448.249	1.136	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)c3cnc4[nH]ncc4c3)CCO2)C1	1781229620	GOVFTZFLBDQUHJ-ZWKOTPCHSA-N	426.304	1.638	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CNC(=O)OC(C)(C)C)C1	1781937737	PERTUOPOZQIVJV-STXHMFSFSA-N	447.960	1.279	50	20	IDGD	
O=C(c1cccc2nccn12)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1782361768	PMDDILVTAGZEQS-YOEHRIQHSA-N	425.258	1.468	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)COc3ccc(Cl)c(F)c3)CCO2)C1	1783871785	VNKAZACHCFFBKS-KXBFYZLASA-N	449.306	1.942	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(OC(F)F)cn3)CCO2)C1	1783873404	OIFWDBYQRLHKAT-ACJLOTCBSA-N	433.839	1.380	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3F)C[C@@H]21	1783965311	HFUPRFPPSBOYQA-DUPGQFARSA-N	428.302	1.845	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnn(Cc4ccccc4)c3)C[C@@H]21)[C@@H](O)CCl	1784091509	WJUNRGRXHVVYRX-LEAZDLGRSA-N	446.935	1.124	50	20	IDGD	
COc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]3C2)cc(OC)c1C	1784096355	VNYQDHMLSYYHNT-FJXLLPKBSA-N	440.924	1.205	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c(F)c1F	1785052161	DUOMVNBUIXHWJZ-OAQYLSRUSA-N	438.475	1.090	50	20	IDGD	
COc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]3C2)c([N+](=O)[O-])cc1O	1787448155	VPBYKJZKESWGCN-JIVACREVSA-N	445.831	1.437	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)c1ccc2nncn2c1	1788375255	GWMKTBCCQKZIHQ-PWNZVWSESA-N	440.273	1.013	50	20	IDGD	
C=CC[C@H](C(=C)C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1	1788610973	CTBGIWAPWJXEKB-JSJNYSNDSA-N	441.532	1.047	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)c1cc2cccnn2c1	1790434358	QYKLJURIBDOZRJ-VCOSZWKGSA-N	439.285	1.618	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)c1ccc2nn[nH]c2c1	1790536078	XMHBVOITTOKNFB-GVARAGBVSA-N	440.273	1.242	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)Br)C[C@@H]21	1790964433	PZKMYZKFNFWAFF-VLJOUNFMSA-N	440.176	1.923	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc3c1cnn3C)C2	1792867965	MBLPRKHFWUFYFC-ZUMXRPEOSA-N	449.349	1.808	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)Cc1ccccc1)C2	1792871976	GPBOCIJCABIOKU-FWEDZOCSSA-N	439.350	1.211	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2)C1CCN(Cc2ccccn2)CC1	1794160287	VRTPAPPKZXQYCK-UKBAYJJMSA-N	438.931	1.418	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc3ccccc13)C2)c1cccc(B(O)O)c1	1795738728	BJUSTFYULRZOAU-BBIADKPPSA-N	444.296	1.037	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1(c3ccc(O)cc3)CC1)C2	1796189587	GDLXUNABOFXHJL-ACDBMABISA-N	434.301	1.056	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(Br)ccc1O)C2)[C@@H](F)Cl	1796366307	RUPFKENYNRIZGI-HZZFPTLFSA-N	435.677	1.892	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc2n[nH]cc2c1	1796611982	ODTRTRCAPXWETP-DIWZVOJHSA-N	447.499	1.949	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3nccn3c1)C2	1799275551	XHAZZKMZJISVBK-QHHYFVSCSA-N	425.316	1.774	50	20	IDGD	
COc1cc(C)cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Br)C3)c1	1799452396	XFCKZMFZPFIDFM-OCVGTWLNSA-N	429.286	1.897	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1csc(C)n1)C2	1800640250	NKXPBXVWCLURFR-FAXLKDOZSA-N	430.368	1.757	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1CCN(C(C)C)CC1)C2	1800640252	NORSJKLFEAEYQI-MHORFTMASA-N	444.414	1.870	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CS[C@H]1CCCCO1)C2	1800759202	KSXULLXIBPQGKO-IGNRKKQASA-N	435.384	1.619	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(OC)c(N(C)C)c1)C2	1800976857	ALCVUEOFHBHBBZ-RCJHGTSTSA-N	439.940	1.218	50	20	IDGD	
C/C(=C\c1cccnc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2	1801351754	FNQHHFQXATXHHG-FLUJKDTBSA-N	426.286	1.765	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCc1cccc(C#N)c1)C2	1802334841	PPXPXFJMJOLBJV-ACDBMABISA-N	425.533	1.502	50	20	IDGD	
Cc1ccc(CCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)c(C)n1	1802745623	MFZPMZSRZIZVRU-KOUNCHBCSA-N	435.333	1.263	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H]2Cc3ccccc3CN2)[C@H]1c1cccnc1)[C@@H](O)CCl	1803138590	CRPRJQVFHHXKCZ-WOZUAGRISA-N	442.947	1.402	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)C2(C#N)CC2)[C@@H]1c1cccnc1	1806849665	DQDXFQXJGCOXFH-CRICWCDVSA-N	447.499	1.525	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)c2ccno2)[C@H]1c1cccnc1	1808415016	RFQOQAJRSWPZSA-VQMZYRHSSA-N	449.471	1.523	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2ncn(C(C)C)n2)[C@H]1c1cccnc1	1808721519	NICJESKREYEIRJ-IXDOHACOSA-N	434.928	1.827	50	20	IDGD	
O=C(/C=C/c1ccsc1)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1	1809974837	ADKAWWKMKBSSTP-AATRIKPKSA-N	438.358	1.986	50	20	IDGD	
C#CC(=O)NC[C@@H]1CCN(C(=O)CN(C)NC(=O)NCc2ccccc2)[C@H]1c1cccnc1	1812530671	KBUZXLMTKDLTDZ-REWPJTCUSA-N	448.527	1.067	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)COCCOC)[C@H]1c1cccnc1	1812775024	PCOOBYUMSARMKW-BQFCYCMXSA-N	442.354	1.924	50	20	IDGD	
Cc1cc(C)nc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)CCC(=O)NN(C)C)CC3)c1	1815958017	FUBYDWPBNUAYNP-AWEZNQCLSA-N	444.561	1.754	50	20	IDGD	
Cc1cncc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)c1	1816500432	JXCHVOLGJGULID-QGZVFWFLSA-N	427.509	1.792	50	20	IDGD	
Cc1ccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)nc1	1816540691	AFTVAUAOMAQLES-IBGZPJMESA-N	433.277	1.413	50	20	IDGD	
O=C1NCCCn2nc(C(=O)N3CCCC[C@H]3c3cc(NC(=O)[C@H](F)Cl)n[nH]3)cc21	1818038983	HHDCTKHBEMZPDU-WFASDCNBSA-N	437.863	1.580	50	20	IDGD	
CCOC(=O)N[C@H](O)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CO[Si](C)(C)C)[nH]n1	1819241705	OJUJYBSOVOIYAO-SUMWQHHRSA-N	441.561	1.318	50	20	IDGD	
C=CC(=O)N[C@@H](C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCBr)[nH]n1	1819578785	LCBNAXJATDKEOP-AAEUAGOBSA-N	426.315	1.878	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCBr)[nH]n1	1819578786	LCBNAXJATDKEOP-DGCLKSJQSA-N	426.315	1.878	50	20	IDGD	
CN1CCN(CC(=O)N[C@H]2CCc3nc(NC(=O)[C@](C)(Cl)CCl)sc3C2)CC1	1822864806	HSKXHVROGUKLRN-KPZWWZAWSA-N	448.420	1.539	50	20	IDGD	
O=C(CCN1CCOC1=O)N[C@@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1	1823006501	CDZPMEVKJZJKHB-PELKAZGASA-N	449.302	1.588	50	20	IDGD	
CN1C(=O)CC[C@H]1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCBr)CC2	1823046812	LYJAOEAPCWMCQI-KOLCDFICSA-N	429.340	1.461	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)C2(F)CCC2)n[nH]1	1823076981	NZRASVVLPIEKPG-OAHLLOKOSA-N	429.456	1.606	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)C[C@H]2CCCCO2)CC1	1824904534	BXXHEFOIBKBTRU-FGZHOGPDSA-N	442.365	1.559	50	20	IDGD	
CCc1ncccc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1	1825513371	KFNNALAPWFENRZ-QHCPKHFHSA-N	449.360	1.871	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](C)N1C[C@H]3C[C@H]3C1)CC2	1826000271	QHADCDKHQQGOII-QNSTZXKLSA-N	426.970	1.649	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc3cccnn3n1)CC2	1826003187	HPJAMFXZZPLSJJ-PWSUYJOCSA-N	434.909	1.665	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc3cccnn3n1)CC2	1826003188	HPJAMFXZZPLSJJ-ZYHUDNBSSA-N	434.909	1.665	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ncccc1F)CC2	1826087951	MDFXJAQDHOQLEP-LLVKDONJSA-N	434.497	1.276	50	20	IDGD	
Cc1ncncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1	1829358014	OZEOVTLYKOGMRB-OAQYLSRUSA-N	436.321	1.012	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ncc(F)cc3F)C2)C1	1830353582	GARYZESNJUFJAG-IBGZPJMESA-N	431.867	1.695	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc(N(C)C)o3)C2)C1	1831643940	LUZNFSHTRANTBS-LIRRHRJNSA-N	428.917	1.218	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)CCc3ccccc3F)CC2)CC1)[C@H](O)CCl	1833312785	DODVDMBGYJZXSY-HXUWFJFHSA-N	439.959	1.930	50	20	IDGD	
CCOc1cccc(C(=O)N2CCC(N3CCC(NC(=O)[C@@H](O)CCl)CC3)CC2)c1	1833313264	CRNRPHNLVZZCAI-FQEVSTJZSA-N	437.968	1.870	50	20	IDGD	
O=C(CSC1CCCC1)NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1833456601	GKVVFYDBTYIFCX-GOSISDBHSA-N	432.030	1.834	50	20	IDGD	
Cc1cnc(Cl)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)c1	1834560771	WZCCPAZQOFAGMR-KRWDZBQOSA-N	436.723	1.917	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3nc[nH]n3)CC2)CC1	1834953353	CEIPKFDRZVCDMI-AWEZNQCLSA-N	427.347	1.163	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)NC(=O)OCC)CC2)CC1	1835642767	QYIRSQIVBHCUPS-FUHWJXTLSA-N	446.976	1.030	50	20	IDGD	
Cc1ncc(C(=O)N2CCC(N3CCC(NC(=O)CO[Si](C)(C)C)CC3)CC2)cn1	1835834987	KCHFQOLZWRHFGL-UHFFFAOYSA-N	433.629	1.822	50	20	IDGD	
O=C(CCc1ccc[nH]1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1836015962	NPMBAUYNRLMKGA-DOTOQJQBSA-N	432.290	1.094	50	20	IDGD	
COc1cc(C(=O)N2CCC(OC3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)ccn1	1836718450	OSLCXCBEARXEGG-KRWDZBQOSA-N	425.913	1.302	50	20	IDGD	
COCCOCC(=O)N1CCC(OC2CCN(C(=O)[C@H](C)Br)CC2)CC1	1837769196	NBOHPRSHTMHMRX-AWEZNQCLSA-N	435.359	1.431	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)Cc3ccn(C)n3)CC2)CC1	1837948224	XEXSZLJLVGIWCU-CQSZACIVSA-N	441.370	1.745	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)CCNC(C)=O)CC2)CC1	1838755603	STYLCKHFGBRTAG-QGZVFWFLSA-N	446.386	1.685	50	20	IDGD	
CCOc1cccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](Cl)CC)CCO3)c1O	1839146964	BYGRQKSLGVZUHW-HRAATJIYSA-N	440.924	1.878	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)c3ccccc3Cl)C2)C1	1839148466	AFAVNHFKRRCIDW-WRWLIDTKSA-N	445.343	1.847	50	20	IDGD	
O=C(C(Cl)Cl)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CCc3ccccc3O1)CCO2	1840139291	NVMLGXVNRUHTJL-UZLBHIALSA-N	443.327	1.640	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)n1ccnc1C)CCO2	1840489557	YNRMRJMRSCBKSW-KNBMTAEXSA-N	426.945	1.616	50	20	IDGD	
COc1ccc([C@H]2C[C@H]2C(=O)N2CCCC23CN(C(=O)CCC(=O)NN(C)C)C3)cc1	1841576237	OUQLPFKCFWVTNZ-RTBURBONSA-N	428.533	1.375	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H]1CC[C@H](C(=O)N2CCCC23CN(C(=O)[C@@H](O)CCl)C3)CC1	1841754465	GBLBEPCIULHUAK-JYJNAYRXSA-N	443.972	1.873	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCCC12CN(C(=O)CCSC(=N)N)C2	1841924470	PFEAQNBQVMODMC-LBPRGKRZSA-N	447.989	1.339	50	20	IDGD	
O=C(CCN1Cc2ccccc2C1=O)N1CC2(CCCN2C(=O)[C@@H](F)Br)C1	1845218144	NXNIUZIMQUHLKI-MRXNPFEDSA-N	438.297	1.926	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC2(CCCN2C(=O)c2cnc3c(c2)CCNCC3)C1	1845796178	NMJNTRQNHRDNTL-AWEZNQCLSA-N	435.366	1.618	50	20	IDGD	
CCS(=O)(=O)c1ccc(CC(=O)N2CCCC23CN(C(=O)[C@H](Cl)COC)C3)cc1	1845939722	OJWQEDXUXUABSR-QGZVFWFLSA-N	442.965	1.480	50	20	IDGD	
CC(C)(C)OC(=O)NC1CCC(C(=O)N2CCCC23CN(C(=O)[C@H](O)CCl)C3)CC1	1846954399	GBLBEPCIULHUAK-UYSNPLJNSA-N	443.972	1.873	50	20	IDGD	
COCCOCCOCCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](C)CBr	1847499765	MDRDYLYJVOLQHT-JYJNAYRXSA-N	435.359	1.289	50	20	IDGD	
COc1c(Br)cccc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl	1847562469	WGSXNROHZZTOEF-IHRRRGAJSA-N	431.714	1.873	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)[C@@H](C)Oc1ccc(C#N)cc1	10780593	GQYLXRVBWKQYMR-GFCCVEGCSA-N	431.832	1.992	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)CCc2c(C)nc3nc(N)nn3c2C)cc1OC	12693636	NOTCTJXTEKZSGQ-UHFFFAOYSA-N	427.465	1.124	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNS(=O)(=O)c2ccc(C(=O)O)cc2)cc1	13059858	DHCVAJWBVURJPC-UHFFFAOYSA-N	447.498	1.429	50	20	IDGD	
COc1cc(CCC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc(OC)c1	15584349	SJKIKMISGCLEFE-UHFFFAOYSA-N	440.544	1.996	50	20	IDGD	
CC(C)C[C@H](C(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)N1C(=O)[C@H]2CC=CC[C@@H]2C1=O	17329942	UEMREQWLDXESBV-YESZJQIVSA-N	428.445	1.722	50	20	IDGD	
O=C(NNC(=O)c1cccnc1)c1ccc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1	27766385	PUYIIBUOYOFTRV-UHFFFAOYSA-N	441.425	1.865	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)N1CCN(C(=O)CCC2CCCC2)CC1	725873956	VMWHBCZCMNFCGR-UHFFFAOYSA-N	435.550	1.333	50	20	IDGD	
COc1ccc(CN2C[C@H](C(=O)NNC(=O)c3nnc(O)c4ccccc34)CC2=O)cc1	726523722	VDXBPOZJNQOKOD-CQSZACIVSA-N	435.440	1.154	50	20	IDGD	
C[C@H]1C[C@@H](C)CN(C(=O)CN2CCN(C(=O)NNC(=O)CCCc3ccccc3)CC2)C1	727846109	KYTLWGAVEWJIQU-BGYRXZFFSA-N	443.592	1.872	50	20	IDGD	
CC(=O)N1CCN(CCOc2ccc(CCNC(=O)NNC(=O)C(C)(C)C)cc2)CC1	728135084	WHTSJMVJYKBINW-UHFFFAOYSA-N	433.553	1.149	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@@H](C)C(=O)NNC(=O)c1ccc(S(N)(=O)=O)s1	729301107	YVROXCJOYHMMFP-JTQLQIEISA-N	431.923	1.894	50	20	IDGD	
CC[C@H](NC(=O)NNC(=O)[C@H](C)Oc1ccccc1F)c1cccc(S(N)(=O)=O)c1	729613510	UBXYWIBRIVLXCE-LRDDRELGSA-N	438.481	1.722	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@@H]2CC(=O)N(c3ccc(F)cc3)C2)c2ccccc2c1=O	730204803	DTIUNMWOSXKEPF-CYBMUJFWSA-N	437.431	1.370	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])o2)c1	731957749	ACYWDVQKCQOCIS-AWEZNQCLSA-N	432.389	1.271	50	20	IDGD	
COc1ccc(-c2noc(CCCC(=O)NNC(=O)CCN3C[C@@H](C)O[C@H](C)C3)n2)cc1	732262890	XAJZTDQMMFJJDH-HZPDHXFCSA-N	445.520	1.715	50	20	IDGD	
COC(=O)c1ccc(-c2ccc(/C=C(/C#N)C(=O)c3c(N)n(C)c(=O)n(C)c3=O)o2)cc1	732578820	SORMYMQMVBKAGZ-UVTDQMKNSA-N	434.408	1.503	50	20	IDGD	
Cc1ccc(CC(=O)N2CCN(C(=O)NNC(=O)c3cnn(-c4ccccc4)c3)CC2)cc1	733350232	SOLHCXDROSSGKP-UHFFFAOYSA-N	446.511	1.922	50	20	IDGD	
N#Cc1ccc(N2C(=O)N[C@@H](CCC(=O)NNC(=O)CCOc3ccccc3)C2=O)cc1	733776536	KKWGTQNXYRLWJV-SFHVURJKSA-N	435.440	1.380	50	20	IDGD	
CC(C)[C@@H](CNC(=O)NNC(=O)c1nnc(O)c2ccccc12)NC(=O)OC(C)(C)C	734690436	TVAGEIFZNHUTIQ-CQSZACIVSA-N	432.481	1.829	50	20	IDGD	
CCOc1ccc(Cl)cc1C(C)=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O	735972435	CVNSISODGPQNPD-UHFFFAOYSA-N	425.898	1.164	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)NC2CCN(C[C@H]3CCOC3)CC2)cc1	737055712	FEWVWJNWFOWLDI-DLBZAZTESA-N	434.537	1.684	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)[C@@H]1CCCN(C(=O)COc2ccccc2)C1	741282830	QNIIPYYMHYAXFX-GOSISDBHSA-N	425.485	1.790	50	20	IDGD	
Cc1nc2c(C(N)=O)cnn2c(C)c1CCC(=O)NNC(=O)C(F)(F)Oc1ccccc1	741596195	MFRQTFQKDJJOFR-UHFFFAOYSA-N	446.414	1.197	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2cn(Cc3cccs3)nn2)c2ccccc2c1=O	742474767	MKGZQHKLYZIWLE-UHFFFAOYSA-N	437.485	1.583	50	20	IDGD	
O=C(NCCS(=O)(=O)NCC1CCC1)NNC(=O)Nc1ccc(OC(F)F)cc1	743602876	RTEILZMNYGKSDQ-UHFFFAOYSA-N	435.453	1.343	50	20	IDGD	
O=C(NNC(=O)N1CCN(C(=O)CN2CCCC2)CC1)c1cccc(Br)c1	743685795	DEWLNHITXQRIKU-UHFFFAOYSA-N	438.326	1.044	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)[C@@H]2CC(=O)N(c3ccc(F)cc3F)C2)cc1	744706897	IJAOXEHJQNLINT-CQSZACIVSA-N	442.378	1.194	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)c1	744743502	VROMTQCEBYIJON-UHFFFAOYSA-N	434.368	1.270	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NCCN2CCN(C(=O)OC(C)(C)C)CC2)cc1	744896047	DNYAPOYJUIBEIZ-UHFFFAOYSA-N	435.525	1.257	50	20	IDGD	
COCCS(=O)(=O)c1ccc(C(=O)OCC(=O)NNC(=O)c2cccc(C)c2)cc1	744905594	NNFKNDUNBARSOW-UHFFFAOYSA-N	434.470	1.033	50	20	IDGD	
CC(=O)CCc1ccc(OCC(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1	745107431	BZYUFJVZINDODG-UHFFFAOYSA-N	432.502	1.341	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)c1nc(C(C)(C)C)no1	745919477	GWPLBEDGOYFNFQ-NSHDSACASA-N	438.510	1.323	50	20	IDGD	
O=C(CN1CCN(c2ccc3ccccc3n2)CC1)NNC(=O)c1cccc([N+](=O)[O-])c1	746468116	FINIEDOUFZGMNO-UHFFFAOYSA-N	434.456	1.726	50	20	IDGD	
CC(=O)N1CC[C@](C)(C(=O)NNC(=O)c2nc(-c3ccccc3)n(-c3ccccc3)n2)C1	746823337	ZNXMMBRRWZFUJK-QHCPKHFHSA-N	432.484	1.954	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@](F)(C(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)C1	748210311	LOTRLTAHGYMSHU-LJQANCHMSA-N	443.859	1.993	50	20	IDGD	
NS(=O)(=O)c1ccc(N2CCOCC2)c(C(=O)NNc2ccc(Cl)c(F)c2)c1	748897300	AOSGKBJTGYXSFC-UHFFFAOYSA-N	428.873	1.720	50	20	IDGD	
O=C(CCc1ccccc1)NNC(=O)CNS(=O)(=O)c1ccc(Br)s1	749849765	GWURZAOYGDKPLY-UHFFFAOYSA-N	446.348	1.569	50	20	IDGD	
CC(C)N1C[C@H](NC(=O)NNC(=O)COc2ccc(OCc3ccccc3)cc2)CC1=O	750643303	JERKBCDUKIKYGE-GOSISDBHSA-N	440.500	1.984	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NCC1(CN2CCOCC2)CCCCC1	751607105	JYKDJWXTZFOBSC-UHFFFAOYSA-N	437.566	1.091	50	20	IDGD	
CN1C(=O)c2cccc3c(S(=O)(=O)NNC(=O)c4ccc5c(c4)OCCO5)ccc1c23	753771057	MFDSXHGOHSPUIA-UHFFFAOYSA-N	439.449	1.824	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)n([C@H]2CCS(=O)(=O)C2)n1	755537494	VTFWNTBHABHHGN-INIZCTEOSA-N	443.489	1.203	50	20	IDGD	
CCCN(CCC)C(=O)c1ccc(NC(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)cc1	755969214	KJVGOUHNPHBATI-ZDUSSCGKSA-N	427.527	1.039	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)Nc1cccc(N2C(=O)CN(C)C2=O)c1	755994672	ZQRIOXPPWXCQEN-LBPRGKRZSA-N	429.408	1.844	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)Nc2ccc(S(=O)(=O)C[C@H]3CCCO3)cc2)c1O	756495337	QDZNNHWNQNJFPC-CQSZACIVSA-N	449.485	1.820	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1	756611302	RYOWANABBHKALC-GFCCVEGCSA-N	434.430	1.975	50	20	IDGD	
COC(=O)c1cc(NC(=O)NNC(=O)c2cc(OC)cc(OC)c2)c(OC)c(OC)c1	756744005	YNAYYZYVQNCMKH-UHFFFAOYSA-N	433.417	1.974	50	20	IDGD	
COC(=O)c1cc(NC(=O)NNC(=O)CCc2ccc(OC)cc2)cc(S(C)(=O)=O)c1	757673369	FGLLXUKMJNASHN-UHFFFAOYSA-N	449.485	1.671	50	20	IDGD	
Cc1c(CCC(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)cnn1C	758151690	WQPDOZZURWNUSH-UHFFFAOYSA-N	447.542	1.985	50	20	IDGD	
COC(=O)[C@@H](C)Cc1ccc(NC(=O)C(=O)NNc2cccc(S(C)(=O)=O)c2)cc1	759401315	MVWLPRCIWVEEBW-ZDUSSCGKSA-N	433.486	1.524	50	20	IDGD	
CC(=NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)c1cnc(C)s1	761255773	XOMFIQWZTIFHEN-UHFFFAOYSA-N	436.559	1.945	50	20	IDGD	
COCCC1(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)CCCC1	761766784	AAINKAPVJRAJFT-UHFFFAOYSA-N	426.539	1.478	50	20	IDGD	
O=C(CCCCCNC(=O)NC1CCCCC1)NNc1nccc(N2CCOCC2)n1	762850435	JGRGZBPWYUZWSE-UHFFFAOYSA-N	433.557	1.949	50	20	IDGD	
O=C(NNc1nccc(N2CCOCC2)n1)[C@@H]1CCCN(c2ncnc3sccc23)C1	762852505	NMIKMUPTFBDFIW-CQSZACIVSA-N	440.533	1.678	50	20	IDGD	
COC(=O)c1cc(OC)ccc1NC(=O)C(=O)NNC(=O)c1cc2ccccc2cc1O	763525818	DOUUHANHGXVKFU-UHFFFAOYSA-N	437.408	1.740	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)N2C[C@H](C)Oc3ccccc32)cc(OC)c1OC	763540303	SKTISLYVYJZOSO-LBPRGKRZSA-N	429.429	1.288	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2ccc(C)c(C(=O)N(C)C)c2)c1	763665784	NZWDIFBVFRCQNK-UHFFFAOYSA-N	426.473	1.479	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(C(=O)N(CC)CC)cc1	763712462	RLLUTRNDUZVTLS-UHFFFAOYSA-N	440.500	1.896	50	20	IDGD	
CC(C)C[C@H](C)n1nccc1NC(=O)C(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	763791723	XZTJVSNWCGSTQY-ZDUSSCGKSA-N	439.476	1.137	50	20	IDGD	
CCOC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)cc1	763867313	ZQLPTLQOXMIFFF-LBPRGKRZSA-N	432.408	1.948	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc(C)c(S(=O)(=O)NC(C)(C)C)c1	763959806	JARQDKIRMSHODH-UHFFFAOYSA-N	446.529	1.780	50	20	IDGD	
Cc1ccc(Oc2ccc(NC(=O)C(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)cn2)cc1C	764001681	BWBWYSHIEUFQQG-AWEZNQCLSA-N	446.485	1.011	50	20	IDGD	
CCCNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2OC)c1	764013055	UQIKNAYQCUALLI-UHFFFAOYSA-N	432.864	1.888	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(Br)c2)cc1-n1cnnn1	764062961	HTVIITFAYQDIGA-UHFFFAOYSA-N	444.249	1.133	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2ccc(C(=O)NC(C)C)c(C)c2)cc1	764128035	YJDVJYPFEUTZPD-UHFFFAOYSA-N	440.500	1.861	50	20	IDGD	
CCS(=O)(=O)c1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)c1cccc(C#N)c1	764234733	IGZPCHXZMAHVRX-UHFFFAOYSA-N	434.861	1.405	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)C(=O)Nc1ccc(N2C(=O)CCCC2=O)cc1	764242622	WHCBYAHMRWSTAY-UHFFFAOYSA-N	447.451	1.471	50	20	IDGD	
CN(C)C(=O)COc1ccc(NC(=O)C(=O)NNC(=O)c2cccc3ncccc23)cc1	764253704	SSBBRAIZVWLGGZ-UHFFFAOYSA-N	435.440	1.102	50	20	IDGD	
CN(C)c1nnc(-c2ccc(NC(=O)C(=O)NNC(=O)CCc3ccccc3O)cc2)o1	764281375	VKXCLCLGZDOTRN-UHFFFAOYSA-N	438.444	1.227	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)C(=O)Nc1ccc(C(=O)N2CCCC[C@H]2C)c(Cl)c1	764295754	QLUKYZHLFYVJEP-LLVKDONJSA-N	446.895	1.786	50	20	IDGD	
COc1ccc(NC(=O)c2ccc(NC(=O)C(=O)NNC(=O)c3c[nH]nc3C)cc2)cc1	764297701	VLYWAHHHRQXBHK-UHFFFAOYSA-N	436.428	1.379	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)C(=O)Nc1ccc(C(=O)N2CCc3ccccc32)cc1	764298735	ZNLAKABUTLBIEA-UHFFFAOYSA-N	432.440	1.321	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)C(=O)Nc1ccnc(OCC(F)(F)C(F)F)c1	764314062	RDYTZALYIDDGIV-UHFFFAOYSA-N	446.332	1.829	50	20	IDGD	
CCOCC(=O)NNC(=O)C(=O)Nc1ccc(Oc2ccccc2S(=O)(=O)CC)cc1	764318061	SCEVTMIXNRWBRB-UHFFFAOYSA-N	449.485	1.395	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)C(=O)Nc1cccc(C(=O)N2CCOCC2)c1)c1ccccc1	764331799	HJBCIRLKGWNEEY-LJQANCHMSA-N	438.484	1.439	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)C(=O)Nc1ccc(OC)c(N2CCOC2=O)c1)c1ccccc1	764332225	PQYWXUOIJHYGJT-MRXNPFEDSA-N	440.456	1.932	50	20	IDGD	
O=C(NNc1c(F)cc(C(=O)NC2CC2)cc1F)c1ccc(CN2C(=O)CNC2=O)cc1	764333637	KZWZCYQJSSLGRC-UHFFFAOYSA-N	443.410	1.666	50	20	IDGD	
CCOC(=O)c1cc(-c2ccccc2)ccc1NC(=O)C(=O)NNC(=O)c1cnn(C)c1	764363906	WGHFYVTYNSGBTF-UHFFFAOYSA-N	435.440	1.664	50	20	IDGD	
CC(C)(C)OC(=O)CCC(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	765424713	NCMBXNFHUNBHGS-UHFFFAOYSA-N	438.956	1.727	50	20	IDGD	
O=C(COC(=O)CCC(=O)c1ccc(Cl)cn1)NNC(=O)[C@@H]1COc2ccccc2O1	769185794	QOTHKSFHYGHEKW-KRWDZBQOSA-N	447.831	1.229	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CC(=O)N(c2ccccc2Cl)C1)c1ccc(-n2cnnn2)cc1	769596642	HJWFHALFSGMLIO-CYBMUJFWSA-N	425.836	1.130	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)NCC3(c4ccc5c(c4)OCCO5)CCCC3)nc21	770343272	ZQHDPGJKKNOFCL-UHFFFAOYSA-N	439.476	1.978	50	20	IDGD	
Cn1ncc(C(=O)N2CCN(S(=O)(=O)CBr)CC2)c1Cc1ccccc1	770694654	KWEBQGFMYFYOAO-UHFFFAOYSA-N	441.351	1.451	50	20	IDGD	
COc1c(C)cc(S(=O)(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)cc1C	771607608	OEWGAKNLSDQXKV-UHFFFAOYSA-N	425.894	1.591	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1	772188807	YLHFUFBFTCBTJK-UHFFFAOYSA-N	445.863	1.926	50	20	IDGD	
Cc1c(CC(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)nnn1-c1ccccc1	772898855	TWPVWULQRPSEST-UHFFFAOYSA-N	426.864	1.235	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc23)C1	773411029	HUKIPHOQXXHDQC-NSHDSACASA-N	432.437	1.879	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)CCc2nc(-c3ncccn3)no2)C1	773422031	TZYXUNJPUAZTRW-ZDUSSCGKSA-N	445.480	1.254	50	20	IDGD	
COC(=O)c1cccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)c1C	774010253	WYUFVWZTNMXCRP-LBPRGKRZSA-N	433.848	1.988	50	20	IDGD	
CO[C@H](c1ccccc1F)[C@@H](C)NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	776078323	YKHLVSSCMPZJSG-XIKOKIGWSA-N	427.436	1.793	50	20	IDGD	
COC[C@@H](C)n1ccc(NC(=O)C(=O)NNC(=O)c2cc(C)n(-c3ccccc3)c2C)n1	778706481	RZOOJCXDIVJYMY-OAHLLOKOSA-N	438.488	1.898	50	20	IDGD	
CCOc1ccc(/C=C(\C#N)C(=O)N2CCC[C@@H](S(=O)(=O)N3CCOCC3)C2)cc1	779581873	CIEAIKBCYIOETO-WORNYLJVSA-N	433.530	1.645	50	20	IDGD	
COC[C@H](CNC(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1)OC	781395002	RUYWNKLXDVATMW-LEWJYISDSA-N	426.517	1.605	50	20	IDGD	
CSCc1cccc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1	783016379	YZKRTJDFAZCGGQ-UHFFFAOYSA-N	436.559	1.944	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ccc(Cl)cc2[N+](=O)[O-])cc1-n1nnnc1C	783291911	SPWZFZXIGQDLBQ-UHFFFAOYSA-N	446.811	1.623	50	20	IDGD	
Cc1cc(C)c(NNC(=O)C(=O)Nc2cccc(S(=O)(=O)N3CCOCC3)c2)c(C)c1	783367134	UUAUMDDJEDLJHX-UHFFFAOYSA-N	446.529	1.715	50	20	IDGD	
Cc1cc(C(=O)NC2CCCC2)ccc1NC(=O)C(=O)NNc1ccc(-n2cccn2)nn1	783437150	TZQBMCOWLUTQPZ-UHFFFAOYSA-N	448.487	1.725	50	20	IDGD	
O=C(NNc1ccc(-n2cccn2)nn1)C(=O)Nc1ccc(I)cc1	783437373	ZMIZWYGKPBGKHC-UHFFFAOYSA-N	449.212	1.349	50	20	IDGD	
O=C(NNC(=O)C(=O)N1CCCC1)C(=O)Nc1ccc(Oc2ccc(Cl)cc2)nc1	783996137	DPGCTRIXFIBEIU-UHFFFAOYSA-N	431.836	1.236	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N[C@@H]2CCCN(Cc3ccccn3)C2=O)cc1OC	784177386	RFOVPZXFOWNECF-MRXNPFEDSA-N	427.461	1.234	50	20	IDGD	
COc1cccc(NNC(=O)C(=O)Nc2ccc(NC(=O)CN3CCCCCC3)cc2)n1	784847332	BFLQODKDGBPNAA-UHFFFAOYSA-N	440.504	1.987	50	20	IDGD	
O=C(CCOc1ccccc1I)NNC(=O)NCC(F)(F)F	784874494	OIGIOXSWYFEKLJ-UHFFFAOYSA-N	431.152	1.953	50	20	IDGD	
C[C@H](c1ccccc1)n1ccc(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)n1	785060832	OOMBHIRCADVOKH-OAHLLOKOSA-N	431.456	1.469	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)CC2(N3CCOCC3)CCCC2)cc1OC	786104001	GVQSGNQEBPLRPB-UHFFFAOYSA-N	449.504	1.043	50	20	IDGD	
C[C@H]1[C@@H](C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)CCN1C(=O)OC(C)(C)C	786257418	VSWRALPQNSIVPD-WFASDCNBSA-N	425.507	1.497	50	20	IDGD	
Cc1c(NC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])cccc1N1CCNC1=O	786313272	QSCRQTXVAVDERX-UHFFFAOYSA-N	428.405	1.665	50	20	IDGD	
C[C@]1(NNC(=O)NC[C@@H](C(=O)OCc2ccccc2)c2ccccc2)CCS(=O)(=O)C1	786891189	VVPXIKHPKKLHDP-KNQAVFIVSA-N	445.541	1.895	50	20	IDGD	
O=C(NC[C@@H](O)c1cc(F)cc(Cl)c1)NNC(=O)C1CCN(c2ncccn2)CC1	787857710	JJHXSAOCPIHSIL-MRXNPFEDSA-N	436.875	1.550	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2ccnn2-c2cc(C)ccn2)c2ccccc2c1=O	788299663	CKWBIGBNVZEHGW-UHFFFAOYSA-N	432.444	1.772	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cc(C3(C)CCCC3)on2)cc(OC)c1OC	789730623	UWRHVWLPIIDPHL-UHFFFAOYSA-N	446.460	1.932	50	20	IDGD	
COc1cc(NNC(=O)C(=O)Nc2cccc(OCCS(C)(=O)=O)c2)ccc1Cl	789796873	MSOWNZGKFBMCNU-UHFFFAOYSA-N	441.893	1.854	50	20	IDGD	
COc1cc(C)c(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)cc1OC	789810285	MISIUBJXXDUMMS-KXBFYZLASA-N	427.457	1.671	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNS(=O)(=O)c2cnn(CC(F)F)c2)c1	790053690	RLFFUPBCWBPAKX-UHFFFAOYSA-N	439.238	1.543	50	20	IDGD	
COC(=O)c1nc([C@@H]2CCCN2CC(=O)NNC(=O)c2cccc(C#N)c2)sc1C	791615529	MNFWQMPXJDWKKM-HNNXBMFYSA-N	427.486	1.708	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)c(F)cc1C	793022317	VGEUTRGBAQCQIL-UHFFFAOYSA-N	442.403	1.347	50	20	IDGD	
CN(CC(N)=O)C(=O)c1cccc(NC(=O)C(=O)NNc2c(Cl)cccc2Cl)c1	793027348	CFTBSKYNYWELIX-UHFFFAOYSA-N	438.271	1.633	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C1CCN(c2oc(C)nc2C#N)CC1	793832395	XRRRKRGZLWCTLC-UHFFFAOYSA-N	433.490	1.627	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNS(=O)(=O)c1ccc(Cl)c([N+](=O)[O-])c1	794598322	DTWOTHQOXMYYPA-UHFFFAOYSA-N	442.837	1.484	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CC[C@H]3[C@H](CCN3C(=O)OC(C)(C)C)C2)n1	795126571	DJMISOSLVHXBFM-CABCVRRESA-N	437.566	1.473	50	20	IDGD	
CCOC(=O)c1ccc(OC)c(S(=O)(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1	795281501	YMDMQUDWXCFDNI-INIZCTEOSA-N	436.442	1.021	50	20	IDGD	
CCc1ccc(C(=O)NNS(=O)(=O)c2cc(Cl)cc(C(=O)NC)c2OC)cc1	795282275	DPFBONCBOIVGPI-UHFFFAOYSA-N	425.894	1.894	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2cnc3ccccc3c2)c1	800830545	APMAIRWXWGTUCQ-UHFFFAOYSA-N	434.499	1.108	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(F)c(S(=O)(=O)NC(C)C)c2)cc1	801108407	ICVJLQVFMOLSAA-UHFFFAOYSA-N	436.465	1.221	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)c2c(C)oc(C)c2S(N)(=O)=O)cc1Cl	802071426	FKMPGQCBLWYCQV-UHFFFAOYSA-N	446.869	1.681	50	20	IDGD	
COc1ccc(C2=NO[C@@H](CNC(=O)NNC(=O)c3nnc(O)c4ccccc34)C2)cc1	802359222	IUUUNDIQOOHHGD-CQSZACIVSA-N	436.428	1.481	50	20	IDGD	
COC(=O)c1c(F)cc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1F	802566869	COLPTHREIVTTBY-UHFFFAOYSA-N	443.366	1.337	50	20	IDGD	
NC(=O)c1ccc(/C=C/C(=O)N2CCC[C@@H]2C(=O)NNc2ccc3c(=O)[nH]ccc3c2)cc1	803430891	NJBOAFSYPCOLBP-URZUPRTMSA-N	445.479	1.775	50	20	IDGD	
N#Cc1c(Br)cccc1S(=O)(=O)NNC(=O)COc1ccccc1O	804989399	NANUFYSLRVOQKQ-UHFFFAOYSA-N	426.248	1.415	50	20	IDGD	
COc1ccc(CN2CC[C@H](NC(=O)NNC(=O)CCc3ccccc3)C2=O)c(OC)c1	806028783	MIOXHLYLVQQYKE-IBGZPJMESA-N	440.500	1.768	50	20	IDGD	
CC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cc(Br)cn2C)ccc1F	806976583	HHFNHEZUYRFSPK-UHFFFAOYSA-N	425.214	1.529	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3nccnc3c2Br)cc1	806978049	JZRKEMBHNIQIPU-UHFFFAOYSA-N	439.229	1.664	50	20	IDGD	
Cc1ccccc1[C@@H]([C@H](C)NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)N(C)C	807406508	RWFAGJYZDOAUGX-MGPUTAFESA-N	436.516	1.877	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@H]2CCCSC2)c1	807595746	ZVIAKCXWORHLSS-CQSZACIVSA-N	428.580	1.804	50	20	IDGD	
CN(C)CCCOc1cnccc1CNC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	808348885	UJNWOURDQVVYFO-IBGZPJMESA-N	429.477	1.083	50	20	IDGD	
O=C(C[C@H]1CCCC(=O)N1)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	809560866	SCTCKRCZCQLCSR-GOSISDBHSA-N	433.472	1.208	50	20	IDGD	
Cc1nc(COc2ccc(C(=O)NNc3ccc(S(=O)(=O)N(C)C)cc3)cc2)no1	812732005	QKFFMLYBARRMMN-UHFFFAOYSA-N	431.474	1.964	50	20	IDGD	
COC(=O)c1cn(-c2cccc(NC(=O)NNC(=O)COc3ccccc3F)c2)nn1	812979868	DZYYEQQZVSAXNK-UHFFFAOYSA-N	428.380	1.425	50	20	IDGD	
O=C1CN(Cc2cccc(NC(=O)C(=O)NNc3ccc(C(F)(F)F)cn3)c2)CCN1	812981453	ZXKWRZKXWNXAGT-UHFFFAOYSA-N	436.394	1.114	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)N1CCC2(CCN(Cc3ccccc3)CC2)C1	814295224	RMYDTHWLWPKRHY-UHFFFAOYSA-N	439.516	1.738	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NN=C2CCCc3nc(O)c(C(N)=O)cc32)C1	814973608	INUPVFKXUZRKIZ-LBPRGKRZSA-N	431.493	1.690	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1ccc(Br)c(C2CC2)n1	815569004	CIHBAQXJPXJBKW-UHFFFAOYSA-N	449.261	1.592	50	20	IDGD	
Cc1nnc(-c2cccc(NC(=O)C(=O)NNc3ccccc3S(=O)(=O)N(C)C)c2)o1	815751477	ATHBAWUOKPESIQ-UHFFFAOYSA-N	444.473	1.377	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCO1)C(=O)Nc1ccnn1Cc1c(Cl)cccc1Cl	815778897	JLJXPZHMKXPXKX-CYBMUJFWSA-N	426.260	1.503	50	20	IDGD	
CN(C)NC(=O)Nc1cccc(NC(=O)c2cc(-c3ccco3)nc3c(C(N)=O)ncn23)c1	816406474	RSHHUVGBUVAVME-UHFFFAOYSA-N	448.443	1.939	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)c1cccc(CN2C(=O)CSC2=O)c1	817050928	CXQOFWSTWSGAQY-UHFFFAOYSA-N	448.526	1.889	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)CCCN1CCN(c2ccccc2)CC1	817053417	QKZJVGJTRRJMIT-UHFFFAOYSA-N	445.589	1.982	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)/C=C/C(=O)Nc1ccc2n[nH]cc2c1	817053778	GDARBXNYFQZOQN-MDZDMXLPSA-N	428.474	1.451	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)[C@@H]2CC(=O)N(CCN(C)C)C2)c1	818745468	IWZIHADAWBKWGP-GFCCVEGCSA-N	427.299	1.089	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)/C=C\c2ccc(I)o2)cc1	864017871	GPHJQFNCPAFZKG-VURMDHGXSA-N	437.193	1.995	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)[C@H]1CC(=O)N(c2cc(C)ccc2OC)C1	869780081	NSYIKSQZHPVUHV-INIZCTEOSA-N	441.484	1.982	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CNC(=O)c2ccc([N+](=O)[O-])c(C)c2)cc(OC)c1OC	913415672	JXUJWUJFCRNSBX-UHFFFAOYSA-N	446.416	1.120	50	20	IDGD	
CCCOc1ccc(S(=O)(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1	914845645	GDSZYVHTSLVSPA-UHFFFAOYSA-N	447.922	1.400	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)c2cc(S(=O)(=O)N3CCCC3)c(C)o2)c1	915805946	CKUJOIYJRNQSBP-UHFFFAOYSA-N	435.502	1.829	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)NCc2ccc(S(N)(=O)=O)s2)c1C	915906225	SUKDOFFWSSLQCI-LBPRGKRZSA-N	426.520	1.310	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)NC1CCCCC1	916110691	NEARCTCCKRHLBK-UHFFFAOYSA-N	430.552	1.296	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)NCCNC(=O)c1ccc(Cl)cc1	916262609	KECJQMJRQAJXTD-UHFFFAOYSA-N	435.824	1.387	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)NCCNC(=O)c1ccccc1Cl	916263579	LOKHAKDHOLHFRH-UHFFFAOYSA-N	435.824	1.387	50	20	IDGD	
CN1CCN(Cc2ccc(CNC(=O)NNC(=O)[C@H]3COc4ccccc4O3)cc2)CC1	916387792	GYDMFXWSDXHEPN-OAQYLSRUSA-N	439.516	1.104	50	20	IDGD	
CCCn1c(C)cc(/C=C(/C#N)C(=O)N2CCN(C(=O)C(=O)N3CCCC3)CC2)c1C	916433416	PJSQPUBTZBROKA-HKWRFOASSA-N	425.533	1.715	50	20	IDGD	
O=C(COC(=O)[C@H](CO)NC(=O)c1ccccc1)NN=C(c1ccccc1)c1ccccc1	917500628	WRMAICJTDAQKCS-NRFANRHFSA-N	445.475	1.889	50	20	IDGD	
O=C(NN=Cc1cccc2c1OCCO2)c1cccc(S(=O)(=O)N2CCOCC2)c1	917532945	YIKMIVTXTCKHKA-UHFFFAOYSA-N	431.470	1.243	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1)n1cccn1	918199373	YAELPYWHXLELRA-HNNXBMFYSA-N	427.486	1.384	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1	918217412	CXWXGGHNFRYVRY-UHFFFAOYSA-N	427.436	1.443	50	20	IDGD	
CS(=O)(=O)c1ccc(F)c(C(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)c1	919624099	TYMSOKUTBWZXBO-UHFFFAOYSA-N	428.825	1.501	50	20	IDGD	
CCCS(=O)(=O)CC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	919809354	LNGLJVOWXMHTOI-UHFFFAOYSA-N	445.544	1.135	50	20	IDGD	
CCCCCCn1nc(C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)c2ccccc2c1=O	919883090	ASCVCFQXEYBUKA-AWEZNQCLSA-N	449.533	1.108	50	20	IDGD	
O=C(COC(=O)CNC(=O)c1ccc(F)cc1F)NNC(=O)c1cccc(Cl)c1	919902053	SKOYNFJUUQBPHJ-UHFFFAOYSA-N	425.775	1.352	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NCc2cccc(C(=O)N3CCOCC3)c2)cc1	920812229	VWCVSVMIXCZGSZ-UHFFFAOYSA-N	426.473	1.377	50	20	IDGD	
COCCCNC(=O)NNC(=O)c1ccc(Cl)c(S(=O)(=O)N2CCC[C@@H](C)C2)c1	920862521	PINXOMWZTYIYFH-CYBMUJFWSA-N	446.957	1.741	50	20	IDGD	
CC[C@]1(C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)CCN(C(=O)OC(C)(C)C)C1	1116339878	LCRCOCSFPHJHKL-QFIPXVFZSA-N	444.488	1.900	50	20	IDGD	
Nc1nc(Cl)c(C=NNC(=O)c2cncn2-c2ccccc2)c(N2CCOCC2)n1	1317751163	NZWPQEFNRABDAC-UHFFFAOYSA-N	426.868	1.498	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@H]2CCCCN2Cc2ccncc2)cc(OC)c1OC	1318313813	RUCORNFARJULCT-QGZVFWFLSA-N	428.489	1.923	50	20	IDGD	
COC(=O)c1cc(OC)c(S(=O)(=O)NNC(=O)c2cncn2-c2ccccc2)s1	1318932624	ZAHRTONFSIWZBJ-UHFFFAOYSA-N	436.471	1.352	50	20	IDGD	
O=C(NNc1nccc(N2CCOCC2)n1)c1cccnc1I	1320138904	AUPOMYCMISJMHD-UHFFFAOYSA-N	426.218	1.070	50	20	IDGD	
O=C(CCl)NCCNS(=O)(=O)c1cc(Br)ccc1Br	1336910438	UPONASNADBLZQL-UHFFFAOYSA-N	434.537	1.845	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCCN1S(=O)(=O)c1cccs1)c1n[nH]c2c1CCCC2	1337476610	XATVZGZVQHERGJ-AWEZNQCLSA-N	437.547	1.354	50	20	IDGD	
O=C(NCCc1nnc(-c2ccccc2)o1)NNC(=O)C1CCN(c2ncccn2)CC1	1340929073	MOLNKXMCFLFSIF-UHFFFAOYSA-N	436.476	1.316	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cccc3c1NC(=O)C3)CCO2	1779299035	MLTJNXVKMDTUPH-NRFANRHFSA-N	431.565	1.476	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnncc2C(=O)O)C1	1779691361	FNRNJFQRVDRDPW-JXXFODFXSA-N	438.912	1.710	50	20	IDGD	
Cn1ccc(=O)cc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@](C)(Cl)CCl)C2	1780059145	PWEWRLCFLZQXDA-LSTHTHJFSA-N	444.359	1.749	50	20	IDGD	
COCCCC(=O)N1CCO[C@@]2(CCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1	1780095792	WYZHIJJXHWPOPX-NRFANRHFSA-N	449.460	1.390	50	20	IDGD	
CC(C)(C)n1cc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)nn1	1780354612	UMMYBQXMTZCAOG-BLLLJJGKSA-N	432.294	1.167	50	20	IDGD	
O=C(CCCn1c(O)nc2ccccc21)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Cl)CCO2	1780919496	DSFTXNLBWSAKAC-YLJYHZDGSA-N	438.887	1.886	50	20	IDGD	
Nc1ccccc1/C=C/C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781331037	JMOBSDNGIVWEPL-WXFDERKXSA-N	426.286	1.802	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(O)c([N+](=O)[O-])c3)C2)C1	1781539977	FRAGCOWOWQPNHM-MSOLQXFVSA-N	446.287	1.980	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc3cnccc3[nH]1)C2	1782175346	HUKHDSMKJVZRRD-RRMPHLOHSA-N	434.924	1.944	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)n2cncn2)C1	1782532930	DEHTVALJTUBCEO-LUXYFRNMSA-N	442.358	1.527	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)n2cncn2)C1	1782534316	XYFAADIOXKWUAM-ZOMKSWQUSA-N	428.331	1.136	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cncn3-c3ccncc3)CCO2)C1	1783533217	XKIFWNTWFBROHC-IFXJQAMLSA-N	448.321	1.494	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cccc(F)c1Cl)CCO2	1783935843	YISZTQRKFLGTRD-FQEVSTJZSA-N	440.903	1.296	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3[C@H]4SC=C[C@H]43)C[C@@H]21	1783975122	ZYLGLLLICLTHCU-TYSGWJLXSA-N	429.380	1.872	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](C)Cn3ccnc3)C2)C1	1784495807	ZTHQKSATTJVNGV-IIDMSEBBSA-N	427.343	1.380	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CNC(=O)c3ccco3)C[C@@H]21	1784617626	AILNNRNMLDFCJI-JKQORVJESA-N	425.913	1.397	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)c1	1785112407	HPZFCGWCCNJXRU-BFUOFWGJSA-N	438.322	1.872	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3occc3Br)[C@H]2C1	1787588298	NSMOELBNEVAZPL-VTPLQMEGSA-N	449.729	1.889	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnn4ccccc34)[C@H]2C1	1787854892	WTSSFCQZAFLQSN-HPZZRFSDSA-N	435.322	1.711	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)c1cc(O)nc2ccccc12	1787901111	QZBZFXSIDGRUJS-HZCDGDGTSA-N	433.892	1.133	50	20	IDGD	
O=C(Cc1ccccn1)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1	1788281099	AFEKBVNDKGFBTO-UHFFFAOYSA-N	429.285	1.752	50	20	IDGD	
Cc1cc(CC(=O)Nc2ccc(C3(NC(=O)CCC(=O)NN(C)C)CCC3)cc2)n[nH]1	1789588525	AYFZZIKJZBUCDZ-UHFFFAOYSA-N	426.521	1.768	50	20	IDGD	
Cc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Br)C[C@@H]32)c(O)c1	1791926976	YEJIBNSYECMVKH-MZGVZZPPSA-N	429.286	1.984	50	20	IDGD	
CC(C)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN1CCc3sccc3C1)C2	1792782598	YDUOGFURCUKANA-HGKCTWBKSA-N	440.009	1.961	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(C(N)=O)cc1)C2	1792873233	QEEWVQQKPPVRDS-KSYCFECVSA-N	438.322	1.020	50	20	IDGD	
O=C(Cc1ccc(Br)cn1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCl	1793110912	RPKBWYSXVFWMFN-XGUBFFRZSA-N	430.730	1.625	50	20	IDGD	
CCc1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)n(C)n1	1796892066	XSLJOCSJZCGZEQ-XTUBRDOVSA-N	439.520	1.368	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1cccn2ccnc12	1797456104	QEPZLISLTIFWHF-ZMJPVWNMSA-N	425.258	1.228	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)COCCNC(=O)OC(C)(C)C	1799260266	BCNOAYGVIWEYQR-IVSAIRAKSA-N	447.960	1.135	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1c(F)ccc([N+](=O)[O-])c1C	1799759363	QIXOFLTXCCXZBF-IPJQOSJUSA-N	443.859	1.499	50	20	IDGD	
CCN(CC)C[C@H](C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)CBr)C2	1800218283	NQUKZWYHCWRCOB-BPKGMFCQSA-N	432.403	1.585	50	20	IDGD	
CC(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C#N)=C/c1ccc(F)cc1F	1800330394	PDHZYCOTGVGGPM-IBMUYAKESA-N	433.455	1.886	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(C)nn1CC)C2	1800640000	SBIABZCTTLIJCS-FQLMCAECSA-N	427.343	1.588	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc3c1cnn3C)C2	1800641315	YKTNUGKMDQIWKC-ZDFLXESQSA-N	449.349	1.950	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)n1ccccc1=O)C2	1800641721	IFTIPSUMPFOCPP-LFYQSXPISA-N	440.338	1.172	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(N3CCOCC3)cc1)C2)C(Cl)Cl	1801016310	XNAWKXFYZWUKPW-SCAQPMJSSA-N	442.343	1.530	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(C(N)=O)cc1	1801657064	OZKWXGFCIWCOPX-YGTYGHESSA-N	428.316	1.225	50	20	IDGD	
C[C@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1nc3ccccc3n(C)c1=O)C2	1801962519	MWVHOFSRILMMCJ-FQUUOJAGSA-N	447.333	1.969	50	20	IDGD	
O=C1CC(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](Br)Cc2ccccc2)C3)C1	1802009092	IEXFDHAXTYCUMS-UKBAYJJMSA-N	449.345	1.561	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](O)CCl)C3)C1	1804249190	DNVVLCKTUJLUBN-QKPAOTATSA-N	429.945	1.481	50	20	IDGD	
COc1cc(C(=O)NC[C@H]2CCN(C(=O)C(Cl)Cl)[C@@H]2c2cccnc2)n(C)n1	1804929106	PUNUMWQKTIKTQV-IUODEOHRSA-N	426.304	1.947	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2ccc(F)cn2)[C@@H]1c1cccnc1	1805985673	DKSXSEVWSSBPRL-KKSFZXQISA-N	442.495	1.308	50	20	IDGD	
CCOC(=O)/C=C/C(=O)N1CC[C@H](CNC(=O)CCBr)[C@@H]1c1cccnc1	1806339467	MPVADAMOTIIAEX-BYPNVWOASA-N	438.322	1.992	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)NC[C@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1	1808225373	BILNVEAPSMBVDZ-YCPHGPKFSA-N	440.342	1.319	50	20	IDGD	
C[C@H](NC(=O)c1cnccn1)C(=O)N1CC[C@H](CNC(=O)[C@@H](F)Cl)[C@@H]1c1cccnc1	1808313219	BRVROWUTEOCUFE-JSQNDZKTSA-N	448.886	1.230	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC2(CCCN(C(=O)Cn3ccnc3)C2)CC1	1808610243	NYLCTFAKOVVTSY-KOEQRZSOSA-N	439.520	1.248	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)c1cn2ccsc2n1	1809938547	OJTRPGXXOFEXSQ-CWRNSKLLSA-N	433.921	1.710	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)[C@@H]3CNc4ccccc43)CC2)C1	1809966633	IOSDJWPPACWGHJ-OAQYLSRUSA-N	447.344	1.421	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)c2ccco2)[C@H]1c1cccnc1	1810297760	DLPLOYVHLVCIEY-BEFAXECRSA-N	434.456	1.307	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H](CNC(=O)c2ccnnc2O)[C@H]1c1cccnc1	1811220634	DMMUJDYYQKGCAG-XNRPHZJLSA-N	448.321	1.928	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)Cn2cccn2)[C@H]1c1cccnc1	1813028513	RPMFRCGGUOMTBZ-WNHJNPCNSA-N	433.940	1.874	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2c(O)cc(O)cc2O)[C@@H]1c1cccnc1	1813034498	NXKZISLCDGVYHC-FRIZHTMISA-N	449.891	1.772	50	20	IDGD	
N=C(N)SCCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCBr)CC2	1814938963	DPGOSWHEDWBELK-MRVPVSSYSA-N	434.385	1.857	50	20	IDGD	
Cc1cccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)n1	1816393586	NVQDOCGQOJIJSL-IBGZPJMESA-N	433.277	1.413	50	20	IDGD	
COCCOCCOCCC(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](F)Cl)sc2C1	1817133433	FRXBLYWENBSSRD-XHDPSFHLSA-N	437.921	1.659	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)Cc2ccccn2)n[nH]1	1817642887	VAYUQLJSJJSSJT-QGZVFWFLSA-N	427.509	1.413	50	20	IDGD	
Cn1cc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@@H](O)CCl)CC3)c(C(F)F)n1	1817823845	RNZQNLJFDAWYAD-XVKPBYJWSA-N	433.868	1.640	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnc(O)nc2O)n[nH]1	1818022088	FTUUUSOHJZWQIB-KWQFWETISA-N	439.270	1.700	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccon2)[nH]n1	1818111409	JSCNRELAVODYOS-PDYUXYPTSA-N	438.448	1.838	50	20	IDGD	
COc1ccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)cc1	1820570269	RKCLQESDPOQZQZ-HXUWFJFHSA-N	448.288	1.718	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3ccccc3C(N)=O)sc2C1	1823451158	QJWKFJNXVORTRQ-GXFFZTMASA-N	436.921	1.722	50	20	IDGD	
O=C1CCc2ccc(C(=O)N3CCC([C@H]4CCCCN4C(=O)[C@@H](O)CCl)CC3)nc2N1	1824182531	FLIXSBBCWIGBIH-MSOLQXFVSA-N	448.951	1.799	50	20	IDGD	
Cc1onc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)c1C	1824750108	NMJQKXLMKREYCD-FQEVSTJZSA-N	439.321	1.518	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CSCC(=O)OC)CC2	1825994107	HVEJHVVPVJMZAM-NXEZZACHSA-N	435.955	1.215	50	20	IDGD	
COC(=O)NCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](C)CBr)CC2	1826495323	MYNMJMJLZUTSKY-BDAKNGLRSA-N	433.328	1.442	50	20	IDGD	
COC(OC)C(=O)N1CCC([C@H]2CCCCN2C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)CC1	1827677118	IGWOEFGZWPOBOH-LSPPGFKNSA-N	447.536	1.359	50	20	IDGD	
Cc1cc2cc(C(=O)N3CCOC[C@]4(C3)CN(C(=O)[C@@H](O)CCl)CCO4)ccc2[nH]1	1830735341	HHVMPQGFNDVFFY-RXVVDRJESA-N	435.908	1.146	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)Cc3ccccc3)C2)C1	1831657446	OHSWJOODWRGATN-IPJJNNNSSA-N	438.952	1.454	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2c[nH]c(=O)cn2)CC1	1831661384	QRKGBQYMXASIKL-DOMZBBRYSA-N	425.327	1.787	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CCCCC1(F)F)CCO2	1831726428	KRDGPXKNZVPRQM-RLFYNMQTSA-N	438.899	1.522	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ncc(F)cc3F)CCO2)C1	1831968547	WUHOZEDJJXTLIK-PIGZYNQJSA-N	448.264	1.213	50	20	IDGD	
C[C@@H](C(=O)NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1)n1ccnc1	1833375240	BAQXTVBAYYARIF-HNNXBMFYSA-N	440.386	1.801	50	20	IDGD	
Cc1ccsc1C(=O)N1CCO[C@@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1	1833948317	OVBAKBXGODWTDF-LJQANCHMSA-N	426.611	1.978	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)s1	1833959371	QUGATDUYCJXSTO-DYVFJYSZSA-N	431.352	1.910	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)[C@H](C)S)CC2)CC1	1835118087	OWVQTQZBUQLQLT-BGHCKBSUSA-N	448.593	1.010	50	20	IDGD	
O=C(c1cnc(C(F)(F)F)cn1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1836375638	OCLOWABPZHRVOE-IUODEOHRSA-N	440.781	1.100	50	20	IDGD	
C[C@@H]1CC[C@H](C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](C)CBr)C3)C2)O1	1836601902	UBLBISDUZKYHKG-LUXYFRNMSA-N	433.343	1.041	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC(OC2CCN(C(=O)Cn3cccn3)CC2)CC1	1836670172	BHTNATIQOUDOOD-OAHLLOKOSA-N	441.370	1.913	50	20	IDGD	
O=C(c1ncc(F)cc1F)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836713767	KQOQQUICIUUVLE-INIZCTEOSA-N	431.867	1.572	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)CN3CCOCC3)CC2)CC1	1836918868	KFPRNIMQMIKHIM-LJQANCHMSA-N	429.989	1.725	50	20	IDGD	
COc1cccc(C(=O)N2CCOC[C@@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)c1	1837715092	VIULRKUGSPFFGM-OAQYLSRUSA-N	436.581	1.617	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3nc[nH]c3[N+](=O)[O-])CC2)CC1	1838093118	ABELGUGLNZSZLT-CQSZACIVSA-N	443.888	1.184	50	20	IDGD	
COc1cc(OC)c(F)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)c1	1838552364	CHNGRRTUCVIYNM-APWZRJJASA-N	448.850	1.447	50	20	IDGD	
O=C(Cc1cc[nH]n1)N1CCC(OC2CCN(C(=O)[C@H](F)Br)CC2)CC1	1838647952	AWELGLWUNLYQND-INIZCTEOSA-N	431.306	1.641	50	20	IDGD	
CC(C)c1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)CCBr)C3)C2)on1	1838774820	XNDSOPIUFXZUBV-SFHVURJKSA-N	444.326	1.653	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CSc3ncccn3)C2)C1	1839143670	DTOGPWNMWQDGKM-KBXCAEBGSA-N	428.942	1.043	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnn4cccc(F)c34)C2)C1	1839148076	LOYVMMSOBRVYPK-FOIQADDNSA-N	438.887	1.561	50	20	IDGD	
C[C@H]1CC[C@H](C(=O)N2CCOC[C@@]3(CN(C(=O)[C@@H](F)Br)CCO3)C2)CC1	1839203467	LWPVUAPKWDLLGO-ADAWSYLGSA-N	435.334	1.960	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc4c(c3)NC(=O)CC4)CCO2)C1	1839609268	ATTXUKGYKCLCGC-JTSKRJEESA-N	449.935	1.659	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@]3(C)CC3(F)F)C2)C1	1840035803	GNLGNOKPBWPKEL-CQDKDKBSSA-N	425.270	1.272	50	20	IDGD	
Cc1ccc(C(=O)C(=O)N2CCO[C@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)cc1	1840097065	URFZUCYBHMLWQJ-JOCHJYFZSA-N	436.936	1.899	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3scnc3C3CC3)C2)C1	1840151060	VPFRULCSHWOTSM-IFXJQAMLSA-N	443.953	1.344	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)Oc3ccccc3)C2)C1	1840154774	FVFMTFWVLURMQY-PLMTUMEDSA-N	440.924	1.164	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)cc(C)c1O	1840190881	SIUFJDHZUBAVFB-IBGZPJMESA-N	431.316	1.883	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccc(O)cn3)CCO2)C1	1840494864	XAYCXULENRBPMM-YLJYHZDGSA-N	425.913	1.194	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H]1C(=O)N1CCCC12CN(C(=O)[C@H](O)CCl)C2	1841474217	XUELNKKHSIGQJB-RRFJBIMHSA-N	429.945	1.483	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1ccc(N(C)C)cn1)C2	1843415460	JRZYMBZTZJCBOY-MFKUBSTISA-N	437.504	1.099	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)[C@@H](C)Cc1ccco1)C2	1843417349	YSGFTTSESZAJFW-HXNWEGJNSA-N	425.489	1.796	50	20	IDGD	
Cn1c(=O)n(CC(=O)N2CCCC23CN(C(=O)CCBr)C3)c2ccccc21	1843859493	LFWFBVGPDZQBFD-UHFFFAOYSA-N	435.322	1.328	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)c2cc(OC)c(O)cc2[N+](=O)[O-])C1	1844738073	HAJYSPTVBGIQFT-LBPRGKRZSA-N	427.841	1.380	50	20	IDGD	
O=C([C@@H](O)CCl)N1CC2(CCCN2C(=O)c2cc(Br)c(O)cc2F)C1	1844743849	JWDNDEPWGFGRGE-ZDUSSCGKSA-N	435.677	1.711	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCCC12CN(C(=O)c1cc3n(n1)CCCNC3=O)C2	1846070634	VALZNRKGOXGBRX-GFCCVEGCSA-N	438.326	1.007	50	20	IDGD	
CC(C)(C)NCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1848099635	QPYGJCLWYWAFAR-KKUMJFAQSA-N	430.977	1.708	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=O)c2ccc3c(c2)OCCO3)c1	11055685	OVSBPJVEWSLROA-UHFFFAOYSA-N	439.877	1.436	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc1OC	15948186	DEEJYQMJHJQACP-UHFFFAOYSA-N	447.513	1.953	50	20	IDGD	
O=C(COC(=O)COc1ccc(N2CCCC2=O)cc1)NNC(=O)c1ccc(Cl)cc1	16465025	MMGCFQLXSLYHBA-UHFFFAOYSA-N	445.859	1.850	50	20	IDGD	
Cc1cc(OCC(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)no1	17633459	JVYQTYJVHQGNCD-UHFFFAOYSA-N	433.428	1.525	50	20	IDGD	
COc1ccc(-c2nnc(S)n2CC(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1	21904202	JRCXMCDXOVZWGH-UHFFFAOYSA-N	441.469	1.475	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)Cc1ccc(F)cc1	28663131	OCCJUOYAJLLTSI-UHFFFAOYSA-N	449.504	1.169	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2nccn2C(F)F)c1	726708816	HVJNWNKLVGNIHG-UHFFFAOYSA-N	444.464	1.453	50	20	IDGD	
CCCC(=O)N1CSC[C@@H]1C(=O)NNC(=O)c1ccc(CSc2nncn2C)cc1	727364033	JDLKNSKDCNIOJT-OAHLLOKOSA-N	448.574	1.570	50	20	IDGD	
CCOc1ccc(C(=O)CCC(=O)N([C@H]2CCS(=O)(=O)C2)N(C)C)cc1OCC	728179619	NFCYONMZBWHUDF-INIZCTEOSA-N	426.535	1.939	50	20	IDGD	
C[C@H]1CCCCN1S(=O)(=O)c1cccc(C(=O)N([C@@H]2CCS(=O)(=O)C2)N(C)C)c1	728180713	WVDVSNFQJNZAJQ-DOTOQJQBSA-N	443.591	1.356	50	20	IDGD	
O=C(NNC(=O)C(O)(c1ccccc1)c1ccccc1)C1CCN(c2ncccn2)CC1	728981759	ZLNIMFPGMFHRCK-UHFFFAOYSA-N	431.496	1.777	50	20	IDGD	
COc1cccc2c1OC[C@@H](NC(=O)NNC(=O)C1CCN(c3ncccn3)CC1)C2	729051849	AAGYKSXDFBVAHJ-INIZCTEOSA-N	426.477	1.036	50	20	IDGD	
CC(C)OCCCn1c(NNC(=O)CCN2C(=O)CCC2=O)nc2ccccc2c1=O	729279978	ZIHBBMLKUXLOCF-UHFFFAOYSA-N	429.477	1.194	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)CN2C(=O)N[C@](C)(c3ccc(C)cc3)C2=O)cn1	729692164	MWXCDRMOLJOWNW-HXUWFJFHSA-N	442.501	1.183	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Cc2coc(-c3cccs3)n2)cc1	729965868	FSZHHKHWFMGNIZ-UHFFFAOYSA-N	448.526	1.722	50	20	IDGD	
Cn1c(CCC(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)nc2ccccc2c1=O	729988601	IOZQOGMLYPBGGU-UHFFFAOYSA-N	442.859	1.524	50	20	IDGD	
C[C@@H]1CCCN(S(=O)(=O)c2cc(C(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)n(C)c2)C1	730205029	ALOWUXPOOXUSSY-CYBMUJFWSA-N	449.489	1.429	50	20	IDGD	
C[C@@H]1CCCN(S(=O)(=O)c2cc(C(=O)NNC(=O)c3ccc(Cl)nc3)n(C)c2)C1	730209494	CQZHRRBCVVYTBM-GFCCVEGCSA-N	439.925	1.569	50	20	IDGD	
CCS(=O)(=O)N[C@H](CCSC)C(=O)NNc1nc(-c2ccc(Cl)cc2)no1	732976854	NCXHAAUWGXVAHU-GFCCVEGCSA-N	433.943	1.894	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)CN1C(=O)[C@@H]2[C@@H](C1=O)[C@H]1C=C[C@H]2C1	734251882	RHMKLOQNIRSQLC-LUVWLHFXSA-N	446.529	1.014	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCC[C@H](CN3CCC(C)CC3)C2)cc1OC	735871462	PBADKOKNZBZSTI-GOSISDBHSA-N	432.565	1.909	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)c2cn(C)c3nc(C)ccc3c2=O)cc1C	736827046	WNKRZWOTBNHTCO-UHFFFAOYSA-N	442.497	1.792	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(F)cc2)C1	737636734	XDILBIAMJWXXPC-QGZVFWFLSA-N	449.504	1.591	50	20	IDGD	
O=C(COC(=O)c1cc(O)nc2cc(F)ccc12)NNC(=O)[C@H]1COc2ccccc2O1	740258816	OIRNSHSFTZIZMQ-QGZVFWFLSA-N	441.371	1.224	50	20	IDGD	
COCCNS(=O)(=O)c1c[nH]c(C(=O)NNC(=O)c2cc3c(s2)CC[C@H](C)C3)c1	741144666	YVMCCRPANYURLF-NSHDSACASA-N	440.547	1.201	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H](Cn2cccn2)c2ccccc2)c1	741425361	JRPFNOQFGHJKAG-GOSISDBHSA-N	427.486	1.672	50	20	IDGD	
CC(=NNC(=O)c1cc([N+](=O)[O-])ccc1O)c1cccc(S(=O)(=O)N2CCOCC2)c1	741773467	CUFAHEMTHZJWHO-UHFFFAOYSA-N	448.457	1.475	50	20	IDGD	
Cc1nn(C)c(C)c1S(=O)(=O)N[C@H](C)C(=O)NNC(=O)c1c(Cl)cccc1Cl	742063728	JDVIDSPKIVUWAK-SECBINFHSA-N	448.332	1.472	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)c1cc(N2CCNC2=O)ccc1Cl	742077117	RFTNFHGSMMFOOY-UHFFFAOYSA-N	440.888	1.338	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)CCCC2)c1cccc(S(=O)(=O)N2CCOCC2)c1	743798094	NIJBVBUVXBKFTI-UHFFFAOYSA-N	443.525	1.661	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)c2cnc3n(c2=O)CCS3)cc1Cl	743836258	OLVWYEJVQUMZKL-UHFFFAOYSA-N	425.854	1.486	50	20	IDGD	
Cc1nn(C)c2nc(C3CC3)cc(C(=O)OCC(=O)NNC(=O)c3ccc(C#N)cc3)c12	744542954	CWMJKLULWJSSEF-UHFFFAOYSA-N	432.440	1.644	50	20	IDGD	
CC(C)(C)OC(=O)N1CCCC[C@H]1C(=O)OCC(=O)NNC(=O)c1cccc(C#N)c1	744885118	ZZBFJDXWEFDXSL-INIZCTEOSA-N	430.461	1.652	50	20	IDGD	
C[C@H]1C[C@@H](NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)C(=O)N1c1ccccc1	745881751	LWUJVSFAEJCYEE-SUMWQHHRSA-N	434.456	1.072	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)c2cc(S(=O)(=O)N3CCCC3)ccc2O)c(C)c1	745988888	DKNTXBRWXWJAIV-UHFFFAOYSA-N	446.529	1.667	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)[C@H]1CCCN(C(=O)NC2CCCC2)C1	746094394	IODPAIOZZMIDBA-INIZCTEOSA-N	432.521	1.976	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)[C@@H]2CCCN2Cc2ccccn2)CC1	746271964	QMQQTKKMLPPJNN-SFHVURJKSA-N	446.552	1.776	50	20	IDGD	
O=C(NN=Cc1cnc2cnccn12)c1cccc(S(=O)(=O)NCc2ccccc2)c1	746367040	UMHHXYLLDHLMGX-UHFFFAOYSA-N	434.481	1.972	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)[C@@H]2CCCN2C(=O)/C=C/c2ccc(C(N)=O)cc2)cc1	747173230	ZIZBITIFYLJWNO-UBIUBJKMSA-N	431.452	1.123	50	20	IDGD	
CCN(CC(C)(C)O)C(=O)/C(C#N)=C/c1cn(CCC(N)=O)nc1-c1ccc(OC)cc1	747417399	RSNJJIKLVUITPJ-SFQUDFHCSA-N	439.516	1.960	50	20	IDGD	
C[C@H](CC(=O)NNC(=O)c1ccc(Cl)cc1F)/N=C1/NS(=O)(=O)c2ccccc21	747431878	RVJCHUMHSWUILT-SNVBAGLBSA-N	438.868	1.757	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)Nc2nccs2)cc1)c1cnc2sccn2c1=O	747944918	YZOSUDLEFNKPLD-UHFFFAOYSA-N	448.511	1.770	50	20	IDGD	
O=C(NNC(=S)NC[C@H]1CCOC1)c1cccc(S(=O)(=O)NCc2ccccc2)c1	749694971	ZQFQYKMLURTPOD-MRXNPFEDSA-N	448.570	1.311	50	20	IDGD	
COc1cc(N2C[C@H](C(=O)NNC(=O)CCc3ccccc3)CC2=O)cc(OC)c1OC	749801195	XFTPKGOVSUIEJQ-MRXNPFEDSA-N	441.484	1.846	50	20	IDGD	
O=C(NNc1nc(Br)cn2ccnc12)[C@@H]1CCCN(C(=O)c2ccncc2)C1	750248718	SQYVDVRNTNYZFX-CYBMUJFWSA-N	444.293	1.882	50	20	IDGD	
CCn1cnc2c1c(=O)n(CC(=O)NN=C(C(C)C)C1CC1)c(=O)n2Cc1ccccc1	750922488	OAQLYJJEVOIQSP-UHFFFAOYSA-N	436.516	1.966	50	20	IDGD	
COC(=O)c1ccc(Cl)cc1S(=O)(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	751270371	UMOPDIUTTXBJJI-UHFFFAOYSA-N	446.890	1.153	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)NCc2ccc(S(=O)(=O)NC[C@@H]3CCCO3)cc2)o1	752364984	QOZYUEWVPJQLBO-HNNXBMFYSA-N	436.490	1.190	50	20	IDGD	
COc1cc(OC)cc(N2C[C@@H](C(=O)NNC(=O)c3cc(Cl)ccc3O)CC2=O)c1	752789171	KQTCUINMAHRVSI-NSHDSACASA-N	433.848	1.877	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)Nc2cccc(S(=O)(=O)N(C)C)c2)cc1	755368508	YGDJFEVAEDKAEV-AWEZNQCLSA-N	448.501	1.760	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)c1ccc2nc[nH]c2n1	755516433	GSXAIEBNRUADFJ-UHFFFAOYSA-N	427.896	1.190	50	20	IDGD	
O=C(NNC(=O)c1ccccc1F)Nc1ccc(F)c(S(=O)(=O)N2CCOCC2)c1	756031267	LIYUAPNLCRXYRM-UHFFFAOYSA-N	440.428	1.452	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2ccccc2Cn2cncn2)c2ccccc2c1=O	756152704	QYSPPKIWSPZJCX-UHFFFAOYSA-N	432.444	1.523	50	20	IDGD	
CN(C1CC1)S(=O)(=O)c1ccc(NC(=O)NNC(=O)COc2ccc(C#N)cc2)cc1	756400863	FQEASFGHZOVDIY-UHFFFAOYSA-N	443.485	1.573	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CNC2(c3ccc(F)cc3)CCOCC2)cc1OC	756586230	OKFPPWVUNYDLDZ-UHFFFAOYSA-N	431.464	1.899	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)N2CCN(c3nc(N)ns3)CC2)c(C)n1C[C@@H]1CCCO1	758588853	LRTAIVWYNHKTOG-RLGUWMIQSA-N	441.561	1.973	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)NNC(=O)C(=O)Nc1ccnn1Cc1ccc(F)cc1	760278590	ZVAFTQOWVLJKSD-UHFFFAOYSA-N	434.431	1.880	50	20	IDGD	
C[C@H](C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)c1cccc([N+](=O)[O-])c1	761402155	SZGIXNTZVTUKTJ-AWEZNQCLSA-N	446.485	1.944	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)C(=O)NCc3ccc(F)cc3)n[nH]2)cc1OC	763153344	ZFYIBLJVSCFFHR-UHFFFAOYSA-N	441.419	1.310	50	20	IDGD	
CCC(=O)NNC(=O)C(=O)Nc1ccc(F)cc1-c1nc(CCOc2ccccc2)no1	763440443	FKJSWRWZJSCHIL-UHFFFAOYSA-N	441.419	1.993	50	20	IDGD	
CCOc1ccc(C(=O)N2CCCCC2)cc1NC(=O)C(=O)NNC(=O)c1ccncc1	763462583	PMGBRVPUKPHHQW-UHFFFAOYSA-N	439.472	1.506	50	20	IDGD	
O=C(NNC(=O)c1ccccn1)C(=O)Nc1cc(-c2nnc3n2CCCCC3)ccc1F	763468389	XZXYMNGJXMBVSF-UHFFFAOYSA-N	437.435	1.605	50	20	IDGD	
O=C(CN1CCCCCC1)Nc1cccc(NC(=O)C(=O)NNC(=O)c2cccnc2)c1	763488580	MLHTYRSYKYRZSC-UHFFFAOYSA-N	438.488	1.296	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)CCCOc2ccc(Cl)cc2C)c(=O)n(C)c1	763510912	VQONMZGALXDADJ-UHFFFAOYSA-N	434.880	1.601	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)nn1-c1cccc(F)c1	763572476	ROXQCXHHGHERNW-KRWDZBQOSA-N	439.403	1.246	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)Nc1cc(F)ccc1Br	763579099	UPNNBMJSJPOBDW-CQSZACIVSA-N	438.209	1.514	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)N1CCc2ccc(Br)cc21	763625920	ZVNUSLJCAZTVEO-UHFFFAOYSA-N	442.273	1.756	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2F)n(-c2ccccc2F)n1	763678364	DSQQXLSUVBNWLO-UHFFFAOYSA-N	429.383	1.624	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(C)n([C@H](C)C2CC2)n1	763685336	TXEOWFOZVBBPRI-CQSZACIVSA-N	429.477	1.726	50	20	IDGD	
O=C(CC12CC3CC(CC(C3)C1)C2)NNC(=O)C(=O)Nc1cccc(N2CCNC2=O)c1	763732323	FBFAORMDOQIUJP-UHFFFAOYSA-N	439.516	1.909	50	20	IDGD	
O=C(NNC(=O)c1cccc(Cl)c1)C(=O)Nc1ccc2nc3n(c(=O)c2c1)CCC3	763752559	ICBZMPLBAHZGOT-UHFFFAOYSA-N	425.832	1.396	50	20	IDGD	
COC(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)c1	763809587	XDVSZBUDIGDCSM-UHFFFAOYSA-N	430.804	1.163	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)COc2ccc(C)cc2)sc2c1CCC2	763819827	FALCHKGJRCYZQT-UHFFFAOYSA-N	445.497	1.887	50	20	IDGD	
O=C(CCCCOc1ccc(Br)cc1)NNC(=O)CNC(=O)c1cccnc1	763821875	YLGHYZNCVLUOMO-UHFFFAOYSA-N	449.305	1.971	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc3ccccc3c2)nn1CCC#N	763856145	YQGLKKZJVBLDQU-HNNXBMFYSA-N	434.456	1.812	50	20	IDGD	
Cc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccccc1F	763859211	ZAOVPPVNVNHLPN-CYBMUJFWSA-N	430.436	1.389	50	20	IDGD	
COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NNC(=O)c1ccc(OC(C)C)c(OC)c1	763915707	FOOWJLRPQHXXES-UHFFFAOYSA-N	446.416	1.799	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cnn(C[C@H]3CCCO3)c2)ccc1OC(C)C	763916374	NZSBMNHXJCNRFD-MRXNPFEDSA-N	445.476	1.258	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3cccc(S(C)(=O)=O)c3)cc2C1	763942018	LNIGCTMIMKDXJZ-LLVKDONJSA-N	435.527	1.676	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc1C	763945546	ZFVLBYFLHLRTLO-UHFFFAOYSA-N	437.412	1.073	50	20	IDGD	
CCOc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NNC(=O)c1cc(Cl)ccc1O	763976844	GBUVVNDHEGPBQL-UHFFFAOYSA-N	448.863	1.546	50	20	IDGD	
CS(=O)(=O)Nc1cc(C(=O)NNC(=O)CSc2ccccc2O)ccc1Cl	764045238	GCGPPBSECBEQHI-UHFFFAOYSA-N	429.907	1.970	50	20	IDGD	
Cc1ccc2cccc(NC(=O)C(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)c2n1	764077760	NDPWVRXFXNUEEY-UHFFFAOYSA-N	426.454	1.346	50	20	IDGD	
CC[C@H](C)C(=O)NNC(=O)C(=O)Nc1cc(NC(=O)CN2CCCC[C@@H]2C)ccc1F	764084644	VNDKKYAXANYIDP-KBPBESRZSA-N	435.500	1.771	50	20	IDGD	
O=C(NNC(=O)c1ccc(F)cc1Br)C(=O)Nc1ccnn1-c1ccncc1	764085624	NDNZCHLHOCXEFT-UHFFFAOYSA-N	447.224	1.569	50	20	IDGD	
CCCS(=O)(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)nc2)c1	764101363	PXVXZAVXENJUSE-UHFFFAOYSA-N	439.881	1.286	50	20	IDGD	
CCC(C)(C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cccc(OC)c2O)cc1	764132765	XIDFEDMIUYZTSK-UHFFFAOYSA-N	442.472	1.719	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)C(=O)Nc1ccc(C(=O)NC2CCCC2)cc1	764287986	BRPLKGWVERNPMW-UHFFFAOYSA-N	438.484	1.783	50	20	IDGD	
Cn1cc(NC(=O)C(=O)NNC(=O)c2cc3ccccc3o2)cc(Br)c1=O	764331106	MQFKNYAYSSWSQO-UHFFFAOYSA-N	433.218	1.294	50	20	IDGD	
CCOC(=O)c1cc(C)sc1NC(=O)C(=O)NNC(=O)c1cnn(-c2ccccc2)c1	764343001	LOVGVCMHLIGXKV-UHFFFAOYSA-N	441.469	1.819	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1cnn(-c2ccccc2)c1	764394184	XXHRYPWHMVSJOQ-UHFFFAOYSA-N	425.470	1.759	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)c3cc(S(=O)(=O)NC)oc3C)n[nH]2)cc1	765572067	UTUYXZBXZPZJQP-UHFFFAOYSA-N	431.474	1.523	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H](NC(C)=O)C2CCCC2)c1	766064037	JEDMFDRPVXBXLS-GOSISDBHSA-N	438.550	1.173	50	20	IDGD	
NC(=O)COc1ccc(Cl)cc1S(=O)(=O)NNC(=O)c1cccc2ccccc12	766323415	VHDZKOKOAFECPH-UHFFFAOYSA-N	433.873	1.981	50	20	IDGD	
O=C(COc1ccccc1O)NNS(=O)(=O)c1ccc(OC[C@H]2CCOC2)c(F)c1	767764650	FSRLIZDCMRYKCA-ZDUSSCGKSA-N	440.449	1.335	50	20	IDGD	
O=C(NNC(=O)c1ccccn1)C(=O)Nc1ccc(Cc2nnc3n2CCCCC3)cc1	768233264	MALHZSJXAYXVQH-UHFFFAOYSA-N	433.472	1.390	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2ccc(C(=O)O)cc2Cl)c1	768499059	VRVVIZJJWVBKBY-UHFFFAOYSA-N	432.863	1.065	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)CN2C(=O)N[C@@]3(CCCC(C)(C)C3)C2=O)cc1	768561717	DVQXSSWEEUUWHO-JOCHJYFZSA-N	430.505	1.666	50	20	IDGD	
COc1ccc(-n2c(C)nnc2SCC(=O)NNC(=S)NCCSC)cc1	770246890	JYUMUTZMALVAIX-UHFFFAOYSA-N	426.593	1.535	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)NCCS(=O)(=O)c1ccccc1	770279049	SINXMXRXUWEBSU-CYBMUJFWSA-N	425.894	1.912	50	20	IDGD	
C[C@H]1C[C@@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)CCO1	770353480	CCEGPAWNPZSSEH-YJBOKZPZSA-N	446.529	1.677	50	20	IDGD	
CCNS(=O)(=O)c1ccc2c(c1)N(C(=O)C(=O)NNc1c(F)cccc1Cl)CC2	770810079	GHYZYPMCFQTVKE-UHFFFAOYSA-N	440.884	1.810	50	20	IDGD	
CC(=NNC(=O)C(=O)NCc1ccc(Cl)cc1)c1cccc(OCC(=O)N(C)C)c1	771567552	HZDSTODRMLFGQG-UHFFFAOYSA-N	430.892	1.964	50	20	IDGD	
Cc1ccc(S(=O)(=O)NC2CC2)cc1C(=O)O[C@H](C)C(=O)NNC(=O)CC(C)C	771969364	FIFWAHNSYUESGX-CYBMUJFWSA-N	425.507	1.175	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)c1ccnc(O)c1Br	772516879	DWWNMNOXQDUKEF-UHFFFAOYSA-N	427.642	1.281	50	20	IDGD	
O=C(C[C@H](O)c1cccc(F)c1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	772556126	USGFPLIZLUCOPK-SFHVURJKSA-N	435.477	1.495	50	20	IDGD	
CCS(=O)(=O)N[C@@H](CCSC)C(=O)NNC(=O)[C@H](C)Oc1cccc(Cl)c1	772964966	AEDWJVZMMXESQY-FZMZJTMJSA-N	437.971	1.316	50	20	IDGD	
Cn1nc(-c2cc(F)cc(F)c2)cc1NC(=O)C(=O)NNC(=O)[C@H]1Cc2ccccc2O1	773540052	GVYPIUGJSQMSNF-QGZVFWFLSA-N	441.394	1.455	50	20	IDGD	
C[C@@H](NCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)c1cccc(N2CCOC2=O)c1	775262719	CXFYXICULIGZRO-CYBMUJFWSA-N	427.417	1.663	50	20	IDGD	
COCCO[C@@H]1COCC[C@@H]1NC(=O)NNC(=O)c1cc(F)ccc1Br	777276531	XMXVQKARZSNAPZ-UONOGXRCSA-N	434.262	1.353	50	20	IDGD	
Cc1ccc(-c2nnc(S)n2CCC(=O)NNC(=O)CNC(=O)OC(C)(C)C)cc1	778432924	CZMGXJATAUAUJJ-UHFFFAOYSA-N	434.522	1.604	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)N2CCC[C@@H]2C(=O)NNc2cccc(OC)n2)o1	780768750	DKXGSWZCKIELPD-GFCCVEGCSA-N	438.462	1.156	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)CCNS(=O)(=O)c2ccc3c(c2)OCCCO3)c1	780789568	GSHVDJZFOXSHBL-UHFFFAOYSA-N	449.485	1.446	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc2c(c1)OCCCO2)NNc1ncncc1Cl	781819816	LRBPJVCLRPGKPE-UHFFFAOYSA-N	427.870	1.103	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)[C@H]1CC(c2ccccc2[N+](=O)[O-])=NO1	782043481	YHEORBYZHJILEW-MRXNPFEDSA-N	445.819	1.205	50	20	IDGD	
CC(=O)N1CCN(Cc2ccccc2NC(=O)NNC(=O)c2c(C)nc3ccccn23)CC1	782079170	RNTZUSIFGYRNSD-UHFFFAOYSA-N	449.515	1.773	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)NC(C)(C)C)ccc1F	782117885	QSTOWKQZSCFMHV-UHFFFAOYSA-N	438.481	1.993	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(OC3COC3)cc2)cc1OC	782121407	XWGWLAGYVSMZJF-UHFFFAOYSA-N	443.456	1.661	50	20	IDGD	
Cn1cc(CNC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c(-c2ccccc2)n1	782535972	KLYZEPVCWDRPTB-UHFFFAOYSA-N	427.486	1.635	50	20	IDGD	
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC(=O)C(=O)NN=c1cc[nH]cc1	783378306	DMQXHRTXUHMSBU-UHFFFAOYSA-N	435.440	1.855	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)C(=O)Nc1cccc2c1OCCC2=O	784216750	PGZXILFRKFTZRO-UHFFFAOYSA-N	444.469	1.174	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)C2CN(C(=O)OC(C)(C)C)C2)cc1	784586189	TXVFZUAHDJNIJE-UHFFFAOYSA-N	446.533	1.735	50	20	IDGD	
CNS(=O)(=O)CCNC(=O)NNC(=O)c1cc(-c2ccc(C)cc2)nc2ccccc12	784663413	NXHZUVSMWJLOCN-UHFFFAOYSA-N	441.513	1.703	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)Cc3ccc4c(c3)NC(=O)C4)n[nH]2)cc1OC	784683872	JSUQXUNGCXKXHO-UHFFFAOYSA-N	435.440	1.592	50	20	IDGD	
O=C(NNc1ccccc1Cl)C(=O)Nc1cc(C2CC2)nn1[C@@H]1CCS(=O)(=O)C1	784770252	DWRUVGUEGOEDFC-GFCCVEGCSA-N	437.909	1.855	50	20	IDGD	
COc1ccc(S(=O)(=O)NC2CC2)cc1NC(=O)C(=O)NNc1cc(C)ccc1F	784883953	KVLSTODYAPZFHM-UHFFFAOYSA-N	436.465	1.665	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNc2cc(F)c(F)cc2F)cc(S(C)(=O)=O)c1	784895801	KTEARXKDDAUMRW-UHFFFAOYSA-N	445.375	1.376	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)c(Br)n1	785073175	FFERLMFYKWVZOX-UHFFFAOYSA-N	431.250	1.129	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNc2cc(F)c(F)c(F)c2)cccc1C(=O)N1CCOCC1	785088383	KWBSIWZKEGXOAB-UHFFFAOYSA-N	436.390	1.967	50	20	IDGD	
Cn1ccnc(NNC(=O)C(=O)Nc2cc(C(C)(C)C)nn2-c2ccc(F)cc2)c1=O	785089851	GZVAKEPRNGOWRW-UHFFFAOYSA-N	427.440	1.484	50	20	IDGD	
COC(=O)[C@H]1CN(C(=O)C(=O)NNc2nc(C(F)(F)F)cs2)c2ccccc2O1	785143943	FOANQWJYMGYKBK-SNVBAGLBSA-N	430.364	1.572	50	20	IDGD	
CSc1nnnn1-c1cccc(NC(=O)C(=O)NNc2cccc(F)c2[N+](=O)[O-])c1	790998119	BWDFRYDLFJXNFW-UHFFFAOYSA-N	432.397	1.513	50	20	IDGD	
CSCC[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)NNc1nc2ccccn2n1	791240196	WANSOBPUYVQSRA-AWEZNQCLSA-N	429.462	1.632	50	20	IDGD	
CC(C)(C)OC(=O)CCc1cccc(NC(=O)C(=O)NNC(=O)Cc2cccnc2)c1	792356035	LJTGWAKXFUKQIH-UHFFFAOYSA-N	426.473	1.685	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cnn3c2C[C@H](CNC(C)=O)CC3)ccc1OC(C)C	792736214	FPXKIKRIJGPJOF-OAHLLOKOSA-N	443.504	1.452	50	20	IDGD	
CN(C)N(C(=O)C1=NOC2(CCN(C(=O)OC(C)(C)C)CC2)C1)[C@@H]1CCS(=O)(=O)C1	792850729	QGIJPVDTSIFMCG-CQSZACIVSA-N	444.554	1.025	50	20	IDGD	
Cc1nn(C)c(C)c1-c1cc(C(=O)NNC(=O)CNC(=O)OCc2ccccc2)n[nH]1	794064324	BJAAQCVWCYNSRP-UHFFFAOYSA-N	425.449	1.114	50	20	IDGD	
CCn1cnc2c1c(=O)n(CC(=O)NN=C1CSC[C@H]1C)c(=O)n2Cc1ccccc1	794879959	NZBYNFBKEFKRBC-CQSZACIVSA-N	440.529	1.283	50	20	IDGD	
Cc1ccc(N2C[C@@H](C(=O)NNc3ccccc3S(=O)(=O)N(C)C)CC2=O)cc1F	795168183	IQRVJINSRNPGJD-AWEZNQCLSA-N	434.493	1.881	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(F)c(N3CCOC3=O)c2)cc1	796989930	MMWMMTJPBKQMDU-UHFFFAOYSA-N	430.392	1.256	50	20	IDGD	
Cc1cc(O[C@H]2CCN(C)C2=O)ccc1NC(=O)C(=O)NNC(=O)c1ccccc1F	799257324	ILVBJXAKLYPYAB-KRWDZBQOSA-N	428.420	1.143	50	20	IDGD	
O=C(CCn1nc(O)c2ccccc2c1=O)NNC(=O)Nc1ccc(OC(F)F)cc1	802045579	PVELAKMEGBFKOQ-UHFFFAOYSA-N	433.371	1.947	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NNC(=O)Nc2ccc3c(c2)OCO3)cc1	802099837	FBIXDKRGHZRPGY-INIZCTEOSA-N	446.485	1.730	50	20	IDGD	
CCC1CCC2(CC1)NC(=O)N(CC(=O)NNC(=O)Nc1ccc(N(C)C)cc1)C2=O	802123052	HSSIIFIFBBTGTI-UHFFFAOYSA-N	430.509	1.796	50	20	IDGD	
COCCNC(=O)[C@@H](C)OC(=O)c1ccc(NC(=O)NNc2nc3ccccn3n2)cc1	806752355	ZRILAIIOMWHHLK-CYBMUJFWSA-N	441.448	1.186	50	20	IDGD	
CCN(CC)CC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(O)cc2)c1	806990418	DTIMKMHNFXICQH-UHFFFAOYSA-N	427.461	1.072	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNc2ncccc2F)c(Br)cc1F	807301519	BHKNJNPXTCOLMR-UHFFFAOYSA-N	429.177	1.991	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(F)cc2)C1	807371890	SUCMRHQKQQQMTN-CQSZACIVSA-N	445.513	1.163	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cccc3c2COC3=O)cc1	808934550	KPPYDYSQOCTVMP-LBPRGKRZSA-N	425.397	1.113	50	20	IDGD	
COC(=O)Cc1occc1C(=O)NNC(=O)c1cc(-c2ccc(OC)c(OC)c2)[nH]n1	810584346	PNSCHOAFNOPJEB-UHFFFAOYSA-N	428.401	1.477	50	20	IDGD	
CC(C)(C)n1cnc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)n1	812449923	TVGZBRWJIQYAPO-UHFFFAOYSA-N	434.522	1.283	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)c2cccn(Cc3ccccc3)c2=O)cc1	812732496	JJFFYMPQISCBBQ-UHFFFAOYSA-N	426.498	1.904	50	20	IDGD	
COCCS(=O)(=O)c1ccc(C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)cc1	812733253	LBOZFQIQUSPNHJ-UHFFFAOYSA-N	441.531	1.114	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@@H]2CCN(c3ccccc3F)C2)c1	812923260	ANYSAIRHMXRBIP-AWEZNQCLSA-N	434.493	1.700	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)Nc2ccc(F)cc2CS(C)(=O)=O)cc1	812953932	QRJKOXQKKAIKJB-UHFFFAOYSA-N	444.510	1.769	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2cnn(-c3ccccc3F)c2)cc1	813033840	NPMWSZMKAMCKBG-UHFFFAOYSA-N	446.464	1.344	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2c3c(cc4c2CCC4)CCC3)cc1	813034042	WEGRIVZLMFIUGQ-UHFFFAOYSA-N	442.541	1.996	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCc2nncn2C1)C(=O)Nc1ccc(SC2CCCC2)cc1	815692351	OZQZACPBGAEDJV-CYBMUJFWSA-N	428.518	1.661	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1cccc(OC(F)F)c1	815752186	HMEHKAZGLWCGJF-UHFFFAOYSA-N	428.417	1.620	50	20	IDGD	
O=C(CN1CCCCCC1)Nc1ccc(NC(=O)C(=O)NNc2ncncc2F)cc1	815763848	DIKYCEFKLVICEQ-UHFFFAOYSA-N	429.456	1.512	50	20	IDGD	
CCOc1ccc(NNC(=O)C(=O)Nc2ccc(NC(=O)CN3CCOCC3)cc2)cc1	815815848	UTSFXDYMVORMRL-UHFFFAOYSA-N	441.488	1.438	50	20	IDGD	
NC(=O)[C@@H]1CC(C(=O)NNC(=O)c2cc(-c3ccccc3)on2)=NN1c1ccc(F)cc1	913083979	XHXLDYHGVQKCGW-KRWDZBQOSA-N	436.403	1.362	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=S)Nc2cccc(S(=O)(=O)N(C)C)c2)c1	913445776	KIZZJZQFKFQPQB-UHFFFAOYSA-N	438.531	1.586	50	20	IDGD	
CCn1c(=O)nc(O)c2c(C(=O)NNC(=O)Cc3ccc(F)cc3)cc(C3CC3)nc21	914406112	NJDBKSBTTAELEZ-UHFFFAOYSA-N	425.420	1.537	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)c2cccc(NC(=O)c3cccnc3)c2)c2ccccc2c1=O	914846646	SDRFEIAYTOBJIS-UHFFFAOYSA-N	442.435	1.656	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NC[C@@H](c2cccs2)N2CCCC2)c2ccccc2c1=O	915901799	LHTPTVGKXCHEKA-INIZCTEOSA-N	440.529	1.776	50	20	IDGD	
Cc1nc2ccccc2n1CCCNC(=O)NNC(=O)c1csc(N2CCOCC2)n1	915906877	SHQWCKBQPUNZQC-UHFFFAOYSA-N	443.533	1.672	50	20	IDGD	
CCOc1cccc2c1OCC(C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)=C2	916108627	BXUMKENRDDHVQP-UHFFFAOYSA-N	445.497	1.573	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)cc1	916563045	YNBUYYNXRSHAFJ-UHFFFAOYSA-N	432.502	1.018	50	20	IDGD	
CCn1cnnc1CNC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	916580623	LOTUAPNMOYTLEG-UHFFFAOYSA-N	449.518	1.305	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)N[C@H]1COc2ccccc2C1	916635886	FHHOUYIQBHQNEN-QGZVFWFLSA-N	444.513	1.419	50	20	IDGD	
Cc1cc(C)c(S(=O)(=O)NNC(=O)c2ccc(Cl)nc2)c(C)c1NS(C)(=O)=O	917746593	LDYGMMLGAZOOLA-UHFFFAOYSA-N	446.938	1.655	50	20	IDGD	
COc1ccccc1OCCN(C)C(=O)NNC(=O)c1csc(N2CCOCC2)n1	918002037	MLCHVIXNSGPGQQ-UHFFFAOYSA-N	435.506	1.354	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)c2cc(S(=O)(=O)NC3CC3)ccc2C)cc1	919835429	JAHPHYAIHOZODJ-UHFFFAOYSA-N	431.514	1.838	50	20	IDGD	
Cc1nc(COc2ccc(F)cc2)sc1C(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1	919888435	CRDWFWOGBAIAOF-GFCCVEGCSA-N	442.494	1.301	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1cn(C)nc1-c1ccncc1	920274986	MHIWKCWIKFJWPF-UHFFFAOYSA-N	427.490	1.158	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2ccccc2N2CCN(C)CC2)c2ccccc2c1=O	920928597	UETJLJDZNWCJQW-UHFFFAOYSA-N	449.515	1.635	50	20	IDGD	
O=C(NNc1ccc(Br)cc1)C1=NN([C@@H]2CCS(=O)(=O)C2)C(=O)CC1	932509233	JFUQVUICTRSEQB-GFCCVEGCSA-N	429.296	1.058	50	20	IDGD	
Cn1ncc(I)c1C(=O)NNC(=O)c1cncn1-c1ccccc1	1117733344	ICUKQQBHASCKQP-UHFFFAOYSA-N	436.213	1.285	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)CC2(CC(=O)N3CCOCC3)CCCC2)cc1	1248522003	UMGDIRYXPWXKAJ-UHFFFAOYSA-N	432.521	1.454	50	20	IDGD	
O=C(NNc1cccnn1)[C@@H]1Cc2ccccc2CN1S(=O)(=O)c1ccc(F)cc1	1254616126	STXXAXNMJNKFSH-SFHVURJKSA-N	427.461	1.875	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C=NNC(=O)Cc1csc(N2CCOCC2)n1	1317692305	OXSNMPLXYBHMID-UHFFFAOYSA-N	436.563	1.274	50	20	IDGD	
CC(C)CN(CC(=O)NNC(=O)c1csc(N2CCOCC2)n1)C(=O)OC(C)(C)C	1319640729	OJTCNDMNMHDXTM-UHFFFAOYSA-N	441.554	1.634	50	20	IDGD	
COc1cccc(C[C@H](O)C(=O)NNC(=O)c2cc(-c3ccc(OC)c(OC)c3)[nH]n2)c1	1320739945	OFULFFFVEZEQNM-SFHVURJKSA-N	440.456	1.467	50	20	IDGD	
COCCOCC(=O)NC1CCC(C(=O)NNc2cncc(Br)c2)CC1	1341242148	RIYYROAMAKOZJJ-UHFFFAOYSA-N	429.315	1.625	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnn3ccncc23)C1	1778685291	RDWWHFBBWSQDDX-WRWLIDTKSA-N	435.912	1.111	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H]1CCOC1)CCO2	1780099135	UMNGPANGIXDCNU-QVKFZJNVSA-N	447.444	1.000	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)c(-n2nccn2)c1	1780245781	VFSGQRZXHPAHPD-LJQANCHMSA-N	438.315	1.823	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)Cc2ccc3ncnn3c2)C1	1780550889	WEWSDEKQXUUAOV-CSODHUTKSA-N	433.940	1.803	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c(C)c1	1780587107	BLQWHHWJZOUIKX-QHCPKHFHSA-N	437.500	1.059	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cnc4sc(C)cn4c3=O)CCO2)C1	1781218466	HVWJATKTRCNVDT-LIRRHRJNSA-N	438.937	1.525	50	20	IDGD	
O=C(c1cc2ncccc2[nH]1)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781333837	SCDHUCQSSDDBHW-WMLDXEAASA-N	425.258	1.697	50	20	IDGD	
COC(=O)C1(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](C)Br)C3)CC1	1781813417	GTPBOEZUFVHEBZ-PBFPGSCMSA-N	431.327	1.237	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(F)c(N(C)C)c(F)c3)C2)C1	1782110394	VDPVODCYTYOMNX-VBKZILBWSA-N	445.894	1.728	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCc1cnn(C)c1)C2	1782170228	CLFVTZMEKKYLKI-SQGPQFPESA-N	426.945	1.120	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)COc2cccnn2)C1	1782519166	AUQJIUXALSVVRH-PMUMKWKESA-N	441.326	1.153	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)CN3CCSCC3)CCO2)C1	1783339537	SLNDANBGGFGQQS-PBHICJAKSA-N	434.400	1.039	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cnn4ncccc34)CCO2)C1	1783347604	MUZBYBGQJQUDCR-KSSFIOAISA-N	436.310	1.346	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@H]2[C@H](C(=O)N3CC[C@]4(C3)CN(C(=O)[C@H](F)Cl)CCO4)[C@@H]2C1	1783467319	MXPDOFWFPXGDLF-MTCCJSQRSA-N	445.919	1.464	50	20	IDGD	
Cc1occ(C(F)(F)F)c1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]2C1	1784090677	KPPBULMVMOODBJ-VTPLQMEGSA-N	438.830	1.800	50	20	IDGD	
CCSc1cccnc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]2C1	1784093456	ZPQRKZKIPFCYRC-XQLPTFJDSA-N	427.954	1.387	50	20	IDGD	
COC(=O)c1ccc(CC(=O)N2CC[C@@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)cc1	1784157268	YFBCMTBYPMWRTD-QFIPXVFZSA-N	448.592	1.697	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](C)n3cccc3)C2)C1	1784327450	XJDIVQFCJRQEJZ-HRJSYZDASA-N	440.504	1.013	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(=O)c3ccco3)[C@H]2C1	1785136880	QEWOWISHDFIZIY-ABHRYQDASA-N	427.295	1.473	50	20	IDGD	
COC[C@H](Cl)C(=O)NC1(c2ccc(NC(=O)c3cc4n(n3)CCNC4=O)cc2)CCC1	1787572827	MIFHXWFPGOSSBT-HNNXBMFYSA-N	445.907	1.628	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3=NO[C@@H](c4ccccc4)C3)[C@H]2C1	1788143296	UVVVECIOTPBSOQ-CAVMOMJPSA-N	449.935	1.738	50	20	IDGD	
CN1CCCC[C@@H]1C(=O)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1	1788144960	HWCNQDKSWCRIKS-OAQYLSRUSA-N	435.333	1.598	50	20	IDGD	
Cc1cnc(C(=O)NC2(c3ccc(NC(=O)c4cccc(B(O)O)c4)cc3)CCC2)cn1	1788145946	JLZDHQZOGMCSCR-UHFFFAOYSA-N	430.273	1.526	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21)c1ccnc(Br)c1	1788821492	FAZRNOYNUZUDBF-MNXVOIDGSA-N	434.693	1.972	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21	1789865833	FPBILVCYDHQPQZ-JUFZMCDQSA-N	430.170	1.987	50	20	IDGD	
CN(C)c1cncc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]3C2)c1	1789868854	OKBVSLNMFKMKMJ-FDRFZEDHSA-N	443.375	1.977	50	20	IDGD	
CCCC(=O)N[C@@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]2C1	1789870228	ABWYKHJUYKGKNT-OSBUWBMXSA-N	436.380	1.507	50	20	IDGD	
CCN(CC)C[C@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]2C1	1789924886	FVAZEXFCMFPGBC-UVPYHEFZSA-N	436.366	1.635	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc4ncccn34)C[C@@H]21)[C@H](F)Br	1789925114	AEYIHZUYJJPITL-IMIFBBOLSA-N	440.273	1.013	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CCCCC3(F)F)C[C@@H]21	1791288058	RAJJKTZGCGNHKF-QAETUUGQSA-N	444.523	1.165	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(=O)c2ccccc2o1)c1cccc(B(O)O)c1	1792850699	SJAHUDZDPVXYML-BCDXTJNWSA-N	446.268	1.038	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C[C@H](N)c1cccnc1)C2	1792868010	QCZZMRORPBLCPX-IJCAJFLPSA-N	439.354	1.092	50	20	IDGD	
COc1ncc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)CBr)cc1F	1792870395	NFWYBZDJTXNZHE-IKVITTDRSA-N	444.301	1.464	50	20	IDGD	
COc1cncc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCBr)C3)c1	1794052413	KPZMEWNSRIPPKN-CCWDJLKJSA-N	440.338	1.397	50	20	IDGD	
O=C1CN(c2cccc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)[C@@H](F)Cl)C4)n2)CCCN1	1794841067	SLBOGEHVUGLTCH-KYZVSKTDSA-N	437.903	1.194	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)c1ccc2c(c1)CCCC2=O	1796191502	RECBRJPZAUGZPX-WKCHPHFGSA-N	446.312	1.451	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc2c1cnn2C	1797638610	KLRLPPIKSMIOHB-MUJYYYPQSA-N	426.521	1.198	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](O)C(C)C)C2	1799219546	PNPRTRAPJTZYKB-NXEZDXNNSA-N	433.461	1.789	50	20	IDGD	
COc1cccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Br)c1F	1799352324	QGNAPBFJIYRLSY-OWLDWWDNSA-N	433.249	1.728	50	20	IDGD	
CC[C@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN(C)NC(=O)NCc1ccccc1)C2	1800072884	GMXVHCWZRVHMHF-RDGPPVDQSA-N	449.983	1.988	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccn3nccc3c1)C2	1800641622	GBDLDDQKCRWCPM-FSDCSDTHSA-N	435.322	1.711	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccnc(Br)c1)C2)C(Cl)Cl	1801017057	KYBSNYSOCYVXHQ-PEGIJTEDSA-N	437.121	1.851	50	20	IDGD	
CC#C[C@@H](CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](Cl)COC)C2)c1ccc(O)cc1	1801055370	OVHIBZAQJKPRPX-DCIOMXRHSA-N	448.947	1.733	50	20	IDGD	
CCOC(=O)N(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](O)CCl)C2)Cc1ccco1	1802754035	PVRKTJKSNCSCKR-IVSAIRAKSA-N	441.912	1.476	50	20	IDGD	
Cc1cc(NC(=O)CC(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)no1	1803139619	RQLKTXICQBRWDG-VCBZYWHSSA-N	449.895	1.012	50	20	IDGD	
Cc1cc(C)n(CCC(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)n1	1803145817	INDROFRUUSRWAW-HBFSDRIKSA-N	433.940	1.591	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)c2cc(O)ncn2)[C@@H]1c1cccnc1	1803741505	ICVXXFCRSLWNEP-GHJWDPDVSA-N	434.294	1.680	50	20	IDGD	
CC(=O)N(C)CCC(=O)NC[C@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1	1804068154	SLDVUMYEQFYKEJ-VQIMIIECSA-N	439.354	1.741	50	20	IDGD	
CN1N=C(C(=O)NC[C@H]2CCN(C(=O)C(Cl)Cl)[C@@H]2c2cccnc2)CCC1=O	1804124744	VWRPPPTXEXMHLP-IUODEOHRSA-N	426.304	1.499	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H]1C[C@H](C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](O)CCl)C3)C1	1804291179	GRWGLNYWXKYQSG-CMXYNOPPSA-N	429.945	1.528	50	20	IDGD	
O=C(COC1CCCCC1)N1CCCC2(CCN(C(=O)c3cccc(B(O)O)c3)CC2)C1	1805266262	AYFULBLXIAYHGK-UHFFFAOYSA-N	442.365	1.561	50	20	IDGD	
O=C(c1cnc(C(F)(F)F)cn1)N1CCC2(CCCN(C(=O)[C@H](O)CCl)C2)CC1	1805523656	SADGNBJLDYDVOD-CYBMUJFWSA-N	434.846	1.940	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC2(CCCN(C(=O)[C@H](C)NS(=O)(=O)CC)C2)CC1	1805954213	RRTAWSXGFXKYHI-HOTGVXAUSA-N	436.018	1.953	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)[C@H]1CC=CCC1	1808125551	QLIVTIMXWSBZGO-UCNVEGJOSA-N	433.317	1.437	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)c1cnn2ccccc12	1809068463	DFCZJHONMCTHRB-ZYSHUDEJSA-N	427.892	1.649	50	20	IDGD	
O=C(c1ccn2cncc2c1)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1	1809978775	QFNUZHQRMPMHCK-UHFFFAOYSA-N	446.316	1.173	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1cccc(F)c1	1811800264	KSESSBCITKDUOH-SIKLNZKXSA-N	447.275	1.534	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2n[nH]cc2[N+](=O)[O-])[C@H]1c1cccnc1	1813032216	VQHHOEWDYGUKLS-XEZPLFJOSA-N	436.856	1.286	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@H](CNC(=O)CCS(C)(=O)=O)[C@H]1c1cccnc1	1813574776	FFPULZTVVHCLBQ-QFBILLFUSA-N	441.626	1.374	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)C1CC(F)(F)C1	1814537914	UMOJPVUFBVSMGI-INIZCTEOSA-N	432.236	1.441	50	20	IDGD	
Cc1nc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)cs1	1816578564	WMMGCWLINGFDNQ-KRWDZBQOSA-N	439.306	1.474	50	20	IDGD	
CCNC(=O)N[C@@H](C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCBr)n[nH]1	1816782471	QNBOWYXEVDVAEU-WCQYABFASA-N	443.346	1.894	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CS(C)(=O)=O)n[nH]1	1817057443	WISQECHDYDTUJR-NHYWBVRUSA-N	425.338	1.683	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)C1CC(=O)C1)CC2	1817284817	PATVVKHKIXBGDQ-LPUHGPTISA-N	442.501	1.168	50	20	IDGD	
Cc1ccc(=O)n(C(C)(C)C(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@H](F)Cl)CC3)n1	1820090139	XXMHZTDTUOKLMW-YGRLFVJLSA-N	441.916	1.890	50	20	IDGD	
C[Si](C)(C)OCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccnc1C(N)=O)CC2	1820161148	SEXXOOMKDATZKO-NSHDSACASA-N	447.593	1.714	50	20	IDGD	
Cc1nc(C)c(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)CCC(=O)NN(C)C)CC3)o1	1820582699	VPJRNXCRRSTSSC-LBPRGKRZSA-N	434.522	1.347	50	20	IDGD	
CN1CCC[C@@H](C(=O)Nc2cc([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)C1	1820727932	GSTSILRXSRULQT-WBVHZDCISA-N	433.557	1.117	50	20	IDGD	
Cc1ccc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2cccc(B(O)O)c2)CC3)c(C)c1	1822017860	DDHBHNCTENZWER-QGZVFWFLSA-N	449.341	1.979	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H]2CCCSC2)n[nH]1	1823458186	GZEKLVDZYMPQLB-ZBFHGGJFSA-N	436.582	1.918	50	20	IDGD	
C[C@@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1)n1ccnc1	1827055846	LYRYZQMAZONAOH-LAUBAEHRSA-N	438.337	1.057	50	20	IDGD	
O=C(/C=C/c1ccco1)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827056464	VGYUELUPPREWID-DGSRBQDKSA-N	436.317	1.906	50	20	IDGD	
O=C1CCc2ccc(C(=O)N3CCCC[C@@H]3C3CCN(C(=O)[C@@H](O)CCl)CC3)nc2N1	1827394675	TUGHXXPEYONVCB-MSOLQXFVSA-N	448.951	1.799	50	20	IDGD	
COc1ccc([C@H](C)C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)cc1	1830450902	USCSGMVPYFYEHT-VHFSOBRXSA-N	428.888	1.790	50	20	IDGD	
O=C(c1cc(F)ccc1Cl)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1830733365	KLDBDYSBZNJERL-YJBOKZPZSA-N	435.279	1.149	50	20	IDGD	
Cc1cc(C)n(CC(=O)N2CCC([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)n1	1831871679	WBXTYZWVTDDNKR-HXUWFJFHSA-N	446.596	1.493	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cnn3c2CCC3)CC1	1831874309	GQPRJFMHPLXIOK-LJQANCHMSA-N	444.580	1.436	50	20	IDGD	
C[C@@]1(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1(F)F	1832803874	PMQKQPIAOONKAC-UTKZUKDTSA-N	449.502	1.964	50	20	IDGD	
CCC(=O)N[C@@H](C)C(=O)N1CCC(N2CCC(NC(=O)C(C)(C)CCl)CC2)CC1	1833213750	YPHVIALZUSXHNV-HNNXBMFYSA-N	429.005	1.738	50	20	IDGD	
O=C(c1ccc(F)s1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1833217638	PJCSNHSWMYDSAQ-SWLSCSKDSA-N	439.278	1.648	50	20	IDGD	
C[C@@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)c3cncnc3)CC2)CC1	1833262586	WXHCRQAAIJVSQZ-AWEZNQCLSA-N	438.370	1.693	50	20	IDGD	
C[C@@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)C3CN(C)C3)CC2)CC1	1833266129	RDPIARGEZZVFBU-AWEZNQCLSA-N	429.403	1.151	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)CCc3cccc(O)c3)CC2)CC1)[C@H](O)CCl	1833312745	AVLUSORADRBELU-HXUWFJFHSA-N	437.968	1.496	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)C[C@H](NC)C(=O)O)CC2)CC1	1833532483	REJGGRZFNUZKMC-IRXDYDNUSA-N	430.977	1.028	50	20	IDGD	
O=C(Cc1ncccn1)NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1	1833876883	YFANISLFOUUJLY-KRWDZBQOSA-N	442.333	1.281	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)c1scnc1C1CC1	1834034706	XRYXYHCZRJBJMS-INIZCTEOSA-N	440.997	1.805	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)c3cocn3)CC2)CC1	1834306883	WMLVCLNZCOVCNB-CYBMUJFWSA-N	427.343	1.891	50	20	IDGD	
COc1cnc(C(=O)NC2CCN(C3CCN(C(=O)C(Cl)Cl)CC3)CC2)cn1	1834317204	QCMCWQCODOGCDB-UHFFFAOYSA-N	430.336	1.474	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)[C@@H]3C[C@@H]3C3CC3)CC2)CC1	1836662363	ZANNMUXYBBFPOB-WOJBJXKFSA-N	434.581	1.404	50	20	IDGD	
O=C(c1ccc2nonc2c1)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836717767	JFSBQXZCXCZROV-GOSISDBHSA-N	436.896	1.435	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccn4nccc4c3)C2)C1	1837713357	YUBYZWOPGINZQA-OAQYLSRUSA-N	446.580	1.256	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3ncn(C(C)C)n3)CC2)CC1	1838148657	LHLQRKQHYFHWAE-KRWDZBQOSA-N	441.960	1.725	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cnncc3C(=O)O)CC2)CC1	1838462296	MKCDEDDTWKAKKI-KRWDZBQOSA-N	438.912	1.804	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cnc4ccccn34)C2)C1	1839141684	QBDXTNVUJAXGGK-DYESRHJHSA-N	434.924	1.351	50	20	IDGD	
O=C(C1CC(F)(F)C1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839197484	XWXAEUAYQHZVMV-RISCZKNCSA-N	429.233	1.179	50	20	IDGD	
O=C(CCc1ccc[nH]1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839198976	GXTSHNUEPBUGCA-WBVHZDCISA-N	432.290	1.094	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)ccc1O	1839201752	IFJIJRQIDKQDTB-QAPCUYQASA-N	445.285	1.461	50	20	IDGD	
O=C([C@H](O)CCl)N1CCOC[C@@]2(C1)CN(C(=O)C1(c3ccccc3)CCC1)CCO2	1840113031	BSDGFMGKDWXSCO-WIYYLYMNSA-N	436.936	1.164	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3scnc3C3CC3)C2)C1	1840151061	VPFRULCSHWOTSM-KUHUBIRLSA-N	443.953	1.344	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)CC[C@@H]3CCOC3)CCO2)C1	1840585156	AITHNGOHRPBKDT-MDZRGWNJSA-N	447.370	1.291	50	20	IDGD	
C[C@H](C(=O)N1CCCC12CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)C1(O)CCC1	1841045502	OFAOODUQQRCZSE-CABCVRRESA-N	443.972	1.873	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC12CN(C(=O)[C@@H](O)NC(=O)OC(C)(C)C)C2	1841288575	CXFYYSQCVGEQPD-NWDGAFQWSA-N	434.331	1.064	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCO)C(=O)N1CCCC12CN(C(=O)C(C)(C)CCl)C2	1841429224	QZNIRAPGBKHADT-AWEZNQCLSA-N	431.961	1.731	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2cnccc2C(F)(F)F)C1	1842426721	YVIRZBWELLFCIL-UHFFFAOYSA-N	448.405	1.230	50	20	IDGD	
O=C(CCc1ccc(F)c(F)c1)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843010329	DOTXPLVHAISNED-UHFFFAOYSA-N	428.244	1.094	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@]2(F)CCN(C(=O)OC(C)(C)C)C2)C1	1843955027	NMJJUYAVBBDWGQ-XOBRGWDASA-N	447.935	1.793	50	20	IDGD	
O=C1CC(C(=O)N2CC3(CCCN3C(=O)[C@H](Br)Cc3ccccc3)C2)=NN1	1845941469	AHEDWGRXCWJNAU-CQSZACIVSA-N	433.306	1.072	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)c1nn(C)c(C)c1Br)C2	1846363454	KLXALGORBVOWKN-NSHDSACASA-N	433.734	1.562	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)c1ncccc1Br)C2	1846385288	MPCSKZFACJPFNO-UHFFFAOYSA-N	438.326	1.034	50	20	IDGD	
Cc1cc(Br)c(N)cc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl	1847558349	JTKANBWZPMRGTE-KKUMJFAQSA-N	430.730	1.755	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@](F)(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](O)CCl)C1	1847563896	RHEVNCNRPDSSJG-KZDUYQQSSA-N	447.935	1.527	50	20	IDGD	
COc1cc(C(=O)NNC(=O)COc2cc(C)cc(C)c2)cc(Cl)c1OCC(N)=O	14317186	SBWWDLDJKUUTOX-UHFFFAOYSA-N	435.864	1.670	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)[C@@H]1CC(=O)N(c2cc(C)ccc2OC)C1	15668574	YWVAKEPUXFJZFJ-OAHLLOKOSA-N	427.457	1.592	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@H]1COc2ccc(Cl)cc2C1	16053062	RKBXJRPNJITIGM-CYBMUJFWSA-N	436.921	1.954	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)CN1C(=O)N[C@@]2(C[C@@H](C)CC(C)(C)C2)C1=O	21199795	ZDMSLOGNRWTERV-WHEQGISXSA-N	440.504	1.541	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)CCCN1C(=O)c2ccccc2C1=O	25413923	DQYLEVWLAMVPJL-UHFFFAOYSA-N	425.441	1.688	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCCC(=O)NNC(=O)Cc2c[nH]c3ccccc23)cc1	26536354	OCENSYKZDYACEZ-UHFFFAOYSA-N	444.513	1.625	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)c2ccc(CSc3nncn3C)cc2)cc1	26750957	ZPKZJUKXYRUMSA-UHFFFAOYSA-N	427.486	1.956	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=S)NCC(C)(C)CN(C)C)c1	727066090	SQPBOOMFXVLTQW-UHFFFAOYSA-N	443.639	1.414	50	20	IDGD	
CN1CCN(C[C@@H](NC(=O)NNC(=O)c2ccc3c(c2)OCCO3)c2ccccc2)CC1	727944501	DMAVKVVKYMHYLQ-LJQANCHMSA-N	439.516	1.391	50	20	IDGD	
O=C1CCC(=O)N(c2ccc(C(=O)NNc3ccc(S(=O)(=O)NC4CC4)cc3)cc2)N1	728211129	HRIUVEQSVJGDRV-UHFFFAOYSA-N	443.485	1.042	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CC(C)(C)C)cc1S(=O)(=O)NCc1ccccn1	728607896	FXWIHBINQIJYCP-UHFFFAOYSA-N	434.518	1.766	50	20	IDGD	
CN(C)CCN1CCC(NC(=O)NNC(=O)c2cc(F)ccc2Br)CC1	728742352	BQAGQQZBDWUOBE-UHFFFAOYSA-N	430.322	1.558	50	20	IDGD	
CC(C)NC(=O)Nc1ccc(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1	728889679	LZWBXOSIRSKZIU-UHFFFAOYSA-N	425.493	1.684	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)NCc1ccc(CN2CCC(O)CC2)cc1	729622126	ZZOJUIDYURUQOU-UHFFFAOYSA-N	426.517	1.725	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)[C@H]1CC(=O)N(c2cccc(Br)c2)C1	730781583	SWRHSZIMHJZYGP-LBPRGKRZSA-N	448.273	1.734	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)NCc1ccc(N(C)S(C)(=O)=O)cc1	732256604	ITCPVJSWOZKOMV-UHFFFAOYSA-N	440.909	1.889	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)c1ccccc1NS(=O)(=O)C(F)(F)F	732749815	GMAGBOITXCCJOW-UHFFFAOYSA-N	447.391	1.797	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)N[C@H]1CCN(c2ccccc2F)C1=O	732892697	FOAXVPXACSAFKB-ZDUSSCGKSA-N	431.380	1.249	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cc(C)ccc2N2CCCC2)cc1	735028651	MZXZBDUWWVINET-UHFFFAOYSA-N	444.557	1.985	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)c2ccc(S(=O)(=O)N(C)C)o2)cc1C	736776835	GYBDCZWJQDCSNB-UHFFFAOYSA-N	443.503	1.080	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)CCSc1ccc2c(c1)OCCO2	737854267	GGTNNYSHNDDWNK-UHFFFAOYSA-N	440.522	1.795	50	20	IDGD	
CCn1c(NNC(=O)c2ccc(CNS(=O)(=O)CC)cc2)nc2ccccc2c1=O	741664632	IZNJTKJBAKAEIU-UHFFFAOYSA-N	429.502	1.613	50	20	IDGD	
O=C(NNC(=O)c1cccc(Br)c1)c1ccc(CN2C(=O)CNC2=O)cc1	742770030	SDGQPZLNIMAAOH-UHFFFAOYSA-N	431.246	1.576	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C[C@@H](C)/N=C1/NS(=O)(=O)c2ccccc21	743283473	AYJPUEAHPJRVDI-CQSZACIVSA-N	444.513	1.293	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NCc2ccn(-c3ccccc3)n2)cc1	745729273	NOPYZCLYRYRMQV-UHFFFAOYSA-N	428.474	1.812	50	20	IDGD	
Cc1ccc(N2CC[C@@H](NC(=O)NNC(=O)c3nn(-c4ccccc4)cc3O)C2=O)cc1	745852631	SYLHZYGCXHQZFQ-QGZVFWFLSA-N	434.456	1.636	50	20	IDGD	
O=C(NNC(=O)N1CCOCC1)c1cc(S(=O)(=O)N2CCCCC2)ccc1Cl	745992887	LKNJIDODPIQSKH-UHFFFAOYSA-N	430.914	1.201	50	20	IDGD	
NC(=O)CC[C@@H](C(=O)NNc1nc(-c2ccccc2)no1)N1C(=O)c2ccccc2C1=O	746241728	OOMGYOPTNGHYJN-HNNXBMFYSA-N	434.412	1.110	50	20	IDGD	
CCOc1ccccc1C(=O)N1CCC[C@@H]1C(=O)NNC(=O)Cc1cn2ccccc2n1	746550485	NWUVWBGWMCLVGL-GOSISDBHSA-N	435.484	1.728	50	20	IDGD	
Cc1csc([C@@](O)(CC(=O)NNC(=O)Cn2cnc3ccccc32)C(F)(F)F)n1	746817918	MFJJMSWPGPZYBE-INIZCTEOSA-N	427.408	1.789	50	20	IDGD	
Cn1ccnc(NNC(=O)c2ccc(I)c(Br)c2)c1=O	747938095	PJNCYTUDHILVLX-UHFFFAOYSA-N	449.046	1.904	50	20	IDGD	
CCn1c(=O)nc(O)c2c(C(=O)NNC(=O)CNc3ccc(C)cc3)cc(C3CC3)nc21	748022614	OQDRRWFAXLNKII-UHFFFAOYSA-N	436.472	1.576	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NCCCN1CCN(c2ccncc2)CC1	748464484	DGLDRMYMASOJFJ-QGZVFWFLSA-N	444.511	1.531	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)N[C@@H](C)c1cc2c(cc1Br)OCCO2	748616580	CZJBUYZVMSLGCE-QWRGUYRKSA-N	446.298	1.663	50	20	IDGD	
COC(=O)c1cc(OC)c(S(=O)(=O)NNC(=O)c2cc(OC)cc(OC)c2)s1	748790274	ABJPIFMBBDASQO-UHFFFAOYSA-N	430.460	1.184	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)CNS(=O)(=O)c2ccc(Cl)s2)o1	749850725	CHPSUQMFYCNLGP-UHFFFAOYSA-N	448.954	1.576	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)NC1CCC(N2CCCCC2)CC1	751102589	KGCUFVUAFFYROU-UHFFFAOYSA-N	436.582	1.721	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNS(=O)(=O)c1cc(C(=O)O)cc([N+](=O)[O-])c1	751145692	GGQKDDSPQVPOMX-UHFFFAOYSA-N	429.794	1.578	50	20	IDGD	
COc1ccc(C(=O)N2CCC(NC(=O)NNC(=O)c3ccc(C)o3)CC2)cc1OC	752990111	ZKTIURPIKONHCF-UHFFFAOYSA-N	430.461	1.854	50	20	IDGD	
Cc1nc2c(c(O)nn2C)c(C)c1CCC(=O)OCC(=O)NNC(=O)c1cccs1	754552372	MNBVPNYXOWMCBZ-UHFFFAOYSA-N	431.474	1.289	50	20	IDGD	
C[C@H]1Cc2ccccc2N1S(=O)(=O)c1cccc(C(=O)NNC(=O)Cc2cc[nH]n2)c1	755268179	DNDPRSXIFMCKTJ-AWEZNQCLSA-N	439.497	1.553	50	20	IDGD	
C[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)C(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	755365733	BLCSZFSFOPNYDL-VXGBXAGGSA-N	428.511	1.792	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)Nc1ccccc1C(=O)N1CCN(C)CC1	755625354	YWFONPGUVAYARE-OAHLLOKOSA-N	443.479	1.834	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C(=O)Nc2ccc(N3C[C@H]4CC[C@H]3C4)cc2)nc2ccccc21	756173719	JJPMLVGBYOCEJP-YJBOKZPZSA-N	446.511	1.891	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc1S(N)(=O)=O	756639371	XRGVEQLUTBMKDA-UHFFFAOYSA-N	430.446	1.000	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)Nc3ccn(CCN4CCOCC4)n3)n[nH]2)cc1	756647948	XOIXXJFLQOWAMD-UHFFFAOYSA-N	438.492	1.380	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)Nc1ccc(F)cc1I	756872128	POFCVEODVQMHLQ-SSDOTTSWSA-N	441.222	1.018	50	20	IDGD	
CCOC(=O)c1cnc(C)c(NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1	757810084	GFUISBXWKADHEB-UHFFFAOYSA-N	427.465	1.426	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)CCN1c2ccccc2Sc2ccccc21	758053974	MVKNCJIDVLIAMS-CYBMUJFWSA-N	434.543	1.765	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)Nc1ccc([N+](=O)[O-])cc1F	758361755	MDVVJSVRWQECOJ-UHFFFAOYSA-N	439.425	1.903	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)NC[C@@H]1CSCCN1Cc1ccccc1	759328925	VXAAVQGYQBLKJI-LJQANCHMSA-N	439.541	1.885	50	20	IDGD	
CCC[C@@H](NC(N)=O)C(=O)NNC(=O)c1ccc(CSc2nc(C)cc(C)n2)cc1	759698640	ZCZPJHRMZOPATK-MRXNPFEDSA-N	430.534	1.984	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2ccc(I)c(O)c2)C[C@H](C)O1	761040768	KJPYKHOHOWLWSW-QWRGUYRKSA-N	447.273	1.257	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)CN2C(=O)c3ccc(Br)cc3C2=O)n1	762914644	XGVCJKXZAGCKGD-UHFFFAOYSA-N	447.293	1.825	50	20	IDGD	
O=C(CCn1nc(O)c2ccccc2c1=O)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	763173577	PJUOKIUMLUZKMJ-UHFFFAOYSA-N	436.403	1.483	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)c1ccc(F)c(I)c1	763320690	GRHIFFFPZYKHIA-UHFFFAOYSA-N	447.229	1.683	50	20	IDGD	
C[C@H]1CN(c2ccccc2NC(=O)C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)C[C@@H](C)O1	763446735	WKEMZEFBPAICJG-OKILXGFUSA-N	441.444	1.608	50	20	IDGD	
O=C(NNC(=O)c1ccccn1)C(=O)Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1	763463918	NRFPQVRHPNKPLS-UHFFFAOYSA-N	445.501	1.046	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C)c(C(=O)NC(C)C)c2)cc1OC	763552222	XJWGSZOFANSRFY-UHFFFAOYSA-N	442.472	1.550	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1Cl	763570854	JEOZFNRDINZRJT-KRWDZBQOSA-N	449.847	1.291	50	20	IDGD	
CO[C@@]1(CNC(=O)NNC(=O)[C@@H]2Cc3ccccc3CN2Cc2ccccc2)CCOC1	763646806	JYDPNBJVNGLXCG-XUZZJYLKSA-N	438.528	1.749	50	20	IDGD	
N#CCn1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2Cc2ccccc2)cn1	763718192	IUQNGRYCUJFSMD-UHFFFAOYSA-N	432.440	1.162	50	20	IDGD	
Cc1nc(-c2ccccc2NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)no1	763746329	SKKLMIIAGXWXMQ-UHFFFAOYSA-N	434.456	1.584	50	20	IDGD	
COC(=O)c1ccc(OC)cc1NC(=O)C(=O)NNC(=O)CN1CCCc2ccccc21	763746413	UNYPDRLRDJWDJN-UHFFFAOYSA-N	440.456	1.021	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1cc(C#N)ccc1OC(F)F	763864895	LWTVDAIODHRSDI-JTQLQIEISA-N	436.346	1.852	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1cccn(CC(F)(F)F)c1=O	763865101	IETHQOTVKPJAPE-SNVBAGLBSA-N	444.341	1.103	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1cccnc1Br	763866942	RTCPRHAKGPQDLD-VIFPVBQESA-N	425.214	1.537	50	20	IDGD	
COc1c(F)cc(F)cc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccc(C(C)=O)cc1	763872975	QFSRZAADRAYBFC-LLVKDONJSA-N	435.383	1.729	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)OC(C)(C)O3)cc1	763877469	KJZYGDYAWRHPNN-CYBMUJFWSA-N	441.440	1.950	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)nn1[C@@H](C)C1CC1	763943979	IPYJSAPAXHWSSU-ZDUSSCGKSA-N	437.460	1.454	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3ccn(-c4ncccc4F)n3)cc2C1	763947940	GHQVZKOAUUWIMS-LLVKDONJSA-N	442.476	1.992	50	20	IDGD	
COc1ccc(NC(=O)c2cccc(NC(=O)C(=O)NNC(=O)c3cccn3C)c2)cn1	763999169	QDOJVLDCMHQPBQ-UHFFFAOYSA-N	436.428	1.081	50	20	IDGD	
CCN1CCc2ccc(NC(=O)C(=O)NNC(=O)c3cc(Br)cn3C)cc21	764005335	YUKJSDNWYRJJKM-UHFFFAOYSA-N	434.294	1.570	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1O)C(=O)Nc1ccc(=O)n(Cc2ccccc2)c1	764116981	LMAMPJJBOGHWKI-UHFFFAOYSA-N	440.843	1.655	50	20	IDGD	
Cc1ncsc1C(=O)NNC(=O)C(=O)Nc1ccccc1CN1C[C@H](C)O[C@@H](C)C1	764245674	IQYGEEAOXKZYMX-STQMWFEESA-N	431.518	1.460	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)C(=O)Nc1ccc(N2CCCC2=O)c(Cl)c1	764281210	MQRFAVNSGCOCQG-UHFFFAOYSA-N	444.875	1.891	50	20	IDGD	
CN1CCN([C@H](CNC(=O)NNC(=O)CSc2ccccc2O)c2cccs2)CC1	764318925	JKCWQIDDNHHATB-OAHLLOKOSA-N	449.602	1.865	50	20	IDGD	
O=C(CCN1C(=O)c2ccccc2C1=O)NNc1c(F)cc(C(=O)NC2CC2)cc1F	764333642	XXNPIACHQBAHEN-UHFFFAOYSA-N	428.395	1.986	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)C1CCN(c2ccc3cccc(O)c3n2)CC1	764342722	HXUALHGIKHMJKJ-UHFFFAOYSA-N	448.483	1.129	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@H]2COc3ccc(C)cc32)cc1	764373900	HJWODRUXMMFKCK-KRWDZBQOSA-N	432.502	1.388	50	20	IDGD	
CNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(C)c(C)c3)[nH]n2)cc1	764386323	FWGSUCWGQWJALC-UHFFFAOYSA-N	434.456	1.453	50	20	IDGD	
CC(=NNC(=O)[C@@H](C)CN1C[C@H](C)O[C@H](C)C1)c1ccc(Cl)c(S(N)(=O)=O)c1	764667423	RUUCKSDNRFMTEK-RWMBFGLXSA-N	430.958	1.573	50	20	IDGD	
CC(C)(C)OC(=O)NNC(=O)C(=O)Nc1ccnn1Cc1cnn(-c2ccccc2)c1	765388826	AKQOCQGTVATPMP-UHFFFAOYSA-N	425.449	1.612	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)c1cc(F)ccc1[N+](=O)[O-]	766661328	WGJKSLNVRBZQSN-UHFFFAOYSA-N	449.870	1.966	50	20	IDGD	
COc1ccc(Br)c(CC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1	768570362	FRAORSCQCJZNQP-UHFFFAOYSA-N	448.321	1.854	50	20	IDGD	
COC[C@@H](C)n1c(C)cc(/C=C(\C#N)C(=O)OCC(=O)N2CCN(C(C)=O)CC2)c1C	768747423	LECCGYWKTCENDX-MBTVCVBTSA-N	430.505	1.453	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)N[C@H]3CCCN(c4ncccn4)C3)nc21	770348524	ZXMKHRNHAJZPNG-LBPRGKRZSA-N	426.485	1.372	50	20	IDGD	
O=C(NNc1ccnc(Br)c1)c1cc(S(=O)(=O)N2CCSCC2)c[nH]1	771537160	HAVQVPPJSJFZGU-UHFFFAOYSA-N	446.352	1.667	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)C1CCN(C(=O)CCc2ccccc2)CC1	771990227	CGVXFULGBJXHET-QGZVFWFLSA-N	431.533	1.983	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1cccc(NC(=O)[C@@H]2Cc3ccccc3O2)c1	772025713	RKFHUQZSSISNLS-UGSOOPFHSA-N	425.441	1.732	50	20	IDGD	
CN(C)N(C(=O)c1cc(I)c(F)cc1F)[C@@H]1CCS(=O)(=O)C1	772038103	WFRNGEALAXESFE-MRVPVSSYSA-N	444.241	1.675	50	20	IDGD	
C[C@H]1C[C@H](NC(=O)NNC(=O)CNC(=O)c2cccs2)CCN1C(=O)OC(C)(C)C	772357726	OWTPRCFPVAPWOD-QWHCGFSZSA-N	439.538	1.596	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNS(=O)(=O)c3cc(C)c(C)s3)CC2)cc1	773231499	LNLYNMHUULLTQA-UHFFFAOYSA-N	436.603	1.801	50	20	IDGD	
COCCC1(C(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)CC1	773251849	NVBPMCRKAFZFAX-UHFFFAOYSA-N	431.514	1.743	50	20	IDGD	
COc1cc(C)c(NC(=O)C(=O)NNC(=O)c2cc(Br)cn2C)cc1F	773500076	PUOZSPWUCOPGDJ-UHFFFAOYSA-N	427.230	1.643	50	20	IDGD	
CS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2)cc1Cl	773639211	LYQFHYNCTURGDK-UHFFFAOYSA-N	427.826	1.702	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)Nc1cnn(Cc2nnc3n2CCCC3)c1	775207275	UEKPEINOXXWCJW-UHFFFAOYSA-N	430.494	1.411	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN[C@@H](CS(C)(=O)=O)c1ccccc1	775549231	MSCZARMHEWIEIA-INIZCTEOSA-N	439.921	1.485	50	20	IDGD	
COc1cccc2[nH]cc(CC(=O)NNC(=O)c3sc(N4CCOCC4)nc3C)c12	778532484	RTHQEHYPCWWHNH-UHFFFAOYSA-N	429.502	1.782	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)C(=O)Nc1ccc(CNC(=O)OC(C)(C)C)cc1	778713578	LNZLSDBIXNBUER-UHFFFAOYSA-N	427.461	1.814	50	20	IDGD	
Cn1ncc(Cl)c1C=NNC(=O)CCCCC(=O)NN=Cc1c(Cl)cnn1C	780188177	HKOHAIDZELXKSK-UHFFFAOYSA-N	427.296	1.621	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2ccc(OC(F)F)cc2OC(F)F)CCS(=O)(=O)C1	783425894	JWKUEBJVBBDHNU-HNNXBMFYSA-N	443.375	1.026	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2ccc(Oc3ccc(Cl)nn3)cc2)CCS(=O)(=O)C1	783428343	UYCWGPIBHWFJSF-QGZVFWFLSA-N	439.881	1.059	50	20	IDGD	
O=C(NNc1ccc(-n2cccn2)nn1)C(=O)Nc1cccc(OCc2cscn2)c1	783432892	GYUBGCSCGMIPBK-UHFFFAOYSA-N	436.457	1.780	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)[C@@H](Cc1ccccc1)n1nnnc1C	786133614	MMCKMKYSHSZRBZ-LJQANCHMSA-N	436.472	1.007	50	20	IDGD	
C[C@H]1[C@@H](C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)CCN1C(=O)OC(C)(C)C	786378308	RRVVKYLAPSSJHR-BBRMVZONSA-N	430.461	1.508	50	20	IDGD	
CN1CCC(n2ccc(NC(=O)C(=O)NNc3nc(-c4ccc(Cl)cc4)no3)n2)CC1	787560047	WAJFZPUGKGLLHW-UHFFFAOYSA-N	444.883	1.935	50	20	IDGD	
O=C(CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@H]12)NNC(=O)c1cc(Br)c[nH]1	787993128	XXCRIHKBEBVFMZ-GVXVVHGQSA-N	430.328	1.264	50	20	IDGD	
Cc1c(C(=O)NNc2ccccc2S(N)(=O)=O)sc2nc3n(c(=O)c12)CCCCC3	788228500	LJIRNKCGIXUQJZ-UHFFFAOYSA-N	447.542	1.897	50	20	IDGD	
COc1cc(C)c(S(=O)(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1Cl	788484848	MWTOBTHFBLTCSV-UHFFFAOYSA-N	432.907	1.684	50	20	IDGD	
COc1ccc(OC)c([C@H]2C[C@@H]2C(=O)N2CCN(S(=O)(=O)CBr)CC2)c1	788526058	PLVGARFMWSGWDB-HIFRSBDPSA-N	447.351	1.634	50	20	IDGD	
COC(=O)COc1ccc(C=NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1[N+](=O)[O-]	788704592	WWPSGHNIRFVFOE-UHFFFAOYSA-N	439.384	1.157	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN(C)[C@@H](C)c2cccc(N3CCOC3=O)c2)n1	789367245	SPBTUZFGYCSPJH-AWEZNQCLSA-N	431.518	1.791	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc3c2OCC[C@H]3OC)o1	790951444	FMSQRWGYFXHUNH-QGZVFWFLSA-N	444.488	1.991	50	20	IDGD	
CCc1c(NC(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)cnn1-c1cccc(Cl)c1	792487005	VLTKVWAHPXISJN-SNVBAGLBSA-N	428.902	1.179	50	20	IDGD	
CN(C)N(C(=O)c1cccc(NC(=O)c2ccc3nc[nH]c3c2)c1)[C@@H]1CCS(=O)(=O)C1	792849982	MVYMNLAIGLMADQ-QGZVFWFLSA-N	441.513	1.921	50	20	IDGD	
N#Cc1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)ccc1F	794742011	QOZHONWGGFADPZ-UHFFFAOYSA-N	430.461	1.947	50	20	IDGD	
O=C(CN1CCN([C@@H]2CCN(Cc3ccccc3)C2)CC1)NNC(=O)c1cccs1	796384896	QAAPWFHECSZWPX-LJQANCHMSA-N	427.574	1.401	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)c3cc(Br)cnc3OCC3CC3)nc21	796447050	BXPFORQEGTZNSA-UHFFFAOYSA-N	434.254	1.772	50	20	IDGD	
COC(=O)c1cc(F)c(Br)cc1NC(=O)C(=O)NNC(=O)c1ccc[nH]1	796998206	BSJCEBNXORTSFY-UHFFFAOYSA-N	427.186	1.103	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2ccc(F)c(N3CCOC3=O)c2)cc1	797001256	IJTXQGDIJZPLQX-UHFFFAOYSA-N	444.419	1.510	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(N3CCC(N(C)C)CC3)c(F)c2)n1	797369917	QFPAIHDOAOJBMN-UHFFFAOYSA-N	442.495	1.459	50	20	IDGD	
CN(C)Cc1cc(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)ccc1Cl	799257359	JSVBKIABQLLVTR-KRWDZBQOSA-N	432.864	1.328	50	20	IDGD	
COc1cnc2ccccc2c1C(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1	801796074	DQZQHNWYHVRJBQ-UHFFFAOYSA-N	442.497	1.634	50	20	IDGD	
CC[C@H](C)[C@H](NC(=O)N1CCCC1)C(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	802064564	VSOZOCFJBYRPSQ-BBRMVZONSA-N	439.538	1.463	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)CN(C)C(=O)[C@H](C)n2cccn2)cc1Cl	802071858	ILEOWAMHMMXIJK-NSHDSACASA-N	438.872	1.426	50	20	IDGD	
C[C@H](CCNS(=O)(=O)c1ccccc1)NC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	802528147	RLVJIDZMZNYSCX-CYBMUJFWSA-N	435.462	1.296	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)C(=O)Nc1ccc(OC(F)F)cc1F	802566189	DFJJXCZPOPWWSJ-UHFFFAOYSA-N	442.306	1.500	50	20	IDGD	
CN(C)CCCOc1cnccc1CNC(=O)NNC(=O)c1ccc2c(c1)OCCO2	808346713	LNUXUHNYUGPISF-UHFFFAOYSA-N	429.477	1.328	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)cnn1-c1ccc(Cl)cc1	808934788	VIABQNDKUDBZHB-SFHVURJKSA-N	439.859	1.924	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2cc(O)ccc2Cl)CC1	810414151	NKUAAFDVPITHOQ-UHFFFAOYSA-N	425.898	1.134	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)C(=O)N3CCN(c4ccccc4)CC3)nc21	812506936	FBXHQFLLRUWTPS-UHFFFAOYSA-N	438.492	1.079	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)Nc2ccc(CS(C)(=O)=O)cc2)cc1	812928182	MUYSFUWXORNNGO-UHFFFAOYSA-N	426.520	1.630	50	20	IDGD	
CCN(CC)Cc1cccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)c1	813033481	VPYUARXAQRAZEO-UHFFFAOYSA-N	447.561	1.861	50	20	IDGD	
COc1ccc(-c2ccc(C)c(NC(=O)C(=O)NNC(=O)[C@@H]3CCc4nncn4C3)c2)cn1	815691434	PWORYGJQXLSALN-MRXNPFEDSA-N	449.471	1.006	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)C(=O)NNc1cccc(Cl)n1	815728454	DFCREDMLQHACRJ-UHFFFAOYSA-N	441.897	1.466	50	20	IDGD	
Cc1nc2cc(NC(=O)C(=O)NNc3ccccc3S(=O)(=O)N(C)C)ccc2n1C	815751064	QIJYNXOSCHGFPC-UHFFFAOYSA-N	430.490	1.214	50	20	IDGD	
O=C(NNc1ncncc1F)c1ccccc1NS(=O)(=O)c1ccc2nc(O)[nH]c2c1	817078476	GNWDWZUXHPYGTC-UHFFFAOYSA-N	443.420	1.755	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)CNS(=O)(=O)c3cccc(C#N)c3)cc2C1	913162552	YXDSOKFHRBHRNQ-LBPRGKRZSA-N	432.527	1.484	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)[C@@H]1CC(=O)N(Cc2ccccn2)C1	914881282	HVNVKEJABVWUFD-CYBMUJFWSA-N	447.289	1.419	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(S(=O)(=O)NC(C)C)c2)cc1C	916561915	ICUNNISWNUSUJU-UHFFFAOYSA-N	432.502	1.390	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)CNC(=O)c2ccc(Br)s2)cc1	916729170	LXJVCTKXAKNOMS-UHFFFAOYSA-N	426.292	1.775	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)C[C@H]1Oc2ccccc2NC1=O	916826349	LKVKNMWHKXWJTK-OAHLLOKOSA-N	434.246	1.765	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)[C@@H]2CC(=O)N(c3ccc4c(c3)OCCO4)C2)cc1	919832717	GUTJKDAHNLECDF-MRXNPFEDSA-N	439.468	1.600	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NC[C@@H](C)c2ccc(F)cc2)cc1	920053002	BFCZCSOOSCWBBI-OAHLLOKOSA-N	436.509	1.889	50	20	IDGD	
O=C(CSc1ccccc1[N+](=O)[O-])NNC(=O)Cc1csc(N2CCOCC2)n1	920212377	HKSNISACRZVYJJ-UHFFFAOYSA-N	437.503	1.370	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2cc(C)nc3ccccc23)cc1	920429284	YTACQBQFPXGGTP-UHFFFAOYSA-N	440.481	1.485	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)Nc1ccccc1CN1C(=O)CNC1=O	920931391	NDCPENNPGAAOMF-UHFFFAOYSA-N	441.444	1.369	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)N2CCN(S(=O)(=O)c3ccc(F)cc3)CC2)cc(C#N)n1C	931015679	TVGSTQSWGUYWBE-BOPFTXTBSA-N	441.488	1.784	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)c3ccnc(Cl)c3I)nc21	1319608738	VWCISTCXEZRDSO-UHFFFAOYSA-N	445.608	1.479	50	20	IDGD	
Cc1ccc(Cn2ncc3c(C(=O)NNC(=O)CNC(=O)c4ccco4)cc(C)nc32)cc1	1321254916	XGPVPYMVBZKYDE-UHFFFAOYSA-N	446.467	1.880	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNc3ccc(C(C)(C)C)nn3)CC2)cc1	1321937928	SWPRWSSQZBZTIY-UHFFFAOYSA-N	446.577	1.532	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)[C@@H]2CCCN2C(=O)C(F)(F)F)CC1	1326759929	XMBAORXXAHURBN-LBPRGKRZSA-N	436.431	1.334	50	20	IDGD	
Cc1cc2nnc(C(=O)N3CC[C@]4(C3)CN(C(=O)C(C)(C)CCl)CCO4)c(C)n2n1	1777779063	JCRRBJDZUMHTNO-FQEVSTJZSA-N	434.928	1.450	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnn4ccncc34)C2)C1	1777985612	AVBKLLWEZAPECG-KSSFIOAISA-N	436.310	1.346	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)COC(=O)C(F)(F)F)C2)C1	1778894594	LZMNREYBHFWQHT-QMTHXVAHSA-N	445.232	1.095	50	20	IDGD	
CC1(C(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)CCCCC1	1779034293	QODLMVSFOVOKSA-QFIPXVFZSA-N	429.521	1.099	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)N2C[C@H]3C[C@H]3C2)C1	1779264716	OTXOGQWGPGBKEE-IGYPPAOUSA-N	427.973	1.094	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(CN(C(=O)c3ncc[nH]3)CCO2)C1	1780095056	DGNANZAKIPIFAN-FQEVSTJZSA-N	443.416	1.001	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(-n4c(O)nnc4O)cc3)CCO2)C1	1781217379	IOIYNTAOLSBBIQ-MGPUTAFESA-N	449.895	1.139	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)[C@@H](N)Cc3cscn3)CCO2)C1	1781227039	FXTREVNTVKFDJV-IAOVAPTHSA-N	435.377	1.079	50	20	IDGD	
O=C(c1cccc(F)c1[N+](=O)[O-])N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781334315	XTMISFGUMQOAMS-XJKSGUPXSA-N	448.220	1.868	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)n2ccnn2)C1	1781551722	CUFNCLBQUUZGGI-LUXYFRNMSA-N	442.358	1.527	50	20	IDGD	
O=C(c1cccc2ccnn12)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1782228486	AESPQZWNNOCHRJ-YOEHRIQHSA-N	425.258	1.468	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](C)[S@](=O)c3ccccc3)C2)C1	1782688423	WYRURXSWSOKCRT-DRACSYEFSA-N	442.965	1.266	50	20	IDGD	
Cc1ccc(OCC(=O)N2CCO[C@]3(CCN(C(=O)[C@H](C)Br)C3)C2)cc1	1783533111	QUJKHPWOAOZUQT-HNAYVOBHSA-N	425.323	1.987	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccc4c(c3)CNC4=O)CCO2)C1	1783533853	KVDROMYGEQNANN-HXPMCKFVSA-N	436.306	1.157	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)CCc3ccc(OC)cc3F)CCO2)C1	1783874510	ICCAGJUKAWATEJ-UTKZUKDTSA-N	442.915	1.851	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3c(C)nc4ccc(F)cn34)CCO2)C1	1783881972	OQMNVCUPBMTTRJ-QRWLVFNGSA-N	438.887	1.479	50	20	IDGD	
CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](Cl)COC)C2)C1	1783885315	YPHWFNTZRUIARY-SIFCLUCFSA-N	447.960	1.373	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccnn3-c3ccccc3)C[C@@H]21)[C@@H](O)CCl	1784090579	IPXSCMRDAUGVKY-CBVHJVASSA-N	432.908	1.065	50	20	IDGD	
CC(C)(C)OC(=O)C(C)(C)CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]2C1	1784092044	DPQIAIXJHWYTPN-JONQDZQNSA-N	446.972	1.324	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3CCCCN3C)[C@H]2C1	1784114523	WARLIKFYJBUDFE-SIRPWMCASA-N	430.387	1.624	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CC[C@@H]4CCC(=O)N4C3)C[C@@H]21	1784620673	GIONWGYYPLZDRL-XEZGLNCPSA-N	439.984	1.775	50	20	IDGD	
O=C(NCCC(=O)N1CC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2)c1ccccc1	1785333272	KDRGMFZZNIRKGK-LJQANCHMSA-N	428.316	1.440	50	20	IDGD	
CCC[C@H](Cl)C(=O)Nc1ccc(C2(NC(=O)c3cc(=O)n4[nH]nnc4n3)CCC2)cc1	1786443298	GTTHPAMASSKUTR-AWEZNQCLSA-N	443.895	1.968	50	20	IDGD	
O=C([C@@H](O)CCl)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@]3(F)CCCCC3(F)F)[C@H]2C1	1788172110	SPXLVHNRQWSKDA-DEEHTKSCSA-N	426.863	1.483	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)c1cn2cccnc2n1	1788311344	ZXSNAJCYFIUYHD-AUZPSNTRSA-N	440.273	1.013	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3cc(F)ccn3)C[C@@H]21)[C@H](F)Br	1789922656	QLLWJDUDATWFJT-SIUGBPQLSA-N	446.292	1.824	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4c(c3)CC(=O)N4)C[C@@H]21	1791253952	JPPKWRFWNVEIJA-SCNOPHJPSA-N	435.908	1.028	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1ccc(C2(NC(=O)c3ccc(=O)oc3)CCC2)cc1	1791599267	FLHPBBWMLKWDTB-UHFFFAOYSA-N	426.473	1.761	50	20	IDGD	
O=C(NCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](F)Br)C2)c1cccs1	1794394386	UKQFXRQHSZESEG-FBKDDSFISA-N	432.315	1.807	50	20	IDGD	
CC1(C)CCC(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cccc(B(O)O)c2)CC1	1795739905	OJTRMTJJUTUMLU-HATOLVCRSA-N	442.365	1.176	50	20	IDGD	
CC(C)(C)OC(=O)N1CCO[C@@H](C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](F)Cl)C1	1796811892	YUGMNISGNLSEMO-XLWJZTARSA-N	433.908	1.795	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H](C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](F)Cl)[C@@H](O)C1	1796812218	ZYGCTUBYVNMHCZ-IWTMDLJTSA-N	433.908	1.387	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1n[nH]c2c1CC[C@H]2C	1796973960	QTWQAWWRSBNGIT-JNZVMSIHSA-N	439.354	1.836	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/C1CCCCC1)C2	1797753081	SGHOFIYNBKTQMI-NECVAMPVSA-N	441.532	1.025	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1Cc2ccccc2O1	1797825012	LDEIHHTYCBXJJW-OSQUSHSHSA-N	449.511	1.762	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2)c1cc2ncsc2[nH]1	1797979403	BGNBEYAZZFILKK-WDAIWFPHSA-N	427.324	1.613	50	20	IDGD	
COc1ccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)C(Cl)Cl)C3)c(C#N)c1	1799241413	WOWIDKWVZUCGPT-XOIINTDNSA-N	426.300	1.503	50	20	IDGD	
C[C@@H](Oc1ccccn1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@](C)(Cl)CCl	1799278770	XNWMZWUTKLEIGJ-HUYPOWGKSA-N	430.332	1.675	50	20	IDGD	
NC[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Br)c1ccccc1	1799346147	FPJHURJOZMXOTR-QRJUGERDSA-N	428.302	1.009	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CNC(=O)OC(C)(C)C	1800675372	OXEKISMIZKERLR-XFMPKHEZSA-N	448.358	1.274	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cn3cc(F)ccc3n1)C2	1800759166	IZUBFGFNLOKDFC-OVZMXSCWSA-N	439.285	1.460	50	20	IDGD	
Cc1cc(C)n(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)Br)n1	1800763133	POSYWHGDZAXJDI-PNBKFKSVSA-N	427.343	1.263	50	20	IDGD	
CC(C)(C)OC(=O)N1C(=O)CC[C@@H]1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](O)CCl)C2	1802617097	JLMKIEKTYPVIMZ-KHMAMNHCSA-N	443.928	1.150	50	20	IDGD	
CNC(=O)CC(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)CBr)[C@@H]1c1cccnc1	1803473275	NHUCCXZSSWNEAP-RVSPLBMKSA-N	425.327	1.255	50	20	IDGD	
COc1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)ccc1F	1803591111	KQEIGYSAZMEUCO-BCDXTJNWSA-N	426.253	1.080	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H]1C(=O)N1CCC2(CCCN(C(=O)[C@@H](O)CCl)C2)CC1	1805517999	NJAJUYDZYIXSRI-CVEARBPZSA-N	443.972	1.827	50	20	IDGD	
O=C1CC[C@H](C(=O)NC[C@@H]2CCN(C(=O)[C@H](F)Br)[C@H]2c2cccnc2)N1	1806815184	OYMTZNFPSNQDBB-NEBZKDRISA-N	427.274	1.057	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H](CNC(=O)CSC(=N)N)[C@H]1c1cccnc1	1807008316	JGKNSBZCODFXFZ-VNHYZAJKSA-N	442.383	1.888	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC2(CCCN(C(=O)c3cc(C(=O)O)ncn3)C2)CC1	1807575825	KJWNLSDTBGUTJC-UHFFFAOYSA-N	434.569	1.871	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1	1808427742	RWLBXHVHCIOIDV-RPVQJOFSSA-N	439.354	1.739	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCC2(CCCN(C(=O)c3cc4n(n3)CCNC4=O)C2)CC1	1808816367	PELQULWOGYLNBW-UHFFFAOYSA-N	435.956	1.736	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)c2ccccn2)[C@H]1c1cccnc1	1810297690	CTDXNWQLWLAUSW-JXFKEZNVSA-N	445.483	1.109	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@H]1c1cccnc1)c1cc(O)no1	1810983493	FWWHGSDOOXXYNQ-BPNCWPANSA-N	427.230	1.785	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)CN2CCOCC2)[C@H]1c1cccnc1	1812863952	JCFAYUITXSNBCU-LESCRADOSA-N	439.354	1.203	50	20	IDGD	
CC(=O)N(C)CCC(=O)N1CC[C@H](CNC(=O)[C@@H](C)Br)[C@H]1c1cccnc1	1812864170	GBSNJCYCWYORMS-MZMPZRCHSA-N	439.354	1.739	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)c2cc(=O)ccn2C)[C@H]1c1cccnc1	1812867244	NXIATUCGYBBLMU-JOQOYGCGSA-N	447.333	1.883	50	20	IDGD	
C#CCCCCC(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1813223814	UVHFNMHIVXQMRN-NZQKXSOJSA-N	433.317	1.275	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)Cc2ccc(O)cn2)[C@@H]1c1cccnc1	1813500367	ZRSKGGPKSYKXLW-BPAFIMBUSA-N	432.908	1.685	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)CCN3CCOCC3)sc2C1	1814648167	CGKHYMZXSPGRKU-NWDGAFQWSA-N	445.383	1.561	50	20	IDGD	
COC(=O)[C@@H]1CC[C@H](C(=O)N2CCCC[C@H]2c2cc(NC(=O)[C@@H](O)CCl)n[nH]2)C1	1814863982	DZZNMRODXHUJEF-NEBZKDRISA-N	426.901	1.591	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)Cc2ccc3c(c2)OCO3)[nH]n1)[C@@H](O)CCl	1814868580	ALERXDZCJPKDIK-GJZGRUSLSA-N	434.880	1.973	50	20	IDGD	
Cc1ccc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)c(C)c1	1815360625	KOGNDPKKVDKZLX-KRWDZBQOSA-N	449.341	1.979	50	20	IDGD	
Cc1ncc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)cn1	1816291540	RDVUNFCHXOKGMO-MRXNPFEDSA-N	428.497	1.187	50	20	IDGD	
Cc1ccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)[nH]n2)cn1	1816371416	RJLQWDGTWNVIMH-GOSISDBHSA-N	448.487	1.731	50	20	IDGD	
O=C(CCBr)Nc1cc([C@H]2CCCCN2C(=O)[C@@H]2CCCS2(=O)=O)[nH]n1	1816784189	DBNOCDLVKBCDHN-OLZOCXBDSA-N	447.355	1.764	50	20	IDGD	
COc1ccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)nc1	1817475608	VKZWALYQVRSITL-IBGZPJMESA-N	449.276	1.113	50	20	IDGD	
C[C@@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1)c1ccccn1	1817479996	YZJZLIVOXOZRON-FOIQADDNSA-N	447.304	1.594	50	20	IDGD	
Cc1n[nH]c(C)c1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1	1819666900	GMLCKWBEKAQUFK-HNNXBMFYSA-N	430.513	1.429	50	20	IDGD	
CN1CCC[C@H](C(=O)N2CCCC[C@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)C1	1822415442	HEKWUNCRNVGQRP-RDJZCZTQSA-N	433.557	1.117	50	20	IDGD	
N#Cc1cc(CC(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@@H](O)CCl)CC3)ccc1F	1822960429	VMNMNVXQICKCIB-WFASDCNBSA-N	436.896	1.908	50	20	IDGD	
Cc1noc(CC(=O)N[C@H]2CCc3nc(NC(=O)[C@@H](F)Br)sc3C2)n1	1823005024	XRBWZWNMLGZZRA-JVXZTZIISA-N	432.275	1.680	50	20	IDGD	
Cc1cccnc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1	1824696780	HZKCRWLLBFDUQN-OAQYLSRUSA-N	435.333	1.617	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)C2=NN(C)C(=O)CC2)CC1	1824928441	UCTFEMFFEHWUGT-WBVHZDCISA-N	426.945	1.468	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccco2)CC1	1825263890	WQRGXCOQOICPDS-DGSRBQDKSA-N	436.317	1.906	50	20	IDGD	
COc1nccnc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1	1825512542	UMEOXHWBCFXXGO-KRWDZBQOSA-N	446.552	1.092	50	20	IDGD	
CC[C@@H](NC(C)=O)C(=O)N[C@H]1CCc2nc(NC(=O)[C@H](C)Br)sc2C1	1825635958	NEJDBWJGVPGGRA-INTQDDNPSA-N	431.356	1.753	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnn3cccnc13)CC2	1826000664	ZWHANRAPBPNQAV-CMPLNLGQSA-N	434.909	1.665	50	20	IDGD	
CC(=O)C[C@@H](C)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827060527	NGCYKASSSWUJAY-IIBYNOLFSA-N	428.338	1.215	50	20	IDGD	
Cc1ccn2ncc(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)C(C)(C)CCl)CCO4)c2c1	1830357966	NVTBKUJOIYGOTH-JOCHJYFZSA-N	448.951	1.978	50	20	IDGD	
CC(C)=NO[C@H](C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1	1830419260	NRJJUXVORPECFY-IEBWSBKVSA-N	437.585	1.780	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3ccco3)C2)C1	1830535112	JFKIPBUSPYNGEG-KXBFYZLASA-N	443.338	1.700	50	20	IDGD	
CCc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)n[nH]1	1830538984	XELLUCMGBKIYKH-FZKQIMNGSA-N	443.342	1.073	50	20	IDGD	
O=C(Cc1cnc2ccccn12)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1830668244	YJVUFZFUXRVEES-IBGZPJMESA-N	441.315	1.137	50	20	IDGD	
O=C(c1cccc(F)c1Cl)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1830733880	WTZQZBASVYGJDZ-KSSFIOAISA-N	435.279	1.149	50	20	IDGD	
CCC[C@H]1CC[C@H](C(=O)N2CCOC[C@@]3(CN(C(=O)[C@H](O)CCl)CCO3)C2)CC1	1830736000	OWVTUATUHLVOTC-IKVWTGGYSA-N	430.973	1.649	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccccc3C(N)=O)C2)C1	1831653502	GVJRTJZZTGNGMS-LAUBAEHRSA-N	437.924	1.263	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(C(N)=O)cc3)C2)C1	1831659834	WGJGYBMJBGMSFQ-LAUBAEHRSA-N	437.924	1.263	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@H](C)NC(=O)CC)CC2)CC1	1833418144	RPKSVAZARIORLZ-MAUKXSAKSA-N	429.005	1.880	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)[C@@H]3C=CCN3)CC2)CC1	1835054477	NTPGJHKTFBDWKL-IRXDYDNUSA-N	427.387	1.260	50	20	IDGD	
NCC(=O)N1CCO[C@@]2(COCCN(C(=O)CCCCCCCCBr)C2)C1	1835555525	FBIZTEOZPQYOCO-LJQANCHMSA-N	448.402	1.527	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@H](C)N3C[C@H]4C[C@@H]4C3)CC2)CC1	1835671890	AWVSGXSVMOFANG-XLSPSMHOSA-N	425.017	1.916	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc4nc[nH]c34)C2)C1	1837711814	RHQUXKJWDSINDK-OAQYLSRUSA-N	446.580	1.484	50	20	IDGD	
O=C(c1ccc(C(F)(F)F)[nH]1)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1837766926	VXTQAEMWQQVDAN-OAHLLOKOSA-N	444.237	1.907	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)COCCOC)CC2)CC1	1837769125	CWTNNTHAXLHLOQ-QGZVFWFLSA-N	449.386	1.822	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC(OC2CCN(C(=O)[C@H](N)c3ccccn3)CC2)CC1	1837873478	NTDMAXRDFXGYBM-OAQYLSRUSA-N	448.640	1.932	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3c(F)cncc3F)CCO2)C1	1838168151	BXLBWTYTCAQBQW-DIFFPNOSSA-N	448.264	1.213	50	20	IDGD	
CCC[C@H](NC(C)=O)C(=O)N1CCC(OC2CCN(C(=O)[C@H](Cl)COC)CC2)CC1	1838785940	LGKVHVBIHOOIGN-MOPGFXCFSA-N	445.988	1.544	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3nc(Cl)ccc3F)C2)C1	1839142412	NSBYPXRUHGIULR-SGTLLEGYSA-N	434.295	1.962	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4cccnc4n3)C2)C1	1839145555	LZKLLNPZFSNOPP-IERDGZPVSA-N	432.908	1.717	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnoc3C3CC3)C2)C1	1839151194	KMIZRWKDDVSDIY-RBUKOAKNSA-N	446.331	1.858	50	20	IDGD	
Cc1noc(C)c1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839198089	SMTXLKBUEPPUPY-CJNGLKHVSA-N	434.262	1.052	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccncc3F)C2)C1	1839964244	KXANVHQQHASUSL-RDTXWAMCSA-N	444.301	1.464	50	20	IDGD	
O=C(c1ccn2cncc2c1)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840188530	ODIKWDUCMFFWDT-SFHVURJKSA-N	427.288	1.208	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)c1ccccn1)CCO2	1840330153	NJJJHVNXIDMYBA-IIBYNOLFSA-N	439.940	1.069	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)[C@H]2CCCCO2)C1	1841105022	LAUPYCHFKUTKEG-GOSISDBHSA-N	431.445	1.906	50	20	IDGD	
O=C(Cc1cc(F)ccc1Br)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1	1841350320	VLRMKONGUVPJEV-CQSZACIVSA-N	433.705	1.934	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](C(=O)N2CC3(CCCN3C(=O)[C@@H](F)Cl)C2)[C@H](O)C1	1843361668	HPTPKSHXVGGTJD-BFHYXJOUSA-N	433.908	1.342	50	20	IDGD	
O=C([C@H](F)Br)N1CC2(CCCN2C(=O)c2ccc3nc(CO)[nH]c3c2)C1	1843670930	LUYMKBKVKCBKAI-AWEZNQCLSA-N	425.258	1.563	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCCC12CN(C(=O)C(C)(C)n1nc(C)ccc1=O)C2	1846070913	LVUUWDRICAQLBC-CQSZACIVSA-N	439.354	1.664	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)CCN1C(=O)Cc3ccccc3C1=O)C2	1846360357	ILXPTDJERNRTSE-QGZVFWFLSA-N	447.919	1.059	50	20	IDGD	
COC(=O)c1ccc(OCC(=O)N2CCCC23CN(C(=O)[C@@H](C)Br)C3)cc1	1847149904	MXKUERFORVJDOO-CYBMUJFWSA-N	439.306	1.839	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)Cn1c(=O)n(C)c2ccccc21	1847501321	NBQPQRPRZLCZFV-JQFCIGGWSA-N	449.349	1.573	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H]1COCCN1C(=O)OC(C)(C)C	1847946188	PYBSVUJPANDDPC-FXUDXRNXSA-N	429.945	1.842	50	20	IDGD	
Cc1cc(C)c2c(-n3cccc3)c(C(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)sc2n1	16145948	UJHVACJZLZGJJS-CYBMUJFWSA-N	432.527	1.900	50	20	IDGD	
CNS(=O)(=O)c1ccc(C(=O)NNC(=O)COc2ccc(Br)cc2)cc1	16508270	LOBYXKXPUFGCCO-UHFFFAOYSA-N	442.291	1.197	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CCNS(=O)(=O)c2ccc(F)c(F)c2)cc1OC	28776952	MIWWVEXVAGKEBA-UHFFFAOYSA-N	443.428	1.112	50	20	IDGD	
O=C(NNC(=O)[C@@H]1C[C@H]2CCCC[C@@H]2N1C(=O)c1cccc(Cl)c1)C(=O)N1CCCC1	726161928	YNRJPOVTQNUIMB-JLSDUUJJSA-N	446.935	1.883	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)NCCc1cc(Br)ccc1F	726247471	UNKIJSBCEMOSER-UHFFFAOYSA-N	427.230	1.484	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)NCc1cccc(CN2CCCCCC2)c1	726249775	LOEOZRKONLVQGS-UHFFFAOYSA-N	427.505	1.916	50	20	IDGD	
COc1ccc(N2CCC(NC(=O)NNC(=O)COc3ccccc3[N+](=O)[O-])CC2)cc1	726715702	XQLGCMPATAICEJ-UHFFFAOYSA-N	443.460	1.982	50	20	IDGD	
CN(C)CC(C)(C)CNC(=S)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	727066966	ABCQSGHXDSQURO-UHFFFAOYSA-N	441.623	1.168	50	20	IDGD	
O=C(CN[C@@H](CN1CCOCC1)c1ccccc1)NNC(=O)c1cccc([N+](=O)[O-])c1	727384141	LWUIVYJJZNROFI-IBGZPJMESA-N	427.461	1.019	50	20	IDGD	
C#Cc1cccc(NC(=S)NNC(=O)c2cc(S(=O)(=O)N3CCCC3)c(C)o2)c1	727500285	URTIOHAQCWMVIH-UHFFFAOYSA-N	432.527	1.985	50	20	IDGD	
C#Cc1cccc(NC(=S)NNC(=O)CC/N=C2/NS(=O)(=O)c3ccccc32)c1	727501485	WOVGYYHGMGTPJI-UHFFFAOYSA-N	427.511	1.114	50	20	IDGD	
CCOC(=O)c1c(S(=O)(=O)NNC(=O)c2sc(-c3ccccc3)nc2C)n[nH]c1C	728171410	ZBRPYRBQSMAYKA-UHFFFAOYSA-N	449.514	1.950	50	20	IDGD	
CNC(=O)c1ccc(C(=O)NNC(=O)[C@H]2Cc3ccccc3CN2Cc2ccccc2)cn1	728519573	LOGWFORVXCRZLX-JOCHJYFZSA-N	443.507	1.829	50	20	IDGD	
CCn1c(=O)nc(O)c2c(C(=O)NNC(=O)Cn3ccc4ccccc43)cc(C3CC3)nc21	729451419	UNMKJYVXZVZMGJ-UHFFFAOYSA-N	446.467	1.810	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c(N)c([N+](=O)[O-])c1	729509652	YVXHSJLDPBWGQZ-UHFFFAOYSA-N	426.477	1.459	50	20	IDGD	
O=C(NNC(=O)[C@H](Oc1ccc(F)c(F)c1)c1ccccc1)N[C@@H]1CCS(=O)(=O)C1	730536843	WGJAHRMFJNDOPF-CXAGYDPISA-N	439.440	1.602	50	20	IDGD	
COc1cc(C=NNC(=O)Cc2nc3ccccc3n2C)cc(OC)c1OCC(N)=O	730546296	DNHCVVFSIWZTIP-UHFFFAOYSA-N	425.445	1.147	50	20	IDGD	
CSCC[C@H](NC(=O)c1cccc(C)c1)C(=O)NNC(=O)COc1ccccc1O	730781215	HWRPWMYQWNUJGE-INIZCTEOSA-N	431.514	1.779	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NNC(=O)Cc2ccccc2F)s1	731329961	IPQHGZCVMQFYDK-HNNXBMFYSA-N	425.507	1.739	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)CN1C(=O)CCc2ccccc21	731956892	ZJEHWUNJOMWKHU-UHFFFAOYSA-N	435.528	1.326	50	20	IDGD	
O=C(NNC(=O)C1CCN(S(=O)(=O)c2ccc3c(c2)OCCCO3)CC1)C1CCC1	732142840	KQERVJAUZZYPCS-UHFFFAOYSA-N	437.518	1.196	50	20	IDGD	
Cc1ccc(-c2nnc(S)n2CCC(=O)NNC(=O)CCN2C[C@@H](C)O[C@H](C)C2)cc1	732263749	OJHHQLCHDAFEJR-HZPDHXFCSA-N	446.577	1.579	50	20	IDGD	
Cc1ccc(CCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)cn1	732472957	FVQDKUBMDKQZRQ-UHFFFAOYSA-N	445.545	1.751	50	20	IDGD	
C[C@H](NC(=O)/C(C#N)=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)N(C)C	733163332	JYPHHKONEQJSIR-LERPTODRSA-N	442.907	1.579	50	20	IDGD	
CCOCCCn1c(NNC(=O)c2ccc(-n3cnnn3)cc2)nc2ccccc2c1=O	733269013	XKZZBLYXXSDCPW-UHFFFAOYSA-N	434.460	1.556	50	20	IDGD	
NS(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)c2ccc(F)cc2Br)c1	733368697	BSLWIAOGLFLTIV-UHFFFAOYSA-N	434.218	1.450	50	20	IDGD	
Cn1c(=O)c2cc(C(=O)NNc3ccc(Br)cc3Cl)cnc2n(C)c1=O	733808426	ZOAGTHNRAFXWNH-UHFFFAOYSA-N	438.669	1.805	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)Cc2csc(-c3ccoc3)n2)ccc1Cl	737766518	OXIBKOCVHFBZCU-UHFFFAOYSA-N	440.890	1.708	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCN(C(=O)OC(C)(C)C)[C@H](C)C2)cc1OC	741804427	QEUYVSSJMMMCCX-CQSZACIVSA-N	436.509	1.406	50	20	IDGD	
Cc1cc(F)c(S(=O)(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1[N+](=O)[O-]	742030121	YLSHTDBEWKQUSL-UHFFFAOYSA-N	438.441	1.058	50	20	IDGD	
O=C(COc1ccccc1O)NNS(=O)(=O)c1cc([N+](=O)[O-])ccc1Br	742292034	SONWRWCXIAHVNI-UHFFFAOYSA-N	446.235	1.451	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@@H]2SCCc3sccc32)cc1	742472820	UVRSQOAYBATRNV-QGZVFWFLSA-N	439.584	1.855	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@H]2C[C@@]23CCc2ccccc23)cc1	743288318	AZELBVVAUNEZFO-DENIHFKCSA-N	427.526	1.667	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)N[C@@H](C)CN1CCN(c2ccccc2)CC1	743633701	SKFDVLWRCIKVDU-SFHVURJKSA-N	425.533	1.779	50	20	IDGD	
CN(CC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)c1ccc(C(F)(F)F)cc1C=O	746447274	WAAGAUHYTDDTQI-UHFFFAOYSA-N	447.377	1.391	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)Cc1cn2ccccc2n1)c1ccc(S(=O)(=O)N(C)C)cc1	746754723	DIOCBDFZWVYJOE-AWEZNQCLSA-N	444.517	1.219	50	20	IDGD	
Cc1nc(C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)nn1-c1n[nH]c(C(F)(F)F)n1	747348565	SJOCKFVNQUESPJ-SSDOTTSWSA-N	442.333	1.080	50	20	IDGD	
C[C@@H](C=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O)c1cccc(Br)c1	747629668	KLEIHHDIGNEHHU-JTQLQIEISA-N	440.323	1.239	50	20	IDGD	
COc1ccc(/C=C(/C#N)C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1	747874189	UTSABPIKSCFFBQ-DQXUBXGMSA-N	437.408	1.133	50	20	IDGD	
C[C@H](NC(=O)C(C)(C)C)C(=O)NNc1ccc(S(=O)(=O)Nc2nccs2)cc1	747944723	WXNQXJXGVYRMJP-NSHDSACASA-N	425.536	1.938	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1CC(CC(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1)C2	748286946	DSKJIYAHNXDWFY-KKUMJFAQSA-N	429.539	1.137	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)NCCCN1CCN(c2ccncc2)CC1	748465809	SERMRRNOLXOLJJ-UHFFFAOYSA-N	430.484	1.142	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1	748619615	TYBBWMZKXLCDTF-RBSFLKMASA-N	426.489	1.321	50	20	IDGD	
O=C(NNc1ccc(OCC(F)(F)F)cc1)[C@@H]1CC(=O)N(CCN2CCOCC2)C1	748705046	WJLSXICKVFEGLM-CQSZACIVSA-N	430.427	1.252	50	20	IDGD	
O=C(NCCc1ccc(O)cc1)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	749347209	NSPNGHJHHVCFMU-UHFFFAOYSA-N	446.529	1.754	50	20	IDGD	
O=C(NCc1ccco1)NNC(=O)c1ccc2ncc(I)n2c1	749356466	BDCIABCRQGUORP-UHFFFAOYSA-N	425.186	1.676	50	20	IDGD	
Cc1cc(N2CCC(NC(=O)NNC(=O)C(=O)Nc3ccc(C)c(C)c3)CC2)nc(C)n1	749617559	ZNDIDFOBERXVPG-UHFFFAOYSA-N	439.520	1.648	50	20	IDGD	
C[C@@H](NC(=O)CC1CCCCC1)C(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	750233994	LNKBXSBVPMZUEA-CYBMUJFWSA-N	434.449	1.374	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)c1cn(Cc2ccccc2)nc1-c1cccnc1	751207337	VZFGCEPGBOEKGZ-UHFFFAOYSA-N	444.451	1.777	50	20	IDGD	
CCCNC(=O)Nc1ccc(CC(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1	751294842	UEMRTOXIITVMBM-UHFFFAOYSA-N	446.533	1.515	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(C#N)[nH]2)c1	751539274	SZIIRAABQDNGAE-UHFFFAOYSA-N	439.453	1.771	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)N[C@@H]1CCN(Cc2ccc(C#N)cc2)C1=O	753292001	MBPHXZNNONBKKD-QGZVFWFLSA-N	427.486	1.389	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)N[C@H]2CCCN(Cc3ccccn3)C2=O)nc2ccccc21	753301266	ZXYMZTCLEMUTEQ-KRWDZBQOSA-N	435.488	1.032	50	20	IDGD	
O=C(Cn1c(=O)ccn(Cc2ccccc2)c1=O)NNc1ccc(-c2ccccc2)nn1	754469588	FIQCGXCUSFDWSD-UHFFFAOYSA-N	428.452	1.659	50	20	IDGD	
CC1(C)C[C@@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)CCO1	754675320	MRFLXMBNRXATOK-INIZCTEOSA-N	438.550	1.763	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2ccc(-n3nccn3)cc2)cc1	755916028	NZALPBIXUTZAJV-UHFFFAOYSA-N	443.489	1.049	50	20	IDGD	
Cc1nc2ccccc2n1C[C@H]1CCCN1C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	756049072	COPHMDFVUOQOJS-GOSISDBHSA-N	445.487	1.839	50	20	IDGD	
CN(C)C(=O)Cn1ccc(NC(=O)NNC(=O)COc2ccccc2-c2ccccc2)n1	756311708	SYGHVNPUQVNJAV-UHFFFAOYSA-N	436.472	1.870	50	20	IDGD	
Cc1c(NC(=O)NNC(=O)COc2ccc(F)cc2)cccc1S(=O)(=O)NC1CC1	756706198	PXBKCPYYLBDQJW-UHFFFAOYSA-N	436.465	1.807	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)CN2C(=O)NC3(C[C@H](C)C[C@@H](C)C3)C2=O)cc1OC	756868482	USODPEZXFFPQGH-ZIAGYGMSSA-N	446.504	1.602	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)c(C(F)F)c2)c1	757917783	PCGUGGRMOJOTLW-UHFFFAOYSA-N	441.416	1.848	50	20	IDGD	
CCOc1cc2c(cc1[C@@H]1C[C@@H]1NC(=O)NNC(=O)C(=O)Nc1ccccn1)O[C@H](C)C2	758753471	QKMJMDMJHGSCTG-INWMFGNUSA-N	439.472	1.629	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)C(=O)Nc1ccccn1)c1ccc(NC(=O)c2ccncc2)cc1	758775804	KLYSPUPXRPSSJV-CQSZACIVSA-N	447.455	1.759	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)c2ccc(CS(=O)(=O)C(F)F)cc2)c1	759381712	VLBGXKFZQZMKSO-UHFFFAOYSA-N	440.424	1.750	50	20	IDGD	
C[C@@H](O)C[C@H](CNC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)c1ccccc1	759610937	MWEAVGGZSLHMAI-GDBMZVCRSA-N	434.518	1.981	50	20	IDGD	
CN1CCC(CNC(=S)NNC(=O)c2ccc(CSc3nncn3C)cc2)CC1	760466491	QOCXQXJJFXXCOY-UHFFFAOYSA-N	433.607	1.558	50	20	IDGD	
CC[C@@H]1CN(C(=O)/C(C#N)=C\c2cn(CCC(N)=O)nc2-c2ccc(OC)cc2)C[C@@H]1O	762209682	XLZZMCIWSCCQGZ-DCPLBHPDSA-N	437.500	1.570	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3ccc4ccccc4n3)cn2)C[C@H](C)O1	763451344	VCEMUXXGPRHEDT-GJZGRUSLSA-N	448.483	1.643	50	20	IDGD	
O=C(NNC(=O)c1ccccn1)C(=O)Nc1ccc(S(=O)(=O)c2ccc(F)cc2)cc1	763463184	AVQIKAZYAIWJFX-UHFFFAOYSA-N	442.428	1.453	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)cn2)C[C@H](C)O1	763468495	LHEDHANXQRNETB-STQMWFEESA-N	442.432	1.003	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)n(-c2ccc(F)cc2)n1	763470782	OVDRZRCNPVSXKD-UHFFFAOYSA-N	426.364	1.628	50	20	IDGD	
CCNC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2ccccc2Br)c1	763482071	DSXOBDLQSCGDQT-UHFFFAOYSA-N	448.277	1.990	50	20	IDGD	
CNC(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)COc2cc(C)cc(C)c2)c1	763643888	AQFRTZGIAQZZMU-UHFFFAOYSA-N	432.864	1.481	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(OC)c(OC(C)C)c1	763656839	GANGDVQAZZEVSO-UHFFFAOYSA-N	431.445	1.656	50	20	IDGD	
CCN(CC)C(=O)c1ccccc1NC(=O)C(=O)NNC(=O)COc1ccc(OC)cc1	763660086	WRCHYZYPSQHCEA-UHFFFAOYSA-N	442.472	1.342	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(-c2ccccc2)ns1	763662984	DMHOJNCDGNTVPU-UHFFFAOYSA-N	426.454	1.984	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)cnc1Br	763694388	GPVGZAIMUJRXMQ-UHFFFAOYSA-N	441.669	1.971	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(Cl)c(C[S@@](C)=O)c2)c1	763760375	LHQNTWMKZBHIHU-GDLZYMKVSA-N	436.921	1.684	50	20	IDGD	
COc1ccc(NC(C)=O)cc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccccc1F	763857288	MNFHWDFZOFOKSN-LLVKDONJSA-N	432.408	1.346	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)NNC(=O)C(=O)Nc1ccc(CN2C(=O)CCC2=O)cc1	763865016	GWWOJSMXPSGVIM-UHFFFAOYSA-N	447.451	1.146	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1cccc(-c2nccn2C)c1	763874042	YWCZDIZCPPDRAR-ZDUSSCGKSA-N	425.420	1.780	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(Cl)c(C(N)=O)c2)cc1OC	763902038	MMBAMYWGLTXZES-UHFFFAOYSA-N	434.836	1.246	50	20	IDGD	
O=C(Cc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1ccccc1S(=O)(=O)C(F)F	763941850	RDTHGLOHSSRVRB-UHFFFAOYSA-N	445.831	1.665	50	20	IDGD	
CNC(=O)c1ccc(OC)c(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2OC)c1	764011574	JFLMIBLLHGZHCK-UHFFFAOYSA-N	434.836	1.117	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1ccc(-n2cnnn2)c(C)c1	764011923	LIVZCGKRSYJNPO-UHFFFAOYSA-N	429.824	1.032	50	20	IDGD	
COC(=O)COc1cccc(NC(=O)C(=O)NNC(=O)c2cccc(C(F)(F)F)c2)c1	764040543	MAQJTTNTVFTFHS-UHFFFAOYSA-N	439.346	1.657	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc(Cl)c(C(N)=O)c3)n[nH]2)cc1	764110439	JZGXLYQGFJBONI-UHFFFAOYSA-N	440.847	1.537	50	20	IDGD	
Cc1ncsc1C(=O)NNC(=O)C(=O)Nc1cc(C(C)(C)C)nn1-c1ccccn1	764245355	DYJRIARNHVNEPB-UHFFFAOYSA-N	427.490	1.729	50	20	IDGD	
O=C(NNC(=O)c1cccc2ncccc12)C(=O)Nc1cccc(CN2CCCC2=O)c1	764258343	ZPCLBRRLLFCNRR-UHFFFAOYSA-N	431.452	1.757	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)C(=O)Nc1cccc(-c2nnnn2C2CC2)c1	764287852	BFLGMIDJCMQZBC-UHFFFAOYSA-N	435.444	1.099	50	20	IDGD	
CN(C)CC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)C(C)(C)c2ccccc2)cc1	764309859	WNZQCABDHHYWIX-UHFFFAOYSA-N	425.489	1.250	50	20	IDGD	
O=C(NNC(=O)c1cc2ccccc2o1)C(=O)Nc1ccc2nc(N3CCOCC3)oc2c1	764343948	XSOAXLSOQNPCDR-UHFFFAOYSA-N	449.423	1.810	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)C(=O)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1	764354295	PHYYUKUDKKWOHZ-LJQANCHMSA-N	447.499	1.054	50	20	IDGD	
CC(C)(C)OC(=O)N1CCc2c(NC(=O)C(=O)NNC(=O)Cc3ccncc3)cccc21	764355799	JFEKIFOTSNYHRJ-UHFFFAOYSA-N	439.472	1.708	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)C(=O)Nc1ccnc(Sc2ccccn2)c1	764367185	JQKDROPGXPCEAK-UHFFFAOYSA-N	437.481	1.931	50	20	IDGD	
O=C(NNC(=O)C(F)(F)Oc1ccccc1)C(=O)Nc1ccc(OCC(F)(F)F)nc1	764369564	HZCAXTXFCRRYSV-UHFFFAOYSA-N	448.304	1.780	50	20	IDGD	
COc1cc(F)ccc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccccc2OC)[nH]n1	764376318	BOSCPMSTYVPSQO-UHFFFAOYSA-N	427.392	1.633	50	20	IDGD	
Cc1nn(C)c2ncc(NC(=O)C(=O)NNC(=O)c3cc(-c4ccc(F)cc4)[nH]n3)cc12	764387979	OYOOVADOVPZLLR-UHFFFAOYSA-N	436.407	1.206	50	20	IDGD	
CNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)CSc2ccccc2OC)c1C	764397716	MGFLMZTUQWEMIC-UHFFFAOYSA-N	430.486	1.241	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1cc(Cl)ccc1N1CCSCC1	764401482	XAZBISASDRWUOA-LBPRGKRZSA-N	444.941	1.031	50	20	IDGD	
CN(C)c1nnc(-c2ccc(NC(=O)C(=O)NNC(=O)c3ccc(Cl)cc3F)cc2)o1	764410409	OREZISGXQAWYSZ-UHFFFAOYSA-N	446.826	1.995	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)Nc3cc(F)cc(F)c3)nc2)CC1	765282311	MLZKPZVHSBWKCZ-UHFFFAOYSA-N	426.449	1.445	50	20	IDGD	
O=C(NCc1cccc(N2CCCS2(=O)=O)c1)NNC(=O)c1cc2c(s1)CCC2	765305255	YWRUXBWKJUOECQ-UHFFFAOYSA-N	434.543	1.921	50	20	IDGD	
CCc1ccc(S(C)(=O)=O)cc1C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C	765318625	KCKLABRGHADLLU-UHFFFAOYSA-N	427.523	1.718	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(NC(=O)C(=O)NNC(=O)OC(C)(C)C)ccc1C	765393881	UHCHBUYMVNPFAF-UHFFFAOYSA-N	428.511	1.520	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)c3ccc(S(=O)(=O)N(C)C)o3)n[nH]2)cc1	765571256	HMOBBIDMWWQDKH-UHFFFAOYSA-N	431.474	1.557	50	20	IDGD	
Cc1nn2c(C=NNC(=O)CN3CCN(C(=O)c4ccccc4)CC3)c(C)nc2s1	765581993	BJQJPXAOOVNIOC-UHFFFAOYSA-N	425.518	1.316	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)CN2C(=O)[C@H]3CCCC[C@@H]3C2=O)n[nH]1	765603738	SQNMSKSCFQVLPP-STQMWFEESA-N	425.445	1.022	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cc(-c4ccccc4)[nH]n3)CC2)cc1	765748782	QIWNLZQIARWGCB-UHFFFAOYSA-N	432.528	1.964	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)[C@@H]1CCc2c[nH]nc2C1	766661184	SMKXIGGGYWYDAI-OAHLLOKOSA-N	430.940	1.133	50	20	IDGD	
Cn1cnc(CNC(=O)/C(C#N)=C\c2cn(CCC(N)=O)nc2-c2ccc(Cl)cc2)n1	769122928	UFNGYWBXWXGROV-ZSOIEALJSA-N	438.879	1.431	50	20	IDGD	
CS(=O)(=O)c1ccc(C(=O)NNC(=O)COc2ccccc2F)cc1Br	769606268	CWTZNZXXWRFWOH-UHFFFAOYSA-N	445.266	1.832	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1cccc(S(=O)(=O)N(C)c2ccccc2)c1	771868444	PFVJLKXWZGVYBH-CQSZACIVSA-N	433.486	1.614	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)NCC1CCN(c2ccncc2)CC1	772612377	MOKOZQOAQMTNGT-UHFFFAOYSA-N	428.449	1.616	50	20	IDGD	
O=C(NN=Cc1ncc(C2OCCO2)s1)c1ccc(S(=O)(=O)N2CCCC2)cc1	773017829	HWZWKFNOIRSSOQ-UHFFFAOYSA-N	436.515	1.737	50	20	IDGD	
Cc1c(Cl)cccc1NNC(=O)C(=O)Nc1ccccc1OCC(=O)N1CCOCC1	773766958	TVSPXBPCWLRBOA-UHFFFAOYSA-N	446.891	1.968	50	20	IDGD	
CS(=O)(=O)C[C@H](NC(=O)NNC(=O)c1cc(Br)c[nH]1)c1ccccc1	774278656	IPTKBLRJVZYQAL-ZDUSSCGKSA-N	429.296	1.507	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@H]2CCc3cc(O)ccc3C2)cc1	775083833	ZKAVOEDALJMVOH-KRWDZBQOSA-N	446.529	1.209	50	20	IDGD	
CN(C)CC(=O)NNC(=O)Nc1sc2c(c1C(=O)N1CCOCC1)CCC(C)(C)C2	775668789	WZMSKJPQQRMBTF-UHFFFAOYSA-N	437.566	1.450	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)Nc1ccc(C[C@@H]2NC(=O)NC2=O)cc1	775702684	MDINNBWAILHMEW-AWEZNQCLSA-N	443.485	1.391	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3ccc4nsnc4c3)cc2)CC1	776711471	NNJNSVLWYUBNAQ-UHFFFAOYSA-N	432.531	1.384	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)ccc1Cl	778224170	DLJPXBXBSREABH-UHFFFAOYSA-N	448.791	1.449	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CNC(=O)OC(C)(C)C)cc1I	778437135	TZLSXPWDWFRCBY-UHFFFAOYSA-N	449.245	1.586	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@H](C(=O)NNc2ccc(OC(F)F)cc2)[C@@H](C)O)cc1	779535361	SIPOXDCBLSFBGC-WBMJQRKESA-N	429.445	1.767	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)c1cc(O)cc([N+](=O)[O-])c1	780322670	OWDWIMYSVOQDBV-UHFFFAOYSA-N	448.457	1.550	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@]2(C[C@H]2C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)C1	780601437	VQRQLDSLWLMOAS-KSFYIVLOSA-N	444.536	1.488	50	20	IDGD	
COC(=O)c1ccccc1NNC(=O)[C@H]1CCCN1C(=O)/C=C\c1ccc(C(N)=O)cc1	780730833	DKAHQVXSHOEIIA-QTJNJRLBSA-N	436.468	1.720	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NN=Cc3cnc(N)nc3)c2)cc1	781571364	JEDIOUZVIKQZCX-UHFFFAOYSA-N	426.458	1.632	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2ccc(O)cc2)cnc(Cl)c1Br	782833858	MJVJHQKUOGSXJA-UHFFFAOYSA-N	427.642	1.911	50	20	IDGD	
NC(=O)COc1ccc(NC(=O)C(=O)NNc2ccc(Br)cc2F)cc1	783086398	NXNHKSJMQYEHED-UHFFFAOYSA-N	425.214	1.534	50	20	IDGD	
CSCc1cccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)c1	783264988	VNNRCTXCNBUPSP-UHFFFAOYSA-N	437.547	1.713	50	20	IDGD	
Cc1cccc(Oc2ncccc2NC(=O)C(=O)NN[C@]2(C)CCS(=O)(=O)C2)c1C	783426522	MLKWMJNZAKDHTB-HXUWFJFHSA-N	432.502	1.627	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)C(=O)Nc1cccc(-n2cccn2)c1	784212909	HGTNXEGHUVZYSG-UHFFFAOYSA-N	440.485	1.395	50	20	IDGD	
COc1ccc(C(=O)CCC(=O)NNC(=O)c2ccc3c(c2)OCCO3)c(OC)c1OC	784589474	XRTMWRAYYMTVAW-UHFFFAOYSA-N	444.440	1.908	50	20	IDGD	
CN(C)C(=O)COc1ccc(NC(=O)C(=O)NNc2cccc(C(F)(F)F)n2)cc1	784955604	ZRWSDJDXVQSIMP-UHFFFAOYSA-N	425.367	1.649	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNc2cc(F)c(F)c(F)c2)ccc1S(=O)(=O)N(C)C	785083488	PCIWTTVMYGWOKT-UHFFFAOYSA-N	446.407	1.445	50	20	IDGD	
CC(C)CN1C[C@H]2CN(C(=O)NNC(=O)c3cc(Br)c[nH]3)CCN2C1=O	787734424	DEPUUPNLYJXPOP-GFCCVEGCSA-N	427.303	1.209	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1ccnc(Oc2ccc(F)cc2F)c1	789740050	SNOPOMLYJDJZDZ-LLVKDONJSA-N	438.387	1.290	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C(=O)Nc2nc3c(s2)CCCCC3)nc2ccccc21	789750023	YTARPEYFJISIFI-UHFFFAOYSA-N	426.502	1.627	50	20	IDGD	
COc1cc(F)cc(NNC(=O)C(=O)Nc2ncn(Cc3ncc(C)c(OC)c3C)n2)c1	789776427	DYVFFVYFWUFPFB-UHFFFAOYSA-N	443.439	1.576	50	20	IDGD	
Cc1ccc(CN2CC[C@@H](NC(=O)NNC(=O)c3cc([N+](=O)[O-])ccc3O)C2=O)cc1	790696786	NVZDZFJRHKAAIE-MRXNPFEDSA-N	427.417	1.354	50	20	IDGD	
CC(C)(C)OC(=O)NC(C)(C)c1cc(C=NNC(=O)N[C@H]2CCS(=O)(=O)C2)on1	792985708	KYFNCXUVVFOQLM-NSHDSACASA-N	429.499	1.255	50	20	IDGD	
O=C(NNS(=O)(=O)c1c(F)c(F)cc(F)c1F)c1csc(N2CCOCC2)n1	795285780	YSBIYRXWRUVFHA-UHFFFAOYSA-N	440.400	1.159	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2cc(Br)cc([N+](=O)[O-])c2C)n1	797539055	TZPPHAYUIOQJNR-UHFFFAOYSA-N	436.222	1.769	50	20	IDGD	
O=C(CCCc1ccccc1)NNC(=O)NCCNS(=O)(=O)c1ccc(F)cc1F	799369556	UJPZYLMTXQDGAO-UHFFFAOYSA-N	440.472	1.596	50	20	IDGD	
O=C(NNc1ccc(-n2cccn2)nn1)C(=O)Nc1ccc(OCC(F)(F)F)c(F)c1	800626983	CJQQUIXPSIJDFK-UHFFFAOYSA-N	439.329	1.824	50	20	IDGD	
NS(=O)(=O)Cc1cccc(CNC(=O)NNC(=O)Cc2ccc3ccccc3c2)c1	800718012	YUHHPXZQRUPMEQ-UHFFFAOYSA-N	426.498	1.701	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)[C@H](C)NS(=O)(=O)c2c(C)nn(C)c2C)c(Cl)c1	802047380	CGCCLHWUDSMMJE-NSHDSACASA-N	442.929	1.518	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(CC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)C1	802069119	WYPSRHDPIIUDEM-UHFFFAOYSA-N	426.495	1.500	50	20	IDGD	
CCC1(CC)NC(=O)N(CC(=O)NNC(=O)Nc2cc(OC)c(Cl)cc2OC)C1=O	802084361	YVQFFVMDXLNVES-UHFFFAOYSA-N	441.872	1.621	50	20	IDGD	
CC(C)(C)[C@@H]1CCc2sc(C(=O)NNC(=O)NC3CC(NS(C)(=O)=O)C3)cc2C1	802418705	PHJKBIPMIXRIHO-IYXRBSQSSA-N	442.607	1.923	50	20	IDGD	
CC[C@H]1CN(C(=O)NNC(=O)c2ccc(OC)c(Br)c2)C[C@H](C)S1(=O)=O	805103831	FGRZSHRKWVZPNM-JQWIXIFHSA-N	448.339	1.710	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)Nc2cccc3c2CNC3=O)c2ccccc2c1=O	806750244	OMLVHMZYZAVTBM-UHFFFAOYSA-N	434.456	1.907	50	20	IDGD	
O=C(NCCOc1ccc(Cl)cc1)NNC(=O)c1csc(N2CCOCC2)n1	806969426	VBJNMIIZARNGDQ-UHFFFAOYSA-N	425.898	1.656	50	20	IDGD	
CCC(C)(C)[C@H]1CCc2nc(NC(=O)C(=O)NNC(=O)[C@H](C)OCCOC)sc2C1	806978984	KIRSJMKFPBBBTB-STQMWFEESA-N	440.566	1.822	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)Nc1ccc(Oc2cccnc2)cc1	808934796	VPPXBYUMGJPURN-IBGZPJMESA-N	434.408	1.800	50	20	IDGD	
C[C@H]1Oc2ccccc2[C@H]1NC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	812430050	FAWMKIHFBALFGC-KUHUBIRLSA-N	446.533	1.166	50	20	IDGD	
CC(C)N(C)C[C@H](C)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	812509048	IEWLBRWFEKHBNA-HNNXBMFYSA-N	425.555	1.144	50	20	IDGD	
CCCc1nnc(SCC(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)n1N	813495638	HIDDUXXBPZCXKT-UHFFFAOYSA-N	425.465	1.350	50	20	IDGD	
O=C(COC(=O)C1CCC(OC[C@@H]2CCCO2)CC1)NNC(=O)c1cccc([N+](=O)[O-])c1	815346280	DEOWZGASRJHRLU-UYJHFMRCSA-N	449.460	1.653	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(C#N)cn2)cc(OCC)c1OCC	815563837	PTEOZBBMITVHIC-UHFFFAOYSA-N	441.444	1.549	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)CC2CCCC2)nnn1CCOc1ccc(F)cc1	815568447	IBFPVKLIGFAWEV-UHFFFAOYSA-N	432.456	1.471	50	20	IDGD	
CCCOc1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2CCc3nncn3C2)cc1OCCC	815691376	OHHOQKCIPHNZDE-CQSZACIVSA-N	444.492	1.204	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCc2nncn2C1)C(=O)Nc1ccc(Cl)c(Br)c1	815691755	AFGCSZIPKOTHDL-QMMMGPOBSA-N	441.673	1.043	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCc2nncn2C1)C(=O)Nc1cc(Cl)ccc1OC(F)(F)F	815692001	HICOGIIZPVBFFJ-QMMMGPOBSA-N	446.773	1.179	50	20	IDGD	
CCOC(=O)c1c(NC(=O)/C(C#N)=C\c2cn(C)c(=O)n(C)c2=O)sc2c1CCCC2	844152634	OPJBFNXGFIYJKM-XFXZXTDPSA-N	442.497	1.747	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)CCNS(=O)(=O)c1cccs1	869746125	ACXRUFOBHYXXNC-UHFFFAOYSA-N	427.504	1.042	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)[C@@H]2COc3ccc(OC)cc3C2)c2ccccc2c1=O	914775399	NAVSTNUQAZEBAP-HNNXBMFYSA-N	436.468	1.827	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)NCC(=O)Nc2ccc(Br)cc2C)n1	915897657	OBQNKTUZIWXOBI-UHFFFAOYSA-N	437.298	1.540	50	20	IDGD	
CNS(=O)(=O)Cc1ccc(CNC(=O)NNC(=O)Cc2cccc3ccccc23)cc1	916228534	FPRMYLQRQPADCU-UHFFFAOYSA-N	440.525	1.962	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NN=C(C)c1cccnc1)N(S(C)(=O)=O)CC2	916354509	CTKOYVLQEFWFBF-SFHVURJKSA-N	446.529	1.888	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)N1CCc2ccccc2C1	916603856	LDJXMBULQHAUSJ-HNNXBMFYSA-N	430.530	1.481	50	20	IDGD	
Cc1nc(-c2cccnc2)nc(O)c1CC(=O)NNC(=O)[C@H](C)Oc1ccccc1F	918203845	LDZFMHHMPSLDMZ-ZDUSSCGKSA-N	425.420	1.849	50	20	IDGD	
CSCC[C@H](C(=O)NNC(=O)c1ccc(C)cc1O)N1C(=O)c2ccccc2C1=O	918340872	FZSUGXPRAGUTJF-MRXNPFEDSA-N	427.482	1.880	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN(S(=O)(=O)c2ccccc2)C1)c1ccc(Cl)cc1O	918359392	ZHYDOKCRVQHCER-ZDUSSCGKSA-N	437.905	1.908	50	20	IDGD	
CCS(=O)(=O)NC1CCN(C(=O)NNC(=O)c2cc3c(s2)CC[C@@H](C)C3)CC1	918779542	YUHJJWYFNCDUQT-GFCCVEGCSA-N	428.580	1.631	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@@H]1CCCN(CC(F)(F)F)C1	919810108	YBGQYPCFZWWEIJ-GFCCVEGCSA-N	435.472	1.323	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)c2cccc(N3CCCS3(=O)=O)c2)o1	920272412	UCFGKESTIBGLMV-UHFFFAOYSA-N	434.518	1.736	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	921298582	AWPFJVOVADQSBR-UHFFFAOYSA-N	440.522	1.147	50	20	IDGD	
COC(=O)c1ccc(OC)c(S(=O)(=O)NNC(=O)c2cncn2-c2ccccc2)c1	1116189668	UGUYBRYTBKEVPR-UHFFFAOYSA-N	430.442	1.291	50	20	IDGD	
O=C(NNC(=O)c1n[nH]c2c1CCCC2)/C(=C\c1cccnc1)NC(=O)c1ccccc1	1251810148	AQDKIOWEMDDSDT-CPNJWEJPSA-N	430.468	1.916	50	20	IDGD	
CN(CCCNC(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1)CC(F)(F)F	1328687772	VVMKUMIACXFDDZ-UHFFFAOYSA-N	439.479	1.848	50	20	IDGD	
CNC(=O)c1cc(Cl)cc(S(=O)(=O)NNC(=O)c2ccccc2Cl)c1OC	1345377799	OLJRPVMACBXECQ-UHFFFAOYSA-N	432.285	1.985	50	20	IDGD	
O=C(c1ccn2nccc2c1)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1778734182	GDKONMIEGOIBQH-PBHICJAKSA-N	425.258	1.468	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)o1	1779024586	UUPBAQJBDSHCNH-XIKOKIGWSA-N	442.310	1.713	50	20	IDGD	
Cc1cccn2ncc(C(=O)N3CCO[C@@]4(CCN(C(=O)CO[Si](C)(C)C)C4)C3)c12	1779299414	SQHFTEMNRCOQPQ-OAQYLSRUSA-N	430.581	1.938	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CNC(=O)c2cc(C)on2)C1	1779435752	IGMHOHHGCJPAGS-YYFZDKIDSA-N	440.928	1.244	50	20	IDGD	
CCOc1ncc(Cl)cc1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1779679993	GTZWEJNAAVAXEY-KDOFPFPSSA-N	432.304	1.177	50	20	IDGD	
O=C(C1=C2c3ccccc3C(=O)N2CC1)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Cl)CCO2	1780004328	BUZMWDYZLZQGSK-LAUBAEHRSA-N	433.867	1.622	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cn4[nH]cnc(=O)c4c3C)C2)C1	1780016172	FMOCINYRNVTXEX-MGPUTAFESA-N	435.912	1.182	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccoc3Cl)C2)C1	1780454739	XCBWVRDFGJXFIV-IYHCKTHZSA-N	447.879	1.511	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(O)nn1)C2	1780710323	PKSRCFWQPBMTDS-JEBQAFNWSA-N	431.320	1.546	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H]3CC[C@@H]4CCC(=O)N4C3)C2)C1	1781059835	TUZQTZHYVFQEPA-HRLGVUPISA-N	442.354	1.001	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnc(N(C)C)o1)C2	1782171102	ONKJQGJCDYKVOV-ZBQZNYHESA-N	428.917	1.122	50	20	IDGD	
COc1cc2c(O)cccc2cc1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1782388028	XYRWSLCBYZSQQI-GCJKJVERSA-N	448.903	1.597	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C=C(/C)C(=O)O)C1	1783161661	DRQPAGVELKRLFG-ZDBYUICRSA-N	431.327	1.705	50	20	IDGD	
C[C@@H](O)C(=O)N1CC[C@]2(CN(C(=O)/C(C#N)=C/c3ccc(Br)cc3)CCO2)C1	1783527307	YCYDSPRYYUBRIP-AFVLYDJWSA-N	448.317	1.567	50	20	IDGD	
CC(C)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CSc3ncccn3)C[C@@H]21	1783850850	VAINMKKLMHFTFP-KKUMJFAQSA-N	426.970	1.813	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc([N+](=O)[O-])o3)C[C@@H]21	1783964005	GSDWFDNZVCUJPW-UHXUPSOCSA-N	444.282	1.812	50	20	IDGD	
COc1ccc([C@@H]2C[C@H]2C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]3C2)cc1	1784085038	BQAQQPSXKQSMSH-MWVHYEFZSA-N	436.936	1.378	50	20	IDGD	
O=C(C[C@H]1COc2ccccc2O1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21	1784391351	CTVNITCUWOFZLX-SVZGUOJNSA-N	426.872	1.731	50	20	IDGD	
C=C(Oc1ccccc1O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](Cl)COC)C[C@@H]21	1787502707	LFGNWZXYPAULDP-GGXPGOJBSA-N	438.908	1.518	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)c1c[nH]c2ncccc12	1787875963	SGLIKBANDQDXGZ-RCBQFDQVSA-N	435.322	1.941	50	20	IDGD	
CC(=O)O[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)Br)C[C@@H]21)C(C)C	1788479117	CLOVVIUVSLKIIJ-YDMUCJKGSA-N	433.343	1.337	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccn4cncc34)C[C@@H]21	1788764713	SKYGEHMMMIKDBU-IEZWGBDMSA-N	430.581	1.779	50	20	IDGD	
CC(C)(C)c1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Br)C[C@@H]32)[nH]n1	1788916716	RZQRVTUEINWBJV-TZQJONAQSA-N	445.333	1.991	50	20	IDGD	
CCOc1ncc(Cl)cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21	1788978344	MYAGMLDXHUGPEM-DDWPSWQVSA-N	446.331	1.327	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1ccc(C2(NC(=O)Cc3cc[nH]n3)CCC2)cc1	1789522004	VAARZLRWJJYHAJ-UHFFFAOYSA-N	433.472	1.399	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccnc4c3OCO4)C[C@@H]21)[C@@H](F)Br	1789924593	NWUUOTIZPYBBCU-QVSJOPQTSA-N	444.257	1.094	50	20	IDGD	
Cc1cnn([C@@H](C)C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]3C2)c1	1789926985	MXXWUJGMHHUDBO-YTFOTSKYSA-N	431.306	1.423	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc(N)s3)C[C@@H]21	1790960882	BTMIDYUHIYMAJW-BJDJZHNGSA-N	431.356	1.492	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CC(=O)OC(C)(C)C)C[C@@H]21	1791055211	OMBBBUMAPAYTOM-RFGFWPKPSA-N	433.343	1.481	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc(F)cn3)C[C@@H]21	1791058054	NZDJSWHWYBMEOH-KNPMLCFXSA-N	428.302	1.526	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)Br)[C@H]2C1	1791063642	OMJZYTZUIPVQCG-NWBUJAPZSA-N	440.176	1.923	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ncn(-c4ccccc4)n3)C[C@@H]21	1791254002	HKLITBDWVHOBDJ-OWLYRPNTSA-N	447.923	1.114	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc4ccc(F)cn34)C[C@@H]21	1791257294	XEHLJUFLNGXBRA-FAYQHZLMSA-N	438.887	1.321	50	20	IDGD	
CN(CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]2C1)C(=O)OC(C)(C)C	1791294446	YTXPZCFAUXQIAA-AVGNSLFASA-N	438.352	1.637	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCNC(=O)OC(C)(C)C)[C@H]2C1	1792125240	GYOTZZDELNYDKP-JONQDZQNSA-N	447.960	1.135	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c[nH]c(-c3ccc(F)cc3)c1)C2)[C@@H](O)CCl	1792976410	TYICCRKDPPUTRZ-QXGSTGNESA-N	435.883	1.624	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/C(=O)NCc1ccccc1	1793074639	QXYBLOWRHJLNSN-KTPFRNPESA-N	433.936	1.751	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(C)oc1C	1794708533	PGEOHNNLCKEPIJ-HGQKDGAKSA-N	441.488	1.234	50	20	IDGD	
CC(C)CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1795099605	VOJFTJUMKDIGGN-IVSAIRAKSA-N	431.961	1.754	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnn2ccccc12	1797359516	PKLOAJKMIKFGPX-CKFWPPNZSA-N	447.499	1.720	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2cnccc2[nH]1	1797518796	MHEQBHMECHGGDM-LOUJCGABSA-N	435.322	1.940	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnc2sc(C)cn2c1=O	1797606431	UAVAZEJMHWQYNK-XFMPKHEZSA-N	438.937	1.570	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2[nH]ccc2s1	1797667272	UMWUPPBHVMBGIN-CLLJXQQHSA-N	438.513	1.794	50	20	IDGD	
CC(=O)N[C@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2)c1ccc(F)cc1	1799052985	FIRYESBFQQJWPS-KUHBDSFDSA-N	429.851	1.127	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2nn(C)cc2c1	1799911118	CULQZXKLZCODDJ-DFGXFYAUSA-N	449.349	1.950	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](F)Br)c1cccn2c(O)nnc12	1800159317	QSMZAJXTNYRXAI-WYFGTUCQSA-N	426.246	1.377	50	20	IDGD	
N#Cc1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)c(Cl)c1	1800688529	QJIAALAPJSMTAI-BCDXTJNWSA-N	437.692	1.457	50	20	IDGD	
Cc1cccc2c(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@@H](C)Br)n[nH]c12	1800762117	NZNXOPPDEVFTJB-NFFDBFGFSA-N	435.322	1.858	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccnc(C(F)(F)F)c1)C2	1800973512	BWEKOPCKYKQPGR-QVHKTLOISA-N	435.830	1.557	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1Cc2[nH]nc(C(F)(F)F)c2C1)[C@@H](O)CCl	1801413534	GWEDAPUVJXLBTR-JVWRJRKNSA-N	434.846	1.381	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@H](CNC(=O)CN2CCOC2=O)[C@@H]1c1cccnc1	1803337995	FPWDAWVDVDRRDT-LPHOPBHVSA-N	434.569	1.391	50	20	IDGD	
CCS(=O)(=O)CC(=O)NC[C@@H]1CCN(C(=O)C(C)(C)CCl)[C@@H]1c1cccnc1	1803509252	JISQGRKNKFKOMZ-DOTOQJQBSA-N	429.970	1.787	50	20	IDGD	
CC(=O)NC(C)(C)C(=O)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@H]1c1cccnc1	1803597168	YRZXSYLYOHVTRN-KKUMJFAQSA-N	443.317	1.693	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)CCN2CCN(C)CC2)[C@H]1c1cccnc1	1806918086	YPUKQJZAEJJYNP-IRFCIJBXSA-N	436.000	1.742	50	20	IDGD	
C[C@]1(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)CC=CCC1	1807375598	UFHNORJCYLNVFF-HOKHCIIBSA-N	447.344	1.827	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)NC[C@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1	1808427741	RWLBXHVHCIOIDV-QBIMZIAESA-N	439.354	1.739	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)c3cccc4c3OCC4)CC2)C1	1809977885	KSAJFNDPKLXSRM-UHFFFAOYSA-N	448.328	1.460	50	20	IDGD	
Cc1ncoc1C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1	1810299921	VMWCWOHHEZHZNS-QAPCUYQASA-N	449.471	1.010	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)C23CC(C2)C3)[C@@H]1c1cccnc1	1810309090	OZEQGTZHLCVMIS-ARTHDXMKSA-N	434.500	1.200	50	20	IDGD	
CC(=O)N/C(C)=C/C(=O)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@H]1c1cccnc1	1812320329	FQYOQHQNPVCVQV-MGEMVTEXSA-N	441.301	1.818	50	20	IDGD	
CC(C)[C@H](S)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1815240989	XNXZQRLEJCIUFA-AEFFLSMTSA-N	430.339	1.350	50	20	IDGD	
Cc1ccc(CC(=O)N2CCCC[C@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)cc1	1817471632	UGHVYARAACDJNW-NRFANRHFSA-N	446.316	1.947	50	20	IDGD	
CCc1ccnc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)c1	1817475552	SVBWWABNFSHBTE-FQEVSTJZSA-N	447.304	1.667	50	20	IDGD	
O=C1Cc2cc(C(=O)Nc3cc([C@H]4CCCCN4C(=O)[C@H](O)CCl)[nH]n3)ccc2N1	1818979325	BQRVAXPFIPYFOY-HZPDHXFCSA-N	431.880	1.810	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc[nH]1)CC2	1819797875	NXXVQYVYWCYHLW-SNVBAGLBSA-N	425.474	1.009	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](O)N2CCOCC2)[nH]n1	1820865836	CFAGVTPEHDTYCB-YEWWUXTCSA-N	448.351	1.289	50	20	IDGD	
C[C@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H](O)CCl)CC1)[C@H]1SC(=N)NC1=O	1824183132	PRCPCBQBYHJFPO-SPWCGHHHSA-N	444.985	1.008	50	20	IDGD	
COc1ccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)cn1	1824742104	FNKYPIVHKYKVTR-IBGZPJMESA-N	445.564	1.697	50	20	IDGD	
Cc1ccn(CC(=O)N2CCCC[C@@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)n1	1825274353	MYNVJLFERFXFFB-LJQANCHMSA-N	432.569	1.184	50	20	IDGD	
C[C@H](Cn1cccn1)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1	1825342324	UQJFDBLIXWTBKP-QUCCMNQESA-N	446.596	1.512	50	20	IDGD	
C[C@H](C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2)c1ccccc1	1828230758	SBCZCFMFSDZWHX-KSSFIOAISA-N	449.341	1.852	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CO[Si](C)(C)C)CC1	1829101906	HNLBPVPAFXQHHB-IRXDYDNUSA-N	426.634	1.905	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC[C@H]1C1CCN(C(=O)C2=NNC(=O)C2)CC1	1831552612	DTJMIYOQPAITLZ-ZFWWWQNUSA-N	427.343	1.656	50	20	IDGD	
C[C@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1)n1ccnc1	1831870494	DJMDKYLULGKMKS-IEBWSBKVSA-N	432.569	1.437	50	20	IDGD	
Cc1ccnc(C(=O)N2CCC([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)c1	1831873085	IYLADMMFQNOZSP-HXUWFJFHSA-N	429.565	1.996	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)[C@H]3CCCS3(=O)=O)CC2)CC1	1833534645	JYRJOLYZURFKMR-QZTJIDSGSA-N	448.029	1.543	50	20	IDGD	
Cn1cc(CCC(=O)N2CCC(N3CCC(NC(=O)CO[Si](C)(C)C)CC3)CC2)cn1	1835833386	CEYOMPBXVXDKMV-UHFFFAOYSA-N	449.672	1.776	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)CCN(C)C(C)=O)CC2)CC1	1837041213	YUSNMCUCMWSUBE-GOSISDBHSA-N	431.961	1.107	50	20	IDGD	
N[C@@H](Cc1cscn1)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](F)Cl)CC2)CC1	1838062597	TZDZNOUDXCMUFU-JKSUJKDBSA-N	432.949	1.546	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3c(C)nc4ccccn34)C2)C1	1839144445	ACJZHGZMYOPNDC-IERDGZPVSA-N	434.924	1.730	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(-n4cccn4)nc3)C2)C1	1839146863	YQRKAOYEZKKTSY-UWJYYQICSA-N	447.923	1.355	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnn4cccc(C)c34)CCO2)C1	1839612129	BBFFPOCYKFBHNM-UWJYYQICSA-N	434.924	1.730	50	20	IDGD	
CCOc1ncccc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840186527	AGYVQGFUTRTMSP-SFHVURJKSA-N	432.304	1.354	50	20	IDGD	
C[C@@H](CC(N)=O)C(=O)N1CCCC12CN(C(=O)[C@@H](Br)Cc1ccccc1)C2	1841658976	RPUILFSUNOIZPY-HOCLYGCPSA-N	436.350	1.708	50	20	IDGD	
O=C(CC[C@@H]1CNc2ccccc2C1)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843013302	FARJDHWYRONTKE-SFHVURJKSA-N	447.344	1.248	50	20	IDGD	
CCSc1cccnc1C(=O)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843014534	UTYGQEFFIABELK-UHFFFAOYSA-N	425.319	1.004	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N1CC2(CCCN2C(=O)[C@@H](F)Cl)C1	1843367355	WIDXQUNQRANIPQ-UONOGXRCSA-N	443.907	1.583	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1c(F)ccnc1Cl)C2	1843415473	KKQHZQGPEVIPMQ-BRJLIKDPSA-N	446.870	1.825	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)C2=NO[C@@H](c3ccccc3)C2)C1	1843863276	OTWYJGUGFBUYSO-LJQANCHMSA-N	448.483	1.020	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@H]1O)C2	1845164930	LKASHXPSZLJUTO-OWCLPIDISA-N	443.972	1.825	50	20	IDGD	
CCOC(=O)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)[C@@H](F)Cl)C2	1847043731	NNRRENOYSBXDNX-NWDGAFQWSA-N	435.880	1.181	50	20	IDGD	
CCc1nn(C)c(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](O)CCl)c1Br	1847560155	MALPOFJAAZKBDJ-SDDRHHMPSA-N	433.734	1.160	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)c1ccc(CN2C(=O)CCC2=O)cc1	10159565	GDNLYFHFYGTQTQ-UHFFFAOYSA-N	433.424	1.302	50	20	IDGD	
CCOc1ccccc1C(=O)NCCCC(=O)NNC(=O)Cc1nc2ccccc2n1C	15855487	YQMZVLJNCBCJIU-UHFFFAOYSA-N	437.500	1.872	50	20	IDGD	
Cc1ccnc2nc(C(=O)NNC(=O)COc3ccc(OCc4ccccc4)cc3)nn12	16005985	FIISIEBTGPFJRJ-UHFFFAOYSA-N	432.440	1.852	50	20	IDGD	
COc1ccc(N2C[C@@H](C(=O)NNC(=O)COc3cc(C)ccc3C)CC2=O)c(OC)c1	17202881	FWTNLJPHUIUPKW-INIZCTEOSA-N	441.484	1.900	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)c3cnn(C)c3)c2)c(C)c1	21007405	LHNLORWDMYOAJA-UHFFFAOYSA-N	427.486	1.913	50	20	IDGD	
Cc1cccc(-n2ncc(C(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)c2C)c1	29506162	YEMHZAFBVCFLJU-UHFFFAOYSA-N	441.513	1.814	50	20	IDGD	
Cc1csc([C@@](O)(CC(=O)NNC(=O)c2ccc3c(c2)OCCO3)C(F)(F)F)n1	109027250	NJXVKBFKAOCJIR-INIZCTEOSA-N	431.392	1.824	50	20	IDGD	
Cc1csc([C@](O)(CC(=O)NNC(=O)CNC(=O)c2cccs2)C(F)(F)F)n1	725739911	ORPIDHBVXLNCPI-CQSZACIVSA-N	436.437	1.230	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNS(=O)(=O)c2ccc(C)c(OCC(=O)O)c2C)cc1C	726156996	YFDVTZFCFAGZFU-UHFFFAOYSA-N	449.485	1.332	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cn(-c3ccccc3)nc2C)cc1	726523789	YJZRABRQWMMUGS-UHFFFAOYSA-N	441.513	1.571	50	20	IDGD	
CC(=O)N[C@@H](CC(=O)OCC(=O)NNC(=O)c1ccc(C)cc1)c1c(F)cccc1F	727570322	BITSJNQXLJWFIE-KRWDZBQOSA-N	433.411	1.845	50	20	IDGD	
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC[C@@H](C(=O)NNC(=O)c2cccc(Cl)c2)C1	728203703	LLGWHSGCJRFHQN-CQSZACIVSA-N	439.925	1.542	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)N2CCN(C(=O)CN3CCCC3)CC2)c1C	728551776	NMQAAILIYZFOST-QNGOZBTKSA-N	427.549	1.425	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)N2CCN(C(=O)Cc3ccccc3Cl)CC2)c1	728953707	VUKAZEAAOMYEOM-UHFFFAOYSA-N	425.876	1.953	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCC(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1ccccc1	729303763	ZMAOPTLOMWJQBT-CVEARBPZSA-N	439.534	1.615	50	20	IDGD	
COc1ccc(CN2C[C@@H](C(=O)NNC(=S)Nc3ccc(OC)nc3)CC2=O)cc1	729691649	KIGKCIPGFINWFM-AWEZNQCLSA-N	429.502	1.465	50	20	IDGD	
CS(=O)(=O)c1ccc(OCCNC(=O)NNC(=O)COc2ccc(F)cc2)cc1	730067299	WJGQZRYEOQYNDB-UHFFFAOYSA-N	425.438	1.017	50	20	IDGD	
C#CCN1CCC[C@H]1C(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	730104271	PVKZHXVXRSVFPP-FQEVSTJZSA-N	429.484	1.247	50	20	IDGD	
CC(=O)Nc1ccc(NS(C)(=O)=O)c(C(=O)NNC(=O)C(C)(C)c2ccccc2)c1	731441137	LUIXWDBVBIFXSB-UHFFFAOYSA-N	432.502	1.755	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)c1ccc(Br)c(S(C)(=O)=O)c1	731490305	LMRNNWKCZBMKTL-UHFFFAOYSA-N	427.276	1.936	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)[C@H]1CCCN1C(=O)/C=C/c1ccc(C(N)=O)cc1	731492502	KRLBODFWTUMCMI-LVMGUKCRSA-N	436.468	1.260	50	20	IDGD	
N#Cc1ccc(N2CCC[C@@H]2C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1	732336219	CTFRONCHHAPOKL-GOSISDBHSA-N	437.412	1.440	50	20	IDGD	
Cc1cc(NNC(=O)c2cc(S(=O)(=O)N3CCOCC3)c(Cl)cc2Cl)ncn1	734255482	IVNXLDJIMRELJF-UHFFFAOYSA-N	446.316	1.870	50	20	IDGD	
CCc1nc(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)nn1-c1ccccc1	735461616	JZDRBIYFWWUSIR-UHFFFAOYSA-N	448.892	1.205	50	20	IDGD	
CC(=O)NCC(=O)N1CCc2cc(C(=O)NNC(=S)Nc3cc(C)ccc3C)ccc21	735703006	FAGUVHFUUFAUBO-UHFFFAOYSA-N	439.541	1.960	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)c1ccc2c(c1)C(=O)N(Cc1ccncc1)C2=O	737635264	XMPRWDDOYZKBNS-UHFFFAOYSA-N	444.447	1.856	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2Br)c2ccccc2c1=O	739679405	XNUPGAODBWENFA-UHFFFAOYSA-N	446.217	1.679	50	20	IDGD	
O=C(NNc1cccc(C(F)(F)F)n1)c1ccc(S(=O)(=O)N2CCOCC2)cc1	740142142	IWHYJMOQXLZSJW-UHFFFAOYSA-N	430.408	1.878	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCC(C)CC2)cc1	740852283	SZXOFVFSINJABY-UHFFFAOYSA-N	438.550	1.173	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)N[C@@H]2CCC[C@@H](S(C)(=O)=O)C2)c1	741094280	YKFJVMFXUJUNLV-ZYHUDNBSSA-N	448.339	1.758	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cc(N3CCOC3=O)ccc2F)cc(OC)c1OC	741514392	LSVVLOQURRVGOM-UHFFFAOYSA-N	433.392	1.883	50	20	IDGD	
CCCc1c(C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)nnn1-c1cccc(C(C)C)c1	741523860	SZAQQEBIHYLEEO-HNNXBMFYSA-N	433.534	1.539	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N[C@H](C)c2cnn(C)c2)cc1	741700052	DUJXNCYDJCAFFX-DISPHTKASA-N	447.499	1.952	50	20	IDGD	
COc1ccc(N2CCN(CCNC(=O)NNC(=O)Cc3ccc(F)cc3)CC2)cc1	742948121	MQUIICXTBCXYLX-UHFFFAOYSA-N	429.496	1.529	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NCCOc2ccc([N+](=O)[O-])cc2)cc1	743601742	HYOZVXIQQSKTJZ-UHFFFAOYSA-N	437.434	1.413	50	20	IDGD	
C[C@H](C(=O)NNC(=O)c1cc(Br)ccc1O)S(=O)(=O)c1ccc(F)cc1	743730945	IVYBBRSNMPRCEG-SECBINFHSA-N	445.266	1.917	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)C[C@@H](NC(N)=O)c2cccs2)cc1	743831261	UOLMAPWRJZJWSA-GFCCVEGCSA-N	425.492	1.104	50	20	IDGD	
Cc1nn(CC(C)C)c(C)c1CCC(=O)OCC(=O)NNC(=O)c1cccc(C#N)c1	744526308	KPCXSUAZYUMQHK-UHFFFAOYSA-N	425.489	1.965	50	20	IDGD	
Cn1cc(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)c(-c2cccnc2)n1	744621458	XKBPYYAAKHJHTE-UHFFFAOYSA-N	442.501	1.260	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)N[C@@H]3CC[C@H]4CCC[C@@H]4C3)nc2)CC1	745875402	GERGSQVTECVIJZ-BRWVUGGUSA-N	436.582	1.613	50	20	IDGD	
O=C(NNC(=O)c1ccc2noc(-c3ccc(F)cc3)c2c1)N[C@H]1CCS(=O)(=O)C1	746833749	GGMNRCKMZDSMRZ-AWEZNQCLSA-N	432.433	1.765	50	20	IDGD	
C[C@@H](CN1CCCC1=O)NC(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1	747979965	OCSWRCXLFQJWMF-PGRDOPGGSA-N	449.555	1.955	50	20	IDGD	
C[C@@H](C(=O)NNc1ccc(Br)cc1F)N1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O	748200934	IAIMFCPTZADGOA-AJVHJNHVSA-N	426.242	1.582	50	20	IDGD	
CCCCN1C(=O)CC[C@@H](C(=O)NNC(=O)C(=O)N2CCCC2)[C@H]1c1ccc(OC)cc1	748240261	DFGNYLCEDLJQNZ-UYAOXDASSA-N	444.532	1.545	50	20	IDGD	
O=C(NCCC(=O)N1CCN(c2ccccn2)CC1)NNC(=O)c1cccc(Cl)c1	748465150	KXPOZIAJWQUNKG-UHFFFAOYSA-N	430.896	1.418	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)CN2CCCN(C(=O)Cc3cccc(F)c3)CC2)cc1	748836589	WJSPKGAFANDBGV-UHFFFAOYSA-N	437.475	1.235	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2cnc3c(c2)c(C)nn3C)ccc1OC(C)C	749372007	TVYUOKWLYUQPTJ-UHFFFAOYSA-N	433.490	1.696	50	20	IDGD	
CC(C)Cn1cnc(S(=O)(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)c1	749864936	CVCIUXLLHORAQH-UHFFFAOYSA-N	444.558	1.431	50	20	IDGD	
Cc1c(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cnn1CCC(C)C	750169567	NHGKHMFPNXUARP-SFHVURJKSA-N	430.461	1.382	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)CCc2nc[nH]n2)c1	750603133	GNRIQISPXSGIPZ-UHFFFAOYSA-N	444.473	1.008	50	20	IDGD	
CN(CC(=O)NNC(=O)c1cc2c(s1)CC[C@@H](C(C)(C)C)C2)[C@@H]1CCS(=O)(=O)C1	753564149	OPCRQHOKMVTUIP-HUUCEWRRSA-N	441.619	1.779	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2ccc(-n3ccnn3)cc2)cc1	756313502	QCCWEJNEUJHDMW-UHFFFAOYSA-N	443.489	1.049	50	20	IDGD	
CCn1ncc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1-c1ccccc1	756796383	IKNJCQHEXGENFP-UHFFFAOYSA-N	441.513	1.895	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCc2n[nH]cc2C1)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	756906175	XRACTDCDNQMQBC-GOSISDBHSA-N	442.483	1.678	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)CC1(C)CC1)N(S(C)(=O)=O)CC2	757782107	VXSRBEQWJYYTLF-OAHLLOKOSA-N	439.534	1.290	50	20	IDGD	
O=C(NC1CC1)N[C@H]1CCN(C(=O)NNC(=O)c2ccc(COc3ccccc3)o2)C1	760655870	JVXTWAWTIIMKEO-HNNXBMFYSA-N	427.461	1.749	50	20	IDGD	
O=C(Cn1c(S)nnc1-c1ccc(Cl)cc1)NNc1nccc(N2CCOCC2)n1	762858114	ZCVABICNQBUWTF-UHFFFAOYSA-N	446.924	1.657	50	20	IDGD	
O=C(NNC(=O)c1ccccc1Br)C(=O)Nc1ncn(C2CCCCC2)n1	763482536	HNPLNWVZWDFCIO-UHFFFAOYSA-N	435.282	1.946	50	20	IDGD	
COCCOc1cc(NC(=O)C(=O)NNC(=O)c2c[nH]c3ccccc23)ccc1OC	763541490	UPRFVXCCCXBHAE-UHFFFAOYSA-N	426.429	1.601	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(S(=O)(=O)N3CCCCC3)cc2)c(C)o1	763582581	IQQAANDMZPCUJX-UHFFFAOYSA-N	448.501	1.471	50	20	IDGD	
CCn1cnnc1-c1ccccc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccccc2)[nH]n1	763603957	DTGUIDUXKOXTHI-UHFFFAOYSA-N	444.455	1.755	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)c2cc(C)nc3ccccc23)cc1	763609874	BXUJUHLMDDBCET-UHFFFAOYSA-N	436.424	1.495	50	20	IDGD	
CCNC(=O)c1ccc(C)c(NC(=O)C(=O)NNC(=O)COc2ccccc2CC)c1	763713291	MYCXGJYDDMWDDM-UHFFFAOYSA-N	426.473	1.472	50	20	IDGD	
COCC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)cc1	763728537	VTIKYTUPVPBPTE-UHFFFAOYSA-N	428.489	1.574	50	20	IDGD	
O=C(NNC(=O)c1cc2c(s1)CCC2)C(=O)Nc1ccnc(OCC(F)(F)F)c1	763783936	RFCBIRRQLJQIFT-UHFFFAOYSA-N	428.392	1.973	50	20	IDGD	
CC[C@@H](C)Oc1ccc(NC(=O)C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1	763786519	PHXACIDTXXEJHP-CYBMUJFWSA-N	437.456	1.511	50	20	IDGD	
C=CCN(C)S(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(CC)cc2)cc1	763832486	UMSJHLHJPJNQBR-UHFFFAOYSA-N	444.513	1.455	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1cccc(Cn2cccn2)c1	763855689	AMXHNFQHEXBQSB-AWEZNQCLSA-N	425.420	1.624	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cc(C)nn2-c2ccccc2)cc1	763875745	AAJWHONWXPLHFT-INIZCTEOSA-N	449.467	1.937	50	20	IDGD	
CC(C)CC(=O)NNC(=O)C(=O)Nc1cc(Br)ccc1N1CCOCC1	763888471	MOTKQHCHCWHGDI-UHFFFAOYSA-N	427.299	1.418	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCCCC3)cccc1-n1cnnn1	763961539	HDRBCDGZZOFLDY-UHFFFAOYSA-N	439.501	1.701	50	20	IDGD	
CCOC(=O)c1cc(F)c(F)cc1NC(=O)C(=O)NNC(=O)c1cc(Cl)ccc1O	763974399	NQVCBLZLZHJRIL-UHFFFAOYSA-N	441.774	1.900	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)C(=O)Nc1cc(Cl)c(Cl)cc1Cl	764002757	RMXMZMGMBLMUPN-ZCFIWIBFSA-N	428.681	1.167	50	20	IDGD	
COC(=O)c1cc2cc(NC(=O)C(=O)NNC(=O)Cc3ccccc3OC)ccc2o1	764133598	WPNHUWNEEHVOPP-UHFFFAOYSA-N	425.397	1.557	50	20	IDGD	
Cc1cnn(Cc2cc(F)ccc2F)c1NC(=O)C(=O)NNC(=O)CCc1ccco1	764171027	DTAITHXRWPZPNX-UHFFFAOYSA-N	431.399	1.830	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)C(=O)Nc2ccc3[nH]ncc3c2)c1	764233220	TVQLYMCWJQMPSX-UHFFFAOYSA-N	432.234	1.734	50	20	IDGD	
O=C(NNC(=O)c1cccc(OC(F)F)c1)C(=O)Nc1ccc(N2CCCC2=O)cc1	764250148	KKIQDGNJTSOICU-UHFFFAOYSA-N	432.383	1.815	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)C(=O)Nc1cc(N2CCCC2=O)ccc1F	764279224	ZEJYQLDRELYDTP-UHFFFAOYSA-N	428.420	1.377	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)C(=O)Nc1cc2c(cc1[N+](=O)[O-])OCCCO2	764281284	QAYJOPGXTNYPMM-UHFFFAOYSA-N	444.400	1.180	50	20	IDGD	
CC(C)(C(=O)NNC(=O)C(=O)Nc1ccc(=O)n(Cc2ccccc2)c1)c1ccccc1	764303006	QUYIVWJWCSUBOR-UHFFFAOYSA-N	432.480	1.960	50	20	IDGD	
O=C(NNC(=O)c1cc2ccccc2o1)C(=O)Nc1cccc(C(=O)N2CCOCC2)c1	764342312	LZTMADPNHCKPOA-UHFFFAOYSA-N	436.424	1.305	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COCc2ccccc2)ccc1N1CCOCC1	764366937	FRFACANXINGNTL-UHFFFAOYSA-N	426.473	1.134	50	20	IDGD	
CC(=O)Nc1cc(NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)ccc1F	764378015	VGOCSSUCPVSJTH-UHFFFAOYSA-N	430.421	1.635	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cccnc3-n3cccn3)n[nH]2)cc1	764384592	FKSVPMKWCMOXRY-UHFFFAOYSA-N	444.455	1.620	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1cccc(Cl)c1Oc1cccnc1	764400619	QTKUUUUKCKSDMD-GFCCVEGCSA-N	436.852	1.665	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3ccc(-n4cncn4)cc3C)CC2)cc1	766640964	HZVCRQVOMPSNRG-UHFFFAOYSA-N	447.543	1.463	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)[C@H](c1ccccc1F)N1CCOCC1	767351895	CFKORCJVHNBVQJ-QFIPXVFZSA-N	443.475	1.441	50	20	IDGD	
COCCOC(=O)c1c(C)[nH]c(C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)c1C	768262044	DTPNHZWQJYXQEP-UHFFFAOYSA-N	431.474	1.961	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)CN(C)S(=O)(=O)c3cccnc3)n[nH]2)cc1	768268670	FFJMFBUDEWMUBK-UHFFFAOYSA-N	442.501	1.116	50	20	IDGD	
Cc1nc2cc(O)nn2c(C)c1CCC(=O)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	768277912	WQQYFZLGFAUNCV-UHFFFAOYSA-N	437.435	1.975	50	20	IDGD	
C=CCNS(=O)(=O)c1ccc(C(=O)NNc2c(OC)cccc2S(C)(=O)=O)cc1	768637331	DULLMOLFGKBGDU-UHFFFAOYSA-N	439.515	1.320	50	20	IDGD	
CNC(=O)C1CN(C(=O)/C(C#N)=C\c2cn(CCC#N)nc2-c2ccc(OC)c(OC)c2)C1	768647733	SAKOXZVNQYKOLY-SXGWCWSVSA-N	448.483	1.592	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)N[C@@H]3CCN(c4ccccc4F)C3=O)nc21	770393245	CEHFAKMXWDGMPG-CYBMUJFWSA-N	442.455	1.858	50	20	IDGD	
O=C(Cc1csc(NC(=O)c2ccco2)n1)NNC(=O)c1ccc2c(c1)OCCO2	770417013	IEYBDDJJPVGANE-UHFFFAOYSA-N	428.426	1.763	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)COc1ccccc1Cc1ccccc1)[C@@H]1CN(C)CCO1	770434928	IQPZBJGRFCISFU-UTKZUKDTSA-N	426.517	1.706	50	20	IDGD	
CCN1CCN(c2cccc(NC(=O)C(=O)NNC(=O)c3cc4ccccc4o3)c2)CC1	770771094	GXGWQUIYHIXPOE-UHFFFAOYSA-N	435.484	1.974	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NCC(=O)NNc2nccnc2C(C)C)c1	772867819	VKLLPSVCMLTXOL-UHFFFAOYSA-N	448.549	1.504	50	20	IDGD	
CCOC(=O)[C@@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNc2cccc(C#N)c2)cc1F	773688549	LIFWOLNBJHHLHJ-GFCCVEGCSA-N	441.419	1.461	50	20	IDGD	
CC[C@@H](C)NS(=O)(=O)c1cccc(NC(=O)C(=O)NNc2cnc3ccccc3n2)c1	773718219	JXWBSKNWZVCGOZ-CYBMUJFWSA-N	442.501	1.788	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C)c(S(=O)(=O)NC3CC3)c2)cc1F	773888343	LCQLWOXFNNJSHI-UHFFFAOYSA-N	448.476	1.283	50	20	IDGD	
Cc1cc(S(N)(=O)=O)ccc1CNC(=O)NNC(=O)CSc1ccc(Cl)cc1	775212672	QMDXETVKNROILM-UHFFFAOYSA-N	442.950	1.919	50	20	IDGD	
COc1cccc([C@@H]2[C@H](C(=O)NNC(=O)COc3ccc(C#N)cc3)CC(=O)N2C2CC2)c1	776558188	NHWJYUMPBMFBRQ-NFBKMPQASA-N	448.479	1.845	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2N2CCOCC2)o1	776705667	LRXSNOKGUBRRHF-UHFFFAOYSA-N	445.476	1.941	50	20	IDGD	
CC(C)C[C@H]1C[C@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)CCO1	777752202	YOWYYPKZBOJOGL-CVEARBPZSA-N	426.539	1.475	50	20	IDGD	
O=C(C1CCN(CC(F)(F)F)CC1)N1CCN(S(=O)(=O)CBr)CC1	777777552	MACBHXIRRPRARI-UHFFFAOYSA-N	436.294	1.087	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NN=C1CCS(=O)(=O)c2ccc(Br)cc21	777904367	MZTBNESUWSOTMA-UHFFFAOYSA-N	446.323	1.972	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)c1csc(-c2ccc3c(c2)OCCO3)n1	778437962	IGRMIPWXDBTRNX-UHFFFAOYSA-N	434.474	1.867	50	20	IDGD	
COc1ccc2nc(NNC(=O)CN3C(=O)c4ccccc4S3(=O)=O)c(C)cc2c1	778479399	ZBYXSLSOQPQSDG-UHFFFAOYSA-N	426.454	1.840	50	20	IDGD	
NC(=O)[C@H]1CC(C(=O)NNc2ccc([N+](=O)[O-])cc2Br)=NN1c1ccccc1	779141041	VPGGYIGWZUTEJC-OAHLLOKOSA-N	447.249	1.921	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)[C@H]2C[C@@]23CCN(C(=O)OC(C)(C)C)C3)cc1	781285852	RSTBFSBHPKQRSM-OPAMFIHVSA-N	431.489	1.946	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CN2CCNC(=O)[C@H]2c2ccccc2C(F)(F)F)c1	782100545	FRLCRLZNFGAIBX-GOSISDBHSA-N	445.401	1.511	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C(=O)Nc2cccc(Cn3cccn3)c2)nc2ccccc21	782887047	NVCIOAHTLCBNTE-UHFFFAOYSA-N	431.456	1.147	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)cc1F	782894097	LDKWFVRPZOFFIX-UHFFFAOYSA-N	443.435	1.066	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccc(Cl)c(C#N)c2)nc1	783262171	BNDHWFVQGPNNMV-UHFFFAOYSA-N	436.881	1.375	50	20	IDGD	
Cc1ccc(-n2nc(C(C)(C)C)cc2NC(=O)C(=O)NN[C@@]2(C)CCS(=O)(=O)C2)cc1	783426117	FVUXEOWCILWTRL-NRFANRHFSA-N	447.561	1.615	50	20	IDGD	
Cc1cc(Oc2ncccn2)ccc1NC(=O)C(=O)NNc1ccc(-n2cccn2)nn1	783437290	WNSPNOYJTVVXEF-UHFFFAOYSA-N	431.416	1.635	50	20	IDGD	
O=C(NNc1nc(Br)cn2ccnc12)[C@@H]1CC=CC[C@H]1C(=O)N1CCOCC1	784782772	DHYYCOFALLYGCP-CHWSQXEVSA-N	449.309	1.376	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ccc(Br)nc2)cc1S(C)(=O)=O	784808978	JKOOOOAGRSYTHF-UHFFFAOYSA-N	427.280	1.638	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1cc(C)n(-c2ccccc2)n1	785330476	IOMZDHPZTYSCDF-UHFFFAOYSA-N	443.485	1.675	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccc(C)c(C(=O)N2CCOCC2)c1	787548546	DZGYGHPHJXHQBH-UHFFFAOYSA-N	438.484	1.104	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2cc(F)c(F)c(F)c2)cc1C(=O)N1CCOCC1	787572360	VJNVQYTTXODDOK-UHFFFAOYSA-N	436.390	1.967	50	20	IDGD	
CCOc1cc(C(=O)NNS(=O)(=O)C[C@@H]2CCCOC2)cc(OCC)c1OCC	788138559	CVZFCBONQJADDT-CQSZACIVSA-N	430.523	1.874	50	20	IDGD	
CN1CCN(C(=O)NNC(=O)[C@H]2CCCN2C(=O)c2ccc(Br)cc2)CC1	788170032	WZGMTRZMSGXWPW-OAHLLOKOSA-N	438.326	1.042	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@@H]1CC(C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)=NO1	788626390	XROLFDNHJGJHMO-ZDUSSCGKSA-N	428.449	1.507	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N2CC([C@H]3CCOC3)C2)cc1	792608764	TXZUQUSBSVNHGP-PGLQMZEQSA-N	449.511	1.836	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)N1CC=C(CCN2C(=O)c3ccccc3C2=O)CC1	792908064	LNICKLKTIZCFOA-UHFFFAOYSA-N	433.468	1.683	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cnc(CC3CC3)nc2)ccc1OC(C)C	793022368	WGKQTAXAYVAUOS-UHFFFAOYSA-N	427.461	1.625	50	20	IDGD	
Cc1nc(C#N)c(N2CCC(C(=O)NNc3nc(O)c4cnn(C(C)(C)C)c4n3)CC2)o1	793477925	MJIDFDBCRNUGKQ-UHFFFAOYSA-N	439.480	1.815	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C2CCN(S(=O)(=O)c3ccc(C#N)cc3)CC2)n1	794074304	CAJVCIHUHDTFQY-UHFFFAOYSA-N	427.486	1.124	50	20	IDGD	
CCOC(=O)c1ccc(NNC(=O)CN(C)C2=NS(=O)(=O)c3ccccc32)cc1C	794660556	ZIKVTKWDOMDOIM-UHFFFAOYSA-N	430.486	1.696	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)c(OC)c(C)c1OC	796998620	KCQBNMZDOXLCCV-UHFFFAOYSA-N	445.428	1.192	50	20	IDGD	
O=C(Cc1ccc(S(=O)(=O)N2CCCCC2)s1)NNC(=O)NCC(F)(F)F	798314870	DTJTVGCNERKJGP-UHFFFAOYSA-N	428.458	1.358	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2CCCN2C(=O)c2ccc3c(c2)OCO3)cc1	801109626	WHECCLVBAISROX-INIZCTEOSA-N	438.440	1.114	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)c2cc([N+](=O)[O-])c(F)cc2N)c2ccccc2c1=O	801798648	ZEAHUBJSYRMZHA-UHFFFAOYSA-N	428.380	1.682	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(C(=O)NNC(=O)Nc2ccc(Cl)cc2)cc1	802021854	BYKGNLPRBYNGQP-UHFFFAOYSA-N	426.882	1.731	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)NCc2cc(C)nn2C)cc1	803459286	WKSXOGQLOMNBRU-GZTJUZNOSA-N	447.499	1.699	50	20	IDGD	
Cc1onc(-c2cccnc2)c1C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	803822964	XRRNPERVFQOQIY-INIZCTEOSA-N	438.396	1.189	50	20	IDGD	
Cc1nc(O)c(Br)cc1C(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	806346249	JZNGNWJVNILSQH-UHFFFAOYSA-N	432.234	1.824	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCCc1c[nH]c2ccccc12	806967587	NOHCYDZTLABNAC-UHFFFAOYSA-N	428.518	1.956	50	20	IDGD	
CCN(C)C(=O)c1cccc(NC(=O)C(=O)NNC(=O)COc2cc(C)ccc2C)c1	806973130	AOEUQMDHJOQQHU-UHFFFAOYSA-N	426.473	1.560	50	20	IDGD	
COC(=O)c1cc(Br)c(OC)cc1NC(=O)C(=O)NNC(=O)C1CCC1	806979902	JXRRICVYDJTOHJ-UHFFFAOYSA-N	428.239	1.130	50	20	IDGD	
CS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccc(F)c(N3CCCNC3=O)c2)cc1	806994639	JHVPDTTYVIVLHK-UHFFFAOYSA-N	449.464	1.231	50	20	IDGD	
CNS(=O)(=O)c1cc(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2C)ccc1F	807455774	UCRJQQVOXNZTKR-UHFFFAOYSA-N	425.398	1.032	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)N[C@@H]2CCCN(C(=O)N3CCCC3)C2)cc1	807461233	UTWRAXJTZJBUJT-DLBZAZTESA-N	447.536	1.863	50	20	IDGD	
CC(=NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1)c1cnnn1-c1ccccc1	807977136	ZZNQWFZBQUMXSO-UHFFFAOYSA-N	431.500	1.566	50	20	IDGD	
CC1(C)NC(=O)N(c2cccc(NC(=O)NNC(=O)COc3ccc(F)cc3)c2)C1=O	812973399	XJBYZFSBYAIPPW-UHFFFAOYSA-N	429.408	1.892	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)/C=C\CN(C)CC(F)(F)F)c2ccccc2c1=O	814364433	BYYDGMZGTGMLKB-TWGQIWQCSA-N	425.411	1.618	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2nn(C)cc2Br)c2ccccc2c1=O	814364878	QYFUTCGUZIKFHP-UHFFFAOYSA-N	433.266	1.377	50	20	IDGD	
Cc1cc(C)nc(SCc2ccc(C(=O)NNC(=O)CCn3ncn(C)c3=O)cc2)n1	814884522	LRDRHNNCJGHDGJ-UHFFFAOYSA-N	441.517	1.132	50	20	IDGD	
O=C(N=c1cc[nH]cc1)NN=C1C(=O)N(Cc2ncon2)c2ccc(Br)cc21	815003832	MBJIPZNRSJYADN-UHFFFAOYSA-N	442.233	1.722	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNc2ncccc2Cl)nnn1CCOc1ccc(F)cc1	815558184	UFWOXQIAUODITB-UHFFFAOYSA-N	433.831	1.935	50	20	IDGD	
CCOc1ccc(NNC(=O)C(=O)Nc2cnn(-c3ccccc3S(C)(=O)=O)c2)cc1	815817347	NXHGNECXYXQZIS-UHFFFAOYSA-N	443.485	1.756	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)COc1cccc2cccnc12	856532089	SUWYENZREAJYFX-UHFFFAOYSA-N	433.512	1.973	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)c2cccc(-n3cnnn3)c2)cc(OCC)c1OCC	859285290	XRVOMSMTVRBKBB-UHFFFAOYSA-N	440.460	1.933	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)[C@@H](C(C)C)N1C(=O)c2ccccc2C1=O	863998656	MCRJRKICHVPWLH-LJQANCHMSA-N	425.441	1.542	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)c1ccc(F)c(S(=O)(=O)NC2CC2)c1	914595348	BZODOABVYIFHGP-UHFFFAOYSA-N	437.449	1.115	50	20	IDGD	
COc1ccccc1[C@H](NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)c1nccn1C	914598285	WPQQUTUQKPNKLT-SFHVURJKSA-N	447.459	1.138	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)CN1C(=O)c2ccccc2N2C(=O)CC[C@@]12C	914830559	FMAJFCSGUMUZAP-QHCPKHFHSA-N	446.467	1.403	50	20	IDGD	
Cc1cccc([C@H](CNC(=O)NNC(=O)c2c(C)nc3ccccn23)N2CCOCC2)c1	915259897	JZUSWLRQDNHKLH-IBGZPJMESA-N	436.516	1.969	50	20	IDGD	
C[C@@H]1C[C@H]1C(=O)Nc1ccc(C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1	915407632	FTKJTBDNVZPJQE-SJKOYZFVSA-N	440.412	1.807	50	20	IDGD	
Cc1nnnn1[C@H](Cc1cccc(F)c1)C(=O)NNC(=O)c1nnc(O)c2ccccc12	916124167	BAQYYMMXYYBDBH-MRXNPFEDSA-N	436.407	1.014	50	20	IDGD	
COc1cc(-n2cnnn2)c(Cl)cc1C(=O)NNC(=O)[C@@H](C)Oc1ccc(F)cc1	916138354	HFWXQMLAOGERQO-SNVBAGLBSA-N	434.815	1.692	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)N[C@H](CN1CCOCC1)c1ccccc1	916216316	FDVKTGSFCXGZFU-GOSISDBHSA-N	436.472	1.353	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NN=Cc2ccc(N3CCOCC3)cc2)cc1	916276513	HHPDQVNYKZOARN-UHFFFAOYSA-N	430.530	1.602	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCc2ccc(C(=O)NC)cc2)nc1	916392478	YLOOLYSJBQBFOP-UHFFFAOYSA-N	434.522	1.298	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCc2ccccc2Cn2cncn2)nc1	916393847	PRWXRIKAUFNVHF-UHFFFAOYSA-N	444.521	1.234	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)[C@@H]1COc2ccccc2O1)N1CCN(c2ccccc2)CC1	916514604	HLMGLASXGBZXHA-UWJYYQICSA-N	439.516	1.368	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NCc2cccc(N3CCCC3=O)c2)c2ccccc2c1=O	916517896	ZLLJCVFDYJFKOQ-UHFFFAOYSA-N	434.456	1.205	50	20	IDGD	
O=C(CN1CCN(c2cccc([N+](=O)[O-])c2)CC1)NNC(=O)c1cccc([N+](=O)[O-])c1	917119378	BCSBYYWKXYGZNA-UHFFFAOYSA-N	428.405	1.086	50	20	IDGD	
O=C(CCn1cc(Cl)cn1)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	917496323	BJBNBQCVCSNJEE-UHFFFAOYSA-N	425.898	1.172	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)N[C@@H](c1ccc(F)cc1)[C@@H]1CCCO1	918126139	HCOLGWYNWVJRRZ-IRXDYDNUSA-N	449.508	1.983	50	20	IDGD	
O=C(Cn1nc(-c2ccccc2)oc1=O)NNC(=O)c1ccc(F)cc1Br	918340399	NYSKHDGAPVWIHK-UHFFFAOYSA-N	435.209	1.866	50	20	IDGD	
CCS(=O)(=O)N1CCC[C@@H](C(=O)NNC(=O)COc2ccc(Br)cc2)C1	918552442	TVWDAGXIYVRACQ-GFCCVEGCSA-N	448.339	1.037	50	20	IDGD	
CN(C)Cc1cccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1	918759201	MTOKDPQLRQTSMG-UHFFFAOYSA-N	430.530	1.608	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)NCCN2C(=O)c3ccccc3C2=O)cc1	919788661	SMPZFOPVEPHIFF-AWEZNQCLSA-N	440.456	1.479	50	20	IDGD	
O=C(NNC(=O)C1(c2ccc(Br)cc2)CCCC1)N[C@H]1CCS(=O)(=O)C1	919889433	LZNIHUWYTWRPDQ-AWEZNQCLSA-N	444.351	1.778	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCCOc2cc(C)cc(C)c2)cc1	919916513	KCBVITWUPHQBKT-UHFFFAOYSA-N	448.545	1.642	50	20	IDGD	
Cc1ccc(C)c(S(=O)(=O)Nc2ccccc2C(=O)NNC(=O)C(=O)NC(C)C)c1	920431737	OXEQDFSRYYRKQG-UHFFFAOYSA-N	432.502	1.390	50	20	IDGD	
Cc1ccc(S(=O)(=O)Nc2ccc(F)cc2)cc1C(=O)NNC(=O)CN1CCCC1=O	920826413	LIKXMZGYHQSNQJ-UHFFFAOYSA-N	448.476	1.318	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)CCCC[C@@H]2SC[C@H]3NC(=O)N[C@H]32)c1C	921302585	ZTTUUNFKJQFOAP-IIHSZXCVSA-N	434.562	1.944	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)[C@H]2CC(=O)N(Cc3ccccc3)C2)CC1	1251911940	ZPCJAPJTJUXJFE-SFHVURJKSA-N	444.532	1.830	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1)c1ccc(F)c(F)c1	1319200239	DQPYLXXPFLVFOB-OAHLLOKOSA-N	430.455	1.674	50	20	IDGD	
O=C(Cc1c[nH]c2cnccc12)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	1324175618	QIMUVAZGJWJZJC-UHFFFAOYSA-N	441.513	1.741	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnc4ncccn34)C2)C1	1777935876	GPCAKHWBBJPWKJ-UGSOOPFHSA-N	436.310	1.346	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)C3CN(C(=O)OC(C)(C)C)C3)C2)C1	1778124413	MIJCJVFOPPCLTH-YWZLYKJASA-N	429.945	1.701	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3c[nH]c4ccc(OC)cc34)C2)C1	1778509535	MCZUQOZHXNFVPT-DYESRHJHSA-N	435.908	1.874	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc4n(n3)CCCC4)C2)C1	1778562317	ZTRDZCFBISJQSE-RBUKOAKNSA-N	429.348	1.899	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(CCN(C(=O)C[C@@H]3CNc4ccccc4O3)C2)C1	1778931731	QDHUFILAPCNVTL-VGSWGCGISA-N	447.608	1.931	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1n[nH]c3ccc(F)cc13)CCO2	1779297096	QQLLZABEPBVIAD-HXUWFJFHSA-N	434.544	1.997	50	20	IDGD	
N#Cc1ccc2[nH]nc(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)[C@@H](O)CCl)C4)c2c1	1781206615	XXXCEYOOKRACAR-CSODHUTKSA-N	445.907	1.162	50	20	IDGD	
Cc1cccc(C)c1NC(=O)C(=O)N1CC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1781242162	JUIJJFNUAHFARW-IBGZPJMESA-N	428.316	1.876	50	20	IDGD	
O=C([C@H](F)Br)N1CC[C@]2(C1)CN(C(=O)[C@H]1CNc3ccccc31)CCO2	1781331061	KHGZSAWWRRAQQF-YEWWUXTCSA-N	426.286	1.716	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781334260	NSFSXHYEWJWNJB-JRPNMDOOSA-N	425.251	1.068	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)C1(O)CCC1)C2	1781995858	XRVVZNVLOHEMTO-LUXYFRNMSA-N	431.371	1.835	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)COc1cccnc1)C2	1781997135	FQQXXVSWJCYKCP-ZSZQSSIHSA-N	440.338	1.758	50	20	IDGD	
O=C(CN1CCCCC1=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCBr)C2	1782101716	WBSTUOLCCKKBSK-DNVCBOLYSA-N	444.370	1.298	50	20	IDGD	
COc1cccc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CCC(=O)NN(C)C)C2)c1	1782212265	NWYWSEIYRATXEX-AUSIDOKSSA-N	446.548	1.196	50	20	IDGD	
CSCC[C@@H](O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)Br)C2	1782232166	ZPKMIKGRWDTJLF-VMUDFCTBSA-N	437.400	1.398	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCS(C)(=O)=O)C1	1782716853	DSJOFRVPSZTVNF-KBRIMQKVSA-N	443.393	1.171	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)CNC(=O)OC(C)(C)C)C2)C1	1783401671	TUMQTUKUMPPNQZ-FZKQIMNGSA-N	448.358	1.515	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccc4c(c3)CNC4=O)CCO2)C1	1783533852	KVDROMYGEQNANN-CWTRNNRKSA-N	436.306	1.157	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)Cc3ccc(C(=O)OC)cc3)C2)C1	1784162270	YUXJVHHIKVSAQW-DYESRHJHSA-N	438.908	1.099	50	20	IDGD	
CC(C)OCC(=O)Nc1ccc(C2(NC(=O)c3cnccc3C(=O)NN)CCC2)cc1	1785918853	QOVWEPMTNQQQFV-UHFFFAOYSA-N	425.489	1.858	50	20	IDGD	
CC(C)n1cnc(C(=O)NC2(c3ccc(NC(=O)c4ccc(B(O)O)cc4)cc3)CCC2)n1	1788141125	MNLGLDLSFPNSSM-UHFFFAOYSA-N	447.304	1.600	50	20	IDGD	
Cc1cc(CC(=O)NC2(c3ccc(NC(=O)c4ccc(B(O)O)cc4)cc3)CCC2)no1	1788143637	QBBYVOFZTLOPFP-UHFFFAOYSA-N	433.273	1.653	50	20	IDGD	
O=C(CC1CCOCC1)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1	1788143648	JIACKJZBZAFHAR-UHFFFAOYSA-N	436.317	1.931	50	20	IDGD	
CCOc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CO[Si](C)(C)C)C[C@@H]32)nn1	1789396542	CNTYPOJMQHOHGX-ZOBUZTSGSA-N	436.585	1.320	50	20	IDGD	
COC(=O)CCC(=O)NC1(c2ccc(NC(=O)c3cnccc3C(=O)NN)cc2)CCC1	1789522920	XTDKUTNRAUPVGJ-UHFFFAOYSA-N	439.472	1.386	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(C)(C)OC(=O)NC(C)C)[C@H]2C1	1789753608	MGGLJHQBJLIXRZ-JONQDZQNSA-N	431.961	1.897	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nccc4[nH]ccc34)C[C@@H]21)[C@@H](F)Br	1789923074	RTKVYGHCITYFOD-YLUJIRGKSA-N	439.285	1.847	50	20	IDGD	
Cc1cc(F)ccc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2C1	1791292142	AFPDBVLZUBUTRI-SNRMKQJTSA-N	434.512	1.100	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1ccc(C2(NC(=O)[C@@H]3CCC(=O)NC3)CCC2)cc1	1791595751	NKKXUOLQBWMZIC-OAHLLOKOSA-N	429.521	1.020	50	20	IDGD	
CCC[C@@H](NC(C)=O)C(=O)NC1(c2ccc(NC(=O)CCC(=O)NN(C)C)cc2)CCC1	1791603259	MOCXYBDZJLVQSL-LJQANCHMSA-N	445.564	1.798	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnc(OCF)cn1	1794406470	QMCYZDLDCYUSKT-MCYUEQNJSA-N	445.289	1.017	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](Br)Cc1ccccc1)C2)c1nc[nH]n1	1796032569	SVWQUFPZTBSJDZ-FZKCQIBNSA-N	448.321	1.014	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1CCN(C)CC1)C2	1796889882	WWKSDIIXZUJPTA-XMYAHUOOSA-N	428.537	1.100	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)c1c[nH]c2cc(Cl)ccc12	1796925708	ZUNPWWQNWPYVJL-YNHQPCIGSA-N	426.300	1.624	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1c(C)oc2cc(O)ccc12	1796997854	WTDYFSYXNWIXIP-AODNKKSCSA-N	436.892	1.904	50	20	IDGD	
Cc1cnc2c(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)CCBr)C4)cnn2c1	1797418799	UELPTTNDKSJLCD-YWVIFJGQSA-N	436.310	1.026	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccccc1C1CC1)C2	1797754268	PBTZRRAISGBKPE-VPTLXERWSA-N	449.511	1.080	50	20	IDGD	
COC(=O)[C@H]1CC[C@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CO[Si](C)(C)C)CC1	1797952800	LXNHWXJMJRSPIZ-CGNOENMKSA-N	440.613	1.407	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2)c1cccn(C(F)F)c1=O	1797992831	ASFWBRPMNUWOSR-GNXNZQSNSA-N	448.264	1.232	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c(c1)OCO3)C2	1799274773	APPAYDPIOJBDGK-UESRRSCYSA-N	429.300	1.855	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@](C)(Cl)CCl	1800078796	NXRAPMTWVHLAQF-ZGXUYQBDSA-N	442.347	1.995	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccn(C(F)F)n1)C2	1800642100	WTLQHDVZNYCPKQ-LSCVPOLPSA-N	435.269	1.655	50	20	IDGD	
Cc1cc(O)c([N+](=O)[O-])cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCC(=O)NN(C)C)C2	1800804173	OKYRJRPRUAZCDN-QDMKHBRRSA-N	447.492	1.234	50	20	IDGD	
COC(=O)[C@H]1CCC[C@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CO[Si](C)(C)C)C3)C1	1800966166	NQPHMTAGGGTADI-CWLGOENISA-N	440.613	1.407	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc([N+](=O)[O-])c(OC)c1)C2	1800982746	KGWZXAYXDPFFCG-LOUJCGABSA-N	441.868	1.060	50	20	IDGD	
C[C@H](CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc(B(O)O)c1)C2)Oc1ccccc1	1801449561	MWKZRIIUSWKXFK-RZXSNQJFSA-N	436.317	1.476	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)CNC(=O)N(C)C)[C@@H]1c1cccnc1	1802681439	AJVRZXKMAFOZSU-NOLJZWGESA-N	440.342	1.142	50	20	IDGD	
CN1CCC[C@H]1C(=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@H]1c1cccnc1	1803944289	YKMBMHODPSFYDR-YHUYYLMFSA-N	427.318	1.872	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2nc3ccccn3n2)[C@@H]1c1cccnc1	1807934004	JOFDTCCJMCQQFK-RYRKJORJSA-N	442.907	1.698	50	20	IDGD	
CN(C)C(=O)NCC(=O)N1CC[C@@H](CNC(=O)CO[Si](C)(C)C)[C@@H]1c1cccnc1	1810537373	DJZBGFHEIGRKSQ-LPHOPBHVSA-N	435.601	1.210	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC2(CCCN(C(=O)c3cccc4c[nH]nc34)C2)CC1	1810614508	KKKQOGSHPSXQER-UHFFFAOYSA-N	446.316	1.401	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)N1CC[C@H](CNC(=O)[C@@H](C)Br)[C@@H]1c1cccnc1	1812864462	PLJDGHZIQGBZHE-KFZJALRRSA-N	439.354	1.738	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H](CNC(=O)C[C@@](C)(O)CC(=O)O)[C@H]1c1cccnc1	1813064578	ZNBCNZGGCSDXIN-FQELHTAISA-N	439.940	1.968	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)CCS(C)(=O)=O)[C@@H]1c1cccnc1	1813576006	AUCCBJQOOYULIX-BJJXKVORSA-N	446.367	1.306	50	20	IDGD	
C[C@]1(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)CC=CCC1	1813579101	JMIRAXMMDCQPEO-XTJBDQBJSA-N	447.344	1.827	50	20	IDGD	
Cc1ncc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)[nH]n2)[nH]1	1815403798	JAXNVLUFILNPCK-INIZCTEOSA-N	437.464	1.059	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnco1)CC2	1817275938	HPWZNZNOZCDNAK-IVWJEFBKSA-N	441.473	1.491	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](N)CN)n[nH]1	1818016384	MWQKEXGNQSWBPV-HJXFBKQLSA-N	443.458	1.573	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)CO[Si](C)(C)C)n[nH]1	1819597264	OGCCLJALCVKOJE-OAHLLOKOSA-N	438.605	1.626	50	20	IDGD	
CC(=O)OC[C@H](OC(C)=O)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](F)Cl)CC2	1819855383	JKUZHRRJHIRHCO-SUZMYJTESA-N	435.861	1.084	50	20	IDGD	
C[Si](C)(C)OCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)CN1CCOCC1)CC2	1820163133	ZJNXMOCZKBZINS-CYBMUJFWSA-N	426.615	1.239	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)Cn2ccncc2=O)[nH]n1	1820868570	JOZSRCJEGLPZRN-SCLBCKFNSA-N	441.319	1.895	50	20	IDGD	
O=C(CN1C(=O)C=CC1=O)Nc1cc([C@H]2CCCCN2C(=O)CCBr)[nH]n1	1822530121	MOGSUXOAXMQGFJ-GFCCVEGCSA-N	438.282	1.112	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](C)n2cnnn2)n[nH]1	1822863288	MGICEGVQIFZKRX-JBLDHEPKSA-N	425.291	1.433	50	20	IDGD	
C=C1CC(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)C1	1823701802	DMEPCQGIUQJXCM-HXUWFJFHSA-N	425.533	1.885	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)Cn1nnc3ccccc31)CC2	1825994950	QVFNMHFLKLPGDB-NWDGAFQWSA-N	448.936	1.754	50	20	IDGD	
CC(=O)C[C@@H](C)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827055436	WBPPNWQQRLSNNI-IIBYNOLFSA-N	428.338	1.215	50	20	IDGD	
O=C(c1cncc(F)c1)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827055744	DIKFOHCIPBESGG-OAQYLSRUSA-N	439.296	1.448	50	20	IDGD	
Cc1oncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827055770	FDNNJAQGFXRJKQ-FQEVSTJZSA-N	425.294	1.210	50	20	IDGD	
O=C([C@H]1CCCOC1)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827060082	OVONOLHUZXAFSF-FPOVZHCZSA-N	428.338	1.026	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)n2)CC1	1827602736	UFNRKMBHRJITCT-UKRRQHHQSA-N	426.901	1.375	50	20	IDGD	
CO[C@@H](C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)CC1	1827679886	ZJMTUDFYKRQUPM-VFGZWROSSA-N	431.537	1.775	50	20	IDGD	
Cc1ccc(F)cc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1830077683	CGUBDFVPOGXZNL-MAUKXSAKSA-N	447.276	1.895	50	20	IDGD	
COC(=O)C12CC(C(=O)N3CCCC[C@@H]3C3CCN(C(=O)[C@@H](O)CCl)CC3)(C1)C2	1831601737	VWTVQXJSHFEVHS-SHEVMCDFSA-N	426.941	1.549	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CC3CCN(C)CC3)C2)C1	1831638746	GFFALGDHHIHWSX-GHTZIAJQSA-N	429.989	1.582	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(OC)nc3)C2)C1	1831641203	XCGJEQXSGNQLLU-OXQOHEQNSA-N	425.913	1.568	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3nccc4nc[nH]c34)C2)C1	1831645269	ANPHHUUAPQKMPM-XOBRGWDASA-N	435.912	1.435	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnn4cccnc34)C2)C1	1831651245	OEUZFLCSKCTMKN-OXQOHEQNSA-N	435.912	1.207	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)COc3cccnc3)CCO2)C1	1832679626	BJOBBHKHLDYWJW-OALUTQOASA-N	446.331	1.153	50	20	IDGD	
C[C@H](C(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)Br)CC2)CC1)C1(O)CCC1	1833069008	BKYYFMQZFUOPEF-HUUCEWRRSA-N	444.414	1.893	50	20	IDGD	
O=C(c1cc(O)nc(Cl)c1)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1833583277	XOSHUCUYSCMDBT-INIZCTEOSA-N	438.695	1.314	50	20	IDGD	
Cc1[nH]nc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)c1F	1833675424	SWSYSYBZQYHLTF-IRXDYDNUSA-N	437.299	1.164	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3cnnn3C)CC2)CC1	1833901819	QSVUHYIRZTZIJC-HNNXBMFYSA-N	441.374	1.174	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)c1ccnc(Cl)c1	1834193744	FCQCRLLSJGGEBO-INIZCTEOSA-N	429.348	1.520	50	20	IDGD	
COc1ccc([C@@H](O)C(=O)N2CCC(N3CCC(NC(=O)[C@H](F)Cl)CC3)CC2)cc1	1835078161	TYAGTNDFUZLGAL-MOPGFXCFSA-N	441.931	1.835	50	20	IDGD	
Cc1nnc(CCC(=O)N2CCC(N3CCC(NC(=O)[C@H](F)Cl)CC3)CC2)s1	1835078496	JFUABCPYNGQMRO-KRWDZBQOSA-N	431.965	1.885	50	20	IDGD	
O=C(c1cnc(C(F)(F)F)cn1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1836375639	OCLOWABPZHRVOE-SWLSCSKDSA-N	440.781	1.100	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC1CCN(C2CCN(C(=O)CN3CCCC3=O)CC2)CC1	1836398408	JDXQTBMRSBDBHJ-FQEVSTJZSA-N	447.407	1.417	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3c(F)cccc3F)C2)C1	1837714451	GZIKLCHKDIKTNK-FQEVSTJZSA-N	442.535	1.886	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(OC)cc3)CCO2)C1	1838967411	BTICLBJORAWTHE-YLJYHZDGSA-N	426.897	1.019	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CC[C@H](C(=O)OC)C3)C2)C1	1839141463	JKNMJTMSTXHJEX-OLPIVMHESA-N	430.929	1.050	50	20	IDGD	
O=C(c1ccc(F)s1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839198422	ZXFSTTTWKPOSDM-SWLSCSKDSA-N	439.278	1.648	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(O)c([N+](=O)[O-])c3)CCO2)C1	1839274601	HKILQNFAIYULOG-LIRRHRJNSA-N	441.868	1.388	50	20	IDGD	
C/C=C/C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)C1	1839812609	JBICQYJAGVCWOU-XOUUHQBZSA-N	445.944	1.151	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)(Cl)Cl)CCO2	1839922359	UXMYDZQMFFNDIK-CQSZACIVSA-N	447.819	1.665	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccncc3O)C2)C1	1839964840	GBONKRWUUPTZIO-RDTXWAMCSA-N	442.310	1.031	50	20	IDGD	
COc1cc(OC)cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)c1	1840188977	OWWSWKHEISEREU-IBGZPJMESA-N	447.315	1.578	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)Cc1ccccc1)CCO2	1840301117	DDCKOMOEJLHVKQ-LZNRXBQRSA-N	438.952	1.575	50	20	IDGD	
Cc1cc(C(=O)N2CC3(CCCN3C(=O)C(C)(C)CCl)C2)n(-c2cccc(=O)n2C)n1	1841225820	ONTFZTBPXKASOV-UHFFFAOYSA-N	445.951	1.961	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H]1CCC[C@@H]1C(=O)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1	1841354720	QVTAATZJKUPEOU-SOUVJXGZSA-N	429.945	1.483	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC2(CCCN2C(=O)c2csnn2)C1	1841695220	DJDKGEFVRVCTRF-NSHDSACASA-N	429.930	1.487	50	20	IDGD	
Nc1c(C(=O)N2CC3(CCCN3C(=O)[C@H](F)Br)C2)sc2nccnc12	1845217202	KZXIUUDYOCRFFE-NSHDSACASA-N	428.287	1.781	50	20	IDGD	
COc1ccc(F)cc1C(=O)N1CCCC12CN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2	1846804148	ULBOCPBLHXOWHP-AFUMVMLFSA-N	441.463	1.785	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC[C@H]2[C@@H]1CCN2C(=O)c1ncc(Cl)cc1Cl	1847204547	HBFNMDCRWYKGAK-HOTGVXAUSA-N	434.088	1.197	50	20	IDGD	
C=C1C[C@@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](O)CCl)N(C(=O)OC(C)(C)C)C1	1847564019	PHDCYDSNVCZGNA-VGWMRTNUSA-N	427.929	1.354	50	20	IDGD	
CC(=O)N/C(=C\c1ccccc1)C(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	8773998	GGJWPKIAXRDZLU-BOPFTXTBSA-N	426.385	1.076	50	20	IDGD	
O=C(COC(=O)CCNS(=O)(=O)c1cccc(Cl)c1)NNC(=O)c1cccs1	9361451	PSRDJSBHPRVIMY-UHFFFAOYSA-N	445.906	1.074	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)c2cccc(N3CCCS3(=O)=O)c2)cc1OC	10288044	OQWWUIAKYKJZEN-UHFFFAOYSA-N	433.486	1.709	50	20	IDGD	
CCn1c(S)nc2cc(C(=O)NNC(=O)c3n[nH]c(=O)c4ccccc34)ccc2c1=O	17195798	LWYUHWCQGVXSIX-UHFFFAOYSA-N	436.453	1.016	50	20	IDGD	
CN(C)C(=O)COc1ccccc1C(=O)OCC(=O)NNC(=O)c1ccc(Cl)cc1	17835454	GEMMRHXGVWOFTO-UHFFFAOYSA-N	433.848	1.425	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)CN(C)C2=NS(=O)(=O)c3ccccc32)c1C	20919325	FGSGQWUXXISRTP-HNNXBMFYSA-N	444.513	1.299	50	20	IDGD	
O=C(NCc1cccc(C(F)(F)F)c1)NNC(=O)[C@@H]1CC[C@H](C(F)(F)F)NC1=O	195718467	LWVYBUBEYQZMAT-GHMZBOCLSA-N	426.317	1.993	50	20	IDGD	
CC(C)C[C@@H](NC(=O)c1ccc(Cl)cc1)C(=O)NNC(=O)CNC(=O)c1ccco1	725739324	BWSJHYOMAMPXMY-OAHLLOKOSA-N	434.880	1.655	50	20	IDGD	
COc1cccc(-n2ccnc2SCC(=O)NNC(=O)CNC(=O)c2ccco2)c1	725739535	IHNAPZCUQCVOEH-UHFFFAOYSA-N	429.458	1.143	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NC[C@@H](O)c1ccc(OC(F)(F)F)cc1	725873952	VLQPHDSGIWJNTB-GFCCVEGCSA-N	446.407	1.441	50	20	IDGD	
CCS(=O)(=O)NCCCNC(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccccc1	726771224	HTOJAVVJWBPWKT-NBVRZTHBSA-N	440.529	1.816	50	20	IDGD	
CN(C)CCNC(=O)c1cccc(CNC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c1	727603664	AGXGJOADTBQMOC-UHFFFAOYSA-N	428.449	1.030	50	20	IDGD	
CCS(=O)(=O)N1CCC(C(=O)NNC(=O)c2cc(F)ccc2Br)CC1	728549925	RYWMVERYYYOBDX-UHFFFAOYSA-N	436.303	1.411	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNS(=O)(=O)c1cccc(S(=O)(=O)NC2CC2)c1	729667606	TYIKFVHSIBOUDY-UHFFFAOYSA-N	448.526	1.092	50	20	IDGD	
O=C(NCCNS(=O)(=O)Cc1ccccc1)NNC(=O)c1cccc2ncccc12	730117586	ZQSRVISOJFSWSS-UHFFFAOYSA-N	427.486	1.298	50	20	IDGD	
CCCC(=O)N1CSC[C@H]1C(=O)OCC(=O)NNC(=O)c1cc(Cl)ccc1OC	730323866	UWOBJTZGRWKOEY-ZDUSSCGKSA-N	443.909	1.354	50	20	IDGD	
C[C@@H]1CCC[C@@H](NC(=O)CN2CCN(C(=O)NNC(=O)c3cccc(C#N)c3)CC2)C1	731220610	MCQQPSLICHEVMK-VQIMIIECSA-N	426.521	1.225	50	20	IDGD	
CCCn1c(C)cc(/C=C(/C#N)C(=O)OCCN(C)S(=O)(=O)N2CCOCC2)c1C	731290965	HJUCGXQAWSENGD-RGEXLXHISA-N	438.550	1.474	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)NCc1ccccc1OCCN1CCOCC1	731498824	SEXJJRRLCDSNIX-UHFFFAOYSA-N	428.489	1.550	50	20	IDGD	
C[C@@H](CN1C[C@@H](C)O[C@H](C)C1)C(=O)NN=C1CCS(=O)(=O)c2cc(F)c(F)cc21	731924927	MVOGYYHUWPUVMM-YNEHKIRRSA-N	429.489	1.708	50	20	IDGD	
COc1ccc2c(C)c(CCC(=O)NNC(=O)CCN3C[C@@H](C)O[C@H](C)C3)c(=O)oc2c1	732259539	GRZKBUBYRJXKGI-HUUCEWRRSA-N	445.516	1.689	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2csc(-c3ccc4c(c3)OCO4)n2)C[C@H](C)O1	732262803	WHFWGUOFTDXRSA-STQMWFEESA-N	432.502	1.799	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)c2cc(Cl)nc(N3CCCC3)c2)c2ccccc2c1=O	732949078	DYZOLVMMVHLALE-UHFFFAOYSA-N	426.864	1.657	50	20	IDGD	
C[C@@]1(C2CC2)NC(=O)N(CC(=O)NNc2cc(C(F)(F)F)nc(-c3cccnc3)n2)C1=O	734257904	VOQKVFLQJMJYKR-SFHVURJKSA-N	449.393	1.721	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(=O)n(CC(=O)NNc2cc(F)c(F)cc2F)c1	734551549	DJNTTWLUDVSAEC-UHFFFAOYSA-N	432.424	1.439	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)CCNC(=O)c2cccs2)CC1	734825363	ZGHVXYIKYRADDK-UHFFFAOYSA-N	439.538	1.598	50	20	IDGD	
CCS(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=O)c2nnc(O)c3ccccc23)c1	735647410	NAMCWWJNZDGRNS-UHFFFAOYSA-N	434.861	1.857	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(N2C[C@H](C(=O)NNc3cccnn3)CC2=O)cc1	736698623	KMBOLUQAHSPFQH-CQSZACIVSA-N	432.506	1.003	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCCc2cccc(C(=O)NC)c2)nc1	741092045	RDDJUDJYWRITFO-UHFFFAOYSA-N	448.549	1.341	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)c2ccc(C[C@H]3CC(=O)NC3=O)cc2)cc1OC	741144561	VPPLDLQAPGHJNK-INIZCTEOSA-N	425.441	1.374	50	20	IDGD	
COCC(=O)N[C@H](C(=O)NNc1cc(C(F)(F)F)nc(-c2ccccn2)n1)C(C)C	741286707	FHOYNCTZAROBHC-HNNXBMFYSA-N	426.399	1.788	50	20	IDGD	
Cc1ccc(S(=O)(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1Br	743252521	DBFBEBQMLGNXHK-UHFFFAOYSA-N	447.332	1.784	50	20	IDGD	
Cc1ccc(N2C(=O)C[C@@H](C(=O)NNC(=O)C(=O)NC(C)C)[C@@H]2c2cccs2)cc1	744446523	BVUXTRLXYSUPNA-CRAIPNDOSA-N	428.514	1.823	50	20	IDGD	
CCOc1cc(N)c(C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)cc1OCC	744872467	GYMJSRNWWVZAPY-UHFFFAOYSA-N	426.429	1.556	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)[C@H]2CCCN2C(=O)OCC(F)(F)F)c1	744947470	TYTKJNMSJINSNS-CYBMUJFWSA-N	442.350	1.026	50	20	IDGD	
NC(=O)[C@@H]1CCCN(CCCNC(=O)NNC(=O)c2cc(F)ccc2Br)C1	745828868	ABGJKXDLYUNWKU-LLVKDONJSA-N	444.305	1.120	50	20	IDGD	
Cc1c(C(=O)NNC(=O)CCCc2cccs2)cc(S(N)(=O)=O)cc1[N+](=O)[O-]	746252918	ITAFTXVCCMFMAB-UHFFFAOYSA-N	426.476	1.396	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)c2nc(S(C)(=O)=O)n3ccccc23)o1	746396785	FPHZMKBPTUBMJR-UHFFFAOYSA-N	433.490	1.247	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)c1sccc1S(=O)(=O)N1CCCCC1	746553075	FQXAVUFPWWSFCP-UHFFFAOYSA-N	447.542	1.574	50	20	IDGD	
CSCC[C@H](NC(=O)c1ccc([N+](=O)[O-])o1)C(=O)NNC(=O)c1ccc(C#N)cc1	747173199	UTBGIWDPVZLQCR-ZDUSSCGKSA-N	431.430	1.372	50	20	IDGD	
COc1cc(I)c(C(=O)NNc2nccn(C)c2=O)cc1OC	747945488	JFIIGOKDDWEVOF-UHFFFAOYSA-N	430.202	1.159	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)NCc1cc(OC)c(OC)cc1Br	748628642	XLEKZGBOPWCZFQ-SNVBAGLBSA-N	434.287	1.348	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(OCC(=O)NNC(=O)c2cc(Br)ccc2O)C1	751069520	NPQMODSSPPTRIX-UHFFFAOYSA-N	444.282	1.552	50	20	IDGD	
CCCCCCn1nc(C(=O)NNC(=O)CNC(=O)c2ccco2)c2ccccc2c1=O	751206450	GMOBOYAGEWQWBJ-UHFFFAOYSA-N	439.472	1.761	50	20	IDGD	
O=C(/C=C\c1ccc(I)o1)NNC(=O)CNC(=O)c1cccs1	751215656	UZKHUOHNQQWQJC-XQRVVYSFSA-N	445.238	1.536	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNS(=O)(=O)c1ccc(OCC(=O)O)c(F)c1	751269882	KDLUKVQAVCFECS-UHFFFAOYSA-N	432.813	1.574	50	20	IDGD	
COc1cc(OC)cc(N2C[C@@H](C(=O)NNC(=O)[C@H]3COc4ccccc4O3)CC2=O)c1	752269326	VIMSDZNECZATOI-ORAYPTAESA-N	441.440	1.044	50	20	IDGD	
COc1cc(OC)cc(N2C[C@@H](C(=O)NNC(=O)COc3cccc(C)c3)CC2=O)c1	752398275	FSPSZRZSBDWFEA-HNNXBMFYSA-N	427.457	1.592	50	20	IDGD	
CC[C@@H](NC(=O)NNC(=O)c1cc(OC)ccc1Br)C(=O)N1CCOCC1	753047529	URYHZJVGYYBGAC-CQSZACIVSA-N	443.298	1.039	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)C(=O)Nc2ccc(Cl)cc2)c2ccccc2c1=O	753118464	PPGYXFQLBSZHCN-UHFFFAOYSA-N	427.848	1.860	50	20	IDGD	
O=C(NCCCn1ccnn1)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	753352777	VPRWOYFTCNIYEE-UHFFFAOYSA-N	449.518	1.175	50	20	IDGD	
COCC(C)(C)C(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccc(OC)cc2)c1	755381651	PBNGJJVAPLKVKW-UHFFFAOYSA-N	435.502	1.930	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)Nc2ccc(S(=O)(=O)NC(C)C)cc2)cc1	755513007	SSRMOAGOWCVBAL-UHFFFAOYSA-N	436.490	1.614	50	20	IDGD	
CN1CCCN(S(=O)(=O)c2cccc(NC(=O)NNC(=O)CC3CCCC3)c2)CC1	756361415	ZAPKHWBDHAMHJD-UHFFFAOYSA-N	437.566	1.746	50	20	IDGD	
COc1ccc2c(c1)C=C(C(=O)OCC(=O)NNC(=O)c1ccc(OC)c(OC)c1)CO2	756469270	ZCWULMAYWPDGBN-UHFFFAOYSA-N	442.424	1.493	50	20	IDGD	
COC(=O)c1cc(NC(=O)NNC(=O)COc2cccc(C)c2)cc(S(C)(=O)=O)c1	757673361	DTYTVPBWKJNCAV-UHFFFAOYSA-N	435.458	1.417	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)Nc2ccc(-n3ncn(C)c3=O)cc2)cc1	757864416	YTOSMNNMIMCWFJ-AWEZNQCLSA-N	438.444	1.394	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)c2ccccc2c1=O	758070512	CFIJPAUEFGLMJV-UHFFFAOYSA-N	434.412	1.810	50	20	IDGD	
C[C@H]1C[C@@H](C)CN(c2ccc(C(=O)NNC(=O)C(=O)Nc3ccccn3)cc2[N+](=O)[O-])C1	758820419	HTYNJQIJLBDJHN-OKILXGFUSA-N	440.460	1.872	50	20	IDGD	
C#CCCCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	758887791	HSDARDXTTGEQQA-UHFFFAOYSA-N	428.514	1.913	50	20	IDGD	
Cc1cc(S(C)(=O)=O)cc(C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c1C	758942639	LHZOISZJIYXNGF-UHFFFAOYSA-N	449.441	1.233	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccnc(OC(C)C)c2)c1	759679658	VDEZGRXDVCHGSN-UHFFFAOYSA-N	434.518	1.974	50	20	IDGD	
Cc1noc(C[C@H](NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c2ccccc2)n1	759866605	GYZHKHUSLQCCHG-KRWDZBQOSA-N	447.455	1.553	50	20	IDGD	
COc1ccc(C[C@H](C)C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)cc1	760153828	GYLXWBGWCDQKCR-INIZCTEOSA-N	447.561	1.348	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)[C@H](c1ccccc1)N1CCN(C)CC1	762371370	WXXSRPRBQHVBRU-NRFANRHFSA-N	428.558	1.923	50	20	IDGD	
O=C(NNC(=O)c1ccccn1)C(=O)Nc1ccc(Cl)cc1I	763466025	CLQXSVDNWUJDLZ-UHFFFAOYSA-N	444.616	1.739	50	20	IDGD	
O=C(NNC(=O)c1cccnc1)C(=O)Nc1cccc(COc2ccc3c(c2)OCO3)c1	763491919	QSAZCXYWGISARJ-UHFFFAOYSA-N	434.408	1.789	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(SC(F)F)nc2)cc1OC	763550117	GCFPBXLELQDMIA-UHFFFAOYSA-N	426.401	1.813	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)C(=O)Nc2cccc(OCC(N)=O)c2)c1	763595500	RIYMKJHIKKPLJS-UHFFFAOYSA-N	442.472	1.147	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2cn(-c3ccccc3)nc2-c2ccccc2)cnn1C	763601967	PIVHFEDOIBDEHJ-UHFFFAOYSA-N	443.467	1.981	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)cccc1C(=O)N1CCCC1	763682553	WBKWUVRKRKPICM-UHFFFAOYSA-N	449.467	1.268	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCC3)cc1NS(C)(=O)=O	763782346	SQTJLGOUWNPYMX-UHFFFAOYSA-N	436.515	1.316	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)C(=O)Nc1cc(N2CCNC2=O)ccc1Cl	763837441	FYZKXSOVYMVGRT-UHFFFAOYSA-N	449.826	1.174	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccc([S@@](C)=O)c(F)c1	763865562	LJVZNUSTYXSPCB-XUQHIXODSA-N	425.413	1.256	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)C(=O)Nc1ccc(Cl)c2ncccc12	763921528	LVTNKKCAKAJKLP-UHFFFAOYSA-N	436.819	1.264	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)C(=O)Nc1ccc(=O)n(Cc2ccccc2Cl)c1	763993414	PWJDBPBISWRRFA-UHFFFAOYSA-N	427.848	1.288	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)C(=O)N1CCc2ccc(Br)cc21	764003207	ABGLCESGSYHEAS-UHFFFAOYSA-N	446.257	1.571	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)on1)C(=O)Nc1cccc(N2CCOC2=O)c1	764016817	ORWPPDPSBUJFHS-UHFFFAOYSA-N	435.396	1.698	50	20	IDGD	
Cc1nnc(Sc2ccc(NC(=O)C(=O)NNC(=O)Cc3cc[nH]n3)c(C)c2)s1	764293948	RRZYETTVFTYYES-UHFFFAOYSA-N	431.503	1.358	50	20	IDGD	
O=C(Cc1cc[nH]n1)NNC(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1Sc1cccs1	764294329	WEZVXYOFOOZMEI-UHFFFAOYSA-N	446.470	1.859	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)C(=O)Nc2cccc(COCC(F)(F)C(F)F)c2)cn1	764358468	FOQJMBHWFWYMDV-UHFFFAOYSA-N	431.346	1.237	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)C(=O)Nc1ccc(-c2n[nH]c(C3CC3)n2)cc1	764367215	KIWKUWLSHNNWRO-UHFFFAOYSA-N	434.456	1.652	50	20	IDGD	
CCNC(=O)c1ccc(C)c(NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)c1	764370965	UNGFLTVPCFTORK-UHFFFAOYSA-N	434.399	1.502	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc(F)cc3C)n[nH]2)cc1OC	764379462	YGRWCKRDKRJQHQ-UHFFFAOYSA-N	441.419	1.941	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1ccc(Cl)c(C(N)=O)c1	764394332	ZTCOEPKBMFKQDL-UHFFFAOYSA-N	436.877	1.326	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1cnc2c(c1)c(C)nn2C	764398953	YYBPQFSZSSFYDR-UHFFFAOYSA-N	428.474	1.164	50	20	IDGD	
O=C(CSc1nnc(-c2ccco2)n1Cc1ccco1)NNC(=O)C(=O)N1CCCC1	765346229	CDWXGTLSIRIMJH-UHFFFAOYSA-N	444.473	1.041	50	20	IDGD	
Cc1nn2c(C=NNC(=O)c3cccc(S(=O)(=O)N4CCOCC4)c3)c(C)nc2s1	765541615	ANOHBBWRTRJMMF-UHFFFAOYSA-N	448.530	1.192	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)CCCOc2ccc(I)cc2)n[nH]1	765582854	HZLXBNDGZKJCOA-UHFFFAOYSA-N	428.230	1.943	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cnc4cc(C)nn4c3C)CC2)cc1	765748358	MNTZBMGEBLZZJV-UHFFFAOYSA-N	435.532	1.233	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)c1OC	765757256	AZBLFDIAMPDCBO-UHFFFAOYSA-N	446.935	1.936	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)c1ccc2nccn2c1	766662725	DAEHUNRYIBSKAC-UHFFFAOYSA-N	426.908	1.567	50	20	IDGD	
CCc1ccccc1N1C[C@@H](C(=O)OCC(=O)NNC(=O)Cc2ccccc2C)CC1=O	767268796	YAIXZVIKNDUOKS-IBGZPJMESA-N	437.496	1.844	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c(C(C)(C)C)n1	768937872	FDEZVWPUGOEOBN-UHFFFAOYSA-N	433.534	1.577	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)[C@@]3(O)CCN(Cc4ccccc4)C3)nc21	770957787	FNSWCDVVPWWQAX-OAQYLSRUSA-N	425.493	1.367	50	20	IDGD	
COc1ccc(C(=O)NCC(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)cc1OC	771008908	NQEDJMKRLMSVHH-UHFFFAOYSA-N	443.464	1.177	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)N[C@H]2CCO[C@]3(CCOC3)C2)c1	771444592	YDGHWZOHLGBJKX-APPDUMDISA-N	428.283	1.740	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)[C@@H]1CCCc2sccc21	771650505	RZYHMAIQVMLKIW-GOSISDBHSA-N	426.542	1.773	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)[C@H]1CCN(c2ccccc2Br)C1=O	772022430	GNMWWOSBKNUEHG-QWRGUYRKSA-N	426.267	1.291	50	20	IDGD	
O=C(NNc1ccc(C(F)(F)F)cn1)C(=O)Nc1ccc(N2CCCS2(=O)=O)cc1	773676041	ONTCOKDMALVTMN-UHFFFAOYSA-N	443.407	1.722	50	20	IDGD	
Cc1cccc(N2C(=O)N[C@@H](CCC(=O)NNc3cccc(S(C)(=O)=O)c3)C2=O)c1	776534073	BWLAHCYDKGYQOT-KRWDZBQOSA-N	430.486	1.747	50	20	IDGD	
CCOC(=O)C1=NN(c2ccccc2)[C@H](C(=O)NNc2cccc(S(C)(=O)=O)c2)C1	776534703	QDMWEFKNIXUNHD-SFHVURJKSA-N	430.486	1.731	50	20	IDGD	
Cc1cc(Br)cc(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1	777142178	ZRKIOYSASRAVIZ-OAHLLOKOSA-N	434.246	1.683	50	20	IDGD	
COCc1cccc(CC(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)c1	777813772	UVMHRFANIBAGMC-UHFFFAOYSA-N	444.963	1.994	50	20	IDGD	
CN(NC(=O)CCCc1nnc(-c2ccccc2I)o1)C(N)=O	778414757	KBHVLONQKNZEIL-UHFFFAOYSA-N	429.218	1.706	50	20	IDGD	
CC[C@@H](C)C(=O)N1Cc2ccccc2C[C@@H]1C(=O)NNC(=O)CNC(=O)OC(C)(C)C	778441019	HMTKQQYAHLQHDM-RHSMWYFYSA-N	432.521	1.658	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)C1CCN(C(=O)c2ccc(Cl)s2)CC1	778443254	NTISQYULLQPXTA-UHFFFAOYSA-N	444.941	1.926	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N[C@@H]2C[C@@H](O)C2(C)C)cc1	779228356	AGCGIZUGCVQZHC-FINFHUOPSA-N	437.500	1.617	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)c(OC)c1	782121403	XPWPNCQHJMSXSD-UHFFFAOYSA-N	440.456	1.021	50	20	IDGD	
Cc1cc(C)c(S(=O)(=O)NNC(=O)CNC(=O)c2cccs2)c(C)c1CC(=O)O	782253168	UZACRVKTBLXRIE-UHFFFAOYSA-N	439.515	1.040	50	20	IDGD	
CC(C)n1ncc2cc(NC(=O)C(=O)NNC(=O)Cc3nc4ccccc4n3C)ccc21	782888581	VJEIADGKDPEMSS-UHFFFAOYSA-N	433.472	1.833	50	20	IDGD	
Cn1cnn(-c2ccc(NC(=O)C(=O)NNc3ccc(Cl)cc3[N+](=O)[O-])cc2)c1=O	783290499	AWHVDSMFPYZPJA-UHFFFAOYSA-N	431.796	1.214	50	20	IDGD	
CCOC(=O)Cn1cccc(NC(=O)C(=O)NNc2ccc(Cl)cc2[N+](=O)[O-])c1=O	783291277	NYWNQWFUMCKFJT-UHFFFAOYSA-N	437.796	1.055	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2cccnc2-c2ccc(Cl)s2)CCS(=O)(=O)C1	783428633	XVFQMSFJQJCAKE-INIZCTEOSA-N	428.923	1.600	50	20	IDGD	
CC(=O)N/C(=C/c1ccccc1)C(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	783704556	OZHNVQHAUJHTHG-OBGWFSINSA-N	445.520	1.799	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1cccc(CCC(F)(F)F)c1	784004621	HZVROBYWVGOZJQ-UHFFFAOYSA-N	442.419	1.759	50	20	IDGD	
NC(=O)COc1ccc(NC(=O)C(=O)NNc2nc(-c3ccc(Cl)cc3)no2)cc1	784799296	AJJAXVUDHXFDTI-UHFFFAOYSA-N	430.808	1.336	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNc2ccc(Cl)nc2)ccc1S(=O)(=O)N(C)C	784870508	WIIBQFYQNGLVLK-UHFFFAOYSA-N	427.870	1.076	50	20	IDGD	
O=C(NNc1ncc(F)cn1)C(=O)Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1	784949290	KALAOGRDYWNFAY-UHFFFAOYSA-N	436.469	1.262	50	20	IDGD	
CC[C@]1(C)Oc2ccc(NC(=O)C(=O)NNC(=O)[C@@H]3COc4ccccc4O3)cc2O1	785987705	GTBYEPKKPMBXPG-LAUBAEHRSA-N	427.413	1.510	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)C(=O)Nc1cc(Cl)ccc1OCC1CCC1	786426570	LCKGPOWHKKDQBD-UHFFFAOYSA-N	448.863	1.628	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)[C@H]1CCCN(S(=O)(=O)c2ccccc2)C1	788175217	QXPBEVDWQIKARJ-HNNXBMFYSA-N	427.490	1.206	50	20	IDGD	
COCCONC(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccc(C)cc2C)c1	789345644	WPLCLQHEGRQCOT-UHFFFAOYSA-N	436.490	1.626	50	20	IDGD	
CCNC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c1C	789735555	ZKJAFZTZQPHRRU-UHFFFAOYSA-N	449.471	1.722	50	20	IDGD	
Cc1ccn(C[C@](C)(O)C(=O)NNC(=O)c2ccc(COc3ccccc3)o2)c(=O)c1	790483810	SOKXOWHKPDTDSC-QFIPXVFZSA-N	425.441	1.541	50	20	IDGD	
COCCS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2cccc(F)c2[N+](=O)[O-])cc1	790994412	WRCUDTCGTGLLMZ-UHFFFAOYSA-N	440.409	1.236	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1cccc(CCC(=O)OC(C)(C)C)c1	791909055	FVYXDKVIHAZEFJ-GFCCVEGCSA-N	428.511	1.051	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)C(=O)Nc1c2c(nn1-c1ccc(Cl)cc1)CCC2	792265527	DHIUFHAOTOEZHQ-UHFFFAOYSA-N	427.852	1.446	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2cccc(OC(F)F)c2)cc(-n2cccn2)c1	792354607	AEUFWCYHYMWCCT-UHFFFAOYSA-N	445.382	1.882	50	20	IDGD	
C[C@](O)(Cn1cc(C(F)(F)F)ccc1=O)C(=O)NNc1nnc(-c2ccccn2)s1	792476202	PWKLKWWEGHSCNK-INIZCTEOSA-N	440.407	1.675	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2ccc3c(c2)N(CC(F)F)C(=O)CS3)nc1	793038016	WCURZEXZLIFRSU-UHFFFAOYSA-N	437.428	1.876	50	20	IDGD	
COC(=O)c1cc(Br)ccc1S(=O)(=O)NNC(=O)c1cccc(C)n1	794600695	HZIAWWQMXILONN-UHFFFAOYSA-N	428.264	1.562	50	20	IDGD	
CNS(=O)(=O)N1CCC(C(=O)NNC(=O)c2sc(-c3ccccc3)nc2C)CC1	794789010	ZPGZEMJIZKFMJH-UHFFFAOYSA-N	437.547	1.056	50	20	IDGD	
Cn1nc(CC(C)(C)C)cc1NC(=O)C(=O)NNC(=O)CNC(=O)OCc1ccccc1	797369323	SNMRZQPKBHQCQD-UHFFFAOYSA-N	444.492	1.021	50	20	IDGD	
C[C@H](c1cccc(S(N)(=O)=O)c1)N(C)C(=O)NNC(=O)c1cnn(-c2ccccc2)c1	799927014	LNLCXJDBZXMTOJ-CQSZACIVSA-N	442.501	1.567	50	20	IDGD	
Cc1cccnc1NNC(=O)C(=O)Nc1cc2c(cc1N1CCCCC1)n(C)c(=O)n2C	800633592	DFDKEJBUMSIXSU-UHFFFAOYSA-N	437.504	1.653	50	20	IDGD	
Cc1c(C(=O)NNC(=O)CCN2C[C@H](C)O[C@@H](C)C2)nnn1CCOc1ccc(F)cc1	800688276	SGSNIJHMHOGUKL-GJZGRUSLSA-N	448.499	1.065	50	20	IDGD	
COCCNC(=O)c1cccc(NC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)c1	806629059	IRUZZSBLUSKVOC-UHFFFAOYSA-N	438.444	1.421	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@H](C)C(=O)NNC(=O)C(=O)Nc1cccc2c1CNC2=O	806974960	JBWTYSDWACZZNZ-GFCCVEGCSA-N	444.875	1.754	50	20	IDGD	
O=C(CCCc1cccs1)NNC(=O)C(=O)Nc1ccc(F)c(N2C(=O)CCC2=O)c1	806979608	BRQGKKVOULPMAH-UHFFFAOYSA-N	446.460	1.649	50	20	IDGD	
O=C(NNc1nc2ccccn2n1)C(=O)Nc1cc(C(F)(F)F)cc(Br)n1	807033454	QHSYHJUIZMQEBA-UHFFFAOYSA-N	444.171	1.987	50	20	IDGD	
CSCC[C@H](NC(=O)c1ccccc1Cl)C(=O)NNC(=O)N1CCN(C)CC1	807380165	QNZYPBUKZOEPCL-HNNXBMFYSA-N	427.958	1.180	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)[C@H](c1ccccc1)N(C)C	807399035	GYUIVHVULQCFMP-VQIMIIECSA-N	425.537	1.715	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1csc(N2CCOCC2)n1)[C@H](c1ccccc1)N(C)C	807402262	FASMUSAYINOBOF-WMLDXEAASA-N	432.550	1.615	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccc3nc(C)nn3c2)c1	809894273	AXSKVOJJVUSBLR-UHFFFAOYSA-N	445.505	1.535	50	20	IDGD	
COc1ccc(S(=O)(=O)NCC(=O)NNC(=O)CCCc2ccccc2)cc1OC	810337896	YFUVXGZLGHNTEL-UHFFFAOYSA-N	435.502	1.152	50	20	IDGD	
O=C(NCc1cccc(N2C(=O)NC3(CCCC3)C2=O)c1)NNc1nc2ccccn2n1	812561624	UNRWGFUWZNBMNF-UHFFFAOYSA-N	434.460	1.925	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)c2cc3c(nc2O)CC(C)(C)CC3=O)cc1	812729765	UEPSWLJXUGEIRR-UHFFFAOYSA-N	432.502	1.950	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)Nc2ccc(NS(C)(=O)=O)cc2)cc1	812945728	HLZCEBLJSIGNPW-UHFFFAOYSA-N	427.508	1.457	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)[C@@]1(C(F)(F)F)CCN(C(=O)OC(C)(C)C)C1	813461926	OGDXXLDEHJEAHS-QGZVFWFLSA-N	438.447	1.628	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2ccccn2)nnn1Cc1ccc(C(F)(F)F)cc1	815563945	SQERQCRGWNUIIC-UHFFFAOYSA-N	447.377	1.448	50	20	IDGD	
C[C@H](C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1)c1ccc2c(c1)OCO2	815854926	WUIBSNUXWGQDLG-HNNXBMFYSA-N	446.529	1.598	50	20	IDGD	
CCOc1ccc(NS(=O)(=O)c2ccc(C)c(C(=O)N3CC[C@@H](B(O)O)C3)c2)cc1	864234631	YBKWFWJRLCITSA-OAHLLOKOSA-N	432.307	1.883	50	20	IDGD	
CSC[C@H](C(=O)NNC(=O)c1cccc(N(C)C)c1)N1C(=O)[C@@H]2CCCC[C@H]2C1=O	904225085	SUTHOSAMEMXFDJ-BRWVUGGUSA-N	432.546	1.420	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CNS(=O)(=O)c2cc(C)ccc2C)ccc1OC(C)C	913154161	SLOUKJKDAXGELA-UHFFFAOYSA-N	449.529	1.839	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)oc2c1C(=O)CCC2	915110036	UXJROOKMVGXKLH-UHFFFAOYSA-N	445.497	1.966	50	20	IDGD	
COCCNC(=O)CNC(=O)C(=O)Nc1ccccc1S[C@@H](Cl)C(F)(F)F	915744592	DZPCHNRPTVJQDM-CQSZACIVSA-N	427.832	1.723	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCCCn2cnc3ccccc32)c2ccccc2c1=O	915926363	JCZDORMUZPXFKD-UHFFFAOYSA-N	433.472	1.800	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)c1cc(S(=O)(=O)N2CCCC2)c(C)o1	916148311	VTKSLZXXKAXWPI-UHFFFAOYSA-N	431.474	1.403	50	20	IDGD	
CS(=O)(=O)NC1(CNC(=O)NNC(=O)Cc2cccc3ccccc23)CCCCC1	916252043	AOCOUJWTPNHLOM-UHFFFAOYSA-N	432.546	1.965	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2ccc(Cl)c(C(N)=O)c2)c2ccccc2c1=O	916384051	KZTIBHXJLQJVCO-UHFFFAOYSA-N	428.836	1.635	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCCN2CCc3ccccc3C2)nc1	916444368	CLJPSMWTECYALG-UHFFFAOYSA-N	446.577	1.797	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NN=Cc2c(C)nn([C@H]3CCS(=O)(=O)C3)c2C)cc1C	917031539	VZIHLZHMVUFWAW-KRWDZBQOSA-N	431.518	1.565	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)CCC(=O)N3CC(=O)Nc4ccccc43)n[nH]2)cc1	917176006	PTBOIWATVPTKCT-UHFFFAOYSA-N	446.467	1.912	50	20	IDGD	
NC(=O)c1ncn2c(C(=O)NNC(=O)c3ccc(Cl)cc3O)cc(-c3ccco3)nc12	919751517	OUCNZCMTNXBNRG-UHFFFAOYSA-N	440.803	1.522	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)Nc2cccc(CN3CCC[C@@H]3C(N)=O)c2)c1O	920938952	UGMLIXLXSTZOOR-MRXNPFEDSA-N	427.461	1.317	50	20	IDGD	
CCS(=O)(=O)NCc1ccc(C(=O)NNC(=O)c2cncn2-c2ccccc2)cc1	1116126994	XEIZBPPJOQJLAK-UHFFFAOYSA-N	427.486	1.386	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)NCc2cn(-c3ccccc3)nn2)CC1	1252815466	HKGDSJLIPAJTJK-UHFFFAOYSA-N	443.508	1.745	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2ccc(I)cc2)cc1	1317791633	VTCSPPHWYZGLNU-UHFFFAOYSA-N	432.239	1.923	50	20	IDGD	
O=C(CO[C@@H]1CCOC1)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	1319056363	WJUJENPLYXATAG-GFCCVEGCSA-N	425.488	1.115	50	20	IDGD	
CCO[C@@H]1C[C@@H](NC(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)[C@]12CCCO2	1320453934	CUGSNVXDVBQRCB-WHSLLNHNSA-N	440.541	1.691	50	20	IDGD	
O=C(NNC(=O)c1n[nH]cc1I)c1cc(-c2ccc(F)cc2)[nH]n1	1325654822	QBVVVQUDAGPBED-UHFFFAOYSA-N	440.176	1.618	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2cnc(C(=O)OCC)s2)c2ccccc2c1=O	1328855621	RBWKBMVQIWUBFS-UHFFFAOYSA-N	429.458	1.515	50	20	IDGD	
Cn1c(C(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)cc(Br)c1C=O	1344716066	AVUWHVJWAAHPIC-UHFFFAOYSA-N	443.279	1.470	50	20	IDGD	
CCc1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](C)Br)C3)n[nH]1	1777730584	DKISNVHVQPSJRP-WBHUJUFNSA-N	427.343	1.883	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4cncn4c3)C2)C1	1778690916	PXIBZUDIPXELSZ-IFXJQAMLSA-N	435.322	1.809	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)/C=N/N3CCCCC3)C2)C1	1779013970	OQBYUDYJKLUTTH-UDBLOYCBSA-N	429.359	1.319	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)C3=Cc4ccccc4NC(=O)C3)C2)C1	1779991518	VIRNJLLUDKGCBT-VGOFRKELSA-N	447.919	1.496	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc([N+](=O)[O-])cc4c3OCC4)C2)C1	1780093092	BETGKWBTCAXFNK-JXFKEZNVSA-N	437.880	1.991	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccn(CCOC)n1)C2	1780703054	YMEIGVGMRWMIEH-XAUMDUMWSA-N	426.945	1.674	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2c(O)cc(O)cc2O)C1	1781028532	PYALSTWRZGPXRS-GQWAEJPESA-N	426.897	1.948	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](O)NC(=O)OC(C)(C)C)C1	1781050710	VISYQEGGKFTZFE-DHYLWCPWSA-N	447.960	1.361	50	20	IDGD	
O=C1NCc2cc(C(=O)N3CCO[C@]4(CCN(C(=O)[C@@H](F)Br)C4)C3)ccc21	1781331312	IFVDIQQFKAUTLU-KDOFPFPSSA-N	440.269	1.064	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)n2ccnc2C)C1	1782632159	VVKBHPAQZSDPOY-UJAMICLKSA-N	426.945	1.520	50	20	IDGD	
CN(C)[C@H](C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2)c1ccc(Cl)cc1	1782820629	MQYYQSFFUDNDKH-ZWOKBUDYSA-N	444.359	1.372	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)CCc3cnn(C)c3)CCO2)C1	1783342794	OREOYWJIVPRZCT-CRAIPNDOSA-N	427.343	1.356	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccn(CCOC)n3)CCO2)C1	1783348224	XBXPCXWSQQBAHA-KBXCAEBGSA-N	443.342	1.147	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)[C@@H]3CCCN3C(C)C)CCO2)C1	1783354018	LZJOTGPONDPRKO-GJYPPUQNSA-N	430.387	1.863	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(Cl)c(O)cc3O)CCO2)C1	1783537987	SESGCUXPDTZXHP-BTDLBPIBSA-N	447.713	1.978	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cccc(SC)c3O)CCO2)C1	1783883179	VTZKYJHAQBXUQO-IFXJQAMLSA-N	428.938	1.811	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3c(C)nn(C)c3C)[C@H]2C1	1784703400	NVLGJAPMFKUCLF-VGWMRTNUSA-N	441.370	1.804	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(CCN(C(=O)c3ccc(CO)c(F)c3)C2)C1	1785264257	UJZYTOFQSPECGT-SFHVURJKSA-N	429.286	1.547	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3C[C@H]3C3CC3)C[C@@H]21	1787506819	OPYRYSIGHDMBPD-BIMVRYHLSA-N	441.532	1.146	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)N3CCN(C)CC3)[C@H]2C1	1789795177	QLTYMYUBEZZCHJ-FKSLSLAPSA-N	429.005	1.010	50	20	IDGD	
CCc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]3C2)n(C)n1	1789870788	WBGANPBXMCRWRB-HAHWVIBASA-N	431.364	1.812	50	20	IDGD	
C[C@H](Cn1cccn1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]2C1	1789922539	OQJQJZXQOKTHTH-CAEXGNQWSA-N	431.306	1.189	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)NC(=O)c3ccccn3)[C@H]2C1	1790586576	SARQQGOLXUNJNR-FDPKGLCPSA-N	436.940	1.197	50	20	IDGD	
C=CCNC(=O)/C=C\C(=O)NC1(c2ccc(NC(=O)CCC(=O)NN(C)C)cc2)CCC1	1791595556	HBOQBQOGBJDIQK-BENRWUELSA-N	441.532	1.352	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(C(=O)N(C)C)c3)[C@H]2C1	1792099860	ZGAUBQJCJDOZPO-VJANTYMQSA-N	435.952	1.999	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN3C(=O)CSC3=S)[C@H]2C1	1792237534	MNRUWCYGMAMTQK-XUXIUFHCSA-N	448.010	1.234	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(F)ccc1Br)C2)[C@H](O)CCl	1792975623	WQVOBIQEYKUCGN-ANGCBRKESA-N	449.704	1.391	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN(C)C(=O)OC(C)(C)C)C2	1793447262	KHIZHQAFKWNWAR-JYYAWHABSA-N	431.961	1.850	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)c1nc(-c2ccccc2)ns1	1795916926	IURZCOODYHMJAP-LXTVHRRPSA-N	436.921	1.008	50	20	IDGD	
O=C(Cc1ccc2c(c1)CCCO2)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2	1797242949	YHCZZTYGGFZVCS-JLVBRIDZSA-N	427.328	1.947	50	20	IDGD	
COC(=O)CCCCCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CO[Si](C)(C)C	1797956553	LELJJJMIAZHHKA-CWPLJXCYSA-N	428.602	1.551	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](C)N1C[C@@H]2C[C@H]2C1	1798317878	UTQYOJRRQQFBGG-AZZJIIRNSA-N	440.548	1.099	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1[C@H]2c3ccccc3S[C@H]21)c1cccc(B(O)O)c1	1798452665	JHJXVMOLFUBSJG-AZNOEYCNSA-N	448.353	1.506	50	20	IDGD	
Cc1ccc(=O)n(C(C)(C)C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](F)Br)C3)n1	1798587696	JHAMSSCPICTGCI-QVHKTLOISA-N	443.317	1.616	50	20	IDGD	
Cc1nc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Br)c(C)s1	1799344307	HPYLNJZEHBYISG-BAESOJJISA-N	434.331	1.583	50	20	IDGD	
CCOc1ccccc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Br	1799349348	XELAEFAHOYIGGD-VZAMPYOESA-N	429.286	1.979	50	20	IDGD	
CC(C)(C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Br)c1ccccn1	1799351814	BNHAIHJSZAUCFU-AYRXBEOTSA-N	428.302	1.639	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](CC)NC(=O)OC(C)(C)C	1801961039	NMZXLLGMEASTGV-QRJUGERDSA-N	431.961	1.897	50	20	IDGD	
C[C@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H]1CC[C@H]3CCC(=O)N3C1)C2	1801968474	WHBBVEZCQFGXNI-SBOZNWLOSA-N	426.355	1.809	50	20	IDGD	
COc1cc(C#N)cc(C(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]2c2cccnc2)c1	1803141584	QDBJHXXAYGAYPP-NSISKUIASA-N	442.903	1.881	50	20	IDGD	
COc1cccnc1CCC(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]1c1cccnc1	1803142038	VHZDIQPVMLHODU-PLMTUMEDSA-N	446.935	1.724	50	20	IDGD	
Cc1c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)ccc(F)c1F	1803649697	DNTVJPCOHCIRQS-BJWYYQGGSA-N	428.244	1.519	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)CNC(=S)NCC)[C@H]1c1cccnc1	1803693639	AJHCVDPFDVREPN-BQFCYCMXSA-N	440.013	1.979	50	20	IDGD	
CC(=O)N(C)CCC(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)Br)[C@@H]1c1cccnc1	1804071613	GIWCVPHVCPFTCV-RPVQJOFSSA-N	439.354	1.739	50	20	IDGD	
Cc1ccc(C(=O)NC[C@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)nc1	1805874100	YVKLLXSJJZGMTA-XMSQKQJNSA-N	438.532	1.478	50	20	IDGD	
Cn1cc(CC(=O)N2CC[C@@H](CNC(=O)CCBr)[C@H]2c2cccnc2)cn1	1806346486	IBJQZXIZFFMJFB-QFBILLFUSA-N	434.338	1.849	50	20	IDGD	
CCC1(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)CCC1	1807360766	CANXWCLGVCCKTG-TZIWHRDSSA-N	435.333	1.661	50	20	IDGD	
O=C(Cc1cccs1)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1807544162	PZTPRXPBHLFMPP-GCJKJVERSA-N	449.341	1.385	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)[C@H](C)N2CCN(C)CC2)[C@@H]1c1cccnc1	1807904794	BSBCQNVUVLHRGH-LEAZDLGRSA-N	436.000	1.741	50	20	IDGD	
Cc1cscc1C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1808619881	ILZAJOKKAQFCKE-RXVVDRJESA-N	449.341	1.765	50	20	IDGD	
Cn1ncnc1C(=O)N1CC[C@H](CNC(=O)[C@@H](F)Br)[C@H]1c1cccnc1	1808650895	GZHOZAFMCSGDEQ-JHJVBQTASA-N	425.262	1.220	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1CCN(C(=O)c2cc[n+]([O-])cc2)[C@H]1c1cccnc1	1810543948	IBEGVGNEMDTHBG-ICSRJNTNSA-N	428.565	1.886	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2cnncc2C(=O)O)[C@@H]1c1cccnc1	1810806479	SKRIKXCLJCCBTQ-COXVUDFISA-N	431.880	1.907	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)CN2CCOC2=O)[C@H]1c1cccnc1	1812864953	YNVJTXLXLJCZSE-NOLJZWGESA-N	439.310	1.323	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)C2=CCCS2)[C@H]1c1cccnc1	1813067920	HJXVYMUCXWNXPW-JXFKEZNVSA-N	431.562	1.481	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@H]2c2cccnc2)cc1	1813888040	JWMIRLQSXFWYBE-SXLOBPIMSA-N	444.919	1.959	50	20	IDGD	
CC1=CC[C@H](C(=O)N[C@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)CC1	1815344217	OJTULCVYHIXIHP-YOEHRIQHSA-N	439.346	1.795	50	20	IDGD	
O=C(CC(F)(F)F)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1	1815354835	STUDDMRNSJJQPV-LLVKDONJSA-N	427.213	1.001	50	20	IDGD	
Cc1onc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)c1C	1815450590	ISMMRDWKJPCAPS-KRWDZBQOSA-N	437.265	1.314	50	20	IDGD	
Cc1nocc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1816523084	QFOICORECKRYGH-INIZCTEOSA-N	438.448	1.324	50	20	IDGD	
Cc1nc(C)c(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)o1	1817472673	ZFQWVPMWMDNNLZ-QGZVFWFLSA-N	437.265	1.314	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](F)Br)[nH]n1	1817994533	VWBZXLJWEDTVLV-XRNSZHNASA-N	433.282	1.539	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)CCl)CC2)c1ccc2cnccc2n1	1818189256	RESQAYRNZJMRIP-ABAIWWIYSA-N	431.905	1.912	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](F)Cl)CC2)c1cc2n(n1)CCCNC2=O	1818913242	HFIXZYPMPYOAMH-AMIZOPFISA-N	440.888	1.233	50	20	IDGD	
O=C1Cc2cc(C(=O)Nc3nc4c(s3)C[C@@H](NC(=O)[C@H](O)CCl)CC4)ccc2N1	1818918767	DPUGVLXWAIZDGH-SMDDNHRTSA-N	434.905	1.463	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC[C@@H]1c1cc(NC(=O)C(F)(F)Cl)n[nH]1	1822565310	BVRCVDLQRZHLJT-CYBMUJFWSA-N	426.616	1.227	50	20	IDGD	
CNc1nsnc1C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1	1822998866	JDGIVSPLUDQIIT-MLUIRONXSA-N	449.331	1.953	50	20	IDGD	
O=C(Cn1ccncc1=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](F)Br)CC2	1824536686	QGPQVPYJJSTQQO-ISVAXAHUSA-N	444.286	1.003	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC([C@@H]2CCCCN2C(=O)Cn2cncn2)CC1	1827185766	OULYHQAFJRSYBT-ZBFHGGJFSA-N	426.359	1.929	50	20	IDGD	
CC1=C(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CCO1	1827283234	SBRABQUCUZKWSB-HXUWFJFHSA-N	441.532	1.613	50	20	IDGD	
O=C(N[C@H]1CCc2nc(NC(=O)[C@@H]3CCCSC3)sc2C1)c1cccc(B(O)O)c1	1828152300	FYGRTEHRBZZFBW-HIFRSBDPSA-N	445.375	1.192	50	20	IDGD	
C[C@]1(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)CC2)CCCN1	1828924369	PITJHTTUASVQJU-AUSIDOKSSA-N	442.564	1.061	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)CN2C(=O)C=CC2=O)CC1	1829103141	DGOSONGDXDBNFU-QGZVFWFLSA-N	435.597	1.383	50	20	IDGD	
Cc1n[nH]c(C)c1CC(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830363601	FBLYMAYZOLEVDL-FQEVSTJZSA-N	426.945	1.290	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)COc3ccccc3C#N)C2)C1	1830370693	PURUHAGITJHWAX-JOCHJYFZSA-N	449.935	1.658	50	20	IDGD	
CCOC(=O)C(C)(C)C(=O)N1CCOC[C@]2(CN(C(=O)C(C)(C)CCl)CCO2)C1	1830371371	ZGWKCDYLIZACBR-FQEVSTJZSA-N	432.945	1.297	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccn(C)c3)C2)C1	1830535080	IPUDDJLHIQCIER-KBXCAEBGSA-N	428.327	1.126	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccn4cncc34)C2)C1	1831650401	HENZZPHSZCBFRV-UWJYYQICSA-N	434.924	1.812	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H](Cl)COC)CC1	1831830560	DXKYUNZACMPUNJ-OIISXLGYSA-N	430.977	1.568	50	20	IDGD	
C#CCCCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1	1831849780	GGXXNAPHWAEXPM-FQEVSTJZSA-N	425.533	1.722	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(F)n2)CC1	1831873250	FMDNNGJIRGVGEU-SFHVURJKSA-N	433.528	1.827	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3nnc(C)s3)CCO2)C1	1833014971	APTBLHJHLIFHSR-BEFAXECRSA-N	444.985	1.643	50	20	IDGD	
CC(C)(C)[C@H](O)C(=O)NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1	1833286051	OCFFSNRGNBIFQA-QGZVFWFLSA-N	432.403	1.750	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3snnc3C3CC3)CC2)CC1)[C@H](O)CCl	1833310744	ZLEOFYAMOGUFFZ-OAHLLOKOSA-N	441.985	1.200	50	20	IDGD	
Cc1cc(C(=O)N2CCC(N3CCC(NC(=O)[C@@H](O)CCl)CC3)CC2)nn1C(F)F	1833312672	WKHVVDUNXPRMQA-INIZCTEOSA-N	447.914	1.372	50	20	IDGD	
CCOc1cnc(C(=O)N2CCO[C@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)cn1	1833428434	PNCMKGHXEMRATL-HXUWFJFHSA-N	440.928	1.210	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)CN3CCCC3=O)CC2)CC1	1834625295	WOFHBFNXRJRGLG-GOSISDBHSA-N	426.989	1.588	50	20	IDGD	
Cc1cc(F)ccc1C(=O)N1CCOC[C@@]2(CN(C(=O)CCBr)CCO2)C1	1834826398	OJPSWAOMMKXGCS-LJQANCHMSA-N	443.313	1.989	50	20	IDGD	
C[C@@H]1CC[C@H](C(=O)NC2CCN(C3CCN(C(=O)[C@@H](C)Br)CC3)CC2)O1	1835466030	NSXADUDPWMTYSS-CKEIUWERSA-N	430.387	1.909	50	20	IDGD	
COc1cnc(C(=O)N2CCC(N3CCC(NC(=O)CO[Si](C)(C)C)CC3)CC2)cn1	1835833641	ZDVPTRBIDRZQKT-UHFFFAOYSA-N	449.628	1.522	50	20	IDGD	
CC(C)N[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1)C(C)C	1835893057	PQLXNWHKDCHMDE-LAUBAEHRSA-N	432.005	1.730	50	20	IDGD	
CCc1cc(C(=O)N2CCC(N3CCC(NC(=O)[C@H](F)Br)CC3)CC2)n[nH]1	1836412298	CZKCQUCTNGSAPR-INIZCTEOSA-N	444.349	1.848	50	20	IDGD	
Cc1nc(C(=O)N2CCC(OC3CCN(C(=O)[C@H](O)CCl)CC3)CC2)ccc1F	1836714971	GVNCNAXRORKZDC-GOSISDBHSA-N	427.904	1.741	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cn4cc(F)ccc4n3)CCO2)C1	1836961365	BWWYIPZUCBZXRO-MGPUTAFESA-N	438.887	1.561	50	20	IDGD	
C[C@@H](Cc1ccncc1)C(=O)N1CCOC[C@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1837715637	BOEOVCDVZHMFCQ-AVRDEDQJSA-N	449.624	1.568	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(CO)o3)CCO2)C1	1837970217	GNRLAFUQWMETDH-MSOLQXFVSA-N	435.304	1.078	50	20	IDGD	
O=C(CCN1CCOC1=O)N1CCC(OC2CCN(C(=O)C(Cl)Cl)CC2)CC1	1838273401	OCWVYBAYZNAUOC-UHFFFAOYSA-N	436.336	1.631	50	20	IDGD	
O=C(c1nc2ccccc2o1)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1839503755	WMCSHFOBSODKAF-SFHVURJKSA-N	428.272	1.702	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc[nH]c3C)C2)C1	1839963980	BMLKQGHCOXOXOF-YJBOKZPZSA-N	428.327	1.567	50	20	IDGD	
O=C(c1ccc(C(F)(F)F)[nH]1)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840189093	WDPTXRYYEXZOBM-HNNXBMFYSA-N	444.237	1.907	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CCCS1)CCO2	1840578478	APDBPAOOJRHBGV-ZQIUZPCESA-N	435.384	1.512	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)C3CCSCC3)CCO2)C1	1840925043	JWRJGWOURNNTCB-MSOLQXFVSA-N	439.405	1.822	50	20	IDGD	
CC(C)(C)OC(=O)N1CCCC[C@H](C(=O)N2CC3(CCCN3C(=O)[C@@H](O)CCl)C2)C1	1841354797	WRNCISNDODKEFU-HOTGVXAUSA-N	443.972	1.827	50	20	IDGD	
COCC1(C(=O)N2CCCC23CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C3)CC1	1841594881	AQWRDNKFMKPTTM-AWEZNQCLSA-N	429.945	1.749	50	20	IDGD	
O=C(c1ccc2c(Cl)ccnc2c1)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843012101	DJXZVNDXJIZQDL-UHFFFAOYSA-N	449.703	1.699	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](O)[C@](C)(C(=O)N2CC3(CCCN3C(=O)[C@H](F)Cl)C2)C1	1843361699	IMAVYWZANMRNEF-CKFHNAJUSA-N	447.935	1.732	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)c1cn(-c2ccccc2)nc1-c1cccs1	15639437	LPCBGFJSVDPDQY-ZDUSSCGKSA-N	430.511	1.797	50	20	IDGD	
COc1cc(C(=O)NNC(=O)COc2ccc(C)c(C)c2)cc(OC)c1OCC(N)=O	15705840	MQCQJBFTHVFLHA-UHFFFAOYSA-N	431.445	1.025	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COc2cc(C)cc(C)c2)cc1S(=O)(=O)N(C)C	15878953	FOBTUMNWZRTXJD-UHFFFAOYSA-N	435.502	1.402	50	20	IDGD	
CCn1c(=O)c2ccccc2n(CC(=O)NNC(=O)c2cc(-c3ccccc3)on2)c1=O	28793443	DXPWYEUQNVNFLO-UHFFFAOYSA-N	433.424	1.299	50	20	IDGD	
CSCC[C@H](NC(=O)c1ccccc1)C(=O)NNC(=O)c1ccc2c(c1)OCCO2	115342357	QSIDOCDEIYHIFG-INIZCTEOSA-N	429.498	1.771	50	20	IDGD	
COc1ccc(-n2ccnc2SCC(=O)NNC(=O)CNC(=O)c2cccs2)cc1	725740916	JLQGKDGLSGNDSM-UHFFFAOYSA-N	445.526	1.612	50	20	IDGD	
CC(=O)c1ccc(N2CCN(C(=O)NNC(=O)CNC(=O)c3cccs3)CC2)c(F)c1	725871287	DYXOLMSJCAWOSM-UHFFFAOYSA-N	447.492	1.383	50	20	IDGD	
Cn1ccnc1[C@H](NC(=O)NNC(=O)CNC(=O)c1ccco1)c1ccc(Cl)cc1	725871541	DBWHBPPHDOMAHC-MRXNPFEDSA-N	430.852	1.516	50	20	IDGD	
C[C@H](C(=O)NNC(=O)COc1ccc(OCc2ccccc2)cc1)N1CCN(C)CC1	725878649	ZNIPBXBADRJOIM-GOSISDBHSA-N	426.517	1.428	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3ccc(C(F)(F)F)nc3)cc2)CC1	728214537	RFOMNRZMYGNNHD-UHFFFAOYSA-N	443.451	1.793	50	20	IDGD	
COCCN1C[C@@H](C(=O)NNc2ccc(S(=O)(=O)Nc3ccccc3)cc2)CC1=O	728217635	KBZQEUQVOMJHKE-HNNXBMFYSA-N	432.502	1.425	50	20	IDGD	
O=C(NN=Cc1c(N2CCOCC2)nc2ccccn2c1=O)c1cccc(OC(F)F)c1	728434881	QLSYPOGKHZQPNR-UHFFFAOYSA-N	443.410	1.896	50	20	IDGD	
O=C1CC(=O)Nc2cc(S(=O)(=O)NNC(=O)c3cccc(OC(F)F)c3)ccc2N1	728510381	IFHCXKVFUYXEDF-UHFFFAOYSA-N	440.384	1.192	50	20	IDGD	
CCCOc1cn(-c2ccccc2)nc1C(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	728512147	MFSGBUXJVOWQTN-UHFFFAOYSA-N	446.467	1.983	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)Cn2c(=O)n(C)c3ccccc32)c1	728529940	VDCQAYPNDXXVHF-UHFFFAOYSA-N	433.262	1.572	50	20	IDGD	
Cn1ccnc1CNC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	728752612	JFMYCDWCLJVCPF-UHFFFAOYSA-N	434.503	1.427	50	20	IDGD	
CCCN(CCC)C(=O)CCC(=O)NNC(=O)c1sc(N2CCOCC2)nc1C	729282354	SNKPVUXXERMPLC-UHFFFAOYSA-N	425.555	1.478	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)[C@@H]1CS[C@]2(c3ccc(F)cc3)CCC(=O)N12	730778703	UCUKAPMXRGAQNT-BTYIYWSLSA-N	445.472	1.648	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C2(S(=O)(=O)c3ccccc3)CC2)cc(OC)c1OC	731341668	OCEQTNYGXKDOAR-UHFFFAOYSA-N	434.470	1.480	50	20	IDGD	
N#CCCn1cc(/C=C(/C#N)C(=O)N2CCO[C@@H](c3nn[nH]n3)C2)c(-c2ccccc2)n1	732089822	NGRNTVSSWFBKCL-MUMAZLPKSA-N	429.444	1.484	50	20	IDGD	
COC(=O)C[C@H]1c2cc(OC)c(OC)cc2CCN1[C@H](C)C(=O)NNC(=O)CC(C)C	732197011	JPYDWQPJRYAAQY-PBHICJAKSA-N	435.521	1.748	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N[C@@H](C)[C@H](C)N2CCOCC2)cc1Br	732464842	JVRNGCHXHXDNAB-RYUDHWBXSA-N	429.315	1.511	50	20	IDGD	
Cc1ccc(-n2c(NNC(=O)CC[C@@H]3NC(=O)NC3=O)nc3ccccc3c2=O)c(C)c1	733264885	GHGDARKGXZITHF-INIZCTEOSA-N	434.456	1.434	50	20	IDGD	
O=C(NNc1cnccn1)c1cccc(NS(=O)(=O)c2ccc3nnn(O)c3c2)c1	734245321	TZXKHXWRTCCQKB-UHFFFAOYSA-N	426.418	1.016	50	20	IDGD	
O=C(CN(Cc1cccnc1)c1ccccc1)NNC(=O)C1CCN(c2ncccn2)CC1	735655831	WVCCGFRSNPUGQU-UHFFFAOYSA-N	445.527	1.942	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1ccc(N=c2cc[nH]cc2)cc1	735836152	FAFVUOGQLLHDGC-UHFFFAOYSA-N	438.513	1.923	50	20	IDGD	
CSc1ccc(O[C@H](C)C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1	740996151	QKZGRCYFRZKTMA-ACJLOTCBSA-N	446.481	1.706	50	20	IDGD	
CC(C)Oc1ccc(NC(=S)NNC(=O)CCN2C(=O)[C@@H]3[C@H]4CC[C@@H](O4)[C@@H]3C2=O)cc1	743820053	FXOUATXNTZGGRP-AHCXZYCDSA-N	446.529	1.344	50	20	IDGD	
CCS(=O)(=O)N1CCC(C(=O)NNC(=O)Nc2cc(Cl)c(OC)cc2OC)CC1	743833964	OEXHXEOQRDYJRX-UHFFFAOYSA-N	448.929	1.572	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1cn(Cc2ccccc2)nn1	744621954	KHLWRFUBAGPGKJ-UHFFFAOYSA-N	442.501	1.104	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2c(C(C)C)nn(C)c2Cl)cc1OC	745191401	NIWRNANHVHZDOJ-UHFFFAOYSA-N	438.868	1.832	50	20	IDGD	
COc1cc(C(=O)NNC(=O)N[C@H]2C[C@@H](C)N(c3cnn(C)c3)C2=O)ccc1OC(C)C	745916137	BACARLQJOCWSGE-CJNGLKHVSA-N	444.492	1.354	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](CC(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1)c1ccccc1	746139333	OXLHJMWLJNOSML-LSDHHAIUSA-N	440.522	1.160	50	20	IDGD	
CC(=O)N1CCc2cc(S(=O)(=O)NNC(=O)c3cc(Br)c[nH]3)ccc21	747847902	GVLRXNSGAQDYNQ-UHFFFAOYSA-N	427.280	1.310	50	20	IDGD	
O=C(CCOc1ccccc1)NNC(=O)NCCC(=O)N1CCN(c2ccccc2)CC1	748464741	JMLKFHCNQCYQES-UHFFFAOYSA-N	439.516	1.525	50	20	IDGD	
O=C(CCc1nc(-c2nc[nH]n2)no1)NNC(=O)COc1ccccc1-c1ccccc1	748544231	GVZJZKCXURBANU-UHFFFAOYSA-N	433.428	1.681	50	20	IDGD	
N#Cc1ccc(CS(=O)(=O)CC(=O)NNc2nc(Br)cn3ccnc23)cc1	750250454	SWPSQLAMQIIRKF-UHFFFAOYSA-N	449.290	1.422	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)c1nc(NCc2ccco2)ncc1Cl	751206724	RUHZUTFHZOMJAW-UHFFFAOYSA-N	434.865	1.588	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)c1cn(-c2ccc(C(F)(F)F)cn2)nn1	751303780	VKZCPSAVUFTWEJ-UHFFFAOYSA-N	444.171	1.847	50	20	IDGD	
CCn1cc([C@@H]2C[S@@](=O)CCN2C(=O)NNC(=O)c2cccc(OC(F)F)c2)cn1	753130511	MICCTJMJIHIHAM-JGVYIQDASA-N	441.460	1.664	50	20	IDGD	
C[C@@H](C[S@@](C)=O)NC(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	753359647	RJIKPOZLXIWXMV-AOYOOGHLSA-N	441.513	1.156	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)N[C@H]2CCN(Cc3ccc(C#N)cc3)C2=O)cc1C	753732469	MEVUQKFKDBYHCI-FQEVSTJZSA-N	435.484	1.685	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2ccc(OC)c(Br)c2)c(C)o1	754748818	MDIPRNJMTJYMTQ-UHFFFAOYSA-N	447.263	1.769	50	20	IDGD	
CSC[C@H](C(=O)NNc1ccc(C(F)(F)F)nn1)N1C(=O)[C@H]2CCCC[C@H]2C1=O	755191545	IQZOAPPJZLBHMK-OUAUKWLOSA-N	431.440	1.845	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2nnc(O)c3ccccc23)cc1	755516657	JADYMTXANFWNRJ-UHFFFAOYSA-N	444.473	1.489	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)NC1CCN(S(=O)(=O)C(C)(C)C)CC1	755902527	XVPFFQLUUWKDSH-UHFFFAOYSA-N	426.539	1.161	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)Nc2cccc(S(=O)(=O)/N=C3\CCCCCN3C)c2)n[nH]1	756164968	ITNHDSXPNSLPPL-KOEQRZSOSA-N	447.521	1.778	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)NNC(=O)Nc1cccc(N2CCS(=O)(=O)CC2)c1	756206111	JWVQWXAEOVJSEP-UHFFFAOYSA-N	441.513	1.798	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)Nc2ccc(S(=O)(=O)NC)cc2)cc1OC	756641313	TWPSAIYZBHFHGX-UHFFFAOYSA-N	436.490	1.859	50	20	IDGD	
CCOC(=O)Cn1cccc(NC(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)c1=O	757763382	LGABOORIRVVTIU-UHFFFAOYSA-N	430.446	1.330	50	20	IDGD	
COCC(=O)N(C)CC(=O)NNC(=O)c1ccc(CSc2nc(C)cc(C)n2)cc1	758213566	AXSSEQMULKQREF-UHFFFAOYSA-N	431.518	1.252	50	20	IDGD	
O=C(NC1CC1)c1ccc(C(=O)N2CCN(S(=O)(=O)CBr)CC2)cc1	758518919	SSLSYBUCVYGOOX-UHFFFAOYSA-N	430.324	1.019	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NC[C@H](C)c2nccs2)cc1	758721675	BUWPFZMOJGYCSP-ZDUSSCGKSA-N	425.536	1.206	50	20	IDGD	
CCC[C@H](NC(=O)NNC(=O)C(=O)Nc1ccccn1)C(=O)N1CCc2sccc2C1	758747950	UCTHQSSZHGXKOX-AWEZNQCLSA-N	444.517	1.166	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)N[C@H]2CN(C(=O)OC(C)(C)C)C[C@@H]2C#N)cc1OC	758777769	PQUMFIMZQCXUCL-GJZGRUSLSA-N	447.492	1.797	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cnc3nccnc3c2)c1	758998408	UUVCFKQBLJISEC-UHFFFAOYSA-N	428.474	1.130	50	20	IDGD	
NS(=O)(=O)c1ccc(C(=O)NNC(=O)COc2ccccc2-c2ccccc2)cn1	762741462	FKIDGAIRRIZITL-UHFFFAOYSA-N	426.454	1.236	50	20	IDGD	
COC[C@@H](C)NC(=O)/C(C#N)=C\c1ccc(OCCn2cc(C(=O)O)nn2)c(Cl)c1	763113438	ILCVASQMCYFDMA-AISSWFOISA-N	433.852	1.767	50	20	IDGD	
C[C@H]1COCCN1c1ccc(NC(=O)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1	763471352	IWBHHDGNJUYPRJ-ZDUSSCGKSA-N	427.417	1.220	50	20	IDGD	
COc1ccc(Br)c(NC(=O)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c1	763472602	ZWSFBHATKONKNY-UHFFFAOYSA-N	437.206	1.766	50	20	IDGD	
COC(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)c2ccccc2Br)c1	763482735	KQGWDFVYMXUKSN-UHFFFAOYSA-N	434.246	1.564	50	20	IDGD	
Cn1c(=O)n(C)c2cc(NC(=O)C(=O)NNC(=O)c3cc4ccccc4cc3O)ccc21	763525720	BZVAOAYHUIQLCM-UHFFFAOYSA-N	433.424	1.136	50	20	IDGD	
CCn1cnnc1-c1cccc(NC(=O)C(=O)NNC(=O)COc2cc(C)ccc2C)c1	763668383	LRJZMQMSVMBLQP-UHFFFAOYSA-N	436.472	1.747	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(OC(F)F)c(F)c1	763679857	DMAUGDKGGAPPHG-UHFFFAOYSA-N	441.362	1.991	50	20	IDGD	
CCCNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)COc2ccccc2CC)c1	763714456	VYAXWJSGISQFML-UHFFFAOYSA-N	426.473	1.554	50	20	IDGD	
CC(C)Oc1ccc(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)cc1C#N	763746044	PFZOYJCWVHJCNZ-UHFFFAOYSA-N	435.484	1.884	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)C(=O)Nc2ccc(F)nc2)c2ccccc2c1=O	763821634	VSCJHCUAVHHODE-UHFFFAOYSA-N	440.435	1.521	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)c1cnc(-c2ccc3c(c2)OCO3)s1	763823719	FONMVKNRMDLGAV-UHFFFAOYSA-N	425.426	1.125	50	20	IDGD	
CC[C@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)cc1	763873776	WHFDOFFCPKSVMF-KBPBESRZSA-N	444.463	1.907	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(F)c(C(N)=O)c2)cc1OC	763912096	NPOQXQOQRSHSGB-UHFFFAOYSA-N	432.408	1.122	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc[nH]2)n([C@@H]2CCN(Cc3ccccc3)C2)n1	763979192	JWJXCJUUKRVRSS-QGZVFWFLSA-N	435.488	1.366	50	20	IDGD	
Cc1ccc(CN(C)C)cc1NC(=O)C(=O)NNC(=O)c1cc(Br)cn1C	764004328	CYGCWRQTPNJWSC-UHFFFAOYSA-N	436.310	1.557	50	20	IDGD	
CN(C)CCOc1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)on2)cc1	764016728	LVWWMGSJHNXKHX-UHFFFAOYSA-N	437.456	1.682	50	20	IDGD	
O=C(NNC(=O)c1cccc(C(F)(F)F)c1)C(=O)Nc1cc(-n2cnnn2)ccc1F	764041261	ZTWUFKVDKGILFO-UHFFFAOYSA-N	437.313	1.220	50	20	IDGD	
CCOCCCNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)nc2)c1	764100227	YCQDXYQTMJBOEE-UHFFFAOYSA-N	447.879	1.291	50	20	IDGD	
CC(C)NC(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)COc2ccccc2O)c1	764275133	JTQABSMUEWWOBU-UHFFFAOYSA-N	448.863	1.349	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)C(=O)Nc1cccc(C#Cc2ccccn2)c1	764278714	VAEROXBKHNSWEZ-UHFFFAOYSA-N	428.448	1.906	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C(=O)Nc1ccccc1CN1C(=O)CCC1=O)c1ccccc1	764332793	YXGKKHXZUWFOBB-KRWDZBQOSA-N	436.468	1.615	50	20	IDGD	
O=C(CCCc1cccs1)NNC(=O)C(=O)Nc1cc(F)cc(N2CCOCC2)c1	764342115	VCJNSRGMVXUQGR-UHFFFAOYSA-N	434.493	1.833	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)cc(OC)c1OC	764383175	XISRVCDUMVUULK-UHFFFAOYSA-N	445.457	1.564	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)C(=O)Nc1ccccc1CN1C[C@H](C)O[C@@H](C)C1	764386148	RNARJSBFHONAJQ-HOTGVXAUSA-N	425.489	1.399	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)C(=O)Nc2ccc(Cc3ccncc3)cc2)c1	764432177	DBFRQIDJDQSUPY-UHFFFAOYSA-N	432.440	1.426	50	20	IDGD	
COc1cccc(NC(=S)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)c1	764516390	SWMYSGPJYPJKJZ-UHFFFAOYSA-N	427.530	1.471	50	20	IDGD	
CC(C)(C)OC(=O)CCC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	765183703	AJYLFPYLXSFTKM-UHFFFAOYSA-N	425.507	1.354	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1ncc(Br)s1	765399047	ZDIOMSFBVDTXGP-UHFFFAOYSA-N	447.336	1.683	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)NCc2cccc(N3CCCS3(=O)=O)c2)c1	765896605	YYQUBHHUDPVHHV-UHFFFAOYSA-N	438.531	1.456	50	20	IDGD	
Cc1cc(C=NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)ccc1C#N	766427439	AVASNYWNUBZFBF-UHFFFAOYSA-N	440.525	1.971	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NC[C@@]2(C)CCO[C@H]2C2CC2)nc1	768535750	QUJHENAPVFBWOQ-PKOBYXMFSA-N	425.555	1.943	50	20	IDGD	
CC1(C)CCC[C@]2(C1)NC(=O)N(CC(=O)NNC(=O)Cn1cnc3ccccc31)C2=O	768565044	ABNNGDUFNWJZRU-OAQYLSRUSA-N	426.477	1.075	50	20	IDGD	
CCS(=O)(=O)N1CCC(NC(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)CC1	770129654	SCSDNMBNLHCRSZ-LBPRGKRZSA-N	432.930	1.252	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)N2CCN(CC(=O)NNC(=O)c3ccc(C#N)cc3)CC2)c1	770727479	FGFMUFBFQULPKH-UHFFFAOYSA-N	449.511	1.159	50	20	IDGD	
CC(C)(C)C(=O)NNC(=O)CN1C(=O)N[C@@](C)(c2ccc(Br)cc2)C1=O	771250087	KWRINDKTBRFHPO-KRWDZBQOSA-N	425.283	1.410	50	20	IDGD	
Cn1c(O)nc2ncc(-c3cccc(C(=O)NNC(=O)COc4ccccc4O)c3)cc21	771824786	QYXKJTDJZRPLFC-UHFFFAOYSA-N	433.424	1.887	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)[C@H]1CCCN(C(=O)c2ccccc2OC(F)F)C1	771987641	GHOPILFXEONMPD-STQMWFEESA-N	441.431	1.629	50	20	IDGD	
C[C@H]1CN(c2ccnc(C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)c2)C[C@@H](C)O1	772224504	PCVQFDOHMSISAR-IYBDPMFKSA-N	439.520	1.163	50	20	IDGD	
CCn1cc(S(=O)(=O)NNC(=O)c2ccc(COc3ccccc3)o2)c([N+](=O)[O-])n1	772569141	QLEOPUABJJSDAU-UHFFFAOYSA-N	435.418	1.607	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)CCC[C@@]1(C)NC(=O)NC1=O	772710129	ZTGTXNRAORUZQQ-DYZYQPBXSA-N	441.282	1.132	50	20	IDGD	
O=C(NNc1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(I)cn1	773491078	TVEXMZFSUVLKLS-UHFFFAOYSA-N	427.158	1.676	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)NC(=O)[C@@H](C)O2	774008464	JBXTZEKAPZUGIG-GHMZBOCLSA-N	446.847	1.613	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)NCC2=CCN(C)CC2)cc1	775960923	ZZBWVNMCVINCNA-CPNJWEJPSA-N	448.527	1.719	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NCc2ccnc(N(C)C)n2)c2ccccc2c1=O	776070427	WJZMAGBEHINHCS-UHFFFAOYSA-N	438.492	1.197	50	20	IDGD	
O=C(CCSc1ccc(F)cc1)NNC(=O)N[C@H]1CCO[C@]2(CCS(=O)(=O)C2)C1	776077171	SFRRRJJNBHMPII-KBXCAEBGSA-N	445.538	1.375	50	20	IDGD	
Cc1ccc(-n2nc(C(=O)NNC(=O)c3ccc(Cl)c(S(N)(=O)=O)c3)cc2C)cc1	777274274	IIIZGOXUPURMAB-UHFFFAOYSA-N	447.904	1.865	50	20	IDGD	
COC(=O)Cc1cccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1	777403098	RSXPWPJBVGLTOX-UHFFFAOYSA-N	445.497	1.261	50	20	IDGD	
CCOC(=O)N1CCC([C@H](C)NC(=O)NNC(=O)CNC(=O)c2cccs2)CC1	777497843	GCNJSJAMCOAHIT-LBPRGKRZSA-N	425.511	1.065	50	20	IDGD	
O=C(c1ccc(-c2ccco2)nc1O)N1CCN(S(=O)(=O)CBr)CC1	777777364	HWURVFGLYFUCCL-UHFFFAOYSA-N	430.280	1.487	50	20	IDGD	
O=C1NC(=O)C2(CCC(C(=O)NNc3ccc([N+](=O)[O-])cc3Br)CC2)N1	779140391	JDCAQKBLQNSZDR-UHFFFAOYSA-N	426.227	1.569	50	20	IDGD	
CS(=O)(=O)c1ccc(Oc2ccc(NC(=O)C(=O)NN=c3cc[nH]cc3)cc2)cc1	783379132	XAWBOATVJIGPKZ-UHFFFAOYSA-N	426.454	1.781	50	20	IDGD	
CCn1ncc2ccc(NC(=O)C(=O)NNc3ccc(S(=O)(=O)NC4CC4)cc3)cc21	784216003	LTTLQWMCQXMIFG-UHFFFAOYSA-N	442.501	1.579	50	20	IDGD	
CN1C(=O)c2ccc(NC(=O)C(=O)NNc3ccc(C#N)c(C(F)(F)F)c3)cc2C1=O	784232109	OQIIOPSORXGERP-UHFFFAOYSA-N	431.330	1.885	50	20	IDGD	
CCNC(=O)N(C)NC(=O)C(=O)Nc1ccc(N2C(=O)c3ccccc3C2=O)c(Cl)c1	784915485	OCTFLKRVZWSFTC-UHFFFAOYSA-N	443.847	1.772	50	20	IDGD	
CON(C)S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccc(C#N)c(Cl)c2)cc1	785095153	QCEZUMWJKMQSST-UHFFFAOYSA-N	437.865	1.475	50	20	IDGD	
Cc1c(C(=O)NNC(=O)C(=O)Nc2ccccn2)nnn1Cc1ccc(C(F)(F)F)cc1	785180721	AVXSOOVLSUKUPG-UHFFFAOYSA-N	447.377	1.448	50	20	IDGD	
O=C(Cn1cnc2ccc(Br)cc2c1=O)NNc1ccc(-n2ccnc2)nn1	788177847	LBRIKLBQBJRHOD-UHFFFAOYSA-N	441.249	1.278	50	20	IDGD	
NS(=O)(=O)c1ccccc1NNC(=O)C1CCN(C(=O)c2ccc(F)cc2F)CC1	788231432	HIWPNERMBRFZCI-UHFFFAOYSA-N	438.456	1.608	50	20	IDGD	
CCCOc1cc(OC)ccc1C(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1	788672060	RVBPVXWVJLLLAD-UHFFFAOYSA-N	449.529	1.874	50	20	IDGD	
CCN(C)C(=O)[C@@H](C)NC(=O)NNC(=O)COc1ccc(OCc2ccccc2)cc1	788886017	JIGMHZXJPFNZEF-MRXNPFEDSA-N	428.489	1.842	50	20	IDGD	
CC(C)Oc1cc(NC(=O)C(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)ccc1C(N)=O	789731363	CYLAWKPAQJROHU-UHFFFAOYSA-N	442.516	1.875	50	20	IDGD	
Cc1ccc(Cn2nccc2NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)o1	789810708	QBYULOMWGDTKPF-HKUYNNGSSA-N	437.456	1.491	50	20	IDGD	
NC(=O)c1ccc(/C=C\C(=O)N2CCC[C@@H]2C(=O)NNc2cccc(F)c2[N+](=O)[O-])cc1	791067394	SJGAIRIRVQZUFS-SDMNGIDPSA-N	441.419	1.980	50	20	IDGD	
O=C1CN(S(=O)(=O)c2ccc(C(=O)NNc3cc(Cl)cc(Cl)c3)cc2)CCN1	791729246	USHSAGFWHHWDEQ-UHFFFAOYSA-N	443.312	1.871	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)C(=O)Nc1cccc(N2C(=O)CCCC2=O)c1	792355571	TXVTXCLNTULADM-UHFFFAOYSA-N	442.403	1.034	50	20	IDGD	
CN(C)N(C(=O)c1cccc(-c2cnc3nc(O)n(C)c3c2)c1)[C@@H]1CCS(=O)(=O)C1	792851495	XHHZCTYCSSYADQ-MRXNPFEDSA-N	429.502	1.447	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ncccc2C)n(-c2nc3ccccc3s2)n1	793025077	JSHMHBIHPXRIEB-UHFFFAOYSA-N	435.469	1.894	50	20	IDGD	
O=C(/C=C\C(=O)Nc1ccc2n[nH]cc2c1)NNC(=O)CNC(=O)OCc1ccccc1	794061512	HTTAQWMEUGGTSC-HJWRWDBZSA-N	436.428	1.131	50	20	IDGD	
Cc1cccc(C(=O)NNS(=O)(=O)c2cc3c(cc2Br)OCCO3)n1	794599894	SUYAUIOVDLEOAN-UHFFFAOYSA-N	428.264	1.547	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)CCCS(=O)(=O)c2ccc(Cl)cc2)cc1	794760762	SEEFZULHLBVZHL-UHFFFAOYSA-N	435.889	1.992	50	20	IDGD	
COC(=O)[C@@]1(c2ccccc2)CCN(CC(=O)NNC(=O)c2cc(Cl)ccc2OC)C1	794806831	GUTOWHZZYPKDSI-QFIPXVFZSA-N	445.903	1.926	50	20	IDGD	
CC(C)Oc1ccc(NC(=O)C(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)cc1C(N)=O	796990629	UMZMHXRPISVSAN-UHFFFAOYSA-N	442.516	1.875	50	20	IDGD	
CNC(=O)COc1ccc(NC(=O)C(=O)NNc2ncccc2C(F)(F)F)c(C)c1	797043727	TZGPDOYGFRPEIT-UHFFFAOYSA-N	425.367	1.615	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)NCc1ccc(I)c(C)c1	798477783	QXRMZEBQJXMYBE-NSHDSACASA-N	435.262	1.482	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@@H]2C(=O)NNC(=O)CNc2ccccc2OC)cc1	799098371	FQJSDHOEHKJMJW-GOSISDBHSA-N	426.473	1.568	50	20	IDGD	
CCOC(=O)[C@@]1(COC)CCCN(CC(=O)NNC(=O)c2cc(Cl)ccc2OC)C1	799198514	HBMNGBWBPHFVQZ-FQEVSTJZSA-N	441.912	1.401	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2ccccc2S[C@@H](C)C(N)=O)c2ccccc2c1=O	801103506	IBCWDUZTBSLWHV-LBPRGKRZSA-N	439.497	1.457	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(\C#N)C(=O)NS(=O)(=O)[C@H](C)[C@@H](C)C(=O)OC)c1C	802163938	TZMMEKKSKRCBLO-KQAKWNKOSA-N	439.534	1.863	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NC[C@H](N2CCOCC2)C(F)(F)F)ccc1OC(C)C	805844888	OPWQHDSQTGYSJQ-INIZCTEOSA-N	448.442	1.690	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)C(=O)Nc1ccc(F)cc1OC1CCOCC1	806972475	ALKOQRVTKPXUFH-UHFFFAOYSA-N	445.403	1.512	50	20	IDGD	
COc1ccc2cc(NC(=O)C(=O)NNC(=O)CNC(=O)c3cccs3)ccc2c1	807006706	PUAMGIJVPTWALA-UHFFFAOYSA-N	426.454	1.426	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)Nc1csc(-c2ccccc2)n1	807017563	MZIDBWZVACOGPB-UHFFFAOYSA-N	427.398	1.824	50	20	IDGD	
Cc1cc(C(=O)NCC(C)C)ccc1NC(=O)C(=O)NNc1ccc(-n2ccnc2)nn1	807428737	JRVLSXWRCGTIGQ-UHFFFAOYSA-N	436.476	1.438	50	20	IDGD	
O=C(CNS(=O)(=O)c1cc(C(F)(F)F)ccc1Cl)NNc1nc2ccccn2n1	811440022	KAMDSMCQKUZYLF-UHFFFAOYSA-N	448.814	1.823	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)CNS(=O)(=O)c1cccc(F)c1	811462765	YFQHQYWKKPLZIX-NSHDSACASA-N	429.857	1.372	50	20	IDGD	
CCOC(=O)c1ccc(NNC(=O)CNS(=O)(=O)c2ccc(NC(C)=O)cc2)cc1C	812722690	XDJIEOSFCYMTLE-UHFFFAOYSA-N	448.501	1.552	50	20	IDGD	
Cc1cccc(C(C)C)c1NNC(=O)C(=O)Nc1cnn(CC(=O)NCCN(C)C)c1	813046648	FPRFZLXFJUXJBS-UHFFFAOYSA-N	429.525	1.075	50	20	IDGD	
CCCc1nnc(SCC(=O)NNC(=O)COc2ccccc2-c2ccccc2)n1N	813363988	BLYABJXMMCHCNK-UHFFFAOYSA-N	440.529	1.930	50	20	IDGD	
O=C(NN=Cc1c(N2CCOCC2)nc2ccccn2c1=O)Nc1cc(F)cc(F)c1	815005845	XSDMHYBTRIPHSD-UHFFFAOYSA-N	428.399	1.965	50	20	IDGD	
CCOc1ccc(NNC(=O)C(=O)Nc2ccccc2OCC(=O)N2CCOCC2)cc1	815815230	QHKLCBCSBVWKFZ-UHFFFAOYSA-N	442.472	1.405	50	20	IDGD	
Cc1nc2c(c(O)nn2C)c(C)c1CC(=O)NNc1ccccc1S(=O)(=O)N(C)C	817053539	VZLVEOGZGKYJBV-UHFFFAOYSA-N	432.506	1.227	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)C(=O)NCCCc2ccccc2)C1	819659609	XQVDGJSWTVXQHL-KRWDZBQOSA-N	432.521	1.530	50	20	IDGD	
CCOc1ccc(N2C[C@@H](C(=O)NNC(=O)CNc3ccc(OC)cc3)CC2=O)cc1	913430493	HGGLPOHVMMKGNO-HNNXBMFYSA-N	426.473	1.706	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCC(C)(C)N2C[C@@H](C)O[C@H](C)C2)nc1	916234444	GCMUFDKFCJSQHY-HUUCEWRRSA-N	442.586	1.282	50	20	IDGD	
CCn1cnc2c1c(=O)n(CC(=O)NN=C(C)c1ccccc1)c(=O)n2Cc1ccccc1	916332127	OGHWSIXBFRZQFW-UHFFFAOYSA-N	444.495	1.968	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCCCCN1CCCC[C@@H]1C	916504268	RJXOANGWAJVHSI-HNNXBMFYSA-N	438.598	1.887	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)CN1C(=O)Cn2c(cc3ccccc32)C1=O	920274084	KLASDCJAKPZBBZ-CYBMUJFWSA-N	438.415	1.378	50	20	IDGD	
CCNC(=O)CN1CCCN(C(=O)/C(C#N)=C\c2cc(C)n([C@@H](C)COC)c2C)CC1	920455982	KKMSHZFLDLAZPN-PKIWBCANSA-N	429.565	1.890	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC=C2C(=O)CC3(CCCCC3)CC2=O)c1	920977747	KCZHMXSOVLKUPG-UHFFFAOYSA-N	433.530	1.938	50	20	IDGD	
CC1CCN(CCC(=O)NNC(=S)Nc2cccc(S(=O)(=O)N(C)C)c2)CC1	1317703270	YCAFQABVTFJJQH-UHFFFAOYSA-N	427.596	1.377	50	20	IDGD	
CCCS(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)c2ccc(OC)cc2)cc1F	1319802817	NHNVUEGWVNCCBV-UHFFFAOYSA-N	445.494	1.609	50	20	IDGD	
O=C(CN1CCC(CN2C(=O)c3ccccc3C2=O)CC1)NNC(=O)c1ccc(F)cc1	1319998182	GTWWVQXZLQSSSZ-UHFFFAOYSA-N	438.459	1.595	50	20	IDGD	
CN(C)C(=O)Nc1ccc(CNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1	1321495967	FNEVJUUVFHSRIJ-UHFFFAOYSA-N	440.508	1.317	50	20	IDGD	
CCC[C@@H](CCCS(C)(=O)=O)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	1324901113	RFGUMMZUUZIUQX-HNNXBMFYSA-N	425.555	1.082	50	20	IDGD	
Cn1ccc2cccc(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)[C@@H](O)CCl)C4)c21	1778675041	CZQSHRPIZASQCK-NJNPRVFISA-N	433.936	1.906	50	20	IDGD	
CCCC(=O)N[C@@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)Br)C2	1779520509	SDWQGEOSKRVKGM-XTDOFWJNSA-N	446.386	1.589	50	20	IDGD	
O=C(c1ccc(-c2ccccc2)nc1)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1779890334	SASBMQCXVTWZPJ-UGKGYDQZSA-N	429.904	1.792	50	20	IDGD	
O=C(c1ccc(OCCCO)cc1)N1CC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1780126577	NHOQQGOJGRWIRO-LJQANCHMSA-N	431.316	1.695	50	20	IDGD	
Nc1nc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](F)Br)C2)cs1	1780771530	KGMYYIACGFEBDH-UEKVPHQBSA-N	435.319	1.543	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)Cc3ccc([N+](=O)[O-])c(OC)c3)CCO2)C1	1781218455	PDQBWFJXQYHYKY-MGPUTAFESA-N	439.896	1.993	50	20	IDGD	
CC(C)(C)c1cc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)[nH]n1	1781332363	XRTAHERTNRZMBF-DYVFJYSZSA-N	431.306	1.841	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)c1	1781334946	QIJOTEMRWTYSMS-QAPCUYQASA-N	442.285	1.779	50	20	IDGD	
Cc1c(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](C)Br)C2)cnn1C	1781996897	XRICIWZOBQCTJD-CDHAZOANSA-N	427.343	1.639	50	20	IDGD	
CCOC(=O)C1(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](C)Br)C2)CC1	1782002031	LAOIOERXZUALEC-HBUWYVDXSA-N	445.354	1.627	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](NC(C)C)C(C)C)C2	1782170674	SOPIRMPNXUYNKU-TWFHAPMSSA-N	432.005	1.777	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)Nc1nccs1)C2	1782172838	NKNFHRHAXZPKFZ-NRTGNBEESA-N	444.985	1.711	50	20	IDGD	
O=C(c1ccnc2ncccc12)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1782343185	BFCBJCBQWFTBOJ-KBXCAEBGSA-N	437.269	1.764	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cnnc(Cl)c3)CCO2)C1	1783345195	YGZKAYZGZLKAPF-BLLLJJGKSA-N	431.718	1.747	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3ccc(C#N)cc3)[C@H]2C1	1783443955	MKYCWZONRLIRMX-MUGJNUQGSA-N	433.936	1.724	50	20	IDGD	
Cc1nnc(CCC(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](C)Br)C3)C2)s1	1783532538	PENGUMNDXJPYLP-BZNIZROVSA-N	431.356	1.392	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1783849442	OIPKLMRSLIMCDZ-MRUHUIDDSA-N	426.941	1.837	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc([N+](=O)[O-])[nH]3)C[C@@H]21	1783970743	ZTUAABMRIHYJKA-UHXUPSOCSA-N	443.298	1.547	50	20	IDGD	
CCc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCBr)[C@H]3C2)nn1C	1786405965	ANDVAJQDOQHBDG-NOLJZWGESA-N	427.343	1.361	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCBr)[C@H]3C2)c(O)c1	1786409069	WLNRGMKHKYYRJN-NUTKFTJISA-N	441.322	1.779	50	20	IDGD	
COc1nccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Br)C[C@@H]32)c1F	1787139669	KDIHTPFWTKGIAB-HVTMNAMFSA-N	448.264	1.513	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnnc4ccccc34)[C@H]2C1	1787886079	QNDHZSARYGMBDN-UHEFJODHSA-N	432.908	1.477	50	20	IDGD	
Cc1cc(CC(=O)NC2(c3ccc(NC(=O)c4ccc(B(O)O)cc4)cc3)CCC2)nn1C	1788140337	NJBXQRYMFJWXGA-UHFFFAOYSA-N	446.316	1.399	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Br)C[C@@H]32)o1	1788606965	XIKBFHMTWLGFDP-TZQJONAQSA-N	446.273	1.522	50	20	IDGD	
Cc1nc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]3C2)cs1	1788765111	HPLMFGBYSUZXQK-XIRDDKMYSA-N	425.627	1.825	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(C2(NC(=O)C(O)O)CCC2)cc1	1790046296	RHLGCTOVXBWINE-UHFFFAOYSA-N	443.412	1.579	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(Cl)ncn1)C2	1792872416	GBDFDGVQDJHVBL-NJBDSQKTSA-N	431.718	1.364	50	20	IDGD	
COc1cc(N2CCC(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)[C@H](F)Cl)C4)CC2)ncn1	1793307557	NTZXLTYSBVEWMF-KRXQYRFLSA-N	439.919	1.874	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1(C(=O)Nc2ccccc2)CC1	1793404013	NFAAABHBRCJERY-CYGHRXIMSA-N	449.935	1.249	50	20	IDGD	
O=C(COc1cccc2ccccc12)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2	1793814168	BGCCRDADGXSYMT-HPNQWNLUSA-N	432.904	1.408	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2)[C@@H]1COc2ccccc2O1	1793840560	OARHIPSKGLYMIE-VLWCASSMSA-N	439.306	1.201	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2)c1cncn1-c1ccncc1	1794464664	UVIXVSUAFFRYBF-ZSBFGKGUSA-N	448.321	1.256	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](C)Cn1cccn1	1794494961	HFCGCZKLXFVQAV-HEZDOATESA-N	439.520	1.291	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccc2c(c1)OCO2	1795312014	QXQSKAJQISNYPA-VLBMKZOESA-N	443.327	1.784	50	20	IDGD	
Cc1snc2sc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@H](O)CCl)C4)cc12	1796121057	JVCVDFZODXKPHI-IQOUGMIPSA-N	429.951	1.469	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)c1ccnc(C(F)(F)F)c1	1796190862	UTTRKGOLFKKQLK-BJWYYQGGSA-N	447.222	1.346	50	20	IDGD	
Cc1nc(Br)sc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Cl	1796365173	QZEHJKWQQORDFW-PKIKSRDPSA-N	440.722	1.952	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1c(Br)cnn1C	1796747440	RZPQSTRNALYXNF-XCCSTKFXSA-N	447.761	1.793	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCN1Cc2ccccc2C1=O	1797183503	SJPBTZZBSFUJOM-WQDJSCAQSA-N	433.936	1.640	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1n[nH]c2ccccc12	1797414081	HXOXPVMWRDTJPK-YJKIEOBBSA-N	425.258	1.457	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccn2cncc2c1	1797506704	RBYVDIOMFYQSHX-YALNPMBYSA-N	435.322	1.711	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(Cl)ncn1	1798308729	CFASUGFUFYCNNM-MIJXAVMKSA-N	431.718	1.507	50	20	IDGD	
C[Si](C)(C)c1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)co1	1798413896	KCOVQCUJJZHIDE-REPLKXPHSA-N	440.381	1.070	50	20	IDGD	
Cc1cccc(/C=C/C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)n1	1798440339	YHQKCRFCLXXBNX-KXXXJKOBSA-N	434.500	1.354	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3nccn3c1)C2	1799275550	XHAZZKMZJISVBK-MVWRLGRASA-N	425.316	1.774	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](F)Br)[C@H]1CC[C@H]2CCC(=O)N2C1	1800161671	CGRSFTZOVOVSLO-GSTZKUONSA-N	430.318	1.716	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(F)c(F)cc1F)c1cccc(B(O)O)c1	1800377204	WFXHHYRQUJRFBI-QDMKHBRRSA-N	432.207	1.349	50	20	IDGD	
Cc1cccc(Cl)c1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc(B(O)O)c1)C2	1800491628	CSWJWKOIMDZRQY-BCDXTJNWSA-N	426.709	1.894	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1cnn(C)c1)C2	1800638997	FVIKWGGMNYYZJC-JYYAWHABSA-N	427.343	1.116	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3ncccn3n1)C2	1800641307	YDKBOGPKNASGJD-ZWUHOBOKSA-N	436.310	1.106	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Oc1ccccc1)C2	1800759890	OHSONAPGPNFUBY-WVCIDPQESA-N	425.323	1.827	50	20	IDGD	
COc1c(Cl)ccnc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)Br	1800760207	ISAWAPSFTIXTBU-HNCHTBHHSA-N	446.729	1.730	50	20	IDGD	
CC(=O)Nc1ccccc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CO[Si](C)(C)C)C2	1801779245	UVWHBGWLVFUYGL-CWPLJXCYSA-N	433.581	1.700	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@]1(F)CCCCC1(F)F)C2	1802336633	RIIPWHAPBGRGCZ-NXEZDXNNSA-N	432.487	1.915	50	20	IDGD	
Cc1cc(O)c([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCC(=O)NN(C)C	1802338006	LDQOGNXKGJAEBP-QDMKHBRRSA-N	447.492	1.234	50	20	IDGD	
C[C@H](Sc1ccccn1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCC(=O)NN(C)C)C2	1802898909	PVSPXOQFHXRMBV-NXOAAHMSSA-N	433.578	1.573	50	20	IDGD	
CC(C)Cc1cc(C(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)n(C)n1	1803138983	QKMPDDUCXSCWRZ-AHRSYUTCSA-N	447.967	1.933	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cnc3ncccn23)[C@H]1c1cccnc1)[C@@H](O)CCl	1803143191	WKLPHUJJNRBOTG-XIRDDKMYSA-N	428.880	1.044	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)COc2cccnc2)[C@H]1c1cccnc1	1804338195	CIECKAJAAQPSJH-IMFGXOCKSA-N	432.908	1.815	50	20	IDGD	
Cc1noc(C)c1CCC(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1	1804599559	FOXWCVHFOWQLOA-XKGZKEIXSA-N	434.924	1.925	50	20	IDGD	
Cn1c(C(=O)NC[C@H]2CCN(C(=O)CO[Si](C)(C)C)[C@H]2c2cccnc2)cccc1=O	1805313997	ADRAEQBNGBDLKE-UTKZUKDTSA-N	442.592	1.951	50	20	IDGD	
C[C@H](C(=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Cl)[C@H]1c1cccnc1)N1CCN(C)CC1	1807862110	AYBKPPJCOXHKEH-LAVFITLUSA-N	425.936	1.258	50	20	IDGD	
CCc1cc(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](Cl)COC)[C@@H]2c2cccnc2)nn1C	1811143195	HEIBZUQSIYUKLI-VDZJLULYSA-N	433.940	1.951	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)c2ccnnc2O)[C@@H]1c1cccnc1	1811233714	QSEGIXVKFVNNNC-WHOFXGATSA-N	434.294	1.680	50	20	IDGD	
Cc1ccn(C)c1C(=O)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1	1815360839	OQYIBZWDEJKHJP-HNNXBMFYSA-N	438.318	1.009	50	20	IDGD	
Cc1cnn(CC(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@H](F)Br)CC3)c1	1815760173	PXAHIFHGQBJHLA-RNCFNFMXSA-N	430.303	1.951	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@H]1CCc2nc(NC(=O)Cn3ccnn3)sc2C1	1815764676	YZIKWCHAACUOKS-UWVGGRQHSA-N	427.328	1.378	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1CCc2nc(NC(=O)c3nc[nH]c3[N+](=O)[O-])sc2C1	1817198732	ISINFLGWLLIJTI-SECBINFHSA-N	438.542	1.852	50	20	IDGD	
C[C@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1)c1ccccn1	1817474236	BGIJEFJMDLRVHE-MGPUTAFESA-N	447.304	1.594	50	20	IDGD	
CN1N=C(C(=O)N[C@H]2CCc3nc(NC(=O)CO[Si](C)(C)C)sc3C2)CCC1=O	1820160310	JPZJBPKZONTYAM-NSHDSACASA-N	437.598	1.515	50	20	IDGD	
Cn1ccc(=O)cc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](F)Br)CC2	1821314024	PSTJOBWFKTXGQG-ISVAXAHUSA-N	443.298	1.758	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1cc([C@H]2CCCCN2C(=O)C[C@@H](NC)C(=O)O)[nH]n1	1822087144	GOSWZKQVWMMEGH-CYZMBNFOSA-N	444.330	1.638	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H]2CNC(=O)O2)CC1	1824089819	QSGYIDSZQNGPOA-YUELXQCFSA-N	430.343	1.746	50	20	IDGD	
COc1cnc(C(=O)N[C@@H]2CCc3nc(NC(=O)[C@H](C)Br)sc3C2)cn1	1825636993	PFAVINJFDVZHJB-DTWKUNHWSA-N	440.323	1.951	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC[C@H]1C1CCN(C(=O)[C@H]2CC[C@H](O)CC2)CC1	1827054707	KAMLDCQZNKPJGQ-NYVOZVTQSA-N	442.365	1.151	50	20	IDGD	
C[C@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H](O)CCl)CC1)[C@@H]1SC(=N)NC1=O	1827665617	ZARDIDKTFJLHSQ-MYPMTAMASA-N	444.985	1.008	50	20	IDGD	
Cc1nc(C)c(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)o1	1829295162	YVRRKAJKISQSHK-HXUWFJFHSA-N	439.321	1.518	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(C)=O)C2)C1	1829339801	CCDAHIJNKXFLAS-GHTZIAJQSA-N	437.924	1.712	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H](C)N2CCN(C)CC2)CC1	1830242891	UHZDNFWJALHNQB-IHPCNDPISA-N	443.032	1.496	50	20	IDGD	
Cc1c(Cl)cccc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1830720332	XLXHZPXOYNFIMC-APWZRJJASA-N	431.316	1.318	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3cc(C)n(C)n3)CCO2)C1	1830945626	OGJLPYUNYVLGPI-YLJYHZDGSA-N	426.945	1.135	50	20	IDGD	
CC(=O)N[C@@H](C(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1)C(C)(C)C	1831083618	SETJOKRDYLRXSG-HRAATJIYSA-N	445.988	1.259	50	20	IDGD	
C=C[C@@H](O)C(C)(C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1	1831873112	AJLXEDQWYWJXDI-RBUKOAKNSA-N	436.597	1.552	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3sccc3F)CCO2)C1	1831910959	YYCQUEUFORXHIQ-PXAZEXFGSA-N	449.342	1.988	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccc(C)c(C)c3)CCO2)C1	1832405784	UZDKHNFCIOFHDY-UGKGYDQZSA-N	438.952	1.556	50	20	IDGD	
CC[C@H](NC(C)=O)C(=O)NC1CCN(C2CCN(C(=O)[C@](C)(Cl)CCl)CC2)CC1	1833096774	CVBZVVMOHVBCBC-FXAWDEMLSA-N	449.423	1.709	50	20	IDGD	
CCn1nccc1C(=O)NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1	1834276117	VOIIPGDFBZWHGG-UHFFFAOYSA-N	440.386	1.873	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@](C)(Cl)CCl)C3)C2)nc1	1834379014	MOQHKPPPWCZDDY-RTBURBONSA-N	430.332	1.696	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3cc(O)n[nH]3)CC2)CC1	1834772434	CKTCJAVFBHWYQM-NSHDSACASA-N	428.331	1.084	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cn4ncccc4n3)CC2)CC1	1835394776	WUSJCNNLDBAMFZ-KRWDZBQOSA-N	448.955	1.168	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CSc3ncccn3)CCO2)C1	1836115606	ZKXUWNPJYVHRHP-KDOFPFPSSA-N	428.942	1.043	50	20	IDGD	
CCC(=O)N[C@H](C)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](Cl)COC)CC2)CC1	1836818603	QRNYIGBQTGIKDL-PBHICJAKSA-N	431.961	1.154	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(Cl)nc(OC)c3)CCO2)C1	1838233020	ZQRKHRVSHHJPOR-LIRRHRJNSA-N	446.331	1.831	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(C)n(C(F)F)n3)CCO2)C1	1838707973	CKJLAZIVOPNFHE-UGSOOPFHSA-N	434.871	1.674	50	20	IDGD	
O=C(c1ccccc1F)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1838856228	VQYAJATXWRHLSR-YOEHRIQHSA-N	433.249	1.586	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cncn3-c3ccncc3)C2)C1	1839142767	AHBPWQSKVNMCSM-LAUBAEHRSA-N	447.923	1.355	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccc(OC)cc3C#N)C2)C1	1839146923	AMPPVKCRPLJANY-UGKGYDQZSA-N	449.935	1.583	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3CCCS3)C2)C1	1839156225	IEDTVNDNBZQHIP-COXVUDFISA-N	425.378	1.575	50	20	IDGD	
C[C@H](Cc1ccncc1)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1839656678	YKQVNCADAZEJJB-VGSWGCGISA-N	437.968	1.982	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CNc3ccccc3C)C2)C1	1840152097	XGGGJPXPGIJBCC-UTKZUKDTSA-N	439.940	1.117	50	20	IDGD	
Cn1ncc2c(C(=O)N3CCOC[C@]4(C3)CN(C(=O)C(Cl)Cl)CCO4)cccc21	1840188687	XFNYGVJWJIECBE-IBGZPJMESA-N	441.315	1.447	50	20	IDGD	
O=C(c1cnc2ccc(C(F)(F)F)cn12)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1	1841351716	ZVWOAFSVCFLZQA-ZDUSSCGKSA-N	430.814	1.770	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)Cc2ccc(F)cc2Cl)C1	1841833755	ILPRVRIESJVBNZ-UHFFFAOYSA-N	430.672	1.219	50	20	IDGD	
CS(=O)(=O)c1ccc(C(=O)N2CC3(CCCN3C(=O)CCBr)C2)cc1F	1842639371	GZRYJJVZPRKKCD-UHFFFAOYSA-N	447.326	1.831	50	20	IDGD	
COc1ccc(C(=O)N2CC3(CCCN3C(=O)c3cccc(B(O)O)c3)C2)c(Cl)c1	1843015347	GHEYIFBDZPJRHE-UHFFFAOYSA-N	428.681	1.159	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2ccc3cnccc3n2)C1	1843680567	HEPIBDIUNOOSMO-JFLMPSFJSA-N	445.483	1.581	50	20	IDGD	
Cc1cc2cccc(C(=O)N3CCCC34CN(C(=O)c3cnccc3C(=O)NN)C4)c2[nH]1	1843736948	AGCSUYLTNCJJIA-UHFFFAOYSA-N	432.484	1.606	50	20	IDGD	
Cc1ccn2c(=O)c(C(=O)N3CCCC34CN(C(=O)[C@H](C)Br)C4)cnc2c1	1843787987	KWHPFZRSYHEYRH-ZDUSSCGKSA-N	433.306	1.603	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)c1ccc(NC(=O)C3CC3)cc1)C2	1846385424	FBYONZJDDCLZIM-UHFFFAOYSA-N	441.532	1.225	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)Cc2cc(C)on2)C1	1846557697	UIQKCUKTKOAHHO-UHFFFAOYSA-N	442.428	1.876	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)c2ccc(N3C(=O)C=CC3=O)cc2)C1	1846891249	NCAOWTJMXSIPOT-MRXNPFEDSA-N	431.876	1.187	50	20	IDGD	
CN(CCOc1cccc(Cl)c1)C(=O)NNC(=O)c1csc(N2CCOCC2)n1	9790185	YNZILNGRZLVJAP-UHFFFAOYSA-N	439.925	1.998	50	20	IDGD	
CCn1c(NNC(=O)c2ccc(S(C)(=O)=O)c([N+](=O)[O-])c2)nc2ccccc2c1=O	14367766	JLKAUEJMVSBYOT-UHFFFAOYSA-N	431.430	1.485	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)[C@H]2CC(=O)N(c3ccc4c(c3)OCCO4)C2)c1	16005418	PDAQOFWHZSUNLG-HNNXBMFYSA-N	425.441	1.346	50	20	IDGD	
Cc1ccc(CCC(=O)NCC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)cc1	116389288	FYIZYKLBIKEQJM-UHFFFAOYSA-N	445.545	1.107	50	20	IDGD	
COc1ccc(Br)c2[nH]c(C(=O)NNC(=O)CNC(=O)c3ccco3)cc12	725741391	QISBWSFXBGKYDP-UHFFFAOYSA-N	435.234	1.723	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)NCc1ccc([C@@]2(C)NC(=O)NC2=O)cc1	726282736	QZPOHEAPNQVWQY-HXUWFJFHSA-N	445.863	1.547	50	20	IDGD	
CN(C)CCNC(=O)c1cccc(CNC(=O)NN=c2sc3ccccc3n2C)c1	727480093	URAQESICGRWKMI-UHFFFAOYSA-N	426.546	1.846	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNS(=O)(=O)c2ccccc2[N+](=O)[O-])c1	728508615	VZOJNYXABLZPEE-UHFFFAOYSA-N	430.236	1.989	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)CN2C(=O)c3ccc(C)cc3C2=O)c1	728529063	PPYSWSJHQFJYOC-UHFFFAOYSA-N	446.257	1.823	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)CCCc2ccc3c(c2)CC(=O)N3)c2ccccc2c1=O	729300954	ZMRNEOVVTPFFJV-UHFFFAOYSA-N	433.468	1.695	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)Cc2coc(-c3cccs3)n2)ccc1Cl	729966681	WHIVGSUAPSBAQP-UHFFFAOYSA-N	440.890	1.708	50	20	IDGD	
CC[C@@H](NC(=O)NNC(=O)c1ccc(OC)cc1OC)c1cccc(S(N)(=O)=O)c1	730025555	LGGHGUCRDOIGCE-MRXNPFEDSA-N	436.490	1.447	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccccc1	730034497	WDFWPRHBFMKHAL-GOSISDBHSA-N	431.514	1.716	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](CCNC(=O)NNC(=O)COc2ccccc2C#N)C1	730139065	KMPWHRKTXRRURE-HNNXBMFYSA-N	431.493	1.915	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@@H]1CC(=O)N(c2ccc(F)cc2)C1	730204957	GVVLWAHAEBZWSH-CYBMUJFWSA-N	447.492	1.241	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)c1sccc1S(=O)(=O)N1CCSCC1	731491141	MQJAZJSNHBKBPZ-UHFFFAOYSA-N	441.556	1.569	50	20	IDGD	
Cc1nc(C(=O)NNC(=O)CCN2C[C@H](C)O[C@H](C)C2)nn1-c1ccccc1C(C)C	732260297	CGAYNJMNSWBASS-IYBDPMFKSA-N	428.537	1.959	50	20	IDGD	
C[C@@H]1CCC[C@H](OCC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)C1	732931761	GENIMJLURUOSBK-WBVHZDCISA-N	439.534	1.064	50	20	IDGD	
CC(=O)N1CCC[C@@H](C(=O)NNc2nc3ccccc3c(=O)n2CCCOC(C)C)C1	733266159	RTGZDUANYAAQJJ-QGZVFWFLSA-N	429.521	1.913	50	20	IDGD	
Cc1ccc(-n2c(NNC(=O)[C@H](C)NS(C)(=O)=O)nc3ccccc3c2=O)c(C)c1	733364762	DXHQWWLNINWGLP-AWEZNQCLSA-N	429.502	1.383	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)N[C@@H]2CCC[C@H](C(=O)N(C)C)C2)c2ccccc2c1=O	734223940	RVKDAJHVRJVELN-LSDHHAIUSA-N	442.520	1.568	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)NC3CCN(C[C@H]4CCCO4)CC3)n[nH]2)cc1	734280252	JMHGWCLQILGZQP-GOSISDBHSA-N	426.521	1.973	50	20	IDGD	
CC(=O)NCC(=O)N1CCc2cc(C(=O)NNC(=O)Cn3ccc4ccccc43)ccc21	735635167	XGGQYKVRWAQKDM-UHFFFAOYSA-N	433.468	1.128	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)[C@@H]3CSc4ccccc43)cc2)CC1	735686336	QKKDDWWONPFGRT-GOSISDBHSA-N	432.571	1.955	50	20	IDGD	
CCc1ccc(O[C@@H](C)C(=O)N2CCN(CC(=O)NNC(=O)c3cccs3)CC2)cc1	736622267	PBNPULPVNCRJHP-INIZCTEOSA-N	444.557	1.683	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)N[C@H]1CCN(c2ccc(Cl)cc2)C1=O	740026075	PIVIETBOBIDDTQ-INIZCTEOSA-N	440.851	1.065	50	20	IDGD	
COc1ccc(S(=O)(=O)CCC(=O)NNC(=O)Cc2ccc(Cl)cc2)cc1OC	740814320	QSMODSGSYMCRJX-UHFFFAOYSA-N	440.905	1.911	50	20	IDGD	
Cc1cc(C)cc(CCNC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)c1	741093130	NIQJDDGOEABAAE-UHFFFAOYSA-N	446.577	1.503	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)[C@@H](C)NC(=O)c2cc3c(C)nn(C)c3s2)cc1	742034237	GLXSKNKTBCMYEI-CYBMUJFWSA-N	429.502	1.596	50	20	IDGD	
CC(=O)N[C@H](Cc1c[nH]c2ccc(Br)cc12)C(=O)NNC(=O)c1c[nH]nc1C	742069558	ILAYFLVLQOZIKT-MRXNPFEDSA-N	447.293	1.470	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)Cc2csc(NC(=O)C(C)(C)C)n2)C[C@H](C)O1	743290121	BICFDZNZPDHVPE-STQMWFEESA-N	425.555	1.317	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)[C@@H](C)Oc2cccc(Br)c2)C[C@@H](C)O1	743290689	IXBCBSNFFLAMFO-HZSPNIEDSA-N	428.327	1.863	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)[C@@H](C)Oc2cccc(Br)c2)C[C@@H](C)O1	743290691	IXBCBSNFFLAMFO-MGPQQGTHSA-N	428.327	1.863	50	20	IDGD	
CN(C)C(=O)CN1CCC(NC(=O)NNC(=O)Nc2ccc(OC(F)F)cc2)CC1	743626789	NECOKXWDCVXHQH-UHFFFAOYSA-N	428.440	1.176	50	20	IDGD	
O=C(CNC(=O)c1ccccc1I)NNC(=O)NC1CCCC1	744469727	DAKISOOXMXIYAY-UHFFFAOYSA-N	430.246	1.294	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)NCC2(NS(C)(=O)=O)CCCCC2)cc1	745428763	QKUQHDWRKSHRPY-UHFFFAOYSA-N	426.543	1.340	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNS(=O)(=O)c2cc(C(=O)O)oc2C)c1	746055466	NBNUXKXRYVPJHE-UHFFFAOYSA-N	433.236	1.681	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)NC[C@@H](c1ccc(F)cc1)N1CCOCC1	746744569	RXXITNTZEOOMQF-IBGZPJMESA-N	440.479	1.420	50	20	IDGD	
COC(=O)[C@H](O)C1CCN(C(=O)/C(C#N)=C/c2cc(C)n(C[C@H]3CCCO3)c2C)CC1	747518157	JZGCXHUYQBNVCU-XGXHACIMSA-N	429.517	1.963	50	20	IDGD	
COc1cc(S(=O)(=O)NNC(=O)[C@H]2COc3ccccc3O2)ccc1Br	747596705	QXXRHGZWAGJFRM-OAHLLOKOSA-N	443.275	1.607	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)NCCC(=O)NNc2cc(Cl)nc(C)n2)cc1	748335099	NFOXROFDRQKNPY-UHFFFAOYSA-N	426.886	1.209	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)C2(c3ccc(F)cc3)CCC2)CC1	749536558	QRJXWTIJWUZDPQ-UHFFFAOYSA-N	447.536	1.722	50	20	IDGD	
O=C(C[C@@H]1CSCCS1)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	751538725	MLVGZFFVSKKTTO-OAHLLOKOSA-N	443.616	1.861	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2c(C)nn(-c3ccccc3)c2C)n1	752855794	BBHLVTUQVKOPJV-UHFFFAOYSA-N	427.486	1.801	50	20	IDGD	
CC[C@H](NC(=O)NNC(=O)c1ccc(-n2c(C)ccc2C)cc1)C(=O)N1CCOCC1	753057177	LUFILZZXGNSDNR-IBGZPJMESA-N	427.505	1.676	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)N[C@H](CC)C(=O)N2CCOCC2)cc1OC	753057652	MZKRLEVNAQKLOT-MRXNPFEDSA-N	436.509	1.456	50	20	IDGD	
Nc1nc(Cl)cc(NNC(=O)[C@@H]2CCCN(S(=O)(=O)c3ccc(F)cc3)C2)n1	753457666	RPOSJEBDDRHAKQ-SNVBAGLBSA-N	428.877	1.395	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2cc([N+](=O)[O-])ccc2OC)c2ccccc2c1=O	755322838	VSSNPPCDSAKIGE-UHFFFAOYSA-N	426.389	1.800	50	20	IDGD	
COc1nc(Cl)c(C=NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)s1	755466392	AYQLDBGWTSOBDP-UHFFFAOYSA-N	444.922	1.590	50	20	IDGD	
COc1ccc(NNC(=O)CNC(=O)[C@@H]2CCCN2C(=O)OC(C)(C)C)c([N+](=O)[O-])c1	755514209	DQZNEIWNIJPUFF-AWEZNQCLSA-N	437.453	1.562	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)Nc1cc(Br)ccc1N1CCOCC1	756040144	WSWGFLYVGZKALT-LBPRGKRZSA-N	445.314	1.490	50	20	IDGD	
CN(C1CC1)S(=O)(=O)c1ccc(NC(=O)NNC(=O)CCc2ccccc2O)cc1	756402001	KQLKWHANRHMXLN-UHFFFAOYSA-N	432.502	1.961	50	20	IDGD	
O=C(NCCOc1cccc(C(F)(F)F)n1)NNC(=O)c1nnc(O)c2ccccc12	759622030	KNFPPYRKYOFUTQ-UHFFFAOYSA-N	436.350	1.772	50	20	IDGD	
O=C(NNc1ncc(F)cn1)c1ccc(NS(=O)(=O)c2ccc3nc(O)[nH]c3c2)cc1	760914414	CAOASTLSQAWIFL-UHFFFAOYSA-N	443.420	1.755	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCc2ccc(Cl)nc2)c1	761775279	SYJSREYBUAPDRL-UHFFFAOYSA-N	425.898	1.172	50	20	IDGD	
Cc1cccc(-n2c(NNC(=O)Cn3cc([C@H](C)O)nn3)nc3ccccc3c2=O)c1C	763047390	HYWHQDRYONHNHU-HNNXBMFYSA-N	433.472	1.791	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(C(=O)N2CCCC2)c(F)c1)[C@H]1COc2ccccc2O1	763417134	PIMYMYWTOANENX-GOSISDBHSA-N	449.460	1.211	50	20	IDGD	
O=C(NNC(=O)c1ccncc1)C(=O)Nc1ccc(I)cc1Cl	763462338	NFRWXHXSVHWCHH-UHFFFAOYSA-N	444.616	1.739	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccccc2Br)ccc1-n1cnnn1	763483159	NXCVUBXVDCFDMP-UHFFFAOYSA-N	444.249	1.133	50	20	IDGD	
CC(C)(C)c1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(-n3ccnn3)c2)cc1	763601291	XRHBXYAUQFJZPH-UHFFFAOYSA-N	436.472	1.730	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)ccc1Cl	763678156	DXDMYHZVBGWDSK-UHFFFAOYSA-N	430.804	1.163	50	20	IDGD	
CCOc1cc(C(=O)N(C)C)ccc1NC(=O)C(=O)NNC(=O)COc1ccccc1F	763678298	CHFRZIJZXUNHEM-UHFFFAOYSA-N	446.435	1.091	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNC(=O)c2nnc(O)c3ccccc23)cc1OCC	763791513	ULUYJGNLDLKWEO-UHFFFAOYSA-N	439.428	1.533	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)n(C)c(=O)n3C)c1C	763850596	OTOUGMCPZKOSDH-AWEZNQCLSA-N	439.472	1.047	50	20	IDGD	
Cc1nnc(-c2cccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc3ccccc3F)c2)o1	763864479	JSSMVGVEWPKGLQ-NSHDSACASA-N	427.392	1.738	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)c(F)cc1F	763871429	GREAIZFRMHZVMM-SECBINFHSA-N	439.346	1.444	50	20	IDGD	
COc1cc(F)c(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(C(C)=O)cc2)cc1F	763872571	OMBXTVOHOVFXRN-LLVKDONJSA-N	435.383	1.729	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(F)c(NC(C)=O)c2)cc1OC	763899700	AIFBJGBVXNKTIZ-UHFFFAOYSA-N	432.408	1.591	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(Cn3cncn3)c2)cc1OC	763912056	MHPJYBQONFTKQD-UHFFFAOYSA-N	438.444	1.133	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccccc1N1C[C@H](C)O[C@H](C)C1	764132881	RKWDFBLVJWJUJQ-IYBDPMFKSA-N	440.500	1.637	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccoc2)cc1NC(=O)CN1CCCCC1	764159328	ALNIPXARPRPFEC-UHFFFAOYSA-N	427.461	1.412	50	20	IDGD	
CCOCCOc1c(Cl)cccc1NC(=O)C(=O)NNC(=O)[C@H]1Cc2ccccc2O1	764165351	XJAKEHLYPKYCTA-QGZVFWFLSA-N	447.875	1.845	50	20	IDGD	
CS(=O)(=O)N1CCc2c(NC(=O)C(=O)NNC(=O)c3cc4ccccc4o3)cccc21	764343311	UDOJBDWOERLVBC-UHFFFAOYSA-N	442.453	1.155	50	20	IDGD	
CCOCCOCc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)c1	764350129	YNPVPRLXUMBNSG-UHFFFAOYSA-N	435.864	1.998	50	20	IDGD	
Cc1ccc(NC(=O)c2ccccc2)cc1NC(=O)C(=O)NNC(=O)Cc1ccncc1	764355480	BZVIHNLWEXNBDP-UHFFFAOYSA-N	431.452	1.971	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)C(=O)Nc1cnn(-c2cnc3ccccc3n2)c1	764367057	SUCAVVOVTIWIDG-UHFFFAOYSA-N	445.439	1.118	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2ccccc2-n2cncn2)n[nH]1	764376518	FCPWNLKGWHUXTA-UHFFFAOYSA-N	446.427	1.066	50	20	IDGD	
CCOC(=O)c1ccsc1NC(=O)C(=O)NNC(=O)CSc1ccccc1OC	764398096	OFPBZPSDGYHKFJ-UHFFFAOYSA-N	437.499	1.812	50	20	IDGD	
COc1ccc(NC(=O)NNc2nccnc2OC)cc1S(=O)(=O)N1CCCCC1	764592188	KAWDYMIIMZYDRA-UHFFFAOYSA-N	436.494	1.817	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCCOCC(F)(F)C(F)F)nc1	765648425	XSPHWUUELDVQPB-UHFFFAOYSA-N	431.412	1.311	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)NC[C@H]1CCCCN1C1CC1	765665294	ZZUXQGXMYGCQTD-OAQYLSRUSA-N	428.581	1.546	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1cc(F)c(F)cc1I	766260492	GKZGVWHMPKDNNN-UHFFFAOYSA-N	449.155	1.450	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1cccc2c1CCN(C(=O)OC(C)(C)C)C2	766260849	LGLSONGFFFVUJB-UHFFFAOYSA-N	442.476	1.860	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1cc(C(=O)N2C[C@H](C)C[C@@H](C)C2)ccc1C	766261028	OBQNCUZARPTWLV-ZIAGYGMSSA-N	440.504	1.994	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1ccc(-n2ncc3ccccc32)cc1Cl	766373680	IQSJFLHWPCCHHZ-CYBMUJFWSA-N	432.889	1.875	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)N[C@H]1CC(=O)N(c2ccc(Cl)c(F)c2)C1	766555320	YDJMEWXLSHCCIR-APPDUMDISA-N	448.838	1.755	50	20	IDGD	
CC[C@H](NC(=O)NNc1ccccc1S(C)(=O)=O)c1ccccc1OCC(=O)NC	766878390	CVRYBDRLCLEYCV-HNNXBMFYSA-N	434.518	1.992	50	20	IDGD	
O=C(NCc1nc(C2CC2)cs1)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	767149366	WSCZLEPKVMOKGP-UHFFFAOYSA-N	449.558	1.949	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3ccnn3C3CCCC3)cc2)CC1	767962720	PTFUOBJFKFXCAR-UHFFFAOYSA-N	432.550	1.691	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)CCc3c(C)nc4nc(N)nn4c3C)n[nH]2)cc1C	768255683	HTQJSNNJCIJOLU-UHFFFAOYSA-N	447.503	1.724	50	20	IDGD	
COc1ccc(NNC(=O)[C@H]2CCN(c3ccc4c(c3)OCCO4)C2=O)c([N+](=O)[O-])c1	768332325	WBXDEIDNKCGHEY-CQSZACIVSA-N	428.401	1.871	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)Nc2cccc(S(=O)(=O)N3CCCN(C)CC3)c2)n1	770022377	DOGIEUWYLJHSEO-UHFFFAOYSA-N	433.538	1.568	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@@H]2COc3cc(C)c(C)cc32)cc1	770213028	XAPIMJBEBQCCMI-GOSISDBHSA-N	431.514	1.556	50	20	IDGD	
CSCCNC(=S)NNC(=O)c1ccc2ncc(I)n2c1	770248691	RRAQVHWQOSDHSM-UHFFFAOYSA-N	435.316	1.411	50	20	IDGD	
COc1ccc(Cl)cc1N1C[C@@H](C(=O)NNC(=O)c2ccc3c(c2)OCCO3)CC1=O	770406075	GPQGPWLXVDJTBY-ZDUSSCGKSA-N	445.859	1.934	50	20	IDGD	
CCNC(=O)N(C)NC(=O)c1ccc(NS(=O)(=O)c2ccc3c(c2)OCCO3)cc1	770545044	WKCCNXBQAYYGPK-UHFFFAOYSA-N	434.474	1.565	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)N[C@@H]1CCCN(CC(F)(F)F)C1=O	770659361	RDODQYSTUBTRBC-GXFFZTMASA-N	436.818	1.991	50	20	IDGD	
COC(=O)CN1CCN(c2ccc(NC(=O)C(=O)NNc3c(C)cccc3F)cc2)CC1	770814877	DGGIOBHTCFGFCM-UHFFFAOYSA-N	443.479	1.511	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)c3csc(-c4ccc5c(c4)OCCO5)n3)nc21	770982381	HJNILDOAHVKHFA-UHFFFAOYSA-N	425.430	1.721	50	20	IDGD	
COCCCNC(=O)Cc1noc(CCC(=O)C(C#N)=C2N(C)c3ccccc3N2C)n1	771058551	PJRDGDXYWKUXMV-UHFFFAOYSA-N	438.488	1.588	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)O[C@H](C)C(=O)NNC(=O)CC(C)C)c1	771881841	KSTQMDIUCXSVIZ-CQSZACIVSA-N	427.523	1.456	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)c1ccc(F)c(S(=O)(=O)NC(C)C)c1	771991332	XYOQOTAIJGBZNB-LBPRGKRZSA-N	431.486	1.251	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1cnn(-c2ccc(Cl)nn2)c1C(F)(F)F	772030832	HGQFFYMAEFFJME-SSDOTTSWSA-N	434.762	1.437	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)CCNC(=O)Cc2ccccc2)C1	773411571	ODZKLGAHVVZDAG-KRWDZBQOSA-N	432.521	1.530	50	20	IDGD	
CS(=O)(=O)CCOc1cccc(NC(=O)C(=O)NNc2ccc(C(F)(F)F)cn2)c1	773669787	OLMYEXUGZWWDFE-UHFFFAOYSA-N	446.407	1.606	50	20	IDGD	
COc1ccc(S(=O)(=O)NC(C)(C)C)cc1NC(=O)C(=O)NNc1cccc(C#N)c1	773685013	CBOWHBXOMGQFTE-UHFFFAOYSA-N	445.501	1.725	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)c(Cl)n1	774009507	QKHMNAFNZBBZET-SECBINFHSA-N	427.244	1.950	50	20	IDGD	
CO[C@@H]1[C@@H](C)[C@H](NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)C1(C)C	776067647	UBHBRMLJSRREAR-RRQGHBQHSA-N	438.550	1.475	50	20	IDGD	
COc1ccc(C(=O)NNc2nc(Br)cn3ccnc23)cc1-n1cnnn1	776171814	WKPRTAXVIATOOF-UHFFFAOYSA-N	430.226	1.233	50	20	IDGD	
COC(=O)C1(c2ccc(S(=O)(=O)NNC(=O)c3c(C)nc4ccccn34)cc2)CC1	776271888	LELXALOFQLSKQS-UHFFFAOYSA-N	428.470	1.471	50	20	IDGD	
COc1ccc(NC(=O)NNc2cccc(S(C)(=O)=O)c2)cc1NS(C)(=O)=O	776473081	FPNZPHMUOSHLGB-UHFFFAOYSA-N	428.492	1.619	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)NCc2cccc(C(=O)N3CCOCC3)c2)c1	776619431	ZKZXMQGJFXYZJM-UHFFFAOYSA-N	432.502	1.389	50	20	IDGD	
NC(=O)[C@@H]1CC(C(=O)NNc2ccc([N+](=O)[O-])cc2Br)=NN1c1ccccc1	779141040	VPGGYIGWZUTEJC-HNNXBMFYSA-N	447.249	1.921	50	20	IDGD	
O=C(NNc1nc2ccccc2s1)C(=O)Nc1ccccc1C(=O)N1CCOCC1	782813945	GVXFTDXLLKATNV-UHFFFAOYSA-N	425.470	1.851	50	20	IDGD	
Cc1ccccc1-n1nccc1NC(=O)C(=O)NNC(=O)Cc1nc2ccccc2n1C	782887459	PMUPXALDTQVZMU-UHFFFAOYSA-N	431.456	1.396	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2cccc(S(=O)(=O)/N=C3\CCCN3C)c2)cc1	783037567	SAWAYARVAJFNRX-HKOYGPOVSA-N	445.501	1.590	50	20	IDGD	
COc1ccc(Cl)c(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)c1	783265760	XBKSMRANTXRSMC-UHFFFAOYSA-N	441.897	1.512	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)NC[C@@H]2COC(C)(C)O2)c2ccccc2c1=O	783267054	GKEDCHDKAMNNNK-CQSZACIVSA-N	431.493	1.682	50	20	IDGD	
COc1ncc(C)cc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1	783409796	WGOQLLVYZKIQJX-UHFFFAOYSA-N	432.380	1.774	50	20	IDGD	
Cc1ccnc(NNC(=O)C(=O)Nc2cccc(S(=O)(=O)/N=C3/CCCN3C)c2)c1	783931500	ROVJSDHPOADQQW-ULJHMMPZSA-N	430.490	1.285	50	20	IDGD	
Cn1nc(CC(C)(C)C)cc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	784212506	AYQZWEBPAOGVJU-UHFFFAOYSA-N	448.549	1.531	50	20	IDGD	
CN1CCC[C@H](N(C)C(=O)c2ccc(NC(=O)C(=O)NNc3cc(Cl)ccn3)cc2)C1	784861131	PYZJGESQOHHOGM-KRWDZBQOSA-N	444.923	1.983	50	20	IDGD	
Cc1cc(C(=O)N2CCC(C)CC2)ccc1NC(=O)C(=O)NNc1ccnc(N(C)C)n1	784968696	CWLUKYMGIVQOMA-UHFFFAOYSA-N	439.520	1.805	50	20	IDGD	
C#CCOc1cccc(NC(=O)C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)c1	785099648	JHMJOTSMUUIEKN-UHFFFAOYSA-N	428.395	1.951	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)CCOc1ccccc1I	785174772	SATHZILDHUWRCR-SNVBAGLBSA-N	434.230	1.549	50	20	IDGD	
NC(=O)[C@@H]1CC(C(=O)NNC(=O)NCc2ccc(Cl)cc2)=NN1c1ccc(F)cc1	787436023	ICBPQOCLKFKQBF-INIZCTEOSA-N	432.843	1.430	50	20	IDGD	
Cc1csc(C(=O)NNC(=O)CNC(=O)c2cccnc2)c1I	788001398	NVHYTDKEKMDAGF-UHFFFAOYSA-N	444.254	1.247	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(Cl)cc1)NNC(=O)c1cc(-c2ccccc2)on1	789901341	OMZQGWLTVGHPTJ-UHFFFAOYSA-N	434.861	1.735	50	20	IDGD	
O=C(NNc1nc2ccccn2n1)C(=O)Nc1cc(C(F)(F)F)ccc1N1CCOCC1	792387790	HBTXIBMABPHRIH-UHFFFAOYSA-N	449.393	1.667	50	20	IDGD	
C[C@]1(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)CCN(C(=O)OCc2ccccc2)C1	792821338	DQZZKZYEFRJIQO-QFIPXVFZSA-N	449.471	1.472	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)N1CCC[C@H](C=NNC(=O)c2ccc3c(c2)OCCO3)C1	794490359	PZNZXHGNKWLWAM-OAHLLOKOSA-N	446.504	1.937	50	20	IDGD	
N#Cc1ccc(C(=O)NNS(=O)(=O)c2cc(Br)c(F)cc2[N+](=O)[O-])cc1	795304525	IOZMJKXEARLFCD-UHFFFAOYSA-N	443.210	1.991	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)[C@@](C)(O)CSc1cccc(F)c1	796484316	UNDFTUMKFRCDRS-SFHVURJKSA-N	430.502	1.524	50	20	IDGD	
Cc1ccc(F)c(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)c1Br	797093667	SBLVRRCPYMDJAW-UHFFFAOYSA-N	448.252	1.873	50	20	IDGD	
CN(C)C(=O)c1ccc(S(=O)(=O)NNC(=O)c2cccc(Br)c2)cc1	799535564	VSMXLGVOWWKKNL-UHFFFAOYSA-N	426.292	1.774	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)C(=O)Nc1ccc(F)cc1OCCC(F)(F)F	800623780	WJDVTGCQPVWKFB-UHFFFAOYSA-N	428.342	1.881	50	20	IDGD	
COCCNS(=O)(=O)c1c[nH]c(C(=O)NNC(=O)Nc2ccc(C)cc2Cl)c1	802049757	HMAWBHVOVLWLQZ-UHFFFAOYSA-N	429.886	1.368	50	20	IDGD	
O=C(CN1C(=O)[C@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O)NNC(=O)Nc1ccc(Cl)cc1Cl	802087205	QBTILTGEPCEKDI-RFHZTLPTSA-N	427.244	1.309	50	20	IDGD	
CC[C@@H](C)NS(=O)(=O)c1ccc(C(=O)NNC(=O)Nc2ccc3c(c2)OCO3)cc1	802102891	FBROEBPSZBQNFX-GFCCVEGCSA-N	434.474	1.959	50	20	IDGD	
C[C@@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)NNC(=O)Nc2ccc3c(c2)OCO3)C1=O	802103436	SOTLQTIUXZOBPK-FQEVSTJZSA-N	443.391	1.174	50	20	IDGD	
COc1ccc(Cl)c(NC(=O)NNC(=O)c2ccc(S(=O)(=O)N(C)OC)cc2)c1	802114239	WBXBTMAHQZYTDV-UHFFFAOYSA-N	442.881	1.997	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)[C@H]1CS[C@]2(c3ccc(F)cc3)CCC(=O)N12	804954076	GOFJYYWAARCSJF-QRWLVFNGSA-N	439.476	1.835	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)c2cnc(C3OCCO3)s2)cc1	806375552	MDPKTJCYIDLKJJ-UHFFFAOYSA-N	446.514	1.684	50	20	IDGD	
Cc1ncsc1C(=O)NNC(=O)C(=O)Nc1cccc(F)c1Cn1cccc(C)c1=O	806978599	HEDHYTMCHDTOLP-UHFFFAOYSA-N	443.460	1.509	50	20	IDGD	
COc1ccc(CS(C)(=O)=O)cc1NC(=O)C(=O)NNc1cccc([N+](=O)[O-])c1C	807006393	XUXJLUXTBUPQJT-UHFFFAOYSA-N	436.446	1.538	50	20	IDGD	
O=C(NNC(=O)C(=O)Nc1ccccn1)N[C@@H](c1cncc(Br)c1)C1CC1	807252365	PDIBSVPIADLISH-CQSZACIVSA-N	433.266	1.659	50	20	IDGD	
CN1CCN(C(=O)NNC(=O)c2ccc(S(=O)(=O)Nc3ccccc3F)cc2)CC1	807381542	YIFUPTMTQDTNTR-UHFFFAOYSA-N	435.481	1.228	50	20	IDGD	
Cc1cc([N+](=O)[O-])ccc1NNC(=O)C(=O)Nc1ccc(N2CCNC(=O)C2)c(Cl)c1	807456730	GYZDBBMSVRMDSV-UHFFFAOYSA-N	446.851	1.575	50	20	IDGD	
CCCS(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1	808068493	ACFBNZJQQWTACC-QGZVFWFLSA-N	440.499	1.020	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)OCC(=O)Nc2ccc(S(C)(=O)=O)cc2)cc(C#N)n1C	809302772	KIKMEPXIDUPXCW-NVNXTCNLSA-N	426.454	1.698	50	20	IDGD	
CC(C)n1ncc2cc(C(=O)NNC(=O)c3ccc(Cl)c(S(N)(=O)=O)c3)cnc21	810468997	ZTHAOWHBAOJWHA-UHFFFAOYSA-N	436.881	1.388	50	20	IDGD	
COC[C@@]1(C(=O)OCC(=O)NNC(=O)c2ccc(C)cc2)CCN(C(=O)OC(C)(C)C)C1	811400757	SNCHSDYPYNLQAY-JOCHJYFZSA-N	449.504	1.573	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)c1ccc2c(c1)NC(=O)CNC2=O	814222387	JDZLEBDHFKCRHG-CYBMUJFWSA-N	432.436	1.750	50	20	IDGD	
C[C@@H](COC1CCCC1)CS(=O)(=O)N1CCN(S(=O)(=O)CBr)CC1	815032311	FIUKZWAOXVVHDI-ZDUSSCGKSA-N	447.417	1.211	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)[C@H](C)Cc2cnc3ccccc3n2)n1	815465953	PSNWABICUCGPLH-GFCCVEGCSA-N	427.486	1.507	50	20	IDGD	
CCOC(=O)c1cnn(-c2cccc(NC(=O)C(=O)NNc3ncncc3F)c2)c1C	815765870	GUONGHHMQRMWNX-UHFFFAOYSA-N	427.396	1.368	50	20	IDGD	
Cc1ccc(NNC(=O)[C@@H](CCS(C)(=O)=O)NS(=O)(=O)c2ccccc2)cc1	849512750	KATOCSUUHBSLAX-QGZVFWFLSA-N	425.532	1.220	50	20	IDGD	
COc1cccc(NCC(=O)NN=Cc2c(N3CCOCC3)nc3ccccn3c2=O)c1	874090867	HQXJRQVUFCMSQU-UHFFFAOYSA-N	436.472	1.102	50	20	IDGD	
Cc1ccc(NC(=O)CS[C@H](C)C(=O)NNC(=O)CCN2C[C@H](C)O[C@@H](C)C2)cc1	912920150	WCVMZUDXSMTXMS-YESZJQIVSA-N	436.578	1.702	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)c1	913423012	MSIVUNBXSGIYRN-UHFFFAOYSA-N	431.449	1.541	50	20	IDGD	
COc1cc(N2C[C@@H](C(=O)NNC(=O)Cc3ccc(F)cc3)CC2=O)cc(OC)c1OC	913471801	YVBZVJIRAAERBD-AWEZNQCLSA-N	445.447	1.595	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NCC#Cc2cccc(C(F)(F)F)c2)c2ccccc2c1=O	916247528	FMBCVNFSZXNEFJ-UHFFFAOYSA-N	443.385	1.948	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NN=Cc1ccccc1O)N(S(C)(=O)=O)CC2	916355055	JBACRRMDOQEUIH-QGZVFWFLSA-N	447.513	1.809	50	20	IDGD	
CC(=NNC(=O)CCN1CCCCCC1)c1ccc(S(=O)(=O)N2CCOCC2)cc1	916358647	XZWQYYONZBBBFM-UHFFFAOYSA-N	436.578	1.814	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NCc2ccc(CN3CCN(C)CC3)cc2)cc1	916387871	JJOXATNGILBOID-UHFFFAOYSA-N	441.532	1.352	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)N[C@@H]3C[C@H]4C[C@H]3[C@H]3CCC[C@H]34)nc2)CC1	916585148	QCFNSNLFOFCMEG-VINWQNLFSA-N	448.593	1.469	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCN(c2cccc([N+](=O)[O-])c2)CC1	917119644	QYXNJRNUKHKVAW-UHFFFAOYSA-N	447.879	1.840	50	20	IDGD	
CCNC(=O)COc1cccc(CNC(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)c1	918090516	GJNUPGBMGXHPOI-CQSZACIVSA-N	432.452	1.639	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)NCc1ccc(N2CCOCC2)c(F)c1	918217961	OQHVTBRKDSXUGD-UHFFFAOYSA-N	427.436	1.443	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2ccc([C@H](C)NC(C)=O)s2)cc1OC	918399642	ROGLWLMJYOONOE-JTQLQIEISA-N	427.504	1.586	50	20	IDGD	
O=C(NN=Cc1sc(N2CCOCC2)nc1-c1ccccc1)N[C@H]1CCS(=O)(=O)C1	920379984	DPBNEIIQGKBMIN-HNNXBMFYSA-N	449.558	1.467	50	20	IDGD	
CCCCN1C(=O)C[C@@H](C(=O)NNC(=O)CN2CCCC2=O)[C@H]1c1ccc(OC)cc1	920436258	ZRQXDEGRUQYBGG-DYESRHJHSA-N	430.505	1.155	50	20	IDGD	
N#Cc1ccc(NCC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)cc1	920804808	BEGVAMRIDGZSTO-UHFFFAOYSA-N	441.513	1.606	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)Nc2nc(CN3C[C@H](C)O[C@H](C)C3)cs2)cc1	920930243	BMQFMXIJHSFSIJ-OKILXGFUSA-N	449.533	1.993	50	20	IDGD	
CC(=O)N1C[C@@H]2CCC[C@@H](NC(=O)NNC(=O)Nc3ccc(S(C)(=O)=O)cc3)[C@H]2C1	1117497570	UQTSMIKDQWALFV-RRQGHBQHSA-N	437.522	1.073	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)c2cc3c(C(F)(F)F)cc(O)nc3o2)c2ccccc2c1=O	1317771726	MQZNEBGMXHDVTE-UHFFFAOYSA-N	447.329	1.874	50	20	IDGD	
COc1cc(-n2cnnn2)c(Cl)cc1C(=O)NNC(=O)c1cncn1-c1ccccc1	1319026582	YTXCRWITEILVPQ-UHFFFAOYSA-N	438.835	1.585	50	20	IDGD	
COCc1ccc(S(=O)(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1	1320602122	LFCBCIDIELHZLH-UHFFFAOYSA-N	427.523	1.790	50	20	IDGD	
Nc1cnnc(NNC(=O)N[C@H]2CCN(c3cccc(Br)c3)C2=O)c1Cl	1320869710	PRVPSCXELFEWDW-NSHDSACASA-N	440.689	1.906	50	20	IDGD	
CN(C)C(=O)Nc1ccc(CNC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1	1326835972	ODIXLGHSUXUYKY-UHFFFAOYSA-N	433.490	1.328	50	20	IDGD	
C[C@@H]1CN(Cc2csc(NC(=O)NNC(=O)c3n[nH]c4c3CCCC4)n2)C[C@@H](C)O1	1337767395	SBOGFTNDAQPAJH-VXGBXAGGSA-N	433.538	1.821	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1)C(=O)N1CCCC[C@@H]1C	1339212068	IOIZXLJKOHMOGL-GJZGRUSLSA-N	439.557	1.753	50	20	IDGD	
Cc1cc(NC(=O)CC(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](F)Cl)C3)no1	1778074093	PZEZBDIDFVKVNC-PZPSRYQVSA-N	430.864	1.360	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2)c1cccc2ncccc12	1778451992	QOHIIKYXADVQDO-WOIUINJBSA-N	431.920	1.962	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(CCN(C(=O)c3n[nH]c4ccc(F)cc34)C2)C1	1778622890	YQLRNEFBWMRFNC-SFHVURJKSA-N	439.285	1.931	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccn3nccc3c2)C1	1779166945	NFFLYLPDYKZVJL-WAOWUJCRSA-N	434.924	1.716	50	20	IDGD	
CC(=O)N[C@@H](C(=O)N1CCO[C@]2(CCN(C(=O)CO[Si](C)(C)C)C2)C1)C(C)(C)C	1779293950	HWWUOSCIOGUYSS-PXNSSMCTSA-N	427.618	1.219	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@]2(C1)CN(C(=O)Cc1cnc3ccccn13)CCO2	1779295096	XPQZQWJIKHOGBA-OAQYLSRUSA-N	430.581	1.558	50	20	IDGD	
Cn1ncc2cc(C(=O)N3CCO[C@@]4(CCN(C(=O)CO[Si](C)(C)C)C4)C3)ccc21	1779296859	IRJVOAUQKPPZNB-OAQYLSRUSA-N	430.581	1.868	50	20	IDGD	
Cc1nccc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](F)Br)C2)n1	1780773752	VUAJBMJMWIZEEA-CKEIUWERSA-N	429.290	1.603	50	20	IDGD	
CC[S@@](=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Br)C1	1780774727	JUHOIMFMAHOLCA-BBDQLSLDSA-N	441.363	1.350	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)CCN3C(=O)c4ccccc4C3=O)CCO2)C1	1781215662	UTUDDOIGXDSNMQ-HTAPYJJXSA-N	447.919	1.520	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccnc4c3OCO4)CCO2)C1	1781231192	HERJAJSPPQTAQO-ZWKOTPCHSA-N	430.288	1.490	50	20	IDGD	
CC(C)(C)c1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)[nH]n1	1781332361	XRTAHERTNRZMBF-CXAGYDPISA-N	431.306	1.841	50	20	IDGD	
O=C(Cn1cnc2ccccc21)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781332770	FACXMTMGTVRRIN-SJLPKXTDSA-N	439.285	1.557	50	20	IDGD	
COc1ccc(CC(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](F)Cl)CCO3)c([N+](=O)[O-])c1	1781412809	ODQCMRGLUXJGOV-SJLPKXTDSA-N	429.832	1.510	50	20	IDGD	
C/C=C(\C)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2	1783068076	VPHXREJNXMMCKC-OESVVIHISA-N	429.945	1.915	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)/C=C/c3ccc([N+](=O)[O-])o3)CCO2)C1	1783870681	FLRMBEIEBKPBOU-SPQWOLSXSA-N	427.841	1.285	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)Cc3ccc(C(=O)OC)cc3)CCO2)C1	1783879467	VFLFMPWYSOZRAY-DYESRHJHSA-N	438.908	1.099	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3c(F)ccc([N+](=O)[O-])c3C)CCO2)C1	1783881656	SODUYRRWCJZPOG-BFUOFWGJSA-N	443.859	1.740	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CCCN3Cc3ccccc3)C[C@@H]21)[C@H](O)CCl	1784096393	WDQVKPYXGVAXHA-FCMAGTKHSA-N	449.979	1.230	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnnc(Cl)c3)[C@H]2C1	1785452552	AJLYDBWBTTXOFE-PYERRIOISA-N	435.739	1.960	50	20	IDGD	
CCc1noc(C)c1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCBr)[C@H]2C1	1786406366	PPKHDGLFWMFQPP-YDHLFZDLSA-N	428.327	1.924	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cn3cc(Cl)cn3)[C@H]2C1	1787003888	RQRRSUOAMTUFOQ-BPUTZDHNSA-N	428.993	1.368	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnn4c(C)cc(C)nc34)[C@H]2C1	1787910160	SZLITKFTWPOVJZ-DKIMLUQUSA-N	433.940	1.957	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccn4ccnc4c3)[C@H]2C1	1788361228	AGUJILQXZBLBNQ-TUUVXOQKSA-N	435.322	1.711	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4c(c3)n(C)c(=O)n4C)C[C@@H]21	1789860016	RPPFODLHUKJMMI-FPXQBCRKSA-N	448.951	1.488	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)Cc3ccccc3)[C@H]2C1	1790957572	SNKKKVSYXBVSEO-QSGXVVIFSA-N	439.350	1.353	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(C)nc(O)c3)C[C@@H]21	1790960866	BUYCXBRTVDSSTA-TUUVXOQKSA-N	440.338	1.862	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)Br)C[C@@H]21	1790964430	PZKMYZKFNFWAFF-MOLYVOAJSA-N	440.176	1.923	50	20	IDGD	
CC(C)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)cc([N+](=O)[O-])c1)C2	1792784508	HOWOZFMOLCEJIO-YWVIFJGQSA-N	425.869	1.769	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CCc2ccoc2C1	1793124007	NTSDFNOXNUQOGL-NOSJPKONSA-N	425.323	1.758	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CCN1C(=O)OC(C)(C)C	1793630884	XNMHZRXCOOFITM-NNXHMXCWSA-N	443.972	1.993	50	20	IDGD	
O=C1CN(c2cccc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)[C@H](F)Cl)C4)n2)CCCN1	1794841066	SLBOGEHVUGLTCH-AHXJXLJNSA-N	437.903	1.194	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CCC[C@@H]2CCCC[C@@H]21	1797266119	REOPKSMCSHLAJO-FQOWZCASSA-N	448.608	1.556	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(F)cnc1Cl	1798730078	LUZXFQKNCJXWAG-BTTYYORXSA-N	425.892	1.499	50	20	IDGD	
CO[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Br)c1ccccc1	1799346108	CEILKHPMWGLFQQ-XFIYOXNOSA-N	429.286	1.654	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccn3ccnc13)C2)[C@H](F)Br	1799349869	MOXJMNMKZJSBIH-XCCSTKFXSA-N	425.258	1.228	50	20	IDGD	
C[C@H](Oc1ccccn1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Br)C2	1801369160	MGOQLSQMXZIDNZ-YMSVYLFOSA-N	426.311	1.222	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1c(C)nn(C)c1C	1801380153	DNTZZKNHLHPOAD-KPEUIFRASA-N	441.370	1.343	50	20	IDGD	
C[C@@H](CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc(B(O)O)c1)C2)Oc1ccccc1	1801449557	MWKZRIIUSWKXFK-DVWBAYGPSA-N	436.317	1.476	50	20	IDGD	
CCOC(=O)c1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CCC(=O)NN(C)C)cc1	1802338871	YEOQQTFVLXVJDA-REPLKXPHSA-N	444.532	1.488	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C=C/c1ccccc1[N+](=O)[O-])C2	1802344347	XHLNXAAZWUTCGO-YXACMKRGSA-N	443.504	1.619	50	20	IDGD	
CC(C)(CCl)C(=O)NC[C@@H]1CCN(C(=O)c2nccnc2C(N)=O)[C@H]1c1cccnc1	1802905037	WXOJPIVKHPDKEV-YOEHRIQHSA-N	444.923	1.555	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc(CO)c(F)c2)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803146787	CZAWOSYBJATMAH-ZYSHUDEJSA-N	435.883	1.632	50	20	IDGD	
Cn1ccc(C(=O)NC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)c1	1805287594	BEFLYOWHDZCZNN-JXFKEZNVSA-N	447.499	1.052	50	20	IDGD	
O=C([C@H]1CCc2nc(O)nc(O)c2C1)N1CCCC2(CCN(C(=O)[C@H](F)Cl)CC2)C1	1807088342	HFVWTMQOWSATAQ-WFASDCNBSA-N	440.903	1.758	50	20	IDGD	
CC(C)[C@H](S)C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1807359093	DTGPEUWTPZBIRK-HOJAQTOUSA-N	441.362	1.035	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CCc2ccco2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1	1807369853	XGKJAHVNTUIVCB-WMZHIEFXSA-N	447.300	1.307	50	20	IDGD	
CC1=C(C(=O)NC[C@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)CCO1	1807766589	ZCXDDRPKNQNARQ-DYESRHJHSA-N	429.521	1.155	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1	1807998168	IZYXZOVVAJUSMA-XUWXXGDYSA-N	434.880	1.461	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2cc(F)cn2C)[C@@H]1c1cccnc1	1808872573	QCVAZFAVJHIBMV-KKSFZXQISA-N	444.511	1.252	50	20	IDGD	
O=C(c1ccc(-n2cnnc2)cc1)N1CCCC2(CCN(C(=O)[C@H](O)CCl)CC2)C1	1809624101	RZSSMMODCBRNOW-GOSISDBHSA-N	431.924	1.712	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2ccccc2F)[C@@H]1c1cccnc1	1811679931	AHBPUMFEZBQPDN-JTSKRJEESA-N	441.507	1.913	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)[C@@H](C)n2ccnn2)[C@H]1c1cccnc1	1812400180	YLZVXZHNDLRJBV-SJXGUFTOSA-N	435.326	1.724	50	20	IDGD	
CC(=O)C[C@H](C)C(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1813011094	FUYWWLUSVVQZLU-KLHJMIIUSA-N	431.537	1.076	50	20	IDGD	
COCCn1nccc1C(=O)N1CC[C@H](CNC(=O)[C@@H](Cl)COC)[C@@H]1c1cccnc1	1813031443	VHPYWVCDGZKGSY-AOIWGVFYSA-N	449.939	1.498	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)CC2CCC2)[C@H]1c1cccnc1	1814118272	MNCBVGGNAKTVJG-LAUBAEHRSA-N	436.516	1.590	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)CCN3CCOCC3)sc2C1	1814648132	BNANDBVUDOHRPY-OLZOCXBDSA-N	430.958	1.031	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)CCc3cccnc3)sc2C1	1815733310	LJORAUJOFNGEGN-OAHLLOKOSA-N	444.561	1.456	50	20	IDGD	
O=C(CCBr)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1816782426	OHGZLLNTONOOFX-HNNXBMFYSA-N	449.114	1.180	50	20	IDGD	
CC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)sc2C1	1817277180	LZYBJZGKIPTOHE-XIXVAHAYSA-N	444.517	1.558	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@H]2CCC(F)(F)C2)[nH]n1)c1ccc(B(O)O)cc1	1817470821	ZDIAMWGYBNFKNV-YOEHRIQHSA-N	446.263	1.831	50	20	IDGD	
O=C(Cn1ccccc1=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](F)Br)[nH]n1	1817520338	PLPVAMIIVMNDTE-MLGOLLRUSA-N	440.273	1.954	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)c3ncccc3F)sc2C1	1820925552	AQYIBKSNQLGJCK-LLVKDONJSA-N	434.497	1.276	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)Cc2cscn2)[nH]n1	1822413902	GHPOLYUYZIJPJL-HNNXBMFYSA-N	433.538	1.474	50	20	IDGD	
Cc1ncncc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1	1822414982	PVQFEMAIRLNGJK-MRXNPFEDSA-N	428.497	1.187	50	20	IDGD	
CN1C(=O)CC[C@H]1C(=O)N[C@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1	1823007549	PQYOQUMIFJRMBJ-DXBFQKDVSA-N	433.303	1.366	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnc(N(C)C)o2)CC1	1825756966	MLZBEQKKJHOQHP-QGZVFWFLSA-N	448.568	1.347	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)Cc1ccc(F)cn1)CC2	1826085170	IJXUEESXIDPXHN-CQSZACIVSA-N	448.524	1.205	50	20	IDGD	
C#CCCCCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(B(O)O)cc1)CC2	1826420573	JIURMLRGKRZGBP-INIZCTEOSA-N	425.319	1.242	50	20	IDGD	
CC(C)[C@H](S)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827050004	DGRMZELHKBDHFP-PMACEKPBSA-N	432.395	1.554	50	20	IDGD	
O=C(CCN1CCCC1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827055183	RJIUSQXXOJWCRK-QFIPXVFZSA-N	441.381	1.086	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(Cl)cnc3O)CCO2)C1	1829557879	SXJLXNBZMQDJKG-DNVCBOLYSA-N	446.331	1.918	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CN2CCN(C(C)=O)CC2)CC1	1830308652	UCTNIYFKYFZDCT-PMACEKPBSA-N	441.016	1.788	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3cccc(C#N)c3)CCO2)C1	1830462335	BSYWTTGFTJQTSM-DENIHFKCSA-N	449.935	1.201	50	20	IDGD	
CC(=O)C(C)(C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)CBr)C2)C1	1831117201	RLHPJVFAKNMHAT-SCLBCKFNSA-N	433.343	1.089	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc(OC)c(F)c3)C2)C1	1831644219	RNXCNPVJWYLWLZ-QRWLVFNGSA-N	443.903	1.707	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(=O)n2O)CC1	1831829087	XYFMVTZJFHFFAI-JKSUJKDBSA-N	425.913	1.573	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCN2CCOC2=O)CC1	1831831424	XXLKFVMKWBCZRL-IAGOWNOFSA-N	429.945	1.702	50	20	IDGD	
C[C@@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)c3cc(O)no3)CC2)CC1	1833263009	GCSLDFGRCGAROS-LBPRGKRZSA-N	443.342	1.596	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3ccc4occc4c3O)CC2)CC1)[C@@H](O)CCl	1833312031	IVPGZKLBMPIOJZ-SFHVURJKSA-N	449.935	1.923	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(C)c(C)n3)CCO2)C1	1833694937	FDPMNXAHABQHPX-OXQOHEQNSA-N	425.913	1.022	50	20	IDGD	
COC(=O)CCC(=O)NC1CCN(C2CCN(C(=O)CO[Si](C)(C)C)CC2)CC1	1834434113	VWIBDUIZZFDVQQ-UHFFFAOYSA-N	427.618	1.363	50	20	IDGD	
CCC(=O)N[C@@H](C)C(=O)N1CCC(N2CCC(NC(=O)CO[Si](C)(C)C)CC2)CC1	1835834690	FDKOTOJKBNQQNU-INIZCTEOSA-N	440.661	1.324	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(C=O)s3)CCO2)C1	1835947703	OSZCMRSAZLDBKS-PXAZEXFGSA-N	445.335	1.414	50	20	IDGD	
O=C(c1cc(C2CC2)on1)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836585322	IRFWIQAITCPDPK-KRWDZBQOSA-N	425.913	1.764	50	20	IDGD	
C[C@@H](Nc1cccnc1)C(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836716555	BLPGNPQKTVDXKO-DNVCBOLYSA-N	438.956	1.480	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)N1CCC(OC2CCN(C(=O)CCBr)CC2)CC1	1837653486	GBWMGYJWYCODRQ-CQSZACIVSA-N	446.386	1.637	50	20	IDGD	
O=C(/C=C/c1cccnc1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839197933	NEKNDNGVZXPUOF-NDIJEHHESA-N	442.285	1.242	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccnc(Cl)c3)C2)C1	1840030967	BKTCYWVEOQXYJS-SJKOYZFVSA-N	446.729	1.588	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(F)ccc3F)C2)C1	1840154357	VEANBQRPOATYEY-BEFAXECRSA-N	432.851	1.289	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(C)cc3O)CCO2)C1	1840669771	OQVZSZYOYTVEBZ-OXJNMPFZSA-N	426.897	1.024	50	20	IDGD	
COc1cc(C(=O)N2CC3(CCCN3C(=O)[C@H](O)CCl)C2)cc([N+](=O)[O-])c1OC	1841353298	OWUGMGMOOWAKHU-CYBMUJFWSA-N	427.841	1.029	50	20	IDGD	
COc1ccc(CC(=O)N2CCCC23CN(C(=O)[C@@H](O)CCl)C3)c(Br)c1	1841376088	PBHPOYGJPXLKDM-HNNXBMFYSA-N	445.741	1.803	50	20	IDGD	
O=C1CC[C@H](C(=O)N2CCCC23CN(C(=O)[C@H](Br)Cc2ccccc2)C3)N1	1842798323	JZRQPOLDTUEYOS-HZPDHXFCSA-N	434.334	1.475	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC2(CCCN2C(=O)c2cccc3c2NC(=O)C3=O)C1	1844125696	NVYXQAUJTYXUBJ-LLVKDONJSA-N	434.290	1.669	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1cccc3cccnc13)C2	1844264258	ZIZIJRQCAGLLCE-UHFFFAOYSA-N	430.468	1.364	50	20	IDGD	
C[C@@H](NC=O)C(=O)N1CCCC12CN(C(=O)/C(C#N)=C/c1ccc(Br)cc1)C2	1845180622	MXHGKYKWSLSUDO-BRYYZUPOSA-N	445.317	1.694	50	20	IDGD	
CC(=O)N[C@H](C(=O)N1CC2(CCCN2C(=O)[C@@H](F)Br)C1)c1ccc(F)cc1	1845218918	KHGIKLJODGKFNJ-LSDHHAIUSA-N	444.276	1.897	50	20	IDGD	
C=CCNC(=O)/C=C\C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)/C(C#N)=C/c1ccc(F)cc1F	1847262623	ZBQCDCWVAAEBPD-DINMJNSOSA-N	440.450	1.932	50	20	IDGD	
COc1ccc(-c2n[nH]cc2C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1	11593889	LJQNBCFSJLLQOE-UHFFFAOYSA-N	443.485	1.410	50	20	IDGD	
COC(=O)CCCNC(=S)NNC(=O)Cc1nn2c(C3CCCCC3)nnc2s1	18141360	QPPWDRNAFHONRJ-UHFFFAOYSA-N	439.567	1.225	50	20	IDGD	
Cc1ccc(-n2cnnc2SCC(=O)NNC(=O)c2n[nH]c(=O)c3ccccc23)cc1C	22886132	LPDQSEIBVVMFCV-UHFFFAOYSA-N	449.496	1.674	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)CCNC(=O)c2ccco2)cc1	26752125	LRIZWCUSDVLIDU-UHFFFAOYSA-N	428.474	1.282	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)CN2C(=O)N[C@@](C)(c3ccc(F)cc3)C2=O)c1	26900666	OIHQKKAAGWIJRQ-NRFANRHFSA-N	444.419	1.071	50	20	IDGD	
O=C(NNC(=O)c1c[nH]nc1-c1ccccc1)c1cccc(S(=O)(=O)N2CCCC2)c1	29001267	WRZLXRUVCPWHKJ-UHFFFAOYSA-N	439.497	1.936	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1	36833902	JCBXPUCVBNSUCF-UHFFFAOYSA-N	446.573	1.919	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2cccc(C(=O)NNC(=O)c3cc(C)oc3C)n2)c(C)o1	59019006	PAMQJDSHPBZBMA-UHFFFAOYSA-N	439.428	1.651	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCN(c3ncc(Cl)cc3Cl)CC2)n1	108125924	PJLXQRNZSKLNMF-UHFFFAOYSA-N	443.360	1.665	50	20	IDGD	
O=C(NCc1cccc(C(F)(F)F)c1)NNC(=O)[C@H]1CC[C@@H](C(F)(F)F)NC1=O	195718466	LWVYBUBEYQZMAT-QWRGUYRKSA-N	426.317	1.993	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)N1CCC[C@@H]1c1cccc2c1OCCO2	727479491	LQHJTZGMZUCCNP-CQSZACIVSA-N	430.486	1.827	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCOc2ccccc21)c1cccc(S(=O)(=O)N2CCCC2)c1	728177088	SZZQFXJUNJZELQ-SFHVURJKSA-N	429.498	1.798	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCOc2ccccc21)c1ccc(S(=O)(=O)N2CCCC2)cc1	728187429	IPDWAMKUAXFDSW-GOSISDBHSA-N	429.498	1.798	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3cc4cc(F)ccc4[nH]3)cc2)CC1	728214946	VJLQABCZFMXPEN-UHFFFAOYSA-N	431.493	2.000	50	20	IDGD	
COC(=O)Nc1ccc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1	728322968	IOIWSMBAYLEIID-MRXNPFEDSA-N	429.385	1.009	50	20	IDGD	
CCOC(=O)c1ccc(-n2c(C)cc(C=NNC(=O)[C@@H](C)NS(C)(=O)=O)c2C)cc1	728436053	KGCYGMSZEWGWAX-CQSZACIVSA-N	434.518	1.659	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2cccc(OC(F)F)c2)cc1	728610532	ZPPSTDBBXLYMQM-UHFFFAOYSA-N	441.412	1.230	50	20	IDGD	
CCC1(CC)NC(=O)N(CC(=O)NNC(=O)c2ccc(Br)cc2Cl)C1=O	728832790	RTLLEHRFDKJSNG-UHFFFAOYSA-N	445.701	1.974	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)[C@@H]1CCCN1C(=O)c1ccc2c(c1)OCO2	729451972	MCXYWTIHMRVVND-SFHVURJKSA-N	434.452	1.822	50	20	IDGD	
CCN1CCC[C@@H]1CN1C[C@H](C(=O)NNC(=O)COc2cc(C)ccc2C(C)C)CC1=O	729627435	LFDJWRWBUBOUQT-RTBURBONSA-N	444.576	1.977	50	20	IDGD	
CO[C@](C)(C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)c1ccccc1	730205675	PALHFXYDSDZNBO-NRFANRHFSA-N	431.514	1.794	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CN2CCN(CC(=O)N3CCCc4ccccc43)CC2)cc1	731355480	BBZIMAPBMYVXHE-UHFFFAOYSA-N	449.555	1.353	50	20	IDGD	
O=C(CN(Cc1ccco1)c1cccc(Cl)c1)NNC(=O)[C@H]1CCS(=O)(=O)C1	731964549	LTEJVCXVFRJBBI-ZDUSSCGKSA-N	425.894	1.522	50	20	IDGD	
CSCC[C@H](C(=O)NNc1nc(-c2ccncc2)no1)N1C(=O)[C@@H]2CCCC[C@H]2C1=O	732065418	FNCYIEPXNLDYCM-RBSFLKMASA-N	444.517	1.872	50	20	IDGD	
CNC(=O)C1CCC(NC(=O)NNC(=O)c2ccc(OC)c(Br)c2)CC1	732243300	NQURTHXJLKVPCR-UHFFFAOYSA-N	427.299	1.707	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)c2cc(C)nc3ccccc23)cc1C(=O)N(C)C	734414109	AFNURQJTEDWTAS-UHFFFAOYSA-N	442.497	1.877	50	20	IDGD	
COc1ccc(S(=O)(=O)C[C@H](C)C(=O)NNC(=O)c2cc(OC)cc(OC)c2)cc1	734989950	IURLMHNPZKXWTP-ZDUSSCGKSA-N	436.486	1.583	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)NCCNS(=O)(=O)c1ccccc1[N+](=O)[O-])c1ccccc1	735190831	QFSWDJRBKMFDAN-OAHLLOKOSA-N	449.489	1.397	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCN(c2ccc(C(N)=O)cc2)CC1	735495441	VOFASQWPTPYUOO-UHFFFAOYSA-N	445.907	1.031	50	20	IDGD	
Cc1nc(C)c(C=NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)s1	736428736	LTEJBJKKSKTABP-UHFFFAOYSA-N	436.559	1.864	50	20	IDGD	
O=C(CC[C@@H]1NC(=O)N(c2ccc(Cl)cc2)C1=O)NNC(=O)COCc1ccccc1	737629418	QJEGGIFLUCQHSR-KRWDZBQOSA-N	444.875	1.909	50	20	IDGD	
C[C@H](NS(=O)(=O)c1cccs1)C(=O)NNC(=O)c1cccc(Br)c1	742773034	KNEOMNLZHODQPE-VIFPVBQESA-N	432.321	1.639	50	20	IDGD	
CCS(=O)(=O)NCc1ccc(C(=O)NNC(=O)c2cc(-c3ccc(C)cc3)[nH]n2)cc1	743310138	YLJMQRLZJXPNQP-UHFFFAOYSA-N	441.513	1.899	50	20	IDGD	
CC(C)(C(=O)NNC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)c1ccccc1	743599027	BHBRDGOECBFBAF-UHFFFAOYSA-N	433.490	1.435	50	20	IDGD	
COc1cc(C#N)ccc1OCCCC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	743829400	OPMUIMNBYQTKLF-UHFFFAOYSA-N	446.485	1.982	50	20	IDGD	
CC(C)[C@@H](CNC(=O)NNC(=O)Nc1ccc(OC(F)F)cc1)N1CCN(C)CC1	745431597	DUNPFSCRWSZACH-MRXNPFEDSA-N	428.484	1.896	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)N[C@H]3CCN(c4cc(C)nn4C)C3=O)n[nH]2)cc1	745905927	OMICHEPXFVPLSH-HNNXBMFYSA-N	436.476	1.177	50	20	IDGD	
CCc1ccccc1OCC(=O)NNS(=O)(=O)c1ccc(OCC(=O)O)c(Cl)c1	748690710	ZTPVWXIMEDYNLH-UHFFFAOYSA-N	442.877	1.754	50	20	IDGD	
CCCC(O)(CCC)CC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	749176075	PEMISAFPKMZNSG-UHFFFAOYSA-N	425.551	1.954	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)NCC(=O)N2CCN(c3ccccc3)CC2)cc1	749215840	SWBLOIOEHROIPV-UHFFFAOYSA-N	439.516	1.307	50	20	IDGD	
O=C(CCc1ccccc1)NNC(=O)CN1C(=O)COc2cc(Br)ccc21	749800774	MUYDRUPNULLNJV-UHFFFAOYSA-N	432.274	1.955	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)N2CCN(c3cnn(C)c3)C(=O)C2)c(C)n1C[C@H]1CCCO1	750072690	RPGPCWACFJWQIN-BYHQVZLYSA-N	436.516	1.800	50	20	IDGD	
Cc1ccc(-n2cnnc2SCC(=O)NNC(=O)CNC(=O)c2ccco2)cc1Cl	751202750	WLNJNDWNBCASPX-UHFFFAOYSA-N	448.892	1.492	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)NCCNS(=O)(=O)c2ccc(Cl)s2)c1	752126210	FYWZDHUTFIOVSH-UHFFFAOYSA-N	446.938	1.398	50	20	IDGD	
CSCCNC(=S)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	752730976	RGMQJRWZFZJQBA-UHFFFAOYSA-N	427.555	1.917	50	20	IDGD	
COc1cccc([C@@H](C)CC(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)c1	753340372	PAANNACTKNAQCU-INIZCTEOSA-N	447.561	1.663	50	20	IDGD	
Cc1noc(C2CCC(NC(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)CC2)n1	753361724	XERUCDCWMGQUDN-UHFFFAOYSA-N	425.449	1.295	50	20	IDGD	
Cn1nc(SCC(=O)NN=Cc2cc(C(F)(F)F)ccc2Cl)c(=O)n(C)c1=O	753695040	LKZJLSADIUKMJH-UHFFFAOYSA-N	435.815	1.394	50	20	IDGD	
COCCN(C)S(=O)(=O)[C@@H]1CCCN(C(=O)NNC(=O)c2cccc3ccccc23)C1	755260379	PLAXLVJUBBVKNZ-QGZVFWFLSA-N	448.545	1.567	50	20	IDGD	
CN(C)c1ccc(S(=O)(=O)N(C)C)cc1NC(=O)NNC(=O)CCc1ccccc1	755535580	XEJBDDJXKQZRFF-UHFFFAOYSA-N	433.534	1.788	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)Nc1ccccc1C(=O)N1CCN(C)CC1	755623000	MWCVMNMBWFONLT-UHFFFAOYSA-N	441.488	1.315	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)Nc3cnc4c(c3)c(=O)n(C)c(=O)n4C)cc2C1	755847114	QMLDRNLPYZDYOG-JTQLQIEISA-N	442.501	1.285	50	20	IDGD	
COc1cc(C)ccc1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	756180881	KEMSBYWJOMMZSX-UHFFFAOYSA-N	448.501	1.491	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)Nc1ccc(N2CCOCC2)c(F)c1	756335199	ARCTWAIJJXFRLO-UHFFFAOYSA-N	426.408	1.778	50	20	IDGD	
Cn1c(C(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)cccc1=O	756872889	MARXEQFYYCNGGG-UHFFFAOYSA-N	432.483	1.322	50	20	IDGD	
Cc1cc(CNC(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)ncn1	757662801	HCMIXWUJOGBFKN-UHFFFAOYSA-N	443.471	1.631	50	20	IDGD	
CC(C)Oc1ccc(Br)cc1NC(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1	757739642	OUGOCSGKPDAGTJ-SNVBAGLBSA-N	434.312	1.824	50	20	IDGD	
COc1cc(C)ccc1CNC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	757746248	OFCGOLFFTUBEHG-UHFFFAOYSA-N	446.529	1.932	50	20	IDGD	
C[C@@H]1C[C@@H](NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)CN1Cc1ccccc1	757762103	JMSYPDHJVNIXKU-NVXWUHKLSA-N	434.500	1.541	50	20	IDGD	
CC(=O)N1CC[C@H](NC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])c2ccccc21	757793639	JPRSGOPRSMDPTB-HNNXBMFYSA-N	427.417	1.802	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)COc2ccccc2F)cc1S(=O)(=O)NC1CC1	757866276	OGMHCDYSMIZVQX-UHFFFAOYSA-N	436.465	1.807	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](CCC(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)C1	758717284	SVLVLRPMRYYQRD-INIZCTEOSA-N	444.488	1.900	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)NC[C@H]2CC(=O)N(Cc3ccccc3)C2)c1	758980934	QKTIPWPMOBYWCM-MRXNPFEDSA-N	426.473	1.697	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NC[C@H](C[C@@H](C)O)c1ccccc1	759611703	OWQGSOBZDIDHOA-PBHICJAKSA-N	447.561	1.787	50	20	IDGD	
NC(=O)[C@@H]1CC[C@@H](CNC(=O)C(=O)Nc2ccccc2S[C@H](Cl)C(F)(F)F)O1	760120690	JTLKQZXIYWRGOX-KPCOEVGBSA-N	439.843	1.994	50	20	IDGD	
C[C@@H](CC(=O)NNC(=O)c1cc2ccccc2o1)NS(=O)(=O)c1cccnc1Cl	760707185	PMBOUHKNVHWTNK-NSHDSACASA-N	436.877	1.999	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NC3CCC(F)(F)CC3)nc2)CC1	761775773	IELAMVDPKWTTEE-UHFFFAOYSA-N	432.497	1.222	50	20	IDGD	
CN(C)CCOc1cc(CNC(=O)NNC(=O)c2cccc(Br)c2)ccn1	762588632	JTKYFJCSNULXBI-UHFFFAOYSA-N	436.310	1.929	50	20	IDGD	
Cc1cc(C(=O)NC(C)C)ccc1NC(=O)C(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	763472533	WSRHDPDCSAPNSD-UHFFFAOYSA-N	427.417	1.441	50	20	IDGD	
COc1ncncc1NC(=O)C(=O)NNC(=O)CCCOc1ccc(Cl)cc1Cl	763502871	ZNNYYZFYPKJPID-UHFFFAOYSA-N	442.259	1.737	50	20	IDGD	
CCCCN(C)S(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2O)cc1	763528212	NINCTZLVSKBJNI-UHFFFAOYSA-N	448.501	1.213	50	20	IDGD	
CN(C)c1ccccc1NC(=O)C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	763530305	HNERYGGOSIHYFL-UHFFFAOYSA-N	438.532	1.051	50	20	IDGD	
CCN(CC)C(=O)c1ccccc1NC(=O)C(=O)NNC(=O)c1ccc2c(c1)OCO2	763547458	BWLOTPKBOYZZSF-UHFFFAOYSA-N	426.429	1.297	50	20	IDGD	
COC(=O)N(C)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(OC)cc2)cc1	763661232	MCYLMRKGWJUCAK-UHFFFAOYSA-N	430.417	1.063	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(-c3nnc(C)n3C)c2)cc1C	763668120	YTGMYWJEZQQLPD-UHFFFAOYSA-N	436.472	1.572	50	20	IDGD	
Cc1nccn1-c1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)cn1	763686433	MAQJXBDAEQCKKE-UHFFFAOYSA-N	428.836	1.394	50	20	IDGD	
CS(=O)(=O)Cc1ccccc1NC(=O)C(=O)NNC(=O)C12CC3CC(CC(C3)C1)C2	763726930	BTILJGUOUPWMTL-UHFFFAOYSA-N	433.530	1.534	50	20	IDGD	
Cc1c(CS(C)(=O)=O)cccc1NC(=O)C(=O)NNC(=O)c1cc2c(s1)CCC2	763785166	KZSHIJQTYWHPFD-UHFFFAOYSA-N	435.527	1.490	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)C(=O)Nc1ccc(Br)c(F)c1	763790818	OTPDWQFYADQITF-UHFFFAOYSA-N	448.208	1.637	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)ccc1Br	763814443	UREIGDTYTPAMAM-UHFFFAOYSA-N	431.246	1.794	50	20	IDGD	
COC(=O)c1cc2cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc3ccccc3F)ccc2o1	763848586	DFOGJKCSZAQSDD-LLVKDONJSA-N	443.387	1.912	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)ccc1C(=O)N(C)C	763852558	YJVRZKDZYNLUFY-ZDUSSCGKSA-N	430.436	1.389	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)C2=C(C)N(C)c3ncnn3[C@@H]2C)c2ccccc2c1=O	763928857	RZIFBEXVPURDBL-CYBMUJFWSA-N	436.476	1.144	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc1OC(F)F	763944510	MKITVIYDUVISAJ-UHFFFAOYSA-N	445.382	1.887	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)C(=O)Nc1cccc(N2CCCNC2=O)c1	763994962	KLEMUGLBEZJPKE-UHFFFAOYSA-N	449.265	1.097	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccc(N2C[C@H](C)O[C@@H](C)C2)nc1	764136841	UTKYDAYWDGCBPM-GJZGRUSLSA-N	441.488	1.032	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2O1)C(=O)Nc1cc(N2CCCC2=O)ccc1Cl	764151164	GMDRFXVSZIGFBI-QGZVFWFLSA-N	442.859	1.556	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1)c1ccc(F)cc1	764245654	HWKRIESPHSXTFX-FQEVSTJZSA-N	426.492	1.925	50	20	IDGD	
CCOC(=O)c1cc(C(C)(C)C)sc1NC(=O)C(=O)NNC(=O)Cc1ccccn1	764267306	SDTZEBQBMKFWOK-UHFFFAOYSA-N	432.502	1.946	50	20	IDGD	
CCCCNc1ccccc1C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	764281683	ISJGUOHHLXMTJM-UHFFFAOYSA-N	446.577	1.987	50	20	IDGD	
CC(C)n1nnnc1-c1ccccc1NC(=O)C(=O)NNC(=O)CCc1ccccc1O	764289898	ZHLZQXXRIQSDMV-UHFFFAOYSA-N	437.460	1.345	50	20	IDGD	
CCOCC(=O)NNC(=O)C(=O)Nc1ccc(NC(=O)c2ccoc2)cc1C(F)(F)F	764316595	BGAHCAVOUNYLPS-UHFFFAOYSA-N	442.350	1.673	50	20	IDGD	
C[C@@H](NC(=O)OC(C)(C)C)c1ccc(NC(=O)C(=O)NNC(=O)Cc2ccncc2)cc1	764353923	MVGVWCARVPYFON-CQSZACIVSA-N	441.488	1.996	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)C(=O)Nc1ccc(CN2CCc3ccccc32)cc1	764353961	NRRUYFRNBUYLBG-UHFFFAOYSA-N	429.480	1.973	50	20	IDGD	
CC(=O)N(Cc1ccc(NC(=O)C(=O)NNC(=O)COCc2ccccc2)cc1)C(C)C	764368080	VBSDIBOJLGIODF-UHFFFAOYSA-N	440.500	1.746	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)C(=O)Nc1cc2c(cc1F)CCC(=O)N2	764403761	AMIRPSATRTXUKI-UHFFFAOYSA-N	432.433	1.294	50	20	IDGD	
Cn1cc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2F)cc(Br)c1=O	764410957	XOQSXFOYGYVAMX-UHFFFAOYSA-N	445.632	1.340	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)C(=O)Nc2cc(C)nn2-c2ccccc2C)c1	764430565	JSPPUBKXFVCLJP-UHFFFAOYSA-N	435.444	1.242	50	20	IDGD	
CN(CC(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1)[C@@H]1CCSC1	764753288	UPKWLAULQANOBE-GOSISDBHSA-N	440.013	1.042	50	20	IDGD	
CCc1ncc(C=NNC(=O)CN2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)s1	764819587	RSQINQGDJVYCLC-UHFFFAOYSA-N	435.575	1.471	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NN=C1C(=O)Nc2cc(O)ccc21	764831611	QSKRYZLXJPZYQG-UHFFFAOYSA-N	427.892	1.636	50	20	IDGD	
C=C(C)Cn1c(SCC(=O)NNC(=O)CNC(=O)c2ccco2)nnc1-c1ccco1	765383809	UFDRRWMTMJSRJH-UHFFFAOYSA-N	444.473	1.377	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1ccc(OC(F)F)cc1	765739671	ZWOIQIYTTBTNCW-UHFFFAOYSA-N	432.427	1.507	50	20	IDGD	
CCc1nn(C)c(CC)c1S(=O)(=O)NNC(=O)c1cc(OC)c(OC)c(OC)c1	766308904	TVQDUXDLKVXFIH-UHFFFAOYSA-N	426.495	1.194	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2ccc([N+](=O)[O-])c3cccnc23)cc1OC	766354438	GBSKQDBDZDWSBM-UHFFFAOYSA-N	432.414	1.784	50	20	IDGD	
Cc1onc(-c2ccccn2)c1C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	766647319	FUTMBGIIAMWOCG-UHFFFAOYSA-N	448.483	1.264	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)c1ccc2nc(O)[nH]c2c1	766661479	WJERQXBZYOVPFB-UHFFFAOYSA-N	442.907	1.501	50	20	IDGD	
C[C@H](NC(=O)NNc1ccccc1S(C)(=O)=O)c1cccc(S(=O)(=O)N(C)C)c1	766945533	UDNAEJXBNHALIF-ZDUSSCGKSA-N	440.547	1.728	50	20	IDGD	
CC(C)O[C@@H]1C[C@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)C1(C)C	768448583	MRIIUCAFQKCSSO-JKSUJKDBSA-N	426.539	1.473	50	20	IDGD	
Cc1cccc(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)c1Br	769266598	NSRFBSKRMYJZTI-UHFFFAOYSA-N	431.246	1.794	50	20	IDGD	
O=C(NNc1ccc(F)cc1Br)Nc1ccn(CC(=O)N2CCOCC2)n1	770035234	UVWQFFGQXPQODV-UHFFFAOYSA-N	441.261	1.792	50	20	IDGD	
O=C(CCCC(=O)c1ccc(Br)cc1)NNC(=O)[C@H]1CCS(=O)(=O)C1	770822275	ANSKQBFIECKROZ-LBPRGKRZSA-N	431.308	1.384	50	20	IDGD	
C=C(C)Cn1c(SCC(=O)NNc2nc(O)c3cnn(C)c3n2)nnc1-c1ccco1	770990991	PWYOCOSFNWQWLH-UHFFFAOYSA-N	441.477	1.732	50	20	IDGD	
N#C/C(=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)N[C@@H](CO)C1CC1	771046431	PAJHOYQOXBJZAF-DWCFMXGVSA-N	427.892	1.873	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCc2nc(COc3ccccc3)n[nH]2)cc1OC	771380743	YIKFZVFKPNWXOQ-UHFFFAOYSA-N	426.433	1.545	50	20	IDGD	
COC(=O)COc1c(C)cc(C(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)cc1C	772182384	JCCCIBZUVPJMEM-UHFFFAOYSA-N	447.875	1.586	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)c1ccccc1CSc1nc[nH]n1	772887728	BSVKMFNVOVVHHK-UHFFFAOYSA-N	444.904	1.828	50	20	IDGD	
CC(C)(C)CC(=O)N1CSC[C@@H]1C(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772889513	PPVGGDRRDMZRDO-CQSZACIVSA-N	440.953	1.441	50	20	IDGD	
COc1cc(C(=O)N(C)C)ccc1NC(=O)C(=O)NNc1ccc(C(F)(F)F)cn1	773666367	NXTMNTOQCQPMRJ-UHFFFAOYSA-N	425.367	1.893	50	20	IDGD	
O=C(NNc1ncccn1)C(=O)Nc1ccccc1N1CCN(CCc2ccncc2)CC1	773721730	SRXJBUKYFDQDFA-UHFFFAOYSA-N	446.515	1.318	50	20	IDGD	
Cc1cc(=O)c(C(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)cn1C	774329652	KXFBQLPCFPTGKI-UHFFFAOYSA-N	446.510	1.631	50	20	IDGD	
COC1(CNC(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)CCC1	780859403	DNLOCXZPFGEOPK-UHFFFAOYSA-N	435.484	1.958	50	20	IDGD	
CC(F)(F)c1cccc(NC(=O)C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1	782116798	GIYFNUFHYFDKQW-UHFFFAOYSA-N	432.431	1.591	50	20	IDGD	
COC(=O)CNC(=O)c1ccc(NC(=O)C(=O)NNc2ncccc2C(F)(F)F)cc1	783121247	HRURDMOCXBEGTI-UHFFFAOYSA-N	439.350	1.085	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)Nc2ccccc2C)cc1C(=O)OC	783411606	ULJDARLFFLVQOF-UHFFFAOYSA-N	428.401	1.360	50	20	IDGD	
COC(=O)Nc1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)cc1	784212766	GAFQVHRBGOPOCD-UHFFFAOYSA-N	447.473	1.387	50	20	IDGD	
N#Cc1ccc(NNC(=O)C(=O)Nc2cnn(CC(=O)NC3CC3)c2)cc1C(F)(F)F	784240192	PSIJCLOFRCYWFK-UHFFFAOYSA-N	435.366	1.134	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ccc(OC(F)F)cc2)cc1-n1nnnc1C	784312403	LVDLTVNJXXTMQK-UHFFFAOYSA-N	433.375	1.663	50	20	IDGD	
O=C(NNc1cc(Cl)ccn1)C(=O)Nc1cccc(Cn2nc3ccccn3c2=O)c1	784856188	GWSNTTHXVXGQCS-UHFFFAOYSA-N	437.847	1.675	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)Nc1ccc(Cl)c2cccnc12	785023931	QKOJONVWZWQTCV-UHFFFAOYSA-N	429.776	1.902	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc(-n4ccnn4)cc3)n[nH]2)c1	785126960	WCITWCGMXPNZGM-UHFFFAOYSA-N	444.455	1.674	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)[C@H](O)Cc2ccccc2Cl)cc1OC	785730199	ARHVOOIBDNBBKN-OAHLLOKOSA-N	436.848	1.265	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1cccc(C(F)(F)F)n1	786430823	MNCOEKAMAWHQFN-UHFFFAOYSA-N	432.380	1.594	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NN=C3CCC4(CCCO4)CC3)CC2)cc1	788023192	ANAANUHBHDCSKQ-UHFFFAOYSA-N	448.589	1.897	50	20	IDGD	
COCCN1C(=O)c2ccc(C(=O)NNc3cccc(F)c3[N+](=O)[O-])cc2S1(=O)=O	791069204	HBZCXNXJFXDEKN-UHFFFAOYSA-N	438.393	1.282	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)c1nc(Br)cs1	792199939	MFRJSDZHPBJOSU-UHFFFAOYSA-N	438.351	1.879	50	20	IDGD	
COc1cc(C(F)(F)F)ncc1NC(=O)C(=O)NNC(=O)COc1ccccc1C#N	792268037	JYRUTUIXJYTRRT-UHFFFAOYSA-N	437.334	1.146	50	20	IDGD	
CNS(=O)(=O)c1ccc(NC(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)nc1	792395188	VFGHBRFPZRHBKM-UHFFFAOYSA-N	435.434	1.135	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)NCCCN(C2CC2)S(=O)(=O)c2cccc(F)c2)n1	793020887	DAEYCXKFFSARCI-UHFFFAOYSA-N	449.508	1.717	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)Cc2cccnc2)n(-c2nc3ccccc3s2)n1	793024175	CGHBLAWLOHXQOD-UHFFFAOYSA-N	435.469	1.514	50	20	IDGD	
CCCn1c(CCC(=O)NNC(=O)c2cccc(C)n2)nc2cc(S(N)(=O)=O)ccc21	794077380	VQYIDAJSTIZYNJ-UHFFFAOYSA-N	444.517	1.191	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNS(=O)(=O)c1cccc([N+](=O)[O-])c1OC	794867274	VUDBLCNGFPZNAZ-UHFFFAOYSA-N	425.419	1.391	50	20	IDGD	
CC(C)Oc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)cc1C(N)=O	797002741	RZKZXDWPLZDYLV-UHFFFAOYSA-N	434.836	1.331	50	20	IDGD	
O=C(NNC(=O)c1ccccc1F)C(=O)Nc1ccc(Cl)c(CN2CCOCC2)c1	797534927	GZNCYCPLTMOWPT-UHFFFAOYSA-N	434.855	1.711	50	20	IDGD	
COCCn1cc(CNC(=O)NNC(=O)c2ccc(OC)c(Br)c2)cn1	799926231	IXKVRSOWTNTOQT-UHFFFAOYSA-N	426.271	1.445	50	20	IDGD	
COC[C@@H](C)n1c(SCC(=O)NNC(=O)N=c2cc[nH]cc2)nnc1-c1ccccc1	802034090	ACWLMTDBADEQRU-CQSZACIVSA-N	441.517	1.914	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@H]2CN(Cc3ccccc3)CCO2)cc1	802063856	DQKZRDHDWKLLOG-GOSISDBHSA-N	432.502	1.144	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2c(C)c(C(F)(F)F)nn2C)cc1C	806973561	ROFIHCQEYOQPFN-UHFFFAOYSA-N	427.383	1.529	50	20	IDGD	
COC(=O)CCNC(=O)c1ccc(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2C)cc1	807457368	BREHCHKNNGGASL-UHFFFAOYSA-N	443.416	1.278	50	20	IDGD	
COC[C@@]1(CNC(=O)NNc2ccc(-n3cccn3)nn2)CCCN1C(=O)OC(C)(C)C	807550078	CUZZGNKAQZGVPF-FQEVSTJZSA-N	446.512	1.705	50	20	IDGD	
CC(C)Oc1ccc([C@@H](CNC(=O)NNC(=O)CNC(=O)c2ccco2)N(C)C)cc1	807589875	ZCYAOOVLRIAMNW-QGZVFWFLSA-N	431.493	1.430	50	20	IDGD	
COc1ccc(-c2ocnc2C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1	808643678	NMBOQUCSMNNJDT-UHFFFAOYSA-N	440.368	1.876	50	20	IDGD	
COCCOCc1ccc(CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1	812867551	MEKQZXORYKCZSN-UHFFFAOYSA-N	449.533	1.287	50	20	IDGD	
CC1(C)NC(=O)N(c2cccc(NC(=O)NNC(=O)c3ccc4c(c3)OCO4)c2)C1=O	812972172	CELNJHYPFCUGLT-UHFFFAOYSA-N	425.401	1.717	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc3c(C)nn(C)c3c2)cc1	812979162	KGRJCOWCGNABJO-CQSZACIVSA-N	437.456	1.638	50	20	IDGD	
Cc1nn(C)c2cc(NC(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)ccc12	812989924	UNVOTOVZSDZIAM-UHFFFAOYSA-N	430.490	1.599	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C1(S(=O)(=O)c2ccccc2)CCOCC1	813379291	YNXPWAFOKWLGIY-UHFFFAOYSA-N	442.497	1.427	50	20	IDGD	
Cn1cnc(NC(=O)C(=O)NNC(=O)c2cn(-c3ccccc3)nc2-c2ccccc2)n1	815564181	ABQPWDJMXQFFIJ-UHFFFAOYSA-N	430.428	1.068	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCc2nncn2C1)C(=O)Nc1ccc(Br)c(Cl)c1	815693020	JMCSRGMQTRQDND-QMMMGPOBSA-N	441.673	1.043	50	20	IDGD	
COC(=O)c1cc(Br)c(OC)cc1NC(=O)C(=O)NNc1ncncc1F	815763917	HQBSBNBGQSMYPD-UHFFFAOYSA-N	442.201	1.255	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2cnn(C)c2I)c2ccccc2n1	816560609	UJBFHUPEDQSIJO-UHFFFAOYSA-N	435.225	1.956	50	20	IDGD	
CC(C)(C)OC(=O)N1CC2(COC2)[C@@](F)(C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)C1	816809147	MIDYOLIAXVAAJQ-IBGZPJMESA-N	438.412	1.331	50	20	IDGD	
C[C@@]1(c2ccc(Br)cc2)NC(=O)N(CC(=O)NNc2ncncc2F)C1=O	817079008	DILSTMKKPIPINI-INIZCTEOSA-N	437.229	1.289	50	20	IDGD	
O=C(CNC(=O)NCc1ccc(F)cc1)NNC(=O)c1ccc(Br)s1	822200414	GZYUAFBMHWKSQO-UHFFFAOYSA-N	429.271	1.910	50	20	IDGD	
NC(=O)[C@H]1CC(C(=O)NNC(=O)c2cc(-c3ccccc3)on2)=NN1c1ccc(F)cc1	913083981	XHXLDYHGVQKCGW-QGZVFWFLSA-N	436.403	1.362	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)CN2C(=O)N[C@]3(CCc4ccccc43)C2=O)c(C)c1	913164904	YVPSGVHPVNKJQK-QHCPKHFHSA-N	435.484	1.256	50	20	IDGD	
C=CCNC(=S)NNC(=O)c1ccc(OC)c(S(=O)(=O)N[C@H]2CCCC[C@H]2C)c1	913435539	WTCBAMXPCCZVKT-HIFRSBDPSA-N	440.591	1.847	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C2CCN(C(=O)COc3ccccc3)CC2)c1	914846689	VFAAVHKGLCLVRG-UHFFFAOYSA-N	425.485	1.839	50	20	IDGD	
COc1cc(-n2cnnn2)c(Cl)cc1C(=O)NNC(=O)COc1ccc(C)c(C)c1	916107905	MFDNJKKGLYUELV-UHFFFAOYSA-N	430.852	1.781	50	20	IDGD	
CC(=NNC(=O)COc1cc(C)ccc1C)c1ccc(S(=O)(=O)NCCC(=O)O)cc1	916297882	MHASBUBSOKJGJP-UHFFFAOYSA-N	447.513	1.976	50	20	IDGD	
CCCNC(=O)c1cccc(CNC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c1	916478806	SENZIDMKSKWKBS-UHFFFAOYSA-N	436.472	1.218	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CN2C(=O)N[C@@]3(C[C@H](C)CC(C)(C)C3)C2=O)cc1	916830520	DKFHADUYJYKYJD-JLCFBVMHSA-N	443.504	1.218	50	20	IDGD	
COc1cccc(CCC(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1OC	917288706	BAQHTJOZFKDALM-SFHVURJKSA-N	444.440	1.167	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(I)cc1)c1ccc(Cl)nc1	917745876	AUSCJUFUWCXBJZ-UHFFFAOYSA-N	437.646	1.963	50	20	IDGD	
CNC(=O)COc1cccc(CNC(=O)NNC(=O)CCSc2ccc(F)cc2)c1	918095797	GYDWGNNMCFKANK-UHFFFAOYSA-N	434.493	1.963	50	20	IDGD	
CC[C@@H](NC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)c1ccccc1OCC(=O)NC	918221184	HEUIIAYPWOZQKA-MRXNPFEDSA-N	429.433	1.815	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)[C@@H]2CCCN(C(=O)CC)C2)c2ccccc2c1=O	918689926	HEXPKFZRSMVYAV-MRXNPFEDSA-N	441.532	1.996	50	20	IDGD	
O=C(CCc1ncc(-c2ccccc2Br)o1)NNC(=O)CN1CCCC1=O	919743879	USHGNVAOVUHHRZ-UHFFFAOYSA-N	435.278	1.807	50	20	IDGD	
O=C(NNC(=O)c1cn(-c2ccccc2)nc1-c1cccs1)N[C@@H]1CCS(=O)(=O)C1	919883431	CUKQHQDEKHMHEV-CYBMUJFWSA-N	445.526	1.732	50	20	IDGD	
Cc1ccc(-n2cnnn2)cc1NC(=O)NNC(=O)COc1ccc(Br)cc1	919896897	MWSJCPOOPIFPOR-UHFFFAOYSA-N	446.265	1.965	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)COc1ccccc1[N+](=O)[O-])c1ccc(N2CCOCC2)cc1	920921567	MIAQWRWZEJQCES-HNNXBMFYSA-N	443.460	1.902	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@H]2CCCN2C(=O)/C=C\c2ccc(C(N)=O)cc2)cc1	1115888310	HFPCZAHKRCIHTJ-WYVHHVQNSA-N	436.468	1.260	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)c2cn(-c3ccc(Br)cc3)nn2)cc1	1317828492	RNYLWBMAHSSJHF-UHFFFAOYSA-N	441.245	1.741	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCC(=O)NNC(=O)[C@H](C)Oc2ccccc2F)cc1	1317863115	SIKCBBXPZVAKDW-ZDUSSCGKSA-N	439.465	1.118	50	20	IDGD	
CC(C)n1cc2c(n1)[C@H](NC(=O)NNC(=O)C1CCN(c3ncccn3)CC1)CCC2	1320267375	INSXULRPJRAFNO-QGZVFWFLSA-N	426.525	1.878	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc2oc(=O)[nH]c2cc1Cl)c1cncn1-c1ccccc1	1339588277	DSAJMKNJMYTNQJ-UHFFFAOYSA-N	433.833	1.584	50	20	IDGD	
O=C(c1cc2cc[nH]c2cc1Cl)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1777997397	XRSPXISCVCVKPJ-VQIMIIECSA-N	426.300	1.865	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Br)C2)c1cc2n(n1)CCC2	1779121642	FLUHJAKRSDRDPU-IIDMSEBBSA-N	443.317	1.647	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc4cccnn4n3)C2)C1	1779963745	SUSIOSIWJNKBTE-ACJLOTCBSA-N	436.310	1.204	50	20	IDGD	
O=C(c1cnc2snnc2c1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1780071553	KHOIKUQILQIOJN-IAQYHMDHSA-N	444.286	1.220	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Br)C1)N1C[C@H]2C[C@H]2C1	1780775039	VHRMKDCHUFYHNV-OUSZYSOSSA-N	446.361	1.531	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)C2)C1	1781765898	LKSSJSOXOSWCMC-APPDUMDISA-N	444.257	1.961	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3c(O)cc(O)cc3O)C2)C1	1781818608	NAXRWXOARDBYIO-XIKOKIGWSA-N	443.294	1.420	50	20	IDGD	
CCC(=O)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](Br)Cc3ccccc3)C2)C1	1783021587	CRLRNXCXAZKBQS-UZLBHIALSA-N	437.334	1.802	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc(CO)c(F)c2)C1	1783077630	ABHSVBKVCTWFAM-HGHGUNKESA-N	442.915	1.699	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)Cn3cnc4ccccc43)C2)C1	1783752933	UQCPNHRSDYYPJG-AUUYWEPGSA-N	435.322	1.650	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)C(=O)Nc3c(C)cccc3C)CCO2)C1	1783880572	KGZUMBKCHKQEOC-HRAATJIYSA-N	437.924	1.326	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cccc3nscc13)CCO2	1783936196	FRJUCQDCJVGYOZ-OAQYLSRUSA-N	445.545	1.113	50	20	IDGD	
Cc1nc2cc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]4C3)ccc2s1	1784092117	HINRICFECWOJEQ-DIECFANBSA-N	437.949	1.798	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C3(c4cccc(Cl)c4)CC3)C[C@@H]21)[C@@H](O)CCl	1784093626	ZKFVSYQYSWQRLK-MGHWNKPDSA-N	441.355	1.951	50	20	IDGD	
Cn1ncc(Br)c1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21	1787776666	KOTRPYSSWARRHB-PZEZNAACSA-N	437.697	1.310	50	20	IDGD	
O=C(CCN1CCCCC1)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1	1787787206	LGHLQKMIRPNNFB-UHFFFAOYSA-N	449.360	1.990	50	20	IDGD	
CC(C)n1cnc(C(=O)NC2(c3ccc(NC(=O)c4cccc(B(O)O)c4)cc3)CCC2)n1	1788143940	YAPUHPBBKJNFCV-UHFFFAOYSA-N	447.304	1.600	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)[C@H](O)CCl)CCC2)cc1)c1cc2n(n1)CCCNC2=O	1789221714	ZAKLTTIHGPTLKH-QGZVFWFLSA-N	445.907	1.364	50	20	IDGD	
Cc1ccc(OC(C)(C)C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](O)CCl)C[C@@H]32)nc1	1789722911	UULIKRCSPLOOLO-NXOAAHMSSA-N	439.940	1.127	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CC[C@H](C(=O)OC)CC3)C[C@@H]21	1789858089	RLMCVMIEDZQAKQ-FRMKIJSPSA-N	428.957	1.963	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cnn(C)c3)C[C@@H]21	1790963968	QIWBBVIXVZRQMW-VGWMRTNUSA-N	427.343	1.116	50	20	IDGD	
Cc1nc(N)sc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)Br)[C@H]2C1	1791057269	AADBBRGNHKWUMO-VGDYDELISA-N	431.356	1.410	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCN3CCCCC3)C[C@@H]21	1791058122	PXGLPWQWDANLFE-QAETUUGQSA-N	430.387	1.626	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C#Cc3ccc(Cl)cc3)C[C@@H]21	1791250091	YXMIJBWSIRCRQQ-WNHJNPCNSA-N	439.339	1.925	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1ccc(C2(NC(=O)CCc3cncnc3)CCC2)cc1	1791599196	CPWMPWQDYAYXQY-UHFFFAOYSA-N	438.532	1.916	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(Cl)c(F)c(Cl)c1)C2)[C@@H](O)CCl	1792980457	PJXDTCZTGVERNY-FJHTZYQYSA-N	439.698	1.935	50	20	IDGD	
COc1cc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@](C)(Cl)CCl)C3)ccn1	1793901754	UBHAHDACVQHODQ-ZDUSMZPESA-N	444.359	1.849	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1ccc2c(c1)CCC2)c1ccc(B(O)O)cc1	1794100520	GNTACYGEMGLBBT-NUNAXRQHSA-N	432.329	1.350	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)Nc1cccnc1	1795610919	HRGVIDKGPKYZPB-BIYBGRMPSA-N	439.354	1.645	50	20	IDGD	
CC(=O)Nc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CO[Si](C)(C)C)C3)ccn1	1796744161	GRUDYTVPUPSPMV-HGKCTWBKSA-N	434.569	1.095	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2c(c1)OCO2	1796786904	MPVVXQFDNDBLGV-AODNKKSCSA-N	429.300	1.855	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](OC(C)=O)C(C)C	1797596964	WGMUPKMTVMDINE-XFIYOXNOSA-N	433.343	1.337	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](O)CCl)C3)C1	1797819547	ONCUNRNGISTVLO-QMHWVQJVSA-N	429.945	1.481	50	20	IDGD	
COc1ccnc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CO[Si](C)(C)C)c1OC	1797957336	JEYFUXPSOUWWSJ-XOIINTDNSA-N	437.569	1.154	50	20	IDGD	
Cc1nc(F)ccc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)CBr)C2	1798310007	QHAIBNHWHLPNLH-VFFTVRQLSA-N	428.302	1.763	50	20	IDGD	
Cc1cccc(F)c1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnccc1C(=O)NN	1798443539	GQRSSPWSCIKRAS-QDMKHBRRSA-N	425.464	1.698	50	20	IDGD	
C[C@@H](Nc1cnccn1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@](C)(Cl)CCl	1799275814	BYMHAYWNYYCDMO-RWAMIBMJSA-N	430.336	1.103	50	20	IDGD	
COc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@](C)(Cl)CCl)c(O)c1	1799276421	GJANZTSAJCQSBF-JZGBQWHFSA-N	431.316	1.840	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccn(C(F)F)n1)C2	1799277833	QPNLAYSIDPTNSQ-FXZYXXQUSA-N	425.263	1.718	50	20	IDGD	
CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@](C)(Cl)CCl	1800084845	YKYCZWHKIGWREH-BZKOTJRBSA-N	444.363	1.331	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2c(c1)NC(=O)CC2	1800102229	CMGSMGSBPQJIRX-RCJHGTSTSA-N	435.908	1.028	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ncc[nH]1)C2)[C@H](Br)Cc1ccccc1	1800435362	GDHXFSVKFWNTSS-YYIAUSFCSA-N	447.333	1.619	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc3[nH]ncc3c1)C2	1800640924	MGEUWFDCTRNCSO-XGUBFFRZSA-N	436.310	1.335	50	20	IDGD	
Cc1cccc(Cl)c1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCC(=O)NN(C)C	1801012699	WBQJJGRKEAGICV-YVWYUNDQSA-N	436.940	1.225	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1CCc2ccccc2C1	1801844743	VBUARSRJSSZHRL-BURNTYAHSA-N	426.561	1.803	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)[C@@H]2CCC(=O)NC2)[C@@H]1c1cccnc1	1802613320	QZKUUBHGGDXPJK-CRNXPOROSA-N	437.338	1.397	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2nc3ccccc3[nH]2)[C@H]1c1cccnc1)[C@H](O)CCl	1803139495	PZKYYMRTWDEDRP-QGTPRVQTSA-N	427.892	1.877	50	20	IDGD	
Cn1nc2c(c1C(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)CCC2	1803146639	CBGZCBOVUAITDH-OLMNPRSZSA-N	431.924	1.223	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)C(F)F)[C@H]1c1cccnc1	1808414888	OLROITSBEBGKGH-DVGSEWNHSA-N	432.431	1.487	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@H]1c1cccnc1	1808431151	IAZONOSNWVMHPZ-IPOQPSJVSA-N	443.317	1.645	50	20	IDGD	
CCc1cc(C(=O)N2CCC3(CCCN(C(=O)c4cccc(B(O)O)c4)C3)CC2)no1	1809977582	HNIMEKLMRYNILE-UHFFFAOYSA-N	425.294	1.075	50	20	IDGD	
C[C@H](NC(=O)c1cnccn1)C(=O)NC[C@@H]1CCN(C(=O)[C@H](F)Cl)[C@@H]1c1cccnc1	1810446728	IXZDQLGVENNDPM-SDNTUTLCSA-N	448.886	1.230	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@H]1CCN(C(=O)CN2CCOC2=O)[C@H]1c1cccnc1	1810538172	TVFAXFJFPZSIFI-APWZRJJASA-N	434.569	1.391	50	20	IDGD	
Cc1nccn1CC(=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@H]1c1cccnc1	1812406555	ICHHHVHITGHRJU-BHYGNILZSA-N	438.301	1.983	50	20	IDGD	
O=C(Cn1cnc2ccccc21)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1	1812966196	KQVJVXWLWGXVGI-LDQXTDLNSA-N	441.919	1.737	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)CSc2ncccn2)[C@@H]1c1cccnc1	1813031831	SVFRQRKVWNWGAU-SOLBZPMBSA-N	449.964	1.924	50	20	IDGD	
COCc1oncc1C(=O)N1CC[C@H](CNC(=O)[C@@H](Cl)COC)[C@@H]1c1cccnc1	1813031833	XODXUXSDNLKWIX-HFTRVMKXSA-N	436.896	1.789	50	20	IDGD	
COc1ccc(CC(=O)N2CCCC[C@H]2c2cc(NC(=O)[C@@H](O)CCl)n[nH]2)cc1O	1814864685	RQITZGMLMJFSCT-HOCLYGCPSA-N	436.896	1.958	50	20	IDGD	
CCS(=O)(=O)CC(=O)Nc1cc([C@H]2CCCCN2C(=O)CO[Si](C)(C)C)[nH]n1	1815174775	XWTAXDZLVMMEKJ-CQSZACIVSA-N	430.603	1.688	50	20	IDGD	
CCC[C@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN(C)C(=O)C(=O)O)[nH]n1	1815321996	GHTSVTILUKRPPP-AAEUAGOBSA-N	427.889	1.352	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccns2)n[nH]1	1816274132	FWBFGNVARNGUNS-AWEZNQCLSA-N	440.489	1.484	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3nccc4nc[nH]c34)sc2C1	1816902201	RWWHOWDUJNTDGY-NXEZZACHSA-N	434.909	1.894	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](F)Br)CC2	1817021396	GEIPNQYCAVDTTF-BYULHYEWSA-N	436.307	1.193	50	20	IDGD	
CCc1ccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)cn1	1817473363	ONIAGENGSVHJHI-HXUWFJFHSA-N	447.304	1.667	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1)c1nc(O)n2c1CCCC2	1819628027	JPESPLKUUSUJHT-GXTWGEPZSA-N	436.900	1.554	50	20	IDGD	
COc1cc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@@H](O)CCl)CC3)ccc1O	1822241463	XXACQGFMKNKHQI-GWCFXTLKSA-N	425.894	1.683	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)CC[C@H]2CCOC2)[nH]n1	1822417674	LJNKJXOOZLDKMD-RDJZCZTQSA-N	434.541	1.592	50	20	IDGD	
CC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)COc1ccc(O)nn1)CC2	1822855739	PBYCFNUQKYQXTP-ZJUUUORDSA-N	425.898	1.647	50	20	IDGD	
Cn1cccc1C(=O)C(=O)N[C@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1	1823013875	KROGPLDZXDOVTE-SDBXPKJASA-N	443.298	1.967	50	20	IDGD	
C[C@@]1(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)[nH]n2)CC1(F)F	1823397590	DCJXCAVOVYPWHX-KUHUBIRLSA-N	447.446	1.759	50	20	IDGD	
C[C@@H](C(=O)N[C@@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1)n1cccc1	1826092124	MWCWXICODIZAON-UONOGXRCSA-N	432.550	1.491	50	20	IDGD	
CO[C@H](C)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1)CC2	1826155415	ZLXUOQVYKWMILT-TUECAUIESA-N	432.506	1.224	50	20	IDGD	
Cn1cc(CC(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@@H](F)Br)CC3)cn1	1826943317	FWHHSYIPSLJMOL-NOZJJQNGSA-N	430.303	1.722	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4n(n3)CCCC4)C2)C1	1830361767	CDGGLPXECLBMNG-OAQYLSRUSA-N	438.956	1.554	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)COC3CCCCC3)CCO2)C1	1830383747	HRPZQZILYFYCNQ-HNAYVOBHSA-N	447.370	1.576	50	20	IDGD	
CC(C)[C@H](S)C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](C)CBr)CCO2)C1	1830535693	SBCLPKCALXVJLW-KEYYUXOJSA-N	437.400	1.428	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)CC3CCOCC3)C2)C1	1830537827	PZVMETDUBISBBF-BEFAXECRSA-N	447.370	1.291	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(F)n3)C2)C1	1830540086	MQUKOHIKTOANID-UGSOOPFHSA-N	444.301	1.322	50	20	IDGD	
Cc1ocnc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)CBr)CCO2	1830543555	UBNZAJCPPAMITC-SJKOYZFVSA-N	430.299	1.084	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4ccnn4c3)C2)C1	1831654031	PNKKQIQJTMTVML-NQIIRXRSSA-N	434.924	1.812	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3cccc(OC)n3)CCO2)C1	1832823777	BZVHCMOPRIWAII-DYESRHJHSA-N	439.940	1.497	50	20	IDGD	
CNc1nsnc1C(=O)NC1CCN(C2CCN(C(=O)[C@H](Cl)COC)CC2)CC1	1833072993	DQIHSWSPALRGCG-CQSZACIVSA-N	444.989	1.019	50	20	IDGD	
CC(=O)NC(C)(C)C(=O)NC1CCN(C2CCN(C(=O)C(C)(C)CCl)CC2)CC1	1833484993	UEWLJMGLUYFREE-UHFFFAOYSA-N	429.005	1.738	50	20	IDGD	
Cc1nscc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)Br)C2)C1	1833748705	IMDOMBDOYWUEIS-BZNIZROVSA-N	432.340	1.305	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1)C(=O)c1ccco1	1833755830	BLGVALNJYQKUDI-MRXNPFEDSA-N	444.301	1.724	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cscn3)CCO2)C1	1834260016	UVVWINBHELITOW-MLGOLLRUSA-N	432.340	1.387	50	20	IDGD	
Cc1ccccc1NCC(=O)NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1834773704	MCECAKKLDSCYQN-HXUWFJFHSA-N	436.984	1.578	50	20	IDGD	
CCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](Br)Cc3ccccc3)C2)C1	1834816126	YHERAIHFWKTBCY-PXNSSMCTSA-N	439.350	1.859	50	20	IDGD	
COc1cscc1C(=O)NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1835233113	XAVOEOHGKNVANR-INIZCTEOSA-N	429.970	1.542	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccccn3)CCO2)C1	1836184776	NKBDXUJCEFRECQ-HNAYVOBHSA-N	440.338	1.112	50	20	IDGD	
O=C(CCBr)N1CCC(OC2CCN(C(=O)c3cc(CO)on3)CC2)CC1	1837654335	AHOCWIMICVHMTL-UHFFFAOYSA-N	444.326	1.564	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnccc3Cl)CCO2)C1	1837780884	QALZIPUTVFNZQK-YJBOKZPZSA-N	432.304	1.059	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccnn3C(C)C)CCO2)C1	1838019040	VRCRCBGZZQDBAK-OXJNMPFZSA-N	426.945	1.942	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3c(F)cncc3F)CCO2)C1	1838161261	GVTBVUQERDUURY-DJJJIMSYSA-N	431.867	1.837	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)[C@H]3CC3(F)F)CC2)CC1	1838273918	APUGJBSHUDCTQT-MRXNPFEDSA-N	430.496	1.013	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3(c4ccc(O)cc4)CC3)C2)C1	1839141499	KBPGNQWONDRNQL-NQIIRXRSSA-N	436.936	1.898	50	20	IDGD	
CC(C)n1nccc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2	1839153580	KULFPXSYBZUQJP-RBUKOAKNSA-N	447.363	1.770	50	20	IDGD	
O=C([C@@H]1C[C@]1(F)Cl)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839203049	XOZITHDACJFXMJ-TXFQPVFDSA-N	431.661	1.058	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(Cl)c(F)c3)CCO2)C1	1839272490	QIQHIONVDBHNPK-HNAYVOBHSA-N	449.306	1.803	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3ccccn3)C2)C1	1840031660	YUAQRPGMKBCRNY-KXBFYZLASA-N	440.338	1.254	50	20	IDGD	
C=CC[C@H](C(=C)C)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H](C)Br)CCO2)C1	1840033538	IJJNLNDQMNYEND-MDZRGWNJSA-N	429.355	1.995	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4ccoc4c3)C2)C1	1840155326	XVTYENHGHIUSQL-UWJYYQICSA-N	436.892	1.757	50	20	IDGD	
Cc1ncc(/C=C/C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)s1	1840190637	FMIDXRKQLMSRTH-YATRRXNKSA-N	434.345	1.725	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)c(O)c1	1840670720	RYFCTAUPUDBXQD-QAPCUYQASA-N	445.285	1.461	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC12CN(C(=O)[C@H](O)NC(=O)OC(C)(C)C)C2	1841288576	CXFYYSQCVGEQPD-RYUDHWBXSA-N	434.331	1.064	50	20	IDGD	
O=C(c1cc(-c2ccccc2)on1)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843012992	XOMMLUOLSLRTET-UHFFFAOYSA-N	431.257	1.152	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2cccc3nc[nH]c23)C1	1843252246	QQWFAYQJXWPIOW-VULFUBBASA-N	433.472	1.514	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)Cc2cnc[nH]2)C1	1843344183	OKQCOHWCKMYKED-UHFFFAOYSA-N	427.417	1.303	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)c1ncccn1)C2	1844692059	BKNXYGSDWMVASY-UHFFFAOYSA-N	425.401	1.441	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@H]1CC(=O)N(Cc3ccccc3)C1)C2	1846360646	XFIIQXHCGTUKOJ-MSOLQXFVSA-N	433.936	1.492	50	20	IDGD	
O=C(NNC(=O)c1cc(Cl)ccc1O)c1ccc2c(c1)C(=O)N(C[C@H]1CCCO1)C2=O	10600915	LWUVLLOSNBPTHL-CYBMUJFWSA-N	443.843	1.895	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1OC	17406194	GIZZUJORQOTBEZ-UHFFFAOYSA-N	435.502	1.484	50	20	IDGD	
Nc1ccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc1[N+](=O)[O-]	17460387	PIFNSPXPVKXDBZ-UHFFFAOYSA-N	433.446	1.036	50	20	IDGD	
O=C(COC(=O)c1cccc(N2CCCC2=O)c1)NNC(=O)c1ccc([N+](=O)[O-])cc1	19480886	QZCQVLQQZIAWHV-UHFFFAOYSA-N	426.385	1.340	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1Cc2c(OC)ccc(OC)c2[C@H](O)C1	26159825	AIJKMWJWNTVNJR-OAHLLOKOSA-N	449.891	1.676	50	20	IDGD	
CCc1ccc(C(=O)N2CCN(C(=O)NNC(=O)CNC(=O)c3cccs3)CC2)cc1	725872330	DKCZYWYNUPJDCD-UHFFFAOYSA-N	443.529	1.239	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@H](C(=O)NNc3nc(-c4cccnc4)no3)C2)cc1	728074687	HUTMZAHTBWRSQN-INIZCTEOSA-N	442.501	1.984	50	20	IDGD	
COCCNC(=O)CSc1ccccc1C(=O)NNc1nc(-c2cccnc2)no1	728075846	AFJAZBANBHZWPJ-UHFFFAOYSA-N	428.474	1.743	50	20	IDGD	
CN(C)C(=O)c1cccc(S(=O)(=O)NNC(=O)c2cc(F)ccc2Br)c1	728509844	PVRGOUCQHLGBJP-UHFFFAOYSA-N	444.282	1.913	50	20	IDGD	
COc1ccc([C@@]2(C)NC(=O)N(CC(=O)NNC(=O)Cn3ccc4ccccc43)C2=O)cc1	729449777	CAEHSWNUECCLBQ-HSZRJFAPSA-N	449.467	1.265	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)[C@@H]1CS[C@@H](Cc2ccccc2F)C(=O)N1	729450926	AZQHHWDVNJYXIM-HKUYNNGSSA-N	440.500	1.771	50	20	IDGD	
COc1cc(C(=O)NCC(=O)NNC(=O)Cn2ccc3ccccc32)ccc1OC(F)F	729540872	OQYZQPDSZDTOFY-UHFFFAOYSA-N	446.410	1.829	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)Cc2c(C)nc3[nH]n(C)c(=O)c3c2C)cc1	730103843	HLXLGLFIHFIAFR-AWEZNQCLSA-N	441.488	1.435	50	20	IDGD	
COc1cccc(C[C@@H](C(=O)NNC(=O)c2cccc3ncccc23)n2nnnc2C)c1	730226990	WMGGFDIVLUCNOV-FQEVSTJZSA-N	431.456	1.783	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)c1ccc(Cl)c(S(=O)(=O)NCc2ccccc2)c1	731852413	SZPIGEFWKKXXCO-UHFFFAOYSA-N	447.904	1.925	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)NNC(=O)C2CCC2)cc1	732141336	HERVBKQMXXSUPH-WJDWOHSUSA-N	436.472	1.289	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)N1CCN(S(=O)(=O)c2ccc(F)c(Cl)c2)CC1	732196752	FMFGNDDQOZRVPT-CYBMUJFWSA-N	448.948	1.367	50	20	IDGD	
CN(c1ccc(CNC(=O)NNC(=O)Cn2ccc3ccccc32)cc1)S(C)(=O)=O	732246264	KKRACKBBHRPPKX-UHFFFAOYSA-N	429.502	1.568	50	20	IDGD	
COc1ccc(C)cc1N1C[C@H](C(=O)NNC(=O)CCN2C[C@H](C)O[C@H](C)C2)CC1=O	732261330	MCZIZFJZKNGQDG-IXDOHACOSA-N	432.521	1.003	50	20	IDGD	
Cc1ccc([C@@]2(C)NC(=O)N(CC(=O)NNc3ccccc3S(C)(=O)=O)C2=O)cc1	732303051	VDZAUXJONCBAEI-HXUWFJFHSA-N	430.486	1.309	50	20	IDGD	
O=C(NNC(=O)c1cn(-c2ccc(C(F)(F)F)cn2)nn1)c1cnn(-c2ccccc2)c1	733110747	RYLPZHHFQMNVLB-UHFFFAOYSA-N	442.361	1.942	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)c1ccc(S(C)(=O)=O)o1	733125772	KCCAAOZEUZALIL-VIFPVBQESA-N	431.264	1.674	50	20	IDGD	
COc1ccc([C@@H]2[C@H](C(=O)NNC(=O)[C@H]3COc4ccccc4O3)CCC(=O)N2C)cc1	734313351	IFELFCNVSANBMQ-OZOXKJRCSA-N	439.468	1.592	50	20	IDGD	
Cc1ccc(N2CCCC2)c(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1	735166078	CYZNMWUSFZKRQI-FQEVSTJZSA-N	439.468	1.739	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)N2CCC[C@H](CNS(N)(=O)=O)C2)c(C)n1C[C@H]1CCCO1	739699413	QPUMAUBQUNFBKT-QOJQYCKNSA-N	449.577	1.223	50	20	IDGD	
C[C@@H](C(=O)OCC(=O)NNC(=O)c1ccccc1)N1CCN(c2ccc(F)cc2)CC1	740983107	RTIDHRFARWICTD-INIZCTEOSA-N	428.464	1.341	50	20	IDGD	
O=C(CCS(=O)(=O)c1ccc2c(c1)OCCCO2)NNc1nc(-c2ccncc2)no1	741209025	CGABYSDJOLANHN-UHFFFAOYSA-N	445.457	1.600	50	20	IDGD	
O=C(CCCOc1cccnc1)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	742467372	AYGDRPOBCIODPM-UHFFFAOYSA-N	446.529	1.876	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)[C@H](C)NC(=O)c2cc3c(C)nn(C)c3s2)cc1	743293480	AAVWPMZMDMXAEK-ZDUSSCGKSA-N	428.518	1.629	50	20	IDGD	
O=C(NNC(=O)N1CC[C@@H](COCc2ccccc2)C1)C1CCN(c2ncccn2)CC1	743588775	IMYUSAVZIFEETP-LJQANCHMSA-N	438.532	1.973	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1)NC1CCCC1	744052554	HXHFWWRPMPRUQV-CYBMUJFWSA-N	439.494	1.269	50	20	IDGD	
C[C@H](C(=O)NNc1c(F)cc(F)cc1Br)N1C(=O)[C@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O	744368537	ZTFLBMUEFZVRAZ-XQEGPDNTSA-N	444.232	1.721	50	20	IDGD	
C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)OCC(=O)NNC(=O)c1ccc(C#N)cc1	744496838	INWCMKOJRLFJGW-GFCCVEGCSA-N	428.426	1.951	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)[C@@H]1CCCN1C(=O)Nc1ccc2c(c1)OCCO2	746219708	VLJUVMJDUAXPDX-INIZCTEOSA-N	425.445	1.239	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)c1ccc(NS(=O)(=O)c2cccs2)cc1O	747515911	VZCJMBYGVMHEKT-UHFFFAOYSA-N	432.483	1.653	50	20	IDGD	
O=C(NNc1cccc([N+](=O)[O-])c1)c1ccc2c(c1)S(=O)(=O)N(C[C@H]1CCCO1)C2=O	747995052	MHMNSTNFPBYAEL-OAHLLOKOSA-N	446.441	1.675	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc2c(c1)nc(CCC(=O)NNc1cccc(C#N)c1)n2C	748048030	AXLGGEXKODZHBG-UHFFFAOYSA-N	426.502	1.771	50	20	IDGD	
C[C@]1(c2ccc(C(=O)NNC(=O)c3ccc(Br)s3)cc2)NC(=O)NC1=O	748517620	ZYNGAKJVSFEEGA-MRXNPFEDSA-N	437.275	1.640	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NCC(=O)NNc2cccc3cnccc23)c1	749291489	IFWZTGJJXDWVPT-UHFFFAOYSA-N	427.486	1.358	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN1C(=O)c1ccc2c(c1)OCO2)c1nnc(O)c2ccccc12	749560098	FMGBUNPALJJNGG-OAHLLOKOSA-N	449.423	1.130	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2cccc(Cl)c2[N+](=O)[O-])ccc1Cl	749866098	GCLRJWGWFLMJKI-UHFFFAOYSA-N	433.229	1.624	50	20	IDGD	
C[C@H](C(=O)NNC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1)N1CCN(C)CC1	750663262	LGYIHPNNVQXLHZ-QGZVFWFLSA-N	433.516	1.331	50	20	IDGD	
COc1ccc(-n2cnnc2SCC(=O)NNC(=O)CNC(=O)c2cccs2)cc1	751209559	RVBJTTLDDZSCEE-UHFFFAOYSA-N	446.514	1.007	50	20	IDGD	
CCN(CCS(C)(=O)=O)C(=O)NNC(=O)[C@@H](C)Oc1cccc(Br)c1	753002088	BPVINONPSJMNIK-LLVKDONJSA-N	436.328	1.324	50	20	IDGD	
CCc1cc(Br)ccc1NNC(=O)CCn1cnc2c1c(=O)n(C)c(=O)n2C	753168702	FYYHLCICSRZIHV-UHFFFAOYSA-N	449.309	1.292	50	20	IDGD	
Cc1nc(Cl)cc(NNC(=O)[C@@H]2CN(Cc3nc(O)c4ccccc4n3)CCO2)n1	754421650	XXEADOFDCBNLBJ-AWEZNQCLSA-N	429.868	1.431	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)NNC(=O)[C@H](C)Oc2cccc(Br)c2)co1	755411751	FLAVPHZNWJQKFG-VIFPVBQESA-N	446.279	1.179	50	20	IDGD	
O=C(NNC(=O)c1ccncc1)Nc1ccc(S(=O)(=O)NC2=NCCCCC2)cc1	755498696	FGRJOPWRKGEYBK-UHFFFAOYSA-N	430.490	1.799	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2cccc(NC(=O)C3CC3)c2)c1	755638052	BZHSBBLAMYRKTC-UHFFFAOYSA-N	445.501	1.752	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NC2CCN(S(=O)(=O)C(C)(C)C)CC2)cc1	755925166	LQLREVRJCJPAIH-UHFFFAOYSA-N	426.539	1.297	50	20	IDGD	
O=C1CN(c2ccc(NC(=O)NNC(=O)[C@@H]3COc4ccccc4O3)cc2Cl)CCN1	755937310	FZGPZUUSYXWTNR-KRWDZBQOSA-N	445.863	1.269	50	20	IDGD	
O=C(CN(Cc1ccccc1O)C[C@H]1CCCO1)NNC(=O)c1ccc([N+](=O)[O-])cc1	756326056	CHWGRXVRKYBPIL-GOSISDBHSA-N	428.445	1.743	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)ccc1Cl	757475682	DDKJIBMULKRNQY-UHFFFAOYSA-N	429.794	1.364	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1)c1cn[nH]c1	757714595	PMZIGGAJWISTPC-CQSZACIVSA-N	442.501	1.593	50	20	IDGD	
Cc1nn(-c2ccccc2)cc1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	757977934	BQPQRFWWNSJWTO-UHFFFAOYSA-N	442.501	1.898	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)[C@@H](Sc1ccc(F)c(F)c1)c1ccccc1	758035876	ODEGYRWZVFXURB-ZBEGNZNMSA-N	443.497	1.883	50	20	IDGD	
C[C@@H](NC(=O)OC(C)(C)C)[C@@H]1CCCN(CC(=O)NNC(=O)c2cccc(C#N)c2)C1	758791701	JBRXWAVOJHYCAQ-CRAIPNDOSA-N	429.521	1.944	50	20	IDGD	
O=C(NNC(=O)c1cc(F)cc([N+](=O)[O-])c1Br)C(=O)Nc1ccccn1	758840162	ULTTVMHLXJGZIZ-UHFFFAOYSA-N	426.158	1.291	50	20	IDGD	
Cc1ccnc(-n2nccc2NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)c1	760279358	NACHWDVLJZCHJC-INIZCTEOSA-N	436.472	1.746	50	20	IDGD	
Cc1ccnc(-n2nccc2NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)c1	760280235	SSPOSHKYHACNMH-UHFFFAOYSA-N	433.472	1.114	50	20	IDGD	
CCCS(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)NCc2ccco2)c(OC)c1	761279970	FKGTUZLZQXEUNZ-UHFFFAOYSA-N	446.507	1.133	50	20	IDGD	
O=C(NNc1nccc(N2CCOCC2)n1)c1ccc(I)cc1	762869365	XOCQUMZSZYOWOL-UHFFFAOYSA-N	425.230	1.675	50	20	IDGD	
O=C(CCc1ccccc1O)NNS(=O)(=O)c1ccc(C(=O)N2CCCC2)c(F)c1	763433871	JNWSAQNUCMSBJL-UHFFFAOYSA-N	435.477	1.710	50	20	IDGD	
COC(=O)c1cc(OC)ccc1NC(=O)C(=O)NNC(=O)COc1cc(C)ccc1C	763664823	IMLOCOMNYGQLEY-UHFFFAOYSA-N	429.429	1.264	50	20	IDGD	
O=C(COc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1cc2c(cc1Cl)OCO2	763684158	GFYFJLQZKVIDSL-UHFFFAOYSA-N	426.212	1.887	50	20	IDGD	
COC(=O)C(C)(C)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)cc1	763686521	MZVXETMBZCZXQS-UHFFFAOYSA-N	447.875	1.956	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)C(=O)N1CCc2c(F)cccc21	763695590	PZORFOXIBYBJQN-UHFFFAOYSA-N	436.237	1.704	50	20	IDGD	
CCN1CCN(Cc2ccc(NC(=O)C(=O)NNC(=O)c3cccc(Cl)c3)cc2)CC1	763747937	JAYFTDJWESHXAN-UHFFFAOYSA-N	443.935	1.877	50	20	IDGD	
Cc1c(CS(C)(=O)=O)cccc1NC(=O)C(=O)NNC(=O)c1cccc(N(C)C)c1	763754894	XIKGKTFRYFEWHJ-UHFFFAOYSA-N	432.502	1.005	50	20	IDGD	
CC(C)Oc1cc(F)ccc1NC(=O)C(=O)NNC(=O)COc1ccccc1[N+](=O)[O-]	763803694	MQYNHFFLOYFGFW-UHFFFAOYSA-N	434.380	1.686	50	20	IDGD	
O=C(CCc1ncc(-c2ccc(Cl)cc2)o1)NNC(=O)CNC(=O)c1cccnc1	763823539	HTWCZJOWVBUOQB-UHFFFAOYSA-N	427.848	1.900	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)nn1-c1ccccc1	763866649	XIGWJZDHSZYWON-AWEZNQCLSA-N	425.420	1.873	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2cc(F)c(N3CCCCC3)c(F)c2)n1	763893457	VPNYJWLMKSYZIN-UHFFFAOYSA-N	434.447	1.555	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2sccc2C(=O)OC)cc1OC	763911022	KCBIDRORJSQEQB-UHFFFAOYSA-N	435.458	1.732	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(N(C)C(C)=O)c2)cc1OC	763912296	VYTTURLCPRBMFO-UHFFFAOYSA-N	442.472	1.866	50	20	IDGD	
Cc1ccc(Cn2cccc(NC(=O)C(=O)NNC(=O)Cc3ccc(F)cc3)c2=O)cc1	763919878	ZYRRSRZEAYHOBV-UHFFFAOYSA-N	436.443	1.673	50	20	IDGD	
CC(C)Oc1ccc(F)cc1NC(=O)C(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	763945524	YXUIVWOIAQFQIT-UHFFFAOYSA-N	441.419	1.904	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc(N2CCOCC2)c2ccncc12	763956454	OHPKIRVRWWQZSZ-UHFFFAOYSA-N	433.468	1.780	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)C(=O)Nc1ccc(Br)cc1Br	763998037	DKPKLINZLYBYIT-UHFFFAOYSA-N	444.083	1.950	50	20	IDGD	
CCOC(=O)C1=NN(c2ccccc2)[C@@H](C(=O)NNC(=O)CSc2ccccc2O)C1	764038245	OFVZKLFGKSMJBF-MRXNPFEDSA-N	442.497	1.830	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)CN1C(=O)N[C@]2(CCc3ccccc32)C1=O	764042665	LJFQHYIDAHTOBE-NRFANRHFSA-N	440.481	1.025	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cnc3c(c2)c(C)nn3C)o1	764139631	WZWLTDNHTMRMJM-UHFFFAOYSA-N	427.465	1.111	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2O1)C(=O)Nc1ccc(-c2noc(C(F)F)n2)cc1	764163865	NAORTFBVCLMMJH-AWEZNQCLSA-N	443.366	1.764	50	20	IDGD	
CN(C)C(=O)c1cc(NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)ccc1F	764242695	YQWCOFXZCQBWBQ-UHFFFAOYSA-N	425.420	1.268	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)C(=O)Nc1ccnn1Cc1ccccc1F	764243188	ONASQVGMOQBMHL-UHFFFAOYSA-N	434.431	1.811	50	20	IDGD	
CCOCC(=O)NNC(=O)C(=O)Nc1ccnn1[C@H](C)c1cc(Cl)ccc1Cl	764317271	HWUQCKLABXYNTE-SNVBAGLBSA-N	428.276	1.922	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccncc2)cc1I	764356218	QRYJPEQIGAJESU-UHFFFAOYSA-N	438.225	1.323	50	20	IDGD	
CC(C)Oc1ncccc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	764389097	YLLGDCADYJPOKZ-UHFFFAOYSA-N	426.408	1.798	50	20	IDGD	
COc1nccnc1NNC(=O)[C@H](CCSC)NS(=O)(=O)/C=C\c1ccccc1	764465502	YIXARMWOJVJCDB-CTXBLAANSA-N	437.547	1.640	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@@H](C)C(=O)NNC(=O)[C@H](C)S(=O)(=O)C1CCOCC1	764561863	ACTOUBOUXUAHED-KBPBESRZSA-N	446.953	1.854	50	20	IDGD	
CC(=NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C)c1ccc(-c2cccs2)cc1	764813167	VCYMTNGLTLNHRC-UHFFFAOYSA-N	436.497	1.703	50	20	IDGD	
Cc1nnnn1/C(=C/c1ccc(F)cc1)C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C	765318496	IKCDIQLTKAQUQH-FOWTUZBSSA-N	447.471	1.571	50	20	IDGD	
O=Cc1ccccc1OCC(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	766663747	NAMFHPHQTSXHTQ-UHFFFAOYSA-N	444.919	1.497	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCCCN(C)C)cc1C(=O)NNc1ncnc2ccsc12	766673451	GCUGUEVKAIYCRP-UHFFFAOYSA-N	448.574	1.987	50	20	IDGD	
O=C(NNC(=O)c1ccc(Br)s1)NC1CCN([C@H]2CCC[C@H]2O)CC1	767937253	IKMVWULGPOZVRN-NWDGAFQWSA-N	431.356	1.832	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1cc(C)nn1-c1ncccn1	768238576	DMPFEEXCKSNXDM-UHFFFAOYSA-N	429.824	1.032	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)c2ccccc2SCC(N)=O)n[nH]1	768273226	AISRFOQJONPVDJ-UHFFFAOYSA-N	425.470	1.738	50	20	IDGD	
COc1cc(C(=O)NNC(=O)N[C@@H]2CCO[C@]3(CCSC3)C2)cc(OC)c1OC	768516290	KILOLHZHMVPPIF-BFUOFWGJSA-N	425.507	1.711	50	20	IDGD	
CCc1c(C(=O)NNC(=O)CCN2C[C@H](C)O[C@H](C)C2)cnn1-c1ccccc1OC	769648833	SQDKLHGJWXROKI-IYBDPMFKSA-N	429.521	1.704	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)Nc1cnn(CC(=O)NC2CC2)c1	770048735	JKFZGONFJFRFTA-UHFFFAOYSA-N	449.537	1.387	50	20	IDGD	
O=C(Oc1ccc([N+](=O)[O-])c2ncccc12)C1=NN([C@@H]2CCS(=O)(=O)C2)C(=O)CC1	770136874	OKMUZEIDHHVYAQ-LLVKDONJSA-N	432.414	1.214	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc(F)c(F)c1)NNc1ccnc(Br)c1	771551536	FJGZRIRZUYTDFW-UHFFFAOYSA-N	435.250	1.934	50	20	IDGD	
COc1ccc(COCCNC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1	772566430	YMFMMDFUPUKRJH-UHFFFAOYSA-N	425.445	1.103	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCCS1(=O)=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1	772614897	PJLHUXLHTLEJQK-SFTDATJTSA-N	441.553	1.728	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)[C@@H](O)Cc1ccccc1Cl	773234085	XRAKTRAQFJGOLG-KRWDZBQOSA-N	439.921	1.408	50	20	IDGD	
Cc1cc(S(N)(=O)=O)cc(NC(=O)C(=O)NNc2ccc(C(F)(F)F)cn2)c1C	773668053	YNHFVFDSBMWZCE-UHFFFAOYSA-N	431.396	1.446	50	20	IDGD	
O=C(NNc1c(Cl)cccc1Cl)C(=O)Nc1ccn(CC(=O)N2CCOCC2)n1	773694914	UAQHJYDVUNLPOO-UHFFFAOYSA-N	441.275	1.131	50	20	IDGD	
CO[C@H](c1ccccc1F)[C@H](C)NC(=O)NNC(=O)c1csc(N2CCOCC2)n1	775712556	CZJBMCZATGWUFM-LRDDRELGSA-N	437.497	1.839	50	20	IDGD	
C#C[C@@H](NC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1)[C@@H]1CCCO1	776228643	AWLPHMDKZPFDKH-ZBFHGGJFSA-N	448.526	1.674	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cc(C)n([C@@H](C)C3CC3)n2)cc1	777273702	DCDHYGUXXUBXPC-HNNXBMFYSA-N	433.534	1.553	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CC(NC(=O)/C(C#N)=C\c3cc(C#N)n(C)c3C)C2)cc1	777427306	AZPIOUMBRLBFHG-PXNMLYILSA-N	439.497	1.310	50	20	IDGD	
Cc1ccnc2c(S(=O)(=O)NNC(=O)C3CCN(c4ncccn4)CC3)cccc12	777623978	PCNBSHZWIOCOTI-UHFFFAOYSA-N	426.502	1.559	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NC[C@H]2COC3(CCC(C)CC3)O2)c2ccccc2c1=O	777759667	HABOLPMMBWKGMS-HVPFBLEYSA-N	443.504	1.682	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNS(=O)(=O)c1cc(C(=O)O)cc(Cl)c1Cl	777939398	NARXKNYURBMYNJ-UHFFFAOYSA-N	442.277	1.526	50	20	IDGD	
O=C(NNc1ccc([N+](=O)[O-])cc1Br)C(=O)Nc1nc2c(s1)COCC2	778750401	AAEDEDHIAXCIHX-UHFFFAOYSA-N	442.251	1.968	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)c1cn(C)nc1-c1cnn(C)c1	780171913	PQABGSMDIBTGIV-LLVKDONJSA-N	447.293	1.812	50	20	IDGD	
CCOc1ccccc1N1C[C@H](C(=O)NNC(=O)CCNC(=O)OC(C)(C)C)CC1=O	780974130	QJASKDHPTAFBKF-CQSZACIVSA-N	434.493	1.500	50	20	IDGD	
CCOc1cc(/C=C\C(=O)N2CCN(S(=O)(=O)CBr)CC2)ccc1O	781017880	LHAHSJDJIAMZAT-XQRVVYSFSA-N	433.324	1.631	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)nc1Br	782111457	FKPLMXLOEDKXKW-UHFFFAOYSA-N	432.234	1.819	50	20	IDGD	
CS(=O)(=O)c1ccccc1NC(=O)C(=O)NNC(=O)c1ccc(Cl)cc1Cl	782925695	JZYLRJWFRIAHTJ-UHFFFAOYSA-N	430.269	1.797	50	20	IDGD	
Cc1ccccc1NC(=O)NNC(=O)C(=O)Nc1ccccc1C(=O)N1CCOCC1	783415810	KEWUKYHIWWQCQM-UHFFFAOYSA-N	425.445	1.259	50	20	IDGD	
CC(C)c1ccc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1[N+](=O)[O-]	784258485	ZRUBWXLONDVLEL-GOSISDBHSA-N	443.412	1.862	50	20	IDGD	
O=C(NNc1ccc(F)cc1Br)C(=O)Nc1ccc2c(c1)S(=O)(=O)CC2	784803904	PVYATMQCKRZSFP-UHFFFAOYSA-N	442.266	2.000	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)cc1OCC	785066106	NWVZJEBPWSKKHG-UHFFFAOYSA-N	425.445	1.460	50	20	IDGD	
O=C(NNc1c(F)cc(C(=O)NC2CC2)cc1F)C(=O)Nc1cnn(C[C@H]2CCCO2)c1	785099244	BJPNVSOZWYJYCZ-CQSZACIVSA-N	448.430	1.314	50	20	IDGD	
CC(C)Cc1cc(NC(=O)C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)n(C)n1	785099253	BPHVIKASYKOYNP-UHFFFAOYSA-N	434.447	1.871	50	20	IDGD	
CCNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2cc(-c3cc(C)ccc3C)[nH]n2)c1	785126283	NNSVVTDIUZJVBZ-UHFFFAOYSA-N	448.483	1.843	50	20	IDGD	
COC(=O)c1cccc(NC(=O)C(=O)NNc2c(OC)cccc2S(C)(=O)=O)c1C	785339473	SDCOBRXKMMBNFV-UHFFFAOYSA-N	435.458	1.276	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2scnc2COC)c1	785671206	ZEHDPUUSDDWOBS-UHFFFAOYSA-N	426.520	1.395	50	20	IDGD	
O=C(NNc1ccc(-n2cccn2)nn1)C(=O)Nc1cc(Br)c(F)cc1F	786424617	SMCFZVBDHKUHFH-UHFFFAOYSA-N	438.192	1.785	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2)cc1C(=O)N1CCOCC1	787543782	HWIPGPAYHRNMCO-UHFFFAOYSA-N	444.875	1.521	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1ccc(C#N)cc1)C(=O)NNc1nnc(-c2ccccn2)s1	788556765	ROQSASPVHMIZLW-LLVKDONJSA-N	429.487	1.282	50	20	IDGD	
CN(C)[C@@H]1CCOc2c(NC(=O)C(=O)NNC(=O)c3cc(Cl)ccc3O)cccc21	789732777	XITALSYTTCMVTE-OAHLLOKOSA-N	432.864	1.831	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)NC[C@@H]2CC[C@@H](O)C2)cc1	789856758	BRYMGRHRTBZYOX-HIHUVZAKSA-N	437.500	1.618	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)[C@@H]2COCCN2C2CCCC2)c2ccccc2c1=O	790065137	JTVZFFUCWIMFLI-SFHVURJKSA-N	427.505	1.382	50	20	IDGD	
O=C(NNc1nc2ccccn2n1)c1ccc(C(=O)NNc2nc3ccccn3n2)s1	792513160	DRTUZUSRPPDWFS-UHFFFAOYSA-N	434.445	1.347	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNS(=O)(=O)c1ccccc1S(=O)(=O)C(F)F	794578233	HZLFNQRCIQUQMH-UHFFFAOYSA-N	444.441	1.262	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)c1cccc(NC(=O)[C@@H]2CCCO2)c1	795169875	ZSILADALYFMMHN-KRWDZBQOSA-N	432.502	1.811	50	20	IDGD	
CCNC(=O)N(C)c1cccc(NC(=O)C(=O)NNC(=O)COc2ccccc2OC)c1	796991396	DDKQLVHUYSIRAE-UHFFFAOYSA-N	443.460	1.026	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)Nc1ccc(NS(=O)(=O)Cc2ccccc2)cn1	797653673	GXIAWKUUBKOHCN-UHFFFAOYSA-N	429.462	1.522	50	20	IDGD	
C[C@H](c1cccc(S(N)(=O)=O)c1)N(C)C(=O)NNC(=O)Cn1ccc2ccccc21	799920338	DHJQKCISUKQMTK-CQSZACIVSA-N	429.502	1.723	50	20	IDGD	
CN1C(=C(C#N)C(=O)CN2C(=O)c3ccc(F)cc3S2(=O)=O)N(C)c2ccccc21	801664510	VOEXAEAATJIGHC-UHFFFAOYSA-N	426.429	1.861	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)Nc2nnn(Cc3ccccc3F)c2C)c1	801808046	PVGBILAFNZYJIW-UHFFFAOYSA-N	426.412	1.594	50	20	IDGD	
O=C(N=c1cc[nH]cc1)NNC(=O)c1cc(S(=O)(=O)NCc2ccccc2)ccc1O	802033824	POUVAGVMZJVLEZ-UHFFFAOYSA-N	441.469	1.154	50	20	IDGD	
CCN(CC)C(=O)N1CCC(C(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)CC1	802066512	XWTZPKSKBGLWKU-UHFFFAOYSA-N	439.538	1.417	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)C(C)(C)NC(=O)C(F)(F)F)cc1Cl	802074135	YSCJNBJQDPVPMX-UHFFFAOYSA-N	426.779	1.967	50	20	IDGD	
COC(=O)c1cc(C)c(NC(=O)C(=O)NNC(=O)COCc2ccccc2)c(Cl)c1	806979047	LPXNGZBFLJIUAL-UHFFFAOYSA-N	433.848	1.738	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)NCCNS(=O)(=O)c2cccc(Cl)c2Cl)o1	807453770	GVGPRSIHXNVQGR-UHFFFAOYSA-N	435.289	1.817	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)N[C@@H]3CCCN(C(=O)N4CCCC4)C3)nc21	807459570	KXEHZDDVGCZCMX-CYBMUJFWSA-N	445.528	1.593	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@](C(=O)NNC(=O)CNC(=O)c2ccco2)(C(F)(F)F)C1	808344387	UZSMDJXBUPQXBV-QGZVFWFLSA-N	448.398	1.346	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)cc2[nH]ccc12	808934647	OXZBQJPUDGZDJB-NSHDSACASA-N	442.403	1.647	50	20	IDGD	
COc1ccc(F)cc1C=NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	812221434	BAUWIQAHUJVNHZ-UHFFFAOYSA-N	449.504	1.938	50	20	IDGD	
CC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	812728818	ATQNTIVFNJROKP-HXUWFJFHSA-N	443.529	1.609	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)Cc2ccsc2)nnn1CCOc1ccc(F)cc1	815568066	UHALMABYTPMHFS-UHFFFAOYSA-N	446.464	1.195	50	20	IDGD	
COCc1cnc(NC(=O)C(=O)NNc2cc(C(=O)OC)ccc2Br)s1	815865858	HLXGLSUSDWFNKU-UHFFFAOYSA-N	443.279	1.920	50	20	IDGD	
Cc1nn(C)c(C)c1S(=O)(=O)N[C@H](C)C(=O)NNc1ncnc(Cl)c1C(C)C	816486207	TVJKLUUZRIDBMG-SNVBAGLBSA-N	429.934	1.414	50	20	IDGD	
COc1ccc(-n2cc(O)c(C(=O)NNc3ccccc3S(=O)(=O)N(C)C)n2)cc1	817053691	CFSYOTGEZSXEQP-UHFFFAOYSA-N	431.474	1.594	50	20	IDGD	
C[C@@H]1Cc2ccccc2N1C(=O)[C@H]1CCCC[C@@H]1C(=O)NNC(=O)N1CCN(C)CC1	819721448	TXINQOMXOSXXOX-NEWSRXKRSA-N	427.549	1.759	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)CCc2nc(O)c3c4c(sc3n2)CCC4)C[C@@H](C)O1	822201310	AFXTUFZCQKSFCI-CHWSQXEVSA-N	447.561	1.465	50	20	IDGD	
O=C(CNc1ccccc1)NNC(=O)c1ccc(Cl)c(S(=O)(=O)N2CCCC2)c1	823327920	OMORLRORKRJLSP-UHFFFAOYSA-N	436.921	1.998	50	20	IDGD	
O=C(NNc1ncccn1)C1CCN(S(=O)(=O)c2ccc(Br)s2)CC1	913044432	ZNPFDZFWBIUYMQ-UHFFFAOYSA-N	446.352	1.845	50	20	IDGD	
COc1cc(C=O)ccc1OCC(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12	913588193	VSGHYBCFKUHRKO-UHFFFAOYSA-N	438.440	1.639	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)CCCOc2ccc3c(c2)CCC(=O)N3)c2ccccc2c1=O	914459685	BDXDSPQAMYZTGV-UHFFFAOYSA-N	449.467	1.438	50	20	IDGD	
COCCN1C[C@@H](C(=O)NNc2ccc(S(=O)(=O)c3ccc(C)cc3)cc2)CC1=O	914466464	DEICPMBHMRZMMU-INIZCTEOSA-N	431.514	1.766	50	20	IDGD	
Cc1nc2c(C#N)cnn2c(C)c1CCC(=O)NNC(=O)c1nnc(O)c2ccccc12	914781725	MVNNMBZTRRKCCK-UHFFFAOYSA-N	430.428	1.260	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)NC[C@H]2CN(Cc3ccccc3)CCO2)c1	915894709	NZCHELXTUIBSRM-NRFANRHFSA-N	426.517	1.914	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(NC(=S)NNC(=O)CCN2CCCCCC2)c1	916116768	AVHYVICLBDTQMP-UHFFFAOYSA-N	427.596	1.521	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1cc(-c2c(C)nn(C)c2C)[nH]n1	916134427	LWRDLJGAFBQGND-UHFFFAOYSA-N	444.521	1.103	50	20	IDGD	
COCCn1c(C)cc(C=NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c1C	916258548	ZAGUDGIAEUPIJL-UHFFFAOYSA-N	448.545	1.536	50	20	IDGD	
CN(Cc1ccccc1)C(=O)N1CCN(CC(=O)NNC(=O)c2cccc(Cl)c2)CC1	917134296	RBOUMYJZTBVDFO-UHFFFAOYSA-N	443.935	1.971	50	20	IDGD	
O=C(CN1CCC(C(=O)NCc2ccc(F)cc2)CC1)NNC(=O)c1ccc(F)cc1	917141456	GPFUMWBAUUYPFD-UHFFFAOYSA-N	430.455	1.754	50	20	IDGD	
COc1ccc(-c2nnc(SCC(=O)NNC(=O)c3ccc(C)cc3)n2N)c(OC)c1	917345001	LRPIVHLDAJVMPL-UHFFFAOYSA-N	442.501	1.538	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1	918002027	LVTZFMOMLONGOW-NSHDSACASA-N	434.478	1.902	50	20	IDGD	
C[C@@H](CN1CCCC1=O)NC(=O)NNC(=O)COc1ccc(OCc2ccccc2)cc1	918100093	NILAWAZYDJEVSP-KRWDZBQOSA-N	440.500	1.986	50	20	IDGD	
C=CCCOCC(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccc(OC)cc2)c1	920431677	MOLZGTPLHWBRRO-UHFFFAOYSA-N	433.486	1.850	50	20	IDGD	
O=C(NCCc1cccs1)NNC(=O)[C@@H]1CS[C@H](Cc2ccccc2F)C(=O)N1	920859307	BLHRQFXNDLJHLS-JKSUJKDBSA-N	436.534	1.603	50	20	IDGD	
CC(C)[C@H](C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)N1C[C@@H](C)O[C@H](C)C1	921203190	TXDWDWUCEKFBTQ-TXTKFYIRSA-N	445.608	1.480	50	20	IDGD	
CCC(CC)[C@H](C(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1)N1CCOCC1	1116134510	AJDKHGMARCKYIO-GOSISDBHSA-N	440.585	1.918	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)CCc2ccc3c(c2)CCO3)CC1	1319127284	MEODRDOOXMLFQA-UHFFFAOYSA-N	445.545	1.029	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@@H](C(=O)NNc2cncc(Br)c2)[C@H](C)O)cc1	1341980608	SFJXEERWIWUNDR-XHDPSFHLSA-N	443.323	1.324	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnc4cc(C)ccn4c3=O)C2)C1	1777999413	ZROZLMDAIDFORU-KKSFZXQISA-N	432.908	1.464	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2n[nH]c3c2CC[C@@H]3C)C1	1778603768	AAMJBROVVKZFJT-RYSHRAHSSA-N	438.956	1.841	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Cl)C2)[C@@H]1ON=C(c2ccccc2)O1	1779260815	RPXGRQCGMCIUCX-VVVONTASSA-N	439.871	1.769	50	20	IDGD	
C[C@@H](Cn1cncn1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)Br)C2	1779501617	CZTZWKYIHKEMBM-LUXYFRNMSA-N	442.358	1.212	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(CCN(C(=O)c3cncc4cnccc34)C2)C1	1780011281	BIKWTAXEYSBOCM-NRFANRHFSA-N	428.565	1.925	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Br)C1	1780776856	GRHAKMFTJRYJNJ-RTWAVKEYSA-N	429.714	1.445	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(CS(C)(=O)=O)nc3)CCO2)C1	1781219812	WHRWJGZLYHZLOH-VQIMIIECSA-N	443.953	1.087	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)c3cc4cccnn4n3)CCO2)C1	1781231263	IWODCEHKQNLAOQ-ZWKOTPCHSA-N	426.304	1.409	50	20	IDGD	
Cc1cccc(CCC(=O)N2CCO[C@]3(CCN(C(=O)[C@H](F)Br)C3)C2)n1	1781326697	QZHLVYNMIIBRSP-FUHWJXTLSA-N	428.302	1.843	50	20	IDGD	
O=C(c1cn2ccccc2n1)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781329870	MFPPPIADSXFLNU-PBHICJAKSA-N	425.258	1.468	50	20	IDGD	
O=C(c1nccc2occc12)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781331375	PWFSNUAUJAZKQA-WMLDXEAASA-N	426.242	1.962	50	20	IDGD	
Cc1ccn2c(C(=O)N3CC[C@]4(C3)CN(C(=O)[C@H](C)Br)CCO4)cnc2c1	1782491976	GUPVDFITCWSACH-LIRRHRJNSA-N	435.322	1.870	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](C)CN(CC)CC)C2)C1	1782701718	HIXYBLUMEYIKIG-BXWFABGCSA-N	432.403	1.968	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H]3C[C@@H]3F)C2)C1	1782934333	CFWJAZJEAKUOHN-DKICVRJWSA-N	435.408	1.322	50	20	IDGD	
O=C(CCNC(=O)c1ccccc1)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Cl)C2	1783102311	DQLCPAKAZGSCKO-PLMTUMEDSA-N	439.915	1.855	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)CN3CCC(C)CC3)CCO2)C1	1783344920	WRASGIOTVDYNRB-VQIMIIECSA-N	430.387	1.722	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cccc4ccnn34)CCO2)C1	1783352976	LOXJLDFNXPCRNV-HNAYVOBHSA-N	435.322	1.951	50	20	IDGD	
CC(C)c1nc(CC(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](C)Br)C3)C2)no1	1783529332	IMBITAWWOSYFRK-SJCJKPOMSA-N	429.315	1.349	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)Cc1ccccc1Cl)CCO2	1783933806	HMCMJRNYMVNQQB-NRFANRHFSA-N	436.940	1.085	50	20	IDGD	
Cc1nc(C)c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]3C2)o1	1783969610	IHNMJGKUXZOSIX-HJPIBITLSA-N	428.327	1.916	50	20	IDGD	
Cc1nn(C)c(C)c1CC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2	1784512604	LGZDZKMHEBNIJS-RTBURBONSA-N	431.364	1.646	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)Cc3ccc(F)cc3OC)C2)C1	1785660243	GSPYXCSTHYWOCP-JXFKEZNVSA-N	428.888	1.461	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)c1n[nH]c(C2CC2)c1F	1785765222	WFZJZFBYHGEJBZ-AVGNSLFASA-N	443.317	1.805	50	20	IDGD	
C[C@@H](Br)C(=O)NC1(c2ccc(NC(=O)C[C@@H]3NC(=O)NC3=O)cc2)CCC1	1786764539	PAAPMQURDVYNTM-MFKMUULPSA-N	437.294	1.502	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc([N+](=O)[O-])cc3F)C[C@@H]21)[C@@H](F)Cl	1787450635	REOPIOOKFBPDFA-MOWSHJCCSA-N	431.823	1.791	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21)[C@H]1ON=C(c2ccccc2)O1	1788521668	FZCNJFABFKWKGP-WFTHSTBKSA-N	442.299	1.505	50	20	IDGD	
CCCC(=O)N[C@@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]2C1	1788764609	OPUZOTAPCHUOSY-QAETUUGQSA-N	427.618	1.122	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(Cl)ncn3)[C@H]2C1	1789059458	HTPCEPDLTCIQHS-BLFANLJRSA-N	431.718	1.507	50	20	IDGD	
CC(=O)N/C(=C\c1ccco1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21	1790180884	QIVKNDJPDMVMNK-UJAJJJNPSA-N	444.315	1.540	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21	1791057835	IDROERBLFMZOEM-RHYQMDGZSA-N	426.149	1.535	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4occc4c3O)C[C@@H]21	1791257248	UMLDTXJLQSZSRF-PTOXDTDZSA-N	436.892	1.986	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1ccc(C2(NC(=O)CCn3cncn3)CCC2)cc1	1791603267	MYCXPENUGGTSHL-UHFFFAOYSA-N	427.509	1.175	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)Oc3ccccn3)[C@H]2C1	1791626287	AADNXVVTBYYAOO-QXKUPLGCSA-N	440.338	1.612	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1C[C@@H]1c1ccc(Cl)cc1)C2)[C@H](O)CCl	1792981386	KSYUBYSISVLINL-YFXBATGZSA-N	427.328	1.633	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CSc1ccncc1	1793950143	RWBZMGJTTQGORL-NFFDBFGFSA-N	428.352	1.547	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CNC(=O)c1cccs1	1794115172	HQXONRRTCAOIQE-UMPJEAMMSA-N	427.954	1.475	50	20	IDGD	
O=C(/C=C/c1ccccc1[N+](=O)[O-])N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1	1796189641	KRGNLNKTQKJYPV-NBWRFPAISA-N	449.272	1.240	50	20	IDGD	
C=CCCC(C)(C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1	1796440346	SOZGDVJTHTUSGX-BRTCSPBQSA-N	443.548	1.702	50	20	IDGD	
COc1cc(OC)cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CO[Si](C)(C)C)C3)c1	1798898571	OBNAFCNBRYCDCW-CWPLJXCYSA-N	436.581	1.759	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CC(=O)Nc1ccc(F)cc1	1799035877	XLKWPFXCYNREEL-UESRRSCYSA-N	425.888	1.761	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1C[C@@]13C(=O)Nc1ccccc13)C2	1799269769	FABVMPSXWMICKI-PJHOBBQFSA-N	431.920	1.503	50	20	IDGD	
CCOC(=O)N1CCC(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](Cl)CC)CC1	1799271072	LCMQWHQJIVPPTB-YYIAUSFCSA-N	429.945	1.462	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(O)c(F)c1	1799546963	NXQUDSBIHVCQPG-YGSHXTJESA-N	429.286	1.766	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2)c1ccc(Br)c(O)c1	1799584235	FQTCILGUEQPTCM-DJBIQUGXSA-N	435.677	1.892	50	20	IDGD	
Cc1c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](O)CCl)C3)cc(Cl)cc1[N+](=O)[O-]	1799765493	KFUDIYZEIUOWRG-OJXGSEEGSA-N	446.287	1.360	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc(C#N)cc1)C2	1800637654	FXVTVEWOGDBGQN-ZMMAXQRCSA-N	434.334	1.864	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1n[nH]c3c(Cl)cccc13)C2	1800979765	ZWLKFKPFIQVRFD-JLUCKKNBSA-N	441.315	1.673	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)Oc1cccnc1	1801405302	MQFJEILWEYQJHH-AQDIXCGQSA-N	426.311	1.222	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)c1ccc(F)c(C(F)(F)F)c1	1801856067	TVSMAFRYZJDBAI-JLUCKKNBSA-N	438.805	1.647	50	20	IDGD	
CN(C)C(=O)NCC(=O)NC[C@@H]1CCN(C(=O)[C@](C)(Cl)CCl)[C@H]1c1cccnc1	1802681288	PHNYSZDDDIIODT-URLQWDBASA-N	444.363	1.595	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2[nH]nc3ncccc23)[C@@H]1c1cccnc1)[C@H](O)CCl	1803140246	YQKLNFOECUKHRX-YSVLISHTSA-N	428.880	1.272	50	20	IDGD	
Cc1nscc1C(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1805192984	MYAUIRVOZQJZRK-OXQOHEQNSA-N	444.561	1.539	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1ccccc1O	1805195563	CPWRBRXWJUYXMJ-PGRDOPGGSA-N	445.284	1.100	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)C[C@H](N)c2cccnc2)[C@H]1c1cccnc1	1807267659	TYABDTYQBVJRPG-XODKDNOYSA-N	445.951	1.826	50	20	IDGD	
CC(C)CNC(=O)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@H]1c1cccnc1	1808447802	WFWVOCKIZXELQG-SOUVJXGZSA-N	443.317	1.550	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)CN(C)C(=O)C(=O)O)[C@@H]1c1cccnc1	1812389038	WXGIXRAJOQJDNL-ZOBUZTSGSA-N	438.912	1.038	50	20	IDGD	
O=C(Nc1cccnc1)C(=O)N1CC[C@@H](CNC(=O)C(Cl)Cl)[C@@H]1c1cccnc1	1813077370	HEWWXXIBPBGJGD-ZFWWWQNUSA-N	436.299	1.925	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)CN2C(=O)C=CC2=O)[C@H]1c1cccnc1	1813175650	LTSGLAGVKVZVBD-GQIGUUNPSA-N	432.908	1.420	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)c1ccc(CO)c(F)c1	1813990304	GNNILVWIIBZZIM-SNRMKQJTSA-N	435.883	1.632	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)C(F)(F)C(F)(F)C(=O)O)[nH]n1)[C@@H](O)CCl	1814867557	NICBXWXUZLWKGF-IUCAKERBSA-N	444.769	1.357	50	20	IDGD	
CC1=CC[C@H](C(=O)N[C@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)CC1	1815356862	UQOZROZIJCGSJR-YOEHRIQHSA-N	439.346	1.795	50	20	IDGD	
Cc1ccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)nc1C	1816235650	HOFMUFUIIWOCPT-HXUWFJFHSA-N	447.304	1.721	50	20	IDGD	
Cc1ccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)c(O)c1	1817479412	MHUZVJJRJQJMQZ-LJQANCHMSA-N	448.288	1.723	50	20	IDGD	
CC(C)c1cc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)n[nH]1	1820285470	RYFQOZMOVAAZIO-KRWDZBQOSA-N	444.540	1.935	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)CCn2cncn2)[nH]n1)[C@@H](F)Br	1820936558	BWAVRYXLZBXKLA-BXUZGUMPSA-N	428.266	1.774	50	20	IDGD	
CCNC(=S)NCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](C)Br)[nH]n1	1821644019	FQWKOHHIPVSCRP-JQWIXIFHSA-N	445.387	1.669	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CNC(=O)c2ccco2)[nH]n1	1822368525	JBTJKVHMEHEFJJ-OCCSQVGLSA-N	437.884	1.679	50	20	IDGD	
COC1(CC(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)CCC1	1823072240	WYKWAKBFCAFUMU-GOSISDBHSA-N	440.309	1.355	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](O)NC(=O)OC(C)(C)C)sc2C1	1823572403	XSVMKXHFXLZPTF-FTGAXOIBSA-N	446.957	1.916	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CN2C(=O)CNC2=O)CC1	1824904957	VUBJTPSKJVNBBA-IFXJQAMLSA-N	447.363	1.394	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(O)nc(O)c1)CC2	1825641062	GNGQRANQQNZNSJ-VXNVDRBHSA-N	441.307	1.959	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)Cc1nnc(C)s1)CC2	1825998726	JBDWEXUPJOXZOE-NXEZZACHSA-N	429.955	1.712	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CNC(=O)OC(C)(C)C)CC2	1826004923	UYQGFHBGCLIDAP-WDEREUQCSA-N	446.957	1.834	50	20	IDGD	
O=C([C@H](O)CCl)N1CCC([C@H]2CCCCN2C(=O)COC(=O)C(F)(F)F)CC1	1828833156	JGQGMTOADLATDZ-CHWSQXEVSA-N	428.835	1.311	50	20	IDGD	
O=C(c1cccnc1S)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1829798922	RZGBUOXSZNIBKQ-BLLLJJGKSA-N	448.314	1.131	50	20	IDGD	
CCOC(=O)O[C@@H](C)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830366231	LJTMNSWRLCKYQH-IFXJQAMLSA-N	434.917	1.269	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)/C=C/c3ccco3)C2)C1	1830536150	YVQHENGLMMMDDX-UPILZFLTSA-N	441.322	1.780	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3CCCSC3)C2)C1	1830547031	ZNQQIFQVDVJJCP-RKVPGOIHSA-N	449.411	1.617	50	20	IDGD	
O=C(c1cc(-c2ccccc2)on1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1830719398	CONYIGBEHJJLHR-UWJYYQICSA-N	449.891	1.011	50	20	IDGD	
CC1CCN(CC(=O)N2CCO[C@@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)CC1	1831093596	MLUXQAZBMLKFJT-NRFANRHFSA-N	429.989	1.440	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C(C)=O)[nH]n3)C2)C1	1831644407	WZYHEILSENZLDZ-LIRRHRJNSA-N	426.901	1.090	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cc[nH]c4nccc3-4)CC2)CC1)[C@H](O)CCl	1833310167	APWZXNFDVOBTLR-GOSISDBHSA-N	433.940	1.299	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)[C@H]3CCC(=O)NC3)CC2)CC1	1833529650	CUGSSBLUOJAYCZ-MAUKXSAKSA-N	426.989	1.492	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(C)nc3)CCO2)C1	1833998686	NHODFEPZIPBOFU-VQIMIIECSA-N	440.338	1.634	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)c3ccn(C)n3)CC2)CC1	1834215027	DDVDGTZJLIWJMQ-CQSZACIVSA-N	440.386	1.636	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cncc(F)c3)CCO2)C1	1834360033	RJPFHPHOLGFIFU-ROUUACIJSA-N	434.295	1.527	50	20	IDGD	
Cc1ccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)cc1	1835085615	MBDZLBDKZBVDSJ-UZLBHIALSA-N	439.350	1.777	50	20	IDGD	
CC[C@H](C)[C@H](O)C(=O)N1CCC(N2CCC(NC(=O)[C@H](F)Br)CC2)CC1	1836414168	XECFJGGAILHZEQ-RCBQFDQVSA-N	436.366	1.656	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccnc(Cl)c3)C2)C1	1837712445	RJRJJEKENLDFEJ-LJQANCHMSA-N	441.988	1.657	50	20	IDGD	
C/C(=C\c1cccnc1)C(=O)N1CCOC[C@@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1837717911	RASORDCZGAMLTN-YGYUYSJASA-N	447.608	1.793	50	20	IDGD	
O=C(Cn1ccncc1=O)N1CCC(OC2CCN(C(=O)C(Cl)Cl)CC2)CC1	1838724716	VTUHWIBZTRLXCJ-UHFFFAOYSA-N	431.320	1.046	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc4snnc4c3)C2)C1	1839146766	VPMHDYGGWIDARI-SCLBCKFNSA-N	439.925	1.174	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3c(C)nn(C)c3C)C2)C1	1839148779	JOKQMVIGYMRFGD-XLIONFOSSA-N	426.945	1.053	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cc(F)ccc3F)C2)C1	1839149674	ODYISOBKWSNTNF-OXJNMPFZSA-N	430.879	1.981	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(O)ccc3O)CCO2)C1	1839448844	YNHNDEWSKMYHPK-MOPGFXCFSA-N	447.315	1.404	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc4ccnn34)CCO2)C1	1839496960	LYDZYNNJAXOYQE-UWJYYQICSA-N	434.924	1.812	50	20	IDGD	
C[C@H](Cc1ccc(F)cc1)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1	1839762968	LSDIRNAIDBZTCV-YWMUFLPLSA-N	442.915	1.060	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)n3cccc3)C2)C1	1839967368	KEKOEPRWEFZKMN-GJYPPUQNSA-N	442.354	1.679	50	20	IDGD	
CCCc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](Cl)COC)CCO3)cc1	1840154452	XDARZOBXGKZTAE-UGKGYDQZSA-N	438.952	1.963	50	20	IDGD	
C[C@H](Oc1ccccc1)C(=O)N1CCOC[C@@]2(CN(C(=O)C(Cl)Cl)CCO2)C1	1840189844	OLHMEGZTXOJVPM-LIRRHRJNSA-N	431.316	1.714	50	20	IDGD	
CN1CCCC[C@H]1C(=O)N1CCCC12CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1841365906	IKSFJUBZKMZTQG-HOTGVXAUSA-N	442.988	1.806	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)c2cnn(C)c2)C1	1842444516	DDDONYKYFHWIPK-UHFFFAOYSA-N	427.417	1.384	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2ccc(C=O)s2)C1	1843017450	WHJUYWOAASCRKI-LPYMAVHISA-N	427.486	1.512	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)[C@H](C)Cc1ccccn1)C2	1843417085	ULOOYQGAUJLNIG-MSZQUAHTSA-N	436.516	1.598	50	20	IDGD	
O=C(CCS(=O)(=O)c1ccccc1)N1CC2(CCCN2C(=O)[C@@H](F)Br)C1	1845216668	DGKOGKSZLCAJOG-OAHLLOKOSA-N	447.326	1.744	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)N2CCCC23CN(C(=O)[C@H](O)CCl)C3)CC1	1847145567	BHXVYMMXXPZZRT-OAHLLOKOSA-N	429.945	1.437	50	20	IDGD	
CC[C@H](NC(C)=O)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O	1847295231	CWFWESUQSHFDGH-BZSNNMDCSA-N	446.460	1.250	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](CC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](O)CCl)C1	1847559415	RHHLPIXJDPDNQO-LUKYLMHMSA-N	443.972	1.825	50	20	IDGD	
Cc1noc(C)c1S(=O)(=O)N1CCC(C(=O)NNC(=O)c2cccc(N(C)C)c2)CC1	17252379	TXBOFIWHYHQGHE-UHFFFAOYSA-N	449.533	1.219	50	20	IDGD	
CNS(=O)(=O)c1ccc(CCC(=O)NNC(=O)c2cc(-c3ccccc3)n[nH]2)cc1	17519245	WCUGVAYZMJPVBE-UHFFFAOYSA-N	427.486	1.379	50	20	IDGD	
O=C(COC(=O)Cc1csc(N2CCCC2=O)n1)NNC(=O)c1ccc(Cl)cc1	19476294	CCAHLQPKXYRPFT-UHFFFAOYSA-N	436.877	1.470	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)Cc1ccc(OC(F)F)cc1	27193187	WIQHGDJJAPBLFN-UHFFFAOYSA-N	426.445	1.893	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2C(=O)COc3ccccc32)cc1Br	726278026	APTIQTBTRMHSIS-UHFFFAOYSA-N	434.246	1.644	50	20	IDGD	
CC1CCC(NS(=O)(=O)CC(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)CC1	728211286	PWYHUPJSFFNTSZ-UHFFFAOYSA-N	444.579	1.069	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3csc([N+](=O)[O-])c3)cc2)CC1	728214626	CJVLRMAHNBYAET-UHFFFAOYSA-N	425.492	1.349	50	20	IDGD	
CS(=O)(=O)N1CCC[C@H]1C(=O)NNc1ccc(S(=O)(=O)Nc2ccccc2)cc1	728217955	WEQRCAUMXQJKAW-KRWDZBQOSA-N	438.531	1.355	50	20	IDGD	
COc1ccc2oc(C)c(C(=O)OCC(=O)NNC(=O)[C@@H]3COc4ccccc4O3)c2c1	728329435	AEYJWFZYCBJKCL-SFHVURJKSA-N	440.408	1.894	50	20	IDGD	
Cn1c(=O)nc(O)c2c(C(=O)NNC(=O)c3cccc(OC(F)F)c3)cc(C3CC3)nc21	728544438	CFHRFSGKTIUQAS-UHFFFAOYSA-N	445.382	1.588	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)N3CCN(C(=O)CN4CCCC4)CC3)cc2C1	728715357	YHKLXICLSSRKOF-HNNXBMFYSA-N	433.578	1.467	50	20	IDGD	
COCCS(=O)(=O)c1ccc(C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)cc1	728972655	XEINLMVABUXPGT-UHFFFAOYSA-N	448.469	1.860	50	20	IDGD	
CC(C)Oc1ccc(NC(=S)NNC(=O)C/N=C2/NS(=O)(=O)c3ccccc32)cc1	728986161	OQQAHKLISOPQJH-UHFFFAOYSA-N	447.542	1.530	50	20	IDGD	
COc1cccc([C@@H](CNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)N(C)C)c1	729045569	WQJKIJGGRWMQCF-LJQANCHMSA-N	441.536	1.335	50	20	IDGD	
CC(C)c1c(C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)cnn1-c1cccc(Cl)c1	729276590	HVCAIGWJEPPNDV-NSHDSACASA-N	427.914	1.348	50	20	IDGD	
Cc1cc(C)nc(-n2nc(C)c(CC(=O)NNC(=O)CCN3C[C@H](C)O[C@@H](C)C3)c2C)n1	732262863	WTKRGEYAOQPZTR-HOTGVXAUSA-N	443.552	1.085	50	20	IDGD	
COC(=O)c1cc(OC(=O)C2CCN(c3ccc4nncn4n3)CC2)ccc1[N+](=O)[O-]	732652844	SIKGLEPMRPYBDZ-UHFFFAOYSA-N	426.389	1.641	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCCN(C)CC(F)(F)F)cc1Br	732673392	FWQICMLWOXYZQK-UHFFFAOYSA-N	427.221	1.896	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)N[C@H]2CCN(C3CCN(C)CC3)C2)c1	734282733	CJOZAMDOARYXBE-SFHVURJKSA-N	431.581	1.996	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)CCC1CC1)N(S(C)(=O)=O)CC2	734543680	SUILDKLZTIXGKK-MRXNPFEDSA-N	439.534	1.290	50	20	IDGD	
COc1ccc([C@@H]2[C@@H](C(=O)OCC(=O)NNC(=O)c3cccs3)CCC(=O)N2C)cc1	734617639	KONCKMRVVUXXAX-HNAYVOBHSA-N	445.497	1.671	50	20	IDGD	
CN1CC[C@H](OC(=O)/C(C#N)=C/c2cn(CCC(N)=O)nc2-c2ccc(Cl)cc2)C1=O	734880379	DNEHJOZFVNBJLX-SHRNQRGKSA-N	441.875	1.760	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)NC2CCN(C[C@@H]3CCOC3)CC2)cc1OC	736392911	UKHIGSUKWLKJTF-INIZCTEOSA-N	434.537	1.929	50	20	IDGD	
CC(C)NC(=O)C(=O)NNC(=O)c1cc(OCC(F)(F)F)ccc1OCC(F)(F)F	737779178	ZTZVNSPGUKHART-UHFFFAOYSA-N	445.316	1.854	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCCCC2)cc1)NNc1ncnc2[nH]cnc12	740746680	DHWFOXDTTFQBKB-UHFFFAOYSA-N	429.506	1.603	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)CC(N)=O)cc2)cc1	742473298	AQIZRXAYSYHORH-UHFFFAOYSA-N	447.513	1.445	50	20	IDGD	
O=C(NNc1ccc(Cl)cc1Cl)C(=O)Nc1ccnn1[C@H]1CCS(=O)(=O)C1	742904129	AEOUMPDLZYFQGE-JTQLQIEISA-N	432.289	1.631	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(OCC(F)(F)F)cc1)c1cc([N+](=O)[O-])ccc1O	743268382	OMPBDTGYOFXMFM-UHFFFAOYSA-N	435.336	1.865	50	20	IDGD	
COc1ccc(C(=O)NCC(=O)NNC(=O)C(F)(F)Oc2ccccc2)cc1[N+](=O)[O-]	743562836	YYMBJXJHMAZNLT-UHFFFAOYSA-N	438.343	1.152	50	20	IDGD	
COc1cccc(CO[C@@H](C)C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)c1	744619107	HXUVBKPPUQHKMH-INIZCTEOSA-N	449.529	1.765	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1ccc(NC(=O)C2CC2)cc1	744619297	MFZOVLZNXADILU-UHFFFAOYSA-N	444.513	1.813	50	20	IDGD	
O=C(NNC(=O)c1nccn2ccnc12)c1nn(Cc2ccccc2)c(=O)c2ccccc12	746095681	WRAKJTUKRMUYTH-UHFFFAOYSA-N	439.435	1.562	50	20	IDGD	
O=C(CCSCc1nc(O)c2ccccc2n1)NNC(=O)Cc1cn2ccccc2n1	746640429	DQRSAHBKXHFGKT-UHFFFAOYSA-N	436.497	1.997	50	20	IDGD	
COc1cc(C)nc(NNC(=O)NCc2cccc(S(=O)(=O)N3CCCCC3)c2)n1	746761764	MNKWIVOJUKAWLT-UHFFFAOYSA-N	434.522	1.795	50	20	IDGD	
COC(=O)c1ccsc1N1CC[C@H](NC(=O)NNC(=O)COCc2ccccc2)C1=O	746779833	LEAOTTVJJWOWLD-HNNXBMFYSA-N	446.485	1.187	50	20	IDGD	
CN(CCOc1cccc(CNC(=O)NNC(=O)Cc2ccncc2)c1)C1CCOCC1	747500569	KXCBWJUYWFJJQZ-UHFFFAOYSA-N	441.532	1.644	50	20	IDGD	
COc1ccc(C=NNC(=O)CSc2nn(C)c(=O)n(C)c2=O)cc1OCCC(C)C	747612153	VVHUPZLPDZJWHA-UHFFFAOYSA-N	449.533	1.155	50	20	IDGD	
Cc1c(C(=O)NNc2ccc(F)cc2Br)cnc2c1c(=O)n(C)c(=O)n2C	748076559	IWXDHXORYKIGJC-UHFFFAOYSA-N	436.241	1.599	50	20	IDGD	
C=CCCCC(=O)NNC(=O)C[C@H]1c2cc(OC)c(OC)cc2CCN1S(C)(=O)=O	748285959	MNLBXOSWXYXJJG-INIZCTEOSA-N	439.534	1.456	50	20	IDGD	
C[C@H](CC(N)=O)NC(=O)/C(C#N)=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	748719524	PEVLSKRPKBRAOJ-OJLMPMFISA-N	428.880	1.366	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2cc(OC)c(C(=O)O)cc2Cl)cc1OC	749142628	PREUGJJAHIFEMZ-UHFFFAOYSA-N	444.849	1.687	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(C(=O)NCC(=O)NNc2cccc(C#N)c2)cc1	749259915	LZNGVYQCIHCXSB-UHFFFAOYSA-N	429.502	1.462	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C1CCN(C(=O)/C=C/c2ccccc2)CC1	751209141	LETSNEZJZUXMNV-CMDGGOBGSA-N	440.525	1.577	50	20	IDGD	
CC(C)c1ccc(-n2c(NNC(=O)Cn3ccc(O)nc3=O)nc3ccccc3c2=O)cc1	752037978	ULDRADLQAIGJAF-UHFFFAOYSA-N	446.467	1.915	50	20	IDGD	
CCn1cc([C@H]2C[S@](=O)CCN2C(=O)NNC(=O)c2c(C)nc3ccccn23)cn1	753030521	HXLJBKLLSXNWIH-DHMKHTPVSA-N	429.506	1.019	50	20	IDGD	
CCOC(=O)c1sc([C@@H](C)NCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)nc1C	755030265	FLSBSVYBFUWUFH-LLVKDONJSA-N	435.462	1.648	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCC(=O)NNc1nc(-c2ccncc2)no1	755220671	FFPIAWZJPLXGCA-CYBMUJFWSA-N	431.453	1.090	50	20	IDGD	
O=C(Cc1ccc(Cl)cc1)NNC(=O)NC1CCN(S(=O)(=O)C(F)(F)F)CC1	755301471	JUWVOLZSQQTAJQ-UHFFFAOYSA-N	442.847	1.527	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2ccc(NC(=O)NNC(=O)c3ccccn3)cc2)C[C@@H](C)O1	755424475	UQZKRVPPBPWZQX-OKILXGFUSA-N	433.490	1.346	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)Nc1ccc(S(=O)(=O)C(F)F)cc1	755444656	QOGGDNMIULQSTQ-UHFFFAOYSA-N	437.384	1.798	50	20	IDGD	
CCOc1ccc(NC(=O)NNC(=O)c2ccncc2)cc1S(=O)(=O)N1CCCC1	755468765	CERFJYGICGAYSB-UHFFFAOYSA-N	433.490	1.731	50	20	IDGD	
O=C(NNC(=O)c1ccccn1)Nc1ccc(S(=O)(=O)NC2=NCCCCC2)cc1	755498619	DPUIBKDJAXOIDH-UHFFFAOYSA-N	430.490	1.799	50	20	IDGD	
CC(C)C[C@@H](C)OCCC(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	755809280	JSAUWQLDOVLPIU-MRXNPFEDSA-N	427.571	1.302	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)Nc1ccc(CC(=O)N2CCOCC2)cc1	755861232	CGCUYGSMHPJDEV-OAHLLOKOSA-N	444.463	1.847	50	20	IDGD	
Cc1c(NC(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)cccc1C(=O)Nc1ccccc1	756278953	ARLZLSUTDUUIAR-CYBMUJFWSA-N	433.490	1.338	50	20	IDGD	
CCNC(=O)N1CCc2ccc(NC(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)cc21	756729649	DUWZJMPZDSYNGG-UHFFFAOYSA-N	435.448	1.221	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)N[C@H]1CCN(C(=O)CCc2ccccc2)C1	756981824	BTIPNNHMPKDBJJ-FXAWDEMLSA-N	438.484	1.391	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2cc(Br)c[nH]2)ccc1Cl	757471172	FNIXMPJPDMWLFV-UHFFFAOYSA-N	436.671	1.841	50	20	IDGD	
COc1ncc(NC(=O)NNC(=O)COc2ccc(Br)cc2)cc1C(N)=O	757691103	CLEYHULIOVWPFW-UHFFFAOYSA-N	438.238	1.183	50	20	IDGD	
CC(C)n1ncc(C(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)c1N	757715333	KOGYEXIBRJNBLG-UHFFFAOYSA-N	448.530	1.983	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)ncn1	757758113	BOSWBIKJNCZTAV-UHFFFAOYSA-N	448.486	1.814	50	20	IDGD	
CC(C)(NC(=O)C(F)(F)F)C(=O)NNC(=O)COc1ccc(Br)cc1	757793851	QNUPZHIYIDLJFU-UHFFFAOYSA-N	426.189	1.432	50	20	IDGD	
CC(C)C[C@H](NC(=O)c1ccc(Cl)cc1)C(=O)NNC(=O)C(=O)Nc1ccccn1	758839259	CARNWOZURFFONV-HNNXBMFYSA-N	431.880	1.666	50	20	IDGD	
CC(=O)[C@@H]1C[C@H](CC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)C1(C)C	759972742	HDPQKCJUEFWYEC-APWZRJJASA-N	436.578	1.707	50	20	IDGD	
Cc1cc(C)nc(-n2nccc2NC(=O)C(=O)NNC(=O)c2cc(C)nc3ccccc23)n1	760279328	MFGBXJKIQVWWDA-UHFFFAOYSA-N	444.455	1.535	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1cc(N2CCCC2=O)ccc1Cl	760392706	VQGQTFHOFGDDQQ-UHFFFAOYSA-N	442.907	1.934	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)N2CC[C@H](n3cc(C(=O)OC)nn3)C2)c1C	760675989	IXIDQYUUNVPBMQ-LTXFRBGYSA-N	426.477	1.510	50	20	IDGD	
COC(=O)[C@@H](C)NC(=O)/C(C#N)=C/c1cn(CCC(N)=O)nc1-c1ccc(OC)cc1	761103441	KWKHFHIWOXJNAV-QQFZQELXSA-N	425.445	1.019	50	20	IDGD	
CCc1csc(-n2cc(C(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)cn2)n1	762739487	ZYMJEBINADKUGJ-UHFFFAOYSA-N	448.530	1.216	50	20	IDGD	
CC(=NNC(=O)COc1ccccc1[N+](=O)[O-])c1c(C)nn(CCS(C)(=O)=O)c1C	763140576	JALJCTKKGPHMIH-UHFFFAOYSA-N	437.478	1.372	50	20	IDGD	
CC(=NNC(=O)c1nnc(O)c2ccccc12)c1c(C)nn(CCS(C)(=O)=O)c1C	763141635	NQATZIYXVKRPLZ-UHFFFAOYSA-N	430.490	1.347	50	20	IDGD	
COC(=O)c1ccc(F)cc1S(=O)(=O)NNC(=O)CCCNC(=O)OC(C)(C)C	763439393	NZFWHFWFPHXQRL-UHFFFAOYSA-N	433.458	1.227	50	20	IDGD	
C[C@@H]1CN(c2ccccc2NC(=O)C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)C[C@@H](C)O1	763446743	WKEMZEFBPAICJG-ZIAGYGMSSA-N	441.444	1.608	50	20	IDGD	
Cc1ccc(N2CCOC2=O)cc1NC(=O)C(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	763454420	KDKVEFMPLAGSEG-UHFFFAOYSA-N	427.373	1.260	50	20	IDGD	
CC(C)(C)OC(=O)N1CCc2c(cccc2NC(=O)C(=O)NNC(=O)c2ccncc2)C1	763465085	VXXQVLFRRQJGLO-UHFFFAOYSA-N	439.472	1.775	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(-n2cncn2)c(Cl)c1	763469019	ZSJMETFKTWJDAL-UHFFFAOYSA-N	429.780	1.229	50	20	IDGD	
O=C(NNC(=O)c1ccccc1Br)C(=O)Nc1ccc(-c2ncon2)cc1	763483489	VAVFNTAXNWRXSG-UHFFFAOYSA-N	430.218	1.899	50	20	IDGD	
C[S@](=O)Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)ccc1Cl	763557751	DKXQFCDKCHMLOQ-LJAQVGFWSA-N	437.861	1.347	50	20	IDGD	
CC(C)(C)OCc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1	763574346	ZDDKVPAHCATKCN-GOSISDBHSA-N	427.457	1.928	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)[nH]n1)C(=O)Nc1ccn(-c2ncccc2F)n1	763612552	JJEYYZXJYHQOPD-UHFFFAOYSA-N	434.391	1.196	50	20	IDGD	
Cc1ccnc(Oc2ccc(NC(=O)C(=O)NNC(=O)c3c(C)nc4ccccn34)cc2)n1	763629484	MBMFNECWIAECRS-UHFFFAOYSA-N	445.439	1.933	50	20	IDGD	
Cc1ccc2c(c1)N(C(=O)C(=O)NNC(=O)c1nn(C(C)C)c(=O)c3ccccc13)CC2	763790235	HMNCSZQAXGPUPI-UHFFFAOYSA-N	433.468	1.636	50	20	IDGD	
Cc1cc(F)cc(NC(=O)C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1	763796353	AENSAAQRQOKAAQ-UHFFFAOYSA-N	448.476	1.318	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)Cn1c(Cc2ccccc2)nc2ccccc21	763818776	OSVCOVIGCBKBGD-UHFFFAOYSA-N	442.479	1.600	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)CC(=O)N2	763850973	CHYPZFGLZWYZIN-CYBMUJFWSA-N	432.436	1.888	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccccc2C[S@@](C)=O)c1C	763851893	GAWHTLFFQAHORA-INCQDFKNSA-N	431.514	1.735	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cnc3c(c2)c(C)nn3C)cc1	763859857	GKPDRXOMQGKHGR-ZDUSSCGKSA-N	440.460	1.229	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cc(F)cc(F)c2OC)cc1	763860660	JUYGZERARLBVKW-NSHDSACASA-N	437.399	1.926	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1c(F)cccc1-n1cccn1	763865071	HWWUXEXJENTKNI-LBPRGKRZSA-N	429.383	1.704	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccc(Oc3cccc(C#N)c3)nc2)n1	763885493	MTHABHZBXNNKRA-UHFFFAOYSA-N	433.428	1.345	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)C(=O)Nc2ccccc2CS(C)(=O)=O)cc1	763897874	HOSYAVIIYFJSBK-UHFFFAOYSA-N	435.527	1.418	50	20	IDGD	
C[C@@H]1CCC2=S=C(C(=O)NNC(=O)C(=O)Nc3ccc(C(=O)N(C)C)cc3)C=C2C1	763939296	CVUWEWGTOCKKNS-GFCCVEGCSA-N	428.514	1.312	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3ccc4c(c3)S(=O)(=O)CC4)cc2C1	763947569	BZYUFCJWEHXEER-LLVKDONJSA-N	447.538	1.602	50	20	IDGD	
Cc1cccc(Cn2nccc2NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)c1	763999305	VGCXFLUNTFGEAZ-UHFFFAOYSA-N	445.277	1.730	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)N1CCc2c(Cl)cccc21	764002342	LCOIYTOXRWQCAD-UHFFFAOYSA-N	425.670	1.791	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1ccc(F)cc1OCC(F)F	764006052	JGOVQTRXFCJUFS-UHFFFAOYSA-N	439.346	1.641	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2O1)C(=O)Nc1ccc(NC(=O)c2ccccc2)nc1	764167542	KSEZHYSTSZULKX-GOSISDBHSA-N	445.435	1.424	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)c2ccc(C#N)cc2)sc2c1CCC2	764181462	DCNOGGMNECADCF-UHFFFAOYSA-N	426.454	1.685	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)N(C)CC3)c1	764233285	WDHTWBQXQXLFMZ-UHFFFAOYSA-N	447.289	1.850	50	20	IDGD	
N#Cc1cccc(COc2ccc(NC(=O)C(=O)NNC(=O)Cc3cccnc3)cc2F)c1	764267005	QCLWKKTWACBCHC-UHFFFAOYSA-N	447.426	2.000	50	20	IDGD	
COc1ccc(Sc2ccc(NC(=O)C(=O)NNC(=O)c3cnn(C)c3)cc2)cc1	764359964	RCOYNPJTZHIYJI-UHFFFAOYSA-N	425.470	1.980	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2cccs2)[nH]n1)C(=O)Nc1cccnc1OCC(F)F	764376428	DFXBAASSBDSHJU-UHFFFAOYSA-N	436.400	1.577	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)C(=O)Nc1cccc(OCC(=O)Nc2ccccc2)c1	764385950	QGKSUVNHAKSCPI-UHFFFAOYSA-N	447.451	1.807	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1ccccc1-n1ccnn1	764396702	ANFJIHLPLLSNKJ-UHFFFAOYSA-N	426.458	1.154	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)[C@@H](C)NS(=O)(=O)c2cccc(C#N)c2)cc1OC	764572238	LZLVKHUNQDGWBB-CYBMUJFWSA-N	446.485	1.094	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)CNC(=O)c2cc(F)cc(F)c2)n[nH]1	765595591	NGZYCGIOBKINOQ-UHFFFAOYSA-N	429.383	1.555	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3C)CC2)cc1	765748268	BHGZLAXZQIZSKU-UHFFFAOYSA-N	425.489	1.790	50	20	IDGD	
Cn1nc(C(C)(C)C)cc1C(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	766664941	YQWBRPUKOFAYCX-UHFFFAOYSA-N	446.983	1.950	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cnn1CC(C)C	766759772	SFQCLASDWVSXIV-UHFFFAOYSA-N	433.534	1.707	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)c2ccccc2S(=O)(=O)CCN(C)C)cc1C	767191992	PUFAGUWOJPHXRJ-UHFFFAOYSA-N	433.530	1.479	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N2CCC(CCC(N)=O)CC2)cc1Br	767218153	ZGISPBBGORGMPF-UHFFFAOYSA-N	427.299	1.790	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)NCc1ccc(O)c(Br)c1	767231730	LGZSFSOQKBKERJ-UHFFFAOYSA-N	439.222	1.972	50	20	IDGD	
COc1ccc2c(c1)[C@@H](NC(=O)NNC(=O)c1sc(N3CCOCC3)nc1C)CCO2	767296494	LBRJUIBPZANPIP-HNNXBMFYSA-N	447.517	1.765	50	20	IDGD	
CC(=O)[C@H]1CC(C(=O)OCC(=O)NNC(=O)Cc2ccccc2C)=NN1c1ccccc1	767345853	MYLQGHKQHYKLAH-HXUWFJFHSA-N	436.468	1.452	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2ccc(C(=O)O)cc2Cl)cc(OC)c1OC	768495873	HBXYDQMQGQGKFI-UHFFFAOYSA-N	444.849	1.687	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNc3nc4ccccc4[nH]3)CC2)cc1	768505870	YAKZKUGTBXBWTR-UHFFFAOYSA-N	428.518	1.321	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@H]12	768614031	YZSRCDCCQPPSHP-RBOXIYTFSA-N	442.563	1.268	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)NC1[C@H]2[C@H]3CC[C@@H](C3)[C@H]12	769200312	OMXDYJOZDKWLGJ-USJZOSNVSA-N	432.546	1.850	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1cc(S(=O)(=O)NCc2ccco2)ccc1C	771874698	MAGKLZZGXDIJDF-CYBMUJFWSA-N	437.474	1.169	50	20	IDGD	
CCS(=O)(=O)c1ccc(CC(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)cc1	772182974	OYHBZMWSOFRTLQ-UHFFFAOYSA-N	437.905	1.140	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C[C@H]1CSCCN1C(=O)OC(C)(C)C	772221956	QEFMNXLUTJCVBA-AWEZNQCLSA-N	439.534	1.964	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)Nc1cnn(Cc2nnc3n2CCCC3)c1	772638502	AXAMAPNVLPQYTQ-ZDUSSCGKSA-N	442.455	1.619	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)C(=O)Nc2cnc3c(c2)CN(C(=O)OC(C)(C)C)CC3)n1	773478844	CYSZWHJWAGUBHW-UHFFFAOYSA-N	441.492	1.863	50	20	IDGD	
Cc1nc(NC(=O)C(=O)NNC(=O)Cc2c[nH]c3ccccc23)ccc1Br	773527473	LKPJVDXJOWXBPW-UHFFFAOYSA-N	430.262	1.962	50	20	IDGD	
COC(=O)c1c(F)cccc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1cccc(Cl)c1	774009574	RFQUHZNJZVZRJU-JTQLQIEISA-N	437.811	1.819	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)Nc1cccc2cc[nH]c12	776062739	BODBSQJZZXXBCS-UHFFFAOYSA-N	443.485	1.655	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCc2ccc(C(C)(C)O)cc2)cc1	776192155	PBAOMZMVABLPPO-UHFFFAOYSA-N	448.545	1.374	50	20	IDGD	
CNS(=O)(=O)c1cccc([C@@H](C)NC(=O)NNc2cccc(S(C)(=O)=O)c2)c1	776619680	FEOSVXBJMURGBU-GFCCVEGCSA-N	426.520	1.386	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)COC2CCN(C(=O)OC(C)(C)C)CC2)c1	777087554	LNNZCSVGQJXGBB-UHFFFAOYSA-N	437.493	1.881	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)[C@@H]2C[C@@H](O)CN2C(=O)OCc2ccccc2)nc1C	778425184	MQEDQRFWHGBPGI-WBVHZDCISA-N	443.460	1.177	50	20	IDGD	
O=C(CCC(=O)N1CCN(c2ncccn2)CC1)NNc1ccccc1OC(F)(F)F	779210820	MXUXNXXDZXBHHW-UHFFFAOYSA-N	438.410	1.947	50	20	IDGD	
CC(C)(C)OC(=O)NCC(F)(F)CNC(=O)NNC(=O)COc1ccc(C#N)cc1	779669167	LYYABNRYSLSCGU-UHFFFAOYSA-N	427.408	1.427	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)C1=CCN(C)CC1	781397359	ZGTPYGDNNNZFGP-HNNXBMFYSA-N	435.550	1.066	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2cc(C)cc(C)c2)c(OC)c1	782121134	KQGDDFRLULOOGR-UHFFFAOYSA-N	429.429	1.264	50	20	IDGD	
CCN(CC)C(=O)Cn1ccc2cc(NC(=O)C(=O)NNc3ccc(OC)cn3)ccc21	782145727	WLPZQJRFCQYGJC-UHFFFAOYSA-N	438.488	1.995	50	20	IDGD	
C=CCOc1cccc(NC(=O)C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)c1	782897705	SHRXBIHFJRMLGV-UHFFFAOYSA-N	445.501	1.253	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNc2ccc(F)cc2F)cc(S(C)(=O)=O)c1	783345179	WZOJOZABTIPMPC-UHFFFAOYSA-N	427.385	1.237	50	20	IDGD	
C[C@H](SCC(=O)Nc1ccc(F)cc1)C(=O)OCC(=O)NNC(=O)c1cccs1	785059013	QUJPMGSUHRYKQJ-NSHDSACASA-N	439.490	1.952	50	20	IDGD	
CC1CCN(c2ccc(NC(=O)C(=O)NNC(=O)Cc3cn4ccccc4n3)cc2)CC1	785059914	DGXHKLFHJXABDF-UHFFFAOYSA-N	434.500	1.899	50	20	IDGD	
CS(=O)(=O)Nc1ccccc1C(=O)OCC(=O)NNC(=O)c1cccc(Cl)c1	785385962	PARPCENMXZTVNX-UHFFFAOYSA-N	425.850	1.330	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)c1C	785614595	VYFHZHGXZNQOSP-UHFFFAOYSA-N	437.544	1.841	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)Cc1ccccc1S(C)(=O)=O	786427155	OXCYEGCOURKWGX-UHFFFAOYSA-N	439.559	1.853	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)[C@@]3(O)CCc4ccccc4C3)n[nH]2)cc1OC	786481388	CNIKCZJAFBKMFW-HSZRJFAPSA-N	436.468	1.775	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CCc2ccccc2O)cc1C(=O)N(C)C(C)C	787543513	XSRCCAYIQWGFCU-UHFFFAOYSA-N	440.500	1.900	50	20	IDGD	
NC(=O)N[C@@H](CC(=O)NNC(=O)CN1CCCC1=O)c1cccc(Oc2ccccc2)c1	789857248	QQXHKJZSELGYIW-SFHVURJKSA-N	439.472	1.348	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@@](C)(O)Cn2ccc(C)cc2=O)cc1Br	790703739	JIBOUIVPZGNZTP-SFHVURJKSA-N	438.278	1.140	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccc2c1OCC[C@H]2OC	790951062	BRYYPRUUNMKCES-MRXNPFEDSA-N	443.456	1.720	50	20	IDGD	
CC(C)NC(=O)NC1(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)CCCCC1	792023917	XFFYSMHGKSEUPO-UHFFFAOYSA-N	438.554	1.151	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)NNC(=O)[C@H](C)Oc2cccc(Br)c2)n1	792780825	SNENGSGSWOXUBW-NSHDSACASA-N	436.266	1.595	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)C2CCC(OCCOC)CC2)c2ccccc2c1=O	792805303	DOTBFZWJKVNEFX-UHFFFAOYSA-N	430.505	1.789	50	20	IDGD	
O=C(CN1C(=O)C(F)(F)Oc2ccccc21)NNC(=O)c1cc(Br)c[nH]1	794211571	VSOUHMCXXUQDGA-UHFFFAOYSA-N	429.177	1.557	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H]2CN(CC(=O)NNC(=O)c3ccc(C#N)cc3)CC[C@@H]21	795134531	WYLNUOVKDFNAGT-MSOLQXFVSA-N	427.505	1.651	50	20	IDGD	
Cn1cc(-c2cc(F)ccc2NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)cn1	797027569	APNNTQSRQNJTTD-UHFFFAOYSA-N	449.446	1.442	50	20	IDGD	
COc1ccc(NC(C)=O)cc1NC(=O)NNC(=O)CNC(=O)OCc1ccccc1	797610807	WNMBMENYUUBBTG-UHFFFAOYSA-N	429.433	1.733	50	20	IDGD	
COCCOc1ccc(S(C)(=O)=O)cc1NC(=O)NNC(=O)c1ccc(C)cc1O	806736697	NQYNIJBCTUPCAU-UHFFFAOYSA-N	437.474	1.596	50	20	IDGD	
CCOC(=O)C(C)(C)c1csc(NC(=O)C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)n1	806972082	GIQHUQGDNZXCJD-UHFFFAOYSA-N	449.445	1.292	50	20	IDGD	
N#Cc1ccc(NC(=O)C(=O)NNc2ccc(-n3cccn3)nn2)cc1Br	807001775	JAWPWDFJZQDDKZ-UHFFFAOYSA-N	427.222	1.378	50	20	IDGD	
O=C1COC[C@H](C[C@@H]2CN(C(=O)C(=O)NNc3cc(F)c(F)c(F)c3)c3ccccc32)N1	807020810	RNTGKJOEVGZBAK-YPMHNXCESA-N	448.401	1.583	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)c1ccc(OC)c(S(=O)(=O)NC(C)(C)C)c1	807370723	SWCRADGCXIPWRX-UHFFFAOYSA-N	445.538	1.322	50	20	IDGD	
COc1ccc(CN2CC[C@H](NC(=O)NNC(=O)c3ccccc3O)C2=O)c(OC)c1	807577955	QHTCYGQTSIEJHJ-INIZCTEOSA-N	428.445	1.155	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2nc(C)n(C)c2Br)c(OC)c1	808088328	DSYZHTUTICKQBC-UHFFFAOYSA-N	433.284	1.132	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)CNS(=O)(=O)c1c(Cl)cccc1Cl	810565441	RCFCHMLXIJHRSR-UHFFFAOYSA-N	430.313	1.970	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2cc(-c3ccc(C)c(C)c3)[nH]n2)cc1	810584603	FTTXKAVZGUVQCY-UHFFFAOYSA-N	441.513	1.741	50	20	IDGD	
CCCc1nnc(SCC(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)n1N	813494436	MGIVXXVMJKRSBK-UHFFFAOYSA-N	438.457	1.473	50	20	IDGD	
CN(C)c1cc(F)c(C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)cc1[N+](=O)[O-]	814484467	GMDNKSVXGNBQQM-UHFFFAOYSA-N	429.364	1.290	50	20	IDGD	
CC(=NNC(=O)CSc1nnc(O)nc1O)c1oc2cc(C)ccc2c1CC(=O)O	814785289	VMXXRQNFDPDVSB-UHFFFAOYSA-N	431.430	1.597	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1cccc(N2CCCC2)c1	815751623	HLQAVDHWXSMCAH-UHFFFAOYSA-N	431.518	1.619	50	20	IDGD	
CC(C)c1c(Cl)ncnc1NNC(=O)CN1CCN(C(=O)OC(C)(C)C)CC1=O	816485612	TUIQFQCFYBJTQL-UHFFFAOYSA-N	426.905	1.776	50	20	IDGD	
CCN1CCC(N2CCC(C(=O)NNC(=O)c3cc(OC)c(OC)c(OC)c3)CC2)CC1	816814290	MYZHUFDULFJDPM-UHFFFAOYSA-N	448.564	1.670	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)[C@H]1CCCN(C(=O)NC2CCCC2)C1	817052908	VVXGTUVRKUMXLW-HNNXBMFYSA-N	437.566	1.744	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNS(=O)(=O)c3ccc4c(c3)C(=O)N(C)C4=O)cc2C1	861655727	BKDWXLOIIZALRA-SNVBAGLBSA-N	433.511	1.722	50	20	IDGD	
COc1cc(OC)c(N(C)S(=O)(=O)c2cccc(C(=O)NNC(C)=O)c2)cc1Cl	912693599	GIMDOMPIDYFPBZ-UHFFFAOYSA-N	441.893	1.963	50	20	IDGD	
O=C(CNS(=O)(=O)c1cc(C(F)(F)F)ccc1Cl)NNC(=O)c1ccncc1	912768832	LTUYJEMFVORXOA-UHFFFAOYSA-N	436.799	1.493	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@H]2CC(=O)N(c3ccc(F)cc3F)C2)cc(OC)c1OC	914747922	VRGWATZEESCVNQ-LBPRGKRZSA-N	449.410	1.805	50	20	IDGD	
O=C(NNC(=O)c1c[nH]nc1-c1ccncc1)c1cccc(S(=O)(=O)N2CCCC2)c1	916107846	NZZYDYWQYIXXOQ-UHFFFAOYSA-N	440.485	1.331	50	20	IDGD	
Cc1ccc(C)n1-c1ccc(C(=O)NNC(=O)NCCC(=O)N2CCN(C)CC2)cc1	916433331	JOLUHUUUIJBNRG-UHFFFAOYSA-N	426.521	1.202	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NC[C@H](C)N2CCN(c3ccccc3)CC2)cc1OC	916514801	NWVOMTLRHXLXAG-KRWDZBQOSA-N	441.532	1.859	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1)c1nncn1C	916580668	PFUNXLUNMIIGNR-LLVKDONJSA-N	449.518	1.383	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CCC(=O)c2ccc3c(c2)OCCCO3)cc1	916830697	PYUPUAPPKLMISO-UHFFFAOYSA-N	425.441	1.905	50	20	IDGD	
CCN1C(=O)c2ccc(C(=O)NNC(=O)Cc3c[nH]c4ccccc34)cc2S1(=O)=O	917522131	BRLIOZYFQFQPQR-UHFFFAOYSA-N	426.454	1.336	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNS(=O)(=O)c2ccc(C)c(F)c2)cc1	917720804	LWHPSMIFYSXCFV-UHFFFAOYSA-N	429.495	1.073	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)[C@@H]2CCCN(C(=O)CCOc3ccccc3)C2)c1O	919756786	TVUWQBDTQXDDDE-MRXNPFEDSA-N	441.484	1.870	50	20	IDGD	
CC(=O)N1CCN(S(=O)(=O)c2ccc(C(=O)NNc3ccc(F)cc3F)cc2)CC1	920087939	SYLFUESDFBKASG-UHFFFAOYSA-N	438.456	1.575	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)NCc1cccc(CN2CCO[C@@H](C)C2)c1	920236639	DXLHHEMNGAAHDI-KRWDZBQOSA-N	426.517	1.989	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)N[C@@H]1CCCN(C(=O)c2ccccc2)C1	1318177850	XTSLMURVVYCRIC-QGZVFWFLSA-N	448.483	1.827	50	20	IDGD	
CC(C)n1ncc2c1[C@@H](NC(=O)NNC(=O)c1csc(N3CCOCC3)n1)CCC2	1321172795	URQCGLJDHTUCAC-AWEZNQCLSA-N	433.538	1.779	50	20	IDGD	
CC(=NNC(=O)c1n[nH]c2c1CCCC2)c1ccc(OCC(=O)N2CCOCC2)cc1	1322096202	QYPDXTAMSZVBJN-UHFFFAOYSA-N	425.489	1.680	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCCc2ccc(N(C)C)cc2)cc1	1322307374	FVRNZDCQHDEWEM-UHFFFAOYSA-N	447.561	1.255	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2cc3c(cc2Cl)NC(=O)C3)c2ccccc2c1=O	1330271249	PARHREXGDLQFJU-UHFFFAOYSA-N	425.832	1.639	50	20	IDGD	
O=C(c1ccc2nccn2c1)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1778014401	DSOGBADOVHPPSD-PBHICJAKSA-N	425.258	1.468	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCO[C@]2(CCN(C(=O)c3cccnn3)C2)C1	1779464311	GKYQGTCZWZWDRE-VROYLXGSSA-N	439.422	1.805	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](COC)NC(C)=O)C1	1779552828	AIMZZDCRIUIXIW-MIALQEHNSA-N	431.961	1.059	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3c(F)cncc3F)C2)C1	1779731706	FJIRPANFPRPYTP-DIFFPNOSSA-N	432.265	1.977	50	20	IDGD	
C/C=C(/C)C(=O)N1CCO[C@@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1	1780968224	GYFQOMVMTLADOS-CLHCTPIOSA-N	443.548	1.129	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(C(=O)O)n(C(C)C)n3)CCO2)C1	1781214547	ZMAMWNPXGFZYTB-DJJJIMSYSA-N	426.901	1.623	50	20	IDGD	
CC(C)(C)n1cc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](F)Br)C3)C2)cn1	1781326746	SFHYAQZULZDYQV-GUYCJALGSA-N	431.306	1.772	50	20	IDGD	
O=C(c1cnc2snnc2c1)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781333263	FJBWXWDBVJLFAO-NHYWBVRUSA-N	444.286	1.220	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1[nH]nc3ncccc13)C2)C(Cl)Cl	1782214989	FRKUITZUCYFOKN-KZULUSFZSA-N	426.304	1.889	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cc(C(C)=O)[nH]n3)CCO2)C1	1783343440	IYTXZRSGTHVFSR-SJKOYZFVSA-N	427.299	1.229	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cnn4c3CCC4)CCO2)C1	1783353590	PZCQYEZDECABPQ-KBXCAEBGSA-N	425.327	1.446	50	20	IDGD	
Cc1csc(CCC(=O)N2CCO[C@@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)c1	1783933514	OAZRXUNXIYHOOK-OAQYLSRUSA-N	436.578	1.192	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H]1C(=O)N1CCO[C@@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783941513	DUBBYPXFNLUOBE-KPZWWZAWSA-N	436.336	1.629	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(CCN(C(=O)c3ccccc3C3CC3)C2)C1	1784949256	ORBGLEDOXYTTSQ-DEOSSOPVSA-N	434.301	1.001	50	20	IDGD	
CCC[C@H](NC(C)=O)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2	1785441044	YZVUISHVQGKVHR-YEWWUXTCSA-N	432.359	1.152	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)c1nccc2nc[nH]c12	1787354816	GXXXAEMIJQRLLT-PCVQNBPASA-N	440.273	1.242	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CC(=O)N(C4CCCC4)C3)C[C@@H]21)[C@H](F)Cl	1787444404	ZNPUBRSCICJMAG-XIZOUUALSA-N	429.920	1.292	50	20	IDGD	
NC(=O)[C@H](N)CCC(=O)NC1(c2ccc(NC(=O)CCBr)cc2)CCC1	1787672745	AKOOJRKGUVEKFM-CQSZACIVSA-N	425.327	1.498	50	20	IDGD	
CCc1nc(C(=O)NC2(c3ccc(NC(=O)c4cccc(B(O)O)c4)cc3)CCC2)co1	1788147917	OPUVBZMPWWSDSF-UHFFFAOYSA-N	433.273	1.978	50	20	IDGD	
CC(=O)O[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)C(C)C	1788479464	FMFYQLJNZCIIDY-YYFQZIEXSA-N	437.306	1.244	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C#CC3(O)CCCCC3)[C@H]2C1	1788638790	GRILEDSSPFGOGW-FHWLQOOXSA-N	436.625	1.516	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C=N/O[C@@H]3CCCCO3)[C@H]2C1	1788653068	SQPGRMYXFHQVKP-GONAQHPDSA-N	429.945	1.760	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(Cl)cnc3O)C[C@@H]21	1788762153	MVNHTEVHISLBDF-RCBQFDQVSA-N	441.988	1.885	50	20	IDGD	
COc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]3C2)ccc1O	1789924472	FXZILCUOOSQXKO-APYUEPQZSA-N	445.285	1.685	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]3C2)o1	1791056318	STFHBGRBVXNZKS-HTUGSXCWSA-N	442.310	1.615	50	20	IDGD	
COc1cccc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](C)Br)[C@H]3C2)n1	1791057763	XFQLKOMSAJFNMF-SDADXPQNSA-N	440.338	1.396	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(C)c4n[nH]cc4c3)C[C@@H]21	1791257168	RJGPLAVNEKXUJW-MGHWNKPDSA-N	434.924	1.718	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnn3ccccc13)C2	1792868452	ZOPUVESTVOVOND-VWPFQQQWSA-N	435.322	1.569	50	20	IDGD	
CN(CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ncc[nH]1)NC(=O)NCc1ccccc1	1794837247	DXBOCOCYXPAROB-BCDXTJNWSA-N	439.520	1.008	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1c(C)noc1C	1795045575	VXNVLPJWUZFJOC-VFMVUTOHSA-N	426.477	1.677	50	20	IDGD	
CCCc1onc(C)c1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCBr	1795114408	FNAZHNPRSIFQSX-FVCICTRLSA-N	428.327	1.924	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(Cl)o1)C2	1796442032	NUILPXONPAEBKG-CNKKGNCFSA-N	447.879	1.270	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CC(c3ccccc3)=NO1)C2	1797953691	CXLDIIHOBTYJTD-SHJAMOMRSA-N	445.592	1.621	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2)c1ccc(Br)cc1O	1799475773	MSOJRPGYCRXYDM-WAYYCVMKSA-N	435.677	1.892	50	20	IDGD	
Cc1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)cc2c[nH]nc12	1800918435	KLKAOPGZGJUHBG-ACDBMABISA-N	432.289	1.117	50	20	IDGD	
C[C@H](NC(=O)c1ccc(F)cc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(Cl)Cl	1801016379	GOKBUUTZPZFURW-DNVSUFBTSA-N	446.306	1.337	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1cc[nH]n1	1801361248	NSEAUJSBINHFFG-FZKCQIBNSA-N	439.944	1.723	50	20	IDGD	
COc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Br)C3)ccc1F	1801711063	GNIWHPUTEUEYBD-JLUCKKNBSA-N	433.249	1.728	50	20	IDGD	
CC[C@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccn(CCOC)n1)C2	1801801194	BLUWLRWAXIGGRH-XGUBFFRZSA-N	427.343	1.955	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)COc1ccccc1C#N	1801991759	NCPIEXASVGVUIV-ZDUSMZPESA-N	440.327	1.763	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](O)CCl)C2	1801995531	WWKZQQZAZFPDEX-XFIYOXNOSA-N	429.945	1.624	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)CNC(=O)N(C)C)[C@H]1c1cccnc1	1802681437	AJVRZXKMAFOZSU-JGGQBBKZSA-N	440.342	1.142	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cc(O)nc(Cl)c2)[C@H]1c1cccnc1)[C@@H](O)CCl	1803142501	XOHVGBIQQCYPFT-JDFRZJQESA-N	439.299	1.755	50	20	IDGD	
C=CCNC(=O)/C=C\C(=O)N1CCCC2(CCN(C(=O)CCBr)CC2)C1	1804851254	FGPFOXGQWIRKJL-PLNGDYQASA-N	426.355	1.861	50	20	IDGD	
CC(=O)N/C(C)=C/C(=O)N1CC[C@H](CNC(=O)CCBr)[C@H]1c1cccnc1	1806346516	JXKBAXZVQMIHPC-LILOBXFESA-N	437.338	1.912	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@H](CNC(=O)CCSC(=N)N)[C@@H]1c1cccnc1	1807127629	PGNUOMPQJJKZEW-YJBOKZPZSA-N	437.642	1.956	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)/C=C/C2CCCC2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1	1807374317	YUFAAFHCVPDRPR-DYCBHTBMSA-N	447.344	1.827	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)c1nc2ccccn2n1	1807928244	HTRGCSKZFSETJJ-ZOBUZTSGSA-N	428.880	1.044	50	20	IDGD	
Cc1[nH]ccc1C(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1808755916	UPHKEMRLCYPCRM-UTKZUKDTSA-N	426.521	1.411	50	20	IDGD	
Cn1cc(F)cc1C(=O)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1	1809977923	LMZDJTZRCVYHCR-UHFFFAOYSA-N	427.285	1.003	50	20	IDGD	
Cc1nscc1C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1813071063	OKOOPQBIXHLERM-UZLBHIALSA-N	444.561	1.539	50	20	IDGD	
O=C(C[C@H]1CCCCO1)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1	1815336997	IQSGJIPPWJQIEC-JKSUJKDBSA-N	443.334	1.008	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)COc2cccnc2)n[nH]1	1815763810	NUOKMIVNVSEFMA-KRWDZBQOSA-N	443.508	1.249	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1ccc(O)cc1	1820578975	SEHSUDJOMRROPG-IBGZPJMESA-N	434.261	1.415	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@H](O)CCl)CC2)c1ccc(-n2cccn2)nc1	1820732568	PVOURVITFSOLQI-TZMCWYRMSA-N	446.920	1.549	50	20	IDGD	
CC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CN1C(=O)CSC1=S)CC2	1822857486	IMNNLBSOPYXBGJ-IUCAKERBSA-N	447.007	1.933	50	20	IDGD	
O=C(/C=N/O[C@@H]1CCCCO1)N1CCC([C@H]2CCCCN2C(=O)[C@@H](O)CCl)CC1	1824185731	GQPXJQZRXCCJGZ-MGKZJYGNSA-N	429.945	1.735	50	20	IDGD	
C[C@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1)n1ccnc1	1824312922	NURFUAREZGAEGL-DYESRHJHSA-N	438.337	1.057	50	20	IDGD	
CC(C)(CCl)C(=O)N[C@@H]1CCc2nc(NC(=O)COc3ccc(O)nn3)sc2C1	1824554147	SVOJXTMWQJLXMI-SNVBAGLBSA-N	439.925	1.895	50	20	IDGD	
CSCC[C@H](O)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](C)Br)sc2C1	1825646652	BDAOTZOKHWQKBS-NGZCFLSTSA-N	436.397	1.953	50	20	IDGD	
Cc1ccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)cn1	1825818806	YYWJSYSQLIXQRY-FQEVSTJZSA-N	429.565	1.996	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1nccnc1OC)CC2	1825994150	QQPFUPZNOKFAMF-ZJUUUORDSA-N	425.898	1.421	50	20	IDGD	
Cc1c(Cl)cccc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1830720338	XLXHZPXOYNFIMC-VQIMIIECSA-N	431.316	1.318	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H](O)N2CCOCC2)CC1	1831654889	IFEUSCGKRYNDCL-ZSZQSSIHSA-N	446.386	1.040	50	20	IDGD	
O=C([C@@H](F)Cl)N1CCOC[C@@]2(C1)CN(C(=O)C1(c3ccc(F)cc3)CC1)CCO2	1832386872	DNZLIMCRPPIGBU-VQIMIIECSA-N	428.863	1.848	50	20	IDGD	
COc1cccc(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)n1	1832821013	LTGYOKNJYSNBNE-MJGOQNOKSA-N	429.876	1.014	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC(N2CCC(NC(=O)[C@H]3CCCCO3)CC2)CC1	1833112839	WXJONDSQOSTJAO-LJQANCHMSA-N	425.646	1.979	50	20	IDGD	
C#CCO[C@@H](C)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](C)CBr)CC2)CC1	1833265262	RQVKQAXDHCVHCF-HOTGVXAUSA-N	442.398	1.627	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3n[nH]c4c3CCCC4)CC2)CC1)[C@H](O)CCl	1833310458	JGGOYTPKWJFKNO-GOSISDBHSA-N	437.972	1.073	50	20	IDGD	
COC(OC)C(=O)NC1CCN(C2CCN(C(=O)[C@H](C)CBr)CC2)CC1	1833388667	RQWSARQZUWYNEL-CYBMUJFWSA-N	434.375	1.208	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)Cc3nnc(C)o3)CC2)CC1	1833532093	AMMJTCTUNSIHLU-KRWDZBQOSA-N	425.961	1.900	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)c3ncnn3C)CC2)CC1	1834073277	QTXZOLVWZVCBBQ-CYBMUJFWSA-N	441.374	1.031	50	20	IDGD	
O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)c1cnoc1C1CC1)CCO2	1834612735	RGBRDELHWVXSLK-GOSISDBHSA-N	442.310	1.407	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCBr)CCO3)C2)c(C)n1	1834823386	RDYBHEGVNPSECF-LJQANCHMSA-N	440.338	1.553	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CC3CCOCC3)CCO2)C1	1835423764	JPLGTQIICPQBFI-APWZRJJASA-N	447.370	1.433	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)C(Cl)Cl)CC2)CC1)c1cc2cn[nH]c2cn1	1835643284	LTYJSXUVVVBRBM-UHFFFAOYSA-N	439.347	1.947	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(Cl)cn3)CCO2)C1	1837899850	XNXZJRCAAIVECW-KBXCAEBGSA-N	432.304	1.059	50	20	IDGD	
Cc1ccc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)o1	1839156360	NKPJQTGGTOEOOP-OALUTQOASA-N	433.332	1.823	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)ccc1F	1839201575	BDYPVHQDYICASK-MAUKXSAKSA-N	447.276	1.895	50	20	IDGD	
C[C@H](Cc1ccc(F)cc1)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1839764619	HSDCUKZONLXFBH-CFLQYTFWSA-N	430.879	1.995	50	20	IDGD	
C=CCC(F)(F)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)Br)C2)C1	1839890743	QVNVYAVETZCRAS-WFASDCNBSA-N	425.270	1.438	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)n3cccn3)C2)C1	1839967504	OGIBYOLOSRKPCR-VKJFTORMSA-N	443.342	1.074	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CNC(=O)OC(C)(C)C)CCO2)C1	1839986011	FLXUCYKDIQMPLT-QRWLVFNGSA-N	447.960	1.375	50	20	IDGD	
Cc1nccn1CCCC(=O)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1840388716	HTIMSWKFMUUAEZ-GOSISDBHSA-N	433.336	1.232	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@](F)(C(=O)N2CC3(CCCN3C(=O)[C@H](O)CCl)C2)C1	1841353610	GVVGUELUBSEJSL-JLTOFOAXSA-N	447.935	1.529	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC2(CCCN2C(=O)c2cccnc2CS(C)(=O)=O)C1	1842240117	XPXCPPFXMAFWKG-UHFFFAOYSA-N	427.954	1.708	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC2(CCCN2C(=O)CC(=O)Nc2cc(C)on2)C1	1843401509	YYAAXHFFSKIYPG-LBPRGKRZSA-N	427.299	1.689	50	20	IDGD	
COc1cccc(C(=O)N2CC3(CCCN3C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)c1F	1843417215	IYXCPKOVMMFUCX-AFUMVMLFSA-N	441.463	1.785	50	20	IDGD	
CC(C)(C)c1ccc(C(=O)N2CCCC23CN(C(=O)c2ccc(B(O)O)cc2)C3)s1	1843558864	BBSIESDRCUQKJD-UHFFFAOYSA-N	426.347	1.856	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2cnn3ccccc23)C1	1843654100	VJSZJIFHVDCDTQ-MFKUBSTISA-N	433.472	1.285	50	20	IDGD	
O=C(/C=C/C(=O)N1CC2(CCCN2C(=O)[C@H](F)Br)C1)NCc1ccco1	1845217986	GUBJDGYHFBBOPL-RGDDUWESSA-N	428.258	1.346	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCCC12CN(C(=O)CN1C(=O)C=CC1=O)C2	1845871937	GTFVQPRCWHSFEM-OVCLIPMQSA-N	440.406	1.000	50	20	IDGD	
CC(C)(C)OC(=O)N1CCCC[C@@H]1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl	1847562829	AXILPMJTCXMNJG-CAOSSQGBSA-N	429.945	1.578	50	20	IDGD	
CCn1c(SCC(=O)OCC(=O)NNC(=O)c2ccccc2)nnc1-c1ccco1	9398309	LVULMUREAYCYTH-UHFFFAOYSA-N	429.458	1.655	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)CCc2nc3sc4c(c3c(=O)[nH]2)CCCC4)n1	15462476	KFOPVAQQPJGAJG-UHFFFAOYSA-N	428.518	1.457	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C2CCN(S(=O)(=O)c3ccc(C#N)cc3)CC2)cc1	16055723	WWYOXMVSFMWSNU-UHFFFAOYSA-N	440.525	1.983	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)c2ccc(Cl)c(S(=O)(=O)NC[C@@H]3CCCO3)c2)n1	24505026	ICTAISJGZRPAGE-AWEZNQCLSA-N	439.925	1.961	50	20	IDGD	
Cn1ccnc1SCc1cccc(C(=O)NNC(=O)CNC(=O)c2cccs2)c1	725740347	UEMMISGAMBPFJM-UHFFFAOYSA-N	429.527	1.965	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCCC(=O)NC(C)(C)C	728065005	NQDANNALIJZGCF-NSHDSACASA-N	429.315	1.852	50	20	IDGD	
CS(=O)(=O)Nc1cc(C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)ccc1F	728211285	PUPMJYJGSBRMHI-UHFFFAOYSA-N	442.494	1.395	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3ccc(-n4ccnc4)cc3)cc2)CC1	728214412	OPVACQYSFAEGJL-UHFFFAOYSA-N	440.529	1.565	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)CCOc2ccc(F)c(Cl)c2)n1	728726887	IJIYNDPEJUSDKS-UHFFFAOYSA-N	429.857	1.946	50	20	IDGD	
CN1CCN(CCCCNC(=O)NNC(=O)COc2ccc(Br)cc2)CC1	728949234	RPZDONYNRMYJDI-UHFFFAOYSA-N	442.358	1.186	50	20	IDGD	
CCOc1cc2c(cc1[C@@H]1C[C@@H]1C(=O)NNC(=O)CNC(=O)c1ccco1)O[C@H](C)C2	730490082	WWDUXJAYYZWGRZ-INWMFGNUSA-N	427.457	1.683	50	20	IDGD	
CC(C)(C(=O)NNC(=O)c1cc(S(N)(=O)=O)ccc1Br)c1ccccc1	731200407	NXRVHVGYSQBTQW-UHFFFAOYSA-N	440.319	1.835	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)[C@@H]1CC(=O)N(c2cc(OC)c(OC)c(OC)c2)C1	731491746	ULIWDKRAIBWSQD-CYBMUJFWSA-N	443.456	1.535	50	20	IDGD	
CCNS(=O)(=O)CCNC(=O)NNC(=O)c1cc2c(s1)CC[C@H](C(C)(C)C)C2	731760247	WQEFGWUGKQRPOQ-ZDUSSCGKSA-N	430.596	1.782	50	20	IDGD	
COC(=O)c1ccccc1S(=O)(=O)NNC(=O)c1ccc(OC)c(Br)c1	732048414	IRMDILRLDSFUIZ-UHFFFAOYSA-N	443.275	1.868	50	20	IDGD	
COCCOc1cn(-c2ccccc2)nc1C(=O)NNC(=O)CCN1C[C@@H](C)O[C@H](C)C1	732264662	WFRWWURVAITTDX-IAGOWNOFSA-N	445.520	1.158	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N(C)Cc2cc[nH]n2)cc1	732660689	IFLFGPAKPMPLEF-WJDWOHSUSA-N	433.472	1.723	50	20	IDGD	
CC(C)[C@H](C(=O)NNC(=O)c1cnn(-c2ccccc2)c1)N1C(=O)c2ccccc2C1=O	733108330	MKVAOCPOBKWCAB-LJQANCHMSA-N	431.452	1.954	50	20	IDGD	
CC(C)OCCCn1c(NNC(=O)C2(C(=O)NC3CC3)CC2)nc2ccccc2c1=O	733265654	IENMNICLMNGABS-UHFFFAOYSA-N	427.505	1.714	50	20	IDGD	
CCn1c(=O)c(=O)[nH]c2cc(C(=O)NNc3nc(-c4ccccn4)nc(C)c3C)ccc21	734256393	ATLZZIQCQTUSAK-UHFFFAOYSA-N	431.456	1.935	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NN=C2C(=O)Nc3cc4c(cc32)OCCO4)CC1	734750081	VAWKPSGKHFCYMM-UHFFFAOYSA-N	445.476	1.813	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2ccc3c(c2)C(=O)NCC3)ccc1OC(C)C	734806714	FZZKDEYQEQFQPX-UHFFFAOYSA-N	433.486	1.392	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)c1ccc(N2CCCS2(=O)=O)cc1Cl	736007512	VEKVAHMDFGPKQA-UHFFFAOYSA-N	437.905	1.892	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)[C@H]1CCCN(S(=O)(=O)c2ccccc2)C1	737637083	MEYYIVKLYUKXDE-SFHVURJKSA-N	431.514	1.452	50	20	IDGD	
C[C@@H]1C[C@@H](C)CN(C(=O)CN2CCN(C(=O)NNC(=O)COCc3ccccc3)CC2)C1	738497289	RCZBPRNSSDRUQI-RTBURBONSA-N	445.564	1.066	50	20	IDGD	
CCc1cc(NNC(=O)CCN2C(=O)[C@H]3[C@H]4CC[C@@H](O4)[C@@H]3C2=O)nc(-c2ccccn2)n1	743377028	WYHHZRPYOYHYMU-LTDCPUDJSA-N	436.472	1.097	50	20	IDGD	
CC(=NNC(=O)Cc1cc(O)nc(O)n1)c1ccc(S(=O)(=O)CC(F)(F)F)cc1	743446238	SMLOGMXISUUFNS-UHFFFAOYSA-N	432.380	1.307	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)NCc2ccc(N(C)S(C)(=O)=O)cc2)cc1	743605298	RMOYUJZDJLNUPS-UHFFFAOYSA-N	434.522	1.684	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1cncn1-c1ccccc1	744621902	SIXMXNIGVWAADZ-UHFFFAOYSA-N	427.486	1.650	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)[C@@H]2CCCN2C(=O)OCC(F)(F)F)c1	744947471	TYTKJNMSJINSNS-ZDUSSCGKSA-N	442.350	1.026	50	20	IDGD	
Cc1cccc(O[C@H](C)CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1	745875760	IWHKNHPGTLUOJV-OAHLLOKOSA-N	434.518	1.657	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)c2cc([N+](=O)[O-])cc(S(C)(=O)=O)c2)o1	746397178	NOVFFRVUVKNGNK-UHFFFAOYSA-N	438.462	1.508	50	20	IDGD	
Cn1ncnc1COc1ccc(S(=O)(=O)NNC(=O)c2cccc3ncccc23)cc1	746592036	SSBYNTCKLXYFFI-UHFFFAOYSA-N	438.469	1.566	50	20	IDGD	
COc1cc(C)nc(NNC(=O)[C@@H]2CC(=O)N(CCc3ccc(OC)c(OC)c3)C2)n1	746632902	LDXGBXZUUMPCLF-OAHLLOKOSA-N	429.477	1.345	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NCCOc1ncccc1C(F)(F)F	746723078	RAQHQKUFMDHHMT-UHFFFAOYSA-N	431.396	1.301	50	20	IDGD	
O=C(NNC(=O)c1ccccc1CSC1=NCCS1)N[C@@H]1CCS(=O)(=O)C1	747366125	UOGFXYCPGGAXCJ-GFCCVEGCSA-N	428.561	1.154	50	20	IDGD	
C[C@H](NC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)[C@@H](C)c1ccccc1	747589843	UIWGQROBHOAQMQ-SJORKVTESA-N	446.577	1.836	50	20	IDGD	
COc1ncnc(N)c1C=NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	747625115	DOIAIQFALVXKAA-UHFFFAOYSA-N	440.485	1.310	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)[C@@](C)(O)[C@@H](C)c2ccccc2)cc1OC	748484858	UICCQSOLTDNLED-FPTDNZKUSA-N	430.457	1.563	50	20	IDGD	
CN(C)[C@]1(CNC(=O)NNC(=O)COc2ccc(Br)cc2)CCSC1	748646470	FZSWNRMLXWXYJG-INIZCTEOSA-N	431.356	1.596	50	20	IDGD	
Cc1nn(Cc2ccc(Cl)cc2)c(C)c1C(=O)NNC(=O)CNC(=O)c1ccco1	748707743	CINBOHCLGXDQEE-UHFFFAOYSA-N	429.864	1.986	50	20	IDGD	
CN1C[C@@H](NC(=O)NNc2ccc(S(=O)(=O)NC3CCCCCCC3)cn2)CC1=O	750653632	XSZCQOANQYNCBL-HNNXBMFYSA-N	438.554	1.330	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)c3ccc([C@@]4(C)NC(=O)NC4=O)cc3)n[nH]2)cc1	751065758	SNAMILPWQPOWMY-JOCHJYFZSA-N	432.440	1.515	50	20	IDGD	
O=C(NNS(=O)(=O)c1cccc(F)c1F)c1ccc(S(=O)(=O)N2CCCC2)cc1	751261226	JJATXPUIFNPOBF-UHFFFAOYSA-N	445.469	1.373	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1)C(=O)N1CCC(C(=O)NCCCN2CCOCC2)CC1	752463080	QNUUIEGAHFJFEJ-CAPFRKAQSA-N	428.508	1.810	50	20	IDGD	
CC[C@H](CS(=O)(=O)c1ccccc1)NC(=O)NNC(=O)Cc1cn2ccccc2n1	752705284	QSDRTWGDSHCQPO-OAHLLOKOSA-N	429.502	1.460	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)CSc1nc(C)cc(C)n1	755185405	HQCRFHJOMLYWAT-UHFFFAOYSA-N	438.893	1.852	50	20	IDGD	
Cc1cccc(NS(=O)(=O)c2ccc(C)c(C(=O)NNC(=O)Cc3cc[nH]n3)c2)c1	755288093	FPGSMZKRCFVBAN-UHFFFAOYSA-N	427.486	1.831	50	20	IDGD	
COC(=O)c1cccc(NC(=O)C(=O)NNc2ccc(Cl)nn2)c1Br	756153217	DZJRINYIAWNZQQ-UHFFFAOYSA-N	428.630	1.761	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@H]2C)ccc1NC(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1	756246234	TWBJTCBGEXPSJK-GDBMZVCRSA-N	436.534	1.597	50	20	IDGD	
CNS(=O)(=O)c1ccc(C)c(NC(=O)NNC(=O)c2cccc(OC(F)F)c2)c1	756523506	CBKWAEMZRUIRBX-UHFFFAOYSA-N	428.417	1.971	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)Nc1ccc(S(=O)(=O)NC2CC2)cc1	756774891	DSNHDRBZRPJJGM-UHFFFAOYSA-N	440.485	1.780	50	20	IDGD	
CN(CC(=O)NNC(=O)c1csc(N2CCOCC2)n1)C(=O)OCc1ccccc1	756796294	HSZCTUYVKSHTLI-UHFFFAOYSA-N	433.490	1.009	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)CN2C(=O)NC3(C[C@@H](C)C[C@H](C)C3)C2=O)c1	756863765	MOBGECPBCSYOQK-STQMWFEESA-N	432.477	1.212	50	20	IDGD	
CC(C)CN1C(=O)C(=NNC(=O)[C@H]2CCS(=O)(=O)C2)c2cc(Br)ccc21	756882377	WCCBPAGPUREMSY-NSHDSACASA-N	442.335	1.707	50	20	IDGD	
CC(=O)[C@@H]1C[C@H](CC(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)C1(C)C	759955405	KSUQDYIAGLXPHD-RTWAWAEBSA-N	428.577	1.901	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccnn1Cc1ccc(F)cc1	760277748	QCVGOKHJGOWDIA-UHFFFAOYSA-N	425.420	1.408	50	20	IDGD	
C[C@@H](CC(=O)NNC(=O)c1cccc2ncccc12)NS(=O)(=O)c1cccnc1Cl	760546463	WYEWGDJGCMZXJZ-LBPRGKRZSA-N	447.904	1.801	50	20	IDGD	
CCn1c(=O)c(=O)[nH]c2cc(C(=O)NNC(=O)CSc3ccccc3OC)ccc21	761620656	XDYJQXPULPKZIV-UHFFFAOYSA-N	428.470	1.272	50	20	IDGD	
COc1ccccc1NC(=S)NNC(=O)c1ccc(CCNS(C)(=O)=O)s1	761660175	KSZBQDAVAKCFQY-UHFFFAOYSA-N	428.561	1.480	50	20	IDGD	
COc1cc(C=NNC(=O)CNC(=O)c2cccnc2)ccc1OC(=O)c1cccnc1	763191770	AICQPUZGGYGPJL-UHFFFAOYSA-N	433.424	1.585	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cccnc2)c(Br)cc1F	763489056	UPWXHGZRROMFFK-UHFFFAOYSA-N	439.197	1.170	50	20	IDGD	
COC(=O)c1c(NC(=O)C(=O)NNC(=O)COc2cc(C)cc(C)c2)sc(C)c1C	763647322	LSYHUBBTPBMPMT-UHFFFAOYSA-N	433.486	1.933	50	20	IDGD	
Cc1ccc(Cn2nccc2NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)o1	763685889	YVJAVIOIAVSUFN-UHFFFAOYSA-N	431.836	1.651	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)NCc1ccc(N2CCCS2(=O)=O)cc1	763693677	FGIVBBKEGKGMFL-UHFFFAOYSA-N	432.502	1.308	50	20	IDGD	
C[S@@](=O)c1ccc(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)cc1F	763729330	VZFPPCZTHQAKIA-SSEXGKCCSA-N	432.477	1.102	50	20	IDGD	
CCC(=O)Nc1ccc(C)c(NC(=O)C(=O)NNC(=O)c2cc(OC)cc(OC)c2)c1	763775468	ROSAOTMGZDSCOX-UHFFFAOYSA-N	428.445	1.760	50	20	IDGD	
CCOc1ncccc1NC(=O)C(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12	763791820	XHYLIKVXNMNGLN-UHFFFAOYSA-N	438.444	1.171	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(S(=O)(=O)N(C)C(C)C)cc2)cc1	763834792	QCPWMQPJADHUFG-UHFFFAOYSA-N	446.529	1.678	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccn(CC(F)(F)F)n2)c1C	763848082	GWVOBIKYMUANTL-LBPRGKRZSA-N	427.383	1.616	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccc(CN2CCOC2=O)cc1	763856218	FNAKWZRVYFOATO-ZDUSSCGKSA-N	444.419	1.331	50	20	IDGD	
CNC(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)c1	763864666	FCCAVQQRBZOXEN-SNVBAGLBSA-N	436.827	1.392	50	20	IDGD	
CC(C)CC(=O)NNC(=O)C(=O)Nc1ccc(S(=O)(=O)N2C[C@@H](C)C[C@@H](C)C2)cc1	763883912	SHHLISDRYYGVJA-GASCZTMLSA-N	438.550	1.485	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2c[nH]nc2-c2ccccn2)ccc1OC(C)C	763920875	FPQDGZDKDLQMCD-UHFFFAOYSA-N	438.444	1.667	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3cnn(C[C@H]4CCCO4)c3)cc2C1	763939651	NOTXYCCJRWLBPD-SWLSCSKDSA-N	431.518	1.648	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3cc(Cl)ccc3O)cc2)CCO1	763973953	IKDVRQSHVLNWHX-LBPRGKRZSA-N	432.864	1.670	50	20	IDGD	
C[C@@]1(c2ccccc2)NC(=O)N(CC(=O)NNC(=O)CSc2ccccc2O)C1=O	764046512	MPPHPEXLRDWAAA-FQEVSTJZSA-N	428.470	1.099	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cccc1C(F)(F)F	764077114	HFVBNKJUFMOPTO-UHFFFAOYSA-N	443.403	1.817	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(OC)c2O)c(Br)c1	764131533	PZAPAKUQOBOBPO-UHFFFAOYSA-N	438.234	1.572	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)Cc2cccnc2)cc1OCc1cccnc1	764264101	POCWKSGFJDKGCY-UHFFFAOYSA-N	435.440	1.393	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)C(=O)Nc1ccc(NC(=O)C2CC2)cc1C(F)(F)F	764265893	GXWWNQBKNCWSLK-UHFFFAOYSA-N	449.389	1.778	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)Cc2cccnc2)sc2c1CCCCC2	764266547	MYAWCKFLFMHTRG-UHFFFAOYSA-N	444.513	1.917	50	20	IDGD	
O=C(Cc1ccccn1)NNC(=O)C(=O)Nc1ccc(CC(=O)Nc2ccccc2F)cc1	764266582	GGXQXRFMYSOIQD-UHFFFAOYSA-N	449.442	1.731	50	20	IDGD	
CS(=O)(=O)c1c(Cl)cccc1NC(=O)C(=O)NNC(=O)COCc1ccccc1	764368453	WLZBKRZIYBULGA-UHFFFAOYSA-N	439.877	1.046	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3OC)[nH]n2)c(Cl)n1	764377946	UAZVLLHGHYUMMF-UHFFFAOYSA-N	444.835	1.542	50	20	IDGD	
Cc1ccc(C(=O)NCC(F)(F)F)cc1NC(=O)C(=O)NNC(=O)c1ncccc1C	764388223	FASWVCNJSHSYNQ-UHFFFAOYSA-N	437.378	1.390	50	20	IDGD	
CS(=O)(=O)[C@H]1CCCCC1=NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	764829032	CNQYAQMWOKHJIQ-IBGZPJMESA-N	440.997	1.917	50	20	IDGD	
CNc1c(C(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)cccc1[N+](=O)[O-]	765591189	RQLOLUYFYRXWBI-UHFFFAOYSA-N	440.504	1.524	50	20	IDGD	
C[C@@H]1CCCC[C@]12NC(=O)N(CC(=O)NNC(=O)c1cc(-c3ccc(F)cc3)[nH]n1)C2=O	765617305	GCBYCNFYJOLSEB-GTJPDFRWSA-N	442.451	1.478	50	20	IDGD	
CNC(=O)[C@@H]1CCC[C@H]1NC(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1	765667021	VITPHOSDKNBQIZ-YPAWHYETSA-N	449.555	1.859	50	20	IDGD	
NC(=O)COc1ccc(Cl)cc1S(=O)(=O)NNC(=O)Cn1ccc2ccccc21	766320615	ILUDIXJBBTVGOL-UHFFFAOYSA-N	436.877	1.169	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1sccc1OC(F)F	766652497	QCTLCMQXRGLDLH-UHFFFAOYSA-N	438.456	1.569	50	20	IDGD	
Cc1noc(Cl)c1CC(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	766664857	WEGVDUYYEZCPRR-UHFFFAOYSA-N	440.331	1.798	50	20	IDGD	
Cc1ccc(S(N)(=O)=O)c(C(=O)NNC(=O)COc2ccc(Br)cc2)c1	767191519	CQBDEQRCELTUCD-UHFFFAOYSA-N	442.291	1.245	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)c1cccnc1OCC(F)(F)F	767281170	UBVJQHRTQSQCHQ-UHFFFAOYSA-N	425.363	1.878	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)CCCOc2ccc3c(c2)OCO3)c1	767530881	SCYWOODOXQHCQH-UHFFFAOYSA-N	425.397	1.450	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)CCC(=O)N1CCN(c2ccccc2)CC1	767853778	YWOYBVMRNRTVFI-UHFFFAOYSA-N	439.516	1.384	50	20	IDGD	
CC(C)(C)[C@@H](Br)C(=O)NC1CCN(S(=O)(=O)C2CCOCC2)CC1	768167852	XJCHZHUQYAYNBM-AWEZNQCLSA-N	425.389	1.885	50	20	IDGD	
CO[C@H](CNC(=O)OC(C)(C)C)CC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	768223360	CXAKARMIJPGKEK-ZDUSSCGKSA-N	444.510	1.173	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)[C@H]2CC(=O)N(CC(F)(F)F)C2)n[nH]1	768282064	VMKZLUBFJBFCNR-JTQLQIEISA-N	425.367	1.257	50	20	IDGD	
Cc1nc(-c2cccnc2)nc(NNC(=O)c2cccc([C@]3(C)NC(=O)NC3=O)c2)c1C	769118576	XGZVZAUTHCHKQV-QFIPXVFZSA-N	431.456	1.967	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)nnn1Cc1ccc(F)cc1	769848223	WIOSGBROXCSLNE-UHFFFAOYSA-N	435.419	1.740	50	20	IDGD	
CSCCNC(=S)NNC(=O)CCc1nc(C2(NC(C)=O)CCCCCC2)no1	770241163	VTPMLZLYSOUIHR-UHFFFAOYSA-N	442.611	1.546	50	20	IDGD	
O=C(NNC(=O)[C@H]1CC(=O)N(c2c(F)cccc2F)C1)c1nnc(O)c2ccccc12	770577700	DVRFTLNFOYDLSC-JTQLQIEISA-N	427.367	1.428	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)C3=CCOCC3)c2)cc1	771605187	FWVBKAPERFHRBI-UHFFFAOYSA-N	431.470	1.604	50	20	IDGD	
C[C@]1(c2ccc(F)c(Cl)c2)NC(=O)N(CC(=O)NNc2ccc(Cl)nn2)C1=O	771734677	HCJMFMRSTILQQC-MRXNPFEDSA-N	427.223	1.833	50	20	IDGD	
Cc1cc(N2CCCS2(=O)=O)ccc1C(=O)O[C@H](C)C(=O)NNC(=O)CC(C)C	772152261	BXYGJHJQIGPIBR-CQSZACIVSA-N	425.507	1.274	50	20	IDGD	
CNC(=O)COc1cccc(CC(=O)NNC(=O)c2ccc(F)cc2Br)c1	772219186	QKYUKQORMKRVIR-UHFFFAOYSA-N	438.253	1.717	50	20	IDGD	
O=C(Cn1cc(C(=O)NNC(=O)c2cccc(Br)c2)cn1)NC1CCCC1	772458468	BOEDUASJNCPTNV-UHFFFAOYSA-N	434.294	1.779	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)sc1S(N)(=O)=O	772971906	QJZAZIOEDZSYSY-MRVPVSSYSA-N	433.895	1.286	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@@H]1CN(C(=O)NNC(=O)c2cccc(OC(F)F)c2)CCO1	773272913	KOMGOEFIMGCJFD-CQSZACIVSA-N	444.435	1.868	50	20	IDGD	
CN1CCN(C(=O)NNC(=O)C[C@@](O)(c2nc3ccccc3s2)C(F)(F)F)CC1	773660153	VHOOUUCAEMJPAX-MRXNPFEDSA-N	431.440	1.425	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccccc2CN2C(=O)CCC2=O)cc1F	773889035	KYRGVZLEHDRLGV-UHFFFAOYSA-N	426.404	1.183	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(OCC(F)(F)F)nc1)[C@H]1COc2ccccc2O1	777906550	BXBHJTJCVZVNHM-CYBMUJFWSA-N	433.364	1.172	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)NNC(=O)NCc2ccco2)cc1Br	780383901	NNLFRYQPZDQZCH-UHFFFAOYSA-N	431.268	1.693	50	20	IDGD	
O=C(NNC(=O)C(=O)NC1CC1)C(=O)Nc1ccc(Sc2ccc(Cl)cc2)cc1	782967609	UUIVMRPGRWZFAQ-UHFFFAOYSA-N	432.889	1.856	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1cccc(NC(=O)C(=O)NNc2cncc(Cl)n2)c1	783258103	AFFNPDSHNOGBIM-UHFFFAOYSA-N	426.886	1.289	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2cccc(CSC3CCOCC3)c2)CCS(=O)(=O)C1	783426137	FWKRGHQOOBFAQJ-LJQANCHMSA-N	441.575	1.235	50	20	IDGD	
Cc1nc(-c2cccc(NC(=O)C(=O)NNC(=O)CNC(=O)c3ccco3)c2)oc1C	784003932	GBMFCNDZUFSNLC-UHFFFAOYSA-N	425.401	1.067	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N(CC)CC)cc1NC(=O)C(=O)NNc1ccccn1	784791209	DTHKZIHCMSNZLT-UHFFFAOYSA-N	435.506	1.593	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)C(=O)Nc2cccc(CN3CCN(C)CC3)c2)c1	784852188	RXNSPIUXRKQULI-UHFFFAOYSA-N	425.489	1.302	50	20	IDGD	
CCN(CC)Cc1cccc(NC(=O)C(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)c1	785022213	DKVBMQWUCGUDPU-UHFFFAOYSA-N	429.433	1.542	50	20	IDGD	
O=C(NNc1cc(F)c(F)c(F)c1)C(=O)Nc1ccc(C(=O)N2CCOCC2)c(F)c1	785083250	JHQMOLFTBPKCPE-UHFFFAOYSA-N	440.353	1.797	50	20	IDGD	
N#Cc1ccc(NNC(=O)C(=O)Nc2ccccc2CN2C(=O)CCC2=O)cc1Cl	785095362	VJEMIQZHXYIVPG-UHFFFAOYSA-N	425.832	1.942	50	20	IDGD	
COC(=O)c1csc(NC(=O)C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)c1	785099235	BHUSZEAOVCBPDH-UHFFFAOYSA-N	438.412	1.787	50	20	IDGD	
COc1cc(Cl)ccc1NC(=O)C(=O)NNc1c(OC)cccc1S(C)(=O)=O	785331607	WUAZETOMRJXPRK-UHFFFAOYSA-N	427.866	1.843	50	20	IDGD	
C[C@@H]1[C@@H](C(=O)NNC(=O)c2csc(N3CCOCC3)n2)CCN1C(=O)OC(C)(C)C	786258013	XMDLKNNZSHLKFH-OLZOCXBDSA-N	439.538	1.386	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)NCc3cc([N+](=O)[O-])cc(C(F)(F)F)c3)nc21	787339003	MZSORLWAEQTUHG-UHFFFAOYSA-N	426.315	1.822	50	20	IDGD	
CS(=O)(=O)c1cc(NC(=O)C(=O)NNC(=O)Cc2ccccc2F)ccc1Cl	788332189	BFFHXBWZBUSYAB-UHFFFAOYSA-N	427.841	1.211	50	20	IDGD	
C[C@@H]1C[C@@H](C)CN(S(=O)(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)C1	788918733	ZSNOHIHQXAGYOK-HUUCEWRRSA-N	433.575	1.318	50	20	IDGD	
COC(=O)c1csc(-c2cccc(CNC(=O)NN[C@]3(C)CCS(=O)(=O)C3)c2)n1	790622578	CNWOQGBOGGEPLJ-GOSISDBHSA-N	438.531	1.478	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)CCN1CCN(C(=O)OC(C)(C)C)CC1	792014113	FSESEUQIHMNMCV-UHFFFAOYSA-N	436.509	1.164	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)cccc1NC(=O)N(C)C	792354608	KMJRCVVRVFVNKZ-UHFFFAOYSA-N	433.852	1.847	50	20	IDGD	
CC(=O)NC[C@@H]1CCn2ncc(C(=O)NNC(=O)CCSc3ccc(F)cc3)c2C1	792736240	GISYEOXWPXBQJU-CQSZACIVSA-N	433.509	1.664	50	20	IDGD	
COC(=O)[C@@H]1CCCCN1C(=O)c1cccc(NC(=O)C(=O)NCCSSC)c1	793078681	HTMFMLJCVQXNDF-HNNXBMFYSA-N	439.559	1.920	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNS(=O)(=O)c2ccc(C(=O)OC)cc2F)cc1	794575863	AVABHNWTJGIQSZ-LBPRGKRZSA-N	440.449	1.788	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)c1cn(-c2cccc([N+](=O)[O-])c2)nn1	795168106	HHNYWRCHWCEUAA-UHFFFAOYSA-N	431.434	1.183	50	20	IDGD	
O=C(NNC(=O)c1cccnc1)Nc1ccc(NS(=O)(=O)Cc2ccccc2)cn1	797653418	RTKRGZVPKWIXTC-UHFFFAOYSA-N	426.458	1.885	50	20	IDGD	
Cc1cc(O[C@@H]2CCN(C)C2=O)ccc1NC(=O)C(=O)NNC(=O)CCc1ccccc1	799258932	LCXIJJYTZACTER-LJQANCHMSA-N	438.484	1.323	50	20	IDGD	
COc1cc(OC)cc(N2C[C@@H](C(=O)NNC(=O)C(=O)Nc3ccc(C)cc3)CC2=O)c1	801110586	DKCDCLXCAMKMLB-AWEZNQCLSA-N	440.456	1.151	50	20	IDGD	
COCCS(=O)(=O)CC(=O)NNc1c(Br)cccc1Br	801501667	TVYAENTXCWJBQO-UHFFFAOYSA-N	430.118	1.716	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)c2cc(N3CCNC(=O)C3)ccn2)cc1Cl	802074703	VUTPGOWDBQYHOB-UHFFFAOYSA-N	448.867	1.155	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)Cc2c(C)[nH]c3ccnn3c2=O)cc1Cl	802075608	ZADBZKZTGKTFGH-UHFFFAOYSA-N	434.840	1.397	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)Cn2ccc(=O)c([N+](=O)[O-])c2)c(OC)cc1Cl	802079674	VNWKFZGSRRGCOM-UHFFFAOYSA-N	425.785	1.280	50	20	IDGD	
O=C(NNc1ccc2c(=O)[nH]ccc2c1)NC1CCN(S(=O)(=O)C(F)(F)F)CC1	806945580	MBDIRFNYUVQMOS-UHFFFAOYSA-N	433.412	1.468	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1cc(F)c(N2CCOCC2)cc1F	806976306	ADZKGNUXLBFBJC-UHFFFAOYSA-N	434.399	1.210	50	20	IDGD	
Cc1c(NNC(=O)C(=O)Nc2ccc(F)c(N3C(=O)CCC3=O)c2)cccc1[N+](=O)[O-]	807005327	FVZWGOWTCZANJG-UHFFFAOYSA-N	429.364	1.778	50	20	IDGD	
O=C(COc1ccccc1Cc1ccccc1)NNC(=O)NCCC1(O)CCOCC1	807448170	HMCJNSJPJAHGAV-UHFFFAOYSA-N	427.501	1.918	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)NCc2ccccc2S(N)(=O)=O)cc1OC	807604746	CPXILXLVXZUKLX-UHFFFAOYSA-N	436.490	1.276	50	20	IDGD	
Cc1nn(C)cc1S(=O)(=O)NC(=O)/C(C#N)=C/c1cc(C)n(C[C@@H]2CCCO2)c1C	809034155	RPTNUUXTPKKJEE-GONKEYIRSA-N	431.518	1.738	50	20	IDGD	
COc1ccc(Sc2nsc(NC(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)n2)cc1	809922307	CYMYMQPTBANZJN-SECBINFHSA-N	443.532	1.285	50	20	IDGD	
NC(=O)c1ccc(NC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c(OCC(F)F)c1	810304675	RJNBTYDPJJYWJQ-OAHLLOKOSA-N	436.371	1.422	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)CNS(=O)(=O)c1ccc(NC(C)=O)cc1)c1ccccc1	810379140	QIFCIWUYVBQOOU-GOSISDBHSA-N	432.502	1.265	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)[C@]2(COC)CCN(C(=O)OC(C)(C)C)C2)nc1C	810933512	YYPHGUXHSGJLSD-HXUWFJFHSA-N	437.497	1.678	50	20	IDGD	
COC(=O)c1cn(-c2cccc(NC(=O)NNc3cccc(S(C)(=O)=O)c3)c2)nn1	812979488	AACOKUNWJNOIRP-UHFFFAOYSA-N	430.446	1.606	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)N[C@@H]1CC(=O)N(c2ccccc2F)C1	813236356	JEJFPKUVXHRIDP-CQSZACIVSA-N	430.436	1.739	50	20	IDGD	
NC(=O)c1ccccc1Oc1ccc(NC(=O)NNC(=O)[C@H]2CCc3nncn3C2)cc1	814654243	DYHCLXIXRGSUIZ-ZDUSSCGKSA-N	435.444	1.585	50	20	IDGD	
CC(Cn1cccn1)=NNC(=O)c1cc(S(=O)(=O)NCc2ccccc2)ccc1O	814779020	ZYXHCFLZXGYLQD-UHFFFAOYSA-N	427.486	1.873	50	20	IDGD	
O=C(COC(=O)c1ccc(OC(F)F)c(F)c1)NNC(=O)[C@@H]1COc2ccccc2O1	815484070	BTSCEGFKXUGCCD-HNNXBMFYSA-N	440.330	1.571	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1)C1CC1	815570087	QSCMRLXEKVIAKS-UHFFFAOYSA-N	446.467	1.787	50	20	IDGD	
Cc1cc(-c2ncccc2NC(=O)C(=O)NNC(=O)[C@@H]2CCc3nncn3C2)cs1	815691954	GKVBHTISDKPPTG-GFCCVEGCSA-N	425.474	1.059	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)[C@@H]1CC(=O)N(c2ccc3c(c2)OCCO3)C1	825615175	LOAFTVNIPJKSPJ-CQSZACIVSA-N	440.456	1.079	50	20	IDGD	
Cc1ccc(NNC(=O)[C@H](CCS(C)(=O)=O)NS(=O)(=O)c2ccccc2)cc1	849512749	KATOCSUUHBSLAX-KRWDZBQOSA-N	425.532	1.220	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2ccc(NNC(=O)[C@@H]3CCC(=O)N3)c([N+](=O)[O-])c2)cc1	912762690	MZVUKKGXCZXVRB-HNNXBMFYSA-N	449.445	1.126	50	20	IDGD	
CCOc1cc2c(cc1CNC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)O[C@H](C)C2	915934080	VBDCQXZPOVAZBD-CYBMUJFWSA-N	447.513	1.956	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2cccc(NC(=O)C3CCC3)c2)c1	916381879	XUPLAENERFVKQH-UHFFFAOYSA-N	444.513	1.973	50	20	IDGD	
COCc1ccccc1CNC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1	916426291	IJORGCKWLHQWCU-UHFFFAOYSA-N	434.518	1.293	50	20	IDGD	
CN1CCN(CCCNC(=O)NNC(=O)COc2ccccc2F)[C@@H](c2ccccc2)C1	916484661	FCVWTKKYWMOGJY-HXUWFJFHSA-N	443.523	1.914	50	20	IDGD	
O=C(NN=Cc1ccc(-n2ccnc2)cc1)C(=O)NN=Cc1ccc(-n2ccnc2)cc1	917022491	FCXMYOKPMGUBHR-UHFFFAOYSA-N	426.440	1.658	50	20	IDGD	
CC(C)S(=O)(=O)CC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	917698031	XARFLTTYUWPEBM-UHFFFAOYSA-N	445.544	1.133	50	20	IDGD	
CCOc1ccc(C(=O)NNS(=O)(=O)c2cc(S(C)(=O)=O)ccc2C)cc1OC	917727688	MKXOVXTVHANPCT-UHFFFAOYSA-N	442.515	1.429	50	20	IDGD	
Cc1ccccc1NC(=O)NNC(=O)c1ccc(C)c(S(=O)(=O)N2CCOCC2)c1	918692990	QJQNPIHTTDIGSX-UHFFFAOYSA-N	432.502	1.791	50	20	IDGD	
CCCS(=O)(=O)N1CCCC[C@H]1C(=O)OCC(=O)NNC(=O)c1cccc(Cl)c1	919475622	UHKIRGPPTOUKPW-HNNXBMFYSA-N	445.925	1.239	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2ccc(N3NC(=O)CCC3=O)cc2)ccc1OC(C)C	920288116	NXAFKNHERUKXIC-UHFFFAOYSA-N	440.456	1.715	50	20	IDGD	
COc1cc(C=NNC(=O)N[C@@H]2CCS(=O)(=O)C2)ccc1OC(=O)c1cccnc1	920380104	GRPYHTKPJAUYPY-OAHLLOKOSA-N	432.458	1.130	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NCc1cccc(C(=O)N2CCOCC2)c1	920811305	GTZRUWQZVGAHNP-OAHLLOKOSA-N	444.463	1.596	50	20	IDGD	
COCCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2c3ccccc3C[C@H]2C)c1	920862994	NRVKILGHMSOKOE-OAHLLOKOSA-N	446.529	1.807	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2cc(C)nn2-c2ccccn2)c2ccccc2c1=O	920928502	JTQGMDICAXZBEG-UHFFFAOYSA-N	432.444	1.772	50	20	IDGD	
O=C(NNC(=O)c1cccc2c1OCCO2)c1cccc(S(=O)(=O)N2CCCCC2)c1	921298654	HJGMZQWXMSSNGC-UHFFFAOYSA-N	445.497	1.707	50	20	IDGD	
O=C(CCCC[C@@H]1SC[C@H]2NC(=O)N[C@H]21)NNC(=O)c1cc(Br)c[nH]1	921304598	XXCRIHKBEBVFMZ-NTZNESFSSA-N	430.328	1.264	50	20	IDGD	
O=C([C@H](O)CCl)N1CCO[C@]2(CCN(C(=O)[C@H]3C[C@@H]3c3ccc(Cl)cc3)C2)C1	1778185993	APHRODUGZRNOIT-YZLZLFLDSA-N	427.328	1.873	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2)C1=NO[C@H](c2ccccc2)C1	1778788039	VKVWNVHKIPGLQU-VQQMMKBISA-N	449.935	1.618	50	20	IDGD	
O=C1Cc2cccc(C(=O)N3CCO[C@]4(CCN(C(=O)[C@@H](F)Br)C4)C3)c2N1	1781333045	LGTVWBXWXAIPOW-QAPCUYQASA-N	440.269	1.315	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CN2CCCCC2=O)C1	1782108051	IKMPIXYZENHNRK-SPYBWZPUSA-N	444.370	1.296	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc3ccccn3n1)C2	1782172642	ITXUSGVNOSTHNE-YRISNDGFSA-N	434.924	1.716	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc4cccnc4nc3O)C2)C1	1782267047	CFPPUSLITZWUKY-YWZLYKJASA-N	434.880	1.033	50	20	IDGD	
O=C(COc1cccnn1)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCBr)C2	1782519102	SXYSLNGMCABUMB-RDTXWAMCSA-N	441.326	1.154	50	20	IDGD	
O=C(CCc1cnccn1)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Br)C2	1782576595	MZQQYCQVWJBIRE-UWWQBHOKSA-N	443.317	1.614	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc(Cl)nc3)[C@H]2C1	1783380474	BEAUAZRWMBQIOC-DEQVHRJGSA-N	445.745	1.897	50	20	IDGD	
COc1ccc([C@H](O)C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](C)Br)C3)C2)cc1	1783527803	GMQXISQTCSBRAW-AZOIQLNYSA-N	441.322	1.342	50	20	IDGD	
CCOc1cnc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](C)Br)C3)C2)cn1	1783532563	PQKRQOGUICKJOV-YVEFUNNKSA-N	427.299	1.102	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(C1)CN(C(=O)C1(C(=O)Nc3ccccc3)CC1)CCO2	1783871887	WZGMJBVLQIFLJF-LAUBAEHRSA-N	449.935	1.489	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)CCc3ccc(OC)nc3)CCO2)C1	1783872599	COOKWEUEPYMPLO-OXJNMPFZSA-N	425.913	1.107	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ncccc3C(F)(F)F)CCO2)C1	1783876844	AYKJLBYQOWMOKE-CXAGYDPISA-N	435.830	1.798	50	20	IDGD	
O=C(CCc1cncc(C(F)(F)F)c1)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1784295949	AEFINCRQYLDDGU-QAPCUYQASA-N	449.857	1.463	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)CCc3cnccn3)C2)C1	1784560816	GRJUUMCSONTKNU-CRAIPNDOSA-N	425.327	1.413	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](C)n3ccnc3C)C2)C1	1784638956	IIRUSJMTVZZYKY-XUWXXGDYSA-N	427.343	1.756	50	20	IDGD	
C[C@H](C(=O)Nc1ccc(C2(NC(=O)c3cnccc3C(=O)NN)CCC2)cc1)n1ccnc1	1786232770	SAFRYRXYDFKBIO-OAHLLOKOSA-N	447.499	1.891	50	20	IDGD	
CC(C)N[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)C(C)C	1786962148	HYPDIDWKGLEMLB-QXKUPLGCSA-N	436.366	1.679	50	20	IDGD	
Cn1cc(CCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCBr)C[C@@H]32)cn1	1787011071	LPKPBYIJVYSWNQ-JYJNAYRXSA-N	427.343	1.117	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC1(c2ccc(NC(=O)c3ccc(O)nn3)cc2)CCC1	1787231463	XOWPUEFZRHBESZ-UHFFFAOYSA-N	426.477	1.303	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C3(C(=O)Nc4ccccc4)CC3)C[C@@H]21)[C@H](F)Cl	1787443371	HATKLHIZVXOLTD-HJWJTTGWSA-N	437.899	1.919	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@]3(C)C[C@@H]3C)C[C@@H]21	1787507562	DOLIQLDBLGRNGN-WBJBUAFFSA-N	429.521	1.146	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]2C1)n1cccc1C=O	1788765091	RFEPLMWAEJOYKT-NEPXVJNWSA-N	435.597	1.693	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccnc3SC)[C@H]2C1	1789071278	UGRJMWQTRIWSGQ-TUUVXOQKSA-N	427.954	1.651	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cn4[nH]cnc(=O)c4c3C)[C@H]2C1	1789172738	LXHDADDGEWXKFB-LLLHUVSDSA-N	449.939	1.332	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(C)c4n[nH]cc4c3)[C@H]2C1	1790363691	AKABKHDUMZSIDW-MGHWNKPDSA-N	434.924	1.718	50	20	IDGD	
NC(=O)[C@H](N)CCC(=O)NC1(c2ccc(NC(=O)[C@@H](F)Br)cc2)CCC1	1790534843	UFEIHJAQJJGWCX-TZMCWYRMSA-N	429.290	1.404	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3c(C)nn(C)c3C)C[C@@H]21	1790958064	GPLXDJVGPPRFPO-JONQDZQNSA-N	441.370	1.804	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cnccn3)C[C@@H]21	1790958312	OYHWUJDDNUCQQD-TUUVXOQKSA-N	425.327	1.172	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cnc3ccccn13)C2	1792868763	OKLZTWZCXGXJPT-ZTENYAIWSA-N	449.349	1.497	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3cccnc3n1)C2	1792870359	FDHOKNMQNOMTQH-FAYQHZLMSA-N	447.333	1.864	50	20	IDGD	
CC(C)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C=C/C(=O)NCc1ccccc1	1792938515	SFFKDUZGSRJFPS-RJNPGBPASA-N	447.963	1.714	50	20	IDGD	
C/C=C(\C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1793879307	YOMUROQVINRINC-YYTNDJERSA-N	429.945	1.674	50	20	IDGD	
O=C(NCCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](F)Br)C2)c1ccc[nH]1	1794307363	JFKXDRFOUADACP-OXIQGZBJSA-N	429.290	1.463	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(Br)nc1F)[C@@H](O)CCl	1794532373	UDHALJCZTOITMF-WYFGTUCQSA-N	434.693	1.835	50	20	IDGD	
COC(=O)[C@H]1CCC[C@@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCBr)C1	1795116897	DSYRHTWMBPHHQQ-LBKYZSNHSA-N	445.354	1.340	50	20	IDGD	
Cc1cc(C(=O)NCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CCBr)no1	1795493350	GOCXRRBQSQPYMF-CLLJXQQHSA-N	427.299	1.136	50	20	IDGD	
CC(C)c1ccc(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)cc1	1796192149	NXTDWYPUELARIQ-NUNAXRQHSA-N	434.345	1.984	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnn2ccncc12	1797062295	UNLGNSBEIGJIDO-LMWOUKEDSA-N	436.310	1.106	50	20	IDGD	
CC(=O)Nc1ccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)C(Cl)Cl)C3)cc1	1797233659	ZARYPMHHOJHTAN-XOIINTDNSA-N	428.316	1.581	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(C)cc1	1798965777	WPHKSDROMVNUHS-WCARGJHZSA-N	437.500	1.332	50	20	IDGD	
Cc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Br)ncc1[N+](=O)[O-]	1799346928	FGZCTWBTPPWROF-DJBIQUGXSA-N	445.245	1.192	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccnc2c(O)cccc12	1800097425	PWVZBGQVWWBZEK-KOFHJDLBSA-N	448.317	1.927	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c[nH]nc3c1)C2	1800639564	IZNDBXRJLATOLC-IVSAIRAKSA-N	435.322	1.940	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cccc(OC)n1)C2	1800640044	IHKCUTCXTRPTDY-ZFHGCVPZSA-N	440.338	1.396	50	20	IDGD	
Cc1ccc(COCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CCC(=O)NN(C)C)cc1C	1802332594	DXLHALCSQQHOBW-WKCHPHFGSA-N	444.576	1.831	50	20	IDGD	
CCOc1ncccc1C(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1	1803137794	RVLHBDKGZUVXJA-NJAFHUGGSA-N	432.908	1.795	50	20	IDGD	
Cc1cc[nH]c1C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1807361672	HBPLVSFEGIYYEQ-RXVVDRJESA-N	432.289	1.031	50	20	IDGD	
C=C(C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)C(F)(F)F	1807374049	WWKDTXWILDMVKI-AEFFLSMTSA-N	447.222	1.200	50	20	IDGD	
Cn1ncnc1C(=O)N1CC[C@H](CNC(=O)[C@H](F)Br)[C@H]1c1cccnc1	1808650897	GZHOZAFMCSGDEQ-UPJWGTAASA-N	425.262	1.220	50	20	IDGD	
CN1C(=O)CC[C@H]1C(=O)N1CC[C@H](CNC(=O)[C@H](F)Br)[C@H]1c1cccnc1	1808676003	KDGVCLUOZCFNPO-CLWVCHIJSA-N	441.301	1.399	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC2(CCCN(C(=O)CCN3CCCCC3)C2)CC1	1809323995	VFHHYTGMGWEZIM-UHFFFAOYSA-N	435.613	1.467	50	20	IDGD	
CS(=O)(=O)c1ccc(C(=O)N2CCC3(CCCN(C(=O)[C@@H](F)Cl)C3)CC2)nc1	1810900175	YEPRYPHCQMLOFZ-OAHLLOKOSA-N	431.917	1.864	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H](CNC(=O)CNC(=O)OC)[C@@H]1c1cccnc1	1813270091	YYVIDIMPQUUIEQ-YCPHGPKFSA-N	441.326	1.617	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)CCS(C)(=O)=O)[C@H]1c1cccnc1	1813573194	DHTZYWCMELAOGG-SOLBZPMBSA-N	429.970	1.930	50	20	IDGD	
CN[C@H](CC(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@](C)(Cl)CCl)CC2)C(=O)O	1815081593	DRGFZDNRRGXJMB-DOZZXWOPSA-N	437.349	1.354	50	20	IDGD	
Cc1cncc(C(=O)N[C@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)c1	1815339981	YVQCSCUCWPFNSF-INIZCTEOSA-N	436.302	1.066	50	20	IDGD	
O=C(CC(F)(F)F)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1	1815354836	STUDDMRNSJJQPV-NSHDSACASA-N	427.213	1.001	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccccc2O)[nH]n1)c1cccc(B(O)O)c1	1817473546	ZRPIMTMKZKMICY-GOSISDBHSA-N	434.261	1.415	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CN2CCN(C(C)=O)CC2)n[nH]1	1818966416	FRVZLCCCNNXHOF-DOTOQJQBSA-N	438.960	1.583	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2nccs2)[nH]n1	1819401992	HASDOXHWIAGHNI-CQSZACIVSA-N	440.489	1.484	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccnnc2O)[nH]n1)[C@H](F)Br	1820935083	IBMFDIRYUMZGTF-JQWIXIFHSA-N	427.234	1.902	50	20	IDGD	
C[C@@H](C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1)C1(O)CCC1	1822412596	RRWUJTMBWMDPIN-HOCLYGCPSA-N	434.541	1.326	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@]2(C)CC2(F)F)[nH]n1	1822417159	BJIOFGWRIUKOPQ-SCLBCKFNSA-N	426.468	1.820	50	20	IDGD	
CN1N=C(C(=O)N[C@H]2CCc3nc(NC(=O)[C@@](C)(Cl)CCl)sc3C2)CCC1=O	1822861016	UEWVAKPKYZTLLU-XYZCENFISA-N	446.360	1.900	50	20	IDGD	
O=C(COc1cccnn1)N[C@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1	1823013988	MECDJZZWELFKFH-ISVAXAHUSA-N	444.286	1.615	50	20	IDGD	
Cc1cccc(C)c1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(B(O)O)cc1)CC2	1823515282	ZMVADTWGYKAOJJ-KRWDZBQOSA-N	449.341	1.979	50	20	IDGD	
CN[C@H](CC(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H](C)CBr)CC1)C(=O)O	1824092720	GYXVNMGURQFIJN-NUEKZKHPSA-N	446.386	1.700	50	20	IDGD	
O=C1Nc2c(cccc2C(=O)N2CCC([C@@H]3CCCCN3C(=O)[C@H](O)CCl)CC2)C1=O	1824184882	AOJBJZLGHICTTM-DLBZAZTESA-N	447.919	1.654	50	20	IDGD	
CCOc1cnc(C(=O)N[C@H]2CCc3nc(NC(=O)[C@H](Cl)COC)sc3C2)cn1	1825993546	JTWXZJQVWULCGG-WDEREUQCSA-N	439.925	1.811	50	20	IDGD	
O=C1CC[C@@H](C(=O)N2CCC([C@@H]3CCCCN3C(=O)CCBr)CC2)CN1	1826354474	IAOHHWIZYWICBK-CVEARBPZSA-N	428.371	1.917	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](O)c2ccccc2)CC1	1826651774	DSXOXXXEOXDQAG-REWPJTCUSA-N	444.576	1.713	50	20	IDGD	
C[C@@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1)n1ccnc1	1827048861	APVVCHAMVQIBOR-UWJYYQICSA-N	438.337	1.057	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2C[C@H](O)CN2)CC1	1830204462	XHUQUYINLDPNPV-QAETUUGQSA-N	430.387	1.502	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(=O)cco2)CC1	1831871463	FXLMQNFEFSEOJX-SFHVURJKSA-N	432.521	1.246	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)[C@H]2CCCS2)CC1	1832433917	LYABZFSCYQODAU-VQTJNVASSA-N	430.379	1.495	50	20	IDGD	
Cc1noc(C)c1CC(=O)N1CCO[C@]2(COCCN(C(=O)CCBr)C2)C1	1832552283	BDMJUNQIOPDSPC-SFHVURJKSA-N	444.326	1.075	50	20	IDGD	
O=C(CCc1cccs1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1833158896	KTJBABZCLXMROW-RDJZCZTQSA-N	449.342	1.828	50	20	IDGD	
O=C(c1ccccc1O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1833758439	SJQWDBTXLFPQPU-YOEHRIQHSA-N	431.258	1.153	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccnc3OC)CCO2)C1	1834125294	OWMHCLNAZDPNJB-UZLBHIALSA-N	425.913	1.568	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3ccsc3)CCO2)C1	1836008493	DHRDRKGLEZJCRJ-QFBILLFUSA-N	430.954	1.391	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc4n(n3)CCCO4)CCO2)C1	1836966549	DBTJOJVZQQEWHO-YWZLYKJASA-N	440.928	1.143	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cccc(=O)n3C)CC2)CC1	1837380661	ZMJKJBIHQSSISU-KRWDZBQOSA-N	439.940	1.251	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(Cl)ncn3)CCO2)C1	1838254376	SQPXZJQATNBUHI-GOSISDBHSA-N	431.320	1.465	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccnc3SC)CCO2)C1	1838287307	GTJACWXJAVWKDX-DNVCBOLYSA-N	443.953	1.127	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(OC)cc3OC)CCO2)C1	1838880284	LFTPUOFFKBPEJQ-UTKZUKDTSA-N	440.924	1.791	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)c3ccc(OC)cc3)C2)C1	1839141647	OMMGMBREZHNQBL-UEXGIBASSA-N	440.924	1.202	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3nc(O)n4c3CCCC4)C2)C1	1839145417	HBJLAHJIAIKYRW-XOBRGWDASA-N	440.928	1.012	50	20	IDGD	
Cc1ccc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)o1	1839203178	CFSHVDLHNINACJ-WBVHZDCISA-N	433.274	1.277	50	20	IDGD	
O=C(c1cc(F)cc([N+](=O)[O-])c1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1839353796	QRZHNEGDKUVZAN-PBHICJAKSA-N	433.795	1.338	50	20	IDGD	
CC(=O)Nc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)ccc1C	1839402957	SRRZQLFZPOLPLJ-FXAWDEMLSA-N	441.887	1.558	50	20	IDGD	
Cc1cccc(CCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)n1	1840186391	GVMFPMAWLLXRTB-LJQANCHMSA-N	430.332	1.583	50	20	IDGD	
CC(C)(C(=O)N1CCO[C@@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1)c1ccccn1	1840329353	SVYJJMKUOBWDDN-JOCHJYFZSA-N	449.624	1.667	50	20	IDGD	
O=C(c1cc(Br)cnc1Cl)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1	1841352021	RQXCBMADAQLAMN-LLVKDONJSA-N	437.121	1.914	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H]2C[C@@]21C(=O)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1	1841353949	ZIDRASVRBULKRJ-CKNLXJGOSA-N	427.929	1.189	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2cnc(Cl)c(Cl)c2)C1	1844449152	UUBOXDUVVLEHPO-UHFFFAOYSA-N	449.298	1.518	50	20	IDGD	
CS(=O)(=O)Cc1ncccc1C(=O)N1CC2(CCCN2C(=O)[C@@H](F)Br)C1	1845216437	QNKUNVOPBQOFOD-CYBMUJFWSA-N	448.314	1.134	50	20	IDGD	
O=C([C@H](O)CCl)N1CC2(CCCN2C(=O)c2cccc([N+](=O)[O-])c2Br)C1	1845330284	BTXOBHBTJVGFLF-GFCCVEGCSA-N	446.685	1.774	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)C2CN(C(=O)OCc3ccccc3)C2)C1	1845948894	XZBFSQVUNWCMOO-GOSISDBHSA-N	449.935	1.712	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC12CN(C(=O)c1cccc(S(C)(=O)=O)c1)C2	1846175402	XEEGCTCPLLXHRL-LBPRGKRZSA-N	429.336	1.691	50	20	IDGD	
Cc1oc(-c2ccccc2)nc1C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	9717676	OYJANOWQTHNMQW-QGZVFWFLSA-N	437.408	1.794	50	20	IDGD	
CS(=O)(=O)Nc1ccccc1C(=O)OCC(=O)NNC(=O)c1ccc(Cl)cc1	10265581	XQLAZQNPIVLYSU-UHFFFAOYSA-N	425.850	1.330	50	20	IDGD	
O=C(CSc1nnc(N2CCOCC2)n1C1CC1)NNC(=O)c1ccc(Cl)cc1	11376880	IYXNJPTUUXZOID-UHFFFAOYSA-N	436.925	1.656	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CSc2ccc(C)cc2)cc1S(=O)(=O)N(C)C	15467547	ADNPEMFPJCGPOF-UHFFFAOYSA-N	437.543	1.807	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)COc2cccc(N3CCCC3=O)c2)c2ccccc2c1=O	17190630	GZPDPTJBVIWYBT-UHFFFAOYSA-N	449.467	1.383	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)[C@@H]1CC(=O)N(Cc2ccccc2Cl)C1	26692473	JYSLUCNWYFBQBQ-RDTXWAMCSA-N	429.860	1.676	50	20	IDGD	
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)NNC(=O)c1cccc(Cl)c1	26773309	GXOHLISUFPNCSO-INIZCTEOSA-N	432.864	1.662	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@H](c2ccccc2)N2CCCCC2=O)c2ccccc2c1=O	110938488	BTWHARQBCILCJN-NRFANRHFSA-N	447.495	1.931	50	20	IDGD	
CC[C@@H](C)N(C)CCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	727227506	AOHXEIRMSAQGMA-MRXNPFEDSA-N	439.582	1.536	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)Cn2cc(Br)ccc2=O)cc1F	727498169	JSALKALDACCCAT-UHFFFAOYSA-N	429.271	1.776	50	20	IDGD	
CCOC(=O)c1cc(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc([N+](=O)[O-])c1	728846049	UOSXBXWFNXDKDL-UHFFFAOYSA-N	442.432	1.239	50	20	IDGD	
O=C(NCc1cc(F)ccc1F)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	729622295	WIRJKJNKQXTLKS-UHFFFAOYSA-N	438.456	1.894	50	20	IDGD	
CC(C)COc1ccc(CC(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1	730368140	RSBKVONUVNBUFF-FQEVSTJZSA-N	442.468	1.795	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)[C@H]1CCN(c2ccc3c(c2)OCCO3)C1=O	730521064	OQRXPFCIAUKOAK-OAHLLOKOSA-N	445.859	1.934	50	20	IDGD	
Cc1ccc([C@@H](CN2CCOCC2)NC(=O)NNC(=O)COc2ccccc2O)cc1	730903302	JEDKCOSQWTZWMN-GOSISDBHSA-N	428.489	1.483	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])c(OC)c1	731052409	OVJLKMYUXRZPPA-UHFFFAOYSA-N	436.808	1.456	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)c1ccccc1)C(=O)NNC(=O)Cc1ccccc1F	731345186	FGDXGGTWBVDHPN-QGZVFWFLSA-N	439.534	1.616	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)N1CCC(C(=O)Nc2ccc(Br)cn2)CC1	731848219	GQQJKDPGSRDGSH-LLVKDONJSA-N	426.315	1.441	50	20	IDGD	
O=C(NNC(=O)[C@H](O)c1cccnc1)c1ccccc1NS(=O)(=O)c1cccs1	731865887	WBNLXKLZXTUHPN-MRXNPFEDSA-N	432.483	1.439	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1)N1CCc2ccccc2C1	732259920	LCTKSHXNXIDFMV-LBPRGKRZSA-N	436.921	1.195	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)Cc1ccc(OCC#N)cc1	732365216	JSXDAMVBSIGJMO-UHFFFAOYSA-N	431.832	1.798	50	20	IDGD	
CN1CCN(C)[C@H](CNC(=O)NNC(=O)COc2ccc(OCc3ccccc3)cc2)C1	732474617	IKBBJILVOFWFAM-LJQANCHMSA-N	441.532	1.221	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@@H]2CCCN2Cc2ccccc2)c1	734173275	GXJIYTIXYCCCBU-SFHVURJKSA-N	430.530	1.699	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)N[C@H](C)CN2CCN(c3ccccn3)CC2)c1	735588031	YRAJUDQYGVJUAF-LJQANCHMSA-N	440.548	1.618	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCc3ccccc32)cc1C(=O)NNc1cccnn1	736702142	CYWXNOSOJGPLTH-UHFFFAOYSA-N	425.470	1.994	50	20	IDGD	
CCOc1ccc(/C=C(/C#N)C(=O)N2CCN(c3cc(N4CCOCC4)ncn3)CC2)cc1	737999024	GMIKBUSEGZBLCV-HKWRFOASSA-N	448.527	1.968	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCC2(c3cccc(F)c3)CC2)c1	740484672	REHXRVVAESKGIZ-UHFFFAOYSA-N	434.493	1.752	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)c1ccc2c(c1)C(=O)N(C1CCCCC1)C2=O	740851359	AZGRNDYYDAPDNN-UHFFFAOYSA-N	428.489	1.681	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)CCN2CCN(c3ccccn3)CC2)cc1	741144429	RQNGPLPMSAVKCK-SFHVURJKSA-N	441.532	1.607	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)[C@@H]2CCCN(C(=O)c3ccncc3)C2)cc1OC	742037856	IZFAPMQFCSSYKK-QGZVFWFLSA-N	426.473	1.802	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1cc(-c2ccncc2)on1	744622536	XQYHGCMOADKYCH-UHFFFAOYSA-N	429.458	1.514	50	20	IDGD	
C[C@H](CC(=O)c1ccccc1F)C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	745488029	HDLZCIOBACIAJZ-BFUOFWGJSA-N	444.415	1.565	50	20	IDGD	
C[C@@H]1C[C@@H](NC(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)CCN1C	745855276	USZNYKTWHZFDBO-AEFFLSMTSA-N	448.527	1.872	50	20	IDGD	
Cn1cccc1CNC(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	745925302	KXVXXUWFVIYYBI-UHFFFAOYSA-N	430.472	1.871	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)c1ccccc1S(=O)(=O)N1CCCCC1	746548826	NFGFHZTWLBEOLR-UHFFFAOYSA-N	441.513	1.513	50	20	IDGD	
COc1cc(C)nc(NNC(=O)c2ccc(OC)c(S(=O)(=O)NC3CCCC3)c2)n1	746634338	CKBIBDKSNNPRRL-UHFFFAOYSA-N	435.506	1.780	50	20	IDGD	
COc1cc(C)nc(NNC(=O)c2ccc(Br)c(S(=O)(=O)N(C)C)c2)n1	746634865	RSXAZKHZSXUVGE-UHFFFAOYSA-N	444.311	1.563	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1ccc(N2CCOCC2)cc1	746648126	ZJHAODALFCZEEQ-UHFFFAOYSA-N	447.875	1.803	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2cc3c(s2)CCCCC3)cnc2c1c(=O)n(C)c(=O)n2C	747726791	ZWUHVXTXQIGXPG-UHFFFAOYSA-N	441.513	1.346	50	20	IDGD	
CS(=O)(=O)CC[C@@H](NC(=O)c1ccc(Cl)cc1)C(=O)NNc1cccc(C#N)c1	748035028	LHNVBECNVVHBRX-QGZVFWFLSA-N	434.905	1.888	50	20	IDGD	
CCOC(Cn1cc(C(=O)NNc2nc(-c3ccccn3)nc3c2CCC3)nn1)OCC	748340104	AXQRZIFIPCYCQC-UHFFFAOYSA-N	438.492	1.775	50	20	IDGD	
O=C(Cc1csc(-c2nc[nH]n2)n1)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1	748519272	YRKKEKWZUOOAJU-UHFFFAOYSA-N	432.409	1.908	50	20	IDGD	
O=C(CCn1nc(O)c2ccccc2c1=O)NNc1ccc(S(=O)(=O)C(F)F)cc1	748610578	OSYQNXPRVJIRSZ-UHFFFAOYSA-N	438.412	1.632	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNS(=O)(=O)c2cc(F)cc(C(=O)O)c2)cc1	749143436	UXRUVZAQDNBRSR-LLVKDONJSA-N	426.422	1.700	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@H](CCC#N)c2ccccc2)cc1	749222543	SXYDGTDNVNAEJI-LJQANCHMSA-N	443.529	1.991	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)c2cccn3c(I)cnc23)n1	750014661	CFDORIUNBBZVAC-UHFFFAOYSA-N	438.229	1.213	50	20	IDGD	
CCCN(CC)c1ccc(C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cn1	751290409	KAYDNWIISYRTBX-UHFFFAOYSA-N	447.561	1.708	50	20	IDGD	
CC[C@@H](CS(=O)(=O)c1ccccc1)NC(=O)NNC(=O)c1cc(Br)c[nH]1	752127735	RBILYHIDJFVOLA-LBPRGKRZSA-N	443.323	1.974	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)NC[C@H]1CCN(S(C)(=O)=O)C1	753005341	UMGVRBXINSQGJL-CYBMUJFWSA-N	437.547	1.344	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)N[C@H]2CCN(Cc3ccc(C#N)cc3)C2=O)cc1	753738130	NXHHQGILRNHXDT-IBGZPJMESA-N	437.456	1.077	50	20	IDGD	
C[C@@]1(c2ccc(C(=O)OCC(=O)NNC(=O)c3ccc(Cl)cc3)cc2)NC(=O)NC1=O	754527920	RIWFSVQIJOVGIV-FQEVSTJZSA-N	444.831	1.013	50	20	IDGD	
COc1ccc(C(=O)NN=Cc2cnc(N3CCN(C)CC3)nc2)cc1Br	755728275	RJPQVQJOFMNWHH-UHFFFAOYSA-N	433.310	1.763	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)CNC(=O)c2cccs2)c(Cl)cc1F	755966843	SDCPFBRSZDJSJT-UHFFFAOYSA-N	449.869	1.067	50	20	IDGD	
Cc1cc(OCc2cccc(F)c2)ccc1NC(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O	756339282	FJUVXJYXJSVLTK-CYBMUJFWSA-N	438.481	1.804	50	20	IDGD	
COc1ccc(Sc2ccc(NC(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)cc2)cc1	756354739	CETAZXMRSIYWFJ-LBPRGKRZSA-N	438.531	1.937	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)Nc1ccn(CCc2ccncc2)n1	756729463	BMWPYRGAMBLVBR-UHFFFAOYSA-N	425.405	1.661	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCCC2Cc3ccccc3C2)cc1	756732934	ZOAJBXRNMOAHDI-UHFFFAOYSA-N	444.557	1.751	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)c2cnn(CCC#N)c2-c2ccccc2)c1	758032485	UJIODSARZIVAAC-UHFFFAOYSA-N	437.481	1.942	50	20	IDGD	
O=C(c1cccc(OCC(F)F)n1)N1CCN(S(=O)(=O)CBr)CC1	758527140	JBRNRNWJGLIVOU-UHFFFAOYSA-N	428.255	1.166	50	20	IDGD	
O=C(c1cc(-c2ccc(F)cc2)on1)N1CCN(S(=O)(=O)CBr)CC1	758528484	WBPWPSKGBQHLGB-UHFFFAOYSA-N	432.271	1.921	50	20	IDGD	
Cc1cc(S(C)(=O)=O)cc(C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)c1C	758945465	HQCZMHZIPXCBCV-UHFFFAOYSA-N	429.454	1.197	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)c1ccc(Br)cc1-n1cncn1	758961027	QLLCVOWUORGHGX-UHFFFAOYSA-N	449.290	1.282	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cnc([C@H]4CCCO4)s3)CC2)cc1	760403307	HXBCHFSNKAQUJG-GOSISDBHSA-N	443.573	1.882	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)[C@@H]1CCCN1C(=O)OCc1ccccc1	763100483	IXVAJGBURJKEKY-QFBILLFUSA-N	425.441	1.775	50	20	IDGD	
O=C(NNC(=O)c1ccccc1Br)C(=O)Nc1c[nH]nc1-c1ccccn1	763482858	LXIINWYCSCOIEJ-UHFFFAOYSA-N	429.234	1.634	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)C3CC3)cc2C(F)(F)F)C[C@H](C)O1	763562904	NNOZWZYMIUOVPZ-QWRGUYRKSA-N	428.411	1.815	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc2c(c1)OC1(CCCC1)O2	763656909	JONLYCIKAKYWDY-UHFFFAOYSA-N	441.440	1.902	50	20	IDGD	
COCCOc1ccc(C#N)cc1NC(=O)C(=O)NNC(=O)COc1cc(C)ccc1C	763667529	ARYPGAKGFBXPRX-UHFFFAOYSA-N	440.456	1.365	50	20	IDGD	
Cc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NNC(=O)COc1ccc(Cl)cc1	763695976	ZNALVFATMHNOIX-UHFFFAOYSA-N	432.864	1.515	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccc(CN2CCCC2=O)c1	763717243	SOKYYJYJVKPAIE-UHFFFAOYSA-N	438.484	1.536	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)c(F)cc1F	763838189	POAZDRONSZCLMI-UHFFFAOYSA-N	425.319	1.055	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccc(N2CCCC2=O)cc1	763865923	SXMIDMDZJNSNHE-CYBMUJFWSA-N	428.420	1.506	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccc(Cl)cc2OCC(F)(F)F)n1	763892669	HFYFEENQXUWLCG-UHFFFAOYSA-N	447.801	1.881	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(CNC(C)=O)cc2)cc1OC	763911909	QULKJSBVMYVDTF-UHFFFAOYSA-N	442.472	1.520	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)Cc3ccc(Cl)cc3)cn2)C[C@H](C)O1	763936085	CMINCGAHCGOHQK-KBPBESRZSA-N	445.907	1.677	50	20	IDGD	
C[C@@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(NC(=O)C(=O)NNC(=O)c3ccc[nH]3)cc2)C1	763980816	NGMLRLHNYARPPA-ZIAGYGMSSA-N	447.517	1.081	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(S(=O)(=O)NC(C)(C)C)c2)c(O)c1	764108507	IZOPQIKTKRSHJP-UHFFFAOYSA-N	448.501	1.177	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccccc2Oc2ncccc2C#N)c1O	764130641	ATXWIJYEAFVZRZ-UHFFFAOYSA-N	447.407	1.859	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(-c3nnc4n3CCCCC4)c2)cc1	764176262	DUYSUIMWWYFXJB-UHFFFAOYSA-N	443.467	1.943	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)c(OC)c1OC	764241882	NIWSMWYOQHHARO-UHFFFAOYSA-N	426.429	1.453	50	20	IDGD	
C[C@H]1CN(Cc2ccccc2NC(=O)C(=O)NNC(=O)Cc2ccccn2)C[C@@H](C)O1	764267316	SNFQRRPRNUGPHL-IYBDPMFKSA-N	425.489	1.019	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(F)c2I)o1	764371184	IQQSSFVKGZIEMG-UHFFFAOYSA-N	431.161	1.731	50	20	IDGD	
CC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)c1C	764377798	QFEMFZKUIUZRKQ-UHFFFAOYSA-N	426.458	1.805	50	20	IDGD	
COC(=O)[C@H](C)Cc1ccc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)cc1	764380325	VYVZWOHXDCVDJY-CYBMUJFWSA-N	449.410	1.796	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2cccs2)[nH]n1)C(=O)Nc1ccn(-c2ncccc2F)n1	764385124	SCEJXCQPPNBGKU-UHFFFAOYSA-N	440.420	1.258	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cc(C)[nH]n2)cc1S(=O)(=O)N1C[C@@H](C)C[C@H](C)C1	765588352	XLMYRLPGCNUJJB-STQMWFEESA-N	449.533	1.468	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cccc(C)c3[N+](=O)[O-])CC2)cc1	765749828	UKIDSNVCTPKZQA-UHFFFAOYSA-N	425.489	1.790	50	20	IDGD	
O=C(CCCn1cnc2ccccc21)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	766635533	AKWGZCGJRNBOPJ-UHFFFAOYSA-N	448.527	1.422	50	20	IDGD	
O=C(Cc1ccn(-c2ccccc2)n1)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	766645023	YLLLUHDTDYMWOG-UHFFFAOYSA-N	446.511	1.020	50	20	IDGD	
COC(=O)N(C)CCCC(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	766661751	YSYQLGUGHOUEOD-UHFFFAOYSA-N	439.944	1.083	50	20	IDGD	
CSCCNC(=S)NNC(=O)c1ccc(S(=O)(=O)N2CCCC[C@@H]2C)cc1	769767571	QVRVKZGOOHOFQF-ZDUSSCGKSA-N	430.621	1.722	50	20	IDGD	
Cn1nc(SCC(=O)NN=Cc2ccc(Cl)cc2Br)c(=O)n(C)c1=O	769797629	WOHZXYHTSDSAEW-UHFFFAOYSA-N	446.714	1.137	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N[C@@H](C)[C@@H]1CN(C)CCO1	769967573	PIDLZSOPLLKPSN-HUBLWGQQSA-N	429.315	1.266	50	20	IDGD	
Cc1cc2c(N3CCC[C@@H]3C(=O)NNC(=O)CNC(=O)c3cccs3)ncnc2s1	770529944	IHOONENHZJTFCA-CYBMUJFWSA-N	444.542	1.607	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)NCc2ccc(Cl)cc2I)cn1	770609881	ASJXJWVLIHTLRP-UHFFFAOYSA-N	433.637	1.822	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)[C@@H]3CCCN3C(=O)c3ccccc3OC(F)F)nc21	770979458	FCVJKPOKQCTDTG-LBPRGKRZSA-N	447.402	1.418	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)ncc1Br	773522394	ARULQIBCPABHOL-UHFFFAOYSA-N	432.234	1.189	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc2c(c1)CCN2C(=O)C(=O)NNc1ccc2ccccc2n1	773661790	MLYXNVOFIWUEBV-UHFFFAOYSA-N	439.497	1.518	50	20	IDGD	
CN(c1ccccc1NC(=O)C(=O)NNc1ccc(C(F)(F)F)cn1)S(C)(=O)=O	773669003	DUPAWCXOOJZBFY-UHFFFAOYSA-N	431.396	1.578	50	20	IDGD	
CC(C)[C@]1(C)C[C@@H]1C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	773771260	REBBWLMQNUOJKW-NQIIRXRSSA-N	437.562	1.470	50	20	IDGD	
CS(=O)(=O)Cc1ccc(Cl)cc1S(=O)(=O)NNC(=O)COCc1ccccc1	774621120	RSILRKNJYIDOBU-UHFFFAOYSA-N	446.934	1.411	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NC[C@H]1CCCCN1S(=O)(=O)CBr	774879289	ZEVUPEYVWNUSPZ-GFCCVEGCSA-N	442.376	1.554	50	20	IDGD	
Cc1ccc(S(=O)(=O)C[C@H](C)NC(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)cc1	776191152	ACIZNAVLAOLCQS-LBPRGKRZSA-N	436.446	1.415	50	20	IDGD	
COc1cccc([C@H]2[C@@H](C(=O)NNC(=O)COc3ccccc3O)CC(=O)N2C2CC2)c1	776475913	OEZLDXABQNEEAM-JTSKRJEESA-N	439.468	1.679	50	20	IDGD	
CSCC[C@H](C(=O)NNc1cccc(S(C)(=O)=O)c1)N1C(=O)c2ccccc2C1=O	776541218	LELUFIMUPJOKGQ-QGZVFWFLSA-N	447.538	1.951	50	20	IDGD	
O=C(NN=Cc1cccc(Br)c1OC(F)F)N[C@@H]1CCS(=O)(=O)C1	776766766	ULHCXPMJSPTPFM-SECBINFHSA-N	426.239	1.871	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)c2ccc(S(=O)(=O)CCCC#N)cc2)nc1C	778425716	VYNREVYKRQGBTD-UHFFFAOYSA-N	431.474	1.796	50	20	IDGD	
Cc1cc(F)c2nc(O)cc(C(=O)NNC(=O)c3csc(N4CCOCC4)n3)c2c1	778532375	NDAOEIZMKADSBL-UHFFFAOYSA-N	431.449	1.756	50	20	IDGD	
CC(C)NC(=O)C(=O)NNC(=O)CC1(CNC(=O)OCc2ccccc2)CCCCC1	780227821	UFONPGRSMLQQCZ-UHFFFAOYSA-N	432.521	1.925	50	20	IDGD	
O=C(NCc1ccc(S(=O)(=O)NC[C@@H]2CCCO2)cc1)NNc1ncncc1Cl	780965184	XFPMHPNRUFPHQL-ZDUSSCGKSA-N	440.913	1.414	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)NCc1cccc(S(=O)(=O)N(C)C)c1	782765396	ZCPNTBCPTCLHCH-UHFFFAOYSA-N	434.518	1.409	50	20	IDGD	
O=C(Cn1nnc(-c2ccccc2)n1)NN=Cc1cn(-c2ccc(F)c(Cl)c2)nn1	782899473	MLEGKZGLMNYSLL-UHFFFAOYSA-N	425.815	1.864	50	20	IDGD	
N#C[C@@H](c1ccccc1)c1ccc(NC(=O)C(=O)NNC(=O)C(=O)NC2CC2)cc1Cl	782966626	PEAORCICHIBRRB-INIZCTEOSA-N	439.859	1.360	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2ccc(S(=O)(=O)N3CCCCC3)cc2)nc(C)n1	783324103	DIKSPVVOJWQCSI-UHFFFAOYSA-N	432.506	1.350	50	20	IDGD	
O=C(NNc1cc(F)c(F)cc1F)C(=O)Nc1ccc(CC(=O)N2CCOCC2)cc1	784893637	YJIYBLKJHOZPFS-UHFFFAOYSA-N	436.390	1.587	50	20	IDGD	
O=C(NNc1ncc(F)cn1)C(=O)Nc1ccc(N2CCOCC2)cc1C(F)(F)F	784949199	GRZJIJZAPKCCEL-UHFFFAOYSA-N	428.346	1.553	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)Nc1cc2c(cc1Cl)OCCO2	785023071	LKXZUIAJSXOMCV-UHFFFAOYSA-N	436.764	1.125	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)C(=O)Nc1ccc(OC[C@H]2CCCO2)cc1	785068168	VMHGJQYWSRLKKJ-GOSISDBHSA-N	437.456	1.221	50	20	IDGD	
Cn1ccnc(NNC(=O)C(=O)Nc2cc(Br)ccc2N2CCCC2)c1=O	785086239	LJDAGWATFDFZPS-UHFFFAOYSA-N	435.282	1.225	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2ccc(CNS(C)(=O)=O)cc2)cc1Cl	785116055	CNGFDIYITWNNES-UHFFFAOYSA-N	426.882	1.480	50	20	IDGD	
COC[C@@H](C)Oc1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)c1scnc1C	787889037	HQCLZFZBXDWNGD-SECBINFHSA-N	426.882	1.918	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2ccc(CN3CCCC3)cc2)ccc1Cl	789374968	QDPWVKSCFJSKAO-UHFFFAOYSA-N	436.921	1.658	50	20	IDGD	
Cn1nc(-c2ccc(F)cc2F)cc1NC(=O)C(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	789729836	JRSWDRCGURHVPR-UHFFFAOYSA-N	444.354	1.673	50	20	IDGD	
O=C(NNC(=O)c1c[nH]nc1-c1ccoc1)c1ccc(S(=O)(=O)N2CCCC2)cc1	789869005	PUPJXMLALYPTFO-UHFFFAOYSA-N	429.458	1.529	50	20	IDGD	
COc1cc(NNC(=O)[C@@H](C)NS(=O)(=O)c2ccc(C(N)=O)cc2)ccc1Cl	790179845	HEFQAAZXCKWANJ-SNVBAGLBSA-N	426.882	1.258	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)N[C@@H](C)c2nnnn2C2CC2)c2ccccc2c1=O	790711481	SEMOHBXXTUAWFH-LBPRGKRZSA-N	439.480	1.223	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)NC[C@H]1CCN(Cc2ccccc2)C1	792229782	JVOXHOVRDXHQNN-QGZVFWFLSA-N	427.461	1.826	50	20	IDGD	
CCc1c(NC(=O)C(=O)NNC(=O)c2cncc(NC(C)=O)c2)cnn1C(CC)CC	792266093	NDQHIKGMNIMUNF-UHFFFAOYSA-N	429.481	1.560	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cncc(NC(C)=O)c2)c(F)cc1C	793030986	KHEUNJQXGGXHFK-UHFFFAOYSA-N	445.407	1.064	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNC(=O)COc1ccccc1Br	794064020	SXGCPHQHEMOZQU-UHFFFAOYSA-N	436.262	1.902	50	20	IDGD	
CCCCOc1ccc(C(=O)NCC(=O)NNc2ccccc2S(=O)(=O)N(C)C)cc1	795168870	VVDHDSYOANVZSJ-UHFFFAOYSA-N	448.545	1.989	50	20	IDGD	
CCOC(=O)c1cc(S(=O)(=O)NNC(=O)c2cccc(OC)c2O)c(F)cc1C	795302868	BDRWMRZKCNXHRM-UHFFFAOYSA-N	426.422	1.648	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)[C@@H]1[C@H]2CN(C(=O)OC(C)(C)C)C[C@H]21	796082549	RPHVHWUKYDOPEM-MNZLEMJZSA-N	431.489	1.341	50	20	IDGD	
COC(=O)[C@]1(C(F)(F)F)CCN(CC(=O)NNC(=O)c2cc(Cl)ccc2OC)C1	796301769	WTLAWLCMDZVSJY-INIZCTEOSA-N	437.802	1.537	50	20	IDGD	
CCNC(=O)N(C)c1cccc(NC(=O)C(=O)NNC(=O)COc2ccc(OC)cc2)c1	796992698	WDKCSKRXTROOHF-UHFFFAOYSA-N	443.460	1.026	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NC(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)nc1	797653291	PCNCIUPQUAYILX-UHFFFAOYSA-N	435.491	1.250	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)CCc2nc(-c3ncccn3)no2)c(OC)cc1Cl	802082347	FDWSNKYOFMKDQU-UHFFFAOYSA-N	447.839	1.983	50	20	IDGD	
N#Cc1ccc(Cl)c(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)c1	802762845	NMZOCBUAEWTVES-UHFFFAOYSA-N	425.876	1.431	50	20	IDGD	
O=C1N[C@H](C(=O)NNc2ccc3c(=O)[nH]ccc3c2)CS[C@H]1Cc1ccccc1F	803428137	SGCCXYJHCUVTRR-ROUUACIJSA-N	426.473	1.953	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)[C@@H]1CCN(c2ccc(C#N)cc2F)C1	804381041	GOVOTYBZAUBAJS-CQSZACIVSA-N	434.472	1.379	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)NCC2(S(C)(=O)=O)CCCC2)cc1OC	805839861	IWOHGEWZNQBDAO-UHFFFAOYSA-N	427.523	1.785	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)Nc2ccc(F)c(S(=O)(=O)N(C)C)c2)cc1C	806543891	MDZKYMDMRUXICH-UHFFFAOYSA-N	438.481	1.925	50	20	IDGD	
O=C(NCCNS(=O)(=O)c1ccc(Cl)s1)NNc1ccc2c(=O)[nH]ccc2c1	807013023	CMPJEJYJGRKIBE-UHFFFAOYSA-N	441.922	1.848	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN(C)CCn1cc(Br)cn1	808802446	WXESISJLAPPANF-UHFFFAOYSA-N	444.717	1.701	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N=c2cc(C)[nH]c3ccccc23)cc1	809885846	PKDOQDWSGOELQX-UHFFFAOYSA-N	441.513	1.747	50	20	IDGD	
O=C(CC12C[C@H]3C[C@@H](CC(O)(C3)C1)C2)NNc1ccccc1S(=O)(=O)N1CCOCC1	813467743	LMICNNCEMRGJEL-WZGNDQMWSA-N	449.573	1.872	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ccnc(N(C)C)n2)cc1S(=O)(=O)C1CCCC1	815604850	CDLDCXIOUOHQJR-UHFFFAOYSA-N	446.533	1.649	50	20	IDGD	
O=C(COC(=O)c1ccc(NC(=O)C2CC2)cc1)NNC(=O)[C@@H]1COc2ccccc2O1	819497113	PSOWZGAITXQYGP-SFHVURJKSA-N	439.424	1.179	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)[C@H](CC(C)C)N1C(=O)[C@H]2CC=CC[C@@H]2C1=O	825630852	QWRBERZQOQSYBT-BQFCYCMXSA-N	442.516	1.620	50	20	IDGD	
O=C(c1nnn(-c2cccc(Br)c2)c1C(F)(F)F)N1CC[C@@H](B(O)O)C1	864234800	WHHHCCGWRXJCBX-MRVPVSSYSA-N	432.993	1.738	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)C[C@@H]2OC(=O)c3ccccc32)c1	912643079	QMPLEEZJQPYLKF-SFHVURJKSA-N	445.497	1.780	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(N2C[C@H](C(=O)NNc3ncccn3)CC2=O)cc1	913044411	WVOQZXRKIRBMMO-CQSZACIVSA-N	432.506	1.003	50	20	IDGD	
N#Cc1cccc(S(=O)(=O)NCC(=O)NNC(=O)c2ccc(Br)s2)c1	913161234	WUJQVNMYSQVOKS-UHFFFAOYSA-N	443.304	1.122	50	20	IDGD	
COC(=O)NNC(=O)[C@@H](CCSC)NS(=O)(=O)c1ccc(Br)cc1	913176969	USCCDDWNYGZEPS-LLVKDONJSA-N	440.341	1.236	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CNS(=O)(=O)c2ccc3ccccc3c2)cc1OC	913415640	BTWMJRBKWJUWEA-UHFFFAOYSA-N	443.481	1.597	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)C2CCN(c3cnccn3)CC2)c2ccccc2c1=O	914265334	HCACJSRDUZCERV-UHFFFAOYSA-N	435.488	1.274	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)[C@@H]2CC(=O)N(C(C)(C)C)C2)c2ccccc2c1=O	914750129	WJNVJWFQSUGMNP-OAHLLOKOSA-N	441.532	1.995	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1cnn(Cc2ccccc2)c1C	915636503	NLPZBVUPQDUKTB-UHFFFAOYSA-N	440.529	1.916	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NC[C@H](c1cccs1)N1CCN(C)CC1	915902133	QDPQVNRVFYDFGZ-CRAIPNDOSA-N	449.552	1.974	50	20	IDGD	
CCO[C@H]1C[C@H]1C(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2OC)c1	916095371	GPGPYIYYUKPXGH-QAPCUYQASA-N	433.486	1.682	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NC[C@H](c2ccc(C)o2)N2CCOCC2)cc1	916229795	YZOWNSSZONDDKO-GOSISDBHSA-N	432.477	1.379	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)NCc2cccc(S(=O)(=O)NC(C)C)c2)c1	916486303	KLQQRTKHALRYKV-UHFFFAOYSA-N	448.545	1.900	50	20	IDGD	
COCCOc1ncccc1CNC(=O)NNc1ccc(S(=O)(=O)NC(C)C)cn1	916510792	SQJKOJCZRKFGCO-UHFFFAOYSA-N	438.510	1.015	50	20	IDGD	
O=C(NCCCn1nc2n(c1=O)CCCC2)NNC(=O)c1ccc(Cl)cc1Cl	916650267	YMBSZFVTBAIPGE-UHFFFAOYSA-N	427.292	1.722	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)c2ccc3c(c2)S(=O)(=O)N(CC)C3=O)cc1OC	917521134	RNVJLLBNAUMDOD-UHFFFAOYSA-N	447.469	1.333	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCc2ccccc2OC(C)C)cc1	918127272	CHDFUKDINDFSIF-UHFFFAOYSA-N	448.545	1.933	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2cccnc2)nc2ccccc12)N[C@@H]1CCS(=O)(=O)C1	919886609	VIDQUPCFZSVUMM-CQSZACIVSA-N	425.470	1.428	50	20	IDGD	
O=C(NCc1ccc(F)c(F)c1)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	920344581	VAYQCORIJLPILZ-UHFFFAOYSA-N	438.456	1.894	50	20	IDGD	
O=C(CN1CCCC1=O)NNC(=O)[C@@H]1CCCN1C(=O)c1ccc(Cl)c(Cl)c1	920435593	KKZLQQUXENQHHC-AWEZNQCLSA-N	427.288	1.368	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1OC	920929733	LZFCKNCEGXNLFU-UHFFFAOYSA-N	437.434	1.832	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2cccc(S(=O)(=O)/N=C3/CCCN3C)c2)cc1	1254715489	XKABIHHAFFGEFV-MOHJPFBDSA-N	445.501	1.975	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)N[C@H]2CCO[C@]3(CCS(=O)(=O)C3)C2)c2ccccc2n1	1319831597	JSFQWAIWDCWEJM-VBKZILBWSA-N	432.502	1.224	50	20	IDGD	
CCOC(=O)c1cnc(C)c(C(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)c1	1320052633	PMHKLTPEJQPHNC-UHFFFAOYSA-N	434.493	1.975	50	20	IDGD	
O=C(NNC(=O)c1ccc(Br)cc1)Nc1ccccc1CN1C(=O)CNC1=O	1320410731	GFHSBSRAAIUPKF-UHFFFAOYSA-N	446.261	1.967	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(O)no2)C1	1779807280	PRLCMLOLRXFJFF-XTQGRXLLSA-N	430.299	1.681	50	20	IDGD	
N=C(N)SCCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Br)C1	1780771728	PLRMZCDQICEZIS-IFUGULHKSA-N	439.351	1.208	50	20	IDGD	
COc1cc(CCC(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)ccn1	1781326758	SVAOJJYGLOGJNF-SJLPKXTDSA-N	444.301	1.543	50	20	IDGD	
CCc1[nH]nc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](F)Br)C3)C2)c1Cl	1781330864	IHBXHHFKOLOSCL-SWLSCSKDSA-N	437.697	1.760	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)o1	1781330999	CJWWOEDPMAKBKX-CJNGLKHVSA-N	432.246	1.372	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)n1ccnn1)C2	1782002868	YMPPZYYAJRJBPQ-ZOMKSWQUSA-N	428.331	1.136	50	20	IDGD	
CCc1noc(C)c1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](Cl)COC)C1	1782173434	AIDPDXNFZYPSKL-YYFZDKIDSA-N	427.929	1.927	50	20	IDGD	
Cn1nc2c(c1C(=O)N1CC[C@@]3(C1)CN(C(=O)[C@@H](F)Br)CCO3)CCC2	1782439779	MCFYGRUJJXYOLY-RHSMWYFYSA-N	429.290	1.043	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cnccc3N(C)C)CCO2)C1	1783343459	JGICSASMBLHOJT-HNAYVOBHSA-N	439.354	1.765	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3n[nH]c4c3CCCC4)CCO2)C1	1783347783	OSXDGQKVJKMAJH-KUHUBIRLSA-N	439.354	1.906	50	20	IDGD	
CCOc1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](Br)CC)C3)C2)nn1	1783353700	ZGAKVGHGUZYFAD-ACJLOTCBSA-N	441.326	1.492	50	20	IDGD	
COc1ccccc1OCC(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](C)Br)C2)C1	1783527534	CPOUPMMENMCLDP-KUHUBIRLSA-N	441.322	1.687	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc4cccnc4n3)CCO2)C1	1783534282	SBTJTALFEHZFCP-YJYMSZOUSA-N	433.306	1.857	50	20	IDGD	
CC(C)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN3C(=O)CSC3=S)C[C@@H]21	1783855287	MLCMQTRPDKSVKN-AVGNSLFASA-N	448.010	1.091	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)C1(c3ccccc3)CCC1)CCO2	1783937766	OIAQPYGRSCBABZ-QHCPKHFHSA-N	442.560	1.311	50	20	IDGD	
C[C@@H](Cc1ccc(F)cc1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]2C1	1784094805	SHYAMDMJHLKGJK-WPHMXFNYSA-N	426.916	1.584	50	20	IDGD	
CC(C)N1CCC(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CO[Si](C)(C)C)C[C@@H]32)CC1	1784994337	QVFHWLCFKWYIHA-UFYCRDLUSA-N	439.673	1.938	50	20	IDGD	
COc1nccnc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]21	1785648456	MUBSRXOZIXALJC-PAKFGRKTSA-N	431.320	1.315	50	20	IDGD	
CCOC(CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCBr)[C@H]2C1)OCC	1786407878	YUWBWQZEUXIZNF-KKUMJFAQSA-N	435.359	1.540	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3n[nH]c4c3CC[C@@H]4C)[C@H]2C1	1787953311	PDPFCHZKWQQROF-YLXLXVFQSA-N	439.354	1.836	50	20	IDGD	
Nc1nc(C(=O)NC2(c3ccc(NC(=O)c4ccc(B(O)O)cc4)cc3)CCC2)cs1	1788140733	PLJXANGKSJVYHJ-UHFFFAOYSA-N	436.302	1.467	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(C4CC4)on3)C[C@@H]21)[C@@H](F)Br	1789921584	QSAHGWFHTJOTJF-LWWSYDQCSA-N	430.274	1.836	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc4c3NC(=O)C4)[C@H]2C1	1790448535	DPZOTYKHBVYSQM-HJWJTTGWSA-N	435.908	1.028	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)Oc3ccccn3)C[C@@H]21	1791256586	QYMBUUOZAJFHDE-HMDCTGQHSA-N	425.913	1.082	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3CC[C@H](O)CC3)[C@H]2C1	1791406026	PZSWYQXHNKGDHX-UYLCUJDWSA-N	431.371	1.691	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CC[C@@H]3CCOC3)[C@H]2C1	1791812586	ZVKJEKBWHRDKGI-NRKLIOEPSA-N	431.371	1.814	50	20	IDGD	
CC(C)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(=O)nc3sccn13)C2	1792783915	GVXFBSJICKNYLO-JJLQDPRZSA-N	438.937	1.224	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccnc3ncccc13)C2	1792873937	HBKIRZGJSIZHDO-VWPFQQQWSA-N	447.333	1.864	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CCCN(Cc3ccccc3)C1)C2)[C@@H](O)CCl	1792975414	QVHWPDCFVXOWQG-CRSSMBPESA-N	449.979	1.088	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCl)c1nn(-c2ccccc2)c2c1COC2	1793110340	LVPLCPIPNHYDRO-PSFFPDNBSA-N	444.919	1.754	50	20	IDGD	
C[C@@H](Cn1cccn1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)CBr)C2	1794203103	DDGKALGGZUESGI-GVRJEKJASA-N	427.343	1.140	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@H](O)CCl)C4)c[nH]2)cc1	1794289983	LGJXMKWBMZQPSD-PIKOESSRSA-N	431.920	1.793	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc2[nH]ncc12	1796155632	VODYMPBIXIBXNO-JRATXPSKSA-N	435.322	1.797	50	20	IDGD	
CCOC(=O)[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](F)Cl	1796811513	RTZMEVUVBJVNBJ-ITGHMWBKSA-N	449.907	1.615	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1cc2ccccn2n1	1796834470	FQNCAKMVFRTVMD-BAESOJJISA-N	425.258	1.228	50	20	IDGD	
CCc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)CBr)C3)nn1C	1798318270	UOFSSBDHJUIVCZ-JFILPPLUSA-N	427.343	1.217	50	20	IDGD	
C/C=C/C=C\C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O	1798523196	WAJLFEQDSMFDQR-PYTDSYFNSA-N	443.456	1.856	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc3c1NC(=O)C3=O)C2	1798627346	CVIVFWQIBUOZCM-BTTYYORXSA-N	429.549	1.925	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnc(O)[nH]1)C2	1799220743	XTVNJEYSZAXZKH-CLLJXQQHSA-N	443.416	1.514	50	20	IDGD	
COc1ccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Br)cc1O	1799343402	UZWXDRQJJFYBTA-LZDSYCOUSA-N	445.285	1.223	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCCc1ccncc1)C2)[C@H](F)Br	1799344233	CRWMPEWLFLJXHH-FSDCSDTHSA-N	428.302	1.684	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1noc3c1CCCC3)C2)[C@@H](F)Br	1799346129	CZZFLPWMRRKNLN-YJKIEOBBSA-N	430.274	1.447	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2nn[nH]c2c1	1800143777	BSEAIWRFSUUHQM-TYYYEBLRSA-N	426.304	1.397	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1n[nH]c3ccccc13)C2	1800642114	XMARKVRHPDUOSM-FAXLKDOZSA-N	435.322	1.940	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cccc([N+](=O)[O-])c1)C2	1800754205	JCNKIQXMVCPEQY-DPYKFYPSSA-N	440.294	1.510	50	20	IDGD	
CCc1nn(C)c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)Br)c1Cl	1800758311	SOZKOXRDRLLKBX-DYNIEEOBSA-N	447.761	1.623	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)CN2C(=O)C=CC2=O)[C@@H]1c1cccnc1	1803694725	LVFGZBNPBZAQGM-GQIGUUNPSA-N	432.908	1.420	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC2(CCN(C(=O)CNC(=O)N(C)C)CC2)C1	1805382396	FKVKLCXERQIIOW-CQSZACIVSA-N	431.375	1.520	50	20	IDGD	
Cc1ccncc1C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1807375565	QBEJIUFSDXWYNH-DENIHFKCSA-N	444.300	1.098	50	20	IDGD	
Cc1nn[nH]c1C(=O)NC[C@@H]1CCN(C(=O)[C@H](C)CBr)[C@@H]1c1cccnc1	1807797532	LSCFWGLNDWTIHH-DIOULYMOSA-N	435.326	1.859	50	20	IDGD	
Cn1cc(C(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)c(C(F)F)n1	1808841007	CJYCIQTYOYAANO-JGGQBBKZSA-N	441.866	1.672	50	20	IDGD	
O=C(c1cnc(C(F)(F)F)cn1)N1CCCC2(CCN(C(=O)[C@H](O)CCl)CC2)C1	1810424130	MUZAWPVQSRRIHI-CYBMUJFWSA-N	434.846	1.940	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)CCn2ccnn2)[C@@H]1c1cccnc1	1812779357	SWQNXWHTSKTSJW-SOLBZPMBSA-N	449.353	1.943	50	20	IDGD	
Cc1onc(C(=O)N2CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)c1C	1813067801	DSHQQDJASNVPNM-DYESRHJHSA-N	442.520	1.379	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)c[nH]1	1813070861	NFLXACROGIOBFX-DYESRHJHSA-N	426.521	1.411	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)[C@@H]1CCc2nc[nH]c2C1	1813322589	JJUUUSOIBAVHON-MWLKLMTCSA-N	431.924	1.215	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](O)c3ccccc3)sc2C1	1814378098	JXZBYCBZGRJRRV-LIRRHRJNSA-N	445.545	1.162	50	20	IDGD	
C=CCNC(=O)/C=C\C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](F)Br)[nH]n1	1814438761	TWWGTXPQAKCWAN-VLZSXYJSSA-N	442.289	1.951	50	20	IDGD	
C=CCC(CC=C)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1	1815350019	DQICYUWWQKQLLX-QGZVFWFLSA-N	439.346	1.817	50	20	IDGD	
O=C(CCc1ccco1)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1815931670	DKBNWTMSZDZDIY-IBGZPJMESA-N	436.277	1.621	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3cc4n(n3)CCCO4)sc2C1	1819122067	GHSGQYJFKFSDIT-QWRGUYRKSA-N	439.925	1.602	50	20	IDGD	
Cc1nc[nH]c1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819403087	USRZDRDBAYSKCW-OAHLLOKOSA-N	437.464	1.059	50	20	IDGD	
C[C@@H](CS(C)(=O)=O)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CO[Si](C)(C)C)n[nH]1	1819591997	SRDQRWAANSHQPF-DZGCQCFKSA-N	444.630	1.934	50	20	IDGD	
Cc1nnc(CCC(=O)N2CCC([C@@H]3CCCCN3C(=O)[C@H](O)CCl)CC2)s1	1824180739	MQDFEDVEOFRYDZ-JKSUJKDBSA-N	428.986	1.999	50	20	IDGD	
O=C(c1nc(O)n2c1CCCC2)N1CCC([C@H]2CCCCN2C(=O)[C@@H](O)CCl)CC1	1824186972	WTBYXIJYFQRNEB-WBVHZDCISA-N	438.956	1.758	50	20	IDGD	
CSCC(C)(C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1	1824559818	AAQBLMMFMRMUGG-FQEVSTJZSA-N	446.422	1.989	50	20	IDGD	
C=CCC(F)(F)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCC(=O)NN(C)C)CC2	1825257957	YFDXSYPINCWIOA-LLVKDONJSA-N	429.493	1.640	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccnc1C(N)=O)CC2	1825993034	DKMLAACGOIBSKW-ONGXEEELSA-N	437.909	1.117	50	20	IDGD	
O=C([C@@H](F)Br)N1CCC([C@H]2CCCCN2C(=O)CN2CCOCC2)CC1	1826718652	INXJRTGPRBEWKA-NVXWUHKLSA-N	434.350	1.629	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccn3c(O)nnc23)CC1	1827538484	NYGXCKRMVSGENQ-IAGOWNOFSA-N	449.939	1.922	50	20	IDGD	
O=C([C@H](O)CCl)N1CCC([C@H]2CCCCN2C(=O)[C@H]2Cc3ccccc3CN2)CC1	1827614445	XXVSFINHSJJCOD-NJDAHSKKSA-N	433.980	1.920	50	20	IDGD	
CN1CCC(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)CC1	1829894612	QHJRLMJXFYKLER-OALUTQOASA-N	436.380	1.021	50	20	IDGD	
C[C@H](C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2)n1cccc1C=O	1830357858	MUAHINOLCAPUOR-IIBYNOLFSA-N	439.940	1.583	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCCn3cccc3)C2)C1	1830369878	CUYQMMOWZWACIF-NRFANRHFSA-N	425.957	1.990	50	20	IDGD	
Cc1cc(C)cc(CCC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)c1	1830738661	RRFJSBGACVOVPW-KNQAVFIVSA-N	438.952	1.292	50	20	IDGD	
COc1cccc(Cl)c1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1830738938	VXBCOKIMBYZOAH-AUUYWEPGSA-N	447.315	1.018	50	20	IDGD	
Cc1ccc(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)cc1F	1831308653	DXKWUWZUTNDCSZ-NQIIRXRSSA-N	442.915	1.123	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)Cn3ccnc3)C2)C1	1831660177	ZLDZYAUXKQUARA-ABSDTBQOSA-N	426.945	1.383	50	20	IDGD	
CC(C)N1CCC(C(=O)N2CCO[C@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)CC1	1832416368	ZYVSXAAUVIPIFI-LJQANCHMSA-N	436.380	1.367	50	20	IDGD	
O=C(COC1CCCCC1)NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1833217020	OXEOSLLGCUSJNI-IBGZPJMESA-N	429.989	1.507	50	20	IDGD	
C[C@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)c3ncnn3C)CC2)CC1	1833262614	YQVOHQKASARLJP-CYBMUJFWSA-N	441.374	1.031	50	20	IDGD	
Cc1nc(CC(=O)NC2CCN(C3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)cs1	1833817419	SQHCUCGXMTZYPA-KRWDZBQOSA-N	428.986	1.165	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](C)CBr)C3)C2)on1	1834218245	SMQNLBRXJIACEQ-PXAZEXFGSA-N	430.299	1.084	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)C[C@@H](NC)C(=O)O)CC2)CC1	1834740679	QFFANBLOXFZEHD-IAGOWNOFSA-N	430.977	1.028	50	20	IDGD	
CC(C)N[C@@H](C(=O)N1CCOC[C@]2(CN(C(=O)CCBr)CCO2)C1)C(C)C	1834822573	WEWKOWKKPLWKMX-MJGOQNOKSA-N	448.402	1.250	50	20	IDGD	
Cc1cccc(F)c1C(=O)N1CCOC[C@]2(CN(C(=O)CCBr)CCO2)C1	1834826856	YZSSWENCXSKODH-IBGZPJMESA-N	443.313	1.989	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](CC)NC(N)=O)CC2)CC1	1835054658	XDYWPBSWCDVXJX-DLBZAZTESA-N	429.993	1.412	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3sc(N)nc3C)CCO2)C1	1835801587	WNMLJASJGRHWPX-UGSOOPFHSA-N	430.958	1.511	50	20	IDGD	
COCc1c[nH]c(C(=O)N2CCC(OC3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)c1	1836718552	SGHDCGYULYESTK-SFHVURJKSA-N	427.929	1.373	50	20	IDGD	
C[C@@H](CC(N)=O)C(=O)N1CCC(OC2CCN(C(=O)CCBr)CC2)CC1	1836908270	WHGHJDMPNZDSQQ-ZDUSSCGKSA-N	432.359	1.282	50	20	IDGD	
O=C(c1ccc2cncn2c1)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1837125076	VPRVQQJLZVTYBF-SFHVURJKSA-N	427.288	1.208	50	20	IDGD	
Cc1nc2sccn2c1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1837143300	CBLVWUUYWAWPPG-CXAGYDPISA-N	430.889	1.309	50	20	IDGD	
O=C(CCBr)N1CCC(OC2CCN(C(=O)CN3CCOCC3)CC2)CC1	1837651717	GHLNOAHDDYNPPE-UHFFFAOYSA-N	446.386	1.102	50	20	IDGD	
O=C(CCBr)N1CCC(OC2CCN(C(=O)c3ccncn3)CC2)CC1	1837653781	YGKAVYDAMBCMRL-UHFFFAOYSA-N	425.327	1.874	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4cccn4cn3)C2)C1	1837713298	UROUJEDJZICAMM-NRFANRHFSA-N	446.580	1.256	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(C)cc(C#N)c3)CCO2)C1	1839454195	ZSGHNBBNUNMQBL-WIYYLYMNSA-N	435.908	1.191	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccc(F)cc3F)CCO2)C1	1839980118	ZIRQWDHILLOUSS-UZLBHIALSA-N	446.878	1.218	50	20	IDGD	
COc1ccc(COCC(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)cc1	1840253901	NWSLUNLFJGUYPT-UYAOXDASSA-N	444.887	1.203	50	20	IDGD	
O=C(Cc1cc(F)ccc1Br)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1	1841350319	VLRMKONGUVPJEV-AWEZNQCLSA-N	433.705	1.934	50	20	IDGD	
O=C(c1nc2ccc(C(F)(F)F)cn2n1)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1	1841350562	KFQAHWHXKXJVLL-NSHDSACASA-N	431.802	1.165	50	20	IDGD	
Cc1oc2cc(O)ccc2c1C(=O)N1CCCC12CN(C(=O)c1cnccc1C(=O)NN)C2	1843741558	CFUBJMKXNUKCIB-UHFFFAOYSA-N	449.467	1.576	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1cc(C(F)(F)F)c[nH]1)C2	1844264147	LCEQCPPFLACWAC-UHFFFAOYSA-N	436.394	1.163	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC2(CCCN2C(=O)C2(N3CCN(C)CC3)CC2)C1	1845103145	FLYIXPPLHYEXBK-OAHLLOKOSA-N	427.387	1.143	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)[C@H](C)c2ccc(O)cc2)C1	1845184061	DQMHXFOUUXPLCC-DAWOQIAZSA-N	437.500	1.833	50	20	IDGD	
Cn1ncc(C(=O)N2CC3(CCCN3C(=O)[C@H](F)Br)C2)c1C(F)(F)F	1845216247	FNIZSCLRXPSOLJ-JTQLQIEISA-N	427.196	1.946	50	20	IDGD	
O=C(c1ccc2nc(CO)[nH]c2c1)N1CC2(CCCN2C(=O)[C@@H](F)Br)C1	1845217786	VRKLWLPIFIIEBS-CQSZACIVSA-N	425.258	1.563	50	20	IDGD	
CC(C)(C)OC(=O)N1CC=C(C(=O)N2CCCC23CN(C(=O)[C@@H](O)CCl)C3)CC1	1846941976	JIUORGHGVYVLBP-HNNXBMFYSA-N	427.929	1.357	50	20	IDGD	
O=C1NC[C@@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](Br)Cc2ccccc2)O1	1847852017	ZBKFMRHHENUJDU-VGWMRTNUSA-N	436.306	1.303	50	20	IDGD	
Cn1ccc(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)n1	1848095861	VXDLLCVKFDLICP-KKUMJFAQSA-N	425.917	1.368	50	20	IDGD	
COc1ccc([C@@]2(C)NC(=O)N(CC(=O)NNC(=O)c3cc(Cl)ccc3O)C2=O)cc1	10600873	SICDJMKMPLZJTB-HXUWFJFHSA-N	446.847	1.282	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)c2ccc(S(=O)(=O)Nc3ccccc3)cc2)n1	12666717	ADVSMBGCNFFYMV-UHFFFAOYSA-N	427.486	1.762	50	20	IDGD	
COc1ccc(C)cc1CC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	14794613	ICCXKQCANNXZKW-UHFFFAOYSA-N	431.514	1.792	50	20	IDGD	
CON(C)S(=O)(=O)c1cc(C(=O)NNC(=O)COc2ccc(F)cc2)ccc1Cl	14894012	NIIYLKYRIJXMKV-UHFFFAOYSA-N	445.856	1.501	50	20	IDGD	
CC(=O)N1CCN(c2ccccc2CNC(=O)NNC(=O)COc2ccc(C)cc2)CC1	726273694	ICCNJXCLUQOSNO-UHFFFAOYSA-N	439.516	1.573	50	20	IDGD	
Cc1cc(C(=O)NC2CCN(CC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)CC2)c(C)o1	727437821	YIJNAOPUJKBSSQ-UHFFFAOYSA-N	443.460	1.460	50	20	IDGD	
COc1ccc(C)cc1CC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	728213037	BXLANHKCRUYUTQ-UHFFFAOYSA-N	432.546	1.626	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3ccc(Br)o3)cc2)CC1	728213495	MJOGQMSSHATBAI-UHFFFAOYSA-N	443.323	1.735	50	20	IDGD	
CCOC(=O)C1=NN(c2ccccc2)[C@@H](C(=O)NNC(=O)CNc2cccc(OC)c2)C1	728713545	WDZUNBFQMYFHHO-LJQANCHMSA-N	439.472	1.453	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)n1	728724222	GZXCCPAMRTXJRZ-UHFFFAOYSA-N	444.429	1.092	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)[C@H]2CCCN(S(=O)(=O)c3ccc(F)cc3)C2)c1	728828140	HOIUNQGUBKMICX-INIZCTEOSA-N	430.461	1.559	50	20	IDGD	
CC(=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O)c1cc(C)ccc1OC(F)F	730569042	KHTHUEJIRVHGSI-UHFFFAOYSA-N	427.433	1.021	50	20	IDGD	
O=C(CNC(=O)c1c(Cl)cccc1[N+](=O)[O-])NNC(=O)NCCc1cccs1	731059415	WHKINESFJFDCLJ-UHFFFAOYSA-N	425.854	1.613	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)NCc1cccc(C(=O)NC[C@@H]2CCCO2)c1	731403151	DGYMLCCPSAUZKM-SFHVURJKSA-N	428.464	1.808	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)c1cc(S(C)(=O)=O)ccc1Br	731493311	VSFGFSBOVCHLKW-UHFFFAOYSA-N	427.276	1.936	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)NCCS(=O)(=O)NCC2CCC2)c(C)n1-c1ccccc1	731760925	IHOYOJBNXLEBGN-UHFFFAOYSA-N	447.561	1.758	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N(C)[C@@H](C)[C@H](C)S(C)(=O)=O)cc1Br	733347703	HNQWYYAFZXWKJT-UWVGGRQHSA-N	436.328	1.566	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@H]2OCCc3ccccc32)c1	733651711	OHFRUUMKBJFQTE-GOSISDBHSA-N	432.502	1.195	50	20	IDGD	
CCOC(=O)c1cc(S(=O)(=O)NNC(=O)NC2CCCCC2)cc([N+](=O)[O-])c1C	734806849	LUIRNECMDBIOQJ-UHFFFAOYSA-N	428.467	1.905	50	20	IDGD	
Cc1ncc2c(n1)CCC[C@H]2NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	734950824	JGZAMGIAYBEABN-QGZVFWFLSA-N	432.506	1.057	50	20	IDGD	
C[C@@H](CN1CCOCC1)C(=O)NN=C1C(=O)Nc2c(Br)cc(Cl)cc21	735611868	FIWNIPHAZRNTLI-VIFPVBQESA-N	429.702	1.843	50	20	IDGD	
CC[C@H]1CCCCN1CCNC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1	737066256	ILXAWAVUTQAQSQ-KRWDZBQOSA-N	439.582	1.210	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)NC1CCN(CC(=O)Nc2ccccc2)CC1	738455468	VOTLCOUWUQGQBS-UHFFFAOYSA-N	439.516	1.637	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H]2CCN(CC3CC3)C2)c1	739035311	MKIXAOGXBCTBGX-QGZVFWFLSA-N	437.566	1.145	50	20	IDGD	
CC(=NNC(=O)c1cccc(N(C)C)c1)c1cccc(S(=O)(=O)N2CCOCC2)c1	739399322	CTMSTWGRICLKCI-UHFFFAOYSA-N	430.530	1.928	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)[C@H]1CCCN(C(=O)COc2ccccc2)C1	741207424	MPUXXPSNQQPYEV-INIZCTEOSA-N	429.448	1.670	50	20	IDGD	
CCS(=O)(=O)NCc1ccc(C(=O)NNC(=O)c2cccc(OC(F)F)c2)cc1	741681022	FSKDQBRWBRNHMQ-UHFFFAOYSA-N	427.429	1.802	50	20	IDGD	
CN(CC(=O)NNc1c(F)cc(F)cc1Br)S(=O)(=O)c1cccnc1	741980004	PPNNOUVCGCHHMB-UHFFFAOYSA-N	435.250	1.886	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNS(=O)(=O)c1cc([N+](=O)[O-])c(C)cc1F	742026119	YLPSXLVLGHIRHT-UHFFFAOYSA-N	427.410	1.830	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)[C@H]1CCCN(C(=O)c2ccncc2)C1	742061763	JPWBNSXHTWURFM-INIZCTEOSA-N	443.529	1.518	50	20	IDGD	
Cn1c(=O)nc(O)c2cc(C(=O)NNc3c(F)cc(F)cc3Br)cnc21	742108526	XBNCMAJWAZWHAF-UHFFFAOYSA-N	426.177	1.832	50	20	IDGD	
O=C(CCN1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O)NNc1ccc(C(F)(F)F)cc1[N+](=O)[O-]	743297598	TWYTULRWOGMVMU-GBOPCIDUSA-N	442.350	1.609	50	20	IDGD	
Cc1ccc(-n2c(N(C)C)nc(C=NNC(=O)Cc3cc(O)nc(O)n3)c2Cl)cc1	743445864	JTGULEMMPYWNNB-UHFFFAOYSA-N	429.868	1.794	50	20	IDGD	
O=C(NCCS(=O)(=O)NC[C@H]1CCCCO1)NNC(=O)c1cccc2ccccc12	743628888	XHEQQMOBBNWLEZ-MRXNPFEDSA-N	434.518	1.272	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)[C@H]2CC(=O)N(c3ccccc3Cl)C2)c1	744563361	BQJSYBHVCRALKF-HNNXBMFYSA-N	440.843	1.569	50	20	IDGD	
COc1cc([N+](=O)[O-])ccc1OC(=O)[C@@H]1CC(=O)N(c2cccc(S(N)(=O)=O)c2)C1	746194316	NNFQWWXJHLERBT-LLVKDONJSA-N	435.414	1.209	50	20	IDGD	
COc1cc(C)nc(NNC(=O)CN2C(=O)N[C@](C)(c3ccc4ccccc4c3)C2=O)n1	746694193	QDXMIHMEUUQJIO-JOCHJYFZSA-N	434.456	1.857	50	20	IDGD	
COc1ccccc1CC(=O)N1CCC(NC(=O)NNC(=O)Cc2ccncc2)CC1	747583727	GMRAXIVOLHUGFH-UHFFFAOYSA-N	425.489	1.197	50	20	IDGD	
O=C(CCN1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O)NNc1ccc(OCC(F)(F)F)cc1	748701708	WYSIIZPRCIJFJR-XOUADPBQSA-N	427.379	1.623	50	20	IDGD	
C[C@@H](Cc1ccncc1)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	749620524	NSPZKJVBXYLLEY-HNNXBMFYSA-N	431.518	1.441	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc(C)cc1	750578971	QVGQNGWAJHREJJ-KRWDZBQOSA-N	447.513	1.383	50	20	IDGD	
CCOC(=O)c1cnn(-c2ccc(C(=O)NNC(=O)CNC(=O)c3ccco3)cc2)c1C	751202787	WUYDWWABAISTBQ-UHFFFAOYSA-N	439.428	1.141	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)CNC(=O)c2ccco2)c2cnn(Cc3cccs3)c2n1	751203114	ZTLLAZBJFPRFJF-UHFFFAOYSA-N	438.469	1.634	50	20	IDGD	
C[C@H](NC(=S)NNC(=O)c1cccc(S(=O)(=O)N2C[C@@H](C)O[C@H](C)C2)c1)C1CC1	751619674	WIPLVGFMPGMFHB-MCIONIFRSA-N	440.591	1.392	50	20	IDGD	
C/C(=C/C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1)c1ccc([N+](=O)[O-])cc1	752351751	RGMSDWRPZWDTCH-ADYSOMBNSA-N	441.396	1.529	50	20	IDGD	
CCN1C(=O)[C@@H]2CN(C(=O)/C(C#N)=C\c3cc(C)n([C@@H](C)COC)c3C)CCN2C1=O	752507893	KFIFNTAISVMYBQ-QCTOKRQISA-N	427.505	1.714	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)c2cc(S(=O)(=O)NC3CC3)ccc2Br)o1	752522666	BISBQRHSSNSMEV-UHFFFAOYSA-N	442.291	1.866	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C2CCN(S(=O)(=O)c3ccc4c(c3)CCC4)CC2)o1	752527708	OICOUBVLGIBACS-UHFFFAOYSA-N	431.514	1.939	50	20	IDGD	
Cn1c(NNC(=O)CCNC(=O)c2ccc(Br)cc2)nc2ccccc2c1=O	752907446	KORBSZZCPPCBHD-UHFFFAOYSA-N	444.289	1.959	50	20	IDGD	
Cc1oc(S(=O)(=O)N(C)C)cc1C(=O)NNC(=O)Cc1nc(-c2ccccc2)cs1	753284118	BGPLBPXVEXDYKU-UHFFFAOYSA-N	448.526	1.966	50	20	IDGD	
CC(=O)c1cccc(S(=O)(=O)NCC(=O)NNC(=O)c2cc(C)nc3ccccc23)c1	754778643	ZETYBMGPKDAZNE-UHFFFAOYSA-N	440.481	1.485	50	20	IDGD	
COc1cccc(-c2noc(SCC(=O)NNC(=O)COc3ccccc3O)n2)c1	755292482	BVWHIDZPQTYKTO-UHFFFAOYSA-N	430.442	1.769	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)N[C@@H]1CCN(c2c(F)cccc2F)C1=O	756213786	YOZINRONELLDAF-OAHLLOKOSA-N	448.426	1.878	50	20	IDGD	
CCOC(=O)Cn1ccc2cc(NC(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)ccc21	756395927	LEYXAUDDYCRPEI-UHFFFAOYSA-N	448.443	1.647	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2ccc3c(c2)C(=O)CCC3)cc1	756878974	DXFJZBNZZVCBHV-UHFFFAOYSA-N	444.513	1.987	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)NCc2ccc3c(c2)CCS3(=O)=O)cc1OC	757751557	PQTYNIOQWNQEFP-UHFFFAOYSA-N	447.513	1.958	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)c2ccc(Cl)nc2)ccc1S(=O)(=O)N(C)C	757775908	MOFZMRNFSKGTSL-UHFFFAOYSA-N	427.870	1.460	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)COc2ccc(C#N)cc2)cc1S(=O)(=O)NC1CC1	757863465	CLTRDJPQPQGGQC-UHFFFAOYSA-N	443.485	1.539	50	20	IDGD	
O=C(NNc1nc(O)c2ccccc2n1)c1ccc(S(=O)(=O)NC[C@@H]2CCCO2)cc1	758298333	HRVDCLYPIKCMKM-AWEZNQCLSA-N	443.485	1.550	50	20	IDGD	
COc1ccc(C[C@@H](C)CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1	758651575	OVAXEOTWBPFUPZ-CQSZACIVSA-N	433.534	1.811	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N[C@H]2CN(C(=O)OC(C)(C)C)C[C@@H]2C#N)cc1OC	758753110	DHJAMTQBENIGEV-KBPBESRZSA-N	433.465	1.407	50	20	IDGD	
CCn1c(=O)n(CC)c2nc(NC(=O)CCC(=O)NNc3nc(C)cc(C)n3)ccc21	761140015	IFDYHRBAEAPMEG-UHFFFAOYSA-N	426.481	1.507	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)c1ccc(F)c(S(=O)(=O)N(C)C)c1	761619545	QJFPXJAPNYWYNI-UHFFFAOYSA-N	441.506	1.638	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1	762362335	XULUEDHCCNSBAR-UHFFFAOYSA-N	428.430	1.737	50	20	IDGD	
CCOC(=O)c1cnn2c(C(=O)NNC(=O)c3ccc(OC(C)C)c(OC)c3)ccnc12	763270876	XTOGXKNPQQGFGV-UHFFFAOYSA-N	441.444	1.777	50	20	IDGD	
CC(C)n1nnnc1-c1ccccc1NC(=O)C(=O)NNC(=O)c1ccc2ccccc2n1	763466257	JTCFZTJOJSOGLB-UHFFFAOYSA-N	444.455	1.869	50	20	IDGD	
CS(=O)(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c1	763470544	KBBYMOFSPDWWMB-UHFFFAOYSA-N	440.821	1.051	50	20	IDGD	
CS(=O)(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2ccccc2Br)c1	763482870	MIBFTJYJTOYLFW-UHFFFAOYSA-N	440.275	1.252	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)NCC1(N2CCCC2)CCOCC1	763511107	SQTLDLSRUYJTKX-UHFFFAOYSA-N	427.546	1.267	50	20	IDGD	
C[C@H]1C[C@H](C)CN(C(=O)c2ccccc2NC(=O)C(=O)NNC(=O)c2ccccc2O)C1	763526658	DXEBRZIVQDFTTH-GJZGRUSLSA-N	438.484	1.910	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)C(=O)Nc1cc(F)c(F)cc1F	763528775	AGKOFSBBZMTFGE-UHFFFAOYSA-N	449.433	1.402	50	20	IDGD	
Cc1cccc(NC(=O)C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c1C#N	763530864	JPYHGOOGRGKTQY-UHFFFAOYSA-N	434.500	1.165	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)cc1C(=O)NC(C)C	763559878	XSJRUVZTSZKETR-UHFFFAOYSA-N	426.429	1.262	50	20	IDGD	
Cc1ccc(C(=O)NC2CC2)cc1NC(=O)C(=O)NNC(=O)c1c(C)nc2ccccn12	763628213	HHDKHHGITHRNII-UHFFFAOYSA-N	434.456	1.243	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2ccc(F)c(C(=O)N(C)C)c2)c1	763666060	WBIQPMFZEXAJGD-UHFFFAOYSA-N	430.436	1.309	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)C(=O)Nc1cccc(Oc2cnccn2)c1	763683154	UUIWIYXDSVGXNQ-UHFFFAOYSA-N	425.376	1.573	50	20	IDGD	
NC(=O)C1CCN(c2ccccc2NC(=O)C(=O)NNC(=O)c2cccc(Cl)c2)CC1	763747681	FDRWNGGVAIOGIO-UHFFFAOYSA-N	443.891	1.441	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2ccc(C)c(C(=O)NC(C)C)c2)c1	763775846	VVGDBHVOHYGQSK-UHFFFAOYSA-N	442.472	1.550	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2cc(C)ccc2-n2cc(C)cn2)c1	763775929	ZCBQVUDEUWLBGY-UHFFFAOYSA-N	437.456	1.906	50	20	IDGD	
CC(C)Oc1c(F)cc(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)cc1F	763807714	QMZUXALHJDNTBM-UHFFFAOYSA-N	432.383	1.789	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)C(=O)Nc1cc(Br)ccc1F	763837480	GVIGYVIUCRYHRJ-UHFFFAOYSA-N	428.189	1.892	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1nc(-c2nccn2C)cs1	763864066	FNYPEXYZBUWCQF-JTQLQIEISA-N	432.437	1.236	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cnn(CC(C)C)c2C)cc1	763872955	PTWIIHLGOBSHOK-OAHLLOKOSA-N	429.477	1.604	50	20	IDGD	
NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)CCSc2ccc(F)cc2)cc1Cl	763901399	GGLLYJAEEGOTSX-UHFFFAOYSA-N	438.868	1.846	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccnn2Cc2cccc(Br)c2)n[nH]1	764100170	XCFKCTSMXORRGL-UHFFFAOYSA-N	446.265	1.125	50	20	IDGD	
CC[C@H](C)NS(=O)(=O)c1cccc(NC(=O)NNC(=O)COc2ccccc2O)c1	764255539	ZBTNHBUNPUFSBZ-ZDUSSCGKSA-N	436.490	1.701	50	20	IDGD	
CCOc1cc2c(cc1NC(=O)C(=O)NNC(=O)CCc1ccccc1O)O[C@@H](C)C2	764277671	GJDORBVXLDTEBA-ZDUSSCGKSA-N	427.457	1.833	50	20	IDGD	
CC(C)(C)c1nnc(NC(=O)C(=O)NNC(=O)c2cc(Br)ccc2O)s1	764280947	UWOJDEWYGCUONV-UHFFFAOYSA-N	442.295	1.703	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(C)c(C)c3)[nH]n2)cc1	764389098	WYAXIDKBVKNJME-UHFFFAOYSA-N	435.440	1.880	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)CSc1nnc(-c2cccnc2)n1Cc1ccco1	764605260	FSCDJAKDVLJMDK-UHFFFAOYSA-N	437.485	1.873	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1)c1ccc(S(=O)(=O)NC2CC2)cc1	765606540	BNGVQKLJHRMDDB-UHFFFAOYSA-N	443.460	1.731	50	20	IDGD	
O=C(CCNC(=O)c1ccc([N+](=O)[O-])cc1)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	765615245	CWRUWUOXGVVOLI-UHFFFAOYSA-N	440.391	1.705	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1cc(O)nc2ccccc12	766642889	OHJUXFHVLFFAGR-UHFFFAOYSA-N	433.468	1.159	50	20	IDGD	
O=C(COc1ccc(OCc2ccccc2)cc1)NNC(=O)NC[C@@H]1CCCS1(=O)=O	767172716	AECRQYWHESTDNB-IBGZPJMESA-N	447.513	1.552	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)C[C@@H]1CN(C(=O)OC(C)(C)C)CCO1	767488093	IPOURPQIWMHUPP-QGZVFWFLSA-N	449.504	1.254	50	20	IDGD	
CN(C)CCS(=O)(=O)c1ccccc1C(=O)NNC(=O)c1cc(-c2cccs2)[nH]n1	767887374	TUPQPNVFZUYCHQ-UHFFFAOYSA-N	447.542	1.548	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N2CCC3(CCN(C)C3=O)CC2)cc1Br	770514714	SOFOUQUCYYJPNP-UHFFFAOYSA-N	439.310	1.756	50	20	IDGD	
COc1ccccc1[C@]1(C)NC(=O)N(CC(=O)NNC(=O)Cn2ccc3ccccc32)C1=O	771260873	NUPISLFIWGCICF-QHCPKHFHSA-N	449.467	1.265	50	20	IDGD	
COc1ccccc1[C@@]1(C)NC(=O)N(CC(=O)NNC(=O)C(C)(C)c2ccccc2)C1=O	771268821	VZMMOKGZSQBDNO-HSZRJFAPSA-N	438.484	1.587	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)c1cccc(NS(=O)(=O)C(F)(F)F)c1	772266890	QOVJDGWIEOWZAT-SNVBAGLBSA-N	439.412	1.687	50	20	IDGD	
COc1cc(C)c(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)cc1C	773661135	JOGPVKNSWQAJMP-UHFFFAOYSA-N	432.502	1.835	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc2c(c1)CCN2C(=O)C(=O)NNc1cccc(C#N)c1	773680672	GCDUILXXZOEJFS-UHFFFAOYSA-N	441.513	1.621	50	20	IDGD	
CC(C)Cn1c(=O)nc(O)c2c(C(=O)NNc3cc(Cl)nc(N)n3)cc(C3CC3)nc21	773866289	SGXQYNFDKAWJPA-UHFFFAOYSA-N	444.883	1.813	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)oc(=O)n2C	774007911	CRBYDPRJLZXELO-JTQLQIEISA-N	432.820	1.338	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(N2CCOCC2)c(C(=O)NNc2cnccn2)c1	775278281	DQOUYIUTJFUGFO-UHFFFAOYSA-N	434.522	1.101	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1nnc(-c2c(F)cccc2Cl)s1	775903138	MNKSCMANHQRHGY-ZCFIWIBFSA-N	436.878	1.088	50	20	IDGD	
Cn1nc(SCC(=O)NN=C2C[C@H](OCc3ccccc3)C2(C)C)c(=O)n(C)c1=O	776763875	RCDRUQOWDCRJSP-HNNXBMFYSA-N	431.518	1.059	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)c2cc(Cl)c(-n3cnnn3)cc2OC)nc1C	778421205	HVCUDCOLWXFAGL-UHFFFAOYSA-N	432.828	1.356	50	20	IDGD	
COC[C@@H](C)n1ccc(NC(=O)C(=O)NNC(=O)COc2cc(C)ccc2C(C)C)n1	778706672	XVZUUCAUVJCEAP-OAHLLOKOSA-N	431.493	1.687	50	20	IDGD	
CNS(=O)(=O)c1cc(NC(=O)C(=O)NNc2ccccc2OC(F)(F)F)ccc1C	778797497	CZKBNIMMLPWJJN-UHFFFAOYSA-N	446.407	1.884	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)c1cc([N+](=O)[O-])ccc1OC(F)F	778959841	BBYMURGUYXFVKF-UHFFFAOYSA-N	442.762	1.927	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)C[C@@H](C)NS(=O)(=O)c2cccnc2Cl)c1	781035038	WWLGXVZDVVFCEL-LLVKDONJSA-N	426.882	1.722	50	20	IDGD	
CC(C)[C@H]1CN(CC(=O)NNC(=O)c2cccc(C#N)c2)CCN1C(=O)OC(C)(C)C	781989984	XALNWCHDFOPIID-GOSISDBHSA-N	429.521	1.897	50	20	IDGD	
Cc1ccc(F)cc1C(=O)C(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	782013356	HLYLEHYVNQZMSW-UHFFFAOYSA-N	446.910	1.935	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)cc1Cl	783264969	UYBZFYVLLDOYHD-UHFFFAOYSA-N	441.897	1.512	50	20	IDGD	
Cc1cc(C)cc(NNC(=O)C(=O)Nc2cc(S(=O)(=O)N(C)C)ccc2N(C)C)c1	783359363	NFYHRIPGPYFPIS-UHFFFAOYSA-N	433.534	1.702	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)Nc2ccccc2C)cc1NS(C)(=O)=O	783416287	PYCKAOSGWSRPKT-UHFFFAOYSA-N	435.462	1.167	50	20	IDGD	
COCCOc1ccc(Br)cc1NC(=O)C(=O)NNc1nccnc1Cl	784777794	LPXRRTKVWSWVQL-UHFFFAOYSA-N	444.673	2.000	50	20	IDGD	
CCN(CC)c1ccc(NC(=O)C(=O)NNc2c(OC)cccc2S(C)(=O)=O)cn1	785331283	RVLSDESIONAZAG-UHFFFAOYSA-N	435.506	1.422	50	20	IDGD	
CCS(=O)(=O)CCn1cc(C)c(NC(=O)NNC(=O)Cc2ccc(Cl)cc2)n1	786734830	JADANEMPRPBGJU-UHFFFAOYSA-N	427.914	1.675	50	20	IDGD	
Cc1cnc(Cl)c(NC(=O)C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)c1	787890224	XZMBLMVTNDIWIQ-UHFFFAOYSA-N	442.863	1.734	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2ccc(Cl)c(S(C)(=O)=O)c2)n1	788338954	WCANSRHGFGNZRD-UHFFFAOYSA-N	440.913	1.462	50	20	IDGD	
CCC[C@@H]1CCc2nc(NC(=O)C(=O)NNC(=O)COc3ccccc3O)sc2C1	789734580	KJRSCIBZAVUASF-GFCCVEGCSA-N	432.502	1.919	50	20	IDGD	
CN(NC(=O)[C@H]1CC(c2cccnc2)=NO1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	790886545	YYZBDWIVHTTZNP-MRXNPFEDSA-N	432.481	1.210	50	20	IDGD	
CCS(=O)(=O)c1ccc(CNC(=O)NNC(=O)[C@H]2COc3ccccc3O2)s1	792217094	CPHNZDAIRRHGIU-CQSZACIVSA-N	425.488	1.212	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NN=C2CCCc3c2cnn3-c2ncccn2)ccc1Cl	792927189	KESBEANWYHLCAL-UHFFFAOYSA-N	445.892	1.434	50	20	IDGD	
CC(C)NC(=O)NC1(C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)CCCCC1	794722284	UWBZCSLAMVXDIQ-UHFFFAOYSA-N	425.555	1.791	50	20	IDGD	
COCCS(=O)(=O)c1ccc(C(=O)NNc2ccccc2S(=O)(=O)N(C)C)cc1	795181045	GWIRDPSSGFNVDY-UHFFFAOYSA-N	441.531	1.114	50	20	IDGD	
C[C@@H]1[C@@H](CNC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)CCC[C@H]1C	797541827	AGWFLYMALCMOQC-IXDOHACOSA-N	438.598	1.716	50	20	IDGD	
COC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)CCc2ccc(OC)cc2)c1C	798042443	SBOBCPSSJLFPMM-UHFFFAOYSA-N	428.445	1.901	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc3c(=O)n4ccccc4nc3n2C)cc1C	798310271	PSAPZYOLGVAGJS-UHFFFAOYSA-N	432.440	1.203	50	20	IDGD	
N#Cc1cccc(-n2ccc(C(=O)OCC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)n2)c1	798799824	FGRAIFSWZTVDDC-UHFFFAOYSA-N	434.368	1.270	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)NCc1cccc(CS(N)(=O)=O)c1	799982840	NXJDRWPJRRGDKP-GFCCVEGCSA-N	440.909	1.426	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN(Cc2ccc(-n3cncn3)cc2)C2CC2)n1	801972364	MYAZBLUUZKECGV-UHFFFAOYSA-N	425.518	1.387	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(n2cc(C(=O)NNC(=O)N=c3cc[nH]cc3)nn2)CC1	802035700	HRIBRUOBKJPYIG-UHFFFAOYSA-N	430.469	1.134	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1nc(C2CCOCC2)cs1	806975276	SIZNIPGDEMLCNI-NSHDSACASA-N	436.465	1.730	50	20	IDGD	
O=C(Cc1ccccn1)NNC(=O)C(=O)Nc1cccc2cc(Br)cnc12	806979064	QRYRKJXQCSNKIW-UHFFFAOYSA-N	428.246	1.721	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)[C@@H](c2cnn(C)c2)N(C)C(=O)OC(C)(C)C)c1	807117015	RSRFRKCHRSSYSB-MRXNPFEDSA-N	445.480	1.143	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)C(=O)Nc1ccc([S@@](=O)C(F)(F)F)cc1	807429571	VHTZMYLPKIYQGM-SSEXGKCCSA-N	439.379	1.372	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)N2CCC[C@H](CNS(=O)(=O)C3CC3)C2)c1C	807900228	UTFYKIDKNRGZDP-BAOGCXAUSA-N	448.589	1.979	50	20	IDGD	
COCCOCc1ccc(C=NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1	807953240	QBVGLFPFEHHSIM-UHFFFAOYSA-N	425.894	1.914	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)C(=O)Nc2cccc3c2COC3=O)c1	808934971	ZWAZHFJHVHRNCN-UHFFFAOYSA-N	425.441	1.954	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2nnc3ccccc3n2)c1	809957642	RRYQALKYGWRRNM-UHFFFAOYSA-N	428.474	1.130	50	20	IDGD	
NS(=O)(=O)c1ccc(C=NNC(=O)Cc2nn3c(C4CCCCC4)nnc3s2)cc1	811633849	UXMACVFOGHNRDM-UHFFFAOYSA-N	447.546	1.574	50	20	IDGD	
O=C(NNC(=O)N1CCC[C@H](CNC(=O)C(F)(F)F)C1)c1cnn(-c2ccccc2)c1	811880426	MMTBCYQLXCCRNT-CYBMUJFWSA-N	438.410	1.617	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2cccc3c2OC(C)(C)C3)cc1	813033746	JNCXTQYRRLVFPK-UHFFFAOYSA-N	432.502	1.732	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1)NNc1ncncc1F	814294996	WPQUHSFYQNTQSZ-LJQANCHMSA-N	435.463	1.900	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)Nc1ccn(CCc2ccncc2)n1	814648493	VDUIWCLWRGKOKN-UHFFFAOYSA-N	429.506	1.920	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(OC(F)F)c(F)c2)c1	814722271	RTJAOJQPYBVMQE-UHFFFAOYSA-N	431.392	1.752	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NN=Cc1ccc(Cl)c(S(N)(=O)=O)c1	814750005	SXDHTMKZMZWTNX-UHFFFAOYSA-N	443.938	1.353	50	20	IDGD	
C[C@@](O)(C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1)c1ccc(Cl)cc1	815498643	KHOCTSSEPQGIOP-JXFKEZNVSA-N	434.832	1.078	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)CCc2ccccc2O)cc1)[C@H]1C[C@@H]1C	815569187	KAHKRTKZQFULTK-LIRRHRJNSA-N	438.484	1.872	50	20	IDGD	
CN(C)c1nccc(NNC(=O)C(=O)Nc2ccn(-c3ccc(Br)cc3)n2)n1	815605508	WYPCRHBFBBQVDB-UHFFFAOYSA-N	445.281	1.573	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)Cn2nnc3c2CCCC3)cc(OCC)c1OCC	816814380	PAVBVYNRYBRMKX-UHFFFAOYSA-N	431.493	1.814	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)Nc2nc(C)n(C)n2)cc1	817019077	QXTCDEYKQJUPQB-GDNBJRDFSA-N	434.460	1.417	50	20	IDGD	
CCCCn1c(=O)nc(O)c2c1nc(CCC(=O)NNc1ncncc1F)n2CC(C)C	817080206	IFSXTDMIFAWAGR-UHFFFAOYSA-N	446.487	1.760	50	20	IDGD	
O=C(Cn1cnc2ccccc21)NNC(=O)[C@H]1CC(=O)N(Cc2ccccc2Cl)C1	913495787	LBVYMCNNHDDMJD-HNNXBMFYSA-N	425.876	1.886	50	20	IDGD	
O=C(COC(=O)[C@@H]1CC(=O)N(c2ccc3c(c2)CCC3)C1)NNC(=O)c1cccs1	914634053	BIBFNLKKBPOXOQ-OAHLLOKOSA-N	427.482	1.594	50	20	IDGD	
O=C(CCn1ccccc1=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	915045621	CHAAHYXKNPPZAL-UHFFFAOYSA-N	443.467	1.401	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)CCc2c(C)nc3c(c(OC)nn3C)c2C)cc1	915064706	IJTNMPUMMYYFGH-UHFFFAOYSA-N	440.504	1.794	50	20	IDGD	
Cc1cc(C)c(N2C[C@@H](C(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)CC2=O)c(C)c1	915076965	XLUHUCLVQXOVNI-KRWDZBQOSA-N	443.525	1.829	50	20	IDGD	
COc1ccccc1NC(=S)NNC(=O)[C@H]1CS[C@H](Cc2ccccc2F)C(=O)N1	915599082	QKWDRPUPTJUXBX-NVXWUHKLSA-N	448.545	1.995	50	20	IDGD	
Cc1nnnn1[C@@H](Cc1ccc(F)cc1)C(=O)NNC(=O)[C@H](C)Oc1ccccc1F	915697800	YHBVUZTXOBYFKI-SJCJKPOMSA-N	430.415	1.658	50	20	IDGD	
CN(C)[C@@H](CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)c1ccco1	915896551	FMIXILVYCFNOBP-KRWDZBQOSA-N	449.533	1.311	50	20	IDGD	
CCCn1nc(C(=O)NNS(=O)(=O)c2ccccc2C(=O)OC)c2ccccc2c1=O	916102330	BOMFMAZRPOKQAX-UHFFFAOYSA-N	444.469	1.216	50	20	IDGD	
Cc1ccc([C@@H](CNC(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)N2CCOCC2)o1	916228446	BYCXQGZSRAYYCP-GOSISDBHSA-N	443.504	1.547	50	20	IDGD	
CC(C)Oc1ncccc1CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	916511968	LILHLBVTQLGNMW-UHFFFAOYSA-N	435.506	1.263	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)sc(C)c1C	916562062	JRPMXKYCYOGCRY-UHFFFAOYSA-N	437.449	1.846	50	20	IDGD	
COc1cc(CNC(=O)NNC(=O)c2cc(Br)c[nH]2)ccc1OCCO	918002771	VDTZGNQYBUVQNY-UHFFFAOYSA-N	427.255	1.301	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)NC1CCN(c2ccccc2)CC1	919783179	GJONRZCROHRYIV-UHFFFAOYSA-N	430.534	1.593	50	20	IDGD	
Cc1noc(CCC(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)n1	920434273	XYUYJHFFNAQHCC-UHFFFAOYSA-N	432.444	1.474	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N(C)Cc2nccn2C)cc1	920848993	KOCQNMGYTZJMDT-SFQUDFHCSA-N	447.499	1.733	50	20	IDGD	
Cc1csc2ncc(C(=O)NNC(=O)C3CCN(C(=O)OC(C)(C)C)CC3)c(=O)n12	1116478506	KZYCLWDGIVTZQW-UHFFFAOYSA-N	435.506	1.473	50	20	IDGD	
C[C@H](O)CNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cccc(OC(F)F)c2)cc1	1262596495	HYRFZRYGPXCVQN-NSHDSACASA-N	443.428	1.022	50	20	IDGD	
CC(=NNC(=O)C[n+]1ccccc1)c1ccc(S(=O)(=O)N2CCCC[C@H]2C(=O)O)cc1	1317705695	MJNJGKCVCXVZNT-IBGZPJMESA-O	445.521	1.142	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)C2CCN(c3cnccn3)CC2)CC1	1318996700	FKKFEBYJUGWLPU-UHFFFAOYSA-N	432.525	1.488	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)[C@H](c1cnn(C)c1)N(C)C(=O)OC(C)(C)C	1323517846	MIBUBJBCQGNRDX-SFHVURJKSA-N	447.492	1.563	50	20	IDGD	
CCCCOc1ccc(C(=O)NNS(=O)(=O)c2cnc3c(cnn3C)c2)cc1OC	1324179381	VCDOIENZIAVMNE-UHFFFAOYSA-N	433.490	1.779	50	20	IDGD	
CC(=O)N1CCC[C@@H](CNC(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)C1	1326831662	JLFQIEJQSXLXQQ-HNNXBMFYSA-N	428.493	1.180	50	20	IDGD	
CNS(=O)(=O)c1ccc(CC(=O)NNC(=O)c2cc(-c3cc(C)ccc3C)[nH]n2)cc1	1337857057	RGBREJHJARATAV-UHFFFAOYSA-N	441.513	1.605	50	20	IDGD	
Cc1c(NC(=O)NNC(=O)COc2ccccc2O)nnn1CCOc1ccc(F)cc1	1344694310	YPVVWNVUHWJZAI-UHFFFAOYSA-N	444.423	1.742	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(F)(F)C(F)(F)C(=O)O)C2)[C@H](F)Cl	1778023139	WNRSSXMLJIEFRG-VYUIOLGVSA-N	436.761	1.390	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(-c4ccncc4)[nH]n3)C2)C1	1779593429	PAGLCRNEISHUBM-BFUOFWGJSA-N	448.321	1.699	50	20	IDGD	
COC[C@H](C)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1	1780095600	QUALJPDGSALHJA-LHSJRXKWSA-N	449.460	1.246	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Cl)C2)c1cc(O)cc([N+](=O)[O-])c1	1781098868	FVHXVEYXOAOACT-RVKKMQEKSA-N	429.832	1.962	50	20	IDGD	
Cc1cc(C)n(CCC(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)n1	1781333117	CSJLMOUHZRUBEB-WBVHZDCISA-N	431.306	1.410	50	20	IDGD	
O=C(C1Cc2ccccc2C1)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781337218	QEZPRRRBEDPQQW-VQIMIIECSA-N	425.298	1.922	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(O)n1)C2	1781996884	XDILGLLBTWAMSY-WPKBUWHJSA-N	426.311	1.698	50	20	IDGD	
C[C@@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)Br)C1)n1cccn1	1782002895	WUEWBWRRKYLVQI-BASYENTBSA-N	427.343	1.741	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(OC)cc1O)C2	1782173768	OMLKLIRRWBJJRY-YRISNDGFSA-N	440.924	1.782	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3n[nH]c4c3CCCC4)CCO2)C1	1783534575	LUUHWBBRJHGVNY-KZULUSFZSA-N	425.327	1.515	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)CCO2)C1	1783536217	FQNJCUVEMVZKOF-APPDUMDISA-N	444.257	1.961	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)Cn3ccnc3)C[C@@H]21	1783973637	CFLJAJJRLOLNKP-QEOTZNIISA-N	441.370	1.530	50	20	IDGD	
COC(=O)[C@@H]1CC[C@@H](C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Br)C[C@@H]32)C1	1784088531	WTPYFPMVICNPBG-UMBPPFEGSA-N	449.317	1.246	50	20	IDGD	
CSc1ccc(CC(=O)N2CC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)cc1	1784217650	DBAIUGYFZGPFIH-QFIPXVFZSA-N	448.589	1.154	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ncc(F)cc3F)[C@H]2C1	1784771405	LLLKIARSBNLBNH-WRZDFSGXSA-N	432.265	1.737	50	20	IDGD	
O=C1CSc2cc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]4C3)ccc2N1	1787445546	IFCJTGONBYCVQA-GWIFVGGISA-N	441.912	1.859	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3ON=C(c4ccccc4)O3)C[C@@H]21)[C@@H](F)Cl	1787446486	MRKIANKMXWAPPZ-CYBJUQQLSA-N	425.844	1.235	50	20	IDGD	
COCCOCC(=O)Nc1ccc(C2(NC(=O)c3cnccc3C(=O)NN)CCC2)cc1	1787834875	XMBWFOYPYMZCRR-UHFFFAOYSA-N	441.488	1.096	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)c3cnccc3F)CCC2)cc1)c1ccc(B(O)O)cc1	1788140814	ZZTABSOOEZDOSI-UHFFFAOYSA-N	433.248	1.962	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21)c1cc(Cl)cc2nn[nH]c12	1789283284	UWCFHXJIYDFOEF-BHCNVRCUSA-N	430.267	1.739	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(S(C)(=O)=O)cn3)C[C@@H]21	1789858681	IVSIZXPBHAJAMV-FAYQHZLMSA-N	443.953	1.096	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ncn(-c4ccccc4)n3)C[C@@H]21	1789859663	JYVKFKLQJHBSMP-DKIMLUQUSA-N	431.924	1.878	50	20	IDGD	
C[C@@H](Nc1cnccn1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]2C1	1789870777	VOAVUEFOJSEQTD-FACIQBDNSA-N	444.363	1.493	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(OC)cc3F)[C@H]2C1	1790049376	ZXPXXVRLNTULIV-RPZXMPESSA-N	428.888	1.681	50	20	IDGD	
C[C@H](O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](Br)Cc3ccccc3)[C@H]2C1	1790780286	VZSDURQHZCNYSB-FUJDEKNSSA-N	439.350	1.353	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(C=O)s3)C[C@@H]21	1791058460	YVXFVTXJIDIOFG-XWUBHJNHSA-N	429.336	1.937	50	20	IDGD	
COc1ccc(OCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@](C)(Cl)CCl)C3)cc1	1792725419	PGAHFSMLSHAHRE-VLBMKZOESA-N	445.343	1.900	50	20	IDGD	
O=C(/C=C/c1cccc(C(F)(F)F)c1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2	1793698739	ZLLWJRLRXPNVQJ-VIAGFTJPSA-N	446.853	1.908	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1n[nH]c(C)c1F	1794810421	ZKENJOSEXPTGCV-MGGJZVGQSA-N	429.456	1.243	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(C)nn1CC	1796136205	CDOIRMXUDGHDHB-FQLMCAECSA-N	427.343	1.588	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2cccn2cn1	1797101551	GDHLYUFPNUVFSW-AODNKKSCSA-N	425.316	1.774	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccnn1-c1ccccc1)C2	1797955861	KSRWJDOKSQIWBW-UPHUGPLXSA-N	442.592	1.927	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NNC(=O)C1	1798374113	FJKRYSHHLDEYRS-WMTCKVMYSA-N	427.411	1.386	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccnc2c1OCO2	1798473755	RLASVVCBBNUNOM-XCCSTKFXSA-N	440.294	1.187	50	20	IDGD	
COc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Cl)C3)cc1NC(C)=O	1798609231	BZVDGTURZFLVFA-RMHZUWNSSA-N	427.860	1.391	50	20	IDGD	
CC(C)(C)c1cnc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Br)cn1	1799347491	OFKUYBDLQISAJD-BAESOJJISA-N	443.317	1.668	50	20	IDGD	
CC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C#N)=C/c1ccc(F)cc1F	1800332708	WWSZPJMVQFZBJI-RNCDSHHQSA-N	431.439	1.831	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3cccn3cn1)C2	1800640606	BHKPLISXVLHEAH-IARIHHJXSA-N	435.322	1.711	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc([N+](=O)[O-])cc1F)C2)C(Cl)Cl	1801016512	GHZXZUMPLFHWNM-QHBPRCKVSA-N	434.251	1.670	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CCc2ccc(F)nc2)[C@H]1c1cccnc1)[C@H](O)CCl	1803135547	FBUNSMVCLXOGMP-QKLQHJQFSA-N	434.899	1.854	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cc(Cl)cnc2O)[C@@H]1c1cccnc1)[C@H](O)CCl	1803138118	XIDHSCZLDGKHCR-APHBMKBZSA-N	439.299	1.755	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2nccc3[nH]ccc23)[C@H]1c1cccnc1)[C@H](O)CCl	1803139245	MTOLNBKEQRRZMA-YJLNNSPDSA-N	427.892	1.877	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2c(O)cc(O)cc2O)[C@H]1c1cccnc1)[C@@H](O)CCl	1803141903	VLLHCHHCVBDJOL-IWEFOYFVSA-N	435.864	1.118	50	20	IDGD	
Cn1nncc1C(=O)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@H]1c1cccnc1	1804750652	XTPURDCUJJRTTR-UBHSHLNASA-N	425.262	1.220	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2cc(C(C)=O)[nH]n2)[C@H]1c1cccnc1	1805261060	DFHNWNQPPZPNLS-RVKKMQEKSA-N	433.896	1.581	50	20	IDGD	
COc1cccc(CC(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)c1	1806551805	HTHLYRARAFROMV-HFSMHLIXSA-N	431.920	1.938	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCC2(CCCN(C(=O)CN3C(=O)CNC3=O)C2)CC1	1806590010	HPPUWJBXFAKLTE-QGZVFWFLSA-N	433.336	1.006	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)/C=C/c2ccoc2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807360507	BZRRWQMOXGNXQM-GVHNWALWSA-N	445.284	1.387	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2nccc3nc[nH]c23)[C@@H]1c1cccnc1	1808138622	LBWNFORODWZYPU-DOXZYTNZSA-N	442.907	1.926	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1CCN(C(=O)[C@H]2CCNC(=O)C2)[C@H]1c1cccnc1	1808317977	PNLGHUPQKBLPKW-GGLFYADGSA-N	441.359	1.850	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2nccnc2C(N)=O)[C@H]1c1cccnc1	1811182442	NXHCKOIZJSLDJX-RVKKMQEKSA-N	444.923	1.698	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)[C@H]3CCC(=O)N3)sc2C1	1814422405	HDLYIOJVMMYKTQ-IQJOONFLSA-N	429.340	1.507	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1ccns1	1816273160	ABCOXXGAKMWWFZ-HNNXBMFYSA-N	425.279	1.166	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(C3CC3)on2)[nH]n1)c1cccc(B(O)O)c1	1817475456	OGFVRZIGRYOCKN-SFHVURJKSA-N	449.276	1.575	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1	1817479361	LLHWFCJJZLMXLI-NHYWBVRUSA-N	449.114	1.179	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(=O)n3[nH]nnc3n2)n[nH]1	1817812393	FPTRBBPXQYDNNM-GXFFZTMASA-N	447.887	1.249	50	20	IDGD	
Nc1n[nH]c(CCC(=O)Nc2cc([C@H]3CCCCN3C(=O)[C@@H](F)Br)[nH]n2)n1	1819286197	NIYOKYYEWVAZGJ-NOZJJQNGSA-N	443.281	1.425	50	20	IDGD	
CNC(=S)NCCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](F)Br)[nH]n1	1819408037	VZIPLHPHQNYQBC-GWCFXTLKSA-N	449.350	1.576	50	20	IDGD	
O=C(COc1cc(Cl)ccn1)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)CCl)CC2	1820080517	RTJGAJNKBNRFLE-PWSUYJOCSA-N	445.328	1.782	50	20	IDGD	
CCS(=O)(=O)CC(=O)N[C@@H]1CCc2nc(NC(=O)CO[Si](C)(C)C)sc2C1	1820160606	RSTTXNADEKBOSB-LLVKDONJSA-N	433.628	1.341	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)CCl)CC2)c1n[nH]c2cccc(F)c12	1824293082	MCSCHTZVQMZVKN-PELKAZGASA-N	437.884	1.984	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](Cl)COC)CC2	1824613352	VZDKUWYPYSWVMS-MXWKQRLJSA-N	433.914	1.871	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)C1=NN(C)C(=O)CC1)CC2	1825636653	YGOBDVIZVJZHGW-IUCAKERBSA-N	442.339	1.447	50	20	IDGD	
COCCOCCOCCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](F)Cl)CC2	1825773086	MCEWOIUHEHJTIB-ABAIWWIYSA-N	437.921	1.659	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)COC(C)(C)C)CC2	1826082931	GMGFASWLGQVFPK-LBPRGKRZSA-N	425.555	1.243	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@]1(C)CC1(F)F)CC2	1826092050	KAZUKVDXNGQAIT-BMLIUANNSA-N	429.493	1.473	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)c2cncs2)CC1	1826132686	YZFFFOJWANCZIH-SFHVURJKSA-N	427.335	1.370	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](C)n3cncn3)sc2C1	1826797124	FCXXJOBLRITJBW-LPEHRKFASA-N	427.328	1.691	50	20	IDGD	
C[C@@]1(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)CC1(F)F	1827060033	MSKVPURHPQYQCY-RXVVDRJESA-N	434.292	1.645	50	20	IDGD	
O=C([C@@H](F)Cl)N1CCC([C@H]2CCCCN2C(=O)CS(=O)(=O)N2CCCC2)CC1	1827675185	CMUDZDMQWOLFFQ-NVXWUHKLSA-N	437.965	1.566	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H](C)CN)CC1	1827681210	PTVSNGWWTITMRH-DGMXVEBPSA-N	430.553	1.335	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H](O)N2CCOCC2)CC1	1828965656	QOASDFSIMOARMP-ROUUACIJSA-N	429.989	1.522	50	20	IDGD	
CN1CCC[C@@H](C(=O)N2CCCC[C@@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)C1	1830184216	IQCHHYBVLXXKDH-WOJBJXKFSA-N	435.613	1.321	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(F)cn3C)C2)C1	1830538591	KNQRQFSWEDEUCS-ACJLOTCBSA-N	446.317	1.265	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3cnccc3C)CCO2)C1	1833015208	OACGZYOTFJWWNP-RXVVDRJESA-N	439.940	1.033	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3ccco3)CCO2)C1	1833050642	APQNOYXSWPXFTH-MOPGFXCFSA-N	433.332	1.905	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCCc3ccncc3)CCO2)C1	1833060109	UHAUVVIHFDAGDA-WIYYLYMNSA-N	439.940	1.115	50	20	IDGD	
O=C(Cc1cccc(Cl)n1)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1833178513	KMYGKDJOBXRNQJ-QGZVFWFLSA-N	436.723	1.538	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)CSC3CCCC3)CC2)CC1)[C@@H](O)CCl	1833306483	TYXFTDWZTBDFCZ-SFHVURJKSA-N	432.030	1.834	50	20	IDGD	
COc1cscc1C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)CCl)CC2)CC1	1833310782	SDQPLOPFCUJBNW-MRXNPFEDSA-N	429.970	1.542	50	20	IDGD	
CC(C)c1nc(CC(=O)NC2CCN(C3CCN(C(=O)[C@@H](F)Cl)CC3)CC2)no1	1833784009	VCHWANLRSQKSAO-QGZVFWFLSA-N	429.924	1.842	50	20	IDGD	
O=C(/C=C/c1ccsc1)NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1833865998	GKUNBWORDHTMGC-ZMXQLYDGSA-N	425.982	1.933	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)c3c(F)cncc3F)C2)C1	1834823459	WCIBVPNXEOFHIK-KRWDZBQOSA-N	448.264	1.215	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cn4cccnc4n3)CC2)CC1	1835547390	DZKBZVFUYSQSBI-QGZVFWFLSA-N	448.955	1.168	50	20	IDGD	
C[C@@H](C(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1)n1cccc1C=O	1835951454	FLHYNIROINRMHR-HRAATJIYSA-N	439.940	1.583	50	20	IDGD	
O=C(c1cc(C(F)F)no1)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1836247352	KVTRNBFFORWEMP-HNNXBMFYSA-N	428.219	1.486	50	20	IDGD	
CC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)c3cnc4ncccn34)CC2)CC1	1836394236	OKPXPSYGDSINQM-KRWDZBQOSA-N	432.956	1.932	50	20	IDGD	
CC[C@@H](Br)C(=O)NC1CCN(C2CCN(C(=O)[C@@H]3C=CCN3)CC2)CC1	1836541993	RAZBCPRTTRSTQR-SJORKVTESA-N	427.387	1.260	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(Cl)nn3)CCO2)C1	1837833122	RUUUXWCTSZPDNP-SCLBCKFNSA-N	431.320	1.608	50	20	IDGD	
O=C(c1cnc(O)nc1O)N1CCC(OC2CCN(C(=O)C(Cl)Cl)CC2)CC1	1838078024	MHYMNCPZKUNBPC-UHFFFAOYSA-N	433.292	1.304	50	20	IDGD	
CN(C)c1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)cn1	1838198951	YAQDXAIFTSAHNA-SFHVURJKSA-N	431.320	1.021	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccnc3SC)CCO2)C1	1838287208	FPMLOGCUXBUWIZ-KXBFYZLASA-N	427.954	1.891	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](C)n3ccnn3)CC2)CC1	1838730379	OQNYHMUDIPBZDQ-RHSMWYFYSA-N	427.933	1.092	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(F)ccc3F)CCO2)C1	1838860406	FVYXNRYDIUNBBH-SGTLLEGYSA-N	447.276	1.818	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)C(=O)c3ccc(Cl)cc3)C2)C1	1839141794	SQRUYONXRPLECI-OXQOHEQNSA-N	443.327	1.997	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(-n4cccn4)cc3)C2)C1	1839147044	FXJBXBDHUXOULE-DENIHFKCSA-N	446.935	1.960	50	20	IDGD	
O=C(Cc1cccs1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839198731	ARANCFITJWXVAS-HOCLYGCPSA-N	435.315	1.438	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(O)cc3F)CCO2)C1	1839317030	HKFRDJNNPZPIKU-MOPGFXCFSA-N	449.306	1.838	50	20	IDGD	
COc1cc(C)c(C)cc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1839464572	UYIZFCHSGUOCFM-FXAWDEMLSA-N	428.888	1.916	50	20	IDGD	
CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](Br)Cc1ccccc1)CCO2	1839802428	WXTPHQWNPILQOA-XLIONFOSSA-N	439.350	1.859	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C=C/c3ccc(C)s3)C2)C1	1840156730	YIMNMSPHILBJGJ-HOQHSMRBSA-N	442.965	1.780	50	20	IDGD	
COc1ccc(OC)c(C(=O)CCC(=O)N2CC3(CCCN3C(=O)[C@@H](O)CCl)C2)c1	1841354168	LDUOVHPINSDMRI-KRWDZBQOSA-N	438.908	1.470	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCCC12CN(C(=O)Cc1cnc[nH]1)C2	1841925003	UNEHEWKLJFWWDY-AWEZNQCLSA-N	425.917	1.288	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC2(CCCN2C(=O)c2cnc(O)[nH]2)C1	1844503022	OBESIOMSUVLNAI-NSHDSACASA-N	427.889	1.064	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)c2n[nH]c3c2CCc2ncccc2-3)C1	1844663914	NZNJIRFEDNZFOB-HNNXBMFYSA-N	429.908	1.641	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)Cc1cnc[nH]1)C2	1844692490	CZSMDXKZEOUMMZ-UHFFFAOYSA-N	427.417	1.303	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)c2ccc3sccc3c2O)C1	1845659727	DLLVHLINBVZKES-UHFFFAOYSA-N	436.298	1.418	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC2(CCCN2C(=O)Cn2cccc([N+](=O)[O-])c2=O)C1	1845825200	CYTKATHSMCPCOQ-GFCCVEGCSA-N	441.282	1.133	50	20	IDGD	
CC(C)CCC(=O)N1CCCC12CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2	1845985164	JPTBUMZQAQRGPZ-UHFFFAOYSA-N	429.565	1.972	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)C1CN(C(=O)c2ccccc2OC)C1	1847457657	UYVCKWSGDATMMT-BZSNNMDCSA-N	449.935	1.223	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CCc1cn[nH]c1	1848095625	GZXILMQJKRHAFM-JYJNAYRXSA-N	439.944	1.676	50	20	IDGD	
CNc1ccc(C(=O)OCC(=O)NNC(=O)c2ccc(OC)c(OC)c2)cc1[N+](=O)[O-]	9924230	YILHLOBFEWXEMW-UHFFFAOYSA-N	432.389	1.272	50	20	IDGD	
Cn1c(=O)c2c(ncn2CCC(=O)NN=C(c2ccccc2)c2ccccc2)n(C)c1=O	18230382	XHJFSMKBWZAFEC-UHFFFAOYSA-N	430.468	1.393	50	20	IDGD	
CSc1nc(C)c(CCC(=O)NNC(=O)c2csc(N3CCOCC3)n2)c(C)n1	20910922	CXZJVFWPJNGTPX-UHFFFAOYSA-N	436.563	1.502	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)CN2C(=O)COc3ccc(Cl)cc32)cc1OC	23447835	JECKASWIKQILJZ-UHFFFAOYSA-N	433.848	1.934	50	20	IDGD	
CC(C)(C)C(=O)NCCCC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	26561613	GKZCQXNILHLVHO-UHFFFAOYSA-N	438.550	1.175	50	20	IDGD	
O=C(NNC(=O)c1ccc(N2CCCC2)nc1)c1ccc(S(=O)(=O)N2CCCC2)cc1	60373357	CKUMEDAPXQXLMN-UHFFFAOYSA-N	443.529	1.541	50	20	IDGD	
CC(C)c1ccc(CN2CCN(C(=O)NNC(=O)CNC(=O)c3ccco3)CC2)cc1	725873177	WFFQAKGIHBWPKK-UHFFFAOYSA-N	427.505	1.691	50	20	IDGD	
CN1C(=C(C#N)C(=O)COC(=O)CCc2nc(-c3ncccn3)no2)N(C)c2ccccc21	727902671	MUEDGWCLQDXZIU-UHFFFAOYSA-N	445.439	1.893	50	20	IDGD	
CCCS(=O)(=O)Nc1ccc(C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1	728018668	QXIIUNKXCKYMKX-UHFFFAOYSA-N	443.485	1.160	50	20	IDGD	
NC(=O)c1ccc(/C=C/C(=O)N2CCC[C@H]2C(=O)NNc2nc(-c3cccnc3)no2)cc1	728075043	QXLKYCGWYZBBRI-JEJOPICUSA-N	447.455	1.378	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCCCC2)cc1C(=O)N([C@@H]1CCS(=O)(=O)C1)N(C)C	728176406	OEGXJQIRKUNJIJ-MRXNPFEDSA-N	443.591	1.276	50	20	IDGD	
COc1ccc(C)cc1-n1ccc(C(=O)OCC(=O)NNC(=O)Cc2nc(C)cs2)n1	728730455	AKDGSNAXRKGNAQ-UHFFFAOYSA-N	443.485	1.501	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1cccn(Cc2ccccc2)c1=O	728845724	JGCZKUCRXJUDKZ-UHFFFAOYSA-N	432.484	1.364	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)NCC1CCN(S(=O)(=O)c2ccccc2)CC1	728953494	ZJOWRPDRQGXKBS-UHFFFAOYSA-N	431.518	1.055	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)NC[C@H](c1ccc(Cl)cc1)N1CCOCC1	730824513	HXLUMXZUUUBDKQ-QGZVFWFLSA-N	448.907	1.828	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)N1CCC[C@@H](NS(=O)(=O)c2cccc(F)c2)C1	732201398	ZELYVLZTVQMABG-GOEBONIOSA-N	428.530	1.150	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)N1CCC[C@H](NS(=O)(=O)c2cccc(F)c2)C1	732201399	ZELYVLZTVQMABG-HOCLYGCPSA-N	428.530	1.150	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)N[C@@H](Cc2ccccc2)CN2CCOCC2)c1	732476205	APKQDINIWWGCAO-NRFANRHFSA-N	440.544	1.956	50	20	IDGD	
N#Cc1ccc(N2C(=O)N[C@@H](CCC(=O)NNC(=O)c3ccc(Cl)cc3O)C2=O)cc1	733806360	ZVSHIGQJZKBPMZ-HNNXBMFYSA-N	441.831	1.583	50	20	IDGD	
CCOCCCN1CC[C@H](NC(=O)NNC(=O)c2nnc(O)c3ccccc23)[C@H](C)C1	734682505	BJQGUXOLSUEREG-PBHICJAKSA-N	430.509	1.416	50	20	IDGD	
CCc1cccc(OCC(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)c1	735116701	CKRCSDTYOFKTOS-UHFFFAOYSA-N	433.534	1.102	50	20	IDGD	
CS[C@H]1CCC[C@H](NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)C1	735385453	ZMIGLOQLTSDTRD-GJZGRUSLSA-N	428.580	1.620	50	20	IDGD	
Cn1cc(N2CC[C@@H](NC(=O)NNC(=O)c3cc4c(s3)CCCCCC4)C2=O)cn1	735583783	FDRMIXGROZVKMV-OAHLLOKOSA-N	430.534	1.890	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2cnc(O)c(Br)c2)c2ccccc2c1=O	742034496	OPOJTNWVSZHLEP-UHFFFAOYSA-N	432.234	1.354	50	20	IDGD	
Cc1c(Br)cc(S(=O)(=O)NNC(=O)c2ccccc2O)cc1[N+](=O)[O-]	743252397	ZYBNGRYDPNUPKT-UHFFFAOYSA-N	430.236	1.995	50	20	IDGD	
COCCOc1ccc(S(=O)(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)cc1C	743268287	JRXZNPRSTWSYOL-UHFFFAOYSA-N	425.419	1.257	50	20	IDGD	
CC(C)COc1ncccc1C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	744620538	HNXMKFWYIAZPRP-UHFFFAOYSA-N	434.518	1.894	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1ccc(C(F)(F)F)nc1O	744621640	WKNVADQTIHCQFH-UHFFFAOYSA-N	446.407	1.584	50	20	IDGD	
CN(C)c1nc2sc(C(=O)OCC(=O)NNC(=O)c3cccc(C#N)c3)cc2s1	744841874	DQSYLYTXPXGUMV-UHFFFAOYSA-N	429.483	1.913	50	20	IDGD	
O=C(CSc1nnc(O)nc1O)NN=C1CCC[C@@H](N2C(=O)c3ccccc3C2=O)C1	745201213	NKOJAUZOKHZBMG-LLVKDONJSA-N	442.457	1.086	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)CCc1c(C)nc2c(c(O)nn2C)c1C	746096356	SMJKGQKOWHJLBD-UHFFFAOYSA-N	449.515	1.983	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)/C(=C/c1cccnc1)NC(=O)c1ccccc1	746638074	WWLLVPWBFCUWAT-MOSHPQCFSA-N	440.463	1.890	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)CN2C(=O)CCOc3ccccc32)cc1	747533727	QGBWNSMGKIAXAM-HNNXBMFYSA-N	427.457	1.816	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)NC[C@H](c1ccccc1Cl)N1CCOCC1	748620916	LGEUITUYMYTQHV-WMLDXEAASA-N	428.917	1.095	50	20	IDGD	
CNS(=O)(=O)c1csc(C(=O)NNC(=O)NCc2cccc(C(F)(F)F)c2)c1	748704821	ZRCCXKCLQYZQQB-UHFFFAOYSA-N	436.437	1.819	50	20	IDGD	
O=C(COC(=O)Cn1cc([N+](=O)[O-])ccc1=O)NN=C(c1ccccc1)c1ccccc1	748917548	QFLPUFMUIIRZPQ-UHFFFAOYSA-N	434.408	1.869	50	20	IDGD	
Cc1cc(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)c(N)c([N+](=O)[O-])c1	749414057	RDKSSAWGXMXIOD-UHFFFAOYSA-N	435.462	1.263	50	20	IDGD	
Cc1cc(C)nc(-n2nc(C)c(CC(=O)NNC(=O)CNC(=O)c3cccs3)c2C)n1	751209470	QJODSDRVVXKAKS-UHFFFAOYSA-N	441.517	1.077	50	20	IDGD	
C[C@@H]1C[C@H](CCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)CCO1	753333686	DKKDMPVCINEQCM-HZPDHXFCSA-N	438.550	1.620	50	20	IDGD	
COc1cc(OC)c2cc(CCCNC(=O)NNC(=O)CNC(=O)c3ccco3)[nH]c2c1	753895042	PTGXKJTZRCHCOP-UHFFFAOYSA-N	443.460	1.471	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)N[C@@H]1[C@@H]2CCO[C@@H]2C12CCCC2	754837694	BCYDAMYCANQFNV-IMJJTQAJSA-N	435.550	1.580	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)Nc1ccc(S(=O)(=O)C(F)F)cc1	755445237	XZOGSXMJLCFZIT-UHFFFAOYSA-N	429.401	1.923	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c(OCC(=O)N(C)C)c1	756202646	KSJDVBFJTILWSP-SFHVURJKSA-N	428.445	1.455	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)cc1	756206075	JLCUMDRBSNNNRC-UHFFFAOYSA-N	432.502	1.462	50	20	IDGD	
COc1ccc(C#N)cc1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	756274474	RFHXWUZKSHQTSL-UHFFFAOYSA-N	443.485	1.818	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN(C)[C@@H](C)c2ccc([S@](C)=O)cc2)cc1OC	756550714	MBFFKYMZJFJKEO-KJEZJMDVSA-N	433.530	1.895	50	20	IDGD	
Cc1c(NC(=O)NNC(=O)c2ccc3c(c2)OCO3)cccc1S(=O)(=O)NC1CC1	756705485	MULIVURZKMXFKM-UHFFFAOYSA-N	432.458	1.631	50	20	IDGD	
CCOC(=O)c1sc([C@H](C)NC(=O)NNC(=O)COc2ccc(C#N)cc2)nc1C	757274835	YBSAHOUPWDOWER-LBPRGKRZSA-N	431.474	1.970	50	20	IDGD	
Cc1ccnc(NC(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1	758000838	YUVSRONECPOIEW-UHFFFAOYSA-N	447.517	1.196	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(CS(=O)(=O)C(F)F)cc2)cc1	759389845	LUGHCYVRYRKLJG-UHFFFAOYSA-N	440.424	1.750	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)N=c1cc[nH]cc1I	760024477	MAYDSKOUCHYCAV-UHFFFAOYSA-N	428.186	1.045	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccnn2[C@@H](C)C2CC2)cc1	760276815	DDOGBXGPAPCOBH-UONOGXRCSA-N	429.477	1.806	50	20	IDGD	
COC(=O)c1cc(Cl)ccc1S(=O)(=O)NNC(=O)CCCNC(=O)OC(C)(C)C	763439767	RJESLBMUTYCMTF-UHFFFAOYSA-N	449.913	1.741	50	20	IDGD	
CCOC(=O)c1cc(Br)ccc1NC(=O)C(=O)NNC(=O)c1ccccn1	763466930	MEOJDXOLMFURCP-UHFFFAOYSA-N	435.234	1.421	50	20	IDGD	
CN(C)C(=O)C[C@H]1CN(C(=O)C(=O)NNC(=O)c2cccnc2)c2ccc(Cl)cc21	763492498	ZTDZPZFNOGLLQB-ZDUSSCGKSA-N	429.864	1.105	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(F)c(F)c2F)cc(OC)c1OC	763538921	GRAABPPNVZLJNE-UHFFFAOYSA-N	427.335	1.529	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cc3c(cc2C)OCO3)cc(OC)c1OC	763544405	XIGVAOZODYHYNY-UHFFFAOYSA-N	431.401	1.149	50	20	IDGD	
O=C(NNC(=O)c1sc2ccccc2c1Cl)C(=O)Nc1cnn(-c2ncccn2)c1	763576834	FAESQYWPUPPWRF-UHFFFAOYSA-N	441.860	1.930	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cnn(-c2ccccc2F)c1C	763663786	ZFEULBLFSPENLR-UHFFFAOYSA-N	441.419	1.493	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(-c2csnn2)cc1	763685037	RRFOAIIJKACGQO-UHFFFAOYSA-N	441.469	1.769	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(Br)cc2)c(C)n1	763695741	VFCUTSHCNUEHFG-UHFFFAOYSA-N	437.250	1.326	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)C(=O)Nc2ncn(Cc3ccc(Cl)cc3)n2)c1	763757563	IEFPGJKXTADMFU-UHFFFAOYSA-N	441.879	1.446	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)C(=O)Nc2ccccc2OC2CCCC2)c2ccccc2c1=O	763789803	DPJWTYLLAUCPSQ-UHFFFAOYSA-N	449.467	1.655	50	20	IDGD	
CN(C)c1c(Cl)cccc1NC(=O)C(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	763790662	MORVOEXKODSJGQ-UHFFFAOYSA-N	442.863	1.053	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccc(OC[C@@H]2CCCO2)cc1	763866909	RMYXHCPGHVVDBS-KUHUBIRLSA-N	445.447	1.937	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(C(C)=O)cc2)cc1OC	763875823	BEWFVAVALKVGRF-AWEZNQCLSA-N	443.456	1.850	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)C2=S=C3CC[C@H](C)CC3=C2)ccc1C(=O)N(C)C	763941944	ZIXVVEBBWBWWKC-LBPRGKRZSA-N	442.541	1.621	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1ccc(-n2cncn2)c(Cl)c1	764006779	UWSKFMUICIVUET-UHFFFAOYSA-N	442.819	1.092	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1cccnc1OCC(F)F	764012660	UHUNDMUUZGRLDZ-UHFFFAOYSA-N	428.779	1.787	50	20	IDGD	
CC[C@@H](C)NS(=O)(=O)c1cccc(NC(=O)C(=O)NNC(=O)Cc2ccsc2)c1	764034608	SMRCYDKFJDGNMW-GFCCVEGCSA-N	438.531	1.154	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CCc2ncc(NC(=O)C(=O)NNC(=O)C3CCCC3)cc2C1	764069476	CUMICVKARKRAQC-OAHLLOKOSA-N	445.520	1.740	50	20	IDGD	
CCNC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccc3ccccc3c2)cc1	764090603	CQKQUBXISXSDHO-UHFFFAOYSA-N	448.479	1.683	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccccn2)cc1OCc1cccnc1	764267099	NJEFQJWERJFQSR-UHFFFAOYSA-N	435.440	1.393	50	20	IDGD	
CCNC(=O)N1CCc2ccc(NC(=O)C(=O)NNC(=O)CCc3ccccc3O)cc21	764289942	ZQALVWMAEBDFNL-UHFFFAOYSA-N	439.472	1.203	50	20	IDGD	
O=C(Cc1cc[nH]n1)NNC(=O)C(=O)Nc1ccc(Cc2nc3ccccc3s2)cc1	764294081	UMTAGJWWCYJMGC-UHFFFAOYSA-N	434.481	1.939	50	20	IDGD	
COC(=O)c1cccc(C#Cc2cccc(NC(=O)C(=O)NNC(=O)c3c[nH]nc3C)c2)c1	764297482	UGKBGPCAUAVINO-UHFFFAOYSA-N	445.435	1.304	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)C(=O)Nc1ccc(NC(=O)CN(C)C)cc1)c1ccccc1	764329201	VBTCECCVVVCGBI-GOSISDBHSA-N	425.489	1.466	50	20	IDGD	
COCCS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc3ccccc3o2)cc1	764330618	CXKXUKCUHLGXMH-UHFFFAOYSA-N	445.453	1.253	50	20	IDGD	
CC(=O)N1CCc2cc(NC(=O)C(=O)NNC(=O)c3cc(-c4cccs4)[nH]n3)ccc21	764382874	RUPANTYEPALIMB-UHFFFAOYSA-N	438.469	1.447	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2ncccc2C)cc(OC)c1Br	764385871	NYMLKTGIFAPXEP-UHFFFAOYSA-N	437.250	1.569	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1cc(Br)ccc1OC(C)C	764401940	ZYJWXRBFMCBFFJ-NSHDSACASA-N	446.298	1.374	50	20	IDGD	
CCOc1cccc(C=NNC(=O)CN2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)n1	764820517	ZWJKUNZLDYZOFG-UHFFFAOYSA-N	445.545	1.245	50	20	IDGD	
O=S(=O)(Nc1ccc(S(=O)(=O)N2CCOCC2)cn1)c1ccc(CCCl)cc1	764956245	SWYYHROAFTZMPD-UHFFFAOYSA-N	445.950	1.685	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)Cn1cc(Br)ccc1=O	765321037	VAYMZVJMCDBNJB-UHFFFAOYSA-N	431.287	1.063	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)cc1	765618383	ZCBWCRQGPQSERE-UHFFFAOYSA-N	431.449	1.541	50	20	IDGD	
Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	766259367	YSBYZTGMLOUUCG-UHFFFAOYSA-N	434.430	1.015	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cc(F)cc([N+](=O)[O-])c3N)CC2)cc1	766639981	BGHFXGWFYSBDAD-UHFFFAOYSA-N	444.467	1.203	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)[C@@H]1Cc2cc(F)ccc2O1	766659444	BKCFWHVBMITMQQ-FQEVSTJZSA-N	446.910	1.748	50	20	IDGD	
Nc1ccc(C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)cc1[N+](=O)[O-]	766661681	YJZFKNHTSSONOE-UHFFFAOYSA-N	446.895	1.409	50	20	IDGD	
COc1ccc([C@H](CNC(=O)NNc2ccccc2S(C)(=O)=O)N2CCOCC2)cc1	766838463	VDXVUAAAKMCALV-IBGZPJMESA-N	448.545	1.798	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)Cc3csc4nccn34)cc2)CC1	767962327	PKHGHIFOXQQMDE-UHFFFAOYSA-N	434.547	1.018	50	20	IDGD	
C[C@@H](CCC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)NC(=O)OC(C)(C)C	768224858	OHDMXAKKFSZCQM-LBPRGKRZSA-N	428.511	1.936	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(N2CCOCC2)c(C(=O)NNc2ccc([N+](=O)[O-])cc2)c1	768246789	KMBHPNYFWZBAMO-UHFFFAOYSA-N	449.489	1.439	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)c1ccc([N+](=O)[O-])c(O)c1	768290287	GIKXXIGSIHMAAW-UHFFFAOYSA-N	447.879	1.533	50	20	IDGD	
Cc1nn(CC(=O)OC(C)C)c(C)c1C=NNC(=O)Cc1csc(N2CCOCC2)n1	768356459	ZCRDCEMKIULDPH-UHFFFAOYSA-N	448.549	1.437	50	20	IDGD	
O=C(CSc1nnc(-c2cnccn2)n1Cc1ccco1)NNC(=O)c1cccs1	768415986	VGKHFDLQWSZNSM-UHFFFAOYSA-N	441.498	1.991	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2c(-c3ccncc3)noc2C)cc1OC	769044528	YOXGSSHZFYMPRO-UHFFFAOYSA-N	440.412	1.680	50	20	IDGD	
CN(C)C(=O)COc1ccc(C(F)(F)C(=O)NNc2nc3ccccc3c(=O)n2C)cc1	769581692	YKFMVTPEUNMOCN-UHFFFAOYSA-N	445.426	1.636	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1cccc(S(=O)(=O)Nc2ccc(F)cc2)c1	771869486	YPNJIUMWTLQSRA-GFCCVEGCSA-N	437.449	1.729	50	20	IDGD	
Cc1cn2c(=O)c(C(=O)NNC(=O)c3nn(C(C)C)c(=O)c4ccccc34)cnc2s1	772558635	UIFYOSREDIKTHV-UHFFFAOYSA-N	438.469	1.430	50	20	IDGD	
CC(C)(C)NC(=O)N1CCN(C(=O)NNC(=O)c2cccc(Br)c2)CC1	773341097	PTWGGNFLRRMOGP-UHFFFAOYSA-N	426.315	1.929	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)CCC(=O)N3CC2CC2)c1	773493792	IIRTZVKNGRPMHN-UHFFFAOYSA-N	449.511	1.842	50	20	IDGD	
O=C(NNc1ncnc2ccsc12)C(=O)Nc1ccc(I)cn1	773638547	JCWCAMJXOLHCNC-UHFFFAOYSA-N	440.226	1.773	50	20	IDGD	
COC(=O)c1ccc(C)c(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)c1	774009457	PWJRFABDSMXKOC-LBPRGKRZSA-N	433.848	1.988	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN[C@H](C)c2ccc3c(c2)CC(=O)N3C)cc1OC	775350073	ILRMMBGFALFZIL-CYBMUJFWSA-N	426.473	1.335	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)c2cnc3scc(C)n3c2=O)c1	776345607	UBFPZFVFBHEDSI-UHFFFAOYSA-N	437.275	1.910	50	20	IDGD	
CCOC(=O)N1CCC[C@H]([C@H](C)NC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])C1	777262387	OBJHSNYEWTUDFY-KBPBESRZSA-N	437.453	1.561	50	20	IDGD	
CCn1cc(-c2n[nH]cc2C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cn1	778282716	IRKRHXAOKYQXAO-UHFFFAOYSA-N	436.520	1.266	50	20	IDGD	
CC(C)OCCCn1c(NNC(=O)c2cnc(N(C)C)cn2)nc2ccccc2c1=O	779665465	CNXXQJPLICLOMX-UHFFFAOYSA-N	425.493	1.825	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2cc(C)n(-c3cccc(C#N)c3)n2)n1	780199105	XCTOBCDQQRTZHD-UHFFFAOYSA-N	438.469	1.364	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2c[nH]ccc2=NC(=O)OC(C)(C)C)n1	781391341	CDOGSAWMQOBRHA-UHFFFAOYSA-N	449.489	1.162	50	20	IDGD	
Cc1cc(C(=O)NCC(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)ccc1[N+](=O)[O-]	781917518	INUFTMQBXSZKDR-UHFFFAOYSA-N	448.819	1.291	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)[C@@H]3CC(c4ccccc4[N+](=O)[O-])=NO3)nc21	781969314	IDTOKFOGRVXLJG-AWEZNQCLSA-N	440.420	1.831	50	20	IDGD	
COCCOc1ccc(Br)cc1NC(=O)C(=O)NNc1ncncc1Cl	782165176	DZORTFMXHVTTKU-UHFFFAOYSA-N	444.673	2.000	50	20	IDGD	
Cc1cc(C(=O)N2CCSCC2)ccc1NC(=O)C(=O)NNC(=O)c1ccc(O)cc1	782834518	XRXMWUAWUVWHJS-UHFFFAOYSA-N	442.497	1.289	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)C(=O)Nc1csc2ccccc12	782896385	HKMPHRSFCYBQFF-UHFFFAOYSA-N	431.499	1.594	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)C(=O)Nc2cccc(C(=O)N3CCCCC3)c2)c1	784839180	GFKVYEKDIHYGFE-UHFFFAOYSA-N	444.513	1.798	50	20	IDGD	
Cc1ccc(S(=O)(=O)Nc2ccc(F)cc2)cc1C(=O)NNC(=O)N1CCN(C)CC1	788169032	HVWRUHKGKFJMHX-UHFFFAOYSA-N	449.508	1.537	50	20	IDGD	
Cc1cc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)N3CCN(C)CC3)cc2)ccc1F	788169996	VYMANJBRBLJNQD-UHFFFAOYSA-N	449.508	1.537	50	20	IDGD	
CCOC(=O)C1(CC(=O)NNC(=O)c2cccc(S(=O)(=O)N(CC)CC)c2)CCC1	788694744	QZBSAVZSXXVSIY-UHFFFAOYSA-N	439.534	1.602	50	20	IDGD	
Cc1c(Br)cc(C=NNC(=O)[C@@H](C)NS(C)(=O)=O)cc1Br	789003576	BDQIARUZLSDPSL-MRVPVSSYSA-N	441.145	1.908	50	20	IDGD	
COc1ccccc1Nc1ncccc1C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	789056516	FXGFROMNWCWLNB-UHFFFAOYSA-N	430.428	1.884	50	20	IDGD	
CC[C@H]1CCc2nc(NC(=O)C(=O)NNC(=O)COc3ccc(OC)cc3)sc2C1	789731880	JDGOSEMTEOAXMZ-LBPRGKRZSA-N	432.502	1.832	50	20	IDGD	
CC[C@@H]1CCc2nc(NC(=O)C(=O)NNC(=O)COc3ccc(C#N)cc3)sc2C1	789733200	YXIHNSPYVPJWTF-GFCCVEGCSA-N	427.486	1.695	50	20	IDGD	
O=C(NNS(=O)(=O)c1c(Cl)ccc(F)c1F)c1csc(N2CCOCC2)n1	790045329	LSQUSPQLGHIWAA-UHFFFAOYSA-N	438.865	1.535	50	20	IDGD	
Cc1cccnc1NNC(=O)C(=O)Nc1ccc(F)c(NC(=O)CCN2CCOCC2)c1	792376488	VETAZDBOKPBSSV-UHFFFAOYSA-N	444.467	1.272	50	20	IDGD	
CCOC(=O)c1cc(C=NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)on1	792871175	GLXZHXCULYJFMB-UHFFFAOYSA-N	434.474	1.790	50	20	IDGD	
CSCC[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)NNC(=O)c1cccc(C)n1	794074340	DPMAKVDBVIJSKN-MRXNPFEDSA-N	431.474	1.611	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)c3nnn(Cc4cc(C)no4)c3C)n[nH]2)cc1	794393438	PEHZOZFAKDQFRV-UHFFFAOYSA-N	434.460	1.959	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCn2c(Br)cnc2C1	796046850	GWOFAJMCCWRMIA-UHFFFAOYSA-N	442.701	1.584	50	20	IDGD	
CCNC(=O)N(C)c1cccc(NC(=O)C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c1	796991404	LIIJIGLOQRXDOF-UHFFFAOYSA-N	428.405	1.160	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccnn2[C@H]2CCN(Cc3ccccc3)C2)n1	797370391	BCBWQRSDQBZRPW-SFHVURJKSA-N	447.499	1.433	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)Nc1ccc(S(=O)(=O)N(C)C)cn1	797653216	MBDFIVIIPAJFQG-LLVKDONJSA-N	425.442	1.091	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C2=NN(c3ccc(F)cc3)[C@@H](C(N)=O)C2)c2ccccc2n1	799008788	BEUYJHIYMKSZFF-LJQANCHMSA-N	434.431	1.564	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNS(=O)(=O)c1cccc(Br)c1F	799124604	VMKLRIBAXAJEQM-UHFFFAOYSA-N	426.264	1.422	50	20	IDGD	
CC(C)(C(=O)NNS(=O)(=O)c1cc(Br)cc(C(N)=O)c1)c1ccccc1	799530184	CTTMWDPBGFNNGI-UHFFFAOYSA-N	440.319	1.835	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)Nc1cccc2c1CNC2=O	806754673	BXFMFCXQMZYPKK-UHFFFAOYSA-N	443.485	1.181	50	20	IDGD	
Cn1[nH]cc2c(=NC(=O)C(=O)NNC(=O)COc3ccccc3-c3ccccc3)ccnc1-2	806973563	RQADWAKQEJSLIC-UHFFFAOYSA-N	444.451	1.174	50	20	IDGD	
COCCNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)C(C)(C)c2ccccc2)c1	806979760	FRODKFWOUMIWFR-UHFFFAOYSA-N	426.473	1.127	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3ccc4c(c3)N(C)CCO4)CC2)cc1	807093316	KUJFPTQTQYMFHA-UHFFFAOYSA-N	437.544	1.402	50	20	IDGD	
Cc1ccc(F)c(NC(=O)C(=O)NNc2ccc(-n3ccnc3)nn2)c1Br	807428768	KGRJFJDVJKUOJO-UHFFFAOYSA-N	434.229	1.954	50	20	IDGD	
CC(C)(C)c1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc3c(c2)C(=O)OC3)cc1	808934657	PKGJQHXYYHNWFB-UHFFFAOYSA-N	425.441	1.819	50	20	IDGD	
O=C1O[C@H](c2ccccc2)C[C@H]1C(=O)N1CCN(S(=O)(=O)CBr)CC1	809750492	YASWGIJMYGHIGU-KBPBESRZSA-N	431.308	1.117	50	20	IDGD	
Cc1nc(Cl)cc(NNC(=O)CNS(=O)(=O)c2ccc(Br)s2)n1	810438433	UWUUMVDJBMKKLP-UHFFFAOYSA-N	440.732	1.684	50	20	IDGD	
COC(=O)c1ccccc1NNC(=O)CNS(=O)(=O)c1ccc(Br)cc1	810891600	TZVRKIYTQHUUKP-UHFFFAOYSA-N	442.291	1.657	50	20	IDGD	
COc1ccc(CNC(=O)NNC(=O)NCc2ccc(Cl)cc2)cc1S(N)(=O)=O	812428756	LHYCEVRJZSAOBF-UHFFFAOYSA-N	441.897	1.210	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCc2cc3ccccc3n(C)c2=O)nc1	813839267	WAWAZJFDPUEHFH-UHFFFAOYSA-N	444.517	1.447	50	20	IDGD	
O=C(NNC(=O)C1(Cc2ccccc2Br)CC1)N[C@H]1CCS(=O)(=O)C1	814620493	TWWBQSGFXAHKAK-LBPRGKRZSA-N	430.324	1.289	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)Cc2ccc(F)cc2)nnn1Cc1ccccc1F	815567417	XOCWQCRCPZTMLC-UHFFFAOYSA-N	428.399	1.242	50	20	IDGD	
N#Cc1ccc(Oc2cccc(NC(=O)C(=O)NNC(=O)[C@H]3CCc4nncn4C3)c2)cc1	815691782	BFIKHTMGRCKVOC-HNNXBMFYSA-N	445.439	1.291	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)Cc2ccc(S(N)(=O)=O)s2)c1	818746514	RYQCIPZMVGEINM-UHFFFAOYSA-N	448.320	1.630	50	20	IDGD	
Cc1ccc(N2C[C@H](C(=O)OCC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)CC2=O)cc1	849123350	YUGLHBAFMGQQJL-OAHLLOKOSA-N	440.412	1.261	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)CN1C(=O)N[C@@]2(C[C@H](C)CC(C)(C)C2)C1=O	871631305	CHNNYPOGEJRZJA-IQMFZBJNSA-N	444.532	1.912	50	20	IDGD	
O=C(COC(=O)c1cccc(NC(=O)C2CC2)c1)NNC(=O)c1cccc([N+](=O)[O-])c1	899148875	WKWUXKJRJGOPLP-UHFFFAOYSA-N	426.385	1.561	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(C)c(C(=O)NNC(=S)Nc2cccc(C)c2)c1	913454545	LHTYVUMJVIMPTB-UHFFFAOYSA-N	436.559	1.860	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)CNC(=O)c1ccc([N+](=O)[O-])c(C)c1	913455171	PAHBTEMWLAOWCJ-UHFFFAOYSA-N	430.417	1.258	50	20	IDGD	
COc1ccnc(NNC(=O)[C@H]2CCCCN2S(=O)(=O)c2ccc([N+](=O)[O-])cc2)n1	914763502	SASSOWOZWAEZHR-CQSZACIVSA-N	436.450	1.080	50	20	IDGD	
Cc1[nH]c2ccc(Br)cc2c1CC(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1	915141106	CPTSYHXDBRWIHC-SNVBAGLBSA-N	428.308	1.363	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)CS(=O)(=O)c2cccc(Br)c2)c1	915595702	WQKAHVFHVUUJES-UHFFFAOYSA-N	440.319	1.750	50	20	IDGD	
Cc1ccc(O[C@@H](C)C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c(Br)c1	916144710	JYVQUVGZZSNXJZ-LBPRGKRZSA-N	445.277	1.962	50	20	IDGD	
O=C(NCCCOc1ccccc1)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	916218811	GGSAIAHUSKIQAY-UHFFFAOYSA-N	446.529	1.884	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NC[C@H](c1ccccc1)N1CCOCC1	916509521	QUCIMHRYBZFLAD-OXQOHEQNSA-N	430.480	1.997	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cc(-c3ccncc3)on2)cc1	917910998	BZZCHVDYEUNKRX-UHFFFAOYSA-N	429.458	1.127	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cccc(OCCOC)c2)c1	919684602	BGMRBQGUEVSSRY-UHFFFAOYSA-N	449.529	1.817	50	20	IDGD	
CCCS(=O)(=O)N1CCCC[C@H]1C(=O)NNC(=O)c1cc(-c2ccc(C)cc2)[nH]n1	919815594	PBYFPZJNCRUYJZ-SFHVURJKSA-N	433.534	1.740	50	20	IDGD	
N#Cc1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2ccc(Br)cc2)cc1	1115813742	STYPHVVBTKAJLS-UHFFFAOYSA-N	437.275	1.060	50	20	IDGD	
Cn1cc(N2CC[C@H](NC(=O)NNC(=O)COc3ccc(Br)cc3)C2)cn1	1116092162	BBWHTJAEOMYFSR-ZDUSSCGKSA-N	437.298	1.171	50	20	IDGD	
CC(C)c1nn([C@H]2CCS(=O)(=O)C2)cc1C(=O)NNC(=O)c1n[nH]c2c1CCCC2	1252172625	MIKFIQAQEXIHNM-LBPRGKRZSA-N	434.522	1.043	50	20	IDGD	
CC(C)(C)c1ccc(NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)nn1	1318585405	FZGIXOSUNMEOQJ-UHFFFAOYSA-N	447.561	1.871	50	20	IDGD	
CCOC(=O)[C@@H]1CN(C(=O)OC(C)(C)C)CCN1CC(=O)NNC(=O)c1cccc(C)c1	1319984349	FLLUSRRYIIIWCD-KRWDZBQOSA-N	448.520	1.240	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CC(F)(F)C(=O)O)C1	1778012333	AUCJDTVLMFERBZ-CXAGYDPISA-N	436.528	1.462	50	20	IDGD	
COCc1oncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)Br)C2	1778345102	WOSDFBCTIXOQRS-WBHUJUFNSA-N	444.326	1.732	50	20	IDGD	
O=C(c1ccc2cccnc2n1)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1778434004	UYEGIZUBJYMNAC-KSSFIOAISA-N	437.269	1.764	50	20	IDGD	
O=C(C(Cl)Cl)N1CCO[C@]2(CCN(C(=O)[C@@H]3ON=C(c4ccccc4)O3)C2)C1	1778874397	JTCVQWQNBREASD-ROUUACIJSA-N	428.272	1.355	50	20	IDGD	
CC(=O)NCC(C)(C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CO[Si](C)(C)C)C1	1779539933	TYVDMBYAJNQOFR-DYESRHJHSA-N	441.645	1.514	50	20	IDGD	
COCc1c[nH]c(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)c1	1780073462	HNVABTAKIRWQIL-UGSOOPFHSA-N	428.327	1.636	50	20	IDGD	
O=C(c1cc2ncccc2[nH]1)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781333832	SCDHUCQSSDDBHW-PBHICJAKSA-N	425.258	1.697	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)nc2nccn12	1781334124	VKENBGWXCUSBBO-DYVFJYSZSA-N	440.273	1.172	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cn1ccnc1)C2	1781900380	OIYGBZRQRJZVAN-HDMKZQKVSA-N	427.343	1.571	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(O)nn1)C2	1781901211	LVHYSVWSGJUMKR-WPKBUWHJSA-N	441.326	1.483	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cncc(N(C)C)c3)CCO2)C1	1783344004	LZNXUTHYNMEIAW-VQIMIIECSA-N	439.354	1.765	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3c(F)cncc3F)CCO2)C1	1783351315	JLPIQLMSUTZYFC-GTNSWQLSSA-N	432.265	1.977	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H]1CCc3nc[nH]c3C1)CCO2	1783355004	GVZQWZIHUIPECZ-CKFHNAJUSA-N	439.354	1.518	50	20	IDGD	
CC(C)Cc1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](C)Br)C3)C2)n(C)n1	1783532390	HOCMNWBSWQCAMX-AUUYWEPGSA-N	441.370	1.846	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)CCN3Cc4ccccc4C3=O)CCO2)C1	1783875545	RNPJAHCJYANYDF-AVRDEDQJSA-N	449.935	1.116	50	20	IDGD	
O=C(CCn1c(=O)oc2ccccc21)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21	1785194486	MOLJEFCJOHLXSH-YFPWBOGZSA-N	439.871	1.499	50	20	IDGD	
N#Cc1ccccc1OCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1785379825	VFAGXZWWQZCIED-WMZOPIPTSA-N	440.269	1.457	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)CN3C(=O)CSC3=S)C2)C1	1785540538	YFJQRFVFIVADBY-SJKOYZFVSA-N	433.983	1.084	50	20	IDGD	
C[C@@H](Nc1cccnc1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCBr)[C@H]2C1	1786405883	IGHJWNAANXVXEW-OHFALNGGSA-N	439.354	1.647	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(Cl)cc4nn[nH]c34)C[C@@H]21)[C@@H](F)Cl	1787447904	JQOSBDBBTCQEHU-ZUVQAIGSSA-N	430.267	1.739	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCC(C)C)C[C@@H]21	1787507602	IJRWUWKNHVMQQU-MPKALDKKSA-N	431.537	1.536	50	20	IDGD	
C[C@@H](Oc1cccnc1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]2C1	1788766235	XYUHHIZPOOZBRO-NEPXVJNWSA-N	435.597	1.680	50	20	IDGD	
Cn1cc(CC(=O)NC2(c3ccc(NC(=O)c4cnccc4C(=O)NN)cc3)CCC2)cn1	1789523519	FFXKYFNZGSPWAQ-UHFFFAOYSA-N	447.499	1.409	50	20	IDGD	
Cc1nn(C)c(C)c1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]2C1	1789867660	HTARWMJNGWJYLX-XLPNERPQSA-N	431.364	1.867	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccn4cncc4c3)C[C@@H]21)[C@H](F)Br	1789926071	MPTQKZYCRLBLRY-TUUVXOQKSA-N	439.285	1.618	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)ON=C(C)C)[C@H]2C1	1789957391	PZZUUMRTWKNJSF-YXMSTPNBSA-N	432.359	1.941	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CC(c4ccccc4)=NO3)C[C@@H]21)C(Cl)Cl	1791292446	DORCXIVBGREJNO-DIECFANBSA-N	440.327	1.963	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(N(C)C)c1)C2	1792872659	UJNGZNKOPKAWBB-NYCLONFESA-N	438.366	1.987	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3nn(C)cc3c1)C2	1792874117	LEWGSFPEODQIRG-PTOXDTDZSA-N	449.349	1.808	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H]1C=C[C@@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Cl)C3)C1	1793875573	GLPZTXZBEUPTRB-OWDFPOFWSA-N	445.919	1.580	50	20	IDGD	
COc1c(Cl)ccnc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCBr	1795114919	METLUOCGHMBJHQ-GNXNZQSNSA-N	446.729	1.732	50	20	IDGD	
COC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2	1795519737	OSIUBADGQJFQMX-QDMKHBRRSA-N	447.444	1.725	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cn1cncn1)[C@@H](Br)Cc1ccccc1	1796292278	GYNNYEKKGGQMNX-MHORFTMASA-N	446.349	1.923	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(N3CCOCC3)cc1)C2)[C@@H](F)Cl	1796363693	YGSFUJVRRMHYCD-CYGHRXIMSA-N	425.888	1.261	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(C)nc1O)C2	1796892082	YUJFBQQOVMWJED-MVRRYPJTSA-N	438.488	1.481	50	20	IDGD	
Cc1cn2c(=O)c(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)C(Cl)Cl)C4)cnc2s1	1797065337	SPVPFAWQUQZYBD-PEGIJTEDSA-N	445.328	1.071	50	20	IDGD	
Cc1cc(/C=C/C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)CBr)C3)no1	1797831141	HJXXMYFXVDOBGI-PGQDAVBQSA-N	426.311	1.617	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C=C/c1cc(C)on1	1797834541	NZUGLSNHVXJRKG-XZERZOKQSA-N	426.311	1.759	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc3c1NC(=O)C3)C2	1797957202	FRQFDVFJGQILOV-CCWDJLKJSA-N	431.565	1.236	50	20	IDGD	
Cn1cc2cc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@H](F)Br)ccc2n1	1799348486	JDMVNHYFBMHCSY-XRGAULLZSA-N	439.285	1.467	50	20	IDGD	
C=C(CC(=O)OCC)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](Br)CC	1800642530	NLYSTSCGCJMRST-FQLMCAECSA-N	431.327	1.259	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CNC(=O)OC(C)(C)C)C2	1800644138	JYHYVZACDGMILV-QVHKTLOISA-N	448.358	1.274	50	20	IDGD	
CCN1CCC(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C3)CC1	1804492260	XDIOBVOSUYZDJR-JAEJZPAFSA-N	442.564	1.491	50	20	IDGD	
Cc1nc(CC(=O)NC[C@@H]2CCN(C(=O)[C@H](C)Br)[C@@H]2c2cccnc2)no1	1804496587	QIDJGANLZQWEMC-PZSREKOKSA-N	436.310	1.805	50	20	IDGD	
C=CCNC(=O)/C=C\C(=O)N1CC[C@@H](CNC(=O)CCBr)[C@H]1c1cccnc1	1806337189	GTWDTXPMKPMHAH-FRWFVBGZSA-N	449.349	1.731	50	20	IDGD	
O=C(CCBr)NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1	1806340976	SNQMGIBXKFKZSW-ACJLOTCBSA-N	449.305	1.992	50	20	IDGD	
Cc1cc(C(=O)N2CCCC3(CCN(C(=O)c4cccc(B(O)O)c4)CC3)C2)cnc1C	1807367498	WXTRTUXWFDTVDU-UHFFFAOYSA-N	435.333	1.537	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC2(CCCN(C(=O)C(=O)c3ccccc3)C2)CC1	1808984291	WXBCUNHFJOZMNP-UHFFFAOYSA-N	428.533	1.474	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@H](CNC(=O)CCN2CCOC2=O)[C@@H]1c1cccnc1	1809532623	NMOHKMPRSUFXRU-PXNSSMCTSA-N	448.596	1.781	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC2(CCCN(C(=O)CN3CCOCC3)C2)CC1	1809546382	VBJUBHMKUBYXRD-MRXNPFEDSA-N	430.387	1.723	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)c3ccc(F)cn3)CC2)C1	1809967740	JIOZMUXCUXAPAZ-UHFFFAOYSA-N	425.269	1.059	50	20	IDGD	
Cc1ocnc1C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1	1810302623	LLYNFOGCTTXHEI-KXBFYZLASA-N	449.471	1.010	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)c2c[nH]c(=O)cn2)[C@@H]1c1cccnc1	1811458211	LQICQWTXFCKOCW-RBOXIYTFSA-N	434.294	1.268	50	20	IDGD	
COC(=O)C12CC(C(=O)NC[C@@H]3CCN(C(=O)[C@@H](O)CCl)[C@H]3c3cccnc3)(C1)C2	1812834024	MBZIQFIBMXUDMD-VICSCYKQSA-N	435.908	1.030	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)CCc2cnccn2)[C@H]1c1cccnc1	1813032884	GYSRMRRRZOEKRX-KPFFTGBYSA-N	431.924	1.764	50	20	IDGD	
C=CCOCCCC(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1813069539	ZRDPRNLDIMOVLB-AUSIDOKSSA-N	445.564	1.443	50	20	IDGD	
CCOC(=O)C(C)(C)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](Cl)COC)[C@H]1c1cccnc1	1814174767	YTPGWDBEHWGDLO-ULQDDVLXSA-N	439.940	1.931	50	20	IDGD	
O=C(Cc1cccs1)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1	1815339949	WOAZEVBNOCWAOB-AWEZNQCLSA-N	441.343	1.353	50	20	IDGD	
O=C(CCc1ccoc1)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1	1815361715	OUKGKWMUQPECLX-INIZCTEOSA-N	439.302	1.275	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](F)Br)CC2)c1cc(O)nc(O)c1	1816727030	CFSPNBXYPMLHHU-JMCQJSRRSA-N	445.270	1.866	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ncc[nH]1)CC2	1817277166	LRWVNFAISTUDBT-VCEHOBFASA-N	440.489	1.226	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCBr)CC2	1817297068	VDLGOSCPRHVAQV-MWLCHTKSSA-N	431.356	1.707	50	20	IDGD	
Cn1cc(F)cc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1	1817471882	TYDXNARQZBUFII-KRWDZBQOSA-N	439.256	1.187	50	20	IDGD	
CC(C)(C)OCC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1	1817474118	MOWCKDHKKPJTRQ-KRWDZBQOSA-N	428.298	1.211	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnoc2)n[nH]1	1818185180	USXLBVUSUJJGCR-SOAGAIGUSA-N	438.448	1.838	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3cnn4cccnc34)sc2C1	1818991675	NKIAQAIQWGLRAC-JQWIXIFHSA-N	434.909	1.665	50	20	IDGD	
COc1cc(C(=O)N[C@H]2CCc3nc(NC(=O)CO[Si](C)(C)C)sc3C2)n(C)n1	1820160891	JAFQPKQTFKIELV-NSHDSACASA-N	437.598	1.963	50	20	IDGD	
CCNC(=S)NCC(=O)N[C@@H]1CCc2nc(NC(=O)CO[Si](C)(C)C)sc2C1	1820168816	GYFCJSNIJGEGHQ-LLVKDONJSA-N	443.671	1.391	50	20	IDGD	
CCOC(=O)c1cc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)[C@H](O)CCl)[nH]n2)ccn1	1820297265	MYXRITFZJAEMBX-HZPDHXFCSA-N	449.895	1.887	50	20	IDGD	
Cc1ccc(CC(=O)N2CCCC[C@@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)cn1	1822410690	PLRNZEFXWSVNLC-GOSISDBHSA-N	441.536	1.721	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H]2CCCCN2C)[nH]n1	1822412164	KVRQBINAOPWIOV-SJORKVTESA-N	433.557	1.259	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H]2CCOC2)n[nH]1	1822952865	XLRNTTOZMRSKHQ-CRRXUQMMSA-N	441.492	1.572	50	20	IDGD	
Cn1cccc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1	1825761909	QJOUOEGDMSRDTP-LJQANCHMSA-N	438.532	1.571	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CN1CCSCC1)CC2	1825991450	KSFFRRZCQLUNIS-RYUDHWBXSA-N	432.999	1.358	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@H]1CCc2nc(NC(=O)[C@H]3CCNC(=O)C3)sc2C1	1826210179	NQEQJLBKSWXOMK-VWYCJHECSA-N	443.367	1.612	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H](N)CCC(N)=O)CC1	1826817968	PLXDYRVTONATQU-VNQPRFMTSA-N	445.402	1.230	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC[C@H]1C1CCN(C(=O)C23CC(F)(C2)C3)CC1	1827050346	NPVRBQIFXUHGBR-BVVFMGSASA-N	428.313	1.492	50	20	IDGD	
O=C(NCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H](O)CCl)CC1)c1ccco1	1827181845	JQIYXNGQOZVOLG-CVEARBPZSA-N	425.913	1.229	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)C2CC(F)(F)C2)CC1	1828922070	KEEQQWWWWQIZGT-SFHVURJKSA-N	449.502	1.964	50	20	IDGD	
CC(C)(C)c1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)cn1	1830720122	TUTOCOQSEGRLTN-KKSFZXQISA-N	439.940	1.049	50	20	IDGD	
C=CCNC(=O)/C=C\C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@H](Cl)COC)CC1	1831827448	YFFSDGWDWJCBAI-BTFXCVNISA-N	425.957	1.718	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)C3CCC(CO)CC3)CCO2)C1	1832514180	NEIOJXOEEMEEIW-BPZDKFOGSA-N	430.973	1.507	50	20	IDGD	
COc1cncc(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)c1	1832914898	GXGJZTVNIMZGNS-MJGOQNOKSA-N	429.876	1.014	50	20	IDGD	
COc1ccc([C@H](O)C(=O)NC2CCN(C3CCN(C(=O)[C@@H](F)Cl)CC3)CC2)cc1	1833184415	QEHLVACVAIPSPD-RBUKOAKNSA-N	441.931	1.835	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)C3(c4ccccc4)CC3)CC2)CC1)[C@@H](O)CCl	1833306412	QGUOZZZTIYIFNX-FQEVSTJZSA-N	433.980	1.890	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)COC3CCCCC3)CC2)CC1)[C@@H](O)CCl	1833306709	ZJSROMPDRUFQTR-IBGZPJMESA-N	429.989	1.507	50	20	IDGD	
CCn1nccc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1	1834418089	CNPTXSIMFUNQDR-QZTJIDSGSA-N	433.336	1.209	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](Cl)CC)CC2)CC1	1835709005	NOQTWKHOJFVITG-PBHICJAKSA-N	429.993	1.283	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3ccc[nH]3)CCO2)C1	1836018138	XBVBUZSJRYKMDP-KSSFIOAISA-N	428.327	1.187	50	20	IDGD	
COc1cnc(C(=O)N2CCC(OC3CCN(C(=O)[C@H](O)CCl)CC3)CC2)c(F)c1	1836715767	ZJTUELYCRIRIBJ-QGZVFWFLSA-N	443.903	1.441	50	20	IDGD	
Cc1nc(C)c(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)o1	1838007434	BLZIFXVJLCSJBQ-DIFFPNOSSA-N	430.299	1.145	50	20	IDGD	
CC(C)c1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)no1	1839197785	IHWUVKWXYDJVPD-RHSMWYFYSA-N	448.289	1.559	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)c(C)n1C	1839200366	JFZOWGZIMAMEEP-YJBOKZPZSA-N	446.317	1.402	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3CC=CCC3)C2)C1	1839961904	MSRUEOPKDRAXFL-GPMSIDNRSA-N	429.355	1.973	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3ccoc3)C2)C1	1839967113	AVWPELXCVRCVDF-QFBILLFUSA-N	443.338	1.842	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)cn1C	1840032806	KNQQDFFPTFEATF-RDTXWAMCSA-N	428.327	1.187	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2	1840036416	JSGBXJPVJTYMLW-MISXGVKJSA-N	442.148	1.010	50	20	IDGD	
O=C(Cc1cc(F)cc(F)c1)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840188185	UIAOATRDNJDHCD-GOSISDBHSA-N	437.270	1.767	50	20	IDGD	
O=C(c1ccn2nccc2c1)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840188606	SRJURVZFHFQIRX-SFHVURJKSA-N	427.288	1.208	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC2(CCCN2C(=O)[C@@H]2CCc3nc(O)nc(O)c3C2)C1	1842058975	OHXBVJVZBIAFJD-CYBMUJFWSA-N	434.569	1.048	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H]2CC[C@@H]1[C@@H](C(=O)N1CCCC13CN(C(=O)[C@@H](O)CCl)C3)C2	1847095154	LYPZXMPBUVPAOW-JONQDZQNSA-N	441.956	1.578	50	20	IDGD	
O=C(CCCC[C@@H]1CCSS1)NCCOCCOCCOCCOCCO	2332239864	SBWLDAYVUHENHK-QGZVFWFLSA-N	425.613	1.875	50	20	IDGD	
CSc1cccc(N2C[C@@H](C(=O)OCC(=O)NNC(=O)c3cccs3)CC2=O)c1	10265088	NLYYHFFJQUWFNJ-LBPRGKRZSA-N	433.511	1.827	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2ccc(C(=O)NNC(=O)c3ccccc3F)cc2)C[C@@H](C)O1	15991478	DLCCCJVVVZOURS-OKILXGFUSA-N	435.477	1.698	50	20	IDGD	
C[C@H]1CC(C)(C)C[C@]2(C1)NC(=O)N(CC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)C2=O	21001363	HDLBCNWSBADETQ-YUNKPMOVSA-N	431.449	1.493	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)[C@H](NS(=O)(=O)c2ccc3c(c2)OCCCO3)C(C)C)n1	22233990	GDCSCZXDQVPMIX-GOSISDBHSA-N	449.533	1.701	50	20	IDGD	
Cc1c(C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)nnn1-c1cccc([N+](=O)[O-])c1	24490248	VUZUKCSJNXLECK-GFCCVEGCSA-N	428.380	1.852	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)/C(C#N)=C/c2cc(C#N)n(C)c2C)c2ccccc2c1=O	25672733	ZSHSIRSRLJSLSD-MHWRWJLKSA-N	443.467	1.693	50	20	IDGD	
O=C(NNC(=O)c1ccn(-c2ccccc2)n1)c1ccc(S(=O)(=O)N2CCCC2)cc1	31482305	MOKPSLQVEVNJPU-UHFFFAOYSA-N	439.497	1.732	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)CCNS(=O)(=O)/C=C\c1ccccc1	207040354	BVFZPGCFHKZZBX-OWBHPGMISA-N	433.486	1.202	50	20	IDGD	
CCN1C[C@H](CN(C)C(=O)NNC(=O)CNC(=O)c2cccs2)Oc2ccccc21	725872543	QNFPQMVSFDNDNW-AWEZNQCLSA-N	431.518	1.438	50	20	IDGD	
COc1cc(OC)c(N)c(C(=O)OCC(=O)NNC(=O)c2cc(Cl)ccc2OC)c1	726207000	GDSVPXRMJSSYGV-UHFFFAOYSA-N	437.836	1.566	50	20	IDGD	
O=C(CSC[C@H]1CCCCO1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	727293052	HLORGLMPVZTNSS-MRXNPFEDSA-N	441.575	1.534	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNS(=O)(=O)c1cc(F)ccc1C(=O)OC	727350855	WTZVMVKFFWFHPF-UHFFFAOYSA-N	426.422	1.400	50	20	IDGD	
Cc1noc(C)c1S(=O)(=O)N1CCC(C(=O)NN=c2sc3ccccc3n2C)CC1	727939469	OHQNCXVVIYCYKG-UHFFFAOYSA-N	449.558	1.877	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)c2sccc2S(=O)(=O)NCc2ccco2)c1	728870743	AUWZZTKOAIAFEO-UHFFFAOYSA-N	430.467	1.766	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)c1cn(-c2ccccc2)nc1-c1cccs1	729275078	KLORTDVSRVORLH-GFCCVEGCSA-N	433.515	1.300	50	20	IDGD	
O=C(CC1(CC(=O)Nc2nccs2)CCCCC1)NNC(=O)[C@H]1CCS(=O)(=O)C1	730273601	ZNDMEUQHTDTDGS-ZDUSSCGKSA-N	442.563	1.394	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2cccc(Br)c2O)n1	730365751	PZENGOGXCFBKMI-UHFFFAOYSA-N	428.264	1.467	50	20	IDGD	
CCn1c(=O)nc(O)c2c(C(=O)NNC(=O)Cc3ccccc3F)cc(C(C)C)nc21	731344440	JLTUZHXTQSBDPG-UHFFFAOYSA-N	427.436	1.783	50	20	IDGD	
COc1ccc([N+](=O)[O-])cc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)C2CCC2)c1	732140960	CJNBLOOMGDWPCV-UHFFFAOYSA-N	448.457	1.965	50	20	IDGD	
COCCOc1cn(-c2ccccc2)nc1C(=O)NNC(=O)CCN1C[C@H](C)O[C@@H](C)C1	732264665	WFRWWURVAITTDX-IRXDYDNUSA-N	445.520	1.158	50	20	IDGD	
COc1ccc([C@]2(C)NC(=O)N(CC(=O)NNc3ccc(Br)nc3)C2=O)cc1	732838565	HAJBSWYEGFIMQM-SFHVURJKSA-N	448.277	1.763	50	20	IDGD	
COC[C@@H](C)n1c(C)cc(/C=C(/C#N)C(=O)NS(=O)(=O)CCCC(=O)OC)c1C	734087818	CLIQCFXVCXWNLR-AYCSXLNKSA-N	425.507	1.619	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)c1	735117598	YWJDSVMLYZCUIV-UHFFFAOYSA-N	433.534	1.157	50	20	IDGD	
C[C@@H](CN1CCN(c2ccccn2)CC1)NC(=O)NNC(=O)[C@H](C)Oc1ccc(F)cc1	735585557	GBTJYNPFGKNYFQ-IRXDYDNUSA-N	444.511	1.529	50	20	IDGD	
O=C(CNC(=O)c1ccc(Br)s1)NNC(=O)COCc1ccccc1	738545494	GQVFWLUUHBKSKX-UHFFFAOYSA-N	426.292	1.605	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)N[C@@H](C)[C@@H]2CN(Cc3ccccc3)CCO2)c1	741268242	WCWISMRKFPUVCH-RXVVDRJESA-N	426.517	1.994	50	20	IDGD	
CC(C)(C)OC(=O)N(CC(=O)NNC(=O)CNC(=O)c1cccs1)C[C@H]1CCCO1	741921810	YFIYRBBBMRSGFD-CYBMUJFWSA-N	440.522	1.041	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)CN1C(=O)[C@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O	742481273	RCCZNGFGNIAHDQ-VDERGJSUSA-N	440.481	1.042	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)Cc2ccc(C(=O)NNC(=O)c3ncccn3)cc2)cc1	743289174	OOKMIHCZYCNJLE-UHFFFAOYSA-N	439.497	1.681	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)[C@@H](C)NC(=O)c2cc3c(C)nn(C)c3s2)cc1	743293477	AAVWPMZMDMXAEK-CYBMUJFWSA-N	428.518	1.629	50	20	IDGD	
CC[C@H](NC(=O)NNC(=O)Nc1ccc(N(C)C)cc1)c1cccc(S(N)(=O)=O)c1	743592926	OTVKCYYPPLFNCL-KRWDZBQOSA-N	434.522	1.887	50	20	IDGD	
C#Cc1cccc(NC(=S)NNC(=O)c2ccc(S(=O)(=O)CC(=O)N(C)C)cc2)c1	743821138	WPHIYABCRJQPNG-UHFFFAOYSA-N	444.538	1.161	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)CN2C(=O)c3ccccc3C2=O)cc1Cl	743833746	FEPCHCGXICXYLB-UHFFFAOYSA-N	432.820	1.806	50	20	IDGD	
COC[C@@H](C)n1c(C)cc(/C=C(/C#N)C(=O)OCCNS(=O)(=O)c2cnn(C)c2)c1C	744459965	HISGBUOHGDKFOI-FNMPFJKNSA-N	449.533	1.475	50	20	IDGD	
Cc1ccc([C@@H](CNC(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)N2CCOCC2)cc1	745682822	RVSBVPARUOOSDS-GOSISDBHSA-N	443.460	1.626	50	20	IDGD	
O=C(NCCc1ccn(-c2ccc(F)cc2)n1)NNC(=O)c1cc([N+](=O)[O-])ccc1O	745892104	MHRNXTUMPOHTKB-UHFFFAOYSA-N	428.380	1.812	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCCCCC2)cc1)NNC(=O)N1CCOCC1	745993002	RNOHXPYAPGUUGC-UHFFFAOYSA-N	438.550	1.257	50	20	IDGD	
CN1CCN(Cc2cccc(C(=O)NNc3ccc(S(=O)(=O)NC4CC4)cc3)c2)CC1	746200316	HRMVKUKXXKJQRP-UHFFFAOYSA-N	443.573	1.632	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(C(=O)NNC(=O)Cc2ccncc2)ccc1Br	747323367	XOFHIRFETBAMGF-UHFFFAOYSA-N	441.307	1.098	50	20	IDGD	
C=CCn1c(=O)c2ccccc2n2c(SCC(=O)NNC(=O)Cc3ccncc3)nnc12	747429479	MVNBEHBTSFQEJB-UHFFFAOYSA-N	449.496	1.107	50	20	IDGD	
Cc1cc(S(=O)(=O)NNC(=O)c2ccc(Cl)nc2)ccc1OCCCC(=O)O	747605761	AKUZXRLSPQZDMP-UHFFFAOYSA-N	427.866	1.910	50	20	IDGD	
COc1ccc(Br)c(S(=O)(=O)NNC(=O)CNC(=O)c2cccs2)c1	747612368	QPSWRBMLZOQIOF-UHFFFAOYSA-N	448.320	1.259	50	20	IDGD	
COc1cc(CNC(=O)NNC(=O)C(=O)N2CCCC2)ccc1OCc1ccccc1	748445652	DVSCCFDVEBWGCM-UHFFFAOYSA-N	426.473	1.727	50	20	IDGD	
O=C(CSCC(=O)N1CCOCC1)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1	748512324	PKJPBPXIFBQRHO-UHFFFAOYSA-N	441.453	1.015	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNc3cccc4cnccc34)CC2)cc1	748759410	QHXNSLZOOODUBF-UHFFFAOYSA-N	439.541	1.993	50	20	IDGD	
CCc1ccccc1OCC(=O)NNS(=O)(=O)c1ccc(OCC(=O)O)c(F)c1	751260785	GGGNMJWZQYEZNK-UHFFFAOYSA-N	426.422	1.240	50	20	IDGD	
Cn1cc(CC(=O)NNC(=O)c2cccc(S(=O)(=O)Nc3ccccc3Cl)c2)cn1	751281848	VRFYVXFJOLEONI-UHFFFAOYSA-N	447.904	1.878	50	20	IDGD	
COc1cccc(-c2nc(C)c(C(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)[nH]2)c1	755406947	FTVVJELPYXNPDC-UHFFFAOYSA-N	432.440	1.715	50	20	IDGD	
CC(=O)Nc1ccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1	755493651	DAIFWFDJKWZEMU-UHFFFAOYSA-N	445.501	1.896	50	20	IDGD	
O=C1CSc2ccc(NC(=O)NNC(=O)C3CCN(c4ncccn4)CC3)cc2N1	755550406	JSLMLESDEIIYQP-UHFFFAOYSA-N	427.490	1.590	50	20	IDGD	
CC(=O)Nc1ccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1C	755635959	SKEYKQOQBUPKCI-UHFFFAOYSA-N	433.490	1.670	50	20	IDGD	
C#CCOc1ccc(F)cc1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	756756101	FEALPNUBUHUUOW-UHFFFAOYSA-N	434.449	1.555	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)N[C@@H]1CCN(c2ccccc2OC)C1=O	756917265	VDCQRWIOGCZKEZ-CQSZACIVSA-N	428.445	1.219	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cn1C	757594150	PKHQRJSXRAKIDJ-UHFFFAOYSA-N	442.520	1.567	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)Nc2cc(Br)c(=O)n(C)c2)c1	757689272	KAGRVLATLWUYNS-UHFFFAOYSA-N	425.239	1.632	50	20	IDGD	
CNC(=O)Cn1nc(NC(=O)NNC(=O)CCCOc2ccc(Cl)cc2C)cc1C	757823459	QWWNZJKUFDVMQH-UHFFFAOYSA-N	436.900	1.911	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)Nc2c(C)nn([C@H]3CCS(=O)(=O)C3)c2C)cc1	757870838	AMMSGKOYQRBBHU-INIZCTEOSA-N	449.533	1.654	50	20	IDGD	
CN(C)N(C(=O)[C@@H]1CN(C(=O)OC(C)(C)C)CCC1(F)F)[C@H]1CCS(=O)(=O)C1	757871590	OOABTHARQBPVDT-STQMWFEESA-N	425.498	1.371	50	20	IDGD	
COc1cc(C(=O)N2CCN(S(=O)(=O)CBr)CC2)cc2c1O[C@H](C)C2	758535182	MWUUURISFVTRSM-LLVKDONJSA-N	433.324	1.459	50	20	IDGD	
CC(=O)N[C@@H](C(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1)C1CCCC1	758785781	FVSFRFNGNJRMIP-MRXNPFEDSA-N	425.530	1.317	50	20	IDGD	
C[C@H](NC(=O)OC(C)(C)C)[C@@H]1CCCN(CC(=O)NNC(=O)c2cccc(C#N)c2)C1	758791710	JBRXWAVOJHYCAQ-MAUKXSAKSA-N	429.521	1.944	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)NC[C@@H]2CC(=O)N(Cc3ccccc3)C2)cc1C	759683582	OJVKMGJSFXWNBH-SFHVURJKSA-N	437.500	1.621	50	20	IDGD	
COc1ccc2c(c1)OC[C@@H]2CC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	760222732	BBGAGHPBAHBMSP-SFHVURJKSA-N	438.528	1.921	50	20	IDGD	
C[C@H](CC(=O)NNC(=O)Cc1ccc(Cl)cc1)NS(=O)(=O)c1cccnc1Cl	760300757	HKLLVQCLYPSVBI-LLVKDONJSA-N	445.328	1.835	50	20	IDGD	
Cc1csc([C@@](O)(CC(=O)NNC(=O)CCNC(=O)OC(C)(C)C)C(F)(F)F)n1	760437910	LRIQNWWRQCBBNX-HNNXBMFYSA-N	440.444	1.654	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COc2ccc(F)cc2)nc1I	761135962	QKMOPNSUTBGBSY-UHFFFAOYSA-N	445.188	1.674	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C1=NN(c2ccccc2)C(=O)[C@@H](C)N1	762404797	MDMITFSKZBOTKQ-CYBMUJFWSA-N	427.486	1.273	50	20	IDGD	
Cc1c(C(=O)NNc2nccc(N3CCOCC3)n2)nnn1-c1ccc(OC(C)C)cc1	762863159	YZCWFNLMAFPBPK-UHFFFAOYSA-N	438.492	1.746	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	763320655	FLCFWBVXPDRMFX-HNNXBMFYSA-N	430.486	1.427	50	20	IDGD	
O=C(NNC(=O)c1ccccc1O)C(=O)Nc1ccc(N2CCOCC2)c2ccncc12	763527859	LJWBECUPBYWZLY-UHFFFAOYSA-N	435.440	1.177	50	20	IDGD	
O=C(NNC(=O)c1ccccc1O)C(=O)Nc1cccc(N2C(=O)c3ccccc3C2=O)c1	763527893	LPPOKDUEDYTSAG-UHFFFAOYSA-N	444.403	1.593	50	20	IDGD	
O=C(NNC(=O)c1cc2ccccc2cc1O)C(=O)Nc1cnn(Cc2ccncc2)c1	763528480	TYZVTLVLYVDPHH-UHFFFAOYSA-N	430.424	1.585	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)[nH]n1)C(=O)Nc1cnn(Cc2ccncc2)c1	763604875	OSSNEFSGULJOMU-UHFFFAOYSA-N	430.428	1.116	50	20	IDGD	
Cc1ccc(C(N)=O)cc1NC(=O)C(=O)NNC(=O)COc1cccc(C(F)(F)F)c1	763639032	JGDVVQWEIIYSPL-UHFFFAOYSA-N	438.362	1.278	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc3c(c2)OC2(CCCC2)O3)cc1	763659327	MGPQYYZKGCYPKM-UHFFFAOYSA-N	441.440	1.902	50	20	IDGD	
COC(=O)c1cc(F)c(F)cc1NC(=O)C(=O)NNC(=O)COc1ccccc1F	763678805	JTYYKJVTJURHTH-UHFFFAOYSA-N	425.319	1.055	50	20	IDGD	
CS(=O)(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)COc2ccccc2F)c1	763680898	CKWFLASFQLKWFX-UHFFFAOYSA-N	443.840	1.048	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2cc(C)n(-c3ccc(C)cc3)n2)c1	763774887	IQHVPHBRAKLYKY-UHFFFAOYSA-N	437.456	1.906	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(C)c2C(=O)N2CCCC2)cc1	763809844	REJCYEKWYBFVSZ-UHFFFAOYSA-N	438.484	1.704	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(C)cc2OCCN(C)C)cc1	763821954	TVDLHEQCJZDXMD-UHFFFAOYSA-N	428.489	1.409	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)NC(=O)CO3)c1C	763847277	AKDDPHZVEAEFFD-CYBMUJFWSA-N	426.429	1.188	50	20	IDGD	
COC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(C(C)=O)cc2)c1	763870669	BNONKEHKOCQHAP-ZDUSSCGKSA-N	442.428	1.621	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)C(=O)Nc1ccccc1OC1CCCC1	763921602	MGJLQEGETVGXND-UHFFFAOYSA-N	435.444	1.383	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)n(-c2ccccc2)n1	763998148	MNABMCKWEXXBRA-UHFFFAOYSA-N	431.250	1.671	50	20	IDGD	
COC(=O)c1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)c1ccc2c(c1)OCCO2	764005587	CAGVXFQSDJNODG-UHFFFAOYSA-N	433.804	1.298	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1nc(-c2nccn2C)cs1	764011364	GGUNXRUAIZBQJR-UHFFFAOYSA-N	434.865	1.605	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)on1)C(=O)Nc1cccc(N2CCCC2=O)c1	764017555	ZLDJMDYLNJPBLW-UHFFFAOYSA-N	433.424	1.868	50	20	IDGD	
CNC(=O)[C@@H]1CN(C(=O)C(=O)NNC(=O)Cc2cccc3ccccc23)c2ccccc2O1	764020046	UASMPGDAAWLBPC-FQEVSTJZSA-N	446.463	1.070	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc(N2CCCN(C)CC2)cc1	764048708	SKLFPKJLDNHQDX-UHFFFAOYSA-N	425.489	1.237	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccccc2Br)c1	764084200	FNPXTHZEALIKOM-UHFFFAOYSA-N	440.275	1.252	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)N3CCCC[C@@H]3C)c(Cl)c2)n[nH]1	764109399	SYQKYQGZCWZTRF-LBPRGKRZSA-N	446.895	1.786	50	20	IDGD	
CC(C)(C)OC(=O)Cc1ccccc1NC(=O)C(=O)NNC(=O)[C@@H]1Cc2ccccc2O1	764162314	CBSWXUFCUCGERE-SFHVURJKSA-N	439.468	1.660	50	20	IDGD	
C[C@@H](C(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2cccc(C#N)c2)c1)n1cccn1	764233254	VMWNJJZGEDWECI-AWEZNQCLSA-N	445.439	1.354	50	20	IDGD	
COc1ccc(OC)c(NC(=O)C(=O)NNC(=O)c2cc(Br)ccc2O)c1	764277376	LHXSFTDOAWFRKI-UHFFFAOYSA-N	438.234	1.572	50	20	IDGD	
O=C(Cc1cc[nH]n1)NNC(=O)C(=O)Nc1ccc(OC(F)F)c(Cc2ccccc2)c1	764286513	WOBKJEJDBARMDA-UHFFFAOYSA-N	443.410	1.931	50	20	IDGD	
COCCCOc1cccc(NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)c1	764383058	VKXHTWKUOJVGTF-UHFFFAOYSA-N	443.485	1.953	50	20	IDGD	
Cc1nccn1-c1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)cn1	764389081	YFFKVTGFHHTZGV-UHFFFAOYSA-N	448.418	1.505	50	20	IDGD	
Cc1cc(C(=O)NC(C)C)ccc1NC(=O)C(=O)NNC(=O)CSc1ccccc1O	764394996	YBKHQPKYLFELNA-UHFFFAOYSA-N	444.513	1.717	50	20	IDGD	
CS(=O)(=O)c1c(Cl)cccc1NC(=O)C(=O)NNC(=O)c1ccc(Cl)cc1F	764410253	BUCNLYMGRWBSAP-UHFFFAOYSA-N	448.259	1.936	50	20	IDGD	
C[C@@H](NC(=O)c1n[nH]c2ccccc12)C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C	765317033	IVRWNCRWGXURTQ-GFCCVEGCSA-N	432.481	1.134	50	20	IDGD	
COc1ccc([N+](=O)[O-])cc1C(=O)NNC(=O)CN1CCN(Cc2ccc(C)cc2)CC1	765747854	IROCWQPCPXCYLJ-UHFFFAOYSA-N	441.488	1.491	50	20	IDGD	
C[C@H](Oc1cccnc1)C(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	765758774	QGLCZEAZZYHSIY-INIZCTEOSA-N	431.924	1.468	50	20	IDGD	
CC[C@H]1CCCC[C@@H]1OCC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1	766339064	NADILMITTFPLBO-WMZOPIPTSA-N	425.551	1.748	50	20	IDGD	
CCOC1CC(CNC(=O)NNC(=O)Cn2ccc3ccccc32)(N2CCOCC2)C1	767802132	LHASHOZOWBMGHO-UHFFFAOYSA-N	429.521	1.242	50	20	IDGD	
O=S(=O)(CBr)N1CCN(S(=O)(=O)c2cc(F)cc(Cl)c2)CC1	767848521	APFIXHYZFVFGKG-UHFFFAOYSA-N	435.724	1.468	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)[C@@H]1CC(c2ccccc2[N+](=O)[O-])=NO1	768641594	SZKGRPYODRRSKD-HNNXBMFYSA-N	434.430	1.643	50	20	IDGD	
CCOC(=O)c1n[nH]c(C2CCN(CC(=O)NNC(=O)c3ccccc3Cl)CC2)n1	770034639	SHJRLTNKXXHJRV-UHFFFAOYSA-N	434.884	1.275	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)C[C@@H](O)c2ccc(Cl)cc2)c1	772557177	DIJWXZQAXMYAIZ-MRXNPFEDSA-N	425.894	1.475	50	20	IDGD	
COC[C@H](NC(=O)NNC(=O)c1csc(N2CCOCC2)n1)c1ccc(F)c(F)c1	773451515	ZPENZWUAJCFDTC-AWEZNQCLSA-N	441.460	1.590	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])cnn1C1CCCC1	773526202	XWYDGKJDEIFXFW-UHFFFAOYSA-N	430.421	1.380	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(CN3CCN(C)CC3)c2)cc1F	773889167	NDCVNASHJVCVSX-UHFFFAOYSA-N	427.480	1.281	50	20	IDGD	
CCc1cnccc1[C@@H](C)NC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1	774327921	FHXAIOQYXYQITQ-OAHLLOKOSA-N	433.534	1.665	50	20	IDGD	
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC[C@@H](C(=O)NNc2ccc(C(F)(F)F)cn2)C1	775265061	SFMDNQLYCJTKJK-GFCCVEGCSA-N	446.455	1.984	50	20	IDGD	
CO[C@@H]1CCC[C@@H]1CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	775459770	PDDVJIJQBJVTJA-SJLPKXTDSA-N	438.550	1.620	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)Nc2ccc(C[C@H]3NC(=O)NC3=O)cc2)cc1OC	775704868	HLILCYIRVAENGW-OAHLLOKOSA-N	441.444	1.311	50	20	IDGD	
CN(NC(=O)c1csc(S(C)(=O)=O)c1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776213997	SFNCXRUOBLMZMS-UHFFFAOYSA-N	446.551	1.401	50	20	IDGD	
CC1CCC2(CC1)OC[C@@H](CNC(=O)NNC(=O)C1CCN(c3ncccn3)CC1)O2	776907273	LCGSKWNQMZURNO-FIWNRLKKSA-N	432.525	1.345	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CN2CCNC(=O)[C@H]2c2cccc(Br)c2)c1	777717620	WGLIYIQWRDXCQO-GOSISDBHSA-N	445.317	1.692	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)[C@@H](C)NC(=O)c2cc3c(C)nn(C)c3s2)nc1C	778425608	UXCABOIEXPWUNV-LLVKDONJSA-N	445.505	1.480	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)c(O)c1O	780982463	GRMPCNPYXAJJKG-UHFFFAOYSA-N	432.908	1.638	50	20	IDGD	
Cc1cc2ccccc2nc1NNC(=O)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(F)cc1	781001072	YNITZLVFHUEOBZ-APWZRJJASA-N	444.488	1.950	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)[C@@H]1C[C@@]12CCN(C(=O)OC(C)(C)C)C2	781281963	MDHIZFRSPYQNIA-GAJHUEQPSA-N	445.516	1.875	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)c(OC)c1	782121275	NNXJVMRTOGGZTC-UHFFFAOYSA-N	437.412	1.272	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)NCc2cccc(S(=O)(=O)N(C)C)c2)c1C	782770583	SZTZHKCAAWYZSJ-MRXNPFEDSA-N	448.545	1.852	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)cc1)C(=O)Nc1ccc(C(=O)N2CCc3ccccc32)cc1	782833992	ODDFZENCQXAJAU-UHFFFAOYSA-N	444.447	1.995	50	20	IDGD	
Cc1cccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)c1Cl	783264339	MZXYVRPQYDKSLP-UHFFFAOYSA-N	425.898	1.812	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)CCC(=O)c2ccc(OC)c(OC)c2OC)c1O	784623914	BCTURYLLGQZUMB-UHFFFAOYSA-N	432.429	1.851	50	20	IDGD	
CC(C)(C)c1nsc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)n1	784834160	XIRVJTIIKJJUFO-UHFFFAOYSA-N	433.462	1.914	50	20	IDGD	
Cc1cc(C(=O)NC2CCCCC2)ccc1NC(=O)C(=O)NNc1nccn(C)c1=O	785085800	GBWDYEXBUHGGBY-UHFFFAOYSA-N	426.477	1.233	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)[C@@H](CC(N)=O)NC(=O)c2ccccc2Cl)c1	786085739	JTDGDRCGKDPJKO-QGZVFWFLSA-N	446.891	1.157	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)C(C)(C)S(=O)(=O)C3CC3)n[nH]2)cc1OC	786481168	AMGULQLVWKEEID-UHFFFAOYSA-N	436.490	1.211	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)[C@H](C)[C@@H](C)S(C)(=O)=O)c2ccccc2c1=O	788266541	XERBFJVUBLDQHO-ZIAGYGMSSA-N	436.534	1.417	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2nnc(O)c3ccccc23)c(C)cc1C	788330040	BHQSMRWGZAJGQK-UHFFFAOYSA-N	437.412	1.139	50	20	IDGD	
O=C(NNc1nc2ccccn2n1)c1c[nH]c2ccc(I)cc2c1=O	791253286	SIZTVFNQUWQFLU-UHFFFAOYSA-N	446.208	1.932	50	20	IDGD	
O=C(NNc1ccc2c(=O)[nH]ccc2c1)C(=O)Nc1ccc(S(=O)(=O)NC2CC2)cc1	793068791	DJGIXIMLRXLIPF-UHFFFAOYSA-N	441.469	1.051	50	20	IDGD	
CCCNC(=O)[C@H]1CN(C(=O)C(=O)NNc2ccc3c(=O)[nH]ccc3c2)c2ccccc2O1	793069836	JZSFFBQYRBVGQN-LJQANCHMSA-N	449.467	1.292	50	20	IDGD	
COc1ccc(C)cc1N1C[C@@H](C(=O)NNc2ccccc2S(=O)(=O)N(C)C)CC1=O	795181526	MYVYRJQZJCPFTL-HNNXBMFYSA-N	446.529	1.750	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)C2(c3cncc(Br)c3)CC2)cc1	799521763	QXWSIBQOFNVARB-UHFFFAOYSA-N	443.257	1.752	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)NCCS(=O)(=O)CCc2ccccc2)c1	800064946	CWXUKFJVFGPJMU-UHFFFAOYSA-N	435.502	1.305	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)c2nnn(CCOc3ccc(F)cc3)c2C)cc1	800315661	AAZWXCBTNVRYSX-UHFFFAOYSA-N	427.436	1.953	50	20	IDGD	
COCCn1cc(CNC(=O)NNC(=O)c2cc(OC)ccc2Br)cn1	800734833	ZHPSEWLSEZNUGA-UHFFFAOYSA-N	426.271	1.445	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)N[C@H]1CCCN(C(=O)Cc2ccccc2)C1	801005967	OVYURJMFLBZQOL-INIZCTEOSA-N	443.529	1.042	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2CCCN(C(=O)c3ccc4n[nH]cc4c3)C2)cc1	801107133	MTHVHAFTTPMJEP-INIZCTEOSA-N	448.483	1.510	50	20	IDGD	
C[C@@H](CCNS(=O)(=O)c1ccccc1)NC(=O)NNc1ccccc1S(C)(=O)=O	801797543	JJIJYVVZRMEGHK-AWEZNQCLSA-N	440.547	1.473	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H]1CCC[C@@H]1C(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	802067682	KABIPEXKVBMGBM-GJZGRUSLSA-N	440.522	1.936	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)Nc2ccc3c(c2)OCO3)c1	802103707	YMLHRLDCJYTGTJ-UHFFFAOYSA-N	438.437	1.708	50	20	IDGD	
CCN1CCN(CC(=O)NNc2ccc(-c3cccc(C(F)(F)F)c3)nn2)C(=O)C1=O	804209338	VWMCAOGGXONOJE-UHFFFAOYSA-N	436.394	1.296	50	20	IDGD	
N#Cc1ncn(CCNC(=O)NNC(=O)[C@@H]2Cc3ccccc3CN2Cc2ccccc2)n1	805029578	MRKROAOIQSYEOM-FQEVSTJZSA-N	444.499	1.107	50	20	IDGD	
CNS(=O)(=O)c1cc(NC(=O)NNC(=O)CSc2ccccc2OC)ccc1F	806546144	JLZPIUTZGHFWSX-UHFFFAOYSA-N	442.494	1.687	50	20	IDGD	
Cn1[nH]cc2c(=NC(=O)C(=O)NNc3c(F)cc(F)cc3Br)ccnc1-2	807017360	JPLSMMAMNVFESZ-UHFFFAOYSA-N	425.193	1.464	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)c1cc(S(=O)(=O)N2CCC2)ccc1Cl	807370917	YFDUBSYPXOURDQ-UHFFFAOYSA-N	433.914	1.285	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NC(C3CCC3)C3CCC3)nc2)CC1	807542877	GBULOTXAJMRXDD-UHFFFAOYSA-N	436.582	1.613	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)N[C@@H]2CCC[C@@H]3CN(C(C)=O)C[C@H]32)cc1	812433239	IWTYXCIJSZVQNV-BGRCLHOASA-N	432.521	1.830	50	20	IDGD	
Nc1nc2c(s1)C(=NNC(=O)c1cccc(S(=O)(=O)N3CCOCC3)c1)CCC2	814688994	RGDYVDNBOCYNAD-UHFFFAOYSA-N	435.531	1.217	50	20	IDGD	
COc1ccccc1-c1ncc(C=NNC(=O)Nc2ccc(S(N)(=O)=O)cc2)cn1	814965526	NUEVZYNIUPGLKC-UHFFFAOYSA-N	426.458	1.955	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNc2ccc(S(C)(=O)=O)cc2)cc1)C1CC1	815586007	XIEUKDYNZVAMQW-UHFFFAOYSA-N	430.486	1.687	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)CN1C(=O)C(F)(F)Oc2ccccc21	816134417	BOSVJSWIUYHFCQ-UHFFFAOYSA-N	441.412	1.560	50	20	IDGD	
O=C(CCCCC/N=C1/NS(=O)(=O)c2ccccc21)NNC(=O)CNc1ccccc1	823327758	DKLBUUUVFOSANX-UHFFFAOYSA-N	443.529	1.545	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNS(=O)(=O)c2cccc(S(C)(=O)=O)c2)cc1	903939369	PZABUDUIHKCYLC-ZDUSSCGKSA-N	442.515	1.266	50	20	IDGD	
CNS(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)c2cc(C)nc3ccccc23)cc1	906372089	BLAYBXQCJYVITR-UHFFFAOYSA-N	434.499	1.075	50	20	IDGD	
CCCn1c(C)cc(/C=C(\C#N)C(=O)N(CC)CC(=O)N[C@H]2CCS(=O)(=O)C2)c1C	912663583	JUGPCUKJIVQCHC-MVDPLZLPSA-N	434.562	1.574	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)[C@@H]3CCC(=O)N3)c3ccccc3n2)cc1OC	912913665	UVWVBNQETDMYAF-KRWDZBQOSA-N	434.452	1.959	50	20	IDGD	
CC(C)c1c(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)cnn1-c1ccccn1	915045988	PMZLRBRDZRBTNW-UHFFFAOYSA-N	441.517	1.759	50	20	IDGD	
CC(=O)Nc1ccc(NC(=S)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1	915117560	MSWJSXHMBGLOGE-UHFFFAOYSA-N	449.558	1.592	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)[C@H](Cc2ccc(F)cc2)n2nnnc2C)c1	915695591	VDHGKNFFYXEGRJ-IBGZPJMESA-N	426.452	1.748	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)NC[C@H]1CN(Cc2ccccc2)CCO1	915893863	CTFPLPFPCRDWPD-IBGZPJMESA-N	442.516	1.696	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)N1CCc2ccccc21	916622799	LXIDYDZUPUIVCF-OAHLLOKOSA-N	445.545	1.332	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)CNC(=O)NC1CCCCC1	917922290	OZUWAMGCOZYDRF-GFCCVEGCSA-N	441.326	1.996	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)OCC(=O)NCC(=O)NC(C)(C)C)c(C)n1C[C@H]1CCCO1	918952882	NSQOAPXJPWPZBU-SZVPOVDMSA-N	444.532	1.765	50	20	IDGD	
CNS(=O)(=O)c1ccc([C@H](C)NC(=O)NNC(=O)c2ccc(OC)c(OC)c2)cc1	919779709	WBHPFKGFMCHHOY-LBPRGKRZSA-N	436.490	1.317	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)Nc2ccc(CN3C(=O)CNC3=O)cc2)c1	920930219	BGFMKEOJQAASAL-UHFFFAOYSA-N	425.445	1.587	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2ccc(-n3ccnc3)cc2)c1	921244484	HIWKSWATDZLQOJ-UHFFFAOYSA-N	442.501	1.267	50	20	IDGD	
CC(C)NC(=S)NNC(=O)c1cc(S(=O)(=O)N(C)C)ccc1N1CCCCC1	1317723478	IJIRFRPCZFCWAY-UHFFFAOYSA-N	427.596	1.445	50	20	IDGD	
COCCN1C(=O)c2ccc(C(=O)NNC(=O)c3ccccc3Cl)cc2S1(=O)=O	1321736740	MKXJCBPTOWTUKR-UHFFFAOYSA-N	437.861	1.206	50	20	IDGD	
Cn1c(C(=O)O)cc(Br)c1C=NNC(=O)NCCNC(=O)OC(C)(C)C	1322944098	MJYCLVDNRDJHGH-UHFFFAOYSA-N	432.275	1.644	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)[C@@]3(F)CCOC3)c2)c(C)c1	1326644782	SKVFBFIICFPVEV-HXUWFJFHSA-N	435.477	1.994	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1cc(C(C)(C)C)nn1Cc1ccccc1	1342389227	SELSKQKAVHMRBH-CYBMUJFWSA-N	436.538	1.319	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnc4ccccn34)C2)C1	1777818017	SQYCJOMEPUYVNB-AUUYWEPGSA-N	435.322	1.809	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CC(F)(F)C(=O)O)C1	1778014852	USHKASZGLITCMV-FIXISWKDSA-N	441.269	1.394	50	20	IDGD	
Cc1nc[nH]c1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)CBr)C2	1778253877	HIBJZUOMUUIVHI-RVZJWNSFSA-N	427.343	1.877	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)Cc3ccc4c(c3)CCCO4)C2)C1	1778270094	NRLVNZSIBBYWHM-XMSQKQJNSA-N	436.936	1.638	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](C)n3ccccc3=O)C2)C1	1779265582	WVXURZIYMLZVJQ-ZRGWGRIASA-N	440.338	1.270	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(N(C)C)nc3)C2)C1	1779764577	JRUKNZFDIJIFRW-FZKQIMNGSA-N	425.327	1.375	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccnc4c3OCO4)C2)C1	1780030786	ZWKWIZBRVKJYKW-ACJLOTCBSA-N	440.294	1.427	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CNC(=O)c1ccco1)C2	1780702414	QWKOQQCGUMMRDU-YYFZDKIDSA-N	425.913	1.541	50	20	IDGD	
C[C@@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@](C)(Cl)CCl)C1)n1ccnn1	1780716452	IQNUCPUXUCDWGX-IHETXDGRSA-N	432.352	1.589	50	20	IDGD	
CCc1[nH]nc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](F)Br)C2)c1F	1780770911	JLYUVLQJSGJAHK-HYSWKAIVSA-N	449.296	1.929	50	20	IDGD	
CN(CC(=O)N1CC[C@@]2(C1)CN(C(=O)C(C)(C)C)CCO2)NC(=O)NCc1ccccc1	1780968588	BYZAHLBATHHVTM-HSZRJFAPSA-N	445.564	1.209	50	20	IDGD	
CC(=O)N[C@H](C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@](C)(Cl)CCl)C2)C1)C(C)(C)C	1781225096	DKPVJJNIZFWSJV-CCKFTAQKSA-N	436.380	1.603	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)c3nn[nH]c3C(F)(F)F)CCO2)C1	1781232047	SMKKJKIEKOFSDA-KGLIPLIRSA-N	444.241	1.503	50	20	IDGD	
CCOC(CC(=O)N1CCO[C@]2(CCN(C(=O)[C@H](Br)CC)C2)C1)OCC	1783355922	ZWKOQZQUPSLPFO-RDTXWAMCSA-N	435.359	1.779	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)CCO2)C1	1783536224	FQNJCUVEMVZKOF-DIFFPNOSSA-N	444.257	1.961	50	20	IDGD	
O=C(C[C@@H]1COc2ccccc2O1)N1CCO[C@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783942119	IGENXGKLXZADKN-BFUOFWGJSA-N	429.300	1.850	50	20	IDGD	
CCc1[nH]nc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]3C2)c1F	1783969336	LJXUJOSCERIKAJ-MNXVOIDGSA-N	445.333	1.736	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCCn3ccnc3)C[C@@H]21	1783974127	JEGKQIZOXDUQEB-QZWWFDLISA-N	441.370	1.674	50	20	IDGD	
CC#C[C@H](CC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2)c1ccc(O)cc1	1784016784	ZAQSCPGNKILMNE-JUXOCIIHSA-N	434.920	1.319	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)c(Cl)c1	1785032883	CSGMOMARXHXKNJ-QFIPXVFZSA-N	442.708	1.086	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)COc3cccnc3)[C@H]2C1	1785147794	LBHWZEKUCDDUCA-VRKREXBASA-N	426.311	1.224	50	20	IDGD	
O=C(CCc1cncnc1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21	1787043767	RENDRZVDSWORRO-YXWQFLTLSA-N	429.290	1.079	50	20	IDGD	
O=C(CC[C@@H]1CCOC1)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1	1788145084	DYYLMBFRUVQFRN-QGZVFWFLSA-N	436.317	1.931	50	20	IDGD	
CC[S@](=O)CCC(=O)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1	1788145579	FCOWBWQENKNEPV-HKBQPEDESA-N	442.346	1.273	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4ncncc4c3)[C@H]2C1	1788379846	WIMCHHXVVVYQFA-XPYUAMARSA-N	432.908	1.477	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)c1cc2cnccc2[nH]1	1788419055	LCNPXWBCJARTQS-LVLWZLKYSA-N	439.285	1.847	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1(c2ccc(NC(=O)CCC(N)=O)cc2)CCC1	1791269213	KTIQMJRERFJQCT-MZJWZYIUSA-N	438.488	1.520	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCn3nc(C)cc3C)[C@H]2C1	1791510961	CDUANDQTMZDISG-XSLAGTTESA-N	426.945	1.124	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)Nc1cccnc1)C2	1792867924	NVPGVNDHSKQCPA-LBKYZSNHSA-N	439.354	1.503	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCN1CCCCC1)C2	1792868063	RZBJUHXQDHQGDR-XLMAVXFVSA-N	430.387	1.483	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnccc1Cl)C2	1792871195	QPQSMHIWLMVZHP-OHTBPHCPSA-N	430.730	1.969	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CSc1ccc(F)cc1F)C2)[C@@H](O)CCl	1792974865	FVXHZNSNZMDRCI-UOHMRFDXSA-N	434.892	1.246	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CC[C@H]1CNc3ccccc3C1)C2)[C@@H](O)CCl	1792977115	QNDYGMSYOWASHT-ZBVIFMFPSA-N	435.952	1.240	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCl)[C@@H](O)c1cccc(Br)c1	1793115796	ZGYGVRZUWLFHOO-JKJDWNRSSA-N	445.741	1.720	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H]2C[C@]21C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCl	1793115938	BOSKTJMOJZJKCJ-LQJCKMKWSA-N	441.956	1.624	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C=C/c1ccc(F)cc1F	1793681799	DJIQWFFNFVWYJL-KPEMIJLNSA-N	428.863	1.821	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1CCN(Cc2ccccn2)CC1)[C@@H](O)CCl	1794443963	GTPYKQVNFBNPPT-YRPNKDGESA-N	434.968	1.532	50	20	IDGD	
Cc1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)c(Cl)c1	1796190680	XUWPEHABBGAHQS-BCDXTJNWSA-N	426.709	1.894	50	20	IDGD	
CC[C@@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)N(CC)CC	1796890725	HRDLVIUEJJWSHP-NVQWDPAISA-N	444.580	1.879	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2)c1cccc2c1OCCO2	1796960207	CLFSTPDMXRFMKU-FVCICTRLSA-N	439.306	1.446	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CO[Si](C)(C)C)C1	1797956798	ZMASIIWLSVKXMX-ZQOJQMTGSA-N	440.613	1.407	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](C)N1C[C@H]2C[C@H]2C1	1798317887	UTQYOJRRQQFBGG-SZQYBFAVSA-N	440.548	1.099	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(O)c([N+](=O)[O-])c1)C2	1799275992	FZHFXFFCPBORLV-ABXQLRGKSA-N	446.287	1.740	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(CO)c(F)c1)C2	1799282015	HOAHEJHQFCEJSK-MVWRLGRASA-N	433.307	1.758	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](O)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@](C)(Cl)CCl	1800081677	AQJDLWKYPSVARN-OBONJLLUSA-N	438.352	1.704	50	20	IDGD	
COc1ccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)Br)cc1	1800755934	AMSZVWWACYRUJK-FRQROOTJSA-N	425.323	1.611	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](O)c1ccccc1Cl	1801200459	UERAKZDMSDKNSV-ZTJZGAFRSA-N	445.741	1.746	50	20	IDGD	
COc1cccc(/C=C/C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)c1	1801847855	IGDGOQMQCFRKGV-IKNLRRFCSA-N	434.301	1.340	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(OCC2CC2)cc1)c1ccc(B(O)O)cc1	1803791809	IBTMRGIMUVZEPO-KOUNCHBCSA-N	448.328	1.721	50	20	IDGD	
O=C(COC1CCCCC1)N1CCCC2(CCN(C(=O)c3ccc(B(O)O)cc3)CC2)C1	1805266758	QPFAXBTZYSHDOL-UHFFFAOYSA-N	442.365	1.561	50	20	IDGD	
COCCCC(=O)N1CCCC2(CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CC2)C1	1805340134	MVRXRPLONDTALT-JJIBRWJFSA-N	431.537	1.778	50	20	IDGD	
Cc1noc(N)c1C(=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@@H]1c1cccnc1	1807108296	VTXVSAVKKGEXGJ-IACUBPJLSA-N	440.273	1.970	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccccc2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807360204	IEEJNJYXIHGKNQ-UNMCSNQZSA-N	429.285	1.395	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)cc1	1807364697	GPGTUWCPECMKMZ-FYYLOGMGSA-N	443.312	1.703	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccccc2O)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1	1807369548	NPNKFGJFBSTKRX-PGRDOPGGSA-N	445.284	1.100	50	20	IDGD	
Cc1noc(CC(=O)NC[C@@H]2CCN(C(=O)[C@H](F)Br)[C@@H]2c2cccnc2)n1	1807525499	UYBJVXRFIYSWPM-MAZHCROVSA-N	440.273	1.712	50	20	IDGD	
O=C(CSc1ncccn1)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1	1807569647	RKJQCQYMHJGUQA-ZMSDIMECSA-N	435.937	1.269	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@H](CNC(=O)[C@@H]2C[C@H](O)CN2)[C@H]1c1cccnc1	1807707858	PDGBBLJZPOIJLW-ZAHIEGGZSA-N	429.348	1.047	50	20	IDGD	
C[C@@H]1CCc2c(C(=O)NC[C@@H]3CCN(C(=O)[C@H](O)CCl)[C@H]3c3cccnc3)n[nH]c21	1809250096	DPAXIHQWINHNHM-FERZIJSQSA-N	431.924	1.774	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)c1cnc2[nH]ncc2c1	1809707861	RVDHLDGFODCTRR-IAOVAPTHSA-N	428.880	1.272	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)c2cc(=O)ccn2C)[C@@H]1c1cccnc1	1812867239	NXIATUCGYBBLMU-DHSIGJKJSA-N	447.333	1.883	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)[C@H](N)c2ccccn2)[C@@H]1c1cccnc1	1813032228	VCXWYMNWFKWQEG-RNIPGJKVSA-N	431.924	1.436	50	20	IDGD	
CN1N=C(C(=O)N2CC[C@@H](CNC(=O)C(Cl)Cl)[C@@H]2c2cccnc2)CCC1=O	1813076687	YSOCSNPKDJJTGT-WFASDCNBSA-N	426.304	1.499	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)C2(F)CCC2)[C@@H]1c1cccnc1	1813684224	NRCMXQVSXOZBJV-QAPCUYQASA-N	440.479	1.292	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H]2CCC(=O)NC2)n[nH]1	1814524773	ADEQFJALNSRTDV-LOWVWBTDSA-N	426.315	1.711	50	20	IDGD	
CC(=O)NCCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](C)CBr)n[nH]1	1814782944	FHXJZUDBCVDNQZ-BXUZGUMPSA-N	428.331	1.959	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2nc3ccc(F)cn3n2)[nH]n1)[C@H](O)CCl	1814875043	MSNSECWPSZSMBJ-CHWSQXEVSA-N	435.847	1.497	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)Cn2cc([N+](=O)[O-])cn2)n[nH]1	1815823825	WFURRDKOIJUYKD-JSGCOSHPSA-N	439.860	1.461	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc(F)cn2)n[nH]1	1816590101	DFJJNIVUZQHAEZ-MRXNPFEDSA-N	431.472	1.623	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)C(=O)c2ccccc2)n[nH]1	1816715453	WOPZDNXIVSTXRA-KRWDZBQOSA-N	440.504	1.658	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](F)Cl)CC2	1817279889	KTBPJNMBVXTBCE-KGVFOJOVSA-N	440.888	1.724	50	20	IDGD	
CCc1cc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)n[nH]1	1817705910	FQCDRTVVCCQIOF-INIZCTEOSA-N	430.513	1.374	50	20	IDGD	
C[C@]1(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cnccc3C(=O)NN)n[nH]2)CC1(F)F	1819404318	GVJMPUMGHHNMAN-IFXJQAMLSA-N	447.446	1.759	50	20	IDGD	
C[C@@](O)(CC(=O)O)CC(=O)N[C@@H]1CCc2nc(NC(=O)CO[Si](C)(C)C)sc2C1	1820169623	ZUIIYZUIJVSSJM-ZMZPIMSZSA-N	443.598	1.522	50	20	IDGD	
CC[C@@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)Cn2cc(C)c(O)nc2=O)[nH]n1	1820861305	WWSCAQFBXUQVCZ-TZMCWYRMSA-N	436.900	1.690	50	20	IDGD	
COCCn1nccc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](Cl)COC)n[nH]1	1822367709	ACINNXGPWTYQQO-HIFRSBDPSA-N	438.916	1.812	50	20	IDGD	
CCn1ccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)n1	1822412657	BSLHHILOBUHJPJ-INIZCTEOSA-N	430.513	1.305	50	20	IDGD	
COc1ccc(CC(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@H](O)CCl)CC3)c(C#N)c1	1822805587	YXJCQWUUAQNVLU-CZUORRHYSA-N	448.932	1.778	50	20	IDGD	
O=C(Cc1ncccn1)N[C@@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1	1823001685	JDEVLVMBRHOZKO-AMIZOPFISA-N	428.287	1.778	50	20	IDGD	
COc1ccc(C(=O)N[C@@H]2CCc3nc(NC(=O)[C@H](C)Br)sc3C2)nn1	1825642326	POFLBNBXPPDIAZ-DTWKUNHWSA-N	440.323	1.951	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(C(C)=O)[nH]n1)CC2	1825994655	WWKMXAPVLXCBTB-UWVGGRQHSA-N	425.898	1.548	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1CCc2nc(NC(=O)CCn3ccnn3)sc2C1	1826877419	FHMSRUNMHMOTOV-HWPZZCPQSA-N	431.349	1.973	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4c(c3)OCO4)C2)C1	1830362063	KANQIRPPXUOHMK-OAQYLSRUSA-N	438.908	1.750	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(O)cc3F)C2)C1	1830363582	DEHISKDASOBEPA-HXUWFJFHSA-N	428.888	1.866	50	20	IDGD	
C=CCNC(=O)/C=C\C(=O)NC1CCN(C2CCN(C(=O)C(C)(C)CCl)CC2)CC1	1833074267	DVFRKEQFLUZPHY-WAYWQWQTSA-N	439.000	1.681	50	20	IDGD	
C[C@@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)c3cnc(O)[nH]3)CC2)CC1	1833263023	GNTOWIDJXAYDGJ-LBPRGKRZSA-N	442.358	1.332	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC(N2CCC(NC(=O)C(=O)c3ccco3)CC2)CC1	1833756137	LGKNRHGNOJCUJD-UHFFFAOYSA-N	435.597	1.885	50	20	IDGD	
Cc1ccn(CC(=O)NC2CCN(C3CCN(C(=O)[C@@H](F)Br)CC3)CC2)n1	1833853495	CDOGFNSXTQVKAS-QGZVFWFLSA-N	444.349	1.454	50	20	IDGD	
CC(C)c1nc(C(=O)N2CCOC[C@]3(CN(C(=O)CCBr)CCO3)C2)co1	1834819135	HQIZLSBNDIATLM-SFHVURJKSA-N	444.326	1.653	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cccn4ccnc34)CC2)CC1	1835578772	IUNHPNWIIAGAHG-IBGZPJMESA-N	447.967	1.773	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3ccc(Cl)nn3)CC2)CC1	1835882728	LFZNTLPOUSSWEU-OAHLLOKOSA-N	444.363	1.569	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1Cc3ccccc3CN1)CCO2	1836485007	KZQAJQYQAUZTCK-CNNODRBYSA-N	435.952	1.175	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc4c(C)cccc4[nH]3)CCO2)C1	1836918536	BFZOBVQMVCNZMQ-VGSWGCGISA-N	449.935	1.800	50	20	IDGD	
Cc1nc(C(=O)N2CCC(OC3CCN(C(=O)[C@H](F)Cl)CC3)CC2)c(=O)[nH]c1C	1837266378	VUGNTXQGEKRPJR-INIZCTEOSA-N	428.892	1.533	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3nnc(-c4ccccc4)o3)CCO2)C1	1837537607	ZGKLYUBFZCOTCI-HRAATJIYSA-N	448.907	1.824	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(-c4ccncc4)[nH]n3)CCO2)C1	1838012615	QLAYJZPMKIDODN-IIBYNOLFSA-N	447.923	1.559	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(C#N)c3)CCO2)C1	1838907894	UUODPTFYAAHRLG-WOJBJXKFSA-N	440.327	1.865	50	20	IDGD	
CCc1[nH]nc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](Cl)CC)CCO3)c1Cl	1839143745	HATUASJTISOHOK-XIKOKIGWSA-N	433.336	1.713	50	20	IDGD	
Cc1ncc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)s1	1839200238	DRNACPHTJFKIQF-DOMZBBRYSA-N	436.303	1.212	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1839680502	JNSBRPJCWNUNKL-KUHUBIRLSA-N	434.917	1.269	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccncc3F)C2)C1	1840032758	JNKOCJMFUSZYOX-YVEFUNNKSA-N	430.274	1.074	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(Cl)s3)C2)C1	1840149797	AFNOVRCZHBCMMQ-SJKOYZFVSA-N	437.345	1.725	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C)cc(C)n3)C2)C1	1840151425	BAXCWQIMJVTRJN-JXFKEZNVSA-N	425.913	1.022	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(Cl)cn3)C2)C1	1840153367	MADFOCODTWQJFF-KSSFIOAISA-N	432.304	1.059	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@H](CCO)NC(=O)OC(C)(C)C)C1	1841428940	AONGQVJFJDZUJZ-CABCVRRESA-N	431.961	1.873	50	20	IDGD	
C/C(=C/C(=O)N1CC2(CCCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C1)C(=O)O	1841925512	CZMNAINLLKZUQF-FSBNRTBOSA-N	429.901	1.353	50	20	IDGD	
O=C(COCCOCCOCc1ccccc1)N1CC2(CCCN2C(=O)[C@@H](F)Cl)C1	1843366843	UDBGQABNINRBBE-LJQANCHMSA-N	442.915	1.974	50	20	IDGD	
COc1cc(C)c(C)cc1C(=O)N1CC2(CCCN2C(=O)c2cnccc2C(=O)NN)C1	1844265117	VVRRFQJWMZCJSS-UHFFFAOYSA-N	437.500	1.441	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H]1CCc2ccoc2C1	1847661898	ZBQZBTKGVUQEBA-ZYMUAVKASA-N	437.500	1.720	50	20	IDGD	
O=C(COC(=O)CSc1ccc([N+](=O)[O-])cc1)NNC(=O)[C@@H]1COc2ccccc2O1	9352075	LWZNIZFLASLBIO-INIZCTEOSA-N	447.425	1.218	50	20	IDGD	
C=C1c2ccccc2C(=O)N1[C@H](C)C(=O)NNC(=O)c1nn(CC)c(=O)c2ccccc12	14044379	QRDSSYONQOCBLU-CQSZACIVSA-N	431.452	1.693	50	20	IDGD	
O=C(NNC(=O)c1cc2ccccc2o1)c1cccc(S(=O)(=O)N2CCOCC2)c1	15525073	KIEFPRJGXMCCKD-UHFFFAOYSA-N	429.454	1.529	50	20	IDGD	
C[C@@H]1Cc2cc(C(=O)NNC(=O)Cn3cnc4ccccc43)ccc2N1S(C)(=O)=O	17405005	OSGBWIMGBXKXPN-CYBMUJFWSA-N	427.486	1.208	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(C(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)cc1	26070421	PBXUQUFDMSVGKE-INIZCTEOSA-N	449.529	1.457	50	20	IDGD	
O=C(CCC(=O)N1CC(=O)Nc2ccccc21)NNC(=O)c1cc(-c2ccccc2)on1	27261483	MJYILFYEHPBQCS-UHFFFAOYSA-N	433.424	1.868	50	20	IDGD	
COc1ccc(-c2n[nH]c(SCC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)n2)cc1	57748454	XOYHSDNHCXSWGU-UHFFFAOYSA-N	428.430	1.942	50	20	IDGD	
CCc1c(C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cnn1Cc1ccccc1	97297477	JPNBWUXYLFLRSP-UHFFFAOYSA-N	430.468	1.816	50	20	IDGD	
CC1CCN(Cc2ccccc2CNC(=O)NNC(=O)CNC(=O)c2ccco2)CC1	725870567	KQAQFFNAIAUIMW-UHFFFAOYSA-N	427.505	1.772	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)N1CCCN(Cc2ccc(F)cc2)CC1	725874186	WLKUZXLNAOHRGX-UHFFFAOYSA-N	433.509	1.566	50	20	IDGD	
C[C@H]1CN(C[C@@H](C)C(=O)NNC(=S)NCCc2ccc3c(c2)OCCO3)C[C@@H](C)O1	726748579	ZBIRWNZBJJVLOS-OAGGEKHMSA-N	436.578	1.241	50	20	IDGD	
CCCC(=O)N1CSC[C@@H]1C(=O)NNC(=O)COc1ccc(Br)cc1	727295009	KKDZGCFIHULWFC-CYBMUJFWSA-N	430.324	1.677	50	20	IDGD	
COc1ccc(COCCCNC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1	727472866	DMSNTEMHIPLQAE-UHFFFAOYSA-N	425.449	1.222	50	20	IDGD	
CCOc1ccc(OCC)c(NC(=S)NNC(=O)c2cnc3n(c2=O)CCS3)c1	727494904	UKXSTEUJRRMXKQ-UHFFFAOYSA-N	435.531	1.778	50	20	IDGD	
O=C(COC(=O)c1cnc(-c2ccccc2)s1)NNC(=O)[C@@H]1COc2ccccc2O1	728328073	FLAIYHSFINOILM-INIZCTEOSA-N	439.449	1.954	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NC[C@@H]2CCCN(C(C)C)C2)cc1	729618698	FXFIOMYRKRMQFE-KRWDZBQOSA-N	439.582	1.066	50	20	IDGD	
COC1CCN(C2(CNC(=O)NNC(=O)COc3ccccc3[N+](=O)[O-])CCCC2)CC1	730914792	UFAQABUDYCJBMX-UHFFFAOYSA-N	449.508	1.728	50	20	IDGD	
Cc1ccccc1-n1ccnc1SCC(=O)NNC(=O)CCN1C[C@@H](C)O[C@H](C)C1	732265148	ZVQKAKWTEVJUGA-IAGOWNOFSA-N	431.562	1.920	50	20	IDGD	
O=C(NCCN1C(=O)CCC1=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1	733800603	BIVHSNJZQWBSOF-HXUWFJFHSA-N	449.511	1.093	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)Oc1ccccc1	733848923	BHIDYSVDVICXLP-MRXNPFEDSA-N	446.529	1.883	50	20	IDGD	
COc1ccc([C@H]2[C@@H](C(=O)NNC(=O)c3ccc4c(c3)OCCO4)CCC(=O)N2C)cc1	734316161	KSGBIFXBJFTEPQ-UWJYYQICSA-N	439.468	1.837	50	20	IDGD	
Cc1cc(S(=O)(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)ccc1[N+](=O)[O-]	734418553	KQRMGPZZFUDNKG-UHFFFAOYSA-N	445.457	1.817	50	20	IDGD	
C[C@H](CN1CCN(c2ccccn2)CC1)NC(=O)NNC(=O)Cc1ccc(Cl)cc1	735518795	LUCLZSHTSUMJAE-MRXNPFEDSA-N	430.940	1.819	50	20	IDGD	
O=C(COC(=O)c1cccc(Oc2cnccn2)c1)NNC(=O)c1ccc([N+](=O)[O-])cc1	736923860	AMBSTHDOLGXNEG-UHFFFAOYSA-N	437.368	1.795	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CCN2C(=O)CCc3ccccc32)cc(OC)c1OC	737468445	AYZSZMPYQXHPAG-UHFFFAOYSA-N	427.457	1.843	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)c2ccnc(N3CCCC3)n2)CC1	739731662	AETYBZSOLRBJFU-UHFFFAOYSA-N	433.513	1.420	50	20	IDGD	
O=C(NCc1cc(F)ccc1N1CCOCC1)NNC(=O)c1cc(Br)c[nH]1	740903114	KGPOFOOLIGREMG-UHFFFAOYSA-N	440.273	1.897	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCCCOC[C@@H]2CCOC2)cc1Br	740914677	DDIHMTAFDBOOFT-LBPRGKRZSA-N	430.299	1.845	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)CCS(=O)(=O)c1ccc2c(c1)OCCCO2	741188442	ZZJWHYAJKJVVHT-UHFFFAOYSA-N	434.470	1.482	50	20	IDGD	
O=C(CCN1C(=O)[C@H]2[C@H](C1=O)[C@H]1CC[C@H]2O1)NNC(=O)c1ccc(Cl)cc1Cl	742482395	JZOVQSHHKSISPI-QHSBEEBCSA-N	426.256	1.307	50	20	IDGD	
COCCOC[C@@H]1CCN(C(=O)NNC(=O)c2ccc(OC)c(Br)c2)C1	743604079	JKZIBADPXPTALG-GFCCVEGCSA-N	430.299	1.797	50	20	IDGD	
CNC(=O)c1cccc(CCNC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)c1	743623661	KRICIDCMPSKJFB-UHFFFAOYSA-N	433.490	1.028	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)N[C@H](C)CN2CCN(c3ccccc3)CC2)c1	743631453	BITNLMVLNRQLPI-QGZVFWFLSA-N	441.532	1.859	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2cc3c(cc2[N+](=O)[O-])OCCO3)cc1	743829398	OLURVFFIGUUGFS-UHFFFAOYSA-N	436.402	1.236	50	20	IDGD	
COc1nc2sccn2c1C=NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	744562854	AFYIXVGZYVTJPV-UHFFFAOYSA-N	449.514	1.189	50	20	IDGD	
CCS(=O)(=O)Nc1ccccc1C(=O)OCC(=O)NNC(=O)c1cccc(Cl)c1	744564740	MAMJVLZONVDPOF-UHFFFAOYSA-N	439.877	1.720	50	20	IDGD	
Cc1ccc(C(=O)N2CCC[C@@H](C(=O)OCC(=O)NNC(=O)c3cccc(C#N)c3)C2)cc1	744705802	UGLBKJRMFZODSB-HXUWFJFHSA-N	448.479	1.723	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)c2nc(N3CCCC3)ncc2Cl)cc1	744791541	WKSIOLHGPDNYJB-UHFFFAOYSA-N	428.836	1.220	50	20	IDGD	
Cc1ccccc1O[C@@H](C)CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	745887570	OPZDGKLTFGVRKW-HNNXBMFYSA-N	434.518	1.657	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)N[C@@H]2CC(=O)N([C@H]3C[C@H]3c3ccccc3)C2)cc1	745914365	NBYPHGLRAJTMIO-UXPWSPDFSA-N	438.484	1.561	50	20	IDGD	
O=C(CCCS(=O)(=O)c1ccc(Br)cc1)NNC(=O)Cc1ccncc1	747324807	ISNWOGDEROZAJZ-UHFFFAOYSA-N	440.319	1.788	50	20	IDGD	
C[C@H]1CCCN(S(=O)(=O)c2ccc(CNC(=O)NNC(=O)Cc3ccncc3)cc2)C1	747493656	CBEVCRLIJSIYPK-INIZCTEOSA-N	445.545	1.575	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)c2cc(S(=O)(=O)N3CCC3)ccc2Cl)cc1	748690025	VUVKJFNWERBOMJ-UHFFFAOYSA-N	437.905	1.883	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)NCc1ccccc1CN1CCC(O)CC1	749592365	UVIRINDOQLAHFT-UHFFFAOYSA-N	436.516	1.744	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(N2C[C@H](C(=O)O)CC2=O)cc1)c1cc2ccccc2o1	749867473	YIQPUXRHYRBFGT-CYBMUJFWSA-N	443.437	1.494	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1	751204230	WOMKWLRZPFWIMH-LJQANCHMSA-N	438.406	1.611	50	20	IDGD	
Cc1c(C(=O)NNC(=S)N[C@H](C)C2CC2)cc(Br)cc1S(N)(=O)=O	751618723	KHNLGDOSCHSKBZ-MRVPVSSYSA-N	435.369	1.312	50	20	IDGD	
COc1cc(OC)cc(N2C[C@H](C(=O)OCC(=O)NNC(=O)c3cccs3)CC2=O)c1	752581165	QGHOXUBTNMJYEZ-GFCCVEGCSA-N	447.469	1.123	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)N[C@H]2CCN(Cc3ccc(C#N)cc3)C2=O)c1	753733506	QRRJKQUHAGDOPU-SFHVURJKSA-N	427.486	1.389	50	20	IDGD	
COC(=O)c1cc2c(cc1NC(=O)C(=O)NNc1ncccc1C(F)(F)F)OCO2	753840322	FWAUIGKUIKLRCD-UHFFFAOYSA-N	426.307	1.698	50	20	IDGD	
Cc1ccc2cccc(S(=O)(=O)NNC(=O)c3csc(N4CCOCC4)n3)c2n1	753981803	RZORRNIBDBHFNO-UHFFFAOYSA-N	433.515	1.460	50	20	IDGD	
CC(C)Cn1c(=O)nc(O)c2c(C(=O)NNc3ccnc(N(C)C)n3)cc(C(C)C)nc21	754420949	UQXJPMGRKMYUAN-UHFFFAOYSA-N	440.508	1.889	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)Nc1ccc(-c2csc(N3CCOCC3)n2)cc1	755580402	ANDJJMJNOOOZFT-CQSZACIVSA-N	449.533	1.851	50	20	IDGD	
COc1ccc(C(=O)N2CCOCC2)cc1NC(=O)NNC(=O)COCc1ccccc1	756258284	PQINMYRGMJZMKA-UHFFFAOYSA-N	442.472	1.537	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)Nc1cc(F)cc(S(N)(=O)=O)c1	756514153	FDTCIERYBNXKQQ-UHFFFAOYSA-N	428.467	1.427	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)Nc2ccc(F)c(-n3nnnc3C3CC3)c2)c1	756780513	YVRKUJKXISJJLC-UHFFFAOYSA-N	439.411	1.499	50	20	IDGD	
CCOC(=O)[C@H](C)NC(=O)c1ccc(NC(=O)NNC(=O)c2cccc(N(C)C)c2)cc1	756790778	RXVXVADRAKWIAM-AWEZNQCLSA-N	441.488	1.901	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)Nc1ccn(CC(F)F)n1	756867998	OXTVMRXMLHODBM-UHFFFAOYSA-N	442.448	1.399	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)N[C@H]1CN(C)Cc2ccccc21	757004404	VJXOGNBZHFRXGY-INIZCTEOSA-N	430.534	1.419	50	20	IDGD	
CCOC(=O)c1sc([C@H](C)NC(=O)NNC(=O)COc2ccccc2C#N)nc1C	757269673	AXFJMRAALDWGIY-LBPRGKRZSA-N	431.474	1.970	50	20	IDGD	
O=C(NN=c1cc[nH]cc1Cl)[C@H]1CCCN1S(=O)(=O)c1cccc([N+](=O)[O-])c1	757420020	GKGKSQUYUMKTPQ-OAHLLOKOSA-N	425.854	1.362	50	20	IDGD	
O=C(NNC(=O)c1cccc(Br)c1F)c1csc(N2CCOCC2)n1	757833586	CGYJCXIQMSPGCE-UHFFFAOYSA-N	429.271	1.956	50	20	IDGD	
CCCCn1ncc(C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)c1CC	760830050	CCMKZUFUCBDTTB-UHFFFAOYSA-N	449.581	1.334	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)N[C@H]1CCCN(c2ccccc2F)C1=O	761815358	HXPYZPPARNMJJE-INIZCTEOSA-N	425.420	1.602	50	20	IDGD	
Cc1nnc(-c2cccc(NC(=O)C(=O)NNC(=O)c3ccc4ccccc4n3)c2)n1C	763450693	SBEBALGEDQKUFO-UHFFFAOYSA-N	429.440	1.738	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1cnn(-c2ccccc2Cl)c1	763629549	MQRVVNOFVKTQNE-UHFFFAOYSA-N	437.847	1.882	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(OCC(F)(F)F)cc2)cc1	763660099	XFMNYCCMTCCXDF-UHFFFAOYSA-N	441.362	1.801	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)C(=O)Nc1ccc(CN2CCCC2=O)cc1	763678663	HDUAMIDRZZRTPB-UHFFFAOYSA-N	428.420	1.113	50	20	IDGD	
NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)cc1Cl	763694850	LLIXZGVJEISZMK-UHFFFAOYSA-N	425.228	1.257	50	20	IDGD	
CCc1cccc(CC)c1NC(=O)C(=O)NNC(=O)c1nn(CC)c(=O)c2ccccc12	763787382	ZAWYMYLTDSLHQV-UHFFFAOYSA-N	435.484	1.941	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1cccc(CN2CCOC2=O)c1	763852521	YFTCHMDNWKJVHQ-ZDUSSCGKSA-N	444.419	1.331	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)cc1C(=O)NC(C)C	763855724	AWESYFGPQUCRBT-CQSZACIVSA-N	444.463	1.826	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccc([S@](C)=O)c(F)c1	763863867	DRHJPBTYJUQIHC-UIHBWLLHSA-N	425.413	1.256	50	20	IDGD	
COC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2ccc(Br)s2)c1	763939871	CCLYZNVSTAMTMP-UHFFFAOYSA-N	426.248	1.697	50	20	IDGD	
CCN(CC)c1ccc(NC(=O)C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cn1	763944536	MUCCAOWXAOMSNT-UHFFFAOYSA-N	437.460	1.219	50	20	IDGD	
COc1cc(F)c(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)cc1OC	763995947	SKUICHVPOPHPCE-UHFFFAOYSA-N	429.202	1.333	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1cccnc1Br	764012402	QEOWVSXRLDPNLQ-UHFFFAOYSA-N	427.642	1.906	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)on1)C(=O)Nc1cccc(CN2CCCC2=O)c1	764017474	YMPLWXXCOIMWOE-UHFFFAOYSA-N	447.451	1.864	50	20	IDGD	
CN(C)C(=O)c1ccccc1NC(=O)C(=O)NNC(=O)c1cccc(Br)c1	764059256	PXUOYYDONRQTIG-UHFFFAOYSA-N	433.262	1.551	50	20	IDGD	
CCN(CC)CCOc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(C)cc2O)cc1	764105564	UVLVLAHXBNVWRG-UHFFFAOYSA-N	428.489	1.821	50	20	IDGD	
Cc1cc(C)cc(-n2nc(NC(=O)C(=O)NNC(=O)[C@@H]3Cc4ccccc4O3)cc2C)c1	764168464	PFMPEHSIAMIRTI-IBGZPJMESA-N	433.468	1.887	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)C(=O)Nc1ccc2c(c1)OCCCO2	764205103	ZCYRIDBMGGKCBT-UHFFFAOYSA-N	436.465	1.239	50	20	IDGD	
CCN(CC)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)Cc2cccnc2)cc1Cl	764268352	JDPAJTLOXSTFGA-UHFFFAOYSA-N	431.880	1.546	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1ccccc1C(=O)N1CCCCC1	764276907	FAOBOKMRWSSOES-UHFFFAOYSA-N	440.456	1.183	50	20	IDGD	
COCC[S@@](=O)Cc1cccc(NC(=O)C(=O)NNC(=O)C(C)(C)c2ccccc2)c1	764314855	ZFOLQHDUFGLLER-WJOKGBTCSA-N	445.541	1.645	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)C(=O)Nc1cccc(N2CCCS2(=O)=O)c1)c1ccccc1	764329533	NUPXJNPLALJOCL-GOSISDBHSA-N	444.513	1.506	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CCc2ncc(NC(=O)C(=O)NNC(=O)C3CCC3)cc2C1	764334651	IBJJHABAPNUWET-CQSZACIVSA-N	431.493	1.350	50	20	IDGD	
C[C@@H]1C[C@@H](C)CN(C(=O)c2ccccc2NC(=O)C(=O)NNC(=O)Cc2ccncc2)C1	764356324	UUAKKQYQTAZURZ-HZPDHXFCSA-N	437.500	1.528	50	20	IDGD	
CCCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)cc1	764369718	ISLDROYSVVXCQT-UHFFFAOYSA-N	434.399	1.584	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)C(=O)Nc1cc(C(F)(F)F)ccc1-n1cccn1	764388314	GDVLOSIPEJAOES-UHFFFAOYSA-N	432.362	1.994	50	20	IDGD	
CC(C)C(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)cc1	764400872	KDZOPRQGAIDYBM-UHFFFAOYSA-N	430.486	1.865	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)cc1	765318824	RTQHBTKWAIAKFN-AWEZNQCLSA-N	442.538	1.114	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)[C@@H](C)c3ccc(C)o3)CC2)cc1	765730092	TZILBQWAIDVKCV-KRWDZBQOSA-N	448.545	1.154	50	20	IDGD	
C[C@H](CCc1cccc(F)c1)C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765739343	URFRILRHJQHMGG-GOSISDBHSA-N	440.519	2.000	50	20	IDGD	
C[C@@H](NC(=O)C(C)(C)C)C(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	765755200	OUIVWFVIJRZWHP-OAHLLOKOSA-N	437.972	1.156	50	20	IDGD	
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	765895647	XNNBZGXCUXKMMC-BEFAXECRSA-N	434.500	1.398	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(=CC(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)C1	766142811	BLUDEOVXGCDTJR-UHFFFAOYSA-N	434.405	1.076	50	20	IDGD	
O=C(NNc1nc(Br)cn2ccnc12)c1ccc(=O)n(-c2ccccc2F)n1	766209729	KHVLOIINHMXUDM-UHFFFAOYSA-N	444.224	1.934	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1cc(C(=O)N2C[C@@H](C)C[C@H](C)C2)ccc1C	766261026	OBQNCUZARPTWLV-KBPBESRZSA-N	440.504	1.994	50	20	IDGD	
Cc1onc(-c2ccccn2)c1C(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	767560753	DRTDOVUHVLBSMM-UHFFFAOYSA-N	425.357	1.571	50	20	IDGD	
CC(C)(C)[C@@H](Br)C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	768210254	VGNBMSXJDOGZND-AWEZNQCLSA-N	434.356	1.960	50	20	IDGD	
CC(C)(C)[C@@H](Br)C(=O)NC1CN(S(=O)(=O)c2ccc3c(c2)OCCO3)C1	768389011	WLFFJGNDCSOKKE-HNNXBMFYSA-N	447.351	1.757	50	20	IDGD	
COC(=O)c1ccc(S(=O)(=O)NNC(=O)[C@@H](C)Oc2ccc3ccccc3c2)cn1	769627118	QRZCCTWKBWVMQE-CYBMUJFWSA-N	429.454	1.798	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)N[C@H](C)[C@H]2CN(C)CCO2)cc(OCC)c1OCC	770124831	SSAVTSPQJICCMI-RDTXWAMCSA-N	438.525	1.546	50	20	IDGD	
CC(C)C[C@@H](C(=O)NNC(=O)c1ccc2c(c1)OCCO2)N1C(=O)[C@H]2CC=CC[C@H]2C1=O	770417952	NTUREXYTBCLDMS-BBWFWOEESA-N	441.484	1.585	50	20	IDGD	
O=C(CN1CCC[C@H](c2nnc3n2CCCCC3)C1)NNC(=O)c1ccc([N+](=O)[O-])cc1	771791511	PUAFIDUKEUGOMQ-INIZCTEOSA-N	441.492	1.553	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)c2cnn(CC(=O)NC3CCCC3)c2)o1	772439403	FRMQXAGHRQEKIL-UHFFFAOYSA-N	430.509	1.452	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1cccc(-n2ccnn2)c1	774008445	IUVPNXCLIWUNIB-LBPRGKRZSA-N	428.836	1.474	50	20	IDGD	
Nc1ccccc1S(=O)(=O)NCC(=O)NNC(=O)c1ccc(COc2ccccc2)o1	774328091	UZZGMZIFVLJQDY-UHFFFAOYSA-N	444.469	1.180	50	20	IDGD	
CCNC(=O)NNS(=O)(=O)c1cc(C(=O)O)c(Br)cc1Br	775673683	STTKNJJPAUZIEF-UHFFFAOYSA-N	445.089	1.422	50	20	IDGD	
CCOc1cccc([C@@H]2C[C@H]2NC(=O)NNC(=O)c2csc(N3CCOCC3)n2)c1	775715219	UNVQUAIJMOBVMZ-JKSUJKDBSA-N	431.518	1.879	50	20	IDGD	
Nc1nc(-c2ccc(C(=O)OCC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)cc2)cs1	775884158	GIWFCTAFDZCPAI-UHFFFAOYSA-N	441.425	1.919	50	20	IDGD	
O=C(O)[C@@H]1CC(=O)N(C2CCN(S(=O)(=O)c3ccc(CCCCl)cc3)CC2)C1	776714297	MAWDRUVOTNGVTM-OAHLLOKOSA-N	428.938	1.944	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)/C(=C/c2ccc(F)cc2)n2nnnc2C)nc1C	778421113	GHXCFHKBZZKOSS-SXGWCWSVSA-N	426.412	1.537	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2cc(OC)c(Br)c(OC)c2)nc1	782145798	QCQMBULCJLIQMM-UHFFFAOYSA-N	425.239	1.952	50	20	IDGD	
O=C(NNc1nc2ccccc2s1)C(=O)Nc1ncn(CC(=O)N2CCCCCC2)n1	782816446	WQUWWRQFYJOILZ-UHFFFAOYSA-N	442.505	1.372	50	20	IDGD	
CC(C)N1CCN(c2cccc(NC(=O)C(=O)NNC(=O)c3ccc(O)cc3)c2)CC1	782833007	AXXOHDNSONRAQS-UHFFFAOYSA-N	425.489	1.322	50	20	IDGD	
CN(C)c1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)Cc1nc2ccccc2n1C	782888004	VBSRMPGOHVMCQH-UHFFFAOYSA-N	428.880	1.621	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2cccc(COc3cccc(F)c3)c2)CCS(=O)(=O)C1	783424933	GNOUTICHLPNYGO-HXUWFJFHSA-N	435.477	1.541	50	20	IDGD	
CC(C)(C)OC(=O)N1CCc2[nH]nc(C(=O)NNC(=O)COc3ccccc3O)c2C1	783613231	FYOVKUABPJRAGE-UHFFFAOYSA-N	431.449	1.249	50	20	IDGD	
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)NNC(=O)c1cc(C)nc2ccccc12	783803650	CTYNMHYZACNMSV-UHFFFAOYSA-N	444.425	1.861	50	20	IDGD	
O=C(NN=Cc1ncc(Br)cc1Br)[C@H]1CCS(=O)(=O)C1	783822707	WJTMEAJEJJYFFJ-ZETCQYMHSA-N	425.102	1.491	50	20	IDGD	
CNS(=O)(=O)c1ccc2c(c1)N(C(=O)C(=O)NNc1ccc(OC(F)F)cc1)CC2	784310211	ZJWCYCGUZHQRPG-UHFFFAOYSA-N	440.428	1.229	50	20	IDGD	
C[C@@H]1CN(C(=O)c2ccc(NC(=O)C(=O)NNc3nccnc3Cl)cc2)C[C@@H](C)O1	784778370	WWRBCQVOWMMZCJ-VXGBXAGGSA-N	432.868	1.461	50	20	IDGD	
COC(=O)c1cc(OC)c(OC)cc1NC(=O)C(=O)NNc1cc(F)c(F)c(F)c1	785083220	HMYHUIPDVLKEPM-UHFFFAOYSA-N	427.335	1.990	50	20	IDGD	
O=C(NNc1nnc(-c2ccccn2)s1)c1cc(S(=O)(=O)N2CCCC2)ccc1O	788558926	UVIPFCQDRRSCIM-UHFFFAOYSA-N	446.514	1.847	50	20	IDGD	
CS(=O)(=O)CC[C@H](C(=O)OCC(=O)NNC(=O)c1cccc(C#N)c1)c1ccccc1	789114646	HAHCFSFZRXFZRD-SFHVURJKSA-N	443.481	1.081	50	20	IDGD	
Cc1noc(-c2ccc(C(F)(F)F)cc2NC(=O)C(=O)NNC(=O)c2ccncc2)n1	789729727	HGLLYMSARYLERH-UHFFFAOYSA-N	434.334	1.859	50	20	IDGD	
COc1cccc(Cl)c1CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	790540288	KRFXXQIOTZAMRW-UHFFFAOYSA-N	440.909	1.743	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)N[C@@H](c1cncc(Br)c1)C1CC1	790693388	VSJDPODQGSYNOK-OAHLLOKOSA-N	436.266	1.649	50	20	IDGD	
C[C@]12CCN(C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)C[C@@H]1C2(Cl)Cl	790708967	MDFZDDZIODRVIQ-GUYCJALGSA-N	427.336	1.950	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NC[C@@H]2CCN(Cc3ccccc3)C2)cc1	792228935	GMBIZFWOSIIORW-KRWDZBQOSA-N	445.545	1.948	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@@H](C)CCC(=O)OC(C)C)cc1	792304203	MULNOJQPUVAZIV-HNNXBMFYSA-N	442.538	1.066	50	20	IDGD	
COc1ccc(CCC(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1F	792728227	QTLNXZDGCXZHIV-GOSISDBHSA-N	432.404	1.298	50	20	IDGD	
Cc1ccc2c(c1)CC[C@H](C(=O)NNC(=O)c1ccc(S(=O)(=O)N3CCCC3)cc1)O2	792805581	KKEJWSPTKJRAAL-HXUWFJFHSA-N	443.525	1.934	50	20	IDGD	
Cc1cc(C)c(C(=O)NNC(=O)CNC(=O)c2ccco2)cc1I	793336417	KYAXWWSNMBTWBC-UHFFFAOYSA-N	441.225	1.692	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2C[C@H](c3ccccc3)[C@@H]3COCC[C@@H]32)cc1OC	796357073	BHHDKIXHRKMHBM-AABGKKOBSA-N	439.512	1.969	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN([C@H]2CCN(CC(=O)NNC(=O)c3cccs3)C2)CC1	796618791	WTHKXHAUIOSXFV-HNNXBMFYSA-N	437.566	1.136	50	20	IDGD	
CCOc1cc(F)ccc1NC(=O)C(=O)NNC(=O)CNC(=O)OCc1ccccc1	797369426	WECMPUCAKWBUON-UHFFFAOYSA-N	432.408	1.237	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2cc(N3CCOCC3)ccc2C)c1	797535325	MGGWXJHBXLJKRS-UHFFFAOYSA-N	440.500	1.613	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc3ccccc3c(=O)o2)c1	797701510	SGLJJFQAABZSBI-UHFFFAOYSA-N	443.481	1.898	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(CN3CCC(CO)CC3)cc2)cc1C	798308013	MOLDASOKHZEVIK-UHFFFAOYSA-N	438.528	1.907	50	20	IDGD	
CCOc1ccc([N+](=O)[O-])cc1NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	799236240	NIAGWNPNWDHIJN-UHFFFAOYSA-N	426.389	1.707	50	20	IDGD	
Cn1c(=O)c2cc(C(=O)NNc3cc([N+](=O)[O-])ccc3Br)cnc2n(C)c1=O	800619480	QPXZJMQPXBYTIZ-UHFFFAOYSA-N	449.221	1.060	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2cccc3c2OCO3)cc1Br	800835783	DGDKULJOQBHHEY-UHFFFAOYSA-N	429.248	1.810	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)Cn2cnc3sccc3c2=O)c(OC)cc1Cl	802080678	LDXOBDDOGICTPT-UHFFFAOYSA-N	437.865	1.982	50	20	IDGD	
COc1ccc(C2=NO[C@@H](CNC(=O)NNC(=O)Cc3ccccc3OC)C2)cc1F	802340277	GZWCKBPTCHFDDW-OAHLLOKOSA-N	430.436	1.909	50	20	IDGD	
CCOC(=O)C(C)(C)c1csc(NC(=O)NNC(=O)[C@H]2COc3ccccc3O2)n1	806821821	ZQNLIVWNTVMHID-CYBMUJFWSA-N	434.474	1.977	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc3c(c2)C(=O)CC(C)(C)O3)cc1	806974373	ICRLEVSPYGCNDI-UHFFFAOYSA-N	425.441	1.904	50	20	IDGD	
COC(=O)c1c(C)csc1NC(=O)C(=O)NNc1c(OC)cccc1S(C)(=O)=O	807026998	KIXWTDMVTVWIHN-UHFFFAOYSA-N	441.487	1.337	50	20	IDGD	
CCOC(=O)c1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1	809957670	TXZODHJOEYTSSH-UHFFFAOYSA-N	445.497	1.723	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)Cc2ccc(C(=O)NNC(=O)c3ncn(C)n3)cc2)cc1	809983486	LGMRJGBSRKBDEH-UHFFFAOYSA-N	442.501	1.019	50	20	IDGD	
CCOc1ccccc1N1C[C@@H](C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)CC1=O	812732528	KKHARGADTXGGDK-HNNXBMFYSA-N	446.529	1.832	50	20	IDGD	
CCNC(=O)COc1cccc(NC(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)c1	812919667	WJLJNXVZINTTHQ-UHFFFAOYSA-N	435.506	1.600	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@H]2CCc3nncn3C2)cc(C)c1Br	815691456	QQZXBLSUFDPOQL-NSHDSACASA-N	435.282	1.006	50	20	IDGD	
CCNC(=O)c1ccc(C)c(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)N(C)C)c1	815751518	CJRCVQIDIFIJQY-UHFFFAOYSA-N	447.517	1.077	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1nc(C(C)(C)C)cs1	815751940	VJXHAQVUZHGBKR-UHFFFAOYSA-N	425.536	1.773	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@@H](CN1CCCC1)c1ccccc1	816828964	WMCLBJGYWQJSFH-SFHVURJKSA-N	443.573	1.929	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)N(C)Cc2ccccc2S(N)(=O)=O)c1C	817261599	UXPBJIXNZLTEMO-XDHOZWIPSA-N	430.530	1.964	50	20	IDGD	
CC(=O)N1CCN(c2ccc(C(=O)NNC(=O)CNc3ccccc3)cc2[N+](=O)[O-])CC1	823327947	QWCNJLKMJJCKFC-UHFFFAOYSA-N	440.460	1.136	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NC[C@H]1CN(Cc2ccccc2)CCO1	915894111	HWMIDMIQGXZITC-UZLBHIALSA-N	430.480	1.824	50	20	IDGD	
COc1cc(C(=O)NNC(=O)COc2ccccc2F)ccc1OCC(=O)NC(C)C	916093282	LPEDXYBVIBPYJU-UHFFFAOYSA-N	433.436	1.578	50	20	IDGD	
O=C(NN=Cc1c(N2CCCCC2)nc2ccccn2c1=O)[C@@H]1COc2ccccc2O1	916292080	PHGWDQCKXYRLHC-IBGZPJMESA-N	433.468	1.975	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)NCCN1CCN(c2ccccc2)CC1	916514824	OTXMKLSAKJJVDW-KRWDZBQOSA-N	429.496	1.746	50	20	IDGD	
COC(=O)NNC(=O)c1cc(S(=O)(=O)NCCOc2ccccc2)ccc1Cl	916559940	RXNXCAQTTKOMFH-UHFFFAOYSA-N	427.866	1.698	50	20	IDGD	
COc1ccc(/C=C(\C#N)C(=O)OCC(=O)NNC(=O)c2ccc(OC)c(OC)c2)cc1	916617148	AGYQSQVDXGUBAN-MHWRWJLKSA-N	439.424	1.624	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CNC(=O)c2cccc(Br)c2)cc1	916830444	YRQVDWWOYPBPQF-UHFFFAOYSA-N	433.262	1.273	50	20	IDGD	
CCc1c(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cnn1-c1ccccn1	917903622	BTGWRERFXVJJFI-UHFFFAOYSA-N	447.543	1.803	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NCc2cccc(N3CCOC3=O)c2)c2ccccc2c1=O	919658903	UCAFYMXHFCINDP-UHFFFAOYSA-N	436.428	1.034	50	20	IDGD	
CCN(CC)[C@H](CNC(=O)NNC(=O)C(=O)NC1CC1)c1ccc(C(F)(F)F)cc1	920919438	NUNAFYNBLAXUKA-OAHLLOKOSA-N	429.443	1.697	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)Cc2ccc(C(=O)NNC(=O)[C@H]3CCOC3)cc2)cc1	921202814	GCVCNCYUHSHLKJ-SFHVURJKSA-N	431.514	1.613	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)CCn2cnc3sccc3c2=O)CC1	1116082965	BPJXVJCPDFAECA-UHFFFAOYSA-N	449.533	1.643	50	20	IDGD	
CNS(=O)(=O)c1ccc(Br)c(C(=O)NNC(=S)Nc2ccccn2)c1	1261913816	IJKUDVBPTDWOHS-UHFFFAOYSA-N	444.336	1.384	50	20	IDGD	
Cc1ccc(C(=O)NCC(=O)NNC(=O)c2ccc(CSc3nncn3C)cc2)s1	1317764573	UHZMGAUTYXQHDP-UHFFFAOYSA-N	444.542	1.668	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3ccnc(OC4CCC4)c3)CC2)cc1	1319674516	CLCVDIOYUHBDSU-UHFFFAOYSA-N	437.544	1.900	50	20	IDGD	
COc1ccc(N(C(C)=O)c2nc(C=NNC(=O)[C@@H]3CCS(=O)(=O)C3)cs2)cc1	1321784219	SYLVHSWPGIODEN-CYBMUJFWSA-N	436.515	1.721	50	20	IDGD	
O=C(NCC(=O)N1CCCC1)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	1339312872	XRITXUXNOFHGAR-UHFFFAOYSA-N	448.483	1.011	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H]1C[C@@]13C(=O)Nc1ccccc13)C2)[C@H](F)Cl	1778027819	AQCUIZHNAXOHEC-NKFCYASASA-N	449.910	1.945	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnc3ncccn13)C2	1779544083	KFNIFBFJGANHIX-DYESRHJHSA-N	445.596	1.708	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)Cc3ccc([N+](=O)[O-])c(OC)c3)C2)C1	1781192861	QWTMXXZTALGOAN-FOIQADDNSA-N	439.896	1.993	50	20	IDGD	
COc1ncc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](F)Br)C3)C2)cc1F	1781326614	QPKBEYGNGXKWOR-LRDDRELGSA-N	434.237	1.363	50	20	IDGD	
O=C(CCOc1ccccc1)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781328737	XWACQOJZHROOHL-SJLPKXTDSA-N	429.286	1.976	50	20	IDGD	
COCCOCCOCCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Cl)C2	1782064783	AMCSZCJVZNIVME-HHXXYDBFSA-N	438.924	1.104	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(F)nc1F)C2	1782166683	HNIRSQDOJAFMMV-PJIJBLCYSA-N	431.867	1.741	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(OC)cc1O)C2	1782173766	OMLKLIRRWBJJRY-HGHGUNKESA-N	440.924	1.782	50	20	IDGD	
COc1ccccc1CC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1783328095	BICBFXIVFCWQDF-SJLPKXTDSA-N	429.286	1.758	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)COc3ccc(O)cc3)[C@H]2C1	1783843275	ZSTYQZFEPVQSRK-PYTWLRIVSA-N	441.322	1.534	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3csc(C(F)(F)F)n3)CCO2)C1	1783877939	SEAFCSPUMPQQEG-BONVTDFDSA-N	441.859	1.859	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(C(F)(F)F)nc3)C[C@@H]21)[C@H](O)CCl	1784086408	LMBPHXXDVADOFS-FQUUOJAGSA-N	435.830	1.293	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3ncccc3OC)[C@H]2C1	1785247670	GWBURCJYYJYELO-FPXQBCRKSA-N	439.940	1.256	50	20	IDGD	
CCC1(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)/C(C)=N/NC(=O)c4ccc[nH]4)[C@H]3C2)CCC1	1787508452	JSGVRXQXCDCHTA-BODMQJBDSA-N	443.548	1.680	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)c1cn2ccccc2n1	1787840949	KRHBQXKSFWWSSR-LMRQPLJMSA-N	439.285	1.618	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(O)nc4ccccc34)[C@H]2C1	1787903562	HNWLSXNNHARKHI-KUZCPNRJSA-N	447.919	1.788	50	20	IDGD	
Cc1ccc(SCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](O)CCl)C[C@@H]32)cc1	1788094246	LUMYXNKAOLLXQM-DKIMLUQUSA-N	426.966	1.667	50	20	IDGD	
O=C(NC1(c2ccc(NC(=O)c3nc[nH]c3[N+](=O)[O-])cc2)CCC1)c1ccc(B(O)O)cc1	1788611644	KXOBAECTEXXIAS-UHFFFAOYSA-N	449.232	1.059	50	20	IDGD	
C=C(CC(=O)OCC)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]2C1	1789871977	KJBXPKDTWILGTA-XMDUPGNXSA-N	435.348	1.712	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCCn3ccnc3)C[C@@H]21	1790963359	GHIUGCYNRXQQOH-NXOAAHMSSA-N	441.370	1.817	50	20	IDGD	
CCOc1ncccc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](Cl)COC)[C@H]2C1	1791251146	XOJLJYXEYKQIIG-HJWJTTGWSA-N	425.913	1.327	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnn4cccc(C)c34)C[C@@H]21	1791257254	USBPFWHCXFJYFE-DKIMLUQUSA-N	434.924	1.490	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]3C2)n1	1791294242	OIGQDOUVGQBMQU-OBJOEFQTSA-N	429.304	1.437	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(Cl)cnc1O	1792390841	URUMMWVNRHMNHT-ORXSELOVSA-N	432.702	1.427	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(Cl)ccc1F)c1cccc(B(O)O)c1	1792772082	MPCKAVHDQMPXRT-BJWYYQGGSA-N	430.672	1.725	50	20	IDGD	
CC(C)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1CCC3(CC1)OCCO3)C2	1792785667	OTBIUOWQUSVSOZ-BJWYYQGGSA-N	428.957	1.774	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnn(-c3cccnc3)c1)C2	1795112862	WMMRVFTWSLNLEG-JLVBRIDZSA-N	448.321	1.256	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](CCN)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C(Cl)Cl)C2	1796031148	YAGDGFVOUVJQKF-YVECIDJPSA-N	437.368	1.670	50	20	IDGD	
O=C1Nc2c(cccc2C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](F)Br)C3)C1=O	1798209137	ZJCTULGTSJQPHK-DRNSDYETSA-N	438.253	1.764	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ncon1)C2	1799220656	OQGMTSNTUHLSTQ-CLLJXQQHSA-N	429.389	1.469	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(C=O)s1)C2	1800640136	VTWMLZUVHNXUSM-WJNVRWDZSA-N	429.336	1.937	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)n1ccccc1=O)C2	1800641724	IFTIPSUMPFOCPP-XGYYKPKNSA-N	440.338	1.172	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CC(c3ccccc3)=NN1)C2	1800762731	ZMPUSSRDPAGJMC-IVFVNLKQSA-N	449.349	1.126	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(Cl)nc(OC)c1)C2	1800978318	AITKBNXUVSMFCY-OQMKEHIESA-N	432.304	1.201	50	20	IDGD	
CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@](C)(Cl)CCl)C2	1802843833	LEFMNFDYCZPTFH-BZKOTJRBSA-N	444.363	1.331	50	20	IDGD	
CC(C)(CCl)C(=O)NC[C@H]1CCN(C(=O)CCc2nc(N)n[nH]2)[C@H]1c1cccnc1	1802901068	LZZLHQVDZPMFJV-PBHICJAKSA-N	433.944	1.686	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2n[nH]c3ccccc23)[C@@H]1c1cccnc1)[C@H](O)CCl	1803143025	RDVLQJWKJFBECT-POZUXBRTSA-N	427.892	1.877	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)Cc2cncnc2)[C@H]1c1cccnc1	1804654787	VBIAGSSDBVDQLL-QANKJYHBSA-N	432.322	1.904	50	20	IDGD	
Cc1ccsc1C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1805395761	DXUNNQYFFGRCGB-QUCCMNQESA-N	449.341	1.765	50	20	IDGD	
Cc1cccc(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)n1	1805508500	WAKHIDJQLFHGNL-KNQAVFIVSA-N	444.300	1.098	50	20	IDGD	
N[C@@H](Cc1cccnc1)C(=O)NC[C@@H]1CCN(C(=O)C(Cl)Cl)[C@H]1c1cccnc1	1808365669	WRQOUMKFCCTMDV-ULQDDVLXSA-N	436.343	1.856	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)c2cnoc2)[C@H]1c1cccnc1	1808417586	NCNCMAMXIFCSAN-YRJCQSRDSA-N	449.471	1.523	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2c[nH]c(=O)cn2)[C@@H]1c1cccnc1)[C@@H](F)Br	1808676150	NKAXFGAZHCECLB-NILFDRSVSA-N	438.257	1.175	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)Cn2nccn2)[C@@H]1c1cccnc1)[C@H](F)Br	1808676539	UFKNVKHXIWCNID-CFVMTHIKSA-N	425.262	1.070	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC2(CCCN(C(=O)c3ccc(C=O)s3)C2)CC1	1809988492	FIVMRINNZIZOLA-UHFFFAOYSA-N	434.562	1.778	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1ccccc1F	1811673528	PFOIPAQGIYJATK-PGRDOPGGSA-N	447.275	1.534	50	20	IDGD	
COc1ccc(C(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@H]2c2cccnc2)c(O)c1	1811749779	HYEGZXAYUVRQTD-KYNGSXCRSA-N	433.892	1.715	50	20	IDGD	
C[C@H](Cc1ccncc1)C(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1	1812334169	NDMSPINHAMFBBW-XWPNQZOQSA-N	430.936	1.961	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)[C@H]2CCC(=O)N2)[C@H]1c1cccnc1	1812774693	CWWLAUBMLLZFIH-DLTWYDFYSA-N	437.338	1.540	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)[C@@H]2CCC(=O)N2C)[C@H]1c1cccnc1	1812869188	SIGIDSORJJXKFB-QEWYBTABSA-N	437.338	1.492	50	20	IDGD	
C[C@H](C(=O)NC[C@H]1CCN(C(=O)CO[Si](C)(C)C)[C@H]1c1cccnc1)n1cncn1	1813402466	QRMDXVCDEWOPCL-SUMDDJOVSA-N	430.585	1.792	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)Cc2ccc(O)cn2)[C@H]1c1cccnc1	1813500369	ZRSKGGPKSYKXLW-MOXGXCLJSA-N	432.908	1.685	50	20	IDGD	
C=CCOCCCC(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1	1815335685	KGEWVJZINBJBMD-INIZCTEOSA-N	443.334	1.032	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccnc(F)c2)[nH]n1)c1ccc(B(O)O)cc1	1817470104	IZPJAOIRGYRFJX-QGZVFWFLSA-N	437.240	1.243	50	20	IDGD	
CNC(=S)NCCC(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](F)Br)[nH]n1	1819408040	VZIPLHPHQNYQBC-ZWNOBZJWSA-N	449.350	1.576	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1ncccc1F	1819972742	UKAFDJUIBGMGEN-QGZVFWFLSA-N	437.240	1.243	50	20	IDGD	
Cn1ccc(=O)cc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](F)Br)CC2	1821314025	PSTJOBWFKTXGQG-OQPBUACISA-N	443.298	1.758	50	20	IDGD	
C[C@H](Br)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](C)CS(C)(=O)=O)[nH]n1	1822183673	GIOPZFDJLXOLHZ-GVXVVHGQSA-N	449.371	1.866	50	20	IDGD	
C[C@H](Br)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H]2CCNC(=O)C2)[nH]n1	1822191242	DYHKYFWFSRKYKH-DMDPSCGWSA-N	426.315	1.711	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccnc2C(N)=O)[nH]n1	1822367337	LQKIGPMBGUXIGD-TZMCWYRMSA-N	434.884	1.463	50	20	IDGD	
CCNC(=S)NCC(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](Cl)COC)n[nH]1	1822377506	XFWFJEJDRHICMU-AAEUAGOBSA-N	430.962	1.140	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1	1823003021	GLEAIXQEDHLYQL-VFWDIBGWSA-N	435.319	1.612	50	20	IDGD	
O=C(c1ccncc1F)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827059979	ZRMIDNWAHHQLST-NRFANRHFSA-N	439.296	1.448	50	20	IDGD	
COC[C@@H](NC(C)=O)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CCBr)CC1	1829112760	DBDMCYIADLWPCP-SJORKVTESA-N	446.386	1.542	50	20	IDGD	
C/C(=C\c1ccc(C)o1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1830732092	UPSGWONONDFZSK-YZDOQNMSSA-N	426.897	1.047	50	20	IDGD	
CC(C)[C@H]1CC[C@H](C(=O)N2CCOC[C@]3(CN(C(=O)[C@@H](O)CCl)CCO3)C2)CC1	1830736752	WOPYDCPBUWVSMW-RYLXDESZSA-N	430.973	1.505	50	20	IDGD	
Cc1cccnc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1831834840	IPSJNZHYIRTZEW-YOEHRIQHSA-N	430.274	1.151	50	20	IDGD	
CNc1nsnc1C(=O)NC1CCN(C2CCN(C(=O)C(Cl)Cl)CC2)CC1	1833072960	AUNRRCAXGKKIDJ-UHFFFAOYSA-N	435.381	1.569	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3c[nH]c4nccc-4c3)CC2)CC1)[C@@H](O)CCl	1833310282	GCHYTGRZYTZOIT-SFHVURJKSA-N	433.940	1.299	50	20	IDGD	
CCc1cc(C(=O)N2CCC(N3CCC(NC(=O)CCBr)CC3)CC2)n[nH]1	1834421626	ATSJKNBKRMHYHO-UHFFFAOYSA-N	440.386	1.942	50	20	IDGD	
O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)CCBr)CCO2	1834822474	PKGDBBPLJVBTAJ-CQSZACIVSA-N	442.148	1.013	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)c3ccc(O)cc3)C2)C1	1834823676	BQYFDFMREOXXTR-SFHVURJKSA-N	427.295	1.247	50	20	IDGD	
Cc1cc(C(=O)N2CCC(N3CCC(NC(=O)CO[Si](C)(C)C)CC3)CC2)nn1C	1835833572	SRXPTFHMTBLIQC-UHFFFAOYSA-N	435.645	1.765	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)CCc3cn[nH]c3)CC2)CC1)[C@@H](F)Br	1836414165	XDXXOJXGMAZRQX-QGZVFWFLSA-N	444.349	1.604	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)CC3(O)CCC3)CC2)CC1)[C@@H](F)Br	1836414533	PRQHOTGITGZESI-MRXNPFEDSA-N	434.350	1.554	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1Cc3ccccc3O1)CCO2	1836649766	AMJHWAAOMJTVGJ-SIKLNZKXSA-N	448.592	1.298	50	20	IDGD	
C[C@@H](Nc1ccccc1)C(=O)N1CCO[C@@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1	1837338406	KIBXYWRLJVXEHB-XMSQKQJNSA-N	449.624	1.795	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@H](C)n3cccn3)CC2)CC1	1838786825	QWRCDRZKFYSZQT-YJBOKZPZSA-N	426.945	1.697	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)cc1F	1838916374	PEYXZZKHEGPKRB-LIRRHRJNSA-N	443.313	1.988	50	20	IDGD	
CCc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)cn1	1839197813	JDDUEDAAVLVWIG-MAUKXSAKSA-N	444.301	1.405	50	20	IDGD	
O=C(CCc1ccccn1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839198047	RCMHXNDJBCXUQY-WMZOPIPTSA-N	444.301	1.161	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CC3CCOCC3)C2)C1	1839963561	OHFCKWRIPJBNGC-QFBILLFUSA-N	447.370	1.433	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1839966325	AUPWNVGPOHVNCG-HZMBPMFUSA-N	432.142	1.420	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)s1	1840030979	BRJOSDMTZZRPGX-GUYCJALGSA-N	431.352	1.910	50	20	IDGD	
COc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)cc1	1840034618	REDFVGSHDDGPNQ-LIRRHRJNSA-N	441.322	1.549	50	20	IDGD	
O=C(c1n[nH]c(C2CC2)c1F)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840186631	RNALHHCEAUVMTK-KRWDZBQOSA-N	435.283	1.300	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)n1ccnc1C)CCO2	1840489559	YNRMRJMRSCBKSW-RIFZZMRRSA-N	426.945	1.616	50	20	IDGD	
O=C(c1cc(F)cc(F)c1F)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1840719237	BNWUJUFUNLWLCA-KRWDZBQOSA-N	441.233	1.978	50	20	IDGD	
O=C([C@@H](O)CCl)N1CC2(CCCN2C(=O)[C@@H]2CCCN2C(=O)c2ccc(F)cc2)C1	1841307484	MGBLFQJYHVSHNY-IRXDYDNUSA-N	437.899	1.233	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H]1CCC[C@@H](C(=O)N2CC3(CCCN3C(=O)[C@H](O)CCl)C2)C1	1841354524	FQJSNULDDAFWOP-OWCLPIDISA-N	443.972	1.873	50	20	IDGD	
Cc1snc2sc(C(=O)N3CCCC34CN(C(=O)c3ccc(B(O)O)cc3)C4)cc12	1843242075	JCHARJYVPZIPBL-UHFFFAOYSA-N	441.343	1.477	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCCC12CN(C(=O)[C@H](C)NC(=O)c1ccccn1)C2	1846071997	AHSDJMJYTPGNLV-UONOGXRCSA-N	437.338	1.577	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)[C@H]2CCc3ccccc3C2)C1	1846092818	ZMWCOIAPYGQWNJ-SFHVURJKSA-N	433.512	1.307	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@]23C[C@@H]2CCN3C(=O)OC(C)(C)C)C1	1846192706	PEEHJEJUNUUJNW-VFCRVFHLSA-N	441.956	1.843	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)c1c(C)nn(-c3ccccc3)c1O)C2	1846360935	OBCJVBQZFYDOPE-MRXNPFEDSA-N	432.908	1.957	50	20	IDGD	
CS(=O)(=O)c1ccc(Cl)c(C(=O)N2CCCC23CN(C(=O)[C@H](O)CCl)C3)c1	1846922080	ACKSYOAQIKLSLZ-CQSZACIVSA-N	435.329	1.160	50	20	IDGD	
CC(=O)N[C@@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1)C(C)C	15846607	IVQRGDQKWVRMLH-LJQANCHMSA-N	446.529	1.087	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)CCN1C(=O)[C@H](C)Oc2ccccc21	16205312	TYYKMDPFHDVMOC-HNNXBMFYSA-N	435.484	1.950	50	20	IDGD	
Cc1nnc(NNC(=O)[C@@H](NS(=O)(=O)c2ccc3ccccc3c2)C(C)C)nc1O	21127957	SFAZNXPSKJSEOI-INIZCTEOSA-N	430.490	1.485	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)CN1C(=O)N[C@@]2(CCCC[C@@H]2C)C1=O	25413498	SWCFVKMZZSYFHM-LHSJRXKWSA-N	432.477	1.112	50	20	IDGD	
C[C@H](C(=O)NNC(=O)c1ccc(F)cc1Br)N1C(=O)NC2(CCCC2)C1=O	726526981	ZIBWUPQTDUQQOQ-SECBINFHSA-N	441.257	1.602	50	20	IDGD	
Cn1cnnc1SCC(=O)Nc1cccc(C(=O)NNC(=S)NCC2CCC2)c1	727866341	FDPACKSNYFVZNQ-UHFFFAOYSA-N	433.563	1.455	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCCCC(=O)NNc2nc(-c3ccncc3)no2)cc1C	728073497	JSJFIEWSLXRYFP-UHFFFAOYSA-N	430.490	1.950	50	20	IDGD	
O=C(COC(=O)[C@H]1CCCN1c1ncnc2sccc12)NNC(=O)c1ccccc1	728673192	OXWOJYDEUXBADM-OAHLLOKOSA-N	425.470	1.665	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)c1ccc2c(c1)C(=O)N(CCc1ccccc1)C2=O	728852756	UPVLZVDKHYNBSU-UHFFFAOYSA-N	428.448	1.924	50	20	IDGD	
COc1cccc(C[C@H](C(=O)NNC(=O)Cn2ccc3ccccc32)n2nnnc2C)c1	729450647	ISIRFACLCDOHMS-HXUWFJFHSA-N	433.472	1.576	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1)NNC(=O)Cn1ccc2ccccc21	729452048	QTQAALJKIBOQQL-UHFFFAOYSA-N	445.457	1.066	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)NCCc1ccc(OCC(=O)NC2CC2)cc1	729496959	HDHJKMPDNWLKKH-UHFFFAOYSA-N	449.511	1.872	50	20	IDGD	
CCS(=O)(=O)N1CCC(C(=O)NNC(=O)c2ccccc2OC)(c2ccccc2)CC1	731493083	PALHHRSTGSNWOY-UHFFFAOYSA-N	445.541	1.840	50	20	IDGD	
C[C@H](NC(=O)CCC(=O)NNC(=O)NCC1CC1)C(=O)c1ccc(Br)cc1	732062687	HHKQGJCHONUADN-NSHDSACASA-N	439.310	1.657	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)[C@@H]1CCCN(S(=O)(=O)c2c(C)n[nH]c2C)C1)c1ccccc1	732132909	KLRBXNDEFOVRTM-QZTJIDSGSA-N	447.561	1.768	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN(C)[C@@H]2CCN(c3ccccc3Cl)C2=O)n1	732206848	HNRWQKOCYJBAED-OAHLLOKOSA-N	435.937	1.532	50	20	IDGD	
Cc1nc2c(C#N)cnn2c(C)c1CCC(=O)NNC(=O)c1cnn(-c2ccccc2)c1	733110746	RXERUSLIOUNCFI-UHFFFAOYSA-N	428.456	1.797	50	20	IDGD	
CN(C)CC(=O)NNC(=O)c1ccc(Cl)c(NS(=O)(=O)c2ccc(F)cc2)c1	733359163	DEOVLSMFRYWDMZ-UHFFFAOYSA-N	428.873	1.603	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)c1nn(-c2ccccc2F)c2c1CCC2	734240961	XZONYARKCJTOIK-UHFFFAOYSA-N	446.483	1.969	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(=O)n(CC(=O)NNc2nccc3sccc23)c1	734246696	IXMCWUMLITUTJL-UHFFFAOYSA-N	435.531	1.632	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(C(=O)NNc2ccccc2S(=O)(=O)NC(C)(C)C)o1	734251627	KEEAVNZCWXWDHV-UHFFFAOYSA-N	444.535	1.364	50	20	IDGD	
CC(=O)N(c1nc(C=NNC(=O)Cc2csc(N3CCOCC3)n2)cs1)C1CC1	734296465	LFPTXXRDLMEXBB-UHFFFAOYSA-N	434.547	1.644	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)CCSc2ccc3c(c2)OCCO3)c1	737503979	ZXANFSGUCKRHFQ-UHFFFAOYSA-N	436.511	1.805	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)N[C@@H]2CCC[C@@H](S(C)(=O)=O)C2)nc1	741093161	NPGQSLJMGFTDHA-ZIAGYGMSSA-N	447.583	1.094	50	20	IDGD	
O=C(CN1C(=O)c2ccccc2S1(=O)=O)NNC(=O)c1cccc(Br)c1	742770492	ZYWXGLZATNZJJM-UHFFFAOYSA-N	438.259	1.055	50	20	IDGD	
COc1ccc(N2CCN(CCNC(=O)NNC(=O)COc3ccc(C)cc3)CC2)cc1	743363651	VFUAYYYTLKMLNE-UHFFFAOYSA-N	441.532	1.535	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)N[C@@H]1CC(=O)N([C@@H]2C[C@H]2c2ccccc2)C1	743509949	NRXQRQGKQUUKGP-FGTMMUONSA-N	438.484	1.561	50	20	IDGD	
CC(C)(C)CNC(=O)c1ccc(C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)cc1	745183855	VXRUCDDMAPTYJM-UHFFFAOYSA-N	436.468	1.952	50	20	IDGD	
COc1ccc2c(c1)OCC[C@H]2NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	745861029	HOIAGSIQYGTHAA-QGZVFWFLSA-N	448.501	1.413	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)C1CCN(C(=O)CCc2ccccc2)CC1	746549906	JDYFSFADDFESPO-UHFFFAOYSA-N	433.512	1.896	50	20	IDGD	
COc1ccc(N2CCN(CCCNC(=O)NNc3nc(C)cc(OC)n3)CC2)cc1	746743865	YBTARRHALFTYAA-UHFFFAOYSA-N	429.525	1.641	50	20	IDGD	
C[C@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)NNC(=O)c2ccc(Cl)cc2F)C1=O	747330541	BSTTXZVQSJZVNK-LJQANCHMSA-N	436.802	1.846	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)NCCNS(=O)(=O)c2cccs2)cc1	747437630	MLQCLRPQHNUUPZ-UHFFFAOYSA-N	428.561	1.458	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)CCCC#N)cc2)c1	748175176	WSNHZKLZXSQONY-UHFFFAOYSA-N	449.510	1.242	50	20	IDGD	
COc1ccc(-n2c(C)cc(/C=C(\C#N)C(=O)NNC(=O)C(=O)N3CCCC3)c2C)cc1	748246533	BYHCTOONSXWSJG-QGOAFFKASA-N	435.484	1.780	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)[C@H]2CCCN2C(=O)c2ccc3c(c2)OCO3)c2ccccc21	749563917	OENRAUCHTPEZAO-GOSISDBHSA-N	434.452	1.973	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1CN(CC(=O)NNC(=O)c1ccc(C#N)cc1)CC2	750063441	SJVCWOXMPIIYHW-ROUUACIJSA-N	427.505	1.793	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)N[C@H]1CCN(CCCc2ccccc2)C1=O	750659544	HUGMBSZRPZHSFZ-KRWDZBQOSA-N	441.444	1.478	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCCC(=O)NNc2cc(Cl)nc(COC)n2)cc1	753978960	CCQOJVOBYCCZEJ-UHFFFAOYSA-N	443.913	1.487	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)Nc1ccc(S(=O)(=O)C(F)F)cc1	755443514	HIKPFCNYBULKDL-UHFFFAOYSA-N	437.388	1.125	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)n([C@@H]2CCS(=O)(=O)C2)n1	755529140	CEQCLYRRGAJGNM-HZPDHXFCSA-N	449.533	1.788	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)c2cc(Cl)ccc2O)n([C@H]2CCS(=O)(=O)C2)n1	755530920	IABXZOCQLUDCAZ-NSHDSACASA-N	427.870	1.377	50	20	IDGD	
COCCCn1ccc(NC(=O)NNC(=O)COc2ccc(Br)cc2)n1	756660025	RDXUSANZXRSLQG-UHFFFAOYSA-N	426.271	1.914	50	20	IDGD	
Cc1c(NC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cccc1S(=O)(=O)NC1CC1	756705549	NHVMIPZENKNFSA-UHFFFAOYSA-N	433.446	1.810	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)COc2ccccc2C#N)ccc1S(=O)(=O)N(C)C	757776452	QFIGCCIFNZFGKF-UHFFFAOYSA-N	447.473	1.049	50	20	IDGD	
CC(=O)c1ccc(NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1C	757781340	RODJJYPMQOSLPI-UHFFFAOYSA-N	432.502	1.979	50	20	IDGD	
CS(=O)(=O)CCn1cccc(NC(=O)NNC(=O)c2ccc(Cl)cc2F)c1=O	757782079	VTGCNSXSBFNZQZ-UHFFFAOYSA-N	430.845	1.152	50	20	IDGD	
COC(=O)Nc1ccc(NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1F	757996679	KLBBOHLVFZNITR-UHFFFAOYSA-N	428.380	1.717	50	20	IDGD	
Cc1cc(C(=O)N2CCN(S(=O)(=O)CBr)CC2)nn1-c1ccc(F)cc1	758535498	OXJUYIQDAMUPAD-UHFFFAOYSA-N	445.314	1.760	50	20	IDGD	
Cc1ccc(CNC(=O)NNC(=O)CNC(=O)c2cccs2)c(O[C@H]2CCOC2)c1	758862976	UWXSOEQSYYAVMB-HNNXBMFYSA-N	432.502	1.485	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc2c(c1)COC2)NNC(=O)Cc1cccc2ccccc12	759687540	AHHANWXDAFCDGO-UHFFFAOYSA-N	439.493	1.538	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccnn3-c3cc(C)ccn3)n[nH]2)cc1	760276342	CZDBMJPLTYZJOR-UHFFFAOYSA-N	444.455	1.674	50	20	IDGD	
CCOc1ccc(N2C[C@H](C(=O)NNC(=O)CCNC(=O)OC(C)(C)C)CC2=O)cc1	760442354	JSKZNRSLTIDKND-CQSZACIVSA-N	434.493	1.500	50	20	IDGD	
O=C(O)c1cc(Br)cc(S(=O)(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c1	762462609	KWFSVOHPIXGJJI-UHFFFAOYSA-N	444.219	1.679	50	20	IDGD	
O=C(CCNC(=O)c1ccc(Br)cc1)NNc1nccc(N2CCOCC2)n1	762856311	KGYWNGFHZMXDPX-UHFFFAOYSA-N	449.309	1.339	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1cc(N2CCCC2=O)ccc1Cl	763466550	JIWNTARSQRFEHL-UHFFFAOYSA-N	445.819	1.775	50	20	IDGD	
COCCOc1c(Cl)cc(NC(=O)C(=O)NNC(=O)c2ccccn2)cc1Cl	763467156	NIMOARJWLJXOJA-UHFFFAOYSA-N	427.244	1.813	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2c[nH]c3ccccc23)ccc1N1CCCC1=O	763540638	IHXKQYPJUPWVPC-UHFFFAOYSA-N	435.440	1.703	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccc(-c2nccc(C)n2)c1	763663458	IZLDFKYSDMKERY-UHFFFAOYSA-N	435.440	1.626	50	20	IDGD	
CCN1C(=O)CCc2cc(NC(=O)C(=O)NNC(=O)COc3ccc(C#N)cc3)ccc21	763682643	YMQVKGHUCWTRNN-UHFFFAOYSA-N	435.440	1.022	50	20	IDGD	
CS(=O)(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)cc1	763735247	OYMLQKVVFZHBHO-UHFFFAOYSA-N	433.530	1.534	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2cc(C)n(-c3cccc(F)c3)n2)c1	763771705	DXYSIGBIJUYCBG-UHFFFAOYSA-N	441.419	1.737	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2ccnc(OCC(F)(F)F)c2)c1	763774783	FXWJVLHICVXHFR-UHFFFAOYSA-N	442.350	1.440	50	20	IDGD	
CCc1nnc(-c2cccc(NC(=O)C(=O)NNC(=O)c3cc(OC)cc(OC)c3)c2)o1	763775888	XMBLBALOALUXRB-UHFFFAOYSA-N	439.428	1.716	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2ccc(OC)c(Cl)c2)c2ccccc2c1=O	763787385	ZBEGAWDANYUVAX-UHFFFAOYSA-N	443.847	1.478	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)C(=O)N1CC2(CCC2)c2c(F)cccc21	763790725	NTFNRGIWMHWHEN-UHFFFAOYSA-N	435.415	1.704	50	20	IDGD	
CC(C)(C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)cc1	763808547	YEDBUUAVJUHISG-UHFFFAOYSA-N	437.456	1.251	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cnn(C[C@H]3CCCO3)c2)c1C	763842279	YNORVPZVEOXZJL-DOTOQJQBSA-N	429.477	1.232	50	20	IDGD	
Cc1cc(S(C)(=O)=O)ccc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1cccc(C)c1C	763849735	MODDQMZZOALIOI-HNNXBMFYSA-N	447.513	1.569	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(Br)c2)cn1	763883846	RJPFWHRYODVYNO-SNVBAGLBSA-N	437.250	1.406	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccnn2Cc2ccccn2)cc1OC	763900439	JIWCQPPNGDIFFE-UHFFFAOYSA-N	438.444	1.133	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(OC)cc2C(=O)OC)cc1OC	763912657	QVSJFFBSQUEKGH-UHFFFAOYSA-N	445.428	1.289	50	20	IDGD	
COc1c(Cl)cccc1NC(=O)C(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	763947934	FVWALIPXIBFRNR-UHFFFAOYSA-N	429.820	1.640	50	20	IDGD	
O=C(NNC(=O)c1cc(Cl)ccc1O)C(=O)Nc1ccc(N2CCOCC2)c(F)c1	763976923	IUSVNBYKKCWECM-UHFFFAOYSA-N	436.827	1.421	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(Br)c2)c(Cl)n1	764058219	FMWHDNJKHRSOSN-UHFFFAOYSA-N	427.642	1.906	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(NS(C)(=O)=O)c(Cl)c2)c(O)c1	764110636	SFMNJSRVZAQWFT-UHFFFAOYSA-N	440.865	1.125	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1cc(C)n(-c2cccc(F)c2)n1	764136821	UGAFPZUZASENHH-UHFFFAOYSA-N	425.420	1.657	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2O1)C(=O)Nc1c2c(nn1-c1ccccc1)CCC2	764164528	RJUFNOJBLOPETN-IBGZPJMESA-N	431.452	1.451	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)C(=O)Nc1ccc(C)c(S(=O)(=O)NC)c1)c1ccccc1	764327277	WRYPOEZEDLGVTC-MRXNPFEDSA-N	432.502	1.183	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccnn2[C@@H]2CCN(Cc3ccccc3)C2)o1	764371379	ZDGHMWFJKJRMAT-QGZVFWFLSA-N	436.472	1.631	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2ncccc2C)cc1N1CCCCC1=O	764385851	NCXREOZARRMCJI-UHFFFAOYSA-N	425.445	1.315	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1)C(=O)Nc1cccc(OCCF)c1	764387250	HEQQQZLFPLZGLE-UHFFFAOYSA-N	429.383	1.964	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccc(OC)cc2)c1)N(C)C	764396970	SBZJPJXUYNAZPG-SFHVURJKSA-N	434.518	1.597	50	20	IDGD	
CO[C@H](C)C(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2F)c1	764410888	WEWCFJFXDAFXTQ-SNVBAGLBSA-N	436.827	1.852	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)OC(C)(C)C)c(C)c1S(=O)(=O)NC1CC1	765389598	IXEKHQXNNNHFQU-UHFFFAOYSA-N	426.495	1.239	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3ccc(-n4cccn4)nc3)n[nH]2)cc1OC	765596736	KYGVJEXGWWBYPZ-UHFFFAOYSA-N	433.428	1.749	50	20	IDGD	
Cc1nc(CC(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)c(C)s1	765757550	WJLPACDZBCJCSG-UHFFFAOYSA-N	435.981	1.921	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@@H]2CN(Cc3ccccc3)C[C@H]2C)c2ccccc2c1=O	765890882	HBHYSJSSCDRSAH-OXQOHEQNSA-N	448.527	1.881	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)N[C@@H]1C[C@@H](OC(C)C)C1(C)C	766086243	VWPJOJBZBNCWCL-ZIAGYGMSSA-N	425.555	1.824	50	20	IDGD	
CN1CCO[C@@H]([C@@H](NC(=O)NNC(=O)C(=O)Nc2ccccn2)c2ccc(Cl)cc2)C1	766319560	MZCLISPKCFEKBY-WBVHZDCISA-N	446.895	1.076	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)c1cn(-c2cccc([N+](=O)[O-])c2)nn1	767338306	BUVFCSUBSGAKCW-UHFFFAOYSA-N	438.400	1.031	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)[C@@](C)(NC(=O)OC(C)(C)C)c3ccccc3)nc21	767924394	AOQUNVDFNRYLQF-FQEVSTJZSA-N	427.465	1.952	50	20	IDGD	
COCCN(CCNC(=O)NNC(=O)c1nnc(O)c2ccccc12)C(=O)OC(C)(C)C	768120156	AWJPTQYNOQNZMV-UHFFFAOYSA-N	448.480	1.163	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)NC2CCN([C@H]3CCCC[C@H]3O)CC2)cc1	769165519	ZFOALRIJSIDDQF-TYCQWZJGSA-N	448.564	1.951	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccnn1-c1cccc(F)c1	770774583	RFFULIMAELHBFK-UHFFFAOYSA-N	425.420	1.739	50	20	IDGD	
Cc1cn2c(=O)c(C(=O)NNC(=O)CCN3CCN(c4ccccc4)CC3)cnc2s1	772558787	VUQZFGAOCCBNDZ-UHFFFAOYSA-N	440.529	1.038	50	20	IDGD	
C[C@H]1Oc2ccccc2N(CC(=O)NNC(=O)[C@H]2CCCN(C(=O)OC(C)(C)C)C2)C1=O	773416521	BUQDVZZANCXDAV-CABCVRRESA-N	446.504	1.595	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NNC(=O)c2ccccc2Cn2cncn2)C1	773418565	KFZWPIQWJRRNQL-MRXNPFEDSA-N	428.493	1.735	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ccccc2[N+](=O)[O-])cc1-n1nnnc1C1CC1	773654877	HVHZBKXIAXAKDX-UHFFFAOYSA-N	438.404	1.538	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2cccc(N3CCN(CC4CC4)CC3)c2)n1	773724663	YEHUEMUCKLDABY-UHFFFAOYSA-N	425.493	1.099	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NC[C@@H]1CCCCN1S(=O)(=O)CBr	774879290	ZEVUPEYVWNUSPZ-LBPRGKRZSA-N	442.376	1.554	50	20	IDGD	
COc1cc(C)nc(NNC(=O)N[C@@H]2CCN(c3cccc(Br)c3)C2=O)n1	775222910	VEASYDKEQMZFHJ-CYBMUJFWSA-N	435.282	1.988	50	20	IDGD	
CN(C)C(=O)[C@@H]1CC[C@H](CNC(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)O1	775461721	QZUFSTKRBCSOQV-YPMHNXCESA-N	438.428	1.242	50	20	IDGD	
COc1cccc([C@@H]2[C@H](C(=O)NNC(=O)Cc3cn4ccccc4n3)CC(=O)N2C2CC2)c1	776335071	XHZKDGMXZAGWDJ-AUSIDOKSSA-N	447.495	1.785	50	20	IDGD	
CCOC(=O)N1CCC[C@@H]([C@H](C)NC(=O)NNC(=O)c2cc(Br)c[nH]2)C1	776844084	DLLYUFFCDVOHLP-WDEREUQCSA-N	430.303	1.978	50	20	IDGD	
Cc1cc(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)nn1[C@@H](C)C1CC1	777405136	GVVODXZZWGGUJD-HNNXBMFYSA-N	433.534	1.940	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNc3ccc4ccccc4n3)CC2)cc1	777460715	UPLQOKRDLCYEFN-UHFFFAOYSA-N	439.541	1.993	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)NC[C@H]1CC(=O)N(C2CC2)C1	780890305	FEFXLUKREMBGOL-LLVKDONJSA-N	425.283	1.169	50	20	IDGD	
COC(=O)[C@@H]1[C@H](O)CCCN1C(=O)CCC(=O)C(C#N)=C1N(C)c2ccccc2N1C	781456710	ILARKDYXBOBLQC-QUCCMNQESA-N	426.473	1.182	50	20	IDGD	
COc1cccc(NNC(=O)[C@@H]2C[C@@H](O)CN2S(=O)(=O)c2ccc(Cl)cc2)n1	782047366	AZJSCSDUBCEUTJ-OCCSQVGLSA-N	426.882	1.011	50	20	IDGD	
O=C(NNc1ncncc1Cl)C(=O)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1	782166363	SSTOCJIAOFNYSY-HNNXBMFYSA-N	440.895	1.855	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)NCc2cccc(S(=O)(=O)N(C)C)c2)c1C	782770582	SZTZHKCAAWYZSJ-INIZCTEOSA-N	448.545	1.852	50	20	IDGD	
CC(C)N(C)S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ncnc3ccsc23)cc1	783254621	HLCVIFJLRYORON-UHFFFAOYSA-N	448.530	1.802	50	20	IDGD	
O=C(NNc1cncc(Cl)n1)C(=O)Nc1cc2c(cc1Br)OCCO2	783259688	HQZABRYOAYTQEF-UHFFFAOYSA-N	428.630	1.746	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccccc2O[C@H](C)C#N)nc1	783262484	DWWIKRLGZNFUTD-CYBMUJFWSA-N	446.489	1.141	50	20	IDGD	
Cc1ccnc(NNC(=O)C(=O)Nc2ccc(S(=O)(=O)N3C[C@H](C)O[C@H](C)C3)cc2)c1	783934128	MVIDVPKAOCGOTG-GASCZTMLSA-N	447.517	1.270	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CCOCC1)c1cccc(Br)c1	784429853	UUSCJNRVFGSVJY-CVEARBPZSA-N	436.306	1.651	50	20	IDGD	
CS(=O)(=O)N1CCc2c(NC(=O)C(=O)NNc3nc(C(F)(F)F)cs3)cccc21	785144956	AGKKCHZBGIZVDP-UHFFFAOYSA-N	449.436	1.566	50	20	IDGD	
CNS(=O)(=O)c1cccc(NC(=O)C(=O)NNc2nc(C(F)(F)F)cs2)c1C	785146351	OAZXPHUGHJWSOW-UHFFFAOYSA-N	437.425	1.460	50	20	IDGD	
COc1cc(F)cc(NNC(=O)C(=O)Nc2cccc(N3CCN(C(C)=O)CC3)c2)c1	785246696	OWRQGIAMTXGQNR-UHFFFAOYSA-N	429.452	1.585	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)c3cnn(C)n3)c2)c(C)c1	785669578	FZWKANRWDJVNPT-UHFFFAOYSA-N	428.474	1.308	50	20	IDGD	
CC[C@]1(C)Oc2ccc(NC(=O)C(=O)NNC(=O)c3cc([N+](=O)[O-])ccc3O)cc2O1	785993337	DCLLEPCSBUGSMJ-LJQANCHMSA-N	430.373	1.598	50	20	IDGD	
N#C/C(=C/C1CC1)C(=O)OCC(=O)N1CCN(S(=O)(=O)c2ccc3c(c2)CCC3)CC1	786673594	ILVIZHTUVSJYEP-UNOMPAQXSA-N	443.525	1.411	50	20	IDGD	
O=C(COC(=O)CCc1nnc(C2CCCC2)o1)NNC(=O)c1cccc([N+](=O)[O-])c1	786755922	YLGQQNYXQBVGNK-UHFFFAOYSA-N	431.405	1.572	50	20	IDGD	
N#C/C(=C\c1ccc(O)cc1)C(=O)Nc1ccc(NC(=O)CCN2C(=O)CNC2=O)cc1	787010978	SQULMWNXLZBKCP-RVDMUPIBSA-N	433.424	1.818	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)cc1C(=O)N(C)C(C)C	787543674	KYXYGDJZEQONOQ-UHFFFAOYSA-N	444.463	1.779	50	20	IDGD	
C[C@@H]1CCCCN1S(=O)(=O)c1ccc(C(=O)NNc2ccc(-n3ccnc3)nn2)cc1	788180759	FXQXEUJOVPUIDO-OAHLLOKOSA-N	441.517	1.982	50	20	IDGD	
Cc1nc(C#N)c(N2CCC(C(=O)NNc3ccc(S(=O)(=O)NC4CC4)cc3)CC2)o1	788655468	MEJGAPVUOFCZAS-UHFFFAOYSA-N	444.517	1.655	50	20	IDGD	
COc1nc(Br)ccc1NC(=O)C(=O)NNC(=O)COc1ccc(C)cc1	789587392	XIBWFRYDWNGISD-UHFFFAOYSA-N	437.250	1.326	50	20	IDGD	
COc1cncc(C(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)n1	790200080	YKAAYCGPCWCYPG-UHFFFAOYSA-N	433.471	1.422	50	20	IDGD	
CO[C@@H]1CCOc2c(NC(=O)C(=O)NNC(=O)COc3cc(C)cc(C)c3)cccc21	790951524	HVTKLKUFEVRAHZ-GOSISDBHSA-N	427.457	1.938	50	20	IDGD	
O=C(NNc1ccc(Cl)nn1)C(=O)Nc1ccc2c(c1)N(CC(F)F)C(=O)CS2	793017371	CYDUMJTUDUDMKG-UHFFFAOYSA-N	442.835	1.916	50	20	IDGD	
CCNC(=O)N(C)c1cccc(NC(=O)C(=O)NNC(=O)COc2ccccc2CC)c1	796989239	BHMXNMYHVVLPGG-UHFFFAOYSA-N	441.488	1.580	50	20	IDGD	
COc1c(C)ccc(NC(=O)C(=O)NNC(=O)CNC(=O)OCc2ccccc2)c1C	797370123	UREWZWMNJNINFM-UHFFFAOYSA-N	428.445	1.324	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CC[C@@H](C(=O)N(C)c3ccccc3)C2)cc1OC	797530850	ZLYYXQSELDPKQE-QGZVFWFLSA-N	440.500	1.450	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)C[C@H](C)O1	798105744	DYLHBJLKBXRSNL-JENIJYKNSA-N	432.521	1.434	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](O)[C@@H](O)c2nc3ccccc3s2)cc1C	798308369	WWDOWPSIEHCIPC-JKSUJKDBSA-N	428.470	1.094	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)c1ccccc1F)C(=O)NNC(=O)NCC(F)(F)F	798315488	IXZBLMIUHMMFOW-SNVBAGLBSA-N	446.448	1.118	50	20	IDGD	
Cn1cc2c(n1)CCC[C@H]2C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	798829229	CLYILHOSWZVUIC-MRXNPFEDSA-N	431.518	1.086	50	20	IDGD	
NS(=O)(=O)Cc1cccc(CNC(=O)NNC(=O)CC23CC4CC(CC(C4)C2)C3)c1	800717981	XXNAPBATQFVZHL-UHFFFAOYSA-N	434.562	1.912	50	20	IDGD	
CC(C)(C)OC(=O)N1CSC[C@@H]1C(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	802063800	QBZBHXKDZFYLND-CYBMUJFWSA-N	444.535	1.553	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)N[C@@H](C)CCNS(=O)(=O)c2ccccc2)cc1C	802529053	ORHWUMNEQKFKCE-KRWDZBQOSA-N	448.545	1.770	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C2(n3cccn3)CCN(C(=O)OC(C)(C)C)CC2)n1	803283732	VUPDLCUJKAWGMR-UHFFFAOYSA-N	428.493	1.774	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)c1cc(S(=O)(=O)N2CCC2)ccc1Cl	804957799	BKDHIMYXDMMYKE-UHFFFAOYSA-N	433.881	1.467	50	20	IDGD	
Cc1cc([N+](=O)[O-])ccc1NNC(=O)C(=O)Nc1ccc(S(=O)(=O)N(C)C2CC2)cc1	807455543	OJWBBFYMLLHYNP-UHFFFAOYSA-N	447.473	1.768	50	20	IDGD	
CCOC(=O)C(=O)c1cc(S(=O)(=O)NNC(=O)c2c(Cl)cccc2Cl)cn1C	808090327	YWXGVCKQNAFDNW-UHFFFAOYSA-N	448.284	1.701	50	20	IDGD	
CC[C@H]1[C@@H](C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)CCN1C(=O)OC(C)(C)C	810107065	VLFPHHMFDLIOFN-HOTGVXAUSA-N	439.534	1.887	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCC(=O)NNc2cccnc2Cl)cc1OCC	810493662	GVSFMTKNLVSUPG-UHFFFAOYSA-N	428.898	1.954	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)c2cc(Cl)ncc2Br)cc1	811393394	HADVGHUHEDVDFO-UHFFFAOYSA-N	437.637	1.987	50	20	IDGD	
COc1ccc2c(c1)C1(CC1)CN(C(=O)NNC(=O)C1CCN(c3ncccn3)CC1)C2	811874485	MIKHTOHZUICBBX-UHFFFAOYSA-N	436.516	1.990	50	20	IDGD	
O=C(NNC(=O)C(=O)NC1CC1)N[C@H]1CCCc2c1[nH]c1ccc(Br)cc21	812431952	ACUGHOQSLFUZBH-AWEZNQCLSA-N	434.294	1.917	50	20	IDGD	
Cc1c(S(=O)(=O)NC(=O)/C(C#N)=C/c2cn(CCC#N)nc2-c2ccccc2)cnn1C	813954275	RRAJHHPJIKHOEU-GZTJUZNOSA-N	449.496	1.918	50	20	IDGD	
C[C@@H](Cc1cnc2ccccc2n1)C(=O)NNC(=O)c1csc(N2CCOCC2)n1	814736125	NLNXQYDAJKSAQU-ZDUSSCGKSA-N	426.502	1.563	50	20	IDGD	
Cc1ccc(NNC(=O)C(=O)Nc2nnn(Cc3ccc(C(F)(F)F)cc3)c2C)nn1	815593060	AMDWZKFFMFQEMB-UHFFFAOYSA-N	434.382	1.834	50	20	IDGD	
O=C(c1nnn(-c2ccc(Br)cc2)c1C(F)(F)F)N1CC[C@@H](B(O)O)C1	864234133	NJBSYJXEFDNCTE-MRVPVSSYSA-N	432.993	1.738	50	20	IDGD	
C[C@@H]1CCCCN1C(=O)CN1CCN(CC(=O)NNC(=O)c2ccccc2Cl)CC1	913053395	MLMFSEOKUFITCC-MRXNPFEDSA-N	435.956	1.120	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)CNS(=O)(=O)c2ccccc2F)c1	913419316	BHVHHYJVFGEPFP-UHFFFAOYSA-N	437.493	1.762	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NN=C2C(=O)Nc3c(F)ccc(Cl)c32)ccc1Cl	914559943	ZFWOBVNPUFMXSP-UHFFFAOYSA-N	431.232	1.866	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)cc1OC	914747912	UZNAKJNBVMLFTG-UHFFFAOYSA-N	435.502	1.713	50	20	IDGD	
COc1ccnc(NNC(=O)C2CCN(S(=O)(=O)c3cc(F)ccc3F)CC2)n1	914762794	JYUCUASFLSWCAE-UHFFFAOYSA-N	427.433	1.307	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)COc2cccc(NC(=O)C3CC3)c2)cc1	914936675	MQQURMPEHWEQBT-UHFFFAOYSA-N	425.441	1.727	50	20	IDGD	
Cc1ccc(C(=O)N2CCC[C@H](C(=O)OCC(=O)NNC(=O)c3cccs3)C2)cc1	914999473	BJKVHTMBYWEHBN-INIZCTEOSA-N	429.498	1.913	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)[C@@H]2CCCN(S(=O)(=O)c3ccccc3)C2)cc1C	915188504	SUIYCYNOZODGBN-GOSISDBHSA-N	445.541	1.931	50	20	IDGD	
Cc1nn(C(C)(C)C)c2nc(C3CC3)cc(C(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)c12	915831993	FIPSISMWDVXZJE-CYBMUJFWSA-N	433.534	1.568	50	20	IDGD	
O=C(NC[C@@H]1CN(Cc2ccccc2)CCO1)NNC(=O)c1cc(Br)c[nH]1	915893902	DOIDLDGFBOMOSU-OAHLLOKOSA-N	436.310	1.622	50	20	IDGD	
Cc1nc2ccccc2n1CCCNC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	915906842	RKDSGLGIKQJITH-UHFFFAOYSA-N	433.472	1.626	50	20	IDGD	
COc1ccc2c(=O)c(C(=O)NNC(=O)c3nn(C(C)C)c(=O)c4ccccc34)c[nH]c2c1	916093025	XKIGQUOMMRJGRL-UHFFFAOYSA-N	447.451	1.902	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2c(C)cc(C)nc2O)c1	916216346	GMMQUHSKQWKYFH-UHFFFAOYSA-N	449.533	1.579	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)NCc2ccc(OCCN(C)C)cc2)cc1C	916388252	BTRJIGJFQPFMRS-UHFFFAOYSA-N	427.505	1.713	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCN2CCC(C)CC2)c1	916451565	LRBKLBDSOCMWLR-UHFFFAOYSA-N	439.582	1.393	50	20	IDGD	
C=CCNS(=O)(=O)c1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)cc1	916561680	DBYFURYATRBXTD-UHFFFAOYSA-N	430.486	1.167	50	20	IDGD	
Cc1cc(NC(=O)[C@@H](C)SCC(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)no1	916562118	LFTCVSZGLHBGPU-CYBMUJFWSA-N	433.490	1.446	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)c2cc(OC)cc(OC)c2)sc(C)c1C	916562812	HIRNGULMUPMPIC-UHFFFAOYSA-N	449.485	1.959	50	20	IDGD	
CC(C)C(=O)N1CCCC[C@H]1C(=O)NNC(=O)c1ccc(CSc2nncn2C)cc1	917793630	YSOJSJURCFFNFR-KRWDZBQOSA-N	444.561	1.906	50	20	IDGD	
O=C(NNC(=O)c1noc2c1CCCC2)c1cccc(S(=O)(=O)N2CCCCC2)c1	917901985	CKIKWBQMBDULRI-UHFFFAOYSA-N	432.502	1.803	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCC(=O)N(C)Cc2ccccc2)nc1	918089284	BFXDFYRDCAJECZ-UHFFFAOYSA-N	448.549	1.397	50	20	IDGD	
O=C(NCC1(c2cccc(Br)c2)CCOCC1)NNC(=O)C(=O)NC1CC1	918097819	QHMDDJAWDMSDLA-UHFFFAOYSA-N	439.310	1.106	50	20	IDGD	
Cc1ccc([C@H](CNC(=O)NNC(=O)COc2ccc(C#N)cc2)N2CCOCC2)cc1	918099663	YKGWMKUDLDIFBN-NRFANRHFSA-N	437.500	1.649	50	20	IDGD	
CCN(CCCNC(=O)NNC(=O)c1ccc(-n2c(C)ccc2C)cc1)S(C)(=O)=O	918118775	AZKBLMZVFJRWIZ-UHFFFAOYSA-N	435.550	1.710	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)CC(F)(F)F)CC2)cc1	918364227	LYINKIBMXBPYNQ-UHFFFAOYSA-N	435.424	1.390	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2c[nH]nc2-c2ccncc2)cc1OC	919425439	PRRGXCNYXJIQPR-UHFFFAOYSA-N	425.401	1.107	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)CNC(=O)c1ccc(OC(F)F)c(OC)c1	919822996	ZDYCZJVOXJOVLB-UHFFFAOYSA-N	437.399	1.425	50	20	IDGD	
CCN(CC)C(=O)c1ccc(S(=O)(=O)NNC(=O)c2ccc(OC)c(OC)c2)cc1	920308344	DIDZVRZDFWZJME-UHFFFAOYSA-N	435.502	1.809	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NC[C@H](c2cccc(F)c2)N2CCOCC2)cc1	921247576	HRZSSELPXXXUHL-HXUWFJFHSA-N	430.480	1.917	50	20	IDGD	
Cc1nc2cc(O)nn2c(C)c1CC(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1	1116086878	DNOATZSRVDPCHJ-UHFFFAOYSA-N	446.508	1.389	50	20	IDGD	
O=C(NNC(=O)c1n[nH]c2c1CCCC2)c1cccc(NN2C(=O)[C@H]3CC=CC[C@@H]3C2=O)c1	1116877263	LJBNNOZJNIGPHH-HOTGVXAUSA-N	448.483	1.641	50	20	IDGD	
C[C@@H](CN1CCN(c2ccccn2)CC1)NC(=O)NNC(=O)c1cncn1-c1ccccc1	1251922809	CZBFQENXVWEKRF-SFHVURJKSA-N	448.531	1.422	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NC2CCN(C[C@H]3CCOC3)CC2)cc(OC)c1OC	1328880947	PWTHOAKPAUKRAL-CQSZACIVSA-N	436.509	1.157	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3n[nH]c4c3CC[C@H]4C)C2)C1	1777845141	CVARCYALGIADMC-VLXJIEOASA-N	439.354	1.934	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4c(c3)n(C)c(=O)n4C)C2)C1	1777864950	QXMKJRIFTUQTBR-OPAMFIHVSA-N	448.951	1.728	50	20	IDGD	
O=C(c1cnc2[nH]ncc2c1)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1778416549	OBGBQSRFWLCYKZ-LRDDRELGSA-N	426.246	1.092	50	20	IDGD	
Cc1nc2sccn2c1C(=O)N1CC[C@@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1778719916	COVYUJOFHUJAKT-LJQANCHMSA-N	436.610	1.999	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)c3cc4ccccc4o3)CCO2)C1	1779029904	BHZDFPNNTQCNKP-HSZRJFAPSA-N	449.467	1.189	50	20	IDGD	
CN(C)c1ccc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)cn1	1779763334	HJISZTHTLLYUTB-YOEHRIQHSA-N	429.290	1.282	50	20	IDGD	
Cn1cc(CCC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](F)Br)C2)cn1	1780771092	BQIPDIWJEFYOCI-UWWQBHOKSA-N	445.333	1.557	50	20	IDGD	
Cc1ncccc1CCC(=O)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781325512	DQGYNCQWHVPAGL-FUHWJXTLSA-N	428.302	1.843	50	20	IDGD	
O=C(c1nccc2occc12)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781331377	PWFSNUAUJAZKQA-YOEHRIQHSA-N	426.242	1.962	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)c(F)c1	1781334030	USFXOHDUAJKCSM-PBHICJAKSA-N	433.249	1.968	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)C3(Br)CC3)C2)C1	1781340637	MVJZJYBOPFAAJQ-SMDDNHRTSA-N	438.160	1.775	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc[n+]([O-])c1)C2	1781996833	UQIWCHBZDROHMI-DDUZABMNSA-N	426.311	1.231	50	20	IDGD	
CS(=O)(=O)c1ccc(F)c(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](F)Cl)CCO3)c1	1782152405	RXZXSNFXHNVKPM-RHSMWYFYSA-N	436.864	1.207	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)nc2nccn12	1782355039	PPBLMEXXNUZODT-CXAGYDPISA-N	440.273	1.172	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@]2(C1)CN(C(=O)c1cc(O)no1)CCO2	1782867516	PJTSEEPJXYNIDC-MYHKYFONSA-N	444.394	1.709	50	20	IDGD	
C/C=C(/C)C(=O)N1CC[C@]2(C1)CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)CCO2	1783081768	SHVDXZSQTZAMIB-FMOCQCRYSA-N	431.445	1.930	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cc(OC)nn3C)CCO2)C1	1783345051	WOELKBGYYIQWEE-SJKOYZFVSA-N	429.315	1.046	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc4nn[nH]c4c3)CCO2)C1	1783355487	UARISGOWKSYNIB-UGSOOPFHSA-N	436.310	1.575	50	20	IDGD	
CCSc1ncccc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21	1783410530	GEZJFFKPEFWTSI-HNKHHVNMSA-N	427.954	1.387	50	20	IDGD	
CC(C)(C)OC(=O)NC(C)(C)C(=O)N1CCO[C@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783943076	SSWSIWVESSDFTB-SFHVURJKSA-N	438.352	1.923	50	20	IDGD	
C[C@H](Cc1ccccn1)C(=O)N1CC[C@]2(CN(C(=O)[C@@H](F)Br)CCO2)C1	1784287617	XNLUJFLBVLNAEC-DDUZABMNSA-N	428.302	1.781	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CNC(=O)c3cccs3)[C@H]2C1	1785330335	GVCLZRHIGOXQKW-VGWMRTNUSA-N	441.981	1.865	50	20	IDGD	
C#CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](Cl)CC)CCO2	1785575837	GJVYBGYCPMIEJE-XFQAVAEZSA-N	441.956	1.750	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(C(=O)O)ncn3)[C@H]2C1	1785645433	NHZNLJACNJKAGX-KSSIRIBKSA-N	445.303	1.004	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(F)(C(=O)N2CC[C@]3(CN(C(=O)[C@H](F)Cl)CCO3)C2)C1	1785685790	OLFSHWYCIUNTPF-SJCJKPOMSA-N	437.871	1.310	50	20	IDGD	
O=C(C[C@H]1NC(=O)NC1=O)Nc1ccc(C2(NC(=O)[C@@H](F)Br)CCC2)cc1	1786761729	JVMVBFVEBFMDDM-DGCLKSJQSA-N	441.257	1.409	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3nnsc3C3CC3)[C@H]2C1	1787679845	LPNKRWLCVVKGNX-FQUUOJAGSA-N	428.942	1.263	50	20	IDGD	
COc1ccc2cc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)[C@@H](O)CCl)C[C@@H]43)[nH]c2c1	1787905389	CTUUZAHKJXMWRJ-BMIPRAEKSA-N	435.908	1.370	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3nn[nH]c3C(F)(F)F)[C@H]2C1	1789359319	FVOCMQJVASDWIZ-SRVKXCTJSA-N	449.506	1.268	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)c1cc(O)ccc1O	1790263356	APFZKAAIFYNRIL-PJODQICGSA-N	427.295	1.476	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3C[C@H]4CC[C@@H]3O4)C[C@@H]21	1790964524	REELZXZUSFMVLA-NGLPHOLESA-N	429.355	1.707	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3cccc(F)c3F)[C@H]2C1	1790983595	REGRVCDBTUSLFZ-MPTYRVRUSA-N	430.879	1.741	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@H]1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(C)(C)CCl)C[C@@H]21	1791230603	ZRIZGNXNUNNMNL-PNKHAZJDSA-N	440.968	1.987	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3ccccc3OC)C[C@@H]21	1791249844	RTQNMWFJTNMHHS-JPLJXNOCSA-N	438.952	1.861	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3COc4ccccc4O3)C[C@@H]21	1791252557	MQXOJRZJTGRFAR-FLKCQLHMSA-N	438.908	1.060	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)n3cccc3C=O)C[C@@H]21	1791254886	VWECFUTZOUNUOU-IAVJCBSLSA-N	425.913	1.095	50	20	IDGD	
COC(=O)[C@H]1CC[C@H](C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]3C2)CC1	1791292754	OKFJTSBNIOJYOI-YTFOTSKYSA-N	435.348	1.749	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1ccc(C2(NC(=O)[C@@H]3CCCCN3C)CCC2)cc1	1791596076	NYNZDCDWQQFESS-IBGZPJMESA-N	429.565	1.978	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](CN)c1ccccc1)C2	1792867954	ONTJXQUIYGXNIM-JFMONLCZSA-N	438.366	1.350	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)Cn1ccnc1)C2	1792873322	SIVLDGAIAJXFEQ-DGXTUMSLSA-N	427.343	1.140	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2)[C@H]1CCc2ccoc2C1	1793122229	BTCKXPAVWFZGAT-AFIMGQEJSA-N	425.323	1.759	50	20	IDGD	
COc1cc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Br)C3)ccn1	1793901727	RYNUYFZGOOBYNZ-RMHZUWNSSA-N	444.301	1.303	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cncc3cnccc13)C2	1795114870	HFAPVTYRTGQIGW-ZSBFGKGUSA-N	433.306	1.618	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@@H](C)C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](F)Cl)cc1	1796805016	UOGJOOYOPAOFCJ-JBXGNFEISA-N	445.944	1.834	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2n(n1)CCCC2	1797443044	GIBKFINISJFVHB-YXPYIKCWSA-N	439.354	1.596	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnnc3ccccc13)C2	1797955981	SOKFYFFXFZGNQA-YVWYUNDQSA-N	428.565	1.685	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CC(=O)N(Cc3ccccc3)C1)C2	1799263255	IAZPSYUNGRARCM-GQUPQBGVSA-N	447.963	1.642	50	20	IDGD	
COc1ncc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@](C)(Cl)CCl)cc1C	1799277659	UKKGVUFLXIBLNH-YGTYGHESSA-N	430.332	1.838	50	20	IDGD	
C[C@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](F)Br)[C@@H]1SC(=N)NC1=O	1800159282	PKBTVPCJUHYRHF-OJHQEIPXSA-N	435.319	1.118	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2)[C@H]1Cc2[nH]nc(C(F)(F)F)c2C1	1800321659	XVBZPJJJOLWNGS-PEZYRPDVSA-N	438.809	1.267	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C#CC1(O)CCCCC1)C2	1800642146	YNUGPPMMWSFXPJ-DFGXFYAUSA-N	441.366	1.448	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1Cc3ccccc3N1)C2	1800643444	SFFCSLQBVXNXHY-CRCOGDFISA-N	436.350	1.786	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(C(F)(F)F)ccn1)C2	1800977185	SXTKUPXXTJDQKA-NDPMZMCLSA-N	435.830	1.557	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1nc3cc([N+](=O)[O-])ccc3[nH]1)C2	1802280822	VPVCBCOULDDHJK-GFQSEFKGSA-N	435.868	1.977	50	20	IDGD	
CC(C)(CCl)C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1802899496	CZFWXKADXKLDPK-IEBWSBKVSA-N	443.740	1.346	50	20	IDGD	
Nc1ccccc1/C=C/C(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]1c1cccnc1	1803138905	PJPCSMUSBBXNEI-BHSHMPGXSA-N	428.920	1.983	50	20	IDGD	
CN1N=C(C(=O)NC[C@H]2CCN(C(=O)CO[Si](C)(C)C)[C@H]2c2cccnc2)CCC1=O	1804120578	KADZJECWCMUSRZ-UZLBHIALSA-N	445.596	1.547	50	20	IDGD	
Cc1ccc(F)cc1C(=O)N1CCCC2(CCN(C(=O)c3ccc(B(O)O)cc3)CC2)C1	1805057260	OUOVRUFYESUJHU-UHFFFAOYSA-N	438.308	1.973	50	20	IDGD	
COc1cccc(CC(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@H]2c2cccnc2)c1	1806551802	HTHLYRARAFROMV-DSKINZAPSA-N	431.920	1.938	50	20	IDGD	
CCC(=O)C(=O)N1CC[C@@H](CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@@H]1c1cccnc1	1808416106	DRVCWKPAGMBQCS-TYNUBOESSA-N	438.488	1.201	50	20	IDGD	
C[C@]1(C(=O)N2CC[C@H](CNC(=O)[C@H](F)Br)[C@@H]2c2cccnc2)CCCN1	1808675496	BWKNOWKAJYWJSG-LDDOYCOJSA-N	427.318	1.920	50	20	IDGD	
O=C(CCc1cccnc1)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1	1809966615	IDGLUNCOENIRQC-UHFFFAOYSA-N	435.333	1.239	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)c1nn[nH]c1C(F)(F)F	1811562134	DCPAAXVJZCHBKK-GMXVVIOVSA-N	446.817	1.138	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)CO[Si](C)(C)C)[C@@H]1c1cccnc1	1813072823	HBDOMUNIXXPEBO-DYESRHJHSA-N	449.628	1.312	50	20	IDGD	
Cc1nc(C)c(C(=O)N2CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)o1	1813073879	PKQBHDBTKNIPQY-YLJYHZDGSA-N	442.520	1.379	50	20	IDGD	
C=CCC(F)(F)C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1813074017	NSOIOBCIUALFPE-VQIMIIECSA-N	437.491	1.672	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@H]2ON=C(c3ccccc3)O2)[nH]n1)[C@H](O)CCl	1814872209	FNBFTFZQGSMRRH-BXTJHSDWSA-N	447.879	1.736	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CO)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](F)Cl)[nH]n1	1817974885	RAWRNPJAEMABAT-OBJOEFQTSA-N	447.895	1.822	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@H](O)CCl)CC2)c1cnnc2ccccc12	1818179021	FYUXNKYIUFZZNB-MEBBXXQBSA-N	431.905	1.912	50	20	IDGD	
O=C(COC(=O)C(F)(F)F)Nc1nc2c(s1)C[C@H](NC(=O)C(Cl)Cl)CC2	1819616786	YRCNLEBQJOXYCR-RXMQYKEDSA-N	434.223	1.964	50	20	IDGD	
C[C@H](Cn1cncn1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCBr)CC2	1820066296	MIYGHUFLEHYNOI-GHMZBOCLSA-N	441.355	1.768	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(CO)on2)[nH]n1)[C@@H](F)Br	1820939022	DBYFDMWLRDINIJ-WCQYABFASA-N	430.234	1.886	50	20	IDGD	
O=C(CCBr)N[C@H]1CCc2nc(NC(=O)c3cc[n+]([O-])cc3)sc2C1	1821047403	MWURHXGBTSDFOC-NSHDSACASA-N	425.308	1.787	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCc2ccc(O)nn2)n[nH]1	1821640893	ZFCOGALIIWUCIR-HIFRSBDPSA-N	436.900	1.784	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)CCBr)[nH]n1)[C@H]1CCCS1(=O)=O	1821830764	AVJXRNIISZMNHT-QWHCGFSZSA-N	447.355	1.764	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](C)Br)n[nH]1	1822189610	WOHWDTOLQOMSFJ-DMDPSCGWSA-N	426.315	1.876	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)COC(=O)C(F)(F)F)[nH]n1	1822369761	HXGCOBDSAYPILV-ONGXEEELSA-N	440.806	1.761	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnncc2C(=O)O)[nH]n1	1822373129	VAZLHLRAQLXKCC-OCCSQVGLSA-N	436.856	1.458	50	20	IDGD	
C[C@@H](CS(C)(=O)=O)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)C(Cl)Cl)n[nH]1	1822419394	XLNPBIPQYHICTN-GXSJLCMTSA-N	425.338	1.886	50	20	IDGD	
C[C@H](C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1)n1cccc1	1822678467	YLFMMICIJSTHAD-NVXWUHKLSA-N	429.525	1.838	50	20	IDGD	
CCS(=O)(=O)CC(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H](F)Br)CC1	1824468260	YICVDJRJWKVEHA-HIFRSBDPSA-N	441.363	1.731	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccno2)CC1	1825917324	VCOQBTSVZLGJCD-KRWDZBQOSA-N	426.477	1.220	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnc(N(C)C)o1)CC2	1825994741	YRFPJZMJODEGAD-UWVGGRQHSA-N	427.914	1.677	50	20	IDGD	
CC(C)[C@@H](S)C(=O)N[C@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1	1826083946	VTHSBFDPVRQHCR-MEDUHNTESA-N	427.596	1.383	50	20	IDGD	
Cc1cccnc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827055873	MWVZUJDNQUWPOV-OAQYLSRUSA-N	435.333	1.617	50	20	IDGD	
CCc1cc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)n[nH]1	1827288968	YWIQHTQBTJZXMB-OAQYLSRUSA-N	438.337	1.199	50	20	IDGD	
CCCNC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830353625	HJZVYAWATSYBPF-FQEVSTJZSA-N	431.961	1.014	50	20	IDGD	
CC[C@H](NC(C)=O)C(=O)NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1	1833094953	ZONCSCNBSKWSFL-KRWDZBQOSA-N	445.402	1.258	50	20	IDGD	
Cc1c[nH]c(C)c1CCC(=O)N1CCC(N2CCC(NC(=O)[C@H](O)CCl)CC2)CC1	1833305969	HLTOTGGUYOYULW-HXUWFJFHSA-N	439.000	1.735	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3c[nH]c4cnccc34)CC2)CC1)[C@@H](O)CCl	1833310143	KVWKNOIVHMITQQ-IBGZPJMESA-N	433.940	1.348	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnn(C(C)(C)C)c3)CCO2)C1	1833455627	WYJDNJPKZKXQKH-OXQOHEQNSA-N	426.945	1.726	50	20	IDGD	
Cc1nscc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1	1833746989	GHXXRAAGGXKEAF-IRXDYDNUSA-N	436.361	1.758	50	20	IDGD	
Cc1nc(C(=O)NC2CCN(C3CCN(C(=O)C(Cl)Cl)CC3)CC2)c(=O)[nH]c1C	1833939861	DLQPHFNNLTXKGP-UHFFFAOYSA-N	444.363	1.376	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC(N2CCC(NC(=O)c3cnsn3)CC2)CC1	1833978064	QYHIFOMUDGOZGG-UHFFFAOYSA-N	425.631	1.575	50	20	IDGD	
Cc1cnc(Cl)c(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)c1	1834324725	QQNFOBDKDYAEPA-KRWDZBQOSA-N	443.375	1.828	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)c3ccccc3)CC2)CC1	1836217337	BVPGXQDPNUBYFY-UHFFFAOYSA-N	429.565	1.245	50	20	IDGD	
O=C(c1ccc2cccnc2n1)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836717131	JUOSCZBWAWURQX-LJQANCHMSA-N	446.935	1.842	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccnn3-c3ccccc3)C2)C1	1839145062	SIBZCUIQJAZJJA-AVRDEDQJSA-N	446.935	1.960	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccc(OC)cc3C#N)C2)C1	1839146922	AMPPVKCRPLJANY-SIKLNZKXSA-N	449.935	1.583	50	20	IDGD	
Cc1cncc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)c1	1839151008	FKAGBDPZGDDAIA-MOPGFXCFSA-N	430.332	1.696	50	20	IDGD	
C[C@@]1(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)CC1(F)F	1839156384	NYZQHZNDEYPNOZ-JYJNAYRXSA-N	429.291	1.724	50	20	IDGD	
C=C(CC(=O)OCC)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](Cl)CCC)C2)C1	1839173315	JWSKCVUIWSZJNF-OXJNMPFZSA-N	430.929	1.360	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)CCO2)C1	1839414653	USPWNPBFZMFHFA-VQIMIIECSA-N	441.868	1.388	50	20	IDGD	
CN(C)c1c(F)cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)cc1F	1839468860	HVHUYWLQHXNKLT-LPHOPBHVSA-N	449.857	1.635	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)COc3ccccc3F)CCO2)C1	1839968039	MZPUNRBXVHIDPR-OAQYLSRUSA-N	442.915	1.926	50	20	IDGD	
C=CCOCCCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)Br)CCO2	1840030280	HOTBCOTWOORCIO-YJBOKZPZSA-N	433.343	1.209	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCN3CCCC3)CCO2)C1	1840940465	KOKCXAKKGJQEAU-RBUKOAKNSA-N	436.380	1.165	50	20	IDGD	
O=C([C@@H]1CCCN1C(=O)c1ccc(F)cc1)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1	1841348104	KFZLYNZIJZKGMF-IRXDYDNUSA-N	437.899	1.233	50	20	IDGD	
CC1(CC(=O)N2CC3(CCCN3C(=O)[C@H](O)CCl)C2)CN(C(=O)OC(C)(C)C)C1	1841354658	NDIWLFDPKAWOQQ-CQSZACIVSA-N	429.945	1.437	50	20	IDGD	
Cc1nn2cc(CC(=O)N3CCCC34CN(C(=O)CCBr)C4)nc2s1	1841786549	NGNQIMAEFYSZNX-UHFFFAOYSA-N	426.340	1.630	50	20	IDGD	
O=C(/C=C\c1c[nH]c2ccccc12)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843013160	OWRVRMCRZLHFSA-KTKRTIGZSA-N	429.285	1.378	50	20	IDGD	
O=C1COc2ccc(C(=O)N3CC4(CCCN4C(=O)[C@H](F)Br)C3)cc2N1	1845217987	GUFKJNWHVJZESQ-AWEZNQCLSA-N	426.242	1.525	50	20	IDGD	
O=C(COc1ccc(Cl)c(F)c1)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cccc(B(O)O)c1	1847769573	GDBZDRNJKWGTJW-OALUTQOASA-N	446.671	1.053	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2ccc(=O)n(Cc3ccccc3)n2)c2ccccc2c1=O	10086624	NFXXUSDBUTVWPZ-UHFFFAOYSA-N	444.451	1.096	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NN[C@@H](C(=O)NC1CC1)c1ccc(F)cc1	10173099	KCFZOWHDICMRSE-HSZRJFAPSA-N	439.535	1.979	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCC(C)(C)N2C[C@H](C)O[C@@H](C)C2)cc(OC)c1OC	10368883	ZLNKSJNTJBEUCX-KBPBESRZSA-N	438.525	1.544	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)CCn2c(=O)[nH]c(=O)c3ccccc32)cc1OC	12697297	XSCGEPWICINFGY-UHFFFAOYSA-N	440.456	1.339	50	20	IDGD	
CC(C)n1ncc2c(C(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)cc(-c3ccccc3)nc21	15639627	XUXRTTMNFGDRPD-HNNXBMFYSA-N	441.513	1.875	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1OCC	15902142	RMIAJONRAVPJIV-UHFFFAOYSA-N	449.529	1.874	50	20	IDGD	
COc1ccc(N2C[C@H](C(=O)NNC(=O)c3cc(-c4ccccc4)n[nH]3)CC2=O)c(OC)c1	17519046	JEGKWEKGELJAOF-OAHLLOKOSA-N	449.467	1.908	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1ccc(-n2nccc2C)cc1	27193197	OWUHMMRWPLLRNP-UHFFFAOYSA-N	426.502	1.857	50	20	IDGD	
COCCCNC(=S)N(C)NC(=O)c1ccc2c(c1)C(=O)N(Cc1ccco1)C2=O	726076782	CNUJNUPKTONYKB-UHFFFAOYSA-N	430.486	1.563	50	20	IDGD	
O=C(NCc1ccc2c(c1)CCO2)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	726272631	ONLMWFCOUQXQLJ-UHFFFAOYSA-N	444.513	1.550	50	20	IDGD	
C[C@H]1CC(C)(C)C[C@]2(C1)NC(=O)N(CC(=O)NNc1nc(-c3ccncc3)no1)C2=O	726377427	YZDCHMIQYDPNAZ-YUNKPMOVSA-N	427.465	1.712	50	20	IDGD	
CCOCC(C)=NNC(=O)C[C@@H]1c2cc(OC)c(OC)cc2CCN1S(C)(=O)=O	726424406	RCPMZSJTEMXPAP-MRXNPFEDSA-N	427.523	1.481	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCCN(Cc3ccccc3C)CC2)cc1OC	727828003	IYPDFJBMHGMMIF-UHFFFAOYSA-N	440.544	1.981	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)Cn1cnc2scc(-c3cccs3)c2c1=O	728852564	GKILETNLHFMNMV-UHFFFAOYSA-N	425.495	1.972	50	20	IDGD	
CC(C)c1nc(C#N)c(NNC(=O)c2cc(S(N)(=O)=O)c(Br)s2)o1	729528405	ADPNCQUYADFDKB-UHFFFAOYSA-N	434.297	1.898	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)Cc2coc(-c3cccs3)n2)cc1OC	730058628	PUBICZQSMCZUJR-UHFFFAOYSA-N	445.453	1.967	50	20	IDGD	
Cc1ccc(Cn2nc(C)c(CCC(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)c2C)cc1	730164983	DRCWJNYULZZUHD-SFHVURJKSA-N	432.546	1.371	50	20	IDGD	
COc1ccccc1[C@@H](NC(=O)NNC(=O)COc1ccccc1O)c1nccn1C	730905842	VKYHZRUVDAFQSX-LJQANCHMSA-N	425.445	1.633	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])cc1	731059024	NMRORHZFMPXOPH-UHFFFAOYSA-N	431.792	1.076	50	20	IDGD	
NC(=O)c1ccccc1N1CC[C@H](NC(=O)NNC(=O)NCc2ccc(Cl)cc2)C1	732997976	FLVNXWDGSDLIIB-HNNXBMFYSA-N	430.896	1.731	50	20	IDGD	
Cn1c(NNC(=O)[C@H](Cc2ccccc2)NC(=O)c2cccnc2)nc2ccccc2c1=O	733261475	BZGGSQXPGUTEMD-FQEVSTJZSA-N	442.479	1.813	50	20	IDGD	
CCOCCCn1c(NNC(=O)[C@@H]2CC(=O)N(CC(C)C)C2)nc2ccccc2c1=O	733265949	NQSFAYGVPJCSMV-MRXNPFEDSA-N	429.521	1.771	50	20	IDGD	
Cc1nc(-c2ccccn2)nc(NNC(=O)C2=NN(c3ccccc3)[C@H](C(N)=O)C2)c1C	734256159	MLWZSSKUAYFTBD-SFHVURJKSA-N	430.472	1.719	50	20	IDGD	
COC(=O)[C@H](NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)c1ccc(F)cc1	735506657	DJVPGACFTKHCJQ-GOSISDBHSA-N	435.477	1.759	50	20	IDGD	
CC[C@H](C)[C@H](NC(=O)N1CCCC1)C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C	736091070	BMFWYDFNEHTULG-KBPBESRZSA-N	428.534	1.062	50	20	IDGD	
Cc1nn(C)c2sc(C(=O)N[C@H](C)C(=O)NNC(=O)CCc3ccccc3O)cc12	743338181	LBXFKBYPJVOSTO-GFCCVEGCSA-N	429.502	1.547	50	20	IDGD	
COc1cccc(OCCCNC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)c1	743624544	LGXIIYZBJJHVLK-UHFFFAOYSA-N	436.490	1.904	50	20	IDGD	
CN(C[C@@H]1CCCN(CC(=O)NNC(=O)c2cccc(C#N)c2)C1)C(=O)OC(C)(C)C	744393950	VVLLAVVGSLAAHS-KRWDZBQOSA-N	429.521	1.898	50	20	IDGD	
C[C@@H](CC(=O)OCC(=O)NNC(=O)c1cccc(C#N)c1)S(=O)(=O)c1ccc(F)cc1	744957772	OGTBVLJPWJPFPF-ZDUSSCGKSA-N	447.444	1.254	50	20	IDGD	
NS(=O)(=O)c1ccc(CNC(=O)NNC(=O)Nc2ccc(OC(F)F)cc2)cc1	745258231	LDKUOBCGSYHNQM-UHFFFAOYSA-N	429.405	1.471	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NCC(=O)Nc2ccc(F)c(F)c2)cc1	745283170	OOKSXBPVDDSNRU-UHFFFAOYSA-N	441.416	1.343	50	20	IDGD	
CCOCC(=O)NNC(=O)N[C@@H](c1cccc(S(C)(=O)=O)c1)c1ccc(F)c(F)c1	745903289	FKYMCISTGJKUNI-SFHVURJKSA-N	441.456	1.825	50	20	IDGD	
Cc1noc(C)c1S(=O)(=O)NC1(C(=O)NNc2nc(-c3cccnc3)no2)CCCC1	746241688	NQYCIFWJDKSOOD-UHFFFAOYSA-N	447.477	1.471	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1	746555881	IQERVAHYCJQVFA-CYBMUJFWSA-N	442.457	1.299	50	20	IDGD	
CSc1nc(O)nc(C)c1C(=O)NNC(=O)COc1ccc(Br)cc1	747346035	TZIDRUJJJRUVMQ-UHFFFAOYSA-N	427.280	1.815	50	20	IDGD	
CS(=O)(=O)c1ccc(C(=O)NNc2ccc(S(=O)(=O)Nc3nccs3)cc2)o1	747942891	FPGZCGOMAAVDAO-UHFFFAOYSA-N	442.500	1.697	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)c2ccc3c(c2)NC(=O)[C@H](C)N3C)c2ccccc2c1=O	749866766	TYXCMYIECBNUIR-ZDUSSCGKSA-N	448.483	1.829	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)N[C@@H]1CCN(c2cccc(Cl)c2)C1=O	750670930	PEBOVVLISOTTPM-MRXNPFEDSA-N	427.848	1.726	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)NC1CCC(N2CCCCC2)CC1	751106326	MOWJGFLSCKUNRA-UHFFFAOYSA-N	429.569	1.821	50	20	IDGD	
C[C@H](NC(=S)NNC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(F)cc2)C1)C1CC1	751620693	XSFNAPVKMPEZNK-GXTWGEPZSA-N	428.555	1.520	50	20	IDGD	
CC(=O)NC[C@@H]1CCn2ncc(C(=O)NNC(=O)c3cc(-c4ccc(C)cc4)[nH]n3)c2C1	752834483	RASCWYILCBZRQH-OAHLLOKOSA-N	435.488	1.355	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N[C@H](C)CO[C@H]1CCOC1	753814251	XSSZKEQOSMLOHR-XUJVJEKNSA-N	430.299	1.741	50	20	IDGD	
O=C(CSc1nc(-c2ccccc2)no1)NNC(=O)c1csc(N2CCOCC2)n1	754848422	IOBAVYWXMHQYJV-UHFFFAOYSA-N	446.514	1.583	50	20	IDGD	
CCC1(C(=O)NNC(=O)c2cccc(S(=O)(=O)Nc3ccc(OC)cc3)c2)COC1	755036687	FTKXNNNLHSPNHN-UHFFFAOYSA-N	433.486	1.684	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)Nc1cccc(S(=O)(=O)NC2CC2)c1	755586046	QSEROOQFYITAIR-QGZVFWFLSA-N	432.458	1.120	50	20	IDGD	
CN(C)C(=O)COc1ccc(NC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])cc1	755646923	SCKGVALJTJVNOP-UHFFFAOYSA-N	431.405	1.294	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2c(F)c(F)cc(F)c2F)CC1	755810675	SFNUOEQFHCZBIE-UHFFFAOYSA-N	447.414	1.331	50	20	IDGD	
C=CCN(C)S(=O)(=O)c1ccc(NC(=O)NNC(=O)c2c(C)nc3ccccn23)cc1	755932054	JARNZEFALOWFKG-UHFFFAOYSA-N	442.501	1.916	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)Nc1ccc(-c2noc(C(F)(F)F)n2)cc1	756316540	ZUWOIRBUUPOJGB-VIFPVBQESA-N	433.368	1.343	50	20	IDGD	
COCCS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1	756555137	RTZYXXUVFFYXHX-UHFFFAOYSA-N	435.458	1.344	50	20	IDGD	
COCC[S@](=O)Cc1cccc(NC(=O)NNC(=O)COc2ccccc2C#N)c1	756614693	UVHRCPWATIFQSC-PMERELPUSA-N	430.486	1.685	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)Nc1ccc(C)c(S(=O)(=O)NC(C)(C)C)c1	756682869	QHBJUXFDMMNGKG-CYBMUJFWSA-N	430.527	1.276	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1N1CCOC1=O	756818491	NWUSCDBMQBLKCG-UHFFFAOYSA-N	438.404	1.094	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)CCc1nc2ccccc2n1-c1ccccc1	758036392	RJBPHCATPNCWBL-CQSZACIVSA-N	429.502	1.043	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)c1	758055511	QFAKERFKKQKGDW-UHFFFAOYSA-N	445.457	1.330	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)N[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1C#N	758751957	LPAUHXUQOXDKQO-GZBFAFLISA-N	435.456	1.682	50	20	IDGD	
CC(C)(C)OC(=O)NCC1(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)CC1	758826919	PHPRYAMOEXCUPV-UHFFFAOYSA-N	445.564	1.651	50	20	IDGD	
CC(C)C[C@@H](CCC(=O)NNC(=O)c1cccnc1)C(=O)NNC(=O)c1cccnc1	759108730	AJFWFSSKCVSNKU-OAHLLOKOSA-N	426.477	1.141	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)NC[C@H]1CSCCN1Cc1ccccc1	759328921	VXAAVQGYQBLKJI-IBGZPJMESA-N	439.541	1.885	50	20	IDGD	
O=C(Cc1csc(N2CCOCC2)n1)NN=C1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1	760242421	SPZNENJBARIVAU-HNNXBMFYSA-N	433.494	1.914	50	20	IDGD	
C[C@@H](C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1)c1cccc([N+](=O)[O-])c1	761971420	AXZAMSMVKKXEHG-CQSZACIVSA-N	434.474	1.863	50	20	IDGD	
CCOC(=O)C(C)(C)C(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	762937344	JGPBJKMQVDTNOV-UHFFFAOYSA-N	436.468	1.795	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)NCc3ccnc(OCCN(C)C)c3)n[nH]2)cc1	763102937	KAEXIGHAMWGQKW-UHFFFAOYSA-N	437.504	1.865	50	20	IDGD	
CN(C)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3n2)cc1Cl	763450236	LUIQBOPGOUMSDI-UHFFFAOYSA-N	439.859	1.990	50	20	IDGD	
Cc1ccc(C(=O)N2C[C@@H](C)C[C@H](C)C2)cc1NC(=O)C(=O)NNC(=O)c1cccnc1	763490685	BHZYCDXPHHLTLW-GJZGRUSLSA-N	437.500	1.908	50	20	IDGD	
Cc1cc(F)ccc1NC(=O)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	763511964	LFANBEKTLZVUDH-UHFFFAOYSA-N	448.476	1.318	50	20	IDGD	
CCN(CC)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1	763572683	NSFGBZLTUFKOKB-GOSISDBHSA-N	440.456	1.095	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)oc(=O)n3C)c(C)n1-c1ccccc1	763601706	HKMNMSVCBWHEHG-UHFFFAOYSA-N	447.451	1.939	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(F)c(C(N)=O)c2)c(C)n1-c1ccccc1	763603180	WLHCKIUUVDCGHZ-UHFFFAOYSA-N	437.431	1.732	50	20	IDGD	
C=CCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(C)nc3ccccc23)cc1	763615311	DGPGWGCBSJZHBZ-UHFFFAOYSA-N	431.452	1.859	50	20	IDGD	
CCOc1cc2c(cc1NC(=O)C(=O)NNC(=O)COc1ccc(OC)cc1)O[C@H](C)C2	763663718	NAYKAHJHQRBESH-CYBMUJFWSA-N	443.456	1.582	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2cccc(Cl)c2-n2cncn2)c1	763665288	SGLDWKCCCGLYBF-UHFFFAOYSA-N	442.863	1.702	50	20	IDGD	
O=C(COc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1ccc(N2CCCC2=O)cc1	763686679	PNIVAEHJPRZTSQ-UHFFFAOYSA-N	430.848	1.632	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccc(OC[C@H]2CCCO2)c1	763712112	KYZHKIQYHWQGAS-LJQANCHMSA-N	441.484	1.972	50	20	IDGD	
CCOc1cc(C)ccc1NC(=O)C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	763719259	WMEOGVRDOQWNNJ-UHFFFAOYSA-N	448.501	1.044	50	20	IDGD	
O=C(CN1CCCc2ccccc21)NNC(=O)C(=O)Nc1ccc(OCC(F)F)cc1	763746231	QZZKDIKCQHOYNM-UHFFFAOYSA-N	432.427	1.869	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(N3CCCC3=O)c(Cl)c2)cc1	763810763	AVZFUOXSIPLJOC-UHFFFAOYSA-N	444.875	1.940	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(C(=O)N3CCCC3)ccc2OC)cc1	763832838	VUARRIJXZTYRKD-UHFFFAOYSA-N	438.484	1.893	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)Cc2c[nH]c3ccccc23)ccc1N1CCCC1=O	763865720	SEHSBDJGNFJYIY-UHFFFAOYSA-N	449.467	1.632	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N(CC)CC)cc1NC(=O)C(=O)NNC(=O)CC(C)C	763888367	KALSTVKAMHMHOC-UHFFFAOYSA-N	442.538	1.248	50	20	IDGD	
Cc1ccc(-n2nc(C(C)C)cc2NC(=O)C(=O)NNC(=O)Cn2nc(C)cc2C)cc1	763892240	CJYJAKLAQCOIQG-UHFFFAOYSA-N	437.504	1.904	50	20	IDGD	
CCS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)CSc2ccc(C)cc2)cc1	763898248	OUNWCMGXJLBOJZ-UHFFFAOYSA-N	435.527	1.667	50	20	IDGD	
O=C(NNC(=O)c1ccc(Br)s1)C(=O)Nc1ccccc1-n1cncn1	763941146	ONSNRDNENLFSHF-UHFFFAOYSA-N	435.263	1.491	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCCCC3)cc1	763962888	ULYJZDICPOKQBF-UHFFFAOYSA-N	445.497	1.969	50	20	IDGD	
CC[C@@H](C)n1ncc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)c1C1CC1	764006251	NJSAPMUJLYWUBC-GFCCVEGCSA-N	427.461	1.902	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc(OCC2CCOCC2)cc1	764040415	HHPULDIVXDLATE-UHFFFAOYSA-N	427.457	1.900	50	20	IDGD	
Cc1n[nH]c(C)c1[C@@H](C)CC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	764140736	XEFGOGSJKKYIRU-AWEZNQCLSA-N	434.566	1.600	50	20	IDGD	
COc1ccc(Cn2nccc2NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)cc1	764164872	UPBKQIDMTFIHAE-GOSISDBHSA-N	435.440	1.030	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CCc2ccccc2)c(OCC(=O)N(C)C)c1	764193055	WNEHHIUSZZDHHJ-UHFFFAOYSA-N	426.473	1.181	50	20	IDGD	
CS(=O)(=O)c1c(F)cc(NC(=O)C(=O)NNC(=O)c2cc3ccccc3o2)cc1F	764330615	CWQZXPCCYCUUQE-UHFFFAOYSA-N	437.380	1.514	50	20	IDGD	
CCN(CC)CCn1ccc2cc(NC(=O)C(=O)NNC(=O)Cc3ccncc3)ccc21	764352816	DOJSBIHCSMUWQJ-UHFFFAOYSA-N	436.516	1.707	50	20	IDGD	
CN(C)C(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)c1	764387274	IEVWHXNYPJGRQB-UHFFFAOYSA-N	438.419	1.317	50	20	IDGD	
CCn1c(=O)c2ccccc2n(CC(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)c1=O	765569097	FPRBREPZSZXAKY-UHFFFAOYSA-N	438.469	1.096	50	20	IDGD	
O=C(Cc1cccc2ccccc12)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765739303	SOKXRZFPWASTSH-UHFFFAOYSA-N	430.508	1.988	50	20	IDGD	
CC(C)(C)OC(=O)NCc1cc(C(=O)OCC(=O)NNC(=O)c2cccs2)ccn1	766225776	UHIRANPNOKKFHK-UHFFFAOYSA-N	434.474	1.786	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1)N1CCCC1=O	766662709	CETCKRVIEZYIEH-GOSISDBHSA-N	435.956	1.006	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)Cc3c(C)nc4nc(N)nn4c3C)n[nH]2)c1	768279007	PUUXHWNGQJCJQN-UHFFFAOYSA-N	433.476	1.334	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CSc2nnc(-c3ccccn3)n2C)cc1OC	768413660	IYFURSHHFUMFNL-UHFFFAOYSA-N	428.474	1.448	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@@H]2[C@@H]3Cc4ccccc4[C@@H]23)c1	769151304	PTZWLZREVKPFRE-IPMKNSEASA-N	428.514	1.467	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N[C@H]2CCO[C@@]3(CCOC3)C2)cc1Br	771444769	POLKEEOUGJGQMY-SJCJKPOMSA-N	428.283	1.740	50	20	IDGD	
COC(=O)c1ccc2c(c1)CN(CC(=O)NNC(=O)c1cc(Cl)ccc1OC)CC2	771451831	FQEACONDWFFLBG-UHFFFAOYSA-N	431.876	1.955	50	20	IDGD	
Cc1nn(-c2cncc3nnnn23)c(C)c1CC(=O)NNc1ccnc(Br)c1	771537154	GTFLHOFMURSVKE-UHFFFAOYSA-N	443.269	1.165	50	20	IDGD	
C[C@]1(c2ccc(F)c(Cl)c2)NC(=O)N(CC(=O)NNc2ncccc2[N+](=O)[O-])C1=O	771738811	NYGAYYNDRTVRJV-QGZVFWFLSA-N	436.787	1.693	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc(F)ccc1Br)c1ccc(-n2cnnn2)cc1	771897316	CWZUMNMLYMONDN-UHFFFAOYSA-N	441.242	1.187	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)C1(c2ccc(Br)cc2)CCOCC1	772070263	VOXZNWNNMKGIJF-LBPRGKRZSA-N	427.295	1.986	50	20	IDGD	
O=C(NNc1ccccc1[N+](=O)[O-])C(=O)Nc1ccc(I)cn1	773575892	DGPPWLPDJQUFMR-UHFFFAOYSA-N	427.158	1.676	50	20	IDGD	
NC(=O)CC[C@H](NS(=O)(=O)c1cccc(C(F)(F)F)c1)C(=O)NNc1ccccn1	773621490	AUQDZEFDIHBLSK-ZDUSSCGKSA-N	445.423	1.156	50	20	IDGD	
CCOC(=O)[C@@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNc2nccnc2C(C)C)cc1	773992215	MPGOHNYFCCLHIA-CYBMUJFWSA-N	442.476	1.363	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1cccc(C(=O)N(C)C)c1	774003229	VQJOKALCISHCMH-GFCCVEGCSA-N	432.864	1.595	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccc(Cl)c(C(N)=O)c1	774010603	YIUSMHWLLVVWNX-VIFPVBQESA-N	439.255	1.646	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2ccc(NC(=O)NNC(=O)c3ccccc3)cc2)C[C@H](C)O1	775280898	ZALLAXQKDMSFIT-GJZGRUSLSA-N	432.502	1.951	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)NCc3cccc(N4CCOCC4)n3)nc21	776257235	RUFWEAADRCIQGL-UHFFFAOYSA-N	441.496	1.345	50	20	IDGD	
C[C@@H](CC(=O)NNc1cccc(S(C)(=O)=O)c1)/N=C1/NS(=O)(=O)c2ccccc21	776528297	NMLGRGOMUKWZAP-LBPRGKRZSA-N	436.515	1.051	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(N2CCOC2=O)c([N+](=O)[O-])c1)c1cc2ccccc2o1	777635425	FONBQVOIMXYDIT-UHFFFAOYSA-N	446.397	1.921	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)[C@@H](Cc2cccc(F)c2)n2nnnc2C)nc1C	778429272	JNLMDNVAELIEHV-MRXNPFEDSA-N	428.428	1.323	50	20	IDGD	
CC(=O)Nc1ccc(C(C)=NNC(=O)C(=O)NN=C(C)c2ccc(NC(C)=O)cc2)cc1	781572920	XSSCCWAFWJTLFU-UHFFFAOYSA-N	436.472	1.984	50	20	IDGD	
COCCOc1ccc(Br)cc1NC(=O)C(=O)NNc1ccc(OC)cn1	782144918	IRGBEPLWENVYEY-UHFFFAOYSA-N	439.266	1.960	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(O)cc2)cc1OCc1cccnc1	782834595	ZBPDXRXRBGYERY-UHFFFAOYSA-N	436.424	1.775	50	20	IDGD	
CC(C)(C)OC(=O)Nc1ccc(NC(=O)C(=O)NNc2ccc(S(C)(=O)=O)cc2)cn1	783071950	POFXURYCYULBCO-UHFFFAOYSA-N	449.489	1.914	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ccc(Br)cc2F)cc1S(N)(=O)=O	783086768	UKONPOIWSXZQQQ-UHFFFAOYSA-N	445.270	1.626	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)C2(Cc3ccc(F)cc3)CC2)CC1	783897632	WIMXBBSRBMCWBY-UHFFFAOYSA-N	447.536	1.623	50	20	IDGD	
CNC(=O)COc1ccc(NC(=O)C(=O)NNc2ccc(C#N)c(C(F)(F)F)c2)cc1	784237881	ZCMMWPGLMUFMSI-UHFFFAOYSA-N	435.362	1.784	50	20	IDGD	
O=C(CCSc1ccc(F)cc1)NNC(=O)[C@H]1CC=CC[C@H]1C(=O)N1CCOCC1	784297223	VJTLXBBDOKDNJF-ZWKOTPCHSA-N	435.521	1.897	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNc2ncccc2Cl)cc1OC	784817230	WAMQHOLDXQRHON-UHFFFAOYSA-N	427.870	1.587	50	20	IDGD	
Cc1ccc(-n2nc(NC(=O)C(=O)NNC(=O)c3cc([N+](=O)[O-])ccc3O)cc2C)cc1	785024518	VKSUQDJFSKEQDV-UHFFFAOYSA-N	438.400	1.503	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)cccc1C(=O)N1CCCC1	785060857	PWIZEELDIKIQNZ-UHFFFAOYSA-N	448.483	1.207	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1cnn(Cc2ccccc2)c1	785331763	ZQAAEKLCZKOZKG-UHFFFAOYSA-N	443.485	1.425	50	20	IDGD	
CCOc1ccc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)NCCC#N)cc2)cc1	787360125	WUOJFWKPOAKISB-UHFFFAOYSA-N	431.474	1.744	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)C(=O)Nc1cc(C#N)cn1C(C)(C)C	789735521	QVJAACZYRUNSCT-UHFFFAOYSA-N	434.497	1.506	50	20	IDGD	
CCn1c(S)nc2cc(C(=O)NNC(=O)c3ccc(OC)c(OC)c3)ccc2c1=O	790083199	QYTAUXOZIZNDNI-UHFFFAOYSA-N	428.470	1.797	50	20	IDGD	
Cn1nc(SCC(=O)NN=Cc2c[nH]c3cc(Cl)cc(Cl)c23)c(=O)n(C)c1=O	790155769	RBMAYASVZASKFN-UHFFFAOYSA-N	441.300	1.510	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc2c1CCN(C(=O)NNC(=O)COCc1ccccc1)C2	790730650	BSQGUDDYOWFMHU-UHFFFAOYSA-N	446.529	1.253	50	20	IDGD	
Cn1nc([C@@H]2CCCOC2)cc1NC(=O)C(=O)NNC(=O)COc1ccc(Cl)cc1	790951838	MGEQCMSAABABGU-GFCCVEGCSA-N	435.868	1.132	50	20	IDGD	
COC(=O)CCSCc1cccc(NC(=O)C(=O)NNc2nc3ccccn3n2)c1	792391536	FBWWAJXADRKVOR-UHFFFAOYSA-N	428.474	1.607	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)c2cccc(NN3C(=O)[C@@H]4CC=CC[C@H]4C3=O)c2)cc1	793290656	UVNJGUYDJHQRHA-RTBURBONSA-N	429.436	1.911	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNS(=O)(=O)c2ccc(C(=O)OC)cc2F)cc1	794575861	AVABHNWTJGIQSZ-GFCCVEGCSA-N	440.449	1.788	50	20	IDGD	
Cc1onc(-c2cccnc2)c1C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	794764646	UXJNJIJWYKYQCM-UHFFFAOYSA-N	429.458	1.370	50	20	IDGD	
O=C(CN1CCCC[C@@H]1COC(=O)N[C@H]1CCOC1)NNC(=O)c1ccccc1Cl	796549608	OORJRSSJRVZHHI-LSDHHAIUSA-N	438.912	1.471	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)[C@@H](CC(N)=O)NC(=O)CC(C)C	798153989	PJKLNQOVSILAGE-CQSZACIVSA-N	431.518	1.286	50	20	IDGD	
CC1=C(C(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)[C@@H](C)n2ncnc2N1C	798966037	GZVPGCUDAOAVMJ-CYBMUJFWSA-N	448.528	1.293	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)c(C)c(OC)c1	800622378	CCSFOKHIPRSSAE-UHFFFAOYSA-N	425.239	1.503	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)NCCS(=O)(=O)CCc2ccccc2)c1	800755531	IRKALRKIIRLTCC-UHFFFAOYSA-N	433.530	1.670	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N[C@@H]2CCN(C(=O)Nc3ccccc3)C2)cc1OC	800987374	WSIYGUPWHLOTMV-MRXNPFEDSA-N	427.461	1.954	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C=O)cc2Br)cc1	801108303	KMYJPZKPBMOIPU-UHFFFAOYSA-N	434.246	1.735	50	20	IDGD	
Cc1cc(=O)c(C(=O)NNC(=O)N=c2cc[nH]cc2)nn1-c1cccc(C(F)(F)F)c1	802024993	OJMJMSLWGYPYPF-UHFFFAOYSA-N	432.362	1.843	50	20	IDGD	
CCS(=O)(=O)N1CCC[C@H](C(=O)NNC(=O)Nc2cc(OC)c(Cl)cc2OC)C1	802084116	OFKFKQGYRAYYBV-NSHDSACASA-N	448.929	1.572	50	20	IDGD	
Cc1c(C(F)(F)F)nn(C)c1NC(=O)C(=O)NNC(=O)COc1ccc(Cl)cc1	806974206	ZGPXCRHYKFKJIY-UHFFFAOYSA-N	433.774	1.566	50	20	IDGD	
C[C@H]1Oc2ccccc2[C@H]1NC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	812429966	BUZGDJUDYWYAHX-KUHUBIRLSA-N	444.513	1.937	50	20	IDGD	
CNC(=O)Cn1ccc2ccc(NC(=O)NNc3ccc(S(=O)(=O)N(C)C)cc3)cc21	812947207	LBXJGXKEMPPTCS-UHFFFAOYSA-N	444.517	1.786	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)C3(c4cccnc4)CCCC3)cc2)CC1	813495266	UEIFTZOEYRLNKQ-UHFFFAOYSA-N	443.573	1.973	50	20	IDGD	
CCC[C@H](C)C(=O)NCCNC(=O)NNC(=O)c1ccc(OC)c(Br)c1	814300574	OUKPUMMSCDULOQ-NSHDSACASA-N	429.315	1.954	50	20	IDGD	
CC(C)NC(=O)NC1(C(=O)NNc2ccccc2S(=O)(=O)N(C)C)CCCCC1	817052473	CFTZRBRROVDMRE-UHFFFAOYSA-N	425.555	1.791	50	20	IDGD	
Cc1nnnn1/C(=C/c1ccc(F)cc1)C(=O)OCC(=O)NNC(=O)c1cccs1	818185634	UFQBLRKLILGMGM-NTEUORMPSA-N	430.421	1.185	50	20	IDGD	
CSC[C@H](C(=O)NNC(=O)COc1cc(C)ccc1C)N1C(=O)[C@H]2CCCC[C@@H]2C1=O	864002816	QLMJSTMGQRHUML-YESZJQIVSA-N	447.557	1.736	50	20	IDGD	
COc1ccc(Cl)cc1NS(=O)(=O)c1cccc(C(=O)N2CC[C@@H](B(O)O)C2)c1	864234299	OYGXUGGJMHZYTG-CYBMUJFWSA-N	438.698	1.838	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)CN1C(=O)[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O	912601341	ZIIDAQLYYMHCQD-AZFZUWSMSA-N	433.464	1.562	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)[C@@H]2CC(=O)N(c3ccc(F)cc3F)C2)c2ccccc2c1=O	914750404	HLLGQCSDBYBAAN-LLVKDONJSA-N	441.394	1.026	50	20	IDGD	
COc1ccc(-c2nn(CCC#N)cc2/C=C(\C#N)C(=O)NCc2nncn2C)cc1OC	915193637	KBDGPPOGTYMUBB-CXUHLZMHSA-N	446.471	1.833	50	20	IDGD	
O=C(NNC(=O)c1nc(N2CCCC2)ncc1Cl)c1csc(N2CCOCC2)n1	916734707	NCJMVBUTRYEBIB-UHFFFAOYSA-N	437.913	1.098	50	20	IDGD	
Cc1cccc(NC(=O)[C@@H]2CCCN(CC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)C2)n1	917399798	DJOHVHVHAQBLQU-MRXNPFEDSA-N	440.460	1.410	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NN=Cc2c[nH]nc2-c2ccc3c(c2)OCO3)c1	917534663	MNVFTQCKPUCDGA-UHFFFAOYSA-N	441.469	1.820	50	20	IDGD	
O=C(NNC(=O)N1CCC[C@@H](OCC(F)(F)F)C1)c1csc(N2CCOCC2)n1	918002042	MPBLRSKSPUAUPM-LLVKDONJSA-N	437.444	1.377	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCc2ccc([C@@H]3C[C@@H]3C)o2)cc1	918078531	UTLQTEIESKNGAC-WMLDXEAASA-N	434.518	1.863	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)OCC(=O)N[C@H](C)C(=O)N(C)C)c(C)n1C[C@H]1CCCO1	918952516	IGMTUNIVIGDTLP-UCRHTDJMSA-N	430.505	1.327	50	20	IDGD	
CCCC(=O)N1CCCC[C@@H]1C(=O)OCC(=O)NNC(=O)c1cc(Cl)ccc1OC	919619314	NJMJNDQFGAVCDV-OAHLLOKOSA-N	439.896	1.834	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)NCCCN1C(=O)NC2(CCCCC2)C1=O	919901909	MWNNTPIUAGZWHY-UHFFFAOYSA-N	431.493	1.213	50	20	IDGD	
Cc1cc(Cl)c(C)c(S(=O)(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)c1Cl	919960919	LSVKVFUCTVDVHU-SECBINFHSA-N	430.335	1.290	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)[C@H]2CCCN2C(=O)/C=C\c2ccc(C(N)=O)cc2)c(O)c1	920037429	PAUWOSQZDCPYKC-RLGIIYIFSA-N	436.468	1.265	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NN=Cc1nc2c(c(O)nc(=O)n2C)n1C	920363686	GFUXBKOUDVBALQ-VIFPVBQESA-N	449.265	1.053	50	20	IDGD	
Cc1nn([C@@H]2CCS(=O)(=O)C2)c(Cl)c1C=NNC(=O)CNC(=O)OC(C)(C)C	1116499262	BNGMJPPVOSKCFU-LLVKDONJSA-N	433.918	1.179	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)[C@H]2Nc3ccccc3S(=O)(=O)N2)c1	1252607619	YUYPSUOOAQQHGD-IBGZPJMESA-N	432.502	1.375	50	20	IDGD	
Nc1cnnc(NNC(=O)NCCN2CCN(c3cccc(Cl)c3)CC2)c1Cl	1319222592	VCSJEKVGGAHDGI-UHFFFAOYSA-N	425.324	1.814	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCN(c2ccccc2Br)C1=O)c1n[nH]c2c1CCCC2	1321707261	YBKLLNUMPUNNER-LBPRGKRZSA-N	446.305	1.865	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnnc4ccccc34)C2)C1	1777730461	YSHUXRWGIBKBRH-ORAYPTAESA-N	433.306	1.857	50	20	IDGD	
Cc1nc2ncccn2c1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1777901737	QJYNGIHYBSTDOK-SUMWQHHRSA-N	440.273	1.172	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H]2Cc3ccccc3CN2)C1	1777985850	CKKUJUBILPQNAT-VLVHOKLOSA-N	449.979	1.469	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccn4cncc4c3)C2)C1	1778658019	GNVKKQVVHDERND-VQIMIIECSA-N	435.322	1.951	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(Cl)nn3)C2)C1	1779432790	PMQNWKZYBUZINQ-BDJLRTHQSA-N	431.718	1.747	50	20	IDGD	
COc1ccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](F)Br)C3)nn1	1779952567	NIBLFRHNQAYSFF-SUYBPPKGSA-N	445.289	1.303	50	20	IDGD	
CC[C@H](NC(C)=O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Br)C1	1780770240	JUKHQQWEYXMFKC-QDEZUTFSSA-N	436.322	1.106	50	20	IDGD	
C[C@H](Cn1ccnc1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Br)C1	1780776647	CATWPYVXCAJTEC-ZXFNITATSA-N	445.333	1.724	50	20	IDGD	
O=C(c1ccc2nccn2c1)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781330171	SANOBCBEJJCIIW-RHSMWYFYSA-N	425.258	1.468	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(Cl)c(F)c3)C2)C1	1781537501	RNHPCGMTWNTLGA-HXUWFJFHSA-N	440.903	1.296	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4nn[nH]c4c3)C2)C1	1782583319	FICDCNGHQRVEMT-UGSOOPFHSA-N	436.310	1.575	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(N(C)C)cn3)CCO2)C1	1783343524	JNJFAVFOGKHXGY-KXBFYZLASA-N	439.354	1.765	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3nnsc3C3CC3)CCO2)C1	1783534948	SOQXCQPMCPMWAO-HWPZZCPQSA-N	429.340	1.642	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)NNc3ccccc3)[C@H]2C1	1783553319	BQUWHQJSUCBQGS-UYKLPWQDSA-N	438.956	1.225	50	20	IDGD	
C=CCCc1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](Cl)COC)C3)C2)c(O)n1	1783873481	PBNXWVMUKBEACY-UWJYYQICSA-N	437.924	1.603	50	20	IDGD	
C#CCCCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)CCO2	1783907761	KXZUIAAZFHWVQX-QFIPXVFZSA-N	443.456	1.767	50	20	IDGD	
COc1ccc([C@@H]2C[C@H]2C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](O)CCl)C[C@@H]32)cc1	1784424947	FEBDVBMALBTOFL-XVAUXIKLSA-N	436.936	1.378	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(F)(F)C(F)(F)C(=O)O)C[C@@H]21	1784615807	ALKBWECADXKKLI-YFKTTZPYSA-N	446.825	1.729	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)[C@H]1CNc2ccccc21	1786876937	XZJDTXLBISLPQL-LLLJDESDSA-N	440.313	1.866	50	20	IDGD	
CCc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](Br)CC)C[C@@H]32)n[nH]1	1787169771	PSNAQHSPFUCQMM-ZIEJDFEHSA-N	427.343	1.739	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3ccc4c(c3)OCO4)C[C@@H]21)[C@@H](F)Cl	1787445329	FUBCJTUZBBJZCL-AGGDQXJMSA-N	426.872	1.862	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ncn(-c4ccccc4)n3)[C@H]2C1	1787584402	CNWQASGKUPACSW-OWLYRPNTSA-N	447.923	1.114	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Cl)C[C@@H]21)c1cccc(N2CCOCC2)n1	1787657649	AMHYGEXQAWCDKI-ILXVDBEPSA-N	440.903	1.046	50	20	IDGD	
O=C(/C=C/C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21)NCc1ccco1	1788720813	OATFQULGLJVQGO-BHZQXVQBSA-N	444.315	1.235	50	20	IDGD	
COc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]32)nn1C	1789402386	NLSQPULIGYMHBW-MMNXLFCMSA-N	433.336	1.258	50	20	IDGD	
CC(=O)OC[C@@H](OC(C)=O)C(=O)Nc1ccc(C2(NC(=O)[C@H](O)CCl)CCC2)cc1	1789542230	GZZZIQJNRUPEHJ-IAGOWNOFSA-N	440.880	1.215	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)ON=C(C)C)[C@H]2C1	1789957389	PZZUUMRTWKNJSF-GVRJEKJASA-N	432.359	1.941	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3CCC4(CC3)OCCO4)[C@H]2C1	1790738013	FLQSKXKFEPCXHK-XSLAGTTESA-N	444.956	1.153	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cn(C)nc3OC)C[C@@H]21	1790961541	PFRZQTZCLXQEFL-JURCDPSOSA-N	443.342	1.196	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccncc1Cl)C2	1792870741	KDHFFMCJWIWRNK-MCYUEQNJSA-N	430.730	1.969	50	20	IDGD	
CC(C)Oc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](O)CCl)cc1C#N	1792983391	KHVUGRCMAHBOAW-ZMMAXQRCSA-N	435.908	1.148	50	20	IDGD	
CCOc1cnc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)CBr)C3)cn1	1794337789	PLOZPGAVEALGMN-NFFDBFGFSA-N	441.326	1.110	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(F)c(C)n1	1794355559	AGOYBMKGOCPSFC-ZWUHOBOKSA-N	428.302	1.906	50	20	IDGD	
Cc1snc2sc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@@H](O)CCl)C4)cc12	1796121059	JVCVDFZODXKPHI-QPPBUOOMSA-N	429.951	1.469	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(C=O)s1	1796196040	SFJFGQWEDHRNIJ-CLLJXQQHSA-N	427.486	1.125	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1cccc2ccccc12	1796781180	ICQFXLDHXQJKJB-BBIADKPPSA-N	444.296	1.037	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1c2c(nn1C)CCC2	1800049579	FHGZEWPOAGEICM-LMWOUKEDSA-N	439.354	1.286	50	20	IDGD	
C#CCO[C@H](C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C#N)=C/c1ccc(F)cc1F	1800332437	LSSRYMPJXUMREL-ILCOLZDNSA-N	443.450	1.500	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3cccn3cn1)C2	1800640607	BHKPLISXVLHEAH-YXPYIKCWSA-N	435.322	1.711	50	20	IDGD	
Cn1nncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C(C#N)=C/c1ccc(F)cc1F	1801435835	IQBYHPUUJPPLDR-RMWXTBGQSA-N	426.427	1.952	50	20	IDGD	
COc1cccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Br)C3)c1F	1801926036	JHXHXSJXYHHESJ-OWLDWWDNSA-N	433.249	1.728	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)COc2ccc(F)cc2)[C@H]1c1cccnc1)[C@@H](O)CCl	1803139323	WUEWIDAWCUNQSB-QSFXBCCZSA-N	435.883	1.905	50	20	IDGD	
CN(C)c1ccc(C(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)cn1	1803139985	AVVZKAIHXQMYCP-AYBZRNKSSA-N	431.924	1.462	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cccc3ccnn23)[C@H]1c1cccnc1)[C@H](O)CCl	1803146482	BFGSIFAGJZYQLT-IPELMVKDSA-N	427.892	1.649	50	20	IDGD	
Cn1c(C(=O)N2CC[C@@H](CNC(=O)CCBr)[C@H]2c2cccnc2)cccc1=O	1806338602	CGNVAHDQCDVVSW-HNAYVOBHSA-N	447.333	1.885	50	20	IDGD	
C[C@@H]1C[C@]1(C)C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1	1807772277	IVTXCOZQHMOTTH-XVRCHWGISA-N	436.516	1.446	50	20	IDGD	
C[C@H](NC(=O)c1ccccn1)C(=O)N1CC[C@H](CNC(=O)[C@@H](F)Cl)[C@H]1c1cccnc1	1808322769	XHNFEELEPTXDFO-PAYONLEZSA-N	447.898	1.835	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)Cn2nccn2)[C@@H]1c1cccnc1	1808959401	DYNAKUYRVLUCIO-ZOBUZTSGSA-N	435.326	1.553	50	20	IDGD	
O=C(/C=N/O[C@@H]1CCCCO1)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1	1810358335	RUBZDWYXCKQLCX-MHVLGXLCSA-N	438.912	1.216	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)c1cc2ncccc2[nH]1	1812074174	SLHHXGREUWEAGD-JVPBZIDWSA-N	427.892	1.877	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)Cn2nc(C)cc2C)[C@H]1c1cccnc1	1813028208	LFIZQJKODHKCRJ-BJLQDIEVSA-N	433.940	1.855	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2cnn3ccncc23)[C@H]1c1cccnc1	1813031281	RZFNFCFFBIVVJK-IEZWGBDMSA-N	442.907	1.698	50	20	IDGD	
Cc1nccn1CCCC(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1	1813356318	UNJJCZAYVITUCS-CMKODMSKSA-N	433.940	1.672	50	20	IDGD	
C[C@H](Oc1cccnc1)C(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1	1813437027	YWGLLACHOCJKRS-IAAVTCLWSA-N	432.908	1.550	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCBr)n[nH]1	1816782468	QNBOWYXEVDVAEU-DGCLKSJQSA-N	443.346	1.894	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCBr)[nH]n1	1817991100	XFKHJVGUGAQCDZ-JQWIXIFHSA-N	429.319	1.634	50	20	IDGD	
Cc1ncc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)s1	1818405878	JOOKTVLBAOZJGW-INIZCTEOSA-N	439.306	1.474	50	20	IDGD	
Cc1[nH]ccc1C(=O)N[C@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1	1819797278	SEGBSGZXPDAADA-NSHDSACASA-N	439.501	1.318	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)C2CC(=O)C2)n[nH]1	1823405975	KOQZVDGYCYWQGH-FQIOEHTJSA-N	439.476	1.515	50	20	IDGD	
COC(=O)NCC(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H](C)CBr)CC1	1824096876	XTEYDCQCDMJTBP-DZGCQCFKSA-N	432.359	1.993	50	20	IDGD	
COc1ccnc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)[C@@H](O)CCl)CC2)c1OC	1824184840	RYWHYVBGXCNBJM-HOTGVXAUSA-N	439.940	1.932	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnn3ncccc13)CC2	1825997868	DELZFWCZFLXKJB-PWSUYJOCSA-N	434.909	1.665	50	20	IDGD	
Cc1nccn1[C@H](C)C(=O)N[C@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1	1826091802	DFRZBGAYEGOHAV-OCCSQVGLSA-N	447.565	1.194	50	20	IDGD	
O=C1C[C@@H](C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)CCBr)CC3)CCN1	1826215569	UCGXXPGFSICNDC-UWVGGRQHSA-N	429.340	1.366	50	20	IDGD	
CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](F)Cl)CC2	1826647172	KJIFKQSWLSRHLQ-MRCXROJRSA-N	442.904	1.060	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1	1827428680	BRFUMNBNSXJPMX-QGZVFWFLSA-N	447.536	1.099	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4cn[nH]c4cn3)C2)C1	1830362401	VKQJIMIGCRSTFT-HXUWFJFHSA-N	435.912	1.293	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)C(=O)c3ccc(Cl)cc3)CCO2)C1	1830688201	QUMQJPKDENIBGL-OXQOHEQNSA-N	443.327	1.997	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3c(C)c[nH]c3C)CCO2)C1	1830903678	KKAGKNIGBRIQKM-GHTZIAJQSA-N	441.956	1.274	50	20	IDGD	
CC(C)[C@H](S)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1	1831494202	YWKYDRAELKKDQG-RRQGHBQHSA-N	427.394	1.634	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4cccn4cn3)C2)C1	1831645574	CMJAJPZJLFFQEI-DYESRHJHSA-N	434.924	1.812	50	20	IDGD	
Cc1ccc(CC(=O)N2CCC([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)cn1	1831871472	GCPDNPFUDBIQBU-NRFANRHFSA-N	443.592	1.925	50	20	IDGD	
Cc1noc(C)c1CC(=O)N1CCO[C@@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1	1832556511	BBFIMNGPSXHHHM-FQEVSTJZSA-N	439.585	1.142	50	20	IDGD	
Cn1c(C(=O)N2CCC(N3CCC(NC(=O)C(C)(C)CCl)CC3)CC2)cccc1=O	1833212176	OLEYDYGCUMVVPE-UHFFFAOYSA-N	436.984	1.836	50	20	IDGD	
CCc1cnc(C(=O)N2CCC(N3CCC(NC(=O)[C@H](O)CCl)CC3)CC2)s1	1833312641	UPPMVCPPTKOTNT-MRXNPFEDSA-N	428.986	1.490	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)CS(=O)(=O)CC)CC2)CC1	1833451212	OIWNPRJGQVVDEF-QGZVFWFLSA-N	436.018	1.400	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)CSCC(=O)OC)CC2)CC1	1833476220	GVKLBENWFOZUDY-QGZVFWFLSA-N	448.029	1.872	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnoc3C)CCO2)C1	1834319280	QCKRIVVMPAZOCM-YOEHRIQHSA-N	430.299	1.227	50	20	IDGD	
C[C@]1(C(=O)N2CCOC[C@]3(CN(C(=O)CCBr)CCO3)C2)CC1(F)F	1834826367	MUTNLIMQULPIOG-CABCVRRESA-N	425.270	1.273	50	20	IDGD	
O=C(Cc1ccc(F)cc1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1835051036	IPDOJLZSPSOVAL-SJLPKXTDSA-N	447.276	1.515	50	20	IDGD	
O=C(NCCC(=O)N1CCC(N2CCC(NC(=O)[C@@H](F)Cl)CC2)CC1)c1ccc[nH]1	1835078854	ZGVIRYQHAHSRSI-GOSISDBHSA-N	441.935	1.241	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)C#CC3(O)CCCCC3)CC2)CC1)[C@@H](F)Cl	1835084328	YIKKSEMIUOHJEA-LJQANCHMSA-N	427.948	1.791	50	20	IDGD	
O=C(Cc1cc(F)cc(F)c1)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1836123210	KIMMMQIZLUOQPK-SFHVURJKSA-N	437.270	1.767	50	20	IDGD	
CC[C@H](C)[C@@H](N)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](F)Br)CC2)CC1	1836412586	NGETXEIQQRUXGR-APHBMKBZSA-N	435.382	1.622	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)CN3C(=O)C=CC3=O)CC2)CC1	1836922175	JSBWOFBGFYCNJO-KRWDZBQOSA-N	439.940	1.318	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnn4ccccc34)C2)C1	1837712961	BEJLFTPXVBFYPM-NRFANRHFSA-N	446.580	1.256	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)Nc1ccccn1)CCO2	1837738727	XXPBDHJBKWNBPD-XGHQBKJUSA-N	438.956	1.746	50	20	IDGD	
O=C(c1cnc(Cl)c(Cl)c1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1837915407	GKYDQPFZFSYYMN-MLGOLLRUSA-N	440.686	1.993	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)ccn1	1837941826	XBCQVKPCURFVNF-KSSFIOAISA-N	426.311	1.243	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)c(C)n1	1838363873	RENGDBOAISYZRE-YJBOKZPZSA-N	444.301	1.459	50	20	IDGD	
O=C(c1cc(CO)on1)N1CCC(OC2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1838556005	SSEUCDDXFLUFNH-OAHLLOKOSA-N	448.289	1.470	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cn(C(C)(C)C)nn3)CCO2)C1	1838756225	ZHKNWCVZTGMQRD-YWZLYKJASA-N	441.960	1.511	50	20	IDGD	
Cc1ccn(C)c1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)Br)C2)C1	1838822087	AYSDBHIWEXJJAO-KDOFPFPSSA-N	428.327	1.187	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(-n4cccn4)nc3)C2)C1	1839146861	YQRKAOYEZKKTSY-LAUBAEHRSA-N	447.923	1.355	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CC34CCCN3CCC4)C2)C1	1839147555	VBMIHNMIYYBEPW-LAUBAEHRSA-N	427.973	1.479	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)C(=O)c3ccccc3)C2)C1	1839151408	QPBMXVJHKSDVMH-PMACEKPBSA-N	443.327	1.562	50	20	IDGD	
Cc1cnc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)s1	1839151530	VEWOPFVKPPIWNL-IRXDYDNUSA-N	436.361	1.758	50	20	IDGD	
O=C(C[C@@H]1CCCCO1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839198989	PSNRINWWYJHEQC-LXZKKBNFSA-N	437.306	1.093	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnn4cccc(F)c34)CCO2)C1	1839619739	DFKSIKOSOZNKPS-MGPUTAFESA-N	438.887	1.561	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3coc(C)n3)C2)C1	1839963174	CBEDJFZJSRPBFK-DYVFJYSZSA-N	430.299	1.227	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cc(C)on3)C2)C1	1839967123	BDYTWTOWIZNSIT-QAPCUYQASA-N	444.326	1.155	50	20	IDGD	
C[C@H](NNc1ccccc1)C(=O)N1CCOC[C@@]2(CN(C(=O)C(Cl)Cl)CCO2)C1	1840186573	AXCMFNGIGYYSJS-LIRRHRJNSA-N	445.347	1.252	50	20	IDGD	
Cn1cc(NC(=O)OC(C)(C)C)cc1C(=O)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1	1841349782	NVBKKHAWMUIZCQ-OAHLLOKOSA-N	440.928	1.789	50	20	IDGD	
CC(C)[C@@H](C(=O)N1CCCC12CN(C(=O)c1cnccc1C(=O)NN)C2)c1ccccc1	1841406246	JGNABRKELNMESP-HXUWFJFHSA-N	435.528	1.942	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@]2(NC(=O)OC(C)(C)C)CCOC2)C1	1845208652	RAIHCVWIVNYXKC-XOBRGWDASA-N	429.945	1.891	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2ccc3c(c2)C(=O)CC3)C1	1845622871	FRUGEVVJZRFIKZ-CVKSISIWSA-N	447.495	1.767	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@H]1CN(Cc3ccccc3)CCO1)C2	1846362441	FCZPYJUPGLEBCD-MOPGFXCFSA-N	435.952	1.345	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)c1cc(C(F)(F)F)ccn1)C2	1846385366	WJUMVCFULFCVKX-UHFFFAOYSA-N	427.427	1.290	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1cncn1-c1ccc(F)cc1	16177491	AWSRJZOREXVPTO-UHFFFAOYSA-N	430.465	1.688	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)[C@H]2CCCN(C(=O)OC(C)(C)C)C2)c2ccccc2c1=O	17193376	OXNCDFASSUTYPA-ZDUSSCGKSA-N	429.477	1.342	50	20	IDGD	
CC(=O)c1cccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)c3ccccn3)CC2)c1	17328773	LXEFNYJILXGREL-UHFFFAOYSA-N	430.486	1.146	50	20	IDGD	
O=C(Cc1noc2ccccc12)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	20901170	LLSVGCUXVCHCIZ-UHFFFAOYSA-N	428.470	1.616	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)CN2C(=O)N[C@](C)(c3ccc(F)cc3)C2=O)c1	28636554	VRMFTGIOKCDONU-JOCHJYFZSA-N	442.447	1.436	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2ccc(C(=O)NNC(=O)c3cccn3C)cc2)cc1	726538721	WBCBGTNKUXAHAX-UHFFFAOYSA-N	428.470	1.909	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=S)NCCc2ccc3c(c2)OCCO3)cc1C	726743959	AHJLVAAIQRSFMT-UHFFFAOYSA-N	428.514	1.751	50	20	IDGD	
CC(C)CC(=O)N1CCN(C(=O)CCCCCNC(=O)NNC(=O)c2ccccc2)CC1	727477008	VRKPMYGRSWTWIY-UHFFFAOYSA-N	445.564	1.908	50	20	IDGD	
CC/C=C(\C)C(=O)N1CSC[C@@H]1C(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	728066052	XHNAIHKJXROWDA-MYWXAZLQSA-N	429.502	1.597	50	20	IDGD	
NC(=O)c1ncn2c(C(=O)NNc3nc(-c4ccccc4)no3)cc(-c3ccco3)nc12	728080397	GPEVMQNLHLXHFA-UHFFFAOYSA-N	430.384	1.895	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3cc(C(C)(C)C)nn3C)cc2)CC1	728216366	YBSZESFHNPIGGI-UHFFFAOYSA-N	434.566	1.411	50	20	IDGD	
CCN(C)[C@H](C(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1)c1ccccc1	728600656	ZBUWGDMEBHPTJV-FQEVSTJZSA-N	432.546	1.456	50	20	IDGD	
COc1ccc2oc(C(C)=NNC(=O)CSc3nn(C)c(=O)n(C)c3=O)c(C)c2c1	729143829	SMWGLIJCXBJPSL-UHFFFAOYSA-N	431.474	1.175	50	20	IDGD	
O=C(CNC(=O)c1c(Cl)cccc1[N+](=O)[O-])NNC(=O)c1ccc(Cl)cc1O	731051512	PQNIRMYMPULVIH-UHFFFAOYSA-N	427.200	1.798	50	20	IDGD	
O=C(CCN1CCN(C(=O)[C@H]2CCCO2)CC1)NNC(=O)c1cc2c(s1)CCCCC2	732051828	BYFCHOLNBLQCEK-QGZVFWFLSA-N	448.589	1.491	50	20	IDGD	
Cc1ccc(-n2c(C)cc(/C=C(/C#N)C(=O)N3CCN(S(N)(=O)=O)CC3)c2C)cc1	732066000	BUUMSPPXZZXBSR-UYRXBGFRSA-N	427.530	1.657	50	20	IDGD	
CC[C@@H](C)C(=O)N1CCC[C@H](C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)C1	732334839	APVWZUUMPRYCAT-HIFRSBDPSA-N	434.449	1.184	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)NCCNc1nccc(C(F)(F)F)n1	739046943	ZKPQKNYAWICINW-UHFFFAOYSA-N	443.342	1.225	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)N2CCC[C@H](CNS(N)(=O)=O)C2)c(C)n1C[C@@H]1CCCO1	739699415	QPUMAUBQUNFBKT-YOBSTWPBSA-N	449.577	1.223	50	20	IDGD	
COc1cccc(N2CC[C@@H](CNC(=O)NNC(=O)c3cc([N+](=O)[O-])ccc3O)C2)c1	745800366	PUQVNAASNXDRDM-ZDUSSCGKSA-N	429.433	1.780	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@@H]2C[C@H](C)N(c3ccccc3)C2=O)c2ccccc2c1=O	745880803	BLQOHXOCUGHDAE-KBXCAEBGSA-N	448.483	1.554	50	20	IDGD	
Cc1cc(N2CC[C@H](NC(=O)NNC(=O)[C@H](C)Oc3cccc(C)c3C)C2=O)n(C)n1	745906870	VYBWNPGHTHAGHF-HOTGVXAUSA-N	428.493	1.249	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)N[C@@H]2CC(=O)N([C@@H]3C[C@@H]3c3ccccc3)C2)cc1	745914363	NBYPHGLRAJTMIO-NSISKUIASA-N	438.484	1.561	50	20	IDGD	
O=C(CNC(=O)c1cccc(Br)c1)NNC(=O)Cc1cn2ccccc2n1	746702516	WUVYQZFQJNDXLT-UHFFFAOYSA-N	430.262	1.217	50	20	IDGD	
CC(C)C[C@@H](/N=C1/NS(=O)(=O)c2ccccc21)C(=O)NNC(=O)c1ccc(C#N)cc1	747175273	LERLKFHTGNXLNU-QGZVFWFLSA-N	439.497	1.473	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCc3ccccc32)cc1C(=O)NNC(=O)c1ccc[nH]1	747663058	IXQZJKJEJMAGHJ-UHFFFAOYSA-N	440.481	1.850	50	20	IDGD	
COc1ccc(-n2c(C)cc(/C=C(/C#N)C(=O)NNC(=O)C(=O)N3CCCC3)c2C)cc1	748246532	BYHCTOONSXWSJG-AQTBWJFISA-N	435.484	1.780	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)Cn3cnc4ccccc43)cc2)CC1	748620050	OJOSSTUNGUEDQC-UHFFFAOYSA-N	428.518	1.116	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)CCc2nc3c(O)nc(=O)n(C)c3[nH]2)c(C)n1-c1ccccc1	749160939	PTZRYWQPNFPCAI-UHFFFAOYSA-N	449.471	1.164	50	20	IDGD	
NC(=O)c1ccc(/C=C/C(=O)N2CCC[C@@H]2C(=O)NNC(=O)c2cc3ccccc3o2)cc1	749477338	YSNUTKOQXOXCNH-ZPHJMFTNSA-N	446.463	1.997	50	20	IDGD	
CCC1(C(=O)NNC(=O)C[C@@H]2c3cc(OC)c(OC)cc3CCN2S(C)(=O)=O)CC1	749524039	MEHHJNNPLLNZNF-OAHLLOKOSA-N	439.534	1.290	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)CCOc2cccc(C(N)=O)c2)c2ccccc2c1=O	751298130	XDXJGBLXZKYBAD-UHFFFAOYSA-N	437.456	1.306	50	20	IDGD	
O=C(NNS(=O)(=O)c1cnn([C@H]2CCOC2)c1)c1ccc(Br)cc1Cl	751547553	LIMNSDIPLDYTFF-JTQLQIEISA-N	449.714	1.884	50	20	IDGD	
CCOC(=O)C1(C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)CCC1	752126634	BOOXGIUSCDXLCF-UHFFFAOYSA-N	436.940	1.338	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)N[C@@H]2CCCN(Cc3ccccn3)C2=O)c1	753298315	LTMIQCLYONHHDM-LJQANCHMSA-N	425.489	1.599	50	20	IDGD	
CS(=O)(=O)N1CC[C@@H](CNC(=O)NNC(=O)COc2ccccc2-c2ccccc2)C1	753671360	PRCRHNHFJYQNFJ-INIZCTEOSA-N	446.529	1.344	50	20	IDGD	
CCOc1ccc(C(=O)NNS(=O)(=O)c2cc(C)cc(C(=O)O)c2F)cc1OC	753770125	MTMIRVJHJGILQH-UHFFFAOYSA-N	426.422	1.863	50	20	IDGD	
Cc1ccc(CNC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c(N2CCOCC2)c1	753923004	CFPFJNBERGTTSZ-FQEVSTJZSA-N	426.473	1.502	50	20	IDGD	
C[C@H](NCC(=O)NNC(=O)c1ccc(C#N)cc1)[C@H]1CCCN(C(=O)OC(C)(C)C)C1	754314470	BNLXFPABZGVBRS-YJBOKZPZSA-N	429.521	1.944	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)Nc2cc(C)nn2[C@@H]2CCS(=O)(=O)C2)c1	755537544	WEXXLTSBBBGYQQ-CYBMUJFWSA-N	437.478	1.035	50	20	IDGD	
CCCC[C@@H](NC(=O)[C@H](C)NC(=O)C(C)(C)C)C(=O)NNC(=O)c1ccc(C)cc1O	755694395	KISJZXMQNIWEPW-GOEBONIOSA-N	434.537	1.687	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)c2ccccc2c1=O	756066002	PNLAXLMZSZYNJY-UHFFFAOYSA-N	448.342	1.910	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)CN2C(=O)NC3(C[C@@H](C)C[C@H](C)C3)C2=O)c1C	756866727	FGTHSTDKROPCMT-GRDNDAEWSA-N	444.532	1.965	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)N[C@@H]1CCN(c2ccccc2OC)C1=O	757284089	CDNDBVGDNUCQMX-OAHLLOKOSA-N	442.472	1.609	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)CNC(=O)c1cccc(F)c1	757691390	UKDBSWRGHKTFOJ-UHFFFAOYSA-N	437.811	1.222	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)Nc1cccn(CCS(C)(=O)=O)c1=O	757782085	VXRWHWWGZMWFFU-UHFFFAOYSA-N	442.881	1.021	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)N[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1C#N	758753522	PRUBFJKEEQAQGX-KBPBESRZSA-N	449.533	1.877	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)NC[C@]1(Cc2ccc(F)cc2)CCC[C@@H]1O	759672020	NFGPVCBOFPPZJY-LAUBAEHRSA-N	432.452	1.253	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1cnc([C@H]2CCCO2)s1	760407326	ZQCKUVVRBVLIOO-MRXNPFEDSA-N	443.529	1.214	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)[C@@H]2CN(C(=O)OC(C)(C)C)CCC2(F)F)C[C@@H](C)O1	760787642	LNNCNCKPIAVKMO-ZNMIVQPWSA-N	448.511	1.525	50	20	IDGD	
O=C(NNc1ncc(F)cn1)c1cccc(S(=O)(=O)Nc2ccc3c(c2)OCO3)c1	760908942	XPWLBEPLUXHFKK-UHFFFAOYSA-N	431.405	1.902	50	20	IDGD	
C[C@H]1Oc2ccccc2N(CCC(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)C1=O	761185813	ZDUWNMHRGFNSAF-CYBMUJFWSA-N	445.859	1.848	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3cccc([C@@H]4CCOC4)c3)cc2)CC1	762003068	NXQANTSEMONKHA-LJQANCHMSA-N	444.557	1.884	50	20	IDGD	
Cc1cccc(C(=O)NNc2nccc(N3CCOCC3)n2)c1I	762862526	VDFGPVUUOHSOQL-UHFFFAOYSA-N	439.257	1.983	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)cc1Cl	763549348	YKHFKTZKSOZEMX-UHFFFAOYSA-N	449.803	1.020	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)C(=O)Nc2cccnc2-n2cncn2)c1	763599977	CIUUDAGVVJDUNK-UHFFFAOYSA-N	437.460	1.259	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cccc3c2oc(=O)n3C)c(C)n1-c1ccccc1	763602152	PKGZHCHLHQPYCC-UHFFFAOYSA-N	447.451	1.939	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2cc(C)nc3ccccc23)cc(OC)c1OC	763615748	HNCYNFURKWURFP-UHFFFAOYSA-N	438.440	1.969	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2cccc(-c3nnc(C)n3C)c2)c1	763669191	UUCYVPHYUVGKPD-UHFFFAOYSA-N	436.472	1.572	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cc(N3CCOC3=O)ccc2C)cc1C	763679697	KLHMBYRSEMQDBH-UHFFFAOYSA-N	440.456	1.733	50	20	IDGD	
C[S@](=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)cc1F	763686869	WDXGSMJBTDCCOK-NDEPHWFRSA-N	427.841	1.381	50	20	IDGD	
CC1CCN(c2ccc(NC(=O)C(=O)NNC(=O)c3nnc(O)c4ccccc34)cc2)CC1	763790720	NOBFLZXOLFJHQU-UHFFFAOYSA-N	448.483	1.971	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccc(-n2cccn2)c(F)c1	763848601	DKGGBXXTQYRVJW-GFCCVEGCSA-N	429.383	1.704	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cc(C)n(-c3ccccc3)n2)cc1	763870976	CAYJVEDTHWLTAH-INIZCTEOSA-N	449.467	1.937	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)n1	763886296	RYUGGTVVAZRHRH-FQEVSTJZSA-N	430.468	1.942	50	20	IDGD	
CC(C)CC(=O)NNC(=O)C(=O)Nc1cnc2c(c1)C[C@H](NC(=O)OC(C)(C)C)CC2	763886422	XQDUMPBYNKYUFE-CQSZACIVSA-N	433.509	1.596	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)C(=O)Nc2ccccc2OCCC(N)=O)cc1	763895797	GUGUDPHUQJYUAU-UHFFFAOYSA-N	430.486	1.127	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)C(=O)Nc1ccc(CC(F)(F)F)cc1	763922669	YKRGVTYQKPYDDM-UHFFFAOYSA-N	433.350	1.167	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1cc(S(C)(=O)=O)ccc1Cl	764048763	UHYLMPPAJBHFJG-UHFFFAOYSA-N	425.850	1.152	50	20	IDGD	
O=C1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3ccc4ccccc4c3)cc2)CCN1	764064058	CEXQUPFTBFSTDZ-UHFFFAOYSA-N	431.452	1.176	50	20	IDGD	
CCN(CC)C(=O)c1ccccc1NC(=O)C(=O)NNC(=O)CCc1ccc(OC)cc1	764124514	JPXQMIQCTFHNKF-UHFFFAOYSA-N	440.500	1.896	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(N(C)C(C)=O)cc2)o1	764138767	JTIKJBBROLVHFV-UHFFFAOYSA-N	429.477	1.504	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2O1)C(=O)Nc1cccc(Cl)c1N1CCOCC1	764163952	NPOWUJDSJKLXEZ-QGZVFWFLSA-N	444.875	1.266	50	20	IDGD	
CC(C)[C@H]1CC[C@@H](C)C[C@@H]1OC(=O)c1ccccc1NC(=O)C(=O)NNC(=O)CN(C)C	764204224	PDNVZOYZJCXNOJ-MDZRGWNJSA-N	446.548	1.952	50	20	IDGD	
O=C(NNC(=O)c1cccc(OC(F)F)c1)C(=O)Nc1ccc(Br)nc1	764259711	MVZQXJZLRRXFHQ-UHFFFAOYSA-N	429.177	1.845	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)ccc1O)C(=O)Nc1c[nH]nc1-c1ccccc1	764279660	ASANMGJVFMXRLM-UHFFFAOYSA-N	444.245	1.945	50	20	IDGD	
O=C(NNc1nccc(N2CCOCC2)n1)c1ccc(F)c(I)c1	764329153	QCGSDPPHZDJMIQ-UHFFFAOYSA-N	443.220	1.814	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1)C(=O)Nc1ccnn1Cc1ccccc1	764388452	SESJGJMRJHANFK-UHFFFAOYSA-N	447.430	1.860	50	20	IDGD	
Cn1c(=O)c2c(ncn2CC(=O)NN=C(CC(C)(C)C)c2ccc(F)cc2)n(C)c1=O	764812297	IJSOVBMATRHREM-UHFFFAOYSA-N	428.468	1.530	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)CN1CCN(Cc2ccc(C)cc2)CC1	765748676	NYPXJUPJLAFCSV-UHFFFAOYSA-N	440.544	1.738	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)c1n[nH]c2ccccc12	765756183	MMPHVSLPYOSDGL-UHFFFAOYSA-N	426.908	1.795	50	20	IDGD	
CN(C)CC(=O)NNC(=O)C(=O)Nc1ccc(NC(=O)c2cccc(Cl)c2)c(F)c1	766259769	JPGKVSFRYQKZFK-UHFFFAOYSA-N	435.843	1.379	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)[C@@H]1Cc2cc(F)ccc2O1	766663210	JTYKDZGYYVXLCB-FQEVSTJZSA-N	446.910	1.748	50	20	IDGD	
CC(C)(C)Oc1cccc(CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)n1	767186838	DXTKWECLUOSZGC-UHFFFAOYSA-N	434.522	1.696	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2c(C)nc3ccccn23)ccc1OC(C)C	768233258	LYSACODGPURQBQ-UHFFFAOYSA-N	425.445	1.838	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)c2ccc(=O)n(-c3ccccc3)n2)n[nH]1	768273350	DKYPNANTVYLION-UHFFFAOYSA-N	430.424	1.706	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)C[C@H]3CCC[C@@H]3C)CC2)cc1	769008978	XLOLZQYCNCOROB-ZWKOTPCHSA-N	436.578	1.275	50	20	IDGD	
C[C@@]1(c2cccc(C(=O)NNC(=O)NCc3cccc(C(F)(F)F)c3)c2)NC(=O)NC1=O	769150149	QPDVIWOPYCHQOH-IBGZPJMESA-N	449.389	1.904	50	20	IDGD	
CN(C)C(=O)Cn1cc(NC(=O)NNc2ccccc2S(=O)(=O)NC(C)(C)C)cn1	770049702	VEOAKMPRXJGLJS-UHFFFAOYSA-N	437.526	1.197	50	20	IDGD	
Cc1cn(-c2ccccc2)nc1C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	770618318	GTVFCIRLWXTVAA-SFHVURJKSA-N	436.424	1.325	50	20	IDGD	
Cc1nc2c(C#N)cnn2c(C)c1CCC(=O)NNc1nc(O)c2cnn(C(C)(C)C)c2n1	770964379	ALPDQPVGKVDPQL-UHFFFAOYSA-N	448.491	1.894	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)c3ccc(S(=O)(=O)Cc4ccccc4)cc3)nc21	770970774	DIAOLGRUGDNKGV-UHFFFAOYSA-N	438.469	1.800	50	20	IDGD	
C[C@H]1CCCN(c2ccc(C(=O)NNc3nc(O)c4cnn(C)c4n3)cc2[N+](=O)[O-])C1	770972280	GZKZGYCFKVPBCF-NSHDSACASA-N	426.437	1.970	50	20	IDGD	
CCOC(=O)CNC(=O)C1CCN(C(=O)/C(C#N)=C\c2cc(C)n(CCOC)c2C)CC1	772567712	CCGMZMSQCDSWRV-MOSHPQCFSA-N	444.532	1.576	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ncn(Cc3ccc(Cl)cc3)n2)cc1F	773891097	ZZNVLDQMQZERPK-UHFFFAOYSA-N	430.827	1.827	50	20	IDGD	
CN(C)C(=O)[C@@H]1CC[C@H](CNC(=O)NNC(=O)c2ccc(COc3ccccc3)o2)O1	774659295	NGEDZQCZOFKNCZ-QAPCUYQASA-N	430.461	1.438	50	20	IDGD	
Cc1sc2ncc(C(=O)NNC(=O)c3cc(-c4ccc(F)cc4)[nH]n3)c(=O)n2c1C	775801287	QLEGXLVDKFRIQV-UHFFFAOYSA-N	426.433	1.977	50	20	IDGD	
CN(NC(=O)c1c[nH]nc1-c1ccncc1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776202065	PUPYGGWKGLOBJA-UHFFFAOYSA-N	429.481	1.721	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)c2sccc2S(=O)(=O)N2CCCC2)c1	776541105	HFKNTWPMHQKFDW-UHFFFAOYSA-N	429.545	1.693	50	20	IDGD	
CNS(=O)(=O)c1ccc([C@@H](C)NC(=O)NNc2cccc(S(C)(=O)=O)c2)cc1	776616878	KKKRUDUKFVXMJW-GFCCVEGCSA-N	426.520	1.386	50	20	IDGD	
Cc1c(Br)ccc(N)c1C(=O)OCC(=O)NNC(=O)c1ccc(C#N)cc1	778344616	BOWKAAZOAQFRRD-UHFFFAOYSA-N	431.246	1.829	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2ccc(C(=O)NNc3cc(Cl)nc(N)n3)cc2)C[C@@H](C)O1	779375209	MRTZWYQHYUUQAD-PHIMTYICSA-N	440.913	1.267	50	20	IDGD	
COC(=O)CNC(=O)NN=Cc1ccc(OS(=O)(=O)c2ccc(C)cc2)c(OC)c1	779823352	NRGHPTREMXWFAC-UHFFFAOYSA-N	435.458	1.577	50	20	IDGD	
O=C(NNc1ncncc1Cl)C1CCN(S(=O)(=O)c2cc(F)ccc2F)CC1	781832029	XNRAGSJNCIDKMT-UHFFFAOYSA-N	431.852	1.952	50	20	IDGD	
CC(=O)N1CCN(Cc2ccccc2NC(=O)NNC(=O)c2ccc(C)cc2O)CC1	782079275	XCYDZTYVZZJHKQ-UHFFFAOYSA-N	425.489	1.831	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2cccc3cnccc23)nc1	783264344	NCEUPHWVRABSCQ-UHFFFAOYSA-N	428.474	1.398	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)C(=O)Nc1ccccc1N1CCCCCC1	784003912	FGXASXWIKYGRIZ-UHFFFAOYSA-N	427.461	1.176	50	20	IDGD	
C[C@H]1CN(C(=O)C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)c2ccccc2O1	784214792	DTWAHXLKYMJLNR-ZDUSSCGKSA-N	430.486	1.385	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ccc(OC(F)(F)F)cc2)cc1OCC(N)=O	784801841	YXNCYICQPNRXCO-UHFFFAOYSA-N	442.350	1.540	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)cn1	784832887	FTKLAOGNGVKWJF-UHFFFAOYSA-N	444.416	1.185	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2ccccc2C(=O)N2CCOCC2)cc1Cl	785118652	STGBOVNDYOWMJI-UHFFFAOYSA-N	432.864	1.903	50	20	IDGD	
COC(=O)[C@@](C)(CNC(=O)NNC(=O)c1cc(OC)c(OC)c(OC)c1)c1ccccc1	787254709	ITXXJZPDPUORBI-QFIPXVFZSA-N	445.472	1.787	50	20	IDGD	
O=C(NNC(=O)c1ccc(NCC2CC2)nc1)c1ccc(S(=O)(=O)N2CCCC2)cc1	788265463	LVPHWKHGYUYLTE-UHFFFAOYSA-N	443.529	1.763	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccc(Cl)cc1-n1cccn1	788334514	WCOGBGZVYRLTND-UHFFFAOYSA-N	427.848	1.863	50	20	IDGD	
CCc1[nH]nc(C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c1Br	789138688	GTJIYSOYBGMFFR-UHFFFAOYSA-N	440.210	1.261	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(-n3cccn3)ccc2C)cc1OC	789584847	RJLCOJZUBBSHKE-UHFFFAOYSA-N	437.456	1.988	50	20	IDGD	
Cc1cc(C)c(S(=O)(=O)NNC(=O)CNC(=O)OCc2ccccc2)cc1C(=O)O	794599115	UTULBUDEUACYNY-UHFFFAOYSA-N	435.458	1.238	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)c2ccc(C(=O)NNC(=O)c3cccc(C)n3)s2)n1	795671491	RLJRYKFKWGKTDI-UHFFFAOYSA-N	438.469	1.305	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNC(=O)C(=O)Nc1ccc(-c2ccc[nH]2)cc1	797369402	UZNUAZXNTPLTMC-UHFFFAOYSA-N	435.440	1.694	50	20	IDGD	
C[S@](=O)c1ccc(CC(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)cc1	797903162	AHZFLQZDBNIOFD-NDEPHWFRSA-N	437.543	1.131	50	20	IDGD	
C=C(C)[C@@H]1OCC[C@@H]1CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(CC)CC)c1	798117510	CFOQELCWNUCMNW-AEFFLSMTSA-N	438.550	1.642	50	20	IDGD	
Cn1cc2c(n1)CCC[C@@H]2C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	798829228	CLYILHOSWZVUIC-INIZCTEOSA-N	431.518	1.086	50	20	IDGD	
C[C@@H]1CCNC(=O)[C@@H]1NC(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1	799368056	RFASNZHPKRSWGW-MAODMQOUSA-N	435.528	1.469	50	20	IDGD	
C[C@H](CCNS(=O)(=O)c1ccccc1)NC(=O)NNC(=O)c1cc2c(s1)CCC2	801796102	IVYHBTHIEVNFJS-CYBMUJFWSA-N	436.559	1.938	50	20	IDGD	
CC(C)(C)OC(=O)c1cnc(C(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)cn1	802064477	RZGYUDXEOUPYRN-UHFFFAOYSA-N	435.462	1.302	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)Nc1ccc(F)c(N2CCCNC2=O)c1	806806977	RYMILDIJFRCCCI-UHFFFAOYSA-N	429.408	1.983	50	20	IDGD	
CCS(=O)(=O)c1ccc([C@H](C)NC(=O)NNC(=O)COc2ccccc2C#N)cc1	807269096	AGLVXURVRLPVCT-AWEZNQCLSA-N	430.486	1.822	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)Cn1c(-c2ccc(F)cc2)c(C)sc1=O	807369517	XISUMYYYWFQDPN-UHFFFAOYSA-N	425.482	1.961	50	20	IDGD	
Cc1c(CS(C)(=O)=O)cccc1NC(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	812941388	IPJILERVKLLMTP-UHFFFAOYSA-N	440.547	1.939	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)Nc1cccc(N2C(=O)N[C@@](C)(C3CC3)C2=O)c1	812988393	DBBCYKBEVPWIRG-FQEVSTJZSA-N	447.492	1.853	50	20	IDGD	
CC(=NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1)c1ccc(S(=O)(=O)CC(N)=O)cc1	814877444	OMJOMBJBTZQVBW-UHFFFAOYSA-N	443.460	1.629	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1)[C@@H]1C[C@@H]1C	815564005	UXNMPQFKFWXPFK-KPZWWZAWSA-N	439.428	1.756	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)C(=O)Nc2ccc(C#N)cn2)c2ccccc2c1=O	815566425	TVGFXDUIZIBAAY-UHFFFAOYSA-N	447.455	1.253	50	20	IDGD	
Cc1nc2ccccc2n1CC(=O)NN=Cc1c(Cl)nc(N)nc1N1CCOCC1	874055579	DAQMDWPVPUDVTP-UHFFFAOYSA-N	428.884	1.357	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NN=Cc2c(Cl)nc(N)nc2N2CCOCC2)cc1C	874092866	FEKAMQJKXNJWRZ-UHFFFAOYSA-N	431.884	1.254	50	20	IDGD	
O=C(C[C@@H]1SC(N2CCCC2)=NC1=O)Nc1ccc(C(=O)NNc2ncccn2)cc1	913044045	LLPCCZAUNKFRIH-HNNXBMFYSA-N	439.501	1.656	50	20	IDGD	
O=C(NNC(=O)c1ccc2nc(O)[nH]c2c1)c1cccc(S(=O)(=O)N2CCCC2)c1	914710452	RSMVJEMKIGHWIN-UHFFFAOYSA-N	429.458	1.128	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)[C@H]2CC(=O)N(c3ccc(F)cc3F)C2)nc2ccccc21	914748189	MCYQFHAQNVPTIF-LBPRGKRZSA-N	427.411	1.595	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C1CCN(S(=O)(=O)c2cccnc2)CC1	914829954	JBEZREXKGBMVKI-UHFFFAOYSA-N	446.529	1.271	50	20	IDGD	
COc1nn(C)c2nc(C)c(CCC(=O)OCC(=O)NNC(=O)c3cccs3)c(C)c12	914976137	SVDMZZHNGRGCCI-UHFFFAOYSA-N	445.501	1.592	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@@H]2C(=O)NNC(=O)COc2ccccc2F)c(OC)c1	915059709	NEMVACMIFIHAIX-QGZVFWFLSA-N	445.447	1.674	50	20	IDGD	
O=C(NNC(=O)c1ccc(-c2ccccc2)nc1O)c1csc(N2CCOCC2)n1	916136480	PENKRGAQXHYECD-UHFFFAOYSA-N	425.470	1.822	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NCCCc2c[nH]nc2C)c2ccccc2c1=O	916259842	NFXZKQGNONUSML-UHFFFAOYSA-N	425.493	1.805	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)NCC[C@@](O)(c2nccn2C)C(F)(F)F)c1	916377205	ADQFZFHDABNBOA-QGZVFWFLSA-N	429.399	1.278	50	20	IDGD	
CCCNC(=O)c1cccc(CNC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)c1	916478800	RGOVYKGDYNBFFB-UHFFFAOYSA-N	436.472	1.862	50	20	IDGD	
CNC(=O)NNC(=O)C1CCN(S(=O)(=O)c2ccc(Cl)c(C(F)(F)F)c2)CC1	919877682	JLALJBIXYYPEEY-UHFFFAOYSA-N	442.847	1.720	50	20	IDGD	
Cc1nn(-c2ccc(Cl)cc2)c(C)c1CC(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1	919884138	DXYSTKATDNCOGF-CQSZACIVSA-N	439.925	1.203	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)CNC(=O)c2ccc(Br)cc2)cc1	920212667	GHOFJULJHZRZFT-UHFFFAOYSA-N	434.290	1.968	50	20	IDGD	
C[C@@H]1CN(C[C@@H](C)C(=O)NNC(=S)NC2CCN(Cc3ccccc3)CC2)C[C@@H](C)O1	920307914	QDRKLXDIWGBHLK-GUDVDZBRSA-N	447.649	1.892	50	20	IDGD	
Cc1nnc(CNC(=O)/C(C#N)=C\c2cn(CCC(N)=O)nc2-c2ccc(Cl)cc2)o1	920851434	LKPZKWAFWLULFR-ZSOIEALJSA-N	439.863	1.994	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@@H]3COc4ccc(F)cc4C3)CC2)cc1	1116407407	OAMPDYIVPUUWPL-FQEVSTJZSA-N	440.519	1.650	50	20	IDGD	
C[C@@H]1CCCN(S(=O)(=O)c2cc(C(=O)NNC(=O)c3n[nH]c4c3CCCC4)n(C)c2)C1	1318317550	TXHPTDOAFBSLEM-CYBMUJFWSA-N	448.549	1.122	50	20	IDGD	
C[C@@H](Sc1nnnn1C1CC1)C(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1	1318621339	NJDRILRAXQIYEI-LLVKDONJSA-N	439.542	1.283	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2ccncc2OC[C@@H]2CCOC2)c1	1342651861	IRYGAVZPCWGFQY-CQSZACIVSA-N	448.501	1.045	50	20	IDGD	
O=C(c1ccc2nccnc2c1)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1777978828	CUFLRIVMENDLDZ-QAPCUYQASA-N	437.269	1.764	50	20	IDGD	
Cc1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](O)CCl)C3)ncc1[N+](=O)[O-]	1778246256	HLXKTZLAOMOYHX-FRQCXROJSA-N	440.884	1.025	50	20	IDGD	
O=C(c1ccc2[nH]ccc2n1)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1778491441	UNADJCQDVXORLO-YOEHRIQHSA-N	425.258	1.697	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@]2(C1)CN(C(=O)C1(F)CN(C(=O)OC(C)(C)C)C1)CCO2	1781224357	VLBKCUHUNYJPIR-IFXJQAMLSA-N	447.935	1.793	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)c3[nH]nc4ccncc34)CCO2)C1	1781228182	YYEQMOCEDPEANC-MSOLQXFVSA-N	426.304	1.638	50	20	IDGD	
Cc1ccc([C@@H](C)C(=O)N2CC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)cc1	1783315807	HXMXTLXVMZLOBY-WZONZLPQSA-N	430.549	1.301	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](C)Nc1nccs1)CCO2	1783534996	UYAUYSIVDSWUIK-HWWQOWPSSA-N	431.356	1.557	50	20	IDGD	
CCOC(=O)[C@@H]1CCC[C@H](C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](Cl)COC)C3)C2)C1	1783870416	BLOJWGSNQHEECV-WCLQXYBISA-N	444.956	1.440	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cc(OC)cc(OC)c3F)CCO2)C1	1783881025	INKNBAGVFHRDAD-FOIQADDNSA-N	444.887	1.540	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]3C2)c2cc(O)ccc2n1	1784092121	HINXWKDEEGIHOR-KGUHOSCRSA-N	447.919	1.442	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccn4c(O)nnc34)C[C@@H]21	1784618911	RTUXXSCIZMNVME-TUUVXOQKSA-N	435.912	1.436	50	20	IDGD	
CC[C@H](NC(C)=O)C(=O)Nc1ccc(C2(NC(=O)CCC(=O)NN(C)C)CCC2)cc1	1785869365	ZMOUYRNGLFZCGP-SFHVURJKSA-N	431.537	1.408	50	20	IDGD	
O=C(CCc1cnc[nH]1)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1	1786806765	TVEZJCJFDXMQLC-UHFFFAOYSA-N	432.289	1.470	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)c1n[nH]c2c1CCCC2	1787314278	CKVTYEFOTLFYTL-YLUJIRGKSA-N	443.317	1.572	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)c1cccc(-c2ccccc2)n1	1787579944	HQWORGGCSSOJHE-PZBISTMVSA-N	443.931	1.942	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3nn(C)c4c3CCC4)[C@H]2C1	1788023128	DKUOFLHXZQSAHZ-DUPGQFARSA-N	439.354	1.286	50	20	IDGD	
C[C@H](C(=O)Nc1ccc(C2(NC(=O)[C@H](O)CCl)CCC2)cc1)[C@H]1SC(=N)NC1=O	1788633831	YVNRFJBIDWBJLF-ZLKJLUDKSA-N	438.937	1.523	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CNc4ccccc43)C[C@@H]21)[C@@H](F)Br	1789922267	HGXHWOZVOXWHFJ-OHYFQZGNSA-N	440.313	1.866	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(F)cc([N+](=O)[O-])c3)[C@H]2C1	1790132737	BSJAYLBYESSDDJ-UQCMEYCASA-N	443.859	1.581	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccn4c(C)cc(C)nc34)[C@H]2C1	1790531012	RXJXNLCGAUVYLM-KANFNMMFSA-N	448.951	1.798	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CC[S@](=O)CC)C[C@@H]21	1790960729	RCFSROXRDIAOCY-DCTMNQNWSA-N	437.400	1.298	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc(N(C)C)o3)C[C@@H]21	1790961823	UWORMQVIHROLBV-FQUUOJAGSA-N	443.342	1.507	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CNC(=O)OC(C)(C)C)C[C@@H]21	1791063394	HFIXZMABJJWIBR-XUXIUFHCSA-N	448.358	1.274	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(F)c(C)c3N)C[C@@H]21	1791251749	UPTKWQRWLJGDQX-QEWYBTABSA-N	427.904	1.563	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(-c4ccco4)no3)C[C@@H]21	1791253594	BRKYXMMPMIWKIG-FLTUCWPJSA-N	437.880	1.782	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(-n2cnnc2)cc1	1795494147	JLPPTHUAUBSCDN-JJAZEVLHSA-N	448.321	1.254	50	20	IDGD	
Cc1c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CCBr)cn2[nH]cnc(=O)c12	1795494369	UVNPGAWSCYSSFI-CLLJXQQHSA-N	436.310	1.368	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)c1cccnc1OCC1CC1	1796188319	PGSIOLVNTHEPFV-ACDBMABISA-N	449.316	1.116	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)C1=NO[C@H](c2ccccc2)C1	1796189013	MQOSIGOCIJDSHE-IIZPIQPGSA-N	447.300	1.136	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnn2ncccc12	1796275944	ZMBSNGPQKLOYQS-TYYYEBLRSA-N	426.304	1.169	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](NC(C)C)C(C)C)C2	1796892270	UWCLVFZTTQVFAP-PWTSDQHNSA-N	444.580	1.781	50	20	IDGD	
COc1ccc([N+](=O)[O-])c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](F)Br)C3)n1	1797211845	YZEVBNZWTZYECX-JIXVBMEVSA-N	445.245	1.941	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1[C@H]2Sc3ccccc3[C@H]21	1798458392	ZXPJBFFSZVXLEK-YKEXBACISA-N	442.585	1.886	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1ccc2ccnn2c1	1800026930	FYPFDYJDXAEAIC-NEBZKDRISA-N	425.258	1.228	50	20	IDGD	
C[C@H](S)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](Br)Cc1ccccc1	1800437424	YAKFQJXYNDPKLL-RKOFLFEYSA-N	441.391	1.901	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CC[C@H](C(=O)OC)C1)C2	1800637631	FLYYTCVFPNAVGX-CMXYNOPPSA-N	445.354	1.339	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](CN)c1ccccc1)C2	1800639631	KTHXMYUSIKXONZ-RZFLPCETSA-N	438.366	1.492	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3ncnn3c1)C2	1800642048	TXYHXYRHBVEKKI-FQLMCAECSA-N	436.310	1.106	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1[C@H]2C=CS[C@@H]21	1801319309	DDKBEGJMOGPBSO-LKINUUATSA-N	427.530	1.634	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1(C(C)C)CCC1	1801607053	BORSPJXYNCHEAV-BRTCSPBQSA-N	443.548	1.536	50	20	IDGD	
COC[C@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ncn(-c3cccc(F)c3)n1)C2	1802273909	OUHYQTXBKZUARL-ORQFMDKSSA-N	435.887	1.912	50	20	IDGD	
CC(=O)NC(C)(C)C(=O)NC[C@@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1	1803589831	VPXMETHZUYHLQA-RDJZCZTQSA-N	439.354	1.787	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC2(CCCN(C(=O)[C@H]3CCC(=O)NC3)C2)CC1	1804981863	KHLDRVZDLKMSNE-GJZGRUSLSA-N	428.371	1.917	50	20	IDGD	
Cc1nn(C)c(C)c1C(=O)N1CCCC2(CCN(C(=O)CCC(=O)NN(C)C)CC2)C1	1806263957	GBWGVAJMDAUVAB-UHFFFAOYSA-N	432.569	1.255	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1807359001	CFYJIGBDXUUTHT-IEBWSBKVSA-N	443.740	1.346	50	20	IDGD	
CC1(C)CC(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)C1	1807375786	VMPXZRJWNKWDQB-WIYYLYMNSA-N	435.333	1.517	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)c1cnc2[nH]ncc2c1	1809707866	RVDHLDGFODCTRR-RRQGHBQHSA-N	428.880	1.272	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)[C@H]3[C@H]4SC=C[C@H]43)CC2)C1	1809973367	IZKIUMIFIBIBPU-OTWHNJEPSA-N	426.347	1.086	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)n2)[C@H]1c1cccnc1)C(Cl)Cl	1813080253	NZDMKULDCAUAMT-GWCFXTLKSA-N	426.260	1.406	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)CN3CCOCC3)sc2C1	1814572316	KMDYSRZRYRUIRI-RYUDHWBXSA-N	445.383	1.561	50	20	IDGD	
O=C(NCC(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](O)CCl)n[nH]1)c1cccs1	1814867443	LDFPDOOIZMXJPC-STQMWFEESA-N	439.925	1.493	50	20	IDGD	
Cn1nc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)[C@@H](F)Br)[nH]n2)cc1O	1816123233	LUQPEFWOXCNXFZ-GXFFZTMASA-N	429.250	1.845	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](N)Cc3cccnc3)sc2C1	1817192599	QDDJBCSPEFHCOC-RDBSUJKOSA-N	437.953	1.274	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](C)CBr)CC2	1817292629	LXHUUAKATMEBPQ-HOSYDEDBSA-N	445.383	1.953	50	20	IDGD	
CN1CCN(CC(=O)Nc2cc([C@H]3CCCCN3C(=O)[C@@H](F)Br)[nH]n2)CC1	1818913888	SZTHEPOBUJKXJH-CZUORRHYSA-N	445.337	1.340	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H]2CC2(F)F)[nH]n1	1819403047	TXBMXVURRFGLLB-GXTWGEPZSA-N	433.419	1.369	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnn4c3OCCC4)sc2C1	1824001937	ZXBXENIODZEEFJ-ZYHUDNBSSA-N	439.925	1.602	50	20	IDGD	
O=C([C@@H]1CC[C@@H]2CCC(=O)N2C1)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)CC1	1824185630	YXORMCXRTSJZKF-YRXWBPOGSA-N	439.984	1.607	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(O)cn2)CC1	1826212563	JIKVDIIYAFWWRU-NRFANRHFSA-N	437.305	1.014	50	20	IDGD	
C=C(C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1)C(F)(F)F	1827053073	BDIKCBPUWZEMQQ-SFHVURJKSA-N	438.255	1.718	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(C)=O)C2)C1	1829339803	CCDAHIJNKXFLAS-RXVVDRJESA-N	437.924	1.712	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(Cl)nc3)CCO2)C1	1829513000	SUMJILJMUDWDHR-KBXCAEBGSA-N	432.304	1.059	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)Cn2cc(C)c(O)nc2=O)CC1	1830314152	BYJVPEHCJHCMSI-DLBZAZTESA-N	438.956	1.894	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccn4nccc34)C2)C1	1830366828	WKRDCZVRUPDHSF-OAQYLSRUSA-N	434.924	1.669	50	20	IDGD	
C[C@@H](Cc1ccccn1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830370287	POIUASYVMXYFET-HTAPYJJXSA-N	437.968	1.982	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(F)cn3)C2)C1	1830537169	CITWDBNBMJBMSV-ACJLOTCBSA-N	444.301	1.322	50	20	IDGD	
Cc1ccc(CCC(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)cc1F	1831308656	DXKWUWZUTNDCSZ-WIYYLYMNSA-N	442.915	1.123	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CC[C@H](N)C(N)=O)CC1	1831550461	WHIZDQQIEVUVCO-HRCADAONSA-N	445.402	1.372	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C)n(CC)n3)C2)C1	1831652371	ZKHILXGULRAVKW-JXFKEZNVSA-N	426.945	1.689	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3cc(F)ccn3)CCO2)C1	1832855990	VWECHNFIKPLUJC-FXAWDEMLSA-N	427.904	1.627	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cnoc3C3CC3)CC2)CC1	1834349036	VISYYLKNEPZUAN-GOSISDBHSA-N	438.956	1.991	50	20	IDGD	
CCn1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](C)CBr)C3)C2)n1	1834401521	JREMBVVZDFCARS-KDOFPFPSSA-N	443.342	1.004	50	20	IDGD	
Cn1nc(C(=O)N2CCC(N3CCC(NC(=O)CCBr)CC3)CC2)cc1O	1834422529	SYZBBSSAGXSMQZ-UHFFFAOYSA-N	442.358	1.096	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)Cc3cccc(F)c3)C2)C1	1834822401	LEXCEVDBRRBZKR-IBGZPJMESA-N	443.313	1.610	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3ccnc4c3OCO4)CC2)CC1)[C@@H](F)Cl	1835084342	ZBAIFGRXGHPACU-MRXNPFEDSA-N	426.876	1.530	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3ccn4ccnc4c3)CC2)CC1	1835573863	OEWOLKUGXCMPNP-IBGZPJMESA-N	447.967	1.773	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3ccc[nH]3)CCO2)C1	1836018136	XBVBUZSJRYKMDP-KBXCAEBGSA-N	428.327	1.187	50	20	IDGD	
CC(C)Cc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)n(C)n1	1836338375	RBYSXJWUELSIBS-LJQANCHMSA-N	447.363	1.492	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnc4[nH]ncc4c3)CCO2)C1	1836807729	CKTOFWBFBFLFSA-OXQOHEQNSA-N	435.912	1.435	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1n[nH]c3ccccc13)CCO2	1836941124	KLFZCCUJZVIBLB-OAQYLSRUSA-N	446.580	1.484	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccn4ccnc34)CCO2)C1	1836995382	OWHRVQCYCFLYMO-NRFANRHFSA-N	434.924	1.669	50	20	IDGD	
COc1nc(C)ccc1C(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1838170609	RDAAIPPICXRVOT-OAQYLSRUSA-N	439.940	1.734	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@H](C)Cn3cncn3)CC2)CC1	1838421349	OACOXGNHTNBTOL-QAPCUYQASA-N	441.960	1.167	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)cc1	1838967294	VWBDGBCPOYVJPN-CRAIPNDOSA-N	445.285	1.456	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc([N+](=O)[O-])cc3F)C2)C1	1839147403	PKZKQANEKVPQML-DNVCBOLYSA-N	443.859	1.821	50	20	IDGD	
CCc1ncccc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839197924	MTZCHBLFMHTKEF-CRAIPNDOSA-N	444.301	1.405	50	20	IDGD	
O=C(Cc1ccsc1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839199865	XHKPRZORNXRWKS-ZBFHGGJFSA-N	435.315	1.438	50	20	IDGD	
Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1839427924	AAMJTTMHOANJLM-CRAIPNDOSA-N	447.822	1.647	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3CCOCC3)C2)C1	1839963253	FYGWHIVBJLHCMC-CRAIPNDOSA-N	433.343	1.043	50	20	IDGD	
Cc1ncccc1CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840187099	VGQDWKVTMOUHJI-LJQANCHMSA-N	430.332	1.583	50	20	IDGD	
Cc1ccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)o1	1840508831	IQWDVTJVZSASIH-RBUKOAKNSA-N	433.332	1.823	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H]1CC(=O)N1CCCC12CN(C(=O)[C@H](O)CCl)C2	1841777160	ZENMSCUFWJGCEC-HUUCEWRRSA-N	429.945	1.579	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2nccc3[nH]ccc23)C1	1843278103	QZPJYCKIQRIGTG-VULFUBBASA-N	433.472	1.514	50	20	IDGD	
COc1ccc(CNC(=O)CCC(=O)N2CC3(CCCN3C(=O)[C@@H](F)Cl)C2)cc1	1843365958	TZXPSJNWWLMKGN-GOSISDBHSA-N	425.888	1.829	50	20	IDGD	
COC1(CC(=O)N2CCCC23CN(C(=O)[C@H](F)Cl)C3)CN(C(=O)OC(C)(C)C)C1	1843847028	RKRQAJQSEPMFLE-AWEZNQCLSA-N	433.908	1.750	50	20	IDGD	
Cc1cc2cc(C(=O)N3CC4(CCCN4C(=O)c4cnccc4C(=O)NN)C3)ccc2[nH]1	1844264998	IVJUJGFWVGYKOP-UHFFFAOYSA-N	432.484	1.606	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@]2(C[C@@H]2C(=O)N2CCCC23CN(C(=O)[C@H](O)CCl)C3)C1	1846156518	WDQDWPPPHFKTBC-SXGZJXTBSA-N	441.956	1.437	50	20	IDGD	
Cc1cc(C)n2ccc(C(=O)N3CC4(CCCN4C(=O)CCC(=O)NN(C)C)C3)c2n1	1846385891	HVDCSQOHPVHYJV-UHFFFAOYSA-N	426.521	1.141	50	20	IDGD	
COc1ccc([C@H](O)C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](C)CBr)cc1	1847392481	SFESQSJZINKDIC-ZCPGHIKRSA-N	425.323	1.961	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NN[C@@H](C(=O)NC2CC2)c2ccc(F)cc2)c1	10833836	JDJKBMPIMXQDQL-GOSISDBHSA-N	434.493	1.330	50	20	IDGD	
O=C(COc1ccc(I)cc1)NNC(=O)c1ccc2c(c1)OCO2	15793446	MKSYXDMILAXDDK-UHFFFAOYSA-N	440.193	1.860	50	20	IDGD	
CCOC(=O)/C(C#N)=C/NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	18989115	DPXQANIYTFPJQD-SAPNQHFASA-N	428.470	1.370	50	20	IDGD	
O=C(CN1C(=O)COc2ccc(Cl)cc21)NNC(=O)c1cc(-c2ccccc2)n[nH]1	23449284	QNBJBCFHQAMYCV-UHFFFAOYSA-N	425.832	1.917	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)/C(=C/c2ccc(F)cc2)n2nnnc2C)cc1	23573353	IZZBZAZREYQGBC-WQRHYEAKSA-N	438.419	1.432	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)c(C)c1	24918497	RSLKOTUZVYACAP-UHFFFAOYSA-N	449.529	1.549	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@H](c1ccccc1)n1cccn1	109764150	PFHWCIYMAUSVMK-INIZCTEOSA-N	426.502	1.535	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NCC2CCN(CC)CC2)c2ccccc2c1=O	726274475	DPPWPNJYNMEVHZ-UHFFFAOYSA-N	428.537	1.873	50	20	IDGD	
COc1ccc(CN2C[C@H](C(=O)NNC(=O)[C@H](C)Oc3ccc(F)cc3)CC2=O)cc1	726522861	YXHVGLXQLVUUAX-GOEBONIOSA-N	429.448	1.798	50	20	IDGD	
CC(C)C[C@@H](C)CC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	727661862	HQLWILTYHZEYOG-QGZVFWFLSA-N	439.578	1.860	50	20	IDGD	
COc1ccccc1C1(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)CC1	728340290	HPZNXIQLODJBAE-SFHVURJKSA-N	426.425	1.257	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccccc1Br)C1CCN(c2ncccn2)CC1	728856240	KGFQJNBIENZZGK-UHFFFAOYSA-N	440.323	1.465	50	20	IDGD	
C[C@H](C(=O)NC1CC1)N1CCN(C(=O)NNC(=O)c2ccc(Br)s2)CC1	728942039	IILWGMQMXNBADC-SNVBAGLBSA-N	444.355	1.150	50	20	IDGD	
CN(C(=O)c1cccc(C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)c1)c1ccccc1	729342031	UYDLFVYGDYJAAV-INIZCTEOSA-N	430.486	1.094	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)[C@@H](CCSC)NC(=O)c2ccccc2)cn1	729692544	KHEPRDXERKMBNU-OAHLLOKOSA-N	433.559	1.960	50	20	IDGD	
CC(C)(C)CC(=O)N1CSC[C@H]1C(=O)OCC(=O)NNC(=O)c1cccc(Cl)c1	730322792	CPEPMHFXGCKKAW-AWEZNQCLSA-N	441.937	1.982	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)[C@@H]1CS[C@@]2(c3ccc(F)cc3)CCC(=O)N12	730778713	UCUKAPMXRGAQNT-YCRPNKLZSA-N	445.472	1.648	50	20	IDGD	
COC[C@@H](C)n1c(C)cc(/C=C(\C#N)C(=O)OCCN(C)S(=O)(=O)N(C)C)c1C	731144445	GRSHUCOSWLDXQG-CLXYIWAZSA-N	426.539	1.501	50	20	IDGD	
CCCCN(C)C(=O)c1ccccc1S(=O)(=O)NNC(=O)[C@H]1COc2ccccc2O1	731469503	WTNDDKFNDGNHNA-GOSISDBHSA-N	447.513	1.708	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)N[C@H](C)C(=O)N2CCS(=O)(=O)CC2)c(C)n1CC(C)C	731477097	QRHZOZLASVUGQW-VXIUPONVSA-N	434.562	1.430	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(N2CCCC2)c(C(=O)NNC(=O)c2c[nH]nc2C)c1	731878978	LPHRRAPCTRCVER-UHFFFAOYSA-N	448.549	1.424	50	20	IDGD	
COC(=O)c1c(S(=O)(=O)NNC(=O)c2ccc(COc3ccccc3)o2)n[nH]c1C	732045412	JRTOOZVELVTMCX-UHFFFAOYSA-N	434.430	1.300	50	20	IDGD	
O=C(NCCCNC(=O)c1ccc(F)cc1)NNC(=O)c1nn(-c2ccccc2)cc1O	732249940	ZEZREQDGWOJEDS-UHFFFAOYSA-N	440.435	1.481	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2ccc(OCC(F)(F)C(F)F)nc2)C[C@H](C)O1	732260753	HQFYOSDLTYQVMV-RYUDHWBXSA-N	436.406	1.621	50	20	IDGD	
C[C@@]12CCC(=O)N1c1ccccc1C(=O)N2CC(=O)NNc1ccccc1S(C)(=O)=O	732302464	HMEROTWCUCGNNS-NRFANRHFSA-N	442.497	1.532	50	20	IDGD	
CC(C)N(C)S(=O)(=O)c1cccc(C(=O)NNc2ccccc2S(C)(=O)=O)c1	732305154	BHKAPPGKHQYPQW-UHFFFAOYSA-N	425.532	1.876	50	20	IDGD	
O=C(COc1ccccc1-c1ccccc1)NNC(=O)NCCN/C(O)=C1\N=CC=CC1=O	732467037	UJLUPTSKHZHWCI-QURGRASLSA-N	449.467	1.589	50	20	IDGD	
O=C(Cc1cccc2ccccc12)NNC(=O)NCCS(=O)(=O)NC[C@H]1CCCCO1	732474186	JQTTYMHIBONXFT-GOSISDBHSA-N	448.545	1.201	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)NCc2ccccc2S(=O)(=O)N(C)CCO)cc1	733040529	DZHQHODYMOIJCB-UHFFFAOYSA-N	434.518	1.006	50	20	IDGD	
CC(C)OCCCn1c(NNC(=O)c2ccc(S(N)(=O)=O)o2)nc2ccccc2c1=O	733265532	FZWAVDFFLGNSOK-UHFFFAOYSA-N	449.489	1.209	50	20	IDGD	
C[C@H](CC(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1)NC(=O)c1ccccc1	734824823	JOKOJWKYESOAJS-OAHLLOKOSA-N	447.536	1.925	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)c2cc(-c3ccccc3)nc3ccccc23)c(=O)n(C)c1=O	734986992	XOJVGIIDIAYGFP-UHFFFAOYSA-N	429.436	1.374	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)cn1	735445929	JDYCXWDRLLVORH-JYRVWZFOSA-N	435.556	1.924	50	20	IDGD	
Cc1cccc(NC(=O)N2CCN(CC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)CC2)c1	738312367	RNKJZFHXGCTSEK-UHFFFAOYSA-N	440.460	1.514	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)[C@@H]1CCC[C@@H]1NC(=O)OC(C)(C)C	739734853	YNGQUSFMTKXVTR-OLZOCXBDSA-N	429.518	1.535	50	20	IDGD	
COCC(=O)N[C@H](C(=O)NNC(=O)[C@@H](C)Oc1cccc(Br)c1)C(C)C	741207145	JFKYNVDJIPUKIO-ABAIWWIYSA-N	430.299	1.151	50	20	IDGD	
Cc1ccc2cccc(C(=O)NNc3ncccc3S(=O)(=O)N3CCN(C)CC3)c2n1	741286895	IPWPJDNTFDYJNX-UHFFFAOYSA-N	440.529	1.631	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NN[C@@H](C(N)=O)c2ccc(Br)cc2F)c1	743468418	KILBQMQCIHGQTI-CQSZACIVSA-N	444.282	1.453	50	20	IDGD	
O=C(CCC1CCCC1)NCC(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	744619484	QQNXVPNLGOMPPC-UHFFFAOYSA-N	438.550	1.237	50	20	IDGD	
O=C(NCc1ccccc1CN1CCOCC1)NNC(=O)c1cc([N+](=O)[O-])ccc1O	745333527	OBXCKUZRUPCIKP-UHFFFAOYSA-N	429.433	1.277	50	20	IDGD	
CC[C@H]1Oc2cc([C@H](C)NC(=O)NNC(=O)COc3ccccc3O)ccc2NC1=O	745934064	YMBGBMHKCMXORW-BLLLJJGKSA-N	428.445	1.972	50	20	IDGD	
CC(C)OCCS(=O)(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	745998279	ISZAVOMIEPZELC-UHFFFAOYSA-N	447.560	1.538	50	20	IDGD	
NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NNC(=O)Cc3cn4ccccc4n3)cc2)C1	746754836	DTQOBHBOTDEJMM-QGZVFWFLSA-N	449.515	1.109	50	20	IDGD	
COc1ccc(C(=O)OCC(=O)NNC(=O)c2ccc(C)cc2)cc1N1CCNC1=O	747714933	GQVQNHGTZQFZRU-UHFFFAOYSA-N	426.429	1.151	50	20	IDGD	
Cc1ccccc1NC(=O)NNC(=O)c1ccc(S(N)(=O)=O)c(Br)c1	748058496	BTNNWKLEFWBUJJ-UHFFFAOYSA-N	427.280	1.871	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)NC[C@H](c1ccccc1Cl)N1CCOCC1	748620263	LGEUITUYMYTQHV-RHSMWYFYSA-N	428.917	1.095	50	20	IDGD	
O=C(Cc1cccc(F)c1)NCCNC(=O)NNC(=O)c1cc(Br)c[nH]1	748826203	ZFLSRWIUWVKYDP-UHFFFAOYSA-N	426.246	1.219	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCN(C(=O)OCc3ccccc3)CC2)n1	749528718	IVLACZWGJYGBGQ-UHFFFAOYSA-N	431.518	1.096	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)[C@H]1CCCN1C(=O)c1ccc2c(c1)OCO2	749715651	XRZSCEINNVGRQQ-OAHLLOKOSA-N	441.440	1.255	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)N[C@@H]2CC(=O)N(C3CC3)C2)c2ccccc2c1=O	750653627	XNFRRFKWPXREJS-CQSZACIVSA-N	440.504	1.294	50	20	IDGD	
CCCCN1C(=O)CC[C@H](C(=O)NNC(=O)C(=O)NC(C)C)[C@@H]1c1ccccc1OC	750873382	QKKGTBFJPZJFQH-LPHOPBHVSA-N	432.521	1.447	50	20	IDGD	
COc1cc(C=NNC(=O)CNC(=O)c2ccco2)cc(I)c1O	750939012	WBYAOOUWRZHLDP-UHFFFAOYSA-N	443.197	1.479	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)[C@]2(C)CCCN(C(=O)OC(C)(C)C)C2)c2ccccc2c1=O	751546950	GEADEEYNWKDIIH-JOCHJYFZSA-N	443.504	1.732	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCCn2c(O)nc3ccccc32)nc1	753042000	VSZJZIWWXKJWQN-UHFFFAOYSA-N	433.494	1.150	50	20	IDGD	
CCOC(=O)c1ccc(N2CC(NC(=O)NNC(=O)c3ccc(Cl)cc3OC)C2)nc1	753280045	QDERXYBPUYBFQE-UHFFFAOYSA-N	447.879	1.753	50	20	IDGD	
O=Cc1ccc(OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c(Br)c1	755108140	GVYPBOMBUIHURB-MRXNPFEDSA-N	435.230	1.628	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)Nc2ccc(N3CCCS3(=O)=O)cc2)cc1	755593340	KIHIHTNQVJNHHM-UHFFFAOYSA-N	434.474	1.467	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)Nc2ccc(CC(=O)N3CCOCC3)cc2)c1	755862559	SHHVGIGCIXNWPY-UHFFFAOYSA-N	442.472	1.572	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)NNC(=O)NC1CCN(S(=O)(=O)C(F)(F)F)CC1	756150192	MQRDKPYYKNSIHU-UHFFFAOYSA-N	447.439	1.355	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)N[C@@H]2CCN(c3ncccc3F)C2)nc1	756160411	PDVOIDKNOXDJQR-CYBMUJFWSA-N	437.501	1.207	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Nc2ccn(CC(=O)N(C)C)n2)ccc1OCCC(C)C	756311056	KYRLHESPSXACCW-UHFFFAOYSA-N	446.508	1.871	50	20	IDGD	
COc1ncnc(N(C)C)c1NC(=O)NNC(=O)COc1ccc(Br)cc1	757709623	TXNOALRFSXBRCQ-UHFFFAOYSA-N	439.270	1.545	50	20	IDGD	
COCCCS(=O)(=O)c1ccc(NC(=O)NNC(=O)COc2ccc(C#N)cc2)cc1	757821506	BVDDIPOKJSTPSW-UHFFFAOYSA-N	446.485	1.600	50	20	IDGD	
COc1ccccc1[C@@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)C(=O)Nc1ccccn1	758831533	QQEVJNMEIMAHHE-MRXNPFEDSA-N	443.460	1.442	50	20	IDGD	
CC(C)c1nc(C(=O)NNC(=O)C(=O)Nc2ccccn2)nn1-c1ccccc1Cl	758832186	UFTXCXQLUCFDBP-UHFFFAOYSA-N	427.852	1.839	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccnn2[C@@H](C)C2CC2)nc1	760308496	XRXHSMPNYFNMNQ-LBPRGKRZSA-N	435.510	1.018	50	20	IDGD	
COc1cc(C(=O)NNC(=O)N[C@@H]2CCN(C(=O)C3CCCC3)C2)cc(OC)c1OC	762085960	GDYPNXIZESTSBB-OAHLLOKOSA-N	434.493	1.448	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)CCc1c(C)nc2[nH]n(C)c(=O)c2c1C	762370226	IBRATLCPBZWNPE-UHFFFAOYSA-N	443.529	1.759	50	20	IDGD	
CCNC(=O)N1CCc2ccc(NC(=O)C(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)cc21	763442114	LIRYYGKNFBIFDL-UHFFFAOYSA-N	440.416	1.087	50	20	IDGD	
O=C(NNC(=O)c1ccncc1)C(=O)Nc1cc(F)c(I)c(F)c1	763465156	UFNPASJBGBSZFN-UHFFFAOYSA-N	446.151	1.364	50	20	IDGD	
COc1ccc(C(C)(C)C)cc1NC(=O)C(=O)NNC(=O)[C@@H]1COc2ccccc2O1	763573415	RYENHATXZNIHMH-SFHVURJKSA-N	427.457	1.919	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CNC(=O)NNC(=O)c1nn(-c2ccccc2)cc1O)C1CC1	763586257	SUPYJJUFRTZQGM-HNNXBMFYSA-N	444.492	1.825	50	20	IDGD	
Cn1ccnc1-c1cccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)c1	763605552	VBUXMLPDTLKVOI-UHFFFAOYSA-N	429.440	1.877	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2cccc(OCCN(C)C)c2)c1	763644345	IMGFUIJEIBINJB-UHFFFAOYSA-N	428.489	1.409	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(Cl)c(C(=O)N(C)C)c2)cc1C	763665262	QNJWRLAIGZIGJL-UHFFFAOYSA-N	446.891	1.824	50	20	IDGD	
O=C(COc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1ccccc1C(=O)N1CCCC1	763686446	MGFXQYBKEQSGSA-UHFFFAOYSA-N	444.875	1.741	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CC23CC4CC(CC(C4)C2)C3)cc1S(N)(=O)=O	763735957	PKRNSDKMWBBIEE-UHFFFAOYSA-N	448.545	1.335	50	20	IDGD	
O=C(NNC(=O)c1cccc(Cl)c1)C(=O)Nc1ccc(N2CCCS2(=O)=O)cc1	763752496	FNLBJEVLBQQJRN-UHFFFAOYSA-N	436.877	1.280	50	20	IDGD	
COCCOc1ccc(F)cc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccc(F)cc1	763865155	IZRPUDMWGWVIBI-GFCCVEGCSA-N	437.399	1.543	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)C(=O)Nc2cccc(OCC(=O)N(C)C)c2)cc1	763890898	IAICAIQRUKWUAU-UHFFFAOYSA-N	444.513	1.340	50	20	IDGD	
O=C(CCSc1ccc(F)cc1)NNC(=O)C(=O)Nc1ncn(Cc2ccccc2)n1	763894968	IWQZZUKLUSRXQN-UHFFFAOYSA-N	442.476	1.734	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccnn2Cc2ccc(C)o2)cc1OC	763902759	XJNVKWWESREQMA-UHFFFAOYSA-N	441.444	1.640	50	20	IDGD	
COC(=O)[C@@H](C)Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)cc1	763974150	LVNOMCROVGUCGZ-NSHDSACASA-N	433.848	1.797	50	20	IDGD	
CCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(C)cc3)[nH]n2)c(C)c1	764110200	HEBYTXCCRFLZLK-UHFFFAOYSA-N	448.483	1.843	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)C(=O)Nc1ccccc1-n1cc(Br)cn1	764263382	GBYLENIOFRCMDW-UHFFFAOYSA-N	443.261	1.358	50	20	IDGD	
O=C(NNC(=O)C1CCC1)C(=O)Nc1cccc(CS(=O)(=O)Cc2ccccc2)c1	764338018	BDUAJDPWFZYPNG-UHFFFAOYSA-N	429.498	1.688	50	20	IDGD	
CC[C@H](C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1)c1ccc(F)cc1	764462702	PKESWPZCZGOIAT-KRWDZBQOSA-N	435.525	1.794	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNS(=O)(=O)c3ccc(Cl)nc3)CC2)cc1	765129055	ZXMKGWUJMWMYRE-UHFFFAOYSA-N	437.953	1.171	50	20	IDGD	
COc1ccc(C(=O)NCC(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)cc1[N+](=O)[O-]	765570255	YCWHOHCPPDMHQP-UHFFFAOYSA-N	444.429	1.246	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCCCCC3)cc2)n[nH]1	765586853	KKBRFWYQPWQDDR-UHFFFAOYSA-N	433.534	1.677	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc([N+](=O)[O-])c2cccnc12)c1cnn(-c2ccccc2)c1	766368031	DBJFAJYWQWJCAU-UHFFFAOYSA-N	438.425	1.952	50	20	IDGD	
C[C@@H]1C[C@@H]1c1ccc(CCC(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)o1	766642902	OOYUMKUIOQJKRW-XLIONFOSSA-N	438.528	1.941	50	20	IDGD	
CC(C)c1cc(NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)n(-c2ncccn2)n1	768243421	VPDJVXWIAOVWKL-UHFFFAOYSA-N	443.851	1.544	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)[C@H](C(C)C)N2C[C@@H](C)O[C@H](C)C2)n[nH]1	768282077	WBDNNMFCCBSQOQ-SXGZJXTBSA-N	429.521	1.980	50	20	IDGD	
COc1ccc(NNC(=O)[C@@H]2CCCN2S(=O)(=O)c2cccs2)c([N+](=O)[O-])c1	768329501	WYJGGPVHDYAEHF-ZDUSSCGKSA-N	426.476	1.961	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNS(=O)(=O)c1cc(Br)sc1Cl	771141966	CJIOBIIGQCEKLA-UHFFFAOYSA-N	442.700	1.497	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1cccc(S(=O)(=O)Nc2cccc(C)c2)c1	771869106	SVBKFOUUFUJBKE-AWEZNQCLSA-N	433.486	1.899	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1cc(S(=O)(=O)N2CCCC[C@H]2C)ccc1C	771934922	XAAJQVZSNDHFGZ-HUUCEWRRSA-N	439.534	1.661	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)CCc1nc(O)c2c3c(sc2n1)C[C@@H](C)CC3	771950579	ZJFXPLLBEBAJBD-WDEREUQCSA-N	434.518	1.943	50	20	IDGD	
CC(C)(CC(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1)NC(=O)OC(C)(C)C	772193260	SETSWCAUVZPNJN-UHFFFAOYSA-N	426.901	1.797	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)c1nc(S(C)(=O)=O)n2ccccc12	772971812	OQOXXYQXQOMVKC-LLVKDONJSA-N	436.877	1.620	50	20	IDGD	
CS(=O)(=O)c1cccc(Cl)c1C=NNC(=O)Cc1csc(N2CCOCC2)n1	773188486	DAEQKULNAJMJMB-UHFFFAOYSA-N	442.950	1.729	50	20	IDGD	
CC(=O)N(CCc1ccccc1)CC(=O)NNC(=O)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	773411522	NJPSBBUASMUCEK-LJQANCHMSA-N	446.548	1.872	50	20	IDGD	
CNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)c1C	774008067	ITJJSRWTULHJHT-LBPRGKRZSA-N	432.864	1.561	50	20	IDGD	
CO[C@@H]1[C@H](C)[C@H](NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)C1(C)C	776067649	UBHBRMLJSRREAR-XOKHGSTOSA-N	438.550	1.475	50	20	IDGD	
CN(NC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(Br)s1)C(N)=O	778415484	IMOUURHJUABUKL-QMMMGPOBSA-N	425.330	1.096	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)NNC(=O)CNC(=O)OC(C)(C)C)c(C)n1C[C@@H]1CCCO1	778444863	ALXZBXBIUCARGA-BHEJFATLSA-N	445.520	1.863	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)c1c[nH]nc1-c1cccc(OC(F)F)c1	778445497	OMVROLOTDPOEEP-UHFFFAOYSA-N	425.392	1.964	50	20	IDGD	
O=C(NN=c1cc[nH]cc1)Nc1ccc(CC(=O)N2CCN(c3ncccn3)CC2)cc1	782012261	JYYHGIAMMZVVAT-UHFFFAOYSA-N	432.488	1.333	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)c1cccc(NS(=O)(=O)C(F)(F)F)c1	782537353	HNWHOLDBTHVFGJ-AWEZNQCLSA-N	445.375	1.549	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CCC[C@H](NC(=O)NNC(=O)[C@H]2COc3ccccc3O2)C1	782645837	AIMQPHQJFNZBAH-JJRVBVJISA-N	434.493	1.993	50	20	IDGD	
CC(C)(C)OC(=O)NCc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(O)cc2)c1	782834068	QEFMFZIMZAXEOO-UHFFFAOYSA-N	428.445	1.817	50	20	IDGD	
O=C(NNc1ccc(F)cc1F)C(=O)Nc1ccccc1OCC(=O)N1CCOCC1	783344877	OXZUGPGNOMSWQO-UHFFFAOYSA-N	434.399	1.284	50	20	IDGD	
COc1cc(OC)c(Cn2nccc2NC(=O)C(=O)NNc2cc(C)ncn2)c(OC)c1	783945854	QBIYKCNTMDADCK-UHFFFAOYSA-N	441.448	1.137	50	20	IDGD	
O=C(NNC(=O)[C@H]1CC=CC[C@@H]1C(=O)N1CCOCC1)c1cc(-c2cccs2)[nH]n1	784456276	LROUMACTUQDEHM-KBPBESRZSA-N	429.502	1.340	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ccccc2C(F)(F)F)cc1OCC(N)=O	784823707	AQCQHOADLJYRFU-UHFFFAOYSA-N	426.351	1.660	50	20	IDGD	
COCCCS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccc(Cl)nc2)cc1	784870410	RJLKAOVUFGSKKU-UHFFFAOYSA-N	426.882	1.627	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F	785059817	BKPSQZVGCBASOJ-UHFFFAOYSA-N	448.342	1.173	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)C(=O)Nc1ccc(Cl)c(OC(F)F)c1	785067749	LRRGQMPIJWZCOV-UHFFFAOYSA-N	437.790	1.918	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)Cc2ccccc2S(C)(=O)=O)c2ccccc2c1=O	785689630	OVXHYOHAUAQOQZ-UHFFFAOYSA-N	442.497	1.214	50	20	IDGD	
CC(=NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)c1cc(C)nn1C	788955056	PBVWUHCYQROCKW-UHFFFAOYSA-N	433.534	1.222	50	20	IDGD	
Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	789439815	IOHTVGYBSIBNND-UHFFFAOYSA-N	435.462	1.928	50	20	IDGD	
COC1(CC(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)CCC1	790114728	TWOWDIPVIKGMLZ-UHFFFAOYSA-N	431.514	1.885	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)Cn1c(S)nnc1-c1cccc(C)c1	791728021	WSEXTDCVMDDGDV-UHFFFAOYSA-N	427.486	1.777	50	20	IDGD	
CC[C@H](C)NS(=O)(=O)Cc1cccc(NC(=O)C(=O)NNc2nc3ccccn3n2)c1	792395101	PCQOEKBHYNOXOY-ZDUSSCGKSA-N	445.505	1.029	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)NCc2ccc(C(=O)N3C[C@@H](C)O[C@H](C)C3)cc2)n1	792919491	JKFXOTPWDBMDKM-HZPDHXFCSA-N	425.489	1.784	50	20	IDGD	
O=C(NNc1ccc2c(=O)[nH]ccc2c1)C(=O)Nc1ccc(S(=O)(=O)C(F)F)cc1	793070108	WXYXDCAOQXWPCW-UHFFFAOYSA-N	436.396	1.606	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)[C@@H]2CCCC[C@H]2C(=O)NNC(=O)c2cccc(C)n2)n1	794080540	TXRPSXLOKWEGOS-HZPDHXFCSA-N	438.488	1.122	50	20	IDGD	
Cc1cc(C(=O)NNS(=O)(=O)c2ccc(S(C)(=O)=O)nc2)c(C)n1-c1ccccc1	794578224	HWLSGPZCDWENNX-UHFFFAOYSA-N	448.526	1.516	50	20	IDGD	
Cc1cccc(C(=O)NNS(=O)(=O)c2cc(Br)c(C)c([N+](=O)[O-])c2)n1	794599829	PRZIJANJIDFGCY-UHFFFAOYSA-N	429.252	1.992	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2[C@@H](C)CN(C(=O)C(C)(C)C)C[C@H]2C)cc1OC	795140371	CHRFMRSDGGHKFR-GASCZTMLSA-N	434.537	1.432	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)c1ccc2c(c1)CCN2S(C)(=O)=O	795169714	UOXWXDKTTRCUSH-UHFFFAOYSA-N	438.531	1.016	50	20	IDGD	
CCOC(=O)C1(S(C)(=O)=O)CCN(S(=O)(=O)c2ccc(CCCl)cc2)CC1	796185376	XHMMQELCFMRBNA-UHFFFAOYSA-N	437.967	1.599	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(Cl)c(CN3CCOCC3)c2)cc1	797535924	RWDVMNSBJKMKNR-UHFFFAOYSA-N	441.875	1.444	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H](c2cccc(F)c2)N2CCOCC2)cc1C	798310477	ZBVOEBCPFXQDEH-IBGZPJMESA-N	428.464	1.602	50	20	IDGD	
CCO[C@@H]1C[C@@](NC(=O)OC(C)(C)C)(C(=O)NNC(=O)NCC(F)(F)F)C1(C)C	798315597	LHVZZSIFQHVWED-QLJPJBMISA-N	426.436	1.978	50	20	IDGD	
COC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)c1OC(C)C	799257896	VHGSMOPQOFDILU-UHFFFAOYSA-N	443.412	1.389	50	20	IDGD	
CSC[C@@H](C)C(=O)N1CCC(C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)CC1	799309536	SDIMSGPWZWFEKF-CYBMUJFWSA-N	441.575	1.089	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)[C@H]2CC(=O)N(c3ccc(OC)cc3OC)C2)cc1	802057332	PQHBUTCRVPTDES-ZDUSSCGKSA-N	428.445	1.918	50	20	IDGD	
CC1(C)CC(=O)c2cc(C(=O)NNC(=O)Nc3ccc(S(C)(=O)=O)cc3)c(O)nc2C1	802063690	ABMDQDBFSGWQIY-UHFFFAOYSA-N	446.485	1.812	50	20	IDGD	
COc1cccc(C2(C(=O)OCC(=O)NNC(=O)c3ccc(OC)c(OC)c3)CC2)c1	803790144	BMGMBWCNNIAEBP-UHFFFAOYSA-N	428.441	1.748	50	20	IDGD	
Cc1c(NC(=O)CSCC(=O)NNc2cccc(F)n2)c(=O)n(-c2ccccc2)n1C	804771350	SQBDHDFWMXTHPS-UHFFFAOYSA-N	444.492	1.834	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N[C@H](c2nncn2C)C(C)C)cc1Br	805103695	AONKMDANILDJGG-ZDUSSCGKSA-N	425.287	1.928	50	20	IDGD	
Cn1cccc1C(=O)C(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	806344743	LJTWAVRYTNEWGV-UHFFFAOYSA-N	432.483	1.531	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cc(F)c(N3CCOCC3)cc2F)cc1	806974237	AUDOVURGVGHNBF-UHFFFAOYSA-N	448.426	1.275	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1	807368396	CVVSPGMSTZQAOA-NSHDSACASA-N	428.467	1.198	50	20	IDGD	
CCOC(=O)C(=O)c1cc(S(=O)(=O)NNC(=O)c2cc(C)nc3ccccc23)cn1C	808069141	PBRMFRBTDDAJPJ-UHFFFAOYSA-N	444.469	1.251	50	20	IDGD	
CCCOc1ccc(C(=O)NNS(=O)(=O)c2cnc(NC(C)=O)s2)cc1OC	808069591	AJRINXJDTSOXIF-UHFFFAOYSA-N	428.492	1.522	50	20	IDGD	
CCS(=O)(=O)N1CCC([C@H](C)N(C)C(=O)NNC(=O)CCOc2ccccc2)CC1	808254703	DZEUZICTBDBDSE-INIZCTEOSA-N	440.566	1.578	50	20	IDGD	
NC(=O)c1ccc(OCC(F)F)c(NC(=O)C(=O)NNC(=O)c2c[nH]c3ccccc23)c1	810385096	LQNRVGSTMIZWBV-UHFFFAOYSA-N	445.382	1.310	50	20	IDGD	
COC(=O)c1c(F)ccc(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)c1F	810385888	DAWHULIPIUNXLO-UHFFFAOYSA-N	425.319	1.055	50	20	IDGD	
CC(C)(C)OC(=O)N1CCOc2ccc(NC(=O)C(=O)NNC(=O)CC3CC3)cc2C1	812979878	FOGGSKIVGOHQEV-UHFFFAOYSA-N	432.477	1.702	50	20	IDGD	
CC(C)(C)OC(=O)N1CCOc2ccc(NC(=O)C(=O)NN=c3cc[nH]cc3)cc2C1	812983887	LEBQKBMERCKKQN-UHFFFAOYSA-N	427.461	1.715	50	20	IDGD	
Cn1c(=O)c(CNC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])cc2ccccc21	813838037	ABGJXVWOXGQKJS-UHFFFAOYSA-N	425.401	1.356	50	20	IDGD	
O=C(NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)NNC(=O)[C@H]1CCc2nncn2C1	814325746	YJSDSUYCPDJXAJ-JTQLQIEISA-N	427.343	1.298	50	20	IDGD	
O=C(NN=C1COc2cc(F)cc(F)c21)c1cccc(S(=O)(=O)N2CCOCC2)c1	814688784	MMFCUCULBUIMNP-UHFFFAOYSA-N	437.424	1.512	50	20	IDGD	
CCOc1ccc(NNC(=O)C(=O)Nc2ncn(Cc3ncc(C)c(OC)c3C)n2)cc1	815815050	IZUGWBHNTXVMNI-UHFFFAOYSA-N	439.476	1.827	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)c1cc(S(C)(=O)=O)ccc1Cl	817052917	WBQBLPBWYJHSSO-UHFFFAOYSA-N	431.923	1.751	50	20	IDGD	
CC/C=C(/C)C(=O)N1CSC[C@@H]1C(=O)NNc1ccccc1S(=O)(=O)N(C)C	817055216	RNARDRLDOUJKRQ-JEMSNHSXSA-N	426.564	1.638	50	20	IDGD	
COc1cccc(/C=C(\C(=O)NNC(=O)COc2ccc(C)c(C)c2)n2nnnc2C)c1	818023340	GBXZBKORKIIXDO-UDWIEESQSA-N	436.472	1.831	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)CCC(=O)N2CCC(c3ccccc3)=N2)C[C@H](C)O1	912919128	KIYNCACAOWXAFJ-IRXDYDNUSA-N	429.521	1.050	50	20	IDGD	
CSCC[C@@H](C(=O)NNC(=O)Cc1ccc(F)cc1)N1C(=O)c2ccccc2C1=O	913156192	PMMMVPXZRARBPA-KRWDZBQOSA-N	429.473	1.934	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)cc1	914832290	ROGDJOKGBRBTQY-UHFFFAOYSA-N	434.518	1.503	50	20	IDGD	
Cc1[nH]c2ccc(Br)cc2c1CC(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1	915141105	CPTSYHXDBRWIHC-JTQLQIEISA-N	428.308	1.363	50	20	IDGD	
CN(C)N(C(=O)c1cnn(-c2ccc(Br)cc2)c1)[C@@H]1CCS(=O)(=O)C1	916040933	HQJWCKDBOCQRPS-OAHLLOKOSA-N	427.324	1.741	50	20	IDGD	
C[C@H](Cn1cccn1)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	916463499	MIXDTQMBQFWQME-OAHLLOKOSA-N	434.522	1.090	50	20	IDGD	
CCS(=O)(=O)NCCNC(=O)NNC(=O)c1cc2c(s1)CC[C@@H](C(C)(C)C)C2	916516697	OOKPYSSOLCDXOF-CYBMUJFWSA-N	430.596	1.782	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCCOc2cccc(F)c2)cc1	916634304	DKTQYRYEKHEQCH-UHFFFAOYSA-N	438.481	1.164	50	20	IDGD	
COc1cc(CNC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)ccc1OCC(=O)N(C)C	916641542	QQVOBZJRIKOCEN-UHFFFAOYSA-N	445.432	1.215	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(C)nc3cc(C)nn23)c1	916743878	VKACKOGVBJCZFZ-UHFFFAOYSA-N	444.517	1.451	50	20	IDGD	
CCOc1ccccc1C(=O)N1CCN(CC(=O)NNC(=O)c2ccccc2Cl)CC1	917141500	IMXTUMMFZGBIJU-UHFFFAOYSA-N	444.919	1.958	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2cc(C(=O)NNC(=O)C(C)(C)C)ccc2Cl)C[C@@H](C)O1	917182654	QNFDFYAVVHKZNY-TXEJJXNPSA-N	431.942	1.945	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)Cn2cc(C(N)=O)c3ccccc32)c2ccccc2c1=O	917390173	CQZWLTCLVIECTC-UHFFFAOYSA-N	446.467	1.321	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1	918118967	WVMLGRNSWOUFBY-SFHVURJKSA-N	438.532	1.599	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)NCc2ccc(N3CCOCC3)c(F)c2)nc2ccccc21	918218302	UVSNJWSMJOURNZ-UHFFFAOYSA-N	440.479	1.622	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@H]1CCCN(CC(F)(F)F)C1	919810109	YBGQYPCFZWWEIJ-LBPRGKRZSA-N	435.472	1.323	50	20	IDGD	
CN(C)C(=O)C[C@@H](NC(=O)NNC(=O)COc1ccccc1[N+](=O)[O-])c1ccccc1	920045963	FMLYDYBUDMUERB-OAHLLOKOSA-N	429.433	1.524	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)c1cc([N+](=O)[O-])cc(S(C)(=O)=O)c1	920277600	GOUFLZTUVXCHLB-UHFFFAOYSA-N	445.251	1.174	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2cc(C(=O)NNC(=O)NCC3CC3)ccc2Cl)C[C@H](C)O1	920860170	IXTIEPOFBRDBHE-RYUDHWBXSA-N	444.941	1.492	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)[C@H](C(C)C)N2C[C@H](C)O[C@@H](C)C2)c2ccccc2c1=O	921202715	BGLDJYUGXAYEQJ-FTRWYGJKSA-N	443.548	1.701	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)ccc1N1CCCC1=O	1320114509	ZYVBZNYSSSZYLM-UHFFFAOYSA-N	437.504	1.981	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4cc(OC)ccc4n3)C2)C1	1777900353	RRAPQCQSIDJDPK-HTAPYJJXSA-N	447.919	1.941	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)N(C)C(C)=O)C1	1778104979	ORLFHFINRXDRKG-GKDNMFGBSA-N	446.386	1.541	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)[C@@H]3CCC[C@@H]4CCCC[C@@H]43)C2)C1	1778299012	NJHFVHOZYJEKIJ-PWSZPPJVSA-N	448.608	1.796	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)N2C[C@H]3C[C@H]3C2)C1	1779264720	OTXOGQWGPGBKEE-XWUBNECOSA-N	427.973	1.094	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3nc(O)n4c3CCCC4)C2)C1	1779346962	AZDUQRSGTPWLDH-RTBURBONSA-N	445.347	1.605	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(CCN(C(=O)c3cc(-c4cccnc4)[nH]n3)C2)C1	1779607099	BEXSPYRZEPPIBK-LJQANCHMSA-N	448.321	1.700	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc(O)nc2)C1	1780125810	CGJSWKBRRABTIZ-ZXYWRSMDSA-N	440.338	1.946	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(N4CCN(C)CC4)cc3)CCO2)C1	1781210962	FHYPZKFGXTYPOW-NFBKMPQASA-N	448.995	1.899	50	20	IDGD	
O=C(c1ccc2n[nH]cc2c1)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781331062	KIMLFWCIPUVZBZ-PBHICJAKSA-N	425.258	1.697	50	20	IDGD	
Cc1nc[nH]c1CSCC(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781331415	JWWAENQOIHSITH-HOCLYGCPSA-N	449.346	1.472	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc([N+](=O)[O-])o1)C2	1782168624	RTNHLKBZNZSXBJ-WPKBUWHJSA-N	429.857	1.569	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)Cc3c(C)noc3C)CCO2)C1	1783344562	UQAYFHDSOMAUTA-QAPCUYQASA-N	428.327	1.837	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)C[C@@H](N)c3cccnc3)CCO2)C1	1783532430	HTAGVRCCXCRSEH-JOQOYGCGSA-N	425.327	1.085	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)Cc3c(F)ccc(F)c3F)CCO2)C1	1783871026	LVSMFHRSRUQAGL-BFUOFWGJSA-N	434.842	1.730	50	20	IDGD	
O=C(C(Cl)Cl)N1CC[C@@]2(C1)CN(C(=O)[C@H]1ON=C(c3ccccc3)O1)CCO2	1783946110	IMTBQGCQDGCCJW-QZTJIDSGSA-N	428.272	1.355	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]3C2)c(O)n1	1783970097	NAJCUKFONCORIG-MZGVZZPPSA-N	440.338	1.720	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=N/O[C@@H]3CCCCO3)C[C@@H]21	1784618425	ZVSAXVZOXKTWCK-DVBHBNPLSA-N	429.945	1.903	50	20	IDGD	
C[C@@H](C#N)c1cccc(C(=O)N2CC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c1	1785084756	WXXQRHASLCQOCM-GAJHUEQPSA-N	441.532	1.130	50	20	IDGD	
CC1(CC(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](F)Cl)CCO3)CN(C(=O)OC(C)(C)C)C1	1785709751	QPGRLDYLRHXLBS-FOIQADDNSA-N	447.935	1.998	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3nccc4nc[nH]c34)[C@H]2C1	1787357442	LCBMHKQOCHCMDH-UHXUPSOCSA-N	436.310	1.335	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CC(=O)Nc3cc(C)on3)[C@H]2C1	1787492655	MAHUZLJXNKOOII-AJNGGQMLSA-N	426.901	1.309	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3c(C)nc4ccccn34)[C@H]2C1	1787849270	UQOIVKRQDHKSBO-QAETUUGQSA-N	434.924	1.490	50	20	IDGD	
COCc1c[nH]c(C(=O)NC2(c3ccc(NC(=O)c4cccc(B(O)O)c4)cc3)CCC2)c1	1788147926	OZCSSPJLEWCIRH-UHFFFAOYSA-N	447.300	1.902	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3n[nH]c4ccc(F)cc34)[C@H]2C1	1788388270	GOTBQTNZOKUMHV-SIUGBPQLSA-N	438.887	1.549	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CS[C@H]3CCCCO3)[C@H]2C1	1788646314	FRARFEFRNCFENV-RPUYLAQPSA-N	434.986	1.480	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4cccnn4n3)C[C@@H]21)[C@@H](F)Br	1789924416	CHJCAPWJKGUTEN-HQRZJTNHSA-N	440.273	1.013	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)c1cc(Cl)c(F)cc1F	1790008632	VWAWMPQPSGRJQW-JIVACREVSA-N	437.270	1.811	50	20	IDGD	
C[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]21)c1ccccc1	1792238053	FNZJXIKGLJUFPU-LEAZDLGRSA-N	430.549	1.143	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCOc1ccc(F)cc1	1792736653	BIFMZXXYMOUSTB-ZUMXRPEOSA-N	443.313	1.968	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cnc3ccccn13)C2	1792868762	OKLZTWZCXGXJPT-BKEDOTJMSA-N	449.349	1.497	50	20	IDGD	
CCc1nn(C)c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](O)CCl)c1Br	1793110687	UAHDBJROJSUVGZ-LSCVPOLPSA-N	447.761	1.597	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CSCc1[nH]cnc1C)C2	1793448483	CKWPOXSOPSQSQY-BASYENTBSA-N	428.986	1.948	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(-c3ccncc3)[nH]n1)C2	1795115837	MZBNQHUMYUSRIN-ZSBFGKGUSA-N	448.321	1.460	50	20	IDGD	
O=C(NC1(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](O)CCl)C3)CC1)OCc1ccccc1	1797854892	GEXWYQGWOUNFJO-XMTFNYHQSA-N	449.935	1.683	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc3sccn3c1)C2	1798440514	ZDCZJXHASAKXJS-QDMKHBRRSA-N	438.513	1.565	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)S)C2	1798523171	VAYOGOZJCGAPGH-MMPOEDRJSA-N	437.474	1.042	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3cccn3cn1)C2)[C@H](F)Br	1799347857	VMJCWXVACIMFNC-JLUCKKNBSA-N	425.258	1.228	50	20	IDGD	
COc1ccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Cl)C3)c([N+](=O)[O-])c1	1799401604	XJKRKNLXGDZKPW-LZDSYCOUSA-N	429.832	1.270	50	20	IDGD	
Cc1cc(O)c([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2	1799830263	MWPCLIFRFPZUCP-WDAIWFPHSA-N	432.260	1.616	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)Oc1ccccn1)C2	1800762916	KIPNCAALFKOODS-IPVBOJNNSA-N	426.311	1.222	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cc3cccnc3cc1F)C2	1800977133	JQZRMTVFVQNLDB-KYFSNAEOSA-N	449.910	1.760	50	20	IDGD	
Cc1ccc(C(=O)NCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CO[Si](C)(C)C)C3)cc1	1802120669	IJEDGTIKIJLIEU-RMFSNUHRSA-N	447.608	1.166	50	20	IDGD	
CN(C)C(=O)NCC(=O)NC[C@@H]1CCN(C(=O)[C@@](C)(Cl)CCl)[C@H]1c1cccnc1	1802681286	PHNYSZDDDIIODT-QOKNQOGYSA-N	444.363	1.595	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)CN2CC(=O)NC2=O)[C@H]1c1cccnc1	1804183152	LJNBDWMAKZFRAL-RVKKMQEKSA-N	435.912	1.047	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H](CNC(=O)c2cnnn2C)[C@@H]1c1cccnc1	1804740586	WMQADRXDKBIOEQ-XPKDYRNWSA-N	435.326	1.561	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)c2ccncc2)[C@H]1c1cccnc1	1805476764	TZDJFYHZOPJUQG-FXAWDEMLSA-N	445.483	1.109	50	20	IDGD	
CCc1oncc1C(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1806033304	QZFQRUSLVBRWPS-IIBYNOLFSA-N	442.520	1.325	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)o1	1807360242	POEOIWGABAAXSQ-NQIIRXRSSA-N	433.273	1.296	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)[C@H]2CC=CCC2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807363940	DJPRWNIGCOMOBW-CZTZKLFOSA-N	433.317	1.437	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)[C@H]2CC=CCC2)[C@@H]1c1cccnc1	1808147775	LQRQSEMEHOUECY-KPLVRAHFSA-N	427.549	1.817	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2cnn3cccnc23)[C@H]1c1cccnc1	1809745333	OYWWKCRUPQJLQV-RYQLBKOJSA-N	442.907	1.698	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)c1cc2ncccn2n1	1809761640	WRDWYZVHEHVSAX-QILLFSRXSA-N	428.880	1.044	50	20	IDGD	
Cc1nc(C(=O)N2CCC3(CCCN(C(=O)c4ccc(B(O)O)cc4)C3)CC2)sc1C	1809970820	BKNKCNBZAQXWOS-UHFFFAOYSA-N	441.362	1.598	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)c3c(F)cccc3F)CC2)C1	1809977499	AYHAAUCXEOGSDZ-UHFFFAOYSA-N	442.271	1.803	50	20	IDGD	
CS(=O)(=O)c1cncc(C(=O)N2CCC3(CCCN(C(=O)[C@H](F)Cl)C3)CC2)c1	1810899527	QOWAKWHMYBPTSE-HNNXBMFYSA-N	431.917	1.864	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)c1cccc2ccnn12	1812084450	DCYPITSGJKYIEW-IPELMVKDSA-N	427.892	1.649	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)[C@H](C)CC(N)=O)[C@H]1c1cccnc1	1812865414	OTPFNFLYQVENKV-DSPQJCBJSA-N	425.327	1.382	50	20	IDGD	
CN[C@H](CC(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](C)CBr)n[nH]1)C(=O)O	1814779973	BRNXOCURQASMLM-RTXFEEFZSA-N	444.330	1.496	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1coc(Cl)n1	1816174709	WKJPCRGWQIKEEV-OAHLLOKOSA-N	443.656	1.351	50	20	IDGD	
CC(C)NCCC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1817441918	UHEPRNOSQRVYMX-QGZVFWFLSA-N	442.524	1.102	50	20	IDGD	
CC(=O)C(C)(C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1	1817470500	SRNITRVAPHWMEO-KRWDZBQOSA-N	426.282	1.011	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cccc(F)c2)[nH]n1)c1ccc(B(O)O)cc1	1817472731	ULPADIUTHBTDDO-LJQANCHMSA-N	436.252	1.848	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)c3n[nH]cc3[N+](=O)[O-])sc2C1	1820302559	HHDSMCQUZDVHEA-RNFRBKRXSA-N	443.283	1.784	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](N)CCC(N)=O)[nH]n1	1820864174	RXCXGRUFKUBMSI-BFCNOCSMSA-N	433.340	1.231	50	20	IDGD	
Cc1ccnc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)c1	1827757205	FEFOFXZUDPGTOE-JOCHJYFZSA-N	435.333	1.617	50	20	IDGD	
CCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCN2C(=O)OCc1ccccc1	1828547900	BAKLQYMVDBGWAE-LAUBAEHRSA-N	437.924	1.448	50	20	IDGD	
Cc1c[nH]cc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1	1828926716	OHDUBSNOKWYSIC-HXUWFJFHSA-N	438.532	1.869	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CCCCO1)CCO2	1829908315	DTZMDBPYQYAFHR-VKJFTORMSA-N	433.343	1.043	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](CN)c3ccccc3)C2)C1	1830359319	MTKWSFFFGQSDNR-GCJKJVERSA-N	437.968	1.450	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4cccnn4n3)C2)C1	1830365378	XACFXRZVJLDUOI-FQEVSTJZSA-N	435.912	1.064	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C=C/c3ccoc3)C2)C1	1830535335	MRGXSNVSBFHXAH-UCAFPWNGSA-N	441.322	1.780	50	20	IDGD	
Cc1ccc(SCC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)cc1	1830731467	LRNPRRKQBDYDNY-PXNSSMCTSA-N	442.965	1.143	50	20	IDGD	
O=C(c1cc(-c2ccccc2)no1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1830731713	MEVPFEGLEDXRLK-UTKZUKDTSA-N	449.891	1.011	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnnc(Cl)c3)C2)C1	1831644555	ZPAWWPYGPHBQED-KSSFIOAISA-N	431.320	1.608	50	20	IDGD	
O=C([C@@H](F)Br)N1CCC([C@@H]2CCCCN2C(=O)CCn2ccnn2)CC1	1832246468	HEQAOFNCVPAKFM-GOEBONIOSA-N	430.322	1.978	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)[C@H]2CCCSC2)CC1	1832856364	NAUSIVFBHDYXHQ-FPOVZHCZSA-N	444.406	1.743	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)CCl)CC2)CC1	1833310719	YYSIMCRZNKUZFL-GOSISDBHSA-N	447.967	1.428	50	20	IDGD	
Cc1cnc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)s1	1833805292	MJFJEFQOZISUTQ-MLGOLLRUSA-N	432.340	1.305	50	20	IDGD	
O=C(CCCc1ccncc1)NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1833843337	GVUAZXPTQPQKPP-HXUWFJFHSA-N	436.984	1.576	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](F)Cl)CC2)CC1)c1cccn2c(O)nnc12	1835043505	RTJBUDYJXWULCA-HNNXBMFYSA-N	438.891	1.155	50	20	IDGD	
COCCn1nccc1C(=O)N1CCC(N2CCC(NC(=O)[C@H](F)Cl)CC2)CC1	1835079817	UJNBMURBHVALHA-KRWDZBQOSA-N	429.924	1.249	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CCC(F)(F)F)CCO2)C1	1835328929	FLOJPSSMURRCCP-SWLSCSKDSA-N	445.276	1.959	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](OC(C)=O)C(C)C)CC2)CC1	1835650463	JZGYJKRPOWOVPX-OALUTQOASA-N	445.988	1.400	50	20	IDGD	
Cn1cccc(C(=O)N2CCC(N3CCC(NC(=O)CO[Si](C)(C)C)CC3)CC2)c1=O	1835835330	VFMSYKPKAASLHU-UHFFFAOYSA-N	448.640	1.422	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cccn3ccnc13)CCO2	1837000186	HTLJGCXUZGMVQX-NRFANRHFSA-N	446.580	1.256	50	20	IDGD	
O=C([C@H](F)Cl)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1[C@H]3Sc4ccccc4[C@H]31)CCO2	1837473898	XSASHSQUPQWACP-DRCYAFTPSA-N	440.924	1.865	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccc(OC)c(F)c3)C2)C1	1839149220	YAYLPUPMRWDPKS-HRAATJIYSA-N	442.915	1.851	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C=C/c3ccoc3)C2)C1	1839962346	BMPLTEKKHAHZKO-HLPXUMPJSA-N	441.322	1.923	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccncc3Cl)C2)C1	1840033643	MFSKRNHGEUYZKL-PXAZEXFGSA-N	446.729	1.588	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CSC3CCCC3)C2)C1	1840150089	FJZQSKXIHLDKHM-LPHOPBHVSA-N	434.986	1.372	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccccc3Cl)C2)C1	1840151510	FFFXLGYGAWXUMY-PXNSSMCTSA-N	445.343	1.593	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@H](CCO)NC(=O)OC(C)(C)C)C1	1841428941	AONGQVJFJDZUJZ-GJZGRUSLSA-N	431.961	1.873	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC2(CCCN2C(=O)C2CCN(S(C)(=O)=O)CC2)C1	1843838128	VKOBGXRWGALTKV-MRXNPFEDSA-N	440.393	1.098	50	20	IDGD	
CN(C)C(=O)c1cccc(C(=O)N2CCCC23CN(C(=O)[C@H](F)Br)C3)c1	1846924037	OROJUQSINFSGQO-AWEZNQCLSA-N	426.286	1.896	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)/C=C(/C)C(=O)O)C1	1846994307	UQVBEUFZDZWRHE-WQLSENKSSA-N	431.401	1.368	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H]1CC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl	1847556086	CQOKGFKWEZFHAA-FXUDXRNXSA-N	429.945	1.578	50	20	IDGD	
Cc1nnc(CC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)o1	1848099004	CORWXBSDDCMQOL-IHRRRGAJSA-N	441.916	1.254	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Cc2cnn(-c3ccccc3)c2)cc1	23354424	PFJAEQWSBKPPIL-UHFFFAOYSA-N	441.513	1.191	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)CN2C(=O)N[C@](C)(c3ccc(F)cc3)C2=O)c1	28640276	RDAGCDUZOBEXCJ-JOCHJYFZSA-N	442.447	1.436	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)c1ccccc1F)C(=O)NNc1nc(C)cc(C)n1	29065846	JTVOZQUKUYOBFB-AWEZNQCLSA-N	427.527	1.776	50	20	IDGD	
COc1cc(NC(=O)C(C)(C)C)c(C(=O)NNC(=O)CNC(=O)c2ccco2)cc1OC	725741304	NWXCRDDEHGTMFD-UHFFFAOYSA-N	446.460	1.472	50	20	IDGD	
CC[C@H](C)C(=O)Nc1cccc(CNC(=O)NNC(=O)CNC(=O)c2cccs2)c1	725874432	ZGBJGILXDSBNGY-ZDUSSCGKSA-N	431.518	1.993	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=S)NCCc1ccc2c(c1)OCCO2	726745835	YQOFFVCNCRFJCZ-UHFFFAOYSA-N	431.514	1.973	50	20	IDGD	
CCN(Cc1ccc(CN(C)C)cc1)C(=O)NNC(=O)c1csc(N2CCOCC2)n1	727473100	FTIHLKSKKHSJAZ-UHFFFAOYSA-N	446.577	1.918	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(CCC(=O)NNC(=S)NCC2CCC2)cc1	727866295	CQHIQLAGXKCJDP-UHFFFAOYSA-N	426.608	1.945	50	20	IDGD	
O=C(COC(=O)Cc1c[nH]c2cc(Cl)ccc12)NNC(=O)[C@H]1COc2ccccc2O1	728342898	JOHSVGLLCMUOLG-GOSISDBHSA-N	443.843	1.894	50	20	IDGD	
O=C(Cn1c(=O)nc(O)c2ccccc21)NNC(=O)c1cc(F)ccc1Br	728610712	LTVSYDKMPDEFEP-UHFFFAOYSA-N	435.209	1.465	50	20	IDGD	
CCc1c(C(=O)OCC(=O)NNC(=O)Cc2nc(C)cs2)cnn1-c1ccccn1	728722786	VFFKNLRYQXDIAS-UHFFFAOYSA-N	428.474	1.142	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c([N+](=O)[O-])cc1OC	728848486	QNIMLYALVXTKIT-UHFFFAOYSA-N	430.421	1.080	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)o2)cn1	729692566	KVGKQQUDFKZGNO-UHFFFAOYSA-N	425.492	1.099	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)NCc1ccc(C(=O)N2CCCCC2)cc1	730820034	FADVKCMFHBYUIC-UHFFFAOYSA-N	426.473	1.928	50	20	IDGD	
CC(=O)Nc1ccc(NS(C)(=O)=O)c(C(=O)NNC(=O)NCCc2cccs2)c1	731436302	WCDGBMYFYNGBOE-UHFFFAOYSA-N	439.519	1.265	50	20	IDGD	
CC1CCN(c2ccc(C(=O)OCC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)cn2)CC1	732338143	XYJBCQHDRTZUIG-UHFFFAOYSA-N	441.444	1.844	50	20	IDGD	
Cc1c(/C=C(\C#N)C(=O)NCC2CCN(S(=O)(=O)C(F)(F)F)CC2)cc(C#N)n1C	732661879	FYPXJBAKTAASPP-VIZOYTHASA-N	443.451	1.790	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)[C@H](CCSC)NC(=O)Cc2ccccc2)c1O	732828243	SESHJMILKVZYEE-INIZCTEOSA-N	431.514	1.642	50	20	IDGD	
Cc1cc(=O)c(C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)nn1-c1ccccc1F	733110170	FHWXOIFBFROTSO-UHFFFAOYSA-N	432.415	1.941	50	20	IDGD	
CCOCCCn1c(NNC(=O)c2ccc3c(c2)C(=O)NC3=O)nc2ccccc2c1=O	733365992	XABWJTAOIZOYBN-UHFFFAOYSA-N	435.440	1.464	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NC[C@H](C)CN2CCOCC2)c2ccccc2c1=O	739049100	OEWZDHUFZRRTBN-INIZCTEOSA-N	444.536	1.109	50	20	IDGD	
CC(=O)N[C@@H](CC(=O)NNC(=O)c1ccc(COc2ccc(Cl)c(C)c2)cc1)C(N)=O	740749325	VLUVMVBEEMMPLD-SFHVURJKSA-N	446.891	1.369	50	20	IDGD	
Cc1nn(C)c(C)c1S(=O)(=O)N[C@H](C)C(=O)NNC(=O)c1ccc2ccccc2c1	742049006	UBHWWUNGVYGPGW-CYBMUJFWSA-N	429.502	1.318	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)[C@@H](c1cccc(F)c1)N1CCOCC1	742061454	GIQPJZNNOWXXJB-HXUWFJFHSA-N	448.520	1.783	50	20	IDGD	
O=C(CN1C(=O)[C@H]2[C@H](C1=O)[C@H]1CC[C@H]2O1)NNc1ccc(C(F)(F)F)cc1[N+](=O)[O-]	743297734	WBWSGXNSJIKFGO-HBJVGIJOSA-N	428.323	1.219	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)[C@H](C)NC(=O)c2cc3c(C)nn(C)c3s2)cc1	743321688	ZSBUMYVALWJDCM-ZDUSSCGKSA-N	443.529	1.850	50	20	IDGD	
O=C(CCCN1C(=O)c2ccccc2C1=O)NNC(=O)c1cc(Br)ccc1O	743730148	PFYHMUZCDWZSBD-UHFFFAOYSA-N	446.257	1.992	50	20	IDGD	
Cc1c(C(=O)NNC(=O)Nc2ccc(N(C)C)cc2)nnn1-c1ccc2c(c1)OCCO2	743829047	VZUBUNXXUJDSBJ-UHFFFAOYSA-N	437.460	1.879	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2ccc(CNC(=O)C(C)(C)C)cc2)n1	745138468	YEGUYOSOFKDXQB-UHFFFAOYSA-N	446.529	1.661	50	20	IDGD	
O=C(COC(=O)[C@@H](c1ccccc1F)N1CCOCC1)NNC(=O)c1cccc(Cl)c1	745499810	PIXCFKFNMPURKB-LJQANCHMSA-N	449.866	1.857	50	20	IDGD	
O=C(CCSCc1nc(O)c2c3c(sc2n1)CCC3)NNC(=O)N1CCOCC1	745991859	HRSFRZDBNKWOMQ-UHFFFAOYSA-N	437.547	1.582	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2c(C)noc2C(F)(F)F)cc1	746093035	AKDWGYLDEZJKMU-UHFFFAOYSA-N	434.396	1.392	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)CC[C@@H]2NC(=O)N(c3cccc(C)c3)C2=O)c1	746307214	PBSUVZMROQEONB-KRWDZBQOSA-N	438.444	1.015	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)c2sc(N3CCCC3)nc2Cl)c1	746871640	KRQVGGXQYZYCQU-UHFFFAOYSA-N	428.923	1.875	50	20	IDGD	
Cc1c(C(=O)NNC(=O)CCc2ccccc2)cc(Br)cc1S(N)(=O)=O	747375823	SKGPPHTVTMYVRW-UHFFFAOYSA-N	440.319	1.799	50	20	IDGD	
COCCNS(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(Cl)cc2F)c1	747430868	GDCOCJPUVZJVIC-UHFFFAOYSA-N	429.857	1.479	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(Cl)c(N3CCNC3=O)c2)cc1	747722929	PBWPQSTVXOYXBG-UHFFFAOYSA-N	441.831	1.359	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc2c(c1)COC2)NNc1ccc([N+](=O)[O-])cc1Cl	748710627	DJVFDIGTMPVVKU-UHFFFAOYSA-N	426.838	1.700	50	20	IDGD	
C[C@H](Sc1ccnc2cc(Cl)ccc12)C(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1	749874250	MODAEBPTNCUQIP-WDEREUQCSA-N	427.935	1.951	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)COC3CN(C(=O)OC(C)(C)C)C3)n[nH]2)cc1	751065751	SMNSOQNRUVGCKA-UHFFFAOYSA-N	429.477	1.782	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)NCC2(CN3CCOCC3)CCCCC2)c1	751810966	XQGCOMOAZYIHTK-UHFFFAOYSA-N	434.537	1.931	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COc2ccccc2O)cc1S(=O)(=O)NC1CCCC1	752624257	UIQBLKZCLAEETB-UHFFFAOYSA-N	447.513	1.762	50	20	IDGD	
CS[C@H](C)CNC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	752700020	LTBKKLVIUNTRJC-CQSZACIVSA-N	436.559	1.861	50	20	IDGD	
CCn1cc([C@@H]2C[S@](=O)CCN2C(=O)NNC(=O)c2cc(Br)c[nH]2)cn1	753035443	ZIZVWRDDKNNFNK-WHDAMIPWSA-N	443.327	1.154	50	20	IDGD	
C[C@H]1C[C@H](CCNC(=O)NNC(=O)CNC(=O)c2ccco2)CN1Cc1ccccc1	753046585	MAQVVLIGLVOGNO-WMZOPIPTSA-N	427.505	1.641	50	20	IDGD	
O=C(Cc1c[nH]c2cccc(Br)c12)NNC(=O)c1ccc(-n2cnnn2)cc1	753902038	NQNNTSMZCODUKO-UHFFFAOYSA-N	440.261	1.910	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c(C(F)F)n1	755161151	XIJCGEPINNKVEC-UHFFFAOYSA-N	427.433	1.217	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)Nc2cccnc2N2CCOCC2)cc1	756184058	QXBKAUZBNJSLAA-OAHLLOKOSA-N	429.477	1.937	50	20	IDGD	
NC(=O)c1ccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1F	756352189	RJACHYSTZLPKEV-UHFFFAOYSA-N	449.464	1.176	50	20	IDGD	
C#CCOc1ccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1	756479951	ROSDRYVSMODTJV-UHFFFAOYSA-N	442.497	1.950	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)Nc1ccc(S(=O)(=O)N2CCCC2)c(OC)c1	756586465	SAWVJVWZVMYNJA-UHFFFAOYSA-N	448.501	1.955	50	20	IDGD	
Cc1c(NC(=O)NNC(=O)COc2ccccc2F)cccc1S(=O)(=O)NC1CC1	756705188	KNUFHHMOYBUHPA-UHFFFAOYSA-N	436.465	1.807	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)[C@@](C)(O)CN2Cc3ccccc3C2=O)o1	756812154	KXFPANHVTSRVHG-QFIPXVFZSA-N	428.489	1.289	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2ccc(OC)c([N+](=O)[O-])c2)c2ccccc2c1=O	757993396	LMWOKASNVMUHSC-UHFFFAOYSA-N	426.389	1.800	50	20	IDGD	
C[C@@H](CN(C)C(=O)OC(C)(C)C)C(=O)N1CCN(S(=O)(=O)CBr)CC1	758511922	FBGZTEWOSMPGLH-LBPRGKRZSA-N	442.376	1.316	50	20	IDGD	
NC(=O)[C@@H]1CC[C@H](CNC(=O)C(=O)Nc2ccccc2S[C@H](Cl)C(F)(F)F)O1	760120693	JTLKQZXIYWRGOX-OWCSCZDJSA-N	439.843	1.994	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2cnccc2-c2ccccc2)c1	760277565	NBNIGPPYGHFIRC-UHFFFAOYSA-N	438.465	1.552	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)[C@@H](Cc2ccccc2)n2nnnc2C)n[nH]1	763151739	DZXHSTOXXSVGCX-LJQANCHMSA-N	446.471	1.625	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNS(=O)(=O)c1cc(C(=O)O)cc(F)c1F	763438659	CNSLYSFJANETIP-UHFFFAOYSA-N	437.421	1.277	50	20	IDGD	
CCN(CC)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1	763472550	XMJHYFNGGBWRLQ-UHFFFAOYSA-N	427.417	1.477	50	20	IDGD	
O=C(NNC(=O)c1cccnc1)C(=O)Nc1cccc(F)c1I	763494472	DWCPFGJPGXWTGC-UHFFFAOYSA-N	428.161	1.225	50	20	IDGD	
O=C(NNC(=O)c1ccccc1O)C(=O)Nc1ccc(I)cc1	763527230	OEFJCUKKCNKAAE-UHFFFAOYSA-N	425.182	1.397	50	20	IDGD	
Cc1ccc(CNC(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)c(N2CCOCC2)c1	763529946	HOYJSURUPJRYDM-UHFFFAOYSA-N	449.552	1.967	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)c(C(F)(F)F)c1	763577741	KTPZXKMTKGLULZ-OAHLLOKOSA-N	439.346	1.640	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1c(F)c(F)c(F)c(F)c1F	763628331	IUGFXXNKXFOJRE-UHFFFAOYSA-N	427.289	1.738	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2cc(C(F)(F)F)cnc2O)c1	763646738	IZNDNFGXLXHBBP-UHFFFAOYSA-N	426.351	1.588	50	20	IDGD	
COCC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)COc2cc(C)cc(C)c2)cc1	763648640	VKGHFIYJLAAONS-UHFFFAOYSA-N	428.445	1.053	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccn(CCc3ccncc3)n2)cc1C	763680628	RZJFTQYQGCMAJY-UHFFFAOYSA-N	436.472	1.303	50	20	IDGD	
CC(C)c1ccc(NC(=O)C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1	763717851	BEIZHTDNUOGWEC-UHFFFAOYSA-N	432.502	1.460	50	20	IDGD	
Cc1cc(C(=O)NCC(C)C)ccc1NC(=O)C(=O)NNC(=O)c1cccc(N(C)C)c1	763759798	BVLSFUSLHMXQOL-UHFFFAOYSA-N	439.516	1.847	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccc(-n2cncn2)c(Cl)c1	763838783	UXAYQKJIKOCEMS-UHFFFAOYSA-N	432.799	1.225	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)ccc1Cl	763857331	NJDOGPJTTDLAGD-SNVBAGLBSA-N	437.811	1.819	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2nnc(C(C)(C)C)s2)cc1	763861905	TVFXKIGJTUYEAI-LLVKDONJSA-N	435.506	1.788	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1cccc(OCCN(C)C)c1	763864315	AIPCRKFQZVWIGR-CQSZACIVSA-N	432.452	1.320	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)N(C)C)cc2)cc1	763870737	BWIUOQQQLXHSCI-AWEZNQCLSA-N	440.456	1.144	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc3c2OCCO3)cc1OC	763911920	RYYBVGBYNWBNEQ-UHFFFAOYSA-N	429.429	1.655	50	20	IDGD	
O=C(Cc1cccc2ccccc12)NNC(=O)C(=O)Nc1ccn(-c2ncccc2F)n1	764029788	VOFFPFCVOIAEGJ-UHFFFAOYSA-N	432.415	1.888	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(Br)c2)cc1C(=O)N(C)C	764059292	QXMMAPGKHSZWKU-UHFFFAOYSA-N	447.289	1.859	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(Cl)c(C(=O)NC3CCCCC3)c2)n[nH]1	764106315	INHKIXIPHAQYRV-UHFFFAOYSA-N	446.895	1.834	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)CCc2ccco2)cc1OCc1cccnc1	764168270	AFCSRWITUOIBOM-UHFFFAOYSA-N	438.440	1.981	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)C(=O)Nc2cc(C(C)C)on2)c1	764232948	UDPJCZAHHOTLBU-UHFFFAOYSA-N	425.239	1.969	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)C(=O)Nc1ccnn1CCc1ccccc1	764239254	IUPCPGBHWRDAMV-UHFFFAOYSA-N	430.468	1.867	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)Cc2ccccn2)sc2c1CCCS2	764263490	GNPJTEDCMKDAEM-UHFFFAOYSA-N	448.526	1.687	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)C(=O)Nc1ccc(-n2cncn2)c(Cl)c1	764281303	QXIUFZDHASGPHH-UHFFFAOYSA-N	428.836	1.345	50	20	IDGD	
O=C(Cc1cc[nH]n1)NNC(=O)C(=O)Nc1ccnn1Cc1cccc(Cl)c1Cl	764296655	FAWYDWPGCSUPSS-UHFFFAOYSA-N	436.259	1.290	50	20	IDGD	
CCCCS(=O)(=O)c1ccc(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1	764822536	HPWPNPBBWTUPGP-UHFFFAOYSA-N	445.545	1.728	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cc(C)ccc3[N+](=O)[O-])CC2)cc1	766648114	IHVPPIIYCLZEOA-UHFFFAOYSA-N	425.489	1.790	50	20	IDGD	
CC(C)NC(=O)c1ccc(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1	767192421	SXEDUJPSXMCPME-UHFFFAOYSA-N	438.893	1.200	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)[C@H](C)NS(=O)(=O)c1cccc(C#N)c1	767736180	XEAHUOSRYRKNFU-AWEZNQCLSA-N	430.486	1.014	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ccc3nncn3n2)CC1)c1cc(-c2cccs2)[nH]n1	768260849	POANZJYMXHABQP-UHFFFAOYSA-N	437.489	1.254	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=S)Nc3ccccn3)CC2)cc1	768584734	WSSCJMALYZCCII-UHFFFAOYSA-N	449.558	1.509	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)NCc1ccnc(N2CCOCC2)c1	770147987	YDNYNWQVNOZILW-AWEZNQCLSA-N	433.896	1.870	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCSCC(F)(F)F)c1	770288898	PVXLCCQIFGWLHI-UHFFFAOYSA-N	428.458	1.176	50	20	IDGD	
CCN1CCN(CCCCNC(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)CC1	770341847	OZHDGJBLXOQKLI-UHFFFAOYSA-N	433.561	1.331	50	20	IDGD	
CC(=O)Nc1cccc(OCCNC(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)c1	770388349	ZWWPMEDZADXPMS-UHFFFAOYSA-N	442.480	1.950	50	20	IDGD	
CC1CCC(NS(=O)(=O)CC(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)CC1	770965923	HNXZIGYXOWJILX-UHFFFAOYSA-N	439.542	1.228	50	20	IDGD	
COc1ccc([C@@H](OC)[C@H](C)NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1	772076499	KZSQXYDOHNZMAK-UGSOOPFHSA-N	435.502	1.819	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)N[C@H]1[C@@H]2c3ccccc3CC[C@H]21	772631883	SWOMQLRZLZYQCZ-BRWVUGGUSA-N	427.530	1.961	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2ccc(C(=O)N3CCc4ccccc43)cc2)n1	773724490	SLWNZYFGOKIVFA-UHFFFAOYSA-N	432.440	1.770	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)Cn2c(S)nc3ccccc3c2=O)cc1	775200764	SAVUGQVWIQKRHW-CYBMUJFWSA-N	442.497	1.699	50	20	IDGD	
O=C(Cc1ccc2ccccc2c1)NNC(=O)N[C@H]1CCO[C@@]2(CCS(=O)(=O)C2)C1	776074111	WZNYOZLXVNMPCW-RXVVDRJESA-N	431.514	1.449	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NN/C=C1\C(=O)N(c2ccccn2)C(=O)c2ccccc21	777869343	IWYDOOKJLSTFLK-VBKFSLOCSA-N	437.456	1.755	50	20	IDGD	
COc1ccc([C@H]2[C@H](C(=O)NNC(=O)CNC(=O)OC(C)(C)C)CCC(=O)N2C)cc1	778437024	RLDFZLUFKJTZEH-QAPCUYQASA-N	434.493	1.277	50	20	IDGD	
C[C@H](NC(=O)OC(C)(C)C)[C@@H]1CCN(C(=O)NNC(=O)CNC(=O)c2cccs2)C1	778639802	GWKXNLGBVMNNBA-QWHCGFSZSA-N	439.538	1.454	50	20	IDGD	
Cc1cc(N2C[C@H](C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)CC2=O)ccc1F	779914973	JVLLSIPUVPBENG-CYBMUJFWSA-N	437.472	1.342	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NN=C[C@H]1CCSC1)N(S(C)(=O)=O)CC2	782168343	CSSTZCIOPBHPRC-CZUORRHYSA-N	441.575	1.808	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2nc3ccccc3s2)cc1	782811940	DJSRHDWMEHPERR-UHFFFAOYSA-N	449.514	1.303	50	20	IDGD	
CN1CCC/C1=N\S(=O)(=O)c1cccc(NC(=O)C(=O)NNc2cccc(F)c2)c1	783040294	ITIDXBLTPAIUAG-JJIBRWJFSA-N	433.465	1.720	50	20	IDGD	
CCCS(=O)(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)Nc2ccccc2C)c1	783417615	XASAUDYFQBKFFQ-UHFFFAOYSA-N	433.490	1.938	50	20	IDGD	
O=C(CN1c2cccc3cccc(c23)S1(=O)=O)NN/C=C1\C(=O)NC(=O)c2ccccc21	783680200	ZCPAHEKIBZELOP-WJDWOHSUSA-N	448.460	1.280	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCCCC2)cc1NC(=O)C(=O)NNc1cc(C)ccn1	783934758	YJNSITGYQWTIDX-UHFFFAOYSA-N	447.517	1.655	50	20	IDGD	
CN(Cc1ccccc1)c1ccc(NC(=O)C(=O)NNC(=O)CNC(=O)c2ccco2)cc1	784001733	CMCYNPQXDPNWOW-UHFFFAOYSA-N	449.467	1.432	50	20	IDGD	
Cc1ccc(Br)cc1CNC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	784061567	PKSRUNOFRDSRRS-UHFFFAOYSA-N	430.266	1.877	50	20	IDGD	
O=C(NNc1ccc(Cl)nc1)C(=O)Nc1ccc(F)c(N2CCCS2(=O)=O)c1	784871619	RQGPDHWPWXQUBH-UHFFFAOYSA-N	427.845	1.496	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)n([C@H]2C[C@H]3CC[C@H]2C3)n1	785023449	IVFAPWALTYYCST-HUBLWGQQSA-N	442.432	1.566	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)C(=O)Nc1cccnc1OCc1ccccc1	785066508	CHNMMBILNOPHLQ-UHFFFAOYSA-N	444.451	1.637	50	20	IDGD	
COCCS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccc(OC)c(Cl)c2)cc1	785120090	GEYVMRDTJAHJNK-UHFFFAOYSA-N	441.893	1.851	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@@H](C(=O)NNc2nnc(-c3ccccn3)s2)[C@@H](C)O)cc1	788558639	SBHFZPYELMXHLT-IUODEOHRSA-N	448.530	1.080	50	20	IDGD	
COc1ccc(C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c(OC(F)F)c1	789234472	MKJKLLJXHASPFC-UHFFFAOYSA-N	439.327	1.823	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)C(=O)Nc1nc(C2CCC2)cs1	789756197	BTHRFBXHJXMFJT-UHFFFAOYSA-N	435.531	1.933	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2cccc(F)c2[N+](=O)[O-])cc1	791000960	TZWXDRCWQOZTFB-UHFFFAOYSA-N	439.425	1.502	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)Cn2c(CS(C)(=O)=O)nc3ccccc32)c1	791686269	ZKBGLJJTCVGUNC-UHFFFAOYSA-N	444.513	1.424	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@H](C#N)Cc3ccc(C#N)cc3)CC2)cc1	792237627	MUJTUYRQGOIIOU-QHCPKHFHSA-N	444.539	1.514	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)C2CCC(NC(=O)C3CC3)CC2)c2ccccc2c1=O	792805481	HCNVEOBPZFLAGE-UHFFFAOYSA-N	439.516	1.823	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H]2[C@@H](C1)[C@@H]2C(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	794353318	GNLCYDYGVKEHDS-FICVDOATSA-N	438.506	1.356	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)Nc2ccc(S(=O)(=O)N(C)C)cn2)cc1OC	797653984	OSWPDXXOWRFFNB-UHFFFAOYSA-N	437.478	1.206	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)Nc2ccc(O[C@H]3CCN(C)C3=O)cc2C)c1O	799238622	CWYPNYLCOFWRQI-KRWDZBQOSA-N	428.445	1.785	50	20	IDGD	
O=C(CSc1nnc2c(=O)[nH]c3ccccc3n12)NNC(=O)c1ccccc1Cl	799826550	NCONRFMQASLCLJ-UHFFFAOYSA-N	428.861	1.778	50	20	IDGD	
Cc1cnc(O)n1-c1ccc(C(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)cc1	802067593	VXOJNIQBWQMCRI-UHFFFAOYSA-N	429.458	1.756	50	20	IDGD	
O=C(Cc1nc(-c2ccccc2)cs1)NNC(=O)CN1C(=O)[C@H]2CCCC[C@H]2C1=O	802580942	BLOJCSZRIRBCSN-GASCZTMLSA-N	426.498	1.675	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)C1(n2cccn2)CCN(C(=O)OC(C)(C)C)CC1	803619482	AQRKWXXIKIEGMB-AWEZNQCLSA-N	437.497	1.098	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)C(=O)Nc1csc(-c2ccccc2)n1	806975596	GUHDQQNXSBZOML-UHFFFAOYSA-N	434.441	1.186	50	20	IDGD	
CCCCCn1nc(C(=O)NNS(=O)(=O)c2ccc(C#N)o2)c2ccccc2c1=O	808069780	JXVBANRECBSDJO-UHFFFAOYSA-N	429.458	1.675	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2C(F)(F)F)on1)N[C@H]1CCS(=O)(=O)C1	812534272	IZQKVNUVCKNSDB-VIFPVBQESA-N	432.380	1.492	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1nnc(O)c2ccccc12)c1ccc(N2CCCNC2=O)cc1	813239475	KWLVYPNDJUKEHE-CYBMUJFWSA-N	449.471	1.960	50	20	IDGD	
CCCN1C(=O)c2ccccc2N2C(=O)CC[C@]12C(=O)NNc1nc(-c2ccncc2)no1	815236641	BVCCSVUEBOUFPH-QFIPXVFZSA-N	447.455	1.964	50	20	IDGD	
O=C(CCCCCNS(=O)(=O)c1ccc2c(c1)OCCO2)NNC(=O)c1ccncc1	912769308	GWCHRAQBTQTOKN-UHFFFAOYSA-N	448.501	1.153	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2ccc(Br)s2)cc1C	913164730	ZDNUBQVWCGARGU-UHFFFAOYSA-N	446.348	1.867	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)c1cccc(S(=O)(=O)NC2CCCC2)c1	913465412	XIDVHLQKIIACEG-UHFFFAOYSA-N	435.477	1.887	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)c2ccc(F)c(S(=O)(=O)N3CCCC3)c2)cc1	914602506	UTRZGVRREJKVBF-UHFFFAOYSA-N	446.460	1.322	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)[C@H]2CCCN(S(=O)(=O)c3ccccc3)C2)c1	915133028	ICIKUEHOUIMDPM-SFHVURJKSA-N	445.541	1.931	50	20	IDGD	
CN(C(=O)CSCC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)C1CCCCC1	915164654	MNIGHTZDAJZBMV-UHFFFAOYSA-N	441.575	1.375	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2ccc(N3CCOC3=O)cc2)ccc1Cl	915594013	BXIZHPYBMZJXLN-UHFFFAOYSA-N	438.849	1.019	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCCCN2CCCCCC2=O)c2ccccc2c1=O	915905669	RAGHAISKPIJMFW-UHFFFAOYSA-N	428.493	1.153	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NN=Cc2ccc(OCCC(=O)O)cc2)ccc1Cl	915949126	BLYWHWOHKHFQSM-UHFFFAOYSA-N	425.850	1.605	50	20	IDGD	
O=C(NCCNC(=O)c1ccccc1Cl)NNC(=O)c1nnc(O)c2ccccc12	916263687	RNLCXGRNBKXBNM-UHFFFAOYSA-N	428.836	1.363	50	20	IDGD	
CC(=NNC(=O)c1c[nH]c2ccccc12)c1ccc(S(=O)(=O)N2CCNCC2)cc1	916287476	HCLRWQJOTDXJBD-UHFFFAOYSA-N	425.514	1.916	50	20	IDGD	
O=C(NCCOc1ccc(C(F)(F)F)cc1)NNC(=O)c1ccc(-n2cnnn2)cc1	916650959	ZWUYDRXVTHKCAS-UHFFFAOYSA-N	435.366	1.704	50	20	IDGD	
Cc1nn([C@@H]2CCS(=O)(=O)C2)c(C)c1C=NNC(=O)[C@H](C)CN1C[C@H](C)O[C@H](C)C1	917028283	DHOZTIUIMMIZKM-ZXFNITATSA-N	439.582	1.055	50	20	IDGD	
CC[C@@H](NC(=O)NNc1ccc(-n2cccn2)nn1)c1ccccc1OCC(=O)N(C)C	918222128	ADHVSNGQPUWNRV-MRXNPFEDSA-N	438.492	1.907	50	20	IDGD	
CC(C)n1nc(C(=O)NNS(=O)(=O)c2c[nH]c3ncccc23)c2ccccc2c1=O	918754322	WGSYIVHCXFASIV-UHFFFAOYSA-N	426.458	1.477	50	20	IDGD	
CC(=NNC(=O)NCc1ccco1)c1ccc(S(=O)(=O)N(C)CCCC(=O)O)cc1	920826301	UWVGCMSGFNYVNN-UHFFFAOYSA-N	436.490	1.988	50	20	IDGD	
COc1cc(C=NNC(=O)[C@@H]2CCS(=O)(=O)C2)c([N+](=O)[O-])cc1OCC(F)(F)F	921259084	VYCCIGQRTZPGKF-SECBINFHSA-N	439.368	1.429	50	20	IDGD	
CS(=O)(=O)c1ccc(OCCCCC(=O)NNC(=O)Cn2cnc3ccccc32)cc1	921301602	FYFOECWIRNCJPG-UHFFFAOYSA-N	444.513	1.837	50	20	IDGD	
O=C(NCCNC(=O)c1ccccc1C(F)(F)F)NNc1ccc(-n2cccn2)nn1	1115856060	AXZKVXVRYVMJCN-UHFFFAOYSA-N	434.382	1.737	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1ccc(-n2cccn2)c(F)c1	1115995491	RZEFBITUOKVKGJ-UHFFFAOYSA-N	430.465	1.688	50	20	IDGD	
CCS(=O)(=O)c1ccc(CNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1	1322007963	ULZVUGVMDSIDHR-UHFFFAOYSA-N	446.533	1.017	50	20	IDGD	
CN(C)C(=O)COc1ccc(C(F)(F)C(=O)NNC(=O)c2n[nH]c3c2CCCC3)cc1	1325634441	HNWZZINVRFYBJJ-UHFFFAOYSA-N	435.431	1.309	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)c2ccc(S(=O)(=O)NC[C@H](C)O)cc2)c1C	1346622049	YGQKSAVXRPHPAA-HOCLYGCPSA-N	449.529	1.191	50	20	IDGD	
CC(=O)Nc1ccc(CC(=O)N2CC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)cc1	1778259207	YQHIWLPUBZOUKF-LJQANCHMSA-N	428.316	1.821	50	20	IDGD	
C=CC[C@H](C(=C)C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2	1779272002	SLFZZQJWKOUILO-PQNGQFLHSA-N	440.349	1.262	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](C)Nc3ccccn3)C2)C1	1779323677	QAPPMKXHFVVFLO-SPYBWZPUSA-N	439.354	1.743	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)C3=NN(c4ccccc4)C(=O)C3)CCO2)C1	1781218521	NRJZRKQBVKIJAE-KKSFZXQISA-N	432.908	1.627	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)Nc1ccccn1)C2	1782176223	YHFJBGZGURQWHW-ZGPJWRFFSA-N	438.956	1.650	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)Cc3ccccc3O)C2)C1	1783231143	YAOLBZUXPFFYKB-KUHUBIRLSA-N	425.323	1.796	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)Cn3nc(C)cc3C)CCO2)C1	1783344082	MZUVKAWHRCALBO-CRAIPNDOSA-N	427.343	1.503	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)Cc3noc4ccccc34)CCO2)C1	1783532317	HCQWNEIQIUCRRC-BFUOFWGJSA-N	436.306	1.984	50	20	IDGD	
Cc1nnc(CCC(=O)N2CCO[C@]3(CCN(C(=O)[C@H](C)Br)C3)C2)s1	1783532540	PENGUMNDXJPYLP-MEDUHNTESA-N	431.356	1.392	50	20	IDGD	
CCOc1ccc(CC(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)cc1OC	1783699066	BCUBDPGUVFBWTB-IIBYNOLFSA-N	440.924	1.066	50	20	IDGD	
O=C(Cn1cnc2ccccc21)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1783750792	LZBJBYYHGHOHTF-WMZOPIPTSA-N	439.285	1.557	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccc(Cl)cc1F)CCO2	1783932778	FFCQPPIRQGFDCT-HXUWFJFHSA-N	440.903	1.296	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(F)nc3)C[C@@H]21	1783970248	PKLWHIAAKDVXHV-MXAVVETBSA-N	428.302	1.845	50	20	IDGD	
CC(=O)N[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)Br)C[C@@H]21)C(C)(C)C	1784310530	FGLJKMPXHBPEQE-DGVSKKNDSA-N	446.386	1.300	50	20	IDGD	
Cc1nccn1[C@H](C)C(=O)N1CC[C@@]2(CN(C(=O)[C@H](C)CBr)CCO2)C1	1784628628	LHTLKPXXYWEWDF-LBTNJELSSA-N	427.343	1.613	50	20	IDGD	
CN(C)c1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]32)nc1	1785749432	WLWQPEUKXPEOCS-GGLFYADGSA-N	443.375	1.977	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(O)n3)[C@H]2C1	1786042870	BFGZAIVATKFDIP-OSFYFWSMSA-N	426.311	1.412	50	20	IDGD	
C=C(Oc1ccccc1O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](Cl)COC)C[C@@H]21	1787502705	LFGNWZXYPAULDP-FPXQBCRKSA-N	438.908	1.518	50	20	IDGD	
CCc1cc(C(=O)NC2(c3ccc(NC(=O)c4cccc(B(O)O)c4)cc3)CCC2)no1	1788147952	QHUBXTRPXYNLKB-UHFFFAOYSA-N	433.273	1.978	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1ccc(C2(NC(=O)c3[nH]nnc3C)CCC2)cc1	1788648050	FUKJNMZUZJRISD-VULFUBBASA-N	448.487	1.995	50	20	IDGD	
CCc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCBr)C[C@@H]32)nn1C	1789064696	KMXUYBXTGFFDDS-NOLJZWGESA-N	427.343	1.361	50	20	IDGD	
CCn1nc(C(C)C)cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21	1789381451	RRJUCRMFDDCBMW-ZZCKCESHSA-N	426.945	1.219	50	20	IDGD	
O=C(Cc1ccc2ncnn2c1)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21	1789717731	GHBAAGCYFQHXDX-IHRRRGAJSA-N	426.304	1.055	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccn4cncc4c3)C[C@@H]21	1791056369	VSNXSPFOKUGPHR-QCPWZWHMSA-N	435.322	1.711	50	20	IDGD	
Cc1nn(C)c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]3C2)c1F	1791057082	OFJPTKIQAIGUKX-IXOXFDKPSA-N	431.306	1.244	50	20	IDGD	
COc1cc(F)cc(/C=C/C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](O)CCl)C[C@@H]32)c1	1791147916	DHAOZOIQYXMFRG-LWTGDAADSA-N	440.899	1.427	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(OC)cc3OC)C[C@@H]21	1791253824	KKBJAPOHSMYAHQ-UHEFJODHSA-N	440.924	1.551	50	20	IDGD	
CCn1nc(C)cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)CBr	1792867686	IUMBNRHLZDCAJE-ZIEJDFEHSA-N	427.343	1.446	50	20	IDGD	
Cc1nnc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)CBr)s1	1792869981	FOXUYOWJHBXWJQ-VFFTVRQLSA-N	445.383	1.400	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1C[C@H]1c1ccc(Cl)cc1)C2)[C@H](O)CCl	1792981382	KSYUBYSISVLINL-NLHADHJGSA-N	427.328	1.633	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CC(=O)N(Cc2ccccc2)C1)[C@@H](O)CCl	1793397556	VVMHHXGRTOWQIM-FQBWVUSXSA-N	433.936	1.273	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(OC(F)F)cn1	1794459031	CRYKDQAWIORUID-NDPMZMCLSA-N	433.839	1.140	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1(C#N)CC1	1795412382	NNCKPNJSDBHEAL-ZSBFGKGUSA-N	442.428	1.027	50	20	IDGD	
O=C(Cc1c(F)cccc1Cl)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1	1796189588	GHKIKBSQOYOGKJ-BJWYYQGGSA-N	444.699	1.653	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1cc2ccccn2n1	1796834471	FQNCAKMVFRTVMD-JLUCKKNBSA-N	425.258	1.228	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(C#N)cc1)C2	1796892708	INGIINMWOQUMES-OLGCSEPZSA-N	432.484	1.944	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CC[C@@H]2CCC(=O)N2C1	1799152864	PHQHRCOLNVPQME-WEVKLEIESA-N	425.957	1.385	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3ccccn3n1)C2	1799274977	FUWWOJHRNBSELE-UESRRSCYSA-N	425.316	1.774	50	20	IDGD	
O=C(CN1C(=O)CSC1=S)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](F)Br	1800165518	RIBNLJFXYPUHSU-JXVAYASWSA-N	438.344	1.175	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)n1ccccc1=O)C2	1800641720	IFTIPSUMPFOCPP-JBXGNFEISA-N	440.338	1.172	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cn(C(C)(C)C)nn1)C2	1800760615	VZFSWBOQNGAYPF-NRWUCQMLSA-N	428.331	1.020	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCCC#C[Si](C)(C)C)C2	1800977340	XWUHHSPWHUDKAF-SFNKJDCFSA-N	429.033	1.881	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H](CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Cl)C3)C1	1801139365	JVYUNGBRBARAIE-GFISCPRKSA-N	447.935	1.758	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@H]1CCN(C(=O)COCCO)[C@@H]1c1cccnc1	1803014608	JMHGFASUWZYVFM-FRFSOERESA-N	428.327	1.127	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)[C@@H]1CC=CCC1	1803026619	QQGKMBCSCAFFKT-PIPMEXSNSA-N	433.317	1.437	50	20	IDGD	
Cn1cnc(C(=O)NC[C@@H]2CCN(C(=O)[C@](C)(Cl)CCl)[C@H]2c2cccnc2)n1	1805327635	XUYGNWXLWOIDHN-SUNYJGFJSA-N	425.320	1.766	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCCC2(CCN(C(=O)Cn3cc(C)c(O)nc3=O)CC2)C1	1806164506	ZJQONJKAJSLZNM-MRXNPFEDSA-N	438.956	1.896	50	20	IDGD	
Cc1nc(CC(=O)N2CC[C@H](CNC(=O)CCBr)[C@H]2c2cccnc2)no1	1806342195	KKOVTGZQHLMMRN-RDTXWAMCSA-N	436.310	1.807	50	20	IDGD	
C[C@@H]1CCC[C@@H]1C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1807361069	GRDJHGISQMMQRR-JJJJLYANSA-N	435.333	1.517	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](F)Cl)[C@@H]1c1cccnc1)c1cccn2c(O)nnc12	1808189670	WSJRGAVTCIAHIW-NWANDNLSSA-N	432.843	1.684	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)CC(F)(F)C(=O)O)[C@H]1c1cccnc1	1808294366	KFSZFHYXRWPKFS-KCQAQPDRSA-N	433.839	1.451	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)c1cc2cnccc2[nH]1	1809987761	JCHWWNXFUTVQQZ-KYNGSXCRSA-N	427.892	1.877	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)c1nc(O)n2c1CCCC2	1810584446	BBAFUHCIBHMCFJ-ZVZYQTTQSA-N	447.923	1.239	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@H](O)C(=O)N1CCC2(CCCN(C(=O)[C@@H](F)Cl)C2)CC1	1810902578	KUFVBWHPLLUBJF-UONOGXRCSA-N	435.924	1.638	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2ccc3nn[nH]c3c2)[C@@H]1c1cccnc1	1813034200	DSDJQFXLUWGPCJ-TXPKVOOTSA-N	442.907	1.926	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)[C@@H]2C[C@]2(F)Cl)[C@@H]1c1cccnc1	1813074001	NPWDPLQJKRYXOL-AIUZKBQUSA-N	439.919	1.385	50	20	IDGD	
CCOCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1)CC2	1813778287	KSAZJHJMXIDJPK-IVWKQIGUSA-N	432.506	1.226	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2nn[nH]c2C(F)(F)F)[nH]n1)[C@@H](O)CCl	1814873476	OMKKEOKZHAXAIL-BDAKNGLRSA-N	435.794	1.452	50	20	IDGD	
Cc1ccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)[nH]n2)o1	1815385117	BGTQTVFICAISIR-MRXNPFEDSA-N	437.460	1.929	50	20	IDGD	
COC[C@H](C)C(=O)N[C@@H]1CCc2nc(NC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)sc2C1	1817275841	FTQCCJKRBIGUNB-QVEWIHMQSA-N	446.533	1.472	50	20	IDGD	
Cc1occc1C(=O)N[C@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1	1819795969	WOZNSDZPXXKZGS-NSHDSACASA-N	440.485	1.583	50	20	IDGD	
COC[C@H](NC(C)=O)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)C(C)(C)CCl)CC2	1820183800	GQORNAXQRTURAT-AAEUAGOBSA-N	430.958	1.471	50	20	IDGD	
CN1N=C(C(=O)N[C@@H]2CCc3nc(NC(=O)[C@H](F)Br)sc3C2)CCC1=O	1823002973	VUOYOVSGKAWJBY-KRTXAFLBSA-N	446.302	1.354	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](O)CCl)CC2	1825501579	GKTNBZHRAQKCPS-ONGXEEELSA-N	432.930	1.180	50	20	IDGD	
Cc1cnc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)cn1	1825874499	OVFZXOMNGXLSCS-IBGZPJMESA-N	430.553	1.391	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)C(=O)Nc1cccnc1)CC2	1826000200	OGIPKNMKVJMSNA-PWSUYJOCSA-N	437.909	1.343	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)/C=C/c1cccnc1)CC2	1826080439	KSACHRHUOGVNIZ-SBJJXXPASA-N	442.545	1.537	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)CCn3cncn3)sc2C1	1826611207	QMLWUGDISYGIIQ-GHMZBOCLSA-N	441.355	1.910	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)CCC(F)(F)F)CC1	1826668880	URUKNGZGVHZRDD-SFHVURJKSA-N	440.271	1.942	50	20	IDGD	
O=C([C@H]1CCCCO1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827049359	RZRHSSMVUJRTSC-LEWJYISDSA-N	428.338	1.169	50	20	IDGD	
O=C(N[C@@H]1CCc2nc(NC(=O)C3CC4(CCC4)C3)sc2C1)c1ccc(B(O)O)cc1	1827369208	HFYNZHKTXVKADS-MRXNPFEDSA-N	439.346	1.629	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)C2(C)COC2)CC1	1827677676	YAQZXLMBGDFWRB-DUYBAWCLSA-N	443.548	1.777	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H](O)N2CCOCC2)CC1	1828969644	WYEZGRADQILAIY-ICSRJNTNSA-N	441.645	1.108	50	20	IDGD	
COc1ncc(Cl)cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1829584011	AWFIGNMTBDFLSA-DYVFJYSZSA-N	436.267	1.348	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CN2CCSCC2)CC1	1831827424	XOUVIIGIPPJQJK-MSOLQXFVSA-N	432.030	1.909	50	20	IDGD	
C[C@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1)n1cccc1	1832107254	DXXHSCPJULLGNB-GCJKJVERSA-N	437.349	1.662	50	20	IDGD	
O=C(C[C@@H]1CCCCO1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1832346045	HXJHTNOINMRVQR-QRTARXTBSA-N	437.306	1.093	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2CCCS2)CC1	1832438696	NNOPETOHDDHDMW-OALUTQOASA-N	445.589	1.814	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)CSCC(=O)OC)CC2)CC1	1833530140	MMAPMXGHISYWLL-KRWDZBQOSA-N	448.029	1.872	50	20	IDGD	
O=C(c1n[nH]c(C2CC2)c1F)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1833686516	JFTHJHBZOAQLNZ-QGZVFWFLSA-N	435.283	1.300	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3c(F)c(C)nn3C)CC2)CC1	1834030355	VCILYBYAPQECER-MRXNPFEDSA-N	443.951	1.307	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)CCN3CCN(C)CC3)CC2)CC1	1834624922	PTFRMTDQAWUXOU-FQEVSTJZSA-N	442.048	1.213	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)c3cc(F)ccc3F)C2)C1	1834824028	RLEMNNGHCSNRTR-GOSISDBHSA-N	447.276	1.820	50	20	IDGD	
O=C(CCc1ccoc1)N1CCOC[C@@]2(C1)CN(C(=O)CCBr)CCO2	1834826705	UCGYXSSPOPARBW-GOSISDBHSA-N	429.311	1.454	50	20	IDGD	
Cn1cc(CCC(=O)N2CCO[C@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)cn1	1835986388	PYIHBOFALFLSBV-HXUWFJFHSA-N	426.945	1.074	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)CN3CCOC3=O)CC2)CC1	1836785639	CBYBGKWMIHRHGE-KRWDZBQOSA-N	429.945	1.845	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccn4cncc4c3)CCO2)C1	1837074123	UPTPUNNICOIKTO-RXVVDRJESA-N	434.924	1.812	50	20	IDGD	
CCc1cnc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)s1	1837724446	OTVJFVQDVHOTLH-SJCJKPOMSA-N	446.367	1.559	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(OC2CCN(C(=O)C3(F)CC3)CC2)CC1	1838103216	QKTNQLKFJOXBIS-MFKUBSTISA-N	447.511	1.621	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)[C@H](C)NC(C)=O)CC2)CC1	1838755843	VEOWOWKPTGOWKL-GUYCJALGSA-N	446.386	1.683	50	20	IDGD	
CC(C)n1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)n1	1838788101	KQJFMHOJFLAUJG-YOEHRIQHSA-N	447.305	1.225	50	20	IDGD	
Cc1ccncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2	1839152735	JLOPZQBKQBHUDO-OALUTQOASA-N	430.332	1.696	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CC[C@H](O)CC3)C2)C1	1839155304	QIAUABPQNDLKRG-STEAMIEHSA-N	437.364	1.230	50	20	IDGD	
CC(C)c1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)n[nH]1	1839199956	ASYVQVLPBDCZLY-WMLDXEAASA-N	447.305	1.294	50	20	IDGD	
O=C([C@H](F)Br)N1CCO[C@]2(COCCN(C(=O)C3(F)CCCCC3)C2)C1	1839201485	ZDABASDWLKDTKT-XJKSGUPXSA-N	439.297	1.806	50	20	IDGD	
COc1cc(C)c(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)cc1OC	1839399182	NKFPDAPZBPSOEO-YLJYHZDGSA-N	444.887	1.617	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc4ccncc34)CCO2)C1	1839509088	KGBCGFPIANNPHX-KNQAVFIVSA-N	447.919	1.559	50	20	IDGD	
C#CC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](Br)Cc3ccccc3)C2)C1	1839810225	LYWOCYRUWGKLQM-XLIONFOSSA-N	435.318	1.082	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)c3ccccc3)C2)C1	1840030845	YCNPDFIVTFCLDZ-GMBSWORKSA-N	443.313	1.937	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)[C@H](C)CBr)C1	1841286630	QBWMVZHJDUGUHJ-JLKNBBFOSA-N	438.326	1.355	50	20	IDGD	
CCOC(=O)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)[C@H](F)Cl)C1	1843367509	IOJVKVDZTPDDBH-NEPJUHHUSA-N	435.880	1.181	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)Cc1cccc3ncccc13)C2	1844263630	ZGTOXDLDJFGHDH-UHFFFAOYSA-N	444.495	1.293	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)c2cc(S(C)(=O)=O)ccc2F)C1	1845567653	ZTGSPRYMUTWYHP-CQSZACIVSA-N	432.901	1.300	50	20	IDGD	
CCOc1ccccc1-n1nnnc1SCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	3496855	YROKBYGWIXCCNO-UHFFFAOYSA-N	443.445	1.523	50	20	IDGD	
Cc1ccc(S(=O)(=O)Nc2ccc(C(=O)NNc3nnc(C)c(=O)[nH]3)cc2)cc1C	10899359	WLJYMIUTRZQNLM-UHFFFAOYSA-N	428.474	1.648	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)c1cccc(S(=O)(=O)N2CCCCC2)c1	15793649	FTXWHZZXBWMULZ-UHFFFAOYSA-N	431.470	1.665	50	20	IDGD	
CCCn1c(=O)n(CCC(=O)NNC(=O)Cc2nc3ccccc3n2C)c2ccccc21	16229702	SRIPVVZDIQULPU-UHFFFAOYSA-N	434.500	1.880	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)[C@H](C)NS(=O)(=O)c2ccc(Cl)cc2)cc1	17112632	MFJZYWUSUFCIHU-ZDUSSCGKSA-N	425.894	1.542	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](Cc1ccccc1)C(=O)NNC(=O)CNC(=O)c1cccs1	725739290	BLPRLLRGJZNZFE-OAHLLOKOSA-N	446.529	1.761	50	20	IDGD	
COc1ccc([C@H](CNC(=O)NNC(=O)CNC(=O)c2cccs2)N2CCCC2)cc1	725872950	TVQRCMCFEUXCIV-KRWDZBQOSA-N	445.545	1.654	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)Cn2nc(-c3ccccc3)oc2=O)cc1OC	726190147	OJNRCERZHNUVCA-UHFFFAOYSA-N	426.429	1.762	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(Cl)cc2NC(C)=O)cc1OC	727529268	NLXZODXUIFIUFU-UHFFFAOYSA-N	449.847	1.934	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)CN(C)C(=O)OC(C)(C)C)c1	727861861	TWDYGOLXVQBXBK-UHFFFAOYSA-N	442.538	1.345	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)[C@H]2CCCN2C(=O)OCC(F)(F)F)cc1	727931330	WGFUBHXCPZYXNB-CYBMUJFWSA-N	431.367	1.463	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)CCCOc3ccccc3)cc2)CC1	728213011	AEZVVUHQDZSBFB-UHFFFAOYSA-N	432.546	1.925	50	20	IDGD	
COC(=O)c1ccc(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)s1	728215386	YPXMZBYDQIHBTJ-UHFFFAOYSA-N	438.531	1.228	50	20	IDGD	
COc1cccc(CO[C@@H](C)C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1	728326019	AWUDBYAIAAYXRX-LIRRHRJNSA-N	444.440	1.131	50	20	IDGD	
C#CCNC(=O)CN1CCN(C(=O)/C(C#N)=C/c2cc(C)n(C[C@H]3CCCO3)c2C)CC1	728533498	KVXKYEVAGIVWRK-QJUACMODSA-N	437.544	1.085	50	20	IDGD	
C[C@H](CCC(=O)NNC(=O)c1cccc(C#N)c1)CC(=O)NNC(=O)c1cccc(C#N)c1	728826460	JCQDIWPTNUDCOP-OAHLLOKOSA-N	446.467	1.459	50	20	IDGD	
N#Cc1cccc(C(=O)NNS(=O)(=O)c2cc3c(cc2Br)OCCO3)c1	728853750	CHUYNUABIYAOKF-UHFFFAOYSA-N	438.259	1.715	50	20	IDGD	
Cc1c(-c2ccccc2)oc2c(C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)cccc2c1=O	729276460	FTIITUYAEODWBJ-CYBMUJFWSA-N	443.481	1.467	50	20	IDGD	
COc1ccc(S(=O)(=O)Nc2ccccc2C(=O)NNC(=O)c2c[nH]nc2C)cc1	732083501	VKMCHKNKLCQNDP-UHFFFAOYSA-N	429.458	1.602	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2c[nH]nc2C)cc1S(=O)(=O)N[C@@H]1CCCC[C@H]1C	732084082	KDHPWMSYUUFLEZ-MLGOLLRUSA-N	449.533	1.659	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Cn2nc(-c3ccccc3)oc2=O)cc1Br	732175690	NNQLICIGWCOUCR-UHFFFAOYSA-N	447.245	1.736	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)c2csc(CNC(=O)OC(C)(C)C)n2)C[C@@H](C)O1	732828840	VCCFAHLBPCBJRS-CHWSQXEVSA-N	441.554	1.428	50	20	IDGD	
O=C(NNc1ccc(Cl)nn1)N[C@@H]1CCCN(c2cc(N3CCOCC3)ncn2)C1	732913895	HCHATGCKTWLBNG-CYBMUJFWSA-N	433.904	1.052	50	20	IDGD	
CC(C)c1ccc(-n2c(NNC(=O)CN(C)S(C)(=O)=O)nc3ccccc3c2=O)cc1	733264086	IPHMFATWXBIERL-UHFFFAOYSA-N	443.529	1.844	50	20	IDGD	
CC(C)OCCCn1c(NNC(=O)c2ccc(-n3cncn3)nc2)nc2ccccc2c1=O	733265304	AMLZETVXJMGDPM-UHFFFAOYSA-N	448.487	1.944	50	20	IDGD	
C[C@@H]1CCCN(S(=O)(=O)c2cc(C(=O)NNC(=O)COCc3ccccc3)n(C)c2)C1	737634426	CZPVUWOVWYEIOU-MRXNPFEDSA-N	448.545	1.424	50	20	IDGD	
O=C(NCCNc1nccc(C(F)(F)F)n1)NNC(=O)c1cnn(-c2ccccc2)c1	738477493	JOFZVSXHCINMFA-UHFFFAOYSA-N	434.382	1.737	50	20	IDGD	
CC(C)CC(=O)NCCC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	741659275	KBDKELZCFNNOIT-UHFFFAOYSA-N	438.550	1.175	50	20	IDGD	
COc1ccc2c(c1)OCC[C@@H]2NC(=O)NNC(=O)c1sc(N2CCOCC2)nc1C	743510515	XSMWLOZGCHSJFE-HNNXBMFYSA-N	447.517	1.765	50	20	IDGD	
COc1ccc(OCCCNC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)cc1	743561286	KSOAFTSROLSDRP-UHFFFAOYSA-N	436.490	1.904	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2ncc(C)s2)c1	745877368	VDQSWXSOHQBFNP-UHFFFAOYSA-N	425.536	1.626	50	20	IDGD	
C[C@H]1C[C@@H](NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)C(=O)N1c1ccccc1	745883405	TUNRXOSUPVEKBL-SUMWQHHRSA-N	430.486	1.228	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCCCC(=O)OC(C)(C)C	745931441	NVKDQVVSXIZTGQ-UHFFFAOYSA-N	427.527	1.354	50	20	IDGD	
Cc1cc(C)n2nc(SCc3ccccc3C(=O)NNC(=O)N3CCOCC3)nc2n1	745987840	HZKOFEBPRNOCOX-UHFFFAOYSA-N	441.517	1.720	50	20	IDGD	
CSCC[C@H](C(=O)NNC(=O)COc1ccc(C)cc1)N1C(=O)[C@H]2CCCC[C@H]2C1=O	746129372	HXLMXKUEOSNUBE-FGTMMUONSA-N	447.557	1.818	50	20	IDGD	
CCO[C@H](CCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)C(C)C	746422906	ZOHZZQZVCWGNNN-GOSISDBHSA-N	440.566	1.866	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNS(=O)(=O)c2ccc(F)c(C(=O)OC)c2)cc1	747596946	SNVPRWXSXJEEQA-LBPRGKRZSA-N	440.449	1.788	50	20	IDGD	
CS(=O)(=O)c1ccc(NNC(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)cc1	748142224	GCJVZVHIVZYEAG-UHFFFAOYSA-N	434.430	1.830	50	20	IDGD	
COc1cc(/C=C/C(=O)NNC(=O)C(=O)N2CCCC2)ccc1OCc1c(C)noc1C	748247112	KUNPGAQKQZKSGH-VQHVLOKHSA-N	442.472	1.662	50	20	IDGD	
Cc1nnc2n1C[C@@H](C(=O)NNC(=O)[C@H]1Cc3ccccc3CN1Cc1ccccc1)CC2	750728687	YEITWSHQIMNZOE-FCHUYYIVSA-N	444.539	1.923	50	20	IDGD	
Cc1nc(-c2ccccc2)oc1C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	750942959	BXSXLCMRGNURKV-QGZVFWFLSA-N	437.408	1.794	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NC1CCC(OC(C)C)CC1	752699121	XLGSSQCQPKVWNI-UHFFFAOYSA-N	425.555	1.968	50	20	IDGD	
O=C(CCc1ccncn1)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	755321222	UZAFGBBCRVTJAH-UHFFFAOYSA-N	439.497	1.349	50	20	IDGD	
CCN(CC)C(=O)c1ccc(NC(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)cc1Cl	755644237	MYYSBMBUGDDJMK-LLVKDONJSA-N	430.914	1.409	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2ccc(OCC(=O)OC)cc2)c2ccccc2c1=O	755794838	KCBQRNKQMWTHPE-UHFFFAOYSA-N	439.428	1.435	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1csc([C@@H]2CCCO2)n1	755936309	BBCNCAGVWRHJMI-HNNXBMFYSA-N	438.531	1.772	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)Nc1cccc(Cn2nc3ccccn3c2=O)c1	755937295	FUIRCMQBEUUGEA-UHFFFAOYSA-N	447.411	1.919	50	20	IDGD	
CS(=O)(=O)CCOc1cccc(NC(=O)NNC(=O)c2ccc(Cl)cc2O)c1	756297113	IUMVVHQKLNISRI-UHFFFAOYSA-N	427.866	1.936	50	20	IDGD	
COC(=O)CN1CCN(c2ccc(NC(=O)NNC(=O)Cc3ccccc3F)cc2)CC1	756394774	XWJWUAWHHPMHKS-UHFFFAOYSA-N	443.479	1.516	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)Nc2cc(S(=O)(=O)N(C)C)ccc2F)c1	756682066	GFZWNCJVYABHCN-UHFFFAOYSA-N	438.481	1.925	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)Nc1cc(S(=O)(=O)N(C)C)ccc1F	756686488	VJLFBMXGCRMXBE-NSHDSACASA-N	442.444	1.835	50	20	IDGD	
O=C(NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)Nc1cnn(CC(F)F)c1	756710580	ZKTFKDRYCJKLRL-UHFFFAOYSA-N	442.448	1.399	50	20	IDGD	
Cc1ccc(N2CCOC2=O)cc1NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	756821685	PDVKSQRRMLTZSS-UHFFFAOYSA-N	436.428	1.665	50	20	IDGD	
CC[C@@H](CN1CCCC1)NC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	758847643	FSFUSZNGHWMFEC-KRWDZBQOSA-N	437.566	1.290	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@@H]2CC[C@@H]3SCCS[C@H]32)c2ccccc2c1=O	763077149	BLXPJMRFDQYETD-YCPHGPKFSA-N	433.559	1.740	50	20	IDGD	
O=C(CSc1nnnn1CC(F)(F)F)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	763173162	LHAQBCJYESOMND-UHFFFAOYSA-N	444.374	1.318	50	20	IDGD	
CN(NC(=O)CNC(=O)c1cccs1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	763282183	LWOGKKLJJSDERG-UHFFFAOYSA-N	425.511	1.114	50	20	IDGD	
CCC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)cc1	763538364	ATEKZZHKWXCUGY-UHFFFAOYSA-N	444.444	1.461	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cc(C3CC3)nn2-c2ccccc2)cc1	763660394	BMQWHGQQDVUVCH-UHFFFAOYSA-N	449.467	1.923	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)CCCN3C(C)=O)c1	763773085	UGYRGYCLXNTPEY-UHFFFAOYSA-N	440.456	1.403	50	20	IDGD	
O=C(NNC(=O)c1cc2c(s1)CCC2)C(=O)Nc1cccc(Cn2cccnc2=O)c1	763781931	OPRZBXNCSNENAA-UHFFFAOYSA-N	437.481	1.242	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2cc(Cl)ccc2C)c2ccccc2c1=O	763785055	CEOWMZYYKGOMDV-UHFFFAOYSA-N	427.848	1.778	50	20	IDGD	
CC(C)CCn1nc(C(=O)NNC(=O)C(=O)Nc2cccc(F)c2)c2ccccc2c1=O	763842678	ISXQFRNSCZQFAJ-UHFFFAOYSA-N	439.447	1.981	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cc(C3CC3)n(CC)n2)cc1	763861931	UCNDGDXVPFITLY-CYBMUJFWSA-N	429.477	1.733	50	20	IDGD	
CN(C)C(=O)Cn1ccc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCCCCC3)n1	763911803	MXIZAVHIHGCHQB-UHFFFAOYSA-N	446.533	1.092	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(C(N)=O)c(F)c2)ccc1OC(C)C	763921878	QYVMGVBDSLPFTJ-UHFFFAOYSA-N	432.408	1.120	50	20	IDGD	
CCNC(=O)N1CCc2ccc(NC(=O)C(=O)NNC(=O)Cc3ccc(Cl)cc3)cc21	763936010	CGROMMZLMFTNQF-UHFFFAOYSA-N	443.891	1.761	50	20	IDGD	
Cc1cc(-c2cccc(Cl)c2)ccc1NC(=O)C(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1	763997278	IGLXKSMJYYQUIR-OAHLLOKOSA-N	449.916	1.836	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1ccc(C)c(S(C)(=O)=O)c1	764012539	RXSDJYLVIXRWCK-UHFFFAOYSA-N	439.877	1.460	50	20	IDGD	
CCC(CC)NC(=O)[C@@H]1CN(C(=O)C(=O)NNC(=O)C2CCCC2)c2ccccc2O1	764078102	YIBRJGNIJMXWHN-SFHVURJKSA-N	430.505	1.423	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccnc(Sc3ccccn3)c2)c1O	764130110	AZHBQEPAJUSZQC-UHFFFAOYSA-N	439.453	1.742	50	20	IDGD	
Cc1ccc(Cn2cccc(NC(=O)C(=O)NNC(=O)c3scnc3C)c2=O)cc1	764247548	ZBPQTYPAWJRHOL-UHFFFAOYSA-N	425.470	1.370	50	20	IDGD	
CC(C)(C)OC(=O)c1ccccc1NC(=O)C(=O)NNC(=O)COc1ccccc1O	764278350	WPNYSTSYVOXEMF-UHFFFAOYSA-N	429.429	1.512	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)NC[C@H]1CN(Cc2ccccc2)CCO1	764327639	ZDSFTSLRJRKBEU-KRWDZBQOSA-N	430.530	1.716	50	20	IDGD	
Cc1nn(Cc2ccc(F)cc2)c(Cl)c1C(=O)NNC(=O)CNC(=O)c1cccnc1	764344740	IDRLUTBJDBHNPU-UHFFFAOYSA-N	444.854	1.618	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)C(=O)Nc1ccc(OCCN2CCCCC2)cc1	764354809	WOIDFGAQFVKWLW-UHFFFAOYSA-N	425.489	1.275	50	20	IDGD	
C[C@@H](CC(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1)C1CCN(C(=O)OC(C)(C)C)CC1	764617407	UJJIVTPWCBZQOW-ZFWWWQNUSA-N	431.555	1.242	50	20	IDGD	
CC(C)CC(=NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C)c1ccc(Cl)cc1	764816452	JMKXGGCTQLKOCN-UHFFFAOYSA-N	430.896	1.654	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)[C@H]1CCCN(C(=O)c2ccccc2)C1	765310708	KQQKDJGDQNDWFF-KRWDZBQOSA-N	432.521	1.991	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)N[C@@H]1CC(=O)N([C@@H]2C[C@H]2c2ccccc2)C1	765799333	GWAKHXJLRUWPIH-SOLBZPMBSA-N	428.514	1.873	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)C1=NO[C@H](c2ccccc2)C1	766635865	HJDSBFDHDBWDOF-FQEVSTJZSA-N	435.484	1.109	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)C3(NC(=O)OC(C)(C)C)CC3)CC2)cc1	766647988	HUFDWAGHTNGOGL-UHFFFAOYSA-N	445.564	1.317	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)c1ccc2nn[nH]c2c1	766659928	JSXQHMMVPOBPLC-UHFFFAOYSA-N	427.896	1.190	50	20	IDGD	
CC(C)(C)Oc1cccc(CNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)n1	767214094	ZJEOAUAGJSCPFN-UHFFFAOYSA-N	427.509	1.796	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(OC[C@H]2CCOC2)c(F)c1)c1ccc(Cl)nc1	767447496	BXKLYYVPJPHPHK-NSHDSACASA-N	429.857	1.913	50	20	IDGD	
COC(=O)[C@H](NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1ccccc1C	767554424	JPUOFHDSFQOPAN-LJQANCHMSA-N	447.513	1.165	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)CO[C@H]2CCCN(C(=O)OC(C)(C)C)C2)c1	767771927	UTAWEFVPUOKWDI-HNNXBMFYSA-N	437.493	1.881	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](OCC(=O)NNC(=O)COc2ccc(F)cc2)C1	769050972	YYZGWRRYIOASEI-INIZCTEOSA-N	425.457	1.768	50	20	IDGD	
CCc1nc(-c2ccc(C(=O)OCC(=O)NNC(=O)Cc3nc(C)cs3)cc2)n[nH]1	770154100	NHHSHBKYNSSZPN-UHFFFAOYSA-N	428.474	1.346	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CN2C(=O)N[C@@](C)(c3ccc(F)c(Cl)c3)C2=O)c(O)c1	770223421	SEPSWPZKYBQNRV-FQEVSTJZSA-N	448.838	1.721	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCC2(C)Cc3ccccc3C2)c1	770311549	FQXQWXHHLMDVSO-UHFFFAOYSA-N	430.530	1.686	50	20	IDGD	
O=C(CCN1CCN(C(=O)[C@@H]2CCCO2)CC1)NNc1ccc(Br)c(F)c1	771681726	WQSWPQMPNBFUKF-INIZCTEOSA-N	443.317	1.745	50	20	IDGD	
CS(=O)(=O)c1ccccc1-n1cc(NC(=O)C(=O)NNc2ccccc2[N+](=O)[O-])cn1	773656213	ZTQVTLGNSIBJSQ-UHFFFAOYSA-N	444.429	1.266	50	20	IDGD	
O=C(COC(=O)[C@H]1CCc2c(Cl)cccc21)NNC(=O)[C@H]1COc2ccccc2O1	775932102	POUQPVZIQYCZBA-KBXCAEBGSA-N	430.844	1.900	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)N[C@H]2CCO[C@@]3(CCS(=O)(=O)C3)C2)cc1	776075739	DIWCYGJMHUCRQA-KSSFIOAISA-N	427.548	1.154	50	20	IDGD	
COCc1nnc(-c2cccc(C(=O)OCC(=O)NNC(=O)c3cccc(C#N)c3)c2)o1	776456744	QRRJGVXEDMHMQF-UHFFFAOYSA-N	435.396	1.373	50	20	IDGD	
O=C(NNC(=O)[C@@]1(F)CCN(C(=O)OCc2ccccc2)C1)c1ccc2c(c1)OCO2	776966064	HGYUGMLIMGRGLD-OAQYLSRUSA-N	429.404	1.927	50	20	IDGD	
O=C(CCn1c(=O)oc2cc(S(=O)(=O)N3CCCC3)ccc21)NNc1ccccn1	777470294	KAYJVSITVMNFSJ-UHFFFAOYSA-N	431.474	1.307	50	20	IDGD	
CCNS(=O)(=O)c1ccccc1S(=O)(=O)NNC(=O)c1cc(C)nc2ccccc12	777596692	ZMNDSNUJUIFHNJ-UHFFFAOYSA-N	448.526	1.465	50	20	IDGD	
Cc1ccc2cccnc2c1S(=O)(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	777907653	ZABDEWNQGQMZJL-UHFFFAOYSA-N	448.526	1.417	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)[C@H]2CCCN2C(=O)/C=C\c2ccc(C(N)=O)cc2)c1	780793524	YTMJYIWYIQNOMD-UZRURVBFSA-N	436.468	1.720	50	20	IDGD	
Cn1cnn(CC(=O)NNC(=O)c2cc(-c3ccccc3Cl)nc3ccccc23)c1=O	781417385	GGSXOHZBDQAGIZ-UHFFFAOYSA-N	436.859	1.912	50	20	IDGD	
O=C(NNc1ncncc1Cl)C(=O)N1C[C@@H](C(=O)N2CCCCC2)Oc2ccccc21	782158788	CLOAXERNKWDUQE-INIZCTEOSA-N	444.879	1.380	50	20	IDGD	
C=CCOc1cccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)c1	784214488	YDFDFYLBRNQCHO-UHFFFAOYSA-N	430.486	1.774	50	20	IDGD	
O=C(NNc1ccc(Br)nc1)C(=O)Nc1ccc(C(=O)N2CCOCC2)cc1	784806660	NIQJARHOVXDVKH-UHFFFAOYSA-N	448.277	1.398	50	20	IDGD	
CSc1cnn(-c2ccccc2)c1NC(=O)C(=O)NNC(=O)Cc1cn2ccccc2n1	785061086	RWXAKQGESXKVAM-UHFFFAOYSA-N	449.496	1.571	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2cccc(C(F)(F)F)n2)n[nH]1	786417631	UGWXSKDGNGYJBS-UHFFFAOYSA-N	448.361	1.899	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)C(F)(F)C3(O)CCCC3)cc2)CC1	786425851	GSHGCSZXUVQSLS-UHFFFAOYSA-N	432.493	1.006	50	20	IDGD	
C=C(CBr)CN1CC(S(=O)(=O)N2CCN(C(=O)OC(C)(C)C)CC2)C1	791483775	TWPALCGLPRHLHY-UHFFFAOYSA-N	438.388	1.504	50	20	IDGD	
CC(C)c1ccccc1NC(=S)NNC(=O)[C@@H](C)N1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O	792492062	PMNRIVLOGDATKR-YFTGLANFSA-N	430.530	1.679	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cccc(Cl)n3)n[nH]2)cc1OC	793026243	QGESXESXCRNCCF-UHFFFAOYSA-N	444.835	1.542	50	20	IDGD	
Cc1cc(S(=O)(=O)NNC(=O)CNC(=O)OCc2ccccc2)cc([N+](=O)[O-])c1F	794598874	OGVBXHFYZKEHFH-UHFFFAOYSA-N	440.409	1.278	50	20	IDGD	
O=C(CCCS(=O)(=O)c1ccc(Cl)cc1)NNC(=O)CNC(=O)c1cccs1	795957164	JESZXCRHNGADDA-UHFFFAOYSA-N	443.934	1.533	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(OC)c(OC)c(C)c1OC	796989222	BDKFPZMXAHCVID-UHFFFAOYSA-N	445.472	1.748	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNC(=O)C(=O)Nc1ccccc1C(F)(F)F	797370274	XWXKIDUQAZAEMS-UHFFFAOYSA-N	438.362	1.718	50	20	IDGD	
CCOC(=O)c1cnc(C)c(NC(=O)NNC(=O)CNC(=O)OCc2ccccc2)c1	797639455	ZRENHHWBPFKGOW-UHFFFAOYSA-N	429.433	1.646	50	20	IDGD	
CCOc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccccc1F	799258393	BHXWIKGFSDDMQR-LLVKDONJSA-N	434.380	1.686	50	20	IDGD	
CC(=O)NCCNC(=O)CCC(=O)NNC(=O)Nc1ccc(Br)cc1Cl	802038606	MMZPBFIAVHFLPP-UHFFFAOYSA-N	448.705	1.288	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2nc(N3CCCC3)ncc2Cl)cc1	802066661	UWMGVVNNNIXLCC-UHFFFAOYSA-N	438.897	1.600	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)N2CCC[C@@H]2C(=O)NNc2ncccc2F)o1	804215477	SCBMBFUQGJGRDB-GFCCVEGCSA-N	426.426	1.287	50	20	IDGD	
CCOc1cc(Br)ccc1NC(=O)C(=O)NNc1ccc(-n2ccnc2)nn1	807429496	SWSDIZQQSOCUSW-UHFFFAOYSA-N	446.265	1.905	50	20	IDGD	
COc1cc(NC(C)=O)c(Cl)cc1S(=O)(=O)NNC(=O)c1ccc2c(c1)OCO2	808069178	RODRRRZYQJPROR-UHFFFAOYSA-N	441.849	1.659	50	20	IDGD	
Cc1nc(S(=O)(=O)NNC(=O)c2nnc(-c3ccccc3)o2)c(Br)n1C	808080892	KCNSRRCUFYYLEX-UHFFFAOYSA-N	441.267	1.164	50	20	IDGD	
O=C(COC(=O)[C@@H]1C[C@@H](c2ccccc2)OC1=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	808588919	LJEDXMLDNNLCTE-HOTGVXAUSA-N	427.369	1.203	50	20	IDGD	
CC(C)(C)[Si](C)(C)OCCN1CCN(S(=O)(=O)[C@H]2CCS(=O)(=O)C2)CC1	808735405	UXTFGUBFFBTPRL-HNNXBMFYSA-N	426.677	1.143	50	20	IDGD	
N#Cc1cc(Cl)nc(NNC(=O)CNS(=O)(=O)c2cccc(Br)c2)c1	810835112	VJDYYSDDZPDFMC-UHFFFAOYSA-N	444.698	1.791	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)c2nnn(-c3ccn(C)n3)c2C)cc1Cl	814411116	LSSWIVUFWJNRMA-UHFFFAOYSA-N	434.844	1.446	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)cc1)[C@H]1C[C@H]1C	815565600	USCPBCBTOJXGGW-VLIAUNLRSA-N	449.467	1.484	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)[C@@H]2CCN(c3ccc(F)cc3)C2=O)C1	816510239	PWDCRLMABHRLDF-YOEHRIQHSA-N	448.495	1.973	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)c2cc([N+](=O)[O-])ccc2N2CCOCC2)cc1	823498044	UVCBAPSBFOCOHN-UHFFFAOYSA-N	442.428	1.358	50	20	IDGD	
C=CCn1c(SCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)nnc1-c1ccncc1	824970265	XLNXIPRMFGAAAP-UHFFFAOYSA-N	439.457	1.988	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)CCNS(=O)(=O)c2ccccc2Cl)c1	825805995	VPGFJMKXRBFPMK-UHFFFAOYSA-N	440.909	1.277	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(Cl)cc1)NNC(=S)NCCc1cccs1	838818478	AZRXOVBZOLVMIA-UHFFFAOYSA-N	432.980	1.418	50	20	IDGD	
Cc1cc(C)c(C)c(S(=O)(=O)NCC(=O)OCC(=O)NNC(=O)c2ccccc2)c1C	848376946	RBEJUAALXFIWCN-UHFFFAOYSA-N	447.513	1.203	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCCNC(=O)c1ccco1	914537238	OUAXNOYOMDYTCQ-NSHDSACASA-N	439.266	1.570	50	20	IDGD	
COc1ccc2c(c1)C[C@@H](C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1)CO2	914781747	NWCWKAGXAOXISU-GFCCVEGCSA-N	439.877	1.008	50	20	IDGD	
CN(C)N(C(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-])[C@@H]1CCS(=O)(=O)C1	915828521	LLPBPSWHWPCZAA-SNVBAGLBSA-N	425.385	1.642	50	20	IDGD	
CCCC[C@H](CC)CNC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	915879362	ZBHIISBAOVMOJK-INIZCTEOSA-N	426.587	1.860	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)NC[C@H](c1cccs1)N1CCN(C)CC1	915901476	ILEXXYUGMFUDNL-MRXNPFEDSA-N	441.561	1.637	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NC[C@@H](C)N2CCCC[C@@H]2C)cc1	916446929	DTJLFPZZZAOPON-DLBZAZTESA-N	439.582	1.209	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCCCS(=O)(=O)Cc2ccccc2)cc1OC	916577031	KECMNXUEMIXCGR-UHFFFAOYSA-N	435.502	1.653	50	20	IDGD	
CCCn1c(=O)nc(O)c2c(C(=O)NNC(=O)c3ccc(Cl)nc3)cc(C3CC3)nc21	917252144	BUXWKPHAFAPZOG-UHFFFAOYSA-N	442.863	1.908	50	20	IDGD	
CC(C)NC(=O)C(=O)NNC(=O)[C@@H]1CCC(=O)N(Cc2ccccc2)[C@@H]1c1ccccc1	917622104	IZMXHMMSTSGMRP-TZIWHRDSSA-N	436.512	1.839	50	20	IDGD	
CCCCS(=O)(=O)N1CCC[C@@H]1C(=O)NNC(=O)c1ccc(Br)s1	918688762	COQOUFABEYMJFX-SNVBAGLBSA-N	438.369	1.866	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)NNC(=O)c2c(C)nc3ccccn23)cc1OC	918776777	ZJLSBFNCCJNRKN-UHFFFAOYSA-N	440.460	1.729	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2ccc(CN3CCN(C)CC3)cc2)c2ccccc2c1=O	919742937	LSZIKUSCQCBNEX-UHFFFAOYSA-N	448.527	1.239	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCC(=O)N2CCCc3ccccc32)c1	920045585	POGXTDMSLLOFJV-UHFFFAOYSA-N	430.486	1.014	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@@H](C)NS(=O)(=O)c2cccc(C(F)(F)F)c2)cc1	1116320884	ULDDGQGRQKJQFT-LLVKDONJSA-N	445.419	1.842	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@H]1CCCCN1Cc1ccncc1	1318358943	DVMMKQISRZAWPR-QGZVFWFLSA-N	444.561	1.499	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NN=Cc1cccc2cn[nH]c12	1318670278	IEXPUYHOOJYSTG-UHFFFAOYSA-N	441.513	1.667	50	20	IDGD	
CCN1CCOC[C@@H]1C(=O)NNC(=O)c1ccc(CSc2nc(C)cc(C)n2)cc1	1335881495	PNWYDBCNEIYGIM-GOSISDBHSA-N	429.546	1.867	50	20	IDGD	
CCCC(=O)N[C@H](C)C(=O)N1CC[C@]2(CN(C(=O)[C@H](Br)CC)CCO2)C1	1779259077	XFPPUNXQZUQURV-HBUWYVDXSA-N	432.359	1.295	50	20	IDGD	
C=CC(=O)N[C@@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](Br)CC)C2	1779536178	KTKDNOHLWMQNEE-XTDOFWJNSA-N	444.370	1.365	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(CCN(C(=O)c3cncc4cnccc34)C2)C1	1780011282	BIKWTAXEYSBOCM-OAQYLSRUSA-N	428.565	1.925	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Cl)C2)c1cc(-n2ccnc2)ccn1	1780215956	URVBHMUJMMWCBP-FUHIMQAGSA-N	435.887	1.929	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)ccc1Br	1780869345	NQLRXXLWUOWHBC-YJBOKZPZSA-N	445.741	1.801	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(CCN(C(=O)[C@H]3CC[C@H]4CCC(=O)N4C3)C2)C1	1781055623	AIMILPTVJHPMHQ-XGHQBKJUSA-N	437.613	1.069	50	20	IDGD	
C[C@@H](NC(=O)OC(C)(C)C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2	1782077173	AZTGHZXCNZJWFE-RDNQGFKOSA-N	447.960	1.013	50	20	IDGD	
CCN(CC)[C@H](C(=O)N1CC[C@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1)c1ccccc1	1782813119	PCGWWHJCBYUNGH-XQBPLPMBSA-N	437.968	1.499	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cccc4c3OCCO4)CCO2)C1	1783534110	FEHCLFNNZQHUBG-BFUOFWGJSA-N	439.306	1.685	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3nnc(-c4ccccc4)o3)CCO2)C1	1783534153	QOPOPQWRSDRBLM-BFUOFWGJSA-N	449.305	1.964	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccc4ncncc4c3)CCO2)C1	1783534845	ZWQPYTUCZADWSI-BFUOFWGJSA-N	433.306	1.857	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@H](C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)C1	1783866369	FOBUEDOIHFADAF-GJRWTSMGSA-N	445.354	1.579	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cn4ccccc4n3)C[C@@H]21	1783965779	RBLLZBATLLHMFB-JKQORVJESA-N	449.349	1.959	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3[C@@H]4Sc5ccccc5[C@H]43)C[C@@H]21)[C@@H](O)CCl	1784092191	IWAVXAPMYFINQB-BPYLMNKQSA-N	436.961	1.454	50	20	IDGD	
COc1ccc(F)cc1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1785025122	RVLPWFOGYSFXHJ-RHSMWYFYSA-N	433.249	1.968	50	20	IDGD	
CN(C)CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C[C@@H]21	1786479932	BQRRZRGTFSFDHT-TYDTZWSASA-N	432.471	1.413	50	20	IDGD	
Cc1nn(C)cc1C(=O)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1	1786506938	ARXQNHHEHZXIBQ-UHFFFAOYSA-N	432.289	1.470	50	20	IDGD	
C[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)n1cccc1C=O	1786996295	DPHYTLKXTSSRED-OSZUESSQSA-N	444.301	1.532	50	20	IDGD	
COc1nccnc1C(=O)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1	1787087111	DSRNROVMGGHPCJ-UHFFFAOYSA-N	446.272	1.227	50	20	IDGD	
O=C(Cc1ccc(F)cn1)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1	1788140702	LJCALEGKLGRPJE-UHFFFAOYSA-N	447.275	1.891	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC1(c2ccc(NC(=O)CCc3cncnc3)cc2)CCC1	1788212408	SUVAOCLFQYZYKP-UHFFFAOYSA-N	438.532	1.916	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3c(F)cncc3F)[C@H]2C1	1789005865	VYAHBNCHUCFLDF-YXMPFFBPSA-N	446.292	1.984	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3nn[nH]c3C(F)(F)F)[C@H]2C1	1789358862	QPZCLKZUECVZAP-YFKTTZPYSA-N	437.850	1.824	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4n(n3)CCC4)C[C@@H]21	1791056071	NBDRYLHJWMPHTN-DSPQJCBJSA-N	425.327	1.206	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccccc3-n3nccn3)C[C@@H]21	1791257178	RYZBETRLFLEBTO-RMRDIRSESA-N	447.923	1.114	50	20	IDGD	
Cc1ccc(C)c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]32)c1	1791924866	ZKWDUGWFIIUDSA-IHPCNDPISA-N	430.549	1.270	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCl)C1CCN(Cc2ccccn2)CC1	1793110605	MEKVXBLNADMXPY-YRPNKDGESA-N	434.968	1.532	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H](C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](O)CCl)C1	1793111858	ZNDGMIJNWNDYAZ-LJIZCISZSA-N	429.945	1.481	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1c[nH]c2ccc(C)cc12	1793970824	BGLTYENMDHQUDP-VWFIUDSGSA-N	433.936	1.862	50	20	IDGD	
C[C@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCBr)[C@@H]1SC(=N)NC1=O	1795492350	KAEXAINRECIMKV-JPYZYGQNSA-N	431.356	1.212	50	20	IDGD	
CC(C)(C)c1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)cn1	1796185773	NGZOPQUAGQPQFY-ACDBMABISA-N	435.333	1.625	50	20	IDGD	
C[C@H](Cc1ccc(F)cc1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1	1796190372	RXZUKHDBTIAXMA-ZHHJKBAOSA-N	438.308	1.636	50	20	IDGD	
CCn1nc(C)cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C(C)=N/NC(=O)c1ccc[nH]1	1796892231	QEFQYIJAAABUER-GSWMANSFSA-N	439.520	1.597	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1ccc2[nH]ccc2n1	1797397385	AOZKCYWNHPCUOQ-ANGCBRKESA-N	425.258	1.457	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2cn[nH]c2cn1	1797579381	FVOPQDWIFLHRSM-YGSHXTJESA-N	436.310	1.192	50	20	IDGD	
COc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@](C)(Cl)CCl)C3)ccc1O	1798952759	GAZNFEMRFPYOPZ-AODNKKSCSA-N	431.316	1.840	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1c[nH]c3ccccc13)C2)[C@@H](F)Br	1799348311	GLUSIKVWUPPWGF-JGTCGTHISA-N	438.297	1.991	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@](C)(Cl)CCl	1800078795	NXRAPMTWVHLAQF-QBKBXNBMSA-N	442.347	1.995	50	20	IDGD	
O=C1Nc2c(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)[C@@H](F)Br)cccc2C1=O	1800158248	FSNUGKKHIVJHGE-DRNSDYETSA-N	438.253	1.764	50	20	IDGD	
CN1CCN(C2(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)[C@H](F)Br)CC2)CC1	1800162353	VLHLWZBVRDWSEX-XGUBFFRZSA-N	431.350	1.095	50	20	IDGD	
COc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)Br)c(F)c1	1800759966	UQLOLEJOFOZOIJ-OVZMXSCWSA-N	429.286	1.821	50	20	IDGD	
COC(=O)c1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](O)CCl)C3)c([N+](=O)[O-])c1	1800792588	MEJUNSMSVOCLOY-ZWUHOBOKSA-N	439.852	1.233	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cn1cnc2ccccc21	1800888879	HPHSWDYREMTYAS-NXEZDXNNSA-N	449.349	1.799	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1CC(C)(C)C1	1801060097	QWRHNAYORHZNPQ-KXJDEQQPSA-N	429.521	1.146	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CNC(=O)C(F)(F)F	1802383836	ZXEAHOFAMPGGDF-VLEAKVRGSA-N	428.249	1.477	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCCC2(CCN(C(=O)CN3CCS(=O)(=O)CC3)CC2)C1	1806152678	GZBOOOJIMQINIL-QGZVFWFLSA-N	448.029	1.356	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCCC2(CCN(C(=O)c3cc(=O)n4[nH]cnc4n3)CC2)C1	1806156889	LGQQCCCRZSZRFE-CQSZACIVSA-N	434.928	1.670	50	20	IDGD	
Cn1cccc(C(=O)N2CCCC3(CCN(C(=O)[C@H](F)Br)CC3)C2)c1=O	1806296110	PKVTZMHCPZAVOB-AWEZNQCLSA-N	428.302	1.921	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)C2CC3(CCC3)C2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1	1807373293	APVBGBWEFLIGJG-SIKLNZKXSA-N	447.344	1.661	50	20	IDGD	
Cn1ccc(CC(=O)NC[C@@H]2CCN(C(=O)CCBr)[C@H]2c2cccnc2)n1	1807512045	BXIBCCNXNZEJCJ-KXBFYZLASA-N	434.338	1.849	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)c1[nH]nc2ccncc12	1808095154	LNWNKIRSGMCHRE-OWQGQXMQSA-N	428.880	1.272	50	20	IDGD	
Cn1nncc1C(=O)N1CC[C@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]1c1cccnc1	1808291923	QWQNULQGQLYZQY-DDUZABMNSA-N	425.320	1.766	50	20	IDGD	
CC(=O)NCCC(=O)N1CC[C@H](CNC(=O)[C@](C)(Cl)CCl)[C@@H]1c1cccnc1	1808318308	UQAMMKRTJJCDKA-HHXXYDBFSA-N	429.348	1.850	50	20	IDGD	
Cc1noc(N)c1C(=O)N1CC[C@H](CNC(=O)[C@H](F)Br)[C@H]1c1cccnc1	1808660778	CZMVFLFRHLEJJK-BNOWGMLFSA-N	440.273	1.970	50	20	IDGD	
CC(=O)N[C@H](C)C(=O)N1CC[C@H](CNC(=O)[C@H](F)Br)[C@H]1c1cccnc1	1808678905	PFWHOAJBLFCQQC-QZKOUSHUSA-N	429.290	1.303	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2cc3cccnn3n2)[C@H]1c1cccnc1	1811269541	GLRIPCDGBHBIBO-HHXXYDBFSA-N	442.907	1.698	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@@H](CNC(=O)c2c[nH]c(=O)cn2)[C@@H]1c1cccnc1	1811446576	GBDOPOVZRRUPLQ-IFIJOSMWSA-N	448.321	1.516	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)Cc2ccn(C)n2)[C@H]1c1cccnc1	1812864572	PZNMGRGCPJTNQF-YEWWUXTCSA-N	434.338	1.847	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2[nH]nc3ncccc23)[C@@H]1c1cccnc1	1813029898	BALQJQNSUUZNNH-QILLFSRXSA-N	442.907	1.926	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)C(F)(F)C(F)F)[C@H]1c1cccnc1	1813068419	MLGMWZPAXFDFDJ-BBRMVZONSA-N	447.433	1.361	50	20	IDGD	
C=C[C@H](O)C(C)(C)C(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1813072428	DMCDMKDUGHTJSW-WFXMLNOXSA-N	445.564	1.034	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)C2(C#N)CCC2)[C@H]1c1cccnc1	1813074797	VWOLAANRHWDBFN-PXNSSMCTSA-N	426.521	1.154	50	20	IDGD	
C[C@H](C(=O)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@@H]1c1cccnc1)n1cncn1	1813402166	ONYZJQJAWSVIBP-BEAPCOKYSA-N	439.289	1.631	50	20	IDGD	
COc1ccc([C@H](O)C(=O)Nc2cc([C@@H]3CCCCN3C(=O)[C@@H](O)CCl)[nH]n2)cc1	1814632432	HJKSSSAYZHOMRI-BQFCYCMXSA-N	436.896	1.744	50	20	IDGD	
CN[C@H](CC(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](F)Br)[nH]n1)C(=O)O	1817372306	PMNFNIMQTHLMOY-NRUUGDAUSA-N	434.266	1.155	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(F)nc2)[nH]n1)c1ccc(B(O)O)cc1	1817472098	HUPRCKAXDNFRCU-KRWDZBQOSA-N	437.240	1.243	50	20	IDGD	
CSCC(C)(C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1	1817474094	LWGCNDSBXUXTNH-QGZVFWFLSA-N	444.366	1.785	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2[C@@H]3C=CS[C@@H]23)[nH]n1)c1ccc(B(O)O)cc1	1817474781	FQQUAHXOGIXJEN-IAAVTCLWSA-N	438.318	1.271	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CNC(=O)c2ccco2)n[nH]1	1817606654	LFHJLYSIABCOBK-GXTWGEPZSA-N	437.884	1.679	50	20	IDGD	
COCCCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)n[nH]1	1818110389	DRQBWNFIZDSFEW-PTZPRWATSA-N	443.508	1.962	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](C)CN)[nH]n1	1818112047	RRCDOCJVUQCSAE-NGLVEMMDSA-N	428.497	1.131	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](O)N3CCOCC3)sc2C1	1819877993	YMJAOOQVLDEGFA-BWACUDIHSA-N	430.958	1.113	50	20	IDGD	
NC(=O)c1nccnc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)C(Cl)Cl)[nH]n1	1820027225	XEMMSQQNQLTUKQ-SECBINFHSA-N	426.264	1.408	50	20	IDGD	
N#Cc1ccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)cc1	1820550625	ZOULLTAYXHVBTA-FQEVSTJZSA-N	443.272	1.581	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccnnc2O)[nH]n1)[C@@H](F)Br	1820935082	IBMFDIRYUMZGTF-CMPLNLGQSA-N	427.234	1.902	50	20	IDGD	
Cc1cc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@H](O)CCl)CC3)n(C(F)F)n1	1821567613	PWIIQULXPFKQMB-LDYMZIIASA-N	433.868	1.869	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnc(O)nc1O)CC2	1822863558	OBUYICLSZBAPBL-GYKQLYQFSA-N	446.316	1.806	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3c(O)cc(O)cc3O)sc2C1	1823529543	JEHPLMVARGIJKD-PSASIEDQSA-N	441.893	1.740	50	20	IDGD	
O=C1CC[C@H](C(=O)N2CCCC[C@H]2C2CCN(C(=O)CCBr)CC2)CN1	1823834648	NHQJSBAFBJMCME-HOTGVXAUSA-N	428.371	1.917	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H]2CCC(=O)NC2)CC1	1823842851	GNAKNCDJKJCOPU-NUEKZKHPSA-N	428.371	1.916	50	20	IDGD	
Cc1ccc(CC(=O)N2CCCC[C@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)cn1	1825297804	PTKCNJRDNKVKRO-NRFANRHFSA-N	443.592	1.925	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](C)NC(C)=O)CC2	1825451399	JWWHNZKGJCYICT-LSJOCFKGSA-N	431.356	1.753	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCC(=O)NN(C)C)CC2	1825647881	VYCYABDHFFYSDD-ZJUUUORDSA-N	446.371	1.212	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1CCc2nc(NC(=O)CN3C(=O)C=CC3=O)sc2C1	1826319872	TVQNKDNTNOVTAG-XLFHBGCDSA-N	445.328	1.216	50	20	IDGD	
O=C(/C=C/c1cnc[nH]1)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827060603	RYZJUICNRHCNAI-CQQBXOTJSA-N	436.321	1.036	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)/C=C/c3cccc(C)n3)CCO2)C1	1829728357	LPITVUBMSBKVIV-DYWSFYFFSA-N	437.924	1.113	50	20	IDGD	
COc1ccccc1OCC(=O)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1830232160	WAQOYHIVJIKEHN-IBGZPJMESA-N	447.315	1.334	50	20	IDGD	
Cc1nnc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)s1	1830358206	SEBDATBIAABQOO-SFHVURJKSA-N	430.958	1.110	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCCn3ccnc3C)C2)C1	1831657210	MVEHIWORXZENOI-GHTZIAJQSA-N	440.972	1.836	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3CCN(CC)CC3)C2)C1	1831658392	DSFXWJUNNIYXSL-GHTZIAJQSA-N	429.989	1.582	50	20	IDGD	
CC(=O)C[C@H](C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1	1831798832	ICALQFNBTCBRMI-KKSFZXQISA-N	428.338	1.215	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)C[C@@](C)(O)CC(=O)O)CC2)CC1	1833534677	GIXLKECUKYNZBQ-LAUBAEHRSA-N	445.988	1.581	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccsc3)CCO2)C1	1833968887	YWBLBNVDJYNSIY-RHSMWYFYSA-N	431.352	1.992	50	20	IDGD	
Cc1nccn1CC(=O)N1CCC(N2CCC(NC(=O)CCBr)CC2)CC1	1834424402	ZMOATDHXNQSAKX-UHFFFAOYSA-N	440.386	1.548	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3csc(C)c3C)CCO2)C1	1834541394	KVJMFPGLKUPKGG-LPHOPBHVSA-N	430.954	1.689	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC(N2CCC(NC(=O)[C@H](N)c3ccccn3)CC2)CC1	1834725493	VHUCRWGJIAYYIU-OAQYLSRUSA-N	447.656	1.505	50	20	IDGD	
O=C(NCC(=O)N1CCC(N2CCC(NC(=O)[C@@H](F)Cl)CC2)CC1)c1ccco1	1835080595	YKARVYJPONLWQX-QGZVFWFLSA-N	428.892	1.115	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)/C=C/c3ccccc3)CCO2)C1	1835114829	XAYBFEZFQHEYDI-KJOHCHSBSA-N	437.334	1.940	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCC(N2CCC(NC(=O)c3n[nH]cc3[N+](=O)[O-])CC2)CC1	1835866954	AQDUSJPWMBVSGW-UHFFFAOYSA-N	440.932	1.768	50	20	IDGD	
O=C(c1cccn2cncc12)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1837114045	YQABEHGWGGADBF-GOSISDBHSA-N	427.288	1.208	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(O)ccc3F)C2)C1	1837715066	UGOKIRLPXBGZOY-FQEVSTJZSA-N	440.544	1.453	50	20	IDGD	
Cc1nscc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839197876	KOKRGLCMRKXYQK-DOMZBBRYSA-N	436.303	1.212	50	20	IDGD	
CCOc1cccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](Cl)CC)C3)C2)c1O	1839427061	FFYSMIMVRWETDN-HRAATJIYSA-N	440.924	1.878	50	20	IDGD	
Cc1ccn2c(C(=O)N3CCO[C@]4(COCCN(C(=O)C(Cl)Cl)C4)C3)cnc2c1	1839602767	YCSNTXWNMFXXDS-LJQANCHMSA-N	441.315	1.516	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccnc3)C2)C1	1839963879	ZJMHZEBYAHONJK-QAPCUYQASA-N	426.311	1.325	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1C[C@H]3CC[C@@H]1O3)CCO2	1840048171	SKDUTZRTVQFZHT-IPXJXJKCSA-N	445.354	1.041	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(O)c(C)c3)C2)C1	1840154984	MAAVFHUFSWYYJG-OXJNMPFZSA-N	426.897	1.024	50	20	IDGD	
O=C(Cc1cccnc1Cl)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840186854	QJJMJUYZJSMAMK-QGZVFWFLSA-N	436.723	1.538	50	20	IDGD	
O=C(c1cnc2ccc(F)cn12)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840189860	PXFPETYKAMTJPP-SFHVURJKSA-N	445.278	1.347	50	20	IDGD	
O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)CCCn1cccc1)CCO2	1840460192	AIDZSUVYXVMPBQ-LJQANCHMSA-N	442.354	1.510	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccccc3NC(C)=O)CCO2)C1	1840724946	SHOHLYCEDSKZIQ-UWJYYQICSA-N	437.924	1.732	50	20	IDGD	
CO[C@H](C)[C@@H](C(=O)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1)N(C)C(=O)OC(C)(C)C	1841352215	BQQSPXZQVLEIRO-ILXRZTDVSA-N	447.960	1.060	50	20	IDGD	
C[C@@H](C(=O)N1CC2(CCCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C1)C1(O)CCC1	1841924042	PANWOLWZJAPJOZ-GJZGRUSLSA-N	443.972	1.873	50	20	IDGD	
Cc1onc(-c2ccccc2)c1C(=O)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843013430	HWDUEOFOUZNSIC-UHFFFAOYSA-N	445.284	1.461	50	20	IDGD	
CCN1CCC(C(=O)N2CC3(CCCN3C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)CC1	1843417217	JFGFMNAKJFHARX-LFVJCYFKSA-N	428.537	1.056	50	20	IDGD	
O=C(Cn1ccc2sccc2c1=O)N1CC2(CCCN2C(=O)[C@H](F)Br)C1	1845216225	CQMCAKXDJWZPGT-AWEZNQCLSA-N	442.310	1.957	50	20	IDGD	
N=C1NCCN1CC(=O)N1CC2(CCCN2C(=O)[C@@H](Br)Cc2ccccc2)C1	1845941430	YIWMLGLQUXFJCR-INIZCTEOSA-N	448.365	1.036	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC12CN(C(=O)[C@H](O)CCNC(=O)OC(C)(C)C)C2	1846178211	KSRGKGYAJJULEC-QWHCGFSZSA-N	448.358	1.249	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)C[C@@H](NC(N)=O)c2cccs2)c2ccccc2c1=O	11148171	HOZMKOXDMNMJQI-CQSZACIVSA-N	442.501	1.429	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)CCN2C(=O)COc3ccccc32)cc1	18071519	UJZVDQAUFLFEBB-HNNXBMFYSA-N	427.457	1.816	50	20	IDGD	
COc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)cc1	18103865	RIVIGPVIHYJQTA-JKSUJKDBSA-N	449.529	1.594	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(C(=O)NNC(=O)Cc2ccc(Cl)cc2)cc1	26071117	TZPOPHDHCDLQAB-UHFFFAOYSA-N	425.894	1.268	50	20	IDGD	
COc1ccc(C)cc1N1C[C@@H](C(=O)NNC(=O)c2cc(Br)c[nH]2)CC1=O	28717597	VXKRRQYHFCSJQF-NSHDSACASA-N	435.278	1.908	50	20	IDGD	
C[C@H](NC(=S)NNC(=O)c1cc(S(=O)(=O)NCc2ccccc2)ccc1O)C1CC1	727271488	FAMHKAXKCDTORI-ZDUSSCGKSA-N	448.570	1.778	50	20	IDGD	
CC/C=C(/C)C(=O)N1CSC[C@H]1C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	727986740	DHWGKIRIGZBGMU-GIXCSOPHSA-N	425.532	1.109	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)CSCC(=O)Nc1cccc(Br)c1	728204172	WTMCGEFVAVEBTM-UHFFFAOYSA-N	425.308	1.921	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)C3C[C@@H]4CCC[C@H](C3)C4=O)cc2)CC1	728214952	VMMPBJIMXYQJGF-SJPCQFCGSA-N	434.562	1.461	50	20	IDGD	
O=C(NCCCN1C(=O)NC2(CCCC2)C1=O)NNC(=O)c1cccc(OC(F)F)c1	728594733	XXIKGIAHLLVASZ-UHFFFAOYSA-N	439.419	1.487	50	20	IDGD	
CS(=O)(=O)c1cc(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)ccc1Cl	728845380	JCMFLWLORZIUIH-UHFFFAOYSA-N	437.909	1.211	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CC(=O)N(c2ccc3c(c2)CCC3)C1)C1CCN(c2ncccn2)CC1	728846154	SLKAZWICTCVGGL-LJQANCHMSA-N	448.527	1.382	50	20	IDGD	
O=C(CNC(=O)NCc1ccco1)NNC(=O)c1ccc(Br)cc1Cl	728870067	PHWYHDQTPRVZPU-UHFFFAOYSA-N	429.658	1.956	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)c2ccc3c(c2)C(=O)NC3=O)cc(OCC)c1OCC	729283435	PXZIHFIKDAOBOI-UHFFFAOYSA-N	441.440	1.841	50	20	IDGD	
C[C@H](NC(=O)CCC(=O)C(C#N)=C1N(C)c2ccccc2N1C)[C@H](C)N1CCOCC1	729447758	ZYLHGHODTFVHRF-IRXDYDNUSA-N	425.533	1.882	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)[C@@H]1C[C@@H](O)CN1C(=O)OCc1ccccc1	729541718	YBVAEIMFNWONSI-QUCCMNQESA-N	436.468	1.561	50	20	IDGD	
Cc1c(C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)cnn1-c1cccc(Br)c1	729946106	TXDMTODDARKZBW-NSHDSACASA-N	441.307	1.139	50	20	IDGD	
C[C@H]1C[C@H](C)CN(C(=O)CN2CCN(C(=O)NNC(=O)C(C)(C)c3ccccc3)CC2)C1	731220993	CDRXVHQMRUBFAN-OALUTQOASA-N	443.592	1.827	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)c1nnn(-c2cccc3cccnc23)c1C	731452976	ADZCQKPBFGCHLA-UHFFFAOYSA-N	432.440	1.973	50	20	IDGD	
N#CC1(C(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)CCOCC1	731487603	PPCKCHOCYNVDRQ-UHFFFAOYSA-N	434.499	1.630	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)Sc1nnc(N2CCOCC2)n1-c1ccccc1	731904050	DEWIUVGAACRLAG-OAHLLOKOSA-N	432.550	1.778	50	20	IDGD	
C[C@@H]1CN(C[C@@H](C)C(=O)NN=C2CCS(=O)(=O)c3cc(F)c(F)cc32)C[C@@H](C)O1	731924921	MVOGYYHUWPUVMM-JHJVBQTASA-N	429.489	1.708	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)c1ccc2c(c1)S(=O)(=O)N=C1N=CNN12)c1ccccc1	731996876	GWRMBNXISVSGID-AWEZNQCLSA-N	426.458	1.053	50	20	IDGD	
COc1ccc(Cl)c(S(=O)(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)c1	732747145	MUWIPDHFVAZPFJ-UHFFFAOYSA-N	430.866	1.998	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)N[C@H]1CCCN(c2ccccc2)C1=O	734072124	QGQBZVVGLLRXIJ-HNNXBMFYSA-N	427.417	1.500	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@H]2CCC[C@H](C(=O)N(C)C)C2)c2ccccc2c1=O	734222781	WNPNLQRWAMXJPY-KBPBESRZSA-N	428.493	1.007	50	20	IDGD	
O=C(NNC(=O)N1CCN(C(=O)N2CCCCC2)CC1)c1cnn(-c2ccccc2)c1	736660008	CRRMOPGKABKEOG-UHFFFAOYSA-N	425.493	1.450	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N[C@H](CCSC)C(=O)NNc2cccnn2)cc1	736704368	STLNUXAUNMOZLV-OAHLLOKOSA-N	425.536	1.419	50	20	IDGD	
CC(C)CCn1cc(C(=O)NNC(=O)c2ccc(CSc3nncn3C)cc2)nn1	740813435	IPTDNASZYFIPMF-UHFFFAOYSA-N	428.522	1.820	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)c1cc(S(=O)(=O)Nc2ccccc2F)c[nH]1	740851959	DHZCGYAFNOOWSQ-UHFFFAOYSA-N	439.469	1.020	50	20	IDGD	
CN(C)C(=O)CS(=O)(=O)c1ccc(C(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)cc1	741883271	MJNOXNNADIMQHE-UHFFFAOYSA-N	447.557	1.526	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)ccc1-n1cncn1	742036794	NVYAEEIMTMUMSP-UHFFFAOYSA-N	427.490	1.252	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@@H]2Cc3cc(C)c(C)cc3O2)cc1	742473120	YVLSSDFEYAXKNR-IBGZPJMESA-N	431.514	1.383	50	20	IDGD	
C[C@@H](CC(=O)NNC(=O)Cc1c[nH]c2ccccc12)/N=C1/NS(=O)(=O)c2ccccc21	742478217	NGQVCMSVSZCDGU-ZDUSSCGKSA-N	439.497	1.375	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)N1CCc2ccccc2C1	743523585	BCWGUDQVZIJDAF-HNNXBMFYSA-N	445.545	1.873	50	20	IDGD	
CCN(CC1CCN(c2ccccn2)CC1)C(=O)NNC(=O)CNC(=O)c1cccs1	743577637	FMIZWNOVZYXNCE-UHFFFAOYSA-N	444.561	1.852	50	20	IDGD	
O=C(CCCS(=O)(=O)N1CCCC1)NNC(=O)c1cc(Br)ccc1O	743729989	KRUCIXSXOWQKLW-UHFFFAOYSA-N	434.312	1.122	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)[C@H](c2ccccc2)N2CCSCC2)c1	745088528	GMTFDYJLXQVXPC-FQEVSTJZSA-N	438.509	1.653	50	20	IDGD	
Cc1ccc(N2CCC[C@@H](NC(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)C2=O)cc1	745884163	HDULTUHBBROURI-GOSISDBHSA-N	448.483	1.382	50	20	IDGD	
O=C(NNC(=O)c1ccc(F)c(S(=O)(=O)Cc2ncon2)c1)c1cccc(Cl)c1	746095237	MIPOVNJTNPGSRE-UHFFFAOYSA-N	438.824	1.911	50	20	IDGD	
Cn1ncnc1COc1ccc(S(=O)(=O)NNC(=O)NCCc2cccs2)cc1	746592431	XXTXPRCTHZZPFX-UHFFFAOYSA-N	436.519	1.191	50	20	IDGD	
Cc1nc(C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)nn1-c1n[nH]c(C(F)(F)F)n1	747348567	SJOCKFVNQUESPJ-ZETCQYMHSA-N	442.333	1.080	50	20	IDGD	
Cc1ccc(NC(=S)NNC(=O)c2cnc3c(c2C)c(=O)n(C)c(=O)n3C)c(C)c1	748049150	WDQGCIXUUZCFRQ-UHFFFAOYSA-N	426.502	1.189	50	20	IDGD	
CC(C)Cn1ncc2cc(C(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)cnc21	748214054	JFYMFXZLBAFQSO-UHFFFAOYSA-N	444.517	1.412	50	20	IDGD	
O=C(CCCC[C@@H]1SC[C@H]2NC(=O)N[C@@H]21)NNc1ccc(S(=O)(=O)C(F)F)cc1	748611283	IKFGQFSIJMIQKV-IPYPFGDCSA-N	448.517	1.852	50	20	IDGD	
Cc1c(NNC(=O)Cc2ccc(S(=O)(=O)N3CCOCC3)s2)cccc1[N+](=O)[O-]	748666987	UEWAUJUWDGLDNR-UHFFFAOYSA-N	440.503	1.671	50	20	IDGD	
O=C(NNc1ccc(OCC(F)(F)F)cc1)C1=NN([C@@H]2CCS(=O)(=O)C2)C(=O)CC1	748694407	MSEGIWGXWVURKI-GFCCVEGCSA-N	448.423	1.236	50	20	IDGD	
CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)NNC(=O)Cc1cn2ccccc2n1	749417377	WSBFZACGRBDHTF-LJQANCHMSA-N	436.447	1.392	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1ccc(I)c(Cl)c1	749875486	UVWLGWGEONTFQG-MRVPVSSYSA-N	442.662	1.140	50	20	IDGD	
COc1ccc(C(=O)CNC(=O)CCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1	751281631	BZFMQCQKVGLWSX-UHFFFAOYSA-N	428.401	1.144	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=S)N[C@@H](C)C2CC2)ccc1OC	751617370	JHUJWBIQCMFVHL-LBPRGKRZSA-N	428.580	1.633	50	20	IDGD	
CC[C@@H](NC(=O)NNC(=O)c1cc(F)ccc1Br)C(=O)N1CCOCC1	753047785	WRVNZFHYYVZCJE-CYBMUJFWSA-N	431.262	1.170	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)c1scnc1Br	753998455	CUGVHCMOTUIZKW-UHFFFAOYSA-N	438.351	1.879	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)NCCN2C(=O)[C@@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2=O)c1C	755459101	NRPYAZBRQBLYOJ-PCIYZRNASA-N	436.512	1.582	50	20	IDGD	
CN1CCC/C1=N/S(=O)(=O)c1cccc(NC(=O)NNC(=O)Cc2cccnc2)c1	756033660	ZGPZZWQCJFYXND-ULJHMMPZSA-N	430.490	1.290	50	20	IDGD	
CON(C)C(=O)c1ccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1	756503904	NUPVAGQPZFAHFO-UHFFFAOYSA-N	449.489	1.037	50	20	IDGD	
Cc1cc(C(=O)N2CCOCC2)ccc1N(C)CC(=O)NNC(=O)c1cccc(C#N)c1	756603818	ZXBXCFIXINBYIY-UHFFFAOYSA-N	435.484	1.237	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)Nc1ccc(S(=O)(=O)NC2CC2)cc1	756777114	VACLDDDKVSBMNO-LBPRGKRZSA-N	436.465	1.887	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)[C@H](C)NS(=O)(=O)c2cccc(C#N)c2)c(OC)c1	757188647	UROLODVQWHRXBZ-LBPRGKRZSA-N	432.458	1.164	50	20	IDGD	
Cc1cc(=NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)c(C)c[nH]1	757806502	BMRMUXVULXPZEY-UHFFFAOYSA-N	431.518	1.761	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2nnc(-c3ccccc3)s2)c1	760193807	ZOAKOLTWALWCBY-UHFFFAOYSA-N	431.499	1.753	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])o1	762371187	RRFQWWUBMIVIFD-LBPRGKRZSA-N	448.457	1.741	50	20	IDGD	
O=C(COC(=O)c1c[nH]c2cccc([N+](=O)[O-])c12)NNC(=O)[C@@H]1COc2ccccc2O1	762905515	ZBOWBPHWBSYOKK-INIZCTEOSA-N	440.368	1.220	50	20	IDGD	
O=C(NNC(=O)c1ccccc1)C(=O)Nc1cc(Br)ccc1N1CCOCC1	763422939	HQPZAXDADOHINC-UHFFFAOYSA-N	447.289	1.685	50	20	IDGD	
O=C(COc1cccc(NC(=O)C(=O)NNC(=O)c2ccncc2)c1)Nc1ccccc1	763464220	MUGGYHOPXCJRSL-UHFFFAOYSA-N	433.424	1.499	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccccc2SCCC(N)=O)cc1OC	763551375	WDQVZBYKOVIPHP-UHFFFAOYSA-N	446.485	1.071	50	20	IDGD	
CCN(CC)C(=O)COc1cccc(NC(=O)C(=O)NNC(=O)c2ccccc2F)c1	763575466	WEMCDVUMELLBBJ-UHFFFAOYSA-N	430.436	1.473	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)cccc1N1CCOC1=O	763600237	FVRQVRVRGSQOJK-UHFFFAOYSA-N	448.439	1.741	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2c(C)nc3ccccn23)cc1OC(C)C	763627718	DDVVNDJHJOSTQQ-UHFFFAOYSA-N	425.445	1.838	50	20	IDGD	
COc1cc(OC)c(NC(=O)C(=O)NNC(=O)c2c(C)nc3ccccn23)cc1Cl	763630198	XOFOWNKPNGAJEW-UHFFFAOYSA-N	431.836	1.713	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)COc3ccccc3F)cc2)C[C@H](C)O1	763679866	PTAPOEZHTBHLOI-GJZGRUSLSA-N	444.463	1.604	50	20	IDGD	
CCn1cnnc1-c1cccc(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)c1	763686802	UMOFZJCFILEIGZ-UHFFFAOYSA-N	442.863	1.783	50	20	IDGD	
Cc1cn(-c2ccccc2)nc1NC(=O)C(=O)NNC(=O)COc1ccc(Cl)cc1	763694913	LXSBSBSSEUTQQE-UHFFFAOYSA-N	427.848	1.999	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Cc2cccc(S(=O)(=O)CC)c2)c2ccccc2c1=O	763723462	PUIKRIJAUSGICA-UHFFFAOYSA-N	442.497	1.214	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)CSc2ccc(Cl)cc2)ccc1-n1cnnn1	763732525	COHAOOCODBWMNP-UHFFFAOYSA-N	445.892	1.502	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccccc1C(=O)NC(C)(C)C	763864448	JMQFBFMHQLGOFV-CYBMUJFWSA-N	444.463	1.907	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)CCCC(=O)N2	763872822	PCIBUDWOTKHKRL-LBPRGKRZSA-N	428.420	1.654	50	20	IDGD	
Cc1cc(=O)n(C)cc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1c(C)cc(Cl)cc1C	763883800	QUNQLRVUEJRZIK-CYBMUJFWSA-N	434.880	1.517	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(OC(C)C)c(OC)c2)c(F)c1	763916098	IGHUOHGENIYRNG-UHFFFAOYSA-N	447.419	1.808	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ccc(Br)s2)ccc1F	763939290	MCYGTRQNRZMAES-UHFFFAOYSA-N	444.238	1.836	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)Nc1nn(C(C)(C)C)cc1C#N	764004633	JOCUQRVZYZPWAV-UHFFFAOYSA-N	436.270	1.010	50	20	IDGD	
O=C(Cc1ccsc1)NNC(=O)C(=O)Nc1cc(Cl)ccc1C(=O)N1CCCC1	764035179	NKMPFCIUDDPUJB-UHFFFAOYSA-N	434.905	1.966	50	20	IDGD	
Cc1cc(S(C)(=O)=O)ccc1NC(=O)C(=O)NNC(=O)Cc1ccc2ccccc2c1	764084311	JMLQMAQELFUGCS-UHFFFAOYSA-N	439.493	1.880	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1cc(N2CCCC2=O)ccc1F	764131767	KSHCJNSALXBMQH-UHFFFAOYSA-N	428.420	1.290	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)c1O	764131848	SKRYDPSCXMTOAG-UHFFFAOYSA-N	440.315	1.310	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(N3CCOC3=O)cc2)o1	764139365	UJVVWRDTIXYICI-UHFFFAOYSA-N	443.460	1.478	50	20	IDGD	
C[C@@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(NC(=O)C(=O)NNC(=O)c3ccoc3)cc2)C1	764163840	MUBLUPBJTJLNJP-ZIAGYGMSSA-N	448.501	1.346	50	20	IDGD	
COc1cccc(-c2nsc(NC(=O)C(=O)NNC(=O)[C@H]3Cc4ccccc4O3)n2)c1	764167034	HRCQEEJIHAQPAI-OAHLLOKOSA-N	439.453	1.303	50	20	IDGD	
CCN1CCc2ccc(NC(=O)C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)cc21	764203779	DJEFHRHEAYYHCC-UHFFFAOYSA-N	433.509	1.460	50	20	IDGD	
CC(=O)Nc1c(C)ccc(NC(=O)C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)c1C	764204512	WUDPSMBOJYEYMW-UHFFFAOYSA-N	449.508	1.653	50	20	IDGD	
O=C(Cc1ccccn1)NNC(=O)C(=O)Nc1ccc(F)c(NC(=O)Cc2ccccc2)c1	764263979	LELXKVYIYNATLW-UHFFFAOYSA-N	449.442	1.731	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)ccc1O)C(=O)Nc1scnc1C1CC1	764280601	QEVHBBGDTAIUJJ-UHFFFAOYSA-N	425.264	1.888	50	20	IDGD	
C[C@@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)CCc3ccccc3O)cn2)C[C@@H](C)O1	764281505	YJGROXFMONGPFR-HUUCEWRRSA-N	441.488	1.120	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(N)=O)c(C)c2)cc1Br	764326919	QVKMDNXPKBOFDG-UHFFFAOYSA-N	449.261	1.265	50	20	IDGD	
Cn1cnnc1-c1cccc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c1	764351983	VFOUYEOKDRLXGN-UHFFFAOYSA-N	430.428	1.068	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(CN2CCc3ccccc32)cc1	764398403	HIWKVFDYQGWADI-MRXNPFEDSA-N	440.500	1.387	50	20	IDGD	
C[C@H](NS(=O)(=O)c1ccc(C#N)cc1)C(=O)NNC(=O)CC12CC3CC(CC(C3)C1)C2	764533811	MEGSCGOBBOCGKD-DFLMZXFUSA-N	444.557	1.979	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)NCc1ccc(N2CCCS2(=O)=O)cc1	764774252	VEMMPGFHUJZRLW-UHFFFAOYSA-N	446.529	1.698	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)CCc2cncc3ccccc23)ccc1Cl	765321824	DXDFDLBYXCKRFB-UHFFFAOYSA-N	432.889	1.929	50	20	IDGD	
COC(=O)c1ccc(C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)cn1	765755097	DRYASGNXCOXKAI-UHFFFAOYSA-N	445.907	1.100	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cnn(C)c3C(F)(F)F)CC2)cc1	766642197	OBUIGBKEVZELDO-UHFFFAOYSA-N	438.454	1.326	50	20	IDGD	
Cc1nnc(-c2ccc(C(=O)NNC(=O)CN3CCN(C(=O)c4ccccc4)CC3)cc2)o1	766651796	MOGVKKZCFMDOJY-UHFFFAOYSA-N	448.483	1.264	50	20	IDGD	
N#CCc1cccc(C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)c1	766659893	HYOFQZCIYCZZQB-UHFFFAOYSA-N	425.920	1.985	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)c1n[nH]c2c1CCCC2	766663781	NRMUTAYAXFSXPI-UHFFFAOYSA-N	430.940	1.521	50	20	IDGD	
CC(C)(C)[C@@H](Br)C(=O)OCC(=O)N1CCc2cc(S(N)(=O)=O)ccc21	766745986	KNSPAXNFAAMRFI-AWEZNQCLSA-N	433.324	1.576	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)c1nc(C)n(-c2ccc(F)cc2)n1	767274775	QNKWMRRTJFVDKX-UHFFFAOYSA-N	425.420	1.570	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)[C@@H]1CC(=O)N(c2ccc3c(c2)CCC3)C1	767279255	QDWCIRMRFQRCSU-HXUWFJFHSA-N	449.507	1.770	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)c2csc(-c3ncccc3F)n2)c1	768662216	VDAKBWNYIDNCPN-UHFFFAOYSA-N	425.401	1.834	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2c(C)cnn2Cc2ccccc2F)cc1	769268416	ZSDLMXUAHCDYQS-UHFFFAOYSA-N	439.447	1.852	50	20	IDGD	
CO[C@@H](c1ccc(F)cc1)[C@H](C)NC(=O)NNC(=O)c1csc(N2CCOCC2)n1	770754934	YBAUPZXFXKLCDP-BLLLJJGKSA-N	437.497	1.839	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCC2CCN(c3ccncc3)CC2)cc(OC)c1OC	771902762	DBBRRZMGKSNRQT-UHFFFAOYSA-N	443.504	1.968	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCCNC(=O)NNC(=O)c2cccc3ncccc23)s1	772630334	JTHBSIIAPQZINT-UHFFFAOYSA-N	433.515	1.527	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)[C@H](CC)N2CCO[C@@H](CC)C2)c2ccccc2c1=O	773714892	YKAYSVAHOVXJJO-YJBOKZPZSA-N	429.521	1.457	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)c(Cl)n1	774009508	QKHMNAFNZBBZET-VIFPVBQESA-N	427.244	1.950	50	20	IDGD	
CCO[C@@H]1C[C@H](NC(=O)NNC(=O)c2nnc(O)c3ccccc23)[C@@H]1Oc1ccccc1	776535720	WZCAMDXAJIQIOV-SCTDSRPQSA-N	437.456	1.904	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)nn1[C@H](C)C1CC1	777418660	AQIUJKNLRIVXNT-QGZVFWFLSA-N	438.532	1.382	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Cc2cccc(COC)c2)c1	777766432	LCZIWKHVFYTEBY-UHFFFAOYSA-N	433.530	1.867	50	20	IDGD	
Nc1nc(Cl)cc(NNC(=O)CNC(=O)c2ccccc2I)n1	779375572	ZBIAPISCQQVJIV-UHFFFAOYSA-N	446.636	1.190	50	20	IDGD	
Cn1c(=NNC(=O)C(=O)Nc2ccc(C(=O)N3CCOCC3)cc2)sc2ccccc21	783351729	IGKVDHQOTTUUJQ-UHFFFAOYSA-N	439.497	1.283	50	20	IDGD	
O=C1CCc2cc(NC(=O)C(=O)NNc3ccc(S(=O)(=O)NC4CC4)cc3)ccc2N1	784214342	WCQSZZBXJPXYCE-UHFFFAOYSA-N	443.485	1.094	50	20	IDGD	
CCCc1nc(C)c(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)s1	784218126	ZSXDYFHRXJGNEX-UHFFFAOYSA-N	437.547	1.927	50	20	IDGD	
COCC(=O)N1CCc2cc(NC(=O)C(=O)NNc3ccc(Br)nc3)ccc21	784807196	WIQVKVKRBSRSSY-UHFFFAOYSA-N	448.277	1.461	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNc2ccc(Br)nc2)cc1	784809773	ARQMTYQGKSPQBS-UHFFFAOYSA-N	442.295	1.688	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CC(=O)NNC(=O)c1csc(N2CCOCC2)n1)C1CC1	785022462	RPUGMBJQVBDCFI-ZDUSSCGKSA-N	439.538	1.434	50	20	IDGD	
COc1cc2nc(C)sc2cc1NC(=O)C(=O)NNC(=O)Cc1cn2ccccc2n1	785068591	XUWRWKJJAACLID-UHFFFAOYSA-N	438.469	1.590	50	20	IDGD	
CCc1ccc(NC(=O)C(=O)NNc2nc(C(F)(F)F)cs2)cc1S(N)(=O)=O	785147303	CWNXJDKQUZTRFL-UHFFFAOYSA-N	437.425	1.454	50	20	IDGD	
CN(C)NC(=O)Nc1cccc(NS(=O)(=O)c2ccccc2S(=O)(=O)N(C)C)c1	788093088	HQURHIGKZAWEJE-UHFFFAOYSA-N	441.535	1.336	50	20	IDGD	
NC(=O)c1cc2c(nc1O)CCCC2=NNC(=O)CCN1CCN(c2ccccc2)CC1	788949962	BRYKGXQILMZHGK-UHFFFAOYSA-N	436.516	1.255	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(C(N)=O)c(OC(C)C)c2)c2ccccc2n1	789732693	UAYTZQWSRSFQOO-UHFFFAOYSA-N	449.467	1.829	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2ncn(Cc3ncc(C)c(OC)c3C)n2)cc1	789747746	ZCPKFDOAVUNGOM-UHFFFAOYSA-N	425.449	1.437	50	20	IDGD	
CC(C)(C)[C@@H]1CCc2nc(NC(=O)C(=O)NNC(=O)CNC(=O)c3ccco3)sc2C1	789756419	DIOLDRLNRFNRRR-LLVKDONJSA-N	447.517	1.403	50	20	IDGD	
COc1cc(OC)c(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)cc1F	789821409	SVQSWBDJUHLVLC-UGSOOPFHSA-N	431.420	1.502	50	20	IDGD	
O=C1C[C@H](Cc2ccc(NC(=O)C(=O)NNc3cccc(F)c3[N+](=O)[O-])cc2)C(=O)N1	790999146	YNRPGXWOGZXKTC-NSHDSACASA-N	429.364	1.021	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)C2=C(C)N(C)c3ncnn3[C@@H]2C)cc1C	791462884	IYLLUTOAIAHGLN-GFCCVEGCSA-N	432.506	1.500	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2cc(Br)ccc2O1)c1ccc(-n2cnnn2)cc1	792030499	NORUJVDFGWVZEZ-HNNXBMFYSA-N	429.234	1.190	50	20	IDGD	
C[C@@](O)(CN1C(=O)NC2(CCCC2)C1=O)C(=O)NNc1ccc(Br)c(F)c1	793838557	LTWUQYDWKSZRRJ-MRXNPFEDSA-N	443.273	1.647	50	20	IDGD	
CCC(=O)c1ccc(Cl)c(S(=O)(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c1	794575865	AWAZKOVEMDZFSO-UHFFFAOYSA-N	434.865	1.532	50	20	IDGD	
CNC(=O)COc1ccc(NC(=O)C(=O)NNc2ccc(Br)cn2)c(C)c1	797068331	WJFFWLJEGKSHDI-UHFFFAOYSA-N	436.266	1.359	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCc2ccc3[nH]ccc3c2)c1	799715108	BWSPIPWIBOTQIW-UHFFFAOYSA-N	429.502	1.605	50	20	IDGD	
Cc1ccc(-n2ncc(C(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)c2C(F)(F)F)cc1	800520598	GDGVCHYILRWNRP-NSHDSACASA-N	430.408	1.395	50	20	IDGD	
NC(=O)c1ccc(SCC(=O)NNC(=O)Nc2cc(F)cc(F)c2)c([N+](=O)[O-])c1	802003868	YIASXZKKXRRRGO-UHFFFAOYSA-N	425.373	1.917	50	20	IDGD	
O=C(CCn1c(S)nc2ccccc2c1=O)NNC(=O)Nc1ccc2c(c1)OCO2	802095411	CLWKQOCYZAYPHX-UHFFFAOYSA-N	427.442	1.657	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)N[C@@H]1CCN(C(=O)COc2ccccc2)C1	802468470	RJVVCLJHRFWGDQ-OAHLLOKOSA-N	427.417	1.219	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)c1cccc(NN2C(=O)[C@@H]3CC=CC[C@H]3C2=O)c1	802490862	YKYNPEJLGCMIND-RTBURBONSA-N	448.479	1.977	50	20	IDGD	
Cc1nc2c3cccnc3nn2c(C)c1CCC(=O)OCC(=O)NNC(=O)c1ccccc1	803762100	ZYQXFBNCGUIFHI-UHFFFAOYSA-N	446.467	1.831	50	20	IDGD	
CCC[C@@H](NC(=O)NCc1ccc(F)cc1)C(=O)NNc1ccc(-n2ccnc2)nn1	804950802	FPTLSUSZDATUQK-MRXNPFEDSA-N	426.456	1.913	50	20	IDGD	
CC[C@H](NC(=O)NNc1ccc(-n2ccnc2)nn1)[C@H]1CN(Cc2ccccc2)CCO1	805203702	QOUBMNNYQZQZKC-RBUKOAKNSA-N	436.520	1.968	50	20	IDGD	
CCN(C)C(=O)c1cccc(NC(=O)C(=O)NNC(=O)CCc2ccc(OC)cc2)c1	806977377	GPEKOOSAECLBKX-UHFFFAOYSA-N	426.473	1.506	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)c1ccc(OC)c(I)c1	807369835	MBBSCHDEBGHYAF-UHFFFAOYSA-N	436.246	1.850	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2cc(C(=O)NNC(=O)N3CCN(C)CC3)ccc2C)cc1	807380125	PQGIKMUCZUZMEY-UHFFFAOYSA-N	445.545	1.706	50	20	IDGD	
CN1CCN(C(=O)NNC(=O)Cn2cnc3sc(-c4ccccc4)cc3c2=O)CC1	807382572	GQPUYSBUBXVZLD-UHFFFAOYSA-N	426.502	1.113	50	20	IDGD	
CC(C)(C)c1cc(NC(=O)C(=O)NNc2ccc(-n3ccnc3)nn2)n(-c2ccccn2)n1	807429069	OQVSULYQYXTDHD-UHFFFAOYSA-N	446.475	1.622	50	20	IDGD	
O=C(NCCCn1cc(Br)cn1)NNC(=O)c1nn(-c2ccccc2)cc1O	807610565	AOKWLTQNLBOFFR-UHFFFAOYSA-N	448.281	1.571	50	20	IDGD	
CCN(C)C(=O)c1cccc(S(=O)(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)c1	808070049	IDMFAHCEBMBJCK-UHFFFAOYSA-N	432.502	1.344	50	20	IDGD	
COc1cc(Cl)c(NC(=O)C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1C	808934691	QTKDYVJVOKUMIY-UHFFFAOYSA-N	439.877	1.460	50	20	IDGD	
Cc1cc(O)nc2cc(C(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)ccc12	809540997	BYWWHIXNPLSOCV-UHFFFAOYSA-N	428.470	1.574	50	20	IDGD	
Cc1cc(C)c(C)c(S(=O)(=O)NCC(=O)NNC(=O)Cc2cn3ccccc3n2)c1C	810465745	PCUNAESESZTCRN-UHFFFAOYSA-N	443.529	1.236	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)NCC(=O)NNc2ccc([N+](=O)[O-])cc2Cl)cc1	810686365	DJHDPEGURVZBHN-UHFFFAOYSA-N	441.853	1.628	50	20	IDGD	
Cc1ccc([C@@H](CN2CCOCC2)NC(=O)NNC(=O)COc2ccccc2F)cc1	813493442	APJSTKIEOBUNSI-LJQANCHMSA-N	430.480	1.917	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCc2nncn2C1)c1nc(-c2ccccc2)n(-c2ccccc2)n1	814217303	AVMZBCDCWHHVED-MRXNPFEDSA-N	428.456	1.549	50	20	IDGD	
COC(=O)c1cnn(C)c1NC(=O)C(=O)NNC(=O)c1ccc(-c2ccc(F)cc2)s1	815567074	NPBAHKCUEJEGFB-UHFFFAOYSA-N	445.432	1.474	50	20	IDGD	
COCc1cc(NC(=O)C(=O)NNc2ccc(S(C)(=O)=O)cc2)cc(C(=O)OC)c1	815585187	ALUQWHIZOAHRCJ-UHFFFAOYSA-N	435.458	1.105	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2c(I)cnn2C)c2ccccc2n1	816560752	ZEDJUBUPIRPTEW-UHFFFAOYSA-N	435.225	1.956	50	20	IDGD	
Cc1noc(C)c1S(=O)(=O)N1CCC(C(=O)NNc2nc3ccccc3n2C)CC1	816577288	FLAXCUQUQQJSTP-UHFFFAOYSA-N	432.506	1.722	50	20	IDGD	
C[C@H](Oc1ccc(Cl)cc1Br)C(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1	893188152	OUYSHLVKISLCFZ-IUCAKERBSA-N	439.715	1.452	50	20	IDGD	
O=C(CN1CCCN(C(=O)c2cccc(F)c2)CC1)NNC(=O)c1ccc([N+](=O)[O-])cc1	913203800	NSBHXCABJFGFNS-UHFFFAOYSA-N	443.435	1.343	50	20	IDGD	
Cc1ccc(C)c(S(=O)(=O)Nc2ccccc2C(=O)NNC(=O)CN2CCCC2=O)c1	914831482	ZPWPENKOTZNCLB-UHFFFAOYSA-N	444.513	1.488	50	20	IDGD	
CS(=O)(=O)CC[C@H](NC(=O)c1ccc(Cl)cc1)C(=O)NNC(=O)C1CCCC1	914849321	VXSGLJPCMKXPQK-HNNXBMFYSA-N	429.926	1.211	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cnn(-c3ccc(Cl)cc3)c2)c1	916093878	BAZJSVHPSSODJT-UHFFFAOYSA-N	447.904	1.851	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)NCc1ccccc1OCC(=O)NC[C@@H]1CCCO1	918217353	HLFZSOYIAKQXKQ-SFHVURJKSA-N	440.500	1.813	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)n1	918220207	IDEQZQALWFJKHV-IYBDPMFKSA-N	432.500	1.783	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)[C@H](C)NC(=O)C2CCCCC2)c2ccccc2c1=O	918409359	LGDHIAAWPILAFG-AWEZNQCLSA-N	427.505	1.823	50	20	IDGD	
O=C(NNC(=O)[C@H]1CC(c2ccc(Cl)cc2Cl)=NO1)N[C@H]1CCS(=O)(=O)C1	919883658	BVOSPUYNAJZYNY-TVQRCGJNSA-N	435.289	1.004	50	20	IDGD	
CCn1cnc2c1c(=O)n(CC(=O)NN=C/C=C/c1ccco1)c(=O)n2Cc1ccccc1	920369644	XYPQPDQGYZERSC-SBIXABTGSA-N	446.467	1.836	50	20	IDGD	
CCS(=O)(=O)Nc1cc(OC)ccc1S(=O)(=O)NNC(=O)c1ccccc1Cl	1319656398	OOJFCROCIPUSAS-UHFFFAOYSA-N	447.922	1.734	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Cl)C2	1778090954	IVTRKARLUQEXTC-RHJVYHOCSA-N	441.891	1.169	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc3[nH]ccc3n2)C1	1779000685	HVYKDJBJSFYPEZ-CFCCAZDESA-N	434.924	1.944	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)c3ccccc3Cl)CCO2)C1	1779032624	OYZIIGOYVQSINH-OAQYLSRUSA-N	443.891	1.096	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cn3ccsc3n2)C1	1779093333	VZJBQLGJZVEKNP-ZBQZNYHESA-N	440.953	1.777	50	20	IDGD	
Cc1nccnc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Br)C1	1780773712	MUEGCAMBOOZXTC-HACGYAERSA-N	429.290	1.603	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(CCN(C(=O)[C@@H]3CC[C@H]4CCC(=O)N4C3)C2)C1	1781055620	AIMILPTVJHPMHQ-LLGFUMIMSA-N	437.613	1.069	50	20	IDGD	
O=C(Cc1cccnc1Cl)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781325689	HMKNDBMXHZIWKM-BBRMVZONSA-N	434.693	1.798	50	20	IDGD	
O=C(c1ccn2ccnc2c1)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781332517	ZYZIWXGLBMDVRJ-YOEHRIQHSA-N	425.258	1.468	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1c(C)nc3ncccn13)C2	1782173153	ZAHRULQGQBJBQI-WHSLLNHNSA-N	449.939	1.419	50	20	IDGD	
COCCn1nccc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C(Cl)Cl)C1	1782217485	MIDIHGZPZJAUJN-RDTXWAMCSA-N	433.336	1.461	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(CCN(C(=O)c3cccc4c3NC(=O)C4)C2)C1	1782412505	GJJNBHKABGPTCE-NRFANRHFSA-N	431.565	1.476	50	20	IDGD	
O=C(C(Cl)Cl)N1CCO[C@]2(CCN(C(=O)[C@@H]3CC(c4ccccc4)=NN3)C2)C1	1782608998	WTGKERAMMNKDNW-KXBFYZLASA-N	425.316	1.386	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](O)Cc1ccccc1)CCO2	1783355847	YILOJXLBDHFEER-QKLQHJQFSA-N	439.350	1.593	50	20	IDGD	
COc1ccc(F)cc1CC(=O)N1CCO[C@]2(CCN(C(=O)[C@H](C)Br)C2)C1	1783540328	UEFIWPYBPFPEPM-ORAYPTAESA-N	443.313	1.990	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc4c(c3)NC(=O)CC4)CCO2)C1	1783880782	GNZAPWAYNGRBAA-KKSFZXQISA-N	435.908	1.269	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc1Cl	1783933316	UQNLDHNCHHBQDZ-NRFANRHFSA-N	436.940	1.465	50	20	IDGD	
COc1ncccc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]2C1	1783968538	WQFHVGZCAIORPV-SDADXPQNSA-N	440.338	1.715	50	20	IDGD	
C[C@H](Sc1ccccn1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]2C1	1784096266	VARZOQCAZNXXNM-GVRJEKJASA-N	427.954	1.142	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=N/O[C@@H]3CCCCO3)C[C@@H]21	1784618433	ZVSAXVZOXKTWCK-VROHHENTSA-N	429.945	1.903	50	20	IDGD	
O=C(Cc1cc([N+](=O)[O-])ccc1F)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Cl)C[C@@H]21	1785004160	XRFJFBDBFPKAJQ-CDUAKIRFSA-N	431.823	1.791	50	20	IDGD	
O=C(COc1cccc2ccccc12)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21	1785010117	LENAYMMJWKSWAL-WBKMXMRLSA-N	446.931	1.798	50	20	IDGD	
O=C1CC(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](Br)Cc2ccccc2)CCO3)C1	1785409003	FLRFVDJACXXJRB-NQIIRXRSSA-N	449.345	1.802	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccnc(C(F)F)c3)[C@H]2C1	1785526437	JKJIVJIACDEFCO-AYDFFVQHSA-N	431.867	1.866	50	20	IDGD	
N[C@H](C(=O)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1)c1ccccn1	1788040708	QYIXXLDIVVGFJM-NRFANRHFSA-N	444.300	1.209	50	20	IDGD	
CC(C)c1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Br)C[C@@H]32)n[nH]1	1789323628	JIIYGGDZVSASGU-LWWSYDQCSA-N	431.306	1.817	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3c[nH]c4ncccc34)C[C@@H]21)[C@H](F)Br	1789922412	FGDZQZSIBPTTDK-HJPIBITLSA-N	439.285	1.847	50	20	IDGD	
Cc1nccn1CCCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]2C1	1789927001	NKEHSVIELYEHRC-QBYUYEEZSA-N	445.333	1.642	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)c1cc(O)ccc1F	1790053792	MKNXTYIHCMQKPG-HLHNXRDNSA-N	433.249	1.815	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)COc3cccnc3)C[C@@H]21	1790958344	PTTLACYBGFCUDY-LLLHUVSDSA-N	440.338	1.614	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cn4cccnc4n3)C[C@@H]21	1791056099	NTSHVALHPGCVKL-ABHRYQDASA-N	436.310	1.106	50	20	IDGD	
CN(CC(=O)Nc1ccc(C2(NC(=O)CO[Si](C)(C)C)CCC2)cc1)C(=O)C(=O)O	1791097939	SYHPJUNAPAQCDI-UHFFFAOYSA-N	435.553	1.515	50	20	IDGD	
COc1ccc(/C=C/C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](O)CCl)C[C@@H]32)c(F)c1	1791129000	NFNCZWBZLFWFRB-SMFIWNGZSA-N	440.899	1.427	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(Cl)nc(OC)c3)C[C@@H]21	1791255287	JQPUFZKJIRZEEF-MXAVVETBSA-N	446.331	1.591	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(F)c(F)cc3F)C[C@@H]21	1791256503	AEOADRISIRUZMU-AKENFEQQSA-N	434.842	1.951	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1ccc(C2(NC(=O)[C@H](O)N3CCOCC3)CCC2)cc1	1791435054	PPUOXFDEERNRNY-ACJLOTCBSA-N	440.338	1.555	50	20	IDGD	
O=C([C@@H](O)CCl)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3CC[C@H](C(F)(F)F)CC3)[C@H]2C1	1792149745	XUVKAKJHSJMXCK-QNILMXGZSA-N	440.890	1.935	50	20	IDGD	
Cc1nn(C)c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)CBr)c1F	1792869856	BVMZOVDVSDZDGJ-ZKCLLBTKSA-N	431.306	1.102	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CCc2ccccc2[C@@H]1O	1793039073	ZXVBRWLNUQUWKO-KOLYYURTSA-N	446.620	1.724	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@@H](C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](O)CCl)C3)C[C@H]2C[C@H]21	1793129124	KCPJBXKFWXFARO-JIYOGZPKSA-N	441.956	1.622	50	20	IDGD	
Cc1ncc(Br)cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2	1794317444	ZLOXNPKDJWOFPC-RDBQEKCUSA-N	434.693	1.890	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CC(c3ccccc3)=NN1)C2	1795116634	ZWIVTMOVXBELBC-HIRMHNASSA-N	449.349	1.127	50	20	IDGD	
CO[C@@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1ccccc1	1795168760	FALNUKURDVIKPS-YIDVYQOGSA-N	429.286	1.654	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCc1ccc2c(c1)OCO2	1795321757	WGMFHCDDEAEAAP-QOIOWGMHSA-N	438.908	1.191	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(Br)ncc1F)C2)[C@@H](F)Cl	1796365125	QMGPJAHRHHZQNT-PTYMLPSESA-N	438.656	1.721	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCc1cnn(C)c1)C2	1796892148	LJCFYXZRKWQHHZ-DHMPJCMBSA-N	439.520	1.125	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H]1CCCN1C(C)C)C2	1796893199	QQJUKVVCUAHVLI-NVQWDPAISA-N	442.564	1.631	50	20	IDGD	
COc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)CBr)C3)ccn1	1798120294	IGMDEDQTDGHFNX-ZIEJDFEHSA-N	426.311	1.324	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2n(n1)CCC2	1798177336	VFYOLCLXRLKAQA-YVLAOCGESA-N	437.504	1.215	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@](C)(Cl)CCl)C1	1799278421	GAXMZPNTTSDWMR-BVWVXVDMSA-N	449.375	1.792	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nnsc1C1CC1)C2)[C@H](F)Br	1799347329	MDFQCSOAWZKRDB-WJZNIJOASA-N	433.303	1.309	50	20	IDGD	
N#Cc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](O)CCl)C3)cc(C(F)(F)F)c1	1799783898	ICEFPMVXGXTQSN-XRGAULLZSA-N	445.825	1.380	50	20	IDGD	
CCC1(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)/C(C#N)=C/c2ccc(F)cc2F)C3)COC1	1800388283	XLOMXCVPJVAOCP-GKEMIQDWSA-N	445.466	1.888	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCC(=O)N1CCCC1)C2	1800640444	YGPNMAYJCOTYCZ-BASYENTBSA-N	444.370	1.152	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CCC[C@H]3CCCC[C@H]31)C2	1801011451	MAVGCRMVFCLXKB-PEBBSFMPSA-N	448.608	1.556	50	20	IDGD	
C[C@@H](C#N)c1cccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CCC(=O)NN(C)C)C3)c1	1803683252	ABMKNLAGIAFKTF-QLIIJSOBSA-N	425.533	1.938	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)Cc2ncccn2)[C@@H]1c1cccnc1	1804692917	CTZRQRGJBGMEGS-JOQOYGCGSA-N	432.322	1.904	50	20	IDGD	
C=CCSCC(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1807363395	OMCSKFFSWUFWOQ-RXVVDRJESA-N	439.346	1.000	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)Cn2ccccc2=O)[C@H]1c1cccnc1	1807441181	FJEILYUBPISCEG-ZSZQSSIHSA-N	447.333	1.733	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@H]1CCN(C(=O)CN2CCNC2=N)[C@@H]1c1cccnc1	1808295857	MTFOMMLMLLDWFJ-OGWOLHLISA-N	441.363	1.164	50	20	IDGD	
CN1C(=O)CC[C@H]1C(=O)N1CC[C@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]1c1cccnc1	1808306115	ZBCMFELKYCWCJA-DOHHPOSVSA-N	441.359	1.945	50	20	IDGD	
COc1cc(C(=O)N2CC[C@H](CNC(=O)CO[Si](C)(C)C)[C@@H]2c2cccnc2)nn1C	1810543707	DUXYDFZINYVBRD-UZLBHIALSA-N	445.596	1.995	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2ccc(F)nc2)[C@@H]1c1cccnc1	1810700906	IYJDBKOOQRDOBY-KKSFZXQISA-N	442.495	1.308	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@H]1CCc2nc(NC(=O)CCN(C)C)sc2C1	1814543352	PKGZRLOCHQRXSK-XIXVAHAYSA-N	445.549	1.141	50	20	IDGD	
C[C@@H](CS(C)(=O)=O)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CO[Si](C)(C)C)[nH]n1	1815229396	GZDDNUSDVRCETH-ZFWWWQNUSA-N	444.630	1.934	50	20	IDGD	
O=C(/C=C/c1ccoc1)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1	1815337278	QLVNQAJYWWYHIE-DAILVRCLSA-N	437.286	1.355	50	20	IDGD	
Cc1ncc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)[nH]n2)cn1	1816289186	HMEYULRQRWCZGM-KRWDZBQOSA-N	449.475	1.126	50	20	IDGD	
CNC(=S)NCCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)C(C)(C)CCl)CC2	1819801479	MRMBXXVKPBKNCU-SNVBAGLBSA-N	432.015	1.804	50	20	IDGD	
CC[C@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CS(=O)(=O)N2CCCC2)[nH]n1	1820857231	QWJQNCDSFMWSOV-DZGCQCFKSA-N	445.973	1.845	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)CCN2CCOC2=O)[nH]n1)[C@H](F)Br	1820933103	AEKJAUWGSHMGJV-FZMZJTMJSA-N	446.277	1.935	50	20	IDGD	
O=C(CCBr)N[C@H]1CCc2nc(NC(=O)c3c[nH]c(=O)cn3)sc2C1	1821466191	UPWRKFAZYJWLQP-QMMMGPOBSA-N	426.296	1.237	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)C[C@H]2CCCCO2)[nH]n1	1822410687	PKWKZMOKCRZOSD-NVXWUHKLSA-N	434.541	1.734	50	20	IDGD	
CN1CCCC[C@H]1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1	1824204004	WQMGEYQGOYKNAV-YADHBBJMSA-N	441.381	1.084	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H]1CCC(=O)NC1)CC2	1825631172	CSGYLWMZKUNOHF-GUBZILKMSA-N	429.340	1.365	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)c2ccccc2O)CC1	1825662331	GOKNPAOOIXWEGN-OAQYLSRUSA-N	436.317	1.619	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1c(C)nc3ncccn13)CC2	1826000625	YRSGEHHVOFTSLE-NWDGAFQWSA-N	448.936	1.974	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cccnc1S)CC2	1826081022	MAJNQGYQGHNIPR-LLVKDONJSA-N	448.574	1.426	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(C#N)c1)CC2	1826089058	XUSODISCCPGHGT-HNNXBMFYSA-N	440.529	1.614	50	20	IDGD	
CCn1nccc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1	1826101960	LYONEDPIJHRTFH-GOSISDBHSA-N	432.569	1.509	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)c2cncs2)CC1	1826131756	DISJSWZUURMOBV-GOSISDBHSA-N	427.335	1.370	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)CCN2CCCCC2)CC1	1826545402	JNARGSNSPPFJAT-NRFANRHFSA-N	449.640	1.855	50	20	IDGD	
O=C(CC(F)(F)F)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827055318	XOHOOMMXSHSUMX-QGZVFWFLSA-N	426.244	1.552	50	20	IDGD	
CC(=O)C[C@H](C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827055437	WBPPNWQQRLSNNI-KKSFZXQISA-N	428.338	1.215	50	20	IDGD	
C/C=C/C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCN2C(=O)OCc1ccccc1	1828551316	MOAASXBKTIZFLO-VWPBMBFCSA-N	449.935	1.614	50	20	IDGD	
CCOC(=O)N[C@H](O)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H](C)Br)CC1	1828763085	JPGVAVREOZFKRG-BPLDGKMQSA-N	448.358	1.454	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCCC[C@H]1C1CCN(C(=O)CN2C(=O)CNC2=O)CC1	1829099774	NHRWYRAWEGNGPW-INIZCTEOSA-N	438.601	1.009	50	20	IDGD	
O=C(c1cc(-c2ccccc2)on1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1829590173	DVWMDJYNEARHPQ-PXNSSMCTSA-N	437.855	1.946	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)COc3ccc(OC)cc3)CCO2)C1	1830243454	CIHCKBUIFHYVIS-GHTZIAJQSA-N	440.924	1.548	50	20	IDGD	
O=C1C[C@H](C(=O)N2CCC([C@@H]3CCCCN3C(=O)[C@@H](F)Br)CC2)CCN1	1830381748	MUWRPDJBCMARLZ-IJEWVQPXSA-N	432.334	1.823	50	20	IDGD	
Cc1c[nH]c(C)c1CCC(=O)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1830904061	PGQQUISNYAPHNH-LJQANCHMSA-N	432.348	1.824	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)CCc2ccc(O)nn2)CC1	1831087381	BGPOQVJPAPJVDU-ZWKOTPCHSA-N	438.956	1.988	50	20	IDGD	
COCCOCCOCCC(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H](O)CCl)CC1	1831722012	NWYIRBRUIXPADY-OALUTQOASA-N	448.988	1.276	50	20	IDGD	
Cc1csc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)c1	1831782010	ICCIEEIJSGBNJZ-CXAGYDPISA-N	431.352	1.910	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(O)n3)CCO2)C1	1834193696	YGROLTGXTYZMDZ-QZTJIDSGSA-N	432.304	1.094	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCC(N2CCC(NC(=O)Cn3ccnc3)CC2)CC1	1834266695	BTQUDXHDOSFFBM-LJQANCHMSA-N	430.380	1.691	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)CCBr)CCO2)C1	1834819797	WHVXIKIIFAXNQZ-INIZCTEOSA-N	425.751	1.493	50	20	IDGD	
C=CC[C@H](C(=C)C)C(=O)N1CCOC[C@]2(CN(C(=O)CCBr)CCO2)C1	1834823421	UDVJQBXJPTZCLP-APWZRJJASA-N	429.355	1.996	50	20	IDGD	
Cc1cc(NC(=O)CC(=O)N2CCC(N3CCC(NC(=O)[C@@H](F)Cl)CC3)CC2)no1	1835079885	ZPBINNIQGHPPNG-GOSISDBHSA-N	443.907	1.418	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)CN3CCCCC3)CCO2)C1	1835378021	LHCMGRPMSALCEP-OALUTQOASA-N	436.380	1.165	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cc4ncccn4n3)CC2)CC1	1835543166	QKPYAPIODQSSLM-QGZVFWFLSA-N	448.955	1.168	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](F)Cl)CC3)CC2)o1	1835735902	FIIYRCHFZANNKA-QGZVFWFLSA-N	428.892	1.958	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3ccn(C(F)F)n3)CC2)CC1	1835955272	KBCRKYPCFJGKKT-HNNXBMFYSA-N	447.914	1.717	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)CCc3ccc(O)nn3)CC2)CC1	1836397569	IURIJZAUXUQBGC-GOSISDBHSA-N	437.972	1.704	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cn4ccsc4n3)CCO2)C1	1837049123	PSZMBTZWOAYKKT-UGSOOPFHSA-N	426.926	1.483	50	20	IDGD	
CN1CCC(CC(=O)N2CCOC[C@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)CC1	1837708867	QQWBHSAPIYNRIU-OAQYLSRUSA-N	441.645	1.026	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)C[C@H]3CCCCO3)C2)C1	1837709936	BBRSAMGPPIULQA-YLJYHZDGSA-N	428.602	1.254	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@H](COC)NC(C)=O)CC2)CC1	1838435054	MNZHAHGEYAETTJ-ROUUACIJSA-N	431.961	1.154	50	20	IDGD	
O=C(c1ccc(O)cc1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1838971067	AIDSTTORIPBWCR-WMLDXEAASA-N	431.258	1.153	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)C3CCC4(CC3)OCCO4)C2)C1	1839147841	DSVPHPCPWRNIOB-PXNSSMCTSA-N	444.956	1.394	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccc(F)cc3OC)C2)C1	1839149319	BQAWIHJVEFIKMP-DYESRHJHSA-N	442.915	1.851	50	20	IDGD	
Cc1onc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)c1C	1839150343	JQZUFFXHEJQWCE-ZWKOTPCHSA-N	434.320	1.598	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(F)nc3)C2)C1	1839153913	VTAUNVSHIFEDHT-ZWKOTPCHSA-N	434.295	1.527	50	20	IDGD	
COc1ccc(Cl)cc1CC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1839790150	JSFFATJMGNKZMH-MJGOQNOKSA-N	449.306	1.882	50	20	IDGD	
CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](Br)Cc1ccccc1)CCO2	1839801795	CYGTUPFFYSNVGC-PKOBYXMFSA-N	425.323	1.469	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3ccc(C)cn3)C2)C1	1840150384	KIWMGCYRXJAHPZ-RXVVDRJESA-N	439.940	1.033	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccc(C)c(C)c3)C2)C1	1840150960	URGZLFHZQVDFMY-KNQAVFIVSA-N	438.952	1.556	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(F)cc3F)C2)C1	1840153912	FPDLLKZLYSVIFR-KXBFYZLASA-N	432.851	1.289	50	20	IDGD	
C=CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1	1840174359	YRHHOYPBNUBMJJ-NRFANRHFSA-N	447.444	1.166	50	20	IDGD	
Cc1ncc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)s1	1840399625	DVFABIWAEKEDTE-IBGZPJMESA-N	441.626	1.302	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](C(=O)N2CCCC23CN(C(=O)[C@H](F)Cl)C3)[C@@H](O)C1	1841026107	VRLPXBPFLSAGKA-IHRRRGAJSA-N	433.908	1.342	50	20	IDGD	
Cn1c(C(=O)N2CC3(CCCN3C(=O)[C@@H](O)CCl)C2)cc2c1-c1ncccc1OC2	1841350645	PKWMYDXMCKZKPR-HNNXBMFYSA-N	430.892	1.396	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCCC12CN(C(=O)Cc1ncccn1)C2	1841924257	PEPJLPNVOJQXMB-AWEZNQCLSA-N	437.928	1.355	50	20	IDGD	
Cc1ccc2nc(C(=O)N3CC4(CCCN4C(=O)c4cccc(B(O)O)c4)C3)sc2c1	1843013591	ZMXWJZXFVWIJPS-UHFFFAOYSA-N	435.314	1.415	50	20	IDGD	
C[C@@H](NC(=O)c1ccc(F)cc1)C(=O)N1CCCC12CN(C(=O)CCBr)C2	1845002200	DXNMDJWIXLTPAH-CYBMUJFWSA-N	440.313	1.932	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](O)[C@](C)(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](F)Cl)C1	1847238179	VZFYSHDYIIHAGK-ZSORPBTDSA-N	447.935	1.731	50	20	IDGD	
CC[C@@H](NC(C)=O)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1847295658	IWPIVMWHURASAZ-UGUYLWEFSA-N	444.960	1.235	50	20	IDGD	
CC(=O)N[C@@H](CC(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1)c1cccs1	10414789	UIWVAXXPZPZSHJ-LBPRGKRZSA-N	444.922	1.077	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)c2ccc(S(=O)(=O)N(C)C3CCCCC3)cc2)n1	12666879	UVRRLXZGTALTTM-UHFFFAOYSA-N	447.561	1.914	50	20	IDGD	
O=C(CNC1=NS(=O)(=O)c2ccccc21)NNC(=O)CC12CC3CC(CC(C3)C1)C2	17185727	AZNVFPGQBGZQRZ-UHFFFAOYSA-N	430.530	1.479	50	20	IDGD	
O=C(CCCCCNS(=O)(=O)c1ccc2c(c1)OCCO2)NNC(=O)c1ccccn1	17329464	CHLZNWUAFLOMLW-UHFFFAOYSA-N	448.501	1.153	50	20	IDGD	
O=C(CCNS(=O)(=O)/C=C/c1ccccc1)NNC(=S)NCCc1cccs1	21125658	YNNUPQXLWIMXLS-GXDHUFHOSA-N	438.600	1.766	50	20	IDGD	
CCn1c(=O)c2ccccc2n(CC(=O)NNC(=O)c2cc3c(s2)CC[C@@H](C)C3)c1=O	27331624	QEXZUTJTRRTZQY-CYBMUJFWSA-N	440.525	1.831	50	20	IDGD	
O=C(CCN1C(=O)c2ccccc2C1=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	726867386	IRQGEOMBTUMSHV-UHFFFAOYSA-N	428.470	1.257	50	20	IDGD	
COCCn1cc(NC(=O)NNC(=O)c2nn(CCC(C)C)c(=O)c3ccccc23)cn1	726875254	SHKNQOFRTZBZOD-UHFFFAOYSA-N	441.492	1.752	50	20	IDGD	
CNS(=O)(=O)c1cccc([C@@H](C)NC(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)c1	727608611	BHUVWCYTAFLUHJ-CHWSQXEVSA-N	438.481	1.593	50	20	IDGD	
CNC(=O)NNC(=O)c1cc(I)ccc1I	727673869	YPUJSSCZLIREGJ-UHFFFAOYSA-N	444.998	1.470	50	20	IDGD	
O=C(COC(=O)c1ccc(-c2ccccc2)nc1O)NNC(=O)[C@H]1COc2ccccc2O1	728327428	KSFUUHVFPKZTQV-LJQANCHMSA-N	449.419	1.598	50	20	IDGD	
Cc1noc(C)c1CSc1ccccc1C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O	729274879	GKQVDQYXXPISKB-NSHDSACASA-N	426.520	1.282	50	20	IDGD	
CC(C)N1CCC[C@@H](CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)C1	729618355	BTBILPORWYIJJC-HNNXBMFYSA-N	425.555	1.001	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)[C@@H]2CS[C@@H](Cc3ccccc3F)C(=O)N2)cn1	729691984	GULIDHUIXGRTPJ-GJZGRUSLSA-N	449.533	1.390	50	20	IDGD	
CNC(=O)C1(C(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)CCC1	729965856	QBANNPJBTJSVGP-UHFFFAOYSA-N	433.472	1.066	50	20	IDGD	
O=C(Cc1ccc(Cl)cc1)NNC(=O)[C@@H]1CCN(c2ccc3c(c2)OCCO3)C1=O	730515242	KQQKWJWTXBXKAR-INIZCTEOSA-N	429.860	1.854	50	20	IDGD	
O=C(CC[C@@H]1NC(=O)N(c2ccc(Cl)cc2)C1=O)NNC(=O)CNc1ccccc1	730830255	OYIUBJLKTAGAEK-INIZCTEOSA-N	429.864	1.805	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCCOc2ccc([N+](=O)[O-])cc2)c2ccccc2c1=O	731761544	QNFFOPSWLDENBA-UHFFFAOYSA-N	440.416	1.348	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1ccc(C)c(C(=O)NNC(=O)c2c[nH]nc2C)c1	732082998	OOHQPQAVZKMOCB-UHFFFAOYSA-N	443.485	1.911	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)N[C@@H]2CCN(CC(F)(F)F)C2=O)cc1	732589825	FUZFIXXUVJTPQJ-SMDDNHRTSA-N	432.399	1.346	50	20	IDGD	
O=C(NCCCN1CCN(c2ccncc2)CC1)NNC(=O)c1cnn(-c2ccccc2)c1	733345257	SEXYNIGMGLTZIF-UHFFFAOYSA-N	448.531	1.424	50	20	IDGD	
CCOc1ccc(NC(=S)NNC(=O)Cn2cc(Br)c(O)nc2=O)cc1	733792048	IKRRANFXGAYPOO-UHFFFAOYSA-N	442.295	1.128	50	20	IDGD	
COCCOc1ccc(-n2nc(C)c(C(=O)NNC(=O)Cc3ccccc3F)n2)cc1	735011857	XWPDSDXJDNUSMI-UHFFFAOYSA-N	427.436	1.744	50	20	IDGD	
CC(=O)N1CCN(S(=O)(=O)c2ccc(C(=O)NNc3c(F)cccc3F)cc2)CC1	735698503	MEDBQENRWMJBRO-UHFFFAOYSA-N	438.456	1.575	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)CSc1nnc(C)n1-c1ccccc1OC	740852011	GVUGJGZIUCPPDO-UHFFFAOYSA-N	434.522	1.129	50	20	IDGD	
CC(C)(NS(C)(=O)=O)C(=O)NNC(=O)CCCOc1ccc(Cl)cc1Cl	742032205	ASHDUFWWBDDIKN-UHFFFAOYSA-N	426.322	1.628	50	20	IDGD	
CN(CCCC(=O)NNC(=O)COc1ccc(F)cc1)C1=NS(=O)(=O)c2ccccc21	742036671	MWQQNPGIOUASHQ-UHFFFAOYSA-N	448.476	1.213	50	20	IDGD	
O=C(CS(=O)(=O)Cc1cccc(Br)c1)NNc1ncnc2[nH]cnc12	743468365	DBYJSFZRDYZGFK-UHFFFAOYSA-N	425.268	1.174	50	20	IDGD	
COc1cccc(C(=O)N2CCN(CC(=O)NNC(=O)c3cccc(C)c3)CC2)c1OC	744394215	CVKPQKADNYBCJN-UHFFFAOYSA-N	440.500	1.231	50	20	IDGD	
COC[C@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)C(C)C	745848529	HXPNUXIASOKOJR-KRWDZBQOSA-N	426.539	1.476	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCC(C)(C)NC(=O)OC(C)(C)C)c2ccccc2c1=O	745927158	UJSLIVPVSKOCPE-UHFFFAOYSA-N	446.508	1.664	50	20	IDGD	
Cn1cnnc1Sc1ccc(C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)cc1[N+](=O)[O-]	748284363	MCBIYBZDWCGXKE-HNNXBMFYSA-N	440.441	1.639	50	20	IDGD	
CCc1cc(N2CCC(NC(=O)NNC(=O)[C@H](C)Oc3ccccc3F)CC2)ncn1	748663249	ITRKLFLLKJNOAQ-AWEZNQCLSA-N	430.484	1.945	50	20	IDGD	
CS(=O)(=O)Nc1cccc(CC(=O)NNc2nc(Br)cn3ccnc23)c1	750248626	RJDVJKREJMSTHM-UHFFFAOYSA-N	439.295	1.549	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)N[C@@H]2CCC[C@H]([S@@](=O)CC)C2)nc1	750670883	OVMLULCXBADCKQ-XAZSVGOPSA-N	445.611	1.818	50	20	IDGD	
CCOCCCn1c(NNC(=O)[C@@H]2CS[C@@]3(C)CCC(=O)N23)nc2ccccc2c1=O	752048445	UGXFRLBSEODYJZ-KKSFZXQISA-N	445.545	1.720	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C2CCN(S(=O)(=O)c3ccc(F)c(F)c3)CC2)o1	752523486	VCFIKFJBHCJRGX-UHFFFAOYSA-N	427.429	1.728	50	20	IDGD	
CCn1c(=O)n(CC)c2nc(NC(=O)CCC(=O)NNc3cc(Cl)nc(N)n3)ccc21	753455676	WXELFDHCDKQSIL-UHFFFAOYSA-N	447.887	1.125	50	20	IDGD	
CC(=O)c1c(C)[nH]c(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1C(C)C	753494615	ONPHDSHQQXMBNE-MRXNPFEDSA-N	443.456	1.793	50	20	IDGD	
O=C(Cc1cccc2ccccc12)NNC(=O)NC1CCN(S(=O)(=O)C2CC2)CC1	753965843	IKLHKKVFEGXIRK-UHFFFAOYSA-N	430.530	1.669	50	20	IDGD	
CCOC(=O)[C@H](NCC(=O)NNC(=O)c1cc(Cl)ccc1OC)[C@@H]1CCCOC1	754261198	JOXSRVFYVBSYPF-SJKOYZFVSA-N	427.885	1.058	50	20	IDGD	
CON(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)c2cc(C)nc3ccccc23)cc1	754777367	FQUKMOCCSXHTPN-UHFFFAOYSA-N	428.470	1.800	50	20	IDGD	
O=C(CCNS(=O)(=O)c1cccc([N+](=O)[O-])c1)NNc1ccc(C(F)(F)F)nn1	755188975	BULCONLPOIGYAU-UHFFFAOYSA-N	434.356	1.215	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)C[C@](C)(O)C3CC3)c2)cc1	755381346	LBRKKBPUKYYWOL-NRFANRHFSA-N	447.513	1.808	50	20	IDGD	
CN1CCN(C(=O)c2ccccc2NC(=O)NNC(=O)COc2ccc(Cl)cc2)CC1	755623131	NKYGYFPDQXRNJV-UHFFFAOYSA-N	445.907	1.959	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)Nc1ccc(NC(=O)[C@@H]2CCCO2)cc1	755642052	VFTADFIYYDQPAT-KRWDZBQOSA-N	443.416	1.944	50	20	IDGD	
O=C(Cc1cc[nH]n1)NNC(=O)Nc1ccc(CCn2nnc(-c3ccccc3)n2)cc1	756294304	GNWCCWYREXEGHP-UHFFFAOYSA-N	431.460	1.701	50	20	IDGD	
CN(C)C(=O)Cn1ccc(NC(=O)NNC(=O)c2cc(F)ccc2Br)n1	756311403	OQCWXNOPLOKZJH-UHFFFAOYSA-N	427.234	1.339	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)Nc2ccccc2OCCn2ccnc2)c2ccccc2c1=O	756468231	CMGJNZVWTWLXQS-UHFFFAOYSA-N	447.455	1.676	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cncc(N3CCOCC3)c2)cc1Br	756989366	DDOPBPACVBDPEZ-UHFFFAOYSA-N	435.278	1.764	50	20	IDGD	
CC[C@@H]1CN(C(=O)NNC(=O)CNC(=O)c2ccco2)CC[C@H]1NC(=O)OC(C)(C)C	757020616	PTDGQXBOJUJHTB-ZIAGYGMSSA-N	437.497	1.375	50	20	IDGD	
O=C(COC(=O)c1cncc(-c2ccccc2)c1)NNC(=O)[C@@H]1COc2ccccc2O1	758111803	ZGWRMLGKBKRGGV-FQEVSTJZSA-N	433.420	1.893	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)CCn2nc(O)c3ccccc3c2=O)n[nH]1	763150824	CMIITMJTKFADCG-UHFFFAOYSA-N	448.439	1.352	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)c3cc(C)c4c(O)nc(O)nc4n3)n[nH]2)c1	763174153	JUJOZWCUNNGIGK-UHFFFAOYSA-N	433.428	1.826	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@@H](C)c2c(F)cccc2F)cc1	763462239	IQMKQFLVVJUEKD-ZDUSSCGKSA-N	425.457	1.845	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1Br	763471100	CQLAHHKCJPFYOD-UHFFFAOYSA-N	437.206	1.766	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(OC(F)F)cc2)cc(OC)c1OC	763539367	KXPVJTSHCLNKRF-UHFFFAOYSA-N	439.371	1.714	50	20	IDGD	
CCc1nnc(-c2ccc(NC(=O)C(=O)NNC(=O)[C@H]3COc4ccccc4O3)cc2)o1	763572344	QQRYIICBKIATPJ-MRXNPFEDSA-N	437.412	1.225	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2ccc(C(=O)NC(C)(C)C)cc2)c1	763646705	IFILSIBASPKGRB-UHFFFAOYSA-N	440.500	1.997	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(F)ccc1Br	763663510	JZCJKXMBGKSFLO-UHFFFAOYSA-N	440.225	1.762	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2ccnn2Cc2ccc(C)o2)c1	763665444	JBDMYAMCNNLSHA-UHFFFAOYSA-N	425.445	1.615	50	20	IDGD	
CN(C)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2F)cc1Cl	763681912	SERFIFOBPCXFIZ-UHFFFAOYSA-N	436.827	1.346	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccccc1CN(CC)C(C)=O	763716491	HTWRRJJLFKAUQE-UHFFFAOYSA-N	440.500	1.782	50	20	IDGD	
CCOc1ccc(OC)cc1NC(=O)C(=O)NNC(=O)CN1CCCc2ccccc21	763745658	HRILNDXDRSDSCF-UHFFFAOYSA-N	426.473	1.633	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2cc(OC)ccc2OC(F)F)c1	763772007	KKEPFKFUAHTXHD-UHFFFAOYSA-N	439.371	1.714	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2cc(-c3nnco3)ccc2C)c1	763772886	PRTAECXFLIKDMS-UHFFFAOYSA-N	425.401	1.462	50	20	IDGD	
COC(=O)c1ccc(OC(C)C)c(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)c1	763840777	XPYJWPFTYFSGEQ-UHFFFAOYSA-N	447.419	1.564	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cnn(C[C@H]3CCCO3)c2)c1C	763842308	YNORVPZVEOXZJL-NVXWUHKLSA-N	429.477	1.232	50	20	IDGD	
COc1ccc(OC(F)F)c(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)c1	763865092	IDOFJHQVFLEZOS-JTQLQIEISA-N	441.362	1.989	50	20	IDGD	
CCOc1ccc(C#N)cc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccc(C(C)=O)cc1	763873731	YEJFFNUEPVHJHW-AWEZNQCLSA-N	438.440	1.713	50	20	IDGD	
CCCCOc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c(C)c1	763921251	KNCFORZUVCQHTE-UHFFFAOYSA-N	437.460	1.549	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3cccnc3-n3cncn3)cc2C1	763938283	DAFXELJLSKLGDL-LLVKDONJSA-N	425.474	1.248	50	20	IDGD	
CCS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)C2=S=C3CC[C@@H](C)CC3=C2)cc1	763940728	HYRFFJNIQSGEBO-GFCCVEGCSA-N	449.554	1.404	50	20	IDGD	
O=C(NNC(=O)c1cc2c(s1)CCCCC2)C(=O)Nc1cnn(-c2ncccn2)c1	763968526	QKWVEUVXVPHILZ-UHFFFAOYSA-N	425.474	1.392	50	20	IDGD	
CCn1ncc2ccc(NC(=O)C(=O)NNC(=O)c3cc(Br)cn3C)cc21	764005018	ROJSSEHMRKQNJQ-UHFFFAOYSA-N	433.266	1.557	50	20	IDGD	
C[C@@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)Cc3ccsc3)cc2F)C[C@@H](C)O1	764034651	SUWMCOSBRKOZTM-CHWSQXEVSA-N	434.493	1.829	50	20	IDGD	
Cc1nnnn1[C@@H](Cc1ccc(F)cc1)C(=O)NNC(=O)CSc1ccccc1O	764045461	LMRJHASURTZNQI-HNNXBMFYSA-N	430.465	1.550	50	20	IDGD	
CCN(CC)CCOc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)nc2)cc1	764099504	AXZYHEHKOLEWQK-UHFFFAOYSA-N	433.896	1.855	50	20	IDGD	
CCCS(=O)(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(C)cc2O)c1	764105189	LXFHLVRAWKSLNS-UHFFFAOYSA-N	434.474	1.252	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(F)cc2Br)c1O	764130145	BXOWHUVPGUYWRG-UHFFFAOYSA-N	426.198	1.702	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccn(-c3ncccc3F)n2)o1	764138623	GOVVMHFCTBKGMA-UHFFFAOYSA-N	443.439	1.241	50	20	IDGD	
COCCOC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(C#N)cc2)c1	764176373	CTPNNIPNUNOHQB-UHFFFAOYSA-N	425.401	1.153	50	20	IDGD	
Cc1c(CS(C)(=O)=O)cccc1NC(=O)C(=O)NNC(=O)Cn1ccc2ccccc21	764243277	QJPSHXZPNLGKSF-UHFFFAOYSA-N	442.497	1.280	50	20	IDGD	
C[C@H]1COCCN1c1ccc(NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)cc1	764243734	XMZJPMUEFAARFH-INIZCTEOSA-N	435.484	1.653	50	20	IDGD	
O=C(NNC(=O)c1cccc(OC(F)F)c1)C(=O)Nc1cccnc1Br	764260361	WHTFETVGYYRYKZ-UHFFFAOYSA-N	429.177	1.845	50	20	IDGD	
C#CCOc1cccc(NC(=O)C(=O)NNC(=O)c2cc(Br)ccc2O)c1	764276875	HNMCQUXRDSQTFO-UHFFFAOYSA-N	432.230	1.566	50	20	IDGD	
N#CCc1ccc(OCc2cccc(NC(=O)C(=O)NNC(=O)Cc3cc[nH]n3)c2)cc1	764292958	JHQWHFJAQLOODP-UHFFFAOYSA-N	432.440	1.383	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3cc4ccccc4o3)cn2)C[C@H](C)O1	764331642	YZYCCDWZSCSUAT-KBPBESRZSA-N	437.456	1.841	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)N[C@H]2CCCC[C@H]2N2CCOCC2)nc1	764377845	ZQJFYWDFRFXSJG-DLBZAZTESA-N	440.570	1.038	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc4c(c3)OCC(=O)N4)n[nH]2)cc1C	764386585	JHNNHOSBHCBNMK-UHFFFAOYSA-N	448.439	1.424	50	20	IDGD	
COC(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)cc1	764386770	CCKKJQIZRRQTNN-UHFFFAOYSA-N	439.403	1.331	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1F)C(=O)Nc1ccccc1CN1CCNC1=O	764410307	FLMXZRJHEBSDJO-UHFFFAOYSA-N	433.827	1.404	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@]2(CCN(C(=O)NNC(=O)CNC(=O)c3ccco3)C2)C1	765241265	LFRWDXKQSBLFBF-HXUWFJFHSA-N	435.481	1.083	50	20	IDGD	
Cc1nnnn1/C(=C/c1ccc(F)cc1)C(=O)NNC(=O)CSc1ccccc1O	765249722	OSWTWAWXWCRIOH-XNTDXEJSSA-N	428.449	1.764	50	20	IDGD	
COC(=O)NNC(=O)C(=O)Nc1cc(OC)c(OC)cc1C(=O)N1[C@@H](C)CCC[C@@H]1C	765377622	YCWAOJRVCZBSCG-RYUDHWBXSA-N	436.465	1.433	50	20	IDGD	
CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CCN(S(=O)(=O)CBr)CC1	765638981	RNYFJTMEKSWVGP-CQSZACIVSA-N	448.339	1.990	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1cc(Cl)nc(Cl)c1	765736422	RUNBZHCMUKOPGL-UHFFFAOYSA-N	436.299	1.607	50	20	IDGD	
O=C(COC(=O)c1ccc(=O)n(-c2ccccc2F)n1)NNC(=O)c1ccc(Cl)cc1	766202072	KYAWNLBAUYSMSL-UHFFFAOYSA-N	444.806	1.643	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)N1C[C@@H](CC(=O)N(C)C)c2cc(Cl)ccc21	766265011	VBWUTJUBIMFYKC-LLVKDONJSA-N	432.868	1.190	50	20	IDGD	
CC[C@H](Oc1cccc(C)c1)C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	766648524	HJRLZOUGHHWPMU-NRFANRHFSA-N	438.528	1.758	50	20	IDGD	
O=C(/C=C\c1cncc(F)c1)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	766662696	BQJMJKRERWEDHX-UTCJRWHESA-N	431.899	1.853	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)c2cncc(C(=O)OC)c2)c2ccccc2c1=O	767163082	CKKYHYYFQNUBEO-UHFFFAOYSA-N	437.456	1.843	50	20	IDGD	
Cc1ccc(C(=O)N[C@H](C(=O)OCC(=O)NNC(=O)Cc2ccccc2C)C(C)C)cc1	767239459	ZCSQWIWJIWZBFV-QFIPXVFZSA-N	439.512	1.991	50	20	IDGD	
O=C(COC(=O)CCC(=O)c1ccc2c(c1)CCC(=O)N2)NNC(=O)c1cccs1	767607596	BKTZCTBWHCGWLP-UHFFFAOYSA-N	429.454	1.600	50	20	IDGD	
CCN(CC)[C@@H](CNC(=O)NNc1nc(O)c2cnn(C)c2n1)c1cccc(OC)c1	770342356	RKCSRJIZEIHPNM-INIZCTEOSA-N	428.497	1.787	50	20	IDGD	
CC(C)OCCN1CCC(NC(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)CC1	770401275	LXUXJUUOOZIWSO-UHFFFAOYSA-N	434.545	1.802	50	20	IDGD	
CN(CCNC(=O)NNc1ccccc1S(C)(=O)=O)S(=O)(=O)c1cccs1	772017102	UBDGIKPVQUFLKU-UHFFFAOYSA-N	432.549	1.098	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1cc(I)cc([N+](=O)[O-])c1	772231913	QGSORTRLRKJRRU-ZETCQYMHSA-N	435.174	1.302	50	20	IDGD	
CC[C@@H](C)[C@@H](NC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1)C(F)(F)F	772530656	IGFGPWLDIAPHGX-IUODEOHRSA-N	438.472	1.923	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)c1cnnn1-c1ccccc1Cl	772898914	WRLGAKMEHUKAPM-UHFFFAOYSA-N	433.255	1.652	50	20	IDGD	
CC(=O)Nc1cc(S(=O)(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)ccc1O	773266978	VFNFPJKYCQMZOP-JTQLQIEISA-N	427.866	1.781	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NNC(=O)[C@H]2CC(=O)N(Cc3ccco3)C2)C1	773411783	RIJVSWLTGVEIKM-CABCVRRESA-N	434.493	1.423	50	20	IDGD	
CCOc1ccc(C(=O)NCC(=O)NNC(=O)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1	773422658	XFSGFNXNKIDGEG-MRXNPFEDSA-N	448.520	1.610	50	20	IDGD	
CN1CCN(C(=O)NNC(=O)CSc2nnc(-c3ccc4ccccc4c3)o2)CC1	773672860	LOIULTSRZTYOBZ-UHFFFAOYSA-N	426.502	1.970	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2cccc(C[S@](=O)c3ccccc3)c2)n1	773724601	VHYNYLZPYLSMKY-PMERELPUSA-N	425.470	1.875	50	20	IDGD	
CCO[C@@H]1C[C@H](NC(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)[C@@H]1Oc1ccccc1	776530924	JEIGKVHUAINGJS-JQHSSLGASA-N	430.417	1.869	50	20	IDGD	
Cc1cc(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)nn1[C@H](C)C1CC1	777425835	LRGFRAZQLIDKAI-MRXNPFEDSA-N	446.577	1.856	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)CCc2c(C)c3c(C)nn(C)c3[nH]c2=O)nc1C	778430723	ZDNOAVZMXNXVJI-UHFFFAOYSA-N	427.465	1.229	50	20	IDGD	
O=C(CN1C(=O)[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)NNc1ccc([N+](=O)[O-])cc1Br	779140241	FWRWRWVBDNHPOZ-WDQYXFPCSA-N	435.234	1.608	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1cn(-c2cccc(Cl)c2)nn1	780172814	AKGZCMPJGWFMBJ-UHFFFAOYSA-N	447.908	1.597	50	20	IDGD	
Cc1cc(C(=O)NNS(=O)(=O)c2ccccc2S(=O)(=O)N(C)C)c2ccccc2n1	780366776	YCBWOXCLUJKWHE-UHFFFAOYSA-N	448.526	1.417	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)N[C@H]1CCCN(C(=O)OC(C)(C)C)CC1	781020800	LUYJGDOIORWBAJ-ZDUSSCGKSA-N	429.518	1.631	50	20	IDGD	
COc1ccc(NNC(=O)C2CCN(S(=O)(=O)c3cc(F)ccc3F)CC2)nc1	781530987	XJFRNOVXWQWSRW-UHFFFAOYSA-N	426.445	1.912	50	20	IDGD	
O=C(NNc1ncncc1Cl)c1ccc(Cl)c(S(=O)(=O)NC[C@@H]2CCCO2)c1	781824495	SLNVPCXUCDIQFU-NSHDSACASA-N	446.316	1.998	50	20	IDGD	
CCc1c(C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)nnn1Cc1ccc(F)cc1	781847688	WDPWJSQAXMFQRW-SFHVURJKSA-N	425.420	1.629	50	20	IDGD	
CC(=O)N1CCN(c2cccc(NC(=O)NNC(=O)c3ccc4c(c3)OCO4)c2)CC1	782084223	XKGGEXUBKCXZSE-UHFFFAOYSA-N	425.445	1.550	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2ccc(N3CCN(C(=O)C4CC4)CC3)nc2)cc1	783036035	LSKWKYXMWIYTJU-UHFFFAOYSA-N	438.488	1.231	50	20	IDGD	
O=C(NNc1cncc(Cl)n1)C(=O)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1	783260335	ZLMQRHOHOBNCHD-UHFFFAOYSA-N	438.897	1.386	50	20	IDGD	
CCc1nc2cc(NC(=O)C(=O)NNc3ccc(S(=O)(=O)NC(C)C)cn3)ccc2o1	783264360	NLRCMRGWYXJEMA-UHFFFAOYSA-N	446.489	1.554	50	20	IDGD	
Cc1ccn(C)c(=O)c1NC(=O)C(=O)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1	783407981	IIXAPDXMLBTIKU-UHFFFAOYSA-N	432.380	1.069	50	20	IDGD	
C[C@@H]1CN(c2ccc(NC(=O)C(=O)NNc3ccc(-n4cccn4)nn3)cc2)C[C@@H](C)O1	783433330	PIOYAHQUJLYSIW-HUUCEWRRSA-N	436.476	1.358	50	20	IDGD	
C[C@@H](c1ccc(NC(=O)C(=O)NNc2ccc(-n3cccn3)nn2)cc1)N1CCOCC1	783437147	TZHDHWQQKUAJNS-HNNXBMFYSA-N	436.476	1.137	50	20	IDGD	
COC[C@@H]1CN(C(=O)NNC(=O)[C@@H](C)Oc2cccc(Br)c2)C[C@H](C)O1	784058634	YBJSAETXDGKYJU-ZOWXZIJZSA-N	430.299	1.693	50	20	IDGD	
CS(=O)(=O)c1cc(Br)ccc1NC(=O)C(=O)NNc1ccc(Cl)nc1	784875458	SVFWNZKHWSQLIM-UHFFFAOYSA-N	447.698	1.983	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2cc(F)c(F)c(F)c2)cc1NS(C)(=O)=O	785088139	CQCJDLVMCDWDJX-UHFFFAOYSA-N	432.380	1.566	50	20	IDGD	
COC(=O)CCc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2OC)c1	786417100	KKYWVZGLHAQBOU-UHFFFAOYSA-N	433.848	1.854	50	20	IDGD	
C[C@H](C(=O)OCC(=O)NNC(=O)c1ccc(C#N)cc1)C1CN(C(=O)OC(C)(C)C)C1	786989067	KYHXDGCNKBVASL-ZDUSSCGKSA-N	430.461	1.365	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(-c2ccsc2)nn1C	787540755	FFHJBPFQHHYOTH-UHFFFAOYSA-N	429.458	1.322	50	20	IDGD	
Cc1sc(Br)nc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	788261200	JURFOUCOFLXYAM-UHFFFAOYSA-N	447.336	1.539	50	20	IDGD	
CN(NS(=O)(=O)c1cccc([N+](=O)[O-])c1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	788917960	XURRIYQJZNRRDJ-UHFFFAOYSA-N	443.482	1.393	50	20	IDGD	
C[C@](O)(Cn1cc(C(F)(F)F)ccc1=O)C(=O)NNC(=O)CSc1ccccc1O	792288782	YSGXNORPQHEGNU-KRWDZBQOSA-N	445.419	1.263	50	20	IDGD	
O=C(Cc1ccccn1)NNC(=O)C(=O)Nc1ccc2c(c1)N(CC(F)F)C(=O)CS2	793024471	FFVPBFWAVULUOE-UHFFFAOYSA-N	449.439	1.114	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)c(OC)c(C)c1OC	797001721	KKIMGSJWCFJFEQ-UHFFFAOYSA-N	437.836	1.780	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)COc2ccc([N+](=O)[O-])c(C)c2)c2ccccc2c1=O	797701150	CXFCODIDIJXXMG-UHFFFAOYSA-N	425.401	1.473	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNS(=O)(=O)c1ccc(Cl)cc1Br	799124452	RJIMZDSHCUOOSU-UHFFFAOYSA-N	442.719	1.937	50	20	IDGD	
CN1C(=O)COc2cc(NC(=O)C(=O)NNC(=O)c3cc(-c4ccccc4)on3)ccc21	799259359	ZJDURRCTDJWROE-UHFFFAOYSA-N	435.396	1.097	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(OCCBr)cc1)c1cccc([N+](=O)[O-])c1	799518644	OQPSIZVJRKNRGD-UHFFFAOYSA-N	444.263	1.992	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2O1)C(=O)Nc1ccnc(OCc2ccccc2)c1	800623298	LHYLJTVMBHTOLW-IBGZPJMESA-N	432.436	1.750	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc(I)ccc2O)cc1	801111726	REAMQMJLZYQELZ-UHFFFAOYSA-N	439.209	1.705	50	20	IDGD	
COc1ccc(Cl)c(NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccccc2)c1	802111064	XYQVYBAGRDBVAU-UHFFFAOYSA-N	426.882	1.822	50	20	IDGD	
Cc1cc(C)c(S(=O)(=O)NCCC(=O)NNc2ccc(-n3ccnc3)nn2)c(C)c1	804957484	KDESQJWGLNSVEU-UHFFFAOYSA-N	429.506	1.399	50	20	IDGD	
NC(=O)c1ccc(/C=C\C(=O)N2CCC[C@@H]2C(=O)NNc2nccnc2C2CCC2)cc1	805461501	FZPUETONWDKOFS-IBWPDUFMSA-N	434.500	1.991	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)[C@@H]2CCC(=O)c3ccccc32)CC1	806872645	MCYXBLOBNZGVHV-QGZVFWFLSA-N	443.529	1.221	50	20	IDGD	
Cc1cc([N+](=O)[O-])ccc1NNC(=O)C(=O)Nc1ccc(S(=O)(=O)NC2CC2)cc1	807456911	KINWURFEPASSFU-UHFFFAOYSA-N	433.446	1.426	50	20	IDGD	
COc1ccccc1C(=O)NNS(=O)(=O)N(C)C1CCN(C(=O)OC(C)(C)C)CC1	808090858	XFGLXGPOBZJJJY-UHFFFAOYSA-N	442.538	1.506	50	20	IDGD	
COC(=O)c1cc(C=NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)on1	814711285	YOLZOGMFKRQVPI-UHFFFAOYSA-N	431.412	1.927	50	20	IDGD	
COc1ccccc1COc1cccc(NC(=O)C(=O)NNC(=O)[C@H]2CCCO2)c1C	815779835	YALPPUXUQDOVTI-LJQANCHMSA-N	427.457	1.848	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)[C@@]2(c3ccccc3)CCC(=O)NC2)cc1	816818187	TVJMFOMJWBPXRF-HJPURHCSSA-N	425.485	1.848	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1sc(N(C)C)nc1Cl	857431635	NXHSEBDYIDDUKL-UHFFFAOYSA-N	430.943	1.539	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNS(=O)(=O)c2ccc(F)cc2C)cc1	874002803	BJPURPHLHMNRAY-UHFFFAOYSA-N	429.495	1.073	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2OC(F)F)CC1)NNC(=O)c1cccs1	893376833	GNLKIJXBXPCHSO-UHFFFAOYSA-N	438.456	1.569	50	20	IDGD	
O=C(Cn1cnc2ccccc21)NNC(=O)[C@@H]1CC(=O)N(Cc2ccccc2Cl)C1	913495789	LBVYMCNNHDDMJD-OAHLLOKOSA-N	425.876	1.886	50	20	IDGD	
O=C(COc1cccc(NC(=O)c2ccco2)c1)NNC(=O)[C@@H]1COc2ccccc2O1	914747675	DAOBBWXTPNFASY-IBGZPJMESA-N	437.408	1.898	50	20	IDGD	
COc1ccc2c(c1)C[C@H](C(=O)NNC(=O)c1nn(C(C)C)c(=O)c3ccccc13)CO2	914781376	BHJYBMJWABEHFO-HNNXBMFYSA-N	436.468	1.998	50	20	IDGD	
COc1ccc([C@H](CNC(=O)NNC(=O)COc2ccccc2F)N(C)C)cc1OC	915897570	GGAFRPYURNQHQR-INIZCTEOSA-N	434.468	1.855	50	20	IDGD	
CCCCS(=O)(=O)N1CCC(C(=O)NNC(=O)COc2cc(C)cc(C)c2)CC1	916032957	JHHAWKVGAWQJOR-UHFFFAOYSA-N	425.551	1.672	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)N[C@@H](C)c2cccc(S(N)(=O)=O)c2)c1C	916196646	BUZCJHNPNQGPAV-GJZGRUSLSA-N	434.518	1.810	50	20	IDGD	
COc1cc(OC)cc([C@H](NC(=O)NNC(=O)Cn2nc(C)cc2C)c2nccn2C)c1	916229076	LVIIVJIHMJBKHF-IBGZPJMESA-N	441.492	1.371	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)NCCN2CCN(c3ncccn3)CC2)c1C	918623386	NPHOHENOEWOEPW-PGMHBOJBSA-N	437.548	1.387	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1ccc2c(c1)OCCO2)c1ccc(N2CCOCC2)cc1	920869835	BCFTYFYAXFUJPP-HNNXBMFYSA-N	426.473	2.000	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)Nc2ccccc2CN2C(=O)CNC2=O)c1	920930330	JBYGVYMUELQGJK-UHFFFAOYSA-N	427.417	1.222	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)N[C@@H]1CC(=O)N(c2ccccc2)C1	921078842	YJVGAXZREOCYNI-CQSZACIVSA-N	444.517	1.038	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)c2ccc(S(=O)(=O)NCCC#N)cc2)cc1C	921159872	BQDQBCGKHBPHQD-UHFFFAOYSA-N	430.486	1.335	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1	1117675139	IEDKQBWVQLRSHU-UHFFFAOYSA-N	443.485	1.011	50	20	IDGD	
CN(C)[C@@]1(CNC(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)CCSC1	1319171779	MRGWPBNKXMLDPK-LJQANCHMSA-N	429.587	1.401	50	20	IDGD	
Nc1cnnc(NNC(=O)C2CCN(S(=O)(=O)/C=C/c3ccccc3)CC2)c1Cl	1333803695	GYMTUFUCCNVIEC-DHZHZOJOSA-N	436.925	1.868	50	20	IDGD	
CC(=O)N(C)[C@@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@](C)(Cl)CCl)C2	1778105619	FDTMTYPAKITNBE-ARKSPBFVSA-N	436.380	1.603	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cn4cccnc4n3)C2)C1	1778478292	IGFKPRKLDLILMI-ROUUACIJSA-N	426.304	1.409	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCn1ccnn1)C2	1780714348	AQJBOHISEGZICW-ZTFGCOKTSA-N	432.352	1.418	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)Cc3ccc(S(C)(=O)=O)cc3)CCO2)C1	1781212809	HJDREVJJMJVSQK-PXNSSMCTSA-N	442.965	1.480	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)c(O)c1	1781333805	JJKUGKAVOUNWMA-RHSMWYFYSA-N	431.258	1.535	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2	1781897699	OGYQALVXBCIGMI-BCUIYNNISA-N	425.751	1.274	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)C2)C1	1781938243	FFFVBXOETNVRAO-MSOLQXFVSA-N	446.287	1.980	50	20	IDGD	
C=C[C@H](O)C(C)(C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)Br)C1	1781997950	OVMNFJOIBXQNGC-NXEZDXNNSA-N	431.371	1.857	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2)c1ccc(-c2ncc[nH]2)cc1	1783020635	HLHUXEGRWYZQJC-JBYIUTFZSA-N	446.935	1.804	50	20	IDGD	
CCOc1ncccc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](Cl)COC)C[C@@H]21	1783391033	MYWAMGFFZHREOW-LLLHUVSDSA-N	425.913	1.327	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(-c4ccncc4)[nH]n3)CCO2)C1	1783877466	JCKDUMHUWGYDIA-QRWLVFNGSA-N	433.896	1.169	50	20	IDGD	
Cn1nc(C(F)(F)F)cc1C(=O)N1CCO[C@@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783946246	KJGZNJRXEAYSOV-CQSZACIVSA-N	429.226	1.686	50	20	IDGD	
COc1c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]3C2)ccc(F)c1F	1784092598	QNORQWNSXQUNSX-LVGORTOPSA-N	432.851	1.166	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3csc(N)n3)[C@H]2C1	1786910547	FDXPIHAOPVDWCI-ZPFDUUQYSA-N	431.356	1.350	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3nc4ccccn4c3C)[C@H]2C1	1787858965	GVDMSWGQJZEDEY-QAETUUGQSA-N	434.924	1.490	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCN3CCOC3=O)[C@H]2C1	1788137546	YWRVGPYNLCBRSN-WZTLGTBRSA-N	436.336	1.045	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc4c(c3)CCNCC4)C[C@@H]21	1789865343	RLBRZIAKKWEHAC-BOLBYERCSA-N	434.968	1.381	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CCCN(C)C3)C[C@@H]21	1790962797	BCHJPLBWIWWQMY-XAJHFOFHSA-N	430.387	1.481	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccn4cncc4c3)C[C@@H]21	1791056368	VSNXSPFOKUGPHR-CSFVBSKPSA-N	435.322	1.711	50	20	IDGD	
CCSc1ncccc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc(B(O)O)c1)C2	1792447017	GSAKFKNTXXZTPL-BCDXTJNWSA-N	439.346	1.439	50	20	IDGD	
CCOC(=O)N1CCC(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C(C)(C)CCl)CC1	1792785960	LRWHHTTWDYLZGF-BJWYYQGGSA-N	443.972	1.710	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2	1793152549	OWSXGNDUOVKJCK-AYCBFJCHSA-N	447.935	1.804	50	20	IDGD	
Cc1c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)ccc(F)c1F	1796192414	IRQNUCYLHGLVLX-BJWYYQGGSA-N	428.244	1.519	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CC(=O)N(Cc3cccs3)C1)C2)[C@H](F)Cl	1796361500	GZLAMYRLGFAXJA-PMUIAIRXSA-N	443.928	1.221	50	20	IDGD	
COC[C@H](NC(=O)OC(C)(C)C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](Cl)COC)C2	1796844215	ZDTUBTWDVXHCGI-JKJDWNRSSA-N	447.960	1.418	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H]1[C@H]3C=CS[C@H]31)C2	1796893506	CJJRYQHGPAIRJS-HKUMGMRESA-N	427.530	1.634	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1cccc2c1OCCO2	1796962648	UVJGMRQGZRFTKS-YHYOWMERSA-N	443.269	1.352	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C=C/c1ccsc1)C2	1798440612	FKIUAQBZVJUCPE-OAIVMCAHSA-N	425.514	1.712	50	20	IDGD	
COc1cc(F)ccc1CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Br	1799350585	YJQUTGJBEGTTIM-LZDSYCOUSA-N	447.276	1.657	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CCc2nc[nH]c2C1	1801270777	SGKDLZSENGYFTJ-GODIYZJISA-N	439.354	1.278	50	20	IDGD	
COc1cccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)Br)C3)c1F	1801927392	QWMWDLDMZVFVAH-LSSIXWDNSA-N	429.286	1.821	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1CCN(C(=O)c2c[nH]c(=O)cn2)[C@@H]1c1cccnc1	1803016459	XZBINXUKUVQCMX-HACGYAERSA-N	448.321	1.516	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc2c(c1)CCCO2	1803531171	SNGKQWAMQHLSPG-REPLKXPHSA-N	428.533	1.636	50	20	IDGD	
CC(C)(C)n1ccc(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)n1	1805042184	YTFFSENWPDVNRC-SZMVWBNQSA-N	433.940	1.952	50	20	IDGD	
O=C(CCBr)NC[C@@H]1CCN(C(=O)[C@@H]2CCNC(=O)C2)[C@@H]1c1cccnc1	1806346247	DACLXLKRMYTHFQ-QIIPPGSGSA-N	437.338	1.399	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@H](CNC(=O)[C@H]2CCC(=O)N2)[C@H]1c1cccnc1	1806821487	FQRVGPKBTWEIPF-ZDXGLAPJSA-N	427.332	1.602	50	20	IDGD	
Cc1ccncc1C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1808784675	NHLVKSBKEAQKEJ-UGKGYDQZSA-N	444.300	1.098	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@H](CNC(=O)/C=C\C(=O)NC2CC2)[C@@H]1c1cccnc1	1810129119	CDKOUQSOGUBZRT-IHANMSTJSA-N	444.608	1.774	50	20	IDGD	
C#CCCCC(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1	1813049280	RWXOAYQORJHEMM-DYESRHJHSA-N	434.500	1.203	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)C2=COCCC2)[C@@H]1c1cccnc1	1813118386	HKXCHBATGWFNGQ-UTKZUKDTSA-N	429.521	1.155	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@@H](CNC(=O)CCn2cncn2)[C@@H]1c1cccnc1	1813316863	YDCUVXRHAVFPGN-HFTRVMKXSA-N	449.353	1.800	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)CC2CCC2)[C@H]1c1cccnc1	1814118271	MNCBVGGNAKTVJG-DYESRHJHSA-N	436.516	1.590	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc(-n3cccn3)nc2)[nH]n1)[C@H](O)CCl	1814873049	JLUIQEITSNUAFS-HZPDHXFCSA-N	443.895	1.896	50	20	IDGD	
O=C1COc2ccc(C(=O)N3CCCC[C@@H]3c3cc(NC(=O)[C@@H](O)CCl)n[nH]3)cc2N1	1814873321	PIYWGRNUAKCSEN-CABCVRRESA-N	447.879	1.646	50	20	IDGD	
Cc1occc1C(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1	1815339893	SIMGKVKOWOUUSD-AWEZNQCLSA-N	425.275	1.264	50	20	IDGD	
Cn1ncc2c(C(=O)Nc3nc4c(s3)C[C@H](NC(=O)[C@H](O)CCl)CC4)cccc21	1818552883	IYDLDTPMACFJLA-MEBBXXQBSA-N	433.921	1.855	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H]2C[C@H]2F)n[nH]1	1820778115	WECNMUMNUGJOBS-YHGAKORUSA-N	429.456	1.894	50	20	IDGD	
Cc1cnn([C@H](C)C(=O)N2CCCC[C@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)c1	1822416559	HSFSGRZWBNMBJT-WBVHZDCISA-N	444.540	1.541	50	20	IDGD	
O=C(NCC(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H](O)CCl)CC1)c1ccco1	1824182182	VPSFVDBPRBMQOB-JKSUJKDBSA-N	425.913	1.229	50	20	IDGD	
O=C([C@@H]1ON=C(c2ccccc2)O1)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)CC1	1824185498	FFGSTLNYQLKFBZ-SPEDKVCISA-N	449.935	1.941	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1CCc2nc(NC(=O)Cn3ccncc3=O)sc2C1	1824536949	YJEVHBAGKKZRHH-QGHHPUGFSA-N	444.344	1.548	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCn1cncn1)CC2	1825647560	QAQQVGDUNZQOSB-NXEZZACHSA-N	427.328	1.520	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnncc1C(=O)O)CC2	1826002671	ACXSQRZXFGHHOP-LDYMZIIASA-N	439.881	1.111	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC[C@@H]1C1CCN(C(=O)C(F)(F)Cl)CC1	1827055259	SRPPIFJJSMZHFX-MRXNPFEDSA-N	428.672	1.431	50	20	IDGD	
CO/C=C(\C)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1	1828924114	JAZMDVILFIGMQM-JUWJPQTCSA-N	429.521	1.469	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H](C)N2CCN(C)CC2)CC1	1830245473	UHZDNFWJALHNQB-MISYRCLQSA-N	443.032	1.496	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3CC=CCC3)C2)C1	1830543327	PYLONSZEOWEGFX-JTDSTZFVSA-N	429.355	1.830	50	20	IDGD	
CCOC(=O)[C@@H]1CCC[C@H](C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)C1	1830701808	BCVRBQFNGMSERV-QOIOWGMHSA-N	448.919	1.347	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)C3=CCCS3)CCO2)C1	1831559405	YGRDLVLVEJRZTN-SUMWQHHRSA-N	433.368	1.637	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](CC)N(CC)CC)CCO2	1831662170	NMNWFNFXOWNSKG-UEXGIBASSA-N	432.005	1.971	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)/C=C/c3cccnc3)CCO2)C1	1833103088	NWVMKYKLMDQUQZ-UVEXCMSLSA-N	442.343	1.788	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H](C)Cn3cccn3)CCO2)C1	1833191689	RSXMRHLCWQXNLM-ABSDTBQOSA-N	426.945	1.383	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)COc3cccnc3)CC2)CC1	1833760467	RZJDNFLRGDOXIM-LJQANCHMSA-N	438.956	1.286	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)cn1	1833999424	MXBRCNDHELZCTQ-RHSMWYFYSA-N	430.274	1.151	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)Cn3ccnc3)CC2)CC1	1834267580	ZTXBYRNXRFBUSA-AWEZNQCLSA-N	426.359	1.238	50	20	IDGD	
CC[C@H](C)[C@H](N)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1834686346	CQLQJNXBGOGPRR-VBNZEHGJSA-N	435.382	1.622	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC(N2CCC(NC(=O)CCSC(=N)N)CC2)CC1	1834708732	CGXBZVKLJUGQJY-UHFFFAOYSA-N	443.690	1.426	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccc(F)cc3)CCO2)C1	1835052101	QWKPTWKHWPDGEL-XLIONFOSSA-N	428.888	1.078	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3cscn3)CCO2)C1	1836037489	MMYDCOYNHLOMGX-GUYCJALGSA-N	446.367	1.173	50	20	IDGD	
O=C(c1cnc2cc(Cl)ccn12)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1836369135	ZIPYAOSZLLONQV-MAUKXSAKSA-N	445.278	1.592	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)[C@@](C)(O)C(F)(F)F)CC2)CC1	1836395152	UYTNVSQTJBLLBA-RHSMWYFYSA-N	427.895	1.889	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3ccc4ncnn4c3)CC2)CC1	1838351719	LUFSMGDSZYAUQI-GOSISDBHSA-N	449.939	1.595	50	20	IDGD	
CC(C)c1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)on1	1838778616	AEVYQYHXJZFOHU-FZKQIMNGSA-N	444.326	1.651	50	20	IDGD	
Cc1ccn(C)c1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)CBr)C2)C1	1838815503	HOSWSYSFRVCNEC-DNVCBOLYSA-N	442.354	1.435	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(-c4ccccn4)[nH]n3)C2)C1	1839145893	HFNQAIVSTFQDBR-YCRPNKLZSA-N	447.923	1.559	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(O)n3)C2)C1	1839151340	OKZRZRNTNYWMEF-MSOLQXFVSA-N	432.304	1.094	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccccc3C3CC3)C2)C1	1840156199	KGPJKICDKITZGT-KNQAVFIVSA-N	436.936	1.888	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3ccoc3)CCO2)C1	1840516343	KHPIEZQEHYPIPP-MOPGFXCFSA-N	433.332	1.905	50	20	IDGD	
O=C(c1cccc(I)c1)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1	1841352669	FHFBHVXXARVFQL-ZDUSSCGKSA-N	448.688	1.708	50	20	IDGD	
CC[C@H](C)[C@@H](O)C(=O)N1CC2(CCCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C1	1841923998	LRFLAYDDQAWRIX-SOUVJXGZSA-N	431.961	1.729	50	20	IDGD	
CC1(C)CCc2cccc(C(=O)N3CCCC34CN(C(=O)c3cccc(B(O)O)c3)C4)c2O1	1843298505	IRUNTTBTPXGLEB-UHFFFAOYSA-N	448.328	1.601	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)[C@@H](C)Nc2nccs2)C1	1843394917	CEUUXOBGPCFQJR-CBOPYVSYSA-N	443.533	1.281	50	20	IDGD	
CC(=O)C(C)(C)C(=O)N1CC2(CCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)C1	1845038414	ZLMGKGNEISMSAG-UHFFFAOYSA-N	443.548	1.151	50	20	IDGD	
O=C1CC[C@H](C(=O)N2CC3(CCCN3C(=O)[C@@H](Br)Cc3ccccc3)C2)CN1	1845939924	IAFQTZYAWCNYMH-IRXDYDNUSA-N	448.361	1.722	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc(O)ncn1	1847893289	WDHQWRGEFVMSPE-HOTGVXAUSA-N	441.400	1.145	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2cccc(CS(C)(=O)=O)c2)c2ccccc2c1=O	14847150	HROBKFLZMMJAIN-UHFFFAOYSA-N	442.497	1.426	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1[nH]c(C)c(C(=O)OC(C)C)c1C	16177461	OQVZTCFVFRIZKR-UHFFFAOYSA-N	449.533	1.873	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)c2ccc3c(=O)n(-c4ccccc4)c(=O)[nH]c3c2)cc1	16205187	RYRHTTLAGHKBIN-UHFFFAOYSA-N	444.447	1.827	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)c2cc(S(=O)(=O)N3CCCCC3)cn2C)c1	106076117	ARLYWQUQUXTFEZ-UHFFFAOYSA-N	448.545	1.657	50	20	IDGD	
O=C(COC1CCCC1)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	117276901	BTSBVNCJPJXZOC-UHFFFAOYSA-N	431.514	1.885	50	20	IDGD	
CCC[C@@](C)(NC(=O)OC(C)(C)C)C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	727729654	VZBMBOODSMKLOJ-LJQANCHMSA-N	427.523	1.935	50	20	IDGD	
COc1ccc([C@]2(C)NC(=O)N(CC(=O)NNc3nc(-c4cccnc4)no3)C2=O)cc1	728075933	SIACXDMQFQKUGE-FQEVSTJZSA-N	437.416	1.051	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)c1cccc(N2C(=O)CCC2=O)c1	728210871	YQMKRVCNKZFJQD-UHFFFAOYSA-N	428.470	1.538	50	20	IDGD	
COC(=O)Nc1cccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1	728455135	BLANLGGQMSZWGL-UHFFFAOYSA-N	446.485	1.724	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1cccc(OC(F)F)c1)c1cccc(S(N)(=O)=O)c1	728599767	QUNHOHPJDAXOFS-JTQLQIEISA-N	428.417	1.641	50	20	IDGD	
O=C(NNC(=O)[C@H]1CC(=O)N(c2ccc(Cl)cc2)C1)C1CCN(c2ncccn2)CC1	728845240	FCXSIBUPLQXOSB-HNNXBMFYSA-N	442.907	1.547	50	20	IDGD	
CS(=O)(=O)c1ccc(Br)c(C(=O)NNC(=O)Cc2ccc(F)cc2)c1	728856776	AJPJZVCPNLGRBH-UHFFFAOYSA-N	429.267	1.995	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)N1CCC(C(=O)N2CCC[C@H](C)C2)CC1	728945222	WSIPZIOTJCWCDH-HNNXBMFYSA-N	426.521	1.968	50	20	IDGD	
CN(C)CCOc1ccc(CCNC(=O)NNC(=O)c2cc(Br)c[nH]2)cc1	729221269	NJWDAEOSGVYKJZ-UHFFFAOYSA-N	438.326	1.904	50	20	IDGD	
COCCOc1cn(-c2ccccc2)nc1C(=O)NNC(=O)c1cccc(OC)c1O	729525782	LQTWNNAFWNRLAH-UHFFFAOYSA-N	426.429	1.687	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NC[C@H]2CCCN(C(C)C)C2)cc1	729618699	FXFIOMYRKRMQFE-QGZVFWFLSA-N	439.582	1.066	50	20	IDGD	
CC(C)(C(=O)NNC(=O)N1CCN(CC(=O)NCc2ccccc2)CC1)c1ccccc1	731222011	SJEABSIDYMQFKY-UHFFFAOYSA-N	437.544	1.639	50	20	IDGD	
Cc1nc(CN2CCC(C(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)CC2)cs1	731606658	DBSHKWYUXOXYHO-UHFFFAOYSA-N	436.559	1.528	50	20	IDGD	
C[C@@H](NC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)c1cccc(O)c1	732889100	KEGGVIHSLKJWRP-CQSZACIVSA-N	434.522	1.111	50	20	IDGD	
C[C@H](CS(C)(=O)=O)NC(=O)NNC(=O)COc1ccc(OCc2ccccc2)cc1	733663174	VFAMFDMHVROLMU-OAHLLOKOSA-N	435.502	1.408	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)CN2C(=O)CCc3ccccc32)CC1	734821418	JGAYVPUVRPEVBQ-UHFFFAOYSA-N	445.520	1.696	50	20	IDGD	
C[C@H]1CCCC[C@H]1OCC(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	735117567	XQZMTQHIPXSLIT-JKSUJKDBSA-N	425.555	1.056	50	20	IDGD	
COCCNS(=O)(=O)c1cccc(CNC(=O)NNC(=O)Nc2ccccc2C)c1	735517315	BYQSMQXFKPGXEY-UHFFFAOYSA-N	435.506	1.456	50	20	IDGD	
CC(C)(Sc1ccc(Br)cc1)C(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1	735995830	UHQMYKQJZSFAAQ-SNVBAGLBSA-N	435.365	1.902	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1cc(N2CCNC2=O)ccc1F	737765618	ICFZASIOQZNWTC-UHFFFAOYSA-N	448.480	1.032	50	20	IDGD	
O=C(CC[S@](=O)c1ccc2c(c1)OCCO2)NNC(=O)c1cc(-c2ccccc2)[nH]n1	740749899	VCZICCQNCJXVKO-HKBQPEDESA-N	440.481	1.807	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)[C@@H]1CCN(c2ccccc2Br)C1=O	740852611	FHBVWVKQMPACOV-LBPRGKRZSA-N	439.310	1.254	50	20	IDGD	
C[C@@H]1CN(C(=O)NNC(=O)CNC(=O)c2cccs2)CC[C@H]1NC(=O)OC(C)(C)C	740912932	JKUGERVFBVTAGO-CHWSQXEVSA-N	439.538	1.454	50	20	IDGD	
CN(C)N(C(=O)c1ccc(S(=O)(=O)Cc2ccccc2)cc1)[C@@H]1CCS(=O)(=O)C1	741176082	OAZSKBQWAKERIL-GOSISDBHSA-N	436.555	1.766	50	20	IDGD	
CC(C)n1cc(S(=O)(=O)NNC(=O)c2ccc(CSc3nncn3C)cc2)cn1	741646183	DQCONPUICCJIDG-UHFFFAOYSA-N	435.535	1.508	50	20	IDGD	
COc1ccc(Br)cc1C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C	741693233	MQWHHWGTTGGQPG-UHFFFAOYSA-N	431.287	1.926	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNS(=O)(=O)c2ccc(C(=O)O)c(Cl)c2)cc1C	743250553	FULRZQCGQIOFIN-UHFFFAOYSA-N	425.850	1.603	50	20	IDGD	
COC(=O)c1ccc(S(=O)(=O)NNC(=O)Cc2cccnc2)c(Br)c1	743257821	PZFIXPADDHHDKX-UHFFFAOYSA-N	428.264	1.183	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(NC(=O)C(F)(F)F)cc1)c1cc([N+](=O)[O-])ccc1O	743269163	YUJVNPBAZOMQRX-UHFFFAOYSA-N	448.335	1.425	50	20	IDGD	
O=C(NNc1cccc([N+](=O)[O-])c1)C1CCN(C2=NS(=O)(=O)c3ccccc32)CC1	748004418	GDHBCFUPDDXEMG-UHFFFAOYSA-N	429.458	1.899	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)c2ccc([C@]3(C)NC(=O)NC3=O)cc2)cc1	748013337	PKIPUYRSTQRMCU-DMZKTXOQSA-N	440.456	1.368	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)N2CCCC2)cc(OC)c1OCc1ccccc1	748247763	SSQGCAAMXBPFSM-UHFFFAOYSA-N	427.457	1.666	50	20	IDGD	
NC(=O)C1CCN(c2ncccc2CNC(=O)NNC(=O)c2cc3ccccc3o2)CC1	749565842	AKADFVQOKGTUQH-UHFFFAOYSA-N	436.472	1.674	50	20	IDGD	
CNC(=O)COc1ccc(C(=O)NNc2nc(Br)cn3ccnc23)cc1OC	750245962	FTTRTTJCPWGWOU-UHFFFAOYSA-N	449.265	1.382	50	20	IDGD	
Cc1cc(S(=O)(=O)NNC(=O)[C@@H]2COc3ccccc3O2)sc1Br	751202353	KRPPPVZVSQQTSH-NSHDSACASA-N	433.305	1.969	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)[C@@H]1CC(=O)N(c2cc(Cl)cc(Cl)c2)C1	751202817	JBFXFYPUWABLFG-SNVBAGLBSA-N	439.255	1.517	50	20	IDGD	
Cc1cc(C)c(N2C[C@@H](C(=O)NNC(=O)CNC(=O)c3cccs3)CC2=O)c(C)c1	751208681	HXQWIBBIWJNQMS-HNNXBMFYSA-N	428.514	1.604	50	20	IDGD	
CC(C)C[C@H](C(=O)NNc1nc2ccccc2c(=O)n1C)N1C(=O)[C@@H]2CC=CC[C@H]2C1=O	752907911	PARXJDXYGGXNEF-IIDMSEBBSA-N	437.500	1.743	50	20	IDGD	
COc1ccc2c(c1)CC[C@@H](NC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)C2	753291936	PRYDXLHKXMNIEO-MRXNPFEDSA-N	432.502	1.992	50	20	IDGD	
CCS(=O)(=O)N1CCC(C(=O)NNc2cc(Cl)nc(N)n2)(c2ccccc2)CC1	753450347	UKFSVOCUSRVSJV-UHFFFAOYSA-N	438.941	1.539	50	20	IDGD	
NS(=O)(=O)c1cc(Br)c(Cl)c(C(=O)NNC(=O)c2ccccc2)c1	753767151	AKMMUNKDFGYMIS-UHFFFAOYSA-N	432.683	1.825	50	20	IDGD	
COc1cc(C(=O)NNC(=S)Nc2ccc(OC(C)C)cc2)sc1S(N)(=O)=O	754200006	MBZREBOJHBDYQT-UHFFFAOYSA-N	444.560	1.823	50	20	IDGD	
CCS(=O)(=O)N1CCC(CNC(=O)NNC(=O)c2cccc(Br)c2)CC1	754208480	FRNADHXXHOSCOZ-UHFFFAOYSA-N	447.355	1.455	50	20	IDGD	
COc1cccc(-c2nsc(NC(=O)C(=O)NNc3cccc(S(C)(=O)=O)c3)n2)c1	755345525	ZMCFVTIHBQABQA-UHFFFAOYSA-N	447.498	1.699	50	20	IDGD	
CCOc1ccc(NC(=O)NNC(=O)CC2CC2)cc1S(=O)(=O)N1CCOCC1	755550501	WEPYDOANGVAZKJ-UHFFFAOYSA-N	426.495	1.059	50	20	IDGD	
CCn1ccnc1C=NNC(=O)c1cc(S(=O)(=O)NCc2ccccc2)ccc1O	755608500	MAGCCCHWOGXYKX-UHFFFAOYSA-N	427.486	1.851	50	20	IDGD	
CCNC(=O)COc1cccc(NC(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)c1	755655792	MSHHSEIJWJOQDA-UHFFFAOYSA-N	446.460	1.694	50	20	IDGD	
Cc1cc(N2CCOCC2)ccc1NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1	755742006	SAKUKTVWDJNSKN-UHFFFAOYSA-N	439.520	1.691	50	20	IDGD	
CCC(=O)NNC(=O)Nc1cc(S(=O)(=O)N2CCCCC2)ccc1N1CCOCC1	755844548	HNJYTLGWKXUDGR-UHFFFAOYSA-N	439.538	1.261	50	20	IDGD	
Cc1c(NC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cccc1C(=O)N1CCOCC1	756184909	QCWGJTCAWRHYKC-UHFFFAOYSA-N	427.417	1.842	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)Nc2cccc(C(=O)N3CCOCC3)c2C)c1	756184941	TYTLDQXLCFEOQT-UHFFFAOYSA-N	442.472	1.951	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)Nc2ccc(N3CCN(C(=O)C4CC4)CC3)nc2)c(O)c1	756295210	MBEWPEAOPVGTBT-UHFFFAOYSA-N	438.488	1.621	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)Nc2ccc(OCCC(N)=O)cc2)n[nH]1	756501085	AQRBLDMOEAIRKT-UHFFFAOYSA-N	438.444	1.806	50	20	IDGD	
CC(=O)Nc1ccc(Cl)c(C(=O)N2CCN(S(=O)(=O)CBr)CC2)c1	758526464	CUJUQKAVUIBCMB-UHFFFAOYSA-N	438.731	1.738	50	20	IDGD	
Cc1ccc(CNC(=O)NNC(=O)C(=O)Nc2ccccn2)c(OC[C@@H]2CCCO2)c1	758846118	URYWPOIWJKADJL-INIZCTEOSA-N	427.461	1.417	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)c3cncnc3)c2)c(C)c1	760802477	LKJCYKCRKNOSLQ-UHFFFAOYSA-N	425.470	1.969	50	20	IDGD	
CNC(=O)COc1ccc(C(=O)NNC(=O)CSc2ccccc2OC)cc1OC	761637351	QEJGZOXPEOSARD-UHFFFAOYSA-N	433.486	1.382	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NN=Cc3cnc(C4OCCO4)s3)CC2)cc1	761829897	YGQRESKCDWHJRL-UHFFFAOYSA-N	429.546	1.765	50	20	IDGD	
CN(CC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)[C@@H]1CCSC1	763385978	KHMGPKHLSNTCGM-MRXNPFEDSA-N	440.591	1.060	50	20	IDGD	
CN(C)C(=O)c1ccccc1NC(=O)C(=O)NNC(=O)c1ccccc1Br	763482755	KYXMPCLLDLRZIQ-UHFFFAOYSA-N	433.262	1.551	50	20	IDGD	
COC(=O)c1cc(Br)c(F)cc1NC(=O)C(=O)NNC(=O)c1cccnc1	763494461	DHOGISPOONXWDF-UHFFFAOYSA-N	439.197	1.170	50	20	IDGD	
C[C@@H](c1cccc(NC(=O)C(=O)NNC(=O)c2c[nH]c3ccccc23)c1)N1CCOCC1	763534570	KKSBRIUMXZXDEQ-HNNXBMFYSA-N	435.484	1.961	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(N3CCOC3=O)ccc2C)cc1OC	763550206	ABXOVRCUPCBSBR-UHFFFAOYSA-N	442.428	1.369	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(-n3cccn3)c(Cl)c2)cc1OC	763550724	KLGURIFVQVCASR-UHFFFAOYSA-N	443.847	1.943	50	20	IDGD	
COc1cc(OC)c(OC)cc1NC(=O)C(=O)NNC(=O)c1cc(C)nc2ccccc12	763615091	AJUVKXZMDWQVIH-UHFFFAOYSA-N	438.440	1.969	50	20	IDGD	
O=C(COc1cccc(C(F)(F)F)c1)NNC(=O)C(=O)Nc1ccc2c(c1)OCCO2	763638590	BWYDEYYGEGVQJS-UHFFFAOYSA-N	439.346	1.642	50	20	IDGD	
COC(=O)c1ccccc1NC(=O)C(=O)NNC(=O)COc1cccc(C(F)(F)F)c1	763639372	MUWQOCQNWMHIPI-UHFFFAOYSA-N	439.346	1.657	50	20	IDGD	
N#CCOc1cccc(NC(=O)C(=O)NNC(=O)COc2cccc(C(F)(F)F)c2)c1	763640481	YLTZOCJKBVDKFW-UHFFFAOYSA-N	436.346	1.773	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCC3)cc1N1CCOC1=O	763783022	JXBGYODDDIAERA-UHFFFAOYSA-N	428.470	1.902	50	20	IDGD	
CSCc1cccc(NC(=O)C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c1	763790601	KXVFMZMJQOBJRE-UHFFFAOYSA-N	425.470	1.196	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)C(=O)Nc2cccc3cccnc23)c2ccccc2c1=O	763791449	RTGMUPCDVPCTQG-UHFFFAOYSA-N	444.451	1.925	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1nc(-c2ccccc2F)cs1	763809724	ZVSNFKFZKBZBHX-UHFFFAOYSA-N	439.428	1.986	50	20	IDGD	
CC(C)C(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)cc1	763849131	HTDHZCXEBVRBGZ-ZDUSSCGKSA-N	430.436	1.974	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cnn(Cc3ccccn3)c2)c1C	763849438	LORCOYMYEPSUKV-MRXNPFEDSA-N	436.472	1.497	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)cnc1Br	763873200	SDJIRWWNUBBOFI-JTQLQIEISA-N	439.241	1.845	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(-c3noc(C)n3)c2)cc1OC	763903971	XEGRPZQWMKGZLA-UHFFFAOYSA-N	439.428	1.852	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(C(=O)N(C)C)ccc2C)cc1OC	763911033	BEKCUMNLHKXBLP-UHFFFAOYSA-N	442.472	1.504	50	20	IDGD	
CN(C)CCC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccc(F)cc2)cc1	763921081	QJBLJLFESKMFHM-UHFFFAOYSA-N	429.452	1.045	50	20	IDGD	
Cn1cc(NC(=O)C(=O)NNC(=O)Cc2ccc(Cl)cc2)cc(Br)c1=O	763931397	FZDVFYXFTPSYKX-UHFFFAOYSA-N	441.669	1.130	50	20	IDGD	
COCCCOc1cccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)c1	764006979	WMPUXIGIIHQTTM-UHFFFAOYSA-N	429.429	1.273	50	20	IDGD	
CN(C)C1CCN(c2ccc(NC(=O)C(=O)NNC(=O)Cc3ccsc3)cc2)CC1	764034775	KEQSCFNFDFMWGQ-UHFFFAOYSA-N	429.546	1.607	50	20	IDGD	
COC(=O)c1ccc(N2CCCC2)c(NC(=O)C(=O)NNC(=O)c2ccccc2OC)c1	764040097	CTNTWHXKHGCGBI-UHFFFAOYSA-N	440.456	1.482	50	20	IDGD	
O=C(CN1CCCCCC1)Nc1ccc(NC(=O)C(=O)NNC(=O)C2CCCC2)cc1	764069470	CTLQSOAWCBRSKS-UHFFFAOYSA-N	429.521	1.777	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(OC(F)(F)F)cc2)c1	764078671	ZOEXQMNVIPYYIB-UHFFFAOYSA-N	445.375	1.388	50	20	IDGD	
COC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2ccc(F)cc2Br)c1	764084901	JOTKCHKZGMPGEK-UHFFFAOYSA-N	438.209	1.775	50	20	IDGD	
CS(=O)(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccc3ccccc3c2)cc1	764090522	AGQPXSBEUNGBCR-UHFFFAOYSA-N	439.493	1.713	50	20	IDGD	
CCCCOc1ccc(OC)cc1NC(=O)C(=O)NNC(=O)c1cccc(OC)c1O	764130989	CWOBTBBNVGCHDZ-UHFFFAOYSA-N	431.445	1.988	50	20	IDGD	
CC(C)CCC(=O)NNC(=O)C(=O)Nc1cc(Cl)ccc1OCCS(C)(=O)=O	764202770	JOPXVMTWGCSHSG-UHFFFAOYSA-N	433.914	1.286	50	20	IDGD	
CC(C)(C)OC(=O)Nc1ccc(F)c(NC(=O)C(=O)NNC(=O)Cc2cccnc2)c1	764268420	RWNXLRTYEYOOQS-UHFFFAOYSA-N	431.424	1.896	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)COc2ccccc2O)cnn1-c1ccccc1F	764274729	CEDLQCLUEPGEFB-UHFFFAOYSA-N	427.392	1.190	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)C(=O)Nc1cccc(C#Cc2ccccn2)c1	764364056	ZNSFUCNPLCYVOS-UHFFFAOYSA-N	428.448	1.784	50	20	IDGD	
CCOC(=O)N(C)c1ccc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)cc1	764401201	NXYCEKROUQHJSD-UHFFFAOYSA-N	446.485	1.863	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1F)C(=O)Nc1ccccc1C(=O)N1CCOCC1	764410299	FFACMPRRTBSODU-UHFFFAOYSA-N	448.838	1.351	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)[C@@H]1CCCN(C(=O)N2CCCC2)C1	765319605	ZYDQYDHKDZQXBF-OAHLLOKOSA-N	425.530	1.367	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CC(F)F)C(=O)NNC(=O)c1csc(N2CCOCC2)n1	765530124	IXANYXCYDCKRLU-JTQLQIEISA-N	449.480	1.289	50	20	IDGD	
CCCNc1ccc(CNC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1	765615744	DHWNSBANENNXCF-UHFFFAOYSA-N	447.561	1.968	50	20	IDGD	
O=C(C[C@@H]1CCc2ccccc2C1)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765735359	KXISQODEUGADLP-LJQANCHMSA-N	434.540	1.787	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N2CCCC[C@H](S(C)(=O)=O)C2)cc1Br	767809186	CNPFKPGEFTWZSF-LBPRGKRZSA-N	448.339	1.711	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCOCC2)cc1C(=O)NNc1ccc([N+](=O)[O-])cc1	768246783	JTIWNVZGIWMEMH-UHFFFAOYSA-N	436.446	1.381	50	20	IDGD	
Cc1cccc([C@H](CC(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)NC(N)=O)c1	770968472	XNFQKCLMTKIDIY-AWEZNQCLSA-N	426.481	1.838	50	20	IDGD	
COc1cc([N+](=O)[O-])ccc1OC(=O)CN1C(=O)N[C@](C)(c2ccccc2OC)C1=O	771318053	HMCYBOVAGLHHHL-HXUWFJFHSA-N	429.385	1.985	50	20	IDGD	
CO[C@@H](c1ccc(F)cc1)[C@@H](C)NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	771434573	PLBKRLONPMQWLV-KZULUSFZSA-N	427.436	1.793	50	20	IDGD	
C[C@H]1C(=O)Nc2cc(C(=O)NNC(=O)C(=O)NCc3ccc(Cl)cc3)ccc2N1C	772191979	HWBDXODBHCCBJV-NSHDSACASA-N	429.864	1.194	50	20	IDGD	
CN(C)C(=O)Nc1ccc(C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c(Cl)c1	772355857	ZCWKNECBIXBQRU-UHFFFAOYSA-N	442.863	1.755	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)CN1C(=O)N[C@@](C)(c2ccccc2)C1=O	772971185	JZQNTTWBGPCBES-ZSEKCTLFSA-N	444.875	1.722	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)CCNS(=O)(=O)c2c(C)cc(C)cc2C)c1	773071491	BXXHXMBSUBDHIU-UHFFFAOYSA-N	447.517	1.095	50	20	IDGD	
Cc1nn(CCC(=O)NNC(=O)[C@H]2CCCN(C(=O)OC(C)(C)C)C2)c(C)c1[N+](=O)[O-]	773419781	NYVTWGAVMIBLFU-AWEZNQCLSA-N	438.485	1.593	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)C(=O)Nc2cc(S(=O)(=O)N(C)C(C)C)ccc2C)n1	773478231	MDXGKOJWODLFPN-UHFFFAOYSA-N	434.522	1.513	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)C(=O)Nc2ccc(C(=O)N3C[C@H](C)O[C@@H](C)C3)cc2)n1	773483289	UGWUGBBLUBKOSK-GJZGRUSLSA-N	426.477	1.425	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)CCCOc2ccc(Cl)cc2Cl)nn1C	773492723	RZFPVWUFLIDJEE-UHFFFAOYSA-N	444.275	1.681	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(C)nn1-c1ccc(C)nn1	773493991	JHZDDTSGBGZPBP-UHFFFAOYSA-N	437.460	1.006	50	20	IDGD	
COC(=O)CCN1CCN(C(=O)NNC(=O)c2ccc(Br)s2)[C@@H](C)C1	774664528	ZEISLAWMQBAFOI-JTQLQIEISA-N	433.328	1.434	50	20	IDGD	
CC[C@H](C)Oc1cc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)ccn1	777182815	IUYATOGXDIGZIF-SUMWQHHRSA-N	429.429	1.403	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)c2cn(C)nc2-c2cnn(CC)c2)cc1	777422834	ZEMAVFJZUQOKAT-CQSZACIVSA-N	426.477	1.931	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNS(=O)(=O)c1c(OC)cc(OC)cc1OC	777595316	FZBARYWUJLEBHL-UHFFFAOYSA-N	440.474	1.500	50	20	IDGD	
COc1ccc2c(c1)OC[C@@H](C(=O)N1CCN(S(=O)(=O)CBr)CC1)C2	777777946	ULYYTNFGZDWTBG-ZDUSSCGKSA-N	433.324	1.073	50	20	IDGD	
COc1cc(Cl)c(S(=O)(=O)NNC(=O)CNC(=O)OC(C)(C)C)cc1Cl	777940433	LHUKKKUIRXNRLR-UHFFFAOYSA-N	428.294	1.836	50	20	IDGD	
CC(C)(C)Oc1ccc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cn1	778187903	FCWKEEZPOVIRSW-INIZCTEOSA-N	429.429	1.403	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)c1cc(O)nc2c(Br)cccc12	778442045	PVDPTRKTMIBJCQ-UHFFFAOYSA-N	439.266	1.989	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C(=O)Nc2cncc(Br)c2)nc2ccccc21	782893358	IPAUVNIYOUOYHB-UHFFFAOYSA-N	431.250	1.059	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(OC)c(NC(=O)C(=O)NNc2cc(C)ccn2)c1	783929585	XUPUDDYSYRPNNF-UHFFFAOYSA-N	435.506	1.511	50	20	IDGD	
Cc1cscc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	784231351	XTLZNDCEYVYLTK-UHFFFAOYSA-N	437.547	1.074	50	20	IDGD	
CNC(=O)Cn1ccc2ccc(NC(=O)C(=O)NNc3ccc(Br)cn3)cc21	784338658	DZUZANKNOIHDDC-UHFFFAOYSA-N	445.277	1.627	50	20	IDGD	
CCCNC(=O)[C@@H]1CN(C(=O)C(=O)NNc2ccc(C#N)c(Cl)c2)c2ccccc2O1	785085680	CGZWQJQSRVPXEV-SFHVURJKSA-N	441.875	1.975	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)[C@H]2CCCN2c2ccccc2)cc1OC	785132528	QNJZTRFOVDHPMU-QGZVFWFLSA-N	427.457	1.677	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)[C@H](CC(N)=O)NC(=O)c2ccccc2Cl)cc1C	786084462	FBGGPRQRLQLVQT-KRWDZBQOSA-N	446.891	1.157	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)CNC(=O)c2ccco2)ccc1Oc1ccncc1	787556534	XTEDRNKWPVGAPX-UHFFFAOYSA-N	437.412	1.291	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2nnn(CC3CCCC3)c2C)cc1	788719518	GPGAJBYMWGLROG-UHFFFAOYSA-N	448.549	1.167	50	20	IDGD	
C[C@H]1CCC2=S=C(C(=O)NNC(=O)C(=O)Nc3cc([C@@H]4CCCO4)nn3C)C=C2C1	789731419	HEXDWIGUHVQBTE-FZMZJTMJSA-N	431.518	1.196	50	20	IDGD	
O=C(NNC(=O)[C@H]1OCC[C@H]1c1ccccc1)C(=O)Nc1cccc(NC(=O)C2CC2)c1	789819246	NXDIZYJXXBTYSC-OALUTQOASA-N	436.468	1.694	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2cc(-c3ccccc3)on2)cc1C	789901076	FNFWZJOXGROQTR-UHFFFAOYSA-N	428.470	1.698	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNS(=O)(=O)c1ccc(C(=O)OC)c(C(F)(F)F)c1	790067768	CSOMMGIADDLOMK-UHFFFAOYSA-N	439.412	1.106	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2cccc3c2OCC[C@@H]3OC)c1	790952881	XDERLQMJWDKFOT-KRWDZBQOSA-N	429.429	1.574	50	20	IDGD	
CCCNS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2cccc(F)c2[N+](=O)[O-])cc1	790999361	BFTYXQSCAZKNEJ-UHFFFAOYSA-N	439.425	1.504	50	20	IDGD	
CC(C)CC(=O)NNC(=O)c1cc(Br)c(C(=O)NNC(=O)CC(C)C)o1	792045759	FBMMBVYKPJFFKW-UHFFFAOYSA-N	431.287	1.656	50	20	IDGD	
CCc1c(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)cnn1C(CC)CC	792266888	BCVASGPSUXLBTD-GOSISDBHSA-N	429.477	1.733	50	20	IDGD	
O=C(CN1CCNC(=O)[C@@H]1c1ccc(OC(F)(F)F)cc1)NNC(=O)c1cccs1	792359400	IKRXMNZMOUFQBK-HNNXBMFYSA-N	442.419	1.581	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)c2cc(NC(C)=O)ccc2NS(C)(=O)=O)cc1	792798918	SLLVMQUTOKXOIU-UHFFFAOYSA-N	448.501	1.419	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2OC)c(F)cc1C	793023049	GLSLMPGQWZVQEH-UHFFFAOYSA-N	447.419	1.484	50	20	IDGD	
CNS(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)c2ccc(Cl)cc2F)cc1C	794590162	QMHIHMZXQOXLGI-UHFFFAOYSA-N	435.886	1.319	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)NNC(=O)c2cccc(C)n2)c(Br)c1	794599172	DEVZQNPURUUMBX-UHFFFAOYSA-N	442.291	1.953	50	20	IDGD	
C[C@@](O)(CSc1cccc(F)c1)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	796144098	RAZXUZKVLFJWTF-HXUWFJFHSA-N	433.509	1.523	50	20	IDGD	
Cc1ccc2c(c1)CC[C@H](C(=O)OCC(=O)NNC(=O)[C@@H]1COc3ccccc3O1)O2	796298652	JSMFYXFSESVWQD-MOPGFXCFSA-N	426.425	1.219	50	20	IDGD	
CC(C)n1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(Br)c2)n1	796999823	OPOKYSGUNCWHEU-NSHDSACASA-N	438.282	1.780	50	20	IDGD	
Nc1c(C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)ccnc1-c1ccccc1	797484919	HYYHPMCSCULSCO-UHFFFAOYSA-N	435.396	1.857	50	20	IDGD	
Cc1c(NC(=O)NNC(=O)c2nnc(O)c3ccccc23)nnn1Cc1ccccc1F	801807984	OMCMFUQVUIJKTB-UHFFFAOYSA-N	436.407	1.889	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)c2cc([N+](=O)[O-])c(F)cc2N)CC1	801902609	GSLGZIFKDBOZMZ-UHFFFAOYSA-N	440.432	1.660	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(OC(F)F)nc2)cc(OC)c1OC	802565605	BOLRNZBPKMOCPM-UHFFFAOYSA-N	440.359	1.109	50	20	IDGD	
C[C@@]1(C2CC2)NC(=O)N(CC(=O)NNC(=O)Cc2nc(-c3ccccc3)cs2)C1=O	802580207	RMBDBZLHAAHAMF-FQEVSTJZSA-N	427.486	1.221	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)NCCC2(O)CCC2)cc1	803704130	UINJABROUBXMJN-LGMDPLHJSA-N	437.500	1.762	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N(C)C[C@H](C)OC)cc1	804839155	YJVSNPRPGDSNNO-ZCQLHAAUSA-N	425.489	1.834	50	20	IDGD	
C[C@H](CCNS(=O)(=O)c1ccccc1)NC(=O)NNc1ccc2c(=O)[nH]ccc2c1	807218413	BKCUENKQYVGOAO-CQSZACIVSA-N	429.502	1.911	50	20	IDGD	
COCC(C)(C)CCCNC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	807582955	WZWPJNQHSAYTEV-UHFFFAOYSA-N	442.586	1.097	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2cncc(C(F)(F)F)c2)CC1	809682990	KZAHCYVLKXLNNI-UHFFFAOYSA-N	444.439	1.188	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)[C@@H]2CCc3nnn(C)c3C2)c2ccccc2c1=O	809982426	FXVOHJJRBOBAKC-CQSZACIVSA-N	437.504	1.281	50	20	IDGD	
Cc1nc2ccc(NC(=O)C(=O)NNc3ccc(S(=O)(=O)C(F)(F)F)cc3)cn2n1	810393772	SFXPSCHUWWQHBK-UHFFFAOYSA-N	442.379	1.413	50	20	IDGD	
CC(C)c1cc(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)n(-c2ccccc2)n1	810399266	SHNHYASFKBIVOQ-UHFFFAOYSA-N	445.483	1.972	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNS(=O)(=O)CCCN1C(=O)c2ccccc2C1=O	811683016	OBXVWRWHBDXVMW-UHFFFAOYSA-N	440.481	1.278	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNS(=O)(=O)c3ccc4c(c3)NC(=O)CC(=O)N4)cc2C1	812548241	IERWZBQFLTWASV-SNVBAGLBSA-N	448.526	1.777	50	20	IDGD	
C[C@H]1CN(c2cccc(F)c2)CCN1C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	814295795	GANWJTBLVDZYDK-INIZCTEOSA-N	441.511	1.784	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2ccc(Cl)nc2)nnn1Cc1ccccc1F	815568061	UGORQDRIBCQMNI-UHFFFAOYSA-N	431.815	1.222	50	20	IDGD	
COC(=O)c1cc(Br)c(F)cc1NC(=O)C(=O)NNc1ncncc1F	815764553	LROZCEKGZITFRH-UHFFFAOYSA-N	430.165	1.386	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)[C@@H]1CCCN(c2ccccc2)C1=O	815933891	FKPPSWLQAFCJLB-KRWDZBQOSA-N	428.876	1.547	50	20	IDGD	
C[C@H]1CC(C)(C)C[C@@]2(C1)NC(=O)N(CC(=O)NNC(=O)Cn1cnc3ccccc31)C2=O	913495822	OZNRMSYUCLGFOW-RCDICMHDSA-N	440.504	1.321	50	20	IDGD	
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC(=NNC(=O)c2ccc3c(c2)OCCO3)CC1	914560325	YLUSOKPEWHXIFD-UHFFFAOYSA-N	433.490	1.368	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N2CCC(C(=O)NNc3nccc(OC)n3)CC2)cc1	914762901	AEQZXGNAETUREV-UHFFFAOYSA-N	435.506	1.428	50	20	IDGD	
Cc1ccc(C(=O)CCC(=O)CCC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)s1	915189015	QSBPVQHUDKAPPV-UHFFFAOYSA-N	440.485	1.806	50	20	IDGD	
COc1ccc([C@H](CNC(=O)NNC(=O)COc2ccc(C)cc2)N2CCOCC2)cc1	915897057	RLOPRFAYXXXAKG-NRFANRHFSA-N	442.516	1.786	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)c2ccc(OCC(=O)NC(C)C)c(OC)c2)c1	916034824	IZFCYNVPZFEYOV-UHFFFAOYSA-N	445.472	1.691	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NC2CCN(Cc3ccccn3)CC2)c2ccccc2c1=O	916382261	GWYQNBVZRHNVFI-UHFFFAOYSA-N	449.515	1.420	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C(C)C)N2C(=O)c3ccccc3C2=O)cc1C	916562988	XLTUDWLTMXUYTQ-GOSISDBHSA-N	436.468	1.710	50	20	IDGD	
CC(C)N1C(=O)c2ccc(C(=O)NNC(=O)c3ccc4ccccc4n3)cc2S1(=O)=O	916746293	JDSOKHSASIGHQD-UHFFFAOYSA-N	438.465	1.863	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CCNS(=O)(=O)/C=C\c2ccccc2)cc1	916830778	WOXJFOJDDIYKAN-OWBHPGMISA-N	430.486	1.061	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCc2ccc(OC)c(OC)c2OC)cc(OC)c1OC	918014597	JWWCNONGFDMHJQ-UHFFFAOYSA-N	449.460	1.882	50	20	IDGD	
C[C@@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)NNC(=O)c2ccc(Cl)cc2O)C1=O	918358920	DKMYDMPGCDFQQB-IBGZPJMESA-N	434.811	1.413	50	20	IDGD	
O=C(CC(F)(F)F)NNC(=O)C1CCN(S(=O)(=O)c2cc(F)ccc2F)CC1	918366024	QMOFGPTVDYDJME-UHFFFAOYSA-N	429.367	1.465	50	20	IDGD	
CCN(CCCNC(=O)/C(C#N)=C/c1cc(C)n(C[C@H]2CCCO2)c1C)S(C)(=O)=O	918670048	HNUOETUIQPPTBL-UMSHPIDHSA-N	436.578	1.979	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)[C@H]2CCN(c3ccccc3Br)C2=O)c1O	919757803	ZMNCTFAYNPWKDO-GFCCVEGCSA-N	448.273	1.977	50	20	IDGD	
C[C@H](C(=O)N(C)CC(=O)NNC(=O)c1ccc(F)cc1Br)n1cccn1	919849224	NNDRCJHRDPHHBD-SNVBAGLBSA-N	426.246	1.265	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)NCCN1C(=O)COc2ccccc21	1322149837	OZICDJHSLKKRRY-ZDUSSCGKSA-N	432.864	1.863	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)NCC(=O)NNc2cncc(Br)c2)cc1	1324193503	UHXQVCYIXIOLDT-UHFFFAOYSA-N	442.295	1.224	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)NCCCN1C(=O)NC(C)(C)C1=O	1340511751	UEXZYUQRNSWQGF-NSHDSACASA-N	425.873	1.158	50	20	IDGD	
Cc1nn([C@@H]2CCS(=O)(=O)C2)c(Cl)c1C=NNC(=O)COc1ccccc1O	1347634929	YUQVWBGMRUIDTG-GFCCVEGCSA-N	426.882	1.439	50	20	IDGD	
C[C@H](NC(=O)c1ccccc1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Cl)C1	1778027234	GSLCYPAQFKYBBN-CTRXZIQJSA-N	439.915	1.853	50	20	IDGD	
COC(=O)C12CCC(C(=O)N3CC[C@@]4(CN(C(=O)[C@H](F)Cl)CCO4)C3)(CC1)CC2	1778303224	QMPUNFILACBMRG-PHSYYZNHSA-N	430.904	1.864	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc4ncccn4n3)C2)C1	1778462109	XTBNABHNPMKFBR-ACJLOTCBSA-N	436.310	1.204	50	20	IDGD	
CCOC(=O)C1(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](F)Br)C2)CC1	1780776227	BAZGBNGRWIPETG-PBFPGSCMSA-N	449.317	1.534	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cc(S(C)(=O)=O)ccc3F)CCO2)C1	1781219944	SSMXFFHPLKZANF-HNAYVOBHSA-N	446.928	1.690	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)o1	1781229537	FTNWRBSEGBRVRQ-ROUUACIJSA-N	432.304	1.918	50	20	IDGD	
N#Cc1cc(CC(=O)N2CC[C@@]3(CN(C(=O)CCBr)CCO3)C2)ccc1F	1781296923	JTLDWFNHKQPBLH-IBGZPJMESA-N	438.297	1.855	50	20	IDGD	
Nc1ccccc1/C=C/C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781331036	JMOBSDNGIVWEPL-OZZQIWQLSA-N	426.286	1.802	50	20	IDGD	
O=C([C@H](F)Br)N1CC[C@]2(C1)CN(C(=O)[C@H](O)c1ccccc1Cl)CCO2	1781334804	QAUARZUIBIVORV-KEYYUXOJSA-N	449.704	1.894	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C=C\C(=O)NC1CC1)C2	1781997900	NNZKPLXZLZNJMF-ZUNJUMKGSA-N	442.354	1.119	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CSCC(=O)O)C2	1782002554	RJQGWUHJHXWXDC-HWWQOWPSSA-N	437.356	1.102	50	20	IDGD	
CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Cl)CCO2	1782049627	MRXNXHVVKAYESY-YJBOKZPZSA-N	428.848	1.639	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CC13CCCN1CCC3)C2	1782178633	MOPXOIBXEVJOTA-DBXWQHBBSA-N	442.000	1.773	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3c4c(nn3C)CCC4)C2)C1	1782442029	UXRWNULNGNMCNA-AUUYWEPGSA-N	439.354	1.526	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H]2CC[C@H](C)CC2)C1	1782688211	ZMYOACUCWHPNJP-FZONSQQESA-N	436.597	1.700	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(O)nc(Cl)c3)CCO2)C1	1783532357	MMGHISDYLLTVPR-QFYYESIMSA-N	432.702	1.668	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)C3(C)CCCCC3)C2)C1	1783817715	GVFRQTOAJIKYHB-VAHWYXDJSA-N	443.548	1.921	50	20	IDGD	
CC(C)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cn(C(C)(C)C)nn3)C[C@@H]21	1783852229	QJYGQROKCFPPEI-DZKIICNBSA-N	425.961	1.891	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cc(OC)c(OC)cc3C)CCO2)C1	1783879778	AUXYVYDSGKCRHM-HRAATJIYSA-N	440.924	1.710	50	20	IDGD	
CCN(CC)C[C@@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]2C1	1783974645	UIIAHPMWGCHVJF-ZBRFXRBCSA-N	446.430	1.975	50	20	IDGD	
COC(=O)CCCCCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2	1784044677	XPVXCJDYJNFZAS-KXBFYZLASA-N	447.370	1.971	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3CCCCC3(F)F)[C@H]2C1	1784662972	XDMLVNUUKYYKKM-QAETUUGQSA-N	444.523	1.165	50	20	IDGD	
COc1cc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)ccc1F	1785011326	XMPZQNYXFJDWER-RHSMWYFYSA-N	433.249	1.968	50	20	IDGD	
COc1cccc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)c1F	1785299931	DYSBCIMBXHYMNR-YOEHRIQHSA-N	433.249	1.968	50	20	IDGD	
COc1cc(F)ccc1CC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1785657137	JWUHQAMOMJYFQB-SJLPKXTDSA-N	447.276	1.897	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccn4nccc4c3)C[C@@H]21	1786407132	OZOJZYMLQGHXEU-XIRDDKMYSA-N	435.322	1.713	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)c1ccc2[nH]ccc2n1	1788319496	RYXWVERFQRSVCQ-KUDNYVPYSA-N	439.285	1.847	50	20	IDGD	
C[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]2C1)n1ccccc1=O	1789926377	VVQJLJGHQFJQSK-SMSYFYOWSA-N	444.301	1.080	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)c1ccc(N2CCCCC2)cc1	1790105833	XTPOSNXFAIJOHZ-WJMWBRGCSA-N	449.979	1.870	50	20	IDGD	
O=C(CCc1cnc2[nH]ccc2c1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21	1791141045	SLTJONMBSQAXNE-XSLAGTTESA-N	434.924	1.075	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3cncc(OC)c3)C[C@@H]21	1791252940	YZHPERYLDZBATI-WNHJNPCNSA-N	439.940	1.256	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3cc(C)cc(F)c3)[C@H]2C1	1791363246	NGHJJDLHUYYUCH-WNHJNPCNSA-N	426.916	1.910	50	20	IDGD	
C[C@H](Sc1ccccn1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21	1791579680	SVXXIVJYBIODHX-GVRJEKJASA-N	427.954	1.142	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nc3ccccc3n(C)c1=O)C2	1793450027	YJOUIDYGDUATQF-BASYENTBSA-N	446.935	1.544	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cc(F)ccc1F)C2	1795116900	DZPVKLGOLHBMGY-IVWMJMPLSA-N	431.277	1.882	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)c1cc(F)ccc1Cl	1796191770	VOEDVSGGYREBTJ-BJWYYQGGSA-N	430.672	1.725	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CC1CCCC1)C2	1796441259	PBDHIQKEJUDMSG-NAMOIKSGSA-N	429.521	1.290	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)ccc1O)C2	1796892716	JRNPPQXAEQQICU-JWBKOJIWSA-N	439.472	1.484	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(CCN2CCCC2)nc1)[C@H](O)CCl	1796961444	MSJFRCLTODMOAL-IYWMVGAKSA-N	434.968	1.571	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1ccc2nccnc2c1	1797057191	AQNSLCIIDKGVPB-VZAMPYOESA-N	437.269	1.524	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)c1cc2cc[nH]c2cc1Cl	1797067144	PVZBSJDUVYRABW-LZDSYCOUSA-N	426.300	1.624	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCBr)C3)o1	1797747870	XZZBAOVAKVJIKX-DRXBFXEBSA-N	428.283	1.226	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(F)cnc1Cl)C2	1798439915	NLVVFIRBRXXHJB-CLLJXQQHSA-N	446.870	1.438	50	20	IDGD	
CC1=NN(c2ccc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@@H](F)Cl)C4)cc2)C(=O)C1	1798979947	GKMLHHABZYPQPF-LTCOOKNTSA-N	436.871	1.537	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(=O)Nc1c(C)cccc1C	1799283751	MRYSUVAARSAPMA-DFGXFYAUSA-N	437.924	1.085	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(C)nc(O)c1)C2	1800639608	KJBCXVJSQQRMNE-FQLMCAECSA-N	426.311	1.472	50	20	IDGD	
C[C@@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(S(C)(=O)=O)cn1)C2	1801959209	GKOJKRNTHMJZNQ-FVCCEPFGSA-N	444.351	1.520	50	20	IDGD	
CCC[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2	1802133302	YSRAWHQIEAKYQI-XLWJZTARSA-N	435.924	1.804	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc2c(c1)CCCO2)c1ccc(B(O)O)cc1	1803524054	DZZOZGHRIZXNSP-WKCHPHFGSA-N	434.301	1.257	50	20	IDGD	
O=C(CCc1ccc(F)nc1)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1	1804436318	DOZSXDVIESOOEQ-SQGPQFPESA-N	434.899	1.854	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2ccc(F)s2)[C@@H]1c1cccnc1	1804736374	JETRUYPJNYHMFO-YWZLYKJASA-N	447.536	1.975	50	20	IDGD	
Cc1cccc(/C=C/C(=O)N2CCCC3(CCN(C(=O)c4ccc(B(O)O)cc4)CC3)C2)n1	1804824053	VADREKABTPOWIH-ZHACJKMWSA-N	447.344	1.628	50	20	IDGD	
C[C@H](CNC(=O)OC(C)(C)C)C(=O)N1CCCC2(CCN(C(=O)[C@H](O)CCl)CC2)C1	1805532081	DJXLLROWKICBNJ-HZPDHXFCSA-N	445.988	1.978	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC2(CCCN(C(=O)[C@H](O)C(C)C)C2)CC1	1805643005	PFUYAEGIZQLATP-WCIBBKAISA-N	431.537	1.369	50	20	IDGD	
Cn1c(C(=O)N2CC[C@H](CNC(=O)CCBr)[C@@H]2c2cccnc2)cccc1=O	1806338597	CGNVAHDQCDVVSW-BEFAXECRSA-N	447.333	1.885	50	20	IDGD	
O=C(C[C@H]1CCCCO1)N1CCCC2(CCN(C(=O)c3ccc(B(O)O)cc3)CC2)C1	1806592539	VLEMUBSPYMTJJR-HXUWFJFHSA-N	428.338	1.170	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@@H](CNC(=O)CN)[C@@H]1c1cccnc1	1807029407	PSRDEWRTZBBGJV-ZOBUZTSGSA-N	439.944	1.178	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)Cn2cc([N+](=O)[O-])cn2)[C@@H]1c1cccnc1	1808250217	IOVPNKYNWOXMAB-UWWQBHOKSA-N	434.884	1.910	50	20	IDGD	
CC(C)CNC(=O)C(=O)NC[C@@H]1CCN(C(=O)CO[Si](C)(C)C)[C@H]1c1cccnc1	1808447159	FHNFHRASCADKCM-HKUYNNGSSA-N	434.613	1.711	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2nccnc2C(N)=O)[C@H]1c1cccnc1	1811191963	UHKBLGSRAUZEEI-JKIFEVAISA-N	430.896	1.308	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)CC[C@H]2CCOC2)[C@H]1c1cccnc1	1813073452	ISGCWLVMWZUJDW-LTMIRXACSA-N	445.564	1.277	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2ccc(F)nc2)[C@@H]1c1cccnc1	1813074267	SLELNUPTDIEKOX-HRAATJIYSA-N	442.495	1.308	50	20	IDGD	
C=C(C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1)C(F)(F)F	1813074444	RCHTZDAZFQQHFN-QAPCUYQASA-N	441.454	1.579	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](N)CCC(N)=O)n[nH]1	1817248839	FFJATBQHYRAIJO-ZMNCSTGQSA-N	433.340	1.231	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CC[C@H](N)C(N)=O)n[nH]1	1817351253	ALWPTLADLFBGJS-NTZNESFSSA-N	443.346	1.026	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)CCc2ccoc2)[nH]n1)c1ccc(B(O)O)cc1	1817475888	YTGKUKHNALIFEA-IBGZPJMESA-N	436.277	1.621	50	20	IDGD	
COCCn1nccc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](Cl)COC)CC2	1817594540	GASFLSKNGNFCOO-NWDGAFQWSA-N	441.941	1.466	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccccn1)CC2	1819795931	VWNZBVWBSOSNSK-NSHDSACASA-N	437.485	1.076	50	20	IDGD	
CCC1(C(=O)N[C@H]2CCc3nc(NC(=O)c4cnccc4C(=O)NN)sc3C2)CCC1	1819796739	CCWZGMVXSLSXKL-LBPRGKRZSA-N	442.545	1.948	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccc(C#N)c2)n[nH]1	1820486398	KFGTWAJQFCQYOR-GOSISDBHSA-N	437.504	1.960	50	20	IDGD	
CN[C@H](CC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@](C)(Cl)CCl)n[nH]1)C(=O)O	1820865116	OHNBDPWXADUEKS-PSTGCABASA-N	434.324	1.701	50	20	IDGD	
CC(C)n1ccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)n1	1822414386	DFZCMTPZAWBARU-KRWDZBQOSA-N	444.540	1.866	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCS(C)(=O)=O)CC2	1822870087	RUFIDSARVSXKAH-RFAUZJTJSA-N	442.390	1.726	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)C(C)(C)CNC(C)=O)CC2	1825993787	FLOIUXBRHRZTLV-RYUDHWBXSA-N	430.958	1.471	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)COC(=O)C(F)(F)F)CC2	1826000127	LWEKCLMJYRMBEG-JGVFFNPUSA-N	443.831	1.414	50	20	IDGD	
Cc1onc(C(=O)N[C@@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)c1C	1826082960	HACKFRYTPMRSMQ-GFCCVEGCSA-N	434.522	1.347	50	20	IDGD	
Cc1cccnc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827050391	QUUPCFLCULQACT-OAQYLSRUSA-N	435.333	1.617	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](O)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@H](F)Cl)CC1	1827615002	KCKYTRBPFSJDRS-QLFBSQMISA-N	435.924	1.984	50	20	IDGD	
O=C([C@@H](O)CCl)N1CCC([C@@H]2CCCCN2C(=O)c2ccc3nc(CO)[nH]c3c2)CC1	1828097158	MSNQTGSITAYILA-OALUTQOASA-N	448.951	1.888	50	20	IDGD	
Cc1n[nH]c(C)c1C(=O)N1CCCC[C@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1	1829171066	QZBYBJBNXHLHDL-SFHVURJKSA-N	432.569	1.633	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](C)NC(=O)OC(C)(C)C)CCO2)C1	1830303723	KTLXNOSLLYSMKC-BXTJHSDWSA-N	447.960	1.373	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccsc3)CCO2)C1	1833968886	YWBLBNVDJYNSIY-PBHICJAKSA-N	431.352	1.992	50	20	IDGD	
O=C(CSc1ccccc1)NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1834515504	VBQRNVJYSRVEGA-IBGZPJMESA-N	440.009	1.950	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)Cn3cc(Cl)cn3)CC2)CC1	1834814791	GBIVKDBFYKIXGT-QGZVFWFLSA-N	446.379	1.362	50	20	IDGD	
CCc1nc(C(=O)N2CCOC[C@]3(CN(C(=O)CCBr)CCO3)C2)co1	1834822993	CQCITURODRLDTG-KRWDZBQOSA-N	430.299	1.092	50	20	IDGD	
O=C(Cc1ccc(F)cc1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1835051037	IPDOJLZSPSOVAL-WMZOPIPTSA-N	447.276	1.515	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3nc[nH]c3[N+](=O)[O-])CC2)CC1	1835098366	PISIKVXIGMATGP-OAHLLOKOSA-N	440.932	1.911	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)NC2CCN(C3CCN(C(=O)[C@H](O)CCl)CC3)CC2)o1	1835732945	CNQVCQJSGLZWFE-MRXNPFEDSA-N	440.928	1.023	50	20	IDGD	
O=C(c1cc2cccnc2[nH]1)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836717144	KFNAFZFTZSGIBZ-GOSISDBHSA-N	434.924	1.775	50	20	IDGD	
O=C(CN1CCCC1=O)N1CCC(OC2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1837809692	SMZRPGZWMOUEAL-QGZVFWFLSA-N	448.333	1.298	50	20	IDGD	
CSCC[C@H](O)C(=O)N1CCC(OC2CCN(C(=O)C(Cl)Cl)CC2)CC1	1838789703	UVKJTJRLZSFGAI-AWEZNQCLSA-N	427.394	1.903	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc([N+](=O)[O-])[nH]3)CCO2)C1	1838825351	QHKVGSRBXUEDAC-SCLBCKFNSA-N	428.873	1.400	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(F)c3)CCO2)C1	1838912806	VOMVPBHJZUPROO-ACJLOTCBSA-N	429.286	1.679	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(Cl)c3)CCO2)C1	1838920298	QWJLOKYSHPNBBO-LPHOPBHVSA-N	431.316	1.664	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cccc(F)c3)C2)C1	1840151701	LRSOHWGVILLWNY-FXAWDEMLSA-N	428.888	1.078	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4c(C)cccc4[nH]3)C2)C1	1840153359	LWALBFFTHNMBPT-VGOFRKELSA-N	449.935	1.800	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(C)cc(Cl)c3)C2)C1	1840155877	FRJNPQNFIRIGCO-XLIONFOSSA-N	445.343	1.972	50	20	IDGD	
CC(C)Cc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)n(C)n1	1840187436	ANBKBGFSZGUBAY-LJQANCHMSA-N	447.363	1.492	50	20	IDGD	
O=C(c1ccc2cncn2c1)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840188466	LJGAYIUKZLFKQM-SFHVURJKSA-N	427.288	1.208	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(CO)c(F)c3)CCO2)C1	1840781657	DIYXNAUJELTWJZ-DYESRHJHSA-N	442.915	1.796	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)CN(C(=O)OC(C)(C)C)C2CC2)C1	1841141200	XTOBJDYTWFZIAB-OAHLLOKOSA-N	429.945	1.843	50	20	IDGD	
COc1ccc(CC(=O)N2CC3(CCCN3C(=O)[C@@H](O)CCl)C2)c(Br)c1	1841347723	CNSJXPHZWVWNRG-HNNXBMFYSA-N	445.741	1.803	50	20	IDGD	
COc1ccc(Cn2cc(CC(=O)N3CCCC34CN(C(=O)[C@H](O)CCl)C4)cn2)cc1	1841994336	ACYJDKGGKHRGRG-LJQANCHMSA-N	446.935	1.286	50	20	IDGD	
CS(=O)(=O)c1ccc(CC(=O)N2CCCC23CN(C(=O)[C@H](F)Br)C3)cc1	1842811014	JVWXPADTPVNLFU-HNNXBMFYSA-N	447.326	1.527	50	20	IDGD	
CC(C)NCCC(=O)N1CCCC12CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1842992806	KRAQKMLBYBZQNS-HNNXBMFYSA-N	430.977	1.710	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)CCc1cccc(O)c1)C2	1843416804	CHAPKBLMJFQEMN-PCLIKHOPSA-N	437.500	1.662	50	20	IDGD	
Cc1cc(C)n2ccc(C(=O)N3CC4(CCCN4C(=O)c4cnccc4C(=O)NN)C3)c2n1	1844265072	RWUZOEMTVOGULK-UHFFFAOYSA-N	447.499	1.080	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)c1ccc([N+](=O)[O-])cc1	3506447	JQUJMCIANXIBRG-UHFFFAOYSA-N	432.458	1.844	50	20	IDGD	
CC(=O)c1cccc(S(=O)(=O)NCCC(=O)NNC(=O)c2cc3c(s2)CCC3)c1	10891380	RMRGNXNUGUQAJC-UHFFFAOYSA-N	435.527	1.569	50	20	IDGD	
COc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NNC(=S)NCCc2cccs2)cc1	11512669	AMZBFLCNQPAISY-LBPRGKRZSA-N	442.588	1.162	50	20	IDGD	
Cc1nn(-c2ccc(F)cc2)c(C)c1C(=O)NNC(=O)c1csc(N2CCOCC2)n1	24291438	GFJZPAZHVFYCMR-UHFFFAOYSA-N	444.492	1.996	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)CCNS(=O)(=O)/C=C\c2ccccc2)cc1	210943320	BOYGIKPEIPQRNX-OWBHPGMISA-N	432.502	1.235	50	20	IDGD	
O=C(CCCn1c(=O)oc2ccccc21)NNc1ccc(S(=O)(=O)NC2CC2)cc1	726862847	FNOQCSADNVSIQC-UHFFFAOYSA-N	430.486	1.959	50	20	IDGD	
CCCn1nc(C(=O)NN=Cc2c(C)nn(CCC(=O)OC)c2C)c2ccccc2c1=O	727059185	LVPPXTTXCRMSFP-UHFFFAOYSA-N	438.488	1.947	50	20	IDGD	
COc1ccc(-c2nnc(S)n2CCC(=O)N([C@H]2CCS(=O)(=O)C2)N(C)C)cc1	728178365	WDLBTUGBJZRNTE-AWEZNQCLSA-N	439.563	1.125	50	20	IDGD	
CC(C)NC(=O)CN(C)CC(=O)NNc1ccc(S(=O)(=O)Nc2ccccc2)cc1	728218069	YWIJSJUXNUPROX-UHFFFAOYSA-N	433.534	1.387	50	20	IDGD	
CC(C)C[C@H](NC(=O)c1ccc(Cl)cc1)C(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1	728370798	CEIIMSRFLTWCHK-ZFWWWQNUSA-N	429.926	1.067	50	20	IDGD	
C[C@]1(NNC(=O)N[C@H]2CCN(c3ccc(Br)cc3)C2)CCS(=O)(=O)C1	728755389	LWWZAGYSLAVUIM-BBRMVZONSA-N	431.356	1.409	50	20	IDGD	
CN(C(=O)CN1CCN(C(=O)NNC(=O)c2cccc(C#N)c2)CC1)C1CCCCC1	728954101	QPFYQXQKSHBBTH-UHFFFAOYSA-N	426.521	1.321	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)[C@@H]2CC(=O)N(c3ccc4c(c3)OCCO4)C2)cn1	729693306	SBFJWPUNLCRFDS-GFCCVEGCSA-N	443.485	1.232	50	20	IDGD	
Cc1nc(C)c(CCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)s1	731123879	PGRQBZUYVFMCDA-UHFFFAOYSA-N	425.536	1.197	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)NC1CCN(CC(=O)Nc2ccccc2)CC1	731497685	LZMVRYNUTFKDKF-UHFFFAOYSA-N	425.489	1.742	50	20	IDGD	
COc1ccc(Cn2cc(C(=O)NNC(=O)c3csc(N4CCOCC4)n3)cn2)cc1	731596962	NLEUBCLAOVQPNG-UHFFFAOYSA-N	442.501	1.308	50	20	IDGD	
CN(c1ccc(CNC(=O)NNC(=O)c2cccc(OC(F)F)c2)cc1)S(C)(=O)=O	732247710	PEANFTAFTZALAQ-UHFFFAOYSA-N	442.444	1.828	50	20	IDGD	
CSc1cccc(N2C[C@H](C(=O)NNC(=O)CCN3C[C@@H](C)O[C@H](C)C3)CC2=O)c1	732262392	SCMGVLZJWVCQIR-BZUAXINKSA-N	434.562	1.408	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)NCC2CCN(S(=O)(=O)C(F)F)CC2)c1	733045182	GFWLCDHSERYHFN-UHFFFAOYSA-N	448.492	1.277	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN1C(=O)OCC(F)(F)F)c1cnn(-c2ccccc2)c1	733106825	MEDKOIVAAJDTDD-CQSZACIVSA-N	425.367	1.797	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])o1)c1cnn(-c2ccccc2)c1	733109713	ASFBAHJRHJMUIP-OAHLLOKOSA-N	438.400	1.439	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)NNC(=O)c1cnn(-c2ccccc2)c1	733350152	PFOWHYOXGSRULY-UHFFFAOYSA-N	428.836	1.823	50	20	IDGD	
O=C(Cc1ccc(Cl)cc1)NNC(=O)NCCN1CCN(C(=O)C2CCCCC2)CC1	733351292	YELUPSLNHPUXNX-UHFFFAOYSA-N	449.983	1.937	50	20	IDGD	
CC(=O)Nc1ccc(CC(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)cc1	734821060	FIWFARSNMCQCMU-UHFFFAOYSA-N	433.509	1.917	50	20	IDGD	
COc1ccc(S(=O)(=O)C[C@H](C)C(=O)NNC(=O)COc2cc(C)cc(C)c2)cc1	735028710	NOVIERDRAPXBGU-INIZCTEOSA-N	434.514	1.948	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)CCN1C(=O)CCc2ccccc21	737467201	HRVUNVDIECCURY-UHFFFAOYSA-N	449.555	1.716	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H]1CCC[C@@H]1C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	739552935	XSQBPTHSKIVCES-HOTGVXAUSA-N	432.525	1.534	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNS(=O)(=O)c3ccccc3S(N)(=O)=O)cc2C1	740705597	JGVWPZSRUQCUSQ-SNVBAGLBSA-N	429.545	1.144	50	20	IDGD	
CCN1C[C@H](CN(C)CC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)Oc2ccccc21	741609328	BZMXYZSXOWESEH-KRWDZBQOSA-N	427.461	1.575	50	20	IDGD	
O=C(NNC(=O)[C@@H](c1cccc(F)c1)N1CCOCC1)C1CCN(c2ncccn2)CC1	741923201	NTIKJEHTEKHSPV-LJQANCHMSA-N	442.495	1.053	50	20	IDGD	
CCOc1ccc(-c2nnc(SCC(=O)NNC(=O)c3cccc(C)c3)n2N)cc1	742449402	IAJIHKAMESEMKX-UHFFFAOYSA-N	426.502	1.919	50	20	IDGD	
COc1ccc(O[C@@H](C)CNC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)cc1	743509630	IQJJHKVAQJWTOY-ZDUSSCGKSA-N	449.533	1.708	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)CN2C(=O)N[C@@](C)(C3CC3)C2=O)cc1Cl	743834751	RUFNFYYRPFIVIE-SFHVURJKSA-N	439.856	1.230	50	20	IDGD	
COc1ccc2c(ccn2CC(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)c1	744620167	FCQHIEKOYWCIAX-UHFFFAOYSA-N	444.513	1.814	50	20	IDGD	
Cc1ccc([C@H](CNC(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)N2CCOCC2)o1	745398538	GFZCYAFJAQRUDE-HNNXBMFYSA-N	433.421	1.219	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)CNC(=O)c2cc3ccccc3[nH]2)cc1C	745642199	AYBGWUAQQZHQCZ-UHFFFAOYSA-N	442.497	1.834	50	20	IDGD	
COc1c(Br)cc(Cl)cc1S(=O)(=O)NNC(=O)N1CCOCC1	745834323	OMCRCYMPDPGVPZ-UHFFFAOYSA-N	428.692	1.346	50	20	IDGD	
Cc1cnc([C@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)C2CC2)s1	745866354	VFXDCJCUZUVXCS-OAHLLOKOSA-N	437.547	1.797	50	20	IDGD	
C[C@H](CCc1ccc2c(c1)OCO2)NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	746966566	QVZIOLKMUCAXCL-CYBMUJFWSA-N	437.456	1.628	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCCCCC2)cc1C(=O)NNC(=O)c1cccn1C	747598609	FCMRMSACISBAOA-UHFFFAOYSA-N	434.518	1.673	50	20	IDGD	
O=C(Cc1cccc(OC(F)(F)F)c1)NNC(=O)c1csc(N2CCOCC2)n1	747727256	KJAMNZAOPAKWKT-UHFFFAOYSA-N	430.408	1.882	50	20	IDGD	
COc1ccc(C(=O)NNc2cc(Cl)nc(C)n2)cc1S(=O)(=O)N1CCOCC1	747981950	MSCFZBYRCQYLOC-UHFFFAOYSA-N	441.897	1.225	50	20	IDGD	
C[C@H](C(=O)NNc1ccc(Br)cc1F)N1C(=O)[C@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O	748200946	IAIMFCPTZADGOA-QXVRGBBPSA-N	426.242	1.582	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCCN1C(=O)/C=C\c1ccc(Cl)cc1)C(=O)N1CCCC1	748239185	FEWZJXXOYAEHJQ-SDMNGIDPSA-N	432.908	1.504	50	20	IDGD	
CC[C@H](NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)c1nnc2n1CCCCC2	749579155	HGXHBEFXPXQRCJ-INIZCTEOSA-N	441.540	1.493	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NC[C@@H]2CCN(c3ccccc3OC)C2)cc1	750330485	FLDRLQPNWINXSE-INIZCTEOSA-N	428.489	1.940	50	20	IDGD	
Cn1c2ccccc2c2cc(S(=O)(=O)NNC(=O)CNC(=O)c3ccco3)ccc21	751282052	IKLLXWIQYDEMIB-UHFFFAOYSA-N	426.454	1.664	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)c1cc(Cn2cc(Br)cn2)on1	752285592	BJWZIPWTZSKMAD-UHFFFAOYSA-N	434.250	1.694	50	20	IDGD	
COCC[C@@H](Cc1ccco1)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	753284122	ZZVJCKCRHVSGRH-HNNXBMFYSA-N	438.506	1.122	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCC[C@@H]2CCO[C@@H](C)C2)c1	753347627	SNDPZJQWZRYHIX-JKSUJKDBSA-N	440.566	1.866	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCc2ccc(C)cc2N2CCOCC2)cc1OC	753823025	SIYIIKKXXOJQSS-UHFFFAOYSA-N	428.489	1.993	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1ccccc1CN1CCc2ccccc21	756137095	RZKYGSSJDCGXCI-CQSZACIVSA-N	431.518	1.340	50	20	IDGD	
NS(=O)(=O)c1cccc(NC(=O)NNC(=O)c2ccc(F)cc2Br)c1	756509068	KPCFJRZVKGJYOE-UHFFFAOYSA-N	431.243	1.702	50	20	IDGD	
CS(=O)(=O)NCc1ccc(NC(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)cc1	756630274	SUVGIOVWHYJOQB-UHFFFAOYSA-N	446.464	1.732	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)NNC(=O)c1cccc(N(C)C)c1	756673941	DBXZXCNKZDDNNO-UHFFFAOYSA-N	449.533	1.868	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)nc1)Nc1cc(C2CC2)nn1[C@H]1CCS(=O)(=O)C1	756857346	VLIZVJMJXXHMJF-LBPRGKRZSA-N	438.897	1.635	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2cnc(OCc3ccccc3)cn2)c2ccccc2c1=O	757745156	XUEBSSZVBXBIQM-UHFFFAOYSA-N	444.451	1.860	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)c1nccs1	758725015	UCUHVWFQVZYBBL-CYBMUJFWSA-N	437.547	1.675	50	20	IDGD	
COc1ccc(Br)cc1C(=O)CCC(=O)NNC(=O)C(=O)Nc1ccccn1	758840579	KCARBNDQWIPJHA-UHFFFAOYSA-N	449.261	1.602	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1ccc(OCC(F)F)nc1	761813024	KQIWEJAXWYLBJD-UHFFFAOYSA-N	442.444	1.503	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccccc1OCC(F)(F)F	763662946	NYPZIOKTOYIQBY-UHFFFAOYSA-N	441.362	1.801	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccccc1C(=O)NC(C)(C)C	763712388	PRMXQZTYWINUTF-UHFFFAOYSA-N	440.500	1.942	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccc(Oc2cnccn2)c1	763716456	HDZPMVAERVAWKE-UHFFFAOYSA-N	435.440	1.996	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cccc(Cl)c2)c(OC)c(OC)c1	763749805	FJMIHITVYQNRFX-UHFFFAOYSA-N	435.820	1.544	50	20	IDGD	
COc1cc(Br)cc(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)c1	763838859	BCGIYZIRBISOMP-UHFFFAOYSA-N	440.225	1.762	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)cnc1Br	763839410	GOIPTVQSHPJMIZ-UHFFFAOYSA-N	425.214	1.457	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cc(C#N)ccc2OC)cc1	763862465	XNXBBVVCZHHDNR-CYBMUJFWSA-N	426.429	1.519	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccccc2S(C)(=O)=O)cc1OC	763912082	NCAUFGAMOVTJGV-UHFFFAOYSA-N	449.485	1.287	50	20	IDGD	
CCS(=O)(=O)c1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)Cc1ccc(F)cc1	763918298	BCJHHGISOHGWQD-UHFFFAOYSA-N	441.868	1.601	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)Nc1ccc(NC(=O)C2CC2)cc1	764002696	QNKBIHOONNMNNV-UHFFFAOYSA-N	448.277	1.536	50	20	IDGD	
CC(C)NC(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)c2cccc(C#N)c2)c1	764242408	QAOMBLYBOUBRNL-UHFFFAOYSA-N	427.848	1.750	50	20	IDGD	
Cc1cc(OC(C)C)ccc1NC(=O)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	764259847	KHCRNXQKGASBOA-UHFFFAOYSA-N	440.504	1.575	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)C(=O)Nc2ccc(Cl)c(C(=O)NC3CCCCC3)c2)cn1	764360068	SHCCQAJRKKOGHV-UHFFFAOYSA-N	446.895	1.536	50	20	IDGD	
Cc1ccc(S(C)(=O)=O)cc1NC(=O)C(=O)NNC(=O)C(F)(F)Oc1ccccc1	764380080	OBZYHJQCBCKICU-UHFFFAOYSA-N	441.412	1.156	50	20	IDGD	
CCC(=NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C)c1ccc(Cl)c(Cl)c1	764812734	QGDVKIZXEISZFO-UHFFFAOYSA-N	437.287	1.671	50	20	IDGD	
CSc1ccc(S(=O)(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)cc1	765128038	TWQCYNPPIVHFSC-UHFFFAOYSA-N	448.614	1.844	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCCCC2)cc1NC(=O)C(=O)NNC(=O)OC(C)(C)C	765398717	MVXHEOVBMLTUOY-UHFFFAOYSA-N	440.522	1.664	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)[C@@H]3CN(C(=O)OC(C)(C)C)CCO3)n[nH]2)cc1	765411022	WSYTXLMDJMZNLT-KRWDZBQOSA-N	429.477	1.782	50	20	IDGD	
Cc1cc(NC(=O)CSCC(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)no1	765618375	LOPHFSQGVSEBJY-UHFFFAOYSA-N	432.437	1.645	50	20	IDGD	
Cc1cc(S(=O)(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)ccc1C#N	766546227	BKOSMNBROWOEPF-UHFFFAOYSA-N	425.470	1.781	50	20	IDGD	
COC(=O)Nc1ccccc1C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	766643654	RFOCFVZFGBLJIU-UHFFFAOYSA-N	439.472	1.084	50	20	IDGD	
COc1ccc(C(=O)NNC(=S)Nc2ccccn2)cc1S(=O)(=O)NC(C)(C)C	768584095	JUTKXYDPHRSMGE-UHFFFAOYSA-N	437.547	1.798	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)CS(=O)(=O)NC1CCC(C)CC1	768637120	DFMDNHWVHSMWSG-UHFFFAOYSA-N	433.552	1.040	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](C(=O)NNC(=O)C1CCN(c2ncccn2)CC1)C(C)(C)C	769180327	QITZCMYCJVEWKL-OAHLLOKOSA-N	434.541	1.780	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CC(=O)N(c2c(F)cccc2F)C1)c1cc(Br)c[nH]1	770602265	MWQADPZGDNGOST-MRVPVSSYSA-N	427.205	1.870	50	20	IDGD	
C[C@H](NS(=O)(=O)c1ccc(C(N)=O)cc1)C(=O)NNc1ccnc2cc(Cl)ccc12	770952332	MRHANLWOFMYDTE-NSHDSACASA-N	447.904	1.797	50	20	IDGD	
Cc1cc2c(cc1C)[C@@H](C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1)CO2	771735432	QCILLYMEEFCCEP-KRWDZBQOSA-N	445.545	1.254	50	20	IDGD	
O=C(Cc1cc(Cl)c2c(c1)OCCO2)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772192495	MKOKBKPRBKIDSV-UHFFFAOYSA-N	438.267	1.771	50	20	IDGD	
CC(C)CNC(=O)N1CCC[C@@H](C(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)C1	772884005	HAWHWRLSBHYTGR-OAHLLOKOSA-N	437.928	1.181	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)c1cccn(Cc2ccccc2)c1=O	772898547	RZBBELUEEQXEOM-UHFFFAOYSA-N	438.871	1.627	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)NNC(=O)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)cc(C#N)n1C	773412474	WBKGGCCMTIRRAO-GESOSKEOSA-N	440.504	1.907	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)C(=O)Nc1ccc(F)cn1	773530138	UNFOFMOCEURYKB-VIFPVBQESA-N	425.214	1.537	50	20	IDGD	
Cc1nc(S(=O)(=O)N2CCC(C(=O)NNc3ccc(C(F)(F)F)cn3)CC2)cn1C	775254817	FVLMNDWBJDEEKW-UHFFFAOYSA-N	446.455	1.686	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccc(NC(=O)NNC(=O)CCc2ccccc2O)nc1	776063354	SEOQIKNRQCMPHC-UHFFFAOYSA-N	435.506	1.650	50	20	IDGD	
COC(=O)Cc1cc(=O)n(-c2ccc(C(=O)NNc3cccc(S(C)(=O)=O)c3)cc2)[nH]1	776721720	WHVHUJHYDGZDRY-UHFFFAOYSA-N	444.469	1.042	50	20	IDGD	
CC(C)N1CC[C@H](NC(=O)NNC(=O)C(=O)N2CCCC2)[C@@H]1c1ccc(Cl)c(F)c1	777750906	XSBMYPDUIQIKJN-IRXDYDNUSA-N	439.919	1.956	50	20	IDGD	
COc1ccc2nc(Cl)ccc2c1S(=O)(=O)NNC(=O)CNC(=O)OC(C)(C)C	777939379	LXWJWCIJYYNTHB-UHFFFAOYSA-N	444.897	1.731	50	20	IDGD	
CCOC(=O)c1cc(F)cc(S(=O)(=O)NNC(=O)c2nnc(-c3ccccc3)o2)c1	778564896	WHVZDMGHPQFSNA-UHFFFAOYSA-N	434.405	1.676	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)Nc2cccc(S(=O)(=O)N3CCOCC3)c2)c1	780446316	DHTHFORCTLPDTA-UHFFFAOYSA-N	434.474	1.643	50	20	IDGD	
O=C(CCc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])NNC(=O)c1cc(Br)c[nH]1	781575263	QSDPJSKBSHLPJM-UHFFFAOYSA-N	426.183	1.987	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)NCc2ccccc2CN2CC[C@@H](O)C2)cc1C	781950792	DYTAYAVLORQUQC-HXUWFJFHSA-N	439.516	1.339	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NCc2ccccc2CN2CC[C@@H](O)C2)cc1	781951033	GDQVMKJVJYTVFJ-GOSISDBHSA-N	428.489	1.171	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(OC2COC2)cc1	782121489	OWEZETSMDIDROK-UHFFFAOYSA-N	429.429	1.028	50	20	IDGD	
O=C(NNC(=O)C(=O)NC1CC1)C(=O)Nc1ccc(Br)c(Cl)c1Cl	782965612	HMIRGYBXROJFCH-UHFFFAOYSA-N	438.065	1.120	50	20	IDGD	
Cc1cc(F)ccc1NNC(=O)C(=O)Nc1cccc(S(=O)(=O)NC2=NCCC2)c1	783445614	WQZZRACTQGUVFI-UHFFFAOYSA-N	433.465	1.687	50	20	IDGD	
COc1cc(C=NNC(=O)Cc2csc(N3CCOCC3)n2)ccc1OCCC(=O)O	783812035	YDORXSFJWIWTJD-UHFFFAOYSA-N	448.501	1.535	50	20	IDGD	
COC(=O)[C@@H]1CN(C(=O)C(=O)NNc2ccnc(Br)c2)c2ccccc2O1	784828626	MQHBFMOQOCBBRL-ZDUSSCGKSA-N	435.234	1.254	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)N1C[C@@H]2CCCN2c2ccccc21	785023922	QFASMUWSAOXHSN-ZDUSSCGKSA-N	425.401	1.077	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1ccc2c(c1)CCN2C(C)=O	785330020	BWQBEQPBNBRKBZ-UHFFFAOYSA-N	446.485	1.090	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)Nc2cnc(N3CCN(C(=O)OC(C)(C)C)CC3)nc2)n[nH]1	786182189	LRDBLNYCQFYLJT-UHFFFAOYSA-N	445.484	1.032	50	20	IDGD	
CCNC(=O)Nc1ccc(C)c(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1	787540616	BMZSLMOOJQDTRZ-KRWDZBQOSA-N	441.444	1.062	50	20	IDGD	
CN1CCC/C1=N\S(=O)(=O)c1ccc(NC(=O)NNc2cc(Cl)nc(N)n2)cc1	789051924	RIZASCOYXHRQMR-ZVHZXABRSA-N	438.901	1.674	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccc2c1OCC[C@H]2N(C)C	789733255	WIRPVZUIQCGTQO-GOSISDBHSA-N	440.500	1.799	50	20	IDGD	
COC(=O)c1cc(Cl)cc(S(=O)(=O)NNC(=O)c2ccccc2OC)c1OC	790068526	MCZGAEFHUKLPQP-UHFFFAOYSA-N	428.850	1.767	50	20	IDGD	
O=C(NN=Cc1nccn1-c1ccccc1)c1cccc(S(=O)(=O)N2CCOCC2)c1	790141918	XYTCMTYLYZGELR-UHFFFAOYSA-N	439.497	1.657	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)c1nn(-c2ccccc2)cc1O	792497361	VDNLRUDQFYVEIY-UHFFFAOYSA-N	434.500	1.551	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)CC[S@@](=O)c2ccc3c(c2)OCCO3)cc1	792803017	MQKBIVFPEHFZAR-SSEXGKCCSA-N	432.498	1.744	50	20	IDGD	
COCCNC(=O)c1cccc(S(=O)(=O)NNC(=O)c2cc(C)nc3ccccc23)c1	795280889	OGARPXWOYDGABA-UHFFFAOYSA-N	442.497	1.543	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)CNC(=O)OCc2ccccc2)ccc1OC(C)C	797368297	AHYCBMBBPQVUKL-UHFFFAOYSA-N	442.472	1.795	50	20	IDGD	
CCOc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NNC(=O)c1ccc(OC)c(OC)c1	799257943	WYFYLFJAKXPSDG-UHFFFAOYSA-N	432.389	1.410	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)C1CCN(C(=O)[C@@H](C)CSC)CC1	799408272	RFNQRFRLHWHMNV-HNNXBMFYSA-N	445.589	1.984	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NC[C@H]3CCCC(F)(F)C3)nc2)CC1	800718203	CTXBDKDURAFMLW-AWEZNQCLSA-N	446.524	1.469	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(C(=O)NNC(=O)Nc2cc(F)cc(F)c2)cc1	802006694	OWEIXXFFUBYLAV-UHFFFAOYSA-N	428.417	1.356	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2c[nH]n3c2nc(=O)c2ccccc23)cc1	802068017	WRCBQHLSJIZSMM-UHFFFAOYSA-N	440.441	1.046	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCN(c2ccc3c(c2)OCCO3)C1=O)Nc1ccc2c(c1)OCO2	802105244	RMVYPWVYQJXKEL-CQSZACIVSA-N	440.412	1.392	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)NCCNS(=O)(=O)c2ccc(F)cc2Cl)cc1	802434345	KMJQAGLQPGNSAG-UHFFFAOYSA-N	442.900	1.964	50	20	IDGD	
CN1CCN(C(=O)NNC(=O)c2cnn([C@@H]3CCCN(C(=O)OC(C)(C)C)C3)c2)CC1	807383033	ZCMLLZQCNWPKDF-MRXNPFEDSA-N	435.529	1.057	50	20	IDGD	
C[C@@H]1CSC[C@@H]1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	807478600	VCHFVBAQAUWROF-CJNGLKHVSA-N	426.564	1.557	50	20	IDGD	
Cc1nc(Cl)cc(NNC(=O)CNS(=O)(=O)c2ccc(Br)cc2)n1	810438716	ZKRUWRGKXRRQSB-UHFFFAOYSA-N	434.703	1.623	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)[C@@H](O)c2ccc(Cl)cc2F)cc1OC	811368294	ZYYSQEQEIGYSKU-KRWDZBQOSA-N	440.811	1.534	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)c2cc(S(=O)(=O)NC)ccc2C)cc1	811884163	AXUWGTQDXMSPEQ-AWEZNQCLSA-N	435.502	1.530	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)N[C@@H]2CCC[C@@H]3CN(C(C)=O)C[C@@H]32)cc1	812433241	IWTYXCIJSZVQNV-BXIUTXANSA-N	432.521	1.830	50	20	IDGD	
O=C(NN=C1COc2cccc(Cl)c21)c1cccc(S(=O)(=O)N2CCOCC2)c1	814689209	WXECZOMYHWRLRN-UHFFFAOYSA-N	435.889	1.887	50	20	IDGD	
O=C(NNc1ncncc1F)C(=O)Nc1ccc(S(=O)(=O)c2ccc(F)cc2)cc1	815764395	GMEUZCYYRPQLHM-UHFFFAOYSA-N	433.396	1.669	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)C1CCN([C@@H]2CCSC2)CC1	816828765	OCQOCAHKSRSYNA-OAHLLOKOSA-N	439.607	1.267	50	20	IDGD	
Cc1nnnn1/C(=C\c1ccc(F)cc1)C(=O)NNc1ccccc1S(=O)(=O)N(C)C	817054447	KEOMOCSSWBQBAP-ATVHPVEESA-N	445.480	1.512	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)c2cnn(Cc3cccs3)c2n1	887554346	VLQVFQUTQNXWMQ-GFCCVEGCSA-N	433.515	1.045	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C2=NN(c3ccccc3)[C@H](C(N)=O)C2)c(C)n1-c1ccccc1	913081491	RBIDNCIDFMMIMB-NRFANRHFSA-N	444.495	1.975	50	20	IDGD	
O=C(CNS(=O)(=O)c1cccc(Br)c1)NNc1ccccc1[N+](=O)[O-]	913105355	MLOBDYXWHBEPAP-UHFFFAOYSA-N	429.252	1.779	50	20	IDGD	
CN(C)c1ccc(C(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)cn1	914711798	HOEBTPZVYFREBK-UHFFFAOYSA-N	442.479	1.981	50	20	IDGD	
O=C(COC(=O)c1cc(-c2ccc(F)cc2)[nH]n1)NNC(=O)[C@@H]1COc2ccccc2O1	914826807	RHNMLVNVZQQVKN-SFHVURJKSA-N	440.387	1.360	50	20	IDGD	
O=C(NCc1ccc(C(=O)N2CCOCC2)cc1)NNC(=O)c1ccc2ccccc2n1	916247862	MIBSKTQPQSHHDJ-UHFFFAOYSA-N	433.468	1.851	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)N[C@H]2CCN3CCC[C@H]3C2)c2ccccc2c1=O	916573078	HJWDPCWEHMJZDU-HOTGVXAUSA-N	426.521	1.767	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)N[C@H]1CCN2CCCC[C@H]12	916638469	GWADOXWYEHNLNJ-RBUKOAKNSA-N	449.577	1.432	50	20	IDGD	
CC(C)(C)C(=O)NNC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O	917182736	ZLWSERVIOAAGRP-UHFFFAOYSA-N	436.446	1.908	50	20	IDGD	
CN1C(=O)Cc2cc(S(=O)(=O)NNC(=O)c3ccc(F)cc3Br)ccc21	917755042	QEHQXORWUIFERK-UHFFFAOYSA-N	442.266	1.730	50	20	IDGD	
CCOc1ccc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)c3c[nH]nc3C)cc2)cc1	917904680	WYGUVIQWKOQVRU-UHFFFAOYSA-N	443.485	1.992	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)c1ccccc1F)C(=O)NNC(=O)CC(F)(F)F	918364687	SDBFTTKYZYVONS-SNVBAGLBSA-N	431.433	1.326	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)C2(NC(C)=O)CCCCC2)c1	918399477	PMEJMFKMXUVKAD-UHFFFAOYSA-N	438.550	1.317	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)NCCN3C(=O)c4ccccc4C3=O)n[nH]2)cc1	919785755	IZSIKEMGAMQWHA-UHFFFAOYSA-N	432.440	1.625	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)NCc2ccc(N3CCOCC3)cc2)cc1C	919790204	QZMUHEXJDMAAGT-UHFFFAOYSA-N	425.489	1.609	50	20	IDGD	
CCN(CC)C(=O)c1ccc(S(=O)(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1	920311055	YOOIXOAKBLLACP-UHFFFAOYSA-N	433.486	1.563	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)NCc1nc(Cc2ccccc2)no1	921118666	ASSQGPZAOAVDOV-UHFFFAOYSA-N	426.389	1.478	50	20	IDGD	
CC(C)(C)C(=O)Nc1ccc(S(=O)(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1	921205304	MCBCPMYRSDAVFR-QGZVFWFLSA-N	433.486	1.821	50	20	IDGD	
CC(C)CN(CC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)C(=O)OC(C)(C)C	1116271475	IKLULTIRTGONPN-UHFFFAOYSA-N	434.541	1.734	50	20	IDGD	
CCOc1cc(C=NNC(=O)C[n+]2ccccc2)ccc1OCC(=O)N1CCCCC1	1248411070	SWTHZFXITNUVJL-UHFFFAOYSA-O	425.509	1.914	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)N[C@H](C)C(=O)NCC(F)(F)F)cc1Cl	1252256157	MDMLPQAWIKTRTE-SSDOTTSWSA-N	441.794	1.760	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)[C@@H]1CC(=O)N(c2ccc(C#N)cc2)C1	1255008683	SBSVFXGKQREDAQ-CQSZACIVSA-N	428.470	1.467	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCCc2nc(Cc3ccccc3)no2)cc1OC	1263135957	NKTLZXSMYKFHBY-UHFFFAOYSA-N	425.445	1.864	50	20	IDGD	
CCOC(=O)N1CCC(C(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)CC1	1318903109	IJOQWNQHMDXEJB-UHFFFAOYSA-N	426.514	1.649	50	20	IDGD	
CS(=O)(=O)c1cc(Br)cc(C(=O)NNc2nncc(N)c2Cl)c1F	1319219277	IVXSRFYBUVDEGK-UHFFFAOYSA-N	438.666	1.774	50	20	IDGD	
CNC(=O)NN=Cc1cc(I)cc(I)c1O	1321993270	AMPKVGRKIYCIBM-UHFFFAOYSA-N	444.998	1.864	50	20	IDGD	
CN(C)c1ccc(NC(=S)NNC(=O)c2cc3c(c(S(N)(=O)=O)c2)CCC3)cc1	1336042432	YTMFYJNGUZZOIC-UHFFFAOYSA-N	433.559	1.520	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](N)Cc2cscn2)C1	1777968988	VRFAANKJVUXMEV-YIOZNXECSA-N	428.986	1.544	50	20	IDGD	
O=C([C@H](O)CCl)N1CCO[C@]2(CCN(C(=O)[C@H]3C[C@H]3c3ccc(Cl)cc3)C2)C1	1778185980	APHRODUGZRNOIT-LJCCNALRSA-N	427.328	1.873	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccccc3F)C2)C1	1780479228	KPHDSYMZGDRTJJ-IBUSPFOHSA-N	441.463	1.403	50	20	IDGD	
CCCOc1ccc(C(=O)N2CC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)cc1	1780839069	LFOCATKLSARXMM-HSZRJFAPSA-N	446.548	1.292	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc([N+](=O)[O-])c4c3OCO4)CCO2)C1	1781219377	XVCAJXJLOSHVRL-DJJJIMSYSA-N	439.852	1.784	50	20	IDGD	
COC(=O)[C@@H]1CC[C@H](C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)C1	1781225579	MZIYVJBTXVDSFO-FTUNRGFVSA-N	435.348	1.642	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)/C=C/C3CCCC3)C2)C1	1781277607	HIVJAVYTAPBWAE-CCBHUHBVSA-N	441.532	1.697	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H]1CC[C@H](O)CC1)C2	1782001134	AMFHTACLEPHLOW-XHWCBRGXSA-N	431.371	1.835	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1	1782009590	WZTYHYYYHYLGPQ-DYZYQPBXSA-N	447.713	1.978	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Br)C2	1782177946	BLKYUMIHCZSFFQ-FUTJPDQTSA-N	429.714	1.445	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3nc4ccccn4n3)CCO2)C1	1783344160	ZLISHYCMBVQWFA-SCLBCKFNSA-N	436.310	1.346	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](C)NC(=O)OC(C)(C)C)C2)C1	1783711871	BCJMJVZBSUCVJJ-JCGVRSQUSA-N	448.358	1.513	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)Cc3ccc([N+](=O)[O-])cc3F)CCO2)C1	1783881489	MWHBIYVBEBJCOL-BEFAXECRSA-N	443.859	1.360	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cccc(C(F)(F)F)c3)C[C@@H]21)[C@@H](O)CCl	1784093514	AEFYVGNSDFHMJB-HJWJTTGWSA-N	448.869	1.827	50	20	IDGD	
C=C[C@@H]1C[C@]1(NC(=O)OC(C)(C)C)C(=O)N1CC[C@@]2(CN(C(=O)[C@@H](F)Cl)CCO2)C1	1785596492	XCKUTXPSBQCVEB-UYVJDWJCSA-N	445.919	1.820	50	20	IDGD	
Cc1cc(CC(=O)NC2(c3ccc(NC(=O)c4ccc(B(O)O)cc4)cc3)CCC2)n[nH]1	1788142114	BIZHWKOXCQUBIB-UHFFFAOYSA-N	432.289	1.388	50	20	IDGD	
COc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CO[Si](C)(C)C)C[C@@H]32)c(O)c1	1789482441	ABNQITGFDXSKNX-FNHZYXHNSA-N	436.581	1.846	50	20	IDGD	
Cn1ccc(CC(=O)NC2(c3ccc(NC(=O)c4cnccc4C(=O)NN)cc3)CCC2)n1	1789522402	DHNXLTGWBCCTKB-UHFFFAOYSA-N	447.499	1.409	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]3C2)c(O)n1	1789870563	NPDXSFBLYXBWSC-VFSPDHHESA-N	430.332	1.925	50	20	IDGD	
C[C@@H](Cn1cccn1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]2C1	1789922552	OQJQJZXQOKTHTH-YYFQZIEXSA-N	431.306	1.189	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(C(F)(F)F)[nH]3)C[C@@H]21	1791255662	XTVBCQRWJNVHEE-FMSGJZPZSA-N	437.846	1.881	50	20	IDGD	
Cc1cccnc1CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)CBr	1792868800	PNJMJNCRWVCGCH-GGXPGOJBSA-N	438.366	1.943	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccnc(Cl)c1)C2	1792869929	DMMQNFTZJDIBPM-IKVITTDRSA-N	430.730	1.969	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(=O)C[C@H]1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](F)Cl)C2	1793251415	XDVBQSZAVPFBKP-CUZKYEQNSA-N	431.892	1.738	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)[C@@H]1CCCN(Cc2ccccc2)C1	1793750802	NWOWOJFHUQSCLJ-YMQHIKHWSA-N	449.979	1.088	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCN1C(=O)c2ccccc2C1=O	1793862558	ZJIANFXQBGOZFS-CSHUHZATSA-N	447.919	1.280	50	20	IDGD	
COc1ncccc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2	1795086614	IJMIBXMCHBZATD-MVRRYPJTSA-N	438.488	1.476	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccn(-c3ccccc3)n1)C2	1795114956	QWFLSBIKUWTXPM-CCWDJLKJSA-N	447.333	1.861	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2)c1cnc2cc(Cl)ccn12	1796059051	ACFNWFRGGZNACY-WDAIWFPHSA-N	431.707	1.995	50	20	IDGD	
O=C(Cc1c(F)cccc1F)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1	1796191624	GRRXBEHVNBSPDH-BJWYYQGGSA-N	428.244	1.139	50	20	IDGD	
CC(=O)N[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Cl)c1ccc(F)cc1	1796367517	KFDYRWTVTKVVDS-QMPXSYISSA-N	429.851	1.127	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1[nH]cc3c1CCC3)C2	1796892080	YQNIPGLLTYRZQK-AUHJYUKYSA-N	436.516	1.889	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2c(F)cc(F)cc2[nH]1	1796936211	UHFIHGFPDSUBDR-WZTYKQCMSA-N	441.862	1.903	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2)C1=NO[C@H](c2ccccc2)C1	1797179370	SFJNHVJOYQPZST-XRGAULLZSA-N	426.300	1.897	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc2[nH]ccc2n1	1798053150	SEHWOTCFQPCZHL-CWNKPHDYSA-N	447.499	1.949	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccccc1C	1798851322	QXMZFOVNRPTHSK-KLQCHYFMSA-N	437.500	1.332	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COc1ccc(C(=O)OC)cc1)C2	1799273917	VJQLJFOGGKGCAW-LORHWOILSA-N	438.908	1.459	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1COc3ccccc3O1)C2	1799273973	NNMATVLUHCKSGE-UZSUOLLMSA-N	443.327	1.652	50	20	IDGD	
C[C@@H](Nc1ccccc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Br	1799348959	DZWJNBBCYHYHJO-QUEVPRLRSA-N	428.302	1.767	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)c1ccc(F)cc1C(F)(F)F	1801852261	QQKIJSNYZUXMHT-ANGCBRKESA-N	438.805	1.647	50	20	IDGD	
COc1cc(F)ccc1CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2	1802181875	DWHCDBSTQYMKKX-LZDSYCOUSA-N	447.276	1.657	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)c2ccc[n+]([O-])c2)[C@H]1c1cccnc1	1804781713	CRVGHDQGKXNSFI-YSVLISHTSA-N	433.306	1.818	50	20	IDGD	
Cc1ccc(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)s1	1805409425	PYONBNQOCIILOW-NQIIRXRSSA-N	449.341	1.765	50	20	IDGD	
C#CCO[C@@H](C)C(=O)N1CCCC2(CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CC2)C1	1806003480	CXJWYAYHLWNYEW-WLXKGNRNSA-N	441.532	1.390	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)C(Cl)Cl)[C@H]1c1cccnc1	1810242040	ZSNPNNLTMMSJLB-XBFCOCLRSA-N	430.336	1.599	50	20	IDGD	
Cc1ccn(C)c1C(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1811609937	BSPPXAWDMOKECD-GCJKJVERSA-N	440.548	1.421	50	20	IDGD	
CC(=O)NCCC(=O)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@H]1c1cccnc1	1812662612	ZXTFOMCWEMQFQF-BPUTZDHNSA-N	429.290	1.304	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCBr)CC2	1817017373	XGLNZVKNRRLFJX-BDAKNGLRSA-N	432.344	1.287	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](CC)NC(N)=O)sc2C1	1817023836	KCVASMOJFGMGIV-LPEHRKFASA-N	446.371	1.676	50	20	IDGD	
Cc1cccnc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1	1817470212	LVXSZMZLOBAOOZ-GOSISDBHSA-N	433.277	1.413	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)C2CCSCC2)[nH]n1)c1cccc(B(O)O)c1	1817478575	GPZILIJQGDZDQZ-GOSISDBHSA-N	442.350	1.539	50	20	IDGD	
COCCn1ccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)[C@H](Cl)COC)[nH]n2)n1	1818261679	CHTBEZMTLIYIEF-CJNGLKHVSA-N	438.916	1.812	50	20	IDGD	
CC(C)[C@@H](S)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1	1819793151	LKBALAQXKBFEGS-MEBBXXQBSA-N	448.574	1.322	50	20	IDGD	
CC(C)(C)CC(=O)N[C@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1	1819794678	BCZCCMIUAQQQEP-NSHDSACASA-N	430.534	1.804	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](O)CCl)CC2)c1cccn(C(F)F)c1=O	1820249537	CAMCKBJSTDCJTI-KWQFWETISA-N	446.863	1.525	50	20	IDGD	
CC(C)n1nccc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCC(=O)NN(C)C)CC2	1820608983	ZJINYUABJGNQIW-ZDUSSCGKSA-N	447.565	1.519	50	20	IDGD	
COc1cc(C#N)cc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@@H](O)CCl)CC3)c1	1821383944	LEJORLANRVDAMV-DOMZBBRYSA-N	434.905	1.849	50	20	IDGD	
CCC[C@H](NC(C)=O)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](Cl)COC)n[nH]1	1822376267	FPYZDRPTUWCOAK-OFQRWUPVSA-N	427.933	1.960	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CN1CCOCC1)CC2	1822863467	KVCOFWKNZSSCEK-DIFFPNOSSA-N	435.377	1.624	50	20	IDGD	
COC(OC)C(=O)N1CCCC[C@H]1C1CCN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)CC1	1824340850	XRKUGDFTBHAXJM-WORIPGKHSA-N	447.536	1.359	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)C[C@@H]2CCCCO2)CC1	1824904590	CQRYGLIISVZGDJ-FCHUYYIVSA-N	442.365	1.559	50	20	IDGD	
O=C(N[C@H]1CCc2nc(NC(=O)C(Cl)Cl)sc2C1)c1nc2ncccn2n1	1826097432	RXMNPECNHQRXHA-ZETCQYMHSA-N	426.289	1.610	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)CNC(=O)OC)sc2C1	1826506998	VPQVVOROMBYZSH-IUCAKERBSA-N	433.328	1.585	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)CCCn3ccnc3)sc2C1	1826690465	KXXFUHYMOKYQRH-QWHCGFSZSA-N	425.942	1.986	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)Cc3cnn(C)c3)sc2C1	1826948857	JDSSAUVXHJOLQF-MWLCHTKSSA-N	426.340	1.815	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)c1ccc(OC)cc1)CCO2	1830216508	DYUHQSXNAQXJJB-WFXMLNOXSA-N	440.924	1.202	50	20	IDGD	
O=C(Cc1c(F)cccc1Cl)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1	1830283931	WXAZZTQSLYQWNJ-VQIMIIECSA-N	449.306	1.078	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cn4ncccc4n3)C2)C1	1830362186	NNJKTWWSTWHVCL-HXUWFJFHSA-N	435.912	1.064	50	20	IDGD	
O=C(c1cc(F)cc(Cl)c1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1830738798	TXAIGUBCJXHFCR-QAPCUYQASA-N	435.279	1.149	50	20	IDGD	
Cn1ccc(=O)cc1C(=O)N1CCC(N2CCC(NC(=O)C(C)(C)CCl)CC2)CC1	1833214348	KQMAEPQYJHJQCG-UHFFFAOYSA-N	436.984	1.836	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3ccc4nccn4c3)CC2)CC1)[C@H](O)CCl	1833310331	QKISMIBKJBLAAY-GOSISDBHSA-N	433.940	1.119	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(NC(C)=O)n3)CCO2)C1	1833338503	OBAZKCMIQPLTPI-MGPUTAFESA-N	438.912	1.127	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)CN3CCCCC3=O)CC2)CC1	1833535579	YIPDYVMNTQVVJU-IBGZPJMESA-N	441.016	1.978	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cc(C)nn3C)CC2)CC1	1834190399	SDUIMNSQVUYDJS-QGZVFWFLSA-N	425.961	1.168	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)CCN3CCOCC3)CC2)CC1	1834638332	CEPQBXAZWBJIGQ-LJQANCHMSA-N	429.005	1.298	50	20	IDGD	
C=CCOCCCC(=O)N1CCOC[C@]2(C1)CN(C(=O)CCBr)CCO2	1834819524	QLIFESAFJLZENP-SFHVURJKSA-N	433.343	1.211	50	20	IDGD	
Cn1cc(C(=O)N2CCC(OC3CCN(C(=O)CCBr)CC3)CC2)cn1	1837465625	PJBOBKQWZIHCNG-UHFFFAOYSA-N	427.343	1.817	50	20	IDGD	
CC(C)n1nccc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1	1838024187	WMFPBPMMUUUYGJ-RTBURBONSA-N	447.363	1.770	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3c(C)n[nH]c3C)CC2)CC1	1838445052	YHRDBSWQEYDWEE-KRWDZBQOSA-N	426.945	1.893	50	20	IDGD	
Cc1ccc(F)cc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839197234	NPBQHRIGMJTJGS-CRAIPNDOSA-N	447.276	1.895	50	20	IDGD	
O=C(c1cnoc1C1CC1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839197739	GYUHFRMYELUUAZ-YOEHRIQHSA-N	446.273	1.313	50	20	IDGD	
O=C(c1cccc(F)c1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839201590	BTLIQOJAPOFOAA-PBHICJAKSA-N	433.249	1.586	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3CC=CCC3)C2)C1	1839965841	MSRUEOPKDRAXFL-BXWFABGCSA-N	429.355	1.973	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4ncoc4c3)C2)C1	1840152626	NZADTGYJGOXRIK-MGPUTAFESA-N	437.880	1.152	50	20	IDGD	
C[Si](C)(C)c1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)co1	1840188597	SDQWEGXCCQSMTR-GOSISDBHSA-N	449.407	1.699	50	20	IDGD	
CN(CC(=O)N1CC2(CCCN2C(=O)C2(C)CCC2)C1)NC(=O)NCc1ccccc1	1841022527	CJPXLHBJRWCOTJ-UHFFFAOYSA-N	427.549	1.726	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)Cc2ccccn2)C1	1843096371	JRSSJCJDAJNFEA-UHFFFAOYSA-N	438.440	1.975	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)[C@@H](O)c1ccco1)C2	1844692007	XTJLMCDAADTERE-SFHVURJKSA-N	443.412	1.664	50	20	IDGD	
CC(=O)N/C(=C\c1ccco1)C(=O)N1CCCC12CN(C(=O)[C@H](F)Br)C2	1845442140	UNCFFMFTJRNPMG-MQJVFOOVSA-N	428.258	1.651	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cnc(Cl)nc1	1847176726	NREPCJPQYLTYIH-KJQHPKAKSA-N	429.868	1.079	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)C[C@@H]1OCCc2ccccc21	1847758351	MLOXUGJQHXUCPZ-ACRUOGEOSA-N	449.511	1.205	50	20	IDGD	
CCn1c(NNC(=O)c2ccc(S(=O)(=O)N(C)OC)cc2)nc2ccccc2c1=O	11162255	DQCWDVCJCURMFE-UHFFFAOYSA-N	431.474	1.355	50	20	IDGD	
CC(C)(C)NC(=S)NNC(=O)c1cc(S(=O)(=O)N2CCOCC2)ccc1Cl	14894676	PEMSEXYROFQPAO-UHFFFAOYSA-N	434.971	1.268	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)CN2C(=O)N[C@@](C)(c3ccc(F)cc3)C2=O)c1	28636550	VRMFTGIOKCDONU-QFIPXVFZSA-N	442.447	1.436	50	20	IDGD	
CCOc1ccc(C(=O)NNS(=O)(=O)c2cc([N+](=O)[O-])ccc2OC)cc1OC	28808437	BUEJYMTXRDHYTN-UHFFFAOYSA-N	425.419	1.634	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(OC[C@@H]3CCCO3)cc2)c1	30549446	QOMKAEAQZUBZIL-SFHVURJKSA-N	447.513	1.570	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NC1CCN(CCc2ccccc2)CC1	725873632	OJWLRGFZAYRRMY-UHFFFAOYSA-N	429.546	1.515	50	20	IDGD	
CC(=O)N1CCN(c2ccccc2CNC(=O)NNC(=O)c2cccc(N(C)C)c2)CC1	726273375	BOWIJHYAHLHSOA-UHFFFAOYSA-N	438.532	1.565	50	20	IDGD	
N#Cc1ccc(N2CCC(NC(=O)NNC(=O)c3nn(-c4ccccc4)cc3O)CC2)nc1	727481112	SGMGSVQBTQLFHA-UHFFFAOYSA-N	446.471	1.458	50	20	IDGD	
C#Cc1cccc(NC(=S)NNC(=O)[C@@H](CSC)N2C(=O)[C@H]3CCCC[C@H]3C2=O)c1	727501246	PICJBXBPOLFNTN-IXDOHACOSA-N	444.582	1.892	50	20	IDGD	
COc1cc(N2C[C@H](C(=O)NNC(=S)NCC3CCC3)CC2=O)cc(OC)c1OC	727866154	RPZGICNQSFICGM-CYBMUJFWSA-N	436.534	1.361	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)c2ccc(C(=O)NC)nc2)cc(OCC)c1OCC	728511250	GHHUIPMDFCIZTN-UHFFFAOYSA-N	430.461	1.712	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)N2CCC(NS(=O)(=O)c3ccc(F)cc3)CC2)c1	728952880	GVSNSKQFFYCCHX-UHFFFAOYSA-N	445.476	1.495	50	20	IDGD	
CC[C@@H](NC(=O)NNC(=O)c1cccc2cccnc12)c1cccc(S(N)(=O)=O)c1	729227942	UUSNLNXYXSBDQR-QGZVFWFLSA-N	427.486	1.978	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NN[C@H](C(N)=O)c2ccc(Br)cc2)c1	729677028	YCMMACOAHDLWOI-AWEZNQCLSA-N	426.292	1.314	50	20	IDGD	
CN(C)c1ccc(NC(=S)NNC(=O)CCOc2ccc(S(C)(=O)=O)cc2)cc1	729689055	NUYYORYCXSJCDW-UHFFFAOYSA-N	436.559	1.943	50	20	IDGD	
CC[C@H](NC(=O)NNC(=O)c1ccc(OC)cc1OC)c1cccc(S(N)(=O)=O)c1	730025554	LGGHGUCRDOIGCE-INIZCTEOSA-N	436.490	1.447	50	20	IDGD	
CC(=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O)c1ccc(N2CCCCC2)cc1	730568936	GVRBJSQMFPZWMO-UHFFFAOYSA-N	430.534	1.102	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)c1cn(-c2cccc([N+](=O)[O-])c2)nn1	731470798	JJYWUWADMIUUHD-UHFFFAOYSA-N	434.416	1.549	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)CS(=O)(=O)c1cccc(Br)c1	731493709	CYZHRYGHQHLKGX-UHFFFAOYSA-N	427.276	1.693	50	20	IDGD	
Cc1ccc(C(=O)NCCNC(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)cc1	732468650	ZJSSLWFPAQBUCR-UHFFFAOYSA-N	434.522	1.133	50	20	IDGD	
CCC(CC)[C@H](CNC(=O)NNC(=O)c1cnn(-c2ccccc2)c1)N1CCOCC1	733338212	ZDMPDJOWRKIQAU-FQEVSTJZSA-N	428.537	1.953	50	20	IDGD	
O=C(C[C@H]1OCCc2ccccc21)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	734416976	GBSUVOIPBFRPFZ-HXUWFJFHSA-N	443.525	1.936	50	20	IDGD	
Cc1ccccc1[C@@H](C)CC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	734767695	BKMZCKACAJKDLP-KRWDZBQOSA-N	445.541	1.971	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNS(=O)(=O)c2csc(C(=O)O)c2)CC1	734807191	JYBKPIMTPCJMKD-UHFFFAOYSA-N	448.523	1.338	50	20	IDGD	
CC(C)CS(=O)(=O)CCC(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	734826068	VVJQSWIJLLELOV-UHFFFAOYSA-N	434.559	1.177	50	20	IDGD	
Cc1ncc2c(n1)CCC[C@H]2NC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	734952687	TWQQRWAQPAYLGN-OAQYLSRUSA-N	437.548	1.705	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CSc2nnc(C3CC3)n2CCC(N)=O)cc1C	735979868	UQBMWWZPNAZEIT-UHFFFAOYSA-N	436.563	1.517	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCCCOC[C@H]1CCOC1	740903208	JMKVVALJJIUIKG-UONOGXRCSA-N	444.326	1.990	50	20	IDGD	
O=C(CNC(=O)c1c[nH]c2ccccc2c1=O)NNC(=O)c1cccc(Br)c1	742771467	VXNXITYLRMTTIO-UHFFFAOYSA-N	443.257	1.482	50	20	IDGD	
COc1cccc(-c2noc([C@H](C)NC(=O)NNC(=O)CNC(=O)c3cccs3)n2)c1	743577649	FQQBJGFFZLKNAP-NSHDSACASA-N	444.473	1.628	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)[C@@H]2CC(=O)N(c3ccc(F)cc3F)C2)c1	744707658	OWNVAPGMVCIKFU-CQSZACIVSA-N	442.378	1.194	50	20	IDGD	
Cc1ccc(O[C@H](C)CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1	745888046	GYUGSNBSMIGNEZ-OAHLLOKOSA-N	434.518	1.657	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)N[C@@H]2CC(=O)N([C@@H]3C[C@@H]3c3ccccc3)C2)cc1	745914073	HQZASSXTLAQBDK-MISYRCLQSA-N	433.468	1.424	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](CC(=O)NNC(=O)C(=O)Nc1ccccn1)c1ccccc1	746213782	YHBUMIKVLBSHGE-OAHLLOKOSA-N	427.461	1.824	50	20	IDGD	
CC(C)NS(=O)(=O)CCNC(=O)CCC(=O)C(C#N)=C1N(C)c2ccccc2N1C	746526578	HLIKSCWNGZCHIX-UHFFFAOYSA-N	433.534	1.101	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCO[C@@H](C(=O)OC(C)(C)C)C1	746678512	JUZYVGCKFQXGKE-OAHLLOKOSA-N	427.885	1.152	50	20	IDGD	
O=C(Cn1c(=O)ccn(Cc2ccccc2)c1=O)NNC(=O)c1ccc(Cl)cc1F	747332668	VUQBAMWYIJCZFH-UHFFFAOYSA-N	430.823	1.312	50	20	IDGD	
C[C@@H](c1ccc([S@](C)=O)cc1)N(C)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	747500969	OINPGSUBHBWGBM-IWAYBZMOSA-N	444.561	1.864	50	20	IDGD	
CC(=NNC(=O)Cc1cn2ccccc2n1)c1cccc(S(=O)(=O)N2CCOCC2)c1	747637581	CIBAHKJMNLSQKW-UHFFFAOYSA-N	441.513	1.438	50	20	IDGD	
CCCCN1C(=O)CC[C@H](C(=O)NNC(=O)C(=O)N2CCCC2)[C@@H]1c1ccccc1OC	748247845	VWLAYLVLDQHWTE-PXNSSMCTSA-N	444.532	1.545	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)(F)F)cc1)[C@H]1CC[C@H](C(F)(F)F)NC1=O	748517977	BWQKXFONBODJDU-VHSXEESVSA-N	433.330	1.880	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNS(=O)(=O)c1sc(C(=O)OC)cc1OC	748790299	BKUFMMQQBFGDQY-UHFFFAOYSA-N	444.487	1.331	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)NCC(=O)N2CCN(Cc3ccccc3)CC2)cc(C#N)n1C	749617668	REHYWSSZLYIJAH-MTJSOVHGSA-N	430.512	1.573	50	20	IDGD	
C[C@@H](C(=O)OCC(=O)NNC(=O)c1ccc(Cl)cc1)N1C(=O)[C@@H]2CCCC[C@H]2C1=O	750280452	PRUWPMQWSVLOKS-NILFDRSVSA-N	435.864	1.208	50	20	IDGD	
COc1cc(OC)cc(N2C[C@@H](C(=O)NNC(=O)CNc3ccc(C)cc3)CC2=O)c1	752792791	QIZXFASYFSTCQW-HNNXBMFYSA-N	426.473	1.625	50	20	IDGD	
O=C(NNc1ccc(C(F)(F)F)nn1)c1ccc2c(c1)S(=O)(=O)N(C1CC1)C2=O	755197500	OHSFJJZOXSIBCD-UHFFFAOYSA-N	427.364	1.559	50	20	IDGD	
O=C(CCSCc1nc(O)c2c3c(sc2n1)CCC3)NNC(=O)Cc1cc[nH]n1	755281614	KDAGBNHJCOYBAD-UHFFFAOYSA-N	432.531	1.622	50	20	IDGD	
COc1ccc(C(F)(F)C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1	755398494	OAIPUSMNLKFIIL-UHFFFAOYSA-N	427.429	1.499	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)c1	756206144	KILYYAJCLMWVRA-UHFFFAOYSA-N	431.518	1.454	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)COc2ccccc2C#N)cc1N1CCCS1(=O)=O	756703215	FXIAIGMOXYSEHQ-UHFFFAOYSA-N	443.485	1.638	50	20	IDGD	
O=C1C[C@H](Cc2ccc(NC(=O)NNC(=O)c3cccc(OC(F)F)c3)cc2)C(=O)N1	756816635	SIUDSAJSUFKPMJ-ZDUSSCGKSA-N	432.383	1.960	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1oc2ccccc2c1COc1ccccc1	758045570	COGSKXNDOANAND-ZDUSSCGKSA-N	431.470	1.711	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)c1nc(-c2ccccc2)oc1-c1ccccc1	758047362	MWVSOJNSHNBDIM-CYBMUJFWSA-N	428.470	1.707	50	20	IDGD	
COC(=O)[C@@H](C)Oc1ccc(C=NNC(=O)c2sc(N3CCOCC3)nc2C)cc1	758364655	HNTWWDRKVJONLZ-CQSZACIVSA-N	432.502	1.992	50	20	IDGD	
CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCN(S(=O)(=O)CBr)CC1	758526999	FBAWFHGNNMJTSA-NSHDSACASA-N	428.349	1.116	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)NCc2ccc3c(c2)C(=O)NCC3)c2ccccc2c1=O	758684981	SMNWAUWJNFXILX-UHFFFAOYSA-N	448.483	1.408	50	20	IDGD	
Cc1c(C(=O)NNc2nccc(N3CCOCC3)n2)nnn1-c1ccc(F)c(Cl)c1	762859995	GCTCRZMVIZYQET-UHFFFAOYSA-N	432.847	1.752	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(F)cc1Br	763467393	DCXJAEVQCMDCTL-UHFFFAOYSA-N	425.170	1.896	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3c[nH]c4ccccc34)cn2)C[C@H](C)O1	763539862	ANHKQKPIDZQMPY-KBPBESRZSA-N	436.472	1.576	50	20	IDGD	
CC(C)(C)c1ccc(OCC(=O)NNC(=O)C(=O)Nc2nn(C(C)(C)C)cc2C#N)cc1	763601418	ZDJDSLKWWYDVAQ-UHFFFAOYSA-N	440.504	1.972	50	20	IDGD	
COC(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)COc2ccc(OC)cc2)c1	763663316	GZIYJAUXKMWJCN-UHFFFAOYSA-N	435.820	1.300	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C)c(C)c2)cc1	763680534	QQKRYTGQWARBFT-UHFFFAOYSA-N	448.501	1.230	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)C(=O)Nc1ccnn1CC1CC1	763694730	LJUIAYAMKVHDOD-UHFFFAOYSA-N	436.266	1.221	50	20	IDGD	
CN(C)CCOc1ccc(NC(=O)C(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)cc1	763733995	JBVRNYNOHWZCNC-UHFFFAOYSA-N	428.533	1.929	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2cccc(OC[C@H]3CCCO3)c2)c1	763773504	YNLVXOYDRMKVPT-QGZVFWFLSA-N	443.456	1.661	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2cc(F)c(OC)c(F)c2)c2ccccc2c1=O	763785649	KOEFTLAMYMLGSP-UHFFFAOYSA-N	445.382	1.103	50	20	IDGD	
CC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)c1	763790463	JRMOHTSFEGGVEH-UHFFFAOYSA-N	435.440	1.580	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)NC(=O)CO2	763855421	WKTOFAWMNJEKAT-CYBMUJFWSA-N	448.435	1.724	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(-n3cccn3)cc2)cc1	763859845	GKDDOTUBMVYGCT-HNNXBMFYSA-N	437.456	1.824	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1cccc(CN2CCCC2=O)c1	763865000	MZBOVPANQWFJJB-CQSZACIVSA-N	442.447	1.502	50	20	IDGD	
CC(=O)N1CCc2cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc3ccc(F)cc3)ccc21	763871945	IYGMHUSJNZGQTM-LBPRGKRZSA-N	428.420	1.288	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)c(C)c1	763872147	KFIATWUDRSQRJL-AWEZNQCLSA-N	433.436	1.713	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(C(C)=O)cc2)cc1F	763878576	RLJCPENYMLXXLO-ZDUSSCGKSA-N	431.420	1.980	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)Cc3ccc(F)cc3)cc2)C[C@@H](C)O1	763920317	HCTGOSWLIDFKFI-GASCZTMLSA-N	428.464	1.768	50	20	IDGD	
CCOC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1	764007078	ZGLIQDMLTSJYJA-UHFFFAOYSA-N	428.401	1.426	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])o1	764043867	YSAVVYMUPFIIMP-NSHDSACASA-N	434.430	1.438	50	20	IDGD	
Cn1cnnc1-c1cccc(NC(=O)C(=O)NNC(=O)Cc2ccc3ccccc3c2)c1	764086128	XFPYFTUGGQSVLJ-UHFFFAOYSA-N	428.452	1.964	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(I)c2)c(O)c1	764109964	NGGUXFXDYLAVMU-UHFFFAOYSA-N	439.209	1.705	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2ccc(C(=O)N(C)OC)cc2)cc1	764131749	NGRYHEFWJGOFOA-UHFFFAOYSA-N	428.445	1.047	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)o1	764139328	QRQKZRFMFGTHGY-UHFFFAOYSA-N	433.421	1.438	50	20	IDGD	
CC(C)OC(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)c1	764154344	PNWRGBGTVZDNKJ-KRWDZBQOSA-N	445.859	1.995	50	20	IDGD	
CC[C@H](C)NS(=O)(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2cccc(C#N)c2)c1	764233681	CUYYBCSJFOEAAW-ZDUSSCGKSA-N	443.485	1.035	50	20	IDGD	
O=C(Cc1ccccn1)NNC(=O)C(=O)Nc1cc(Cl)ccc1OC[C@@H]1CCCO1	764264770	UAFOBEDENLIKCZ-HNNXBMFYSA-N	432.864	1.621	50	20	IDGD	
C[S@](=O)c1cccc(NC(=O)C(=O)NNC(=O)c2cc(F)ccc2Br)c1	764270421	MRROGHUPWBJUFG-SANMLTNESA-N	442.266	1.725	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2cc(Br)ccc2O)c(OC)c1	764278700	WEKQPJDUDRPQLB-UHFFFAOYSA-N	438.234	1.572	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cnn(CC3CC3)c2)cc1Br	764327156	VTVLLWLVOGVOEQ-UHFFFAOYSA-N	436.266	1.464	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(NC(=O)C(=O)NNC(=O)C2CCC2)ccc1Cl	764335499	TWTXQZGQFGGJMI-UHFFFAOYSA-N	430.914	1.257	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc4nccnc4c3)n[nH]2)cc1	764385173	UUOISKSSRDZFLZ-UHFFFAOYSA-N	429.440	1.982	50	20	IDGD	
CCOc1cc(NC(=O)C(=O)NNC(=O)c2ncccc2C)c([N+](=O)[O-])cc1OCC	764388339	GOVBAXYFQXVJGF-UHFFFAOYSA-N	431.405	1.495	50	20	IDGD	
COC(=O)c1cc(C)ccc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	764388520	TYYKNHDXHSLAOX-UHFFFAOYSA-N	439.403	1.711	50	20	IDGD	
C=CCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)CSc2ccccc2OC)cc1	764392317	DIBHTEZVQWGOAN-UHFFFAOYSA-N	442.497	1.489	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1ccc2c(c1)NC(=O)[C@H](C)O2	764392974	MZHSHCNMEOQLEH-NSHDSACASA-N	444.469	1.293	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1C	764399744	LOAXABYFKCFVFH-HNNXBMFYSA-N	440.456	1.796	50	20	IDGD	
CCOC(=O)COc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2F)c1	764413085	MJZRRXFVBSAEMH-UHFFFAOYSA-N	437.811	1.821	50	20	IDGD	
Cc1ccc(C)c(Sc2ccc(NC(=O)C(=O)NNC(=O)[C@H]3COCCO3)cc2)c1	764430052	RHTQEWSYTXLJHK-QGZVFWFLSA-N	429.498	1.956	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)c3ccc(CN4C(=O)CNC4=O)cc3)n[nH]2)cc1	765571276	ICRLOWKVWGFYQF-UHFFFAOYSA-N	446.467	1.766	50	20	IDGD	
C[C@H]1CCCC[C@]12NC(=O)N(CC(=O)NNC(=O)c1cc(-c3ccc(F)cc3)[nH]n1)C2=O	765617313	GCBYCNFYJOLSEB-QKVFXAPYSA-N	442.451	1.478	50	20	IDGD	
O=C(CCC(=O)c1cccs1)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765738828	OTIBNVIACHLRBE-UHFFFAOYSA-N	428.514	1.316	50	20	IDGD	
Cc1cc(N(C)C)cc(C)c1NC(=O)C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C	766260655	UAQVENHVAWVKPB-UHFFFAOYSA-N	435.525	1.760	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)c2csc(S(C)(=O)=O)c2)c1	766555594	KYKKVHOWGFZNMB-UHFFFAOYSA-N	433.305	1.998	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)Cn1cc2ccccc2n1	766660597	OIBATGRGHVGKAB-UHFFFAOYSA-N	440.935	1.655	50	20	IDGD	
COc1ccc(C(=O)CNC(=O)CCC(=O)NNc2ccccc2S(C)(=O)=O)cc1	766668976	AZAKIKBVRMEUQR-UHFFFAOYSA-N	433.486	1.321	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)[C@H]1CS[C@H](Cc2ccccc2F)C(=O)N1	766669057	FXKPNGMJOYVSQU-HZPDHXFCSA-N	437.518	1.515	50	20	IDGD	
CC(C)c1cc(NC(=O)C(=O)NNC(=O)C2=S=C3CCCC3=C2)n(-c2ncccn2)n1	768237409	JZBHILRIWPBXJA-UHFFFAOYSA-N	439.501	1.074	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)[C@H]2CN(Cc3ccccc3)CCO2)n[nH]1	768273263	BIUQUPVWVPUXQU-OAQYLSRUSA-N	435.484	1.747	50	20	IDGD	
O=C(COC(=O)c1csc(-c2ncccc2F)n1)NNC(=O)c1ccc([N+](=O)[O-])cc1	768657073	SLIIURARNVNXKO-UHFFFAOYSA-N	445.388	1.870	50	20	IDGD	
O=C(CCC(=O)c1ccc2c(c1)CCC(=O)N2)NNC(=O)c1nn(-c2ccccc2)cc1O	768687197	LYWRFYWMROMHIA-UHFFFAOYSA-N	447.451	1.887	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)Cn1c(S)nc2ccccc2c1=O	768735866	AQZXFHQUIFEZST-UHFFFAOYSA-N	434.499	1.241	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)c2cc(Br)ncc2[N+](=O)[O-])cc1	769831394	FGJCIYWFPYMJFX-UHFFFAOYSA-N	437.206	1.679	50	20	IDGD	
COC(=O)C[C@@]1(NC(=O)CCC(=O)C(C#N)=C2N(C)c3ccccc3N2C)CCCOC1	771658148	XNHNZTYUBDSQJL-QHCPKHFHSA-N	440.500	1.886	50	20	IDGD	
C[C@]1(c2ccc(F)c(Cl)c2)NC(=O)N(CC(=O)NNC(=O)CNc2ccccc2)C1=O	771716563	IJMXLMXNHWVFJZ-HXUWFJFHSA-N	447.854	1.506	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)c1cccc(S(=O)(=O)NCC2CC2)c1	771996469	VZHRRMCXFLTFCI-ZDUSSCGKSA-N	425.507	1.114	50	20	IDGD	
COc1cc(Cl)ccc1NC(=O)C(=O)NNC(=O)c1cc(Br)cn1C	773499850	MKZLDBVRSQHBTR-UHFFFAOYSA-N	429.658	1.849	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccc(C(F)(F)F)cn2)nc1	773638684	LWXHWROUYGMEFG-UHFFFAOYSA-N	446.411	1.264	50	20	IDGD	
CC(C)N(C)S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccccc2[N+](=O)[O-])cc1	773653818	LLYLJGUHYUJELF-UHFFFAOYSA-N	435.462	1.706	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1	776615781	ATQBNKMHWANZOJ-INIZCTEOSA-N	445.545	1.618	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)N[C@@H]2CCN(CCCc3ccccc3)C2=O)c1	776627989	UPQANPAQWXWVSA-LJQANCHMSA-N	430.530	1.950	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)[C@]1(F)CCN(C(=O)OCc2ccccc2)C1	778435993	BAXHWHBJBQGRGZ-FQEVSTJZSA-N	438.456	1.409	50	20	IDGD	
CC(C)NC(=O)C(=O)NNS(=O)(=O)c1ccc(Br)c(Cl)c1Cl	780371160	WSBZGWSDLFVUKA-UHFFFAOYSA-N	433.111	1.590	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2ccc(S(=O)(=O)N3CCCCC3)cc2)nc1	782145643	LRGADOKLYQNIPH-UHFFFAOYSA-N	433.490	1.347	50	20	IDGD	
Cc1cc(NC(=O)CSCC(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)no1	782713045	CITGQKDWEWKVGJ-UHFFFAOYSA-N	440.865	1.313	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2ccc(S(=O)(=O)/N=C3/CCCN3C)cc2)cc1	783021780	HLWSXXZYLQCTIN-MOHJPFBDSA-N	445.501	1.590	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(F)c(NC(=O)C(=O)NNc2ccc(F)c(F)c2F)c1	784807274	SVIYRTCOPUYADJ-UHFFFAOYSA-N	434.371	1.575	50	20	IDGD	
O=C(NNc1ccnc(Br)c1)C(=O)Nc1cccc(CN2CCOC2=O)c1	784828425	HUGMHQJLJTZQTI-UHFFFAOYSA-N	434.250	1.878	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2cccc([N+](=O)[O-])c2)cc1S(=O)(=O)NC1CC1	784831997	WOCRJEGVRJWXSW-UHFFFAOYSA-N	449.445	1.126	50	20	IDGD	
C[C@@H](c1ccccc1)n1ccc(NC(=O)C(=O)NNc2cccc(S(C)(=O)=O)c2)n1	784844531	LQGIJTTURCIEAV-AWEZNQCLSA-N	427.486	1.978	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2cc(-c3ccsc3)nn2C)cc1	787541632	BEJKZSDJSXWLOJ-UHFFFAOYSA-N	427.486	1.876	50	20	IDGD	
CN1CCN(C(=O)NNC(=O)c2ccc(S(=O)(=O)N(C)C3CCCCC3)cc2)CC1	788166293	KWZUHPFXEMDOTR-UHFFFAOYSA-N	437.566	1.242	50	20	IDGD	
O=C(NC[C@H](Cc1cccc(F)c1)C(=O)N1CCOCC1)NNc1cncc(Cl)n1	789308253	BSQBLOPOVPGIIG-AWEZNQCLSA-N	436.875	1.613	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2ccnn2-c2nc(C)cc(C)n2)c2ccccc2c1=O	789308892	AGIYUPQPGPLQPG-UHFFFAOYSA-N	447.459	1.475	50	20	IDGD	
COc1cc(NNC(=O)C(=O)Nc2ccc(N3CCCS3(=O)=O)cc2)ccc1Cl	789796263	QGJASIOXINYWOR-UHFFFAOYSA-N	438.893	1.970	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Cc2cccc(C(F)F)c2)cc1	790484265	WXLFFHWWXTVDIT-UHFFFAOYSA-N	425.457	1.943	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@@H](C(=O)NNc2cccc(F)c2[N+](=O)[O-])[C@@H](C)O)cc1	791148251	UWUGHUXUHCRLPI-IAQYHMDHSA-N	426.426	1.213	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2O)c(F)cc1C	793026722	UCCGPJFSNXYPRI-UHFFFAOYSA-N	433.392	1.181	50	20	IDGD	
Cn1ccnc1C(=O)c1ccc(NC(=O)C(=O)NNc2ccc3c(=O)[nH]ccc3c2)cc1	793068719	CCEYSZDVBUCJIM-UHFFFAOYSA-N	430.424	1.574	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2ccc(OC(C)C)c(C(N)=O)c2)c1	796992692	VTZZMSKKZBJJPM-UHFFFAOYSA-N	442.472	1.354	50	20	IDGD	
COC(=O)c1cc(Cl)c(Cl)cc1NC(=O)C(=O)NNC(=O)c1scnc1C	797535317	MEKKRKHQGLSXNJ-UHFFFAOYSA-N	431.257	1.945	50	20	IDGD	
Cc1ccc(N2CCOCC2)cc1NC(=O)C(=O)NN=c1sc2ccccc2n1C	797537175	BNBMKTLKUSWPFE-UHFFFAOYSA-N	425.514	1.955	50	20	IDGD	
CC(C)Oc1ccc(NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1C(N)=O	797677789	XSQBOSZNJHHDRF-UHFFFAOYSA-N	438.444	1.286	50	20	IDGD	
COc1ccc(-c2nnc(S)n2CCC(=O)NNC(=O)CNc2ccccc2)cc1	799381312	YODIVYJJEQJTJK-UHFFFAOYSA-N	426.502	1.892	50	20	IDGD	
CCc1cccc(C)c1NNC(=O)C(=O)Nc1ccc(S(=O)(=O)NCCOC)cc1	799844124	KQFIIGZWAPBUDS-UHFFFAOYSA-N	434.518	1.564	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)[C@@H](C)NC(=O)c2cc3c(C)nn(C)c3s2)cc1	802063253	XAIIQZYGXWBVFJ-LLVKDONJSA-N	430.490	1.923	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)N[C@H]1CCN(C(=O)COc2ccccc2)C1	802467326	RNRFPZFQJDCYFL-HNNXBMFYSA-N	427.417	1.219	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNc2ccc([N+](=O)[O-])cc2)(S(C)(=O)=O)CC1	802821461	PAVDHOCMXUHNGK-UHFFFAOYSA-N	442.494	1.852	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)C(=O)Nc1nc(-c2ccco2)cs1	806978039	JNBNBFLOGGBPOJ-UHFFFAOYSA-N	437.478	1.794	50	20	IDGD	
CCOc1ccc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)c3ncn(C)n3)cc2)cc1	809982605	UQDFSERMNDDMDN-UHFFFAOYSA-N	444.473	1.089	50	20	IDGD	
CCOC(=O)c1cccc(NC(=O)c2cccc(NC(=O)C(=O)NNC(=O)C3CC3)c2)c1	810385729	XEZYUFXBSLESMU-UHFFFAOYSA-N	438.440	1.612	50	20	IDGD	
CN(C(=O)OC(C)(C)C)c1ccc(C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)s1	810581198	MIJYMZUBKDEEBA-JTQLQIEISA-N	432.524	1.251	50	20	IDGD	
Cc1cc(CNC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])cc(N2CCCC2)n1	812542263	VWUWXIWBDUBIRO-UHFFFAOYSA-N	428.449	1.808	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NN=C(C)c3cnnn3C)c2)cc1	814689092	INBIZUKDMDJQKU-UHFFFAOYSA-N	428.474	1.779	50	20	IDGD	
O=C(CSc1nnc(O)nc1O)NN=C1COc2cc(Br)c(F)cc21	814785225	TXZSCVARPVIFJB-UHFFFAOYSA-N	430.215	1.189	50	20	IDGD	
CC1(C)CC(=NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)c2sc(N)nc2C1	814879145	RSJFNRVQZVFINH-UHFFFAOYSA-N	440.573	1.976	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1cn(Cc2ccccc2)nn1	815566635	ZUZIBEYARAHPAD-ZDUSSCGKSA-N	426.408	1.019	50	20	IDGD	
CCC[C@@H](C(=O)NNC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1)S(N)(=O)=O	816828555	IWANEGMYPUYQQT-INIZCTEOSA-N	442.501	1.153	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2ccc(O)c(C(=O)NNC(=O)[C@H]3CCCO3)c2)cc1	817216423	ZYQSFHMYHHEGDR-QGZVFWFLSA-N	435.458	1.142	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccccc1F)NNC(=O)Cc1nc(-c2ccccc2)cs1	908386016	UJXKZHLXKPYLRF-UHFFFAOYSA-N	448.501	1.618	50	20	IDGD	
COc1cc(C)c(S(=O)(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)c(C)c1	914845682	JGAWKMLKVTWHOA-UHFFFAOYSA-N	447.922	1.236	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)NCCCN2C(=O)NC3(CCCC3)C2=O)cc1OC	915906023	CQVDGUXUAOCCSN-UHFFFAOYSA-N	447.492	1.293	50	20	IDGD	
CC(C)(C)n1cc(C=NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)cn1	915937226	NTURWRRFQYFHDW-UHFFFAOYSA-N	447.561	1.742	50	20	IDGD	
COc1cc2c(cc1OC)C(=NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1)C(=O)N2	915949490	KFJVHLGYSNZDKJ-UHFFFAOYSA-N	438.849	1.091	50	20	IDGD	
Cc1oc(C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)cc1S(=O)(=O)N1CCCC1	916145184	CDHYMPXLMIHJRC-UHFFFAOYSA-N	443.485	1.837	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NN=Cc1cccnc1)N(S(C)(=O)=O)CC2	916356339	SHOOUADLDFQHEX-QGZVFWFLSA-N	432.502	1.498	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)CCc2nc3ccccc3o2)cc1OC	917234990	RTRQHMUUHDIKSB-UHFFFAOYSA-N	427.413	1.782	50	20	IDGD	
CSC[C@H](C(=O)NNC(=O)c1c[nH]c2ccccc12)N1C(=O)[C@H]2CCCC[C@@H]2C1=O	917359051	UIVDIWMAKGPYCW-GRDNDAEWSA-N	428.514	1.836	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)c2ccccc2c1=O	917387352	QZYXWPFPRABWGC-UHFFFAOYSA-N	433.384	1.102	50	20	IDGD	
CCn1c(NNC(=O)CN(C)C(=O)c2ccc(Br)o2)nc2ccccc2c1=O	917394067	ZNHDZNLLVZDQPN-UHFFFAOYSA-N	448.277	1.987	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)c2cccnc12	917728940	XQIFYGSWEUTHRH-UHFFFAOYSA-N	428.470	1.808	50	20	IDGD	
O=C(CNS(=O)(=O)c1c[nH]c2ncccc12)NNC(=O)CC12CC3CC(CC(C3)C1)C2	918757745	FOAJZZPTICXAGD-UHFFFAOYSA-N	445.545	1.595	50	20	IDGD	
C[C@H]1CCCN(Cc2csc(NC(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)n2)C1	920931979	LQLNWSWUYLGKAQ-ZDUSSCGKSA-N	441.521	1.817	50	20	IDGD	
NC(=O)c1ccc(/C=C\C(=O)N2CCC[C@@H]2C(=O)NNC(=O)c2ccccc2Cl)cc1	1317965720	XONLAZDFNJQGBE-ZVBPTUHVSA-N	440.887	1.904	50	20	IDGD	
O=C(Cn1cnc2ccccc21)NNC(=O)c1ccc(NC(=O)c2ccc(O)nc2)cc1	1318501478	AUUIQVNLFJFLQY-UHFFFAOYSA-N	430.424	1.850	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2ccc3nnc(C(F)F)n3c2)cc1OC	1319322690	WWBPEMRLXFODBD-UHFFFAOYSA-N	449.370	1.302	50	20	IDGD	
O=C(NNC(=O)[C@H]1Nc2ccccc2S(=O)(=O)N1)Nc1ccc(OC(F)F)cc1	1321789891	XDVSEMBOKVJJJF-ZDUSSCGKSA-N	427.389	1.171	50	20	IDGD	
C[C@@H](O)CNS(=O)(=O)c1ccc(C(=O)NNC(=S)Nc2cccc(Cl)c2)cc1	1335651159	WTDLLKGFRGQQGN-LLVKDONJSA-N	442.950	1.631	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(C)nc(O)c2)C1	1778038731	HANGUWUGZINCEX-JXXFODFXSA-N	425.913	1.477	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)CCN3Cc4ccccc4C3=O)C2)C1	1778184080	XRADAGYEBVFMFZ-GCJKJVERSA-N	433.936	1.880	50	20	IDGD	
Cc1ccn2c(C(=O)N3CCO[C@]4(CCN(C(=O)CO[Si](C)(C)C)C4)C3)cnc2c1	1779299770	ZCKJMGOGPOYDKV-NRFANRHFSA-N	430.581	1.938	50	20	IDGD	
O=C(c1cc2ncsc2[nH]1)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1779338466	OBAKQJLZGCVKPY-ABAIWWIYSA-N	431.287	1.758	50	20	IDGD	
COc1cc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)ccn1	1779555060	CGMQMPIMNZKROX-SCLBCKFNSA-N	426.311	1.565	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccnnc1O)C2)[C@@H](F)Br	1780774048	UXIRESJXQOBCRI-XHBSWPGZSA-N	431.262	1.000	50	20	IDGD	
COc1cc(CC(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](F)Cl)CCO3)ccc1[N+](=O)[O-]	1781190506	ZDGDUIPOYCAFOQ-AEFFLSMTSA-N	429.832	1.510	50	20	IDGD	
O=C(c1c[nH]c2nccc-2c1)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781331055	KGBDMTZUUXSTQR-DYVFJYSZSA-N	425.258	1.649	50	20	IDGD	
COC(=O)C1(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)CO[Si](C)(C)C)C3)CC1	1781812102	QAXQRJJBZANLNR-DNVCBOLYSA-N	426.586	1.305	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)nc(O)c1)C2	1781997953	LIHLSDINKPRYNX-WHWRDJHUSA-N	442.310	1.404	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc([N+](=O)[O-])c(O)cc3C)C2)C1	1782103929	DIACGCOKUQSZCL-IFXJQAMLSA-N	441.868	1.306	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnccc1N(C)C)C2	1782171187	RYESWKZCSLQUDS-HGHGUNKESA-N	438.956	1.529	50	20	IDGD	
C[C@@H](Cc1ccc(F)cc1)C(=O)N1CC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1	1782928602	JOQRZCVHGNUPEK-GAJHUEQPSA-N	448.539	1.207	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccnc3S)[C@H]2C1	1783548812	PHLOZCWHPIGNQG-XWUBHJNHSA-N	428.352	1.747	50	20	IDGD	
COc1ccc(/C=C/C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)c(F)c1	1783655947	PSNOOHGMOQLGHI-IRSIMQGLSA-N	426.872	1.277	50	20	IDGD	
O=C(C[C@H]1COc2ccccc2O1)N1CCO[C@@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783942121	IGENXGKLXZADKN-DJJJIMSYSA-N	429.300	1.850	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(=O)oc3)C[C@@H]21	1783967115	BTJBRVTZTZFTEB-JURCDPSOSA-N	427.295	1.264	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(Cl)nc3Cl)C[C@@H]21)[C@@H](O)CCl	1784091405	SMHODAYPYCXWEI-BQUFFADESA-N	436.723	1.581	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCCC(=O)OC(C)(C)C)[C@H]2C1	1784137458	SVCDTJUPSQYKBR-QAETUUGQSA-N	446.972	1.732	50	20	IDGD	
C[C@H](Oc1ccccn1)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1784488103	MWLOEJRENXVYKQ-RVSPLBMKSA-N	430.274	1.369	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@]3(C)CC=CCC3)C2)C1	1784752350	IBZRURPPSFNAEF-VWPSMMGISA-N	441.532	1.697	50	20	IDGD	
Cc1cc(C)c(C(=O)N2CC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)c(C)c1	1784985834	HVZIJSJQYMGKRH-DEOSSOPVSA-N	436.317	1.049	50	20	IDGD	
O=C1CC(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](Br)Cc2ccccc2)CCO3)C1	1785409004	FLRFVDJACXXJRB-RXVVDRJESA-N	449.345	1.802	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C=C/C(=O)c3cccs3)[C@H]2C1	1787513540	KAOWXPLDSLYGQM-LDFDMIBHSA-N	440.949	1.721	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4nccnc4c3)[C@H]2C1	1788031258	WJJLBVCQTKJHNS-FPXQBCRKSA-N	432.908	1.477	50	20	IDGD	
Cc1cnn([C@@H](C)C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]3C2)c1	1789926986	MXXWUJGMHHUDBO-YYFQZIEXSA-N	431.306	1.423	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cn3cc(Cl)cn3)C[C@@H]21	1790961852	SFHZRUMGVHAVPP-MHEUCROKSA-N	447.761	1.690	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)Nc3cnccn3)C[C@@H]21	1791056288	RAGQFGMOWSTTNS-AICCOOGYSA-N	440.342	1.040	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1	1791567865	JGHGMYCMZMWUBJ-GOSISDBHSA-N	430.697	1.368	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](Br)Cc1ccccc1)C2)c1ccno1	1794741244	NGCGGTQKLJXXCN-DFGXFYAUSA-N	448.317	1.884	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ncc(Cl)cn1	1794877950	FAPABZBUQAHSJT-FTORJNITSA-N	443.895	1.516	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc3ccccc3n1)C2	1795114538	TVNBWVDUHQETQK-IVWMJMPLSA-N	433.306	1.618	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CC(=O)N(Cc3cccs3)C1)C2)[C@H](F)Cl	1796361504	GZLAMYRLGFAXJA-XRQSXFTLSA-N	443.928	1.221	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1c(C)nn(C)c1C)C2	1796890815	KVNXYXZIWRUPTJ-XTUBRDOVSA-N	439.520	1.423	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1nnc(-c2ccccc2)o1	1797821701	OFYJVFYDLFSCSW-QKPAOTATSA-N	434.880	1.194	50	20	IDGD	
CCc1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)cc(C)n1	1798440505	YORPFOAKZWVHHS-BCDXTJNWSA-N	436.516	1.517	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2)c1ccc([N+](=O)[O-])c2c1OCO2	1798625945	DMTATJNLBBFAFB-GDGVSTKUSA-N	429.788	1.061	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)no1	1798886326	LQWWUZWNCMEVRR-RNJOBUHISA-N	442.900	1.764	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C(=O)C1CC1)C2	1799219536	PHYLHZSIKSBYOF-QDMKHBRRSA-N	429.429	1.751	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(-c2ccc(O)nn2)cc1)[C@H](O)CCl	1800814970	AGAUUTKVJWYWEU-KYHPRHEASA-N	430.892	1.701	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2	1800959265	KHMNNPUOJLIVSO-RBTXIFOQSA-N	447.301	1.022	50	20	IDGD	
CC(C)(C)OC(=O)N1C(=O)CC[C@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2	1801158506	MWWQMDXJMDQSSX-XXUMUBMXSA-N	447.891	1.037	50	20	IDGD	
CC(C)(C)n1ccc(C(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)n1	1803141517	OLXBNADQTILDTA-NXHRZFHOSA-N	433.940	1.952	50	20	IDGD	
CC(=O)O[C@H](C(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)C(C)C	1803143072	STCZHUMDEYEIAG-BDXSIMOUSA-N	425.913	1.275	50	20	IDGD	
Cc1c(C(=O)N2CC[C@H](CNC(=O)[C@@H](F)Cl)[C@H]2c2cccnc2)cn2[nH]cnc(=O)c12	1808315445	NNJDWOLIWMALSE-KBRIMQKVSA-N	446.870	1.580	50	20	IDGD	
O=C(Cn1ccccc1=O)N1CCCC2(CCN(C(=O)[C@@H](F)Br)CC2)C1	1810035105	MFGRQPLYWVNXRE-MRXNPFEDSA-N	428.302	1.770	50	20	IDGD	
Cc1cccc(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)c1	1811863460	VWBWAAZERSRVIA-JTHBVZDNSA-N	443.312	1.703	50	20	IDGD	
Cc1cc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)[nH]n2)no1	1816527408	FGZQTCVFGYXKIH-MRXNPFEDSA-N	438.448	1.324	50	20	IDGD	
Cc1nc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)cs1	1817470820	HUOJGWQARHJYKE-QGZVFWFLSA-N	439.306	1.474	50	20	IDGD	
CCc1nc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)co1	1817472578	XKUJUYNQHPLBGT-KRWDZBQOSA-N	437.265	1.260	50	20	IDGD	
C[C@H](Br)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2nc3ncccn3n2)[nH]n1	1822187457	VIPQLGFTSKIPFC-CMPLNLGQSA-N	447.297	1.937	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnncc2C(=O)O)[nH]n1	1822373128	VAZLHLRAQLXKCC-JSGCOSHPSA-N	436.856	1.458	50	20	IDGD	
Cc1noc(C)c1CC(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1	1822410665	OABNZDKJZFTPLM-QGZVFWFLSA-N	445.524	1.622	50	20	IDGD	
C=C(CC(=O)OCC)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1	1822415954	VFRDWPSITGVLHN-INIZCTEOSA-N	448.524	1.284	50	20	IDGD	
COCCOCCOCCC(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)CC1	1824185610	JRRXLTKQYDRRAZ-OALUTQOASA-N	448.988	1.276	50	20	IDGD	
C[C@@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1)n1ccnc1	1824313688	ZNZZNQJHQOEVOH-UWJYYQICSA-N	438.337	1.057	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1[nH]nnc1C)CC2	1825447000	NMRKBYONMKGIAX-IUCAKERBSA-N	427.328	1.969	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](O)Cc1ccccc1)CC2	1826004411	JAGDRGBASJCVKB-OFQRWUPVSA-N	437.949	1.913	50	20	IDGD	
C=C[C@@H](O)C(C)(C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1	1828889740	VCHQQKYFBVDBJX-RTBURBONSA-N	436.597	1.552	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)C3CC(F)(F)C3)CCO2)C1	1829990416	CQCYJHZGERABFH-JKSUJKDBSA-N	429.291	1.724	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)COC3CCCCC3)CCO2)C1	1830383784	JLROMGWUHLICNW-YLJYHZDGSA-N	432.945	1.046	50	20	IDGD	
Cc1ccc(CCC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)s1	1830726050	NXERWZUNBWEJMT-APWZRJJASA-N	430.954	1.045	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)COc2ccc(O)nn2)CC1	1831116334	GXOXTJZBKWVSEV-CVEARBPZSA-N	440.928	1.435	50	20	IDGD	
C[C@@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)Cc3cnc[nH]3)CC2)CC1	1833263251	GZDBURWXUTTYHB-AWEZNQCLSA-N	440.386	1.555	50	20	IDGD	
Cc1cccnc1CCC(=O)N1CCC(N2CCC(NC(=O)[C@H](O)CCl)CC2)CC1	1833308540	UXTKFSNLUFAWGZ-HXUWFJFHSA-N	436.984	1.494	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)CC34CCCN3CCC4)CC2)CC1)[C@H](O)CCl	1833313241	BQFOAIIHCAOROD-LJQANCHMSA-N	441.016	1.176	50	20	IDGD	
C#CCO[C@@H](C)C(=O)NC1CCN(C2CCN(C(=O)[C@H](C)CBr)CC2)CC1	1833464239	SLYOTZWTFRIDBN-CVEARBPZSA-N	442.398	1.627	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(OC)n3)CCO2)C1	1833762452	TVSRTEQXRGNYLB-YWZLYKJASA-N	425.913	1.568	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)CC(C)(C)O)CC2)CC1	1834572299	UWJOSWSYPTZKIK-CQSZACIVSA-N	432.403	1.750	50	20	IDGD	
CC[C@H](NC)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)CBr)CC2)CC1	1834790413	FQUQIJUVUHWIQH-YOEHRIQHSA-N	431.419	1.587	50	20	IDGD	
CC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)c3cc4ncccn4n3)CC2)CC1	1836397124	RZFLFSSRZYBGPX-KRWDZBQOSA-N	432.956	1.932	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnc4[nH]ncc4c3)CCO2)C1	1836807728	CKTOFWBFBFLFSA-OXJNMPFZSA-N	435.912	1.435	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cccn4nccc34)C2)C1	1837715834	LWHKENMNFZNMKW-OAQYLSRUSA-N	446.580	1.256	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2	1839150155	ZXMFZMBHBCLVHD-IRXDYDNUSA-N	429.772	1.944	50	20	IDGD	
C=CCOCCCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2	1839150480	NTXKYFLIDMCQHB-MOPGFXCFSA-N	437.364	1.662	50	20	IDGD	
O=C(c1ccc(F)s1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839198420	ZXFSTTTWKPOSDM-DOMZBBRYSA-N	439.278	1.648	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc4ccncc34)CCO2)C1	1839509090	KGBCGFPIANNPHX-UGKGYDQZSA-N	447.919	1.559	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC12CN(C(=O)C1(c3ccccc3)CCCC1)C2	1843012680	DTXNVKACJLDOBR-UHFFFAOYSA-N	432.329	1.695	50	20	IDGD	
O=C(C(Cl)Cl)N1CC2(CCCN2C(=O)[C@H]2CN(Cc3ccccc3)CCO2)C1	1843926024	WQSCTSRUYBVWKM-MRXNPFEDSA-N	426.344	1.895	50	20	IDGD	
Cc1nc2ccncc2cc1C(=O)N1CCCC12CN(C(=O)c1cnccc1C(=O)NN)C2	1844025820	AJRVOUJWOOCWKF-UHFFFAOYSA-N	445.483	1.068	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)c1cccc(N3CCCNC(=O)C3)n1)C2	1845163809	VCYPEORYDBONEB-OAHLLOKOSA-N	433.940	1.242	50	20	IDGD	
CC(C)(C)Oc1ccc(C(=O)N2CCCC23CN(C(=O)c2ccc(B(O)O)cc2)C3)cc1	1845388893	PWBUENPBNGOUFB-UHFFFAOYSA-N	436.317	1.675	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@H](C)NC(=O)OCc1ccccc1)C2	1846365001	VNRYEFMEYLTSPS-WBVHZDCISA-N	437.924	1.759	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)CC2(O)CCC2)C1	1846732978	VCKMQPCTXHBDNH-UHFFFAOYSA-N	431.445	1.642	50	20	IDGD	
Cc1cc(O)c(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](O)CCl)cc1Br	1847561948	NOMDIMBMYURVNC-YDHLFZDLSA-N	431.714	1.878	50	20	IDGD	
C[C@@H]1[C@@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](O)CCl)CCN1C(=O)OC(C)(C)C	1847568697	ISZDZFIUMHVTAR-YXMSTPNBSA-N	429.945	1.433	50	20	IDGD	
COc1ccc([C@@H]2C[C@H]2C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2cnccc2C(=O)NN)cc1	1847780129	LWRIHEKHGJMOAP-YHELAOLJSA-N	449.511	1.313	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)cc(OC)c1OCc1ccccc1	10213626	GYGNJEOFRZCUPJ-HNNXBMFYSA-N	448.497	1.479	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)Cn1c(=O)[nH]c(=O)c2ccccc21	11236860	HXKWXVBJLNMJBV-AWEZNQCLSA-N	432.436	1.458	50	20	IDGD	
CC[C@H](C)NS(=O)(=O)c1ccc(C(=O)OCC(=O)NNC(=O)c2cccs2)cc1	24656099	ZEJFNMHEPZGPRV-LBPRGKRZSA-N	439.515	1.443	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(F)cc2)C1)c1ccc2c(c1)OCO2	26965428	WDMKPRUFUXCOKF-AWEZNQCLSA-N	449.460	1.416	50	20	IDGD	
CCn1cc(Br)cc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	110015591	UARWAHQMFOZJGO-UHFFFAOYSA-N	443.323	1.596	50	20	IDGD	
Cc1nc(CN2CCC(C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)CC2)cs1	111105100	CTIFUILGLJCMEX-UHFFFAOYSA-N	426.506	1.100	50	20	IDGD	
CC(C)(C)NC(=S)NNC(=O)c1cn(C2CCN(C(=O)OC(C)(C)C)CC2)nn1	725907683	OQKQEDNZVLTFDR-UHFFFAOYSA-N	425.559	1.758	50	20	IDGD	
Cc1noc([C@@H](C)NC(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)n1	726278269	HAKYAWHSVJKMKU-CYBMUJFWSA-N	447.455	1.841	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)[C@@H]2CC(=O)N(Cc3ccc(OC)cc3)C2)cc1OC	726522204	FXNXOEDQVQWTDH-QGZVFWFLSA-N	441.484	1.912	50	20	IDGD	
COC(=O)c1cc(C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)cc([N+](=O)[O-])c1	726867804	VMWNYIIYBJPRPO-UHFFFAOYSA-N	434.430	1.579	50	20	IDGD	
C[C@]1(NNC(=O)NCc2cccc(C(=O)OCc3ccccc3)c2)CCS(=O)(=O)C1	727604089	OCWNCCRDGURMIE-NRFANRHFSA-N	431.514	1.925	50	20	IDGD	
O=C(NNc1nc(-c2cccnc2)no1)[C@@H]1CCCCN1S(=O)(=O)c1ccccc1	728078658	OQAJGYMZGAOPNM-INIZCTEOSA-N	428.474	1.818	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3ccc(NC4CC4)nc3)cc2)CC1	728215602	HRJLIWYSYKJAPX-UHFFFAOYSA-N	430.534	1.349	50	20	IDGD	
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC[C@H](C(=O)NNc2nc(-c3cccnc3)no2)C1	728218393	ZQFKSFRLFBZMIB-AWEZNQCLSA-N	446.493	1.016	50	20	IDGD	
Cn1cc(C(=O)NNS(=O)(=O)c2cc3c(cc2[N+](=O)[O-])OCCO3)c2ccccc21	728261929	ZTJRFNCFGQOCAW-UHFFFAOYSA-N	432.414	1.481	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2)c1ccc(Cl)cc1O	728263239	VUZUPKYNXURDKY-UHFFFAOYSA-N	429.794	1.348	50	20	IDGD	
CCCNC(=O)NNS(=O)(=O)c1cc(S(=O)(=O)N(CC)CC)ccc1Cl	728263246	VWKAPVDNWDMIHP-UHFFFAOYSA-N	426.948	1.273	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2cc(C)n(Cc3ccccn3)c2C)n1	728722586	FZGHBARFWYSZKM-UHFFFAOYSA-N	441.513	1.860	50	20	IDGD	
O=C(NNC(=O)c1cc(F)ccc1Br)NC1CCN(C(=O)C2CC2)CC1	728742878	SGSPZGDSQDKYKV-UHFFFAOYSA-N	427.274	1.933	50	20	IDGD	
Cc1nc2[nH]n(C)c(=O)c2c(C)c1CCC(=O)NNC(=O)c1cc(-c2ccccc2)[nH]n1	729283296	FUFFFGDQFMFGEP-UHFFFAOYSA-N	433.472	1.662	50	20	IDGD	
Cc1ccc(-c2csc3ncn(CCC(=O)NNC(=O)Cc4cc[nH]n4)c(=O)c23)cc1	730091547	HTHVBSPQYMMQGT-UHFFFAOYSA-N	436.497	1.937	50	20	IDGD	
CCCN(C)CC(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccc(OC)cc2)c1	730104806	YOJZZSWIEVRKIS-UHFFFAOYSA-N	434.518	1.599	50	20	IDGD	
NC(=O)[C@@H]1CCCN(Cc2cccc(CNC(=O)NNC(=O)c3ccccc3F)c2)C1	731118087	NEOWTLCMPPYGHG-QGZVFWFLSA-N	427.480	1.667	50	20	IDGD	
Cc1c(C(=O)OCC(=O)NNC(=O)c2cccs2)nnn1-c1ccc2ncccc2c1	731399682	CEBWYZHKAIALCD-UHFFFAOYSA-N	436.453	1.803	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)c1ccc2c(c1)S(=O)(=O)N(CCOC)C2=O)c1ccccc1	731997802	YGJQMMFAQYEIEX-INIZCTEOSA-N	445.497	1.432	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1	732049938	FPWOUMJCSBYAAY-GFCCVEGCSA-N	448.457	1.496	50	20	IDGD	
C=CCn1c(SCC(=O)NNC(=O)N2CCOCC2)nnc1-c1ccc(Cl)cc1	732063768	FGPVTGVKCHIVMS-UHFFFAOYSA-N	436.925	1.950	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)CCNS(=O)(=O)c1cccc(C(C)=O)c1)c1ccccc1	732292102	RDZOASCLSFFPDZ-IBGZPJMESA-N	431.514	1.899	50	20	IDGD	
Cc1c(C(=O)OCC(=O)NNC(=O)c2ccccc2)nnn1-c1cccc2cnccc12	732343086	DVSYEMJZHJSIDL-UHFFFAOYSA-N	430.424	1.742	50	20	IDGD	
CC(C)n1cc([C@H](C)NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cn1	732894029	SNNATTPUKROLSC-HNNXBMFYSA-N	448.549	1.954	50	20	IDGD	
CC(C)n1ncc2c(C(=O)NNC(=O)CN(C)C)cc(-c3ccc4c(c3)OCCO4)nc21	733360082	AVDCXKTXXVENJX-UHFFFAOYSA-N	438.488	1.773	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)c2nnn(-c3cccc([N+](=O)[O-])c3)c2C)cc1	733514304	RFFMPFVGWSMDHR-UHFFFAOYSA-N	438.400	1.410	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)N[C@@H](Cc1ccccc1)CN1CCOCC1	733649662	AUKLJIBXVWSUAT-NRFANRHFSA-N	448.527	1.760	50	20	IDGD	
COc1ccc(S(=O)(=O)NCCC(=O)NNc2cnnc3ccccc23)cc1OC	733810764	BJFGSMJYTZTZCA-UHFFFAOYSA-N	431.474	1.459	50	20	IDGD	
CN1C(=O)C[C@@H](C(=O)NNC(=O)COc2ccc(C#N)cc2)[C@@H]1c1cccc(Cl)c1	734417637	SQYOBMRTTJWQLX-XLIONFOSSA-N	426.860	1.957	50	20	IDGD	
CCCC(=O)N1CCC[C@H](C(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)C1	734825993	SAXFAWCLGIYWFU-HNNXBMFYSA-N	439.557	1.755	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2ncoc2-c2ccccc2)CC1	735118305	RFJKTTYQSNXQPE-UHFFFAOYSA-N	442.501	1.430	50	20	IDGD	
O=C(NCC1Cc2ccccc2C1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	735386725	PMHPBAMUKJWBPI-UHFFFAOYSA-N	442.541	1.830	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCC(NC(=O)NNC(=O)C(C)(C)C)CC2)cc1OC	735512617	JFIANZROCVJXQD-UHFFFAOYSA-N	442.538	1.233	50	20	IDGD	
COc1ccc([C@@H]2[C@@H](C(=O)NNC(=O)COCc3ccccc3)CCC(=O)N2C)cc1	737634936	QHQBLMJUZMIBMS-SIKLNZKXSA-N	425.485	1.969	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)[C@@H]1CN(Cc2ccccc2)CCO1	741424277	BMOQLKPEJCVFEI-KXBFYZLASA-N	427.461	1.828	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)[C@@H]3Cc4cc(F)ccc4O3)cc2)CC1	743335548	ZMJRWQYOGJYTIM-IBGZPJMESA-N	434.493	1.209	50	20	IDGD	
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC(=NNC(=O)Nc2ccc(C(=O)O)cc2)CC1	743444319	IDGSAXULTBBIHZ-UHFFFAOYSA-N	434.478	1.687	50	20	IDGD	
C[C@H]1C[C@H](NC(=O)NNC(=O)c2cccc(Br)c2)C(=O)N1c1cnn(C)c1	743686521	JIBXYIAZLAYUQU-HZMBPMFUSA-N	435.282	1.321	50	20	IDGD	
CN(C)[C@@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)c1ccccc1	744314445	YZTLDXBCHZXSBR-LJQANCHMSA-N	430.530	1.535	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)[C@@H](c2ccccc2)N2CCCCC2=O)cc1	744991671	QYSIZGGQSHRUII-OAQYLSRUSA-N	434.452	1.616	50	20	IDGD	
O=C(NNC(=O)N[C@@H]1CCN(CCN2CCOCC2)C1)Nc1ccc(OC(F)F)cc1	745828789	VTSXFVXZAXFXHU-OAHLLOKOSA-N	442.467	1.030	50	20	IDGD	
CO[C@]1(C)C[C@H](NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)C1(C)C	745930371	DCZWODBUVGLPJY-OXJNMPFZSA-N	438.550	1.619	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2Cc3ccccc3C[C@@H]2C(=O)NNC(=O)c2ccc[nH]2)cc1	747663521	VSOAJHDUWOSDHU-HXUWFJFHSA-N	438.509	1.900	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)N2CCC[C@@H]2C(=O)NNc2ccccc2F)o1	748050278	VXUNRHXIPPZSJT-CQSZACIVSA-N	425.438	1.892	50	20	IDGD	
NS(=O)(=O)Cc1cccc(C(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)c1	748523581	WINGDJWRYRHWBU-UHFFFAOYSA-N	437.421	1.526	50	20	IDGD	
CCn1cc(S(=O)(=O)NC(=O)/C(C#N)=C/c2cc(C)n(C[C@H]3CCCO3)c2C)cn1	749216274	GYZSQCOSBIGBTA-JIARHERNSA-N	431.518	1.912	50	20	IDGD	
CC[C@H](Oc1ccccc1C)C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	749536752	VSYKIFIEKMKNTC-KRWDZBQOSA-N	447.561	1.627	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)NCCC(=O)NNC(=O)c2cc3ccccc3o2)cc1	749546436	VSPFMLXDGBMLEC-UHFFFAOYSA-N	444.469	1.521	50	20	IDGD	
N#CCNC(=O)/C(C#N)=C\c1cn(CCC(N)=O)nc1-c1ccc(Br)cc1	749603836	MZLSBKMFFMRLIT-LCYFTJDESA-N	427.262	1.735	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)C1=NN(c2ccccc2)[C@@H](C(C)=O)C1	751294140	MBSPCAJHLZVVAD-HXUWFJFHSA-N	432.484	1.970	50	20	IDGD	
CNS(=O)(=O)c1cc(NC(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)ccc1C	755513657	BTAYEPLTXNQCQN-UHFFFAOYSA-N	428.474	1.760	50	20	IDGD	
Cc1cc(C)nc(-n2nc(C)cc2NC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])n1	755517156	XXQLTMNZYDUGSG-UHFFFAOYSA-N	440.420	1.727	50	20	IDGD	
COCCS(=O)(=O)c1ccc(NC(=O)NNC(=O)COc2cc(C)cc(C)c2)cc1	756555724	UZBDFRWAHINDLF-UHFFFAOYSA-N	435.502	1.955	50	20	IDGD	
CCOC(=O)C(C)(C)n1cc(NC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])cn1	757719642	AYQAIGOAOPCRBI-UHFFFAOYSA-N	434.409	1.321	50	20	IDGD	
COC(=O)C[C@@H](C)C(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2OC)c1	758354220	CLFSZQVIQNIWEG-CYBMUJFWSA-N	449.485	1.456	50	20	IDGD	
O=C(NNC(=O)[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)c1ccccc1)C(=O)Nc1ccccn1	758835724	YFUKYDXBUJFLID-KSZLIROESA-N	435.484	1.641	50	20	IDGD	
Cc1c(C(=O)NNc2nc3ccccc3c(=O)n2C)cnn1CCO[C@@H]1CCCCO1	759104280	UQAJAQDWWWMROV-GOSISDBHSA-N	426.477	1.739	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)NC[C@@H]2CN(Cc3ccccc3)CCCO2)c1	759214736	RJENJTAUTRVNOV-OAQYLSRUSA-N	425.533	1.988	50	20	IDGD	
CCNS(=O)(=O)c1ccc(CC(=O)NNC(=O)c2ccc(Cl)cc2OC)cc1	759356248	LLGDDMAADVOZTR-UHFFFAOYSA-N	425.894	1.651	50	20	IDGD	
CC(=NNC(=O)[C@@H](C)NS(C)(=O)=O)c1ccc(CNC(=O)OC(C)(C)C)nc1C	760249316	OQTFMUUTFLSTBX-CYBMUJFWSA-N	427.527	1.193	50	20	IDGD	
COc1ccc2c(c1)OC[C@@H]2CC(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	760614053	MOEQQXWIAORMOO-ZDUSSCGKSA-N	429.385	1.474	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCCC(=O)NNc1cc(C#N)cc(Cl)n1	760928153	DLUKRWPQRVSTBQ-ZDUSSCGKSA-N	436.900	1.956	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)c1nn(-c2ccc(F)cc2)ccc1=O	761636049	JDHPYLNQWLUHFK-UHFFFAOYSA-N	428.445	1.934	50	20	IDGD	
C[C@@H]1CN(Cc2ccccc2)C[C@@H](C)C1NC(=O)NNC(=O)CNC(=O)c1ccco1	761790153	KNWZRRSULYKGGH-HZPDHXFCSA-N	427.505	1.496	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)N[C@H]2CCCN(c3ccccc3F)C2=O)cc1	761817858	DYCPIZWKUAYCBV-KRWDZBQOSA-N	430.436	1.739	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C[C@H](C)/N=C2/NS(=O)(=O)c3ccccc32)n1	762892639	AGILTCCQXJETHK-ZDUSSCGKSA-N	431.522	1.283	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cccc(OC(F)(F)F)c2)cc1	763121703	IOGJZKUPTRRPFC-UHFFFAOYSA-N	445.419	1.975	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc([S@](=O)C(F)(F)F)cc1	763443019	WJXOIWQZEJQPDU-PMERELPUSA-N	444.347	1.622	50	20	IDGD	
COC(=O)c1ccc(C(F)(F)F)cc1NC(=O)C(=O)NNC(=O)c1ccccc1O	763526217	IAYDAUHVCNEBQF-UHFFFAOYSA-N	425.319	1.597	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)C(=O)Nc1ccc(OCCc2ccccc2)nc1	763548569	NAEFFBJPNGZYAN-UHFFFAOYSA-N	448.435	1.832	50	20	IDGD	
C[S@@](=O)c1cccc(NC(=O)C(=O)NNC(=O)COc2cccc(C(F)(F)F)c2)c1	763639592	PFOLJBCTYLQLBB-SSEXGKCCSA-N	443.403	1.608	50	20	IDGD	
COCC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C)c(C)c2)cc1	763666508	HLQJAEVGSQFEIR-UHFFFAOYSA-N	428.445	1.053	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2ccnn2-c2ccccc2)c2ccccc2c1=O	763785105	DYTFNKDXWHRVPW-UHFFFAOYSA-N	445.439	1.002	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)c(C)c1	763790358	IRDFDRWQOFBIFZ-UHFFFAOYSA-N	437.456	1.694	50	20	IDGD	
C#CCOc1cccc(NC(=O)C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)c1	763790558	KWIHQVJJJXKFDA-UHFFFAOYSA-N	447.451	1.389	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(S(=O)(=O)CCOC)cc2)cc1	763831671	LSXBNZWFYOSVKE-UHFFFAOYSA-N	433.486	1.069	50	20	IDGD	
CC(C)CC(=O)NNC(=O)C(=O)Nc1cc(F)c(I)c(F)c1	763885046	IZSVSDNJCIKJHF-UHFFFAOYSA-N	425.173	1.701	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cnn(CCO)c2-c2ccccc2)cc(OC)c1OC	763917970	DYFJUJPDMOQXSY-UHFFFAOYSA-N	440.456	1.643	50	20	IDGD	
O=C(Cc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1cc2c(cc1[N+](=O)[O-])OCCCO2	763935726	ADFNDSSODLICAA-UHFFFAOYSA-N	448.819	1.738	50	20	IDGD	
CCC(=O)Nc1ccc(C)c(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)c1	763994729	FLHXRNNDZOBQLZ-UHFFFAOYSA-N	436.266	1.834	50	20	IDGD	
COC(=O)c1c(F)cccc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccccc2)on1	764017170	SOWNILDPZCPSOZ-UHFFFAOYSA-N	426.360	1.667	50	20	IDGD	
CC[C@H](C)C(=O)NNC(=O)C(=O)Nc1cc(OC)c(OC)cc1C(=O)N1CCCCC1	764083484	JMFSLKLTTXIVAP-ZDUSSCGKSA-N	434.493	1.462	50	20	IDGD	
O=C(Cc1ccc2ccccc2c1)NNC(=O)C(=O)Nc1ccc(NC(=O)C2CC2)nc1	764092109	NFWUUKRGGNYFQX-UHFFFAOYSA-N	431.452	1.912	50	20	IDGD	
CCOC(=O)c1ccn(-c2ccccc2NC(=O)C(=O)NNC(=O)CC2CCCC2)n1	764187151	DUNMILRQIKZENT-UHFFFAOYSA-N	427.461	1.715	50	20	IDGD	
Cc1ncsc1C(=O)NNC(=O)C(=O)Nc1ccc(NC(=O)NCc2ccco2)cc1	764245404	SIDIZDNITWBIOI-UHFFFAOYSA-N	442.457	1.766	50	20	IDGD	
O=C(Cc1ccccn1)NNC(=O)C(=O)Nc1ccc(CN2CCc3ccccc32)cc1	764263993	LOOHRSMGSGOACC-UHFFFAOYSA-N	429.480	1.973	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cc([N+](=O)[O-])c(C)cc2Br)o1	764369371	DKSSTWHCZKPJHX-UHFFFAOYSA-N	425.195	1.967	50	20	IDGD	
COc1ccc(OC)c(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3OC)[nH]n2)c1	764377919	SLJMDUFNDPOVEW-UHFFFAOYSA-N	439.428	1.502	50	20	IDGD	
O=C(NNC(=O)C(F)(F)Oc1ccccc1)C(=O)Nc1cnn(Cc2ccccn2)c1	764379851	MMBWKYVOWUFTGC-UHFFFAOYSA-N	430.371	1.084	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2ncccc2C)cc1OCc1cccnc1	764386265	VCEIRINOZCCZCV-UHFFFAOYSA-N	435.440	1.772	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)C(=O)Nc1nc2cc3c(cc2s1)OC(F)(F)O3	764388176	BJVPQFHIEPABKI-UHFFFAOYSA-N	435.368	1.721	50	20	IDGD	
COc1ccc2cc(NC(=O)C(=O)NNC(=O)CSc3ccccc3O)ccc2n1	764394115	NXKSDERMIGDRGJ-UHFFFAOYSA-N	426.454	1.827	50	20	IDGD	
CC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)cc1Cl	764395019	YKEXAPZFNPGAIF-UHFFFAOYSA-N	436.877	1.882	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1cccc(-c2n[nH]c(C)n2)c1	764397369	HOJNVXKEHBYYMA-UHFFFAOYSA-N	440.485	1.667	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)C[C@H]3COC(=O)C3)c2)c(C)c1	764464081	LWJBCLHCFIAJCV-OAHLLOKOSA-N	445.497	1.818	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1ccc(C(=O)N2CCC(C)CC2)cc1C	766260595	HRVIWJGSZKGING-UHFFFAOYSA-N	426.477	1.748	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)[C@@H]1CC(=O)N(c2ccc(Cl)c(F)c2)C1	766295933	SVCMSWTXZRZFCL-PIGZYNQJSA-N	433.823	1.819	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H]2CCCc3c[nH]nc32)c1	767226248	FTTSTSUIPJVZBY-INIZCTEOSA-N	434.522	1.462	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)Nc1cc(C(N)=O)ccc1CN(C)C	769243861	UQDPOGVFZKPOAK-UHFFFAOYSA-N	435.506	1.408	50	20	IDGD	
CSCCNC(=S)NNC(=O)c1cc(S(=O)(=O)N(C)C(C)C)ccc1Cl	769769824	PIBJACABHNOFCR-UHFFFAOYSA-N	439.028	1.841	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1ncccc1C(F)(F)F	770770157	REKYMBJXCQSCCD-UHFFFAOYSA-N	430.408	1.878	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)NCc2nc(COc3ccccc3)n[nH]2)cc1OC	771375523	GHXPVTHMQIIWNV-UHFFFAOYSA-N	440.460	1.935	50	20	IDGD	
O=C(COC(=O)Cc1ccccc1I)NNC(=O)c1cccs1	771396485	PMTSJBFBZDMMTR-UHFFFAOYSA-N	444.250	1.900	50	20	IDGD	
O=C(NNc1ccc(F)c([N+](=O)[O-])c1)c1cccc(S(=O)(=O)NC[C@H]2CCCO2)c1	771591026	UTGXALDXRQDMQW-CQSZACIVSA-N	438.437	1.948	50	20	IDGD	
Cc1noc(COc2ccc(NC(=O)C(=O)NNC(=O)c3ccc(C)c(F)c3)cc2)n1	773887541	BJUFNSMOCFTCIJ-UHFFFAOYSA-N	427.392	1.804	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccc(NC(=O)NNc3cnc4ccccc4n3)c2)CC1	775562299	NAKNBTBIEZUSQK-UHFFFAOYSA-N	441.517	1.715	50	20	IDGD	
CC(C)(C)OC(=O)c1cccc(CNC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c1	775714107	MMPANSNBCTXXAQ-UHFFFAOYSA-N	437.460	1.762	50	20	IDGD	
CC#CCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2OC)c1	776204961	HIXUAPDBWLPGRK-UHFFFAOYSA-N	430.486	1.853	50	20	IDGD	
Cc1ccc(C[C@@H](C)C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1	778522338	RTMDFIAKSAONRT-QGZVFWFLSA-N	445.541	1.656	50	20	IDGD	
COC(=O)c1csc(S(=O)(=O)N2CCN(S(=O)(=O)CCCCCl)CC2)c1	780685474	XRBNIJFRGFXAAW-UHFFFAOYSA-N	444.984	1.190	50	20	IDGD	
CS(=O)(=O)CC[C@@H](NC(=O)c1ccccc1Cl)C(=O)NNc1ncncc1Cl	781819257	AESXOIQOXCOGPN-CYBMUJFWSA-N	446.316	1.460	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)Cc1cccc(N2CCCC2=O)c1	781821252	FVBRGRFUUYRNDF-UHFFFAOYSA-N	449.555	1.716	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)cc1)C(=O)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1	782835573	AJFDJJLOXKVCMR-SFHVURJKSA-N	448.483	1.435	50	20	IDGD	
O=C(NNc1ccc(Br)cc1F)C(=O)Nc1ccc2c(c1)S(=O)(=O)CC2	783084474	BFIGCTOKXIWFFW-UHFFFAOYSA-N	442.266	2.000	50	20	IDGD	
Cc1nn([C@@H]2CCS(=O)(=O)C2)c(C)c1NC(=O)C(=O)NNc1cccc2c1CCCC2	783450696	PYSLHRNBJQOZAF-MRXNPFEDSA-N	445.545	1.820	50	20	IDGD	
CNC(=O)COc1ccc(NC(=O)C(=O)NNc2ccc(Br)cc2C)cc1	784414255	ICZPARRNNSASOW-UHFFFAOYSA-N	435.278	1.964	50	20	IDGD	
Cn1ccnc1C(=O)c1ccc(NC(=O)C(=O)NNc2ccc(Br)nc2)cc1	784806727	PJMWVALERWIRMO-UHFFFAOYSA-N	443.261	1.890	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1ccc(F)c(C#N)c1	784834284	VHFJTAJTPSYJHN-UHFFFAOYSA-N	433.465	1.856	50	20	IDGD	
COC(=O)c1cc2cc(NC(=O)C(=O)NNc3cccc(S(C)(=O)=O)c3)ccc2o1	784844949	USORMNYOUCQNPR-UHFFFAOYSA-N	431.426	1.705	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2ccc(C)c(N3CCOC3=O)c2)n1	785227442	RPTIAWGUXONPSD-UHFFFAOYSA-N	427.465	1.670	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)C2(Cc3ccccc3F)CC2)cc1	785444163	HLVGYMFIXTWMEP-UHFFFAOYSA-N	433.505	1.925	50	20	IDGD	
Cc1ccc(NC(=O)[C@H](C)OC(=O)/C(C#N)=C\C2CC2)cc1S(=O)(=O)N1CCOCC1	786679245	YADUCDRNGFAXMF-ZCQLHAAUSA-N	447.513	1.746	50	20	IDGD	
Cc1nn(-c2ccc(Br)cc2)c(C)c1C(=O)NNC(=O)N1CCN(C)CC1	788165710	GCNVQVVPRJFXCI-UHFFFAOYSA-N	435.326	1.853	50	20	IDGD	
O=C(Cc1cc(O)nc(O)n1)NN=Cc1ccc(Br)cc1N1CCOCC1	788715798	AQYCIVVARKXRIK-UHFFFAOYSA-N	436.266	1.180	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)C(=O)Nc1nc2c(s1)CCCCC2	789732379	NGBUULBEUVDMTD-UHFFFAOYSA-N	433.446	1.485	50	20	IDGD	
CCc1nc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)sc1C	789745540	CQJHEBAMHRSSLT-UHFFFAOYSA-N	426.524	1.177	50	20	IDGD	
Cc1nc(-c2cccc(NC(=O)C(=O)NNC(=O)[C@H]3OCC[C@H]3c3ccccc3)c2)n[nH]1	789809574	AHZUNJQFYWWYDR-ROUUACIJSA-N	434.456	1.439	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)N2CCC(C(=O)NCCSSC)CC2)o1	791100851	WUKUROBMNYWGHV-UHFFFAOYSA-N	436.577	1.984	50	20	IDGD	
C[C@@](O)(CN1C(=O)NC2(CCCC2)C1=O)C(=O)NNC(=O)c1ccc(Cl)cc1Cl	792829269	QEUKHAPDERNGRE-QGZVFWFLSA-N	443.287	1.370	50	20	IDGD	
CC(C)(C)OC(=O)NCCc1nc(C(=O)NNC(=O)Cc2cn3ccccc3n2)cs1	793600245	SFJOBOFBXQIBNI-UHFFFAOYSA-N	444.517	1.862	50	20	IDGD	
Nc1nc(Cl)cc(NNC(=O)c2cccc(NN3C(=O)[C@H]4CC=CC[C@H]4C3=O)c2)n1	793799089	BQFPOPINIXZFBM-BETUJISGSA-N	427.852	1.747	50	20	IDGD	
Cc1cc(NC(=O)CSCC(=O)NNc2ccccc2S(=O)(=O)N(C)C)no1	795176958	HTRSOQKSTXTNFI-UHFFFAOYSA-N	427.508	1.048	50	20	IDGD	
O=C(NNC(=O)c1cc2c(s1)CCC2)C(=O)Nc1ccc(F)c(N2CCOC2=O)c1	796989969	NYQIVFRXBFVZBW-UHFFFAOYSA-N	432.433	1.732	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(OC(C)C)c(C(N)=O)c2)c2ccccc2n1	796991467	FBJDXNOZHIJDCM-UHFFFAOYSA-N	449.467	1.829	50	20	IDGD	
O=C(NNC(=O)c1c[nH]c2ccccc12)C(=O)Nc1ccc(F)c(N2CCOC2=O)c1	796992420	QXHWNUNVPJLUJX-UHFFFAOYSA-N	425.376	1.663	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)CCC(=O)N2CCC(O)CC2)cc1Cl	802073731	QCUFQVYUWKQEQN-UHFFFAOYSA-N	428.873	1.273	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1ccsc1	802390592	SWKWDBVQBWSIFW-ZDUSSCGKSA-N	438.531	1.474	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN([C@@H](CNC(=O)NNC(=O)C2CCC2)C(F)(F)F)CC1	802465262	JTKCHDOFUHSVGI-ZDUSSCGKSA-N	437.463	1.601	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc2c(c1)nc(CCC(=O)NN(C)C(=O)OC)n2CC	804124386	OBNPMTSXJAINKF-UHFFFAOYSA-N	439.538	1.749	50	20	IDGD	
Cc1c(NNC(=O)C(=O)Nc2ccc(F)c(S(=O)(=O)N(C)C)c2)cccc1[N+](=O)[O-]	807006032	RIHFUURRYNSJMJ-UHFFFAOYSA-N	439.425	1.374	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)C1CCN(c2ccc(C#N)cc2F)CC1	807210981	FIZFWGBRRWQABF-UHFFFAOYSA-N	433.484	1.976	50	20	IDGD	
CC(=NNC(=O)c1cc(S(=O)(=O)NCc2ccccc2)ccc1O)c1cc(CO)on1	812225072	ZUTGDYMRMBRYBJ-UHFFFAOYSA-N	444.469	1.505	50	20	IDGD	
CCOC(=O)c1ccc(NNC(=O)c2ccc(S(=O)(=O)N3CCOCC3)o2)cc1C	812721602	YRWRWDVWINZCKK-UHFFFAOYSA-N	437.474	1.543	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)[C@H]2CC(=O)N(c3c(F)cccc3F)C2)cc1	812732293	ZPNYKJMNPLQPBL-LBPRGKRZSA-N	438.456	1.711	50	20	IDGD	
CC(=O)Nc1cccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)c1C	813033700	HJLZYYLXOUYHLP-UHFFFAOYSA-N	433.490	1.286	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNc2cccc(S(C)(=O)=O)c2)cc1)[C@@H]1C[C@@H]1C	815558624	JAUROJUWQVCORJ-ORAYPTAESA-N	444.513	1.933	50	20	IDGD	
Cn1cc(NC(=O)C(=O)NNC(=O)c2ccc(COc3ccc4ccccc4c3)cc2)nn1	815564393	HRCPNEQLXYSJQK-UHFFFAOYSA-N	444.451	1.947	50	20	IDGD	
CCCN1C(=O)c2ccccc2N2C(=O)CC[C@]12C(=O)NNC(=O)NCC(F)(F)F	816565394	NTOCLPNJOKWTMD-KRWDZBQOSA-N	427.383	1.268	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)c2c(I)cnn2C)cc1	816597675	BGEIFZIKIJQDRN-UHFFFAOYSA-N	428.234	1.557	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)CCn2c(S)nc3ccccc3c2=O)c1	825796293	BPOJVCLADDVBFN-UHFFFAOYSA-N	427.486	1.343	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2cnc3c(c2)c(=O)n(C)c(=O)n3C)c(C)n1-c1ccccc1	862171162	WEFTZXPUQCHYED-UHFFFAOYSA-N	446.467	1.115	50	20	IDGD	
Cc1ccc(S(=O)(=O)Oc2ccc(S(=O)(=O)N3CC[C@@H](B(O)O)C3)cc2)cc1	864231450	NGKVWOMFIPQBSF-CQSZACIVSA-N	425.293	1.000	50	20	IDGD	
O=C(C1CCN(S(=O)(=O)c2cccc(C(F)(F)F)c2)CC1)N1CC[C@H](B(O)O)C1	864233995	LXPHIJOQKQRPBJ-AWEZNQCLSA-N	434.245	1.181	50	20	IDGD	
COCC(=O)NC1CCN(C(=O)/C(C#N)=C/c2cc(C)n(C[C@H]3CCCO3)c2C)CC1	915705784	TXBVLWXJIJYMHS-PRWBYUBPSA-N	428.533	1.945	50	20	IDGD	
CC(C)c1c(C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cnn1-c1ccccn1	916124792	NTILJIVVUFCOBN-UHFFFAOYSA-N	431.456	1.712	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCc2ccnc(-n3cccn3)c2)nc1	916394098	AAODZEDUQVPMLP-UHFFFAOYSA-N	444.521	1.519	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NC[C@@H](C1CCCCC1)N(C)C	916447902	HWUXOXARMUYQCW-INIZCTEOSA-N	438.598	1.743	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NCc2cc(Br)cs2)c2ccccc2c1=O	916626862	XYNIJHSJSYYRGI-UHFFFAOYSA-N	436.291	1.902	50	20	IDGD	
O=C(Cc1cccc2ccccc12)NNC(=O)NC[C@@]1(N2CCOCC2)CCSC1	916636875	NUWURSQMTLFGSE-QFIPXVFZSA-N	428.558	1.921	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)N1CCCN(C(=O)c2ccsc2)CC1	918001979	KVNZFFGQZPTLMW-UHFFFAOYSA-N	426.502	1.907	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)CN1C(=O)N[C@]2(C[C@H](C)CC(C)(C)C2)C1=O	919822203	GIWRWCMATKPAAK-PEBXRYMYSA-N	430.505	1.522	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccco2)nn1-c1ccccc1)N[C@H]1CCS(=O)(=O)C1	919889270	KIPWBNZQTKTVSR-ZDUSSCGKSA-N	429.458	1.263	50	20	IDGD	
CC(=NNC(=O)N[C@@H]1CCS(=O)(=O)C1)c1ccc(OCC(=O)Nc2ccccc2)cc1	920383557	FTLPWYLWZLLVAW-GOSISDBHSA-N	444.513	1.914	50	20	IDGD	
CC(=NNC(=O)NCCc1cccs1)c1ccc(S(=O)(=O)N2CCNCC2)cc1	920830396	CWWAEOGMWGRXJJ-UHFFFAOYSA-N	435.575	1.608	50	20	IDGD	
Cc1cc(N2CCN(C)CC2)ccc1NC(=O)NNC(=O)c1nnc(O)c2ccccc12	920928544	OSDACEBWRUFLLS-UHFFFAOYSA-N	435.488	1.862	50	20	IDGD	
CCn1cc(C(C)=NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)cn1	920986089	AJBSVIHCARGXPJ-UHFFFAOYSA-N	433.534	1.397	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)ccn1	1318595379	QXVLPUOCKILGGG-UHFFFAOYSA-N	440.481	1.644	50	20	IDGD	
CS(=O)(=O)Nc1ccccc1CC(=O)NNc1nc(Br)cn2ccnc12	1319014831	LROQTONSJLIDKG-UHFFFAOYSA-N	439.295	1.549	50	20	IDGD	
CN1CCN(c2ccccc2CNC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)CC1	1321806979	OQNRAIKVIOURQH-UHFFFAOYSA-N	433.516	1.768	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCOCC2)cc1C(=O)NNc1ccc(C(C)(C)C)nn1	1323001257	HDJLSSIIRHUKGN-UHFFFAOYSA-N	449.533	1.561	50	20	IDGD	
O=C(NNS(=O)(=O)CCc1ccccc1Br)c1n[nH]c2c1CCCC2	1330056235	BQAXOWBKWWJOKD-UHFFFAOYSA-N	427.324	1.858	50	20	IDGD	
CN1CCN(c2ccc(/C=C(/C#N)C(=O)Nc3ccc(S(N)(=O)=O)cc3)cc2F)CC1	1337561683	BZLSDRKTVWGHQL-VBKFSLOCSA-N	443.504	1.771	50	20	IDGD	
Cc1nn[nH]c1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)CBr)C2	1777740656	FJEFJERTWUHAFC-CJBNDPTMSA-N	428.331	1.272	50	20	IDGD	
CN(C)c1ccc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)c2ccccc12	1777813467	FUBJMWMTZFZMOO-REWPJTCUSA-N	445.947	1.949	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4cncn4c3)C2)C1	1778690918	PXIBZUDIPXELSZ-LIRRHRJNSA-N	435.322	1.809	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)CSCc3[nH]cnc3C)C2)C1	1778914128	XNRZZZSUKKAGCW-KSSFIOAISA-N	430.958	1.035	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)o1	1779027944	TWFXWDAJTYDUMX-BBRMVZONSA-N	432.246	1.372	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc3n(n2)CCC3)C1	1779121212	XBMRQEHHVSPZEL-WIYYLYMNSA-N	434.613	1.808	50	20	IDGD	
C[C@H](NC(=O)c1ccccc1)C(=O)N1CCO[C@@]2(CCN(C(=O)CO[Si](C)(C)C)C2)C1	1779300142	PAINNTMJMFTSQR-HTAPYJJXSA-N	447.608	1.486	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cccc(C(F)(F)F)n3)C2)C1	1779514386	CPTMTPDJZTWVOZ-PXAZEXFGSA-N	435.830	1.798	50	20	IDGD	
CCc1cc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)n(C)n1	1779622680	XWOWYTIWLIQBIO-SCLBCKFNSA-N	427.343	1.457	50	20	IDGD	
Cc1cnn([C@@H](C)C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](F)Br)C2)c1	1780777457	SORMQEASMYLSGF-LUXYFRNMSA-N	445.333	1.957	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2)c1ccc([N+](=O)[O-])cc1F	1780880258	ZMIDKCDZVAIPRB-FRQCXROJSA-N	443.859	1.461	50	20	IDGD	
Cc1nnc(CCC(=O)N2CCO[C@@]3(CCN(C(=O)[C@](C)(Cl)CCl)C3)C2)s1	1781224093	HHRIHUCVIODSAZ-SJORKVTESA-N	435.377	1.845	50	20	IDGD	
CN1CCc2cc(C(=O)N3CCO[C@]4(CCN(C(=O)[C@@H](F)Br)C4)C3)ccc21	1781330154	ROEDQMJZAIHOLD-APWZRJJASA-N	440.313	1.813	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc4cccnn4c3)C2)C1	1782387767	BATRZCJXVBEOBC-QFBILLFUSA-N	435.322	1.951	50	20	IDGD	
COc1ccc(CCC(=O)N2CCO[C@]3(CCN(C(=O)[C@H](C)Br)C3)C2)cn1	1783529282	HJFJUQHTUZJDDE-IFXJQAMLSA-N	440.338	1.636	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccc4c(cnn4C)c3)CCO2)C1	1783534689	YBUQKVQWNQSZCP-BFUOFWGJSA-N	435.322	1.800	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)COc3cc(Cl)ccn3)CCO2)C1	1783878422	YHNCXGXAEBZZGL-KSSFIOAISA-N	432.304	1.198	50	20	IDGD	
Cc1onc(-c2ccncn2)c1C(=O)N1CCO[C@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783948495	PHONEKJHNGCLPU-SFHVURJKSA-N	440.287	1.687	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3ncc[nH]3)C[C@@H]21	1783974472	OUNUHEZRCMYBCA-AJNGGQMLSA-N	427.343	1.353	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3nc(C)no3)[C@H]2C1	1787053596	REZSUMANCFPMQX-XUXIUFHCSA-N	429.315	1.074	50	20	IDGD	
CC(C)OC(=O)c1ncccc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]2C1	1787444323	SVIWLOAWRPAHOX-QEWYBTABSA-N	441.887	1.775	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1	1788149462	VKJIVNBCQMSMTO-GOSISDBHSA-N	430.697	1.368	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC1(c2ccc(NC(=O)c3cc(=O)n4[nH]nnc4n3)cc2)CCC1	1788407376	HWZJODWNTWVVLL-CQSZACIVSA-N	443.895	1.968	50	20	IDGD	
COCc1oncc1C(=O)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1	1788829397	MJEFACWTLDEUPF-UHFFFAOYSA-N	449.272	1.562	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(C)n(C(F)F)n3)[C@H]2C1	1789329876	BIFWMQMXDHEMIS-ABHRYQDASA-N	434.871	1.434	50	20	IDGD	
Cc1ncccc1CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]2C1	1789922125	HUFPAXQPRGXJGV-OVWQWFNUSA-N	442.329	1.993	50	20	IDGD	
CC(C)n1nccc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]2C1	1789924623	PPLCWOGZAVYJQH-NZBPQXDJSA-N	431.306	1.748	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3n[nH]c4ccc(C#N)cc34)[C@H]2C1	1790330623	LYYANTWBNAPEAX-MBGYTDRXSA-N	445.907	1.282	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3sc(N)nc3C)C[C@@H]21	1790961771	QLPLOEQFMQZBRF-CYDGBPFRSA-N	445.383	1.801	50	20	IDGD	
CCc1nn(C)c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](Cl)COC)[C@H]3C2)c1Cl	1791252835	RPRAVISTMZPDOX-ABHRYQDASA-N	447.363	1.483	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)Cn3ccnc3)[C@H]2C1	1791631270	ZTOVGPOZQHBMMF-VIQHNZTISA-N	441.370	1.672	50	20	IDGD	
CC(=O)N[C@@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)CBr)C2)C(C)(C)C	1793190152	GSSKOAMNNZROOS-SLZITWOASA-N	446.386	1.158	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCC(=O)N1CCCC1	1793803177	BWXKVTKFKQZILL-AFIMGQEJSA-N	444.370	1.010	50	20	IDGD	
CC(=O)Nc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCBr)C3)ccn1	1796745115	FHZGOJQFMPDVSD-XOIINTDNSA-N	439.310	1.028	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1c[nH]c2ncccc12	1796871519	OPJSBJGGSMAVLS-JFILPPLUSA-N	435.322	1.797	50	20	IDGD	
Cn1ncc2cc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@@H](F)Br)C4)ccc21	1797085939	LWLJUYPDEUPPBK-OCVGTWLNSA-N	439.285	1.467	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1CN(C(=O)OC(C)(C)C)C1	1797146743	YHUKQWQHDJBCIU-QKPAOTATSA-N	429.945	1.460	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c(F)ccnc1Cl)C2	1797952692	GTOLRBXNVVJXIL-DRXBFXEBSA-N	429.952	1.929	50	20	IDGD	
COC(=O)[C@H]1CC=CC[C@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CO[Si](C)(C)C	1797956767	YGZXFJKPTMBHBR-OYNZLANYSA-N	438.597	1.183	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccccc1C(=O)OCCO)C2	1799268704	FULLONBNUZJRNI-DACLVMHWSA-N	438.908	1.056	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1n[nH]c(C3CC3)c1F)C2	1799275825	DGVHIVSGMOFSJO-IMEWIIRVSA-N	433.311	1.866	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CC[C@H]3CCC(=O)N3C1)C2	1799277387	YQJFMWDDFWALAT-JEEGOSIGSA-N	446.375	1.213	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)c1ccc(C(F)(F)F)c(F)c1	1799536367	NRSMMVQDRSSNAX-JLUCKKNBSA-N	438.805	1.647	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1(N2CCN(C)CC2)CC1	1799978022	ZCRNKKBOZMJRDT-JONQDZQNSA-N	427.387	1.188	50	20	IDGD	
CCSc1ncccc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](Cl)COC	1800974506	WCJCKYMDLGJBQF-XRGAULLZSA-N	427.954	1.651	50	20	IDGD	
C#CCCCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN(C)NC(=O)NCc1ccccc1)C2	1802307528	OTKZJCRLFPOBOH-WKCHPHFGSA-N	439.560	1.774	50	20	IDGD	
COc1ccc(OCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CCC(=O)NN(C)C)cc1	1802335216	YZNTUOFHSNLRML-BJWYYQGGSA-N	432.521	1.085	50	20	IDGD	
CC(=O)N[C@H](C(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)C(C)(C)C	1803136129	OCHZSRAGYAAACZ-VSZNYVQBSA-N	438.956	1.238	50	20	IDGD	
Cc1c(C(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)nc2ccccn12	1803139737	UTQXDPZHQVFGFE-FUHIMQAGSA-N	441.919	1.957	50	20	IDGD	
COc1cnc(C(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]2c2cccnc2)c(F)c1	1803141239	MEDYYYXUGVWIIP-MZMPZRCHSA-N	436.871	1.544	50	20	IDGD	
CCOC(CC(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)OCC	1803146793	QKZKUAUBPQFRSL-GJYPPUQNSA-N	427.929	1.476	50	20	IDGD	
O=C(Cc1cncnc1)NC[C@@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1	1804646782	IJVXLBOWIPBHCL-QFBILLFUSA-N	432.322	1.905	50	20	IDGD	
O=C(O)c1cc(C(=O)NC[C@@H]2CCN(C(=O)C(Cl)Cl)[C@H]2c2cccnc2)ncn1	1804974278	RBXVNTQEZJGQRE-FZMZJTMJSA-N	438.271	1.693	50	20	IDGD	
Cc1cncc(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)c1	1805767466	QZSKKJBTNZYDSI-KNQAVFIVSA-N	444.300	1.098	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC2(CCCN(C(=O)[C@@H](F)c3ccccc3)C2)CC1	1806515902	ZFEDPRAWDOOKQB-NRFANRHFSA-N	438.308	1.922	50	20	IDGD	
CC1=CC[C@H](C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)CC1	1807363535	OZVZHKYVPQGBGX-IEIRFRATSA-N	447.344	1.827	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc(O)cc2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807368108	YLNDGWFIHPCIBG-SIKLNZKXSA-N	445.284	1.100	50	20	IDGD	
Cc1cscc1C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1807373850	CSQAYVJYEMFZCI-GHTZIAJQSA-N	449.341	1.765	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)CN2CCSCC2)[C@H]1c1cccnc1	1813027883	HTCNDFCMKJKJCM-AOIWGVFYSA-N	440.997	1.390	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)CCc2ccco2)[C@@H]1c1cccnc1	1813070340	HYXYZWAEJJLTQG-FDDCHVKYSA-N	441.532	1.686	50	20	IDGD	
Cc1ccnc(C(=O)N2CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)c1	1813071299	QWSKINJLMBTLGL-AVRDEDQJSA-N	438.532	1.478	50	20	IDGD	
Cc1ccc(CC(=O)Nc2nc3c(s2)C[C@H](NC(=O)CCC(=O)NN(C)C)CC3)cc1	1813988773	BWJFFPSKSVLITH-MRXNPFEDSA-N	443.573	1.979	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)[C@@H]1CCC(F)(F)C1	1814386660	FEQTZLBZGGHLLN-PBHICJAKSA-N	446.263	1.831	50	20	IDGD	
O=C(/C=N/O[C@@H]1CCCCO1)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)CCl)CC2	1819901423	VJHMSIQFFARGQT-TWLURHDGSA-N	430.914	1.184	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CN2CCCCC2=O)n[nH]1	1822303387	HCTSSKWRZOTOSZ-ZFWWWQNUSA-N	425.917	1.668	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CNC(=O)c2cccnc2)[nH]n1	1822366984	GFENZSGXPDBQDT-HOCLYGCPSA-N	448.911	1.481	50	20	IDGD	
CN1CCN(C2(C(=O)Nc3nc4c(s3)C[C@@H](NC(=O)[C@H](F)Cl)CC4)CC2)CC1	1822716062	VPWHJIXZFUNSAB-FZMZJTMJSA-N	429.949	1.370	50	20	IDGD	
O=C(N[C@@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1)c1cc(O)nc(O)n1	1823004652	RYNLQRBNROBHJY-FWOIEVBISA-N	446.258	1.261	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)[C@@H](O)CCl)CC2)n1	1824180233	FGAKXGPTQTZTGC-ROUUACIJSA-N	436.940	1.873	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2CNC(=O)O2)CC1	1824569577	PNXXQKJJROUTRI-QEJZJMRPSA-N	430.343	1.746	50	20	IDGD	
CN1CCC[C@H]1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1	1824790727	OODKDCBYSQQYIZ-PMACEKPBSA-N	442.564	1.013	50	20	IDGD	
C[C@@H]1C[C@@]1(C)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1	1828924011	IBUAIHAAZFMGQQ-NFHUAXAMSA-N	427.549	1.965	50	20	IDGD	
CNC(=S)NCCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H](C)Br)CC1	1828931599	SFYLWGAGCZMXGA-UKRRQHHQSA-N	447.443	1.874	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(CO)o2)CC1	1829275294	XRHYNLVZJAXGSZ-GOSISDBHSA-N	434.537	1.378	50	20	IDGD	
CCN(CC)C[C@@H](C)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830366113	KIJSZXGTYSQCSK-UTKZUKDTSA-N	432.005	1.686	50	20	IDGD	
CS(=O)(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H](F)Br)CC1	1830380907	CADFQSGMOSYFQV-UKRRQHHQSA-N	441.363	1.731	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)n3ccnc3C)C2)C1	1831658828	IORKLGASWXUDOZ-RIFZZMRRSA-N	426.945	1.616	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cnc(O)nc2O)CC1	1831832788	IPPVMIMUYMGCPQ-LSDHHAIUSA-N	426.901	1.375	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCc2ncc[nH]2)CC1	1831875081	RCTGZXXVWOPBKF-GOSISDBHSA-N	432.569	1.335	50	20	IDGD	
COc1cccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)n1	1832759224	JTIXCFUNXVTSPJ-OAQYLSRUSA-N	439.940	1.354	50	20	IDGD	
CN(C)c1ccc(C(=O)N2CCC(N3CCC(NC(=O)[C@H](F)Cl)CC3)CC2)nc1	1835078847	YPYXFHIINBGUMW-SFHVURJKSA-N	425.936	1.867	50	20	IDGD	
Cc1nc2ncccn2c1C(=O)N1CCC(N2CCC(NC(=O)[C@H](F)Cl)CC2)CC1	1835080829	XUWBFERSFNLYNV-KRWDZBQOSA-N	436.919	1.757	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)CNc3ccc(F)cc3)CCO2)C1	1835577408	VMJXZOAVTFNENQ-NRFANRHFSA-N	441.931	1.959	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC(OC2CCN(C(=O)Cn3ccnn3)CC2)CC1	1836670185	BITHGJPORYHTNE-AWEZNQCLSA-N	442.358	1.308	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)Cn3nc(C)cc3C)CC2)CC1	1837180624	JCWJHYALLFMQES-IBGZPJMESA-N	440.972	1.752	50	20	IDGD	
COc1ccsc1C(=O)N1CCOC[C@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1837715231	DDGMFIIADBHDFS-IBGZPJMESA-N	442.610	1.678	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@H]3CCCS3(=O)=O)CC2)CC1	1838637392	NUIMBCMRAQRFDT-IAGOWNOFSA-N	434.986	1.580	50	20	IDGD	
Cc1ccc(O)c(C(=O)N2CCO[C@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)c1	1838892812	BWJOUBJGAHMASE-NRFANRHFSA-N	436.581	1.622	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(C)c(F)c3)CCO2)C1	1838916526	XGGZTOMOMNZRJN-UZLBHIALSA-N	428.888	1.458	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(O)cc3)CCO2)C1	1838971926	ROTDRCKRCJVQDR-VQIMIIECSA-N	441.322	1.636	50	20	IDGD	
Cc1nscc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2	1839151663	ZPHXZQDLFVSGKO-SJORKVTESA-N	436.361	1.758	50	20	IDGD	
Cc1onc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)c1C	1839198441	DMEZBSPHVWURSU-CJNGLKHVSA-N	434.262	1.052	50	20	IDGD	
O=C(c1ccc(Cl)o1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839200053	BCMZXHDAIDHZAD-WFASDCNBSA-N	439.665	1.694	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(Cl)c(O)cc3O)CCO2)C1	1839251708	GSMYYCCINXFFSM-ORAYPTAESA-N	447.315	1.839	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3CCCCN3C)C2)C1	1839961869	LQOWFKDNTUNWQT-FRQCXROJSA-N	446.386	1.101	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)c1	1840729555	SEZMBQODZGZEFP-QFBILLFUSA-N	427.860	1.249	50	20	IDGD	
COc1cccc(Cl)c1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1840736991	OVXJVVSAGZYRQG-MAUKXSAKSA-N	435.279	1.953	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC12CN(C(=O)[C@@H]1ON=C(c3ccccc3)O1)C2	1841288035	VGAFOZPMMWFOAX-UGSOOPFHSA-N	436.306	1.956	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@H](C)NS(=O)(=O)c2ccc(C)cc2)C1	1841369295	KMLRNYQNCDSQNE-DOTOQJQBSA-N	441.981	1.883	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC2(CCCN2C(=O)c2ccc(S(C)(=O)=O)cn2)C1	1842256039	LSBXAVPYQPUKOI-CYBMUJFWSA-N	444.351	1.476	50	20	IDGD	
Cc1ncoc1C(=O)N1CCCC12CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1842502150	VTGPYUYZTSITRO-ZDUSSCGKSA-N	426.901	1.932	50	20	IDGD	
O=C(CSc1ccc(F)cc1F)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843013041	AXMWLHQPZAYPKR-UHFFFAOYSA-N	446.284	1.254	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)c2cccc3c2OC(C)(C)C3)C1	1843301786	VLZBPERAJTZPHW-UHFFFAOYSA-N	428.533	1.590	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1ccnc(Cl)n1)C2	1843416352	ZZCVRJUFKQEZPS-WYMPLXKRSA-N	429.868	1.081	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2ccoc2C(F)(F)F)C1	1843488995	SSEHFEJZIITSLJ-UHFFFAOYSA-N	437.378	1.428	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC2(CCCN2C(=O)c2ccccc2C(=O)OCCO)C1	1844719127	GBTMGDHCCMHMIN-UHFFFAOYSA-N	434.565	1.504	50	20	IDGD	
CN(CC(=O)N1CCCC12CN(C(=O)C13CC(F)(C1)C3)C2)NC(=O)NCc1ccccc1	1845038255	KBKIXJVQERKGDB-UHFFFAOYSA-N	443.523	1.428	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@]1(O)CCN(C(=O)OC(C)(C)C)C1)C2	1845167805	VSVGIOWUCQDSNK-JLTOFOAXSA-N	429.945	1.579	50	20	IDGD	
CCOC(=O)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)[C@@H](Cl)CC)C1	1845168725	WIMMCCFQBPCVQH-UONOGXRCSA-N	445.944	1.664	50	20	IDGD	
O=C(CCN1Cc2ccccc2C1=O)N1CC2(CCCN2C(=O)[C@H](F)Br)C1	1845218143	NXNIUZIMQUHLKI-INIZCTEOSA-N	438.297	1.926	50	20	IDGD	
COC(=O)c1ccc(OCC(=O)N2CC3(CCCN3C(=O)[C@@H](C)Br)C2)cc1	1846180216	UEHCRURLQSGHOD-CYBMUJFWSA-N	439.306	1.839	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@H](O)c1cccc(Br)c1)C2	1846363546	PBPDBOUZPYUQHF-LSDHHAIUSA-N	445.741	1.940	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)CCc1cccc([N+](=O)[O-])c1)C2	1846384088	BGSJGGPBCIKYKE-UHFFFAOYSA-N	431.493	1.104	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)c1ccc(-c3cccnc3)cc1)C2	1846385502	OHUISASFIGSHMH-UHFFFAOYSA-N	435.528	1.939	50	20	IDGD	
C[C@@H](C#N)c1cccc(C(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)c1	1846828365	DBBFUJCNFUBWSB-HNNXBMFYSA-N	432.484	1.443	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@](C)(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](O)CCl)C1	1847559482	NHGZAUORKYOVHU-CJXDPKRBSA-N	429.945	1.435	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cccc(=O)n1O	1848346113	ADUJDYSGURPXRV-WYTCUBLDSA-N	440.406	1.786	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CCn2cnc3c(C)cccc3c2=O)cc(OC)c1OC	12609257	AVQPOQMXLYESGD-UHFFFAOYSA-N	440.456	1.582	50	20	IDGD	
Cc1cccc2c(=O)n(CC(=O)NNC(=O)c3nn(C(C)C)c(=O)c4ccccc34)cnc12	16231490	VMBVJXAURCFQHD-UHFFFAOYSA-N	446.467	1.457	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1	17513430	RGGNHELGJYKHGT-UHFFFAOYSA-N	431.514	1.928	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2cc(=O)n(C)c3ccccc23)c2ccccc2c1=O	107761279	OQEOCGNXWACVIO-UHFFFAOYSA-N	431.452	1.733	50	20	IDGD	
Cc1cc(C(=O)N2CCC[C@H]2C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)ccc1[N+](=O)[O-]	726520710	KDNNUOBYTHPLJY-KRWDZBQOSA-N	441.400	1.877	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1)NNC(=O)CCC1CCCCC1	727414198	FPWUKKLBAPGBAT-UHFFFAOYSA-N	426.495	1.771	50	20	IDGD	
CC(=O)N[C@@H](CC(=O)NNC(=O)c1nn(-c2ccccc2)cc1O)c1c(F)cccc1F	727483790	ZHKBJGXVGAGMAM-INIZCTEOSA-N	443.410	1.885	50	20	IDGD	
COc1ccccc1C1(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)CC1	728214198	KLLGAYFKXRFRGS-UHFFFAOYSA-N	444.557	1.806	50	20	IDGD	
COc1ccc(C2(C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)CCOCC2)cc1	728846880	UXJNBUDIRJVMSK-UHFFFAOYSA-N	439.516	1.597	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)NCc2ccc(S(=O)(=O)N3CCCC3)cc2)c1	728946098	YUOHEVLGVISZHY-UHFFFAOYSA-N	427.486	1.487	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)NCCCCN2CCN(c3ncccn3)CC2)c1	729221208	KDYDJMXRQVYAHU-UHFFFAOYSA-N	441.536	1.097	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)cc1NC(=O)c1ccccc1F	729274838	FLSDJHUCJJLUHE-GFCCVEGCSA-N	436.465	1.085	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@@H](NC(=O)NC(C)(C)C)C(C)C	729282293	PTTNJOGILSNKCD-ZDUSSCGKSA-N	440.570	1.171	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)c1ccc(S(=O)(=O)N=c2cc[nH]cc2)cc1	729450705	MJTMETRRHRTPIV-UHFFFAOYSA-N	449.492	1.720	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)[C@H]1CCCN(S(=O)(=O)Cc2ccccc2)C1	730514646	BZEWVEHYRRUGIT-SFHVURJKSA-N	433.505	1.758	50	20	IDGD	
CC(C)(C(=O)NNC(=O)Cn1c(CS(C)(=O)=O)nc2ccccc21)c1ccccc1	731176329	QDYYWQRCWROHFI-UHFFFAOYSA-N	428.514	1.706	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)c2nnn(-c3ccc(OC(F)F)cc3)c2C)c1O	731225421	XZPOQLRGGJDXHN-UHFFFAOYSA-N	433.371	1.966	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)c1ccc(Cl)c(S(=O)(=O)N2CCCCC2)c1	731851668	MJWODAXWRYUWBT-UHFFFAOYSA-N	425.898	1.621	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)N2CCN(S(N)(=O)=O)CC2)c(C)n1-c1ccccc1F	732066697	UCIIXWNHESCBBO-SFQUDFHCSA-N	431.493	1.488	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCCNC(=O)c2ccco2)cc1Br	732238480	QASHHNOTIZUSKK-UHFFFAOYSA-N	425.239	1.425	50	20	IDGD	
COc1ccc([C@]2(C)NC(=O)N(CC(=O)NNc3ccccc3S(C)(=O)=O)C2=O)cc1	732305523	MKXFIQSUKQBYMW-FQEVSTJZSA-N	446.485	1.009	50	20	IDGD	
COc1ccc(-n2c(C)cc(/C=C(\C#N)C(=O)N3CC[C@@H](S(N)(=O)=O)C3)c2C)cc1	732664233	LLQNTAJHJRWCHW-FVECTHPASA-N	428.514	1.899	50	20	IDGD	
CN(CCO)S(=O)(=O)c1ccccc1CNC(=O)NNC(=O)CCCc1ccccc1	733041167	SECXZDZEDACPKX-UHFFFAOYSA-N	448.545	1.153	50	20	IDGD	
O=C(NC[C@@H](c1ccccc1)N1CCOCC1)NNC(=O)c1cnn(-c2ccccc2)c1	733338726	JQVJRNFXWTUKBD-NRFANRHFSA-N	434.500	1.890	50	20	IDGD	
COc1ccc(OC)c([C@H](O)CNC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c1	733348526	PGSHDDQHZWXQBF-GOSISDBHSA-N	425.445	1.567	50	20	IDGD	
CC(=NNC(=O)c1ccc(O)c(Cl)c1)c1ccc(S(=O)(=O)NCC(=O)O)cc1	734093680	PNDBRQVJYAKZQO-UHFFFAOYSA-N	425.850	1.563	50	20	IDGD	
C[C@]1(C2CC2)NC(=O)N(CC(=O)NNc2cc(C(F)(F)F)nc(-c3cccnc3)n2)C1=O	734257903	VOQKVFLQJMJYKR-GOSISDBHSA-N	449.393	1.721	50	20	IDGD	
COc1ccc(C=NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c(OCC(=O)O)c1	734363167	VUKQDKZPWSLXOK-UHFFFAOYSA-N	435.458	1.173	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Cc2c[nH]c3ccc(F)cc23)cc1	734416682	AZFVEZTYEMWXMJ-UHFFFAOYSA-N	432.477	1.626	50	20	IDGD	
CCOCCCN1CC[C@@H](NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)[C@H](C)C1	734544400	RORLUHIPIMBFHS-IEBWSBKVSA-N	447.584	1.160	50	20	IDGD	
O=C(NNC(=O)c1cc2c(s1)CCCCCC2)N[C@@H]1CCN(CCN2CCOCC2)C1	734686658	SECZXZUHRJSBFH-GOSISDBHSA-N	449.621	1.758	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNS(=O)(=O)c2ccc(C(=O)O)cc2)CC1	734807410	OLDSIZJQRLKFOS-UHFFFAOYSA-N	442.494	1.277	50	20	IDGD	
C[C@@H]1CN([C@H](CNC(=O)NNC(=O)c2cnn(C)c2)c2c(F)cccc2Cl)CCO1	735580219	RYRAXPWKPYZEGY-MLGOLLRUSA-N	438.891	1.619	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN2CCN(CC(=O)N3CCCC[C@@H]3C)CC2)cc1C	736308354	LQKAABRUGNQZHN-KRWDZBQOSA-N	449.621	1.399	50	20	IDGD	
CN(C)c1nccc(NNC(=O)c2cccc(NC(=O)CSc3nncn3C)c2)n1	740114132	PYCHGESRUPLVHA-UHFFFAOYSA-N	427.494	1.159	50	20	IDGD	
Cc1cc(C#N)ccc1S(=O)(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12	740810536	YHHUZVAKQZEQLD-UHFFFAOYSA-N	425.470	1.781	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)[C@@H]1CN(Cc2ccccc2)CCO1	741215101	NZOTXCGLBIRGOR-FQEVSTJZSA-N	430.530	1.471	50	20	IDGD	
O=C(NNC(=O)C(F)(F)Oc1ccccc1)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])o1	741593497	IMZQKTIZMINKSI-LBPRGKRZSA-N	438.343	1.612	50	20	IDGD	
O=C(CCNS(=O)(=O)c1cccnc1)NNc1c(F)cc(F)cc1Br	742108472	TVKALCXXHMXLEA-UHFFFAOYSA-N	435.250	1.934	50	20	IDGD	
CC(C)(C)C(=O)NNC(=O)CSc1nnc(N2CCOCC2)n1Cc1ccccc1	742450613	CVZQKKUZSFGETF-UHFFFAOYSA-N	432.550	1.449	50	20	IDGD	
CS(=O)(=O)NCCc1ccc(C(=O)NNC(=O)c2cccc(Br)c2)s1	742772202	SGVLBVSWDQYUEX-UHFFFAOYSA-N	446.348	1.677	50	20	IDGD	
CCCS(=O)(=O)N1CCCC[C@H]1C(=O)NNC(=O)c1cc(Br)ccc1O	743730184	RAHPOHULNCUMTK-ZDUSSCGKSA-N	448.339	1.510	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)CCCNC(=O)c2ccc(F)cc2F)cc1	744518239	BNGJCVIDNUYYAZ-UHFFFAOYSA-N	444.394	1.351	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)NCCc2csc(N3CCCC3)n2)cc1C	745838617	PIQNWSOYPVYLSE-UHFFFAOYSA-N	430.534	1.872	50	20	IDGD	
O=C(NNC(=O)N1CCC(OCCN2CCCC2)CC1)c1cnn(-c2ccccc2)c1	745999139	SGWNZLRVXUKDNG-UHFFFAOYSA-N	426.521	1.804	50	20	IDGD	
Cc1nc2c(c(O)nn2C)c(C)c1CCC(=O)NNC(=O)c1nnc(O)c2ccccc12	746097139	VWDMTHPDHXIRMM-UHFFFAOYSA-N	435.444	1.333	50	20	IDGD	
Cn1nc(Br)c2c(=O)n(CC(=O)NNc3cc(F)c(F)c(F)c3)cnc21	746700147	SQOGNWNZSRQPAK-UHFFFAOYSA-N	431.172	1.453	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)Cc1cn2ccccc2n1)[C@@H]1CN(Cc2ccccc2)CCO1	746766988	IBDNHDGHBKJDDC-XLIONFOSSA-N	436.516	1.497	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1ccc(C(=O)NNc2nccn(C)c2=O)cc1	747942221	OQSDMNXUOWSTTO-UHFFFAOYSA-N	429.458	1.347	50	20	IDGD	
CC(C)Oc1ccc(-c2nc(C(=O)NNC(=O)N[C@@H]3CCS(=O)(=O)C3)cs2)cc1	749173490	LNHIGIXREXHILX-CYBMUJFWSA-N	438.531	1.728	50	20	IDGD	
O=C(COC(=O)C[C@@H](O)c1ccc(Cl)cc1)NNC(=O)[C@@H]1COc2ccccc2O1	750368907	CJZVQYJNQGTSDC-PBHICJAKSA-N	434.832	1.294	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(\C#N)C(=O)NNC(=O)CNC(=O)c2ccco2)c1C	751204933	SMJFSUXUDDNLGT-VEJKBTLKSA-N	427.461	1.390	50	20	IDGD	
Cc1sc2ncn(CCC(=O)NNC(=O)CNC(=O)c3cccs3)c(=O)c2c1C	751209475	QLMNJDISQABBAP-UHFFFAOYSA-N	433.515	1.104	50	20	IDGD	
CCOC(=O)c1ccc(N2CC(NC(=O)NNC(=O)Cc3ccc(Cl)cc3)C2)nc1	753278759	GTGVGUXMRREFPR-UHFFFAOYSA-N	431.880	1.673	50	20	IDGD	
COC(=O)c1c(Br)ccc(NC(=O)C(=O)NNc2nc3ccccn3n2)c1C	753850344	CZQMIDNTDZVFRL-UHFFFAOYSA-N	447.249	1.669	50	20	IDGD	
Cc1ccc(CNC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c(N2CCOCC2)c1	753926654	WRHSNGAMLTYMIF-UHFFFAOYSA-N	446.529	1.379	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@H](C)C(=O)NNC(=O)CN1C(=O)N[C@](C)(C2CC2)C1=O	754822161	BGAGPGBZMJJSOP-MPBGBICISA-N	436.896	1.592	50	20	IDGD	
COc1ccccc1-c1noc([C@H](C)NCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)n1	755042581	XAQNPCXEHLORHU-LBPRGKRZSA-N	440.416	1.765	50	20	IDGD	
O=C(NCCN1C(=O)[C@@H]2[C@@H](C1=O)[C@H]1C=C[C@H]2C1)NNC(=O)NCc1ccc(Cl)cc1	755256056	KGBFESOQVXXYIZ-SDADXPQNSA-N	431.880	1.161	50	20	IDGD	
CCN(CC)c1ccc(S(=O)(=O)N(CC)CC)cc1NC(=O)NNC(=O)COC	755401809	TXZYVANFTGADBW-UHFFFAOYSA-N	429.543	1.362	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)Nc2ccc(CC(=O)N3CCOCC3)cc2)cc1	755862555	SGFCPFMYKVFAAL-UHFFFAOYSA-N	437.456	1.191	50	20	IDGD	
COc1ccc(-n2cc(CNC(=O)NNC(=O)COc3ccccc3[N+](=O)[O-])nn2)cc1	756071016	RYDMXTKKLNQRLK-UHFFFAOYSA-N	441.404	1.094	50	20	IDGD	
CN(C(=O)Cc1ccc(NC(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)cc1)c1ccccc1	756098254	NFFBTBQPVSRVHL-INIZCTEOSA-N	444.513	1.480	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)Nc1cccc(S(=O)(=O)N2CCN(C)CC2)c1	756212658	NTWNMOLPGLUTPI-UHFFFAOYSA-N	431.518	1.398	50	20	IDGD	
COc1ccc(C(=O)N2CCOCC2)cc1NC(=O)NNC(=O)Cc1ccc(F)cc1	756255860	DRYXOJJICSIMKZ-UHFFFAOYSA-N	430.436	1.702	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN(C)[C@@H](C)c2ccc(S(C)(=O)=O)cc2)cc1OC	756482063	NFZXTOYCPNUVEQ-AWEZNQCLSA-N	449.529	1.561	50	20	IDGD	
CCn1nnnc1-c1cccc(NC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])c1	756685715	PBCGWPHLBFOFTE-UHFFFAOYSA-N	426.393	1.500	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)COc2cccc(C)c2)ccc1S(=O)(=O)N(C)C	757776531	QTRNLWNXBMXHCB-UHFFFAOYSA-N	436.490	1.486	50	20	IDGD	
CCOC(=O)N1[C@H](C(=O)NNC(=O)C(=O)Nc2ccccn2)CC[C@@H]1c1ccc(C)o1	758832707	IHHFGFBUOCKOMM-KGLIPLIRSA-N	429.433	1.431	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)[C@@H]2CCCN(S(=O)(=O)c3ccc(C)s3)C2)nc1	759730240	GBAOVZQHZAPGCM-CQSZACIVSA-N	438.531	1.782	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)C2=Cc3cc(Br)ccc3OC2)C[C@@H](C)O1	762188713	ANQZDAVYRSSTEF-CHWSQXEVSA-N	438.322	1.872	50	20	IDGD	
Cc1ccc2c(c1)C(=O)N([C@H](C)C(=O)NNC(=O)c1cc(-c3ccc(F)cc3)[nH]n1)C2=O	763174027	UOCQGLFPPNAIJE-GFCCVEGCSA-N	435.415	1.970	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)c2ccncc2)sc2c1CC[C@@H](C)C2	763461686	AHKCAEUTIXSALW-LLVKDONJSA-N	430.486	1.844	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2O)cc1OCc1cccnc1	763530778	ZKLNFYUQEMPJFU-UHFFFAOYSA-N	436.424	1.775	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)C(=O)Nc1cnn(Cc2ccc(Cl)cc2)c1	763549283	WNRXINLSAHZKTQ-UHFFFAOYSA-N	441.831	1.713	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2c(C)nc3ccccn23)n(-c2ccccc2F)n1	763627681	CSTFNLUZXAHFKB-UHFFFAOYSA-N	435.419	1.676	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2ccc(=O)n(Cc3ccccc3)c2)c1	763665341	FXUYVAHUAQLCKO-UHFFFAOYSA-N	448.479	1.678	50	20	IDGD	
COCC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)COc2cc(C)ccc2C)cc1	763665901	QQHQNKCJJOBFDJ-UHFFFAOYSA-N	428.445	1.053	50	20	IDGD	
CCCCN1CCc2ccc(NC(=O)C(=O)NNC(=O)COc3ccc(C#N)cc3)cc21	763680755	QHODYNMAKULTLC-UHFFFAOYSA-N	435.484	1.886	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)cc1	763736518	VQMHAWPQPIQVRG-UHFFFAOYSA-N	448.545	1.751	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2cccc(-c3nnc(C)o3)c2)c1	763773006	SPAIOUZZCFXTNK-UHFFFAOYSA-N	425.401	1.462	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2cc(-c3ccccc3C)nn2C)c1	763775185	MZMWKXYZRZNBJU-UHFFFAOYSA-N	437.456	1.812	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)C2=S=C3CCCC3=C2)n(-c2ccccc2F)n1	763786316	YTXSRAZIHZHOCG-UHFFFAOYSA-N	427.461	1.608	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)C(=O)Nc2ccc(-c3nccs3)cc2)c2ccccc2c1=O	763790824	PNZPQDGYJSCBMM-UHFFFAOYSA-N	448.464	1.457	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)C(=O)Nc2cnccc2C)c2ccccc2c1=O	763820125	GXAOHXWQZPQSPX-UHFFFAOYSA-N	436.472	1.690	50	20	IDGD	
CC(C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)cc1	763849009	GYSCYNLLZVGETL-CYBMUJFWSA-N	430.436	1.517	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccc(N3CCCC3=O)c(Cl)c2)n1	763880835	JLJZMNNDMSGUMW-UHFFFAOYSA-N	432.868	1.066	50	20	IDGD	
CCNC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)CSc2ccc(C)cc2)cc1	763895830	HXGUIVZZAQJODJ-UHFFFAOYSA-N	444.513	1.388	50	20	IDGD	
CC(C)n1nnnc1-c1ccccc1NC(=O)C(=O)NNC(=O)Cc1ccc(F)cc1	763919443	TWONYBRLZJYUJI-UHFFFAOYSA-N	425.424	1.389	50	20	IDGD	
COc1ccc(I)c(NC(=O)C(=O)NNC(=O)c2cccn2C)c1	763999184	QQALHDZECDQUNE-UHFFFAOYSA-N	442.213	1.038	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2cccc3ccccc23)cc1-n1cnnn1	764050253	DUNPNDXQGXZROE-UHFFFAOYSA-N	431.412	1.224	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1)[C@@H]1CN2CCCN1CC2	764074177	DRSKCSCBIKVKEO-GOTSBHOMSA-N	433.556	1.151	50	20	IDGD	
C#CCOc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(F)cc2Br)c1	764086976	ZRGQJAWGPKDCNB-UHFFFAOYSA-N	434.221	2.000	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(F)ccc2OC[C@@H]2CCCO2)c(O)c1	764104863	GLWKMFOLAMDSMK-AWEZNQCLSA-N	431.420	1.797	50	20	IDGD	
CN1CCC/C1=N\S(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)CC(C)(C)C)cc1	764197470	ABCVIWWGHDUNOM-HZHRSRAPSA-N	437.522	1.022	50	20	IDGD	
CCNS(=O)(=O)c1ccc(C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)cc1	764332088	CZPQSYSRKAOVDL-UHFFFAOYSA-N	438.456	1.912	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)C(=O)Nc1ccc(OCC(F)(F)F)nc1	764342239	DZPUYYJMQKZAOS-UHFFFAOYSA-N	448.361	1.608	50	20	IDGD	
CC(C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)cc1	764369565	IAIDNUHJAUMZLD-UHFFFAOYSA-N	434.399	1.583	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)N[C@H]1CCC(F)(F)C1	764379705	VDOZVYXJJJFQLH-AWEZNQCLSA-N	430.477	1.993	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)Nc1ccc(OC)cc1I	765412490	LJVDYZNNPYQMJO-SECBINFHSA-N	437.234	1.504	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccccc1F)NNC(=O)c1cc(-c2cccs2)[nH]n1	765568992	BJHWGJCLVSUKLL-UHFFFAOYSA-N	437.478	1.407	50	20	IDGD	
COC(=O)c1cccc(C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)c1	765757973	ZGQMKHCVKWYDSW-UHFFFAOYSA-N	444.919	1.705	50	20	IDGD	
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)NNC(=O)COc1ccccc1[N+](=O)[O-]	765892870	NBZFHKGMJDTYHY-DOTOQJQBSA-N	427.461	1.825	50	20	IDGD	
CC[C@@H](Oc1ccccc1C)C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	766653667	SNYVBWZSCAEOOF-HXUWFJFHSA-N	438.528	1.758	50	20	IDGD	
COC(=O)[C@@H](c1cccc(Cl)c1)N1CCN([C@H](C)C(=O)NNC(=O)CC(C)C)CC1	766974195	ZLUJWCWQBMNQEB-DNVCBOLYSA-N	438.956	1.754	50	20	IDGD	
Cc1ccc(N2C[C@H](C(=O)OCC(=O)NNC(=O)Cc3ccccc3C)CC2=O)cc1F	767258944	YNAWRFGALYGARR-QGZVFWFLSA-N	441.459	1.729	50	20	IDGD	
COc1ccc(NNC(=O)CCC(=O)N2CCN(c3ccccn3)CC2)c([N+](=O)[O-])c1	768338472	KCRXHKJSIHQZNS-UHFFFAOYSA-N	428.449	1.571	50	20	IDGD	
CCn1cnc2c1c(=O)n(CC(=O)NN=C1CCCOCC1)c(=O)n2Cc1ccccc1	770592536	UHDXBAIXHJVRMJ-UHFFFAOYSA-N	438.488	1.101	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])c2ncccc12	770775271	ZPYVQJPFEWCLCX-UHFFFAOYSA-N	439.384	1.317	50	20	IDGD	
CCOC(=O)CON=C(C(=O)NNC(=O)CC12CC3CC(CC(C3)C1)C2)c1cc[nH]n1	770814373	ZZZPQPMYAVWDEB-UHFFFAOYSA-N	431.493	1.447	50	20	IDGD	
Cc1cc2c(N3CCC[C@H]3C(=O)NNC(=O)C(=O)Nc3ccccn3)ncnc2s1	771029974	CRRSBCXFUVBBGY-ZDUSSCGKSA-N	425.474	1.150	50	20	IDGD	
CC(=NNC(=O)N[C@@H]1CCS(=O)(=O)C1)c1ccc(OC[C@@H]2CCCCO2)c(F)c1	771099912	HKSNMCVFOMTRFR-CVEARBPZSA-N	427.498	1.984	50	20	IDGD	
CCOC(=O)N1CC[C@H](NC(=O)NNC(=O)c2cc(OC)ccc2Br)C1	771381075	QEARLAKOQPRIIT-JTQLQIEISA-N	429.271	1.633	50	20	IDGD	
CNS(=O)(=O)c1ccc(C(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)cn1	771431997	NFZOBWJAIRCQKF-UHFFFAOYSA-N	438.409	1.040	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@@H](C(C)C)N2CCCS2(=O)=O)ccc1OC(C)C	772630910	PCGPDWZWWCCZCI-QGZVFWFLSA-N	427.523	1.304	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)[C@@H]2CCN(C(=O)CC)C2)c2ccccc2c1=O	773051141	TUMIFFQLFNGDLP-OAHLLOKOSA-N	427.505	1.606	50	20	IDGD	
COCc1ccc(S(=O)(=O)NNC(=O)c2ccc(CSc3nncn3C)cc2)cc1	774611853	SGKWOTUYNGTZFT-UHFFFAOYSA-N	447.542	1.877	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)Cn2c(S)nc3ccccc3c2=O)cc1	775200767	SAVUGQVWIQKRHW-ZDUSSCGKSA-N	442.497	1.699	50	20	IDGD	
C#CCOc1ccccc1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	776087199	IEFDQFYCKYPUIM-UHFFFAOYSA-N	442.497	1.950	50	20	IDGD	
Cc1cc(C)c2[nH]cc(C(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)c(=O)c2c1	776096077	FJLYIMKHMJLWHV-UHFFFAOYSA-N	442.497	1.470	50	20	IDGD	
CC[C@H](NC(=O)OC(C)(C)C)C(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776205100	JVKOLBIHDQGSKM-AWEZNQCLSA-N	443.545	1.925	50	20	IDGD	
Cn1c(CCC(=O)NNc2ccccn2)nc2cc(S(=O)(=O)N3CCOCC3)ccc21	777472356	DDDHQXVUHGINFO-UHFFFAOYSA-N	444.517	1.065	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)c1ccc(Oc2ccc(C(N)=O)cc2)cc1	778444014	ZQEAESBDSMVVCN-UHFFFAOYSA-N	428.445	1.864	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(C(=O)NNc2ccc([N+](=O)[O-])cc2Br)co1	779143263	XRKVNNJMEMLWCV-UHFFFAOYSA-N	433.240	1.958	50	20	IDGD	
CC[C@@H](C)n1nc(NC(=O)C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)cc1C	782896234	CRHQQKJQYIGCDK-LLVKDONJSA-N	449.537	1.164	50	20	IDGD	
COC(=O)c1cc(Br)c(F)cc1NC(=O)C(=O)NNc1cc(C)nc(C)n1	783326597	YUDQLGHOYHMRLX-UHFFFAOYSA-N	440.229	1.863	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2ccc(COCc3ccccc3)cc2)CCS(=O)(=O)C1	783424523	FFMLNMOKHNWHAT-NRFANRHFSA-N	431.514	1.540	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)C(=O)Nc1cccc(N2CCCC2)c1	784217664	WQUWHFROXFJRTQ-UHFFFAOYSA-N	443.529	1.809	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N2CCOCC2)cc1NC(=O)C(=O)NNc1ccccc1	784764995	KGXRYVNLBAYAQZ-UHFFFAOYSA-N	448.501	1.188	50	20	IDGD	
CCCNC(=O)[C@@H]1CN(C(=O)C(=O)NNc2ccc(F)c(F)c2F)c2ccccc2O1	784806583	JJKAKOLGJLLPOK-HNNXBMFYSA-N	436.390	1.867	50	20	IDGD	
CN(C1CC1)S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2cccc([N+](=O)[O-])c2)cc1	784828404	FRPVZFJDXRDHFO-UHFFFAOYSA-N	433.446	1.460	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)Nc1ccc(Cc2ccncc2)cc1	785023610	OEULBJLFJWFTMF-UHFFFAOYSA-N	435.396	1.686	50	20	IDGD	
CCCN1Cc2cccc(NC(=O)C(=O)NNC(=O)c3cc([N+](=O)[O-])ccc3O)c2C1	785024750	ZPCZMZYUICOKML-UHFFFAOYSA-N	427.417	1.426	50	20	IDGD	
N#CCCCN1C(=O)CCc2cc(NC(=O)C(=O)NNC(=O)c3ccccc3F)ccc21	787895714	YHFIGMJKQAAJEP-UHFFFAOYSA-N	437.431	1.808	50	20	IDGD	
CN(C)c1cccc(CCC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1	788624527	LUXZSQPGSBVCBE-UHFFFAOYSA-N	444.557	1.931	50	20	IDGD	
COC(=O)COc1ccc(C=NNC(=O)c2nnc(O)c3ccccc23)cc1[N+](=O)[O-]	788702065	CKVGSQSMSUOSON-UHFFFAOYSA-N	425.357	1.559	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2ccc(O[C@@H]3CCOC3)cc2)ccc1Cl	788719635	JYLMYIYXKGGFGY-CQSZACIVSA-N	439.877	1.230	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)c(F)c1	789819287	OQZOICAICURMFF-YOEHRIQHSA-N	429.404	1.271	50	20	IDGD	
CS(=O)(=O)CC[C@@H](C(=O)NNC(=O)C1CCN(c2ncccn2)CC1)c1ccccc1	789931110	OKMPCUSCYAHPOM-GOSISDBHSA-N	445.545	1.059	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)c1nn(-c2ccc(Cl)cc2)cc1O	790013334	WZNVRLUBHQPPDG-UHFFFAOYSA-N	448.266	1.962	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)Nc2cnc3c(c2)c(=O)n(C)c(=O)n3C)c1C	790558479	JAPOTIMFWRPFCB-SXGWCWSVSA-N	436.472	1.243	50	20	IDGD	
CN(NC(=O)[C@H]1CCN(CC(F)(F)F)C1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	792316274	BIHQXEJOWGSMJF-ZDUSSCGKSA-N	437.463	1.506	50	20	IDGD	
Cc1cccnc1NNC(=O)C(=O)Nc1ccc(N2CCOCC2)cc1N1CCOCC1	792375249	FJIXTLLERYHBRK-UHFFFAOYSA-N	440.504	1.145	50	20	IDGD	
COC(=O)NNC(=O)c1cccc(NC(=O)C[C@@H]2SC(N3CCCCC3)=NC2=O)c1	792608802	SNKLXIDXKXCLBC-AWEZNQCLSA-N	433.490	1.500	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2ccnc(N(C)C)n2)n(-c2nc3ccccc3s2)n1	793046426	MFNKCLZLJDEXAU-UHFFFAOYSA-N	437.489	1.728	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccccc1S(=O)(=O)C(F)F)c1c[nH]c2ccccc12	794579192	SVKXHZAXTPTUQC-UHFFFAOYSA-N	429.426	1.788	50	20	IDGD	
O=S(=O)(CBr)N1CCN(S(=O)(=O)Cc2ccc(Cl)c(F)c2)CC1	795156003	LOCNTVSYDCMEMF-UHFFFAOYSA-N	449.751	1.609	50	20	IDGD	
CN(C(=O)OC(C)(C)C)[C@@H](C(=O)NNC(=O)COCc1ccccc1)c1cnn(C)c1	796579068	OXDIMRLMZQEGEN-GOSISDBHSA-N	431.493	1.692	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccn(-c3ncccc3C(F)(F)F)n2)n1	797371122	PFKSXLCMLKZLJN-UHFFFAOYSA-N	433.350	1.389	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@@H]2C(=O)OCC(=O)NNC(=O)c2ccccc2)cc1	798791550	TZSLFESSZFJPIP-GOSISDBHSA-N	425.441	1.304	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)Nc1cc(F)c(Br)cc1Cl	799233193	DOTCMMULXAEPRO-ZCFIWIBFSA-N	428.667	1.829	50	20	IDGD	
CC(C)(C)OC(=O)NCC[C@@H]1CCCN(CC(=O)NNC(=O)c2ccc(C#N)cc2)C1	799357893	BVDSNMBXKUEPGG-KRWDZBQOSA-N	429.521	1.946	50	20	IDGD	
Cc1c([N+](=O)[O-])ccc(F)c1NC(=O)C(=O)NNC(=O)CN1CCCc2ccccc21	800622549	NPPCEWFKMBEZQV-UHFFFAOYSA-N	429.408	1.581	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccnc(CNC(=O)OC(C)(C)C)c2)cc1	801110112	PETQGGSMZONMST-UHFFFAOYSA-N	427.461	1.814	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1ccc(C(=O)NNC(=O)N=c2cc[nH]cc2)cc1	802028480	YYEINWKJGCEDQQ-UHFFFAOYSA-N	441.469	1.779	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)CCC(=O)N2CCN(c3ccccc3)CC2)cc1	802050836	HIZZUOBNQFLRHH-UHFFFAOYSA-N	425.489	1.977	50	20	IDGD	
CC(C)CSc1ccc(S(=O)(=O)NCC(=O)NNC(=O)C(C)(C)C)cc1[N+](=O)[O-]	802479178	ZPCCYTJCDPITBH-UHFFFAOYSA-N	446.551	1.815	50	20	IDGD	
COCCc1ccnc(NC(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)c1	806658169	PBWJCYPYPLCKMC-UHFFFAOYSA-N	436.513	1.912	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)C(=O)Nc1nc(-c2ccco2)cs1	806974355	GRAMWDFUPRRJLH-UHFFFAOYSA-N	431.386	1.476	50	20	IDGD	
Cc1sc2nc(CS[C@@H](C)C(=O)NNC(=O)N3CCN(C)CC3)nc(O)c2c1C	807381532	YFGMWKZAMPQNDY-LBPRGKRZSA-N	438.579	1.624	50	20	IDGD	
NS(=O)(=O)c1ccc(C=NNC(=O)Nc2ccc(C(=O)O)cc2)cc1Br	807973675	HWNVZVYXLCGMOH-UHFFFAOYSA-N	441.263	1.950	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NNC(=O)Cn2ncc3ccccc3c2=O)C1	808011229	RBZHMGOVGMJIIT-OAHLLOKOSA-N	429.477	1.191	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2O1)C(=O)Nc1ccc(Br)c([N+](=O)[O-])c1	810386969	ZICAUPXXWSAELA-AWEZNQCLSA-N	449.217	1.447	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(Br)cc1)NNc1cccc([N+](=O)[O-])c1	810678593	CSCAAGVROUHLDZ-UHFFFAOYSA-N	429.252	1.779	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NC[C@@H]2C[C@H](F)CN2C(=O)OC(C)(C)C)cc1	813815413	MGQRAJOCBJRDGQ-KBPBESRZSA-N	440.472	1.752	50	20	IDGD	
O=S(=O)(CBr)N1CCN(S(=O)(=O)Cc2ccc(C(F)F)cc2)CC1	815032512	HWINVAXFGVXYLD-UHFFFAOYSA-N	447.323	1.754	50	20	IDGD	
C[C@H](Cc1cnc2ccccc2n1)C(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	815467002	OLXMQBHSRDXKNO-CYBMUJFWSA-N	437.412	1.721	50	20	IDGD	
CNC(=O)c1cc(Oc2ccccc2NC(=O)C(=O)NNc2ncncc2F)ccn1	815764783	UWNXBYOSNDCFCG-UHFFFAOYSA-N	425.380	1.244	50	20	IDGD	
CCOc1ccc(NNC(=O)C(=O)Nc2ccc(N3CCN(C(=O)OC)CC3)nc2)cc1	815815186	OFQLFWINWDPYDH-UHFFFAOYSA-N	442.476	1.451	50	20	IDGD	
N#CCCn1cc(/C=C(\C#N)C(=O)NCCCCS(N)(=O)=O)c(-c2ccccc2)n1	818124341	CYTDOERGMLWMQP-GHRIWEEISA-N	426.502	1.556	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)Cn2c(S)nnc2-c2cccc(C)c2)cc1	825542670	WBDGJWZYVDQIOD-UHFFFAOYSA-N	426.502	1.810	50	20	IDGD	
CS(=O)(=O)N1CCCC[C@H]1C(=O)NNC(=O)c1ccccc1OCc1ccc(F)cc1	887594974	GXGKPSQGRMGEBU-SFHVURJKSA-N	449.504	1.980	50	20	IDGD	
O=C(Cc1cccc2ccccc12)NNC(=O)C1CCN(c2ccc3nnnn3n2)CC1	896967271	NZIRFUZYWOOFRL-UHFFFAOYSA-N	430.472	1.279	50	20	IDGD	
COc1cc(S(=O)(=O)N2CCOCC2)cc(C(=O)NNc2ccc(F)cc2)c1OC	912710011	BVIRTSRRUKIQHD-UHFFFAOYSA-N	439.465	1.621	50	20	IDGD	
Cc1ccc(/C=C(/C#N)C(=O)OCC(=O)N(C[C@@H]2CCCO2)[C@@H]2CCS(=O)(=O)C2)cc1	913229211	VEUWIYHDTOZEBT-BXWLARMLSA-N	446.525	1.640	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)[C@H]2CC(=O)N(CC(F)(F)F)C2)c2ccccc2c1=O	914750657	UBMOJEBOPGUKBU-NSHDSACASA-N	439.394	1.149	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@H]2CC(=O)N(C3CCCCC3)C2)c2ccccc2c1=O	914829707	MYMTYEGGUWSYSX-AWEZNQCLSA-N	425.489	1.359	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c(C)n1-c1ccccn1	914846758	YXIOMRSMAQSYEI-UHFFFAOYSA-N	441.513	1.814	50	20	IDGD	
O=C(CCn1ccccc1=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	914871189	WYKGDRRSADDOQQ-UHFFFAOYSA-N	443.463	1.458	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2CC(=O)N(c3ccc(F)cc3F)C2)cc1C	914881987	OVVMSBLXQQOIQR-ZDUSSCGKSA-N	430.411	1.721	50	20	IDGD	
CCOc1ccccc1C(=O)N1CCC[C@H]1C(=O)OCC(=O)NNC(=O)c1ccccc1	915006309	TUCIVTRDLQEMBG-SFHVURJKSA-N	439.468	1.694	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2ccc(OCC(=O)O)cc2)ccc1OC(C)C	915045026	QCYRUFTXOBAZSI-UHFFFAOYSA-N	438.458	1.569	50	20	IDGD	
COc1cccc([C@H](CNC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])N(C)C)c1	915902448	ULJQKIKKCCIHOA-KRWDZBQOSA-N	431.449	1.616	50	20	IDGD	
CC(=NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)c1ccc(O)cc1	915915072	MUAKMHOFNKBIKR-UHFFFAOYSA-N	431.514	1.886	50	20	IDGD	
O=C(NCc1nnc2ccc(C(F)(F)F)cn12)NNC(=O)c1cc(Br)c[nH]1	916222936	QGDSUYIQBMWKOV-UHFFFAOYSA-N	446.187	1.983	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)c1ccc(F)c(S(=O)(=O)N(C)C)c1	916361372	ZPAFRTMMVYNWHX-LLVKDONJSA-N	427.429	1.444	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)NC2CCC3(CC2)OCCO3)c2ccccc2c1=O	916412943	UXLGAQJWTAQGTR-UHFFFAOYSA-N	429.477	1.607	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)N[C@H]1CCN2CCC[C@H]2C1	916573905	SJAWTPOYGCKQIE-ROUUACIJSA-N	449.577	1.432	50	20	IDGD	
COCCNS(=O)(=O)c1cccc(C(=O)NNC(=O)Cc2ccc3ccccc3c2)c1	917197609	GCFQBCOZXFBMDS-UHFFFAOYSA-N	441.509	1.768	50	20	IDGD	
Cn1c2ccccc2c2cc(S(=O)(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)ccc21	918149433	XJDBMOYTBUJECL-UHFFFAOYSA-N	447.480	1.931	50	20	IDGD	
COc1cc(CNC(=O)NNC(=O)Cc2nc3ccccc3n2C)ccc1OCCO	918227971	CRTQMNPAMPWTCT-UHFFFAOYSA-N	427.461	1.026	50	20	IDGD	
NC(=O)c1ccc(/C=C\C(=O)N2CCC[C@H]2C(=O)NNC(=O)c2ccc(Cl)nc2)cc1	920037730	UHULOZHENHNSHA-AVFOEOQDSA-N	441.875	1.299	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@H](C(C)C)N2C[C@H](C)O[C@@H](C)C2)c2ccccc2c1=O	920275593	FMUQDZWPQHMCTH-DOXZYTNZSA-N	429.521	1.311	50	20	IDGD	
COC(=O)c1ccc(COc2ccccc2C=NNC(=O)N[C@@H]2CCS(=O)(=O)C2)cc1	920382541	ZAHYEYGMZYYTQW-GOSISDBHSA-N	445.497	1.872	50	20	IDGD	
CCCNC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1ccc2c(c1)OCCO2	921042116	AYLCQMVCIQYFIT-UHFFFAOYSA-N	434.474	1.613	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)NC[C@H](c2cccc(F)c2)N2CCOCC2)c1	921199336	HRDVXDBBKHVPSI-HXUWFJFHSA-N	429.496	1.909	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)NCc2c(F)cccc2NS(C)(=O)=O)c1	1116240299	CLLHHMQSHGEHNI-UHFFFAOYSA-N	440.453	1.359	50	20	IDGD	
CCOC1CC(CNC(=O)NNC(=O)c2cncn2-c2ccccc2)(N2CCOCC2)C1	1116811412	GCXOZOROEDQZOV-UHFFFAOYSA-N	442.520	1.086	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)[C@@H]2CC(=O)N(CC(F)(F)F)C2)CC1	1251914413	ICBQOAJWUYWMLK-GFCCVEGCSA-N	436.431	1.192	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NCc2cccc(CN3CCN(C)CC3)c2)cc1	1318283593	NYQIZXQZFCAQLG-UHFFFAOYSA-N	425.533	1.652	50	20	IDGD	
CNS(=O)(=O)c1ccc(CC(=O)NNc2ccc([N+](=O)[O-])cc2Br)cc1	1343088867	LYMSSFTZEBDMEG-UHFFFAOYSA-N	443.279	1.951	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)c1cc(Br)c(Br)[nH]1	1346853513	ZQQWQUDVIPBXLV-UHFFFAOYSA-N	440.092	1.825	50	20	IDGD	
CC1(C)NC(=O)N(CCCNC(=O)NNC(=O)c2cc(F)ccc2Br)C1=O	1347992946	GNRSCCJBNQOGOY-UHFFFAOYSA-N	444.261	1.253	50	20	IDGD	
O=C(c1cnc2ccccn12)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1777825209	QWCXCUYTRVTDLU-WMLDXEAASA-N	425.258	1.468	50	20	IDGD	
C[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Cl)C1	1778023119	ZHUQNNBMYRNILD-FGBSKUFISA-N	435.924	1.948	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@]2(C1)CN(C(=O)c1cccc3ccoc13)CCO2	1779036785	DOCUOBPFPFPGCI-QHCPKHFHSA-N	449.467	1.189	50	20	IDGD	
CCOc1ncc(Cl)cc1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](Cl)COC)CCO2	1779686780	CRYQMKUEWBJELH-HNAYVOBHSA-N	446.331	1.831	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc([N+](=O)[O-])c4c3OCO4)C2)C1	1780237498	PJEIHZHFSDQDPM-DJJJIMSYSA-N	439.852	1.784	50	20	IDGD	
C[C@H](Cn1cncn1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Br)C1	1780774479	BFYATOPDQYZIJO-VWPFQQQWSA-N	446.321	1.119	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(N4CCOCC4)cc3)CCO2)C1	1781218269	MUUVSXAOLWLGON-UGKGYDQZSA-N	435.952	1.984	50	20	IDGD	
O=C(c1cc2cccnc2[nH]1)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781330981	BOZVYBIRJIRKSK-SUMWQHHRSA-N	425.258	1.697	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3c(O)cc(O)cc3O)C2)C1	1781818983	SKYLVVBECHJYDP-BMLIUANNSA-N	429.267	1.030	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(=O)oc1)C2	1781900889	XLFGNRVBDVCLTH-SPYBWZPUSA-N	441.322	1.941	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc3n(n1)CCC3)C2	1781997824	LJDJNKQJKUIZQP-URKNILKWSA-N	439.354	1.740	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(C3CC3)on1)C2	1782169324	ZXJCLJRILXAEOI-JNAXZKDPSA-N	425.913	1.933	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc3cccnc3[nH]1)C2	1782175721	QBSREIXIQWZYOP-QLVMHMETSA-N	434.924	1.944	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnn3ccncc13)C2)C(Cl)Cl	1782217335	CSEYXOQDSITHNR-RDTXWAMCSA-N	426.304	1.661	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(CCN(C(=O)c3cnc4ccc(F)cn34)C2)C1	1782461125	UCQJFUKFNUFQEU-GOSISDBHSA-N	439.285	1.702	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cnccc3N(C)C)CCO2)C1	1783532924	UCGOFSIPMNBXNE-FZKQIMNGSA-N	425.327	1.375	50	20	IDGD	
CC(=O)Nc1ccccc1C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](C)Br)C2)C1	1783535968	CEOZXDXUBIMCBU-DJJJIMSYSA-N	438.322	1.872	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CC[C@@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1783848873	ASWAAHPMTFMNGH-CSODHUTKSA-N	438.597	1.423	50	20	IDGD	
Cc1cc(C)c(OCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]3C2)c(C)c1	1784084220	OAQJGDASCFRVEA-OKYOBFRVSA-N	438.952	1.570	50	20	IDGD	
COc1ccc(F)cc1CC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2	1784087855	ROVPZCOKDUMHLI-YJYMSZOUSA-N	443.313	1.990	50	20	IDGD	
Cc1ccc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]3C2)cc1[N+](=O)[O-]	1784093240	SLXOVPZGCGBADP-ONIAQPFYSA-N	439.896	1.025	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(-c4ncc[nH]4)cc3)C[C@@H]21)[C@H](O)CCl	1784095922	PKSYRSPFIISNDW-FJIDUMEYSA-N	432.908	1.270	50	20	IDGD	
C[C@@H](Sc1ccccn1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]2C1	1784096283	VARZOQCAZNXXNM-YXMSTPNBSA-N	427.954	1.142	50	20	IDGD	
O=C(CCc1cncc(C(F)(F)F)c1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1784295946	AEFINCRQYLDDGU-MAUKXSAKSA-N	449.857	1.463	50	20	IDGD	
Nc1nc2cc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)[C@H](O)CCl)C[C@@H]43)ccc2s1	1786908518	JGMKEIAYBVJOFD-VIRABCJISA-N	438.937	1.072	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CNC(=O)c3ccco3)[C@H]2C1	1787082951	PMQNSROPRJOZQD-VODUFIJXSA-N	446.331	1.225	50	20	IDGD	
Cc1c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]3C2)ccc2c1OCCO2	1787445338	BLUZLYZNFJNKNT-GKEYINFOSA-N	426.872	1.894	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3occc3C)C[C@@H]21	1787509131	VCXMUXGLBXSXPF-SMKMMKTPSA-N	441.488	1.315	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)[C@H](O)c3ccccc3)CCC2)cc1)c1cccc(B(O)O)c1	1788143527	BRBGETSMJDXYOX-JOCHJYFZSA-N	444.296	1.848	50	20	IDGD	
C[C@H](C(=O)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1)N1C[C@H]2C[C@H]2C1	1788145562	CLGCWRFCZMJVPS-QRQLOZEOSA-N	447.344	1.454	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21)c1ccc(OCCCO)cc1	1789235258	AYGWJFYFYDTYOW-XIRDDKMYSA-N	445.343	1.845	50	20	IDGD	
Cc1nn[nH]c1C(=O)NC1(c2ccc(NC(=O)c3cnccc3C(=O)NN)cc2)CCC1	1789522908	WHWXVWUEUHUDJB-UHFFFAOYSA-N	434.460	1.173	50	20	IDGD	
C[Si](C)(C)OCC(=O)Nc1ccc(C2(NC(=O)[C@H](O)N3CCOCC3)CCC2)cc1	1789647979	XOSVNSPNKGOXAM-FQEVSTJZSA-N	435.597	1.623	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccnc3C(N)=O)C[C@@H]21	1789868333	CEYPVKHIALVFQU-MDWPOOTQSA-N	443.331	1.010	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3c(O)cc(O)cc3O)C[C@@H]21)[C@H](F)Br	1789923582	VQMCIPIRMFUGKV-BOCCBSBMSA-N	447.257	1.087	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC1(c2ccc(NC(=O)c3cc4cccnn4n3)cc2)CCC1	1789993045	KEMYWJGDQGHKNR-UHFFFAOYSA-N	449.515	1.850	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cn(C)c4ncccc34)C[C@@H]21	1791055672	DCVZUYPBEVJMLP-RMRKRWHISA-N	449.349	1.950	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)COc3cc(Cl)ccn3)C[C@@H]21)C(Cl)Cl	1791298316	POIHOTQSOKLGIO-DRZSPHRISA-N	436.723	1.897	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3CC(C)(C)C3)[C@H]2C1	1791338917	FSCVHSHSRFGZQN-IIYRHJEWSA-N	443.548	1.536	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1cnc3ccccc3c1)C2)[C@@H](O)CCl	1792975560	UUAMKBGFOYPFJW-NZGUISNBSA-N	431.920	1.357	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(Cl)nc3ccccc13)C2)[C@H](O)CCl	1792978134	FQEGUJVGJAWAFO-XBCDXLOZSA-N	438.311	1.691	50	20	IDGD	
CC(C)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cncn1-c1ccncc1	1794462981	FTYFAJNDEFJYKN-JLVBRIDZSA-N	431.924	1.736	50	20	IDGD	
CCc1nn(C)c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CCC(=O)NN(C)C)C3)c1Cl	1794746065	LXSOBEDATKLMQT-BTTYYORXSA-N	438.960	1.261	50	20	IDGD	
C[C@@H](Oc1ccccc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCBr	1795115039	AYPHKROZICWTIK-ZXFNITATSA-N	425.323	1.829	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(O)c([N+](=O)[O-])c1)C2	1795115086	HDGQNZNDYGQLKK-DRXBFXEBSA-N	442.266	1.289	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCC#N	1795420402	QQKIMUMUWZPMHG-HBCWATKFSA-N	430.417	1.027	50	20	IDGD	
CC(C)[C@H]1CC[C@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2ccc(B(O)O)cc2)CC1	1795736680	FAPWQDOWUCCTMM-BUUIKWLOSA-N	442.365	1.032	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1n[nH]c2c1CS(=O)(=O)C2	1796386135	YYGBMSRSSXLEGD-GFQSEFKGSA-N	428.942	1.497	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@](C)(O)C(F)(F)F)C2	1796890699	GCVRGPOKAOAWBQ-JKHKVNPQSA-N	443.426	1.072	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1nnc(-c2ccccc2)o1	1797821700	OFYJVFYDLFSCSW-FZKCQIBNSA-N	434.880	1.194	50	20	IDGD	
CC(=O)N/C(=C\c1ccco1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CO[Si](C)(C)C	1797956148	DTPAOXUAXBEDOH-ZDLRXWDGSA-N	449.580	1.198	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1c(O)cc(O)cc1O	1799659311	SSJMKIHPGCRNJU-FXZYXXQUSA-N	443.294	1.180	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](C)NC(=O)c1ccc(F)cc1	1799815093	AGGJUMPXODWBPX-CUWKQTPXSA-N	439.915	1.836	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1n[nH]c2ccc(C#N)cc12	1799885630	UMJNGJVSRJGVQZ-YGSHXTJESA-N	446.305	1.421	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CS(=O)(=O)N1CCCC1)C2	1800078555	ANEPRPPAHRXHPY-LOUJCGABSA-N	440.393	1.287	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c(c1)OCO3)C2	1800640679	DJYVUTXNASXASU-LOUJCGABSA-N	439.306	1.792	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3ncccc3[nH]1)C2	1800642931	CQQZSULICIOERR-IPJQOSJUSA-N	435.322	1.940	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc3c1NC(=O)C3)C2	1800761652	DPBOMPZEZFOZJF-VFFTVRQLSA-N	436.306	1.168	50	20	IDGD	
COC(=O)c1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](O)CCl)C3)c([N+](=O)[O-])c1	1800792585	MEJUNSMSVOCLOY-OQMKEHIESA-N	439.852	1.233	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)C(C)(C)CCl)C3)C1	1800962598	RVWBHYVGBNJGPJ-OVYGPGRDSA-N	428.957	1.820	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(OC)cc1Cl)C2	1800983331	YQXCNCLLHOUVCP-CZAMWMTLSA-N	431.316	1.806	50	20	IDGD	
O=C1CSc2cc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)C(Cl)Cl)ccc2N1	1801015979	ALXHMAZFQNFBJP-QHBPRCKVSA-N	444.340	1.738	50	20	IDGD	
COC(=O)CCCCCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)CBr)C2	1801072068	WYWCADDVTMVABS-ZXFNITATSA-N	447.370	1.731	50	20	IDGD	
COc1ccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)Br)C3)cc1F	1801503283	ZQBFNAUBBCVGST-GNTLTTKYSA-N	443.313	1.750	50	20	IDGD	
CC(=O)NC(C)(C)C(=O)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@@H]1c1cccnc1	1803597174	YRZXSYLYOHVTRN-ZNMIVQPWSA-N	443.317	1.693	50	20	IDGD	
COc1ccc(F)cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(B(O)O)cc1)C2	1803607238	ZESIDVSNGFXCNJ-BCDXTJNWSA-N	426.253	1.080	50	20	IDGD	
O=C(CCN1C(=O)C=CC1=O)NC[C@H]1CCN(C(=O)C(Cl)Cl)[C@H]1c1cccnc1	1803916690	JHHNHHWSTRLTIH-DYVFJYSZSA-N	439.299	1.206	50	20	IDGD	
COc1cc(CCC(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)ccn1	1804273831	VDHRHGUSRJWFJF-BBTUJRGHSA-N	446.935	1.724	50	20	IDGD	
CNC(=S)NCCC(=O)N1CCC2(CCCN(C(=O)[C@@H](C)CBr)C2)CC1	1805383996	JVAWHAQBESACIZ-AWEZNQCLSA-N	447.443	1.733	50	20	IDGD	
O=C(c1cccc(-n2cncn2)c1)N1CCC2(CCCN(C(=O)[C@@H](O)CCl)C2)CC1	1805525918	BEIGZADESJKEIJ-SFHVURJKSA-N	431.924	1.712	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2nccs2)[C@@H]1c1cccnc1	1805942577	XLPRWWWPTJXHBQ-YJBOKZPZSA-N	430.534	1.231	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC2(CCCN(C(=O)c3cc[nH]n3)C2)CC1	1806230054	IMAVIRFVQREXOC-BUVRLJJBSA-N	425.493	1.389	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)c1ccc2c[nH]nc2c1	1808049992	ZAXCERLPCXHXQW-UHOSZYNNSA-N	427.892	1.877	50	20	IDGD	
Cn1ncc2c(C(=O)NC[C@@H]3CCN(C(=O)[C@@H](O)CCl)[C@H]3c3cccnc3)cccc21	1809428950	VPXBPFUMDFEKSJ-YSSFQJQWSA-N	441.919	1.888	50	20	IDGD	
O=C(c1ccn2ccnc2c1)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1	1809972029	JZHHZHYNLANRGZ-UHFFFAOYSA-N	446.316	1.173	50	20	IDGD	
O=C(CS[C@@H]1CCCCO1)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1	1810343426	VSWAVTRVIOEPKA-RNIPGJKVSA-N	441.981	1.947	50	20	IDGD	
CC(=O)NC(C)(C)C(=O)N1CC[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]1c1cccnc1	1810537511	JAAJBGHXULHLOH-PKOBYXMFSA-N	434.613	1.854	50	20	IDGD	
CCS(=O)(=O)CC(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](C)Br)[nH]n1	1815173931	INQCREAQADEKSG-ZYHUDNBSSA-N	435.344	1.620	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H]2CNC(=O)O2)n[nH]1	1815279516	GSCDKFWXJVOGJX-WCQGTBRESA-N	428.287	1.684	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](C)CBr)[nH]n1	1817989131	QEYUIQRGEYTSPO-GVXVVHGQSA-N	443.346	1.880	50	20	IDGD	
COC[C@@H](NC(C)=O)C(=O)N[C@@H]1CCc2nc(NC(=O)CO[Si](C)(C)C)sc2C1	1820165591	KNOXNEMDAFXRBB-TZMCWYRMSA-N	442.614	1.058	50	20	IDGD	
O=C(O)CSCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](F)Br)n[nH]1	1820936419	BZVKQWFGQLUEOP-RNCFNFMXSA-N	437.291	1.910	50	20	IDGD	
Cc1nc2ncccn2c1C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@H](O)CCl)CC1	1824186238	LOOVDLACZGLDBY-IAGOWNOFSA-N	433.940	1.871	50	20	IDGD	
CC(C)[C@H](S)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1	1824536941	BBQWSSOJCYDTQO-PMACEKPBSA-N	432.395	1.554	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CN2C(=O)CNC2=O)CC1	1824609662	OAIOQVMRWIMDIR-HOTGVXAUSA-N	426.945	1.565	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)CN2CC(=O)NC2=O)CC1	1824967099	LSXYLGIPTXKZDR-HZPDHXFCSA-N	426.945	1.565	50	20	IDGD	
O=C(CCN1C(=O)C=CC1=O)N[C@H]1CCc2nc(NC(=O)C(Cl)Cl)sc2C1	1826093347	XNCBATXYENQLQB-QMMMGPOBSA-N	431.301	1.174	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)c2cncs2)CC1	1826131757	DISJSWZUURMOBV-SFHVURJKSA-N	427.335	1.370	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCC([C@H]2CCCCN2C(=O)CN2CCNC2=N)CC1	1826874391	NPBBDZINPGAUKF-DNVCBOLYSA-N	432.396	1.682	50	20	IDGD	
C[C@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1)c1ccccn1	1827060343	YEMRVIWIVJATPK-MBSDFSHPSA-N	449.360	1.798	50	20	IDGD	
CN[C@@H](CC(=O)N1CCC([C@@H]2CCCCN2C(=O)CO[Si](C)(C)C)CC1)C(=O)O	1829102475	RPNRZBHFQDOZDC-IRXDYDNUSA-N	427.618	1.520	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccnc3S)CCO2)C1	1829791711	IYZNSQCCZMDTKN-DNVCBOLYSA-N	427.954	1.848	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H](N)CN)CC1	1831225139	HTEZUAOYXDPLNO-RZGBZVGDSA-N	445.514	1.777	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@H]2CCCS2(=O)=O)CC1	1831286226	STHMDJIGBWMADG-GVDBMIGSSA-N	434.986	1.437	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3c(F)c(C)nn3C)C2)C1	1831643843	IGINSEZQVYKTRV-KUHUBIRLSA-N	430.908	1.345	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ncc(F)cc3F)CCO2)C1	1831956361	ASGMKVIUVQKDPT-LIRRHRJNSA-N	431.867	1.837	50	20	IDGD	
CC(C)(CCl)C(=O)NC1CCN(C2CCN(C(=O)[C@H]3CCNC(=O)C3)CC2)CC1	1833216026	NBSPVTGCHMRCOP-HNNXBMFYSA-N	426.989	1.349	50	20	IDGD	
Cc1cccc(F)c1C(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)CCl)CC2)CC1	1833312943	MXFSFWBSYWRHAE-SFHVURJKSA-N	425.932	1.919	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccns3)CCO2)C1	1833779020	PQINPVFPHZFSHV-MLGOLLRUSA-N	432.340	1.387	50	20	IDGD	
Cc1c(C(=O)NC2CCN(C3CCN(C(=O)[C@H](F)Br)CC3)CC2)cnn1C	1834280946	OFVNZDCDNJCUHU-INIZCTEOSA-N	444.349	1.604	50	20	IDGD	
Cn1nc(C(=O)NC2CCN(C3CCN(C(=O)C(Cl)Cl)CC3)CC2)c2c1CCC2	1835397983	GDPFNIAEHUVQEK-UHFFFAOYSA-N	442.391	1.898	50	20	IDGD	
O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)c1cnccc1F)CCO2	1836313233	CZHDJCZIJKAHCS-QGZVFWFLSA-N	430.274	1.076	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC1CCN(C2CCN(C(=O)c3ccnnc3O)CC2)CC1	1836399933	QWMZMNIWIPIWKE-IBGZPJMESA-N	444.363	1.604	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccn3ccnc3c1)CCO2	1836986463	GOMQCIORXUYELG-OAQYLSRUSA-N	446.580	1.256	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC(OC2CCN(C(=O)CCS(C)(=O)=O)CC2)CC1	1838432219	HFSDTERRLHQKEL-UHFFFAOYSA-N	448.658	1.271	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(-c4ccncc4)[nH]n3)C2)C1	1839145826	RDQVJKBCZUOOIC-HRAATJIYSA-N	447.923	1.559	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)Oc3cccnc3)C2)C1	1839148451	ADXCZNQEDADCBK-RIFZZMRRSA-N	425.913	1.323	50	20	IDGD	
O=C([C@H](F)Br)N1CCO[C@]2(COCCN(C(=O)[C@H](F)c3ccccc3)C2)C1	1839198627	LIGVRGROEHABJE-VKJFTORMSA-N	447.276	1.844	50	20	IDGD	
O=C(c1ccc([N+](=O)[O-])cc1F)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1839278032	YOPGXFUDOLVJOZ-YOEHRIQHSA-N	433.795	1.338	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccncc3O)C2)C1	1839964838	GBONKRWUUPTZIO-KDOFPFPSSA-N	442.310	1.031	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccoc3Cl)C2)C1	1840034467	MLJLBPGVPCBYAJ-BDJLRTHQSA-N	435.702	1.786	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3CCCSC3)C2)C1	1840035847	HYDJGTRYFASZAQ-VBQJREDUSA-N	435.384	1.369	50	20	IDGD	
C[C@H](Nc1nccs1)C(=O)N1CCOC[C@]2(CN(C(=O)C(Cl)Cl)CCO2)C1	1840187495	FMTKBRLFHXOKKS-MEDUHNTESA-N	437.349	1.204	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)n1cccc1)CCO2	1840354038	AYFHTJPAPWNABE-JTDSTZFVSA-N	442.354	1.679	50	20	IDGD	
Cc1nc[nH]c1C(=O)N1CC2(CCCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C1	1841924969	SDWRVFAFCHXORN-ZDUSSCGKSA-N	425.917	1.667	50	20	IDGD	
O=C(/C=C/c1cc(F)c(F)c(F)c1)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843012315	BCNLOCTWVFUUPH-FARCUNLSSA-N	444.218	1.314	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@H]1CCN(C(=O)OC(C)(C)C)C1)C2	1846362748	UFROZGXTLKSNDY-GJZGRUSLSA-N	429.945	1.701	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2ccc(OCC3CC3)cc2)C1	1846863190	AGTSZYOBRYGNOV-UHFFFAOYSA-N	449.511	1.605	50	20	IDGD	
C#CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)[C@@H](C)Br)C2	1847071683	WSDRACQBVMIWIJ-ZIAGYGMSSA-N	442.354	1.890	50	20	IDGD	
CCOc1ncccc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)/C(C)=N/NC(=O)c1ccc[nH]1	1847183056	LVCVPCQGAHPFFE-YKLHELRZSA-N	438.488	1.430	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Cc2nc3ccccc3n2C)cc(Cl)c1OCC(N)=O	10123615	IQNGUZIMJASWIT-UHFFFAOYSA-N	445.863	1.103	50	20	IDGD	
COc1ccc(C(=O)C2CCN(CC(=O)NNC(=O)Cc3nc(C)cs3)CC2)cc1	14327420	ZNWJUQHZTHXCPY-UHFFFAOYSA-N	430.530	1.745	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)[C@@H]1CC(=O)N(c2ccc3c(c2)OCCO3)C1	24626553	VFHDSOKPJIXVFP-GFCCVEGCSA-N	445.859	1.934	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)CCn2cnc3ccccc3c2=O)c2ccccc2c1=O	27077759	KQSPRVNXNVZHOY-UHFFFAOYSA-N	446.467	1.368	50	20	IDGD	
COCCCNC(=S)N(C)NC(=O)c1ccc2c(c1)S(=O)(=O)c1ccccc1C2=O	726077039	MLZPSGDLBXMNPC-UHFFFAOYSA-N	447.538	1.551	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=S)Nc2ccc(Cl)nc2)cc1	727065708	FDVOPCMIROPGNJ-UHFFFAOYSA-N	427.939	1.682	50	20	IDGD	
C[C@@H](C#N)Oc1ccc(C=NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1	727687256	LWABHTQWLSXZIO-INIZCTEOSA-N	442.497	1.762	50	20	IDGD	
Cn1c(C(=O)NNC(=O)c2cccc(OC(F)F)c2)cc2c(=O)n3ccccc3nc21	728488161	MSDKNXFQJKJWDI-UHFFFAOYSA-N	427.367	1.862	50	20	IDGD	
O=C(CCc1nc(-c2cccs2)no1)NNC(=O)C1CCN(c2ncccn2)CC1	728847672	KNRUPQHLFWGCOW-UHFFFAOYSA-N	427.490	1.585	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCc2ccccc2)cc1C(=O)NNC(=O)Cc1cccnc1	728893942	YQMAYRCSGSZUKN-UHFFFAOYSA-N	438.509	1.872	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(C(=O)NNC(=O)c3cccc(C#N)c3)CC2)cc1C	728954379	DDIHXBVVCIAOAM-UHFFFAOYSA-N	441.513	1.536	50	20	IDGD	
O=C(CCCn1cccn1)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	729298684	RYWDEFDXIGZVFO-UHFFFAOYSA-N	430.468	1.883	50	20	IDGD	
Cn1cc(S(=O)(=O)N2CCCCC2)cc1C(=O)NNC(=O)Cn1ccc2ccccc21	729450588	DIBFMODIWPFBIU-UHFFFAOYSA-N	443.529	1.616	50	20	IDGD	
O=C(NNC(=O)c1cccc2ncccc12)c1ccc(S(=O)(=O)N2CCOCC2)cc1	730226410	KMDJXDDIGZZYNT-UHFFFAOYSA-N	440.481	1.331	50	20	IDGD	
O=C(COC(=O)CNC(=O)c1c(Cl)cccc1[N+](=O)[O-])NNC(=O)c1cccs1	731100690	DRBAAFADWIIFHR-UHFFFAOYSA-N	440.821	1.044	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)[C@@H](CCSC)NC(=O)c1ccc([N+](=O)[O-])o1	731493848	IMHOCNQKCMLJHY-GFCCVEGCSA-N	436.446	1.509	50	20	IDGD	
CNS(=O)(=O)C1CCN(C(=O)NNC(=O)c2ccc(COc3ccccc3)o2)CC1	732235897	LGSWQOFIRMBIMQ-UHFFFAOYSA-N	436.490	1.227	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCc2cccc(F)c2F)c1	732894859	RHYJXECOPPZRME-UHFFFAOYSA-N	426.445	1.402	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCC[C@@H](CNC(=O)C(C)(C)C)C2)cc1OC	732989710	UFWIWUATVRCFBW-HNNXBMFYSA-N	434.537	1.339	50	20	IDGD	
CN1CCN(Cc2ccc(CNC(=O)NNC(=O)c3cnn(-c4ccccc4)c3)cc2)CC1	733341164	WVMOGSNNKHADCK-UHFFFAOYSA-N	447.543	1.764	50	20	IDGD	
COc1ccc(C=NNC(=O)CCN2CCN(c3ccccc3)CC2)c(OCC(=O)O)c1	734362721	RZZGKLMSXCITEX-UHFFFAOYSA-N	440.500	1.821	50	20	IDGD	
O=C(NCCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1)NNc1cc(F)c(F)cc1F	734663391	LCJKOCPONJRFNT-UHFFFAOYSA-N	433.368	1.617	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)c3cn(C)c(=O)n(C)c3=O)c3ccccc3n2)cc1	734990387	IAQAMHQEYRZSGY-UHFFFAOYSA-N	443.463	1.682	50	20	IDGD	
COCCNS(=O)(=O)c1cccc(CNC(=O)NNc2cc(F)c(F)cc2F)c1	735587879	YJEGQJUAIIEYIP-UHFFFAOYSA-N	432.424	1.855	50	20	IDGD	
O=C(NNS(=O)(=O)C[C@@H]1CCCO1)[C@H]1Cc2ccccc2CN1Cc1ccccc1	735646321	PEDNZNXXYRYENJ-LEWJYISDSA-N	429.542	1.743	50	20	IDGD	
Cc1ccc(NCCCNC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c([N+](=O)[O-])c1	740026064	PCLQPZAHBPEYNW-UHFFFAOYSA-N	439.436	1.325	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)Nc2cnn(CC(=O)N3CCOCC3)c2)c1C	741701834	DGHWXJXBZSKSPT-ODLFYWEKSA-N	440.504	1.352	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)[C@H]2CCCCN2C(=O)c2ccc(O)nn2)cc1OC	741741259	SPFBEZOITQQIAQ-OAHLLOKOSA-N	443.460	1.045	50	20	IDGD	
COc1ccc(O[C@H](C)CNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1	743589726	XGXCKCIOQRFICW-OAHLLOKOSA-N	428.493	1.500	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)N[C@H]2CC(=O)N(CCOc3ccccc3)C2)cc1	743636712	IEKOWCXDSJEWOA-KRWDZBQOSA-N	440.504	1.768	50	20	IDGD	
CC[C@@H](C)c1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)C(C)(C)C)CC2)cc1	744382940	DKWWPQKHOKPFRO-MRXNPFEDSA-N	438.594	1.700	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CN2CCN(c3oc(-c4ccco4)nc3C#N)CC2)c1	744386822	SKMICZLLFPZCNO-UHFFFAOYSA-N	434.456	1.698	50	20	IDGD	
Cc1c(/C=C(\C#N)C(=O)O[C@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)cc(C#N)n1C	744632668	MTJLSZSAOWBBCJ-MGMWDDNKSA-N	441.469	1.330	50	20	IDGD	
COc1ccc(C2(C(=O)OCC(=O)NNC(=O)c3cccc(C#N)c3)CCOCC2)cc1	744860555	BGNPHTUVYDWJRU-UHFFFAOYSA-N	437.452	1.619	50	20	IDGD	
O=C(NNC(=O)c1cccc(CO)c1)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	745492379	ZMDIYWSLKMPKJH-UHFFFAOYSA-N	428.452	1.956	50	20	IDGD	
CC(C)(C)OC(=O)CCNC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	745835782	COEHVPCOYJCNGL-UHFFFAOYSA-N	440.522	1.147	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)N[C@H]2CCCN(c3ccn(C)n3)C2=O)cc1	745884502	YJUXGZFCUYHVHU-YOEHRIQHSA-N	444.492	1.112	50	20	IDGD	
O=C(NNC(=O)N1CCOCC1)c1ccccc1NS(=O)(=O)c1ccc(Cl)cc1	745991946	MSNSDXRRRGSCLD-UHFFFAOYSA-N	438.893	1.827	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)CN1CCN(C(=O)OCc2ccccc2)CC1	747398639	FSYFKDMUWXRCJI-UHFFFAOYSA-N	440.500	1.305	50	20	IDGD	
CC(C)CC(=O)NCCC(=O)NNc1ccc(S(=O)(=O)Nc2nccs2)cc1	747944225	RMRWBDWDDVEFCK-UHFFFAOYSA-N	425.536	1.939	50	20	IDGD	
O=C(CCN1CCN(C(=O)[C@@H]2CCCO2)CC1)NNc1ccc(F)cc1Br	748073822	BTAUMXGVGWHGPL-INIZCTEOSA-N	443.317	1.745	50	20	IDGD	
NS(=O)(=O)Cc1ccc(C(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)cc1	748521017	ZYUGVSFSSRQSBR-UHFFFAOYSA-N	437.421	1.526	50	20	IDGD	
C[C@H](C(=O)NNc1ccc(OCC(F)(F)F)cc1)N1C(=O)[C@H]2[C@H](C1=O)[C@H]1CC[C@H]2O1	748703799	SWPAZSUROJKSLU-WMESBKTJSA-N	427.379	1.622	50	20	IDGD	
Cc1cccc(S(=O)(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)c1C#N	749754980	ZSLVQTQBJQYNBL-UHFFFAOYSA-N	425.470	1.781	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CN(C)CCC2CCN(C3CCN(C)CC3)CC2)cc1	750835732	QDDBJRBXMXGIDN-UHFFFAOYSA-N	429.609	1.884	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)N(C)C[C@H](O)CN2CCOCC2)c(C)n1C[C@@H]1CCCO1	751430417	KPJJRNPDOAUJBC-XWGMMEHJSA-N	430.549	1.342	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)N[C@@H](CC(N)=O)C2CCOCC2)N(C)c2ccccc21	752709640	ZTNMDTLYYIICJQ-KRWDZBQOSA-N	439.516	1.444	50	20	IDGD	
COc1ccc([C@@H]2[C@@H](C(=O)NNC(=O)CO)CCC(=O)N2c2ccc(OC)cc2)cc1	753442957	QRASEBHCPMXTIX-GHTZIAJQSA-N	427.457	1.328	50	20	IDGD	
CC(=NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)c1cc(O)cc(O)c1	753691795	AYCPRBRYSCLFIO-UHFFFAOYSA-N	447.513	1.592	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)c1ccnc(O[C@H]2CCOC2)c1	754000344	MPTRMIPBZKDBFM-FQEVSTJZSA-N	439.516	1.223	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCO[C@@H](CCc3ccccc3)C2)cc1OC	755260802	FRDIKUVARHTFDE-IBGZPJMESA-N	427.501	1.798	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)Cc2cccnc2)cc1S(=O)(=O)N1CCCCC1	755412199	BVHXOCKWJJGGCZ-UHFFFAOYSA-N	447.517	1.660	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)c2cc(-c3ccccc3)on2)n([C@@H]2CCS(=O)(=O)C2)n1	755536699	UHNXGSDXDYKRQP-CQSZACIVSA-N	444.473	1.673	50	20	IDGD	
CN1CCN(C(=O)c2ccccc2NC(=O)NNC(=O)COc2ccc(C#N)cc2)CC1	755624517	VDGGTHMSFJJVFC-UHFFFAOYSA-N	436.472	1.178	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)ccc1NC(C)=O	755913522	IZTGXUUZDMIFHR-UHFFFAOYSA-N	449.489	1.370	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2ccc(CS(C)(=O)=O)cc2)c2ccccc2c1=O	756268724	GZDLWIDGRPHJQQ-UHFFFAOYSA-N	443.485	1.428	50	20	IDGD	
N#Cc1cc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)ccc1F	756358836	YYYBKGTXPOBZFH-UHFFFAOYSA-N	431.449	1.948	50	20	IDGD	
CC[C@@H](c1ccccc1)c1nnc(NC(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)s1	756461846	WLKAGKYAUOZSJG-JQWIXIFHSA-N	426.524	1.170	50	20	IDGD	
CCn1cc([N+](=O)[O-])c(C(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)n1	757595124	HPKFDAUBGRMINI-UHFFFAOYSA-N	425.446	1.061	50	20	IDGD	
C#CC[C@@H](NC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)c1ccccc1	757775209	JXCFNMHDKHJIHQ-LJQANCHMSA-N	442.545	1.408	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)COc2cccc(Br)c2)n1	757982273	KHIVTVWMXPDJMI-UHFFFAOYSA-N	442.291	1.526	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(C)(C)NC(=O)C(F)(F)F)cc1Br	758338980	UUDZBDFDIRZPHA-UHFFFAOYSA-N	426.189	1.676	50	20	IDGD	
O=C(c1cnnn1-c1ccccc1Cl)N1CCN(S(=O)(=O)CBr)CC1	758522427	HXMKGHINUNTHJN-UHFFFAOYSA-N	448.730	1.361	50	20	IDGD	
CN1C(=O)CCc2cc(C(=O)N3CCN(S(=O)(=O)CBr)CC3)ccc21	758528053	OKOZLIXSCYHFEN-UHFFFAOYSA-N	430.324	1.036	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)N[C@H]2CCN(C(=O)CC)C2)cc(OCC)c1OCC	762080127	DAMSRGRGBKMGQP-HNNXBMFYSA-N	436.509	1.838	50	20	IDGD	
CC[C@@H]1CN(C(=O)/C(C#N)=C/c2cn(CCC(N)=O)nc2-c2ccc(OC)cc2)C[C@H]1O	762209685	XLZZMCIWSCCQGZ-QHWBIOISSA-N	437.500	1.570	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H]2COc3ccc(Cl)cc32)c1	762359190	UIAVHHBDEDEFSJ-HNNXBMFYSA-N	438.893	1.668	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)[C@H](C(C)C)N3CCCS3(=O)=O)n[nH]2)c1	763176023	VOZGHMYHKWMKSS-SFHVURJKSA-N	433.534	1.515	50	20	IDGD	
CCS(=O)(=O)c1cccc(S(=O)(=O)NNC(=O)CSc2ccccc2O)c1	763408160	DEWDVFZKOAYYFC-UHFFFAOYSA-N	430.529	1.288	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2Br)cc1	763483492	VEOLGINKRMOUPJ-UHFFFAOYSA-N	440.275	1.252	50	20	IDGD	
Cc1cc(C(=O)N2CCOCC2)ccc1NC(=O)C(=O)NNC(=O)c1c[nH]c2ccccc12	763535717	KCBQBMZKHXESCN-UHFFFAOYSA-N	449.467	1.348	50	20	IDGD	
COC(=O)[C@H](C)Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(OC)c(OC)c2)cc1	763552120	VYBOCJKZRJCPFI-CYBMUJFWSA-N	443.456	1.455	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)Nc1csc(-c2ccccn2)n1	763570596	GTWMYHXVCQJWAW-AWEZNQCLSA-N	425.426	1.131	50	20	IDGD	
COC(=O)c1sccc1NC(=O)C(=O)NNC(=O)COc1ccc(C(C)(C)C)cc1	763599438	GVQFSUQXWFJHDX-UHFFFAOYSA-N	433.486	1.997	50	20	IDGD	
Cc1cnc(O)n1-c1ccccc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccccc2)[nH]n1	763603820	ATDBHCOVCUUQDQ-UHFFFAOYSA-N	445.439	1.676	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2c(C)nc3ccccn23)ccc1C(=O)NC(C)C	763627924	FTGIGGCXYQGANJ-UHFFFAOYSA-N	436.472	1.489	50	20	IDGD	
Cc1cc(C)n(-c2ccc(NC(=O)C(=O)NNC(=O)COc3ccc(C)c(C)c3)cn2)n1	763668159	ZEKJQLKZZRZDIH-UHFFFAOYSA-N	436.472	1.666	50	20	IDGD	
COc1ccc(Cn2nccc2NC(=O)C(=O)NNC(=O)c2cccc(N(C)C)c2)cc1	763760798	SIKXJJVBMBQUBH-UHFFFAOYSA-N	436.472	1.406	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccco3)nc3ccccc23)ncn1	763765154	XGVSDOLLKZFFGJ-UHFFFAOYSA-N	432.396	1.693	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)NC(=O)[C@@H](C)O2	763863874	DUOGSQPTSKASRB-MNOVXSKESA-N	430.392	1.099	50	20	IDGD	
COc1ccc(NC(C)=O)cc1NC(=O)C(=O)NNC(=O)CSc1ccc(C)cc1	763897042	TWHUPPGQJUYBCE-UHFFFAOYSA-N	430.486	1.840	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)C(=O)Nc1ccccc1CC(F)(F)F	763921838	PGSVWANBKKBFDI-UHFFFAOYSA-N	433.350	1.167	50	20	IDGD	
Cc1cc(C)n(-c2cccc(NC(=O)C(=O)NNC(=O)c3ccc4c(c3)OCCO4)c2)n1	764005448	YJCJIGWCRRIUKT-UHFFFAOYSA-N	435.440	1.660	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)[C@@H]1CS[C@@H](Cc2ccccc2F)C(=O)N1	764049611	KQWGDWDJHMSLOP-YOEHRIQHSA-N	449.529	1.614	50	20	IDGD	
COC(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)c1	764114977	JQVFTXDMNAFESQ-UHFFFAOYSA-N	426.212	1.885	50	20	IDGD	
CC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(C#N)cc2)c(C(F)(F)F)c1	764177790	RAFJESWVYUNUFG-UHFFFAOYSA-N	433.346	1.935	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)CCC(C)C)c(C(=O)N2CCCC2)cc1OC	764197738	GXAMPWBXXYNIST-UHFFFAOYSA-N	434.493	1.462	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)C(=O)Nc1cc(F)cc(N2CCOCC2)c1	764239568	OTWKFWOAKIZQMF-UHFFFAOYSA-N	439.447	1.403	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)C(=O)Nc1cc(I)ccc1Cl	764295227	KYCGLRSJZNDYMN-UHFFFAOYSA-N	447.620	1.376	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)CN(C(=O)OC(C)(C)C)CC3)cn1	764363198	LTDWLGSIXYDLFD-UHFFFAOYSA-N	442.476	1.113	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1ccc(O[C@H]2CCOC2)cc1	764393638	SDLDEBIAMSKFNQ-INIZCTEOSA-N	445.497	1.741	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)c1ccc(CN2CCC(CO)CC2)cc1	764591071	WWCIZCPMBHIPQN-UHFFFAOYSA-N	435.484	1.615	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)[C@H]1CCCN(C(=O)Cc2ccccc2)C1	765321432	AMPVJIHBRGXEHZ-SFHVURJKSA-N	446.548	1.920	50	20	IDGD	
Cc1nn2cc(S(=O)(=O)NNC(=O)c3cnn(-c4ccccc4)c3)cnc2c1Cl	766316228	DFBRADMLOMQBFI-UHFFFAOYSA-N	431.865	1.500	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3ccc(-n4cncn4)c(C)c3)CC2)cc1	766649445	PHSNZUMFMUNIMU-UHFFFAOYSA-N	447.543	1.463	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)Nc1cccc(CN2C(=O)CNC2=O)c1	767219913	GRJITKRPUZOWPI-UHFFFAOYSA-N	447.473	1.299	50	20	IDGD	
CC1(C)CCC[C@@]2(C1)NC(=O)N(CC(=O)NNC(=O)Cn1ccc3ccccc31)C2=O	768570689	ILTRWYDSJZLGGA-QFIPXVFZSA-N	425.489	1.680	50	20	IDGD	
Cc1cnn(Cc2ccccc2F)c1NC(=O)C(=O)NNC(=O)[C@H]1Cc2ccccc2O1	769266625	ORWYGPNFJHWKAU-GOSISDBHSA-N	437.431	1.469	50	20	IDGD	
CCc1ccccc1-n1cnnc1SCC(=O)NNc1nc(O)c2cnn(C)c2n1	770991515	SGVGWWARHXMVGO-UHFFFAOYSA-N	425.478	1.447	50	20	IDGD	
C[C@@]1(c2ccc(Br)cc2)NC(=O)N(CC(=O)NNC(=O)c2ccc[nH]2)C1=O	771236804	VNWVLYHXEHVLJC-KRWDZBQOSA-N	434.250	1.005	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)[C@H]1CSCN1C(=O)c1ccc(C(C)(C)C)cc1	772094482	DBSNJPYIXSVNLT-CZUORRHYSA-N	435.546	1.988	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)CCCNC(=O)c1cccnc1	772455129	SCBITQGCYRNCHT-UHFFFAOYSA-N	433.534	1.812	50	20	IDGD	
COc1ccc(Cn2nccc2NC(=O)C(=O)NNc2cnc3ccccc3n2)c(OC)c1	773719135	OOURJWHCCNFMIH-UHFFFAOYSA-N	447.455	1.974	50	20	IDGD	
O=C(NNC(=O)c1cc(OC(F)F)cc(OC(F)F)c1)c1ccc(-n2cnnn2)cc1	775642789	NYOZMEMATXWTTM-UHFFFAOYSA-N	440.313	1.940	50	20	IDGD	
CCC(CC)n1nc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1C	776427281	DFQJZYLJQDOVSR-SFHVURJKSA-N	430.461	1.697	50	20	IDGD	
CCO[C@@H]1C[C@@H](NC(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)[C@H]1Oc1ccccc1	776530925	JEIGKVHUAINGJS-KBAYOESNSA-N	430.417	1.869	50	20	IDGD	
CCCNC(=O)c1cccc(C(=O)N2CCN(S(=O)(=O)CBr)CC2)c1	777777490	JSVUDWRWWIPXJX-UHFFFAOYSA-N	432.340	1.266	50	20	IDGD	
CCN(CC)C(=O)c1ccc(S(=O)(=O)NNC(=O)CNC(=O)OC(C)(C)C)cc1	777938710	DJFPVCKWAXJMBZ-UHFFFAOYSA-N	428.511	1.003	50	20	IDGD	
Cc1cc(C)c(S(=O)(=O)N(CCc2ccccc2)CC(=O)NN(C)C(N)=O)c(C)c1	778417137	NWFLTJZSPLZSSL-UHFFFAOYSA-N	432.546	1.887	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)[C@@H](C)CS(=O)(=O)c2ccc(OC)cc2)nc1C	778421452	NACARTADADWEQB-LBPRGKRZSA-N	436.490	1.523	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(Oc2ccccc2)c(C#N)c1	778712768	HXFHBGXWXDRAAI-CQSZACIVSA-N	426.429	1.488	50	20	IDGD	
C[C@@H]1CCN(C(=O)OC(C)(C)C)[C@@H](C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)C1	778835689	KEQHWWGZOVZLFV-ZIAGYGMSSA-N	443.545	1.877	50	20	IDGD	
COc1ccc(Cn2ccc(NC(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)n2)cc1	779505047	BOLXYKFRAJTTEL-UHFFFAOYSA-N	443.485	1.810	50	20	IDGD	
O=C(C[C@H](NC(=O)c1ccc(O)cc1)c1ccccc1)NNC(=O)C(=O)Nc1ccccn1	780634744	RLJSZRVKRPPDPS-SFHVURJKSA-N	447.451	1.435	50	20	IDGD	
CN1C[C@H](C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c2ccccc2C1=O	781821331	GZJDQQHDRMLGFW-NRFANRHFSA-N	435.528	1.216	50	20	IDGD	
Cc1ccc(Cl)c(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)c1	783262024	AJOJLXSUUUYNDL-UHFFFAOYSA-N	425.898	1.812	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2cc(Cl)ccc2OC[C@H]2CCCO2)CCS(=O)(=O)C1	783427613	PFRJVSSPAPAZHZ-ACJLOTCBSA-N	445.925	1.034	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2cccc(OCc3ccc(F)cc3)c2)CCS(=O)(=O)C1	783429044	ZHNWDHCTYWTYMX-HXUWFJFHSA-N	435.477	1.541	50	20	IDGD	
Cc1ccnc(NNC(=O)C(=O)Nc2ccc(S(=O)(=O)N3CCC[C@H](C)C3)cc2)c1	783930645	KMQLPGXJGZHHIO-HNNXBMFYSA-N	431.518	1.892	50	20	IDGD	
CCCn1ccc2ccc(NC(=O)C(=O)NNC(=O)CNC(=O)c3cccs3)cc21	784003890	RBXNIKAMWKDJHA-UHFFFAOYSA-N	427.486	1.629	50	20	IDGD	
CC(=O)Nc1cc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)ccc1C	784208179	LHTOMJFKFWHWTL-UHFFFAOYSA-N	445.501	1.476	50	20	IDGD	
O=C(NNc1c(Cl)cc(F)cc1Cl)C(=O)Nc1ccn(CCN2CCOCC2)n1	784878675	SLPNULUCTKLZLM-UHFFFAOYSA-N	445.282	1.743	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2ccc(CN(C(C)=O)C3CC3)cc2)n1	785225355	HEYCZYJEPSGPOA-UHFFFAOYSA-N	439.520	1.916	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H](c2cc(C(=O)NNC(=O)c3ccc4c(c3)OCO4)n[nH]2)C1	786624866	MKZBOXDSXZPLBT-CYBMUJFWSA-N	443.460	1.938	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1cnc(O)c2ccccc12	787095509	LMRSDQMWGFVXCC-UHFFFAOYSA-N	428.470	1.718	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@@H]2C(=O)NNc2ccccc2S(N)(=O)=O)s1	788232220	RENUQGLGKNBWNR-CYBMUJFWSA-N	444.560	1.000	50	20	IDGD	
CCCCOc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)cn1	789812000	IFUNPTAHJMPLGD-HKUYNNGSSA-N	426.473	1.919	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)[C@@H]1CC12CN(C(=O)OC(C)(C)C)C2	789834115	AQJWSQQAZAMMKF-ZDUSSCGKSA-N	426.514	1.696	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)c1c[nH]nc1-c1ccoc1	789992238	WXJCMLOHMWEGDI-UHFFFAOYSA-N	442.907	1.902	50	20	IDGD	
COC(=O)c1cccc(Cl)c1S(=O)(=O)NNC(=O)c1ccc2c(c1)OCCO2	790045316	LJFMLIDCCBYRQQ-UHFFFAOYSA-N	426.834	1.521	50	20	IDGD	
Cc1ccn(C[C@@](C)(O)C(=O)NNC(=O)c2ccc(Br)cc2Cl)c(=O)c1	790642337	RXGCKGISJJNPML-QGZVFWFLSA-N	442.697	1.785	50	20	IDGD	
CN1CCC(Oc2ccc(CNC(=O)NNC(=O)CNC(=O)OC(C)(C)C)cc2)CC1	790928460	XTIFKTWDCVFFLD-UHFFFAOYSA-N	435.525	1.515	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1cc([C@H]2CCCOC2)nn1C	790952981	YRJDOCNHPBDDQS-OLZOCXBDSA-N	433.440	1.007	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)NCCCCn1cc(Br)cn1	792221796	OOURKLJKMXAVPQ-UHFFFAOYSA-N	434.298	1.647	50	20	IDGD	
C[C@@H](C(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)[C@@H]1OCCc2sccc21	796496796	YVCZKWXSXZHONY-DIFFPNOSSA-N	433.442	1.911	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2CCCN(C(=O)NC3CCCC3)C2)cc1C	798309841	PDBUCYCGSGEDEY-MRXNPFEDSA-N	429.521	1.754	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NN=CC1(SC)CC1)N(S(C)(=O)=O)CC2	800808919	VBAGCIAPYLHVJV-HNNXBMFYSA-N	441.575	1.950	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)N2CCN(c3ccc(F)cc3)CC2)cc1	801107161	NZYBIIWLRKLLJK-MRXNPFEDSA-N	427.480	1.431	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)C2(NC(=O)c3c(C)nn(C)c3C)CCCC2)cc1	801110349	WHGHODBTFJNWKP-UHFFFAOYSA-N	440.504	1.174	50	20	IDGD	
C[C@@]1(c2ccc(C(=O)NNC(=O)Nc3ccc(OC(F)F)cc3)cc2)NC(=O)NC1=O	802045255	JGPFUJCHWLFYMT-IBGZPJMESA-N	433.371	1.809	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@@H](C)Oc3ccc(C=O)cc3)CC2)cc1	802762453	HGUNWRPHRHPHSQ-LJQANCHMSA-N	438.528	1.540	50	20	IDGD	
Cn1cnc2c(C(=O)NNC(=O)CN3CCN(Cc4ccccc4Cl)CC3)ccnc21	805191926	UMFRXVIZTCJCJC-UHFFFAOYSA-N	441.923	1.201	50	20	IDGD	
CN(C)S(=O)(=O)C[C@H](NC(=O)NNC(=O)c1cc2ccccc2cc1O)C(F)(F)F	806565342	LAHALQVAHXYGHY-AWEZNQCLSA-N	448.423	1.312	50	20	IDGD	
O=C(NNc1ncccc1F)C(=O)Nc1cc(N2CCCS2(=O)=O)ccc1Cl	807301562	JUYLMUGUGKAESB-UHFFFAOYSA-N	427.845	1.496	50	20	IDGD	
CC(C)(C)OC(=O)N1CCc2ncc(NC(=O)C(=O)NNc3ncccc3F)cc2C1	807302354	SBHLDNHCJILVSG-UHFFFAOYSA-N	430.440	1.991	50	20	IDGD	
Cc1cc([N+](=O)[O-])ccc1NNC(=O)C(=O)Nc1cccc(N2CCS(=O)(=O)CC2)c1	807455220	HTLSGKMAUOMRLR-UHFFFAOYSA-N	447.473	1.220	50	20	IDGD	
CC(=O)N1C[C@@H]2[C@@H](CCC[C@H]2NC(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)C1	808357622	LKPCGGFRQBOYNC-ARFHVFGLSA-N	425.530	1.269	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(Oc3cccnc3)cc2)cc1	808934327	AAIPQGFUAAEXTP-UHFFFAOYSA-N	431.408	1.910	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCC3)cc2[nH]ccc12	808934633	OJPLASDKPYBRBO-UHFFFAOYSA-N	426.454	1.904	50	20	IDGD	
COc1ccc(S(=O)(=O)NCC(=O)NNc2ccc(Cl)cc2[N+](=O)[O-])cc1OC	810153645	AILSNEBCMBIRJT-UHFFFAOYSA-N	444.853	1.687	50	20	IDGD	
COC(=O)c1c(F)ccc(NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c1F	810338787	KEDUFHPVXCYAKU-UHFFFAOYSA-N	431.355	1.465	50	20	IDGD	
COC(=O)COc1c(C)cc(C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)cc1C	812732285	ZGYUGGHMWPBSBU-UHFFFAOYSA-N	435.502	1.862	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)CCn3ncn(C)c3=O)c3ccccc3n2)cc1	814718135	KHHFSTGNHYUZLO-UHFFFAOYSA-N	430.468	1.957	50	20	IDGD	
CC(=NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1)c1cn(-c2ccccc2)nn1	814730536	QPOQQGNARCCJFN-UHFFFAOYSA-N	426.502	1.737	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCO1)C(=O)Nc1cc(I)ccc1Cl	815779614	NOQVKXLIYFBZAP-SNVBAGLBSA-N	437.621	1.210	50	20	IDGD	
Cn1c(=O)n(CC(=O)NNC(=O)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)c2ccccc21	816509550	UVYBKHJCKDKDET-CQSZACIVSA-N	431.493	1.135	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NNC(=O)c2ccccc2CN2CCOCC2)C1	816511092	OPXASECONKHMMJ-GOSISDBHSA-N	446.548	1.927	50	20	IDGD	
C=C[C@@H](O)C(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2cccc(C(F)(F)F)c2)c1	816830147	SZFAWFGXCJELOB-OAHLLOKOSA-N	443.403	1.814	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCc2nncn2C1)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-]	816881648	LVUYHYQPULXDRP-HNNXBMFYSA-N	436.428	1.789	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccccc1	864020342	SOXADWKHOBNQMN-KRWDZBQOSA-N	435.477	1.595	50	20	IDGD	
CCc1c(C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cnn1-c1ccccc1	914630278	FPKXEGCKXPZRPO-UHFFFAOYSA-N	437.412	1.961	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2CC(=O)N(c3ccc(F)cc3F)C2)cc1C	914881985	OVVMSBLXQQOIQR-CYBMUJFWSA-N	430.411	1.721	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)c1ccc(-n2ccnc2S)cc1	915674833	KCFJEHQEXYIBAY-UHFFFAOYSA-N	430.515	1.529	50	20	IDGD	
NS(=O)(=O)c1ccc(CNC(=O)NNC(=O)CSc2ccc(Cl)cc2)s1	915906135	LPVLYMWZUKJVML-UHFFFAOYSA-N	434.952	1.672	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NCc2ccccc2OC(F)(F)F)c2ccccc2c1=O	916228600	IYDZPRLBJPGBQE-UHFFFAOYSA-N	435.362	1.976	50	20	IDGD	
C[C@H](NC(=O)NNc1ccc(-n2cccn2)nn1)c1ccc(OCC(=O)NC2CC2)cc1	916489383	KSJSJZBVVLWPHH-AWEZNQCLSA-N	436.476	1.707	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)NCc2ccc(S(=O)(=O)N(C)C)cc2)c1	916646801	ORECQCDGPCNYOU-UHFFFAOYSA-N	434.518	1.463	50	20	IDGD	
O=C(Cc1ccc2ccccc2c1)NNC(=O)CN1C(=O)COc2ccc([N+](=O)[O-])cc21	917195789	YTAPWVGXFZQSHT-UHFFFAOYSA-N	434.408	1.864	50	20	IDGD	
Cc1cccc(NC(=O)[C@H]2CCCN(CC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)C2)n1	917399786	DJOHVHVHAQBLQU-INIZCTEOSA-N	440.460	1.410	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc2nc(O)cc(C(=O)NNC(=O)CC(F)(F)F)c2c1	918365511	ASMGGQVLWPGDIX-UHFFFAOYSA-N	448.423	1.684	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNS(=O)(=O)c2c(F)cc(F)cc2F)ccc1Cl	918725452	LAQRQONVDLTRGD-UHFFFAOYSA-N	443.812	1.028	50	20	IDGD	
CC(C)n1nc(C(=O)NNS(=O)(=O)c2cccc3c2COC3=O)c2ccccc2c1=O	918726561	QYTQKGCHRBGTJX-UHFFFAOYSA-N	442.453	1.271	50	20	IDGD	
O=C(COC(=O)c1cccc(N2CCOC2=O)c1)NNC(=O)c1ccc([N+](=O)[O-])cc1	919199161	WCCGJOZPGWFMNU-UHFFFAOYSA-N	428.357	1.169	50	20	IDGD	
CNS(=O)(=O)c1ccc([C@H](C)NC(=O)NNC(=O)Cc2c[nH]c3ccccc23)cc1	919778487	CVVLMQKBLNCXJR-ZDUSSCGKSA-N	429.502	1.710	50	20	IDGD	
O=C(NNC(=O)C1CCN(Cc2ccccc2)CC1)c1csc(N2CCOCC2)n1	919963930	VBCNCWHPGNGCJB-UHFFFAOYSA-N	429.546	1.653	50	20	IDGD	
CCn1c(NNC(=O)C2=NN(c3ccc(F)cc3)[C@H](C(N)=O)C2)nc2ccccc2c1=O	935364329	SATLROXOJFUQKS-KRWDZBQOSA-N	437.435	1.119	50	20	IDGD	
CCOc1ccccc1C(=O)N1CCC[C@@H]1C(=O)NNC(=O)c1n[nH]c2c1CCCC2	1317820586	BZKWZALLZUZHGG-QGZVFWFLSA-N	425.489	1.753	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NCc1ccccc1N1CCN(C)CC1	1318261831	DNXYKPJXEKIPBX-INIZCTEOSA-N	429.496	1.875	50	20	IDGD	
COc1ccccc1CC(=O)N1CCC(NC(=O)NNc2nncc(N)c2Cl)CC1	1324020807	GCLSREDHFBCZHZ-UHFFFAOYSA-N	433.900	1.581	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnn4ccncc34)C2)C1	1777988343	LBKSGXBQNROZDJ-MSOLQXFVSA-N	426.304	1.409	50	20	IDGD	
CC[S@@](=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@](C)(Cl)CCl)C2	1779220412	JKZMMUITQCMWJZ-OUJRWXTJSA-N	441.421	1.895	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCc2nc(N)n[nH]2)C1	1779239224	UIVXGTWGZLLMPV-IQUTYRLHSA-N	426.949	1.241	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc[n+]([O-])c1)C2	1780710208	LRMUYLGVMROTPM-AYOQOUSVSA-N	430.332	1.684	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Br)C2)[C@@H](F)Br	1780773825	NHMFHXNPEKCDLM-VWMGYNLJSA-N	448.102	1.881	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)[C@H]3CCc4nc[nH]c4C3)CCO2)C1	1781231873	BBHHBKCGABSXCB-AGRHKRQWSA-N	429.348	1.581	50	20	IDGD	
O=C(c1ccc2c(c1)COC2)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781329829	KVXUIOAOQVBUMU-YJBOKZPZSA-N	427.270	1.851	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)/C=C3\C(=O)Nc4ccccc43)CCO2)C1	1783534512	VNZJDAKVSANQQR-GWXHHLPMSA-N	448.317	1.635	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cc(Cl)nc(OC)c3)CCO2)C1	1783877117	GCHJSZVNPGQAKC-FZKQIMNGSA-N	432.304	1.441	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(-c4ncc[nH]4)cc3)CCO2)C1	1783884918	VOQDDGSNTQHCLD-UWJYYQICSA-N	432.908	1.774	50	20	IDGD	
CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783950400	WHFROXRCXOVOPD-SFHVURJKSA-N	445.303	1.908	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3CC(=O)N(C4CCCC4)C3)[C@H]2C1	1784967634	DAXRDROMQGOILL-BVRUVYRISA-N	439.984	1.775	50	20	IDGD	
CCOC(=O)/C=C/C(=O)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1	1788140756	SKITVVINSQQVNN-OUKQBFOZSA-N	436.273	1.233	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCC(=O)N3CCCC3)C[C@@H]21	1788765027	FSMCXSXMFQEXIG-BZSNNMDCSA-N	439.629	1.220	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc4ncsc4[nH]3)[C@H]2C1	1788787206	NDILZSGUJPEXKI-ASHKBJFXSA-N	426.926	1.472	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)c1ccc(Br)cn1	1788831136	LGIHVHOVVYHCCU-FATJJJSSSA-N	446.729	1.037	50	20	IDGD	
CCc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]3C2)n(C)n1	1789924494	HRUREZLZHSBLGD-HQRZJTNHSA-N	431.306	1.266	50	20	IDGD	
CCCC(=O)N[C@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]2C1	1791055732	HGCVVIQYWCASMB-MRLBHPIUSA-N	432.359	1.054	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)c1ccc(OCC2CC2)cc1	1792036445	QVLRVXPQXJMJDY-LEAZDLGRSA-N	436.936	1.668	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(-c2ccccc2)on1	1792459346	CZMFATQQPVXTKD-BCDXTJNWSA-N	439.516	1.966	50	20	IDGD	
C[C@@H](CBr)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCNC(=O)c1ccc[nH]1)C2	1792987598	VMRYHKPGDIWYBD-XQLPTFJDSA-N	439.354	1.804	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](O)CCl)C1	1793111859	ZNDGMIJNWNDYAZ-QMHWVQJVSA-N	429.945	1.481	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1C[C@@H]1F)C2	1793879040	BMQHAPCACZHSHD-IWTMDLJTSA-N	433.908	1.066	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2)c1ccc(Br)nc1F	1794241339	NZARDMSAQXNFHQ-VVJJBPBLSA-N	438.656	1.721	50	20	IDGD	
COc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Cl)cc1NC(C)=O	1796366049	IPVXFLZXOXNRSP-DLTLXFJOSA-N	427.860	1.391	50	20	IDGD	
COC(=O)c1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Cl)c([N+](=O)[O-])c1	1796366853	JCFRBLUZIZPNTD-BAESOJJISA-N	443.815	1.119	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1snnc1C	1797061327	WHOMWRFBQDBGHP-ZVMOGAGKSA-N	429.506	1.232	50	20	IDGD	
Cc1c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CO[Si](C)(C)C)cn2[nH]cnc(=O)c12	1798626959	BRBUISDBURBQOK-QDMKHBRRSA-N	431.569	1.434	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3n[nH]cc3c1)C2)[C@H](F)Br	1799346319	PCJLKUOJVFUXRN-NEBZKDRISA-N	425.258	1.457	50	20	IDGD	
C/C=C/C=C\C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2	1800484446	VBGOPQHCHPWTHY-PYTDSYFNSA-N	443.456	1.856	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3nn[nH]c3c1)C2	1800642943	DOUZVTAJSJECKQ-OQMKEHIESA-N	436.310	1.335	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccncc1C(F)(F)F)C2	1800978701	ZBPNPGHYWCXHOG-JLUCKKNBSA-N	435.830	1.557	50	20	IDGD	
Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCC(=O)NN(C)C	1802338894	ZZQVHFRDHQZCEM-QDMKHBRRSA-N	449.483	1.667	50	20	IDGD	
NC[C@H](C(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)c1ccccc1	1803138746	MKJHISWEFUXUOH-FYQPLNBISA-N	430.936	1.430	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2nnsc2C2CC2)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803139484	PZIIXTHFSAGGSW-OFQRWUPVSA-N	435.937	1.730	50	20	IDGD	
C#CCO[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@@H]1c1cccnc1	1803549650	CHYMHOLKYDJPHP-SLBVQIDZSA-N	426.286	1.816	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@H](CNC(=O)c2ccc(O)nn2)[C@@H]1c1cccnc1	1805268326	KADNDJFQPDZELM-KXBFYZLASA-N	429.553	1.748	50	20	IDGD	
Cc1cncc(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)c1	1805767464	QZSKKJBTNZYDSI-DENIHFKCSA-N	444.300	1.098	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1807366910	VXEJFXIYJTXDHB-HKUYNNGSSA-N	443.740	1.346	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)CCC2CCC2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1	1807367028	WVMQDSDPQRGMAG-OFNKIYASSA-N	435.333	1.661	50	20	IDGD	
C[C@]1(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)CC=CCC1	1807375604	UFHNORJCYLNVFF-XTJBDQBJSA-N	447.344	1.827	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)[C@H](F)Cl)[C@@H]1c1cccnc1	1808312358	CWASSIKAKNUWRB-AYGWOXMKSA-N	448.886	1.756	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)c1ccc2nonc2c1	1809126435	DMUBUCICFYGHGT-BMGDILEWSA-N	429.864	1.537	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC2(CCCN(C(=O)[C@@H]3CNc4ccccc43)C2)CC1	1809803467	VECQCCGHKIRUBM-OAQYLSRUSA-N	447.344	1.421	50	20	IDGD	
C=CCC(F)(F)C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1812667542	FLIFRCKQNMRFMW-MJGOQNOKSA-N	443.259	1.292	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)c(C)o1	1813070108	FGLTUMVVLJLRAX-AVRDEDQJSA-N	441.532	1.984	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2cccc(C#N)c2)[C@@H]1c1cccnc1	1813073239	ODZMJJDQVKEXGX-NFBKMPQASA-N	448.527	1.646	50	20	IDGD	
CC(=O)c1cc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)n[nH]1	1816295123	NMYKDGJSDJCPBV-INIZCTEOSA-N	444.496	1.014	50	20	IDGD	
O=C(CC(F)(F)C(=O)O)Nc1nc2c(s1)C[C@@H](NC(=O)CCBr)CC2	1817091237	OPMSYVUGUINFLW-ZETCQYMHSA-N	440.266	1.950	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@H](O)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](F)Cl)n[nH]1	1818035556	NUZLVZNERVIFJO-OBJOEFQTSA-N	447.895	1.822	50	20	IDGD	
Cc1nccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)n1	1822413926	HRJHGZDMCFSQIE-INIZCTEOSA-N	428.497	1.187	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)C(C)(C)NCCC#N)[nH]n1	1822414235	NIQIGAKTSNRWLM-MRXNPFEDSA-N	446.556	1.057	50	20	IDGD	
Cc1ccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)c(O)n1	1822415102	TXJRLKHPMQSDSZ-INIZCTEOSA-N	443.508	1.498	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)CCc2ncc[nH]2)n[nH]1	1822632565	JHTYWCMTPXBYQN-HNNXBMFYSA-N	430.513	1.131	50	20	IDGD	
O=C1CCc2ccc(C(=O)N3CCC([C@H]4CCCCN4C(=O)[C@H](O)CCl)CC3)nc2N1	1824182532	FLIXSBBCWIGBIH-QZTJIDSGSA-N	448.951	1.799	50	20	IDGD	
O=C1Cc2cccc(C(=O)Nc3nc4c(s3)C[C@@H](NC(=O)[C@@H](O)CCl)CC4)c2N1	1824198850	NJJXDAHWCFFIHP-GWCFXTLKSA-N	434.905	1.463	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ncc[nH]2)CC1	1825637733	DZHYKSPNEPAIST-GTPWMTBTSA-N	439.520	1.777	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnc(O)nc1O)CC2	1825640897	KWLWJPKNFJDLBZ-BQBZGAKWSA-N	442.295	1.354	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CO[Si](C)(C)C)CC1	1827561936	JZEZQKZJHISSNO-IRXDYDNUSA-N	426.634	1.905	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CS[C@H]3CCCCO3)C2)C1	1830364661	OAISPLRPALQFNX-FXAWDEMLSA-N	449.013	1.968	50	20	IDGD	
C[C@H](Cc1ccncc1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830365193	BHFFBAPFJPEVFS-VGSWGCGISA-N	437.968	1.982	50	20	IDGD	
CCCOc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)cc1	1830733848	VSSQJNDHPOYQFJ-RXVVDRJESA-N	440.924	1.145	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H]2CCNC(=O)C2)CC1	1831656800	KVLSVNJOANTPSZ-IMJJTQAJSA-N	428.371	1.916	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(C(=O)O)ncn2)CC1	1831829001	WYXSSCGXLFTUIX-RHSMWYFYSA-N	438.912	1.662	50	20	IDGD	
CCc1cc(C(=O)N2CCC([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)n(C)n1	1831873774	XIVCKWCWACUTEI-LJQANCHMSA-N	446.596	1.589	50	20	IDGD	
Cc1nnc(CCC(=O)N2CCO[C@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)s1	1833022834	BFDRTJSDESXYLF-MRXNPFEDSA-N	437.349	1.039	50	20	IDGD	
CC(C)[C@@H](O)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](C)CBr)CC2)CC1	1833265461	XELASBUMDVPLPJ-WMLDXEAASA-N	432.403	1.606	50	20	IDGD	
O=C(COc1ccccc1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1834954344	NVIKMIHFVCSIPK-SJLPKXTDSA-N	445.285	1.212	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)Cc1ccc(F)cc1)CCO2	1835050133	ISVYPUKVEVUYBE-OAQYLSRUSA-N	438.572	1.676	50	20	IDGD	
Cc1cc(C(=O)N2CCC(N3CCC(NC(=O)[C@@H](F)Cl)CC3)CC2)nc2nccn12	1835080996	BTPLJTMQZUUDCO-QGZVFWFLSA-N	436.919	1.757	50	20	IDGD	
CC(C)CNC(=O)C(=O)NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1	1835130469	IHWZOAVTOJUWHN-HNNXBMFYSA-N	449.365	1.021	50	20	IDGD	
O=C(Cn1cnc2ccccc21)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836719157	OMZDAUMSFHVMSA-FQEVSTJZSA-N	448.951	1.635	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)C3(F)CCCCC3)C2)C1	1837713069	FMROUOZOCYSUHP-LJQANCHMSA-N	430.593	1.967	50	20	IDGD	
O=C(NCC(=O)N1CCC(OC2CCN(C(=O)[C@@H](F)Cl)CC2)CC1)c1ccco1	1837962479	SFDYDJXKDBPEFJ-QGZVFWFLSA-N	429.876	1.542	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ncccc3F)CCO2)C1	1838251654	GBOLFZPZEVRNBZ-ACJLOTCBSA-N	444.301	1.464	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)cc(O)n1	1839152231	RKGCCNHINKAQGS-RTBURBONSA-N	446.331	1.402	50	20	IDGD	
CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](Br)Cc1ccccc1)CCO2	1839802429	WXTPHQWNPILQOA-YLJYHZDGSA-N	439.350	1.859	50	20	IDGD	
Cc1ccc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)cc1	1840031878	FSLZELIIUALGJX-OXJNMPFZSA-N	439.350	1.777	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C=C/c3ccccc3)C2)C1	1840032081	NJUNZLUEQXMUHC-APJIANLZSA-N	437.334	1.940	50	20	IDGD	
O=C(C(Cl)Cl)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CCc3ccccc31)CCO2	1840260317	KQGXXRBLGDTIKW-OXJNMPFZSA-N	427.328	1.977	50	20	IDGD	
CCOc1ccsc1C(=O)N1CCCC12CN(C(=O)c1cnccc1C(=O)NN)C2	1840982409	GGBRQAVWFHXRNA-UHFFFAOYSA-N	429.502	1.276	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC2(CCCN2C(=O)CN2CCCCC2)C1	1842817963	YRZWDUHZPIKLOS-INIZCTEOSA-N	442.988	1.808	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1cnnc3ccccc13)C2	1843416072	VXNWOGLUUUNEHT-CVKSISIWSA-N	445.483	1.581	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC2(CCCN2C(=O)c2cccc(N3CCOCC3)n2)C1	1843527738	IZHROGCHWWNMIM-UHFFFAOYSA-N	432.597	1.587	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)N1CCCC12CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2	1844371003	CLZUJGOSDDIZIU-CYBMUJFWSA-N	444.444	1.028	50	20	IDGD	
CC(C)(C)OC(=O)NCCOCC(=O)N1CCCC12CN(C(=O)CO[Si](C)(C)C)C2	1845154516	RXSLIKKHTNJQRE-UHFFFAOYSA-N	443.617	1.583	50	20	IDGD	
C=CCNC(=S)NNC(=O)c1cc(S(=O)(=O)N(CC)CC)ccc1N1CCCC1	725908495	DEKKCNCAAOXOLL-UHFFFAOYSA-N	439.607	1.612	50	20	IDGD	
COCCCNC(=S)N(C)NC(=O)c1ccc(S(=O)(=O)Nc2ccccc2)cc1	726076572	XWNIWVMGNBHUJJ-UHFFFAOYSA-N	436.559	1.975	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)NCC(=O)N2CCc3ccccc32)cc1	726281350	NURVDTCIOTWYPK-OAHLLOKOSA-N	426.473	1.772	50	20	IDGD	
O=C(NNc1nc(-c2ccncc2)no1)[C@@H]1CCCCN1S(=O)(=O)c1ccccc1	726377316	VQLNHTQBTFYMBL-INIZCTEOSA-N	428.474	1.818	50	20	IDGD	
O=C(NCc1cccc(OCC(F)F)c1)NNC(=O)c1csc(N2CCOCC2)n1	726611961	YYRPIRGULNKFOR-UHFFFAOYSA-N	441.460	1.768	50	20	IDGD	
O=C(NNC(=O)c1ccc[nH]1)c1cccc(S(=O)(=O)NCc2ccc3c(c2)OCO3)c1	726630890	URTHDZANNMLFKR-UHFFFAOYSA-N	442.453	1.297	50	20	IDGD	
CN(C)CCNC(=O)c1cccc(CNC(=O)NNC(=O)COc2ccccc2F)c1	727604343	WIOUSZZZRPCHQL-UHFFFAOYSA-N	431.468	1.027	50	20	IDGD	
CN(C)N(C(=O)c1cccc(S(=O)(=O)N2CCCCCC2)c1)[C@@H]1CCS(=O)(=O)C1	728178080	BFCKDTNRCGDSMV-QGZVFWFLSA-N	443.591	1.357	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1csc(N2CCOCC2)n1)c1ccc2c(c1)CC(=O)N2C	728301409	CMCIHFLGHLIAGU-LBPRGKRZSA-N	444.517	1.204	50	20	IDGD	
O=C(NCc1ccccc1CN1CCCC1)NNC(=O)C1CCN(c2ncccn2)CC1	728945208	VZTWQTZWDZQHKI-UHFFFAOYSA-N	437.548	1.819	50	20	IDGD	
C[C@]1(c2ccc(CNC(=O)NNC(=O)c3cccc4ncccc34)cc2)NC(=O)NC1=O	730127226	LIRPFEBZONNYCV-JOCHJYFZSA-N	432.440	1.434	50	20	IDGD	
Cc1c(C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)nnn1-c1cccc2cnccc12	731165339	NYRIJXVIQBZBKP-IBGZPJMESA-N	430.424	1.725	50	20	IDGD	
CCNS(=O)(=O)CCNC(=O)C(=O)Nc1ccccc1S[C@@H](Cl)C(F)(F)F	731763395	OBVXJWFEOZVRJP-CYBMUJFWSA-N	447.888	1.900	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)N1CCN(S(=O)(=O)c2cc(Cl)ccc2Cl)CC1	731848840	NTWHEEABZXLVBS-NSHDSACASA-N	437.349	1.246	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCCNc2ccc(C#N)cn2)cc1Br	732240768	JYXJSLVJIMCXEM-UHFFFAOYSA-N	433.266	1.780	50	20	IDGD	
N#Cc1ccc([C@H](NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)C(N)=O)cc1	734507394	XIBBRSPEPDCPTD-IBGZPJMESA-N	441.513	1.194	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2nc(-c3ccc(Cl)cc3)no2)c1	734535190	VODHHNCTRVIZKB-UHFFFAOYSA-N	449.876	1.938	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCOCC2)cc1C(=O)NNc1cc(F)c(F)cc1F	734554836	KFQGDODSTGUGIQ-UHFFFAOYSA-N	445.419	1.890	50	20	IDGD	
Cc1ccc(OCC(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)cc1C	735116874	JIHBLJQGLUEXKW-UHFFFAOYSA-N	433.534	1.157	50	20	IDGD	
COc1ccc(N2CCN(CCNC(=O)NNC(=O)COCc3ccccc3)CC2)cc1	738460314	JQLHABBFCYVOAY-UHFFFAOYSA-N	441.532	1.364	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNS(=O)(=O)c2ccc(C#N)cc2F)CC1	739672035	MYJJAFKSNWDXNZ-UHFFFAOYSA-N	441.485	1.589	50	20	IDGD	
CC(=O)N[C@@H](CC(=O)NNC(=O)c1ccc(COc2ccc(Cl)cc2)cc1)C(N)=O	740748872	BPEMVGAZAVKPNZ-KRWDZBQOSA-N	432.864	1.060	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCc1nc(-c2ccccc2)n[nH]1	741419239	SLHIREJNEXEXBD-UHFFFAOYSA-N	442.505	1.217	50	20	IDGD	
CN(CCCC(=O)NNC(=O)COCc1ccccc1)C1=NS(=O)(=O)c2ccccc21	741946782	YJMDMGQBQNSDSD-UHFFFAOYSA-N	444.513	1.212	50	20	IDGD	
O=C(NNC(=O)c1cnc2c(c1)c(O)nc(=O)n2C1CC1)c1cccc(Br)c1	742771982	MDJDBUDFKIIIGZ-UHFFFAOYSA-N	444.245	1.669	50	20	IDGD	
O=C(C/N=C1/NS(=O)(=O)c2ccccc21)NNC(=O)Nc1ccc(OC(F)F)cc1	743832957	WRWDTDLAVYHELA-UHFFFAOYSA-N	439.400	1.179	50	20	IDGD	
COc1ccc(CC(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)cc1OC	744618834	FBLHVHOLOUVRNT-UHFFFAOYSA-N	435.502	1.411	50	20	IDGD	
O=C(CN1C(=O)CCc2ccccc21)NNc1ccccc1S(=O)(=O)N1CCOCC1	744620691	JVFZOBYJZBBGHC-UHFFFAOYSA-N	444.513	1.130	50	20	IDGD	
CC(=O)[C@H]1CC(C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)=NN1c1ccccc1	745029003	KQKXBOPIRSUJOY-LJQANCHMSA-N	433.424	1.086	50	20	IDGD	
CC[C@@H]1Oc2cc([C@@H](C)NC(=O)NNC(=O)CNC(=O)c3ccco3)ccc2NC1=O	745933198	UUJWFELGHFXJDF-RISCZKNCSA-N	429.433	1.211	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)CC2CN(C(=O)OC(C)(C)C)C2)c2ccccc2c1=O	746097164	WGZURIIGJGCBJN-UHFFFAOYSA-N	429.477	1.434	50	20	IDGD	
C[C@]1(c2ccc3ccccc3c2)NC(=O)N(CC(=O)NNC(=O)c2ccc(C#N)cc2)C1=O	747214487	IVRIFCKLYNIWJR-XMMPIXPASA-N	441.447	1.940	50	20	IDGD	
O=C(CN1CCN(C(=O)OCc2ccccc2)CC1)NNc1nc(-c2ccncc2)no1	747372539	KJDDXPKUVGTYKN-UHFFFAOYSA-N	437.460	1.529	50	20	IDGD	
Cn1ccnc(NNC(=O)c2ccc(S(=O)(=O)NCCc3cccs3)cc2)c1=O	747941446	FKFDJJJZOHUZLC-UHFFFAOYSA-N	433.515	1.120	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CC12CCOCC2)c1cccc(S(=O)(=O)NCc2ccccc2)c1	748527245	KZIGJEYTILDPQP-IBGZPJMESA-N	443.525	1.743	50	20	IDGD	
C[C@H](O)c1ccc(CNC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc1	749348231	JEPKIAZHYDAAKT-HNNXBMFYSA-N	446.529	1.669	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NC2CCN(c3cc(C)nc(C)n3)CC2)cc1	749616719	RXQLWOPPXSNBKI-UHFFFAOYSA-N	428.493	1.480	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(Br)cc2[N+](=O)[O-])c1	750818959	HWPGLNDTXWGWKI-UHFFFAOYSA-N	442.247	1.836	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNS(=O)(=O)c1cc(C(=O)O)cc(F)c1C	751261098	IQPGNNYCNLFGRK-UHFFFAOYSA-N	426.422	1.620	50	20	IDGD	
CCOC(=O)[C@H](NCC(=O)NNC(=O)c1cc(Cl)ccc1OC)C1CCOCC1	755194710	YBCISPFITSPSTM-QGZVFWFLSA-N	427.885	1.058	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)Nc2cc(C)nn2[C@H]2CCS(=O)(=O)C2)c2ccccc2n1	755537766	YIJGTUHJLIMQMM-AWEZNQCLSA-N	442.501	1.874	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)Nc1cccc(C(=O)N2CCOCC2)c1	755935181	ZPRILCKQDQBEAS-CQSZACIVSA-N	430.436	1.918	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)Nc2cccc(N3C(=O)CNC3=O)c2)o1	755991895	KNQAINIXYWFHJW-UHFFFAOYSA-N	428.449	1.644	50	20	IDGD	
C[C@@H]1C[C@@H](NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)CN1Cc1ccccc1	757773557	PIJHNSULYFWWBQ-CRAIPNDOSA-N	430.530	1.697	50	20	IDGD	
Cc1cccc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1Br	757823247	XRLVTSXZVZPEMQ-HNNXBMFYSA-N	449.257	1.902	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)Nc1ccccc1CN1CCNC1=O	757922564	CUJCOYLKXAOPGS-UHFFFAOYSA-N	438.492	1.071	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1csc(-c2cccc(C(F)(F)F)c2)n1	758038078	BZGWHDGBEKHZFQ-QMMMGPOBSA-N	436.437	1.528	50	20	IDGD	
CCN(CC)[C@@H](C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)c1cccc(C(F)(F)F)c1	758043677	JGWDUDORLUKEHY-SMDDNHRTSA-N	438.472	1.173	50	20	IDGD	
CCOC(=O)c1ccc(C(=O)N2CCN(S(=O)(=O)CBr)CC2)nc1C	758513308	TUIUREWNMUKJHS-UHFFFAOYSA-N	434.312	1.007	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NC2CCN(c3cccnn3)CC2)cc1Br	759018885	QTVLQAYUOMDLJT-UHFFFAOYSA-N	449.309	1.861	50	20	IDGD	
Cc1cc(S(=O)(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc(C(=O)O)c1Cl	759089413	AVTUSMXYPMIPBZ-AWEZNQCLSA-N	426.834	1.496	50	20	IDGD	
C[C@H](CO)CCCNC(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	759635770	XBHULDHZTQHAHG-INIZCTEOSA-N	437.500	1.797	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)c2cc(N3CCCC3=O)ccc2Cl)c2ccccc2c1=O	760227247	MMBFIYZZOWNXGT-UHFFFAOYSA-N	439.859	1.789	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)N[C@H](C)c1cccc(S(N)(=O)=O)c1	761648920	OYOOFDMMORUGMH-GFCCVEGCSA-N	438.531	1.526	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)N[C@@H]1CC[C@@H]2SCCS[C@@H]21	762526389	DVQMTPUMXANXAR-MBNYWOFBSA-N	443.620	1.612	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)C(=O)Nc1cccn(Cc2ccccc2)c1=O	763455365	QRTZFCQUPAEFCK-UHFFFAOYSA-N	435.396	1.205	50	20	IDGD	
COc1cc2nc(C)sc2cc1NC(=O)C(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	763471849	NKLHABUWUKNLRI-UHFFFAOYSA-N	429.414	1.921	50	20	IDGD	
O=C(NNC(=O)c1cc2ccccc2cc1O)C(=O)Nc1cccc(N2CCCNC2=O)c1	763526489	GYPKZEALTFWSRB-UHFFFAOYSA-N	447.451	1.865	50	20	IDGD	
COc1cc(OC)cc(OCCNC(=O)NNC(=O)c2cc(Br)c[nH]2)c1	763538029	LLEQMPRFGYTDTL-UHFFFAOYSA-N	427.255	1.817	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccccc2C(=O)NC(C)(C)C)cc1OC	763551610	YWJVIIITJIHOBL-UHFFFAOYSA-N	442.472	1.632	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cnn(-c3ncccc3C#N)c2)c2ccccc2n1	763616645	XAVHCZVNLKKJRD-UHFFFAOYSA-N	440.423	1.395	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(-c3nnc(N(C)C)o3)cc2)c1	763630828	OJOMMDCUBDPKEZ-UHFFFAOYSA-N	438.444	1.276	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(-n2cccn2)c(F)c1	763682973	XYESKDWENQAQGT-UHFFFAOYSA-N	441.419	1.575	50	20	IDGD	
CCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(OC)cc(OC)c2)c(C)c1	763772177	ORODGISNXZYZAS-UHFFFAOYSA-N	428.445	1.162	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)C(=O)Nc2cccc3ccncc23)c2ccccc2c1=O	763789812	CJBSNHCOSNBCFJ-UHFFFAOYSA-N	444.451	1.925	50	20	IDGD	
Cc1cc(Br)ncc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccccc1F	763855906	CDWVEUROSSMLOW-SNVBAGLBSA-N	439.241	1.845	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccccc1Cn1cncn1	763864857	LHNZFKDCVRHGMI-CYBMUJFWSA-N	426.408	1.019	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccc(OCC(F)(F)F)nc1	763865501	KRKLPKBGZVOGLU-SNVBAGLBSA-N	444.341	1.715	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccccc2C[S@@](C)=O)cc1	763867178	SLCXEWDRXYZINQ-JKGBWWFKSA-N	447.513	1.517	50	20	IDGD	
COC(=O)Nc1cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)ccc1F	763872038	JQEBHUGTHMTLKX-SNVBAGLBSA-N	436.371	1.697	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(-n3ccnn3)cc2)cc1	763878328	OXIAEXCFCUIPRB-AWEZNQCLSA-N	436.428	1.023	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2nc(C(C)(C)C)ns2)cc1	763879042	VTWYKTHSWVBLDR-NSHDSACASA-N	433.490	1.592	50	20	IDGD	
COc1ccc(Cn2nccc2NC(=O)C(=O)NNC(=O)Cc2ccsc2)c(OC)c1	764025933	RSHBMXICKBWZCY-UHFFFAOYSA-N	443.485	1.339	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc(OC)c(N2CCCCC2=O)c1	764049386	YSVFMKXWSGFEBX-UHFFFAOYSA-N	440.456	1.620	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2cc(C)[nH]n2)ccc1NC(=O)OC(C)(C)C	764109215	QVSCGSMTSZXGRD-UHFFFAOYSA-N	432.437	1.473	50	20	IDGD	
CC(C)(C)CC(=O)NNC(=O)C(=O)Nc1ccc(F)c(S(=O)(=O)NC(C)(C)C)c1	764198669	JWARADIOKCTHFK-UHFFFAOYSA-N	430.502	1.425	50	20	IDGD	
CN(C)CC(=O)NNC(=O)C(=O)Nc1ccc(Oc2ccc(F)cc2)c2ccncc12	764211848	KZJWNDCSCVMAFT-UHFFFAOYSA-N	425.420	1.814	50	20	IDGD	
CCCN(C(=O)c1ccccc1NC(=O)C(=O)NNC(=O)Cc1ccccn1)C(C)C	764263472	GIHCQCCMAKXFIJ-UHFFFAOYSA-N	425.489	1.671	50	20	IDGD	
Cc1nn(-c2ccc(C#N)cc2)c(NC(=O)C(=O)NNC(=O)CCc2ccccc2O)c1C	764277359	CKFYSOSQHCTDRW-UHFFFAOYSA-N	446.467	1.785	50	20	IDGD	
CC(C)(C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2O)cc1	764277672	MSVKOUXQNPBRNO-UHFFFAOYSA-N	428.445	1.085	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)ccc1O)C(=O)Nc1ccc(F)c(F)c1F	764279923	HXZUQZOEFCJCPO-UHFFFAOYSA-N	432.152	1.972	50	20	IDGD	
CN(C)C(=O)c1cc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)ccc1F	764369311	CLYHQIWJQXHBDV-UHFFFAOYSA-N	438.362	1.285	50	20	IDGD	
COc1ccc(OC(C)C)c(NC(=O)C(=O)NNC(=O)c2cncc(NC(C)=O)c2)c1	764433604	NYPQCPDIXQSXTR-UHFFFAOYSA-N	429.433	1.236	50	20	IDGD	
O=C(CCC(=O)N1CCN(c2ncccn2)CC1)NNC(=O)Cc1cccc2ccccc12	764640060	FNSACCPJIUIPPG-UHFFFAOYSA-N	446.511	1.449	50	20	IDGD	
Cc1ccc(Cl)c(S(=O)(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)c1	765639278	CBRKARUELXSIHY-UHFFFAOYSA-N	438.314	1.573	50	20	IDGD	
CN1CCO[C@H]([C@H](NC(=O)NNC(=O)CNC(=O)c2ccco2)c2ccc(Cl)cc2)C1	766321925	SVSLZIYAXAWZAF-FUHWJXTLSA-N	449.895	1.065	50	20	IDGD	
COc1cccc(OCCN2CCN(CC(=O)NNC(=O)Cc3ccccc3C)CC2)c1	767049014	SKAUJLZMHCEIKO-UHFFFAOYSA-N	440.544	1.390	50	20	IDGD	
CN(C)C(=O)c1cc(F)ccc1NC(=O)C(=O)NNC(=O)c1cc(-c2cccs2)[nH]n1	768240925	DFTJUTJSCDMTHQ-UHFFFAOYSA-N	444.448	1.379	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cnn(C(F)F)c2)cc1Br	768241372	HHOLMPWIQDQMAE-UHFFFAOYSA-N	432.181	1.449	50	20	IDGD	
COc1ccc(C(=O)NNc2ccc([N+](=O)[O-])cc2)cc1S(=O)(=O)N1CCOCC1	768245929	ASOAUHKGHHREFK-UHFFFAOYSA-N	436.446	1.381	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)c2nccc3c(S(N)(=O)=O)cccc23)c1	768459590	DJQKRFZVQVRXSK-UHFFFAOYSA-N	428.470	1.339	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)[C@@H](c1ccccc1F)N1CCOCC1	768634006	ADKUJJQOESFRGQ-LJQANCHMSA-N	437.493	1.754	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)c1ccc(S(=O)(=O)N(C)OC)cc1	768635999	NOGWZXAWYCSBJL-UHFFFAOYSA-N	443.503	1.038	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)c2cc(Br)ncc2[N+](=O)[O-])c1	769838073	DXWBTDTYWNWUKO-UHFFFAOYSA-N	437.206	1.679	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2ccc3c(c2)OCCO3)sc2nc3n(c(=O)c12)CCC3	770391827	YQLUHOCHCZFLRY-UHFFFAOYSA-N	426.454	1.559	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)N[C@H]1C[C@H](C)N(c2cnn(C)c2)C1=O	770654746	CWFNELLJFYFOCT-MKBNYLNASA-N	434.884	1.365	50	20	IDGD	
C[C@H](NS(=O)(=O)c1cccc(C(F)(F)F)c1)C(=O)NNC(=O)CNc1ccccc1	770952147	KIGHPILGOMENCK-LBPRGKRZSA-N	444.435	1.632	50	20	IDGD	
CNC(=O)COc1ccc(C(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)cc1OC	772993287	ACKVETILCNYOPZ-LBPRGKRZSA-N	435.864	1.702	50	20	IDGD	
CCS(=O)(=O)c1ccccc1C(=O)NNC(=O)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	773418155	SHYKHNITQKAYHC-CQSZACIVSA-N	439.534	1.888	50	20	IDGD	
CCN1CCN(C(=O)Cc2ccc(NC(=O)C(=O)NNc3ccc(C#N)cc3)cc2)CC1	773700338	JEMCOZCCJXTGCY-UHFFFAOYSA-N	434.500	1.347	50	20	IDGD	
CN(C)C(=O)[C@H]1CC[C@H](CNC(=O)NNC(=O)COc2ccccc2-c2ccccc2)O1	775455897	XTZDQXMYWJOAAK-YLJYHZDGSA-N	440.500	1.699	50	20	IDGD	
CCOC(=O)[C@H](C)NC(=O)c1ccc(NC(=O)NNc2cccc(S(C)(=O)=O)c2)cc1	776473199	GSPFZBUZKAEFAZ-ZDUSSCGKSA-N	448.501	1.920	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)c2ccc(S(=O)(=O)N=c3cc[nH]cc3)cc2)c1	776541198	JSHBLOISPQQCAZ-UHFFFAOYSA-N	446.510	1.465	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)NCCN2CCN(c3ccc(F)cc3)CC2)c1	776616339	CQJORBQMHPKFDC-UHFFFAOYSA-N	435.525	1.678	50	20	IDGD	
COc1ccc(S(=O)(=O)CCC(=O)NNc2cccc(S(C)(=O)=O)c2)cc1OC	776720626	FYBOBNPFZKVOJD-UHFFFAOYSA-N	442.515	1.414	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)Cc2ccc(F)cc2Br)n1	777124686	OCTSVTZHIIAFID-UHFFFAOYSA-N	444.282	1.829	50	20	IDGD	
Cc1cc(Cl)ccc1OCC(=O)N1CCN(S(=O)(=O)CBr)CC1	777779605	PMTGCWSWDPXGKH-UHFFFAOYSA-N	425.732	1.854	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1cc([N+](=O)[O-])c2nsnc2c1	778263443	MFYPQTVXUFATMU-UHFFFAOYSA-N	428.434	1.067	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1OC(F)F)c1csc(N2CCOCC2)n1	778530802	AAIXFIRHRKCKMU-UHFFFAOYSA-N	443.388	1.564	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)[C@@H](O)[C@@H](O)c1nc2ccccc2[nH]1	779581987	JPGQOYDRJQIXKR-CVEARBPZSA-N	437.481	1.850	50	20	IDGD	
COc1cccc(NNC(=O)c2ccc(OC)c(S(=O)(=O)NCc3ccccn3)c2)n1	780770098	DFMGKJWPAKJKOR-UHFFFAOYSA-N	443.485	1.729	50	20	IDGD	
O=C(C[C@@H](O)c1ccc(OCc2ccccc2)cc1)NNC(=O)[C@@H]1CCS(=O)(=O)C1	780860068	JSSMYVOJRRXRGR-IEBWSBKVSA-N	432.498	1.271	50	20	IDGD	
CC(C)[C@H]1C[C@@H](CC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)CCO1	782017453	ZARVOHAJEYZWMI-FXAWDEMLSA-N	438.594	1.907	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)C(=O)Nc1cccc(Cl)c1Cl	782896343	FYKANBQWUCZZQF-UHFFFAOYSA-N	444.300	1.686	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)C(=O)Nc1ccc2c(c1)OC1(CCCCC1)O2	784001781	DGSXMLRGIRGBKA-UHFFFAOYSA-N	442.428	1.227	50	20	IDGD	
Cc1ccc(-c2ncco2)cc1NC(=O)C(=O)NNC(=O)CNC(=O)c1cccs1	784003996	SSLXAHRZNHJEJK-UHFFFAOYSA-N	427.442	1.227	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1ccccc1OC(F)(F)F	784004448	GICKDMNZLRMEPQ-UHFFFAOYSA-N	430.364	1.163	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CCOCC1	784290378	NKCSFKQPLJTPPA-SJORKVTESA-N	431.489	1.053	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)N[C@@H]1CCCN(Cc2ccccn2)C1=O	784317689	JZTICIIJNDWXDI-LJQANCHMSA-N	433.472	1.403	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)cc1[N+](=O)[O-]	784832909	GMVUWCXXUNGXSI-UHFFFAOYSA-N	444.372	1.682	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)C(=O)Nc2ccc(CCN3CCOCC3)cc2)c1	784844122	GPBMKJIDUMRRTM-UHFFFAOYSA-N	446.529	1.047	50	20	IDGD	
O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])NNC(=O)c1ccc(-n2cnnn2)cc1	785032386	MCBNYASBEQXIPR-UHFFFAOYSA-N	433.837	1.777	50	20	IDGD	
CSCCNC(=S)NNC(=O)CCOc1cccc(I)c1	785229999	SUIAGTOXKGAIBA-UHFFFAOYSA-N	439.344	1.918	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNc2cc(F)cc(OC)c2)cc(S(C)(=O)=O)c1	785247015	RHSBTXMSNBWKHQ-UHFFFAOYSA-N	439.421	1.106	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)Nc1ccc(Cl)cc1-n1cccn1	788339451	ZCBWJHUUQIZGLT-UHFFFAOYSA-N	444.791	1.539	50	20	IDGD	
CCN(C)C(=O)[C@@H](C)NC(=O)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1	788896900	RSAAVWUGPYKQAE-UTKZUKDTSA-N	437.544	1.811	50	20	IDGD	
Cc1cccc(CS(=O)(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)c1	788914762	FOJHHWUHGKHQTM-UHFFFAOYSA-N	426.539	1.934	50	20	IDGD	
CC(C)n1nc(-c2ccco2)cc1NC(=O)C(=O)NNC(=O)Cc1cn2ccccc2n1	789767577	BNVHNDNUBWCILI-UHFFFAOYSA-N	435.444	1.700	50	20	IDGD	
O=C(Cc1csc2ccc(Br)cc12)NNC(=O)[C@H]1CCS(=O)(=O)C1	791477986	RCDFZTCMCDUWHS-VIFPVBQESA-N	431.333	1.788	50	20	IDGD	
Cc1cc(=O)c(C(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)nn1-c1ccccc1	792556005	YRMYAWMFSHCTTC-UHFFFAOYSA-N	440.843	1.812	50	20	IDGD	
O=C(NNC(=O)N1C[C@@H]2CN(Cc3ccccc3)C[C@@H]2C1)C1CCN(c2ncccn2)CC1	792908082	LSKHCMRUNMNIPZ-OYRHEFFESA-N	449.559	1.498	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)[C@@H]2CCC[C@@H](C(=O)NNC(=O)c3cccc(C)n3)C2)n1	794081018	YMSWTAWYIRAYEY-HZPDHXFCSA-N	438.488	1.122	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)[C@H](C)CNC(=O)OC(C)(C)C)c2ccccc2c1=O	794774949	KHGGCBSVPPOYGL-CYBMUJFWSA-N	431.493	1.728	50	20	IDGD	
CN(C)C(=O)NNC(=O)[C@@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(C)(C)O	795822220	GIGPSFPRYCCASO-LJQANCHMSA-N	440.500	1.967	50	20	IDGD	
O=C(NNC(=O)[C@H]1COCCO1)C(=O)Nc1ccc(-c2csc(C(F)(F)F)n2)cc1	797011492	JXQCPYAXRDIJHW-GFCCVEGCSA-N	444.391	1.330	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)c1	797433632	HTUFTAFFKGZOFY-GOSISDBHSA-N	445.497	1.652	50	20	IDGD	
COc1coc(C(=O)NNC(=O)c2nc(-c3ccccc3)n(-c3ccccc3)n2)cc1=O	798829067	DENHWAXDJVQSTI-UHFFFAOYSA-N	431.408	1.971	50	20	IDGD	
O=C(Cc1ccccn1)NNC(=O)C(=O)Nc1cc(F)c(Br)cc1Cl	799258901	KMRIDWSISROYGI-UHFFFAOYSA-N	429.633	1.965	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)c1ccc(NCC2CC2)nc1	800687829	GWJIIEZVWXFUDD-UHFFFAOYSA-N	443.529	1.763	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)N[C@H]1CCN(C(=O)Nc2ccccc2)C1	801005418	CHJLNIYVHVUANK-AWEZNQCLSA-N	430.490	1.115	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccn3)c2C(F)(F)F)cc1	801108460	AXNHGWTZHVLXQL-UHFFFAOYSA-N	432.362	1.994	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)N=c1cc[nH]cc1)N1C(=O)c2ccc(Br)cc2C1=O	802027530	KPAYGJBBTAKMSY-VIFPVBQESA-N	432.234	1.103	50	20	IDGD	
CC(C)(C)OC(=O)N1CCOC[C@@H]1CC(=O)NNC(=O)CSc1ccccc1O	802941495	BYZPCEFGDWETRQ-ZDUSSCGKSA-N	425.507	1.658	50	20	IDGD	
CCc1nnc(NC(=O)[C@@H](C)[C@@H](C)NC(=O)NNC(=O)COc2ccccc2F)s1	804867413	AOFIGNQKBSJDFJ-WDEREUQCSA-N	438.485	1.612	50	20	IDGD	
CCN=c1nc(NCC)n2c(SCC(=O)NNc3nccnc3C3CCC3)n[nH]c2n1	805461708	LALGXASMMZADQI-UHFFFAOYSA-N	443.541	1.098	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)Nc1cc(C2CC2)nn1[C@@H]1CCS(=O)(=O)C1	806328120	CKAHGYJYSYCZQC-CYBMUJFWSA-N	443.493	1.244	50	20	IDGD	
CNS(=O)(=O)c1cc(NC(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)ccc1F	806544590	JWUWLOAQYBAYKT-JTQLQIEISA-N	428.417	1.493	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc3c2CNC3=O)cc1OC	806975928	VGBJHIBCEZIURH-UHFFFAOYSA-N	426.429	1.127	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)NC[C@@H](c1cccs1)N1CCOCC1	806993732	HOTPVIRTRJJOTB-HNNXBMFYSA-N	428.518	1.722	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)N[C@@H]1CCCN(C(=O)CCC(F)(F)F)C1	807575550	KAGWQPPKACHIQG-CYBMUJFWSA-N	434.390	1.868	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cccc(N(C)C)c2)nn1-c1ccc(F)cc1F	808934496	IBYRJMXXTLTAEP-UHFFFAOYSA-N	442.426	1.925	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)c2c(Br)nnn2C)cc1OC	809979657	AHQXNTNWRZLSEC-UHFFFAOYSA-N	426.271	1.840	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)C(=O)Nc1c2c(cc3c1CCC3)CCC2	810386301	UICUZMPZBLYIMD-UHFFFAOYSA-N	438.440	1.737	50	20	IDGD	
COc1ccc2nc(NNC(=O)CNS(=O)(=O)c3ccc(C#N)cc3)c(C)cc2c1	810951029	AJAALYOSJTXATE-UHFFFAOYSA-N	425.470	1.845	50	20	IDGD	
O=C(COc1ccccc1-c1ccccc1)NNC(=O)c1ccc2c(c1)NC(=O)CNC2=O	814209587	YZICTPSLWLJCAZ-UHFFFAOYSA-N	444.447	1.876	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)C(C)(C)c2ccccc2[N+](=O)[O-])c1	814210973	MRFBOYDROQBYKM-UHFFFAOYSA-N	434.474	1.584	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NN=C(C)c1cc[nH]n1)N(S(C)(=O)=O)CC2	814759298	XYJXLSHRQDWVRV-MRXNPFEDSA-N	435.506	1.216	50	20	IDGD	
Cc1nc(O)c(Br)cc1C(=O)NNc1ccccc1S(=O)(=O)N(C)C	817055323	WRWVTEQGLUNCJH-UHFFFAOYSA-N	429.296	1.865	50	20	IDGD	
COc1cc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc(OC)c1C	848948598	RLSLRTQUZDZXOG-SFHVURJKSA-N	430.413	1.156	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)CN1C(=O)N[C@@](C)(c2ccc(C)cc2)C1=O	871635781	XVGPPPOEZWZIMN-QHCPKHFHSA-N	438.484	1.551	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1)NNC(=O)c1ccncc1	912768937	PBQKMJYNGOHQQW-UHFFFAOYSA-N	436.799	1.493	50	20	IDGD	
Cn1cc(S(=O)(=O)NNC(=O)c2ccccc2OCc2ccc(F)cc2)cc1C(N)=O	912979465	WZVPAGZEHJYCTE-UHFFFAOYSA-N	446.460	1.465	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)NCCCN2C(=O)NC3(CCCC3)C2=O)c1	915906200	REOILQCEUXWBAB-UHFFFAOYSA-N	431.493	1.267	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)N[C@H](C)c2cccc(S(N)(=O)=O)c2)c1C	916196645	BUZCJHNPNQGPAV-CABCVRRESA-N	434.518	1.810	50	20	IDGD	
Cn1ccnc1[C@@H](NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)c1ccc(F)cc1	916220863	FNADPVJNUYENRC-KRWDZBQOSA-N	449.446	1.540	50	20	IDGD	
CNS(=O)(=O)c1ccc(C(C)=NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1	916334036	CUUFBYYUJSXEJM-UHFFFAOYSA-N	444.922	1.050	50	20	IDGD	
O=C(NCc1ccc(S(=O)(=O)NC[C@H]2CCCO2)cc1)NNC(=O)c1ccccc1	916649726	QYGBHDMJAZKAAH-QGZVFWFLSA-N	432.502	1.288	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@H](C)c2c(F)cccc2F)cc1	918101012	GGHBPLXTADOJAB-CYBMUJFWSA-N	440.472	1.985	50	20	IDGD	
COc1ccc(C(=O)NCCNC(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)cc1	918221753	NGIGLAJZISVCGB-UHFFFAOYSA-N	427.461	1.011	50	20	IDGD	
O=C(NNC(=O)N1CCN(C(=O)N2CCCC2)CC1)c1ccc(Br)s1	918778437	DWBZKZNKJPCJTN-UHFFFAOYSA-N	430.328	1.698	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)CN1C(=O)c2ccc(Br)cc2C1=O	919820474	FSINYHPEFDGKHZ-UHFFFAOYSA-N	446.257	1.444	50	20	IDGD	
COc1cc(C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)ccc1OCc1ccccc1	919883911	FBXDYIDZVALZQK-INIZCTEOSA-N	433.486	1.405	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)c2c([N+](=O)[O-])c(C)nn2C)c2ccccc2c1=O	919972317	MAWUFKQDPZWWRP-UHFFFAOYSA-N	441.448	1.612	50	20	IDGD	
CCCc1noc2nc(-c3ccco3)cc(C(=O)NNC(=O)N[C@H]3CCS(=O)(=O)C3)c12	920291606	BNWSBEYNCGKWOM-NSHDSACASA-N	447.473	1.566	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)N[C@H]2CC(=O)N(c3ccccc3)C2)nc1	921125236	GGNCLJRYEGWTHN-HNNXBMFYSA-N	446.533	1.544	50	20	IDGD	
COc1cc(C(=O)NNC(=O)N[C@H]2COc3c(F)cc(F)cc3C2)cc(OC)c1OC	1346317467	AISJZGGTXBUXPD-CYBMUJFWSA-N	437.399	1.938	50	20	IDGD	
Cc1nnsc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCBr)C2	1778236943	CKTHBWRUCKVITH-MLGOLLRUSA-N	431.356	1.759	50	20	IDGD	
CCC1(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2ccc(B(O)O)cc2)C3)CCC1	1778889776	NMQGWGXRVIZBKN-AUSIDOKSSA-N	428.338	1.074	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)nc2nccn12	1779298222	BTFWJIBLFHBXEY-HXUWFJFHSA-N	431.569	1.333	50	20	IDGD	
CCc1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](F)Br)C3)nn1C	1779909980	FYBHOYZRHSFTDX-IIDMSEBBSA-N	445.333	1.801	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnc4snnc4c3)C2)C1	1780071616	IFTKFPPOIJPJLR-MGPLVRAMSA-N	440.323	1.313	50	20	IDGD	
Cc1c(Br)c(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](F)Cl)CCO3)nn1C	1780367408	WZBRHECQZKEDOI-IUODEOHRSA-N	437.697	1.469	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)c3ccccc3Cl)C2)C1	1780503750	ZJWQHXJQYAJBHG-NRFANRHFSA-N	443.891	1.096	50	20	IDGD	
O=C(c1cccn2nccc12)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781332005	CQNXQEBCULFUNN-WMLDXEAASA-N	425.258	1.468	50	20	IDGD	
COc1ccc2[nH]cc(/C=C/C(=O)N3CC[C@@]4(C3)CN(C(=O)[C@@H](O)CCl)CCO4)c2c1	1781389122	XECIZNKXKZRBTJ-FESIQLCVSA-N	447.919	1.619	50	20	IDGD	
CCC(=O)N[C@@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)Br)C1	1781997399	UUCZSFKYTVFDCC-UYAYXHRUSA-N	432.359	1.198	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1ccc(O)cn1)C2	1782001609	HOMFODZFSTXYNJ-URKNILKWSA-N	440.338	1.627	50	20	IDGD	
CSCC[C@@H](O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)Br)C1	1782001718	JVBQPQHSHILZQU-ZOMKSWQUSA-N	437.400	1.398	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(C(F)F)no1)C2	1782170477	MWUIMOLTZADHLR-UCMVZMLTSA-N	435.855	1.994	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc(CO)c(F)c2)C1	1783077631	ABHSVBKVCTWFAM-YRISNDGFSA-N	442.915	1.699	50	20	IDGD	
COc1cc(C#N)cc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](C)Br)C3)C2)c1	1783538381	UOUPUWQWLCRPQI-BFUOFWGJSA-N	436.306	1.794	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)CCCn3ccnc3)C2)C1	1784397676	VLNNNKSXBBFPIS-YJBOKZPZSA-N	427.343	1.524	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3CCCCC3(F)F)[C@H]2C1	1784662970	XDMLVNUUKYYKKM-NXOAAHMSSA-N	444.523	1.165	50	20	IDGD	
COc1ccc(CC(=O)N2CC[C@@]3(CN(C(=O)CCBr)CCO3)C2)cc1F	1784700416	FMIKZHUORXDAAG-IBGZPJMESA-N	443.313	1.992	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)C3(C(C)C)CCC3)C2)C1	1784857633	CRKFNNKOEOFWJI-YALBQKEFSA-N	443.548	1.777	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C=C/c3ccccc3)[C@H]2C1	1786568983	XMFVURRFSAUDCD-VGZMHKMPSA-N	428.533	1.053	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)c1nccc2nc[nH]c12	1787354815	GXXXAEMIJQRLLT-OUCVZQCGSA-N	440.273	1.242	50	20	IDGD	
COc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)CBr)C[C@@H]32)nc1	1787757563	MCQWVBSTHPLQOH-RMRKRWHISA-N	440.338	1.715	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC1(c2ccc(NC(=O)c3cc(=O)n4[nH]cnc4n3)cc2)CCC1	1788139537	PZLRPMWCVCEJKU-CQSZACIVSA-N	444.879	1.419	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4ncnn4c3)[C@H]2C1	1788451873	CDVQCYCICJKRSL-ULQDDVLXSA-N	431.569	1.174	50	20	IDGD	
C[C@@H](Nc1cnccn1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CO[Si](C)(C)C)C[C@@H]21	1788628071	SINLBKDQTZRVNZ-QZWWFDLISA-N	435.601	1.108	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1ccc(C2(NC(=O)c3ncnn3C)CCC2)cc1	1788643828	DUKFYSNZWCUCBT-CCVNUDIWSA-N	448.487	1.697	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3CC[C@H]4CCC(=O)N4C3)[C@H]2C1	1789766913	GABOOQWHLHSKMF-UGCZWRCOSA-N	439.984	1.775	50	20	IDGD	
C[C@@H](O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](Br)Cc3ccccc3)C[C@@H]21	1791053857	UWSTVIHTIHMTRD-QSGXVVIFSA-N	439.350	1.353	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nccc4nc[nH]c34)C[C@@H]21	1791057708	OIYQEGAMAYXGMR-UHXUPSOCSA-N	436.310	1.335	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc(OC)c(O)c3)C[C@@H]21	1791249394	KJCMGUODFVYLOI-GGXPGOJBSA-N	440.924	1.177	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)COc3cc(Cl)ccn3)C[C@@H]21	1791255699	YPXHUILCACBTDA-HNKHHVNMSA-N	446.331	1.347	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1ccc(C2(NC(=O)c3cc(O)nc(O)c3)CCC2)cc1	1791599358	INJQOBLTPWJMJS-UHFFFAOYSA-N	441.488	1.614	50	20	IDGD	
COc1cc(Cl)cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](O)CCl)C[C@@H]32)c1	1792026429	DCYCXULDHATHIM-UQCMEYCASA-N	431.316	1.542	50	20	IDGD	
CCN1CCC(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCBr)C[C@@H]32)CC1	1792293990	QXCVNZFOXJDYHR-ULQDDVLXSA-N	430.387	1.483	50	20	IDGD	
CC(C)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COc1cc(Cl)ccn1)C2	1792783228	OSAGKPWCFYPQBN-FVCICTRLSA-N	430.332	1.968	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3cc[nH]c3cc1Cl)C2)[C@H](O)CCl	1792980915	AUDCDOCNXUYUCA-CZAMWMTLSA-N	426.300	1.624	50	20	IDGD	
COC(=O)[C@H]1CC[C@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Br)C3)CC1	1793609085	SJMSJDKMWIBTDO-SOAFEQHCSA-N	449.317	1.246	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCc1cnc[nH]1	1794283265	ARBQJZCPYDHUQJ-FWKYCFCSSA-N	425.493	1.115	50	20	IDGD	
COc1ncc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Br)C3)cc1F	1794364711	OICJCAQHTLEGJU-LFSVMHDDSA-N	434.237	1.123	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(-n3cnnc3)cc1)C2	1795113009	VCTJSEVWZQPMGR-JLVBRIDZSA-N	448.321	1.256	50	20	IDGD	
Cn1c(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)cc2ccccc21	1796189727	SCDASDIGEBJYKZ-WKCHPHFGSA-N	445.328	1.353	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccnc(OCC(C)C)c1	1796462371	VOGSFQMGDSVEBC-ZMMAXQRCSA-N	439.940	1.573	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cn2ccsc2n1	1797485771	IRJFDKOEOVJDDE-HNCHTBHHSA-N	427.324	1.382	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)CBr)C3)o1	1797743646	KCUDAIXEBNIILB-YGSHXTJESA-N	442.310	1.472	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cccnc1Cl)C2	1797952621	BGWVSOLROXLEHN-JLVBRIDZSA-N	425.989	1.719	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CC1CN(C(=O)OC(C)(C)C)C1)C2	1799271545	QYMNBPOLNAPYAJ-KYHPRHEASA-N	443.972	1.850	50	20	IDGD	
CN(C)c1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@](C)(Cl)CCl)nc1	1799277445	RTXVTPNJIFTJIR-UESRRSCYSA-N	429.348	1.587	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Br	1799352460	XOUDKUKQUXWKLZ-ZLCQRPCESA-N	447.301	1.022	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1Cc2ccccc2N1	1800315056	OUIVLTQLDGFVFT-UIVXMWCNSA-N	436.350	1.644	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccn(C(C)C)n1)C2	1800642653	UTXZMAVDJJUEBW-HLPPOEQASA-N	427.343	1.841	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCc1cccc(O)c1	1801121572	LUEZCPOGAHSUGL-JNNRSPCRSA-N	439.350	1.945	50	20	IDGD	
CC[C@@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)COc1ccc(O)nn1)C2	1801805529	AAKVGDNZEDOGIB-YVECIDJPSA-N	427.299	1.373	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C(Cl)Cl)c1nc2c(=O)[nH]c3ccccc3n2n1	1802342328	YOVMOLGGNMHBEJ-JGPRNRPPSA-N	449.298	1.626	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]2c2cccnc2)nn1C(F)F	1803140351	DJTSMPTWTLNOMJ-FVQBIDKESA-N	441.866	1.901	50	20	IDGD	
O=C(CCC1CCC1)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1803370463	QNDSHZXJDDKZSE-REWPJTCUSA-N	435.333	1.661	50	20	IDGD	
COc1ncc(C(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@H]2c2cccnc2)cc1F	1804958666	WUTXNTFRCQOGQT-XKQJLSEDSA-N	436.871	1.544	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)c1cc(O)nc(Cl)c1	1805031707	GQTVZABBCKYAKP-RVSPLBMKSA-N	439.299	1.755	50	20	IDGD	
NC[C@H](C(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)c1ccccc1	1807248410	QBUZOQKQZSGPKI-HAGHYFMRSA-N	430.936	1.430	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1808259639	LPHMXHRGXNRRCW-NZSAHSFTSA-N	429.713	1.098	50	20	IDGD	
Cc1cscc1C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1808620995	QXDWYTONEJSKTH-NQIIRXRSSA-N	449.341	1.765	50	20	IDGD	
O=C1C[C@H](C(=O)N2CC[C@H](CNC(=O)[C@H](F)Br)[C@@H]2c2cccnc2)CCN1	1808678635	MDSUKHKSTQZCSS-OYNZBZHQSA-N	441.301	1.304	50	20	IDGD	
O=C1Cc2cc(C(=O)NC[C@@H]3CCN(C(=O)[C@H](O)CCl)[C@@H]3c3cccnc3)ccc2N1	1809683445	IKJVGWWKDLJUAA-QKYXUNIQSA-N	442.903	1.496	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)c3cccc4[nH]ncc34)CC2)C1	1809966544	BIKIOBOLKSWGGO-UHFFFAOYSA-N	446.316	1.401	50	20	IDGD	
Cc1cccc(CCC(=O)N2CCC3(CCCN(C(=O)c4ccc(B(O)O)cc4)C3)CC2)n1	1809968766	DTWIVVPGLBVYGU-UHFFFAOYSA-N	449.360	1.547	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)c1ccc2c(c1)CNC2=O	1810035550	NAJUFPVEEIOZLU-IPELMVKDSA-N	442.903	1.244	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)c[nH]1	1813070864	NFLXACROGIOBFX-LAUBAEHRSA-N	426.521	1.411	50	20	IDGD	
Cn1cc(CC(=O)NC[C@H]2CCN(C(=O)CCBr)[C@H]2c2cccnc2)cn1	1813455571	GBPPWMIZBPKWAJ-APWZRJJASA-N	434.338	1.849	50	20	IDGD	
C/C(=C/C(=O)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@@H]1c1cccnc1)C(=O)O	1814097023	ZLHNVHSECUBOCV-LSLMRWIDSA-N	428.258	1.809	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)CCN3CCOCC3)sc2C1	1814648131	BNANDBVUDOHRPY-CHWSQXEVSA-N	430.958	1.031	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)C#Cc2ccccc2)[nH]n1)c1cccc(B(O)O)c1	1817473164	JJGRPHWALZYMNN-NRFANRHFSA-N	442.284	1.447	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cncs2)[nH]n1)c1cccc(B(O)O)c1	1817473376	QFCACCKQJMKKCG-HNNXBMFYSA-N	425.279	1.166	50	20	IDGD	
Cc1cccnc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819401842	VDDVVPDCKSCTBZ-QGZVFWFLSA-N	448.487	1.731	50	20	IDGD	
CN(CC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@](C)(Cl)CCl)n[nH]1)C(=O)C(=O)O	1820869494	WFLNWLYYTXUJCW-DIFFPNOSSA-N	448.307	1.181	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)Cc2ccc3ncnn3c2)[nH]n1	1822374666	ZFUUAWVXQNZUPH-GOEBONIOSA-N	445.911	1.941	50	20	IDGD	
Cc1cc(C)n(CC(=O)N2CCCC[C@@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)n1	1822411083	ZXLHCBUGXRQQLU-QGZVFWFLSA-N	444.540	1.288	50	20	IDGD	
CSCC(C)(C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1	1824559819	AAQBLMMFMRMUGG-HXUWFJFHSA-N	446.422	1.989	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)c2cncc(F)c2)CC1	1826059789	PQMVOOKTCUXHIN-LJQANCHMSA-N	433.528	1.827	50	20	IDGD	
O=C(c1n[nH]c2c1CS(=O)(=O)C2)N1CCC([C@H]2CCCCN2C(=O)[C@@H](F)Cl)CC1	1827607579	IEDRUUBMXCKZSF-GDBMZVCRSA-N	446.932	1.606	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H](O)N2CCOCC2)CC1	1829102638	BQYYGEDFGYKACT-WIYYLYMNSA-N	441.645	1.108	50	20	IDGD	
COC[C@H](NC(C)=O)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CO[Si](C)(C)C)CC1	1829102854	OZNQNNKMVXYFOT-OALUTQOASA-N	441.645	1.609	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)Cc2ccncc2)CC1	1830174256	PEXQZFQEZMAHGP-QFIPXVFZSA-N	435.333	1.237	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3F)C2)C1	1830538833	RHIKZLXLPDOKQJ-SCLBCKFNSA-N	444.301	1.322	50	20	IDGD	
C=C[C@H](O)C(C)(C)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H](C)CBr)CCO2)C1	1830540820	TYBFJXSGRZXDJR-YZVOILCLSA-N	447.370	1.047	50	20	IDGD	
O=C(CCCc1ccccc1F)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1	1830692395	XWBIMFYOHIELJX-NQIIRXRSSA-N	442.915	1.205	50	20	IDGD	
C[C@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1)N1C[C@H]2C[C@@H]2C1	1831873746	VUHWISZSWJRMIL-WLRLJWMZSA-N	447.624	1.319	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cc4ncsc4[nH]3)CC2)CC1)[C@@H](O)CCl	1833311740	BVKQHDCSNYJIQG-INIZCTEOSA-N	439.969	1.409	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)[C@H]1CNc2ccccc21	1834726076	DEYAYYCMNNYEPY-AZUAARDMSA-N	434.968	1.367	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)C(C)C)CC2)CC1	1835118168	CFIWIEDRHARDDV-PCLIKHOPSA-N	430.553	1.348	50	20	IDGD	
Cn1ncc2c(C(=O)NC3CCN(C4CCN(C(=O)[C@@H](O)CCl)CC4)CC3)cccc21	1835417696	ITYGUMXGUGLKNW-FQEVSTJZSA-N	447.967	1.358	50	20	IDGD	
C[C@H](Cn1cccn1)C(=O)N1CCC(N2CCC(NC(=O)CO[Si](C)(C)C)CC2)CC1	1835835388	XYTYGTVATPWMKG-GOSISDBHSA-N	449.672	1.942	50	20	IDGD	
CC(=O)N(C)[C@@H](C)C(=O)N1CCC(N2CCC(NC(=O)[C@@](C)(Cl)CCl)CC2)CC1	1836398104	FCLOGMGLGPXMSS-XOBRGWDASA-N	449.423	1.661	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC(OC2CCN(C(=O)C3CCCC3)CC2)CC1	1837605202	HHEQXIFPJPBHQM-UHFFFAOYSA-N	428.338	1.169	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(Cl)nn3)CCO2)C1	1837833284	XNMOLPBABYXBJF-GOSISDBHSA-N	431.320	1.465	50	20	IDGD	
C/C=C/C=C\C(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1	1838394576	MDFRJTSFUCTDDG-IAROGAJJSA-N	441.532	1.430	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(OC)c(OC)c3)CCO2)C1	1838932169	SLUOVCSDJXQQTF-IIBYNOLFSA-N	440.924	1.791	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(F)c3F)CCO2)C1	1839000099	STNWISUVUODVFM-IFXJQAMLSA-N	432.851	1.289	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3ccc(C#N)cc3)C2)C1	1839141770	SCGNGPALXISKGJ-DENIHFKCSA-N	433.936	1.965	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4cccnc4n3)C2)C1	1839145557	LZKLLNPZFSNOPP-KKSFZXQISA-N	432.908	1.717	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(-n4cccn4)nc3)C2)C1	1839146862	YQRKAOYEZKKTSY-UTKZUKDTSA-N	447.923	1.355	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccncc3)C2)C1	1839154540	QQFAKKJTQSDYQJ-RBUKOAKNSA-N	430.332	1.317	50	20	IDGD	
O=C(CCc1ccccn1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839198045	RCMHXNDJBCXUQY-FUHWJXTLSA-N	444.301	1.161	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3n[nH]c4cccc(F)c34)CCO2)C1	1839599641	VXDBZLPBAHDSHJ-RNODOKPDSA-N	438.887	1.789	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1	1840033648	MJGFLWDNUGNLSI-CJNGLKHVSA-N	437.407	1.078	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3cccs3)C2)C1	1840151218	XUFMSGIWZYWAST-VQIMIIECSA-N	430.954	1.391	50	20	IDGD	
CC(C)(C)n1ncc(C(=O)N2CCCC23CN(C(=O)c2ccc(B(O)O)cc2)C3)c1Cl	1842258219	ZAKUHZPYKYVNNO-UHFFFAOYSA-N	444.728	1.102	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)[C@@H]2CCCN2C(C)C)C1	1846723711	CUGLYRKTLZGDPD-MRSJDWDVSA-N	428.537	1.197	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H]1CCC[C@@H]1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl	1847568795	MNXFFBOUYNDFGK-QXKUPLGCSA-N	429.945	1.481	50	20	IDGD	
COC(=O)CSCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)/C(C#N)=C/c1ccc(F)cc1F	1847818777	LNYSHILBKITCPC-AYUCCAJWSA-N	449.479	1.980	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)C(=O)N(C[C@@H]1CCCO1)C2=O)c1ccc([N+](=O)[O-])cc1	9028899	BTZQHVPPISQIAG-HNNXBMFYSA-N	438.396	1.445	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)c2cc(Cl)c(OCC(N)=O)c(OC)c2)c1	14073285	NTJIHNKIZHSIPC-UHFFFAOYSA-N	437.836	1.305	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)C1CCN(S(C)(=O)=O)CC1	14326262	CKNZCRMMKXWEFP-LLVKDONJSA-N	448.339	1.035	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(Cl)cc2)cc1C	15886636	BRVGYQKMNNTNAD-UHFFFAOYSA-N	439.921	1.804	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)c2cccnc2O)c1	17396890	OARRUTVAGZCXTN-UHFFFAOYSA-N	442.453	1.671	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)c2cc(S(=O)(=O)NC3CC3)ccc2C)c1	28659694	CWUIRTMAZMZCLI-UHFFFAOYSA-N	431.514	1.893	50	20	IDGD	
Cc1nn(C)c(C)c1C(=O)C(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1	215857434	SGQFDPSNOJOZQS-OAQYLSRUSA-N	445.523	1.994	50	20	IDGD	
C=CCCC(=O)NNC(=O)C[C@H]1c2cc(OC)c(OC)cc2CCN1S(C)(=O)=O	726619983	RDYHWJZUVGGNAR-HNNXBMFYSA-N	425.507	1.066	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNS(=O)(=O)c1sc(NC(C)=O)nc1C	727350298	JFAOLCYVCDXOPJ-UHFFFAOYSA-N	428.492	1.197	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)c2cccc(CN3C(=O)CNC3=O)c2)cc1F	727499147	NQGAEVITEJAMCO-UHFFFAOYSA-N	431.449	1.518	50	20	IDGD	
CCc1noc(CCCC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)n1	728215899	LJSNVEQJWQQZHV-UHFFFAOYSA-N	436.538	1.034	50	20	IDGD	
CC(C)[C@@H](CNC(=O)NNC(=O)c1cc(F)ccc1Br)N1CCN(C)CC1	728742907	UJDAAGFGOQYVLT-MRXNPFEDSA-N	444.349	1.804	50	20	IDGD	
CCN1CCC[C@@H]1CN1C[C@H](C(=O)NNC(=O)c2cc3c(s2)CC[C@@H](C)C3)CC1=O	729625961	FYYOQIZMEZHOPW-DJIMGWMZSA-N	432.590	1.967	50	20	IDGD	
CCCOc1ccc(CNC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cn1	730908015	PHWNPNJBAQMNJF-UHFFFAOYSA-N	449.533	1.330	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(F)cc2)C1	731328387	FUQWNSSJENSPFY-OAHLLOKOSA-N	437.468	1.756	50	20	IDGD	
CCNC(=O)CCC(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccc(OC)cc2)c1	732049622	WNUSRBCNIYPIDQ-UHFFFAOYSA-N	448.501	1.173	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CCN2C[C@H](C)O[C@H](C)C2)cc1I	732261355	MMPBQMYWGYCOSB-BETUJISGSA-N	445.301	1.860	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N(C)[C@@H](C)CS(C)(=O)=O	732677044	RFABYPFZEPANFT-QWRGUYRKSA-N	436.328	1.322	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NNc2nc3ccccc3c(=O)n2C)s1	733260976	VBOGPAJDDYFKNM-HNNXBMFYSA-N	447.542	1.600	50	20	IDGD	
Cn1c(=O)nc(O)c2cc(C(=O)NNC(=O)NCc3cccc(C(F)(F)F)c3)cnc21	742453007	CGYDICZSMUWVNY-UHFFFAOYSA-N	436.350	1.197	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@@H]2SCCc3ccccc32)cc1	742471806	KKSPTASRXDBMEP-LJQANCHMSA-N	433.555	1.794	50	20	IDGD	
COc1cc(C(=O)NNC(=O)N[C@H]2CCN(c3ccc(C)cc3)C2=O)cc(OC)c1OC	743505348	AEEYWLSSUFTMGT-INIZCTEOSA-N	442.472	1.770	50	20	IDGD	
CC(C)NS(=O)(=O)c1cccc(CNC(=O)NNC(=O)Nc2ccc(N(C)C)cc2)c1	743525877	PXSQECICFWXNJN-UHFFFAOYSA-N	448.549	1.975	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@H](C)Oc2ccc(F)c(F)c2)cc1	743738026	QGSUEGGKESJGMN-ZDUSSCGKSA-N	441.456	1.509	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)CN2CCC(c3nc(-c4ccccn4)no3)CC2)cc1	744393497	MQFVAGRZLKGDMM-UHFFFAOYSA-N	431.456	1.644	50	20	IDGD	
O=C(Nc1ccccc1C(=O)NNC(=O)[C@@H]1COCCO1)c1ccc([N+](=O)[O-])cc1Cl	744649501	ULYWZJSXZBGSNL-INIZCTEOSA-N	448.819	1.677	50	20	IDGD	
O=C(CC(F)(F)F)NNC(=O)NCCc1ccc(S(=O)(=O)N2CCCCC2)s1	745890288	QSKGWJFUMNYDEF-UHFFFAOYSA-N	442.485	1.748	50	20	IDGD	
C[C@@H]1C[C@H](NC(=O)NNC(=O)Nc2ccc(OC(F)F)cc2)C(=O)N1c1cnn(C)c1	745916353	CHTCAEVIBINKEF-YGRLFVJLSA-N	437.407	1.551	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)N[C@@H]2C[C@H](C)N(c3cnn(C)c3)C2=O)cc1OC	745919725	WQYMHWQJLPDSDM-XJKSGUPXSA-N	444.492	1.356	50	20	IDGD	
Cc1nc(CNC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)sc1C	745923397	PEUSPAUNUKJLEA-UHFFFAOYSA-N	437.547	1.689	50	20	IDGD	
CCCCN1C(=O)CC[C@H](C(=O)NNC(=O)N2CCOCC2)[C@@H]1c1ccc(OC)cc1	745988314	XMWRSMOMEVOXEF-ICSRJNTNSA-N	432.521	1.848	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN(C(=O)NC2CCCC2)C1)C1CCN(c2ncccn2)CC1	746219684	UOTLBCXGDFXPMZ-KRWDZBQOSA-N	443.552	1.205	50	20	IDGD	
COc1ccc([C@@H]2[C@H](C(=O)NNC(=O)Cc3cn4ccccc4n3)CCC(=O)N2C)cc1	746549603	BMQBNCXOYDBZHU-XMSQKQJNSA-N	435.484	1.643	50	20	IDGD	
COc1ccc(C(=O)NNc2cccc([N+](=O)[O-])c2)cc1S(=O)(=O)N1CCOCC1	748006586	VZMFUGGDRCAPRE-UHFFFAOYSA-N	436.446	1.381	50	20	IDGD	
COc1ccc(-n2cc(O)c(C(=O)NNC(=O)c3cc(OC)c(OC)c(OC)c3)n2)cc1	748013761	OMGDCLKIOHFBCI-UHFFFAOYSA-N	442.428	1.687	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)CNC(=O)NCc2ccc([N+](=O)[O-])cc2)c1C	748211966	ARBHQELILNYESE-OAHLLOKOSA-N	443.460	1.626	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)NCc1ccc(N2CCc3ccccc3C2)nc1	748622930	XPAWTPMGCZIQEI-MRXNPFEDSA-N	427.505	1.526	50	20	IDGD	
Cc1c(NNC(=O)C2CCN(S(=O)(=O)c3cn(C)c(C)n3)CC2)cccc1[N+](=O)[O-]	748670052	BVCRGKIONSPTGQ-UHFFFAOYSA-N	436.494	1.489	50	20	IDGD	
COc1ccc(C2(C(=O)NNC(=O)CN(C)S(=O)(=O)c3ccc(C)cc3)CCC2)cc1	750715780	BVYQBAATXIOQMO-UHFFFAOYSA-N	445.541	1.893	50	20	IDGD	
COc1cc([N+](=O)[O-])ccc1OC(=O)CN(C)S(=O)(=O)c1ccc(NC(C)=O)cc1	751173702	GDGZWFMATTWTLY-UHFFFAOYSA-N	437.430	1.788	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)Cn1c(COc2ccccc2)nc2ccccc21	751204610	KLVSDZUHRQUBFJ-UHFFFAOYSA-N	447.451	1.786	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)c2ccccc2N2CCOCC2)c2ccccc2c1=O	751293201	GJWMAVDYZFSGHO-UHFFFAOYSA-N	435.484	1.889	50	20	IDGD	
Cc1cc(F)ccc1-n1cc(O)c(C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)n1	751296823	BKBRVGJGXMCFGS-UHFFFAOYSA-N	436.403	1.347	50	20	IDGD	
COc1ccc(CCN2C[C@H](C(=O)NNc3cc(Cl)nc(N)n3)CC2=O)cc1OC	753680848	BOPRTXZPCFBHEW-GFCCVEGCSA-N	434.884	1.264	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)c1cc(F)cc([N+](=O)[O-])c1Br	754995984	LBPMFQNRTSFAJN-UHFFFAOYSA-N	445.226	1.749	50	20	IDGD	
CCC(=O)NNC(=O)Nc1cc(S(=O)(=O)N2CCOCC2)ccc1N1CCCCC1	755392434	PPPWARCNGVCSQM-UHFFFAOYSA-N	439.538	1.261	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1ccc(Cc2nc3ccccc3s2)cc1	755446136	ADHOYXFXZIGVIH-GFCCVEGCSA-N	447.542	1.978	50	20	IDGD	
CS(=O)(=O)CCOc1cccc(NC(=O)NNC(=O)COc2ccc(Cl)cc2)c1	756297620	NCVYRSMTRSDWNJ-UHFFFAOYSA-N	441.893	1.995	50	20	IDGD	
CCOC(=O)Cn1cccc(NC(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)c1=O	757764252	PUKHTYHAISSHTG-HNNXBMFYSA-N	430.461	1.648	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)Nc1ccc2nc(N3CCOCC3)oc2c1	757777023	LKBGBVOYEYCPMI-GOSISDBHSA-N	439.428	1.657	50	20	IDGD	
CCOCCS(=O)(=O)NCC(=O)NNc1nnc(-c2ccccc2)n1-c1ccccc1	758225030	FPYJEAKKXZDNRH-UHFFFAOYSA-N	444.517	1.333	50	20	IDGD	
O=C(c1c[nH]nc1-c1ccccc1F)N1CCN(S(=O)(=O)CBr)CC1	758511606	BRQJNHQYSCXLOT-UHFFFAOYSA-N	431.287	1.656	50	20	IDGD	
O=C(c1cccc(Cl)c1[N+](=O)[O-])N1CCN(S(=O)(=O)CBr)CC1	758522434	HZWHOXVCQWURSW-UHFFFAOYSA-N	426.676	1.688	50	20	IDGD	
Cc1cc(F)ccc1-n1cc(C(=O)N2CCN(S(=O)(=O)CBr)CC2)nn1	758526958	DMXRBYAUQFCINX-UHFFFAOYSA-N	446.302	1.155	50	20	IDGD	
Cc1nc([N+](=O)[O-])cn1CCC(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758782270	NGCBCDKUHZOXSK-UHFFFAOYSA-N	439.473	1.126	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccccn2)c2cnn(Cc3cccs3)c2n1	758820554	IVVMDXLOHDEYAL-UHFFFAOYSA-N	435.469	1.644	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NC[C@H](C[C@H](C)O)c2ccccc2)nc1	759610509	MDTKCZWEKVVEFA-RDJZCZTQSA-N	435.550	1.949	50	20	IDGD	
Cc1c(S(=O)(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)oc2ccc(F)cc12	760341983	CPULPELBDRBWKQ-UHFFFAOYSA-N	426.447	1.907	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)c2ccc(I)c(O)c2)c1O	761056079	DSCDVMNKDRKICX-UHFFFAOYSA-N	428.182	1.786	50	20	IDGD	
C[C@@H](C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1)c1cccc([N+](=O)[O-])c1	763400563	XPYXYVZYIUDOGQ-SJKOYZFVSA-N	429.385	1.229	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNS(=O)(=O)c2cc(Cl)cc(C(=O)O)c2C)cc1C	763417587	VNAOJDSIWTUNJW-UHFFFAOYSA-N	439.877	1.912	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)c([N+](=O)[O-])c1	763439945	YYAYPQPVQOKBRO-UHFFFAOYSA-N	432.455	1.218	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)CCCC(=O)N3)cc1OC	763550841	RZEXPGWVGKEORF-UHFFFAOYSA-N	426.429	1.378	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccccc2Cn2cncn2)c2ccccc2n1	763615193	BQXCTWDVMMZSTF-UHFFFAOYSA-N	429.440	1.583	50	20	IDGD	
COC(=O)[C@H]1CN(C(=O)C(=O)NNC(=O)c2cc(C)nc3ccccc23)c2ccccc2O1	763616461	UQSKNVMDBMPJEP-LJQANCHMSA-N	448.435	1.271	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2cccc(C(=O)NC(C)(C)C)c2)c1	763646709	IKFSZCDMMFMQNE-UHFFFAOYSA-N	440.500	1.997	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(Cl)c(C(=O)NC)c1	763682627	SENMINBZOKIVLG-UHFFFAOYSA-N	448.863	1.263	50	20	IDGD	
CC(C)Oc1ccc(C#N)cc1NC(=O)C(=O)NNC(=O)CN1CCCc2ccccc21	763727252	AHRZEDOXRGDOBC-UHFFFAOYSA-N	435.484	1.884	50	20	IDGD	
CCCNC(=O)[C@H]1CN(C(=O)C(=O)NNC(=O)c2cccc(Cl)c2)c2ccccc2O1	763747529	ANNMLOLKQGIDOZ-QGZVFWFLSA-N	444.875	1.421	50	20	IDGD	
CS(=O)(=O)c1c(Cl)cccc1NC(=O)C(=O)NNC(=O)c1cc2c(s1)CCC2	763782484	DMFBKQDSMIWELB-UHFFFAOYSA-N	441.918	1.693	50	20	IDGD	
Cc1ccc(Cn2nccc2NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)o1	763849920	MOSUCQIBMOXEDD-ZDUSSCGKSA-N	429.408	1.525	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccc(OCCN(C)C)cc1	763856220	FNCJWINQKGCTJN-CQSZACIVSA-N	432.452	1.320	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cccc(CN(C)C)c2)cc1	763861888	SVAHPMVTQLBSEF-HNNXBMFYSA-N	428.489	1.700	50	20	IDGD	
CC(C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)cc1	763864709	GJTLUQSVRHMYGD-CYBMUJFWSA-N	430.436	1.517	50	20	IDGD	
Cc1ccc(C(N)=O)cc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1c(C)cc(Cl)cc1C	763884300	UWQSKUAZRZAMLK-CYBMUJFWSA-N	446.891	1.918	50	20	IDGD	
COC(=O)c1ccsc1NC(=O)C(=O)NNC(=O)c1cccc(Br)c1	764063681	WAKOSQRZAFYWGA-UHFFFAOYSA-N	426.248	1.697	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(OC3CCCC3)nc2)c1	764077975	POODSLXBFQJXTP-UHFFFAOYSA-N	446.485	1.206	50	20	IDGD	
C[C@H]1CCCN(S(=O)(=O)c2ccc(NC(=O)C(=O)NNC(=O)c3ccoc3)cc2)C1	764163294	IIHZWNJMLVHEFY-ZDUSSCGKSA-N	434.474	1.100	50	20	IDGD	
CC(C)CCC(=O)NNC(=O)C(=O)Nc1ccc(S(=O)(=O)C[C@@H]2CCCO2)cc1	764200176	VYJAFWAMLHYUDI-HNNXBMFYSA-N	425.507	1.161	50	20	IDGD	
CCc1onc(C)c1NC(=O)C(=O)NNC(=O)c1cc(OC)ccc1Br	764232012	MCDKSMRROHOKMC-UHFFFAOYSA-N	425.239	1.716	50	20	IDGD	
Cc1ncsc1C(=O)NNC(=O)C(=O)Nc1cccc(N2CCN(CC3CC3)CC2)c1	764248000	XOROGFLNKAMEGF-UHFFFAOYSA-N	442.545	1.383	50	20	IDGD	
COc1ccccc1NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)Cc2cccnc2)cc1	764268051	DLWRTWBHPNYFEW-UHFFFAOYSA-N	447.451	1.671	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)C(=O)Nc1ccc(NC(=O)C2CC2)cc1C(F)(F)F	764297450	RJWZXNDAAQAPFQ-UHFFFAOYSA-N	438.366	1.485	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2cccs2)[nH]n1)C(=O)Nc1cccc(Cn2cncn2)c1	764384906	MHFLMQOLKVNIMD-UHFFFAOYSA-N	436.457	1.178	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(CN2CCc3ccccc32)cc1	764398402	HIWKVFDYQGWADI-INIZCTEOSA-N	440.500	1.387	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)CSc3ccccc3O)cc2)CCO1	764402343	ZKCCJPIJHRQKIF-AWEZNQCLSA-N	444.513	1.496	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNS(=O)(=O)c3ccc([N+](=O)[O-])cc3)CC2)cc1	765124594	BXBQTMNVPUXGSS-UHFFFAOYSA-N	447.517	1.031	50	20	IDGD	
O=C(Cc1cccc2cccnc12)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765734953	GCPXXGVUWWRZEI-UHFFFAOYSA-N	431.496	1.383	50	20	IDGD	
O=C(Cc1ccc(-n2cccc2)cc1)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765737017	DHKIJTYRMUHLAR-UHFFFAOYSA-N	445.523	1.625	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3ccc(C(N)=S)cc3)CC2)cc1	765749717	RFLDFUNNIZZJAZ-UHFFFAOYSA-N	425.558	1.208	50	20	IDGD	
O=C(NNc1ncnc2ccsc12)NC1CCN(S(=O)(=O)C2CCOCC2)CC1	765787337	DWHYOENEFXVBQL-UHFFFAOYSA-N	440.551	1.291	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1cccc(COc2ccc3c(c2)OCO3)c1	766260858	LMAYDXSFYFPUOR-UHFFFAOYSA-N	437.412	1.875	50	20	IDGD	
Cn1nc(SCC(=O)NN=Cc2ccc(Oc3cccc(F)c3)cc2)c(=O)n(C)c1=O	766432796	BMMQFQMWMWVICL-UHFFFAOYSA-N	443.460	1.653	50	20	IDGD	
NS(=O)(=O)c1ccc(Br)c(C(=O)NNc2ncnc3ccsc23)c1	766676601	QPOXRMSKXZALMR-UHFFFAOYSA-N	428.293	1.858	50	20	IDGD	
CCOc1ccc(/C=C(/C#N)C(=O)N2CCN(S(=O)(=O)c3cn(C)c(C)n3)CC2)cc1	766743293	GNGYIOBDXBNRSY-AQTBWJFISA-N	443.529	1.567	50	20	IDGD	
CC(=O)N[C@@H](CC(=O)OCC(=O)NNC(=O)Cc1ccccc1C)c1ccc(C)cc1	767262359	XTLFQCAOPAVBSR-FQEVSTJZSA-N	425.485	1.804	50	20	IDGD	
Cc1nc2[nH]n(C)c(=O)c2c(C)c1CC(=O)NNC(=O)c1cc(-c2cccs2)[nH]n1	768261909	YIAVIADMGUGRKU-UHFFFAOYSA-N	425.474	1.334	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NC[C@@]2(C)CCO[C@@H]2C2CC2)cc1	768529190	OPJGOWJTSWHOSP-UYAOXDASSA-N	438.550	1.151	50	20	IDGD	
CC1(C)CCC[C@]2(C1)NC(=O)N(CC(=O)NNC(=O)Cn1ccc3ccccc31)C2=O	768570687	ILTRWYDSJZLGGA-JOCHJYFZSA-N	425.489	1.680	50	20	IDGD	
CSCCNC(=S)NNC(=O)c1cccc(S(=O)(=O)N2CCCC[C@H]2C)c1	769764183	ABTDJWMKSFDENQ-CYBMUJFWSA-N	430.621	1.722	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)[C@H]1CCN(C(=O)OCc2ccccc2)C1	770080792	RCTJQUHGGVDSHW-LPHOPBHVSA-N	425.441	1.633	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)NC[C@H](O)C(C)C)cc1	771601373	IYALJCZPEDPIAL-XLCPLWEUSA-N	425.489	1.474	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)c1cn(Cc2cccc(F)c2)nn1	772195434	MEHDAMJBOWAUKE-UHFFFAOYSA-N	430.827	1.196	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CCOCC1	772971224	YFTAMPVHRFHPQC-QGTPRVQTSA-N	435.908	1.696	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)on1)C(=O)Nc1ccc(Br)cn1	773530252	UOFBVSWHCMSLFM-UHFFFAOYSA-N	430.218	1.899	50	20	IDGD	
CN(C)CCn1c(=O)oc2ccc(NC(=O)C(=O)NNc3ccccc3[N+](=O)[O-])cc21	773648915	XBPKOZZOLHZHJP-UHFFFAOYSA-N	428.405	1.146	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@H](C(=O)NNc2ccc(C(F)(F)F)cn2)[C@@H](C)O)cc1	775249273	JZZYXBHIRUMZTG-ABAIWWIYSA-N	432.424	1.580	50	20	IDGD	
Cc1cc(C[C@@H](C)NC(=O)NNC(=O)CNC(=O)OC(C)(C)C)n(-c2ccccc2)n1	778705541	LFPJMLAAWNJESV-CQSZACIVSA-N	430.509	1.967	50	20	IDGD	
O=C(CNC(=O)c1ccc2c(c1)OCO2)NNc1ccc([N+](=O)[O-])cc1Br	779145057	FWWWQOWYPUNVHF-UHFFFAOYSA-N	437.206	1.959	50	20	IDGD	
COC(=O)[C@H]1[C@H](O)CCCN1C(=O)CCC(=O)C(C#N)=C1N(C)c2ccccc2N1C	781456711	ILARKDYXBOBLQC-UYAOXDASSA-N	426.473	1.182	50	20	IDGD	
O=C(CNC(=O)c1ccccc1I)NNc1ncncc1Cl	781833403	GPZLWGZLTRHTHY-UHFFFAOYSA-N	431.621	1.608	50	20	IDGD	
O=C1NC[C@@H]2CN(S(=O)(=O)c3ccc(S(F)(F)(F)(F)F)cc3)CCN2C1=O	782985625	QNTLJQJQJSCGDE-SECBINFHSA-N	435.396	1.675	50	20	IDGD	
O=C(NNc1ccc(F)cc1F)C(=O)Nc1ccc(N2CCN(C(=O)C3CC3)CC2)nc1	783344775	LSVQMMSQUVUNIT-UHFFFAOYSA-N	444.442	1.500	50	20	IDGD	
CCCCNS(=O)(=O)c1cccc(NC(=O)C(=O)NNC(=O)Nc2ccccc2C)c1	783417217	NXQGKIDXLMMDTJ-UHFFFAOYSA-N	447.517	1.865	50	20	IDGD	
CNS(=O)(=O)c1cccc(NC(=O)C(=O)NNc2cccc(C(F)(F)F)n2)c1C	784958620	ODBFHGOCAQQSEN-UHFFFAOYSA-N	431.396	1.399	50	20	IDGD	
CN(C)c1nccc(NNC(=O)C(=O)Nc2ccc(OCc3ccccn3)c(F)c2)n1	784969788	PSEOHLNKVRFCGP-UHFFFAOYSA-N	425.424	1.738	50	20	IDGD	
CC(C)Oc1c(F)cc(NC(=O)C(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)cc1F	785023467	JJNSJHIYIZTLFF-UHFFFAOYSA-N	438.343	1.766	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)c2cc([C@H]3CCN(C(=O)OC(C)(C)C)C3)[nH]n2)n1	786670440	REAYGQQDLNSJTC-AWEZNQCLSA-N	431.497	1.409	50	20	IDGD	
CC(C)n1nc(-c2ccco2)cc1NC(=O)C(=O)NNC(=O)COc1ccc(C#N)cc1	789732240	MZLGOVQKPHTIJM-UHFFFAOYSA-N	436.428	1.761	50	20	IDGD	
Cc1ccn(C[C@@](C)(O)C(=O)NNC(=O)[C@H](C)Oc2c(C)cc(Cl)cc2C)c(=O)c1	790483084	IBMNRBDZMKYPPO-YCRPNKLZSA-N	435.908	1.793	50	20	IDGD	
CC(C)c1c(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)cnn1-c1ccccc1Cl	790491294	HGQJLLOMKAXLMW-GFCCVEGCSA-N	439.925	1.780	50	20	IDGD	
COC(=O)c1cn(CCNC(=O)NNC(=O)c2sc(-c3ccccc3)nc2C)nn1	790655300	HHIUVYNRBJASMG-UHFFFAOYSA-N	429.462	1.141	50	20	IDGD	
CN(CC(=O)NNc1nc2ccccn2n1)S(=O)(=O)c1ccc(Br)cc1	791252227	BINIHUFHGRURSV-UHFFFAOYSA-N	439.295	1.256	50	20	IDGD	
Cc1nc2cc(C(=O)NNC(=O)c3cccc(S(=O)(=O)N4CCOCC4)c3)ccc2o1	791447977	YBNOWMIQUWEJHL-UHFFFAOYSA-N	444.469	1.232	50	20	IDGD	
COc1ccc(OC)c(C2=NO[C@@H](C(=O)NNC(=O)c3nnc(O)c4ccccc34)C2)c1	792015544	CAXXEQONJSCAGO-QGZVFWFLSA-N	437.412	1.307	50	20	IDGD	
CCOC(=O)[C@H](C)NC(=O)c1ccc(NC(=O)NNc2nc3ccccn3n2)cc1F	792317627	NLMMFZGMKQCGOY-NSHDSACASA-N	429.412	1.698	50	20	IDGD	
COc1ccccc1C(=O)NNS(=O)(=O)c1ccc(C(=O)O)cc1OC(F)(F)F	792697411	GXFKNAQROQCGOT-UHFFFAOYSA-N	434.348	1.915	50	20	IDGD	
CS(=O)(=O)C1(CNC(=O)NNC(=O)COc2ccc(Br)cc2)CCC1	793260126	QLHUJHTXFUNVCK-UHFFFAOYSA-N	434.312	1.126	50	20	IDGD	
Cn1cc(-c2cc(F)ccc2NC(=O)C(=O)NNC(=O)COCc2ccccc2)cn1	797007305	QELUDJMQIMKISI-UHFFFAOYSA-N	425.420	1.529	50	20	IDGD	
COc1ccc(S(=O)(=O)NCC(=O)NN=c2sc3ccccc3n2C)cc1OC	798304185	UMZRBIFLFHGZKM-UHFFFAOYSA-N	436.515	1.167	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cnn(CC(=O)NC3CCCCC3)c2)cc1C	798309292	JVAHFVCOUWWODU-UHFFFAOYSA-N	440.504	1.349	50	20	IDGD	
CC(=O)NCCN(Cc1ccc(C)s1)C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	800983176	CBSSRRVOJTURSQ-UHFFFAOYSA-N	442.505	1.025	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)Nc1ccc(Br)cc1)N1C(=O)NC2(CCCC2)C1=O	801995840	VLMXMIXFHMREST-JTQLQIEISA-N	438.282	1.855	50	20	IDGD	
CCOCCS(=O)(=O)NCC(=O)NNC(=O)Nc1c(Cl)cc(Cl)cc1Cl	802069314	GFSMVYKPCSIVIY-UHFFFAOYSA-N	447.728	1.755	50	20	IDGD	
COCc1nc(Cl)cc(NNC(=O)Nc2ccc(OC)c(NS(C)(=O)=O)c2)n1	806311404	JVQQYWAKVMAPLN-UHFFFAOYSA-N	430.874	1.805	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2nc(Cc3ccccc3)cs2)cc1	806973176	CIXKQRBDEBQTEH-UHFFFAOYSA-N	440.481	1.907	50	20	IDGD	
COc1ccc(CS(C)(=O)=O)cc1NC(=O)C(=O)NNC(=O)C(C)(C)c1ccccc1	806980086	OBSHGKQRKOZSSQ-UHFFFAOYSA-N	447.513	1.304	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)c1cccc(CS(=O)(=O)NC(C)(C)C)c1	807369781	JZVREKINSGSXLQ-UHFFFAOYSA-N	429.539	1.455	50	20	IDGD	
COC(=O)c1ccc(Cl)c(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1	811292664	PPNUISSFLLCBEW-MRXNPFEDSA-N	448.815	1.271	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2ccc(Cl)cc2OC)cc1	811337985	XSBDLGCQWSYFDE-UHFFFAOYSA-N	441.893	1.348	50	20	IDGD	
CN(C)c1cc(Cl)cc(Cl)c1C=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O	811637438	XIQSQTFILYNIFP-UHFFFAOYSA-N	445.332	1.094	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)Nc1ccc(CNS(C)(=O)=O)cc1	814640929	XUCFXURJXXHZFX-UHFFFAOYSA-N	441.535	1.135	50	20	IDGD	
Cn1c(Cl)nc(Cl)c1C=NNC(=O)C(=O)NN=Cc1c(Cl)nc(Cl)n1C	814692017	GICNPZHPAOMOEI-UHFFFAOYSA-N	440.078	1.368	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1coc(Sc2ncccn2)n1	816828429	FSNRNEJPTOMQBK-UHFFFAOYSA-N	447.502	1.292	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)[C@@H](c1ccccc1)N1CCC(O)CC1	817053936	MFDOXZKXZZXPRB-HXUWFJFHSA-N	432.546	1.578	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)Cn1cnc2c(oc3ccccc32)c1=O	817054190	XVKVCZFKHCBLCM-UHFFFAOYSA-N	441.469	1.536	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)cc1	913422626	AYHBSFGXQKWIEE-UHFFFAOYSA-N	441.469	1.019	50	20	IDGD	
COc1ccc(CCN2C[C@H](C(=O)NNC(=O)NC3CCCCC3)CC2=O)cc1OC	913450813	ANWCNYIJYANFLI-MRXNPFEDSA-N	432.521	1.758	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2ccc3c(=O)n(C)c(=O)n(C)c3n2)c(C)n1-c1ccccc1	914109901	PCUAKDUZCSSHCI-UHFFFAOYSA-N	446.467	1.115	50	20	IDGD	
C[C@H](Oc1ccccc1Cl)C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	914333725	QELRBHIAMUAXPO-VIFPVBQESA-N	432.285	1.869	50	20	IDGD	
Cc1nc(-c2ccccc2)[nH]c1C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	916108665	LDXUYMRDBVOTGW-UHFFFAOYSA-N	427.486	1.710	50	20	IDGD	
CC(=NNC(=O)Cc1nc2ccccc2n1C)c1ccc(OCC(=O)N2CCOCC2)cc1	916312931	ASUGWDVNBZFKAB-UHFFFAOYSA-N	449.511	1.894	50	20	IDGD	
Cn1ccnc1[C@](O)(CCNC(=O)NN=c1sc2ccccc2n1C)C(F)(F)F	916380878	SCZABQNYXBDDSQ-MRXNPFEDSA-N	428.440	1.928	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)NCc1cccc(S(N)(=O)=O)c1	916623914	DEAMJWDYGCJSQZ-AWEZNQCLSA-N	442.497	1.785	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)C2=NO[C@@H](c3ccccc3)C2)c1	917495864	CCPJZBYPAVSMNE-LJQANCHMSA-N	444.513	1.996	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)NCc1cccc(OCC(=O)N(C)C)c1	918013187	HUOKSHVJSHEOEB-UHFFFAOYSA-N	434.880	1.960	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)CN1CCCCC1	918104451	OXMCSLUKLMNOIX-HNNXBMFYSA-N	425.555	1.003	50	20	IDGD	
Cc1nccn1-c1ccc(CNC(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)cn1	918112337	OHUXMVTZXVONQZ-UHFFFAOYSA-N	444.521	1.484	50	20	IDGD	
NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NNC(=O)Cc3ccc(F)cc3)cc2)C1	918117489	FYVXHQNOCZGVEJ-KRWDZBQOSA-N	427.480	1.601	50	20	IDGD	
COC(=O)c1cc(NC(=O)NNC(=O)c2cc(OC)cc(OC)c2)cc(C(=O)OC)c1	920930053	FTCUJQASBWSLRH-UHFFFAOYSA-N	431.401	1.744	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)C(C)(C)NC(=O)OC(C)(C)C)cc1	921302238	WWTOEPHIVDRIMU-UHFFFAOYSA-N	442.538	1.066	50	20	IDGD	
CS(=O)(=O)c1cc(C(=O)NNC(=O)c2ccc(Br)cc2)cc([N+](=O)[O-])c1	1317972396	IOZBMQWRARNEHH-UHFFFAOYSA-N	442.247	1.836	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)NNC(=O)[C@@H]1CS[C@@H](Cc2ccccc2F)C(=O)N1	1337242078	IJUMSJXHKKQIDN-OALUTQOASA-N	440.500	1.840	50	20	IDGD	
O=C(/C=C/C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Cl)C1)NCc1ccco1	1778029833	HCQZQIBTOZQBRZ-CFKNTDOYSA-N	441.887	1.500	50	20	IDGD	
Cc1ccn2c(C(=O)N3CCO[C@@]4(CCN(C(=O)CO[Si](C)(C)C)C4)C3)cnc2c1	1779299776	ZCKJMGOGPOYDKV-OAQYLSRUSA-N	430.581	1.938	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(-c4ccccc4)[nH]n3)C2)C1	1780291453	ZVFQATHHIRWBDQ-IIBYNOLFSA-N	432.908	1.774	50	20	IDGD	
CCN(C)[C@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)CBr)C2	1781451339	WZERAKTTXINGLD-YKTARERQSA-N	432.403	1.872	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccn3cncc13)C2	1782175705	PHVOHLWCWYNSTJ-YRISNDGFSA-N	434.924	1.716	50	20	IDGD	
Cn1cccc1C(=O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Br)C2	1782611069	XXOBLXIDNKRTNV-QIIPPGSGSA-N	444.301	1.412	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2)c1ccc2c(c1)CCCO2	1782883200	BNFHAHPUSIPKCA-SFGWALBWSA-N	436.936	1.739	50	20	IDGD	
CC[C@H](O)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](Br)Cc3ccccc3)C2)C1	1783018815	QHFMOIDDIQRCJH-ZWOKBUDYSA-N	439.350	1.593	50	20	IDGD	
COc1nccc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](C)Br)C3)C2)c1F	1783532037	CAWPUDIIKPLZTF-PIGZYNQJSA-N	430.274	1.456	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3n[nH]c4ccc(C#N)cc34)CCO2)C1	1783536262	ILBOUROGHIQHAQ-BUXKBTBVSA-N	446.305	1.661	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(C)ccc3-n3ccnn3)CCO2)C1	1783883968	XIMCVLLJASVFOZ-UTKZUKDTSA-N	447.923	1.273	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](C)Cn3ccnc3)C2)C1	1784495812	ZTHQKSATTJVNGV-VKJFTORMSA-N	427.343	1.380	50	20	IDGD	
O=C(CCc1cncnc1)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1	1788208246	RLFWFLJRDKTOJD-UHFFFAOYSA-N	444.300	1.537	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)c3ccccc3)C[C@@H]21)[C@H](F)Br	1789922983	VTDCGAYYBIWCTO-GVRJEKJASA-N	429.286	1.390	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3nc4ccc(F)cn4n3)[C@H]2C1	1790526503	HWENWQCXVSRKDB-QEJZJMRPSA-N	437.903	1.727	50	20	IDGD	
CC(C)n1nccc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)Br)[C@H]2C1	1791058625	AAPASPRYKPJMGM-YXWQFLTLSA-N	427.343	1.841	50	20	IDGD	
CC(C)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccn(C(F)F)c1=O)C2	1792783952	HVXOYLFZAHYRLG-DABQJJPHSA-N	431.867	1.712	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cn(C(C)(C)C)nn1)C2	1792872494	KQIWRXGGUVDBHV-XPCVCDNBSA-N	442.358	1.267	50	20	IDGD	
CC(C)c1nn2ccccc2c1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](O)CCl	1792977362	UDJWMONOFMRJDH-QHHYFVSCSA-N	434.924	1.261	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@@H](C)C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](F)Cl)C3)cc1	1793146812	IPJMQHNEQVKBSZ-JBXGNFEISA-N	445.944	1.834	50	20	IDGD	
CN(C)c1cncc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@](C)(Cl)CCl)C3)c1	1794297023	FCXAHNGVCKPBIP-QHHYFVSCSA-N	429.348	1.587	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)c1cccnc1-c1cccc(F)c1	1796033998	WTZYGNKWDRTMDT-QXGSTGNESA-N	447.894	1.691	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1noc2c1CCCC2	1796155376	WFMOWNZZGQVNNY-OHTBPHCPSA-N	426.311	1.540	50	20	IDGD	
O=C(Cc1ccc(F)cc1Cl)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1	1796189853	ISHBSZASZDFWLG-REPLKXPHSA-N	444.699	1.653	50	20	IDGD	
CC[C@H](CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Cl)NC(=O)OC(C)(C)C	1796367735	RTSZQDHUVOHZCO-RHBQXOTJSA-N	435.924	1.804	50	20	IDGD	
CC(C)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(-c2cccnc2)[nH]n1	1798157090	VHTHOJVMJOATDT-JLVBRIDZSA-N	431.924	1.940	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCc1cccs1)C2	1798440758	ONWYWMDIMVDQML-QDMKHBRRSA-N	427.530	1.631	50	20	IDGD	
C[C@@H](NC(=O)c1ccc(F)cc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2	1799050911	GUOPJCYJVCHRFU-BCEUIYSSSA-N	429.851	1.068	50	20	IDGD	
C[C@@H](Nc1ccccn1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Br	1799350158	SUUQLXITLPFLMC-AMVBZWJASA-N	429.290	1.162	50	20	IDGD	
Cc1ccn2ncc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@@H](C)Br)c2c1	1800757467	LWQNYJJEZYBQBR-VWPFQQQWSA-N	435.322	1.629	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C[C@H]1OCCc3ccccc31)C2	1800971442	YZWUYAHDTBFDNN-BKRRIZPZSA-N	436.936	1.534	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(C(F)(F)F)n1)C2	1800976705	CRMCSAFSPMLOSY-NWJSVONSSA-N	435.830	1.557	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cc3cccnc3cc1F)C2	1800977131	JQZRMTVFVQNLDB-DLRJPAPCSA-N	449.910	1.760	50	20	IDGD	
C[C@H](Oc1cccnc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)CBr)C2	1801396573	WKLTTWUTNWATMU-JGFGOLAASA-N	440.338	1.470	50	20	IDGD	
O=C([C@H](O)CCl)N1CCCC2(CCN(C(=O)[C@H]3CC[C@@H]4CCC(=O)N4C3)CC2)C1	1805525376	PXRDDLIDMCUUAJ-GVDBMIGSSA-N	425.957	1.218	50	20	IDGD	
Cn1ccc(CC(=O)N2CC[C@@H](CNC(=O)CCBr)[C@@H]2c2cccnc2)n1	1806340329	BYWCWOCPTIJADZ-KXBFYZLASA-N	434.338	1.849	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)c2ccsc2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1	1807369813	WLNZCLKGAROAIT-YLJYHZDGSA-N	435.314	1.456	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)Cn2ccccc2=O)[C@H]1c1cccnc1	1807442325	NYILGSUQKKSZBZ-FUHIMQAGSA-N	432.908	1.203	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)[C@H](C)CS(C)(=O)=O)[C@H]1c1cccnc1	1808243378	DZRBMFCZHGHVJW-IWCQGFGOSA-N	429.970	1.786	50	20	IDGD	
Cc1cc(F)ccc1C(=O)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1	1809977639	GJBJHQYURXKKJT-UHFFFAOYSA-N	438.308	1.973	50	20	IDGD	
Cc1cc(C(=O)N2CCC3(CCCN(C(=O)c4cccc(B(O)O)c4)C3)CC2)c(C)n1C	1809978085	WCNMUYUSVSEFOL-UHFFFAOYSA-N	437.349	1.480	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H](CNC(=O)CNC(C)=O)[C@@H]1c1cccnc1	1812623562	ROHXYQORIDWELA-VYDXJSESSA-N	425.327	1.397	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2cnc3[nH]ncc3c2)[C@@H]1c1cccnc1	1813031204	RAFWDSPNYQQYTC-JCGIZDLHSA-N	442.907	1.926	50	20	IDGD	
CC(C)=NO[C@H](C)C(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1813073754	SNGMUVCDDWBSBR-MMOPVJDHSA-N	446.552	1.261	50	20	IDGD	
CC(C)/C=C/C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1	1813695005	XTKUUKCBNXLXPZ-RAIXIZIVSA-N	436.516	1.612	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1CCc2nc(NC(=O)CN3CCCC3=O)sc2C1	1814585605	JULGYEKFTVSUIN-GHMZBOCLSA-N	443.367	1.709	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H]1CC=CCC1)CC2)c1ccc(B(O)O)cc1	1815335683	KFEUQAFXKYTXJO-CJNGLKHVSA-N	425.319	1.405	50	20	IDGD	
O=C(CCC(=O)N1CCCC1)Nc1cc([C@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1	1815639329	XLZCGDWUXHOTSU-HUUCEWRRSA-N	425.917	1.404	50	20	IDGD	
O=C(/C=C/c1ccco1)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1815947854	JSYYJFFWLFAIMT-GNISGLHKSA-N	434.261	1.702	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2nccs2)[nH]n1	1819401991	HASDOXHWIAGHNI-AWEZNQCLSA-N	440.489	1.484	50	20	IDGD	
Cn1cccc(C(=O)N[C@@H]2CCc3nc(NC(=O)CO[Si](C)(C)C)sc3C2)c1=O	1820160293	IOYPTPUOIXJHOR-GFCCVEGCSA-N	434.594	1.919	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)CCN2CCOCC2)[nH]n1)[C@H](F)Br	1820932048	CGYYOQRYUUTIGV-BBRMVZONSA-N	446.321	1.815	50	20	IDGD	
COc1ccc2[nH]cc(C(=O)Nc3nc4c(s3)C[C@H](NC(=O)[C@H](O)CCl)CC4)c2n1	1821244449	VMPCNXFYUJBDDK-NOZJJQNGSA-N	449.920	1.854	50	20	IDGD	
CC(=O)NCCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](C)CBr)[nH]n1	1821978409	QGWDQRBEBUGQQE-RISCZKNCSA-N	428.331	1.959	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)[C@@H]1C[C@]1(F)Cl	1822501273	KDSQZMIZRIXNME-ZUEVXXBESA-N	434.664	1.320	50	20	IDGD	
CCC(=O)N[C@H](C)C(=O)N[C@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1	1822999031	NKEXQFMDGAOXIT-LWINAJNOSA-N	435.319	1.660	50	20	IDGD	
O=C(c1cnc2snnc2c1)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)CC1	1824185582	KDVJOQDTRIBEFG-HOTGVXAUSA-N	437.953	1.919	50	20	IDGD	
CN1CCCC[C@@H]1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1	1824199496	WQMGEYQGOYKNAV-FCHUYYIVSA-N	441.381	1.084	50	20	IDGD	
CC(=O)N/C(C)=C/C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCBr)CC2	1824468488	FSXPNCNVOLGSJJ-MXMFLMJRSA-N	429.340	1.880	50	20	IDGD	
CCc1nc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)co1	1827052626	SQZBYLHMUHZLFU-FQEVSTJZSA-N	439.321	1.464	50	20	IDGD	
O=C(c1cncc(O)c1)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827060536	ONXFNCXPZVHBHG-OAQYLSRUSA-N	437.305	1.014	50	20	IDGD	
CC(C)(C)n1cc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)[C@@H](O)CCl)CC2)nn1	1829784317	ARKBBKZZIZYMCM-SJORKVTESA-N	425.961	1.866	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cnc4ccccn34)C2)C1	1831639347	QPGSIODWARSYFR-XMSQKQJNSA-N	448.951	1.741	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CC[C@H](C(=O)OC)CC1)CCO2	1832013108	HIKUVSYUDVWDJG-LHUKNYEISA-N	444.956	1.440	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3cc(C)cs3)CCO2)C1	1832985863	XJEUEHKYRMYDSH-PXNSSMCTSA-N	444.981	1.699	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H]3CCc4ccccc43)CC2)CC1)[C@@H](O)CCl	1833313120	WROIXTMTMDYJRK-RTWAWAEBSA-N	433.980	1.888	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)c3c(F)cncc3F)C2)C1	1834823460	WCIBVPNXEOFHIK-QGZVFWFLSA-N	448.264	1.215	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)c1cc2n(n1)CCCC2	1835569798	POYGMWTWNACPOU-IBGZPJMESA-N	437.972	1.004	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3c[nH]c4ncccc34)C2)C1	1837713115	IAVSXPBQVAKEBQ-OAQYLSRUSA-N	446.580	1.484	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(C#N)c3)C2)C1	1837714624	LTGMUDUKORIPQT-OAQYLSRUSA-N	431.565	1.480	50	20	IDGD	
O=C(c1ccc(Cl)nc1Cl)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1837825641	SZJHVCFSWIOXAE-BLLLJJGKSA-N	440.686	1.993	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3ccc4nncn4c3)CC2)CC1	1838332282	WUKYQARPVSQJFA-SFHVURJKSA-N	449.939	1.595	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)Cc3cc(C)[nH]n3)CC2)CC1	1838413874	RJOIZCBQGGBXPW-SFHVURJKSA-N	426.945	1.513	50	20	IDGD	
CC(C)c1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)on1	1838778618	AEVYQYHXJZFOHU-UGSOOPFHSA-N	444.326	1.651	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3Cc4ccccc4CN3)C2)C1	1839144517	CVGBGZCWBKQZEL-DXIQSLLYSA-N	435.952	1.175	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C=C/c3cnc[nH]3)C2)C1	1839967245	GVBFBPRUJXALED-AIWSSPEVSA-N	441.326	1.053	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccccc3)C2)C1	1840031965	JDVUUKRWTYZFMG-BEFAXECRSA-N	425.323	1.469	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnoc3C3CC3)C2)C1	1840032019	LJHFCFYRRWZRFD-SGTLLEGYSA-N	442.310	1.405	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cn3cnc4ccccc43)CCO2)C1	1840100884	LZJJPKUXUZTZHN-JTSKRJEESA-N	448.951	1.900	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C)cnc3Cl)C2)C1	1840151260	ZCNMCXSVGBTUQV-DNVCBOLYSA-N	446.331	1.367	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccc(F)cc3)C2)C1	1840151896	QOQZMCIGFCXVIA-PXNSSMCTSA-N	428.888	1.078	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(F)cc3OC)C2)C1	1840155629	BUIBTIFACXLYSA-JXFKEZNVSA-N	444.887	1.158	50	20	IDGD	
O=C(CCCc1ccncc1)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840186150	DBADNRIZHRGZPK-LJQANCHMSA-N	430.332	1.664	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(C)c(O)c(C)c3)CCO2)C1	1840677176	SNVMMFXJOCGFBH-UTKZUKDTSA-N	440.924	1.333	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](CCC)NC(C)=O)CCO2	1840851242	KZYSHIVSTAVFLK-ABSDTBQOSA-N	431.961	1.155	50	20	IDGD	
CC(=O)N[C@H](Cc1cc(F)c(F)c(F)c1)C(=O)N1CC2(CCCN2C(=O)[C@H](F)Cl)C1	1843365209	FUXSIDSHPXSYBC-ZBFHGGJFSA-N	449.832	1.889	50	20	IDGD	
Cc1ccc(CCC(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)s1	1844263764	SCPQFSPATCQVGY-UHFFFAOYSA-N	427.530	1.505	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1cccc3cnccc13)C2	1844264507	ZXBVFOANKVWNKJ-UHFFFAOYSA-N	430.468	1.364	50	20	IDGD	
O=C1C[C@H](C(=O)N2CC3(CCCN3C(=O)[C@@H](Br)Cc3ccccc3)C2)CN1	1845942383	CRZXEQVBRJKOJZ-HOTGVXAUSA-N	434.334	1.332	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@H](F)C[C@H]1C(=O)N1CCCC12CN(C(=O)[C@H](O)CCl)C2	1847132488	VIFOMEQJZWRUBJ-MELADBBJSA-N	433.908	1.137	50	20	IDGD	
COc1ccccc1CCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cnccc1C(=O)NN	1847681420	UGZXBDMRKLPOID-OALUTQOASA-N	437.500	1.142	50	20	IDGD	
CC(=O)NC(C)(C)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O	1847824966	OLWSVDTUXLRWJZ-IRXDYDNUSA-N	446.460	1.250	50	20	IDGD	
O=C(NNC(=O)c1ccc(NS(=O)(=O)/C=C/c2ccccc2)cc1)C(=O)NC1CC1	9890013	NNNJAHICVIROEZ-OUKQBFOZSA-N	428.470	1.139	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)[C@H](C)NS(=O)(=O)c2ccc(C)cc2)cc1	18072013	SNTKUAIGNVQHQS-HOTGVXAUSA-N	449.529	1.675	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)CCNS(=O)(=O)c1ccc(F)c(F)c1	21026331	MAHRGSOCUSRJCD-UHFFFAOYSA-N	447.847	1.756	50	20	IDGD	
O=C(Cn1cnc2ccc(Br)cc2c1=O)NNC(=O)c1ccc2c(c1)OCO2	107536976	XIMINOSBHHOGIP-UHFFFAOYSA-N	445.229	1.349	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H]2CCCN2c2ncnc3sccc23)c1	728464274	QBUPYKQHCMHBCR-OAHLLOKOSA-N	445.526	1.525	50	20	IDGD	
CC(C)Cn1c(=O)nc(O)c2c(C(=O)NNC(=O)Cc3cccnc3)cc(C3CC3)nc21	728891787	FYSXOVMXACNMGB-UHFFFAOYSA-N	436.472	1.429	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)NC1CCN(CC(F)(F)F)CC1	728951076	ZMIDIACYMPEJSZ-UHFFFAOYSA-N	429.447	1.050	50	20	IDGD	
CN(C[C@@H]1CCN(CC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)C1)C(=O)OC(C)(C)C	729478737	ZHCMBUHXYPVMCW-AWEZNQCLSA-N	435.481	1.545	50	20	IDGD	
CCCOc1ccc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cn1	730907867	NUAAIZXHHNPQSY-UHFFFAOYSA-N	435.506	1.265	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C1CCN(C2=NS(=O)(=O)c3ccccc32)CC1	731491497	NXDLGBNAQRXSSH-UHFFFAOYSA-N	442.497	1.317	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CSc2nnnn2C2CC2)cc1Br	732036080	UNEGSDOBZLLFQI-UHFFFAOYSA-N	427.284	1.332	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)CCN3CCN(C(=O)[C@H]4CCCO4)CC3)cc2C1	732053148	XYHLDBQGXNGRTM-NVXWUHKLSA-N	448.589	1.347	50	20	IDGD	
CCOCCCN1CC[C@@H](NC(=O)NNC(=O)Cc2nc3ccccc3n2C)[C@H](C)C1	734684394	NPNZGHMHDTWFNA-IAGOWNOFSA-N	430.553	1.583	50	20	IDGD	
CC(=NNC(=O)c1csc(N2CCOCC2)n1)[C@H]1CN(Cc2ccccc2)CCO1	735612336	NFXAPAGEAOFRAR-LJQANCHMSA-N	429.546	1.986	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)c1ccc(N2CCCS2(=O)=O)cc1Cl	736066402	GKTBVSPZALWOKU-UHFFFAOYSA-N	441.868	1.859	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)NCc2ccc(O)nc2)cc1	736173423	GLLIBDQXIFDURQ-YVLHZVERSA-N	446.467	1.758	50	20	IDGD	
C[C@H]1CCCCN1C(=O)[C@@H](C)NC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	737047088	HGIFNNJGBZHZMG-RBUKOAKNSA-N	444.580	1.319	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)[C@H]1CC(=O)N(c2ccc(F)c([N+](=O)[O-])c2)C1	737637569	FKLWULSMNNVQRL-AWEZNQCLSA-N	430.392	1.451	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)NCc2n[nH]cc2Br)c2ccccc2c1=O	739019226	AYMQZUHZNPXCPY-UHFFFAOYSA-N	448.281	1.607	50	20	IDGD	
CN(C)c1nccc(NNC(=O)C2CCN(S(=O)(=O)c3ccc4c(c3)CCC4)CC2)n1	740117139	CXTCCXPCRRENOC-UHFFFAOYSA-N	444.561	1.575	50	20	IDGD	
O=C(CN1C(=O)N[C@]2(CCc3ccccc32)C1=O)NNC(=O)c1cccc2ccccc12	741575127	IDWSLPXAXRBPCA-DEOSSOPVSA-N	428.448	1.994	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc2oc(=O)[nH]c2cc1Cl)c1cc(Br)c[nH]1	743250219	AYUUXABORRKDTO-UHFFFAOYSA-N	435.643	1.488	50	20	IDGD	
CC(C)c1ccc(S(=O)(=O)c2ccc(NNC(=O)c3cn(CC(N)=O)nn3)cc2)cc1	743300394	CGWGFDHQLJPQCK-UHFFFAOYSA-N	442.501	1.477	50	20	IDGD	
COc1cc(C=NNC(=O)Cc2cc(O)nc(O)n2)ccc1OC(=O)c1ccc(F)cc1	743447842	PRWNDZOVCFOQDA-UHFFFAOYSA-N	440.387	1.948	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)N[C@H](C)CN1CCN(c2ccccc2)CC1	743507765	IBNYGNKFMKKRRM-QGZVFWFLSA-N	435.532	1.797	50	20	IDGD	
CC[C@](C)(O)CNC(=O)/C(C#N)=C\c1cn(CCC(N)=O)nc1-c1ccc(OC)cc1	743760933	QSJRTYJPFYAPTC-KLZTUXMASA-N	425.489	1.618	50	20	IDGD	
CN(C)[C@H](CNC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)Cc1ccccc1	745294007	WXZINTSJEFFATL-KRWDZBQOSA-N	433.534	1.599	50	20	IDGD	
Cn1ccnc1[C@@H](NC(=O)NNC(=O)c1cc([N+](=O)[O-])ccc1O)c1cccc(F)c1	745397078	XMFMZXQVTHCOQA-INIZCTEOSA-N	428.380	1.907	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@H](C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)C1	746093631	RMRLPPCQSFBAOE-GOEBONIOSA-N	437.518	1.212	50	20	IDGD	
COc1ccc(N2C[C@H](C(=O)NNC(=O)Cc3cn4ccccc4n3)CC2=O)c(OC)c1	746548557	JTEAAVTXMBLFBQ-CQSZACIVSA-N	437.456	1.095	50	20	IDGD	
CCCC[C@@H](/N=C1/NS(=O)(=O)c2ccccc21)C(=O)NNC(=O)Cc1ccncc1	747428707	SROMQZIVQHXSHL-MRXNPFEDSA-N	429.502	1.069	50	20	IDGD	
O=C(COc1ccc(OCc2ccccc2)cc1)NNC(=O)C[C@@H]1CCS(=O)(=O)C1	747474683	WJOLAJBBZWRTRM-KRWDZBQOSA-N	432.498	1.617	50	20	IDGD	
COC(=O)c1ccc(OC)c(S(=O)(=O)NNC(=O)c2cccc(Br)c2)c1	747616120	JCZJCAINXJQPPH-UHFFFAOYSA-N	443.275	1.868	50	20	IDGD	
CS(=O)(=O)c1ccc(OCCC(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)cc1	748610849	SUHZVAGJKZDONI-UHFFFAOYSA-N	448.469	1.999	50	20	IDGD	
Cc1c(NNC(=O)CNS(=O)(=O)c2ccc3c(c2)OCCCO3)cccc1[N+](=O)[O-]	749288886	CZGXYHKDYWIHES-UHFFFAOYSA-N	436.446	1.486	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)c2cnc(-c3ncccn3)s2)c2ccccc2c1=O	749561370	PTSRFOYKXTWRJV-UHFFFAOYSA-N	435.469	1.966	50	20	IDGD	
O=C(CCn1c(=O)nc(O)c2ccccc21)NNc1nc(Br)cn2ccnc12	750248179	XXMLDZYIEBWTSB-UHFFFAOYSA-N	444.249	1.441	50	20	IDGD	
CNS(=O)(=O)[C@H]1CCN(C(=O)/C(C#N)=C\c2cn(CCC#N)nc2-c2ccccc2)C1	750515928	KFHYPPDDNNDERO-GTVARFKMSA-N	438.513	1.521	50	20	IDGD	
O=C(CN1CCOCC1)N1CCN(S(=O)(=O)c2ccc(CCCCl)cc2)CC1	750853165	BMZFVQZFTYVJRD-UHFFFAOYSA-N	429.970	1.023	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(OCC(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)C1	750954755	BYJRWGFQCOQBBS-UHFFFAOYSA-N	441.868	1.280	50	20	IDGD	
Cc1nc(-c2cccnc2)nc(NNC(=O)c2ccc([C@]3(C)NC(=O)NC3=O)cc2)c1C	751066514	JAPNCNDESVMKIO-QFIPXVFZSA-N	431.456	1.967	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)c1cc(Cn2cc(Br)cn2)on1	752127075	HXORBZICBFAYPE-UHFFFAOYSA-N	440.279	1.842	50	20	IDGD	
CC[C@H](CS(=O)(=O)c1ccccc1)NC(=O)NNC(=O)c1ccc(OC)c(OC)c1	752130802	VSHIJMYQGJZROX-OAHLLOKOSA-N	435.502	1.900	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)n1	752502304	DKFCIKIADFWQIY-UHFFFAOYSA-N	440.481	1.644	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)[C@H]2CCCCN2S(=O)(=O)c2ccc([N+](=O)[O-])cc2)o1	752780722	BKMCQWNNRQRIDL-OAHLLOKOSA-N	436.446	1.501	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)N[C@H]2CCN(Cc3ccc(C#N)cc3)C2=O)cc1	753292829	VHDOCDASWHTRTA-IBGZPJMESA-N	435.488	1.761	50	20	IDGD	
CCCN(CCNC(=O)NNC(=O)c1nnc(O)c2ccccc12)C(=O)OC(C)(C)C	754667677	DZQARQREDUBSGA-UHFFFAOYSA-N	432.481	1.927	50	20	IDGD	
CC(=O)Nc1cccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1	755494533	LCOXPHIZNMHLSB-UHFFFAOYSA-N	445.501	1.896	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)ccc1N1CCSCC1	756296188	XMKFSBUGBPPLGT-UHFFFAOYSA-N	438.517	1.990	50	20	IDGD	
O=C(CNC(=O)c1ccccc1I)NNc1ncccc1[N+](=O)[O-]	759303911	QAMJMHUBFAPICE-UHFFFAOYSA-N	441.185	1.468	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@](C)(O)CN2C(=O)C(C)(C)c3ccccc32)cc1OC	760053542	XZOLJMJFKJTNSS-HSZRJFAPSA-N	441.484	1.540	50	20	IDGD	
CCO[C@@H]1C[C@H](NC(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)[C@@]12CCCO2	760144098	UQJBRDGPZYIPLW-JKSBSHDWSA-N	443.504	1.648	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)CCNC(=O)N1CCc2ccccc2C1	760438506	WNEQBZGQJMTUHX-UHFFFAOYSA-N	433.509	1.207	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)[C@@H]1CN(C(=O)OC(C)(C)C)CCC1(F)F	760490324	NRDDBIRNAFAXNG-NSHDSACASA-N	436.456	1.551	50	20	IDGD	
CC(=O)Nc1cc(C(=O)NNC(=O)CNC(=O)c2cccs2)cc(C(F)(F)F)c1	760493456	RMROGTDWCZTGPU-UHFFFAOYSA-N	428.392	1.916	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)CCNC(=O)[C@H]1CCCN1C(=O)OC(C)(C)C	760798660	BYLXLKCPILDPGA-MRXNPFEDSA-N	448.520	1.291	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	761783300	QHCJIXNBHFSVFW-KRWDZBQOSA-N	426.473	1.596	50	20	IDGD	
C#CCOc1ccc(F)cc1NC(=O)C(=O)NNC(=O)c1ccccc1Br	763482088	FCEIBRTWMPNAAA-UHFFFAOYSA-N	434.221	2.000	50	20	IDGD	
COc1c(Br)cc(Cl)cc1NC(=O)C(=O)NNC(=O)c1cccnc1	763495418	USGBTUMKEPHPGF-UHFFFAOYSA-N	427.642	1.906	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cccc(CN3C[C@@H](C)O[C@H](C)C3)c2)c(C)o1	763584323	ZZYKIURETSPUKB-HUUCEWRRSA-N	428.489	1.905	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(S(=O)(=O)N(C)C(C)C)cc2)c(C)o1	763586906	RRHOTFRTCMBDDY-UHFFFAOYSA-N	436.490	1.325	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)C(=O)Nc2ccc(-n3ccnn3)cc2)c1	763598150	VUNRFKWEXSSYCP-UHFFFAOYSA-N	436.472	1.864	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1	763685896	ZAGWVZPRDYDHOZ-UHFFFAOYSA-N	436.808	1.812	50	20	IDGD	
CSCc1ccccc1NC(=O)C(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	763790241	GYPLPLIAGTVHAW-UHFFFAOYSA-N	425.470	1.196	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)n(-c2ccccc2)n1	763857836	PIXZETKJZRPANL-CQSZACIVSA-N	425.420	1.873	50	20	IDGD	
Cc1ccc(Cn2nccc2NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)s1	763871159	DYSDSWSCIVBAQG-ZDUSSCGKSA-N	445.476	1.994	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cnn(-c3ccccn3)c2)cc1	763873009	RCHYANVSURHWFK-AWEZNQCLSA-N	436.428	1.023	50	20	IDGD	
Cc1nnc(-c2ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc3ccc(F)cc3)cc2)o1	763873287	VAQSJTRNXVLTLZ-LLVKDONJSA-N	427.392	1.738	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccn(-c3cccc(C(F)(F)F)c3)n2)n1	763881661	ONRYHAHJXKBPAR-UHFFFAOYSA-N	449.393	1.491	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@H](C)C(=O)NNC(=O)C(=O)Nc1ccn(CCC#N)n1	763883507	PQIFGIIBSFFXCT-CYBMUJFWSA-N	432.868	1.620	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2C)cc1-n1nnnc1C1CC1	763960642	RZROHHSBXPLMRL-UHFFFAOYSA-N	435.444	1.256	50	20	IDGD	
O=C(NNC(=O)c1cc2c(s1)CCCCC2)C(=O)Nc1cccnc1-n1cncn1	763963048	XWZAVLNSZTXUCN-UHFFFAOYSA-N	425.474	1.392	50	20	IDGD	
Cc1ccccc1COc1cccc(NC(=O)C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)c1	763996153	CDEXDASWLDGEOH-MRXNPFEDSA-N	445.497	1.095	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1cccc(Cl)c1S(C)(=O)=O	764138593	FPSNQZPFGGIGJE-UHFFFAOYSA-N	439.877	1.081	50	20	IDGD	
COc1ccc(Cn2nccc2NC(=O)C(=O)NNC(=O)CCc2ccco2)c(OC)c1	764171155	FRIVMPAHSBOPMK-UHFFFAOYSA-N	441.444	1.260	50	20	IDGD	
COc1cccc(Cn2nccc2NC(=O)C(=O)NNC(=O)CCc2ccco2)c1OC	764177356	ODQSZTZARGLVGW-UHFFFAOYSA-N	441.444	1.260	50	20	IDGD	
CN(C)c1nnc(-c2ccc(NC(=O)C(=O)NNC(=O)c3cccc4ncccc34)cc2)o1	764257522	KGBSCLYMHVFSGS-UHFFFAOYSA-N	445.439	1.751	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2cc(Br)ccc2O)cc(OC)c1	764278071	RAJUYXGTBQJJLD-UHFFFAOYSA-N	438.234	1.572	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)C(=O)Nc1ccc(Oc2cccnc2)nc1	764351986	VGKXNHVRSWILMZ-UHFFFAOYSA-N	443.423	1.854	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccnn2Cc2cnn(-c3ccccc3)c2)o1	764367421	HDPLRKCVWFXJOU-UHFFFAOYSA-N	433.428	1.418	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2ccc(C)nc2N(C)C)n[nH]1	764377825	QNYMEOXLFDHKRE-UHFFFAOYSA-N	437.460	1.254	50	20	IDGD	
O=C(NNC(=O)C(F)(F)Oc1ccccc1)C(=O)Nc1ccn(CCc2ccncc2)n1	764379625	GGCYRGHEPRVYOJ-UHFFFAOYSA-N	444.398	1.279	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)N[C@@H](CCO)C2CCOCC2)N(C)c2ccccc21	764405525	TUISBQXCWWIGPR-SFHVURJKSA-N	426.517	1.951	50	20	IDGD	
CCOc1ccc(NC(=O)NNC(=O)OC(C)(C)C)cc1S(=O)(=O)N1CCOCC1	765116106	WDUBQMVJUOLPSH-UHFFFAOYSA-N	444.510	1.667	50	20	IDGD	
CC(C)(C)OC(=O)NNC(=O)C(=O)Nc1ccccc1S(=O)(=O)N1CCCCC1	765391204	PREKNZXAISZBSE-UHFFFAOYSA-N	426.495	1.356	50	20	IDGD	
C[C@@H](NC(=O)OC(C)(C)C)[C@@H]1COCCC1=NNC(=O)Cn1nnc(-c2ccccc2)n1	766009161	LMIGEYTZJOMHMC-ZBFHGGJFSA-N	443.508	1.762	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@@](C)(O)[C@H](C)c3ccccc3)CC2)cc1	766644043	OCIDGJVNBISBIX-NLFFAJNJSA-N	438.572	1.815	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)CN1C(=O)[C@@H](C)Oc2ccccc21	767277273	DKYQZGYUXAGCTC-OAHLLOKOSA-N	425.441	1.042	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)C(=O)Nc1ccc(Cc2nnc3n2CCCCC3)cc1	768240931	DKMAMWYKJHODTI-UHFFFAOYSA-N	447.499	1.319	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)Nc1ccc2c(c1)S(=O)(=O)CC2	769243265	ZILMTUYWGXKKNX-UHFFFAOYSA-N	425.488	1.577	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCN(C(=O)OCc2ccccc2)C1)c1ccc2c(c1)OCCO2	770132734	VRMRFFRSKZFCIG-KRWDZBQOSA-N	425.441	1.878	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)c1ccc(S(=O)(=O)N(C)C)nc1	770209491	UUYKDOGNISVYTQ-AWEZNQCLSA-N	442.497	1.714	50	20	IDGD	
CC(C)Oc1ccc(NC(=S)NNC(=O)c2ccc(S(=O)(=O)N(C)C)nc2)cc1	770228380	VLEXCMJZRKOAKF-UHFFFAOYSA-N	437.547	1.751	50	20	IDGD	
COc1ccc(C)cc1[C@@]1(C)NC(=O)N(CC(=O)NNc2ncccc2[N+](=O)[O-])C1=O	771623968	YHYZTPNEARTXIW-LJQANCHMSA-N	428.405	1.217	50	20	IDGD	
Cn1ncc(C(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)c1Cc1ccccc1	772517871	KOLVOEGWZNYRBU-UHFFFAOYSA-N	425.876	1.742	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	772715920	CWWUGYBFERLGAE-UHFFFAOYSA-N	432.908	1.390	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1cc(C(F)(F)F)ccn1	773545216	JEIWUAVHSLXDCU-UHFFFAOYSA-N	428.392	1.987	50	20	IDGD	
O=C(NNc1ccc2ccccc2n1)C(=O)Nc1cc(N2CCCS2(=O)=O)ccc1F	773662387	VLTVDPKEFIXOEG-UHFFFAOYSA-N	443.460	1.996	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2c(F)cccc2F)cc1-n1nnnc1C1CC1	773713614	LYGLEXXAYFHMIL-UHFFFAOYSA-N	429.387	1.908	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)CCS(=O)(=O)c2ccc3c(c2)OCCO3)c1	776715410	UPBGGXNQBJCVJP-UHFFFAOYSA-N	440.499	1.168	50	20	IDGD	
CC(=NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)C1CCS(=O)(=O)CC1	777423449	SVGSKMIGCMWLBM-UHFFFAOYSA-N	427.548	1.402	50	20	IDGD	
COCC(=O)N1CCc2cc(NC(=O)C(=O)NNc3ccc(C(F)(F)F)cn3)ccc21	778723546	CRRZAQSPJRPRAJ-UHFFFAOYSA-N	437.378	1.718	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNc2ccc([N+](=O)[O-])cc2Br)ccc1F	779143998	AAYGNMKKGQCBAX-UHFFFAOYSA-N	433.215	1.901	50	20	IDGD	
O=C(NNc1ccccc1OC(F)(F)F)C1=NN([C@H]2CCS(=O)(=O)C2)C(=O)CC1	779208690	DIYHUBPMXBRZSR-JTQLQIEISA-N	434.396	1.194	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)/C=C\c3ccc(O)c(O)c3)cc2)CC1	779535873	FSHXDHAZPXPWGQ-OQFOIZHKSA-N	432.502	1.190	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NOCc1ccc(F)cc1Br	780913378	ZXCCGNMPVJGYHN-UHFFFAOYSA-N	445.270	1.842	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2cc(S(=O)(=O)NC3CC3)ccc2OC)cc1	783034581	CCITYJKJFRDMOC-UHFFFAOYSA-N	434.474	1.226	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ccc(F)cc2F)cc1S(=O)(=O)NC1CC1	783344766	LKFZNXQUNNEDSM-UHFFFAOYSA-N	440.428	1.496	50	20	IDGD	
CCC(C)(C)OCc1cccc(NC(=O)C(=O)NN[C@@]2(C)CCS(=O)(=O)C2)c1C	783426712	JXNLDNYKFLJUMQ-FQEVSTJZSA-N	425.551	1.837	50	20	IDGD	
O=C(NNc1ccc(OC(F)(F)F)cc1)C(=O)Nc1cnn(CCN2CCOCC2)c1	784802368	ZDBSJLRACWBDFL-UHFFFAOYSA-N	442.398	1.196	50	20	IDGD	
Cn1cnc2cc(NC(=O)C(=O)NNc3ccccc3S(=O)(=O)NC(C)(C)C)ccc21	784834032	RIBPAYKXNAXTHW-UHFFFAOYSA-N	444.517	1.732	50	20	IDGD	
CC(C)(C)OC(=O)Nc1ccc(NC(=O)C(=O)NNc2cccc(S(C)(=O)=O)c2)cn1	784841629	MXYLUHGHSITJJO-UHFFFAOYSA-N	449.489	1.914	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2cccc(C(F)(F)F)n2)cc1NS(C)(=O)=O	784952856	UEWFSIYTXJSSOC-UHFFFAOYSA-N	431.396	1.862	50	20	IDGD	
Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	785701618	LXZMPUQGEGBKPX-UHFFFAOYSA-N	446.221	1.716	50	20	IDGD	
N#C/C(=C\C1CC1)C(=O)OCC(=O)NCCN1C(=O)S/C(=C/c2cccnc2)C1=O	786674967	YTOKZLQBQQFXRO-BVXMOGEKSA-N	426.454	1.637	50	20	IDGD	
COC[C@@H](NC(=O)NNC(=O)c1csc(N2CCOCC2)n1)c1ccc(Cl)cc1	787378401	VNBLSGQECWSNFK-CQSZACIVSA-N	439.925	1.965	50	20	IDGD	
COc1ccc(OC)c([C@H]2C[C@H]2C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1	788085913	FKMHYHKHYRMARK-SJLPKXTDSA-N	447.513	1.519	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@H]2CCCN(c3ccccc3)C2)c1	789313363	BAMAUYNQNRGAHY-MRXNPFEDSA-N	430.530	1.951	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(C(N)=O)c(OC(C)C)c2)c1	789731138	AJVNXQHRPABKOK-UHFFFAOYSA-N	428.445	1.046	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccc3c2OCC[C@H]3N(C)C)cc1	789731261	CVLZUSUSVWNDIK-GOSISDBHSA-N	442.472	1.245	50	20	IDGD	
Cc1noc(-c2ccc(C(F)(F)F)cc2NC(=O)C(=O)NNC(=O)c2cccn2C)n1	789731466	IKNXNDQHZOMRJV-UHFFFAOYSA-N	436.350	1.802	50	20	IDGD	
O=C(NNC(=O)[C@H]1OCC[C@H]1c1ccccc1)C(=O)Nc1cccnc1Br	789810844	QWIPQXZLELNUEQ-JSGCOSHPSA-N	433.262	1.503	50	20	IDGD	
CC(=NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1)c1ccc(O)nn1	790144558	VDPKAQUZAAZWHW-UHFFFAOYSA-N	425.470	1.815	50	20	IDGD	
COc1cc(NNC(=O)C2CCN(S(=O)(=O)c3cn(C)c(C)n3)CC2)ccc1Cl	790181027	WGTHFSJLYRLRFT-UHFFFAOYSA-N	441.941	1.935	50	20	IDGD	
O=C(NNc1nc2ccccn2n1)C1CCN(C2=NS(=O)(=O)c3ccccc32)CC1	791243540	DNXOHOBFFFWHBA-UHFFFAOYSA-N	425.474	1.034	50	20	IDGD	
COc1c(NC(=O)C(=O)NNC(=O)CCCc2ccccc2)cc(Cl)cc1C(N)=O	793024844	GIWWQIIMFBDKHV-UHFFFAOYSA-N	432.864	1.556	50	20	IDGD	
CC(C)O[C@@H](C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1)c1ccccc1	794394572	ZQDOFNNECDKAHN-JOCHJYFZSA-N	438.528	1.758	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCC(Oc3ccc(C#N)cc3F)CC2)n1	796514409	KUDHDEYPAFKWCI-UHFFFAOYSA-N	431.493	1.696	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(S(=O)(=O)NCCC(C)C)cc2)n1	797371553	YSKJLXDYUBONHF-UHFFFAOYSA-N	447.517	1.114	50	20	IDGD	
COc1ccc(S(=O)(=O)NC(C)(C)C)cc1NC(=O)NNC(=O)c1cccc(C)n1	797629823	STSRDVXURFLHHW-UHFFFAOYSA-N	435.506	1.942	50	20	IDGD	
O=C(NNC(=O)c1[nH]nnc1-c1ccccc1)c1cccc(S(=O)(=O)N2CCCC2)c1	797701553	VBDOVBDCNGFQRK-UHFFFAOYSA-N	440.485	1.331	50	20	IDGD	
C[S@@](=O)C1(CNC(=O)NNC(=O)[C@H]2Cc3ccccc3CN2Cc2ccccc2)CC1	799368675	YKYJCCFRDQBMOU-PLTNMMHCSA-N	440.569	1.855	50	20	IDGD	
CCn1ncc2cc(C(=O)NNC(=O)CN(C)S(=O)(=O)c3ccc(C)cc3)c(C)nc21	799408260	RBZNDWPGHYWTSQ-UHFFFAOYSA-N	444.517	1.150	50	20	IDGD	
CN(C)c1ncn(-c2cccc(NC(=O)NNC(=O)COc3ccccc3[N+](=O)[O-])c2)n1	799416000	BEQPSIBTUIKRGV-UHFFFAOYSA-N	440.420	1.473	50	20	IDGD	
Cc1c([N+](=O)[O-])ccc(F)c1NC(=O)C(=O)NNC(=O)c1cc(-c2cccs2)[nH]n1	800624727	HLLZAMBLUMXMIR-UHFFFAOYSA-N	432.393	1.894	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1c(F)ccc([N+](=O)[O-])c1C	800625497	PJXFOZYNISCGMA-UHFFFAOYSA-N	436.421	1.929	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)N[C@@H]1CCCN(C(=O)Cc2ccccc2)C1	801005971	OVYURJMFLBZQOL-MRXNPFEDSA-N	443.529	1.042	50	20	IDGD	
COCCOc1cncc(C(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)c1	801192129	MDMNGBFRJBVMIL-UHFFFAOYSA-N	437.497	1.356	50	20	IDGD	
Cc1cc(=O)c(C(=O)NNC(=O)N=c2cc[nH]cc2)nn1-c1ccccc1C(F)(F)F	802029123	MQDJZUYIEYKDRY-UHFFFAOYSA-N	432.362	1.843	50	20	IDGD	
C[C@H]1NC(C(=O)NNC(=O)Nc2ccc(OC(F)F)cc2)=NN(c2ccccc2)C1=O	802045760	WPDOTCCYMJCBJC-LLVKDONJSA-N	432.387	1.779	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)CCNS(=O)(=O)c2ccc(C(C)=O)cc2)cc1	802060253	HFSFSICVRYYNDN-UHFFFAOYSA-N	434.474	1.419	50	20	IDGD	
CC1(C)CC(=O)c2cc(NC(=O)C(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)ccc2O1	806972068	FOGUHLMZVIJMAG-UHFFFAOYSA-N	426.385	1.738	50	20	IDGD	
CC(C)Cc1ccc([C@H](CNC(=O)NNC(=O)C(=O)Nc2ccccn2)N(C)C)cc1	807601936	QNFQPWAHMOGNBR-SFHVURJKSA-N	426.521	1.852	50	20	IDGD	
O=C(COC(=O)[C@@H]1C[C@H](c2ccccc2)OC1=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	808588921	LJEDXMLDNNLCTE-JKSUJKDBSA-N	427.369	1.203	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)N[C@H](C1CC1)C(F)(F)F	808869553	KPOGBPOACGJLHM-CQSZACIVSA-N	434.440	1.756	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2cccc3c2COC3=O)cc1	808911467	NPUZFABAHXLVEA-UHFFFAOYSA-N	432.458	1.139	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)OCC(=O)Nc2ccccc2SCC(N)=O)cc(C#N)n1C	809303546	PGCVZDWMAPHZCI-CHHVJCJISA-N	437.481	1.871	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)[C@@H]2CCN(c3ccccc3F)C2)ccc1Cl	809982983	WLIWSKOLRKFJSS-GFCCVEGCSA-N	440.884	1.414	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)CNS(=O)(=O)c2ccc(Cl)c(Cl)c2)cc1	810268478	UQNHWKJXNCUXHP-UHFFFAOYSA-N	427.269	1.605	50	20	IDGD	
O=C(CNS(=O)(=O)c1cccc(F)c1)NNc1ccc(S(=O)(=O)C(F)F)cc1	810346700	VVTPNOLWPFTBNG-UHFFFAOYSA-N	437.421	1.244	50	20	IDGD	
Cn1nc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)NC(C)(C)C)cc1C1CC1	810382614	HYVXLXASOSUNLR-UHFFFAOYSA-N	434.522	1.456	50	20	IDGD	
COc1ccc(Cn2cc(C(=O)NNc3ccc(S(=O)(=O)N(C)C)cc3)cn2)cc1	812726321	AXTVNZMDANFLOW-UHFFFAOYSA-N	429.502	1.947	50	20	IDGD	
O=C(NC[C@@H]1CCN(c2ccccc2F)C1)NNC(=O)c1csc(N2CCOCC2)n1	812866995	BKWRZDOANCVDLP-AWEZNQCLSA-N	448.524	1.589	50	20	IDGD	
Cc1cc(Cl)cnc1NC(=O)C(=O)NNC(=O)COc1ccc(Br)cc1	812979119	AJSRIWQSPPNTES-UHFFFAOYSA-N	441.669	1.971	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccccc2OCC2CC2)cc1	813033347	ORWXJOAMZLGNGT-UHFFFAOYSA-N	432.502	1.808	50	20	IDGD	
CC(=NNC(=O)C1=S=C2CC[C@@H](C)CC2=C1)c1ccc(S(=O)(=O)CC(N)=O)cc1	814759751	NEGPABKPCKLFEF-GFCCVEGCSA-N	433.555	1.624	50	20	IDGD	
CC(=NNC(=O)c1cc(S(=O)(=O)NCc2ccccc2)ccc1O)c1cnnn1C	814778916	XVSRXJVGKUEXBM-UHFFFAOYSA-N	428.474	1.153	50	20	IDGD	
Cc1cccnc1NNC(=O)C(=O)Nc1ccc([N+](=O)[O-])c(I)c1	815619274	IRDYQMGLHJRCTK-UHFFFAOYSA-N	441.185	1.985	50	20	IDGD	
CNC(=O)Oc1cccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)c1	815626115	WBMIAZMYSGYXAY-NSHDSACASA-N	434.836	1.612	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2cnc(C(F)(F)F)c(C#N)c2)cc1	816596961	YPDLLYKQQLHWPA-UHFFFAOYSA-N	427.364	1.842	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCc2ccc(Cn3cncn3)cc2)cc(OC)c1OC	838656400	LNFKRFNHUVPJHW-UHFFFAOYSA-N	440.460	1.496	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)CN1C(=O)NC2(CCC(CC)CC2)C1=O	869762175	HFISUYMISXSBCY-UHFFFAOYSA-N	446.504	1.502	50	20	IDGD	
CCOc1ccccc1N1C[C@H](C(=O)NNC(=O)CCN2C[C@H](C)O[C@@H](C)C2)CC1=O	912919862	RSOGCVHDKCPHEC-YESZJQIVSA-N	432.521	1.085	50	20	IDGD	
COc1cccc(C[C@H](C(=O)NNC(=O)c2cc(-c3ccccc3)on2)n2nnnc2C)c1	915686217	YLHMDAWRXHGJEA-LJQANCHMSA-N	447.455	1.890	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)CNS(=O)(=O)c2cccc(C(F)(F)F)c2)cc1	915771666	NILICWQHAFLVHM-UHFFFAOYSA-N	445.419	1.519	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCc2c[nH]c3ccccc23)c1	915885036	GCZPYPUSIMHRIU-UHFFFAOYSA-N	429.502	1.605	50	20	IDGD	
O=C(NCCn1ccnc1)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	915905473	RTRDCWSXMDDKJT-UHFFFAOYSA-N	442.501	1.006	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NCCCN2C(=O)NC3(CCCCC3)C2=O)cc1C	916268664	BAVUXZWVMKUIPQ-UHFFFAOYSA-N	445.520	1.657	50	20	IDGD	
NS(=O)(=O)c1ccc(OCCSCC(=O)NNC(=O)c2cccc(Cl)c2)cc1	916733672	CWIKBYNUTVBMKC-UHFFFAOYSA-N	443.934	1.561	50	20	IDGD	
O=C(C=C(C1CC1)C1CC1)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	917541277	BTJRTYYOCUPBFD-UHFFFAOYSA-N	447.557	1.534	50	20	IDGD	
CN(C)[C@H](CNC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)c1ccc(F)cc1	918090520	GOHWKEIUTZNKDJ-QGZVFWFLSA-N	426.452	1.320	50	20	IDGD	
CC(=O)Nc1ccc(O)c(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1	919810451	GRGYXGDMAOXFOK-UHFFFAOYSA-N	446.485	1.210	50	20	IDGD	
Cc1cccc(N2CCN(S(=O)(=O)CC(=O)NNC(=O)NC3CCCCC3)CC2)c1	919835523	RSOHYNXWBJIBDP-UHFFFAOYSA-N	437.566	1.110	50	20	IDGD	
CC(=O)N/C(=C/c1ccccc1)C(=O)NNC(=O)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	920435484	HOBLSSDOQUQGQZ-CLEQQJOVSA-N	430.505	1.958	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)c1ccccc1F)C(=O)NNC(=O)NCc1ccco1	920856393	FQCQYAGBGIMCHT-AWEZNQCLSA-N	444.510	1.349	50	20	IDGD	
CCS(=O)(=O)c1cccc(NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1	1320247524	SKUXQWAHBWNJIU-UHFFFAOYSA-N	432.506	1.340	50	20	IDGD	
Cn1nc2ccccc2c1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	1320538251	QDPLDXIRZVYPKU-UHFFFAOYSA-N	427.486	1.433	50	20	IDGD	
CCCn1nc(C(=O)NNS(=O)(=O)c2c[nH]c(C(F)(F)F)c2)c2ccccc2c1=O	1344043096	VPFCKXCSSAEJOD-UHFFFAOYSA-N	443.407	1.777	50	20	IDGD	
CC(C)CNC(=O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCBr)C2	1778112801	ZKVFNRBTNBZQQO-RDTXWAMCSA-N	432.359	1.058	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4c(c3)NC(=O)CO4)C2)C1	1778575119	OZDUBWCEZXZOEK-NRFANRHFSA-N	447.564	1.313	50	20	IDGD	
C[C@@H](C(=O)N1CC[C@@]2(CN(C(=O)CCBr)CCO2)C1)n1ccccc1=O	1779267366	ZTGZPAGYIRSAPG-KBXCAEBGSA-N	426.311	1.024	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccc(O)c([N+](=O)[O-])c1)CCO2	1779299982	IFIXWVOXCVGDAA-LJQANCHMSA-N	437.525	1.595	50	20	IDGD	
C[C@@H](C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CO[Si](C)(C)C)C2)n1ccccc1=O	1779526804	GIDWRVLFAVYHFT-NJNPRVFISA-N	449.624	1.775	50	20	IDGD	
C[C@H](Nc1ccccn1)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@](C)(Cl)CCl)C2)C1	1781230336	RACVGIIKROAUJY-ZOCIIQOWSA-N	429.348	1.948	50	20	IDGD	
O=C(c1cnc(Cl)s1)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781332339	XPPSQPXFLLLDIU-NOZJJQNGSA-N	426.695	1.931	50	20	IDGD	
COc1ccc(CC(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](F)Br)C3)C2)cc1F	1781335630	XXNHWNATFXISLP-WMZOPIPTSA-N	447.276	1.897	50	20	IDGD	
C[C@H](C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Br)C2)n1ccnn1	1781549342	AIPUBNUEEMGVPZ-NFFDBFGFSA-N	432.294	1.044	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](CC)NC(C)=O)C2	1781897907	UQBHRNGTXBBXPB-WFXMFSGNSA-N	446.386	1.589	50	20	IDGD	
Cn1cc2cc(C(=O)N3CC[C@]4(C3)CN(C(=O)[C@H](F)Br)CCO4)ccc2n1	1782244644	GGKRMTKOODWBQE-YJBOKZPZSA-N	439.285	1.707	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)N1CC[C@]2(CN(C(=O)[C@H](C)CBr)CCO2)C1	1782698055	FUMTXLPIMZROMR-PBFPGSCMSA-N	435.315	1.409	50	20	IDGD	
O=C(c1ncon1)N1CCO[C@]2(CCN(C(=O)[C@H](Br)Cc3ccccc3)C2)C1	1783022267	JSGFDCVQHNAKGI-BEFAXECRSA-N	449.305	1.519	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)CCO2)C1	1783536228	FQNJCUVEMVZKOF-GTNSWQLSSA-N	444.257	1.961	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)COc3cccc(Cl)c3)CCO2)C1	1783869365	PBHJHNZRSVSWIU-VQIMIIECSA-N	431.316	1.803	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@]1(F)CCCCC1(F)F)CCO2	1783934361	FPLDERKSGJWNPG-OALUTQOASA-N	448.486	1.107	50	20	IDGD	
Cc1nccn1CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]2C1	1783974619	SNLXMYPAMRFEOQ-OEAJRASXSA-N	427.343	1.202	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCN3CCCCC3)[C@H]2C1	1786574821	IZJQAKUXACJAAQ-OWSLCNJRSA-N	444.414	1.873	50	20	IDGD	
O=C(CC(=O)Nc1ccc(F)cc1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Cl)C[C@@H]21	1789682140	ZEOFZTZXFDHGAJ-FGVQXAILSA-N	429.851	1.668	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCCn3ccnc3)C[C@@H]21	1789872223	DRJNTTKBRVBFRH-IUVQAAGXSA-N	431.364	1.879	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)c3ccccc3Cl)C[C@@H]21	1791256416	QFKPFFMYEAYJBF-FSXCVOIBSA-N	445.343	1.607	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccnc1-c1ccccc1)C2)[C@H](O)CCl	1792978512	XHDUGYDFDRLCFG-UKBAYJJMSA-N	429.904	1.552	50	20	IDGD	
Cc1onc(-c2ccccc2)c1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2	1794610582	MRQVTRLAQLYBAZ-KYHPRHEASA-N	433.892	1.453	50	20	IDGD	
COC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1795516654	MOVUISBFBBPGTG-XGUBFFRZSA-N	445.944	1.710	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Cl)C1CC1	1796361868	WZZUAERSGJJNCQ-AEKWLRTRSA-N	447.935	1.804	50	20	IDGD	
C=CCCc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CO[Si](C)(C)C)c(O)n1	1797954568	WPNQNKJPWVYQQL-CWPLJXCYSA-N	447.608	1.961	50	20	IDGD	
CCc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)CBr)C3)n(C)n1	1798165217	QWPPWYGOVGMKGT-JFILPPLUSA-N	427.343	1.217	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc([N+](=O)[O-])c(OC)c1)C2	1799271022	IUWCRAKUDOBSTL-UMPJEAMMSA-N	425.869	1.824	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cn1nnc3ccccc31)C2	1799273674	FZRZJDKPTLQIFP-JBYDNAENSA-N	440.331	1.257	50	20	IDGD	
COc1ccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Br)cc1	1799346797	AIXOGJSXPZFJQD-DLTLXFJOSA-N	429.286	1.518	50	20	IDGD	
CCOc1cccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCBr)C3)c1O	1799754440	NJJACTYNWYNHSE-FVCICTRLSA-N	441.322	1.779	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1cnc2ccc(F)cn12	1800063964	DYWWEWBODFMCAO-OWLDWWDNSA-N	443.248	1.367	50	20	IDGD	
O=C1CCc2ccc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)C(Cl)Cl)C4)cc2N1	1800102971	XCQSPTNFXYVSOS-YWVIFJGQSA-N	426.300	1.578	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(-c3cc[nH]n3)cc1)C2	1800976882	CCSHZGISFZWGTJ-ZMMAXQRCSA-N	432.908	1.534	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cc(F)ccc1OC)C2	1800982196	ZHMQKKCNZATATN-QHHYFVSCSA-N	428.888	1.220	50	20	IDGD	
O=C1C[C@H](C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](Br)Cc2ccccc2)C3)CN1	1801678845	IWSUVERGOXPDBH-JCECYMMASA-N	448.361	1.767	50	20	IDGD	
C=CCNC(=O)/C=C\C(=O)NC[C@H]1CCN(C(=O)CO[Si](C)(C)C)[C@@H]1c1cccnc1	1802480698	DLISUNSGSSRZKW-YYNCDVECSA-N	444.608	1.797	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@H]1CCN(C(=O)COCCO)[C@H]1c1cccnc1	1803014625	JMHGFASUWZYVFM-UNEWFSDZSA-N	428.327	1.127	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cccc3c[nH]nc23)[C@H]1c1cccnc1)[C@@H](O)CCl	1803138822	FQELDGUTMGEHPC-IEZWGBDMSA-N	427.892	1.877	50	20	IDGD	
COc1cc(C(=O)NC[C@@H]2CCN(C(=O)CO[Si](C)(C)C)[C@H]2c2cccnc2)n(C)n1	1804923574	LJKRZDVUFBGJPA-JXFKEZNVSA-N	445.596	1.995	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2ccccc2O)[C@@H]1c1cccnc1	1805205735	FASZSKXYJBWLLK-VGSWGCGISA-N	439.516	1.480	50	20	IDGD	
O=C(CC(F)(F)C(=O)O)NC[C@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1	1808286963	FTUVIROLNMHOIO-DOMZBBRYSA-N	448.264	1.982	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC2(CCCN(C(=O)c3ocnc3C)C2)CC1	1808587439	ZUBNXGGEDKJDHY-PCLIKHOPSA-N	440.504	1.962	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)[C@@H]3Cc4ccccc4N3)CC2)C1	1809980642	YVOPZGMWCMQVRB-QFIPXVFZSA-N	447.344	1.248	50	20	IDGD	
Cc1n[nH]c(C)c1C(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1810652071	KPVLOFGRSJQDLC-DYESRHJHSA-N	441.536	1.114	50	20	IDGD	
CCCC(=O)N[C@H](C)C(=O)N1CC[C@H](CNC(=O)[C@H](Cl)COC)[C@H]1c1cccnc1	1813031092	JIBPYHLBRDULQR-KLICCBINSA-N	438.956	1.646	50	20	IDGD	
O=C1CCc2ccc(C(=O)N3CCCC[C@@H]3c3cc(NC(=O)[C@H](O)CCl)n[nH]3)nc2N1	1814870498	USDZQMGYNLEBJO-HUUCEWRRSA-N	446.895	1.595	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc3c(n2)OCCO3)[nH]n1)[C@@H](O)CCl	1814870545	WBPVCBZORGPWHP-KGLIPLIRSA-N	435.868	1.482	50	20	IDGD	
CC[C@H](C)[C@@H](O)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1815253856	SXOLELFMMJANNT-ULFGMLNVSA-N	443.508	1.121	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](CC)NC(N)=O)sc2C1	1817023835	KCVASMOJFGMGIV-KXUCPTDWSA-N	446.371	1.676	50	20	IDGD	
COCCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[nH]n1	1817038851	GHMPTDUROZGURY-OHHQFBAHSA-N	429.481	1.572	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)C2(F)CCC2)[nH]n1	1819404500	NXKSZEUWKFTXGY-OAHLLOKOSA-N	429.456	1.606	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccnn2)n[nH]1	1819714008	CBZOQORYXVCORI-VEMXNMSTSA-N	449.475	1.640	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)/C=N/N3CCCCC3)sc2C1	1819780847	INWDJCWYFURTMB-HVHIRKTFSA-N	427.958	1.781	50	20	IDGD	
CCS(=O)(=O)CC(=O)N[C@H]1CCc2nc(NC(=O)[C@@](C)(Cl)CCl)sc2C1	1822861135	WGOKOWMCTMFRAF-VFZGTOFNSA-N	442.390	1.726	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](O)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](F)Cl)CC2	1823565642	DLCIBEQXVAVPSX-LCWDIZFYSA-N	436.893	1.433	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)[C@@H]2CCCCO2)CC1	1823818117	KXDHOIIGJDWXIA-RTWAWAEBSA-N	428.338	1.169	50	20	IDGD	
COc1ccc([C@H](O)C(=O)N2CCC([C@H]3CCCCN3C(=O)[C@@H](O)CCl)CC2)cc1	1824176440	OENAZFDFMYNUET-AABGKKOBSA-N	438.952	1.948	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](C)Cn1cncn1)CC2	1825640578	CYMNJGVFXBVNEG-GARJFASQSA-N	441.355	1.766	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)Cc1ccc3ncnn3c1)CC2	1826005945	BQLXTLIIQRMFBD-STQMWFEESA-N	448.936	1.594	50	20	IDGD	
C=C[C@@H](O)C(C)(C)C(=O)N[C@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1	1826087506	FXYAGJITTNTOSH-SWLSCSKDSA-N	437.566	1.001	50	20	IDGD	
COc1ccnc(C(=O)N[C@@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)c1	1826087638	HAQHUGSMAAVJCI-GFCCVEGCSA-N	446.533	1.146	50	20	IDGD	
CCc1ccnc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)c1	1827052728	BWZBOSDGDRAYFL-HSZRJFAPSA-N	449.360	1.871	50	20	IDGD	
O=C(c1cccc(O)n1)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827055882	IMJHCDZCIMKDIE-FQEVSTJZSA-N	437.305	1.014	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CCC(F)(F)C1)CCO2	1829657814	CEEHCUBCQHGUSL-HEHGZKQESA-N	439.297	1.662	50	20	IDGD	
Cc1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)c1F	1830101953	YYGFLUKHSJXUJS-QAPCUYQASA-N	447.276	1.895	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H](C)NS(=O)(=O)CC)CC1	1830302875	JXNLGYOGCPKBCC-HYVNUMGLSA-N	436.018	1.951	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@](C)(O)C(F)(F)F)C2)C1	1830358163	MMHKEFKOHJCKQJ-JKSUJKDBSA-N	430.851	1.021	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3noc4c3CCCC4)C2)C1	1830358459	VQKJHIPUCCMQDO-OAQYLSRUSA-N	439.940	1.888	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CC[C@H](C(=O)OC)C1)CCO2	1830714242	NQRXQANBGOBSLH-NARAOEGZSA-N	430.929	1.050	50	20	IDGD	
O=C([C@@H](O)CCl)N1CCC([C@@H]2CCCCN2C(=O)c2nc3ccc(F)cn3n2)CC1	1831045557	IWYZJFNNJRQBDW-HOTGVXAUSA-N	437.903	1.701	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CC(c3ccccc3)=NO1)CCO2	1831263732	VZSFJPRBGDUWPP-KPLVRAHFSA-N	449.935	1.653	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4ccccn4n3)C2)C1	1831647442	VBJSDVGEEYFZTH-LAUBAEHRSA-N	434.924	1.812	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4cn[nH]c4cn3)C2)C1	1831649840	BZUJVZTVQBHTRP-FOIQADDNSA-N	435.912	1.435	50	20	IDGD	
C[C@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1)N1C[C@H]2C[C@H]2C1	1831873743	VUHWISZSWJRMIL-AYWYSENESA-N	447.624	1.319	50	20	IDGD	
O=C(Cc1cc(F)ccc1Cl)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1	1832264594	IPGKJRWDBKKEQD-VQIMIIECSA-N	449.306	1.078	50	20	IDGD	
CCC(=O)N[C@@H](C)C(=O)NC1CCN(C2CCN(C(=O)[C@H](C)Br)CC2)CC1	1833423128	ZGLQTUYVKQEISG-KBPBESRZSA-N	445.402	1.256	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnc(OCC)cn3)CCO2)C1	1833430066	OXWKOOHMJNXQAD-FOIQADDNSA-N	440.928	1.353	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)c1ccccc1)CCO2	1835298378	BUEAOULLQNZQQT-CTNGQTDRSA-N	436.581	1.028	50	20	IDGD	
O=C(CS[C@H]1CCCCO1)NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1835757078	NMLONGMTOBAICM-MJGOQNOKSA-N	448.029	1.418	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc4n(n3)CCCO4)CCO2)C1	1836966546	DBTJOJVZQQEWHO-FOIQADDNSA-N	440.928	1.143	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)/C(C)=C/c3ccc(C)o3)CCO2)C1	1837582536	OUBDJAIQUGTTTH-OWDDFCINSA-N	440.924	1.702	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)NC(=O)OC(C)(C)C)C2)C1	1839148713	HACTWIDWFJQNAH-QEEYODRMSA-N	447.960	1.373	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(C#N)cc3)C2)C1	1839154217	GYMXJQXFTHGEMS-WOJBJXKFSA-N	440.327	1.865	50	20	IDGD	
CCc1ccnc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)c1	1840031730	APFHRIKLGOPVGS-IFXJQAMLSA-N	440.338	1.497	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)Oc1cccnc1)CCO2	1840449791	KMHPGUGXHFUJRA-MMOPVJDHSA-N	439.940	1.713	50	20	IDGD	
COc1cccc(Cl)c1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1840736990	OVXJVVSAGZYRQG-CRAIPNDOSA-N	435.279	1.953	50	20	IDGD	
Cc1cc(F)ccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)Br)C2)C1	1840778647	FMZJUPMMJUUIGP-AUUYWEPGSA-N	443.313	1.988	50	20	IDGD	
COCc1c[nH]c(C(=O)N2CC3(CCCN3C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)c1	1843416416	HIJBICOQWVFXND-ZVHZXABRSA-N	426.477	1.112	50	20	IDGD	
C[C@H](NC(=O)c1ccc(F)cc1)C(=O)N1CC2(CCCN2C(=O)CO[Si](C)(C)C)C1	1844378880	UCHTVUMALIBVJQ-HNNXBMFYSA-N	435.572	1.999	50	20	IDGD	
COc1cc(C(=O)N2CCCC23CN(C(=O)CCBr)C3)c([N+](=O)[O-])cc1O	1844737081	VMKCJMAMCBPQFT-UHFFFAOYSA-N	442.266	1.911	50	20	IDGD	
O=C(Nc1ccc(C(=O)N2CCCC23CN(C(=O)[C@@H](O)CCl)C3)cc1)c1ccco1	1845553379	NLRQWUMOUSMCGU-INIZCTEOSA-N	431.876	1.949	50	20	IDGD	
COc1cc(C(=O)N2CC3(CCCN3C(=O)[C@@H](C)Br)C2)c([N+](=O)[O-])cc1O	1846177674	CLGGKFFEHZTANO-SNVBAGLBSA-N	442.266	1.909	50	20	IDGD	
CN(CC(=O)N1CC2(CCCN2C(=O)C2CC(C)(C)C2)C1)NC(=O)NCc1ccccc1	1846419010	QLZUONFQQUAWEE-UHFFFAOYSA-N	441.576	1.972	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Cc2csc(N3CCCC3=O)n2)cc(OC)c1OC	21189861	JBVPLESNHJAOHB-UHFFFAOYSA-N	434.474	1.299	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CCn2c(=S)[nH]c3ccccc3c2=O)cc1OC	26961489	CTAIMIWVYZUOTQ-UHFFFAOYSA-N	428.470	1.928	50	20	IDGD	
O=C(O)COc1ccc(S(=O)(=O)NNC(=O)c2cccc(OC(F)F)c2)cc1F	728510805	VBHNFUBWPCWHLB-UHFFFAOYSA-N	434.348	1.514	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)[C@H]2CC(=O)N(CC(F)(F)F)C2)c1	728527449	JFXIIRFZNYOPMJ-QMMMGPOBSA-N	438.200	1.630	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)c2ccc(NS(C)(=O)=O)cc2)c1	728529732	MJVQIWMVBCNZGG-UHFFFAOYSA-N	442.291	1.904	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CCc2ccccc2O)cc1S(=O)(=O)NC1CC1	730034087	REUUVAWVASYBAS-UHFFFAOYSA-N	433.486	1.235	50	20	IDGD	
COc1ccc(-c2ccc(C(=O)NNC(=O)N[C@H]3CCS(=O)(=O)C3)c(F)c2)c(F)c1	730534056	JVLMJSHOQGZYQZ-LBPRGKRZSA-N	439.440	1.772	50	20	IDGD	
O=C1NC(=O)C2(CCC(C(=O)NNC(=O)c3ccc(F)cc3Br)CC2)N1	731472041	JERSVJSTDLWVFF-UHFFFAOYSA-N	427.230	1.118	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)CCNC(=O)N1CCc2ccccc2C1	731866303	LACRMZMEFOWYCE-OAHLLOKOSA-N	428.464	1.898	50	20	IDGD	
Cc1nn(-c2ccccc2)c2sc(C(=O)NNC(=O)NCCCS(C)(=O)=O)cc12	732891285	BVBNVCRNSYMFFJ-UHFFFAOYSA-N	435.531	1.774	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)/C(=C\c1cccnc1)NC(=O)c1ccccc1	733123987	MZWTWRBRBLNGQC-DOIQENQNSA-N	444.447	1.840	50	20	IDGD	
CC(C)(C(=O)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1)S(C)(=O)=O	733142937	ZBEVSJRXUZBTKG-IBGZPJMESA-N	429.542	1.584	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)[C@]2(O)CCN(Cc3ccccc3)C2)c2ccccc2c1=O	733885276	WXSIWZOLAMIIPG-DEOSSOPVSA-N	449.511	1.375	50	20	IDGD	
CCCn1nc(C(=O)NNS(=O)(=O)c2c(C)nn(C(C)C)c2C)c2ccccc2c1=O	734420148	WWPXZKLMDYKMFM-UHFFFAOYSA-N	446.533	1.824	50	20	IDGD	
CCc1ccc([C@H](C)C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)cc1	735117579	YGBPRJRGWANATQ-INIZCTEOSA-N	431.562	1.827	50	20	IDGD	
O=C(Oc1ccc([N+](=O)[O-])cc1Br)C1=CN2CCS(=O)(=O)N=C2C=C1	739301697	KUSIYUXEPLRGJH-UHFFFAOYSA-N	428.220	1.760	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2ccc(Cl)cc2OC)ccc1OC	739670658	MYXHZTOUQJHXIZ-UHFFFAOYSA-N	428.850	1.767	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)N[C@@H](C)[C@@H]1CN(Cc2ccccc2)CCO1	741266680	LXEKYSRWYOLMMQ-LPHOPBHVSA-N	436.516	1.876	50	20	IDGD	
CC(C)(C)C(=O)Nc1ccc(F)c(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c1	742480649	MCUWAFRYOJYTRP-UHFFFAOYSA-N	425.424	1.861	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)CCCNC(=O)c2ccc(F)cc2F)c1	744519050	XNXVBEYKXALZOU-UHFFFAOYSA-N	444.394	1.351	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1ccc(Br)o1	744619202	KCNGYDUQOKJBRC-UHFFFAOYSA-N	430.280	1.820	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)C2=NN(Cc3ccccc3)C(=O)CC2)cc1	744783969	MXUMVRIAOBTGCH-UHFFFAOYSA-N	433.424	1.041	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)c2cc(Br)cnc2N(C)C)c1	745025270	FXUYXNDVETXABT-UHFFFAOYSA-N	435.278	1.837	50	20	IDGD	
CCN1CCN(S(=O)(=O)c2ccc(Cl)c(C(=O)NNC(=O)NC(C)C)c2)CC1	745139838	RQMARTFJVMSPOH-UHFFFAOYSA-N	431.946	1.019	50	20	IDGD	
Cc1cc(N2CC[C@H](NC(=O)NNC(=O)c3ccc(OCCC(C)C)cc3)C2=O)n(C)n1	745904506	BWSCDGHIVNNFGK-SFHVURJKSA-N	442.520	1.903	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)COc2cccc(NC(=O)c3ccco3)c2)c1	746300527	WNZSQMJYDOTTGR-UHFFFAOYSA-N	437.412	1.725	50	20	IDGD	
COc1cccc(C(=O)N2CCN(CC(=O)NNC(=O)c3ccc(C)cc3)CC2)c1OC	746853820	DSOXWXWUFXJJHI-UHFFFAOYSA-N	440.500	1.231	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)Cn2nnc(-c3ccc(Cl)cc3)n2)o1	747212295	LNNPXTWVAQJOOA-UHFFFAOYSA-N	431.884	1.890	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)CNC(=O)NCc1ccc([N+](=O)[O-])cc1	748212661	SLXXCZLXFMALND-GFCCVEGCSA-N	433.396	1.148	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN(C(=O)c2ccc(Cl)c(Cl)c2)C1)C(=O)N1CCCC1	748240807	KSOMXZGYSMTCFX-CYBMUJFWSA-N	441.315	1.615	50	20	IDGD	
Cc1cc(Br)ccc1NNC(=O)[C@H](C)NS(=O)(=O)c1c(C)nn(C)c1C	748736904	KBHMIGHGHHBVAV-NSHDSACASA-N	444.355	1.918	50	20	IDGD	
CC(C)S(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)c2ccccc2F)cc1F	749749775	CLZKFHVYDRQIAS-UHFFFAOYSA-N	433.458	1.738	50	20	IDGD	
CC(C)N1C[C@H](NC(=O)NNC(=O)[C@H](C)Oc2cccc(Br)c2)CC1=O	750644315	QCLXWSVPGLWCLT-WCQYABFASA-N	427.299	1.556	50	20	IDGD	
CCOc1ccc(C(=O)NNS(=O)(=O)c2cc(C(=O)O)cc(F)c2C)cc1OC	751264658	ZDPCGJYZURLHGA-UHFFFAOYSA-N	426.422	1.863	50	20	IDGD	
COc1cc(NC(=O)CNC(=O)NNC(=O)c2cc(Br)c[nH]2)cc(OC)c1	751999799	NXLWHFOWXXOFSJ-UHFFFAOYSA-N	440.254	1.377	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)c2cc(Cn3cc(Br)cn3)on2)cc1	752610919	HPFUNEMKWXQXDY-UHFFFAOYSA-N	433.266	1.863	50	20	IDGD	
CCCC(CCC)C(=O)NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1	753657532	VIRQLLYVBBKFGS-UHFFFAOYSA-N	438.594	1.665	50	20	IDGD	
O=C(CCCc1ccccc1)NNC(=O)NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1	754186261	GUZMNQWCKMYOEL-UHFFFAOYSA-N	434.474	1.722	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)Nc2ccccc2C(=O)N2CCN(C)CC2)c1O	755623172	OWQCOIGBSFYNCQ-UHFFFAOYSA-N	427.461	1.255	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccc(C(=O)OC)cc2)c1	755828955	TXXWAPFZRKUEIG-UHFFFAOYSA-N	448.501	1.970	50	20	IDGD	
O=C(CN(Cc1ccccc1O)C[C@@H]1CCCO1)NNC(=O)c1cccc([N+](=O)[O-])c1	756337960	ZUWTWMKARZMIAR-SFHVURJKSA-N	428.445	1.743	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)Nc1cccc(C(=O)NCCC(N)=O)c1	756395726	YYCPGPYXQIFVKO-UHFFFAOYSA-N	445.501	1.245	50	20	IDGD	
COCCS(=O)(=O)c1ccc(NC(=O)NNC(=O)COc2ccccc2F)cc1	756549690	GTNSYBBAUWWUOY-UHFFFAOYSA-N	425.438	1.478	50	20	IDGD	
Cn1cc(NC(=O)NNC(=O)c2nnc(O)c3ccccc23)cc(Br)c1=O	757689197	JCSKFUZAPNSFFY-UHFFFAOYSA-N	433.222	1.263	50	20	IDGD	
O=C(Cc1nn2c(C3CCCCC3)nnc2s1)NN=C1CCC2(CC1)NC(=O)NC2=O	758101019	WXJWTAHJQAPVGD-UHFFFAOYSA-N	444.521	1.400	50	20	IDGD	
O=C(CCCOc1ccc2c(c1)OCO2)N1CCN(S(=O)(=O)CBr)CC1	758527957	MXIAHPVSWGWSPX-UHFFFAOYSA-N	449.323	1.401	50	20	IDGD	
CC(C)(C)OC(=O)NCC1(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)CC1	759377051	FOKRWEZSJYKJDD-UHFFFAOYSA-N	425.511	1.046	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNS(=O)(=O)c1ccc(S(C)(=O)=O)c(F)c1	760339953	PJSLLBXYYXQSCP-UHFFFAOYSA-N	436.870	1.515	50	20	IDGD	
Cc1c(NC(=O)CSCC(=O)NNc2ncc(F)cn2)c(=O)n(-c2ccccc2)n1C	760907801	ZXJHDNQVYCZICY-UHFFFAOYSA-N	445.480	1.229	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)c1ccc2c(c1)C[C@@H](C)N2S(C)(=O)=O	761635532	CETSDGYJDJMXAL-CYBMUJFWSA-N	449.554	1.959	50	20	IDGD	
CC(C)OCCCn1c(NNC(=O)c2cc3n(n2)CCCO3)nc2ccccc2c1=O	761890697	QKHHRHFCKSAZBP-UHFFFAOYSA-N	426.477	1.948	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(OC(F)(F)F)cc1Br)c1cnccn1	762467169	OIQFFTLHKQNBGF-UHFFFAOYSA-N	441.185	1.761	50	20	IDGD	
CCOC(=O)C(C)(C)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	762682267	TWXHJDCTSCIOQQ-UHFFFAOYSA-N	425.507	1.212	50	20	IDGD	
CSc1ccc(C(C)=NNC(=O)CSc2nn(C)c(=O)n(C)c2=O)c(Cl)c1	763359542	PCLQWUHWFMCMJZ-UHFFFAOYSA-N	427.939	1.487	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cc(Cl)c(N)c(Cl)c2)cc1	763462226	ILVSGDKPKXKLOH-UHFFFAOYSA-N	445.328	1.966	50	20	IDGD	
CCN1C(=O)CCc2cc(NC(=O)C(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)ccc21	763468448	KLUGNVMYYYUWBM-UHFFFAOYSA-N	425.401	1.294	50	20	IDGD	
Cc1cccc(NC(=O)C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1F	763509345	SGYKEUYZGISQPY-UHFFFAOYSA-N	448.476	1.318	50	20	IDGD	
CC(C)CNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2O)cc1Cl	763528601	QANRPCJAIYNECJ-UHFFFAOYSA-N	432.864	1.831	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cccnc2N2CCCCC2)cc1OC	763550322	KDQMLSCTMMEYHL-UHFFFAOYSA-N	427.461	1.489	50	20	IDGD	
COc1cc(OC)c(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1Cl	763570842	IUZLLHFNXLOEQR-INIZCTEOSA-N	435.820	1.283	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)Nc1ccc(Cl)c2cccnc12	763571067	KHCHKCRDJGBHPM-MRXNPFEDSA-N	426.816	1.814	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2ccc(N3CCOC[C@H]3C)cc2)c1	763645109	QEGUHWVFFMCHOW-QGZVFWFLSA-N	440.500	1.693	50	20	IDGD	
O=C(NNC(=O)c1cccc(Cl)c1)C(=O)Nc1ccc(F)c(-n2nnnc2C2CC2)c1	763747166	AAPQTJLSYBCTAG-UHFFFAOYSA-N	443.826	1.732	50	20	IDGD	
COCCOC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2cccc(N(C)C)c2)c1	763754038	KNURTLNOVCZVDA-UHFFFAOYSA-N	443.460	1.347	50	20	IDGD	
CC(=O)N(Cc1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)cc1)C1CC1	763812597	HHMJZTHDXPOCIE-UHFFFAOYSA-N	449.467	1.234	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)cn1	763849307	KWCSRXHECNGDSX-OAHLLOKOSA-N	430.461	1.277	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccccc1O[C@@H]1CCOC1	763866628	XBJRFUFOKRHXPR-ZIAGYGMSSA-N	431.420	1.547	50	20	IDGD	
COC(=O)[C@@H](C)Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)cc1	763872275	MANDZUYYIDTCHB-UONOGXRCSA-N	445.447	1.731	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)N1C[C@H]2CCCN2c2ccccc21	763873425	STRCMZPJDKQEOW-GOEBONIOSA-N	426.448	1.756	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)on1)C(=O)Nc1ccc(N2CCOC2=O)cc1	764004173	TVZMKPXNAOVBEP-UHFFFAOYSA-N	435.396	1.698	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)Nc1cccc(-c2nccn2C)c1	764005368	ZRBTYFLELWYYEV-UHFFFAOYSA-N	445.277	1.588	50	20	IDGD	
O=C(Cc1ccsc1)NNC(=O)C(=O)Nc1ccc2c(c1)C(=O)N(CC1CC1)C2=O	764024552	HFRASGMLFAGYLN-UHFFFAOYSA-N	426.454	1.083	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc(N2CCSCC2)cc1C	764040731	KRHYENRROVDLAL-UHFFFAOYSA-N	428.514	1.957	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccccc1N1C[C@@H](C)O[C@H](C)C1	764041612	YFELIGKZRUZPFJ-HUUCEWRRSA-N	426.473	1.709	50	20	IDGD	
COc1cc(C(=O)N(C)C)ccc1NC(=O)C(=O)NNC(=O)c1ccc2ccccc2c1	764067166	OZKJKFYECXUMHN-UHFFFAOYSA-N	434.452	1.950	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)OC(C)(C)C)cc2F)c1O	764130903	KWHHJRDTNXLXGH-UHFFFAOYSA-N	447.419	1.895	50	20	IDGD	
CN(C)C(=O)C[C@H]1CN(C(=O)C(=O)NNC(=O)CCc2ccco2)c2ccc(Cl)cc21	764172248	SNWSHALIGBGASA-ZDUSSCGKSA-N	446.891	1.622	50	20	IDGD	
N#Cc1c(F)cccc1-n1ccc(NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)n1	764241888	NTMMIHDITKXIME-UHFFFAOYSA-N	445.414	1.624	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)C(=O)Nc1ccc(CC(=O)N2CCc3ccccc32)cc1	764297385	QHIVMNOCEVHWHC-UHFFFAOYSA-N	446.467	1.250	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)C(=O)Nc1ccccc1CN1CCOCC1	764343050	MOKVUWLFQARMKZ-UHFFFAOYSA-N	448.483	1.104	50	20	IDGD	
O=C(NCc1ccc(N2CCCS2(=O)=O)cc1)NNC(=O)c1ccc([N+](=O)[O-])cc1	764773654	PSQIMKPRAHNZBO-UHFFFAOYSA-N	433.446	1.279	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)c1ccc2c(c1)CCN2S(C)(=O)=O	765322709	KVCYDBVPLGFDOE-UHFFFAOYSA-N	440.522	1.075	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)Cc3cccc([N+](=O)[O-])c3)CC2)cc1	765749238	KQNIMVDELONLQV-UHFFFAOYSA-N	425.489	1.411	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)NCc2cccc(N3CCCS3(=O)=O)c2)cc1	765889289	ADUKTKCZBPUOSP-UHFFFAOYSA-N	443.485	1.008	50	20	IDGD	
Nc1c(C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)cccc1[N+](=O)[O-]	766664869	WRWOSIKAWLGSOJ-UHFFFAOYSA-N	446.895	1.409	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)c1ccc(N2C[C@H](C)O[C@H](C)C2)nc1	767281743	FNIOJUZTSBWUTC-CALCHBBNSA-N	440.500	1.551	50	20	IDGD	
COc1cccc(-c2cc(C(=O)OCC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)n[nH]2)c1	767601917	DZZAYLBINFQGKP-UHFFFAOYSA-N	439.384	1.612	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)Cc3c(C)nc4[nH]n(C)c(=O)c4c3C)n[nH]2)cc1	768268717	SOABQZANJMRABE-UHFFFAOYSA-N	447.499	1.835	50	20	IDGD	
CCC(CC)[C@@H](C(=O)NNC(=O)c1cc(-c2ccccc2OC)[nH]n1)N1CCOCC1	768274649	VNTANIAISPJJNA-FQEVSTJZSA-N	429.521	1.983	50	20	IDGD	
NS(=O)(=O)c1ccc(C(=O)NNC(=O)Nc2ccc(Br)cc2Cl)nc1	769749163	ZPEVXNSHTNTWTQ-UHFFFAOYSA-N	448.686	1.611	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)N1CCC[C@H]1C(=O)NNC(=S)NCCSC	770240055	LYISWNIORGOWHL-ZDUSSCGKSA-N	430.983	1.812	50	20	IDGD	
O=C(NNC(=O)[C@H]1CC(=O)N(Cc2ccccc2Cl)C1)c1ccc2c(c1)OCCO2	770390194	BZCQUULJLQRKIX-HNNXBMFYSA-N	429.860	1.921	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)NCc1ccnc(OCCN(C)C)c1	770569475	TYGRORAKTDYJSQ-CQSZACIVSA-N	435.912	1.973	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@H]2[C@@H]3c4ccccc4CC[C@H]32)cc1	772630381	OZELCJZTDZCBBC-HMXCVIKNSA-N	442.541	1.674	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C1CCN(c2ccc3nnnn3n2)CC1	772996522	SBECFZUKJQWOOW-LBPRGKRZSA-N	444.883	1.004	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2cccc(COCC(F)(F)C(F)F)c2)n1	773727340	WZAOPBDKDMXVFS-UHFFFAOYSA-N	431.346	1.984	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NN=C1C(=O)Nc2c(F)cc([N+](=O)[O-])cc21	774345018	OVIIMKMFBLIDTG-UHFFFAOYSA-N	434.409	1.422	50	20	IDGD	
COc1ccc(F)cc1CC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	775885122	UVWLKEOXKSIUDI-UHFFFAOYSA-N	436.509	1.456	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)n(C)c1	778932387	SWTBAIOWLDTZMU-UHFFFAOYSA-N	436.462	1.029	50	20	IDGD	
COc1cccc(NNC(=O)NCc2ccccc2OCC(=O)NC[C@@H]2CCCO2)n1	779982050	IYIOHMJOGGGUPF-INIZCTEOSA-N	429.477	1.591	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1cccnc1-c1ccc(Cl)s1	782702178	IEQWJZOUDWLKFO-JTQLQIEISA-N	426.882	1.601	50	20	IDGD	
CCCNC(=O)[C@@H]1CN(C(=O)C(=O)NNc2ncnc3ccsc23)c2ccccc2O1	783252852	DKMYGDWOXDYUIE-HNNXBMFYSA-N	440.485	1.455	50	20	IDGD	
Cn1ncc(NC(=O)C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)c1C(F)(F)F	785099202	AMBRCRNOXVSZBW-UHFFFAOYSA-N	446.336	1.691	50	20	IDGD	
C[C@H](Cc1ccccc1)NC(=S)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	786080908	HOPFKJRABIRMSG-GOSISDBHSA-N	439.585	1.571	50	20	IDGD	
COc1cccc(-n2c(CC(=O)NNC(=O)[C@@H](C)O)csc2=NCc2ccco2)c1	786686962	IKQBYUDIMNBSHV-CYBMUJFWSA-N	430.486	1.312	50	20	IDGD	
O=C(NNC(=O)c1n[nH]c2c1CCCCC2)c1cccc(S(=O)(=O)N2CCCC2)c1	788757164	QCHWBTFLRVWSMM-UHFFFAOYSA-N	431.518	1.538	50	20	IDGD	
CS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNc2cccc(F)c2[N+](=O)[O-])cc1Cl	790996914	ITYMZHSTRYBYQD-UHFFFAOYSA-N	445.816	1.841	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)CCc2ccccc2C(N)=O)cc1	792015012	QSHHAFQXJKNMFK-UHFFFAOYSA-N	438.513	1.600	50	20	IDGD	
Cc1cccc(=O)n1C[C@@](C)(O)C(=O)NNC(=O)c1cc(F)ccc1Br	792137898	ZJPFBXSPOXOKMD-QGZVFWFLSA-N	426.242	1.271	50	20	IDGD	
CSSCCNC(=O)C(=O)Nc1cnc(N2CCOCC2)c(Br)c1	793081837	UISGREBABQVAMN-UHFFFAOYSA-N	435.369	1.747	50	20	IDGD	
Cc1nn(-c2ccccc2)c(N)c1C=NNC(=O)Cc1csc(N2CCOCC2)n1	794886623	BIQCLRNNLQEGEX-UHFFFAOYSA-N	425.518	1.749	50	20	IDGD	
COCCOCc1cc(C(=O)NNc2ccccc2S(=O)(=O)N(C)C)ccc1F	795169693	TWBXNHLGLMUZFD-UHFFFAOYSA-N	425.482	1.996	50	20	IDGD	
O=C(CN1CC=C(CCN2C(=O)c3ccccc3C2=O)CC1)NNC(=O)c1ccccc1	796464976	VEMZUEMYGOITNN-UHFFFAOYSA-N	432.480	1.766	50	20	IDGD	
COC(=O)c1cc(F)cc(NC(=O)C(=O)NNC(=O)c2cc(OC)cc(OC)c2)c1F	796990756	WZQJRWNJJRDEEG-UHFFFAOYSA-N	437.355	1.168	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(-c3nnnn3C(C)C)c(F)c2)n1	797370993	NORPDGNZERKXHH-UHFFFAOYSA-N	426.412	1.163	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)N[C@@H]1C[C@H]1c1cc(F)c(F)c(F)c1	798048110	HSBKUPYDENTUSV-GXFFZTMASA-N	441.435	1.897	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)c2ccc(F)c(S(=O)(=O)N(C)C)c2)o1	801139581	KNNGZFJNNKSBHJ-UHFFFAOYSA-N	440.497	1.586	50	20	IDGD	
COc1ccc(C2=NO[C@@H](CNC(=O)NNC(=O)c3ccc(OC)c(OC)c3)C2)cc1F	802345103	KNIHQAGLEYCRNF-CQSZACIVSA-N	446.435	1.989	50	20	IDGD	
O=C(CNS(=O)(=O)c1c[nH]c2ncccc12)NNc1ccnc(Br)c1	803115436	TZMZEWVKOMRPQG-UHFFFAOYSA-N	425.268	1.142	50	20	IDGD	
Cc1cc(Br)c(C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)cc1N	803852949	FQSWQENFYBQQIA-UHFFFAOYSA-N	431.246	1.829	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N[C@H](C)c2n[nH]c(C)n2)cc1	804812664	RCOPJTLTDRLSQK-YDRQLGOLSA-N	448.487	1.645	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)OCC(=O)N2CCN(C(=O)c3ccco3)CC2)cc(C#N)n1C	809300964	NQNIMAUFORIVPM-YVLHZVERSA-N	435.440	1.233	50	20	IDGD	
O=C(NNC(=O)N1CCCN2c3ccccc3C[C@@H]2C1)c1csc(N2CCOCC2)n1	811850604	ANTDBILYMHBKCL-MRXNPFEDSA-N	442.545	1.471	50	20	IDGD	
O=C(CCc1ncccn1)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	812454426	LVGXQBCGGAGAGZ-UHFFFAOYSA-N	428.456	1.572	50	20	IDGD	
CC(=O)Nc1ccc(C)c(NC(=O)C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)c1	813033592	ATABENGNOYKMHF-UHFFFAOYSA-N	433.490	1.286	50	20	IDGD	
NS(=O)(=O)N1CCC[C@H](C(=O)OCC(=O)NN=C(c2ccccc2)c2ccccc2)C1	815262955	JDJJEWKNUPAUCC-SFHVURJKSA-N	444.513	1.014	50	20	IDGD	
O=C(NNC(=O)c1ccccc1O)C(=O)Nc1ccn(-c2ccc(Br)cc2)n1	815563684	KVZGWYGZHFHYNP-UHFFFAOYSA-N	444.245	1.740	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)[C@@]2(c3ccccc3)CCC(=O)NC2)cc1	816818188	TVJMFOMJWBPXRF-MWTRTKDXSA-N	425.485	1.848	50	20	IDGD	
Cc1cc(CN2C(=O)c3ccccc3C2=O)cc(C(=O)NNc2nnc(C)c(O)n2)c1O	817277862	NHTQDSCRLIKVJH-UHFFFAOYSA-N	434.412	1.453	50	20	IDGD	
COC(=O)c1c(F)cccc1NNC(=O)c1ccc(OC)c(S(=O)(=O)NC2CC2)c1	819715915	LIJNHRYRECHOSQ-UHFFFAOYSA-N	437.449	1.819	50	20	IDGD	
CC[C@@H](C)[C@H](C(=O)OCC(=O)NNC(=O)c1cccs1)N1C(=O)c2ccccc2C1=O	844205819	ZJXHTOQPTPRJEH-SJKOYZFVSA-N	443.481	1.763	50	20	IDGD	
CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)CCC(C)C)c(=O)n2Cc1ccccc1	849208639	JGTMZTIUXWMRGP-UHFFFAOYSA-N	440.504	1.012	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccccc1C(F)(F)F)NNC(=O)c1cc2c(s1)CCC2	913571496	BVUHGLWQRDFYFM-UHFFFAOYSA-N	447.460	1.995	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)N2CCN(S(=O)(=O)N(C)C)CC2)c(C)n1C[C@H]1CCCO1	914504008	IMKXNBOMDQYZEW-UMSHPIDHSA-N	449.577	1.142	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCC(=O)Nc2ccc(F)c(F)c2)c2ccccc2c1=O	915895083	XBFIGKRQHATLPU-UHFFFAOYSA-N	444.398	1.277	50	20	IDGD	
Cc1oc(C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)cc1S(=O)(=O)N1CCCC1	916138281	DKBHNLWUFPMZGF-ZDUSSCGKSA-N	439.465	1.740	50	20	IDGD	
CC(=NNC(=O)[C@H](C)CN1CCCCCC1)c1ccc(S(=O)(=O)N2CCNCC2)cc1	916367283	XYJCZPQBQKATGU-GOSISDBHSA-N	449.621	1.633	50	20	IDGD	
CN1CCN(C(=O)c2ccc(CNC(=O)NNC(=O)c3ccc(Cl)cc3)cc2)CC1	916389952	DYKTYBWEVKERGG-UHFFFAOYSA-N	429.908	1.872	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NCc1ccc(S(=O)(=O)N(C)C)cc1	916646813	PGKUDEDUDKRWGJ-CYBMUJFWSA-N	438.481	1.374	50	20	IDGD	
CCc1noc(CCCC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)n1	916726316	JCRPPMSPAPOPRL-UHFFFAOYSA-N	435.506	1.200	50	20	IDGD	
CC(C)N1C(=O)c2ccc(C(=O)NNC(=O)c3cn(C)c4ccccc34)cc2S1(=O)=O	916745676	DYPKFKTYNKTTQK-UHFFFAOYSA-N	440.481	1.806	50	20	IDGD	
O=C(NCCS(=O)(=O)c1ccc(Cl)cc1)NNC(=O)c1ccc2c(c1)OCCO2	919786767	YSOXNSGZJOEFKN-UHFFFAOYSA-N	439.877	1.529	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNS(=O)(=O)c1cc(CC(=O)O)ccc1OC	919954716	SZUWQAOUECSVEH-UHFFFAOYSA-N	438.458	1.110	50	20	IDGD	
C[C@H]1CN(C[C@H](C)C(=O)NNC(=S)NC2CCN(Cc3ccccc3)CC2)C[C@@H](C)O1	920307911	QDRKLXDIWGBHLK-GBESFXJTSA-N	447.649	1.892	50	20	IDGD	
CC(=NNC(=O)NCCc1cccs1)c1ccc(S(=O)(=O)NCCC(=O)O)cc1	920830332	AREWBXYXBZNHJP-UHFFFAOYSA-N	438.531	1.767	50	20	IDGD	
NC(=O)[C@@H]1CCCN1Cc1cccc(NC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1	920932453	LLUXVHYRWQCYMT-LPHOPBHVSA-N	439.472	1.129	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cccc(-n3ccc(C)n3)c2)cc1OC	1115910931	GUKNQLCGZJYEEU-UHFFFAOYSA-N	438.440	1.816	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2ccc(Br)c(S(C)(=O)=O)c2)cc1	1115923877	KOEPMZFMQYMENE-UHFFFAOYSA-N	427.276	1.936	50	20	IDGD	
Cc1c(C(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)nnn1Cc1ccncc1	1117414743	BEBBYUWVGLMMIF-UHFFFAOYSA-N	443.508	1.438	50	20	IDGD	
CN1CCN(Cc2cccc(CNC(=O)NNC(=O)COc3ccc(F)cc3)c2)CC1	1318226805	USNKAZGLMVJJFJ-UHFFFAOYSA-N	429.496	1.483	50	20	IDGD	
C[C@@H](c1ccncc1)N1CCC(NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)CC1	1319386792	MCSWTFAUBVTMQA-HNNXBMFYSA-N	445.545	1.655	50	20	IDGD	
Cc1nn([C@H]2CCS(=O)(=O)C2)c2nc(C3CC3)cc(C(=O)NNc3cccnn3)c12	1320946177	OUVHDRRGLPPENJ-ZDUSSCGKSA-N	427.490	1.524	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(CC(=O)NNC(=O)c2cncn2-c2ccccc2)cc1	1324973915	ZAZSNAKFTWQWSD-UHFFFAOYSA-N	427.486	1.126	50	20	IDGD	
O=C(NCc1ccccc1CN1CC[C@@H](O)C1)NNC(=O)c1nnc(O)c2ccccc12	1325132935	KFCNJYOPIWVNKR-MRXNPFEDSA-N	436.472	1.046	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(CNC(=O)NNC(=O)c2cncn2-c2ccccc2)c1	1330855225	XRKXRTPGFVBSRI-UHFFFAOYSA-N	442.501	1.267	50	20	IDGD	
O=C(NNC(=O)c1cncn1-c1ccccc1)c1ccc(N2CCCS2(=O)=O)cc1	1337056888	NDYVPVGCQKFYCZ-UHFFFAOYSA-N	425.470	1.487	50	20	IDGD	
Cn1nc(Br)cc1C(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1	1343665046	GYNVUOHXFVJQTA-UHFFFAOYSA-N	430.303	1.591	50	20	IDGD	
COCC1(CNC(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)CCOCC1	1343757254	BUHPULQQYBNOIB-UHFFFAOYSA-N	428.530	1.407	50	20	IDGD	
O=C(c1cc2cccn2cn1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1778051153	NRCGAWFRHTVLLD-RHSMWYFYSA-N	425.258	1.468	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)N(C)C(C)=O)C1	1778104981	ORLFHFINRXDRKG-NVQRDWNXSA-N	446.386	1.541	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cn4cccnc4n3)C2)C1	1778478291	IGFKPRKLDLILMI-QZTJIDSGSA-N	426.304	1.409	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)/C=N/O[C@@H]3CCCCO3)C2)C1	1779098283	FXGHOPSSEHMAAZ-WAOQFGCASA-N	446.342	1.376	50	20	IDGD	
C[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCO[C@]2(CCN(C(=O)CO[Si](C)(C)C)C2)C1	1779301556	RDGXFUOTXGNNIN-QRWLVFNGSA-N	443.617	1.581	50	20	IDGD	
Cn1c(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](F)Cl)CCO3)cc2c[nH]c3nccc-3c21	1780036967	LMBPKHIFSBFMAU-OXJNMPFZSA-N	433.871	1.984	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cccc(-c4cnccn4)c3)C2)C1	1780186284	HVJMNLWDNYPJAY-XMSQKQJNSA-N	444.919	1.841	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(CO)on2)C1	1780221570	ZPCSQVCUVKABIS-FHLIZLRMSA-N	434.320	1.531	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)c3cnc4[nH]ncc4c3)CCO2)C1	1781229616	GOVFTZFLBDQUHJ-QZTJIDSGSA-N	426.304	1.638	50	20	IDGD	
COc1ccc(F)c(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)c1	1781335639	YJZLGPAJEIEIAM-PBHICJAKSA-N	433.249	1.968	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1c(C)n[nH]c1C)C2	1782179773	UGUMPVALYQADLH-SQGPQFPESA-N	426.945	1.337	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)ccc1F)C2	1782179955	XPXLKBPBXHDIGO-WRWLIDTKSA-N	428.888	1.913	50	20	IDGD	
C=CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@]2(CN(C(=O)[C@@H](F)Cl)CCO2)C1	1783766658	NEVLFAOZSBIINH-PJIJBLCYSA-N	433.908	1.820	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3cccc(C#N)c3)[C@H]2C1	1783917534	NCEWLXZFPUNXRW-MUGJNUQGSA-N	433.936	1.724	50	20	IDGD	
CC(=O)NCC(C)(C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]2C1	1783964709	ZEKZKFINYLRAAH-OEAJRASXSA-N	446.386	1.159	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccn(C(F)F)n3)C[C@@H]21	1783970712	ZAVHCMLTRBXKBP-MNXVOIDGSA-N	449.296	1.903	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@](C)(O)C(F)(F)F)[C@H]2C1	1784877515	PXBJDNQXIYRQBB-VSBZFQJLSA-N	445.276	1.453	50	20	IDGD	
Cc1nc(O)c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]32)nc1C	1785575551	NHLOFLHKGSKPCY-WFTHSTBKSA-N	445.347	1.629	50	20	IDGD	
CC(C)(C)OC(=O)NC1(C(=O)N2CC[C@]3(CN(C(=O)C(Cl)Cl)CCO3)C2)CC1	1785714792	DLXGNCMXXFXFQU-KRWDZBQOSA-N	436.336	1.677	50	20	IDGD	
C[C@H](C(=O)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1)n1ccnc1	1786231207	FAPBWLYIHFCMBK-MRXNPFEDSA-N	432.289	1.572	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(O)c(F)c3)C[C@@H]21	1786408868	HUOHMIOUPXEOEL-XEZPLFJOSA-N	429.286	1.910	50	20	IDGD	
CC[S@@](=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]21	1788492594	ZRXKTJNRQQTVSX-YNNFZIPTSA-N	427.394	1.361	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(F)(F)C(F)(F)C(=O)O)C[C@@H]21	1789858633	HCVTXIKXWBJBND-MMWGEVLESA-N	432.798	1.339	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)Cc3ccccc3)C[C@@H]21)[C@@H](F)Br	1789924687	AJFBUGALQOKWEW-ZOFXXKQRSA-N	443.313	1.260	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnn4c3CCC4)C[C@@H]21	1791063428	IUFKXMQRJIXXNR-DSPQJCBJSA-N	425.327	1.206	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3CCc4nc[nH]c4C3)[C@H]2C1	1791531441	UWXNEUKQSFDOQF-WWMMRCEASA-N	443.375	1.731	50	20	IDGD	
CCC[C@@H](NC(C)=O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)CBr)C[C@@H]21	1792182095	KOZPUXOYFXTTPQ-GWFJUFKTSA-N	446.386	1.302	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCc1ccc(F)c(F)c1	1792746680	JIEUSNBDKYBCFO-NXEZDXNNSA-N	430.879	1.741	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1n[nH]c3c1CC[C@H]3C)C2	1792867884	JQPKFEPEBYNHDP-QCPCCJPKSA-N	439.354	1.694	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccccc1OC(F)(F)F)C2)[C@@H](O)CCl	1792975252	OMTJEZAXHNGVOK-WJNVRWDZSA-N	436.814	1.388	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1C[C@@]13C(=O)Nc1ccccc13)C2	1793452727	HVLVGUSOXISVGX-PZCNRVBOSA-N	445.947	1.894	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(F)(F)C(F)(F)C(=O)O	1793728481	SJTYWFPZCROOQS-LMLFDSFASA-N	432.798	1.339	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)[C@H]1CCc2ccccc2C1	1796190012	GZPCLZHFECAWSQ-SNJCGAMXSA-N	432.329	1.423	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2c(c1C)OCCO2	1796251813	RYPBQDPCCJSROM-CXHZTBPHSA-N	438.908	1.223	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(OCC(F)(F)F)n1)C2)[C@@H](F)Cl	1796361864	PGAITUUZWASOSB-RDBQEKCUSA-N	439.793	1.760	50	20	IDGD	
CCC[C@H](NC(C)=O)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C(C)=N/NC(=O)c1ccc[nH]1	1796893208	RLLFPGRGJPHLSW-ZKUSUILTSA-N	444.536	1.063	50	20	IDGD	
C[C@@H](Nc1nccs1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CO[Si](C)(C)C	1797956018	VQFYKYPFGFKTLK-HGTKMLMNSA-N	426.615	1.385	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](CN)c1ccccc1)C2	1799274776	HVKPBUKXOMFEKF-QRXRQMIZSA-N	428.360	1.555	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc(F)cn1)C2	1800639509	GWNJLIQTLOZKAD-DJZPMSPPSA-N	428.302	1.526	50	20	IDGD	
CCC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2	1802133298	YSRAWHQIEAKYQI-AICCOOGYSA-N	435.924	1.804	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)[C@@H]2CC=CCC2)[C@H]1c1cccnc1	1803033404	LQRQSEMEHOUECY-ZWCUEREDSA-N	427.549	1.817	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cccc3[nH]ncc23)[C@@H]1c1cccnc1)[C@H](O)CCl	1803139900	XGUKXSLLDHBORR-GDIGMMSISA-N	427.892	1.877	50	20	IDGD	
O=C(c1cnc2c(c1)CCNCC2)N1CCC2(CCCN(C(=O)[C@@H](O)CCl)C2)CC1	1805526482	SNIMYOWJRHUJNX-IBGZPJMESA-N	434.968	1.214	50	20	IDGD	
CN(C)C(=O)NCC(=O)N1CC[C@H](CNC(=O)CCBr)[C@H]1c1cccnc1	1806339192	ZRBSSPOGOLDLRF-RHSMWYFYSA-N	440.342	1.144	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)N1CC[C@@H](CNC(=O)CCBr)[C@H]1c1cccnc1	1806343222	OAOHVKAWRRSJTO-QIIPPGSGSA-N	437.338	1.563	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC2(CCCN(C(=O)C3=NN(C)C(=O)CC3)C2)CC1	1806629153	PBRWAGCHPQASMU-CYBMUJFWSA-N	427.343	1.609	50	20	IDGD	
N[C@@H](Cc1cscn1)C(=O)N1CC[C@H](CNC(=O)[C@H](F)Cl)[C@@H]1c1cccnc1	1808313125	SHOXGJSCFWMYDU-OEAJRASXSA-N	425.917	1.648	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)Cc2ncccn2)[C@@H]1c1cccnc1)[C@H](F)Br	1808651110	IIUPVSGZKLAFCT-XKQJLSEDSA-N	436.285	1.811	50	20	IDGD	
C[C@@H](Nc1cccnc1)C(=O)N1CCCC2(CCN(C(=O)CCC(=O)NN(C)C)CC2)C1	1809785662	JMKUUTQKQKINMW-GOSISDBHSA-N	444.580	1.486	50	20	IDGD	
CCC(=O)C(=O)NC[C@H]1CCN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@H]1c1cccnc1	1812565712	MRPJYROIOPCDAX-RBIZEYAUSA-N	438.488	1.201	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)Cc2ccn(C)n2)[C@@H]1c1cccnc1	1812864568	PZNMGRGCPJTNQF-JCKWVBRZSA-N	434.338	1.847	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)C1CC2(CCC2)C1	1813650099	UXGBXHCVLFBEQY-SIKLNZKXSA-N	447.344	1.661	50	20	IDGD	
COCC1(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)[nH]n2)CC1	1815191901	RRXJWPLNJAMPIE-MRXNPFEDSA-N	441.492	1.141	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@H]1CCc2nc(NC(=O)[C@H]3CC3(F)F)sc2C1	1818679827	XUCOBOKZHRWWGO-GZMMTYOYSA-N	436.444	1.023	50	20	IDGD	
CC(=O)N1CCN(CC(=O)Nc2cc([C@H]3CCCCN3C(=O)C(Cl)Cl)[nH]n2)CC1	1818967691	VFBSHMICZKJNIN-CQSZACIVSA-N	445.351	1.370	50	20	IDGD	
C[C@H](CS(C)(=O)=O)C(=O)N1CCCC[C@H]1c1cc(NC(=O)C(Cl)Cl)n[nH]1	1822419397	XLNPBIPQYHICTN-KOLCDFICSA-N	425.338	1.886	50	20	IDGD	
CN1C(=O)CC[C@H]1C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1	1823007557	PQYOQUMIFJRMBJ-VFWDIBGWSA-N	433.303	1.366	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnn3cccnc13)CC2	1826000665	ZWHANRAPBPNQAV-JQWIXIFHSA-N	434.909	1.665	50	20	IDGD	
O=C([C@@H]1C[C@@]1(F)Cl)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827060726	YHIDALPHTMNLFR-WFXMLNOXSA-N	436.720	1.524	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H](C)CN)CC1	1827681211	PTVSNGWWTITMRH-DSOYRZJRSA-N	430.553	1.335	50	20	IDGD	
CC(C)O[C@@H](C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1	1829020684	WGHNBMCKPHZGEE-LAUBAEHRSA-N	430.354	1.413	50	20	IDGD	
CCOc1ncccc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](Cl)CC)C2)C1	1829542478	ZKRMPHUBFODQBL-OXQOHEQNSA-N	425.913	1.568	50	20	IDGD	
COc1c(Cl)cccc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1830738124	MAHBWCBRXMDNOC-HNAYVOBHSA-N	447.315	1.018	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)Nc3cnccn3)C2)C1	1831651064	NFRVHCNQUNEOJX-TWOQFEAHSA-N	439.944	1.141	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CN2CCN(C)CC2)CC1	1831655318	NRIPBBOGCCONFO-AEFFLSMTSA-N	443.430	1.637	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)COC(C)(C)C)CCO2)C1	1832317248	JQEREDKTWHIGLM-RDTXWAMCSA-N	435.359	1.431	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)CCN2CCCC2)CC1	1832966143	NWOVRZPNNWRHMO-JOCHJYFZSA-N	441.381	1.086	50	20	IDGD	
Cc1ccc(OCC(=O)N2CCC(N3CCC(NC(=O)[C@H](O)CCl)CC3)CC2)cc1	1833308913	DJCBBPCMXHNSCQ-HXUWFJFHSA-N	437.968	1.545	50	20	IDGD	
COC[C@H](C)C(=O)NC1CCN(C2CCN(C(=O)[C@H](C)CBr)CC2)CC1	1833522977	IKLPRZBQXSUTDZ-CABCVRRESA-N	432.403	1.872	50	20	IDGD	
Cc1cncc(C(=O)N2CCO[C@]3(COCCN(C(=O)CCBr)C3)C2)c1	1834280522	VLCAEQAWXGROND-SFHVURJKSA-N	426.311	1.245	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cc4ccccn4n3)CC2)CC1	1835302681	IQOKDQKCZPJNQR-IBGZPJMESA-N	447.967	1.773	50	20	IDGD	
CN1C(=O)CC[C@H]1C(=O)N1CCC(N2CCC(NC(=O)CO[Si](C)(C)C)CC2)CC1	1835836163	PLFCZEKLJGYUEV-SFHVURJKSA-N	438.645	1.030	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)/C(C)=C/c3ccc(C)o3)CCO2)C1	1837582532	OUBDJAIQUGTTTH-KJDCMORTSA-N	440.924	1.702	50	20	IDGD	
CCc1nc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](Br)CC)C3)C2)co1	1838138364	UKJIUWBFULNCTA-UGSOOPFHSA-N	444.326	1.481	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(OCC)nn3)CCO2)C1	1838829484	AXSGPKVIAURFAA-QRWLVFNGSA-N	440.928	1.353	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cc(F)cc(F)c3)C2)C1	1839144317	VEVHLJLSCCMRPD-YLJYHZDGSA-N	430.879	1.981	50	20	IDGD	
Cc1ncsc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2	1839151612	XXBPRAXCRSVHMX-DLBZAZTESA-N	436.361	1.758	50	20	IDGD	
COc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)s1	1840031500	RUPAOQYMYKUCDZ-YVEFUNNKSA-N	447.351	1.610	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCCc3ccncc3)C2)C1	1840150799	QPYZFPDKWVERMS-GHTZIAJQSA-N	439.940	1.115	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)Cc3ccccc3)C2)C1	1840156017	MFWHCWBNKYPPJS-LZNRXBQRSA-N	438.952	1.575	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(OC)c3C)CCO2)C1	1840645218	JJKAIFXTSRBQSQ-DYESRHJHSA-N	440.924	1.327	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC2(CCCN2C(=O)[C@@H]2CCC(=O)NC2)C1	1841114817	NQPNZUIIAWQMEC-FUXXUDPSSA-N	428.439	1.601	50	20	IDGD	
O=C(c1c(F)ccc(Cl)c1F)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843012607	FWBJHKGXDRTCMY-UHFFFAOYSA-N	434.635	1.429	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)CCc1ccc(C)cn1)C2	1843415397	OWGQOJFBRCDPDN-YZSQISJMSA-N	436.516	1.660	50	20	IDGD	
Cc1nc2cc(C(=O)N3CCCC34CN(C(=O)c3ccc(B(O)O)cc3)C4)ccc2s1	1843764872	JJLRHGGTBDMKOY-UHFFFAOYSA-N	435.314	1.415	50	20	IDGD	
O=C([C@@H](F)Cl)N1CC2(CCCN2C(=O)c2nc3c(Br)cc(F)cn3n2)C1	1845725211	DWXPNMZDJDDKBX-SNVBAGLBSA-N	448.655	1.982	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)CCc2ccc(N(C)C)cc2)C1	1846506988	JNQFRNAJQLPPQZ-UHFFFAOYSA-N	429.565	1.262	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)SC1=NS(=O)(=O)CCN12)c1ccc2c(c1)OCO2	18017732	KCFJCWFDQBEJBR-UHFFFAOYSA-N	446.466	1.102	50	20	IDGD	
COc1ccc(-c2nc(C(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)cs2)cc1OC	18949585	FUQVXDNCLBKVAK-LLVKDONJSA-N	425.488	1.023	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NNC(=O)c2cc(Br)c[nH]2)cc1	23914329	NNMQZJQFYWYKEF-JTQLQIEISA-N	429.296	1.214	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)CN2C(=O)COc3ccc(Cl)cc32)nc2ccccc21	26538836	KOHIOQMIXOPXBN-UHFFFAOYSA-N	427.848	1.342	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCCC(=O)NNc2nc(-c3ccncc3)no2)cc1	726376807	CWFHGOTXKXBLJC-UHFFFAOYSA-N	432.462	1.342	50	20	IDGD	
COc1ccc(CN2C[C@H](C(=O)NNC(=O)CNc3ccc(OC)cc3)CC2=O)cc1	726618694	BABWDAMXOVEQAA-MRXNPFEDSA-N	426.473	1.312	50	20	IDGD	
Cn1cnnc1SCC(=O)NNC(=O)COc1ccc(OCc2ccccc2)cc1	726929620	XJXRHCHSQZQCJO-UHFFFAOYSA-N	427.486	1.713	50	20	IDGD	
COC(=O)CCn1nc(C)c(C=NNC(=O)c2sc(N3CCOCC3)nc2C)c1C	727060152	ZGPNEGWYQDBGKK-UHFFFAOYSA-N	434.522	1.428	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc(OC(F)(F)F)cc1)NNC(=O)Cc1cccnc1	728893900	XRBCINYCEIDXCU-UHFFFAOYSA-N	446.407	1.039	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2cccc(C(=O)N(C)CC)c2)c2ccccc2c1=O	729169688	YGCDIFFVPCZNTB-UHFFFAOYSA-N	435.484	1.973	50	20	IDGD	
Cc1ccc(-n2nc(C(=O)NNC(=O)N[C@H]3CCS(=O)(=O)C3)c3c2CCC3)c(C)c1	730213149	IHMRDBFDQUSNDJ-AWEZNQCLSA-N	431.518	1.109	50	20	IDGD	
Cn1nc(SCC(=O)NN=C(/C=C\c2ccccc2)c2ccccc2)c(=O)n(C)c1=O	730571450	ROSZUHOLJFDJFW-UILKHAHSSA-N	435.509	1.805	50	20	IDGD	
CN1CCN(C(=O)c2ccc(CNC(=O)NNC(=O)C(C)(C)c3ccccc3)cc2)CC1	731220021	RFOAIDUSMATWLL-UHFFFAOYSA-N	437.544	1.882	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CCCN2C(=O)NC(C)(C)C2=O)cc1Br	732175057	GZOVEYHPEIPYCF-UHFFFAOYSA-N	441.282	1.329	50	20	IDGD	
Cc1ccc(-n2nc(C(=O)NNC(=O)CCN3C[C@H](C)O[C@@H](C)C3)c3c2CCC3)cc1	732261428	MUZIGOPBZLCGJU-IRXDYDNUSA-N	425.533	1.930	50	20	IDGD	
COC(=O)c1cc(OC(=O)c2ccc(S(=O)(=O)N3CCOCC3)o2)ccc1[N+](=O)[O-]	732653073	DPAFFJDPVHBGPW-UHFFFAOYSA-N	440.386	1.215	50	20	IDGD	
CCCCS(=O)(=O)N1CCC(C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)CC1	733110120	BKRXYXFGLPQJKC-UHFFFAOYSA-N	433.534	1.475	50	20	IDGD	
Cc1cccc(-n2c(NNC(=O)CN3CCC(=O)NC3=O)nc3ccccc3c2=O)c1C	733365946	VJJDJVRDMYIFLY-UHFFFAOYSA-N	434.456	1.388	50	20	IDGD	
C[C@@H](CNC(=O)CCC(=O)C(C#N)=C1N(C)c2ccccc2N1C)CN1CCN(C)CC1	733882183	DMCLWHLUXLMARF-SFHVURJKSA-N	438.576	1.657	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)NCC2(N(C)C)CCOCC2)N(C)c2ccccc21	733884104	ADNKIIWGNJMGNE-UHFFFAOYSA-N	425.533	1.884	50	20	IDGD	
CC(=O)NCC(=O)N1CCc2cc(C(=O)NNC(=O)C34CC5CC(CC(C5)C3)C4)ccc21	735631023	WCRZIKFTRCFVMX-UHFFFAOYSA-N	438.528	1.689	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)N[C@@H]1CC(=O)N(CCOc2ccccc2)C1	743591676	QXNRWSNVGJDVAG-GOSISDBHSA-N	435.484	1.652	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CN2CCC(NS(=O)(=O)c3cccs3)CC2)c1	744384975	FVKPVYZOQHOJKP-UHFFFAOYSA-N	436.559	1.260	50	20	IDGD	
Cc1ccc(C(=O)NC2CCN(CC(=O)NNC(=O)c3cccc(C#N)c3)CC2)s1	744394258	FPWIXDZLGWKPFN-UHFFFAOYSA-N	425.514	1.584	50	20	IDGD	
N#CCOc1ccc(CC(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)cc1	744621216	LTYZVAVRYWZXAG-UHFFFAOYSA-N	430.486	1.296	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)[C@H]2CC(=O)N(c3ccc4c(c3)CCC4)C2)c1	744681940	ICTKVFWGMIZKSH-IBGZPJMESA-N	446.463	1.404	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)c2cn(Cc3cccs3)nn2)cc1C	745560780	NCUYIVBPNHELOE-UHFFFAOYSA-N	433.515	1.938	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)N[C@H]2CCCN(c3ccc(C)cc3)C2=O)cc1	745882357	VGKVKCLQIQFOEM-IBGZPJMESA-N	426.473	1.908	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)Oc1cccc(Cl)c1	745883227	MPEPQMDSVRKEFC-GFCCVEGCSA-N	429.864	1.998	50	20	IDGD	
Cc1ccc(N2CCC[C@@H](NC(=O)NNC(=O)c3csc(N4CCOCC4)n3)C2)cc1	745888176	NILFEJRBMMFSFN-MRXNPFEDSA-N	444.561	1.901	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCC(=O)NC1CCCC1	746726598	WZAPIOJJNWYYMH-LLVKDONJSA-N	427.299	1.606	50	20	IDGD	
C[C@@H]1CC(C)(C)C[C@]2(C1)NC(=O)N(CC(=O)NNC(=O)CCOc1ccccc1)C2=O	747181011	CKVGFZVSFIJADM-QRQCRPRQSA-N	430.505	1.740	50	20	IDGD	
O=C(NC[C@H]1CCN(c2cccc(Br)c2)C1)NNC(=O)C(=O)N1CCCC1	748455851	CREIPEVEURYSMP-CYBMUJFWSA-N	438.326	1.228	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)[C@@]1(O)CCN(Cc2ccccc2)C1	748594881	ZKRUAPTZEKPOKD-JOCHJYFZSA-N	446.573	1.844	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)CNC(=O)OCC(F)(F)F	748601473	DSSCLECLQINXFC-UHFFFAOYSA-N	426.417	1.495	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@](C)(C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)C1	751602616	RMIKCMHHSZREQA-FQEVSTJZSA-N	439.534	1.888	50	20	IDGD	
COC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(NC(=O)NNC(=O)CC(C)C)cc2)C1	755557400	IVWIFHAKGMGEHJ-AWEZNQCLSA-N	440.522	1.459	50	20	IDGD	
CS(=O)(=O)c1ccccc1NC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	755582726	HETHFBQTVOTRLR-UHFFFAOYSA-N	445.545	1.455	50	20	IDGD	
C[S@](=O)c1cccc(NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c1	756527464	SKRQGCQUARUQLW-PMERELPUSA-N	429.546	1.789	50	20	IDGD	
Cc1cccc(NS(=O)(=O)c2ccc(C(=O)NNc3ccc(C(N)=O)nn3)cc2)c1C	757401703	DOTQPAWAYCYKJG-UHFFFAOYSA-N	440.485	1.750	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1S(=O)(=O)NC1CC1	757864726	DDDAYPLKELUKQX-KRWDZBQOSA-N	446.485	1.428	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)c1cc(Cl)ccc1Oc1ccc(F)cc1	758041338	YGYICNHKIYCYTO-SNVBAGLBSA-N	429.857	1.970	50	20	IDGD	
COc1ccc(COCCC(=O)N2CCN(S(=O)(=O)CBr)CC2)cc1	758512217	JQJNYZYMSNATPL-UHFFFAOYSA-N	435.340	1.428	50	20	IDGD	
CC(C)NC(=O)NNC(=O)[C@@]12CCC(=O)N1c1ccccc1C(=O)N2Cc1ccccc1	759644609	VDKYQHHJMGWJIM-HSZRJFAPSA-N	435.484	1.905	50	20	IDGD	
COCCCNC(=S)N(C)NC(=O)CCn1cnc2sc3c(c2c1=O)CCCC3	761789121	CGLMCBRISIBOLJ-UHFFFAOYSA-N	437.591	1.601	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)C1CCOCC1	762370633	RFCYEXMMJGBSDX-OAHLLOKOSA-N	438.550	1.620	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)N[C@@H]1CC[C@@H]2SCCS[C@@H]21	762527526	KOUZKBFPDXHJGC-KGYLQXTDSA-N	429.593	1.303	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)c3cnc4c(c3)c(O)nc(=O)n4C)n[nH]2)cc1C	763176492	JRBVNMMNOBZACE-UHFFFAOYSA-N	433.428	1.116	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1ccncc1Br	763435987	YOQHSAAXZWCQEL-UHFFFAOYSA-N	441.307	1.622	50	20	IDGD	
Cc1nc(-c2cccc(NC(=O)C(=O)NNC(=O)[C@H]3COc4ccccc4O3)c2)oc1C	763574464	ZSJLZHWLKUHLOD-GOSISDBHSA-N	436.424	1.884	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(OC)c(OC)c1OC	763714280	RYUKNUYGFYDIFT-UHFFFAOYSA-N	431.445	1.440	50	20	IDGD	
CC(C)C(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)c1	763746484	XYVCUGHNSQOHOZ-UHFFFAOYSA-N	437.500	1.820	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)CCC(=O)N3C)c1	763771640	JOEACAZPSLWBOB-UHFFFAOYSA-N	426.429	1.013	50	20	IDGD	
CN(C)CCn1ccc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCCCCC3)n1	763915046	VYNDJRRKDJYHKM-UHFFFAOYSA-N	432.550	1.565	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)cc1S(C)(=O)=O	763973635	CROWVARHBXBACS-UHFFFAOYSA-N	425.850	1.157	50	20	IDGD	
CCN1CCN(c2ccc(NC(=O)C(=O)NNC(=O)c3ccccc3OC)c(C)c2)CC1	764041073	QGTQAYMJQPDUEC-UHFFFAOYSA-N	439.516	1.545	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N(CC)CC)cc1NC(=O)C(=O)NNC(=O)[C@@H](C)CC	764083088	OYEZNOIRHLLUOY-ZDUSSCGKSA-N	442.538	1.248	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(N3CCCC3=O)cc2)o1	764139318	QOJWHFSFTZSQKD-UHFFFAOYSA-N	441.488	1.648	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccn(-c3ccc(Cl)cc3C#N)n2)cc1	764177266	NCHNWJIXMCLAJF-UHFFFAOYSA-N	433.815	1.669	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3CN2Cc2ccccc2)nn1C	764179024	MVQZHCFNLGIANM-FQEVSTJZSA-N	446.511	1.442	50	20	IDGD	
O=C(CCCc1ccccc1)NNC(=O)C(=O)Nc1cccc(C(=O)N2CCOCC2)c1	764223152	BWXFNJSLUARTKZ-UHFFFAOYSA-N	438.484	1.268	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)C(=O)Nc1ccc2c3c(cccc13)CC2	764259502	INWRBLFZSIOJTG-UHFFFAOYSA-N	444.495	1.731	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)n(-c2ccccc2F)n1	764350761	KZXOWNTXNLESQV-UHFFFAOYSA-N	447.430	1.905	50	20	IDGD	
C[C@H]1COCCN1c1ccc(NC(=O)C(=O)NNC(=O)COCc2ccccc2)cc1	764362686	GXCSUBOVWOBCHW-INIZCTEOSA-N	426.473	1.214	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)C(=O)Nc1ccc(OCC2CCOCC2)cc1	764367548	XUYPRZHDNTVEBM-UHFFFAOYSA-N	441.484	1.795	50	20	IDGD	
COC(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)c1	764371071	WLPQTTJZEWAVND-UHFFFAOYSA-N	441.774	1.884	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCCc2nc(C)c(C)s2)cc1	764372605	KEHQFIPEJGDUFC-UHFFFAOYSA-N	439.563	1.262	50	20	IDGD	
COCC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)cc1	764382383	IZGFEVLTIBXZRC-UHFFFAOYSA-N	442.457	1.123	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)C(=O)Nc2c(C)nn(-c3ccccc3)c2C)c1	764430797	QQXHRDNNVDHKKQ-UHFFFAOYSA-N	435.444	1.242	50	20	IDGD	
CC(C)(C)OC(=O)NNC(=O)C(=O)Nc1ncn(Cc2cccc(Br)c2)n1	765391059	UGUCYJTYFFFUFA-UHFFFAOYSA-N	439.270	1.583	50	20	IDGD	
CNc1c(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)cccc1[N+](=O)[O-]	765570532	VWFWNVFZNNNNMO-UHFFFAOYSA-N	435.462	1.414	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765737460	ZMAVZEMTFKCJFU-UHFFFAOYSA-N	448.527	1.204	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@@H]2CCN(C3CCCCC3)C2=O)c2ccccc2c1=O	767171050	OUPOQLXGUQFHJX-QGZVFWFLSA-N	440.504	1.294	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)N[C@H]1CCCc2c[nH]nc21	767227572	TVJBYTPMNXTWMA-INIZCTEOSA-N	432.506	1.216	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)CCn1cnc2c(C)cccc2c1=O	767264883	HKSDLMSFWOOBPM-UHFFFAOYSA-N	436.468	1.337	50	20	IDGD	
COc1ccc(-n2c(SCC(=O)NNC(=O)C3CC3)nnc2-c2cnccn2)cc1	768412107	TVJJAYLCKLZIBK-UHFFFAOYSA-N	425.474	1.382	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N2CCOCC2)cc1NC(=O)NNC(=O)C(C)(C)C	769935635	SGGIJEMPSXFJDO-UHFFFAOYSA-N	428.511	1.305	50	20	IDGD	
C[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)CCN1C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	771945389	ALWPJUDSPDAWCS-HIFRSBDPSA-N	444.496	1.394	50	20	IDGD	
CCCCn1ncc(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)c1C	772442086	KJHMPDGOWJRUSE-UHFFFAOYSA-N	434.566	1.685	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@H]1CN(C(=O)NNC(=O)c2cccc(OC(F)F)c2)CCO1	773272912	KOMGOEFIMGCJFD-AWEZNQCLSA-N	444.435	1.868	50	20	IDGD	
Cn1nc(-c2cc(F)cc(F)c2)cc1NC(=O)C(=O)NNC(=O)COc1ccc(F)cc1	773530210	UWRFRSJVDLUINA-UHFFFAOYSA-N	447.373	1.669	50	20	IDGD	
COC(=O)c1cc(Br)c(F)cc1NC(=O)C(=O)NNc1nccc(OC)n1	773723596	DGKCISQAOHFFGV-UHFFFAOYSA-N	442.201	1.255	50	20	IDGD	
CCOCC(=O)NNC(=O)Nc1ccc(OCCN2C(=O)c3ccccc3C2=O)cc1	775871561	JEJDTKXNUUVVFT-UHFFFAOYSA-N	426.429	1.551	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccc(NC(=O)NNC(=O)COc2ccccc2O)nc1	776061050	DSLVEAZKWPCGRM-UHFFFAOYSA-N	437.478	1.096	50	20	IDGD	
COCc1nnc(-c2cccc(C(=O)OCC(=O)NNC(=O)Cc3nc(C)cs3)c2)o1	776456078	RFFDCEXIHNMQSC-UHFFFAOYSA-N	445.457	1.195	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1N1CCOCC1)c1cc(Br)c[nH]1	776557722	IXANPOLZSNCKMN-UHFFFAOYSA-N	438.238	1.597	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(N2C[C@H](C(=O)NNc3ccccn3)CC2=O)cc1	777473627	FYTCOJNGVFQSHS-OAHLLOKOSA-N	431.518	1.608	50	20	IDGD	
Cc1cc2ccccc2nc1NNC(=O)CCC(=O)Nc1ccc2c(n1)n(C)c(=O)n2C	777477383	LLVHMTLSLDWWEY-UHFFFAOYSA-N	433.472	1.991	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc(Cl)ccc1OC[C@@H]1CCCCO1)N1CCOCC1	777619434	YMLYSTFVEGIMOL-AWEZNQCLSA-N	433.914	1.523	50	20	IDGD	
CCCn1nc(C(=O)NNS(=O)(=O)c2ccc(C#N)cc2Cl)c2ccccc2c1=O	779829567	KEBMXQBLPHRBNW-UHFFFAOYSA-N	445.888	1.955	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(S(=O)(=O)C(F)(F)F)cc1)c1ccc(Cl)nc1	780375423	HPEKCPWQHIKFBR-UHFFFAOYSA-N	443.812	1.652	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](NC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)CC1	780668598	CKFVGFDHDDNNSQ-PBHICJAKSA-N	434.493	1.946	50	20	IDGD	
COc1ccc(NNC(=O)c2ccc(S(=O)(=O)N(C)C)c(Br)c2)nc1	781525996	LAVVPJXEWTWENK-UHFFFAOYSA-N	429.296	1.860	50	20	IDGD	
COc1cccc(Cn2ccc3ccc(NC(=O)C(=O)NNC(=O)C(=O)NC4CC4)cc32)c1	782964923	BFTQXWNSXXMBJX-UHFFFAOYSA-N	449.467	1.063	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(NC(=O)C(=O)NNc2cncc(Cl)n2)ccc1Cl	783258370	GRBCWRUAOLBJHL-UHFFFAOYSA-N	433.277	1.116	50	20	IDGD	
CN1CCC[C@H](N(C)C(=O)c2ccc(NC(=O)C(=O)NNc3cncc(Cl)n3)cc2)C1	783268125	NVFZEQXNLRWHDF-HNNXBMFYSA-N	445.911	1.378	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2ccc(CC(=O)N3CCSCC3)cc2)nc(C)n1	783329640	IDFKHWXQQBHGPP-UHFFFAOYSA-N	428.518	1.293	50	20	IDGD	
Cc1cnn([C@H]2CCCc3ccccc32)c1NC(=O)C(=O)NN[C@]1(C)CCS(=O)(=O)C1	783424398	DJRRALIXJPBTDU-LAUBAEHRSA-N	445.545	1.254	50	20	IDGD	
C[C@@H](NC(=O)C1CCCCC1)C(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	783703901	IQGXZVXLBARVDX-OAHLLOKOSA-N	439.557	1.707	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2ccc(C)c(NC(=O)CN3CCCCC3)c2)ncn1	783938899	DRUFREHNYIISAZ-UHFFFAOYSA-N	425.493	1.600	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNc2ccc(Br)cn2)c(C)c1	784341457	NABRZWSTWNSMGG-UHFFFAOYSA-N	437.250	1.786	50	20	IDGD	
O=C(COC(=O)CCN1C(=O)[C@@H]2CCCC[C@H]2C1=O)NNC(=O)c1cccc(Cl)c1	784374849	HKIVEJSUOXDJBM-HUUCEWRRSA-N	435.864	1.210	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)Nc1cccc(N2CCCCC2)c1	785022945	CRTPKPRKRVCGKZ-UHFFFAOYSA-N	427.417	1.690	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2cccc(C(=O)N3CCCC3)c2C)n1	785226107	PAKMWZQWBAPAFQ-UHFFFAOYSA-N	439.520	1.949	50	20	IDGD	
CCCc1c(NC(=O)C(=O)NNC(=O)Cc2cccnc2)cnn1-c1cccc(C#N)c1	785991436	RORLNAKUFDAIAM-UHFFFAOYSA-N	431.456	1.420	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2cccc([N+](=O)[O-])c2)cc1C(=O)N1CCOCC1	787541290	RKBKJPLMSCSMQB-UHFFFAOYSA-N	427.417	1.457	50	20	IDGD	
O=C(CCNC(=O)c1ccc(Br)cc1)NNc1ccc(-n2ccnc2)nn1	788174794	JXCFVPWIJQDQHS-UHFFFAOYSA-N	430.266	1.688	50	20	IDGD	
CC[C@H]1CCc2nc(NC(=O)C(=O)NNC(=O)c3cncc(NC(C)=O)c3)sc2C1	789739456	OMYBCWSSGDPALO-NSHDSACASA-N	430.490	1.411	50	20	IDGD	
COC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)cc1	789811956	HRAHQZLXGYSGFE-IRXDYDNUSA-N	426.429	1.524	50	20	IDGD	
O=C(NNC(=O)c1cc2nccnc2cc1F)c1cccc(S(=O)(=O)N2CCCC2)c1	791446036	MMUIDDREFLJDDS-UHFFFAOYSA-N	443.460	1.628	50	20	IDGD	
CNC(=O)c1cc2cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc3ccc(F)cc3)ccc2[nH]1	792352167	CXFHCJLVNJZRDP-NSHDSACASA-N	441.419	1.220	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(N3C(=O)CCCC3=O)c2)cc1	792355066	OJJDGLKSGLPNTR-UHFFFAOYSA-N	438.440	1.203	50	20	IDGD	
C[C@H]1CN(C(=O)c2ccc(NC(=O)C(=O)NNc3nc4ccccn4n3)cc2)C[C@@H](C)O1	792393471	HMSUAJGAKQAWGO-OKILXGFUSA-N	437.460	1.061	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2cc(Cl)cc(Cl)c2)cc1OCC(N)=O	792437798	MIKXKEVKNZUXHV-UHFFFAOYSA-N	427.244	1.948	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2C[C@@H](F)C[C@H]2CN(C)C(=O)OC(C)(C)C)n1	792919463	LZKZYJUMIHJKCA-KBPBESRZSA-N	443.545	1.421	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1cnc(CC2CC2)nc1	793017974	NBTZIAUCGDKDFM-UHFFFAOYSA-N	446.533	1.588	50	20	IDGD	
CCOC(=O)c1cc(S(=O)(=O)NNC(=O)CNC(=O)OC(C)(C)C)c(F)cc1C	795347173	GPEYJOYJFSJBPA-UHFFFAOYSA-N	433.458	1.145	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(OC)c(OC)c(C)c2OC)c(OC)c1	797003286	AQLBQJIPPJNPAD-UHFFFAOYSA-N	447.444	1.438	50	20	IDGD	
C[C@@]1(CNC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)CCN(Cc2ccccc2)C1	798483337	BUIXZQNAQINUMJ-QFIPXVFZSA-N	444.557	1.946	50	20	IDGD	
COc1cc(F)cc(NNC(=O)C(=O)Nc2ccc(O[C@@H]3CCN(C)C3=O)cc2C)c1	799262740	JIDFTUIZGAOXLO-GOSISDBHSA-N	430.436	1.834	50	20	IDGD	
CSC[C@H](C)C(=O)N1CCC(C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)CC1	799537792	QOWFZWXOHXRTBI-AWEZNQCLSA-N	446.529	1.100	50	20	IDGD	
O=C(NCCC(=O)OC1CCCCC1)NNC(=O)c1csc(N2CCOCC2)n1	800983663	QJRDEJJPSCVLRD-UHFFFAOYSA-N	425.511	1.190	50	20	IDGD	
Cn1ncc2c(O)nc(CCC(=O)NNC(=O)Nc3ccc(Br)cc3)nc21	801998533	UGYRJQYOJUMSCA-UHFFFAOYSA-N	434.254	1.617	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)[C@H]1CC(=O)N(CCOc2ccccc2Cl)C1	804952367	KUZFJVZSUPIHOZ-AWEZNQCLSA-N	441.879	1.686	50	20	IDGD	
CC(C)n1ncc2c(C(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)cc(-c3ccco3)nc21	807298362	CFXJYCIVMPCWRM-LBPRGKRZSA-N	431.474	1.468	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(Br)cc1)NNc1nccnc1C1CCC1	811527722	VRDHFTZXNARARE-UHFFFAOYSA-N	440.323	1.928	50	20	IDGD	
CN(C)c1ncc(Br)cc1C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	812733497	UQZPTOZPIXCUPI-UHFFFAOYSA-N	442.339	1.917	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H](NC(=O)OC(C)(C)C)C(F)(F)F)cc1C	813373854	JWUHTOWDZFNRHI-LBPRGKRZSA-N	432.399	1.845	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1ccc2c(c1)N(C(=O)Cc1ccccc1)CC2	815572265	YTSXBVQJRZTTCP-UHFFFAOYSA-N	446.467	1.699	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)c1ccc2c(c1)NC(=O)CNC2=O	815854975	YYJGTYQSIUCKPI-UHFFFAOYSA-N	445.501	1.202	50	20	IDGD	
CCC[C@H](C(=O)NNC(=O)c1cn(-c2ccccc2)nc1-c1ccccc1)S(N)(=O)=O	816815046	KZLFJRMEVHZDSB-GOSISDBHSA-N	441.513	1.758	50	20	IDGD	
COCCn1nnc2c1CCN(C(=O)CCC(=O)C(C#N)=C1N(C)c3ccccc3N1C)C2	817840430	KTFSOMOAOZPSPT-UHFFFAOYSA-N	449.515	1.480	50	20	IDGD	
Cn1c(=O)n(CCC(=O)NNC(=O)COc2ccc(Br)cc2)c2ccccc21	821736001	PIZNEISMYQHWLX-UHFFFAOYSA-N	447.289	1.719	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)CCc2nc(O)c3c4c(sc3n2)CCC4)C[C@@H](C)O1	822201309	AFXTUFZCQKSFCI-BETUJISGSA-N	447.561	1.465	50	20	IDGD	
CSc1ccc(N2C[C@@H](C(=O)NNC(=O)C(=O)Nc3ccc(C)cc3)CC2=O)cc1	893070933	ZPRHZYQGNFJSNW-AWEZNQCLSA-N	426.498	1.856	50	20	IDGD	
Cc1cc(C)c(C)c(S(=O)(=O)NCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c1C	912770425	BKZNKLMAUCNWBW-UHFFFAOYSA-N	434.474	1.568	50	20	IDGD	
CCS(=O)(=O)N1CCC(C(=O)NNC(=O)Cn2nc(C)cc2C)(c2ccccc2)CC1	914343681	FTPUIPSULQNGGT-UHFFFAOYSA-N	447.561	1.031	50	20	IDGD	
Cc1nc2ccccc2c(=O)n1CC(=O)OCC(=O)NNC(=O)c1cccc(Cl)c1	914639671	OBYXPXQIRCUNRU-UHFFFAOYSA-N	428.832	1.363	50	20	IDGD	
Cn1ccnc1[C@H](NC(=O)NNC(=O)COc1ccccc1[N+](=O)[O-])c1cccc(F)c1	916223820	DXMIEGSTJGQIFH-GOSISDBHSA-N	442.407	1.966	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CNC(=O)c2ccc(Br)o2)cc1C	916562299	NZZCNXRXVBOLNB-UHFFFAOYSA-N	437.250	1.175	50	20	IDGD	
COc1cc(CNC(=O)NNC(=O)Cc2ccc(Cl)cc2)ccc1OCC(=O)N(C)C	916641443	HRWHSDFDPXASJV-UHFFFAOYSA-N	448.907	1.889	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CNC(=O)CC23CC4CC(CC(C4)C2)C3)cc1	916830555	GSBFVDZXUSYRAT-UHFFFAOYSA-N	426.517	1.804	50	20	IDGD	
Cc1ccc(C(=O)NNS(=O)(=O)c2cc(C(=O)O)sc2Br)c(O)c1	917753093	AIARSEIJMBXCNX-UHFFFAOYSA-N	435.277	1.846	50	20	IDGD	
CCc1c(C(=O)OCC(=O)NNC(=O)c2ccc(OC)c(OC)c2)cnn1C(C)(C)C	919387161	MMXRSUGQCVCELE-UHFFFAOYSA-N	432.477	1.836	50	20	IDGD	
O=C(CCc1nc(-c2cc(Br)cs2)no1)NNC(=O)CN1CCCC1=O	920433175	RECJRHCNUOMYSG-UHFFFAOYSA-N	442.295	1.263	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)N[C@H]1CCCN(C(=O)c2ccccc2)C1	1318155545	KBISVARBYPLZBR-HNNXBMFYSA-N	429.502	1.113	50	20	IDGD	
Cn1c(=O)n(C)c2cc(C(=O)N3CC[C@@]4(C3)CN(C(=O)C(C)(C)CCl)CCO4)ccc21	1777864719	MPKXXBPECKSFGL-JOCHJYFZSA-N	448.951	1.586	50	20	IDGD	
Cn1ncc2c(C(=O)N3CC[C@]4(C3)CN(C(=O)[C@H](F)Br)CCO4)cccc21	1778031663	OPOPFJFMUYIGEU-YJBOKZPZSA-N	439.285	1.707	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(CCN(C(=O)c3ccc4ncncc4c3)C2)C1	1778599723	NRRRFQAJDKHLSF-LJQANCHMSA-N	433.306	1.858	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cnc3c(c1)CCNCC3)CCO2	1779298898	LGSYYXPBHQBZLF-QFIPXVFZSA-N	446.624	1.065	50	20	IDGD	
COc1nc(C)ccc1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](C)CBr)CCO2	1779738083	IBKFJLGHTJHRCC-BFUOFWGJSA-N	440.338	1.873	50	20	IDGD	
COc1ccnc(C(=O)N2CC[C@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)c1OC	1780448059	SEGFLLXVVHWOKX-FQEVSTJZSA-N	425.913	1.807	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)COc3ccc(O)cc3)CCO2)C1	1781225308	IDQPIVXKLPMTGU-MOPGFXCFSA-N	431.316	1.837	50	20	IDGD	
O=C(Cc1noc2ccccc12)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781331590	SNFKQOJUVALFKV-AEFFLSMTSA-N	440.269	1.891	50	20	IDGD	
CCn1ccc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](C)Br)C2)n1	1781996856	WAPWOKHUCABRRK-DDUZABMNSA-N	427.343	1.814	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C=N/O[C@H]1CCCCO1)C2	1782175292	GFWQPULZZMQBMT-AZNCZSJYSA-N	445.944	1.283	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H]3[C@@H](O)CCN3Cc3ccccc3)C2)C1	1782813030	WMQJMDJVZSLVEK-IHFIDZABSA-N	449.979	1.469	50	20	IDGD	
CC(=O)N[C@@H](C)C(=O)N1CCO[C@]2(CCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1	1782867659	WNLJEKNNAQBICB-RABVXATESA-N	446.454	1.226	50	20	IDGD	
COc1cc(CCC(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](C)Br)C3)C2)ccn1	1783530268	WGTMRQQIQBKCNI-KUHUBIRLSA-N	440.338	1.636	50	20	IDGD	
CCOc1cnc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](C)Br)C3)C2)cn1	1783532561	PQKRQOGUICKJOV-SJKOYZFVSA-N	427.299	1.102	50	20	IDGD	
CC(C)[C@H](C(=O)N1CC[C@@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1)c1ccc(F)cc1	1783732379	XDKXMQLHWWIPIA-LQWHRVPQSA-N	426.916	1.995	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3c(F)ccc([N+](=O)[O-])c3C)CCO2)C1	1783881663	SODUYRRWCJZPOG-ORAYPTAESA-N	443.859	1.740	50	20	IDGD	
O=C(c1cc(Cl)c2nncn2c1)N1CCO[C@@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783946843	VACSWYICUMKSKF-MRXNPFEDSA-N	432.695	1.630	50	20	IDGD	
CN(C)c1cccc(OCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Cl)C[C@@H]32)c1	1785059475	YRTUQDJFPGMISD-LZLXCTOHSA-N	427.904	1.646	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccs3)[C@H]2C1	1785905899	FATUGOXYJCAMFG-GLYSVQQSSA-N	443.529	1.475	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CC(F)(F)F)[C@H]2C1	1786688553	LQBMAPRBJKXMQM-RJSLJBRQSA-N	443.426	1.053	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)C[C@@H]21	1789866978	TZKSUDSZODPZGY-UQCMEYCASA-N	425.869	1.911	50	20	IDGD	
CC(C)(C)n1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]3C2)n1	1789922644	QGOMCGFARYZNOK-JURCDPSOSA-N	445.333	1.922	50	20	IDGD	
CCN(CC)C[C@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CO[Si](C)(C)C)C[C@@H]21	1790602959	QHCIYHVTUYIIEY-VJANTYMQSA-N	427.662	1.796	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(F)cn3C)C[C@@H]21	1790962136	VMBZRJLJNGXCJC-PCBIJLKTSA-N	430.318	1.931	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3CC=CC[C@H]3C(=O)OC)[C@H]2C1	1791236839	YVHQNAABFPTJFD-PCCRXHMLSA-N	426.941	1.739	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CCc3cccc(Cl)c31)C2)[C@@H](O)CCl	1792984086	SDJQUNMPUFHXGR-WVYJYSKYSA-N	427.328	1.559	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCl	1793113824	SXRUFOOLJZMTQR-OQMKEHIESA-N	439.852	1.372	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(N(C)C)cn1	1794457547	YPKNOSJCPUNBNQ-ZJOBFFGXSA-N	439.354	1.382	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cn(C)cn1	1795279112	QENVPQKACDZXMG-QDMKHBRRSA-N	441.444	1.819	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)c1cc(F)c(F)cc1F	1796189413	KTUIMNHNIWASPM-QDMKHBRRSA-N	432.207	1.349	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc3nccn13)C2	1796893542	FUISIFWILLMOBT-CKFWPPNZSA-N	447.499	1.720	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1Cc2ccccc2O1	1797224591	ANAZOEHPAMBLGX-UIVXMWCNSA-N	437.334	1.611	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCCC#C[Si](C)(C)C	1797730513	JOAMKAMVWMJALV-SFNKJDCFSA-N	429.033	1.881	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1csc(C(F)(F)F)n1	1798258861	VABRKFWBKUMSLM-DTHBNOIPSA-N	441.859	1.619	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc3ccncc13)C2	1798443221	YZRHDNQMDMDRGA-BJWYYQGGSA-N	444.495	1.799	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cn(C(C)(C)C)nn1	1798708426	CSHMBLZWNUIOSE-QVHKTLOISA-N	442.358	1.410	50	20	IDGD	
CC(C)NC(=O)OC(C)(C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(C)(C)CCl)C2	1799128938	ZEEADKBWDIDNNM-QDMKHBRRSA-N	431.961	1.754	50	20	IDGD	
CCOC(=O)[C@@H]1CCC[C@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](Cl)CC)C1	1799264230	DFTGARMGSAIZQL-RFSXOUPVSA-N	428.957	1.963	50	20	IDGD	
COC(=O)[C@H]1CC[C@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@](C)(Cl)CCl)CC1	1799274263	UOWHLDNLNVFMOO-HLROQWKMSA-N	449.375	1.792	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(C#N)ccc1F	1799745034	OJZBLMFCUIFXSS-MBMVNNNZSA-N	438.297	1.932	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(S(C)(=O)=O)ccc1F	1799860824	UNKMSGAPHIHWDF-RBNVPPIJSA-N	446.928	1.450	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnn3ccccc13)C2	1800641242	TXAXHNAKKYUPFC-IARIHHJXSA-N	435.322	1.711	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1C[C@@]12C(=O)Nc1ccccc12	1800761286	YMIAFFTXKMTSMV-PZCNRVBOSA-N	445.947	1.894	50	20	IDGD	
CC[C@@H](NC(C)=O)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)Br)[C@@H]1c1cccnc1	1802884892	UNELEOQSWABRPI-VJUNAUMWSA-N	439.354	1.786	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cnc(OCF)cn2)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803142007	VAOMDLJCDKOYDF-JLJPHGGASA-N	437.859	1.097	50	20	IDGD	
COc1cc(C(=O)NC[C@H]2CCN(C(=O)C(Cl)Cl)[C@H]2c2cccnc2)n(C)n1	1804929104	PUNUMWQKTIKTQV-DOMZBBRYSA-N	426.304	1.947	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2cscn2)[C@H]1c1cccnc1	1805748433	ODBIOZJKHWYTEI-HNAYVOBHSA-N	430.534	1.231	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)[C@@H]2CCCCO2)[C@H]1c1cccnc1	1813068367	LKJZZHRVWHEURJ-WFXMLNOXSA-N	431.537	1.030	50	20	IDGD	
Cc1[nH]ccc1C(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1813071640	VIWGEHXNZUYYPW-LAUBAEHRSA-N	426.521	1.411	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)COc2cccnn2)[C@H]1c1cccnc1	1813391431	MPGMTBSNIXSQRM-DHSIGJKJSA-N	448.321	1.740	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1CCc2nc(NC(=O)CCN3CCOCC3)sc2C1	1814643672	CVOIFJHWIQMTFJ-CQSZACIVSA-N	440.642	1.629	50	20	IDGD	
C[C@@H](CBr)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CS(C)(=O)=O)[nH]n1	1814780304	LJOXVFISBQFHAX-JQWIXIFHSA-N	435.344	1.477	50	20	IDGD	
O=C(N[C@@H]1CCc2nc(NC(=O)[C@@H](F)Cl)sc2C1)c1n[nH]c2c1CS(=O)(=O)C2	1817121552	MZINKFKRPXCUTN-SREIQFSDSA-N	447.901	1.055	50	20	IDGD	
CC[C@H](NC)C(=O)N1CCCC[C@H]1c1cc(NC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)n[nH]1	1818112180	VJOAVLLFXBJPEY-UIVFFXIBSA-N	442.524	1.534	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)Cn2ccccc2=O)[nH]n1)[C@H](F)Br	1820932913	VDDWYPJWEJCYSI-WBMJQRKESA-N	440.273	1.954	50	20	IDGD	
Cc1cc(C)n(CC(=O)N2CCCC[C@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)n1	1822411082	ZXLHCBUGXRQQLU-KRWDZBQOSA-N	444.540	1.288	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(O)n2)[nH]n1	1822413423	VLJOFJQWIYKRRF-OAHLLOKOSA-N	429.481	1.189	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CN2C(=O)CNC2=O)CC1	1824010366	OXUZXRLBJVGNLB-HNNXBMFYSA-N	426.945	1.423	50	20	IDGD	
Cc1noc(C)c1CC(=O)N[C@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1	1826083952	VTLVEXIZLHKMJM-ZDUSSCGKSA-N	448.549	1.276	50	20	IDGD	
CCn1ccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)n1	1827050882	GQEZHSUJAHNMDG-OAQYLSRUSA-N	438.337	1.130	50	20	IDGD	
Cc1ncc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)cn1	1827055779	FPBZEKWVOYPLAC-OAQYLSRUSA-N	436.321	1.012	50	20	IDGD	
O=C([C@@H](O)CCl)N1CCC([C@H]2CCCCN2C(=O)[C@H]2Cc3ccccc3CN2)CC1	1827614450	XXVSFINHSJJCOD-NJYVYQBISA-N	433.980	1.920	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CC(C)(C)O)CC1	1827681190	OHJDPPBNKPTMQU-DUYBAWCLSA-N	445.564	1.901	50	20	IDGD	
C[C@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1)N1C[C@@H]2C[C@H]2C1	1828817189	NSFWHWJXYLTAEN-BVOGOJNSSA-N	447.624	1.319	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)C/N=C/c2ccco2)CC1	1828998424	CZFUUPDXTAAEBM-HSJQUHBMSA-N	445.564	1.691	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)n[nH]1	1829729724	SXQQETODRXPRSQ-LJQANCHMSA-N	439.520	1.264	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(OC)n(C)n2)CC1	1829847172	ZLTSMBUXWVCHSQ-RDJZCZTQSA-N	426.945	1.916	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CN2CCNC2=N)CC1	1830316011	FTTAANHGLQJWSG-KXBFYZLASA-N	432.396	1.682	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(OC)cc3O)C2)C1	1831655263	VKJJZBARXGUZOH-DYESRHJHSA-N	440.924	1.878	50	20	IDGD	
O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)CCc1cccs1)CCO2	1833155812	VLECOTXHPKWEBL-GOSISDBHSA-N	445.379	1.922	50	20	IDGD	
COc1cccc(C(=O)N2CCC(N3CCC(NC(=O)[C@H](O)CCl)CC3)CC2)c1C	1833313021	QPUCTDZPCJMBSF-LJQANCHMSA-N	437.968	1.789	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnc(OC)c(F)c3)CCO2)C1	1833480469	JUBZSOKNZRBTNJ-FOIQADDNSA-N	443.903	1.707	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3coc(Cl)n3)CCO2)C1	1833560014	MMFZGADJBBZDRE-BONVTDFDSA-N	436.690	1.181	50	20	IDGD	
CCc1cnc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCBr)CCO3)C2)s1	1834823438	VCDOGJXXKPGFHT-QGZVFWFLSA-N	446.367	1.561	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)c1ccc2cc[nH]c2c1	1835294585	UMDJZALLASQSCX-FQEVSTJZSA-N	432.952	1.953	50	20	IDGD	
O=C(c1ccsc1)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1	1837407952	UACRSPOPQSFMLR-UHFFFAOYSA-N	442.346	1.354	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)[C@@H]3CCC(=O)N3)CC2)CC1	1837738300	FCESKGHSTJGTKT-WFASDCNBSA-N	430.343	1.047	50	20	IDGD	
C[C@H](C(=O)N1CCC(OC2CCN(C(=O)CO[Si](C)(C)C)CC2)CC1)n1cncn1	1838432473	ZKFOCNLWSGIGPB-MRXNPFEDSA-N	437.617	1.689	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3c(F)cccc3Cl)CCO2)C1	1838871051	DSKIPLYHEVAZQF-KUHUBIRLSA-N	449.306	1.803	50	20	IDGD	
O=C(c1cccc(F)c1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1838911277	JXBGJNMCBQGRIF-PBHICJAKSA-N	433.249	1.586	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccnc4ncccc34)C2)C1	1839147905	GQEMQKWKOBJEAR-LAUBAEHRSA-N	432.908	1.717	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cccnc3)C2)C1	1839152253	SGARUOAPYAITCX-OALUTQOASA-N	430.332	1.317	50	20	IDGD	
CCc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)n(C)n1	1839153090	AJBKZSBJTLTVRO-RTBURBONSA-N	447.363	1.289	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3CCC(O)CC3)C2)C1	1839155300	QIAUABPQNDLKRG-NRERDWFFSA-N	437.364	1.230	50	20	IDGD	
C[C@H](Cc1ccco1)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H](F)Br)CCO2)C1	1839203447	LMXNHEOSPLAAQG-DDUZABMNSA-N	447.301	1.605	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C1(Br)CC1)CCO2	1839205571	MMQOJIBOPWDFIO-INIZCTEOSA-N	437.762	1.635	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3cccnc3)C2)C1	1840031728	ANTXEHPKXASMFB-KXBFYZLASA-N	440.338	1.254	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(Cl)cn3)C2)C1	1840033922	UWUNNTAQKSUNCW-YVEFUNNKSA-N	446.729	1.588	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(C4CC4)cc3)C2)C1	1840155104	PXBVIWHHFMGSDO-KNQAVFIVSA-N	436.936	1.888	50	20	IDGD	
O=C(c1n[nH]c(C2CC2)c1F)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840186637	RNALHHCEAUVMTK-QGZVFWFLSA-N	435.283	1.300	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)C3CC4(CCC4)C3)CCO2)C1	1840604861	BPGMESTVNKMTPC-IFXJQAMLSA-N	429.355	1.807	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(OC)ccc3F)CCO2)C1	1840686681	ZOJJNBQUXLRTNP-OXQOHEQNSA-N	428.888	1.922	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)OC)C1	1841750233	XEYMGAJJESVLGR-KFWWJZLASA-N	447.960	1.372	50	20	IDGD	
O=C(c1cc2ccc(Cl)cc2[nH]1)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843012940	UPHTVNDJRJWYSX-UHFFFAOYSA-N	437.692	1.632	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2n[nH]c3c2CC[C@H]3C)C1	1843727635	GMSUOOQTULWYGP-CBOPYVSYSA-N	437.504	1.410	50	20	IDGD	
Cc1ccc(SCC(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)cc1	1843827661	YSQLDMGDFWZMPU-UHFFFAOYSA-N	439.541	1.603	50	20	IDGD	
COc1cc(C(=O)N2CCCC23CN(C(=O)[C@H](O)CCl)C3)ccc1Br	1845341488	HTHPDPZMLPGLNZ-CYBMUJFWSA-N	431.714	1.874	50	20	IDGD	
CCN(CC)[C@H](C(=O)N1CCCC12CN(C(=O)c1ccc(B(O)O)cc1)C2)c1ccccc1	1845838531	AYDGJGOHFTYDKI-QFIPXVFZSA-N	449.360	1.267	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)N1CC2(CCCN2C(=O)/C(C#N)=C/c2ccc(F)cc2F)C1	1845871365	RPESDSKCBMOXBK-BRYYZUPOSA-N	428.439	1.766	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)C(=O)c2ccc(C)cc2)C1	1846285685	BEJOZCXFHAFQKN-PCLIKHOPSA-N	435.484	1.515	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)c1cc(-c3cccs3)on1)C2	1846385311	OWIUKEKDRYAAOJ-UHFFFAOYSA-N	431.518	1.593	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)cc1F	1847369928	SLHSKKSBJXVPJA-WECDIVOHSA-N	441.463	1.784	50	20	IDGD	
O=C(CN1C(=O)COc2ccc([N+](=O)[O-])cc21)NNC(=O)C12CC3CC(CC(C3)C1)C2	26809011	WQFSSRQDESQYRX-UHFFFAOYSA-N	428.445	1.684	50	20	IDGD	
CCOc1ccc(NC(=S)NNC(=O)CN2C(=O)COc3ccc([N+](=O)[O-])cc32)cc1	28633398	PDFTVQBPYQPJHA-UHFFFAOYSA-N	445.457	1.737	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cc(-c3ccccc3)on2)cc(Cl)c1OCC(N)=O	28793660	ASUUUSAJPYLCDY-UHFFFAOYSA-N	444.831	1.943	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@H]2CCCN(CC(F)(F)F)C2)c2ccccc2c1=O	195617282	JATRQTYUSFOZSI-LBPRGKRZSA-N	425.411	1.452	50	20	IDGD	
CCOc1ccc(C2(CNC(=O)NNC(=O)CNC(=O)c3ccco3)CCOCC2)cc1	726240009	RARBQKGDSSYTRH-UHFFFAOYSA-N	444.488	1.487	50	20	IDGD	
CNS(=O)(=O)c1cccc([C@H](C)NC(=O)NNC(=O)Cc2nc3ccccc3n2C)c1	727608273	OMGOIJJBDJRMIV-ZDUSSCGKSA-N	444.517	1.116	50	20	IDGD	
CSc1nnc(CCCNC(=O)NN[C@@]2(C)CCS(=O)(=O)C2)n1C1CCCC1	728133416	FKBLRYFSAYGMMR-KRWDZBQOSA-N	430.600	1.429	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)Cc2nc(-c3cccs3)oc2C)n1	728727987	ODAPWOGHQVCPSZ-UHFFFAOYSA-N	434.499	1.952	50	20	IDGD	
CCc1ccccc1N1C[C@H](C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)CC1=O	728847729	NFBOABIUTZXSCU-GOSISDBHSA-N	436.516	1.456	50	20	IDGD	
CS(=O)(=O)CCNC(=S)NNC(=O)CCCOc1ccc(Cl)cc1Cl	729157901	KVAZRLMSXCMWPO-UHFFFAOYSA-N	428.363	1.692	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@H]2CCc3c(C)cccc32)cc1	729621086	CLHCFUDAPRJVRU-IBGZPJMESA-N	430.530	1.942	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccccc1Cl)NNC(=O)CCc1ccccc1O	730034151	WJQURJRRGGIFEK-UHFFFAOYSA-N	425.894	1.494	50	20	IDGD	
CS(=O)(=O)Nc1cccc(CC(=O)NNC(=O)c2ccc(Br)s2)c1	730205354	REPRLJSGJVAAKZ-UHFFFAOYSA-N	432.321	1.886	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)NCCc1ccc(OCC(=O)NC2CC2)cc1	731360169	ZOKXXCMHUFRJQM-UHFFFAOYSA-N	428.464	1.599	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)CN1C(=O)N[C@@](C)(c2ccc(F)cc2)C1=O)c1ccccc1	731998183	ZEFQDDFDFLXJBR-VGSWGCGISA-N	426.448	1.934	50	20	IDGD	
O=C(NNC(=O)c1cc(O)nc2ccc([N+](=O)[O-])cc12)c1nn(-c2ccccc2)cc1O	732262766	YFOOYFDTWQTYEE-UHFFFAOYSA-N	434.368	1.815	50	20	IDGD	
Cc1c(C(=O)NNC(=O)CCN2C[C@@H](C)O[C@H](C)C2)nnn1-c1cccc2ncccc12	732263329	LTLVAAJWUVAZIL-HUUCEWRRSA-N	437.504	1.384	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N[C@H](C)[C@H](C)N2CCOCC2)cc1Br	732464840	JVRNGCHXHXDNAB-NEPJUHHUSA-N	429.315	1.511	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)N[C@H](Cc1ccccc1)CN1CCOCC1	732476400	HPAPXQDJXLYQJB-OAQYLSRUSA-N	435.528	1.915	50	20	IDGD	
COC(=O)c1cc(OC(=O)c2ccc(CCNS(C)(=O)=O)s2)ccc1[N+](=O)[O-]	732652459	CJVZJYNIHRFNEC-UHFFFAOYSA-N	428.444	1.754	50	20	IDGD	
CN(CCO)S(=O)(=O)c1ccccc1CNC(=O)NNC(=O)C(C)(C)c1ccccc1	733043634	PTOGHCLBAFPFER-UHFFFAOYSA-N	448.545	1.108	50	20	IDGD	
N#Cc1ccc(N2C(=O)N[C@H](CCC(=O)NNC(=O)c3cccc(Cl)c3)C2=O)cc1	733754774	NGNKGGZKNMVXKA-MRXNPFEDSA-N	425.832	1.878	50	20	IDGD	
O=C(COC(=O)Cc1c[nH]c2ccc(F)cc12)NNC(=O)[C@@H]1COc2ccccc2O1	734597296	HQRWQYNNOGZDLF-SFHVURJKSA-N	427.388	1.380	50	20	IDGD	
C[C@H](CN1CCN(c2ccccn2)CC1)NC(=O)NNC(=O)Cc1c[nH]c2ccccc12	735585260	CSIWNZLCWLHHOQ-QGZVFWFLSA-N	435.532	1.647	50	20	IDGD	
COc1ccc(C(=O)N2CCC(NC(=O)NNC(=O)CC(F)(F)F)CC2)cc1OC	735761800	YKLNDAGEEWMEJZ-UHFFFAOYSA-N	432.399	1.591	50	20	IDGD	
O=C(NNC(=O)N1CCC[C@H](C(=O)c2ccc(F)cc2)C1)c1ccc(-n2cnnn2)cc1	738451282	YXWOANQAAWMYAC-INIZCTEOSA-N	437.435	1.751	50	20	IDGD	
O=C(CCc1nc(-c2ccoc2)no1)NNC(=O)CCN1CCN(c2ccccc2)CC1	739475098	YAVMZHQKHSDFCK-UHFFFAOYSA-N	438.488	1.622	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)Nc2cnn(CC(=O)N3CCOCC3)c2)c1C	741701837	DGHWXJXBZSKSPT-YBFXNURJSA-N	440.504	1.352	50	20	IDGD	
COc1cc(C(=O)NNC(=O)COCc2ccccc2)cc(NS(C)(=O)=O)c1OC	742692597	MCUWAMCZLFLMIT-UHFFFAOYSA-N	437.474	1.053	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NC[C@@H]2CCCN(Cc3ccccc3)C2)c2ccccc2c1=O	743359050	QQVMJXCKCAUQOJ-SFHVURJKSA-N	448.527	1.790	50	20	IDGD	
CS(=O)(=O)c1ccc(OCCCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1	743606001	IMMVOHKJTVSOQQ-SFHVURJKSA-N	434.470	1.237	50	20	IDGD	
COc1cccc(O[C@H](C)CNC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)c1	743672741	LSGPVLTWPBTSBJ-CQSZACIVSA-N	425.445	1.998	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)NC[C@@H]2CCC[C@]23NC(=O)NC3=O)c(C)n1C[C@H]1CCCO1	744630783	VVGINJGSFILOBM-FWIRFEINSA-N	439.516	1.685	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)[C@@H](O)[C@@H](C)c2ccc(C)cc2)cc1OC	745756334	MNGZAEMVORCJRM-XOBRGWDASA-N	430.457	1.481	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)CC[S@](=O)c1ccc2c(c1)OCCO2	746094206	FLOQTGNZXPISPA-PMERELPUSA-N	434.470	1.191	50	20	IDGD	
C[C@@H](CC(=O)NNC(=O)c1ccc(Cl)cc1F)/N=C1/NS(=O)(=O)c2ccccc21	747431876	RVJCHUMHSWUILT-JTQLQIEISA-N	438.868	1.757	50	20	IDGD	
C[C@H](c1ccncc1)N1CCC(NC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])CC1	749221348	GFNJXKVHSNWVBW-OAHLLOKOSA-N	442.476	1.925	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)NCC(=O)N1CCN(c2ccccc2)CC1	749222503	YOZQPCRZXHTGII-MRXNPFEDSA-N	443.479	1.272	50	20	IDGD	
COCCCOc1ccc(C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1	749865872	VZRHNIDJPRSQOK-UHFFFAOYSA-N	449.529	1.492	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)c1ccc(=O)n(Cc2ccccc2Cl)c1	751209838	VZDLELLNAZHGPJ-UHFFFAOYSA-N	444.900	1.803	50	20	IDGD	
CCC(=O)NCc1cc(S(=O)(=O)NNC(=O)COc2ccccc2CC)ccc1OC	751538234	GTPJVTTTZIALQS-UHFFFAOYSA-N	449.529	1.672	50	20	IDGD	
C[C@H](NC(=S)NNC(=O)CNC(=O)c1ccccc1I)C1CC1	751619247	LTXWZMKJQTUVLJ-VIFPVBQESA-N	446.314	1.315	50	20	IDGD	
COc1ccc([C@@H](CNC(=O)NNC(=O)c2ccc(C)o2)N2CCOCC2)cc1OC	752365210	RPLTZGHRFPHISJ-MRXNPFEDSA-N	432.477	1.623	50	20	IDGD	
COC(=O)c1ccccc1S(=O)(=O)N1CCC(C(=O)NNC(=O)c2ccc(C)o2)CC1	752522608	ACDAUNLFCUKHLI-UHFFFAOYSA-N	449.485	1.237	50	20	IDGD	
CC[C@@H](CS(=O)(=O)c1ccccc1)NC(=O)NNc1ccccc1S(C)(=O)=O	752702156	ADJIMZJMFYEQCX-AWEZNQCLSA-N	425.532	1.969	50	20	IDGD	
CN(CCS(C)(=O)=O)C(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1	753041497	OUADNLQOROHICO-HXUWFJFHSA-N	444.557	1.331	50	20	IDGD	
CON(C)S(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)cc1	755534330	KAWYKQZAVJDCHA-GFCCVEGCSA-N	440.453	1.628	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)Nc1cccc(S(=O)(=O)NC2CC2)c1	755585523	NVQBICAXWDKOLT-UHFFFAOYSA-N	432.458	1.365	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)Nc1ccc(NC(=O)[C@@H]2CCCO2)cc1	755640636	KICWKGKSQBWTDG-KRWDZBQOSA-N	436.432	1.246	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)Nc1cccc(C(=O)N2CCOCC2)c1	755927156	RECDTUBLBJBSEU-UHFFFAOYSA-N	436.428	1.274	50	20	IDGD	
CCOc1ccc(Cl)cc1CCNC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	756051091	QDXNEVFYMZAVJR-UHFFFAOYSA-N	429.868	1.901	50	20	IDGD	
CCc1ccc(NC(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)cc1S(N)(=O)=O	756527551	ZUNDMKREASQQEE-UHFFFAOYSA-N	443.526	1.354	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1	756561331	AXWZEMNURGZAJE-UHFFFAOYSA-N	447.521	1.308	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)Nc1ccc(OC)c(S(=O)(=O)NC2CC2)c1	756682875	QJANJNYXEMIDGE-UHFFFAOYSA-N	448.501	1.540	50	20	IDGD	
CCC(=O)c1cc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)ccc1F	757863074	PQHUYSKSVFLTQH-SFHVURJKSA-N	430.388	1.563	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1ccc(-c2ccc(OC(F)F)cc2)s1	758040853	SJCAXFOVDFNXDC-VIFPVBQESA-N	433.458	1.715	50	20	IDGD	
CC1CC(C#N)(C(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)C1	758150901	AMLLBLAZCBXDLO-UHFFFAOYSA-N	426.498	1.866	50	20	IDGD	
O=C(c1ncccc1OCC(F)(F)F)N1CCN(S(=O)(=O)CBr)CC1	758528359	SLDJJWMEIZDFJX-UHFFFAOYSA-N	446.245	1.463	50	20	IDGD	
CN1C(=O)CCc2cc(C(=O)OCC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)ccc21	758578109	FZJUFBPRXJSHNT-UHFFFAOYSA-N	426.385	1.122	50	20	IDGD	
O=C(NCCCSc1nccs1)NNC(=O)c1csc(N2CCOCC2)n1	759590220	IITQDOBAEQFYOU-UHFFFAOYSA-N	428.565	1.563	50	20	IDGD	
O=C(CSCC(F)(F)F)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	761191455	AFSPLNPQFULJNE-UHFFFAOYSA-N	439.481	1.918	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	761786910	KZNYURCOKNWKNY-SFHVURJKSA-N	440.500	1.986	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)c2cc(S(=O)(=O)N(C)C)ccc2Cl)n1	762914680	YLTHXTOCSUELHV-UHFFFAOYSA-N	426.930	1.983	50	20	IDGD	
COC(=O)c1ccc(F)c(NC(=O)C(=O)NNC(=O)c2ccccc2Br)c1	763482003	CGMVOVKEXZUQDQ-UHFFFAOYSA-N	438.209	1.775	50	20	IDGD	
CC(C)(C)c1ccc(OCC(=O)NNC(=O)C(=O)Nc2nc3c(s2)COCC3)cc1	763594900	NNGCHCSIVIPAFX-UHFFFAOYSA-N	432.502	1.678	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCOC[C@@H]1C[C@@H](O)c1ccccc1	763636768	SWFCPTJVZSIGDR-PKOBYXMFSA-N	447.919	1.934	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(C)c(N2CCOC2=O)c1	763663752	NMPSFDUXACRUHO-UHFFFAOYSA-N	442.428	1.125	50	20	IDGD	
COC(=O)N(C)c1ccc(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)cc1	763745257	BHQBTBRFUTVUDR-UHFFFAOYSA-N	439.472	1.428	50	20	IDGD	
COC(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)c2nnc(O)c3ccccc23)c1	763789800	DLGLTMWKSSHFKN-UHFFFAOYSA-N	443.803	1.175	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)c1nc(C2CC2)n(-c2ccccc2Cl)n1	763818371	JTARGBOLDKNXHN-UHFFFAOYSA-N	439.863	1.384	50	20	IDGD	
Cc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccccc1F	763859212	ZAOVPPVNVNHLPN-ZDUSSCGKSA-N	430.436	1.389	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cccc(-n3ccnn3)c2)cc1	763862603	YOIXWKNJEAGTMA-CQSZACIVSA-N	438.444	1.219	50	20	IDGD	
CC[C@@H](C)n1nc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(C(C)=O)cc2)cc1C	763879557	YHQFXRULMNGKJQ-DOMZBBRYSA-N	429.477	1.919	50	20	IDGD	
Cn1ccnc1C(=O)c1ccc(NC(=O)C(=O)NNC(=O)Cc2ccc(Cl)cc2)cc1	763933391	WVKZQKMJDLUZHP-UHFFFAOYSA-N	439.859	1.633	50	20	IDGD	
NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Br)s2)cc1F	763938473	HHRMHGNRNHNIJT-UHFFFAOYSA-N	429.227	1.148	50	20	IDGD	
CCN1CCc2ccc(NC(=O)C(=O)NNC(=O)c3nn(-c4ccccc4)cc3O)cc21	763945431	XTEBSSQQQGOODO-UHFFFAOYSA-N	434.456	1.360	50	20	IDGD	
O=C(NNC(=O)c1ccc(COc2ccccc2)o1)C(=O)Nc1ccc(-n2ccnc2)nc1	763949728	GPYKVIVLRWGKCP-UHFFFAOYSA-N	446.423	1.839	50	20	IDGD	
COc1ccccc1Oc1ccc(NC(=O)C(=O)NNC(=O)c2cnccn2)cc1F	764023676	CJOICTWIJGMVOK-UHFFFAOYSA-N	425.376	1.816	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(OCCNC(=O)OC(C)(C)C)cc2)n[nH]1	764106349	KLRIULZDNDOBGI-UHFFFAOYSA-N	446.464	1.021	50	20	IDGD	
CCN(CC(=O)NNC(=O)c1cccc(C)c1)CC(=O)Nc1ccc2c(c1)OCCO2	764156348	NMHFXWBRPBUPMN-UHFFFAOYSA-N	426.473	1.488	50	20	IDGD	
O=C(CCc1ccco1)NNC(=O)C(=O)Nc1ccc(NC(=O)NC[C@@H]2CCCO2)cc1	764171221	IMDJWUISOYLCIW-KRWDZBQOSA-N	443.460	1.299	50	20	IDGD	
O=C(COC(=O)COC/C=C/c1ccccc1)NNC(=O)[C@H]1COc2ccccc2O1	764196123	LTUSKTIJOJUHAX-MBNRZODZSA-N	426.425	1.247	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)C(=O)Nc1cc(N2CCCC2=O)ccc1F	764242548	GXFYOMBKUDOCRH-UHFFFAOYSA-N	437.431	1.693	50	20	IDGD	
Cc1ncsc1C(=O)NNC(=O)C(=O)Nc1cccc(CN(C)C(=O)C(F)(F)F)c1	764247543	SGZFSPUAFJKAFL-UHFFFAOYSA-N	443.407	1.372	50	20	IDGD	
CN(C)C(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cccc3ncccc23)ccc1Cl	764252332	DXXBQFMFHOJFMP-UHFFFAOYSA-N	439.859	1.990	50	20	IDGD	
CCNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2cc(Br)ccc2O)c1	764277737	NFQLKZRXFVFZEX-UHFFFAOYSA-N	449.261	1.304	50	20	IDGD	
CC[C@@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2O)cc1	764278060	QGXPYEKZEYIIQS-CYBMUJFWSA-N	428.445	1.085	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)C(=O)Nc1ccccc1C(=O)N1C[C@@H](C)C[C@H](C)C1	764298124	OABVVEXCOCJQRE-STQMWFEESA-N	426.477	1.236	50	20	IDGD	
O=C(Cn1c(S)nc2ccccc2c1=O)NNc1c(F)cc(C(=O)NC2CC2)cc1F	764333184	QJQGPXRNGJZGNP-UHFFFAOYSA-N	445.451	1.999	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)cc1N1CCOC1=O	764377394	DFZDOBOMDRFHQC-UHFFFAOYSA-N	448.382	1.709	50	20	IDGD	
CCNC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)c1	764380113	OVPOXJMAVJBLHC-UHFFFAOYSA-N	435.387	1.586	50	20	IDGD	
Cc1cc(I)ccc1NC(=O)C(=O)NNC(=O)c1ncccc1C	764386604	JKETYKSIDSFOIJ-UHFFFAOYSA-N	438.225	1.703	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1cccnc1OCC(F)F	764397083	FMTKQAROYRULDM-UHFFFAOYSA-N	440.428	1.612	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=S)NCCc3cccnc3)CC2)cc1	764519774	XPUYIQGCKXBOJN-UHFFFAOYSA-N	426.590	1.246	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)OC(C)(C)C)c(OCC(F)(F)F)c1	765392096	UTJTVAZKJLCISJ-UHFFFAOYSA-N	435.355	1.909	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765731875	DFLSEGDWYCUUFH-MRXNPFEDSA-N	428.464	1.198	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1cnn(Cc2ccccc2)c1	765732508	IBQRNMRACPUFMV-UHFFFAOYSA-N	446.511	1.150	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)CCNC(=O)c3cccs3)CC2)cc1	765749180	SRTFDGVOLZNWIN-UHFFFAOYSA-N	443.573	1.142	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)N[C@H]1CC(=O)N(c2ccc(Cl)c(F)c2)C1	766551708	GENRLMMKAFRKTH-NSHDSACASA-N	436.827	1.699	50	20	IDGD	
CC(C)(C)OC(=O)N1CCO[C@@H](CC(=O)OCC(=O)NNC(=O)c2cccs2)C1	767491347	KBOXPYHXKTZOLO-LBPRGKRZSA-N	427.479	1.078	50	20	IDGD	
C[C@H](O)CNC(=O)/C(C#N)=C\c1cn(CCC(N)=O)nc1-c1ccc(Br)cc1	769083093	NCIPFPMHZKVUOX-QENILXLESA-N	446.305	1.592	50	20	IDGD	
O=C(NNC(=O)[C@H]1CC(=O)N(c2c(F)cccc2F)C1)c1cnn(-c2ccccc2)c1	770734930	YKQZLAIIOKPUGQ-ZDUSSCGKSA-N	425.395	1.965	50	20	IDGD	
Cc1ccncc1[C@H](C)NC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	771441078	PAUZKIPXGHIRJP-HNNXBMFYSA-N	431.518	1.880	50	20	IDGD	
NS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccc(Br)c(F)c2)cc1	771744130	HEIMIZQRAMTYMN-UHFFFAOYSA-N	431.243	1.317	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)[C@@H](NC(=O)c1ccc(OC)cc1)c1ccccc1	772074844	HGJJMZYTAOKOCU-LIRRHRJNSA-N	427.457	1.655	50	20	IDGD	
CN(CC(=O)NNC(=O)c1cccc(C#N)c1)[C@H](C(N)=O)c1cccc(Br)c1	772405725	UGAOSPHVDMJWSF-KRWDZBQOSA-N	444.289	1.240	50	20	IDGD	
CC(=O)Nc1cc(S(=O)(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)ccc1O	773266981	VFNFPJKYCQMZOP-SNVBAGLBSA-N	427.866	1.781	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)C(=O)Nc2ccc(C(=O)N(C)[C@@H]3CCCN(C)C3)cc2)n1	773478206	LBFJWJLAQKXBIJ-GOSISDBHSA-N	439.520	1.341	50	20	IDGD	
CN(C1CCCCC1)S(=O)(=O)c1cccc(NC(=O)C(=O)NNc2ncccn2)c1	773721660	RNRAUNIRBAJVDK-UHFFFAOYSA-N	432.506	1.512	50	20	IDGD	
O=C(NCCc1cnccn1)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1	774697244	KXGPKFUWXOBZIX-JOCHJYFZSA-N	430.512	1.977	50	20	IDGD	
CC[C@@H]1Oc2cc([C@@H](C)NCC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)ccc2NC1=O	775462636	BDWORYVPBYMAHX-PXAZEXFGSA-N	441.444	1.816	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)Nc1ccc(S(=O)(=O)NC(C)(C)C)cn1	776061768	AQJMBWIDERIYIY-UHFFFAOYSA-N	449.533	1.953	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1=O	776180569	FSQWWSQLNGVJGJ-DGCLKSJQSA-N	432.399	1.193	50	20	IDGD	
CCc1ccccc1S(=O)(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1	777596853	CTADJSQTWPCQOR-UHFFFAOYSA-N	425.532	1.188	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)[C@H](O)[C@H](O)c1nc2ccccc2[nH]1	779581990	JPGQOYDRJQIXKR-JKSUJKDBSA-N	437.481	1.850	50	20	IDGD	
Cc1cc(N2C[C@H](C(=O)OCC(=O)NNC(=O)c3ccc(C#N)cc3)CC2=O)ccc1F	780182085	MOYJXUKLEYXDOA-MRXNPFEDSA-N	438.415	1.363	50	20	IDGD	
CC(C)S(=O)(=O)c1ccc(CC(=O)NNC(=O)c2cc(Br)c[nH]2)cc1	781137146	PKOFRNMVZNDITL-UHFFFAOYSA-N	428.308	1.963	50	20	IDGD	
COc1ccc(NNC(=O)c2ccc(OC)c(S(=O)(=O)NCc3ccccn3)c2)nc1	782047026	WJPIKJIRLMUQAY-UHFFFAOYSA-N	443.485	1.729	50	20	IDGD	
CC(=O)N1CCN(c2cccc(NC(=O)C(=O)NNc3ccccc3[N+](=O)[O-])c2)CC1	782124696	SNRGHMJFZKUOPD-UHFFFAOYSA-N	426.433	1.345	50	20	IDGD	
CC[C@H](C)NS(=O)(=O)c1cccc(NC(=O)C(=O)NNc2ncncc2Cl)c1	782165920	LYHJWLOZQALHIQ-JTQLQIEISA-N	426.886	1.289	50	20	IDGD	
CCOc1cc(C)ccc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)NC(C)C)cn1	783265912	ZWBINQCRLLWUQF-UHFFFAOYSA-N	435.506	1.557	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1ccc2c(c1)nc(C)n2C	785330000	BNTGETZMYQMXPG-UHFFFAOYSA-N	431.474	1.376	50	20	IDGD	
CN(NC(=O)Nc1ccc(F)c(C(N)=O)c1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	785838199	XIIREXKAQAPVDU-UHFFFAOYSA-N	438.460	1.566	50	20	IDGD	
O=C(NNC(=O)N1CCC[C@H](Oc2ncccc2F)C1)c1ccc(-n2cnnn2)cc1	787734583	CQEJILNYKZENPS-HNNXBMFYSA-N	426.412	1.094	50	20	IDGD	
COc1cc(F)ccc1NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1	788190765	NOZHKPOEJLZVHJ-UHFFFAOYSA-N	436.509	1.592	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)C(=O)Nc2nc(C)c(C)s2)c1	789736013	YUPNYWYVMKKOEX-UHFFFAOYSA-N	427.280	1.931	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(Cc3nnc4n3CCC4)cc2)cc1	792268090	KTBPIXAUXFWEDM-UHFFFAOYSA-N	448.483	1.288	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3n2)cc(-n2cccn2)c1	792349719	BJOFAVHHOUIFHB-UHFFFAOYSA-N	430.424	1.829	50	20	IDGD	
COc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NNC(=O)c2cc3ccccc3cc2O)cc1	792521625	POXNUQWFYUQEAL-ZDUSSCGKSA-N	443.481	1.682	50	20	IDGD	
CC(C)C(=O)Nc1nc(CC(=O)NNc2ccccc2S(=O)(=O)N(C)C)cs1	795168713	SMQIWLNYERFOHI-UHFFFAOYSA-N	425.536	1.674	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN(C)CCc2nc(-c3ccccc3)no2)cc1OC	796388034	KYAXAQNVUGCBSI-UHFFFAOYSA-N	439.472	1.689	50	20	IDGD	
C[C@@H]1CCN(C(=O)OC(C)(C)C)[C@H](C)[C@H]1NCC(=O)NNC(=O)c1cccc(C#N)c1	796646380	AYBRUKDKAZBUHK-CLCXKQKWSA-N	429.521	1.943	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2cnn(-c3ccccc3)c2C(F)(F)F)n1	797369791	JXYAGVXYJNXZSG-UHFFFAOYSA-N	432.362	1.994	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)C[C@@H](C)O1	798105749	DYLHBJLKBXRSNL-ZIFCJYIRSA-N	432.521	1.434	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)Cc2ccc(S(=O)(=O)N(C)C)cc2)c2ccccc2n1	798126314	SDQJFHARTBWXSW-UHFFFAOYSA-N	426.498	1.797	50	20	IDGD	
COCCOc1cc(OC)ccc1C(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	802065196	QOHBIXUSMIOKMN-UHFFFAOYSA-N	437.474	1.590	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H]2CCc3ccccc3OC2)c1	802403158	CIOPLALXVHNFHQ-INIZCTEOSA-N	432.502	1.275	50	20	IDGD	
COC(=O)c1c(F)cc(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)cc1F	802566654	ZPPUXWMYWWSTNP-UHFFFAOYSA-N	446.410	1.290	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)C(C)(C)OC(C)=O)c1	806337339	CQCIENPOIMQGHD-UHFFFAOYSA-N	449.485	1.599	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)C(=O)Nc2ccc(F)c(N3C(=O)CCC3=O)c2)c1	806968212	BUYJAWWOGRYUGR-UHFFFAOYSA-N	428.376	1.348	50	20	IDGD	
COC(=O)c1cc(C)c(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)c(Cl)c1	806974508	KZLIHUQZDWGOIU-UHFFFAOYSA-N	444.831	1.472	50	20	IDGD	
CCOC(=O)C(C)(C)c1csc(NC(=O)C(=O)NNc2ccc3c(=O)[nH]ccc3c2)n1	807080108	OAVZLPUQGXRTEA-UHFFFAOYSA-N	443.485	1.907	50	20	IDGD	
CCOC(=O)C(=O)c1cc(S(=O)(=O)NNC(=O)c2ccc(C(C)(C)C)cc2)cn1C	808068665	DYLCNVIGMMMVTC-UHFFFAOYSA-N	435.502	1.692	50	20	IDGD	
CN(C)CCCOc1cnccc1CNC(=O)NNC(=O)Cc1cn2ccccc2n1	808347488	MFYXPCBQCIIMII-UHFFFAOYSA-N	425.493	1.133	50	20	IDGD	
Cn1nnc2c1C[C@H](C(=O)NNC(=O)c1nc(-c3ccccc3)n(-c3ccccc3)n1)CC2	809981629	RGHORXBQMHJDLD-MRXNPFEDSA-N	442.483	1.629	50	20	IDGD	
N#Cc1ncn(-c2ccccc2NC(=O)C(=O)NNC(=O)c2cccc3ccccc23)n1	810384436	KSGMLAJDRRTNID-UHFFFAOYSA-N	425.408	1.692	50	20	IDGD	
NS(=O)(=O)c1ccc(C=NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)cc1	811645416	LIVJOWIWSXIQST-UHFFFAOYSA-N	449.964	1.255	50	20	IDGD	
CCCCN(C)C[C@H](C)NC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	812458147	XPTRBJRXFTVKDF-INIZCTEOSA-N	439.582	1.536	50	20	IDGD	
C[C@@H]1CCCN(c2cc(C(=O)OCC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)ccn2)C1	812653750	PBSCRZPCZJGOLX-CQSZACIVSA-N	441.444	1.844	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN[C@@H](C)c2ccc(N3CCCNC3=O)cc2)n1	812901987	CNCTVZDFJCQLLM-AWEZNQCLSA-N	430.534	1.412	50	20	IDGD	
CC(=NNC(=O)[C@H]1CCS(=O)(=O)C1)c1cc(Br)ccc1OCC(=O)O	814781861	OALBPIHQBFDICP-JTQLQIEISA-N	433.280	1.187	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)cc1)[C@H]1C[C@@H]1C	815608321	XKGLWTHHFRTJHU-LIRRHRJNSA-N	448.483	1.424	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)C2CCN([C@@H]3CCSC3)CC2)c2ccccc2c1=O	816805977	NOCCCMMDVJTPNW-MRXNPFEDSA-N	443.573	1.956	50	20	IDGD	
O=C(NNS(=O)(=O)c1cnc(Cl)c(Br)c1)c1ccc2c(c1)OCCO2	821136015	ZJDFMIDXQLIHRN-UHFFFAOYSA-N	448.682	1.892	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)[C@@H]2CC(=O)N(c3ccc4c(c3)OCCO4)C2)c1	825777353	VMIVPTSYBAUSTM-CQSZACIVSA-N	440.456	1.079	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)CCS(=O)(=O)c2ccc3c(c2)OCCO3)cc1C	864001928	VHJWKXRGQHDZRA-UHFFFAOYSA-N	448.497	1.465	50	20	IDGD	
O=C(c1cccnc1N1CCN(Cc2cccc(Cl)c2)CC1)N1CC[C@@H](B(O)O)C1	864232197	WZFWBLUJEXVSNJ-QGZVFWFLSA-N	428.729	1.746	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)[C@@H]2CC(=O)N(c3ccc4c(c3)CCC4)C2)c2ccccc2c1=O	914280320	LOELGLVTGXJHNI-MRXNPFEDSA-N	445.479	1.236	50	20	IDGD	
CN(CC(=O)NNC(=O)c1ccc(-c2ccc(F)cc2)s1)[C@H]1CCS(=O)(=O)C1	914531860	JGRWFYCPGBSPCU-AWEZNQCLSA-N	425.507	1.434	50	20	IDGD	
Cc1ccn(-c2ccc(C(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)cc2)n1	915635747	MSSZOKAXLKVJAD-UHFFFAOYSA-N	427.486	1.506	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NN=Cc2ccc(N(C)CCO)cc2)c1	916261139	XAWCMEHVYHFJMN-UHFFFAOYSA-N	432.546	1.910	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)NC1CCN(CCc2ccccc2)CC1	916382771	ODHBEDVQTSJPAQ-UHFFFAOYSA-N	434.500	1.987	50	20	IDGD	
CC(=NNC(=O)C(=O)Nc1ccc(C)cc1)c1ccc(OCC(=O)N2CCOCC2)cc1	917032274	WSVMVSZAPPOCOK-UHFFFAOYSA-N	438.484	1.712	50	20	IDGD	
COc1ccc(CNC(C)=O)cc1S(=O)(=O)NNC(=O)c1ccc2ccccc2n1	917713653	MZZRJAIVQDFTNS-UHFFFAOYSA-N	428.470	1.503	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C1CCN(S(=O)(=O)c2ccccc2)CC1	919820579	QXTUDJMRWWAXQS-UHFFFAOYSA-N	431.514	1.486	50	20	IDGD	
O=C(CS(=O)(=O)Cc1cccc(Br)c1)NNC(=O)NCC(F)(F)F	920211501	RSDKIODXKZSZTG-UHFFFAOYSA-N	432.218	1.257	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)c2cn(Cc3ccccc3)nn2)CC1	1251915096	QQTCZKHHUCDDPZ-UHFFFAOYSA-N	428.493	1.735	50	20	IDGD	
COc1cc(OC)cc(C(=O)N2CCC(C(=O)NNc3nncc(N)c3Cl)CC2)c1	1253124044	ONLYSJPSOWNBAA-UHFFFAOYSA-N	434.884	1.725	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)NCc1ccccc1NS(C)(=O)=O	1317883385	OJLSKESDUMEVIN-UHFFFAOYSA-N	426.882	1.864	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NCc2ccccc2N2CCN(C)CC2)cc1C	1318293242	HYXOMTTZGIMFMV-UHFFFAOYSA-N	425.533	1.965	50	20	IDGD	
CNS(=O)(=O)c1ccc(CC(=O)NNC(=O)NCc2cccc(C(F)(F)F)c2)cc1	1320152391	HNZCCCLAHNUXQB-UHFFFAOYSA-N	444.435	1.687	50	20	IDGD	
Nc1cnnc(NNC(=O)[C@H]2CCN(c3ccccc3Br)C2=O)c1Cl	1322679279	IGROSWPWMVJXOM-MRVPVSSYSA-N	425.674	1.971	50	20	IDGD	
C[S@](=O)c1ccc(NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1	1323829692	LMOQAIYIVQKYKL-PMERELPUSA-N	429.546	1.789	50	20	IDGD	
N#CC1(c2ccccn2)CCN(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)CC1	1325172424	DZFXJFBFRUDCOD-UHFFFAOYSA-N	434.504	1.386	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccnc3ncccc13)CCO2	1779298727	IJHFNDDEJCUWIS-OAQYLSRUSA-N	428.565	1.925	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3c(OC)cccc3OC)C2)C1	1780540673	ADXUEVZQFXKHOR-VLIAUNLRSA-N	426.897	1.401	50	20	IDGD	
CN(C)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781327783	AANJRFAXSALCGR-PBHICJAKSA-N	429.290	1.282	50	20	IDGD	
O=C(c1cccc(C(F)(F)F)c1F)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1781624016	HUCWGAOJYBXDPE-CXAGYDPISA-N	438.805	1.888	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3c(F)cc(OC)cc3F)C2)C1	1781709759	LACUINNGLDZUDJ-BFUOFWGJSA-N	432.851	1.671	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccccc3-n3nccn3)C2)C1	1781840494	VFTGRKQTPDJONU-LIRRHRJNSA-N	448.321	1.494	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1nnc(C)o1)C2	1781900826	TVGDWWIDCLNGQS-HBUWYVDXSA-N	443.342	1.608	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1nccc3nc[nH]c13)C2	1782172408	AVZXMOLXLYHIQN-XBHMSOGKSA-N	435.912	1.339	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C=N/O[C@H]1CCCCO1)C2)C(Cl)Cl	1782217951	DOQSGUNUQAGBHS-USJDNNDHSA-N	436.336	1.833	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H]2CCc3nc[nH]c3C2)C1	1782456153	FWALHOMFOIDSCN-DKZVUGQWSA-N	448.640	1.880	50	20	IDGD	
Cc1nccn1[C@@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Br)C2	1782626183	IVCVIOZXMZSPDH-WLLUSJSYSA-N	445.333	1.957	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccc4cncn4c3)CCO2)C1	1783349741	SBFWZHRIXOUHQR-VQIMIIECSA-N	435.322	1.951	50	20	IDGD	
COc1cccc(CC(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](C)Br)C3)C2)c1	1783532523	JMKATWMCXDCSKV-KUHUBIRLSA-N	425.323	1.851	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)CCOCCOCCOC)C2)C1	1783661545	KCFGYLMCHVWHOM-FXAWDEMLSA-N	434.961	1.294	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)NC(=O)OC(C)(C)C)C[C@@H]21	1784620052	ICZMTQARILKECG-JBXGNFEISA-N	447.960	1.217	50	20	IDGD	
Cc1nn2cc(CC(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)[C@H](F)Cl)C[C@@H]43)nc2s1	1784849537	HTRJGAZUWRJUDS-NHULGOKLSA-N	429.905	1.156	50	20	IDGD	
CC(C)(CCl)C(=O)Nc1ccc(C2(NC(=O)c3cc(=O)n4[nH]nnc4n3)CCC2)cc1	1786011814	AOHHSCBPACOSGP-UHFFFAOYSA-N	443.895	1.825	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3ccc(F)cn3)[C@H]2C1	1787034598	YEQCSYWUMZNVBF-BMYCAMMWSA-N	432.323	1.979	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Cl)C[C@@H]21)c1ccc(Br)cn1	1788831506	BTCGRGZWUGJUPW-DTCNJJKHSA-N	434.693	1.972	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3c(F)cncc3F)C[C@@H]21)[C@@H](F)Br	1789924615	PFGYYQDKMJZIIR-XYDQJSOLSA-N	436.228	1.644	50	20	IDGD	
COc1ccc(F)c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](O)CCl)C[C@@H]32)c1OC	1790157047	BUJJMORLBBCCRV-DUPGQFARSA-N	444.887	1.036	50	20	IDGD	
Cn1nc2c(c1C(=O)NC[C@@H]1OC[C@@H]3CCN(C(=O)[C@H](F)Br)C[C@@H]31)CCC2	1790463044	ZUSDBLRMMMRRBF-ZAJUMQRFSA-N	443.317	1.193	50	20	IDGD	
Cc1ccc([C@@H](C)C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]32)cc1	1790944956	NVGKAHGFENOYFF-HZEGPAAWSA-N	444.576	1.451	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(C)(C)NCCC#N)C[C@@H]21	1790961304	IALHBLYQRKSNLP-JONQDZQNSA-N	443.386	1.421	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3ccccc3F)[C@H]2C1	1791768521	SIHYSCDCHNGPPW-BJLQDIEVSA-N	448.539	1.111	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CC[C@H]3CCOC3)[C@H]2C1	1791818341	RUEZYRPSIUCKIW-VIQHNZTISA-N	431.371	1.956	50	20	IDGD	
CCC[C@@H](NC(C)=O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21	1792182216	LFKMFDURVKCENV-JONQDZQNSA-N	432.359	1.056	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1C[C@@H]1c1ccc(F)cc1	1792907886	ABWNMPZFEPKYIG-USYVTKNRSA-N	430.524	1.940	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](CCO)NC(=O)OC(C)(C)C	1793250018	NZPJIXJUGOVLFR-JKJDWNRSSA-N	447.960	1.154	50	20	IDGD	
C[C@@H](S)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1793879283	VUCQNYAWSGMEJU-PEBLQZBPSA-N	435.974	1.026	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1ccc(F)cc1Cl)c1cccc(B(O)O)c1	1793988310	YBHCTIQUTXNBSO-REPLKXPHSA-N	444.699	1.653	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@]1(C)CCCN1)C2	1794142448	NDISYWQOCJJWGD-QKQGURCUSA-N	442.988	1.899	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc3ccc(F)cn13)C2	1795116363	BUMKYEYHEVHDCU-DPIQGUFMSA-N	439.285	1.462	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1noc2c1CCCC2	1796150880	YUTFFYJYUMCOOY-JFILPPLUSA-N	440.338	1.788	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)c1ccc(Cl)nc1Cl	1796191817	BQCOYEHYAVHJBW-QDMKHBRRSA-N	448.115	1.634	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccnn1CCOC	1797057952	FQRFMMNUIAFRMX-XGUBFFRZSA-N	427.343	1.955	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cn2cc(F)ccc2n1	1797429736	NYDFQIUSSHQREV-FIXGWNCBSA-N	443.306	1.913	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](N)c1cccc(Cl)c1)C2	1797954794	KQCPAZZGXTZKTK-WTLGNFPFSA-N	440.016	1.781	50	20	IDGD	
Cc1nc2ncccn2c1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CO[Si](C)(C)C	1797955858	KPOPUJKWKCKADY-SCAQPMJSSA-N	431.569	1.092	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc[nH]n1)C2	1799219622	YLSJQKQDQJCORE-BTTYYORXSA-N	427.417	1.809	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccc(C)c([N+](=O)[O-])c1	1799331625	SROGBSLQFGHESP-RCJHGTSTSA-N	439.896	1.289	50	20	IDGD	
Cc1nc[nH]c1CSCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Br	1799350371	XHZRFXNYCUFSAW-JLUCKKNBSA-N	449.346	1.231	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](F)Br	1800159041	LUMNFWUNKDDWLJ-RPHACJDCSA-N	442.289	1.449	50	20	IDGD	
COc1cc(F)c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)c(F)c1	1800476939	JYHJZBPEHYSSQP-MUJYYYPQSA-N	444.243	1.219	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)[C@@H]1CCc2ccccc2O1	1800954600	WIKXBQOENACJRQ-KUHBDSFDSA-N	441.297	1.660	50	20	IDGD	
Cn1ncc2cc(C(=O)N3CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]3c3cccnc3)ccc21	1803142867	LICGQBXRXRQMGO-UXPWSPDFSA-N	441.919	1.888	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cccc3ccnn23)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803146489	BFGSIFAGJZYQLT-ZYSHUDEJSA-N	427.892	1.649	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)CN2CCN(C)CC2)[C@@H]1c1cccnc1	1803692957	BETQONGQXILHSJ-IRFCIJBXSA-N	436.000	1.742	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2cccnc2C(N)=O)[C@@H]1c1cccnc1	1804812278	SBXFGTOZDSOZLC-HFTRVMKXSA-N	429.908	1.913	50	20	IDGD	
Cn1c(C(=O)NC[C@@H]2CCN(C(=O)CO[Si](C)(C)C)[C@H]2c2cccnc2)cccc1=O	1805313998	ADRAEQBNGBDLKE-UWJYYQICSA-N	442.592	1.951	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H](CNC(=O)C(=O)N(C)C)[C@@H]1c1cccnc1	1806936758	RBWFJCUHKYZGCS-YUELXQCFSA-N	425.327	1.207	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)Cc2cscn2)[C@@H]1c1cccnc1	1807496879	AZCXRGRBFFRANN-IERDGZPVSA-N	444.561	1.160	50	20	IDGD	
CCOCC(=O)N1CC[C@H](CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@@H]1c1cccnc1	1808413468	BBDZPDNIIYBDCL-QOZRKGCKSA-N	440.504	1.258	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)c2cocn2)[C@@H]1c1cccnc1	1808414835	MDUDSWSPAZXSBC-RUVVGEKZSA-N	449.471	1.523	50	20	IDGD	
C[C@@H]1CC[C@H](C(=O)NC[C@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)O1	1809560116	YPUHMKSCPFGQGD-FLTJSSMESA-N	431.537	1.028	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2cc3ncccn3n2)[C@H]1c1cccnc1	1809766992	DDPSCQWHKAWLCM-JTDSTZFVSA-N	442.907	1.698	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)CN3CCOCC3)sc2C1	1814572675	VMORZOSNDULJFK-WDEREUQCSA-N	431.356	1.171	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)CCBr)[nH]n1)c1cccc(=O)n1O	1816146509	JGTXABOURMTNAS-GFCCVEGCSA-N	438.282	1.900	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](C)CN)n[nH]1	1817223736	OJQOCVVSKWNMBG-DBPLZXHISA-N	428.497	1.131	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CN(C)C)[nH]n1	1818111495	NWZUUUBNOBQMNW-DXRSZSRVSA-N	428.497	1.097	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](F)Br)CC2)c1cc[n+]([O-])cc1	1821053565	UBQVKIYOFZIMHH-BXKDBHETSA-N	429.271	1.693	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@H]1c1cc(NC(=O)C[C@@](C)(O)CC(=O)O)n[nH]1	1822413557	IXZYYRONFXXLNJ-QAGHZCBJSA-N	445.314	1.801	50	20	IDGD	
CC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CN1C(=O)CSC1=S)CC2	1822857487	IMNNLBSOPYXBGJ-RKDXNWHRSA-N	447.007	1.933	50	20	IDGD	
CCC[C@H](NC(C)=O)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](Cl)COC)[nH]n1	1823441893	CHWIJPUIVQPIFL-DZKIICNBSA-N	427.933	1.960	50	20	IDGD	
CSCC[C@@H](O)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCBr)CC2	1826125099	UGVIHGKHXJKOBK-MWLCHTKSSA-N	436.397	1.954	50	20	IDGD	
O=C(c1cc(=O)nc2cccnn12)N1CCC([C@H]2CCCCN2C(=O)[C@@H](F)Cl)CC1	1827610921	SDFGDKCANVYTIF-RDTXWAMCSA-N	435.887	1.857	50	20	IDGD	
C[C@H](C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2)c1ccccc1	1828230980	WWFFXCCJMPNEQF-KBXCAEBGSA-N	449.341	1.852	50	20	IDGD	
Cc1ncc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)CC2)[nH]1	1828923786	XXDGTSBSUZRVOS-LJQANCHMSA-N	439.520	1.264	50	20	IDGD	
Cc1ocnc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1	1829430552	DELQEFZNVDPPMV-IBGZPJMESA-N	425.294	1.210	50	20	IDGD	
O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(Cl)nc1)CCO2	1829505251	LKTRQTLKJYBHAZ-QGZVFWFLSA-N	446.729	1.590	50	20	IDGD	
COC(=O)CCCCCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830370163	JQNHIGZKCPORGI-OAQYLSRUSA-N	446.972	1.831	50	20	IDGD	
Cc1n[nH]c(C)c1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)CBr)CCO2	1830539096	AYFPIUUHLPHUJP-KZULUSFZSA-N	443.342	1.128	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CCCCN1C)CCO2	1830775300	LPHKCQCUCYBQNY-BXWFABGCSA-N	446.386	1.101	50	20	IDGD	
Cc1csc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCBr)C3)C2)c1	1831773621	OSFRMRSTYYZGEB-QGZVFWFLSA-N	431.352	1.912	50	20	IDGD	
Cc1onc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)c1C	1831978382	TWICWPRONBDQHV-LJQANCHMSA-N	425.558	1.213	50	20	IDGD	
Cc1onc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)c1C	1831981659	GPDAYODHTDHJIY-CJNGLKHVSA-N	434.262	1.052	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)C[C@@H]3CCCCO3)CCO2)C1	1832351494	PDCBUTGLTFVNON-BXWFABGCSA-N	447.370	1.576	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)N1CCC(N2CCC(NC(=O)C(C)(C)CCl)CC2)CC1	1833214522	FHOMGCBDXHGWMA-OAHLLOKOSA-N	444.020	1.531	50	20	IDGD	
COc1ccc(C(=O)N2CCC(N3CCC(NC(=O)[C@@H](O)CCl)CC3)CC2)c(O)c1	1833313242	BQJFXCFFVLEMBT-IBGZPJMESA-N	439.940	1.186	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)c3cnnn3C)CC2)CC1	1833896405	HBJRVMXGHPOJJD-CYBMUJFWSA-N	441.374	1.031	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)c3cnccn3)CC2)CC1	1834122185	STMVCKRVIBYHJX-AWEZNQCLSA-N	438.370	1.693	50	20	IDGD	
Cc1cncc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)c1	1834287449	HDRXGFMSIGVGED-RDTXWAMCSA-N	426.311	1.243	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(CN(C(=O)CCBr)CCO2)C1	1834823397	RRYUSHLFBBMDGI-INIZCTEOSA-N	437.407	1.079	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC1CCN(C2CCN(C(=O)c3cnsn3)CC2)CC1	1835835380	XMKBMMXLWZHJTG-UHFFFAOYSA-N	425.631	1.575	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC1CCN(C2CCN(C(C)=O)CC2)CC1	1836107461	OQNYRKSCIDQYRT-UHFFFAOYSA-N	432.477	1.725	50	20	IDGD	
O=C(CC12CCCN1CCC2)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836718084	PPMBXEFWAJFFQP-IBGZPJMESA-N	442.000	1.603	50	20	IDGD	
C[C@@H](C(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1)n1ccccc1=O	1837680368	IQBNLGMAPJSDPS-HRAATJIYSA-N	439.940	1.131	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3n[nH]c4ccccc34)C2)C1	1837713334	XLXSVEDCWWSOAM-NRFANRHFSA-N	446.580	1.484	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)COc3ccccc3OC)C2)C1	1839141516	KJKVWEXMMOWESX-IIBYNOLFSA-N	440.924	1.548	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnn4c(C)cc(C)nc34)C2)C1	1839144496	BUMVWHBXMAMALT-DYESRHJHSA-N	449.939	1.434	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C=C/c3cccnc3)C2)C1	1839150743	WHKMSHMCFDDFBT-WEPWYQGCSA-N	442.343	1.788	50	20	IDGD	
Cc1ccc(F)c(C(=O)N2CCO[C@]3(COCCN(C(=O)CCBr)C3)C2)c1	1839311447	UHWVKOXNZFHQEM-IBGZPJMESA-N	443.313	1.989	50	20	IDGD	
O=C(c1cc(F)cc([N+](=O)[O-])c1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1839353797	QRZHNEGDKUVZAN-RHSMWYFYSA-N	433.795	1.338	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc4ccoc4cn3)CCO2)C1	1839487142	SNTVKMYGQGRQEG-YWZLYKJASA-N	437.880	1.152	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(C)n4ccnc4n3)CCO2)C1	1839550327	CGBGHKGHCQXGSB-FOIQADDNSA-N	435.912	1.125	50	20	IDGD	
C[C@H](CC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1)Oc1ccccc1	1839746979	GBWVJVIVKRDVEL-ZTNFWEORSA-N	428.888	1.835	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccncc3)C2)C1	1839963210	DSTPTYGUVYYOFT-MAUKXSAKSA-N	426.311	1.325	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3CCC(O)CC3)C2)C1	1839967569	QKOKKFBTHYUMNM-IADFQQGMSA-N	447.370	1.167	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccnc4ccccc34)C2)C1	1840152190	AOTGZERJLNANOL-XMSQKQJNSA-N	447.919	1.559	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@]1(C)CC=CCC1)CCO2	1840557874	GEUITGROEGDJKI-ZYSHUDEJSA-N	429.355	1.973	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(C)c3Cl)CCO2)C1	1840693232	NYGGXRMSIJHTLT-UZLBHIALSA-N	445.343	1.972	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1ccc(O)cc1F)C2	1843416737	VCZHAPLPDVMFGK-ZMOGYAJESA-N	427.436	1.482	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC2(CCCN2C(=O)c2cccc(N3CCOCC3)n2)C1	1843528133	CONMCABNYQAOLI-LJQANCHMSA-N	441.359	1.972	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)[C@@]1(C)CCCN1)C2	1844692975	INTQLKUEXZAPBM-HXUWFJFHSA-N	430.461	1.479	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCCC12CN(C(=O)CCOCCOCCOC)C2	1846072610	HQUOLCBMBXFKNK-OAHLLOKOSA-N	435.359	1.433	50	20	IDGD	
CC(=O)N/C(=C\c1ccccc1)C(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	8773995	LRHJZPNMFHMKNT-YVLHZVERSA-N	426.385	1.076	50	20	IDGD	
Cc1ccc(N2C(=O)C[C@H](C(=O)NNC(=O)C(=O)NC3CC3)[C@@H]2c2cccs2)cc1	11684139	JHFAVOVRPURSTG-MAUKXSAKSA-N	426.498	1.577	50	20	IDGD	
O=C(CSc1nnc(NC[C@H]2CCCO2)s1)NNC(=O)c1cccc([N+](=O)[O-])c1	16330849	JFFOGZOZGNFGRW-GFCCVEGCSA-N	438.491	1.591	50	20	IDGD	
COc1ccc(Cn2nnnc2SCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1	16368794	QKLOZILLPVIAFD-UHFFFAOYSA-N	443.445	1.192	50	20	IDGD	
CCCn1c(C)cc(/C=C(\C#N)C(=O)O[C@H](C)C(=O)N(C)[C@H]2CCS(=O)(=O)C2)c1C	16793210	KBNBUOKVBDJPOC-GHXXYLLISA-N	435.546	1.999	50	20	IDGD	
COCCOc1ccccc1C(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1	108756351	NFLCEFVDXRVHJO-UHFFFAOYSA-N	435.502	1.102	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1csc(-c2cnccn2)n1	728379914	PHMUKVHXVZPAPE-UHFFFAOYSA-N	447.860	1.880	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)CCn2cc([N+](=O)[O-])nc2C)c1	728526201	MACXHMQZGMJBLO-UHFFFAOYSA-N	426.227	1.722	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc(F)cc1)NNC(=O)c1cccc(OC(F)F)c1	728545412	HCNLTEOLQBTGTP-UHFFFAOYSA-N	431.392	1.557	50	20	IDGD	
CCS(=O)(=O)N1CCC[C@@H](C(=O)NNC(=O)c2cc(F)ccc2Br)C1	728546506	WJPFKOKFJPAEIQ-SNVBAGLBSA-N	436.303	1.411	50	20	IDGD	
CC(=O)N[C@H](CC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)c1c(F)cccc1F	728846960	XWILHFRDNDAQDD-QGZVFWFLSA-N	446.458	1.386	50	20	IDGD	
CC(C)[C@@H]1CCC[C@@H](NC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)C1	729058854	QZAGGBQETVURGS-IAGOWNOFSA-N	438.598	1.859	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCCN(C)C(=O)OC(C)(C)C	729221628	UQGREGGRFGYGQS-UHFFFAOYSA-N	442.542	1.099	50	20	IDGD	
CC[C@H](NC(=O)NNC(=O)c1ccc2ccccc2n1)c1cccc(S(N)(=O)=O)c1	729229930	CEIRPEDUVXAPOA-INIZCTEOSA-N	427.486	1.978	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(C(=O)NNC(=S)NC(C)(C)C)cc1Br	729688463	CKXQPLPKXSBBTB-UHFFFAOYSA-N	437.385	1.607	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCN(c2ccc3c(c2)OCCO3)C1=O)c1ccc2ccccc2n1	730512393	OGCLUVPGBJQHCO-MRXNPFEDSA-N	432.436	1.820	50	20	IDGD	
N#CCN1CCC(NC(=O)NNC(=O)[C@H]2Cc3ccccc3CN2Cc2ccccc2)CC1	730674814	OWAGPTPLVKQVTN-HSZRJFAPSA-N	446.555	1.932	50	20	IDGD	
NC(=O)[C@@H]1CCCN(Cc2cccc(CNC(=O)NNC(=O)CCc3ccccc3)c2)C1	731118841	XRDGITRGXRDICP-OAQYLSRUSA-N	437.544	1.847	50	20	IDGD	
CC(C)(C(=O)NNC(=O)C1CCN(S(=O)(=O)c2cccnc2)CC1)c1ccccc1	731175388	UQDOEYCKZGBVSO-UHFFFAOYSA-N	430.530	1.608	50	20	IDGD	
O=C(NCCCN(C(=O)C1CCC1)C1CC1)NNC(=O)c1cc(Br)c[nH]1	731358183	HORXAFGETKLLKK-UHFFFAOYSA-N	426.315	1.902	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1nc(C)n(-c2ccccc2)n1	731596926	LRMWTIAJOYDBHA-UHFFFAOYSA-N	427.490	1.252	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2nc3nc(C)cc(C)n3n2)cc1Br	732235477	WAGKRPMTLUEXGF-UHFFFAOYSA-N	434.254	1.979	50	20	IDGD	
O=C(CNC(=O)c1ccc(Br)o1)NNC(=O)c1cnn(-c2ccccc2)c1	733364012	FCGGBEQFYKUUOG-UHFFFAOYSA-N	432.234	1.419	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)NNc2nc(-c3ccccn3)nc(C)c2C)ccc1OC	734256883	QHQSFLUUCQCJHQ-UHFFFAOYSA-N	442.501	1.829	50	20	IDGD	
CN1C(=O)CC[C@H](C(=O)NNC(=O)C(=O)N2CCCC2)[C@@H]1c1ccc(C(F)(F)F)cc1	734432872	XDLNBVGLSVGSLR-HOCLYGCPSA-N	440.422	1.385	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)N[C@H]2CCN(c3cnn(C)c3)C2=O)N(C)c2ccccc21	735477782	VALKBVOCJLAPAQ-KRWDZBQOSA-N	447.499	1.312	50	20	IDGD	
CC(=O)N[C@H](CC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)c1ccc(F)cc1F	741660157	JEQSDJYYLVIZMA-QGZVFWFLSA-N	443.410	1.240	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2ccc(-c3n[nH]c(C)n3)cc2)c2ccccc2c1=O	742241924	OWURDOWDCFKXNQ-UHFFFAOYSA-N	431.456	1.975	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)[C@H](C)NC(=O)c1cc2c(C)nn(C)c2s1	743318266	FBIFFQTUHNQLCP-LBPRGKRZSA-N	429.502	1.460	50	20	IDGD	
Cc1c(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)cnn1-c1ccccn1	744622089	WHLFWBRJJKPROZ-UHFFFAOYSA-N	442.501	1.354	50	20	IDGD	
CN(C)C(=O)NNC(=O)c1ccc(NC(=O)C[C@H]2SC(N3CCCC3)=NC2=O)cc1	746003247	CNCPTIFJEBHXLL-CQSZACIVSA-N	432.506	1.025	50	20	IDGD	
Cc1cc(C)nc(SCc2ccc(C(=O)NNC(=O)c3nccnc3C(N)=O)cc2)n1	746113754	XMNBUMXOIIVAEZ-UHFFFAOYSA-N	437.485	1.349	50	20	IDGD	
COc1cc(C)nc(NNC(=O)C2CCN(S(=O)(=O)c3ccc(F)c(F)c3)CC2)n1	746623511	NXBGJVULDGEYAA-UHFFFAOYSA-N	441.460	1.616	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)/C(=C\c1cccnc1)NC(=O)c1ccccc1	746638073	WWLLVPWBFCUWAT-DEDYPNTBSA-N	440.463	1.890	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)[C@@H]1CC12CCCC2	747296405	YNDUVUGVZWALEF-SFHVURJKSA-N	435.546	1.368	50	20	IDGD	
CNS(=O)(=O)c1cccc(S(=O)(=O)NNC(=O)c2ccc(C(C)(C)C)cc2)c1	747406901	LFTQDEYWWQCRHA-UHFFFAOYSA-N	425.532	1.516	50	20	IDGD	
O=C(CCCN1C(=O)CCC1=O)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1	747778642	JYVLVTGKIXWBJS-NRFANRHFSA-N	448.523	1.690	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)[C@@H]2CCCN2C(=O)CC(C)(C)C)c2ccccc2c1=O	748165984	FSSYLHSFCKQHHQ-KRWDZBQOSA-N	441.532	1.995	50	20	IDGD	
Cc1cc(N2CCC(NC(=O)NNC(=O)[C@H](C)Oc3ccc(F)cc3)CC2)nc(C)n1	749616802	UNCDYUVBELJYRF-AWEZNQCLSA-N	430.484	1.999	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)[C@@H]2CCCN2C(=O)c2ccc3c(c2)OCO3)c1O	749737002	MCUCYYSSLYPWOA-AWEZNQCLSA-N	427.413	1.195	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NNc2nc3ccccc3c(=O)n2C)cc1	752906263	GPUDTUHDCUUPAD-SFHVURJKSA-N	441.513	1.538	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)Nc1cc2c(cc1Cl)OCCCO2	755584810	YKLZAUGBTSTKTO-UHFFFAOYSA-N	429.824	1.944	50	20	IDGD	
CCc1c(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cnn1CCC(C)C	755597320	YVFKKTOBWCVTNP-LJQANCHMSA-N	444.488	1.636	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cc(S(N)(=O)=O)c(C)o2)ccc1OCCC(C)C	755624094	UKBMPVNVFXDUOK-UHFFFAOYSA-N	439.490	1.744	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)Nc1ccc(CC(=O)NCC(=O)OC)cc1)c1ccccc1	755863945	ZRFUYQKWNFEVHA-SFHVURJKSA-N	426.473	1.865	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)Nc1ccc(CCN2CCOCC2)cc1	756165947	SCGAMPPJNNURIU-FQEVSTJZSA-N	426.473	1.554	50	20	IDGD	
CN(C)C(=O)c1cc(NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)ccn1	756647759	RLNXTDSBUKMSDT-UHFFFAOYSA-N	439.520	1.148	50	20	IDGD	
COc1ccc(Cn2nnnc2SCC(=O)NNC(=O)c2cccc(Cl)c2)cc1	756650619	MXYQEYGVILVMAX-UHFFFAOYSA-N	432.893	1.937	50	20	IDGD	
C[C@H]1CN(C(=O)Cn2cc(NC(=O)NNC(=O)Cc3ccc(F)cc3)cn2)C[C@H](C)O1	756840748	ZHJFEUZVYNBVHV-KBPBESRZSA-N	432.456	1.053	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)CN2C(=O)N[C@]3(C[C@@H](C)C[C@@H](C)C3)C2=O)cc1	756868523	WTAIOTDJEDCAOV-USGNIVHTSA-N	432.546	1.981	50	20	IDGD	
CCOC(=O)c1sc([C@H](C)NC(=O)NNC(=O)c2nnc(O)c3ccccc23)nc1C	757269663	AQIXCTVMZAXTMQ-JTQLQIEISA-N	444.473	1.982	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)Nc1cc(Br)c(F)cc1Cl	757595149	ASVLVRFWKFSAGM-LURJTMIESA-N	428.667	1.829	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)c2cccnc2I)cc1	757736075	AANQOPTYSWSDKJ-UHFFFAOYSA-N	426.214	1.568	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)Nc1cnc2c(c1)C[C@@H](NC(=O)OC(C)(C)C)CC2	757928736	KKZOXNDKRCGHHL-ZDUSSCGKSA-N	429.481	1.962	50	20	IDGD	
CCCc1c(C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)nnn1-c1cccc(C(C)C)c1	758049399	ZJSQKVRKSUAOMD-ZDUSSCGKSA-N	436.538	1.042	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCCC(=O)NNC(=O)CCc1ccccc1	760809034	OEKBVMOMIAGRBM-QGZVFWFLSA-N	432.521	1.672	50	20	IDGD	
CC(C)(C)OC(=O)NCc1nc(C(=O)NNc2nccc(N3CCOCC3)n2)cs1	762864355	AVWRCFKGALMHDA-UHFFFAOYSA-N	435.510	1.551	50	20	IDGD	
CCOC(=O)c1cc(F)c(F)cc1NC(=O)C(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	763443050	WVKUPGIJJBEHSR-UHFFFAOYSA-N	436.327	1.449	50	20	IDGD	
O=C(NNC(=O)c1ccncc1)C(=O)Nc1cccc(F)c1I	763464554	NERUJQXWJHBZGM-UHFFFAOYSA-N	428.161	1.225	50	20	IDGD	
C[C@H]1CN(c2ccccc2NC(=O)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)C[C@@H](C)O1	763471836	MTVFVGBGLIESOM-OKILXGFUSA-N	441.444	1.608	50	20	IDGD	
O=C(NNC(=O)c1ccccc1F)C(=O)Nc1cccn(Cc2ccc(F)cc2)c1=O	763561138	JKGYEFRLYZFELZ-UHFFFAOYSA-N	426.379	1.575	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)Nc1ccc(N2CCSCC2)cc1	763574591	FUCFTULNCLNZCV-SFHVURJKSA-N	442.497	1.166	50	20	IDGD	
COc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NNC(=O)c1cc(C)nc2ccccc12	763613926	DWZJAYMQARXWQD-UHFFFAOYSA-N	449.467	1.653	50	20	IDGD	
COCC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)cc1	763685325	ALKQIODLVFZCGC-UHFFFAOYSA-N	434.836	1.090	50	20	IDGD	
Cc1cn2cc(NC(=O)C(=O)NNC(=O)COc3ccc(Br)cc3)ccc2n1	763693840	FQVYMWWDIUUPSN-UHFFFAOYSA-N	446.261	1.570	50	20	IDGD	
CO[C@@H](C)c1cccc(NC(=O)C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1	763718274	JHVSDIZRMVUVKL-ZDUSSCGKSA-N	448.501	1.044	50	20	IDGD	
COc1ccc2cc(NC(=O)C(=O)NNC(=O)CN3CCCc4ccccc43)ccc2n1	763729014	SUBCPKKOVMWEAQ-UHFFFAOYSA-N	433.468	1.782	50	20	IDGD	
O=C(CSc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1ccc(-n2nccn2)nc1	763738594	VQAICQGFZGZDFJ-UHFFFAOYSA-N	431.865	1.194	50	20	IDGD	
Cc1ccc(Oc2ccc(NC(=O)C(=O)NNC(=O)COc3ccc(F)cc3)cc2)nn1	763843001	KQIWBZLVOUJZDZ-UHFFFAOYSA-N	439.403	1.881	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)cc1C(=O)NC(C)C	763855721	AWESYFGPQUCRBT-AWEZNQCLSA-N	444.463	1.826	50	20	IDGD	
Cc1nnc(-c2ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc3ccccc3F)cc2)o1	763855911	CEPGIQZYJSVXBX-NSHDSACASA-N	427.392	1.738	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccc(-n2cncn2)c(F)c1	763872715	OKTAMYQBPFJIAA-LLVKDONJSA-N	430.371	1.099	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(-n3ccnc3)nc2)cc1	763878338	OXMLUWBBWQKRLD-AWEZNQCLSA-N	436.428	1.023	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)C(=O)Nc1c[nH]nc1-c1ccccc1	763945596	ZVHUOYZFKSBEOG-UHFFFAOYSA-N	431.412	1.368	50	20	IDGD	
CCOC(=O)COc1cccc(NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)c1	763978016	CPJDGKLAPLHUNE-UHFFFAOYSA-N	435.820	1.387	50	20	IDGD	
CCCOc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c(C)c1	764077229	JPRBXRHDUQZZQM-UHFFFAOYSA-N	433.486	1.587	50	20	IDGD	
Cc1cc(C)n(-c2ccc(C(F)(F)F)cc2NC(=O)C(=O)NNC(=O)c2cc(C)[nH]n2)n1	764109385	SUJICRGYUQAQRJ-UHFFFAOYSA-N	449.393	1.939	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2ccc3c(c2)NC(=O)[C@H](C)O3)cc1	764127868	TYERWRKXQJXPJJ-LBPRGKRZSA-N	426.429	1.133	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2c(SC)cnn2-c2ccccc2)c1O	764130103	ATRMGGWAHIAHLI-UHFFFAOYSA-N	441.469	1.708	50	20	IDGD	
CN(C)c1nc2cc(NC(=O)C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)ccc2o1	764202525	DPSUZRGQELPDOU-UHFFFAOYSA-N	448.480	1.285	50	20	IDGD	
CCOc1cc(C(=O)N(C)C)ccc1NC(=O)C(=O)NNC(=O)CCCc1ccccc1	764223475	CVIPDHPHSZXYMX-UHFFFAOYSA-N	440.500	1.896	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)C(=O)Nc1c(F)cc(Cl)cc1F	764258861	BHYQSAJLMVQRDW-UHFFFAOYSA-N	438.822	1.411	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)Cc2ccccn2)n(-c2cccc(C(F)(F)F)c2)n1	764264267	ORUYNYQHLYWLBS-UHFFFAOYSA-N	446.389	1.923	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)C(=O)Nc1cc(C(N)=O)ccc1-n1cc(C)cn1)c1ccccc1	764332778	YSWFGQFFXAPUDX-QGZVFWFLSA-N	448.483	1.559	50	20	IDGD	
CCCc1cc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3OC)[nH]n2)n(C)n1	764376408	CZNDPOVSTUVTEC-UHFFFAOYSA-N	425.449	1.171	50	20	IDGD	
CC(C)c1csc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)n1	764377934	XHCOMUSSKROWLL-UHFFFAOYSA-N	425.536	1.661	50	20	IDGD	
C#CCOc1cc(F)ccc1NC(=O)C(=O)NNC(=O)CSc1ccccc1OC	764392791	LAUJPEYPAZMIBC-UHFFFAOYSA-N	431.445	1.725	50	20	IDGD	
CC(=NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1)c1ccccc1F	764819971	UMFQDWPZKYYTKI-UHFFFAOYSA-N	432.521	1.981	50	20	IDGD	
CC(C)(C)OC(=O)NNC(=O)C(=O)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1	765391039	NVBOMISDZLQIKM-INIZCTEOSA-N	428.493	1.825	50	20	IDGD	
O=C(COC/C=C\c1ccccc1)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765733634	ODOJWLKGUPGFHO-YFHOEESVSA-N	436.512	1.322	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)N[C@H]1CC(=O)N(c2ccc(Cl)c(F)c2)C1	766552373	IDUNZMNOTWIYFO-LBPRGKRZSA-N	448.838	2.000	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)Cc3csc4nccn34)CC2)cc1	766642328	RBDPKYRARMNZOP-UHFFFAOYSA-N	426.546	1.212	50	20	IDGD	
CC(=O)N[C@H](CC(=O)OCC(=O)NNC(=O)Cc1ccccc1C)c1ccc(C)cc1	767262360	XTLFQCAOPAVBSR-HXUWFJFHSA-N	425.485	1.804	50	20	IDGD	
Cc1nc(COc2ccccc2C(=O)OCC(=O)NNC(=O)Cc2ccccc2C)no1	767266181	WEQSJLIIYBVZSW-UHFFFAOYSA-N	438.440	1.812	50	20	IDGD	
Cc1nn(C(C)C)c(C)c1S(=O)(=O)N1CCN(S(=O)(=O)CBr)CC1	767851156	OEEYSISFONDMOM-UHFFFAOYSA-N	443.389	1.069	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)CNC(=O)c1ccc(C(F)(F)F)cc1	768629043	DLEVNKLYAKPCNP-UHFFFAOYSA-N	445.419	1.991	50	20	IDGD	
O=C(c1ccc([N+](=O)[O-])c(Cl)c1)N1CCN(S(=O)(=O)CBr)CC1	768732062	YBHJMGWMJKCSRR-UHFFFAOYSA-N	426.676	1.688	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)Nc1ccc(CNS(C)(=O)=O)cc1	769242261	UYOSCBYYKLJKKL-UHFFFAOYSA-N	442.519	1.297	50	20	IDGD	
COC[C@@H](C)n1c(C)cc(/C=C(/C#N)C(=O)N2CCC(C(=O)NCCCO)CC2)c1C	769332458	AWYIFSMORFHAPQ-OJSPLJLUSA-N	430.549	1.957	50	20	IDGD	
CCCCNC(=O)NNC(=O)c1cc(S(=O)(=O)Nc2ccccc2OC)ccc1O	769724824	BBYZTVUUPOVIEP-UHFFFAOYSA-N	436.490	1.946	50	20	IDGD	
CCN1CCN(c2cccc(NC(=O)NNC(=O)COc3ccccc3[N+](=O)[O-])c2)CC1	771275422	BURMOWVGQNXSRT-UHFFFAOYSA-N	442.476	1.968	50	20	IDGD	
COc1ccccc1[C@@]1(C)NC(=O)N(CC(=O)NNc2nc(-c3ccccc3)no2)C1=O	771483416	QZDVTWQPJCFCAK-OAQYLSRUSA-N	436.428	1.656	50	20	IDGD	
CCOC(=O)c1cc(C(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)cc([N+](=O)[O-])c1	772188715	SYQIZCFFPPBATP-UHFFFAOYSA-N	448.819	1.502	50	20	IDGD	
C[C@@H](CN(C)C(=O)OC(C)(C)C)C(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772195075	ILSXBAVCJULEID-LBPRGKRZSA-N	426.901	1.607	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)CCCC[C@@H]1SC[C@H]2NC(=O)N[C@H]21	772969215	KQGLFKGHSBNNQV-MQVNZCODSA-N	440.953	1.981	50	20	IDGD	
CN(Cc1ccccc1)[C@@H](CNC(=O)NNC(=O)CNC(=O)c1cccs1)C1CC1	773263335	CNOOBUDLCSHVPA-KRWDZBQOSA-N	429.546	1.719	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1ccc(OC(F)F)c2cccnc12	773496395	LEIUIHGXAOSKHX-UHFFFAOYSA-N	446.366	1.707	50	20	IDGD	
O=C(NCc1cccnn1)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	775040056	PGDOEGKMHHYDBS-UHFFFAOYSA-N	432.487	1.483	50	20	IDGD	
CCOC(=O)c1cnc(C)c(C(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)c1	776206378	TVIYCKOSPCONHG-UHFFFAOYSA-N	449.508	1.816	50	20	IDGD	
O=C(NNC(=O)[C@H](O)Cc1cccc(C(F)(F)F)c1)c1nn(-c2ccccc2)cc1O	779370980	MIPDCIDVLVSAGJ-OAHLLOKOSA-N	434.374	1.961	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCN([C@@H](C#N)c3ccc(F)cc3)CC2)n1	780315200	NWSPVFKNWARRRF-KRWDZBQOSA-N	430.509	1.163	50	20	IDGD	
CSc1ccccc1S(=O)(=O)NNC(=O)CN1CCN(Cc2ccc(C)cc2)CC1	780399111	XZAUDHPUIMYZOF-UHFFFAOYSA-N	448.614	1.844	50	20	IDGD	
Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCN(S(=O)(=O)CCCCCl)CC1	780667055	RXZIPHIMRCUGOZ-UHFFFAOYSA-N	439.943	1.558	50	20	IDGD	
O=C(COC(=O)c1c[nH]nc1-c1ccsc1)NNC(=O)[C@@H]1COc2ccccc2O1	781331575	QRCDJVMGXFYCIE-HNNXBMFYSA-N	428.426	1.282	50	20	IDGD	
CN(CC(=O)NNc1ncncc1Cl)S(=O)(=O)c1ccc(Br)cc1	781819358	AINBIZABMVEWTB-UHFFFAOYSA-N	434.703	1.656	50	20	IDGD	
COc1cccc(C(=O)NCC(=O)NNc2ccccc2S(=O)(=O)NC(C)(C)C)c1	782754938	RLHGWJRNVNGSCT-UHFFFAOYSA-N	434.518	1.645	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccnc(OC(C)C)c2)nc1	783263675	IWFPMOSGDXDDJK-UHFFFAOYSA-N	436.494	1.032	50	20	IDGD	
Cn1c(=NNC(=O)C(=O)Nc2ccccc2S(=O)(=O)C(F)F)sc2ccccc21	783352542	XNXKOCNVPNXDJF-UHFFFAOYSA-N	440.453	1.807	50	20	IDGD	
Cc1ccccc1NC(=O)NNC(=O)C(=O)Nc1cccc(S(=O)(=O)N2CCCC2)c1	783413259	FSEYLCQQPZMNDP-UHFFFAOYSA-N	445.501	1.571	50	20	IDGD	
CCN1CCN(c2ccc(NC(=O)C(=O)NNc3cccc(C(=O)OC)c3)cc2)CC1	784851251	JFLLEKYQUUHJDA-UHFFFAOYSA-N	425.489	1.697	50	20	IDGD	
COC(=O)CN1CCN(c2ccc(NC(=O)C(=O)NNc3cc(Cl)ccn3)cc2)CC1	784862234	ZZCATNZAGLRRCK-UHFFFAOYSA-N	446.895	1.112	50	20	IDGD	
CCOc1cc2c(cc1NC(=O)C(=O)NNC(=O)Cc1cn3ccccc3n1)O[C@@H](C)C2	785068046	RVPHCFYOEINVKZ-ZDUSSCGKSA-N	437.456	1.385	50	20	IDGD	
CN1CCN(C(=O)c2ccccc2NC(=O)C(=O)NNc2ccc(Cl)c(F)c2)CC1	785183765	KPABVDWDNVPKEF-UHFFFAOYSA-N	433.871	1.949	50	20	IDGD	
C[C@@H]1[C@@H](C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)CCN1C(=O)OC(C)(C)C	787993211	OKJBLBNWGDMTKH-HIFRSBDPSA-N	429.477	1.984	50	20	IDGD	
COc1c(C)cnc(Cn2cnc(NC(=O)C(=O)NNc3ccc4ccccc4n3)n2)c1C	789745797	NIWUODISKGHMPH-UHFFFAOYSA-N	446.471	1.977	50	20	IDGD	
COCCCOc1ccccc1NC(=O)C(=O)NNC(=O)[C@H]1OCC[C@H]1c1ccccc1	789809656	CWQIQZXYVGGIDY-PXNSSMCTSA-N	441.484	1.761	50	20	IDGD	
CCOC(=O)c1cc(C)sc1NC(=O)C(=O)NNC(=O)[C@H]1OCC[C@H]1c1ccccc1	789810482	OJLLEDUNOKZHHO-HOCLYGCPSA-N	445.497	1.892	50	20	IDGD	
N#Cc1ccc(S(=O)(=O)N2CCC(C(=O)NNc3nc4ccccn4n3)CC2)cc1	791255863	IYYCOOWGTDTQPN-UHFFFAOYSA-N	425.474	1.145	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N2CC([C@H]3CCOC3)C2)cc1	792608762	TXZUQUSBSVNHGP-DKFVHQPUSA-N	449.511	1.836	50	20	IDGD	
CC(=O)NC[C@@H]1CCn2ncc(C(=O)NNC(=O)[C@@H](C)Oc3ccc4ccccc4c3)c2C1	792736021	DYIRIIDRHGOYME-NVXWUHKLSA-N	449.511	1.963	50	20	IDGD	
CN(C)N(C(=O)c1cc(NC(=O)OCC(F)(F)F)ccc1O)[C@H]1CCS(=O)(=O)C1	792853276	CWNVFWSLNJUOTA-NSHDSACASA-N	439.412	1.609	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1ccc2ccn(C)c(=O)c2c1	793024141	AOCSSBZMHOEVPQ-UHFFFAOYSA-N	440.481	1.425	50	20	IDGD	
C[C@](O)(CN1C(=O)NC2(CCCC2)C1=O)C(=O)NNC(=O)c1c(Cl)cccc1Cl	793386104	ZVPYPTZFPPPXRP-KRWDZBQOSA-N	443.287	1.370	50	20	IDGD	
Cc1ccc(C)c(SCC(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1	797610561	SEMHZUIBJWEIRO-KRWDZBQOSA-N	430.482	1.926	50	20	IDGD	
CS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)cc1[N+](=O)[O-]	801180443	HGJWRGZAQHDQIQ-UHFFFAOYSA-N	447.404	1.602	50	20	IDGD	
CC(C)c1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)N=c3cc[nH]cc3)CC2)cc1	802027481	ITAMDKFWSNSHQM-UHFFFAOYSA-N	445.545	1.881	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)CCCN2C(=O)CN(C)C2=O)c(OC)cc1Cl	802085650	HXWBGXNEQMRRNV-UHFFFAOYSA-N	427.845	1.184	50	20	IDGD	
C[C@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)NNC(=O)Nc2ccc3c(c2)OCO3)C1=O	802103440	SOTLQTIUXZOBPK-HXUWFJFHSA-N	443.391	1.174	50	20	IDGD	
Cc1ccc(/C=C(/C#N)C(=O)OCC(=O)Nc2cc(C)nn2[C@@H]2CCS(=O)(=O)C2)cc1	802399576	CXWPHJNJAMEGLO-DAIOKFOQSA-N	442.497	1.948	50	20	IDGD	
CCOC(=O)C(C)(C)c1csc(NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)n1	806821631	WRVXLCWVKPVMID-UHFFFAOYSA-N	444.477	1.426	50	20	IDGD	
COC(=O)c1cc(Br)c(OC)cc1NC(=O)C(=O)NNC(=O)CC(C)(C)C	806977998	IABLYITUWAOVCA-UHFFFAOYSA-N	444.282	1.766	50	20	IDGD	
CCCS(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)c2ccc3c(c2)OCO3)cc1	808069221	SNRLAQQLQGJYBR-UHFFFAOYSA-N	426.472	1.222	50	20	IDGD	
CC(=O)N1C[C@@H]2CCC[C@@H](NC(=O)NNC(=O)c3nn(-c4ccccc4)cc3O)[C@H]2C1	808357712	NDUIYYQZQPBYHS-BHYGNILZSA-N	426.477	1.169	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)Cc2c[nH]c3ccccc23)cc2[nH]ccc12	808934360	BLOZFULGXBJNNU-UHFFFAOYSA-N	433.424	1.764	50	20	IDGD	
COc1ccc(-c2ocnc2C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1	809541289	IFJUXAUIPCAAQG-UHFFFAOYSA-N	444.469	1.675	50	20	IDGD	
CC(C)n1ncc2cc(C(=O)OCC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)cnc21	811623839	YNFFXRXIMJAMFK-UHFFFAOYSA-N	426.389	1.538	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCc1nc(N(C)C)no1	812218266	BXQQGFILLLVJTA-SECBINFHSA-N	427.259	1.196	50	20	IDGD	
CC(=O)N1c2ccc(S(=O)(=O)NNC(=O)[C@@H]3COc4ccccc4O3)cc2C[C@@H]1C	812536322	XVAKLMCZLYRJCG-BUXKBTBVSA-N	431.470	1.134	50	20	IDGD	
COc1cc(C(=O)N(C)C)ccc1NC(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	812949108	ODFRDCCQPIXBTB-UHFFFAOYSA-N	435.506	1.796	50	20	IDGD	
CCCN1Cc2cccc(NC(=O)C(=O)NNc3ccc(S(=O)(=O)N(C)C)cc3)c2C1	813033706	HWTJOKKQVWPGMB-UHFFFAOYSA-N	445.545	1.744	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)Cc3nnc(C)o3)c2)cc1	813363789	UDTFABVQPOOYKM-UHFFFAOYSA-N	445.457	1.191	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)c2cn3c(Br)cnc3s2)c1	815369728	IUNLRFUPHPDNHW-UHFFFAOYSA-N	448.258	1.648	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)CNc3ccccc3)CC2)cc1C	823327421	JXSIMQHYJCFTQA-UHFFFAOYSA-N	444.557	1.964	50	20	IDGD	
CCC1CCC2(CC1)NC(=O)N(CC(=O)NNC(=O)CNc1cccc(OC)c1)C2=O	825781788	IONSQNXTVMOBIK-UHFFFAOYSA-N	431.493	1.145	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N[C@H](CCSC)C(=O)NNc2ncccn2)cc1	913044280	HYOZRSMIMRMSRX-OAHLLOKOSA-N	425.536	1.419	50	20	IDGD	
COCCNS(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(Cl)cc2Cl)c1	913055346	UMJIWFVBOAHIHV-UHFFFAOYSA-N	446.312	1.993	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)NCCNC(=O)c1ccco1	914537128	FVHIHJBAIZDLGU-UHFFFAOYSA-N	425.239	1.181	50	20	IDGD	
COCCOc1ccc(S(=O)(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)cc1C	914877514	ZDQVHZBMRARHQB-UHFFFAOYSA-N	435.502	1.585	50	20	IDGD	
CC(=O)Nc1ccc(NC(=S)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1	915117706	WFWNQSKQMPHBPU-UHFFFAOYSA-N	435.531	1.527	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)CNC(=O)c1c[nH]c2ccccc2c1=O	915357373	BPNKEDOYJRYMNF-GFCCVEGCSA-N	426.404	1.012	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)CNC(=O)c1ccccc1OC(F)F	915775719	NGFODNOLYGOBRV-UHFFFAOYSA-N	445.426	1.778	50	20	IDGD	
CCN(CCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)c1cccc(C)c1	915903239	YUXJDHAWUJOVPU-UHFFFAOYSA-N	447.561	1.716	50	20	IDGD	
COc1ccc(N2CCN(CCCNC(=O)NNC(=O)c3ccccc3F)CC2)cc1	916199023	VEXHPMALMLPGNR-UHFFFAOYSA-N	429.496	1.991	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)NCC2(NS(C)(=O)=O)CCCCC2)c1C	916253837	OKJQLLNDFGJNMW-MRXNPFEDSA-N	440.566	1.653	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)NCc2cccnc2N2CCOCC2)c1C	916400236	XNHNRNZHCWLKCP-KRWDZBQOSA-N	427.505	1.833	50	20	IDGD	
Cc1csc(CCNC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)n1	916573461	OKJUGTBHNFYERW-UHFFFAOYSA-N	437.547	1.423	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NCc2nnc3n2CCCC3)c2ccccc2c1=O	916649366	LYZISLZIMNEBMZ-UHFFFAOYSA-N	438.492	1.269	50	20	IDGD	
Cc1cc(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c2ncccc2c1	917719235	BFDWGVGKIMJZFX-UHFFFAOYSA-N	448.526	1.417	50	20	IDGD	
O=C(C[C@@H](NC(=O)c1ccccc1)c1ccccc1)NNC(=O)N[C@H]1CCS(=O)(=O)C1	919885351	OSXVIIBNDAZMRS-ZWKOTPCHSA-N	444.513	1.065	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2nc(-c3ccccc3)ns2)c1	920931413	ONQZSBGKZDGLDH-UHFFFAOYSA-N	446.514	1.922	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)Nc2ccccc2CN2C(=O)CNC2=O)cc1	920932174	XZKYOZLZOJMJOV-UHFFFAOYSA-N	427.486	1.992	50	20	IDGD	
CC(C)CN1C(=O)/C(=C/NNC(=O)CSc2nc3ccccc3s2)C(=O)NC1=S	920978133	ZBEJPFSRJZRWPA-YRNVUSSQSA-N	449.583	1.792	50	20	IDGD	
C[C@H](Cc1cccc(F)c1)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	920999185	HTHMULRYGSCZOC-OAHLLOKOSA-N	449.504	1.486	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@H]2Cc3ccccc3CN2C(C)=O)c2ccccc2c1=O	933437304	LVKVDFOMKHTKBF-LJQANCHMSA-N	433.468	1.151	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)Cc1ccccc1NS(C)(=O)=O	1116803854	IOMHWNJSSMNLRK-GFCCVEGCSA-N	425.894	1.869	50	20	IDGD	
CC(C)CC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)NNC(=O)c1ccc(Br)cc1	1117668646	NFTPVPFCFISBNQ-HNNXBMFYSA-N	436.310	1.707	50	20	IDGD	
CC(=NNC(=O)c1cncn1-c1ccccc1)c1c(C)nn(CCS(C)(=O)=O)c1C	1253050158	ZJXOEHKQZDYORJ-UHFFFAOYSA-N	428.518	1.884	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)C(=O)c2cnn(-c3ccccc3)c2)CC1	1318903636	QWLUWHRNZBTHBU-UHFFFAOYSA-N	441.488	1.850	50	20	IDGD	
CCS(=O)(=O)N1CCC(NC(=O)NNC(=O)c2ccc(Br)cc2)CC1	1319617306	SBXOWDPZAQTZFD-UHFFFAOYSA-N	433.328	1.207	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)ccc1-n1cncn1	1322260278	ICPAFCIJDGSHMK-UHFFFAOYSA-N	428.493	1.984	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccn4ccnc4c3)C2)C1	1778564643	OZQDGWZAVWJUPT-KUHUBIRLSA-N	435.322	1.809	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)C(=O)Nc3cccnc3)C2)C1	1779205680	BOOXOTADSUAHRP-KDOFPFPSSA-N	439.310	1.024	50	20	IDGD	
C[C@H](C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCBr)C2)N1C[C@H]2C[C@H]2C1	1779246189	GDRQMHNYHOQIEX-ISIBIEBGSA-N	442.398	1.626	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cc(Cl)cnc1O)CCO2	1779294304	FNAZWPUTGJYEQJ-SFHVURJKSA-N	427.961	1.736	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](Br)CC)C2	1779536172	KTKDNOHLWMQNEE-DEXNDLTESA-N	444.370	1.365	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(CCN(C(=O)c3[nH]cnc3-c3cccnc3)C2)C1	1780052070	FVJCIFYPPWFFKA-LJQANCHMSA-N	448.321	1.700	50	20	IDGD	
O=C(c1cccnc1-c1ccc(F)cc1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1780348823	ZQQILAWFPXFCRL-PGRDOPGGSA-N	447.894	1.931	50	20	IDGD	
Cc1ccc(CCC(=O)N2CCO[C@]3(CCN(C(=O)[C@H](F)Br)C3)C2)cn1	1781327019	WDZDMHBFSGJQFE-FUHWJXTLSA-N	428.302	1.843	50	20	IDGD	
Cc1nc2sccn2c1C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781331540	MUCGIJPCPBLUMY-LRDDRELGSA-N	445.314	1.838	50	20	IDGD	
O=C(c1cc(F)cc(C(F)(F)F)c1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1781607830	APTPNVQEDKRRSE-WMLDXEAASA-N	438.805	1.888	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cccc4c3NC(=O)C4)C2)C1	1782410330	KDEKPTRONYVJOW-CWTRNNRKSA-N	436.306	1.408	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3c4c(nn3C)CCC4)C2)C1	1782442036	UXRWNULNGNMCNA-KUHUBIRLSA-N	439.354	1.526	50	20	IDGD	
CC(=O)N[C@@H](C)C(=O)N1CC[C@]2(CN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)CCO2)C1	1783180587	BKXFQSHTVIZQNK-VTKMWWQSSA-N	446.454	1.226	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)Cc3ccccc3O)C2)C1	1783231141	YAOLBZUXPFFYKB-AUUYWEPGSA-N	425.323	1.796	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)CCc3cnccn3)CCO2)C1	1783354309	PGCKWGNJBMGURX-QAPCUYQASA-N	425.327	1.413	50	20	IDGD	
CCOc1ncccc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21	1783389843	CMQXXVRNTTUESU-BPUTZDHNSA-N	440.338	1.859	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)CNC(=O)c3cccs3)CCO2)C1	1783532625	QEGMRWLOWBKQMF-SJKOYZFVSA-N	444.351	1.091	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H]1CCN1C(=O)OC(C)(C)C)CCO2	1783882252	XAMSFKFQBAAPHL-STXHMFSFSA-N	445.944	1.080	50	20	IDGD	
COc1ccc(CC(=O)N2CC[C@]3(CN(C(=O)CCBr)CCO3)C2)cc1F	1784700417	FMIKZHUORXDAAG-LJQANCHMSA-N	443.313	1.992	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@]2(CCN(C(=O)C34CC(C3)C4)C2)C1	1784829661	WNWYUHBFEOTTON-SAYDWMHPSA-N	441.956	1.749	50	20	IDGD	
CC(C)c1nc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Br)C[C@@H]32)no1	1785210963	JLJIUVGJSZWHKH-ASHKBJFXSA-N	447.305	1.406	50	20	IDGD	
O=C(CCc1ccc2c(c1)OCO2)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21	1786604376	OCRCNZRRDLBCLE-IPQUUHLSSA-N	426.872	1.862	50	20	IDGD	
Cn1cncc1C(=O)Nc1ccc(C2(NC(=O)c3cnccc3C(=O)NN)CCC2)cc1	1787454975	BSZBNRXGXOTUKM-UHFFFAOYSA-N	433.472	1.480	50	20	IDGD	
O=C([C@@H](F)Br)N1CC[C@H]2CO[C@@H](CNC(=O)C3(C(F)(F)F)CC3)[C@H]2C1	1788220134	AOYDDXPYBCWKDY-XWLWVQCSSA-N	431.224	1.999	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)c1cncc(C(F)(F)F)c1	1789016723	LQDARZADGQRHDF-HPEDKQMDSA-N	435.830	1.293	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3ON=C(c4ccccc4)O3)C[C@@H]21	1789863359	OQYNVNCGCSSMKX-YJZCJGOMSA-N	435.908	1.718	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C#CC3(O)CCCCC3)C[C@@H]21	1789870798	WSJNHHQGAJEJFX-OGNFBWPZSA-N	445.387	1.901	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3c(O)cc(O)cc3O)[C@H]2C1	1790155530	XBQUPUWTTFUMKB-DPYKFYPSSA-N	426.897	1.804	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)COc3cccnn3)C[C@@H]21	1790963783	MCIXMVPNMFQCIR-XQLPTFJDSA-N	441.326	1.009	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](NC(=O)OC)c1ccccc1	1792802951	AGDQUOBPMJPWGJ-FLXSYLCISA-N	437.924	1.691	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c(Cl)ccnc3c1)C2)[C@H](O)CCl	1792980210	NPGUFAQTBTXYCN-JGTCGTHISA-N	438.311	1.691	50	20	IDGD	
CC(C)(C)OC(=O)N1CC=C(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Cl)C3)C1	1793224766	OYLSSJCPFYAAPI-LXTVHRRPSA-N	431.892	1.288	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnn(-c3cccnc3)c1)C2	1793445828	SCOZBGIYTHZLRT-UKBAYJJMSA-N	431.924	1.878	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](Br)Cc1ccccc1)C2)c1cc[nH]n1	1793507555	PLZXTKLTROFZTR-DFGXFYAUSA-N	447.333	1.619	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCC#N)C2	1793881110	PGXKXPGMALYPFH-FQLMCAECSA-N	428.917	1.012	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1csc(C)n1	1794350600	BNNKCVLTWFNEIV-NZPKQRIRSA-N	442.545	1.766	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C[C@@H]1COc3ccccc3O1)C2	1797953990	ZYCHHMKGFOLJBC-MPWIWIEXSA-N	448.592	1.658	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cn1cnc3ccccc31)C2	1797956571	MGRLKOXPHYCRDH-VPTLXERWSA-N	430.581	1.477	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Br)c1	1799352488	ZEXWLJALJWSYHX-XRGAULLZSA-N	442.285	1.539	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCCn1c(O)nc2ccccc21)[C@H](O)CCl	1799827779	PBYHIYYOBHBWQY-BASYENTBSA-N	434.924	1.760	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C[C@H](O)CNC(=O)OC(C)(C)C)C2	1800074525	DRCMZCIKYVMVLC-XFIYOXNOSA-N	431.961	1.918	50	20	IDGD	
Cn1ccnc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C#N)=C/c1ccc(F)cc1F	1800332780	ZQQRURULPSOTFZ-SQABCVSLSA-N	441.438	1.509	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3nncn3c1)C2	1800642030	SIVXCJVJZJZXBC-FQLMCAECSA-N	436.310	1.106	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H]2[C@@H](C1)[C@@H]2C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2	1800738187	IJBYHZBQEJNCGQ-RMCMBSFLSA-N	445.919	1.223	50	20	IDGD	
Cc1ccccc1OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)Br	1800756971	SDHXTZUHHUNEQV-AFIMGQEJSA-N	425.323	1.747	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cccc3ncccc13)C2	1800970261	ALEJSQCWAHOQCH-HPNQWNLUSA-N	431.920	1.621	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1C[C@H]1c1ccc(OC)cc1)C2	1800971306	VERGOGCAKNLSJK-ZNRYJCSXSA-N	436.936	1.642	50	20	IDGD	
C[C@H](Cc1ccc(F)cc1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(B(O)O)cc1)C2	1801490942	FPKADBACCGNNIV-ZHHJKBAOSA-N	438.308	1.636	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccn(C(F)F)n2)[C@@H]1c1cccnc1)[C@H](O)CCl	1803141150	LJPRWQRRHHEZQZ-NWANDNLSSA-N	427.839	1.593	50	20	IDGD	
C#CC(=O)N1CC[C@@H](CNC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)[C@@H]1c1cccnc1	1804240880	KXGHYVHQYIZRIO-BQFCYCMXSA-N	434.924	1.853	50	20	IDGD	
COc1ccc(CC(=O)N2CCC3(CCCN(C(=O)[C@H](O)CCl)C3)CC2)c(C#N)c1	1805525476	SRWLTTISHNVLPU-LJQANCHMSA-N	433.936	1.940	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC2(CCCN(C(=O)c3ccnc(F)c3)C2)CC1	1806304839	DRICGIUGKZHESM-UHFFFAOYSA-N	440.479	1.378	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H](CNC(=O)CS(C)(=O)=O)[C@H]1c1cccnc1	1806772975	WUJZCKSPCAUQKL-IJEWVQPXSA-N	446.367	1.306	50	20	IDGD	
C[C@]1(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)CC1(F)F	1807368224	QOZALESFYCOMTE-PLMTUMEDSA-N	443.259	1.126	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2cnncc2C(=O)O)[C@@H]1c1cccnc1	1808264421	YCTHZXJKRJKEOM-RRQGHBQHSA-N	431.880	1.907	50	20	IDGD	
C[C@H](Cn1cncn1)C(=O)NC[C@@H]1CCN(C(=O)C(Cl)Cl)[C@H]1c1cccnc1	1810480025	LWVYWRZTIPWUNY-SNPRPXQTSA-N	425.320	1.819	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)Cn2ccncc2=O)[C@H]1c1cccnc1	1812344928	GADDPGSMHPBREF-DHSIGJKJSA-N	448.321	1.128	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)CN3CCCC3=O)sc2C1	1814601217	GJCSABQCFGTNOO-NXEZZACHSA-N	429.340	1.461	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](O)C(C)C)n[nH]1	1814944916	VEKPHDDMHVMAPP-ROXVCHECSA-N	443.508	1.553	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3cc(=O)n4[nH]cnc4n3)sc2C1	1815330165	MIWDQGZBGPCGQY-DTWKUNHWSA-N	435.897	1.117	50	20	IDGD	
Cc1cc2nnc(C(=O)N[C@H]3CCc4nc(NC(=O)[C@@H](F)Cl)sc4C3)c(C)n2n1	1817122525	JRAHJRFSJYOKMZ-LKFCYVNXSA-N	437.888	1.958	50	20	IDGD	
Nc1c(C(=O)Nc2cc([C@H]3CCCCN3C(=O)[C@H](O)CCl)[nH]n2)sc2nccnc12	1817433730	IWPNTGQDZIPMIP-GHMZBOCLSA-N	449.924	1.902	50	20	IDGD	
CN1CCN(CC(=O)Nc2cc([C@H]3CCCCN3C(=O)CCBr)[nH]n2)CC1	1818911805	IVLBOMPZAXDDSU-OAHLLOKOSA-N	441.374	1.434	50	20	IDGD	
C[C@H](NC(=O)c1cnccn1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](F)Cl)CC2	1820023198	SCVXONFPEQKIIF-RVBZMBCESA-N	440.888	1.198	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)c3cc[n+]([O-])cc3)sc2C1	1821054641	SHCIJLRHCUGATC-KOLCDFICSA-N	425.308	1.786	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](O)CCl)CC2)c1cncc2cnccc12	1821208111	KDASQQDBFADHSA-XHDPSFHLSA-N	431.905	1.912	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)COc2ccc(O)nn2)n[nH]1	1821667469	AEZOEOHHZYQVEE-AAEUAGOBSA-N	438.872	1.230	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H]2[C@@H]3C=CS[C@@H]23)n[nH]1	1821710585	AZRRQOUWGPPNPN-MQRGZFNUSA-N	432.550	1.650	50	20	IDGD	
Cc1cnn([C@@H](C)C(=O)Nc2cc([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)c1	1822750489	CGHUZWBLMDAJDA-DOTOQJQBSA-N	444.540	1.541	50	20	IDGD	
O=C([C@H](O)CCl)N1CCCC[C@@H]1C1CCN(C(=O)C(F)(F)C(F)(F)C(=O)O)CC1	1824178030	BWNHARUAWDTUER-VXGBXAGGSA-N	446.825	1.561	50	20	IDGD	
O=C(CSc1nc[nH]n1)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](F)Br)CC2	1826673731	OFOSOTQNADFNPE-WKEGUHRASA-N	449.331	1.656	50	20	IDGD	
O=C(COc1cccnn1)Nc1nc2c(s1)C[C@@H](NC(=O)CCBr)CC2	1826758789	LYYQUFWRAAHEKM-JTQLQIEISA-N	440.323	1.709	50	20	IDGD	
O=C(c1cnccc1F)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827054971	QSARPTKWHQGESQ-OAQYLSRUSA-N	439.296	1.448	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)CCc2cccnc2)CC1	1827218777	YJJRARKVMORMEF-QHCPKHFHSA-N	449.360	1.628	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H]2C[C@H](O)CN2)CC1	1830204461	XHUQUYINLDPNPV-LUKYLMHMSA-N	430.387	1.502	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2[C@@H]3C=CS[C@@H]23)CC1	1831152367	HHYDVXDKWVGLJB-UWHLTILDSA-N	440.374	1.475	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3Cc4ccccc4N3)C2)C1	1831657924	RODZYNDLMINNAC-ZWCUEREDSA-N	435.952	1.887	50	20	IDGD	
COc1ccc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)nn1	1831873432	KMHAZJRKMPMMJP-SFHVURJKSA-N	446.552	1.092	50	20	IDGD	
CC(C)(CCl)C(=O)NC1CCN(C2CCN(C(=O)CCS(C)(=O)=O)CC2)CC1	1833216129	UWTRQXWCKMFCBP-UHFFFAOYSA-N	436.018	1.258	50	20	IDGD	
Cc1ccc(C(=O)C(=O)N2CCC(N3CCC(NC(=O)[C@H](O)CCl)CC3)CC2)cc1	1833312905	KZUOIFBKIDFMRI-LJQANCHMSA-N	435.952	1.349	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H]3CCc4ccccc4O3)CC2)CC1)[C@@H](O)CCl	1833312959	NMQZQOIRPKIHBP-FPOVZHCZSA-N	449.979	1.552	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)nc1C	1833692054	JISJEEDKAYIAOM-OAQYLSRUSA-N	435.597	1.620	50	20	IDGD	
Cc1nscc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1833747026	IEJWJDCTKSLNKL-WFASDCNBSA-N	436.303	1.212	50	20	IDGD	
CCn1ccc(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](F)Br)CC3)CC2)n1	1834274105	WAQUAUWHFLKGME-MRXNPFEDSA-N	444.349	1.779	50	20	IDGD	
Cc1oncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)CBr)C2)C1	1834310583	AQWBXDXYFWYGNU-YVEFUNNKSA-N	430.299	1.084	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)CCN3CCCCC3)CC2)CC1	1834529966	VBBZUKKYECFEAK-HXUWFJFHSA-N	443.032	1.688	50	20	IDGD	
Cc1[nH]nc(C(=O)N2CCC(N3CCC(NC(=O)CO[Si](C)(C)C)CC3)CC2)c1F	1835835031	MGSJRVVZNLDZFO-UHFFFAOYSA-N	439.608	1.894	50	20	IDGD	
O=C(CCc1c[nH]c2ccccc12)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1	1836104866	WQJUMABYFXTBBB-UGKGYDQZSA-N	449.935	1.157	50	20	IDGD	
CC(=O)N(C)[C@@H](C)C(=O)N1CCC(N2CCC(NC(=O)[C@H](F)Br)CC2)CC1	1836412305	DCWKEDQEAJHQDI-LRDDRELGSA-N	449.365	1.115	50	20	IDGD	
CC(C)CNC(=O)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](F)Br)CC2)CC1	1836412621	OIUGAVMYTVTUMA-OAHLLOKOSA-N	449.365	1.021	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3[nH]nc4ncccc34)CCO2)C1	1836451394	WGNBSODIFXRCPX-MGPUTAFESA-N	435.912	1.435	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)/C=C3\C(=O)Nc4ccccc43)CCO2)C1	1837325585	WYHYKXYFXINCES-LTCHYWQDSA-N	447.919	1.496	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3Cc4ccccc4O3)C2)C1	1837713342	XZMAYZNJAKMHKG-SIKLNZKXSA-N	448.592	1.298	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(F)cc3)CCO2)C1	1838956371	HFNAEOZQFKKLML-ACJLOTCBSA-N	429.286	1.679	50	20	IDGD	
Cc1ncsc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2	1839151613	XXBPRAXCRSVHMX-IAGOWNOFSA-N	436.361	1.758	50	20	IDGD	
CC(C)c1nc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)co1	1839197605	BUQRVJMTJLOJOM-DYVFJYSZSA-N	448.289	1.559	50	20	IDGD	
O=C1CCc2ccc(C(=O)N3CCO[C@]4(COCCN(C(=O)C(Cl)Cl)C4)C3)cc21	1839530244	GGVPLHPMTSQRQZ-HXUWFJFHSA-N	441.311	1.689	50	20	IDGD	
Cc1ccncc1CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840186166	FFWDAHJLOZWORB-LJQANCHMSA-N	430.332	1.583	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCn3nc(C)cc3C)CCO2)C1	1840345177	BCQBCFYEHRJIQJ-GHTZIAJQSA-N	440.972	1.754	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccc(F)cc3OC)CCO2)C1	1840934563	FZHVGTICSMRBKU-LAUBAEHRSA-N	442.915	1.851	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)Cc2ccc(Cl)c(F)c2)C1	1841208155	TYFLLDVHVILAQJ-UHFFFAOYSA-N	430.672	1.219	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CC(N)=O)C(=O)N1CC2(CCCN2C(=O)C(C)(C)CCl)C1	1841228009	VQGJBYYSCFWOFC-ZDUSSCGKSA-N	444.960	1.224	50	20	IDGD	
C#CCCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1	1841352613	AVSWSUFYUDHEHF-HOTGVXAUSA-N	441.956	1.486	50	20	IDGD	
CC1(C)C=C(C(=O)N2CC3(CCCN3C(=O)[C@@H](O)CCl)C2)CN1C(=O)c1ccccc1	1841353807	QPGVEHSSMNMSCD-SFHVURJKSA-N	445.947	1.651	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)CCN2C(=O)Cc3ccccc3C2=O)C1	1841402323	LQLMQLBMOAJENM-KRWDZBQOSA-N	431.920	1.822	50	20	IDGD	
Cc1cc[nH]c1C(=O)N1CCCC12CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2	1842229239	ZHPLEOKHIZCCKI-UHFFFAOYSA-N	438.532	1.486	50	20	IDGD	
CC(C)c1csc(C(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)n1	1844263811	XTYBWXSJUWZUCY-UHFFFAOYSA-N	428.518	1.396	50	20	IDGD	
COc1c(Cl)cccc1C(=O)N1CC2(CCCN2C(=O)c2cnccc2C(=O)NN)C1	1844265445	CWMRJGWMFROPMF-UHFFFAOYSA-N	443.891	1.478	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)c2cccc(OC3CCOCC3)n2)C1	1844606762	XJQDLRCQIYMBRC-MRXNPFEDSA-N	437.924	1.710	50	20	IDGD	
C#CCO[C@H](C)C(=O)N1CC2(CCCN2C(=O)c2cc([N+](=O)[O-])ccc2OC(C)=O)C1	1844692025	YTXIHFHQJLCTRH-CQSZACIVSA-N	429.429	1.375	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H]2O[C@H](C[C@@H]2C(=O)N2CCCC23CN(C(=O)[C@@H](F)Cl)C3)C1	1845077188	XXGPMDZIGGRIEM-LXTVHRRPSA-N	445.919	1.749	50	20	IDGD	
CN(C)C(=O)c1cccc(C(=O)N2CC3(CCCN3C(=O)[C@H](F)Br)C2)c1	1845220569	AAJXGLDNQBFUAL-AWEZNQCLSA-N	426.286	1.896	50	20	IDGD	
COc1ccc(/C=C(\C)C(=O)N2CCCC23CN(C(=O)c2ccc(B(O)O)cc2)C3)cc1	1845834131	VOEHJWVKLRFMLJ-SAPNQHFASA-N	434.301	1.296	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC12CN(C(=O)c1cc3n(n1)CCCNC3=O)C2	1846070635	VALZNRKGOXGBRX-LBPRGKRZSA-N	438.326	1.007	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@H]2[C@H]3CN(C(=O)OC(C)(C)C)C[C@H]32)C1	1846134192	OWMUCBONXDVIIH-FZKCQIBNSA-N	441.956	1.557	50	20	IDGD	
CC#C[C@H](CC(=O)N1CCCC12CN(C(=O)c1cccc(B(O)O)c1)C2)c1ccc(O)cc1	1846415886	YKQJGQUKZXTCLQ-LJQANCHMSA-N	446.312	1.086	50	20	IDGD	
Cc1nn(C)cc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1847912596	MGNZIAHXJIFJPP-JYJNAYRXSA-N	439.944	1.676	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(Br)o2)cc1OC	10801274	WZCBSTXKFSIJDG-UHFFFAOYSA-N	427.207	1.677	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c1	15524757	BTQVXHQYSWMHKV-UHFFFAOYSA-N	447.513	1.164	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCCC2)cc1)NNC(=O)COc1ccc(F)cc1	15757959	QXPVULZMHALVHQ-UHFFFAOYSA-N	449.504	1.769	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)c1ccc(Cl)c(Cl)c1)C(=O)NNC(=O)C1CC1	15793798	KJFVYMHULSDUET-ZDUSSCGKSA-N	440.374	1.951	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)CCNS(=O)(=O)c2ccc(C)c(C)c2)c1	28636399	OKJYGOXPNVOOCY-UHFFFAOYSA-N	433.530	1.815	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)CN2C(=O)N[C@@](C)(c3ccc(F)cc3)C2=O)c1	28640272	RDAGCDUZOBEXCJ-QFIPXVFZSA-N	442.447	1.436	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNS(=O)(=O)c2ccc(N3CCCC3=O)cc2)cc1	28808360	UQHVTGIMFDGJKK-HNNXBMFYSA-N	447.513	1.989	50	20	IDGD	
NC(=O)c1cccc(CCNC(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)c1	726717803	FBRMAMPTHBSVDM-UHFFFAOYSA-N	430.408	1.948	50	20	IDGD	
Cc1occc1C(=O)NC1CCN(CC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)CC1	727436574	FCNFDUWRCCBTRU-UHFFFAOYSA-N	429.433	1.152	50	20	IDGD	
Cc1nn(C)c(C)c1CCC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	728215375	YHMFQVDTCHURNV-UHFFFAOYSA-N	434.566	1.049	50	20	IDGD	
Cc1nc(S(=O)(=O)N2CCN(C(=O)/C(C#N)=C/c3cc(C#N)n(C)c3C)CC2)cs1	728556884	YJWXEKHEQOMYRI-LZYBPNLTSA-N	444.542	1.410	50	20	IDGD	
CCCC(=O)N1CCCC[C@@H]1C(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12	730205738	PNCRIVUIBQZAED-QGZVFWFLSA-N	427.505	1.920	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(F)cc2)C1	731491192	GUDCZXGRCLUTRW-CQSZACIVSA-N	435.477	1.696	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCCS(=O)(=O)NCC2CCC2)ccc1OC(C)C	731686265	VSEMKBPBRPKHNC-UHFFFAOYSA-N	442.538	1.146	50	20	IDGD	
CS(=O)(=O)CCN1CCC(NC(=O)NNC(=O)Cc2cccc3ccccc23)CC1	731761483	OCMJKOHMPBHCPM-UHFFFAOYSA-N	432.546	1.222	50	20	IDGD	
CCOc1ccc(/C=C(\C#N)C(=O)NCCNS(=O)(=O)c2ccccc2[N+](=O)[O-])cc1	735060742	UTPIAPWIELNODN-DTQAZKPQSA-N	444.469	1.995	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2c[nH]nc2-c2ccccc2)CC1	735117043	MDVUOUZMKFTPML-UHFFFAOYSA-N	441.517	1.165	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cnn(C)c2)cc1S(=O)(=O)N1C[C@@H](C)C[C@H](C)C1	735445445	VKWQIFTVRYNHJQ-KBPBESRZSA-N	449.533	1.170	50	20	IDGD	
O=C(Cc1cc(O)nc(S)n1)NN=C1C(=O)Nc2c(Cl)cc(Br)cc21	735612907	QYALLRCGNVBLQL-UHFFFAOYSA-N	442.682	1.902	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NNc2ccc(Cl)nn2)o1	735688816	XLYXPHGEFIDSRR-JTQLQIEISA-N	443.869	1.196	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)N[C@H]1CCN(c2ccc(Cl)cc2)C1=O	740483838	IGPRSGJYVYHQNW-AWEZNQCLSA-N	447.835	1.763	50	20	IDGD	
O=C(NNC(=O)[C@@H](c1cccc(F)c1)N1CCOCC1)c1nnc(O)c2ccccc12	742033645	DQOLPHYAGAJUIP-GOSISDBHSA-N	425.420	1.309	50	20	IDGD	
CC(=O)N[C@H](Cc1c[nH]c2ccc(Br)cc12)C(=O)NNC(=O)c1cnn(C)c1	742079702	ULSNXOIIDVHVEW-MRXNPFEDSA-N	447.293	1.172	50	20	IDGD	
COc1cc(C(=O)NNc2nc(-c3ccncc3)no2)cc(NS(C)(=O)=O)c1OC	742613747	WHMPVNJZZYYMNS-UHFFFAOYSA-N	434.434	1.277	50	20	IDGD	
COc1ccc(CC(=O)NCc2ccc(C(=O)NNc3ncnc4[nH]cnc34)cc2)cc1	743471473	JLJQBQMTQPVAPL-UHFFFAOYSA-N	431.456	1.977	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)nc1	743805900	WOVBETSSESDJIW-UHFFFAOYSA-N	427.508	1.320	50	20	IDGD	
CC(C)[C@@H](NC(=O)c1ccccn1)C(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	743829801	DNBGWKILYIBVIK-MRXNPFEDSA-N	433.490	1.092	50	20	IDGD	
CCNS(=O)(=O)c1ccc(C)c(C(=O)OCC(=O)NNC(=O)c2cccc(C)c2)c1	744471067	NUBNBIXRJUXJNV-UHFFFAOYSA-N	433.486	1.220	50	20	IDGD	
Cc1ccc(N2C[C@@H](C(=O)OCC(=O)NNC(=O)c3ccc(C#N)cc3)CC2=O)cc1F	744497035	IVNATXCJNMCLNO-INIZCTEOSA-N	438.415	1.363	50	20	IDGD	
COc1ccccc1C1(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)CC1	744622095	WMFBYBVSMSZBKG-UHFFFAOYSA-N	431.514	1.891	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)[C@H]2CCCN2Cc2ccccc2)ccc1Cl	745835668	VCTVWTIWTJDICU-MRXNPFEDSA-N	436.921	1.413	50	20	IDGD	
CCN1CCO[C@H](C(=O)NNC(=O)c2ccc(CSc3nc(C)cc(C)n3)cc2)C1	746113212	NOUCURSDDQYVEE-SFHVURJKSA-N	429.546	1.867	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(CCNC(=O)NNc2nc(C)cc(OC)n2)s1	746757798	BHHXBNVSDAWERR-UHFFFAOYSA-N	442.567	1.754	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1	746758557	LMWZPXHDHGYAEN-UHFFFAOYSA-N	440.479	1.508	50	20	IDGD	
CCCOc1ccc(CC(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)cc1OCCC	746833743	GCRIBYPUUQVALX-OAHLLOKOSA-N	427.523	1.324	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNS(=O)(=O)c1cc(C(=O)OC)cc(C)c1C	747595775	FVZDTXBKEWGINF-UHFFFAOYSA-N	436.486	1.877	50	20	IDGD	
COc1cc(S(=O)(=O)NNC(=O)c2ccc3c(c2)OCCO3)ccc1Br	747601009	JHVUVOSRBDPJEE-UHFFFAOYSA-N	443.275	1.852	50	20	IDGD	
Cc1cc(OCc2ccc(C(=O)NNC(=O)C3=NN4CCCN=C4N3)cc2)ccc1Cl	748015133	ZBYKRONRBBVSCW-UHFFFAOYSA-N	440.891	1.967	50	20	IDGD	
COc1ccc(-n2cc(O)c(C(=O)NNc3ccc(S(=O)(=O)NC4CC4)cc3)n2)cc1	748038650	MYKWHZFDDCHAFH-UHFFFAOYSA-N	443.485	1.784	50	20	IDGD	
CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	749322938	HPSQJHJBHUHISL-GOSISDBHSA-N	427.392	1.724	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)NCC2CCN(CC(=O)NC(C)(C)C)CC2)c1	751111012	KWAWLUSFIHLVAS-UHFFFAOYSA-N	433.553	1.331	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCC[C@@H]2CCO[C@H](C)C2)c1	753347624	SNDPZJQWZRYHIX-HZPDHXFCSA-N	440.566	1.866	50	20	IDGD	
Cc1cnccc1CCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	755089197	KONMARKMJSQUCV-UHFFFAOYSA-N	431.518	1.361	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)Nc1ccc(S(=O)(=O)N2C[C@H](C)C[C@@H](C)C2)cc1	755420958	OSDOTXGMPCICCY-CHWSQXEVSA-N	434.522	1.851	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)Nc2ccccc2C(=O)N2CCOCC2)cc1	755624470	UMMZOMFTIMBNIK-UHFFFAOYSA-N	428.445	1.399	50	20	IDGD	
O=C(NC[C@@H]1CSCCS1)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	756052116	FJHJCDKCIBXMQQ-CQSZACIVSA-N	444.604	1.264	50	20	IDGD	
COC(=O)N(C)Cc1ccc(NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1	756609385	BLCLAXXTLOOMKY-UHFFFAOYSA-N	438.444	1.598	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCC2CCS(=O)(=O)CC2)ccc1OCCC(C)C	756754916	WJTOQDKWCCGUTC-UHFFFAOYSA-N	441.550	1.889	50	20	IDGD	
CCOc1cc(C(=O)N(C)C)ccc1NC(=O)NNC(=O)COc1ccccc1C#N	756868619	LKOOTMYAZCVAGF-UHFFFAOYSA-N	425.445	1.890	50	20	IDGD	
CC[C@@H]1CN(CC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)CC[C@@H]1NC(=O)OC(C)(C)C	757103929	FZSOUCSWEVAJEY-PBHICJAKSA-N	449.508	1.981	50	20	IDGD	
Cn1cc(Br)cc(NC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])c1=O	757592610	JTMVGNYJGWBKEM-UHFFFAOYSA-N	440.210	1.288	50	20	IDGD	
COC(=O)c1cc(NC(=O)NNC(=O)c2cccc3ncccc23)cc(S(C)(=O)=O)c1	757674022	NTVSPAXNIINWBK-UHFFFAOYSA-N	442.453	1.891	50	20	IDGD	
COc1ncncc1NC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	757690639	ODQZVTQOVIIKLV-UHFFFAOYSA-N	448.486	1.814	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)CCc1c(-c2ccc(F)cc2)[nH]c2ccccc12	758048747	VIZVAWKQBHJQLK-CYBMUJFWSA-N	446.504	1.992	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=S)NC[C@@H]1CCCCO1	758251324	JJGTUZNFWXXEET-KRWDZBQOSA-N	440.013	1.522	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)N1CCO[C@H](c2cccc(OC(F)F)c2)C1	758745468	KNJYHYDGXJLSSI-HNNXBMFYSA-N	438.387	1.425	50	20	IDGD	
Cc1ccc(C(=O)NNS(=O)(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)o1	760366517	ZAAPWHTYRMJBDB-UHFFFAOYSA-N	427.504	1.386	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)c2ccc(=O)n(-c3cnn(C)c3)c2)c1	760814549	RPQZJANEOAAYGN-UHFFFAOYSA-N	446.261	1.417	50	20	IDGD	
COc1ccc2c(c1)[C@@H](C(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1)CC2	761403772	WBWCHXRMYUMJOW-SFHVURJKSA-N	431.514	1.502	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)NCc1cccc(CS(C)(=O)=O)c1	761675491	ZDQYGMLRZDXXDW-UHFFFAOYSA-N	437.543	1.863	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@@H](C)c3cccc([N+](=O)[O-])c3)CC2)cc1	762089055	YUFYBGAELDCOEJ-SFHVURJKSA-N	439.516	1.972	50	20	IDGD	
CC[C@@H]1CN(C(=O)/C(C#N)=C\c2cn(CCC(N)=O)nc2-c2ccc(OC)cc2)C[C@H]1O	762209691	XLZZMCIWSCCQGZ-YBBBUGGBSA-N	437.500	1.570	50	20	IDGD	
O=C(CCCC[C@@H]1SC[C@H]2NC(=O)N[C@@H]21)NNC(=O)c1cc(-c2ccccc2)[nH]n1	762937962	OCWBRLQJZAXWMJ-RYRKJORJSA-N	428.518	1.564	50	20	IDGD	
CC(C)n1cnnc1-c1ccccc1NC(=O)C(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	763445066	DYZLFVMKJQJZQD-UHFFFAOYSA-N	437.416	1.834	50	20	IDGD	
Cn1c(=O)n(C)c2cc(NC(=O)C(=O)NNC(=O)c3ccccc3Br)ccc21	763482562	HYJNNGJXWNZMAH-UHFFFAOYSA-N	446.261	1.039	50	20	IDGD	
CN1CCc2ccc(NC(=O)C(=O)NNC(=O)c3ccccc3Br)cc2C1=O	763482970	PUYDXBJLQYGITG-UHFFFAOYSA-N	445.273	1.477	50	20	IDGD	
CCOC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1	763574450	ZKCICVQQGMKUSH-INIZCTEOSA-N	428.401	1.181	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(NC(=O)NC[C@H]3CCCO3)cc2)c(C)o1	763583335	MHQYSTPPCUHOCO-MRXNPFEDSA-N	443.460	1.597	50	20	IDGD	
CC(C)(C)OC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2F)cn1	763680045	RBIBXVPHRLPMSL-UHFFFAOYSA-N	447.423	1.733	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cccc(Cl)c2)cc1C(=O)OC	763747241	CXLPKXNBHGBNFE-UHFFFAOYSA-N	433.804	1.313	50	20	IDGD	
COC(=O)CCSc1cccc(NC(=O)C(=O)NNC(=O)c2cccc(N(C)C)c2)c1	763759183	WLULNOWPCCAGGL-UHFFFAOYSA-N	444.513	1.808	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(Cl)c(C[S@](C)=O)c2)c1	763760376	LHQNTWMKZBHIHU-LJAQVGFWSA-N	436.921	1.684	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2cc(F)cc(Cl)c2)c2ccccc2c1=O	763786884	RGVSQZXJGPETGU-UHFFFAOYSA-N	431.811	1.609	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)C(=O)N1C[C@H]2CCCN2c2ccccc21	763790630	MARWITYWXQJONC-CYBMUJFWSA-N	432.440	1.112	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)cnc1Br	763814149	QMHRVJKJWHTFAS-UHFFFAOYSA-N	432.234	1.189	50	20	IDGD	
Cc1nc(N2CCOCC2)ccc1NC(=O)C(=O)NNC(=O)Cc1c[nH]c2ccccc12	763864539	CYEDFBDWMGYHFW-UHFFFAOYSA-N	436.472	1.037	50	20	IDGD	
CC(=O)Nc1cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)ccc1Cl	763864936	MFAFKSXYURHFMJ-JTQLQIEISA-N	436.827	1.991	50	20	IDGD	
Cc1ccc(Cn2nccc2NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)o1	763867565	WVMABNSKZSKMEV-ZDUSSCGKSA-N	429.408	1.525	50	20	IDGD	
CCCCn1ncc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(C(C)=O)cc2)c1C	763872148	KUMJESJZOPVQDK-OAHLLOKOSA-N	429.477	1.748	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)C(=O)Nc1cccc(CS(=O)(=O)c2ccccc2)c1	763999191	QVXXXQYUKSOABF-UHFFFAOYSA-N	440.481	1.399	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1N1CCOC1=O	764003183	BSHUYQIRGHRGQA-UHFFFAOYSA-N	440.412	1.123	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cc(C(=O)N3C[C@H](C)C[C@@H](C)C3)ccc2C)n[nH]1	764106595	NBHGKSSLBUHJRO-CHWSQXEVSA-N	440.504	1.544	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)CC(F)(F)F)cccc1S(=O)(=O)NC(C)(C)C	764112334	JTMSAFQFNDBOPH-UHFFFAOYSA-N	438.428	1.110	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2cc(NC(C)=O)ccc2OC)cc1	764131697	MKBKQQMPCHDUSF-UHFFFAOYSA-N	428.445	1.381	50	20	IDGD	
Cc1ncsc1C(=O)NNC(=O)C(=O)Nc1ccc(C(=O)NC2CCCCC2)cc1	764244678	JYSBMZLLCBVRJD-UHFFFAOYSA-N	429.502	1.914	50	20	IDGD	
Cc1ncsc1C(=O)NNC(=O)C(=O)Nc1ccc(OCCN(C)C)c(Cl)c1	764246769	QSVSCNZKOCYAEE-UHFFFAOYSA-N	425.898	1.445	50	20	IDGD	
CC(C)Oc1ccc(Br)cc1NC(=O)C(=O)NNC(=O)Cc1cccnc1	764265601	BMRJJUJUMAFVNG-UHFFFAOYSA-N	435.278	1.960	50	20	IDGD	
CCOC(=O)c1c(C2CC2)csc1NC(=O)C(=O)NNC(=O)COc1ccccc1O	764275733	SJBXRWOOQPXSRU-UHFFFAOYSA-N	447.469	1.673	50	20	IDGD	
COc1cc(C(=O)N(C)C)ccc1NC(=O)C(=O)NNC(=O)C(C)(C)c1ccccc1	764308947	JIHGJQYRPCSMSZ-UHFFFAOYSA-N	426.473	1.461	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)nn1-c1cccc(F)c1	764351265	QRDZBIKYQXJYKV-UHFFFAOYSA-N	447.430	1.905	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)C(=O)Nc1ccn(CCc2ccncc2)n1	764405237	QWEAVUNZIUWTEM-UHFFFAOYSA-N	440.485	1.105	50	20	IDGD	
O=C(CCC(=O)N1CCN(c2ccccn2)CC1)NNC(=O)c1ccc(Cl)cc1F	765767640	LPXKTXDYYYZPKQ-UHFFFAOYSA-N	433.871	1.764	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@H]2CC(C(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)C[C@H](C1)C2=O	767763794	QVWXZGZCRFPGKP-GOOCMWNKSA-N	446.460	1.818	50	20	IDGD	
CCOC1CC(CNC(=O)NNC(=O)CCc2ccc(OC)cc2)(N2CCOCC2)C1	767887430	GPORVZFYSXBIPZ-UHFFFAOYSA-N	434.537	1.228	50	20	IDGD	
CC(C)c1cc(NC(=O)C(=O)NNC(=O)Cc2ccccc2F)n(-c2ncccn2)n1	768241740	ILOSIBKRDMBTCC-UHFFFAOYSA-N	425.424	1.253	50	20	IDGD	
COc1cc(I)c(C(=O)NNC(=O)c2cc(C)[nH]n2)cc1OC	768277096	BFDITNSPURBWAC-UHFFFAOYSA-N	430.202	1.415	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)N[C@H]2CCO[C@@]3(CCSC3)C2)nc1	769239749	MOPVXHBZNZVDAB-GUYCJALGSA-N	429.568	1.449	50	20	IDGD	
COC(=O)c1n[nH]c2ccc(NC(=O)NNc3c(OC)cccc3S(C)(=O)=O)cc12	769242181	SUVPTYBWFYELDC-UHFFFAOYSA-N	433.446	1.910	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)N[C@@H]3CCC[C@@H](S(C)(=O)=O)C3)nc21	770396400	HXVIGAISFCVBBT-GHMZBOCLSA-N	425.515	1.269	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	770650547	VSKYLQYRBYJVPL-BZNIZROVSA-N	434.836	1.309	50	20	IDGD	
CN1CC(=O)N(CCCC(=O)NNC(=S)Nc2cccc(Br)c2)C1=O	770997186	VMCNWDMJFWRFET-UHFFFAOYSA-N	428.312	1.441	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)c1ccc2c(=O)n3c(nc2c1)CCCCC3	771848497	BBOUXGYHAJBNIB-AWEZNQCLSA-N	428.489	1.862	50	20	IDGD	
Cc1csc([C@](O)(CC(=O)O[C@H](C)C(=O)NNC(=O)CC(C)C)C(F)(F)F)n1	772064608	OECMCRNSYLZRHQ-MEBBXXQBSA-N	425.429	1.717	50	20	IDGD	
C[C@H]1CN(c2ccnc(C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)c2)C[C@H](C)O1	772284067	PVZLMOXSBPFYRR-KBPBESRZSA-N	436.513	1.164	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1cnn([C@@H]2CCCN(C(=O)OC(C)(C)C)C2)c1	772300798	NWCNZFQRLKZCLN-UKRRQHHQSA-N	437.497	1.558	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)[C@H]1CN(Cc2ccccc2)CCO1	772885267	YJMCZYCYJAAECV-GOSISDBHSA-N	430.892	1.005	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)cc1C(=O)O	773266257	RRNGAWDEOMQIFM-SNVBAGLBSA-N	428.850	1.824	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)C(=O)Nc1ccc(C(F)(F)F)cn1	773662146	PNGJUQBOHIZCSM-UHFFFAOYSA-N	443.407	1.623	50	20	IDGD	
O=C(COC(=O)c1ccccc1OC(F)(F)F)NNC(=O)[C@@H]1COc2ccccc2O1	775110648	UZJFEWAXVAXOAL-HNNXBMFYSA-N	440.330	1.729	50	20	IDGD	
Cc1cc(CNC(=O)NNC(=O)c2cc3c(s2)CC[C@@H](C)C3)ccc1S(N)(=O)=O	775228567	JIESIDBTCUVYLU-LLVKDONJSA-N	436.559	1.973	50	20	IDGD	
Cc1c(C(=O)N2CCN(S(=O)(=O)CBr)CC2)cnn1Cc1ccccc1	777837628	PIZCRKWCAGQELG-UHFFFAOYSA-N	441.351	1.680	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1c(C)nn(C)c1-n1cccn1	778483031	QROAIQPEBSATFM-UHFFFAOYSA-N	446.851	1.194	50	20	IDGD	
CCc1cnccc1CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(CC)CC)c1	779408539	VNKWKTSHVOKJRL-UHFFFAOYSA-N	433.534	1.819	50	20	IDGD	
O=C(NN=c1cc[nH]cc1)c1cc(S(=O)(=O)N2CCOCC2)c(Cl)cc1Cl	780761204	KJZYCHYBTLIYFX-UHFFFAOYSA-N	431.301	1.588	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3c[nH]nc3-c3cnn(C)c3)n[nH]2)cc1OC	780976684	XSZHBMHRVRLBLI-UHFFFAOYSA-N	436.432	1.292	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)NCc1cccc(S(=O)(=O)N(C)C)c1	782763403	AFPFDBVOILYZJK-CYBMUJFWSA-N	438.481	1.374	50	20	IDGD	
Cc1ccc(NNC(=O)C(=O)Nc2ccc(C(=O)NCC(=O)N(C)C)c(Cl)c2)cc1	783348644	QJOLSRDLRKMTEF-UHFFFAOYSA-N	431.880	1.548	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1cccc(CC(F)(F)F)c1	784005128	PZLGJAUUOCQWEO-UHFFFAOYSA-N	428.392	1.369	50	20	IDGD	
O=C(NNc1ccnc(Br)c1)C(=O)Nc1ccc(S(=O)(=O)C(F)F)cc1	784828489	IYCZTGCIHQJPPF-UHFFFAOYSA-N	449.233	1.922	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)C(=O)Nc2cccc(CN3CCOC3=O)c2)c1	784844058	FMYJLXKGCMLQBL-UHFFFAOYSA-N	432.458	1.124	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc4c(c3)CC(=O)N4)n[nH]2)c1	785125149	BFYQOJBWVPWVAV-UHFFFAOYSA-N	432.440	1.588	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2cccc([C@@H](C)N3CCOCC3)c2)n1	785227924	ZVTSRCDMLCNFQM-MRXNPFEDSA-N	441.536	1.798	50	20	IDGD	
CSCCNC(=S)NNC(=O)CCOc1ccccc1I	785230039	VIBYHWDRQRANKB-UHFFFAOYSA-N	439.344	1.918	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2ccc(N3CCN(C)CC3)c(Br)c2)ncn1	787898785	NHZHBHQHDYJVFC-UHFFFAOYSA-N	448.325	1.381	50	20	IDGD	
COC(=O)c1cncc(S(=O)(=O)NNC(=O)NCc2cccc(C(F)(F)F)c2)c1	788479716	GZRBPRDTGRQJGP-UHFFFAOYSA-N	432.380	1.580	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)c(C)cc1C	789822316	WGMKQZXMYXTZRY-LPHOPBHVSA-N	439.468	1.749	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2ccnc(N(C)C)n2)cc(N2CCN(C(C)C)CC2)c1	792289575	ALTGZGYYGGNOEY-UHFFFAOYSA-N	440.552	1.463	50	20	IDGD	
COCc1cc(C(=O)OC)cc(S(=O)(=O)NNC(=O)c2cc(OC)cc(OC)c2)c1	793350415	NFEZOVIGMILCCX-UHFFFAOYSA-N	438.458	1.260	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C[C@@H]1COCCN1C(=O)OC(C)(C)C	794787446	ILTAFUSWEASIFX-UKRRQHHQSA-N	425.457	1.766	50	20	IDGD	
CC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)NNc1ccccc1S(=O)(=O)N(C)C	795176885	GSSMBQWZKOYHMV-LJQANCHMSA-N	443.529	1.609	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CSCCOCCN2C(=O)c3ccccc3C2=O)c1	795244949	JAYUMUUUFJSYHB-UHFFFAOYSA-N	441.509	1.802	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)CCc2cccc(Cl)c2)c1	795280748	LYSPBMILVVDFPJ-UHFFFAOYSA-N	445.950	1.397	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2c(F)ccc([N+](=O)[O-])c2C)cc1	800622760	RNWFHTDGAFTUFZ-GFCCVEGCSA-N	448.407	1.994	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)N[C@@H]1CCCN(C(=O)Cc2ccccc2)C1	800983324	GNHULDGLMDSDRS-GOSISDBHSA-N	440.500	1.638	50	20	IDGD	
Cc1ccc([C@@]2(C)NC(=O)N(CC(=O)NNC(=O)Nc3ccc4c(c3)OCO4)C2=O)cc1	802101244	ILQGPWIHYUJOOH-OAQYLSRUSA-N	439.428	1.344	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)NCc1ccncc1OC[C@@H]1CCOC1	807615571	IQEGNRHGWUAAFU-CQSZACIVSA-N	445.432	1.315	50	20	IDGD	
O=C(NNc1cccc(F)n1)c1cccc(NS(=O)(=O)c2ccc3nnn(O)c3c2)c1	807748588	LCARUSYFVIPJEQ-UHFFFAOYSA-N	443.420	1.760	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)nn1-c1ccc(F)cc1F	808934828	WHYRURNDKHTEAI-KRWDZBQOSA-N	441.394	1.549	50	20	IDGD	
Cc1nn(C)cc1S(=O)(=O)NC(=O)/C(C#N)=C\c1cc(C)n(C[C@H]2CCCO2)c1C	809034158	RPTNUUXTPKKJEE-ZTXRYZOMSA-N	431.518	1.738	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3cncc(C(F)(F)F)c3)cc2)CC1	809664855	NNCFZHGAOHMXKV-UHFFFAOYSA-N	443.451	1.793	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2ccc(C(N)=O)cc2OCC(F)F)c(OC)c1	810301941	JTOQXGAUZQGNDO-UHFFFAOYSA-N	438.387	1.913	50	20	IDGD	
CC(C)Nc1ccc(S(=O)(=O)NCC(=O)NNc2ncncc2Cl)cc1[N+](=O)[O-]	811327119	YXRJIKPJJMMVMG-UHFFFAOYSA-N	443.873	1.280	50	20	IDGD	
C[C@@H](C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1)S(=O)(=O)c1ccc(F)cc1	812728839	BMONNCFGSNBJJC-LBPRGKRZSA-N	429.495	1.382	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)o2)cc1	812732737	RLNJPWKGHNBIMM-UHFFFAOYSA-N	442.519	1.071	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccnn2Cc2ccccc2)cc1	813033628	CIAISBQGXXDOBA-UHFFFAOYSA-N	442.501	1.264	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@H]2NC(=O)NNC(=O)Cc1cn2ccccc2n1	813809655	VIBIWJHYHHUBDI-MRXNPFEDSA-N	442.520	1.997	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1ccccc1Br	815750896	MSNQKWIRIUIRKE-UHFFFAOYSA-N	441.307	1.781	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)[C@H](CCS(C)(=O)=O)NC(=O)c2ccc(Cl)cc2)n1	837302382	OTGWYPGLPIOBNK-HNNXBMFYSA-N	439.925	1.423	50	20	IDGD	
CCC[C@H](NC(=O)NCc1ccc(Br)cc1)C(=O)N1CC[C@H](B(O)O)C1	864234528	SGIIBGSGOZTJLX-ZFWWWQNUSA-N	426.120	1.492	50	20	IDGD	
O=C([C@@H]1CCCCN1C(=O)c1ccc(Br)c(F)c1)N1CC[C@H](B(O)O)C1	864234693	TZBMQOILXTULTQ-WFASDCNBSA-N	427.079	1.658	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1ccc(Cl)cc1)C(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	912771421	FUTXKIAWHSWQNF-SNVBAGLBSA-N	426.838	1.376	50	20	IDGD	
CSc1nc(O)c(C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)cc1C#N	913623911	OTHABQJTAAOIDW-UHFFFAOYSA-N	438.469	1.746	50	20	IDGD	
CCn1c(=O)nc(O)c2c(C(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)cc(C3CC3)nc21	913962392	SYVLRVUDNNILIP-UHFFFAOYSA-N	438.400	1.377	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)Cc2c(C)[nH]c(-c3ccncc3)nc2=O)c1C	915790515	KGTXHFNFJLIHCF-MRXNPFEDSA-N	435.484	1.915	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)NC[C@@H](c2cccs2)N2CCN(C)CC2)c1	915902520	WGGWSDLEPKERBD-SFHVURJKSA-N	431.562	1.754	50	20	IDGD	
CC(=NNC(=O)CNc1ccccc1F)c1ccc(S(=O)(=O)N2CCNCC2)cc1	915920970	ZNFVLYNDWOQVCX-UHFFFAOYSA-N	433.509	1.372	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)c2cnn(C(C)(C)C)c2C(F)(F)F)c2ccccc2c1=O	916124844	WAALWBORCAERGI-UHFFFAOYSA-N	436.394	1.979	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)COc1ccc(C#N)cc1)N1CCN(c2ccccc2)CC1	916515046	YTMWJFXBOACHJF-GOSISDBHSA-N	436.516	1.478	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H]2CCN3CCCC[C@H]23)c1	916638600	JADUGHLEIHJXOW-ZWKOTPCHSA-N	437.566	1.288	50	20	IDGD	
CCOC(=O)c1c(S(=O)(=O)NNC(=O)c2cc3c(s2)CC[C@@H](C)C3)n[nH]c1C	917728399	SRCZUXSBAARILG-SECBINFHSA-N	426.520	1.704	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)[C@@H](C)Sc2nncn2C)c2ccccc2c1=O	917919995	LWQQQFZFIXSXRO-CYBMUJFWSA-N	443.533	1.657	50	20	IDGD	
C[C@H](NC(=O)NN[C@@]1(C)CCS(=O)(=O)C1)c1cc2c(cc1Br)OCCO2	918097490	QXIUXXVMQAFUDB-QFYYESIMSA-N	448.339	1.662	50	20	IDGD	
COc1cccc([C@H](C)C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c1	919678199	UMXVXRDLAYLCOX-HNNXBMFYSA-N	447.513	1.281	50	20	IDGD	
O=C(Cc1csc(N2CCOCC2)n1)NN=Cc1cc2c(cc1[N+](=O)[O-])OCCO2	920369258	VAMJADWHYODSCL-UHFFFAOYSA-N	433.446	1.352	50	20	IDGD	
O=C(CN1CCCC1=O)NNC(=O)c1ccc(NS(=O)(=O)c2ccc(F)cc2)cc1	920825574	CGXYNJIGCXINQQ-UHFFFAOYSA-N	434.449	1.010	50	20	IDGD	
Cc1cccc(NS(=O)(=O)c2ccc(C(=O)NNC(=O)CN3CCCC3=O)cc2)c1C	920827726	WYZSSVVVVMLLJP-UHFFFAOYSA-N	444.513	1.488	50	20	IDGD	
O=C(NNC(=O)[C@@H](Cc1ccccc1)NC(=O)c1cccnc1)c1ccc([N+](=O)[O-])cc1	921298208	QVMMQIOAZYVUFA-LJQANCHMSA-N	433.424	1.792	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)c1ccc(N2CCC[C@@H](C(N)=O)C2)cc1	1115885907	JWAXBBHFHSKORG-MRXNPFEDSA-N	425.489	1.270	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N2CC(O)(C3CC3)C2)cc1	1116778069	RWJIQPRPNFZYIZ-YBEGLDIGSA-N	435.484	1.324	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4nc(CO)[nH]c4c3)C2)C1	1777702392	FEWYHVFATKEWJQ-QVKFZJNVSA-N	434.924	1.906	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc3cn[nH]c3cn1)C2	1779545428	LIEKVWWQPFFLJO-WIYYLYMNSA-N	445.596	1.937	50	20	IDGD	
COC(=O)c1ccc(CC(=O)N2CC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)s1	1780898426	FDBLNXVURSBPGF-QGZVFWFLSA-N	435.329	1.711	50	20	IDGD	
O=C(c1c[nH]c2nccc-2c1)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781331054	KGBDMTZUUXSTQR-CXAGYDPISA-N	425.258	1.649	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H]3C[C@@]34C(=O)Nc3ccccc34)C2)C1	1783496620	XNYYESGUNWTTNM-DJDZNOHASA-N	431.920	1.744	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)CCNC(=O)OC(C)(C)C)CCO2)C1	1783537230	JREKRZGKPZNQNM-ACJLOTCBSA-N	448.358	1.515	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(=O)c4ccccc4o3)CCO2)C1	1783870156	VFSLSLOIMVXSCM-BTYIYWSLSA-N	434.876	1.490	50	20	IDGD	
Cc1cc(C)n(CCC(=O)N2CC[C@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)n1	1784321068	LQQUYSRPYOPOGX-OALUTQOASA-N	431.364	1.956	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)c1cccnc1OCC1CC1	1785733715	NPJZYHMNAYTEKP-DKIMLUQUSA-N	437.924	1.063	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3ccc4c(c3)OCO4)[C@H]2C1	1786597917	XXKOAAFGRFMDJW-GGXPGOJBSA-N	438.908	1.191	50	20	IDGD	
Cc1cnn(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)CBr)C[C@@H]32)c1	1787114009	JKFYYSQNBXCGIZ-UGUYLWEFSA-N	427.343	1.202	50	20	IDGD	
O=C(Cc1cncnc1)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1	1788140175	MATMXFJIOLRNDJ-UHFFFAOYSA-N	430.273	1.147	50	20	IDGD	
O=C(Cc1cccnc1)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1	1788267432	ZWABFKOAKMCNJD-UHFFFAOYSA-N	429.285	1.752	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4nc[nH]c4c3)[C@H]2C1	1788330657	GNFFOGCPZAJSPM-MJFSBKNWSA-N	435.322	1.940	50	20	IDGD	
O=C(/C=N/O[C@@H]1CCCCO1)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21	1788657587	BROYVYOYWDNARR-ONDITIQCSA-N	446.342	1.280	50	20	IDGD	
CCN(CC)C[C@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)Br)[C@H]2C1	1791063104	ACOHJPVBPSBKLP-WOYTXXSLSA-N	432.403	1.727	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](NC(=O)OC)c1ccccc1	1792906113	RTRZOOMKRTXJDR-CWQOZTLDSA-N	437.924	1.976	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CNC(=O)OC(C)(C)C	1793011347	BNPQFUUBNCCYFO-RKQHYHRCSA-N	448.358	1.294	50	20	IDGD	
C=CCCc1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)c(O)n1	1794823717	LMLWHVJWTHTPOQ-ACDBMABISA-N	449.316	1.151	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccn(C(F)F)c1=O)C2	1795115902	SPZYMIPKTJYBLC-GNXNZQSNSA-N	448.264	1.232	50	20	IDGD	
CN(C)CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](Br)Cc1ccccc1)C2	1795185911	PVDVTHHBYVFYDX-SFNKJDCFSA-N	438.366	1.144	50	20	IDGD	
N#CC1(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](Br)Cc2ccccc2)C3)CC1	1795413084	MISOVXAUIWBTPN-MHORFTMASA-N	446.345	1.886	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2c(c1)n(C)c(=O)n2C	1796982706	CYYMOFPACHQZGP-KRXQYRFLSA-N	434.924	1.098	50	20	IDGD	
CO[C@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnccc1C(=O)NN)c1ccccc1	1798439195	NPEXFEQPHHUFHV-CLWJZODNSA-N	437.500	1.325	50	20	IDGD	
Cc1ccc(F)c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)c1	1798441991	RDXFCURSEOMYHN-QDMKHBRRSA-N	425.464	1.698	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cn1ccnn1)C2	1799217866	KSQOBZVTAJKWCG-QDMKHBRRSA-N	442.432	1.064	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cn1cncn1)C2	1799217957	PDAINLAWJDBUTC-QDMKHBRRSA-N	442.432	1.064	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c(c1)OCO3)C2	1799274771	APPAYDPIOJBDGK-AODNKKSCSA-N	429.300	1.855	50	20	IDGD	
C[C@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1ccc(O)cc1	1799302224	KXKGOXZFYUCNFO-APDPGRRMSA-N	429.286	1.776	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccon1)C2)[C@@H](Br)Cc1ccccc1	1800435324	DXGOJZVXAZVIHL-DFGXFYAUSA-N	448.317	1.884	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccc2c(c1)CCO2	1800689316	AWFQSXLUKYGETP-XJTZBENFSA-N	437.334	1.537	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc(Cl)c(Cl)c1)C2	1800977210	UOGLUSVTVFNVPK-XCCSTKFXSA-N	436.723	1.845	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)Oc1ccccn1	1801362667	QCZVPFDIPFUCNK-LBKYZSNHSA-N	440.338	1.470	50	20	IDGD	
O=C(Cn1cnnn1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](Br)Cc1ccccc1	1801568532	ZIWCFEFJICASCW-YYIAUSFCSA-N	447.337	1.318	50	20	IDGD	
O=C1C[C@H](C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](Br)Cc2ccccc2)CN1	1801570783	WENVNWSITNWPHR-JCECYMMASA-N	448.361	1.767	50	20	IDGD	
C[C@@H](CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCC(=O)NN(C)C)Oc1ccccc1	1802338645	VNGHZVQNUBZCTJ-OKYOBFRVSA-N	430.549	1.855	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@H]1c1cccnc1)c1csnn1	1803753068	IFQFKDLLDKIMAP-DRZSPHRISA-N	428.287	1.943	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)c2cocn2)[C@H]1c1cccnc1	1806019378	XZBLNCQURKXGAN-RUVVGEKZSA-N	449.471	1.523	50	20	IDGD	
COC(=O)CSCC(=O)N1CCCC2(CCN(C(=O)[C@@H](F)Br)CC2)C1	1806036512	DKAPOIPDBYOBPA-CQSZACIVSA-N	439.347	1.814	50	20	IDGD	
CCc1[nH]nc(C(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@H]2c2cccnc2)c1Cl	1807700961	UGCLFYVGNFXRTF-QEORTHHSSA-N	440.331	1.940	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H](CNC(=O)Cn2nccn2)[C@@H]1c1cccnc1	1808961854	YKVRBKCPKRRQME-HFTRVMKXSA-N	425.320	1.615	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)[C@H]2CC2(F)F)[C@H]1c1cccnc1	1809524174	ZFNRABYSISVXRT-KBRIMQKVSA-N	444.442	1.055	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)c1cnn2cccnc12	1809736322	CUUBPFOOPNGTLT-BHYGNILZSA-N	428.880	1.044	50	20	IDGD	
COc1ccsc1C(=O)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1	1809977652	MDGZBVZZCYDXNR-UHFFFAOYSA-N	442.346	1.595	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)[C@@H]3Cc4ccccc4O3)CC2)C1	1809978735	LYIPOYKWJVFGSL-QFIPXVFZSA-N	448.328	1.215	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1CCN(C(=O)c2ccc[n+]([O-])c2)[C@H]1c1cccnc1	1810541539	UVNZSBUEJPVSNA-PXNSSMCTSA-N	428.565	1.886	50	20	IDGD	
Cn1cc2cc(C(=O)NC[C@@H]3CCN(C(=O)[C@@H](O)CCl)[C@@H]3c3cccnc3)ccc2n1	1812095428	SICVIJARSMWEHU-FFZOFVMBSA-N	441.919	1.888	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)CSCC(=O)OC)[C@@H]1c1cccnc1	1813028525	RVRXEDAEEFZTRN-RVKKMQEKSA-N	443.953	1.247	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2cc(C(=O)O)ncn2)[C@@H]1c1cccnc1	1813029827	YXQVUDXALMDDKS-GRDNDAEWSA-N	447.879	1.143	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)N1CC[C@H](CNC(=O)[C@H](Cl)COC)[C@@H]1c1cccnc1	1813034784	XSSSAWICLCJYKK-DZUCGIPZSA-N	441.912	1.903	50	20	IDGD	
C[C@H](C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1)C1(O)CCC1	1814428975	RGQNOTRBOOFUJS-GDBMZVCRSA-N	434.541	1.326	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CN2CCCC2=O)n[nH]1	1817161777	PJIUOTJAXSWVPB-YPMHNXCESA-N	426.315	1.808	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)C#Cc2ccccc2)[nH]n1)c1cccc(B(O)O)c1	1817473165	JJGRPHWALZYMNN-OAQYLSRUSA-N	442.284	1.447	50	20	IDGD	
Cc1nc2ncccn2c1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](O)CCl)CC2	1818389251	QVPNCGVLMHOYDF-ZYHUDNBSSA-N	434.909	1.320	50	20	IDGD	
COC[C@H](NC(C)=O)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](F)Br)[nH]n1	1819611828	NUNSKBNIIWTARU-SGMGOOAPSA-N	448.293	1.243	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](O)N3CCOCC3)sc2C1	1819877996	YMJAOOQVLDEGFA-NVGCLXPQSA-N	430.958	1.113	50	20	IDGD	
Cc1cc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)ccc1O	1821096385	GMQWSWHLVQEUEA-LJQANCHMSA-N	448.288	1.723	50	20	IDGD	
CC(=O)c1cc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)n[nH]1	1822412682	DJCMQYAWVKEKKO-MRXNPFEDSA-N	444.496	1.014	50	20	IDGD	
CC[C@H](C)[C@@H](O)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1	1824548422	OZDIIZLAJIXVLD-ZLGUVYLKSA-N	430.354	1.007	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CN1CCSCC1)CC2	1825632300	RDTABKNNUNNDMD-WDEREUQCSA-N	447.424	1.887	50	20	IDGD	
C[C@@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)CCBr)CC1)n1cnnn1	1826360063	CMSHWXDQPUKXLU-ZFWWWQNUSA-N	427.347	1.639	50	20	IDGD	
O=C(CCn1ccnn1)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](F)Br)CC2	1826878133	VDYHHHDACZMZKA-QPUJVOFHSA-N	431.291	1.427	50	20	IDGD	
CCSc1ncccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1829578054	CUTGLVKWPXKVHY-KSSFIOAISA-N	431.917	1.798	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CC3CCN(C)CC3)CCO2)C1	1829996053	GRAQNUKKEBZRKU-NQIIRXRSSA-N	429.989	1.582	50	20	IDGD	
O=C(COc1cccc(Cl)c1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1830278523	DCTCHLYRORNXRR-SJLPKXTDSA-N	435.279	1.710	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3[nH]nc4ccncc34)C2)C1	1830358775	ZKWAYLKIMSMMHN-FQEVSTJZSA-N	435.912	1.293	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cscn3)C2)C1	1830538114	VZIFGCOFVVEJKY-WBMJQRKESA-N	432.340	1.244	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)NCCC#N)C2)C1	1831646484	LWTXINSKQRCGCY-OXQOHEQNSA-N	428.961	1.132	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(Cl)ncn3)C2)C1	1831654423	KTRKVIGAKWQZKD-FZKQIMNGSA-N	431.320	1.608	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2C[C@@]2(F)Cl)CC1	1831957869	BGLKPFNAFJITLN-WFXMLNOXSA-N	436.720	1.524	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)Cn3nnc4ccccc43)CCO2)C1	1832198525	JRJUOYXZQWVECK-NRFANRHFSA-N	449.939	1.153	50	20	IDGD	
CC[C@@H](NC(C)=O)C(=O)NC1CCN(C2CCN(C(=O)[C@](C)(Cl)CCl)CC2)CC1	1833096777	CVBZVVMOHVBCBC-YLJYHZDGSA-N	449.423	1.709	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)C3=NN(C)C(=O)CC3)CC2)CC1	1833689307	BABRXUIBZJOBIS-MRXNPFEDSA-N	425.961	1.184	50	20	IDGD	
Cc1ncsc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)CBr)C2)C1	1834261975	OCWBOOFKSQEDTL-YVEFUNNKSA-N	446.367	1.553	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cncc(F)c3)CCO2)C1	1834361166	MCOWBZPLDZPMKV-SJCJKPOMSA-N	430.274	1.074	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3nn[nH]c3C(F)(F)F)CC2)CC1)[C@H](F)Cl	1835082156	UQRRNLOFWICQQM-ZDUSSCGKSA-N	440.829	1.543	50	20	IDGD	
Cc1ncncc1C(=O)N1CCC(N2CCC(NC(=O)CO[Si](C)(C)C)CC2)CC1	1835836233	UPWYAIGNXFDFDM-UHFFFAOYSA-N	433.629	1.822	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3cnc(O)[nH]3)CC2)CC1	1835966593	CGSLWXIFJCOIBS-AWEZNQCLSA-N	442.358	1.474	50	20	IDGD	
O=C(c1n[nH]c2ccc(F)cc12)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1837043505	VGQJNGCHIGGFPC-GOSISDBHSA-N	445.278	1.576	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cccnc3S)C2)C1	1837708616	MGUROIVNUAIAQP-LJQANCHMSA-N	439.610	1.292	50	20	IDGD	
COCc1c[nH]c(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@](C)(Cl)CCl)C3)C2)c1	1838519105	ZTGJJSOZMKNQEW-RTBURBONSA-N	448.347	1.467	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)COc3ccc(OC)cc3)C2)C1	1839141188	AEPFNVRHQHOVQU-RXVVDRJESA-N	440.924	1.548	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cnc4ccccn34)C2)C1	1839141685	QBDXTNVUJAXGGK-LAUBAEHRSA-N	434.924	1.351	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3noc(C(C)C)n3)C2)C1	1839142674	VRWSQRBSHDLRFN-AUUYWEPGSA-N	428.917	1.209	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3coc([Si](C)(C)C)c3)C2)C1	1839145620	NNECOKQGLBRAQJ-UZLBHIALSA-N	443.016	1.912	50	20	IDGD	
Cc1ncccc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2	1839151556	WDPQEARAXAUBIY-MOPGFXCFSA-N	430.332	1.696	50	20	IDGD	
C=C(C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2)C(F)(F)F	1839155253	PNFJCJOCFDYKQT-CABCVRRESA-N	433.254	1.798	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cc3ncccc3[nH]1)CCO2	1839492356	HSSIUCUSPPHCAN-OAQYLSRUSA-N	446.580	1.484	50	20	IDGD	
O=C(c1cccn2nccc12)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1839540579	LEQGCIMKTDUBBF-GOSISDBHSA-N	427.288	1.208	50	20	IDGD	
C[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1)[S@](=O)c1ccccc1	1839672450	KLNUIWJGCHKHFW-NUBDNITGSA-N	446.928	1.174	50	20	IDGD	
C[C@H](Cc1ccc(F)cc1)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1839764620	HSDCUKZONLXFBH-LIVBEALHSA-N	430.879	1.995	50	20	IDGD	
C#CC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](Br)Cc1ccccc1)CCO2	1839802256	PUGOZDKUONVEQE-XLIONFOSSA-N	435.318	1.082	50	20	IDGD	
Cc1cccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)c1F	1840030754	VSYTVGGIZLSYKZ-IFXJQAMLSA-N	443.313	1.988	50	20	IDGD	
Cc1ccc(C(=O)C(=O)N2CCO[C@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)cc1	1840099919	JENQAFPRRWTTPH-LJQANCHMSA-N	429.300	1.438	50	20	IDGD	
O=C(CCOc1ccc(F)cc1)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840187307	RVHAXRMGZRYWBE-IBGZPJMESA-N	449.306	1.855	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)[C@H]2CCCCN2C)C1	1841363977	DHRUBLXXFMHRGJ-GOSISDBHSA-N	444.488	1.821	50	20	IDGD	
CCC(=O)N[C@@H](C)C(=O)N1CCCC12CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)C2	1841535912	USIRQYJMJOCWNT-FSEGOYHTSA-N	430.455	1.990	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)[C@H](C)c1ccc(O)cc1)C2	1843416767	XZEJCLNLYGMSPG-DAWOQIAZSA-N	437.500	1.833	50	20	IDGD	
Cn1ncc(I)c1C(=O)N1CCCC12CN(C(=O)[C@@H](F)Cl)C2	1843602973	DCZYBXLJRVDXBQ-SNVBAGLBSA-N	440.644	1.376	50	20	IDGD	
C/C(=C\c1cccs1)C(=O)N1CC2(CCCN2C(=O)c2cnccc2C(=O)NN)C1	1844263378	YUFJHBMPLQKTPO-GXDHUFHOSA-N	425.514	1.667	50	20	IDGD	
O=C([C@@H](Br)Cc1ccccc1)N1CC2(CCCN2C(=O)c2cnc(O)[nH]2)C1	1844505127	WAWNJXTYHIKZBM-AWEZNQCLSA-N	433.306	1.939	50	20	IDGD	
CCN(C)[C@H](C)C(=O)N1CCCC12CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2	1845748563	XRBXQIJCZBIJHR-CQSZACIVSA-N	432.477	1.677	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)[C@H](c1ccc(Cl)cc1)N(C)C)C2	1846386016	URTOGEGULMYZTI-FQEVSTJZSA-N	449.983	1.519	50	20	IDGD	
COc1cccc(Cl)c1C(=O)N1CCCC12CN(C(=O)c1cccc(B(O)O)c1)C2	1846850622	ZKRHIDNVAXIVMQ-UHFFFAOYSA-N	428.681	1.159	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)Cc1ccccn1	1848099717	SONYVKMHWISAKE-ULQDDVLXSA-N	436.940	1.958	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)s1	1848332305	LZVQUZZZEYLXNI-LCBPUBMQSA-N	429.502	1.706	50	20	IDGD	
CCOc1ccc(NC(=S)NNC(=O)CCn2c(=O)[nH]c(=O)c3ccccc32)cc1	10742958	CPUVDAFSSPNUOG-UHFFFAOYSA-N	427.486	1.496	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCC(NC(=O)c3ccccc3)CC2)cc1OC	11102638	VMTQVMIJNDOLBX-UHFFFAOYSA-N	440.500	1.359	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)[C@@H]2CC(=O)Nc3cc(F)ccc32)cc1OC	12936182	NAGXHPQFHBTJPN-CQSZACIVSA-N	445.403	1.273	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)CSc1ccc(C(N)=O)cc1[N+](=O)[O-]	15879298	JIYOPRPXCSXURN-UHFFFAOYSA-N	434.430	1.021	50	20	IDGD	
CSCc1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1	21894506	NPLAMDOHJUPUKA-UHFFFAOYSA-N	449.554	1.645	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)CN2C(=O)COc3ccc(Cl)cc32)cc1	23516725	GVXSDHCHCBMZAB-UHFFFAOYSA-N	431.832	1.378	50	20	IDGD	
CS(=O)(=O)N1CCCc2cc(C(=O)OCC(=O)NNC(=O)c3cccs3)ccc21	26106913	FWJURTGMZKPRGU-UHFFFAOYSA-N	437.499	1.078	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)c2cccc(CN3C(=O)CNC3=O)c2)cc1	28318874	FZCNUPYNWDMTTK-AWEZNQCLSA-N	440.456	1.366	50	20	IDGD	
C[C@@H]1CCCC[C@@]12NC(=O)N(CC(=O)NNC(=O)c1cc(Br)c[nH]1)C2=O	28717697	GUTDNAXJHOUTKA-JDNHERCYSA-N	426.271	1.039	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc(OCC)c1OCC	28884270	HJVGMJIJTMNKBE-UHFFFAOYSA-N	440.460	1.933	50	20	IDGD	
COc1cc(C=NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)cc(OC)c1O	254517989	IBZYEQFZSZUPJP-UHFFFAOYSA-N	426.517	1.986	50	20	IDGD	
CC(=NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1)c1ccc(O)cc1	254614586	PASYBYVMUAGUEZ-UHFFFAOYSA-N	430.530	1.547	50	20	IDGD	
CC(C)(C)NC(=S)NNC(=O)[C@@H](CCS(C)(=O)=O)NC(=O)c1ccc(Cl)cc1	726141181	HNZFAHFPMMTSJI-CYBMUJFWSA-N	448.998	1.167	50	20	IDGD	
CCOC(=O)[C@H]1CCCN(C(=O)CN(C)C(=O)/C(C#N)=C\c2cc(C#N)n(C)c2C)C1	726174551	BTYOXPQZAPJWKB-RSFAQHHSSA-N	425.489	1.372	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCC(=O)N2CCc3ccccc32)cc(OC)c1OC	726190184	JYQMWEUXDWUOGS-UHFFFAOYSA-N	428.445	1.246	50	20	IDGD	
CN(C)N(C(=O)CCCCOc1ccc(S(C)(=O)=O)cc1)[C@@H]1CCS(=O)(=O)C1	728162182	UAWWUSUZHQPQCY-OAHLLOKOSA-N	432.564	1.132	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2ccc(Br)cc2O)ccc1Cl	728204179	WYVFDYCRSXUKQJ-UHFFFAOYSA-N	448.682	1.530	50	20	IDGD	
CC(C)c1noc(CCC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)n1	728214913	UUGOTZNPPWRHNG-UHFFFAOYSA-N	436.538	1.205	50	20	IDGD	
O=C(CNC(=O)c1c[nH]c2ccccc2c1=O)NNC(=O)c1cccc(OC(F)F)c1	728544963	PLSLHGYPYPXBJS-UHFFFAOYSA-N	430.367	1.321	50	20	IDGD	
Cc1cc(C)n(-c2ccc(NC(=O)NNC(=O)C3CCN(c4ncccn4)CC3)cn2)n1	728938275	HCTITRFNOZPYRV-UHFFFAOYSA-N	435.492	1.743	50	20	IDGD	
C[C@H]1C[C@@H](C)CN(C(=O)CN2CCN(C(=O)NNC(=O)c3cccc(C#N)c3)CC2)C1	728954649	LNEYIICFPDDPIU-CALCHBBNSA-N	426.521	1.035	50	20	IDGD	
Cc1nc2cc(O)nn2c(C)c1CC(=O)NNc1ccc(S(=O)(=O)C(F)F)cc1	729533386	HQHOSXSBGKAYQF-UHFFFAOYSA-N	425.417	1.734	50	20	IDGD	
CNS(=O)(=O)c1cccc([C@H](C)NC(=O)NNC(=O)Cn2ccc3ccccc32)c1	729610739	ZHJACYSSFQLPBJ-AWEZNQCLSA-N	429.502	1.641	50	20	IDGD	
CC/C=C(/C)C(=O)N1CSC[C@@H]1C(=O)OCC(=O)NNC(=O)c1cccc(Cl)c1	730318753	BTJQOVNZFIBZOY-HYMFSAHRSA-N	439.921	1.902	50	20	IDGD	
O=C(COC(=O)[C@@H](c1ccccc1)N1CCC(O)CC1)NNC(=O)c1ccc(Cl)cc1	731249801	WQBBGFQWOOKHKB-HXUWFJFHSA-N	445.903	1.842	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)N1CCN(c2nn3cc(-c4ccc(F)cc4)nc3s2)CC1	731847993	BRQDQTMTUREHAS-CYBMUJFWSA-N	445.524	1.665	50	20	IDGD	
O=C(CCN1CCN(C(=O)[C@@H]2CCCO2)CC1)NNC(=O)c1ccc(Cl)cc1Cl	732053167	YDRIVORISILMBM-INIZCTEOSA-N	443.331	1.468	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)NCc1ccc(N(C)S(C)(=O)=O)cc1	732475395	DPNPBOSKQZMSRQ-ZDUSSCGKSA-N	438.481	1.519	50	20	IDGD	
CCc1cc(N2CCC[C@@H](NC(=O)NNC(=O)[C@@H](C)Oc3ccc(F)cc3)C2)ncn1	732914493	QTHCFRPOICSWSH-RHSMWYFYSA-N	430.484	1.945	50	20	IDGD	
C[C@H](NC(=O)NN[C@]1(C)CCS(=O)(=O)C1)c1ccc(NC(=O)c2ccncc2)cc1	733848646	SBFLMQLYACFTJV-VBKZILBWSA-N	431.518	1.776	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)[C@H]1CC(=O)N(c2ccc(Cl)cc2)C1	734241629	SKHMJLHQHADOFI-LBPRGKRZSA-N	439.900	1.548	50	20	IDGD	
CC(C)[C@H](NS(=O)(=O)c1ccc(Br)cc1)C(=O)NNc1cnccn1	734244653	UNEZWVPWCPCXRH-AWEZNQCLSA-N	428.312	1.685	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2ccccn2)c(F)cc1Br	734414345	GZJVSRYSWZOTBK-UHFFFAOYSA-N	432.227	1.393	50	20	IDGD	
CN(C)[C@@H](CNC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)c1c(F)cccc1F	734675691	LAQUAAWTZXAVDR-INIZCTEOSA-N	444.442	1.459	50	20	IDGD	
Cc1nn(C)c(C)c1C[C@H](C)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	741878325	FKHHNFBWSGURQB-AWEZNQCLSA-N	447.561	1.461	50	20	IDGD	
CC(C)c1ncc(S(=O)(=O)NNC(=O)c2ccc(CSc3nncn3C)cc2)[nH]1	742231592	OASJMSHPYVIWFZ-UHFFFAOYSA-N	435.535	1.577	50	20	IDGD	
O=C(NNS(=O)(=O)c1cccc(C(=O)NC2CC2)c1)c1cccc(Br)c1	743264410	SMBPEJAUIOPZDR-UHFFFAOYSA-N	438.303	1.965	50	20	IDGD	
C[C@H]1CCCCN1C(=O)[C@@H](C)NC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	743581743	FAYUUXQKLLCJEK-QWHCGFSZSA-N	425.511	1.215	50	20	IDGD	
COc1cccc(-c2noc([C@@H](C)NC(=O)NNC(=O)COc3ccccc3O)n2)c1	743706031	XIKICCRBTVNSDQ-GFCCVEGCSA-N	427.417	1.921	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1cn(Cc2cccs2)nn1	744622317	RNDIOTHRVPBRDA-UHFFFAOYSA-N	448.530	1.166	50	20	IDGD	
CC[C@H](C)[C@H](NC(=O)N1CCCC1)C(=O)OCC(=O)NNC(=O)c1cccc(C#N)c1	745060715	WNVFYDGAGRITIQ-KSSFIOAISA-N	429.477	1.083	50	20	IDGD	
C[C@]12CCC(=O)N1c1ccccc1C(=O)N2CC(=O)NNC(=O)COc1ccc(F)cc1	746577481	MSXCVTHREVBGFB-JOCHJYFZSA-N	440.431	1.351	50	20	IDGD	
COc1cc(C)nc(NNC(=O)c2cc(S(=O)(=O)N(C)C)ccc2N2CCCCC2)n1	746627229	JCNCGXGALRNOII-UHFFFAOYSA-N	448.549	1.791	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)Cc1cn2ccccc2n1)c1cccc(S(=O)(=O)N(C)C)c1	746760620	FFGCFYFLTBLSLR-AWEZNQCLSA-N	444.517	1.219	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)c1nc(C)n(-c2n[nH]c(C(F)(F)F)n2)n1	747354921	WYYOINPLPWXCEH-UHFFFAOYSA-N	444.761	1.449	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)c1cccc(F)c1I	750537526	YAZOQPFSVYVXRB-UHFFFAOYSA-N	442.188	1.016	50	20	IDGD	
COc1cc(C=NNC(=O)CSc2nnc(O)nc2O)ccc1OCC(F)(F)F	750931844	BWAJLSAEYICIQF-UHFFFAOYSA-N	433.368	1.475	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(CCCCl)cc1)c1csc(N2CCOCC2)n1	751263790	PHGHBFBCSPEJFG-UHFFFAOYSA-N	444.966	1.774	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3nnc(O)c4ccccc34)n[nH]2)cc1OC	751296880	DQDDXDLDQYBWAE-UHFFFAOYSA-N	434.412	1.818	50	20	IDGD	
COc1ccc(C(=O)CCC(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)cc1F	751718001	URAQWVFIXGCDCY-UHFFFAOYSA-N	427.388	1.673	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)NCc2cnc(N(C)C)n2C)cc1Cl	751807024	LYJMXDMHQZJZRD-UHFFFAOYSA-N	425.877	1.693	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)N1CC[C@H](OCCCc2ccccc2)C1	752008899	AVNXIGZODQRGGM-KRWDZBQOSA-N	430.530	1.942	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CNC(=O)c2ccccc2C(F)(F)F)cc1OC	755038933	NZXCXWHEYOOKKI-UHFFFAOYSA-N	425.363	1.914	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)Nc1ccc(N2C[C@H]3CC[C@H]2C3)cc1	756163326	HAJYRTWODFZGSE-GZRFBZBPSA-N	436.468	1.601	50	20	IDGD	
CN1CCN(CC(=O)N(C)c2ccc(NC(=O)NNC(=O)c3ccc(C#N)cc3)cc2)CC1	756358640	LKSMDBOVKIOPKK-UHFFFAOYSA-N	449.515	1.235	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)[C@@H]2CCC(=O)N2Cc2ccc(Br)cc2)n1	756408890	YDDPVUZZJYVMHJ-INIZCTEOSA-N	448.321	1.601	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)cc1NS(C)(=O)=O	756781613	HNFBHOFUMDJIHV-LLVKDONJSA-N	440.453	1.826	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)N[C@H]2CN(C(=O)OC(C)(C)C)C[C@H]2C#N)cc1	758761956	RZBWLCFLXGRWQI-CJNGLKHVSA-N	433.465	1.163	50	20	IDGD	
C[C@H]1CCCCN1S(=O)(=O)c1ccc(C(=O)NNC(=O)C(=O)Nc2ccccn2)cc1	758835261	VLHCEILGWYNMNN-AWEZNQCLSA-N	445.501	1.044	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)[C@H]2CCCN2C(=O)/C=C/c2ccc(C(N)=O)cc2)nc1	759729468	VJVWNQKVYCWEDN-SCBHQAGPSA-N	437.456	1.115	50	20	IDGD	
C[C@@H](NC(=O)CCC(=O)NNc1ncc(F)cn1)C(=O)c1ccc(Br)cc1	760911314	FKGRRQVEROZDDL-SNVBAGLBSA-N	438.257	1.989	50	20	IDGD	
CCCCOc1ccc(C(=O)NCC(=O)NNc2nccc(N3CCOCC3)n2)cc1	762848039	LQRATXSTPRPTFY-UHFFFAOYSA-N	428.493	1.365	50	20	IDGD	
CC(C)(C)OC(=O)NCCOc1cccc(NC(=O)C(=O)NNC(=O)c2ccccc2)c1	763425404	JIXQSNVPQAUXDL-UHFFFAOYSA-N	442.472	1.990	50	20	IDGD	
Cc1nnnn1-c1cc(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3n2)ccc1F	763449718	FYRIKIVRHQXGMH-UHFFFAOYSA-N	434.391	1.058	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3n2)cc1N1CCOC1=O	763467676	VPZUDUWOJFVWHM-UHFFFAOYSA-N	449.423	1.600	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c(OC[C@@H]2CCCO2)c1	763468990	ZKIXQWUUWZOBNT-INIZCTEOSA-N	442.428	1.861	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)c1ccc2c(c1)CC(=O)N2C	763497254	DFTPDLWXBQGVDD-ZDUSSCGKSA-N	433.509	1.902	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cc(C)nn2C(C)(C)C)cc(OC)c1OC	763540143	SEWQOKJHHTWLSS-UHFFFAOYSA-N	433.465	1.372	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2Cc2ccccc2)c(O)n1	763718020	GBHPJSBNZVKNHD-UHFFFAOYSA-N	434.452	1.851	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2ccc(N3CCO[C@H](C)C3)cc2)c1	763771451	ASBGTRYTGOFGRT-CQSZACIVSA-N	442.472	1.329	50	20	IDGD	
O=C(NNC(=O)c1cc2c(s1)CCC2)C(=O)Nc1cnn(-c2cnc3ccccc3n2)c1	763780592	BMJLHSINBMEZCV-UHFFFAOYSA-N	447.480	1.765	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)C(=O)CCC3)c2ccccc2c1=O	763787338	XPPCFFLMAZAKFA-UHFFFAOYSA-N	447.451	1.335	50	20	IDGD	
CCc1c(NC(=O)C(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])cnn1CC(C)C	763804448	STGCPISWOJTJMJ-UHFFFAOYSA-N	432.437	1.175	50	20	IDGD	
O=C(CCC(=O)c1cc(Cl)sc1Cl)NNC(=O)CNC(=O)c1cccnc1	763820735	QCGPIFHFDAOMMH-UHFFFAOYSA-N	429.285	1.990	50	20	IDGD	
C#CCOc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(OCC)cc2)cc1	763861302	NPKNNMVUUXXUSP-HNNXBMFYSA-N	425.441	1.651	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cccc(N(C)C(C)=O)c2)cc1	763872039	JKQPJNNCZBFNOI-AWEZNQCLSA-N	440.456	1.425	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2c[nH]nc2-c2ccccn2)cc1OC	763910273	AWVSCLUDDKTHNX-UHFFFAOYSA-N	438.444	1.669	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)Cc3ccc(F)cc3)cn2)C[C@@H](C)O1	763919629	WIOWLOZWEYLVGV-OKILXGFUSA-N	429.452	1.163	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccc(CCN2CCSCC2)cc1	763920904	MFYJVENVPAYGAM-UHFFFAOYSA-N	444.532	1.746	50	20	IDGD	
O=C(Cc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1ccc(C(=O)N2CCCC2)cc1	763930455	ASISNYNAXLXKMC-UHFFFAOYSA-N	428.876	1.905	50	20	IDGD	
CC(C)Sc1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1	764002557	NTPVJSMZERPPTE-SNVBAGLBSA-N	433.939	1.361	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(-c3n[nH]c(-c4ccccc4)n3)cc2)n[nH]1	764100291	ZMXWLTSXJFWYCL-UHFFFAOYSA-N	430.428	1.570	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccnn2Cc2ccc(C(F)(F)F)cc2)n[nH]1	764106377	LQWVODOKPXPWKB-UHFFFAOYSA-N	435.366	1.381	50	20	IDGD	
O=C(CC1CC1)NNC(=O)C(=O)Nc1ccc(NC(=O)[C@@H]2CCCO2)cc1C(F)(F)F	764141941	IFJQKSVOGDMLSK-AWEZNQCLSA-N	442.394	1.709	50	20	IDGD	
Cc1noc(COc2ccc(NC(=O)C(=O)NNC(=O)[C@@H]3Cc4ccccc4O3)cc2)n1	764168456	PERWBVFAPKSWHZ-KRWDZBQOSA-N	437.412	1.047	50	20	IDGD	
CCCCNS(=O)(=O)c1cccc(NC(=O)C(=O)NNC(=O)CCc2ccco2)c1	764168912	IXTGCRDYMJBLDB-UHFFFAOYSA-N	436.490	1.077	50	20	IDGD	
CCc1cc(O)nc(-c2cccc(NC(=O)C(=O)NNC(=O)CCc3ccccc3O)c2)n1	764281201	MJEGHQYHJFQRRU-UHFFFAOYSA-N	449.467	1.836	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)C(=O)Nc1cnn(-c2ccccc2Br)c1	764296040	SPCYCTSRSXMSPP-UHFFFAOYSA-N	432.238	1.066	50	20	IDGD	
C[C@H]1CCCCN1C(=O)c1ccc(NC(=O)C(=O)NNC(=O)Cc2cc[nH]n2)cc1Cl	764296609	BRSZTWIZFDRKTH-LBPRGKRZSA-N	446.895	1.406	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)C(=O)Nc1ccnn1Cc1c(Cl)cccc1Cl	764297546	BCYJGWLZFCFBJK-UHFFFAOYSA-N	436.259	1.669	50	20	IDGD	
CCS(=O)(=O)c1cc(F)ccc1NC(=O)C(=O)NNC(=O)Cc1ccccc1F	764319833	BLXFHIWBZYMDJJ-UHFFFAOYSA-N	425.413	1.087	50	20	IDGD	
Cc1nn(C)c2nc(-c3ccccc3)cc(C(=O)NNC(=O)CNC(=O)c3cccnc3)c12	764344478	DKTSBTQMHTYNKT-UHFFFAOYSA-N	443.467	1.530	50	20	IDGD	
CC(=O)N(C)c1ccccc1NC(=O)C(=O)NNC(=O)c1cc(-c2cccs2)[nH]n1	764382738	RBAYDCBKNKJJHZ-UHFFFAOYSA-N	426.458	1.521	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)C(=O)Nc2cc(C3CC3)nn2-c2ccccc2)c1	764432145	CQLJHNWRAIELFE-UHFFFAOYSA-N	447.455	1.503	50	20	IDGD	
CC(=NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C)c1cc(F)c(Cl)cc1Cl	764813227	VPJLGFNYZNNTPE-UHFFFAOYSA-N	441.250	1.420	50	20	IDGD	
CS(=O)(=O)c1ccc(OCCC(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)cc1	765608158	VZUQQRZDPGTOHP-UHFFFAOYSA-N	446.460	1.849	50	20	IDGD	
CN1CCN(Cc2ccc(CNC(=O)NNc3ccccc3S(C)(=O)=O)cc2)CC1	765671908	WBNNQZDFSLSEMX-UHFFFAOYSA-N	431.562	1.664	50	20	IDGD	
COc1ccc(CC(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)cc1F	765760059	YXQGUIWZQFIRRS-UHFFFAOYSA-N	448.926	1.995	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3ccc(N)c([N+](=O)[O-])c3)CC2)cc1	766650331	SVMFSCRMPWMUCH-UHFFFAOYSA-N	426.477	1.064	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NC2CCN([C@@H]3CCC[C@H]3O)CC2)cc(OC)c1OC	767927287	JYVXJEWQUYISCF-HZPDHXFCSA-N	436.509	1.034	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3cnc4cc(C)ccn4c3=O)n[nH]2)cc1OC	768275766	FSZUOBHELFBERI-UHFFFAOYSA-N	448.439	1.485	50	20	IDGD	
CC[C@H]1CCCC[C@@H]1OCC(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	768276096	OMHSBSKINHKWOX-ICSRJNTNSA-N	430.549	1.577	50	20	IDGD	
CCc1ccc(C(=O)NNc2nc3ccccc3[nH]2)cc1S(=O)(=O)N1CCOCC1	768503880	LWLAOMGMCWNTJX-UHFFFAOYSA-N	429.502	1.903	50	20	IDGD	
CN(C)C(=O)COc1ccc(C(F)(F)C(=O)NNc2nc(-c3ccncc3)no2)cc1	769565668	ODAQYFXGSGQKTD-UHFFFAOYSA-N	432.387	1.834	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)[C@@H]1CCN(C(=O)OCc2ccccc2)C1	770133931	JOHKYIAZHUQBDO-QGZVFWFLSA-N	426.473	1.913	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)c2cccn3c(O)nnc23)c2ccccc2c1=O	770548283	BUVIQXOJFJBYBY-UHFFFAOYSA-N	435.444	1.410	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCc2sccc21)c1cccc(S(=O)(=O)N2CCOCC2)c1	771216699	MMBCCLIWSUEYGT-QGZVFWFLSA-N	449.554	1.650	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)Cc2cc(Br)ccc2F)n1	771387127	ZKMSMRXAPRRMIN-UHFFFAOYSA-N	444.282	1.829	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)N[C@@H]2CCO[C@@]3(CCOC3)C2)c1	771444593	YDGHWZOHLGBJKX-DIFFPNOSSA-N	428.283	1.740	50	20	IDGD	
C[C@]1(c2ccc(F)c(Cl)c2)NC(=O)N(CC(=O)NNc2cc(Cl)nc(N)n2)C1=O	771738016	GXENGOGKJJKQJM-MRXNPFEDSA-N	442.238	1.415	50	20	IDGD	
N#CCC(=O)NNC(=O)c1ccc(NS(=O)(=O)c2ccc(Br)cc2)cc1	771860170	SJLPDHAKAWWSCN-UHFFFAOYSA-N	437.275	1.925	50	20	IDGD	
CC(C)(C)OC(=O)NC1(CC(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)CCC1	772194759	DGHASGFXXJWQTJ-UHFFFAOYSA-N	438.912	1.941	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)NCCNS(=O)(=O)c2ccc(C)s2)c1	772629431	AFBIZQOEYONVCX-UHFFFAOYSA-N	440.547	1.361	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(Cl)c(C(=O)NNc2nccnc2C(C)C)c1	772817534	XEXNTXPZSIKAJS-UHFFFAOYSA-N	427.914	1.935	50	20	IDGD	
COc1ccc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)nc1	775090535	SNVVHVXJSMGQMV-UHFFFAOYSA-N	433.490	1.019	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1)c1ccc(OC)cc1	775643179	NQDPZBPESRRWPL-AWEZNQCLSA-N	425.894	1.951	50	20	IDGD	
CN(C(=O)OC(C)(C)C)[C@H](C(=O)NNC(=O)[C@@H]1COc2ccccc2O1)c1cnn(C)c1	776318253	RXBZFTOAHZGHID-IRXDYDNUSA-N	445.476	1.316	50	20	IDGD	
CC[C@H](CS(=O)(=O)c1ccccc1)NC(=O)NNc1cccc(S(C)(=O)=O)c1	776625467	KHSBJEWCJXWREK-CQSZACIVSA-N	425.532	1.969	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cc(C)n([C@H](C)C3CC3)n2)cc1OC	777189601	AXYZLSQMGIDNKI-CYBMUJFWSA-N	430.461	1.798	50	20	IDGD	
NS(=O)(=O)c1ccc(NCCC(=O)NNc2ccc3ccccc3n2)c([N+](=O)[O-])c1	777465041	YPCMYEFYJYGZCY-UHFFFAOYSA-N	430.446	1.736	50	20	IDGD	
Cc1cc(Br)c([N+](=O)[O-])cc1S(=O)(=O)NNC(=O)NCc1ccco1	777616587	KPZSWWALTGBXMD-UHFFFAOYSA-N	433.240	1.951	50	20	IDGD	
Cc1ccc(S(=O)(=O)NC(C)(C)C)cc1C(=O)NNC(=O)CNC(=O)OC(C)(C)C	778437650	HRZWWGFZSSSBAZ-UHFFFAOYSA-N	442.538	1.358	50	20	IDGD	
Cc1cnn(-c2c(C(=O)OCC(=O)NNC(=O)c3ccc(Cl)cc3)c(C)nn2C)c1	778551620	HSAKPURRVYBSOT-UHFFFAOYSA-N	430.852	1.494	50	20	IDGD	
CC(C)(C)OC(=O)NCc1cc(C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)co1	781382129	KOJDNUWNRASUPA-UHFFFAOYSA-N	442.428	1.794	50	20	IDGD	
CC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)cc1C	782897329	MXYSSORXYZXNAA-UHFFFAOYSA-N	445.501	1.199	50	20	IDGD	
O=C(NNc1ncnc2ccsc12)C(=O)Nc1ccc(N2CCCS2(=O)=O)cc1	783252726	BRDSFAYHMYJEFM-UHFFFAOYSA-N	432.487	1.313	50	20	IDGD	
CN1CCC/C1=N/S(=O)(=O)c1cccc(NC(=O)C(=O)NN(C)c2ccccc2)c1	783432473	YNLOSFDZLCJGJE-NKFKGCMQSA-N	429.502	1.606	50	20	IDGD	
CSc1cnn(-c2ccccc2)c1NC(=O)C(=O)NNc1ccc(-n2cccn2)nn1	783437067	RTYVTVLPMSUPLY-UHFFFAOYSA-N	435.473	1.652	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)N1CC2(CCC2)c2c(F)cccc21	784003205	BUYKXBQZKQEKEF-UHFFFAOYSA-N	430.461	1.233	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N2CCCCC2)cc1NC(=O)C(=O)NNc1ccccn1	784795390	XMBCSYVNFBYSKR-UHFFFAOYSA-N	447.517	1.737	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1ccn(CC(F)F)n1	784833796	PSAMFCSBJMVHCQ-UHFFFAOYSA-N	444.464	1.307	50	20	IDGD	
Cc1cc(Br)ncc1NC(=O)C(=O)NNC(=O)Cc1cn2ccccc2n1	785059934	DUFCVYCASNHTGQ-UHFFFAOYSA-N	431.250	1.129	50	20	IDGD	
COc1cc(F)cc(NNC(=O)C(=O)Nc2cccc(CN3CCC(C(N)=O)CC3)c2)c1	785242385	ZHOIINDLHIBSNJ-UHFFFAOYSA-N	443.479	1.613	50	20	IDGD	
COC(=O)[C@](C)(CNC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)c1ccccc1	787310234	XEZVFBCFIJBQMH-HXUWFJFHSA-N	433.486	1.165	50	20	IDGD	
COc1ccccc1C(=O)N[C@H](CCSC)C(=O)NNc1ccc(-n2ccnc2)nn1	788178674	SGFJGNYEHKTTSQ-OAHLLOKOSA-N	441.517	1.666	50	20	IDGD	
COc1cccc([C@@H]2[C@@H](C(=O)NNc3ccccc3S(N)(=O)=O)CC(=O)N2C2CC2)c1	788223948	QHHIQSLZXCEYLY-OXJNMPFZSA-N	444.513	1.538	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)N(C)CC(F)(F)F	788265991	RFZJATRWNFLVJU-LBPRGKRZSA-N	436.456	1.115	50	20	IDGD	
CCOCCCn1c(NNC(=O)[C@H]2CC(c3cccnc3)=NO2)nc2ccccc2c1=O	790635801	WVHATFVWZNDBJW-LJQANCHMSA-N	436.472	1.854	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1cc([C@@H]2CCCOC2)nn1C	790952319	QWLMGCZPKFGGGL-LLVKDONJSA-N	435.868	1.376	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N1CC[C@@H](N2CCCC2=O)C1	791010463	VISURTLIPRAYOU-TZMCWYRMSA-N	439.310	1.654	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NC[C@@H]2CCN(Cc3ccccc3)C2)c2ccccc2c1=O	792227485	MTXKEJRXXKJXQA-KRWDZBQOSA-N	434.500	1.400	50	20	IDGD	
CSCCONC(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	793418070	HUWXQQDSSNNNTI-UHFFFAOYSA-N	427.490	1.627	50	20	IDGD	
NC(=O)Cc1occc1C(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	794767340	LYLRTMAZUMYYOG-UHFFFAOYSA-N	445.435	1.140	50	20	IDGD	
COc1c([N+](=O)[O-])cccc1S(=O)(=O)NNC(=O)c1cccc(Br)c1	794865582	JXHHERCMYUISGZ-UHFFFAOYSA-N	430.236	1.989	50	20	IDGD	
COC(=O)c1cc(F)c(Br)cc1NC(=O)C(=O)NNC(=O)c1ccccc1	796990610	ZUXZNLOJGWAZIP-UHFFFAOYSA-N	438.209	1.775	50	20	IDGD	
Cc1ccc(-c2cccnc2)cc1NC(=O)C(=O)NNC(=O)[C@@H]1COc2ccccc2O1	796992958	YCOVRDJWPMXEHA-FQEVSTJZSA-N	432.436	1.983	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)Nc2ccc3c(c2)OCC(=O)N3C)cc1	799244587	ICKQPFVQFPBWNT-ZDUSSCGKSA-N	426.429	1.865	50	20	IDGD	
O=C(COC(=O)CSc1nc2ccccc2o1)NNC(=O)c1cccc([N+](=O)[O-])c1	800789006	FEWMBVWCRHMIJI-UHFFFAOYSA-N	430.398	1.833	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)N[C@@H]1CCN(C(=O)Nc2ccccc2)C1	801078101	VKBVZANEBPQXLD-MRXNPFEDSA-N	449.471	1.828	50	20	IDGD	
O=C(N=c1cc[nH]cc1)NNC(=O)c1ccc(S(=O)(=O)Nc2ccc(F)cc2)cc1	802032165	ONRWZYLAFPFCPH-UHFFFAOYSA-N	429.433	1.910	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)CNC(=O)c2ccc(C#N)cc2)c(OC)cc1Cl	802082750	NMADPPAHDNDFBJ-UHFFFAOYSA-N	431.836	1.812	50	20	IDGD	
C[C@H](Cc1cncc2ccccc12)C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	805682296	RNEQJRASDILNCS-QVKFZJNVSA-N	449.463	1.944	50	20	IDGD	
COC(=O)c1ccsc1N1CC[C@@H](NC(=O)NNc2ccc3c(=O)[nH]ccc3c2)C1=O	806900251	UHHMEVZPOJDVMR-OAHLLOKOSA-N	441.469	1.808	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)C(=O)N=c1ccnc2n(C)[nH]cc1-2	806975001	KAFXHOSEXZEJMN-UHFFFAOYSA-N	435.469	1.173	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)C(=O)Nc1cc(F)ccc1OC[C@H]1CCCO1	807429275	QZYUQBURSKDSMR-CQSZACIVSA-N	441.423	1.441	50	20	IDGD	
CC(C)[C@H](NC(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12)c1nncn1C	807431591	HGNDZNSENXSNQA-HNNXBMFYSA-N	426.481	1.447	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)N[C@H]2CCCN(C(=O)N3CCCC3)C2)cc1OC	807459036	PBVBWZBTAZQWCD-INIZCTEOSA-N	433.509	1.718	50	20	IDGD	
CNC(=O)c1cc(O[C@H]2CCCN(C(=O)/C(C#N)=C/c3cc(C#N)n(C)c3C)C2)ccn1	808234740	OLARKBMHSIBXDZ-ZUNINTSYSA-N	432.484	1.937	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1c[nH]nc1-c1ccccn1	811366283	XDLDYSGGHAYFCU-UHFFFAOYSA-N	429.820	1.752	50	20	IDGD	
O=C(CNS(=O)(=O)c1c(F)cccc1F)NNc1nnc(-c2ccccn2)s1	811390306	SENATLQUQLZZNX-UHFFFAOYSA-N	426.430	1.300	50	20	IDGD	
CC(C)N(C)C[C@H](C)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	812511529	GNTJNJFXPCFYII-INIZCTEOSA-N	439.582	1.534	50	20	IDGD	
CN(C)S(=O)(=O)CCNC(=O)NNC(=O)c1cc2c(s1)CC[C@H](C(C)(C)C)C2	812692887	CTRRWJBEBGSZJD-ZDUSSCGKSA-N	430.596	1.735	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2cc(C3CC3)nc3onc(C)c23)n1	812879641	TTWRVYANKXFPGP-UHFFFAOYSA-N	429.458	1.720	50	20	IDGD	
COC(=O)c1cn(-c2cccc(NC(=O)NNC(=O)[C@@H]3COc4ccccc4O3)c2)nn1	812981125	MTGSPEUFRRVSTE-KRWDZBQOSA-N	438.400	1.047	50	20	IDGD	
CC(=O)N(C)c1cccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)c1	813033123	FYTFLYOPLUQIAR-UHFFFAOYSA-N	433.490	1.001	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)[C@@H]1CCCN1C(=O)Nc1ccccc1	813508931	NJOONVQBMJFRDB-KRWDZBQOSA-N	443.891	1.800	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NN=Cc3ncc(Cl)s3)CC2)cc1	814877124	JLHIXNZTPDJHCB-UHFFFAOYSA-N	441.966	1.562	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)Cc2ccc(Cl)cc2)nnn1Cc1ccccc1F	815567395	WVDDSMBNRCJCRQ-UHFFFAOYSA-N	444.854	1.756	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCc2nncn2C1)C(=O)Nc1ccc(N2CCCCC2)c(Cl)c1	815692345	OXIYLGWPKWWGRR-CYBMUJFWSA-N	445.911	1.270	50	20	IDGD	
CC(C)c1c(Cl)ncnc1NNC(=O)[C@H](C)NS(=O)(=O)c1ccc(C(N)=O)cc1	816486043	LRGBQYWTKQEZNH-JTQLQIEISA-N	440.913	1.162	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NNC(=O)c2cccnc2N2CCOCC2)C1	816510060	LKJBXWKZFYABMV-OAHLLOKOSA-N	433.509	1.326	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)CC3CC3)CC2)cc1OC	819136445	XBCRWDYTQZSLPG-UHFFFAOYSA-N	425.507	1.052	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)C[C@@H](NC(C)=O)c1ccc(Br)cc1	819727815	LDYKXNIEBCUKSF-OAHLLOKOSA-N	444.326	1.953	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)[C@@H]2CS[C@H](Cc3ccccc3F)C(=O)N2)cc1	888625561	TXBBKBZBESKOKZ-ZWKOTPCHSA-N	442.472	1.066	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)CNS(=O)(=O)c1cccc(Br)c1	913263869	PDCLJXKKQNFZBM-UHFFFAOYSA-N	426.292	1.497	50	20	IDGD	
O=C(CNC(=O)c1ccncc1)NNC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1	914831644	QEWKWUHWFVFTHF-UHFFFAOYSA-N	441.451	1.520	50	20	IDGD	
NS(=O)(=O)c1cccc(NC(=O)NNC(=O)COc2cccc(C(F)(F)F)c2)c1	915257019	YOEZPFMWRMGUME-UHFFFAOYSA-N	432.380	1.585	50	20	IDGD	
CCOCC(=O)NNC(=O)Cc1csc(=NCc2ccco2)n1-c1cccc(OC)c1	915775918	YRRWWDDRMQCKJC-UHFFFAOYSA-N	444.513	1.968	50	20	IDGD	
COc1ccc([C@@H](CNC(=O)NNC(=O)COc2ccc(F)cc2)N2CCOCC2)cc1	915896758	JUQMOEBYDWSYOI-HXUWFJFHSA-N	446.479	1.617	50	20	IDGD	
Cc1ccc([C@@H](CN2CCOCC2)NC(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1	916217302	KDRTXCSJZVHMBS-LJQANCHMSA-N	440.500	1.784	50	20	IDGD	
Cn1ccnc1[C@](O)(CCNC(=O)NNC(=O)c1ccc2ccccc2n1)C(F)(F)F	916381795	UEJGRVGKNQHLTO-GOSISDBHSA-N	436.394	1.753	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)CC1	916519092	XPSKUMCOQSVOLS-UHFFFAOYSA-N	440.522	1.434	50	20	IDGD	
Cc1c(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)nnn1-c1ccccc1	917532458	WMXKMJBHESKQFN-UHFFFAOYSA-N	433.516	1.549	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(OC2CCCC2)cc1)c1ccc(-n2cnnn2)cc1	917727574	LIEQCLKDLAXMTD-UHFFFAOYSA-N	428.474	1.607	50	20	IDGD	
CCN(CC)c1nc2sc(C(=O)NNC(=O)N[C@H]3CCS(=O)(=O)C3)cc2s1	919885469	LNDNBGRXLUIMQR-VIFPVBQESA-N	431.565	1.335	50	20	IDGD	
CCc1ccccc1OCC(=O)NNS(=O)(=O)c1cc2c(c(C(=O)O)c1)OCCO2	919954472	MROFXOMTKIAXJU-UHFFFAOYSA-N	436.442	1.107	50	20	IDGD	
CC(C)c1c(C(=O)NNC(=O)CN2CCCC2=O)cnn1-c1ccc(C(F)(F)F)cn1	920436118	VRQUKVAIKDRMPD-UHFFFAOYSA-N	438.410	1.793	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)Nc1cccc(CN2CCC[C@H]2C(N)=O)c1	920931456	SYBGUQWXPMOFEI-IBGZPJMESA-N	439.516	1.930	50	20	IDGD	
COc1c(Cl)cc(Cl)cc1C=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O	921259072	VNTBCOWGVBEODV-UHFFFAOYSA-N	432.289	1.037	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)CNC(=O)OC(C)(C)C)c1	921298902	QPOYTSVSZCGMGR-UHFFFAOYSA-N	428.511	1.003	50	20	IDGD	
O=C(Cn1cc(C(F)(F)F)ccc1=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	1115975956	ZBWWJGMREFVDQZ-UHFFFAOYSA-N	430.408	1.451	50	20	IDGD	
CNS(=O)(=O)c1csc(C(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)c1	1116205738	VLAVCOMPLOYKCK-UHFFFAOYSA-N	446.551	1.064	50	20	IDGD	
CCCCCCn1cc(S(=O)(=O)NNC(=O)c2ccccc2Cl)c(O)nc1=O	1116444902	DIJCMYRBDOSYTJ-UHFFFAOYSA-N	428.898	1.806	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)Nc2ccc(OC(F)F)cc2)cc2c1CCC2	1116949559	LUHGFKBXVZVYDC-UHFFFAOYSA-N	440.428	1.891	50	20	IDGD	
O=C(NCCC(=O)N1CCN(c2ccccn2)CC1)NNC(=O)c1ccccc1Cl	1251401850	INEKULMYIOJUAP-UHFFFAOYSA-N	430.896	1.418	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1	1318550600	XGKVELOINXBHRZ-UHFFFAOYSA-N	439.515	1.103	50	20	IDGD	
Cc1ccc(S(=O)(=O)C[C@@H](C)NC(=O)NNC(=O)c2cncn2-c2ccccc2)cc1	1320422310	POEWLNAQOJPHLZ-MRXNPFEDSA-N	441.513	1.987	50	20	IDGD	
COC(=O)N1CCC[C@@H](NC(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)C1	1321909256	RWXXZURBQAYZGT-CQSZACIVSA-N	427.502	1.195	50	20	IDGD	
O=C(NNC(=O)C1(S(=O)(=O)c2ccccc2)CCOCC1)c1n[nH]c2c1CCCC2	1324069368	CDVKMPPDMIDEPT-UHFFFAOYSA-N	432.502	1.073	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3nc4ccccc4n(C)c3=O)C2)C1	1777889664	BTEWWSREQGDWHK-QKKBWIMNSA-N	432.908	1.394	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccccc1-n1nccn1)C2)[C@@H](F)Cl	1778027956	FNYJKZAITPGLKP-MBOZVWFJSA-N	435.887	1.929	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc4cn[nH]c4cn3)C2)C1	1778780335	BRPCNSNBZOQHPO-ROUUACIJSA-N	426.304	1.638	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(Cl)cc3)CCO2)C1	1779032670	QLPMHHNRXFGSOY-NRFANRHFSA-N	443.891	1.096	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3nnc(-c4ccccc4)o3)C2)C1	1779113677	AQBLJDUITKBLAA-BFUOFWGJSA-N	449.305	1.964	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)COc3cc(Cl)ccn3)C2)C1	1779231892	BVXPSDMYARLTEV-YVEFUNNKSA-N	446.729	1.727	50	20	IDGD	
CN(C)c1cccc(OCC(=O)N2CCO[C@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)c1	1779293735	BAGFWHSLUUPXND-QFIPXVFZSA-N	449.624	1.813	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@]2(C1)CN(C(=O)c1ccc3cccnc3n1)CCO2	1779297134	SNFCPCVMVVTBPI-NRFANRHFSA-N	428.565	1.925	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](COC(C)=O)OC(C)=O)C1	1779404931	NYTYLVJZZFWAIN-TVKQPGBESA-N	446.928	1.013	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)c(OC)c1	1780535946	WYKWMMSAAAOKHI-MAUKXSAKSA-N	445.285	1.838	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)c3nccc4nc[nH]c34)CCO2)C1	1781227389	KUYRQFDWTLBVSZ-ROUUACIJSA-N	426.304	1.638	50	20	IDGD	
O=C([C@@H](F)Br)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)c1ccccc1Cl)CCO2	1781334801	QAUARZUIBIVORV-CKEIUWERSA-N	449.704	1.894	50	20	IDGD	
C[C@H](Oc1ccccn1)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781335055	ROVHFLJFTKGFEL-DXCKQFNASA-N	430.274	1.369	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)c(OC)c1	1781335224	VQKHFLHGDWEPGG-CRAIPNDOSA-N	445.285	1.838	50	20	IDGD	
CCOc1ccc(Cl)cc1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1781743579	SYGJHJQKVQVFDB-DNVCBOLYSA-N	431.316	1.782	50	20	IDGD	
CC(C)Oc1ccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)c(F)c1	1782065811	UASJTHRCJMZZNN-FXAWDEMLSA-N	428.888	1.656	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C[C@@](C)(O)CC(=O)O)C1	1782201782	AULTYCSSUNLYIH-JSNMRZPZSA-N	432.945	1.381	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)Cn2ccnc2)C1	1782547342	NFVVGYRQFXTXQE-YIOZNXECSA-N	441.370	1.817	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)Cc3ccc([N+](=O)[O-])cc3F)C2)C1	1782973854	LCTKQTNBIADWNM-DNVCBOLYSA-N	443.859	1.360	50	20	IDGD	
CCS(=O)(=O)c1ccc(CC(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](F)Cl)CCO3)cc1	1783017193	JTCGYLOZJUUKPL-HKUYNNGSSA-N	446.928	1.387	50	20	IDGD	
C[C@H](NC(=O)c1ccccc1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Cl)C2	1783257837	YBNLOYXRVSWRKH-CTRXZIQJSA-N	439.915	1.853	50	20	IDGD	
C[C@H](Oc1ccccc1)C(=O)N1CC[C@]2(CN(C(=O)[C@@H](F)Br)CCO2)C1	1783321028	KATLOJPJSPDBCY-JCKWVBRZSA-N	429.286	1.974	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](C)Br)C3)C2)cc1	1783536901	HXWJTZXPSXQNQW-BFUOFWGJSA-N	438.322	1.872	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3c4c(nn3C)CCC4)CCO2)C1	1783538037	VMOHBGCIDYAOEJ-KZULUSFZSA-N	425.327	1.136	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)C3(c4ccccc4)CCC3)C2)C1	1783797029	FYBRUXHFIGUAAM-QHCPKHFHSA-N	442.560	1.311	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)C(C)(C)NC(=O)OC(C)(C)C)CCO2	1783871819	WBCZIRHYPRKTMX-VLIAUNLRSA-N	447.960	1.373	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(-n4cccn4)cc3)CCO2)C1	1783882503	ZWIWHQBZRCDZTC-RXVVDRJESA-N	432.908	1.570	50	20	IDGD	
CCOC(CC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](C)CBr)CCO2)OCC	1784161290	WZHDRXOHFBNFFS-RDTXWAMCSA-N	435.359	1.637	50	20	IDGD	
CCOC(=O)N(CC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Cl)CCO2)Cc1ccco1	1784302901	MHFOKYJVUHEIFC-APWZRJJASA-N	445.875	1.602	50	20	IDGD	
Cc1noc(N)c1C(=O)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1	1788143898	TVBCYEVOIJCTEY-UHFFFAOYSA-N	434.261	1.307	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)[C@@H]1[C@H]2Sc3ccccc3[C@H]21	1788618896	YDCNFYQLZXQADS-JEFZUKILSA-N	436.961	1.454	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(-c4ccccn4)[nH]n3)[C@H]2C1	1788949553	OUZJZWLUTFGUFL-ZTENYAIWSA-N	447.923	1.319	50	20	IDGD	
CCOc1ncc(Cl)cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21	1788978345	MYAGMLDXHUGPEM-KSYCFECVSA-N	446.331	1.327	50	20	IDGD	
Cc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Br)C[C@@H]32)c(C)n1	1789111302	OZSOZDOKUMTMMI-QCEMKRCNSA-N	428.302	1.982	50	20	IDGD	
CC[C@@H](C)[C@H](N)C(=O)NC1(c2ccc(NC(=O)c3cnccc3C(=O)NN)cc2)CCC1	1789522889	SNYJLZOIUBQSOW-KUHUBIRLSA-N	438.532	1.806	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]2C1)N1C[C@H]2C[C@H]2C1	1789867848	GZYBEDQBAVMZEX-YLRNSDIYSA-N	432.392	1.543	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4cn[nH]c4cn3)C[C@@H]21)[C@H](F)Br	1789925756	IVQPQYMRXIBSCI-YIVQXAGMSA-N	440.273	1.242	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(F)n3)C[C@@H]21	1790960586	MTHHGNPCUIYSKD-XPCVCDNBSA-N	428.302	1.988	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(OC(F)F)cn3)C[C@@H]21	1791252945	ZMBZLEJNQZTYCT-PCBIJLKTSA-N	447.866	1.530	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(-c4ccncc4)[nH]n3)C[C@@H]21	1791255613	XDUFXCSAMICKNZ-GGXPGOJBSA-N	447.923	1.319	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)[C@@H]1CCc2nc[nH]c2C1	1791526853	QUBQUDWPNFENGU-FHIRATQRSA-N	439.354	1.279	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(Cl)cnc1OC	1792402813	IXLHUWCRYVXWPO-JLUCKKNBSA-N	432.304	1.201	50	20	IDGD	
COC(=O)[C@H]1CC=CC[C@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(C)(C)CCl	1792785518	BHTBDNPMDWWHQM-BPKGMFCQSA-N	426.941	1.596	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3nccnc3c1)C2	1792867770	HBLPQCGDJSTBQZ-LJGDNWOOSA-N	447.333	1.864	50	20	IDGD	
Cc1c[nH]c(C)c1CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2	1793097938	SKDBTOLLEQVBMJ-CCWDJLKJSA-N	426.355	1.939	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@@H](C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](O)CCl)C[C@H]2C[C@H]21	1793107828	XDXDPANEWCGADG-JIYOGZPKSA-N	441.956	1.622	50	20	IDGD	
N#Cc1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](O)CCl)c(C(F)(F)F)n1	1793110821	WKTRGWLMINHZNS-GFQSEFKGSA-N	430.814	1.824	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](F)c1ccccc1	1793964102	RGPJFZFZNLOASY-YYAJDYIMSA-N	425.464	1.648	50	20	IDGD	
O=C(Cc1ccc(Br)cn1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2	1794157732	IMZNLFZOKZJBJB-ANGCBRKESA-N	434.693	1.511	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](N)c1cccc(Cl)c1	1795625168	IPLDFMKLXGMRIG-WTLGNFPFSA-N	440.016	1.781	50	20	IDGD	
C=CCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Cl	1796367424	INJCBULANIZVML-QRJUGERDSA-N	447.935	1.970	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1nc(C)oc1C(F)(F)F	1796409347	PIJIZXBAVOLWMX-WRWGMCAJSA-N	439.818	1.459	50	20	IDGD	
COC(=O)[C@@H](CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](F)Cl)NC(=O)OC(C)(C)C	1796810295	VHHIJXURLKNPHF-OKWIKPQFSA-N	449.907	1.615	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2ccccn2n1	1797347786	FVWGETJWUOUQSG-BQYPDTMYSA-N	447.499	1.720	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc2c1OCCO2	1797484102	VPSCLDLZBUSEMJ-MUJYYYPQSA-N	430.505	1.083	50	20	IDGD	
CC(C)n1nccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnccc1C(=O)NN	1798440007	SHJAWEPRORDHHJ-QDMKHBRRSA-N	425.493	1.028	50	20	IDGD	
O=C(Cc1cc(Br)ccc1O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2	1799253352	WPASKTPMONOVLG-OJXGSEEGSA-N	449.704	1.821	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3ncccc3[nH]1)C2)[C@@H](F)Br	1799348864	QIRJYPLSOQAJNH-ANGCBRKESA-N	425.258	1.457	50	20	IDGD	
CCC(=O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](Br)Cc1ccccc1	1800437232	SKRMADFTJGGABJ-KYHPRHEASA-N	437.334	1.561	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3n(n1)CCC3)C2	1800641990	PTXITMQLKOAQGG-FAXLKDOZSA-N	425.327	1.206	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc3c(c1)CCCO3)C2	1800978021	JPQNHDCHQIPECP-BMQTXXJKSA-N	436.936	1.398	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1F)C2	1802338005	LCWIJQFTPRVNOJ-BTTYYORXSA-N	435.456	1.359	50	20	IDGD	
CN1N=C(C(=O)N2CC[C@@H](CNC(=O)C(C)(C)CCl)[C@H]2c2cccnc2)CCC1=O	1802898765	ZHOYXMGCGMLFQT-MAUKXSAKSA-N	433.940	1.961	50	20	IDGD	
CC(C)(C)n1cc(C(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)cn1	1803142192	WPQHLCYNDDKJLV-BPQIPLTHSA-N	433.940	1.952	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)CN2C(=O)CNC2=O)[C@H]1c1cccnc1	1803686497	OEMQNEBZCGQPLI-MPGHIAIKSA-N	435.912	1.047	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@H]1c1cccnc1)c1cc(O)ncn1	1803739971	BEVGPSSBCGXSFB-CQDKDKBSSA-N	438.257	1.587	50	20	IDGD	
Cc1nc(O)c(C(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@H]2c2cccnc2)nc1C	1804870557	NYEVMMLUOSLTFQ-UXLLHSPISA-N	433.896	1.113	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2cc(C(=O)O)ncn2)[C@H]1c1cccnc1	1804972700	GDCNTROTAVEPSD-GRDNDAEWSA-N	447.879	1.143	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC2(CCN(C(=O)c3c[nH]c(=O)cn3)CC2)C1	1805387306	IFPIISRXHKYKHI-ZDUSSCGKSA-N	425.327	1.646	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC2(CCN(C(=O)C[C@](C)(O)CC(=O)O)CC2)C1	1805389261	KROCGFAIKZHCNA-KDOFPFPSSA-N	447.370	1.864	50	20	IDGD	
Cc1cccc(CC(=O)N2CCCC3(CCN(C(=O)c4ccc(B(O)O)cc4)CC3)C2)n1	1805689033	UAJIJNMETKHPOX-UHFFFAOYSA-N	435.333	1.157	50	20	IDGD	
Cc1nnc(CC(=O)N2CC[C@@H](CNC(=O)CCBr)[C@H]2c2cccnc2)o1	1806340932	RHAHNPNXCDIFIQ-KBXCAEBGSA-N	436.310	1.807	50	20	IDGD	
COC(=O)NCC(=O)N1CC[C@H](CNC(=O)CCBr)[C@@H]1c1cccnc1	1806347077	SGFGRODXBWCSDV-CJNGLKHVSA-N	427.299	1.228	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)o1	1807364694	JUTRRLVELNZXAT-NQIIRXRSSA-N	433.273	1.296	50	20	IDGD	
O=C(Cc1ccc2ncnn2c1)NC[C@@H]1CCN(C(=O)[C@@H](F)Cl)[C@H]1c1cccnc1	1807406824	AIJPOXZXFHCIBR-ZYSHUDEJSA-N	430.871	1.907	50	20	IDGD	
N=C(N)SCC(=O)N1CC[C@H](CNC(=O)[C@@H](F)Br)[C@H]1c1cccnc1	1808661668	OJABGHVKELSLBZ-RAIGVLPGSA-N	432.319	1.405	50	20	IDGD	
CC(=O)NCC(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)CBr)[C@@H]1c1cccnc1	1812614642	OAPAPIIJHOWEFU-YLQAJVPDSA-N	425.327	1.255	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2ccns2)[C@@H]1c1cccnc1	1813071834	YHIGMUWXGMDXCY-HNAYVOBHSA-N	430.534	1.231	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2ncccc2F)[C@H]1c1cccnc1	1813074154	QWUQJOPXBOCVDR-IERDGZPVSA-N	442.495	1.308	50	20	IDGD	
CC(C)[C@H](S)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1	1815350256	MCOGZASEGOOKNJ-CJNGLKHVSA-N	433.364	1.003	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cncs2)n[nH]1	1816583104	SSEHKLCIXUSNOO-AWEZNQCLSA-N	440.489	1.484	50	20	IDGD	
CS(=O)(=O)c1cncc(C(=O)N[C@@H]2CCc3nc(NC(=O)[C@@H](F)Cl)sc3C2)c1	1817116859	GPXZPEFIFVCPIS-NOZJJQNGSA-N	446.913	1.702	50	20	IDGD	
CC(C)O[C@@H](C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1	1817472325	QNKGAWYPPCQQNP-KBXCAEBGSA-N	428.298	1.209	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](O)CCl)CC2)c1cn2cc(F)ccc2n1	1819102947	VBDCRNWTPQJLJA-GXFFZTMASA-N	437.884	1.755	50	20	IDGD	
C[Si](C)(C)OCC(=O)Nc1cc([C@H]2CCCCN2C(=O)CCN2C(=O)C=CC2=O)[nH]n1	1819591906	PGLPZLFMWYWTQK-OAHLLOKOSA-N	447.568	1.568	50	20	IDGD	
COc1cc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@@H](O)CCl)CC3)ccc1O	1822241465	XXACQGFMKNKHQI-MFKMUULPSA-N	425.894	1.683	50	20	IDGD	
C[C@@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1)C1(O)CCC1	1823737762	XJNLTAFMRMWDDV-HKUYNNGSSA-N	436.597	1.530	50	20	IDGD	
CC(=O)N[C@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)CC1)C(C)(C)C	1824179553	TYVYXFNVUHKUPR-OKZBNKHCSA-N	429.989	1.757	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(OC)nn1C)CC2	1825994065	PUPDDWJONFTQFW-UWVGGRQHSA-N	427.914	1.365	50	20	IDGD	
COCc1oncc1C(=O)N[C@H]1CCc2nc(NC(=O)[C@H](Cl)COC)sc2C1	1825999158	RQXFJVQCRVCTKX-GXSJLCMTSA-N	428.898	1.757	50	20	IDGD	
Cn1cc(CC(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@H](F)Br)CC3)cn1	1826943320	FWHHSYIPSLJMOL-ZANVPECISA-N	430.303	1.722	50	20	IDGD	
O=C(c1ccc(Cl)cc1F)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1	1830080399	XHDSPVYTVMGSQJ-QAPCUYQASA-N	435.279	1.149	50	20	IDGD	
CC(=O)N[C@H](C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2)C(C)(C)C	1830353403	BHLTWXHSIICSHF-IERDGZPVSA-N	445.988	1.259	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CC[C@@H](C(=O)OC)C1)CCO2	1830706544	ILHJGJALYUBQBY-GRXQJBFDSA-N	444.956	1.440	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CCc2ccc(O)nn2)CC1	1831087372	BGPOQVJPAPJVDU-MSOLQXFVSA-N	438.956	1.988	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc[nH]c4nccc3-4)C2)C1	1831646370	KTFGXZRFPUSGDN-UTKZUKDTSA-N	434.924	1.992	50	20	IDGD	
Cc1onc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@](C)(Cl)CCl)C3)C2)c1C	1831981930	KCLBEMPTWXBGIE-MSOLQXFVSA-N	434.320	1.598	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)COC(C)(C)C)CCO2)C1	1832306925	KEYHUSOFDGFYGN-KSSFIOAISA-N	435.359	1.289	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H]2CCCOC2)CC1	1832870037	OWZQEGYKJNPDRJ-PXNSSMCTSA-N	443.548	1.345	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3ccc(C)nc3)CCO2)C1	1832912907	LHMCHPASEZOWIA-WIYYLYMNSA-N	439.940	1.033	50	20	IDGD	
C[C@@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)[C@@H]3C=CCN3)CC2)CC1	1833263799	SXPKAMGIGGWOIH-YOEHRIQHSA-N	427.387	1.117	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)CCc3cnc[nH]3)CC2)CC1	1833789399	FMMUCDYYSKEKRK-GOSISDBHSA-N	425.961	1.168	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCBr)CCO3)C2)cc1F	1834823754	IJQYPPSVYDTERV-LJQANCHMSA-N	443.313	1.989	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)C[C@H](N)c3cccnc3)CCO2)C1	1835824978	NDIWZALBMZUULT-UWJYYQICSA-N	438.956	1.193	50	20	IDGD	
CC[C@@H](C(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1)N(CC)CC	1836713541	GGBKQERWXSKHJX-RBUKOAKNSA-N	432.005	1.705	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)Nc1ccccc1)CCO2	1837341736	LAEKNSGLVSMCSP-BLIXFSHQSA-N	439.940	1.197	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](C)n3cnnn3)CC2)CC1	1838773349	BZERLZOHXLSHEV-CHWSQXEVSA-N	443.346	1.016	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1839021439	JTMIEFZNRWHCEL-YJBOKZPZSA-N	435.279	1.953	50	20	IDGD	
C[C@H](C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2)N1C[C@H]2C[C@H]2C1	1839153104	AZLZZEQMWPJNAG-ZGMAETJZSA-N	448.391	1.019	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnn4c3CCC4)C2)C1	1839154715	VJRBBYGBSCSAPB-OALUTQOASA-N	445.347	1.136	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3C[C@@H]3C3CC3)C2)C1	1839962119	VBVJMWSVMVXAMT-JEWRLFTDSA-N	429.355	1.662	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)C3CCOCC3)C2)C1	1839963256	FYGWHIVBJLHCMC-YJBOKZPZSA-N	433.343	1.043	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCCn3cccc3)C2)C1	1840036116	FQAAUQGRZXYKQW-VQIMIIECSA-N	442.354	1.508	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3nc(C(C)C)cs3)C2)C1	1840150247	IICYRHHIZPGDFX-LIRRHRJNSA-N	445.969	1.590	50	20	IDGD	
O=C(Cc1cccc(F)c1F)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840189745	JVQOOKZAVLCPPW-GOSISDBHSA-N	437.270	1.767	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC2(CCCN2C(=O)[C@H](O)c2ccco2)C1	1841068672	UENYWHHHVDPOEI-DZGCQCFKSA-N	441.912	1.649	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)COCCOCCOCCOC)C2	1841670581	IIESNMOWRLLNRD-KRWDZBQOSA-N	434.961	1.294	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)[C@@H]2C[C@@H]2c2ccc(Cl)cc2)C1	1843873127	OSQSIWKCCNCXIM-WOJBJXKFSA-N	438.720	1.641	50	20	IDGD	
CC(C)c1ccc(CC(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)cc1	1844265337	SDTOLHRRTWEMOM-UHFFFAOYSA-N	435.528	1.868	50	20	IDGD	
CC(C)[C@@H](CC(=O)N1CCCC12CN(C(=O)[C@H](O)CCl)C2)NC(=O)OC(C)(C)C	1846293202	AHFJRVBWYXJMSG-HUUCEWRRSA-N	431.961	1.729	50	20	IDGD	
Cc1ccc(C)c(S(=O)(=O)Nc2cccc(C(=O)NNc3nnc(C)c(=O)[nH]3)c2)c1	11265957	SLMPDNXIORWCNE-UHFFFAOYSA-N	428.474	1.648	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN(C(=O)Nc2ccccc2)C1)c1n[nH]c(=O)c2ccccc12	17195606	GNUBMXWDIHNBMR-AWEZNQCLSA-N	434.456	1.628	50	20	IDGD	
C[C@@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)NNC(=O)c2cc3c(s2)CCC3)C1=O	26545808	YXQLEQPBOQBHQV-FQEVSTJZSA-N	430.461	1.604	50	20	IDGD	
O=C(Cc1cccc(O)c1)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	60201220	MSLWIYWICRXROM-UHFFFAOYSA-N	439.493	1.874	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C2=NN(c3ccccc3)[C@H](C(N)=O)C2)o1	109019520	VAOKGXKDHPKKKF-KRWDZBQOSA-N	426.477	1.003	50	20	IDGD	
O=C(CN1CCN(C(=O)NNC(=O)CCCc2ccccc2)CC1)NCc1ccccc1	727846604	SWPVAAPLJVAJRE-UHFFFAOYSA-N	437.544	1.684	50	20	IDGD	
CN(C)N(C(=O)c1cc(-c2ccc(Br)cc2)[nH]n1)[C@@H]1CCS(=O)(=O)C1	728177940	NVFIGWGMVCSLCZ-CYBMUJFWSA-N	427.324	1.945	50	20	IDGD	
CC(=NNC(=O)[C@@H](C)NS(C)(=O)=O)c1ccc(OCC(=O)Nc2ccccc2)cc1	728437978	ZBOQEZJUBCTNAS-OAHLLOKOSA-N	432.502	1.482	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNS(=O)(=O)c2cc(C(=O)O)cs2)c1	728508373	OKAMQDVQUDCTCH-UHFFFAOYSA-N	435.277	1.841	50	20	IDGD	
O=C(CCn1c(=O)oc2cc(Cl)ccc21)NNC(=O)C1CCN(c2ncccn2)CC1	728847627	JEGCHCDQRUABFV-UHFFFAOYSA-N	444.879	1.492	50	20	IDGD	
CCN(C)C(=O)c1cccc(C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)c1	729298527	LCXQYSPBPNKQCQ-UHFFFAOYSA-N	446.529	1.169	50	20	IDGD	
COc1cc(Br)c(C=NNC(=O)Cc2cc(O)nc(S)n2)cc1OC	730587114	WMOYCDPKMTYLLT-UHFFFAOYSA-N	427.280	1.943	50	20	IDGD	
C[C@H](NC(=O)NN[C@]1(C)CCS(=O)(=O)C1)c1cc(F)ccc1N1CCC(O)CC1	730677360	IFZFLDDGLHUIGA-ORAYPTAESA-N	428.530	1.229	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COc2cc([N+](=O)[O-])c(C=O)cc2OC)cc1OC	731597300	KIBGOZJKYORJIU-UHFFFAOYSA-N	433.373	1.273	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1)c1ccc([N+](=O)[O-])cc1	732049394	UFLALBKSHZUJLM-LBPRGKRZSA-N	433.402	1.630	50	20	IDGD	
COc1cc([N+](=O)[O-])c(C(=O)NNC(=O)CCN2C[C@H](C)O[C@H](C)C2)cc1SC	732258516	DUANFSNGKSMBFR-TXEJJXNPSA-N	426.495	1.586	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NCc2ccc(N(C)S(C)(=O)=O)cc2)cc1C	732476027	WEOBFCRCOKHXEY-UHFFFAOYSA-N	434.518	1.609	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)[C@@H]2CC(=O)N(C[C@@H]3CCCN3CC)C2)o1	733139209	FIAOCVAPWLMUBS-SJORKVTESA-N	433.553	1.215	50	20	IDGD	
O=C(NC[C@H]1CCCN1Cc1ccccc1)NNC(=O)C1CCN(c2ncccn2)CC1	734169533	YSTBWYCIALIJJY-HXUWFJFHSA-N	437.548	1.688	50	20	IDGD	
O=C(NNc1nccnc1Cl)[C@H]1CCCN1S(=O)(=O)c1cccc([N+](=O)[O-])c1	734261538	KPUQYRCNOSYURS-GFCCVEGCSA-N	426.842	1.335	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)c2ccc(N3CCOCC3)cc2)CC1	734825482	HJXMTHSOAZTZHY-UHFFFAOYSA-N	447.536	1.867	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Cc2ccccc2OC(F)F)c1	735646376	AJMNZOACPMZDHZ-UHFFFAOYSA-N	427.429	1.542	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)CN(Cc2cccnc2)c2ccccc2)C[C@H](C)O1	735687629	PKJSVAVGZUPYTP-OALUTQOASA-N	425.533	1.735	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)CN2C(=O)CCOc3ccccc32)cc1C	736767158	WZNLNPLQESSHMJ-UHFFFAOYSA-N	445.497	1.739	50	20	IDGD	
CN(CC(=O)NNC(=O)c1ccc2ccccc2c1)S(=O)(=O)c1cccc([N+](=O)[O-])c1	737804099	IOYJTAGBDHZDFK-UHFFFAOYSA-N	442.453	1.830	50	20	IDGD	
COc1cc(N2C[C@H](C(=O)NNc3ccnc(N(C)C)n3)CC2=O)cc(OC)c1OC	740102994	SYUZBDPSQQKUEQ-GFCCVEGCSA-N	430.465	1.065	50	20	IDGD	
Cc1cc(C#N)ccc1S(=O)(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	740809613	DZDXVKSRECTLRY-UHFFFAOYSA-N	448.526	1.275	50	20	IDGD	
C[C@H](C(=O)OCC(=O)NNC(=O)c1ccccc1)N1CCN(c2ccc(F)cc2)CC1	740983108	RTIDHRFARWICTD-MRXNPFEDSA-N	428.464	1.341	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCN(c2cccc(Cl)c2)C1=O)c1ccc(-n2cnnn2)cc1	742035463	MMUVUVDHMSETME-MRXNPFEDSA-N	425.836	1.130	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)CN2CCN(C(=O)OC(C)(C)C)CC2=O)c(Cl)c1	743824516	NGLTUBXMJMHZNU-UHFFFAOYSA-N	439.900	1.880	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1cccc(NC(=O)C2CC2)c1	744619994	CPDOISIXZQLUIM-UHFFFAOYSA-N	444.513	1.813	50	20	IDGD	
C[C@H](C(=O)NNC(=O)c1cc2c(s1)CCCCC2)N1C(=O)[C@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O	746099513	ABXBNQDBUVRVPY-GTOWQFAVSA-N	431.514	1.329	50	20	IDGD	
CS(=O)(=O)c1ccc(OCCC(=O)NNC(=O)c2cc(-c3ccccc3)on2)cc1	746516350	KUCSAZHPHLTLIF-UHFFFAOYSA-N	429.454	1.975	50	20	IDGD	
COC(=O)c1ccsc1N1CC[C@@H](NC(=O)NNC(=O)c2cccc(N(C)C)c2)C1=O	746781315	RWUIOCMIWXOGFH-OAHLLOKOSA-N	445.501	1.350	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)[C@H](C)C1CC1)N(S(C)(=O)=O)CC2	747934099	BXUSPVSBYQYOEQ-MLGOLLRUSA-N	439.534	1.146	50	20	IDGD	
CS(=O)(=O)c1nc(C(=O)NNc2nc(-c3ccccn3)nc3c2CCC3)c2ccccn12	747984483	QFUCJIXMVQXPHG-UHFFFAOYSA-N	449.496	1.835	50	20	IDGD	
COCCOCC(=O)NC1CCC(C(=O)NNC(=O)Cc2c[nH]c3ccccc23)CC1	748697843	XQZUVPAVHLIZCE-UHFFFAOYSA-N	430.505	1.196	50	20	IDGD	
CC(C)N1C[C@H](NC(=O)NNC(=O)[C@@H]2Cc3ccccc3CN2Cc2ccccc2)CC1=O	750646415	XREYIFTYYYUHQX-YADHBBJMSA-N	449.555	1.953	50	20	IDGD	
O=C1Nc2c(I)cccc2C1=NNC(=O)[C@H]1COc2ccccc2O1	750917783	MRSORKWTZSXXAA-CYBMUJFWSA-N	449.204	1.904	50	20	IDGD	
COCCOc1ccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1	755690925	HFHPRPWKLBJSCI-UHFFFAOYSA-N	436.490	1.429	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)Nc2ccc(C(=O)NCC(F)(F)F)cc2)c1	755707904	NROKXTDHPLRSSJ-UHFFFAOYSA-N	438.366	1.799	50	20	IDGD	
CCCCN1C(=O)CC[C@H](C(=O)NNc2ccc(C(N)=O)nn2)[C@H]1c1ccccc1OC	757400050	PRSDAMGNIAJHGB-MGPUTAFESA-N	440.504	1.807	50	20	IDGD	
O=C(COC(=O)C(F)(F)c1c(F)cccc1F)NNC(=O)c1ccc([N+](=O)[O-])cc1	757825554	JTNGHNHSWPHYHJ-UHFFFAOYSA-N	429.282	1.969	50	20	IDGD	
Cc1cc(C(=O)N2CCOCC2)ccc1NC(=O)NNC(=O)c1ccc2c(c1)OCCO2	757828976	AVCBVORNSIHTHL-UHFFFAOYSA-N	440.456	1.705	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)N[C@@H]2CCc3c[nH]nc3C2)c2ccccc2c1=O	758906097	PPWUWCLMGCWQIT-OAHLLOKOSA-N	437.504	1.811	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCO[C@@H](c3cccc(OC(F)F)c3)C2)n1	759362598	CPKPJCRDOQZWES-OAHLLOKOSA-N	440.472	1.816	50	20	IDGD	
CC(C)(C)C(=O)NNC(=O)C(=O)Nc1ccc(C(=O)NCc2ccccn2)c(Cl)c1	761071300	BKZGDARCCRDVBB-UHFFFAOYSA-N	431.880	1.797	50	20	IDGD	
N#Cc1cccc(-c2csc(NC(=O)C(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)n2)c1	763446617	VDMAFSRVKSKHQJ-UHFFFAOYSA-N	436.409	1.990	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1c2c(nn1-c1ccccc1)CCC2	763471669	WBUNKVFBGXHTIE-UHFFFAOYSA-N	434.412	1.669	50	20	IDGD	
CCN(c1ccccc1)S(=O)(=O)c1ccc(OC)c(NC(=O)C(=O)NNC(C)=O)c1	763511388	BIKWAMSGMAHEKM-UHFFFAOYSA-N	434.474	1.016	50	20	IDGD	
CCOC(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)c1	763600542	KSARDJNUUHAUJQ-UHFFFAOYSA-N	435.440	1.582	50	20	IDGD	
C[S@](=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)cc1F	763604358	JYODRNFDXWZCLK-PMERELPUSA-N	429.433	1.353	50	20	IDGD	
CCOC(=O)N(C)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2F)cc1	763680600	UNEAVYNXBBRQFJ-UHFFFAOYSA-N	432.408	1.583	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(C)nn1C1CCOCC1	763684849	OXHRUFNUOIXLEY-UHFFFAOYSA-N	445.476	1.107	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(C#Cc3ccccn3)c2)cc1	763809959	WVHPJKGNUGPWFL-UHFFFAOYSA-N	428.448	1.955	50	20	IDGD	
CC(C)Oc1cc(Br)cc(C(=O)NNC(=O)CNC(=O)c2cccnc2)c1	763825053	PKXXMZZOLLJXTO-UHFFFAOYSA-N	435.278	1.822	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)cnn1-c1ccccc1	763848647	FAGYCKZDWYEYTK-CQSZACIVSA-N	425.420	1.873	50	20	IDGD	
COc1cc(C#N)ccc1Oc1ccc(NC(=O)C(=O)NNC(=O)c2cnccn2)cc1	764030713	GAYJJKUYORVCPB-UHFFFAOYSA-N	432.396	1.549	50	20	IDGD	
O=C(Cc1ccsc1)NNC(=O)C(=O)Nc1ccccc1I	764036187	ZUOHABFNIKMIJM-UHFFFAOYSA-N	429.239	1.681	50	20	IDGD	
O=C1CCc2cc(NC(=O)C(=O)NNC(=O)c3cccc(Br)c3)ccc2N1	764058187	DWBQUWOFJUSQNF-UHFFFAOYSA-N	431.246	1.734	50	20	IDGD	
Cc1nc(-c2cccc(NC(=O)C(=O)NNC(=O)c3cccc(Br)c3)c2)n[nH]1	764058531	KBHGKGIZVLZOQO-UHFFFAOYSA-N	443.261	1.942	50	20	IDGD	
CCCCOC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cccc(OC)c2O)cc1	764131129	GQKAOAWIPDBJSX-UHFFFAOYSA-N	429.429	1.757	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(F)ccc2OC[C@H]2CCCO2)cc1	764177669	SIJOQKZCTJGPDR-MRXNPFEDSA-N	426.404	1.655	50	20	IDGD	
CCc1cc(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3CN2Cc2ccccc2)no1	764179007	MMEVVVQGFMXTBZ-FQEVSTJZSA-N	447.495	1.950	50	20	IDGD	
CC(C)S(=O)(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)CCc2ccccc2)c1	764186022	RZBKALVHPZMIRH-UHFFFAOYSA-N	431.514	1.729	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl	764205108	ZFNSINGXBHIMFY-UHFFFAOYSA-N	443.844	1.639	50	20	IDGD	
CCn1cnnc1-c1cccc(NC(=O)C(=O)NNC(=O)c2cccc3ncccc23)c1	764257472	HPASODOXAHAUOX-UHFFFAOYSA-N	429.440	1.913	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)C(C)(C)c2ccccc2)c(OC)c(OC)c1	764309379	OZVQJIFKKVLHDF-UHFFFAOYSA-N	443.456	1.554	50	20	IDGD	
N#Cc1ccc(Cn2cnc(NC(=O)C(=O)NNC(=O)c3cc4ccccc4o3)n2)cc1	764330928	IEQBSEZTWNNBAF-UHFFFAOYSA-N	429.396	1.344	50	20	IDGD	
COc1nccnc1NNC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1	764482459	WHIAVGSNKWBCER-CQSZACIVSA-N	436.450	1.080	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)Nc3cccc(S(N)(=O)=O)c3)n[nH]2)cc1	765307358	MALBXUCHVXKDKS-UHFFFAOYSA-N	428.474	1.753	50	20	IDGD	
C[C@@H](CC(=O)NNC(=O)CNC(=O)c1cccnc1)C1CCN(C(=O)OC(C)(C)C)CC1	765510313	UJOCUGMCNMCDIX-HNNXBMFYSA-N	447.536	1.632	50	20	IDGD	
CCC1(C(=O)NNC(=O)CN2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)CCCC1	766635879	HZQXZBGCKHMMFP-UHFFFAOYSA-N	436.578	1.419	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H]2CCCc3cccnc32)c1	767403780	PLJLVDHKSWPFKN-SFHVURJKSA-N	430.530	1.993	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)[C@@H]1CCCN(C(=O)NC2CCCC2)C1	768629300	HTMWXGYMSDUHPL-CQSZACIVSA-N	438.550	1.906	50	20	IDGD	
CC1(C)C(=O)Nc2ccc(C(=O)NNC(=O)c3ccc(Cl)c(S(N)(=O)=O)c3)cc21	768931630	ZIQCTKXJNVCXNQ-UHFFFAOYSA-N	436.877	1.292	50	20	IDGD	
CC(C)(C)OC(=O)N1CCc2ccccc2[C@H]1C(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1	769077650	LHTMGORCLOWPQU-ZBFHGGJFSA-N	437.518	1.103	50	20	IDGD	
Cn1ncc(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)c1Cc1ccccc1	770111541	VEDHMYVCRCOLCI-UHFFFAOYSA-N	426.502	1.379	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)CCc2cccc3c2OCO3)cc1	770211464	DUZBNDUQYBPUAS-UHFFFAOYSA-N	433.486	1.124	50	20	IDGD	
Cc1cc2c(cc1C)[C@H](C(=O)NNC(=O)CN1CCN(C(=O)c3ccccc3)CC1)CO2	770245141	KPLOTIKALWRJOX-HXUWFJFHSA-N	436.512	1.385	50	20	IDGD	
CNC(=O)COc1cccc(CNC(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)c1	770293880	VZLKLFNUJPZYFS-CYBMUJFWSA-N	434.880	1.763	50	20	IDGD	
CCCC[C@H](NC(=O)NCC)C(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	771271131	YZDYJHBFSTYOLC-HNNXBMFYSA-N	442.561	1.594	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2ccc(OC)c(NC(=O)OC(C)(C)C)c2)n1	773724037	LJGCJHLOCHPQSN-UHFFFAOYSA-N	432.437	1.923	50	20	IDGD	
Cc1cc(CNC(=O)NNC(=O)CSc2ccc(Cl)cc2)ccc1S(N)(=O)=O	775232429	YBDHMNRJXGLRKA-UHFFFAOYSA-N	442.950	1.919	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN[C@H](C)c2cc(OC)c(OC)cc2F)cc1OC	775424369	STPUURUXKGPXBC-GFCCVEGCSA-N	435.452	1.972	50	20	IDGD	
Cc1cc(C)c(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1Br	777141210	ILWIEFVIZAYXKK-INIZCTEOSA-N	448.273	1.992	50	20	IDGD	
Cc1ccnc2c(S(=O)(=O)NNC(=O)C(=O)NCc3ccc(Cl)cc3)cccc12	777648142	KUSOLCPPMKCVBT-UHFFFAOYSA-N	432.889	1.823	50	20	IDGD	
O=C(CN1CCNC(=O)[C@H]1c1cccc(Br)c1)NNC(=O)c1cccs1	777717188	QMBVZIFKAUJVCE-OAHLLOKOSA-N	437.319	1.445	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)CNC(=O)c1cccs1)[C@H]1CCN(Cc2ccccc2)C1	778639268	APNIIXUHRGWZTM-WBVHZDCISA-N	429.546	1.719	50	20	IDGD	
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	779389409	ZASLLHYVGKPJJU-LBPRGKRZSA-N	432.481	1.181	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1ccnn1Cc1ccc(C(F)(F)F)cc1	779462779	SZTPUHWPBVINAP-JTQLQIEISA-N	448.427	1.041	50	20	IDGD	
COC(=O)c1ccccc1NNC(=O)c1sccc1S(=O)(=O)Nc1cnn(C)c1	780729224	LHNOTOZGECWSSO-UHFFFAOYSA-N	435.487	1.826	50	20	IDGD	
CN1C(=O)C[C@H](C(=O)NNC(=O)CCNC(=O)OC(C)(C)C)[C@@H]1c1cccc(Cl)c1	780974473	XZNUGIATPLTZPX-YOEHRIQHSA-N	438.912	1.922	50	20	IDGD	
C[C@](O)(CC(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1)c1ccccc1	780984798	YRNVXFCSMWDYRM-QHCPKHFHSA-N	444.963	1.903	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)[C@@H]2CC(c3ccccc3[N+](=O)[O-])=NO2)cc1OC	781934852	ZKGIEZCMBFBMTQ-SFHVURJKSA-N	428.401	1.956	50	20	IDGD	
CC(=O)N1CCN(Cc2ccccc2NC(=O)NNC(=O)c2cccc(N(C)C)c2)CC1	782076863	IDSFYBSQEGOXQW-UHFFFAOYSA-N	438.532	1.883	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)F)cc1)C(=O)Nc1ccc(OC2COC2)cc1	782116402	GIFPVZCQEXPAKK-UHFFFAOYSA-N	441.412	1.542	50	20	IDGD	
CC(C)OC(=O)NCc1ccc(NC(=O)C(=O)NNc2ccc(S(C)(=O)=O)cc2)cc1	783076653	YZOPTOBREFRPNF-UHFFFAOYSA-N	448.501	1.807	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2ccc(F)cc2I)nc(C)n1	783325228	XPWSACMYHQYNEJ-UHFFFAOYSA-N	429.193	1.919	50	20	IDGD	
COC[C@H](C)NS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccc(F)cc2C)cc1	783447750	NERZDZWXJNHYGX-ZDUSSCGKSA-N	438.481	1.529	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1ccccc1SC(F)(F)F	784003232	CEJHLFRWTJNXCO-UHFFFAOYSA-N	446.432	1.876	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1cc(C(F)F)ccc1Cl	784003638	JZXDQDFDFLRXBS-UHFFFAOYSA-N	430.820	1.855	50	20	IDGD	
Cc1cn2cc(NC(=O)C(=O)NNc3ccc(S(=O)(=O)NC4CC4)cc3)ccc2n1	784214553	ZXNOWLZBCGBMOZ-UHFFFAOYSA-N	428.474	1.165	50	20	IDGD	
CN(C)CCn1c(=O)oc2ccc(NC(=O)C(=O)NNc3cc(F)c(F)cc3F)cc21	784891902	KUJKBSUVSHBUNR-UHFFFAOYSA-N	437.378	1.655	50	20	IDGD	
CS(=O)(=O)N1CCc2c(NC(=O)C(=O)NNc3cccc(C(F)(F)F)n3)cccc21	784959303	XQBPUADDWKNPEP-UHFFFAOYSA-N	443.407	1.504	50	20	IDGD	
Cc1ccc(C(=O)NCC2CC2)cc1NC(=O)C(=O)NNC(=O)c1ccc(O)c(Cl)c1	785990426	GTMZCBTWARNKMV-UHFFFAOYSA-N	444.875	1.894	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc2c(c1)COC2)NNC(=O)NCc1ccc(Cl)cc1	787423731	DPIRUGUENLYGSJ-UHFFFAOYSA-N	438.893	1.179	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2)cc1C(=O)N1CCOCC1	787554694	JEQBVYWXGJIFSM-UHFFFAOYSA-N	427.417	1.457	50	20	IDGD	
CC(C)CN1C[C@@H]2CN(C(=O)NNC(=O)c3cccc(OC(F)F)c3)CCN2C1=O	787857779	MRUIHVSZORDZAN-AWEZNQCLSA-N	425.436	1.720	50	20	IDGD	
CN(CC(=O)NNc1nnc(-c2ccccn2)s1)S(=O)(=O)c1cccc([N+](=O)[O-])c1	788568016	VSPBEMTVZNYOFB-UHFFFAOYSA-N	449.474	1.272	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@@H]2CC23CN(C(=O)OC(C)(C)C)C3)cc(OC)c1OC	788672424	USUSEPFSJBKWGA-ZDUSSCGKSA-N	435.477	1.730	50	20	IDGD	
CCOC(=O)C1(CC(=O)NNC(=O)c2cc(-c3ccc(OC)c(OC)c3)[nH]n2)CCC1	789199912	PLDYJFROSHNQLY-UHFFFAOYSA-N	430.461	1.978	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1cc(-n2cccn2)ccc1C	789597424	SVCGJCCLGIZCBH-UHFFFAOYSA-N	443.485	1.675	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3ccc4c(c3)CC(=O)N4C)cc2C1	789732242	RZYJZSPOEWSKOD-NSHDSACASA-N	426.498	1.792	50	20	IDGD	
CC(C)n1nc(-c2ccco2)cc1NC(=O)C(=O)NNC(=O)COc1ccccc1C#N	789732922	SNFQYFDGGAITJX-UHFFFAOYSA-N	436.428	1.761	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2ccnc(Oc3ccc(F)cc3F)c2)CCS(=O)(=O)C1	789750113	CKNAUGGSFZSLNG-GOSISDBHSA-N	440.428	1.289	50	20	IDGD	
NC(=O)c1ccc(/C=C\C(=O)N2CCC[C@H]2C(=O)NNc2cccc(F)c2[N+](=O)[O-])cc1	791067390	SJGAIRIRVQZUFS-NLZINVLXSA-N	441.419	1.980	50	20	IDGD	
CC(=O)NC[C@@H]1CCn2ncc(C(=O)NNC(=O)c3cc4c(s3)CC[C@@H](C)C4)c2C1	792736193	LMOWEIGKQCMIAM-TZMCWYRMSA-N	429.546	1.843	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Cc2ccc(S(=O)(=O)N(C)C)cc2)ccc1OC(C)C	792822899	OUQRDVUMBIDIAN-UHFFFAOYSA-N	449.529	1.736	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)N[C@@H]2CCN(c3cccc(Br)c3)C2=O)n1	793197655	AYODRSGYQPUAPS-OAHLLOKOSA-N	432.278	1.902	50	20	IDGD	
C[C@H]1CN(C(=O)CCC(=O)C(C#N)=C2N(C)c3ccccc3N2C)C[C@H](C)S1(=O)=O	794157748	NEJCXKJGUCHSKB-GJZGRUSLSA-N	430.530	1.691	50	20	IDGD	
CCC(=NNC(=O)[C@H](C)CN1C[C@H](C)O[C@@H](C)C1)c1ccc(Cl)c(S(N)(=O)=O)c1	794477613	DCPXGKWRXDDKDR-RDBSUJKOSA-N	444.985	1.963	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)c2ccc(CS(=O)(=O)C(F)F)cc2)cc1	794718268	YMASYILYJFJKRY-UHFFFAOYSA-N	447.485	1.831	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)[C@H]2CCCCN2C(C)=O)c2ccccc2c1=O	794774390	KKBYSDAAGUSSDA-GOSISDBHSA-N	427.505	1.749	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H]2CN(CC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)CC[C@H]21	795099295	MLKJPTUGNFBULM-DOTOQJQBSA-N	447.492	1.687	50	20	IDGD	
C[C@@]1(C(=O)NNC(=O)CNC(=O)c2cccnc2)CCN(C(=O)OCc2ccccc2)C1	795180859	FPWRGPYKSNPJKV-JOCHJYFZSA-N	439.472	1.008	50	20	IDGD	
COCCNC(=O)c1cccc(S(=O)(=O)NNC(=O)c2cccc(OC(F)F)c2)c1	795312957	AKSJERSYFBMCRI-UHFFFAOYSA-N	443.428	1.288	50	20	IDGD	
C[C@H]1[C@H](C)CCC[C@H]1CNC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	797541826	AGWFLYMALCMOQC-IKGGRYGDSA-N	438.598	1.716	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)[C@H]1CCCN1C(=O)OCc1ccccc1	797730924	VYDOZZDKFYOYAI-MRXNPFEDSA-N	449.508	1.643	50	20	IDGD	
N#Cc1ccc(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)s1	797814696	BYYNVRNWIWEDDE-UHFFFAOYSA-N	440.528	1.028	50	20	IDGD	
Cc1nc(C(=O)NNc2ccc(-c3cccc(C(F)(F)F)c3)nn2)nn1-c1nc[nH]n1	804209019	IFSCHYCIWUKJRT-UHFFFAOYSA-N	430.354	1.927	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)c1nccn1-c1ccccc1	805068868	SMRYPGYMWJBDRX-INIZCTEOSA-N	434.504	1.970	50	20	IDGD	
COc1cc(OC)cc(N2CC[C@@H](NC(=O)NNc3ccc4c(=O)[nH]ccc4c3)C2=O)c1	806906351	QRSZGLHVKORIAB-LJQANCHMSA-N	437.456	1.977	50	20	IDGD	
CSCC[C@@H](NC(=O)c1ccc2ccccc2n1)C(=O)NNC(=O)N1CCN(C)CC1	807380056	ASQSINDAZHWZFC-GOSISDBHSA-N	444.561	1.075	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2ccc(-n3ccnc3)nn2)nn1-c1ccccc1Cl	807428994	NVHXTNOXJISNLN-UHFFFAOYSA-N	437.851	1.892	50	20	IDGD	
C[C@H](CCOCc1ccccc1)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	807607757	RVHXDOXBACJTDO-MRXNPFEDSA-N	448.545	1.876	50	20	IDGD	
CCCS(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)CCc2ccccc2O)cc1	808088329	DUCHVKBHUPZFTK-UHFFFAOYSA-N	426.516	1.518	50	20	IDGD	
COC(=O)c1c(F)ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)c1F	810386098	MCTSFLULZCLOOV-LBPRGKRZSA-N	449.410	1.922	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCC(=O)NNc2ncccc2Cl)cc1OCC	810406257	ZRNSOLQXKZXNAG-UHFFFAOYSA-N	428.898	1.954	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccc(F)cc2OCC#N)cc1	813033070	CZPPAOVEWXSDRV-UHFFFAOYSA-N	435.437	1.060	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccccc2Br)cc1	813033264	LMXAMCYWTMGGAE-UHFFFAOYSA-N	441.307	1.781	50	20	IDGD	
Cc1nc(N2CCOCC2)ccc1NC(=O)NNc1ccccc1S(=O)(=O)N(C)C	814673692	YQMCOERTCLZXJO-UHFFFAOYSA-N	434.522	1.626	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)c1cnn(C)c1I	814737202	YLRWCAATJAMXPX-MRVPVSSYSA-N	432.193	1.392	50	20	IDGD	
CNS(=O)(=O)c1ccc(C(=O)NNc2cc(C(=O)OC)ccc2Br)o1	816716760	ADIBWDYXJXLFTC-UHFFFAOYSA-N	432.252	1.494	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)COc2cccc(C(C)=O)c2)c1	912643091	STLHVWJLQCAIDA-UHFFFAOYSA-N	447.513	1.760	50	20	IDGD	
CC(=O)N1CCN(S(=O)(=O)c2cccc(C(=O)NNc3ccccc3Cl)c2)CC1	912646918	ZDLKKKSQYMRSGP-UHFFFAOYSA-N	436.921	1.950	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)CNS(=O)(=O)c2ccccc2F)cc1OC	913069799	LXVDWWYDSZZFFG-UHFFFAOYSA-N	439.465	1.363	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)c1ccc2c(=O)n3c(nc2c1)CCCCC3	913571555	NWCLEXOJCFDULV-UHFFFAOYSA-N	439.497	1.375	50	20	IDGD	
COc1ccc(OCC(=O)NN=C2CCN(S(=O)(=O)c3c(C)n[nH]c3C)CC2)cc1	914554711	PVUSGGYZNMNEOP-UHFFFAOYSA-N	435.506	1.371	50	20	IDGD	
Cc1cccc([C@@H](CC(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)NC(N)=O)c1	914645885	TWBRMHVPYOKFTF-MRXNPFEDSA-N	432.864	1.752	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(Cn3ccnc3)cc2)c1	915056554	PSQRQKGFNIOLDJ-UHFFFAOYSA-N	427.486	1.257	50	20	IDGD	
C[C@H](Oc1ccc2c(c1)CCC2)C(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	915483239	DLXNBISCOLAALK-ZDUSSCGKSA-N	427.413	1.855	50	20	IDGD	
Cc1ccc(C)c(S(=O)(=O)NCC(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)c1	915787663	HDXCPQLBMVXCER-KRWDZBQOSA-N	433.530	1.813	50	20	IDGD	
O=C(NNC(=O)C(F)(F)c1ccccc1)c1cccc(S(=O)(=O)N2CCOCC2)c1	916030285	SOUMDFJUCMSYPE-UHFFFAOYSA-N	439.440	1.261	50	20	IDGD	
COc1ccc(OCC(=O)NN=C(C)c2ccc(S(=O)(=O)N3CCOCC3)cc2)cc1	916296990	YNMDZCUNZAOJRB-UHFFFAOYSA-N	447.513	1.635	50	20	IDGD	
C[C@H]1CN(c2ccc(CNC(=O)NNC(=O)c3cc(Br)c[nH]3)cn2)CCO1	916392674	HIMDOZSOLLIRPC-NSHDSACASA-N	437.298	1.542	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)nnn1-c1ccccc1	917530823	DKUGRFZHNAMIKL-UHFFFAOYSA-N	431.456	1.941	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2ccc(-n3c(C)cnc3O)cc2)c2ccccc2c1=O	918757872	MNDVCAHTDGYQKQ-UHFFFAOYSA-N	432.440	1.691	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(OC)c(C(=O)NNC(=O)Cc2ccccc2OC)c1	919822456	VANVWUKWBDLYAJ-UHFFFAOYSA-N	449.529	1.738	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)[C@H]2CC(=O)N(c3ccc4c(c3)OCCO4)C2)cc1	919832716	GUTJKDAHNLECDF-INIZCTEOSA-N	439.468	1.600	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)NCCNC(=O)c2ccc(F)cc2)cc1OC	919916303	HDMOXWYRJXABDJ-UHFFFAOYSA-N	432.452	1.997	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)c1cccnc1	921304061	BWCWWRVWAKQWDR-IBGZPJMESA-N	442.479	1.840	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1	1116084815	JKZWTTUJKLJSML-UHFFFAOYSA-N	425.507	1.846	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccccc1)NNC(=O)c1ccc(F)cc1Br	1332466108	RVPXWHIFZDLVOD-UHFFFAOYSA-N	430.255	1.328	50	20	IDGD	
CCc1[nH]nc(C(=O)N2CCO[C@@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)c1Cl	1779296110	JYNIYZUCOLVPIK-GOSISDBHSA-N	428.993	1.921	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc(NC(C)=O)o2)C1	1779371826	RIHCXFZMABSSNT-YYFZDKIDSA-N	441.912	1.619	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(N4CCN(C)CC4)cc3)CCO2)C1	1781210964	FHYPZKFGXTYPOW-OFNKIYASSA-N	448.995	1.899	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(CCN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)C2)C1	1781937069	DHWTWLWCOFTSKM-QGZVFWFLSA-N	442.266	1.529	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)Cn1cccn1)C2	1781996946	ZNMSGFCPTAMHPM-YYAJDYIMSA-N	441.370	1.817	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@]2(CN(C(=O)Cc3cnc[nH]3)CCO2)C1	1782865999	GJUGOMVMDYQPDD-RWHUQTJRSA-N	441.438	1.667	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](O)Cc3ccccc3)C2)C1	1783340987	FXGYBZWRKBIXDR-URLQWDBASA-N	425.323	1.203	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cn4ncccc4n3)CCO2)C1	1783347996	RHWARAHLDJHPRD-FZKQIMNGSA-N	436.310	1.346	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3n[nH]c4c3CC[C@H]4C)CCO2)C1	1783534550	WDUGTSMKTJEQSH-SOZUMNATSA-N	425.327	1.686	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)CC(=O)Nc3ccc(F)cc3)CCO2)C1	1783880850	GCNFIWNSUNPKQZ-OXJNMPFZSA-N	441.887	1.238	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cc(C)c(C(=O)O)c(C)c3)CCO2)C1	1783882833	QZIGWKSRRFKXLD-HRAATJIYSA-N	438.908	1.699	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3ccccc3Cl)C[C@@H]21)[C@H](O)CCl	1784089424	BTWFNIOONGHAKB-ONIAQPFYSA-N	429.344	1.852	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cn4ccc(Cl)cc4n3)C[C@@H]21)[C@H](O)CCl	1784093369	UYIUWAAOQVTVOR-YUDUHTQSSA-N	441.315	1.181	50	20	IDGD	
COc1cc(F)cc(/C=C/C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]3C2)c1	1784094513	OTVQTDZWKBVEHJ-LWTGDAADSA-N	440.899	1.427	50	20	IDGD	
O=C1CC(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](Br)Cc2ccccc2)CCO3)C1	1785409002	FLRFVDJACXXJRB-GHTZIAJQSA-N	449.345	1.802	50	20	IDGD	
COc1cc(F)ccc1CC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](C)Br)CCO2	1785659924	AIUWYHWTQLQBDY-ORAYPTAESA-N	443.313	1.990	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(C4CC4)on3)C[C@@H]21	1786404799	RHEABAUYNQAMBV-XEZPLFJOSA-N	426.311	1.930	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)c1cccc2c[nH]nc12	1787324363	LXCPILNZYJTTJX-ATVPRXPUSA-N	439.285	1.847	50	20	IDGD	
CC(C)(C)n1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CO[Si](C)(C)C)C[C@@H]32)nn1	1789355620	BQUXHQVCOUMYNL-ZOBUZTSGSA-N	437.617	1.478	50	20	IDGD	
C[C@H](Br)C(=O)NC1(c2ccc(NC(=O)[C@H](O)N3CCOCC3)cc2)CCC1	1789557039	OFIUFTGVQVUJQJ-UGSOOPFHSA-N	440.338	1.555	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)Oc3ccccn3)C[C@@H]21	1791256591	QYMBUUOZAJFHDE-XAJHFOFHSA-N	425.913	1.082	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc(OC)c(F)c3)C[C@@H]21	1791256852	YFKUEYKMEVGVGR-FPXQBCRKSA-N	442.915	1.610	50	20	IDGD	
COc1ccc([C@H](O)C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)Br)C3)cc1	1792715526	JXIMSVDGMXLFOZ-YIUHCBHRSA-N	441.322	1.102	50	20	IDGD	
COc1ccccc1C(=O)N1CC(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](O)CCl)C1	1793105922	GVJCFEARNFYVON-KYHPRHEASA-N	449.935	1.005	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc[nH]n1	1793739331	IFZOEMPNYPRNST-BTTYYORXSA-N	427.417	1.809	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CSc1ccncc1	1793949995	FEJYURKRJDDORQ-YXPYIKCWSA-N	442.379	1.937	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnc[nH]1	1795069758	SRZPMVQUOOBOEM-BTTYYORXSA-N	427.417	1.809	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H]1CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Cl	1796365480	XRSHWXZDEKUKSO-AEKWLRTRSA-N	447.935	1.900	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cn(C)cc1C(F)(F)F	1796678718	KPZHSCHMGZTERI-JLUCKKNBSA-N	437.846	1.501	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C[C@H]1CNc2ccccc2O1	1797676916	QNGNLKDTEMZYRR-GEYWLOKFSA-N	447.608	1.691	50	20	IDGD	
COc1cc(C)cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)c1	1798441780	JVAKUJWHQBVJNN-BJWYYQGGSA-N	437.500	1.568	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(F)nc1C	1799001721	XTXDQIARKGTCSZ-LCFLCXBCSA-N	440.479	1.915	50	20	IDGD	
COc1ncc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Br)cc1C	1799347363	GYIPTCPUPRACII-XJFOESAGSA-N	430.274	1.292	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc2ccnn12	1799905085	PKXMEDONAQNSJN-IARIHHJXSA-N	435.322	1.711	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc3ccc(F)cn13)C2	1800762411	RVHAMPZSCGFOBJ-OVZMXSCWSA-N	439.285	1.460	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)C2CC(F)(F)C2)[C@@H]1c1cccnc1	1802639543	DSQQYZAAHNGBLJ-BEFAXECRSA-N	437.491	1.506	50	20	IDGD	
CC[C@@H](NC(C)=O)C(=O)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@@H]1c1cccnc1	1802882300	NOGGUPSJMVHILA-JJXSEGSLSA-N	443.317	1.693	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccnc3c2OCO3)[C@H]1c1cccnc1)[C@@H](O)CCl	1803140796	IHNCYMFLBQCEDX-BPUTZDHNSA-N	432.864	1.125	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)n1ccccc1=O	1803142829	KEOONVVIYYVIGO-MYZZLAAOSA-N	432.908	1.110	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cnc3ncccn23)[C@H]1c1cccnc1)[C@H](O)CCl	1803143189	WKLPHUJJNRBOTG-UAGQMJEPSA-N	428.880	1.044	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cnn3cccnc23)[C@H]1c1cccnc1)[C@H](O)CCl	1803143301	ZSFAFJYAZWRHGD-UAGQMJEPSA-N	428.880	1.044	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1(F)CN(C(=O)OC(C)(C)C)C1	1804552969	AHMZELKOQVIKGE-LXTVHRRPSA-N	447.935	1.837	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC2(CCN(C(=O)[C@@H]3CCCS3(=O)=O)CC2)C1	1805388908	IRAGCUMFPLSYDD-GJZGRUSLSA-N	449.411	1.826	50	20	IDGD	
CN1Cc2ccccc2C[C@H]1C(=O)N1CCC2(CCCN(C(=O)[C@@H](O)CCl)C2)CC1	1805518186	PTCPMUFKPPECDD-PMACEKPBSA-N	433.980	1.874	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H](CNC(=O)Cn2nccn2)[C@H]1c1cccnc1	1808959391	DYNAKUYRVLUCIO-HLLBOEOZSA-N	435.326	1.553	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)[C@@H]2[C@@H]3C=CS[C@@H]23)[C@H]1c1cccnc1	1813073800	MJHBTUFHGXFYLF-ZNRKGROKSA-N	443.573	1.336	50	20	IDGD	
Cn1cc(CC(=O)NC[C@@H]2CCN(C(=O)CO[Si](C)(C)C)[C@@H]2c2cccnc2)cn1	1813457135	JXDOSMIWWUPDPK-GHTZIAJQSA-N	429.597	1.915	50	20	IDGD	
COC1(CC(=O)N[C@@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)CCC1	1815347849	SKQYYUPECGWJPR-OAHLLOKOSA-N	443.334	1.008	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)C(C)(C)C#N)CC2	1817276471	TZHFFNODHSEIAE-BUGPSZFBSA-N	441.517	1.739	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](O)CCl)CC2)c1ccc2cnccc2n1	1818189258	RESQAYRNZJMRIP-NHYWBVRUSA-N	431.905	1.912	50	20	IDGD	
COc1ccnc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)c1	1819765572	FEZPWTMPJJHPIV-IBGZPJMESA-N	449.276	1.113	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc[nH]3)sc2C1	1820283592	VWZUQFFUBWIRKM-SNVBAGLBSA-N	425.474	1.009	50	20	IDGD	
CC[C@@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc3n(n2)CCNC3=O)[nH]n1	1820854257	PPTDCQPTCHFTHS-BXUZGUMPSA-N	433.900	1.673	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1)c1ccccc1-n1nccn1	1821203621	CZWYLLKLQOQJFE-DLBZAZTESA-N	443.895	1.896	50	20	IDGD	
COc1cccc(OC)c1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](O)CCl)CC2	1821941728	UGUKLEUKXYFERP-JQWIXIFHSA-N	439.921	1.986	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H]2CNC(=O)C2)n[nH]1	1821962352	ROEMZLNWKHBUSE-GVXVVHGQSA-N	426.315	1.711	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CNC(=O)N(C)C)CC1	1824090283	ZYEXKAMXMACLPK-ZBFHGGJFSA-N	445.402	1.908	50	20	IDGD	
O=C(c1ccc2nc(CO)[nH]c2c1)N1CCC([C@@H]2CCCCN2C(=O)[C@H](O)CCl)CC1	1824182805	LEQNICCHJGEIHR-RBUKOAKNSA-N	448.951	1.888	50	20	IDGD	
Cc1ncc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)cn1	1825703966	XZZXVVFEFXDVOK-IBGZPJMESA-N	430.553	1.391	50	20	IDGD	
CC(C)(C)OCC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827050049	FSBNAVDKZFKCRK-FQEVSTJZSA-N	430.354	1.415	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(C)=O)CCN2C(=O)OCc2ccccc2)C1	1828894070	BMMRRNXSPTULBR-WIYYLYMNSA-N	437.924	1.712	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cscn2)CC1	1828925953	UYJDCVPYYMODFB-SFHVURJKSA-N	442.545	1.689	50	20	IDGD	
COC[C@H](NC(C)=O)C(=O)N1CCC([C@H]2CCCCN2C(=O)CO[Si](C)(C)C)CC1	1829102855	OZNQNNKMVXYFOT-RBUKOAKNSA-N	441.645	1.609	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CC[C@@H](N)C(N)=O)CC1	1830315782	DTKMGEUIDMRAJD-VCBZYWHSSA-N	435.396	1.435	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4[nH]ccc4n3)C2)C1	1830362416	WGJDGNWZBOWVGK-NRFANRHFSA-N	434.924	1.898	50	20	IDGD	
C[C@H](Cc1ccc(F)cc1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1830735507	HVCZTVLLBVBYPJ-YWMUFLPLSA-N	442.915	1.060	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C13CC(F)(C1)C3)CCO2	1831592806	JSVAACAHTREFBA-RXOFBLNVSA-N	433.318	1.509	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)C[C@@H]2CCCCO2)CC1	1831871659	WAOMKGBDJDENHV-PMACEKPBSA-N	436.597	1.938	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(O)cc2)CC1	1831874255	KZNKPHRDFGRJEB-FQEVSTJZSA-N	430.549	1.999	50	20	IDGD	
Cc1cccc(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)n1	1832614904	HOTZJSFFFBMQTH-QFIPXVFZSA-N	449.624	1.631	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)CCCC(F)(F)F)CC2)CC1)[C@@H](O)CCl	1833308664	ZUXRDAMGQCUKGI-HNNXBMFYSA-N	427.895	1.890	50	20	IDGD	
O=C([C@H](F)Cl)N1CCC(N2CCC(NC(=O)C(F)(F)C(F)(F)C(=O)O)CC2)CC1	1833660777	LDBJAFUQWRHZOU-NSHDSACASA-N	449.804	1.448	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)CNC(C)(C)C)CC2)CC1	1834699905	NAYKTAMEWOERAO-AWEZNQCLSA-N	431.419	1.730	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(CN(C(=O)CC(C)(C)C)CCO2)C1	1834781314	HEAVVBVHZNKDFJ-OLCUMFGGSA-N	447.536	1.013	50	20	IDGD	
O=C(CC[C@@H]1CCOC1)N1CCOC[C@]2(C1)CN(C(=O)CCBr)CCO2	1834826863	ZFONXPCOEYWZLS-QAPCUYQASA-N	433.343	1.045	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)CCC(F)(F)F)CCO2)C1	1835319132	ODMCEAMZUDYBFR-IUODEOHRSA-N	445.276	1.816	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1nccc3occc13)CCO2	1836291807	GKIMVJMATSLRJY-OAQYLSRUSA-N	447.564	1.749	50	20	IDGD	
C[Si](C)(C)c1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)co1	1837424362	VGFPSBADPZINKH-YJBOKZPZSA-N	432.952	1.429	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CC[C@H]3CCOC3)C2)C1	1839967703	VGJGLLBYXDYSPX-TXPKVOOTSA-N	447.370	1.433	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc([N+](=O)[O-])o3)C2)C1	1840029375	BYRLXFSIDNUOFT-MEDUHNTESA-N	446.254	1.041	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cccc(F)c3)C2)C1	1840032374	WVEGVWDCCOMVTH-IFXJQAMLSA-N	443.313	1.608	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H]3CCc4nc[nH]c4C3)CCO2)C1	1840359959	UQWDPTXFWMPOQR-QVKFZJNVSA-N	438.956	1.236	50	20	IDGD	
COc1ccc(Cl)c(C(=O)N2CC3(CCCN3C(=O)c3ccc(B(O)O)cc3)C2)c1	1843012587	CUQYJNLEDBEMTM-UHFFFAOYSA-N	428.681	1.159	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](C(=O)N1CCCC12CN(C(=O)[C@H](O)CCl)C2)C(C)(C)C	1843323001	OQUDTYVNGFSLDN-ZIAGYGMSSA-N	431.961	1.729	50	20	IDGD	
COC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)[C@@H](C)Br)C2	1843384902	NTGXWPOYTMZFHX-OLZOCXBDSA-N	448.358	1.513	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1c(F)cccc1F)C2	1843416558	XPOJVUAWUYGMOV-DHRITJCHSA-N	429.427	1.916	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)c2nc3c(=O)[nH]c4ccccc4n3n2)C1	1843809582	ZKBJBGRLFHUGQJ-LBPRGKRZSA-N	428.880	1.405	50	20	IDGD	
O=C(COc1cccc2ccccc12)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cccc(B(O)O)c1	1848059224	JNQIZCMDVHNMLT-VXKWHMMOSA-N	444.296	1.414	50	20	IDGD	
O=C(NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12)c1ccc2n[nH]nc2c1	11325086	MCGBJLKCISKNRT-UHFFFAOYSA-N	439.435	1.791	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cnc3cc(C)nn3c2C)c1	27800833	CGTQJZGBPVPGQB-UHFFFAOYSA-N	444.517	1.451	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)c1ccc(C)cc1)C(=O)NNC(=S)NC(C)(C)C	726135420	KNDKTFONVJVEIP-CQSZACIVSA-N	432.637	1.689	50	20	IDGD	
CC(C)(C)NC(=S)NNC(=O)CN1C(=O)N[C@@](C)(c2ccc3ccccc3c2)C1=O	726138658	TUWQXMRJHPARPL-NRFANRHFSA-N	427.530	1.901	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccc(Cl)cc2F)CC1)NNC(=O)c1ccc(F)cc1	727154932	VMYHJRZLKIIPPS-UHFFFAOYSA-N	436.846	1.837	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c(N)c([N+](=O)[O-])c1	727765556	LEABLPMOABNYOQ-UHFFFAOYSA-N	447.473	1.345	50	20	IDGD	
COc1ccc([C@@]2(C)NC(=O)N(CC(=O)NNc3nc(-c4ccccc4)no3)C2=O)cc1	728080206	KGDROMYHFJQTEW-OAQYLSRUSA-N	436.428	1.656	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3c[nH]nc3-c3ccccc3)cc2)CC1	728213385	AUBIDPINTQQYKS-UHFFFAOYSA-N	440.529	1.770	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)/C=C\c1ccccc1)C(=O)NNC(=O)Cc1cccnc1	728893378	JQVLRADBMXYFHP-ADYSOMBNSA-N	448.570	1.484	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)N1CCN(S(=O)(=O)c2ccc(Cl)s2)CC1	728957064	IDEBVPJDZUCBRU-UHFFFAOYSA-N	443.938	1.086	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)NCCCN1C(=O)NC2(CCCC2)C1=O	729494811	FCQKUZSUZDWCRG-UHFFFAOYSA-N	426.477	1.226	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNS(=O)(=O)c2ccc(C)cc2F)cc1	729662315	KUMLYNIYIJGEOG-UHFFFAOYSA-N	429.495	1.073	50	20	IDGD	
CCOC(=O)C1=NN(c2ccccc2)[C@@H](C(=O)NNC(=O)COc2ccccc2O)C1	730835943	NECQTVXMHNUGHX-MRXNPFEDSA-N	426.429	1.116	50	20	IDGD	
CC(C)(C(=O)NNC(=O)[C@H]1CCCN1C(=O)/C=C/c1ccc(C(N)=O)cc1)c1ccccc1	731176236	LRVGIJJKBHNVKX-IZLCOFNUSA-N	448.523	1.915	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)CCc1c(C)nc(N2CCOCC2)nc1O)c1ccccc1	731999086	LJJFXPBMYNLYOL-KRWDZBQOSA-N	427.505	1.601	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)[C@H](NS(=O)(=O)c1ccc2ccccc2c1)C(C)C	732083297	ZKBNAZVIEIUWOY-GOSISDBHSA-N	429.502	1.635	50	20	IDGD	
Cn1cc(-c2ncc(C(=O)OCC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)s2)cn1	732685906	YRAAIMFUCQIBNT-UHFFFAOYSA-N	430.402	1.070	50	20	IDGD	
C[C@H]1CCCC[C@@H]1OCC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	733088724	VGXFWLSUWKYKTQ-YJBOKZPZSA-N	439.534	1.064	50	20	IDGD	
Cn1c(NNC(=O)c2ccc(F)c(S(=O)(=O)NC(C)(C)C)c2)nc2ccccc2c1=O	733261120	KYLZUVXOKZYMMX-UHFFFAOYSA-N	447.492	1.906	50	20	IDGD	
Cn1c(NNC(=O)CN2C(=O)Cn3c(cc4ccccc43)C2=O)nc2ccccc2c1=O	733263124	IXJNEOZCIFFWER-UHFFFAOYSA-N	430.424	1.014	50	20	IDGD	
CCOCCCn1c(NNC(=O)c2c(OC)ncnc2OC)nc2ccccc2c1=O	733268078	JEJFDMHOHYICBF-UHFFFAOYSA-N	428.449	1.387	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)[C@@]2(O)CCN(Cc3ccccc3)C2)c2ccccc2c1=O	733885277	WXSIWZOLAMIIPG-XMMPIXPASA-N	449.511	1.375	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)c1ccc2c(c1)C(=O)N(C[C@@H]1CCCO1)C2=O	737636748	DNJZGRHIFOXGJF-KRWDZBQOSA-N	437.452	1.439	50	20	IDGD	
Cc1cc(NNC(=O)c2cc(C)c3c(=O)n(C)c(=O)n(C)c3n2)ccc1Br	738540943	QBZXPXCXPBWFPH-UHFFFAOYSA-N	432.278	1.768	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(=O)n(CC(=O)NNc2cccc(C(F)(F)F)n2)c1	740136680	XPCOKPURZCWTRN-UHFFFAOYSA-N	447.439	1.436	50	20	IDGD	
O=C(COC(=O)Cc1ccc(S(=O)(=O)C(F)F)cc1)NNC(=O)c1ccccc1	740998967	XNIUIHAZTCTCFJ-UHFFFAOYSA-N	426.397	1.230	50	20	IDGD	
Cc1cc(O)c(C(=O)O)cc1S(=O)(=O)NNC(=O)c1cccc(Br)c1	743263329	COVJRWQXEKGKSF-UHFFFAOYSA-N	429.248	1.785	50	20	IDGD	
COc1ccc(O[C@H](C)CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1	743510154	QORDGELQIZVJGF-CYBMUJFWSA-N	435.506	1.400	50	20	IDGD	
CC[C@@](C)(O)CNC(=O)/C(C#N)=C/c1cn(CCC(N)=O)nc1-c1ccc(OC)cc1	743760937	QSJRTYJPFYAPTC-UPMCQBDUSA-N	425.489	1.618	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)c2cc(N3CCOC3=O)ccc2F)c1	745133855	GHWWLRCWAFNVQZ-UHFFFAOYSA-N	426.360	1.272	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)C[C@H]2CCCN2C(=O)OC(C)(C)C)n1	745455021	WEYUTDKXPDENHW-CYBMUJFWSA-N	440.522	1.474	50	20	IDGD	
COCCOc1ccc(-n2nc(C)c(C(=O)NNC(=O)Cc3cn4ccccc4n3)n2)cc1	746548516	IXNNOJCYHPDBMY-UHFFFAOYSA-N	449.471	1.252	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNc3cc(F)c(F)c(F)c3)CC2)cc1	746699364	BFTJIERDFQOUAS-UHFFFAOYSA-N	442.463	1.862	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NCC2(OC)CCOCC2)c2ccccc2c1=O	747449673	SOFCFRXEHDIOKL-UHFFFAOYSA-N	431.493	1.336	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)NNC(=O)Cc3cn4ccccc4n3)cc2C1	747490260	HHPYXYFJBHUYGM-LBPRGKRZSA-N	426.502	1.739	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)CSCC(=O)c2ccccc2)c1	748544264	HQMOIKVBUKPZRC-UHFFFAOYSA-N	435.527	1.314	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(=O)n(CC(=O)NNc2cccc3c2CCCC3)c1	748578022	UDQZGOLVFIIIJG-UHFFFAOYSA-N	432.546	1.901	50	20	IDGD	
O=C(O)CCCOc1ccc(S(=O)(=O)NNC(=O)c2ccc3c(c2)OCO3)cc1F	751266525	GPPIDTAOFMNPTP-UHFFFAOYSA-N	440.405	1.421	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)Cc3cnn(C)c3)c2)cc1	751281510	QXUQIGDWXYYWIR-UHFFFAOYSA-N	443.485	1.233	50	20	IDGD	
Cn1c(C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)ccc1-c1ccc(Br)cc1	751302916	NZDQXTZGPYVSAU-LBPRGKRZSA-N	440.319	1.650	50	20	IDGD	
CSCCNC(=S)NNC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(C)cc2)C1	752731040	SXKNFPZPVJODBE-CQSZACIVSA-N	430.621	1.254	50	20	IDGD	
COc1cc(NC2CCN(CC(=O)NNC(=O)c3ccc(C#N)cc3)CC2)cc(OC)c1	754665223	CCQDBAYSENBGLY-UHFFFAOYSA-N	437.500	1.913	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccc(C(=O)NC)cc2)c1	755499855	MQUFLGHMQYKFOU-UHFFFAOYSA-N	447.517	1.543	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)Nc1ccc(F)c(-n2nnnc2C2CC2)c1	756780537	ZFEUTSVTGZCELG-UHFFFAOYSA-N	436.407	1.782	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(F)(F)[C@H](C(=O)NNC(=O)[C@H]2COc3ccccc3O2)C1	757758322	AKBSUPQVGZIBDJ-SWLSCSKDSA-N	441.431	1.866	50	20	IDGD	
NC(=O)[C@@H](Cc1ccccc1)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	758138956	NPGOEKZWLGRPDM-LJQANCHMSA-N	430.530	1.192	50	20	IDGD	
Cc1nn(-c2ccccc2)c2sc(C(=O)NNC(=O)NC[C@H]3CC[C@@H](C(N)=O)O3)cc12	760204311	QHZSJVASYFQLDM-HIFRSBDPSA-N	442.501	1.372	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)c2ccccc2c1=O	760346254	WTUMQXFTOSOMBQ-UHFFFAOYSA-N	443.504	1.882	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	760799541	OKBILPWSVVAPJL-OAHLLOKOSA-N	449.464	1.262	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)N[C@@H]2CCN(C(=O)C3CCCC3)C2)cc1	762377929	GZIFQWLVQDACJE-NVXWUHKLSA-N	432.521	1.974	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)N[C@H]1CCCN(c2ccccc2F)C1	762574314	BIWLRFVCYVGACA-KRWDZBQOSA-N	441.511	1.832	50	20	IDGD	
O=C(NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)NC1Cc2ccccc2C1	763159063	SATCVQZGTWXHJO-UHFFFAOYSA-N	428.514	1.583	50	20	IDGD	
O=C(NNC(=O)c1ccncc1)C(=O)Nc1cccc(COCC(F)(F)C(F)F)c1	763464194	MKVOWMKZOFSVEZ-UHFFFAOYSA-N	428.342	1.898	50	20	IDGD	
C[S@@](=O)Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)ccc1Cl	763557746	DKXQFCDKCHMLOQ-GDLZYMKVSA-N	437.861	1.347	50	20	IDGD	
CC(C)Oc1c(F)cc(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1F	763572571	SAVCTFACXDNWKY-MRXNPFEDSA-N	435.383	1.678	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)[nH]n1)C(=O)Nc1cccc(N2CCCCC2=O)c1	763605668	PTCXFRMDNOGZRG-UHFFFAOYSA-N	446.467	1.993	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(C)c(C(=O)N(C)C)c2)c2ccccc2n1	763614538	GFTGZCOBWXHUCC-UHFFFAOYSA-N	433.468	1.953	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(F)c(Br)c2)cc1	763659733	PLHYYNWEDOIVAS-UHFFFAOYSA-N	440.225	1.762	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cc(-c3nnco3)ccc2C)cc1	763660626	DHIHUCKKUDMTTK-UHFFFAOYSA-N	425.401	1.219	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2cnc(Br)cc2C)c1	763664866	KRQRSHLMSYATPT-UHFFFAOYSA-N	435.278	1.934	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccnn1C1CCN(CC)CC1	763716527	IJCNNFAKEAEOGE-UHFFFAOYSA-N	442.520	1.267	50	20	IDGD	
O=C(CN1CCCc2ccccc21)NNC(=O)C(=O)Nc1ccc(CN2CCCC2=O)cc1	763746316	SFVSFEBFLKDUDN-UHFFFAOYSA-N	449.511	1.348	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(S(C)(=O)=O)c2)cc1	763768854	URBMDUFEFRNTSO-UHFFFAOYSA-N	447.513	1.915	50	20	IDGD	
C#Cc1cccc(NC(=O)C(=O)NNC(=O)c2nn(CCCC)c(=O)c3ccccc23)c1	763801502	UIEPZRZCUBUQBF-UHFFFAOYSA-N	431.452	1.578	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(NC(=O)CCN(C)C)cc2)cc1	763808756	FLJJIIFWCZEYMK-UHFFFAOYSA-N	441.488	1.050	50	20	IDGD	
CC(=O)N(Cc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)cc1)C(C)C	763841926	VCPULHKDEDHXAW-UHFFFAOYSA-N	444.463	1.748	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cnn(-c3ccccn3)c2)cc1	763860481	HKPSULDTTWIHQD-AWEZNQCLSA-N	438.444	1.219	50	20	IDGD	
CN(C)C1CCN(c2ccc(NC(=O)C(=O)NNC(=O)Cc3ccc(F)cc3)cc2)CC1	763921164	RIAWJCHDUCSWBE-UHFFFAOYSA-N	441.507	1.685	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)C(=O)Nc1ccc(OC(F)F)cc1	763950905	WPDVVTYAMPPJPY-UHFFFAOYSA-N	431.355	1.579	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(Br)cn2C)c(F)c1	764003050	XEKLPRDPRVALAL-UHFFFAOYSA-N	441.213	1.113	50	20	IDGD	
O=C(Cc1ccsc1)NNC(=O)C(=O)Nc1cccc(C(=O)N2CCSCC2)c1	764033153	HDJPTRDXMWUXMR-UHFFFAOYSA-N	432.527	1.266	50	20	IDGD	
C[C@H]1Oc2ccc(NC(=O)C(=O)NNC(=O)Cc3cccc4ccccc34)cc2NC1=O	764035792	IGCJZBGGTPWFQF-CYBMUJFWSA-N	432.436	1.888	50	20	IDGD	
O=C(NNC(=O)C1CCCC1)C(=O)Nc1cc(N2CCCS2(=O)=O)ccc1Cl	764067110	YCURYQFACCVCLG-UHFFFAOYSA-N	428.898	1.156	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)C(=O)Nc2ccc(NC(C)=O)cc2)c1	764231330	HFJLWIFIMOEVIK-UHFFFAOYSA-N	449.261	1.816	50	20	IDGD	
Cc1cc(C(=O)N2CCC(C)CC2)ccc1NC(=O)C(=O)NNC(=O)c1c[nH]nc1C	764294770	BGGFNRBYBPXMJY-UHFFFAOYSA-N	426.477	1.298	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)c1cccc(OCc2cn3ccccc3n2)c1	764344846	JUGFNPNBUMRPGT-UHFFFAOYSA-N	444.451	1.499	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3ccc(O)c(Cl)c3)cc2)CCO1	764349342	JRJXIPVJVHYMTL-LBPRGKRZSA-N	432.864	1.670	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)C(=O)Nc1ccnn1Cc1ccccc1F	764350721	JBIKFGVYCWKXOA-UHFFFAOYSA-N	447.430	1.656	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)C(=O)N1C[C@H]2CCCN2c2ccccc21	764352064	YYHPQILCJUVEDY-GOSISDBHSA-N	430.468	1.649	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3nn(C(C)(C)C)cc3C#N)n[nH]2)cc1	764384953	OGLHKAUVHIZRCC-UHFFFAOYSA-N	448.487	1.862	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cccc(OCC#N)c3)n[nH]2)cc1	764385107	RGYNHHWYZXTTCR-UHFFFAOYSA-N	432.440	1.941	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(C)cc1-c1nc(C2CC2)no1	764398399	HACHVTUEDIZAFR-LBPRGKRZSA-N	431.449	1.060	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@H]2CN(C(=O)OC(C)(C)C)CCO2)cc(OC)c1OC	764514669	SLECRQDFKIIWFF-OAHLLOKOSA-N	439.465	1.109	50	20	IDGD	
N#C/C(=C\c1cn(CCC(N)=O)nc1-c1cccc(Br)c1)C(=O)N1CC(O)C1	765855516	YCRJVODUCJRRNU-AWNIVKPZSA-N	444.289	1.298	50	20	IDGD	
COc1cc(C#N)ccc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccc(C)c(C)c2)[nH]n1	766261066	ZBKLVYFONNJLGP-UHFFFAOYSA-N	432.440	1.974	50	20	IDGD	
NC(=O)COc1ccc(Cl)cc1S(=O)(=O)NNC(=O)c1cccc(OC(F)F)c1	766322524	QRLAJIMYGCLHKA-UHFFFAOYSA-N	449.819	1.429	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)c1cc(F)cc2nc[nH]c12	766664557	RTIKWAHHGHLBPE-UHFFFAOYSA-N	444.898	1.934	50	20	IDGD	
COc1cc(OC)cc(N2CCCN(CC(=O)NNC(=O)Cc3ccccc3C)CC2)c1	766940815	DGKAXJANUUTGHU-UHFFFAOYSA-N	440.544	1.914	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)CCC(=O)N1CCN(c2ccccn2)CC1	767733586	DUKMQQYRYCNIRZ-UHFFFAOYSA-N	439.516	1.299	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)c2ccc([C@@]3(C)NC(=O)NC3=O)cc2)n[nH]1	768274178	PQRUURANFYRRQV-JOCHJYFZSA-N	448.439	1.215	50	20	IDGD	
CN(C)c1ccc(NC(=S)NNC(=O)c2nccc3c(S(N)(=O)=O)cccc23)cc1	768477542	DUEHZGLOMDRDOP-UHFFFAOYSA-N	444.542	1.580	50	20	IDGD	
CCOC(=O)c1[nH]c(C)c(C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c1C	769130331	YWJKQTAXGPTNGM-UHFFFAOYSA-N	432.389	1.334	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1cc(F)cc(Cl)c1O	769150705	MJNMIXNHHGSLNA-UHFFFAOYSA-N	429.857	1.963	50	20	IDGD	
Cn1c(=NNC(=O)CCC(=O)Nc2ccc3c(n2)n(C)c(=O)n3C)sc2ccccc21	769474750	PWCUHPBBLUEVOO-UHFFFAOYSA-N	439.501	1.176	50	20	IDGD	
N#C/C(=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)O[C@H]1CCNC1=O	769952080	VCVBFPAHWSBIQN-WQMJKPAKSA-N	427.848	1.418	50	20	IDGD	
CCc1c(C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cnn1-c1ccc(OC)cc1	770209216	SHLUZWHKXZXECG-UHFFFAOYSA-N	446.467	1.765	50	20	IDGD	
COc1cc2c(c(OC)c1OC)CCN(CC(=O)NNC(=O)c1ccc(C#N)cc1)CC2	770250234	CEVVEHKUUCYYKE-UHFFFAOYSA-N	438.484	1.446	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)c3nc(S(C)(=O)=O)n4ccccc34)nc21	770965970	PAMCJYAVMCMXJA-UHFFFAOYSA-N	444.477	1.095	50	20	IDGD	
Cc1cc(C(=O)O)c(F)c(S(=O)(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)c1	771605176	QAJDWJSTJJUDNK-UHFFFAOYSA-N	443.840	1.112	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)[C@@H]1CCCN1C(=O)c1ccc(Br)cc1	772066653	ZRWCSRPDRLJWNT-FZMZJTMJSA-N	440.294	1.543	50	20	IDGD	
COc1ccc([C@H](OC)[C@H](C)NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1	772076497	KZSQXYDOHNZMAK-SCLBCKFNSA-N	435.502	1.819	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cn(C)nc2-c2ccccc2)c1	772559366	ZCCMMMQPAVCLJU-UHFFFAOYSA-N	427.486	1.412	50	20	IDGD	
Cc1cc(S(=O)(=O)NCCNC(=O)NNC(=O)c2c[nH]c3ccccc23)c(C)s1	772623448	GFIRPQASLKNXBR-UHFFFAOYSA-N	435.531	1.769	50	20	IDGD	
COC(=O)Cn1cc(C(C)=NNC(=O)c2ccc(CSc3nncn3C)cc2)nn1	772830071	GWJMSKIOIJSFFK-UHFFFAOYSA-N	428.478	1.026	50	20	IDGD	
CCOc1ccc2c(c1)[C@H](NC(=O)NNC(=O)C1CCN(c3ncccn3)CC1)CCO2	773273501	OFXLPEGYKASRKX-GOSISDBHSA-N	440.504	1.946	50	20	IDGD	
Cc1ccc([C@](O)(CC(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)C(F)(F)F)o1	773594880	QAFMMIVPUAMGTH-QGZVFWFLSA-N	447.797	1.845	50	20	IDGD	
O=C(NNc1ccc2ccccc2n1)C(=O)Nc1ccc(CC(=O)N2CCOCC2)cc1	773654269	BFOGJDREIMDWQP-UHFFFAOYSA-N	433.468	1.718	50	20	IDGD	
O=C(NNc1cccc(Cl)c1)C(=O)N1C[C@H](C(=O)N2CCOCC2)Oc2ccccc21	773741940	YFHOVQMWLBRDTK-GOSISDBHSA-N	444.875	1.436	50	20	IDGD	
O=C(CSc1nnc(O)nc1O)NN=C1CCOc2cc(Br)ccc21	774589632	JQRZHQBJZBNLHA-UHFFFAOYSA-N	426.252	1.440	50	20	IDGD	
CC(C)(C)c1ccc(OCC(=O)NNC(=O)Nc2ccnn2[C@H]2CCS(=O)(=O)C2)cc1	776053464	CTJKKCSETVFOAO-HNNXBMFYSA-N	449.533	1.772	50	20	IDGD	
CN(NC(=O)CN1C(=O)CCc2ccccc21)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776213611	PQGVNHSYDRXRGW-UHFFFAOYSA-N	445.520	1.602	50	20	IDGD	
O=C(COC(=O)[C@@]1(F)CCN(C(=O)OCc2ccccc2)C1)NNC(=O)c1ccccc1	777233141	FACQHRARNPOGFS-JOCHJYFZSA-N	443.431	1.742	50	20	IDGD	
Cc1nc(O)c(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1Br	778293308	VZUNLJPMLDUHEN-UHFFFAOYSA-N	442.295	1.226	50	20	IDGD	
COCCN1C(=O)CCc2cc(NC(=O)C(=O)NNC(=O)Cc3ccccc3F)ccc21	778715496	YMIXEYQRSZQHLU-UHFFFAOYSA-N	442.447	1.080	50	20	IDGD	
O=C(NNC(=O)[C@@H](O)Cc1cccc(C(F)(F)F)c1)c1nn(-c2ccccc2)cc1O	779370977	MIPDCIDVLVSAGJ-HNNXBMFYSA-N	434.374	1.961	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)c1cccc2c1CCCN2C(=O)OC(C)(C)C	779378231	YSDPDAIEEDCWSS-GFCCVEGCSA-N	440.522	1.073	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NC[C@@H]1CC(=O)N(C2CC2)C1	780887316	OXXVHKGWBBLADF-RYUDHWBXSA-N	439.310	1.558	50	20	IDGD	
COc1cccc(NNC(=O)C2CCN(S(=O)(=O)c3ccc(F)c(F)c3)CC2)n1	781027400	QALIWFVZXLXNHJ-UHFFFAOYSA-N	426.445	1.912	50	20	IDGD	
CN(C)C(=O)COc1ccc(NC(=O)C(=O)NNc2ccc(Br)cc2)cc1	783006474	WIBUASYTZVFFFY-UHFFFAOYSA-N	435.278	1.998	50	20	IDGD	
CN1CC(=O)N(c2cccc(NC(=O)C(=O)NN=c3sc4ccccc4n3C)c2)C1=O	783349247	GOGQCXLIFTYDMP-UHFFFAOYSA-N	438.469	1.209	50	20	IDGD	
COc1cccc(Oc2ccc(NC(=O)C(=O)NN[C@@]3(C)CCS(=O)(=O)C3)cc2)c1	783424981	HAQRYRRCTPWSKS-FQEVSTJZSA-N	433.486	1.624	50	20	IDGD	
COC(=O)[C@@H]1CCCCN1C(=O)c1cccc(NC(=O)C(=O)NNc2ccnc(F)c2)c1	784848689	LYHKFTPGKXKKGF-INIZCTEOSA-N	443.435	1.470	50	20	IDGD	
CN(C)C(=O)Cn1cc(NC(=O)C(=O)NNc2c(F)cc(F)cc2Br)cn1	785011050	OAVZAGIPGDUPMS-UHFFFAOYSA-N	445.224	1.094	50	20	IDGD	
CCNC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)COc2cc(C)cc(C)c2)c1C	789731930	KVWAPTFSMKKMHT-UHFFFAOYSA-N	441.488	1.918	50	20	IDGD	
COc1ccc(OC)c(C2=NO[C@@H](C(=O)NNC(=O)[C@H](C)Oc3ccc(F)cc3)C2)c1	792020011	CJBTYGNRXJYWRI-HXPMCKFVSA-N	431.420	1.951	50	20	IDGD	
COc1ccc(Br)cc1C(=O)CCC(=O)N([C@@H]1CCS(=O)(=O)C1)N(C)C	792851470	WWQFJNXYGHLGRZ-CYBMUJFWSA-N	447.351	1.913	50	20	IDGD	
CC(C)OCCCn1c(NNC(=O)c2ccoc2CC(N)=O)nc2ccccc2c1=O	796440687	BFYMPQTVUSANGG-UHFFFAOYSA-N	427.461	1.589	50	20	IDGD	
CO[C@H](C)c1cccc(NC(=O)C(=O)NNC(=O)CNC(=O)OCc2ccccc2)c1	797368999	LKXHJGFDASRPHX-CQSZACIVSA-N	428.445	1.406	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(CC(=O)N(C)c3ccccc3)cc2)n1	797370582	GVSWBAMVSCYPKP-UHFFFAOYSA-N	445.479	1.995	50	20	IDGD	
CCn1cc(C(=O)N2CCN(S(=O)(=O)CBr)CC2)c(C(F)(F)F)n1	797973062	MQVHCLGSIFEDHT-UHFFFAOYSA-N	433.250	1.362	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)c1ccc(C)cc1)C(=O)NNC(=O)NCC(F)(F)F	798314969	JCDWSMSOOAWDBR-LBPRGKRZSA-N	442.485	1.288	50	20	IDGD	
CCN(CC)S(=O)(=O)CC(=O)NNC(=O)Nc1ccc(Br)cc1Cl	802042217	BROVKLIBKGVARZ-UHFFFAOYSA-N	441.735	1.927	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)N2CCc3cc(F)ccc32)cc1Br	802567677	VANDIKBWVDFXGR-UHFFFAOYSA-N	436.237	1.947	50	20	IDGD	
COCCNC(=O)[C@@H](C)OC(=O)c1ccc(NC(=O)NNC(=O)c2ccccc2O)cc1	806748244	MNJBHJPVVAONQI-CYBMUJFWSA-N	444.444	1.167	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)on1)C(=O)Nc1nc2c(s1)CSCC2	806976924	OOGLIJUDDXIRFV-UHFFFAOYSA-N	429.483	1.987	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)c1cccc(-c2noc(C(F)(F)F)n2)c1	807081884	HUPMSEWXVKBPJY-UHFFFAOYSA-N	434.334	1.341	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NCc2c(F)cccc2N2CCCC2)c2ccccc2c1=O	807409490	BHIBJFILNZDUSG-UHFFFAOYSA-N	438.463	1.817	50	20	IDGD	
CC(=NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1)c1cccc(-n2ccnn2)c1	807949910	MPLLZFALHVXSDU-UHFFFAOYSA-N	426.502	1.737	50	20	IDGD	
Cc1nc(-c2ccccn2)nc(NNC(=O)CNS(=O)(=O)c2ccccc2F)c1C	810407447	GMWAQQVQXMJCMQ-UHFFFAOYSA-N	430.465	1.716	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccc(OCC3CC3)cc2)cc1	813033710	IFKJYGGTETYTHP-UHFFFAOYSA-N	432.502	1.808	50	20	IDGD	
CN(C)c1cc(Br)cc(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1	814408052	DJEAMRKQLOXQBG-UHFFFAOYSA-N	447.337	1.983	50	20	IDGD	
COc1cc(C=NNC(=O)Nc2ccc(S(N)(=O)=O)cc2)c(Br)cc1O	814968811	BUKTXXPRBRFQLK-UHFFFAOYSA-N	443.279	1.966	50	20	IDGD	
CC(C)[C@H](NS(=O)(=O)c1ccc2c(c1)OCCCO2)C(=O)NCCCSC#N	816538593	XJQFUGFDVMPOBP-KRWDZBQOSA-N	427.548	1.871	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCc2nn[nH]c21)c1ccccc1NS(=O)(=O)c1cccs1	816830696	QMWBXFHFXBYMAE-GFCCVEGCSA-N	446.514	1.548	50	20	IDGD	
O=C(NCc1ccc(N2CCCC2=O)cc1)NNC(=O)c1nn(-c2ccccc2)cc1O	840456591	KVLKNLGQMQOACG-UHFFFAOYSA-N	434.456	1.849	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)c1ccccc1F)C(=O)NNC(=O)NC1CCCCC1	913451083	LPCXJRRJXSPWSE-OAHLLOKOSA-N	446.570	1.889	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)NC2CC2)cc1)NNC(=O)Cc1c[nH]c2ccccc12	913471581	JDFIBIBSXFLSDQ-UHFFFAOYSA-N	440.525	1.931	50	20	IDGD	
C[C@@H](Oc1ccccc1Cl)C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	913628105	WFSDCJRXGVLKFG-GFCCVEGCSA-N	425.894	1.819	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)NC2CCN(C(=O)c3ccoc3)CC2)cc1OC	916261525	KTDMAHYNJRJFAJ-UHFFFAOYSA-N	430.461	1.936	50	20	IDGD	
CN1CCN(C(=O)c2ccc(CNC(=O)NNC(=O)c3c[nH]c4ccccc34)cc2)CC1	916390307	IXRGQBFQGVRLAM-UHFFFAOYSA-N	434.500	1.700	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)NC3CC3)c2)ccc1OC(C)C	916558775	QFBQETQRQLNHOU-UHFFFAOYSA-N	447.513	1.998	50	20	IDGD	
COc1ccc(CNC(C)=O)cc1S(=O)(=O)NNC(=O)c1cc(Br)c[nH]1	917730983	GONFUJNZUUPGIP-UHFFFAOYSA-N	445.295	1.045	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1)NC1CCOCC1	918233234	JWKGVNKDFQYDPE-UHFFFAOYSA-N	432.502	1.288	50	20	IDGD	
Cc1ccc(-c2nc(C=NNC(=O)CSc3nn(C)c(=O)n(C)c3=O)cs2)cc1	918710829	GHZIOEPDTUAMDP-UHFFFAOYSA-N	430.515	1.153	50	20	IDGD	
O=C(NNS(=O)(=O)c1cccc(-n2cnnn2)c1)c1ccc(COc2ccccc2)o1	920244018	BWIKLGGNUSUXKH-UHFFFAOYSA-N	440.441	1.458	50	20	IDGD	
C[C@H](C(=O)OCC(=O)NNC(=O)c1ccc(Cl)cc1)S(=O)(=O)c1ccc(F)cc1	920531060	NEPDNVPMFPCEBS-LLVKDONJSA-N	442.852	1.646	50	20	IDGD	
COCCN1CCC(NC(=O)NNC(=O)[C@@H](C)Oc2cccc(Br)c2)CC1	920814225	ILTSCMWPWBPSSV-CYBMUJFWSA-N	443.342	1.658	50	20	IDGD	
CCCNC(=O)NNC(=O)c1ccc(OC)c(S(=O)(=O)N[C@H]2CCCC[C@@H]2C)c1	921041618	FQOYZBPZMVBERG-ZFWWWQNUSA-N	426.539	1.906	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)N[C@H]2CC(=O)N(c3ccccc3)C2)nc1	921124963	ARUDMXZDJZDAFG-AWEZNQCLSA-N	432.506	1.200	50	20	IDGD	
COCC(=O)NCCC(=O)NNC(=O)c1ccc(CSc2nc3ccccc3[nH]2)cc1	1115896361	UFYCBEWXBHPLCL-UHFFFAOYSA-N	441.513	1.769	50	20	IDGD	
Cc1cc(C)nc(SCc2ccc(C(=O)NNC(=O)[C@H](C)N3C(=O)CCC3=O)cc2)n1	1115967639	UWVPLZVHUMTXBZ-AWEZNQCLSA-N	441.513	1.684	50	20	IDGD	
O=C(CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@H]12)NNC(=O)c1cncn1-c1ccccc1	1248474698	LVIXWYOQZNCAOD-ZVZYQTTQSA-N	428.518	1.359	50	20	IDGD	
CCCC(=O)N1CSC[C@H]1C(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1	1251915184	RWHXLEPDATUSNA-AWEZNQCLSA-N	428.555	1.483	50	20	IDGD	
O=C(NCCNS(=O)(=O)c1cccc(Cl)c1)NNC(=O)c1ccccc1Cl	1318115580	KDQWROQSGLNEDJ-UHFFFAOYSA-N	431.301	1.916	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN(S(=O)(=O)Cc2ccccc2)C1)c1n[nH]c2c1CCCC2	1318380969	MMOSDPGYFAKYDI-MRXNPFEDSA-N	445.545	1.292	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)NC1CCN([C@H]2CCCC[C@@H]2O)CC1	1319252864	QBEMRGNPOBXFOB-IRXDYDNUSA-N	428.493	1.047	50	20	IDGD	
Cn1ncc2cc(S(=O)(=O)NNC(=O)c3ccc(COc4ccccc4)o3)cnc21	1320553572	LIBPLGPJLXMMOQ-UHFFFAOYSA-N	427.442	1.764	50	20	IDGD	
N#C/C(=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)NCCN1CC=CC1	1322269453	GMPGNXTUNGOHDW-GHRIWEEISA-N	438.919	1.974	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)Cn2nc3n(c2=O)CCCCC3)c1	1326329308	YHTIDVAGSMQFHK-UHFFFAOYSA-N	438.282	1.004	50	20	IDGD	
COc1ccc(S(=O)(=O)CCC(=O)NNC(=S)NCCc2cccs2)cc1	1327972752	GLYCANQKURXEGH-UHFFFAOYSA-N	427.573	1.659	50	20	IDGD	
Cc1cc(C(N)=O)cc(C)c1C(=O)N1CC[C@@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1779006864	AXSBYZJGIWFONV-JOCHJYFZSA-N	447.608	1.697	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](COC)NC(=O)OC(C)(C)C)CCO2	1781217085	FFTSEKQPBZAUFL-AUSJPIAWSA-N	447.960	1.373	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc4c(c3)CC(=O)N4)CCO2)C1	1781230541	VBRQEVMOVSYDRQ-PMACEKPBSA-N	440.327	1.861	50	20	IDGD	
N#Cc1cc(CC(=O)N2CCO[C@]3(CCN(C(=O)[C@H](F)Br)C3)C2)ccc1F	1781333266	NHPVTBSVAZFQTM-FUHWJXTLSA-N	442.260	1.760	50	20	IDGD	
CC(C)(C)n1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)nn1	1781335164	VAPCCFBNKJWSRD-MLGOLLRUSA-N	432.294	1.167	50	20	IDGD	
N#Cc1ccc(F)c(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)c1	1781965775	WNQYXILRERDWFD-YOEHRIQHSA-N	428.233	1.831	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(C)ccc3-n3ccnn3)C2)C1	1782169604	VFVMUJQTNYIWMJ-LAUBAEHRSA-N	447.923	1.273	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4ccoc4c3)C2)C1	1782327107	AGVLCCZYJPPRAZ-JOCHJYFZSA-N	428.489	1.249	50	20	IDGD	
Cn1nc2c(c1C(=O)N1CC[C@@]3(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO3)CCC2	1782439743	JXPKCLWNDQLYIT-RTBURBONSA-N	429.348	1.589	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(OC(F)F)cn3)CCO2)C1	1783531899	FJCCFAIWAIAIRQ-GTNSWQLSSA-N	448.264	1.910	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)CCOc3ccc(F)cc3)CCO2)C1	1783869062	NJXWYHBOOMGSDV-YLJYHZDGSA-N	428.888	1.678	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cnn(Cc4ccccc4)c3)CCO2)C1	1783877703	NOSZPTOUHHSMAK-KNQAVFIVSA-N	446.935	1.629	50	20	IDGD	
Cc1ccc(CC(=O)N2CCO[C@@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc1C	1783933368	IWXLKOROQBZRFQ-HSZRJFAPSA-N	430.549	1.049	50	20	IDGD	
CCCC(=O)N[C@@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCBr)[C@H]2C1	1786406041	FDZCENWPKFUVLA-AJNGGQMLSA-N	432.359	1.056	50	20	IDGD	
Cn1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCBr)[C@H]3C2)c(C(F)F)n1	1786406773	CTFPRWZSCMYNJG-GVXVVHGQSA-N	449.296	1.736	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc4[nH]ncc4c3)C[C@@H]21	1786406818	HTCBXYNBWWBCCJ-CQDKDKBSSA-N	436.310	1.336	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C3=C4c5ccccc5C(=O)N4CC3)C[C@@H]21)[C@H](F)Cl	1787447964	OPZQEVZSLJHFOL-ZQINRCPSSA-N	447.894	1.771	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(C(F)(F)F)c[nH]3)[C@H]2C1	1787592152	RIMOZCALZFVHLO-DNVSUFBTSA-N	437.846	1.881	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])o3)CCC2)cc1)c1cccc(B(O)O)c1	1788145400	OFMTVSUWWOIATN-UHFFFAOYSA-N	449.228	1.929	50	20	IDGD	
Cc1ccc(C(=O)NC2(c3ccc(NC(=O)c4cccc(B(O)O)c4)cc3)CCC2)c(O)n1	1788148088	ZXNZTUFTBDBLJZ-UHFFFAOYSA-N	445.284	1.837	50	20	IDGD	
Cc1cnc2c(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)C(C)(C)CCl)C[C@@H]43)cnn2c1	1788336954	UORMMTYGMZDYSV-XIRDDKMYSA-N	433.940	1.896	50	20	IDGD	
N#Cc1ccc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]3C2)cc1	1789921255	ZFVHGEAMWFTEJQ-NBOOPKSLSA-N	438.297	1.771	50	20	IDGD	
CN(C)c1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]3C2)nc1	1789922953	YVGIWLRIDRWXOK-MZGVZZPPSA-N	443.317	1.431	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3CC(c4ccccc4)=NN3)[C@H]2C1	1790543967	VLYCMWHSOFEMGS-XEYPJELSSA-N	446.979	1.997	50	20	IDGD	
C[C@H](Cc1ccc(F)cc1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21	1790722419	BMXZPIKHXWKOCA-VXKGYBDPSA-N	426.916	1.584	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3CCC4(CC3)OCCO4)[C@H]2C1	1790737137	FWFZNERAYDXGLV-FJIDUMEYSA-N	428.957	1.917	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cn4ccsc4n3)C[C@@H]21	1791055699	FDPPYIRTIVSSGP-MNXVOIDGSA-N	441.351	1.773	50	20	IDGD	
COc1ncc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](C)Br)[C@H]3C2)cc1C	1791058042	NRBDTJAUZRMHST-SDADXPQNSA-N	440.338	1.775	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@H]1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]2C1	1791298146	DRVLZYGDMPXFNC-QRTUWBSPSA-N	433.332	1.525	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)[C@@H]1CCCN1Cc1ccccc1	1791463774	SMIFQTNVZVMHPK-SXYSDOLCSA-N	449.979	1.230	50	20	IDGD	
COc1nccnc1C(=O)NC1(c2ccc(NC(=O)CCC(=O)NN(C)C)cc2)CCC1	1791599179	BYOAQFXMUOEYJJ-UHFFFAOYSA-N	440.504	1.606	50	20	IDGD	
CC(C)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3nc(CO)[nH]c3c1)C2	1792782054	OJHZPHRYJKGVKF-ZSBFGKGUSA-N	434.924	1.523	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COc1ccc(O)cc1)C2	1792866484	ATYXVGFXLLWHLJ-FLTUCWPJSA-N	441.322	1.392	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(Cl)c3nncn3c1)C2	1793448740	IEFCWABUMDRWMP-HLPPOEQASA-N	440.331	1.993	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cc(F)ccc1Cl	1793738842	FIEIAAZDAITAEA-VLWCASSMSA-N	433.307	1.865	50	20	IDGD	
COc1cc(CCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CCC(=O)NN(C)C)C3)ccn1	1794169303	WWOSENDAUBHXRX-BCDXTJNWSA-N	431.537	1.034	50	20	IDGD	
COC(=O)[C@H]1CC[C@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCBr)CC1	1795111533	VOFGLJAXNGDGLP-KATPRTFMSA-N	445.354	1.340	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccc(S(C)(=O)=O)cc1	1795415813	AGZABFBTRFMEAD-LORHWOILSA-N	442.965	1.240	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ncsc1Br)C2)[C@@H](F)Cl	1796363601	TZXQWOHFHOOYEO-FBSDJGSXSA-N	426.695	1.643	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Cl)C1	1796364458	GBFWSDVHSNTKMF-QMIVOQANSA-N	433.908	1.367	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/C(=O)c1cccs1	1796896719	ZOEGJVFXOJRMQT-RYHPKKAQSA-N	432.546	1.498	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1cc2cccn2cn1	1797101616	MOCXPHJSRYLRQI-JLUCKKNBSA-N	425.258	1.228	50	20	IDGD	
O=C(/C=C1\C(=O)Nc2ccccc21)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2	1797659035	ARQHGXGEHHQYPX-LCKYFGFMSA-N	448.317	1.397	50	20	IDGD	
C=CC[C@@H](C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O	1798522975	KWBOLICUMKXXMZ-BCEDRHLLSA-N	445.472	1.936	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(C#N)c1Cl	1799307322	ZJNHLRUTTDOIEZ-MUJYYYPQSA-N	431.924	1.836	50	20	IDGD	
CCOC(=O)O[C@@H](C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](Br)CC)C2	1800233269	LXWAEQQRKQHEOQ-HPCHECBXSA-N	435.315	1.311	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc3nccn13)C2	1800643376	RHQNAYIDIQAUBN-UMPJEAMMSA-N	435.322	1.711	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@](C)(Cl)CCl)C2	1800959108	DMRJOELGLSOABG-GEGIDHMNSA-N	447.359	1.568	50	20	IDGD	
Cc1c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)ccc(F)c1F	1803649668	CXNSEOSDGCWSPZ-BJWYYQGGSA-N	428.244	1.519	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@H](CNC(=O)c2cc(O)ncn2)[C@@H]1c1cccnc1	1803744523	PJPSULHCAWAZMN-KXBFYZLASA-N	429.553	1.748	50	20	IDGD	
Cc1noc(C)c1CCC(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1	1804599557	FOXWCVHFOWQLOA-QRFRQXIXSA-N	434.924	1.925	50	20	IDGD	
CCS(=O)(=O)CC(=O)N1CCCC2(CCN(C(=O)[C@H](C)CBr)CC2)C1	1805964228	MWUNVSJZLSWJTQ-CQSZACIVSA-N	437.400	1.683	50	20	IDGD	
O=C(CCBr)NC[C@@H]1CCN(C(=O)Cc2cncnc2)[C@H]1c1cccnc1	1806341915	IGZQCBJMJRZRDF-LPHOPBHVSA-N	432.322	1.905	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC2(CCCN(C(=O)Cc3cccc(Cl)n3)C2)CC1	1807246211	NNHYMDIOHQZDNK-UHFFFAOYSA-N	449.983	1.882	50	20	IDGD	
C[C@@H](Cn1cccn1)C(=O)N1CCCC2(CCN(C(=O)CCC(=O)NN(C)C)CC2)C1	1807270039	HTPIWPVHBXMQLB-SFHVURJKSA-N	432.569	1.123	50	20	IDGD	
CC[C@H](NC(C)=O)C(=O)N1CC[C@H](CNC(=O)[C@H](F)Br)[C@@H]1c1cccnc1	1808649496	SIAMPOJQHKGDSD-UGUYLWEFSA-N	443.317	1.693	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC2(CCCN(C(=O)C[C@H](N)c3cccnc3)C2)CC1	1809895519	VCAUXDMJPPLPFW-IBGZPJMESA-N	444.580	1.076	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)c1ccc2c(c1)CNC2=O	1810035554	NAJUFPVEEIOZLU-KFKAGJAMSA-N	442.903	1.244	50	20	IDGD	
CCOC(=O)C1(C(=O)N2CC[C@H](CNC(=O)[C@@H](Cl)COC)[C@H]2c2cccnc2)CC1	1813034670	UMELTEVFCSVGBO-IXDOHACOSA-N	437.924	1.685	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1813067562	AQSCVEQFLKCDBC-ABSDTBQOSA-N	437.972	1.868	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cccc(=O)n2O)[C@H]1c1cccnc1)C(Cl)Cl	1813077322	JNSSGKYFZHDKMU-WFASDCNBSA-N	425.272	1.604	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)[C@H](O)CCSC)[C@H]1c1cccnc1	1813094660	BZMMZTBSJOOFGY-YYIAUSFCSA-N	429.970	1.455	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1coc(Cl)n1)CC2)c1cccc(B(O)O)c1	1815354770	CQXJMBDWJDISMI-LLVKDONJSA-N	446.681	1.004	50	20	IDGD	
CS(=O)(=O)CC(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](F)Br)[nH]n1	1817057432	VUCUHJLJYRPREJ-SKDRFNHKSA-N	425.280	1.137	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)C#Cc2ccccc2)[nH]n1)c1ccc(B(O)O)cc1	1817471486	PJVOXZPFCATJEO-NRFANRHFSA-N	442.284	1.447	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)CCNC(=S)NC)sc2C1	1819802369	MMQOKPKBOCSPIN-QWRGUYRKSA-N	432.015	1.947	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)c3cccc(C#N)c3)sc2C1	1822034317	SAAVSKKWGJBETJ-OAHLLOKOSA-N	440.529	1.614	50	20	IDGD	
C[C@H](C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)n1cccc1	1822672929	UNGULQRFKJNWFD-DNVCBOLYSA-N	435.293	1.458	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)CCc3ccc(O)nn3)sc2C1	1824491768	OJWUKFPTDRNUHK-RYUDHWBXSA-N	439.925	1.437	50	20	IDGD	
O=C(Cn1ccncc1=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCBr)CC2	1824531291	AMSZFGGLJHLLPL-JTQLQIEISA-N	440.323	1.097	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@H](O)N2CCOCC2)CC1	1824616944	RIXNBCMEDOOUQS-WFXMLNOXSA-N	429.989	1.664	50	20	IDGD	
CCOC(=O)/C=C/C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](C)Br)sc2C1	1825642996	YQMDUVNKKYIJIN-LOSXEJPUSA-N	430.324	1.958	50	20	IDGD	
COc1ncccc1C(=O)N[C@@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1	1826080412	JGEHCPWYRPTKOU-GFCCVEGCSA-N	446.533	1.146	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)CC[C@H]1CCOC1)CC2	1826092134	NHENUGJCJHVOAN-UONOGXRCSA-N	437.566	1.245	50	20	IDGD	
CN[C@@H](CC(=O)N1CCCC[C@H]1C1CCN(C(=O)CCBr)CC1)C(=O)O	1826941150	NKJZZPIPPTUSLF-GJZGRUSLSA-N	432.359	1.454	50	20	IDGD	
CN[C@H](CC(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H](C)Br)CC1)C(=O)O	1826947935	HEZZRRPQDAKTDC-BPLDGKMQSA-N	432.359	1.452	50	20	IDGD	
Cc1onc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)c1C	1827056108	SHVJGBIRHKTABF-FQEVSTJZSA-N	439.321	1.518	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC([C@H]2CCCCN2C(=O)Cn2cnnn2)CC1	1827198594	DQIBYGAOWDPHNC-HUUCEWRRSA-N	427.347	1.466	50	20	IDGD	
Cc1ccn(C)c1C(=O)N1CCCC[C@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1	1829833777	ZQNHZISZUCFONJ-IBGZPJMESA-N	431.581	1.940	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)c(O)n1	1830364224	CRCSIGHNHPURQX-HXUWFJFHSA-N	425.913	1.431	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cn3nnc4ccccc43)C2)C1	1831640348	LMUMAWJFZSFWEG-IERDGZPVSA-N	449.939	1.295	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3c(C)nc4ncccn34)C2)C1	1831647061	OUYMBASNCZJBNH-IERDGZPVSA-N	449.939	1.515	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4ncnn4c3)C2)C1	1831650363	GVTMSVSPGVBZQD-OXJNMPFZSA-N	435.912	1.207	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H](O)c2ccccc2)CC1	1831871125	LWRMKPIEGFOVPZ-OFNKIYASSA-N	444.576	1.713	50	20	IDGD	
O=C([C@H](F)Cl)N1CCOC[C@]2(C1)CN(C(=O)C1(c3ccc(F)cc3)CC1)CCO2	1832386870	DNZLIMCRPPIGBU-LPHOPBHVSA-N	428.863	1.848	50	20	IDGD	
C[C@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)c3ccnnc3)CC2)CC1	1833262625	ZKEJLEKXJVDRIQ-CQSZACIVSA-N	438.370	1.693	50	20	IDGD	
COc1nc(C)ccc1C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)CCl)CC2)CC1	1833311797	FEJZDMGIDUQION-GOSISDBHSA-N	438.956	1.184	50	20	IDGD	
COc1cccc(CC(=O)NC2CCN(C3CCN(C(=O)[C@H](F)Cl)CC3)CC2)n1	1833780384	VXESAYLEHJQHOA-IBGZPJMESA-N	426.920	1.739	50	20	IDGD	
Cc1c(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)cnn1C	1834426425	XVUDRCQTAGDQET-ROUUACIJSA-N	433.336	1.035	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3cncs3)CCO2)C1	1834461255	VJYNEGZGJPHVNB-BLLLJJGKSA-N	432.340	1.244	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)Cc3ccsc3)C2)C1	1834822399	LEQYWPJQIPGWRU-KRWDZBQOSA-N	431.352	1.532	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnccc3F)CCO2)C1	1836319799	ZPKVWYKIGVXURC-RDTXWAMCSA-N	444.301	1.464	50	20	IDGD	
Cc1ccc(OCC(=O)N2CCC(OC3CCN(C(=O)[C@H](O)CCl)CC3)CC2)cc1	1836716861	VSZDDNFBLOVCAF-HXUWFJFHSA-N	438.952	1.972	50	20	IDGD	
CN(C)c1cccc(C(=O)N2CCC(OC3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)c1	1836717941	GIGZWUNLASDOAV-FQEVSTJZSA-N	437.968	1.965	50	20	IDGD	
O=C(c1cc(=O)cco1)N1CCC(OC2CCN(C(=O)[C@H](F)Br)CC2)CC1	1837590824	BTUNJZOWDRNLLN-INIZCTEOSA-N	445.285	1.943	50	20	IDGD	
O=C(CCBr)N1CCC(OC2CCN(C(=O)c3cnc(O)[nH]3)CC2)CC1	1837654506	UPWLURQNSNXVET-UHFFFAOYSA-N	429.315	1.513	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(O)cc3)CCO2)C1	1838971925	ROTDRCKRCJVQDR-QFBILLFUSA-N	441.322	1.636	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CSc3ccncc3)C2)C1	1839142202	JHLUIOBYRFWCLZ-APWZRJJASA-N	427.954	1.648	50	20	IDGD	
N#Cc1cc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)ccc1F	1839187161	NPCBXOUZWHZBAF-HKUYNNGSSA-N	427.835	1.231	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(-n4cccn4)cc3)CCO2)C1	1839337271	ABMACCPMMLCLGA-DENIHFKCSA-N	446.935	1.960	50	20	IDGD	
O=C(c1cnc2ccc(F)cn12)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1839591582	JIUFCHIMRBBMOS-CRAIPNDOSA-N	428.823	1.078	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccnc(C)c3)C2)C1	1839965398	XNESEKVLFPEZLS-LPHOPBHVSA-N	440.338	1.634	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccc(F)cc3F)CCO2)C1	1839979276	FQDSFVAQJIBCBX-UZLBHIALSA-N	430.879	1.981	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(F)s3)C2)C1	1840031492	RRGXMZVKTCPHHV-ZBEGNZNMSA-N	435.315	1.741	50	20	IDGD	
Cc1ncc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)s1	1840036496	LPIXXBFBCGPKBJ-YVEFUNNKSA-N	446.367	1.234	50	20	IDGD	
CNc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](Cl)COC)CCO3)cc1	1840151938	RWEXATIYOZSAHA-YLJYHZDGSA-N	425.913	1.052	50	20	IDGD	
COc1ncccc1CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840186202	GBLNWWGPWSYGMD-LJQANCHMSA-N	446.331	1.283	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1C[C@]1(F)Cl)CCO2	1840248231	YNWYSHBSVDFPBS-IDTSFGKNSA-N	427.698	1.151	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)n1cc(C)cn1)CCO2	1840402504	FYXJDMLSLGUDPM-ZWOKBUDYSA-N	426.945	1.616	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H]1CC[C@H](C(=O)N2CC3(CCCN3C(=O)[C@@H](O)CCl)C2)CC1	1841348220	PRQWERLXYINYKC-JYJNAYRXSA-N	443.972	1.873	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)[C@@H]2C[C@@H]2c2ccc(F)c(F)c2)C1	1841400967	QRWRFBFFNQTOPL-HZPDHXFCSA-N	434.487	1.645	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1snnc1C1CC1)C2	1843416088	XFKHXWRBPVEZSE-WSDLNYQXSA-N	441.517	1.367	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)CCc1cnc[nH]1)C2	1844692075	CXAARYQHLKUEMU-UHFFFAOYSA-N	441.444	1.693	50	20	IDGD	
CCN(CC)[C@@H](C(=O)N1CCCC12CN(C(=O)c1cccc(B(O)O)c1)C2)c1ccccc1	1845838826	TWNPOOYKQYIODD-JOCHJYFZSA-N	449.360	1.267	50	20	IDGD	
O=C1C[C@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](F)Br)CN1C1CCCC1	1848040646	PKUZMJNQHKBGQW-PCBIJLKTSA-N	430.318	1.670	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)CNC(=O)c2ccc3c(c2)OCO3)cc1OC	12695542	SOVMEYNIDRKCGZ-UHFFFAOYSA-N	443.456	1.794	50	20	IDGD	
CON(C)S(=O)(=O)c1cccc(C(=O)NNC(=S)NCCc2cccs2)c1	21125825	JVPJMKINUSITBQ-UHFFFAOYSA-N	428.561	1.282	50	20	IDGD	
CCC[C@@H](NC(=O)NCc1ccc(F)cc1)C(=O)NNC(=O)CNC(=O)c1cccs1	725741925	VWNZAUKKQKQDQB-OAHLLOKOSA-N	449.508	1.433	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CC[C@H](CNC(=O)OC(C)(C)C)C2)cc1OC	725808605	DNWIAMCYZVIZIU-CQSZACIVSA-N	436.509	1.311	50	20	IDGD	
CC(C)COC[C@@H](NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)c1ccco1	726259665	IUVPRRGRBBHONC-MRXNPFEDSA-N	427.461	1.884	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)NCc2ccc([C@]3(C)NC(=O)NC3=O)cc2)c2ccccc2n1	726283424	ZNVZLSMNKIHISN-QHCPKHFHSA-N	446.467	1.742	50	20	IDGD	
C#Cc1cccc(NC(=S)NNC(=O)c2ccc(OC)c(S(=O)(=O)NC(C)C)c2)c1	727498568	WRUGTZRJEMFXRQ-UHFFFAOYSA-N	446.554	1.995	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1ccc2c(c1)OCCO2)c1cccc(S(=O)(=O)N(C)C)c1	727608657	CUTPHFONZXCSQC-CYBMUJFWSA-N	448.501	1.413	50	20	IDGD	
Cc1nc(S(=O)(=O)N2CCC(C(=O)NNC(=O)CCCc3ccccc3)CC2)cn1C	727715311	LZNHWWWWEOMDDN-UHFFFAOYSA-N	447.561	1.300	50	20	IDGD	
CN1CCN(C[C@@H](NC(=O)NNC(=O)COc2ccccc2F)c2ccccc2)CC1	727843807	UTDVMMZDGDBZPY-LJQANCHMSA-N	429.496	1.524	50	20	IDGD	
CC/C=C(/C)C(=O)N1CSC[C@@H]1C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	728211929	MGOVJXMMASQGIM-WIXQGAKGSA-N	438.575	1.828	50	20	IDGD	
COc1ccccc1Nc1nc(Cl)c(C=NNC(=O)[C@@H](C)NS(C)(=O)=O)s1	728437128	YHPLCKMNXMESHJ-SECBINFHSA-N	431.927	1.937	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNS(=O)(=O)c1ccc(F)cc1C(F)(F)F	728507707	XPEUYZBSUSLGCL-UHFFFAOYSA-N	425.385	1.646	50	20	IDGD	
O=C(CCCNS(=O)(=O)c1ccc(F)cc1)NNC(=O)c1cccc(OC(F)F)c1	728609629	MUFGWFDYPOWCKR-UHFFFAOYSA-N	445.419	1.947	50	20	IDGD	
COc1cc(Br)ccc1C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	728844853	CKXJPTXYUJADRP-UHFFFAOYSA-N	434.294	1.925	50	20	IDGD	
COc1cc([N+](=O)[O-])c(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1SC	728846568	OZNXNRQPKUMZGE-UHFFFAOYSA-N	446.489	1.793	50	20	IDGD	
CCN(CCNC(=O)NNC(=O)c1csc(N2CCOCC2)n1)C(=O)OC(C)(C)C	729221532	SCWUHNHQYQHPNV-UHFFFAOYSA-N	442.542	1.181	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)NC2CCCCC2)cc1Br	729297692	DYEMZFMUACJTFV-UHFFFAOYSA-N	447.355	1.976	50	20	IDGD	
COc1ccc(C(=O)CNC(=O)CCC(=O)NNC(=O)Cn2ccc3ccccc32)cc1	729454638	YKIZPKJCCBOXAT-UHFFFAOYSA-N	436.468	1.577	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(NC(=S)NNC(=O)Cn2ccc3ccccc32)c1	729646409	VWIGBGVBJPHOME-UHFFFAOYSA-N	431.543	1.909	50	20	IDGD	
C[C@@H]1CCCC[C@@]12NC(=O)N(CC(=O)NNC(=S)Nc1ccc(N(C)C)cc1)C2=O	729689924	WPGKWFGINYYCIB-ZUOKHONESA-N	432.550	1.571	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cccc3c2O[C@@H](C)C(=O)N3)cc1OC	729744890	KXXPWCJLXRLQPK-NSHDSACASA-N	443.412	1.041	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCCCC(=O)NNC(=O)COc2ccccc2O)cc1C	730778705	KUNBBTIOYWNHEG-UHFFFAOYSA-N	435.502	1.294	50	20	IDGD	
CCOC(=O)[C@@H]1CCCN(C(=O)CN(C)C(=O)NNC(=O)C(C)(C)c2ccccc2)C1	731222944	ZODSHROCBDVBMD-MRXNPFEDSA-N	432.521	1.439	50	20	IDGD	
NS(=O)(=O)c1ccc(Br)c(C(=O)NNC(=O)Cc2ccccc2F)c1	731344704	CLQQQFGDVXAEBK-UHFFFAOYSA-N	430.255	1.239	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)c1ccc2c(c1)OCCO2)N1CCN(c2ccc(F)cc2)CC1	731866217	RUJKQSGQLNLJRQ-HNNXBMFYSA-N	428.464	1.569	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CCc2nc(O)c3cnn(C)c3n2)cc1Br	732033053	MNUHFKTYLVENLE-UHFFFAOYSA-N	449.265	1.234	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)[C@H]1CCCN1S(=O)(=O)c1cccs1	732301762	IOJBXCUIHVNSCD-CYBMUJFWSA-N	429.545	1.448	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)NCCCCN1C(=O)c2ccccc2C1=O	732472432	SJIZCCLWNMKNMQ-UHFFFAOYSA-N	426.429	1.178	50	20	IDGD	
CCOc1ccc(/C=C(/C#N)C(=O)N2CCN(CC(=O)Nc3nncs3)CC2)cc1	733959525	ZVZALJDGTAIYGU-WJDWOHSUSA-N	426.502	1.627	50	20	IDGD	
COC(=O)c1cn(CC(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)c2ccccc12	734239261	KNOXZUHJPDTRFS-UHFFFAOYSA-N	433.465	1.283	50	20	IDGD	
CCOc1cn(-c2ccccc2)nc1C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C	734240733	XKZDUPHBAIJEKU-UHFFFAOYSA-N	432.481	1.740	50	20	IDGD	
Cn1ccnc1SCc1ccc(C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)o1	734241792	KHNFQTFFRAMTSG-UHFFFAOYSA-N	438.510	1.774	50	20	IDGD	
CC(C)[C@@H](CNC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)NC(=O)OC(C)(C)C	734689137	JTYYMCKCKCRFLA-OAHLLOKOSA-N	442.538	1.583	50	20	IDGD	
COc1ccc(S(=O)(=O)C[C@@H](C)C(=O)NNC(=O)COc2ccc(C)c(C)c2)cc1	735029351	VFXTWCWESVWVFX-MRXNPFEDSA-N	434.514	1.948	50	20	IDGD	
CC(C)Oc1ccc(C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)cc1	735117179	CIAGZVWOCSVAHK-UHFFFAOYSA-N	433.534	1.562	50	20	IDGD	
C[C@H](CN1CCN(c2ccccn2)CC1)NC(=O)NNC(=O)[C@@H](C)Oc1ccc(F)cc1	735585556	GBTJYNPFGKNYFQ-IAGOWNOFSA-N	444.511	1.529	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)c2cnc3ccc(C)cn3c2=O)cc1C	736772687	RMBRJDFGPRHURE-UHFFFAOYSA-N	428.470	1.553	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)C(=O)N1CCCC[C@@H]1C	737047087	HGIFNNJGBZHZMG-OALUTQOASA-N	444.580	1.319	50	20	IDGD	
Cc1cccc(N2C[C@H](C(=O)OCC(=O)NNC(=O)c3ccc(C#N)cc3)CC2=O)c1C	744568582	XMQODURLOUNDRI-GOSISDBHSA-N	434.452	1.532	50	20	IDGD	
Cc1ccc(-n2[nH]c(C(=O)NNC(=O)CCN3CCN(c4ccccc4)CC3)cc2=O)cc1	746092573	XHXIQCHNAOLNMC-UHFFFAOYSA-N	448.527	1.447	50	20	IDGD	
CN(C)[C@H](CNC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)c1ccc(Cl)cc1	746778866	YLNKVHFISRCHMM-QGZVFWFLSA-N	438.937	1.990	50	20	IDGD	
C[C@H]1CC(C)(C)C[C@]2(C1)NC(=O)N(CC(=O)NNC(=O)CCOc1ccccc1)C2=O	747181010	CKVGFZVSFIJADM-NYHFZMIOSA-N	430.505	1.740	50	20	IDGD	
COc1cccc(C(NC(=O)NNC(=O)C(=O)N2CCCC2)c2cccc(OC)c2)c1	748661991	RYONQNFUYMUEEI-UHFFFAOYSA-N	426.473	1.746	50	20	IDGD	
O=C(Cc1cccc(F)c1)NCCNC(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	749015471	YUIKDHOZHVWQLT-UHFFFAOYSA-N	440.435	1.020	50	20	IDGD	
CO[C@@H](C)c1nc(C)c(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)s1	749333216	KFWYDHROKVNLGJ-QMMMGPOBSA-N	432.911	1.535	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)N[C@@H]2CCN(CCCc3ccccc3)C2=O)c1	750293058	WSQHJNKUZKLHSK-HXUWFJFHSA-N	440.500	1.882	50	20	IDGD	
Cc1nc(S(=O)(=O)NCCC(=O)NNC(=O)c2cc3c(s2)CCCCC3)cn1C	750662242	BSFRKCITRYVWFZ-UHFFFAOYSA-N	439.563	1.189	50	20	IDGD	
CCC(=O)NCc1cc(S(=O)(=O)NNC(=O)c2ccc3c(c2)OCCO3)ccc1OC	751538554	KVWXFFMUDOIWQG-UHFFFAOYSA-N	449.485	1.116	50	20	IDGD	
CCC(=O)NCc1cc(S(=O)(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)ccc1OC	751539408	XTFJXMWYVBQIKP-UHFFFAOYSA-N	436.446	1.253	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2nccnc2Sc2ccccc2)n1	751861694	SMPJDYPITSWEEA-UHFFFAOYSA-N	443.510	1.940	50	20	IDGD	
O=C(COC(=O)c1c(F)ccc([N+](=O)[O-])c1F)NNC(=O)[C@H]1COc2ccccc2O1	752558024	FTXBIANPPBLUMX-CYBMUJFWSA-N	437.311	1.017	50	20	IDGD	
CC(=O)NC[C@@H]1CCn2ncc(C(=O)NNC(=O)c3cc(-c4cccs4)[nH]n3)c2C1	753259212	QLBWDGZNHIPNMX-GFCCVEGCSA-N	427.490	1.108	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2ccnc(O[C@H]3CCOC3)c2)c2ccccc2c1=O	754011081	AYCRDCCMCRVLOJ-HNNXBMFYSA-N	437.456	1.444	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCN(C(=O)c2ccc(O)cc2)CC1	754640131	RZSMALNWMBEFKR-UHFFFAOYSA-N	446.891	1.273	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)[C@@](C)(O)c2cccc(C(F)(F)F)c2)c2ccccc2c1=O	754843203	VBJWQFCJGQHZFI-IBGZPJMESA-N	434.374	1.621	50	20	IDGD	
CC(C)Oc1cccc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)n1	755180356	PSRKVHWHPRDOHF-UHFFFAOYSA-N	425.489	1.088	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1)NNc1ccc(C(F)(F)F)nn1	755189809	WHLGWCQVCNSTOE-UHFFFAOYSA-N	434.356	1.215	50	20	IDGD	
CCc1noc(CC)c1CNC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	756077241	DNWVNLDXGVJGFJ-UHFFFAOYSA-N	449.533	1.728	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)N[C@@H]1CCN(c2c(F)cccc2F)C1=O	756209535	BMAOQWUTLINLDH-CYBMUJFWSA-N	435.343	1.328	50	20	IDGD	
CCOC(=O)[C@H](C)NC(=O)c1ccc(NC(=O)NNC(=O)Cc2ccc(F)cc2)cc1	756791604	WCAINXONXFENCX-ZDUSSCGKSA-N	430.436	1.903	50	20	IDGD	
CC(C)(C)OC(=O)NCC1(C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)CCCC1	756911502	LPLYFDXYFVVVST-UHFFFAOYSA-N	439.534	1.936	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)NNC(=O)COc2cccc(C)c2)cc(S(C)(=O)=O)c1	757608296	BCQYFQCNOORWNR-UHFFFAOYSA-N	449.485	1.807	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3cccc4c3oc(=O)n4C)n[nH]2)cc1OC	757651369	VIESIDBJDGZKAG-UHFFFAOYSA-N	437.412	1.614	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)Nc1cccc(C(=O)NCc2ccccc2)c1	757802080	ZOJHITCEEKCCIS-INIZCTEOSA-N	430.486	1.204	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1cc([N+](=O)[O-])ccc1SC1CCCC1	758030371	QBCGAERXBZAKLW-JTQLQIEISA-N	430.508	1.328	50	20	IDGD	
C[C@@H]1CCCCN1CCOc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccccn1	758829426	DKQYSGVWHZRBLM-MRXNPFEDSA-N	425.489	1.735	50	20	IDGD	
Cc1cc(C)nc(-n2nccc2NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)n1	760278422	XDKZQKVITKUAAT-UHFFFAOYSA-N	429.824	1.038	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(CNC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)C1	762619457	QGOUFRZBGMMPDJ-UHFFFAOYSA-N	441.510	1.293	50	20	IDGD	
C[C@H]1CN(C(=O)CCC(=O)C(C#N)=C2N(C)c3ccccc3N2C)CCS(=O)(=O)C1	762670591	IHCGBRGBVBWLKF-HNNXBMFYSA-N	430.530	1.550	50	20	IDGD	
O=C(CN1CCCCCC1)Nc1ccc(NC(=O)C(=O)NNC(=O)c2ccccn2)cc1	763465739	DAETWEMJTNSFOK-UHFFFAOYSA-N	438.488	1.296	50	20	IDGD	
CCc1nnc(-c2ccc(NC(=O)C(=O)NNC(=O)[C@@H]3COc4ccccc4O3)cc2)o1	763572339	QQRYIICBKIATPJ-INIZCTEOSA-N	437.412	1.225	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc2c(c1)nc(C1CC1)n2C	763647070	MUHZAYSDGUWHFW-UHFFFAOYSA-N	437.456	1.624	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(F)cc1OC(F)F	763685361	UHAPFUZTJPDOEZ-UHFFFAOYSA-N	441.362	1.991	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(Cl)cc(C(=O)OC)c1	763711261	FXNOCLUUSVLPMW-UHFFFAOYSA-N	433.848	1.854	50	20	IDGD	
CCOc1cc(Cl)ccc1NC(=O)C(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	763791490	UBHXPGKUWQXGCU-UHFFFAOYSA-N	443.847	1.385	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cc(NC(C)=O)ccc2C)cc1	763859673	DTTQXJCMKVIQAE-AWEZNQCLSA-N	442.472	1.906	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccc(N2CCOC[C@@H]2C)cc1	763865179	JEEMDTLHRPVGET-GJZGRUSLSA-N	444.463	1.604	50	20	IDGD	
CCc1cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(Br)c2)no1	763882806	MBDTZEJZRUVROS-SECBINFHSA-N	425.239	1.553	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3cnn(C[C@@H]4CCCO4)c3)cc2C1	763939631	NOTXYCCJRWLBPD-DOMZBBRYSA-N	431.518	1.648	50	20	IDGD	
CCc1c(NC(=O)C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cnn1CC(C)C	763943269	BVZKVQTWUHMBLL-UHFFFAOYSA-N	439.476	1.393	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)c(C)c1	763977450	QELXMXBWNBNXAY-UHFFFAOYSA-N	435.820	1.306	50	20	IDGD	
O=C(NNC(=O)c1ccc[nH]1)C(=O)Nc1cc(I)ccc1Cl	763979587	NMAZXGQDNQNLLH-UHFFFAOYSA-N	432.605	1.672	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cnccn2)n(-c2ccccc2C(F)(F)F)n1	764024674	OKOKEZCHFJFNSE-UHFFFAOYSA-N	433.350	1.389	50	20	IDGD	
O=C(Cc1ccsc1)NNC(=O)C(=O)Nc1ccc(=O)n(Cc2ccccc2Cl)c1	764033222	IHIFGTIMRLNBLM-UHFFFAOYSA-N	444.900	1.940	50	20	IDGD	
CN1CCc2ccc(NC(=O)C(=O)NNC(=O)c3cccc(C(F)(F)F)c3)cc2C1=O	764037705	UTJVCQNDAJFNHY-UHFFFAOYSA-N	434.374	1.733	50	20	IDGD	
COC(=O)c1cccc(C#Cc2cccc(NC(=O)C(=O)NNC(=O)CC(F)(F)F)c2)c1	764112331	JSBCPWXKLZZLKX-UHFFFAOYSA-N	447.369	1.911	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(OC)c2O)cc1Cl	764131171	NZXWDZGTCVPZAF-UHFFFAOYSA-N	437.836	1.479	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)CCc2ccco2)cc1OCc1ccncc1	764166472	LANFLUSXTSZVIR-UHFFFAOYSA-N	438.440	1.981	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)CCc2ccccc2)cc1OC	764185028	GITBVBWRBGLOAD-UHFFFAOYSA-N	448.501	1.176	50	20	IDGD	
CC(C)(C)OC(=O)NCc1cccc(NC(=O)C(=O)NNC(=O)c2cccc(C#N)c2)c1	764236281	CTYDVNAPJABKDW-UHFFFAOYSA-N	437.456	1.983	50	20	IDGD	
CC(C)n1nnnc1-c1ccc(NC(=O)C(=O)NNC(=O)c2cccc(C#N)c2)cc1F	764236727	FMYXSUBRAXHGGI-UHFFFAOYSA-N	436.407	1.331	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2cccc3ncccc23)ccc1N1CCCC1=O	764260250	NGACSSGEWPVTPQ-UHFFFAOYSA-N	447.451	1.770	50	20	IDGD	
COc1c(Br)cc(Cl)cc1NC(=O)C(=O)NNC(=O)Cc1cccnc1	764268937	YSZAREVWTWXRPM-UHFFFAOYSA-N	441.669	1.835	50	20	IDGD	
Cn1ncc(NC(=O)C(=O)NNC(=O)c2cc(F)ccc2Br)c1C(F)F	764270395	LYTMHFZIWGDVBZ-UHFFFAOYSA-N	434.172	1.659	50	20	IDGD	
CC(C)n1cnnc1-c1ccccc1NC(=O)C(=O)NNC(=O)CCc1ccccc1O	764277859	IXQODLDXGFZDFX-UHFFFAOYSA-N	436.472	1.950	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1ccc(Br)cc1F	764278365	XHFYFOQSIJQYKL-UHFFFAOYSA-N	426.198	1.459	50	20	IDGD	
O=C(Cc1cc[nH]n1)NNC(=O)C(=O)Nc1ccc(CC(=O)Nc2ccccc2F)cc1	764294128	VMFLMCVUOBKCGO-UHFFFAOYSA-N	438.419	1.059	50	20	IDGD	
COC(=O)[C@@H]1CN(C(=O)C(=O)NNC(=O)CCCc2cccs2)c2ccccc2O1	764339204	GOHXZNQEOVZMBU-INIZCTEOSA-N	431.470	1.185	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1)C(=O)Nc1ccn(Cc2ccccn2)n1	764388248	QAPHIKRVGKFKTJ-UHFFFAOYSA-N	448.418	1.255	50	20	IDGD	
C[C@@H](C#N)Oc1ccccc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	764388448	SDPRXCLCVNIVQO-LBPRGKRZSA-N	436.403	1.906	50	20	IDGD	
CCOC(=O)c1cc(-c2ccccc2)ccc1NC(=O)C(=O)NNC(=O)[C@@H]1COCCO1	764434658	RAEKNIYTELGELI-SFHVURJKSA-N	441.440	1.032	50	20	IDGD	
COc1nccnc1NNC(=O)CCNS(=O)(=O)c1ccc(OC(F)(F)F)cc1	764469972	AFYZIRGXBWVDPF-UHFFFAOYSA-N	435.384	1.196	50	20	IDGD	
CC(C)(C)OC(=O)NNS(=O)(=O)c1ccc(S(=O)(=O)NCC(F)(F)F)cc1	764932016	LHHTYRAGSYVTNY-UHFFFAOYSA-N	433.430	1.245	50	20	IDGD	
C[C@@H](CCOc1ccccc1)C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765737002	CZYOCGARHHOJFL-IBGZPJMESA-N	438.528	1.697	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cc1OC	765738408	KEMNXFOIFNDJCO-UHFFFAOYSA-N	440.500	1.313	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)C(C)(C)CC(C)C)CC2)cc1	766635908	IOVGEGOSYBTPNJ-UHFFFAOYSA-N	438.594	1.521	50	20	IDGD	
CC(C)(C)NC(=O)CN1CCC(CNC(=O)NNc2ccccc2S(C)(=O)=O)CC1	767085982	GQWCGRSPXVLFEO-UHFFFAOYSA-N	439.582	1.343	50	20	IDGD	
CC(C)(O)C(=O)NNC(=O)[C@H]1CCCN(C(=O)c2ccc(Br)c(F)c2)C1	768245352	RPPBPOVEZDWXOH-NSHDSACASA-N	430.274	1.359	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C2CCN(C(=O)N3CCCC3)CC2)n[nH]1	768281333	IUMWRLFTJFDYER-UHFFFAOYSA-N	440.504	1.774	50	20	IDGD	
O=C(NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)N[C@H]1CCOC2(CCC2)C1	769194522	SFBUOBHOOXVJRS-INIZCTEOSA-N	436.534	1.517	50	20	IDGD	
Cc1cn(-c2ccccc2)nc1C(=O)NNC(=O)c1sc(N2CCOCC2)nc1C	770208734	NKLVFNNDFQUADW-UHFFFAOYSA-N	426.502	1.857	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)c3cccc(N4C(=O)c5ccccc5C4=O)c3)nc21	770983668	OVFOLZQZCICHDG-UHFFFAOYSA-N	429.396	1.626	50	20	IDGD	
CC(C)[C@@H]1C[C@@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)CCO1	772622089	SXWWAFYFEVGVPT-WMZOPIPTSA-N	438.550	1.619	50	20	IDGD	
O=C(NNC(=O)N1CCC(c2nnc3n2CCCC3)CC1)c1cc(Br)c[nH]1	773136306	UIQBFJYDXYRDND-UHFFFAOYSA-N	436.314	1.939	50	20	IDGD	
Cc1cc(C)c(CC(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)c(C)c1	774302376	KCOWBAVUHPQKMU-UHFFFAOYSA-N	431.562	1.629	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CC[C@@H](C(=O)NCC(F)(F)F)C1	778234822	NNTZEVVZXXXHDK-SNVBAGLBSA-N	436.818	1.110	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)c1ccc(F)c(I)c1	778445280	GUBLUHCHGXVXIP-UHFFFAOYSA-N	437.209	1.716	50	20	IDGD	
COCC1(C(=O)NNC(=O)c2cccc(S(=O)(=O)Nc3ccc(OC)cc3)c2)CC1	778522662	XXFAKLRYULQRCR-UHFFFAOYSA-N	433.486	1.684	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)N2CCCC2)ccc1OS(=O)(=O)CCCCCl	780703802	SLJKNYXFHXXPPH-UHFFFAOYSA-N	439.939	1.985	50	20	IDGD	
COc1ccc([N+](=O)[O-])cc1NS(=O)(=O)c1cccc(C(=O)NN=c2cc[nH]cc2)c1	780761276	MIXUTTTUGRAQBE-UHFFFAOYSA-N	443.441	1.978	50	20	IDGD	
CCO[C@H]1C[C@@](NC(=O)OC(C)(C)C)(C(=O)NNC(=O)C(=O)Nc2ccccn2)C1(C)C	780896613	KVILBQTXFSIJDZ-YEJXKQKISA-N	449.508	1.266	50	20	IDGD	
Cc1cc(C(=O)NCC(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)ccc1[N+](=O)[O-]	782635668	RVYVJAMUWIQPRJ-UHFFFAOYSA-N	447.473	1.217	50	20	IDGD	
CCOc1ccccc1NC(=O)C(=O)NNC(=O)c1sc(N2CCOCC2)nc1C	782896308	FNMJDHMDZLQIJA-UHFFFAOYSA-N	433.490	1.087	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2ccc(OC3CCCC3)c(Cl)c2)CCS(=O)(=O)C1	783425573	IOZOKFLMPYFKGH-SFHVURJKSA-N	429.926	1.798	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2ncc(Cc3ccccc3Cl)s2)CCS(=O)(=O)C1	783428727	WSLNDWNWYNFNKE-QGZVFWFLSA-N	442.950	1.524	50	20	IDGD	
CS(=O)(=O)NCCc1ccc(C(=O)COC(=O)/C(C#N)=C\c2ccc(O)cc2)cc1	784020699	KHOJBXRHNQTJCN-PDGQHHTCSA-N	428.466	1.817	50	20	IDGD	
CCOc1ccc(C#N)cc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	784210150	FKEVVOAIWGBGIV-UHFFFAOYSA-N	443.485	1.479	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)C(=O)Nc1ccc(OC(F)F)cc1	784212417	AIRPYIYBMMCSHV-UHFFFAOYSA-N	440.428	1.811	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNc2cccc(OC)n2)c(OCC(F)(F)F)c1	784847543	ICVZDDQDWIXCQI-UHFFFAOYSA-N	442.350	1.900	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2cc(F)cc(F)c2Br)c1O	785990403	GGPXAMFCOXCDQP-UHFFFAOYSA-N	444.188	1.841	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)Cc2c(C(=O)NNc3nc(C)cc(C)n3)c(C)cn2C)n1	786831374	IDQIOQMWNKGYKW-UHFFFAOYSA-N	437.508	1.590	50	20	IDGD	
CN1CCC(n2ccc(NC(=O)C(=O)NNC(=O)Cc3ccc4ccccc4c3)n2)CC1	787542602	BNXKTWBGWNJPKD-UHFFFAOYSA-N	434.500	1.632	50	20	IDGD	
CCOC(=O)c1ccc(C)c(S(=O)(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c1	788745922	AGGXUNNMIXIDQV-UHFFFAOYSA-N	428.470	1.981	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)N[C@H]2CCN(Cc3ccc(C)cc3)C2=O)cc1	790697200	LORSZGJSCMRWHC-IBGZPJMESA-N	426.473	1.514	50	20	IDGD	
CCc1nn(C)c(CC)c1CC(=O)NNC(=O)CN1CCN(Cc2ccc(C)cc2)CC1	790784851	ULUDIVYSTIQMML-UHFFFAOYSA-N	440.592	1.361	50	20	IDGD	
O=C(NNC(=O)c1cccc(Br)c1)C(=O)Nc1cccc(N2CCC2=O)c1	790952617	SENKRGVVURSVFG-UHFFFAOYSA-N	431.246	1.586	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)ccc1C(F)(F)F	790959310	GWLLYMPLNFUWPJ-UHFFFAOYSA-N	442.306	1.728	50	20	IDGD	
NC(=O)CC[C@@H](C(=O)NNc1cccc(F)c1[N+](=O)[O-])N1C(=O)c2ccccc2C1=O	791148415	XNZYCVFOJKCBML-AWEZNQCLSA-N	429.364	1.107	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2nc(Br)ccc2F)c1	792017362	HSSFAPUCFQWNPI-UHFFFAOYSA-N	445.270	1.308	50	20	IDGD	
C[C@@](O)(Cn1cc(C(F)(F)F)ccc1=O)C(=O)NNc1nnc(-c2ccccn2)s1	792476203	PWKLKWWEGHSCNK-MRXNPFEDSA-N	440.407	1.675	50	20	IDGD	
CC(=NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1)c1ccc(C(=O)N(C)C)cc1	793025269	KVSWYVIWRBLOON-UHFFFAOYSA-N	435.528	1.687	50	20	IDGD	
COc1ccc(-c2nn(CCC#N)cc2/C=C(/C#N)C(=O)N2CC(CC(N)=O)C2)cc1OC	794282112	ZDPIJZSNDJFUCS-MFOYZWKCSA-N	448.483	1.722	50	20	IDGD	
O=C(CN[C@H](CO)c1ccccc1OC(F)(F)F)NNC(=O)c1ccc([N+](=O)[O-])cc1	796524754	DQUVUAMPUDNSKS-CQSZACIVSA-N	442.350	1.578	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2cccc3cccnc23)c(OC)c(C)c1OC	797000358	CCJYVMAPLOSWQO-UHFFFAOYSA-N	438.440	1.969	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CC[S@](=O)c2ccc3c(c2)OCCO3)cc1C	798309896	LTIOKAXZLPNKSA-HKBQPEDESA-N	445.497	1.358	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@H]2C(=O)NNC(=O)c2ccc(OC)c(OC)c2)cc1	798349395	ZSYLVLMXLNOBBC-KRWDZBQOSA-N	427.457	1.778	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)cc1	801109840	FBQILMBDNFMVHX-UHFFFAOYSA-N	432.502	1.329	50	20	IDGD	
CC(=O)[C@@H]1CC(C(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)=NN1c1ccccc1	802067134	MTEKJAIXNWOJRW-SFHVURJKSA-N	443.485	1.467	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN([C@@H](CNC(=O)NNC(=O)c2ccc[nH]2)C(F)(F)F)CC1	802465657	QIDWSKKUMKGISB-ZDUSSCGKSA-N	448.446	1.442	50	20	IDGD	
CN(NC(=O)[C@@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(C)(C)O)C(N)=O	802961697	ZJMTVYZFNJSVAG-GOSISDBHSA-N	426.473	1.706	50	20	IDGD	
CCn1cnnc1NC(=O)/C(C#N)=C/c1cn(CCC(N)=O)nc1-c1ccc(OC)cc1	803526056	LRUSZPRKPDFBMV-XNTDXEJSSA-N	434.460	1.591	50	20	IDGD	
COCc1csc(NC(=O)C(=O)NNC(=O)COc2cccc(C(F)(F)F)c2)n1	806973237	FZHISVWDDDQFGO-UHFFFAOYSA-N	432.380	1.473	50	20	IDGD	
CCC(C)(C)[C@@H]1CCc2nc(NC(=O)C(=O)NNC(=O)[C@H](C)OCCOC)sc2C1	806978982	KIRSJMKFPBBBTB-QWHCGFSZSA-N	440.566	1.822	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)C3CCN(CC(F)F)CC3)n[nH]2)cc1OC	807085758	ZBLCHIPTDSEIDQ-UHFFFAOYSA-N	437.447	1.832	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)NCCc1cc(Cl)c2c(c1)OCCO2	807106168	LGOZAZSYXFVZKE-UHFFFAOYSA-N	430.848	1.935	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccccc2)c(C(=O)NCC(F)(F)F)cc1F	810382690	KPLZDLFZWHOCBG-UHFFFAOYSA-N	440.353	1.826	50	20	IDGD	
N#Cc1ncn(-c2ccccc2NC(=O)C(=O)NNC(=O)CC23CC4CC(CC(C4)C2)C3)n1	810386430	ZNACKNBQUZEKEM-UHFFFAOYSA-N	447.499	1.831	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)CCc2cccs2)c1	811675309	HDEPUVXJRGQFPV-UHFFFAOYSA-N	445.588	1.586	50	20	IDGD	
CC(C)C(=O)Nc1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)cc1	813033828	NFFQJHTYCHZYKN-UHFFFAOYSA-N	447.517	1.613	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)N(C)Cc1ccccc1S(N)(=O)=O	814325433	QMFDNDOSSQMWLG-GFCCVEGCSA-N	440.909	1.628	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)C2(N3C(=O)c4ccccc4C3=O)CCCC2)cc1	815440904	ZHIFILHMGAPTCQ-UHFFFAOYSA-N	449.463	1.908	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccc([C@H]3CCOC3)cc2)cc(OC)c1OC	815563993	UOXUHKJAOAUWGY-AWEZNQCLSA-N	443.456	1.616	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNc2cncc(Cl)n2)nnn1CCOc1ccc(F)cc1	815586893	UWMFZPJXRYZGTK-UHFFFAOYSA-N	434.819	1.330	50	20	IDGD	
COc1cc(C)c(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)N(C)C)c(C)c1C	815752088	BKXNDOWBHGHBKL-UHFFFAOYSA-N	434.518	1.953	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)Cc1ccnc(O)c1Br	817052689	MBLZQDCKEZZTBO-UHFFFAOYSA-N	429.296	1.486	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)Cn2c(=O)cnc3ccccc32)cc1	860446023	BDXDGBMLGFWHQU-UHFFFAOYSA-N	449.496	1.279	50	20	IDGD	
CC(=O)N1CCN(S(=O)(=O)c2cccc(C(=O)NNc3ccc(Cl)cc3)c2)CC1	865984595	AGUDTIHQPRANNA-UHFFFAOYSA-N	436.921	1.950	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)COc2ccc(F)cc2Br)C[C@H](C)O1	912919389	MTMAYTVLKDRNHK-RYUDHWBXSA-N	432.290	1.614	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)CNS(=O)(=O)c1ccc(C)c(C)c1	913457452	GZQYDDKGMAHYID-UHFFFAOYSA-N	435.502	1.207	50	20	IDGD	
Cn1ccnc1[C@@H](NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)c1ccc(F)cc1	914598286	WPZOWLMLLLZTMM-KRWDZBQOSA-N	435.423	1.269	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)[C@H]1CCCN(S(=O)(=O)c2ccccc2)C1	915270375	VHIBBFUMTWTOEN-INIZCTEOSA-N	447.513	1.322	50	20	IDGD	
O=C(CS(=O)(=O)c1cccc(Br)c1)NNC(=O)c1cccc([N+](=O)[O-])c1	915594869	GWAGBULGWBCSGA-UHFFFAOYSA-N	442.247	1.592	50	20	IDGD	
CCC(CC)[C@H](CNC(=O)NNC(=O)c1csc(N2CCOCC2)n1)N1CCCC1	916256752	PSAGUVVIZVXUJC-KRWDZBQOSA-N	438.598	1.824	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)Cc2ccccc2OC)sc(C)c1C	916562074	KDYNAEJLFBTMDC-UHFFFAOYSA-N	433.486	1.879	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)CCn2cc(Cl)cn2)c1	917495897	FIZRIOOLNNVVNK-UHFFFAOYSA-N	427.914	1.418	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)CNC(=O)NCc1ccco1	917922518	UYFFNCMJAVZJGK-NSHDSACASA-N	439.266	1.456	50	20	IDGD	
C[C@H]1CCCN(S(=O)(=O)c2ccc(CNC(=O)NNC(=O)c3ccccc3O)cc2)C1	918227528	FXVFENVGHRNAMV-HNNXBMFYSA-N	446.529	1.957	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C2(S(=O)(=O)c3ccc(Cl)cc3)CC2)nc2ccccc21	919689953	IDODMLOEKUGKOZ-UHFFFAOYSA-N	446.916	1.923	50	20	IDGD	
COc1ccc(-n2ccc(C(=O)NNC(=O)c3sc(N4CCOCC4)nc3C)n2)cc1	919809911	JHLGDEISRKKFHT-UHFFFAOYSA-N	442.501	1.557	50	20	IDGD	
CCN1C(=O)c2ccc(C(=O)NNC(=O)CCc3ccc(OC)cc3)cc2S1(=O)=O	919836716	CQVIHNWGVNRKJD-UHFFFAOYSA-N	431.470	1.253	50	20	IDGD	
CNC(=O)NNC(=O)CCN(c1ccc(OC)cc1)S(=O)(=O)c1ccc(C)cc1C	919877875	FHQNPGXYRRJDPN-UHFFFAOYSA-N	434.518	1.858	50	20	IDGD	
CC(=O)NCCCNC(=O)/C(C#N)=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	920854333	YINNWQBOKKQOAR-LFIBNONCSA-N	442.907	1.628	50	20	IDGD	
O=C(CSc1ccc(Cl)cc1)NNC(=O)C1=CC=CN2CCS(=O)(=O)N=C12	921234851	KIKUCKMIHPDLSH-UHFFFAOYSA-N	426.907	1.077	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CC2(CC(=O)N3CCOCC3)CCCC2)cc1OC	1317689367	JEZCVYOQWFUHPW-UHFFFAOYSA-N	433.505	1.664	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)NC2CN(C(=O)OC(C)(C)C)C2)CC1	1318985859	ZUJVCUKRPYLHLE-UHFFFAOYSA-N	441.529	1.583	50	20	IDGD	
Cn1cnnc1SCC(=O)Nc1cccc(C(=O)NNC(=O)NCC(F)(F)F)c1	1325108986	ZXRLDLSXVKFUKA-UHFFFAOYSA-N	431.400	1.052	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc4n(n3)CCCO4)C2)C1	1778555515	CXVZOQNXYCPUPS-MSOLQXFVSA-N	431.320	1.345	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](C)Nc3cnccn3)C2)C1	1779053102	ZEQWEOFRCMSNQH-GLJUWKHASA-N	440.342	1.138	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc3ncccn3n1)C2	1779544294	UGIIXZOQRKBYLT-DYESRHJHSA-N	445.596	1.708	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3c(F)cncc3F)C2)C1	1779725256	JDEBDZYPEULXSA-APPDUMDISA-N	432.265	1.834	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2)c1ccc(-n2cccn2)cc1	1780972039	UDNLMSARRSASRH-NNMXDRDESA-N	446.935	1.600	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)C3CCC4(CC3)OCCO4)CCO2)C1	1781231859	GMFZHKDMBKGGCT-MOPGFXCFSA-N	449.375	1.986	50	20	IDGD	
O=C(c1cccc2c[nH]nc12)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781330614	CSGCATYWWOFIJT-WMLDXEAASA-N	425.258	1.697	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1cnn(C)c1)C2	1781904379	RIPULNMUFVGHMJ-GPMSIDNRSA-N	441.370	1.650	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc4cccnn4c3)C2)C1	1782381178	UAXAPOCMGQMXEG-LIRRHRJNSA-N	435.322	1.809	50	20	IDGD	
Cc1cc(CC(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](C)Br)C3)no1	1782464593	FZXOUUJQWUKRTM-DDUZABMNSA-N	428.327	1.823	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3c(C)nn(C)c3C)CCO2)C1	1783344537	UNKCAYKGEABJHH-KSSFIOAISA-N	427.343	1.654	50	20	IDGD	
Cc1ccn2ncc(C(=O)N3CCO[C@@]4(CCN(C(=O)[C@H](C)Br)C4)C3)c2c1	1783534743	OCBDQEJHWNIAFB-IFXJQAMLSA-N	435.322	1.870	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cc4cnccc4nc3C)CCO2)C1	1783876502	YGRAWYKXRIQHGU-DYESRHJHSA-N	432.908	1.636	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)Cc3cc(F)ccc3OC)CCO2)C1	1783878310	CWMBJAIAWWVQDL-OXJNMPFZSA-N	428.888	1.461	50	20	IDGD	
CSc1ccc(CC(=O)N2CCO[C@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc1	1783938091	SSHKTFATMHGZGG-QFIPXVFZSA-N	448.589	1.154	50	20	IDGD	
COc1ccc(CC(=O)N2CCO[C@]3(CCN(C(=O)C(Cl)Cl)C3)C2)c([N+](=O)[O-])c1	1783947016	LMPAWYFKGMUWQF-GOSISDBHSA-N	446.287	1.780	50	20	IDGD	
Cc1cc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCBr)C[C@@H]32)nn1C	1784240930	VESXACYQELLNIC-BPUTZDHNSA-N	427.343	1.036	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)Cc3ccc(O)cn3)C2)C1	1784644574	LENNTVZKLIUCGF-CRAIPNDOSA-N	426.311	1.333	50	20	IDGD	
CC(=O)Nc1ccccc1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1785100928	AMGGIZDZKDBUQG-CRAIPNDOSA-N	442.285	1.779	50	20	IDGD	
C[C@@H]1[C@H](C(=O)N2CC[C@@]3(CN(C(=O)[C@H](F)Cl)CCO3)C2)CCN1C(=O)OC(C)(C)C	1785745290	WOLIQFUCQKOMKV-ZOZBEKFXSA-N	447.935	1.996	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cn3cc(Cl)cn3)C[C@@H]21	1786405854	GIRFIXSKAPBVRF-UBHSHLNASA-N	433.734	1.301	50	20	IDGD	
Cc1ccn2c(=O)c(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]4C3)cnc2c1	1787447118	MAASKAFQNDWHPT-QEWYBTABSA-N	436.871	1.131	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC1(c2ccc(NC(=O)c3ccc(=O)oc3)cc2)CCC1	1787587791	HTJNBSJERNHVME-UHFFFAOYSA-N	447.451	1.700	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccnc(C)n3)[C@H]2C1	1787694819	APESFOPBSIFTSM-YXWQFLTLSA-N	425.327	1.552	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)[C@@H]3C[C@H]4CC[C@@H]3O4)CCC2)cc1)c1cccc(B(O)O)c1	1788149426	PYLQXHCXYVITIH-NJYVYQBISA-N	434.301	1.682	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)c1ccn(C(F)F)n1	1788940119	RLEZZPSTLWJULP-FSZOTQKASA-N	439.232	1.562	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)COc3ccc(O)cc3)C[C@@H]21)[C@H](F)Br	1789921221	CBZUUMRMBATNRC-SIUGBPQLSA-N	445.285	1.441	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)Oc3ccccn3)C[C@@H]21	1791065122	RIBQGGIIHJYDMQ-QRJUGERDSA-N	440.338	1.612	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4c(c3)CCN4C)C[C@@H]21	1791255002	YQRMCIZWNDZWRE-GNBUJSLZSA-N	435.952	1.526	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cccc([N+](=O)[O-])c1	1792421094	OIJHZXZYHROQNI-QOIYZWAUSA-N	444.315	1.963	50	20	IDGD	
Cc1ccc(OCCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)cc1	1792784459	KMFLFKHIKOBIIV-WKCHPHFGSA-N	436.317	1.396	50	20	IDGD	
CC(C)N1CCC[C@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)CBr	1792872929	HDGRQIZXCANLSQ-KSWRQPAISA-N	430.387	1.480	50	20	IDGD	
Cc1onc(-c2ccccc2)c1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](O)CCl	1792975897	BZGONVMREBECMD-KYHPRHEASA-N	433.892	1.453	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1noc2ccccc12	1796216022	KVBFVSRZXHZPIZ-MUJYYYPQSA-N	427.505	1.382	50	20	IDGD	
C[C@@H](Nc1ccccc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2	1797668765	GRULXPPWOUBBNZ-QUEVPRLRSA-N	428.302	1.767	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1[C@@H]2Sc3ccccc3[C@H]21	1797771860	SUKFITKUHUDSDG-OKRNVVFVSA-N	436.961	1.718	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccnc2c1OCO2	1798474088	WWHZVIQLTAHGPP-ZSMOCIRGSA-N	430.288	1.250	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/C(=O)NCc1ccccc1)C2	1799264889	RUQWUKSDVGOLNT-FQZNYOGHSA-N	433.936	1.466	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)c1ccc(OCC2CC2)cc1F	1799422108	MAXYGAWYHDFXGA-GTYSZEQSSA-N	440.899	1.417	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1cc2ccoc2cn1	1799881331	BTLJIJWMTWBEAN-BAESOJJISA-N	426.242	1.722	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)[S@](=O)c1ccccc1	1800213875	AEFGTNVEVNIQOM-IWLKUAPJSA-N	442.965	1.026	50	20	IDGD	
COc1cc(C)c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)c(C)c1	1800650832	KQIVKJMJCANSHJ-ACDBMABISA-N	436.317	1.557	50	20	IDGD	
Cc1ccccc1CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnccc1C(=O)NN)C2	1801770032	QACUDQDLSXVJKB-REPLKXPHSA-N	435.528	1.878	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)CN2CCOC2=O)[C@H]1c1cccnc1	1803338288	BMCOJCXGANOYFY-JGGQBBKZSA-N	439.310	1.323	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1803690843	UKKXPUWTQXNUKC-HOJAQTOUSA-N	443.740	1.489	50	20	IDGD	
O=C(CN1CCc2sccc2C1)N1CCC2(CCCN(C(=O)[C@H](O)CCl)C2)CC1	1805518544	TXHQYPPKKNOYSX-QGZVFWFLSA-N	440.009	1.937	50	20	IDGD	
C[C@H]1CC[C@H](C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)CC1	1807367860	NMJFCUCDKUNIHQ-LHWDRQQYSA-N	449.360	1.907	50	20	IDGD	
Cc1nc(C(=O)N2CCCC3(CCN(C(=O)c4ccc(B(O)O)cc4)CC3)C2)ccc1F	1807543732	XUXWVNSSDDTIDY-UHFFFAOYSA-N	439.296	1.368	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@H]1c1cccnc1	1808232222	LPIRRNSTKDAABI-XUXIUFHCSA-N	444.305	1.225	50	20	IDGD	
COCCn1nccc1C(=O)NC[C@@H]1CCN(C(=O)[C@@H](Cl)COC)[C@H]1c1cccnc1	1808638879	FTJYLIDNNMLMAK-LNLFQRSKSA-N	449.939	1.498	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccnnc2O)[C@H]1c1cccnc1)[C@@H](F)Br	1808675675	DDAWHGFNWDNQPO-FPMFFAJLSA-N	438.257	1.587	50	20	IDGD	
Cc1ccncc1C(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1808791260	HQEJAVKMONBUGT-GCJKJVERSA-N	438.532	1.478	50	20	IDGD	
Cc1ccc(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)cc1	1811960115	SVQTWKMIBNYEOU-GMAHTHKFSA-N	443.312	1.703	50	20	IDGD	
C=C(C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1)C(F)(F)F	1812682074	JLQRJWCMXOVCMA-YJBOKZPZSA-N	441.454	1.579	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)CSCC(=O)O)[C@H]1c1cccnc1	1813088702	LSWVIXOEBWMZNF-DETPVDSQSA-N	444.351	1.689	50	20	IDGD	
O=C(/C=C/C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](O)CCl)n[nH]1)NCc1ccco1	1814874202	YVBYFEWAUPPWCA-ZWOPJXCPSA-N	449.895	1.467	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1CCc2nc(NC(=O)CN3CCNC3=N)sc2C1	1814927624	INKLQDRSAWDTPS-ABKXIKBNSA-N	433.365	1.131	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(=O)n3[nH]cnc3n2)n[nH]1	1817466745	LTVXMXIOECJPDF-BXUZGUMPSA-N	446.899	1.854	50	20	IDGD	
Cc1cc(C)nc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)c1	1817471180	FQJJSNBUDVIKCU-HXUWFJFHSA-N	447.304	1.721	50	20	IDGD	
C=CCOCCCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1	1817474458	ROYOBROXTFUADC-LJQANCHMSA-N	440.309	1.378	50	20	IDGD	
Cc1ccn(C)c1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1820356445	BFGBYSBPHXFSNL-GOSISDBHSA-N	435.293	1.356	50	20	IDGD	
O=C(CC[C@H]1CCOC1)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1823028987	WASPHTXBCDVISH-HNAYVOBHSA-N	440.309	1.212	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC([C@H]2CCCCN2C(=O)CN2CCOC2=O)CC1	1824334189	ZDWPSBBOSVWYOC-QGZVFWFLSA-N	425.602	1.910	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@H]1CCc2nc(NC(=O)[C@H]3C[C@@H]3F)sc2C1	1824887384	XTPDNAMCJGTFIE-DEPXHDJCSA-N	432.481	1.547	50	20	IDGD	
Cc1cc(C)n(CCC(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@H](O)CCl)CC3)n1	1826573333	IDTKMZWJCQRSFF-TZMCWYRMSA-N	425.942	1.558	50	20	IDGD	
Cc1onc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)c1C	1827056110	SHVJGBIRHKTABF-HXUWFJFHSA-N	439.321	1.518	50	20	IDGD	
O=C([C@H]1CCC=CO1)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827057586	KPQDSNSCYHCAHS-LEWJYISDSA-N	426.322	1.292	50	20	IDGD	
Cc1ccncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827059467	QZFQWDYGUWGYPR-QFIPXVFZSA-N	435.333	1.617	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCCC[C@H]1C1CCN(C(=O)CCc2nc(N)n[nH]2)CC1	1829102821	NQFNAPZWIPRGPP-INIZCTEOSA-N	436.633	1.791	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4cn[nH]c4cn3)C2)C1	1830362400	VKQJIMIGCRSTFT-FQEVSTJZSA-N	435.912	1.293	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)Cc2ccc(O)cn2)CC1	1831877447	YDLRBQVGJSCAOF-FQEVSTJZSA-N	445.564	1.322	50	20	IDGD	
Cc1nc(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)cs1	1832972288	HYAVAHDRVBBQLG-SJKOYZFVSA-N	446.367	1.234	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)c1cccnc1Cl	1833007435	PGBIEQBVWITVFN-INIZCTEOSA-N	429.348	1.520	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)C3CCN(C)CC3)CC2)CC1	1833105546	HCVCZASGPXLJED-OAHLLOKOSA-N	443.430	1.683	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)NC2CCN(C3CCN(C(=O)[C@H](F)Cl)CC3)CC2)n1	1833924276	OKHOBRUIGMIOHV-SFHVURJKSA-N	439.919	1.760	50	20	IDGD	
CN(C)c1ccc(C(=O)NC2CCN(C3CCN(C(=O)[C@H](F)Cl)CC3)CC2)nc1	1834010751	FXWOVMBPFBHBIK-SFHVURJKSA-N	425.936	1.867	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H](O)c3ccccc3)CCO2)C1	1835291061	BMNVOAKSRGCUHN-PWIZWCRZSA-N	445.343	1.413	50	20	IDGD	
O=C(c1ccc(CO)c(F)c1)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836720254	NHMUEINEICZNEE-LJQANCHMSA-N	442.915	1.530	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)C[C@@H](NC)C(=O)O)CC2)CC1	1836918629	BAWKRVXNVHWMOU-DLBZAZTESA-N	431.961	1.455	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3c[nH]c4cnccc34)CCO2)C1	1837173599	ZXOVTBMSBHLDLJ-OAQYLSRUSA-N	434.924	1.898	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)/C=N/N3CCCCC3)CCO2)C1	1837445322	PNELIUCGLKYBDU-YMQCEMJTSA-N	449.379	1.151	50	20	IDGD	
COc1cc(C(=O)N2CCOC[C@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)ccn1	1837715483	SKMOYQMOMGIZLF-FQEVSTJZSA-N	437.569	1.012	50	20	IDGD	
C=CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)CCO2	1838528297	ONNUIQUFMPCDMP-OAQYLSRUSA-N	447.444	1.166	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)Cc3c(C)n[nH]c3C)CC2)CC1	1838657043	JJSGIXOLUFCTMN-LJQANCHMSA-N	440.972	1.821	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3CCC[C@@H](C(=O)OC)C3)C2)C1	1839149094	SZHKPUOZWFYVEY-DLRJPAPCSA-N	444.956	1.440	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc4ccoc4cn3)CCO2)C1	1839487140	SNTVKMYGQGRQEG-MGPUTAFESA-N	437.880	1.152	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3cc(C)ccc3C)CCO2)C1	1839936274	QYTUTHDAYNSNHN-DENIHFKCSA-N	438.952	1.556	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C)no3)C2)C1	1839963847	YGKMJNKYVSPYGR-GUYCJALGSA-N	430.299	1.227	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3(F)CCCCC3)C2)C1	1840033498	HSPMZLDXBOFLKA-YOEHRIQHSA-N	435.334	1.899	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4sccn4c3)C2)C1	1840151968	SLKDFRYAFTZYOK-DNVCBOLYSA-N	441.937	1.325	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cccc(F)c3F)C2)C1	1840156160	OOMJFWAAZYJJEU-QRWLVFNGSA-N	446.878	1.218	50	20	IDGD	
COCCOCCOCCC(=O)N1CC2(CCCN2C(=O)[C@H](C)CBr)C1	1841289140	MCERAGWUHQNALG-OAHLLOKOSA-N	435.359	1.291	50	20	IDGD	
CC#C[C@H](CC(=O)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1)c1ccc(O)cc1	1843015223	UQECZZIGMOJUDL-LJQANCHMSA-N	446.312	1.086	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@H]2COCCN2C(=O)OC(C)(C)C)C1	1843347364	OJLLWVZRVXCGAJ-GJZGRUSLSA-N	429.945	1.843	50	20	IDGD	
Cc1cc(NC(=O)CC(=O)N2CCCC23CN(C(=O)[C@@H](C)CBr)C3)no1	1843399540	RUKGWQAZZDAGFZ-NSHDSACASA-N	427.299	1.546	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)[C@@H]1C[C@H]1c1ccc(F)cc1)C2	1844263178	BPHFVWLQUVQJEU-ZWKOTPCHSA-N	437.475	1.445	50	20	IDGD	
Cc1nn[nH]c1C(=O)N1CC2(CCCN2C(=O)[C@H](Br)Cc2ccccc2)C1	1845941071	CKUXIJUYALWZQS-OAHLLOKOSA-N	432.322	1.936	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC2(CCCN2C(=O)[C@@H]2C[C@H]3CC[C@@H]2O3)C1	1846204180	AERFPPGPNIDTKN-WCVJEAGWSA-N	441.956	1.889	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)CCN1C(=O)Cc3ccccc3C1=O)C2	1846360356	ILXPTDJERNRTSE-KRWDZBQOSA-N	447.919	1.059	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)c1c(F)ccc(Cl)c1F)C2	1846386103	CGHDQNIKWVGBPR-UHFFFAOYSA-N	428.867	1.808	50	20	IDGD	
C#CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)[C@@H](C)Br)C2	1847071681	WSDRACQBVMIWIJ-KGLIPLIRSA-N	442.354	1.890	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](O)CCl)C[C@H]2C[C@H]21	1847558211	JESFOQQMYHZWSY-HIFUNWJGSA-N	427.929	1.186	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H](CC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](O)CCl)C1	1847564391	VCYYFUDPJIVYSC-YHUYYLMFSA-N	429.945	1.435	50	20	IDGD	
CC(C)CC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccc3c(c2)OCO3)c1	10161186	PHOCNPOSENWCOX-UHFFFAOYSA-N	433.486	1.701	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)c1nc(-c2cccs2)n(-c2ccccc2)n1	11002983	XMEIPUDQZPQFKO-LBPRGKRZSA-N	431.499	1.192	50	20	IDGD	
O=C(NNC(=O)c1cc2ccccc2[nH]c1=O)c1cccc(S(=O)(=O)N2CCCC2)c1	11660585	WTZLORYPFDXEHG-UHFFFAOYSA-N	440.481	1.387	50	20	IDGD	
CCS(=O)(=O)c1ccccc1C(=O)NNC(=O)c1sc(N2CCOCC2)nc1C	24396709	FDPLRATZGOOMDM-UHFFFAOYSA-N	438.531	1.157	50	20	IDGD	
COc1ccnc(NNC(=O)c2cc(OC)c(OC)cc2I)n1	110169583	NFJMYGIWBOMXFU-UHFFFAOYSA-N	430.202	1.864	50	20	IDGD	
CC[C@@H](C)C(=O)N1Cc2ccccc2C[C@@H]1C(=O)NNC(=O)CNC(=O)c1ccco1	725742046	ZBKNWYIWDJVQAA-RHSMWYFYSA-N	426.473	1.156	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)N1CCC(C(=O)c2cc(F)ccc2F)CC1	725871937	SQWKGUJPRYXPPX-UHFFFAOYSA-N	434.399	1.623	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NCCSC(C)(C)C)nc2)CC1	727608743	WKBVWKGEXCPTHV-UHFFFAOYSA-N	430.600	1.176	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)Nc2ccc(C(=O)NCCN3CCOCC3)cc2)cc(C#N)n1C	727806696	YMECCWMSVFDQFB-MOSHPQCFSA-N	446.511	1.813	50	20	IDGD	
Cc1cccc(-n2c(C)cc(/C=C(\C#N)C(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)c2C)c1	728382357	IMAMQFKGQNZTGI-HDZGYNCQSA-N	440.525	1.892	50	20	IDGD	
O=C(NNC(=O)c1cccc(OC(F)F)c1)Nc1ccc(CN2C(=O)CNC2=O)cc1	728593424	WBODXPSHDWMTMU-UHFFFAOYSA-N	433.371	1.806	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)NCC(C)(C)N2CCOCC2)c1	728740196	JNDXIWPARGIAHC-UHFFFAOYSA-N	429.315	1.513	50	20	IDGD	
COCCCN1CCC(NC(=O)NNC(=O)c2cc(OC)ccc2Br)CC1	728751979	YDKMTCAAMHVJDG-UHFFFAOYSA-N	443.342	1.903	50	20	IDGD	
O=C1Nc2cccc(Br)c2C1=NNC(=O)C1CCN(c2ncccn2)CC1	728783543	VHFOPIUASLOGCH-UHFFFAOYSA-N	429.278	1.928	50	20	IDGD	
COc1ccccc1OCCCNC(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	729231529	YIOWPHRRSHSJRR-UHFFFAOYSA-N	425.445	2.000	50	20	IDGD	
COC(=O)c1ccc(S(=O)(=O)NNC(=O)Cn2ccc3ccccc32)c([N+](=O)[O-])c1	729667254	LLSJXOHRSJYCRY-UHFFFAOYSA-N	432.414	1.346	50	20	IDGD	
COc1cc(C(=O)NN[C@@H](C(N)=O)c2ccc(Br)cc2)cc(OC)c1OC	729677177	ZUAVEPYDRFQVJY-OAHLLOKOSA-N	438.278	1.936	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)[C@H]2CCCN(S(=O)(=O)Cc3ccccc3)C2)cc1	730585716	LCWWMFQRCKGKKO-IBGZPJMESA-N	444.557	1.796	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)CCCS(=O)(=O)c1ccc(Br)cc1	730999626	XNFVBFVXLPZWCX-UHFFFAOYSA-N	428.308	1.803	50	20	IDGD	
O=C(Cc1ccc(S(=O)(=O)N2CCCCC2)cc1)NNC(=O)Cc1ccccc1F	731330324	JYDFXJNUXKBXMG-UHFFFAOYSA-N	433.505	1.933	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)NCCCN(C(=O)C2CCC2)C2CC2)nc2ccccc21	731406920	ZVAKHPSEJHOERN-UHFFFAOYSA-N	426.521	1.627	50	20	IDGD	
O=C(NCc1cccc(S(=O)(=O)NCc2cccc(F)c2)c1)NNC(=O)C1CCC1	732240457	VGIMYHOWGZASDF-UHFFFAOYSA-N	434.493	1.935	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCC(=O)NCc2ccccc2)cc1Br	732255834	OSSYPGLFGMYHFT-UHFFFAOYSA-N	435.278	1.718	50	20	IDGD	
Cc1cccc(-n2nnc(C(=O)OCC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)c2C)c1	732328625	CAGPNMXIMYLXGX-UHFFFAOYSA-N	438.400	1.410	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)c1ccccc1NS(=O)(=O)C(F)(F)F	732751603	RFOOEOBFFRQUPS-UHFFFAOYSA-N	435.355	1.927	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)NCC1CCN(S(=O)(=O)C(F)F)CC1	733045394	LHBSUGIRHKUADF-UHFFFAOYSA-N	448.492	1.223	50	20	IDGD	
COc1ccc(S(=O)(=O)C[C@H](C)C(=O)NNC(=O)NCCc2cccs2)cc1	735038096	FJPPSXBDVGVAGM-ZDUSSCGKSA-N	425.532	1.740	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2ccc3ncccc3c2)CC1	735117152	CAFMZGPXBOKARG-UHFFFAOYSA-N	426.502	1.323	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)COCc1ccccc1)c1cccc(S(=O)(=O)N(C)C)c1	739006252	RNBDJKMRSRULIC-OAHLLOKOSA-N	434.518	1.545	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)CC[S@](=O)c1ccc2c(c1)OCCO2	740749411	XXXJRPYBBQLFJC-OSXTUODASA-N	436.461	1.710	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)c2ccc(CNS(=O)(=O)CC)cc2)cc1	741661241	CPBLULCGWFDDIL-HNNXBMFYSA-N	449.529	1.753	50	20	IDGD	
CC(=O)Nc1cccc(-n2nnnc2SCC(=O)NNC(=O)c2ccc(C#N)cc2)c1	742451356	UDKGUOROBIDUPP-UHFFFAOYSA-N	436.457	1.046	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@@H](C)n2nnc(-c3ccccc3)n2)cc(OC)c1OC	742471995	JGGPGTHFVXYZQV-GFCCVEGCSA-N	426.433	1.388	50	20	IDGD	
CC(C)[C@H](NC1CCOCC1)C(=O)NNC(=O)COc1ccc(Br)cc1	743282765	RHENNNXUFLLTKI-KRWDZBQOSA-N	428.327	1.769	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NCc2ccccc2Cn2cccn2)cc1	743508073	YGXAJEPJYOJIME-UHFFFAOYSA-N	442.501	1.871	50	20	IDGD	
C[C@@H]1CN(c2ccc(C(=O)NNC(=O)Nc3ccc(S(C)(=O)=O)cc3)cn2)C[C@@H](C)O1	743830971	NUINUDCLMOTJEK-ZIAGYGMSSA-N	447.517	1.565	50	20	IDGD	
CC[S@@](=O)c1ccccc1C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	744620077	BNAQLZMHEQMOFT-MUUNZHRXSA-N	437.543	1.592	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)NC[C@@H]2CN(Cc3ccccc3)CCO2)cc1	745289074	FYQWGGHGXBROQD-HXUWFJFHSA-N	426.521	1.989	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)c2cc(S(=O)(=O)N3CCCC3)ccc2O)c1	745990657	GFBKOUMZDWCKKU-UHFFFAOYSA-N	447.513	1.634	50	20	IDGD	
Cc1sc2nc(CS[C@H](C)C(=O)NNC(=O)N3CCOCC3)nc(O)c2c1C	745992076	UMZHVIANYXCLQE-LLVKDONJSA-N	425.536	1.708	50	20	IDGD	
CN(C)C(=O)NNC(=O)c1cc(S(=O)(=O)N2CCCCC2)ccc1Br	746012893	OGMRJVUNUXTKBO-UHFFFAOYSA-N	433.328	1.540	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)N[C@H]1CCCN(CC(F)(F)F)C1=O	746340163	WLGLFURDSQMFIM-LBPRGKRZSA-N	432.399	1.348	50	20	IDGD	
CCOc1ccc(/C=C(\C#N)C(=O)N2CCN(S(=O)(=O)CCOC(C)C)CC2)cc1	746871925	NRKUWZLSAZQNQJ-XDJHFCHBSA-N	435.546	1.891	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)NCC1CCN(Cc2ccccc2Cl)CC1	748627634	KCPCZARJUSIWLR-OAHLLOKOSA-N	426.945	1.934	50	20	IDGD	
COc1cc(F)cc(NNC(=O)Cc2ccc(S(=O)(=O)N3CCOCC3)s2)c1	748911545	IZYRAGFLHCKCAR-UHFFFAOYSA-N	429.495	1.603	50	20	IDGD	
CS(=O)(=O)c1cc(C(=O)NNC(=O)COc2ccccc2F)ccc1Br	749160231	HEJMSBAVDJTEFU-UHFFFAOYSA-N	445.266	1.832	50	20	IDGD	
CC[C@H](CS(=O)(=O)c1ccccc1)NC(=O)NNC(=O)COc1ccc(C#N)cc1	752704614	OMLJTCAMJHYWDG-MRXNPFEDSA-N	430.486	1.520	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)N[C@H]1CCN(c2ccccn2)C1	753125624	YELSJGKBHHTOHV-AWEZNQCLSA-N	434.294	1.832	50	20	IDGD	
C[C@@H]1C[C@@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)CN1C1CC1	753943794	QQEAEIBAXPABRX-GDBMZVCRSA-N	435.550	1.040	50	20	IDGD	
CCCN(CCC)S(=O)(=O)N1CCN(C(=O)/C(C#N)=C/c2cc(C#N)n(C)c2C)CC1	754716913	FIGFAPUGAWCTJC-CPNJWEJPSA-N	446.577	1.623	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Cc2cc[nH]n2)cc1S(=O)(=O)N[C@H]1CCCC[C@@H]1C	755268783	IAWPTSLNXUMLEY-BBRMVZONSA-N	449.533	1.279	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(N(C)C)c(NC(=O)NNC(=O)c2cccn2C)c1	755436203	YWUWJOLICKLQGK-UHFFFAOYSA-N	436.538	1.588	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccc(N2C[C@H]3CC[C@H]2C3)cc1	756162490	BVQHXXKXCFQSGB-KSSFIOAISA-N	426.448	1.979	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)Nc2ccccc2CN2C(=O)CCC2=O)cc1	756220140	CTYBRYRTLZGLCC-UHFFFAOYSA-N	426.429	1.576	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)Nc1cc(F)cc(N2CCOCC2)c1	756278898	ACAMHFADTLQGBN-UHFFFAOYSA-N	426.408	1.778	50	20	IDGD	
Cc1c(NC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cccc1S(=O)(=O)NC1CC1	756707175	VFDMVZLJONNQIN-QGZVFWFLSA-N	446.485	1.428	50	20	IDGD	
COCCCNC(=O)NNC(=O)[C@@H]1CCC(=O)N1Cc1ccc(Br)cc1	756814469	ZTMHVSJLCYKYJF-AWEZNQCLSA-N	427.299	1.307	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)Nc1ccc(C[C@H]2CC(=O)NC2=O)cc1	756815944	PLAQWVRETKLPBN-OCCSQVGLSA-N	428.420	1.651	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)C(F)(F)c2c(F)cccc2F)cc1	756864986	ZMPOGGSGEBXOCL-UHFFFAOYSA-N	447.410	1.833	50	20	IDGD	
CCCCN1C(=O)CC[C@H](C(=O)NNc2ccc(C(N)=O)nn2)[C@@H]1c1ccc(OC)cc1	757408031	PAFVFFRCOKJWGE-JXFKEZNVSA-N	440.504	1.807	50	20	IDGD	
CN(c1ccccc1NC(=O)NNC(=O)c1cc(-c2ccccc2)[nH]n1)S(C)(=O)=O	757660748	JSMLZTSOVGOGHK-UHFFFAOYSA-N	428.474	1.939	50	20	IDGD	
Nc1ncc([N+](=O)[O-])cc1C(=O)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1	757939675	VJFYMJYSGDHCSN-FQEVSTJZSA-N	446.467	1.960	50	20	IDGD	
O=C(c1cccc(Nc2ncccn2)c1)N1CCN(S(=O)(=O)CBr)CC1	758522000	CGLNVQVUSPBTPL-UHFFFAOYSA-N	440.323	1.660	50	20	IDGD	
O=C(NCc1ccc(COCC(F)(F)F)cc1)NNC(=O)C(=O)Nc1ccccn1	758684699	GJRZDIRNANGYIE-UHFFFAOYSA-N	425.367	1.630	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(F)(F)[C@H](C(=O)OCC(=O)NNC(=O)c2ccccc2)C1	759286471	BNPSPQKVZNRIHH-AWEZNQCLSA-N	441.431	1.883	50	20	IDGD	
CCO[C@@H]1C[C@H](NC(=O)NNC(=O)c2nn(CC)c(=O)c3ccccc23)[C@]12CCCO2	760141714	HGPGRMIEZINXBH-GCKMJXCFSA-N	429.477	1.087	50	20	IDGD	
Cc1c(I)cccc1C(=O)NNC(=O)CCN1C[C@@H](C)O[C@H](C)C1	760986467	ALLGVUUCCPDTCH-VXGBXAGGSA-N	445.301	1.860	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)[C@@H](C(C)C)N3CCCS3(=O)=O)n[nH]2)c1	763176009	VOZGHMYHKWMKSS-GOSISDBHSA-N	433.534	1.515	50	20	IDGD	
C[C@H]1C[C@H](C(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)CCC1=O	763273065	XOKNPNHDBVNXPO-MAUKXSAKSA-N	443.525	1.931	50	20	IDGD	
COc1ccc(CNC(C)=O)cc1S(=O)(=O)NNC(=O)CSc1ccccc1O	763398299	MBPKJJMNDPTKIO-UHFFFAOYSA-N	439.515	1.139	50	20	IDGD	
O=C(NNC(=O)c1cccnc1)C(=O)Nc1cc(Br)ccc1N1CCOCC1	763490610	ALLFWXRGLAHGRR-UHFFFAOYSA-N	448.277	1.080	50	20	IDGD	
CN(C)C(=O)C[C@H]1CN(C(=O)C(=O)NNC(=O)c2ccccc2O)c2ccc(Cl)cc21	763525331	AEGMYSACQISVRU-LBPRGKRZSA-N	444.875	1.415	50	20	IDGD	
O=C(NNC(=O)C1CC1)C(=O)Nc1ccc(CN2C(=O)Cc3ccc(Cl)cc32)cc1	763558486	JFKONIFWWZIIHU-UHFFFAOYSA-N	426.860	1.925	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)N3C[C@H](C)O[C@H](C)C3)cc2)c(C)o1	763576197	IFHULZMQDPGIGV-OKILXGFUSA-N	442.472	1.546	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)Nc1cc(F)c(N2CCCC2)c(F)c1	763576479	AUXOSWUHTACFIR-QGZVFWFLSA-N	446.410	1.491	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(-n3cnnn3)cc2)c(C)n1-c1ccccc1	763603389	ZZRYFNNFVNLYLJ-UHFFFAOYSA-N	444.455	1.470	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(OCC(F)(F)F)nc2)c1	763618933	JMAAHDQGICAUOH-UHFFFAOYSA-N	426.351	1.496	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)cc(OC)c1C(C)C	763674945	QLKGESFHIJZVMX-UHFFFAOYSA-N	440.456	1.864	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2F)n(-c2ccc(F)cc2)n1	763682947	SBHCTPUQEBZURP-UHFFFAOYSA-N	429.383	1.624	50	20	IDGD	
O=C(NNC(=O)C12CC3CC(CC(C3)C1)C2)C(=O)Nc1ccn(CCc2ccncc2)n1	763735699	QZOYVQDVHBTEPK-UHFFFAOYSA-N	436.516	1.823	50	20	IDGD	
O=C(NNC(=O)c1cc2c(s1)CCC2)C(=O)Nc1ccc(N2CCCC2=O)c(F)c1	763782824	WEQAECQBCYIBQQ-UHFFFAOYSA-N	430.461	1.902	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(N3C[C@@H](C)O[C@H](C)C3)nc2)cc1	763820496	IIZHFHYAKZVLTE-HZPDHXFCSA-N	441.488	1.169	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)CNC(=O)c2cccnc2)c2ccc(Br)cc2n1	763824431	PJZLCNDTMVYSFF-UHFFFAOYSA-N	442.273	1.892	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)c1cnn(-c2ccc(Cl)cc2Cl)c1	763825681	VJGCRIQGRFBJBQ-UHFFFAOYSA-N	433.255	1.765	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)N(C)C(=O)CO3)c1C	763840014	HLKKRCXBUJEXFV-AWEZNQCLSA-N	440.456	1.212	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccccc2-n2ccnn2)cc1	763861281	NJVYKYNNNNKCCM-CQSZACIVSA-N	438.444	1.219	50	20	IDGD	
CCc1nnc(-c2cccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc3ccc(F)cc3)c2)o1	763872055	JOKAORMFKXAXNL-GFCCVEGCSA-N	441.419	1.992	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccc(Oc3ncccc3C#N)cc2C)n1	763886153	RUBMNQSPPCFLIB-UHFFFAOYSA-N	447.455	1.653	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc([S@@](C)=O)c(F)c2)cc1OC	763900139	AZEJEHYGRULATE-SSEXGKCCSA-N	437.449	1.370	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cccc(CN(C)C)c2)ccc1OC(C)C	763916121	ILMFFNGJOVPGAE-UHFFFAOYSA-N	428.489	1.944	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc1	763950272	WKYFBUQOFLOATD-UHFFFAOYSA-N	439.428	1.003	50	20	IDGD	
COC(=O)COc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2OC)c1	764013111	VBGGDIJZQUTSST-UHFFFAOYSA-N	435.820	1.300	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc(Cl)cc1C(=O)N1CCCC1	764040056	CALXJJYNBDPPPI-UHFFFAOYSA-N	444.875	1.984	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(CC(F)(F)F)cc2)c1	764077801	NTQMJVQCVZMJDE-UHFFFAOYSA-N	443.403	1.595	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(NC(=O)C(=O)NNC(=O)CCC(C)C)ccc1C	764203538	UGXAKBJQZIUTBY-UHFFFAOYSA-N	426.539	1.548	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)C(=O)Nc2ccn(CC(F)F)n2)c1	764233319	XBTYKQVDSYHFHU-UHFFFAOYSA-N	446.208	1.319	50	20	IDGD	
CC(C)(C)S(=O)(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)c2cccc(C#N)c2)c1	764241861	MPRWNPUJFONSAB-UHFFFAOYSA-N	442.497	1.671	50	20	IDGD	
CCCCn1nccc1NC(=O)C(=O)NNC(=O)c1cc(F)ccc1Br	764276933	IUTYBBYHCMNNIA-UHFFFAOYSA-N	426.246	1.985	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)CCc3ccccc3O)cc2)C[C@@H](C)O1	764277599	FNUQKXWALRETPK-IYBDPMFKSA-N	440.500	1.725	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)c2cnn(C)c2)sc2c1CCCCC2	764358399	KCZRXOOHLUQXMU-UHFFFAOYSA-N	433.490	1.327	50	20	IDGD	
CN(CC(=O)NNC(=O)CSc1ccccc1O)S(=O)(=O)c1ccc(Cl)cc1	765247528	GYLDLJWXJYBSDZ-UHFFFAOYSA-N	443.934	1.606	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1cc(C(=O)N2C[C@@H](C)C[C@@H](C)C2)ccc1C	766261027	OBQNCUZARPTWLV-OKILXGFUSA-N	440.504	1.994	50	20	IDGD	
CCc1cc(NNC(=O)CNC(=O)CNC(=O)OC(C)(C)C)nc(-c2ccccn2)n1	767145444	SZUIPEIPYYMWQR-UHFFFAOYSA-N	429.481	1.185	50	20	IDGD	
CC(C)c1cc(NC(=O)C(=O)NNC(=O)C(C)(C)c2ccccc2)n(-c2ncccn2)n1	768242054	MQXSNBBBBCLIOD-UHFFFAOYSA-N	435.488	1.849	50	20	IDGD	
CCNC(=O)N(C)NC(=O)c1cccnc1SCC(=O)Nc1ccc2c(c1)OCO2	768412638	IOIZIWLIIJZEEM-UHFFFAOYSA-N	431.474	1.847	50	20	IDGD	
Cc1cnn(Cc2ccccc2F)c1NC(=O)C(=O)NNC(=O)COc1ccc(F)cc1	769266662	PHMQOANRFSZAEY-UHFFFAOYSA-N	443.410	1.683	50	20	IDGD	
CN1CC(=O)N(Cc2ccc(C(N)=O)cc2NC(=O)NNc2ccccc2Cl)C1=O	770061007	MEEUOOPWLBHNJP-UHFFFAOYSA-N	430.852	1.982	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(C)(C)N2C(=O)c3ccccc3C2=O)c2ccccc2c1=O	770209971	XOCGPFPBNNTGRI-UHFFFAOYSA-N	447.451	1.252	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)c1occc1CS(=O)(=O)c1ccccc1	771970617	ZBSFJKWXHAQVER-AWEZNQCLSA-N	436.486	1.992	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)c3cnn(CC(=O)NC4CCCC4)c3)nc21	772453199	AFPAUXDICAKNAJ-UHFFFAOYSA-N	441.496	1.299	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)C1(OCc2ccccc2)CCOCC1	772883448	AMIPSNNYULLGRH-UHFFFAOYSA-N	445.903	1.870	50	20	IDGD	
CCN1CCC[C@@H]1CN1C[C@@H](C(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)CC1=O	772997456	VDUPIYBABGSFLC-YQQAZPJKSA-N	436.940	1.588	50	20	IDGD	
O=C(CN1CCN(Cc2nc3ccccc3[nH]2)CC1)NNC(=O)c1cccc(Cl)c1	774734179	XQBXGYVSYOLKPO-UHFFFAOYSA-N	426.908	1.795	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2ccc3c(n2)CCCC3)c1	775105604	CQEDKCHJMOOTFT-UHFFFAOYSA-N	431.518	1.355	50	20	IDGD	
CN1CCN([C@@H](CNC(=O)NNc2cccc(S(C)(=O)=O)c2)c2cccs2)CC1	776609023	WZDFSMZMAZEFHY-KRWDZBQOSA-N	437.591	1.766	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)N[C@H](Cc2ccccc2)CN2CCOCC2)c1	776625715	YBSJLPPDIXLXSW-LJQANCHMSA-N	432.546	1.660	50	20	IDGD	
COC(=O)Cc1cccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1	777757369	LOOVPKXUNSQASW-UHFFFAOYSA-N	445.497	1.261	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@]2(C[C@H]2C(=O)NNC(=O)c2nnc(O)c3ccccc23)C1	780171282	KCOANTNUJBABLN-QKKBWIMNSA-N	427.461	1.744	50	20	IDGD	
CC[C@H]1C[C@@H](CC(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)CCO1	782118799	WHRZZLWOOIYENO-HOTGVXAUSA-N	425.555	1.056	50	20	IDGD	
CN1CCC(N(C)c2ccc(NC(=O)C(=O)NNc3ccc(-n4cccn4)nn3)cc2)CC1	783435804	AFBCGTZPGMSZHT-UHFFFAOYSA-N	449.519	1.275	50	20	IDGD	
CCN(CC)CCNC(=O)c1cc(NC(=O)C(=O)NNc2ccc(C)nn2)ccc1Cl	783952977	MSZRXZNJJDHLFL-UHFFFAOYSA-N	447.927	1.592	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)n(C(C)(C)C)n1	784210232	JCBGCCBOBMYCCG-UHFFFAOYSA-N	434.522	1.469	50	20	IDGD	
CC(=O)Nc1cccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)c1	784212773	GDUGVHIAEHKEHX-UHFFFAOYSA-N	431.474	1.168	50	20	IDGD	
O=C(NNc1ccnc(Br)c1)C(=O)Nc1ccc(CN2C(=O)CCC2=O)cc1	784838180	RUUPOXUWRXEKRL-UHFFFAOYSA-N	446.261	1.575	50	20	IDGD	
CCNC(=O)N1CCc2ccc(NC(=O)C(=O)NNc3ccc(C(F)(F)F)nn3)cc21	784886047	KMYXMAKLZGRHLL-UHFFFAOYSA-N	437.382	1.669	50	20	IDGD	
O=C(NNc1cc(F)c(F)c(F)c1)C(=O)Nc1cccc(S(=O)(=O)N2CCCC2)c1	785082759	IIFAUWLYZAKZRN-UHFFFAOYSA-N	442.419	1.970	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H]2[C@H](C(F)(F)F)[C@H]3CC[C@H]2O3)c1	785444575	JNPHNWWTSYILBR-AAVRWANBSA-N	435.424	1.054	50	20	IDGD	
CC[C@@]1(C)Oc2ccc(NC(=O)C(=O)NNC(=O)Cc3nc4ccccc4n3C)cc2O1	785994590	OEPSRBHZPBGHCZ-QFIPXVFZSA-N	437.456	1.799	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)cccc1N1CCNC1=O	787548352	DOPHPQHFGFFOJB-UHFFFAOYSA-N	443.485	1.108	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1cc([C@H]2CCCO2)nn1C	789740635	XYDKIUVHEDLNOP-CYBMUJFWSA-N	433.490	1.158	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cn(C)nc2-c2ccoc2)cc1	789869096	JVKOTMSMSYCPFT-UHFFFAOYSA-N	431.474	1.070	50	20	IDGD	
CCOc1cc(C=NNC(=O)N2CCN(C)CC2)ccc1OCC(=O)N1CCCCC1	790176471	QUYIGNVDBKRTFG-UHFFFAOYSA-N	431.537	1.768	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)c1c[nH]c2ncc(Br)cc12	792174821	NODDFBNFPOHHFA-UHFFFAOYSA-N	441.286	1.794	50	20	IDGD	
CCCCn1ncc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)c1C(C)C	792269698	UQNOVXSOYYXROK-UHFFFAOYSA-N	429.477	1.978	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)N1CCNC(=O)[C@H]1c1ccc(OC(F)(F)F)cc1	792361197	XGJIFGQNQHICHE-BLLLJJGKSA-N	430.427	1.640	50	20	IDGD	
O=C(NNc1nc2ccccn2n1)C(=O)Nc1ccc(-n2nccn2)cc1C(F)(F)F	792392281	YOHVQWZKTQVXJQ-UHFFFAOYSA-N	431.338	1.411	50	20	IDGD	
CCC(=NNC(=O)Cc1cc(O)nc(S)n1)c1ccc(Cl)c(S(N)(=O)=O)c1	794489150	XIPGRXAUDUSRSL-UHFFFAOYSA-N	429.911	1.245	50	20	IDGD	
NC(=O)Cc1occc1C(=O)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1	795864521	FUWLGSWXGURDDE-FQEVSTJZSA-N	432.480	1.696	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)[C@@H]1CCS(=O)(=O)c2ccccc21	795995039	UWCNGPSWQPALMC-QGZVFWFLSA-N	435.527	1.532	50	20	IDGD	
Cc1ccc(N2CCOCC2)cc1NC(=O)C(=O)NNC(=O)c1ccc2ccccc2n1	797536197	UMOZFJVKLKHBFE-UHFFFAOYSA-N	433.468	1.780	50	20	IDGD	
CC1=C(C(=O)NNC(=O)c2cc(-c3ccco3)nc3ccccc23)S(=O)(=O)CCO1	798273276	WQJNMAQNWUQVGT-UHFFFAOYSA-N	427.438	1.932	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@@H]2C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1	798437735	NPJVUDOLLWFACA-HXUWFJFHSA-N	433.468	1.947	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@H]2C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc1	799099816	FERHRVXWYPINSE-SFHVURJKSA-N	449.467	1.652	50	20	IDGD	
CCc1oc(C=NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cc1C(=O)OC	800814013	FYLWSODXCLZTKK-UHFFFAOYSA-N	426.473	1.537	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2[C@H](C)OC(C)(C)N2C(=O)OC(C)(C)C)cc1	801106324	UUDDHLGINCHDBS-DZGCQCFKSA-N	434.493	1.841	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(C)(C)[C@@H]1C(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	802065764	BHAJSMYMFPEFNN-AWEZNQCLSA-N	440.522	1.888	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@H]2CC(c3cc(F)ccc3F)=NO2)cc1	802066659	UVVOXNFKUMFYDZ-MRXNPFEDSA-N	438.412	1.714	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)N[C@@H]1CCCN(C(=O)CCC(F)(F)F)C1	804867490	CPBVWTADXUCBCH-CYBMUJFWSA-N	446.426	1.738	50	20	IDGD	
COCCCOc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(C)cc2O)cc1OC	806976827	XKLJGYPGCQQTHZ-UHFFFAOYSA-N	431.445	1.524	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cccc3c2OCC(=O)N3)ccc1OC(C)C	810386065	KVSMMXFPJKYHDE-UHFFFAOYSA-N	442.428	1.213	50	20	IDGD	
COC(=O)c1c(F)ccc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)c1F	810387292	OFFQTRDQSMGBSE-UHFFFAOYSA-N	439.396	1.335	50	20	IDGD	
CCOCCCn1c(NNC(=O)[C@@H]2CCc3nnn(C)c3C2)nc2ccccc2c1=O	810398658	GAHZHTUSFNCTMF-CQSZACIVSA-N	425.493	1.200	50	20	IDGD	
CC(C)Nc1ccc(S(=O)(=O)NCC(=O)NNc2cccc(C#N)c2)cc1[N+](=O)[O-]	810679263	OSRXSSPULOCVGN-UHFFFAOYSA-N	432.462	1.708	50	20	IDGD	
CSC1(CNC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)CCN(C)CC1	812550298	YQHDLXQZDKGJQI-UHFFFAOYSA-N	448.637	1.357	50	20	IDGD	
CC/C=C(\C)C(=O)N1CSC[C@@H]1C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	812730383	GUUFDZPMKIOLJZ-MSXUNZPYSA-N	426.564	1.638	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)[C@@H]1OCCc2sccc21	814210623	HSMAHVZPQMRATH-PXAZEXFGSA-N	437.543	1.710	50	20	IDGD	
Cc1nsc(NC2CC2)c1C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	815826923	FZFQIVVJDDWUFN-UHFFFAOYSA-N	442.545	1.245	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)c2cccc(CN3C(=O)CNC3=O)c2)cc1	822564473	FZCNUPYNWDMTTK-CQSZACIVSA-N	440.456	1.366	50	20	IDGD	
Cc1noc2ncc(C(=O)NNC(=O)c3cccc(S(=O)(=O)N4CCCC4)c3)cc12	879298021	UGLIPQKTIASCDW-UHFFFAOYSA-N	429.458	1.391	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)c2cnc3c(c2)c(O)nc(=O)n3C)cc1OC	894112961	KYBMMMACNOGAEH-UHFFFAOYSA-N	441.444	1.296	50	20	IDGD	
COC(=O)c1c[nH]nc1S(=O)(=O)NNC(=O)c1ccc(OCCC(C)C)c(OC)c1	912521665	NBVCHSOETOCRNN-UHFFFAOYSA-N	440.478	1.253	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NN=C2CCS(=O)(=O)C2)c1	912776509	IBVIZBVPNCJVRA-UHFFFAOYSA-N	437.499	1.400	50	20	IDGD	
Cc1ccccc1-n1ncc(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)c1C	914749155	FISRXHOQGJVLJO-UHFFFAOYSA-N	426.502	1.857	50	20	IDGD	
Cc1nn(C)c2[nH]c(=O)c(CCC(=O)NNC(=O)[C@H](C)Oc3ccc(F)cc3)c(C)c12	914846645	PRWVZYGGRCWLGD-ZDUSSCGKSA-N	429.452	1.565	50	20	IDGD	
COc1cc(OC)c(OC)cc1CNC(=O)NNC(=O)COc1ccccc1[N+](=O)[O-]	915919257	OIGMYRADAAYVNV-UHFFFAOYSA-N	434.405	1.530	50	20	IDGD	
CC(=NNC(=O)c1ccncc1)c1ccc(S(=O)(=O)N2CCCC[C@H]2C(=O)O)cc1	916242874	KOJRNCXUXPBLCM-SFHVURJKSA-N	430.486	1.863	50	20	IDGD	
O=C(COC(=O)c1cc(-c2cccs2)[nH]n1)NNC(=O)[C@@H]1COc2ccccc2O1	917257888	VFLJTTOCEPTBHZ-HNNXBMFYSA-N	428.426	1.282	50	20	IDGD	
C[C@@H](SCc1ccccc1)C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	917284098	DIUDZIQCODLZKT-RDTXWAMCSA-N	430.482	1.839	50	20	IDGD	
O=C(NNC(=O)N1CCC(CC(=O)N2CCCC2)CC1)c1cc(Br)c[nH]1	918002792	WFNDBOMVJXDXFJ-UHFFFAOYSA-N	426.315	1.856	50	20	IDGD	
C[C@H](Sc1cc(Cl)ccc1Cl)C(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1	919885054	JOKYVZQNSHBDQB-WPRPVWTQSA-N	426.347	1.992	50	20	IDGD	
O=C(CNC(=O)c1cc(Cl)ccn1)NNC(=O)COc1ccc(Br)cc1	1317729353	VPVAISFEFFMBOE-UHFFFAOYSA-N	441.669	1.454	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)c2ccccc2c1=O	1320882651	SNSFGSCFCJGTSP-UHFFFAOYSA-N	428.489	1.947	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCC(=O)NNC(=O)COc2ccc(C)c(C)c2)cc1	1321876049	LZALBGCUHDRIBB-UHFFFAOYSA-N	435.502	1.207	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)(C)O	1343727866	ZIAPTBICCYUBCM-OAHLLOKOSA-N	427.523	1.599	50	20	IDGD	
O=C(c1ccc2cnccc2n1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1777737223	UZCOSDUAOGJZGE-CRAIPNDOSA-N	437.269	1.764	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cn4ncccc4n3)C2)C1	1777953492	QQDIFNIHCOHEMU-QZTJIDSGSA-N	426.304	1.409	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](C)N3CSCSC3)C2)C1	1779147541	CCSLMQATBPJUMC-ZQIUZPCESA-N	438.015	1.113	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(CCN(C(=O)c3ccc(-n4cccn4)nc3)C2)C1	1779688704	KKZHETJXDFIXEW-LJQANCHMSA-N	448.321	1.496	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C13CC(C(=O)OC)(C1)C3)C2	1780709828	WTRKUHIOXHVCBR-GJWIZFIESA-N	426.941	1.861	50	20	IDGD	
COc1cncc(CCC(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)c1	1781327024	WGTTZBHWYPBRBI-AEFFLSMTSA-N	444.301	1.543	50	20	IDGD	
O=C(c1cnc2snnc2c1)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781333254	FJBWXWDBVJLFAO-ABAIWWIYSA-N	444.286	1.220	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(OC(F)F)cn3)CCO2)C1	1783531898	FJCCFAIWAIAIRQ-DIFFPNOSSA-N	448.264	1.910	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)Cc3ccc4c(c3)CCO4)CCO2)C1	1783540136	SFPZQDCSGGDDCJ-JLTOFOAXSA-N	437.334	1.777	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3c[nH]c4ccc(OC)nc34)CCO2)C1	1783880591	DKUNRTKHGGPANE-XOBRGWDASA-N	436.896	1.269	50	20	IDGD	
Cc1n[nH]c(C)c1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]2C1	1783970480	UIPCVGJMYKTTNM-HJPIBITLSA-N	427.343	1.651	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(-c4cnco4)c3)C[C@@H]21)[C@H](O)CCl	1784091951	FWMCDCNBGWCECR-BMFAXAFESA-N	433.892	1.535	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(S(C)(=O)=O)c(F)c3)C2)C1	1785227335	JOGVLDFJVSXJTO-IFXJQAMLSA-N	446.928	1.690	50	20	IDGD	
N#Cc1ccc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCBr)[C@H]3C2)cc1	1786404328	FCMXEGARVIETIN-BZSNNMDCSA-N	434.334	1.865	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3nccc4[nH]ccc34)[C@H]2C1	1787337721	BNXLRQFACFDTBT-DUPGQFARSA-N	435.322	1.940	50	20	IDGD	
Cn1ncc(Br)c1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]2C1	1787446787	CLDPGPKSLUCJGB-PZEZNAACSA-N	437.697	1.310	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(F)cnc3Cl)[C@H]2C1	1788849376	ORIXIZKOOSJSDV-HPEDKQMDSA-N	434.295	1.721	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3n[nH]c4c3CC[C@@H]4C)C[C@@H]21	1791055976	LBSBZOCQANBECN-YLXLXVFQSA-N	439.354	1.836	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(CO)c(F)c3)C[C@@H]21	1791065523	ZUGPNPNHHSOFSY-SIUGBPQLSA-N	443.313	1.695	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(C(F)(F)F)c[nH]3)C[C@@H]21	1791254029	IWNZSGJZNQUNNL-DNVSUFBTSA-N	437.846	1.881	50	20	IDGD	
C=C1C[C@@H](C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](O)CCl)N(C(=O)OC(C)(C)C)C1	1793116165	HJICJVODLMUIPJ-BQJWPVKWSA-N	441.956	1.790	50	20	IDGD	
CC(C)(C)OC(=O)N1CC=C(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Cl)C3)C1	1793224767	OYLSSJCPFYAAPI-XGUBFFRZSA-N	431.892	1.288	50	20	IDGD	
C=CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2	1793597153	DRBCAHPLYMLVTA-XLWJZTARSA-N	433.908	1.580	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](Br)Cc1ccccc1)C2)[C@@H]1C[C@@H]1F	1793674231	WAWOTSUDZBSREV-NWCWSAAOSA-N	439.325	1.940	50	20	IDGD	
CC(C)(C)OC(=O)N(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Cl)C1CC1	1796360853	BSWILFCCNYAGPD-NOXHYTERSA-N	433.908	1.510	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2cn[nH]c2cn1	1797580749	PNMFQMIFNCKPJD-ABXQLRGKSA-N	426.304	1.397	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1nc2c(=O)[nH]c3ccccc3n2n1	1797659744	NIIBELQWVDNQOB-XJFOESAGSA-N	442.907	1.840	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccn(C(F)F)c1=O)C2	1797956868	IHYZWYKYBRUTJH-YWVIFJGQSA-N	443.523	1.298	50	20	IDGD	
Cn1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)C(C)(C)CCl)C3)c(C(F)(F)F)n1	1798106301	KWPUBCBBLPKFJX-PTEHBNRSSA-N	436.862	1.907	50	20	IDGD	
COc1cccc(OC)c1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Br	1799348550	KAEPPSJFVVZSLH-OJXGSEEGSA-N	445.285	1.598	50	20	IDGD	
COC[C@H](C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN(C)NC(=O)NCc1ccccc1	1799865630	FJZCKTGLCSLFTK-FFGOWVMKSA-N	445.564	1.253	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc2nccn12	1799996396	AGXIYYLBBIAFKS-LOUJCGABSA-N	435.322	1.711	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cn1nccn1	1800244967	OTPKWPRGDLVODB-QDMKHBRRSA-N	442.432	1.064	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1Cc2[nH]nc(C(F)(F)F)c2C1	1800320341	CTCCDJLQXJXVHN-IMTAKKMFSA-N	448.873	1.750	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc3c1OCCO3)C2	1800757855	RRASQOWJZNVHQC-NFFDBFGFSA-N	439.306	1.444	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c(cnn3C)c1)C2	1800759340	MCZWPJJUNMMKLB-FIUQPQMISA-N	435.322	1.560	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1[nH]cnc1-c1cccnc1)C2	1800760259	LJIQAERLRCIDRQ-MHEUCROKSA-N	448.321	1.458	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1cnc3[nH]ccc3c1)C2	1800763100	OCQPDXXDMQVXIB-GMLZMKKNSA-N	449.349	1.869	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1coc([Si](C)(C)C)c1)C2	1800976710	DENXRVBBDDKOKD-JYYAWHABSA-N	428.989	1.282	50	20	IDGD	
C[C@H](S)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](Br)Cc1ccccc1)C2	1800987439	QNBZZBJCCHHPGM-RDDKANTKSA-N	441.391	1.901	50	20	IDGD	
COc1cccc(OC)c1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCC(=O)NN(C)C	1802336410	MXMMQCCEDSNXTB-MUJYYYPQSA-N	432.521	1.329	50	20	IDGD	
CC(C)(C)OC(=O)NCC[C@@H](O)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C(Cl)Cl	1802346131	BVCASSXKIWHZQE-YVECIDJPSA-N	438.352	1.704	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc3nccnc3c2)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803142913	MSLKSCXBGBKPMB-FFZOFVMBSA-N	439.903	1.944	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1ccccc1O	1805196382	IZQNTZYYOUGDBY-XMSQKQJNSA-N	445.284	1.100	50	20	IDGD	
Cc1ccc(=O)n(C(C)(C)C(=O)N2CC[C@H](CNC(=O)[C@@H](F)Cl)[C@H]2c2cccnc2)n1	1808313597	IIVAONNAFBEQNF-KBAYOESNSA-N	449.914	1.922	50	20	IDGD	
CC(=O)N/C(C)=C/C(=O)N1CC[C@H](CNC(=O)CO[Si](C)(C)C)[C@H]1c1cccnc1	1810544708	QVKUSEDKTZFFKE-PTUDVVCWSA-N	432.597	1.979	50	20	IDGD	
O=C(COc1ccccc1F)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1	1812779470	XWRMAYSHQQTNSU-KNBMTAEXSA-N	435.883	1.905	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)c2cc(O)n(C)n2)[C@@H]1c1cccnc1	1812864445	HYBFXZQEQANGKO-NORZTCDRSA-N	436.310	1.624	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)C[C@H](N)c2cccnc2)[C@@H]1c1cccnc1	1813032035	UFONXSDZWBKKMA-VNYTWHDVSA-N	445.951	1.826	50	20	IDGD	
O=C(CNC(=O)C(F)(F)F)NC[C@H]1CCN(C(=O)C(Cl)Cl)[C@H]1c1cccnc1	1813100924	KAFSQYWXMPTXAQ-PWSUYJOCSA-N	441.237	1.570	50	20	IDGD	
C[C@H](CBr)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CC[C@H](N)C(N)=O)[nH]n1	1814781082	WAGKHAVMXZEHOK-MDZLAQPJSA-N	443.346	1.026	50	20	IDGD	
CC(=O)N[C@H](C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1)C(C)(C)C	1815057529	YCBAYMXKMNMNGX-IIAWOOMASA-N	427.933	1.552	50	20	IDGD	
O=C(C[C@@H]1CCCCO1)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1815602008	FABGMDSYULDXND-HKUYNNGSSA-N	440.309	1.355	50	20	IDGD	
Cn1nc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)[C@@H](F)Br)[nH]n2)cc1O	1816123236	LUQPEFWOXCNXFZ-ZWNOBZJWSA-N	429.250	1.845	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(=O)n3[nH]cnc3n2)n[nH]1	1817466746	LTVXMXIOECJPDF-FZMZJTMJSA-N	446.899	1.854	50	20	IDGD	
Cc1noc(C)c1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1	1817473226	MSCHLCALOWQZCU-QGZVFWFLSA-N	437.265	1.314	50	20	IDGD	
O=C(Cc1ccsc1)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1817584059	PSWGBTGMZBZRRY-GOSISDBHSA-N	438.318	1.700	50	20	IDGD	
C=CCNC(=O)/C=C\C(=O)N[C@@H]1CCc2nc(NC(=O)CO[Si](C)(C)C)sc2C1	1820158288	JGTZXPDSNRJTOL-LJTDUEICSA-N	436.610	1.765	50	20	IDGD	
CC[C@@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](Cc2cnc[nH]2)NC(C)=O)[nH]n1	1820859947	IBAIVCAMFNHUKO-DJIMGWMZSA-N	449.943	1.890	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(=O)ccn3C)sc2C1	1821318518	CSZWNCZIPJMFPQ-NXEZZACHSA-N	439.335	1.851	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)Cn2cc([N+](=O)[O-])cn2)[nH]n1	1822367379	MVIXYFFXFYBSTP-JSGCOSHPSA-N	439.860	1.461	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)C(C)(C)CNC(C)=O)[nH]n1	1822372140	ZJZJJVIDVIXILP-ZFWWWQNUSA-N	427.933	1.818	50	20	IDGD	
CCOCCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[nH]n1	1822930802	KTAZTWQDVSXPDC-ZZQPOVDQSA-N	443.508	1.962	50	20	IDGD	
CC(C)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnccc1C(=O)NN)CC2	1825140276	SPVAJXHJCAYKMM-GFCCVEGCSA-N	430.534	1.804	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cncc(F)c1)CC2	1826080550	QGHPSDUJEGIIJA-CYBMUJFWSA-N	434.497	1.276	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827058636	ZNKRIZKKWDYIBC-FQEVSTJZSA-N	446.429	1.451	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)[C@H]2CCC=CO2)CC1	1828892136	FZSBFWCHZBIIGF-NHCUHLMSSA-N	426.322	1.292	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)ccn1	1829251016	YHBYJXKRAWCOLH-HXUWFJFHSA-N	429.565	1.996	50	20	IDGD	
O=C(C#Cc1ccc(Cl)cc1)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1830469809	HPOLFAPSEDZTDK-LJQANCHMSA-N	445.730	1.952	50	20	IDGD	
CC(C)[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1)c1ccccc1	1830838398	QFIOTHSDNHWSKD-DXIQSLLYSA-N	438.952	1.482	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CCC(N)=O)CC1	1831405480	MWJPPPYJYBMKGV-BIKZULFDSA-N	444.536	1.006	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4nccn4c3)C2)C1	1831647521	XCUSONUBDASFCJ-LAUBAEHRSA-N	434.924	1.812	50	20	IDGD	
CC(F)(F)C(C)(C)C(=O)N1CCO[C@@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1	1831682774	PBHFVKMEXZKMHH-LJQANCHMSA-N	436.572	1.976	50	20	IDGD	
COc1cc(CCC(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)ccn1	1832594820	QUDZCBSFWTVQPW-IEBWSBKVSA-N	429.876	1.014	50	20	IDGD	
Cc1ccc(C(=O)NCC(=O)N2CCCC[C@@H]2C2CCN(C(=O)[C@H](O)CCl)CC2)cc1	1832911294	ZHUHQXCCPHYLOS-WOJBJXKFSA-N	449.979	1.944	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)Cc3ccc4c(c3)CCC4)CC2)CC1)[C@H](O)CCl	1833307844	ALZWICLBIFMGNT-JOCHJYFZSA-N	448.007	1.889	50	20	IDGD	
CC[C@@H](C)[C@@H](N)C(=O)N1CCC(N2CCC(NC(=O)CCBr)CC2)CC1	1834421893	RQGRTERKAIKTIV-RDTXWAMCSA-N	431.419	1.716	50	20	IDGD	
C=C[C@@H](O)C(C)(C)C(=O)NC1CCN(C2CCN(C(=O)[C@H](C)Br)CC2)CC1	1835717588	FDVSADCRIMNHHC-WMLDXEAASA-N	444.414	1.915	50	20	IDGD	
O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)C1(F)CCCCC1)CCO2	1836613663	JDMBZIFBLCVIRH-QGZVFWFLSA-N	435.334	1.900	50	20	IDGD	
CC(=O)N[C@H](C)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](C)CBr)CC2)CC1	1836674753	ZFFJZNLRFQFKTC-UONOGXRCSA-N	446.386	1.541	50	20	IDGD	
O=C(c1cc2cccnn2c1)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836718870	FYBOMNFHJHASHR-IBGZPJMESA-N	434.924	1.546	50	20	IDGD	
C=CC[C@H](C(=C)C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)Br)C2)C1	1837312145	VALNWGQEGPYOCY-GPMSIDNRSA-N	429.355	1.995	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)c3cnccn3)CC2)CC1	1837412813	QWSZNEKDQGTGGQ-CYBMUJFWSA-N	425.327	1.872	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)o1	1837454839	MMAXBZMBPDSXQR-QGZVFWFLSA-N	434.276	1.112	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)c(C)n1C	1838385727	ZHPIYPVNWFIFLD-VQTJNVASSA-N	446.375	1.948	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(C#N)c[nH]3)C2)C1	1839153872	UJWLDPWZBQKMKF-ROUUACIJSA-N	429.304	1.193	50	20	IDGD	
N#Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)c(Cl)c1	1839423479	DGUFELOBTUJGLC-YJBOKZPZSA-N	430.263	1.816	50	20	IDGD	
CCc1nc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)co1	1840033533	IHICUIJXYNJZTC-SJKOYZFVSA-N	430.299	1.090	50	20	IDGD	
O=C(c1nnsc1C1CC1)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840187833	ZNTLMEBOJSAYKG-INIZCTEOSA-N	435.333	1.289	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)c(Cl)c1	1840734554	VFGOBSNZNPFPFH-YJBOKZPZSA-N	435.279	1.953	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)C1CCSCC1)CCO2	1840924725	CRGYWWXFQMUEDQ-LJQANCHMSA-N	430.643	1.438	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)c2ncc(Cl)cc2Cl)C1	1840999211	ORVKETWNEYGNDF-UHFFFAOYSA-N	434.088	1.199	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)Cc2c(F)ccc(F)c2F)C1	1841774155	OEEMDUBRNKIDII-UHFFFAOYSA-N	426.439	1.223	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1cc3ccccn3n1)C2	1843415912	BJUWHGNSUFAJEP-BUVRLJJBSA-N	433.472	1.285	50	20	IDGD	
O=C([C@H](F)Br)N1CC2(CCCN2C(=O)[C@H]2ON=C(c3ccccc3)O2)C1	1844198661	WVPJPYUGYGMFRR-BLLLJJGKSA-N	426.242	1.615	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2ccc(F)nc2C)C1	1844575844	GAXYRLQELOSNRO-AFUMVMLFSA-N	426.452	1.480	50	20	IDGD	
CN(C[C@@H]1COc2ccccc2O1)C(=O)NNC(=O)c1csc(N2CCOCC2)n1	9789936	MQKSZVOUYHHVQO-CYBMUJFWSA-N	433.490	1.106	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)c1sc(N2CCOCC2)nc1C	14890498	ABOJKCVPUJQQPT-UHFFFAOYSA-N	428.518	1.661	50	20	IDGD	
CCOc1c(Br)cc(C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)cc1OC	15639596	FPRRLEHYSFNRJE-SECBINFHSA-N	435.296	1.052	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc1	15948137	JXWNJOQQCQJREG-UHFFFAOYSA-N	431.514	1.874	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)C1=Cc2cc(Br)ccc2OC1	22887079	PHSUMMSMPSMKRU-UHFFFAOYSA-N	441.245	1.662	50	20	IDGD	
COc1ccc([N+](=O)[O-])cc1NS(=O)(=O)c1ccc(C(=O)NNC(=O)C(C)C)cc1	23723340	HXYITLRTEJUAJI-UHFFFAOYSA-N	436.446	1.821	50	20	IDGD	
Cc1cc(C)c(S(=O)(=O)NCCC(=O)NNC(=O)c2ccc3c(c2)OCO3)c(C)c1	26690045	XYWBLFNYETVMPN-UHFFFAOYSA-N	433.486	1.470	50	20	IDGD	
C#CCNS(=O)(=O)c1ccc(C(=O)NNC(=O)[C@@H](C)Oc2ccc(OCC)cc2)cc1	28318854	KWFHVIBAKIKDIH-OAHLLOKOSA-N	445.497	1.225	50	20	IDGD	
Cc1ccccc1C(=O)N[C@@H](CC(C)C)C(=O)NNC(=O)CNC(=O)c1cccs1	725741459	NMNVXGQFSZXBJI-INIZCTEOSA-N	430.530	1.778	50	20	IDGD	
CC(C)COC[C@@H](NC(=O)NNC(=O)c1csc(N2CCOCC2)n1)c1ccco1	725868447	UVPPXONZTUWQBD-CQSZACIVSA-N	437.522	1.931	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2cccc(C(=O)NNC(=S)NCC3CCC3)c2)C[C@H](C)O1	727866999	KRZQLMNBFOSEDR-KBPBESRZSA-N	440.591	1.394	50	20	IDGD	
CN(C)C(=O)[C@H]1CCCN1CCCNC(=O)NNC(=O)c1cccc(OC(F)F)c1	728751117	ITUXHUOWAPAFHA-OAHLLOKOSA-N	427.452	1.175	50	20	IDGD	
CCc1c(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cnn1Cc1ccccc1	728845507	KEPXCOMPQGDVKD-UHFFFAOYSA-N	433.516	1.961	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)C1	728847708	MACHKMKKWHDXAO-INIZCTEOSA-N	432.525	1.488	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC(NC(=O)NNC(=O)c3cccc(C#N)c3)CC2)cc1	729045056	LWTBLVOMPKNRBA-UHFFFAOYSA-N	441.513	1.664	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)NCc1ccc(CN2CCC(O)CC2)cc1	729494069	HDTOPZYBHSCYMR-UHFFFAOYSA-N	442.516	1.561	50	20	IDGD	
CC[C@@H](C)NS(=O)(=O)c1ccc(C(=O)NNC(=S)Nc2ccc(OC)nc2)cc1	729692945	ABGYKWIRVYAZKC-GFCCVEGCSA-N	437.547	1.798	50	20	IDGD	
COc1ccc(N(C)S(=O)(=O)c2cccc(C(=O)NNC(=O)Cc3cc[nH]n3)c2)cc1	730102801	NCVMLLBZQFNXPF-UHFFFAOYSA-N	443.485	1.247	50	20	IDGD	
CC1CCN(S(=O)(=O)c2ccc(C(=O)N([C@H]3CCS(=O)(=O)C3)N(C)C)s2)CC1	730161901	NDENCFZKVBOYEH-AWEZNQCLSA-N	449.620	1.275	50	20	IDGD	
O=C(CCNC(=O)NC12CC3CC(CC(C3)C1)C2)NNC(=O)COc1ccccc1O	730778052	AQXMXTJCEKTXRF-UHFFFAOYSA-N	430.505	1.577	50	20	IDGD	
CC(C)(C)C(=O)NNC(=O)N1CCN(S(=O)(=O)c2cccc(Br)c2)CC1	731499378	RJOGWEYXFACFTO-UHFFFAOYSA-N	447.355	1.542	50	20	IDGD	
CN(C)c1ccc(NC(=S)NNC(=O)c2cn(-c3cccc([N+](=O)[O-])c3)nn2)cc1	731500427	DSTFUOXXMPZRJG-UHFFFAOYSA-N	426.462	1.873	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)NC2CCN(CC(=O)N(C)C)CC2)c(C)n1C[C@@H]1CCCO1	731655620	QZEXNFLPMNGKQR-IMEWXKHHSA-N	441.576	1.860	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)CNC(=O)OCC(F)(F)F)c2ccccc2c1=O	732053876	ZXBJFQPSNPGUGD-UHFFFAOYSA-N	429.355	1.027	50	20	IDGD	
COCCCN1CCC(NC(=O)NNC(=O)c2ccc(OC)c(Br)c2)CC1	732461054	LOTVSYLTLUQNCZ-UHFFFAOYSA-N	443.342	1.903	50	20	IDGD	
O=C(Cn1ncn2nccc2c1=O)NNC(=S)Nc1cc(C(F)(F)F)ccc1Cl	732829043	ZWLVQJAMRJFDMK-UHFFFAOYSA-N	445.814	1.581	50	20	IDGD	
COc1ccc(OCCCS(=O)(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1	733122952	KCPRYAAWSNKWJZ-UHFFFAOYSA-N	430.486	1.914	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)c1cccc(S(=O)(=O)NCC2CC2)c1	733170077	OJDOPVTYZXFERU-UHFFFAOYSA-N	439.497	1.635	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NC[C@@H]2OCCc3ccccc32)cc1	733651486	JVYDCDBPIQMGFD-IBGZPJMESA-N	446.529	1.260	50	20	IDGD	
Cc1cc(C)c(N2C[C@H](C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)CC2=O)c(C)c1	734239106	HGGGFAXDNLUNLP-MRXNPFEDSA-N	447.536	1.820	50	20	IDGD	
COCCOc1ccc(-n2nc(C)c(C(=O)NNC(=O)CCc3ccccc3O)n2)cc1	735115759	NXXPKBGYUIKRRG-UHFFFAOYSA-N	439.472	1.700	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)C2(c3ccc(Cl)cc3)CC2)CC1	735117931	JMRSMLOAJKUBJH-UHFFFAOYSA-N	449.964	1.846	50	20	IDGD	
O=C(NNC(=O)c1cccc(-n2cccn2)n1)c1cccc(S(=O)(=O)N2CCCC2)c1	736455342	PZYCHGPYKHPAOQ-UHFFFAOYSA-N	440.485	1.127	50	20	IDGD	
CCCn1c(CCC(=O)NNc2ccnc(N(C)C)n2)nc2cc(S(N)(=O)=O)ccc21	740102149	CYSIJWOHFKETOW-UHFFFAOYSA-N	446.537	1.026	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)[C@H]1CCCN(C(=O)COc2ccccc2)C1	741172007	GKEMDZXUNYRXDM-JXFKEZNVSA-N	439.468	1.291	50	20	IDGD	
CC(=NNC(=O)C[C@H](C(=O)NN=C(C)c1ccc(C)o1)N1CCOCC1)c1ccc(C)o1	741766124	JNFSQIISYWMZBH-GOSISDBHSA-N	443.504	1.961	50	20	IDGD	
CCC(CC)[C@H](C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)N1CCOCC1	742034075	XEKBTSLKIKORIX-HSZRJFAPSA-N	445.608	1.483	50	20	IDGD	
CCc1nncn1CCNC(=O)NNC(=O)[C@H](C)Oc1cccc(Br)c1	743521273	QHZPQXMAEUHCKX-NSHDSACASA-N	425.287	1.401	50	20	IDGD	
Cc1nn(C)c2ncc(C(=O)NNc3ccccc3S(=O)(=O)N3CCOCC3)cc12	744621324	PWTPXXHVJMFCFT-UHFFFAOYSA-N	430.490	1.055	50	20	IDGD	
COC(=O)c1ccc(COc2ccc(C=NNC(=O)C(=O)NC3CC3)cc2OC)cc1	744824186	SBTGHRRAHGBXDW-UHFFFAOYSA-N	425.441	1.790	50	20	IDGD	
O=C(NCc1ccc(N2CCCCC2=O)cc1)NNC(=O)c1cc([N+](=O)[O-])ccc1O	745744080	SHRKIIHEKKBTJI-UHFFFAOYSA-N	427.417	1.962	50	20	IDGD	
CC[C@H]1Oc2cc([C@H](C)NC(=O)NNC(=O)CNC(=O)c3cccs3)ccc2NC1=O	745929307	BXFHJTFODZEHIW-SMDDNHRTSA-N	445.501	1.679	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@H]1CCCN1Cc1ccccn1	746097803	NJIOUVOVFJQCHE-MRXNPFEDSA-N	430.534	1.109	50	20	IDGD	
CN(C)[C@H]1CCC[C@@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)C1	749592861	WXYRKPFPKJMBFF-SJORKVTESA-N	437.566	1.288	50	20	IDGD	
COc1ccccc1N1CC[C@@H](CNC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)C1	749932905	ZTXJORLBTFEAFA-HNNXBMFYSA-N	446.529	1.569	50	20	IDGD	
CO[C@@H](C)c1noc(CN2CCCN(C(=O)/C(C#N)=C/c3cc(C#N)n(C)c3C)CC2)n1	750114909	UJRPZNXLYFHBFU-HKJBKDEOSA-N	437.504	1.937	50	20	IDGD	
CNC(=O)Cc1noc(COC(=O)/C(C#N)=C/c2cn(CCC#N)nc2-c2ccccc2)n1	750303822	HEFYZYCJTRLRDL-MHWRWJLKSA-N	445.439	1.786	50	20	IDGD	
CS(=O)(=O)NCCc1ccc(C(=O)COC(=O)/C(C#N)=C/c2ccc(O)cc2)s1	750667282	XCOKVSIINUJOSF-GXDHUFHOSA-N	434.495	1.878	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)c1nn(-c2ccccc2F)c2c1CCC2	751207052	YKEWQHAFSGEVJJ-UHFFFAOYSA-N	427.461	1.753	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)CCc2c(C)nc(-c3cccnc3)nc2O)c1	751291461	VXRQBMFCVLQIOQ-UHFFFAOYSA-N	437.456	1.964	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)[C@@H]2CCCN(C(=O)c3ccc4n[nH]cc4c3)C2)cc1	751294668	QWDVEVWUYYQLOG-QGZVFWFLSA-N	435.484	1.950	50	20	IDGD	
O=C(C[C@@H]1CSCCS1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	751539786	ZOYWSJNEEFHIKO-CQSZACIVSA-N	429.589	1.471	50	20	IDGD	
O=C1CN(S(=O)(=O)c2cccc(C(=O)NNc3cc(Cl)ccc3Cl)c2)CCN1	752813420	WEDNJCPNBWHSMO-UHFFFAOYSA-N	443.312	1.871	50	20	IDGD	
Cc1ccc(C(=O)NNS(=O)(=O)c2ccc(S(=O)(=O)NCC(F)(F)F)cc2)o1	753081606	IAXWMPXHRWEBIG-UHFFFAOYSA-N	441.409	1.052	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)N[C@@H]1[C@@H]2CCO[C@H]2C12CCCC2	754837696	BCYDAMYCANQFNV-NUEKZKHPSA-N	435.550	1.580	50	20	IDGD	
N#Cc1ccccc1C=NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	755489114	DUMCSYXCENRUTF-UHFFFAOYSA-N	426.498	1.662	50	20	IDGD	
COC(=O)CNC(=O)Cc1ccc(NC(=O)NNC(=O)Cn2ccc3ccccc32)cc1	755862116	MWUBDBLQIAKNEJ-UHFFFAOYSA-N	437.456	1.326	50	20	IDGD	
CS(=O)(=O)Cc1ccc(NC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc1	756268285	ASQANKAVLSHZSS-UHFFFAOYSA-N	429.458	1.589	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Nc2ccc(OCCC(N)=O)cc2)cc(OC)c1OC	756501142	BJMXHBZLFDKRAH-UHFFFAOYSA-N	432.433	1.433	50	20	IDGD	
C[C@@H]1CCCN(CC(=O)NNC(=O)c2cccc(C#N)c2)[C@H]1CNC(=O)OC(C)(C)C	756548641	CAKVVUZOKQDLJF-QAPCUYQASA-N	429.521	1.944	50	20	IDGD	
Cc1c(NC(=O)NNC(=O)COCc2ccccc2)cccc1S(=O)(=O)NC1CC1	756703664	DDFZPEVQDBSSJJ-UHFFFAOYSA-N	432.502	1.805	50	20	IDGD	
O=C(COC(=O)CNC(=O)c1ccccc1C(F)(F)F)NNC(=O)c1cccs1	756729312	ZEOZRTPDHRTGLI-UHFFFAOYSA-N	429.376	1.501	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)NCc1ccc2c(c1)CCS2(=O)=O	757751936	UWIHEFJMDFIQKJ-UHFFFAOYSA-N	433.486	1.325	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1cn(Cc2ccccc2)nc1-c1cccs1	758041266	XTNLDYKAORHUSF-ZDUSSCGKSA-N	447.542	1.359	50	20	IDGD	
CS(=O)(=O)N1CCc2c(NC(=O)NNC(=O)Cc3c[nH]c4ccccc34)cccc21	758298516	GLBFFEHPVVOFPD-UHFFFAOYSA-N	427.486	1.885	50	20	IDGD	
Cn1cc(CCC(=O)N2CCN(S(=O)(=O)CBr)CC2)c2ccccc21	758522980	MIJCVGVSJSIFFX-UHFFFAOYSA-N	428.352	1.937	50	20	IDGD	
Cc1nn(Cc2ccc(Cl)cc2)c(C)c1C(=O)NNC(=O)C(=O)Nc1ccccn1	758834243	MDQRFKVIZYQYIN-UHFFFAOYSA-N	426.864	1.996	50	20	IDGD	
O=C(NNC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)c1ccccc1)C(=O)Nc1ccccn1	758835707	YFUKYDXBUJFLID-BZSNNMDCSA-N	435.484	1.641	50	20	IDGD	
C[C@@H]1CN(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)C[C@@H](c2ccsc2)O1	759718208	KCPHMCQAKMERLL-DOMZBBRYSA-N	437.547	1.858	50	20	IDGD	
Cc1ccc(S(N)(=O)=O)cc1NC(=O)COC(=O)/C(C#N)=C\c1cc(C#N)n(C)c1C	759879734	ZFHBYHNQXPTPBF-UUASQNMZSA-N	441.469	1.250	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1c[nH]c2ccc(Oc3ccccc3)cc2c1=O	760786793	CXDAERJXWVOEAU-CYBMUJFWSA-N	441.465	1.516	50	20	IDGD	
Cn1c(C(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)ccc1[N+](=O)[O-]	761816588	SDLYANUKNDYJHR-UHFFFAOYSA-N	449.470	1.870	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(/C#N)C(=O)NNc2nccc(N3CCOCC3)n2)c1C	762852071	QTDSVOIFVYYXPL-JJBLJPBOSA-N	439.520	1.989	50	20	IDGD	
Cc1ccccc1C(=O)N[C@H](CC(C)C)C(=O)NNc1nccc(N2CCOCC2)n1	762866273	DZRRXDVRWNTDSM-GOSISDBHSA-N	426.521	1.909	50	20	IDGD	
CCOc1ccc(C(=O)NNS(=O)(=O)c2cc(C)c(F)c(C(=O)O)c2)cc1OC	763278228	MVLSSCNMBAYBDQ-UHFFFAOYSA-N	426.422	1.863	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)NCCCN1C(=O)NC2(CCCCC2)C1=O	763458142	NJCKLQNVTZCJAD-UHFFFAOYSA-N	449.533	1.460	50	20	IDGD	
CN1CCN(Cc2cccc(NC(=O)C(=O)NNC(=O)c3c[nH]c4ccccc34)c2)CC1	763540850	LAXMIUFKIKISNL-UHFFFAOYSA-N	434.500	1.315	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2c[nH]c3ccccc23)c(OC)c(OC)c1	763541255	QKXUAEDUMQHJIN-UHFFFAOYSA-N	440.412	1.371	50	20	IDGD	
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC(=O)C(=O)NNC(=O)C1CC1	763563695	UCTHFHZMMMIHMK-UHFFFAOYSA-N	426.429	1.452	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)ccc1Br	763569404	AAAZAJMEIJJLHA-OAHLLOKOSA-N	434.246	1.683	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(NC(=O)C2CC2)ccc1C	763663606	WQQXRJMRRWZLIE-UHFFFAOYSA-N	440.456	1.517	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2OC)ccc1Cl	763664734	ZMBICYXZPSDQDV-UHFFFAOYSA-N	435.820	1.300	50	20	IDGD	
CC[C@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2F)cc1	763680767	VYJBABGJARFJBM-ZDUSSCGKSA-N	430.436	1.519	50	20	IDGD	
CCN(CC)C(=O)c1ccccc1NC(=O)C(=O)NNC(=O)COc1ccc(Cl)cc1	763684182	GMHGZXCRTKIKPU-UHFFFAOYSA-N	446.891	1.987	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)ccc1C(=O)NC(C)C	763686122	JZDKZTMSWOMLGF-UHFFFAOYSA-N	446.891	1.952	50	20	IDGD	
O=C1C[C@@H](c2cccc(NC(=O)C(=O)NNC(=O)CC34CC5CC(CC(C5)C3)C4)c2)CN1	763735971	PTXUBAXXVXIJSE-QQYMGJJXSA-N	438.528	1.983	50	20	IDGD	
CC(C)N(C)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)cc1F	763815026	ZXEPDKKMBHIWMT-UHFFFAOYSA-N	427.436	1.707	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)n(C2CCOCC2)n1	763851732	FRYRHJLIEZBBTI-INIZCTEOSA-N	443.504	1.713	50	20	IDGD	
CCc1nnc(-c2ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc3ccccc3F)cc2)o1	763856936	IYLFUZWZPZXNKR-LBPRGKRZSA-N	441.419	1.992	50	20	IDGD	
COc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccccc1F	763863880	DWMFSPBDXZGYHV-LBPRGKRZSA-N	446.435	1.090	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cnn(CC(F)(F)F)c2)cc1	763873041	RWDOPEQVDUZAKT-LLVKDONJSA-N	441.366	1.201	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)n(Cc2ccccc2)n1	763978570	LRUZTSPKBOYUFZ-UHFFFAOYSA-N	427.848	1.999	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)Nc1cc(CC(C)(C)C)nn1C	764003063	XJZWRMXTLBEQGH-UHFFFAOYSA-N	439.314	1.509	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cc(C)n(CCCOc3ccc(F)cc3)n2)n[nH]1	764106302	HVXROUGXHGWOCZ-UHFFFAOYSA-N	443.439	1.231	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(Sc3nnc(C)s3)cc2C)n[nH]1	764107059	XFGLUSMKKZSIEI-UHFFFAOYSA-N	431.503	1.737	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc([C@@H](C)N3CCOCC3)c2)c(O)c1	764110003	NOWFZLVYAQCKNT-OAHLLOKOSA-N	426.473	1.494	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2cc(F)ccc2OC[C@@H]2CCCO2)c1O	764133882	YSDVUPBXBFPONM-ZDUSSCGKSA-N	447.419	1.497	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2O1)C(=O)Nc1ccnn1-c1cccc(Cl)c1	764153959	NPGYEICKHIZGLC-INIZCTEOSA-N	425.832	1.615	50	20	IDGD	
CCc1ccc(NC(=O)C(=O)NNC(=O)CCCc2ccccc2)cc1S(N)(=O)=O	764227073	VJIMOPNVPATVGE-UHFFFAOYSA-N	432.502	1.005	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2O)cc1Br	764277128	HZBIIIVICWSDBM-UHFFFAOYSA-N	438.234	1.328	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)C(=O)Nc1ccccc1C(=O)N1C[C@@H](C)C[C@@H](C)C1	764298122	OABVVEXCOCJQRE-BETUJISGSA-N	426.477	1.236	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)N[C@H]2CCCC[C@H]2N2CCOCC2)cc1	764373979	ILEUVTJITVHZJG-LSTHTHJFSA-N	434.537	1.826	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)C(=O)Nc1ccc(OCc2noc(C3CC3)n2)cc1	764389787	ZLKKBSQKIDFPOF-UHFFFAOYSA-N	436.428	1.629	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)C(=O)Nc1ccc(-n2cccn2)c(F)c1	764394568	RKLCUPDMBRQJSR-UHFFFAOYSA-N	429.433	1.595	50	20	IDGD	
COC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)cc1F	764405623	UXEPDNUHYNNEEJ-UHFFFAOYSA-N	436.421	1.588	50	20	IDGD	
COc1cc(OC)c(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)cc1Cl	764405944	ZBZJDENYTDEZHX-UHFFFAOYSA-N	439.877	1.941	50	20	IDGD	
CC(=NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1)c1ccc(O)c(F)c1	764820399	YAABFHYTMAWUFV-UHFFFAOYSA-N	448.520	1.686	50	20	IDGD	
COCCSc1ccc([N+](=O)[O-])cc1C(=O)NNC(=O)c1cncc(NC(C)=O)c1	764944176	DZLZXSRDWYDPBQ-UHFFFAOYSA-N	433.446	1.762	50	20	IDGD	
Cc1nn2c(C=NNC(=O)c3ccc(S(=O)(=O)N4CCCC4)cc3)c(C)nc2s1	765558365	CGQUUMQPBSCGIF-UHFFFAOYSA-N	432.531	1.956	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1F	765635046	LLNJZBBJKORHRZ-UHFFFAOYSA-N	446.438	1.119	50	20	IDGD	
O=C(/C=C\SCc1ccco1)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765737596	GXFKIOYMHDLQFR-ZSOIEALJSA-N	428.514	1.632	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNS(=O)(=O)c1ccc(OC[C@@H]2CCOC2)c(F)c1	767473155	KKPFKVBNXNLMPD-GFCCVEGCSA-N	447.485	1.075	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C3=NN(c4ccccc4)[C@H](C(N)=O)C3)n[nH]2)cc1	768268728	TZOUZMVQWGMYAO-FQEVSTJZSA-N	445.483	1.520	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@H](NC3CCOCC3)C(C)C)CC2)cc1	768290587	KPPPWLGAFJPFHX-HSZRJFAPSA-N	445.608	1.053	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)c1cc(S(=O)(=O)N(C)C)ccc1F	768630380	RMVWDPLILJAHJQ-UHFFFAOYSA-N	445.494	1.245	50	20	IDGD	
CCOc1ccc(OCC)c(NC(=S)NNC(=O)c2ccc(S(N)(=O)=O)cn2)c1	769743165	AYHSZGWJOZKKGL-UHFFFAOYSA-N	439.519	1.158	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)CN3C(=O)COc4ccc(Cl)cc43)nc21	770966330	PZJPEAIJEXWNFB-UHFFFAOYSA-N	445.867	1.809	50	20	IDGD	
COc1cccc(-n2ccnc2SCC(=O)NNc2nc(O)c3cnn(C)c3n2)c1	770973659	OLMWTHSJVPOPGS-UHFFFAOYSA-N	426.462	1.499	50	20	IDGD	
COC(=O)c1ccc(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)c(F)c1	773231701	QZAFKVISACYPTF-UHFFFAOYSA-N	437.449	1.390	50	20	IDGD	
CC(=O)Nc1nc(C)c(S(=O)(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)s1	773265978	QUUCITSRLIYPRD-VIFPVBQESA-N	432.911	1.840	50	20	IDGD	
Nc1nc(Cl)cc(NNC(=O)[C@]23CCC(=O)N2c2ccccc2C(=O)N3C2CC2)n1	773863243	UIXRCUXCEDINKK-IBGZPJMESA-N	427.852	1.297	50	20	IDGD	
C=CCOc1cccnc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	775135142	FMSIDXYOLWGXHC-UHFFFAOYSA-N	444.513	1.896	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2N2CCOCC2)cc1	776311095	XCBQRXAQGSUMQI-UHFFFAOYSA-N	428.445	1.834	50	20	IDGD	
COC(=O)N1CCC([C@H](C)NC(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)CC1	777258696	SBXUJZOVFRNDNP-NSHDSACASA-N	434.501	1.780	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)[C@]3(F)CCN(C(=O)OCc4ccccc4)C3)nc21	777400133	SHARRTXBKILIQX-IBGZPJMESA-N	429.412	1.263	50	20	IDGD	
COc1ccc2[nH]cc(CC(=O)N3CCN(S(=O)(=O)CBr)CC3)c2c1	777780150	WSJCRKVIQPXUFL-UHFFFAOYSA-N	430.324	1.545	50	20	IDGD	
COc1ccc(N2CCN(C(=O)/C=C\C(=O)NNC(=O)c3ccccc3F)CC2)cc1	778218786	ZNUGDYBDUJKNJF-KHPPLWFESA-N	426.448	1.500	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)NNC(=O)CNC(=O)OC(C)(C)C)c(C)n1C[C@H]1CCCO1	778444866	ALXZBXBIUCARGA-WAFWZSCLSA-N	445.520	1.863	50	20	IDGD	
COC(=O)c1ccccc1NNC(=O)c1ccc2c(c1)SC1=NS(=O)(=O)CCN12	780730724	LMEIXULVQGRJSX-UHFFFAOYSA-N	432.483	1.842	50	20	IDGD	
CN(C)C(=O)C[C@H]1CN(C(=O)C(=O)NNc2ncncc2Cl)c2ccc(Cl)cc21	782160405	SANRLZROPUYEQI-JTQLQIEISA-N	437.287	1.835	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2[C@H]3CC[C@H]2CN(C(=O)OC(C)(C)C)CC3)n1	782512405	QBTUUXVDXVZCSI-GJZGRUSLSA-N	437.566	1.615	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)c(Br)c1	782887491	QMHISUMYCCZMMD-UHFFFAOYSA-N	444.289	1.973	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C(=O)Nc2ccc(F)cc2OC(F)F)nc2ccccc21	782894160	NMUWBIDXLHXULJ-UHFFFAOYSA-N	435.362	1.642	50	20	IDGD	
COC(=O)[C@@H]1CN(C(=O)C(=O)NNc2ccccc2Br)c2ccccc2O1	782983787	QSWKMEZOJQEJRB-HNNXBMFYSA-N	434.246	1.859	50	20	IDGD	
O=C(CN1CCOCC1)Nc1ccc(NC(=O)C(=O)NNc2ccc(Cl)cc2)cc1	783332901	FXMFKVMSWCKRRV-UHFFFAOYSA-N	431.880	1.693	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CNC(=O)c2cccs2)cc1OCC(F)F	784003656	KROJOQPQAQIPPC-UHFFFAOYSA-N	440.428	1.216	50	20	IDGD	
CC(C)Oc1c(F)cc(NC(=O)C(=O)NNC(=O)CNC(=O)c2cccs2)cc1F	784004070	TXRWXBMGPUJACI-UHFFFAOYSA-N	440.428	1.329	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)c(OCc2ccccc2)c1	784462735	IEHDBPUNPMGXKD-ZDUSSCGKSA-N	436.490	1.365	50	20	IDGD	
O=C(NNc1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(F)c(N2CCCS2(=O)=O)c1	784832001	WRWTVBDZSZAICK-UHFFFAOYSA-N	437.409	1.356	50	20	IDGD	
Cc1ccc(C(N)=O)cc1NC(=O)C(=O)NNc1ccccc1S(=O)(=O)NC(C)(C)C	784834242	YVPNYDSBFUDFFX-UHFFFAOYSA-N	447.517	1.253	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2cc3c(cc2SC)OCCO3)n1	785227056	ZLSBSYLNDWBNRF-UHFFFAOYSA-N	432.506	1.898	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2cnc3ccccc3n2)cc1C(=O)N1CCOCC1	787554138	GDTAUKZWBDJYBB-UHFFFAOYSA-N	434.456	1.492	50	20	IDGD	
COc1cc(NNC(=O)C(=O)Nc2cccc(S(=O)(=O)N(C)C)c2)ccc1Cl	789797726	FUHYCFRPWWWSFQ-UHFFFAOYSA-N	426.882	1.681	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NCCCCn1cc(Br)cn1	792224333	SPCRMLQREJGGIG-UHFFFAOYSA-N	443.327	1.248	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)cccc1NC(=O)N(C)C	792352143	BVEQPSRLNZSEBV-CYBMUJFWSA-N	445.451	1.781	50	20	IDGD	
COc1c(NC(=O)C(=O)NNC(=O)c2cccc3ncccc23)cc(Cl)cc1C(N)=O	793025820	OVPWQMJKBRDMNJ-UHFFFAOYSA-N	441.831	1.395	50	20	IDGD	
C[C@H](C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1)c1ccc2c(c1)OCO2	794181143	SLCPENLYBFHBLH-VIFPVBQESA-N	425.850	1.281	50	20	IDGD	
Cc1nc(COc2ccccc2C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)no1	794718245	YAJPTWUFMDGFIO-UHFFFAOYSA-N	431.474	1.964	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)N1CCNC(=O)[C@@H]1c1ccc(Br)cc1	796577907	ZHNHMDSJAQHNMR-LRDDRELGSA-N	425.327	1.504	50	20	IDGD	
CC(C)Oc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(N(C)C)c2)cc1C(N)=O	796989566	HPJFHPBPBAWUCO-UHFFFAOYSA-N	427.461	1.038	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNS(=O)(=O)c3ccc(C#N)s3)CC2)cc1	797817978	KBKFEFZKNXVNGZ-UHFFFAOYSA-N	433.559	1.056	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@H]2C(=O)OCC(=O)NNC(=O)c2cccc(C)c2)cc1	798791444	VDDSEDROFPPMCW-IBGZPJMESA-N	439.468	1.613	50	20	IDGD	
CCOc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NNC(=O)Cn1ccc2ccccc21	799258678	FTVSDDRCHSSWRO-UHFFFAOYSA-N	425.401	1.734	50	20	IDGD	
COC(=O)c1cccc(NC(=O)C(=O)NNC(=O)Cc2ccccc2OC)c1OC(C)C	799259377	ZMKBGCDECNRJMY-UHFFFAOYSA-N	443.456	1.598	50	20	IDGD	
O=C(NCCNS(=O)(=O)c1ccc(F)cc1F)NNC(=O)c1c[nH]c2ccccc12	799670426	AEYRESHZKRSJTO-UHFFFAOYSA-N	437.428	1.369	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)NCCC(=O)NNc2ccc3c(=O)[nH]ccc3c2)cc1	803429058	UVTIRXRQFNCXSB-UHFFFAOYSA-N	428.470	1.542	50	20	IDGD	
CN(C)S(=O)(=O)C[C@@H](NC(=O)NNC(=O)c1ccc2ccccc2n1)C(F)(F)F	805769741	TWCWMYAMUFMYDE-CYBMUJFWSA-N	433.412	1.001	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)C(=O)Nc1ccc(Cl)cc1OCC(F)F	807004975	ZJMFCOZOBXMXNP-UHFFFAOYSA-N	444.778	1.093	50	20	IDGD	
CN(C)[C@@H](CNC(=O)NNC(=O)c1csc(N2CCOCC2)n1)Cc1ccccc1	807006817	TYZFIGSNFPXVTP-MRXNPFEDSA-N	432.550	1.097	50	20	IDGD	
CN(C)c1c(C=NNC(=O)c2ccc(Br)cc2Cl)c(=O)n(C)c(=O)n1C	807970435	JUCHYTRRGUPWBN-UHFFFAOYSA-N	442.701	1.330	50	20	IDGD	
Cn1c(=O)c(CNC(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)cc2ccccc21	813835291	OAYDFIRHOIWTDZ-UHFFFAOYSA-N	436.476	1.965	50	20	IDGD	
CC(C)(C)c1csc(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)c1C#N	815565017	ADWDYHGFILTXAH-UHFFFAOYSA-N	425.470	1.954	50	20	IDGD	
Cc1cccc(Oc2ncccc2NC(=O)C(=O)NNC(=O)[C@@H]2CCc3nncn3C2)c1C	815691983	GVZDRZSGUALOMX-OAHLLOKOSA-N	449.471	1.431	50	20	IDGD	
N#Cc1cccc(Oc2ccc(NC(=O)C(=O)NNC(=O)[C@@H]3CCc4nncn4C3)cc2)c1	815692365	PMBKNHIVAQPRDL-OAHLLOKOSA-N	445.439	1.291	50	20	IDGD	
CN1CCC[C@@H](N(C)C(=O)c2ccc(NC(=O)C(=O)NNc3cccc(Cl)n3)cc2)C1	815726007	JQONHLYSOWTQBR-MRXNPFEDSA-N	444.923	1.983	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)c1cc2c(nc1O)CC(C)(C)CC2=O	817053839	IKMOJSYWYGKFIK-UHFFFAOYSA-N	432.502	1.950	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)Cn1nnc(-c2ccccc2)n1	849202135	SWHORVBPQBOMRG-LBPRGKRZSA-N	445.277	1.718	50	20	IDGD	
O=C(c1occc1CS(=O)(=O)c1ccc(Br)cc1)N1CC[C@@H](B(O)O)C1	864234309	PIEJIXIFFFMMPF-GFCCVEGCSA-N	442.096	1.705	50	20	IDGD	
O=C(NC[C@H](c1ccc(F)cc1)N1CCOCC1)NNC(=O)c1ccc2c(c1)OCCO2	915897375	DWNHBUMFDKTDJT-GOSISDBHSA-N	444.463	1.614	50	20	IDGD	
COc1cc(C(=O)NNC(=O)COc2ccc(C)cc2)ccc1OCC(=O)NC(C)C	916108824	IXRWAMAGYGHDKV-UHFFFAOYSA-N	429.473	1.747	50	20	IDGD	
CN(C(=O)C1CC1)c1ccccc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	916110323	WCDWAYSTURHBON-UHFFFAOYSA-N	444.513	1.385	50	20	IDGD	
CC(=NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1ccc2c(c1)OCO2	916258956	QBCLYCAORPRILO-UHFFFAOYSA-N	431.470	1.590	50	20	IDGD	
Cc1ccc(/C=C(\C#N)C(=O)OCC(=O)NCCc2ccc(S(N)(=O)=O)cc2)cc1	916599565	UYFMEQVCFNWJQO-LDADJPATSA-N	427.482	1.452	50	20	IDGD	
CC[S@](=O)c1ccccc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	917510417	QRIIPKMRBKIYRP-LJAQVGFWSA-N	449.554	1.673	50	20	IDGD	
CN(C)N(C(=O)[C@H]1CCN(c2cccc(Br)c2)C1=O)[C@@H]1CCS(=O)(=O)C1	917621314	AIWHQBNSBFGCEP-CABCVRRESA-N	444.351	1.294	50	20	IDGD	
CC(C)n1nc(C(=O)NNS(=O)(=O)c2cc(C(=O)O)ccc2F)c2ccccc2c1=O	918063278	NVWPQLJYTZUPHP-UHFFFAOYSA-N	448.432	1.438	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)NCCS(=O)(=O)c2ccc(Cl)cc2)c1	919785795	JSZLDYJXDWKSOQ-UHFFFAOYSA-N	425.894	1.832	50	20	IDGD	
COc1cc(C=NNC(=O)[C@H]2CCS(=O)(=O)C2)c([N+](=O)[O-])cc1OCC(F)(F)F	921259085	VYCCIGQRTZPGKF-VIFPVBQESA-N	439.368	1.429	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)[C@H]2COc3ccc(F)cc3C2)cc1OC	1116401396	VJFYBRJGKOGSRE-CQSZACIVSA-N	432.404	1.398	50	20	IDGD	
O=C(CNC(=O)c1ccc(Br)s1)NNC(=O)c1cncn1-c1ccccc1	1255031880	ZBJFGQSWVUETBM-UHFFFAOYSA-N	448.302	1.887	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)c3cncnc3C)c2)cc1	1317860921	NKFXYIMTGRVUEL-UHFFFAOYSA-N	441.469	1.669	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)NCc2ccccc2NS(C)(=O)=O)nc2ccccc21	1317894794	SMSMODIALZNXLZ-UHFFFAOYSA-N	430.490	1.018	50	20	IDGD	
Cc1nn(C)c(N2CCOCC2)c1C=NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1	1319706016	XXYWVQXJKAGOOH-UHFFFAOYSA-N	434.541	1.662	50	20	IDGD	
C[C@@H](O)CNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2ccc(Cl)cc2Cl)cc1	1346619005	FAJATUVAHAXXIN-SNVBAGLBSA-N	446.312	1.727	50	20	IDGD	
CN1CCc2cc(C(=O)N3CC[C@]4(C3)CN(C(=O)[C@@H](F)Br)CCO4)ccc21	1777920627	NLOTUQICHROWJX-APWZRJJASA-N	440.313	1.813	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)C/N=C/c3ccco3)C2)C1	1779137741	DOPSQCMAVCIFCM-ZCTOSJTPSA-N	426.311	1.702	50	20	IDGD	
COCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc([N+](=O)[O-])ccc2OC(C)=O)C1	1780054293	HYXQSLACSJYREH-WIYYLYMNSA-N	449.460	1.294	50	20	IDGD	
CSc1cccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](O)CCl)C3)c1O	1780076240	YJYOXSYBPZDWSD-YYFZDKIDSA-N	442.965	1.841	50	20	IDGD	
CCOc1ccc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)nn1	1780425233	HXOQDEMPLMGRBN-UGSOOPFHSA-N	441.326	1.350	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CNC(=O)c1cccnc1)C2	1780699389	DGDUIXBPGMSPJL-CBGDNZLLSA-N	436.940	1.343	50	20	IDGD	
Cn1cc(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@](C)(Cl)CCl)C2)cn1	1780715337	OMURZYWYLKFUGP-AYOQOUSVSA-N	431.364	1.713	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](CCO)NC(=O)OC(C)(C)C)CCO2	1781211508	VYXGHQJOIXLFKZ-BXTJHSDWSA-N	447.960	1.109	50	20	IDGD	
O=C(c1ccn2cncc2c1)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781332190	VMVMCPROELDVAJ-WMLDXEAASA-N	425.258	1.468	50	20	IDGD	
O=C(c1ccc2ccnn2c1)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781333419	OJEOZETXQBYMKD-PBHICJAKSA-N	425.258	1.468	50	20	IDGD	
O=C(CN1CCCCC1=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Br)C2	1782105953	LDDMEADPXZVYCG-MZMPZRCHSA-N	448.333	1.203	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)COc1cccnc1)C2	1782171772	DZWAETSKPDEYMZ-MBOZVWFJSA-N	425.913	1.228	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnn(C)c1Cl)C2	1782173535	HPOMHDCAZOJXRI-HBUWYVDXSA-N	433.336	1.455	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cn(C)nc3OC)CCO2)C1	1783344996	VQLZOVOFWKPXRA-DYVFJYSZSA-N	429.315	1.046	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](C)NNc1ccccc1)CCO2	1783528081	JJFAJQHYMSWXJO-DOXZYTNZSA-N	439.354	1.605	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cnccc3N(C)C)CCO2)C1	1783532928	UCGOFSIPMNBXNE-UGSOOPFHSA-N	425.327	1.375	50	20	IDGD	
Cc1cc(C)n(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]3C2)n1	1783968646	DWPNUQWWKKBVGZ-STECZYCISA-N	441.370	1.511	50	20	IDGD	
CCOC(=O)N1CCC(C(=O)N2CC[C@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)CC1	1785370796	RANNYSPXTKECDM-NRFANRHFSA-N	443.972	1.950	50	20	IDGD	
COc1ncccc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCBr)[C@H]2C1	1786404556	YKNNAOYSXKQDRX-QEJZJMRPSA-N	426.311	1.469	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3Cc4ccccc4CN3)[C@H]2C1	1787413259	ZRZSRUQHHHITCP-TUFLPTIASA-N	445.636	1.532	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]2C1)C1CC1	1787446237	ZPBRVILMTPMPNA-UVPYHEFZSA-N	447.935	1.804	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc4ccccn34)[C@H]2C1	1787942065	GSGVJPSWJJOHCD-YXWQFLTLSA-N	435.322	1.711	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)[C@H](O)c3ccco3)CCC2)cc1)c1cccc(B(O)O)c1	1788145206	KDHCWCPDNDLCIS-HXUWFJFHSA-N	434.257	1.441	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccn4cncc4c3)C[C@@H]21	1788764150	AURFLBVTOIUQDR-WDSOQIARSA-N	430.581	1.779	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4ncnn4c3)C[C@@H]21	1788764181	CPJWRPBJEULAGL-ULQDDVLXSA-N	431.569	1.174	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1ccc(C2(NC(=O)c3cccc(O)n3)CCC2)cc1	1789521119	IOKNQDCLTDQIAZ-UHFFFAOYSA-N	446.467	1.847	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCCn3ccnc3)C[C@@H]21)[C@@H](F)Br	1789927261	RZOWYUFZUFCKQD-RZLSGREXSA-N	431.306	1.334	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)Nc1ccc(C2(NC(=O)[C@@H](N)CCC(N)=O)CCC2)cc1	1790492812	OUTVNHLUMSXEAW-KSSFIOAISA-N	429.348	1.950	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(=O)c3ccco3)C[C@@H]21	1790958304	OWVVERDGUBTTTP-ABHRYQDASA-N	427.295	1.616	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1C[C@@H]1c1ccc(F)cc1)c1cccc(B(O)O)c1	1792910376	XDPFQTWHGHMVIJ-YHINDDMVSA-N	436.292	1.561	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C(=O)c1ccc(Cl)cc1	1793084061	BXOMCUTUPAQBSD-BJWYYQGGSA-N	434.924	1.534	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCl	1793110214	CMLBVPKFRGOFRH-ZUWCUPBKSA-N	438.352	1.356	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cn1cc([N+](=O)[O-])cn1	1794277838	FLVCLYKIVWZUFF-GFQSEFKGSA-N	428.287	1.603	50	20	IDGD	
C[C@H](Nc1cccnc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2	1795604161	PBWGQHHJQPXCLC-ZJOBFFGXSA-N	425.327	1.257	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1c(Br)cnn1C	1796747441	RZPQSTRNALYXNF-ZMJPVWNMSA-N	447.761	1.793	50	20	IDGD	
CC(C)(C)OC(=O)CCCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CO[Si](C)(C)C	1797953977	ZLZNXSDSYCOGRI-CWPLJXCYSA-N	442.629	1.940	50	20	IDGD	
Cc1c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)nc2ccccn12	1798440316	LQLQKHCASPFKPE-MUJYYYPQSA-N	447.499	1.207	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(Cl)cc(Cl)n1)c1cccc(B(O)O)c1	1798986048	CLUJOQYCZQXJOK-MUJYYYPQSA-N	448.115	1.634	50	20	IDGD	
Cc1ccc(OC(C)(C)C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CO[Si](C)(C)C)C3)nc1	1799092171	LKMRBCOTQULKGW-XEMDLRDOSA-N	449.624	1.989	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3n(n1)CCCC3)C2)[C@H](F)Br	1799349855	MBSXDBCPCAWWAR-JLUCKKNBSA-N	429.290	1.113	50	20	IDGD	
CCOc1ccc(Cl)cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2	1799615271	BIXJLMCFVALZFG-DJZPMSPPSA-N	431.316	1.542	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](CC)N(CC)CC)C2	1800639866	AJZAQRUGOIVJJZ-QEOTZNIISA-N	432.403	1.870	50	20	IDGD	
COc1ccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)Br)cc1O	1800754624	SLVMEDUIAUBCCP-NASWQRNTSA-N	441.322	1.316	50	20	IDGD	
Cc1cccc2[nH]c(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)CCC(=O)NN(C)C)cc12	1801011520	MRVLTBKDZGOAGS-MFKICJERSA-N	441.532	1.053	50	20	IDGD	
CCS(=O)(=O)CC(=O)NC[C@@H]1CCN(C(=O)[C@H](C)Br)[C@@H]1c1cccnc1	1803518084	PKOLPVUFUXMYER-DUVNUKRYSA-N	446.367	1.306	50	20	IDGD	
Cc1occc1C(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1805619158	NVEQAEIIVZLTIM-UTKZUKDTSA-N	427.505	1.676	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)c[nH]1	1807360807	CUBZSBJNNVMJEJ-GHTZIAJQSA-N	432.289	1.031	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)c1ccc2n[nH]cc2c1	1808013145	XTQGKMHYFYWBPU-KFKAGJAMSA-N	427.892	1.877	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)COc2ccc(O)nn2)[C@@H]1c1cccnc1	1808277340	COKJRGBYZDBYII-ZRGWGRIASA-N	433.896	1.679	50	20	IDGD	
Cc1cc(F)cc(C(=O)N2CCC3(CCCN(C(=O)c4ccc(B(O)O)cc4)C3)CC2)c1	1809969262	AUNCCWRTPNOOIO-UHFFFAOYSA-N	438.308	1.973	50	20	IDGD	
CCN(CC)C[C@@H](C)C(=O)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1	1809979967	HICNUEFMARHMGH-LJQANCHMSA-N	443.397	1.189	50	20	IDGD	
CNC(=S)NCCC(=O)NC[C@@H]1CCN(C(=O)C(Cl)Cl)[C@H]1c1cccnc1	1810309655	CDWFKLWPRFTOAY-JSGCOSHPSA-N	432.377	1.375	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H](CNC(=O)c2c[nH]c(=O)cn2)[C@@H]1c1cccnc1	1811453705	LSMLDQGGZGDROT-AZOIQLNYSA-N	438.315	1.721	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1)c1cc(CO)on1	1811589578	JYXFCRPXAVLSLC-DYVFJYSZSA-N	437.294	1.667	50	20	IDGD	
O=C(Cc1cnc2ccccn12)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1	1814833765	LLAGEFQFJSYCFG-CVEARBPZSA-N	430.896	1.892	50	20	IDGD	
C[C@H](C(=O)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1)c1ccccc1	1815363960	CSTMDZFHTGNBFY-KSSFIOAISA-N	449.341	1.852	50	20	IDGD	
O=C(CCc1ccco1)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1815932051	HHACXDSUYOMFAQ-LJQANCHMSA-N	436.277	1.621	50	20	IDGD	
CC(C)(C)NCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1817283145	YSMYRJVSHXLYLR-INIZCTEOSA-N	442.524	1.102	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](C)Br)CC2	1817310185	OBAYBSZINDPZCC-IQJOONFLSA-N	431.356	1.705	50	20	IDGD	
Cc1nc(C)c(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)o1	1817476945	UOVQOLJQJFXPRX-KRWDZBQOSA-N	437.265	1.314	50	20	IDGD	
CC[S@@](=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCBr)CC2	1819508031	LYSQJCKPSMJFJT-VKTRGTBVSA-N	436.397	1.999	50	20	IDGD	
CCC(=O)N[C@H](C)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1	1822999035	NKEXQFMDGAOXIT-RWYTXXIDSA-N	435.319	1.660	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](O)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](F)Cl)CC2	1823565644	DLCIBEQXVAVPSX-XBURVNOZSA-N	436.893	1.433	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3c4c(nn3C)CCC4)sc2C1	1824245696	YEDLDEWRSMYUDH-ZYHUDNBSSA-N	437.953	1.845	50	20	IDGD	
O=C(c1c[nH]c(=O)cn1)N1CCC([C@H]2CCCCN2C(=O)CCBr)CC1	1826359222	YHYZGRHIAPTRKM-OAHLLOKOSA-N	425.327	1.788	50	20	IDGD	
O=C([C@H](O)CCl)N1CCC([C@H]2CCCCN2C(=O)c2ccc3nc(CO)[nH]c3c2)CC1	1828097160	MSNQTGSITAYILA-RTBURBONSA-N	448.951	1.888	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1830543766	CLDZDVWEMXHRKL-QMTHXVAHSA-N	432.142	1.278	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCCC(=O)OC(C)(C)C)CCO2)C1	1830803218	GDAKFQBSHPTMPP-IERDGZPVSA-N	446.972	1.972	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H]2C[C@H](O)CN2)CC1	1831552132	MOQVQUZTEAUATE-LUKYLMHMSA-N	430.387	1.502	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cnc(C)s3)C2)C1	1831656728	IQJUIOFYAKWOOL-QFBILLFUSA-N	429.970	1.858	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)c1	1832436900	DIOCOCQBHNWARG-AZUAARDMSA-N	428.888	1.673	50	20	IDGD	
O=C(Cc1cnc2ccccn12)NC1CCN(C2CCN(C(=O)[C@H](F)Cl)CC2)CC1	1833293846	QXGPUQDIDNDHIC-FQEVSTJZSA-N	435.931	1.983	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCC(N2CCC(NC(=O)c3cccc(=O)n3O)CC2)CC1	1833960976	IYCJXQRIFJGYBB-UHFFFAOYSA-N	438.956	1.536	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3ncc(Cl)cn3)CC2)CC1	1834057479	HJJQUHJPSWPYLB-MRXNPFEDSA-N	444.363	1.569	50	20	IDGD	
Cc1cncc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)CBr)C3)C2)c1	1834277869	GVGQOKIDYUJRMY-DNVCBOLYSA-N	440.338	1.491	50	20	IDGD	
Cc1nnc(CC(=O)NC2CCN(C3CCN(C(=O)[C@@H](F)Br)CC3)CC2)o1	1834834721	GQVGLDFSFJOHHP-MRXNPFEDSA-N	446.321	1.183	50	20	IDGD	
CCc1[nH]nc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](Cl)CC)C3)C2)c1Cl	1836230778	DXXYTRMVUTXVMR-KZULUSFZSA-N	433.336	1.713	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)C3=NO[C@@H](c4ccccc4)C3)CCO2)C1	1836585756	DULAVNALOPYGDG-KPLVRAHFSA-N	449.935	1.978	50	20	IDGD	
Cc1cc(/C=C/C(=O)N2CCC(OC3CCN(C(=O)[C@H](O)CCl)CC3)CC2)no1	1836717209	NDDSKRHZADTIDX-ZMUQKWFASA-N	425.913	1.595	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)C3CCCCC3)CC2)CC1	1837620239	PWLFCSNUAJYLKZ-UHFFFAOYSA-N	436.597	1.938	50	20	IDGD	
O=C(c1ccccc1F)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1838856227	VQYAJATXWRHLSR-WMLDXEAASA-N	433.249	1.586	50	20	IDGD	
Cc1cc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)no1	1839155117	JNZQOTOJHMDOSJ-ZWKOTPCHSA-N	434.320	1.218	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3[C@H]4C=CS[C@H]43)C2)C1	1839966682	MISKWBCQELRTKT-KQVLKZGSSA-N	445.379	1.491	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)n3cccc3)C2)C1	1840036355	IVVQQQBEBZDOTO-RLFYNMQTSA-N	428.327	1.289	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3CCC(F)(F)CC3)C2)C1	1840150283	IALLRVFPFUJGCC-CRAIPNDOSA-N	438.899	1.522	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)C3=COCCC3)CCO2)C1	1840217696	OSZSYSOAQNQVHI-CRAIPNDOSA-N	431.327	1.311	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCCC12CN(C(=O)CCS(=O)(=O)c1ccccc1)C2	1844377812	WLAVNZGRRBMEAP-UHFFFAOYSA-N	438.622	1.905	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@]23C[C@@H]2CN(C(=O)OC(C)(C)C)C3)C1	1846127601	QCKIUIZOOVEFLT-VTJXTGGHSA-N	441.956	1.701	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@]2(C(=O)N2CCCC23CN(C(=O)[C@@H](O)CCl)C3)C1	1846127747	CDGSQJQIQXOYAM-GXZWQRSESA-N	441.956	1.437	50	20	IDGD	
CC(C)(C)OC(=O)N1CCCC[C@H](C(=O)N2CCCC23CN(C(=O)[C@H](O)CCl)C3)C1	1847159604	KAEYHEANMKFHSP-JKSUJKDBSA-N	443.972	1.827	50	20	IDGD	
O=C(c1nc2ccc(C(F)(F)F)cn2n1)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl	1847560537	VLQYCWXWKJKDOW-SDDRHHMPSA-N	431.802	1.163	50	20	IDGD	
O=C([C@H](O)CCl)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)c1cccc(Br)c1	1847564841	DPGGTSJIBKLBEM-BYNSBNAKSA-N	431.714	1.284	50	20	IDGD	
O=C1Cc2ccccc2C(=O)N1CCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)C(Cl)Cl	1847611785	CBTISHAWUAUKGZ-GJZGRUSLSA-N	438.311	1.607	50	20	IDGD	
O=C(CN1C(=O)COc2ccc([N+](=O)[O-])cc21)NNC(=S)NCCc1cccs1	21124581	SYWCPWQJKPDBOK-UHFFFAOYSA-N	435.487	1.120	50	20	IDGD	
COc1ccc(N2C[C@H](C(=O)NNC(=O)c3ccc(OC)c(OC)c3)CC2=O)c(OC)c1	28777348	ZENWCCYEWBSVIX-CQSZACIVSA-N	443.456	1.535	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2ccc(F)c(S(N)(=O)=O)c2)ccc1OC(C)C	31542759	YXPJDADUKIWNHJ-UHFFFAOYSA-N	425.438	1.344	50	20	IDGD	
CC(C)N1CCN(c2ccc(C(=O)NNC(=O)c3n[nH]c(=O)c4ccccc34)cc2)CC1	109899205	DJTSOQKZMIFEOT-UHFFFAOYSA-N	434.500	1.528	50	20	IDGD	
CC(C)NC(=O)C(=O)NNC(=O)[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)c1ccc(F)cc1F	726157667	YCWXSJKJRBPDCE-VUCTXSBTSA-N	436.459	1.410	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cn(-c3ccccc3)nc2C)cc1OC	726675988	RQIYHNIGBOWZDV-UHFFFAOYSA-N	438.440	1.816	50	20	IDGD	
O=C1CN(C(=O)c2ccc(CNC(=O)NNC(=O)CCCc3ccccc3)cc2)CCN1	727842343	NIUNTLNMJLDNTO-UHFFFAOYSA-N	437.500	1.112	50	20	IDGD	
O=C(NNc1nc(-c2cccnc2)no1)c1ccc(S(=O)(=O)N=c2cc[nH]cc2)cc1	728076609	GOBPXCZSDSPGTK-UHFFFAOYSA-N	437.441	1.506	50	20	IDGD	
O=C(CCNS(=O)(=O)c1cccs1)NNc1ccc(S(=O)(=O)NC2CC2)cc1	728210590	QAVAQOLKPPDLEB-UHFFFAOYSA-N	444.560	1.001	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)Cn2c(C)nc3ccccc3c2=O)c1	728527456	JSOYHLGMHWOCFY-UHFFFAOYSA-N	445.273	1.937	50	20	IDGD	
C[C@@H]1NC(C(=O)NNC(=O)c2cc(F)ccc2Br)=NN(c2ccccc2)C1=O	728549045	ASJNVDJOJJGUTJ-JTQLQIEISA-N	448.252	1.688	50	20	IDGD	
CCOC(=O)N[C@H](CNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)CC(C)C	728958927	HATSJXAOMZORMJ-INIZCTEOSA-N	435.529	1.184	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)CCc1c(C)nc(-c2cccnc2)nc1O	729297246	DCOWVFARBFFMOG-UHFFFAOYSA-N	437.456	1.720	50	20	IDGD	
CCOC(=O)NCCC(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	729298444	GWMNVFMWNFZZOP-UHFFFAOYSA-N	437.456	1.342	50	20	IDGD	
Cc1c(NNC(=O)NCCCCN2CCN(c3ncccn3)CC2)cccc1[N+](=O)[O-]	729614344	FJIWQTZFAGLGON-UHFFFAOYSA-N	428.497	1.922	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)N[C@H](C)[C@H](C)N2CCOCC2)c2ccccc2c1=O	729624304	RTSHUNAVXJJYDM-CVEARBPZSA-N	444.536	1.250	50	20	IDGD	
CCN1CCC[C@@H]1CN1C[C@H](C(=O)NNC(=O)c2ccc(Br)s2)CC1=O	729626155	JKVWERXXNQGWLY-VXGBXAGGSA-N	443.367	1.604	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(CCCNC(=O)NNC(=O)Cc2ccccc2F)CC1	731403690	RYKDYGVKIXDQQZ-UHFFFAOYSA-N	437.516	1.641	50	20	IDGD	
CC(=O)Nc1ccc(NS(C)(=O)=O)c(C(=O)NNC(=O)c2ccc3ccccc3n2)c1	731434229	LHCDRGPRWZHMCZ-UHFFFAOYSA-N	441.469	1.640	50	20	IDGD	
COc1cc(C=O)c([N+](=O)[O-])cc1OCC(=O)NNC(=O)COc1cc(C)cc(C)c1	731597450	UHFFEHRPMYGOHR-UHFFFAOYSA-N	431.401	1.638	50	20	IDGD	
CCCc1[nH]nc(C(=O)NNC(=O)COc2ccc(Br)cc2)c1[N+](=O)[O-]	731600773	JNPDCCUMHVACKP-UHFFFAOYSA-N	426.227	1.873	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])o1	731874508	JZQQALSNBNEGPS-CYBMUJFWSA-N	446.416	1.418	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)CCNC(=O)N2CCc3ccccc3C2)c1	732269744	LSIBEZICQXNKTL-UHFFFAOYSA-N	444.513	1.009	50	20	IDGD	
CCS(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c1	732535432	LSTPIHVOIRPXPM-UHFFFAOYSA-N	428.463	1.098	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)N[C@H]2CCN(CC(F)(F)F)C2=O)cc1	732589823	FUZFIXXUVJTPQJ-RISCZKNCSA-N	432.399	1.346	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@H]2CCC[C@@H](C(=O)N(C)C)C2)c2ccccc2c1=O	734222783	WNPNLQRWAMXJPY-KGLIPLIRSA-N	428.493	1.007	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@H](C(=O)NNC(=O)c3cnn(C)c3)C2)c2ccccc12	735446256	IODSJFMRTRJQME-HNNXBMFYSA-N	435.484	1.895	50	20	IDGD	
C[C@H](C#N)C(=O)NNC(=O)CN(Cc1ccccc1)S(=O)(=O)c1ccc(Cl)cc1	736667321	OCUKUAXVQAHJDQ-CQSZACIVSA-N	434.905	1.838	50	20	IDGD	
CCS(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=O)CCN2C[C@H](C)O[C@H](C)C2)c1	740922022	NRRJXNGBZKVDOL-BETUJISGSA-N	431.942	1.394	50	20	IDGD	
COCC[C@H](Cc1cccc(Br)c1)C(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1	741176468	VCYMYDONRYLANU-ZIAGYGMSSA-N	447.351	1.226	50	20	IDGD	
O=C(NNS(=O)(=O)N1CCCCC1)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	742026085	XCIMLDVYGRLGKN-UHFFFAOYSA-N	441.517	1.354	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)CCCN(C)C2=NS(=O)(=O)c3ccccc32)cc1	742035082	XXHTVQMDMLHRLL-UHFFFAOYSA-N	444.513	1.382	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@@H](c2ccccc2F)N2CCOCC2)cc(OC)c1OC	742241494	JRRDZPWMAKNOTA-LJQANCHMSA-N	447.463	1.686	50	20	IDGD	
CC(=O)Nc1cccc(-n2nnnc2SCC(=O)NNC(=O)c2cccc(C)c2)c1	742451327	SQWODCGZVIXILX-UHFFFAOYSA-N	425.474	1.482	50	20	IDGD	
CC[C@@H](N=c1nn[nH]n1-c1ccccc1)C(=O)NNC(=O)c1cccc(Br)c1	742771782	APUDDTHKYJYNPC-OAHLLOKOSA-N	444.293	1.498	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)NCc2cccc(C(=O)N3CCOCC3)c2)cc1	743561302	IGYDVHVPPOFZAP-UHFFFAOYSA-N	440.504	1.761	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)CSc2ccc(C(N)=O)cc2[N+](=O)[O-])cc1	743828003	WVFOGRGRMULIDH-UHFFFAOYSA-N	432.462	1.705	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2ccc(N(C)C)cc2)cc1S(=O)(=O)NC1CC1	743828464	MSVVVKWYMPAKAH-UHFFFAOYSA-N	447.517	1.668	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)ccc1C	745976775	LBFBJNODEBZYNA-UHFFFAOYSA-N	438.458	1.431	50	20	IDGD	
Cc1ccc(-n2[nH]c(C(=O)NNc3ccc(S(=O)(=O)NC4CC4)cc3)cc2=O)cc1	746200267	GYZZMEAYODCKFH-UHFFFAOYSA-N	427.486	1.672	50	20	IDGD	
CC(C)N(CCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)C(C)C	746422967	SWEUEHOENWGXBW-UHFFFAOYSA-N	427.571	1.390	50	20	IDGD	
Cc1ccc(S(=O)(=O)NC2CC2)cc1C(=O)NNC(=O)Cc1cn2ccccc2n1	746640392	CCPWWZSUOSGLRW-UHFFFAOYSA-N	427.486	1.087	50	20	IDGD	
COc1ccc(/C=C(\C#N)C(=O)c2c(N)n(C)c(=O)n(C)c2=O)cc1OCCC(C)C	747809971	GICWCNANDDMSJP-XNTDXEJSSA-N	426.473	1.890	50	20	IDGD	
O=C(CCN1CCN(C(=O)[C@H]2CCCO2)CC1)NNc1ccc(Br)cc1F	748203410	OHOGFMSFHZYVPP-MRXNPFEDSA-N	443.317	1.745	50	20	IDGD	
Cc1c(C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)cnc2ccccc12	748850318	UKFAEJNHYARVOG-UHFFFAOYSA-N	440.529	1.631	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN1C(=O)c1ccc2c(c1)OCO2)c1ccc2c(c1)OCO2	749563293	YYEYJTFRSPIQIS-CQSZACIVSA-N	425.397	1.210	50	20	IDGD	
COc1cc2ncn(CCCC(=O)NNC(=O)CCc3ccccc3)c(=O)c2cc1OC	749802699	QZNYVRWLOQMXDG-UHFFFAOYSA-N	438.484	1.974	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2ccc3c(c2)NC(=O)[C@H](C)N3C)cc(OC)c1OC	749865239	ZHRXCECFLRDFRO-NSHDSACASA-N	428.445	1.564	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)N1CCCN(Cc2nc([C@@H](C)OC)no2)CC1	750286949	QNZDVYDYBLHEDR-CQSZACIVSA-N	432.481	1.348	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NC[C@@H](C)CNC(=O)OC(C)(C)C)nc1	750437525	CEWUQOLDSKKUJQ-CYBMUJFWSA-N	444.558	1.555	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)NNC(=O)NCc2cccc(C(F)(F)F)c2)ccc1F	752519518	WEIHSHTXOYDSPL-UHFFFAOYSA-N	448.398	1.897	50	20	IDGD	
Cn1cc(C(N)=O)cc1C(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	755062895	WYUWDUYTQINAAD-UHFFFAOYSA-N	447.498	1.061	50	20	IDGD	
COc1ccc(S(=O)(=O)CCC(=O)NNc2ccc(C(F)(F)F)nn2)cc1OC	755183475	NDXVCYOJWDNSQE-UHFFFAOYSA-N	434.396	1.820	50	20	IDGD	
Cc1oc(C(=O)NNC(=O)c2ccc(Br)cc2Cl)cc1S(N)(=O)=O	755666514	XGAWVNMNANGFJX-UHFFFAOYSA-N	436.671	1.726	50	20	IDGD	
COc1ccc2c(c1)C=C(C(=O)OCC(=O)NNC(=O)[C@H]1COc3ccccc3O1)CO2	756465480	JJSFMLLZKTZGJA-LJQANCHMSA-N	440.408	1.002	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)Nc3cc(F)cc(S(N)(=O)=O)c3)n[nH]2)cc1	756515497	NCHDDLFKTAEEHV-UHFFFAOYSA-N	446.464	1.892	50	20	IDGD	
COC(=O)c1n[nH]c2ccc(NC(=O)NNC(=O)c3nn(-c4ccccc4)cc3O)cc12	756570412	BNQNEVLCDRQBAM-UHFFFAOYSA-N	435.400	1.707	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)c2c(C)nc3ccccn23)cc1N1CCCS1(=O)=O	756705791	QHNPKGOGLZADNH-UHFFFAOYSA-N	442.501	1.958	50	20	IDGD	
C[C@@H]1CN(C(=O)Cn2cc(NC(=O)NNC(=O)c3cccc(N(C)C)c3)cn2)C[C@@H](C)O1	756840503	VPXIDEFBAZQQME-HUUCEWRRSA-N	443.508	1.051	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)Nc2ccccc2OCC(=O)N2CCOCC2)c1	756873969	LZKXRKYWQQQPHE-UHFFFAOYSA-N	441.488	1.457	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)N[C@@H]1CCN(C(=O)CCc2ccccc2)C1	757273068	IJXLICDYPSMJSK-QGZVFWFLSA-N	425.445	1.773	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)Nc1c(C)nn([C@@H]2CCS(=O)(=O)C2)c1C	757870914	BNRCSTBXJKNDCH-OAHLLOKOSA-N	435.506	1.264	50	20	IDGD	
CCOc1cc(C=NNC(=O)C(=O)Nc2ccccn2)ccc1O[C@H](C)C(=O)N(C)C	758386876	CQVNBMBGNJHWIJ-CQSZACIVSA-N	427.461	1.425	50	20	IDGD	
O=C(CCc1nc(-c2ccoc2)no1)N1CCN(S(=O)(=O)CBr)CC1	758519073	XANJBGWYLDQLMZ-UHFFFAOYSA-N	433.284	1.089	50	20	IDGD	
C[C@@H](NC(=O)OC(C)(C)C)[C@@H]1CCCN(CC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)C1	758786169	YVMXKKUHOSDNGV-GDBMZVCRSA-N	449.508	1.981	50	20	IDGD	
CCOc1c(Br)cc(C(=O)NNC(=O)C(=O)Nc2ccccn2)cc1OC	758841790	SMJTZGPHBHIMMJ-UHFFFAOYSA-N	437.250	1.651	50	20	IDGD	
N#C/C(=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)NC[C@@H](O)C1CC1	759644244	QLTHTKGTMIXSCO-IDGGIGOKSA-N	427.892	1.873	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)[C@@H]2CCCN(S(=O)(=O)c3ccc(C)cc3)C2)nc1	759738483	ILKCKBPZIAWRIK-MRXNPFEDSA-N	432.502	1.721	50	20	IDGD	
CC1(C)C(=O)N(C[C@](C)(O)C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c2ccccc21	760041713	ZRHVIBJIDWHOFA-NRFANRHFSA-N	426.429	1.431	50	20	IDGD	
COc1ccc(COCCCC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1	760223304	JYGWFXOSPAVBTM-UHFFFAOYSA-N	449.529	1.704	50	20	IDGD	
N#CCOc1cccc(CC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1	760262448	DMNUAHAYSKANAJ-UHFFFAOYSA-N	442.497	1.377	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)c1ncoc1-c1ccc2c(c1)OCCO2	760442732	OHOBOJGDGOVHPG-UHFFFAOYSA-N	432.433	1.789	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)N[C@H]1CCCN(Cc2ccccc2)C1=O	761783314	QQMJVQAGYVBNFI-SFHVURJKSA-N	448.483	1.713	50	20	IDGD	
C[C@H](CC(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1)[C@H]1CCCN(C(=O)OC(C)(C)C)C1	763184669	ACKITCJVIAKGGP-ILXRZTDVSA-N	431.555	1.242	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)C(=O)Nc1ccc(OCC(F)(F)F)cc1	763548011	HESRUPHMPYKBJX-UHFFFAOYSA-N	425.319	1.756	50	20	IDGD	
CCN(CC)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)cc1	763548516	METLBSNTYAWVGG-UHFFFAOYSA-N	426.429	1.297	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(Cl)c(NC(C)=O)c2)cc1OC	763549989	CTPLFFOZLSDOSG-UHFFFAOYSA-N	434.836	1.715	50	20	IDGD	
CCN(CC)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(OC)c(OC)c2)cc1	763550752	RGVHFNLVCVLGKV-UHFFFAOYSA-N	442.472	1.586	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2c(C)nc3ccccn23)c(Br)c1	763629443	JVAKFNNBXKOLPA-UHFFFAOYSA-N	446.261	1.814	50	20	IDGD	
Cc1cc(Oc2ncccn2)ccc1NC(=O)C(=O)NNC(=O)c1c(C)nc2ccccn12	763630349	ZIEYHRXITCKVNI-UHFFFAOYSA-N	445.439	1.933	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)COc2cc(C)ccc2C)c(C)c1	763669355	WNQYGJAXVALWEP-UHFFFAOYSA-N	429.473	1.802	50	20	IDGD	
CN(C)CC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)cc1	763695753	VTKPUWIJTWHASP-UHFFFAOYSA-N	447.879	1.005	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(NC(=O)c3ccccc3)nc2)c1	763759245	XRVDSZUZZKZCKF-UHFFFAOYSA-N	446.467	1.800	50	20	IDGD	
Cc1cc(Cl)c(NC(=O)C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1Cl	763790194	GNGVBPQAOSMCPO-UHFFFAOYSA-N	448.266	1.948	50	20	IDGD	
C=CCNC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C)cc2)cc1	763809091	JTOOLUPFADDXNC-UHFFFAOYSA-N	425.445	1.467	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(CC(=O)N(C)C)cc2)c1C	763850165	OGLJZMYPLOKHDM-MRXNPFEDSA-N	440.500	1.488	50	20	IDGD	
C#CCOc1ccc(F)cc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccc(OCC)cc1	763859784	FWMMEWGTJNFABU-CQSZACIVSA-N	443.431	1.790	50	20	IDGD	
CN(C)CCCOc1ccc(NC(=O)C(=O)NNC(=O)Cc2c[nH]c3ccccc23)cc1	763861952	XBFNYYJMZSACDJ-UHFFFAOYSA-N	437.500	1.827	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)NNC(=O)C(=O)Nc1ccnc(OCC(F)(F)F)c1	763865759	UWPKYDFSDAGXRB-UHFFFAOYSA-N	435.362	1.833	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cc3c(cc2Cl)OCO3)cc1	763872593	OVVNXVYFQFXJCQ-LLVKDONJSA-N	447.831	1.825	50	20	IDGD	
Cc1nc(CC(C)C)c(NC(=O)C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)s1	763917091	PINSRDJHDUIUFI-UHFFFAOYSA-N	428.478	1.025	50	20	IDGD	
CCC(C)(C)OCc1cccc(NC(=O)C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)c1C	764001976	IJAAKGDOSQCBBB-OAHLLOKOSA-N	439.534	1.221	50	20	IDGD	
CN(C)c1nc2cc(NC(=O)C(=O)NNC(=O)c3ccc4c(c3)OCCO4)ccc2o1	764003501	FGKQZSMEFCMPAP-UHFFFAOYSA-N	425.401	1.065	50	20	IDGD	
CC[C@@H](C)n1nc(NC(=O)C(=O)NNC(=O)c2cc(Br)cn2C)cc1C	764005327	YKNYLDUEBPHQMP-SECBINFHSA-N	425.287	1.663	50	20	IDGD	
COc1cc(OC)cc(N2C[C@@H](C(=O)NNC(=O)CSc3ccccc3O)CC2=O)c1	764046621	IAKMSWIHVPDJPC-ZDUSSCGKSA-N	445.497	1.702	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2sc3c(c2C(=O)OC(C)C)CC[C@H](C)C3)n[nH]1	764105881	ANZJNPZWPHAGRP-JTQLQIEISA-N	447.517	1.869	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2cccc(CN3CCCC3=O)c2)cc1	764127193	PYJINLWNKFRDHE-UHFFFAOYSA-N	438.484	1.536	50	20	IDGD	
O=C(CCc1ccco1)NNC(=O)C(=O)Nc1cccc(S(=O)(=O)N2CCCCC2)c1	764170862	BZBIFVLDWUBNRN-UHFFFAOYSA-N	448.501	1.173	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)CCc3ccccc3O)cn2)C[C@H](C)O1	764281503	YJGROXFMONGPFR-GJZGRUSLSA-N	441.488	1.120	50	20	IDGD	
Cc1ccc(C(=O)N2C[C@@H](C)C[C@@H](C)C2)cc1NC(=O)C(=O)NNC(=O)c1c[nH]nc1C	764298163	PRPBIDLTPVGPSR-BETUJISGSA-N	440.504	1.544	50	20	IDGD	
Cc1cn(-c2ccc(C#N)cn2)nc1NC(=O)C(=O)NNC(=O)c1cc2ccccc2o1	764344097	ZEBAMYYKXNOSPX-UHFFFAOYSA-N	429.396	1.593	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)C(=O)Nc1ccc(-n2cnc3ccccc32)nc1	764363296	MVOZCUAAKWBWHK-UHFFFAOYSA-N	444.451	1.723	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)C(=O)Nc2cc(-c3ccncc3)ccc2C)c1	764433138	KLFQWPGANZCHRL-UHFFFAOYSA-N	432.440	1.810	50	20	IDGD	
Cn1c(=O)n(C)c2cc(S(=O)(=O)NNC(=O)OC(C)(C)C)c(Br)cc21	764932705	RFCUULIGUNNWEV-UHFFFAOYSA-N	435.300	1.358	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCCN(C(=O)NNC(=O)c3ccccc3C)CC2)cc1	765636917	YCCWEJMBQYHSAG-UHFFFAOYSA-N	446.529	1.755	50	20	IDGD	
COc1ccc([C@H](C)CC(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cc1	765735270	JDBPBABPIVXIPW-GOSISDBHSA-N	438.528	1.794	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765736957	CMIIWHYTGQVHOR-INIZCTEOSA-N	428.464	1.198	50	20	IDGD	
CC[C@@H](NC(=O)NNc1ccccc1S(C)(=O)=O)c1cccc(S(N)(=O)=O)c1	765757842	GTTMZENTFXVOSH-CQSZACIVSA-N	426.520	1.515	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)c3ccc(=O)n(-c4ccccc4F)n3)nc21	765795591	KNIWKONDCMBQIT-UHFFFAOYSA-N	438.423	1.729	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@H]3CCCCN3C(=O)C(C)C)CC2)cc1	766642349	RDZXUPXBCAVBHP-OAQYLSRUSA-N	443.592	1.297	50	20	IDGD	
COc1cccc(OCCN2CCN(CC(=O)NNC(=O)c3cccc(Cl)c3)CC2)c1	767048528	MXGOQPUUEGTWJD-UHFFFAOYSA-N	446.935	1.806	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)[C@H](C)NS(=O)(=O)c2ccc(C#N)cc2)cc1	767889320	LLIOCCSXYXHEBZ-AWEZNQCLSA-N	430.486	1.014	50	20	IDGD	
COc1cc2c(cc1NC(=O)NNC(=O)COc1ccccc1[N+](=O)[O-])NC(=O)CC2	767957065	SOKZLHXLZQHEDP-UHFFFAOYSA-N	429.389	1.720	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1ccc(F)cc1C(=O)N(C)C	768242156	PJHIRUJPIIVZSE-UHFFFAOYSA-N	448.476	1.414	50	20	IDGD	
O=C(CCCCc1cnn[nH]1)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	768721831	ORRRBYXHLGMCTQ-UHFFFAOYSA-N	433.944	1.136	50	20	IDGD	
O=C(NNC(=O)c1cc(F)ccc1Br)NC1CCN([C@H]2CCC[C@H]2O)CC1	769154491	KLPGDZPWWZQCSU-JKSUJKDBSA-N	443.317	1.910	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)NCCCN1CCC[C@@H](C(N)=O)C1	770513373	SWAQDIWHTNNDLY-ZIAGYGMSSA-N	425.917	1.025	50	20	IDGD	
CCCS(=O)(=O)N1CCCC[C@H]1C(=O)NNc1nc(O)c2cnn(C(C)(C)C)c2n1	770965641	LSVZPGWPUWXJOC-ZDUSSCGKSA-N	439.542	1.324	50	20	IDGD	
COc1ccccc1[C@@]1(C)NC(=O)N(CC(=O)NNC(=O)Cc2c[nH]c3ccccc23)C1=O	771229295	UDRDMNWPPOSEHX-HSZRJFAPSA-N	449.467	1.334	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1cccc(S(=O)(=O)Nc2ccccc2OC)c1	771881414	ISCTUALIZAUGOB-ZDUSSCGKSA-N	449.485	1.599	50	20	IDGD	
CC(C)(C)OC(=O)N1CCSC[C@H]1CC(=O)NNC(=O)CNC(=O)c1cccs1	772103233	WTEVVYNSSBTGIC-GFCCVEGCSA-N	442.563	1.368	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)C(=O)Nc2ncn(Cc3cccc(Br)c3)n2)n1	773478397	OGXLXRYDLXSQQJ-UHFFFAOYSA-N	445.281	1.578	50	20	IDGD	
COc1ccc(SC)c(OC)c1C(=O)NNC(=O)c1csc(N2CCOCC2)n1	775642786	HOPZCNDDWKMLAP-UHFFFAOYSA-N	438.531	1.794	50	20	IDGD	
CN(NC(=O)c1cccc(-c2nc[nH]n2)c1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776215142	ZRPHHPQLVNPRFB-UHFFFAOYSA-N	429.481	1.721	50	20	IDGD	
Cc1cc(-n2cncn2)ccc1C(=O)N1CCN(S(=O)(=O)CBr)CC1	777777908	SIDIRBCSFVVKPK-UHFFFAOYSA-N	428.312	1.016	50	20	IDGD	
Cc1cc(C(=O)N2CCN(S(=O)(=O)CBr)CC2)c(C)n1-c1nccs1	777778143	YQZSCONWAAKNEV-UHFFFAOYSA-N	447.380	1.991	50	20	IDGD	
CC1CCN(c2ccc(C(=O)N3CCN(S(=O)(=O)CBr)CC3)cn2)CC1	777837575	OBMVJBHDSDYOOA-UHFFFAOYSA-N	445.383	1.758	50	20	IDGD	
COCCOC(=O)c1c(NC(=O)C(=O)NNc2ccccc2F)sc(C(N)=O)c1C	782706904	CQJAVKQVZOUIEX-UHFFFAOYSA-N	438.437	1.180	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C(=O)Nc2ccc(N3CCCC3)c(F)c2)nc2ccccc21	782884669	HVMIHLPNSSYUGE-UHFFFAOYSA-N	438.463	1.641	50	20	IDGD	
Cc1ccccc1NC(=O)NNC(=O)C(=O)Nc1ccc(N2CCNC(=O)C2)c(Cl)c1	783411549	SFVLXOPJDYJUOW-UHFFFAOYSA-N	444.879	1.376	50	20	IDGD	
CC(C)(C)c1ccc(Cn2nccc2NC(=O)C(=O)NN[C@]2(C)CCS(=O)(=O)C2)cc1	783423924	BOGSPRLFRIZIDB-OAQYLSRUSA-N	447.561	1.365	50	20	IDGD	
Cc1ccccc1COc1cccc(NC(=O)C(=O)NN[C@@]2(C)CCS(=O)(=O)C2)c1	783426083	FQZXGDAZHYBIHZ-NRFANRHFSA-N	431.514	1.711	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2ccc(Oc3ccccc3)c(C#N)c2)CCS(=O)(=O)C1	783427302	RHXJVGVMHNZOKV-HXUWFJFHSA-N	428.470	1.487	50	20	IDGD	
O=C(NNC(=O)c1ccccc1C(=O)c1ccc(F)c(F)c1)N[C@@H]1CCS(=O)(=O)C1	783574433	KQKNKIJBLOKYDG-GFCCVEGCSA-N	437.424	1.327	50	20	IDGD	
O=C(NNc1c(F)cc(C(=O)NC2CC2)cc1F)C(=O)Nc1cnn(CC(F)F)c1	785099279	CIPVXZSGFRSMTP-UHFFFAOYSA-N	428.346	1.400	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)CCC(=O)N3CCCC#N)c(C)o1	787889305	KTIBLLGGNGLKII-UHFFFAOYSA-N	437.456	1.879	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(Cl)c(S(C)(=O)=O)c2)c(O)c1	788333018	KJLNORGXQHPCGE-UHFFFAOYSA-N	425.850	1.157	50	20	IDGD	
COC(=O)COc1ccc(C=NNC(=O)Cc2nc3ccccc3n2C)cc1[N+](=O)[O-]	788704607	XNOZDJGCVXBOIJ-UHFFFAOYSA-N	425.401	1.726	50	20	IDGD	
CCNC(=O)N(C)NC(=O)C(=O)Nc1ccc(Br)cc1OC(F)(F)F	789593088	LLXQGJYBNNCQAV-UHFFFAOYSA-N	427.177	1.979	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)c1sc2nc(COC)nc(OC)c2c1C	790065112	IOTVDKRNJROAKB-UHFFFAOYSA-N	426.495	1.705	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNc2cccc(F)c2[N+](=O)[O-])cc1C(=O)OC	791000866	RKWVPQXBSNQFBI-UHFFFAOYSA-N	434.336	1.389	50	20	IDGD	
Cn1c(=O)n(C)c2nc(NC(=O)CCC(=O)NNc3cccc(F)c3[N+](=O)[O-])ccc21	791069083	DPIOTBZVONOHPB-UHFFFAOYSA-N	431.384	1.181	50	20	IDGD	
CNS(=O)(=O)c1ccc2c(c1)N(C(=O)C(=O)NNc1cc(Cl)cc(Cl)c1)CC2	792445202	QYVAJNJPLJHDKW-UHFFFAOYSA-N	443.312	1.934	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)NCc2ccc(S(=O)(=O)N3CCC[C@@H](C)C3)cc2)n1	792813207	WABGYMFXGBWCIG-OAHLLOKOSA-N	445.545	1.955	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CCNS(=O)(=O)c2ccc(Br)cc2)n1	794080043	HBHVEYKJHOTQTO-UHFFFAOYSA-N	441.307	1.282	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)COC(F)F)c2)cc1	794743362	YTCZLZNIKNCAED-UHFFFAOYSA-N	429.401	1.496	50	20	IDGD	
C[C@@H](C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1)c1ccc2c(c1)OCO2	795922698	PAFRZQJFFKPEQN-KZULUSFZSA-N	428.397	1.049	50	20	IDGD	
COC(=O)[C@H]1CN(C(=O)OC(C)(C)C)CCCN1CC(=O)NNC(=O)c1ccc(C)cc1	796685584	VRXQXRWNRNZAHV-QGZVFWFLSA-N	448.520	1.240	50	20	IDGD	
COC(=O)c1ccc(NC(=O)NNC(=O)[C@H](C)Oc2cccc(Br)c2)nn1	799232010	YAOGGROKDKVORD-VIFPVBQESA-N	438.238	1.646	50	20	IDGD	
CC(=O)N1CCN(c2ccc(C(=O)NNC(=O)Nc3ccccc3)cc2[N+](=O)[O-])CC1	801987549	MZUBJDARNNROQT-UHFFFAOYSA-N	426.433	1.730	50	20	IDGD	
CCS(=O)(=O)Nc1ccccc1C(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	802066306	TWADXZHWEVBZIV-UHFFFAOYSA-N	440.503	1.318	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)CCCN2C(=O)CN(C)C2=O)cc1Cl	802077081	HGNVTJCOALHIGX-UHFFFAOYSA-N	427.845	1.184	50	20	IDGD	
CC(C)C[C@H](C(=O)NNC(=O)Nc1ccc2c(c1)OCO2)N1C(=O)[C@H]2CC=CC[C@H]2C1=O	802106341	BWDBNWMTMWCRDD-OWCLPIDISA-N	442.472	1.934	50	20	IDGD	
COc1ccc(Cl)c(NC(=O)NNC(=O)c2ccc(CCNS(C)(=O)=O)s2)c1	802112816	SZSDIZRESZMDQP-UHFFFAOYSA-N	446.938	1.968	50	20	IDGD	
CCc1ccccc1[C@@H]1C[C@H]1C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	802543144	NHROVHCCLBFEDI-RBUKOAKNSA-N	443.573	1.827	50	20	IDGD	
CN(C)S(=O)(=O)C[C@H](NC(=O)NNC(=O)c1ccc(Cl)cc1F)C(F)(F)F	805767234	HGOSXTYXXNXXAN-JTQLQIEISA-N	434.799	1.245	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCc2ccnc(OC(F)F)c2)c2ccccc2c1=O	807257377	MBKGSRHGRJTOAM-UHFFFAOYSA-N	432.387	1.557	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)NC2C[C@@H]3CC[C@H](C2)N3CC(=O)N(C)C)c1C	807514704	NDQRWCWGKYSVPG-MVCQKVDPSA-N	445.564	1.485	50	20	IDGD	
CC(=O)N1C[C@@H]2CCC[C@@H](NC(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)[C@H]2C1	808357623	LKPCGGFRQBOYNC-HRCADAONSA-N	425.530	1.269	50	20	IDGD	
CC(C)CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)NNC(=O)[C@@H](C)Oc1cccc(Cl)c1	811461418	ARAHKJMOVWAORF-CXAGYDPISA-N	435.912	1.751	50	20	IDGD	
C[C@H]1CN(C(=O)NNC(=O)c2ccc(Br)cc2Cl)C[C@@H](C)S1(=O)=O	811875098	SMSFQEJWVUMQDQ-DTORHVGOSA-N	438.731	1.964	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2cc(F)ccc2OC(F)F)cc1	813033711	IFTSYDVXXAXEOK-UHFFFAOYSA-N	446.407	1.759	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C)cc2)cc1)[C@H]1C[C@H]1C	815565924	FDNCCHQMZYMQAM-QRWLVFNGSA-N	438.484	1.921	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNc2nccnc2Cl)nnn1CCOc1ccc(F)cc1	815599699	YQSNEGSDBJWUCV-UHFFFAOYSA-N	434.819	1.330	50	20	IDGD	
CC(C)Oc1ccc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)N(C)C)cc1C#N	815751825	PXJFISVMXCBKSE-UHFFFAOYSA-N	445.501	1.678	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)[C@H]1CC(=O)N(c2ccc(F)c([N+](=O)[O-])c2)C1	913123287	GNMSVFPBOFDIRZ-NEPJUHHUSA-N	448.382	1.841	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)c1ccc(NC(=O)C2CC2)cc1	913628108	WIAYOEARZMPXAS-CYBMUJFWSA-N	434.460	1.716	50	20	IDGD	
O=C(COC(=O)c1ccc(=O)n(-c2ccccc2)n1)NNC(=O)c1ccc(Cl)cc1	914666790	HKCNJLXHNPGNFT-UHFFFAOYSA-N	426.816	1.504	50	20	IDGD	
CC(C)NS(=O)(=O)c1cc(C(=O)NNC(=O)Cc2c[nH]c3ccccc23)ccc1F	914749557	VSZMJTWXWQJKBG-UHFFFAOYSA-N	432.477	1.997	50	20	IDGD	
COc1ccc([C@@H](CNC(=O)NNC(=O)COc2ccccc2F)N(C)C)cc1OC	915897571	GGAFRPYURNQHQR-MRXNPFEDSA-N	434.468	1.855	50	20	IDGD	
Cc1cccc(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)c1	916107701	APZOLKFUPJPHOX-UHFFFAOYSA-N	437.543	1.793	50	20	IDGD	
CCS(=O)(=O)N1CCC(NC(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)CC1	916260191	RUXMCKXLLQILJM-HNNXBMFYSA-N	426.539	1.215	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)NCc2ccc(S(=O)(=O)NC[C@@H]3CCCO3)cc2)n1	916649738	RHWIDALVGVCAAL-INIZCTEOSA-N	434.522	1.377	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)Cn1ncc2ccccc2c1=O	919264710	SZBYMCLYLCEWPG-UHFFFAOYSA-N	444.831	1.063	50	20	IDGD	
CNS(=O)(=O)c1ccc([C@H](C)NC(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)cc1	919779132	NSWQMEUXRNKCRM-QWHCGFSZSA-N	438.481	1.593	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)C[C@H](c1ccccc1)OC2=O)N[C@H]1CCS(=O)(=O)C1	919886345	VSTQHXXTBNQREI-FUHWJXTLSA-N	443.481	1.272	50	20	IDGD	
Cc1nc(CSCC(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cs1	1319400595	JBWDYKRKLATRRA-UHFFFAOYSA-N	447.586	1.290	50	20	IDGD	
CCn1nc(C(C)C)cc1C(=O)NNC(=O)CN1CCN(Cc2ccc(C)cc2)CC1	1319425598	SRPHBSLBCJANGQ-UHFFFAOYSA-N	426.565	1.914	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)N[C@H]2CCO[C@]3(CCOC3)C2)CC1	1337107893	CXOUZRGMMXREEP-MGPUTAFESA-N	426.514	1.302	50	20	IDGD	
CC(=O)Nc1c[nH]nc1[C@@H]1CCCN(C(=O)NNC(=O)c2cc(Br)c[nH]2)C1	1337451592	KMVQPUJHTSEECF-SNVBAGLBSA-N	438.286	1.693	50	20	IDGD	
C[C@@H]1CCc2c(C(=O)N3CC[C@]4(C3)CN(C(=O)[C@@H](F)Br)CCO4)n[nH]c21	1777851834	BUKIOLRIAXGOQF-VMDBXTETSA-N	429.290	1.593	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnn3ncccc23)C1	1777948402	CHIGJUAMNDBDIU-XAUMDUMWSA-N	435.912	1.111	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H]3Cc4ccccc4O3)C2)C1	1778243400	ZUTMXIVBEATBQT-WIBUTAKZSA-N	437.334	1.851	50	20	IDGD	
COc1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](F)Br)C3)nn1C	1780245010	BMJFAACYJFNCTK-SUYBPPKGSA-N	447.305	1.247	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Br)C1)n1ccnn1	1780776589	HRDUIRAHGJMUCW-NFFDBFGFSA-N	432.294	1.044	50	20	IDGD	
COC(=O)C1(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](F)Br)C2)CC1	1780777329	WUCKQJUKCWKRTD-XHBSWPGZSA-N	435.290	1.144	50	20	IDGD	
O=C(c1nc(O)n2c1CCCC2)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781331243	HEHTWIUALIDSJO-DYVFJYSZSA-N	445.289	1.059	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781332891	GCROMPOQYVTXQD-LWGWVAHUSA-N	447.301	1.262	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)C2)C1	1781765912	LKSSJSOXOSWCMC-PIGZYNQJSA-N	444.257	1.961	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(C4CC4)cc3)C2)C1	1782026470	JNQFTNLOLIWUPX-HSZRJFAPSA-N	428.533	1.381	50	20	IDGD	
C[C@@H](NC(=O)OC(C)(C)C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2	1782077171	AZTGHZXCNZJWFE-IGMJJTELSA-N	447.960	1.013	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc3ncnn3c1)C2	1782175185	FVYBIOHBCMKSRA-RZQQEMMASA-N	435.912	1.111	50	20	IDGD	
Cn1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)/C(C#N)=C/c4ccc(F)cc4F)C3)C2)n1	1782863530	FPWFFQLBIRAABT-JLOHOZFJSA-N	441.438	1.749	50	20	IDGD	
Cc1ccc(C(=O)NCC(=O)N2CCO[C@@]3(CCN(C(=O)C(Cl)Cl)C3)C2)cc1	1783952127	NYNZNCNNUBNETC-IBGZPJMESA-N	428.316	1.358	50	20	IDGD	
COc1cnc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Br)C[C@@H]32)c(F)c1	1785740996	NVODJMYRAQNWQF-YARBFKLUSA-N	448.264	1.513	50	20	IDGD	
O=C(NC1(c2ccc(NC(=O)[C@@H](O)CCl)cc2)CCC1)c1cccn2c(O)nnc12	1786132679	XWJGIEUEHAXDGG-HNNXBMFYSA-N	429.864	1.782	50	20	IDGD	
Cc1nn(C)cc1C(=O)Nc1ccc(C2(NC(=O)CCC(=O)NN(C)C)CCC2)cc1	1786511428	DEMSCDJKGBOQCQ-UHFFFAOYSA-N	426.521	1.849	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)c1cnn2ccncc12	1788033242	REYZDXTYYMQMEN-LVGORTOPSA-N	440.273	1.013	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)c1cc(C(F)(F)F)ccn1	1788964197	RFGIPYCSTPRCOQ-FATJJJSSSA-N	435.830	1.293	50	20	IDGD	
CCC[C@H](NC(C)=O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]2C1	1789872662	PPIHGXBVKIJYPE-SIBFUHKCSA-N	436.380	1.507	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnn4ncccc34)C[C@@H]21)[C@@H](F)Br	1789922617	JPSGNFPJOHLKNS-HQRZJTNHSA-N	440.273	1.013	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccnc3OC)C[C@@H]21	1790960735	CIUOKRAKNYQJLW-TUUVXOQKSA-N	440.338	1.857	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CNC(=O)OC(C)(C)C)[C@H]2C1	1790987193	MLSJWUDOQHLGRC-VGWMRTNUSA-N	431.961	1.898	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CC[C@H](C(=O)OC)CC3)C[C@@H]21	1791250050	XKYJTBLCYQOKBI-FRMKIJSPSA-N	444.956	1.199	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(Cl)nc3F)C[C@@H]21	1791252329	HGOMSBJUIPXBHP-DEQVHRJGSA-N	434.295	1.721	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4cnccc4nc3C)C[C@@H]21	1791253405	AAONNTPLGPPMPD-DEYWJSPQSA-N	446.935	1.785	50	20	IDGD	
CC[C@@H](Br)C(=O)Nc1ccc(C2(NC(=O)[C@@H](N)CCC(N)=O)CCC2)cc1	1791360397	FRYBECPOFFAGMS-CABCVRRESA-N	439.354	1.887	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)COc3ccccc3C#N)[C@H]2C1	1792148682	XMKVHVRAFVWETM-DWRORGKVSA-N	435.908	1.171	50	20	IDGD	
Cc1nc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)CBr)ccc1F	1792870441	OUSLEZITNNBSOW-YGSHXTJESA-N	428.302	1.763	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(N3CCCC3)c(F)c1)C2)[C@@H](O)CCl	1792980207	FVIAZRSFLMZXNQ-QXGSTGNESA-N	439.915	1.229	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CC(=O)N(C2CCCC2)C1	1793775398	GKBRQTZSVASSEU-ZKHYITAMSA-N	439.984	1.775	50	20	IDGD	
N#CC1(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](Br)Cc2ccccc2)C3)CC1	1795413085	MISOVXAUIWBTPN-XMTFNYHQSA-N	446.345	1.886	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1nc2ccccn2n1	1796102980	DJVLHJCSBRUTQE-XFMPKHEZSA-N	436.310	1.106	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2nc(CO)[nH]c2c1	1796868906	KFBXVMCFUFRUQD-NXEZDXNNSA-N	434.924	1.666	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3n(n1)CCCC3)C2	1799277222	UBTUYHDXVHDRHZ-AODNKKSCSA-N	429.348	1.659	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(=O)Nc1c(C)cccc1C	1799283754	MRYSUVAARSAPMA-KYHPRHEASA-N	437.924	1.085	50	20	IDGD	
C[C@@H](Nc1cccnc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Br	1799346650	UZISWZNQZHYWCZ-AMVBZWJASA-N	429.290	1.162	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Br)cc1	1799351803	BDQMNXORUKDPCG-XRGAULLZSA-N	442.285	1.539	50	20	IDGD	
CCOC(=O)c1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](Cl)COC)C3)cc1	1799789667	VPGNVCJYWPTYJA-XMTFNYHQSA-N	438.908	1.320	50	20	IDGD	
CC(C)[C@@H](O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C#N)=C/c1ccc(F)cc1F	1800332218	HZQFIKVPVKGBCP-NPCRTEPVSA-N	433.455	1.478	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc[nH]1)C2	1800332698	WGBHMSDJLPOQLA-PSKFDLRZSA-N	427.411	1.498	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)Nc1ccccn1)C2	1800642017	RAKJKGRGCXHMCP-XGYYKPKNSA-N	439.354	1.645	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C=C/C(=O)c1cccs1)C2	1802333315	UXMFZXXSFYOLGZ-YEXBIGLPSA-N	432.546	1.498	50	20	IDGD	
N#Cc1ccc2[nH]nc(C(=O)N3CCC4(CCCN(C(=O)[C@H](O)CCl)C4)CC3)c2c1	1805526265	IFBMHSCPLGXJGC-QGZVFWFLSA-N	429.908	1.879	50	20	IDGD	
O=C(CCBr)NC[C@H]1CCN(C(=O)CN2CCCC2=O)[C@@H]1c1cccnc1	1806341201	ZVHVHBVCSMMUQR-DNVCBOLYSA-N	437.338	1.495	50	20	IDGD	
COCCOCC(=O)NC[C@@H]1CCN(C(=O)[C@](C)(Cl)CCl)[C@H]1c1cccnc1	1806758436	FZBRYGGMSBTKEU-VDZJLULYSA-N	432.348	1.987	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC2(CCCN(C(=O)c3cc(C(=O)O)ncn3)C2)CC1	1807577014	MOZIVFPSPPDVTD-LBPRGKRZSA-N	439.310	1.803	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)c1ccc2nccn2c1	1809415264	WXAYSAQCRSZBJW-IEZWGBDMSA-N	427.892	1.649	50	20	IDGD	
C[C@@H]1CCC[C@@H]1C(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1809662019	AWOJWBNGKDVTCY-GZHDQSLTSA-N	429.565	1.897	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)c1cnn2cccnc12	1809736329	CUUBPFOOPNGTLT-XIRDDKMYSA-N	428.880	1.044	50	20	IDGD	
C[C@@H](Cc1ccco1)C(=O)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1	1809972456	IXMJKWQCQAFBDZ-SFHVURJKSA-N	438.333	1.683	50	20	IDGD	
COC1(CC(=O)N2CCC3(CCCN(C(=O)c4cccc(B(O)O)c4)C3)CC2)CCC1	1809978329	PPRYIPXCNJFAQH-UHFFFAOYSA-N	428.338	1.170	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)[C@H](C)CS(C)(=O)=O)[C@H]1c1cccnc1	1813028509	RLVDATHFAAPVLN-IWCQGFGOSA-N	445.969	1.022	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)CSc2ncccn2)[C@H]1c1cccnc1	1813031827	SVFRQRKVWNWGAU-RYRKJORJSA-N	449.964	1.924	50	20	IDGD	
Cc1nocc1C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1813070577	JONPGKLBCYOIPW-OXQOHEQNSA-N	428.493	1.071	50	20	IDGD	
C[C@H]1CC[C@H](C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)CC1	1813545995	JYISFVPPAUJAHM-CFFRYYMNSA-N	449.360	1.907	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)[C@H](O)c3ccccc3)sc2C1	1814395302	JXZBYCBZGRJRRV-IFXJQAMLSA-N	445.545	1.162	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)CCN3CCOCC3)sc2C1	1814648166	CGKHYMZXSPGRKU-NEPJUHHUSA-N	445.383	1.561	50	20	IDGD	
CC(=O)N[C@H](C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1)C(C)(C)C	1815057532	YCBAYMXKMNMNGX-IJEWVQPXSA-N	427.933	1.552	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCN2C(=O)C=CC2=O)n[nH]1	1815470028	JKMAKQNLQLRIHW-AWEZNQCLSA-N	435.912	1.982	50	20	IDGD	
CC(C)(C)OCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1815592246	FHJNCQKSYOZZKV-INIZCTEOSA-N	443.508	1.529	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)CCC(F)(F)F)[nH]n1)c1cccc(B(O)O)c1	1817475477	SDDLTDZLOCNLHU-OAHLLOKOSA-N	438.215	1.738	50	20	IDGD	
Cn1cc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@@H](O)CCl)CC3)c(C(F)F)n1	1817823843	RNZQNLJFDAWYAD-XCBNKYQSSA-N	433.868	1.640	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@H](C(=O)Nc2cc([C@H]3CCCCN3C(=O)[C@H](O)CCl)[nH]n2)C1	1822361422	QNZVWWYWHNQART-SJXGUFTOSA-N	440.928	1.981	50	20	IDGD	
CC[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)Cn1ccnn1)CC2	1825446654	HFYMPINLADANCB-NXEZZACHSA-N	427.328	1.520	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](C)NC(C)=O)CC2	1825451400	JWWHNZKGJCYICT-MIMYLULJSA-N	431.356	1.753	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H]1CC[C@H](C(=O)OC)C1)CC2	1825994419	LEDJWRWIOHJACN-XQHKEYJVSA-N	443.953	1.898	50	20	IDGD	
Cc1nccn1CCCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](O)CCl)CC2	1826692090	LIPSDKPBWSGPBG-JSGCOSHPSA-N	425.942	1.640	50	20	IDGD	
Cc1ccc(CC(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)cn1	1827050752	XOCNRZCNSBCUGM-HSZRJFAPSA-N	449.360	1.546	50	20	IDGD	
O=C([C@@H](O)CCl)N1CCC([C@@H]2CCCCN2C(=O)[C@H]2Cc3ccccc3CN2)CC1	1827614444	XXVSFINHSJJCOD-HKBOAZHASA-N	433.980	1.920	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)[C@H]2CCC=CO2)CC1	1828891905	BAWHHVDINJXQAI-NHCUHLMSSA-N	426.322	1.292	50	20	IDGD	
O=C(CCOc1ccc(F)cc1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1830254174	DZKCRVLGODABHF-HKUYNNGSSA-N	432.851	1.585	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(F)c[nH]3)C2)C1	1830544386	XBVVZNGFQUANCP-SJCJKPOMSA-N	432.290	1.255	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC([C@H]2CCCCN2C(=O)Cn2ccncc2=O)CC1	1831106135	FTUBOXPDHSPDLE-GOSISDBHSA-N	434.613	1.715	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2nc(C)c(C)[nH]c2=O)CC1	1831828394	RMCIBODJAOKUHD-DLBZAZTESA-N	438.956	1.874	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3sccc3F)CCO2)C1	1831910960	YYCQUEUFORXHIQ-SJCJKPOMSA-N	449.342	1.988	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)/C=C/c3ccco3)CCO2)C1	1833069215	LJNBVJHGVZZCQK-IHMJFIQFSA-N	441.322	1.780	50	20	IDGD	
O=C(Cn1nnc2ccccc21)NC1CCN(C2CCN(C(=O)[C@@H](F)Cl)CC2)CC1	1833650963	HBSAFTOHEOVXCJ-LJQANCHMSA-N	436.919	1.537	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CCBr)CCO2)C1	1834824627	CRGUCBKMGGEMPJ-FZMZJTMJSA-N	442.148	1.011	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccc(F)cn3)CCO2)C1	1836030272	WHDMSGHRRNLAEH-YLJYHZDGSA-N	427.904	1.627	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3cccs3)CCO2)C1	1836083652	OCFAZQIJCLHJJD-KSSFIOAISA-N	445.379	1.778	50	20	IDGD	
O=C(c1cc(C(F)F)no1)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1836247353	KVTRNBFFORWEMP-OAHLLOKOSA-N	428.219	1.486	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC(OC2CCN(C(=O)[C@H]3C[C@H]3C3CC3)CC2)CC1	1836657045	KYCVXNFJFGVOKR-VXKWHMMOSA-N	440.349	1.025	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC(OC2CCN(C(=O)c3cc(O)n[nH]3)CC2)CC1	1836670243	CMIHFCZZXLFBTK-GFCCVEGCSA-N	443.342	1.759	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC(OC2CCN(C(=O)C3CN(C)C3)CC2)CC1	1836673945	KTBPXXSJBWQXMB-CQSZACIVSA-N	430.387	1.578	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc4c(c3)CC(=O)N4)CCO2)C1	1836789590	MEUYHOGOSZOSQX-IERDGZPVSA-N	435.908	1.269	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc4[nH]ccc4n3)CCO2)C1	1836902353	AYASLXLBAQFJOY-OAQYLSRUSA-N	434.924	1.898	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)C(=O)c3ccco3)CC2)CC1	1837111658	DBWWCDHIFXONOC-MRXNPFEDSA-N	426.897	1.715	50	20	IDGD	
CC[S@](=O)CCC(=O)N1CCC(OC2CCN(C(=O)[C@@H](Cl)COC)CC2)CC1	1838363057	SVSMDZPTOQKOAS-HPGBDJQBSA-N	437.002	1.398	50	20	IDGD	
C[C@@H](C(=O)N1CCC(OC2CCN(C(=O)[C@](C)(Cl)CCl)CC2)CC1)n1cnnn1	1838637730	AWAJHYZQRTWDQG-SCLBCKFNSA-N	447.367	1.469	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)cc1F	1838916372	PEYXZZKHEGPKRB-IFXJQAMLSA-N	443.313	1.988	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)cc1OC	1838931183	NLDKZPLEHSAUNH-QFBILLFUSA-N	430.860	1.308	50	20	IDGD	
Cc1cc(/C=C/C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)no1	1839200385	JPJNQDDYGSHOGZ-RHINWDHMSA-N	446.273	1.143	50	20	IDGD	
O=C(C[C@@H]1C[C@@H]2CC[C@H]1C2)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839202971	VHMOIBQXLYGDFT-BTWZCHHXSA-N	447.345	1.960	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(O)ccc3O)CCO2)C1	1839448846	YNHNDEWSKMYHPK-RBUKOAKNSA-N	447.315	1.404	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cncs3)C2)C1	1839963616	QGJNFMKKFJDXMW-LRDDRELGSA-N	432.340	1.387	50	20	IDGD	
CCn1nc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)cc1C	1840033616	LIIIXAQOFNAYLX-KDOFPFPSSA-N	443.342	1.065	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(Cl)cc3F)C2)C1	1840149518	RNRLISYWEHBPNB-KXBFYZLASA-N	449.306	1.803	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)/C=C/c3cnc(C)s3)C2)C1	1840155616	BTZWBUVCYWBHKA-FPZJGVQBSA-N	443.953	1.175	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3cnccn3)CCO2)C1	1840458056	JAXDBODGROVGDH-MOPGFXCFSA-N	445.347	1.102	50	20	IDGD	
Cc1nccn1[C@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1840489107	JXHVGRHFRRGSJF-QRWLVFNGSA-N	426.945	1.474	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2ncc(Cl)cc2Cl)C1	1840998726	FZOPXEUENAKZLA-UHFFFAOYSA-N	449.298	1.518	50	20	IDGD	
CS(=O)(=O)c1ccc(Cl)c(C(=O)N2CC3(CCCN3C(=O)[C@@H](O)CCl)C2)c1	1841354571	HXQMMFWXZNTIJQ-AWEZNQCLSA-N	435.329	1.160	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC2(CCCN2C(=O)c2ccc(S(C)(=O)=O)cn2)C1	1842254239	RTDLPTHHKNTFQX-GFCCVEGCSA-N	444.351	1.333	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC2(CCCN2C(=O)c2cc(C#N)c[nH]2)C1	1844795011	LNNFPKFSXOHYDI-HNNXBMFYSA-N	435.912	1.835	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)Cc2ccc([N+](=O)[O-])c(OC)c2)C1	1845148840	VTXKMBOUEJYMKS-AWEZNQCLSA-N	425.869	1.603	50	20	IDGD	
CC(=O)N[C@H](C(=O)N1CC2(CCCN2C(=O)[C@@H](C)Br)C1)c1ccc(F)cc1	1846178298	PBYTWBGMWWMVHR-WBMJQRKESA-N	440.313	1.990	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@H]2C(=O)NNC(=S)NC(C)(C)C)cc1	12748657	FRUIRQOQFIJAOR-INIZCTEOSA-N	440.591	1.726	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)CNC(=O)c1ccc(Br)s1	108101421	CPWSQUCKWKIAOO-UHFFFAOYSA-N	441.307	1.509	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)NCCC#N)cc2)o1	109007644	RWQQWNVNRPKLHF-UHFFFAOYSA-N	447.517	1.388	50	20	IDGD	
COC(=O)c1c(CC(=O)NNC(=O)c2cc(Br)c[nH]2)[nH]c(C(C)=O)c1C	726294396	QRKSIZMEYZGIKC-UHFFFAOYSA-N	425.239	1.407	50	20	IDGD	
C#Cc1cccc(NC(=S)NNC(=O)c2cccc(S(=O)(=O)NCC3CC3)c2)c1	727498038	PUHHZTZCFNSVLB-UHFFFAOYSA-N	428.539	1.988	50	20	IDGD	
O=C(CCCc1ccccc1)NNC(=O)NCCCN1C(=O)NC2(CCCCC2)C1=O	727841040	MQKGZYPBASFBNW-UHFFFAOYSA-N	429.521	1.985	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(C)c(C(=O)N([C@H]2CCS(=O)(=O)C2)N(C)C)c1	728179175	PJDVLUQNCLTFOW-HNNXBMFYSA-N	431.580	1.131	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)c2cccc(S(=O)(=O)NCC3CC3)c2)c(C)c1	728205614	SIVCUJSVQPBPFR-UHFFFAOYSA-N	430.530	1.865	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)COCCOc3ccccc3)cc2)CC1	728216069	PFESDRWLQDPFRW-UHFFFAOYSA-N	448.545	1.161	50	20	IDGD	
CCCN(CC)c1ccc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cn1	728343213	BBNYONMDVWKLMY-GOSISDBHSA-N	442.472	1.462	50	20	IDGD	
Cc1nn(-c2ccc(Br)cc2)c(C)c1C=NNC(=O)[C@@H](C)NS(C)(=O)=O	728435302	XKZHATDNRDIVNB-LLVKDONJSA-N	442.339	1.639	50	20	IDGD	
Cc1cccc(N2C(=O)N[C@H](CCC(=O)NNC(=O)[C@H](C)Oc3ccccc3F)C2=O)c1	730739273	BSXZCFYIVIXZAV-WMLDXEAASA-N	442.447	1.954	50	20	IDGD	
Cc1c(C(=O)NNC(=O)[C@H]2COc3ccccc3O2)nnn1-c1cccc2cnccc12	731165340	NYRIJXVIQBZBKP-LJQANCHMSA-N	430.424	1.725	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)c1cccc(NS(=O)(=O)c2ccc(F)c(F)c2)c1	732082840	OZRUXHLVMCKROX-UHFFFAOYSA-N	435.412	1.872	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)NCC(=O)N1CCN(C(=O)OC(C)(C)C)CC1)c1ccccc1	732245300	XXMWYLKWIUMEOF-QGZVFWFLSA-N	447.536	1.590	50	20	IDGD	
CC[C@@H]1Nc2ccc(C(=O)OCC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)cc2NC1=O	732340352	ZXFPYOREDSSSLV-AWEZNQCLSA-N	441.400	1.355	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCCCC2)cc1S(=O)(=O)NNC(=O)c1cccn1C	733249873	VTUVVWREZRJPRT-UHFFFAOYSA-N	440.547	1.131	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NC[C@H](OC)C(F)(F)F)c2ccccc2c1=O	733658845	NUIXZPOONJUGML-ZDUSSCGKSA-N	429.399	1.718	50	20	IDGD	
COc1ccc([C@@H]2[C@@H](C(=O)NNC(=O)CNC(=O)c3cccs3)CCC(=O)N2C)cc1	734321514	IKADREZDARAQOA-HNAYVOBHSA-N	444.513	1.244	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)Cc1ccc(S(=O)(=O)C(F)F)cc1	740642263	RTORFZJCNOABBD-LLVKDONJSA-N	430.404	1.979	50	20	IDGD	
CC(=NNC(=O)Nc1ccc(C(=O)O)cc1)c1ccc(S(=O)(=O)N2CCOCC2)cc1	743444355	JNIQEZXUYUMTTK-UHFFFAOYSA-N	446.485	1.951	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)N[C@@H]1CC(=O)N([C@@H]2C[C@H]2c2ccccc2)C1	743609531	XXKRRZSQXQTVPP-HLAWJBBLSA-N	444.495	1.973	50	20	IDGD	
C[C@H](C(=O)NNC(=O)c1c(Cl)cccc1Cl)N1C(=O)[C@H]2[C@H](C1=O)[C@H]1CC[C@H]2O1	744362206	XNQFERFUVCDDEZ-NHAJQZOWSA-N	426.256	1.305	50	20	IDGD	
CCO[C@H](C)c1nc(CN2CCN([C@H](C)C(=O)NNC(=O)CC(C)C)CC2)cs1	744412986	LOYXHCRVQYUQQX-HZPDHXFCSA-N	425.599	1.940	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)c2ccccc2I)c1	744473801	FUTMEUGHLFYJAK-UHFFFAOYSA-N	449.204	1.781	50	20	IDGD	
CCC(CC)N1C[C@@H](C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)CC1=O	744620704	KNUNKEUUDLXGOA-HNNXBMFYSA-N	438.550	1.188	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)Cc2ccn(-c3ccc(F)cc3)n2)n1	745421903	UPAGSKUXIUHEKH-UHFFFAOYSA-N	431.449	1.252	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)CCc2nc(O)c3c4c(sc3n2)CCC4)c1	746300396	SIPWHESLUDFXEU-UHFFFAOYSA-N	440.485	1.633	50	20	IDGD	
COc1cc2c(cc1CNC(=O)NNC(=O)COc1ccccc1[N+](=O)[O-])O[C@@H](C)C2	746344717	IRBPKHUUBCPFGO-LBPRGKRZSA-N	430.417	1.836	50	20	IDGD	
COc1ccccc1[C@H](NC(=O)NNC(=O)Cc1cn2ccccc2n1)c1nccn1C	746740022	GIKFTXIYROZUKT-FQEVSTJZSA-N	433.472	1.739	50	20	IDGD	
CN(CCO)S(=O)(=O)c1ccccc1CNC(=O)NNc1ccc(Cl)c(F)c1	746764612	DNYNGXKZCVELBO-UHFFFAOYSA-N	430.889	1.918	50	20	IDGD	
NS(=O)(=O)c1ccc(N2CCOCC2)c(C(=O)NNc2ccc(C(F)(F)F)cc2)c1	748507160	LQZOOSFEHSTWTL-UHFFFAOYSA-N	444.435	1.946	50	20	IDGD	
O=C(CCN1C(=O)NC2(CCCC2)C1=O)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1	748522494	CUDABUMHDLFVNI-UHFFFAOYSA-N	448.423	1.678	50	20	IDGD	
CCOC(=O)C1CCN(S(=O)(=O)NNC(=O)c2ccc(OC(C)C)c(OC)c2)CC1	748674474	VDACTOYYMCFRLT-UHFFFAOYSA-N	443.522	1.237	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2ccc3c(c2)NC(=O)[C@@H](C)N3C)c2ccccc2c1=O	749865330	IZTDZKCPYOHMKP-GFCCVEGCSA-N	434.456	1.268	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(F)ccc2[N+](=O)[O-])c1	751280283	FBXYNZYJLKGKBN-UHFFFAOYSA-N	438.437	1.839	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)N2CCN(c3ncccc3C(N)=O)CC2)c1C	751388426	VFLYDLRSLRFGCO-XMHGGMMESA-N	436.516	1.501	50	20	IDGD	
COc1cc(OC)cc(N2C[C@@H](C(=O)NNC(=O)c3ccc4c(c3)OCCO4)CC2=O)c1	752283621	GDUHZMOUJKKYDM-AWEZNQCLSA-N	441.440	1.289	50	20	IDGD	
Cc1oc(C(=O)NNc2nc(-c3ccccn3)nc3c2CCC3)cc1S(=O)(=O)N(C)C	754018850	UZPKHVGGIYQRQY-UHFFFAOYSA-N	442.501	1.936	50	20	IDGD	
CS(=O)(=O)c1ccc(-n2nnnc2COC(=O)/C(C#N)=C\c2ccc(O)cc2)cc1	754546467	NTPYCOHQXDXNNT-UVTDQMKNSA-N	425.426	1.422	50	20	IDGD	
O=C(CCc1ccncn1)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	755313424	MCLSZMYPDSDGSO-UHFFFAOYSA-N	428.452	1.629	50	20	IDGD	
Cc1ccccc1-n1nc(C(C)(C)C)cc1NC(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O	755760880	HFPUHDVRVGXQHT-CYBMUJFWSA-N	436.538	1.569	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCC1CCS(=O)(=O)CC1	756051199	STTNIXNLEKLMTQ-NSHDSACASA-N	448.339	1.372	50	20	IDGD	
N#Cc1cc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)ccc1F	756356413	BXSVZPGGTGZBCR-UHFFFAOYSA-N	447.448	1.185	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1)Nc1ccn(CCN2CCOCC2)n1	756646720	OHTKUCLBTDKZBZ-UHFFFAOYSA-N	442.455	1.211	50	20	IDGD	
C[S@](=O)c1ccc(NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1F	756770766	NNHYEQSJTSBIHE-HKBQPEDESA-N	447.536	1.928	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)Cc1ccn(-c2ccccc2)n1	756899820	QZMJBKOQKZXATD-UHFFFAOYSA-N	426.502	1.478	50	20	IDGD	
CC[C@@H]1CC[C@H](C(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)O1	756901015	GCMHWGCIPWASIP-IEBWSBKVSA-N	431.514	1.884	50	20	IDGD	
COc1ccc(C(C)(C)C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1OC	758144876	GLLVCWMLZPYWFL-UHFFFAOYSA-N	445.428	1.894	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNS(=O)(=O)c1ccc(F)cc1C(=O)OC	759091389	NIRYQYLHDFWVAR-UHFFFAOYSA-N	426.422	1.400	50	20	IDGD	
Cc1ccnc(-n2nccc2NC(=O)C(=O)NNC(=O)c2cccc(OC(F)F)c2)c1	760278607	ZYIRKJKMKUWLAY-UHFFFAOYSA-N	430.371	1.577	50	20	IDGD	
N#C/C(=C/c1ccc(O)cc1)C(=O)OCC(=O)Nc1cc(S(N)(=O)=O)ccc1Cl	761188484	NMAIBUNFPKDWSV-GHXNOFRVSA-N	435.845	1.782	50	20	IDGD	
O=C(NNC(=O)c1cccnc1)C(=O)Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1	763492399	XJVMDSFIZCXBGG-UHFFFAOYSA-N	445.501	1.046	50	20	IDGD	
Cc1ccc(C(=O)N2CCOCC2)cc1NC(=O)C(=O)NNC(=O)c1c[nH]c2ccccc12	763541203	PKLWPCINGCNVON-UHFFFAOYSA-N	449.467	1.348	50	20	IDGD	
COCCn1ccc2ccc(NC(=O)C(=O)NNC(=O)[C@@H]3COc4ccccc4O3)cc21	763573591	TWVYTBFHUVBGKU-IBGZPJMESA-N	438.440	1.214	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(CN3C(=O)CCCC3=O)cc2)c(C)o1	763584134	SXGDYMANRDYLPD-UHFFFAOYSA-N	426.429	1.335	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cccc(OCCN(C)C)c2)c2ccccc2n1	763610440	FTEOLCXHHKNNJV-UHFFFAOYSA-N	435.484	1.883	50	20	IDGD	
COc1ccc(OC(C)C)c(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)c1	763681072	JFIGMIRXLRPDGL-UHFFFAOYSA-N	426.429	1.519	50	20	IDGD	
O=C(NNC(=O)C12CC3CC(CC(C3)C1)C2)C(=O)Nc1cccc(CN2CCOC2=O)c1	763727638	KTUHLJHCFIDFTF-UHFFFAOYSA-N	440.500	1.941	50	20	IDGD	
COc1ccc(OC(C)C)c(NC(=O)C(=O)NNC(=O)c2nnc(O)c3ccccc23)c1	763789910	GEDKHUFQRXCXOF-UHFFFAOYSA-N	439.428	1.531	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccn(CCc2ccncc2)n1	763872161	KLWGDNSDMPFETJ-AWEZNQCLSA-N	440.435	1.213	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccccc2-n2ccnn2)cc1OC	763912428	OAMCYAISMMEZHY-UHFFFAOYSA-N	438.444	1.464	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)C(=O)Nc1cccc(C(F)F)c1Cl	763917254	SKJRKWQFYKIGGL-UHFFFAOYSA-N	435.778	1.653	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)C(=O)Nc1c(F)c(F)c(F)c(F)c1F	763994116	ABXMQRRAVXOJOS-UHFFFAOYSA-N	441.110	1.872	50	20	IDGD	
N#Cc1cccnc1-n1cc(NC(=O)C(=O)NNC(=O)Cc2cccc3ccccc23)cn1	764037412	WHBYEIGJWXKAGP-UHFFFAOYSA-N	439.435	1.621	50	20	IDGD	
COc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NNC(=O)Cc1ccc2ccccc2c1	764085195	QOURSDDWHBCVIP-UHFFFAOYSA-N	448.479	1.879	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cccn(Cc3ccc(F)cc3)c2=O)cc1	764177972	ZIVFRVYEVVDTAZ-UHFFFAOYSA-N	433.399	1.307	50	20	IDGD	
CN(C)CC(=O)NNC(=O)C(=O)Nc1cc(Cl)c(OCC(F)(F)F)c(Cl)c1	764213038	SIYISGODLUSLAN-UHFFFAOYSA-N	431.198	1.582	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2cccc3ncccc23)cc1N1CCOC1=O	764258894	COYSAOBLNUTVNZ-UHFFFAOYSA-N	449.423	1.600	50	20	IDGD	
COc1ncc(C)cc1NC(=O)C(=O)NNC(=O)c1cc(F)ccc1Br	764270735	SGNFJHRHIJVHIL-UHFFFAOYSA-N	425.214	1.700	50	20	IDGD	
COCCn1ccc2ccc(NC(=O)C(=O)NNC(=O)COc3ccccc3O)cc21	764276881	DNPKZTHIBLVJHO-UHFFFAOYSA-N	426.429	1.158	50	20	IDGD	
CCNC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(OC)cc2OC)c1	764286962	QUCRQGJSOUDFCB-UHFFFAOYSA-N	429.433	1.245	50	20	IDGD	
COc1cc(C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)ccc1OCC(N)=O	764334576	LSFYQPIPJJMXBI-UHFFFAOYSA-N	434.399	1.487	50	20	IDGD	
Cc1nc(SCC(=O)NNC(=O)CNC(=O)c2cccnc2)[nH]c1Cc1ccccc1	764343363	PKKKOGFHVRQDBJ-UHFFFAOYSA-N	438.513	1.373	50	20	IDGD	
COc1cc(C#N)ccc1Oc1ccc(NC(=O)C(=O)NNC(=O)c2cnn(C)c2)cc1	764358609	LLVGETIUQQFIFH-UHFFFAOYSA-N	434.412	1.492	50	20	IDGD	
COc1ccc(Br)c(NC(=O)C(=O)NNC(=O)COCc2ccccc2)c1	764366953	RIHVVHQJGFKJIP-UHFFFAOYSA-N	436.262	1.760	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCCS(=O)(=O)CC1CC1	765643940	KSUOUASKISFSGU-LLVKDONJSA-N	448.339	1.372	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)CNC(=O)Nc3ccccc3)CC2)cc1	765754459	KLPDJLMFDFTZOF-UHFFFAOYSA-N	438.532	1.082	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@H](c3ccccc3)n3cccn3)CC2)cc1	766639465	AEWQZMMRHNLEMI-DEOSSOPVSA-N	446.555	1.746	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)c1ccc2nccn2c1	766659294	AGMWHWMQQWQAPS-UHFFFAOYSA-N	426.908	1.567	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)CNC(=O)CNC(=O)OC(C)(C)C)n[nH]2)cc1C	767119542	KEQXHUMCXULAKZ-UHFFFAOYSA-N	444.492	1.095	50	20	IDGD	
Cc1ccc2c(c1)C(=O)N([C@@H](C)C(=O)OCC(=O)NNC(=O)Cc1ccccc1C)C2=O	767260418	LYAOFLWBGZWNMP-HNNXBMFYSA-N	437.452	1.221	50	20	IDGD	
O=S(=O)(CBr)N1CCN(S(=O)(=O)c2ccc3ncccc3c2)CC1	767851216	PHFVKKNCBOKNSI-UHFFFAOYSA-N	434.337	1.223	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)[C@H](c2ccccc2)N2CCN(C)CC2)n[nH]1	768282062	VJMKYPYXLKQCDI-QFIPXVFZSA-N	448.527	1.835	50	20	IDGD	
CCS(=O)(=O)c1ccc(CCC(=O)NNc2c(OC)cccc2S(C)(=O)=O)cc1	768634093	DWBLVOWMELMCJM-UHFFFAOYSA-N	440.543	1.968	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)c2ccccc2SCC(N)=O)c2ccccc2c1=O	768948569	CYMWFQPHXWLINM-UHFFFAOYSA-N	439.497	1.630	50	20	IDGD	
CCc1c(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cnn1-c1ccc(OC)cc1	769924563	UKLVOGBFLIXTJQ-UHFFFAOYSA-N	449.515	1.911	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N(C)C)nc2)cc1OC	770220755	SQVMPSYPDPWRJJ-UHFFFAOYSA-N	436.490	1.204	50	20	IDGD	
CS(=O)(=O)c1cc(S(=O)(=O)NNC(=O)NCCc2cccs2)c(Cl)s1	770630915	FYHVFEMZPVEMOY-UHFFFAOYSA-N	443.981	1.602	50	20	IDGD	
CCC[C@@H](NC(=O)NCc1ccc(F)cc1)C(=O)NNc1nc(O)c2cnn(C)c2n1	770972856	JUWULZKYRJLUKW-CQSZACIVSA-N	430.444	1.319	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)c3ccc(F)cc3C)CC2)cc1	771277044	YDPPEVSUPGCAET-UHFFFAOYSA-N	448.520	1.210	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)C1(OCc2ccccc2)CCOCC1	772418001	YWLBVHCIVKSIHL-UHFFFAOYSA-N	440.496	1.994	50	20	IDGD	
Cc1cnc(O)n1-c1ccc(C(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)cc1	772898237	OEXPXLCYLBNFKS-UHFFFAOYSA-N	427.848	1.617	50	20	IDGD	
Cc1ccc(-n2nccc2NC(=O)C(=O)NNc2ccc(Br)c(F)c2)nn1	773508515	LMVXGGWUDYMGCZ-UHFFFAOYSA-N	434.229	1.954	50	20	IDGD	
CCOC(=O)[C@@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNc2ccccc2[N+](=O)[O-])cc1	773648215	PGYJVSLBUBJUGB-GFCCVEGCSA-N	443.416	1.358	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1cc2c(cc1F)NC(=O)CC2	774010214	WIHKFDWJGOZOMH-JTQLQIEISA-N	448.838	1.917	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(OC(C)C)c(NC(=O)NNC(=O)CN(C)C)c1	775448759	UDAKJUINBZVTJZ-UHFFFAOYSA-N	429.543	1.219	50	20	IDGD	
CC(=O)c1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c(F)c1	776731018	UIKBYZFMRMOBES-UHFFFAOYSA-N	449.460	1.124	50	20	IDGD	
O=C(Cc1ccc(F)cc1Br)NNC(=O)C1CCN(c2ncccn2)CC1	776829909	UYKYQMJSMKHNCM-UHFFFAOYSA-N	436.285	1.985	50	20	IDGD	
O=C(NNC(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1)c1ccc(-n2cnnn2)cc1	780174590	ZAOFBWZSYPPQEI-UHFFFAOYSA-N	425.408	1.732	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccccc1S(=O)(=O)NC1CC1)c1ccc(Cl)cc1O	780377294	KRMGFQOWKAUVEW-UHFFFAOYSA-N	445.906	1.110	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)c2ccccc2c1=O	781931044	UHEHENFFGTZMHT-UHFFFAOYSA-N	433.327	1.518	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2cccc(S(=O)(=O)N3CCCCC3)c2)nc1	782145297	PUMRNAQOVJLHAX-UHFFFAOYSA-N	433.490	1.347	50	20	IDGD	
NS(=O)(=O)c1cc(F)cc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2Cl)c1	782927253	NKYWVFJSLUYOBU-UHFFFAOYSA-N	449.247	1.180	50	20	IDGD	
N#Cc1cccnc1Oc1ccccc1NC(=O)C(=O)NNc1ccc(-n2cccn2)nn1	783433206	OKXDTYNSSUIACW-UHFFFAOYSA-N	441.411	1.803	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2ccc(OCC(F)F)cc2)cc(OC)c1OC	783805344	TZSKIWGVNAOTIN-UHFFFAOYSA-N	446.428	1.980	50	20	IDGD	
Cc1cc(Br)cn2c(C=NNC(=O)CSc3nnc(O)nc3O)cnc12	783820704	HXRLNSJPAOJNCH-UHFFFAOYSA-N	438.267	1.244	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2cc(NC(=O)CN3CCCC[C@@H]3C)ccc2F)ncn1	783948377	NNDMHDKAVDNHEA-AWEZNQCLSA-N	443.483	1.819	50	20	IDGD	
O=C(NNC(=O)C(=O)N1CCCC1)C(=O)Nc1ccccc1-c1cc(F)c(F)c(F)c1	783999279	LHVWMALONSZDQB-UHFFFAOYSA-N	434.374	1.479	50	20	IDGD	
CS(=O)(=O)CCc1ccc(NC(=O)C(=O)NNc2ccc(OC(F)F)cc2)cc1	784307093	CQIFUOBCTHHOOT-UHFFFAOYSA-N	427.429	1.957	50	20	IDGD	
CCCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNc2cccc(C(=O)OC)c2)cc1	784851000	DSKBYKVLXLRGDC-UHFFFAOYSA-N	434.474	1.707	50	20	IDGD	
CCNC(=O)N(C)NC(=O)C(=O)Nc1cnn(C2CCN(C(=O)OC(C)(C)C)CC2)c1	784917826	YVBDLZJKWQIODE-UHFFFAOYSA-N	437.501	1.086	50	20	IDGD	
Cc1c(Br)cccc1NC(=O)C(=O)NNC(=O)c1cc([N+](=O)[O-])ccc1O	785021752	BQZMTLXHSOCFFB-UHFFFAOYSA-N	437.206	1.771	50	20	IDGD	
CCN(c1ccc(NC(=O)C(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)cc1)C(C)C	785024355	UFOMRLYUQOJVLE-UHFFFAOYSA-N	429.433	1.935	50	20	IDGD	
Cc1ccc(C(=O)NCC2CC2)cc1NC(=O)C(=O)NNc1cccc(S(C)(=O)=O)c1	785990011	XTGSSXARPIYCHV-UHFFFAOYSA-N	444.513	1.620	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCc2ncnn2-c2ccccc2)nc1	787348949	WEZXPMUBANDKNX-UHFFFAOYSA-N	444.521	1.519	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)cccc1N1CCNC1=O	787542774	QVRQNNQNBIDQPV-UHFFFAOYSA-N	434.456	1.265	50	20	IDGD	
Cc1ccc(N2CCNC2=O)cc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccc(F)cc1	787544556	UNGHMUYLPFDGMA-CYBMUJFWSA-N	443.435	1.217	50	20	IDGD	
CN(C)NC(=O)Nc1cccc(NC(=O)C2CCN(S(=O)(=O)c3cccnc3)CC2)c1	788252757	BDBOJRSXWJVCGT-UHFFFAOYSA-N	446.533	1.719	50	20	IDGD	
CS(=O)(=O)[C@@H]1CCCC(=NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)C1	788406961	BUOFRMSUPARMSQ-QGZVFWFLSA-N	441.575	1.934	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)CCc1c(C)nc2nc(C(F)(F)F)nn2c1C	790063394	JBFPILQOUPNHHA-UHFFFAOYSA-N	446.430	1.629	50	20	IDGD	
O=C(NNS(=O)(=O)c1cccc(S(=O)(=O)N2CCCCCC2)c1)c1ccccn1	790381848	DHCGDYMGINUFTN-UHFFFAOYSA-N	438.531	1.270	50	20	IDGD	
CSSCCNC(=O)N1CCN(S(=O)(=O)c2cccc3nsnc23)CC1	790879332	CYDLVAJIYSASGU-UHFFFAOYSA-N	433.606	1.718	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc([C@H]2CCCOC2)nn1C	790952741	UNKWLPSAOVVXFX-HNNXBMFYSA-N	429.477	1.041	50	20	IDGD	
CC(=O)N1CCCN(c2ccc(F)cc2NC(=O)C(=O)NNc2cccc(C#N)c2)CC1	790954084	QUWMZWYPHGFONF-UHFFFAOYSA-N	438.463	1.838	50	20	IDGD	
Cc1ccc(NC(=O)OC(C)(C)C)cc1C(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1	793177448	RCVFCZOEOFTEGV-ZDUSSCGKSA-N	426.495	1.473	50	20	IDGD	
CNS(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)CCCc2ccccc2)cc1C	794587164	GYTDCZXSXOTCCO-UHFFFAOYSA-N	425.532	1.236	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)/C(=C/c2ccc(F)cc2)n2nnnc2C)cc1C	798307608	AOPQLROGEORJJH-WQRHYEAKSA-N	437.435	1.522	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCC2CCC(F)(F)CC2)cc1	800741408	KEKPTWSOKLJVCV-UHFFFAOYSA-N	432.493	1.771	50	20	IDGD	
C[C@H](Sc1ccccc1C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1)C(N)=O	801148123	RMGZPHLCTJLFKQ-LBPRGKRZSA-N	434.543	1.850	50	20	IDGD	
COc1cnc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)s1	806517031	TXFKREFSXFLZBL-UHFFFAOYSA-N	425.492	1.403	50	20	IDGD	
COCc1cnc(NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)s1	806609540	CPIWKKWQAAVPLF-UHFFFAOYSA-N	427.508	1.071	50	20	IDGD	
Cn1ncc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)c1-c1ccccc1	806973773	WFNRNWWTMBWKKQ-UHFFFAOYSA-N	429.440	1.877	50	20	IDGD	
NS(=O)(=O)c1ccccc1CNC(=O)NNC(=O)c1ccc(Br)s1	807605812	RTSBDIQDJMRHFB-UHFFFAOYSA-N	433.309	1.302	50	20	IDGD	
O=C(NNC(=O)c1nc2ccccc2cc1Br)N[C@H]1CCS(=O)(=O)C1	808384854	GOXFYWUTTSAGBM-JTQLQIEISA-N	427.280	1.128	50	20	IDGD	
COc1ccc(-c2ocnc2C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1	808645192	XSNMPWHEKIGITF-UHFFFAOYSA-N	440.368	1.876	50	20	IDGD	
O=C(NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)N[C@@H](C1CC1)C(F)(F)F	808866360	VXHDQIXZDFAVJF-AWEZNQCLSA-N	434.440	1.756	50	20	IDGD	
COc1cc(F)c(F)cc1NC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1	810271490	UYNCOPZKBVTIKQ-UHFFFAOYSA-N	442.444	1.755	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C(=O)Nc1cc(C(N)=O)ccc1OCC(F)F)c1ccccc1	810386994	AQEMBKSSAHXRCZ-AWEZNQCLSA-N	448.426	1.709	50	20	IDGD	
NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc3ccccc3o2)c(OCC(F)F)c1	810387347	RQQVESWIHISVIV-UHFFFAOYSA-N	446.366	1.575	50	20	IDGD	
COc1ccc(S(=O)(=O)NCC(=O)NNc2ccnc(Br)c2)cc1OC	811123564	AIZUETBYEFFJSQ-UHFFFAOYSA-N	445.295	1.283	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccccc1F)NNc1ccc([N+](=O)[O-])cc1Br	811222143	MTMJCPWPLAQFEA-UHFFFAOYSA-N	447.242	1.918	50	20	IDGD	
CCCc1nnc(SCC(=O)NNC(=O)c2cc(F)ccc2Br)n1N	813439241	NDXHDZJQLQVIML-UHFFFAOYSA-N	431.291	1.399	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)NNc2ccccc2S(=O)(=O)N(C)C)cc1	814636313	FZUWXCUUWOULFZ-UHFFFAOYSA-N	441.535	1.847	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCc2nncn2C1)C(=O)Nc1cccc(-c2ccc3c(c2)CCO3)c1	815691873	DFGWBFHHVRYSIT-QGZVFWFLSA-N	446.467	1.229	50	20	IDGD	
Cc1cc(C)n(-c2ccc(C(F)(F)F)cc2NC(=O)C(=O)NNC(=O)[C@H]2CCCO2)n1	815780378	VXTQZSYJRGLQOH-OAHLLOKOSA-N	439.394	1.773	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)C1CCC(OC[C@@H]2CCCO2)CC1	815933854	CKYZBUSKYACURL-VJFUWPCTSA-N	437.924	1.858	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)N2CCC[C@@H]2C(=O)NNc2cccc(Cl)n2)o1	817007310	VSISNIYTONOTSC-LLVKDONJSA-N	442.881	1.801	50	20	IDGD	
CC/C=C(\C)C(=O)N1CSC[C@@H]1C(=O)NNc1ccccc1S(=O)(=O)N(C)C	817055219	RNARDRLDOUJKRQ-XETPBLJFSA-N	426.564	1.638	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ccc3nnnn3n2)CC1)c1cc2ccccc2cc1O	897096800	DJIISUKVEIBXHM-UHFFFAOYSA-N	432.444	1.056	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NN=Cc1c(C)n(C)n(-c2ccccc2)c1=O	912797939	SFTVCMJBLIBHIK-UHFFFAOYSA-N	440.529	1.850	50	20	IDGD	
CC(C)C[C@H](C(=O)NNC(=O)Cn1cnc2ccccc21)N1C(=O)[C@@H]2CC=CC[C@H]2C1=O	913496619	CCVMDYCKYKOVDS-GPMSIDNRSA-N	437.500	1.550	50	20	IDGD	
N#Cc1ccccc1CSCCNC(=O)NNC(=O)c1csc(N2CCOCC2)n1	914532999	BYBAXMWVCMQDCR-UHFFFAOYSA-N	446.558	1.729	50	20	IDGD	
COc1cc(OC)cc(C(=O)NN=C2CCN(S(=O)(=O)c3c(C)n[nH]c3C)CC2)c1	914559470	OGYPSWWFTKWAOQ-UHFFFAOYSA-N	435.506	1.614	50	20	IDGD	
O=C(CN1CCS(=O)(=O)CC1)NNC(=S)Nc1cc(C(F)(F)F)ccc1Cl	916163199	WGMGUOKTQSPLRX-UHFFFAOYSA-N	444.888	1.407	50	20	IDGD	
COCc1ccccc1CNC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	916425732	UUVAAJUGGHZNKE-UHFFFAOYSA-N	425.533	1.876	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCCCCN1CCCC[C@H]1C	916504270	RJXOANGWAJVHSI-OAHLLOKOSA-N	438.598	1.887	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NC[C@]1(N2CCOCC2)CCSC1	916636878	NWAOBLGYMAEWGX-IFXJQAMLSA-N	426.514	1.131	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1	918220148	VOXSUIYVDVQDHC-UHFFFAOYSA-N	441.463	1.568	50	20	IDGD	
COc1cccc(OC)c1Oc1ccc(CNC(=O)NNC(=O)C(=O)NC2CC2)cn1	918221776	NWZMQDVRWLMRLZ-UHFFFAOYSA-N	429.433	1.000	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)Nc2ccc(S(N)(=O)=O)cc2)N(C)c2ccccc21	919685782	VDTINXJQJUXRTO-UHFFFAOYSA-N	439.497	1.943	50	20	IDGD	
O=C(COc1ccc(C2SCCCS2)cc1)NNC(=O)N[C@@H]1CCS(=O)(=O)C1	919883178	BLZWHVFMJIKRSQ-CYBMUJFWSA-N	445.588	1.452	50	20	IDGD	
NC(=O)c1ccc(/C=C/C(=O)N2CCC[C@@H]2C(=O)NNC(=O)c2cccc(Cl)c2)cc1	920021938	RGLULYJYBJLHME-VEGGFIAOSA-N	440.887	1.904	50	20	IDGD	
O=C(NN=Cc1ccc(OC(=O)c2cccc([N+](=O)[O-])c2)cc1)N[C@H]1CCS(=O)(=O)C1	920381763	UALYMZBXWWFQQZ-HNNXBMFYSA-N	446.441	1.634	50	20	IDGD	
Cc1noc(C)c1S(=O)(=O)N1CCC(C(=O)NNC(=S)Nc2ccccn2)CC1	1119112489	ZONDJDCKOAAUFZ-UHFFFAOYSA-N	438.535	1.105	50	20	IDGD	
Cc1ccc(C(=O)N2CCC(NC(=O)NNC(=O)c3nnc(O)c4ccccc34)CC2)cc1	1318258819	ILMRYHOPKMCLCR-UHFFFAOYSA-N	448.483	1.893	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NN=C2C(=O)Nc3cc4c(cc32)OCCO4)CC1	1328603363	YASBZJWRBOAJFQ-UHFFFAOYSA-N	430.461	1.877	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1)CC1(C)OCCO1	1340294046	UYOXEWLXTRFZGK-CQSZACIVSA-N	428.530	1.753	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)C1CCC3(CC1)OCCO3)C2)[C@@H](F)Cl	1778030313	WEQKYVUWKNOBIE-GPMSIDNRSA-N	432.920	1.968	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnncc2C(=O)O)C1	1779692125	WTNPIVJSJIUDNN-FOIQADDNSA-N	438.912	1.567	50	20	IDGD	
COc1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)C(C)(C)CCl)C3)nn1C	1780241505	PHYBNRMXOUJJOS-FOIQADDNSA-N	426.945	1.821	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cccc(F)c3)C2)C1	1780603956	IMCUYDTVCWIVAT-BHSKHCGUSA-N	441.463	1.403	50	20	IDGD	
CC1CCN(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](F)Br)C2)CC1	1780770418	NAHNXCMZDFPNTB-SZVBFZGTSA-N	448.377	1.923	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1ccccn1)C2)[C@H](F)Br	1780773204	GNWPBEOZSJZBTG-UWWQBHOKSA-N	428.302	1.829	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)COCCNC(=O)OC(C)(C)C)CCO2)C1	1781216822	OYBHPBLXWJNVOE-FOIQADDNSA-N	447.960	1.375	50	20	IDGD	
Cn1nc2c(c1C(=O)NC[C@@]13CCCO[C@@H]1CCN(C(=O)C(Cl)Cl)C3)CCC2	1781371937	JJFKSCTVFQFMEC-AUUYWEPGSA-N	429.348	1.840	50	20	IDGD	
Cc1ccccc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCC(=O)NN(C)C)C1	1782212030	CUOWYFKCLPAISN-AUSIDOKSSA-N	430.549	1.496	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc([N+](=O)[O-])[nH]3)CCO2)C1	1783351140	FNKMRWXQDYLJEO-ZBEGNZNMSA-N	429.271	1.540	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(Cl)cnc3O)[C@H]2C1	1783402810	JENIJUQVRABSHU-HPEDKQMDSA-N	432.304	1.288	50	20	IDGD	
COC(=O)CCCCCC(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](C)Br)C2)C1	1783539441	JAFDNCROLXVYLL-KDOFPFPSSA-N	433.343	1.723	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)C1CCC(F)(F)CC1)CCO2	1783933229	FBHFPAJDQCBXRI-LJQANCHMSA-N	430.496	1.015	50	20	IDGD	
Cc1cccc(CCC(=O)N2CCO[C@@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)c1	1783933651	UBWXDGYVEOXLCL-HSZRJFAPSA-N	430.549	1.131	50	20	IDGD	
Cc1ccn2c(=O)c(C(=O)N3CCO[C@@]4(CCN(C(=O)C(Cl)Cl)C4)C3)cnc2c1	1783947976	PJKTVLLTIXUCKF-LJQANCHMSA-N	439.299	1.250	50	20	IDGD	
O=C1CCc2ccc(C(=O)N3CCO[C@]4(CCN(C(=O)C(Cl)Cl)C4)C3)cc2N1	1783949884	NUKSMFWLXYIVSO-IBGZPJMESA-N	426.300	1.819	50	20	IDGD	
CC(=O)O[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]2C1)C(C)C	1783967781	WUARXWGJHSKWJJ-SRQBIAJPSA-N	447.370	1.585	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C3(c4ccc(F)c(F)c4)CC3)C[C@@H]21)[C@H](O)CCl	1784092847	NDLABWHBRZHVPS-KYABYICQSA-N	442.890	1.576	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)c1cnccc1C(F)(F)F	1786000917	NJQKPQVKYKGIIF-FATJJJSSSA-N	435.830	1.293	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnn4ncccc34)[C@H]2C1	1787378071	UJRIWOFNEJAVAX-DUPGQFARSA-N	436.310	1.106	50	20	IDGD	
CN1CCCC[C@@H]1C(=O)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1	1788140053	FYUXLQHUXSHEPB-OAQYLSRUSA-N	435.333	1.598	50	20	IDGD	
C[C@H](Nc1cnccn1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]21	1788629749	XBMMCYLCEBJPFR-OSBUWBMXSA-N	444.363	1.493	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cn3cnc4ccccc43)C[C@@H]21	1788763485	GKESNORSSBVQNK-ZWOKBUDYSA-N	444.608	1.868	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccn4nccc34)[C@H]2C1	1790397730	HGEHVCDFOGDNMR-OAOQPFQOSA-N	449.349	1.959	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cc(C)cc(F)c3)C[C@@H]21	1791257445	GZVSWELCOGOSHI-KANFNMMFSA-N	426.916	1.910	50	20	IDGD	
Cc1nccn1CCCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21	1791572999	FTDFHLLLCMQBFH-QBYUYEEZSA-N	445.333	1.642	50	20	IDGD	
COc1ccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Br)C3)cc1O	1792730523	IEERZKIBAXVMPR-CZAMWMTLSA-N	445.285	1.223	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(CC#N)cc1)C2	1792873558	DFSUJIUPWFZMDW-NKGKWGDASA-N	434.334	1.987	50	20	IDGD	
COc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](O)CCl)c(Cl)c1OC	1792975541	UPAGWMIOGHVDPQ-DZJQYVJYSA-N	447.315	1.160	50	20	IDGD	
O=C(Cc1cccc(F)c1F)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1	1796189904	CIXXNRUMMMROJL-BCDXTJNWSA-N	428.244	1.139	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1nc2ccccc2[nH]1	1796817706	QYTIICWZDHVGAK-NFFDBFGFSA-N	435.322	1.797	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1ON=C(c2ccccc2)O1	1797643019	GWQXWKWURGEDBO-HPNQWNLUSA-N	447.564	1.162	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@]1(F)CCCCC1(F)F)c1ccc(B(O)O)cc1	1797797645	LUGZJHIFYGAWOV-CLWJZODNSA-N	438.255	1.536	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(C(C)C)[nH]n1	1798670841	SCWKTRBLUAJTON-ZWUHOBOKSA-N	427.343	1.910	50	20	IDGD	
Cc1nn(C)c(C)c1CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@](C)(Cl)CCl	1799278514	LMYXJQSZARYVDN-QOIYZWAUSA-N	431.364	1.405	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CS[C@@H]1CCCCO1)C2	1800759198	KSXULLXIBPQGKO-CNBXADPUSA-N	435.384	1.619	50	20	IDGD	
COc1cccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Br)C3)c1F	1801926035	JHXHXSJXYHHESJ-ANGCBRKESA-N	433.249	1.728	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1(F)CN(C(=O)OC(C)(C)C)C1	1802201309	JVLZBBRNEOLTGC-XGUBFFRZSA-N	447.935	1.552	50	20	IDGD	
COC[C@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1(F)CN(C(=O)OC(C)(C)C)C1)C2	1802283359	SFHHACZJSFVSBE-XGUBFFRZSA-N	447.935	1.837	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2snnc2C2CC2)[C@H]1c1cccnc1)[C@@H](O)CCl	1803139231	MPGJZXNAOSUPIR-DZKIICNBSA-N	435.937	1.730	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)Cc2cnccn2)[C@H]1c1cccnc1	1803300832	MWQDEBFYEXWFPF-JCKWVBRZSA-N	432.322	1.904	50	20	IDGD	
CCNC(=S)NCC(=O)N1CCC2(CCCN(C(=O)[C@H](C)CBr)C2)CC1	1805389971	YXGCRXRVDBNGOU-CQSZACIVSA-N	447.443	1.733	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC2(CCCN(C(=O)CS(=O)(=O)CC)C2)CC1	1805967675	ITALYWXWUJMUQJ-CQSZACIVSA-N	437.400	1.826	50	20	IDGD	
O=C(Cc1ccc2c(c1)OCO2)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1	1806674273	DCXRNFMQAUESRL-FVJLSDCUSA-N	445.903	1.659	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)Cn2ccccc2=O)[C@@H]1c1cccnc1	1807441174	FJEILYUBPISCEG-QOKNQOGYSA-N	447.333	1.733	50	20	IDGD	
CC1=C(C(=O)NC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)CCO1	1807766594	ZCXDDRPKNQNARQ-UWJYYQICSA-N	429.521	1.155	50	20	IDGD	
O=C(CS[C@@H]1CCCCO1)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1	1810343419	VSWAVTRVIOEPKA-DKKFBQAASA-N	441.981	1.947	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)c1c(O)cc(O)cc1O	1811412221	HUWCFKIZYLWYQB-IWEFOYFVSA-N	435.864	1.118	50	20	IDGD	
Cc1ccccc1C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1811776912	QBGYZYWRSUCTBQ-NFBKMPQASA-N	443.312	1.703	50	20	IDGD	
CCc1cc(C(=O)N2CC[C@H](CNC(=O)[C@H](Cl)COC)[C@@H]2c2cccnc2)nn1C	1813030402	CTXOEULXAMIDID-SUMDDJOVSA-N	433.940	1.951	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1)C1(O)CCC1	1813067716	BONORVANHBKKIC-HGHGUNKESA-N	445.564	1.012	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)cn1C	1817471742	LNORZKVHANRWLU-LJQANCHMSA-N	435.293	1.356	50	20	IDGD	
Cc1noc(C)c1CC(=O)N1CCCC[C@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1	1822410664	OABNZDKJZFTPLM-KRWDZBQOSA-N	445.524	1.622	50	20	IDGD	
C[C@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)CC1)[C@H]1SC(=N)NC1=O	1824183126	PRCPCBQBYHJFPO-CYUUQNCZSA-N	444.985	1.008	50	20	IDGD	
O=C(C1CCOCC1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827051209	PXRANQOLFMSOSE-NRFANRHFSA-N	428.338	1.026	50	20	IDGD	
Cc1ccncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1	1827898790	COLHYYWILKAZCD-JOCHJYFZSA-N	435.333	1.617	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)COC(=O)C(F)(F)F)CC1	1828834243	DIJZPIPOKHGAAB-KBPBESRZSA-N	442.862	1.965	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccncc3)C2)C1	1830543405	RAVRTSBSUIPFLF-HNAYVOBHSA-N	440.338	1.112	50	20	IDGD	
CC(C)(Cc1ccccc1)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1	1830547243	IMPLDTNHBNAWMU-AVRDEDQJSA-N	438.952	1.311	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CCS(C)(=O)=O)CC1	1831656061	DQZFQHATDCAOIM-HIFRSBDPSA-N	437.400	1.824	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@H](C)n2cnnn2)CC1	1831656828	LJLAACYDQXJLOM-YDHLFZDLSA-N	427.347	1.637	50	20	IDGD	
Cc1cc(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)ccn1	1832626455	OISKFIHYIAVVGG-QFIPXVFZSA-N	449.624	1.631	50	20	IDGD	
N#CC1(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CCC1	1832785918	LYOOMGLCGZGEMO-LJQANCHMSA-N	438.532	1.612	50	20	IDGD	
CC(=O)N/C(C)=C/C(=O)N1CCC(N2CCC(NC(=O)C(C)(C)CCl)CC2)CC1	1833215436	IFSWGNVNMFLQIR-FYWRMAATSA-N	426.989	1.863	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cccc4c3OCC4)CC2)CC1)[C@H](O)CCl	1833309846	BBXHGQOLWCEOEI-LJQANCHMSA-N	435.952	1.406	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cnnc4ccccc34)CC2)CC1)[C@H](O)CCl	1833310264	OKPUKBZIJINEKB-HXUWFJFHSA-N	445.951	1.415	50	20	IDGD	
C#CCO[C@@H](C)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)Br)CC2)CC1	1833469023	JUJULLUWRSMRNT-CABCVRRESA-N	428.371	1.380	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccn(C)c3)CCO2)C1	1833858909	ORPYCBKSHJFBED-CRAIPNDOSA-N	428.327	1.269	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)c(C)o1	1834094569	BTRJIPAXJGOFNC-WMLDXEAASA-N	433.274	1.657	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCC(N2CCC(NC(=O)c3ccnnc3)CC2)CC1	1834142090	QFXBTEYOPLKIAZ-LJQANCHMSA-N	428.364	1.898	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cncc(F)c3)CCO2)C1	1834361164	MCOWBZPLDZPMKV-PXAZEXFGSA-N	430.274	1.074	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3cc[n+]([O-])cc3)CC2)CC1	1836054366	MMAACFSSFRHIOD-AWEZNQCLSA-N	439.354	1.289	50	20	IDGD	
COc1nccnc1C(=O)N1CCC(OC2CCN(C(=O)C(Cl)Cl)CC2)CC1	1837291990	ACLCSUSHZABYKO-UHFFFAOYSA-N	431.320	1.901	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3ccc4nncn4c3)CC2)CC1	1838332281	WUKYQARPVSQJFA-GOSISDBHSA-N	449.939	1.595	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccccc3Cl)CCO2)C1	1838866950	UYYSTTUMCQXJHA-VQIMIIECSA-N	431.316	1.664	50	20	IDGD	
CN1CCC[C@H](C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@](C)(Cl)CCl)C3)C2)C1	1839067213	JHKFWFSEAQRHJB-IPELMVKDSA-N	436.380	1.021	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccn(-c4ccccc4)n3)C2)C1	1839145658	BUJWIGJIPOGPPA-GCJKJVERSA-N	446.935	1.960	50	20	IDGD	
CCc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)nn1C	1839153587	LNRLBBGMNGQEJP-OALUTQOASA-N	447.363	1.289	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccncc3O)C2)C1	1839153600	LSKIYURIMIKCLA-ROUUACIJSA-N	432.304	1.094	50	20	IDGD	
CC(C)n1nccc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839200632	MTFPCYYXEVXOSK-WMLDXEAASA-N	447.305	1.225	50	20	IDGD	
Cc1cncc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)c1	1840031546	UARVJTCGVLLYEY-KDOFPFPSSA-N	426.311	1.243	50	20	IDGD	
O=C(c1ccc2cccnc2n1)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840188400	HRQOUXVYJCLESI-LJQANCHMSA-N	439.299	1.504	50	20	IDGD	
COc1cc(C(=O)N2CC3(CCCN3C(=O)[C@H](O)CCl)C2)nn1-c1ccccc1F	1841350760	WGCGTQGQEQMCQX-MRXNPFEDSA-N	436.871	1.437	50	20	IDGD	
Cc1nn2cc(CC(=O)N3CCCC34CN(C(=O)[C@@H](C)Br)C4)nc2s1	1841787198	LHMLFGFYNWRJGF-SNVBAGLBSA-N	426.340	1.629	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@@H](O)CC(=O)N1CCCC12CN(C(=O)CCBr)C2	1845229854	XIZACVFRCVUHDS-ZDUSSCGKSA-N	448.358	1.251	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)c2ccc(OC(F)(F)F)cc2)C1	1845317799	MXOJVONPVBGNJT-UHFFFAOYSA-N	442.438	1.775	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](CC(=O)N2CCCC23CN(C(=O)[C@H](O)CCl)C3)C1	1846940448	MRPZEXBMAMHEEF-HZPDHXFCSA-N	443.972	1.827	50	20	IDGD	
C#CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)CO[Si](C)(C)C)C2	1847070287	VEBFHYPAYOFJBZ-MRXNPFEDSA-N	437.613	1.958	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc(C#N)c[nH]1	1848099207	FWHYEDSOGSERLE-JYJNAYRXSA-N	435.912	1.834	50	20	IDGD	
COc1ccc([N+](=O)[O-])cc1C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	14847346	JCRGQONUTDVMNH-UHFFFAOYSA-N	448.457	1.463	50	20	IDGD	
CCOc1ccc(N2C[C@@H](C(=O)NNC(=O)Cc3nc4ccccc4n3C)CC2=O)cc1	15926541	JNTZZPJIKPIYMS-HNNXBMFYSA-N	435.484	1.715	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=O)COc2ccccc2F)n(C)c1	16225217	GQHYATNZVZPBRJ-UHFFFAOYSA-N	426.470	1.035	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2cc3c(cc2[N+](=O)[O-])OCCO3)c2ccccc2c1=O	17190012	YEQRQWWIKUKXQN-UHFFFAOYSA-N	439.384	1.171	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1ccc(C(=O)NNc2nnc(C)c(O)n2)cc1	22383449	AXJSYBCXGGDCGE-UHFFFAOYSA-N	430.446	1.452	50	20	IDGD	
O=C(NNC(=O)c1cnc2c(cnn2Cc2ccccc2)c1)c1ccc(-n2cnnn2)cc1	23690349	XLKNGCSVYZWAAE-UHFFFAOYSA-N	439.439	1.530	50	20	IDGD	
Cc1cc(C)nc(SCc2ccc(C(=O)NN/C=C3/C(=O)NC(=S)N=C3O)cc2)n1	29009663	PUUVWZTXPJEKFL-UHFFFAOYSA-N	442.526	1.875	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)on2)cc1	106106123	KRSMSHDFDWVZAG-UHFFFAOYSA-N	428.470	1.975	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)CNC(=O)c1cccs1)c1cccc(N2CCCC2=O)c1	726245470	QULXBIZYDKXAJY-CYBMUJFWSA-N	429.502	1.696	50	20	IDGD	
C#Cc1cccc(NC(=S)NNC(=O)[C@@H]2CS[C@@H](Cc3ccccc3F)C(=O)N2)c1	727499683	LAPULZZQLMSYGM-ROUUACIJSA-N	442.541	1.968	50	20	IDGD	
CC1CCC(NS(=O)(=O)CC(=O)NNC(=O)CCSc2ccc(F)cc2)CC1	728204139	VRZQYVJINNHIHK-UHFFFAOYSA-N	431.555	1.953	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3cccc4c3ccn4C)cc2)CC1	728214835	VQCXJWHXSFYESE-UHFFFAOYSA-N	427.530	1.871	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)NCC2CC2)c(Br)cc1Cl	728262762	KLQHNPZVPZULNU-UHFFFAOYSA-N	440.703	1.792	50	20	IDGD	
O=C(COC(=O)c1cccnc1N1CCCCC1)NNC(=O)[C@H]1COc2ccccc2O1	728329553	ZIGBHRRIDNBINS-GOSISDBHSA-N	440.456	1.216	50	20	IDGD	
Cc1ccc(-n2c(N(C)C)nc(C=NNC(=O)[C@H](C)NS(C)(=O)=O)c2Cl)cc1	728435030	TYLLIJFLLXHEBD-LBPRGKRZSA-N	426.930	1.288	50	20	IDGD	
O=C(NNC(=O)[C@H]1CC(=O)N(Cc2ccccn2)C1)c1cc(F)ccc1Br	728550008	WXRNZPCWPIHCJB-NSHDSACASA-N	435.253	1.793	50	20	IDGD	
O=C(NC[C@H](c1ccccc1)N1CCCC1)NNC(=O)C1CCN(c2ncccn2)CC1	729041655	WMDCYCIYDUDJKF-HXUWFJFHSA-N	437.548	1.861	50	20	IDGD	
CC(=NNC(=O)NCc1ccco1)c1cccc(N(S(C)(=O)=O)S(C)(=O)=O)c1	729816273	JXYGASZQEBYPEW-UHFFFAOYSA-N	428.492	1.229	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)CC[C@@H]1NC(=O)N(c2ccc(Cl)c(Cl)c2)C1=O	730519783	ZGOAZFSVAQNBHF-ZDUSSCGKSA-N	438.271	1.998	50	20	IDGD	
C[C@@H]1CN(Cc2ccc(CNC(=O)NNC(=O)COc3ccccc3O)cc2)C[C@@H](C)O1	730823871	ZFOYDICHKXJMIC-IAGOWNOFSA-N	442.516	1.911	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)NC[C@H]2CCCN2C(=O)OC(C)(C)C)nc2ccccc21	730909218	MLZXXJTVHCQKED-CQSZACIVSA-N	430.509	1.846	50	20	IDGD	
O=C(CNC(=O)c1c(Cl)cccc1[N+](=O)[O-])NNC(=S)NCCc1cccs1	731059425	YDELYIFILAEYQN-UHFFFAOYSA-N	441.922	1.778	50	20	IDGD	
CC1(C)CN(C2(CNC(=O)NNC(=O)COc3ccccc3O)CCCCC2)CCO1	731284574	ANEVBUFGALHFGC-UHFFFAOYSA-N	434.537	1.915	50	20	IDGD	
O=C(NNC(=O)c1cc2c(nc1O)CCCC2)c1cccc(S(=O)(=O)N2CCCC2)c1	731569626	KQFAFHKSHMUPEG-UHFFFAOYSA-N	444.513	1.525	50	20	IDGD	
C[C@@H](OC[C@@H]1CCCCO1)C(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	734824843	JYVAKZZCVDDILW-ZBFHGGJFSA-N	428.530	1.691	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)N[C@H](C)CN2CCN(c3ccccn3)CC2)c1	735519283	SMBCCXBCJRDHAW-GOSISDBHSA-N	426.521	1.310	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCC(C(=O)NNc3ccc(Cl)nn3)CC2)cc1	735688424	VZXNJTHTDYXUKE-UHFFFAOYSA-N	425.898	1.683	50	20	IDGD	
COC(=O)Nc1ccc(CCNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1	738450622	ORLUDEHLEDNMEL-UHFFFAOYSA-N	448.505	1.345	50	20	IDGD	
O=C(Cc1ccc(S(=O)(=O)C(F)F)cc1)NNC(=O)c1nnc(O)c2ccccc12	740813343	DSFOVBCDURERHZ-UHFFFAOYSA-N	436.396	1.335	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2ncoc2-c2ccc3c(c2)OCCO3)C[C@@H](C)O1	743290546	HOQYJUFJYONZTG-OKILXGFUSA-N	430.461	1.373	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)C(=O)N1CCCC[C@H]1C	743581742	FAYUUXQKLLCJEK-OLZOCXBDSA-N	425.511	1.215	50	20	IDGD	
O=C(Cc1ccc(Cl)cc1)NNC(=O)N[C@@H]1CC(=O)N(CCOc2ccccc2)C1	743638577	ROOKWTKOZGJDBR-QGZVFWFLSA-N	430.892	1.893	50	20	IDGD	
Cn1cc(CC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c2ccccc21	743827550	IXHDTVKUBIAJNV-UHFFFAOYSA-N	440.525	1.967	50	20	IDGD	
COc1cc(-n2cnnn2)c(Cl)cc1C(=O)NNC(=O)Nc1ccc(N(C)C)cc1	743829440	PZJOIPNRULPPEO-UHFFFAOYSA-N	430.856	1.857	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)N2CCN(CC(=O)NC3CC3)CC2)c(C)n1C[C@@H]1CCCO1	744313335	DYPZWRPTHYTZFC-IMEWXKHHSA-N	439.560	1.614	50	20	IDGD	
CCCCn1c(N)c(N(CC(=O)NNC(=O)C(C)(C)C)Cc2ccco2)c(O)nc1=O	744386193	FXQJJORLXNTUMM-UHFFFAOYSA-N	434.497	1.124	50	20	IDGD	
CC(C)OC(=O)[C@@H](C)CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	745904312	APEDMRQVPFHHJV-AWEZNQCLSA-N	440.522	1.003	50	20	IDGD	
C[C@@H]1OC(C)(C)N(C(=O)OC(C)(C)C)[C@@H]1C(=O)NNC(=O)c1nnc(O)c2ccccc12	746096465	GLUCYVMTRXCPSU-NHYWBVRUSA-N	445.476	1.857	50	20	IDGD	
Cc1cc(=O)n(CC(=O)NC(C)C)c(C)c1C(=O)NNC(=O)CCCc1ccccc1	746209765	BHAYKPKXPOUULK-UHFFFAOYSA-N	426.517	1.774	50	20	IDGD	
Cc1ccc(-c2nnc(-c3ccc(C(=O)NNC(=O)[C@H]4CCS(=O)(=O)C4)cc3)o2)cc1	746367998	SOAJUAUQSTZJHT-KRWDZBQOSA-N	440.481	1.908	50	20	IDGD	
O=C(NCCS(=O)(=O)NCc1ccccc1)NNC(=O)c1ccc(Cl)cc1F	747578561	DMZQJFQRZNEOSI-UHFFFAOYSA-N	428.873	1.543	50	20	IDGD	
O=C(NCc1ccccc1-c1ccc(Cn2cncn2)cc1)NNC(=O)C(=O)N1CCCC1	748456259	GHSWJIYTAITHKT-UHFFFAOYSA-N	447.499	1.446	50	20	IDGD	
O=C(NNc1nc(Br)cn2ccnc12)c1cc(N2CCNC2=O)ccc1F	750248260	ZRCMLOCMVKAFLK-UHFFFAOYSA-N	434.229	1.917	50	20	IDGD	
CC[S@](=O)[C@H]1CCC[C@H](NC(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)C1	750265272	BJIVBEAUCFJSMR-WXWKEVLISA-N	427.523	1.736	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)C1(S(C)(=O)=O)CCCC1	750271428	AIZZVQCDWPOYGK-UHFFFAOYSA-N	432.882	1.010	50	20	IDGD	
CC[C@H](C)C(=O)N1CCC[C@@H](C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)C1	751043851	RGHBPKGJZDTVAW-VQTJNVASSA-N	443.592	1.631	50	20	IDGD	
Cc1ccc(C)c(S(=O)(=O)C2(C(=O)NNC(=O)CNC(=O)c3ccco3)CCCC2)c1	751203933	AOPRKMRJAHMQMW-UHFFFAOYSA-N	447.513	1.560	50	20	IDGD	
COc1cc(OC)cc(N2C[C@@H](C(=O)NNC(=O)c3cccc(OC)c3O)CC2=O)c1	752520799	WKTDSHLNCIKFHO-LBPRGKRZSA-N	429.429	1.232	50	20	IDGD	
Cc1c(C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)c(=O)oc2ccc(Br)cc12	755065635	UCUFJIYLBBVEAA-VIFPVBQESA-N	443.275	1.060	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NN=Cc3cc(F)ccc3O)CC2)cc1	755791935	VTKHRRDOHFYFAU-UHFFFAOYSA-N	434.493	1.296	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)N[C@H]1CCN(c2c(F)cccc2F)C1=O	756209399	ARGGGZBMQSVJCD-AWEZNQCLSA-N	432.383	1.486	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)Nc2cccnc2-n2cncn2)c2ccccc2c1=O	756292831	RXOQUTKGFFHOIM-UHFFFAOYSA-N	447.459	1.639	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)N[C@@H]2CCN(C(=O)CCc3ccccc3)C2)c1	756979831	JKZBFDVNIJTTFM-GOSISDBHSA-N	440.500	1.882	50	20	IDGD	
COC(=O)c1cc(NC(=O)NNC(=O)COc2ccc(Br)cc2)cn1C	757671034	JLJUFGOZWGKNND-UHFFFAOYSA-N	425.239	1.806	50	20	IDGD	
COc1cccc(C(=O)NNS(=O)(=O)c2cc(Br)cc3c2OCC3)c1O	758149752	YFPCOGGUCWLIOP-UHFFFAOYSA-N	443.275	1.722	50	20	IDGD	
COc1ccc([C@@H](C)NC(=O)NNC(=O)C(=O)Nc2ccccn2)cc1Br	758680993	FSGRTOYIMLKLBA-SNVBAGLBSA-N	436.266	1.883	50	20	IDGD	
CS(=O)(=O)c1ccc(CNC(=O)NNC(=O)Cc2cn3ccccc3n2)cc1Cl	759300014	TYTWEGVHHGVZRU-UHFFFAOYSA-N	435.893	1.464	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)N1CCc2c(F)cc(Br)cc2C1	759307837	DZJHUHRJUYZOQQ-UHFFFAOYSA-N	439.241	1.710	50	20	IDGD	
CCNS(=O)(=O)c1ccc(CC(=O)NNC(=O)c2cc(-c3ccc(C)cc3)[nH]n2)cc1	759360037	JKFDIGIZCICZCY-UHFFFAOYSA-N	441.513	1.687	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)N=c1cc[nH]cc1I	760028195	GDHCNWPOEFNYLE-UHFFFAOYSA-N	430.177	1.479	50	20	IDGD	
Cc1ccc(F)c(NNC(=O)CCC(=O)N2CCN(S(=O)(=O)c3ccccc3)CC2)c1	760141825	VYUUJRLKEGSIIU-UHFFFAOYSA-N	448.520	1.891	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)C3=NOC4(CCN(C(=O)OC(C)(C)C)CC4)C3)nc21	760329724	NBTUKPVSTXWRGX-UHFFFAOYSA-N	446.468	1.058	50	20	IDGD	
CC(C)(C)C(=O)NNC(=O)C(=O)Nc1cc(F)c(F)cc1I	761063410	JBOOOLHILLPKMS-UHFFFAOYSA-N	425.173	1.701	50	20	IDGD	
CCS(=O)(=O)c1cc(F)ccc1NC(=O)C(=O)NNC(=O)COc1cccc(C)c1	763619398	VWSJFZKJAWOWTL-UHFFFAOYSA-N	437.449	1.093	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2ccc(N3CCOCC3)c(F)c2)c1	763664764	GEDCIOOZTNFSGE-UHFFFAOYSA-N	444.463	1.444	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ncn(C2CCCCC2)n1	763683948	DPMINNJUHPJCSX-UHFFFAOYSA-N	430.465	1.347	50	20	IDGD	
CO[C@H](C)C(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)c1	763727241	IWHUCUYQHYNENG-TWLOVUBOSA-N	442.516	1.962	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)CC23CC4CC(CC(C4)C2)C3)cccc1-n1cnnn1	763736078	RPPHOUUVNCCMAH-UHFFFAOYSA-N	437.504	1.663	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2cc3c(cc2SC)OCCO3)c1	763773269	UPMHQLXGBFBJKG-UHFFFAOYSA-N	447.469	1.597	50	20	IDGD	
C[C@@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3cc4c(s3)CCC4)cn2)C[C@@H](C)O1	763781349	JRQBDOSCLPMVDN-CHWSQXEVSA-N	443.529	1.645	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)C(=O)Nc2cnc(C)s2)c2ccccc2c1=O	763821133	RYHYBTZIQXHSSX-UHFFFAOYSA-N	442.501	1.751	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(F)c(N3CCCS3(=O)=O)c2)cc1	763832631	ZGUXXLKJOJJNQN-UHFFFAOYSA-N	448.476	1.328	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)cccc1N1CCOC1=O	763852901	YUCWPGJWFKEXNB-ZDUSSCGKSA-N	444.419	1.644	50	20	IDGD	
COC(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(C(C)=O)cc2)c1	763870702	BRYKLVZWLCDCFM-CQSZACIVSA-N	441.440	1.158	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)c(F)cc1F	763871433	GREAIZFRMHZVMM-VIFPVBQESA-N	439.346	1.444	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)C(=O)Nc1cccc(CN2CCCCC2=O)c1	763919769	UKMJUGCSQGSQSJ-UHFFFAOYSA-N	426.448	1.667	50	20	IDGD	
O=C(NNC(=O)c1ccc(COc2ccccc2)o1)C(=O)Nc1ccccc1-n1cncn1	763949152	HFMZZLXGLQNAEZ-UHFFFAOYSA-N	446.423	1.839	50	20	IDGD	
CON(C)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)C2=S=C3CC[C@H](C)CC3=C2)cc1	763951004	XZZGANBSVQPHDZ-LBPRGKRZSA-N	444.513	1.244	50	20	IDGD	
O=C(NNC(=O)c1ccc(COc2ccccc2)o1)C(=O)Nc1cnn(-c2ccccc2)n1	763951055	QCXZGOFJSDANKM-UHFFFAOYSA-N	446.423	1.839	50	20	IDGD	
O=C(NNC(=O)c1cc(Cl)ccc1O)C(=O)Nc1ncn(Cc2ccc(Cl)cc2)n1	763977350	OKENWCSUJHRFFO-UHFFFAOYSA-N	449.254	1.739	50	20	IDGD	
CCc1c(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)cnn1CC(C)C	763996315	YAYZJEOMNPQZLE-UHFFFAOYSA-N	425.287	1.592	50	20	IDGD	
O=C(Cc1ccsc1)NNC(=O)C(=O)Nc1ccc(CN2C(=O)CCCC2=O)cc1	764036181	ZPEQUPFMNGBYQA-UHFFFAOYSA-N	428.470	1.116	50	20	IDGD	
CN(C)CCOc1cccc(NC(=O)C(=O)NNC(=O)c2cccc(Br)c2)c1	764059726	XQGDITPFJXOYPK-UHFFFAOYSA-N	449.305	1.789	50	20	IDGD	
CC(=O)N1CCc2cc(NC(=O)C(=O)NNC(=O)c3cccc(Br)c3)ccc21	764062730	CASOGLWEYICRTM-UHFFFAOYSA-N	445.273	1.758	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc4c(c3)nc(C)n4C)n[nH]2)cc1	764111906	IALQXPXEXPYLIK-UHFFFAOYSA-N	431.456	1.980	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2O1)C(=O)Nc1ccccc1OC[C@H]1CCCCO1	764151245	IEGOAYYUYPQEMQ-UZLBHIALSA-N	439.468	1.724	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)C(=O)Nc2cccc(Cl)c2N2CCOCC2)c1	764236205	WWWXCUPDTOWFDK-UHFFFAOYSA-N	427.848	1.448	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)cccc1C(=O)N1CCCC1	764239071	DBWKLFNBRCXEFF-UHFFFAOYSA-N	447.495	1.972	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)CCc2ccccc2O)n(-c2ccccc2F)n1	764277390	DAKUAOSWMAGSJV-UHFFFAOYSA-N	425.420	1.744	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1ccc(F)c(Br)c1	764281045	WHWAQGMGASHPRZ-UHFFFAOYSA-N	426.198	1.459	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2cccc3c2OCCC3=O)n[nH]1	764376854	KINADSJXCBJCFS-UHFFFAOYSA-N	449.423	1.450	50	20	IDGD	
CN1C(=O)CCc2cc(NC(=O)C(=O)NNC(=O)c3cc(-c4cccs4)[nH]n3)ccc21	764377372	ONTNQGVIGMEQKJ-UHFFFAOYSA-N	438.469	1.447	50	20	IDGD	
COc1cc(OC)c(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)cc1F	764388499	SEKNNCDIUAWMCV-UHFFFAOYSA-N	445.382	1.772	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1ccnn1Cc1cccc2ccccc12	764398988	IYSZQGKSCAVDRK-OAHLLOKOSA-N	439.472	1.222	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)[C@H](C)NS(=O)(=O)c2cccc(C#N)c2)c1	764523141	GDYYBMCCIBETHG-HNNXBMFYSA-N	430.486	1.068	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)NCc1cccc(OCCN2CCOCC2)c1	765693970	ANKRHZSSNRPGDF-UHFFFAOYSA-N	448.545	1.627	50	20	IDGD	
CCCCCCCC(=O)NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1	766636093	JKZWTQOLTGFNKZ-UHFFFAOYSA-N	438.594	1.809	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1)N1CCCC1=O	766669693	RCDOFSVXKJEOCP-SFHVURJKSA-N	435.956	1.006	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)CN1CCN(C(=O)CCCc2ccccc2)CC1	766862566	AQULUNGAQQXTND-UHFFFAOYSA-N	436.556	1.852	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)c2cc(C)ccc2S(N)(=O)=O)n[nH]1	767886586	LFRSREBVGNVTRO-UHFFFAOYSA-N	429.458	1.116	50	20	IDGD	
COC(=O)c1cc(F)c(C)c(S(=O)(=O)NNC(=O)c2nnc(-c3ccccc3)o2)c1	769864176	CPRDKFJPKFLVTF-UHFFFAOYSA-N	434.405	1.594	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCCSCC(F)(F)F)cc1	770293989	SMTALWCQHXCERZ-UHFFFAOYSA-N	442.485	1.241	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)NCc3ccc(N4CCc5ccccc5C4)nc3)nc21	770343086	XYDHSUULEVLYQU-UHFFFAOYSA-N	445.487	1.853	50	20	IDGD	
CSC[C@H](C(=O)NNC(=O)c1ccc2c(c1)OCCO2)N1C(=O)[C@@H]2CCCC[C@H]2C1=O	770416902	DMFUDQXBLNUIAZ-RBSFLKMASA-N	447.513	1.126	50	20	IDGD	
CC(=O)N1CCN(Cc2ccc(NC(=O)C(=O)NNc3c(C)cccc3F)cc2)CC1	770815399	NMUZONAFNSIOAQ-UHFFFAOYSA-N	427.480	1.880	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1ccc(C(N)=O)cc1)C(=O)NNc1cccc(C(F)(F)F)n1	771021368	GBLACHJXSPNCEZ-SECBINFHSA-N	431.396	1.009	50	20	IDGD	
CCOc1cc(C#N)cc(Br)c1OCC(=O)O[C@@H](C)C(=O)NNC(=O)CC	772003978	MYXILTUNLWKISJ-JTQLQIEISA-N	442.266	1.587	50	20	IDGD	
O=C(COC(=O)c1ccc(F)c(Cl)c1F)NNC(=O)[C@@H]1COc2ccccc2O1	773561475	LAYBRICMCBMQNW-ZDUSSCGKSA-N	426.759	1.762	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2ccc(C(=O)Nc3ccccc3OC)cc2)n1	773723965	ITSUAGJNLKWTBY-UHFFFAOYSA-N	436.428	1.828	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cnn(C)c2-c2ccccc2)cc1OC	775126094	VGXOGOAAPRKYAN-UHFFFAOYSA-N	438.440	1.722	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)c1c(Cl)cccc1S(C)(=O)=O	775917065	VIGDFDDHDLLYCI-UHFFFAOYSA-N	438.889	1.599	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccc(NC(=O)NNC(=O)COCc2ccccc2)nc1	776063177	PLPBORDSLCAVCR-UHFFFAOYSA-N	435.506	1.528	50	20	IDGD	
O=C(NNC(=O)N1CCO[C@@H](c2ccc(F)cc2F)C1)c1ccc(-n2cnnn2)cc1	777411692	BGXOGXUXCYNWAC-QGZVFWFLSA-N	429.387	1.368	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccncn2)c1	778282401	GGDKHEOLDHGQJC-UHFFFAOYSA-N	427.442	1.361	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)C(=O)Nc2cc(Cl)ccc2OC[C@@H]2CCCCO2)cn1	778715620	YXJWGBORCDHLCF-AWEZNQCLSA-N	435.868	1.421	50	20	IDGD	
O=C(CN1C(=O)[C@H]2CCCC[C@H]2C1=O)NNc1ccc([N+](=O)[O-])cc1Br	779136885	SBHOKAVLJURQBS-PHIMTYICSA-N	425.239	1.976	50	20	IDGD	
CN(C)c1cnc(C(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)cn1	779646731	SKVMMSSNGYJTSL-UHFFFAOYSA-N	443.467	1.376	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2ccc(N3CCSCC3)c(Cl)c2)CCS(=O)(=O)C1	783426460	HKPQSYKLBSXYJR-QGZVFWFLSA-N	446.982	1.030	50	20	IDGD	
Cc1c(CSC(C)C)cccc1NC(=O)C(=O)NNC(=O)CNC(=O)c1ccco1	784002028	JHRCNQTYWYFZHZ-UHFFFAOYSA-N	432.502	1.746	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ccc(Br)cc2C)cc1-n1cnnn1	784414159	GYYXFRLCEYKYQZ-UHFFFAOYSA-N	446.265	1.824	50	20	IDGD	
O=C(NNc1ccc(Br)nc1)C(=O)Nc1ccc(S(=O)(=O)C(F)F)cc1	784806767	QIAMDVQLVONHLY-UHFFFAOYSA-N	449.233	1.922	50	20	IDGD	
Cn1cc(NC(=O)C(=O)NNc2ccc(Br)nc2)cc(Br)c1=O	784811545	JAJUFHMTFZLAMB-UHFFFAOYSA-N	445.071	1.387	50	20	IDGD	
C[C@H]1CCCN(S(=O)(=O)c2ccc(NC(=O)C(=O)NNc3ccnc(F)c3)cc2)C1	784849525	XMFDLFUTXATOBJ-ZDUSSCGKSA-N	435.481	1.723	50	20	IDGD	
COCCNC(=O)c1ccc(NC(=O)C(=O)NNc2ccc(Cl)nc2)cc1Cl	784870566	YRKVHBVSUZPDEO-UHFFFAOYSA-N	426.260	1.846	50	20	IDGD	
CCNC(=O)Nc1cccc(NC(=O)C(=O)NNc2c(OC)cccc2S(C)(=O)=O)c1	785331410	ULPRFEDSAAWTLO-UHFFFAOYSA-N	449.489	1.322	50	20	IDGD	
COCCn1cc(NC(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)cn1	785540879	NDGSBTOTAVQXKA-UHFFFAOYSA-N	425.490	1.171	50	20	IDGD	
CC(=O)N1CCN(C(=O)COC(=O)/C(C#N)=C\c2cc(C)n(C[C@@H]3CCCO3)c2C)CC1	786313125	MBPKLVGRAZUQSJ-OCBOALCKSA-N	442.516	1.425	50	20	IDGD	
COCCOc1ccc(F)cc1NC(=O)C(=O)NNC(=O)[C@H]1OCC[C@H]1c1ccccc1	789814033	YIGMSDXKNGZSHG-LPHOPBHVSA-N	445.447	1.510	50	20	IDGD	
Cc1ccn(-c2ccc(NC(=O)C(=O)NNC(=O)CSc3ccccc3O)cc2)n1	793024896	HXXVZNLSNXACNP-UHFFFAOYSA-N	425.470	1.765	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2ccc3c(c2)N(CC(F)F)C(=O)CS3)nc(C)n1	793037211	UMOYTCDQQOXIFY-UHFFFAOYSA-N	436.444	1.879	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@H](C)N(C)CC(F)(F)F)CC2)cc1	793683961	XKGIVSOQZOYXHS-INIZCTEOSA-N	429.487	1.143	50	20	IDGD	
CC[C@@H](C)CCC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	794809961	OBXSNTQLGVWNMQ-MRXNPFEDSA-N	425.551	1.614	50	20	IDGD	
CCOC(=O)c1ccc(F)c(S(=O)(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)c1	795286872	RFVMLIYRAANZPE-UHFFFAOYSA-N	437.449	1.567	50	20	IDGD	
CC(=O)N1CCC(N(CC(=O)NNC(=O)c2cccc(C#N)c2)Cc2cncs2)CC1	795581760	GOSYKRABUUFMPC-UHFFFAOYSA-N	440.529	1.289	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(F)cc1-c1cnn(C)c1	796991383	CYGFGGRCTGKNOO-UHFFFAOYSA-N	441.419	1.400	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2cc(Br)cc([N+](=O)[O-])c2C)n1	797536154	VZXRAXKFLFGTQD-UHFFFAOYSA-N	425.199	1.546	50	20	IDGD	
NC(=O)c1cc(Cl)cc(S(=O)(=O)NNC(=O)c2cccc(Br)c2)c1	799122564	AVQOIPKACHPIGA-UHFFFAOYSA-N	432.683	1.825	50	20	IDGD	
CCOc1ccccc1CN1CCN(C(=O)NNC(=O)CNC(=O)c2ccco2)[C@H](C)C1	799367961	OTDKNLUXHRCWKY-MRXNPFEDSA-N	443.504	1.355	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(S(=O)(=O)NNC(=O)c2ccccc2C)c1	800832563	YYAIQGNWFDDXLU-UHFFFAOYSA-N	425.532	1.649	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)CC[S@@](=O)c2ccc3c(c2)OCCO3)cc1	802117836	FAGJDBZVAGSBBJ-SSEXGKCCSA-N	432.502	1.874	50	20	IDGD	
COC(=O)c1c(F)cc(NC(=O)C(=O)NNc2ccc(Br)nc2)cc1F	802572196	VWGBOYLQNPQIDL-UHFFFAOYSA-N	429.177	1.991	50	20	IDGD	
C[C@H]1C[C@H](N2CCOCC2)CN1C(=O)CCC(=O)C(C#N)=C1N(C)c2ccccc2N1C	804440055	RDVXNGKIWLBXAI-ROUUACIJSA-N	437.544	1.979	50	20	IDGD	
O=C(CN1C(=O)c2ccc(Br)cc2S1(=O)=O)NNC(=O)c1ccccc1	804920458	IRWYWLIINZTALH-UHFFFAOYSA-N	438.259	1.055	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)c2ccc(C(N)=O)c(Cl)n2)cc1	806375375	JSJITBQVJVEMKP-UHFFFAOYSA-N	445.892	1.330	50	20	IDGD	
CCN(C)C(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2cc(OC)cc(OC)c2)c1	806974546	MUKMACHZKPAYGP-UHFFFAOYSA-N	428.445	1.195	50	20	IDGD	
COc1cc(C)c(NC(=O)C(=O)NNC(=O)c2csc(N3CCOCC3)n2)c(C)c1C	806992699	KCXRYPJDTHEKOJ-UHFFFAOYSA-N	447.517	1.313	50	20	IDGD	
Cc1cc(Cl)ccc1S(=O)(=O)NCCNC(=O)NNC(=O)Cc1ccc(F)cc1	807547708	KQCRLNYVJBAKKD-UHFFFAOYSA-N	442.900	1.639	50	20	IDGD	
Cc1nc(-c2ccccn2)nc(NNC(=O)CNS(=O)(=O)c2cccc(F)c2)c1C	810408043	SMRXXNMOSJNFOE-UHFFFAOYSA-N	430.465	1.716	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)[C@H]2CCN(c3ccccc3Cl)C2)n1	811418307	YIVLCAGEXGVVGL-ZDUSSCGKSA-N	436.921	1.865	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)N[C@@H]1c2ccccc2CC12CCOCC2	811851623	LKPNVEWEFXJZRE-LJQANCHMSA-N	433.472	1.701	50	20	IDGD	
O=C(NCCS(=O)(=O)N1CCOCC1)NNc1ccc(Br)cc1Cl	812017756	KTSRBDLRSAJIFD-UHFFFAOYSA-N	441.735	1.391	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1cnn(-c2ccccn2)c1N	815310404	WCHHNMOWCVUJCL-UHFFFAOYSA-N	444.835	1.130	50	20	IDGD	
N#C[C@H](c1ccccc1)c1ccc(NC(=O)C(=O)NNC(=O)[C@H]2CCc3nncn3C2)cc1	815691399	OXLCYHWFJPYLNI-PKOBYXMFSA-N	443.467	1.282	50	20	IDGD	
CC(C)[C@H]1CC[C@@H](C)C[C@H]1OCC(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	839163467	VEAIKKZBWSHIIN-SMOSDQRPSA-N	448.516	1.994	50	20	IDGD	
Cc1cc(Cl)ccc1OCCCC(=O)NNC(=O)CSCC(=O)N1CCOCC1	913110525	FZFSVONVFACCPV-UHFFFAOYSA-N	443.953	1.547	50	20	IDGD	
Cc1ccc(NC(=S)NNC(=O)c2ccc(S(=O)(=O)N3CCOCC3)cc2)cc1C	913434502	ZYZKILWEXXDEQT-UHFFFAOYSA-N	448.570	1.956	50	20	IDGD	
COc1cc(C#N)ccc1OCCCC(=O)NNC(=O)c1csc(N2CCOCC2)n1	915636759	SNRGBHMMKQRKRZ-UHFFFAOYSA-N	445.501	1.480	50	20	IDGD	
CCN1CCC(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)CC1	915903349	GUFHFUKJZZPNLM-UHFFFAOYSA-N	437.566	1.290	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)nn1C(C)(C)C	916096082	GCYVNFSRYPPCII-UHFFFAOYSA-N	433.534	1.806	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NC[C@H](c2ccc(C)o2)N2CCOCC2)cc1OC	916228107	IAYPGEBAMAPJSP-MRXNPFEDSA-N	432.477	1.623	50	20	IDGD	
CCC[C@H](C)N1C[C@@H](C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)CC1=O	917515357	COQUEUBWRFLDMT-GJZGRUSLSA-N	427.505	1.776	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2ccc(Cl)cc2O)cc(Cl)c1OCC(N)=O	918359308	VILVRGQHIMKSQV-UHFFFAOYSA-N	428.228	1.647	50	20	IDGD	
CSCC[C@H](NC(=O)c1ccc([N+](=O)[O-])o1)C(=O)NNC(=O)c1c[nH]c2ccccc12	919810541	KLLNFLUAVGOQMO-AWEZNQCLSA-N	445.457	1.982	50	20	IDGD	
O=C(NNC(=O)c1nc2ncc(Br)cn2n1)c1cc(-c2ccccc2)[nH]n1	919810704	YMPZZPNKFFOHEZ-UHFFFAOYSA-N	427.222	1.352	50	20	IDGD	
NC(=O)c1ccc(/C=C\C(=O)N2CCC[C@@H]2C(=O)NNC(=O)c2ccc(Cl)nc2)cc1	920037732	UHULOZHENHNSHA-MGDKSHQASA-N	441.875	1.299	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)Nc1ccc(CN2C(=O)CNC2=O)cc1	920934264	QWOGRFHESWCPKS-UHFFFAOYSA-N	431.836	1.867	50	20	IDGD	
CCNC(=O)c1cccc(CNC(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)c1	1116082823	BGQGOOVFDJPLHF-UHFFFAOYSA-N	447.536	1.914	50	20	IDGD	
CC(C)(C)OC(=O)N1CCOC[C@H]1CC(=O)NNC(=O)c1cncn1-c1ccccc1	1117127370	HXMNOLNZBFLVNQ-MRXNPFEDSA-N	429.477	1.659	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCCNC(=O)c2cccc(Br)c2)cc1	1318111903	WBCIIFQMXNYQTG-UHFFFAOYSA-N	435.278	1.832	50	20	IDGD	
CN(C)N(C(=O)c1nn(-c2ccccc2F)cc1Br)[C@@H]1CCS(=O)(=O)C1	1323086942	GDBVSQQPLQDVTF-LLVKDONJSA-N	445.314	1.880	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cccc4c3cnn4C)C2)C1	1778031226	AZRMMICAQGSDKH-ORAYPTAESA-N	435.322	1.800	50	20	IDGD	
COCCn1nccc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(C)(C)CCl)C2	1778233239	XNAOGBPFCHKRFD-DYESRHJHSA-N	440.972	1.922	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H]3ON=C(c4ccccc4)O3)C2)C1	1778871613	MZPQBLADALUZTL-GHTZIAJQSA-N	435.908	1.816	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2)c1ccc2ncncc2c1	1779071302	ONXFMEBFZXEMOU-DBXWQHBBSA-N	432.908	1.357	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C=C\C(=O)NC2CC2)C1	1779230714	OEUMKZCVLRTSEV-CTFNTZBASA-N	446.375	1.571	50	20	IDGD	
O=C(c1cccc(OC2CCOCC2)n1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Cl)CCO2	1779904009	MEMKHMKUHNLDKF-YLJYHZDGSA-N	441.887	1.617	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(CN(C(=O)c3cnoc3)CCO2)C1	1780097836	NXDXZQIYJFFURH-FQEVSTJZSA-N	444.400	1.265	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(C#N)cc3)C2)C1	1780695383	FFEKMKZKNJRGFJ-LRULAXNGSA-N	448.483	1.136	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781334264	NSFSXHYEWJWNJB-ZETOZRRWSA-N	425.251	1.068	50	20	IDGD	
O=C(C1Cc2ccccc2C1)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781337216	QEZPRRRBEDPQQW-QFBILLFUSA-N	425.298	1.922	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1[nH]nc3ccncc13)C2	1782172871	PFTPQMMRNVUOFB-AKCHCHLHSA-N	435.912	1.339	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc3cn[nH]c3cn1)C2)C(Cl)Cl	1782218119	VEVHYMOQJFGBMU-RDTXWAMCSA-N	426.304	1.889	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1nn[nH]c1C(F)(F)F)C2)C(Cl)Cl	1782218232	BGHQDWXPADWEBE-XLKFXECMSA-N	444.241	1.755	50	20	IDGD	
C[C@@H](Cn1ccnc1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CO[Si](C)(C)C)C2	1782545712	RXOAGMGQVDACEB-WAOWUJCRSA-N	436.629	1.885	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)C(C)(C)NCCC#N)CCO2	1783343352	UOKPBBUJDCNFCO-RDTXWAMCSA-N	429.359	1.272	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ncccc3Br)CCO2)C1	1783877021	DKBQGNHMWLIREP-GUYCJALGSA-N	446.729	1.541	50	20	IDGD	
COc1cc(F)ccc1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1784917193	MWZNWCIKMZPTAM-PBHICJAKSA-N	433.249	1.968	50	20	IDGD	
CCn1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)CBr)C[C@@H]32)n1	1786169268	QGNNHCWRSDEEAK-HOSILWTGSA-N	427.343	1.527	50	20	IDGD	
Cc1c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Cl)C[C@@H]32)ccc2c1OCCO2	1787360172	ILICIJMKMDGBHI-WIRVQXDCSA-N	426.872	1.894	50	20	IDGD	
COc1cc(OC)c(F)c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]3C2)c1	1787447874	HXZGWTWJQJEBPE-MSMFTSAESA-N	432.851	1.971	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C=N/O[C@H]3CCCCO3)[C@H]2C1	1788660903	RFRNXNMYFLKKCB-ULXNUZMESA-N	446.342	1.279	50	20	IDGD	
CCc1nc(C(=O)Nc2ccc(C3(NC(=O)c4cccc(B(O)O)c4)CCC3)cc2)co1	1789849779	HSMDQTBOARMBLW-UHFFFAOYSA-N	433.273	1.978	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cncn3-c3ccncc3)C[C@@H]21	1789858799	PZKMFGQKOABZGF-RMRDIRSESA-N	431.924	1.878	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(C)(C)n3nc(C)ccc3=O)C[C@@H]21	1789863366	PEOQKTUWTHCJBD-NXOAAHMSSA-N	438.956	1.284	50	20	IDGD	
Cn1nc2c(c1C(=O)NC[C@@H]1OC[C@@H]3CCN(C(=O)CCBr)C[C@@H]31)CCC2	1790460079	UMFCFFKPURPVCI-NOLJZWGESA-N	439.354	1.287	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3ccc(F)nc3)C[C@@H]21	1791056993	KCUQPOSZKCXIBJ-TUUVXOQKSA-N	442.329	1.916	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)Nc3nccs3)C[C@@H]21	1791057053	AGCOXJXENLCBMP-NDKCEZKHSA-N	445.383	1.707	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1ccc(F)nc1)C2	1792868899	VMBAHQZOHYSQCI-LJGDNWOOSA-N	442.329	1.774	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CSCc1[nH]cnc1C)C2	1793448487	CKWPOXSOPSQSQY-KRXQYRFLSA-N	428.986	1.948	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CSC1CCCC1	1793552386	CCJNJHLAQBSPRM-QDMKHBRRSA-N	431.562	1.613	50	20	IDGD	
Cn1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@](C)(Cl)CCl)C3)c(C(F)F)n1	1796702372	LHONWLPYVNPUIL-LLOSTOMTSA-N	439.290	1.797	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H](O)[C@H](C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](F)Cl)C1	1796812221	ZYGCTUBYVNMHCZ-ZAQNNHEOSA-N	433.908	1.387	50	20	IDGD	
C[C@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCBr)C2)[C@@H]1SC(=N)NC1=O	1796873452	IDRISUISCIAANX-JPYZYGQNSA-N	431.356	1.212	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnnc2ccccc12	1796885954	APTRCBDCJVXKAH-ZUMXRPEOSA-N	447.333	1.864	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCc1ncc[nH]1)C2	1796893010	GVZLOMMQQJZTCX-MVRRYPJTSA-N	425.493	1.115	50	20	IDGD	
Cc1nc[nH]c1CSCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Br)C2	1797665057	WPZCQDDZFVHFDE-YGSHXTJESA-N	445.383	1.324	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c(c1)NC(=O)CO3)C2	1797956811	FATXCAFODDRJOB-YVWYUNDQSA-N	447.564	1.072	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnn(C)c1Cl	1798346775	DMPOEJMRNYLXSP-LYIQGSDWSA-N	433.734	1.450	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(N(C)C)c1	1798882729	IZWYQCUGYQCRHM-SCNOPHJPSA-N	438.366	1.987	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3cccnc3n1)C2	1800759325	LQGHDNOMWWSPBM-ZIEJDFEHSA-N	433.306	1.616	50	20	IDGD	
C[C@H](Cc1ccncc1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnccc1C(=O)NN)C2	1801246538	GFHJEVABTWZDNQ-NRSFXHEJSA-N	436.516	1.211	50	20	IDGD	
O=C(COCCO)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](Br)Cc1ccccc1	1801570722	UJFHJQXPYPPZLE-XMTFNYHQSA-N	439.350	1.640	50	20	IDGD	
CC[C@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](O)NC(=O)OC(C)(C)C)C2	1801803806	NULOMFOGYGSKRV-KBRXKUPHSA-N	448.358	1.641	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc3scnc3c1)C2	1802337129	HDGJQQGAHYFABE-MUJYYYPQSA-N	429.546	1.921	50	20	IDGD	
O=C1CC[C@H](C(=O)NC[C@@H]2CCN(C(=O)CCBr)[C@@H]2c2cccnc2)CN1	1802609302	JAULJHVHPINOOY-RLFYNMQTSA-N	437.338	1.399	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc3c(n2)OCCO3)[C@@H]1c1cccnc1)[C@H](O)CCl	1803138685	DNJPYVOIEFLVCO-YXJHDRRASA-N	446.891	1.167	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2[nH]nc3ccncc23)[C@H]1c1cccnc1)[C@H](O)CCl	1803139304	NZSQWCJOFHSJTR-XCRHUMRWSA-N	428.880	1.272	50	20	IDGD	
CC(=O)Nc1cc(C(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)ccn1	1803139361	ONEJGDFHGWJILE-AOIWGVFYSA-N	445.907	1.354	50	20	IDGD	
O=C(Cc1cnccn1)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@H]1c1cccnc1	1803301007	BDIPSONZOHJQQX-JQFCIGGWSA-N	436.285	1.811	50	20	IDGD	
Cc1occc1C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1	1805613590	HNGYMMDXEYOFLB-JXFKEZNVSA-N	448.483	1.615	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H](CNC(=O)COCCOC)[C@@H]1c1cccnc1	1806763001	XTWKWOWBSQCWJL-RYRKJORJSA-N	442.354	1.924	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)[C@@H]1CNc2ccccc21	1807173025	WWTGRILYFVVBBX-JQERWDHBSA-N	428.920	1.896	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](O)C(=O)N1CC[C@H](CNC(=O)[C@@H](F)Cl)[C@H]1c1cccnc1	1808314451	HHJKBNTXOWFDFA-IXYNUQLISA-N	444.891	1.465	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)NC[C@H]1CCN(C(=O)CO[Si](C)(C)C)[C@@H]1c1cccnc1	1808430791	KIMPCZIQZRCBMS-XFQXTVEOSA-N	434.613	1.806	50	20	IDGD	
Cc1ncoc1C(=O)N1CCCC2(CCN(C(=O)c3cnccc3C(=O)NN)CC2)C1	1808583433	AGWLHISRPVXPGN-UHFFFAOYSA-N	426.477	1.140	50	20	IDGD	
CNc1ccc(C(=O)N2CCCC3(CCN(C(=O)c4cccc(B(O)O)c4)CC3)C2)cc1	1809720608	FLROOPUYKLRXMD-UHFFFAOYSA-N	435.333	1.567	50	20	IDGD	
Cc1c(F)cccc1C(=O)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1	1809967975	QQAFTHQKINPYEJ-UHFFFAOYSA-N	438.308	1.973	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1ccc(F)cc1	1811900235	LXLTTZQEJPIBJR-UGKGYDQZSA-N	447.275	1.534	50	20	IDGD	
CC(=O)N/C(C)=C/C(=O)NC[C@@H]1CCN(C(=O)[C@H](C)Br)[C@@H]1c1cccnc1	1812322206	KBAHCSMOANIOAD-WBEPDIGBSA-N	437.338	1.911	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)C[C@@](C)(O)CC(=O)O)[C@H]1c1cccnc1	1813067402	GWZRNWXCBOXFIP-BAAGSCJXSA-N	425.913	1.721	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)CSC(=N)N)sc2C1	1814730834	WKNLGHQGEPXGEU-HTQZYQBOSA-N	434.385	1.855	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)CCC(=O)N2CCCC2)[nH]n1)[C@@H](O)CCl	1814867310	HUFXMPDTPRHAGL-GJZGRUSLSA-N	425.917	1.404	50	20	IDGD	
C[C@@H](CS(C)(=O)=O)C(=O)Nc1cc([C@H]2CCCCN2C(=O)C(Cl)Cl)[nH]n1	1815232692	PQMPDXGZDDZECI-GXSJLCMTSA-N	425.338	1.886	50	20	IDGD	
CN1N=C(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)CO[Si](C)(C)C)[nH]n2)CCC1=O	1815621367	AQAXGNPQAYXZEX-HNNXBMFYSA-N	434.573	1.862	50	20	IDGD	
CN1CCCn2nc(C(=O)N[C@H]3CCc4nc(NC(=O)[C@@H](F)Cl)sc4C3)cc2C1	1817133019	CNWXCVNZSQUFML-ZUZCIYMTSA-N	440.932	1.935	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](F)Br)CC2	1817305912	ZTAFTVIANLVBOM-VFWDIBGWSA-N	435.319	1.612	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)CCc2ccco2)[nH]n1)c1cccc(B(O)O)c1	1817473940	HMAMVSXPUCDLIN-IBGZPJMESA-N	436.277	1.621	50	20	IDGD	
O=C1COc2ccc(C(=O)Nc3cc([C@H]4CCCCN4C(=O)[C@H](O)CCl)[nH]n3)cc2N1	1819100805	FLPCABXEHQOPAV-HUUCEWRRSA-N	447.879	1.646	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](C)Nc3cnccn3)sc2C1	1819837114	RCMNFWXBLRQTBR-TUAOUCFPSA-N	438.941	1.600	50	20	IDGD	
CN1CCN(CC(=O)N2CCCC[C@H]2c2cc(NC(=O)[C@@](C)(Cl)CCl)n[nH]2)CC1	1820865791	BRWHXRPPFNJUCH-KXBFYZLASA-N	445.395	1.886	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CNC(=O)C(F)(F)F)[nH]n1	1822375045	RTYYGCGRYSRGNM-MWLCHTKSSA-N	439.822	1.334	50	20	IDGD	
C[C@@H](Cn1ccnc1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1	1822789287	OZVVFBOQDFSRQY-DOTOQJQBSA-N	444.540	1.308	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)c3cc(O)ccc3O)sc2C1	1823759461	DJJSLENFAOIMTH-NSHDSACASA-N	447.517	1.153	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](Cl)COC)sc2C1	1826004380	HZNVPEGRBPWDTH-VWYCJHECSA-N	433.914	1.871	50	20	IDGD	
Cc1nc(C(=O)N[C@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)cs1	1826080381	GVJFBXXTJKNIEC-NSHDSACASA-N	436.563	1.507	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CC[C@@H]1CCOC1)CC2	1826092133	NHENUGJCJHVOAN-KGLIPLIRSA-N	437.566	1.245	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)CSCC(=O)O)sc2C1	1826119365	WIDPJUDARZLYOG-JGVFFNPUSA-N	436.353	1.656	50	20	IDGD	
O=C(c1[nH]cc2c1CCC2)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827052133	ARAPJWXHGHHEMF-QFIPXVFZSA-N	449.360	1.730	50	20	IDGD	
CC(C)O[C@@H](C)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1	1828924098	ISSFLIFDDFPRAT-OXJNMPFZSA-N	445.564	1.732	50	20	IDGD	
Cc1nccnc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1	1829441958	MSMSSRYITUZJOA-GOSISDBHSA-N	430.553	1.391	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnc(Cl)nc3)CCO2)C1	1829514233	RYZXNZAMWVXBML-SFHVURJKSA-N	431.320	1.465	50	20	IDGD	
Cc1ccn(C)c1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1	1829826248	YMNFMRFYRWSMFC-OAQYLSRUSA-N	437.349	1.560	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)c1ccc(OC)cc1)CCO2	1830216506	DYUHQSXNAQXJJB-WAOWUJCRSA-N	440.924	1.202	50	20	IDGD	
C[C@@H](Nc1cccnc1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830359697	SWZNJSSFAVFYJK-IERDGZPVSA-N	438.956	1.603	50	20	IDGD	
N#Cc1cccc(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)c1	1830462692	HFMVHAGPUMODSM-FQEVSTJZSA-N	440.327	1.751	50	20	IDGD	
CC(C)(Cc1ccccc1)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H](O)CCl)CCO2)C1	1830719686	HIZVAYNZFPLTDB-PGRDOPGGSA-N	438.952	1.311	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(O)c(OC)c3)C2)C1	1831654039	HWNHUSIFKPTRRH-IERDGZPVSA-N	440.924	1.878	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)/C=C/c3ccco3)CCO2)C1	1833078128	JADDCTLUOLRTGC-KCVJVMPHSA-N	441.322	1.923	50	20	IDGD	
C[C@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)[C@H](C)CC(N)=O)CC2)CC1	1833265432	VRZLJQFQDLWVJP-ZIAGYGMSSA-N	445.402	1.101	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3ccn4ccnc4c3)CC2)CC1)[C@@H](O)CCl	1833310576	SAXRARDSUBGDTQ-SFHVURJKSA-N	433.940	1.119	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(C)n3)CCO2)C1	1834049869	FSWVTJPLPOASNG-KXBFYZLASA-N	440.338	1.634	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@]3(CN(C(=O)CCBr)CCO3)C2)c(C)n1	1834823385	RDYBHEGVNPSECF-IBGZPJMESA-N	440.338	1.553	50	20	IDGD	
O=C(Cn1ccccc1=O)NC1CCN(C2CCN(C(=O)C(Cl)Cl)CC2)CC1	1834824480	CDZCOJXQLHKLRG-UHFFFAOYSA-N	429.348	1.224	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](O)Cc3ccccc3)CC2)CC1)[C@H](F)Cl	1835083783	UVXYEPVCFWVXDF-MOPGFXCFSA-N	425.932	1.696	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)C3=NO[C@@H](c4ccccc4)C3)CCO2)C1	1836585758	DULAVNALOPYGDG-LRXVAGHRSA-N	449.935	1.978	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](C)n3cnnn3)CC2)CC1	1836921855	AZWQVVQDHXRSOT-RHSMWYFYSA-N	426.949	1.640	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc4nc[nH]c4c3)CCO2)C1	1836926665	KPRMLSFJSVBBHK-OAQYLSRUSA-N	434.924	1.898	50	20	IDGD	
CCOC(=O)C(C)(C)C(=O)N1CCC(OC2CCN(C(=O)[C@H](Cl)COC)CC2)CC1	1838787038	UMQSCHHFBDMPSU-QGZVFWFLSA-N	446.972	1.828	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3c(OC)cccc3OC)CCO2)C1	1838882505	JAALYMNEFKYWEF-QVKFZJNVSA-N	440.924	1.791	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)COc3ccc(F)cc3)C2)C1	1839143272	RFWWWIXUMHEMKL-XLIONFOSSA-N	428.888	1.678	50	20	IDGD	
C=CCSCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2	1839150421	MFZAMYJTAVUBDZ-IAGOWNOFSA-N	425.378	1.598	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)/C=C/C3CCCCC3)CCO2)C1	1839184354	IWAOTCDUMCWSMW-QQINGMOHSA-N	428.957	1.833	50	20	IDGD	
O=C([C@@H]1CCCS1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839203323	IKAHXTBZBVCIDO-HUBLWGQQSA-N	425.320	1.029	50	20	IDGD	
Cc1cccc(F)c1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839203757	VJJLGPPHHCKYGS-QAPCUYQASA-N	447.276	1.895	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccc(F)cc3)C2)C1	1840151895	QOQZMCIGFCXVIA-FXAWDEMLSA-N	428.888	1.078	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(C)cc(OC)c3)C2)C1	1840155136	QTYDFFJZLPDKTM-NQIIRXRSSA-N	440.924	1.327	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)c3ccc(C)cc3)C2)C1	1840155652	GBIMKJKUQBYNRG-LZNRXBQRSA-N	438.952	1.809	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)C[C@@H](C)c3ccccc3)C2)C1	1840156554	VBTLIPYQGAQNJN-LZNRXBQRSA-N	438.952	1.890	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)Cc2ccc(Cl)cc2)C1	1842717476	FCLQLIVUPLLQHR-UHFFFAOYSA-N	427.892	1.398	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC2(CCCN2C(=O)Cc2ccc(S(C)(=O)=O)cc2)C1	1842811466	KLPFOHMAFCUMFC-CYBMUJFWSA-N	443.363	1.619	50	20	IDGD	
O=C(c1cc(F)c(F)c(Cl)c1)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843015629	RPQMMMDRYAZQFT-UHFFFAOYSA-N	434.635	1.429	50	20	IDGD	
Cn1ncc(Br)c1C(=O)N1CCCC12CN(C(=O)[C@H](F)Br)C2	1843605118	DCNVOSCUOPVSDA-JTQLQIEISA-N	438.095	1.690	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCCC12CN(C(=O)c1cccc(N3CCOCC3)n1)C2	1845170568	APDDCLWZOSIHGW-LJQANCHMSA-N	441.359	1.972	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC2(CCCN2C(=O)C[C@@H](O)CNC(=O)OC(C)(C)C)C1	1845231531	SXVAEAACEHQRIF-CHWSQXEVSA-N	448.358	1.249	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@]2(C(=O)N3CCCC34CN(C(=O)[C@H](O)CCl)C4)C[C@H]2C1	1846103987	PVYZTAJFCFCBND-ZSDSOXJFSA-N	441.956	1.437	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)c1cc(Cl)c(F)cc1F)C2	1846385518	PSMUCFMXBLYEIX-UHFFFAOYSA-N	428.867	1.808	50	20	IDGD	
C[C@@H](O)[C@H](NC(=O)c1ccccc1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CO[Si](C)(C)C	1847436432	URDCTLJBNQMWIH-HYJFEMIMSA-N	447.608	1.219	50	20	IDGD	
CCn1c(=O)c2ccccc2n(CC(=O)NNC(=O)c2cc3c(s2)CCCCC3)c1=O	21971171	GQGJTHPQWUMTCH-UHFFFAOYSA-N	440.525	1.975	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1CNC(=O)NNC(=O)c1cc(Br)c[nH]1	22423215	SDDPRJPKMGZZDZ-UHFFFAOYSA-N	444.311	1.172	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)CCCOc2ccc(C#N)cc2OC)c2ccccc2c1=O	46900929	WKYBBQPURLBGEF-UHFFFAOYSA-N	449.467	1.917	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)c1sccc1S(=O)(=O)N1CCCC1	105629389	LECSRBPSYPDUTO-UHFFFAOYSA-N	438.531	1.414	50	20	IDGD	
CCCCS(=O)(=O)N1CCC(C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)CC1	107820515	CUVDUYQREILLBN-CQSZACIVSA-N	429.514	1.582	50	20	IDGD	
Cc1nc(S(=O)(=O)NCCC(=O)NNC(=O)c2c(Cl)cccc2Cl)cn1C	727804574	HCKOSHFPNKBDDP-UHFFFAOYSA-N	434.305	1.165	50	20	IDGD	
O=C(CCCN1C(=O)CCC1=O)NNc1ccc(S(=O)(=O)Nc2ccccc2)cc1	728217494	YEHQFRWJDDSMCI-UHFFFAOYSA-N	430.486	1.860	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)[C@H]2CCCN2c2ncnc3sccc23)c1	728600913	ZFTXIEHPELUKEI-MRXNPFEDSA-N	426.502	1.928	50	20	IDGD	
CCOC(=O)C1=NN(c2ccccc2)[C@H](C(=O)NNC(=O)COc2ccccc2OC)C1	728713339	RCQOPYNIFOZHNR-KRWDZBQOSA-N	440.456	1.419	50	20	IDGD	
CCOc1ccc(/C=C(/C#N)C(=O)N2CCN([C@@H](C)C(=O)NCCCOC)CC2)cc1	728889238	SBRHENQJVGBCJR-OBKVJGTNSA-N	428.533	1.678	50	20	IDGD	
O=C(Cc1ccc(NC(=O)c2ccc(Br)o2)cc1)NNC(=O)c1cnn[nH]1	729457818	QTJNERUVNZVSLP-UHFFFAOYSA-N	433.222	1.416	50	20	IDGD	
CN(C)CCNC(=O)c1cccc(CNC(=O)NNC(=O)C(C)(C)c2ccccc2)c1	731220777	SCHOVQYUKVADCS-UHFFFAOYSA-N	425.533	1.786	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)N[C@H](C)C(=O)N2CCS(=O)(=O)CC2)c(C)n1CC(C)C	731477098	QRHZOZLASVUGQW-YDDPGSGASA-N	434.562	1.430	50	20	IDGD	
O=C(NCCOc1ccc([N+](=O)[O-])cc1)NNC(=O)c1nn(-c2ccccc2)cc1O	731686691	KWWZYEAZKGPDOJ-UHFFFAOYSA-N	426.389	1.509	50	20	IDGD	
COC(=O)c1c(S(=O)(=O)NNC(=O)[C@@H](C)Oc2ccc3ccccc3c2)n[nH]c1C	732046078	QZSQSAZNVSJQLA-GFCCVEGCSA-N	432.458	1.435	50	20	IDGD	
COc1ccc(C2(CNC(=O)NNC(=O)C(=O)N3CCCC3)CCCCC2)cc1OC	734067881	VVGHAYMDPCMUTA-UHFFFAOYSA-N	432.521	1.859	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)c1ccc(CS(N)(=O)=O)cc1	734251917	SWHAPBHXGJVWAH-UHFFFAOYSA-N	440.547	1.309	50	20	IDGD	
NS(=O)(=O)c1ccc(F)c(CNC(=O)NNC(=O)CC23CC4CC(CC(C4)C2)C3)c1	734675555	IPVIYWVEHFREGO-UHFFFAOYSA-N	438.525	1.910	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)cc1	734807561	VVFRRJOBLKDNDY-UHFFFAOYSA-N	442.538	1.977	50	20	IDGD	
CCOc1ccc(N2C(=O)c3ccc(C(=O)NNC(=O)c4cnn(C)c4)cc3C2=O)cc1	735471479	ZTGFSUHJDOCLLU-UHFFFAOYSA-N	433.424	1.694	50	20	IDGD	
CCS(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c1	735647572	SXSRAXGQCJYMHT-UHFFFAOYSA-N	448.888	1.455	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)[C@H]2CSc3ccccc32)CC1	735685968	HPRQUABENUYQII-HNNXBMFYSA-N	433.559	1.350	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)N2CCN(CC(=O)NNC(=O)c3cccs3)CC2)c1	736621279	HSQGMQZNWQHGCW-MRXNPFEDSA-N	430.530	1.429	50	20	IDGD	
CSCC[C@H](C(=O)NNC(=O)COCc1ccccc1)N1C(=O)[C@@H]2CCCC[C@H]2C1=O	737634836	OERVBRCYIRMYLQ-KZNAEPCWSA-N	447.557	1.648	50	20	IDGD	
CCc1nc(CN2CCN(CC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)CC2)cs1	738309635	OUOZAHVEZHRIGR-UHFFFAOYSA-N	432.506	1.193	50	20	IDGD	
O=C(NNC(=O)c1cccc2ccccc12)c1ccc2c(c1)S(=O)(=O)N=C1N=CNN12	741573461	DOZNNHUJGCJCFQ-UHFFFAOYSA-N	434.437	1.326	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(S(=O)(=O)NC2CC2)cc1)c1cccc2ccccc12	741656077	POPRPVGNLDZOCP-UHFFFAOYSA-N	445.522	1.904	50	20	IDGD	
O=C(NCCS(=O)(=O)NC[C@@H]1CCCCO1)NNC(=O)c1cccc2ccccc12	743628887	XHEQQMOBBNWLEZ-INIZCTEOSA-N	434.518	1.272	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NCC(=O)NNc2ccc(Cl)nc2)c1	743819253	HTSMUOOPDZLSNA-UHFFFAOYSA-N	439.925	1.639	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc(OC(F)(F)F)cc1)NNC(=O)NC1CCCC1	744470011	PABYLWLARFGUQS-UHFFFAOYSA-N	438.428	1.527	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1csc(-c2cnccn2)n1	744621195	URIJAXRBDWALGV-UHFFFAOYSA-N	446.514	1.378	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)N[C@@H]2C[C@@H](C)N(c3cnn(C)c3)C2=O)c(C)n1-c1ccccc1	745916660	FGSQYHCZKFQPGN-FOIQADDNSA-N	449.515	1.966	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNS(=O)(=O)c2cccc(C)c2C(=O)OC)cc1	747406851	KNKCJPJMRLXYHJ-CQSZACIVSA-N	436.486	1.957	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@](F)(C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)C1	748285525	JFBIMPFSEAIQRX-FQEVSTJZSA-N	433.440	1.688	50	20	IDGD	
CNS(=O)(=O)c1csc(C(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)c1	748518385	BPHISQHCFDLFCH-UHFFFAOYSA-N	443.450	1.707	50	20	IDGD	
COc1cc(S(=O)(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c(Cl)cc1C(=O)O	749140575	AJYNSTAKFJZWLB-UHFFFAOYSA-N	429.794	1.578	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)c(C)c1	749152486	RFGXHPUUEGPEAT-UHFFFAOYSA-N	440.547	1.619	50	20	IDGD	
COc1ccccc1NC(=O)CN1CCN(C(=O)/C(C#N)=C/c2cc(C#N)n(C)c2C)CC1	750518288	QMNSIYORXQIPCG-XDHOZWIPSA-N	446.511	1.904	50	20	IDGD	
CCOC(=O)[C@H]1Cc2cc(S(=O)(=O)NNC(=O)c3ccc(Cl)cc3O)ccc2O1	751540953	OMCIUVPVQIRZQA-MRXNPFEDSA-N	440.861	1.536	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@](C)(C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)C1	751776693	YJDGBIRPSHGUHK-QFIPXVFZSA-N	444.488	1.900	50	20	IDGD	
CCC(CC)(CNC(=O)NNC(=O)c1sc(N2CCOCC2)nc1C)C(=O)OC	752127803	VIRHYSWQXLUBQY-UHFFFAOYSA-N	427.527	1.212	50	20	IDGD	
CN(C)N(C(=O)[C@H]1CC(=O)N(CCOc2ccccc2Cl)C1)[C@H]1CCS(=O)(=O)C1	752761892	CFDCBYWSVCDCFT-GJZGRUSLSA-N	443.953	1.060	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)N[C@@H]1CCN(c2ccccn2)C1	753125627	YELSJGKBHHTOHV-CQSZACIVSA-N	434.294	1.832	50	20	IDGD	
CCOc1ccc(NS(=O)(=O)c2ccc(Cl)c(C(=O)NNC(=O)CO)c2)cc1	753437999	KTIAVCJZUUGHBD-UHFFFAOYSA-N	427.866	1.293	50	20	IDGD	
COC(=O)CNC(=O)Cc1ccc(NC(=O)NNC(=O)COc2ccc(C)cc2)cc1	755863598	OFYMHOJIRXVWEF-UHFFFAOYSA-N	428.445	1.058	50	20	IDGD	
CC1(C)C(=O)Nc2ccc(S(=O)(=O)NNC(=O)c3nnc(-c4ccccc4)o3)cc21	755968249	ZQFOOQSDRKPICJ-UHFFFAOYSA-N	427.442	1.590	50	20	IDGD	
CCN1CCN(C(=O)c2ccc(NC(=O)NNC(=O)Cc3ccc(F)cc3)cc2)CC1	756252974	LSFLHBGDKDPUNO-UHFFFAOYSA-N	427.480	1.999	50	20	IDGD	
CC(C)S(=O)(=O)c1ccccc1NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	756529641	UXSPLSZADIHPFQ-UHFFFAOYSA-N	443.485	1.582	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)N2CCC(C(=O)NN=c3cc[nH]cc3Cl)CC2)cc1	757418734	KIGJGEBXUHDLJI-UHFFFAOYSA-N	436.921	1.904	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1cc(Br)ccc1N1CCCC1	757710693	MHUPZBKVXCNPOE-JTQLQIEISA-N	448.343	1.140	50	20	IDGD	
CCS(=O)(=O)c1ccc(CCC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc1	757727743	UQLXCCSJUCNKNO-UHFFFAOYSA-N	442.497	1.765	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)COc2ccccc2F)ccc1S(=O)(=O)N(C)C	757777071	UZRGXIWOSYPJRL-UHFFFAOYSA-N	440.453	1.316	50	20	IDGD	
C[C@H](NC(=O)OC(C)(C)C)[C@@H]1CCCN(CC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)C1	758786172	YVMXKKUHOSDNGV-GOEBONIOSA-N	449.508	1.981	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)C2(CNC(=O)OC(C)(C)C)CC2)c2ccccc2c1=O	758828657	CFGLREFZZKCRFC-UHFFFAOYSA-N	443.504	1.872	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)c2cnc(OCc3ccccc3)cn2)c2ccccc2c1=O	760053617	MXWJVRSUQIRSOC-UHFFFAOYSA-N	430.424	1.377	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H]2CCCN(c3ccccc3F)C2=O)c1	761817209	LQLGMLWFTVLEGY-INIZCTEOSA-N	448.476	1.369	50	20	IDGD	
NC(=O)CCOc1ccc(NC(=O)C(=O)NNC(=O)c2cc3ccccc3cc2O)cc1	763522929	RIFJFRCNIPEIOP-UHFFFAOYSA-N	436.424	1.199	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(NC(=O)C(C)C)c2)cc1OC	763550172	KCTFOJHGWLWMSJ-UHFFFAOYSA-N	428.445	1.698	50	20	IDGD	
CCN(CC)C(=O)c1ccccc1NC(=O)C(=O)NNC(=O)[C@H]1COc2ccccc2O1	763573894	WEBNEUFBAJQFKH-GOSISDBHSA-N	440.456	1.095	50	20	IDGD	
CN(Cc1ncc(-c2ccccc2)[nH]1)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	763608215	MFQGEOINIKGNEU-UHFFFAOYSA-N	434.504	1.956	50	20	IDGD	
C[C@@H]1CCCN(Cc2ccc(NC(=O)C(=O)NNC(=O)COc3ccc(C#N)cc3)cc2)C1	763675436	WJLIWDSMPSCXAT-QGZVFWFLSA-N	449.511	1.955	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccc(N2CCOC2=O)c1C	763712484	IETNNLOSCDXHHL-UHFFFAOYSA-N	440.456	1.679	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)NC(=O)CC3)cc1OC	763902948	ZMKSKRCQPWBNHA-UHFFFAOYSA-N	426.429	1.378	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)CC(=O)N3)cc1OC	763912051	LWWICPOAGFHUJN-UHFFFAOYSA-N	426.429	1.378	50	20	IDGD	
NC(=O)COc1cccc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCCCCC3)c1	763915059	WMQIMRZNQARQPY-UHFFFAOYSA-N	444.513	1.671	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)C(=O)Nc1cnc2c(c1)CN(C(=O)OC(C)(C)C)CC2	763994454	YAMVVSKBXWQRQR-UHFFFAOYSA-N	442.476	1.113	50	20	IDGD	
Cc1c(Br)cccc1NC(=O)C(=O)NNC(=O)c1ccc2c(c1)OCCO2	764005061	VUTDXOIYKWSLQE-UHFFFAOYSA-N	434.246	1.928	50	20	IDGD	
CS(=O)(=O)c1ccc(F)c(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3c2)c1	764062202	UPMPYHXASNJCIU-UHFFFAOYSA-N	429.429	1.782	50	20	IDGD	
COC(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(C)cc3)[nH]n2)c1	764109854	CGVRDBUZAFFYFE-UHFFFAOYSA-N	435.440	1.500	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(N3CCSCC3)c(C)c2)c1O	764132718	QAJPHDCQJWHLLT-UHFFFAOYSA-N	444.513	1.662	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(Cn3cncn3)c2)o1	764138775	KDHICEHNQSSANJ-UHFFFAOYSA-N	439.476	1.161	50	20	IDGD	
COc1ccc(I)c(NC(=O)C(=O)NNC(=O)c2ccoc2)c1	764162597	CYEVBOJRYVTTPI-UHFFFAOYSA-N	429.170	1.293	50	20	IDGD	
Cc1cc(C(=O)NC2CCCC2)ccc1NC(=O)C(=O)NNC(=O)CCc1ccco1	764169170	MIMDXYOJBBJAHC-UHFFFAOYSA-N	426.473	1.979	50	20	IDGD	
Cc1cccc(C)c1Oc1ccccc1NC(=O)C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O	764234458	YBPRRJLBTWCXAB-AWEZNQCLSA-N	448.501	1.119	50	20	IDGD	
COC(=O)c1csc(NC(=O)C(=O)NNC(=O)c2cccc(OC(F)F)c2)c1C	764250042	HPKOSWPPCJFQPK-UHFFFAOYSA-N	427.385	1.844	50	20	IDGD	
CCOCC(=O)NNC(=O)C(=O)Nc1sc2c(c1C(=O)OCC)CC[C@H](CC)C2	764317223	JIYLCPWETRQHDQ-NSHDSACASA-N	425.507	1.562	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C(=O)Nc1ccc(S(=O)(=O)NC(C)C)cc1)c1ccccc1	764328529	PSXLEXHVQNNIEN-SFHVURJKSA-N	446.529	1.653	50	20	IDGD	
COc1ccc(S(N)(=O)=O)cc1C(=O)NNc1c(F)cc(C(=O)NC2CC2)cc1F	764328783	LRURZZKWOOTWEI-UHFFFAOYSA-N	440.428	1.270	50	20	IDGD	
CN(C)c1nnc(-c2ccc(NC(=O)C(=O)NNC(=O)COCc3ccccc3)cc2)o1	764367151	UPHRJMRXLGIICR-UHFFFAOYSA-N	438.444	1.105	50	20	IDGD	
COc1ccc(Cn2nccc2NC(=O)C(=O)NNC(=O)c2ccc(C)o2)c(OC)c1	764368660	XOOWZBGYZBDWQK-UHFFFAOYSA-N	427.417	1.250	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2ccc(SC)nc2)n[nH]1	764378410	ZJZFVICNPMRAEK-UHFFFAOYSA-N	426.458	1.602	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(Oc2ccccc2C#N)cc1	764398619	HWOFAXZTZRMEGI-CQSZACIVSA-N	426.429	1.488	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(C(=O)N(C)C2CCCCC2)cc1	764400311	PBWWRIIJHRYEHR-OAHLLOKOSA-N	448.520	1.229	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)c2cc(Br)c(C)n(C)c2=O)cc1OC	764958034	GMYRINXNGJTATQ-UHFFFAOYSA-N	438.278	1.938	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)[C@@H]2CN(C(C)=O)c3ccccc3O2)n[nH]1	765587505	CDNUKIOZAMBLAP-FQEVSTJZSA-N	435.440	1.660	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)c2c(C)noc2n1	765733868	RSASXNHVCNRVEF-UHFFFAOYSA-N	436.472	1.059	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1ccc(F)c(NC(=O)Cc2ccccc2)c1	766264851	QEPHHZQXNOAXDB-UHFFFAOYSA-N	438.419	1.887	50	20	IDGD	
Cc1ccn2ncc(C(=O)NNC(=O)c3cccc(S(=O)(=O)N4CCCCC4)c3)c2c1	766833044	LLXAMQLDVGXWDQ-UHFFFAOYSA-N	441.513	1.892	50	20	IDGD	
CCc1nn(C)c(Cl)c1C(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1	767191983	PLPCYFPEZNVLNC-UHFFFAOYSA-N	427.914	1.026	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)c1ccc(Br)cc1Br	768273110	ZGSPFGYRMGKOPO-ZETCQYMHSA-N	440.113	1.407	50	20	IDGD	
CC(C)[C@H](NC(=O)OC(C)(C)C)C(=O)NCC(=O)NNc1ccc(S(C)(=O)=O)cc1	768482411	XNOJZVDYZPGKEE-INIZCTEOSA-N	442.538	1.199	50	20	IDGD	
COc1cccc(C(=O)NNS(=O)(=O)c2cc(S(C)(=O)=O)sc2Cl)c1O	770632376	JTORBPDOEBSLOL-UHFFFAOYSA-N	440.908	1.143	50	20	IDGD	
Cc1ccc([C@@](O)(CC(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)C(F)(F)F)o1	773389729	IJRGLHIYEAEPSV-INIZCTEOSA-N	438.403	1.583	50	20	IDGD	
Cc1ccc(I)cc1NC(=O)C(=O)NNC(=O)CC(F)(F)F	773497548	WYUMUXXXIFNTFM-UHFFFAOYSA-N	429.136	1.638	50	20	IDGD	
C#CCOc1ccccc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccc(OCC)cc1	773500695	VVECSGHTBVCILQ-HNNXBMFYSA-N	425.441	1.651	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)ncc1Br	773528991	QIRZQMCPBKRVMY-JTQLQIEISA-N	439.241	1.845	50	20	IDGD	
NS(=O)(=O)c1ccc(NCCC(=O)NNc2ncc(Cl)cc2Cl)c([N+](=O)[O-])c1	775269240	BBOKQGSLNGZDKU-UHFFFAOYSA-N	449.276	1.889	50	20	IDGD	
COCCCOCC(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccc(C)cc2C)c1	775636982	JXIGMDRRXVALFM-UHFFFAOYSA-N	449.529	1.918	50	20	IDGD	
O=C(CSc1ccc(Cl)cc1)NNC(=O)N[C@H]1CCO[C@]2(CCS(=O)(=O)C2)C1	776075730	DIHNKNGNKMBKSB-SUMWQHHRSA-N	447.966	1.499	50	20	IDGD	
CC[C@@H](CS(=O)(=O)c1ccccc1)NC(=O)NNc1cccc(S(C)(=O)=O)c1	776625465	KHSBJEWCJXWREK-AWEZNQCLSA-N	425.532	1.969	50	20	IDGD	
CC(C)Cc1cc(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc(O)n1	777270355	LQFADBDKYAQKGU-UHFFFAOYSA-N	425.533	1.959	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)N(C)CC(=O)NNc2ccc3ccccc3n2)cc1	777464398	MLTPXKJMJLOSFS-UHFFFAOYSA-N	427.486	1.957	50	20	IDGD	
C[C@H](SCC(=O)Nc1ccc(F)cc1)C(=O)NNC(=O)CNC(=O)OC(C)(C)C	778436074	CLIWOZFTYFBGLB-NSHDSACASA-N	428.486	1.558	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)C(C)C)ccc1I	778557475	WHAHIPDTJMOQSR-UHFFFAOYSA-N	426.232	1.043	50	20	IDGD	
COc1cccc(NNC(=O)NCc2ccc(S(=O)(=O)NC[C@H]3CCCO3)cc2)n1	779980085	GCWWMMUSXHYVDU-OAHLLOKOSA-N	435.506	1.374	50	20	IDGD	
CCn1c(=O)c(C(=O)/C(C#N)=C/c2c(Cl)cnn2C)c(N)n(Cc2ccccc2)c1=O	780148301	PRIFYDUONMPVOG-NTEUORMPSA-N	438.875	1.837	50	20	IDGD	
CCNC(=O)N(C)NC(=O)c1ccc(Br)c(S(=O)(=O)NC(C)(C)C)c1	780710770	HVSSQWSRHLSCRD-UHFFFAOYSA-N	435.344	1.832	50	20	IDGD	
Cc1cc(=O)c(C(=O)NNC(=O)CCNC(=O)OC(C)(C)C)nn1-c1ccccc1F	780974440	WRZWVLZVMWQZFJ-UHFFFAOYSA-N	433.440	1.356	50	20	IDGD	
COCCn1cc(C(=O)NNC(=O)c2ccc(CSc3nncn3C)cc2)c(C)n1	782537148	FBQYCKJUONKJKV-UHFFFAOYSA-N	429.506	1.334	50	20	IDGD	
O=C1CN(c2ccc(NC(=O)C(=O)NN(c3ccccc3)c3ccccc3)cn2)CCN1	782821643	RKEQUYWXALQTGT-UHFFFAOYSA-N	430.468	1.826	50	20	IDGD	
CS(=O)(=O)NCc1ccc(NC(=O)C(=O)NNc2ncccc2C(F)(F)F)cc1	783119754	DYWKPUYLKYWGJI-UHFFFAOYSA-N	431.396	1.231	50	20	IDGD	
COc1ccc(C(=O)N2CCN(C)CC2)cc1NC(=O)C(=O)NNc1ccccc1Cl	784770426	HIHGNZWWMXGOFR-UHFFFAOYSA-N	445.907	1.818	50	20	IDGD	
O=C(NNc1nccnc1Cl)C(=O)Nc1cc2c(cc1Br)OCCO2	784777602	BBRWUXGYTZYGSH-UHFFFAOYSA-N	428.630	1.746	50	20	IDGD	
CCC(CC)NC(=O)[C@H]1CN(C(=O)C(=O)NNc2nccnc2Cl)c2ccccc2O1	784780901	SFAMBLPTLHJUQV-OAHLLOKOSA-N	446.895	1.672	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2cccnc2Cl)cc1S(=O)(=O)NC1CC1	784848820	ONSJZQHXQGEBPB-UHFFFAOYSA-N	439.881	1.266	50	20	IDGD	
CC(=O)N1CCN(Cc2cccc(NC(=O)C(=O)NNc3cc(C)ccc3F)c2)CC1	784884244	OXVNRZCQXOFARI-UHFFFAOYSA-N	427.480	1.880	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCN2C(=O)N(CC(C)C)C[C@H]2C1	785879501	ZRBLUROORBSIEL-OAHLLOKOSA-N	437.928	1.187	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2nc3c(s2)CCCC3)cc1	789740432	GRUFENXKSZKIGP-LBPRGKRZSA-N	430.486	1.778	50	20	IDGD	
COCc1cc(C(=O)OC)cc(S(=O)(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c1	793394901	POOXPUKCYUYRGS-UHFFFAOYSA-N	444.469	1.429	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)c3cccc(C)n3)CC2)cc1	794090652	XLMCQOWEODVBMZ-UHFFFAOYSA-N	432.502	1.261	50	20	IDGD	
O=C(NNC(=O)c1c[nH]c2ccccc12)Nc1cc(S(=O)(=O)N2CCCC2)ccn1	797674038	NVHNYQXVENZSSM-UHFFFAOYSA-N	428.474	1.814	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@H]2C(=O)NNC(=O)COc2ccccc2OC)cc1	798826584	XSPDIPKQEJGJKB-KRWDZBQOSA-N	427.457	1.535	50	20	IDGD	
CSC[C@@H](C)C(=O)N1CCC(C(=O)NNC(=O)CSc2ccccc2O)CC1	799716621	UUKLSPOODAICNL-CYBMUJFWSA-N	425.576	1.869	50	20	IDGD	
COC(=O)c1cn(CCNC(=O)/C(C#N)=C\c2cc(C)n(C[C@@H]3CCCO3)c2C)nn1	803644188	VDIBDXKYHSOTQF-BHEJFATLSA-N	426.477	1.385	50	20	IDGD	
CCCN(NC(=O)c1cc(S(N)(=O)=O)ccc1N1CCOCC1)C(=O)OC(C)(C)C	804590532	YGQWBVYPTKGNQA-UHFFFAOYSA-N	442.538	1.463	50	20	IDGD	
O=C(NNc1nccnc1C1CCC1)C(=O)Nc1cccc(N2CCCS2(=O)=O)c1	807461946	CETXDXRCCFMLTE-UHFFFAOYSA-N	430.490	1.366	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cccc(OC(F)F)c2)cc2[nH]ccc12	808935114	JPIFKVAFTNOOCA-UHFFFAOYSA-N	446.366	1.956	50	20	IDGD	
O=C(NNC(=O)c1cc(O)ccc1Cl)c1cccc(S(=O)(=O)N2CCOCC2)c1	809956607	BNXIKUXXYYBKIR-UHFFFAOYSA-N	439.877	1.141	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccccc2N2CCCC2)cc1	813033668	FMDBRUWIXXTWHK-UHFFFAOYSA-N	431.518	1.619	50	20	IDGD	
COCCN1[C@H]2CC[C@H]1CC(=NNC(=O)CN1CCN(Cc3ccc(C)cc3)CC1)C2	814879792	YFSXMESMSJNPQL-GOTSBHOMSA-N	427.593	1.858	50	20	IDGD	
Cc1nc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)nc3ccccc23)nn1C	815563780	NSNDAWFTVRKGIA-UHFFFAOYSA-N	429.440	1.738	50	20	IDGD	
CS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccc(Br)c(C#N)c2)cc1	815585499	JKMICZLPUVAWEV-UHFFFAOYSA-N	437.275	1.806	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCc2nncn2C1)C(=O)Nc1ccc(COCc2ccccc2)cc1	815692643	XHIXKTJPLILPQM-GOSISDBHSA-N	448.483	1.343	50	20	IDGD	
CCS(=O)(=O)Nc1ccccc1C(=O)NNc1ccccc1S(=O)(=O)N(C)C	817054628	QWBFKEHTIOZDQW-UHFFFAOYSA-N	426.520	1.455	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)[C@@H](NS(=O)(=O)c2ccc(C)cc2)C(C)C)c1	825786614	UOLMPAPEMVZQJS-FQEVSTJZSA-N	448.545	1.566	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)cnn1-c1ccccc1F	844256927	OQVCQXSFSKCPOC-UHFFFAOYSA-N	430.465	1.688	50	20	IDGD	
CC(=O)c1cccc(S(=O)(=O)NCCC(=O)NN=c2sc3ccccc3n2C)c1	855556376	WDKDMHDODOKYMU-UHFFFAOYSA-N	432.527	1.743	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)CN1C(=O)N[C@@]2(C[C@@H](C)CC(C)(C)C2)C1=O	871631307	CHNNYPOGEJRZJA-NPMXOYFQSA-N	444.532	1.912	50	20	IDGD	
O=C(NNC(=O)[C@]12CCC(=O)N1c1ccccc1S2)c1csc(N2CCOCC2)n1	892846916	JYRMHCUXJVICSA-LJQANCHMSA-N	445.526	1.370	50	20	IDGD	
Cc1cc(C)c(C)c(S(=O)(=O)NCC(=O)NNC(=O)COc2ccccc2F)c1C	913455144	NHNCRCLPYYAZCV-UHFFFAOYSA-N	437.493	1.564	50	20	IDGD	
C[C@@H]1CN(Cc2ccc(C(=O)NNC(=O)[C@@H]3COc4ccccc4O3)cc2)C[C@@H](C)O1	914775516	RXYWRVARZIAOPU-ZOCZFRKYSA-N	425.485	1.897	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Cc2cc3ccccc3nc2O)cc1	915638358	LMHJBOGYICIKGK-UHFFFAOYSA-N	442.497	1.259	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@@H]2CC(c3cccc(F)c3)=NO2)cc1	916112391	CFZUSCJSLKLZBM-SFHVURJKSA-N	448.476	1.095	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)NCCc2nnc3n2CCCCC3)cc1OC	916235492	ZJYPVSYRMOUXEL-UHFFFAOYSA-N	430.509	1.989	50	20	IDGD	
COc1cc(C=NNC(=O)Cc2csc(C)n2)ccc1OCC(=O)N1CCOCC1	916320206	JLPIHGOWOGURBF-UHFFFAOYSA-N	432.502	1.391	50	20	IDGD	
CC(C)Cn1cnc2c1c(=O)n(CC(=O)NN=Cc1ccco1)c(=O)n2Cc1ccccc1	916332097	NBGFGFDTYQXECL-UHFFFAOYSA-N	448.483	1.807	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NN=C(C)c1cccnc1)N(S(C)(=O)=O)CC2	916354508	CTKOYVLQEFWFBF-GOSISDBHSA-N	446.529	1.888	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)NCCN1CCN(c2ccc(F)cc2)CC1	916513636	IHVGOTLAUMGANL-UHFFFAOYSA-N	443.523	1.920	50	20	IDGD	
COc1cc(CNC(=O)NNC(=O)Cc2ccc(F)cc2)ccc1OCC(=O)N(C)C	916641574	UDCKWNDNSADAQK-UHFFFAOYSA-N	432.452	1.374	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)NCc2nnc3n2CCCC3)cc(OCC)c1OCC	916648595	XDAMJSFEMISTTM-UHFFFAOYSA-N	446.508	1.955	50	20	IDGD	
CCN1C(=O)c2ccc(C(=O)NNC(=O)C34CC5CC(CC(C5)C3)C4)cc2S1(=O)=O	917519502	MTIHLRQAFIDMPJ-UHFFFAOYSA-N	431.514	1.828	50	20	IDGD	
O=C(COc1cc(Cl)c(Cl)cc1Cl)NNC(=O)N[C@H]1CCS(=O)(=O)C1	919885572	MCWYYOIOOJMQMN-ZETCQYMHSA-N	430.697	1.543	50	20	IDGD	
O=C(CCn1ccnc1)Nc1cccc(C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1	919977131	UVNYEKXCMUXOLG-IBGZPJMESA-N	435.440	1.513	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)NCc1cccc(NC(=O)[C@H]2CCCO2)c1	920238222	SRPYBADAUJCXIH-LJQANCHMSA-N	437.456	1.585	50	20	IDGD	
CC(=NNC(=O)N[C@H]1CCS(=O)(=O)C1)c1ccc(OCC(=O)Nc2ccccc2)cc1	920383560	FTLPWYLWZLLVAW-SFHVURJKSA-N	444.513	1.914	50	20	IDGD	
O=C(CNC(=O)c1ccccc1I)NNC(=O)NCc1ccco1	920889890	QWJVRXNZKDNFTA-UHFFFAOYSA-N	442.213	1.145	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)NCc2ccccc2N2CCN(C)CC2)c1	1318275046	BOJHVWUVPCNPJU-UHFFFAOYSA-N	425.533	1.965	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)[C@@H]1CC12CCS(=O)(=O)CC2	1325808877	XTVMERMAHQIUQX-FZMZJTMJSA-N	445.335	1.579	50	20	IDGD	
CN(C)N(C(=O)CC[C@@H]1NC(=O)N(c2ccc(Cl)cc2)C1=O)[C@H]1CCS(=O)(=O)C1	1343773144	CIOGIUWTRCSTKO-GJZGRUSLSA-N	442.925	1.037	50	20	IDGD	
Cn1ncc2c(C(=O)N3CC[C@]4(C3)CN(C(=O)[C@@H](F)Br)CCO4)cccc21	1778031661	OPOPFJFMUYIGEU-QAPCUYQASA-N	439.285	1.707	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(C(=O)N2CC[C@]3(CN(C(=O)C(Cl)Cl)CCO3)C2)C1	1778127424	ZHUQDBHFLCZGFO-GOSISDBHSA-N	436.336	1.487	50	20	IDGD	
COc1ccc(CCC(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)c(F)c1	1778289314	YAHKFACUXYVQSS-XLIONFOSSA-N	428.888	1.197	50	20	IDGD	
Cc1cccc(C)c1SCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1779285034	DYIKFOVSLPTVFX-JXFKEZNVSA-N	426.966	1.825	50	20	IDGD	
Cc1ccc(C(=O)NCC(=O)N2CCO[C@@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)cc1	1779299791	DOIMMIXTNACWPT-JOCHJYFZSA-N	447.608	1.406	50	20	IDGD	
O=C(c1ccc(-c2ccccc2)nc1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1779890333	SASBMQCXVTWZPJ-SIKLNZKXSA-N	429.904	1.792	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc4cccnn4n3)C2)C1	1779963748	SUSIOSIWJNKBTE-UGSOOPFHSA-N	436.310	1.204	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(CN(C(=O)/C=C/C3CC3)CCO2)C1	1780095398	OPWHCBQTFOPFQF-ZMTJCJBESA-N	443.456	1.930	50	20	IDGD	
O=C(c1ccc(OC(F)F)cc1F)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1780140209	SCLSCOPWOXBAAZ-RDTXWAMCSA-N	436.814	1.470	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(CCN(C(=O)c3nn[nH]c3C(F)(F)F)C2)C1	1780359794	HWUKQKLSYJKOPY-ZDUSSCGKSA-N	440.220	1.052	50	20	IDGD	
CCOC(=O)N1CCC(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](Cl)CC)C3)C2)CC1	1781224472	WNMZRHBFFFKALD-JXFKEZNVSA-N	429.945	1.702	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)c3ccnc4c3OCO4)CCO2)C1	1781231191	HERJAJSPPQTAQO-ROUUACIJSA-N	430.288	1.490	50	20	IDGD	
O=C([C@@H]1CCc2ccccc2O1)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781332806	FNMHPOALSHCWGP-TXPKVOOTSA-N	441.297	1.901	50	20	IDGD	
Cc1cccn2ncc(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)[C@@H](O)CCl)C4)c12	1781413310	MNWISSXNGXGZFT-CSODHUTKSA-N	434.924	1.370	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)c(F)c1	1781600315	VAVNBBXCUZTZGS-RHSMWYFYSA-N	433.249	1.968	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCBr)C2)[C@@H]1C[C@H]2CC[C@@H]1O2	1782020621	CLAQNIYSNAKIOK-RUEZSYAVSA-N	429.355	1.853	50	20	IDGD	
CN(C)c1c(F)cc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)cc1F	1782104852	IESAUWHVUMYDCV-HNAYVOBHSA-N	431.867	1.074	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1nc3ccccn3n1)C2	1782170265	FHFYNYVKUNXZAK-BXTJHSDWSA-N	435.912	1.111	50	20	IDGD	
CCOc1cccc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](Cl)COC)C3)C2)c1O	1783882085	VDFDOYWDEPRHFD-FOIQADDNSA-N	426.897	1.488	50	20	IDGD	
Cc1cccc2cc(C(=O)N3CCO[C@]4(CCN(C(=O)CCC(=O)NN(C)C)C4)C3)[nH]c12	1783936568	XJGNOFWOQXTQMO-QHCPKHFHSA-N	441.532	1.293	50	20	IDGD	
COc1ccc2[nH]cc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]4C3)c2c1	1784093297	TYCHWENEYRJMKQ-MNXTYGCHSA-N	435.908	1.370	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/c3cc(F)c(F)c(F)c3)C[C@@H]21)[C@@H](O)CCl	1784094124	LHAGPTLHMQPNTH-GJPACEKJSA-N	446.853	1.697	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)c3cccc4c3CCCC4)C2)C1	1785095545	BRDNKTYSJOMTQG-DEOSSOPVSA-N	442.560	1.382	50	20	IDGD	
O=C(c1ccc(F)c(C(F)(F)F)c1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1785207886	HFUMOIPVQGVHCH-WMLDXEAASA-N	438.805	1.888	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3cncnc3)[C@H]2C1	1785390404	QFPBYNOUTGBGAY-TUUVXOQKSA-N	425.327	1.030	50	20	IDGD	
CCC[C@H](NC(C)=O)C(=O)N1CC[C@@]2(CN(C(=O)[C@H](C)CBr)CCO2)C1	1785441042	YZVUISHVQGKVHR-XUWXXGDYSA-N	432.359	1.152	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)N3C[C@H]4C[C@@H]4C3)[C@H]2C1	1788515587	DRSCXHZJOIWBRN-CLKXDBTJSA-N	428.371	1.090	50	20	IDGD	
Cc1cnn(CC(=O)NC2(c3ccc(NC(=O)c4cnccc4C(=O)NN)cc3)CCC2)c1	1789522762	OFBBRZNYABSDBS-UHFFFAOYSA-N	447.499	1.638	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1ccc(C2(NC(=O)CCc3ncc[nH]3)CCC2)cc1	1789523764	WAMYIHMCESJKPF-UHFFFAOYSA-N	447.499	1.789	50	20	IDGD	
COC[C@H](Cl)C(=O)NC1(c2ccc(NC(=O)[C@H](COC)NC(C)=O)cc2)CCC1	1789661204	IAKLUEBJIOXKSH-IRXDYDNUSA-N	425.913	1.525	50	20	IDGD	
COC(=O)Nc1cccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](O)CCl)C[C@@H]32)c1	1789980356	HZWNDVQAGXBPTO-LLLHUVSDSA-N	439.896	1.058	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(=O)ccn3C)C[C@@H]21	1790963483	TZDJHGXOLAPWPV-FAYQHZLMSA-N	440.338	1.152	50	20	IDGD	
CC(=O)N/C(C)=C/C(=O)Nc1ccc(C2(NC(=O)CCC(=O)NN(C)C)CCC2)cc1	1791028533	GXGMCTOPZKERNQ-CCEZHUSRSA-N	429.521	1.533	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cncn3-c3ccncc3)C[C@@H]21	1791252949	ZPOVOHDPXCHWLX-RMRDIRSESA-N	447.923	1.114	50	20	IDGD	
Cc1cc(F)cc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]32)c1	1791363247	NJVQLSDXBYMUEJ-IHPCNDPISA-N	448.539	1.029	50	20	IDGD	
COC(=O)c1ccc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Cl)C[C@@H]32)cc1	1791417163	TWDLAJWTALVQQU-NBOOPKSLSA-N	426.872	1.530	50	20	IDGD	
C[C@H](Br)C(=O)Nc1ccc(C2(NC(=O)CC[C@@H](N)C(N)=O)CCC2)cc1	1791434800	ZTEBXXDVKNQJPR-SMDDNHRTSA-N	425.327	1.497	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(Cl)ccc1F	1792702720	OXACGTHJLSJQSY-DBWKPXFBSA-N	440.903	1.055	50	20	IDGD	
Cn1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C(C)(C)CCl)c(C(F)(F)F)n1	1792784116	RWPIFTCQEJCYFI-PTEHBNRSSA-N	436.862	1.907	50	20	IDGD	
CCOC(=O)c1cccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](O)CCl)c1F	1793113103	AVXBZVGKIFSNFK-OQMKEHIESA-N	426.872	1.854	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1(c2ccc(O)cc2)CC1)c1cccc(B(O)O)c1	1793167648	LITDUDCGJJRWRQ-ACDBMABISA-N	434.301	1.056	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CC(c2ccccc2)=NO1	1793278810	HNVWHSUFRAPRSV-SHJAMOMRSA-N	445.592	1.621	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)[C@@H]1CCCN(Cc2ccccc2)C1	1793750796	NWOWOJFHUQSCLJ-CRSSMBPESA-N	449.979	1.088	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cccc(C(F)(F)F)n1	1794069930	FVAPDKHUYJXZAR-DMVWFOPNSA-N	449.857	1.486	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1(C)CC1	1795008696	GQUSTVOBCJUDCV-XGUBFFRZSA-N	429.945	1.508	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c(c1)OCCO3)C2	1795114484	OKUHGKLAECMYKM-ZSBFGKGUSA-N	439.306	1.446	50	20	IDGD	
COc1c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)ccc(F)c1F	1796189467	QHVLWSDTTZLLJJ-MUJYYYPQSA-N	444.243	1.219	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)c1cccc(-c2cnco2)c1	1796189499	VGVZNKZFZUTFNN-WKCHPHFGSA-N	445.284	1.587	50	20	IDGD	
C[C@H](NC(=O)c1ccc(F)cc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2	1799049774	BNUPNUAULDAWQN-DNVSUFBTSA-N	446.306	1.337	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(OC)c(N(C)C)c1	1799208956	KOQCUCOVWPQBJT-YYAJDYIMSA-N	439.940	1.218	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C[C@@H](C)NC(=O)OC(C)(C)C)C2	1799269990	MNDGINGEMAXSRB-LFYQSXPISA-N	431.961	1.897	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cnc3ccccn13)C2	1799273956	XCKFXGXAYPENCZ-VLBMKZOESA-N	439.343	1.703	50	20	IDGD	
CC(C)(C)c1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Br)[nH]n1	1799348911	DAEBZAXLJUYLMR-RDBQEKCUSA-N	431.306	1.601	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccn3c(O)nnc13)C2	1800078636	DZHYGSOYUYNRPW-QPSSLKIMSA-N	426.304	1.923	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1C[C@@H]1F)C2)[C@H](Br)Cc1ccccc1	1800436633	NBPIQLWGOQLARJ-NWCWSAAOSA-N	439.325	1.940	50	20	IDGD	
CO[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)Br)c1ccccc1	1800757096	ULPUGVVVZWFVJU-BTYMGIQYSA-N	425.323	1.747	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(Cl)cc1F)C2	1801008908	HLJKLNMVELDIFE-DBWKPXFBSA-N	440.903	1.055	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H]1[C@H]3Sc4ccccc4[C@@H]31)C2	1802337497	MSNRWVQYJZMUEJ-WXEFCSOTSA-N	442.585	1.886	50	20	IDGD	
CC(C)(CCl)C(=O)NC[C@H]1CCN(C(=O)CCS(C)(=O)=O)[C@H]1c1cccnc1	1802904034	HTSCTMQOJINNGL-WBVHZDCISA-N	429.970	1.787	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)Cn2nnc3ccccc32)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803136795	VIKLFBIGUJMLJR-ZAAXVRCTSA-N	442.907	1.132	50	20	IDGD	
Cc1ccsc1C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1805397600	ULIPAFRXYSGKSV-QUCCMNQESA-N	449.341	1.765	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(C(=O)N2CCC3(CCCN(C(=O)[C@H](O)CCl)C3)CC2)C1	1805523814	DBNHBIJZDXDRJW-MRXNPFEDSA-N	443.972	1.684	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC2(CCCN(C(=O)Cc3cccnc3Cl)C2)CC1	1806865062	SGTCHFAEJNKWQK-UHFFFAOYSA-N	449.983	1.882	50	20	IDGD	
CC(C)(F)C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1	1806982136	MCMRRUHNODIROC-RHSMWYFYSA-N	428.468	1.148	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H]2C[C@]2(F)Cl)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1	1807373300	AWCIFHTWZYCOAB-DZKDUJFISA-N	445.687	1.006	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccccc2F)[C@H]1c1cccnc1)c1cccc(B(O)O)c1	1807376201	UEWVJIQBDFAQKT-AVRDEDQJSA-N	447.275	1.534	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@H](CNC(=O)Cn2cncn2)[C@@H]1c1cccnc1	1807603961	ZKUQHTFUAPKXGZ-ZVZYQTTQSA-N	425.320	1.615	50	20	IDGD	
Cc1nocc1C(=O)N1CCCC2(CCN(C(=O)c3cnccc3C(=O)NN)CC2)C1	1808550513	VCKCEKIURJOULT-UHFFFAOYSA-N	426.477	1.140	50	20	IDGD	
CC[S@](=O)CCC(=O)N1CC[C@H](CNC(=O)[C@@H](F)Br)[C@H]1c1cccnc1	1808668147	JEENIZKEFXRTEG-RHVCPTERSA-N	448.358	1.937	50	20	IDGD	
Cc1cnc2c(C(=O)NC[C@@H]3CCN(C(=O)[C@H](O)CCl)[C@H]3c3cccnc3)cnn2c1	1809830175	AZFUWZPCARVPNI-JQHSSLGASA-N	442.907	1.352	50	20	IDGD	
CC(=O)N/C(C)=C/C(=O)N1CC[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]1c1cccnc1	1810544706	QVKUSEDKTZFFKE-ODQNTDMBSA-N	432.597	1.979	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CCN(C(=O)CN)[C@H]1c1cccnc1	1811357941	CMSKEDWEJXDNPB-YWZLYKJASA-N	441.444	1.193	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)CN(C)C(=O)C(=O)O)[C@@H]1c1cccnc1	1812389034	WXGIXRAJOQJDNL-VYDXJSESSA-N	438.912	1.038	50	20	IDGD	
C#CCCCCC(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1813223812	UVHFNMHIVXQMRN-NFBKMPQASA-N	433.317	1.275	50	20	IDGD	
C[C@H](CBr)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CC[C@@H](N)C(N)=O)[nH]n1	1814781084	WAGKHAVMXZEHOK-NQBHXWOUSA-N	443.346	1.026	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)CCc3ccc[nH]3)sc2C1	1815477868	ALNWBWRZBHROFX-CQSZACIVSA-N	432.550	1.389	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)[C@@H](O)CCl)[nH]n2)n1	1816086580	OMJDUSJQHTWLKL-CABCVRRESA-N	434.884	1.669	50	20	IDGD	
COc1cccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)n1	1817471033	PSSCLUCBPRSAKH-GOSISDBHSA-N	449.276	1.113	50	20	IDGD	
COC[C@H](C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)n[nH]1	1818110529	JIFRGTHQMRQUPL-REQSCQPASA-N	443.508	1.818	50	20	IDGD	
CCOC(=O)N[C@H](O)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](C)Br)[nH]n1	1819244460	VDGCKBURINIDOG-OLUVUFQESA-N	446.302	1.250	50	20	IDGD	
Cn1ccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cnccc3C(=O)NN)n[nH]2)c1	1819402013	IQLLLWGBQWYNNX-KRWDZBQOSA-N	436.476	1.366	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@](C)(Cl)CCl)CC2	1820148866	WRXRHFIQBLPIMV-VHCOLVSPSA-N	433.361	1.982	50	20	IDGD	
O=C1CC[C@H](C(=O)N[C@H]2CCc3nc(NC(=O)[C@H](F)Br)sc3C2)CN1	1822999383	PVWQIGFDHPHHFH-UBJUHAIHSA-N	433.303	1.272	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CNCP(=O)(O)O)CC1	1824614043	DPWGRTKBBMTXCF-CVEARBPZSA-N	437.905	1.738	50	20	IDGD	
COC(=O)C1(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)CCBr)CC3)CC1	1825273815	SZXHSPXHEKWAPJ-VIFPVBQESA-N	430.324	1.793	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)on1	1825964121	DZHRAILSZMPHFD-LJQANCHMSA-N	425.294	1.210	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC[C@@H]1C1CCN(C(=O)C(F)(F)C(F)F)CC1	1827050245	KFYZZBSEYUWFTR-MRXNPFEDSA-N	444.234	1.500	50	20	IDGD	
Cc1cnoc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1	1829549659	WDOVWTHJBOGEFQ-IBGZPJMESA-N	425.294	1.210	50	20	IDGD	
COc1ncc(Cl)cc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1829584013	AWFIGNMTBDFLSA-SUMWQHHRSA-N	436.267	1.348	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830353572	FUGRLDJBTVSLBZ-CXAGYDPISA-N	439.778	1.739	50	20	IDGD	
Cc1ccc2[nH]cc(CC(=O)N3CCOC[C@]4(C3)CN(C(=O)[C@H](O)CCl)CCO4)c2c1	1830726204	PJBUHTYQTBHIQY-KNQAVFIVSA-N	449.935	1.075	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc(OCF)cn3)C2)C1	1831643999	MPAPEUHTIVJRCT-LIRRHRJNSA-N	444.891	1.260	50	20	IDGD	
CCCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2	1832549506	SRLVMXFVPVVWMI-MGPUTAFESA-N	447.960	1.375	50	20	IDGD	
CC(C)c1cc(C(=O)N2CCC(N3CCC(NC(=O)[C@@H](O)CCl)CC3)CC2)on1	1833311942	GLKBLDVSHXVOKS-KRWDZBQOSA-N	426.945	1.583	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(NC(C)=O)n3)CCO2)C1	1833338504	OBAZKCMIQPLTPI-QRWLVFNGSA-N	438.912	1.127	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)[C@H](C)n3cnnn3)CC2)CC1	1833535610	ZEMBMOHHQBBBND-YOEHRIQHSA-N	425.965	1.213	50	20	IDGD	
CCc1cc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCBr)CCO3)C2)no1	1834822972	BLHCXSLEPLVHHA-QGZVFWFLSA-N	430.299	1.092	50	20	IDGD	
Cc1ccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)cc1	1835082719	JPEBUEYMMJTQPM-JOCHJYFZSA-N	434.609	1.845	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3nc(O)n4c3CCCC4)CC2)CC1)[C@H](F)Cl	1835084263	UAROLGYLOKVOEH-KRWDZBQOSA-N	441.935	1.645	50	20	IDGD	
CC[C@@H](C)[C@H](N)C(=O)N1CCC(N2CCC(NC(=O)CO[Si](C)(C)C)CC2)CC1	1835833543	PGBVXHYPBSNNEU-UZLBHIALSA-N	426.678	1.783	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)Cc3cc[nH]n3)CC2)CC1)[C@@H](F)Br	1836413504	FTKFFERVFVIOBW-MRXNPFEDSA-N	430.322	1.214	50	20	IDGD	
Cc1cc(C(=O)N2CCC(OC3CCN(C(=O)[C@H](O)CCl)CC3)CC2)cc(O)n1	1836718021	PPMDIRNSQJTHHP-QGZVFWFLSA-N	425.913	1.308	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836718739	CDBZIFSEKDXZTG-CABCVRRESA-N	439.778	1.758	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)c3ccc[n+]([O-])c3)CC2)CC1	1837242903	ZFGFLNLIIMSUMQ-AWEZNQCLSA-N	440.338	1.716	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3ccc[n+]([O-])c3)CC2)CC1	1837244156	AGKUNHFHDUHUDJ-SFHVURJKSA-N	425.913	1.186	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCC(OC2CCN(C(=O)CN)CC2)CC1	1837838841	FOKYAOMITDGYHH-UHFFFAOYSA-N	448.476	1.091	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(C)c(OC)c3)CCO2)C1	1838988891	UITBCHLLOQSXTJ-UWJYYQICSA-N	440.924	1.327	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(F)cc3F)CCO2)C1	1839006831	UOFGVJQPWKDERJ-KZULUSFZSA-N	447.276	1.818	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(F)cc3OC)C2)C1	1839148889	MQFRHNHHPAAFSX-OXJNMPFZSA-N	428.888	1.922	50	20	IDGD	
O=C(c1ccccc1F)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839202256	YQZWSIDXJUGFRZ-WMLDXEAASA-N	433.249	1.586	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CCNC(C)C)C2)C1	1839963932	AMHIOCNYPKXPHZ-YJBOKZPZSA-N	434.375	1.004	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CC=CCC3)C2)C1	1839965843	MSRUEOPKDRAXFL-FRQCXROJSA-N	429.355	1.973	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCOc3ccccc3)C2)C1	1840151066	VQDIWQNJNGIOGE-RXVVDRJESA-N	440.924	1.166	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C=C/c3cccc(O)c3)C2)C1	1840155985	LTXFJZIRNLSZCT-PYEWKGIHSA-N	438.908	1.116	50	20	IDGD	
COc1cnc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)c(F)c1	1840186939	XMBPNHTYRGKRKU-QGZVFWFLSA-N	436.267	1.103	50	20	IDGD	
Cc1nccn1[C@@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1	1840492255	JGUIVVKYUCUBBF-JXFKEZNVSA-N	438.601	1.060	50	20	IDGD	
Cc1cccc(F)c1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1840651523	CCOYVUHWUGLUSV-YJBOKZPZSA-N	447.276	1.895	50	20	IDGD	
CN1CCC(C(=O)N2CCCC23CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C3)CC1	1841095973	WGZYPWNXAPQXIG-INIZCTEOSA-N	442.988	1.664	50	20	IDGD	
CC(C)[C@@H](C(=O)N1CCCC12CN(C(=O)[C@@H](O)CCl)C2)N1Cc2ccccc2C1=O	1841587080	FHOQEXTWXMWBTL-ROUUACIJSA-N	433.936	1.470	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC2(CCCN2C(=O)c2ccc(S(C)(=O)=O)cn2)C1	1842255520	JKOPCAUVSOQVHC-INIZCTEOSA-N	434.345	1.538	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1cc3cccnn3c1)C2	1843416624	HFXRQBLXMODTOV-MFKUBSTISA-N	433.472	1.285	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)Cc1ccc(F)cc1F)C2	1843416793	BFTVMCYBBHHZBB-VULFUBBASA-N	443.454	1.845	50	20	IDGD	
CCCc1onc(C)c1C(=O)N1CCCC12CN(C(=O)c1cnccc1C(=O)NN)C2	1843525278	MPIRRXXPCXKCJQ-UHFFFAOYSA-N	426.477	1.065	50	20	IDGD	
Cc1ccn2c(=O)c(C(=O)N3CCCC34CN(C(=O)CO[Si](C)(C)C)C4)cnc2c1	1843787441	XKCSOUMKVBCJAU-UHFFFAOYSA-N	428.565	1.671	50	20	IDGD	
COC(=O)C[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)[C@H](F)Cl)C2	1846212686	OQVMFWVQEHVBRN-YPMHNXCESA-N	435.880	1.181	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC2(CCCN2C(=O)CCc2ncc[nH]2)C1	1846513842	FQNYFLKCNXEXSI-AWEZNQCLSA-N	439.944	1.678	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](CC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](O)CCl)C1	1847559417	RHHLPIXJDPDNQO-QAETUUGQSA-N	443.972	1.825	50	20	IDGD	
Cn1ccnc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1848095784	OWTQPRLQZSRZPI-IHRRRGAJSA-N	425.917	1.368	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)OCC(=O)NNC(=O)c2ccccc2)ccc1C	3426390	QMDNPTFXCPUYCJ-UHFFFAOYSA-N	447.513	1.644	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C[C@H](NC(C)=O)c2cccs2)c2ccccc2c1=O	14044403	YDSRJMCSMGVILL-HNNXBMFYSA-N	427.486	1.506	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)c2ccc3c(c2)C[C@H](C)N3S(C)(=O)=O)cc1C	14843466	JOCNYDMDLKFGSN-HNNXBMFYSA-N	431.514	1.854	50	20	IDGD	
O=C(Cc1ccc(Cl)cc1)NNC(=O)Cn1c(=O)ccn(Cc2ccccc2)c1=O	14935675	JXLNFRSCGMQAQY-UHFFFAOYSA-N	426.860	1.102	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(C(=O)NNC(=O)COc2ccc(C#N)cc2)ccc1Cl	15888807	YDINQSPCXHEXLY-UHFFFAOYSA-N	436.877	1.302	50	20	IDGD	
O=C(COC(=O)COc1ccc2c(c1)CCC(=O)N2)NNC(=O)c1ccc(Cl)cc1	25669692	XBSCWHKWGKESJC-UHFFFAOYSA-N	431.832	1.608	50	20	IDGD	
COc1ccc(N2C[C@@H](C(=O)NNC(=O)Cc3c[nH]c4ccccc34)CC2=O)c(OC)c1	26536500	DIUTWVWMJKQILU-HNNXBMFYSA-N	436.468	1.928	50	20	IDGD	
O=C(N[C@H](C(=O)NNC(=O)c1n[nH]c(=O)c2ccccc12)c1ccccc1)c1ccccc1	27077618	LUEOJCQBMMIFPS-IBGZPJMESA-N	441.447	1.855	50	20	IDGD	
CN1C(=C(C#N)C(=O)COC(=O)Cn2cnc3sccc3c2=O)N(C)c2ccccc21	28254847	QWEDZODIUKJAMV-UHFFFAOYSA-N	435.465	1.892	50	20	IDGD	
CCCCNC(=O)c1ccc(CNC(=O)NNC(=O)CNC(=O)c2cccs2)cc1	725872378	CZCKTESUPPOBGH-UHFFFAOYSA-N	431.518	1.538	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)NCCCN2CCC[C@H]2C(=O)N(C)C)c2ccccc2n1	726278850	ZWTDZFBJILFJGN-IBGZPJMESA-N	426.521	1.430	50	20	IDGD	
CN(CCc1ccccn1)C(=O)CNC(=O)NNC(=O)c1ccc(Br)s1	727473813	WTHSGIOKGCNMNN-UHFFFAOYSA-N	440.323	1.551	50	20	IDGD	
CCCCC(=O)N1CSC[C@@H]1C(=O)NNC(=O)c1sc(N2CCOCC2)nc1C	728018359	LVWLWLRNXCMVCS-CYBMUJFWSA-N	441.579	1.141	50	20	IDGD	
O=C(NNc1nc(-c2cccnc2)no1)c1cccc(S(=O)(=O)NC[C@H]2CCCO2)c1	728078381	CVXQVGRZQXGDEY-OAHLLOKOSA-N	444.473	1.346	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)[C@@H]3Cc4ccccc4S3)cc2)CC1	728215220	WXOSLGMAFUMNPC-IBGZPJMESA-N	432.571	1.783	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)c2cc(S(C)(=O)=O)ccc2Br)c(O)c1	728962612	JKWHMMCPCIOYSH-UHFFFAOYSA-N	427.276	1.941	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)c1ccc(F)c(S(=O)(=O)NC2CC2)c1	729451764	CKMGJSQMSGXAPR-UHFFFAOYSA-N	430.461	1.682	50	20	IDGD	
CCN1CCC[C@@H]1CN1C[C@H](C(=O)NNC(=O)c2cc3c(s2)CC[C@H](C)C3)CC1=O	729625963	FYYOQIZMEZHOPW-USXIJHARSA-N	432.590	1.967	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)NNC(=O)COc2ccccc2O)N(C)c2ccccc21	730782097	HIDHISGSQKRSBB-UHFFFAOYSA-N	449.467	1.589	50	20	IDGD	
O=C(NNC(=O)N1CCCN(C(=O)CC2CCCC2)CC1)c1ccc(-n2cnnn2)cc1	730820476	GLQQZFMHINOFLC-UHFFFAOYSA-N	440.508	1.131	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C1CCN(S(=O)(=O)c2ccccc2F)CC1	731491138	MPBUCIAHDDYRQI-UHFFFAOYSA-N	435.477	1.696	50	20	IDGD	
O=C(NN=c1cc[nH]c2ccccc12)[C@H]1CCCN1S(=O)(=O)c1cccc([N+](=O)[O-])c1	732999318	FCYCYIXMVCOLMD-LJQANCHMSA-N	441.469	1.861	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NC2CCN(C[C@H]3CCCO3)CC2)nc1	734284243	WLJAUPIBYGWURV-MRXNPFEDSA-N	440.570	1.038	50	20	IDGD	
COc1ccc([C@H]2[C@@H](C(=O)NNc3nc4ccccc4c(=O)n3C)CCC(=O)N2C)cc1	734438748	QKRBUYWWWYFSQM-PXNSSMCTSA-N	435.484	1.995	50	20	IDGD	
COc1ccc([N+](=O)[O-])cc1C(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	734824682	HXERFMXZBMBZQD-UHFFFAOYSA-N	437.453	1.947	50	20	IDGD	
COc1ccc(S(=O)(=O)C[C@@H](C)C(=O)OCC(=O)NNC(=O)c2ccc(C)cc2)cc1	735158815	SLKWXRFANJADED-OAHLLOKOSA-N	448.497	1.418	50	20	IDGD	
CCc1ccc(O[C@@H](C)C(=O)N2CCN([C@H](C)C(=O)NNC(=O)CC(C)C)CC2)cc1	736620851	DSLCFNZKKKFLTI-MSOLQXFVSA-N	432.565	1.743	50	20	IDGD	
Cc1cc(NNC(=O)CCNS(=O)(=O)c2ccc(Br)cc2)nc(C)n1	736716790	UQSOAGRKGVOABD-UHFFFAOYSA-N	428.312	1.668	50	20	IDGD	
CN(C(=O)c1ccncc1)c1ccc(CNC(=O)NN[C@]2(C)CCS(=O)(=O)C2)cc1	737057888	VMZQLFXGADSSSH-HXUWFJFHSA-N	431.518	1.239	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)c1cc(C)c(OCC(=O)N2CCCCC2)c(C)c1	741693581	DZSAYLKHRZUNLI-UHFFFAOYSA-N	446.548	1.761	50	20	IDGD	
CC(C)(C)OC(=O)N(CC(=O)NNC(=O)[C@@H]1COc2ccccc2O1)C[C@@H]1CCCO1	741882705	KPQOHWFPOFIVTL-YOEHRIQHSA-N	435.477	1.390	50	20	IDGD	
O=C(NNS(=O)(=O)c1cnn(-c2ccccc2F)c1)C1CCN(c2ncccn2)CC1	742029956	XMNVBZGXHGYALJ-UHFFFAOYSA-N	445.480	1.028	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)[C@H](C)NC(=O)c2cc3c(C)nn(C)c3s2)c1	742033346	MFFICTTVGYXZSW-AWEZNQCLSA-N	443.529	1.905	50	20	IDGD	
COc1ccc(-c2nnc(SCC(=O)NNC(=O)C3CC3)n2C[C@@H]2CCCO2)cc1	742449547	GOGGLIAMWQPRTO-INIZCTEOSA-N	431.518	1.782	50	20	IDGD	
CC(C)[C@@H](CNC(=O)NNC(=O)c1cccc(Br)c1)N1CCN(C)CC1	745431648	DYZVCWPKXBBMPN-MRXNPFEDSA-N	426.359	1.665	50	20	IDGD	
CN1CCC(C(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)CC1	746092873	HINSIPYJSJTDPS-UHFFFAOYSA-N	430.530	1.268	50	20	IDGD	
Cc1noc(C)c1S(=O)(=O)NC1(C(=O)NNC(=O)c2cccc(Cl)c2)CCCC1	746094868	GXNPNGAHBGZROT-UHFFFAOYSA-N	440.909	1.997	50	20	IDGD	
NS(=O)(=O)Cc1ccc(C(=O)NNC(=O)c2ccc(COc3ccccc3)o2)cc1	746345985	FYZAJNNPHPXFSL-UHFFFAOYSA-N	429.454	1.722	50	20	IDGD	
COc1ccc(-n2cnnc2SCC(=O)NNC(=O)Cc2cn3ccccc3n2)cc1	746549714	VQPXRJCQKCARQA-UHFFFAOYSA-N	437.485	1.406	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1c[nH]nc1-c1ccncc1	746615461	JJWNHHORTLFUPI-UHFFFAOYSA-N	428.474	1.250	50	20	IDGD	
COC(=O)c1ccsc1N1CC[C@@H](NC(=O)NNC(=O)c2cccc(C#N)c2)C1=O	746779140	HIXPXYMBFKHAGB-CQSZACIVSA-N	427.442	1.156	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)c1ccc(C)cc1)C(=O)NNC(=O)c1ccc(C#N)cc1	747175880	OFWBNIXYBQHGRN-GOSISDBHSA-N	446.554	1.728	50	20	IDGD	
COc1ccc(N(C)S(=O)(=O)c2cccc(C(=O)NNc3nccn(C)c3=O)c2)cc1	747941698	MNEBVJBORYRJBL-UHFFFAOYSA-N	443.485	1.371	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNc2nccn(C)c2=O)c1	747942041	SGQCZJYSYRGFDK-UHFFFAOYSA-N	429.458	1.347	50	20	IDGD	
O=C(NCCC(=O)N1CCN(c2ccccc2)CC1)NNC(=O)c1cccc2cccnc12	748465313	OGJHAXDOXLJBHJ-UHFFFAOYSA-N	446.511	1.918	50	20	IDGD	
NS(=O)(=O)c1ccc(CC(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)s1	748609433	BSAQDLMPGVTACK-UHFFFAOYSA-N	425.460	1.078	50	20	IDGD	
C[C@@H]1CN(S(=O)(=O)N2CCN(/C(=C/C#N)c3ccc([N+](=O)[O-])cc3)CC2)C[C@@H](C)O1	750035599	GJIHTYAZCFUNSU-MFAUDRRCSA-N	435.506	1.431	50	20	IDGD	
C[C@H]1C[C@H](C)CN(C(=O)CN2CCN(C(=O)NNC(=O)c3cc4ccccc4o3)CC2)C1	750288944	NIRDRHTWKRHIKF-IRXDYDNUSA-N	441.532	1.909	50	20	IDGD	
CNS(=O)(=O)c1ccc(-c2ccc(C=NNC(=O)CNC(=O)c3cccs3)o2)cc1	750948010	MGSWGLODARWPPX-UHFFFAOYSA-N	446.510	1.796	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=O)NCC(F)(F)F)c1	751616206	DCQPBHZSYYDTKU-UHFFFAOYSA-N	430.836	1.923	50	20	IDGD	
O=C(NCCNS(=O)(=O)c1ccc(Cl)s1)NNC(=O)c1cccc(Cl)c1	752687741	ABBSIHAPRPVFHB-UHFFFAOYSA-N	437.330	1.977	50	20	IDGD	
COc1ccc(-c2nnc(SCC(=O)NNC(=O)CO)n2-c2ccc(C)cc2)cc1	753445239	WVBSCYGPVNIMBZ-UHFFFAOYSA-N	427.486	1.483	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNC(=O)NC[C@H]2CCN(S(C)(=O)=O)C2)cc1	753660493	LCZXSGWXSHPAKD-OAHLLOKOSA-N	426.539	1.337	50	20	IDGD	
CCN1CCN(c2ccc(NC(=O)NNC(=O)[C@@H]3COc4ccccc4O3)cc2)CC1	755471635	HVPDLXMJTDAOJT-FQEVSTJZSA-N	425.489	1.821	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)Nc2cc(S(=O)(=O)N(C)C)ccc2N(C)C)c1	755532729	OWWZWBNZGGUJJU-UHFFFAOYSA-N	449.533	1.543	50	20	IDGD	
C=CCN(C)S(=O)(=O)c1ccc(NC(=O)NNC(=O)c2cccc(OC)c2O)cc1	755931365	AFCUMTLMFIZVHV-UHFFFAOYSA-N	434.474	1.674	50	20	IDGD	
C[C@H]1CCCN(CC(=O)NNC(=O)c2cccc(C#N)c2)[C@H]1CNC(=O)OC(C)(C)C	756548642	CAKVVUZOKQDLJF-YJBOKZPZSA-N	429.521	1.944	50	20	IDGD	
CC[C@H]1CN(CC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)CC[C@@H]1NC(=O)OC(C)(C)C	757103936	FZSOUCSWEVAJEY-YOEHRIQHSA-N	449.508	1.981	50	20	IDGD	
Cc1cc(=NC(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)cc[nH]1	757808408	WGBXNPCXDWSMOY-UHFFFAOYSA-N	439.497	1.757	50	20	IDGD	
CC[C@H](Cc1ccccc1Br)C(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1	758156570	ATZYWTFSHCVTGW-YPMHNXCESA-N	432.340	1.535	50	20	IDGD	
CS(=O)(=O)N1CCc2c(NC(=O)NNC(=O)[C@@H]3COc4ccccc4O3)cccc21	758296805	SVHFLGFCYBVXKK-KRWDZBQOSA-N	432.458	1.001	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)CN2C(=O)COc3cc(Br)ccc32)nc1	759721564	MBWPJICNWDJYDR-UHFFFAOYSA-N	435.234	1.499	50	20	IDGD	
COCCC(C)(C)CNC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	760166052	POJAFIUWTIOUME-UHFFFAOYSA-N	426.539	1.478	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cc(-c3ccc(F)cc3)on2)cc1	761783821	FCAUGGWSLODYRL-UHFFFAOYSA-N	446.460	1.871	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)N[C@H]2CCCN(c3ccccc3F)C2=O)cc1	761819907	XJZSAEZTDDBJRK-KRWDZBQOSA-N	425.420	1.602	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H]1[C@@H]1COCCC1=NNC(=O)[C@H]1CCS(=O)(=O)C1	762418879	UMZZEJWIYKLXGX-SQWLQELKSA-N	429.539	1.329	50	20	IDGD	
CCOc1ccccc1N1C[C@H](C(=O)NNc2nccc(N3CCOCC3)n2)CC1=O	762853083	QAQSSIRIIRFXAD-OAHLLOKOSA-N	426.477	1.208	50	20	IDGD	
COCCOc1cc(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3n2)ccc1OC	763449736	GVTBWGLQYDFVLN-UHFFFAOYSA-N	438.440	1.668	50	20	IDGD	
CCN1CCN(c2ccc(NC(=O)C(=O)NNC(=O)c3ccc4ccccc4n3)cc2)CC1	763451208	WWJWDKOUPMFDQB-UHFFFAOYSA-N	446.511	1.776	50	20	IDGD	
CC(C)N1CCN(c2cccc(NC(=O)C(=O)NNC(=O)c3ccccc3O)c2)CC1	763527897	STJBKSOBHDRYRG-UHFFFAOYSA-N	425.489	1.322	50	20	IDGD	
CN(C)C(=O)C[C@@H]1CN(C(=O)C(=O)NNC(=O)c2ccccc2F)c2ccc(Cl)cc21	763557130	WDIZCGRJDWAJMX-GFCCVEGCSA-N	446.866	1.849	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2c(C)nc3ccccn23)n(-c2ccc(F)cc2)n1	763628636	DFKYCPIXWGIHNR-UHFFFAOYSA-N	435.419	1.676	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(N3CCOC[C@H]3C)cc2)cc1C	763665256	QGYBVOMSGOGQBJ-QGZVFWFLSA-N	440.500	1.693	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccccc2S(=O)(=O)C(C)C)cc1C	763665477	VVOYWYCGDBAKJZ-UHFFFAOYSA-N	447.513	1.650	50	20	IDGD	
Cc1cccc(NC(=O)C(=O)NNC(=O)COc2ccccc2F)c1C(=O)N1CCCC1	763679514	MYYLYHASEUPLLP-UHFFFAOYSA-N	442.447	1.535	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)C(=O)Nc1cc2c(cc1[N+](=O)[O-])OCCCO2	763680587	JUWZZMFHMHSJCU-UHFFFAOYSA-N	448.363	1.060	50	20	IDGD	
CN(C)c1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	763791396	QZQCHZJRJOCTDB-UHFFFAOYSA-N	442.863	1.053	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c2cccnc12	763791749	YEBDYXOWOXPVCZ-UHFFFAOYSA-N	430.424	1.190	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(-c2n[nH]c(C3CC3)n2)cc1	763814965	XZRXGLGMPPJYQN-UHFFFAOYSA-N	445.439	1.386	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)C(=O)Nc1cnc(C2CC2)nc1	763881358	CRTAFNKJFBIZIO-JTQLQIEISA-N	448.277	1.670	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@H](C)C(=O)NNC(=O)C(=O)Nc1c2c(nn1C)CCC2	763883403	MXEQXSPXJIGXIR-GFCCVEGCSA-N	433.896	1.732	50	20	IDGD	
O=C(CCSc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccc2c(c1)C(=O)NCC2	763895771	SOCLPVRIWRREDU-UHFFFAOYSA-N	430.461	1.380	50	20	IDGD	
CC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc1C	763943399	GLRPQVXOFFESIZ-UHFFFAOYSA-N	436.428	1.244	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)C(=O)Nc1cccc(C[S@](=O)Cc2ccccc2)c1	763998483	KTAVOWQGNVPOKI-WJOKGBTCSA-N	438.509	1.874	50	20	IDGD	
C=CCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(Br)cn2C)cc1	764004848	OZSJZUHVOAUOMI-UHFFFAOYSA-N	448.277	1.103	50	20	IDGD	
COC(=O)c1ccc(N2CCCC2)c(NC(=O)C(=O)NNC(=O)Cc2ccsc2)c1	764035047	YTMWAGJUYZHADR-UHFFFAOYSA-N	430.486	1.464	50	20	IDGD	
CC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(F)cc2Br)cc1	764084088	DNWSOTWEAHVYDK-UHFFFAOYSA-N	437.225	1.946	50	20	IDGD	
O=C(CC(F)(F)F)NNC(=O)C(=O)Nc1ccnn1Cc1ccc(Br)cc1	764116637	MMNLLSTUKFMNAH-UHFFFAOYSA-N	448.199	1.732	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(-c3noc(C(F)F)n3)cc2)c1O	764130436	HTTROHUTDFHUAK-UHFFFAOYSA-N	447.354	1.788	50	20	IDGD	
CC(C)CCC(=O)NNC(=O)C(=O)Nc1cc(N2CCCS2(=O)=O)ccc1Cl	764200367	ZJPYTHLQUOSYFL-UHFFFAOYSA-N	430.914	1.402	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)COC/C=C/c3ccccc3)cc2)CC1	764322918	YTLGWDZTZKFUIO-VMPITWQZSA-N	444.557	1.796	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)C(=O)Nc1cccnc1Br	764344133	ZYQDUZMAPLPJRK-UHFFFAOYSA-N	429.234	1.430	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)C(=O)Nc1cc(Br)ccc1-n1cccn1	764353439	GTFMXYUXOWYVCL-UHFFFAOYSA-N	443.261	1.358	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)COCc3ccccc3)cc2)C[C@H](C)O1	764363138	KXUSHEPQRTZWJC-IRXDYDNUSA-N	440.500	1.603	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)cnc1Br	764379057	PNGSXSRRNXERKK-UHFFFAOYSA-N	443.204	1.910	50	20	IDGD	
COC(=O)NCc1ccc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)cc1	764379660	GWNGSDIPHMXQGG-UHFFFAOYSA-N	436.371	1.300	50	20	IDGD	
CCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)cc1	764382669	OTAXADNMAUHMEQ-UHFFFAOYSA-N	426.458	1.288	50	20	IDGD	
Cc1cc(S(C)(=O)=O)ccc1NC(=O)C(=O)NNC(=O)c1ccc(Cl)cc1F	764410159	IBBIELGZWGHAQR-UHFFFAOYSA-N	427.841	1.591	50	20	IDGD	
O=C(NNC(=S)NCc1ccon1)c1nn(Cc2ccccc2)c(=O)c2ccccc12	764437129	CZUORIHDQYHSBC-UHFFFAOYSA-N	434.481	1.742	50	20	IDGD	
C[C@@H]1CN(CCCNC(=O)NNC(=O)COc2ccc(Br)cc2)CCCO1	764582991	LOFQBGNLOXLLEU-CQSZACIVSA-N	443.342	1.659	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)CCC3CCCC3)CC2)cc1	765731187	YRLZZPYBMLFDGC-UHFFFAOYSA-N	436.578	1.419	50	20	IDGD	
COc1ccc(-c2ncc(C(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)s2)cc1OC	766375452	WLWBEGYNXGFHDM-LLVKDONJSA-N	425.488	1.023	50	20	IDGD	
CCCCCn1nc(C(=O)NNS(=O)(=O)c2cc(C)cnc2N)c2ccccc2c1=O	766896951	WACAMZPQYHYLET-UHFFFAOYSA-N	444.517	1.496	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)CCc1c(C)nc2c(c(O)nn2C)c1C	768635540	DWNNCDVDTWYTER-UHFFFAOYSA-N	447.517	1.779	50	20	IDGD	
C[C@@]1(c2cccc(C(=O)NNC(=O)c3cc(F)ccc3Br)c2)NC(=O)NC1=O	769019432	JHLMEVLBUPCGSK-SFHVURJKSA-N	449.236	1.718	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)Nc1cccc(-n2nnnc2SC)c1	769222266	LCSRLHLLEJWULF-UHFFFAOYSA-N	449.518	1.945	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)Cc1ccnc(O)c1Br	770813258	GGSVUQGZKHJWEK-UHFFFAOYSA-N	432.278	1.852	50	20	IDGD	
CC1CCC2(CC1)NC(=O)N(CC(=O)NNc1nc(O)c3cnn(C(C)(C)C)c3n1)C2=O	770967647	YZOIRAXKSJQFCY-UHFFFAOYSA-N	444.496	1.231	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)cc1	771607436	MRNSPMDGBYJOGI-UHFFFAOYSA-N	439.877	1.143	50	20	IDGD	
COc1ccc(S(=O)(=O)NCC(=O)NNC(=O)Cc2ccc(Cl)cc2)cc1OC	771806812	DVGPRDMAXVBEOI-UHFFFAOYSA-N	441.893	1.026	50	20	IDGD	
COC(=O)C[C@H]1CCCN1C(=O)NNC(=O)[C@@H](C)Oc1cccc(Br)c1	771954763	RBWQIYBWDRSJSK-DGCLKSJQSA-N	428.283	1.985	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)c2cnn(CC(=O)NC3CCCC3)c2)cc1OC	772044915	BNSVINRZMSTMSP-UHFFFAOYSA-N	443.504	1.814	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)C2(OCc3ccccc3)CCOCC2)c1	772416598	OIDJAENXBXYOTB-UHFFFAOYSA-N	437.452	1.628	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)c1ccc(S(N)(=O)=O)c(Cl)c1	773170315	DJECSFQDQMNFAX-SECBINFHSA-N	432.285	1.869	50	20	IDGD	
Cc1nc(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)ccc1Br	773524079	DWDGOHQHCVXNSO-UHFFFAOYSA-N	432.234	1.189	50	20	IDGD	
COc1cc(C)c(NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1F	775893222	KIXPBPUXEXJYFQ-UHFFFAOYSA-N	438.481	1.925	50	20	IDGD	
CC1CCC2(CC1)OC[C@@H](CNC(=O)NNC(=O)c1csc(N3CCOCC3)n1)O2	776885610	MOTYMHWQJQQOAT-SHYRYGCCSA-N	439.538	1.246	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc(Cl)ccc1OC[C@@H]1CCCCO1)c1cnccn1	777599930	GZNXPBXVGNWRCM-ZDUSSCGKSA-N	426.882	1.701	50	20	IDGD	
C=CCn1c(S)nc2cc(C(=O)NNc3ncc(C(=O)OCC)c(C)n3)ccc2c1=O	778420881	BVVAFPOLVUFNKD-UHFFFAOYSA-N	440.485	1.903	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)c2ccccc2S(=O)(=O)CCN(C)C)nc1C	778421378	KVCPPHAFNSRPHI-UHFFFAOYSA-N	435.506	1.054	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)c2ccc(F)c(S(=O)(=O)NC3CC3)c2)nc1C	778424418	QWWBSEFSDLAGJI-UHFFFAOYSA-N	437.453	1.298	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)[C@@H]1CCCN(C(=O)Nc2ccccc2F)C1	778437503	FCZNEBQHRVJGEW-CYBMUJFWSA-N	437.472	1.742	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)CC(C)C)ccc1I	778557988	ZGKORFTVGGIANB-UHFFFAOYSA-N	440.259	1.433	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)cc1Br	778712895	LPHQUEQAVZGBGU-MRXNPFEDSA-N	448.273	1.937	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1ccc(C(N)=O)cc1)C(=O)NNc1ccccc1OC(F)(F)F	779203823	KMQXSDPZYHAQMJ-SNVBAGLBSA-N	446.407	1.494	50	20	IDGD	
CCCCn1c(=O)nc(O)c2c1nc(CCC(=O)NN=c1cc[nH]cc1)n2CC(C)C	780757187	VKWMURRZCFUFKI-UHFFFAOYSA-N	427.509	1.648	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)[C@@H]1C[C@H](O)CN1S(=O)(=O)c1ccc(Cl)cc1	781932857	IJUYJORULFYPGE-YOEHRIQHSA-N	437.905	1.234	50	20	IDGD	
COc1cc(OC)c(NC(=O)C(=O)NNc2ncncc2Cl)cc1Br	782159164	OALWNVPVMXEVKZ-UHFFFAOYSA-N	430.646	1.992	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)cc1)C(=O)Nc1ccnc(OCC(F)(F)C(F)F)c1	782833996	OFFQYCVWGKJPHO-UHFFFAOYSA-N	430.314	1.466	50	20	IDGD	
CCCNS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)Nc2ccccc2C)cc1	783411495	QTGYIARTUCXHMZ-UHFFFAOYSA-N	433.490	1.475	50	20	IDGD	
CC(C)COC(=O)Nc1cccc(NC(=O)C(=O)NNc2ccc(-n3cccn3)nn2)c1	783432815	DREFUPROIWVQHN-UHFFFAOYSA-N	438.448	1.949	50	20	IDGD	
C[C@H]1CCCCN1C(=O)c1ccc(NC(=O)C(=O)NNc2ccc(-n3cccn3)nn2)cc1	783436698	NDTQZPUNDHCRKE-HNNXBMFYSA-N	448.487	1.759	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1nc(-c2ccccc2)cs1	784003227	CBILTVJRBAJWON-UHFFFAOYSA-N	429.483	1.388	50	20	IDGD	
CNC(=O)CCOc1ccc(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2Cl)cc1	784383940	MKFJSKQSFSVBCS-UHFFFAOYSA-N	435.824	1.845	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1cccnc1-c1cnn(C)c1	786416119	BRSZHUQPINJVKA-UHFFFAOYSA-N	440.485	1.369	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)[C@@H]2CCCN(C(=O)NC3CCCC3)C2)c1	786808466	LDNHGQITVBRFFE-QGZVFWFLSA-N	430.505	1.663	50	20	IDGD	
C[C@@H](C(=O)OCC(=O)NNC(=O)c1ccc(C#N)cc1)C1CN(C(=O)OC(C)(C)C)C1	786989066	KYHXDGCNKBVASL-CYBMUJFWSA-N	430.461	1.365	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@@H]2CCc3cc(C#N)ccc32)cc1	787420403	JMVMRHUGWYLDAW-LJQANCHMSA-N	441.513	1.505	50	20	IDGD	
Cc1ccc(C)c(-n2cnc3cc(C(=O)NNC(=O)[C@H]4CCS(=O)(=O)C4)ccc32)c1	788429174	VAPWJCIEZGTTST-INIZCTEOSA-N	426.498	1.838	50	20	IDGD	
COc1ccc(S(=O)(=O)CCC(=O)NNc2nnc(-c3ccccn3)s2)cc1OC	788556086	FFBFTWXQAHPOCU-UHFFFAOYSA-N	449.514	1.924	50	20	IDGD	
CN(NS(=O)(=O)c1cc(F)cc(F)c1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	788915969	HUCIBALPXLUALX-UHFFFAOYSA-N	434.465	1.763	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)[C@@H]2CCCc3c(O)cccc32)cc1OC	789252922	OVFQMGMGNUWIOU-MRXNPFEDSA-N	428.441	1.834	50	20	IDGD	
CN1C(=O)Cc2cc(NC(=O)C(=O)NNc3ccc([N+](=O)[O-])cc3Br)ccc21	789742978	BNKDGKZGWJFCPU-UHFFFAOYSA-N	448.233	1.958	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccc(OC)cc2)c1)[C@H](C)O	790070490	UMADUDIMLSDJTO-SCLBCKFNSA-N	435.502	1.664	50	20	IDGD	
Cc1c(C(=O)NNC(=O)[C@H]2COc3ccccc3O2)nnn1Cc1ccc(F)cc1F	790111751	PEGYZHZAZYSTLG-QGZVFWFLSA-N	429.383	1.514	50	20	IDGD	
CCS(=O)(=O)N1CCC(C(=O)NNc2nc3ccccn3n2)(c2ccccc2)CC1	791252829	JDDASYUJLKTGMP-UHFFFAOYSA-N	428.518	1.556	50	20	IDGD	
COc1c(NC(=O)C(=O)NNc2ccc3c(=O)[nH]ccc3c2)cc(Cl)cc1C(N)=O	793069820	JWPVWAFLGJQNJD-UHFFFAOYSA-N	429.820	1.371	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)N1CCC[C@H](C=NNC(=O)COc2ccc(C#N)cc2)C1	794473120	YTYKWIVHOJOFSV-QGZVFWFLSA-N	443.504	1.802	50	20	IDGD	
CCOC(=O)c1ccc(F)c(S(=O)(=O)NNC(=O)c2cc(Br)c[nH]2)c1	795291120	SVSJTURXYHBRRX-UHFFFAOYSA-N	434.243	1.716	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)[C@@H]1CCN(CC(F)(F)F)C1	795736942	AZXMYJOBMUCPDB-SNVBAGLBSA-N	437.802	1.537	50	20	IDGD	
O=C(NNC(=O)c1c(O)cnc2ccc(Cl)cc12)c1csc(N2CCOCC2)n1	801601237	ZSVXJXABIPTGIH-UHFFFAOYSA-N	433.877	1.962	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2cc(NC(C)=O)ccc2NS(C)(=O)=O)cc1	802064975	HVZBZGUZGILSJZ-UHFFFAOYSA-N	435.462	1.492	50	20	IDGD	
C[C@H](C(=O)NNC(=O)c1csc(N2CCOCC2)n1)C1CN(C(=O)OC(C)(C)C)C1	806338568	QTEIBMDMCMQGFS-LBPRGKRZSA-N	439.538	1.244	50	20	IDGD	
O=C(CCOc1ccccc1)NNC(=O)C(=O)Nc1ccc(F)cc1OC1CCOCC1	806977739	XEHGQEXUYATRRA-UHFFFAOYSA-N	445.447	1.939	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2nc(Cc3ccccc3)cs2)c1O	806977813	ZVLDAFRSLHIKRW-UHFFFAOYSA-N	426.454	1.848	50	20	IDGD	
CCCS(=O)(=O)Nc1cccc(NC(=O)C(=O)NNc2nccnc2C2CCC2)c1	807461592	KWZLTZRQXYDADB-UHFFFAOYSA-N	432.506	1.978	50	20	IDGD	
COc1cc(NC(C)=O)c(Cl)cc1S(=O)(=O)NNC(=O)c1cccc(OC)c1O	808081007	QILYMOOEJDYRCJ-UHFFFAOYSA-N	443.865	1.645	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)CNc3ccccc3C(N)=O)n[nH]2)cc1OC	809724286	ZDNOQBWYOFSQOR-UHFFFAOYSA-N	438.444	1.066	50	20	IDGD	
COC(=O)c1c(F)ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2OC)c1C	810384276	BRLKUTFUQWDDTE-UHFFFAOYSA-N	433.392	1.094	50	20	IDGD	
Cn1nnc(Br)c1C(=O)NNc1ccccc1S(=O)(=O)NC(C)(C)C	810405732	MKYCCUDNIPMGFW-UHFFFAOYSA-N	431.316	1.411	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1cncnc1-c1ccccc1	810462370	NQYKIXUOYKMHEK-UHFFFAOYSA-N	439.497	1.921	50	20	IDGD	
Cc1ccc(C)c(S(=O)(=O)NCC(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)c1	810585084	KHTHFACWYSQCCE-UHFFFAOYSA-N	433.515	1.495	50	20	IDGD	
CCN(CC)C(=O)N1CCC(C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)CC1	812732567	LOHDJZVFYRZTFF-UHFFFAOYSA-N	425.555	1.554	50	20	IDGD	
COc1cc(NNC(=O)C(=O)Nc2cccc(CN3CCNC(=O)C3)c2)ccc1Cl	812991144	BDPWEUUIZKBVRN-UHFFFAOYSA-N	431.880	1.362	50	20	IDGD	
N#Cc1ccncc1N1CCN(C(=O)NNC(=O)c2cccc(Br)c2)CC1	814306946	OAAKRLSOVKZVTJ-UHFFFAOYSA-N	429.278	1.892	50	20	IDGD	
CNC(=O)Oc1cccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(C(C)=O)cc2)c1	815566355	RAWNODAFSDXKND-CYBMUJFWSA-N	442.428	1.161	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCc2nncn2C1)C(=O)Nc1cccc(COc2ccccc2)c1	815691349	NDGGXXOHHLTEDE-INIZCTEOSA-N	434.456	1.206	50	20	IDGD	
CSCC[C@H](NC(=O)c1ccccc1Br)C(=O)NNc1cnnn1C	816770500	ZXRNDSLNCPRDPI-LBPRGKRZSA-N	427.328	1.572	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)[C@@H]1CCCN1C(=O)OCC(F)(F)F	817052410	AAXSFVULRZTYOK-LBPRGKRZSA-N	438.428	1.543	50	20	IDGD	
Cc1c(C(=O)NNC(=O)[C@H]2CCCN(C(=O)OC(C)(C)C)C2)cnn1C1CCOCC1	819658745	OWWDWEDSWFMTSD-HNNXBMFYSA-N	435.525	1.951	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1)NNC(=O)c1ccccc1F	913415756	CFQZEAXLJJUMRV-UHFFFAOYSA-N	435.355	1.464	50	20	IDGD	
Cc1nc2c(C#N)cnn2c(C)c1CCC(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	914830807	YUSWFVLBWVLATL-UHFFFAOYSA-N	444.455	1.503	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCCc2ccc3c(c2)OCCO3)c2ccccc2c1=O	915891061	KVRMXVDBZUBKHT-UHFFFAOYSA-N	437.456	1.374	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)N[C@H](c2ccccc2)c2nccn2C)nc1	916220450	HDCZBOYTKRYESS-GOSISDBHSA-N	443.533	1.918	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)NCCNS(=O)(=O)c2ccccc2)c1	916294671	FIEBPHYQRMGHEK-UHFFFAOYSA-N	448.545	1.806	50	20	IDGD	
C=CCN(CC=C)[C@H](CNC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)C(C)C	916522041	WYSBPQSLWHHNAS-GOSISDBHSA-N	426.521	1.576	50	20	IDGD	
O=C(COC(=O)c1sccc1Br)NNC(=O)[C@@H]1COc2ccccc2O1	917273345	MPMJWHVKSMNTDI-LBPRGKRZSA-N	441.259	1.655	50	20	IDGD	
O=C(NNC(=O)c1cccc2c1OCO2)c1cccc(S(=O)(=O)N2CCCCC2)c1	917360864	RDUMLHFJZLGMTM-UHFFFAOYSA-N	431.470	1.665	50	20	IDGD	
CCOc1ccc(C(=O)NNS(=O)(=O)c2ccc([N+](=O)[O-])cc2OC)cc1OC	917728128	VJHRFLZGGVUMMV-UHFFFAOYSA-N	425.419	1.634	50	20	IDGD	
COc1ccc(CNC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c(OC)c1OC	918227755	XLUJSQSIQVGYRP-UHFFFAOYSA-N	441.444	1.104	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)NCCC(=O)N[C@H]2CCS(=O)(=O)C2)c(C)n1CC(C)C	919715443	VWUGQKMVDXRQCO-VBIXMBBUSA-N	434.562	1.478	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)CNC(=O)c2ccc(F)c(F)c2)CC1	1116622358	UIXDGEXUONJERC-UHFFFAOYSA-N	440.447	1.489	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)[C@@H]2CC(=O)N(c3ccc(C#N)cc3)C2)cc1	1318034332	VDJQPRXPTIMTOW-DOTOQJQBSA-N	436.468	1.925	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2cc(C(=O)O)c(F)cc2Br)cc1	1319391826	RALDTRWWEXJECB-UHFFFAOYSA-N	447.238	1.918	50	20	IDGD	
C[C@@H](CCNC(=O)NNC(=O)CNC(=O)c1cccs1)N(C)C(=O)OC(C)(C)C	1321743082	GZQCQMYQXUDRSL-LBPRGKRZSA-N	427.527	1.454	50	20	IDGD	
COCc1nnc(-c2cccc(C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)c2)o1	1323492633	YWSFVAHKQVYZAR-UHFFFAOYSA-N	437.460	1.351	50	20	IDGD	
Cc1ccc2c(c1)C(=O)N(CC(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1)C2=O	1339189945	KMVIOTSBLXDDLG-UHFFFAOYSA-N	444.488	1.386	50	20	IDGD	
COc1ccc(C(=O)NNc2cncc(Br)c2)cc1S(=O)(=O)N(C)C	1341240626	HGBUWEIVOGATCK-UHFFFAOYSA-N	429.296	1.860	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)/C=N/N3CCCCC3)C2)C1	1779013974	OQBYUDYJKLUTTH-VZCCDBLZSA-N	429.359	1.319	50	20	IDGD	
C[C@@H](Cn1cncn1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(C)(C)CCl)C2	1779495970	RVTVCWOHKSNFRH-RZQQEMMASA-N	425.961	1.693	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3csc(C(F)(F)F)n3)C2)C1	1779758653	MRUFPHHRPGRLBG-BONVTDFDSA-N	441.859	1.859	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(CN(C(=O)C3=COCC3)CCO2)C1	1780098953	LOUSVBRHEDGDBS-OAQYLSRUSA-N	445.428	1.268	50	20	IDGD	
C=CC(=O)N[C@@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@](C)(Cl)CCl)C1	1780712753	WYMXZPHNEPCQBO-WTVLQJKYSA-N	434.364	1.427	50	20	IDGD	
Cn1cc(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@](C)(Cl)CCl)C2)cn1	1780715334	OMURZYWYLKFUGP-ATZDWAIDSA-N	431.364	1.713	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)c3c(O)cc(O)cc3O)CCO2)C1	1781235459	ZNSSIVXUPRKDRL-ZWKOTPCHSA-N	433.288	1.483	50	20	IDGD	
CC(C)(C)c1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](F)Br)C3)C2)[nH]n1	1781332367	XRTAHERTNRZMBF-SUMWQHHRSA-N	431.306	1.841	50	20	IDGD	
O=C(c1cc(F)cc(C(F)(F)F)c1)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1781607827	APTPNVQEDKRRSE-RHSMWYFYSA-N	438.805	1.888	50	20	IDGD	
Cc1nc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CCC(=O)NN(C)C)C2)ccc1F	1782209468	RUYPSKYXCNBYOS-XMSQKQJNSA-N	449.527	1.030	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1[nH]cc3c1CCC3)C2	1782212113	IKGOYSLTAUANBI-WZONZLPQSA-N	445.564	1.004	50	20	IDGD	
Cn1cc2cc(C(=O)N3CC[C@]4(CN(C(=O)CCBr)CCO4)C3)ccc2n1	1782239854	HWJXCWUXDVHFGD-IBGZPJMESA-N	435.322	1.802	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(CCN(C(=O)c3cn4c(F)cccc4n3)C2)C1	1782368886	NATXVNKIYGZWQQ-GOSISDBHSA-N	439.285	1.702	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cnc4ccccc4n3)CCO2)C1	1783534416	JGKJJFNUWYVOER-YJYMSZOUSA-N	433.306	1.857	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cccnc3OCC3CC3)CCO2)C1	1783873344	NYEBBONCBRDHGK-DYESRHJHSA-N	437.924	1.568	50	20	IDGD	
CC(C)(C)OC(=O)N1CC=C(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Cl)C[C@@H]32)C1	1784343256	FEFBZKGFCXYEJE-YHUYYLMFSA-N	445.919	1.678	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3Cc4ccccc4CN3C)[C@H]2C1	1785024387	KEBZKFWQDVZXHQ-AFDCHOCNSA-N	449.979	1.277	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc(Br)nc3)C[C@@H]21)[C@H](F)Cl	1787449369	PLGDDMRIDHXRSC-QCQGSNGOSA-N	448.720	1.901	50	20	IDGD	
C[C@H](CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Cl)C[C@@H]21)NC(=O)OC(C)(C)C	1787467214	ADOAQISZSIVSDS-XSEXMBABSA-N	435.924	1.804	50	20	IDGD	
C[C@](O)(C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]2C1)C(F)(F)F	1788764913	CTYRVLLGZVLGJS-QCQGSNGOSA-N	426.508	1.131	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21)c1ccc(OCCCO)cc1	1789236074	XVZMOZUDMYUCIT-DKIMLUQUSA-N	428.888	1.576	50	20	IDGD	
Cc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]32)c(C)c1	1789506839	RNMAVDZOBQMGRJ-IHPCNDPISA-N	430.549	1.270	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3CC[C@@H]4CCC(=O)N4C3)[C@H]2C1	1789766911	GABOOQWHLHSKMF-SGYMCOKNSA-N	439.984	1.775	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4nncn4c3)C[C@@H]21	1789868170	PPTNJEMNAPQPKQ-XMDUPGNXSA-N	440.331	1.559	50	20	IDGD	
C[C@H](Cn1cccn1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]2C1	1789869076	XDMOSNSHQFVMLD-CUGJGTHOSA-N	431.364	1.735	50	20	IDGD	
COCc1oncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]2C1	1789922949	OMUHAKPDVSMTOE-QVSJOPQTSA-N	434.262	1.105	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4ccnn4c3)[C@H]2C1	1790442816	AFUMLEVUHYAPFV-KCMWZYNZSA-N	449.349	1.959	50	20	IDGD	
Cc1cccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]3C2)c1F	1791287338	YQODGIDBLDADLY-SZMVWBNQSA-N	434.512	1.100	50	20	IDGD	
C[C@H](NC(=O)c1ccccc1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]2C1	1791297971	UKGIRSIRRUQVRQ-TUUVXOQKSA-N	442.343	1.588	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3CCc4nc[nH]c4C3)[C@H]2C1	1791528462	OSHNUAJAHPLMJP-DRMAHVMPSA-N	434.613	1.346	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)c1ccccc1OC(F)(F)F	1792666968	SEFZSTJNCNMXFR-WJNVRWDZSA-N	436.814	1.388	50	20	IDGD	
Cc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)CBr)ccc1O	1792874601	SGWNFGJFKSUKMP-JJAZEVLHSA-N	425.323	1.935	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nc(-c3ccccc3)ns1)C2)[C@H](O)CCl	1792977138	RJJZMKSQVXYUBS-LXTVHRRPSA-N	436.921	1.008	50	20	IDGD	
CC1(C)Cc2cccc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3cccc(B(O)O)c3)c2O1	1796191039	RAWGVVTVVATZIE-ACDBMABISA-N	448.328	1.646	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2nccn2c1	1797076889	BEAVSRDRRWCLJG-FAYQHZLMSA-N	435.322	1.569	50	20	IDGD	
Cc1cc(C)n(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)Br)C3)n1	1801247841	BIDCFQQHOCCGJG-PNBKFKSVSA-N	427.343	1.263	50	20	IDGD	
CC[C@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](C)[C@H]1SC(=N)NC1=O)C2	1801801972	QIRPFGXSZGZVJC-DIURFFJMSA-N	445.383	1.601	50	20	IDGD	
C=CCNC(=O)/C=C\C(=O)NC[C@@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1	1802483361	UDVCYFCGTRAJKI-FRWFVBGZSA-N	449.349	1.731	50	20	IDGD	
CC(C)(CCl)C(=O)NC[C@@H]1CCN(C(=O)CCS(C)(=O)=O)[C@@H]1c1cccnc1	1802904023	HTSCTMQOJINNGL-DOTOQJQBSA-N	429.970	1.787	50	20	IDGD	
C=C(Oc1ccccc1O)C(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]1c1cccnc1	1803139679	SWGMZNZZUTXBCG-POAQFYNOSA-N	445.903	1.985	50	20	IDGD	
CN(CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CCOC1)NC(=O)NCc1ccccc1	1803235977	WSHXBZIGOFPOOO-YSTOQKLRSA-N	443.548	1.007	50	20	IDGD	
O=C(CCN1Cc2ccccc2C1=O)N1CCC2(CCCN(C(=O)[C@@H](O)CCl)C2)CC1	1805524277	NSROYNGEFIFNRA-IBGZPJMESA-N	447.963	1.863	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H](CNC(=O)[C@@](C)(Cl)CCl)[C@@H]1c1cccnc1)n1cnnn1	1808317712	ZJYPNPWXURRPOU-TXPWEPMLSA-N	440.335	1.571	50	20	IDGD	
Cc1cc(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)cn1C	1808723121	CJERJZIPRBXUHF-DENIHFKCSA-N	446.316	1.042	50	20	IDGD	
O=C(/C=C/c1ccccc1)N1CCCC2(CCN(C(=O)c3cccc(B(O)O)c3)CC2)C1	1809304373	UOCFJPXMPFNATG-ZHACJKMWSA-N	432.329	1.925	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(-n3ccnc3)ccn2)[nH]n1)[C@H](O)CCl	1814872972	IILCIHDCHKIYKS-DLBZAZTESA-N	443.895	1.896	50	20	IDGD	
CCOC(=O)N[C@@H](O)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCBr)n[nH]1	1816781423	ARUGHKFVWUEXNL-FZMZJTMJSA-N	446.302	1.251	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)C2(C#N)CC2)n[nH]1	1817109078	DZSQZXGVXDFQLS-IXBOPPFXSA-N	436.476	1.840	50	20	IDGD	
O=C(/C=N/O[C@@H]1CCCCO1)Nc1cc([C@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1	1819450179	HFTLCSRBTOHKBN-GBYKNZAESA-N	427.889	1.531	50	20	IDGD	
C[C@@H](Cn1cncn1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CO[Si](C)(C)C)CC2	1820072427	GZCATIJJOVHFCY-QWHCGFSZSA-N	436.614	1.834	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)CO[Si](C)(C)C)[nH]n1	1822414631	JGWNEKGAMDFHFN-HNNXBMFYSA-N	438.605	1.626	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)C2=COCCC2)n[nH]1	1822459406	CKCFQLCOGFJVOI-QGZVFWFLSA-N	439.476	1.408	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC[C@H]1c1cc(NC(=O)C(F)(F)Cl)n[nH]1	1822565859	JWPGTCBYGNGSJF-ZDUSSCGKSA-N	426.616	1.227	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnn3ccncc13)CC2	1826000638	ZFQKKUFOOFVQPE-PWSUYJOCSA-N	434.909	1.665	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(=O)n3[nH]nnc3n2)CC1	1827400120	ZWRGVORZMQIVDK-HOCLYGCPSA-N	449.943	1.453	50	20	IDGD	
N#CCC(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)[C@@H](F)Cl)C2)C1	1828807462	BHIUPXOZIICKKU-YLJYHZDGSA-N	436.871	1.887	50	20	IDGD	
Cc1nc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)cs1	1830357693	DQZTXWRPRSEYFZ-LJQANCHMSA-N	429.970	1.715	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4cnccc4[nH]3)C2)C1	1830361770	CEPBHTASAWDQNX-OAQYLSRUSA-N	434.924	1.898	50	20	IDGD	
O=C(Cc1cc(F)ccc1Cl)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1830726583	QXMNIAJGPRPGDL-VQIMIIECSA-N	449.306	1.078	50	20	IDGD	
Cc1nscc1C(=O)N1CCO[C@@]2(COCCN(C(=O)CCBr)C2)C1	1833742775	KEFAKTADIBGYNZ-MRXNPFEDSA-N	432.340	1.307	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccsc3)CCO2)C1	1833959260	DJQCPHNDUIEINX-DYVFJYSZSA-N	431.352	1.849	50	20	IDGD	
Cc1ncsc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1834267671	FLAOTQPDCMXONP-IUODEOHRSA-N	436.303	1.212	50	20	IDGD	
CCC(=O)N[C@H](C)C(=O)N1CCC(N2CCC(NC(=O)CCBr)CC2)CC1	1834422666	XGFKOWPQWXJTBZ-CQSZACIVSA-N	445.402	1.258	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)c3ccc(F)cc3F)C2)C1	1834824242	ZROXWOHJKKWZMM-GOSISDBHSA-N	447.276	1.820	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)[C@@]3(C)CCCN3)CC2)CC1	1836384711	IKTMQLPLLUWHPU-FXAWDEMLSA-N	443.430	1.874	50	20	IDGD	
CC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)C(=O)Nc3cccnc3)CC2)CC1	1836396697	JHQXJUGPSOGTAE-SFHVURJKSA-N	435.956	1.609	50	20	IDGD	
CCNC(=O)N[C@@H](C)C(=O)N1CCC(N2CCC(NC(=O)[C@H](Cl)CC)CC2)CC1	1836397351	XYVOWVRITMKCMB-WMLDXEAASA-N	429.993	1.283	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC(OC2CCN(C(=O)[C@@H]3C=CCN3)CC2)CC1	1836670910	LNTOHIMEZXIUBO-PBHICJAKSA-N	428.371	1.544	50	20	IDGD	
CC(C)(C)n1cc(C(=O)N2CCC(OC3CCN(C(=O)[C@H](O)CCl)CC3)CC2)nn1	1836717660	AKOLYYAZYPYJCW-QGZVFWFLSA-N	441.960	1.245	50	20	IDGD	
C[C@@H](CC(N)=O)C(=O)N1CCC(OC2CCN(C(=O)CO[Si](C)(C)C)CC2)CC1	1836909776	GSOUPTSFVRANMU-HNNXBMFYSA-N	427.618	1.348	50	20	IDGD	
O=C(c1cc(C2CC2)on1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839197267	OHUSHIVVJPEQAB-RHSMWYFYSA-N	446.273	1.313	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc4c3NC(=O)C4)CCO2)C1	1839573843	DBGFOFYPVGQMJV-HRAATJIYSA-N	435.908	1.269	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ncccc3C)C2)C1	1839962318	AMYCOAWMDDZSGI-DNVCBOLYSA-N	440.338	1.634	50	20	IDGD	
Cc1ccc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)cn1	1840031303	LQYFBNKRPAJZSZ-HNAYVOBHSA-N	440.338	1.172	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3ccccn3)C2)C1	1840031657	YUAQRPGMKBCRNY-BEFAXECRSA-N	440.338	1.254	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)c(C)n1	1840034708	UYKJBZSTXUXCHY-IFXJQAMLSA-N	440.338	1.552	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(O)c(C)c3)C2)C1	1840154985	MAAVFHUFSWYYJG-OXQOHEQNSA-N	426.897	1.024	50	20	IDGD	
C=C(Oc1ccccc1O)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840187537	HZBQNIJHYQDAQX-IBGZPJMESA-N	445.299	1.545	50	20	IDGD	
O=C(c1ccc2cncn2c1)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840188465	LJGAYIUKZLFKQM-GOSISDBHSA-N	427.288	1.208	50	20	IDGD	
C[C@@H](Nc1ccccn1)C(=O)N1CCOC[C@@]2(CN(C(=O)C(Cl)Cl)CCO2)C1	1840188633	VBVSCYMXEDSGMR-ACJLOTCBSA-N	431.320	1.142	50	20	IDGD	
O=C(c1cccn2ccnc12)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840188700	XOXPEPUGWAMFCG-SFHVURJKSA-N	427.288	1.208	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H]3CCc4nc[nH]c4C3)CCO2)C1	1840359960	UQWDPTXFWMPOQR-VFNWGFHPSA-N	438.956	1.236	50	20	IDGD	
CN(CC(=O)N1CC2(CCCN2C(=O)[C@H]2C[C@H]2C2CC2)C1)NC(=O)NCc1ccccc1	1841273250	SATVXAGWFSJLNM-PMACEKPBSA-N	439.560	1.582	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)Cc2ccccc2C(F)(F)F)C1	1842705223	NEBXVCJQSOJUFU-UHFFFAOYSA-N	440.466	1.824	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC2(CCCN2C(=O)c2cc(=O)nc3sccn23)C1	1844625129	CORVIVDPJZTAQZ-MRXNPFEDSA-N	429.329	1.809	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@H](NC(C)=O)c2ccc(F)cc2)C1	1845010377	MYGXTEYJUTXUDZ-DLBZAZTESA-N	425.888	1.460	50	20	IDGD	
O=C(C(Cl)Cl)N1CC2(CCCN2C(=O)[C@@H]2[C@@H](O)CCN2Cc2ccccc2)C1	1845837088	KKHXTCJFWBYHEJ-HOTGVXAUSA-N	426.344	1.629	50	20	IDGD	
Cc1nn[nH]c1C(=O)N1CC2(CCCN2C(=O)[C@@H](Br)Cc2ccccc2)C1	1845941070	CKUXIJUYALWZQS-HNNXBMFYSA-N	432.322	1.936	50	20	IDGD	
C[C@H](NC(=O)c1ccccc1)C(=O)N1CCCC12CN(C(=O)[C@@H](F)Br)C2	1847063306	QIRXKVVZJMUEPN-GXTWGEPZSA-N	426.286	1.699	50	20	IDGD	
C=CCO[C@@H](C)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CN(C)NC(=O)NCc1ccccc1	1847813498	JLZPDYRMGQQEQJ-IHPCNDPISA-N	443.548	1.126	50	20	IDGD	
COC(=O)CCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1848099637	QRXQAKOJHMEUHW-IHRRRGAJSA-N	431.917	1.274	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H]2Oc3ccccc3O[C@H]2C)c1	14287663	WDRROOQGBDWCPJ-LIRRHRJNSA-N	447.513	1.707	50	20	IDGD	
CCOC(=O)c1cc(C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc([N+](=O)[O-])c1	17191980	VVGBIONYGCUYFX-UHFFFAOYSA-N	439.384	1.093	50	20	IDGD	
O=C(NNC(=O)c1cccnc1)c1ccc(OS(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1	27633558	HBLJCVKLEFTFLV-UHFFFAOYSA-N	442.409	1.832	50	20	IDGD	
CC(=O)N1c2ccc(S(=O)(=O)NNC(=O)c3c(C)nc4ccccn34)cc2C[C@H]1C	28679073	XHHHNASVIRWEPZ-GFCCVEGCSA-N	427.486	1.564	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C[C@@](O)(c2nccn2C)C(F)(F)F)cc1OC	105566972	LQSPZXUJIDBHSV-GOSISDBHSA-N	444.410	1.819	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)CN2C(=O)c3ccccc3N3C(=O)CC[C@]23C)c1	106058450	IUPNZKXMWGPTFY-HSZRJFAPSA-N	436.468	1.520	50	20	IDGD	
NS(=O)(=O)c1ccc(CC(=O)NNC(=O)c2ccc(COc3ccccc3)o2)cc1	110925982	QUZZPDAUBKVTTM-UHFFFAOYSA-N	429.454	1.510	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)NCc1ccc(NC(=O)c2ccco2)cc1	725858394	KALYLGPDWBKCMA-UHFFFAOYSA-N	425.401	1.385	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NCc1ccc(CN2CCCCC2)cc1	725871465	HRFAGPDXPQHKIJ-UHFFFAOYSA-N	429.546	1.994	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=S)N[C@H](C)c2cccs2)cc1	726438470	WVQOBAZRDPBWGP-CYBMUJFWSA-N	426.589	1.934	50	20	IDGD	
C[C@H](C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1)N1C(=O)[C@H]2CCCC[C@H]2C1=O	728210076	QFAUNQHLYFQVJG-JLZZUVOBSA-N	434.518	1.134	50	20	IDGD	
COc1ccc(OC)c([C@@H](O)CNC(=O)NNC(=O)c2cccc(OC(F)F)c2)c1	728598911	QUCGHRRQTSCYMS-HNNXBMFYSA-N	425.388	1.983	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2cccc(C#N)c2)ccc1Br	728853274	AGJWKAWDDZDMLO-UHFFFAOYSA-N	438.259	1.731	50	20	IDGD	
CCN(CC)CCOc1ccc(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1	728889874	GZKZZTUWSCEOEA-UHFFFAOYSA-N	440.548	1.875	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)NCCc1ccc(I)s1	728955163	HAXQEHRQNCVQQG-UHFFFAOYSA-N	430.271	1.863	50	20	IDGD	
Cc1nn(C(C)(C)C)c2nc(C(C)C)cc(C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)c12	729274014	FRXOWCHNMQKWNR-LBPRGKRZSA-N	438.554	1.317	50	20	IDGD	
C[C@H]1CCCN(S(=O)(=O)c2cc(C(=O)NNC(=O)NC3CCCCC3)n(C)c2)C1	730205708	CMWRMULEORRSRL-AWEZNQCLSA-N	425.555	1.722	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)[C@H]2CCCN(S(=O)(=O)Cc3ccccc3)C2)c(O)c1	730590484	NTJVLCFUSIECPC-KRWDZBQOSA-N	431.514	1.704	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2ccc(S(=O)(=O)CCCC#N)cc2)C[C@@H](C)O1	732263402	MAZNRGPEQFJPBL-IYBDPMFKSA-N	436.534	1.024	50	20	IDGD	
Cc1nc(-c2ccccn2)nc(NNC(=O)c2nc(S(C)(=O)=O)n3ccccc23)c1C	734257025	YUDGFVCAKJTUGX-UHFFFAOYSA-N	437.485	1.964	50	20	IDGD	
O=C(Cn1[nH]cc2c(=O)ncnc1-2)NNc1cc(C(F)(F)F)nc(-c2ccccn2)n1	734258815	NDZHVRVWDWZWGE-UHFFFAOYSA-N	431.338	1.085	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2ccc(C(=O)NNc3nccnc3Cl)cc2)C[C@@H](C)O1	734260756	LPXJBSVEGVEFHS-TXEJJXNPSA-N	425.898	1.685	50	20	IDGD	
CN1C(=O)C[C@H](C(=O)NNC(=O)[C@H]2COc3ccccc3O2)[C@@H]1c1cccc(Cl)c1	734387233	NJKOYXLIGUQXCU-YJLNNSPDSA-N	429.860	1.847	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)[C@H]2CS[C@]3(C)CCC(=O)N23)CC1	734826104	XDYRAQJYMBWPBD-BFUOFWGJSA-N	441.554	1.170	50	20	IDGD	
CN(C)C(=O)CNC(=O)NNc1ccc(S(=O)(=O)NC2CCCCCCC2)cn1	735580708	XLAGAZGFKKJGAA-UHFFFAOYSA-N	426.543	1.187	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N2CCS(=O)(=O)[C@@H](C)[C@H]2C)cc1Br	736387426	QALYQTXIKJMNQT-ZJUUUORDSA-N	434.312	1.320	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)NCc1ccc(S(=O)(=O)N2CCCC2)cc1	738450275	HTRXXWQMYLHHTE-UHFFFAOYSA-N	446.529	1.518	50	20	IDGD	
Cc1nc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)c2ccccn12	741207318	RDJSAXOZLCOWDA-UHFFFAOYSA-N	441.513	1.892	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2cc3cccc(F)c3o2)CC1	743417755	BOUMZNGAIIEJIG-UHFFFAOYSA-N	433.465	1.660	50	20	IDGD	
C[C@@H](NC(=O)c1n[nH]c2ccccc12)C(=O)NNC(=O)c1cccc(Br)c1	743730619	BEVZZQRNOIYMOH-SNVBAGLBSA-N	430.262	1.905	50	20	IDGD	
Cc1cccc2c(=O)n(CCC(=O)NNC(=O)Nc3ccc(S(C)(=O)=O)cc3)cnc12	743829273	JOTKFKIJJVUYQQ-UHFFFAOYSA-N	443.485	1.351	50	20	IDGD	
Cn1cc(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)c(C(F)(F)F)n1	744620237	HKANODLXOZAVJJ-UHFFFAOYSA-N	433.412	1.217	50	20	IDGD	
O=C(COC(=O)c1c[nH]cc1-c1ccc(F)cc1)NNC(=O)[C@@H]1COc2ccccc2O1	745268313	BFWPAYIVQJYCBZ-IBGZPJMESA-N	439.399	1.965	50	20	IDGD	
O=C(COC(=O)[C@@H]1C[C@@]12CCCc1ccccc12)NNC(=O)[C@@H]1COc2ccccc2O1	745713157	AVMKBRAMBLXLDP-GERBCZOESA-N	436.464	1.811	50	20	IDGD	
C[C@H]1CCC[C@](CNC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)(N(C)C)C1	745720157	KKTYTJGAOJYQSV-LIRRHRJNSA-N	425.555	1.936	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)N[C@@H](C)c2nc(C(C)(C)C)no2)nc1	745917745	OXEAMXDCHUQZAD-NSHDSACASA-N	425.515	1.836	50	20	IDGD	
Cc1cccc(N2C(=O)N[C@H](CCC(=O)NNC(=O)Cc3cn4ccccc4n3)C2=O)c1	746547956	ACZNVUQKMPYNHJ-QGZVFWFLSA-N	434.456	1.238	50	20	IDGD	
CC(C)(C)OC(=O)N(CC(=O)NNC(=O)Cc1cn2ccccc2n1)C[C@H]1CCCO1	746555658	FMBZNWGSSDJIFL-MRXNPFEDSA-N	431.493	1.440	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2CCCN2C(=O)CC(C)(C)C)c1	748214342	QCPUPSFFXORJOG-INIZCTEOSA-N	438.550	1.125	50	20	IDGD	
CC(=NNC(=O)Cc1csc(N2CCOCC2)n1)c1cnn(-c2ccccn2)c1C	748251850	YJARNQVZYKCNPF-UHFFFAOYSA-N	425.518	1.952	50	20	IDGD	
Cc1c(NNC(=O)CNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cccc1[N+](=O)[O-]	749289261	NPJWBCSRCLMRHA-UHFFFAOYSA-N	435.462	1.027	50	20	IDGD	
Cn1ccnc1[C@](O)(CC(=O)NNc1nc(Br)cn2ccnc12)C(F)(F)F	750248362	MQPSRNAYVWGUIJ-CYBMUJFWSA-N	448.203	1.509	50	20	IDGD	
CC(C)[C@H](C(=O)NNC(=O)CNC(=O)c1cccs1)n1nnc(-c2ccccc2)n1	751206927	WQXXXFAYCAPDAO-MRXNPFEDSA-N	427.490	1.176	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)[C@@H]1CCCN(C(=O)c2ccc3n[nH]cc3c2)C1	751291508	VQPHJGXNDJRGFT-FOIQADDNSA-N	449.467	1.403	50	20	IDGD	
CCOC(=O)[C@@H]1Cc2cc(S(=O)(=O)NNC(=O)c3c(C)nc4ccccn34)ccc2O1	751538863	QGIDLQDYXUTOTO-INIZCTEOSA-N	444.469	1.133	50	20	IDGD	
CC(C)(C)OC(=O)Nc1ccccc1CC(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1	755646589	WYXWXRLBWIJDGM-CYBMUJFWSA-N	426.495	1.094	50	20	IDGD	
C[C@H]1C[C@@H](C)CN(C(=O)c2ccccc2NC(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)C1	755669442	ZVTKZSSBCBNGIZ-QLFBSQMISA-N	436.534	1.392	50	20	IDGD	
CN1C(=O)COc2ccc(NC(=O)NNC(=O)c3cc(Br)ccc3O)cc21	756829420	INJABPJPZVCPBQ-UHFFFAOYSA-N	435.234	1.976	50	20	IDGD	
C[C@H]1CN(C(=O)Cn2cc(NC(=O)NNC(=O)c3cccc(N(C)C)c3)cn2)C[C@@H](C)O1	756840500	VPXIDEFBAZQQME-GASCZTMLSA-N	443.508	1.051	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)Nc1ccccc1OCC(=O)N1CCOCC1	756873768	JYTWUAQBEZJROU-UHFFFAOYSA-N	442.472	1.415	50	20	IDGD	
C[C@@H]1C[C@@H](NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)CN1Cc1ccccc1	757737613	DZAGIHURDHVPIZ-YLJYHZDGSA-N	437.548	1.686	50	20	IDGD	
COCc1nc2n(n1)C[C@@H](NC(=O)NNC(=O)c1cc(C)n(-c3ccccc3)c1C)CC2	757777338	PVKIIOYIYNQMPB-INIZCTEOSA-N	437.504	1.791	50	20	IDGD	
O=C(Nc1ccc(CC(=O)N2CCN(S(=O)(=O)CBr)CC2)cc1)C1CC1	758517485	MECYXFCVGVXGJQ-UHFFFAOYSA-N	444.351	1.404	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1ccccc1	758693695	WSCYOPOYHHTNQF-QGZVFWFLSA-N	434.474	1.893	50	20	IDGD	
COc1cc(N2CCN(CC(=O)NNC(=O)c3ccc(C)cc3)CC2)cc(OC)c1OC	759873178	RMUQCRUSGIWWTO-UHFFFAOYSA-N	442.516	1.604	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)Nc1ccc(CN2C(=O)CCCC2=O)cc1	760960986	ZRLVDRDLSKRTMF-UHFFFAOYSA-N	448.443	1.168	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)NC[C@H](O)COc2ccc3c(c2)CCC(=O)N3)cc(C#N)n1C	762368081	IBUSRZMKDVEAQR-CLRKVHHDSA-N	433.468	1.553	50	20	IDGD	
O=C(NNc1nccc(N2CCOCC2)n1)[C@H]1CCCN(c2ncnc3sccc23)C1	762852504	NMIKMUPTFBDFIW-AWEZNQCLSA-N	440.533	1.678	50	20	IDGD	
CC(=O)N(Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1)C1CC1	763443259	YZEZJANRMQERRQ-UHFFFAOYSA-N	439.428	1.505	50	20	IDGD	
C#CCOc1ccc(F)cc1NC(=O)C(=O)NNC(=O)c1cc(OC)c(OC)c(OC)c1	763540120	RGGRCUOBMFSRHZ-UHFFFAOYSA-N	445.403	1.263	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(OC2CCC2)c(F)c1	763647167	OETXMGLLGQMMAI-UHFFFAOYSA-N	431.420	1.931	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(OC(F)(F)F)c2)cc1	763660707	FVVZNHXKYORJNU-UHFFFAOYSA-N	427.335	1.759	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(Cl)c(OC(F)F)c2)cc1	763678135	DIYADDXALHIBNM-UHFFFAOYSA-N	438.774	1.978	50	20	IDGD	
CC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])cc1Cl	763803270	GAGLFEGIZGVGPU-UHFFFAOYSA-N	449.807	1.372	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)cnn1-c1ccccc1F	763806509	DUPUFPWWWZJTTO-UHFFFAOYSA-N	436.403	1.356	50	20	IDGD	
CCc1noc(-c2ccc(C)c(NC(=O)C(=O)NNC(=O)COc3ccc(F)cc3)c2)n1	763840112	IQZKPFDGZWJKRX-UHFFFAOYSA-N	441.419	1.911	50	20	IDGD	
COC(=O)c1c(NC(=O)C(=O)NNC(=O)Cn2nc(C)cc2C)sc2c1CCCCC2	763893700	XUVVOFZURPUDDF-UHFFFAOYSA-N	447.517	1.403	50	20	IDGD	
O=C(CCSc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccc2c(c1)NC(=O)CC2	763896011	WHOZWTDVLQXTBL-UHFFFAOYSA-N	430.461	1.979	50	20	IDGD	
C[S@](=O)Cc1cc(NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)ccc1Cl	763977255	LMRJLYSLUUFHIT-NDEPHWFRSA-N	444.296	1.977	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1ccc(C(=O)N(C)OC)cc1	764011367	GJMAMMVGBBVCJO-UHFFFAOYSA-N	434.836	1.382	50	20	IDGD	
O=C(Cc1ccsc1)NNC(=O)C(=O)Nc1ccc(OCC(F)(F)C(F)F)nc1	764033520	HHODXNLAENGLSA-UHFFFAOYSA-N	434.371	1.751	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1cc(Cl)ccc1C(=O)N1CCCC1	764043937	ZJJHWOUTVKIRAT-UHFFFAOYSA-N	444.875	1.984	50	20	IDGD	
CCCCCn1nc(C)cc1NC(=O)C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	764078563	WJGIDKQHPAZYBK-UHFFFAOYSA-N	435.506	1.185	50	20	IDGD	
COc1cc(Br)c(NC(=O)C(=O)NNC(=O)c2cccc(C#N)c2)cc1OC	764241802	JIIHRDAJZXYAFH-UHFFFAOYSA-N	447.245	1.738	50	20	IDGD	
Cc1cc(Br)ncc1NC(=O)C(=O)NNC(=O)Cn1ccc2ccccc21	764246255	ZOSKRMLRVDUKGF-UHFFFAOYSA-N	430.262	1.893	50	20	IDGD	
CC(C)(C)OC(=O)N1CCc2cc(NC(=O)C(=O)NNC(=O)Cc3ccccn3)ccc21	764265117	ZHKAJDCYNNDGBI-UHFFFAOYSA-N	439.472	1.708	50	20	IDGD	
Cc1nc(COc2ccc(NC(=O)C(=O)NNC(=O)c3ccc(O)c(Cl)c3)cc2)no1	764349059	DQRRHSRCQHRZQG-UHFFFAOYSA-N	445.819	1.716	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc(C)c(F)c3)n[nH]2)cc1OC	764378733	NAFXMGQRNULBPZ-UHFFFAOYSA-N	441.419	1.941	50	20	IDGD	
O=C(CSc1nnc(-c2ccncc2)n1Cc1ccco1)NNC(=O)c1cccnc1	764465064	WCDXIZNMAXXOLW-UHFFFAOYSA-N	435.469	1.930	50	20	IDGD	
O=C(NNC(=O)[C@H](O)c1cc(Cl)cc(Cl)c1)c1csc(N2CCOCC2)n1	764604618	NCAYEYQRVOEWAU-CYBMUJFWSA-N	431.301	1.781	50	20	IDGD	
Cc1cc(I)cc(C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)c1C	764616719	QXHAWPUSBLGFQX-JTQLQIEISA-N	436.271	1.104	50	20	IDGD	
O=C(CCNS(=O)(=O)/C=C\c1ccccc1)NNC(=O)c1cc(-c2cccs2)[nH]n1	765569419	IODNHOINSQUUQL-XFXZXTDPSA-N	445.526	1.880	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(NC(=O)C(=O)NNc2cnccn2)ccc1Cl	766259826	BNSYASQXCDWZIS-UHFFFAOYSA-N	426.886	1.242	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1cc([N+](=O)[O-])c(C)cc1Br	766264642	NKELQMYHZQRLPA-UHFFFAOYSA-N	425.199	1.546	50	20	IDGD	
C[C@@H]1CN(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)[C@H](C)CN1Cc1ccccc1	766517497	GVUHHLBIIRKWDD-IAGOWNOFSA-N	434.504	1.612	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)C[C@@H](C)n3nc(C)cc3C)CC2)cc1	766650973	YEGBELYPJFLAPD-HXUWFJFHSA-N	426.565	1.725	50	20	IDGD	
COc1ccc(S(=O)(=O)NCCC(=O)NNc2ncnc3ccsc23)cc1OC	766676573	QBZREVNXZKGRAL-UHFFFAOYSA-N	437.503	1.520	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1ccc(Sc2ccc([N+](=O)[O-])cc2)cc1	767820512	SSWRKQYOHFDPDJ-CYBMUJFWSA-N	435.483	1.942	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3cccc(-c4nc[nH]n4)c3)cc2)CC1	767846109	FSWDLUZZBNOABD-UHFFFAOYSA-N	441.517	1.165	50	20	IDGD	
Cc1nnc(NNC(=O)CSc2nnc(-c3ccco3)n2Cc2ccco2)nc1O	767851400	JXIGIAABUFXIRP-UHFFFAOYSA-N	428.434	1.614	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)[C@H]2CC[C@H](C(F)(F)F)NC2=O)n[nH]1	768275393	BBCUSTOABVOUCY-IINYFYTJSA-N	425.367	1.303	50	20	IDGD	
CC(C)c1[nH]nc(C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)c1Br	768632088	BCKJKVNISUKVKY-UHFFFAOYSA-N	434.250	1.785	50	20	IDGD	
CN(C)C(=O)COc1ccc(C(F)(F)C(=O)NNC(=O)Cc2cn3ccccc3n2)cc1	769472886	FUKJAPVCZSATRO-UHFFFAOYSA-N	445.426	1.283	50	20	IDGD	
C[C@@H](NC(=S)NNC(=O)CN1C(=O)N[C@@](C)(c2ccc(F)c(Cl)c2)C1=O)C1CC1	770247416	WTJSYIXUFUUHIW-LZVRBXCZSA-N	441.916	1.540	50	20	IDGD	
CCN1CCN(c2cccc(NC(=O)C(=O)NNc3cccc(S(C)(=O)=O)c3)c2)CC1	770764220	JQOPJIZIWBCHNL-UHFFFAOYSA-N	445.545	1.314	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)c2ncccc12	770771727	NSANDCLJVFKKQB-UHFFFAOYSA-N	432.234	1.734	50	20	IDGD	
CS(=O)(=O)N1CCc2c(NC(=O)C(=O)NNc3c(F)cccc3Cl)cccc21	770808967	WPXLNSKQNQYDKQ-UHFFFAOYSA-N	426.857	1.883	50	20	IDGD	
COc1cc(OC)cc(N2C[C@H](C(=O)O[C@@H](C)C(=O)NNC(=O)CC(C)C)CC2=O)c1	772180187	AKEINRBFSLIBMT-UONOGXRCSA-N	435.477	1.182	50	20	IDGD	
Cc1ccc(-n2[nH]c(C(=O)NNC(=O)C(=O)NCc3ccc(Cl)cc3)cc2=O)cc1	772897421	HZVHTCGDROVZPH-UHFFFAOYSA-N	427.848	1.205	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)c1cc(C(N)=O)n(-c2ccccc2)n1	772963348	IWLKRGDEECCUIX-GFCCVEGCSA-N	427.848	1.853	50	20	IDGD	
N#Cc1ccc(NNC(=O)C(=O)Nc2ccc3c(ccn3CCN3CCOCC3)c2)cc1	773701524	UGOCMJKYSWTXEF-UHFFFAOYSA-N	432.484	1.927	50	20	IDGD	
O=C(NNc1c(F)cccc1F)C(=O)Nc1cc(N2CCCS2(=O)=O)ccc1F	773705853	JIDVISKDSTZBPD-UHFFFAOYSA-N	428.392	1.726	50	20	IDGD	
CCn1c(NNC(=O)C2=NN(c3ccc(F)cc3)C(=O)CC2=O)nc2ccccc2c1=O	773753429	KOVHFJZZXWOHAM-UHFFFAOYSA-N	436.403	1.361	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)N[C@H]2CCO[C@]3(CCS(=O)(=O)C3)C2)c(Cl)c1	776076579	NFBGIYDVVWBHJN-YVEFUNNKSA-N	430.914	1.720	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)[C@@H]1CC(=O)N(C2CC2)[C@@H]1c1cccc(OC)c1	776707756	UNDIFDCSUIBNMZ-IEBWSBKVSA-N	430.505	1.199	50	20	IDGD	
COCCO[C@@H]1COCC[C@H]1NC(=O)NNC(=O)c1sc(-c2ccccc2)nc1C	776845945	IWMSHVXVJYBWME-HZPDHXFCSA-N	434.518	1.883	50	20	IDGD	
COCCO[C@H]1COCC[C@@H]1NC(=O)NNC(=O)c1ccc(OC(C)C)c(OC)c1	776935540	CRDKIFBMERGBEX-YJBOKZPZSA-N	425.482	1.247	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Cc2ccccc2CC#N)c1	776964909	SMYQCJXNZAFYJD-UHFFFAOYSA-N	428.514	1.787	50	20	IDGD	
COc1cccc2[nH]cc(CC(=O)NNC(=O)CN3CCN(C(=O)c4ccccc4)CC3)c12	778689119	PIXUEURWCUQHDB-UHFFFAOYSA-N	449.511	1.324	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2Br)nn1CCC#N	778754013	UIPBHGLVVFADIZ-UHFFFAOYSA-N	436.226	1.858	50	20	IDGD	
O=C(Cn1nc2ccccn2c1=O)NNc1cc(C(F)(F)F)nc(-c2cccnc2)n1	779205902	XQSFXUNBVAJCID-UHFFFAOYSA-N	430.350	1.510	50	20	IDGD	
O=C(NCc1ccccc1CN1CC[C@H](O)C1)NNC(=O)c1cc(Br)c[nH]1	781779393	AJOVJQQUMKFAOS-HNNXBMFYSA-N	436.310	1.488	50	20	IDGD	
COCCOC(=O)c1c(NC(=O)C(=O)NNc2ccccc2C)sc(C(N)=O)c1C	783326083	WSYSCBXDOIUAOU-UHFFFAOYSA-N	434.474	1.349	50	20	IDGD	
COc1cc(Oc2ccccc2)ccc1NC(=O)C(=O)NN[C@]1(C)CCS(=O)(=O)C1	783427841	QKRYOENENKQCDF-HXUWFJFHSA-N	433.486	1.624	50	20	IDGD	
Cc1nn([C@H]2CCS(=O)(=O)C2)c(C)c1NC(=O)C(=O)NNc1cccc2c1CCCC2	783450695	PYSLHRNBJQOZAF-INIZCTEOSA-N	445.545	1.820	50	20	IDGD	
O=C(CCOc1cccc(I)c1)NNC(=O)Cc1ccncc1	783967494	ZQTMETDUTWJHJE-UHFFFAOYSA-N	425.226	1.845	50	20	IDGD	
CC(C)Oc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)C(=O)NNc1ccnc(F)c1	784847219	UKWJDHQRLYCMDP-UHFFFAOYSA-N	439.469	1.340	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)n([C@@H]2C[C@H]3CC[C@H]2C3)n1	785068657	ZJCVNEXRZLCLQL-YQQAZPJKSA-N	435.488	1.529	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H]2CCCN(C3CCCCC3)C2=O)c1	785923015	JREWNJJRNPPRFG-KRWDZBQOSA-N	436.534	1.358	50	20	IDGD	
C[C@H]1[C@@H](C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)CCN1C(=O)OC(C)(C)C	786251498	WRIDASWWDKIGKS-STQMWFEESA-N	429.518	1.487	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)CCOc1cccc(I)c1	787247726	LGAYQWAOUJMQAV-SNVBAGLBSA-N	434.230	1.549	50	20	IDGD	
CCOc1cc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)ccc1OC	789812317	KVNJGKPSGSNITQ-LPHOPBHVSA-N	427.457	1.753	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)CCNS(=O)(=O)c1ccc2c(c1)CCCC2	790062796	AAJNLLJGBYTFRH-UHFFFAOYSA-N	441.550	1.170	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)CCNC(=O)c1cc(F)ccc1Br	790062820	AMOLRSUAPFRNNX-UHFFFAOYSA-N	448.289	1.645	50	20	IDGD	
CCS(=O)(=O)c1ccc([C@@H](C)NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1	790655265	GYFZHCYWBMXFPD-CYBMUJFWSA-N	443.489	1.161	50	20	IDGD	
Cc1ccn(C[C@@](C)(O)C(=O)NNc2ccc([N+](=O)[O-])cc2Br)c(=O)c1	790947011	XICUHFIKQFSWNL-MRXNPFEDSA-N	425.239	1.722	50	20	IDGD	
O=C(COC(=O)c1nc(Br)cs1)NNC(=O)c1ccc([N+](=O)[O-])cc1	791476708	WMGDLPJONVAYJT-UHFFFAOYSA-N	429.208	1.432	50	20	IDGD	
Cc1cccnc1NNC(=O)C(=O)Nc1ccc(S(=O)(=O)N2CCC(C)CC2)cc1	792375665	KSIXQPDSWWYPFV-UHFFFAOYSA-N	431.518	1.892	50	20	IDGD	
Cc1nc(O)c(C#N)c(C)c1CCC(=O)NNC(=O)CNC(=O)OCc1ccccc1	794063867	MYBYBYJLVGDXCE-UHFFFAOYSA-N	425.445	1.282	50	20	IDGD	
Cc1c(C(=O)NNc2ccccc2S(=O)(=O)N(C)C)nnn1Cc1ccc(F)cc1	795169309	MMODOWRFQSQNHW-UHFFFAOYSA-N	432.481	1.781	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)CCC(=O)c1ccc2c(c1)CCC(=O)N2	795169565	QMTSCNJHZQXMPA-UHFFFAOYSA-N	444.513	1.928	50	20	IDGD	
COc1cc2c(cc1S(=O)(=O)NNC(=O)c1cccc3ncccc13)OCC(=O)N2	797430361	CFQHCJBHBZTERS-UHFFFAOYSA-N	428.426	1.198	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)Nc2cc(S(=O)(=O)N3CCCC3)ccn2)c1	797673383	CHGVWUFOFUZWLB-UHFFFAOYSA-N	449.489	1.350	50	20	IDGD	
Cn1c(=NNC(=O)Cn2c(CS(C)(=O)=O)nc3ccccc32)sc2ccccc21	798304140	OZVVOJVYMZHGDI-UHFFFAOYSA-N	429.527	1.766	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H](CCS(C)(=O)=O)c2ccccc2)cc1C	798308857	CDCGWXVJJMFLSC-GOSISDBHSA-N	431.514	1.608	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)NCCC(=O)NS(C)(=O)=O)c(C)n1-c1ccccc1F	800552166	LQFWFWYWKLPNMJ-LFIBNONCSA-N	432.477	1.722	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)Nc2cc3c(cc2N2CCCCC2)n(C)c(=O)n3C)n[nH]1	800592667	XAXGMGZYIBHXIE-UHFFFAOYSA-N	426.481	1.365	50	20	IDGD	
COc1ccc(CC(=O)NCc2ccc(C(=O)NNC(=O)N=c3cc[nH]cc3)cc2)cc1	802028355	TXLIJAMNAUNBHG-UHFFFAOYSA-N	433.468	1.838	50	20	IDGD	
COc1cccc(/C=C(/C(=O)NNC(=O)Nc2ccc3c(c2)OCO3)n2nnnc2C)c1	802098129	YXWBBFBQBKDUDW-SXGWCWSVSA-N	437.416	1.570	50	20	IDGD	
COc1cc(OC)cc(N2C[C@@H](C(=O)NNC(=O)Nc3ccc4c(c3)OCO4)CC2=O)c1	802102222	IBNHQIUEMDKRPX-LBPRGKRZSA-N	442.428	1.638	50	20	IDGD	
Cc1ccc(C2=NO[C@H](CNC(=O)NNC(=O)CNC(=O)c3cccs3)C2)cc1C	802378966	FURUSMYFLDEOFV-HNNXBMFYSA-N	429.502	1.618	50	20	IDGD	
O=C(NNc1ccc2c(=O)[nH]ccc2c1)c1cc(S(=O)(=O)N2CCSCC2)c[nH]1	803438927	LIAIHWQMBJRUSN-UHFFFAOYSA-N	433.515	1.351	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)c1ccc(Br)cc1-n1cncn1	804952233	HYLSBJJWKZDAPR-UHFFFAOYSA-N	426.238	1.762	50	20	IDGD	
COCCOc1ccc(S(C)(=O)=O)cc1NC(=O)C(=O)NNc1ccc(F)cc1	806967328	BYVSSDUKCOTCCR-UHFFFAOYSA-N	425.438	1.336	50	20	IDGD	
COc1cc(C(=O)NN=C2C(=O)N(CCN(C)C)c3ccccc32)cc(OC)c1OC	807945057	BAZOYWCHSIECMK-UHFFFAOYSA-N	426.473	1.755	50	20	IDGD	
CC(=O)c1cccc(S(=O)(=O)NCC(=O)NNc2ccc([N+](=O)[O-])cc2Cl)c1	810686286	CARCEWZSHKCWBU-UHFFFAOYSA-N	426.838	1.872	50	20	IDGD	
O=C(Cc1cc(O)nc(S)n1)NN=Cc1cn(-c2ccccc2Br)nn1	811636744	LWGBBLDEGRKQKU-UHFFFAOYSA-N	434.279	1.507	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(=NNC(=O)[C@@H]2CCS(=O)(=O)C2)[C@H]([C@@H]2CCOC2)C1	812224138	BTXIPAWXMBOPDE-KFWWJZLASA-N	429.539	1.187	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)cc2cccnc12	815568124	VXGQBCAZNMVBHO-UHFFFAOYSA-N	432.234	1.734	50	20	IDGD	
CC(C)OCCCn1c(NNC(=O)[C@H]2CCc3nncn3C2)nc2ccccc2c1=O	815604218	HTQXFWPHSQDQPD-HNNXBMFYSA-N	425.493	1.509	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2nc(F)ccc2Br)c2ccccc2c1=O	816805682	FEPNHEKOKTWYNN-UHFFFAOYSA-N	434.225	1.788	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)[C@@H]2CCCS(=O)(=O)C2)c2ccccc2c1=O	816828306	ABDXWZZLXNNSJT-CQSZACIVSA-N	434.518	1.173	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)CSc1nnnn1C1CCCC1	817053204	IHINIBBMVKYECY-UHFFFAOYSA-N	425.540	1.274	50	20	IDGD	
O=C(NNC(=O)c1sccc1S(=O)(=O)N1CCOCC1)c1cc(Cl)ccc1O	818561827	BQWPEMZNPUGIFJ-UHFFFAOYSA-N	445.906	1.203	50	20	IDGD	
CCn1c(NNC(=O)c2cccc(S(=O)(=O)N(C)OC)c2)nc2ccccc2c1=O	823904369	COBVVTPNVGTGDW-UHFFFAOYSA-N	431.474	1.355	50	20	IDGD	
COCCCNC(=S)N(C)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccc(C)s1	899890020	DBULLNZJWHBIJE-CYBMUJFWSA-N	434.609	1.084	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)c2cccc(OCc3cccnc3)c2)c2ccccc2c1=O	916123920	ULLHSNOYRULMCZ-UHFFFAOYSA-N	429.436	1.982	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)NCC2(NS(C)(=O)=O)CCCCC2)c2ccccc2n1	916253853	PEXVTKSPZQLRGS-UHFFFAOYSA-N	433.534	1.739	50	20	IDGD	
O=C(NNC(=O)c1cn2cccnc2n1)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	916739772	UVOIEZKQYYGDIH-UHFFFAOYSA-N	439.439	1.506	50	20	IDGD	
CCCCS(=O)(=O)N1CCC[C@H]1C(=O)NNC(=O)[C@@H](C)Oc1cccc(C)c1C	918690697	ONLPLWTVRDCGHK-SJORKVTESA-N	425.551	1.812	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)cc1OC	919214473	RXZSHTCUOQFYCS-UHFFFAOYSA-N	443.368	1.976	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)NCCNC(=O)c2ccc(F)cc2)cc1	919916435	KJSBVFGQMGJCNI-CQSZACIVSA-N	432.452	1.752	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2cc(OC)ccc2[N+](=O)[O-])c2ccccc2c1=O	920276050	YGPXYBQXCYJVSV-UHFFFAOYSA-N	425.401	1.798	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)Nc1cccc(CN2CCC[C@@H]2C(N)=O)c1	920930345	HGXAYZDZLCJNEZ-QGZVFWFLSA-N	441.488	1.377	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)Nc2ccc(CN3C(=O)CNC3=O)cc2)cc1OC	920932053	SHJVVBKRPKDCHT-UHFFFAOYSA-N	441.444	1.612	50	20	IDGD	
CN1CCN(c2ccc(C=NNC(=O)c3csc(N4CCOCC4)n3)cc2F)CC1	1115862059	HAHVJURKSBGUHI-UHFFFAOYSA-N	432.525	1.635	50	20	IDGD	
N#Cc1ccc(N2C(=O)N[C@H](CCC(=O)NNC(=O)c3ccccc3Cl)C2=O)cc1	1116061005	SMZAERUCQAUSAJ-MRXNPFEDSA-N	425.832	1.878	50	20	IDGD	
COC(=O)C[C@H](NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)c1ccc(C)cc1	1318286457	KBGMTQFTIPDLDZ-SFHVURJKSA-N	440.504	1.636	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@H]2CCCN(S(=O)(=O)Cc3ccccc3)C2)cc1	1318318366	LUYTUQLHNREUCA-SFHVURJKSA-N	431.514	1.698	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2c(F)cc(F)cc2OC)cc(OC)c1OC	1318597528	VCKGSRKNNPVKJX-UHFFFAOYSA-N	432.401	1.623	50	20	IDGD	
O=C(NNC(=O)N[C@@H]1CCO[C@@]2(CCS(=O)(=O)C2)C1)Nc1ccc(OC(F)F)cc1	1319952178	YXBVCMIVWPQZLG-PXAZEXFGSA-N	448.448	1.360	50	20	IDGD	
CC(=O)NC[C@H]1CCn2ncc(C(=O)NNc3nc(-c4ccccn4)nc(C)c3C)c2C1	1326308705	WFSSKDJHDSKDJP-INIZCTEOSA-N	434.504	1.807	50	20	IDGD	
O=C(c1ccc2nccnc2c1)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1777978827	CUFLRIVMENDLDZ-MAUKXSAKSA-N	437.269	1.764	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3coc([Si](C)(C)C)c3)C2)C1	1778999376	AILGSZPDFSPECX-KXBFYZLASA-N	428.989	1.522	50	20	IDGD	
C[C@H](C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCBr)C2)N1C[C@H]2C[C@@H]2C1	1779246187	GDRQMHNYHOQIEX-FLXNRXMOSA-N	442.398	1.626	50	20	IDGD	
C#CC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc([N+](=O)[O-])ccc2OC(C)=O)C1	1780055162	INLVLXMOPVTMLQ-WIYYLYMNSA-N	429.429	1.281	50	20	IDGD	
Cc1nn(C)c(C)c1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Br)C1	1780770503	QQQPMSXYFAFWRE-DDUZABMNSA-N	445.333	1.855	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2)c1ccnc2c(O)cccc12	1781405361	HXEYYTIDYKCUMQ-JBYIUTFZSA-N	447.919	1.668	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnc(Cl)nc1)C2	1782168775	URRIJWRYGGKKEA-HBUWYVDXSA-N	431.320	1.511	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CN1CCC(C)CC1)C2	1782172001	JNHYSGQOHMJUGB-DBXWQHBBSA-N	429.989	1.486	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)Cc3cc(Cl)ccc3OC)C2)C1	1782978137	CSJQYBPUNSCYLP-UZLBHIALSA-N	445.343	1.975	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cc4ccccn4n3)CCO2)C1	1783348045	SRLCIGKVZOOGGE-HNAYVOBHSA-N	435.322	1.951	50	20	IDGD	
COC(=O)Nc1cccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]3C2)c1	1784093452	ZNALMAOMALMDRQ-HJWJTTGWSA-N	439.896	1.058	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H]3CCc4nc[nH]c4C3)C2)C1	1784353080	WTAIHMGWPCWPDN-ZNZDAUKMSA-N	429.348	1.581	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)[C@@H]3SC(=N)NC3=O)C[C@@H]21	1784618733	QZQOZLUVTIKWPW-XZBVAUNFSA-N	444.985	1.176	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)COc3ccc(F)cc3)[C@H]2C1	1786492188	MTGGPRDHPZKMKN-MGHWNKPDSA-N	428.888	1.438	50	20	IDGD	
CC[C@H]1CC[C@H](C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)CC1	1786983976	XVUXRXXZDCXYND-ITJSPEIASA-N	442.365	1.176	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccn(CCOC)n3)[C@H]2C1	1787635091	HEOIVDRROCWXBU-OVWQWFNUSA-N	426.945	1.530	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4nonc4c3)C[C@@H]21	1788762686	LPZXAGGEANYIGF-MPGHIAIKSA-N	432.553	1.668	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(C(C)(C)C)n[nH]3)[C@H]2C1	1788915754	XKLXBOCLACELFH-AYDFFVQHSA-N	426.945	1.554	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cncc(S(C)(=O)=O)c3)C[C@@H]21	1789858816	QSDVPUTXQRPPIO-STECZYCISA-N	443.953	1.096	50	20	IDGD	
CC[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]2C1)N(CC)CC	1789921809	XPCJOPHHIRZOGP-ARKGTOAJSA-N	436.366	1.777	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)c1ccccc1N1CCCCC1	1790254927	PJVQXROAUVVPOY-GIUOSPMZSA-N	449.979	1.870	50	20	IDGD	
CC(C)[C@H](O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C(C#N)=C/c3ccc(F)cc3F)[C@H]2C1	1790693549	JCPNINMMDVRSHY-OQTPAQLSSA-N	447.482	1.868	50	20	IDGD	
Cc1nccn1CCCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21	1791570159	ZVYJWGDIAFMGCS-ULQDDVLXSA-N	441.370	1.736	50	20	IDGD	
CCN1CCC(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)Br)C[C@@H]32)CC1	1792297296	UXTSFVQCBQQGLG-HJWJTTGWSA-N	430.387	1.481	50	20	IDGD	
CC(C)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccccc1-n1nccn1)C2	1792784867	YEKMDNKNIDHJJY-JLVBRIDZSA-N	431.924	1.736	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1=CCCC1)C2	1793880838	HZTVLEWQTXAWNS-YVSFHVDLSA-N	441.956	1.818	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cncc(N(C)C)c1	1794296329	DLXDNIAMOOGETM-YALNPMBYSA-N	439.354	1.524	50	20	IDGD	
COc1ncc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)Br)C3)cc1C	1794985119	GSGFOPITYYLPAN-MHEUCROKSA-N	426.311	1.385	50	20	IDGD	
Cc1cccc2[nH]c(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3cccc(B(O)O)c3)cc12	1796191516	SMROHAVKZKRHDH-REPLKXPHSA-N	431.301	1.722	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ncc(Cl)cn1)C2	1796889814	JWPIMYUAWZSPMN-FTORJNITSA-N	443.895	1.516	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@](C)(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Cl)C3)C1	1797181399	YYZCZJPDGBSQKO-MTCCJSQRSA-N	447.935	1.758	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1CN(Cc2ccccc2)CCO1	1797853290	CDLLCIOCPUUZNF-FDKIHUSFSA-N	449.979	1.779	50	20	IDGD	
CC1=NN(c2ccc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)[C@@H](O)CCl)C4)cc2)C(=O)C1	1799728090	ACBZHBVKNUJIOD-RANZSIQMSA-N	432.908	1.651	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2)c1nc2cc([N+](=O)[O-])ccc2[nH]1	1799878394	YGPPCGLAWGJUBO-YFKFIEJBSA-N	442.259	1.478	50	20	IDGD	
CN1CCN(C2(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)[C@@](C)(Cl)CCl)C4)CC2)CC1	1799978135	NJEKKBSYPCUQSC-RCJHGTSTSA-N	431.408	1.641	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)c1cnc2cccc(Cl)c2c1	1800090644	YJKHPKVAUQGKCM-GGNLRSJOSA-N	438.311	1.691	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1ccc(F)c(C#N)c1	1800136553	ASYFGEMBXZAVIO-BCDXTJNWSA-N	429.496	1.251	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnn3ncccc13)C2	1800639830	OIHDJLNAQNAMEM-FAXLKDOZSA-N	436.310	1.106	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@]1(F)CCCCC1(F)F)C2	1800978071	LDKZAPDVQIDCOF-IQNXINDISA-N	426.863	1.747	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc([N+](=O)[O-])c(O)cc1C)C2	1800979682	UPKACEKJWTYRTR-DMVWFOPNSA-N	441.868	1.066	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1c[nH]c3ncccc13)C2	1800983259	UNQXRNYESRFKKJ-HIRMHNASSA-N	434.924	1.339	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1cnc(C)s1	1802916491	XSECWLZEQIXDAY-XMOXNHLCSA-N	442.545	1.766	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)Cc2cc(C)n(C)n2)[C@@H]1c1cccnc1	1803293108	UCSGSVZEIWCEGO-QRFRQXIXSA-N	433.940	1.626	50	20	IDGD	
Cc1ccc(C(=O)NC[C@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)o1	1803788772	KXIOESNZFGGRGP-DYESRHJHSA-N	427.505	1.676	50	20	IDGD	
Cc1cc(F)ccc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnccc1C(=O)NN)C2	1803927876	MRAKWNUSHPVGAE-MUJYYYPQSA-N	425.464	1.698	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CCc2ccc[nH]2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807366262	YDXVOWUTSJGUKR-CVDCTZTESA-N	446.316	1.042	50	20	IDGD	
C#CCCCCC(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1807366886	HXVAGOMHHOSIDM-OFNKIYASSA-N	433.317	1.275	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)C2CC3(CCC3)C2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1	1807373292	APVBGBWEFLIGJG-KNQAVFIVSA-N	447.344	1.661	50	20	IDGD	
Cc1[nH]ccc1C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1808750001	MMYLLYDCJUVNQO-RXVVDRJESA-N	432.289	1.031	50	20	IDGD	
CC(C)CNC(=O)C(=O)N1CC[C@H](CNC(=O)CO[Si](C)(C)C)[C@@H]1c1cccnc1	1810542760	XXQOKQUNYNOHBB-MJGOQNOKSA-N	434.613	1.711	50	20	IDGD	
CS(=O)(=O)c1cncc(C(=O)N2CCC3(CCCN(C(=O)[C@@H](F)Cl)C3)CC2)c1	1810899529	QOWAKWHMYBPTSE-OAHLLOKOSA-N	431.917	1.864	50	20	IDGD	
CC(=O)NCCC(=O)NC[C@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1	1812656594	QJDFYIUAJKTXKJ-QAPCUYQASA-N	425.327	1.399	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2cn(C)nc2OC)[C@H]1c1cccnc1	1813029425	LRCRGBHKIRIULC-PVAVHDDUSA-N	435.912	1.397	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(F)n2)[nH]n1)c1ccc(B(O)O)cc1	1817472126	JXLJMYNQSUKSEI-KRWDZBQOSA-N	437.240	1.243	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)C2(C#N)CC2)[nH]n1	1818111866	MESWCWGXKQABBS-WJNWYLSZSA-N	436.476	1.840	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)CCl)CC2)c1n[nH]c2ccc(F)cc12	1819205592	DYYBIDPDRIJGLC-RNCFNFMXSA-N	437.884	1.984	50	20	IDGD	
Cc1n[nH]c(C)c1CC(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1	1820995802	OZIOLWGVOWOSFL-KRWDZBQOSA-N	444.540	1.357	50	20	IDGD	
Cn1ccc(=O)cc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](F)Br)CC2	1821314022	PSTJOBWFKTXGQG-AMIZOPFISA-N	443.298	1.758	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1	1823356631	UWHSKELNYWHGRZ-KBPBESRZSA-N	443.932	1.916	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](C)NC(C)=O)sc2C1	1825226676	LHZKHDWRWYAHEL-IEBDPFPHSA-N	431.356	1.753	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](Cl)COC)sc2C1	1826004378	HZNVPEGRBPWDTH-MXWKQRLJSA-N	433.914	1.871	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)N[C@H]1CCc2nc(NC(=O)C(Cl)Cl)sc2C1	1826093210	HPDMACSIYYZCJA-JTQLQIEISA-N	442.328	1.684	50	20	IDGD	
O=C(CC[C@H]1CCOC1)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827060025	MIPHALPTUCJEEY-PGRDOPGGSA-N	442.365	1.416	50	20	IDGD	
C#CC(=O)N1CC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCN2C(=O)OCc1ccccc1	1829359774	FRULLLSAEQVESR-HXUWFJFHSA-N	438.311	1.875	50	20	IDGD	
Cc1c(Cl)cccc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1	1830130918	PBVZYWWHFFHWJR-VQIMIIECSA-N	431.316	1.318	50	20	IDGD	
Cc1nc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)cs1	1830538093	VRNLKLPWFJCBQN-SJKOYZFVSA-N	446.367	1.553	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cccs3)C2)C1	1830538343	CFKWQLVTEQCLSH-KBXCAEBGSA-N	445.379	1.778	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@H](O)N2CCOCC2)CC1	1831654886	IFEUSCGKRYNDCL-QOKNQOGYSA-N	446.386	1.040	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cn(C)nc2OC)CC1	1831828740	TYQREBJRUZDYJZ-IAGOWNOFSA-N	426.945	1.916	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H](N)Cc2cccnc2)CC1	1831831747	AOWSLVIONVNAHQ-HSALFYBXSA-N	436.984	1.825	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H]2C[C@@]2(F)Cl)CC1	1831875577	ZHOJRYJQPKNLKR-QINHECLXSA-N	430.952	1.904	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CC[C@H](C(=O)OC)CC1)CCO2	1832013105	HIKUVSYUDVWDJG-IAGYGMIVSA-N	444.956	1.440	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3cnc[nH]3)CCO2)C1	1832813100	DTSCJRIEVUCFHB-ZWKOTPCHSA-N	433.336	1.035	50	20	IDGD	
C[C@@H](CC(N)=O)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](C)CBr)CC2)CC1	1833265429	VRZLJQFQDLWVJP-KBPBESRZSA-N	445.402	1.101	50	20	IDGD	
CC[C@@H](C(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)CCl)CC2)CC1)N(CC)CC	1833306712	ZJUSSVHBCZQISA-OALUTQOASA-N	431.021	1.278	50	20	IDGD	
C[C@H](Oc1ccccc1)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)CCl)CC2)CC1	1833312041	JEOQQVAPMWOVJN-JXFKEZNVSA-N	437.968	1.625	50	20	IDGD	
Cc1nc(C)c(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)s1	1834079724	RXRQLRDSTCXPEX-DIFFPNOSSA-N	446.367	1.613	50	20	IDGD	
Cn1cnc(C(=O)NC2CCN(C3CCN(C(=O)[C@@](C)(Cl)CCl)CC3)CC2)c1	1834286446	KXYHAHFHMICERB-IBGZPJMESA-N	430.380	1.842	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(CN(C(=O)COc3ccccc3)CCO2)C1	1834952299	CUTTVQHBWRBTLY-OAQYLSRUSA-N	436.581	1.373	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)Cc3cnc[nH]3)CC2)CC1	1835061050	ZPVHASWZVXLJDU-AWEZNQCLSA-N	440.386	1.555	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3ccc(-n4cnnc4)cc3)CC2)CC1)[C@@H](F)Cl	1835080474	WGUIPYIMQOZVJF-LJQANCHMSA-N	448.930	1.987	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3ccc4nncn4c3)CC2)CC1	1835585389	MWZXGKQURYCLHY-GOSISDBHSA-N	448.955	1.168	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC1CCN(C2CCN(C(=O)c3ccc(O)cn3)CC2)CC1	1835833512	MKEIFMLYFPIKGZ-UHFFFAOYSA-N	434.613	1.824	50	20	IDGD	
CC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)c3nc[nH]c3[N+](=O)[O-])CC2)CC1	1836393957	DJDLOIFAAUNKOE-AWEZNQCLSA-N	426.905	1.521	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)ccc1O	1837714476	IAPKEEHTEZDFLV-OAQYLSRUSA-N	436.581	1.622	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)CCN3CCN(C)CC3)CC2)CC1	1837806513	RSLXAUINCBLZJQ-FQEVSTJZSA-N	443.032	1.640	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)/C=C/C(=O)c3cccs3)C2)C1	1839144472	AWPCVCSSPRWMBH-KJDRQLFNSA-N	440.949	1.961	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3cnc4[nH]ccc4c3)C2)C1	1839148954	OVTJVIUOSJGKHN-PGRDOPGGSA-N	448.951	1.969	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C[C@H]3CCCCO3)C2)C1	1839150188	FGZOJCTUIMEQHK-AYOQOUSVSA-N	437.364	1.638	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3CC3)C2)C1	1839743630	GVLHSOJPNJOALJ-CQTHNFAISA-N	431.439	1.738	50	20	IDGD	
CCn1nc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)cc1C	1840033615	LIIIXAQOFNAYLX-KBXCAEBGSA-N	443.342	1.065	50	20	IDGD	
O=C(c1cccc2nc[nH]c12)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840187719	RYKUMSYHZRWTDU-GOSISDBHSA-N	427.288	1.437	50	20	IDGD	
CC(C)(C)c1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)[nH]n1	1840189007	RDHLDPHURTYAJI-GOSISDBHSA-N	433.336	1.581	50	20	IDGD	
O=C(c1ncccc1-c1ccccc1)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843013868	WXERHYGXUKHCHJ-UHFFFAOYSA-N	441.296	1.559	50	20	IDGD	
CC1(C)Cc2cccc(C(=O)N3CCCC34CN(C(=O)c3ccc(B(O)O)cc3)C4)c2O1	1843300361	LQWAEVYYHKKHAN-UHFFFAOYSA-N	434.301	1.211	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)c2cccnc2-c2ccccc2)C1	1843499808	WRNLWYMMBFZTFX-UHFFFAOYSA-N	435.528	1.939	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)CCN1CCCC1)C2	1844693416	CJGCRLBIWNORBE-UHFFFAOYSA-N	444.488	1.823	50	20	IDGD	
C[C@H](C(=O)N1CC2(CCCN2C(=O)[C@H](F)Br)C1)N1CSCSC1	1845217914	CBYSKCJDTASHJL-MNOVXSKESA-N	426.377	1.923	50	20	IDGD	
O=C(c1cc(O)n[nH]1)N1CC2(CCCN2C(=O)[C@H](Br)Cc2ccccc2)C1	1845941097	FBRBOBXHPDGOLN-CQSZACIVSA-N	433.306	1.939	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)c1ccnc(C(F)(F)F)c1)C2	1846384297	AHSIHTDGPHCNLN-UHFFFAOYSA-N	427.427	1.290	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)c1cccc3c1OC(C)(C)CC3)C2	1846384864	SKNXIDVYXXTDGR-UHFFFAOYSA-N	442.560	1.980	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)C1CN(C(=O)c2ccccc2OC)C1	1847457662	UYVCKWSGDATMMT-SQNIBIBYSA-N	449.935	1.223	50	20	IDGD	
CON(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)c2ccc(Br)s2)cc1	14936913	QMKLWVFYWBWFFB-UHFFFAOYSA-N	448.320	1.767	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCC(C(=O)Nc3ccccc3O)CC2)n1	15044693	QMMUTHDJJNNOPX-UHFFFAOYSA-N	431.518	1.198	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2cc([N+](=O)[O-])cc(C)c2C)cc(OC)c1OC	15243845	ZDEBABGYOWSXNV-UHFFFAOYSA-N	439.446	1.861	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)CCn2cnc3sc4c(c3c2=O)CCCC4)n1	16200937	AGDKEBIMCNJVRK-UHFFFAOYSA-N	428.518	1.388	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)c2ccc3c(=O)n(C)c(S)nc3c2)cc1	18071808	BGZBBSTYPUTGHM-GFCCVEGCSA-N	442.497	1.849	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)[C@@H]1CCCN1S(=O)(=O)c1cccs1	109846827	VZHIYASMORFPIP-HNNXBMFYSA-N	437.543	1.690	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)c1ccc(S(=O)(=O)NCCc2cccs2)cc1	116826630	WNBCZVHYSZOJSL-UHFFFAOYSA-N	432.527	1.682	50	20	IDGD	
COCCCNC(=S)N(C)NC(=O)c1ccc(CS(=O)(=O)c2ccccc2)o1	726077047	NDOHVKNJJGUXDG-UHFFFAOYSA-N	425.532	1.741	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)CNC(=O)NCc2ccc(Cl)cc2)cc1	727545771	QCNRWOHBQWKTRX-UHFFFAOYSA-N	432.864	1.452	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC(C(=O)NNc3nc(-c4cccnc4)no3)CC2)cc1	728078791	VXEBKBTYHXPVTG-UHFFFAOYSA-N	442.501	1.984	50	20	IDGD	
C[C@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(S(=O)(=O)NNC(=O)C(C)(C)C)cc2)C1	728260820	SYSLHHLBSYYGFG-OKILXGFUSA-N	431.580	1.709	50	20	IDGD	
O=C(COC(=O)C(F)(F)c1cccc(Cl)c1)NNC(=O)[C@H]1COc2ccccc2O1	728333805	UEKKJOIGUCXZHK-OAHLLOKOSA-N	440.786	1.962	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)COc2ccc(C(F)(F)F)cc2)n1	728729335	NJJMSGFDEVJLLQ-UHFFFAOYSA-N	431.392	1.782	50	20	IDGD	
CCN(CC)CC(=O)N1CCN(C(=O)/C(C#N)=C/c2cc(C)n(CCOC)c2C)CC1	728880807	GTTYJPPWEHWMAU-RCCKNPSSSA-N	429.565	1.671	50	20	IDGD	
CC[C@H](NC(=O)NNC(=O)c1cc(OC)cc(OC)c1)c1cccc(S(N)(=O)=O)c1	729231771	YDACRTKLGOAEKE-KRWDZBQOSA-N	436.490	1.447	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)c2cccc(OC(F)F)c2)cc1S(=O)(=O)NCC#N	731191964	LDJSJGGODQOQGD-UHFFFAOYSA-N	438.412	1.473	50	20	IDGD	
O=C(NNc1ccc(Cl)cc1Cl)C(=O)Nc1ccn(CCN2CCOCC2)n1	731353695	XQKBKRSGGHHYML-UHFFFAOYSA-N	427.292	1.604	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)COc1ccc(N(C)S(=O)(=O)c2cccs2)cc1	731852072	AUYSQZUTAHTJFB-UHFFFAOYSA-N	449.514	1.445	50	20	IDGD	
Cc1cc(-c2noc(CCC(=O)NNC(=O)CCN3C[C@H](C)O[C@H](C)C3)n2)ccc1F	732262479	UHDLGPRXWYYKRW-GASCZTMLSA-N	433.484	1.763	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCN(c2ccc3c(c2)OCCO3)C1=O)c1cnn(-c2ccccc2)c1	733169859	CUJZCWOMOJVFDY-GOSISDBHSA-N	447.451	1.458	50	20	IDGD	
O=C(NCc1ccc(N2CCOCC2)c(F)c1)NNC(=O)c1cnn(-c2ccccc2)c1	733343440	PZDPBSGKDDWFDA-UHFFFAOYSA-N	438.463	1.992	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)[C@H](Cc2ccc(F)cc2)n2nnnc2C)cc1	733515856	KHPYBAVWRMXKGY-SFHVURJKSA-N	440.435	1.217	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)C1	734169129	MYOBDAYYAPJGHQ-INIZCTEOSA-N	447.540	1.423	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)c2c(C)nn(C)c2n1	734821494	MAAHRDOEUWRURC-UHFFFAOYSA-N	445.524	1.929	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccc(F)cc3)CC2)cc1C	736309090	YLVOREYPYLFAAQ-UHFFFAOYSA-N	432.521	1.977	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)c3nonc3C)c2)c(C)c1	736666631	JFZKZHXLQQHWNT-UHFFFAOYSA-N	429.458	1.870	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cc3c(nc2O)CCCCC3)cc1	737767316	VLGTZDXHAACIAJ-UHFFFAOYSA-N	446.529	1.446	50	20	IDGD	
COc1ccccc1NC(=S)NNC(=O)CN1CCN(C(=O)OC(C)(C)C)CC1=O	741297540	APQBZDQPWUDOIX-UHFFFAOYSA-N	437.522	1.092	50	20	IDGD	
CN(C)c1cccc(-c2nnc(SCC(=O)NNC(=O)c3cccc(C#N)c3)n2N)c1	741862228	XGDDLYYTIXJCDN-UHFFFAOYSA-N	436.501	1.150	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)cc1N1CCNC1=O	742033032	HSEJCHNUEIVAKM-UHFFFAOYSA-N	444.444	1.325	50	20	IDGD	
O=C(NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)o1)c1cccc(Br)c1	742772015	NZIDQHDRHRGTIC-UHFFFAOYSA-N	442.291	1.901	50	20	IDGD	
CCc1nsc(N2CCN(CC(=O)NNC(=O)c3cc(Cl)ccc3OC)CC2)n1	744422791	UGDNXOMUFQBJSF-UHFFFAOYSA-N	438.941	1.346	50	20	IDGD	
CCc1ccc(C(=O)OCC(=O)NNC(=O)c2ccc(OC)c(OC)c2)cc1[N+](=O)[O-]	747013644	ZSVNGDQVOAHRDQ-UHFFFAOYSA-N	431.401	1.792	50	20	IDGD	
C[C@]1(NNC(=O)NCc2ccc(Cn3cnc4ccccc43)cc2)CCS(=O)(=O)C1	747305658	BSQHWPIIFRCVNW-NRFANRHFSA-N	427.530	1.966	50	20	IDGD	
O=C(NNC(=O)c1ccccc1S(=O)(=O)N1CCOCC1)c1ccc(Cl)cc1F	747326017	GUSHFFZKFSGXJM-UHFFFAOYSA-N	441.868	1.575	50	20	IDGD	
CC(=O)N1CCC(NC(=O)NNC(=O)[C@@H]2Cc3ccccc3CN2Cc2ccccc2)CC1	747866294	PILDTJIWKMMTME-QHCPKHFHSA-N	449.555	1.955	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)NCC1CCN(S(C)(=O)=O)CC1	749017355	LTTWQSNWKISJEP-HNNXBMFYSA-N	448.545	1.609	50	20	IDGD	
Cc1nc2c(c(O)nn2C)c(C)c1CC(=O)NNc1nc(Br)cn2ccnc12	750250780	ZDEFWGPHPNIHCW-UHFFFAOYSA-N	445.281	1.782	50	20	IDGD	
CC(C)N1C[C@H](NC(=O)NNC(=O)[C@@H](C)Oc2cccc(Br)c2)CC1=O	750644314	QCLXWSVPGLWCLT-DGCLKSJQSA-N	427.299	1.556	50	20	IDGD	
Cc1nc(S(=O)(=O)NCCC(=O)NNC(=O)c2cc3c(s2)CC[C@@H](C)C3)cn1C	750663903	QTAVIWHOTQTPFT-LLVKDONJSA-N	439.563	1.044	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)c2ccc(F)c(NS(C)(=O)=O)c2)cc1OC	750718557	NVRDDLCUWLQHHB-UHFFFAOYSA-N	425.438	1.679	50	20	IDGD	
COC(=O)[C@H]1CCC[C@@H](C(=O)OCC(=O)NNC(=O)c2cc(Cl)ccc2OC)C1	750921611	KERVWDRSOAHGSN-NWDGAFQWSA-N	426.853	1.632	50	20	IDGD	
CN1C(=C(C#N)C(=O)COC(=O)CCOc2cccc(C(N)=O)c2)N(C)c2ccccc21	751682430	SDNBPTOOAXKBKA-UHFFFAOYSA-N	434.452	1.988	50	20	IDGD	
CC[C@@H](CS(=O)(=O)c1ccccc1)NC(=O)NNC(=O)CNC(=O)c1cccs1	752153277	CVRQVFJBWJVYQQ-ZDUSSCGKSA-N	438.531	1.061	50	20	IDGD	
N#Cc1ccc(CN2CC[C@H](NC(=O)NNC(=O)c3cc(Br)c[nH]3)C2=O)cc1	753034896	XBSZSKGWCFWHIC-AWEZNQCLSA-N	445.277	1.394	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)NC[C@H]2CCCN2S(C)(=O)=O)cc1Cl	753115070	QDPTWHGLWYOLEM-SNVBAGLBSA-N	449.917	1.117	50	20	IDGD	
Cn1nnc2cc(C(=O)NNC(=O)COc3ccc(OCc4ccccc4)cc3)cnc21	754009749	KQOCDXKJKMHPPW-UHFFFAOYSA-N	432.440	1.782	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)NNC(=O)COc2ccccc2Cc2ccccc2)co1	755408292	VANOUVMMBTUFLG-UHFFFAOYSA-N	443.481	1.619	50	20	IDGD	
CCNC(=O)c1cccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1	755513629	MMGDRJNQPLMIRM-UHFFFAOYSA-N	433.490	1.153	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)Nc2cccc(N3C(=O)CN(C)C3=O)c2)cc1OC	755993113	QNIKQOKSCYGPAS-UHFFFAOYSA-N	441.444	1.959	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@](C)(O)CN2Cc3ccccc3C2=O)ccc1OC(C)C	756797619	QOXQXQZWLRMAPX-HSZRJFAPSA-N	441.484	1.650	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)Nc1cnn(-c2cnc3ccccc3n2)c1	757783657	GEOYEBBXKWBTNL-UHFFFAOYSA-N	428.412	1.919	50	20	IDGD	
O=C(NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)Nc1cnn(C(F)F)c1	757866483	MTFWSSSOIDMPJI-UHFFFAOYSA-N	428.421	1.529	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)c2ccc(S(=O)(=O)N3C[C@H](C)O[C@H](C)C3)cc2)nc1	759738771	PZSGJQAYKLWYTQ-OKILXGFUSA-N	448.501	1.423	50	20	IDGD	
COc1cccc(/C=C(/C#N)C(=O)OCC(=O)Nc2cc(S(N)(=O)=O)ccc2C)c1	759872555	VANUTRKOAZQHDP-NVNXTCNLSA-N	429.454	1.740	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCCC(=O)NNC(=O)CNc1ccccc1	761040405	HGZMABBOLISGAK-MRXNPFEDSA-N	433.509	1.152	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)C(C)(C)C)cc1S(=O)(=O)N1CCCCCC1	761063751	LSRIHVKSYWABNU-UHFFFAOYSA-N	438.550	1.692	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)NCCNC(=O)c1c(F)cccc1F	761687909	LIPIOFQFDLWNCF-UHFFFAOYSA-N	438.456	1.826	50	20	IDGD	
COCC(=O)NN=Cc1ccc(OS(=O)(=O)c2cc([N+](=O)[O-])ccc2C)c(OC)c1	761818499	NNUZRXFJRBJEAC-UHFFFAOYSA-N	437.430	1.776	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H]1[C@@H]1COCCC1=NNC(=O)[C@@H]1CCS(=O)(=O)C1	762418870	UMZZEJWIYKLXGX-IIAWOOMASA-N	429.539	1.329	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)CCc2nc(-c3cccs3)no2)n1	762420449	JACRICKSRJYRRK-UHFFFAOYSA-N	435.487	1.429	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)[C@H]3CCCCN3C(=O)c3ccc(O)nn3)n[nH]2)cc1	762955350	XKYZFBYFSUOFTA-GOSISDBHSA-N	449.471	1.337	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2c[nH]c3ccccc23)cc1C(=O)OC	763536253	OQZVUQNSGQTFTN-UHFFFAOYSA-N	438.396	1.141	50	20	IDGD	
CCOC(=O)N(C)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)cc1	763549341	YCVKWDUKYNVCAS-UHFFFAOYSA-N	428.401	1.408	50	20	IDGD	
CCOc1ccc(OCc2ccc(C(=O)NNC(=O)C(=O)Nc3cnn(C)c3)cc2)cc1	763602381	ZREZYYPDQXCNJF-UHFFFAOYSA-N	437.456	1.798	50	20	IDGD	
COc1cc(C(=O)N(C)C)ccc1NC(=O)C(=O)NNC(=O)c1cc(C)nc2ccccc12	763616419	LZNUCFQJESWTMC-UHFFFAOYSA-N	449.467	1.653	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2ccc(CN3CCCC3=O)cc2)c1	763649333	XQRGLWNMEZMXHY-UHFFFAOYSA-N	438.484	1.591	50	20	IDGD	
CON(C)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)cc1	763735293	PUNKERHCHRUSAO-UHFFFAOYSA-N	428.489	1.622	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)C(C)(C)C)cc2)c2ccccc2c1=O	763789804	DUOVODDJIYBGSJ-UHFFFAOYSA-N	449.467	1.562	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(-n3ccnn3)cc2)cc1	763859731	FPALCULQMLENFP-AWEZNQCLSA-N	438.444	1.219	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccccc2-n2ccnn2)cc1	763873612	WLYZZAYIQFQPPG-AWEZNQCLSA-N	436.428	1.023	50	20	IDGD	
CCN(CC)c1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(C(C)=O)cc2)cn1	763877452	KAWXUYRPPYDTMJ-HNNXBMFYSA-N	441.488	1.684	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(N(C)C(C)=O)c2)cc1OC	763901120	GBCKEAYSTXEOMH-UHFFFAOYSA-N	428.445	1.476	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)N(C)CC3)ccc1OC(C)C	763922699	ZWJXVCIJTORBHX-UHFFFAOYSA-N	426.473	1.874	50	20	IDGD	
CN(C)C(=O)COc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccc(Cl)cc2)cc1	763932903	VJGWJXWPFIJGND-UHFFFAOYSA-N	432.864	1.136	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3ccc(-n4nccn4)nc3)cc2C1	763948237	ILYJNEODZYMGBH-LLVKDONJSA-N	425.474	1.248	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCCCC3)cn1	763967737	FUZLVKQNHFSHIC-UHFFFAOYSA-N	432.502	1.837	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc[nH]2)n(-c2cccc(Br)c2)n1	763978925	DIGUXANCORQXPF-UHFFFAOYSA-N	431.250	1.671	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)Nc1csc(-c2ccccn2)n1	764004638	JWPKEYRGQVRMMU-UHFFFAOYSA-N	449.290	1.706	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccccc1I	764042445	KFIINOLOOOPZJV-UHFFFAOYSA-N	439.209	1.700	50	20	IDGD	
CCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cccc(Br)c2)cc1	764063730	XCAOPOSGTDTTNV-UHFFFAOYSA-N	433.262	1.599	50	20	IDGD	
COC(=O)c1ccc(OC(C)C)c(NC(=O)C(=O)NNC(=O)Cc2ccccc2OC)c1	764131124	FBVGCRISEVWDLD-UHFFFAOYSA-N	443.456	1.598	50	20	IDGD	
CCOCCOc1c(Cl)cccc1NC(=O)C(=O)NNC(=O)[C@@H]1Cc2ccccc2O1	764165350	XJAKEHLYPKYCTA-KRWDZBQOSA-N	447.875	1.845	50	20	IDGD	
COCCn1ncc2ccc(NC(=O)C(=O)NNC(=O)Cn3ccc4ccccc43)cc21	764242645	KIIHFQIQNYNOSX-UHFFFAOYSA-N	434.456	1.424	50	20	IDGD	
COc1cc(Cl)c(C)cc1NC(=O)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	764266550	MYQFJGAMALVMLK-UHFFFAOYSA-N	446.895	1.450	50	20	IDGD	
C[C@H]1CN(Cc2ccccc2NC(=O)C(=O)NNC(=O)Cc2cccnc2)C[C@H](C)O1	764267786	KDZBSRZFURQZQS-HOTGVXAUSA-N	425.489	1.019	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C(=O)Nc1ccc(N2C(=O)CCC2=O)c(C)c1)c1ccccc1	764328163	BQKMJURVASZDFP-KRWDZBQOSA-N	436.468	1.928	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C(=O)Nc1ccc(N2C[C@H](C)O[C@H](C)C2)nc1)c1ccccc1	764328314	OTPOMOSQBORMBJ-FCEWJHQRSA-N	439.516	1.975	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C(=O)Nc1ccc(S(=O)(=O)CCOC)cc1)c1ccccc1	764330824	YMVZBJOMLSFJJB-SFHVURJKSA-N	447.513	1.386	50	20	IDGD	
N#Cc1ccc(OC(F)F)c(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c1	764350992	NMFSLJLKUQOMBO-UHFFFAOYSA-N	440.366	1.745	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)C(=O)Nc1ccc(-c2noc(C(F)(F)F)n2)cc1	764385569	BZWJCFRMGHNGGP-UHFFFAOYSA-N	434.334	1.859	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)C(=O)Nc2cc(C)nn2-c2ccc(F)cc2)c1	764431033	UMHUKNRKWYETAG-UHFFFAOYSA-N	439.407	1.073	50	20	IDGD	
COc1ccccc1OC[C@@H](C)CNC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	764459510	PDEZARMXMYWINS-AWEZNQCLSA-N	439.472	1.601	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)[C@H](CC(F)F)NC(=O)OC(C)(C)C)c2ccccc2c1=O	765531717	XVLDBAMNXUFZSR-LBPRGKRZSA-N	439.419	1.243	50	20	IDGD	
CS[C@@H](C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1)c1ccccc1	766636766	URDVEZWPZFBLIV-HXUWFJFHSA-N	426.542	1.696	50	20	IDGD	
Cc1onc(-c2ccccn2)c1C(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	767561105	OHGVXKCXHCPSSV-UHFFFAOYSA-N	425.357	1.571	50	20	IDGD	
Nn1c(SCC(=O)NNC(=O)c2ccccc2)nnc1-c1cc(-c2ccccc2)[nH]n1	768439209	FTQZHOWNSHNECI-UHFFFAOYSA-N	434.485	1.602	50	20	IDGD	
CC(=O)N1CCN(S(=O)(=O)c2ccc(C(=O)NNc3nc4ccccc4[nH]3)cc2)CC1	768504193	MZLOSTRQMXWKRS-UHFFFAOYSA-N	442.501	1.173	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1ccc([N+](=O)[O-])c(Cl)c1	768721847	PFGAPCAQXNNJBC-UHFFFAOYSA-N	445.863	1.467	50	20	IDGD	
Cc1cnn(Cc2ccccc2F)c1NC(=O)C(=O)NNC(=O)Cc1ccc(F)cc1	769267435	SCKSLUKONBALAH-UHFFFAOYSA-N	427.411	1.847	50	20	IDGD	
O=C(CCNS(=O)(=O)/C=C\c1ccccc1)NNC(=O)c1ccc2c(c1)OCCO2	770426116	FQKRJMCDUQNHSF-LCYFTJDESA-N	431.470	1.199	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)c3ccc4c(=O)n(-c5ccccc5)c(O)nc4c3)nc21	770985101	YSMHFCGKNPSLMR-UHFFFAOYSA-N	444.411	1.231	50	20	IDGD	
CCOC(=O)c1cnc(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)c(Cl)c1	772710029	WUMMJZYUDLYLME-UHFFFAOYSA-N	439.881	1.280	50	20	IDGD	
CN(Cc1ccccc1)[C@@H](CNC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)C1CC1	773131175	ISCXZJBAAPFECT-FQEVSTJZSA-N	434.504	1.517	50	20	IDGD	
O=C(NNc1cnc2ccccc2n1)C(=O)Nc1cccc(C(=O)N2CCSCC2)c1	773722596	ITMVYSAJYMFMJS-UHFFFAOYSA-N	436.497	1.901	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccc([S@](C)=O)c(F)c1	774010416	VJMPZNBCXLBBLN-WIONRGSFSA-N	441.868	1.770	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1)c1ccc(OC)cc1	775781164	ZWDFUKSLIQZIEZ-NRFANRHFSA-N	438.528	1.794	50	20	IDGD	
CCC(CC)n1nc(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1C	776446935	FCDYOWVDGOUKCZ-UHFFFAOYSA-N	427.914	1.928	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)CCNS(=O)(=O)/C=C\c2ccccc2)nc1C	778422990	XYWIROJIXUGAMS-BENRWUELSA-N	433.490	1.385	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCOCC2)cc1NC(=O)C(=O)NNc1ccccc1F	782705540	DJWAMNGHRWYJDQ-UHFFFAOYSA-N	436.465	1.237	50	20	IDGD	
N#Cc1cccnc1OC1CCC(NC(=O)NNC(=O)Cc2cn3ccccc3n2)CC1	783039929	RYFLAYWGNJLQKN-UHFFFAOYSA-N	433.472	1.864	50	20	IDGD	
N#Cc1cccnc1OC1CCC(NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)CC1	783040110	CIONYWUPVDZAEZ-UHFFFAOYSA-N	447.459	1.263	50	20	IDGD	
Cc1cc(C)c(NC(=O)C(=O)NNC(=O)CNC(=O)c2ccco2)cc1Br	784001955	GWUSKOXHAUAAGB-UHFFFAOYSA-N	437.250	1.175	50	20	IDGD	
Cc1ccc(CN(C)C)cc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	784214774	DMFVOCITBUMMAN-UHFFFAOYSA-N	445.545	1.579	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)Cc1cccc(N2CCCC2=O)c1	784723265	ITKNBVZHJSARHC-UHFFFAOYSA-N	443.529	1.419	50	20	IDGD	
Cn1c(=O)oc2c(NC(=O)C(=O)NNc3nc(-c4ccc(Cl)cc4)no3)cccc21	784796050	YNEJXGVXRKZOTB-UHFFFAOYSA-N	428.792	1.917	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNc2ccc(F)c(F)c2F)c(C(=O)N(C)C)cc1OC	784811948	VJFXQVXSKDZSDD-UHFFFAOYSA-N	440.378	1.905	50	20	IDGD	
O=C(NNc1ccnc(Br)c1)C(=O)Nc1ccccc1CN1C(=O)CCC1=O	784828127	FRYULBPKFPEGTI-UHFFFAOYSA-N	446.261	1.575	50	20	IDGD	
COC(=O)CNC(=O)Cc1ccc(NC(=O)C(=O)NNc2cc(F)c(F)cc2F)cc1	784886640	RAHCYZRDPLYQQL-UHFFFAOYSA-N	438.362	1.017	50	20	IDGD	
CCNC(=O)N(C)NC(=O)C(=O)Nc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(C(F)(F)F)c1	784915729	GKTYUKOQYGMADO-RYUDHWBXSA-N	445.442	1.950	50	20	IDGD	
CCNC(=O)N(C)NC(=O)C(=O)Nc1ccc(NC(=O)[C@H]2CCCO2)cc1C(F)(F)F	784916907	DAXGDPPANOEZLN-CYBMUJFWSA-N	445.398	1.454	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)C2CN(C(=O)OC(C)(C)C)C2)c2ccccc2c1=O	785012112	JQZRTCJIROCJCU-UHFFFAOYSA-N	429.477	1.605	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc(C(N)=O)c(F)c3)n[nH]2)c1	785130564	URBIJXRFNQZRCN-UHFFFAOYSA-N	438.419	1.331	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)[C@H]1[C@H]2CC[C@@H](O2)[C@@H]1C(F)(F)F	785443411	XFBPBXYAXPRRJD-FPAYPSAMSA-N	440.466	1.702	50	20	IDGD	
CN(C)CCn1ccc(NC(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)n1	785855118	HQKSGKVGSMWDEG-UHFFFAOYSA-N	438.533	1.086	50	20	IDGD	
C[C@]1(NNC(=O)NC[C@H](C(=O)OCc2ccccc2)c2ccccc2)CCS(=O)(=O)C1	786891193	VVPXIKHPKKLHDP-UGKGYDQZSA-N	445.541	1.895	50	20	IDGD	
C[C@@H]1CN(c2ccccc2F)CCN1C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	789012258	QUAHHASPHKEHKC-MRXNPFEDSA-N	441.511	1.784	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNS(=O)(=O)c2cc(C(=O)O)c(OC)cc2Cl)c1	790385271	FXZYXWZXKAZFMH-UHFFFAOYSA-N	444.849	1.687	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)Cn3ccc4ccccc4c3=O)CC2)cc1	790555957	AQLICJQCKTVCQV-UHFFFAOYSA-N	447.539	1.275	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNc3nc4ccccn4n3)cc2F)C[C@@H](C)O1	792391923	LGNZWPSLZPTTOA-BETUJISGSA-N	427.440	1.564	50	20	IDGD	
C[C@]1(C(=O)NNC(=O)C(=O)Nc2ccccn2)CCN(C(=O)OCc2ccccc2)C1	793650029	OETUAOBJLYSTBA-NRFANRHFSA-N	425.445	1.216	50	20	IDGD	
O=C(c1cc(O)ccc1C(F)(F)F)N1CCN(S(=O)(=O)CBr)CC1	793776053	WURXZVNZRMFSDA-UHFFFAOYSA-N	431.230	1.851	50	20	IDGD	
CNS(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)c2ccc3ccccc3n2)cc1C	794576124	DIRGOISQIODGTI-UHFFFAOYSA-N	434.499	1.075	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)c2ccoc2CC(N)=O)c2ccccc2c1=O	794775189	NJLXVOJNKUYMQS-UHFFFAOYSA-N	425.445	1.282	50	20	IDGD	
COC(=O)c1cn(CC(=O)NNc2ccccc2S(=O)(=O)N(C)C)c2ccccc12	795168949	GYUSYJFEETXQQZ-UHFFFAOYSA-N	430.486	1.822	50	20	IDGD	
CC(=O)N[C@@H](CC(=O)NNc1ccccc1S(=O)(=O)N(C)C)c1ccc(F)cc1F	795169679	SPQSSAOQJULJFU-KRWDZBQOSA-N	440.472	1.926	50	20	IDGD	
Cc1cc(C)nc(-n2nc(C(=O)NNc3ccccc3S(=O)(=O)N(C)C)cc2C)n1	795181032	GOXMRIRNMURAIY-UHFFFAOYSA-N	429.506	1.595	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2C[C@H](c3ccccc3)[C@@H]3COCC[C@H]32)cc1OC	796357075	BHHDKIXHRKMHBM-HSALFYBXSA-N	439.512	1.969	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)c(OC)c(C)c1OC	797001689	JOAYXTXGHGVTOK-INIZCTEOSA-N	429.429	1.110	50	20	IDGD	
CCNC(=O)N(C)c1cccc(NC(=O)C(=O)NNC(=O)CCc2ccccc2O)c1	797009928	YEZWOBJXYSXYTH-UHFFFAOYSA-N	427.461	1.277	50	20	IDGD	
Cc1ccc(-c2ccnn2C)cc1NC(=O)C(=O)NNC(=O)c1cc(Br)c[nH]1	799258831	NDANRVPHBJIGGU-UHFFFAOYSA-N	445.277	1.886	50	20	IDGD	
NC(=O)CS(=O)(=O)c1ccc(C(=O)NNC(=O)Nc2ccc(OC(F)F)cc2)cc1	802046917	XNFVUUKYPUVXJJ-UHFFFAOYSA-N	442.400	1.014	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(NC(C)=O)cc2)cc1	802052076	DZEBEORIRXYUSY-UHFFFAOYSA-N	449.489	1.127	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@H]2CCN(c3ccc(F)cc3)C2=O)cc1	802066832	BAJCJXMCSPMTGR-MRXNPFEDSA-N	434.449	1.435	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2[nH]cnc2C(=O)c2ccccc2)cc1	802066938	DYCXVIZGIJBREB-UHFFFAOYSA-N	427.442	1.511	50	20	IDGD	
CCCS(=O)(=O)c1ccccc1C(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	802067326	SBDHEFROZGACLB-UHFFFAOYSA-N	439.515	1.740	50	20	IDGD	
CSCC[C@H](C(=O)NNc1ccc(-n2ccnc2)nn1)N1C(=O)c2ccccc2C1=O	804956886	HSNDEQGIRUVYLR-OAHLLOKOSA-N	437.485	1.523	50	20	IDGD	
CN(C)S(=O)(=O)C[C@@H](NC(=O)NNC(=O)C12CC3CC(CC(C3)C1)C2)C(F)(F)F	805768556	CQPLVNNYHUOJTE-RRHJKOLHSA-N	440.488	1.356	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)Nc1ccc(F)c(S(=O)(=O)N(C)C)c1	806543859	KWNWENKUSAEBNW-NSHDSACASA-N	442.444	1.835	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)N2CCN([C@H]3CCN(C(=O)OC(C)(C)C)C3)CC2)n1	808298915	CFSFOBILBYNGNN-INIZCTEOSA-N	432.525	1.371	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(Br)s1)NNc1ccc(Cl)nn1	810419784	OCNBJTADQMFFFZ-UHFFFAOYSA-N	426.705	1.376	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccccc1F)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	810585911	NQQGXEQRTMJBEM-UHFFFAOYSA-N	435.412	1.094	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)C2(c3ccccc3)CC(=O)C2)cc1OC	811268322	YUQAAQUXYXCJPT-UHFFFAOYSA-N	426.425	1.309	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)[C@H]1OCCc2sccc21	814210627	HSMAHVZPQMRATH-SJKOYZFVSA-N	437.543	1.710	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2O1)C(=O)Nc1ccc(Br)c(C2CC2)n1	815568754	SONKPMFHIPQMES-AWEZNQCLSA-N	445.273	1.811	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)cc1)[C@@H]1C[C@@H]1C	815608319	XKGLWTHHFRTJHU-IFXJQAMLSA-N	448.483	1.424	50	20	IDGD	
Cc1ccc(OCc2ccccc2)c(NC(=O)C(=O)NNC(=O)[C@H]2CCc3nncn3C2)c1	815691442	QCPJVYGAHPSYEK-KRWDZBQOSA-N	448.483	1.514	50	20	IDGD	
Cc1ccc(-c2ncccc2NC(=O)C(=O)NNC(=O)[C@H]2CCc3nncn3C2)s1	815692025	HSSWPBKHHKFKEX-LBPRGKRZSA-N	425.474	1.059	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCO1)C(=O)Nc1cc(Cl)ccc1OC[C@@H]1CCCCO1	815779785	VRYBGCUAYDCUEY-XJKSGUPXSA-N	425.869	1.553	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)c1cnn(C)c1I	816505065	LTDNTYPMBIEGEL-MRVPVSSYSA-N	448.648	1.907	50	20	IDGD	
COC(=O)Cc1c(C(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)[nH]c2ccccc12	816814045	GJEHITPAMAFGQK-UHFFFAOYSA-N	441.440	1.984	50	20	IDGD	
CCCn1c(C)cc(/C=C(\C#N)C(=O)N2CCS(=O)(=NS(C)(=O)=O)CC2)c1C	820256185	XOBULALPMBQKGI-SFQUDFHCSA-N	426.564	1.692	50	20	IDGD	
Cc1cc(Br)c(S(=O)(=O)N2CC[C@@H](B(O)O)C2)cc1Br	864230739	FCGLTASVIUXTJD-MRVPVSSYSA-N	426.923	1.757	50	20	IDGD	
O=C(Cn1cnc2ccccc21)NN=Cc1c(N2CCOCC2)nc2ccccn2c1=O	874052357	GLIRISZZNMILMA-UHFFFAOYSA-N	431.456	1.031	50	20	IDGD	
COc1ccnc(NNC(=O)c2cccc(S(=O)(=O)N3CCc4ccccc43)c2)n1	914762117	QNDWMEFIZAEMOK-UHFFFAOYSA-N	425.470	1.994	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)cc1	914974090	AYJIQKCLPSSRIW-UHFFFAOYSA-N	447.513	1.547	50	20	IDGD	
O=C(CCN1CCN(C(c2ccccc2)c2ccccc2)CC1)NNC(=O)c1cc[nH]n1	915807304	DDQNXSFIEQDHNW-UHFFFAOYSA-N	432.528	1.968	50	20	IDGD	
O=C(NCCNS(=O)(=O)c1cccc(Cl)c1)NNC(=O)c1ccc2ccccc2n1	916295076	HJAKGVFTISEWMA-UHFFFAOYSA-N	447.904	1.811	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NC[C@H](C2CCCCC2)N(C)C)c2ccccc2c1=O	916449166	SJVRKJRKWCZICO-GOSISDBHSA-N	428.537	1.871	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)N[C@@H](C)c2nncn2C)c2ccccc2c1=O	916580617	LFFOLGFWUSACJR-ZDUSSCGKSA-N	426.481	1.420	50	20	IDGD	
CCCN(C(=O)[C@H](C)OC(=O)/C(C#N)=C\c1ccc(OC)cc1)[C@@H]1CCS(=O)(=O)C1	916726442	CYLLEBVULHQBLV-KTMFNDIVSA-N	434.514	1.960	50	20	IDGD	
O=C(NN=Cc1ccc(-n2ccnc2)cc1)c1cccc(S(=O)(=O)N2CCOCC2)c1	917023598	YRSSBSGJNWBNER-UHFFFAOYSA-N	439.497	1.657	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)c3cc(C)n(C)n3)c2)cc1	917520939	CXJWDJQIUNPKBI-UHFFFAOYSA-N	443.485	1.613	50	20	IDGD	
O=C(CCN1CCOCC1)Nc1cccc(CNC(=O)NNc2ccc(Cl)nn2)c1	918092086	JKWHHFSTTDTKAD-UHFFFAOYSA-N	433.900	1.617	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)NCc2cccc(OCC(=O)N(C)C)c2)cc1C	918223547	IYVZIJLXNBZHHT-UHFFFAOYSA-N	441.488	1.240	50	20	IDGD	
CC(C)Oc1ccc(NS(=O)(=O)CC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1	918398618	CZMKXCHOEIIPQC-GOSISDBHSA-N	449.485	1.203	50	20	IDGD	
Cc1cc([N+](=O)[O-])c(S(=O)(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1C	918725243	IVYAKCXVDRCCRB-UHFFFAOYSA-N	441.491	1.128	50	20	IDGD	
C[C@H]1CN(C(=O)c2ccc(CNC(=O)NNC(=O)c3ccccc3O)cc2)C[C@H](C)O1	920347502	FRQRCIIVHMRYSL-GJZGRUSLSA-N	426.473	1.786	50	20	IDGD	
COC(=O)c1ccc(COc2ccccc2C=NNC(=O)N[C@H]2CCS(=O)(=O)C2)cc1	920382543	ZAHYEYGMZYYTQW-SFHVURJKSA-N	445.497	1.872	50	20	IDGD	
Cc1cc(C(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)ccc1N1CCNC1=O	920597332	QZICFGSQBYMWLT-UHFFFAOYSA-N	430.848	1.796	50	20	IDGD	
CC(C)(C)OC(=O)NC(C)(C)C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	921302137	OMDPYRUTWZXRFM-UHFFFAOYSA-N	434.902	1.052	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)NCc1ccccc1N1CCN(C)CC1	1318262002	GCRTZYNUAFIHNR-MRXNPFEDSA-N	429.496	1.875	50	20	IDGD	
Cn1cc(N2CC[C@@H](NC(=O)NNC(=O)c3ccc(F)cc3Br)C2)cn1	1318575632	OLPAOYWBTOCATN-LLVKDONJSA-N	425.262	1.545	50	20	IDGD	
O=C(Cn1nc2n(c1=O)CCCCC2)NNC(=O)c1ccc(Br)cc1Cl	1326362872	WANPQLJMYAWOFM-UHFFFAOYSA-N	442.701	1.648	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2nc[nH]c2[N+](=O)[O-])C1	1778060597	MLXMHPFLCXOVAI-SNUQEOBHSA-N	427.889	1.853	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2)c1occc1Br	1778186698	MPBYPSYWJGBSRY-PBFPGSCMSA-N	449.729	1.769	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(=O)nc4sccn34)C2)C1	1779947949	URLYGSCPLWSHPS-IBGZPJMESA-N	438.937	1.465	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(F)cc3)C2)C1	1780705436	XXHASXRWVIQKAY-IBUSPFOHSA-N	441.463	1.403	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@](C)(Cl)CCl)C1	1780712212	XIKFXVCBQNQMIK-OYYCAODRSA-N	436.380	1.603	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3nc4cc([N+](=O)[O-])ccc4[nH]3)CCO2)C1	1781220346	YRLLRZBOUFTMEO-YJYMSZOUSA-N	435.868	1.932	50	20	IDGD	
Cn1nc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](F)Br)C3)C2)c2c1CCC2	1781329150	AGRPZVFRQQTFHN-YOEHRIQHSA-N	429.290	1.043	50	20	IDGD	
O=C(c1ccc2cncn2c1)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781331647	OISFOBIECVNCEN-RHSMWYFYSA-N	425.258	1.468	50	20	IDGD	
COc1ccc(CC(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)cc1F	1781335629	XXNHWNATFXISLP-SJLPKXTDSA-N	447.276	1.897	50	20	IDGD	
O=C(Nc1ccc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)cc1)C1CC1	1781465669	WYWATNWVGXJBDW-UWJYYQICSA-N	435.908	1.078	50	20	IDGD	
O=C(c1cccc(N2CCOCC2)c1)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Cl)CCO2	1781736051	ZCJSWEQUVBHQCW-FXAWDEMLSA-N	425.888	1.501	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccnc4c(O)cccc34)C2)C1	1782510883	DKTTXJIAMKPYBZ-HRAATJIYSA-N	433.892	1.638	50	20	IDGD	
O=C(/C=C/c1cccc(O)c1)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1783272950	FRKANNPTPMUYTI-RPCWLKAMSA-N	427.270	1.926	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@](C)(O)C(F)(F)F)CCO2	1783343445	NCNBODYGBCXROC-BPNCWPANSA-N	431.249	1.303	50	20	IDGD	
C=C(CC(=O)OCC)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](Br)CC)C2)C1	1783353272	NZCADPALZQGFPJ-KSSFIOAISA-N	431.327	1.499	50	20	IDGD	
Cc1ccc(C(=O)NCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)C(C)(C)CCl)[C@H]3C2)cc1	1783854907	FLMBJGTXLSSRRC-FHWLQOOXSA-N	449.979	1.970	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]3C2)n(-c2ccccc2)n1	1784091138	VZCPAKDJGSGJLL-UUXHPUJUSA-N	446.935	1.374	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)N2CC[C@]3(CN(C(=O)CCBr)CCO3)C2)c1	1785108521	NWOWGHMOSPTXQB-IBGZPJMESA-N	438.322	1.874	50	20	IDGD	
COc1ncc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCBr)C[C@@H]32)cc1C	1786270461	YRMAPHMTCRKZHB-BPUTZDHNSA-N	440.338	1.777	50	20	IDGD	
COc1ncc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCBr)[C@H]3C2)cc1C	1786404431	PTDWAFXFFGCAOE-BPUTZDHNSA-N	440.338	1.777	50	20	IDGD	
CC(C)COc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](O)CCl)C[C@@H]32)ccn1	1787518514	CRCZXNHCWQXSMI-XSLAGTTESA-N	439.940	1.309	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc4c3cnn4C)[C@H]2C1	1788067191	DWGYSBIWSUBCIR-IHHFWDAISA-N	449.349	1.950	50	20	IDGD	
C[C@H](Cn1cncn1)C(=O)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1	1788142363	TVXPCBQJOWWEQY-MRXNPFEDSA-N	447.304	1.042	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4cccnn4n3)C[C@@H]21	1788763280	DRYJOHIKLOXPND-ZVZYQTTQSA-N	431.569	1.174	50	20	IDGD	
C[C@@H](Cn1cncn1)C(=O)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1	1789615159	YGQJEOGITOMYFN-INIZCTEOSA-N	447.304	1.042	50	20	IDGD	
CC(C)=NO[C@@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)CBr)C[C@@H]21	1789952758	RASZFFDTPVGXIH-YXMSTPNBSA-N	432.359	1.798	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)c1cc(O)ccc1O	1790265640	UHIYXXUULPMELM-HLHNXRDNSA-N	431.258	1.382	50	20	IDGD	
Cc1cc(C)n(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](C)Br)[C@H]3C2)n1	1791056865	HIBKBEYLQRKJOT-VGWMRTNUSA-N	427.343	1.263	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)c3ccccc3)C[C@@H]21	1791057502	FAAYQLXIRQYPCA-SRQBIAJPSA-N	425.323	1.483	50	20	IDGD	
Cc1nccn1[C@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)Br)[C@H]2C1	1791064608	APRAENZAEJHMIM-URLPEUOOSA-N	427.343	1.516	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc(O)cn3)C[C@@H]21	1791065048	PUUNMUBRDSQHSG-APYUEPQZSA-N	426.311	1.093	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCCC(=O)OC(C)(C)C)C[C@@H]21	1791249012	DEBVWYHGWAAJKZ-QAETUUGQSA-N	446.972	1.732	50	20	IDGD	
CNC(=S)NCCC(=O)NC1(c2ccc(NC(=O)[C@@H](Cl)COC)cc2)CCC1	1791569454	UYZAHPGPDPWIGA-HNNXBMFYSA-N	426.970	1.858	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Cl)C[C@@H]32)C1	1792202893	YSOWNRDYAJFNFL-JKQORVJESA-N	447.935	1.758	50	20	IDGD	
CCC[C@H](NC(C)=O)C(=O)Nc1ccc(C2(NC(=O)CCC(=O)NN(C)C)CCC2)cc1	1792277889	VCPHBJXAAKGSMW-IBGZPJMESA-N	445.564	1.798	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc([N+](=O)[O-])[nH]1)C2	1792872368	BHIRPSGVZVZGDQ-NJBDSQKTSA-N	429.271	1.157	50	20	IDGD	
C[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCBr)c1ccc(O)cc1	1795115360	ZOLLAPJCZOGUIM-LJGDNWOOSA-N	425.323	1.870	50	20	IDGD	
Cc1ccc(CCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)s1	1796188352	SOUZAJVMMCGIIS-REPLKXPHSA-N	426.347	1.621	50	20	IDGD	
CC(C)(C)OC(=O)N[C@]1(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](F)Cl)CCOC1	1796812186	YKICAYNXPPKZOP-IMDDZUEWSA-N	433.908	1.843	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc3[nH]ncc13)C2	1798440275	KFRQWXJFIOMEPB-BTTYYORXSA-N	433.472	1.127	50	20	IDGD	
Cc1cc(F)ccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnccc1C(=O)NN	1798443716	YTCHAPQRBNCZSF-MUJYYYPQSA-N	425.464	1.698	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnoc1)C2)[C@H](Br)Cc1ccccc1	1800434791	AVIKXGLYKARALJ-XMTFNYHQSA-N	448.317	1.884	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@](C)(Cl)CCl)C2	1800673668	ICZZAVFWBHHYAX-JPVZDGGYSA-N	438.352	1.337	50	20	IDGD	
Cc1nccn1CCCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2	1801311771	WTVYUELRCCTUQH-XRGAULLZSA-N	431.306	1.252	50	20	IDGD	
CC(C)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCNC(=O)c1ccccc1	1801947882	WZGRMHURSSBFTR-IZZQQSIFSA-N	435.952	1.661	50	20	IDGD	
C[C@@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CNC(=O)c1cccs1)C2	1801958781	LPJBDPXJHQWMTE-FVCCEPFGSA-N	428.352	1.900	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)C2CC(F)(F)C2)[C@@H]1c1cccnc1	1802639571	DSQQYZAAHNGBLJ-KXBFYZLASA-N	437.491	1.506	50	20	IDGD	
COc1cccc(CCC(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]2c2cccnc2)n1	1803135890	KAKDOJWRQOYBMR-HGHGUNKESA-N	446.935	1.724	50	20	IDGD	
O=C(/C=C/C(=O)N1CCC2(CCCN(C(=O)[C@@H](O)CCl)C2)CC1)NCc1ccccc1	1805515526	RQLOJDYEZWQZSB-UCFODXPJSA-N	447.963	1.690	50	20	IDGD	
CCS(=O)(=O)N[C@H](C)C(=O)N1CCCC2(CCN(C(=O)C(C)(C)CCl)CC2)C1	1805953429	AXDYHBRYIDWYAK-OAHLLOKOSA-N	436.018	1.810	50	20	IDGD	
COC(=O)C1(C(=O)N2CC[C@H](CNC(=O)CCBr)[C@H]2c2cccnc2)CC1	1806346520	KADLHEXDWGDVFL-GDBMZVCRSA-N	438.322	1.826	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)cc1	1807364713	GPGTUWCPECMKMZ-JTHBVZDNSA-N	443.312	1.703	50	20	IDGD	
CC(C)=CCCC(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1807373138	NGWKONIVGBMFBA-NFBKMPQASA-N	435.333	1.827	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)C[C@](C)(O)CC(=O)O)[C@H]1c1cccnc1	1808278113	OSKOLZWLQLFVBB-OFVDUGFESA-N	425.913	1.721	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)c3cc(Cl)ccn3)CC2)C1	1809971401	VPZGGLFLWCHGBK-UHFFFAOYSA-N	441.724	1.573	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)Cn2ccncc2=O)[C@H]1c1cccnc1	1812868740	LEHLSLKTFWFJJW-YEWWUXTCSA-N	448.321	1.128	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)/C=C/c2cnccn2)[C@@H]1c1cccnc1	1813033808	SJDVGIVHNOSVMM-HKGJNHHRSA-N	429.908	1.845	50	20	IDGD	
C[C@@H]1CCC[C@H]1C(=O)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1	1815356689	LJDSZPSNAXOQHD-UHOFOFEASA-N	427.335	1.485	50	20	IDGD	
Cc1ccn(C)c1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1	1817472623	PNSBIXUZHJUCTD-GOSISDBHSA-N	435.293	1.356	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc(C=O)s2)n[nH]1	1817483513	UPIYZTUWQURHHB-HNNXBMFYSA-N	446.533	1.963	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)CN3CCN(C)CC3)sc2C1	1818796498	RMZDZFUQKCIRKS-KBPBESRZSA-N	428.002	1.710	50	20	IDGD	
Cn1nc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)[C@@H](F)Br)n[nH]2)cc1O	1820931747	QCEDTAMAKRAQJQ-ZWNOBZJWSA-N	429.250	1.845	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)C2CCC(O)CC2)[nH]n1	1822416519	GOCRBGJWJYIYJB-VMBOVVBDSA-N	434.541	1.326	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CN(CCO)CCO)CC1	1824015008	JGZGTLDHUHTTDY-GOSISDBHSA-N	432.005	1.158	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@H](O)CCl)CC2)c1cnc2ccc(F)cn12	1824268965	RGUHOOWQTVSGCT-ZWNOBZJWSA-N	437.884	1.755	50	20	IDGD	
CC[C@H](C)[C@@H](O)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1	1824548419	OZDIIZLAJIXVLD-ORYQWCPZSA-N	430.354	1.007	50	20	IDGD	
CC[S@](=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)[C@H](C)Br)sc2C1	1825643052	XSCPBHCPHBLTDY-BYGADWOMSA-N	436.397	1.997	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)Cc1c(C)nn(C)c1C)CC2	1826009158	MKGUDLUZUKPFKE-OCCSQVGLSA-N	439.969	1.902	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H]3CCCS3)sc2C1	1827290438	XLXGLOJCAVTERO-HZMBPMFUSA-N	446.558	1.263	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H]2CCCCO2)CC1	1828922103	MEXHDNBHGUEFEH-PMACEKPBSA-N	443.548	1.488	50	20	IDGD	
O=C([C@H](O)CCl)N1CCC([C@H]2CCCCN2C(=O)[C@H]2CC(c3ccccc3)=NN2)CC1	1831062194	RSJGYRSBKQLFER-NJDAHSKKSA-N	446.979	1.972	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC([C@@H]2CCCCN2C(=O)Cn2ccncc2=O)CC1	1831107316	IUCYFCRDYCNUBK-ZBFHGGJFSA-N	439.354	1.646	50	20	IDGD	
C=CCC(F)(F)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1	1831443847	BPXCRUPJHCYUSQ-IBGZPJMESA-N	434.292	1.811	50	20	IDGD	
O=C(Cc1cc(F)ccc1Cl)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1	1832264593	IPGKJRWDBKKEQD-QFBILLFUSA-N	449.306	1.078	50	20	IDGD	
CC(C)(CCl)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](N)c3ccccn3)CC2)CC1	1833214123	DDOWBNXRLNGFHM-IBGZPJMESA-N	436.000	1.918	50	20	IDGD	
C[C@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)C3=COCC3)CC2)CC1	1833266242	WZHPGXYLXDZDOI-CQSZACIVSA-N	428.371	1.893	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)nc1C	1833693140	CQPZVPOKOAXTIJ-CRAIPNDOSA-N	444.301	1.459	50	20	IDGD	
O=C(Cc1cccc(Cl)n1)NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1833880991	MVXJVWPGHCNKRB-KRWDZBQOSA-N	443.375	1.449	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)c3cc(O)n[nH]3)CC2)CC1	1834766730	MXOHIDWQEBPGGD-GFCCVEGCSA-N	442.358	1.332	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)c3cc(F)cc(F)c3)C2)C1	1834823746	HWOGFYRMSOEESN-SFHVURJKSA-N	447.276	1.820	50	20	IDGD	
COC(=O)C1(C(=O)NC2CCN(C3CCN(C(=O)CCBr)CC3)CC2)CC1	1836534642	FIOWEKOKDZNGSH-UHFFFAOYSA-N	444.370	1.296	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc4cccc(C)c4[nH]3)CCO2)C1	1836856558	KPKWTPJLDNTNDH-VGOFRKELSA-N	449.935	1.800	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(O)cc3F)C2)C1	1837714805	OULNBSWVLQZXFX-HXUWFJFHSA-N	440.544	1.453	50	20	IDGD	
CCc1cnc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](Cl)COC)C3)C2)s1	1837726216	XXCOQMKRPCCLMM-KSSFIOAISA-N	431.942	1.029	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](N)Cc3cccnc3)CC2)CC1	1838092712	XLIQWVDRWJVACB-UXHICEINSA-N	436.984	1.967	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)c(C)n1C	1838380262	KDPWIMCEUHJWAL-NRFANRHFSA-N	425.957	1.977	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3c(C)noc3C)C2)C1	1839142743	YRVKEMZYSRJGBV-PXNSSMCTSA-N	427.929	1.698	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4cnccc4n3)C2)C1	1839144550	DUESOHCXALVQLM-IIBYNOLFSA-N	432.908	1.717	50	20	IDGD	
COc1cc(F)cc(/C=C/C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)c1	1840084794	HDERDVJLVUXGQN-QMUYELLFSA-N	444.862	1.838	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccnc(Cl)c3)C2)C1	1840150846	RSCSIONXXRNTRW-RDTXWAMCSA-N	432.304	1.059	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3ncccc3C)C2)C1	1840151096	VGCCJNUVCJIUNF-DYESRHJHSA-N	439.940	1.033	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)/C=C/c3cnc(C)s3)C2)C1	1840155626	BTZWBUVCYWBHKA-YKTDSXCKSA-N	443.953	1.175	50	20	IDGD	
O=C(CCc1ccc(F)nc1)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840186981	YAINJQFNHDBDPU-SFHVURJKSA-N	434.295	1.413	50	20	IDGD	
Cc1cnc(Cl)c(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)c1	1840187953	HGCPFPOZORFBDD-KRWDZBQOSA-N	436.723	1.917	50	20	IDGD	
COc1cc(N2CCC(C(=O)N3CCCC34CN(C(=O)[C@@H](F)Cl)C4)CC2)ncn1	1841460137	VTDDQPGCOBQAFU-MRXNPFEDSA-N	425.892	1.439	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@H]2CC(=O)N(Cc3cccs3)C2)C1	1841980550	XUVRNJOKBLXTAQ-HOCLYGCPSA-N	439.965	1.554	50	20	IDGD	
O=C(Cc1cc2cccnc2cc1F)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843012059	ZGQAHCBQUVMXPS-UHFFFAOYSA-N	447.275	1.113	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC2(CCCN2C(=O)/C=C/C(=O)NCc2ccco2)C1	1844344825	OFOQGALXGKZIDI-LQYUOIDQSA-N	438.322	1.829	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](CCO)C(=O)N1CC2(CCCN2C(=O)CO[Si](C)(C)C)C1	1844377318	ODBABCDTQYYLBW-OAHLLOKOSA-N	443.617	1.317	50	20	IDGD	
Cc1cc(CC(=O)N2CCCC23CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C3)no1	1846556349	QOVYPERMDQVJCH-HNNXBMFYSA-N	440.928	1.861	50	20	IDGD	
C[C@H](Br)C(=O)N1CC2(CCCN2C(=O)c2ccc(S(C)(=O)=O)c(F)c2)C1	1846894596	PANFACDZPUKMNF-NSHDSACASA-N	447.326	1.830	50	20	IDGD	
CCSc1ncccc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1ccc(B(O)O)cc1	1847194069	MSSDELHFSUVDPJ-ROUUACIJSA-N	425.319	1.003	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](F)Cl)[C@H](O)C1	1847233421	AKBRWJPGYSTRBV-LXFSFDBISA-N	433.908	1.341	50	20	IDGD	
O=C(c1cn2cc(Br)ccc2n1)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl	1847564139	UGYBSAFNPZNXJL-MELADBBJSA-N	441.713	1.512	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H]1C[C@H]1c1ccc(F)c(F)c1	1847612347	DAOJLIBMMDBEKU-QXGSTGNESA-N	434.487	1.643	50	20	IDGD	
COc1ncc(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)cc1F	1848348282	TVTJWRZNEZLKFS-BBNGRIRJSA-N	442.451	1.179	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)c2cccc(CS(C)(=O)=O)c2)c2ccccc2c1=O	14889769	OKUYDQYAOHSWFO-UHFFFAOYSA-N	442.497	1.597	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)c1ccc(N2CCCC2=O)cc1	15737655	ZEOFYAHTJCSIAA-UHFFFAOYSA-N	435.528	1.787	50	20	IDGD	
COc1cc(C(=O)NCC(=O)NNC(=O)c2cc3c(s2)CCC3)cc(OC)c1OC	17445894	NPICDXZIPJFNFM-UHFFFAOYSA-N	433.486	1.454	50	20	IDGD	
Cc1nnnn1/C(=C\c1ccccc1)C(=O)OCC(=O)NNC(=O)c1ccc(Cl)cc1	21690049	CVSMMXITGYPYPP-BOPFTXTBSA-N	440.847	1.637	50	20	IDGD	
C[C@@H]1Cc2cc(C(=O)NNC(=O)c3cc(Br)c[nH]3)ccc2N1S(C)(=O)=O	24123702	KCQCWBFXQACJOV-SECBINFHSA-N	441.307	1.563	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NNC(=O)c2ccc3c(c2)OCO3)cc1	26963850	YXYKYWWDIDTUCT-INIZCTEOSA-N	431.470	1.338	50	20	IDGD	
C[C@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)NNc2nc(-c3ccncc3)no2)C1=O	726376154	GHBDWDZNMZFYCC-LJQANCHMSA-N	425.380	1.181	50	20	IDGD	
CCOC(=O)C1=NN(c2ccccc2)[C@@H](C(=O)NNC(=O)c2cc(Br)c[nH]2)C1	727764959	WXSIAIAWLGFAMK-OAHLLOKOSA-N	448.277	1.736	50	20	IDGD	
O=C(NNC(=S)NCC1CCC1)[C@H]1CCCN(S(=O)(=O)c2ccc(F)cc2)C1	727866419	HHUGOYCQPJUIKN-AWEZNQCLSA-N	428.555	1.522	50	20	IDGD	
N#Cc1ccc(OCc2ccc(C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)o2)cc1	728018787	NJAZTMPPQMQQJN-UHFFFAOYSA-N	429.396	1.781	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@H]2CSCN2C(=O)C(C)(C)C)cc(OC)c1OC	728150984	NILXOXMWMFKYKR-GFCCVEGCSA-N	425.507	1.421	50	20	IDGD	
CCCN(CC)c1ccc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cn1	728343214	BBNYONMDVWKLMY-SFHVURJKSA-N	442.472	1.462	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CSCN1C(=O)c1ccc(Cl)cc1)[C@@H]1COc2ccccc2O1	729166944	AXRKAXPSQFOTQI-YOEHRIQHSA-N	447.900	1.843	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)Cn1ccc2ccccc21)c1cccc(S(=O)(=O)N(C)C)c1	729609981	RKIQXIHJYWFFCD-HNNXBMFYSA-N	443.529	1.983	50	20	IDGD	
C=CCNS(=O)(=O)c1cc(C(=O)NNC(=S)Nc2ccc(OC)nc2)ccc1F	729692046	IOSXNIREYSREPH-UHFFFAOYSA-N	439.494	1.325	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)Cn1cnc2ccc(Br)cc2c1=O	730032513	ACHBBMIDBUETTL-UHFFFAOYSA-N	445.273	1.645	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)[C@H]3CCCCN3C)c2)cc1	731865184	HTLBTUKBVVLLNS-LJQANCHMSA-N	446.529	1.741	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)Cn1cnc2c(c(Br)nn2C)c1=O)c1ccccc1	731999245	NNLCXDRESFCZNA-LBPRGKRZSA-N	447.293	1.234	50	20	IDGD	
COc1ccc(N2C[C@H](C(=O)NNc3nc4ccccc4c(=O)n3C)CC2=O)c(OC)c1	733263491	FWZAWEQOXVPBGY-CYBMUJFWSA-N	437.456	1.447	50	20	IDGD	
CN(CCCC(=O)NNc1nc2ccccc2c(=O)n1C)S(=O)(=O)c1ccc(F)cc1	733263876	SNYZZMIBVZSDIZ-UHFFFAOYSA-N	447.492	1.617	50	20	IDGD	
CN(CC(=O)NNC(=O)c1ccccc1)C[C@@H](O)COc1ccc(C(F)(F)F)cc1	733996359	GARHKHRTJWJGFX-MRXNPFEDSA-N	425.407	1.838	50	20	IDGD	
O=C(NNc1ncccc1Cl)[C@@H]1CCCN1S(=O)(=O)c1cccc([N+](=O)[O-])c1	734247575	QBCXGHWXGBSXGG-AWEZNQCLSA-N	425.854	1.940	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNS(=O)(=O)c1ccc(Oc2ccccc2Cl)cc1	734743104	KOTQKCRLPUICSW-NSHDSACASA-N	447.922	1.380	50	20	IDGD	
Cn1cc(C(=O)NN=C2C(=O)N(Cc3ncon3)c3ccc(Br)cc32)cn1	735412882	CKHSYOKFVCGKJN-UHFFFAOYSA-N	430.222	1.247	50	20	IDGD	
Cc1nn(C)cc1[C@@H](C)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	739033941	HNYPRXRUTKJGOK-CQSZACIVSA-N	448.549	1.608	50	20	IDGD	
NC(=O)CC(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2cccc(C(F)(F)F)c2)c1	740749968	ZKTRMEYUBGRYOV-UHFFFAOYSA-N	444.391	1.143	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)[C@H]1CCCN1C(=O)c1cc(Cl)ccc1OC	740851241	VZUILABCUMIJBK-OAHLLOKOSA-N	438.912	1.405	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)c1ccc(NS(=O)(=O)c2ccccc2)cc1	740851710	RQSHTJKPJYQKEQ-UHFFFAOYSA-N	432.502	1.553	50	20	IDGD	
C[C@@H]1Cc2cc(S(=O)(=O)NNC(=O)c3cc([N+](=O)[O-])ccc3O)cc(Cl)c2O1	743268041	BASHOAJLXNHBCQ-MRVPVSSYSA-N	427.822	1.901	50	20	IDGD	
O=C(CCNC(=O)c1n[nH]c2ccccc12)NNC(=O)c1cc(Br)ccc1O	743733883	RYWSWCUTNICCBD-UHFFFAOYSA-N	446.261	1.612	50	20	IDGD	
CSc1nc(C2CC2)nc(C)c1C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	746094261	USOPEPOIBPJVCY-UHFFFAOYSA-N	449.558	1.709	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2ccc(C(=O)NNC(=O)c3ccc(C#N)cc3)cc2)C[C@H](C)O1	747175676	FUQHBLLWKMVWNU-GJZGRUSLSA-N	442.497	1.431	50	20	IDGD	
Cc1nc(C(=O)NNC(=O)c2cccc3cccnc23)nn1-c1n[nH]c(C(F)(F)F)n1	747371761	YARDHTCDJONLQT-UHFFFAOYSA-N	431.338	1.336	50	20	IDGD	
CCCc1c(C(=O)NNc2nccn(C)c2=O)nnn1Cc1cccc(Br)c1	747942036	KYMOZLAWMHKGQG-UHFFFAOYSA-N	446.309	1.892	50	20	IDGD	
O=C(Cc1ccc(S(=O)(=O)N2CCOCC2)s1)NNc1cccc([N+](=O)[O-])c1	748004864	SGZRMVVKGZWAHK-UHFFFAOYSA-N	426.476	1.363	50	20	IDGD	
CC(=NNC(=O)C(=O)N1CCCC1)c1ccc(S(=O)(=O)NCc2ccc(F)cc2)cc1	748137597	OMNDNNROXSNEHY-UHFFFAOYSA-N	446.504	1.767	50	20	IDGD	
O=C(NC[C@H](c1ccccc1)N1CCc2sccc2C1)NNC(=O)C(=O)N1CCCC1	748453947	OVBKQMYLPYYYRA-GOSISDBHSA-N	441.557	1.800	50	20	IDGD	
O=C(COc1ccc(OCc2ccccc2)cc1)NNC(=O)[C@H]1CC(=O)N(c2cn[nH]c2)C1	748837283	BYZLLAIPKCLGKL-KRWDZBQOSA-N	449.467	1.568	50	20	IDGD	
C[C@H](C(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1)N1CCSCC1	750914828	RCQSDTHTSXVINC-MRXNPFEDSA-N	440.013	1.042	50	20	IDGD	
C[C@]1(c2ccc(C(=O)NNC(=O)c3cc(Br)ccc3O)cc2)NC(=O)NC1=O	751069956	UIKYUIOUWDWEIX-GOSISDBHSA-N	447.245	1.284	50	20	IDGD	
CSCCNC(=S)NNC(=O)C1CCN(S(=O)(=O)c2ccc(C)cc2)CC1	752734193	MYZBOKBJPBIEIQ-UHFFFAOYSA-N	430.621	1.254	50	20	IDGD	
C[C@H](Cc1cc(Br)ccc1F)NC(=O)NNC(=O)CNC(=O)c1ccco1	754851777	WYCYZCZEVAPMRT-SNVBAGLBSA-N	441.257	1.873	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)Nc1ccc(S(=O)(=O)N2CCC(C)CC2)cc1	755422434	KHGUDXIWYGSPSZ-HNNXBMFYSA-N	442.538	1.311	50	20	IDGD	
CS(=O)(=O)CCn1ccc(NC(=O)NNC(=O)c2ccc(F)cc2Br)n1	756759821	MKQHTKCGASARMS-UHFFFAOYSA-N	448.274	1.296	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)c2cncc(I)c2)c1	756864631	UTMGMALZZSHCNO-UHFFFAOYSA-N	427.198	1.778	50	20	IDGD	
Cc1ccc(S(=O)(=O)Nc2ccc(F)cc2)cc1C(=O)NNc1ccc(C(N)=O)nn1	757403883	HNJWBRLUWUQWOS-UHFFFAOYSA-N	444.448	1.581	50	20	IDGD	
O=C(CCNS(=O)(=O)c1cccc(Br)c1)NN=c1cc[nH]cc1Cl	757417778	LCQKVQFDKPHITO-UHFFFAOYSA-N	433.715	1.731	50	20	IDGD	
Cc1nn([C@@H]2CCS(=O)(=O)C2)c(C)c1NC(=O)NNC(=O)Cc1c[nH]c2ccccc12	757872011	RYVWLYKZQAEAHD-OAHLLOKOSA-N	444.517	1.736	50	20	IDGD	
CCCN(CC)c1ccc(C(=O)N2CCN(S(=O)(=O)CBr)CC2)cn1	758528554	WBZYRLHAZPEUKZ-UHFFFAOYSA-N	433.372	1.758	50	20	IDGD	
O=C(CN1CCN(Cc2cccc(Cl)c2)C(=O)C1)NNC(=O)c1ccc([N+](=O)[O-])cc1	758755921	SYNHSCTYOQZCIR-UHFFFAOYSA-N	445.863	1.354	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)N[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1C#N	758758497	IKCXMKNMMMPUHC-KBPBESRZSA-N	427.465	1.346	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H](C#N)[C@H](NC(=O)NNC(=O)c2ccc3c(c2)OCCO3)C1	758759362	LHDDJHZRPMRLCG-UONOGXRCSA-N	431.449	1.161	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NC[C@H](C)CC2(C)OCCO2)c2ccccc2c1=O	758851155	CWSYLKHABKFGHN-OAHLLOKOSA-N	445.520	1.930	50	20	IDGD	
C[C@@H]1CN(S(=O)(=O)c2cc(C(=O)NNc3ncc(F)cn3)ccc2Cl)C[C@@H](C)O1	760922056	AUZBDAHXRUSXEK-GHMZBOCLSA-N	443.888	1.824	50	20	IDGD	
COc1ccc(C=NNC(=O)Cn2nnc(-c3ccccc3)n2)c(Br)c1O	760997947	XTOWTLQWTTXVMD-UHFFFAOYSA-N	431.250	1.967	50	20	IDGD	
Cn1c(=O)c2c(ncn2CC(=O)NN=Cc2ccc(F)c(Cl)c2Cl)n(C)c1=O	761829101	RLRKAVBQCCOREO-UHFFFAOYSA-N	427.223	1.030	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)NCC(=O)N1CCCc2ccccc21	763485520	KATRZTNOCBRUNZ-UHFFFAOYSA-N	433.509	1.601	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2ccn(-c3ccccc3Cl)n2)c1	763623664	FDHSJRSJSBVCNI-UHFFFAOYSA-N	427.848	1.999	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(C(=O)NC(C)C)c(C)c2)cc1	763661216	LXKRIKDWJKFCCO-UHFFFAOYSA-N	442.472	1.307	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccccc2O[C@@H]2CCOC2)cc1	763661320	MUDIGXWQLBZNEY-MRXNPFEDSA-N	429.429	1.028	50	20	IDGD	
O=C(COc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1ccc(-n2cncn2)c(Cl)c1	763687107	ZMBAPROTHCKCQP-UHFFFAOYSA-N	449.254	1.739	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2ccccc2-c2noc(C)n2)c1	763772005	KFGSYQAHQXKIAK-UHFFFAOYSA-N	425.401	1.462	50	20	IDGD	
CC1CCN(c2cccc(NC(=O)C(=O)NNC(=O)c3nnc(O)c4ccccc34)c2)CC1	763791403	QVTTUJAWKSTAPB-UHFFFAOYSA-N	448.483	1.971	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(N3C[C@H](C)O[C@H](C)C3)cc2)cc1	763809927	VVSHAUQUGLNAMZ-CALCHBBNSA-N	440.500	1.774	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(S(=O)(=O)NC3CC3)cc2)cc1	763831608	PREUGWZAMVKUJI-UHFFFAOYSA-N	430.486	1.089	50	20	IDGD	
CCN(CC)c1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(C(C)=O)cc2)cn1	763877453	KAWXUYRPPYDTMJ-OAHLLOKOSA-N	441.488	1.684	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2cccc3c2CN(c2ccccn2)C3)n1	763893428	VBMLGABNVCYSGK-UHFFFAOYSA-N	433.472	1.201	50	20	IDGD	
O=C(NNC(=O)c1ccc(Br)s1)C(=O)Nc1cnn(-c2ccccc2)n1	763938414	FLPICLOONVTRPV-UHFFFAOYSA-N	435.263	1.491	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CC[C@@H](C)C3)cc1-n1cnnn1	763951034	YRCYZWHYMBLMSZ-LLVKDONJSA-N	439.501	1.557	50	20	IDGD	
Cc1ccc(C(=O)NC2CC2)cc1NC(=O)C(=O)NNC(=O)c1cc(Br)c[nH]1	763995928	SFENLELVPYVIQQ-UHFFFAOYSA-N	448.277	1.378	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1cccc(Cn2cccn2)c1	764019532	OUGVYLSGFCPFAK-UHFFFAOYSA-N	427.848	1.993	50	20	IDGD	
CS(=O)(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)c2cccc3ccccc23)cc1F	764047138	AXVGFDABYYEIIR-UHFFFAOYSA-N	443.456	1.923	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc(CCC(=O)N2CCCC2)cc1	764048298	NSNDNXZXGYZXFK-UHFFFAOYSA-N	438.484	1.650	50	20	IDGD	
O=C(NNC(=O)c1cccc(Br)c1)C(=O)Nc1cccnc1-n1cccn1	764063867	ZFSFDJGQGSBPPP-UHFFFAOYSA-N	429.234	1.430	50	20	IDGD	
C[C@@H]1CCCCN1CC(=O)Nc1ccc(F)c(NC(=O)C(=O)NNC(=O)c2ccoc2)c1	764159527	XXLPWGAQEVSCAF-CYBMUJFWSA-N	445.451	1.631	50	20	IDGD	
Cc1cc(C(=O)N2CCOCC2)ccc1NC(=O)C(=O)NNC(=O)CCc1ccccc1	764191568	AWMCZAZUUNPDRB-UHFFFAOYSA-N	438.484	1.186	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)CC(C)(C)C)c(OCC(F)(F)F)c1	764202618	WMXYAZFVLPIKHJ-UHFFFAOYSA-N	433.383	1.936	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)C(=O)Nc1ccc(C(F)(F)F)nc1	764204569	PHTVYDNLCRKVFY-UHFFFAOYSA-N	433.387	1.491	50	20	IDGD	
CN(C)CCOc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(OC(F)F)c2)cc1	764251813	ZCYFNBPCUCENIP-UHFFFAOYSA-N	436.415	1.628	50	20	IDGD	
Cc1cc(C(=O)N2CCC[C@@H](C)C2)ccc1NC(=O)C(=O)NNC(=O)Cc1cccnc1	764265898	HBNZJZWOUWNYET-OAHLLOKOSA-N	437.500	1.591	50	20	IDGD	
Cc1cc(C)n(-c2ccc(C(F)(F)F)cc2NC(=O)C(=O)NNC(=O)Cc2cc[nH]n2)n1	764297165	MKVMFGJZVGHAII-UHFFFAOYSA-N	449.393	1.560	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)c(Cl)c1)C(=O)Nc1ccccc1CN1C(=O)CCC1=O	764349711	TYEIKUDHOHRFKU-UHFFFAOYSA-N	444.831	1.094	50	20	IDGD	
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC(=O)C(=O)NNC(=O)c2cnn(C)c2)cc1	764360452	YCJQAQUDXDZYDA-LBPRGKRZSA-N	430.465	1.406	50	20	IDGD	
CC(C)(C)NC(=O)c1ccccc1NC(=O)C(=O)NNC(=O)COCc1ccccc1	764366587	NNTXQVWNCNBTBK-UHFFFAOYSA-N	426.473	1.518	50	20	IDGD	
O=C(CCNC(=O)c1ccc([N+](=O)[O-])cc1)NNC(=O)c1cc(-c2cccs2)[nH]n1	765566466	WZHLHAORAJJIGX-UHFFFAOYSA-N	428.430	1.628	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)C[C@@H]3C[C@H]4CC[C@H]3C4)CC2)cc1	765728592	MCXMYZUCJRBYEC-FHWLQOOXSA-N	448.589	1.275	50	20	IDGD	
CN1CC(=O)N(CCCC(=O)OCC(=O)C(C#N)=C2N(C)c3ccccc3N2C)C1=O	767272887	BBSDCEOLURXKRB-UHFFFAOYSA-N	425.445	1.094	50	20	IDGD	
Cc1cccc(NC(=S)NNC(=O)[C@H](C)NS(=O)(=O)c2ccc(C#N)cc2)c1C	767854674	KDRDWVINMVYURA-AWEZNQCLSA-N	431.543	1.860	50	20	IDGD	
COc1cc2c(cc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccccc1F)NC(=O)CC2	768238633	SAMBYPPKHFXUSR-NSHDSACASA-N	444.419	1.272	50	20	IDGD	
CCn1c(SCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)nnc1-c1ccccn1	768412910	VHJCRELPNYMHQB-UHFFFAOYSA-N	427.446	1.822	50	20	IDGD	
C[C@H](NC(=S)NNC(=O)CN1C(=O)N[C@](C)(c2ccc(F)c(Cl)c2)C1=O)C1CC1	770247418	WTJSYIXUFUUHIW-NIVTXAMTSA-N	441.916	1.540	50	20	IDGD	
CC(=O)N1CCN(S(=O)(=O)c2cccc(C(=O)OC[C@H](C)CBr)c2)CC1	770326039	RJQTURVDPGOZEH-CYBMUJFWSA-N	447.351	1.727	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)NNC(=O)[C@H](C)Oc1cccc(Cl)c1	770480862	KXQCJQUVOMKQEO-LBPRGKRZSA-N	430.852	1.739	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@@H](NS(C)(=O)=O)C(C)(C)C)ccc1OCCC(C)C	770646026	XEKNFVRJKGNNBE-QGZVFWFLSA-N	443.566	1.845	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)C3CCN(c4oc(-c5ccco5)nc4C#N)CC3)nc21	770967048	COVUIEVPDKKPJW-UHFFFAOYSA-N	449.431	1.548	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)c3cccc(S(=O)(=O)NC4CCCC4)c3)nc21	770971082	GCBTXGPSXSQUFR-UHFFFAOYSA-N	431.478	1.047	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)NCc2nc(COc3ccccc3)n[nH]2)cc1C	771378915	SGJQBIICEALTSL-UHFFFAOYSA-N	437.460	1.470	50	20	IDGD	
Cc1nc2c(c(C)nn2C)c(C)c1CC(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772885072	UNNWKBDPHIKAQH-UHFFFAOYSA-N	442.907	1.553	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)[C@H]1CN(C(=O)OC(C)(C)C)CCO1	772964044	OHXAKOCGTFNZKC-IUODEOHRSA-N	427.885	1.891	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNS(=O)(=O)c2cc(C)c(C)s2)cc1	773227048	PNVUQDMYIMXLFH-UHFFFAOYSA-N	431.561	1.304	50	20	IDGD	
COC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(NC(=O)NNc3ncccn3)cc2)C1	775468539	RUFIYLFDDDZDJO-ZDUSSCGKSA-N	434.478	1.199	50	20	IDGD	
CCNS(=O)(=O)c1ccc2c(c1)N(C(=O)C(=O)NNc1nc3ccccc3s1)CC2	782811861	ADESGYRNQXWUDF-UHFFFAOYSA-N	445.526	1.627	50	20	IDGD	
NS(=O)(=O)c1cc(F)cc(NC(=O)C(=O)NNc2ccc(Br)cc2)c1	783009815	ZFJRTTSYVQJJAD-UHFFFAOYSA-N	431.243	1.317	50	20	IDGD	
Cn1c(=NNC(=O)C(=O)Nc2cnn(-c3cnc4ccccc4n3)c2)sc2ccccc21	783351795	MKYNENAYAZJCJV-UHFFFAOYSA-N	444.480	1.939	50	20	IDGD	
CS(=O)(=O)CCOc1cccc(NC(=O)C(=O)NNc2nccc3sccc23)c1	783445563	TZSDYVBGPZCLIT-UHFFFAOYSA-N	434.499	1.802	50	20	IDGD	
CC(C)(C)OC(=O)N1CCc2[nH]nc(C(=O)NNc3nc(-c4cccnc4)no3)c2C1	783621673	OZQBUQOGDVRELE-UHFFFAOYSA-N	426.437	1.905	50	20	IDGD	
Cc1nc2cc(NC(=O)C(=O)NNc3ccc(S(=O)(=O)NC4CC4)cc3)ccc2o1	784210605	XSVCNLKBEMHYHV-UHFFFAOYSA-N	429.458	1.659	50	20	IDGD	
CNC(=O)[C@H]1CN(C(=O)C(=O)NNc2ccc(Br)cc2C)c2ccccc2O1	784412898	KYEHZJXUDJEWHO-MRXNPFEDSA-N	447.289	1.741	50	20	IDGD	
Cc1ccc(Cn2nccc2NC(=O)C(=O)NNc2cccc(S(C)(=O)=O)c2)s1	784838942	APYBUCYWXBFQCA-UHFFFAOYSA-N	433.515	1.787	50	20	IDGD	
O=C(NNc1cccnc1Cl)C(=O)Nc1ccccc1OCC(=O)N1CCOCC1	784847835	FVLXPDZHEJGBTL-UHFFFAOYSA-N	433.852	1.054	50	20	IDGD	
CNC(=O)CCOc1ccc(NC(=O)C(=O)NNc2nc(C(F)(F)F)cs2)cc1	785145640	KZNKSFOBZGIJEN-UHFFFAOYSA-N	431.396	1.759	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)[C@@H](O)Cc1cccc(C(F)(F)F)c1	785742765	ZKRXVRYAQJYKQX-KRWDZBQOSA-N	438.402	1.851	50	20	IDGD	
CCOC(=O)c1cnn(C)c1NC(=O)C(=O)NNc1c(F)cc(F)cc1Br	786429981	RJHOZKZEVZEQHN-UHFFFAOYSA-N	446.208	1.719	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N2CCN(C(=O)COC(=O)/C(C#N)=C\C3CC3)CC2)cc1	786679790	RFMQEDHYTACYRC-LGMDPLHJSA-N	447.513	1.321	50	20	IDGD	
Cc1cccc(S(=O)(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)c1F	788915424	KWONCSBAFDVUFF-UHFFFAOYSA-N	430.502	1.932	50	20	IDGD	
CN(C)[C@H]1CCOc2c(NC(=O)C(=O)NNC(=O)Cn3ccc4ccccc43)cccc21	789735732	UKISCYKLCVWYOB-IBGZPJMESA-N	435.484	1.813	50	20	IDGD	
CCc1nc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3OC)[nH]n2)sc1C	789739257	KGMBCCAFTDOMMC-UHFFFAOYSA-N	428.474	1.812	50	20	IDGD	
COc1cc(NNC(=O)C(=O)Nc2ccc(CC(=O)N3CCOCC3)cc2)ccc1Cl	789796152	KVRLRCDUNXNNPE-UHFFFAOYSA-N	446.891	1.832	50	20	IDGD	
CCCCNC(=O)CN1CCN(C(=O)/C(C#N)=C/c2cc(C)n(CCOC)c2C)CC1	790222267	NTYSVTUJMRNSPU-RCCKNPSSSA-N	429.565	1.719	50	20	IDGD	
COc1ccc(S(=O)(=O)NCCC(=O)NNc2cccc(F)c2[N+](=O)[O-])cc1OC	790594978	SGXSLMLANOGOFU-UHFFFAOYSA-N	442.425	1.563	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2cccc3c2OCC[C@H]3OC)c1	790952883	XDERLQMJWDKFOT-QGZVFWFLSA-N	429.429	1.574	50	20	IDGD	
Cc1ccn(-c2ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc3ccc(F)cc3)cc2)n1	793021245	AIGGFHBITPUSNG-CQSZACIVSA-N	425.420	1.873	50	20	IDGD	
C[C@@](O)(CN1C(=O)NC2(CCCC2)C1=O)C(=O)NNc1ccc(Br)cc1F	793706978	QHEOFHIWKHMTMT-MRXNPFEDSA-N	443.273	1.647	50	20	IDGD	
O=C(CCCc1ccc2nc(O)[nH]c2c1)NNC(=O)CNC(=O)OCc1ccccc1	794063306	KVIWNQBIZLRNRD-UHFFFAOYSA-N	425.445	1.665	50	20	IDGD	
Cc1cccc(C(=O)NNS(=O)(=O)c2ccc(NS(=O)(=O)C(C)C)c(F)c2)n1	794599819	PDDIRWJPYHZUGQ-UHFFFAOYSA-N	430.483	1.303	50	20	IDGD	
COC(=O)C1=CC(C(C)=NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)=S=C1	794877545	TXFMLIZQKFNBFJ-UHFFFAOYSA-N	435.527	1.398	50	20	IDGD	
O=C(NNc1cccc(F)c1)C(=O)Nc1cnc(N2CCOCC2)c(Br)c1	799259729	BSQKROCCYBBEHG-UHFFFAOYSA-N	438.257	1.902	50	20	IDGD	
C[C@@H]1CCNC(=O)[C@H]1NC(=O)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1	799368053	RFASNZHPKRSWGW-CZAAIQMYSA-N	435.528	1.469	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N[C@H]2CCCN(C(=O)Cc3ccccc3)C2)cc1OC	800987207	SKYAHKYIQDKXNO-SFHVURJKSA-N	440.500	1.882	50	20	IDGD	
C[C@@H]1NC(C(=O)NNC(=O)Nc2ccc(Br)cc2)=NN(c2ccccc2)C1=O	801997253	VUEXRRXVHDASOL-NSHDSACASA-N	445.277	1.940	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(F)(F)F)nc2C)cc1OC	802565983	UBDIQOTXZONRMC-UHFFFAOYSA-N	426.351	1.826	50	20	IDGD	
CC(=O)NCCNC(=O)CCC(=O)NNc1ccc(-c2cccc(C(F)(F)F)c2)nn1	804207793	PBGVZBFWXOQTBU-UHFFFAOYSA-N	438.410	1.638	50	20	IDGD	
COc1cc(C)c(NC(=O)C(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])c(C)c1C	806974950	ZPODJNYKSRAZBV-UHFFFAOYSA-N	430.417	1.694	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2scc(C)c2C(=O)OC)cc1OC	806975066	MKMFQCGOQQWPAZ-UHFFFAOYSA-N	435.458	1.650	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)[C@H](NC(=O)c2ccccc2)c2ccccc2)c1	807116287	KEPBOANMNVCIGM-HXUWFJFHSA-N	431.452	1.972	50	20	IDGD	
C=CCNC(=S)NNC(=O)c1csc(S(=O)(=O)N2CCc3ccccc3C2)c1	810450623	PRNFKZXDRWKMFA-UHFFFAOYSA-N	436.584	1.790	50	20	IDGD	
COC(=O)Cc1occ(C)c1C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	810461707	DXVZSFRTFNUKKT-UHFFFAOYSA-N	437.474	1.081	50	20	IDGD	
C[C@@H](CS(=O)(=O)c1ccc(F)cc1)C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	812730266	BPDHQMKPSQKXQK-ZDUSSCGKSA-N	443.522	1.629	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)CCNC(=O)c2ccc([N+](=O)[O-])cc2)cc1	812731724	RRDZZQFYMCKRRJ-UHFFFAOYSA-N	435.462	1.108	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2cc(C(F)(F)F)ccn2)cc1	813033292	MNMLCKZNAUDUEB-UHFFFAOYSA-N	431.396	1.433	50	20	IDGD	
O=C(NNC(=O)N1CCN(C(=O)c2ccco2)CC1)c1ccc(Br)s1	813539418	NUQATFOURSHEIG-UHFFFAOYSA-N	427.280	1.916	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNS(=O)(=O)c2sc(C)cc2C)cc1	814209748	CYWDRKDUGIATFZ-UHFFFAOYSA-N	431.561	1.304	50	20	IDGD	
CN(Cc1ccccc1S(N)(=O)=O)C(=O)NNC(=O)c1cccc(Br)c1	814306717	HCEIMHZWIBWUPH-UHFFFAOYSA-N	441.307	1.583	50	20	IDGD	
CCOC(=O)c1ccc(C(=O)NNC(=O)c2ccc(CSc3nncn3C)cc2)nc1	814718024	ZFBXDTDORDKUNW-UHFFFAOYSA-N	440.485	1.754	50	20	IDGD	
CCC(=NNC(=O)c1csc(N2CCOCC2)n1)c1ccccc1OCC(=O)N(C)C	814751570	OLVKWQCPMYYJPP-UHFFFAOYSA-N	445.545	1.991	50	20	IDGD	
CC(=NNC(=O)[C@@H](C)Oc1cccc(Cl)c1)c1ccc(S(=O)(=O)CC(N)=O)cc1	814916401	HYBYXZIDKGLXMQ-CYBMUJFWSA-N	437.905	1.907	50	20	IDGD	
CNC(=O)c1cc(Oc2cccc(NC(=O)C(=O)NNC(=O)CC(C)(C)C)c2)ccn1	815568446	HZSDVWCPYXNIAR-UHFFFAOYSA-N	427.461	1.756	50	20	IDGD	
CC(C)n1ncc2cc(NC(=O)C(=O)NNc3ccccc3S(=O)(=O)N(C)C)ccc21	815751831	QFUGGIGQIWNTQH-UHFFFAOYSA-N	444.517	1.949	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)CNC(=O)N1CCc2ccccc2C1	817052480	CMVHQMYESAWJDA-UHFFFAOYSA-N	431.518	1.148	50	20	IDGD	
CC(C)(C)C(=O)NCCCC(=O)NNC(=O)CN1c2cccc3cccc(c23)S1(=O)=O	822775135	KVFJXTJKJITILJ-UHFFFAOYSA-N	446.529	1.438	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1cc(C)nc2c1c(C)nn2C	899609285	LFROYFYQLUGDOJ-UHFFFAOYSA-N	445.863	1.865	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNS(=O)(=O)c2ccc3oc(=O)ccc3c2)cc1	903939482	RKAOAVYQOVWELD-CYBMUJFWSA-N	432.454	1.969	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)c2cc(-c3ccco3)nc3c(C(N)=O)ncn23)c2ccccc21	913082670	ZHRDGODYYBPTIN-UHFFFAOYSA-N	443.423	1.655	50	20	IDGD	
Cc1nc2c(C#N)cnn2c(C)c1CCC(=O)NNC(=O)c1cc(Br)c[nH]1	914781109	BDXHQCZEEFKQQY-UHFFFAOYSA-N	430.266	1.702	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)c2cc(S(=O)(=O)NCCOC)ccc2Cl)cc1	915784008	VKURRBGGKSAGOK-UHFFFAOYSA-N	439.921	1.902	50	20	IDGD	
CC(=O)Nc1cccc(CNC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c1	916373460	CLNFPAHIMJKTAA-UHFFFAOYSA-N	438.532	1.688	50	20	IDGD	
CN(C)c1ccc(CNC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cn1	916444254	PEXKYRDBIWSMSC-UHFFFAOYSA-N	425.537	1.190	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)[C@@H]1COc2ccccc2O1)N1CCN(c2ccccc2)CC1	916514603	HLMGLASXGBZXHA-UTKZUKDTSA-N	439.516	1.368	50	20	IDGD	
CCC(=O)Nc1cccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1	916726681	UJMXBXQHEHBRPK-UHFFFAOYSA-N	444.513	1.894	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNS(=O)(=O)c2ccc(OC)c(C(=O)O)c2)cc1	917725931	WZUQAUBFUUVEDT-LBPRGKRZSA-N	438.458	1.569	50	20	IDGD	
Cc1ccc(-c2noc(CCC(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)n2)cc1F	918205004	XQXPAJJNKOFJQJ-UHFFFAOYSA-N	436.407	1.554	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)[C@@H](C)NC(=O)C2CCCCC2)c2ccccc2c1=O	918409360	LGDHIAAWPILAFG-CQSZACIVSA-N	427.505	1.823	50	20	IDGD	
O=C(NCc1ccccc1-n1ccnc1)NNC(=O)c1csc(N2CCOCC2)n1	919920668	JYORQEHKKPMRKM-UHFFFAOYSA-N	427.490	1.310	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)NCc1cccc(C(=O)NC[C@H]2CCCO2)c1	920346765	BUOWBMWTZPIOCA-LJQANCHMSA-N	444.463	1.644	50	20	IDGD	
Cc1nn(C(F)F)c(C)c1CC(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	920920338	UICOXZCHCLSHMM-UHFFFAOYSA-N	425.348	1.350	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)CC1(CC(=O)N2CCOCC2)CCCC1	1251659741	HQFQBOQEHRELJS-UHFFFAOYSA-N	426.517	1.988	50	20	IDGD	
Cc1cc2nnc(C(=O)N3CC[C@H]4OCCC[C@@]4(CNC(=O)[C@@H](F)Cl)C3)c(C)n2n1	1778025560	DTELMEFAPVSTAH-VVFCZOMOSA-N	438.891	1.403	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H]3Cc4ccccc4O3)C2)C1	1778249575	UXRFAWFVDVSYNU-KNBMTAEXSA-N	437.334	1.994	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)/C=N/O[C@@H]3CCCCO3)C2)C1	1779105080	IGGCAUSHPWYHRF-QAXHHPHWSA-N	446.342	1.519	50	20	IDGD	
Cc1nc[nH]c1CSCC(=O)N1CCO[C@]2(CCN(C(=O)CO[Si](C)(C)C)C2)C1	1779297073	QCVSDRDSQJKHDQ-IBGZPJMESA-N	440.642	1.633	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCNC(=S)NC)C1	1779375888	NRHIYAQUWCBPHB-SPYBWZPUSA-N	433.018	1.392	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(N(C)C)nc3)C2)C1	1779759509	CBVSLNFXTNWSTD-AUUYWEPGSA-N	439.354	1.622	50	20	IDGD	
Cc1noc(N)c1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Br)C1	1780771601	MVBUXHYVDJOYGZ-NSODJVPESA-N	433.278	1.383	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](C)NC(=O)c3ccc(F)cc3)C2)C1	1780907216	VHEACKVIZSONST-XXHMAFKTSA-N	439.915	1.791	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)COc3ccc(C(=O)OC)cc3)CCO2)C1	1781226510	ZPGKOGGMLFFNNJ-DYESRHJHSA-N	438.908	1.699	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)Cc3ccc(OC)cc3[N+](=O)[O-])C2)C1	1781412081	TWWQXRIAUJPYMD-JXFKEZNVSA-N	439.896	1.993	50	20	IDGD	
COC(=O)C1(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](F)Br)C3)CC1	1781812255	VNJATBGTHVCBOD-XHBSWPGZSA-N	435.290	1.144	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CN1CCOCC1)C2	1781899904	HDBYZUCLGXFMAT-FRQCXROJSA-N	446.386	1.006	50	20	IDGD	
O=C(CCc1ncc[nH]1)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCBr)C2	1782402568	HQBGRVWPMYBDNL-RDTXWAMCSA-N	427.343	1.641	50	20	IDGD	
COc1ncc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](C)Br)C3)C2)cc1F	1783532679	RHJUINFAIFWOMC-DIFFPNOSSA-N	430.274	1.456	50	20	IDGD	
C=C1C[C@@H](C(=O)N2CC[C@]3(CN(C(=O)[C@@H](F)Cl)CCO3)C2)N(C(=O)OC(C)(C)C)C1	1784089346	BNZIBRDCMVLUOC-BXTJHSDWSA-N	445.919	1.916	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)Cc3ccc(F)cc3OC)C2)C1	1785660244	GSPYXCSTHYWOCP-OXJNMPFZSA-N	428.888	1.461	50	20	IDGD	
CN(C)c1ncc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCBr)C[C@@H]32)o1	1785883211	HKVJUDQRVLPEPF-AVGNSLFASA-N	429.315	1.119	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnn4ncccc34)C[C@@H]21	1786405827	DDANIEAEXAYQCW-NOLJZWGESA-N	436.310	1.108	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3cscn3)[C@H]2C1	1787037615	VYOMSNMBGAGZIK-JURCDPSOSA-N	430.368	1.696	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)c1cccc(-c2cnccn2)c1	1789263033	MVVHYMAFVKZARO-ZULIPRJHSA-N	444.919	1.337	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21	1789871782	FJNXJDJTBZTJPA-VITBEWHZSA-N	434.133	1.893	50	20	IDGD	
Cc1n[nH]c(C)c1CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21	1789975716	YXOASSOPCRSQQY-BPUTZDHNSA-N	427.343	1.334	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)ccc3F)C[C@@H]21	1791060844	JXEWQYZPHIECIR-KHJVZFFJSA-N	429.286	1.908	50	20	IDGD	
CSc1ccc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](O)CCl)C[C@@H]32)cc1	1791452947	GWLBFOZEFFRPDD-OWLYRPNTSA-N	426.966	1.530	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1(C)CCCC1	1792589420	QTVHRIBKLIMFEC-XLYDMXJNSA-N	429.521	1.290	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)c1cc(Br)ccc1F	1792692760	DROCDBKBPBYJPY-ANGCBRKESA-N	449.704	1.391	50	20	IDGD	
CC[C@H](O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](Br)Cc1ccccc1)C2	1792864869	DMPADPZMPVZNCN-MDMSPXHWSA-N	439.350	1.353	50	20	IDGD	
Cc1noc(C)c1CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Br)C2	1794139464	CGVGWIQVCASBJI-MJRMRKOOSA-N	428.327	1.597	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1c(F)ccnc1Cl	1794238245	AOSHEWBPQYWSRK-XHSYRHOGSA-N	434.693	1.861	50	20	IDGD	
CS(=O)(=O)c1ccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)C(Cl)Cl)C3)cc1	1795415776	GFJMFLVDDKRZJG-YWVIFJGQSA-N	449.356	1.026	50	20	IDGD	
CN(C)C(=O)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](Br)Cc1ccccc1)C2	1795904240	XIMZZJGKXKZKGS-YYIAUSFCSA-N	436.350	1.719	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nc3ccc(C(F)(F)F)cn3n1)C2)[C@H](F)Cl	1796363410	RHGCXVAYDAQQTB-FQPOAREZSA-N	449.792	1.486	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H]1C[C@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Cl)C1	1796370931	PBMPTPKCNUDISW-QAUDVVSPSA-N	433.908	1.414	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C=C/C(=O)c1cccs1	1796446367	OZKZJKHMCYDJJL-OZAHNZTQSA-N	436.606	1.928	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2)c1ccnc(Br)c1	1798020821	BYEMUZQGIQYMTG-PEGIJTEDSA-N	437.121	1.851	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3cn[nH]c3cn1)C2	1799276736	PPLYFKFMGCBWNI-ABXQLRGKSA-N	426.304	1.397	50	20	IDGD	
CN(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H]1CC1(F)F)C2)NC(=O)NCc1ccccc1	1799871435	DVYRBMDVOLOOME-XMTFNYHQSA-N	449.502	1.626	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1C=CCN1)C2)[C@@H](Br)Cc1ccccc1	1800436596	ZDQXRFVXHPEWTN-PJVZLEMVSA-N	448.361	1.110	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCOc1ccccc1)C2	1800758104	PBDOJFOELPUDBR-AFIMGQEJSA-N	425.323	1.829	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1c[nH]c3ncccc13)C2	1800764162	XLCSWIAWNCBJOK-LJGDNWOOSA-N	449.349	1.869	50	20	IDGD	
C[C@@H](Oc1ccccn1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2	1801361759	GQIFTXVEAIYAIJ-VWPFQQQWSA-N	426.311	1.224	50	20	IDGD	
CC(C)(C)OC(=O)N1CC2(C[C@@H]2C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](O)CCl)C3)C1	1801879966	UMGZQKBXSWBKIX-YIDVYQOGSA-N	441.956	1.481	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)C1CC(F)(F)C1	1802632654	OOSAHMKUHPKSGR-LPHOPBHVSA-N	443.259	1.126	50	20	IDGD	
C#CCCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN(C)NC(=O)NCc1ccccc1)C2	1804185401	LUSGYFNANIXIAC-ACDBMABISA-N	425.533	1.384	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2cc(OC)nn2C)[C@@H]1c1cccnc1	1804929092	PGOCRKRXYAKJFM-VKJFTORMSA-N	435.912	1.397	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1ccccc1O	1805196376	IZQNTZYYOUGDBY-GCJKJVERSA-N	445.284	1.100	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC2(CCCN(C(=O)c3sccc3F)C2)CC1	1806313063	NYQAZXLLPRJYRL-UHFFFAOYSA-N	430.310	1.726	50	20	IDGD	
Cc1csc(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)c1	1807358937	ANSBQQOOWNBYNU-RXVVDRJESA-N	449.341	1.765	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1807372596	GZTXGLDCIPNYPE-NEWSRXKRSA-N	429.713	1.098	50	20	IDGD	
CN1CCN(CCC(=O)N2CCCC3(CCN(C(=O)CO[Si](C)(C)C)CC3)C2)CC1	1809554345	LHWRLMXXVFPYAH-UHFFFAOYSA-N	438.689	1.707	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@H]1CCN(C(=O)c2nc[nH]c2[N+](=O)[O-])[C@H]1c1cccnc1	1810539925	ADSXWTLJSOQRBM-PBHICJAKSA-N	446.540	1.884	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H](CNC(=O)[C@H]2CNC(=O)C2)[C@H]1c1cccnc1	1812635452	IVAMSUKIIWYFFF-DNNBLBMLSA-N	437.338	1.255	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2cc3n(n2)CCCO3)[C@H]1c1cccnc1	1813030423	JTDREXYQGSMEGP-BXWFABGCSA-N	447.923	1.634	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2cccs2)[C@H]1c1cccnc1	1813070303	GZSVGNQYVGQFAX-UZLBHIALSA-N	429.546	1.836	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)CC[C@@H]2CCOC2)[C@@H]1c1cccnc1	1813073450	ISGCWLVMWZUJDW-HFJQGTKSSA-N	445.564	1.277	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)C2CC(F)(F)C2)n[nH]1	1814541719	OECKMUGZQNITII-AWEZNQCLSA-N	426.468	1.820	50	20	IDGD	
CC(C)(CCl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](O)N2CCOCC2)[nH]n1	1814697212	SGQDDXAIKRZSRJ-GDBMZVCRSA-N	427.933	1.317	50	20	IDGD	
C=CC[C@H](C(=C)C)C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1	1815344239	PBNXQCXJZSBSOX-IAGOWNOFSA-N	439.346	1.817	50	20	IDGD	
Cc1nnc(CCC(=O)Nc2cc([C@H]3CCCCN3C(=O)[C@@H](O)CCl)[nH]n2)s1	1815913156	NMVGFXRVBPJHAY-OLZOCXBDSA-N	426.930	1.794	50	20	IDGD	
C[C@@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1)n1cccc1	1817474859	HSCOOHYZNICCHL-HNAYVOBHSA-N	435.293	1.458	50	20	IDGD	
O=C(CCN1CCOC1=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](F)Br)CC2	1818694429	JTJYCGFTRWOERZ-PELKAZGASA-N	449.302	1.588	50	20	IDGD	
O=C(CCN1CCOC1=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](F)Br)[nH]n1	1818848440	FPJBTSRTQOIFMN-RISCZKNCSA-N	446.277	1.935	50	20	IDGD	
Cc1nc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cnccc3C(=O)NN)n[nH]2)co1	1819401874	DAUBVVKRQUCDGO-MRXNPFEDSA-N	438.448	1.324	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](F)Br)[nH]n1	1819583213	GLPXFSSFNUECJI-PUYPPJJSSA-N	430.278	1.783	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@H](F)Br)CC2)c1ccnnc1O	1821102307	TWJCFGBAPOBFDP-LDWIPMOCSA-N	430.259	1.555	50	20	IDGD	
Cc1cnc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)s1	1822412647	AXOUNZQTMRWUIS-AWEZNQCLSA-N	433.538	1.854	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(F)cn2)[nH]n1	1822413227	OYSPGTWVBKFKER-MRXNPFEDSA-N	431.472	1.623	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H]2CCNC(=O)C2)n[nH]1	1822476509	CPBCUVQSSHIGLS-YRGRVCCFSA-N	440.342	1.959	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H](N)CCC(N)=O)CC1	1824093570	OIZJLSCKYABHPD-BPUTZDHNSA-N	445.402	1.230	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC([C@@H]2CCCCN2C(=O)CCN2C(=O)C=CC2=O)CC1	1824772125	JCWLUTYLMAFHTF-SFHVURJKSA-N	449.624	1.773	50	20	IDGD	
Cc1ccc(CC(=O)N[C@@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)cn1	1826080777	YFFYQHUDHRQRLB-OAHLLOKOSA-N	444.561	1.374	50	20	IDGD	
COC(=O)CSCC(=O)N[C@@H]1CCc2nc(NC(=O)C(Cl)Cl)sc2C1	1826092643	HBPWXXYMTJOEEQ-SSDOTTSWSA-N	426.347	1.765	50	20	IDGD	
CCc1oncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1	1826172490	BDHMSOZSWQXQKI-GOSISDBHSA-N	433.553	1.843	50	20	IDGD	
O=C([C@@H]1CCCCO1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827049368	RZRHSSMVUJRTSC-SFTDATJTSA-N	428.338	1.169	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)c2ccncc2F)CC1	1827952677	MWJZKULONCZXEJ-OAQYLSRUSA-N	439.296	1.448	50	20	IDGD	
CC(C)O[C@H](C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1	1829021488	KBBZRQVSYQJEKY-OXQOHEQNSA-N	445.564	1.732	50	20	IDGD	
O=C(c1cc(Cl)cnc1O)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1829564078	PRCUKKNPXBZJLR-MRXNPFEDSA-N	438.695	1.314	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)c2[nH]cc3c2CCC3)CC1	1829584257	BVXVLDZRUUGHJL-JOCHJYFZSA-N	449.360	1.730	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C=N/N3CCCCC3)C2)C1	1830362172	NCZKJYCWWDAYOS-XLKWYTADSA-N	428.961	1.180	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)/C=N/O[C@H]3CCCCO3)C2)C1	1830365391	XFRHZFSNXVDICY-VRFIZVPASA-N	445.944	1.237	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CC[C@@H](C(=O)OC)C1)CCO2	1830706556	ILHJGJALYUBQBY-PZTGFMGMSA-N	444.956	1.440	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccccc3C(N)=O)C2)C1	1831653500	GVJRTJZZTGNGMS-DYESRHJHSA-N	437.924	1.263	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)c2cncc(O)c2)CC1	1831699671	XFJCRYSQCYMUDR-OAQYLSRUSA-N	437.305	1.014	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H](N)c2ccccn2)CC1	1831870842	GONMIWRRVLSTTP-KNQAVFIVSA-N	444.580	1.074	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@](C)(Cl)CCl)C3)C2)cn1	1831952985	PQKABZRLASENCY-RTBURBONSA-N	446.331	1.397	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ncc(F)cc3F)CCO2)C1	1831956359	ASGMKVIUVQKDPT-IFXJQAMLSA-N	431.867	1.837	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3cccc(C)c3)CCO2)C1	1832244046	YWBXWVORQKVZRL-SIKLNZKXSA-N	438.952	1.638	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCC(N2CCC(NC(=O)CN3CCCC3)CC2)CC1	1833101400	WHLOCBCXEXSAMN-HXUWFJFHSA-N	433.424	1.890	50	20	IDGD	
CCC(=O)N[C@@H](C)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1833421944	PUKCJCWULOBRKZ-BLLLJJGKSA-N	449.365	1.163	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3coc(Cl)n3)CCO2)C1	1833557908	YWXSJLWTVTVUHS-JKSUJKDBSA-N	440.711	1.634	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccccc3O)CCO2)C1	1833759270	WHLCWHACLJXTMA-HNAYVOBHSA-N	441.322	1.636	50	20	IDGD	
O=C(CCc1cccs1)N1CCOC[C@]2(C1)CN(C(=O)CCBr)CCO2	1834819228	KRRRYRQGPJFNCR-SFHVURJKSA-N	445.379	1.922	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)CNc3ccc(F)cc3)CCO2)C1	1835577409	VMJXZOAVTFNENQ-OAQYLSRUSA-N	441.931	1.959	50	20	IDGD	
O=C([C@@H](F)Br)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836717887	LMIBJLJTYNJKDL-QWHCGFSZSA-N	429.714	1.275	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)c3ccn(C)n3)CC2)CC1	1837490982	NJWOYGJSOQGVAM-CYBMUJFWSA-N	427.343	1.816	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc[nH]c4nccc3-4)C2)C1	1837711968	YEQSFFGWRIXQJY-NRFANRHFSA-N	446.580	1.436	50	20	IDGD	
CCc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@](C)(Cl)CCl)C3)C2)n(C)n1	1838044858	HICFQZLLRSWJCB-RTBURBONSA-N	447.363	1.289	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(F)cc(F)c3)CCO2)C1	1839003604	PZXVCYKZTWEQGP-SGTLLEGYSA-N	447.276	1.818	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](N)c3cccc(Cl)c3)C2)C1	1839144329	VJHLANADEZBTMO-QKLQHJQFSA-N	444.359	1.814	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCCn3ccnc3C)C2)C1	1839149154	VFFSLZBINFDZFC-XLIONFOSSA-N	426.945	1.446	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(CO)c(F)c3)C2)C1	1839149682	OFUSCFMHLOOOHL-OXJNMPFZSA-N	428.888	1.405	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCCn3ccnc3)C2)C1	1839154909	BQBPGAVDSWTFLE-RTBURBONSA-N	447.363	1.356	50	20	IDGD	
Cc1ccc(F)cc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839197235	NPBQHRIGMJTJGS-MAUKXSAKSA-N	447.276	1.895	50	20	IDGD	
O=C(c1cc(F)ccc1Cl)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1	1839325472	XATDBOFSSUJGCT-CRAIPNDOSA-N	435.279	1.149	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)C3(C#N)CCC3)C2)C1	1839967640	STJPNQXMKZXZFX-KBXCAEBGSA-N	428.327	1.310	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(F)c[nH]3)CCO2)C1	1840068346	ZBRFXWOLMHAZMH-SUMWQHHRSA-N	432.290	1.397	50	20	IDGD	
COC(=O)CCCCCC(=O)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1840236098	CCDJSNGYGBOTQO-GOSISDBHSA-N	439.336	1.370	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CCCSC1)CCO2	1840865383	YSBUUYUYNHLMGE-QFBILLFUSA-N	430.643	1.438	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC2(CCCN2C(=O)c2ccc3c(n2)NC(=O)CC3)C1	1843233372	LCAXKHBODZCOOZ-CYBMUJFWSA-N	435.322	1.957	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1cc(C)nn1C(F)F)C2	1843416462	NDJGGFODIURPKT-ZMOGYAJESA-N	447.446	1.538	50	20	IDGD	
O=C([C@H](O)CCl)N1CC2(CCCN2C(=O)[C@@H](O)c2cccc(Br)c2)C1	1845039760	NOSBVDGDGIQNGG-KGLIPLIRSA-N	431.714	1.286	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC2(CCCN2C(=O)c2cc(S(C)(=O)=O)ccc2F)C1	1845566963	YVSQUYJUQWTHIS-UHFFFAOYSA-N	442.585	1.898	50	20	IDGD	
O=C(NN[C@@H](C(=O)NC1CC1)c1ccccc1)c1ccc(S(=O)(=O)N2CCCC2)cc1	15474783	DTYMFHHLWBXQPF-HXUWFJFHSA-N	442.541	1.725	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)CSc2ccc(C(N)=O)cc2[N+](=O)[O-])c1	15878795	NSJMUOQKUCIPOC-UHFFFAOYSA-N	432.458	1.629	50	20	IDGD	
Cc1[nH]c(=O)c(C#N)c(C)c1CCC(=O)OCC(=O)NNC(=O)c1ccc(Cl)cc1	17223121	NDHSCRBJMPIPAF-UHFFFAOYSA-N	430.848	1.454	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)c1ccc(CN2C(=O)CCC2=O)cc1	25414217	MZOLSNLLZOHVBA-UHFFFAOYSA-N	425.441	1.574	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)COc1ccccc1F)c1cccc(S(=O)(=O)N(C)C)c1	727609108	GROLJPSKELJKTE-ZDUSSCGKSA-N	438.481	1.546	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)CN(C)C(=O)OC(C)(C)C	727892347	FFMHNAMLMARCQZ-UHFFFAOYSA-N	429.857	1.520	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNS(=O)(=O)c1ccc(-n2cnnn2)cc1	728171058	PORQYGSQXFIABV-AWEZNQCLSA-N	438.469	1.593	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2cc3c(cc2[N+](=O)[O-])OCCO3)cc1OC	728260532	HAENABKNRYCTRL-UHFFFAOYSA-N	439.402	1.007	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)N[C@H]2COc3c(cccc3OC)C2)nc1	728398424	DOHAGYFZJZSZHS-OAHLLOKOSA-N	449.533	1.751	50	20	IDGD	
CCOC(=O)C1=NN(c2ccccc2)[C@@H](C(=O)OCC(=O)NNC(=O)c2ccccc2)C1	728633440	KQQRIGPWYUIYLO-GOSISDBHSA-N	438.440	1.189	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)c1ccc2c(c1)C(=O)N(C[C@H]1CCCO1)C2=O	729451125	INKHZHRCBGKZHC-QGZVFWFLSA-N	446.463	1.878	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN(S(=O)(=O)Cc2ccccc2)C1)c1cccc([N+](=O)[O-])c1	730444692	RGKXLWBYGAJCDS-QGZVFWFLSA-N	446.485	1.598	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)[C@@H]2CCCN(S(=O)(=O)Cc3ccccc3)C2)cc1	730514065	CKBMEPLBIAGWKB-LJQANCHMSA-N	445.541	1.763	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)c2ccc(C)c(S(=O)(=O)NCC#N)c2)o1	731186826	VFBCLFFATRTZOT-UHFFFAOYSA-N	447.517	1.307	50	20	IDGD	
O=C(CSc1nccn1-c1ccc(C(F)(F)F)cc1)NNC(=O)C(=O)NC1CC1	732052595	OPKORLXXGDGDOH-UHFFFAOYSA-N	427.408	1.409	50	20	IDGD	
Cn1c(N)c(C(=O)/C(C#N)=C\c2c(-c3ccccc3)nc3sccn23)c(=O)n(C)c1=O	732577883	BGPYBZFTQSNTHP-RAXLEYEMSA-N	432.465	1.832	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N(C)Cc2cnccn2)cc1	735483582	UYJSGKBQOUUYGK-GZTJUZNOSA-N	445.483	1.790	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)N[C@@H](CN2CCCC2=O)c2cccc(C(F)(F)F)c2)cn1	735578959	CKMAYSGBWJKCBO-HNNXBMFYSA-N	438.410	1.747	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNS(=O)(=O)c1ccc(F)c(NC(C)=O)c1	736539584	LQPGLEYCMXFNAL-UHFFFAOYSA-N	425.438	1.571	50	20	IDGD	
CCc1ccc(CCNC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1	737055385	BDTGMOJIISRQKT-UHFFFAOYSA-N	432.546	1.751	50	20	IDGD	
O=C(NNc1ncnc2[nH]cnc12)C1CCN(S(=O)(=O)/C=C\c2ccccc2)CC1	743470586	GWFDPMFWXPTYBJ-FLIBITNWSA-N	427.490	1.509	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCOCC2)cc1C(=O)NNc1ccc(Cl)nc1	743818319	SHQQATNSUGUUPW-UHFFFAOYSA-N	426.882	1.521	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(C)=O)cn1	743823659	TXOCTJCPVZCVGJ-KRWDZBQOSA-N	426.502	1.637	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H]1CC(=O)OCC(=O)NNC(=O)c1cccc(C#N)c1	745458723	OCQLJVNAJVGCEE-MRXNPFEDSA-N	430.461	1.652	50	20	IDGD	
CCCCN1C(=O)CC[C@@H](C(=O)NNC(=O)N2CCOCC2)[C@H]1c1ccccc1OC	745991867	HYVATINLNICVDJ-YLJYHZDGSA-N	432.521	1.848	50	20	IDGD	
O=C(NNC(=O)c1ccc(F)c(S(=O)(=O)Cc2ncon2)c1)NC1CCCCC1	746094191	DWCLIWGIOLGGQF-UHFFFAOYSA-N	425.442	1.459	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCN([C@H](C#N)c3ccccc3)CC2)cc1OC	746448483	AWDRKONDPFGKGN-LJQANCHMSA-N	437.500	1.347	50	20	IDGD	
Cc1cc(N2C[C@@H](C(=O)NNC(=O)Cc3ccncc3)CC2=O)ccc1Br	747323203	NFSYIDVJOBEJMM-AWEZNQCLSA-N	431.290	1.896	50	20	IDGD	
O=C(CCN1CCN(C(=O)[C@@H]2CCCO2)CC1)NNc1ccc([N+](=O)[O-])cc1Cl	748726628	MHKUDAHBRKFMGN-INIZCTEOSA-N	425.873	1.405	50	20	IDGD	
COC(=O)/C=C1\SCC(=O)N1CCCOC(=O)/C(C#N)=C\c1cc(C#N)n(C)c1C	748862086	AAGRCGFGWQVTPM-PBJYTAHJSA-N	428.470	1.635	50	20	IDGD	
CCOc1ccccc1C(=O)NCC(=O)NNc1nc(Br)cn2ccnc12	750246574	NDUUQLFPRSCIKG-UHFFFAOYSA-N	433.266	1.764	50	20	IDGD	
CC(C)NC(=O)C(=O)NNC(=O)c1sccc1S(=O)(=O)NC1CCCCCC1	751302018	DCNBWFLTPJJRCR-UHFFFAOYSA-N	430.552	1.035	50	20	IDGD	
Cc1ccc(C(=O)NN=C2C(=O)N(CC(=O)N(C)C)c3ccc(Br)cc32)o1	752175433	UISPZJXDOALAND-UHFFFAOYSA-N	433.262	1.919	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cccc(N(C)C)c2)c(C)c([N+](=O)[O-])c1	753840329	IWYVDRWCQCVLEN-UHFFFAOYSA-N	443.416	1.156	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)[C@@H]2CCCCS2(=O)=O)cc(OCC)c1OCC	753982097	VFVUOAJNTCNANY-INIZCTEOSA-N	428.507	1.611	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)NC1CCN(S(=O)(=O)C(F)(F)F)CC1)c1ccccc1	755305346	YXUKDOUEEOQUHP-AWEZNQCLSA-N	436.456	1.825	50	20	IDGD	
COc1ccc(C(F)(F)C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1	755411781	UEHZJHYGFMUZSZ-UHFFFAOYSA-N	433.820	1.549	50	20	IDGD	
CN(C)c1ccc(S(=O)(=O)N2CCCCC2)cc1NC(=O)NNC(=O)c1cccn1C	755434606	JPDUHJGNDIUWSU-UHFFFAOYSA-N	448.549	1.732	50	20	IDGD	
O=C(Cc1cc[nH]n1)NNC(=O)Nc1ccc(-c2csc(N3CCOCC3)n2)cc1	755583322	QWRSTTYYMDFLQK-UHFFFAOYSA-N	427.490	1.765	50	20	IDGD	
CC(=O)Nc1cc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)ccc1F	755612848	DWXCMNHQOHYTRI-UHFFFAOYSA-N	437.453	1.501	50	20	IDGD	
O=C(NNc1ccc(OC(F)(F)F)cc1)C1=NN([C@@H]2CCS(=O)(=O)C2)C(=O)CC1	761590528	AZGOCZGHCYVUEG-LLVKDONJSA-N	434.396	1.194	50	20	IDGD	
COC(=O)c1cc(Br)c(F)cc1NC(=O)C(=O)NNC(=O)c1ccccc1	763432135	ZKJYAJZIIKMCAG-UHFFFAOYSA-N	438.209	1.775	50	20	IDGD	
CCOc1cc(C(=O)N(C)C)ccc1NC(=O)C(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	763444846	BUSOMAPXPQVVHS-UHFFFAOYSA-N	443.416	1.095	50	20	IDGD	
CN(C)C(=O)COc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3n2)cc1	763455094	NRDGRYITUUSPAL-UHFFFAOYSA-N	435.440	1.102	50	20	IDGD	
COc1ccc(NC(C)=O)cc1NC(=O)C(=O)NNC(=O)c1ccccc1Br	763482639	IWOLUZNBOXSRFQ-UHFFFAOYSA-N	449.261	1.816	50	20	IDGD	
CO[C@H](C)C(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)COc2cc(C)cc(C)c2)c1	763646153	CAQMGIGKAPWDQA-OAHLLOKOSA-N	442.472	1.442	50	20	IDGD	
Cc1nn(-c2ccccc2)cc1NC(=O)C(=O)NNC(=O)CN1CCCc2ccccc21	763733904	IPVUEFBBTGGBSB-UHFFFAOYSA-N	432.484	1.719	50	20	IDGD	
CCOc1cc2c(cc1NC(=O)C(=O)NNC(=O)c1cccc(N(C)C)c1)O[C@H](C)C2	763754459	RHLVEFQJFSRNFL-CYBMUJFWSA-N	426.473	1.874	50	20	IDGD	
CN(C)C(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCC3)ccc1Cl	763775836	VRBUTCXRQBEDKW-UHFFFAOYSA-N	434.905	1.992	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)C(=O)N2CC3(CCC3)c3c(F)cccc32)c2ccccc2c1=O	763791717	XZQPXQDILVCKJO-UHFFFAOYSA-N	449.442	1.302	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)C(=O)N1C[C@@H]2CCCN2c2ccccc21	763804924	XPTVPOHPHRGNHO-AWEZNQCLSA-N	439.428	1.137	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CNC(=O)c2cccnc2)cc(Cl)c1OCC(C)C	763824779	RDZAOWIWNKHESS-UHFFFAOYSA-N	434.880	1.969	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccc(NC(=O)C2CC2)cc1	763849860	LIDNJVWYRWLBEC-LBPRGKRZSA-N	428.420	1.728	50	20	IDGD	
COc1ccc2cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc3ccccc3F)ccc2n1	763851550	UFTNCWVOEDKNEH-GFCCVEGCSA-N	426.404	1.936	50	20	IDGD	
Cc1ccc(N2CCOC2=O)cc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccccc1F	763859226	ZHJBZQWQSMPGCH-ZDUSSCGKSA-N	444.419	1.644	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cccc3c2OCCO3)ccc1OC(C)C	763920838	DYVIPLXCHRDBTP-UHFFFAOYSA-N	429.429	1.653	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CC[C@@H](C)C3)cc1S(C)(=O)=O	763939227	BMZRVXBNHUDPFC-LLVKDONJSA-N	449.554	1.985	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)C(=O)Nc1ccnn1Cc1cccc(Br)c1	763998490	LANMNIDNUIJXFB-UHFFFAOYSA-N	445.277	1.432	50	20	IDGD	
CN1C(=O)CCc2cc(NC(=O)C(=O)NNC(=O)c3cc(-c4ccccc4)on3)ccc21	764003154	AAVIBDFSKWNXJF-UHFFFAOYSA-N	433.424	1.650	50	20	IDGD	
CCN(CC)Cc1cccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)c1	764004772	URYLEXJYJZGNKW-UHFFFAOYSA-N	426.473	1.699	50	20	IDGD	
COC(=O)c1ccc(F)c(NC(=O)C(=O)NNC(=O)c2cc(Br)cn2C)c1	764005109	ULHRWQBVZOTGMA-UHFFFAOYSA-N	441.213	1.113	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1cccc(CN2CCCC2=O)c1	764011379	GNKAHSYWSIZOPH-UHFFFAOYSA-N	444.875	1.871	50	20	IDGD	
O=C(CC(F)(F)F)NNC(=O)C(=O)Nc1cc(Br)ccc1-n1cccn1	764115012	KUVOCMVJZYXZKZ-UHFFFAOYSA-N	434.172	1.673	50	20	IDGD	
CCCCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)CCc2ccccc2)cc1	764185221	JXCCGHHOUYCUTQ-UHFFFAOYSA-N	446.529	1.947	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)c2cccnc12	764204454	UUGIPGIHWPGLGZ-UHFFFAOYSA-N	445.476	1.634	50	20	IDGD	
CN1Cc2ccc(NC(=O)C(=O)NNC(=O)c3cc(F)ccc3Br)cc2C1	764278704	WIMIJIAZWVILJY-UHFFFAOYSA-N	435.253	1.933	50	20	IDGD	
C[C@@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)Cc3ccncc3)cc2F)C[C@@H](C)O1	764352727	CLPHJVHWEZNEHF-ZIAGYGMSSA-N	429.452	1.163	50	20	IDGD	
C[C@@H]1COCCN1c1ccc(NC(=O)C(=O)NNC(=O)COCc2ccccc2)cc1	764362689	GXCSUBOVWOBCHW-MRXNPFEDSA-N	426.473	1.214	50	20	IDGD	
CCCS(=O)(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2ncccc2C)c1C	764386529	ZJBBDYOTXAJLGZ-UHFFFAOYSA-N	433.490	1.250	50	20	IDGD	
CC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)c1C	764388241	PVUWNUTXSBGRTI-UHFFFAOYSA-N	438.419	1.882	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(N2CCc3sccc3C2)cc1	764398494	SRUYWVNDQPXVAZ-CQSZACIVSA-N	446.529	1.448	50	20	IDGD	
O=C(CCC(=O)N1CCN(c2ccccc2)CC1)NNC(=O)c1cccc([N+](=O)[O-])c1	764429934	LTMIHMXPYYASIV-UHFFFAOYSA-N	425.445	1.485	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)CNC(=O)Cc3ccccc3)n[nH]2)cc1OC	765599795	QGYWRSWHSNHYPR-UHFFFAOYSA-N	437.456	1.214	50	20	IDGD	
CNS(=O)(=O)c1csc(C(=O)NNC(=O)c2cc(-c3ccccc3OC)[nH]n2)c1	765601388	MAKVTULLKVNJQQ-UHFFFAOYSA-N	435.487	1.130	50	20	IDGD	
Cc1cccc([C@@H](CC(=O)OCC(=O)NNC(=O)Cc2ccccc2C)NC(N)=O)c1	767278574	HJOUTWWCYMBAGM-GOSISDBHSA-N	426.473	1.336	50	20	IDGD	
CC(C)(O)C(=O)NNC(=O)CSc1nnc(-c2ccc(F)cc2)n1C[C@@H]1CCCO1	768248367	WUCCAJRVDHKFCS-AWEZNQCLSA-N	437.497	1.274	50	20	IDGD	
CSCCNC(=S)NNC(=O)CCNS(=O)(=O)c1c(C)c(C)c(C)c(C)c1C	769767419	KMZMZDWADZLWDQ-UHFFFAOYSA-N	446.664	1.755	50	20	IDGD	
CCS(=O)(=O)N1CCC(CNC(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)CC1	770649128	LRWYAXPKSZGWPE-ZDUSSCGKSA-N	446.957	1.499	50	20	IDGD	
COc1cc(CC(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)cc(OC)c1OC	770956916	XABFRUISWFWMLU-UHFFFAOYSA-N	430.465	1.999	50	20	IDGD	
Cc1ccc(CNC(=O)NCC(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)cc1	770958059	HDHVGZQFPYLLDF-UHFFFAOYSA-N	426.481	1.538	50	20	IDGD	
C=CCNc1ncc(C(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)s1	771046242	RQDZNJGGZQZZMB-UHFFFAOYSA-N	428.562	1.628	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)[C@@H]1CC(c2cc(F)ccc2F)=NO1	772897375	GSXDARHNYSKBOF-INIZCTEOSA-N	436.802	1.575	50	20	IDGD	
O=C(NNc1ccc(C(F)(F)F)cn1)C(=O)Nc1cccc(Cn2cccnc2=O)c1	773666357	NGKWNDWZOQHNQJ-UHFFFAOYSA-N	432.362	1.787	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ccc(C#N)cc2)cc1S(=O)(=O)NC1CC1	773692716	LRFZZGPTCSDTHB-UHFFFAOYSA-N	429.458	1.089	50	20	IDGD	
Cc1ccnc(-n2nccc2NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)c1	774003614	YQZBEWFUNRNUGL-CYBMUJFWSA-N	442.863	1.783	50	20	IDGD	
CS(=O)(=O)C[C@@H](NC(=O)NNC(=O)c1cnn(-c2ccccc2)c1)c1ccccc1	774283571	PZIITXHLLRQRLB-GOSISDBHSA-N	427.486	1.602	50	20	IDGD	
CCOc1cccc([C@H]2C[C@@H]2NC(=O)NNC(=O)c2csc(N3CCOCC3)n2)c1	775715216	UNVQUAIJMOBVMZ-CVEARBPZSA-N	431.518	1.879	50	20	IDGD	
C[C@H]1CCN(S(=O)(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)C1	777907352	SBBLJOXHLZINJA-HNNXBMFYSA-N	441.517	1.209	50	20	IDGD	
O=C1NC[C@@H]2CN(S(=O)(=O)c3cccc(S(F)(F)(F)(F)F)c3)CCN2C1=O	777996986	LMTLUGNMQMGLDL-SECBINFHSA-N	435.396	1.675	50	20	IDGD	
Cc1ccc(S(=O)(=O)C2(C(=O)NNC(=O)CNC(=O)OC(C)(C)C)CCCC2)cc1	778437297	XXKNLPKEUKEABD-UHFFFAOYSA-N	439.534	1.754	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc2c(c1)nc(CCC(=O)NNc1cc(Cl)ccn1)n2C	778446703	CSQLBODRLJJUDD-UHFFFAOYSA-N	436.925	1.948	50	20	IDGD	
COc1cc(NC(C)=O)c(C(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)cc1OC	780051471	FZJOXNPDWWXVBH-UHFFFAOYSA-N	449.847	1.934	50	20	IDGD	
Cc1cccc(S(=O)(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1F	781558770	ZGANWLMTOIONAO-UHFFFAOYSA-N	441.506	1.542	50	20	IDGD	
Cn1c(=NNC(=O)C(=O)Nc2ccccc2CN2CCOCC2)sc2ccccc21	783352581	ZPRNDNWCGYBBDT-UHFFFAOYSA-N	425.514	1.643	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CC=CC[C@H]1C(=O)N1CCOCC1)c1ccc(Br)s1	784295317	FNQNFRXSXWLOLQ-VXGBXAGGSA-N	442.335	1.713	50	20	IDGD	
Cn1c(C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc2c(=O)n3ccccc3nc21	784765347	QEGMMFKZFZZMIF-UHFFFAOYSA-N	443.423	1.152	50	20	IDGD	
COc1ccc2nc(NNC(=O)C(=O)Nc3cccc(-n4nnnc4C)c3)c(C)cc2c1	785162317	BGNKKOIHERVUQF-UHFFFAOYSA-N	432.444	1.918	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1cccc(C(F)(F)F)n1	786416177	DNMHBWVPVGAEJO-UHFFFAOYSA-N	428.392	1.987	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N2C[C@@H]3CN(C)C[C@@H]3C2)cc1	787631792	XZZJOQLGPOJZEV-WKPPOQGHSA-N	448.527	1.361	50	20	IDGD	
COc1ccc(F)c(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c1OC	788424442	XTMZZDAJVXHKHU-UHFFFAOYSA-N	430.480	1.816	50	20	IDGD	
C[C@@]1(C2CC2)NC(=O)N(c2ccc(CNC(=O)NNC(=O)c3ccc(C#N)cc3)cc2)C1=O	790693080	UOOLJRXHZPFPGB-QHCPKHFHSA-N	446.467	1.927	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)NCc1ccc(S(=O)(=O)CC)s1	792219011	YLXXQTBEABJLJV-UHFFFAOYSA-N	441.531	1.850	50	20	IDGD	
COc1ccc(Cn2cc(NC(=O)C(=O)NNC(=O)c3ccc(C)c(F)c3)cn2)cc1	793032726	HYTIJSWGCHPPEE-UHFFFAOYSA-N	425.420	1.787	50	20	IDGD	
CN(CCN1CCN(Cc2ccccc2)CC1)CC(=O)NNC(=O)c1cccc(C#N)c1	796275537	AYKFJNZSWCYURF-UHFFFAOYSA-N	434.544	1.069	50	20	IDGD	
O=C(NNC(=O)C1(c2cncc(Br)c2)CC1)C1CCN(c2ncccn2)CC1	798428902	WTPDOFXWOCADHK-UHFFFAOYSA-N	445.321	1.730	50	20	IDGD	
CCOc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NNC(=O)c1c(C)nc2ccccn12	799256995	DYIFQAIHAXTUJC-UHFFFAOYSA-N	426.389	1.349	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2ccc(OCC(F)(F)F)c(Cl)c2)CCS(=O)(=O)C1	800627612	NJYFYQVFHCZRMZ-AWEZNQCLSA-N	443.831	1.418	50	20	IDGD	
COCN1C(=O)CCc2cc(NC(=O)NNC(=O)c3ccc4c(c3)OCCO4)ccc21	801786542	IDJAUEXVWTYNPU-UHFFFAOYSA-N	426.429	1.807	50	20	IDGD	
O=C(CNS(=O)(=O)c1cccc(C(F)(F)F)c1)NNc1ccc(-n2ccnc2)nn1	804953652	YEKLPPMAQMSGOC-UHFFFAOYSA-N	441.395	1.103	50	20	IDGD	
O=C(COc1ccccc1Cc1ccccc1)NNC(=O)C(=O)Nc1cc2n(n1)CCCC2	806973465	CMBXLEARXRANAV-UHFFFAOYSA-N	447.495	1.975	50	20	IDGD	
C[C@@H](Oc1ccccc1NC(=O)C(=O)NNC(=O)CNC(=O)c1ccco1)C(F)(F)F	807004664	RAOOPDWSWCGUIC-SNVBAGLBSA-N	442.350	1.125	50	20	IDGD	
Cc1cc(O)nc2cc(C(=O)OCC(=O)NNC(=O)[C@@H]3COc4ccccc4O3)ccc12	808658669	IONBUEODBIJDLF-SFHVURJKSA-N	437.408	1.393	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CNS(=O)(=O)c2c(C)c(C)cc(C)c2C)c(OC)c1	810355861	KYNZVIODVVXNLZ-UHFFFAOYSA-N	449.529	1.677	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccc(Oc3ccnc(C#N)c3)cc2)n1	810386238	RDWYFZPBOJQPTQ-UHFFFAOYSA-N	433.428	1.345	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)NCCc2nnc(C)s2)c2ccccc2c1=O	812485057	UFOQHAATHSCYOY-UHFFFAOYSA-N	443.533	1.933	50	20	IDGD	
CCC(C)(C)OCc1cccc(NC(=O)C(=O)NNC(=O)[C@H]2CCc3nncn3C2)c1C	815692086	IXJVTGYEZVEYRJ-HNNXBMFYSA-N	442.520	1.640	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1cccc(-n2cccc2)c1	815752149	FRWAANDZUFURQB-UHFFFAOYSA-N	427.486	1.809	50	20	IDGD	
CCS(=O)(=O)N[C@@H](CCSC)C(=O)NNC(=O)CSc1ccc(Cl)cc1	818825946	ZWKFCATZXGIYAI-ZDUSSCGKSA-N	440.012	1.641	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)Cc2nc(-c3ccccc3)cs2)o1	914847403	MFAOGODDJBVOMQ-UHFFFAOYSA-N	434.499	1.657	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)CCS(=O)(=O)c2ccc(Cl)cc2)c1	915164965	URSYEMYHQJNPFD-UHFFFAOYSA-N	444.918	1.369	50	20	IDGD	
CC(C)S(=O)(=O)c1ccccc1C(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	915190595	MHBVEMZVQQJOII-UHFFFAOYSA-N	428.470	1.190	50	20	IDGD	
COC[C@H](C)NC(=O)NNC(=O)c1ccc(CN(C)S(=O)(=O)c2ccc(C)cc2)cc1	915888011	KVCFRDMHEQPFOC-INIZCTEOSA-N	448.545	1.795	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NC[C@H](c2ccc(F)cc2)N2CCOCC2)cc1	915897301	BULDKGUESYCVLN-HXUWFJFHSA-N	446.479	1.617	50	20	IDGD	
CNS(=O)(=O)c1ccc(CNC(=O)NNC(=O)COc2cc(C)ccc2C)s1	916232322	HVUXNERWZZEYOL-UHFFFAOYSA-N	426.520	1.182	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCc1ccc(C(=O)N(C)C)cc1	916250842	ZZVOPNVGECRUEM-UHFFFAOYSA-N	446.533	1.134	50	20	IDGD	
Cn1ccnc1[C@@](O)(CCNC(=O)NNC(=O)COc1ccc(F)cc1)C(F)(F)F	916377866	GAFLSDUQPTVYQO-INIZCTEOSA-N	433.362	1.109	50	20	IDGD	
CN(C)CCOc1ccc(CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1	916386222	OJFUOJPSYGQUAI-UHFFFAOYSA-N	448.549	1.064	50	20	IDGD	
CC1CCN(CCNC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)CC1	916451928	YRILYWZUSIGWPC-UHFFFAOYSA-N	437.566	1.147	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)NCC1(N2CCSCC2)CCCC1	916616380	ZYYHVANWZPOHTI-UHFFFAOYSA-N	437.522	1.666	50	20	IDGD	
COc1ccc(CCCNC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1	918138959	HRXHUHYLXNJLMR-UHFFFAOYSA-N	448.545	1.587	50	20	IDGD	
CS(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c1	918142977	PGBCVFPIQLFFKI-UHFFFAOYSA-N	448.520	1.203	50	20	IDGD	
CCCS(=O)(=O)N1CCCC[C@@H]1C(=O)NNC(=O)Cn1c(CC)nc2ccccc21	919689557	WEOCVIFPKUDRDJ-QGZVFWFLSA-N	435.550	1.340	50	20	IDGD	
O=C(NCCS(=O)(=O)c1ccc(Cl)cc1)NNC(=O)c1nnc(O)c2ccccc12	919786752	YLYVZZLLQJNVBQ-UHFFFAOYSA-N	449.876	1.407	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)C(=O)c1ccc2c(c1)CCC2	920338220	NVUKMPFLKUBGOS-UHFFFAOYSA-N	441.509	1.604	50	20	IDGD	
O=C(COC(=O)CCc1ccc2c(c1)CCO2)NNC(=O)[C@H]1COc2ccccc2O1	1252827623	YTJWOOQELGXESQ-LJQANCHMSA-N	426.425	1.085	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(/C#N)C(=O)OCC(=O)N2CCC(C(N)=O)CC2)c1C	1317690038	VELPVUGAELHHIH-HNIBHBHRSA-N	430.505	1.486	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)N[C@H](C)c2cnn(C)c2C)c2ccccc2c1=O	1317868006	MIJRCRVWYVCCEH-CYBMUJFWSA-N	425.493	1.944	50	20	IDGD	
COC(=O)c1cc(Cl)cc(S(=O)(=O)NNC(=O)c2cncn2-c2ccccc2)c1	1318688596	KSDGKSXHOWJWLM-UHFFFAOYSA-N	434.861	1.936	50	20	IDGD	
O=C(NCCN1C(=O)COc2ccccc21)NNC(=O)c1cccc(Br)c1	1325807650	IJFPSEHXQWZCEP-UHFFFAOYSA-N	433.262	1.819	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2ccnn2C[C@@H]2CCOC2)c2ccccc2c1=O	1338342346	WCOZWPXGNIDCRE-ZDUSSCGKSA-N	425.449	1.116	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@]2(C1)CN(C(=O)C[C@@H]1CNc3ccccc3O1)CCO2	1779297038	PEMVOIYCSLBDRA-VGOFRKELSA-N	447.608	1.931	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2)c1ncccc1C(F)(F)F	1779828499	MPRUGYNZLUTAFE-PMUMKWKESA-N	449.857	1.828	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc([N+](=O)[O-])[nH]2)C1	1780233772	KJHYOIKVCVOSHI-RVZJWNSFSA-N	428.873	1.304	50	20	IDGD	
C[Si](C)(C)c1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)co1	1781331675	PCSXVKMPVQDLCA-RHSMWYFYSA-N	447.377	1.959	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(F)c(F)c3OC)C2)C1	1781846539	HCVHPJXAPKBPOH-ORAYPTAESA-N	432.851	1.671	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCc2cnccn2)C1	1782577845	OZPOLKJADJHNDM-WIYYLYMNSA-N	434.613	1.775	50	20	IDGD	
O=C([C@H](F)Br)N1CCO[C@@]2(CCN(C(=O)C(F)(F)c3ccco3)C2)C1	1782723323	PNOFUMDIXVKGNS-FZMZJTMJSA-N	425.201	1.892	50	20	IDGD	
O=C1CC(C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](Br)Cc4ccccc4)C3)C2)C1	1783021723	GJQFDIYWAPZMHE-NQIIRXRSSA-N	449.345	1.802	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(=O)ccn3C)CCO2)C1	1783352086	MYNXBBROCMFIGY-KSSFIOAISA-N	426.311	1.002	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(OC)nn3)CCO2)C1	1783353696	ZFZPTKNIRVNIKT-SJKOYZFVSA-N	427.299	1.102	50	20	IDGD	
CCOc1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](C)Br)C3)C2)nn1	1783535666	BKGAGPLPTFLQNK-SJCJKPOMSA-N	427.299	1.102	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccnc4c3OCO4)CCO2)C1	1783538002	RVSBPVKNZYVTJN-GTNSWQLSSA-N	426.267	1.037	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)CCCC(=O)OC(C)(C)C)CCO2)C1	1783872072	ZYPAGOQECFDKDM-QRWLVFNGSA-N	432.945	1.582	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)C3=NO[C@H](c4ccccc4)C3)CCO2)C1	1783874033	BLHSQVMZRKNDLW-DJPFJPOOSA-N	435.908	1.588	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc4sc(N)nc4c3)CCO2)C1	1783876291	NSPPMAWUZBZVMQ-YJYMSZOUSA-N	438.937	1.576	50	20	IDGD	
C[C@H](S)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2	1783886548	RHTBGMAGRFCFQK-ZJNRKIDTSA-N	435.974	1.267	50	20	IDGD	
C[C@@H](Oc1ccccn1)C(=O)N1CC[C@@]2(CN(C(=O)CCBr)CCO2)C1	1784486660	PONLEUSWYLJODM-RDTXWAMCSA-N	426.311	1.464	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21)[C@H]1COc2ccccc2O1	1785044197	ZIICKCYATGHIQL-GVAFMPQTSA-N	429.300	1.610	50	20	IDGD	
Cc1ncccc1CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21	1785127277	QVTWUVPXJVLENN-NBOOPKSLSA-N	442.329	1.993	50	20	IDGD	
CCOC(=O)N1CCC(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](Cl)CC)CCO3)CC1	1785373803	PZUQWITUPDWAJQ-OXJNMPFZSA-N	429.945	1.702	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3cccc(Cl)n3)[C@H]2C1	1785430091	XMWKSPRLMVTPGT-TUUVXOQKSA-N	430.332	1.511	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccn(C(F)F)c3=O)[C@H]2C1	1788797384	LTFXQCFIKHHZQM-MHEUCROKSA-N	431.867	1.854	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21)c1cc2cccnc2nc1O	1790366165	JFJZVXLJQZTGIJ-UBHSHLNASA-N	439.299	1.732	50	20	IDGD	
CN(CC(=O)NC1(c2ccc(NC(=O)[C@@](C)(Cl)CCl)cc2)CCC1)C(=O)C(=O)O	1790494097	WLHATWYVGFAGBC-SFHVURJKSA-N	444.315	1.900	50	20	IDGD	
CC(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1792609498	FTZSSFDUPACGMQ-IVSAIRAKSA-N	447.960	1.133	50	20	IDGD	
O=C(COc1ccc(O)cc1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2	1792778065	NULLRLAUFYGIRA-OJXGSEEGSA-N	431.258	1.051	50	20	IDGD	
COc1cccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)CBr)n1	1792870811	VQOBXUYYLJMXCK-NFFDBFGFSA-N	426.311	1.324	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H]1C[C@H](C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](O)CCl)C1	1793117890	IRHNROHMHNAFLO-YTQIUSBHSA-N	429.945	1.528	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)nc(Cl)c1	1794411955	YKUHZEFDUMLOOL-ADGXKJENSA-N	446.729	1.675	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1nccc2[nH]ccc12	1796202445	KBRDJRVKCGFSSD-JFILPPLUSA-N	435.322	1.797	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)c1cccc2ccccc12	1796781198	KCDWXHLNNFLBHR-BBIADKPPSA-N	444.296	1.037	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H]1CCCSC1)C2	1796892993	FLTIYLVPMDBPDI-AECQCBAMSA-N	431.562	1.902	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2nncn2c1	1797464073	PTBLKTKJPJIJRB-HRJSJKBJSA-N	426.304	1.169	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc3c(c1)OCO3)C2	1797954420	ILXQIRVKDQWONY-VPTLXERWSA-N	434.565	1.399	50	20	IDGD	
CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CO[Si](C)(C)C)C(=O)OC(C)(C)C	1797954449	MIKCLVFRSDILNG-JLVBRIDZSA-N	443.617	1.294	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](Br)Cc1ccccc1)C2)c1ncon1	1798352327	ZGKFYVNYNGKJKT-QKPAOTATSA-N	449.305	1.279	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1[C@H]2Sc3ccccc3[C@H]21)c1ccc(B(O)O)cc1	1798451732	BNATVMCNEOAWIU-HFABISMESA-N	448.353	1.506	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCC#N)C2	1798522270	MMIOGOWBINRFMO-HBCWATKFSA-N	430.417	1.027	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Br	1799352458	XOUDKUKQUXWKLZ-FVUFVHQMSA-N	447.301	1.022	50	20	IDGD	
COc1ccc(Cl)cc1CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2	1800403329	VFAXIFWJZRDJMF-ZFHGCVPZSA-N	431.316	1.080	50	20	IDGD	
CCc1noc(C)c1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](Br)CC	1800642023	RKCHQRTZNWQNBM-ZWUHOBOKSA-N	428.327	1.922	50	20	IDGD	
COC(=O)c1ccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)C(Cl)Cl)C3)cc1	1801145195	BGUHRKRNMYFHQB-MIFYACCESA-N	429.300	1.409	50	20	IDGD	
COC[C@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(S(C)(=O)=O)c(F)c1)C2	1802284053	OMRRDMADBHVLGM-XGUBFFRZSA-N	446.928	1.735	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(OCCCO)cc1)C2	1802337557	ZGWDZPDGRUJZJR-REPLKXPHSA-N	446.548	1.073	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)[C@@H]1C[C@@H]1C1CC1	1802991555	YQOVEXPDSHYKCR-BDKRGJGYSA-N	433.317	1.127	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CSc2ccncc2)[C@H]1c1cccnc1)[C@H](O)CCl	1803136815	VVOKXKSHYXBVBF-WDYCEAGBSA-N	434.949	1.874	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)c(O)c1	1803141368	NMQPGCUEODXQTD-CCKFTAQKSA-N	433.892	1.715	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cc3ncccn3n2)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803142841	KQPVHAKFACRJED-QILLFSRXSA-N	428.880	1.044	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)CSCC(=O)OC)[C@H]1c1cccnc1	1803579537	HHJFNUHIOOKKMQ-RVKKMQEKSA-N	443.953	1.247	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)N1CCC2(CCCN(C(=O)[C@@H](C)CBr)C2)CC1	1805385157	SWCGNYXYEBEMTA-LSDHHAIUSA-N	428.371	1.939	50	20	IDGD	
O=C(c1ncn(-c2cccc(F)c2)n1)N1CCCC2(CCN(C(=O)[C@@H](O)CCl)CC2)C1	1807416830	RUVGQGXPZHHVLS-KRWDZBQOSA-N	449.914	1.851	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCC2(CCCN(C(=O)CNCP(=O)(O)O)C2)CC1	1809662929	LEKOEKYEQVTZJW-HNNXBMFYSA-N	444.296	1.179	50	20	IDGD	
COc1ccc(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](C)Br)[C@@H]2c2cccnc2)nn1	1811209423	MAIKWOGRFKEICZ-HACGYAERSA-N	448.321	1.983	50	20	IDGD	
COc1ccccc1CC(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1	1812762904	JKFYBSHMSCOICQ-WAOWUJCRSA-N	431.920	1.938	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)CNC(=O)OC)[C@@H]1c1cccnc1	1812779134	PDIYPQGTBNLKOX-OFQRWUPVSA-N	441.326	1.617	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)CCc2ccoc2)[C@@H]1c1cccnc1	1813074040	NYEMYLZUTYVCSW-AUSIDOKSSA-N	441.532	1.686	50	20	IDGD	
Cc1cccc(CC(=O)N[C@@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)c1	1815339587	IQSMFOLUOGJUSO-GOSISDBHSA-N	449.341	1.600	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@H]1CCc2nc(NC(=O)[C@H]3CCCO3)sc2C1	1815794536	JZIKXFQAMRIGID-BLKQIODTSA-N	444.517	1.368	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@H](F)Cl)[nH]n1)c1n[nH]c2c1CS(=O)(=O)C2	1817684043	WUNPLHZXIUWNFR-FZMZJTMJSA-N	444.876	1.402	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(O)nc(O)n2)n[nH]1	1818032144	SYBKSAIGNNWOGN-KWQFWETISA-N	439.270	1.700	50	20	IDGD	
Nc1n[nH]c(CCC(=O)Nc2cc([C@@H]3CCCCN3C(=O)[C@H](F)Br)[nH]n2)n1	1819286200	NIYOKYYEWVAZGJ-ZANVPECISA-N	443.281	1.425	50	20	IDGD	
CC(C)O[C@H](C)C(=O)N[C@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1	1819798119	WNZOEVFQVHFMDA-NEPJUHHUSA-N	446.533	1.181	50	20	IDGD	
C=C(CC(=O)OCC)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1	1820897077	CTKLEOYSJBGHTN-MRXNPFEDSA-N	448.524	1.284	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCN2CCCC2)[nH]n1	1822417789	OPBGLFFREVSUIJ-KRWDZBQOSA-N	433.557	1.261	50	20	IDGD	
COc1cc(C(=O)N[C@@H]2CCc3nc(NC(=O)[C@@H](C)Br)sc3C2)nn1C	1825645942	LWHMVRVXLVCKFX-RKDXNWHRSA-N	442.339	1.894	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccnc3Cl)CCO2)C1	1829500730	GAROCVRXUZWMNP-RDTXWAMCSA-N	432.304	1.059	50	20	IDGD	
C=CCOCCCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)CBr)CCO2	1830535319	MJADIQMBSDSPRO-VQIMIIECSA-N	447.370	1.457	50	20	IDGD	
O=C(c1cc(-c2ccccc2)on1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1830719397	CONYIGBEHJJLHR-UTKZUKDTSA-N	449.891	1.011	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)Cn2cnnn2)CC1	1831550388	VOSGVLFHPNHSBE-LSDHHAIUSA-N	427.347	1.466	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3csc(C)n3)CCO2)C1	1832963819	GJCUSUVMELNCCL-QFBILLFUSA-N	429.970	1.858	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3scnc3C)CC2)CC1	1834227323	ZXIFKXOCZRGXTE-INIZCTEOSA-N	428.986	1.891	50	20	IDGD	
Cc1nc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)cs1	1834457203	QDAUPJUYILOXKJ-WFASDCNBSA-N	436.303	1.212	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)C(Cl)Cl)CC2)CC1)c1cc2n(n1)CCCO2	1835570934	RXVKDLURAALUSI-UHFFFAOYSA-N	444.363	1.655	50	20	IDGD	
O=C(Cc1cccs1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1836091615	RHTOPSPHWRQJDA-GOEBONIOSA-N	435.315	1.438	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)C3=NN(C)C(=O)CC3)CC2)CC1	1836394998	NAGPKMYLYIQGBR-MRXNPFEDSA-N	425.961	1.184	50	20	IDGD	
Cc1cccc2cc(C(=O)N3CCO[C@@]4(COCCN(C(=O)[C@H](O)CCl)C4)C3)[nH]c12	1836851488	MVGPEAPSNRQHBX-UTKZUKDTSA-N	435.908	1.146	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccn4nccc4c3)CCO2)C1	1837155597	KPVZMCQQOGDCNY-RXVVDRJESA-N	434.924	1.812	50	20	IDGD	
C/C(=C\c1ccc(C)o1)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1	1837575851	FWQKZHJQUKOHIM-MDIGLQKYSA-N	426.897	1.047	50	20	IDGD	
CCCC(=O)N1CCC(OC2CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CC2)CC1	1837667558	KEABTVNNQZLXQB-LFVJCYFKSA-N	431.537	1.919	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCC(OC2CCN(C(=O)CS(C)(=O)=O)CC2)CC1	1837770529	XUJMHKVTRAYKNT-QGZVFWFLSA-N	443.393	1.266	50	20	IDGD	
Cc1n[nH]c(C)c1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)CBr)C2)C1	1837801564	WHGXQTCJSWDBBN-SGTLLEGYSA-N	443.342	1.128	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3ccnc(OC)c3)C2)C1	1839142306	LQUXVKKPHXOIIC-DYESRHJHSA-N	439.940	1.497	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc4cc(C)ccn34)C2)C1	1839148387	XITIWDBTOKYLHR-IERDGZPVSA-N	434.924	1.730	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)C1(Br)CC1)CCO2	1839207316	PERNNMVDTZEOGO-INIZCTEOSA-N	449.418	1.222	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(C)cc(F)c3F)CCO2)C1	1839459387	QGWCYHYUQLLIFZ-MGPUTAFESA-N	446.878	1.597	50	20	IDGD	
C=CCC(F)(F)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)CBr)C2)C1	1839886641	HFCHQENSYHMGHP-CJNGLKHVSA-N	439.297	1.685	50	20	IDGD	
CC(C)n1nccc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2	1840033386	BYPJJNRUKHXIDR-RDTXWAMCSA-N	443.342	1.317	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CC[C@H]3CCOC3)C2)C1	1840035942	AFUHKRZZYLCWFG-RLFYNMQTSA-N	433.343	1.043	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(C)ccc3F)C2)C1	1840155198	RXUIBBIZLJVPQK-UZLBHIALSA-N	428.888	1.458	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3ccc(C)cc3)C2)C1	1840156449	SIUJJUXUSOKDSG-UGKGYDQZSA-N	438.952	1.638	50	20	IDGD	
O=C(c1cc2ncccc2[nH]1)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840189958	UXENXXVHLUJNIP-SFHVURJKSA-N	427.288	1.437	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)C3CCC(O)CC3)CCO2)C1	1840275383	BDXBIRGPOUWOMT-FCJNSDPXSA-N	447.370	1.167	50	20	IDGD	
C[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1)c1ccccn1	1840503006	KSYJABHWWYYSDG-UWJYYQICSA-N	435.597	1.493	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](C(=O)N2CCCC23CN(C(=O)[C@@H](F)Cl)C3)[C@@H](O)C1	1841026108	VRLPXBPFLSAGKA-MELADBBJSA-N	433.908	1.342	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)c1nc3c(=O)[nH]c4ccccc4n3n1)C2	1841668383	XAFCEUYVEKWKOV-CYBMUJFWSA-N	442.907	1.795	50	20	IDGD	
COc1ccc(CC(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)c(Cl)c1	1841911969	QKTIYPPZLGHNCX-UHFFFAOYSA-N	442.708	1.088	50	20	IDGD	
CC(C)c1csc(C(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)n1	1842148998	POIMRJBRJQFNRM-UHFFFAOYSA-N	428.518	1.396	50	20	IDGD	
CN(CC(=O)N1CC2(CCCN2C(=O)C2=CCCC2)C1)NC(=O)NCc1ccccc1	1842602260	LFTRITOSMVXXAZ-UHFFFAOYSA-N	425.533	1.646	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1ccn(C(C)(C)C)n1)C2	1843415630	TWVHJYHIIPLVCP-BUVRLJJBSA-N	439.520	1.589	50	20	IDGD	
Cc1occ(C(F)(F)F)c1C(=O)N1CCCC12CN(C(=O)c1cccc(B(O)O)c1)C2	1843533777	WBZYGWVIIVRRST-UHFFFAOYSA-N	436.195	1.417	50	20	IDGD	
COc1ccc([C@@H](C)C(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)cc1	1844263249	JYSOEEOAVIIJGR-OAHLLOKOSA-N	437.500	1.314	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCCC12CN(C(=O)CCN1C(=O)c3ccccc3C1=O)C2	1844377200	CVMZHRIGSWYIJE-UHFFFAOYSA-N	443.576	1.728	50	20	IDGD	
COc1cc(C(=O)N2CCCC23CN(C(=O)CO[Si](C)(C)C)C3)c([N+](=O)[O-])cc1O	1844737610	GLBUSCBTXDKCCO-UHFFFAOYSA-N	437.525	1.978	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CCCC12CN(C(=O)[C@H](C)CBr)C2	1846337993	LRYLYOLEJYDQAN-QLFBSQMISA-N	427.339	1.976	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)Cc1ccccc1C(F)(F)F)C2	1846384331	FKCILRNPZPGASX-UHFFFAOYSA-N	440.466	1.824	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)CCNS(=O)(=O)c2cc(C)ccc2C)cc1OC	15475446	FYGUNKAIRBPUAF-UHFFFAOYSA-N	449.529	1.840	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)c1cccc(S(=O)(=O)N(CC)CC)c1	15525546	YZIYQNHUXLVEDY-UHFFFAOYSA-N	449.529	1.956	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)[C@H]2CC(=O)N(c3ccc4c(c3)OCCO4)C2)c1	15878796	NKMUELMFXLGJCR-INIZCTEOSA-N	439.468	1.654	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)[C@H]1CC(=O)N(c2ccccc2OC)C1	23686524	SVCRTACZXJAEQZ-HNNXBMFYSA-N	427.457	1.673	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)N2CCN(c3ccc(C(N)=O)cn3)CC2)c1C	725885272	VMPGLAFVVVVLQZ-MOSHPQCFSA-N	436.516	1.501	50	20	IDGD	
CCOC(=O)Nc1ccc(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1	726151758	IVPPYLOFTLGEHR-UHFFFAOYSA-N	440.865	1.631	50	20	IDGD	
CN(CCCC(=O)NNc1nc(-c2ccncc2)no1)S(=O)(=O)c1ccc(F)cc1	726377349	WVMIDPLCDXCDIW-UHFFFAOYSA-N	434.453	1.815	50	20	IDGD	
N#C/C(=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)N1CCCNC(=O)C1	726778070	IUOGOXQPXIRVOY-XNTDXEJSSA-N	440.891	1.334	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NN=Cc1csc(-c2cccc(Br)c2)n1	728436681	ICTXPHVHRWFBIH-VIFPVBQESA-N	431.337	1.960	50	20	IDGD	
Cc1cc(S(=O)(=O)NNC(=O)c2cccc(OC(F)F)c2)ccc1OCC(=O)O	728510804	VAOGXELCFRBFAV-UHFFFAOYSA-N	430.385	1.683	50	20	IDGD	
COc1ccc(CNC(C)=O)cc1S(=O)(=O)NNC(=O)c1cccc(OC(F)F)c1	728510822	VSZQBVWMFQBVJL-UHFFFAOYSA-N	443.428	1.556	50	20	IDGD	
CC(C)N(CCC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)C(=O)OC(C)(C)C	728890301	KWZHJGKISOFCRU-UHFFFAOYSA-N	434.541	1.876	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)NC2CC2)cc1)NNC(=O)Cn1ccc2ccccc21	729451319	RWDZJJWLEUSHDH-UHFFFAOYSA-N	440.525	1.862	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(CNC(=O)NNC(=O)Cn2ccc3ccccc32)cc1	729497546	PWJGBIQYXCACCK-UHFFFAOYSA-N	429.502	1.422	50	20	IDGD	
CS(=O)(=O)c1ccc(F)c(S(=O)(=O)NNC(=O)Cn2ccc3ccccc32)c1	729667018	CEKQTHLUJPYRKW-UHFFFAOYSA-N	425.463	1.194	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)nnn1-c1cccc2cccnc12	731471483	SXMMCMDYAQVWHI-UHFFFAOYSA-N	440.427	1.174	50	20	IDGD	
COc1ccc(CN([C@@H]2CCS(=O)(=O)C2)[C@H](C)C(=O)NNC(=O)CC(C)C)cc1	731848714	MAGZYQVECSMIRR-NVXWUHKLSA-N	425.551	1.266	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1)[C@H]1COc2ccccc2O1	731957681	WSZWQLISZIMUMV-BXUZGUMPSA-N	446.441	1.248	50	20	IDGD	
Cc1ccc(C2(C(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)CCOCC2)cc1	732050638	YNKUAUVBHRYUNB-UHFFFAOYSA-N	445.541	1.755	50	20	IDGD	
O=C(NNc1ccc(Br)cc1Cl)[C@H]1CC(=O)N(CCN2CCOCC2)C1	733807347	BBHUFWXCMUKLAL-LBPRGKRZSA-N	445.745	1.726	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)NCCNS(=O)(=O)c2ccccc2[N+](=O)[O-])cc1	735188916	NPHRYFJEHZOIPP-UHFFFAOYSA-N	435.462	1.080	50	20	IDGD	
Cc1cccc(NS(=O)(=O)c2ccc(C)c(C(=O)NNC(=O)c3cnn(C)c3)c2)c1	735471105	OIWRSSUMDAFCCU-UHFFFAOYSA-N	427.486	1.913	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2ccc(Br)s2)ccc1OC	739670033	CZGHNQIXNGITJV-UHFFFAOYSA-N	449.304	1.929	50	20	IDGD	
Cc1nc2c(c(O)nn2C)c(C)c1CCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	742242358	ZDEIWFOFTJLMPX-INIZCTEOSA-N	425.445	1.211	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NCCc2cnn(-c3ccccc3)c2)cc1	743528631	LLTBIIZHOHHQGF-UHFFFAOYSA-N	442.501	1.854	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)CCc2nc(-c3cccs3)no2)cc1	743829252	ITXRWVRSZUWXKH-UHFFFAOYSA-N	435.487	1.987	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCCC(=O)NNC(=O)Nc2ccc(N(C)C)cc2)cc1	743829656	ZSYJHEBTVNHEIQ-UHFFFAOYSA-N	449.533	1.673	50	20	IDGD	
CC[C@H](C)NC(=O)[C@@H](C)NC(=O)NNC(=O)[C@@H](C)Oc1cccc(Br)c1	744277820	OMUQJMMIRLZREZ-QJPTWQEYSA-N	429.315	1.850	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)CCC(=O)N2CC(=O)Nc3ccccc32)c1	744576945	OKUMLVWXLGVNAQ-UHFFFAOYSA-N	438.440	1.065	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)c2nc(C)n(-c3n[nH]c(C(F)(F)F)n3)n2)c1	747346156	WOKSQSZYVKINRE-UHFFFAOYSA-N	438.370	1.169	50	20	IDGD	
COC(=O)c1ccc(OC)c(S(=O)(=O)NNC(=O)c2ccc(Br)s2)c1	747596479	MQGPLCSMSCFEOR-UHFFFAOYSA-N	449.304	1.929	50	20	IDGD	
C[C@H](NS(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)N2CCCC2)c1)c1ccccc1	748247909	ZVQWYYNNUHLRIY-HNNXBMFYSA-N	444.513	1.110	50	20	IDGD	
O=C(CCN1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O)NNc1nc(-c2ccccn2)nc2c1CCC2	748341589	UZPZSWQXNCRYJJ-RWQQGDIJSA-N	448.483	1.023	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N(C)C[C@@H]2CCOC2)cc1	749433604	WDCLNFMCHGHNRN-GYXHFJGISA-N	437.500	1.836	50	20	IDGD	
COc1cc(CN2CCN([C@H](C)C(=O)NNC(=O)CC(C)C)CC2)cc(OC)c1OC	749853160	VFHVREDACYGAIJ-MRXNPFEDSA-N	436.553	1.412	50	20	IDGD	
O=C(CC1CCCC1)NNC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1	749942911	MCZXKOHZCHQAGH-OAHLLOKOSA-N	438.506	1.723	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1ccc(Br)c(O)c1	750809807	IURPHGQCRVJNKF-UHFFFAOYSA-N	441.307	1.831	50	20	IDGD	
COc1cc(OC)cc(N2C[C@H](C(=O)NNC(=O)c3cc(-c4ccccc4)[nH]n3)CC2=O)c1	752520021	KWYHXWPFSFZOJF-OAHLLOKOSA-N	449.467	1.908	50	20	IDGD	
Cn1c(NNC(=O)CNC(=O)c2ccc(Br)cc2)nc2ccccc2c1=O	752908840	SFNYCAAYEOEHLM-UHFFFAOYSA-N	430.262	1.569	50	20	IDGD	
O=C(NCCn1cccc1)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	753050156	REPVIQJRFMAMSE-UHFFFAOYSA-N	441.513	1.611	50	20	IDGD	
O=C(NC[C@H]1CCCCS1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	753256474	VEXRBKDLIWKXTN-OAHLLOKOSA-N	426.564	1.701	50	20	IDGD	
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC[C@H](C(=O)NNc2ccc(C(F)(F)F)nn2)C1	755193487	GCQYRMYNKQZIDT-NSHDSACASA-N	447.443	1.379	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)N[C@@H]2CCN(c3ncccc3F)C2)cc1	755302618	NCHZLFOAOUSNGI-CYBMUJFWSA-N	436.469	1.239	50	20	IDGD	
CSc1nnnn1-c1cccc(NC(=O)NNC(=O)c2ccc3c(c2)OCCO3)c1	755735692	ZLZDVJCFTIUFHU-UHFFFAOYSA-N	427.446	1.622	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)Nc1cc(N2CCCS2(=O)=O)ccc1F	756154453	HFPCOKCAWCNXHG-UHFFFAOYSA-N	437.409	1.740	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)Nc2ccc(S(=O)(=O)NCC3CC3)cc2)c1	756784684	QKSYFUOFAFQPBO-UHFFFAOYSA-N	448.501	1.859	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)COCc2ccccc2)cc1-n1nnnc1C1CC1	757621709	RCJZFOMYQKEZNX-UHFFFAOYSA-N	437.460	1.918	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)Nc2ccc(NC(=O)CCN3C(=O)CNC3=O)cc2)c(C)o1	758061702	CQYLIDQZNFQGOM-UHFFFAOYSA-N	442.432	1.243	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)N[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1C#N	758760780	POLDQKDKLSRWCW-WOSRLPQWSA-N	435.456	1.682	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2cccc(Br)c2)c1)C(=O)Nc1ccccn1	758829379	YVJJHDMPBXWBRG-UHFFFAOYSA-N	429.234	1.430	50	20	IDGD	
Cn1cc(S(=O)(=O)NNC(=O)c2ccc(CSc3nncn3C)cc2)nc1Cl	759709767	YOZFBNZYIAJYJX-UHFFFAOYSA-N	441.926	1.118	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)Cc1csc(NC(=O)c2ccco2)n1	760451826	YPJGSSUQBQPMOK-UHFFFAOYSA-N	437.478	1.593	50	20	IDGD	
COc1cc(NC(=O)C2CC2)ccc1S(=O)(=O)NNC(=O)c1cccc(OC)c1O	761279918	BIBNNGCWISNUKD-UHFFFAOYSA-N	435.458	1.381	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN2CCC[C@H](n3cc(C(=O)OC)nn3)C2)cc1C	762621639	BYJOQMLQLQCLLP-ZDUSSCGKSA-N	434.522	1.095	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)C(=O)Nc1ccc2[nH]ccc2c1	763532360	XEWQTILVCTWEMN-UHFFFAOYSA-N	434.500	1.466	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(N2CCOC2=O)ccc1C	763663356	HPBFWAHTCZYKAL-UHFFFAOYSA-N	442.428	1.125	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(N3CCO[C@@H](C)C3)cc2)cc1C	763666560	JISACOXLBNTOIZ-KRWDZBQOSA-N	440.500	1.693	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(C(F)(F)F)cnc1O	763713497	ZGUXKJXTWLLDCL-UHFFFAOYSA-N	426.351	1.533	50	20	IDGD	
CCc1ccc(CC)c(NC(=O)C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1	763717812	ACHSJEAAIHBVJZ-UHFFFAOYSA-N	446.529	1.461	50	20	IDGD	
O=C(NNC(=O)c1cc2c(s1)CCC2)C(=O)Nc1ccccc1CN1CCNC1=O	763783951	ROYCEYVDXOMPET-UHFFFAOYSA-N	427.486	1.162	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(OCCC(N)=O)cc2)c1C	763840370	KBUNDKXSDOCTFP-OAHLLOKOSA-N	442.472	1.111	50	20	IDGD	
CC[C@@H](C)NS(=O)(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2ccccc2C)c1	763957847	MKALHQNWXHRJPJ-CQSZACIVSA-N	432.502	1.472	50	20	IDGD	
Cn1cnnc1-c1cccc(NC(=O)C(=O)NNC(=O)Cc2cccc3ccccc23)c1	764018681	AJWNXBUYHLGTRT-UHFFFAOYSA-N	428.452	1.964	50	20	IDGD	
CC[C@@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(Cl)c(S(=O)(=O)N2CCCCC2)c1	764081093	CTWGSXLBQINIMD-GFCCVEGCSA-N	444.941	1.647	50	20	IDGD	
CCC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(CN(CC)CC)o2)cc1	764138715	ILLCBULUTWGILR-UHFFFAOYSA-N	429.477	1.870	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(C#N)cc2)cc1Cl	764177410	MLLSEVRVARBVPB-UHFFFAOYSA-N	430.804	1.163	50	20	IDGD	
CNS(=O)(=O)c1ccc(C)c(NC(=O)C(=O)NNC(=O)CCCc2ccccc2)c1	764223442	BNHGHCIHUDQUIO-UHFFFAOYSA-N	432.502	1.012	50	20	IDGD	
CCN1CCN(c2ccc(NC(=O)C(=O)NNC(=O)Cn3ccc4ccccc43)cc2)CC1	764239747	RUCALQGLIQROJQ-UHFFFAOYSA-N	448.527	1.569	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(OC(F)F)c2)cc1C(=O)N(C)C	764260454	ZDXYVNOKKGOXEK-UHFFFAOYSA-N	434.399	1.698	50	20	IDGD	
CC(C)(C)OC(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)CCc2ccccc2O)c1	764280525	BZLNJJXZIJOODF-UHFFFAOYSA-N	441.484	1.995	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2cc(F)c(Cl)cc2F)CC1	764281655	HKQKGNFEIISTQD-UHFFFAOYSA-N	445.879	1.706	50	20	IDGD	
CS(=O)(=O)c1c(F)cc(NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)cc1F	764349541	NZBKZDIELGADQG-UHFFFAOYSA-N	447.803	1.127	50	20	IDGD	
CCN(CC)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)cn1	764384519	CCKZVGMXDZMOQZ-UHFFFAOYSA-N	427.490	1.779	50	20	IDGD	
CCc1ccccc1OCC(=O)NNS(=O)(=O)c1cc2c3c(c1)CC(=O)N3CCC2	764932560	OMLATTKHNBCILY-UHFFFAOYSA-N	429.498	1.473	50	20	IDGD	
CC/C=C(/C)C(=O)N1CSC[C@H]1C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C	765320099	LAPHHANXDSFIQG-MQJVFOOVSA-N	428.555	1.697	50	20	IDGD	
COC(=O)[C@@H]1CCCCN1C(=O)c1cccc(NC(=O)C(=O)NNC(=O)OC(C)(C)C)c1	765399267	RYAJYUXNWKGZLB-HNNXBMFYSA-N	448.476	1.349	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)CCN2C(=O)[C@@H]3CCCC[C@H]3C2=O)n[nH]1	765596206	SMFWDPXKZKKEGT-ZIAGYGMSSA-N	439.472	1.412	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)N[C@@H]1C[C@H](OC(C)C)C1(C)C	766086236	VWPJOJBZBNCWCL-KGLIPLIRSA-N	425.555	1.824	50	20	IDGD	
C[C@H](c1ccccc1)[C@@](C)(O)C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	766636569	QJTJCQTXSNFGMQ-HOYKHHGWSA-N	438.528	1.147	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cnn(-c4cccnc4)c3)CC2)cc1	766641653	KADDBEAXGGRURW-UHFFFAOYSA-N	433.516	1.155	50	20	IDGD	
CCn1c(SCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)nnc1-c1cccnc1	768408048	XMHJZTHDFOYUBE-UHFFFAOYSA-N	427.446	1.822	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)CN1C(=O)N[C@]2(CCCC(C)(C)C2)C1=O	768565199	CYUYIUGVHUSRPF-QFIPXVFZSA-N	446.504	1.502	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)[C@H]1CCCN(C(=O)NCC(C)C)C1	768634936	SEDCPTCSOKSISD-AWEZNQCLSA-N	426.539	1.619	50	20	IDGD	
O=C(NNC(=O)c1ccc(F)cc1Br)NC1CCN([C@@H]2CCC[C@@H]2O)CC1	769155935	PSXWNFNKZCDJOF-CVEARBPZSA-N	443.317	1.910	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)N[C@H]1CCO[C@]2(CCSC2)C1	769229335	BRBQXDYZRQZULM-PGRDOPGGSA-N	447.605	1.584	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2cccc(OCC(F)(F)F)c2)n1	770125364	SYBMVHZEUAPXCK-UHFFFAOYSA-N	431.392	1.940	50	20	IDGD	
CC(=O)N1CCN(S(=O)(=O)c2ccc(C(=O)OC[C@H](C)CBr)cc2)CC1	770320953	GPCAHTATRKUOSN-CYBMUJFWSA-N	447.351	1.727	50	20	IDGD	
Cc1cc(-c2noc([C@H](C)NC(=O)NNc3nc(O)c4cnn(C)c4n3)n2)ccc1F	770409970	GCDALASXLMDDBG-VIFPVBQESA-N	427.400	1.954	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)N1CCN(c2ccc(C#N)cn2)CC1	770647573	NDEATNAFFIFHLH-CQSZACIVSA-N	428.880	1.937	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2cc(Br)cc([N+](=O)[O-])c2)C[C@H](C)O1	770949678	DJXPGGUTPJSHHM-QWRGUYRKSA-N	429.271	1.618	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)[C@H]3CN(Cc4ccccc4)CCO3)nc21	770957721	DQCMMYNDUOFABO-MRXNPFEDSA-N	425.493	1.631	50	20	IDGD	
Cc1cccc(N2C[C@@H](C(=O)NNC(=O)C(=O)NCc3ccc(Cl)cc3)CC2=O)c1C	772195798	SNBAXBNAZXMRIQ-INIZCTEOSA-N	442.903	1.774	50	20	IDGD	
Cc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1cccc(Cl)c1	774010277	SEZAXUCHTIWCOC-CYBMUJFWSA-N	446.891	1.904	50	20	IDGD	
CC(C)c1cc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cc(O)n1	775542483	MASRKASRAXGPKR-UHFFFAOYSA-N	425.489	1.130	50	20	IDGD	
O=C(NNC(=O)N1CCC(n2ccc(C(F)(F)F)n2)CC1)c1ccc(-n2cnnn2)cc1	778588913	NDIUOFMWKWGZBN-UHFFFAOYSA-N	449.397	1.569	50	20	IDGD	
CCS(=O)(=O)c1ccc(Br)c(C(=O)NNC(=O)NCc2ccco2)c1	781683068	WQPLXLXBMTVHIR-UHFFFAOYSA-N	430.280	1.980	50	20	IDGD	
CSc1ccc(NC(=O)C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)cc1	782896296	FELCBXGJBFQIBB-UHFFFAOYSA-N	435.531	1.410	50	20	IDGD	
COc1c(C)ccc(NC(=O)C(=O)NNC(=O)c2csc(N3CCOCC3)n2)c1C	782898291	ZGVOLUNSFJFHEJ-UHFFFAOYSA-N	433.490	1.005	50	20	IDGD	
COc1ccc(C(=O)N2CCOCC2)cc1NC(=O)C(=O)NNc1ccc(Cl)cc1	783339391	DJUWILOWZFUZCU-UHFFFAOYSA-N	432.864	1.903	50	20	IDGD	
COC[C@H](C)NS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccc(F)cc2F)cc1	783347766	YBFLUAIQMPKGAM-NSHDSACASA-N	442.444	1.360	50	20	IDGD	
COC(=O)CN1CCN(c2ccc(NC(=O)C(=O)NNc3cc(C)cc(C)c3)cc2)CC1	783356000	DFNOKDVTOIHMCP-UHFFFAOYSA-N	439.516	1.680	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2cc(F)ccc2SCC(F)F)CCS(=O)(=O)C1	783428630	XUHGWXVDRHZXKQ-OAHLLOKOSA-N	425.454	1.319	50	20	IDGD	
CCOc1cccc2[nH]cc(CC(=O)N3CCN(S(=O)(=O)CBr)CC3)c12	783698389	VBNAAQSVKXAHBM-UHFFFAOYSA-N	444.351	1.936	50	20	IDGD	
Cn1c(C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)cc2c(=O)n3ccccc3nc21	784291268	UNUUTOVXDKVRMF-UHFFFAOYSA-N	427.424	1.651	50	20	IDGD	
O=C(NNc1ccc([N+](=O)[O-])cc1Cl)C(=O)Nc1cccc(CN2C(=O)CNC2=O)c1	784391399	IJIBCVUYWLZUEB-UHFFFAOYSA-N	446.807	1.382	50	20	IDGD	
O=C(COCCNC(=O)c1ccccc1)NNC(=O)c1cc(F)ccc1Br	784645889	BTSLTUJWRPNUNG-UHFFFAOYSA-N	438.253	1.796	50	20	IDGD	
COc1ccc2nc(NNC(=O)C(=O)Nc3cc(F)cc(S(N)(=O)=O)c3)c(C)cc2c1	785163341	VNXUCKGGPJTLPZ-UHFFFAOYSA-N	447.448	1.420	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2cc(S(C)(=O)=O)ccc2Cl)n1	785226096	OMVFRVQSJJGHBG-UHFFFAOYSA-N	440.913	1.462	50	20	IDGD	
COCC[C@H](NC(=O)C(=O)Nc1ccccc1S[C@@H](Cl)C(F)(F)F)C(N)=O	785285890	NMKIBRIDIWANEY-LKFCYVNXSA-N	427.832	1.851	50	20	IDGD	
CC[C@@]1(C)Oc2ccc(NC(=O)C(=O)NNC(=O)[C@@H]3COc4ccccc4O3)cc2O1	785987708	GTBYEPKKPMBXPG-UWJYYQICSA-N	427.413	1.510	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)cnc1Br	788140655	QFAIKOBGEZSDBZ-UHFFFAOYSA-N	440.250	1.953	50	20	IDGD	
CC(C)Cn1cnc(S(=O)(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)c1	788917956	XUBRTTWIZPQUNG-UHFFFAOYSA-N	444.558	1.337	50	20	IDGD	
Cc1ccn(C[C@](C)(O)C(=O)OCC(=O)C(C#N)=C2N(C)c3ccccc3N2C)c(=O)c1	790687074	GDCIPJPHWDNSHH-QHCPKHFHSA-N	436.468	1.341	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@@H]2CCS(=O)(=O)c3ccccc32)cc1	791049900	SJOBASMUKCJIOD-OAHLLOKOSA-N	437.499	1.204	50	20	IDGD	
CC(=O)NC1(c2noc(CCC(=O)NNc3nc4ccccn4n3)n2)CCCCCC1	791252112	CCIHFBHDNULVGM-UHFFFAOYSA-N	426.481	1.874	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)NCCCn2c(=O)ccn(C)c2=O)c(C)n1C[C@H]1CCCO1	791263290	VJRWKORIDLFRAF-QRRJMBGHSA-N	439.516	1.258	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)CN2CCN([C@@H](C#N)c3cccc(Cl)c3)CC2)cc1	791625590	SFERDAHTGSHWGF-FQEVSTJZSA-N	436.903	1.855	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@](C)(O)Cn2cc(C(F)(F)F)ccc2=O)cc1OC	792013444	WXZUTFIZGIDMEU-GOSISDBHSA-N	443.378	1.097	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cnc(CC(C)C)nc2)cc1	792356044	YFOMEBXTPUMGAV-AWEZNQCLSA-N	429.477	1.627	50	20	IDGD	
CNS(=O)(=O)c1ccc(NC(=O)NNC(=O)COc2ccc(C(C)(C)C)cc2)nc1	792397252	GTLUOLIAHRIZIZ-UHFFFAOYSA-N	435.506	1.519	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CN(CCO)Cc2ccc(Br)s2)c1	792484628	LIOYPRMXGNKCFX-UHFFFAOYSA-N	437.319	1.638	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)nc1Br	793026685	TWOYWTNVXDXAGH-UHFFFAOYSA-N	427.642	1.911	50	20	IDGD	
Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)NNC(=O)CNC(=O)OCc1ccccc1	794599247	XBYZHMSQENXCPJ-UHFFFAOYSA-N	436.446	1.448	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)CCN(C)C(=O)OC(C)(C)C)cc1	794767760	WATZDFOYTDBOGZ-UHFFFAOYSA-N	442.538	1.020	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)c1ccc(N2CCCS2(=O)=O)cc1	795152317	RJMVCMKGZYWYPD-UHFFFAOYSA-N	438.531	1.234	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CN2CC[C@H](N3CCN(C(=O)OC(C)(C)C)CC3)C2)c1	796615513	KNVIILYFXMZDJN-IBGZPJMESA-N	445.564	1.383	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(OCc3noc(C4CC4)n3)cc2)n1	797369646	CHZOMXICIPICOW-UHFFFAOYSA-N	436.428	1.629	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NC(=O)NNC(=O)Cc2cccc3ccccc23)nc1	797652468	GREAKNGSBZCSCK-UHFFFAOYSA-N	427.486	1.881	50	20	IDGD	
C=C(C)[C@H]1OCC[C@@H]1CNC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	798116044	BHHIMXRBRQWSEA-SJLPKXTDSA-N	436.534	1.396	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)N2CCN(CC(=O)N3CCCCC3)CC2)c1C	798118355	RGYCOTIBCPYPMB-CJLVFECKSA-N	441.576	1.815	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)NCCCNC(=O)/C=C/c2ccccc2)c1	800073344	QRMGXUDTFBUUFC-MDZDMXLPSA-N	426.473	1.868	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)c2nn(-c3ccc(Cl)cc3)cc2O)c1	801372993	QQDBQWAICWWZRH-UHFFFAOYSA-N	439.815	1.721	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])o1)Nc1ccc2c(c1)OCO2	802102923	GHVXCBRWUJTKLQ-NSHDSACASA-N	431.361	1.374	50	20	IDGD	
CSC[C@H](C(=O)NNc1ccc2c(=O)[nH]ccc2c1)N1C(=O)[C@H]2CCCC[C@@H]2C1=O	803431536	BZOSLYOJBUVJLJ-YESZJQIVSA-N	428.514	1.878	50	20	IDGD	
CN(CC(=O)NNc1ccc(-n2ccnc2)nn1)c1cc(Br)ccc1[N+](=O)[O-]	804953046	YTMANSLSRYLAOA-UHFFFAOYSA-N	447.253	1.913	50	20	IDGD	
COC(=O)c1cn(CCNC(=O)NNC(=O)c2cc3c(s2)CC[C@H](C(C)(C)C)C3)nn1	807250932	OXZCBSYWPPGTGP-ZDUSSCGKSA-N	448.549	1.921	50	20	IDGD	
CCN1CCN(Cc2ccc(NC(=O)C(=O)NNc3nccnc3C3CCC3)cc2)CC1	807461882	ZCMVBSPLZZCPEX-UHFFFAOYSA-N	437.548	1.963	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)c1ccc(S(=O)(=O)N(C)C(C)C)cc1	811258419	WLTPUZQKAWEPKG-UHFFFAOYSA-N	435.502	1.564	50	20	IDGD	
COC[C@]1(CNC(=O)NNC(=O)COc2ccc(OC)cc2)OCCc2ccccc21	812478646	ZPAXQUKNPUELFM-QFIPXVFZSA-N	429.473	1.519	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2ncccc2C)cc(C(=O)NNC(=O)c2ncccc2C)c1	813495762	BKFIQCFDELEBOZ-UHFFFAOYSA-N	446.467	1.551	50	20	IDGD	
O=C(Cc1csc(N2CCOCC2)n1)NN=Cc1ccc(Cl)cc1-n1cncn1	814771074	TXNDQYSQTDPHCL-UHFFFAOYSA-N	431.909	1.907	50	20	IDGD	
CCOc1ccc(NNC(=O)C(=O)Nc2ccc(S(=O)(=O)N(C)C3CC3)cc2)cc1	815817506	WECKCKWVETYRNR-UHFFFAOYSA-N	432.502	1.950	50	20	IDGD	
O=C(Nc1ccccc1C(=O)N1CCN(S(=O)(=O)CBr)CC1)C1CC1	815964959	XQIBSDWKCJWLSP-UHFFFAOYSA-N	430.324	1.475	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)[C@@H]1CSCN1C(=O)CC(C)(C)C	817055245	SNWDEUQNAZRXSM-AWEZNQCLSA-N	428.580	1.718	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)NCc2ccc(C(=O)NNC(=O)CC3CC3)cc2)cc1	819135931	HNQFZYMFJBHNII-UHFFFAOYSA-N	429.498	1.929	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)[C@@H](O)[C@@H](O)c1nc2ccccc2s1	825477592	RPVCNMDNWJWHDG-ZWKOTPCHSA-N	431.470	1.316	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN(Cc1ccc(C(N)=O)cc1)C1CC1	912889575	GEXMLIFOQHLZQQ-UHFFFAOYSA-N	430.892	1.873	50	20	IDGD	
CCNC(=O)CN1CCN(C(=O)/C(C#N)=C\c2cc(C)n(C[C@@H]3CCCO3)c2C)CC1	913010178	UNABPIHXKQJSPP-MSTPFNHUSA-N	427.549	1.471	50	20	IDGD	
O=C(NNC(=O)N1CCN(S(=O)(=O)c2cccc3nsnc23)CC1)c1ccccc1	913632560	CEHXYDAQTWJBMT-UHFFFAOYSA-N	446.514	1.052	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)[C@H]1CC(c2cccc(F)c2)=NO1	915132480	CWHCHAYBECGNNJ-OAQYLSRUSA-N	439.491	1.678	50	20	IDGD	
O=C(NNC(=O)c1ccccc1-n1cccn1)c1cccc(S(=O)(=O)N2CCCC2)c1	916030377	YTQJTKXSXAYWAN-UHFFFAOYSA-N	439.497	1.732	50	20	IDGD	
Cc1nnc(O)c(C(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)c1C	916160469	PFCWISZLDKMIIH-UHFFFAOYSA-N	447.498	1.736	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CCNS(=O)(=O)c2c(C)cc(C)cc2C)cc1	916830787	XHUPEGZXMAQTQC-UHFFFAOYSA-N	446.529	1.375	50	20	IDGD	
C#CCNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cc(-c3ccc(C)cc3)[nH]n2)cc1	917178619	ZREZIMSIQRQFOE-UHFFFAOYSA-N	437.481	1.371	50	20	IDGD	
C[C@]1(NNC(=O)NCCC(=O)Nc2ccc(Br)cc2)CCS(=O)(=O)C1	918127570	NXILAAGWVDREHE-HNNXBMFYSA-N	433.328	1.159	50	20	IDGD	
CCN(C[C@H]1COc2ccccc2O1)C(=O)NNC(=O)c1csc(N2CCOCC2)n1	918776664	WOEDMHSXRRFCHQ-AWEZNQCLSA-N	447.517	1.496	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)CCNC(=O)c2ccc(F)cc2)c2ccccc2c1=O	919692832	WXUQUOYMCNOGIL-UHFFFAOYSA-N	439.447	1.698	50	20	IDGD	
CNS(=O)(=O)c1ccc([C@@H](C)NC(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)cc1	919779404	RLKVRHBOSJSOGB-OLZOCXBDSA-N	438.481	1.593	50	20	IDGD	
COc1ccc(-n2ccc(CNC(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)n2)cc1	919916504	IWXRNUXHODTZTE-UHFFFAOYSA-N	433.432	1.001	50	20	IDGD	
C[C@H](COc1ccc(F)cc1F)NC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	919922362	UXAICPSQABJFDO-LLVKDONJSA-N	427.429	1.780	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)n(Cc2ccccc2)n1	920928483	IBXNTAAMYYXTTI-UHFFFAOYSA-N	431.456	1.953	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)Nc1cccc(CN2CCC[C@@H]2C(N)=O)c1	920933377	NOXIWTRYKLLSFE-RDTXWAMCSA-N	443.479	1.896	50	20	IDGD	
Cc1cc(C)c(C)c(S(=O)(=O)NCC(=O)NNC(=O)c2n[nH]c3c2CCCC3)c1C	1248509505	MYOPLHVNASQOSU-UHFFFAOYSA-N	433.534	1.262	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc2ccccc2c1)NNC(=O)c1cncn1-c1ccccc1	1317695937	KUIVJJSQKYJMMQ-UHFFFAOYSA-N	449.492	1.765	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1	1317920337	HHIBJEVRRLYSAP-KRWDZBQOSA-N	425.489	1.541	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)c3cc4c(s3)CCCC4)C2)C1	1778476120	JOJNWMQOZJTTIQ-JOCHJYFZSA-N	448.589	1.443	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3nc4cc(C)c(C)cc4[nH]3)C2)C1	1778925871	CJRCQRJYOCHTJK-VFNWGFHPSA-N	434.924	1.877	50	20	IDGD	
CC(=O)O[C@H](C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)Br)C2)C(C)C	1779210771	HHJOQTCCUSRIJQ-JNNRSPCRSA-N	447.370	1.871	50	20	IDGD	
C[C@@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CO[Si](C)(C)C)C1)N1C[C@H]2C[C@H]2C1	1779545536	VUFJJVNYQLNTHV-FEEZOJJESA-N	437.657	1.692	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3c[nH]c4ccc(OC)nc34)C2)C1	1780045786	FRTCIXPLIKTZNV-JLTOFOAXSA-N	436.896	1.269	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H]2CCCCN2C)C1	1780595211	XMGHSIRXWDQDBB-YIOZNXECSA-N	430.387	1.768	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2)c1cc2ccsc2[nH]1	1781265036	DSZBWYKLYYJEAJ-SPYBWZPUSA-N	425.938	1.957	50	20	IDGD	
C[C@H](C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@](C)(Cl)CCl)C2)n1ccnn1	1781548336	CXDGFCLBKVRBMB-DTTOXWODSA-N	432.352	1.589	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3c(O)cc(O)cc3O)C2)C1	1781814843	UXZITHZUUGGDEP-QZTJIDSGSA-N	433.288	1.483	50	20	IDGD	
CC(C)[C@@H](O)C(=O)N1CCO[C@@]2(CCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1	1782862047	OCCYVDXOXCMQMM-UNHHPSKZSA-N	433.455	1.719	50	20	IDGD	
CNc1nsnc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)CBr)C[C@@H]21	1783518876	CWGSGGDYAWHRJP-BJDJZHNGSA-N	446.371	1.204	50	20	IDGD	
CCc1[nH]nc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](C)Br)C3)C2)c1Cl	1783532674	MICWNGGOCZJYBE-QLJPJBMISA-N	433.734	1.852	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CC3CCN(C)CC3)[C@H]2C1	1783657033	UEYOWYSHMUCRMV-FJIDUMEYSA-N	444.414	1.872	50	20	IDGD	
Cc1ccc(CCC(=O)N2CCO[C@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)s1	1783933044	BMQQRSCLAVRBAQ-NRFANRHFSA-N	436.578	1.192	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1c[nH]c(C(C)(C)C)c1)CCO2	1783935641	AZSKSOMGBMBTKS-JOCHJYFZSA-N	433.553	1.129	50	20	IDGD	
C[C@H](Cc1ccccc1)C(=O)N1CCO[C@@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1	1783938505	ZRKYGKMMBGSOMR-WZONZLPQSA-N	430.549	1.068	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3F)C[C@@H]21	1783965310	HFUPRFPPSBOYQA-DSPQJCBJSA-N	428.302	1.845	50	20	IDGD	
CC(C)COc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]3C2)ccn1	1784090990	SIPDPEVANIBRCD-FJIDUMEYSA-N	439.940	1.309	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](C)Oc3ccccn3)C2)C1	1784490687	BMGZQLBLBNSCED-ZRGWGRIASA-N	440.338	1.852	50	20	IDGD	
CC[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)Br)C[C@@H]21)N(CC)CC	1784632204	JFYICLZTAJZNSM-HMDCTGQHSA-N	432.403	1.870	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H]2C[C@H]2C[C@@H]1C(=O)N1CC[C@]2(CN(C(=O)[C@H](F)Cl)CCO2)C1	1785591413	GFSKOOVBZPFDGC-LBZHBENTSA-N	445.919	1.749	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC1(c2ccc(NC(=O)c3cccc(=O)n3O)cc2)CCC1	1787080027	VKXFIXKCLOIVEB-UHFFFAOYSA-N	441.488	1.206	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C[C@H]3CNc4ccccc4O3)C[C@@H]21)[C@@H](F)Cl	1787446650	VDRCLOCQHIWJDR-DPSXKDBOSA-N	425.888	1.764	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C[C@H]3CNc4ccccc4O3)C[C@@H]21)[C@H](F)Cl	1787446652	VDRCLOCQHIWJDR-SVZGUOJNSA-N	425.888	1.764	50	20	IDGD	
CC(=O)N[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]2C1)c1ccc(F)cc1	1787448619	CJEGNPNGZQQOGR-PEJOBZMASA-N	443.878	1.517	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cn4ncccc4n3)[C@H]2C1	1788016431	GPBHXMFGCBVEQU-ABHRYQDASA-N	436.310	1.106	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4[nH]ccc4n3)[C@H]2C1	1788319730	GXSOPFSGPPSVDT-MRHIQRDNSA-N	435.322	1.940	50	20	IDGD	
COc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]3C2)nn1C	1789872752	VYTKBBCIMJEMEP-XBPIAWKYSA-N	433.336	1.258	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nc4ccccc4[nH]3)C[C@@H]21)[C@H](F)Br	1789922780	NCBZHTZSMODOCI-GVARAGBVSA-N	439.285	1.847	50	20	IDGD	
N#Cc1ccc(F)c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Br)C[C@@H]32)c1	1790227625	JHKUNZFXMCAQNL-DLKVLKDVSA-N	442.260	1.981	50	20	IDGD	
COc1cccc2[nH]cc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)[C@@H](O)CCl)C[C@@H]43)c12	1790423514	MTJSCLRBYWCTES-GKEYINFOSA-N	435.908	1.370	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1ccc(C2(NC(=O)CC(F)(F)C(=O)O)CCC2)cc1	1791599322	HSNOYDGQLKMIAA-UHFFFAOYSA-N	440.447	1.604	50	20	IDGD	
COC(C)(C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)C2	1792575470	SCCINPDKRFSGLC-SQABCVSLSA-N	433.455	1.886	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](Br)Cc1ccccc1)C2)c1cnco1	1793566835	ISJWSFCUBVNIDB-DFGXFYAUSA-N	448.317	1.884	50	20	IDGD	
C[C@@H](NC(=O)c1ccc(F)cc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Cl	1796367696	PKBFAFAWWXJCPH-MIGXYKPQSA-N	429.851	1.068	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2ncnn2c1	1797559792	HSZUHFLSZYBOOZ-HRJSJKBJSA-N	426.304	1.169	50	20	IDGD	
CCOC(=O)O[C@@H](C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@](C)(Cl)CCl)C2	1800230990	GVSWVYXHSWSKAW-QLLRCSDMSA-N	425.309	1.374	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2	1800785604	HMOLUUUWZLLXGG-AICCOOGYSA-N	433.908	1.510	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)C(C)(C)CCl)C3)C1	1800962592	RVWBHYVGBNJGPJ-NNXHMXCWSA-N	428.957	1.820	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccn(-c3ccccc3)n1)C2	1800979310	ZGLHDCMTXQCOTE-HIRMHNASSA-N	432.908	1.329	50	20	IDGD	
COc1ccc([N+](=O)[O-])c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C(Cl)Cl)n1	1801014750	BEKPRVKMRYRPIC-BZBKMWRSSA-N	433.248	1.005	50	20	IDGD	
C[C@H](NC(=O)c1cnccn1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](C)Br	1801962970	GSALNMIGKSPVGV-XHJNMGKDSA-N	438.326	1.017	50	20	IDGD	
CC(C)(C)OC(=O)N1C(=O)CC[C@H]1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](O)CCl)C2	1802617091	JLMKIEKTYPVIMZ-AICCOOGYSA-N	443.928	1.150	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)Cc2cnc3ccccn23)[C@@H]1c1cccnc1)[C@H](O)CCl	1803137773	RNBNUKWQRXKGIP-YRISNDGFSA-N	441.919	1.578	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)o1	1807364707	JUTRRLVELNZXAT-WIYYLYMNSA-N	433.273	1.296	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)c2cnoc2)[C@@H]1c1cccnc1	1808417583	NCNCMAMXIFCSAN-CPJWQURSSA-N	449.471	1.523	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)c1cc2cccn2cn1	1809446934	RBYRMEGHAARDII-ZYSHUDEJSA-N	427.892	1.649	50	20	IDGD	
Cc1ocnc1C(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1811076562	QLYZJESBUUPNEC-UZLBHIALSA-N	428.493	1.071	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1ccc(F)cc1	1811900966	QGYBWBAQRGWKNT-UGKGYDQZSA-N	447.275	1.534	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)NC[C@H]1CCN(C(=O)C(O)O)[C@@H]1c1cccnc1	1812440581	LZJQFIGHRXOPHR-VGNCGENASA-N	442.422	1.283	50	20	IDGD	
Cc1ccc(C(=O)C(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)cc1	1812961999	YLAOWJXMHNYLPF-GBESFXJTSA-N	429.904	1.878	50	20	IDGD	
O=C(O)CSCC(=O)NC[C@@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1	1813084545	ZUJLPAIGPFCLEZ-SUMWQHHRSA-N	444.351	1.690	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@H]2c2cccnc2)c1	1813894892	KFFUVQVVHVSSCU-SXLOBPIMSA-N	444.919	1.959	50	20	IDGD	
C[C@H](CBr)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](N)CCC(N)=O)[nH]n1	1814780872	UAFRAVQXKGFLTK-MDZLAQPJSA-N	443.346	1.026	50	20	IDGD	
Cc1cnn(CC(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@H](F)Br)CC3)c1	1815760176	PXAHIFHGQBJHLA-ZANVPECISA-N	430.303	1.951	50	20	IDGD	
Cc1cc(NC(=O)CC(=O)Nc2cc([C@@H]3CCCCN3C(=O)[C@@H](O)CCl)[nH]n2)no1	1818092398	ZNLQUTGTGKCMLC-STQMWFEESA-N	438.872	1.327	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](C)Br)[nH]n1	1819355687	WCSDFHNJNUSIBV-WZRBSPASSA-N	443.346	1.893	50	20	IDGD	
Cc1ncncc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819403412	KWGWQSVIYHSGOK-KRWDZBQOSA-N	449.475	1.126	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1ccccc1F	1820409453	WZLWKXKETCDNCA-LJQANCHMSA-N	436.252	1.848	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc(O)c(F)c2)n[nH]1	1821094987	AMVDTCAMZJPITC-MRXNPFEDSA-N	446.483	1.933	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H]2CCC(=O)N2)[nH]n1	1822088615	WVQILIYRYDNZCB-GMXVVIOVSA-N	426.315	1.854	50	20	IDGD	
COc1nn(C)cc1C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1	1823001170	BDOVWMZVRKGGLA-HQJQHLMTSA-N	446.302	1.802	50	20	IDGD	
O=C(CCn1cncn1)Nc1nc2c(s1)C[C@@H](NC(=O)CCBr)CC2	1826604166	NGFNEOADMBIDAG-JTQLQIEISA-N	427.328	1.522	50	20	IDGD	
CCC[C@H](NC(C)=O)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](Cl)COC)CC2	1828131442	BZFJYAGRVUOBEJ-OBJOEFQTSA-N	430.958	1.614	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CN2CCN(C(C)=O)CC2)CC1	1828493670	RTKKROLAMIUELL-PMACEKPBSA-N	441.016	1.788	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)CN(C)C(=O)C(=O)O)CC1	1831160325	GJWSTEWXYBAJME-JKSUJKDBSA-N	429.945	1.557	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)[C@H](C)CC)CCO2	1831517998	LRYNJHXKVXOGIQ-FSZRXZPDSA-N	435.359	1.023	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)/C=C/c3ccoc3)CCO2)C1	1832652350	FUVXRNUTYRHZQA-RNYZBBNUSA-N	427.295	1.533	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cccnc3Cl)CC2)CC1)[C@@H](O)CCl	1833307390	RULGDTGODHTAQR-INIZCTEOSA-N	429.348	1.520	50	20	IDGD	
COc1nccc(C(=O)N2CCC(N3CCC(NC(=O)[C@H](O)CCl)CC3)CC2)c1F	1833310192	BMZYKEBFEBYNLW-MRXNPFEDSA-N	442.919	1.014	50	20	IDGD	
Cc1c(C(=O)N2CCC(N3CCC(NC(=O)[C@@H](O)CCl)CC3)CC2)nc2ccccn12	1833310550	RLEXKKZCSRGZLJ-SFHVURJKSA-N	447.967	1.428	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ncc(C)s3)CCO2)C1	1833805224	LBQZNVFVSCIICY-SUMWQHHRSA-N	446.367	1.695	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cnc(N(C)C)o3)CC2)CC1	1834098785	LGMUDSCMWVAAHW-INIZCTEOSA-N	441.960	1.180	50	20	IDGD	
COC(=O)CCC(=O)NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1834434468	CNXVHVISTGRORU-MRXNPFEDSA-N	436.322	1.202	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3cccc(F)c3)CCO2)C1	1835027544	APJHGAWNVLARAM-LIRRHRJNSA-N	443.313	1.608	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccc(F)cc3)CCO2)C1	1835052160	TWOWCKCBJXONGH-IFXJQAMLSA-N	443.313	1.608	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)c1ccc2nccnc2c1	1835401768	UJUMAFXKIXUQIE-HXUWFJFHSA-N	445.951	1.415	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(CN(C(=O)/C=C/c3ccccc3N)CCO2)C1	1835777731	ZWRCEFODUKVHRN-UVIRAJKCSA-N	447.608	1.590	50	20	IDGD	
CCc1cc(C(=O)NC2CCN(C3CCN(C(=O)[C@H](Cl)COC)CC3)CC2)nn1C	1836034416	QIRSUKREALZUDA-GOSISDBHSA-N	439.988	1.422	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(COC)c[nH]3)CCO2)C1	1838513005	UWRIRSGZFNWRRM-OXQOHEQNSA-N	427.929	1.639	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(F)cc3F)CCO2)C1	1839006833	UOFGVJQPWKDERJ-XIKOKIGWSA-N	447.276	1.818	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCn3nc(C)cc3C)C2)C1	1839149079	SSXZAFVUKHJMHE-PXNSSMCTSA-N	426.945	1.364	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc([N+](=O)[O-])[nH]3)C2)C1	1839153491	IKPSTLBYSUXCQA-IAGOWNOFSA-N	449.291	1.229	50	20	IDGD	
Cc1cc(C)nc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)c1	1839199910	ZLJWZFCYACQCNO-CRAIPNDOSA-N	444.301	1.459	50	20	IDGD	
O=C(c1cn2c(F)cccc2n1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1839554975	SXDOAWBGCXQFPM-MAUKXSAKSA-N	428.823	1.078	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ocnc3C)C2)C1	1839963852	YKSYXMRJUMOULV-SUMWQHHRSA-N	430.299	1.227	50	20	IDGD	
Cc1nc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)sc1C	1840034577	PYMJKZMAMCKBGE-GTNSWQLSSA-N	446.367	1.613	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCCn3ccnc3C)CCO2)C1	1840386397	YMMLPBHQCLDZIU-RXVVDRJESA-N	440.972	1.836	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)C3CCSCC3)CCO2)C1	1840925675	ACYMLCGQLWFDFE-CRAIPNDOSA-N	449.411	1.760	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)CCN3CCCC3)CCO2)C1	1840940464	KOKCXAKKGJQEAU-OALUTQOASA-N	436.380	1.165	50	20	IDGD	
CN(CC(=O)N1CC2(CCCN2C(=O)/C=C/C2CC2)C1)NC(=O)NCc1ccccc1	1841374701	YKMGAHWWSYLXJQ-ZHACJKMWSA-N	425.533	1.502	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@H]1C[C@@H]3C[C@@H]3N1C(=O)OC(C)(C)C)C2	1846365696	PGULBBMVQVAKKQ-YHUYYLMFSA-N	441.956	1.842	50	20	IDGD	
O=C1CC[C@@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](Br)Cc2ccccc2)CN1	1847323865	BPFPJRCKIVSBQD-BDXSIMOUSA-N	448.361	1.721	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H]1CC(=O)N(C2CCCC2)C1	1848045875	ZISSQANEECTVCQ-VDERGJSUSA-N	426.355	1.763	50	20	IDGD	
CCOc1cc(C(=O)NNc2nnc(C)c(O)n2)ccc1OCC(=O)N1CCCCC1	23309472	XJZFSPKJTLUKRJ-UHFFFAOYSA-N	430.465	1.433	50	20	IDGD	
O=C(Cn1cc(Br)c(=O)nc1O)NNC(=O)CC12CC3CC(CC(C3)C1)C2	302796655	DTKQIEDVFXVRJC-UHFFFAOYSA-N	439.310	1.465	50	20	IDGD	
COc1cccc(C2CC(=O)C(=CNNC(=O)CNC(=O)c3cccs3)C(=O)C2)c1	725904276	IIZQCYKBQMGWQT-UHFFFAOYSA-N	427.482	1.707	50	20	IDGD	
COc1ccccc1[C@@H](CNC(=O)NNC(=O)CNC(=O)c1ccco1)N1CCCC1	726084304	OYVXWPNXBHBLGR-MRXNPFEDSA-N	429.477	1.186	50	20	IDGD	
COc1ccc([C@@]2(C)NC(=O)N(CC(=O)NNc3nc(-c4ccncc4)no3)C2=O)cc1	726376430	KUSSPUQETJJAAE-HXUWFJFHSA-N	437.416	1.051	50	20	IDGD	
CC(=O)N[C@@H](CC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)c1c(F)cccc1F	727364667	BFBCWBSGRJESDI-INIZCTEOSA-N	443.410	1.240	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)[C@H]1Nc2ccccc2S(=O)(=O)N1	727753017	QXKQOFSBHRHLLS-INIZCTEOSA-N	443.510	1.610	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(C)c(C(=O)NNc2nc(-c3cccnc3)no2)c1	728078455	GKNLODFQQFRXAE-UHFFFAOYSA-N	432.462	1.122	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3cccc(OC(F)F)c3)cc2)CC1	728213208	GPDCRXDQOJIUFF-UHFFFAOYSA-N	440.472	1.981	50	20	IDGD	
O=C(COC(=O)c1cc(F)c(F)c(F)c1F)NNC(=O)[C@H]1COc2ccccc2O1	728326599	BWJMXRBSCPQTBU-GFCCVEGCSA-N	428.294	1.387	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NN=Cc1cn(Cc2ccccc2)nc1-c1ccccc1	728435480	BWZWISAKUKUDPT-MRXNPFEDSA-N	425.514	1.986	50	20	IDGD	
CN1C(=O)Cc2cc(S(=O)(=O)NNC(=O)c3cc(F)ccc3Br)ccc21	728510060	UDDJNJHODZOPLO-UHFFFAOYSA-N	442.266	1.730	50	20	IDGD	
CNC(=O)c1ccc(C(=O)NNC(=O)COc2ccc(-c3ccc(C#N)cc3)cc2)cn1	728511339	JXGWIRYRIHYHIM-UHFFFAOYSA-N	429.436	1.820	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)[C@H]2CCCN2c2ncnc3sccc23)c2ccccc2c1=O	728512297	OCCHCFANAKMCEO-OAHLLOKOSA-N	449.496	1.368	50	20	IDGD	
O=C(CC/N=C1/NS(=O)(=O)c2ccccc21)NNC(=O)c1cccc(OC(F)F)c1	728545567	PCENALBCRUHBLR-UHFFFAOYSA-N	438.412	1.178	50	20	IDGD	
COc1cccc(C(=O)NCC(=O)NNC(=O)c2cc(OC)ccc2Br)c1	728612310	QCKSZCIOSYRDDS-UHFFFAOYSA-N	436.262	1.657	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)Cc2ccc(F)c(Br)c2)n1	728733366	VKUVBHCKWIXWQG-UHFFFAOYSA-N	444.282	1.829	50	20	IDGD	
CCn1cc(Br)cc1C(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	732336881	XFGPVMJAXKGBLZ-UHFFFAOYSA-N	439.222	1.797	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)NNC(=O)NNC(=O)c1cnn(-c2ccccc2)c1	733348135	IDFSYFZBVGKZOS-UHFFFAOYSA-N	427.852	1.884	50	20	IDGD	
CCOCCCN1CC[C@H](NC(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)[C@@H](C)C1	734685803	IBYIVEIBZBCCFD-HKUYNNGSSA-N	433.553	1.709	50	20	IDGD	
C[C@@H](CN1CCN(c2ccccn2)CC1)NC(=O)NNC(=O)NCc1ccc(Cl)cc1	735519204	QTRWNIQHASENDK-INIZCTEOSA-N	445.955	1.959	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCN([C@@H](C)c3cccnc3)CC2)cc1OC	735871835	YAHSYXDFGCFFJQ-INIZCTEOSA-N	427.505	1.239	50	20	IDGD	
CC(C)[C@H](Cc1ccccc1)C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	740086541	ZJZSMHOTEUFEJV-IBGZPJMESA-N	445.589	1.976	50	20	IDGD	
COCCNS(=O)(=O)c1c[nH]c(C(=O)NNC(=O)CC23CC4CC(CC(C4)C2)C3)c1	741143422	TVGGZZMOZZBYQW-UHFFFAOYSA-N	438.550	1.307	50	20	IDGD	
O=C(NNC(=O)c1cccc2ccccc12)c1ccc(S(=O)(=O)N2CCOCC2)cc1	741581744	HOSVVHPYWMSPQX-UHFFFAOYSA-N	439.493	1.936	50	20	IDGD	
COc1ccc(N2CCN(CCNC(=O)NNC(=O)COc3ccccc3F)CC2)cc1	743362833	JKTYRUPDQFDORE-UHFFFAOYSA-N	445.495	1.366	50	20	IDGD	
CCN(C1CCN(C(=O)NNC(=O)c2cccc(Br)c2)CC1)S(C)(=O)=O	743688092	VZXQKYVGMZRMKH-UHFFFAOYSA-N	447.355	1.549	50	20	IDGD	
O=C(CN1C(=O)Cn2c(cc3ccccc32)C1=O)NNC(=O)NCCc1cccs1	743900936	QKSZKXVKGROZNX-UHFFFAOYSA-N	425.470	1.258	50	20	IDGD	
CC(C)[C@@H](C(=O)OCC(=O)NNC(=O)c1ccc(C#N)cc1)S(=O)(=O)C1CCCCC1	744952718	GNQYEALNERKOKM-IBGZPJMESA-N	449.529	1.635	50	20	IDGD	
C[C@@]1(C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)CCCN(C(=O)c2ccccc2)C1	745350976	RQQXWQSKCSHJTL-XMMPIXPASA-N	448.479	1.805	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)NCCCOC1CCOCC1	745845989	ZRARSWWWJSHNFF-UHFFFAOYSA-N	433.553	1.115	50	20	IDGD	
CCCCN1C(=O)CC[C@H](C(=O)NNC(=O)N2CCOCC2)[C@H]1c1ccc(OC)cc1	745988311	XMWRSMOMEVOXEF-AZUAARDMSA-N	432.521	1.848	50	20	IDGD	
Cc1ccc(S(=O)(=O)Nc2ccc(F)cc2)cc1C(=O)NNC(=O)N1CCOCC1	745993063	VPYQEEONURPEGP-UHFFFAOYSA-N	436.465	1.622	50	20	IDGD	
COc1cc(/C=C/C(=O)NNC(=O)N2CCOCC2)ccc1OCc1c(C)noc1C	745995810	CKJBDPFZMRDDPI-FNORWQNLSA-N	430.461	1.965	50	20	IDGD	
NC(=O)CC[C@H](C(=O)NNC(=O)CCCc1ccccc1)N1C(=O)c2ccccc2C1=O	746210521	SHAKVEZVTFWPHS-GOSISDBHSA-N	436.468	1.087	50	20	IDGD	
COc1cccc(NC(=O)COc2ccc(C(=O)NNC(=O)C(=O)N3CCCC3)cc2)c1	748247275	WWNARWPMVIXTEP-UHFFFAOYSA-N	440.456	1.096	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@](F)(C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)C1	748297513	SRRBGDVXTUEQOC-SFHVURJKSA-N	429.470	1.200	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)NCCC1CCN(CC(F)(F)F)CC1	748965499	GEEQQCWTYKXCPR-UHFFFAOYSA-N	426.443	1.872	50	20	IDGD	
CN(C)CCOc1ccccc1N1CCN(CC(=O)NNC(=O)c2cccs2)CC1	750047274	MDOMPTFJIDVULX-UHFFFAOYSA-N	431.562	1.272	50	20	IDGD	
NS(=O)(=O)c1ccc(CCC(=O)NNc2nc(Br)cn3ccnc23)cc1	750250192	OGOUTGZFMRWQLN-UHFFFAOYSA-N	439.295	1.215	50	20	IDGD	
CCOc1ccc(OCC)c(NC(=S)NNC(=O)c2cc(S(N)(=O)=O)oc2C)c1	754202433	YOMABZKZKSNPKC-UHFFFAOYSA-N	442.519	1.664	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)NCCN2C(=O)[C@@H]3[C@@H](C2=O)[C@H]2C=C[C@H]3C2)c(Cl)c1	755245875	CBLSWCOEOGUFIG-APYUEPQZSA-N	431.880	1.791	50	20	IDGD	
O=C(NN=Cc1nn[nH]c1-c1ccccc1)c1cccc(S(=O)(=O)N2CCOCC2)c1	755466609	IOGQMXCTADAQRI-UHFFFAOYSA-N	440.485	1.257	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)c1ccc(O)c([N+](=O)[O-])c1	755515273	AANDQPOOVYSSAV-UHFFFAOYSA-N	447.879	1.533	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)Nc2ccc(-c3csc(N4CCOCC4)n3)cc2)cn1	755582051	KPYGQYUFLSJCBX-UHFFFAOYSA-N	427.490	1.847	50	20	IDGD	
CN1CC(=O)N(c2cccc(NC(=O)NNC(=O)[C@@H]3COc4ccccc4O3)c2)C1=O	755991839	LSQBCJYJEZALGV-INIZCTEOSA-N	425.401	1.078	50	20	IDGD	
Cc1c(NC(=O)NNC(=O)COc2ccccc2C#N)cccc1S(=O)(=O)NC1CC1	756705932	NVKDVUYPHYXESG-UHFFFAOYSA-N	443.485	1.539	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)N[C@H]1CCN(C(=O)CCc2ccccc2)C1	756981059	YTPSXMDNUQJZDB-SFHVURJKSA-N	434.500	1.441	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)c(C)n1C1CCCCC1	758039137	HTTSLWUYQKIYJY-MPMPPSQCSA-N	435.550	1.602	50	20	IDGD	
C[C@H](CC(=O)NNc1nc(O)c2ccccc2n1)/N=C1/NS(=O)(=O)c2ccccc21	758308787	CSGORVRVSUMJMC-LLVKDONJSA-N	426.458	1.296	50	20	IDGD	
CCN(CC)[C@@H](C(=O)N1CCN(S(=O)(=O)CBr)CC1)c1ccccc1	758534071	BEBRXLRZVKEZEA-MRXNPFEDSA-N	432.384	1.896	50	20	IDGD	
C[C@@H](NC(=O)OC(C)(C)C)[C@H]1CCCN(CC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)C1	758781154	VWVYSLMUKPQRRK-ZBFHGGJFSA-N	449.508	1.981	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)N[C@@H]1CCC[C@H]2OCC[C@H]12	761796575	YJXXQEYMAUDMMV-KZNAEPCWSA-N	436.534	1.373	50	20	IDGD	
COC(=O)c1cn([C@@H]2CCCN(C(=O)NNC(=O)Cn3ccc4ccccc43)C2)nn1	762576147	CBLWVVXUDOPRRF-OAHLLOKOSA-N	425.449	1.097	50	20	IDGD	
CO[C@H](C)C(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3n2)c1	763450619	OKXONYLUSMOTAK-CYBMUJFWSA-N	435.440	1.608	50	20	IDGD	
COc1cc(C(=O)NNC(=O)N[C@@H]2CCCC[C@@H]2N2CCOCC2)cc(OC)c1OC	763536450	PZPKLAZCJQEWFX-CVEARBPZSA-N	436.509	1.300	50	20	IDGD	
COc1cc(OC)c(OC)cc1NC(=O)C(=O)NNC(=O)c1ccc(OC)c(OC)c1	763549905	BFKATRBTPBZXBP-UHFFFAOYSA-N	433.417	1.129	50	20	IDGD	
CCOC(=O)c1c(F)cccc1NC(=O)C(=O)NNC(=O)COc1ccccc1OC	763663828	OAXYCKRVJAGLEM-UHFFFAOYSA-N	433.392	1.176	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)C(=O)Nc1cc(N2CCCC2=O)ccc1F	763678295	CGZHMEMTQBHFGE-UHFFFAOYSA-N	432.383	1.257	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccccc1N1CCN(C)CC1	763714510	XXBRTASNFUKQAF-UHFFFAOYSA-N	439.516	1.166	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C)cc2)cc1Cl	763809936	WAINWMRDCDOMHQ-UHFFFAOYSA-N	449.847	1.365	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C)c(N3CCCS3(=O)=O)c2)cc1	763829211	CUFUTFQZCNNDHZ-UHFFFAOYSA-N	444.513	1.497	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc3ccccc3c2)cn1C	763849851	LAQZXHVIUNMFSO-ZDUSSCGKSA-N	438.440	1.518	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(C(C)=O)cc2)ccc1F	763879627	ZZRTXTUZNCTNPC-GFCCVEGCSA-N	445.403	1.368	50	20	IDGD	
Cc1c(CSC(C)C)cccc1NC(=O)C(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1	764001646	BROLCUDZCXPJNC-CQSZACIVSA-N	427.548	1.157	50	20	IDGD	
O=C(NNC(=O)c1ccc(F)cc1Br)C(=O)Nc1cnn(-c2ccncc2)c1	764086936	XNVITFGRFSZULA-UHFFFAOYSA-N	447.224	1.569	50	20	IDGD	
Cc1cccc(C(=O)N2CCCC2)c1NC(=O)C(=O)NNC(=O)c1ccc(Cl)nc1	764091395	DIJWHPZURDQZTD-UHFFFAOYSA-N	429.864	1.679	50	20	IDGD	
O=C(CC1CCCC1)NNC(=O)C(=O)Nc1cccc(Cn2nc3ccccn3c2=O)c1	764189202	YIYYVGSYDDHWBK-UHFFFAOYSA-N	436.472	1.211	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2c(Cl)cccc2Cl)cn1	764220730	AZTXZURGJZFHQD-UHFFFAOYSA-N	431.257	1.192	50	20	IDGD	
CCOCC(=O)NNC(=O)C(=O)Nc1ccc(Cl)c(C(=O)NCc2cccs2)c1	764317726	OXNMRUXAZOYOCG-UHFFFAOYSA-N	438.893	1.454	50	20	IDGD	
CC(C)(C(=O)NNC(=O)C(=O)Nc1cccc(Cl)c1S(C)(=O)=O)c1ccccc1	764319807	BFZVLZBASSOWCU-UHFFFAOYSA-N	437.905	1.807	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)Cc2ccccc2F)ccc1-n1nnnc1C(C)C	764320370	ZLPOJUJHEDUFBE-UHFFFAOYSA-N	439.451	1.562	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2ccc(N(C)C)cc2C)n[nH]1	764376257	AEVMYKVWVUXPRH-UHFFFAOYSA-N	436.472	1.859	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc(-n4cccn4)nc3)n[nH]2)cc1C	764388058	OVWXOFBUCOILGN-UHFFFAOYSA-N	444.455	1.674	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1cccc(NC(=O)c2ccccc2)c1	764397588	AKRGBGRXKSNMCG-AWEZNQCLSA-N	428.445	1.076	50	20	IDGD	
COC(=O)NNC(=O)C(=O)Nc1ccc(I)cc1Br	765365852	LNVKLVUHWUAEOR-UHFFFAOYSA-N	442.007	1.379	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)NCCCN1C(=O)NC2(CCCCC2)C1=O	765639702	CEQZFYUWHHQPAX-UHFFFAOYSA-N	437.522	1.361	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@H](C)OC[C@@H]3CCCCO3)CC2)cc1	766650951	YCIGFBPABCGNNV-FPOVZHCZSA-N	432.565	1.234	50	20	IDGD	
O=C(COC(=O)[C@@H]1CC(=O)N(c2ccc(Cl)c(F)c2)C1)NNC(=O)c1ccccc1	766979779	ZBLZOBPMAJOPCU-CYBMUJFWSA-N	433.823	1.836	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)c1cn(-c2ccc(Cl)cc2)nn1	767282394	PLOBUCZOEOODHC-UHFFFAOYSA-N	427.848	1.776	50	20	IDGD	
CCNC(=O)N(C)NC(=O)/C(C#N)=C/c1cn(CCC(N)=O)nc1-c1ccc(OC)cc1	768413587	SPZLGNAWBJFBNB-RVDMUPIBSA-N	439.476	1.034	50	20	IDGD	
O=C(COC(=O)CCC(=O)c1ccc(Cl)cn1)NNC(=O)c1cccc([N+](=O)[O-])c1	769182773	ZESSXMQZHPYJME-UHFFFAOYSA-N	434.792	1.611	50	20	IDGD	
COc1ccc(C(=O)OC[C@H](C)CBr)cc1S(=O)(=O)N1CCOCC1	770308637	XKDLDGMEZXMDNI-GFCCVEGCSA-N	436.324	1.904	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)NCc3cccc(CS(C)(=O)=O)c3)nc21	770370516	SPQZUJVIJQDDFP-UHFFFAOYSA-N	447.521	1.658	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)[C@H]1CC(=O)N(CCOc2ccccc2Cl)C1	772215756	IXBCMHZTPHPEMC-OLZOCXBDSA-N	425.869	1.056	50	20	IDGD	
COC(=O)Cn1cc(C(C)=NNC(=O)[C@H]2Cc3ccccc3CN2Cc2ccccc2)nn1	772840860	AHUFZNKWLHECHS-JOCHJYFZSA-N	446.511	1.918	50	20	IDGD	
CCC(=O)c1cccc(S(=O)(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)c1	772861674	OTSCBAYDBHMKRL-UHFFFAOYSA-N	438.531	1.504	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)C2=NN(c3ccc(F)cc3)C(=O)CC2=O)c1C	773713275	PAMGISJEIFKSER-AWEZNQCLSA-N	440.431	1.719	50	20	IDGD	
COc1cccc(Cn2nccc2NC(=O)C(=O)NNc2cnc3ccccc3n2)c1OC	773715936	AXHRJRNXVHJKFT-UHFFFAOYSA-N	447.455	1.974	50	20	IDGD	
CC(=O)N(C)c1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)cc1	774001560	ICYIHMLXDHZANB-LBPRGKRZSA-N	432.864	1.876	50	20	IDGD	
CC[C@@H]1Oc2cc([C@H](C)NCC(=O)NNC(=O)Cc3nc(C)cs3)ccc2NC1=O	775462939	GPGSJRBUXPORGW-WFASDCNBSA-N	431.518	1.602	50	20	IDGD	
Cn1nc(CCNC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c2ccccc21	776178503	UGDAZCGWZUPUDN-UHFFFAOYSA-N	449.559	1.659	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)CNC(=O)c1cccs1)[C@H]1CCN(Cc2ccccc2)C1	778639267	APNIIXUHRGWZTM-RDJZCZTQSA-N	429.546	1.719	50	20	IDGD	
O=C(COc1ccc(OCc2ccccc2)cc1)NNC(=O)c1cccn2c(O)nnc12	780848840	RKDAGLUMPPLYSE-UHFFFAOYSA-N	433.424	1.854	50	20	IDGD	
N#Cc1ccc(-c2ccc(OCC(=O)NNC(=O)c3cccn4c(O)nnc34)cc2)cc1	780849345	XYOREFYVYDQKHU-UHFFFAOYSA-N	428.408	1.814	50	20	IDGD	
N#CCCn1cc(/C=C(\C#N)C(=O)NS(=O)(=O)C[C@H]2CCCO2)c(-c2ccccc2)n1	781512991	WYUUEMFGPUMWJI-XYSGSMRZSA-N	439.497	1.996	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)N(C)CCCC(=O)NNc2ncncc2Cl)cc1	781830467	VBSXJIUINNJTSJ-UHFFFAOYSA-N	425.898	1.877	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)C(=O)Nc1ccc(C#N)cc1Cl	782895978	BCEODYYUOIVBON-UHFFFAOYSA-N	448.892	1.213	50	20	IDGD	
Cc1ccccc1NC(=O)NNC(=O)C(=O)Nc1ccc(C(=O)N2CCOCC2)c(F)c1	783411666	WTAOTPNXNSCJOP-UHFFFAOYSA-N	443.435	1.398	50	20	IDGD	
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)NNC(=O)CCCc1cccs1	783826361	FQXWBILSLLZHIA-UHFFFAOYSA-N	427.460	1.775	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2cc(C(F)(F)F)ccc2F)cc1S(N)(=O)=O	785167143	XRPIIYQMADEWNA-UHFFFAOYSA-N	434.371	1.882	50	20	IDGD	
COCCNC(=O)c1ccc(NC(=O)C(=O)NNc2cc(F)cc(OC)c2)cc1Cl	785234765	PHKXJDJAQUMLCF-UHFFFAOYSA-N	438.843	1.946	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)c1ccc(S(C)(=O)=O)c([N+](=O)[O-])c1	785343762	HLOLEOJJPOTCDM-JTQLQIEISA-N	441.849	1.880	50	20	IDGD	
CC[C@@]1(C)Oc2ccc(NC(=O)C(=O)NNC(=O)COc3ccccc3[N+](=O)[O-])cc2O1	785990346	FABKSCOINBWXSO-FQEVSTJZSA-N	444.400	1.657	50	20	IDGD	
Cn1nc(-c2ccsc2)cc1NC(=O)C(=O)NNC(=O)COc1ccc(Cl)cc1	787540720	DNWOEGSQJHGWHR-UHFFFAOYSA-N	433.877	1.967	50	20	IDGD	
COC[C@@H](C)Oc1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)[C@H]1Cc2ccccc2O1	787890091	UJRGHFQJNVZAQY-KZULUSFZSA-N	447.875	1.843	50	20	IDGD	
CN1CCN(C(=O)NNC(=O)C2CCN(c3oc(-c4ccco4)nc3C#N)CC2)CC1	788168962	HQBVCRQZDCCBBO-UHFFFAOYSA-N	427.465	1.011	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)c1ccccc1)C(=O)NNc1ccc(-n2ccnc2)nn1	788179720	YXOMILPTKMAWFO-HNNXBMFYSA-N	447.546	1.206	50	20	IDGD	
CC(=NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C)c1ccccc1SC(C)(C)C	788435649	WPYXYVYGRHXZDA-UHFFFAOYSA-N	442.545	1.865	50	20	IDGD	
C[C@@H]1CCC2=S=C(C(=O)NNC(=O)C(=O)Nc3cc([C@@H]4CCCO4)nn3C)C=C2C1	789731420	HEXDWIGUHVQBTE-RISCZKNCSA-N	431.518	1.196	50	20	IDGD	
COC(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)c1	789811169	WIUXCMJLGBBCTQ-YOEHRIQHSA-N	445.859	1.785	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N2CCC(C(=O)NNc3nc4ccccn4n3)CC2)cc1	791239742	MDCOJRCKPZETHO-UHFFFAOYSA-N	444.517	1.672	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@@H](C)C(=O)NNC(=O)[C@](C)(O)Cn1c(C)cccc1=O	792023784	VZJPWUYMMDQJEY-YCRPNKLZSA-N	435.908	1.793	50	20	IDGD	
O=C(NNc1nc2ccccn2n1)C(=O)Nc1cc2c(cc1Br)OCCO2	792395073	OULAUAWEVORRBS-UHFFFAOYSA-N	433.222	1.345	50	20	IDGD	
C[C@](O)(CN1C(=O)NC2(CCCC2)C1=O)C(=O)NNc1ccc(OC(F)(F)F)cc1	793707423	WNPHDSPBQNNUFR-INIZCTEOSA-N	430.383	1.644	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CC[C@H](Oc2ccc(C#N)cn2)C1	794833732	RDFXGBWSYSQPEZ-HNNXBMFYSA-N	429.864	1.530	50	20	IDGD	
O=C(CSCCOCCN1C(=O)c2ccccc2C1=O)NNC(=O)c1cccs1	795244941	IWPIQCKZCPNLGI-UHFFFAOYSA-N	433.511	1.555	50	20	IDGD	
COC(=O)c1cc(F)cc(NC(=O)C(=O)NNC(=O)CCCc2cccs2)c1F	797006038	HYBSCTXUOUQMIE-UHFFFAOYSA-N	425.413	1.922	50	20	IDGD	
Cc1ccc(F)c(NC(=O)C(=O)NNc2ccc(-n3cccn3)nn2)c1Br	797055391	VDALSINJGQALOH-UHFFFAOYSA-N	434.229	1.954	50	20	IDGD	
CC(C)(C)C(=O)NNC(=O)CN1CCN(Cc2cc(Br)ccc2F)CC1	799189088	HKEMQKZLOQZLLO-UHFFFAOYSA-N	429.334	1.899	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)c1sccc1S(=O)(=O)N1CCCCC1	799713142	QTQNQUPMDSAGQH-UHFFFAOYSA-N	441.506	1.902	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccccc2Oc2cnn(C)c2)c1	801103858	SGQNYRPOVWVKQZ-UHFFFAOYSA-N	443.485	1.538	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](NCC(=O)NNC(=O)c2cccc(C#N)c2)C(C)(C)C1	801588006	ZJLNBVZHLYWFQU-KRWDZBQOSA-N	429.521	1.944	50	20	IDGD	
CN(C)CCS(=O)(=O)c1ccccc1C(=O)NNC(=O)Nc1cc(F)cc(F)c1	802006599	MOWOGGMNVBWFJS-UHFFFAOYSA-N	426.445	1.767	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)N[C@H](C)CCNS(=O)(=O)c2ccccc2)c1	802527213	XPHBCUYVRCLSNF-QGZVFWFLSA-N	448.545	1.770	50	20	IDGD	
C[C@@](O)(CN1Cc2ccccc2C1=O)C(=O)OCC(=O)NNC(=O)c1cccc(Cl)c1	803468783	ZAMQANPAUJNZJP-OAQYLSRUSA-N	445.859	1.051	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc3nccnc3c2Br)c1	806977943	FTTMRYRCXSWRQZ-UHFFFAOYSA-N	439.229	1.664	50	20	IDGD	
COCc1cnc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(C)c(C)c3)[nH]n2)s1	806979043	LMKHZIKOXQPWLH-UHFFFAOYSA-N	428.474	1.696	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNS(=O)(=O)c2cccc(C(=O)N(C)CC)c2)cc1	808069651	DHMLHHADHIWZET-HNNXBMFYSA-N	449.529	1.954	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)NCC(=O)NNc2cccc(F)c2[N+](=O)[O-])cc1	811475423	FASVWOBEFNTQHA-UHFFFAOYSA-N	425.398	1.114	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCc2nncn2C1)C(=O)Nc1nc2c3c(ccc2s1)CCCC3	815692711	ZCNNMXUMKAVDKK-LBPRGKRZSA-N	439.501	1.115	50	20	IDGD	
Cc1ccc(Oc2ccc(NC(=O)C(=O)NNC(=O)[C@H]3CCc4nncn4C3)cn2)cc1C	815693391	VVKJJBVCUYUGDA-HNNXBMFYSA-N	449.471	1.431	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)N(C)C)cc1C(=O)N(C)C	815751106	RHKVIWIAHROVAT-UHFFFAOYSA-N	447.517	1.029	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ncncc2F)cc1NC(=O)CN1CCCCC1	815764325	COYBSJUOLFHUBA-UHFFFAOYSA-N	429.456	1.430	50	20	IDGD	
COc1cccc(/C=C(\C(=O)NNC(=O)c2cc(OC)cc(OC)c2)n2nnnc2C)c1	818025534	VMPQWSJPGOMGQU-DJKKODMXSA-N	438.444	1.467	50	20	IDGD	
CCOC(=O)c1c[nH]nc1S(=O)(=O)NNC(=O)c1ccc(OC(C)C)c(OC)c1	818788835	TWQBKRNXXOFEBN-UHFFFAOYSA-N	426.451	1.006	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2cnn(-c3ccccc3F)c2C)n1	844542529	CXVFOSGNOXKZIS-UHFFFAOYSA-N	431.449	1.632	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)N2CC[C@@H](B(O)O)C2)c(Br)cc1Cl	864232043	VRAZTBIGDJYBAF-SSDOTTSWSA-N	426.481	1.127	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)c1ccc(C)c(NS(C)(=O)=O)c1	906485946	CHWCBLGQPBQVMZ-UHFFFAOYSA-N	429.502	1.740	50	20	IDGD	
COc1ccc2c(ccn2CC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)c1	915596379	BFIFDKNYUMMEKH-UHFFFAOYSA-N	429.502	1.713	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cccc(Cn3ccnc3)c2)cc1	915657911	NIMJWZPSPKSECE-UHFFFAOYSA-N	441.513	1.322	50	20	IDGD	
CN1CCN([C@H](CNC(=O)NNC(=O)COc2ccccc2C#N)c2cccs2)CC1	915902688	ZSFARDXUYAWJOO-QGZVFWFLSA-N	442.545	1.318	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)ccc1OCC(=O)NC(C)C	916037244	OZZRAMICUADKBY-CQSZACIVSA-N	447.463	1.966	50	20	IDGD	
C[C@H]1CN(CCCNC(=O)NNC(=O)COc2ccc(Br)cc2)C[C@@H](C)O1	916249829	MVTXRPSHSHZEFH-OKILXGFUSA-N	443.342	1.658	50	20	IDGD	
C[C@@H](CN1C[C@@H](C)O[C@H](C)C1)C(=O)NN=Cc1ccccc1OCC(=O)N1CCCC1	916372163	OJLBMVVEIZVEIG-IPMKNSEASA-N	430.549	1.883	50	20	IDGD	
Cn1ccnc1[C@@](O)(CCNC(=O)NNC(=O)Cc1c[nH]c2ccccc12)C(F)(F)F	916377957	HPWQNGFBQROTSR-SFHVURJKSA-N	438.410	1.615	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(C(F)(F)F)cc2N)cc1OC	916540540	WVUAKQVKMSJTFL-UHFFFAOYSA-N	441.362	1.923	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCCC(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)cc1	916561729	AXYNZTYEHDZEBD-UHFFFAOYSA-N	432.502	1.066	50	20	IDGD	
Cc1cc(C)nc(SCc2ccc(C(=O)NNC(=O)Cn3cnc([N+](=O)[O-])n3)cc2)n1	916733736	IIXYIRFYGOSYHS-UHFFFAOYSA-N	442.461	1.347	50	20	IDGD	
O=C(COC(=O)c1cncn1-c1ccc(F)cc1)NNC(=O)c1cccc([N+](=O)[O-])c1	917248148	LTTHNOSELJBSIH-UHFFFAOYSA-N	427.348	1.538	50	20	IDGD	
COc1cc([C@H](C)NC(=O)NNC(=O)C(=O)NC2CC2)ccc1OCc1ccccc1	918232641	LOYUIRQAYUGJSH-AWEZNQCLSA-N	426.473	1.944	50	20	IDGD	
Cn1cc(C=NNC(=O)CSc2nnc(O)nc2O)c(-c2cc3ccccc3o2)n1	920370589	KEBUGXFREGTJNC-UHFFFAOYSA-N	425.430	1.672	50	20	IDGD	
CN(C)C(=O)CN1CCN(C(=O)/C(C#N)=C/c2cn(CCC#N)nc2-c2ccccc2)CC1	920430603	SXGUFKDJLWUDJE-HMMYKYKNSA-N	445.527	1.603	50	20	IDGD	
COC(=O)c1cc(NC(=O)NNC(=O)COc2ccc(C#N)cc2)cc(C(=O)OC)c1	920930984	ZICGBOLKUSPCGK-UHFFFAOYSA-N	426.385	1.363	50	20	IDGD	
CC(=O)NCC(=O)NCC(=O)NNC(=O)c1ccc(COc2ccc(Cl)c(C)c2)cc1	921165690	WQPWAAZDQMVFDW-UHFFFAOYSA-N	446.891	1.241	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCN(C(=O)C2CCCCC2)CC1	921191748	QRUWNNZGNFJZNG-UHFFFAOYSA-N	436.940	1.834	50	20	IDGD	
O=C(NNC(=O)c1n[nH]c2c1CCCC2)Nc1ccccc1S(=O)(=O)N1CCCCC1	1116565263	MWGNFGOJJWWFIC-UHFFFAOYSA-N	446.533	1.930	50	20	IDGD	
CCn1nc(C(C)C)cc1C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	1318601246	XZNKKZDKCPGQHS-UHFFFAOYSA-N	435.554	1.114	50	20	IDGD	
CS(=O)(=O)Nc1ccccc1CC(=O)NNC(=O)c1cc(Br)ccc1O	1319175190	GSMUMULBOJVDOO-UHFFFAOYSA-N	442.291	1.530	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)nc(C)c1Br	1321407382	AOMOONULRGALOS-UHFFFAOYSA-N	431.254	1.903	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1csc(N2CCOCC2)n1)c1ccc([S@](C)=O)cc1	1323013851	ARTSHUOXWHHYAA-AOAWJKDVSA-N	437.547	1.422	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)c2cn(C3CCOCC3)nn2)cc1	1327517268	JJCMLHFJEUVWDS-UHFFFAOYSA-N	442.505	1.125	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)Cn2cc(C(F)(F)F)ccc2=O)CC1	1328603377	YJWHWQWFWGRACE-UHFFFAOYSA-N	446.426	1.662	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2cc(C)ccc2NC(=O)N(C)C)c2ccccc2c1=O	1330271755	VHIINHJVJYOHNP-UHFFFAOYSA-N	436.472	1.893	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(C)(C)C)C2	1778091561	VKJHEIHVPGETTC-JBQOLUAXSA-N	431.537	1.680	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc4n(n3)CCCC4)C2)C1	1778564136	GQHQEIHKMNTXRI-FZKQIMNGSA-N	425.327	1.446	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(=O)nc3cccnn23)C1	1780040588	YGOMGOUGWKDCIA-IUSZMWJPSA-N	447.923	1.234	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cccc(-c4cnccn4)c3)C2)C1	1780186283	HVJMNLWDNYPJAY-PGRDOPGGSA-N	444.919	1.841	50	20	IDGD	
O=C([C@@H](F)Br)N1CC[C@]2(C1)CN(C(=O)[C@@H]1Cc3ccccc3CN1)CCO2	1781332087	ZQNMNENRWADXKC-FCEWJHQRSA-N	440.313	1.221	50	20	IDGD	
COc1ccc(CC(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](F)Cl)CCO3)c([N+](=O)[O-])c1	1781412808	ODQCMRGLUXJGOV-FUHWJXTLSA-N	429.832	1.510	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)Cc3c(C)n[nH]c3C)C2)C1	1781433617	PKSSWXPYSCBFIT-CRAIPNDOSA-N	427.343	1.572	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)n1ccnn1)C2	1782002862	YMPPZYYAJRJBPQ-SZOQZIPDSA-N	428.331	1.136	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)Nc1cccnc1)C2	1782170395	KJHJDKINUHGFIP-QTQZEZTPSA-N	438.956	1.650	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)C3CCC4(CC3)OCCO4)C2)C1	1782943919	FAXXWWKTUMLSMQ-OALUTQOASA-N	449.375	1.986	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)Cc3noc(C(C)C)n3)CCO2)C1	1783345065	YNGAAPDRLKUWKI-SCLBCKFNSA-N	443.342	1.739	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)C13CC(C(=O)OC)(C1)C3)CCO2	1783354971	GKIWKBWXQZVVBQ-LUPGOKSRSA-N	443.338	1.333	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cccc(C(F)(F)F)n3)CCO2)C1	1783878385	XPGJIEMXKKELMC-YVEFUNNKSA-N	435.830	1.798	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)Cc3ccc([N+](=O)[O-])cc3F)CCO2)C1	1783881792	MWHBIYVBEBJCOL-HNAYVOBHSA-N	443.859	1.360	50	20	IDGD	
C[C@@H](Cc1ccc(F)cc1)C(=O)N1CCO[C@@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1	1783936993	MUYKLIDKCONHBO-GAJHUEQPSA-N	448.539	1.207	50	20	IDGD	
O=C(c1ccc(N2CCOCC2)cc1)N1CCO[C@@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783945943	UEUWRHODNXAYJG-HXUWFJFHSA-N	442.343	1.770	50	20	IDGD	
Cc1cc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]3C2)no1	1783974819	VLELOQUHNDPGFH-MZGVZZPPSA-N	428.327	1.536	50	20	IDGD	
CC1CCN(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)Br)C[C@@H]32)CC1	1784320797	OEUHONQSNFUVHY-QAETUUGQSA-N	430.387	1.481	50	20	IDGD	
C[C@H](NC(=O)c1ccccc1)C(=O)N1CC[C@@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1785557463	LLWQYMSTBBTUBE-HTAPYJJXSA-N	447.608	1.486	50	20	IDGD	
CCc1ncccc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21	1785654176	FAKIWFZQMGEQBU-DLKVLKDVSA-N	428.302	1.928	50	20	IDGD	
COc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Br)C[C@@H]32)nc1	1787760443	FJGSBVHKRVNMIO-HQRZJTNHSA-N	430.274	1.374	50	20	IDGD	
CC[C@H](NC(C)=O)C(=O)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1	1788145131	GPEQNROCNUEYRB-FQEVSTJZSA-N	437.305	1.029	50	20	IDGD	
C[C@@H](C(=O)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1)C1(O)CCC1	1788145165	IGYGPIQJCXPZPO-INIZCTEOSA-N	436.317	1.665	50	20	IDGD	
CN1CCC[C@H](C(=O)NC2(c3ccc(NC(=O)c4cccc(B(O)O)c4)cc3)CCC2)C1	1788150465	LFXDWSUDSJIHJY-SFHVURJKSA-N	435.333	1.456	50	20	IDGD	
COc1ncc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]3C2)cc1F	1788760980	HURYDYICOLVFTG-QRTARXTBSA-N	439.560	1.674	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21)c1cnc2snnc2c1	1789205847	BHOJEJPQNLRECW-PEXQALLHSA-N	430.317	1.483	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)N3CCN(C)CC3)[C@H]2C1	1789795178	QLTYMYUBEZZCHJ-SPOLIRPYSA-N	429.005	1.010	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4c(c3)OCO4)C[C@@H]21)[C@H](F)Br	1789922713	LQZGBAVOZZNYSK-APYUEPQZSA-N	443.269	1.699	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4ccnn4c3)C[C@@H]21)[C@@H](F)Br	1789924906	GZZNIDSJEGNRCZ-QCEMKRCNSA-N	439.285	1.618	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)c1cc(O)ccc1O	1790265643	UHIYXXUULPMELM-MOUXYMJCSA-N	431.258	1.382	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)c1ccc2sccc2c1O	1790441814	UBAOVYVMHAZGDY-KSYCFECVSA-N	438.933	1.800	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccnc3S)C[C@@H]21	1791054736	NLYPXWKXYWJCQY-XWUBHJNHSA-N	428.352	1.747	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(O)c(OC)c3)C[C@@H]21	1791253412	BRRNVIYTQVNIHL-AFIMGQEJSA-N	426.897	1.248	50	20	IDGD	
Cc1nn(C)c(C)c1CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)Br)C[C@@H]21	1791638350	ZHEFFWHFKKMNGZ-GQGQLFGLSA-N	441.370	1.343	50	20	IDGD	
CC(C)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(F)(F)C(F)(F)C(=O)O)C2	1792782470	RATGMZSDTPICQR-ILWJIGKKSA-N	432.798	1.196	50	20	IDGD	
COc1ccc2c(/C=C/C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@H](O)CCl)c[nH]c2c1	1792981516	LTXOYBKZZBASJU-KWHUGRLPSA-N	447.919	1.379	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1(C(=O)Nc2ccccc2)CC1	1793404015	NFAAABHBRCJERY-MVJTYMMSSA-N	449.935	1.249	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnccn1	1794993162	YAUBNMWWODNKCP-QDMKHBRRSA-N	439.428	1.876	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cn1cnc3ccccc31)C2	1795116455	HXGPGJMHKJVIBC-HBCWATKFSA-N	435.322	1.411	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCc1cnn(C)c1	1795769638	JOFSPIFTCBFSIS-IVSAIRAKSA-N	427.343	1.116	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3sccn3c1)C2)[C@H](F)Br	1799346301	OYLFSWPMAWVPDI-XCCSTKFXSA-N	430.299	1.895	50	20	IDGD	
COC[C@H](C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C#N)=C/c1ccc(F)cc1F	1800332169	DBSCHSWALGIMRF-WCCKXKFDSA-N	433.455	1.744	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1CCC(CO)CC1)C2	1800640332	SBUZKGUJUJQFQI-OARYSHLNSA-N	431.371	1.548	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Nc1cnccn1)C2	1800641964	OCCZGZZCJUECBC-USRAEIGSSA-N	440.342	1.040	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc3nccn13)C2	1800643374	RHQNAYIDIQAUBN-LOUJCGABSA-N	435.322	1.711	50	20	IDGD	
CCc1[nH]nc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)Br)c1Cl	1800756985	SJTPFVRSLWYYFI-XHSYRHOGSA-N	433.734	1.612	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)n1ccnc1C	1801459162	ZUOFKAKXHZQNQW-NZBFACKJSA-N	427.343	1.516	50	20	IDGD	
CC(=O)NCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](Br)Cc1ccccc1	1801570658	QRKGWOAQAJYWAW-MHORFTMASA-N	436.350	1.767	50	20	IDGD	
COC(=O)[C@@H](CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](F)Cl)C2)NC(=O)OC(C)(C)C	1802186113	VZWHEQLJEFUERZ-OKWIKPQFSA-N	449.907	1.615	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)[C@@H]2CC=CCC2)[C@@H]1c1cccnc1	1803033401	LQRQSEMEHOUECY-JUXOCIIHSA-N	427.549	1.817	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc3nccn3c2)[C@@H]1c1cccnc1)[C@H](O)CCl	1803142669	GSEXIVDAIXHMNE-KVSKMBFKSA-N	427.892	1.649	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]1c1cccnc1	1803146944	FHJJHXZAQIHHFX-BFYDXBDKSA-N	440.928	1.212	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)Cc2cc(C)n(C)n2)[C@H]1c1cccnc1	1803293110	UCSGSVZEIWCEGO-XKGZKEIXSA-N	433.940	1.626	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)Cc2ncccn2)[C@H]1c1cccnc1	1804692916	CTZRQRGJBGMEGS-JCKWVBRZSA-N	432.322	1.904	50	20	IDGD	
O=C(NCCC(=O)N1CCC2(CCCN(C(=O)[C@@H](O)CCl)C2)CC1)c1ccccc1	1805529008	FJMJAALUXDGDOQ-SFHVURJKSA-N	435.952	1.637	50	20	IDGD	
Cn1c(C(=O)N2CC[C@H](CNC(=O)CCBr)[C@H]2c2cccnc2)cccc1=O	1806338599	CGNVAHDQCDVVSW-DNVCBOLYSA-N	447.333	1.885	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)CNCP(=O)(O)O)[C@@H]1c1cccnc1	1807024192	MHUWLHUWJCMLMP-ZOBUZTSGSA-N	446.872	1.220	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)C2CC(F)(F)C2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807360153	OREOTJPPYUASOC-APWZRJJASA-N	443.259	1.126	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1807360311	QWSFBYURAFLRAB-YSIASYRMSA-N	443.740	1.489	50	20	IDGD	
CCc1ncccc1C(=O)N1CCCC2(CCN(C(=O)CCC(=O)NN(C)C)CC2)C1	1807601111	LBWROPRERLNMRP-UHFFFAOYSA-N	429.565	1.862	50	20	IDGD	
O=C(Cn1ccncc1=O)N1CCC2(CCCN(C(=O)CCBr)C2)CC1	1809070466	HMWHTCZSUFTJFO-UHFFFAOYSA-N	425.327	1.260	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)CN2CCN(C(C)=O)CC2)[C@H]1c1cccnc1	1809670474	KRMUPHBMQYXPSB-IRFCIJBXSA-N	449.983	1.269	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)o1	1810292113	WRTXABYLKQUJEK-MPGHIAIKSA-N	434.880	1.552	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@@H]1c1cccnc1	1810527282	BHHDSTWEVOHQIE-WXYCVUISSA-N	441.301	1.469	50	20	IDGD	
Cc1nccn1CC(=O)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@H]1c1cccnc1	1812406562	ICHHHVHITGHRJU-XIRDDKMYSA-N	438.301	1.983	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)[C@H](C)S)[C@@H]1c1cccnc1	1813036926	MYINBRJVXADFRM-PJTWFBBKSA-N	442.545	1.540	50	20	IDGD	
C=CCNC(=O)/C=C\C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](F)Br)[nH]n1	1814438759	TWWGTXPQAKCWAN-INIQLVOJSA-N	442.289	1.951	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](C)CBr)n[nH]1	1814780045	FFLQERLTOJZKRG-MDZLAQPJSA-N	443.346	1.880	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1ccc(F)s1	1816026760	LPWQMOISBLBJPL-HNNXBMFYSA-N	442.281	1.910	50	20	IDGD	
CC(C)CNC(=O)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CO[Si](C)(C)C)CC2	1817329049	UGENMBWJTPAKJX-LBPRGKRZSA-N	426.615	1.679	50	20	IDGD	
CN[C@H](CC(=O)Nc1cc([C@H]2CCCCN2C(=O)CO[Si](C)(C)C)[nH]n1)C(=O)O	1817366948	DDZLZQVKNKLINR-ZIAGYGMSSA-N	425.562	1.316	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cncs2)[nH]n1)c1ccc(B(O)O)cc1	1817471367	WNDQFXDUKFMXLL-OAHLLOKOSA-N	425.279	1.166	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(=O)n3[nH]nnc3n2)n[nH]1	1817812395	FPTRBBPXQYDNNM-MFKMUULPSA-N	447.887	1.249	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](C)CN)[nH]n1	1818112046	RRCDOCJVUQCSAE-DBPLZXHISA-N	428.497	1.131	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H]1CCNC(=O)C1)CC2	1822869918	OYKOFXKIPMABBY-YHTYYEMMSA-N	433.361	1.818	50	20	IDGD	
O=C(CCN1CCOC1=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1	1823006502	CDZPMEVKJZJKHB-PRHODGIISA-N	449.302	1.588	50	20	IDGD	
N#Cc1ccc2[nH]nc(C(=O)Nc3nc4c(s3)C[C@H](NC(=O)[C@H](O)CCl)CC4)c2c1	1823888775	OMJOFBCBEXEGKO-QMTHXVAHSA-N	444.904	1.717	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)Cn3ccncc3=O)sc2C1	1824542215	KZBPXXHKBRONLX-VHSXEESVSA-N	440.323	1.095	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnncc1C(=O)O)CC2	1826002669	ACXSQRZXFGHHOP-KCJUWKMLSA-N	439.881	1.111	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](F)Br)CC2	1826005950	BRBKZBKORCOFPC-MHYGZLNHSA-N	428.711	1.999	50	20	IDGD	
CC(C)[C@@H](S)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827055563	CZJFYFNXPGAJDO-WOJBJXKFSA-N	432.395	1.554	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(F)cn2C)CC1	1827947713	WZNOPVSANAPMDB-GOSISDBHSA-N	435.544	1.771	50	20	IDGD	
Cc1ccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)c(C)n1	1829530192	PEUGDKCOVDHXOD-HSZRJFAPSA-N	449.360	1.925	50	20	IDGD	
O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)c1cccnc1S)CCO2	1829793620	UFZZQRXXNSSUNP-QGZVFWFLSA-N	444.351	1.225	50	20	IDGD	
CC(C)n1cnc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)n1	1830358561	XGQLSBRAXBFPNX-LJQANCHMSA-N	427.933	1.194	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)o1	1830364377	HUEBDTFCPCSWRJ-HXUWFJFHSA-N	441.912	1.573	50	20	IDGD	
Nc1n[nH]c(CCC(=O)N2CCC([C@@H]3CCCCN3C(=O)[C@H](F)Br)CC2)n1	1830383021	VCJMZIRIEQWESW-WFASDCNBSA-N	445.337	1.630	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)Cn2cnnn2)CC1	1831550387	VOSGVLFHPNHSBE-HUUCEWRRSA-N	427.347	1.466	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4cccnn4n3)C2)C1	1831654022	HLLKHAQZOGNALM-JXFKEZNVSA-N	435.912	1.207	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2nccnc2C(N)=O)CC1	1831833150	UNWBKJYJCKYYGZ-HUUCEWRRSA-N	437.928	1.063	50	20	IDGD	
COCc1c[nH]c(C(=O)N2CCC([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)c1	1831873610	PUQHTNOHMKOGNC-HXUWFJFHSA-N	447.580	1.767	50	20	IDGD	
COc1cc(CCC(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)ccn1	1832594825	QUDZCBSFWTVQPW-PKOBYXMFSA-N	429.876	1.014	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(CN(C(=O)CCCc3ccncc3)CCO2)C1	1833058256	ZNYUXKFLAMSWAQ-JOCHJYFZSA-N	449.624	1.712	50	20	IDGD	
C[C@@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)c3cocn3)CC2)CC1	1833261972	FWGYQATVIOEDKA-ZDUSSCGKSA-N	427.343	1.891	50	20	IDGD	
COC(=O)[C@H]1CC[C@@H](C(=O)NC2CCN(C3CCN(C(=O)C(Cl)Cl)CC3)CC2)C1	1833307477	UZJDASRZQHSCDK-KGLIPLIRSA-N	448.391	1.951	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H]3CCc4ccccc4O3)CC2)CC1)[C@H](O)CCl	1833312958	NMQZQOIRPKIHBP-CTNGQTDRSA-N	449.979	1.552	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3cnccn3)CC2)CC1	1834124095	AGXMOFVEGVWIPO-INIZCTEOSA-N	438.370	1.835	50	20	IDGD	
Cn1cnc(C(=O)NC2CCN(C3CCN(C(=O)[C@H](F)Br)CC3)CC2)c1	1834286677	OHMRJTGKKFAYQG-HNNXBMFYSA-N	430.322	1.296	50	20	IDGD	
O=C(CC[C@H]1CCOC1)N1CCOC[C@@]2(C1)CN(C(=O)CCBr)CCO2	1834826862	ZFONXPCOEYWZLS-MAUKXSAKSA-N	433.343	1.045	50	20	IDGD	
C[C@@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1)n1cccc1C=O	1835951457	FLHYNIROINRMHR-KKSFZXQISA-N	439.940	1.583	50	20	IDGD	
CC(=O)O[C@@H](C(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)C(C)C	1836717183	MAOGWATYZCUVAK-ZWKOTPCHSA-N	432.945	1.172	50	20	IDGD	
O=C(C1=CCCC1)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1	1837615828	RFFOSWHJDQIWKN-UHFFFAOYSA-N	426.322	1.089	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(Cl)nn1)CCO2	1837838172	XCQWLHCJDMVFGE-SFHVURJKSA-N	442.976	1.052	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ncoc3C)CCO2)C1	1838208346	DGFOFYDXBLMQQT-GUYCJALGSA-N	430.299	1.227	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cc(OC)n(C)n3)CC2)CC1	1838561931	JOJBLERYSXKBDO-MRXNPFEDSA-N	442.944	1.295	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)Cc3ccc(O)cn3)CC2)CC1	1838786268	MPDYEWXNIBNLLD-IBGZPJMESA-N	439.940	1.582	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](Br)CC)C2)C1	1839148184	PVACYMZQOBCLDL-DVOMOZLQSA-N	425.751	1.634	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cccs3)C2)C1	1839152400	YCYNAWUGNATEAD-ROUUACIJSA-N	435.373	1.983	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C#N)c[nH]3)C2)C1	1839966003	RICAWWVSCCSEJC-KSSFIOAISA-N	439.310	1.130	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)COc3ccccc3)C2)C1	1840031781	BZTTUZZWGSGPBA-BEFAXECRSA-N	441.322	1.305	50	20	IDGD	
CCn1nccc1C(=O)N1CC2(CCCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C1	1841924272	QHGALRCKVHLZQB-AWEZNQCLSA-N	439.944	1.852	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)c2cccnc2CS(C)(=O)=O)C1	1842239960	IANJYGMFTWRITH-HNNXBMFYSA-N	427.954	1.851	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H]2C[C@]21C(=O)N1CCCC12CN(C(=O)[C@@H](O)CCl)C2	1846258711	FZWUGINLYIGDSK-PJSUUKDQSA-N	427.929	1.189	50	20	IDGD	
C=C1C[C@@H](C(=O)N2CCCC23CN(C(=O)[C@H](O)CCl)C3)N(C(=O)OC(C)(C)C)C1	1846448688	QFJLLFDICKPOBD-LSDHHAIUSA-N	427.929	1.355	50	20	IDGD	
COc1ccc([C@H]2C[C@@H]2C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)CCC(=O)NN(C)C)cc1	1847775251	KMZYGCMHZWGLQN-FYQPLNBISA-N	428.533	1.374	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H]1[C@H]2COC[C@H]21	1848098892	KNSFXGPUQRVQPF-PLZKBRGSSA-N	427.929	1.213	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)C(=O)c1ccco1	1848124662	VJOMNKXEATTZJU-HOTGVXAUSA-N	441.396	1.811	50	20	IDGD	
C=C1c2ccccc2C(=O)N1CC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	11329817	XXXMXNPDZOWUNH-UHFFFAOYSA-N	433.512	1.473	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=S)NC(C)(C)C)CC2)c(C)c1	14895320	RKPVIBQDWJXRPC-UHFFFAOYSA-N	426.608	1.998	50	20	IDGD	
CC(C)(C)NC(=S)NNC(=O)C1CCN(S(=O)(=O)c2ccc3c(c2)CCC3)CC1	14895416	IXFBHCOIUZZPHF-UHFFFAOYSA-N	438.619	1.870	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)c1cn(-c2ccccc2)nc1-c1cccnc1	16785721	OTWZCRUABWNOFY-HNNXBMFYSA-N	425.470	1.130	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cc(OC)c3c(c2)OCCO3)cc1OC	17184836	MDTOMQHNBADPOP-UHFFFAOYSA-N	446.412	1.102	50	20	IDGD	
Cc1nnc(NNC(=O)c2ccc(NC3=NS(=O)(=O)c4ccccc43)cc2)nc1O	23310680	HRCSYPWEPOWXID-UHFFFAOYSA-N	425.430	1.204	50	20	IDGD	
Cc1cc(C)cc(OCc2nnc(SCC(=O)NNC(=O)c3cccs3)n2N)c1	24197280	JDZATIYBFMHHHB-UHFFFAOYSA-N	432.531	1.803	50	20	IDGD	
O=C(/C=C/c1ccco1)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	25166092	CBSMCCKSOAHZAC-UXBLZVDNSA-N	433.486	1.094	50	20	IDGD	
CC(C)N(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1	26068755	GQHYGICSLUYKIM-GOSISDBHSA-N	433.486	1.317	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)NCCCc2nnc3n2CCCCC3)cc1OC	727606706	BUHMPCDESACHFR-UHFFFAOYSA-N	430.509	1.989	50	20	IDGD	
O=C(NNC(=O)c1c(Cl)cccc1Cl)NNC(=O)[C@@H]1COc2ccccc2O1	727847041	PITNUBKEYWGDQI-ZDUSSCGKSA-N	425.228	1.809	50	20	IDGD	
C#CCNC(=O)CN1CCN(C(=O)/C(C#N)=C\c2cc(C)n(C[C@@H]3CCCO3)c2C)CC1	728533497	KVXKYEVAGIVWRK-BHJKQYKASA-N	437.544	1.085	50	20	IDGD	
COc1ccc(CN2C(=O)c3ccccc3C2=O)cc1C(=O)NNC(=O)Cc1cccnc1	728856681	UULSOXFJLVQROL-UHFFFAOYSA-N	444.447	1.890	50	20	IDGD	
COc1cccc2c1OCC[C@@H]2NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1	728951364	HTPXQRSSTYIEJM-INIZCTEOSA-N	426.477	1.556	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)CC[C@H]2NC(=O)N(c3ccc(Cl)cc3)C2=O)n1	730768585	IVPHGILJIFWKFF-OAHLLOKOSA-N	432.868	1.206	50	20	IDGD	
CCCc1[nH]nc(C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)c1[N+](=O)[O-]	731593793	ADKGGSFIGXCKHK-UHFFFAOYSA-N	427.421	1.636	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)N1CCC[C@@H](CN2CCN(c3ccccn3)CC2)C1	731849617	AQNBPZWUEKSPGK-PMACEKPBSA-N	430.597	1.498	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)CCCNC(=O)c2ccc(F)cc2F)C[C@H](C)O1	732260724	GWAHUOSDSDUJMG-KBPBESRZSA-N	426.464	1.122	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2cccc(NC(=O)c3cccnc3)c2)C[C@H](C)O1	732261486	MYZDSBFQWUCPJH-HOTGVXAUSA-N	425.489	1.594	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N2CC(n3cncn3)C2)cc1	732759056	JBCKFOMJOQUYED-PXNMLYILSA-N	446.471	1.016	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN1S(=O)(=O)c1cccs1)c1cnn(-c2ccccc2)c1	733108870	PGAXRQAOKLARQY-MRXNPFEDSA-N	445.526	1.548	50	20	IDGD	
COc1ccc(CN2CC[C@H](NC(=O)NNC(=O)COc3ccccc3OC)C2=O)cc1	734515998	CMLSRFSSFVJTGG-KRWDZBQOSA-N	442.472	1.214	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)c2c(C)oc(C)c2S(N)(=O)=O)cc1C	736779061	BRWYVHNLFSZBHQ-UHFFFAOYSA-N	443.503	1.094	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)N1CCN(CC(=O)Nc2ccccc2)CC1	738497537	XXONLHLSNRKIGS-UHFFFAOYSA-N	425.489	1.200	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)NCCC(=O)N1CCN(c2ccccc2)CC1	738992634	XYNWDIINFPKTQV-UHFFFAOYSA-N	439.516	1.273	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNS(=O)(=O)c1cc(Br)c(F)cc1F	740812400	HOZSKNNGAUQJQG-UHFFFAOYSA-N	428.255	1.342	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(CC(=O)NNC(=O)c2cccc(OC(F)F)c2)C(=O)C1	741185994	MANHCOMBMCMJFP-UHFFFAOYSA-N	442.419	1.128	50	20	IDGD	
CCCc1c(C(=O)NNC(=O)C(=O)N2CCCC2)nnn1-c1ccc(C(C)(C)C)cc1	741684286	WMQDSVLDZDAXLV-UHFFFAOYSA-N	426.521	1.901	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc(OC)c1OC(F)F	742534222	BEPOUGYOIGYJDN-UHFFFAOYSA-N	444.412	1.784	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1ccc(N2CCCC2=O)cc1	744622366	ULPPJIWZZOKSNJ-UHFFFAOYSA-N	444.513	1.591	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)N[C@H]1CCN(Cc2ccccc2)C1=O	744878237	SYFMVAYRZVPXCG-HNNXBMFYSA-N	427.417	1.105	50	20	IDGD	
C[C@H](CCc1ccccc1F)C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	745575432	GMCGDQBZTBDYDD-AUUYWEPGSA-N	430.432	1.925	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)c1ccc2c(=O)n(Cc3ccco3)c(S)nc2c1	747428450	NCTCYDXRPRQRFV-UHFFFAOYSA-N	435.465	1.725	50	20	IDGD	
COc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NNC(=O)c2ccc(Cl)cc2F)cc1	747430841	FYXJBEKBHPTTQQ-JTQLQIEISA-N	429.857	1.616	50	20	IDGD	
Cc1nc(S(=O)(=O)N2CCC(C(=O)NNC(=O)c3ccc(Cl)cc3)CC2)cn1C	747622408	PQMFXHPSCHFNKO-UHFFFAOYSA-N	439.925	1.244	50	20	IDGD	
C[C@]1(c2ccc(C(=O)NNC(=O)c3ccc(COc4ccccc4)o3)cc2)NC(=O)NC1=O	748011494	DPUKBVIUYKCDKR-HSZRJFAPSA-N	448.435	1.988	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@](F)(C(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)C1	748209238	IYBVGUKFEWTWSI-IBGZPJMESA-N	443.859	1.993	50	20	IDGD	
O=C(NNC(=O)c1cc2ccccc2o1)c1ccc(S(=O)(=O)NC[C@H]2CCCO2)cc1	749473608	IKZOIHNOWRSCKA-MRXNPFEDSA-N	443.481	1.965	50	20	IDGD	
O=C(CCc1ccccc1)NNC(=O)NCc1ccc(S(=O)(=O)N2CCCC2)cc1	749928027	GODTYSLTYRBJIS-UHFFFAOYSA-N	430.530	1.934	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N[C@@H]1CC(=O)N(C2CC2)C1	750654556	CVMAZADFKKSKCJ-CMPLNLGQSA-N	425.283	1.310	50	20	IDGD	
CCCOc1ccc(C(=O)NNS(=O)(=O)c2cc(C(=O)OC)c(C)o2)cc1OC	751141291	CTKCRBRZLOXBJD-UHFFFAOYSA-N	426.447	1.795	50	20	IDGD	
COc1ccc([C@@]2(C)NC(=O)N(CC(=O)Oc3ccc([N+](=O)[O-])cc3OC)C2=O)cc1	751173272	APMPHFFXZQCYQF-HXUWFJFHSA-N	429.385	1.985	50	20	IDGD	
O=C(NN=C[C@@H]1CCOc2ccccc21)c1cccc(S(=O)(=O)N2CCOCC2)c1	752157237	KIDXWAVOQIVZAR-KRWDZBQOSA-N	429.498	1.989	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2nc(-c3cnn(C)c3)oc2C)c2ccccc2c1=O	752265873	KTUWVJDNDKLPOA-UHFFFAOYSA-N	435.444	1.578	50	20	IDGD	
COc1ccc(N2C(=O)CC[C@H](C(=O)NNC(=O)CO)[C@H]2c2ccccc2OC)cc1	753452805	SYUPTMLJWZXSSF-LAUBAEHRSA-N	427.457	1.328	50	20	IDGD	
CS(=O)(=O)N1CC[C@@H](CNC(=O)NNc2c(F)cc(F)cc2Br)C1	753661277	PNFZKBTVOJGAQA-QMMMGPOBSA-N	427.271	1.635	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCCS1(=O)=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1	753767716	DCSHXGITKNRKCP-QGZVFWFLSA-N	439.497	1.663	50	20	IDGD	
COc1ccc(C2(C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)CCC2)cc1OC	754235874	MERJQTVBBIMPJE-UHFFFAOYSA-N	439.516	1.980	50	20	IDGD	
CC(C)N(C)S(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1	755452161	MXXDUQCGUQIUKZ-SFHVURJKSA-N	448.501	1.708	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)c2cc(Br)c[nH]2)n([C@@H]2CCS(=O)(=O)C2)n1	755531871	JXGYNABNSYPWFW-SNVBAGLBSA-N	445.299	1.108	50	20	IDGD	
COC(=O)CNC(=O)c1ccc(NC(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)cc1	755552111	YRVCXGAVXYWHRO-UHFFFAOYSA-N	428.489	1.959	50	20	IDGD	
CCn1ncc(C(=O)OCC(=O)NNC(=O)Cc2nc(C)cs2)c1-c1ccccc1	755728359	PDVDQTWVJXYWKB-UHFFFAOYSA-N	427.486	1.882	50	20	IDGD	
O=C1CN(S(=O)(=O)c2cccc(C(=O)NNc3nc(C(F)(F)F)cs3)c2)CCN1	755858544	YPJWEGJCDRIFLV-UHFFFAOYSA-N	449.436	1.039	50	20	IDGD	
CO[C@H](C)C(=O)Nc1cccc(NC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])c1	756228955	XWLMGSCBWLSKDS-GFCCVEGCSA-N	431.405	1.800	50	20	IDGD	
CS(=O)(=O)CCOc1cccc(NC(=O)NNC(=O)Cn2ccc3ccccc32)c1	756297935	OOGZYQDHSHGHBY-UHFFFAOYSA-N	430.486	1.918	50	20	IDGD	
CCN(CC(=O)NNC(=O)c1ccc(OC)c(OC)c1)[C@@H]1CCN(c2ccccc2)C1=O	756524634	KBRIXSFRHWYDSC-GOSISDBHSA-N	440.500	1.592	50	20	IDGD	
CN(C1CCCCC1)S(=O)(=O)c1cccc(NC(=O)NNC(=O)c2cnn(C)c2)c1	756628827	YHFUVWMGNCLRKB-UHFFFAOYSA-N	434.522	1.840	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2ccn(Cc3ccncc3)n2)c2ccccc2c1=O	756650134	KTKHQTLITPFGRN-UHFFFAOYSA-N	432.444	1.523	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)Nc2ccc(F)c(S(=O)(=O)NC(C)(C)C)c2)n1	756705115	KJDMGBPFKDDHOZ-UHFFFAOYSA-N	440.501	1.569	50	20	IDGD	
COC(=O)Nc1ccc(NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1F	757998129	VEKCBAHUAYNKOB-UHFFFAOYSA-N	431.428	1.863	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)COc1ccc(C(C)(C)C)cc1C(C)(C)C	758048771	VVSPRAUFNHYVSE-ZDUSSCGKSA-N	427.567	1.746	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2ccnc(OCC(F)F)c2)c2ccccc2c1=O	758077550	XHEOPSKJRHYVOP-UHFFFAOYSA-N	431.399	1.920	50	20	IDGD	
Cc1ccc(N2CCN(C(=O)NNC(=O)c3csc(N4CCOCC4)n3)CC2)cc1C	758650739	MFCRTLGLFFNEOE-UHFFFAOYSA-N	444.561	1.773	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cccc(OCC(F)F)n2)cc1	760265233	YCPIUUSFQKZMTB-UHFFFAOYSA-N	442.444	1.116	50	20	IDGD	
CCOc1nc(C(F)(F)F)ccc1C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C	760339796	VNBHAXDZIQOEFD-UHFFFAOYSA-N	435.403	1.968	50	20	IDGD	
CC1CCN(CC(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)CC1	761711035	GDOKDJSFEIZXNS-UHFFFAOYSA-N	444.557	1.658	50	20	IDGD	
C[C@@H]1CN(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)CCN1CC(F)(F)F	762576923	ODEQHNWTQDSJRO-CYBMUJFWSA-N	429.447	1.002	50	20	IDGD	
C[C@H](c1cccc(NC(=O)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c1)N1CCOCC1	763471182	FAYDXAVPXKKKLI-CQSZACIVSA-N	441.444	1.388	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2cccc(F)c2)c1	763507748	CRIACLFYLBQLAR-UHFFFAOYSA-N	436.465	1.256	50	20	IDGD	
CCCCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2F)cc1	763568633	OCJRLGCMHMHZEV-UHFFFAOYSA-N	436.465	1.767	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)COc2cccc(C(F)(F)F)c2)c(C)n1	763639389	NIQPUCUXYVSRAV-UHFFFAOYSA-N	426.351	1.582	50	20	IDGD	
O=C1C[C@H](c2cccc(NC(=O)C(=O)NNC(=O)COc3ccc(Cl)cc3)c2)CN1	763687099	ZCEAGYOKSAEOAS-ZDUSSCGKSA-N	430.848	1.108	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(F)c(C(=O)N(C)C)c1	763714371	USGRLZKPQWQFNP-UHFFFAOYSA-N	430.436	1.255	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc(OCCC(C)C)cc2)nn1CCC#N	763767897	NKEDLIMUAGBPTA-UHFFFAOYSA-N	426.477	1.930	50	20	IDGD	
Cn1cc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCC3)cc(Br)c1=O	763782190	PUHSDIAHKZPYHK-UHFFFAOYSA-N	439.291	1.098	50	20	IDGD	
CCN1CCC(n2nccc2NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)CC1	763871709	HQZMJMFRFFJCKK-AWEZNQCLSA-N	446.483	1.232	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(-n3ccnc3)nc2)cc1OC	763912163	RJKOGUXSGKCOQF-UHFFFAOYSA-N	438.444	1.464	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)ccc1C(F)(F)F	763920862	FJEWMRZIMAIUTO-UHFFFAOYSA-N	433.350	1.389	50	20	IDGD	
COC(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CC[C@@H](C)C3)cc1	763941102	VWDRIONAVIAREO-GFCCVEGCSA-N	429.498	1.988	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1ccccc1CN1CCNC1=O	764012590	SQAOJXQMSNHWCO-UHFFFAOYSA-N	445.863	1.274	50	20	IDGD	
CC[C@H](C)Oc1cccc(NC(=O)C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c1	764077207	JEVCNDKTRLFJQV-ZDUSSCGKSA-N	433.486	1.667	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(C)cc2O)cc1	764105304	PMQSKZGDRQEKTH-UHFFFAOYSA-N	448.501	1.131	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)N3CCCCCC3)cc2)cc1	764181747	GJJICXYPZXUDQS-UHFFFAOYSA-N	433.468	1.974	50	20	IDGD	
CC(C)(C)OC(=O)N1CCCc2cc(NC(=O)C(=O)NNC(=O)Cc3cc[nH]n3)ccc21	764292436	AMCKNQBIRVTCKE-UHFFFAOYSA-N	442.476	1.426	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)C(=O)Nc1cccc(CN2CCN(C)CC2)c1)c1ccccc1	764329657	XSDSEDYVNKDNPG-OAQYLSRUSA-N	437.544	1.714	50	20	IDGD	
Cc1cc(OCc2cccc(F)c2)ccc1NC(=O)C(=O)NNC(=O)c1cnn(C)c1	764363858	VACHFXGGOOLISD-UHFFFAOYSA-N	425.420	1.846	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2ccc(-c3ncon3)cc2)n[nH]1	764376416	DCDHPDFSCIOKND-UHFFFAOYSA-N	447.411	1.535	50	20	IDGD	
CC[C@H](C)NS(=O)(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)c2ncccc2C)c1	764385878	OJOQWHVZBAQNFP-AWEZNQCLSA-N	447.517	1.008	50	20	IDGD	
CCNC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)CSc2ccccc2OC)c1	764392575	GEWZVGJTSXPPQU-UHFFFAOYSA-N	445.501	1.715	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1ccc(C(=O)NC2CC2)cc1	764399119	ZMGOVPZWKCUXSP-UHFFFAOYSA-N	442.497	1.466	50	20	IDGD	
C[C@@H](NC(=O)OC(C)(C)C)[C@@H]1COCCC1=NNC(=O)c1ccc(-n2cnnn2)cc1	766015493	MIZSWYZXPNZRGK-CJNGLKHVSA-N	429.481	1.698	50	20	IDGD	
CC(=O)NC1(C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)CCCCC1	766660746	QZXUZHPRPUIGCQ-UHFFFAOYSA-N	449.983	1.444	50	20	IDGD	
O=C(CSc1ccncc1)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	766661175	SGNCDUKQQTYVIU-UHFFFAOYSA-N	433.965	1.792	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)on1)c1ccc(N2C(=O)CCC2=O)c([N+](=O)[O-])c1	767491659	VWBUWHAVMQNDNV-UHFFFAOYSA-N	449.379	1.978	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])ccc1OC(C)C	768239229	WTXBERRGAFBVBQ-UHFFFAOYSA-N	446.416	1.556	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(Br)cc([N+](=O)[O-])c2)c1	770146566	REGVPVYFTBZBGS-UHFFFAOYSA-N	442.247	1.836	50	20	IDGD	
COC(=O)N1CC(NC(=O)NNC(=O)c2cn(-c3ccccc3)nc2-c2ccccc2)C1	770427138	YADNKURPSOZQQG-UHFFFAOYSA-N	434.456	1.934	50	20	IDGD	
O=C(CN1CC=C(c2ccc3c(c2)OCCO3)CC1)NNC(=O)c1cccc([N+](=O)[O-])c1	771464009	NXKQUXQFIMIFEA-UHFFFAOYSA-N	438.440	1.916	50	20	IDGD	
COc1ccc([C@]2(C)NC(=O)N(CC(=O)NNc3ccc(F)c([N+](=O)[O-])c3)C2=O)cc1	771596617	MJGVBEGEYCAODW-IBGZPJMESA-N	431.380	1.653	50	20	IDGD	
N#Cc1cc(F)c(S(=O)(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)c(F)c1	771607620	OOFAWFMLZWZRHV-UHFFFAOYSA-N	428.804	1.116	50	20	IDGD	
CCc1ccc(C(=O)NNc2nccnc2C(C)C)cc1S(=O)(=O)N1CCOCC1	772847966	KKYJHPMSUCUGOO-UHFFFAOYSA-N	433.534	1.940	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)[C@H]1CCCN(C(=O)N2CCCC2)C1	772898406	QOFBYLBPAHSAAI-HNNXBMFYSA-N	435.912	1.031	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NNC(=O)CCNC(=O)Cc2ccccc2)C1	773411572	ODZKLGAHVVZDAG-QGZVFWFLSA-N	432.521	1.530	50	20	IDGD	
COc1cc(C)c(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(C(C)=O)cc2)cc1F	773500974	ZCHZXDOCFPIOGB-ZDUSSCGKSA-N	431.420	1.899	50	20	IDGD	
Cc1cc(CNC(=O)NNC(=O)Cc2cccc3ccccc23)ccc1S(N)(=O)=O	775222095	HHZWXHQDHFQRII-UHFFFAOYSA-N	426.498	1.869	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)N[C@H]2CCN(c3ccc(Cl)cc3)C2)c2ccccc2c1=O	776633703	UWVARRYRDOMATF-AWEZNQCLSA-N	440.891	1.810	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)NNC(=O)CNC(=O)OC(C)(C)C)c(C)n1C[C@@H]1CCCO1	778444865	ALXZBXBIUCARGA-LTXFRBGYSA-N	445.520	1.863	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2Br)c(OC)n1	778753201	QANVAQZBUUEZAH-UHFFFAOYSA-N	440.210	1.851	50	20	IDGD	
CNC(=O)CCCC(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccc(C)cc2C)c1	780155158	WKDCQGIAWULAPS-UHFFFAOYSA-N	446.529	1.782	50	20	IDGD	
CC(C)[C@@H]1C[C@@H](CC(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)CCO1	781997091	WQCMNKGZRWJSJY-WMZOPIPTSA-N	425.551	1.992	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C(=O)Nc2ccccc2O[C@@H]2CCOC2)nc2ccccc21	782893629	KEKHVUJJHSQDRR-CQSZACIVSA-N	437.456	1.070	50	20	IDGD	
COc1ccc(C(=O)N2CCN(C)CC2)cc1NC(=O)C(=O)NNc1ccc(C)cc1	783348626	PARCBNWPNZYKAS-UHFFFAOYSA-N	425.489	1.473	50	20	IDGD	
O=C(NNC(=O)C(=O)N1CCCC1)C(=O)Nc1ccc(OCc2cccc(F)c2)c(F)c1	783999008	IULUUQJXKKUCOY-UHFFFAOYSA-N	446.410	1.252	50	20	IDGD	
N#Cc1ccc(Oc2ccc(NC(=O)C(=O)NNC(=O)CNC(=O)c3ccco3)cc2)cc1	784003545	ZQTDEZZBHFEYNK-UHFFFAOYSA-N	447.407	1.459	50	20	IDGD	
Cc1c(NNC(=O)C(=O)Nc2ccc(CC(=O)N3CCOCC3)cc2)cccc1[N+](=O)[O-]	784358788	ZMJMMBVQZFERMH-UHFFFAOYSA-N	441.444	1.386	50	20	IDGD	
COc1ccc(C(=O)CCC(=O)NNC(=O)Cc2cn3ccccc3n2)c(OC)c1OC	784677636	NHIUSPXKIBDUEI-UHFFFAOYSA-N	440.456	1.713	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ccc(Cl)nn2)cc1S(=O)(=O)NC(C)(C)C	784793929	WLPQAESGPVFMRI-UHFFFAOYSA-N	440.913	1.597	50	20	IDGD	
Cc1cc(Br)ncc1NC(=O)C(=O)NNC(=O)c1cc([N+](=O)[O-])ccc1O	785024179	SXIOYMVOEYHBJJ-UHFFFAOYSA-N	438.194	1.166	50	20	IDGD	
CCN(C(=O)c1cc(NC(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)ccc1Cl)C(C)C	786471717	MWYHWMOJHCKRTQ-NSHDSACASA-N	447.945	1.301	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)c1cc([C@H]2CCN(C(=O)OC(C)(C)C)C2)[nH]n1	787386014	GCCQJPDPYMPIOH-LBPRGKRZSA-N	436.513	1.200	50	20	IDGD	
COCCOc1cc(OC)ccc1C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	788506410	SIEFHPYHVMHJRT-UHFFFAOYSA-N	435.502	1.918	50	20	IDGD	
Cc1cc(C)c(N2CC[C@@H](NC(=O)NNC(=O)c3cc([N+](=O)[O-])ccc3O)C2=O)c(C)c1	788946238	ZXBGZKGEQJAPTQ-MRXNPFEDSA-N	441.444	1.975	50	20	IDGD	
CC[C@@H]1CCc2nc(NC(=O)C(=O)NNC(=O)COc3ccccc3OC)sc2C1	789732656	SCZZDYISZLBPSX-GFCCVEGCSA-N	432.502	1.832	50	20	IDGD	
O=C(Cc1ccccn1)NNC(=O)C(=O)Nc1ccnc(Oc2ccc(F)cc2F)c1	789735208	UQSWKUFIXOFDNT-UHFFFAOYSA-N	427.367	1.876	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cc([C@H]3CCCO3)nn2C)c1C	789741544	WUVTZZCRROVDID-RHSMWYFYSA-N	429.477	1.442	50	20	IDGD	
CCC[C@@H]1CCc2nc(NC(=O)C(=O)NNC(=O)CNC(=O)c3ccco3)sc2C1	789756485	FVKGVXVTLUMDTQ-LLVKDONJSA-N	433.490	1.157	50	20	IDGD	
Cn1nc(SCC(=O)NN=Cc2ccc(-c3cccc(F)c3F)o2)c(=O)n(C)c1=O	790155127	DLSBRKBNGBLIBU-UHFFFAOYSA-N	435.412	1.260	50	20	IDGD	
O=C(NCCCCn1cc(Br)cn1)NNC(=O)c1ccc2c(c1)OCCO2	792226102	PBQXOAAOJISYJX-UHFFFAOYSA-N	438.282	1.841	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNC(=O)NC1CCN(C(=O)c2ccco2)CC1	792793499	VOWVWLFPPILVLS-UHFFFAOYSA-N	443.460	1.141	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2ccc(C(C)(C)C#N)cc2)cc1	792805783	ARPVNNUTHQFDDZ-UHFFFAOYSA-N	428.514	1.878	50	20	IDGD	
O=C(Cc1cc(O)nc(S)n1)NN=Cc1c(Br)n[nH]c1Br	792960149	RSLJLHWCCGQLHM-UHFFFAOYSA-N	436.089	1.412	50	20	IDGD	
O=C(NNc1ncncc1Cl)C(=O)Nc1ccc2c(c1)N(CC(F)F)C(=O)CS2	793035251	FVXAMODXYCJYPN-UHFFFAOYSA-N	442.835	1.916	50	20	IDGD	
COc1ccc(C(=O)N2CCN(C(=O)NNC(=O)c3cccc(C)n3)CC2)c(OC)c1	793228180	ZNALUEYYJDHHMD-UHFFFAOYSA-N	427.461	1.220	50	20	IDGD	
COC(=O)c1cc(F)c(Br)cc1NC(=O)C(=O)NNC(=O)c1ccncc1	796991859	QLQNUYNBVSQCQK-UHFFFAOYSA-N	439.197	1.170	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](O)[C@H](O)c2nc3ccccc3s2)cc1C	798308367	WWDOWPSIEHCIPC-HOTGVXAUSA-N	428.470	1.094	50	20	IDGD	
Cc1cccc(N2CCN(CCC(=O)NNC(=O)C(=O)Nc3ccc(C)c(C)c3)CC2)c1	798308749	AARCMOQARSVFCO-UHFFFAOYSA-N	437.544	1.910	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@H]2C(=O)OCC(=O)NNC(=O)c2ccc(C)cc2)cc1	798790610	QDEWLBGERSLLOU-IBGZPJMESA-N	439.468	1.613	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NN=Cc2cn(CC(=O)O)c3ccccc23)ccc1Cl	799871325	TYVPEGXNEKMBIJ-UHFFFAOYSA-N	434.861	1.791	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)c1nn(-c2ccc(F)cc2C)cc1O	801429962	OHTYOTLAFZTBGY-UHFFFAOYSA-N	440.431	1.881	50	20	IDGD	
NS(=O)(=O)N1CCC(C(=O)NNC(=O)Nc2c(Cl)cc(Cl)cc2Cl)CC1	802068350	CAWRAZFTXQLPNO-UHFFFAOYSA-N	444.728	1.715	50	20	IDGD	
CCS(=O)(=O)N[C@@H](CCSC)C(=O)NNC(=O)Nc1cc(OC)ccc1Cl	802114828	MQBQFUZCKUXEKB-LBPRGKRZSA-N	438.959	1.562	50	20	IDGD	
CN(C)c1nccc(NNC(=O)C(=O)Nc2ccc(Br)c3cccnc23)n1	802571715	CJAUBQDKPLMRDL-UHFFFAOYSA-N	430.266	1.935	50	20	IDGD	
O=C(COC(=O)[C@H]1CCCN(C(=O)c2ccncc2)C1)NNC(=O)c1ccc(Cl)cc1	803491754	BCBAVOSREYKOLL-INIZCTEOSA-N	444.875	1.592	50	20	IDGD	
O=C(NCCN1CCN(c2cccc(Cl)c2)CC1)NNc1ccc(-n2ccnc2)nn1	805217066	SVBBTUXVKVYRQD-UHFFFAOYSA-N	441.927	1.764	50	20	IDGD	
O=C(NNc1nccnc1C1CCC1)[C@H]1CCCN1S(=O)(=O)c1cccc([N+](=O)[O-])c1	805463695	HCLIFSJMAONGOR-MRXNPFEDSA-N	446.489	1.949	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)c1nccn1-c1ccccc1	806059208	WORLYLGYZHAJHI-AWEZNQCLSA-N	427.486	1.981	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCOCC2)cc1NC(=O)NNc1ncccc1F	806131253	HNTBTQWUZTZJCZ-UHFFFAOYSA-N	425.442	1.399	50	20	IDGD	
O=C(NNC(=O)c1cccc(Cl)c1)C(=O)Nc1ccc(F)c(N2C(=O)CCC2=O)c1	806973688	ITULPIFNRADCSG-UHFFFAOYSA-N	432.795	1.532	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(F)cc2OC2CCOCC2)cc1	806974596	OECWMTTVEVWWQT-UHFFFAOYSA-N	445.447	1.857	50	20	IDGD	
O=C([C@@H]1CC(c2cccc(F)c2)=NO1)N1CCN(S(=O)(=O)CBr)CC1	807196464	LTJQSXMLNKZJQR-AWEZNQCLSA-N	434.287	1.145	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1cc(CN2CCCC2)on1	812524357	LJWDZSJUFAPXOX-UHFFFAOYSA-N	435.506	1.048	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)[C@H]2CCCN(C(=O)NC3CCCC3)C2)cc1	812731808	VMYPDSPMKBIZSH-HNNXBMFYSA-N	437.566	1.744	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)Nc2ccc(C(=O)N3CCOCC3)cc2)cc1	812924041	WZLSLFNOSTYTHL-UHFFFAOYSA-N	447.517	1.558	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)c2cccc(N(C)C)c2)cc1)[C@H]1C[C@@H]1C	815565364	LROIWXDFRRZFIT-XOBRGWDASA-N	437.500	1.914	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCc2nncn2C1)C(=O)Nc1cccc(Cl)c1SC(F)F	815693076	KXDSWHXITYPVLG-QMMMGPOBSA-N	444.851	1.595	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	843446205	CELSNILRFZPUDY-SJCJKPOMSA-N	434.832	1.638	50	20	IDGD	
CCC[C@@H](NC(=O)NCc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccc(C)cc1	847338210	YDDCVGVAGPYDME-GOSISDBHSA-N	443.479	1.888	50	20	IDGD	
C[C@@H]1CCCN(S(=O)(=O)c2ccc(C(=O)NNC(=O)c3ccc4c(c3)OCO4)cc2)C1	859346075	NSHLKKCRCGVCDL-CQSZACIVSA-N	445.497	1.911	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@H](B(O)O)C2)cc1S(=O)(=O)N(C)Cc1ccccc1	864232739	BVIBPCYDDIVSAC-KRWDZBQOSA-N	432.307	1.205	50	20	IDGD	
CCOc1ccc(/C=C(/C#N)C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1	888522518	ITZDLHZVOYMJGF-ATVHPVEESA-N	442.497	1.704	50	20	IDGD	
O=C(CN1CCCC1=O)NNC(=O)c1nc(-c2cccs2)n(-c2ccc(F)cc2)n1	897475583	WZZCPLWIGPJZTH-UHFFFAOYSA-N	428.449	1.518	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNS(=O)(=O)c2ccc(F)cc2Cl)cc1	903910698	ZSUAHGSTZMZLHQ-UHFFFAOYSA-N	449.913	1.418	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NN=C3CCS(=O)(=O)C3)c2)cc1	912776527	JRXXEILBDZUCDL-UHFFFAOYSA-N	437.499	1.400	50	20	IDGD	
Cc1ccc2ncc(C(=O)NNC(=O)COc3ccc(Br)cc3)c(=O)n2c1	912895588	FHNZAEKDPNFSMY-UHFFFAOYSA-N	431.246	1.605	50	20	IDGD	
O=C(NNC(=O)c1cc(S(=O)(=O)N2CCOCC2)ccc1Cl)NC1CCCCC1	913449284	TZUDCGLYMYGVIF-UHFFFAOYSA-N	444.941	1.638	50	20	IDGD	
COc1ccccc1OCC(=O)NN=C1CCN(S(=O)(=O)c2c(C)n[nH]c2C)CC1	914554878	YCGIDWSXRZXKMN-UHFFFAOYSA-N	435.506	1.371	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@H]2CCCN(C(=O)N3CCCC3)C2)c2ccccc2c1=O	915108100	MFUGOWSLEZQMPX-HNNXBMFYSA-N	440.504	1.105	50	20	IDGD	
COc1cc(CCNC(=O)NNC(=O)COc2ccc(F)cc2)c([N+](=O)[O-])cc1OC	916219075	KZZFPIBMRWRHLU-UHFFFAOYSA-N	436.396	1.703	50	20	IDGD	
CO[C@H](CNC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)c1ccccc1	916271643	WSMDKQQKTAOSCT-GOSISDBHSA-N	448.549	1.032	50	20	IDGD	
CC(=NNC(=O)COc1cc(C)ccc1C)c1ccc(S(=O)(=O)N2CCNCC2)cc1	916297675	DURDQTXONOUXMA-UHFFFAOYSA-N	444.557	1.817	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCC(=O)N(Cc2ccccc2)[C@H]1c1ccccc1)C(=O)NC1CC1	917622168	LORGOBAFDGNCAJ-CTNGQTDRSA-N	434.496	1.593	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2ccc(C#N)c(Cl)c2)c1	917719238	BHIXREUIZGVYKP-UHFFFAOYSA-N	442.906	1.085	50	20	IDGD	
CC[C@@H](NC(=O)NNC(=O)COc1ccc(C)cc1)c1ccccc1OCC(=O)NC	918220862	CDYQUYZUPXMPEG-GOSISDBHSA-N	428.489	1.980	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccccc1)NNC(=O)c1ccc(F)cc1Br	918339488	PCUGSGRYQPUBEM-UHFFFAOYSA-N	444.282	1.718	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCCC(=O)NNC(=O)c2ccc(Cl)cc2O)cc1C	918357965	RPNNRLKIURYMFA-UHFFFAOYSA-N	425.894	1.792	50	20	IDGD	
CC(C)N1C(=O)c2ccc(C(=O)NNC(=O)c3ccc(Cl)cc3O)cc2S1(=O)=O	918361826	ITLMFSUVJKCANC-UHFFFAOYSA-N	437.861	1.673	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)CCS(=O)(=O)C1CCCC1	919336627	LDOKKVSOJLFKFQ-UHFFFAOYSA-N	446.909	1.400	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)NCCS(=O)(=O)c1ccc(Cl)cc1	919785945	NVPVQSKMUTYUHJ-UHFFFAOYSA-N	441.893	1.532	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCOCC3)cc2)cc1	919832490	AYHRUJKPPOKSGI-UHFFFAOYSA-N	447.513	1.110	50	20	IDGD	
O=C(C[C@@H](NC(=O)c1ccccc1)c1ccccc1)NNC(=O)N[C@@H]1CCS(=O)(=O)C1	919885348	OSXVIIBNDAZMRS-QZTJIDSGSA-N	444.513	1.065	50	20	IDGD	
C[C@@H](CN1C[C@@H](C)O[C@H](C)C1)C(=O)NNC(=S)NC1CCN(Cc2ccccc2)CC1	920307917	QDRKLXDIWGBHLK-IPMKNSEASA-N	447.649	1.892	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)CCn1cc([N+](=O)[O-])nc1C	920905760	MZQUZNFRBRPHJF-UHFFFAOYSA-N	439.812	1.156	50	20	IDGD	
COC(=O)c1cc(NC(=O)NNC(=O)c2nnc(O)c3ccccc23)cc(C(=O)OC)c1	920928640	XXBLNDNOCOUVMQ-UHFFFAOYSA-N	439.384	1.375	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H](C)OC[C@@H]2CCCO2)c1	921020118	RPEPMEZTVKRUHE-HOCLYGCPSA-N	427.523	1.062	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN1C(=O)c1ccccc1OC(F)F)c1n[nH]c2c1CCCC2	1115866580	IBBMQXIQAXTUHH-HNNXBMFYSA-N	447.442	1.956	50	20	IDGD	
Nc1cnnc(NNC(=O)CN2C(=O)COc3cc(Br)ccc32)c1Cl	1116302075	RAVGEDVITKDZRU-UHFFFAOYSA-N	427.646	1.343	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(CCC(=O)NNc2nncc(N)c2Cl)cc1	1116302285	SEURNDKEUOFOIQ-UHFFFAOYSA-N	426.930	1.819	50	20	IDGD	
CCn1c(C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)cc2ccccc21	1160865402	NMSSUTKNFMWFRR-UHFFFAOYSA-N	442.545	1.749	50	20	IDGD	
CCN1CCN(C(=O)c2ccc(NC(=O)NNC(=O)c3n[nH]c4c3CCCC4)cc2)CC1	1325339128	GQFDSWSPLQKGJZ-UHFFFAOYSA-N	439.520	1.533	50	20	IDGD	
Cc1cccc(NC(=S)NNC(=O)c2ccc(S(=O)(=O)N(C)CCO)cc2)c1C	1327968093	PPDRJFOGQYDWNS-UHFFFAOYSA-N	436.559	1.548	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)/C=C3\C(=O)Nc4ccccc43)C2)C1	1778910078	ZUKQCIDMWDXDEF-HGOAZTOHSA-N	433.892	1.106	50	20	IDGD	
O=C1Nc2c(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)[C@H](F)Cl)C4)cccc2C1=O	1779150243	GYMYXDQJOSIOKP-JOTOCRJQSA-N	437.855	1.483	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@]2(C1)CN(C(=O)c1ccc(O)c([N+](=O)[O-])c1)CCO2	1779299978	IFIXWVOXCVGDAA-IBGZPJMESA-N	437.525	1.595	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(-c4cccnc4)[nH]n3)C2)C1	1779611873	XIZDUCXADYFPRI-DJJJIMSYSA-N	448.321	1.699	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(Cl)ncn3)C2)C1	1779815726	HKCZIADPLTYDCY-BDJLRTHQSA-N	431.718	1.605	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(=O)nc4sccn34)C2)C1	1779949377	WNIJYAFCVSGZEN-DJJJIMSYSA-N	438.937	1.607	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)c(OC)c1	1780532954	AZGSGJIXLZRUPL-OAQYLSRUSA-N	436.581	1.999	50	20	IDGD	
O=C(c1cccc2c1OCC2)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781330210	UELIBQFORHHXHD-MAUKXSAKSA-N	427.270	1.756	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(Cl)ncn1)C2	1782173738	OAMGMPHCVMORJE-RVZJWNSFSA-N	431.320	1.511	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](OC(C)=O)C(C)C)C2	1782175033	AVRANBHUBNHZPY-PDOICOKGSA-N	432.945	1.342	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CNC(=O)C(F)(F)F)C1	1782236030	BLYFXJCWBYUVTO-XHBSWPGZSA-N	427.851	1.196	50	20	IDGD	
O=C(C1CCC2(CC1)OCCO2)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1782943952	FOIRZRVOEGBQSG-RHSMWYFYSA-N	449.317	1.440	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](C)Br)C3)C2)o1	1783533748	GVPHXNMSNAPOPK-GTNSWQLSSA-N	428.283	1.465	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cnn(C(C)(C)C)c3Cl)CCO2)C1	1783873517	QEYHTOYNMIUQNC-KUHUBIRLSA-N	447.363	1.989	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3c(F)ccc(F)c3F)C[C@@H]21)[C@@H](O)CCl	1784086618	YVJLZWZNCMDJAW-LVLWZLKYSA-N	434.842	1.226	50	20	IDGD	
O=C(COc1cccnc1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21	1785146634	IBPJGUZEXXKBIW-ATVPRXPUSA-N	430.274	1.131	50	20	IDGD	
CS(=O)(=O)c1ccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](F)Cl)CCO3)cc1F	1785226342	PVZYVPCRETUQRS-WMLDXEAASA-N	436.864	1.207	50	20	IDGD	
Cc1cc(C(=O)Nc2ccc(C3(NC(=O)CCC(=O)NN(C)C)CCC3)cc2)n(C)n1	1787376385	INMVYPRMVUHNSW-UHFFFAOYSA-N	426.521	1.849	50	20	IDGD	
Cc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Br)C[C@@H]32)cc(O)n1	1787458223	MTUBCAWWRUCAAT-NHULGOKLSA-N	430.274	1.379	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)c1cccc2c1OCC2	1787817899	YDIFHDISUZPPAM-QEWYBTABSA-N	441.297	1.905	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnn4cccnc34)[C@H]2C1	1788292208	NZIYDHNBQCHIAS-XIRDDKMYSA-N	431.569	1.174	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C=N/N3CCCCC3)[C@H]2C1	1788604089	OQWWWUXAUOWGKX-FQHAXPTKSA-N	433.380	1.674	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21	1789668436	FRRWGYRYUXCBOS-RMIITELYSA-N	431.316	1.542	50	20	IDGD	
CCC[C@@H](NC(C)=O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]2C1	1789872657	PPIHGXBVKIJYPE-NAHJCDBISA-N	436.380	1.507	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)COCc3ccccc3)C[C@@H]21	1791057569	GHFMVZZZLFNHTD-DKIMLUQUSA-N	439.350	1.966	50	20	IDGD	
COc1nccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](C)Br)[C@H]3C2)c1F	1791057838	ILZGHBDIYGUFKQ-IMIFBBOLSA-N	444.301	1.606	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1ccc(C2(NC(=O)[C@H]3CCCS3(=O)=O)CCC2)cc1	1791571015	IPVXRHQJNWMGOK-HZPDHXFCSA-N	428.938	1.952	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC1(c2ccc(NC(=O)Cc3ccc(O)cn3)cc2)CCC1	1791937410	HVZVEYYLRDALNK-UHFFFAOYSA-N	439.516	1.837	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3ccc(Cl)cc3[nH]1)C2)[C@@H](O)CCl	1792972478	QAPFAKIFQHBKDK-LZDSYCOUSA-N	426.300	1.624	50	20	IDGD	
COc1cccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@](C)(Cl)CCl)C3)n1	1793989500	QSMPZTCAWGLUNC-OESLAJAZSA-N	430.332	1.459	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cn1ccc2sccc2c1=O	1794044972	XZEAPEKFTBEJPI-HRJSJKBJSA-N	437.949	1.670	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CCc3ccccc3O1)C2	1795117124	NQQOPLCEMRGATM-LORHWOILSA-N	437.334	1.755	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(F)cc([N+](=O)[O-])c1)C2	1797956510	YYGUYOMSBQKHHA-ZSBFGKGUSA-N	439.516	1.789	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(Cl)nc1Cl	1798029285	MQVAUYUZNXCGAN-IQOUGMIPSA-N	436.723	1.845	50	20	IDGD	
CC(C)N1CCC(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)CC1	1798440769	PUXKRIJAHGYPSQ-BCDXTJNWSA-N	442.564	1.057	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccccc1F	1798786827	ZOAMZDOVDKALLZ-DHMDNZFNSA-N	441.463	1.163	50	20	IDGD	
CC(C)(C)n1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Br)cn1	1799347352	GHZVKNIIGQEMAQ-XJFOESAGSA-N	431.306	1.532	50	20	IDGD	
CCc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Br)cc(C)n1	1799347925	XTLFYZCQNFOQFM-OCVGTWLNSA-N	428.302	1.846	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(Cl)c(O)cc1O	1799444104	SBVPIJDSCJDOSD-KSPBDQMDSA-N	442.972	1.806	50	20	IDGD	
C[C@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnccc1C(=O)NN)C2)c1ccc(O)cc1	1800103655	XXEOWTAHSZMZHJ-LLLHUVSDSA-N	437.500	1.446	50	20	IDGD	
C/C(=C/C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C#N)=C/c1ccc(F)cc1F)C(=O)O	1800334027	DLDXFYYAYATVTH-IACVHUAVSA-N	445.422	1.492	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C[C@H](N)c1cccnc1)C2	1800638936	DLKJUOCDVGSSNV-IWSXDTNSSA-N	439.354	1.235	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccnn1C(C)C)C2	1800642129	YFCILCXABUEFEP-HLPPOEQASA-N	427.343	1.841	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cn(C)cc1C(F)(F)F)C2	1800978231	OVWOESHTNFLVFT-BAESOJJISA-N	437.846	1.501	50	20	IDGD	
Cc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCC(=O)NN(C)C)C3)c(Cl)c1	1801735801	SELVDACTVSLUBL-YVWYUNDQSA-N	436.940	1.225	50	20	IDGD	
COC[C@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnc3cc(C)ccn3c1=O)C2	1802272488	AHTJFSXJCJAQAY-IVSAIRAKSA-N	432.908	1.509	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc3ccnn3c2)[C@H]1c1cccnc1)[C@H](O)CCl	1803148250	PRHJKFMFOSASQX-IPELMVKDSA-N	427.892	1.649	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1803689946	HNJMATASMWDLID-HOJAQTOUSA-N	443.740	1.489	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)N1CC[C@@H](CNC(=O)CCBr)[C@@H]1c1cccnc1	1806343224	OAOHVKAWRRSJTO-XUWXXGDYSA-N	437.338	1.563	50	20	IDGD	
Cc1cscc1C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1807361144	HLIFWWFCDDRLJG-NQIIRXRSSA-N	449.341	1.765	50	20	IDGD	
C=CC[C@H](C(=C)C)C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1807362483	VQLKMMZNKOBGFP-WWNPGLIZSA-N	447.344	1.849	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)C(Cl)Cl)[C@@H]1c1cccnc1)c1cc(O)nc(O)n1	1808305427	ZPPNNRDMHSEPKW-ZWNOBZJWSA-N	426.260	1.406	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)CO[Si](C)(C)C)[C@H]1c1cccnc1	1808430785	KIMPCZIQZRCBMS-BPAFIMBUSA-N	434.613	1.806	50	20	IDGD	
CC[S@](=O)CCC(=O)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@H]1c1cccnc1	1810122849	HLSBSTYLEXXMIS-DWVZEGLISA-N	448.358	1.937	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)N1CC[C@H](CNC(=O)[C@H](C)Br)[C@H]1c1cccnc1	1812865200	VGPAUANYTLSSAU-PMOUVXMZSA-N	440.342	1.318	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)CC2CCOCC2)[C@H]1c1cccnc1	1813071480	QVRNLIHLEHSSFS-XXBNENTESA-N	445.564	1.277	50	20	IDGD	
Cc1cnc2c(C(=O)N3CCCC[C@H]3c3cc(NC(=O)[C@@H](O)CCl)n[nH]3)cnn2c1	1814873161	NSCUKEHRJVMINE-GJZGRUSLSA-N	431.884	1.666	50	20	IDGD	
Cc1cc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cnccc2C(=O)NN)CC3)c[nH]1	1817756166	LXSVTVQKVNLLPL-LBPRGKRZSA-N	439.501	1.318	50	20	IDGD	
Cc1cc(C(=O)NCC(=O)Nc2cc([C@H]3CCCCN3C(=O)C(Cl)Cl)[nH]n2)no1	1819468560	NSWUEAOELSGFTI-GFCCVEGCSA-N	443.291	1.932	50	20	IDGD	
O=C(/C=C\C(=O)NC1CC1)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](F)Br)CC2	1819531819	SEWIFIUOPWKFSS-VYOAUYJHSA-N	445.314	1.580	50	20	IDGD	
C[Si](C)(C)OCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)CN1CCCCC1=O)CC2	1820169112	PSQZINBOVUDWFT-CYBMUJFWSA-N	438.626	1.919	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](F)Br)n[nH]1	1820934778	AXCYQBRSBLVNCH-CDMKHQONSA-N	447.309	1.800	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H]2C[C@H]3CC[C@@H]2O3)n[nH]1	1822218781	XSQIXRABMUWTHW-JHNDHUHGSA-N	432.525	1.342	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H]2C[C@@]2(F)Cl)n[nH]1	1822503973	IAAQHJPTJPQMJJ-CFZJUORYSA-N	449.874	1.639	50	20	IDGD	
O=C(N[C@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1)c1ccc[n+]([O-])c1	1823001458	FYIZKXXWBPSBMF-CABZTGNLSA-N	429.271	1.693	50	20	IDGD	
COc1ccc(C(=O)N[C@@H]2CCc3nc(NC(=O)[C@@H](C)Br)sc3C2)nn1	1825642332	POFLBNBXPPDIAZ-RKDXNWHRSA-N	440.323	1.951	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCc1nc(N)n[nH]1)CC2	1825642618	SARSNIQRQYGMGI-HTQZYQBOSA-N	442.343	1.172	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H](F)Cl)CC1	1827609115	NFZMTZWMNAQDPL-HOTGVXAUSA-N	425.892	1.453	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)C2=CCCS2)CC1	1828923627	PTUKQVJTZJNWDP-SFHVURJKSA-N	443.573	1.939	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C1(c3ccccc3)CC1)CCO2	1829843059	DWTCTSDQSNPYJR-RXVVDRJESA-N	436.936	1.428	50	20	IDGD	
CCOC(=O)O[C@@H](C)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830366234	LJTMNSWRLCKYQH-LIRRHRJNSA-N	434.917	1.269	50	20	IDGD	
C=CCOCCCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2	1830535318	MJADIQMBSDSPRO-QFBILLFUSA-N	447.370	1.457	50	20	IDGD	
O=C(Cc1cccc2ncccc12)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1831351325	XDJADKWXGBJQCV-FPOVZHCZSA-N	435.883	1.768	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)n3ccccc3=O)C2)C1	1831651516	QJSKNKZSHWJPPY-LLGFUMIMSA-N	439.940	1.273	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3c4c(nn3C)CCC4)C2)C1	1831653134	BAJXNHGKFNSQKG-IERDGZPVSA-N	438.956	1.386	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)/C=C/c3cccnc3)CCO2)C1	1833104644	KWTPVKAKNLBOQP-LTGPNDRFSA-N	438.322	1.335	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H]3Cc4ccccc4O3)CC2)CC1)[C@H](O)CCl	1833309851	BHMNRFSPIUMEDI-QUCCMNQESA-N	435.952	1.161	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cc(F)cnc3Cl)CC2)CC1)[C@@H](O)CCl	1833311787	DXNARLZJCRIVMS-INIZCTEOSA-N	447.338	1.659	50	20	IDGD	
CN(C)c1cncc(C(=O)N2CCO[C@@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)c1	1833358725	RQZAWKSOHINGGX-NRFANRHFSA-N	438.956	1.483	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)CCBr)C3)C2)s1	1833418958	UVHIBKUBHFLHAT-KRWDZBQOSA-N	447.351	1.612	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)c3cc(Cl)ccn3)C2)C1	1834823077	HVENPFUYUKJOQN-KRWDZBQOSA-N	446.729	1.590	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)c1ccc2cc[nH]c2c1	1835294586	UMDJZALLASQSCX-HXUWFJFHSA-N	432.952	1.953	50	20	IDGD	
COc1ccc(C(=O)NC2CCN(C3CCN(C(=O)[C@H](O)CCl)CC3)CC2)c(C)c1	1836328784	RUPYCHKDCUEFIT-HXUWFJFHSA-N	437.968	1.789	50	20	IDGD	
Cc1cccc2cc(C(=O)N3CCO[C@@]4(COCCN(C(=O)[C@@H](O)CCl)C4)C3)[nH]c12	1836851490	MVGPEAPSNRQHBX-UWJYYQICSA-N	435.908	1.146	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)NC(=O)OCC)CC2)CC1	1836923437	XKHNZHFUTJYZCA-IAGOWNOFSA-N	447.960	1.457	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(F)cn3)C2)C1	1837712397	OUXLOLRINKFTGW-LJQANCHMSA-N	425.533	1.142	50	20	IDGD	
Cc1cc(C#N)cc(C(=O)N2CCOC[C@@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)c1	1837715863	OJWXRAWFSNHMNF-JOCHJYFZSA-N	445.592	1.788	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)C(=O)NCC(C)C)CC2)CC1	1838108342	MUHFNHCAMUBIGC-KRWDZBQOSA-N	431.961	1.011	50	20	IDGD	
O=C(c1c(F)cccc1Cl)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1	1838868011	FEFHBIWTIIIIDV-KDOFPFPSSA-N	435.279	1.149	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(F)c(F)c3)CCO2)C1	1839010733	DKQDRSGJZHNCOO-AUUYWEPGSA-N	432.851	1.289	50	20	IDGD	
O=Cc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)s1	1839199503	OZLWYDYPCUFAPT-XJKSGUPXSA-N	449.298	1.321	50	20	IDGD	
O=C(c1cc2ccoc2cn1)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1839486802	DJTMZFDNBRGGRH-GOSISDBHSA-N	428.272	1.702	50	20	IDGD	
C=CCC(F)(F)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)Br)C2)C1	1839890741	QVNVYAVETZCRAS-IUODEOHRSA-N	425.270	1.438	50	20	IDGD	
C=CCO[C@H](C)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H](Br)CC)CCO2)C1	1839962471	GHZISLSWTDWBSN-RVKKMQEKSA-N	433.343	1.207	50	20	IDGD	
COc1cc(C)ccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1840680596	NBCAPKRJEPTWOJ-IBGZPJMESA-N	431.316	1.877	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC12CN(C(=O)c1ccc3c(c1)n(C)c(=O)n3C)C2	1841287633	YQEKKNSWDXBPOW-ZDUSSCGKSA-N	449.349	1.725	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@]2(C(=O)N2CC3(CCCN3C(=O)[C@@H](O)CCl)C2)C1	1841353486	ADGUHHCXJGMTTG-GXZWQRSESA-N	441.956	1.437	50	20	IDGD	
C[C@H](C(=O)N1CC2(CCCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C1)n1cccn1	1841925370	OWFQLJRBPULEHC-CABCVRRESA-N	439.944	1.780	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)N2CCCC23CN(C(=O)[C@H](O)CCl)C3)CC1	1843931119	LJMIVWJOFLSRAW-HZPDHXFCSA-N	443.972	1.827	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCCC12CN(C(=O)c1ccc(S(C)(=O)=O)c(F)c1)C2	1844379736	FZJXCPWTPTVRGR-UHFFFAOYSA-N	442.585	1.898	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCCC12CN(C(=O)c1ccccc1C(=O)OCCO)C2	1845171481	BQWMTYNCIAIBPE-IBGZPJMESA-N	443.327	1.889	50	20	IDGD	
C=CC[C@H](C)C(=O)N1CCCC12CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2	1845980657	BBMXVNLURIBALC-SFHVURJKSA-N	427.549	1.748	50	20	IDGD	
CCOc1ncc(Cl)cc1C(=O)N1CC2(CCCN2C(=O)CCC(=O)NN(C)C)C1	1846385387	ZMGWAJBIVUPYEB-UHFFFAOYSA-N	437.928	1.324	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC2(CCCN2C(=O)[C@H]2CC[C@H](O)CC2)C1	1846466222	UZRSXUGKSZZEOL-JYJNAYRXSA-N	443.972	1.873	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@H]2CCC(=O)N2C(=O)OC(C)(C)C)C1	1846485946	ZUJGYLFGTYGFOF-UONOGXRCSA-N	443.928	1.370	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)Cc1ccc(Cl)c(F)c1	1847421245	AVKVSDNRZYCTHU-ROUUACIJSA-N	445.882	1.536	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C2CCN(S(=O)(=O)c3ccccc3)CC2)c1	17202846	HHPJNWKELPJESK-UHFFFAOYSA-N	445.541	1.931	50	20	IDGD	
O=C(Cc1ccccc1Cl)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	21894489	MBUMLCZOASENCA-UHFFFAOYSA-N	437.905	1.365	50	20	IDGD	
Cn1cc([N+](=O)[O-])cc1C(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	22306587	KBTKVKSSYCHKHN-UHFFFAOYSA-N	449.470	1.870	50	20	IDGD	
CSc1nc2nc(C)c(CC(=O)NNC(=O)c3cc(-c4ccccc4)n[nH]3)c(C)n2n1	25401457	MTLSQOZENQVSLB-UHFFFAOYSA-N	436.501	1.857	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2cccc(CN3CCOCC3)c2)c2ccccc2c1=O	110670435	XRBRDCTZHWTLTL-UHFFFAOYSA-N	449.511	1.714	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NC[C@@H]1COc2ccccc2C1	117284746	NKJJENQOKXLROZ-CQSZACIVSA-N	431.518	1.483	50	20	IDGD	
O=C(CCCc1ccccc1)NNS(=O)(=O)c1ccc(N2C[C@@H](C(=O)O)CC2=O)cc1	727721669	MQNHEPRDADBHJS-INIZCTEOSA-N	445.497	1.457	50	20	IDGD	
C[C@@H]1CCCCN1S(=O)(=O)c1cccc(C(=O)N([C@@H]2CCS(=O)(=O)C2)N(C)C)c1	728180716	WVDVSNFQJNZAJQ-NVXWUHKLSA-N	443.591	1.356	50	20	IDGD	
C[C@@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(S(=O)(=O)NNC(=O)c3ccc[nH]3)cc2)C1	728260584	JLSWAMHTELMHGD-ZIAGYGMSSA-N	440.547	1.305	50	20	IDGD	
O=C(Cc1cccc2ccccc12)NCC(=O)NNC(=O)C1CCN(c2ncccn2)CC1	728981196	PDWPCXLIVWVGTN-UHFFFAOYSA-N	446.511	1.353	50	20	IDGD	
O=C(NCc1cccc(CO)c1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	729621437	JMKFULFDFOFVDW-UHFFFAOYSA-N	432.502	1.108	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)CC[C@H]2NC(=O)N(c3cccc(C)c3)C2=O)c1	730738667	HBDBMSQIDHOMSB-GOSISDBHSA-N	440.456	1.678	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N[C@@H]2CCN(C3CC3)C2)cc1	730773933	MKNXHROHSOJIPY-XYSGSMRZSA-N	448.527	1.694	50	20	IDGD	
CC(C)(C(=O)NNC(=O)N1CCN(S(=O)(=O)c2ccccc2)CC1)c1ccccc1	731222020	MCOQLJSQULKUOX-UHFFFAOYSA-N	430.530	1.712	50	20	IDGD	
CON(C)S(=O)(=O)c1cc(C(=O)NNC(=O)Cc2ccccc2F)ccc1Cl	731330362	MKFVVALMJKBMTE-UHFFFAOYSA-N	429.857	1.665	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2ccc3c(c2)OCCO3)nnn1-c1cccc2cccnc12	731453167	FVVVPHUZQIBRHK-UHFFFAOYSA-N	430.424	1.970	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)c2cnn(-c3ccccn3)c2C(F)(F)F)C[C@@H](C)O1	732262582	UPCBSNHKKWASQD-CHWSQXEVSA-N	440.426	1.546	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1	732288719	QOENHPPWKJBGQS-CYBMUJFWSA-N	432.458	1.747	50	20	IDGD	
Cc1cc(Br)oc1C(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	732328087	ZPARYTYKLDVWBO-UHFFFAOYSA-N	426.179	1.877	50	20	IDGD	
C=CCOc1ccccc1CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	732473537	YFTCSVPQBHRYRH-UHFFFAOYSA-N	432.502	1.646	50	20	IDGD	
Cn1c(NNC(=O)[C@H]2CCCN2S(=O)(=O)c2cccs2)nc2ccccc2c1=O	733262373	SSMGWRZMRPLQNB-CQSZACIVSA-N	433.515	1.291	50	20	IDGD	
CN(CC(=O)NNc1nc2ccccc2c(=O)n1C)C(=O)c1ccc(Br)o1	733263377	ZGPWREGMBPNPCB-UHFFFAOYSA-N	434.250	1.504	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)Oc1ccccc1	733849934	OFKRZNIZOGDUBF-LJQANCHMSA-N	425.533	1.997	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)Cc2ccc(C(=O)NNC(=O)C3=COCC3)cc2)cc1	734119890	JLAQPKBTZXUMDZ-UHFFFAOYSA-N	429.498	1.881	50	20	IDGD	
Cc1ccc2nc(CSCC(=O)NNC(=O)C3CCN(c4ncccn4)CC3)cn2c1	734126464	CWKKMKCILLYLCQ-UHFFFAOYSA-N	439.545	1.730	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)C1(NC(=O)OC(C)(C)C)CCCC1	734239127	ICBQVESZDKKUKZ-UHFFFAOYSA-N	429.518	1.679	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccccc1Cl)NNC(=O)COCc1ccccc1	738545815	QJUGQVBCAALQRW-UHFFFAOYSA-N	425.894	1.373	50	20	IDGD	
CCOc1ccc(C(=O)NNS(=O)(=O)c2ccc(OC)c(C(=O)OC)c2)cc1OC	739670340	INSZLMRFAQQMLB-UHFFFAOYSA-N	438.458	1.512	50	20	IDGD	
O=C(NNc1cccc(C(F)(F)F)n1)c1sccc1S(=O)(=O)N1CCOCC1	740132483	IFMGVGYLYJWUDZ-UHFFFAOYSA-N	436.437	1.940	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)/C(C#N)=C\c1cc(C)n(C[C@@H]2CCCO2)c1C	740852835	KTHJIWKSQSTPJZ-XGHXRCDJSA-N	429.521	1.643	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)cc1NC(=O)Nc1ccccc1	741175395	KIVVDADBDOSQDY-HNNXBMFYSA-N	430.486	1.835	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CSc2nnc(SCc3ccccc3)n2N)c1	741853623	BXGXXKQYLMKFOX-UHFFFAOYSA-N	439.526	1.709	50	20	IDGD	
CC(C)(C)OC(=O)N(CC(=O)NNC(=O)[C@H]1COc2ccccc2O1)C[C@@H]1CCCO1	741882704	KPQOHWFPOFIVTL-WMLDXEAASA-N	435.477	1.390	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CSc2ccc(S(=O)(=O)N3CCCC3)cn2)c1	742449791	PUJKSQXQUXBXIT-UHFFFAOYSA-N	434.543	1.728	50	20	IDGD	
CC(C)(C)c1nc2ccc(S(=O)(=O)NNC(=O)N[C@H]3CCS(=O)(=O)C3)cc2s1	743254973	WDZJITGRXLEVPM-JTQLQIEISA-N	446.576	1.273	50	20	IDGD	
C[C@H](CCc1cccc(F)c1)C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	743419976	REZCODRQIXZDHO-MRXNPFEDSA-N	449.552	1.869	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)N[C@@H]2CCCN(S(C)(=O)=O)C2)cc1Cl	743563071	LQBASYKEBIIUJL-SNVBAGLBSA-N	449.917	1.117	50	20	IDGD	
CN(C[C@@H]1CCN(Cc2ccccc2)C1)C(=O)NNC(=O)CNC(=O)c1cccs1	743577644	FPDKTZGFWJXEMT-KRWDZBQOSA-N	429.546	1.673	50	20	IDGD	
COc1nc2sccn2c1C=NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	744729333	RVRIHRXPVXRBHB-UHFFFAOYSA-N	433.515	1.953	50	20	IDGD	
CO[C@]1(C)C[C@@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)C1(C)C	745934875	CWKIUNFOUOAYSB-OXQOHEQNSA-N	438.550	1.619	50	20	IDGD	
O=C(Cc1csc(NC(=O)c2ccccc2)n1)NNC(=O)Cc1cn2ccccc2n1	746552995	CIQVEWCBEXLMQJ-UHFFFAOYSA-N	434.481	1.976	50	20	IDGD	
Cc1ccc(C(=O)N2CCC(NC(=O)NNC(=O)Cc3cn4ccccc4n3)CC2)cc1	746762402	RXAFKWIDYWGBAG-UHFFFAOYSA-N	434.500	1.820	50	20	IDGD	
Cc1ccc(NCCCNC(=O)NNC(=O)Cc2cn3ccccc3n2)c([N+](=O)[O-])c1	746766513	FFCCJXMTBOABBN-UHFFFAOYSA-N	425.449	1.926	50	20	IDGD	
CCOc1ccc(N2C(=O)c3ccc(C(=O)NNc4nccn(C)c4=O)cc3C2=O)cc1	747941727	DZHXGDXCXLQDFU-UHFFFAOYSA-N	433.424	1.737	50	20	IDGD	
CC(C)CNS(=O)(=O)c1cc(C(=O)NNc2nccn(C)c2=O)c(Cl)cc1Cl	747943492	ZDGSSEQHEFOBPG-UHFFFAOYSA-N	448.332	1.778	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@](F)(C(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)C1	748210310	LOTRLTAHGYMSHU-IBGZPJMESA-N	443.859	1.993	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H](C(C)C)N2CCCC2=O)c1	748558016	UNVFTMGDVWCNKK-SFHVURJKSA-N	438.550	1.125	50	20	IDGD	
O=C(CN1CCCN(C(=O)Cc2cccc(F)c2)CC1)NNC(=O)c1ccc(F)cc1	748836606	XDZJDTPTJSLBKL-UHFFFAOYSA-N	430.455	1.503	50	20	IDGD	
C[C@H]1CC(C)(C)CC[C@@H]1NC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	748967247	JHLOVDVRYXPNIX-RDJZCZTQSA-N	438.598	1.859	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2cc3ccccc3o2)cc1	749478739	KZBCCKFPRAGLDE-UHFFFAOYSA-N	445.453	1.349	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)c2ccc(F)c(NS(C)(=O)=O)c2)cc1	750718117	CKCBTUSFWKHPQU-LBPRGKRZSA-N	439.465	1.824	50	20	IDGD	
N#Cc1ccc(S(=O)(=O)NNC(=O)CNC(=O)c2cccs2)c(C(F)(F)F)c1	751278796	AMSNXVAVIHELIA-UHFFFAOYSA-N	432.405	1.378	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)n[nH]2)cc1OC	751350821	IDKGTUWQCGZIQG-UHFFFAOYSA-N	444.469	1.572	50	20	IDGD	
CCNC(=O)C1(CNC(=O)NNC(=O)Nc2cc(Cl)c(OC)cc2OC)CCC1	753296364	XKLXXVUDZHQUJU-UHFFFAOYSA-N	427.889	1.999	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)CCOc2ccccc2)c(C)c([N+](=O)[O-])c1	753842117	XRTQNIOATMVBCV-UHFFFAOYSA-N	444.400	1.245	50	20	IDGD	
C[C@H](CS(=O)(=O)c1ccc(F)cc1)C(=O)NNC(=O)c1nnc(O)c2ccccc12	755044868	BMXYTNPPRBZGNB-LLVKDONJSA-N	432.433	1.346	50	20	IDGD	
CON(C)S(=O)(=O)c1ccc(NC(=O)NNC(=O)Cc2ccc(Cl)cc2)cc1	755531135	ACVIHIJXMJIJFI-UHFFFAOYSA-N	426.882	1.917	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)Nc1ccc(-n2nccc2C(F)(F)F)cc1	756184384	CRUSRPIYIKJSAS-JTQLQIEISA-N	431.396	1.479	50	20	IDGD	
COc1cccc(CC(=O)N2CCc3ccc(NC(=O)NNC(=O)Cc4cc[nH]n4)cc32)c1	756319085	FGNMZIISVJCQED-UHFFFAOYSA-N	448.483	1.946	50	20	IDGD	
NC(=O)c1ccccc1Oc1ccc(NC(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)cc1	756859588	TWANNZYOSWBTSQ-GFCCVEGCSA-N	432.458	1.165	50	20	IDGD	
Cc1cnn(-c2ccc(C(N)=O)cc2NC(=O)NNC(=O)COc2ccc(C#N)cc2)c1	757877343	ZAIWMTQXGQYVEK-UHFFFAOYSA-N	433.428	1.383	50	20	IDGD	
CCOCCS(=O)(=O)NCC(=O)NNC(=O)c1ccc(-c2ccc(F)cc2)s1	758156617	CJHSTEWUYXMWBS-UHFFFAOYSA-N	429.495	1.271	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@H](C#N)[C@@H](NC(=O)NNC(=O)c2cc(Br)c[nH]2)C1	758780262	ZSRCMAFUBXRAEL-SKDRFNHKSA-N	441.286	1.480	50	20	IDGD	
Cc1nn(C)c2nc(-c3cccs3)cc(C(=O)NNC(=O)C(=O)Nc3ccccn3)c12	758831274	FBKIQYHAPONLLP-UHFFFAOYSA-N	435.469	1.800	50	20	IDGD	
O=C(NC[C@@H]1CN(Cc2ccccc2)CCCO1)NNC(=O)c1ccc2c(c1)OCCO2	759219820	PPEFILHGHPWEAG-LJQANCHMSA-N	440.500	1.693	50	20	IDGD	
Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCN(CCI)CC1	759322477	KEZMHCQXTIGXOM-UHFFFAOYSA-N	439.275	1.645	50	20	IDGD	
COC1CCC(CC(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)CC1	760154141	KHDKAVVOIHOUSO-UHFFFAOYSA-N	425.555	1.056	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)CCc1c(C)nc2nc(N)nn2c1C	762349666	LADLOYWFDNMZGG-UHFFFAOYSA-N	429.506	1.204	50	20	IDGD	
O=C(COC(=O)c1cc([N+](=O)[O-])c2nsnc2c1)NNC(=O)c1cccc(Cl)c1	762976208	RESJBHARNSMJAX-UHFFFAOYSA-N	435.805	1.871	50	20	IDGD	
O=C(NNC(=O)c1ccccc1)C(=O)Nc1ccc(C(=O)N2CCOCC2)c(Cl)c1	763430828	NYKVFFZQAIXWES-UHFFFAOYSA-N	430.848	1.212	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccn(-c2ccccc2Cl)n1	763443131	XUFKBNSSKDASRN-UHFFFAOYSA-N	428.792	1.834	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)N[C@@H](CN1CCOCC1)c1ccccc1	763466600	RYKIMVLXCGDPLN-KRWDZBQOSA-N	430.530	1.888	50	20	IDGD	
Cc1cccc(N2CCN(Cc3ccc(NC(=O)C(=O)NNC(=O)C4CC4)cc3)CC2)c1	763558393	OCQVSQDXCLKCPS-UHFFFAOYSA-N	435.528	1.813	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)N1CC2(CCCC2)c2c(F)cccc21	763570845	IYLVNAUOEMZQEI-SFHVURJKSA-N	439.443	1.972	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(S(=O)(=O)CC)cc1	763679634	BHQRSKFPIJJFFP-UHFFFAOYSA-N	449.485	1.044	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccccc2S(C)(=O)=O)cc1	763766817	DQIWWOWARXYXAS-UHFFFAOYSA-N	447.513	1.915	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)C(=O)Nc1cccc(CC(F)(F)F)c1	763804128	KUOFZTLQEXNWBM-UHFFFAOYSA-N	440.334	1.865	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)ccc1C(=O)N(C)C	763841901	UYZWJFDNPSQKPU-MRXNPFEDSA-N	440.500	1.867	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cccc(-c3nncn3C)c2)c1C	763842233	XQYITFGNPAASAA-OAHLLOKOSA-N	436.472	1.652	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(OC)c(OC)cc2OC)cc1OC	763901835	KDEVVNKJPUUUPD-UHFFFAOYSA-N	447.444	1.519	50	20	IDGD	
CCOC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc1	763947898	DTDWICRTTGQEPW-UHFFFAOYSA-N	437.412	1.154	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)C(=O)Nc1ccccc1SCc1ccccc1	764001757	FCEZDYYOHJADHD-OAHLLOKOSA-N	447.538	1.500	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1cccc(C(=O)N2CCSCC2)c1	764041377	TUMCOSNXXPPDHR-UHFFFAOYSA-N	442.497	1.284	50	20	IDGD	
CCOC(=O)Cn1ccc2cc(NC(=O)C(=O)NNC(=O)c3ccc(Cl)nc3)ccc21	764091332	BJPRZAJIPYTUTD-UHFFFAOYSA-N	443.847	1.653	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(CS(=O)(=O)C(C)C)c2)c(O)c1	764105631	WOSXPCSFYOKIAU-UHFFFAOYSA-N	433.486	1.424	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2O1)C(=O)Nc1cccc(C(=O)N2CCCCC2)c1	764150764	BBGSGUFFHKSQIP-IBGZPJMESA-N	436.468	1.402	50	20	IDGD	
N#Cc1ccc(Oc2ccc(NC(=O)C(=O)NNC(=O)[C@@H]3Cc4ccccc4O3)cn2)cc1	764151978	MSGNSSRLAPOAIK-IBGZPJMESA-N	443.419	1.835	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2O1)C(=O)Nc1ccc(-c2nnc3n2CCCC3)cc1	764163746	LPZQDIBBGFNRLV-SFHVURJKSA-N	446.467	1.371	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2O1)C(=O)Nc1ccc(CCN2CCCCC2)cc1	764167546	KSFOJHWTSAOYTO-NRFANRHFSA-N	436.512	1.805	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(NC(=O)C(=O)NNC(=O)CC2CCCC2)ccc1Cl	764179752	WEORLPUJUYUGTF-UHFFFAOYSA-N	430.914	1.257	50	20	IDGD	
O=C(CCCc1ccccc1)NNC(=O)C(=O)Nc1ccc(CCN2CCOCC2)cc1	764224058	OTHBETQVVSUMNW-UHFFFAOYSA-N	438.528	1.670	50	20	IDGD	
O=C(NNC(=O)c1cccc(OC(F)F)c1)C(=O)Nc1ccc(C(=O)N2CCCC2)cc1	764260393	XFPYAVJEHDTODZ-UHFFFAOYSA-N	446.410	1.924	50	20	IDGD	
COCCNS(=O)(=O)c1c[nH]c(C(=O)NNC(=S)Nc2ccccc2C(C)C)c1	764322893	XSUHUHAITLTYHH-UHFFFAOYSA-N	439.563	1.694	50	20	IDGD	
NS(=O)(=O)c1ccc(OCC(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)cc1	764335257	ORMUAKPASBJNCH-UHFFFAOYSA-N	440.428	1.027	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1	764342665	GVTRYVLUDDGPQO-UHFFFAOYSA-N	448.439	1.793	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)c(Cl)c1)C(=O)Nc1cccc(-c2nnnn2C2CC2)c1	764349429	OGINQVFEHMGZDX-UHFFFAOYSA-N	441.835	1.434	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1cc(C)nn1C1CCOCC1	764393198	DPIACZCYTXCPGO-UHFFFAOYSA-N	447.517	1.430	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(-c2ncc3n2CCCC3)cc1	764401232	URFRFMAVTKZZLZ-AWEZNQCLSA-N	429.477	1.024	50	20	IDGD	
CCS(=O)(=O)c1cccc(CC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)c1	764450206	MCLZVWJDZCQRAB-UHFFFAOYSA-N	428.470	1.375	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@H](C)Oc3cccc(F)c3)CC2)cc1	765749742	SJJKUYDNGQGCGY-SFHVURJKSA-N	428.508	1.867	50	20	IDGD	
CN(CCO)S(=O)(=O)c1ccccc1CNC(=O)NNc1ncnc2ccsc12	767001877	IFEUGQCLNUDMNK-UHFFFAOYSA-N	436.519	1.130	50	20	IDGD	
Cc1noc(C2CC2)c1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	767889741	JOYULIAJAIPGGW-UHFFFAOYSA-N	449.489	1.348	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)c1ccc(-n2cnc3ccccc32)nc1	768279338	LJWYTYOJSLDNAU-UHFFFAOYSA-N	449.496	1.788	50	20	IDGD	
COc1ccc(NNC(=O)CCS(=O)(=O)c2ccc(OC)c(OC)c2)c([N+](=O)[O-])c1	768579209	JJHSHNSOYMHRNI-UHFFFAOYSA-N	439.446	1.928	50	20	IDGD	
O=C(NCc1cccc2c1OCCCO2)NNC(=O)c1csc(N2CCOCC2)n1	769955851	SWCBOIBLQJBIDD-UHFFFAOYSA-N	433.490	1.285	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)NCc1ccc(N2CCOCC2)nc1	770131060	DCPHCEXWJAKXJN-AWEZNQCLSA-N	433.896	1.870	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNS(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	771607616	ONYDWUBYRYTAFU-UHFFFAOYSA-N	447.256	1.528	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)CN(C)S(=O)(=O)c1ccc(Cl)cc1	771850828	OUJGHNVUHMPINV-LBPRGKRZSA-N	433.914	1.086	50	20	IDGD	
Cc1ccc([N+](=O)[O-])c(OCCC(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)c1	772195041	HHRDQKRQEQSWKP-UHFFFAOYSA-N	434.836	1.789	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)N[C@@H](CS(C)(=O)=O)c2ccccc2)cc1C	774278711	JBTNYQBKPXCULK-KRWDZBQOSA-N	432.502	1.358	50	20	IDGD	
COc1nc(C)ccc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	777271088	UFOCZCZUYIVHET-UHFFFAOYSA-N	432.502	1.648	50	20	IDGD	
COc1cc(C(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)c([N+](=O)[O-])cc1OC	778782608	HWLCYSNPUQYGDK-UHFFFAOYSA-N	437.792	1.883	50	20	IDGD	
Cc1cc(C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)nn1-c1cccc(C#N)c1	780194184	COUHLDWUWYNVHD-UHFFFAOYSA-N	428.408	1.542	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc2c(c1)nc(CCC(=O)NN=c1cc[nH]cc1)n2C	780756270	CJXSMKHARFHURM-UHFFFAOYSA-N	430.534	1.497	50	20	IDGD	
COC(=O)c1cc(F)cc(S(=O)(=O)NNC(=O)c2cccc(Br)c2)c1	782258080	SDLUATGULGVKFK-UHFFFAOYSA-N	431.239	1.998	50	20	IDGD	
Cc1ccccc1NC(=O)NNC(=O)C(=O)Nc1cc(S(=O)(=O)N(C)C)ccc1F	783416898	GQQQXWDVTOXLIS-UHFFFAOYSA-N	437.453	1.176	50	20	IDGD	
N#C/C(=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)NN1CCCNC1=O	783599413	DJNVNXZRVLOFRD-GXDHUFHOSA-N	441.879	1.432	50	20	IDGD	
CN(C)CCn1c(=O)oc2ccc(NC(=O)C(=O)NNc3ccc(OC(F)F)cc3)cc21	784307081	CELMTCZQBGKHBP-UHFFFAOYSA-N	449.414	1.839	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)c(Br)c1	785068113	TXHKCPZKXIXHKJ-UHFFFAOYSA-N	430.262	1.734	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)n(-c2ccc(F)cc2)n1	785073977	PDHSAGSSHVIAAA-UHFFFAOYSA-N	435.419	1.296	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2cccc(CS(C)(=O)=O)c2C)n1	785227803	YAMASKCNDGSAOF-UHFFFAOYSA-N	434.522	1.258	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1cccc(OCCF)c1	785330784	MBGZADAOKHCBOC-UHFFFAOYSA-N	425.438	1.529	50	20	IDGD	
CCCCn1c(N)c(N(CC)C(=O)COC(=O)/C(C#N)=C\c2ccccc2)c(O)nc1=O	785365127	SUIWQJIKEXODQC-VBKFSLOCSA-N	439.472	1.834	50	20	IDGD	
Cc1ccc(C(=O)NCC2CC2)cc1NC(=O)C(=O)NNC(=O)c1ccc(Cl)cc1O	785990365	FHPYSVJACCDOJO-UHFFFAOYSA-N	444.875	1.894	50	20	IDGD	
CCS(=O)(=O)CCn1cc(C)c(NC(=O)C(=O)NNc2c(F)cccc2Cl)n1	787555529	PGFUAZRHQIREGO-UHFFFAOYSA-N	431.877	1.501	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NNc2ccc(-n3ccnc3)nn2)s1	788180650	CVJHMSIJUNCNCB-ZDUSSCGKSA-N	433.519	1.329	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)N[C@@H](COC)[C@@H]2CCCO2)c2ccccc2c1=O	789333618	BWGUBWPINDTBHV-ROUUACIJSA-N	445.520	1.725	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2ccc(NC(=O)NNc3nc4ccccn4n3)cc2)C[C@@H](C)O1	792204777	CJBMEBVXABGBBP-OKILXGFUSA-N	445.505	1.676	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1c2c(nn1-c1ccc(Cl)cc1)CCC2	792267650	GXFJVUQVSRDYGG-UHFFFAOYSA-N	427.852	1.895	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N2CC([C@@H]3CCOC3)C2)cc1	792608765	TXZUQUSBSVNHGP-RMFUMNGISA-N	449.511	1.836	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)N1CCC[C@H](C=NNC(=O)c2ccc3c(c2)OCO3)C1	794457365	WSARDQNHFJEJIU-CQSZACIVSA-N	432.477	1.894	50	20	IDGD	
Cc1nc(C#N)c(N2CCC(C(=O)OCC(=O)NNC(=O)Cc3ccccc3C)CC2)o1	796277857	DIRLCHRHMDWEOA-UHFFFAOYSA-N	439.472	1.313	50	20	IDGD	
CC(C)Oc1ccc(NC(=O)C(=O)NNC(=O)c2cccc3ncccc23)cc1C(N)=O	797009143	PVIVVGLUIYLEMT-UHFFFAOYSA-N	435.440	1.521	50	20	IDGD	
CC(C)Oc1ccccc1NC(=O)C(=O)NNC(=O)CNC(=O)OCc1ccccc1	797369057	NBYMSGXITBDYHD-UHFFFAOYSA-N	428.445	1.486	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)N[C@H]2CC(=O)N(Cc3ccccc3)[C@H]2C)cc1C	798529944	AFRNFWIQVNYDRW-LPHOPBHVSA-N	437.500	1.762	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)C1(c2cncc(Br)c2)CC1	798966078	HXIOMURVXXHBBV-UHFFFAOYSA-N	442.314	1.731	50	20	IDGD	
COc1ccc(-c2nn(CCC#N)cc2/C=C(\C#N)C(=O)OCc2nnn(C)n2)cc1OC	799453201	DRLPBHJKQZRBJS-OQLLNIDSSA-N	448.443	1.655	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(N2CCCCC2)c(C(=O)NNC(=O)N=c2cc[nH]cc2)c1	802029911	RJYDHQQAJWFKBW-UHFFFAOYSA-N	446.533	1.211	50	20	IDGD	
C#Cc1cc(F)c(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(C(C)=O)cc2)c(F)c1	802566649	ZJVVDHGNYXCYEW-GFCCVEGCSA-N	429.379	1.702	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3c(-c4cccnc4)noc3C)CC2)cc1	802763000	POTWCYHLZKOAAI-UHFFFAOYSA-N	448.527	1.932	50	20	IDGD	
CCN(C)C(=O)c1cccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1	806773483	QNOWMRICTHWAGK-UHFFFAOYSA-N	447.517	1.495	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cccc(Cl)c2)ccc1F	806973529	FGCRXLWEJNSIGC-UHFFFAOYSA-N	442.856	1.129	50	20	IDGD	
O=C1COc2c(cc(Cl)cc2NC(=O)C(=O)NNC(=O)c2cc3ccccc3o2)N1	806980338	VPSPCVRDDFVCLV-UHFFFAOYSA-N	428.788	1.817	50	20	IDGD	
Cc1ccccc1[C@@H]([C@@H](C)NC(=O)NNC(=O)c1csc(N2CCOCC2)n1)N(C)C	807406712	AZRFYVFUPAKOIS-CRAIPNDOSA-N	446.577	1.924	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)NC[C@H]2CCCS(=O)(=O)C2)c1	807580637	CRZDNWIQVVMEML-SNVBAGLBSA-N	434.312	1.227	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)Nc1ccc(Oc2cccnc2)cc1	808934798	VPPXBYUMGJPURN-LJQANCHMSA-N	434.408	1.800	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2cncc(Cl)n2)c(C(=O)NCC(F)(F)F)cc1F	810392493	WGNJBMVFEPRFBJ-UHFFFAOYSA-N	448.764	1.951	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(=NNC(=O)CNC(=O)c2cccnc2)[C@@H]([C@H]2CCOC2)C1	812226800	UDCIOYSADZBLIJ-DLBZAZTESA-N	445.520	1.577	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)[C@H]2CSCN2C(=O)CC(C)(C)C)cc1	812728330	KBFUYRWQUMDQFB-OAHLLOKOSA-N	428.580	1.718	50	20	IDGD	
COC(=O)c1cn(-c2cccc(NC(=O)NNC(=O)c3cc(OC)cc(OC)c3)c2)nn1	812980034	LNVHWFOSLQQBOG-UHFFFAOYSA-N	440.416	1.538	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)CNC(=O)c1cccs1)c1ccc(N2CCCOC2=O)cc1	814294309	KQMKDIPRXGPVBG-CYBMUJFWSA-N	445.501	1.916	50	20	IDGD	
O=C(COC(=O)C1CCC(OC[C@H]2CCCO2)CC1)NNC(=O)c1ccc([N+](=O)[O-])cc1	815347616	FXLCUGIRIRYHBJ-VMWRSERWSA-N	449.460	1.653	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCc2nncn2C1)C(=O)Nc1ccccc1COc1ccccc1	815691885	DQACXLPICJBWAL-OAHLLOKOSA-N	434.456	1.206	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1cccc(OCCCC#N)c1	815750604	FTUXDFCFABXGJA-UHFFFAOYSA-N	445.501	1.701	50	20	IDGD	
O=C(CN1C(=O)[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)NNC(=O)c1cc2c(s1)CCCCCC2	913094964	JHHQUNBPTUBZCC-YXUGBTPSSA-N	427.526	1.975	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=O)NC2CCCCC2)c1	913451303	SPBAQRYYYGCEPZ-UHFFFAOYSA-N	432.930	1.541	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)N[C@H](CN1CCOCC1)c1ccccc1	914598227	OLUYBDJSAGNKAI-MRXNPFEDSA-N	436.310	1.795	50	20	IDGD	
CCNC(=O)COc1ccc(CNC(=O)NNc2ccc(-n3cccn3)nn2)cc1OC	916388631	FVYXEFRWHIWNHX-UHFFFAOYSA-N	440.464	1.012	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2ccc(N3CCCCC3)nc2)c1	916392439	YVURAQROXUQHBR-UHFFFAOYSA-N	431.518	1.620	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)NCc2ccc(N3CCO[C@H](C)C3)nc2)c1	916392781	LFPJPTJTKXDPBX-CQSZACIVSA-N	429.477	1.468	50	20	IDGD	
O=C(NCCCN1CCN(c2ccccc2)CC1)NNC(=O)c1nnc(O)c2ccccc12	916487323	AJFHKQSGQFTIFZ-UHFFFAOYSA-N	449.515	1.492	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)NCCN2CCN(c3ccc(F)cc3)CC2)cc1	916513810	UFZZFBIMSBCJSY-UHFFFAOYSA-N	440.479	1.229	50	20	IDGD	
CNS(=O)(=O)c1ccc(C)c(C(=O)NNC(=O)c2cc(-c3ccc(C)cc3)[nH]n2)c1	917178011	DKONSOKCGZVWJV-UHFFFAOYSA-N	427.486	1.676	50	20	IDGD	
O=C(NCCCCN1CCN(Cc2ccccc2)CC1)NNc1ccc(-n2cccn2)nn1	918231316	ZUOOVEWIXRXEQF-UHFFFAOYSA-N	449.563	1.886	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)/C=C/c1ccccc1)C(=O)NNC(=O)CC(F)(F)F	918363651	BJNVSDOFGIQECV-AORWBKJGSA-N	439.481	1.798	50	20	IDGD	
O=C(NNC(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N[C@@H]1CCS(=O)(=O)C1	919886845	WMDMUUOMIWQGRJ-SNVBAGLBSA-N	433.330	1.855	50	20	IDGD	
O=C(CSCc1ccc(Cl)cc1Cl)NNC(=O)N[C@H]1CCS(=O)(=O)C1	919889366	YIDRXWLZNDQVGR-NSHDSACASA-N	426.347	1.744	50	20	IDGD	
CCOc1ccc(C2(CNC(=O)NN[C@]3(C)CCS(=O)(=O)C3)CCOCC2)cc1	919923520	UDXRGLIMQLCDJQ-LJQANCHMSA-N	425.551	1.515	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)NCc2ccco2)cc1	920832452	QROHINPCORZEHO-UHFFFAOYSA-N	430.508	1.003	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)c1ccc(CS(=O)(=O)c2ccccc2)o1	921184501	AIVAOAKOUZBFLP-UHFFFAOYSA-N	431.426	1.038	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2sccc2S(=O)(=O)N2CCSCC2)cc1	1318028009	RPHZKOVRXVMYFG-UHFFFAOYSA-N	441.556	1.569	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)NC1CCN(Cc2ccncc2)CC1	1318285521	CFOLCVLSQLFMAZ-UHFFFAOYSA-N	438.536	1.083	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNS(=O)(=O)N2CCc3ccccc3C2)CC1	1318667832	MWELAHOJNTUPLJ-UHFFFAOYSA-N	438.550	1.557	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NCCOc2ccc3c(c2)CCC3)cc1	1330235213	WKJUJRRVYUFKRG-UHFFFAOYSA-N	432.502	1.994	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@H](C(=O)NNc2cncc(Br)c2)[C@H](C)O)cc1	1341980607	SFJXEERWIWUNDR-NHYWBVRUSA-N	443.323	1.324	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@]1(C)C[C@H]1C)C2	1778092866	SVELAOYPQJNJEH-QXHPIULGSA-N	443.548	1.680	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(C1)CN(C(=O)C1(C)COC1)CCO2	1780095690	XFSVHEYMQGJYLA-NRFANRHFSA-N	447.444	1.000	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)n(C(F)F)n1	1780313090	RMKFAACVADQXBD-ZBEGNZNMSA-N	435.269	1.814	50	20	IDGD	
Cc1nn(C)c(C)c1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Br)C1	1780770504	QQQPMSXYFAFWRE-QIIPPGSGSA-N	445.333	1.855	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)CCNC(=O)c3ccc[nH]3)CCO2)C1	1781223654	AKZMFHFXDCOBPI-RTBURBONSA-N	445.347	1.201	50	20	IDGD	
CC1(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2ccc(B(O)O)cc2)C3)CCCCC1	1782132670	KXSUXZAKUOUJCW-HYBUGGRVSA-N	442.365	1.464	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3CCN(C)CC3)C[C@@H]21	1783964079	JJJBQPMSFPSJTF-HJWJTTGWSA-N	430.387	1.339	50	20	IDGD	
COc1nn(C)cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]2C1	1783968706	GNLPFABVEJKREM-OSFYFWSMSA-N	443.342	1.053	50	20	IDGD	
O=C(c1ccc(C(F)(F)F)cc1F)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1785198741	HMSWFWBZTKGRHI-RHSMWYFYSA-N	438.805	1.888	50	20	IDGD	
Cc1ccc(C(=O)NCC(=O)N2CC[C@@]3(C2)CN(C(=O)CO[Si](C)(C)C)CCO3)cc1	1785565122	YMCJFBXJZBNGRG-JOCHJYFZSA-N	447.608	1.406	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](N)c3ccccn3)[C@H]2C1	1786872572	RUEIGBHOUNFRAF-CUINURIISA-N	439.354	1.235	50	20	IDGD	
CC(=O)c1cc(C(=O)NC2(c3ccc(NC(=O)c4cccc(B(O)O)c4)cc3)CCC2)n[nH]1	1788146015	SBCGWRWMMLMQFD-UHFFFAOYSA-N	446.272	1.354	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3CC[C@H]4CCC(=O)N4C3)[C@H]2C1	1789766932	RJXRLTZNZIMUNL-FPSMNIFISA-N	439.984	1.632	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]2C1	1789921237	DDRTWWFMHZVIRM-DGORSVRFSA-N	444.139	1.688	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3c4c(nn3C)CCC4)[C@H]2C1	1790462218	KNGXWMYCXIQQQI-DUPGQFARSA-N	439.354	1.286	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cncc(N(C)C)c3)C[C@@H]21	1791057937	ZVXHRVAOHGWKES-OQUILHJVSA-N	439.354	1.524	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc(O)cn3)C[C@@H]21	1791065051	PUUNMUBRDSQHSG-KNPMLCFXSA-N	426.311	1.093	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc4c3NC(=O)C4)C[C@@H]21	1791256846	JRJOBGFMRNTIKQ-HJWJTTGWSA-N	435.908	1.028	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(=O)c2ccccc2o1	1792766246	WDHUGAQCKMFRNG-JWXAPSBJSA-N	449.301	1.780	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1[C@@H]3CCC[C@H]1c1ccccc1N3)C2)[C@@H](O)CCl	1792976316	CCVIDQFGBAZKHV-MAOYOYBYSA-N	447.963	1.554	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccnc1-c1cccc(F)c1)C2)[C@H](O)CCl	1792977478	VXCWOTOVKZFNQZ-WTLGNFPFSA-N	447.894	1.691	50	20	IDGD	
Cc1ccc(CSCCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](O)CCl)cc1	1792982824	QSTVDHGRIGKIKD-DMUMMCEESA-N	440.993	1.808	50	20	IDGD	
Cc1nn(C)c(C)c1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)CBr)C2	1793519995	XCQPBCGBBPGVOM-BWPSIRRCSA-N	427.343	1.271	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ncc[nH]1	1794503475	ZPUUDITZUFYMNB-INHOUBOVSA-N	427.411	1.498	50	20	IDGD	
COc1cc(F)ccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1	1796192791	RYMBOIVXGVVOFR-BCDXTJNWSA-N	426.253	1.080	50	20	IDGD	
O=C(CCBr)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(=O)nc2cccnn12	1799188824	UDNYMYUOEDTWAP-CLLJXQQHSA-N	434.294	1.126	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)CNC(=O)OC(C)(C)C)C2	1799265100	ZNVMKBBDJWNCMV-QMHWVQJVSA-N	431.961	1.754	50	20	IDGD	
COC(=O)CCCCCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@](C)(Cl)CCl	1799278856	ZJIVVMZCMSMHPI-CSHUHZATSA-N	437.364	1.936	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1cc(F)ccn1)C2)[C@H](F)Br	1799344248	DURPLCLGSOZIEJ-OJXGSEEGSA-N	432.265	1.433	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1cccc(O)c1)C2)[C@@H](F)Br	1799352261	MZJGEMFWMUMLRO-DLTLXFJOSA-N	429.286	1.605	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CO[Si](C)(C)C)C3)cc1O	1799848198	YZCUCHNKHKIOCA-CWPLJXCYSA-N	449.580	1.405	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](O)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](F)Br	1800162202	LUGVBHAEVTVHIT-FBUUZDRASA-N	438.294	1.158	50	20	IDGD	
CCN(CC)[C@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)c1ccccc1	1800300716	QZNPUGJYSGQOQE-IVDHNXQLSA-N	437.968	1.259	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(O)c([N+](=O)[O-])c1)C2	1800759988	VZVKDLCRNZSOET-BTABJRDXSA-N	442.266	1.287	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnn(C(C)(C)C)c1Cl)C2	1800974404	VSAGDCUYYRDCEQ-AYRXBEOTSA-N	447.363	1.749	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc(NC(C)=O)cc1)C2	1800978582	VRWJHOQYWWOMHM-WQDJSCAQSA-N	437.924	1.031	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)Oc1cccnc1	1801405739	UGQJGXDOBSDKGN-BDLOOMQFSA-N	440.338	1.612	50	20	IDGD	
COc1cccc(Cl)c1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(B(O)O)cc1)C2	1803747862	MPAIWBRUVOJGDC-BJWYYQGGSA-N	442.708	1.594	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2cccc(=O)n2C)[C@@H]1c1cccnc1	1805314666	BXVNGFANAOLYNK-BXWFABGCSA-N	432.908	1.354	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC2(CCN(C(=O)C[C@@](C)(O)CC(=O)O)CC2)C1	1805389267	KROCGFAIKZHCNA-RDTXWAMCSA-N	447.370	1.864	50	20	IDGD	
Cc1cc(C(=O)NC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)no1	1805840056	YRPVDDWQDIBQMK-JXFKEZNVSA-N	428.493	1.071	50	20	IDGD	
O=C(CCn1c(=O)oc2ccccc21)N1CCCC2(CCN(C(=O)[C@@H](O)CCl)CC2)C1	1806898536	JKNBVLITLYNDJR-KRWDZBQOSA-N	449.935	1.816	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)c2cnoc2)[C@@H]1c1cccnc1	1808521666	MTCCXVLHLQULSN-VQMZYRHSSA-N	449.471	1.523	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)c3cccn4ccnc34)CC2)C1	1809971868	AHRCTJATBKVXJV-UHFFFAOYSA-N	446.316	1.173	50	20	IDGD	
CC(F)(F)C(C)(C)C(=O)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1	1809977341	FUQFGRWXPFQYGN-UHFFFAOYSA-N	436.308	1.893	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)c3c[nH]c4ncccc34)CC2)C1	1809978116	MNXGAJSNENBTEH-UHFFFAOYSA-N	446.316	1.401	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)C2CCCC2)[C@@H]1c1cccnc1	1810298597	KGHYNBYDODJZDG-FXAWDEMLSA-N	436.516	1.590	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)C(=O)Nc2cccnc2)[C@@H]1c1cccnc1	1810466328	YNSLTASVVBWPCK-SZMVWBNQSA-N	445.907	1.375	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H](CNC(=O)c2ccnnc2O)[C@@H]1c1cccnc1	1811220635	DMMUJDYYQKGCAG-XPKDYRNWSA-N	448.321	1.928	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1)c1ccnnc1O	1811222531	MOJPWHBDSCOFMI-BBRMVZONSA-N	434.294	1.682	50	20	IDGD	
Cc1cnoc1C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1811250585	SEOUXCDAKYWNRA-QFBILLFUSA-N	428.493	1.071	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2ccc(F)cc2)[C@@H]1c1cccnc1	1811906208	WNPNDPLYRMBXNT-GCJKJVERSA-N	441.507	1.913	50	20	IDGD	
COc1cnc(C(=O)N2CC[C@H](CNC(=O)[C@H](C)Br)[C@H]2c2cccnc2)cn1	1812863549	FGTXWGVAXYRUSQ-DXCKQFNASA-N	448.321	1.983	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)Cc2cnn(C)c2)[C@H]1c1cccnc1	1812867754	MMTOWCQTEGGDDH-OWQGQXMQSA-N	434.338	1.847	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)CN2CCSCC2)[C@@H]1c1cccnc1	1813027884	HTCNDFCMKJKJCM-JENIJYKNSA-N	440.997	1.390	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CNC(=O)N(C)C)n[nH]1	1814566103	CGODFXISXOVBKH-PWSUYJOCSA-N	429.319	1.456	50	20	IDGD	
C[C@H](CBr)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H]2CNC(=O)C2)[nH]n1	1814782842	BGKPTXPVRFXVCI-NTZNESFSSA-N	426.315	1.569	50	20	IDGD	
COc1cccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)n1	1817473421	SGSPPYXMOPCMIL-SFHVURJKSA-N	449.276	1.113	50	20	IDGD	
N#Cc1cccc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cccc(B(O)O)c2)CC3)c1	1822027149	GBCXGNFPBZEQQW-KRWDZBQOSA-N	446.297	1.234	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H]2C[C@H](O)CN2)[nH]n1	1822091090	WABRDIXUPBFTDG-AUZPSNTRSA-N	428.331	1.298	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H]2CNC(=O)C2)CC1	1824096089	JOAQUDIIYIPYDY-VNQPRFMTSA-N	428.371	1.773	50	20	IDGD	
CN1CCCn2nc(C(=O)Nc3nc4c(s3)C[C@@H](NC(=O)[C@H](F)Cl)CC4)cc2C1	1824381413	DQPQEHVHQFEBSG-BONVTDFDSA-N	440.932	1.935	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)C[C@H](N)c1cccnc1)CC2	1825998671	HPCPLRLUFKLPDE-RDBSUJKOSA-N	437.953	1.794	50	20	IDGD	
O=C(C(Cl)Cl)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827054648	IFWPXMYXBJTBMW-INIZCTEOSA-N	427.137	1.403	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](O)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](F)Cl)CC1	1827615005	KCKYTRBPFSJDRS-RRFJBIMHSA-N	435.924	1.984	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)Cn3cc(C)c(O)nc3=O)sc2C1	1827994947	WBFYNEBNLPLJDR-MNOVXSKESA-N	439.925	1.343	50	20	IDGD	
COc1ccnc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)c1	1829262756	POMLFCMUSPEKKA-FQEVSTJZSA-N	445.564	1.697	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(C4CC4)on3)CCO2)C1	1830198522	AWQTZDPBSYSYCA-RBUKOAKNSA-N	446.331	1.858	50	20	IDGD	
CCOC(=O)[C@@H]1CCC[C@H](C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)C1	1830701810	BCVRBQFNGMSERV-ROYATCLZSA-N	448.919	1.347	50	20	IDGD	
COc1cccc(Cl)c1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1830738943	VXBCOKIMBYZOAH-LIRRHRJNSA-N	447.315	1.018	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CN(C)C(=O)C(=O)O)CC1	1831160316	GJWSTEWXYBAJME-CVEARBPZSA-N	429.945	1.557	50	20	IDGD	
CCCNC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](Cl)CCC)C2)C1	1831195498	DEELRCWMHMUXIN-OXJNMPFZSA-N	431.961	1.157	50	20	IDGD	
O=C(CCBr)N1CCC([C@H]2CCCCN2C(=O)[C@@H]2CCCS2(=O)=O)CC1	1831280922	DGJJZMMNFFWXGE-CVEARBPZSA-N	449.411	1.968	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)C(C)(F)F)CCO2	1831686479	GVAIPAHUAPTBOM-SCLBCKFNSA-N	426.888	1.378	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cc(Cl)cnc3O)CC2)CC1)[C@@H](O)CCl	1833307035	LRQAAXASCYWUOE-INIZCTEOSA-N	445.347	1.226	50	20	IDGD	
CN1CCC[C@H]1C(=O)NC1CCN(C2CCN(C(=O)[C@](C)(Cl)CCl)CC2)CC1	1833622076	DNLXVMJKICHETB-FXAWDEMLSA-N	433.424	1.889	50	20	IDGD	
Cn1ccc(C(=O)N2CCC(N3CCC(NC(=O)CCBr)CC3)CC2)n1	1834421256	XOAJYFUJWMVBAX-UHFFFAOYSA-N	426.359	1.390	50	20	IDGD	
Cc1nccn1CC(=O)N1CCC(N2CCC(NC(=O)[C@@H](F)Br)CC2)CC1	1836413982	SPCWNSXZYFVAJH-QGZVFWFLSA-N	444.349	1.454	50	20	IDGD	
COc1cscc1C(=O)N1CCOC[C@@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1837713239	QKSPGNKPUWESMN-LJQANCHMSA-N	442.610	1.678	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](N)c3ccccn3)CC2)CC1	1837876050	YIXHEVUWEXFMLL-HKUYNNGSSA-N	438.956	1.334	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(OC)cc3F)C2)C1	1839147281	MDHZUGLSCGDTHM-OXJNMPFZSA-N	428.888	1.922	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc4ccoc34)CCO2)C1	1839588162	POGXJLJDGRNZBC-LAUBAEHRSA-N	436.892	1.757	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3csnc3C)C2)C1	1839962806	RGMXUVZBKGWUTM-RHSMWYFYSA-N	446.367	1.695	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(OC)cc3C)C2)C1	1840154307	RUINJVUDMDONPJ-RXVVDRJESA-N	440.924	1.327	50	20	IDGD	
COc1ccc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)cc1C	1840186638	MDFFXKBNESQUGS-HXUWFJFHSA-N	445.343	1.806	50	20	IDGD	
Cc1nccn1[C@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1	1840492258	JGUIVVKYUCUBBF-UZLBHIALSA-N	438.601	1.060	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(OC)ccc3F)CCO2)C1	1840687087	VWQZEYODORXZCE-JXFKEZNVSA-N	444.887	1.158	50	20	IDGD	
O=C(C(Cl)Cl)N1CCOC[C@]2(C1)CN(C(=O)[C@@]1(F)CCCC=C1F)CCO2	1840951387	LJSHLRQCKIKJFM-DLBZAZTESA-N	427.275	1.992	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](C(=O)N2CC3(CCCN3C(=O)C(C)(C)CCl)C2)C1	1841226748	CBCOCRHGNGAJFB-LSDHHAIUSA-N	443.972	1.683	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@](F)(C(=O)N2CC3(CCCN3C(=O)[C@H](O)CCl)C2)C1	1841351099	FZYWSNGTXMYTQT-YJYMSZOUSA-N	433.908	1.139	50	20	IDGD	
CS(=O)(=O)Cc1ncccc1C(=O)N1CCCC12CN(C(=O)CCBr)C2	1842240434	LAZDHIMOMCMBET-UHFFFAOYSA-N	444.351	1.228	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1cccc(N(C)C)c1)C2	1843416383	BRCVVURUBKUHAI-PCLIKHOPSA-N	436.516	1.704	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC12CN(C(=O)CCN1C(=O)c3ccccc3C1=O)C2	1846175675	LZZCIFXVZPRTBR-CYBMUJFWSA-N	448.317	1.660	50	20	IDGD	
CO[C@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)C(Cl)Cl)C1	1846386997	VAOLJYNYUMGKLX-NEPJUHHUSA-N	438.352	1.922	50	20	IDGD	
CC(=O)N[C@@H](C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl)c1cccc(Cl)c1	1847565775	XNRWAOLDROQOMK-LUKYLMHMSA-N	428.316	1.319	50	20	IDGD	
CC(=O)N[C@@H](CC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)c1cccs1	11329840	NPSCCNVJJCPHMF-IBGZPJMESA-N	443.573	1.675	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)cc1	16095362	JOXDUFWWBVXEAN-UHFFFAOYSA-N	428.470	1.803	50	20	IDGD	
C[C@H]1Cc2cc(C(=O)OCC(=O)NNC(=O)c3cccs3)ccc2N1S(C)(=O)=O	17161535	IHGMCKWWJFDGGO-NSHDSACASA-N	437.499	1.077	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)cc1OC	21190161	RYQNYPDSXKPWGR-UHFFFAOYSA-N	444.400	1.761	50	20	IDGD	
COc1ccc2nc(C)c(C(=O)NNC(=O)c3ccc(Cl)c(S(N)(=O)=O)c3)cc2c1	25955363	IURLMNFYDUDHRJ-UHFFFAOYSA-N	448.888	1.927	50	20	IDGD	
CCCC(=O)N1CCC[C@H](C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)C1	108316765	IAEPPFSELMTNNE-HNNXBMFYSA-N	427.505	1.777	50	20	IDGD	
CC(C)COC(=O)N1CCC(C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)CC1	726142988	WBHHPSSHTNQMIH-UHFFFAOYSA-N	425.507	1.356	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2ccc(C)c(OCC(=O)O)c2C)cc1OC	726155420	IXVMZYNUMJKBDQ-UHFFFAOYSA-N	438.458	1.407	50	20	IDGD	
CN(C)N(C(=O)c1ccc(S(=O)(=O)N2CCCCCC2)cc1)[C@H]1CCS(=O)(=O)C1	728177200	YVJRLHYFLDDVGA-KRWDZBQOSA-N	443.591	1.357	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNS(=O)(=O)c2ccc3c(c2)OCCO3)c1	728508761	YQHSYCVBHUVCPU-UHFFFAOYSA-N	443.275	1.852	50	20	IDGD	
CN(C(=O)CN1CCN(C(=O)NNC(=O)c2ccc(C#N)cc2)CC1)C1CCCCC1	728597163	ORYDAYZHNVYGDO-UHFFFAOYSA-N	426.521	1.321	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCC2(N3CCCC3)CCOCC2)nc1	729623349	KJNLENZKPPDPGG-UHFFFAOYSA-N	440.570	1.039	50	20	IDGD	
CC(=NNC(=O)Cc1cc(O)nc(S)n1)c1ccc(S(=O)(=O)N2CCCCC2)cc1	730587256	XRELAFFRBWGRHC-UHFFFAOYSA-N	449.558	1.728	50	20	IDGD	
C[C@@H]1CN(C(=O)OC(C)(C)C)CCN1C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	731683830	JZRKHDQBDWMZHC-OAHLLOKOSA-N	447.540	1.375	50	20	IDGD	
O=C(NCCc1cccs1)NNC(=O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1	732062246	DFAKAPGQQSCHHF-LBPRGKRZSA-N	437.503	1.896	50	20	IDGD	
COc1ccccc1CC(C)(C)C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	732950409	UHSYOUFDAYJLRT-UHFFFAOYSA-N	433.530	1.975	50	20	IDGD	
C[C@H](CS(C)(=O)=O)NC(=O)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1	733662568	NHNCZSFYLJFDSZ-UZLBHIALSA-N	444.557	1.377	50	20	IDGD	
N#Cc1ccc(N2C(=O)N[C@@H](CCC(=O)NNc3nc(-c4ccccc4)no3)C2=O)cc1	733775748	QELZYCMWOIPLDB-INIZCTEOSA-N	431.412	1.957	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNc3cnnc4ccccc34)CC2)cc1	733812170	VEKHJGRQMDMHKN-UHFFFAOYSA-N	440.529	1.388	50	20	IDGD	
CCCS(=O)(=O)Nc1cccc(C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)c1	734240047	IJUXMFMSYOTXLQ-UHFFFAOYSA-N	443.526	1.307	50	20	IDGD	
COc1cccc(C(=O)NCC(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)c1	734881202	IWBTVYGRLWHDRX-UHFFFAOYSA-N	449.508	1.155	50	20	IDGD	
Cn1cc(N2CC[C@@H](NC(=O)NNC(=O)c3ccc(COc4ccccc4)o3)C2=O)cn1	735513096	TXHBDNHYKJPIRG-QGZVFWFLSA-N	438.444	1.342	50	20	IDGD	
C[C@H](CN1CCN(c2ccccn2)CC1)NC(=O)NNC(=O)c1cnn(-c2ccccc2)c1	735517239	AIGVAAUTCFVWRA-GOSISDBHSA-N	448.531	1.422	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)N1CCC[C@H](C(=O)c2ccc(F)cc2)C1	738476634	ZIQLFMHYZZBWCU-AWEZNQCLSA-N	432.477	1.953	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc2c(c1)OCCCO2)NNc1cccc(C(F)(F)F)n1	740142361	OOMCVTRCBUSXEH-UHFFFAOYSA-N	446.407	1.683	50	20	IDGD	
COc1cc(C(=O)NNC(=O)N[C@@H]2CCC[C@H](S(C)(=O)=O)C2)ccc1OC(C)C	741093752	VBPMJFSPFZNAMF-CABCVRRESA-N	427.523	1.782	50	20	IDGD	
O=C(NNC(=O)c1c(F)cc(F)cc1F)c1cccc(S(=O)(=O)N2CCCC2)c1	741506448	GQTLAXXKEYVCPJ-UHFFFAOYSA-N	427.404	1.963	50	20	IDGD	
Cc1nc2c(C(N)=O)cnn2c(C)c1CCC(=O)NNC(=O)c1cccc2ccccc12	741572785	KNALGXLHIDUXPO-UHFFFAOYSA-N	430.468	1.992	50	20	IDGD	
Cc1nc(N2CCOCC2)nc(O)c1CCC(=O)NNC(=O)c1cccc2ccccc12	741575571	BHFVJNABZSPRIH-UHFFFAOYSA-N	435.484	1.874	50	20	IDGD	
CCCc1c(C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)nnn1-c1cccc(C(C)C)c1	741672737	PVXAQCAFJCOXTB-HNNXBMFYSA-N	448.549	1.474	50	20	IDGD	
Cc1nn(C)c2sc(C(=O)N[C@H](C)C(=O)NNC(=O)COc3ccccc3F)cc12	742032885	BAGPQACZGQGDCE-LLVKDONJSA-N	433.465	1.427	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)[C@@H](C)NC(=O)c1cc2c(C)nn(C)c2s1	742036083	DJBRLHUUUDPMQL-GFCCVEGCSA-N	439.501	1.479	50	20	IDGD	
Cc1nc(S(=O)(=O)NCC(=O)NNc2c(F)cc(F)cc2Br)cn1C	742108577	ZQMNHNOXBUUISF-UHFFFAOYSA-N	438.254	1.191	50	20	IDGD	
CC(C)N(C)S(=O)(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	742231801	YYJFUSBURVFLSV-UHFFFAOYSA-N	432.549	1.368	50	20	IDGD	
COc1cc(C(=O)NNC(=O)COc2ccc(C)cc2)cc(NS(C)(=O)=O)c1OC	742474987	RJDZDJIVNXJYRO-UHFFFAOYSA-N	437.474	1.224	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc2c3c(cccc13)C(=O)N2)c1cc([N+](=O)[O-])ccc1O	743268114	CVTRYSGAKANORQ-UHFFFAOYSA-N	428.382	1.643	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)NCc2nnnn2-c2ccccc2)cc1Cl	743600747	XTSZVFFZUADIAD-UHFFFAOYSA-N	446.855	1.869	50	20	IDGD	
CCCOc1ccc(C(=O)NNS(=O)(=O)c2cccc(-n3cnnn3)c2)cc1OC	743729195	CAHDHMINBKWZMG-UHFFFAOYSA-N	432.462	1.083	50	20	IDGD	
Cc1nc2cc(O)nn2c(C)c1CC(=O)NNC(=O)c1cc(Br)ccc1O	743733966	WPUQEEOOQWVYBE-UHFFFAOYSA-N	434.250	1.524	50	20	IDGD	
O=C(NNC(=O)C1CCN(S(=O)(=O)c2ccc3c(c2)CCC3)CC1)NC1CCCC1	744052707	PZDNNCLXTZLNMG-UHFFFAOYSA-N	434.562	1.849	50	20	IDGD	
O=C(CCN1C(=O)[C@H]2[C@H](C1=O)[C@H]1CC[C@H]2O1)Oc1ccc([N+](=O)[O-])cc1Br	744168161	KCGHMCVSBVHZMK-QHSBEEBCSA-N	439.218	1.815	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)CN2CCN(C(=O)Cc3ccccc3Cl)CC2)cc1	744391564	ZIQCMOODKNGBQG-UHFFFAOYSA-N	439.903	1.360	50	20	IDGD	
Cn1ncnc1COc1ccc(S(=O)(=O)NNC(=O)c2ccc3ccccc3n2)cc1	746590933	GIVCNQQWUUJUSP-UHFFFAOYSA-N	438.469	1.566	50	20	IDGD	
CN1C(=C(C#N)C(=O)COC(=O)c2ccc(CS(N)(=O)=O)cc2)N(C)c2ccccc21	746632771	XVQUCKCRQALMQR-UHFFFAOYSA-N	440.481	1.522	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)NCCNS(=O)(=O)c3cccs3)n[nH]2)cc1	747438313	RMHDQQASJJTLTO-UHFFFAOYSA-N	448.530	1.369	50	20	IDGD	
O=C(CCOC[C@H]1CCCO1)NNc1ccc(S(=O)(=O)Nc2nccs2)cc1	747943652	LBFRXEOMEUIXIP-CQSZACIVSA-N	426.520	1.973	50	20	IDGD	
O=C(Cn1c(=O)nc(O)c2ccccc21)NNc1nc(-c2ccccn2)nc2c1CCC2	748338101	CVTOETZNCYUCOE-UHFFFAOYSA-N	429.440	1.586	50	20	IDGD	
COc1cc(OC)cc(N2CC[C@H](NC(=O)NNC(=O)COCc3ccccc3)C2)c1	748662161	QGOXYVRUFKXQOW-KRWDZBQOSA-N	428.489	1.830	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)c3ccnn3C)c2)c(C)c1	748830640	CWVHJJDWIPGYES-UHFFFAOYSA-N	427.486	1.913	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)c1ccccc1)C(=O)NNC(=O)CCc1ccccc1	749851274	BVRIKVWWXRVNGC-SFHVURJKSA-N	435.571	1.867	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)c1cc(Cn2cc(Br)cn2)on1	751986881	IRBDFASEHMDCQI-UHFFFAOYSA-N	434.250	1.660	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNS(=O)(=O)c2cnc3ccsc3c2)ccc1Cl	753069860	XQVDNYJIQVIYNP-UHFFFAOYSA-N	446.919	1.220	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCC[C@H]2CCO[C@H](C)C2)cc1	753344547	KXWVPWCMINBXMU-CVEARBPZSA-N	426.539	1.151	50	20	IDGD	
COC(=O)c1c(Br)ccc(NC(=O)C(=O)NNc2ncc(F)cn2)c1C	753853875	WPYIFLVZMQLJII-UHFFFAOYSA-N	426.202	1.555	50	20	IDGD	
CN(CCN1C(=O)c2ccccc2C1=O)C(=O)NNC(=O)c1cc(Br)c[nH]1	754084042	CPTJRSLYTMGXCG-UHFFFAOYSA-N	434.250	1.360	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)/C(C#N)=C\c1ccc(O)cc1	754535684	IDBHPCLBENRZFD-JYRVWZFOSA-N	429.816	1.966	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)Nc2cccc(S(=O)(=O)N(C)C)c2)cc1OC	755366443	JWSLJWKIGMCZHW-UHFFFAOYSA-N	436.490	1.811	50	20	IDGD	
CCNC(=O)COc1cccc(NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1	755658486	YKFBFUVIOGIBTG-UHFFFAOYSA-N	441.492	1.061	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)Nc2ccc(F)c(S(=O)(=O)N3CCOCC3)c2)o1	756035096	ZIJXXSUCKKDGBE-UHFFFAOYSA-N	426.426	1.215	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)Nc2cc(S(N)(=O)=O)cc(C)c2C)o1	756639349	XENRXZPMSILGTB-UHFFFAOYSA-N	437.522	1.852	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1N1CCOC1=O	756844895	OWQPKSBTIQMCMS-UHFFFAOYSA-N	439.476	1.811	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)Nc2cccc(C(N)=O)n2)c2ccccc2c1=O	757738210	MBFGDRXIAKDMIA-UHFFFAOYSA-N	437.460	1.547	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)COc2ccc(Br)cc2)n1	758547702	QAWZVWPRLHKDRY-UHFFFAOYSA-N	442.291	1.526	50	20	IDGD	
CC1CCN([C@H](CNC(=O)NNC(=O)C(=O)Nc2ccccn2)c2cccs2)CC1	758669250	CNPGNRZLNBIMIO-OAHLLOKOSA-N	430.534	1.885	50	20	IDGD	
Cc1cc(Br)cn2cc(CNC(=O)NNC(=O)CNC(=O)c3ccco3)nc12	759258871	RGFQFCZZKPZXHA-UHFFFAOYSA-N	449.265	1.259	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@@H](C(=O)NNc3ncccc3[N+](=O)[O-])C2)s1	759289415	FGDUHDZZYGODTD-GFCCVEGCSA-N	425.492	1.904	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)Cc2cccc(I)c2)C[C@@H](C)O1	760988088	OGOSYLJRCNPESH-CHWSQXEVSA-N	445.301	1.480	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)c1ccc(S(=O)(=O)NC(C)(C)C)o1	761637374	RAXQCTLZEXUBBJ-UHFFFAOYSA-N	441.531	1.918	50	20	IDGD	
CCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)c(C)c1	763602219	XDTDJTAUGKQDCY-UHFFFAOYSA-N	434.456	1.535	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccnn2Cc2ccc(C)s2)cc1	763662004	RQSUPLPHMSZMCP-UHFFFAOYSA-N	443.485	1.475	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(-c3nccc(C)n3)cc2)cc1	763662629	YCYPOFRTRDIEJX-UHFFFAOYSA-N	435.440	1.626	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2cnn(-c3ccccc3F)c2)c1	763665103	FBBSYTRXBCJTBN-UHFFFAOYSA-N	425.420	1.793	50	20	IDGD	
O=C(COc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1cccnc1OCC(F)F	763684244	HTYABSOPTHLIOL-UHFFFAOYSA-N	428.779	1.544	50	20	IDGD	
O=C(NNC(=O)c1cccc(Cl)c1)C(=O)Nc1cnn(-c2cnc3ccccc3n2)c1	763747894	GWCVOXXSRFGGRX-UHFFFAOYSA-N	435.831	1.869	50	20	IDGD	
COC(=O)N(C)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(OC)cc(OC)c2)cc1	763771958	IYMOTQFQKCFMGK-UHFFFAOYSA-N	430.417	1.306	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)cc1C(=O)NC(C)C	763812030	BHILJGXQIPTIPL-UHFFFAOYSA-N	437.456	1.170	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(OC)c([N+](=O)[O-])c2)cc1	763865164	JCKIROGWPHNICG-LBPRGKRZSA-N	446.416	1.556	50	20	IDGD	
COC(=O)c1cccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(C(C)=O)cc2)c1C	763871077	DFKBXCCDTBSQHU-AWEZNQCLSA-N	441.440	1.538	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)C(=O)Nc2cccc(N3CCNC3=O)c2)cc1	763897783	GCYZLGCVCBFOCW-UHFFFAOYSA-N	427.486	1.403	50	20	IDGD	
Cc1cccc(C(=O)N2CCCC2)c1NC(=O)C(=O)NNC(=O)c1cc(Cl)ccc1O	763978237	GUPQBTBIEHYEFM-UHFFFAOYSA-N	444.875	1.990	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1ccc2c(c1)OC1(CCCC1)O2	764004260	OGIJUALQTYGCOV-UHFFFAOYSA-N	439.424	1.899	50	20	IDGD	
O=C(NNC(=O)C1CCCC1)C(=O)Nc1ccc(S(=O)(=O)c2ccc(F)cc2)cc1	764069609	YVQIXHZDSYSQLE-UHFFFAOYSA-N	433.461	1.935	50	20	IDGD	
O=C(NNC(=O)c1ccc(F)cc1Br)C(=O)Nc1cccnc1-n1cccn1	764083880	CDRUXXFFPBTACH-UHFFFAOYSA-N	447.224	1.569	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cnn(-c4ccncc4)c3)n[nH]2)cc1	764113260	VQIGXALTYZFRRC-UHFFFAOYSA-N	430.428	1.366	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1O)C(=O)Nc1cc2c(cc1Cl)OCCO2	764116870	JFUJUQMLMVWVEW-UHFFFAOYSA-N	426.212	1.870	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2O1)C(=O)Nc1cc(C2CC2)nn1-c1ccccc1	764151966	BAQHSXJCNCQFMD-LJQANCHMSA-N	431.452	1.839	50	20	IDGD	
O=C(Cc1ccccn1)NNC(=O)C(=O)Nc1ccc(NC(=O)NCc2ccco2)cc1	764264765	TVKHLTRURVPBIA-UHFFFAOYSA-N	436.428	1.325	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)c2c[nH]nc2C)sc2c1CC[C@@H](CC)C2	764298543	WDUVTYOXITYOGR-LLVKDONJSA-N	447.517	1.871	50	20	IDGD	
CN(CC(=O)NNc1c(F)cc(C(=O)NC2CC2)cc1F)S(=O)(=O)c1ccccc1	764328443	CIASFOXZTYDVLO-UHFFFAOYSA-N	438.456	1.621	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)C(=O)Nc1ccc(-n2nccc2C(F)(F)F)cc1	764386716	LARQHDYCTAWVAS-UHFFFAOYSA-N	432.362	1.994	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)c1nn(-c2ccc(F)cc2)ccc1=O	765319557	GEQPSFIQFXCZIT-UHFFFAOYSA-N	433.440	1.438	50	20	IDGD	
Cc1ccc(-c2n[nH]c(SCC(=O)NNC(=O)CNC(=O)c3cccs3)n2)cc1	765381939	LRKHFGOWORYSIY-UHFFFAOYSA-N	430.515	1.511	50	20	IDGD	
C[C@@]1(c2ccccc2)NC(=O)N(CC(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)C1=O	765565339	OOGGOKAVFKEURA-FQEVSTJZSA-N	438.469	1.366	50	20	IDGD	
O=C(CCCOc1cccnc1)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	765756608	ZMWWHPZBINLJHH-UHFFFAOYSA-N	445.951	1.859	50	20	IDGD	
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)NNC(=O)COc1ccccc1[N+](=O)[O-]	765892886	NBZFHKGMJDTYHY-RDJZCZTQSA-N	427.461	1.825	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)CCOc3ccc(C=O)cc3)CC2)cc1	766647725	VOJDJUBABNKTRY-UHFFFAOYSA-N	438.528	1.542	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)[C@H]1Cc2ccccc2O1	766661841	ZHYCCHNOZIXKGT-HXUWFJFHSA-N	428.920	1.609	50	20	IDGD	
COc1cc2c(cc1OC)CN(C(=O)CCC(=O)NNC(=O)c1ccccc1O)CC2	767825416	UUOXRJMTKAADKS-UHFFFAOYSA-N	427.457	1.536	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)[C@H]3CCCN3C(=O)c3ccccc3O)nc21	771008892	MYCHJHXAJGCLRK-CQSZACIVSA-N	439.476	1.740	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)NCc1nc(COc2ccccc2)n[nH]1	771375966	HZUNTJGKQHBKHH-UHFFFAOYSA-N	428.474	1.712	50	20	IDGD	
COc1ccc([C@H](OC)[C@@H](C)NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1	771966282	WVRYPFYAOPGECS-DNVCBOLYSA-N	442.520	1.808	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)c1cc(Br)ccc1O	772888531	KGUAWHVENGHWRA-UHFFFAOYSA-N	426.654	1.886	50	20	IDGD	
NC(=O)C1CCN(Cc2cccc(NC(=O)C(=O)NNc3c(F)cccc3F)c2)CC1	773714301	RTAYGMGXSWOYTN-UHFFFAOYSA-N	431.443	1.744	50	20	IDGD	
CC[C@@H](CSC)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	775462305	NYWDZDRFZMSNSA-HNNXBMFYSA-N	428.580	1.947	50	20	IDGD	
CN(NC(=O)CNC(=O)CC1CCCC1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776206139	PJRXFCZUOCHBDM-UHFFFAOYSA-N	425.530	1.319	50	20	IDGD	
CCN(C)C(=O)CNC(=O)NNc1ccc(S(=O)(=O)NC2CCCCCCC2)cn1	776257900	INVXFHYPNHCJBS-UHFFFAOYSA-N	440.570	1.577	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)N[C@@H]1CCN(c2ccc(Cl)cc2)C1	776316773	LSAUZKDYXVMBTK-OAHLLOKOSA-N	426.868	1.539	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNS(=O)(=O)c2cc(C(=O)OC)oc2CC)cc1	778557262	VRBUCFZLEHGPOH-GFCCVEGCSA-N	440.474	1.804	50	20	IDGD	
CCOCCCn1c(NNC(=O)CNC(=O)c2cccc(O)c2)nc2ccccc2c1=O	778835557	ITMLUCGVYNMGME-UHFFFAOYSA-N	439.472	1.402	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)N[C@@H]2CCCN(c3ccc(C#N)cc3)C2=O)nc2ccccc21	780903093	PPOZNBGFNQACBJ-GOSISDBHSA-N	445.483	1.513	50	20	IDGD	
COc1ccc(C[C@H](C)C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1OC	781237609	DXLUAPKTWNLCPR-AWEZNQCLSA-N	449.529	1.594	50	20	IDGD	
COc1ccc(NNC(=O)C2CCN(S(=O)(=O)c3cccnc3Cl)CC2)nc1	781516265	PDYVPKGPKOTNDR-UHFFFAOYSA-N	425.898	1.683	50	20	IDGD	
COc1cccc(Cn2nccc2NC(=O)C(=O)NNc2ncncc2Cl)c1OC	782158936	KMACZUBYHGCXQE-UHFFFAOYSA-N	431.840	1.474	50	20	IDGD	
CC[C@@H](C)NS(=O)(=O)c1cccc(NC(=O)C(=O)NNc2ncncc2Cl)c1	782165929	LYHJWLOZQALHIQ-SNVBAGLBSA-N	426.886	1.289	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2cc(-c3cnn(C)c3)ccc2F)n1	782410042	ADSBAFWXGOFLEX-UHFFFAOYSA-N	431.449	1.538	50	20	IDGD	
CC(C)c1ccc(N2Cc3ccc(NC(=O)C(=O)NNC(=O)C(=O)NC4CC4)cc3C2)cc1	782967767	XIRIVSUHZXHUFU-UHFFFAOYSA-N	449.511	1.695	50	20	IDGD	
NC(=O)C1CCN(Cc2cccc(NC(=O)C(=O)NNc3ccc(F)cc3F)c2)CC1	783347001	DOTDSRIUBFUVFN-UHFFFAOYSA-N	431.443	1.744	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2cccc(S(N)(=O)=O)c2)ccc1Br	783922244	ADPGDDFOQQCOET-UHFFFAOYSA-N	427.280	1.487	50	20	IDGD	
Cc1coc(-c2ccc(C)c(NC(=O)C(=O)NNC(=O)CNC(=O)c3ccco3)c2)n1	784002947	XRMKCGKTJUCXFU-UHFFFAOYSA-N	425.401	1.067	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2CO[C@H](C)C2)c1	784147031	WSRQOAAMUIRUHX-HIFRSBDPSA-N	433.486	1.682	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1cnc(C(C)(C)C)nc1	784833190	KHONNIMQCSUADQ-UHFFFAOYSA-N	448.549	1.933	50	20	IDGD	
CC(=O)N1CCN(c2cccc(NC(=O)C(=O)NNc3cc(F)c(F)cc3F)c2)CC1	784895840	MGQIXJVHBIQJJK-UHFFFAOYSA-N	435.406	1.854	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)Nc1cccc(C#Cc2ccccn2)c1	785022891	ABEOXBNFCCOLGE-UHFFFAOYSA-N	445.391	1.495	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2cc(Cl)ccc2C(=O)N(C)C)n1	785225171	FTGDUODEEJFNHT-UHFFFAOYSA-N	433.900	1.760	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2nn(-c3ccc(C#N)cn3)cc2C)n1	785232651	JLABQVAREIFRLA-UHFFFAOYSA-N	434.464	1.165	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)[C@@H]2[C@H](C(F)(F)F)[C@H]3CC[C@H]2O3)cc1OC	785803793	NCTCHXPOPSTSPW-AVRGHOLYSA-N	446.378	1.364	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccnc1-c1cnn(C)c1	786413886	IEKORYWMFWKBNW-UHFFFAOYSA-N	438.444	1.046	50	20	IDGD	
CCNC(=O)Nc1ccc(C)c(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)c1	787542532	MOFMQXGVLUXXJK-KRWDZBQOSA-N	425.445	1.226	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)CCC(=O)Nc1ccc2nc(O)[nH]c2n1	787863579	FMPKHLFKNWTNBY-UHFFFAOYSA-N	432.824	1.505	50	20	IDGD	
CCCn1nc(C(=O)NNS(=O)(=O)c2cnc3ccccc3c2)c2ccccc2c1=O	788139793	OJEUIIDASOPBPD-UHFFFAOYSA-N	437.481	1.978	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@H](C(=O)NNc2nnc(-c3ccccn3)s2)[C@H](C)O)cc1	788558643	SBHFZPYELMXHLT-WFASDCNBSA-N	448.530	1.080	50	20	IDGD	
CC[C@H](C)[C@@H](C(=O)NNC(=O)c1ccc2c(c1)OCCO2)N1C(=O)c2ccccc2C1=O	791014183	JCFDLUXNWGCUAW-DJJJIMSYSA-N	437.452	1.930	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)n1ccc2ccccc2c1=O	791198049	YBRWDFZDSLMOLJ-AWEZNQCLSA-N	442.497	1.274	50	20	IDGD	
O=C(NNC(=O)[C@@H](O)Cc1ccccc1)c1ccccc1NS(=O)(=O)c1cccs1	792853190	RLRUJJJECYUCJC-KRWDZBQOSA-N	445.522	1.914	50	20	IDGD	
CN(C)N(C(=O)c1csc(CCNC(=O)OC(C)(C)C)n1)[C@H]1CCS(=O)(=O)C1	792855915	VFNSDXHZRNUMRF-LBPRGKRZSA-N	432.568	1.316	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)N[C@@H](CO)c1ccccc1OC(F)(F)F	792881661	JQIDLIJQFQGPFW-NSHDSACASA-N	446.407	1.441	50	20	IDGD	
CC(C)c1ncc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)NC(C)(C)C)cn1	796988243	BKKHWKRLIKOHGI-UHFFFAOYSA-N	434.522	1.759	50	20	IDGD	
Cc1ccc(N2CCOCC2)cc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccc(F)cc1	797535292	LFVMTYAEKMGLQR-HNNXBMFYSA-N	444.463	1.524	50	20	IDGD	
CCOC(=O)[C@@H](C)NC(=O)c1ccc(NC(=O)NNC(=O)c2cccc(C)n2)cc1F	797631434	RGIOVMWASZZQKO-GFCCVEGCSA-N	431.424	1.677	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CN(C[C@@H]2CCCO2)C(=O)OC(C)(C)C)cc1C	798308927	RDNMHTXZRCLBKZ-KRWDZBQOSA-N	448.520	1.805	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1)C(=O)NCCF	799904773	RJTABTWNIDVXOW-JXFKEZNVSA-N	441.507	1.418	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)NCCS(=O)(=O)CCc2ccccc2)cc1	800061518	DUGQQJQEQTUXKR-UHFFFAOYSA-N	433.534	1.746	50	20	IDGD	
CS(=O)(=O)c1ccc(C(=O)NNC(=O)CSc2ccccc2O)cc1[N+](=O)[O-]	801180434	XNJVFHQHCXVIIT-UHFFFAOYSA-N	425.444	1.257	50	20	IDGD	
COc1ccc(C2=NO[C@@H](CNC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)C2)cc1F	802341049	BEDVYCNLNODEGL-CQSZACIVSA-N	431.380	1.880	50	20	IDGD	
Cc1c(/C=C(\C#N)C(=O)N2CCc3c(cccc3S(=O)(=O)N(C)C)C2)cc(C#N)n1C	803535064	QMHPZLARNURHRZ-VCHYOVAHSA-N	437.525	1.947	50	20	IDGD	
C[C@H](C(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)n1ccc2ccccc2c1=O	805628045	FMKSUFZDDOYYTE-CYBMUJFWSA-N	438.396	1.475	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NC[C@@H](N2CCOCC2)C(F)(F)F)ccc1OC(C)C	805844891	OPWQHDSQTGYSJQ-MRXNPFEDSA-N	448.442	1.690	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)CC(F)(F)F)c(C)cc1Br	806976164	HDMVQEYBVVNZGJ-UHFFFAOYSA-N	440.172	1.582	50	20	IDGD	
COC(=O)c1cc(C)c(NC(=O)C(=O)NNC(=O)c2ccc(OC)cc2OC)c(Cl)c1	806978650	IGPQODLRSHYTSV-UHFFFAOYSA-N	449.847	1.852	50	20	IDGD	
Cc1ccc([C@H](CNC(=O)NNC(=O)c2cc(Br)c[nH]2)N2CCOCC2)o1	807023774	SXBKGERZXOVLNB-AWEZNQCLSA-N	440.298	1.696	50	20	IDGD	
O=C(NCCc1cc(Cl)c2c(c1)OCCO2)NNC(=O)[C@H]1COc2ccccc2O1	807026248	MNRSXSNFHYRZHY-QGZVFWFLSA-N	433.848	1.824	50	20	IDGD	
CS(=O)(=O)C1(CNC(=O)NNC(=O)c2cc(F)ccc2Br)CCCC1	807536286	REJZOTVJLLWGQM-UHFFFAOYSA-N	436.303	1.890	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)CNS(=O)(=O)c2ccccc2C(F)(F)F)c1O	810191132	PLAVUJMKSSTJRO-UHFFFAOYSA-N	447.391	1.159	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(Oc2ccc(Cl)cc2)cc1)[C@H]1CCS(=O)(=O)C1	811678848	DKLUBXUJZDKKAK-LBPRGKRZSA-N	444.918	1.877	50	20	IDGD	
CO[C@@H]1CCOc2c(NC(=O)C(=O)NNc3ccc(S(=O)(=O)N(C)C)cc3)cccc21	813034054	WNMZZUXRHLHBGF-QGZVFWFLSA-N	448.501	1.489	50	20	IDGD	
Cn1nncc1NNC(=O)C1CCN(S(=O)(=O)c2c(Cl)cccc2Cl)CC1	816770089	JHTOFROVEXNHSJ-UHFFFAOYSA-N	433.321	1.666	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cc(S(=O)(=O)N(C)C)ccc2F)cc1OC	859305870	RFFTWAQYJUTRKO-UHFFFAOYSA-N	425.438	1.168	50	20	IDGD	
O=C(COC(=O)CCCOc1ccc(F)cc1)NNC(=O)[C@H]1COc2ccccc2O1	875620696	QCIBLOOMMDQGTH-GOSISDBHSA-N	432.404	1.515	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1	913263088	VTGHUQAZUXWSIN-UHFFFAOYSA-N	431.392	1.633	50	20	IDGD	
COCCS(=O)(=O)CC(=O)NNC(=O)c1cc(-c2ccccc2)nc2ccccc12	915635312	GZXNXOFULCOYLP-UHFFFAOYSA-N	427.482	1.724	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)[C@@H](Cc2cccc(F)c2)n2nnnc2C)c1	915695216	CMDWEIGLJZEYNR-LJQANCHMSA-N	426.452	1.748	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)CNS(=O)(=O)c2cccc(C#N)c2)c1C	915787683	HZPCAMMYMHKTFD-OAHLLOKOSA-N	430.486	1.068	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)NCc2ccc(N3CCOCC3)nc2)cc1C	916234880	SJNNGJHLSDWYRJ-UHFFFAOYSA-N	426.477	1.004	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NN=Cc1cccn1C)N(S(C)(=O)=O)CC2	916356614	YBCQUCICHLEMSY-KRWDZBQOSA-N	434.518	1.442	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)CS(=O)(=O)Cc2ccc(Cl)s2)cc1	916534239	HCQSXBGSSWRDBB-UHFFFAOYSA-N	444.918	1.629	50	20	IDGD	
CCOc1ccccc1OCC(=O)NN=Cc1c(C)nn([C@@H]2CCS(=O)(=O)C2)c1C	917026831	PIOFFUCDWDCLQK-MRXNPFEDSA-N	434.518	1.787	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(OC)c(C(=O)NNC(=O)c2ccc(Cl)nc2)c1	917252684	WSTDQBSAOUVXFU-UHFFFAOYSA-N	440.909	1.849	50	20	IDGD	
COC(=O)N(C)CC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	917363616	VJAPMBNQZKVNDP-UHFFFAOYSA-N	426.476	1.008	50	20	IDGD	
CC[C@@H](C)NC(=O)CCNC(=O)NNC(=O)[C@H](C)Oc1cccc(Br)c1	918085416	VEIAYOUSLBDJLD-NEPJUHHUSA-N	429.315	1.852	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)c2ccc3c(c2)C(=O)N(C[C@H]2CCCO2)C3=O)c1O	919756699	IEOMFYROLYFLRC-CYBMUJFWSA-N	439.424	1.251	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)c1cc(S(N)(=O)=O)ccc1Br	919822809	LDFBOJGXKYXQQK-UHFFFAOYSA-N	442.291	1.109	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@@H](C)CN2CCC[C@@H](C)C2)cc1	919914491	HKYBTNYKMXOEFA-SJORKVTESA-N	439.582	1.066	50	20	IDGD	
COc1ccc(-n2ccc(CNC(=O)NNC(=O)C(=O)Nc3ccc(C)c(C)c3)n2)cc1	919916110	BYLQYQYUTCTWLQ-UHFFFAOYSA-N	436.472	1.967	50	20	IDGD	
O=C(NC[C@H]1CCN(c2ccc(F)cc2)C1)NNC(=O)c1csc(N2CCOCC2)n1	920046165	IKULYFFAEGVCPN-CQSZACIVSA-N	448.524	1.589	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Cc2cc(OC)ccc2OC)c1	921188373	ATMXGZCYRXTLRV-UHFFFAOYSA-N	449.529	1.738	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)CCCC[C@@H]1SC[C@H]2NC(=O)N[C@@H]21	921303947	HGMMZPVKQVHNAS-INWMFGNUSA-N	426.926	1.835	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)NCc2nnc3n2CCCCC3)CC1	1251919014	KPPJBWOHIKQXBE-UHFFFAOYSA-N	435.529	1.482	50	20	IDGD	
C[C@@H](C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1)c1ccc(F)c(F)c1	1318764284	HRBCDAPWHDJYNN-CYBMUJFWSA-N	439.488	1.543	50	20	IDGD	
C[C@H]1CN(C(=O)c2ccc(CNC(=O)NNc3nncc(N)c3Cl)cc2)C[C@H](C)O1	1319308709	DHZUDKOUIZKRGH-RYUDHWBXSA-N	433.900	1.788	50	20	IDGD	
Cn1c(C(=O)O)cc(Br)c1C=NNC(=O)COc1ccccc1[N+](=O)[O-]	1321888067	ZQQANAZLBJMVAD-UHFFFAOYSA-N	425.195	1.923	50	20	IDGD	
O=C(NCc1ccc(F)cc1)c1nccnc1C(=O)NNc1ccc(-n2ccnc2)nn1	1322607770	GABGORXYGWAEBD-UHFFFAOYSA-N	433.407	1.278	50	20	IDGD	
Cn1ncc2cc(S(=O)(=O)NNC(=O)c3cc(F)ccc3Br)cnc21	1338372457	CSUHXZUZIDGVFM-UHFFFAOYSA-N	428.243	1.493	50	20	IDGD	
C[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCO[C@@]2(CCN(C(=O)CO[Si](C)(C)C)C2)C1	1779294893	RDGXFUOTXGNNIN-MGPUTAFESA-N	443.617	1.581	50	20	IDGD	
Cc1cc2nc(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)[C@H](O)CCl)C4)[nH]c2cc1C	1779295552	IVHUOUPJMVHFTJ-JBYIUTFZSA-N	448.951	1.907	50	20	IDGD	
COc1cccc(OC)c1C(=O)N1CC[C@@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1780538957	NASHEWIQBLWGNS-OAQYLSRUSA-N	436.581	1.999	50	20	IDGD	
CCn1nccc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Br)C1	1780771095	BYUDNCMTHSZBLE-CKEIUWERSA-N	431.306	1.721	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3nn(C)c(C)c3Br)CCO2)C1	1781219462	ZIFPJEAARQBFRI-YVEFUNNKSA-N	447.761	1.952	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)c3n[nH]c4c3CCCC4)CCO2)C1	1781228204	ZOKBPBPUNZDFPH-RBUKOAKNSA-N	429.348	1.968	50	20	IDGD	
CCn1nc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](Cl)COC)C2)cc1C	1782173728	NNSHIERZEZIRKA-XAUMDUMWSA-N	426.945	1.593	50	20	IDGD	
Cc1cc(F)cc(CC(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](O)CCl)C3)c1	1782279567	BATKHIZTSLDKHQ-DBXWQHBBSA-N	426.916	1.790	50	20	IDGD	
Cc1c(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)nc2ccc(Cl)cn12	1782493699	VHSYSLFLGUROEU-KUHUBIRLSA-N	441.315	1.339	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cnn4ncccc34)CCO2)C1	1783347603	MUZBYBGQJQUDCR-KDOFPFPSSA-N	436.310	1.346	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(Cl)nn3)CCO2)C1	1783349659	QOLOJDFTQRODAQ-ZBEGNZNMSA-N	431.718	1.747	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccccc3C(N)=O)CCO2)C1	1783351556	BVNOIWFIGPAMMF-DNVCBOLYSA-N	438.322	1.403	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H]2C[C@@]2(C(=O)N2CC[C@@]3(CN(C(=O)[C@H](F)Cl)CCO3)C2)C1	1783460291	XOGSMHWYXNIUKR-RYMBOPBQSA-N	445.919	1.608	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc4c(c3)NC(=O)CC4)CCO2)C1	1783880646	GNZAPWAYNGRBAA-HRAATJIYSA-N	435.908	1.269	50	20	IDGD	
O=C(/C=C/c1ccc(O)c(O)c1O)N1CCO[C@@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783951334	FURXIVUGCFLQRF-BWDYHRDRSA-N	431.272	1.450	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/c3cnccn3)C[C@@H]21	1783974426	NUFKEUUVRIHLIW-SWVGCBKASA-N	437.338	1.501	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CC[C@H]3CNc4ccccc4C3)C[C@@H]21)[C@H](O)CCl	1784090233	VFAZPHIOPHESIP-ITXZTEAGSA-N	449.979	1.630	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(Cl)nc3Cl)C[C@@H]21)[C@H](O)CCl	1784091406	SMHODAYPYCXWEI-SYEHKZFSSA-N	436.723	1.581	50	20	IDGD	
Cc1nccn1CCCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](C)Br)CCO2	1784412017	PMSMSEGDFPBZOG-KSSFIOAISA-N	427.343	1.585	50	20	IDGD	
CC[C@@H](Br)C(=O)NC1(c2ccc(NC(=O)[C@@H](N)CCC(N)=O)cc2)CCC1	1787978144	NAILLSVWTDEKSO-CABCVRRESA-N	439.354	1.887	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)[C@@H](F)Br)CCC2)cc1)c1cccc(B(O)O)c1	1788150549	XBOBQQQLAYJFFX-MRXNPFEDSA-N	449.085	1.805	50	20	IDGD	
Cc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]32)cc1F	1789520249	FITRAPNCFCDTQA-LNLFQRSKSA-N	434.512	1.100	50	20	IDGD	
Cc1nn(C)c(C)c1CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]2C1	1789873370	VMIZQALVOWPYMT-JWWIWJDOSA-N	445.391	1.795	50	20	IDGD	
COC(=O)C12CC(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]43)(C1)C2	1791016324	YRNRLTFRXCPMPD-VYCBZTLZSA-N	447.359	1.546	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](C)Br)[C@H]3C2)c(O)n1	1791058663	AOPVEBVEKKYKIJ-JURCDPSOSA-N	426.311	1.472	50	20	IDGD	
O=C(Cc1cnc2ccccn12)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2	1792934805	PPTPALWSMUMBEC-LZDSYCOUSA-N	439.285	1.157	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CCN1C(=O)OC(C)(C)C	1793630882	XNMHZRXCOOFITM-BPKGMFCQSA-N	443.972	1.993	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC=C(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Cl)C3)C1	1793873522	YNOYHQAXYCXTIW-FZKCQIBNSA-N	445.919	1.678	50	20	IDGD	
Cc1ccccc1OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2	1795306431	ZOCWKIBTEHHGSU-DLTLXFJOSA-N	429.286	1.654	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCBr)[C@H]1CC[C@H]2CCC(=O)N2C1	1795495559	ZRKFFSYVDOCXGA-GVRJEKJASA-N	426.355	1.811	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)c1cccc(F)c1Cl	1796191765	VGVOJJCCOWLKPA-MUJYYYPQSA-N	430.672	1.725	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)nc2ccccc12	1796916012	RAHVWGOISAXECI-UESRRSCYSA-N	433.892	1.397	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Br	1799347836	XFSXWVDGZUDXAZ-SSRBZLIGSA-N	430.112	1.440	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cn3ccsc3n1)C2)[C@@H](F)Br	1799350039	QDWNERSDGMEVDK-RBLKWDMZSA-N	431.287	1.290	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCNC(=O)OC(C)(C)C	1800170565	SUIKZHKLCFJPEY-QRJUGERDSA-N	431.961	1.918	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](O)Cc1ccccc1	1800632365	OAXSPVPFEZCKOJ-SOVHRIKKSA-N	439.350	1.211	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cn3ncccc3n1)C2	1800640619	BZWBCRNTZYHFEX-ZWUHOBOKSA-N	436.310	1.106	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3cnccc3nc1C)C2	1800977334	XAXVQPUOIOMMQG-HIRMHNASSA-N	432.908	1.395	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccnn1-c1ccccc1)C2	1802336640	ROMDNIHPYJVBLG-GGPHIMKMSA-N	438.532	1.497	50	20	IDGD	
CNC(=S)NCCC(=O)N1CC[C@H](CNC(=O)C(C)(C)CCl)[C@@H]1c1cccnc1	1802900712	DVQYLRSAOSTXQT-WBVHZDCISA-N	440.013	1.836	50	20	IDGD	
Cc1noc(C)c1CCC(=O)N1CCCC2(CCN(C(=O)CCC(=O)NN(C)C)CC2)C1	1807135235	ZMVIPUWFPPSIBO-UHFFFAOYSA-N	447.580	1.828	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CCc2ccco2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807362607	LPZHLRMJPNWSRC-WMZHIEFXSA-N	447.300	1.307	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)c(C)o1	1807365055	WMEVQANMRGFLHS-UGKGYDQZSA-N	447.300	1.605	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)C(Cl)Cl)[C@H]1c1cccnc1)c1cccn2c(O)nnc12	1808193843	GKAQVYQFPOVLFG-OCCSQVGLSA-N	449.298	1.953	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CS(=O)(=O)N2CCCC2)[C@@H]1c1cccnc1)[C@H](F)Cl	1808313349	WRTNUKPQDWDITE-UAGQMJEPSA-N	446.932	1.047	50	20	IDGD	
CC(=O)NCCC(=O)N1CC[C@H](CNC(=O)[C@@H](F)Br)[C@H]1c1cccnc1	1808678333	HPFSCFSNLGQJDH-FVQBIDKESA-N	429.290	1.304	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)C3Cc4ccccc4C3)CC2)C1	1809972678	MVIFVVNFMJTPGI-UHFFFAOYSA-N	446.356	1.626	50	20	IDGD	
CCN(CC)C[C@H](C)C(=O)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1	1809979964	HICNUEFMARHMGH-IBGZPJMESA-N	443.397	1.189	50	20	IDGD	
C[C@H](Cn1cncn1)C(=O)NC[C@@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1	1810474628	DVBLILLJMFWZKS-UWWQBHOKSA-N	449.353	1.800	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H](CNC(=O)[C@H]2CNC(=O)C2)[C@@H]1c1cccnc1	1812635454	IVAMSUKIIWYFFF-MMTVNHQJSA-N	437.338	1.255	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)[C@H]2CNC(=O)C2)[C@@H]1c1cccnc1	1812778657	JBFMZQLZYTYSMY-QSJFSLAZSA-N	437.338	1.397	50	20	IDGD	
Cc1ocnc1C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1813074744	WMXAARBFKQTADM-UZLBHIALSA-N	428.493	1.071	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CNC(=O)N(C)C)n[nH]1	1814562323	LURCENQDPLKKEG-AAEUAGOBSA-N	443.346	1.704	50	20	IDGD	
Cc1ncsc1C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1	1815339613	JZZZLDCTZGXRAK-CYBMUJFWSA-N	442.331	1.127	50	20	IDGD	
O=C(C#Cc1ccccc1)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1	1815355202	RBMZEWIHGPEGPX-GOSISDBHSA-N	445.309	1.100	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H]1CCCSC1)CC2)c1cccc(B(O)O)c1	1815362002	XYQFRSGRKUQKKX-HIFRSBDPSA-N	445.375	1.192	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)CS(=O)(=O)N3CCCC3)sc2C1	1817276109	QKGPTQGOKQCJDA-NEPJUHHUSA-N	448.998	1.498	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)C(Cl)Cl)[nH]n1)c1ccc(B(O)O)cc1	1817475947	WNVREVOYGKJORB-CYBMUJFWSA-N	425.081	1.199	50	20	IDGD	
COCCn1nccc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](Cl)COC)[nH]n1	1818251513	OMFZRAKYFYXGEZ-DZGCQCFKSA-N	438.916	1.812	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](O)CCl)CC2)c1cccc2c1OCCO2	1818311725	UUEGNPLQRNEIEM-GWCFXTLKSA-N	437.905	1.740	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](C)N3C[C@H]4C[C@H]4C3)sc2C1	1819579505	FJIKDRJMOGYADN-RGDJUOJXSA-N	426.970	1.649	50	20	IDGD	
CC(=O)C[C@@H](C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1822345317	XBVMTNWRKJZHNT-PXAZEXFGSA-N	441.492	1.329	50	20	IDGD	
C[C@H](Cn1ccnc1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1	1822416415	CWNPLACZTJBCFU-NVXWUHKLSA-N	444.540	1.308	50	20	IDGD	
Cc1cc(C(=O)NCC(=O)N2CCCC[C@@H]2c2cc(NC(=O)C(Cl)Cl)n[nH]2)no1	1822423751	KCDHBUNGAAXHEG-GFCCVEGCSA-N	443.291	1.932	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H]2CNC(=O)O2)CC1	1824089817	QSGYIDSZQNGPOA-QEJZJMRPSA-N	430.343	1.746	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)Cn1cc(Cl)cn1)CC2	1825998330	FLGOWSLJHQYZKB-GHMZBOCLSA-N	432.333	1.859	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)C(C)(C)NCCC#N)CC2	1825999668	SVPFZYJLJJSQAU-VXGBXAGGSA-N	427.958	1.591	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3cccc([N+](=O)[O-])c3)CCO2)C1	1829625999	ZWIDUAMRRRFNIU-XLIONFOSSA-N	439.896	1.611	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccnc3S)CCO2)C1	1829800446	YJLAZGZAKVYIQF-YVEFUNNKSA-N	444.351	1.224	50	20	IDGD	
O=C(c1cc(Cl)ccc1F)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1	1830183392	OHYRJQNTDOICIK-QAPCUYQASA-N	435.279	1.149	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)COc3ccc(O)cc3)CCO2)C1	1830345659	CJDKHHADGJMHNW-PXNSSMCTSA-N	426.897	1.245	50	20	IDGD	
Cc1occc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2	1830537777	OEGCCRGOMFKLMK-SCLBCKFNSA-N	429.311	1.689	50	20	IDGD	
O=C(C(Cl)Cl)N1CCOC[C@]2(C1)CN(C(=O)C1(c3ccc(O)cc3)CC1)CCO2	1830813402	YTHQVKILWNMDPE-IBGZPJMESA-N	443.327	1.684	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)C(=O)c3ccco3)CCO2)C1	1832663956	IWEUFSBBPHWTKZ-ZWKOTPCHSA-N	433.288	1.155	50	20	IDGD	
C[C@@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)c3ccn(C)n3)CC2)CC1	1833262512	RMHFWRXWCJJJSO-AWEZNQCLSA-N	440.386	1.636	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CCC(N3CCC(NC(=O)[C@H](O)CCl)CC3)CC2)o1	1833312607	RVCFEKKBRHEBFU-MRXNPFEDSA-N	440.928	1.023	50	20	IDGD	
C[C@@H](CC(N)=O)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)CBr)CC2)CC1	1833517999	VRABNFDCJCYWPS-KBPBESRZSA-N	445.402	1.101	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)CCc3cn[nH]c3)CC2)CC1	1833814304	XARSSBYFICLUNY-GOSISDBHSA-N	425.961	1.168	50	20	IDGD	
O=C(Cc1ccccc1F)NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1834488332	JHHLOSOGVIBGTH-LJQANCHMSA-N	425.932	1.540	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)[C@@H]3CCC(=O)N3)CC2)CC1	1834526659	OCSZNDSAGZLYHL-HOTGVXAUSA-N	443.386	1.010	50	20	IDGD	
COc1ccc([C@@H](O)C(=O)N2CCC(N3CCC(NC(=O)[C@@H](F)Cl)CC3)CC2)cc1	1835078164	TYAGTNDFUZLGAL-RTBURBONSA-N	441.931	1.835	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC(N2CCC(NC(=O)c3ccncc3O)CC2)CC1	1835875818	HBINNHBMAXSRLB-UHFFFAOYSA-N	434.613	1.824	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3cscn3)CCO2)C1	1836044588	BBEDMINJXCQUAO-PBHICJAKSA-N	446.367	1.316	50	20	IDGD	
CN(C)c1ccc(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)cc1	1836294784	OCXIJPVWUPLGPC-FQEVSTJZSA-N	436.984	1.538	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)[C@H]3C[C@@H]3C3CC3)CC2)CC1	1836662358	ZANNMUXYBBFPOB-UXHICEINSA-N	434.581	1.404	50	20	IDGD	
O=C([C@@H](O)CCl)N1CCC(OC2CCN(C(=O)C3(C(F)(F)F)CC3)CC2)CC1	1836717164	LBQYOSHFDPJESU-AWEZNQCLSA-N	426.863	1.927	50	20	IDGD	
Cc1cc(C(=O)N2CCC(OC3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)c(C)n1C	1836718207	KNPLLIYVDGPPIJ-IBGZPJMESA-N	425.957	1.854	50	20	IDGD	
O=C(c1ccc2[nH]ccc2n1)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1836909109	QRCBJBDKAZJFDY-GOSISDBHSA-N	427.288	1.437	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc4n(n3)CCCC4)CCO2)C1	1836973846	IUFIMYMMLSEBHE-NRFANRHFSA-N	438.956	1.554	50	20	IDGD	
O=C(CCBr)N1CCC(OC2CCN(C(=O)c3ccnnc3)CC2)CC1	1837426179	MYQZXPVITPYASV-UHFFFAOYSA-N	425.327	1.874	50	20	IDGD	
COCCOCC(=O)N1CCC(OC2CCN(C(=O)CCBr)CC2)CC1	1837651950	UZLATZRAAMBIDL-UHFFFAOYSA-N	435.359	1.433	50	20	IDGD	
Cc1ccc(CC(=O)N2CCOC[C@@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)cc1	1837712524	XCOBSDYQGJJRPB-QFIPXVFZSA-N	434.609	1.845	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ncccc3F)CCO2)C1	1838251656	GBOLFZPZEVRNBZ-FZKQIMNGSA-N	444.301	1.464	50	20	IDGD	
Cc1nc(F)ccc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1	1838267695	BABKURLNKSDGIA-RTBURBONSA-N	448.322	1.835	50	20	IDGD	
CC(C)n1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)n1	1838780593	JWJKRVVOPUUGSZ-FQEVSTJZSA-N	426.945	1.799	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3c(F)cccc3Cl)CCO2)C1	1838871052	DSKIPLYHEVAZQF-LIRRHRJNSA-N	449.306	1.803	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(O)c(OC)c3)C2)C1	1839146735	UNIUKQXNGNKHAY-YWZLYKJASA-N	426.897	1.488	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(-n4cccn4)cc3)C2)C1	1839147047	FXJBXBDHUXOULE-UGKGYDQZSA-N	446.935	1.960	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(F)ccc3OC)C2)C1	1839148593	CZEXVCJGCAGJJE-UZLBHIALSA-N	428.888	1.922	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)C(=O)c3ccccc3)C2)C1	1839151409	QPBMXVJHKSDVMH-UXHICEINSA-N	443.327	1.562	50	20	IDGD	
O=C(COc1ccccc1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839199246	LACGIQLFGNSANR-FUHWJXTLSA-N	445.285	1.212	50	20	IDGD	
COc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)cc1	1839201825	KNFFOUBCESKWPW-YJBOKZPZSA-N	445.285	1.456	50	20	IDGD	
Cc1cc(O)c([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1839466709	PQDXWKJCNWBTCF-CRAIPNDOSA-N	445.831	1.213	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3ccccc3)C2)C1	1840032141	OLTAPPOWRQTHCA-JXFKEZNVSA-N	439.350	1.859	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)C(F)(F)c3ccco3)C2)C1	1840156042	MLMZFOPFCMFGQL-SUMWQHHRSA-N	436.839	1.082	50	20	IDGD	
C[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1)n1cccc1	1840353487	KEFYJEPOWQEFSM-CPUCHLNUSA-N	432.290	1.196	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)c(O)c1	1840669532	ATHQECLBMDQMQA-KUHUBIRLSA-N	441.322	1.554	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@H](O)C[C@H]1C(=O)N1CCCC12CN(C(=O)C(C)(C)CCl)C2	1843103931	SUMAWUNQEJQLEG-GJZGRUSLSA-N	443.972	1.825	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2nc3ccccc3[nH]2)C1	1843643908	XLOJSMXSHLEZAA-VULFUBBASA-N	433.472	1.514	50	20	IDGD	
Cc1ccc(S/C=C/C(=O)N2CCCC23CN(C(=O)c2ccc(B(O)O)cc2)C3)cc1	1844233331	NRCUJLADKBNGRD-SDNWHVSQSA-N	436.342	1.798	50	20	IDGD	
Cc1ccc2[nH]cc(CC(=O)N3CC4(CCCN4C(=O)c4cnccc4C(=O)NN)C3)c2c1	1844263414	BWWQUMOAZJXEPO-UHFFFAOYSA-N	446.511	1.535	50	20	IDGD	
C=CCO[C@H](C)C(=O)N1CC2(CCCN2C(=O)c2cc([N+](=O)[O-])ccc2OC(C)=O)C1	1844692043	ZRDXXJKMVWZBMY-CQSZACIVSA-N	431.445	1.928	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)c1ccc(C(=O)OC)cc1[N+](=O)[O-])C2	1846363862	IIYHYHQSJRHWJV-CQSZACIVSA-N	439.852	1.452	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@H](O)[C@H](C(=O)N2CC3(CCCN3C(=O)C(Cl)Cl)C2)C1	1846388514	PHRKEGZJLAKCMW-VXGBXAGGSA-N	436.336	1.221	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@]2(O)CCN(C(=O)OC(C)(C)C)C2)C1	1846410352	NYJIVKWKFPQAFL-VFNWGFHPSA-N	443.972	1.969	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC2(CCCN2C(=O)CC2(O)CCC2)C1	1846731691	ZRCGDVARMHSVSJ-AWEZNQCLSA-N	429.945	1.627	50	20	IDGD	
Cc1ccc2c(/C=C/C(=O)N3CCCC34CN(C(=O)c3ccc(B(O)O)cc3)C4)c[nH]c2c1	1847121572	YNJNKJLPYNNBFF-UXBLZVDNSA-N	443.312	1.687	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)[C@H]2CCCN(C(=O)c3ccc(F)cc3)C2)cc1	11060097	HDCFIGPJHDZPQD-SFHVURJKSA-N	441.459	1.991	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)C[C@H](NC(N)=O)c2ccccc2)c2ccccc2c1=O	11148160	MSURVIAEQRJSCG-KRWDZBQOSA-N	436.472	1.367	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)N/N=C1/C(=O)Nc2cc3c(cc21)OCCCO3	17372329	FWYYLYDCDLIDAB-UHFFFAOYSA-N	449.511	1.833	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CCc2ccc(S(N)(=O)=O)cc2)ccc1OC(C)C	27238141	ZARBLGZURXZHIT-UHFFFAOYSA-N	435.502	1.524	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNS(=O)(=O)c3ccc4c(c3)n(C)c(=O)n4C)cc2C1	109594810	FPTPSRNBCQSING-NSHDSACASA-N	434.543	1.687	50	20	IDGD	
O=C(Cn1cc(Br)ccc1=O)NNC(=O)c1ccc(F)cc1Br	195571219	UVPYMKVEEKGMSF-UHFFFAOYSA-N	447.058	1.974	50	20	IDGD	
COc1cc(/C=C(/C#N)C(=O)NCc2ccco2)ccc1OCC(=O)N1CCOCC1	207826520	XEKBXHPZJVBNHF-BOPFTXTBSA-N	425.441	1.749	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NCCOc1ccc(Br)cc1	726247857	JTDUANINVLCIGV-UHFFFAOYSA-N	441.307	1.650	50	20	IDGD	
C[C@H](CC(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)NC(=O)C1CCCCC1	727535068	NBYICVYMJLRADG-CYBMUJFWSA-N	434.449	1.374	50	20	IDGD	
O=C(NNC(=O)c1cccc(N2CCCS2(=O)=O)c1)c1cccc(OC(F)F)c1	728486521	DUWRRQQXEPQFFJ-UHFFFAOYSA-N	425.413	1.903	50	20	IDGD	
Cc1nn(CC(C)C)c(C)c1CCC(=O)NNC(=O)C1CCN(c2ncccn2)CC1	728848164	XXEZRWHMQSCLGG-UHFFFAOYSA-N	427.553	1.943	50	20	IDGD	
CC(C)(C(=O)NNC(=O)Cc1cccnc1)S(=O)(=O)c1ccc(Br)cc1	728850578	VRPRLLVHMJDUSC-UHFFFAOYSA-N	440.319	1.787	50	20	IDGD	
CNC(=O)CCN(C)C(=O)/C(C#N)=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	729368916	PZJUNXWSYNKEOO-RVDMUPIBSA-N	442.907	1.580	50	20	IDGD	
Cc1nc2cc(O)nn2c(C)c1CC(=O)NNC(=O)c1ccc(F)cc1Br	729524105	SCQFUNAOBSBBCH-UHFFFAOYSA-N	436.241	1.957	50	20	IDGD	
CCCC(=O)N1CSC[C@@H]1C(=O)NNC(=O)c1ccc(OC)c(Br)c1	732036138	XXTYCASJOKFWSK-GFCCVEGCSA-N	430.324	1.920	50	20	IDGD	
COc1ccc2c(c1)C[C@H](C(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)CO2	732328097	OKVLFGIFLRQORC-AWEZNQCLSA-N	429.385	1.159	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)C[C@H](C)C(=O)c2ccccc2)cc1	732749851	ICBQBDMCAYHQSZ-INIZCTEOSA-N	431.514	1.672	50	20	IDGD	
CN1CCN(C[C@H](NC(=O)NNC(=O)COCc2ccccc2)c2ccccc2)CC1	738496884	CJKCXTXKRHJPSH-NRFANRHFSA-N	425.533	1.522	50	20	IDGD	
COCC(=O)N[C@H](C(=O)NNc1cc(C(F)(F)F)nc(-c2cccnc2)n1)C(C)C	741287044	LOZAIVJPIFPGAT-HNNXBMFYSA-N	426.399	1.788	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CSc2nc(O)c3cnn(-c4ccccc4)c3n2)c1	741843446	PWNHVVQWCUUESC-UHFFFAOYSA-N	445.464	1.946	50	20	IDGD	
COc1cc(NC(=O)OC(C)(C)C)c(Cl)cc1C(=O)NNC(=O)C(=O)NC1CC1	742488916	NQLQCTUGZRMIAU-UHFFFAOYSA-N	426.857	1.735	50	20	IDGD	
Cc1nc(O)c(C#N)c(C)c1CCC(=O)OCC(=O)NNC(=O)c1cccc(Cl)c1	742734000	VRAFVFOKRGOPJE-UHFFFAOYSA-N	430.848	1.866	50	20	IDGD	
NC(=O)[C@H]1CC(C(=O)NNC(=O)c2cccc(Br)c2)=NN1c1ccccc1	742771450	VFKFEDSSGGTCCI-OAHLLOKOSA-N	430.262	1.330	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(C)c(C(=O)NNC(=O)Nc2ccc(N(C)C)cc2)c1	743826590	JHCBXZRHQOARRF-UHFFFAOYSA-N	449.533	1.452	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCCN1Cc2ccccc2C1	744305452	RQKYAXPMZOIUKM-UHFFFAOYSA-N	430.534	1.248	50	20	IDGD	
Cc1ccc(N(C)C(C)C)c(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1	745121331	GYPMAZKSZSJQIJ-HXUWFJFHSA-N	441.484	1.984	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2cccc3cccnc23)c1	745285834	BKMQJVKGXIBYJA-UHFFFAOYSA-N	427.486	1.629	50	20	IDGD	
CCO[C@@H](CCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)C(C)C	746422911	ZOHZZQZVCWGNNN-SFHVURJKSA-N	440.566	1.866	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc(Br)cc(C(F)(F)F)c1)c1cnccn1	746591973	SCIFTCCZZVPXQN-UHFFFAOYSA-N	425.186	1.881	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)NCc1ccc(OCCN2CCCC2)cc1	746764534	BGVGZTQDXKPBQJ-UHFFFAOYSA-N	436.516	1.882	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)CSCc2cscn2)cc1	746785590	QWPZFWILJFHKRY-UHFFFAOYSA-N	428.561	1.153	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCCN1Cc1ccc(F)cc1)c1csc(N2CCOCC2)n1	747199780	DDNJHFGKYJKJTH-SFHVURJKSA-N	447.536	1.935	50	20	IDGD	
CC(C)OCCS(=O)(=O)N1CCN(S(=O)(=O)c2ccc(CCCl)cc2)CC1	747290391	FXDAORDIOGNAQB-UHFFFAOYSA-N	438.999	1.529	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCCc2nc3ccccc3[nH]2)c1	749346482	AZPLZAIANQUMDU-UHFFFAOYSA-N	444.517	1.390	50	20	IDGD	
Cc1cc(S(N)(=O)=O)cc(C(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)c1C	751955449	KXUJKCUVHIKAHM-UHFFFAOYSA-N	433.494	1.308	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@@H]2C(=O)NNC(=O)c2ccc(C)o2)cc1	752779155	DJJBGZXQHFBYMI-QGZVFWFLSA-N	433.486	1.795	50	20	IDGD	
C#CCOCCNC(=O)/C(C#N)=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	753230681	JDVWOIXUDBDTTP-FOWTUZBSSA-N	425.876	1.752	50	20	IDGD	
COc1ccc(C(=O)CCC(=O)NNc2nccc(N3CCOCC3)n2)c(OC)c1OC	753424393	BNVYYOCWTDBLBM-UHFFFAOYSA-N	445.476	1.445	50	20	IDGD	
Cn1cnnc1SCC(=O)Nc1cccc(C(=O)NNc2cc(Cl)nc(N)n2)c1	753454884	MCYKXSGCNPZJKW-UHFFFAOYSA-N	433.885	1.328	50	20	IDGD	
C[C@H](C(=O)OCC(=O)NNC(=O)c1cccc(Cl)c1)c1ccc(S(C)(=O)=O)cc1	753489485	QNSPYEBHYFHOHA-LBPRGKRZSA-N	438.889	1.851	50	20	IDGD	
Cc1cc(C)c(S(=O)(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)cc1[N+](=O)[O-]	755018625	FFBWUEKAMIWQBV-UHFFFAOYSA-N	440.865	1.491	50	20	IDGD	
COc1ccc(S(=O)(=O)NC2CC2)cc1NC(=O)NNC(=O)Cc1ccccc1F	755616580	XOLZKOIFKVXQID-UHFFFAOYSA-N	436.465	1.670	50	20	IDGD	
CCOC(=O)[C@H](C)NC(=O)c1ccc(NC(=O)NNC(=O)c2ccc3c(c2)OCO3)cc1	756790614	PJWNHVZJVOODHM-LBPRGKRZSA-N	442.428	1.563	50	20	IDGD	
Cc1c(NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cccc1N1CCOC1=O	756818669	QLGGQQQMRVYQHR-UHFFFAOYSA-N	439.476	1.811	50	20	IDGD	
CCS(=O)(=O)c1ccc(CCC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1	756863229	IUPBHJQYOIOLFX-UHFFFAOYSA-N	442.497	1.121	50	20	IDGD	
Cn1cc(C(=O)N2CCN(S(=O)(=O)CBr)CC2)c(-c2cccs2)n1	758526970	DVKFQDBOQUBMCW-UHFFFAOYSA-N	433.353	1.589	50	20	IDGD	
COCCOc1cccc(CC(=O)N2CCN(S(=O)(=O)CBr)CC2)c1	758528650	WVSMFOWRTKJHJL-UHFFFAOYSA-N	435.340	1.081	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)c1cnc2nccnc2c1	759392655	PFHNKJYZULWPHH-UHFFFAOYSA-N	439.907	1.257	50	20	IDGD	
COc1ccc2c(c1)OC[C@H]2CC(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	760262078	AEHJYIHTWRAWSO-LLVKDONJSA-N	439.877	1.323	50	20	IDGD	
Cc1cc(C)nc(-n2nccc2NC(=O)C(=O)NNC(=O)c2c(Cl)cccc2Cl)n1	760278219	VCUDGLWXZIRXFP-UHFFFAOYSA-N	448.270	1.986	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1	761398083	AFEDRCYJVYGNPZ-AWEZNQCLSA-N	434.474	1.475	50	20	IDGD	
O=C(NNC(=O)C(=O)NC1CC1)NC1CCN(Cc2ccc(Br)cc2)CC1	762397547	KYDLFQAOQXGRRG-UHFFFAOYSA-N	438.326	1.023	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C2(S(=O)(=O)c3ccccc3)CC2)n[nH]1	763150716	AGQZQVMYUZNKPW-UHFFFAOYSA-N	440.481	1.853	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)c2ccnc3c(C(N)=O)cnn23)cc1OC	763270879	XXRIYRFLXVQPFE-UHFFFAOYSA-N	426.433	1.091	50	20	IDGD	
CCn1cnnc1-c1cccc(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3n2)c1	763449564	DSJUEFLYJJDMGW-UHFFFAOYSA-N	429.440	1.913	50	20	IDGD	
Cc1ccc(C(=O)N2C[C@H](C)C[C@@H](C)C2)cc1NC(=O)C(=O)NNC(=O)c1ccncc1	763464945	REJQHHPDVRPYAL-HUUCEWRRSA-N	437.500	1.908	50	20	IDGD	
CS(=O)(=O)c1ccc(C(=O)NNC(=O)COc2ccccc2Br)cc1	763547232	CWBLHCMOIGPHDC-UHFFFAOYSA-N	427.276	1.693	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cc3c(cc2SC)OCCO3)cc1OC	763549924	BMFBQVUQCAZGGD-UHFFFAOYSA-N	447.469	1.597	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](CNC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)C1CC1	763588813	JWZFWTPOMSSFIG-OAHLLOKOSA-N	440.522	1.337	50	20	IDGD	
CNC(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)c2cc(C)nc3ccccc23)c1	763613952	FPSFSBMRPVIQTA-UHFFFAOYSA-N	439.859	1.956	50	20	IDGD	
COC(=O)c1ccc(OC)cc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccccc2)[nH]n1	763615292	ZSYUDZHOHJDAFT-UHFFFAOYSA-N	437.412	1.272	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1ccc(=O)n(Cc2ccccc2)c1	763623133	CMLSSGGVPIIMBE-UHFFFAOYSA-N	444.451	1.252	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1cccc(Oc2cnccn2)c1	763630254	WVORKZMGYNOJIC-UHFFFAOYSA-N	431.412	1.625	50	20	IDGD	
CCNS(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2ccc(Cl)cc2F)cc1	763655400	OILXXCMGMMBAHV-UHFFFAOYSA-N	428.873	1.922	50	20	IDGD	
O=C(CN1CCCc2ccccc21)NNC(=O)C(=O)Nc1ccccc1C(=O)N1CCCC1	763746358	SUYCTYPSZRBCLT-UHFFFAOYSA-N	449.511	1.461	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)C(=O)Nc1ccc(OC2CCCC2)nc1	763804344	LMFGLKNYCKDDRX-UHFFFAOYSA-N	443.416	1.476	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)NC(=O)CO3)c1C	763847282	AKDDPHZVEAEFFD-ZDUSSCGKSA-N	426.429	1.188	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccccc2Cn2cncn2)c1C	763851227	RGTOCJNHFDINOI-INIZCTEOSA-N	436.472	1.497	50	20	IDGD	
CNC(=O)Cn1ccc2ccc(NC(=O)C(=O)NNC(=O)Cc3c[nH]c4ccccc34)cc21	763864990	GIENGPOHOLVRIF-UHFFFAOYSA-N	446.467	1.197	50	20	IDGD	
CC(=O)Nc1cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)ccc1Cl	763873466	TXOILTFEVOTWFF-JTQLQIEISA-N	436.827	1.991	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2cccc3c2CN([C@H](C)C(C)C)C3)n1	763893418	UXROXXFLMSFNJK-MRXNPFEDSA-N	426.521	1.646	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C)nc2N(C)C)cc1OC	763910332	DYPASHXYXVTYER-UHFFFAOYSA-N	429.477	1.653	50	20	IDGD	
O=C(NNC(=O)c1cc2c(s1)CCCCCC2)C(=O)Nc1cnn(-c2ncccn2)c1	763912674	ZRTUDYLXBMREPT-UHFFFAOYSA-N	439.501	1.783	50	20	IDGD	
CCOC(=O)c1ccn(-c2ccccc2NC(=O)C(=O)NNC(=O)c2ccccc2C)n1	763962208	NMZIAIWLIHHWQS-UHFFFAOYSA-N	435.440	1.757	50	20	IDGD	
N#CCOc1cc(F)ccc1NC(=O)C(=O)NNC(=O)c1cccc(Br)c1	764062955	HLXAHBWNHHEVFB-UHFFFAOYSA-N	435.209	1.890	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1Cl	764077841	OFVBXJADZYQYKX-UHFFFAOYSA-N	425.850	1.152	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(N3C[C@H](C)O[C@H](C)C3)cc2)c(O)c1	764109317	KFQQVKFYMSIFJR-GASCZTMLSA-N	426.473	1.714	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccoc2)n(-c2cccc(Br)c2)n1	764160264	QQTHGTLRYMJGDS-UHFFFAOYSA-N	432.234	1.936	50	20	IDGD	
O=C(Cc1ccccn1)NNC(=O)C(=O)Nc1cccc(C[S@](=O)C2CCCCC2)c1	764266718	JROBBPDCIFSCBL-HKBQPEDESA-N	442.541	1.992	50	20	IDGD	
NC(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc(F)ccc2Br)cc1	764270748	SSPJVTHYHXKVDC-UHFFFAOYSA-N	437.225	1.016	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)C(=O)Nc1ccc([S@@](=O)C(F)(F)F)cc1	764289682	XYRVJWCLQSLSJJ-SSEXGKCCSA-N	443.403	1.738	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)C(=O)Nc1cncc(Br)c1	764350710	INIZKJXVSOPDGN-UHFFFAOYSA-N	429.234	1.430	50	20	IDGD	
COC(=O)N(C)Cc1ccc(NC(=O)C(=O)NNC(=O)COCc2ccccc2)cc1	764368422	WHCALBRXZUKULW-UHFFFAOYSA-N	428.445	1.188	50	20	IDGD	
O=C1CCc2cc(F)c(NC(=O)C(=O)NNC(=O)C(F)(F)Oc3ccccc3)cc2N1	764380230	TZNYSAWHVYKTDM-UHFFFAOYSA-N	436.346	1.468	50	20	IDGD	
O=C(Cc1ccc2c(c1)CCO2)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	765753304	DQPLJSUPERTFQQ-UHFFFAOYSA-N	442.947	1.783	50	20	IDGD	
CC(=O)Nc1c(C)cccc1C(=O)NNC(=O)CN1CCN(Cc2ccc(C)cc2)CC1	766648311	JGYQGCSOHNZSED-UHFFFAOYSA-N	437.544	1.841	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)c1ccn(-c2ccc(F)cc2F)n1	766653103	CAGQMDXFKLKARN-UHFFFAOYSA-N	433.802	1.881	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@@H](C(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)[C@@H](C)O)cc1	767302053	RMNZAMCRJFOAJG-UUJYFKEHSA-N	449.573	1.387	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1)C(=O)Nc1cncnc1	768239849	PFDISAMDZVVARA-FQEVSTJZSA-N	430.468	1.190	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)[C@H](C)NC(=O)c1n[nH]c2ccccc12	768609878	BLFKXQQTXZDASS-NSHDSACASA-N	431.474	1.237	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)CN1C(=O)N[C@](C)(c2ccc(F)c(Cl)c2)C1=O	769935166	ANRMROJBUHHUBL-HXUWFJFHSA-N	448.838	1.716	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)NCc3ccc(COCC(F)(F)F)cc3)nc21	770341799	NLTYPNPKNMWKAF-UHFFFAOYSA-N	425.371	1.974	50	20	IDGD	
Cc1cc(-c2noc([C@@H](C)NC(=O)NNc3nc(O)c4cnn(C)c4n3)n2)ccc1F	770409963	GCDALASXLMDDBG-SECBINFHSA-N	427.400	1.954	50	20	IDGD	
CC(C)C[C@H](C(=O)NNC(=O)c1ccc2c(c1)OCCO2)N1C(=O)[C@H]2CC=CC[C@H]2C1=O	770417955	NTUREXYTBCLDMS-IXDOHACOSA-N	441.484	1.585	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)N[C@@H](C)[C@H]2CN(C)CCO2)c2ccccc2c1=O	770435347	OELVKZUVMGVJFC-MAUKXSAKSA-N	444.536	1.250	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1nn(-c2cccc(C(F)(F)F)c2)c(C)cc1=O	771964534	WPDZZADGAITWNT-NSHDSACASA-N	440.378	1.662	50	20	IDGD	
O=C(C[C@H](c1ccccc1)N1CCOC1=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772196348	YEFJOCDMYSXVCP-QGZVFWFLSA-N	444.875	1.687	50	20	IDGD	
COC(=O)c1ccc(OC)c(S(=O)(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)c1	773264539	KYMYBNRCFOGVNE-LLVKDONJSA-N	442.877	1.912	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)CCC(=O)N3CC2CC2)c(O)c1	773495576	CPMSKHSPOLINSO-UHFFFAOYSA-N	436.468	1.790	50	20	IDGD	
COCCS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccc(C(F)(F)F)cn2)cc1	773667912	UWOQSNPSNHCBAD-UHFFFAOYSA-N	446.407	1.602	50	20	IDGD	
NC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)NNc1ccc(C(F)(F)F)cn1	775257502	OOIDJIQCHMBGLH-ZDUSSCGKSA-N	425.367	1.714	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)NNc2ccccn2)cc1	777473856	SYJSEEAXXACCPR-VBKFSLOCSA-N	431.456	1.879	50	20	IDGD	
COc1ccccc1C(=O)N[C@@H](CCS(C)(=O)=O)C(=O)NNc1cc(Cl)ccn1	778453359	SJYUHOVJOBYNCI-AWEZNQCLSA-N	440.909	1.420	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@H](C(=O)NNC(=O)c2cccc3ccccc23)[C@H](C)O)cc1	779519961	NIGLIVMJHZELIH-YWZLYKJASA-N	441.509	1.637	50	20	IDGD	
C[C@@H]1CN(Cc2ccc(C(=O)NNC(=O)CCNC(=O)OC(C)(C)C)cc2)C[C@@H](C)O1	780971943	VYNTUAUQEGYQCP-HZPDHXFCSA-N	434.537	1.972	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)c2cnc3c(c2)nnn3C)cc(OCC)c1OCC	780978917	VMVNOQVRTAVQKK-UHFFFAOYSA-N	428.449	1.634	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)[C@H]1CC(c2ccccc2[N+](=O)[O-])=NO1	781559648	PDTCAWGELDEMAQ-GOSISDBHSA-N	428.401	1.713	50	20	IDGD	
Cn1cc(-c2n[nH]cc2C(=O)NNc2ccc(S(=O)(=O)Nc3nccs3)cc2)cn1	781946253	XCIWJGGUQTYUJJ-UHFFFAOYSA-N	444.502	1.824	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NN=Cc2cc(Br)nn2C)cc1	782144263	VVSSHJBVJMZKHB-UHFFFAOYSA-N	428.312	1.262	50	20	IDGD	
O=C(NNc1ncncc1Cl)C(=O)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1	782166364	SSTOCJIAOFNYSY-OAHLLOKOSA-N	440.895	1.855	50	20	IDGD	
O=C(NNc1ncc(C(F)(F)F)cc1Cl)C(=O)Nc1ccc(-n2nccn2)nc1	782853239	PJHWXHKFORFGOM-UHFFFAOYSA-N	426.746	1.811	50	20	IDGD	
Cc1cc(C)n(-c2ccc(NC(=O)C(=O)NNC(=O)Cc3nc4ccccc4n3C)cn2)n1	782895278	YWCWTIWCPDECSH-UHFFFAOYSA-N	446.471	1.099	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2ccc(S(=O)(=O)N3CCCC3)c(OC)c2)cc1	783035596	XPYQXBLJHXFFPF-UHFFFAOYSA-N	448.501	1.570	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ncccc2C(F)(F)F)cc1S(=O)(=O)N(C)C	783119840	KTUJMDZYXQDOPO-UHFFFAOYSA-N	445.423	1.741	50	20	IDGD	
COC(=O)CN1CCN(c2ccc(NC(=O)C(=O)NNc3ccc(Cl)cc3)cc2)CC1	783336143	FXAWNQFQVFFGFM-UHFFFAOYSA-N	445.907	1.717	50	20	IDGD	
COC(=O)c1ccc(OC(C)C)c(NC(=O)C(=O)NNc2ccc(-n3cccn3)nn2)c1	783432889	HDYJCKGINZJKKH-UHFFFAOYSA-N	439.432	1.318	50	20	IDGD	
Cc1cc(F)ccc1NNC(=O)C(=O)Nc1cnn(CC(=O)N2C[C@@H](C)O[C@H](C)C2)c1	783446642	UPVPFLPVOMCBQT-ZIAGYGMSSA-N	432.456	1.048	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccco1)c1cccc(S(=O)(=O)NCc2ccccc2)c1	783525906	BVWGJORYMHNOSI-UHFFFAOYSA-N	435.483	1.381	50	20	IDGD	
Cc1nc(C(C)C)nc(O)c1C(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	783705330	VZNKHSUPKYRSIJ-UHFFFAOYSA-N	436.513	1.863	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)C(=O)N1CC2(CCCC2)c2c(F)cccc21	784002334	NZSGXBASFFWYNT-UHFFFAOYSA-N	428.420	1.155	50	20	IDGD	
CCN(c1ccc(NC(=O)C(=O)NNC(=O)CNC(=O)c2cccs2)cc1)C(C)C	784004253	CPZHSQCPLDTQDT-UHFFFAOYSA-N	431.518	1.499	50	20	IDGD	
COc1ccc(Cn2ncc(C)c2NC(=O)C(=O)NNc2ccc(Cl)nn2)cc1OC	784792211	IJDMGJAUQIRXTK-UHFFFAOYSA-N	445.867	1.782	50	20	IDGD	
COc1cccc(NNC(=O)C(=O)Nc2ccc(C(=O)N(C)[C@@H]3CCCN(C)C3)cc2)n1	784845560	BVUAOXJNPMRRST-QGZVFWFLSA-N	440.504	1.338	50	20	IDGD	
Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)C(=O)NNc1ncc(F)cn1	784957191	OCCRPNFACMTDEQ-KRWDZBQOSA-N	438.467	1.649	50	20	IDGD	
CN(Cc1ccccc1NC(=O)C(=O)NNc1ccnc(N(C)C)n1)C(=O)OC(C)(C)C	784977833	JRUNEVTXOZVPKG-UHFFFAOYSA-N	443.508	1.991	50	20	IDGD	
CCCCN(C)c1ccc(NC(=O)C(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)cc1	785024419	ZBALLVNTYPESJY-UHFFFAOYSA-N	429.433	1.936	50	20	IDGD	
CC(C)CN1C[C@H]2CN(C(=O)NNC(=O)c3cnn(-c4ccccc4)c3)CCN2C1=O	787865306	XJWYNDUNRYAXSB-GOSISDBHSA-N	425.493	1.305	50	20	IDGD	
NS(=O)(=O)c1ccccc1NNC(=O)c1ccc(I)c(F)c1	788224894	ZQTMBUCQZXURPE-UHFFFAOYSA-N	435.218	1.835	50	20	IDGD	
COc1cc(NNC(=O)[C@@H]2C[C@@H](O)CN2S(=O)(=O)c2ccc(F)cc2)ccc1Cl	790174774	LAGQWGGFQICEQR-CJNGLKHVSA-N	443.884	1.755	50	20	IDGD	
O=C(NNC(=O)c1cn2ccc(Br)cc2n1)c1ccc(-n2cnnn2)cc1	794785071	SJBQUBUJOZNMDO-UHFFFAOYSA-N	427.222	1.147	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NN=C1CSC[C@@H]1C)N(S(C)(=O)=O)CC2	794881586	LNFCNJNUXYTQOO-LRDDRELGSA-N	441.575	1.808	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)[C@](C)(O)CSc1cccc(F)c1	796484311	UNDFTUMKFRCDRS-GOSISDBHSA-N	430.502	1.524	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)cc1OC	796989874	JSXATQIKSQJNFY-CQSZACIVSA-N	443.456	1.652	50	20	IDGD	
CCCc1c(NC(=O)C(=O)NNC(=O)COCC)cnn1-c1cc(F)c(OC)cc1F	797009527	TTZCOKQTTFLESI-UHFFFAOYSA-N	439.419	1.234	50	20	IDGD	
C=C(C)[C@@H]1OCC[C@@H]1CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	798117288	WXRGZZAHALYRIL-AEFFLSMTSA-N	436.534	1.396	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CN(C[C@H]2CCCO2)C(=O)OC(C)(C)C)cc1C	798308947	RDNMHTXZRCLBKZ-QGZVFWFLSA-N	448.520	1.805	50	20	IDGD	
CCOC(=O)Oc1ccc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1	800287158	VWCAKVXNXIYPPT-QGZVFWFLSA-N	444.396	1.366	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2ccc(NCC3CC3)nc2)cc1	800687847	HQRABJAJYVKBRX-UHFFFAOYSA-N	431.518	1.294	50	20	IDGD	
CCCN(NC(=O)c1cccc(S(=O)(=O)N2CCNC(=O)C2)c1)C(=O)OC(C)(C)C	804592006	SKDCSYKEJRYQFY-UHFFFAOYSA-N	440.522	1.099	50	20	IDGD	
O=C(COCc1cccnc1)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	805154140	IVQDYSQVLBOCCK-UHFFFAOYSA-N	432.502	1.234	50	20	IDGD	
Nc1nc(C2CCCC2)ncc1C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	806973910	NTIYJDYUDVZUPI-UHFFFAOYSA-N	446.533	1.494	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)C(=O)Nc2cc(C)ns2)c2ccccc2c1=O	806974849	WHVGVDJJEAFIQM-UHFFFAOYSA-N	428.474	1.361	50	20	IDGD	
O=C(NCc1ccccc1CN1CCCC1)NNC(=O)c1csc(N2CCOCC2)n1	807071420	IQSLFNRUEJFVRO-UHFFFAOYSA-N	444.561	1.720	50	20	IDGD	
O=C(NCCC1(O)CCC1)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	807264534	RLLWIARNEOSXAA-UHFFFAOYSA-N	435.484	1.694	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cccc3c2COC3=O)cc1	808934549	KPPYDYSQOCTVMP-GFCCVEGCSA-N	425.397	1.113	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)CNS(=O)(=O)c1ccc(Cl)c(Cl)c1	810375096	QLGJNPQHQFHKHT-UHFFFAOYSA-N	432.285	1.742	50	20	IDGD	
O=C(COC(=O)[C@@H]1CCN(c2ccccc2F)C1)NNC(=O)[C@H]1COc2ccccc2O1	811378637	RUYBPTAMSLJBAF-AUUYWEPGSA-N	443.431	1.183	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2cc(Cl)ncc2Br)n1	811392186	FZABBPCKCXNBNO-UHFFFAOYSA-N	447.698	1.809	50	20	IDGD	
COC(=O)Cc1cccc(S(=O)(=O)NNC(=O)c2cc(F)ccc2Br)c1	811683019	OEUIBZLJOHTTRS-UHFFFAOYSA-N	445.266	1.927	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)c2cc(S(=O)(=O)NC3CC3)ccc2C)cc1C	811866888	OLZRVMQGDIJULW-UHFFFAOYSA-N	431.514	1.893	50	20	IDGD	
CN(C)S(=O)(=O)CCNC(=O)NNC(=O)CCCOc1ccc(Cl)cc1Cl	812692134	PIFYGRPJHHOJAD-UHFFFAOYSA-N	441.337	1.374	50	20	IDGD	
CC(C)(C)OC(=O)NCCC[C@H](NC(=O)NNC(=O)C(=O)N1CCCC1)c1ccccc1	812702692	JJVTUHSOCFDEBT-KRWDZBQOSA-N	447.536	1.985	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@H]2CCN(c3ccccc3F)C2)c2ccccc2c1=O	813853681	KCKMNHLWUGLQQE-AWEZNQCLSA-N	438.463	1.778	50	20	IDGD	
C[C@@H](Cc1cnc2ccccc2n1)C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	814722134	LHDFPGHWUCULFJ-AWEZNQCLSA-N	441.513	1.520	50	20	IDGD	
CC(=NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1)c1cccc(CO)c1	814879325	TXMIQSPCPFLDCL-UHFFFAOYSA-N	444.557	1.334	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)C2CCC(OC[C@H]3CCCO3)CC2)cc1	815346117	ZPTADFHOZLMLEC-CTWPCTMYSA-N	429.473	1.617	50	20	IDGD	
O=C(COC(=O)c1cnc2c(F)ccc(F)c2c1)NNC(=O)[C@@H]1COc2ccccc2O1	815355453	DTZXXZZHZXAWFA-KRWDZBQOSA-N	443.362	1.657	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cc(OC)c(C)c(OC)c2)cc1	815566248	NEXITJRNCZKEAM-CQSZACIVSA-N	445.472	1.964	50	20	IDGD	
N#Cc1cc(NC(=O)C(=O)NNC(=O)CCc2ccccc2O)ccc1Br	815569442	UGXFCHOBZHLLRW-UHFFFAOYSA-N	431.246	1.745	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNc2ccc(Cl)nc2)nnn1CCOc1ccc(F)cc1	815602206	RVRPSLZXDKCTAR-UHFFFAOYSA-N	433.831	1.935	50	20	IDGD	
CC[C@@]1(C)Oc2ccc(NC(=O)C(=O)NNc3ccccc3S(=O)(=O)N(C)C)cc2O1	815751920	UOHJRPZWVQOEKD-FQEVSTJZSA-N	448.501	1.916	50	20	IDGD	
Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)C(=O)NNc1ncncc1F	815765324	NIGLSVSOVNWDOP-INIZCTEOSA-N	438.467	1.649	50	20	IDGD	
C[C@H](NS(=O)(=O)c1cccc(C(F)(F)F)c1)C(=O)NNC(=O)c1ccccc1F	825457528	WGMHOPIYMDEVDG-JTQLQIEISA-N	433.383	1.973	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)[C@@H](CC(C)C)N2C(=O)[C@H]3CC=CC[C@H]3C2=O)c1	825791647	ROKRNGPEHSPRQF-CEXWTWQISA-N	442.516	1.620	50	20	IDGD	
Cc1cc(-n2c(C)cc(C(=O)NNC(=O)c3csc(N4CCOCC4)n3)c2C)no1	836848995	NBCTWFMMSHHXES-UHFFFAOYSA-N	430.490	1.758	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)Cn3cccn3)c2)cc1	842471376	RIDFVLIYFZGPHJ-UHFFFAOYSA-N	429.458	1.154	50	20	IDGD	
CSC[C@H](C(=O)NNC(=O)COc1cc(C)cc(C)c1)N1C(=O)[C@@H]2CCCC[C@H]2C1=O	863998490	YWNTVHYNOKMRHD-KZNAEPCWSA-N	447.557	1.736	50	20	IDGD	
COCCNS(=O)(=O)c1cccc(C(=O)NNC(=O)Cc2c[nH]c3ccccc23)c1	913055126	HZMAAZRXQBLIRV-UHFFFAOYSA-N	430.486	1.096	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)CNS(=O)(=O)c3ccc(C#N)cc3)cc2C1	913162444	JCJHLYXVRNAXSQ-LBPRGKRZSA-N	432.527	1.484	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)c2ccc(S(=O)(=O)NC[C@@H]3CCCO3)cc2)cc1	913431436	LGTRCPPWQDZDJF-SFHVURJKSA-N	446.529	1.325	50	20	IDGD	
O=C(NNC(=S)NC1CCN(Cc2ccccc2)CC1)[C@H]1COc2ccccc2O1	913478971	AWAMDAMNDZCPIY-HXUWFJFHSA-N	426.542	1.986	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NCCN2CCN(Cc3ccccc3)CC2)cc1C	915902354	RVPOIZUKMAPHDL-UHFFFAOYSA-N	439.560	1.830	50	20	IDGD	
CNS(=O)(=O)c1cccc(C(C)=NNC(=O)c2sc(N3CCOCC3)nc2C)c1	915953917	XVMADQCVQDMUNM-UHFFFAOYSA-N	437.547	1.350	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=S)NCCN(C)C)c2)c(C)c1	916115923	NKPQQOVMBDGYMB-UHFFFAOYSA-N	449.602	1.775	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCc2cccc(S(N)(=O)=O)c2)ccc1OC(C)C	916625780	PFHXLYWZBDSYIB-UHFFFAOYSA-N	436.490	1.274	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@@H](C)c2ccc(C#N)cc2)cc1	916633127	KJKARHUOYLYVAK-HNNXBMFYSA-N	429.502	1.579	50	20	IDGD	
COc1cc(CNC(=O)NNC(=O)Cc2ccc3ccccc3c2)ccc1OCC(N)=O	916640629	HKRXWEOAFVZQPB-UHFFFAOYSA-N	436.468	1.786	50	20	IDGD	
CC(C)C(=O)N1CCCC[C@H]1C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	917532357	UCSVFXWUMKIJSI-FQEVSTJZSA-N	429.565	1.383	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@@H]2CCCCN2C(=O)c2ccco2)cc(OC)c1OC	918399740	UVTJXFGBMHECHH-AWEZNQCLSA-N	431.445	1.761	50	20	IDGD	
CN1C(=C(C#N)C(=O)COC(=O)CCCS(=O)(=O)N2CCCC2)N(C)c2ccccc21	919554653	FXZGTFNIMAKVSI-UHFFFAOYSA-N	446.529	1.626	50	20	IDGD	
O=C(NNC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1)N[C@@H]1CCS(=O)(=O)C1	919883150	BCWMXBILECNNBH-OAHLLOKOSA-N	440.485	1.065	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCCCOc2ccc(OC)cc2)c2ccccc2c1=O	919922583	VVVUPXHHLPTBPA-UHFFFAOYSA-N	439.472	1.838	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)c1cccc(NC(=O)CCn2ccnc2)c1	920092956	IWQXNGDMGAKPRE-UHFFFAOYSA-N	425.420	1.891	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccc(N3CCCC3)nc2)c1	920931417	OXNDFWJRHAQVLB-UHFFFAOYSA-N	432.506	1.399	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)Nc2ccccc2CN2C(=O)CNC2=O)cc1OC	920931798	CSAOGQDZWIQYGP-UHFFFAOYSA-N	441.444	1.612	50	20	IDGD	
CN1CCN(Cc2ccc(CNC(=O)NNC(=O)c3cncn3-c3ccccc3)cc2)CC1	1317911158	VNTYFHJFPZHAEX-UHFFFAOYSA-N	447.543	1.764	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)c3cc(O)nc4c(Br)cccc34)nc21	1319293088	VPAIGNBKCGFPGV-UHFFFAOYSA-N	430.222	1.842	50	20	IDGD	
O=C(NNc1cncc(Br)c1)c1ccc2c(c1)S(=O)(=O)N(C1CC1)C2=O	1319527271	OTBRZIGIARIMKX-UHFFFAOYSA-N	437.275	1.908	50	20	IDGD	
CN(CCNS(C)(=O)=O)C(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccccc1	1321794377	ULPQKJBCTNABFP-GHRIWEEISA-N	426.502	1.378	50	20	IDGD	
CN1CCN(c2ccc(C=NNC(=O)Nc3ccc(S(N)(=O)=O)cc3)cc2F)CC1	1343890081	GPKOYSHBXPUNTB-UHFFFAOYSA-N	434.497	1.381	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(CCN(C(=O)c3n[nH]c4ccc(F)cc34)C2)C1	1778623115	IMLJUAMMEHTQHG-FQEVSTJZSA-N	434.544	1.997	50	20	IDGD	
O=C(c1cccn2cncc12)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1778686534	REUPGDXPCXPNMZ-RHSMWYFYSA-N	425.258	1.468	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)c3cccc(C)c3)C2)C1	1780672702	ISVYOTOOUAIHED-VAHWYXDJSA-N	437.500	1.573	50	20	IDGD	
Cc1cnn(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@](C)(Cl)CCl)C2)c1	1780713007	JPORWYNSMBRQAP-AYOQOUSVSA-N	431.364	1.942	50	20	IDGD	
N#Cc1cc(CC(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)ccc1F	1781299125	DKAMHHKSDJVCHR-AEFFLSMTSA-N	442.260	1.760	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(-n4cccn4)cc3)C2)C1	1781719933	WXDKHIXKQJZBIN-WIYYLYMNSA-N	432.908	1.570	50	20	IDGD	
Cn1nc2c(c1C(=O)N1CC[C@]3(CN(C(=O)CCBr)CCO3)C1)CCC2	1782436396	GNPSTVZGVFVBRF-SFHVURJKSA-N	425.327	1.137	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3[nH]nc4ncccc34)CCO2)C1	1783347248	CWPYPTSUEJLYHV-ACJLOTCBSA-N	436.310	1.575	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CC[C@]2(CN(C(=O)[C@H](C)Br)CCO2)C1	1783857014	GVDNGVKYPBCYGN-XTDOFWJNSA-N	443.338	1.355	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)C[C@H]3COc4ccccc4O3)CCO2)C1	1783870851	HIQKPTZCTYNYKB-QYWGDWMGSA-N	438.908	1.300	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)N2CCO[C@@]3(CCN(C(=O)C(Cl)Cl)C3)C2)c1	1783939566	JQQRCTCVPZJTEP-QGZVFWFLSA-N	435.329	1.337	50	20	IDGD	
COC(=O)[C@H]1CC[C@@H](C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)C(C)(C)CCl)C[C@@H]32)C1	1784075620	JFJDCPVLOAPOQG-XAJHFOFHSA-N	428.957	1.820	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)nc4ccccc34)C[C@@H]21)[C@H](O)CCl	1784090982	SGDBCGOGHFLTSV-HZCDGDGTSA-N	433.892	1.133	50	20	IDGD	
CN(CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Cl)C[C@@H]21)C(=O)c1ccccc1	1784347641	WQOPHMHANKWGEB-NBOOPKSLSA-N	425.888	1.273	50	20	IDGD	
COc1ccc(F)c(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)c1	1785017316	AWFRQQKIUIJDSG-WMLDXEAASA-N	433.249	1.968	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21	1785335698	HAFVKGWHQJERJZ-SRVKXCTJSA-N	434.345	1.261	50	20	IDGD	
CC(C)(CCl)C(=O)Nc1ccc(C2(NC(=O)CN(CCO)CCO)CCC2)cc1	1786013127	YMRWOOCYEOZCKU-UHFFFAOYSA-N	425.957	1.672	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc4ccoc34)C[C@@H]21)c1ccc(B(O)O)cc1	1786981658	DJUVDVYDJNZAEH-YYWHXJBOSA-N	448.284	1.020	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)c1ccc2c[nH]nc2c1	1787316594	DQRHXBPHRUODAR-ZOBUZTSGSA-N	435.322	1.941	50	20	IDGD	
Cc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](O)CCl)C[C@@H]32)n(-c2ccccc2)n1	1787532298	VPFQLAAYTRNIFC-UUXHPUJUSA-N	446.935	1.374	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)c1ccn2ccnc2c1	1788360311	ODFRLLFMOPEMCG-RZLSGREXSA-N	439.285	1.618	50	20	IDGD	
Cc1nn(C)c(C)c1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]2C1	1789867662	HTARWMJNGWJYLX-XMDUPGNXSA-N	431.364	1.867	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ncc(OC)cc3F)C[C@@H]21	1791252416	LGSHPMXAKFCGIX-ZIEJDFEHSA-N	429.876	1.076	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc3c1cnn3C)C2	1792867963	MBLPRKHFWUFYFC-FLTUCWPJSA-N	449.349	1.808	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CC=CC[C@@H]1C(=O)OC)C2	1793452599	CMLXOUFZHDGZKI-COZGXFGHSA-N	426.941	1.739	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccnn1C	1795150482	PWXKMJTXEVUOLN-QDMKHBRRSA-N	441.444	1.819	50	20	IDGD	
COc1ccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)Br)C3)cc1	1795260640	PZCWQTJIWXWTRP-FRQROOTJSA-N	425.323	1.611	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCN1CCCCC1	1795294270	REPKIDLXMBFSBW-DFGXFYAUSA-N	430.387	1.626	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)Nc1nccs1	1796418251	ZMGTUENPSSQXHQ-NWBUJAPZSA-N	431.356	1.317	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1nc2ccccc2[nH]1	1796823739	KUZVEJIWJODKQT-DJBIQUGXSA-N	425.258	1.457	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cc1cscn1)C2	1796892101	HGGXYZLKZBMIQV-TYQTXCSLSA-N	428.518	1.458	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H]1Cc3ccccc3O1)C2	1796892588	UDEKDYMCXLWEKR-OSQUSHSHSA-N	449.511	1.762	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccnc2ccccc12)c1ccc(B(O)O)cc1	1797281636	VYVVBAUBNGQLHC-REPLKXPHSA-N	429.285	1.480	50	20	IDGD	
CC(C)n1nccc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)CBr)C2	1798152776	UQBYPVZHQFVBPN-AYDFFVQHSA-N	427.343	1.698	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc3n(n1)CCCNC3=O)C2	1798627428	IYFHVMSFNPODBT-QDMKHBRRSA-N	433.585	1.120	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C13CC(C(F)(F)F)(C1)C3)C2)[C@@H](F)Br	1799344324	HSQVKKSQTSYVQE-SLRJVEKRSA-N	443.235	1.999	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1n[nH]c3cccc(F)c13)C2)[C@H](F)Br	1799347829	XDZVBMVVLSNKBB-YPSFTXJRSA-N	443.248	1.596	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1CCC2(CC1)OCCO2	1800382594	GZRGOSGACVZYKH-RCJHGTSTSA-N	449.375	1.746	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](O)Cc1ccccc1	1800632360	OAXSPVPFEZCKOJ-JFMONLCZSA-N	439.350	1.211	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(F)c(F)c1OC)C2	1800977432	OHCZYRYYEVLPLZ-DZJQYVJYSA-N	432.851	1.430	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(OC(F)F)cc1)C2	1800977494	RSNQQVNMWHPNCW-XRGAULLZSA-N	432.851	1.745	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(Cl)ccc1OC)C2	1800978373	BXXIEZZUPPTJAL-RBNVPPIJSA-N	431.316	1.806	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(Cl)cc(OC)c1)C2	1800982241	AHGJSHLHZDLYSH-DLTLXFJOSA-N	431.316	1.806	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cn1cccc([N+](=O)[O-])c1=O	1801358711	GYYOWTLWELNAFU-RVMXOQNASA-N	441.282	1.178	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1c(C)nn(C)c1C	1801380151	DNTZZKNHLHPOAD-CXHZTBPHSA-N	441.370	1.343	50	20	IDGD	
O=C(CN1CCOC1=O)NC[C@@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1	1803340881	ZZKUFMJLVMCCFT-YOEHRIQHSA-N	439.310	1.325	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)[C@@H]2C[C@@H]2F)[C@H]1c1cccnc1	1803972430	WAGNJVIXONUZGJ-YSNZMSLPSA-N	440.479	1.579	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)CCc2ccco2)[C@@H]1c1cccnc1	1804590978	JGXDSEPDYFGPPJ-MBSDFSHPSA-N	441.532	1.686	50	20	IDGD	
Cn1c(C(=O)NC[C@@H]2CCN(C(=O)CCBr)[C@H]2c2cccnc2)cccc1=O	1805311261	VEDCOGIYFOXSIW-KXBFYZLASA-N	447.333	1.885	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC2(CCN(C(=O)CCn3ccnn3)CC2)C1	1805389555	RTLBBTUKWPRPOO-OAHLLOKOSA-N	426.359	1.930	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1ccsc1	1805418962	AOHTZUSXEMGMBA-FXAWDEMLSA-N	435.314	1.456	50	20	IDGD	
Cc1ncsc1C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1805756916	ZIDKVWTWRHNPME-QFBILLFUSA-N	444.561	1.539	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCCC2(CCN(C(=O)c3cnccc3C(=O)NN)CC2)C1	1806164856	LLDWFDQQMOTDHA-KRWDZBQOSA-N	435.956	1.937	50	20	IDGD	
COC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)[C@H](C)Br)[C@@H]1c1cccnc1	1806380901	PSQFZRVGCDCUTR-RVSPLBMKSA-N	426.311	1.824	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)Cn2ccccc2=O)[C@H]1c1cccnc1	1807442323	NYILGSUQKKSZBZ-ABSDTBQOSA-N	432.908	1.203	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)Cc2cscn2)[C@H]1c1cccnc1	1807496878	AZCXRGRBFFRANN-HRAATJIYSA-N	444.561	1.160	50	20	IDGD	
CC(C)O[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1810434961	HSKYXXLEAMMZJW-MMOPVJDHSA-N	433.553	1.274	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)[C@H](C)n2ccccc2=O)[C@H]1c1cccnc1	1810518316	NJWWWPOXBALOQI-ZNWBIBPKSA-N	446.935	1.764	50	20	IDGD	
CC(=O)N(C)CCC(=O)N1CC[C@H](CNC(=O)CO[Si](C)(C)C)[C@@H]1c1cccnc1	1810539831	JJMCMIWSIXMOIG-NQIIRXRSSA-N	434.613	1.807	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1ccc(F)cc1	1811900964	QGYBWBAQRGWKNT-KNQAVFIVSA-N	447.275	1.534	50	20	IDGD	
C=C(C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)C(F)(F)F	1812677046	NIYJAKNYCSMZJJ-WMZOPIPTSA-N	447.222	1.200	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)/C=C\C(=O)NC2CC2)[C@H]1c1cccnc1	1812866091	HILQDQRDPRMFRX-SJAYAVGHSA-N	449.349	1.706	50	20	IDGD	
C=CCSCC(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1813069713	AWUOXAJIBFNAQO-DYESRHJHSA-N	433.578	1.380	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)C1CCSCC1)CC2)c1cccc(B(O)O)c1	1815364106	LDSKIBHBMIYVOQ-HNNXBMFYSA-N	445.375	1.192	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnnc(Cl)c2)n[nH]1	1816024506	AMCGSNHYLLADEM-CQSZACIVSA-N	448.915	1.532	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnc(O)nc3O)sc2C1	1817086667	AAXWCOSRJYLXKA-VGDKGRGNSA-N	446.316	1.806	50	20	IDGD	
COC[C@@H](C)C(=O)N[C@H]1CCc2nc(NC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)sc2C1	1817275837	FTQCCJKRBIGUNB-AIKGMPHFSA-N	446.533	1.472	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)Cc2ccccc2)[nH]n1)c1ccc(B(O)O)cc1	1817470991	BVOQLZFPOSTRJO-FQEVSTJZSA-N	432.289	1.638	50	20	IDGD	
CCc1cc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)no1	1817472650	YBCROKPENJKXCL-GOSISDBHSA-N	437.265	1.260	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)c(C)o1	1817473368	OZYLGCPACFGSKT-IBGZPJMESA-N	436.277	1.919	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)CCC(F)(F)F)[nH]n1)c1cccc(B(O)O)c1	1817475475	SDDLTDZLOCNLHU-HNNXBMFYSA-N	438.215	1.738	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnn4ccncc34)sc2C1	1818507731	WSOXUCWYBVVOIS-ZYHUDNBSSA-N	434.909	1.665	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc3n(n2)CCC3)n[nH]1	1819169763	NHLDBTPXELOVAR-KRWDZBQOSA-N	442.524	1.231	50	20	IDGD	
C=C[C@H](O)C(C)(C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1	1819368586	WFYOGWRWVOKFKV-CVEARBPZSA-N	434.541	1.348	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccccc1)CC2	1819797782	JYSILUAJUQGWGZ-ZDUSSCGKSA-N	436.497	1.681	50	20	IDGD	
C[C@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](C)Cn3cncn3)sc2C1	1820077584	TVSVBASGHQICFH-DCAQKATOSA-N	441.355	1.766	50	20	IDGD	
COc1ccnc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)[C@H](O)CCl)[nH]n2)c1OC	1820385927	HCNHCKYSCIOXBH-CHWSQXEVSA-N	437.884	1.728	50	20	IDGD	
N#Cc1ccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)cc1	1820550089	ISUIVMPWYXXUKK-HXUWFJFHSA-N	443.272	1.581	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(CO)on3)sc2C1	1821693781	XTPIASDADRUNTB-DTWKUNHWSA-N	443.323	1.880	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)[C@H]1C[C@@]1(F)Cl	1822501268	KDSQZMIZRIXNME-WTANOLMUSA-N	434.664	1.320	50	20	IDGD	
C[C@]1(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)CC1(F)F	1823393695	KTFNNVFYBNRLIL-HNAYVOBHSA-N	432.236	1.441	50	20	IDGD	
CC(=O)NC(C)(C)C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](C)Br)sc2C1	1825636467	VYOMROJDTJRSPS-SCZZXKLOSA-N	431.356	1.753	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCc1ccco1)CC2	1826080334	BSDPNJZCJUMTQQ-CYBMUJFWSA-N	433.534	1.654	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)C(F)(F)C(F)F)CC2	1826083188	KQKBJCHUDSEZQH-MRVPVSSYSA-N	439.435	1.329	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)Cc1ccccc1F)CC2	1826085317	MRRBNBSETCIQBZ-AWEZNQCLSA-N	447.536	1.810	50	20	IDGD	
CC(C)(C)n1cc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)[C@H](O)CCl)CC2)nn1	1829784313	ARKBBKZZIZYMCM-DLBZAZTESA-N	425.961	1.866	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)CC[C@@H]3CCOC3)C2)C1	1830545002	DLAWPARHIRXPSS-MDZRGWNJSA-N	447.370	1.291	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](NC(C)=O)C(C)(C)C)CCO2	1831095074	FZNMAMVMIQBVOJ-YRNRMSPPSA-N	431.961	1.011	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CN2CCOC2=O)CC1	1831649539	VTVBBMHMUWCYQS-UKRRQHHQSA-N	430.343	1.842	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)C3CCC(CO)CC3)CCO2)C1	1832523162	NMJHZKJNERDNHG-GKSFYBEXSA-N	447.370	1.025	50	20	IDGD	
C[C@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)CNC(C)(C)C)CC2)CC1	1833262191	IWTUGAOLIQQRQI-OAHLLOKOSA-N	445.446	1.977	50	20	IDGD	
Cc1nc(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)ccc1F	1833957385	QBNPCHACYPJBNN-SFHVURJKSA-N	426.920	1.314	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cnn(C)c3C)CC2)CC1	1834281074	ODPUTCIRVKIJRR-GOSISDBHSA-N	425.961	1.168	50	20	IDGD	
CC[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](Cl)COC)C2)C1)c1ccccc1	1834754324	MNJBFEUFPXNZRV-NNMXDRDESA-N	438.952	1.890	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H]3CCc4nc[nH]c4C3)CC2)CC1)[C@@H](F)Cl	1835083698	QQYWHZBDGDFQDO-FZKQIMNGSA-N	425.936	1.621	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3nc(O)n4c3CCCC4)CC2)CC1)[C@@H](F)Cl	1835084264	UAROLGYLOKVOEH-QGZVFWFLSA-N	441.935	1.645	50	20	IDGD	
CC1=CC[C@@H](C(=O)NC2CCN(C3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)CC1	1835437178	AZJNHSPJQINPJU-LJQANCHMSA-N	447.624	1.677	50	20	IDGD	
O=C(COC(=O)C(F)(F)F)NC1CCN(C2CCN(C(=O)C(Cl)Cl)CC2)CC1	1835687569	JTUWTJXIKWCQKS-UHFFFAOYSA-N	448.269	1.467	50	20	IDGD	
CC[C@H](C)CC(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1	1835734738	RWVPAKDOHYKYOY-INIZCTEOSA-N	444.580	1.307	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3cccnc3)CCO2)C1	1836181258	GOISBCSDRZWYQP-HNAYVOBHSA-N	440.338	1.254	50	20	IDGD	
O=C([C@H](F)Cl)N1CCOC[C@@]2(C1)CN(C(=O)[C@@]1(F)CCCCC1(F)F)CCO2	1836627708	MZCMQWGGGVGOKE-MAZHCROVSA-N	430.826	1.895	50	20	IDGD	
O=C(c1ccc2cncn2c1)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1837125074	VPRVQQJLZVTYBF-GOSISDBHSA-N	427.288	1.208	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccncc3Cl)CCO2)C1	1837890657	CSLSLQVOABLCRR-SJCJKPOMSA-N	446.729	1.588	50	20	IDGD	
C=CC[C@H](C)C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1	1837920159	OZFZVRHGRMDZNR-KRWDZBQOSA-N	428.338	1.191	50	20	IDGD	
O=C(c1cc2cc[nH]c2cc1F)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1838571738	AXEFJPGNEKBJIK-APWZRJJASA-N	427.835	1.911	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CNc3ccc(F)cc3)C2)C1	1839143926	MBPKUSFOXHDFGT-XLIONFOSSA-N	427.904	1.711	50	20	IDGD	
C[C@H](C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2)n1ccnc1	1839150850	ZFWRHTSGPZGWNT-OLMNPRSZSA-N	433.336	1.137	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C13CC(C(=O)OC)(C1)C3)CCO2	1840004821	QWXQHFFHLKJWSM-NUDUCMMGSA-N	442.940	1.194	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3cccs3)C2)C1	1840030907	AJOIRGYKEAUNQU-KSSFIOAISA-N	445.379	1.921	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)C3(C(F)(F)F)CC3)C2)C1	1840153319	KCYUWTIQGMSISR-SWLSCSKDSA-N	428.835	1.039	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C(C)(C)C)n[nH]3)C2)C1	1840153400	NEPBWZMWRHCJKV-XOBRGWDASA-N	442.944	1.031	50	20	IDGD	
C[C@@H](Sc1ccccn1)C(=O)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1840393049	FFEWHFTYTSMJCV-FZKQIMNGSA-N	448.372	1.822	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)c2cnc(C)cn2)C1	1842417912	CWCKRYYFMIMYCI-UHFFFAOYSA-N	439.428	1.749	50	20	IDGD	
C=CCO[C@@H](C)C(=O)N1CC2(CCCN2C(=O)c2cc([N+](=O)[O-])ccc2OC(C)=O)C1	1844692042	ZRDXXJKMVWZBMY-AWEZNQCLSA-N	431.445	1.928	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@H](O)C(=O)N1CC2(CCCN2C(=O)[C@](C)(Cl)CCl)C1	1845168916	HVWBYNWRWPOPER-YVEFUNNKSA-N	438.352	1.312	50	20	IDGD	
CN(CC(=O)N1CC2(CCCN2C(=O)C(F)(F)Cl)C1)NC(=O)NCc1ccccc1	1846481455	ULIPNRCYYFRCBN-UHFFFAOYSA-N	443.882	1.368	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)/C(=C/c2ccccc2)NC(C)=O)c2ccccc2c1=O	14847117	RBAXRKAZWWNDIM-RGEXLXHISA-N	433.468	1.745	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cnc3c(cnn3C(C)C)c2)cc1	26772745	XGHSGVWHXWVRQD-UHFFFAOYSA-N	444.517	1.402	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)[C@H](C)NS(=O)(=O)c2ccc(Cl)cc2)c(C)c1	726101393	NBECWBMIIJLJKD-AWEZNQCLSA-N	438.937	1.883	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)NCCCN3CCC[C@@H]3C(=O)N(C)C)n[nH]2)cc1	726277232	JTZDUQVXRPHAEX-LJQANCHMSA-N	441.536	1.272	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)COc1ccc(Br)cc1)C(=O)N1CCCC[C@@H]1C	726615479	AUIDXSAARCRZFJ-STQMWFEESA-N	441.326	1.948	50	20	IDGD	
O=C(CN1CCC(C(=O)Nc2ccc3c(c2)OCO3)CC1)NNC(=O)c1cccs1	727325181	ORRHTYXXQBDDMD-UHFFFAOYSA-N	430.486	1.589	50	20	IDGD	
CC/C=C(\C)C(=O)N1CSC[C@@H]1C(=O)NNC(=O)c1cc(OC)c(OC)c(OC)c1	727982489	HZCCKXFDJIDTOR-WEKMIXOTSA-N	437.518	1.731	50	20	IDGD	
O=C(CNC(=O)[C@@H]1c2ccccc2C(=O)N1C1CC1)NNc1nc(-c2ccncc2)no1	728071584	BZFWGWYKEGIIFP-KRWDZBQOSA-N	433.428	1.050	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)C1CCN(C(=O)N2CCCC2)CC1	728210158	WBFMAKJCBAPSPX-UHFFFAOYSA-N	435.550	1.498	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3cc4ccccc4n3C)cc2)CC1	728216070	PFHXAGIIIPYBEY-UHFFFAOYSA-N	427.530	1.871	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2ccc(C(=O)NNC(=O)Cc3cccnc3)cc2)cc1	728892420	ZNAUPYZCVMHUEQ-UHFFFAOYSA-N	440.481	1.895	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)C1=NN(c2ccccc2)[C@@H](c2ccccc2)C1	729276046	VZCZNHUFKRNJDA-RDTXWAMCSA-N	429.502	1.079	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)Cc2c(C)nc3c(c(O)nn3C)c2C)cc1	729282555	BOQWCQWXKPFWGN-CQSZACIVSA-N	441.488	1.847	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@H](c2ccccc2)N2CCC(O)CC2)cc(OC)c1OC	729282809	JMYFLZUPCMBDPD-FQEVSTJZSA-N	443.500	1.671	50	20	IDGD	
CN(C)CCOc1ccc(CCNC(=O)NNC(=O)c2nnc(O)c3ccccc23)cc1	729615369	ABXAIEBCMVWLHS-UHFFFAOYSA-N	438.488	1.463	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NCc2ccc(Br)cc2)c2ccccc2c1=O	730130064	AGKRBXJILDZONV-UHFFFAOYSA-N	430.262	1.840	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=O)c2ccccc2OC)c1	731494374	OTSXMWNNPMJNAA-UHFFFAOYSA-N	441.893	1.348	50	20	IDGD	
CCN1CCN(Cc2ccccc2CNC(=O)NNC(=O)c2ccccc2OC)CC1	731499179	UWOKJXXGAVVGOQ-UHFFFAOYSA-N	425.533	1.977	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N[C@H](C)CN2CCN(C)CC2)cc1Br	732256120	VOGQMMDDOPTPIN-GFCCVEGCSA-N	428.331	1.038	50	20	IDGD	
CCCS(=O)(=O)Nc1cccc(C(=O)NNC(=O)CCN2C[C@@H](C)O[C@H](C)C2)c1	732260712	GQJNXIXGBIOTHH-HUUCEWRRSA-N	426.539	1.099	50	20	IDGD	
CCc1cc(N2CCC[C@@H](NC(=O)NNC(=O)COc3ccccc3[N+](=O)[O-])C2)ncn1	732914319	NVCSVWSGOLADFC-OAHLLOKOSA-N	443.464	1.325	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)nnn1-c1cccc([N+](=O)[O-])c1	733108400	PMTYEAWWOMTTIJ-UHFFFAOYSA-N	432.400	1.744	50	20	IDGD	
O=C(CN1Cc2ccccc2C[C@H]1C(=O)NCCc1ccc(F)cc1)NNC(=O)C1CC1	733194535	YWDJDUHUTVOMJH-NRFANRHFSA-N	438.503	1.469	50	20	IDGD	
COc1ccc(CN2CC[C@@H](NC(=O)NNC(=O)c3cccc(N(C)C)c3)C2=O)cc1	734545080	VXAIWSZOCMZMSH-LJQANCHMSA-N	425.489	1.506	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCN(c2cccc(Cl)c2)C1=O)c1csc(N2CCOCC2)n1	742036308	IPPPOLFNJAONIV-AWEZNQCLSA-N	449.920	1.447	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)[C@H]2CN(Cc3nc(O)c4ccccc4n3)CCO2)cc1	742241518	LIWZQOQTRGNSEA-LJQANCHMSA-N	435.484	1.560	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)Cn2cccc(C(F)(F)F)c2=O)cc1	743831532	YTXAIGUXJVLJNA-UHFFFAOYSA-N	432.380	1.124	50	20	IDGD	
C[C@H](NS(=O)(=O)c1cccc(C(=O)NNC(=O)N2CCOCC2)c1)c1ccccc1	745992821	LEDFPHUBCGLICE-HNNXBMFYSA-N	432.502	1.413	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)[C@H]1CCCN(C(=O)NC2CCCC2)C1	746269456	AWLLQBXGAJUGMV-AWEZNQCLSA-N	440.545	1.206	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2c(C(F)(F)F)n[nH]c2C)c1	746578533	AWGILGPWVISPFL-UHFFFAOYSA-N	447.439	1.842	50	20	IDGD	
CC(C)(C)OC(=O)[C@@H]1CN(C(=O)NNC(=O)c2ccc(Br)s2)CCO1	747490379	JYQJRQJPMPQENC-VIFPVBQESA-N	434.312	1.908	50	20	IDGD	
Cn1ccnc(NNC(=O)CC[C@@H]2NC(=O)N(c3ccc(Cl)c(Cl)c3)C2=O)c1=O	747938029	NTNUBMBZKIUHQU-LBPRGKRZSA-N	439.259	1.435	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)[C@H]3CCCN3C3CCCC3)cc2)CC1	749235208	DNNOCYXKRLMDQL-HXUWFJFHSA-N	435.594	1.473	50	20	IDGD	
CC[C@@H](NC(=O)NNC(=O)c1nn(-c2ccccc2)cc1O)c1nnc2n1CCCCC2	749580410	UALKEXAMYSWQAG-OAHLLOKOSA-N	438.492	1.991	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)c1cc(O)nc2c(Br)cccc12	749950784	WPQBKMFZLLKHFW-UHFFFAOYSA-N	433.218	1.487	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)N[C@H]1CCN(CCCc2ccccc2)C1=O	750266038	GZURGDBBLWQULM-SFHVURJKSA-N	440.500	1.638	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N[C@H](C)c2nc(C)no2)cc1	751395833	FPHNZZUWFUFVIZ-YDRQLGOLSA-N	449.471	1.910	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)CCc2ccc(F)cc2F)cc1	751549007	QZUWLISIHAPGTM-UHFFFAOYSA-N	425.457	1.674	50	20	IDGD	
O=C(NCCc1cccs1)NNC(=O)c1cc(Cn2cc(Br)cn2)on1	751716722	JIMJKHKBOOCBGB-UHFFFAOYSA-N	439.295	1.930	50	20	IDGD	
Cc1noc(C)c1[C@@H](C)CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	752699835	IEQOPZFAOLNOFQ-ZDUSSCGKSA-N	449.533	1.824	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)N[C@H]1CC(=O)N(c2cccc(C(F)(F)F)c2)C1	753034105	CSFKBZNLTOCDMJ-YPMHNXCESA-N	432.399	1.193	50	20	IDGD	
CS[C@@H](CNC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)C(C)(C)C	753283590	HUVSKCLPSSFRFS-HNNXBMFYSA-N	444.627	1.422	50	20	IDGD	
Cc1ccc(SCC(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c(C)c1	753568293	MOJQSVRDKRAEJZ-QGZVFWFLSA-N	430.482	1.926	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)N[C@@H]2CCN(Cc3ccc(C#N)cc3)C2=O)nc2ccccc21	753740143	VUFKXOMZUCKAKB-GOSISDBHSA-N	445.483	1.119	50	20	IDGD	
Cc1cc(F)ccc1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	755431717	OGQKYBMSZKAOSN-UHFFFAOYSA-N	436.465	1.622	50	20	IDGD	
CC(=O)Nc1cccc(NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)c1C	755624603	JXVXWHNAORCHJR-UHFFFAOYSA-N	447.517	1.735	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)Nc2cnn(CC(=O)NC3CC3)c2)cc1	756795469	KHRBWDDXEUHEQH-CYBMUJFWSA-N	430.465	1.181	50	20	IDGD	
Cc1cc2c(cc1NC(=O)NNC(=O)c1ccc(S(=O)(=O)N3CCCC3)cc1)OCO2	757979294	QMCSVQCQFLIBNI-UHFFFAOYSA-N	446.485	1.975	50	20	IDGD	
CN(NC(=O)c1ccnc(-n2ccnc2)c1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758785196	CIZIRDVUWUIUMX-UHFFFAOYSA-N	429.481	1.517	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)[C@H]2CCCN2C(=O)c2ccc(OC)cc2OC)nc1	759728707	HIQMSGNOEUKCJM-MRXNPFEDSA-N	428.445	1.633	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)[C@H]2CN(C(=O)OC(C)(C)C)CCC2(F)F)C[C@@H](C)O1	760787640	LNNCNCKPIAVKMO-RBSFLKMASA-N	448.511	1.525	50	20	IDGD	
O=C(NNc1nccc(N2CCOCC2)n1)[C@@H]1CCCN1c1ncnc2sccc12	762869338	WLFCQLUISJSZAN-AWEZNQCLSA-N	426.506	1.430	50	20	IDGD	
Cc1cc(C)n(-c2ccc(Cl)c(C(=O)NNc3nccc(N4CCOCC4)n3)n2)n1	762869650	ZFHCNCDEHUNYBJ-UHFFFAOYSA-N	428.884	1.921	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)Nc3nccs3)cc2)c1	763041179	ZMGGBZRVHAWNBR-UHFFFAOYSA-N	427.467	1.890	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)[nH]n1)C(=O)Nc1cccc(NC(=O)C2CC2)c1	763604347	JREWRZPEJMHLHD-UHFFFAOYSA-N	432.440	1.825	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ncn(Cc3ccccc3)n2)c2ccccc2n1	763617126	UOGHNMJEPAZEOX-UHFFFAOYSA-N	429.440	1.583	50	20	IDGD	
CCn1nc(NC(=O)C(=O)NNC(=O)COc2cccc(C(F)(F)F)c2)cc1C1CC1	763638588	BRNRKYSOONCDLN-UHFFFAOYSA-N	439.394	1.964	50	20	IDGD	
CC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)cc1Cl	763674955	RADOXKFHJJOBHO-UHFFFAOYSA-N	429.820	1.335	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccnc2OCc2ccccc2)cc1	763681830	OSTIMSHQQQQHOD-UHFFFAOYSA-N	445.435	1.697	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)c1ccc2c(c1)C[C@@H](c1ccccc1)OC2=O	763818386	KOPVLVIVKUVUBJ-FQEVSTJZSA-N	444.447	1.727	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)CSCc1ccc(Br)cc1	763824303	NAVZULANHOJAKG-UHFFFAOYSA-N	437.319	1.655	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cccc([N+](=O)[O-])c2C)cc1	763862407	XBAKBGATQFIDQN-ZDUSSCGKSA-N	430.417	1.855	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccc(N2CCCC2=O)c(F)c1	763866647	XHUBMIIZJHUGFM-LBPRGKRZSA-N	446.410	1.645	50	20	IDGD	
CCN(Cc1ccccc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccccc1F)C(C)=O	763866850	XZSVIRKGKGVVQA-AWEZNQCLSA-N	444.463	1.748	50	20	IDGD	
COc1cc(OC)c(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)on2)cc1F	764011661	KEUTXRPLGUJHIY-UHFFFAOYSA-N	428.376	1.898	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2c3c(nn2-c2ccccc2)CCC3)c1O	764132324	UJIZFKVWEXAGAG-UHFFFAOYSA-N	435.440	1.475	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2cc(C(F)(F)F)ccc2N(C)C)c1O	764132389	URFXZXZYDSFRQA-UHFFFAOYSA-N	440.378	1.885	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccc([S@@](=O)C(F)(F)F)cc1	764136567	SIOFAWGSMCMOKV-SSEXGKCCSA-N	443.403	1.651	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2O1)C(=O)Nc1ccnn1-c1cccc(Cl)c1	764153961	NPGYEICKHIZGLC-MRXNPFEDSA-N	425.832	1.615	50	20	IDGD	
COC(=O)[C@@H]1CCCCN1C(=O)c1cccc(NC(=O)C(=O)NNC(=O)CC(C)(C)C)c1	764198627	MFHKAFFVYNLCPN-INIZCTEOSA-N	446.504	1.376	50	20	IDGD	
C[C@H](c1ccc(NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)cc1)N1CCOCC1	764239530	NYVVHCRJJSTVEO-QGZVFWFLSA-N	449.511	1.821	50	20	IDGD	
Cc1nc(N2CCOCC2)ccc1NC(=O)C(=O)NNC(=O)c1cccc(OC(F)F)c1	764249571	BIUVMHCFULCZFN-UHFFFAOYSA-N	449.414	1.228	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1ccc(OC(F)F)c2ncccc12	764274926	GPZWEBZENBYBJE-UHFFFAOYSA-N	446.366	1.707	50	20	IDGD	
O=C(NNC(=O)c1cc2ccccc2o1)C(=O)Nc1ccccc1CN1C(=O)CCC1=O	764342392	NPLJESHCSYZCTQ-UHFFFAOYSA-N	434.408	1.482	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)C(=O)Nc1ccc(C(=O)NC2CCCC2)cc1	764368497	XFNBTAQZNJNXRL-UHFFFAOYSA-N	438.484	1.662	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1cccc(-n2ccnn2)c1	764392861	MGFSDIMOPSTIHA-UHFFFAOYSA-N	426.458	1.154	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2cnccn2)cc1S(=O)(=O)N1CCCCCC1	766257018	PAXVNVBZXDQUMQ-UHFFFAOYSA-N	432.506	1.432	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)c2ccc(N3C(=O)CCC3=O)c([N+](=O)[O-])c2)cc1	768223343	CAFKUCFAJRAGBF-UHFFFAOYSA-N	440.416	1.781	50	20	IDGD	
CC1(C)CCC[C@]2(C1)NC(=O)N(CC(=O)NNC(=O)c1cc(-c3cccs3)[nH]n1)C2=O	768572761	YMSWMZGDMFREEF-HXUWFJFHSA-N	444.517	1.790	50	20	IDGD	
CCN(CC)C(=O)N1CCC(C(=O)NNc2c(OC)cccc2S(C)(=O)=O)CC1	768611564	IDYQRWXSEGYMEF-UHFFFAOYSA-N	426.539	1.716	50	20	IDGD	
C=CCCCCNC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	771375356	DPYUQWXOOOWIMY-UHFFFAOYSA-N	438.550	1.327	50	20	IDGD	
CC(=NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1)c1cnccc1C	771557928	SLJLTDXVKOZLDV-UHFFFAOYSA-N	429.546	1.545	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)c1cn(-c2ccc(C(F)(F)F)cn2)nn1	772069481	QMHBWNYFDDEQDK-JTQLQIEISA-N	428.371	1.420	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)[C@@H]1CCCCN1C(=O)c1ccc(O)nn1	772962380	ADYZJLFBQSGATB-WBMJQRKESA-N	447.879	1.445	50	20	IDGD	
CCC(=O)N1CC[C@@H](C(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)C1	773265637	NHWREIZUVXGDFW-LJQANCHMSA-N	447.499	1.408	50	20	IDGD	
CC(C)c1nccnc1NNC(=O)C(=O)Nc1cccc(Cn2nc3ccccn3c2=O)c1	773992225	MQIFENGXDKSAGK-UHFFFAOYSA-N	446.471	1.540	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)NCc2ccc(S(C)(=O)=O)c(C(F)(F)F)c2)n1	775212684	QWGHEUVJNKSWEO-UHFFFAOYSA-N	447.439	1.453	50	20	IDGD	
Cc1cccc2c(=O)c(C(=O)NNC(=O)CN3CCN(C(=O)c4ccccc4)CC3)c[nH]c12	776176860	NXCAIBCRXKCMDJ-UHFFFAOYSA-N	447.495	1.056	50	20	IDGD	
Cc1cc(C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)nn1-c1ccc(F)cc1	777151615	CPSHVDWONXMHDG-UHFFFAOYSA-N	441.375	1.846	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H](CC(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)C1	778438578	CVNGXGWBZNJBHP-HNNXBMFYSA-N	430.461	1.510	50	20	IDGD	
O=C(CN1CCC[C@H](S(=O)(=O)N2CCc3ccccc32)C1)NNC(=O)c1ccccc1	779624983	SKLJUYBDDXYHEB-IBGZPJMESA-N	442.541	1.305	50	20	IDGD	
Nc1c(Cl)c(Cl)nc(C(=O)NNS(=O)(=O)c2cn3c(n2)CCCC3)c1Cl	779830468	TXEDUILENIVLNN-UHFFFAOYSA-N	439.712	1.780	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)N2CCC(C(=O)NN=c3cc[nH]cc3)CC2)cc1	780761078	GJVXFMGWMBOYSB-UHFFFAOYSA-N	432.502	1.224	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)[C@@H]2CC(c3ccccc3[N+](=O)[O-])=NO2)o1	781949588	MDDFJFSTTYRJJH-SFHVURJKSA-N	429.433	1.984	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)NCc1ccccc1CN1CC[C@@H](O)C1	781956604	WBMZVFMGVPXUNF-LJQANCHMSA-N	442.516	1.561	50	20	IDGD	
N#C/C(=C\c1cn(Cc2cccnc2)nn1)C(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1	783700503	SAHDCIFVPUOHPR-LDADJPATSA-N	444.455	1.885	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)C(=O)Nc1ccc(Br)cc1Cl	784004163	JOCXQRIMDQOAQJ-UHFFFAOYSA-N	443.641	1.211	50	20	IDGD	
O=C(NNc1ccc(OC(F)F)cc1)C(=O)Nc1cccc(C(=O)N2CCOCC2)c1	784309212	ZIBXJNDJJCWGTC-UHFFFAOYSA-N	434.399	1.842	50	20	IDGD	
COc1ccc(C(=O)CCC(=O)NNC(=O)Cn2cnc3ccccc32)c(OC)c1OC	784586721	YHBOZNSFVIXXRU-UHFFFAOYSA-N	440.456	1.873	50	20	IDGD	
CN1CCN(CC(=O)N(C)c2ccc(NC(=O)C(=O)NNc3ccc(F)cc3)cc2)CC1	784790250	SLIOBUNPTUJVAW-UHFFFAOYSA-N	442.495	1.118	50	20	IDGD	
COC(=O)c1ccccc1NC(=O)C(=O)NNc1ccccc1S(=O)(=O)NC(C)(C)C	784833319	ICHVRLDZDFPGOC-UHFFFAOYSA-N	448.501	1.632	50	20	IDGD	
O=C(NNc1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(S(=O)(=O)N2CCCC2)cc1	784833898	VIMWYOOGIBYAQS-UHFFFAOYSA-N	433.446	1.461	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)C(=O)Nc2ccc(C)c(N3CCCS3(=O)=O)c2)c1	784851154	HHMSZZNDTDKHKK-UHFFFAOYSA-N	446.485	1.403	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CNC(=O)c2ccco2)cc(Br)c1OC	786056103	XDQSVPCPOKOWTK-UHFFFAOYSA-N	426.223	1.250	50	20	IDGD	
C[C@@H]1[C@@H](C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)CCN1C(=O)OC(C)(C)C	786251654	OUIIZVVLBGLWFG-ZBFHGGJFSA-N	432.525	1.486	50	20	IDGD	
CCS(=O)(=O)CCn1cc(C)c(NC(=O)C(=O)NNc2ccc(OC(F)F)cc2)n1	787554264	BMUDYKVSOOBQDY-UHFFFAOYSA-N	445.448	1.309	50	20	IDGD	
CN1CCN(C(=O)NNC(=O)[C@H]2CCCN2C(=O)c2cc(Cl)cc(Cl)c2)CC1	788167250	ZOXDQEOJYBWKRZ-OAHLLOKOSA-N	428.320	1.586	50	20	IDGD	
Cc1ccc2[nH]cc(C(=O)NNC(=O)c3sc(N4CCOCC4)nc3C)c(=O)c2c1	788266534	DDXAAONFRSKGMH-UHFFFAOYSA-N	427.486	1.513	50	20	IDGD	
Cc1ccc(CN2CC[C@@H](NC(=O)NNC(=O)c3nnc(O)c4ccccc34)C2=O)cc1	790693374	BHQMHRWXRBUKFP-QGZVFWFLSA-N	434.456	1.389	50	20	IDGD	
COc1ccc(OC)c(C2=NO[C@H](C(=O)NNC(=O)c3ccc(OC)c(OC)c3)C2)c1	791450890	YNJBOWVFGNDIBL-IBGZPJMESA-N	429.429	1.675	50	20	IDGD	
CCCn1nc(C(=O)NNS(=O)(=O)c2ccc(C#N)c(F)c2)c2ccccc2c1=O	793350440	OGXVIYZRKWAOIN-UHFFFAOYSA-N	429.433	1.441	50	20	IDGD	
O=C(CCn1cnccc1=O)NNC(=O)c1cn(-c2ccccc2)nc1-c1ccccc1	794193970	MFDDUYOGBRTXCT-UHFFFAOYSA-N	428.452	1.947	50	20	IDGD	
N#Cc1ccc(Cl)c(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c1	794741845	PVBANXMMQYHDJM-UHFFFAOYSA-N	448.888	1.307	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CC[C@@]3(CCN(Cc4ccccc4)C3)C2)n1	796445424	UKQDFSHNGNEVIB-JOCHJYFZSA-N	427.574	1.739	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2F)c(OC)c(C)c1OC	796992136	NRNUAYGHPJVLIT-UHFFFAOYSA-N	435.408	1.325	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2cc(Cl)ccc2OC[C@H]2CCOC2)n1	797370231	WVJDEGPMNMSAJL-ZDUSSCGKSA-N	432.864	1.858	50	20	IDGD	
N#CCC1(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)CC1	797564437	BCAZMEFWMZRTPS-UHFFFAOYSA-N	441.513	1.803	50	20	IDGD	
Cn1cnc2cccc(C(=O)NNC(=O)c3ccc(S(=O)(=O)N4CCCC4)cc3)c21	798154056	SRDAZJFSESYHQT-UHFFFAOYSA-N	427.486	1.433	50	20	IDGD	
Cc1ccc(O)c(C(=O)Nc2nc(CC(=O)NNC(=O)NCC(F)(F)F)cs2)c1	798316369	XCGKRIOCOUSFSH-UHFFFAOYSA-N	431.396	1.845	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@H]2C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1	798437733	NPJVUDOLLWFACA-FQEVSTJZSA-N	433.468	1.947	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)c(C)c(OC)c1	800625292	MRPFWNPIWSRXFX-UHFFFAOYSA-N	429.458	1.864	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2Cl)cc1	802067106	LKHWDWRGKZDFMS-UHFFFAOYSA-N	435.853	1.186	50	20	IDGD	
COC(=O)c1c(F)cc(NC(=O)C(=O)NNC(=O)COc2cc(C)cc(C)c2)cc1F	802565697	GNYWBEHIUJGKTP-UHFFFAOYSA-N	435.383	1.533	50	20	IDGD	
Cc1ccc(N2CCN(C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)CC2=O)cc1	805068838	SAELTRXEYPAICP-UHFFFAOYSA-N	437.504	1.091	50	20	IDGD	
NC(=O)c1cccc(NC(=O)C(=O)NNc2ccc(-c3cccc(C(F)(F)F)c3)nn2)n1	807299314	SQVSGKNRJXBIQH-UHFFFAOYSA-N	445.361	1.738	50	20	IDGD	
CN1CCC[C@@H](N(C)C(=O)c2ccc(NC(=O)C(=O)NNc3ncccc3F)cc2)C1	807300604	GUBUYNHHLCIHHO-MRXNPFEDSA-N	428.468	1.469	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)N[C@H](c2nncn2C)C(C)C)c1	807431312	DCDAMFYDIBOXEV-ZDUSSCGKSA-N	425.287	1.928	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)COc2cc(C)ccc2C)cc2[nH]ccc12	808934968	ZRSOVWRKMZUWDQ-UHFFFAOYSA-N	438.440	1.736	50	20	IDGD	
COC[C@@]1(C(=O)NNC(=O)c2nnc(O)c3ccccc23)CCN(C(=O)OC(C)(C)C)C1	809933153	UFEUBVIYPUQBNG-OAQYLSRUSA-N	445.476	1.370	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)CNS(=O)(=O)c2cccnc2)cc1OC	809980465	NPRJZHBPFYHUJF-UHFFFAOYSA-N	436.490	1.009	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1)NNC(=O)CC(F)(F)F	810179774	YBGWHDZGBOAFRM-UHFFFAOYSA-N	441.737	1.737	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)NCC(=O)NNc2ccc(Br)nc2)cc1	810396499	XAPCPIPARPMCCU-UHFFFAOYSA-N	442.295	1.224	50	20	IDGD	
CC[C@@H]1[C@@H](C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)CCN1C(=O)OC(C)(C)C	810619048	LAAYZUVZHZSCMH-UONOGXRCSA-N	443.545	1.877	50	20	IDGD	
CCn1c(O)nc2cc(C(=O)NNc3ccc(S(=O)(=O)N(C)C)cc3)ccc2c1=O	812729850	VYCRMCBHGGQGFT-UHFFFAOYSA-N	431.474	1.129	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)N[C@@H]1CC(=O)N(c2ccccc2F)C1	812930629	QOSJFLXFHJEFNT-CYBMUJFWSA-N	438.419	1.467	50	20	IDGD	
COC(=O)Cc1occ(C)c1C(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	813455389	AJQDIFBQCNOAGC-UHFFFAOYSA-N	438.481	1.647	50	20	IDGD	
CNC(=O)Oc1cccc(NC(=O)C(=O)NNC(=O)COc2ccc(C(C)(C)C)cc2)c1	815564611	NVFZTYPKCBPLHV-UHFFFAOYSA-N	442.472	1.867	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)COCc2ccccc2)cc1)[C@H]1C[C@H]1C	815570060	PLSROJDWJOUGHV-QRWLVFNGSA-N	438.484	1.751	50	20	IDGD	
O=C(COC(=O)c1ccc2c(c1)NC(=O)CCS2)NNC(=O)c1ccc([N+](=O)[O-])cc1	843337350	VYBDWYLHIGYDDF-UHFFFAOYSA-N	444.425	1.647	50	20	IDGD	
Cc1cc(OCc2ccc(C(=O)NNC(=O)CN(C)S(C)(=O)=O)cc2)ccc1Cl	914711425	ZNGGCLGCYHLIJF-UHFFFAOYSA-N	439.921	1.880	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)cc1OC	914998934	RCYCUYTZDKLAQG-UHFFFAOYSA-N	442.403	1.851	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1cn(-c2ccc(C)cc2)nn1	915525270	MWYDOIHAHDYNGX-UHFFFAOYSA-N	443.847	1.856	50	20	IDGD	
CC(=NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)c1ccc(N2CCOCC2)cc1	916305711	PKVGHNDZKGQTFI-UHFFFAOYSA-N	430.530	1.928	50	20	IDGD	
C[C@@H]1CCCCN1[C@H](C)CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	916446742	AVBLBTNZSQFXBD-HUUCEWRRSA-N	425.555	1.144	50	20	IDGD	
CN(C)[C@H](CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)C1CCCCC1	916447850	GPDOGPINDZGCCO-GOSISDBHSA-N	439.582	1.391	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NC[C@H](C2CCCCC2)N(C)C)nc1	916448669	MISMFKPNPPAXLE-QGZVFWFLSA-N	426.587	1.905	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)NC[C@]1(N2CCOCC2)CCSC1	916636817	MFLXJOIWBQVZMW-IFXJQAMLSA-N	426.514	1.131	50	20	IDGD	
O=C(COC(=O)CCc1nc2ccccc2o1)NNC(=O)[C@@H]1COc2ccccc2O1	917235544	RVXNUCFVIJZAMA-KRWDZBQOSA-N	425.397	1.291	50	20	IDGD	
O=C(COC(=O)[C@@H](CO)NC(=O)c1ccccc1)NN=C(c1ccccc1)c1ccccc1	917500629	WRMAICJTDAQKCS-OAQYLSRUSA-N	445.475	1.889	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1	918219622	LZTAUXVLHLIFBH-UHFFFAOYSA-N	434.443	1.835	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2ccc(CN3CCC(CO)CC3)cc2)cc1OC	918758510	YPATWERSLXBNQU-UHFFFAOYSA-N	427.501	1.983	50	20	IDGD	
C[C@H]1CCC[C@@H](CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)C1	919916157	PLJGJVPEJYVRSM-JKSUJKDBSA-N	438.550	1.478	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NN=C(CNS(C)(=O)=O)c2ccccc2)CC1	1116428651	OOPQYPOXISEXDD-UHFFFAOYSA-N	438.550	1.703	50	20	IDGD	
CCOC(=O)C1=NN(c2ccccc2)[C@H](C(=O)NNC(=O)c2cncn2-c2ccccc2)C1	1251717135	WPNBFELSFXGIRC-IBGZPJMESA-N	446.467	1.831	50	20	IDGD	
Cc1nn([C@@H]2CCS(=O)(=O)C2)c2nc(C3CC3)cc(C(=O)NNC(=O)NCC3CC3)c12	1317993912	GQYGHIZRGCHFTD-CQSZACIVSA-N	446.533	1.331	50	20	IDGD	
O=C(CCC(=O)N1CCN(c2ccccn2)CC1)NNC(=O)c1cncn1-c1ccccc1	1319373685	YFFISLVBCXZRHF-UHFFFAOYSA-N	447.499	1.157	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N[C@@H]2CCCN(C(=O)c3ccccc3)C2)cc1OC	1322308612	OSLYITXAFQRJPZ-QGZVFWFLSA-N	426.473	1.953	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)N[C@H](C)COc1ccccc1F	1337782720	XNQAKGKBBGOMBY-GFCCVEGCSA-N	437.497	1.839	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)NCCCN1C(=O)NC(C)(C)C1=O	1346613489	IIDGIXDFFCHLFE-AWEZNQCLSA-N	441.488	1.658	50	20	IDGD	
O=C(c1cccn2ccnc12)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1778580916	HRZRDSGEPNMEKV-DYVFJYSZSA-N	425.258	1.468	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)Nc2cnccn2)C1	1779393930	FMRMWZRPDZSWKX-UIVXKWKOSA-N	439.944	1.045	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Br)C2)c1n[nH]cc1[N+](=O)[O-]	1779603196	NJKYFXTUPJXXKX-IFUGULHKSA-N	448.249	1.136	50	20	IDGD	
CCOc1ncc(Cl)cc1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](Cl)COC)CCO2	1779686784	CRYQMKUEWBJELH-KXBFYZLASA-N	446.331	1.831	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](COC(C)=O)OC(C)=O)C2	1780704956	YUNZKQKZGHSYHT-TVKQPGBESA-N	446.928	1.013	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)Cc3ccc(C(=O)OC)s3)C2)C1	1780900281	OIKHCZTXXWDSNB-LIRRHRJNSA-N	428.938	1.925	50	20	IDGD	
O=C(c1cnc2ccccn12)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781330461	XOUGSYKGGHPVJT-RHSMWYFYSA-N	425.258	1.468	50	20	IDGD	
COc1nc(C)ccc1C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781332167	UYDZSJZYBDBENO-GUYCJALGSA-N	430.274	1.533	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc[n+]([O-])cc1)C2	1781998033	RBZJQOQJQBFSJT-DDUZABMNSA-N	426.311	1.231	50	20	IDGD	
CC(C)CNC(=O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)Br)C1	1781998537	AYXACBZKOCLCJL-PMUMKWKESA-N	432.359	1.056	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CC1CCN(C)CC1)C2	1782167352	MCDQYVXZEADXHH-WAOWUJCRSA-N	429.989	1.486	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cn(C)nc1C(F)F)C2	1782173183	ZPZMNUQQRPHDDC-IQUTYRLHSA-N	448.898	1.739	50	20	IDGD	
COC(=O)NCC(=O)N1CCO[C@]2(CCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1	1782867157	PVAUVFSMOGVMKI-JTVVXKTLSA-N	448.426	1.058	50	20	IDGD	
Cc1nccn1CCCC(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](C)Br)C2)C1	1783539819	OCODWOIVEKZACH-RDTXWAMCSA-N	427.343	1.585	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3c[nH]c4ccc(OC)cc34)CCO2)C1	1783877956	SFOHKTKXDITEFW-UTKZUKDTSA-N	435.908	1.874	50	20	IDGD	
CC#C[C@@H](CC(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](Cl)COC)C2)C1)c1ccc(O)cc1	1783879150	PDCQPJHKXULPFL-GREBRCKQSA-N	448.947	1.973	50	20	IDGD	
O=C1CSc2cc(C(=O)N3CCO[C@]4(CCN(C(=O)C(Cl)Cl)C4)C3)ccc2N1	1783945305	GAWIYYOYEICHBL-SFHVURJKSA-N	444.340	1.978	50	20	IDGD	
COc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]3C2)n(C)n1	1783968983	IGRYEZCTAMHQIN-OSFYFWSMSA-N	443.342	1.053	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)Cc3cnc(C)s3)C2)C1	1784440861	UHVWLRWPDNECEG-PBHICJAKSA-N	430.368	1.997	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)COc3ccc(F)cc3)[C@H]2C1	1786492190	MTGGPRDHPZKMKN-RUGDWHBFSA-N	428.888	1.438	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3cncnc3)[C@H]2C1	1787044209	PPTYXOPGTHJSCD-QAETUUGQSA-N	439.354	1.562	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)[C@H]2C1	1787507596	HSMKZLZJYVUKSE-HHWFLTMWSA-N	437.928	1.118	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3cncnc3)C[C@@H]21	1789866607	UZXQIFJAFJSSHS-FPXQBCRKSA-N	429.348	1.625	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4nccn4c3)C[C@@H]21	1791055639	AXSLESIVLDEZAW-TUUVXOQKSA-N	435.322	1.711	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4nc[nH]c4c3)C[C@@H]21	1791056417	XQKQWNHTFKBNNE-YSLLHCQFSA-N	435.322	1.940	50	20	IDGD	
Cc1nccn1[C@@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)Br)[C@H]2C1	1791064604	APRAENZAEJHMIM-OSZUESSQSA-N	427.343	1.516	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nc3ccccc3[nH]1)C2	1792868032	NRSUUCDVGVGRPG-JFILPPLUSA-N	435.322	1.797	50	20	IDGD	
CN1CC(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C1	1794143746	QMOABBAZAGACHQ-FZKCQIBNSA-N	428.961	1.318	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H]1CCOC1)C2	1794143893	YRSFXWGTXOQHHU-LJIZCISZSA-N	429.945	1.793	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)[C@@H]1[C@H]2Sc3ccccc3[C@@H]21	1796188892	YMTNEJYEUKCYPT-JUOVRFQDSA-N	448.353	1.506	50	20	IDGD	
COc1cc(F)ccc1CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1	1796189765	XXASJBBPGHXQHK-ACDBMABISA-N	440.280	1.009	50	20	IDGD	
COc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Cl)c(F)c(OC)c1F	1796366760	CLHPIAIMHGCQDQ-XOZCIVSQSA-N	436.814	1.720	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(Br)c(O)c1)C2)[C@H](F)Cl	1796366843	ISSCTMYLXGRGLT-DJBIQUGXSA-N	435.677	1.892	50	20	IDGD	
CCc1c(Br)c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](O)CCl)C3)nn1C	1796408091	UWUKWOWAKXDXPZ-LSCVPOLPSA-N	447.761	1.597	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2cnccc2n1	1796891696	OPNTVKVRPHIQQF-LJGDNWOOSA-N	447.333	1.864	50	20	IDGD	
Cc1ccc2[nH]c(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)c3ccc(B(O)O)cc3)C4)cc2c1	1797410588	WQPXVDJKZCUMEH-ACDBMABISA-N	431.301	1.722	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CN(Cc2ccccc2)CCO1	1797853293	CDLLCIOCPUUZNF-SSTJLMRISA-N	449.979	1.779	50	20	IDGD	
Cc1ccc(OC(C)(C)C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)C(Cl)Cl)C3)nc1	1799095075	WOVZZFDIGOTRAX-AGGWBTHJSA-N	430.332	1.941	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2)C1CCN(c2ccc(F)cn2)CC1	1800290170	JYZLXKMEXSDCMO-LTCOOKNTSA-N	442.894	1.561	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](Br)Cc1ccccc1)C2)[C@H]1C[C@@H]1F	1800378937	WAWOTSUDZBSREV-COZGXFGHSA-N	439.325	1.940	50	20	IDGD	
O=C([C@H](F)Br)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(Cl)(Cl)Cl	1800585254	XOPFJNAGGDXJNY-YWIQKCBGSA-N	426.497	1.637	50	20	IDGD	
COc1ccc(OCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)Br)cc1	1800754250	KZQUMCYDQNCSIA-ZUMXRPEOSA-N	441.322	1.447	50	20	IDGD	
Cc1cc(C)n(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Br)C3)n1	1801247651	RYBQUKRLLMKFRH-XRGAULLZSA-N	431.306	1.170	50	20	IDGD	
C[C@@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCC(=O)NN(C)C)C2)[S@](=O)c1ccccc1	1801274575	BYSQYGMHLGEHLT-KIDKYUGBSA-N	448.589	1.194	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)COCCOCCOCCOC	1802097378	HYBITFSXEOSSKK-XMTFNYHQSA-N	434.961	1.338	50	20	IDGD	
COC[C@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccnc1CS(C)(=O)=O)C2	1802272526	ABFRTTRNUXXCJN-FQLMCAECSA-N	443.953	1.132	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cnn3cccc(F)c23)[C@H]1c1cccnc1)[C@H](O)CCl	1803146878	CWFYMLCEXMDGBR-QGTPRVQTSA-N	445.882	1.788	50	20	IDGD	
O=C(CCBr)NC[C@H]1CCN(C(=O)c2cccc(=O)n2O)[C@@H]1c1cccnc1	1806340018	XNBMNVPDGGSHLY-RDTXWAMCSA-N	449.305	1.585	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)c2cccc(F)c2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807362844	WTNRDCJQBQVNBM-KNQAVFIVSA-N	447.275	1.534	50	20	IDGD	
O=C(Cc1cccs1)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1807544165	PZTPRXPBHLFMPP-PGRDOPGGSA-N	449.341	1.385	50	20	IDGD	
C[C@H](C(=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Cl)[C@@H]1c1cccnc1)N1CCN(C)CC1	1807862108	AYBKPPJCOXHKEH-BZZMCLGOSA-N	425.936	1.258	50	20	IDGD	
O=C(CCCc1ccncc1)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1	1809968726	BRZCNHXZEAKSPO-UHFFFAOYSA-N	449.360	1.629	50	20	IDGD	
COC(=O)C1(C(=O)N2CC[C@H](CNC(=O)CO[Si](C)(C)C)[C@H]2c2cccnc2)CC1	1810548995	WQXBVZSHHRDWLU-SJLPKXTDSA-N	433.581	1.892	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)no1	1813070427	IWZOTNTURTZXSK-OXQOHEQNSA-N	428.493	1.071	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)cn1C	1813071439	SAPQCOZTSFISKN-GCJKJVERSA-N	440.548	1.421	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)N1CC[C@H](CNC(=O)C(Cl)Cl)[C@@H]1c1cccnc1	1813078781	SFVCYLPCJCJIFS-BNOWGMLFSA-N	430.336	1.599	50	20	IDGD	
O=C(O)CSCC(=O)NC[C@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1	1813084543	ZUJLPAIGPFCLEZ-DYVFJYSZSA-N	444.351	1.690	50	20	IDGD	
O=C(CCc1ccco1)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1	1815350057	FLCDQFMTQIJOJB-OAHLLOKOSA-N	439.302	1.275	50	20	IDGD	
Cc1cncc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)c1	1815354664	ADNSVOZVBJTVKZ-INIZCTEOSA-N	436.302	1.066	50	20	IDGD	
Cc1ccc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)nc1	1815354808	GIFILSBXEKDVOU-OAHLLOKOSA-N	436.302	1.066	50	20	IDGD	
Cc1ccc(CC(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)cn1	1815976635	VOJGVABUCMYWGU-HXUWFJFHSA-N	447.304	1.342	50	20	IDGD	
COc1cnc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)[C@@H](O)CCl)[nH]n2)c(F)c1	1816212524	SKJKATNLTLRBPQ-KBPBESRZSA-N	425.848	1.858	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H]2CCC(=O)N2)n[nH]1	1816972713	FWWAXAHEBSLCQJ-GMXVVIOVSA-N	426.315	1.854	50	20	IDGD	
C[C@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](F)Cl)[nH]n1)[C@H]1SC(=N)NC1=O	1818099687	YXNHQZMSDGCKGB-CWFXUQSRSA-N	430.893	1.739	50	20	IDGD	
C[C@H](Cn1cncn1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](F)Br)CC2	1820072920	VPWXYFGYGTVKCC-KBVBSXBZSA-N	445.318	1.673	50	20	IDGD	
O=C(NCC(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H](O)CCl)CC1)c1cccs1	1824180667	LKGIKOJVDDPEEH-JKSUJKDBSA-N	441.981	1.697	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](O)Cc1ccccc1)CC2	1826004410	JAGDRGBASJCVKB-IJEWVQPXSA-N	437.949	1.913	50	20	IDGD	
CCS(=O)(=O)CC(=O)N1CCC([C@H]2CCCCN2C(=O)CCBr)CC1	1826353169	OTYPZDDSDSGKGP-OAHLLOKOSA-N	437.400	1.826	50	20	IDGD	
Cc1cc(C)nc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)c1	1827317736	QBKOREKINOEQGA-QHCPKHFHSA-N	449.360	1.925	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3(Br)CC3)C2)C1	1830363591	DNNATWISBNPFGR-INIZCTEOSA-N	437.762	1.635	50	20	IDGD	
Cc1cnoc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2	1830543143	KMQXMZILFARFIZ-SJCJKPOMSA-N	430.299	1.084	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2[C@H]3C=CS[C@H]32)CC1	1831153160	OVQOANRCJIYITC-PLACYPQZSA-N	440.374	1.475	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)CBr)C2)C1	1831639341	QOHVKBFMBKLKAL-JKIFEVAISA-N	439.778	1.881	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CNC(=O)C(F)(F)F)CC1	1831834368	COPHBCOEEWGEOT-UONOGXRCSA-N	441.878	1.538	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ncc(F)cc1F)CCO2	1831966160	WRDNZJSKYSRGNM-IBGZPJMESA-N	443.523	1.281	50	20	IDGD	
O=C([C@@H](F)Cl)N1CCOC[C@@]2(C1)CN(C(=O)C1(c3cccc(F)c3)CC1)CCO2	1832364541	FPPYTJQJUFLWQR-VQIMIIECSA-N	428.863	1.848	50	20	IDGD	
Cc1ncccc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1	1834039666	JQFAVPFRKAIBNK-RTBURBONSA-N	430.332	1.696	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](C)CBr)C3)C2)no1	1834343564	LQOCHZOUJGUYQZ-YVEFUNNKSA-N	430.299	1.084	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)Cn3cncn3)CC2)CC1	1834873831	OKHWJDFCPHTSEO-INIZCTEOSA-N	441.374	1.023	50	20	IDGD	
C[C@@H](C(=O)N1CCC(N2CCC(NC(=O)[C@H](F)Cl)CC2)CC1)n1ccccc1=O	1835083979	DIWYQLLGFVQPKB-KSSFIOAISA-N	426.920	1.515	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)C(Cl)Cl)CC2)CC1)c1cn2ncccc2n1	1835394783	XLSPANPZYFQKRN-UHFFFAOYSA-N	439.347	1.718	50	20	IDGD	
Cc1nn(C)cc1C(=O)N1CCC(N2CCC(NC(=O)CO[Si](C)(C)C)CC2)CC1	1835835294	RJNZWWGNXVRKPX-UHFFFAOYSA-N	435.645	1.765	50	20	IDGD	
CC(C)N[C@@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1)C(C)C	1835897522	DJKJDJJOECQIGK-TZIWHRDSSA-N	443.661	1.317	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(C=O)s1)CCO2	1835946164	JGRUPUHAYZVTKV-IBGZPJMESA-N	440.594	1.482	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(C=O)s3)CCO2)C1	1835946755	UAWUMSQSOBLGME-ZWKOTPCHSA-N	449.356	1.867	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3cnn(C)c3)CCO2)C1	1835985434	OOUHVOYUVCWFTJ-FXAWDEMLSA-N	426.945	1.217	50	20	IDGD	
C=C[C@H](O)C(C)(C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1	1837400866	QGKPLMBSBRSMSR-GDIGMMSISA-N	437.364	1.252	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(Cl)cn3)C2)C1	1837715601	ZVEATJHBJSKQKV-IBGZPJMESA-N	441.988	1.657	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)COc3ccc(F)cc3)C2)C1	1839143271	RFWWWIXUMHEMKL-PXNSSMCTSA-N	428.888	1.678	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc4snnc4c3)C2)C1	1839146764	VPMHDYGGWIDARI-ACJLOTCBSA-N	439.925	1.174	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc(N)s3)C2)C1	1839152139	OWDDZCKPXPLFEM-JKSUJKDBSA-N	437.349	1.032	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccccn3)C2)C1	1839152331	WOQAERVWOSBOPD-RTBURBONSA-N	430.332	1.317	50	20	IDGD	
Cc1n[nH]c(C)c1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2	1839153277	DUUPGPVQPLLPDK-MSOLQXFVSA-N	433.336	1.333	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)CCO2)C1	1839354876	YHYVIXAWLNIFTG-QFBILLFUSA-N	443.859	1.821	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc4c(c3)C(=O)CC4)CCO2)C1	1839528803	NCRDPQNMKSYKEO-PGRDOPGGSA-N	434.920	1.903	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(F)cn3)C2)C1	1839963872	ZEAPLYCRRWDKQZ-RDTXWAMCSA-N	444.301	1.464	50	20	IDGD	
Cc1nscc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2	1840031509	SBVFELMRZLGTFZ-BDJLRTHQSA-N	432.340	1.305	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3ccsc3)C2)C1	1840032132	OFHYJSQCDLELQQ-RDTXWAMCSA-N	445.379	1.921	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)cc1	1840034633	RPEBETVQLPXSAN-HNAYVOBHSA-N	425.323	1.848	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)COc3ccc(C)cc3)C2)C1	1840151573	GRCSLFUVXNVJQT-GHTZIAJQSA-N	440.924	1.084	50	20	IDGD	
Cc1cc(F)ccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1840778768	NNCPHBFCBPCKGX-YJBOKZPZSA-N	447.276	1.895	50	20	IDGD	
C=CC(=O)N[C@@H](C)C(=O)N1CCCC12CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)C2	1844372270	ALBXIBNIWLMSLS-FSEGOYHTSA-N	428.439	1.766	50	20	IDGD	
O=C(c1ncn(-c2cccc(F)c2)n1)N1CC2(CCCN2C(=O)[C@H](F)Br)C1	1845216432	QJBSLDSLLFLMSB-ZDUSSCGKSA-N	440.248	1.914	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)c2ccc3c(Cl)ccnc3c2)C1	1845584711	ALJNFASCSYGEPV-UHFFFAOYSA-N	449.703	1.699	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCCC12CN(C(=O)[C@H](CO)NC(=O)OC(C)(C)C)C2	1846069898	BZHDVYLJGTURPZ-OLZOCXBDSA-N	448.358	1.249	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CN1CCCCC1	1848099743	TULVEJSFNLQENJ-ULQDDVLXSA-N	442.988	1.806	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)OCC(=O)N2CCC(C(=O)OC)CC2)c1C	9604265	OLBZBCZHKOSHLF-XDHOZWIPSA-N	431.489	1.613	50	20	IDGD	
C[C@@]1(C2CC2)NC(=O)N(CC(=O)NNC(=O)c2cc(-c3ccco3)nc3ccccc23)C1=O	17409094	DMSNUPIJFRXBES-QHCPKHFHSA-N	447.451	1.976	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c2c(C)noc2n1	22006666	ANHRIVFLKYFAAT-UHFFFAOYSA-N	443.485	1.699	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)c1cccc(S(=O)(=O)N2CCCC2)c1	23914750	VRCWGHNWPFALDT-UHFFFAOYSA-N	441.307	1.637	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)c1ccc2c(=O)n3c(nc2c1)CCCCC3	26972926	WAROYVKHUTUTCA-IBGZPJMESA-N	434.452	1.724	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)c2ccccc2C)cc1S(=O)(=O)N1CCOCC1	43732240	VPJXDDMXGRSOMD-UHFFFAOYSA-N	431.514	1.653	50	20	IDGD	
Cc1nc(S(=O)(=O)NCCC(=O)NN=C(c2ccccc2)c2ccccc2)cn1C	72075518	RFGJJFPIEHYGEY-UHFFFAOYSA-N	425.514	1.966	50	20	IDGD	
COc1ccc(/C=C\C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1OC	207799315	JJIPJWIDQCAFLE-WQLSENKSSA-N	447.513	1.494	50	20	IDGD	
Cc1cccc(-n2ccnc2SCC(=O)NNC(=O)CNC(=O)c2ccco2)c1C	725739273	BHDOSVAAKAVQPC-UHFFFAOYSA-N	427.486	1.752	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)c1cn(-c2ccc(C(F)(F)F)cn2)nn1	725880541	IAKKQYWILVEQDL-UHFFFAOYSA-N	435.366	1.563	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)c1c[nH]nc1-c1ccc2c(c1)OCCO2	725901909	ACKZFPOGUYFNAT-UHFFFAOYSA-N	427.442	1.100	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)Cc2c[nH]c3ccccc23)cc1S(=O)(=O)NCC#N	726883966	POQSBJFKAXCIPP-UHFFFAOYSA-N	425.470	1.282	50	20	IDGD	
C#Cc1cccc(NC(=S)NNC(=O)c2ccc(OC)c(S(=O)(=O)NC3CC3)c2)c1	727500927	CMHCXUCZBWEDSK-UHFFFAOYSA-N	444.538	1.749	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)NC1CCN(c2ccc(C#N)cn2)CC1	727605507	LWWOLFTWZSRDQM-CQSZACIVSA-N	426.452	1.859	50	20	IDGD	
Cc1cc(NC(=O)CN2CCN(C(=O)NNC(=O)CCCc3ccccc3)CC2)no1	727846190	LOEBSMZCWBBMCF-UHFFFAOYSA-N	428.493	1.303	50	20	IDGD	
CCc1ccccc1OCC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	728213058	CTJZDFYGXXPQAO-UHFFFAOYSA-N	432.546	1.707	50	20	IDGD	
Cc1noc(Cl)c1CC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	728213940	HOIZXZNWUNGTAQ-UHFFFAOYSA-N	427.914	1.258	50	20	IDGD	
CNS(=O)(=O)c1cccc(CNC(=O)NNC(=O)c2cccc(OC(F)F)c2)c1	728595659	QHLVXLQOXXSWQI-UHFFFAOYSA-N	428.417	1.340	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2cccc(NC(=O)NC(C)C)c2)n1	728721850	IZERZUIEYLMPCS-UHFFFAOYSA-N	433.490	1.528	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)c2cccc(C#N)c2)cc1	728853683	ZRZSKMSROFZSES-UHFFFAOYSA-N	436.515	1.212	50	20	IDGD	
CC(=O)Nc1cccc([C@@H](C)NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1	728944296	TUSYCWILGINEPR-CQSZACIVSA-N	425.493	1.743	50	20	IDGD	
O=C(COC(=O)[C@@H]1COc2ccc(Cl)cc2C1)NNC(=O)[C@@H]1COc2ccccc2O1	729236719	KQHXNPBTUDFUPF-UGSOOPFHSA-N	446.843	1.422	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=O)Cn2ccc3ccccc32)n(C)c1	729449852	HHUQKGOEOGXIRX-UHFFFAOYSA-N	431.518	1.472	50	20	IDGD	
Cc1nc(CCC(=O)NNC(=O)C(=O)NC2CC2)oc1-c1ccc(Br)cc1	730207661	VTBRRHJDXCNNAQ-UHFFFAOYSA-N	435.278	1.771	50	20	IDGD	
O=C(NCCS(=O)(=O)N1CCSCC1)NNC(=O)c1ccc(Cl)cc1Cl	730672285	FFDSACSLCYIICD-UHFFFAOYSA-N	441.362	1.316	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)Cc3ccccc3F)CC2)cc1	731330400	PNFHMHXXFYWIGF-UHFFFAOYSA-N	449.504	1.625	50	20	IDGD	
CCCS(=O)(=O)Nc1cccc(C(=O)NNC(=O)CCN2C[C@H](C)O[C@@H](C)C2)c1	732260711	GQJNXIXGBIOTHH-GJZGRUSLSA-N	426.539	1.099	50	20	IDGD	
O=C(CSCc1cc(=O)n2ccsc2n1)NNC(=O)c1cnn(-c2ccccc2)c1	733108647	VCUVRLPBFGWKMX-UHFFFAOYSA-N	440.510	1.636	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N2CC(n3ccnc3)C2)cc1	733985989	RZKOESNNZLJUHT-LICLKQGHSA-N	445.483	1.621	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)N[C@H]2CCC[C@@H](C(=O)N(C)C)C2)nc1	734221604	NMSUMDQSNIBJEX-CABCVRRESA-N	440.570	1.385	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)[C@H]1CC[C@@H](C(F)(F)F)NC1=O	734250889	OAJUYBVUCQKDJJ-GWCFXTLKSA-N	436.456	1.664	50	20	IDGD	
COc1ccc(CN2CC[C@H](NC(=O)NNC(=O)c3cccc4ncccc34)C2=O)cc1	734543753	OZGCCWCWMKEERL-FQEVSTJZSA-N	433.468	1.989	50	20	IDGD	
COc1cccc(COCC(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)c1	734826046	UYOHBFSROQSYJR-UHFFFAOYSA-N	436.509	1.942	50	20	IDGD	
CC(=O)NCC(=O)N1CCc2cc(C(=O)NNC(=O)COc3ccc(C)c(C)c3)ccc21	735646626	GJFQQYLLKCUVOJ-UHFFFAOYSA-N	438.484	1.169	50	20	IDGD	
CC[C@H](C)[C@H](NC(=O)N1CCCC1)C(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	736836162	PPVBIZLSJDFZSH-GUYCJALGSA-N	449.464	1.119	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1I	740852135	MILULIMVDAEZHM-UHFFFAOYSA-N	448.217	1.265	50	20	IDGD	
CCCNC(=O)c1cccc(C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c1	741375196	QECRRGNJDNJVHH-UHFFFAOYSA-N	428.401	1.353	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCC[S@@](=O)Cc2ccccc2)c2ccccc2c1=O	741418540	GVJZWVFYOYBTJV-WJOKGBTCSA-N	441.513	1.309	50	20	IDGD	
COCCn1c(SCC(=O)NNC(=O)c2ccc(C#N)cc2)nnc1-c1ccncc1	742450283	WYDHBFIEXWPYQV-UHFFFAOYSA-N	437.485	1.411	50	20	IDGD	
COc1ccccc1-n1cc(S(=O)(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)cn1	743268292	KGDIWPUCTKPFJU-UHFFFAOYSA-N	433.402	1.118	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)[C@H](CNC(=O)OC(C)(C)C)c2ccccc2)C[C@@H](C)O1	743292313	XLFMPJZIONGDMJ-ZHALLVOQSA-N	448.564	1.942	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NCC(=O)N2CCc3ccccc32)cc1	743583889	REHYCPCJRCPWTQ-UHFFFAOYSA-N	431.474	1.015	50	20	IDGD	
O=C(CCC(=O)c1ccc(I)cc1)NNC(=O)N1CCOCC1	745992912	MXXDFWIJSWIUKP-UHFFFAOYSA-N	431.230	1.327	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@@H]2CCCN(C(=O)NC3CCCC3)C2)cc(OC)c1OC	746013983	VDOIUVJLOFXITC-CQSZACIVSA-N	448.520	1.838	50	20	IDGD	
CC(C)N(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Cc2cn3ccccc3n2)c1	746554151	XQQBYHAWXWWQJW-UHFFFAOYSA-N	429.502	1.367	50	20	IDGD	
Cn1ccnc(NNC(=O)c2cc(S(=O)(=O)N3CCCCC3)ccc2Cl)c1=O	747937375	DIJBOMINKMQYKR-UHFFFAOYSA-N	425.898	1.365	50	20	IDGD	
Cc1cccc(S(=O)(=O)NNC(=O)c2ccc(CSc3nncn3C)cc2)c1C#N	749749687	ABDCTNYEBGDUCF-UHFFFAOYSA-N	442.526	1.911	50	20	IDGD	
C[C@H]1C[C@H](NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)CCN1Cc1ccccc1	751098571	GNSZNRJVIOBIAJ-QFBILLFUSA-N	434.504	1.659	50	20	IDGD	
CCC(=O)NCc1cc(S(=O)(=O)NNC(=O)c2cccc3ncccc23)ccc1OC	751549067	VUMACDDQDVIYDG-UHFFFAOYSA-N	442.497	1.893	50	20	IDGD	
CO[C@H](C)c1nc(CNC(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)cs1	753056989	NYPBPPBVUVSLOC-LLVKDONJSA-N	428.540	1.759	50	20	IDGD	
O=C(NNC(=O)N1CCS(=O)(=O)C2(CCCCC2)C1)c1cc(Br)c[nH]1	753803065	SRQLSBYMQSMQNZ-UHFFFAOYSA-N	433.328	1.565	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)ccc1Cl	756167585	GCWDPNARYDUINT-UHFFFAOYSA-N	429.824	1.959	50	20	IDGD	
NC(=O)CCSc1ccccc1NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1	756362882	OCVBVUVZBZODLC-UHFFFAOYSA-N	443.533	1.513	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)cc1	756565183	WGTLJUFDVFQZIY-UHFFFAOYSA-N	443.526	1.906	50	20	IDGD	
CC[C@@H]1CN(CC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)CC[C@H]1NC(=O)OC(C)(C)C	757111073	QCSVIHXIDOCBQT-RHSMWYFYSA-N	449.508	1.981	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccccc2O[C@@H]2CCOC2)c1	757679126	ROGURPMIURNPPY-OAHLLOKOSA-N	448.501	1.571	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)nn1-c1ccc(Cl)c(Cl)c1	758038400	DVCYLVIWQZVJID-SECBINFHSA-N	434.305	1.186	50	20	IDGD	
CCc1cccc2c3c([nH]c12)[C@](CC)(CC(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1)OCC3	758145278	YQSROEFLOREUFI-NYHFZMIOSA-N	447.557	1.881	50	20	IDGD	
COc1cc(F)cc(NNC(=O)CCNS(=O)(=O)c2ccc(OC)c(OC)c2)c1	759318933	AKBIGPZRIYMHFE-UHFFFAOYSA-N	427.454	1.663	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)CN2C(=O)NC3(CCC(C(C)(C)C)CC3)C2=O)nc1	759729156	CMMKCMNJYXXNMT-UHFFFAOYSA-N	431.493	1.838	50	20	IDGD	
CCn1cnc2c1c(=O)n(CC(=O)NN=Cc1[nH]c(C)cc1C)c(=O)n2Cc1ccccc1	760234456	SAHOHYFZKLMDDN-UHFFFAOYSA-N	447.499	1.523	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2cc(C)c(C)c(C(=O)O)c2)cc(OC)c1OC	760336121	XVICLIZDGLHPPZ-UHFFFAOYSA-N	438.458	1.651	50	20	IDGD	
O=C(NNC(=O)c1ccncc1)C(=O)Nc1ccnn1Cc1cccc(Br)c1	763467644	VHZIBFQDXBFXEE-UHFFFAOYSA-N	443.261	1.489	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ccccc2Br)ccc1C	763484115	XVORQGBZUUTFQQ-UHFFFAOYSA-N	434.246	1.944	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)C(=O)Nc1cccc2c1CCCC2	763529457	BRRBWVQAZFHWRY-UHFFFAOYSA-N	449.555	1.864	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(N3CCOCC3)cc2C)cc1OC	763549958	BZJFQYLFVJQGQX-UHFFFAOYSA-N	442.472	1.249	50	20	IDGD	
O=C(NNC(=O)c1ccc(F)c(I)c1)C(=O)Nc1ccccn1	763565016	YBFUWDXDBVKQTR-UHFFFAOYSA-N	428.161	1.225	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccccc2CN2C[C@@H](C)O[C@H](C)C2)c(C)o1	763587614	ZWUGMKNAUZXKBV-HUUCEWRRSA-N	428.489	1.905	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)[nH]n1)C(=O)Nc1ccccc1Cn1cncn1	763604210	ICKXXYKPVMYMJM-UHFFFAOYSA-N	430.428	1.116	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cc(C(F)(F)F)cnc2O)cc1C	763668110	YOJYEVNTQXGSFH-UHFFFAOYSA-N	426.351	1.588	50	20	IDGD	
O=C(CSc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1ccc(-n2ccnn2)cc1	763735797	QDXKLMGNOKIAAA-UHFFFAOYSA-N	430.877	1.799	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)oc(=O)n3C)cc1	763767889	NCRPEIVRVWADDW-UHFFFAOYSA-N	440.456	1.956	50	20	IDGD	
CCCOc1ccccc1NC(=O)C(=O)NNC(=O)c1nn(CC)c(=O)c2ccccc12	763785544	HRHNBAPFSYCLPC-UHFFFAOYSA-N	437.456	1.605	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cc(OC)ccc2OC)cc1	763859504	CXMDTGQUPPSASA-ZDUSSCGKSA-N	431.445	1.656	50	20	IDGD	
CCOC(=O)c1cc(F)c(F)cc1NC(=O)C(=O)NNC(=O)Cc1c[nH]c2ccccc12	763865471	QKACAOUQNPRVBV-UHFFFAOYSA-N	444.394	1.951	50	20	IDGD	
Cc1nnc(-c2cccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc3ccccc3F)c2)n1C	763866359	VQDAQMQIUYVEBK-LBPRGKRZSA-N	440.435	1.483	50	20	IDGD	
CO[C@@H](C)C(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)c1	763871498	HBZBXGCUKDQVIB-STQMWFEESA-N	446.435	1.353	50	20	IDGD	
CCN1CCN(c2ccc(NC(=O)C(=O)NNC(=O)Cc3ccc(Cl)cc3)cc2)CC1	763932791	ULYSSGYIBDSDNH-UHFFFAOYSA-N	443.935	1.811	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)cc1OC	763994293	CDGTVTOMNYPPLV-UHFFFAOYSA-N	425.239	1.584	50	20	IDGD	
COC(=O)[C@H]1CN(C(=O)C(=O)NNC(=O)c2cccc3ccccc23)c2ccccc2O1	764049098	SPMYPBAOJLAXBK-LJQANCHMSA-N	433.420	1.568	50	20	IDGD	
C[C@H]1CCC[C@H](C)N1C(=O)c1cc(Cl)ccc1NC(=O)C(=O)NNC(=O)CN(C)C	764203053	FFPBCBQMZSAIAC-STQMWFEESA-N	437.928	1.391	50	20	IDGD	
Cc1ncsc1C(=O)NNC(=O)C(=O)Nc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1	764246829	ROHQUBKNQKHGKX-GHMZBOCLSA-N	435.481	1.604	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(S(=O)(=O)N3CCC(C)CC3)cc2)o1	764367710	LDVKFUSWZQDERP-UHFFFAOYSA-N	448.501	1.408	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1cccc(N(C)C(C)=O)c1	764393556	QFHHXBOVDOAYEJ-UHFFFAOYSA-N	430.486	1.556	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)C(=O)Nc1cccc(NC(=O)C2CC2)c1	764401612	PHNGHRPAZVWNDK-UHFFFAOYSA-N	428.470	1.619	50	20	IDGD	
Cc1cc(N2CCC(NC(=O)NNC(=O)CSc3ccccc3O)CC2)nc(C)n1	764419715	PULNNHFNLIRNPR-UHFFFAOYSA-N	430.534	1.891	50	20	IDGD	
Cc1ccnn1-c1ccc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cc1	765734030	VBOOTVMOWBVCJE-UHFFFAOYSA-N	446.511	1.400	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)[C@@H]1CC(=O)N(c2ccc(Cl)cc2)C1	767285366	AEOPTIOJPUXKHP-MRXNPFEDSA-N	443.887	1.935	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)NNC(=O)C(=O)Nc1cc(C2CC2)nn1-c1ncccn1	768238720	SZRHDAYCEUVRPM-UHFFFAOYSA-N	444.455	1.350	50	20	IDGD	
CCOc1ccc(-n2c(SCC(=O)NNC(=O)C3CC3)nnc2-c2cnccn2)cc1	768403207	PPVOCDPZJFABIO-UHFFFAOYSA-N	439.501	1.773	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)c2cccc([C@]3(C)NC(=O)NC3=O)c2)cc1	768915091	XSJOHEZKHIPXIT-DMZKTXOQSA-N	440.456	1.368	50	20	IDGD	
Cc1nc(-c2ccccn2)nc(NNC(=O)c2cccc([C@]3(C)NC(=O)NC3=O)c2)c1C	769098232	SVZWRMGUSOMHII-QFIPXVFZSA-N	431.456	1.967	50	20	IDGD	
CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	769535670	PWALGWDQNZFWHL-FQEVSTJZSA-N	436.520	1.763	50	20	IDGD	
CCN1CCN(c2cccc(NC(=O)C(=O)NNC(=O)c3cccc(Cl)c3)c2)CC1	770774721	SPMZMAQSZRDQKJ-UHFFFAOYSA-N	429.908	1.882	50	20	IDGD	
C[C@@H]1Oc2ccccc2N(CC(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)C1=O	770967292	FRJHGQLPNCGDKP-NSHDSACASA-N	425.449	1.544	50	20	IDGD	
C[C@H](C(=O)NNc1nc(O)c2cnn(C(C)(C)C)c2n1)S(=O)(=O)c1ccc(F)cc1	770967544	PZNDIPUGFKGNHQ-SNVBAGLBSA-N	436.469	1.732	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NN=Cc1ccc(N2CCN(C)CC2)cc1	771550987	UUAGFRPTTMBLFZ-UHFFFAOYSA-N	428.562	1.804	50	20	IDGD	
COc1ccccc1[C@]1(C)NC(=O)N(CC(=O)NNc2nc(O)c3ccccc3n2)C1=O	771621310	KYCUVDLJBZXFCI-NRFANRHFSA-N	436.428	1.254	50	20	IDGD	
CCOc1ccccc1C(=O)N1CCC[C@H]1C(=O)O[C@@H](C)C(=O)NNC(=O)CC(C)C	771993581	PUXHEKINDHWONK-RDJZCZTQSA-N	433.505	1.815	50	20	IDGD	
O=C(C[C@H](O)c1ccc(Cl)cc1)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	772809147	DPFHRYKYLRWRLO-IBGZPJMESA-N	444.919	1.369	50	20	IDGD	
CCCCCCCCn1nc(C)c(S(=O)(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)c1C	775257569	MZFFNZGBNBOQNR-MRXNPFEDSA-N	448.611	1.605	50	20	IDGD	
O=C(NNC(=O)c1cccc(O)c1O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	776323695	PNKJELYIXYDOPK-UHFFFAOYSA-N	430.424	1.874	50	20	IDGD	
CC(C)(C)OC(=O)NCc1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2O)cc1	778706033	KJAVBPCOXMSFMY-UHFFFAOYSA-N	428.445	1.817	50	20	IDGD	
O=C(NNC(=O)c1ccccc1O)C(=O)Nc1cc(Cl)ccc1OC[C@@H]1CCOC1	778706200	OJTBEVIJDVGTHB-GFCCVEGCSA-N	433.848	1.861	50	20	IDGD	
O=C(NNC(=O)[C@@H](O)[C@H](O)c1nc2ccccc2s1)c1cccc(Br)c1	779526063	ULFGSGYRCXDYIO-KBPBESRZSA-N	436.287	1.914	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1)c1ncn(C)n1	780703882	UUEGTBWZLXWOQD-OXQOHEQNSA-N	433.516	1.834	50	20	IDGD	
O=C(C[C@@H](O)c1ccc(OCc2ccccc2)cc1)NNC(=O)N[C@@H]1CCS(=O)(=O)C1	780906653	FKKQZSSVLRFKTR-IEBWSBKVSA-N	447.513	1.207	50	20	IDGD	
O=C(CCN1CCOCC1)Nc1cccc(CNC(=O)NNc2ncncc2Cl)c1	780964392	SEHRUIQMRYKETA-UHFFFAOYSA-N	433.900	1.617	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@]2(C[C@@H]2C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)C1	781280863	JDTBULCJOLKYLZ-OPAMFIHVSA-N	442.472	1.510	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1csc(N2CCOCC2)n1)[C@H]1CCCN(C2CCC2)C1	781399806	HSGRREQWNCGQBX-CABCVRRESA-N	436.582	1.577	50	20	IDGD	
O=C(NNC(=O)c1ccccc1NC(=O)OCc1ccccc1)N[C@@H]1CCS(=O)(=O)C1	781948787	FKUYAKFUVPDCDO-OAHLLOKOSA-N	446.485	1.566	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)Nc1cccc(N2CCN(C(C)=O)CC2)c1	782083542	SVJZONAYXFMOTN-UHFFFAOYSA-N	441.488	1.595	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(OC3COC3)cc2)cc1	782121360	VRDZNIBKTPLIGR-CQSZACIVSA-N	443.456	1.416	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)C(=O)Nc1ccc(-c2ccc[nH]2)cc1	782896163	BUTKUAWBZNZNQE-UHFFFAOYSA-N	440.485	1.375	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)C(=O)Nc1cccc2cccnc12	782897661	RSGYMPYRBUIAKZ-UHFFFAOYSA-N	440.485	1.236	50	20	IDGD	
O=C(NNc1ncccc1C(F)(F)F)C(=O)Nc1ccccc1CN1C(=O)CCC1=O	783120530	TURJOXCETGQJIG-UHFFFAOYSA-N	435.362	1.831	50	20	IDGD	
COc1ccc(C(=O)N2CCOCC2)cc1NC(=O)C(=O)NNc1cc(C)cc(C)c1	783359045	HYJIAMUJBOHNOR-UHFFFAOYSA-N	426.473	1.866	50	20	IDGD	
CN(c1ccc(NC(=O)C(=O)NN[C@]2(C)CCS(=O)(=O)C2)cc1F)C1CCCCC1	783423938	BPPDJTDICMXDGD-HXUWFJFHSA-N	440.541	1.731	50	20	IDGD	
CNS(=O)(=O)c1cc(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2Cl)ccc1C	784381910	QIDFYVQRQSKWPX-UHFFFAOYSA-N	441.853	1.547	50	20	IDGD	
CCCc1c(NC(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)cnn1-c1cccc(C#N)c1	784469006	LXUSEEZLTBUESW-AWEZNQCLSA-N	430.490	1.284	50	20	IDGD	
COc1ccc(C(=O)N2CCOCC2)cc1NC(=O)C(=O)NNc1ncccc1Cl	784814108	HCNFQKNJPIWGRY-UHFFFAOYSA-N	433.852	1.298	50	20	IDGD	
CCN1CCN(C(=O)Cc2ccc(NC(=O)C(=O)NNc3ccnc(F)c3)cc2)CC1	784849828	XSAYUOHFNKGEQC-UHFFFAOYSA-N	428.468	1.009	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(NC(=O)C(=O)NNc2cccnn2)ccc1Cl	784858366	KAJZIESLJRSJCV-UHFFFAOYSA-N	426.886	1.242	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc2c(c1)CCN2C(=O)C(=O)NNc1ccc(C#N)c(Cl)c1	785091531	GQGWAZBMBKUISS-UHFFFAOYSA-N	447.904	1.494	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc2c(c1)CCN2C(=O)C(=O)NNc1ccc(Cl)c(F)c1	785179205	XBALIRRQKYPCMU-UHFFFAOYSA-N	440.884	1.762	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2ccccc2N2CCN(C)CC2)n1	785226584	JCYKJPUXWLPTKF-UHFFFAOYSA-N	426.525	1.156	50	20	IDGD	
CCS(=O)(=O)CCn1cc(C)c(NC(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)n1	786725765	QGYPVKUWOWDLFJ-UHFFFAOYSA-N	445.505	1.483	50	20	IDGD	
CCOC(=O)c1ccc(C)c(S(=O)(=O)NNC(=O)c2nnc(-c3ccccc3)o2)c1	788747632	VKEZKTFBKHNRFI-UHFFFAOYSA-N	430.442	1.845	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)C(=O)Nc2cc([C@H]3CCCO3)nn2C)c1	789731569	FMQMLRABMNMOKV-QGZVFWFLSA-N	443.504	1.868	50	20	IDGD	
COc1ccc(Br)cc1C(=O)CCC(=O)NNC(=O)CN1CCCC1=O	789857256	BXMQYDRTDCMVTL-UHFFFAOYSA-N	426.267	1.190	50	20	IDGD	
O=C(CCOCC(F)F)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	790197886	BHBQDAUXSIHXHJ-UHFFFAOYSA-N	433.458	1.982	50	20	IDGD	
O=C(NN=Cc1ccnn1-c1ccccc1)C(=O)NN=Cc1ccnn1-c1ccccc1	790282076	PXMUIXWPRODDHN-UHFFFAOYSA-N	426.440	1.658	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNc2cccc(S(C)(=O)=O)c2)cc(Cl)c1F	792265903	VCSQWUTWODMUNQ-UHFFFAOYSA-N	443.840	1.751	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)cccc1NC(=O)N(C)C	792355033	NUMQHAJDGQGBNG-CYBMUJFWSA-N	445.451	1.781	50	20	IDGD	
Cc1nc2cc(F)c(F)cc2n1CC(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	793770355	BROOBKROLRKPNQ-UHFFFAOYSA-N	435.818	1.740	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N[C@H](C)[C@@H](C)OC)cc1	794004213	IFHKAKFSQOWHEX-DSWHRGLISA-N	425.489	1.881	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNC(=O)C(=O)Nc1ccc2ncsc2c1	797369419	VWLSQQDEEDHGLE-UHFFFAOYSA-N	427.442	1.309	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)c2ccc(Cl)cc2OC)cc1NC(C)=O	798164724	RDKXGYNWRSRACG-UHFFFAOYSA-N	427.866	1.939	50	20	IDGD	
COc1cnc2ccccc2c1C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	801797593	KGIVCEGEOXQQIA-UHFFFAOYSA-N	428.470	1.569	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCCC(=O)NNC(=O)Nc2ccc(OC)cc2)cc1	802054205	LZLVAJASGWXXSO-UHFFFAOYSA-N	436.490	1.615	50	20	IDGD	
Cc1ccc(C(=O)NNc2nccnc2C2CCC2)cc1S(=O)(=O)N1CCOCC1	805474194	VUDSAEKKEBPOGA-UHFFFAOYSA-N	431.518	1.830	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2cccc(Cl)c2OCC(F)F)n1	806975345	UTXVEDVYMSBYOA-UHFFFAOYSA-N	429.811	1.583	50	20	IDGD	
O=C1COC[C@@H](C[C@H]2CN(C(=O)C(=O)NNc3ccc(Cl)c(F)c3)c3ccccc32)N1	807022984	XFQPPFVUXZFPLW-GXTWGEPZSA-N	446.866	1.958	50	20	IDGD	
CN(Cc1ccccc1Br)C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	807136181	WJCQCCAPKALCTP-UHFFFAOYSA-N	430.266	1.911	50	20	IDGD	
CSSCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	807233895	PUKSVEDNGCPDMM-UHFFFAOYSA-N	432.593	1.816	50	20	IDGD	
CCCc1c(C(=O)NNC(=O)N2CCN(C)CC2)cnn1-c1cc(F)c(OC)cc1F	807382250	DCFUHWHEMFRSCO-UHFFFAOYSA-N	436.463	1.713	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cnn(-c3ccc(F)cc3)c2C(F)(F)F)n[nH]1	810384198	GWNXXNMFYMYUQO-UHFFFAOYSA-N	439.329	1.461	50	20	IDGD	
COc1cc(F)c(NC(=O)C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)cc1F	813033630	CLRCRVCOKMAEMZ-UHFFFAOYSA-N	428.417	1.306	50	20	IDGD	
Cc1cc(N2CCCC2)ccc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	813033687	GSCQDFNCDWWQKR-UHFFFAOYSA-N	445.545	1.927	50	20	IDGD	
CCOC(=O)c1cc(COC)cc(NC(=O)C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c1	815563726	MFUJHTACLPFJCS-UHFFFAOYSA-N	444.400	1.318	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)Cc2ccccc2F)cc1)[C@@H]1C[C@H]1C	815569380	QYIHZFQDAVMSMB-BFUOFWGJSA-N	426.448	1.916	50	20	IDGD	
Cn1ncc(C(=O)NNC(=O)c2cccc(Br)c2)c1I	815713568	XTFHRDDALQUUEF-UHFFFAOYSA-N	449.046	1.862	50	20	IDGD	
Cc1nc2ccc(NC(=O)C(=O)NNc3ccccc3S(=O)(=O)N(C)C)cc2s1	815752064	AOBAOEDOPXPLRD-UHFFFAOYSA-N	433.515	1.937	50	20	IDGD	
O=C(NNc1ncncc1F)C(=O)Nc1cc(I)ccc1Cl	815765155	HPCFVKBHYDQLPH-UHFFFAOYSA-N	435.584	1.956	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)CCC(=O)N1CCc2sccc2C1	817052412	ACQOWMPJGUTTAM-UHFFFAOYSA-N	436.559	1.807	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)CN(C)C(=O)[C@@H](C)n2cccn2)c1	818750385	JAFDORPDBXBLMJ-LLVKDONJSA-N	438.282	1.595	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)CCNC(=O)c2ccc(Br)cc2)c1	825777515	XIRDDNTUNQCYOM-UHFFFAOYSA-N	449.305	1.837	50	20	IDGD	
CSCC[C@@H](NC(=O)c1cccc(C)c1)C(=O)NNC(=O)[C@H]1COc2ccccc2O1	859420414	XRKFRRDZYNHLNR-VQIMIIECSA-N	443.525	1.834	50	20	IDGD	
Cn1c(CC(=O)NN=Cc2c(N3CCOCC3)nc3ccccn3c2=O)nc2ccccc21	874068999	QYMBHISRMPXQTI-UHFFFAOYSA-N	445.483	1.111	50	20	IDGD	
O=C(Cc1nc(-c2ccccc2)cs1)NNC(=O)[C@H]1CC(=O)N(CC(F)(F)F)C1	914755591	HAFSYILUSNORJK-LBPRGKRZSA-N	426.420	1.911	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)N2CCCN(S(C)(=O)=O)CC2)c(C)n1C[C@H]1CCCO1	914847236	AIQYGVWAPHWULG-UMSHPIDHSA-N	434.562	1.685	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NCCN2CCN(Cc3ccccc3)CC2)cc1	915901227	GAYPRBNRLCJVHW-UHFFFAOYSA-N	425.533	1.522	50	20	IDGD	
CC(=NNC(=O)Cc1nc(O)c2c(C)c(C)sc2n1)c1cccc(S(N)(=O)=O)c1	915948645	QCUSUYWDGYTVPF-UHFFFAOYSA-N	433.515	1.744	50	20	IDGD	
CN(CCCNC(=O)NNC(=O)COc1ccccc1-c1ccccc1)S(C)(=O)=O	916580404	WLBILYFRCUKGKP-UHFFFAOYSA-N	434.518	1.344	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)N1CCc2sccc2C1	916619344	IOGBPDRMNWIDCG-ZDUSSCGKSA-N	436.559	1.542	50	20	IDGD	
O=C(NN=Cc1ccc(OC(=O)c2cccc([N+](=O)[O-])c2)cc1)N[C@@H]1CCS(=O)(=O)C1	920381764	UALYMZBXWWFQQZ-OAHLLOKOSA-N	446.441	1.634	50	20	IDGD	
CCCCN1C(=O)C[C@@H](C(=O)NNC(=O)CN2CCCC2=O)[C@@H]1c1ccc(OC)cc1	920436265	ZRQXDEGRUQYBGG-UTKZUKDTSA-N	430.505	1.155	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)[nH]n1)Nc1ccc(CN2C(=O)CNC2=O)cc1	920932558	PAUDJLJFGLWEGB-UHFFFAOYSA-N	433.428	1.595	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)NC[C@@H](c2cccc(F)c2)N2CCOCC2)c1	921199773	PONDQBZJHWJOIA-FQEVSTJZSA-N	446.479	1.860	50	20	IDGD	
Cc1nc(N2CCOCC2)nc(O)c1CCC(=O)Nc1cccc(NC(=O)NN(C)C)c1	1116853090	ZYNGXKFBZXYCSN-UHFFFAOYSA-N	443.508	1.497	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)N[C@H]2CCCN(C(=O)c3ccccc3)C2)cc1	1318175759	OBSKIDWUSAXVDU-KRWDZBQOSA-N	426.473	1.709	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CNC(=O)c2cc(Cl)ccn2)cc1Br	1318453745	LEXQMGKCUYEUKL-UHFFFAOYSA-N	441.669	1.697	50	20	IDGD	
N#Cc1cccc(S(=O)(=O)NCC(=O)NNC(=O)c2ccc(Br)cc2)c1	1323923761	QPGRADVYDQZHIA-UHFFFAOYSA-N	437.275	1.060	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cncc(OCC(F)F)c3)CC2)cc1	1324139563	JKASWFTWJSFXBP-UHFFFAOYSA-N	447.486	1.613	50	20	IDGD	
CCOC(=O)N1CCC(NC(=O)CCCNC(=O)NNC(=O)c2ccc(OC)cc2)CC1	1337500699	RZKYXHDVEYPQSN-UHFFFAOYSA-N	449.508	1.157	50	20	IDGD	
O=C(Cc1cc2c(cc1Br)OCCO2)NNC(=O)c1n[nH]c2c1CCCC2	1343322463	MWZQFBPKCIBTJS-UHFFFAOYSA-N	435.278	1.826	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Cl)C2)c1ncn(-c2ccccc2)n1	1778179597	DSGUSJYEYZCDEG-GQIGUUNPSA-N	435.887	1.929	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C2(C(F)(F)F)CC2)C1	1778879094	DBEIAOXZKKEAHI-RDTXWAMCSA-N	448.486	1.216	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)CCC3CCCC3)CCO2)C1	1779031525	SVQVCKLSAYAMEC-JOCHJYFZSA-N	429.521	1.099	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C#CC2(O)CCCCC2)C1	1779398132	IIWLUPGQHWKXOJ-WAOWUJCRSA-N	440.968	1.453	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(CCN(C(=O)c3cc(-c4ccncc4)[nH]n3)C2)C1	1779591640	UBUWEZZACAHEDO-LJQANCHMSA-N	448.321	1.700	50	20	IDGD	
COc1ncc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](F)Br)C3)C2)cc1F	1781326611	QPKBEYGNGXKWOR-BLLLJJGKSA-N	434.237	1.363	50	20	IDGD	
O=C(c1ccc(CO)c(F)c1)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781333069	BLUNDPVBTCYERQ-YOEHRIQHSA-N	433.249	1.452	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccccc3C(N)=O)C2)C1	1781761326	FCBKZYSCCUYWQQ-KXBFYZLASA-N	438.322	1.403	50	20	IDGD	
COc1ncc(Cl)cc1C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](C)Br)C2)C1	1783527671	FFXKXFKKEXJYBU-DIFFPNOSSA-N	446.729	1.971	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(S(C)(=O)=O)c3)[C@H]2C1	1783749275	YUSKHSSLPUIDHR-DKIMLUQUSA-N	442.965	1.701	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(C(F)(F)F)nc3)C[C@@H]21)[C@@H](O)CCl	1784086410	LMBPHXXDVADOFS-XUXIUFHCSA-N	435.830	1.293	50	20	IDGD	
O=C([C@@H](F)Br)N1CCO[C@]2(CCN(C(=O)[C@H](O)c3ccccc3Cl)C2)C1	1784253972	VQERYDMRBIQVCE-CPUCHLNUSA-N	449.704	1.894	50	20	IDGD	
CS(=O)(=O)c1ccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](F)Cl)CCO3)cc1F	1785226341	PVZYVPCRETUQRS-RHSMWYFYSA-N	436.864	1.207	50	20	IDGD	
C[C@H](Cn1cccn1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]21	1785442148	MYXSVYYCGRIOSS-CUGJGTHOSA-N	431.364	1.735	50	20	IDGD	
CC(=O)OC[C@H](OC(C)=O)C(=O)NC1(c2ccc(NC(=O)[C@@H](O)CCl)cc2)CCC1	1786134190	BGXMUKJYKBKOHN-IRXDYDNUSA-N	440.880	1.215	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cn[nH]c3)[C@H]2C1	1787614234	SOBLWJDBZYRSKL-LWOJADLZSA-N	441.438	1.888	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnn4ccccc34)[C@H]2C1	1787854893	WTSSFCQZAFLQSN-RMRKRWHISA-N	435.322	1.711	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)N3C[C@@H]4C[C@H]4C3)[C@H]2C1	1788516896	RVTPXIAJFOORHC-GOMYCMKKSA-N	442.398	1.480	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4c(c3)OCO4)C[C@@H]21	1791057633	NIQKNQDHANJIIA-MJFSBKNWSA-N	439.306	1.792	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1ccc(C2(NC(=O)c3cc4n(n3)CCC4)CCC2)cc1	1791601484	CJLDUCYDYCFXCF-UHFFFAOYSA-N	438.532	1.950	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c[nH]c3cc(Cl)ccc13)C2)[C@H](O)CCl	1792978373	SKJFDSCSJDOZKY-ZWUPXRALSA-N	426.300	1.624	50	20	IDGD	
CC(=O)N[C@@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCl)c1cccc(Cl)c1	1793115321	IYWZEOQPJQHPOG-FLXSYLCISA-N	442.343	1.755	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cncc(N(C)C)c1	1794293483	CKKWAZAFOOGKPU-FAYQHZLMSA-N	439.354	1.382	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](Br)Cc1ccccc1)C2)c1ccon1	1794928833	ZNPYWHHHLRUVRT-DFGXFYAUSA-N	448.317	1.884	50	20	IDGD	
O=C1CSc2cc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@H](F)Cl)C4)ccc2N1	1796291666	BYPPQCABYNAWCI-OJXGSEEGSA-N	427.885	1.468	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cc1ccc(Cl)s1)C2	1798440675	IQXPQSCYMREQEA-CLLJXQQHSA-N	447.948	1.895	50	20	IDGD	
C[C@@H](Cc1ccncc1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnccc1C(=O)NN	1798443137	VNCVCPNNANBARA-OWLYRPNTSA-N	436.516	1.211	50	20	IDGD	
Cn1c(=O)n(C)c2cc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)CO[Si](C)(C)C)ccc21	1798626320	XEFYIKGTMQQFHJ-BJWYYQGGSA-N	444.608	1.980	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CC(=O)N(C3CCCC3)C1)C2	1799263261	ILXTZVSHRZAVME-DHBZOUTCSA-N	425.957	1.385	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(OC)c(OC)c1O)C2	1799267901	FCCAKBWBEDJARB-LMWOUKEDSA-N	426.897	1.630	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(C(F)(F)F)[nH]1)C2)[C@@H](F)Br	1799349829	LPVZFGXKFBZLQI-IWXIMVSXSA-N	442.207	1.927	50	20	IDGD	
COc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Br)C3)c(F)c1	1799520975	KDFKIAWUVBPLNJ-OWLDWWDNSA-N	433.249	1.728	50	20	IDGD	
COC(=O)CCCCCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Br)C2	1801074986	MPGUMKRYVMGICE-VWPFQQQWSA-N	433.343	1.483	50	20	IDGD	
Cc1nccn1[C@H](C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)CBr)C2	1801453595	WVOAWTBUTPCBOU-LKAFINOVSA-N	427.343	1.373	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H]1CCc3ccccc3O1)C2	1802339676	HSTRDJZTCUZNMP-AJYBTWMASA-N	428.533	1.391	50	20	IDGD	
Cc1nn(C)c(C)c1CC(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]1c1cccnc1	1803145740	IADQWHDJEUGXMU-IMFGXOCKSA-N	433.940	1.280	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)CN2CC(=O)NC2=O)[C@@H]1c1cccnc1	1804183154	LJNBDWMAKZFRAL-VKJFTORMSA-N	435.912	1.047	50	20	IDGD	
CC(=O)N[C@H](Cc1cccc(F)c1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](O)CCl)C2	1804215507	BLUCESWOCNKXPB-RHQZKXFESA-N	439.915	1.111	50	20	IDGD	
CCOc1cnc(C(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@H]2c2cccnc2)cn1	1804912499	NZNUUMOQGQNDFB-LESCRADOSA-N	433.896	1.190	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)c1cnc(OCF)cn1	1805024727	AYYKKGOXLAWGFG-LXZKKBNFSA-N	437.859	1.097	50	20	IDGD	
CC1(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)CCCC1	1807360165	OSDVEUMMVMBSLX-CTNGQTDRSA-N	435.333	1.661	50	20	IDGD	
CC(C)N[C@H](C(=O)N1CCCC2(CCN(C(=O)c3cccc(B(O)O)c3)CC2)C1)C(C)C	1809942038	HWKUEJSUFQMDSH-NRFANRHFSA-N	443.397	1.234	50	20	IDGD	
C=C[C@H](O)C(C)(C)C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1810254145	VPALOSHXRMBWFW-BBTUJRGHSA-N	445.564	1.034	50	20	IDGD	
C=CC[C@H](C)C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1	1812588170	CCSFIYFQZLUDQJ-VPWXQRGCSA-N	436.516	1.612	50	20	IDGD	
O=C(Cc1ccc2c(c1)CCO2)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1	1812824106	JPAPHUWWTFKKCW-IPJJNNNSSA-N	443.931	1.865	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)CC2CCOCC2)[C@@H]1c1cccnc1	1813071478	QVRNLIHLEHSSFS-WMZHIEFXSA-N	445.564	1.277	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)Cn2cc([N+](=O)[O-])cn2)[C@@H]1c1cccnc1)C(Cl)Cl	1813078146	PRVVBZPSJWFARA-SWLSCSKDSA-N	441.275	1.696	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(F)s1)CC2)c1ccc(B(O)O)cc1	1815336828	FSMAQQFNZSKPJV-GFCCVEGCSA-N	445.306	1.563	50	20	IDGD	
Cc1nc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)cs1	1816580063	WHINLFONSDAHMB-OAHLLOKOSA-N	433.538	1.854	50	20	IDGD	
COc1cc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)ccn1	1817476524	JBDWYDWXXUMOFM-GOSISDBHSA-N	449.276	1.113	50	20	IDGD	
Cc1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCC(=O)NN(C)C)CC2	1817774692	GEBICZPBGAQPQB-CYBMUJFWSA-N	430.534	1.445	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccncn2)[nH]n1	1818111822	JXJLZKFIPHOVSO-ROCQKPIASA-N	449.475	1.640	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H]2CC2(F)F)[nH]n1	1819403051	TXBMXVURRFGLLB-OCCSQVGLSA-N	433.419	1.369	50	20	IDGD	
COc1ccnc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)CCC(=O)NN(C)C)CC3)c1	1820515769	AHIGGMZADAVJRP-LBPRGKRZSA-N	446.533	1.146	50	20	IDGD	
Cc1oncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827050629	AZJYXAIUMKTAEP-FQEVSTJZSA-N	425.294	1.210	50	20	IDGD	
O=C([C@@H](O)CCl)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2Cc3ccccc3CN2)CC1	1827566718	XXVSFINHSJJCOD-ACRUOGEOSA-N	433.980	1.920	50	20	IDGD	
CCSc1ncccc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1829578050	CUTGLVKWPXKVHY-KBXCAEBGSA-N	431.917	1.798	50	20	IDGD	
Cc1cccnc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2	1830535439	NVPLEFZHDGXRQJ-KXBFYZLASA-N	440.338	1.491	50	20	IDGD	
Cc1ncccc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)CBr)CCO2	1830537452	IQAIKUBKVCYFGM-KUHUBIRLSA-N	440.338	1.491	50	20	IDGD	
Cc1cc(Cl)ccc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1830719802	KSTLKLMYASJJOY-QFBILLFUSA-N	431.316	1.318	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H]2C[C@H](O)CN2)CC1	1831552134	MOQVQUZTEAUATE-VVLHAWIVSA-N	430.387	1.502	50	20	IDGD	
Cc1cc(CC(=O)N2CCC([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)nn1C	1831870385	BDAFRUPGEXBBBB-FQEVSTJZSA-N	446.596	1.264	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(F)cn2)CC1	1831872502	ZLHFVEJXNBXVME-IBGZPJMESA-N	433.528	1.827	50	20	IDGD	
CC(C)N1CCC[C@H]1C(=O)N1CCCC[C@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1	1832445978	DGQADAYWFQZXCD-SFTDATJTSA-N	449.640	1.852	50	20	IDGD	
C[C@H](Cn1cccn1)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1	1833200515	BWYHYIRKDVFMES-MNEFBYGVSA-N	447.363	1.212	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)CS(=O)(=O)CC)CC2)CC1	1833530168	NNICEQLHPCTALH-QGZVFWFLSA-N	436.018	1.400	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](COC)NC(C)=O)CC2)CC1	1833533351	BFARQIAQUGYSRF-RBUKOAKNSA-N	445.004	1.117	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](F)Cl)CC2)CC1)c1cnc(OCF)cn1	1833989138	CYJQPAUNSIYEEE-INIZCTEOSA-N	431.871	1.502	50	20	IDGD	
CN(C)c1ccc(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](F)Cl)CC3)CC2)nc1	1834010749	FXWOVMBPFBHBIK-GOSISDBHSA-N	425.936	1.867	50	20	IDGD	
CC(C)c1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)no1	1834498827	KYNLPEXECISUSI-YOEHRIQHSA-N	448.289	1.559	50	20	IDGD	
CCc1[nH]nc(C(=O)NC2CCN(C3CCN(C(=O)[C@H](O)CCl)CC3)CC2)c1Cl	1834903626	CSSZWSACOJSFCI-OAHLLOKOSA-N	446.379	1.410	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3ccccc3-n3nccn3)CC2)CC1)[C@@H](F)Cl	1835081619	XHUYHEAQGYATAN-LJQANCHMSA-N	448.930	1.987	50	20	IDGD	
C[C@H](Nc1cccnc1)C(=O)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1835695365	FGZIEWBMPDCCEV-SCLBCKFNSA-N	431.320	1.142	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](F)Cl)CC2)CC1)c1ccc(-n2cccn2)nc1	1835979030	WVGTUSLCQAYYKS-LJQANCHMSA-N	448.930	1.987	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cccc(=O)n3O)CC2)CC1	1837285718	XNXWTWVKZXYJTR-INIZCTEOSA-N	425.913	1.715	50	20	IDGD	
CCc1nc(C(=O)N2CCOC[C@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)co1	1837715205	CDBKDSQDRWDPQC-IBGZPJMESA-N	425.558	1.159	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@](C)(Cl)CCl)C3)C2)c(O)n1	1838672165	KDNSIJOYCIMLAX-RTBURBONSA-N	446.331	1.402	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)c(OC)c1	1838879863	MAPLUTZZJQLPDC-APWZRJJASA-N	430.860	1.308	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C#CC3(O)CCCCC3)C2)C1	1839146340	XESTVVYVWYDLFF-DYESRHJHSA-N	426.941	1.159	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3onc4ccccc34)CCO2)C1	1839547603	HIPZKDZDQPYVCD-QRWLVFNGSA-N	437.880	1.152	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccccc3)C2)C1	1839963553	OELNBSHQPCFYEC-XLIONFOSSA-N	439.350	1.859	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)C[C@H](C)c3ccccc3)C2)C1	1840156552	VBTLIPYQGAQNJN-JLMWRMLUSA-N	438.952	1.890	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)/C=C/c3ccc(C)s3)C2)C1	1840156732	YIMNMSPHILBJGJ-YWMZBHJASA-N	442.965	1.780	50	20	IDGD	
Cc1cnn([C@@H](C)C(=O)N2CCO[C@@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)c1	1840404723	BORPLDSDVCDFDW-FXAWDEMLSA-N	438.601	1.060	50	20	IDGD	
Cc1ncncc1C(=O)N1CC2(CCCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C1	1841924749	XSEBFQUYRDIIFF-HNNXBMFYSA-N	437.928	1.734	50	20	IDGD	
CC#C[C@H](CC(=O)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1)c1ccc(O)cc1	1843012460	QTHQHMAGZIFMAW-HXUWFJFHSA-N	446.312	1.086	50	20	IDGD	
COC(=O)CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)[C@H](F)Cl)C1	1843365451	RBHMIEUHXDBAOB-JSGCOSHPSA-N	449.907	1.571	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)[C@@H]1C[C@@H]1c1ccc(F)cc1)C2	1844263176	BPHFVWLQUVQJEU-QZTJIDSGSA-N	437.475	1.445	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2cc(C(=O)O)ccc2OC)ccc1OC(C)C	13361177	LFDDEYHXLUEADJ-UHFFFAOYSA-N	438.458	1.813	50	20	IDGD	
CCOc1ccc(OCc2ccc(C(=O)NNC(=O)CN3CSCC3=O)cc2)cc1	21195327	RQAIDQUYSZZEHB-UHFFFAOYSA-N	429.498	1.958	50	20	IDGD	
Cn1cc(S(N)(=O)=O)cc1C(=O)NNC(=O)CCCOc1ccc(Cl)cc1Cl	21330533	RVSNMRILAHXCSX-UHFFFAOYSA-N	449.316	1.600	50	20	IDGD	
Cc1c(C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)nnn1-c1cccc([N+](=O)[O-])c1	24490254	VUZUKCSJNXLECK-LBPRGKRZSA-N	428.380	1.852	50	20	IDGD	
CC[C@H](C)C(=O)N1Cc2ccccc2C[C@@H]1C(=O)NNC(=O)CNC(=O)c1ccco1	725742047	ZBKNWYIWDJVQAA-WMLDXEAASA-N	426.473	1.156	50	20	IDGD	
COc1ccc(Br)c(CNC(=O)NNC(=O)CNC(=O)c2ccco2)c1	725871453	LHMIIEAXOFNMRE-UHFFFAOYSA-N	425.239	1.311	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)N[C@@H](c1ccc2c(c1)OCCO2)C1CC1	725872375	DNBKODVABNWXPE-GOSISDBHSA-N	430.486	1.731	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)[C@@H]1CC(=O)N(Cc2ccc(OC)cc2)C1	726496705	GYAJVYNKEAUXRF-QGZVFWFLSA-N	441.484	1.669	50	20	IDGD	
CN1C[C@@H](NC(=O)/C(C#N)=C/c2cn(CCC(N)=O)nc2-c2ccc(Cl)cc2)CC1=O	726538107	XGAWUPVWMIJQGT-AAKUMTKESA-N	440.891	1.333	50	20	IDGD	
O=Cc1ccc(OCC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)cc1	727364393	MNCBNQRCNOPUIE-UHFFFAOYSA-N	445.497	1.514	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@@H]2CSCN2C(=O)CC(C)(C)C)cc(OC)c1OC	727752813	JYTIUMKSCUFPRT-ZDUSSCGKSA-N	439.534	1.811	50	20	IDGD	
CN1CCN(C[C@@H](NC(=O)NNC(=O)COc2ccc(F)cc2)c2ccccc2)CC1	727944959	HSOYFABCQRAIFE-HXUWFJFHSA-N	429.496	1.524	50	20	IDGD	
CC(C)NC(=O)C(=O)NNS(=O)(=O)c1ccc(Br)cc1C(F)(F)F	728171211	ULYFMCPIZAAGNA-UHFFFAOYSA-N	432.218	1.302	50	20	IDGD	
COc1ccccc1-n1c(C)nnc1SCC(=O)N([C@@H]1CCS(=O)(=O)C1)N(C)C	728180734	XDBNENZZJOAFEW-CQSZACIVSA-N	439.563	1.169	50	20	IDGD	
Cc1nn(Cc2ccccc2Cl)c(Cl)c1C(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1	728374314	LWUJOUUKHFOYDZ-GFCCVEGCSA-N	445.328	1.742	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)C[C@H](c2ccccc2)N2CCOC2=O)n1	728732300	HIQVHXUXNKIECF-OAHLLOKOSA-N	446.485	1.268	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)Cc3cccnc3)CC2)cc1	728851898	COFBNXVXYQOQLJ-UHFFFAOYSA-N	446.529	1.271	50	20	IDGD	
C[C@@H](C(=O)Nc1cccc(F)c1)N1CCN(C(=O)NNC(=O)Cc2cccnc2)CC1	728957244	ONTWBARFMJTEFV-HNNXBMFYSA-N	428.468	1.149	50	20	IDGD	
O=C(NCCNS(=O)(=O)c1cccc(Cl)c1)NNC(=O)c1cccc2ncccc12	730114113	GMNWBIYXVUDBAW-UHFFFAOYSA-N	447.904	1.811	50	20	IDGD	
COC(=O)Cc1cc(=O)n(-c2ccc(C(=O)NNc3nc(-c4ccccc4)no3)cc2)[nH]1	732113396	TZGSHRNWKIAUTQ-UHFFFAOYSA-N	434.412	1.688	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2cc(F)ccc2I)C[C@@H](C)O1	732262130	JGSZBESZADRGIF-PHIMTYICSA-N	449.264	1.691	50	20	IDGD	
CCN1CCCC[C@@H]1CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	732471216	MCORTTJZGIHXMQ-QGZVFWFLSA-N	437.566	1.290	50	20	IDGD	
Cc1ccccc1-n1cc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cn1	732683027	BBZSJIAKCSWGLI-LJQANCHMSA-N	436.424	1.325	50	20	IDGD	
C[C@@H]([C@@H](C)N(C)C(=O)CCC(=O)C(C#N)=C1N(C)c2ccccc2N1C)S(C)(=O)=O	733277139	YAOGNSQNCGDSEA-CABCVRRESA-N	432.546	1.937	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2ccnc(OC3CCOCC3)c2)c1	733353384	LTDKWXDVUTUSCK-UHFFFAOYSA-N	448.501	1.187	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)NCC2(O)CCCC2)cc1	733977693	IRFWNDUOUWATSB-SFQUDFHCSA-N	437.500	1.762	50	20	IDGD	
COc1ccc([C@@H]2[C@H](C(=O)NNC(=O)COc3ccccc3OC)CCC(=O)N2C)cc1	734417678	IQLOKUSPUVLKNG-VGOFRKELSA-N	441.484	1.840	50	20	IDGD	
Cc1cc(C)c(S(=O)(=O)N2CCC(C(=O)NNC(=O)c3cnn(C)c3)CC2)c(C)c1	735445843	CBPKWAJJMKUHTQ-UHFFFAOYSA-N	433.534	1.207	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)N[C@H](C)CN1CCN(c2ccccn2)CC1	735586418	LSIURQIRBUQDSJ-QGZVFWFLSA-N	442.520	1.010	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)CCN2C(=O)c3ccccc3C2=O)cc1C	736731125	XCICUJBHMXHVIX-UHFFFAOYSA-N	443.481	1.609	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)C(=O)C1)NNC(=O)c1ccc([N+](=O)[O-])cc1	738339116	GABNROSCMCZJAZ-UHFFFAOYSA-N	445.863	1.354	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)[C@@H]2CCCN2Cc2ccccn2)c2ccccc2c1=O	741139509	XHXKTHPRVAEPBP-IBGZPJMESA-N	434.500	1.627	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN(C(=O)c2ccc(Br)c(F)c2)C1)NC1CC1	742053907	UULCNZIHHGTSEY-LLVKDONJSA-N	427.274	1.933	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Cc2ccc(NC(=O)C3CC3)cc2)c2ccccc2c1=O	742474257	PTFFZNCAUPXCHV-UHFFFAOYSA-N	433.468	1.769	50	20	IDGD	
CCn1c(=O)c2ccccc2n(CC(=O)NNC(=O)Nc2ccc(C)cc2Cl)c1=O	743825116	SSBICYWMPFHWNN-UHFFFAOYSA-N	429.864	1.998	50	20	IDGD	
CCOc1ccc(C(=O)NCC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)cc1	743830507	GOETZAVRIUGHRU-UHFFFAOYSA-N	434.474	1.072	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)CN2CCC(NC(=O)Nc3ccc(F)cc3)CC2)cc1	744388827	WLWHBZZJFOKQKK-UHFFFAOYSA-N	438.463	1.744	50	20	IDGD	
O=C(NCC(F)(F)F)NNC(=O)c1ccc(S(=O)(=O)NCc2cccs2)cc1	744471703	TZPDZUHPBVPCEZ-UHFFFAOYSA-N	436.437	1.733	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)NCCS(=O)(=O)NC(C)C	746512033	CSZKJXLWUIGYTE-UHFFFAOYSA-N	425.536	1.390	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cnn(CC(=O)NC3CCCCC3)c2)cc1OC	746580370	WKAZNSXVDAEBSM-UHFFFAOYSA-N	429.477	1.424	50	20	IDGD	
O=C(NCC(=O)N1CCC(Cc2ccccc2)CC1)NNc1ccc(-n2cccn2)nn1	746775585	HWVQQBBKHUCVOD-UHFFFAOYSA-N	434.504	1.770	50	20	IDGD	
NC(=O)N[C@H](CC(=O)NNC(=O)C(=O)N1CCCC1)c1cccc(Oc2ccccc2)c1	748246310	IMDUOVVYCYHTPH-GOSISDBHSA-N	439.472	1.348	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3ccccc3SCC#N)cc2)CC1	748619604	MDRWWGBMEHYCDJ-UHFFFAOYSA-N	445.570	1.995	50	20	IDGD	
COC(=O)c1c(Br)ccc(NC(=O)C(=O)NNC(=O)c2ccccc2)c1C	753839673	MMTVCFFNPAGEEV-UHFFFAOYSA-N	434.246	1.944	50	20	IDGD	
CCc1cc(NNC(=O)c2cnn3c2C[C@H](CNC(C)=O)CC3)nc(-c2ccccn2)n1	754223160	HZCFSJAGDCFNIC-OAHLLOKOSA-N	434.504	1.753	50	20	IDGD	
Cc1ccc(N(CCC(=O)NNC(=O)Cc2cc[nH]n2)S(=O)(=O)c2ccccc2)cc1	755278232	ZUPMDRYLFSIOGQ-UHFFFAOYSA-N	441.513	1.694	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)Nc2ccc(CN3C(=O)CCC3=O)cc2)cc1	755662500	LFESBPJYBCNBLW-UHFFFAOYSA-N	426.429	1.576	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)cc1OCC(F)(F)F	755666039	VEPCEXZDMHVRDB-VIFPVBQESA-N	425.385	1.224	50	20	IDGD	
CCCC[C@H](NC(=O)[C@@H](C)NC(=O)C(C)(C)C)C(=O)NNC(=O)c1ccc(C)cc1O	755694400	KISJZXMQNIWEPW-ZBFHGGJFSA-N	434.537	1.687	50	20	IDGD	
CSc1nnnn1-c1cccc(NC(=O)NNC(=O)c2nnc(O)c3ccccc23)c1	755731346	SWGBRSPTMWYRQD-UHFFFAOYSA-N	437.445	1.500	50	20	IDGD	
CN(C(=O)Cc1ccc(NC(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)cc1)c1ccccc1	756099528	NFFBTBQPVSRVHL-MRXNPFEDSA-N	444.513	1.480	50	20	IDGD	
CNS(=O)(=O)c1ccc(C)c(NC(=O)NNC(=O)[C@H](C)Oc2ccc(C(C)=O)cc2)c1	756528549	UKNJBFGUJNTUKG-AWEZNQCLSA-N	448.501	1.726	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)Nc1ccc(S(=O)(=O)NCC2CC2)cc1	756786241	ZKHXEPVTKFAGEL-UHFFFAOYSA-N	448.501	1.615	50	20	IDGD	
O=C(NNC(=O)c1cc(Cl)cs1)c1cccc(S(=O)(=O)N2CCOCC2)c1	757767222	MCTWMRJJLJFNFA-UHFFFAOYSA-N	429.907	1.497	50	20	IDGD	
Cc1nn([C@@H]2CCS(=O)(=O)C2)c(C)c1NC(=O)NNC(=O)c1c[nH]c2ccccc12	757871237	FWMXKJOBVUKDDN-CYBMUJFWSA-N	430.490	1.807	50	20	IDGD	
O=C(NNC(=O)c1n[nH]c(-c2ccccc2)c1Br)C(=O)Nc1ccccn1	758838072	AJYKXCACYMGULF-UHFFFAOYSA-N	429.234	1.634	50	20	IDGD	
COc1ccc(C(=O)CC(C)(C)CC(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)cc1	759368574	IPOLEYUXPSBUFS-AWEZNQCLSA-N	425.507	1.202	50	20	IDGD	
O=C(Cc1ccccn1)NNC(=O)C(=O)Nc1cc2ccccc2nc1Br	760277530	MRQZZALJHKGQFL-UHFFFAOYSA-N	428.246	1.721	50	20	IDGD	
O=C(COCc1ccccc1)NNS(=O)(=O)c1ccc(Br)c([N+](=O)[O-])c1	760361200	RSCSGCWCHVXCKU-UHFFFAOYSA-N	444.263	1.884	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCCOc2ncccc2Cl)c2ccccc2c1=O	761780900	PPRGOOJFFXHKSB-UHFFFAOYSA-N	430.852	1.488	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N[C@@H]2C=C[C@H](CO)C2)cc1	761902063	ONPUUTDTVFNXDT-LYTHMUMPSA-N	435.484	1.394	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H]1[C@@H]1COCCC1=NNC(=O)CNC(=O)c1ccco1	762422788	AOQVIQQAFCHXQL-ZBFHGGJFSA-N	434.493	1.918	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)NCCCS(=O)(=O)Cc1ccccc1	763291535	AIDNQQQGTAHKDV-UHFFFAOYSA-N	437.543	1.820	50	20	IDGD	
COC(=O)[C@H](C)Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3n2)cc1	763449746	HLOUHCRWUCCENN-CQSZACIVSA-N	434.452	1.986	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cccc(N3CCN(CC4CC4)CC3)c2)c(C)o1	763577633	YHXLPWDUXAHWHD-UHFFFAOYSA-N	439.516	1.828	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(S(=O)(=O)N3CCCC3)cc2)c(C)o1	763578949	PRVGYCFVVKQODH-UHFFFAOYSA-N	434.474	1.081	50	20	IDGD	
CCS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)cc1	763605469	UBAKWLSIYIQQIM-UHFFFAOYSA-N	441.469	1.270	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2ccccc2-n2c(C)cnc2O)c1	763649964	OMNAMJIHBOEUOY-UHFFFAOYSA-N	437.456	1.668	50	20	IDGD	
CO[C@@H](C)C(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)c1	763727240	IWHUCUYQHYNENG-HDDXYUSQSA-N	442.516	1.962	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2cccc(OCCF)c2)c2ccccc2c1=O	763787301	WTERJUAUUCGXPV-UHFFFAOYSA-N	441.419	1.164	50	20	IDGD	
CC(C)C(=O)NNC(=O)C(=O)Nc1ccc(CN2CCN(Cc3ccccc3)CC2)cc1	763817328	HLDUIAFWDMGLTR-UHFFFAOYSA-N	437.544	1.746	50	20	IDGD	
CNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)c1C	763839425	GUYJVZGAUPXTMG-HNNXBMFYSA-N	426.473	1.525	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(CCN(C)C)cc2)c1C	763851469	CVWSRPRDWPIJQG-QGZVFWFLSA-N	426.517	1.961	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1cccc(Cn2cncn2)c1	763858731	WUVZYUFUDMKEAC-CYBMUJFWSA-N	426.408	1.019	50	20	IDGD	
C[C@H]1COCCN1c1ccc(NC(=O)C(=O)NNC(=O)Cc2c[nH]c3ccccc23)cc1	763860947	MATKUGQRCCXDHQ-HNNXBMFYSA-N	435.484	1.722	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cc(C)n([C@@H](C)C3CC3)n2)cc1	763878638	SDGAJNFZTDLJIN-ZFWWWQNUSA-N	441.488	1.919	50	20	IDGD	
COc1cc(C(=O)N(C)C)ccc1NC(=O)C(=O)NNC(=O)CSc1ccc(C)cc1	763895409	DQNHYABXSUIWGE-UHFFFAOYSA-N	444.513	1.584	50	20	IDGD	
NC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ccc(COc3ccccc3)o2)ccc1F	763949164	HOWZWSGZXVFEDX-UHFFFAOYSA-N	440.387	1.496	50	20	IDGD	
NC(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(-c3ccc(F)cc3)s2)cc1	763976601	WZEVKJRTNUTXSX-UHFFFAOYSA-N	440.456	1.982	50	20	IDGD	
CN(C)c1ncc(NC(=O)C(=O)NNC(=O)c2ccc(Br)cc2Cl)cn1	764058346	GDJZELJEWQSUBT-UHFFFAOYSA-N	441.673	1.358	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccccc1CC(=O)OC(C)(C)C	764138707	INJHKIIKUPJLNR-UHFFFAOYSA-N	441.484	1.908	50	20	IDGD	
O=C(NNC(=O)c1ccoc1)C(=O)Nc1ccccc1CS(=O)(=O)c1ccccc1	764162899	FNGNTMKRCCYUEF-UHFFFAOYSA-N	427.438	1.653	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)C(=O)Nc2ccc3nccnc3c2)c1	764231912	KAJYUVGQWISIJG-UHFFFAOYSA-N	444.245	1.801	50	20	IDGD	
Cc1cc(C)c(NC(=O)C(=O)NNC(=O)COc2ccccc2O)c(Br)c1	764281150	ZYPJKSYGVAIVPK-UHFFFAOYSA-N	436.262	1.936	50	20	IDGD	
Cc1cc(C(=O)NCC(C)C)ccc1NC(=O)C(=O)NNC(=O)CCc1ccccc1O	764289684	YIBBVGFTQHKZOI-UHFFFAOYSA-N	440.500	1.805	50	20	IDGD	
O=C(Cc1cc[nH]n1)NNC(=O)C(=O)Nc1cc(Br)cc(C(F)(F)F)c1	764293978	SCVLADUWGNEARD-UHFFFAOYSA-N	434.172	1.520	50	20	IDGD	
Cc1nc(COc2ccc(NC(=O)C(=O)NNC(=O)COCc3ccccc3)cc2)no1	764367145	UIHZVHCUKZVTHL-UHFFFAOYSA-N	439.428	1.260	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1ccccc1C[S@@](C)=O	764393070	CFTUTMMNXBBQLN-GDLZYMKVSA-N	435.527	1.452	50	20	IDGD	
CCOc1ccc(C(=O)NNS(=O)(=O)c2cnn(-c3ccccn3)c2C)cc1OC	765031999	YTELFKXPRRFGKF-UHFFFAOYSA-N	431.474	1.606	50	20	IDGD	
O=C(CC1CCCC1)NCC(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	765757376	SBOWSDISZOMMSF-UHFFFAOYSA-N	449.983	1.302	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc(C#N)cc3OC)n[nH]2)cc1	766259724	HJMAOURINLADKF-UHFFFAOYSA-N	432.440	1.919	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1ccccc1CS(=O)(=O)c1ccccc1	766260827	KSINIDNTZNISCA-UHFFFAOYSA-N	441.469	1.541	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)cnn1C1CCOCC1	766757236	HAVHFJMQYONKLU-UHFFFAOYSA-N	438.488	1.909	50	20	IDGD	
Cc1c(C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cnn1C1CCOCC1	766994226	NZKQICWAHIHHLI-UHFFFAOYSA-N	431.405	1.069	50	20	IDGD	
CCOc1cc(NC2CCN(C(=O)NNC(=O)COCc3ccccc3)CC2)ncn1	767321171	JDRKBSNCAHMIKI-UHFFFAOYSA-N	428.493	1.709	50	20	IDGD	
CC(C)(C(=O)NNC(=O)C(=O)Nc1cc(C2CC2)nn1-c1ncccn1)c1ccccc1	768242568	TUYALYHVPAJNSG-UHFFFAOYSA-N	433.472	1.603	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)CN1C(=O)N[C@@]2(CCCC(C)(C)C2)C1=O	768571480	OEOUOUSMDIDQCX-OAQYLSRUSA-N	426.477	1.295	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)N[C@@H]1CCCN(c2ccn(C)n2)C1=O	770567247	ITKFJUGBJVEIGE-SWLSCSKDSA-N	434.884	1.367	50	20	IDGD	
COCCOCC(=O)NC1CCC(C(=O)NNc2ccnc(Br)c2)CC1	771551861	GZAVQNIULMEKAU-UHFFFAOYSA-N	429.315	1.625	50	20	IDGD	
CCN=c1nc(NCC)n2c(SCC(=O)NNc3c(F)cccc3Cl)n[nH]c2n1	771675332	XPWNPWIXYRELIG-UHFFFAOYSA-N	439.908	1.833	50	20	IDGD	
Cc1nc2[nH]n(C)c(=O)c2c(C)c1CC(=O)NNC(=O)[C@H](C)Oc1cccc(Cl)c1	772998935	RMAQFFNUYXBLGK-LBPRGKRZSA-N	431.880	1.689	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)Nc1cc(C(F)(F)F)ccn1	773527609	JFNUAQJHEVRWFX-UHFFFAOYSA-N	434.172	1.601	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC2(CCN(C(=O)NNC(=O)CNC(=O)c3ccco3)C2)CC1	773528963	AFFUAXDOSUARFP-UHFFFAOYSA-N	449.508	1.473	50	20	IDGD	
COc1ccc(S(=O)(=O)NC(C)(C)C)cc1NC(=O)C(=O)NNc1ccc(C#N)cc1	773696457	BHDVPYOOKGYZRG-UHFFFAOYSA-N	445.501	1.725	50	20	IDGD	
C[C@@H]1CN(C(=O)c2ccc(NC(=O)C(=O)NNc3cnc4ccccc4n3)cc2)C[C@@H](C)O1	773719728	YTBZNFUOVIPLNI-HUUCEWRRSA-N	448.483	1.961	50	20	IDGD	
O=C(NNc1ccc(C(F)(F)F)cn1)Nc1ccc(S(=O)(=O)N2CCOCC2)cn1	776060987	BKLBKRIPCMBNAU-UHFFFAOYSA-N	446.411	1.665	50	20	IDGD	
O=C(NNC(=O)c1cc2c(s1)CCCCC2)N[C@@H]1CCO[C@]2(CCS(=O)(=O)C2)C1	776076507	MDYXZRDTYXYLPV-AUUYWEPGSA-N	441.575	1.697	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)CN1CCN(c2nnc(C(F)(F)F)s2)CC1	776863931	FRAPWQLIVKDBGB-UHFFFAOYSA-N	442.467	1.377	50	20	IDGD	
COc1ccc(N2CCN(C(=O)/C=C\C(=O)NNc3ccccc3[N+](=O)[O-])CC2)cc1	778220443	FZSLMNHCSNJHIO-KHPPLWFESA-N	425.445	1.952	50	20	IDGD	
CN(NC(=O)c1ccc(NS(=O)(=O)c2ccc(Br)cc2)cc1)C(N)=O	778418852	SUMWYMXFXOUZPA-UHFFFAOYSA-N	427.280	1.905	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)[C@@H](Cc1ccccc1)NC(=O)c1ccccc1	778434306	YYOJFDOQKDBLNJ-GOSISDBHSA-N	440.500	1.700	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2COCCO2)cc1OCc1cccc(Cl)c1	778710525	IFJUDPGNAQSWQJ-GOSISDBHSA-N	447.875	1.729	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)CC1	780696252	JERKRDMAIPUZJE-HNNXBMFYSA-N	444.496	1.396	50	20	IDGD	
C[C@@H]1CC[C@H](NC(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)C1	780788132	UGMJRXDWHIPXHQ-WBVHZDCISA-N	438.550	1.159	50	20	IDGD	
O=C(NN=Cc1c(Sc2nnnn2-c2ccccc2)nc2ccccn2c1=O)C(F)F	782235840	KNLUJENBPWXCSB-UHFFFAOYSA-N	442.411	1.537	50	20	IDGD	
O=C1[C@@H](N2CCN(S(=O)(=O)CBr)CC2)CCCN1Cc1ccccc1	782477405	UEPUPKTUOSRECI-INIZCTEOSA-N	430.368	1.477	50	20	IDGD	
CCc1ccc(CC)c(NC(=O)C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)c1	782897369	NWEQSZQEDZSSEL-UHFFFAOYSA-N	445.545	1.813	50	20	IDGD	
O=C(NNc1ncnc2ccsc12)C(=O)Nc1ccc(S(=O)(=O)NC2CC2)cc1	783255680	VDGGQPFCCHHRCR-UHFFFAOYSA-N	432.487	1.214	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(N(C)C)c(NC(=O)C(=O)NNc2cc(C)ccn2)c1	783934366	QGEAYSOOZSPLHR-UHFFFAOYSA-N	448.549	1.568	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1ccc(OC(F)F)c(Cl)c1	784003702	MFPKAHNCFOUKBA-UHFFFAOYSA-N	446.819	1.519	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CCOCC1)c1ccc(Br)s1	784295312	FNQNFRXSXWLOLQ-NEPJUHHUSA-N	442.335	1.713	50	20	IDGD	
CCOC(=O)c1cnn(-c2cccc(NC(=O)C(=O)NNc3nccnc3Cl)c2)c1C	784776626	PCZRNOFHHYUECB-UHFFFAOYSA-N	443.851	1.883	50	20	IDGD	
COCCCS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2cccc([N+](=O)[O-])c2)cc1	784834116	VWVGAYKXWCZGFH-UHFFFAOYSA-N	436.446	1.487	50	20	IDGD	
CN(c1ccccc1NC(=O)C(=O)NNc1ccnc(Br)c1)S(C)(=O)=O	784837143	JIEYOQXBIKKDNJ-UHFFFAOYSA-N	442.295	1.322	50	20	IDGD	
CN(c1ccccc1)S(=O)(=O)c1cccc(NC(=O)C(=O)NNc2ncc(F)cn2)c1	784949509	FISRZAMOYMGZNI-UHFFFAOYSA-N	444.448	1.523	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)c1C	785977915	PPDAZSNNOUWTPN-UHFFFAOYSA-N	446.533	1.041	50	20	IDGD	
CC[C@H](O[C@@H]1CCC[C@@H](C)C1)C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	786352668	SAWJXDYYIABDDN-JEWRLFTDSA-N	434.489	1.891	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2OC)c(C)cc1C	788331555	SJMGINVWIGJEJV-UHFFFAOYSA-N	429.429	1.264	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)[C@H](C)[C@@H](C)C(=O)NNC(=O)c1ccccc1OC	790615991	JOHNRQGMQWGPQM-ZIAGYGMSSA-N	442.472	1.198	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N[C@H](C)c1nnnn1C1CC1	790711724	BJGNPEJSVSTNLX-NXEZZACHSA-N	438.286	1.629	50	20	IDGD	
O=C(C#Cc1ccc(C(F)(F)F)cc1)N1CCN(S(=O)(=O)CBr)CC1	790850060	BXLOQNOZGODTHZ-UHFFFAOYSA-N	439.253	1.883	50	20	IDGD	
COc1cc(Cl)c(Cl)cc1NC(=O)C(=O)NNC(=O)[C@H]1COc2ccccc2O1	792268511	NCTVZKZPKBRDOH-OAHLLOKOSA-N	440.239	1.928	50	20	IDGD	
Cc1cc(C)c(C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)cc1I	792855749	BRIBFNBSERDKEF-SNVBAGLBSA-N	436.271	1.104	50	20	IDGD	
COc1c(NC(=O)C(=O)NNC(=O)C(C)(C)c2ccccc2)cc(Cl)cc1C(N)=O	793024236	DMORNGWIMKVCPE-UHFFFAOYSA-N	432.864	1.511	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)c2cc(Cl)sc2S(N)(=O)=O)cc1	794721042	PFQSTGMVNGVJCC-UHFFFAOYSA-N	438.940	1.056	50	20	IDGD	
COC(=O)c1c(CC(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)[nH]c(C(C)=O)c1C	794730169	JULKZNGNKJOCPA-UHFFFAOYSA-N	436.490	1.248	50	20	IDGD	
NC(=O)Cc1occc1C(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	794813366	ALAPNQAZEKFLTL-UHFFFAOYSA-N	448.482	1.245	50	20	IDGD	
CCOC(=O)c1cc(S(=O)(=O)NNC(=O)c2c(C)nc3ccccn23)c(F)cc1C	795281179	RYEIYLXZBBPAJR-UHFFFAOYSA-N	434.449	1.890	50	20	IDGD	
CCNC(=O)N(C)c1cccc(NC(=O)C(=O)NNC(=O)COc2cc(C)cc(C)c2)c1	796992824	XRLUWZFPFWLGTQ-UHFFFAOYSA-N	441.488	1.634	50	20	IDGD	
Cc1ccc(-c2cccnc2)cc1NC(=O)C(=O)NNC(=O)CNC(=O)c1cccs1	797072775	XULQPBQPIGLIGW-UHFFFAOYSA-N	437.481	1.634	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNC(=O)C(=O)Nc1ccccc1OC(F)F	797369267	RMTWEZPOFWAZLC-UHFFFAOYSA-N	436.371	1.300	50	20	IDGD	
COc1cc2c(cc1S(=O)(=O)NNC(=O)c1cc(C)nc3ccccc13)OCC(=O)N2	797428263	UNWGJYLISMFUPL-UHFFFAOYSA-N	442.453	1.506	50	20	IDGD	
Cc1nn(C)c(Br)c1C(=O)OCC(=O)NNC(=O)c1cccc(Cl)c1	801506699	SJKOGAYKICNXQT-UHFFFAOYSA-N	429.658	1.762	50	20	IDGD	
CC(C)(NS(C)(=O)=O)C(=O)NNC(=O)Nc1ccc(Br)cc1Cl	802040358	DFTAMFICACINHG-UHFFFAOYSA-N	427.708	1.583	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)CCC[C@@]2(C)NC(=O)NC2=O)c(OC)cc1Cl	802079779	AEIBVNRYZXLFRC-QGZVFWFLSA-N	427.845	1.278	50	20	IDGD	
O=C(CN1CCN(C(=O)OCc2ccccc2)CC1)NNc1ccc(-n2ccnc2)nn1	804953996	JEQOSAPGDKMLCB-UHFFFAOYSA-N	436.476	1.060	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)N1CC[C@@H](N2CCN(C(=O)OC(C)(C)C)CC2)C1	805097548	RTSXIIWLWUKVIM-MRXNPFEDSA-N	447.536	1.677	50	20	IDGD	
O=C(COCc1cccnc1)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	806347290	JEMMOFVXTSEANG-UHFFFAOYSA-N	443.467	1.761	50	20	IDGD	
CCOC(=O)C(C)(C)c1csc(NC(=O)C(=O)NNC(=O)c2ccc(C)cc2O)n1	806976156	GVCZLLLBZDPFFE-UHFFFAOYSA-N	434.474	1.398	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)nc1)C(=O)Nc1cc(F)c(N2CCOCC2)cc1F	806976478	QQRLOIIZFBDMTC-UHFFFAOYSA-N	439.806	1.250	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)NCCCN1CCCCCC1=O	807009477	ONIIYQZIFVUWFO-UHFFFAOYSA-N	441.326	1.951	50	20	IDGD	
Cc1ccc([C@@H](CNC(=O)NNC(=O)Cc2nc3ccccc3n2C)N2CCOCC2)o1	807023713	SBAJUBNCPOIRAZ-GOSISDBHSA-N	440.504	1.421	50	20	IDGD	
CN1CCN(C(=O)NNC(=O)[C@@H]2CCC(=O)N(C)[C@@H]2c2ccc(C(F)(F)F)cc2)CC1	807380622	KWDSNOBXZXLQPR-NVXWUHKLSA-N	441.454	1.603	50	20	IDGD	
CCc1nnc(NC(=O)[C@H](C)[C@H](C)NC(=O)NNC(=O)COc2ccc(C#N)cc2)s1	807566653	ZPJCFAMGWUBWSP-NEPJUHHUSA-N	445.505	1.345	50	20	IDGD	
COC(=O)c1c(F)ccc(NC(=O)C(=O)NNC(=O)CCc2ccc(OC)cc2)c1F	810386561	GZHJAKJKOHHMRJ-UHFFFAOYSA-N	435.383	1.479	50	20	IDGD	
COc1ccc(NNC(=O)CNS(=O)(=O)c2ccc(NC(C)C)c([N+](=O)[O-])c2)nc1	811320694	XMQWMHOOUFZTGO-UHFFFAOYSA-N	438.466	1.240	50	20	IDGD	
O=C(NNC(=O)N1CCCN2c3ccccc3C[C@H]2C1)c1csc(N2CCOCC2)n1	811850602	ANTDBILYMHBKCL-INIZCTEOSA-N	442.545	1.471	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@H](F)C[C@H]1CNC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	813816530	ZCWLDLQYUBJVQB-JSGCOSHPSA-N	425.417	1.886	50	20	IDGD	
CCC[C@@H](C)C(=O)NCCNC(=O)NNC(=O)COc1ccc(Br)cc1	814431498	KOLXDXVLPHIXLN-GFCCVEGCSA-N	429.315	1.711	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)C(=O)Nc2cnn(CC(F)F)c2)c1	815866971	WRHMSVNSHWFGIW-UHFFFAOYSA-N	446.208	1.779	50	20	IDGD	
O=C(CCNS(=O)(=O)c1cccnc1)NNC(=O)c1ccc(Br)s1	914831752	SEVMHNIQLPRWOC-UHFFFAOYSA-N	433.309	1.035	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)Cc1cnn(-c2ccccc2)n1	915804976	UFQVZAGEIWIUST-UHFFFAOYSA-N	433.516	1.170	50	20	IDGD	
COc1cc(OC)c(OC)cc1C=NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1	916276635	KTHPLZRNQQHBAV-UHFFFAOYSA-N	435.502	1.792	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2cc(S(C)(=O)=O)ccc2F)c2ccccc2c1=O	918146398	ZYDSCRUNJSYYTC-UHFFFAOYSA-N	446.460	1.424	50	20	IDGD	
Cc1ccccc1C[C@@H](C)NC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	918222103	CTUKTTACNHPRKF-QGZVFWFLSA-N	446.577	1.583	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCc2cccc(OC(C)C)c2)cc1	918225153	GMZRMJPRAUGMPH-UHFFFAOYSA-N	448.545	1.933	50	20	IDGD	
CCS(=O)(=O)N1CCC[C@H](C(=O)NNC(=O)c2ccc(COc3ccccc3)o2)C1	918551174	TVHORTSAJDOCMH-HNNXBMFYSA-N	435.502	1.681	50	20	IDGD	
CS(=O)(=O)N1CCC[C@H](NC(=O)NNC(=O)COc2ccccc2-c2ccccc2)C1	920238736	JULMMFXJFIVYSU-KRWDZBQOSA-N	446.529	1.487	50	20	IDGD	
O=C(NN=Cc1sc(N2CCOCC2)nc1-c1ccccc1)N[C@@H]1CCS(=O)(=O)C1	920379985	DPBNEIIQGKBMIN-OAHLLOKOSA-N	449.558	1.467	50	20	IDGD	
CCCCN1C(=O)CC[C@H](C(=O)NNC(=O)CN2CCCC2=O)[C@@H]1c1ccccc1OC	920435574	JXHILNPIXQHTPD-JTSKRJEESA-N	444.532	1.545	50	20	IDGD	
O=C(Cn1cnc2ccccc21)NNC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccccc1	920438033	JEWKDUDSIAETAX-IBGZPJMESA-N	441.513	1.427	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1nnc(O)c2ccccc12)c1ccc(N2CCOC2=O)cc1	920990556	VWBLYGRPFTUSSK-GFCCVEGCSA-N	436.428	1.997	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)NCc2ccnc(-n3cccn3)c2)CC1	1116093151	YYQRCXKRHACRJJ-UHFFFAOYSA-N	443.508	1.745	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)[C@H]1COc2ccc(F)cc2C1	1253774982	GVOJHFHLOIEGTJ-OAHLLOKOSA-N	435.477	1.541	50	20	IDGD	
C[C@H](O)CNS(=O)(=O)c1ccc(C(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)cc1	1335673766	MPTWFGIAZKTOIA-JHMRYYBSSA-N	435.546	1.323	50	20	IDGD	
CSc1nc(O)c(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1C#N	1516580720	QFRSTHRUSVSIPG-UHFFFAOYSA-N	440.529	1.354	50	20	IDGD	
CCOC(=O)c1cccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)c1F	1780108898	WIWUDECDLVHPBQ-MGPUTAFESA-N	442.871	1.046	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(C)nn2C(F)F)C1	1780164530	JFENZLJPYUOWGW-ZBQZNYHESA-N	448.898	1.968	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCBr)C2)c1cc(CO)on1	1780216216	UDFJMHYYTYGKRE-RHSMWYFYSA-N	430.299	1.079	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(OC)c(OC)c3O)CCO2)C1	1781216258	BYRIHHFDHOIMKM-JLTOFOAXSA-N	426.897	1.870	50	20	IDGD	
O=C(c1ccc2nc[nH]c2c1)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781330898	AQDGADOCXKBNNF-WMLDXEAASA-N	425.258	1.697	50	20	IDGD	
COc1cc(F)ccc1CC(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781337730	VEYATKZILSJLKX-AEFFLSMTSA-N	447.276	1.897	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C/N=C/c1ccco1)C2	1781997602	DMVGVMGAVSVVIR-FDAVPHJGSA-N	440.338	1.996	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cccn4ccnc34)CCO2)C1	1783349223	KCADEYGJYJXISA-KXBFYZLASA-N	435.322	1.951	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cc(Cl)c(O)cc3O)CCO2)C1	1783537984	SESGCUXPDTZXHP-BMLIUANNSA-N	447.713	1.978	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](C)CNC(=O)OC(C)(C)C)CCO2	1783870468	CGXFPGIMTPMYLG-SIFCLUCFSA-N	447.960	1.231	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccn4c(C)cc(C)nc34)CCO2)C1	1783880872	HWNCBYZUYKZZQD-UWJYYQICSA-N	434.924	1.648	50	20	IDGD	
Cc1cc(Cl)ccc1C(=O)N1CCO[C@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1	1783933035	OVPPQFAXMRPXFI-NRFANRHFSA-N	436.940	1.465	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCN(C)C(C)=O)[C@H]2C1	1784936926	HKCHPRVKJYZXJL-VGWMRTNUSA-N	432.359	1.008	50	20	IDGD	
O=C(CN1CCS(=O)(=O)CC1)Nc1ccc(C2(NC(=O)C(Cl)Cl)CCC2)cc1	1786689613	FPKVGDVIGKMTLQ-UHFFFAOYSA-N	448.372	1.655	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3nc4ccccn4n3)[C@H]2C1	1787265833	NKPJSRIIHWFIDY-XUXIUFHCSA-N	436.310	1.106	50	20	IDGD	
Cn1nc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CO[Si](C)(C)C)C[C@@H]32)c2c1CCC2	1788022501	LRGLWVPBGZGNGZ-ZVZYQTTQSA-N	434.613	1.354	50	20	IDGD	
O=C(/C=C/c1cnc[nH]1)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1	1788149446	SLHUTLXMZBHIMR-MDZDMXLPSA-N	430.273	1.551	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)c1ccn(C(F)F)n1	1788939043	VDJJCQLAZGJYJY-GVXVVHGQSA-N	435.269	1.657	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3C[C@H]4CC[C@@H]3O4)C[C@@H]21	1790964525	REELZXZUSFMVLA-YDLMYCGBSA-N	429.355	1.707	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4cccnc4[nH]3)C[C@@H]21	1791055705	FNIXXIMWKFBJBE-DSRCVFDASA-N	435.322	1.940	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)COc3ccccc3OC)C[C@@H]21	1791250463	GILDKSZEIFSHRS-FPXQBCRKSA-N	440.924	1.308	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3=NO[C@@H](c4ccccc4)C3)C[C@@H]21	1791253508	BYKBIFNKEHBYRT-OIGVQNGMSA-N	449.935	1.738	50	20	IDGD	
CC(C)(C)OC(=O)N(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](O)CCl)C2)C1CC1	1792708908	RFFFCYBBWRSXGB-SLBVQIDZSA-N	429.945	1.624	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCc1cccc(C#N)c1	1792833515	ZXNVZZUAENQADD-HATOLVCRSA-N	429.593	1.932	50	20	IDGD	
COc1cscc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)CBr	1792867834	IUZIOFMIIBJWNO-MCYUEQNJSA-N	431.352	1.991	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnnc(Cl)c1)C2	1792870842	WZCLQUSRCOFNBV-SGESHTKJSA-N	431.718	1.364	50	20	IDGD	
Cc1cc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Br)C3)ccn1	1793915221	TZQWADMQMAOTRJ-FSDCSDTHSA-N	428.302	1.603	50	20	IDGD	
CC(C)[C@@H](O)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1794141428	KGMRGQAQEUYTAA-XFIYOXNOSA-N	431.961	1.774	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)COc1cccnc1	1794200156	LGQJNXWQIIXWSU-OSSGZSMMSA-N	438.488	1.233	50	20	IDGD	
CO[C@@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Br)C2)c1ccccc1	1795173396	SQZDRYOQUIDCIG-USACIQFYSA-N	425.323	1.747	50	20	IDGD	
COc1cc(C)c(C)cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1	1796193253	XYPXIKANHGSBRG-ACDBMABISA-N	436.317	1.557	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(F)cn1C	1797203690	IKPZYDSNJKIGLF-XMOXNHLCSA-N	428.468	1.550	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2n(n1)CCCC2	1797439919	GSCMZCQDCYBROJ-VWPFQQQWSA-N	439.354	1.454	50	20	IDGD	
Cc1cc2cccc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)c3ccc(B(O)O)cc3)C4)c2[nH]1	1797507648	WUAPRJUJHWRLEP-ACDBMABISA-N	431.301	1.722	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)NC(=O)c1ccc(F)cc1	1799050059	FXRFNRNOTWCAJQ-IVFVNLKQSA-N	439.915	1.551	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccnn1C)C2	1799220062	KASZSWOWGCPEHZ-QDMKHBRRSA-N	441.444	1.819	50	20	IDGD	
C[C@H](Oc1cccnc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Br	1799351864	DAGSPITZHHLAJW-QIRZIZBZSA-N	430.274	1.129	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2ncccc2[nH]1	1799890125	RSZONPFYVCSTPW-JRATXPSKSA-N	435.322	1.797	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CCCO1)C2	1800334704	XEFOHVWDNFUXRT-DRZPZYELSA-N	431.439	1.640	50	20	IDGD	
CCOC(=O)C(C)(C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](Br)CC	1800645082	SEVHUTREYGIAMZ-XJFOESAGSA-N	433.343	1.339	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CCc3ccccc3O1)C2	1800762922	KJPJHHKHOGSVKB-UIVXMWCNSA-N	437.334	1.753	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cncc(C(F)(F)F)c1)C2	1800978801	KHVSNQMGRREQCK-NEBZKDRISA-N	435.830	1.557	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc3c(c1)OCCO3)C2	1802336557	MIFNLEXJBNGVRG-BJWYYQGGSA-N	430.505	1.083	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1	1803138159	XVHWNTZYPMAXEY-RZFFKMDDSA-N	432.746	1.718	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc3[nH]ccc3n2)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803142955	PARQYOVBMUVSCG-ZOCIIQOWSA-N	427.892	1.877	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2ccn(C)c2)[C@@H]1c1cccnc1	1805294860	HRNSKQXYEZDITL-UWJYYQICSA-N	426.521	1.113	50	20	IDGD	
O=C(CCBr)N1CCCC2(CCN(C(=O)c3cnc(O)nc3O)CC2)C1	1809067333	YXKARTYONVTRML-UHFFFAOYSA-N	427.299	1.518	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@H]1c1cccnc1)c1c[nH]c(=O)cn1	1811457790	ZQZCVQYUOLSPPA-CQDKDKBSSA-N	438.257	1.175	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)[C@@H]1Cc2ccccc2N1	1812430710	CCIZBOPSYDTFCF-FRYIKTPZSA-N	428.920	1.724	50	20	IDGD	
C#CC(=O)NC[C@@H]1CCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)[C@@H]1c1cccnc1	1812525349	SFDLCZREQKZKBM-XYJFISCASA-N	434.924	1.853	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2cccn2C)[C@@H]1c1cccnc1	1813069709	ASIBAHQBLTZQTC-LAUBAEHRSA-N	426.521	1.113	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)[C@H]2CCNC(=O)C2)[C@@H]1c1cccnc1	1813136921	PWWMOXVIWSIUNS-LBEHMCEESA-N	437.338	1.397	50	20	IDGD	
O=C(CSc1nc[nH]n1)NC[C@@H]1CCN(C(=O)C(Cl)Cl)[C@@H]1c1cccnc1	1813351854	SRWSQLZRCVIJSX-WCQYABFASA-N	429.333	1.802	50	20	IDGD	
C[C@]1(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)CC1(F)F	1814073368	BWWHZRKHGSNZTH-YRISNDGFSA-N	443.259	1.126	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1sccc1F	1815427748	OTIFJCCEBBVRJI-MRXNPFEDSA-N	442.281	1.910	50	20	IDGD	
Cc1cnoc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1820068195	MQQZOOHFJUZNGA-HNNXBMFYSA-N	438.448	1.324	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)ncn2)[nH]n1)[C@H](F)Br	1820931702	SJEGMVXWQZFINW-MFKMUULPSA-N	427.234	1.902	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(=O)nc4cccnn34)sc2C1	1821268424	PRKPRXJXRIVLHV-GHMZBOCLSA-N	446.920	1.789	50	20	IDGD	
CCOC(=O)C1(C(=O)Nc2cc([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)CC1	1821805818	SWIKBPXSIVGYBB-OAHLLOKOSA-N	448.524	1.118	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)Cn2cc(C)c(O)nc2=O)n[nH]1	1823368076	HGFUMGUUVMDYLM-GXTWGEPZSA-N	436.900	1.690	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)/C=N/O[C@@H]1CCCCO1)CC2	1826000296	QVHZNVOFLYFESH-NYVFSLHZSA-N	444.941	1.838	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc3cccnn3n1)CC2	1826003186	HPJAMFXZZPLSJJ-JQWIXIFHSA-N	434.909	1.665	50	20	IDGD	
Cc1nn(C)c(C)c1C(=O)N[C@@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1	1826082827	DHOZUNCIPNQNEB-CYBMUJFWSA-N	447.565	1.092	50	20	IDGD	
O=C(CC[C@H]1CCOC1)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827060023	MIPHALPTUCJEEY-AVRDEDQJSA-N	442.365	1.416	50	20	IDGD	
C=CCC(F)(F)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827060353	GVEHHKRIUVFPBE-IBGZPJMESA-N	434.292	1.811	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc3n(n2)CCC3)CC1	1828691094	JJKSOODSXPPQMK-FQEVSTJZSA-N	444.580	1.436	50	20	IDGD	
N#Cc1c[nH]c(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)c1	1829776639	WWOACUFZPRYCML-NRFANRHFSA-N	434.305	1.113	50	20	IDGD	
O=C(C(=O)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1)c1ccc(Cl)cc1	1830689477	IYAKNJSDQFEUDD-SFHVURJKSA-N	449.718	1.783	50	20	IDGD	
Cc1cccc(Cl)c1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1830733009	CTSCJPPYZRWPQK-HNAYVOBHSA-N	431.316	1.318	50	20	IDGD	
Cc1cccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)n1	1830923209	YBPJRDSXKVOOMW-KXBFYZLASA-N	440.338	1.172	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(OC)n3)C2)C1	1831644488	YPWGWUKOBIUPET-QRWLVFNGSA-N	425.913	1.568	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4c(c3)CC(=O)N4)C2)C1	1831652124	WLOLOSQDFMZLIM-VGOFRKELSA-N	449.935	1.659	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCC(N2CCC(NC(=O)[C@@H]3CCC(=O)NC3)CC2)CC1	1833122169	ZNBWPDFZDYGKEA-JLTOFOAXSA-N	447.407	1.321	50	20	IDGD	
C[C@@H](Oc1ccccn1)C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)CCl)CC2)CC1	1833312858	JAWPMCPSDYXNET-CRAIPNDOSA-N	438.956	1.020	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)CNC(=O)N(C)C)CC2)CC1	1833530465	QLPWJDVPWRAIJO-QGZVFWFLSA-N	429.993	1.237	50	20	IDGD	
O=C(NCCC(=O)N1CCC(N2CCC(NC(=O)[C@H](F)Cl)CC2)CC1)c1ccc[nH]1	1835078855	ZGVIRYQHAHSRSI-SFHVURJKSA-N	441.935	1.241	50	20	IDGD	
C[C@H]1CCc2c(C(=O)NC3CCN(C4CCN(C(=O)[C@@H](O)CCl)CC4)CC3)n[nH]c21	1835358963	FRPKEFGMCAOUOW-GUYCJALGSA-N	437.972	1.244	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)N1CCC(N2CCC(NC(=O)CO[Si](C)(C)C)CC2)CC1	1835836920	CAFDBXUAEJBZGU-MRXNPFEDSA-N	438.645	1.100	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cnncc3C(=O)O)CC2)CC1	1835920531	BQBSDIDSNPNCFT-KRWDZBQOSA-N	437.928	1.377	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3ccc[nH]3)CCO2)C1	1836010299	IZAGEKQOMBANMJ-BEFAXECRSA-N	442.354	1.435	50	20	IDGD	
CC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)C[C@](C)(O)CC(=O)O)CC2)CC1	1836397315	DIRFOQOVGBAKFD-JXFKEZNVSA-N	431.961	1.191	50	20	IDGD	
CC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)CCN3CCOC3=O)CC2)CC1	1836397405	ZOUPHGXTAJRSHY-KRWDZBQOSA-N	428.961	1.418	50	20	IDGD	
CC(C)c1nc(CC(=O)N2CCC(OC3CCN(C(=O)[C@H](O)CCl)CC3)CC2)no1	1836715181	MBWJYNAZNMJIIT-MRXNPFEDSA-N	442.944	1.334	50	20	IDGD	
O=C(c1cc2ccccn2n1)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836717443	BNTNFFNMTXLDRO-LJQANCHMSA-N	434.924	1.546	50	20	IDGD	
COc1ccnc(C(=O)N2CCC(OC3CCN(C(=O)[C@H](O)CCl)CC3)CC2)c1	1836718519	QPWMTNRJQKWGDS-GOSISDBHSA-N	425.913	1.302	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc4c3OCCO4)C2)C1	1839145113	VEVBKFXJBBTKEB-KKSFZXQISA-N	438.908	1.545	50	20	IDGD	
Cc1cccc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)n1	1839150789	XQPPGTBALXOPBX-UXHICEINSA-N	444.359	1.625	50	20	IDGD	
C=C(C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1)C(F)(F)F	1839894054	GUDSHVZWNVCMAR-CABCVRRESA-N	433.254	1.798	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccncc3)C2)C1	1839963211	DSTPTYGUVYYOFT-QAPCUYQASA-N	426.311	1.325	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)NC(=O)OC(C)(C)C)CCO2	1840089067	KTLXNOSLLYSMKC-STXHMFSFSA-N	447.960	1.373	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)C2(O)CCN(C(=O)OC(C)(C)C)CC2)C1	1841789861	SZSHGNYXQZVRBR-OAHLLOKOSA-N	443.972	1.969	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)[C@H](C)Oc1ccccn1)C2	1843417335	XQIBLGVEIUIBBR-JZCUADNKSA-N	438.488	1.186	50	20	IDGD	
Cc1ccc(C(=O)NCC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](C)CBr)cc1	1847502114	LICCJBLMXUKCCK-XIRDDKMYSA-N	436.350	1.958	50	20	IDGD	
O=C(/C=C/C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](F)Br)NCc1ccccc1	1847540386	GTZKHHUOJNZKJM-PNJTVDSWSA-N	438.297	1.751	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)/C=C/C(=O)NCc1ccccc1	1847542015	WEGCLNNKBSYGIS-NKMAWLCSSA-N	434.334	1.844	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H]1C[C@@H]1c1ccc(F)c(F)c1	1847606288	LWHGXFRSGWMQCL-SEONNTABSA-N	440.255	1.264	50	20	IDGD	
O=C(COc1ccc(Br)cc1Cl)NNC(=O)[C@@H]1CCS(=O)(=O)C1	16786186	NGPYLIIBNBWDSS-MRVPVSSYSA-N	425.688	1.063	50	20	IDGD	
C[C@@]1(C2CC2)NC(=O)N(CC(=O)NNC(=O)c2ccc(COc3ccccc3)o2)C1=O	21969975	CQBMDLYWJUUWFH-NRFANRHFSA-N	426.429	1.340	50	20	IDGD	
Cc1cccc2c(=O)n(CCC(=O)NNc3ccc(S(=O)(=O)NC4CC4)cc3)cnc12	110432134	FLUIGYRFFDVHFQ-UHFFFAOYSA-N	441.513	1.679	50	20	IDGD	
CCn1c(=O)n(CC(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)c2ccccc21	110434371	SMAHXAOODSECSJ-UHFFFAOYSA-N	429.502	1.407	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)NNC(=O)[C@@H]1CCCN1C(=O)c1ccc2c(c1)OCO2	116430462	GMQJWFYWADFJPE-SFHVURJKSA-N	434.452	1.891	50	20	IDGD	
CN(C[C@H]1OCCc2ccccc21)C(=O)NNC(=O)c1csc(N2CCOCC2)n1	725860634	SBCXFYDNNVYZDK-QGZVFWFLSA-N	431.518	1.580	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@@H](C)NC(=O)c2n[nH]c3ccccc23)ccc1OC(C)C	726381384	BAQYBSFSKLJRHK-CYBMUJFWSA-N	439.472	1.938	50	20	IDGD	
C[C@H](Nc1nc2ccccc2s1)C(=O)NNC(=O)CCc1nc(-c2ncccn2)no1	727723033	CSSPDFLMHGEOGM-NSHDSACASA-N	438.473	1.717	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)c2cc(S(=O)(=O)N3CCCCC3)cn2C)c(C)c1	728205643	VQAOKORZUHWQOB-UHFFFAOYSA-N	447.561	1.690	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)C1=NN(c2ccccc2)[C@H](c2ccccc2)C1	729276044	VZCZNHUFKRNJDA-KDOFPFPSSA-N	429.502	1.079	50	20	IDGD	
C[C@@H](NC(=O)c1ccc(Br)s1)C(=O)NNC(=O)CNc1ccccc1	729513654	FPPIITGUQOHWCE-SNVBAGLBSA-N	425.308	1.888	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)CSc2nnnn2CC(F)(F)F)c1C	729966670	VXYLRGVNMWRPKE-NSHDSACASA-N	432.428	1.559	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)N1CCN(CC(=O)N[C@@H]2CCC[C@H](C)C2)CC1	731499958	SVUBDBGCQKYMEM-DLBZAZTESA-N	431.537	1.362	50	20	IDGD	
O=Cc1cccc(OCc2ccccc2C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)c1	731617072	KKZUWPGCFAHFEL-INIZCTEOSA-N	431.470	1.209	50	20	IDGD	
O=C(Cc1ccc(S(=O)(=O)N2CCCC2)s1)NNc1nc(-c2cccnc2)no1	732111282	HKIRHLNNGSISGE-UHFFFAOYSA-N	434.503	1.663	50	20	IDGD	
C=CCn1c(S)nc2cc(C(=O)NNC(=O)CCN3C[C@H](C)O[C@H](C)C3)ccc2c1=O	732261126	KLXXQCIBHYXKPP-OKILXGFUSA-N	445.545	1.132	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)N[C@H]2CCN(c3ccccc3Br)C2)n1	732476803	XBHUOLZHPFXPNQ-AWEZNQCLSA-N	435.326	1.872	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)NNC(=O)NCc2ccc(Cl)cc2)ccc1OC	733003785	LCYPGCACAIFAGJ-UHFFFAOYSA-N	426.882	1.401	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1N1CCOCC1)c1cnn(-c2ccccc2)c1	733106929	QLYSHTIZOJKNQD-UHFFFAOYSA-N	436.428	1.692	50	20	IDGD	
COC[C@H](C)S(=O)(=O)NC(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccccc1	733715253	RFKHLZDWOMUXPC-VUVCFOEZSA-N	427.486	1.852	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)CC[C@H]2NC(=O)N(c3ccc(C#N)cc3)C2=O)c1	733774792	SZFBVJBDBWRZIH-GOSISDBHSA-N	435.440	1.298	50	20	IDGD	
CC[C@H](Nc1c([N+](=O)[O-])c(C)nn1C)C(=O)NNC(=O)c1cc(Br)c[nH]1	735841625	SRXFJTATMRQKCQ-VIFPVBQESA-N	428.247	1.379	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cnc(-c3ccccc3)[nH]2)cc1	736066301	AJRVWNHAXJOOBM-UHFFFAOYSA-N	427.486	1.467	50	20	IDGD	
Cc1nn(CCCl)c(C)c1C(=O)N1CCN(c2cc(N3CCOCC3)ncn2)CC1	737753893	XERIVXVXWYKINU-UHFFFAOYSA-N	433.944	1.328	50	20	IDGD	
O=C(NNc1ncnc2[nH]cnc12)c1cc(S(=O)(=O)NC2CC2)c(Cl)cc1Cl	740746913	YDOSWTCDPQURRV-UHFFFAOYSA-N	442.288	1.857	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2ccccc2CN2CCOCC2)c2ccccc2c1=O	740748999	GRSBWHPILWQOAN-UHFFFAOYSA-N	435.484	1.323	50	20	IDGD	
O=C(CSc1nnc(O)nc1O)NN=C1CCOc2c(F)cc(Br)cc21	741457773	JLASFFRMFODMGG-UHFFFAOYSA-N	444.242	1.580	50	20	IDGD	
COCCCn1c(=O)c2ccccc2n2c(SCC(=O)NNC(=O)C(C)(C)C)nnc12	742444656	CIGSOEUOBJIEEY-UHFFFAOYSA-N	446.533	1.366	50	20	IDGD	
O=C(CSc1nnc(CN2CCCCC2)n1Cc1ccccc1)NNC(=O)C1CC1	742445767	WVGMJOLCFINLAQ-UHFFFAOYSA-N	428.562	1.962	50	20	IDGD	
COCCN(CCCc1ccccc1)C(=O)NNC(=O)c1csc(N2CCOCC2)n1	744277919	YTAIFXNUDNRXDV-UHFFFAOYSA-N	447.561	1.915	50	20	IDGD	
COc1ccc2c(c1)OC[C@@H](C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1)C2	744621768	GBEQLQJLUXWJRM-INIZCTEOSA-N	447.513	1.411	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)NCCCN1C(=O)COc2ccccc21	745857615	RBDKJMAVOLQGFI-UHFFFAOYSA-N	443.416	1.120	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CC[C@@H](N(C)Cc3ccccc3)C2)cc1OC	746485077	VPLKPAAPQNUJEQ-LJQANCHMSA-N	426.517	1.671	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc2nc(O)cc(C(=O)NNC(=O)c3ccc[nH]3)c2c1	747663465	QWIVNFRAKDRNOX-UHFFFAOYSA-N	431.474	1.374	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)N[C@@H](C)c1cc(F)ccc1N1CCN(C)CC1	748628135	PHBLYSLSMTXCAI-LSDHHAIUSA-N	425.505	1.020	50	20	IDGD	
Cc1nc(-c2cccnc2)nc(O)c1CCC(=O)NNC(=O)COc1ccc(F)cc1	751295399	XXSKLYFPDQXWJI-UHFFFAOYSA-N	425.420	1.851	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=S)N[C@@H](C)C2CC2)c1	751618642	IREOEIMZOMUXHG-JTQLQIEISA-N	434.971	1.172	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H]2C[C@H](OC)C2(C)C)c1	753549692	HKSKJVPFQXWIDN-HOTGVXAUSA-N	426.539	1.475	50	20	IDGD	
NC(=O)c1ccc(CNC(=O)NNC(=O)c2ccc(Br)cc2Cl)cn1	753954898	PPEYHCRCDROGAN-UHFFFAOYSA-N	426.658	1.741	50	20	IDGD	
Cn1cc(CCC(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)c2ccccc21	755050000	UOXDQJZLZXETDK-UHFFFAOYSA-N	434.905	1.873	50	20	IDGD	
NC(=O)c1ccc(/C=C\C(=O)N2CCC[C@H]2C(=O)NNc2ccc(C(F)(F)F)nn2)cc1	755182618	MVGQFZVRXOEADM-MFNCVGGLSA-N	448.405	1.742	50	20	IDGD	
O=C(NNC(=O)c1c[nH]c2ccccc12)Nc1cccc(S(=O)(=O)N2CCOCC2)c1	755353486	IMTRMNBTHVKIPH-UHFFFAOYSA-N	443.485	1.655	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NN=Cc2cc(O)cc(Br)c2O)c1	755507814	GKTMWOKKETUULU-UHFFFAOYSA-N	442.291	1.875	50	20	IDGD	
CN(C)c1ccc(S(=O)(=O)N(C)C)cc1NC(=O)NNC(=O)CCc1ccccc1O	755529373	BCKDLAADLXKZFE-UHFFFAOYSA-N	449.533	1.494	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)Nc2ccccc2C(=O)N2CCN(C)CC2)cc1	755621689	BXVNYTPIBGMIES-UHFFFAOYSA-N	425.489	1.614	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)c2cc(Br)ccc2O)ccc1-n1cnnn1	755679924	OQFOTEKKTWXXAT-UHFFFAOYSA-N	432.238	1.905	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)Nc2cc(-n3cnnn3)ccc2F)n[nH]1	756336387	XFFSPFWIWFNLSL-UHFFFAOYSA-N	437.395	1.667	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1cccc(CSC2CCOCC2)c1	756605836	UVUHMGWWGGJNCI-LBPRGKRZSA-N	430.552	1.189	50	20	IDGD	
O=C(NNc1ncnc2[nH]cnc12)[C@@H]1CCC(=O)N1Cc1ccc(Br)cc1	757660392	AURCNQPWOQXNRD-LBPRGKRZSA-N	430.266	1.750	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccc(C3CC3)nn2)c1	757699468	GBVGGZYJWIUELT-UHFFFAOYSA-N	432.506	1.851	50	20	IDGD	
CNS(=O)(=O)c1cccc(NC(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)c1C	757722257	WRNGGRFCDDZYAY-UHFFFAOYSA-N	443.526	1.361	50	20	IDGD	
O=C(NCc1ccc(OCCN2CCCC2)cc1)NNC(=O)C(=O)Nc1ccccn1	758768186	SOONTOREKHAMFT-UHFFFAOYSA-N	426.477	1.025	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)c2ccc(I)c(O)c2)C[C@@H](C)O1	761040766	KJPYKHOHOWLWSW-GHMZBOCLSA-N	447.273	1.257	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	761636468	HOWWFUMWEZNGRR-UHFFFAOYSA-N	429.907	1.549	50	20	IDGD	
CN1CCN(c2ccccc2NC(=O)C(=O)NNC(=O)c2ccc3ccccc3n2)CC1	763454282	GFCWTVGAAKMMAP-UHFFFAOYSA-N	432.484	1.386	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3n2)cc1	763465879	DQSJMFBNXXTZKO-UHFFFAOYSA-N	441.469	1.396	50	20	IDGD	
CC(=O)NNC(=O)C(=O)Nc1cccc(C(=O)OC2CCN(C(=O)OC(C)(C)C)CC2)c1	763516510	KHMKWOABMRCEAP-UHFFFAOYSA-N	448.476	1.349	50	20	IDGD	
C[C@@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3ccccc3O)cc2F)C[C@@H](C)O1	763530405	UUMRHAUUHDWPMQ-CHWSQXEVSA-N	430.436	1.545	50	20	IDGD	
Cc1conc1NC(=O)C(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	763601661	STOMTJBPUUKMLU-UHFFFAOYSA-N	449.470	1.245	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2ccc(-n3cccn3)c(F)c2)c1	763645019	PQCBBIWTZTUDMU-UHFFFAOYSA-N	425.420	1.793	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(C(=O)N3CCCCC3)c2)cc1	763673213	AOGHXMZVIZUTTM-UHFFFAOYSA-N	449.467	1.349	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2ccccc2SCCC(N)=O)c1	763771912	HJPOEBMMLYFRRJ-UHFFFAOYSA-N	446.485	1.071	50	20	IDGD	
COc1ccc2cc(NC(=O)C(=O)NNC(=O)COc3ccccc3[N+](=O)[O-])ccc2n1	763804130	KVDBSMBPVXABHY-UHFFFAOYSA-N	439.384	1.317	50	20	IDGD	
CCN1C(=O)CCc2cc(NC(=O)C(=O)NNC(=O)COc3ccccc3C#N)ccc21	763815014	ZLKMIUQSHINTHW-UHFFFAOYSA-N	435.440	1.022	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)c(OC)c1OC	763864707	GHKGUTDXTWQAOL-NSHDSACASA-N	435.408	1.405	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1cccc(CN2CCOC2=O)c1	763865438	KNTVYUYSFJUWSO-ZDUSSCGKSA-N	444.419	1.331	50	20	IDGD	
CCn1cnnc1-c1ccccc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccccc1F	763866312	VLWVBCMLXBDXDK-CYBMUJFWSA-N	440.435	1.658	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(Br)nc2)cc1	763872077	JVENDSJESNDVFD-LLVKDONJSA-N	449.261	1.600	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccc(C(=O)N3CCCCCC3)cc2)n1	763893760	ZAKRMSFIQPYXCL-UHFFFAOYSA-N	440.504	1.302	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)C(=O)Nc1cccc(N2CCCCC2)c1	763921599	MGBRNFBRUHJNHO-UHFFFAOYSA-N	434.460	1.052	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccc(F)cc2)cc1N1CCOC1=O	763932454	PFCGFTMCSJTBJL-UHFFFAOYSA-N	430.392	1.120	50	20	IDGD	
CCN(CC)C(=O)COc1cccc(NC(=O)C(=O)NNC(=O)c2ccccc2C)c1	763957830	LNYPIVRNQQIZGH-UHFFFAOYSA-N	426.473	1.642	50	20	IDGD	
O=C(NNC(=O)c1ccc[nH]1)C(=O)Nc1cccc(CS(=O)(=O)C2CCCCC2)c1	763978693	AELKMFKOJNDPEO-UHFFFAOYSA-N	432.502	1.662	50	20	IDGD	
CN(C(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)c2cccn2C)cc1)c1ccccc1	763995494	IKTDDRZHMAYHNF-UHFFFAOYSA-N	433.468	1.630	50	20	IDGD	
CN(C)CC1CCN(c2ccc(NC(=O)C(=O)NNC(=O)c3ccc(C#N)cc3)cc2)CC1	764177107	JIPIRCDUFIETDW-UHFFFAOYSA-N	448.527	1.736	50	20	IDGD	
CC(C)N1CCN(c2cccc(NC(=O)C(=O)NNC(=O)c3cccc(C#N)c3)c2)CC1	764238494	SWNQINWHLHYOTB-UHFFFAOYSA-N	434.500	1.488	50	20	IDGD	
O=C(NNC(=O)c1cccc(OC(F)F)c1)C(=O)Nc1ccccc1N1CCOC1=O	764260199	SYVZWUNHRDJMTF-UHFFFAOYSA-N	434.355	1.644	50	20	IDGD	
O=C(Cc1ccccn1)NNC(=O)C(=O)Nc1ccnn1Cc1ccc(Cl)cc1Cl	764263585	HBXXEXZUGMRECY-UHFFFAOYSA-N	447.282	1.962	50	20	IDGD	
CS(=O)(=O)NC1(CNC(=O)NNC(=O)CSc2ccccc2O)CCCCC1	764327077	SURLAQJSMFCAKQ-UHFFFAOYSA-N	430.552	1.067	50	20	IDGD	
COc1ccc(C(C)(C)C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1	764533775	LFUARDWNHWZLLB-UHFFFAOYSA-N	433.530	1.749	50	20	IDGD	
COC(=O)[C@H](NNC(=O)CNC(=O)c1cccs1)c1cccc(Br)c1	766732089	COETYQZTKASUBW-CQSZACIVSA-N	426.292	1.776	50	20	IDGD	
Cc1ccn2ncc(C(=O)NNC(=O)c3cccc(S(=O)(=O)N4CCCC4)c3)c2c1	766815609	DABKAGTXCKHGCS-UHFFFAOYSA-N	427.486	1.502	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)[C@H](C)S(=O)(=O)C3CCOCC3)n[nH]2)cc1	768268416	PXNDKCNEVNIPRU-ZDUSSCGKSA-N	434.518	1.382	50	20	IDGD	
CC[C@@H](C)[C@H](NC(=O)N1CCCC1)C(=O)NNc1c(OC)cccc1S(C)(=O)=O	768611907	JTXSXBADKWEBQR-CJNGLKHVSA-N	426.539	1.762	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)NC3CCN([C@@H]4CCC[C@H]4O)CC3)n[nH]2)cc1	769154383	KGVBWJRENVSMFB-WOJBJXKFSA-N	426.521	1.707	50	20	IDGD	
Cc1cc2c(cc1C)[C@@H](C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1)CO2	771391890	LWXHZWNXUHEJSJ-KRWDZBQOSA-N	431.514	1.944	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)[C@H](Cc2cccnc2)NC(=O)c2ccccc2)c1	773071486	BQILQEXVVZLRDY-FQEVSTJZSA-N	446.467	1.237	50	20	IDGD	
CC(C)(C)c1sc(C(=O)O)cc1S(=O)(=O)NNC(=O)[C@@H]1COc2ccccc2O1	773249784	OXPITJOLBSILQP-LBPRGKRZSA-N	440.499	1.893	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNS(=O)(=O)c1cccc(-c2nnnn2C)c1	773250490	FOYOLEQDYRVOBX-LLVKDONJSA-N	436.881	1.308	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1S(C)(=O)=O	773420986	YXOKIGJGHMGUOU-OAHLLOKOSA-N	439.534	1.807	50	20	IDGD	
CC(C)c1nccnc1NNC(=O)C(=O)Nc1cccc(C(=O)N2CCSCC2)c1	773998613	RVDURJUXRPDGDV-UHFFFAOYSA-N	428.518	1.871	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)c2ccc(N)c(Br)n2)cc1C	775081460	AWUPVCXQUGCQCY-UHFFFAOYSA-N	441.307	1.977	50	20	IDGD	
C[C@@H]1CN(S(=O)(=O)c2ccc(NC(=O)NNC(=O)c3ccccc3)cc2)C[C@@H](C)O1	775280900	ZALLAXQKDMSFIT-HUUCEWRRSA-N	432.502	1.951	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN[C@H]2CCN(Cc3ccccc3)C[C@H]2C)cc1OC	775689892	NBWGZQAJDRRAOB-XLIONFOSSA-N	440.544	1.965	50	20	IDGD	
Cc1[nH]c(-c2ccncc2)nc(=O)c1CCC(=O)NNc1cccc(S(C)(=O)=O)c1	776534027	ADCMLQZAEZIQMA-UHFFFAOYSA-N	427.486	1.620	50	20	IDGD	
COc1ccc(N2CCN(C(=O)/C=C\C(=O)NNC(=O)Cc3ccccc3F)CC2)cc1	778266251	NMELETOOMRRPER-KHPPLWFESA-N	440.475	1.429	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)nc(C(F)(F)F)n1	778291978	MASBQXXMFGJAKK-UHFFFAOYSA-N	430.412	1.480	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)c2ccc(O[C@@H](C)C(=O)NN(C)C(N)=O)cc2)cc1C	778418075	IIYOCHCFQAEUCD-HNNXBMFYSA-N	434.518	1.938	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)c1ccccc1CS(=O)(=O)c1ccccc1	778442921	IFMYJEXKRHDHAI-UHFFFAOYSA-N	447.513	1.946	50	20	IDGD	
Cn1ccnc(NNC(=O)c2cc(I)ccc2Br)c1=O	780605776	KGCCBLUSINNGEE-UHFFFAOYSA-N	449.046	1.904	50	20	IDGD	
Cc1c(NC(=O)[C@@H](C)SCC(=O)NN=c2cc[nH]cc2)c(=O)n(-c2ccccc2)n1C	780754779	AWKGYPCPZPSCIO-OAHLLOKOSA-N	440.529	1.505	50	20	IDGD	
CC[C@@H](C)NS(=O)(=O)c1ccc(C(=O)NNC(=O)CCNC(=O)OC(C)(C)C)cc1	780971269	MNUSKHOWGVKFOC-CYBMUJFWSA-N	442.538	1.439	50	20	IDGD	
COc1ccc(C[C@H](C)C(=O)N2CCN(S(=O)(=O)CBr)CC2)cc1OC	781357122	YKFVXPXISVGVKI-ZDUSSCGKSA-N	449.367	1.709	50	20	IDGD	
CC(=O)N1CCN(Cc2ccccc2NC(=O)NNC(=O)COc2ccc(F)cc2)CC1	782077904	HHQFVWLNCICOKA-UHFFFAOYSA-N	443.479	1.722	50	20	IDGD	
O=C(NNc1cncc(Cl)n1)C(=O)Nc1ccccc1S(=O)(=O)N1CCCCC1	783265522	ITIHMJAOYLOXRH-UHFFFAOYSA-N	438.897	1.386	50	20	IDGD	
O=C(NNC(=O)c1ccccc1C(=O)c1ccc(F)c(F)c1)N[C@H]1CCS(=O)(=O)C1	783574436	KQKNKIJBLOKYDG-LBPRGKRZSA-N	437.424	1.327	50	20	IDGD	
O=C(NNC(=O)C(=O)N1CCCC1)C(=O)Nc1ccc2cc(Br)ccc2c1	784002533	GKMVXPHKUXCAHZ-UHFFFAOYSA-N	433.262	1.311	50	20	IDGD	
Cc1coc(-c2cccc(NC(=O)C(=O)NNC(=O)CNC(=O)c3cccs3)c2)n1	784005385	YBMPOKFFDIBZMC-UHFFFAOYSA-N	427.442	1.227	50	20	IDGD	
CC(C)Oc1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)cn1	784835527	BNEZNVWDTWNILC-UHFFFAOYSA-N	428.417	1.947	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)C(=O)Nc1c(F)c(F)c(F)c(F)c1F	785060325	HQYXFHMFXMHLSO-UHFFFAOYSA-N	427.289	1.358	50	20	IDGD	
COCCOc1ccc(F)cc1S(=O)(=O)NNC(=O)c1cnn(-c2ccccc2)c1	786723032	DPGZJXYYEYAHDD-UHFFFAOYSA-N	434.449	1.660	50	20	IDGD	
Cc1nc(Cn2cc(C(=O)OCC(=O)C(C#N)=C3N(C)c4ccccc4N3C)nn2)no1	787161031	DTTCAZHVHBGEEB-UHFFFAOYSA-N	434.416	1.065	50	20	IDGD	
CN1CCN(C(=O)NNC(=O)[C@H]2CCCN2C(=O)c2cc(Cl)ccc2Cl)CC1	788169080	IEXSJBIWGYQGBC-OAHLLOKOSA-N	428.320	1.586	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)[C@@H]1CCC(=O)c2cccn21	788763820	ZHAMPOBFJGXZBK-IBGZPJMESA-N	443.935	1.624	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1)c1ncnn1C	788884442	JAKMIOYOBXXJOJ-LLVKDONJSA-N	449.518	1.383	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)C(=O)Nc1ccc(C(N)=O)c(OC(C)C)c1)c1ccccc1	789734783	OSRQAEHMDQGFPZ-MRXNPFEDSA-N	426.473	1.852	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccccc2N2C[C@H]3CC[C@H]2C3)cc1	790951198	DXPWDFJFZAGEHK-HOTGVXAUSA-N	438.484	1.849	50	20	IDGD	
O=C(Cc1csc2ccc(Br)cc12)NNC(=O)N[C@@H]1CCS(=O)(=O)C1	792083189	IMAQLUJSHBONKZ-LLVKDONJSA-N	446.348	1.724	50	20	IDGD	
COC(=O)Cc1cccc(NC(=O)NNC(=O)COc2ccc(Br)cc2)n1	792405579	BHUGBAUZHCLXHT-UHFFFAOYSA-N	437.250	1.791	50	20	IDGD	
CC(CCc1ccc(I)cc1)=NNC(=O)[C@H](C)NS(C)(=O)=O	794509075	YJKYHDKAFWPKFD-NSHDSACASA-N	437.303	1.654	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)NCC(F)(F)F)N1C(=O)c2ccc(Br)cc2C1=O	798315687	ZOPXLUPAFNHAQH-LURJTMIESA-N	437.172	1.326	50	20	IDGD	
Cn1nncc1C(=O)NNC(=O)CCN1CCN(C(c2ccccc2)c2ccccc2)CC1	798350670	MFIMSUORLRHJGW-UHFFFAOYSA-N	447.543	1.373	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2ccc(F)cc2OCCC(F)(F)F)CCS(=O)(=O)C1	800627866	QBLVMEIRDHGSDK-HNNXBMFYSA-N	441.403	1.293	50	20	IDGD	
O=C(NNC(=O)c1nc2cccnc2s1)c1cccc(S(=O)(=O)N2CCCC2)c1	801102584	YKBYETMNCHWIGV-UHFFFAOYSA-N	431.499	1.551	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)N(CCO)CCN2CCOCC2)c(C)n1C[C@H]1CCCO1	801174652	YMUDMEIGJWYXHL-PHCAOYFPSA-N	430.549	1.344	50	20	IDGD	
COc1ccccc1[C@]1(C)NC(=O)N(CC(=O)NNC(=O)Nc2cc(F)cc(F)c2)C1=O	802003260	KWSDUSMWKHQXKV-FQEVSTJZSA-N	447.398	1.593	50	20	IDGD	
CCS(=O)(=O)N1CCC(C(=O)NNC(=O)N=c2cc[nH]cc2)(c2ccccc2)CC1	802029231	JLUKBQJKTLOOCV-UHFFFAOYSA-N	431.518	1.040	50	20	IDGD	
CCOCCOc1c(Cl)cccc1NC(=O)C(=O)NNc1ccc(-n2ccnc2)nn1	807429411	RIRAIBBIDJSZDC-UHFFFAOYSA-N	445.867	1.813	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)N[C@@H]2CCCN(C(=O)N3CCCC3)C2)cc1	807461234	UTWRAXJTZJBUJT-IAGOWNOFSA-N	447.536	1.863	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2cccc(S(C)(=O)=O)c2)nn1-c1ccc(F)cc1F	808933359	LHRRDQLTPQHJEM-UHFFFAOYSA-N	449.439	1.944	50	20	IDGD	
O=C(NNc1c(F)cc(C(=O)NC2CC2)cc1F)C(=O)Nc1ccc2c(c1)C(=O)OC2	808938825	FFXZUXSSDWOZIG-UHFFFAOYSA-N	430.367	1.609	50	20	IDGD	
CC(C)c1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)nc1	809957740	WGFYBXVMAFNFRS-UHFFFAOYSA-N	432.502	1.301	50	20	IDGD	
CCOc1cc(Br)c(F)cc1NC(=O)C(=O)NNC(=O)c1ccncc1	810385126	MKTLLMFGGMDLGO-UHFFFAOYSA-N	425.214	1.782	50	20	IDGD	
O=C(CNS(=O)(=O)c1cccc(F)c1)NNc1nc(Br)cn2ccnc12	810484469	ZAADWSAMNFEIRV-UHFFFAOYSA-N	443.258	1.053	50	20	IDGD	
Cc1nnc(-c2cccc(NC(=O)C(=O)NNc3ccc(S(=O)(=O)N(C)C)cc3)c2)o1	813033861	OMANUZYAPXKICZ-UHFFFAOYSA-N	444.473	1.377	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)c(C2CC2)n1	813487157	FRVTZTQYYRLHSM-UHFFFAOYSA-N	430.940	1.530	50	20	IDGD	
O=C(COC(=O)c1ccc(OC(F)F)c(F)c1)NNC(=O)c1ccc([N+](=O)[O-])cc1	815485956	QSEQTXBNDFPJDV-UHFFFAOYSA-N	427.291	1.953	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2cc(Br)cn2C)cc(OC)c1C	815567945	QRVDETOJIMWCMK-UHFFFAOYSA-N	439.266	1.513	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNc2ncnc3ccsc23)nnn1Cc1ccccc1F	815586580	MNOAGSUMRNUIOB-UHFFFAOYSA-N	426.437	1.860	50	20	IDGD	
O=C(NNc1ncncc1F)C(=O)Nc1cccc(C(=O)Nc2ccc(Cl)cn2)c1	815764481	JOUUDNYDUSNFSC-UHFFFAOYSA-N	429.799	1.998	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCc2nn[nH]c21)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	816831395	QORNBYYWYZZQGI-QGZVFWFLSA-N	443.471	1.388	50	20	IDGD	
COc1ccccc1C(=O)N[C@@H](CCS(C)(=O)=O)C(=O)NNc1cccc(Cl)n1	817007451	CDCMQPFIWYUKIX-ZDUSSCGKSA-N	440.909	1.420	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21	825644036	PYETYYGKRNTHFY-UHFFFAOYSA-N	443.416	1.551	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)N2CCN(CC(=O)NC(C)C)CC2)c(C)n1C[C@H]1CCCO1	843328388	LUZRRHSHXIEGSY-MUIAGPEESA-N	441.576	1.860	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2CCN(C(C)C)C[C@@H]2c2cnn(C)c2)cc1	849487542	OWNZXXWJGVZUIH-RTBURBONSA-N	426.521	1.329	50	20	IDGD	
CC(=O)c1cccc(S(=O)(=O)NCCC(=O)NNC(=O)COc2cccc(C)c2)c1	863972262	SOPIBPDFSFUEBN-UHFFFAOYSA-N	433.486	1.092	50	20	IDGD	
COc1ccccc1NC(=S)NNC(=O)CNS(=O)(=O)c1cccc(C(C)=O)c1	913441066	SBZIOOKWFNYKGW-UHFFFAOYSA-N	436.515	1.194	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)c1	914748151	JXKVNYTVZIIIGH-UHFFFAOYSA-N	435.502	1.713	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)c1[nH]c(C)c(C(=O)OCCOC)c1C	916132937	OCXLBFOKSPZICX-UHFFFAOYSA-N	441.488	1.808	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)C1CCN(C(=O)N(C)C)CC1	916144051	VCADBRJNKCYBTB-LBPRGKRZSA-N	441.326	1.757	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCCCN(C)Cc2ccccc2)c2ccccc2c1=O	916196768	HJODSUPECDWLBG-UHFFFAOYSA-N	436.516	1.883	50	20	IDGD	
CC(=NNC(=O)Cc1c[nH]c2ccccc12)c1ccc(S(=O)(=O)N2CCNCC2)cc1	916337496	ABUNMTLIRJKCHL-UHFFFAOYSA-N	439.541	1.845	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NCC2(c3ccccc3)CCOCC2)c2ccccc2c1=O	916623233	LIZQGRZKQTXMRH-UHFFFAOYSA-N	435.484	1.626	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCCN(C(=O)c3ccsc3)CC2)cc1OC	917409081	GDUVOMFAPDJNHP-UHFFFAOYSA-N	446.529	1.374	50	20	IDGD	
CN(Cc1ccn(-c2ccccc2)n1)C(=O)NNC(=O)c1csc(N2CCOCC2)n1	918001956	KBCDAYQKKKFMIB-UHFFFAOYSA-N	441.517	1.652	50	20	IDGD	
N#CCCn1cc(/C=C(\C#N)C(=O)NCC2(C(N)=O)CCOCC2)c(-c2ccccc2)n1	918098864	IZRHURLEPBORLC-QGOAFFKASA-N	432.484	1.769	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)Cc1c(C)nc(-c2cccnc2)nc1O	918201291	ANQQZKHZNOJVMR-UHFFFAOYSA-N	445.483	1.855	50	20	IDGD	
N#Cc1ccc(CS(=O)(=O)CC(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)cc1	919318211	GATZRKWHLNWRSU-UHFFFAOYSA-N	449.872	1.131	50	20	IDGD	
CN(C)CCNC(=O)c1cccc(CNC(=O)NNC(=O)c2cncn2-c2ccccc2)c1	1115964750	GINUGSMXNZMTEQ-UHFFFAOYSA-N	449.515	1.308	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)NCc2nncn2-c2ccccc2)CC1	1251919007	KKYZTJCEVOTZGS-UHFFFAOYSA-N	443.508	1.745	50	20	IDGD	
Cc1ccc(C)c(S(=O)(=O)NCC(=O)NNC(=O)c2cncn2-c2ccccc2)c1	1337008838	DIDNFOIYZJFBES-UHFFFAOYSA-N	427.486	1.229	50	20	IDGD	
CN(C)C(=O)c1cc(NC(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)ccn1	1337786289	VTWUJCRYWZWLJY-UHFFFAOYSA-N	434.497	1.583	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnnc4ccccc34)C2)C1	1777730458	YSHUXRWGIBKBRH-BFUOFWGJSA-N	433.306	1.857	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4nccnc4c3)C2)C1	1777978744	ANTLQRMFDIBHFY-OAQYLSRUSA-N	428.565	1.925	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnn3ccccc23)C1	1778491637	GFVDRHVNEYKYHA-YRISNDGFSA-N	434.924	1.716	50	20	IDGD	
Cc1cnc2c(C(=O)N3CC[C@@]4(C3)CN(C(=O)[C@@H](C)Br)CCO4)cnn2c1	1778529038	XGEFXUJTOKAKHS-FZKQIMNGSA-N	436.310	1.265	50	20	IDGD	
CCOc1ncc(Cl)cc1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1779680000	GTZWEJNAAVAXEY-RDTXWAMCSA-N	432.304	1.177	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ncccc3C(F)(F)F)C2)C1	1779717665	NSDMEWDGKJJIND-GUYCJALGSA-N	435.830	1.798	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Br)C1)n1cncn1	1780776873	HMOISIVHRIDZFJ-BRXULGCHSA-N	432.294	1.044	50	20	IDGD	
Cc1ccncc1CCC(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781327257	ZMTXQKZLHKTCOJ-AEFFLSMTSA-N	428.302	1.843	50	20	IDGD	
O=C(c1cnc2c(F)c(F)ccc2c1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1782467675	LQWQDIBUKKXWMQ-MGPUTAFESA-N	439.846	1.556	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4nn[nH]c4c3)C2)C1	1782582716	HFAMIARRMOBWCV-ZWKOTPCHSA-N	426.304	1.638	50	20	IDGD	
C[C@H](Cc1ccncc1)C(=O)N1CC[C@@]2(CN(C(=O)[C@H](F)Br)CCO2)C1	1782661098	OUZUGIHINGLJAU-XUWXXGDYSA-N	428.302	1.781	50	20	IDGD	
COc1ncc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](C)Br)C3)C2)cc1C	1783531964	GJSFRGTZOTUTCU-SCLBCKFNSA-N	426.311	1.626	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cnc4ccc(F)cn34)CCO2)C1	1783538129	WICAOVNFNRYZBY-XIKOKIGWSA-N	439.285	1.700	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)/C=C/c3ccccc3[N+](=O)[O-])CCO2)C1	1783884447	SDTWFGSWFXQJHR-AIRUHKMPSA-N	437.880	1.692	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4cncn4c3)C[C@@H]21	1783967292	RLUOAGJUVOOLPF-KCMWZYNZSA-N	449.349	1.959	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@]3(F)CCCCC3(F)F)C[C@@H]21)[C@@H](O)CCl	1784093476	WCQHPOFUAVFQKQ-GGOFEBJYSA-N	426.863	1.483	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](NC(C)=O)C(C)(C)C)[C@H]2C1	1784313142	SANFHXPFVNVVOW-KFGODFMUSA-N	429.989	1.924	50	20	IDGD	
CC[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)Br)C[C@@H]21)N(CC)CC	1784632210	JFYICLZTAJZNSM-XAJHFOFHSA-N	432.403	1.870	50	20	IDGD	
CO[C@@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)[C@H]2C1	1785078946	FURVZACYOVWERY-QXKUPLGCSA-N	447.960	1.133	50	20	IDGD	
COc1nn(C)cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]21	1785863988	FUYNZBOIXYKSMM-XBPIAWKYSA-N	433.336	1.258	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cn(C)nc3C(F)F)[C@H]2C1	1787736154	QUFTUDIDOITCMP-VTPLQMEGSA-N	434.871	1.205	50	20	IDGD	
O=C(Cc1ccc(F)cn1)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1	1788143902	ULRBYERDVWXSFE-UHFFFAOYSA-N	447.275	1.891	50	20	IDGD	
CN(C)c1cncc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]3C2)c1	1788765606	MGCPZKAHKNIQIV-SNRMKQJTSA-N	434.613	1.592	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccn(C(F)F)c3=O)[C@H]2C1	1788797386	LTFXQCFIKHHZQM-MXAVVETBSA-N	431.867	1.854	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc(O)c4ccn(C)c34)C[C@@H]21	1789861576	FSSWOMYZJAFVNP-SJWGOKEGSA-N	434.924	1.890	50	20	IDGD	
COc1cccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]3C2)n1	1789868322	CAHPNAXBDXYHIQ-NGOJXBLDSA-N	430.332	1.920	50	20	IDGD	
C[C@@H](Cn1ccnc1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]2C1	1789926900	KMNBCSBRFIVLSY-YTFOTSKYSA-N	431.306	1.189	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)NC(=O)OC(C)(C)C)[C@H]2C1	1790173593	DSWATPQEWDNCCW-BWJWTDLKSA-N	447.960	1.217	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc([N+](=O)[O-])[nH]3)C[C@@H]21	1791058814	GXMIJUUFQAEPKL-BLFANLJRSA-N	429.271	1.300	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc4c3NC(=O)C4)C[C@@H]21	1791256851	JRJOBGFMRNTIKQ-LLLHUVSDSA-N	435.908	1.028	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3ON=C(c4ccccc4)O3)C[C@@H]21)C(Cl)Cl	1791298462	ZFRFJHYUXMLTJB-MNUAXYBXSA-N	442.299	1.505	50	20	IDGD	
Cc1cccc(/C=C/C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Br)C3)n1	1792472809	PGLMWFYLAFWHLT-OWOJSOJESA-N	426.286	1.683	50	20	IDGD	
COc1ccccc1OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Br)C2	1792722517	JGHUFUHAKYTNRF-ZUMXRPEOSA-N	441.322	1.447	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1n[nH]c3ccccc13)C2	1792870710	IYIFHWYMHXXLNJ-NFFDBFGFSA-N	435.322	1.797	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3n(n1)CCCC3)C2	1795115818	LXWKAWIZOMTPAN-FVCICTRLSA-N	425.327	1.208	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@@H](O)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCBr	1795492820	LDUNNTDZSKBFLI-XJFOESAGSA-N	448.358	1.295	50	20	IDGD	
CCn1nc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)c2ccccc21	1796191230	NJFDNFCUJARPTL-REPLKXPHSA-N	446.316	1.302	50	20	IDGD	
COc1ccc(C(=O)CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Cl)cc1	1796362888	NBBTXFPRADOYNI-GTYSZEQSSA-N	426.872	1.782	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1occc1Br	1796546011	MTLYNGQCVJMNLA-LYIQGSDWSA-N	435.702	1.499	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1n[nH]c2ccc(F)cc12	1797480043	DTWLFSDKUDCPPI-IVWMJMPLSA-N	434.544	1.757	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2cncn2c1	1797529908	MDCGTSZVIJZTSF-MVWRLGRASA-N	425.316	1.774	50	20	IDGD	
Cc1nc[nH]c1CSCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2	1797663689	AYUXCAKNFSRLIM-JLUCKKNBSA-N	449.346	1.231	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(C(F)F)no1)C2	1798440489	XHWCEEOZIDTAMU-JGPRNRPPSA-N	434.403	1.176	50	20	IDGD	
COc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Cl)C3)cc(C(F)(F)F)n1	1798513687	LZBCDBCQYYRBRU-DJBIQUGXSA-N	439.793	1.847	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@@H](O)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CO[Si](C)(C)C	1798624675	WQEVXPUCTRNPJR-QKPAOTATSA-N	443.617	1.362	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1n[nH]c3c1CCc1ncccc1-3)C2	1799269395	YSNCQQGNVMEIBY-VLWCASSMSA-N	443.935	1.791	50	20	IDGD	
CN(C)c1cncc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Br)c1	1799348005	XNFFEIDJYAQSPR-AYRXBEOTSA-N	429.290	1.041	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)[S@@](=O)c1ccccc1	1800213877	AEFGTNVEVNIQOM-KLKWWNPASA-N	442.965	1.026	50	20	IDGD	
COc1ccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)Br)cc1C	1800756562	FEZVITYOUVMUKM-JNNRSPCRSA-N	439.350	1.919	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CCc3ccccc3O1)C2	1800762920	KJPJHHKHOGSVKB-IVFVNLKQSA-N	437.334	1.753	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1(C(=O)Nc3ccccc3)CC1)C2	1800971377	WYXJHPYADAFYSV-MVJTYMMSSA-N	449.935	1.249	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](O)c1ccccc1Cl	1801200334	HGMBQGQKQVFQKF-BRJGLHKUSA-N	431.316	1.217	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)n1cc(C)cn1	1801344154	MGBLMPYVOPARDK-RBZJEDDUSA-N	427.343	1.516	50	20	IDGD	
COc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)Br)C3)ccc1F	1801712064	MDKBEBRUNINASB-YGSHXTJESA-N	429.286	1.821	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H]2COc3ccccc3O2)[C@H]1c1cccnc1)[C@@H](O)CCl	1803135590	FIJFKANWAVULJM-FVCZOJIISA-N	445.903	1.527	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cccc3c[nH]nc23)[C@H]1c1cccnc1)[C@H](O)CCl	1803138831	FQELDGUTMGEHPC-WDYCEAGBSA-N	427.892	1.877	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccn3nccc3c2)[C@H]1c1cccnc1)[C@H](O)CCl	1803142654	GMPFOOTVRGOCTH-UHOSZYNNSA-N	427.892	1.649	50	20	IDGD	
CN1CCc2cc(C(=O)N3CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]3c3cccnc3)ccc21	1803143160	VVIMBDIPIOYXJD-GIVPXCGWSA-N	442.947	1.993	50	20	IDGD	
O=C(/C=C/C(=O)N1CCCC2(CCN(C(=O)[C@H](O)CCl)CC2)C1)NCc1ccccc1	1805478904	YLVMCQOTZVUMLM-IHHMQQGQSA-N	447.963	1.690	50	20	IDGD	
Cc1nocc1C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1805828784	QWLNRFYHZAEGJG-JXFKEZNVSA-N	428.493	1.071	50	20	IDGD	
CCOCC(=O)NC[C@H]1CCN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@@H]1c1cccnc1	1806502780	SAULLFQZRDQXKA-MFWRVWTKSA-N	440.504	1.258	50	20	IDGD	
Cc1cc(CCC(=O)N2CCCC3(CCN(C(=O)c4cccc(B(O)O)c4)CC3)C2)ccn1	1806809282	IPVXXLIFZBSIQL-UHFFFAOYSA-N	449.360	1.547	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC2(CCCN(C(=O)CNC(=O)c3cccnc3)C2)CC1	1806872331	CXOXGMBKKZKWFP-UHFFFAOYSA-N	446.624	1.894	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)c1ccc2n[nH]cc2c1	1808013151	XTQGKMHYFYWBPU-ZYSHUDEJSA-N	427.892	1.877	50	20	IDGD	
O=C(C(=O)N1CCCC2(CCN(C(=O)c3cccc(B(O)O)c3)CC2)C1)c1ccccc1	1808980127	AWRGQSAMOHLYJN-UHFFFAOYSA-N	434.301	1.094	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)c3nc4ccccc4o3)CC2)C1	1809980715	PLFUUNQAKBAGBQ-UHFFFAOYSA-N	447.300	1.666	50	20	IDGD	
C[C@H](Cn1cncn1)C(=O)NC[C@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1	1810474625	DVBLILLJMFWZKS-QGPMSJSTSA-N	449.353	1.800	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1CCN(C(=O)Cc2cnccn2)[C@H]1c1cccnc1	1810537747	NIUAHGXRWLKBMV-UWJYYQICSA-N	427.581	1.972	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2n[nH]cc2[N+](=O)[O-])[C@H]1c1cccnc1	1810638390	MCEGVFNBRAUOFQ-DVOMOZLQSA-N	436.856	1.286	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)c1ccc2ccnn2c1	1812201018	COIDHZDSYBLLIA-ZYSHUDEJSA-N	427.892	1.649	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)[C@H](C)Cn2cccn2)[C@H]1c1cccnc1	1813028511	RPMFRCGGUOMTBZ-BVBHFADKSA-N	433.940	1.874	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2nc3ccccn3n2)[C@H]1c1cccnc1	1813030888	NCOWOIWEDMEDHQ-BQFCYCMXSA-N	442.907	1.698	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)C(=O)c2cccn2C)[C@@H]1c1cccnc1	1813033828	SXDDVNSMIPCUMZ-XYJFISCASA-N	432.908	1.563	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)/C=C/c2ccoc2)[C@@H]1c1cccnc1	1813071728	WHTUAWSPEDRCMU-GDDGWZMTSA-N	439.516	1.767	50	20	IDGD	
O=C(COc1cccnn1)NC[C@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1	1813389490	RRFYHMGPQOAVRZ-BEFAXECRSA-N	448.321	1.741	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cnc(OCF)cn2)[nH]n1)[C@@H](O)CCl	1814869596	USQOEKKVPNNXJW-OLZOCXBDSA-N	426.836	1.411	50	20	IDGD	
CC[C@@H](NC)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1)CC2	1815306643	LIWGXLJWYJNKFI-MLZXSMIQSA-N	445.549	1.187	50	20	IDGD	
CSCC(C)(C)C(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1	1815337562	UKZIRGYRZPTVDT-AWEZNQCLSA-N	447.391	1.438	50	20	IDGD	
Cc1ccc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)cc1C	1815360900	QNHAPMUUGOVRNX-GOSISDBHSA-N	449.341	1.979	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)c3[nH]nnc3C)sc2C1	1815944076	MLEAAFZBZUKMLD-IUCAKERBSA-N	427.328	1.969	50	20	IDGD	
Cc1ccc(CC(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)cc1	1816944560	VDUGMYZDFOQCGM-NRFANRHFSA-N	446.316	1.947	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(F)c2)[nH]n1)c1cccc(B(O)O)c1	1817476817	REZWEQXYONIVJY-IBGZPJMESA-N	436.252	1.848	50	20	IDGD	
Cn1ncc2cc(C(=O)Nc3nc4c(s3)C[C@@H](NC(=O)[C@H](O)CCl)CC4)ccc21	1818544026	RVVRBUXJDNMUCL-SWLSCSKDSA-N	433.921	1.855	50	20	IDGD	
Cn1ccc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cnccc4C(=O)NN)sc3C2)c1	1819794810	FFVDQDALCFBJAZ-GFCCVEGCSA-N	439.501	1.020	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)C2=NNC(=O)C2)[nH]n1	1822085787	DXZWHCWOZAVFBL-CABZTGNLSA-N	425.287	1.451	50	20	IDGD	
CCOC(=O)N[C@H](O)C(=O)N1CCC([C@H]2CCCCN2C(=O)C(C)(C)CCl)CC1	1824013822	RYAZECRARZNSAT-HZPDHXFCSA-N	431.961	1.936	50	20	IDGD	
O=C(c1cnc2snnc2c1)N1CCC([C@H]2CCCCN2C(=O)[C@@H](O)CCl)CC1	1824185578	KDVJOQDTRIBEFG-CVEARBPZSA-N	437.953	1.919	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC([C@H]2CCCCN2C(=O)CS(C)(=O)=O)CC1	1826625429	IQJFCGHDQFGEJQ-UKRRQHHQSA-N	437.400	1.682	50	20	IDGD	
CNCCCC(=O)N1CCCC[C@H]1C1CCN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)CC1	1826888063	GVFJRYRUMPOPQH-UBYGEMSKSA-N	444.580	1.740	50	20	IDGD	
O=C([C@@H]1C[C@@]1(F)Cl)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827060724	YHIDALPHTMNLFR-UEXGIBASSA-N	436.720	1.524	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)C(Cl)Cl)CC1	1828925297	ILZHYMGMVNCGAO-OAHLLOKOSA-N	442.347	1.722	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3nsnc3NC)CCO2)C1	1829748657	CYWXGIQXQBAHEW-PXAZEXFGSA-N	431.946	1.057	50	20	IDGD	
Cc1cnc2c(C(=O)N3CCOC[C@]4(C3)CN(C(=O)C(C)(C)CCl)CCO4)cnn2c1	1830362130	MBQISUOGYGVSAW-NRFANRHFSA-N	449.939	1.373	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830366251	MJGHEEWDCUCYDM-LRDDRELGSA-N	425.751	1.491	50	20	IDGD	
O=C(C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1)c1ccc(Cl)cc1	1830686651	NBRYPWLUBAHQJU-YJBOKZPZSA-N	433.263	1.514	50	20	IDGD	
CC(C)(C)c1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)ccn1	1830725670	QUOIVWYMMSJLAX-KKSFZXQISA-N	439.940	1.049	50	20	IDGD	
CC1(C)CCC(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)CC1	1830733393	KZPIDOZHLBVDCR-UWJYYQICSA-N	430.973	1.649	50	20	IDGD	
O=C(C(Cl)Cl)N1CCC([C@@H]2CCCCN2C(=O)COc2ccc(O)nn2)CC1	1831116924	SVIZUZZAYOZPPY-ZDUSSCGKSA-N	431.320	1.984	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCCC[C@H]1C1CCN(C(=O)Cn2cnnn2)CC1	1831550384	VOSGVLFHPNHSBE-CABCVRRESA-N	427.347	1.466	50	20	IDGD	
CC(C)N1CCC(C(=O)N2CCO[C@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)CC1	1832406567	SWIBNAQGQQSQCU-JOCHJYFZSA-N	444.016	1.828	50	20	IDGD	
COc1cncc(CCC(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)c1	1832914896	GXGJZTVNIMZGNS-IEBWSBKVSA-N	429.876	1.014	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)cnc1C	1833299847	TUKQAGUOTJAPNM-CRAIPNDOSA-N	444.301	1.459	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccccc3O)CCO2)C1	1833758150	OOHVDXFXCGFRCR-RTBURBONSA-N	431.316	1.699	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccns3)CCO2)C1	1833769978	ATTRIXPCOPAHSW-BLLLJJGKSA-N	432.340	1.244	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccnc3)CCO2)C1	1834001113	LLZXGNQZAZPXHF-KSSFIOAISA-N	426.311	1.183	50	20	IDGD	
Cc1nc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](C)CBr)C3)C2)cs1	1834450317	ANQVKTOOIJAAPK-YVEFUNNKSA-N	446.367	1.553	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)[C@H](CC)NC)CC2)CC1	1834794866	JFWPOWMOFOIHHS-IRXDYDNUSA-N	431.419	1.730	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CNC(C)(C)C)CCO2)C1	1835619590	FBWVTASLCINLAM-KBXCAEBGSA-N	434.375	1.004	50	20	IDGD	
Cc1cnoc1C(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)Br)CC2)CC1	1836071857	LRWFRSIHTKYOTK-CYBMUJFWSA-N	427.343	1.952	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](F)Br)CC2)CC1	1836414418	JUBCAFLINTZCOP-UONOGXRCSA-N	442.757	1.502	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cccc4nccn34)CC2)CC1	1836490603	ZHQZTBFMVFHFKJ-SFHVURJKSA-N	447.967	1.773	50	20	IDGD	
O=C([C@H](O)CCl)N1CCC(OC2CCN(C(=O)[C@H]3CNc4ccccc43)CC2)CC1	1836716910	XMWQERVWOPDBBC-AZUAARDMSA-N	435.952	1.794	50	20	IDGD	
O=C([C@@H]1CNc2ccccc21)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836716912	XMWQERVWOPDBBC-QUCCMNQESA-N	435.952	1.794	50	20	IDGD	
Cn1nc2c(c1C(=O)N1CCC(OC3CCN(C(=O)[C@@H](O)CCl)CC3)CC1)CCC2	1836719536	WANRHHASQSVDIR-SFHVURJKSA-N	438.956	1.121	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cn(C)c4ncccc34)CCO2)C1	1837190637	YLBFCWGUPRQKLH-DYESRHJHSA-N	434.924	1.661	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CSCc3[nH]cnc3C)CCO2)C1	1837330643	DCXCGQMXSINRJG-BEFAXECRSA-N	444.985	1.425	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3c(F)c(C)nn3C)CC2)CC1	1837338680	LHYTXDZWLGJQAU-INIZCTEOSA-N	444.935	1.734	50	20	IDGD	
CCc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)no1	1838126804	DOMCKPYFFVVNPL-LJQANCHMSA-N	425.558	1.159	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4cccnc4n3)C2)C1	1839145554	LZKLLNPZFSNOPP-HRAATJIYSA-N	432.908	1.717	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(O)cc3F)C2)C1	1839154063	AAGLVEQGABIUKZ-OALUTQOASA-N	449.306	1.838	50	20	IDGD	
C=CC[C@H](C(=C)C)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H](F)Br)CCO2)C1	1839201159	YIYCOTHQRKRGCZ-RKVPGOIHSA-N	433.318	1.902	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)c(F)c1	1839261865	ZUUUWSLEUQTTCG-MAUKXSAKSA-N	447.276	1.895	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(F)n3)C2)C1	1839965186	PWKRLFYLTKAZNA-FZKQIMNGSA-N	444.301	1.464	50	20	IDGD	
CC(C)n1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)n1	1840034532	OJESPYLHQOLSPK-KDOFPFPSSA-N	443.342	1.317	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3cccc(C#N)c3)C2)C1	1840149088	DKRNAMUDIZEQMH-UGKGYDQZSA-N	449.935	1.201	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(F)cc(F)c3)C2)C1	1840154003	HVQMDKLLTPJFCA-QFBILLFUSA-N	432.851	1.289	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(C)cc(C#N)c3)C2)C1	1840154692	CWRJJFKLDTYGAS-NQIIRXRSSA-N	435.908	1.191	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(C)c(O)c(C)c3)C2)C1	1840156055	HRFPXDBARJVXFE-UWJYYQICSA-N	440.924	1.333	50	20	IDGD	
O=C([C@H](F)Br)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CCCS1)CCO2	1840578702	BAQSBGYLWYEILB-XUJVJEKNSA-N	425.320	1.029	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(OC)c3F)CCO2)C1	1840794294	WHEQZTKRNXLHLD-QRWLVFNGSA-N	428.888	1.922	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC2(CCCN2C(=O)CN(C)C(=O)c2ccccc2)C1	1841521620	PSQYRBQERFNUFN-OAHLLOKOSA-N	436.350	1.993	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC2(CCCN2C(=O)[C@H]2CCN2C(=O)OC(C)(C)C)C1	1841766471	QFYQOAAZIPNRHM-CHWSQXEVSA-N	430.343	1.983	50	20	IDGD	
COc1ccc(C2(C(=O)N3CC4(CCCN4C(=O)c4cccc(B(O)O)c4)C3)CCC2)cc1	1843014537	VDIAQBYCICCJPQ-UHFFFAOYSA-N	448.328	1.314	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)c2cc(-c3ccccc3)no2)C1	1844478185	IQWHRHIJHBMJPM-UHFFFAOYSA-N	431.257	1.152	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1O)C2	1845166231	ITEZGFNCKVWQDS-QLFBSQMISA-N	429.945	1.435	50	20	IDGD	
CN1CCCn2nc(C(=O)N3CC4(CCCN4C(=O)[C@H](F)Br)C3)cc2C1	1845219333	JFQLLURDYGMWGE-AWEZNQCLSA-N	428.306	1.226	50	20	IDGD	
O=C1CC[C@@H](C(=O)N2CC3(CCCN3C(=O)[C@H](Br)Cc3ccccc3)C2)N1	1845940684	DTZRGIAIKSGJHJ-CVEARBPZSA-N	434.334	1.475	50	20	IDGD	
CN(CC(=O)N1CC2(CCCN2C(=O)CC2CCC2)C1)NC(=O)NCc1ccccc1	1847002937	WKFLYBWYTKEPCW-UHFFFAOYSA-N	427.549	1.726	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H](O)C[C@H]1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)C(C)(C)CCl	1847439000	MGWRLYMSMNASOJ-UGUYLWEFSA-N	443.972	1.824	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CCn1c(=O)oc2ccccc21	1848156129	QLINNGILMGWNOI-IHRRRGAJSA-N	436.306	1.970	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)[C@H](C)NS(=O)(=O)c1ccc(Cl)cc1	17582113	IOCZINZMRHOORX-LBPRGKRZSA-N	435.893	1.424	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2ccc(Br)cc2)ccc1Cl	25386038	FPGJFZAPGABTKK-UHFFFAOYSA-N	432.683	1.825	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)Cc1ccccc1F	28663072	WXRHVIMFHYDVRO-UHFFFAOYSA-N	449.504	1.169	50	20	IDGD	
CCn1c(SCC(=O)NNC(=O)c2ccc3c(c2)OCCO3)nnc1-c1ccco1	105310511	LNVKQXDBWLHWTQ-UHFFFAOYSA-N	429.458	1.883	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)[C@H]1CCCN(C(=O)Nc2ccccc2F)C1	725741956	XFMZGFAZVOXDFF-ZDUSSCGKSA-N	431.424	1.240	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)Nc1cccnc1Cl	726871444	SGFPIIPELVARPV-UHFFFAOYSA-N	439.881	1.222	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NN=Cc2ccc(N3CCOCC3)c(F)c2)c1	727253487	DTGYSPULHHYLPQ-UHFFFAOYSA-N	434.493	1.677	50	20	IDGD	
Cc1nc(CC(C)C)sc1C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	728343563	ONUKNUOKHNNJLA-OAHLLOKOSA-N	433.486	1.794	50	20	IDGD	
Cc1csc(SCc2ccccc2C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)n1	728377771	RVVPRDYYDFWSQZ-ZDUSSCGKSA-N	425.557	1.940	50	20	IDGD	
CC(=O)CCc1ccc(O[C@H](C)C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1	728846134	SFTWHMVPZCDZKE-QGZVFWFLSA-N	439.516	1.830	50	20	IDGD	
Cc1cc(=O)c(C(=O)NNC(=O)Cc2cccnc2)nn1-c1ccccc1C(F)(F)F	728852661	LUPWFEMAFIMSMZ-UHFFFAOYSA-N	431.374	1.958	50	20	IDGD	
C=CCNS(=O)(=O)c1ccc(C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)cc1	728974095	DEIYACMCRUWVMM-UHFFFAOYSA-N	445.469	1.904	50	20	IDGD	
CCCn1c(C)cc(/C=C(/C#N)C(=O)O[C@H](C)C(=O)N(C)[C@H]2CCS(=O)(=O)C2)c1C	729236008	KBNBUOKVBDJPOC-WMJHGLBSSA-N	435.546	1.999	50	20	IDGD	
C[C@@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)NNC(=O)Cn2ccc3ccccc32)C1=O	729451302	RMYZPUOVCOKMNI-QFIPXVFZSA-N	437.431	1.395	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)[C@H]2CCCN(S(=O)(=O)Cc3ccccc3)C2)cc1	730539153	KQLMTLWXDKFIJH-IBGZPJMESA-N	426.498	1.561	50	20	IDGD	
CN(C1CC1)S(=O)(=O)c1ccc(NC(=O)NNC(=O)COc2ccccc2O)cc1	730899316	CAUGUSFPNRPPBD-UHFFFAOYSA-N	434.474	1.407	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)c1cc(S(=O)(=O)N2CCOCC2)cn1C)c1ccccc1	731999986	BQRPGWOCLDANOA-KRWDZBQOSA-N	434.518	1.001	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2ccc3c(c2)C(=O)N(C)C3=O)cc1Br	732036144	YEOQWWFTZAHDLH-UHFFFAOYSA-N	432.230	1.758	50	20	IDGD	
CC(C)CNS(=O)(=O)c1ccc(Br)c(C(=O)NNC(=O)C2CCC2)c1	732143675	CERYLZCXWBXLMG-UHFFFAOYSA-N	432.340	1.945	50	20	IDGD	
Cc1nn(CCO)c2ncc(C(=O)OCC(=O)NNC(=O)c3cccc(Cl)c3)cc12	732333713	PHPRQFCDTGSNOO-UHFFFAOYSA-N	431.836	1.003	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1)C1CCS(=O)(=O)CC1	732957199	PEKWJFUXLZELTJ-OAQYLSRUSA-N	441.553	1.586	50	20	IDGD	
Cc1cc(NNC(=O)[C@@H]2CC(=O)N(CCN3CCOCC3)C2)ccc1Br	734254658	COVOGHABFKTFDR-CQSZACIVSA-N	425.327	1.381	50	20	IDGD	
COc1ccc([C@@H]2[C@@H](C(=O)NNC(=O)COc3ccc(C#N)cc3)CCC(=O)N2C)cc1	734417086	JOKKGMGKFIVTLZ-SIKLNZKXSA-N	436.468	1.703	50	20	IDGD	
Cc1n[nH]cc1C(=O)NN=C1C(=O)N(Cc2ncon2)c2ccc(Br)cc21	735411758	TUCMXUZDIMMWID-UHFFFAOYSA-N	430.222	1.545	50	20	IDGD	
C[C@@H](CN1CCOCC1)C(=O)NN=C1C(=O)Nc2c(Cl)cc(Br)cc21	735613131	ZFUQVEQIDFCIQZ-VIFPVBQESA-N	429.702	1.843	50	20	IDGD	
CCOC(=O)N1[C@@H](C(=O)NNC(=O)CNC(=O)c2cccs2)CC[C@@H]1c1ccc(C)o1	736483003	WNMYAAPWRVHCGQ-ZIAGYGMSSA-N	448.501	1.889	50	20	IDGD	
Cc1ccc(O[C@H](C)C(=O)N2CCN(CC(=O)NNC(=O)c3ccccc3)CC2)c(C)c1	738332747	OWPMLFXPNGEXNA-LJQANCHMSA-N	438.528	1.676	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)N[C@H]2CCN(CC3CC3)C2)c2ccccc2c1=O	739036452	VEBZOMADWVBVPM-INIZCTEOSA-N	426.521	1.625	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)[C@H]2CCCCN2Cc2ccccc2)n1	741356213	ZHMWMIKFWJZBLQ-QGZVFWFLSA-N	430.530	1.739	50	20	IDGD	
O=C(CCCS(=O)(=O)N1CCCC1)NNC(=O)NCc1cccc(C(F)(F)F)c1	742448251	JSZBGJYCVXNVBQ-UHFFFAOYSA-N	436.456	1.742	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)NNC(=O)c2scnc2C)cc1Cl	743595223	WHVDYYQRVGEIRI-UHFFFAOYSA-N	428.858	1.803	50	20	IDGD	
CC1(C)[C@H]2OCCC[C@@H]2[C@H]1NC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	745859863	FTWPJGFXNFLJNS-NRSPTQNISA-N	429.565	1.733	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Cn2cc3ccccc3n2)c1	748517279	RRHYDZBEOIQUNH-UHFFFAOYSA-N	429.502	1.528	50	20	IDGD	
COc1ccccc1CC(=O)N1CCC(NC(=O)NNC(=O)c2ccc(C#N)cc2)CC1	749018250	AIGHMWDQUINQJH-UHFFFAOYSA-N	435.484	1.745	50	20	IDGD	
CSCC[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)NNC(=O)c1ncccc1C	752228110	UDVJPAVVRWFYMF-OAHLLOKOSA-N	431.474	1.611	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N(C)Cc2nc[nH]n2)cc1	754859036	OYTNVPJFWARSLW-DHDCSXOGSA-N	434.460	1.118	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)ccc1NC(=O)OC(C)(C)C	755939010	CLXXIKAAYZFOTA-LLVKDONJSA-N	442.494	1.630	50	20	IDGD	
CCc1ccccc1OCC(=O)NNS(=O)(=O)c1cc(F)c(F)c(C(=O)OC)c1	755953528	ARZZIOCKMSMQHC-UHFFFAOYSA-N	428.413	1.702	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)NCC2CCS(=O)(=O)CC2)cc1Cl	756133282	HMWROQYMDMJQTE-UHFFFAOYSA-N	434.902	1.518	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)Nc1cc(F)ccc1OC[C@H]1CCCO1	756477830	ZMTNRHZDTPKLQB-MRXNPFEDSA-N	441.423	1.826	50	20	IDGD	
CNS(=O)(=O)c1ccc(C)c(NC(=O)NNC(=O)[C@@H](C)Oc2ccc(C(C)=O)cc2)c1	756528552	UKNJBFGUJNTUKG-CQSZACIVSA-N	448.501	1.726	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)Nc2cc(Br)cn(C)c2=O)cc1	757601227	WXYZMBRYVHSTOM-UHFFFAOYSA-N	425.239	1.388	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2ccccc2OCc2ccc(F)cc2)co1	757632926	DTXYTVLLDJZMDC-UHFFFAOYSA-N	433.417	1.720	50	20	IDGD	
CCS(=O)(=O)c1ccc(CCC(=O)OCC(=O)NNC(=O)c2ccc(C)cc2)cc1	757786992	KJCZSFOAEDFDLQ-UHFFFAOYSA-N	432.498	1.726	50	20	IDGD	
CC(C)(C)OC(=O)N(CC(=O)N1CCN(S(=O)(=O)CBr)CC1)C1CC1	758524569	WHFLZIUDUOCHIQ-UHFFFAOYSA-N	440.360	1.212	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cn(CC3(C)COC3)nn2)ccc1OCCC(C)C	758998811	ZFGKFJDIMOBHRP-UHFFFAOYSA-N	431.493	1.823	50	20	IDGD	
Cc1ccc(O)c(C(=O)Nc2nc(CC(=O)NNC(=O)Cc3cccnc3)cs2)c1	760873235	XNIVZVIZJHXKES-UHFFFAOYSA-N	425.470	1.737	50	20	IDGD	
CC(=O)Nc1cc(C(=O)NNC(=O)CCN2C[C@H](C)O[C@@H](C)C2)cc(C(F)(F)F)c1	760988556	RQOJEYNJHGIZMO-RYUDHWBXSA-N	430.427	1.924	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N2CCS(=O)(=O)CC[C@H]2C)cc1Br	763271930	OXOOCXLRHQNGFR-SNVBAGLBSA-N	434.312	1.321	50	20	IDGD	
CCOC(=O)N1CCN(C(=O)COC(=O)/C(C#N)=C\c2cc(C)n(CCOC)c2C)CC1	763282338	CAKIKXAFRLHALL-UYRXBGFRSA-N	446.504	1.502	50	20	IDGD	
CN1CCN(CC(=O)NNC(=O)c2cn(-c3ccccc3)nc2-c2ccccc2)CC1=O	763283566	LJDCQBTXJOIEFK-UHFFFAOYSA-N	432.484	1.074	50	20	IDGD	
O=C(NNC(=O)c1ccncc1)C(=O)Nc1ccc(C(=O)N2CCc3ccccc32)cc1	763463838	KCSURYBDWNVWGX-UHFFFAOYSA-N	429.436	1.684	50	20	IDGD	
CCC(=O)Nc1ccc(Cl)c(NC(=O)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c1	763472108	TUBQLUFYLPSRQI-UHFFFAOYSA-N	433.808	1.996	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)Nc1cc2c(cc1Cl)OCCO2	763570731	FLFDCFMHOFGVPN-MRXNPFEDSA-N	433.804	1.037	50	20	IDGD	
COc1cc2nc(C)sc2cc1NC(=O)C(=O)NNC(=O)[C@H]1COc2ccccc2O1	763572983	OYCACPKTZCEFDV-MRXNPFEDSA-N	442.453	1.539	50	20	IDGD	
Cc1cc(C(=O)NC(C)C)ccc1NC(=O)C(=O)NNC(=O)[C@@H]1COc2ccccc2O1	763574384	ZJWWEDAUYFRKEW-SFHVURJKSA-N	440.456	1.059	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)[nH]n1)C(=O)Nc1ccc(N2CCCC2=O)cc1	763603850	BCDXDBFYQDEPIU-UHFFFAOYSA-N	432.440	1.603	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)ccc1F	763614658	UUDOYKNXTOJPGK-UHFFFAOYSA-N	425.376	1.402	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1cccc(CCN2CCCC2)c1	763629800	NXZFYVGLKQMNSW-UHFFFAOYSA-N	434.500	1.681	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(C#Cc3ccccn3)c2)cc1	763674999	SZJDAFVOGJPVDM-UHFFFAOYSA-N	439.431	1.518	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(O[C@H]2CCOC2)cc1	763679536	AKFPXDHLTVYQOX-KRWDZBQOSA-N	443.456	1.418	50	20	IDGD	
CON(C)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)cc1	763694144	FQGOCGXIMYCFRG-UHFFFAOYSA-N	434.836	1.138	50	20	IDGD	
COCc1cc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccco3)nc3ccccc23)ncn1	763762912	GGICEPISYWZSOS-UHFFFAOYSA-N	446.423	1.831	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)C(=O)N1C[C@H]2CCCN2c2ccccc21	763804925	XPTVPOHPHRGNHO-CQSZACIVSA-N	439.428	1.137	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(-n3nccn3)cc2)cc1	763879587	YXSLGZWDFVZZQF-AWEZNQCLSA-N	436.428	1.023	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)C(=O)Nc2ccc3c(c2)CCC(=O)N3C)cc1	763891165	KAHVVDVTUJEUBL-UHFFFAOYSA-N	426.498	1.782	50	20	IDGD	
CCOc1ccc(Br)cc1NC(=O)C(=O)NNC(=O)Cn1nc(C)cc1C	763892798	KWIXTKVDVFTMFU-UHFFFAOYSA-N	438.282	1.447	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C)c(S(C)(=O)=O)c2)cc1OC	763902906	ROCVUUQYJQEVLZ-UHFFFAOYSA-N	449.485	1.206	50	20	IDGD	
Cc1nnnn1-c1cccc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CC[C@H](C)C3)c1	763940564	TXXFQRILVHJOBY-NSHDSACASA-N	439.501	1.557	50	20	IDGD	
C[C@H]1CCCCN1CC(=O)Nc1ccc(F)c(NC(=O)C(=O)NNC(=O)c2ccc[nH]2)c1	763981135	VHTDAGIXXSCQJY-ZDUSSCGKSA-N	444.467	1.366	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1ccnn1Cc1ccccc1F	764006912	VNRNRIBVMVOMIS-UHFFFAOYSA-N	439.403	1.241	50	20	IDGD	
CN(C)C(=O)COc1ccc(NC(=O)C(=O)NNC(=O)c2cccc3ccccc23)cc1	764048533	NPCHCENBHKBGEB-UHFFFAOYSA-N	434.452	1.707	50	20	IDGD	
C[S@](=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cccc(Br)c2)cc1F	764059656	WAHIHDBCHDTUOE-SANMLTNESA-N	442.266	1.725	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)C2CCCC2)ccc1NC(=O)c1cccnc1	764066146	IFFLPLKRDNHZSS-UHFFFAOYSA-N	425.445	1.619	50	20	IDGD	
CC[C@@H](C)C(=O)NNC(=O)C(=O)Nc1c(C)cnn1[C@@H]1CCN(Cc2ccccc2)C1	764081920	KTGMCWHYZMJOJE-CRAIPNDOSA-N	426.521	1.771	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc(Cn4cncn4)cc3)n[nH]2)cc1	764110169	FZDQWHIVENEVQC-UHFFFAOYSA-N	444.455	1.425	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cnn(Cc4ccncc4)c3)n[nH]2)cc1	764110777	KXMSMOJVDHSZAO-UHFFFAOYSA-N	444.455	1.425	50	20	IDGD	
COC(=O)[C@@H](C)Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)cc1	764127591	XSDABHUBJUACPO-NSHDSACASA-N	433.848	1.797	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccc(-n2cccn2)c(Cl)c1	764138856	KPSLLRBCWLBCCV-UHFFFAOYSA-N	427.848	1.863	50	20	IDGD	
COCCOc1c(Cl)cccc1NC(=O)C(=O)NNC(=O)[C@@H]1Cc2ccccc2O1	764166577	CZPKWMGMZKNCRQ-INIZCTEOSA-N	433.848	1.455	50	20	IDGD	
CCN1CCN(c2ccc(NC(=O)C(=O)NNC(=O)CCCc3cccs3)cc2)CC1	764341414	MKLAYZHUDUGMKA-UHFFFAOYSA-N	443.573	1.999	50	20	IDGD	
C[C@H](c1cccc(NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)c1)N1CCOCC1	764345928	MLBSIXQWCNWTGO-CYBMUJFWSA-N	446.891	1.839	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cnn(-c4ncccn4)c3)n[nH]2)cc1	764384950	OAIUEUSTMGBYPP-UHFFFAOYSA-N	445.443	1.015	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)c3ccc(C)cc3F)CC2)cc1	765727225	GKMFFUYFLSKSGH-UHFFFAOYSA-N	448.520	1.210	50	20	IDGD	
O=C(NNC(=O)c1coc(C2CCOCC2)n1)c1cccc(S(=O)(=O)N2CCCC2)c1	767402697	DRALDHXUYGUFAU-UHFFFAOYSA-N	448.501	1.428	50	20	IDGD	
O=C(NNC(=O)c1c[nH]c2ccccc12)C(=O)Nc1cc(C2CC2)nn1-c1ncccn1	768231918	IJEQWIGVFRWDIS-UHFFFAOYSA-N	430.428	1.421	50	20	IDGD	
CCn1c(SCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)nnc1-c1cnccn1	768412049	RTAZFGLIOGSATH-UHFFFAOYSA-N	428.434	1.217	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@H]2C[C@H](OC(C)C)C2(C)C)cc1	768431194	PQXBTGNBBLVLKD-IRXDYDNUSA-N	440.566	1.538	50	20	IDGD	
Cc1nn(-c2ccc(S(N)(=O)=O)cc2)c(C)c1CCC(=O)NN=c1cc[nH]cc1Cl	768443880	FMSXBWUTJXUXIN-UHFFFAOYSA-N	448.936	1.683	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)/C=C\C(=O)Nc1ccc2n[nH]cc2c1	768635131	VYFCFZLMVDDCSM-HJWRWDBZSA-N	429.458	1.613	50	20	IDGD	
COC(=O)c1[nH]c(C)c(C(=O)OCC(=O)NNC(=O)c2ccc(OC)c(OC)c2)c1C	768680388	NKTNJFILWAFLHT-UHFFFAOYSA-N	433.417	1.053	50	20	IDGD	
C[C@H]1C[C@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)CCO1	770353473	CCEGPAWNPZSSEH-MAUKXSAKSA-N	446.529	1.677	50	20	IDGD	
CCNC(=O)N(C)NC(=O)c1ccc(NC(=O)C[C@@H]2SC(N3CCCC3)=NC2=O)cc1	770548231	DDIMZQHEUHLNNI-HNNXBMFYSA-N	446.533	1.415	50	20	IDGD	
Cc1nn(CCCl)c(C)c1C(=O)N1CCO[C@@H](CN2C(=O)c3ccccc3C2=O)C1	771491419	HFTWOUFHJAMQPL-OAHLLOKOSA-N	430.892	1.876	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccccc2)C1	771988159	JBLFQHDTYYPOKY-HZPDHXFCSA-N	439.534	1.213	50	20	IDGD	
CC(C)NC(=O)Nc1ccc(C(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)cc1	772195606	ABUWJWNUCXBCIM-UHFFFAOYSA-N	431.880	1.947	50	20	IDGD	
CC(C)[C@@H]1C[C@H](NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)CCO1	772619762	NOYCYVVJVDTWEZ-AEFFLSMTSA-N	438.550	1.619	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772898817	SMUILUCXAWSCIN-UHFFFAOYSA-N	443.935	1.316	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NN=Cc2ncc(C3OCCO3)s2)c1	772988841	BZBYMWGKBRZDMD-UHFFFAOYSA-N	438.531	1.983	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNc2nccnc2C(C)C)cc(S(C)(=O)=O)c1	773998208	NGYNEZPSUJUJDR-UHFFFAOYSA-N	449.489	1.262	50	20	IDGD	
COC(=O)COc1cccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)c1	774003237	VYUCMVAYROTMFR-GFCCVEGCSA-N	449.847	1.445	50	20	IDGD	
CC1C[C@H](C(=O)NNC(=O)c2ccccc2F)[C@@H](C(=O)NNC(=O)c2ccccc2F)C1	775764075	AXODXWOGAXDWTP-HOTGVXAUSA-N	444.438	1.849	50	20	IDGD	
Cc1ccc(S(=O)(=O)C[C@@H](C)NC(=O)NNC(=O)c2nnc(O)c3ccccc23)cc1	776190870	FSQHTSVJHPEWFK-CYBMUJFWSA-N	443.485	1.450	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)[C@@H]1CCN(Cc2ccccc2)C1	778588883	MHKVCPJMMATUMN-VQIMIIECSA-N	434.504	1.517	50	20	IDGD	
O=C(NNc1ccccc1OC(F)(F)F)C(=O)Nc1ccc2c(c1)S(=O)(=O)CC2	778802964	JCTCADRWPJVRSG-UHFFFAOYSA-N	429.376	1.997	50	20	IDGD	
Nc1nc(Cl)cc(NNC(=O)[C@H]2CC(=O)N(c3ccccc3Br)C2)n1	779373349	HFRYPHLLSDDEEG-QMMMGPOBSA-N	425.674	1.971	50	20	IDGD	
COC(=O)c1ccccc1NNC(=O)[C@@H]1CCCN1S(=O)(=O)c1cccc([N+](=O)[O-])c1	780729313	CXTIVHAXTWCJAU-KRWDZBQOSA-N	448.457	1.678	50	20	IDGD	
N#CCCn1cc(/C=C(\C#N)C(=O)NCCNC(=O)c2cc[nH]n2)c(-c2ccccc2)n1	781042693	OIQHQLKQGDSDPN-GHRIWEEISA-N	428.456	1.640	50	20	IDGD	
Cc1cc(F)ccc1NNC(=O)C(=O)Nc1ccc(C(=O)NCC(=O)N(C)C)c(Cl)c1	783448061	WAFKTHQUQBZGKD-UHFFFAOYSA-N	449.870	1.687	50	20	IDGD	
COC(=O)COc1ccccc1C(C)=NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	783800350	SVPDUKDYCZKQCF-UHFFFAOYSA-N	433.486	1.643	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CNC(=O)c2ccco2)cc1OCCC(C)C	784002480	QKEHOZGYLOADME-UHFFFAOYSA-N	430.461	1.529	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1ccccc1CC(F)(F)F	784004430	XHOPVKRHTBIXPK-UHFFFAOYSA-N	428.392	1.369	50	20	IDGD	
O=C(NNc1ccc(Br)nc1)C(=O)Nc1ccccc1C(=O)N1CCOCC1	784813199	SGXAGOVMXPGJMO-UHFFFAOYSA-N	448.277	1.398	50	20	IDGD	
Cc1cc(C(=O)N2CCCC2)ccc1NC(=O)C(=O)NNc1cccc(S(C)(=O)=O)c1	784838954	BDZUWYPCDFJMDY-UHFFFAOYSA-N	444.513	1.716	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)Nc1cc(F)c(N2CCCC2)c(F)c1	785023942	QWQJBILXLFVBNM-UHFFFAOYSA-N	449.370	1.579	50	20	IDGD	
COc1ccc2nc(NNC(=O)C(=O)Nc3ccc4c(c3)n(C)c(=O)n4C)c(C)cc2c1	785162431	DZFZCKRUZISQFB-UHFFFAOYSA-N	434.456	1.824	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)cc1C(=O)N(C)C(C)C	787541026	ITCPMTHCQUZJBF-UHFFFAOYSA-N	440.456	1.604	50	20	IDGD	
Cn1nc(-c2ccc(Cl)s2)cc1NC(=O)C(=O)NNC(=O)[C@H]1Cc2ccccc2O1	787542421	KFCFBBHFJDLQKY-CYBMUJFWSA-N	445.888	1.892	50	20	IDGD	
C[C@H](C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)N(C)CC(F)(F)F	788265988	RFZJATRWNFLVJU-GFCCVEGCSA-N	436.456	1.115	50	20	IDGD	
Cc1nc2cc(C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)ccc2n1Cc1ccsc1	788588712	WUWDZLHNCZJLBC-LLVKDONJSA-N	435.531	1.153	50	20	IDGD	
CCOC(=O)c1ccc(C)c(S(=O)(=O)NNC(=O)COc2ccccc2OCC)c1	788736258	QQWPQQFZBGUPJE-UHFFFAOYSA-N	436.486	1.959	50	20	IDGD	
Cn1nc(-c2ccc(F)cc2F)cc1NC(=O)C(=O)NNC(=O)Cc1ccccc1F	789734814	OXYYOZWFIFNVOG-UHFFFAOYSA-N	431.374	1.833	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cc([C@@H]3CCCOC3)nn2C)c1C	790951864	MIXOURWUEBELLH-HZPDHXFCSA-N	443.504	1.484	50	20	IDGD	
CCOc1cc(C(=O)N(C)C)ccc1NC(=O)C(=O)NNc1cccc(F)c1[N+](=O)[O-]	790998088	GNMSSUJWCYUPKC-UHFFFAOYSA-N	433.396	1.916	50	20	IDGD	
CNS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2ccc(Br)s2)nc1	792392609	CCDAPTSGXIDEBC-UHFFFAOYSA-N	434.297	1.280	50	20	IDGD	
CC(C)c1ccccc1NC(=S)NNC(=O)[C@H](C)N1C(=O)[C@H]2[C@H](C1=O)[C@H]1CC[C@H]2O1	792492061	PMNRIVLOGDATKR-WVRYCFJFSA-N	430.530	1.679	50	20	IDGD	
COC(=O)c1cc(NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc(Cl)c1F	792504122	JHXBDXFNUOIOKH-UHFFFAOYSA-N	447.810	1.979	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ccc3c(=O)[nH]ccc3c2)cc1S(=O)(=O)N(C)C	793064680	DGZKBNFFJCOTQR-UHFFFAOYSA-N	443.485	1.169	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CNC(=O)OCc2ccccc2)cc1NS(C)(=O)=O	794060347	GIJCZDHFMXIPOM-UHFFFAOYSA-N	434.474	1.054	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)c2cccc(NC(=O)CSc3nncn3C)c2)n1	794090484	TZILEDKYZMPZEX-UHFFFAOYSA-N	425.474	1.324	50	20	IDGD	
CC(C)Oc1ccc(NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)cc1C(N)=O	797005855	VBHNACZNTVERSG-UHFFFAOYSA-N	437.456	1.314	50	20	IDGD	
O=C(NNc1c(F)cccc1F)C(=O)Nc1cc(S(=O)(=O)N2CCCC2)ccn1	797020874	PHNBMOWXQDQVGC-UHFFFAOYSA-N	425.417	1.226	50	20	IDGD	
Cc1ccccc1NC(=O)NNC(=O)CNS(=O)(=O)c1ccc(Br)s1	798309979	HPUSRNODGOBGQG-UHFFFAOYSA-N	447.336	1.950	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C3=NO[C@@H](CNC(=O)OC(C)(C)C)C3)n[nH]2)cc1	798895157	URASQDFOBLYMHM-CQSZACIVSA-N	442.476	1.816	50	20	IDGD	
Cc1cn(-c2ccc(Cl)cc2)nc1NC(=O)C(=O)NNC(=O)COc1ccccc1O	799258890	KHYUXFRPIOAAGB-UHFFFAOYSA-N	443.847	1.705	50	20	IDGD	
Nc1cc(F)c([N+](=O)[O-])cc1C(=O)NNC(=O)COc1ccc(Br)cc1	801797695	LRTYDTYXXIOHLV-UHFFFAOYSA-N	427.186	1.919	50	20	IDGD	
COc1ccccc1O[C@@H]1CCCN(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)C1	804869139	URFNZMPQQHPVDG-QGZVFWFLSA-N	437.460	1.569	50	20	IDGD	
O=C(COCc1cccnc1)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	805191466	GLICBERDNHWSTF-UHFFFAOYSA-N	431.924	1.217	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2O1)C(=O)Nc1ccc(F)cc1OC1CCOCC1	806977272	BWTQZZNVXKBFMY-LJQANCHMSA-N	443.431	1.473	50	20	IDGD	
O=C(NCC1=CCCOC1)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	807594564	XXNOPZGAUONNDD-UHFFFAOYSA-N	436.515	1.840	50	20	IDGD	
COC(=O)c1c(F)cccc1NNC(=O)CCC(=O)N1CCN(c2ccccn2)CC1	808027603	CFOCSDODVQDBKE-UHFFFAOYSA-N	429.452	1.579	50	20	IDGD	
N#Cc1cc(O)cc(C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)c1	809725685	YUVMTDCDKIMSLH-UHFFFAOYSA-N	427.892	1.496	50	20	IDGD	
CC(C[C@H]1CCC(=O)N1)=NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	811631200	OSLALUPTNPXCSS-GOSISDBHSA-N	428.514	1.940	50	20	IDGD	
O=C(NNC(=O)c1cc(CN2CCCC2)on1)c1cccc(S(=O)(=O)N2CCCC2)c1	812449009	HFUNSXBKSRIKBD-UHFFFAOYSA-N	447.517	1.130	50	20	IDGD	
COC(=O)c1cc(Br)cc(C(=O)OCC(=O)NNC(=O)c2ccccc2)c1	812699201	BJGDXKNVLZYHII-UHFFFAOYSA-N	435.230	1.854	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@@H](C)C(=O)NNC(=O)c1ccc2c(c1)NC(=O)CNC2=O	814229994	VNWYPKZWQQUTLH-LBPRGKRZSA-N	444.875	1.867	50	20	IDGD	
Cc1c(C(=O)NNC(=O)[C@@H](C)Oc2cccc(Br)c2)nnn1-c1ccn(C)n1	814366733	QKORRVOJESJRKQ-LLVKDONJSA-N	448.281	1.300	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)Nc1ccc(CN2C(=O)CCC2=O)cc1	814563833	ZYZPGAFKXVKFFH-UHFFFAOYSA-N	445.501	1.735	50	20	IDGD	
O=C(CC1CC1)NNC(=O)c1cc(S(=O)(=O)N2CCOCC2)c(Cl)cc1Cl	819123208	ULXHTBJBOMQFFO-UHFFFAOYSA-N	436.317	1.575	50	20	IDGD	
CNS(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)CC23CC4CC(CC(C4)C2)C3)cc1	906375444	UICLXVINFQLSAO-UHFFFAOYSA-N	441.575	1.511	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2ccccc2)cc1S(=O)(=O)NCc1ccccn1	913004281	OQNSHBVLBRQQRQ-UHFFFAOYSA-N	440.481	1.644	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)CNS(=O)(=O)c2ccc3ccccc3c2)c1	913449235	NJCCPCYYOIEJRC-UHFFFAOYSA-N	441.509	1.961	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2ccc(N3CCCC3=O)cc2)c1	916218671	LTLJXBXWKNLWEK-UHFFFAOYSA-N	430.486	1.361	50	20	IDGD	
COc1cc(OC)cc(C(=O)NN=C(C)c2ccc(S(=O)(=O)NCCC(=O)O)cc2)c1	916314417	BTQJPVXGKCNCIX-UHFFFAOYSA-N	449.485	1.611	50	20	IDGD	
CC(=NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1)c1ccc(S(C)(=O)=O)cc1	916541369	RPCZGEWZOXGUBU-UHFFFAOYSA-N	437.543	1.559	50	20	IDGD	
CN(C)Cc1cccc(CNC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c1	916568941	PNTLFRXKXYCWHV-UHFFFAOYSA-N	438.576	1.791	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NN=Cc2c(C)nn([C@@H]3CCS(=O)(=O)C3)c2C)cc1C	917031540	VZIHLZHMVUFWAW-QGZVFWFLSA-N	431.518	1.565	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c(C(F)(F)F)n1	917363449	IUXQFLZJFLMSKP-UHFFFAOYSA-N	445.423	1.298	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cc(-c3cccs3)[nH]n2)cc1OC	919194011	MORMUMONRAIJQQ-UHFFFAOYSA-N	430.442	1.773	50	20	IDGD	
N#Cc1ccc(-c2ccc(OCC(=O)NNC(=O)CCn3cc([N+](=O)[O-])cn3)cc2)cc1	919837298	VYMMIJTZUSYMIM-UHFFFAOYSA-N	434.412	1.946	50	20	IDGD	
CC(=O)NCCNC(=O)/C(C#N)=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	920848978	KHTPKVGVUICLHG-XNTDXEJSSA-N	428.880	1.238	50	20	IDGD	
C[S@@](=O)c1ccc(C=NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1	1116209496	PFUKIERASBTKTM-MUUNZHRXSA-N	435.527	1.209	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)CSCC(=O)N2CCCCC2)CC1	1318914656	JKIQCVPPPPOWLZ-UHFFFAOYSA-N	442.582	1.527	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)Nc2ccnn2C[C@H]2CCOC2)CC1	1325803648	OHLFEICNJYJVTG-CQSZACIVSA-N	436.513	1.719	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)NCCC(=O)N2CCC[C@@H](C)C2)c2ccccc2c1=O	1346759460	DEMDMXPJZNHXPD-OAHLLOKOSA-N	442.520	1.570	50	20	IDGD	
Cc1cc(C)n2ncc(C(=O)N3CC[C@]4(C3)CN(C(=O)C(Cl)Cl)CCO4)c2n1	1777781237	XNTBIUKNCXMYQQ-SFHVURJKSA-N	426.304	1.593	50	20	IDGD	
O=C(c1cccc2c1OCCO2)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1777835194	DOHBVKSWMMPZFK-MAUKXSAKSA-N	443.269	1.592	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4nncn4c3)C2)C1	1778600224	GWRQYFLSQMIVFH-KDOFPFPSSA-N	436.310	1.346	50	20	IDGD	
Cc1cc(C)cc(C(=O)N2CC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c1	1780690327	SSRAILAYDAPPKA-QHCPKHFHSA-N	437.500	1.059	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(Cl)cc3)C2)C1	1780718639	WDGZGPRWDHVLRQ-OAQYLSRUSA-N	443.891	1.096	50	20	IDGD	
C[C@](O)(C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Br)C1)C(F)(F)F	1780771305	ZJXHFSPDFZRBHI-XYHOJCAOSA-N	449.239	1.504	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)C3(N4CCN(C)CC4)CC3)C2)C1	1781106349	PVOBANHNPJBKGC-YLJYHZDGSA-N	426.989	1.004	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1Cc3[nH]nc(C(F)(F)F)c3C1)CCO2	1781220395	ZPUAWUBFZMFFCA-FNFWKMNBSA-N	448.873	1.991	50	20	IDGD	
Cc1cnc2c(C(=O)N3CCO[C@]4(CCN(C(=O)[C@@](C)(Cl)CCl)C4)C3)cnn2c1	1781230625	WJRARXNYJAFNGS-RBUKOAKNSA-N	440.331	1.718	50	20	IDGD	
O=C(c1cc2ccccn2n1)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781329645	IGRJAOBXINKLOG-PBHICJAKSA-N	425.258	1.468	50	20	IDGD	
O=C([C@@H](F)Br)N1CC[C@]2(C1)CN(C(=O)C(Cl)(Cl)Cl)CCO2	1781332935	GGWOPLKXVQJUNH-XCBNKYQSSA-N	426.497	1.877	50	20	IDGD	
COc1cc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](F)Br)C3)C2)ccc1O	1781334409	NLANWXAUPDQAHA-YOEHRIQHSA-N	431.258	1.535	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(F)c(F)c3OC)C2)C1	1781846540	HCVHPJXAPKBPOH-YJYMSZOUSA-N	432.851	1.671	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(CCN(C(=O)c3c(F)ccc(O)c3F)C2)C1	1781931536	HBKXJAOEQNLOAL-IBGZPJMESA-N	428.508	1.965	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3n[nH]c4ccc(C#N)cc34)C2)C1	1782197810	DHWJDLJMHWLKQU-QRWLVFNGSA-N	431.880	1.132	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(C)(C)CCl)C2	1782210107	FLUQKSMNNKQYTD-FOIQADDNSA-N	430.977	1.138	50	20	IDGD	
COC(=O)[C@H]1CC[C@@H](C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)C(Cl)Cl)C2)C1	1782214166	MMGALLAURVNWGA-ZYKCCNLVSA-N	435.348	1.893	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H]2CCNC(=O)C2)C1	1782267566	HGYYIGDLEBTBSL-NRTGNBEESA-N	444.370	1.058	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(CCN(C(=O)c3ccnc4ncccc34)C2)C1	1782337498	QCSRGRZRTCOTIH-LJQANCHMSA-N	433.306	1.858	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1Cc3ccccc3O1)CCO2	1783349648	QESBCKLUOLGXHC-KNBMTAEXSA-N	437.334	1.994	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cnn4c3OCCC4)CCO2)C1	1783353219	NPZPTIRQHHITJU-RDTXWAMCSA-N	441.326	1.283	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cn4c(F)cccc4n3)CCO2)C1	1783538539	XYTJRBGLJMOYLW-XIKOKIGWSA-N	439.285	1.700	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3cn[nH]c3)[C@H]2C1	1785281160	ZYNDKMDIFINRCT-VGWMRTNUSA-N	427.343	1.496	50	20	IDGD	
CCn1nc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](Cl)COC)C[C@@H]32)c2ccccc21	1787216747	NIWPPPVBLPAKTC-XPYUAMARSA-N	448.951	1.903	50	20	IDGD	
C[C@H](CBr)C(=O)NC1(c2ccc(NC(=O)CC[C@@H](N)C(N)=O)cc2)CCC1	1788054596	JVYJQTOOZAMEME-IUODEOHRSA-N	439.354	1.744	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Cl)C[C@@H]32)C1	1788114511	JBCXKUPWFQANAR-CYUUQNCZSA-N	433.908	1.367	50	20	IDGD	
COc1ccc2oc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)[C@H](O)CCl)C[C@@H]43)cc2c1	1788275968	IZVPJONUJZSKLV-XJTZBENFSA-N	436.892	1.634	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)C(Cl)Cl)CCC2)cc1)c1cc(=O)n2[nH]nnc2n1	1788410484	XZECVTKPKLYNND-UHFFFAOYSA-N	436.259	1.364	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C[C@H](N)c3cccnc3)C[C@@H]21	1789866270	MUXFANMXDMEWEV-LLYLOPHFSA-N	443.375	1.688	50	20	IDGD	
Cc1cccc(CCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]3C2)n1	1789922052	DEUDMGWVIJHXPI-OWIUFQIYSA-N	442.329	1.993	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnn4ccccc34)C[C@@H]21)[C@H](F)Br	1789922702	LMAOYKSCPOUXRE-MZGVZZPPSA-N	439.285	1.618	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccn4nccc4c3)C[C@@H]21)[C@@H](F)Br	1789925265	CWRIFUBXRWAPJV-QCEMKRCNSA-N	439.285	1.618	50	20	IDGD	
CCOC(=O)N[C@H](O)C(=O)NC1(c2ccc(NC(=O)[C@H](F)Br)cc2)CCC1	1790536332	PIAVKGRWHUTPAI-GXTWGEPZSA-N	446.273	1.876	50	20	IDGD	
O=C(NC1(c2ccc(NC(=O)c3cnn4c3CCC4)cc2)CCC1)c1ccc(B(O)O)cc1	1790887837	DVKVYYOPVPOSKY-UHFFFAOYSA-N	444.300	1.571	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3cccc(F)c3F)[C@H]2C1	1790983594	REGRVCDBTUSLFZ-JKQORVJESA-N	430.879	1.741	50	20	IDGD	
CC(C)c1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](C)Br)[C@H]3C2)n[nH]1	1791058699	CJCPNFRRPZPIMU-QCQGSNGOSA-N	427.343	1.910	50	20	IDGD	
Cc1c(Cl)cccc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCC(=O)NN(C)C)C2	1792675738	UFXRTGBICDENPQ-YVWYUNDQSA-N	436.940	1.225	50	20	IDGD	
Cc1ccc(OCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)CBr)cc1	1792867862	NJZBAZNFDMAFQD-GGXPGOJBSA-N	439.350	1.994	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCl)c1ccc(N2CCCOC2=O)cc1	1793114450	GVYGEBIELNXDBM-BZZMCLGOSA-N	435.908	1.885	50	20	IDGD	
COc1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](O)CCl)c(F)c(OC)c1F	1793114855	NHRIKUIAJPYMGK-NOHGZBONSA-N	432.851	1.834	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCl)[C@H](O)c1cccc(Br)c1	1793115798	ZGYGVRZUWLFHOO-XFIYOXNOSA-N	445.741	1.720	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C13CC(C1)C3)C2	1793882314	GWUXCZJOGYJDPK-OZVZFPLOSA-N	441.956	1.508	50	20	IDGD	
Cc1nn(-c2ccccc2)c(O)c1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2	1794327887	XHNITWAKWYNOMW-DLTLXFJOSA-N	436.871	1.624	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](O)c1ccccc1	1795386087	KYMQCHYWLBKTCJ-BQJWPVKWSA-N	425.323	1.483	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cn1cc(Cl)cn1	1795758422	XGZFORJREHTLGX-OHTBPHCPSA-N	433.734	1.157	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)c1cc(Cl)cc(Cl)n1	1796188885	XLHBRKUQSNXYNN-MUJYYYPQSA-N	448.115	1.634	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)c1cccc(F)c1Cl	1796189525	YJPIDNJGSONXLC-MUJYYYPQSA-N	430.672	1.725	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc2c1OCC2	1796797293	POKOTBNRFJRJHY-FSDCSDTHSA-N	437.334	1.998	50	20	IDGD	
COc1cc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CO[Si](C)(C)C)ccn1	1797952675	GCLKQRKBCQYZLV-UPHUGPLXSA-N	435.597	1.464	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(-c2ccncc2)[nH]n1	1798149849	SBDJUDSGSHXKFX-MBMVNNNZSA-N	448.321	1.458	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(OC)cc1OC	1798824201	SVUYFQPTYMNPRD-VLWCASSMSA-N	426.897	1.161	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1(C)CN(C(=O)OC(C)(C)C)C1)C2	1799268276	SOCMKSLUJOWBMZ-QKPAOTATSA-N	443.972	1.850	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cccc([N+](=O)[O-])c1)C2	1799274041	YGTPAVVRKVJWEH-CSHUHZATSA-N	444.315	1.963	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1Cc2ccccc2N1	1800318595	JPRZGUGALAJWKT-BXNDMCELSA-N	426.344	1.849	50	20	IDGD	
CC(C)(C)OC(=O)N1CC2(C[C@H]2C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Cl)C3)C1	1800707608	GQUMJAPYQJHYFT-AICCOOGYSA-N	445.919	1.367	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(=O)c1ccc(C)cc1	1800884995	KOCMAGKLKPQQQK-YVSFHVDLSA-N	437.334	1.941	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(-c3ccccc3)no1)C2	1800976688	CEGUEZPUWSKAGU-YYAJDYIMSA-N	433.892	1.799	50	20	IDGD	
CC[C@H](NC(C)=O)C(=O)NC[C@@H]1CCN(C(=O)CO[Si](C)(C)C)[C@H]1c1cccnc1	1802547618	HHSXBRODLKQMMF-BJLQDIEVSA-N	434.613	1.854	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)nn1C(F)F	1803140350	DJTSMPTWTLNOMJ-BMFZPTHFSA-N	441.866	1.901	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)cc1	1803146762	PUHQBXSISGXHRY-YZGWKJHDSA-N	444.919	1.959	50	20	IDGD	
Cc1cnc(C(=O)NC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)s1	1805245109	RNWDGJZNQHMSAL-QFBILLFUSA-N	444.561	1.539	50	20	IDGD	
Cc1ccc(C(=O)NC[C@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)cn1	1805459853	NJQMHBJTWMPKGP-XMSQKQJNSA-N	438.532	1.478	50	20	IDGD	
COc1cnc(C(=O)N2CC[C@@H](CNC(=O)CCBr)[C@H]2c2cccnc2)cn1	1806339685	QKGFJSDKDQDGAS-KBXCAEBGSA-N	448.321	1.985	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H]2CC=CCC2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807359058	DJPRWNIGCOMOBW-KAGYGMCKSA-N	433.317	1.437	50	20	IDGD	
CCc1ccc(C(=O)N2CCCC3(CCN(C(=O)c4ccc(B(O)O)cc4)CC3)C2)cn1	1808013740	KOPGLHJNYLXTDZ-UHFFFAOYSA-N	435.333	1.482	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)[C@H]2CCCS2(=O)=O)[C@H]1c1cccnc1	1808277313	BTLAFVMUTRCLDN-NXOAAHMSSA-N	427.954	1.682	50	20	IDGD	
CC(=O)OC[C@H](OC(C)=O)C(=O)N1CC[C@H](CNC(=O)[C@H](F)Cl)[C@@H]1c1cccnc1	1808313809	PUKHSXFNMQEATL-QZWWFDLISA-N	443.859	1.117	50	20	IDGD	
COc1cccc(CC(=O)N2CCCC3(CCN(C(=O)CCC(=O)NN(C)C)CC3)C2)c1	1809246708	AVTQXBFHUUIMGZ-UHFFFAOYSA-N	444.576	1.842	50	20	IDGD	
Cc1csc(C(=O)N2CCC3(CCCN(C(=O)c4ccc(B(O)O)cc4)C3)CC2)c1	1809969648	ZGZDJOXGXYLPGR-UHFFFAOYSA-N	426.347	1.895	50	20	IDGD	
CC(C)c1cc(C(=O)N2CCC3(CCCN(C(=O)c4cccc(B(O)O)c4)C3)CC2)on1	1809978035	PGGZAVXBAYDVSY-UHFFFAOYSA-N	439.321	1.636	50	20	IDGD	
Cc1cc(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)ccn1	1810788234	VKIBWBVFHLFSFQ-UNMCSNQZSA-N	444.300	1.098	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](N)c2ccccn2)[C@H]1c1cccnc1	1812864338	OIFWPJOHOLPCAV-IKICRFKJSA-N	446.349	1.966	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)[C@H](C)N2C[C@H]3C[C@H]3C2)[C@@H]1c1cccnc1	1813030987	IITYWEZOYIGCNG-OAUQMPPISA-N	434.968	1.681	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)[C@@H]2CC=CCC2)[C@H]1c1cccnc1	1813068402	MJXGRSSFJUYNMK-JUXOCIIHSA-N	427.549	1.817	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)[C@H]2CCC=CO2)[C@@H]1c1cccnc1	1813074529	UCYZOAOZNHWQCT-WAOWUJCRSA-N	429.521	1.153	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)CCn2cncn2)[C@H]1c1cccnc1	1813321761	PDUGSDAFXSDWCB-XYJFISCASA-N	449.353	1.943	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)C2(F)CCC2)[C@H]1c1cccnc1	1813684222	NRCMXQVSXOZBJV-CRAIPNDOSA-N	440.479	1.292	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)[C@H]1CCC(F)(F)C1	1814386672	FEQTZLBZGGHLLN-WMLDXEAASA-N	446.263	1.831	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)C1CCCCC1)CC2)c1cccc(B(O)O)c1	1815355462	SBZKSLGMUQDDPY-MRXNPFEDSA-N	427.335	1.629	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cncc(F)c2)n[nH]1	1816533214	DECKRZWQWCTNIF-MRXNPFEDSA-N	431.472	1.623	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H]2CCC(=O)N2)n[nH]1	1817089998	FWWAXAHEBSLCQJ-LOWVWBTDSA-N	426.315	1.854	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@H](O)c2ccccc2)[nH]n1)c1cccc(B(O)O)c1	1817473457	VEDMAWIVNDHCPO-TZIWHRDSSA-N	448.288	1.129	50	20	IDGD	
CCOC(=O)N[C@H](O)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](C)Br)[nH]n1	1819244458	VDGCKBURINIDOG-NURSFMCSSA-N	446.302	1.250	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)C2=CCCS2)[nH]n1	1819401448	BMWJKMFSGATVHI-OAHLLOKOSA-N	441.517	1.735	50	20	IDGD	
C[Si](C)(C)OCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)Cn1ccccc1=O)CC2	1820162808	RKPVKPHWTXLLLG-ZDUSSCGKSA-N	434.594	1.769	50	20	IDGD	
CCc1nc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)CCC(=O)NN(C)C)CC3)co1	1820755137	HOCSNSNTQXHZJQ-NSHDSACASA-N	434.522	1.292	50	20	IDGD	
CN1CCN(CC(=O)N2CCCC[C@@H]2c2cc(NC(=O)[C@](C)(Cl)CCl)n[nH]2)CC1	1820865788	BRWHXRPPFNJUCH-DNVCBOLYSA-N	445.395	1.886	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)Cn2ccncc2=O)n[nH]1	1821656942	SLXYNXDBMIBHFA-ACJLOTCBSA-N	441.319	1.895	50	20	IDGD	
C[C@H](Br)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CN2C(=O)C=CC2=O)[nH]n1	1822193074	ZYDXXHMTXUFUCR-CMPLNLGQSA-N	438.282	1.110	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H]2C[C@@]2(F)Cl)n[nH]1	1822507242	MHZYMODMDKGMMB-SRBZOADZSA-N	428.896	1.699	50	20	IDGD	
CC(C)c1cc(C(=O)N[C@@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)n[nH]1	1826088727	LGTAMYYRTWQKEZ-GFCCVEGCSA-N	447.565	1.588	50	20	IDGD	
Cc1ccn(C)c1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827056039	AFPYOOQTEBPUTO-NRFANRHFSA-N	437.349	1.560	50	20	IDGD	
Cc1nccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)n1	1827059489	RFTUPCBPFVECSX-OAQYLSRUSA-N	436.321	1.012	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)n2)CC1	1827602730	UFNRKMBHRJITCT-DZGCQCFKSA-N	426.901	1.375	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830353573	FUGRLDJBTVSLBZ-DYVFJYSZSA-N	439.778	1.739	50	20	IDGD	
O=C(CN1CCCC1=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H](F)Br)CC1	1830374590	IZPFDCJXSLXLLJ-YOEHRIQHSA-N	432.334	1.919	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H](F)Br)CC1	1830378045	HPSVENLOCJBORM-BFHYXJOUSA-N	435.338	1.744	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(C)nc3OC)C2)C1	1831652280	XODDBDKHXLIPCE-LAUBAEHRSA-N	439.940	1.876	50	20	IDGD	
Cc1cc(CC(=O)N2CCCC[C@@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)no1	1832135936	UITIPEJPEFNGHG-LJQANCHMSA-N	433.553	1.518	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H]3C[C@@H]3c3ccccc3)CC2)CC1)[C@@H](O)CCl	1833312878	JXVSBXVCRZGDAC-NJYVYQBISA-N	433.980	1.961	50	20	IDGD	
CC1(C(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)CCCC1	1834800657	WBKDYYGNIKPUSQ-UHFFFAOYSA-N	441.381	1.132	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)COc3ccccc3)CCO2)C1	1834953961	HMLYZXAYLJUVEM-WOJBJXKFSA-N	445.343	1.758	50	20	IDGD	
N[C@H](CC(=O)N1CCC(N2CCC(NC(=O)[C@@H](F)Cl)CC2)CC1)c1cccnc1	1835080344	QDGMKXSVLVBYNF-IEBWSBKVSA-N	425.936	1.578	50	20	IDGD	
C[C@@H](Nc1cnccn1)C(=O)NC1CCN(C2CCN(C(=O)C(Cl)Cl)CC2)CC1	1835750492	LOJLMJPUNDIAFA-CYBMUJFWSA-N	443.379	1.652	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@@](C)(O)C(F)(F)F)CC2)CC1	1837018759	PFGZKCDSVCTTGX-WMLDXEAASA-N	444.878	1.552	50	20	IDGD	
O=C(O)c1cc(C(=O)N2CCC(OC3CCN(C(=O)[C@H](F)Cl)CC3)CC2)ncn1	1837289311	VWNZGSKJCFQKCA-HNNXBMFYSA-N	428.848	1.321	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)C/N=C/c3ccco3)CCO2)C1	1837566740	JNWUEFIORDGASU-JBWYVXEHSA-N	446.331	1.391	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(C#N)ccc3F)C2)C1	1837714378	AYXTZNXBXQDBSR-OAQYLSRUSA-N	449.555	1.619	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3nccnc3C(N)=O)CC2)CC1	1838508451	PCVLCFSGMMVIPM-HNNXBMFYSA-N	437.928	1.205	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3noc(C(C)C)n3)C2)C1	1839142675	VRWSQRBSHDLRFN-IFXJQAMLSA-N	428.917	1.209	50	20	IDGD	
Cc1cnn([C@H](C)C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)c1	1839155193	NLPZHMVSKNNYRU-ATZDWAIDSA-N	447.363	1.445	50	20	IDGD	
Cc1csc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)c1	1839198767	NOZQGAJIDXBSMR-CZUORRHYSA-N	435.315	1.817	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H](F)Br)CCO2)C1	1839199426	WHKYSXRGGSRCNG-ZOWXZIJZSA-N	429.714	1.541	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccn(CC)n3)C2)C1	1839963524	NHEIZROXKAUZKB-KDOFPFPSSA-N	443.342	1.147	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(F)c[nH]3)CCO2)C1	1840063854	QFANASFFJXPWIP-SJKOYZFVSA-N	432.290	1.255	50	20	IDGD	
C[C@H](C(=O)N1CCOC[C@@]2(CN(C(=O)C(Cl)Cl)CCO2)C1)c1ccc(O)cc1	1840189316	KUIOJYBWIWNLMU-DJJJIMSYSA-N	431.316	1.756	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(C)cc(Cl)c3)CCO2)C1	1840699597	OYGPAXCZDQYZCT-FXAWDEMLSA-N	445.343	1.972	50	20	IDGD	
CC(C)(C)OC(=O)N1CCCC[C@@H](C(=O)N2CC3(CCCN3C(=O)[C@@H](O)CCl)C2)C1	1841354796	WRNCISNDODKEFU-CVEARBPZSA-N	443.972	1.827	50	20	IDGD	
Cc1occ(C(F)(F)F)c1C(=O)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843011366	VWFYAXMXYZOGPN-UHFFFAOYSA-N	436.195	1.417	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC12CN(C(=O)C1(c3cccc(Cl)c3)CC1)C2	1843014010	NELWKAYJZPTXDN-UHFFFAOYSA-N	438.720	1.569	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)Cc2noc3ccccc23)C1	1843030346	NZUQGDRKKSWQBI-MFKUBSTISA-N	448.483	1.708	50	20	IDGD	
CCC(=O)N[C@H](C)C(=O)N1CC2(CCCN2C(=O)c2cc([N+](=O)[O-])ccc2OC(C)=O)C1	1844692000	WXEUEKNLYBAMRP-CYBMUJFWSA-N	446.460	1.252	50	20	IDGD	
Cc1occc1C(=O)N1CC2(CCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)C1	1845038529	ONPLHRWOGDLHFH-UHFFFAOYSA-N	439.516	1.751	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2ccc3nn(C)cc3c2)C1	1845598741	WJHCMYFFXUHJCK-MFKUBSTISA-N	447.499	1.524	50	20	IDGD	
O=C([C@@H](Br)Cc1ccccc1)N1CC2(CCCN2C(=O)CCn2cncn2)C1	1846547366	WBWDYCDCQPOBQQ-KRWDZBQOSA-N	446.349	1.878	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H]1C[C@H]1c1ccc(F)cc1	1847457906	UVIXBRRPTBOUKV-HNJRGHQBSA-N	437.475	1.443	50	20	IDGD	
Cc1cccc(C)c1N1C[C@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](O)CCl)CC1=O	1847556244	FVLHEYRICTYPEM-OWSLCNJRSA-N	433.936	1.458	50	20	IDGD	
CC(=O)N/C(=C\c1ccccc1)C(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12	14889748	NFDCHWYKJVQXRQ-UYRXBGFRSA-N	433.468	1.916	50	20	IDGD	
Cc1ccc(C)c(S(=O)(=O)NCCC(=O)NNC(=O)Cc2nc3ccccc3n2C)c1	22616091	PGEBBOXLJGUKCU-UHFFFAOYSA-N	443.529	1.249	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNS(=O)(=O)c1ccc2c(c1)C[C@H](C)N2C(C)=O	28679106	XETUXXSKNSIMNC-AWEZNQCLSA-N	447.513	1.771	50	20	IDGD	
CCCS(=O)(=O)N1CCCC[C@@H]1C(=O)NNC(=O)c1ccc(OC(C)C)c(OC)c1	108756782	QRIYNAPHWNFBMQ-MRXNPFEDSA-N	441.550	1.838	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NCc2cccc(C(=O)NCCN(C)C)c2)cc1C	727603769	FRJYNBNZEWSJJE-UHFFFAOYSA-N	441.532	1.504	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)Cc2csc(-c3ccc(C)o3)n2)n1	728723786	VTCRZQFLZANCOU-UHFFFAOYSA-N	434.499	1.952	50	20	IDGD	
CC[C@H](NC(=O)NNC(=O)c1ccc(OC)c(OC)c1)c1cccc(S(N)(=O)=O)c1	729222921	ZCTRXEIKTIFZRR-HNNXBMFYSA-N	436.490	1.447	50	20	IDGD	
O=C(NCCCCN1CCN(c2ncccn2)CC1)NNC(=O)c1c[nH]c2ccccc12	729233385	OMHDJXDNMSGRGE-UHFFFAOYSA-N	436.520	1.504	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)N[C@@H](C)[C@@H](C)N2CCOCC2)c1	729624748	ZALBMBKIMZCKGU-NWDGAFQWSA-N	429.315	1.511	50	20	IDGD	
COc1ccc([C@]2(C)NC(=O)N(CC(=O)NNC(=O)c3cccc4ncccc34)C2=O)cc1	730227796	NEGSLDSCTAFXOY-QHCPKHFHSA-N	447.451	1.472	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	730829835	VIIRUIOAVXHUKI-OAHLLOKOSA-N	444.492	1.921	50	20	IDGD	
O=C(NC[C@@]1(O)CCCc2ccccc21)NNC(=O)c1csc(N2CCOCC2)n1	731358125	FJORGZMCSLLWCA-FQEVSTJZSA-N	431.518	1.148	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)NCc1ccc(Cl)cc1)c1cccc(S(N)(=O)=O)c1	732991316	CVURPPIFTXFDEO-LLVKDONJSA-N	425.898	1.762	50	20	IDGD	
O=C(NN=c1cc[nH]c2ccccc12)[C@@H]1CCCN1S(=O)(=O)c1cccc([N+](=O)[O-])c1	732999317	FCYCYIXMVCOLMD-IBGZPJMESA-N	441.469	1.861	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN(C(=O)COc2ccccc2)C1)c1nnc(O)c2ccccc12	741206700	CVBDXDIRMQNWNI-HNNXBMFYSA-N	449.467	1.414	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)CN(C[C@@H]2CCCO2)C(=O)OC(C)(C)C)C[C@@H](C)O1	743290065	ABDZLOOIRQDMFA-ZACQAIPSSA-N	442.557	1.049	50	20	IDGD	
COCCOCc1cc(C(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)ccc1F	743831387	WFCPQEUHDGWWLJ-UHFFFAOYSA-N	439.465	1.859	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1C	744407111	LJKLBUZYZRBYGC-CYBMUJFWSA-N	432.506	1.870	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)CCNC(=O)N2CCc3ccccc3C2)c1	745058119	PNWANDASMCWOPN-UHFFFAOYSA-N	438.484	1.457	50	20	IDGD	
C[C@@H](CCc1cccn1C)NC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	745876308	YKUFXUQTKIQQLA-IBGZPJMESA-N	426.565	1.889	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)N[C@H]2C[C@@H](C)N(c3cnn(C)c3)C2=O)c1	745917987	MNINQRGASDAPKC-QAPCUYQASA-N	442.520	1.755	50	20	IDGD	
CCOc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)N3CCOCC3)c2)cc1	745992606	FPUXSURAJSJXPA-UHFFFAOYSA-N	448.501	1.573	50	20	IDGD	
C[C@@]12CCC(=O)N1c1ccccc1C(=O)N2CC(=O)NNC(=O)COc1ccc(C#N)cc1	746580248	TXSPPZPTBWYIHN-QHCPKHFHSA-N	447.451	1.083	50	20	IDGD	
O=C(CN1CCN(C(=O)OCc2ccccc2)CC1)NNC(=O)c1cc2c(s1)CCC2	747345336	MJANAAXOAQEHDX-UHFFFAOYSA-N	442.541	1.952	50	20	IDGD	
Cc1[nH]nc(C(F)(F)F)c1C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	748618877	IPHWRZGVHONSMP-UHFFFAOYSA-N	446.455	1.430	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)NCc1ccc(-n2ccc(C(F)(F)F)n2)cc1	748624707	JHHGJHIRDKMDDC-GFCCVEGCSA-N	429.399	1.773	50	20	IDGD	
COC(=O)Cc1cc(=O)n(-c2ccc(C(=O)NNc3cccc([N+](=O)[O-])c3C)cc2)[nH]1	748665583	FQKNOOHOTPKHKZ-UHFFFAOYSA-N	425.401	1.855	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)NCC2CCN(S(C)(=O)=O)CC2)c(C)n1C[C@H]1CCCO1	748668352	YMTDFTHMKSAPHQ-FVIRYLMMSA-N	448.589	1.979	50	20	IDGD	
CC(C)(C)C(=O)c1ccc(S(=O)(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1	749144803	YCCQOHAMOOKJNZ-UHFFFAOYSA-N	428.474	1.514	50	20	IDGD	
O=C(NCc1ccnc(OC2CCCCC2)c1)NNC(=O)c1ccc(-n2cnnn2)cc1	749422135	FLOCPYZKQWPVAP-UHFFFAOYSA-N	436.476	1.913	50	20	IDGD	
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	749581710	BNELUMJIIQWAJF-UZLBHIALSA-N	448.527	1.788	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CC2CCCC2)cc1S(=O)(=O)N1CCOCC1	749951695	NANWCQDENXGINR-UHFFFAOYSA-N	425.507	1.057	50	20	IDGD	
O=C(NNc1c(F)cc(F)cc1Br)[C@@H]1Nc2ccccc2S(=O)(=O)N1	750046654	GIFPZJCLXLBJIP-CYBMUJFWSA-N	433.234	1.901	50	20	IDGD	
CCn1c(=O)c(=O)[nH]c2cc(C(=O)NNc3nc(Br)cn4ccnc34)ccc21	750246932	OEYDNDHTYDQMGL-UHFFFAOYSA-N	444.249	1.272	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NNC(=O)COc2cc(C)cc(C)c2)cc1	750577549	IQDMKCRZYIDFEJ-FQEVSTJZSA-N	445.541	1.991	50	20	IDGD	
COc1cc(OC)cc(N2C[C@H](C(=O)NNC(=O)c3ccc(Cl)cc3O)CC2=O)c1	752520776	WFDGMVTYKJVQQW-LLVKDONJSA-N	433.848	1.877	50	20	IDGD	
Cc1cc(Cl)c(S(=O)(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1[N+](=O)[O-]	753069942	YTLRCPITUAGWLO-CQSZACIVSA-N	427.822	1.706	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)[C@H]1CCO[C@@H]1c1cnn(Cc2ccccc2)c1	753132399	XQORKTHGYJLKAB-RBUKOAKNSA-N	427.505	1.461	50	20	IDGD	
Cc1nc(S(=O)(=O)N2CCC(C(=O)NNc3ccc(C#N)c(Cl)c3)CC2)cn1C	753303569	XWTFJEWDHZKPJV-UHFFFAOYSA-N	436.925	1.798	50	20	IDGD	
CCn1c(=O)nc(O)c2c(C(=O)NNC(=O)c3cc(Cl)ccc3O)cc(C3CC3)nc21	754414913	CKCFFYIZEHYTCQ-UHFFFAOYSA-N	443.847	1.828	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)c2coc(S(=O)(=O)N(C)C)c2)cc1OC	755414641	DUTXNDDPSYNZRS-UHFFFAOYSA-N	439.490	1.792	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1ccccc1CN(C)C1CCCCC1	755425751	QXLVDXFVLMMSEC-CQSZACIVSA-N	425.555	1.542	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)Nc2cccc(S(=O)(=O)NC3CC3)c2)c1	755585052	GETDUVNFPPIEPG-UHFFFAOYSA-N	434.474	1.611	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)Nc1cccc(OCC(=O)N2CCCC2)c1	755657623	RHHMVUUNCBINQX-IBGZPJMESA-N	440.456	1.681	50	20	IDGD	
CCOC(=O)c1cc2cc(NC(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)ccc2s1	755862029	MFWGGYJWWXAWKX-JTQLQIEISA-N	425.488	1.665	50	20	IDGD	
CN(C)C(=O)COc1cccc(NC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)c1	755960817	SXOPNPQTATZNAF-UHFFFAOYSA-N	438.444	1.511	50	20	IDGD	
Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O	756335602	IXDJJGBQLRFSCA-CQSZACIVSA-N	445.501	1.536	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)Nc2cc(C3CC3)nn2[C@H]2CCS(=O)(=O)C2)c(O)c1	756856427	PMLJQTPLTPOPJB-ZDUSSCGKSA-N	433.490	1.601	50	20	IDGD	
CCOC(=O)c1cc(Br)cc(S(=O)(=O)NNC(=O)NCCCOC)c1	756935967	JFYLIGHTDPRACI-UHFFFAOYSA-N	438.300	1.155	50	20	IDGD	
Cc1cnn(-c2ccc(C(N)=O)cc2NC(=O)NNC(=O)c2c(C)nc3ccccn23)c1	757875064	KVCLQVLGRDKWMX-UHFFFAOYSA-N	432.444	1.702	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)Nc1ccccc1CN1CCNC1=O	757922233	ABTOYTZZZWCGSE-UHFFFAOYSA-N	428.405	1.352	50	20	IDGD	
Cc1csc(SCc2ccc(C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)cc2)n1	758036389	RIVAOPNIFCZPQU-LLVKDONJSA-N	428.561	1.443	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2ccc3c(c2)OCCO3)cnn1CCO[C@@H]1CCCCO1	758160181	UATWWGBDWNBSEG-LJQANCHMSA-N	430.461	1.581	50	20	IDGD	
O=C(Cn1cnc2ccc(Br)cc2c1=O)NNc1nc(O)c2ccccc2n1	758309490	RMVDMPSELKOIBW-UHFFFAOYSA-N	441.245	1.951	50	20	IDGD	
Cc1nn(C)c(C)c1OCC(=O)NNc1ccc(S(=O)(=O)Nc2nccs2)cc1	759096229	YEQNLBGPRIWOSG-UHFFFAOYSA-N	436.519	1.816	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)NC[C@H]1CN(Cc2ccccc2)CCCO1	759228927	JVXJKFFDPQUHIE-FQEVSTJZSA-N	436.516	1.498	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)[C@@H]2CCCN(S(=O)(=O)Cc3ccccc3)C2)nc1	759728711	HMYAAMJIAFXPMS-QGZVFWFLSA-N	432.502	1.553	50	20	IDGD	
Cc1noc(C[C@@H](NC(=O)NNC(=O)c2nnc(O)c3ccccc23)c2ccccc2)n1	759840753	MRGZDKPZEQPKKI-MRXNPFEDSA-N	433.428	1.955	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)[C@](C)(O)CN1C(=O)C(C)(C)c2ccccc21	760073495	IOWGBYIBSCGOOI-HSZRJFAPSA-N	435.484	1.479	50	20	IDGD	
O=C(COC(=O)c1cnc([C@@H]2CCCO2)s1)NNC(=O)[C@H]1COc2ccccc2O1	760673182	QDBLUASWLYFKIG-UONOGXRCSA-N	433.442	1.139	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc2c(c1)nc(CCC(=O)NNc1ncc(F)cn1)n2C	760906809	UNZKVUAUBKADDY-UHFFFAOYSA-N	449.512	1.609	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2ccnc3c(C(N)=O)cnn23)ccc1OCCC(C)C	763270299	IWHPGQGYCXZFPL-UHFFFAOYSA-N	440.460	1.337	50	20	IDGD	
Cc1ccc(NC(=O)C(C)C)cc1NC(=O)C(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	763442063	KWBBNOGVEJNVFH-UHFFFAOYSA-N	427.417	1.897	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cccc1C(=O)N1CCCC1	763468617	NZNYZFRBSAMYRH-UHFFFAOYSA-N	439.428	1.539	50	20	IDGD	
COC(=O)[C@@H](C)Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)cc1	763550536	CRKPHSMOFHFSPF-LBPRGKRZSA-N	427.413	1.167	50	20	IDGD	
CCOC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)cc1C#N	763550947	JOOFRVYMEMKALQ-UHFFFAOYSA-N	439.384	1.255	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)C(=O)Nc2cccc3c2oc(=O)n3C)c1	763597524	OGQIAHLUEZUULB-UHFFFAOYSA-N	440.456	1.728	50	20	IDGD	
Cc1ccnn1-c1ccccc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccccc2)[nH]n1	763601182	PTCZXPXXQFVDLY-UHFFFAOYSA-N	429.440	1.971	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)cnc1Br	763613256	LHNTZFKEPQSKHP-UHFFFAOYSA-N	443.261	1.942	50	20	IDGD	
Cc1ccccc1-c1cc(NC(=O)C(=O)NNC(=O)c2c(C)nc3ccccn23)n(C)n1	763628591	BFAJXHBRCYLXIM-UHFFFAOYSA-N	431.456	1.751	50	20	IDGD	
COCCn1ccc2ccc(NC(=O)C(=O)NNC(=O)c3c(C)nc4ccccn34)cc21	763630403	ZYDMYAFBGOKTBR-UHFFFAOYSA-N	434.456	1.644	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(N3CCCCC3=O)c2)cc1	763661947	QTYZATUIPPENRF-UHFFFAOYSA-N	440.456	1.377	50	20	IDGD	
CCN(CC)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2cc(C)ccc2C)cc1	763665844	PHWMEQNOKQYPRZ-UHFFFAOYSA-N	440.500	1.950	50	20	IDGD	
COCCn1ncc2ccc(NC(=O)C(=O)NNC(=O)COc3cc(C)ccc3C)cc21	763668846	RIWHVAPAGDOKTR-UHFFFAOYSA-N	439.472	1.464	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccc(-c2n[nH]c(C)n2)c1	763682360	MOFQIKNZPCCVDZ-UHFFFAOYSA-N	438.444	1.344	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccc(-c2nncn2CC)c1	763712017	JWPYXSHYCXZCTD-UHFFFAOYSA-N	436.472	1.692	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1	763808369	MOSVGXLQBMHBMC-UHFFFAOYSA-N	431.330	1.614	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(NC(=O)C3CC3)nc2)c1C	763848460	IBYMOFHKXPKHEB-CQSZACIVSA-N	439.472	1.600	50	20	IDGD	
CCCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)cc1	763848662	FLWKHEBXWGVITP-CYBMUJFWSA-N	430.436	1.519	50	20	IDGD	
CCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)c(C)c1	763851791	VONHRYSLCGNRER-ZDUSSCGKSA-N	430.436	1.437	50	20	IDGD	
CNC(=O)c1cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)ccc1Cl	763863691	AUDDIDPGSJUCEE-SNVBAGLBSA-N	436.827	1.392	50	20	IDGD	
CC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)cc1Cl	763865532	LFXDOINTXJSCGZ-JTQLQIEISA-N	436.827	1.991	50	20	IDGD	
CCn1cnnc1-c1ccccc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccc(F)cc1	763872236	LOMUQLBSXOXYNY-ZDUSSCGKSA-N	440.435	1.658	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)CCO2	763882521	JPLMSRKAYDKYQC-NSHDSACASA-N	448.273	1.937	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)C(=O)Nc2ccc(C)c(-n3cnnn3)c2)cc1	763895406	DNPJFTBMGWKCQM-UHFFFAOYSA-N	425.474	1.157	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)C(=O)Nc2ccc(F)c(-n3nnnc3C)c2)cc1	763897438	YYAWDUDZHYTGAC-UHFFFAOYSA-N	443.464	1.296	50	20	IDGD	
O=C(Cc1ccsc1)NNC(=O)C(=O)Nc1cccn(Cc2ccc(F)cc2)c1=O	764035231	QHEZJNSVRMAXKZ-UHFFFAOYSA-N	428.445	1.426	50	20	IDGD	
CN(CC(=O)NNC(=O)CSc1ccccc1O)C(=O)c1ccc(Br)o1	764047365	QYJATJRCOXVUQJ-UHFFFAOYSA-N	442.291	1.759	50	20	IDGD	
CCn1cc(NC(=O)C(=O)NNC(=O)c2ccc(Br)cc2Cl)ccc1=O	764058451	ILIHSZPROJQJNZ-UHFFFAOYSA-N	441.669	1.684	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)N2CC3(CCC3)c3c(F)cccc32)c1	764078304	QKDJHDDUCJFKHJ-UHFFFAOYSA-N	445.472	1.459	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(Cl)cc2C(=O)N2CCCC2)c(O)c1	764105581	VTVHMFGHHBTDRY-UHFFFAOYSA-N	444.875	1.990	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)c2cc(C)[nH]n2)sc2c1CC[C@@H](CC)C2	764106331	JHSAFGHSWDQJDG-LLVKDONJSA-N	447.517	1.871	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccc(C(=O)NC2CCCC2)cc1	764138682	HUPYNAZDPBVDSL-UHFFFAOYSA-N	438.484	1.696	50	20	IDGD	
COC(=O)c1ccc(OCc2ccccc2)c(NC(=O)C(=O)NNC(=O)CC2CC2)c1	764143613	WOVHEWIBXAFLOI-UHFFFAOYSA-N	425.441	1.938	50	20	IDGD	
C=CCN(CC=C)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)cc1	764164868	UOVUWAZTIJZSIE-HXUWFJFHSA-N	448.479	1.590	50	20	IDGD	
COC(=O)[C@H](C)Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)cc1	764169096	UFJIGPKPDPFZFP-FZKQIMNGSA-N	425.441	1.128	50	20	IDGD	
C[C@@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3cccc(OC(F)F)c3)cc2)CCO1	764251173	PZBDFXWBPRBQRF-CYBMUJFWSA-N	448.426	1.913	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)C(=O)Nc1ccccc1N1CCCC1	764261049	WVFLFPSRPPDWAD-UHFFFAOYSA-N	437.504	1.079	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)C(=O)Nc1cccc(F)c1I	764267217	DCSMRNVIBPSPFM-UHFFFAOYSA-N	442.188	1.154	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1cccnc1-n1cccn1	764393587	IUJRAQGXUUFHGP-UHFFFAOYSA-N	426.458	1.154	50	20	IDGD	
O=C(NNC(=O)[C@H]1COCCO1)C(=O)Nc1ccc(OCc2cccc(F)c2)c(F)c1	764430710	ZVNLOTNECNLIBG-QGZVFWFLSA-N	435.383	1.045	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NCc2ccc(N3CCCS3(=O)=O)cc2)cc1	764771946	JCPPXSYQOSNYBQ-UHFFFAOYSA-N	432.502	1.444	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)CSc2nnc(-c3cccnc3)n2Cc2ccco2)n[nH]1	765588443	ORCOFTTUKOCPFC-UHFFFAOYSA-N	438.473	1.566	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)CCNC(=O)C3CCCCC3)CC2)cc1	765748362	CEFRKYIOKNTRQL-UHFFFAOYSA-N	443.592	1.347	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1cnc(-c2ccccc2)nc1	766636719	SHRCOCOWVGRGKB-UHFFFAOYSA-N	444.495	1.363	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1sccc1-n1cccc1	766645599	CLSOUUZFZGNAOB-UHFFFAOYSA-N	437.525	1.758	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)c1coc(C2CCOCC2)n1	767403514	NITINUSEFXPJJI-UHFFFAOYSA-N	427.505	1.542	50	20	IDGD	
O=C(COC(=O)c1ccc2c(c1)nc(O)n2CC(F)(F)F)NNC(=O)c1ccccc1	767483993	QYURZKMXJRXHAO-UHFFFAOYSA-N	436.346	1.922	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)c2ccccc2COC2CCOCC2)c2ccccc2c1=O	767729799	SHWHXQZFTXJZDO-UHFFFAOYSA-N	436.468	1.704	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3ccc([N+](=O)[O-])c(O)c3)n[nH]2)cc1OC	768278701	JOCGFEIMVDJJFA-UHFFFAOYSA-N	427.373	1.783	50	20	IDGD	
C[C@@H]1CN(c2ccc(CNC(=O)NNc3nc(O)c4cnn(C)c4n3)cc2F)C[C@@H](C)O1	770352091	UEDGOPKJHQYRBW-VXGBXAGGSA-N	444.471	1.648	50	20	IDGD	
COC1CCN(C(C)(C)CNC(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)CC1	770395188	GWSVGQMTPIXHPP-UHFFFAOYSA-N	434.545	1.802	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	771880666	ADZGCUSZXMAZSZ-HNNXBMFYSA-N	439.534	1.600	50	20	IDGD	
CCCCn1ncc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)c1C	772477263	PZRHVFQZNGOLQJ-UHFFFAOYSA-N	426.521	1.211	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@@H](C)C(=O)NNC(=O)[C@H](C(C)C)N1CCCS1(=O)=O	772629276	DCROVMCYBKHQMK-HOCLYGCPSA-N	445.969	1.932	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)CN1C(=O)c2ccccc2S1(=O)=O	772973119	ZTEFSIPUZQDHIB-LLVKDONJSA-N	437.861	1.099	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)CCCOc2ccc(S(C)(=O)=O)cc2)c1	773082196	SFWJADHGSSEBKJ-UHFFFAOYSA-N	434.474	1.064	50	20	IDGD	
O=C(COC(=O)Cc1ccnc(O)c1Br)NNC(=O)c1cccc(Cl)c1	773637040	LKHJXIPVQSQUPX-UHFFFAOYSA-N	442.653	1.750	50	20	IDGD	
COc1ccc(NC(=O)/C(C#N)=C/c2ccc(O)cc2)cc1S(=O)(=O)N1CCOCC1	776595551	GXNIUQCJYLKUDS-FOWTUZBSSA-N	443.481	1.967	50	20	IDGD	
CCCC[C@@H](/N=C1/NS(=O)(=O)c2ccccc21)C(=O)NNc1cc(Cl)nc(N)n1	779376301	CSNXZVMUEBFEEC-LLVKDONJSA-N	437.913	1.453	50	20	IDGD	
COC(=O)c1cn(C2CN(C(=O)/C(C#N)=C\c3cc(C)n(C[C@@H]4CCCO4)c3C)C2)nn1	779550253	UQNXBWVKCHIFII-IABUVPNTSA-N	438.488	1.653	50	20	IDGD	
Cc1nn([C@@H]2CCS(=O)(=O)C2)c(C)c1C=NNC(=O)CCNC(=O)OC(C)(C)C	779807701	KVUJEZPADCGWPL-CQSZACIVSA-N	427.527	1.224	50	20	IDGD	
CC(=O)N1CCN(Cc2cccc(NC(=O)C(=O)NNc3ccc([N+](=O)[O-])cc3)c2)CC1	782124513	PKXKYWBJERPPAY-UHFFFAOYSA-N	440.460	1.341	50	20	IDGD	
Cc1cc(Br)c2oc(C(=O)NNC(=O)N[C@H]3CCS(=O)(=O)C3)cc2c1	782550428	NHQOWWKCVIKEGT-JTQLQIEISA-N	430.280	1.635	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)c3cccc(NS(=O)(=O)C(F)(F)F)c3)nc21	782706026	GEWVEYHRPTXPOH-UHFFFAOYSA-N	431.356	1.087	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C(=O)Nc2c(F)c(F)c(F)c(F)c2F)nc2ccccc21	782894626	QXPSJJRNCISTDT-UHFFFAOYSA-N	441.316	1.597	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2cc(Cl)ccc2N2CCCCC2)CCS(=O)(=O)C1	783425978	KURDUEVIEXNPFD-GOSISDBHSA-N	428.942	1.467	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CCCCCC1=NNC(=O)CSc1nnc(O)nc1O	783822086	SEWIEHMNZUUAMT-SNVBAGLBSA-N	426.499	1.705	50	20	IDGD	
Cc1nnnn1-c1cc(NC(=O)C(=O)NNc2ccc(Br)nc2)ccc1F	784806843	RVABIPKYDTVWTG-UHFFFAOYSA-N	435.217	1.349	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNc2ccc(C(F)(F)F)nn2)cc1Cl	784886051	KQFJKXQMCADJLX-UHFFFAOYSA-N	447.757	1.782	50	20	IDGD	
O=C(NNc1c(F)cc(F)cc1Br)C(=O)Nc1cccnc1-n1cncn1	785009858	WFZSWTBUNISCNY-UHFFFAOYSA-N	438.192	1.785	50	20	IDGD	
COc1ccc(OC(F)F)c(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)c1	785059981	FKADMGAROURULF-UHFFFAOYSA-N	433.371	1.273	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2cc(F)cc(N3CCOCC3)c2)n1	785225991	BUIGBVHWPZSZKA-UHFFFAOYSA-N	431.472	1.380	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)N[C@H](COC)[C@@H]2CCCO2)c2ccccc2c1=O	789332467	PELAXRYOOOABFC-SJORKVTESA-N	431.493	1.335	50	20	IDGD	
CN1C(=O)Cc2cc(NC(=O)C(=O)NNC(=O)c3cc4c(s3)CCCCC4)ccc21	789732067	PDEBEIHCLIJHQH-UHFFFAOYSA-N	426.498	1.936	50	20	IDGD	
COc1c(C)cnc(Cn2cnc(NC(=O)C(=O)NNc3cccc(F)c3F)n2)c1C	789766915	DCPIBLWRJUWYMO-UHFFFAOYSA-N	431.403	1.707	50	20	IDGD	
CNS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2ccc(OC(C)C)c(OC)c2)nc1	792398449	YDAQDTQAWHSUFU-UHFFFAOYSA-N	437.478	1.252	50	20	IDGD	
CS(=O)(=O)C1(C(=O)NNC(=O)[C@H]2Cc3ccccc3CN2Cc2ccccc2)CCC1	793305147	QCTMHUIYBKMMQM-HXUWFJFHSA-N	441.553	1.728	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)C2CCN(c3ccc(C#N)cc3F)CC2)c2ccccc2c1=O	794775707	OFLYJAGBXDTXPE-UHFFFAOYSA-N	448.458	1.622	50	20	IDGD	
O=C(CN[C@H](CO)c1ccc(Br)cc1)NNC(=O)c1cccc([N+](=O)[O-])c1	794817342	WRHJZUWIVKPSAL-OAHLLOKOSA-N	437.250	1.442	50	20	IDGD	
CC(C)CNC(=O)N1CCC[C@H](CC(=O)NNc2ccccc2S(=O)(=O)N(C)C)C1	795177147	JLGHANNTKVSXGQ-MRXNPFEDSA-N	439.582	1.848	50	20	IDGD	
COC(=O)[C@H](CS(=O)(=O)NNC(=O)c1cnn(-c2ccccc2)c1)c1ccccc1	795323622	CIYWEUBUANBWIW-GOSISDBHSA-N	428.470	1.393	50	20	IDGD	
CC(C)(C)OC(=O)Nc1ncc(C=NNC(=O)CSc2nnc(O)nc2O)s1	799873486	HKDSDTNWSPDPJD-UHFFFAOYSA-N	427.468	1.329	50	20	IDGD	
O=C(NNC(=O)C1(c2ccc(I)cc2)CC1)C(=O)N1CCCC1	800473372	UIXOSKWKELBGHM-UHFFFAOYSA-N	427.242	1.093	50	20	IDGD	
O=C(NNc1nc(-c2cccnc2)no1)c1ccc(F)c(S(=O)(=O)N2CCOCC2)c1	801154211	ZINCLFPSOUOQAM-UHFFFAOYSA-N	448.436	1.049	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C[C@@H]1COCCN1C(=O)OC(C)(C)C	802937890	HYMFIWHMFWMNEA-CQSZACIVSA-N	439.534	1.961	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N2CCOC[C@@H]2[C@@H]2CCCO2)cc1Br	805104483	SRDJBXRFJNEOID-HIFRSBDPSA-N	428.283	1.692	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)NCCCn1cc(Br)cn1	807611926	DAUMRROVBGKXGS-UHFFFAOYSA-N	441.242	1.353	50	20	IDGD	
CC(C)OCCCn1c(NNC(=O)c2cnc3[nH]c(O)nc3c2)nc2ccccc2c1=O	809667003	OROYQGSHBUXXCG-UHFFFAOYSA-N	437.460	1.945	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(-n2ccc(C(F)(F)F)n2)cc1	810387099	FQUVBEFDEWQSNS-NSHDSACASA-N	443.382	1.029	50	20	IDGD	
COc1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2cccc3ccccc23)cc1OC	810433522	KBZGIPIHWQTTGP-UHFFFAOYSA-N	443.481	1.597	50	20	IDGD	
N#Cc1ccc(S(=O)(=O)NCC(=O)NNc2nc(-c3ccccn3)nc3c2CCC3)cc1	810442373	QSIIHSQENHXDIF-UHFFFAOYSA-N	449.496	1.321	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)CNC(=O)c1ccco1)c1ccc(N2CCCNC2=O)cc1	812881934	HOKDUNBXHMNYCF-CYBMUJFWSA-N	428.449	1.021	50	20	IDGD	
COC(=O)c1cc(C=NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)on1	814732430	LYCFOELRTGCMRJ-UHFFFAOYSA-N	431.408	1.983	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(Br)c(C#N)c2)c1	815565591	UMTLRVJMWRLIJJ-UHFFFAOYSA-N	430.262	1.786	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2cccc(S(=O)(=O)C3CCCCC3)c2)n1	815574125	FSNBJHSVUVCCOD-UHFFFAOYSA-N	433.490	1.673	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCc2nncn2C1)C(=O)Nc1ccc(Br)cc1Cl	815692262	NIUIPYYYGHFWBI-QMMMGPOBSA-N	441.673	1.043	50	20	IDGD	
Cc1ccc([C@@](O)(CC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)C(F)(F)F)o1	818645917	GSFWIMYJLKRBPK-SFHVURJKSA-N	438.362	1.436	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)c2ccc(S(N)(=O)=O)c(C)c2)c1	818745616	LHAIUBAVNWAQPT-UHFFFAOYSA-N	442.291	1.948	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)c1cc(S(=O)(=O)NC(C)(C)C)ccc1C	825614948	CKSSZZJDLOQQGX-UHFFFAOYSA-N	448.545	1.954	50	20	IDGD	
COC[C@@H](C)n1c(C)cc(/C=C(\C#N)C(=O)OCC(=O)NCC(=O)N2CCCC2)c1C	913150146	NUHPTGYMQIKAQC-MWJIIQFGSA-N	430.505	1.501	50	20	IDGD	
CCCCN(C(=O)COC(=O)/C(C#N)=C/c1cc(C#N)n(C)c1C)[C@@H]1CCS(=O)(=O)C1	913286903	MWGVQRPXNSZXKK-JIARHERNSA-N	446.529	1.471	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)[C@H]2CCCN2C(=O)C(C)(C)C)cc1	914846534	OQVGSPDDKWPWRA-MRXNPFEDSA-N	444.561	1.906	50	20	IDGD	
Cc1ccn2c(=O)c(C(=O)NNC(=O)[C@@H](C)Oc3cccc(Br)c3)cnc2c1	915638484	WOEABSQGJOBBMF-GFCCVEGCSA-N	445.273	1.994	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)[C@H]1CCCCN1S(=O)(=O)c1cccs1	915697630	URLMBOUYEVLECL-OAHLLOKOSA-N	441.506	1.657	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)NC[C@@H]2CN(Cc3ccccc3)CCO2)c1	915894710	NZCHELXTUIBSRM-OAQYLSRUSA-N	426.517	1.914	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)NCCCn1cnc2ccccc21	915927155	YGJZTFLZLIRXCP-UHFFFAOYSA-N	449.559	1.969	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)N[C@H](C)c1nnc2ccccn12	916222325	ZCRSHCLDXDMXDP-GFCCVEGCSA-N	430.494	1.036	50	20	IDGD	
COc1ccc(OCC(=O)NN=C(C)c2ccc(S(=O)(=O)NCCC(=O)O)cc2)cc1	916296919	TULSQKSFSLFWPD-UHFFFAOYSA-N	449.485	1.367	50	20	IDGD	
Cc1ccsc1CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	916592358	HDCKVDNNVYJVHI-UHFFFAOYSA-N	438.531	1.222	50	20	IDGD	
C[C@H](Cn1ccnc1)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	916623089	BYCIWGCHMLSJEK-OAHLLOKOSA-N	434.522	1.090	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)NCc2ccc(S(=O)(=O)N3CCCC3)cc2)c1	916647491	GHICIOZABBXWRC-UHFFFAOYSA-N	446.529	1.689	50	20	IDGD	
Cc1ccc(F)c(S(=O)(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1	917721886	LIVPABKUJMQYNC-UHFFFAOYSA-N	441.506	1.542	50	20	IDGD	
O=C(NNC(=O)c1sccc1S(=O)(=O)N1CCOCC1)c1ccc(Cl)cc1O	918358982	GDEMTQINTVWBPQ-UHFFFAOYSA-N	445.906	1.203	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc(S(=O)(=O)N3CCCC3)c(C)o2)cc1C	918686476	FFOIEEDNDXCZHQ-UHFFFAOYSA-N	448.501	1.389	50	20	IDGD	
CNC(=O)NNC(=O)[C@@H](C)Oc1ccc(N(C)S(=O)(=O)c2ccc(C)c(C)c2)cc1	919879656	PMFVQVBQOXKWCY-OAHLLOKOSA-N	434.518	1.856	50	20	IDGD	
O=C(Cc1csc(-c2ccc(Cl)cc2)n1)NNC(=O)N[C@H]1CCS(=O)(=O)C1	919884644	JGBVLRQGMDWOIR-LBPRGKRZSA-N	428.923	1.524	50	20	IDGD	
C=CCNC(=O)c1cccc(S(=O)(=O)NNC(=O)c2nnc(-c3ccccc3)o2)c1	919961897	NFWWSDIWFIXWNB-UHFFFAOYSA-N	427.442	1.276	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2cc(C)cc(C(=O)O)c2O)ccc1OC(C)C	920758328	VKSFGWOEHDWSNX-UHFFFAOYSA-N	438.458	1.818	50	20	IDGD	
CC(=O)NC[C@@H]1CCn2ncc(C(=O)NNc3ccc(S(=O)(=O)C(F)F)cc3)c2C1	1326306577	WMRHESVESWPBBP-GFCCVEGCSA-N	441.460	1.335	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](OC(C)=O)C(C)C)C2)C1	1778801030	XZZYMFGJAMYWEL-MPGHIAIKSA-N	433.343	1.578	50	20	IDGD	
C[C@H](C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCBr)C2)N1C[C@@H]2C[C@H]2C1	1779246190	GDRQMHNYHOQIEX-YNIGFRRXSA-N	442.398	1.626	50	20	IDGD	
CC(=O)N/C(=C\c1ccco1)C(=O)N1CCO[C@]2(CCN(C(=O)CO[Si](C)(C)C)C2)C1	1779299022	MBLSTVQWOLHTPF-CNEDASOKSA-N	449.580	1.438	50	20	IDGD	
CSCC[C@H](O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CO[Si](C)(C)C)C1	1779545903	QFDBOSGNVVGWIV-FRQCXROJSA-N	432.659	1.466	50	20	IDGD	
CC(C)NC(=O)OC(C)(C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Cl)C2	1780584899	OMQIMNFTHAYOFV-BIENJYKASA-N	435.924	1.948	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1cnccn1)C2	1780707872	VJNIKJYAXZHMMY-AYOQOUSVSA-N	429.348	1.769	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Br)C1	1780777247	PMYXBUVGESXZKP-BBGACYKPSA-N	444.139	1.974	50	20	IDGD	
CC[C@@H](NC(C)=O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)Br)C1	1781995531	OXVDVANMEYBMCX-KDQZPGIASA-N	432.359	1.198	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](NC(C)C)C(C)C)C2	1782170617	SOPIRMPNXUYNKU-DCXXXQMHSA-N	432.005	1.777	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H]2CCc3nc[nH]c3C2)C1	1782459843	IYTYRIREPPPZSD-JTQINKHRSA-N	438.956	1.282	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)Cc2cnn(C)c2)C1	1782590605	SBZPDIVSQVNHFB-FRQCXROJSA-N	441.370	1.650	50	20	IDGD	
C[C@H](CC(=O)N1CC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1)Oc1ccccc1	1782879610	FAUFQRCIRAQJEU-JPYJTQIMSA-N	446.548	1.047	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)CC(=O)OC(C)(C)C)CCO2)C1	1783342377	IPIHZCRHBJCTOZ-SCLBCKFNSA-N	433.343	1.722	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccn(CCOC)n3)CCO2)C1	1783348230	XBXPCXWSQQBAHA-RDTXWAMCSA-N	443.342	1.147	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)Cc3c(C)nn(C)c3C)CCO2)C1	1783354515	SACWCQBZUCUNKH-LPHOPBHVSA-N	441.370	1.583	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3ccc[nH]3)C[C@@H]21	1783965829	UWWHUEPVEPWEDL-OTRWWLKZSA-N	426.355	1.958	50	20	IDGD	
Cc1cc(C)n(CCC(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)n1	1784321070	LQQUYSRPYOPOGX-RBUKOAKNSA-N	431.364	1.956	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Cl)C[C@@H]21)c1ccc(N2CCOCC2)cc1	1787546366	KEDFHHXYRHMFQO-DSLXNQLJSA-N	439.915	1.651	50	20	IDGD	
C[C@@H](C(=O)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1)N1C[C@H]2C[C@H]2C1	1788142186	IWWXFCYVKXRKHY-YTQUADARSA-N	447.344	1.454	50	20	IDGD	
C[C@H](C(=O)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1)N1C[C@@H]2C[C@H]2C1	1788145561	CLGCWRFCZMJVPS-NEWSRXKRSA-N	447.344	1.454	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3n[nH]cc3[N+](=O)[O-])C[C@@H]21	1789870789	WCFYWLYODRUKRE-LGXCGXJNSA-N	434.280	1.148	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnn4c3CCC4)C[C@@H]21	1789872461	WXIYYGVBTDCEKK-BCRCDCHUSA-N	429.348	1.659	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3Cc4ccccc4N3)C[C@@H]21)[C@H](F)Br	1789924914	HQYFZXCPIUMOIQ-PTTAZLHSSA-N	440.313	1.693	50	20	IDGD	
COc1ccc(/C=C(\C)C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](O)CCl)C[C@@H]32)cc1	1790664919	AOBBLZYGBOHEBI-APZZBHBJSA-N	436.936	1.678	50	20	IDGD	
O=C(COc1ccccc1F)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21	1790966608	NDQPOVNWYOGMPJ-ZQIUZPCESA-N	443.313	1.969	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cn4ncccc4n3)C[C@@H]21	1791055801	IHGIDGLIKZMSNP-OSFYFWSMSA-N	436.310	1.106	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnn(C(C)(C)C)c3)C[C@@H]21	1791252326	HACSIXRYLZJDOR-HJWJTTGWSA-N	426.945	1.485	50	20	IDGD	
C[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2C1)c1ccccc1	1791292145	AOPVQBDAGYRXTP-GTAWCEEGSA-N	430.549	1.143	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cc3cccnc3cc1F)C2)[C@H](O)CCl	1792978450	CQYVIZKGKAZNKT-BAAGSCJXSA-N	435.883	1.106	50	20	IDGD	
CC(C)(C)c1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)ccn1	1794599388	SEZAOMWBQIAEFJ-ACDBMABISA-N	435.333	1.625	50	20	IDGD	
C[C@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2)n1cccc1C=O	1795749271	XEAWXJWBMNJLLS-VWPFQQQWSA-N	426.311	1.236	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)c1cccc2ncsc12	1796188915	AGSSBUHOCLMIPJ-BJWYYQGGSA-N	435.314	1.542	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnnc2ccccc12	1796889003	CFSMHBWFEMJWKA-KOFHJDLBSA-N	433.306	1.616	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](C)n1ccnc1)C2	1796890698	FXPKTXXKLGPOIA-UFYZLLATSA-N	425.493	1.216	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cncc2cnccc12	1798458886	IYNAOWLUQVHVBZ-DPYKFYPSSA-N	433.306	1.616	50	20	IDGD	
O=C(/C=C/C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCBr)C2)NCc1ccco1	1798569000	FHDFCTXSHBUISO-ISFILERXSA-N	438.322	1.875	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Br	1799352457	XOUDKUKQUXWKLZ-DEPYFDJDSA-N	447.301	1.022	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1(Br)CC1	1799358329	KQFSJXMOSQQPJB-USZNOCQGSA-N	438.160	1.677	50	20	IDGD	
COC(=O)c1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](F)Br)cn1	1800159575	JWTHNBIBNBJNPE-GFQSEFKGSA-N	428.258	1.811	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(C(C)C)[nH]n1)C2	1800642617	SFUKUCJOLSFXRM-ZWUHOBOKSA-N	427.343	1.910	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)Nc1ccccn1)C2	1800759568	WKSSXXDTXORYRN-IPVBOJNNSA-N	425.327	1.255	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(F)cc([N+](=O)[O-])c1)C2	1800759740	FLIDPNUPEYLUHJ-BTABJRDXSA-N	444.257	1.721	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(C(F)(F)F)n1C)C2	1800978070	KYMRIAIGQCNWFO-OXIQGZBJSA-N	437.846	1.501	50	20	IDGD	
C[C@H](Oc1ccccn1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)CBr)C2	1801362665	QCZVPFDIPFUCNK-JGFGOLAASA-N	440.338	1.470	50	20	IDGD	
CC[C@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CNC(=O)c1cccnc1)C2	1801797722	CNKTYAFKVUKPTM-FZKCQIBNSA-N	437.338	1.623	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)[C@@H]2C[C@H]2C2CC2)[C@H]1c1cccnc1	1802992082	HGHXENAHGCFAOI-VQQMMKBISA-N	427.549	1.507	50	20	IDGD	
Cc1c(C(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)nc2ccccn12	1803139738	UTQXDPZHQVFGFE-HLIPFELVSA-N	441.919	1.957	50	20	IDGD	
Cc1cncc(C(=O)NC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)c1	1805771507	HUBFROFOOYDTBE-AVRDEDQJSA-N	438.532	1.478	50	20	IDGD	
Cn1ncc2c(C(=O)NC[C@@H]3CCN(C(=O)[C@H](O)CCl)[C@@H]3c3cccnc3)cccc21	1809428945	VPXBPFUMDFEKSJ-CWFSZBLJSA-N	441.919	1.888	50	20	IDGD	
C[C@H](Cc1ccccn1)C(=O)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1	1809972832	RPBDURFROHMMFQ-LJQANCHMSA-N	449.360	1.485	50	20	IDGD	
CC(C)CCC(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1	1810304239	BGPQDJTWKYIGKW-UWJYYQICSA-N	438.532	1.836	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)c1nc(O)n2c1CCCC2	1810584442	BBAFUHCIBHMCFJ-LESCRADOSA-N	447.923	1.239	50	20	IDGD	
CC(=O)NC(C)(C)C(=O)N1CC[C@H](CNC(=O)[C@H](C)Br)[C@@H]1c1cccnc1	1812865854	YLTNTMAKLDAKPO-MAZHCROVSA-N	439.354	1.786	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)Cc2cnn(C)c2)[C@H]1c1cccnc1	1812867757	MMTOWCQTEGGDDH-XCRHUMRWSA-N	434.338	1.847	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)Cc2c(C)nn(C)c2C)[C@@H]1c1cccnc1	1813033130	IQFXJKBNVFDRKF-SLYNCCJLSA-N	447.967	1.934	50	20	IDGD	
O=C(Nc1cccnc1)C(=O)N1CC[C@@H](CNC(=O)C(Cl)Cl)[C@H]1c1cccnc1	1813077367	HEWWXXIBPBGJGD-DZGCQCFKSA-N	436.299	1.925	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)COCCOC)sc2C1	1814312586	SAVWSDIVYBSGNL-QWRGUYRKSA-N	434.356	1.892	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)C1=CCCS1	1815268962	NJQLYQWGQYWYQN-INIZCTEOSA-N	426.307	1.416	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1cccs1)CC2)c1ccc(B(O)O)cc1	1815337506	UAFZIYMNZZAEFM-ZDUSSCGKSA-N	427.316	1.424	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccncc2)n[nH]1	1816381089	RGPQZHZXYLSPPP-KRWDZBQOSA-N	434.460	1.423	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1cncs1	1816581672	NYQFBZXDNQCCNS-HNNXBMFYSA-N	425.279	1.166	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H]1C[C@@H]1F)CC2	1817276506	ULTRZHXYZMOCGU-BHPJIIJQSA-N	432.481	1.547	50	20	IDGD	
CN[C@H](CC(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@](C)(Cl)CCl)[nH]n1)C(=O)O	1817370504	FPWVCLBUMDJKJF-PSTGCABASA-N	434.324	1.701	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](O)N2CCOCC2)n[nH]1	1819448348	OAUAVAXGNDTKBU-SKDZVZGDSA-N	448.351	1.289	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccs1)CC2	1819795223	KNYISKWIRGGWEX-JTQLQIEISA-N	442.526	1.743	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)C[C@H]2NC(=O)NC2=O)[nH]n1	1820862304	NBCGVNXBNPECOX-AGKHESDQSA-N	445.307	1.236	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](O)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](F)Cl)[nH]n1	1821218832	JFXKQQKWQQZRDH-MPKXVKKWSA-N	433.868	1.779	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CS(C)(=O)=O)[nH]n1	1822087803	NXGBPLRURURMCZ-CMPLNLGQSA-N	435.344	1.620	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](O)c2ccco2)[nH]n1	1822412202	NFPICZWPXSMNNX-LIRRHRJNSA-N	432.481	1.101	50	20	IDGD	
O=C(CN1CCCCC1=O)N[C@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1	1823013739	IHJZGXUEOTVEJT-LKFCYVNXSA-N	447.330	1.758	50	20	IDGD	
CCOC(=O)C(C)(C)C(=O)N[C@H]1CCc2nc(NC(=O)[C@H](Cl)COC)sc2C1	1826009348	RZVHPAVVMVSCJQ-WDEREUQCSA-N	431.942	1.898	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)Cc1ccccc1)CC2	1826085011	ARQUZAIKFKFJIR-OAHLLOKOSA-N	429.546	1.671	50	20	IDGD	
O=C(CCc1ccco1)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827056052	ONRHCASTQIOAJL-JOCHJYFZSA-N	438.333	1.826	50	20	IDGD	
CN1CCCC[C@H]1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827056446	ZRESNRXZXQJSHN-YADHBBJMSA-N	441.381	1.084	50	20	IDGD	
CCC[C@@H](NC(C)=O)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830370613	NJJOFSOYNLEUEL-UZLBHIALSA-N	431.961	1.013	50	20	IDGD	
O=C(C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1)c1ccc(Cl)cc1	1830686646	NBRYPWLUBAHQJU-MAUKXSAKSA-N	433.263	1.514	50	20	IDGD	
COC(=O)C12CC(C(=O)N3CCCC[C@H]3C3CCN(C(=O)[C@@H](O)CCl)CC3)(C1)C2	1831601735	VWTVQXJSHFEVHS-RKAKKKFESA-N	426.941	1.549	50	20	IDGD	
COc1ccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)cn1	1831870435	CFZJHLOOEAHMHV-LJQANCHMSA-N	445.564	1.697	50	20	IDGD	
O=C(c1sccc1F)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1831919380	LWHXQHVTNXFXPQ-WFASDCNBSA-N	439.278	1.648	50	20	IDGD	
C[C@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)CCBr)CC1)n1cnnn1	1832284975	KFLFTWRJDDHDMP-HIFRSBDPSA-N	427.347	1.639	50	20	IDGD	
Cc1ncoc1C(=O)NC1CCN(C2CCN(C(=O)[C@H](C)Br)CC2)CC1	1834262433	HOVNNDVOVDQCQH-LBPRGKRZSA-N	427.343	1.952	50	20	IDGD	
COc1cccc(CC(=O)NC2CCN(C3CCN(C(=O)[C@H](O)CCl)CC3)CC2)c1	1834497788	DSYFDISUYGUPQL-HXUWFJFHSA-N	437.968	1.409	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)[C@H]3CCCO3)CC2)CC1	1834900030	MXGWMLWIJDRBTN-WMLDXEAASA-N	430.387	1.768	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC1CCN(C2CCN(C(=O)c3ccc[n+]([O-])c3)CC2)CC1	1835835253	MXXYDGVSXMVHPB-UHFFFAOYSA-N	434.613	1.357	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836718741	CDBZIFSEKDXZTG-HUUCEWRRSA-N	439.778	1.758	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)CN3CCOC3=O)CC2)CC1	1836785641	CBYBGKWMIHRHGE-QGZVFWFLSA-N	429.945	1.845	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc4cccnc4n3)CCO2)C1	1836832467	BJHOGQYRDDAJFJ-IIBYNOLFSA-N	432.908	1.717	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)Cc3noc(C)n3)CC2)CC1	1837156880	SWIDNCXODAEKAZ-MRXNPFEDSA-N	428.917	1.173	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)c3ccccn3)CC2)CC1	1837416518	PXCHECFJXLBXOU-UHFFFAOYSA-N	431.537	1.067	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(F)n3)CCO2)C1	1837910465	TWVWBVAGMAQJDV-YVEFUNNKSA-N	430.274	1.074	50	20	IDGD	
CC(C)n1cnc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)n1	1839152582	DYIWDOXYGIIINK-MSOLQXFVSA-N	448.351	1.165	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(O)ccc3F)CCO2)C1	1839296060	GLNOIQXEAAGVPU-RTBURBONSA-N	449.306	1.838	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(F)(F)c1ccco1)CCO2	1839691934	UPLFVQHYBXPLEA-SUMWQHHRSA-N	436.839	1.082	50	20	IDGD	
C=C(C(=O)N1CCO[C@@]2(COCCN(C(=O)CCBr)C2)C1)C(F)(F)F	1839892649	ZCAJQXAQIUOMBC-CQSZACIVSA-N	429.233	1.346	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1839966327	AUPWNVGPOHVNCG-QMTHXVAHSA-N	432.142	1.420	50	20	IDGD	
COc1cccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)c1	1840034518	OBBJJNWTWJVFIS-LIRRHRJNSA-N	441.322	1.549	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)cc1	1840034634	RPEBETVQLPXSAN-KXBFYZLASA-N	425.323	1.848	50	20	IDGD	
C[C@H](Oc1ccccn1)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1840427794	ROAWFBQCDPYUPG-UGSOOPFHSA-N	432.304	1.109	50	20	IDGD	
COc1c(Cl)cccc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1	1840738319	CNXKGBIPCMRLQO-HNAYVOBHSA-N	447.315	1.018	50	20	IDGD	
O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1840898846	XGOGCIILXPFHSB-IIMPKJCBSA-N	441.843	1.599	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)C3CCSCC3)CCO2)C1	1840925679	ACYMLCGQLWFDFE-MAUKXSAKSA-N	449.411	1.760	50	20	IDGD	
CC(C)(C)OC(=O)NC1(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)CC1	1840956373	RYLARAKNCDRACB-UGSOOPFHSA-N	449.907	1.035	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H]1CCC(=O)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1	1841351238	JTOLEULMMUSMDJ-HOTGVXAUSA-N	443.972	1.969	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC2(CCCN2C(=O)/C=C/C(=O)NCc2ccco2)C1	1844344824	OFOQGALXGKZIDI-LFAOLKIESA-N	438.322	1.829	50	20	IDGD	
CCOC(=O)c1cc(C(=O)N2CC3(CCCN3C(=O)[C@@H](F)Br)C2)ccn1	1845218499	ISRKFUGPAYPHES-CYBMUJFWSA-N	428.258	1.766	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)Cc1ccc(S(C)(=O)=O)cc1)C2	1846361172	CQBBAKKCXXWUFD-INIZCTEOSA-N	428.938	1.090	50	20	IDGD	
COc1c(Cl)cccc1C(=O)N1CCCC12CN(C(=O)c1ccc(B(O)O)cc1)C2	1846852911	XGICMJYSPPVJBX-UHFFFAOYSA-N	428.681	1.159	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cccc(N2CCCNC(=O)C2)n1	1847435623	UNKNNBAVFIWGSW-IRXDYDNUSA-N	447.967	1.488	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CCCC[C@@H]1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl	1847567827	FFJBFYFDOMVPHP-QEOTZNIISA-N	443.972	1.871	50	20	IDGD	
CSc1cccc(N2C[C@@H](C(=O)OCC(=O)NNC(=O)c3ccccc3)CC2=O)c1	10265046	DEWPLGPTQKIPET-HNNXBMFYSA-N	427.482	1.766	50	20	IDGD	
O=C(COC(=O)/C=C/c1ccc(I)o1)NNC(=O)c1cccs1	10795059	ONOOZEIIJXKEQI-GQCTYLIASA-N	446.222	1.963	50	20	IDGD	
CC(=O)N1C=Cc2ccccc2[C@H]1CC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	15856965	CJXMQXGFXVNKBY-LJQANCHMSA-N	431.452	1.659	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)c2ccc3c(c2)S(=O)(=O)N(C(C)C)C3=O)cc1C	108785543	HFWPOFQVWRATQG-UHFFFAOYSA-N	445.497	1.696	50	20	IDGD	
CC(=O)NC1CCC(NC(=O)NNC(=O)[C@H](C)Oc2cccc(Br)c2)CC1	725876351	OFFKLFVKICMNLV-QGLTVNCISA-N	441.326	1.994	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)[C@@H](C(C)C)N1CCCC1=O	726036847	KJPXCJBPXXVVSV-QGZVFWFLSA-N	425.869	1.300	50	20	IDGD	
COCCCNC(=S)N(C)NC(=O)c1cccc(NS(=O)(=O)c2ccccc2)c1	726077254	SSDCGFBHOMWCAC-UHFFFAOYSA-N	436.559	1.975	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)CNC(=O)c1cccs1)c1cccc(N2CCCC2=O)c1	726245474	QULXBIZYDKXAJY-ZDUSSCGKSA-N	429.502	1.696	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc2c(c1)COC2)NNC(=O)C12CC3CC(CC(C3)C1)C2	726373321	ZADPWBGCTCJFRW-UHFFFAOYSA-N	433.530	1.359	50	20	IDGD	
CCn1nc(C)c(CNC(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)c1C	727604987	MZPDOYMJTDUHSN-UHFFFAOYSA-N	425.493	1.955	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)COc1ccccc1[N+](=O)[O-])c1ccc2c(c1)CC(=O)N2C	728401275	POECJNCXOSFJEO-LBPRGKRZSA-N	427.417	1.584	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Cn2cc(Br)c([N+](=O)[O-])n2)cc1OC	728705650	ZMBFWDOFWCXNTK-UHFFFAOYSA-N	428.199	1.032	50	20	IDGD	
CN(C)[C@H](CNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)c1cccc(F)c1	729045215	ROXAWVRYVZTISN-GOSISDBHSA-N	429.500	1.465	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)Nc2c[nH]ccc2=O)cc1	729367535	RWOBNXFEAZETAI-GDNBJRDFSA-N	432.440	1.668	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)NCc2ccc(CN3CCC(O)CC3)cc2)c1	729494089	ICIHCXPNVPCIIE-UHFFFAOYSA-N	426.517	1.861	50	20	IDGD	
CC[C@@H](N=c1nn[nH]n1-c1ccccc1)C(=O)NNC(=O)c1cc(-c2ccc(C)cc2)[nH]n1	729520786	RYOAYJNVSPYLCF-QGZVFWFLSA-N	445.487	1.434	50	20	IDGD	
CCN1CCC[C@H]1CN1C[C@H](C(=O)NNC(=O)c2ccc(Br)s2)CC1=O	729626152	JKVWERXXNQGWLY-NEPJUHHUSA-N	443.367	1.604	50	20	IDGD	
Cc1cc(C)c(C)c(S(=O)(=O)N2CCC(C(=O)NNC(=O)Cc3cc[nH]n3)CC2)c1C	730103065	WAXPIQLQVHVUIC-UHFFFAOYSA-N	447.561	1.434	50	20	IDGD	
Cc1ccc(C(=O)NNS(=O)(=O)c2cc(Br)cc([N+](=O)[O-])c2)c(O)c1	731177721	JHBRAOAPCRYZNS-UHFFFAOYSA-N	430.236	1.995	50	20	IDGD	
COC(=O)c1ccc(OCCNC(=O)NNC(=O)c2nnc(O)c3ccccc23)cc1	731284401	ZRMPKCBYEFBMEN-UHFFFAOYSA-N	425.401	1.145	50	20	IDGD	
COc1ccc(OC)c(CN2CCN(C(=O)NNC(=O)c3ccccc3OC)CC2)c1	731499928	RBWUFIPHLPCRDM-UHFFFAOYSA-N	428.489	1.885	50	20	IDGD	
COC[C@H](C)n1c(SCC(=O)NNC(=O)c2c[nH]nc2C)nnc1-c1ccccc1	732084711	YOXYOYJKTMXKRC-LBPRGKRZSA-N	429.506	1.737	50	20	IDGD	
CCn1c(=O)nc(O)c2c(C(=O)NNc3nc(-c4cccnc4)no3)cc(C3CC3)nc21	732110510	CSTKKBYFTYFGRI-UHFFFAOYSA-N	434.416	1.596	50	20	IDGD	
CCOc1ncc(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1Cl	732750916	DBHRKZRJWCJNML-UHFFFAOYSA-N	433.273	1.509	50	20	IDGD	
C[S@@](=O)CCNC(=O)/C(C#N)=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	735045864	KQTRPYZTOHRCAA-FCDZUKHYSA-N	433.921	1.481	50	20	IDGD	
CCOc1ccc(S(=O)(=O)Nc2cccc(C(=O)NNC(=O)c3cnn(C)c3)c2)cc1	735473100	MYDDCTRGVSNLNC-UHFFFAOYSA-N	443.485	1.694	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)NCc2ccccc2CN2CCN(c3ccccc3)CC2)cn1	735509547	ARDPJNGBKSKCIU-UHFFFAOYSA-N	447.543	1.887	50	20	IDGD	
C[C@@H](CN1CCN(c2ccccn2)CC1)NC(=O)NNC(=O)Cc1ccc(Cl)cc1	735518793	LUCLZSHTSUMJAE-INIZCTEOSA-N	430.940	1.819	50	20	IDGD	
CC(=O)NCC(=O)N1CCc2cc(C(=O)NNC(=O)Cc3cccc4ccccc34)ccc21	735632208	YMQZNPDTSYNRAP-UHFFFAOYSA-N	444.491	1.869	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2ccc(CS(N)(=O)=O)cc2)c(C)n1-c1ccccc1	736542895	CZGHMLAGGPJGFD-UHFFFAOYSA-N	426.498	1.957	50	20	IDGD	
CC(C)(C)CCC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	737468707	PXWJUIMNFVTBPZ-UHFFFAOYSA-N	425.551	1.614	50	20	IDGD	
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC[C@H](C(=O)NNc2cccc(C(F)(F)F)n2)C1	740141624	KXLOYSVWKQDMTQ-LBPRGKRZSA-N	446.455	1.984	50	20	IDGD	
CC(=NNC(=O)c1csc(N2CCOCC2)n1)c1cccc(N2CCCS2(=O)=O)c1	741161999	PKHXMOCDOLCUNH-UHFFFAOYSA-N	449.558	1.674	50	20	IDGD	
Cc1cc2c(cc1C)O[C@H](C(=O)NNc1ccc(S(=O)(=O)N3CCN(C)CC3)cc1)C2	743334864	OBKPPXYESMELAA-NRFANRHFSA-N	444.557	1.686	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2cc(C)cc(C(=O)O)c2O)cc(OC)c1OC	743835844	GKIMIIWQXGRGHU-UHFFFAOYSA-N	440.430	1.048	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)[C@H]2CCCN2C(=O)OCC(F)(F)F)cc1	744945803	JGXQOBOCELFOCU-CYBMUJFWSA-N	442.350	1.026	50	20	IDGD	
CN(C)C(=O)NNC(=O)c1cc(S(=O)(=O)N2CCCCC2)ccc1N1CCCCC1	746003445	NAFYHKOINMJSNR-UHFFFAOYSA-N	437.566	1.768	50	20	IDGD	
CS(=O)(=O)c1ccc(OCCC(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)cc1	746516103	BEOWQDWUKXYOHP-UHFFFAOYSA-N	428.470	1.710	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)NC1CCN(CC(F)F)CC1	747309288	IWMAPPDQJPNJOV-UHFFFAOYSA-N	435.269	1.888	50	20	IDGD	
O=C(C#Cc1ccccc1)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	747348268	HDBHTNLZUMFULJ-UHFFFAOYSA-N	433.489	1.978	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)OCC(=O)N2CCCC[C@@H]2C(N)=O)c(C)n1C[C@@H]1CCCO1	749221610	RQYFJYUJTHKBQD-OHBNSYPMSA-N	442.516	1.601	50	20	IDGD	
COc1cc(CCC(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)ccc1OCC(F)(F)F	749783827	NQNDQPBWOCBLLO-GFCCVEGCSA-N	438.424	1.151	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(C(=O)CNC(=O)NNC(=O)CCc2ccccc2)CC1	750326825	JMEMBIIBFBDSIB-UHFFFAOYSA-N	433.509	1.029	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)NCC(=O)N1CCN(c2ccc(Cl)cc2)CC1	750335943	WHTPDLVFZHGLBB-UHFFFAOYSA-N	429.908	1.941	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)[C@H]3OCCc4ccccc43)cc2)CC1	750429509	VKWHFMPHPPRBKO-FQEVSTJZSA-N	430.530	1.380	50	20	IDGD	
Cc1ncc([N+](=O)[O-])cc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	750542080	VDQBTZRLRVGOPQ-UHFFFAOYSA-N	447.473	1.548	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc(C)cc1	750632475	YVJKZULWUQEXQI-IBGZPJMESA-N	445.541	1.937	50	20	IDGD	
Cc1nnnn1[C@H](Cc1cccc(F)c1)C(=O)NNC(=S)NCCc1cccs1	753075670	BDADHHJLOUFGKM-MRXNPFEDSA-N	433.538	1.704	50	20	IDGD	
C[C@H](CC(=O)OCc1ccccc1)NC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	753128566	RBKPNNCALWLXPA-CQSZACIVSA-N	433.486	1.556	50	20	IDGD	
C[C@H](CO[C@H]1CCOC1)NC(=O)NNC(=O)[C@@H](C)Oc1cccc(Br)c1	753814240	XSSZKEQOSMLOHR-JMSVASOKSA-N	430.299	1.741	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)NCCN3C(=O)[C@@H]4[C@@H](C3=O)[C@H]3C=C[C@H]4C3)cc2C1	755082143	KTRHRGBVKNGJCV-ACPUWCFLSA-N	442.541	1.624	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)CC(F)(F)F)cc1S(=O)(=O)N1CCCCC1	755412732	GUCVQVFEIJHWGG-UHFFFAOYSA-N	438.428	1.975	50	20	IDGD	
O=C(NNC(=O)c1ccccn1)Nc1ccc(N2CCOCC2)cc1N1CCOCC1	755454431	MMYPVPXBDHEWBW-UHFFFAOYSA-N	426.477	1.221	50	20	IDGD	
COC(=O)CCNC(=O)c1ccc(NC(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)cc1	755602613	GFFRJIAWQUNWKX-CYBMUJFWSA-N	446.435	1.739	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccc3c(c2)OC(C)(C)O3)c1	756221455	GWPHILDHAVWNIA-UHFFFAOYSA-N	434.474	1.911	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H]1COC(=O)c1ccc(NC(=O)NNC(=O)CO)cc1	756294340	GXKJUZUUBSUDAX-OAHLLOKOSA-N	436.465	1.388	50	20	IDGD	
CCOC(=O)Cn1cccc(NC(=O)NNC(=O)c2ccc(OC(C)C)c(OC)c2)c1=O	757764312	QDEMRBDTLBZTAA-UHFFFAOYSA-N	446.460	1.674	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1[N+](=O)[O-]	757994179	URYRXDGZHGYPJA-UHFFFAOYSA-N	437.434	1.320	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)[C@@H](Sc1ccc(F)cc1F)c1ccccc1	758028019	BFVUHNPURAUOIG-ZBEGNZNMSA-N	443.497	1.883	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)c2cccc(S(=O)(=O)N3C[C@H](C)O[C@@H](C)C3)c2)nc1	759737477	CBNTXSWRQWCPHV-KBPBESRZSA-N	448.501	1.423	50	20	IDGD	
COC(=O)C12CCC(C(=O)NNC(=O)c3ccc(CSc4nncn4C)cc3)(CC1)C2	760052868	GLUOPYHKMFVIMP-UHFFFAOYSA-N	443.529	1.992	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)c1cc([N+](=O)[O-])cc(S(C)(=O)=O)c1	761634305	ZAJQBEJPYCRBCA-UHFFFAOYSA-N	439.471	1.560	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)N[C@H]2CCN(C(=O)CC)C2)c2ccccc2c1=O	762374563	CJVZYUCPIZMWSU-HNNXBMFYSA-N	442.520	1.542	50	20	IDGD	
O=S(=O)(CBr)N1CCN(S(=O)(=O)c2cc(F)ccc2Cl)CC1	763206621	QBBMQMXHPHACNE-UHFFFAOYSA-N	435.724	1.468	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2ccncc2)ccc1NC(=O)OC(C)(C)C	763465466	XXXFMUDMQRPNMK-UHFFFAOYSA-N	429.433	1.837	50	20	IDGD	
O=C(NNC(=O)c1ccccc1Br)C(=O)Nc1cccnc1N1CCOCC1	763483635	USRSQHONQXNTCW-UHFFFAOYSA-N	448.277	1.080	50	20	IDGD	
C[C@H](C(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2ccccc2O)c1)n1cccn1	763527154	GTAOPOVWBCYIKA-CYBMUJFWSA-N	436.428	1.188	50	20	IDGD	
COC(=O)c1ccc(F)c(NC(=O)C(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)c1	763539546	NBQUSBYSLVMLOA-UHFFFAOYSA-N	449.391	1.038	50	20	IDGD	
C[C@H](NS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)C2CC2)cc1)[C@H]1C[C@H]2CC[C@H]1C2	763558132	NPIGHHJWRJMKDS-BWQRHGBYSA-N	448.545	1.286	50	20	IDGD	
CCN(CC)C(=O)c1ccccc1NC(=O)C(=O)NNC(=O)c1c(C)nc2ccccn12	763625683	VTEZSNMLDXVFEM-UHFFFAOYSA-N	436.472	1.524	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(OC[C@H]3CCCO3)cc2)cc1	763659071	IIZOIECJXJGGLB-LJQANCHMSA-N	443.456	1.418	50	20	IDGD	
CCn1nccc1NC(=O)C(=O)NNC(=O)COc1ccc(OCc2ccccc2)cc1	763679835	MAYGDWIXPMTGJL-UHFFFAOYSA-N	437.456	1.647	50	20	IDGD	
CS(=O)(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)c1	763684974	RIJRCWMTIBLROE-UHFFFAOYSA-N	439.877	1.050	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)C(=O)Nc2cccc(C(=O)N3CCCCC3)c2)c1	763753666	IPAUTYUHXQSGLJ-UHFFFAOYSA-N	437.500	1.778	50	20	IDGD	
CC(C)NC(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)c2cccc(N(C)C)c2)c1	763759834	DAKKZGANMHIBRX-UHFFFAOYSA-N	445.907	1.944	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(F)cc2OCC#N)c1C	763849224	KBAAWCMMFJUUDJ-AWEZNQCLSA-N	428.420	1.898	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2c(C)cc(Cl)cc2C)n(CCC#N)n1	763876453	DDTIMMHOBZGIJD-AWEZNQCLSA-N	446.895	1.929	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2cc(C)n(-c3ccccc3Cl)n2)n1	763880167	BSUGBDHMAOWNHA-UHFFFAOYSA-N	429.868	1.434	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1ccc(OCc2cccnc2)cc1	764006063	JYMFLGBJGBBJLT-UHFFFAOYSA-N	448.435	1.832	50	20	IDGD	
CCN1CCN(c2ccc(NC(=O)C(=O)NNC(=O)c3ccc(C)cc3O)cc2)CC1	764104942	JTPSUULRGMHZPV-UHFFFAOYSA-N	425.489	1.242	50	20	IDGD	
O=C(CC1CCCC1)NNC(=O)C(=O)Nc1cc2c(cc1Br)OCCO2	764178694	GIQNFLUQOQSGMJ-UHFFFAOYSA-N	426.267	1.887	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)CCCc2ccccc2)cc1	764224378	PLKHJKCKLLIQJL-UHFFFAOYSA-N	446.529	1.482	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)C(=O)Nc1ccc(-n2cncn2)c(Cl)c1	764239608	PQYLBTUDCHVPEU-UHFFFAOYSA-N	437.847	1.662	50	20	IDGD	
C[C@H]1CN(Cc2ccccc2NC(=O)C(=O)NNC(=O)Cc2cccnc2)C[C@@H](C)O1	764267796	KDZBSRZFURQZQS-IYBDPMFKSA-N	425.489	1.019	50	20	IDGD	
CC(C)(C)OC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccccc2F)cn1	764321193	SJRURMZPZJKBCU-UHFFFAOYSA-N	431.424	1.896	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C(=O)Nc1ccc(NC(=O)CN(C)C)cc1)c1ccccc1	764329203	VBTCECCVVVCGBI-SFHVURJKSA-N	425.489	1.466	50	20	IDGD	
CN(c1ccccc1NC(=O)C(=O)NNC(=O)c1cc2ccccc2o1)S(C)(=O)=O	764331209	QQIGXBCPVBOYIL-UHFFFAOYSA-N	430.442	1.228	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c(F)cc1F	764350362	CWJZUWSDZZPTFT-UHFFFAOYSA-N	443.366	1.337	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)C(=O)Nc1cccc(N2C(=O)c3ccccc3C2=O)c1	764356334	UVIGDEJIDNUSMI-UHFFFAOYSA-N	443.419	1.211	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)C(=O)Nc1cccc(CN2CCCCC2=O)c1	764365931	IEFXYKAMURPXRR-UHFFFAOYSA-N	438.484	1.502	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)C(=O)Nc1ccc(-c2nnc3n2CCCC3)cc1	764368057	UBERZJFVOXTRQI-UHFFFAOYSA-N	448.483	1.584	50	20	IDGD	
CCNS(=O)(=O)c1ccc(CNC(=O)NNC(=O)[C@H](C)Oc2ccccc2F)cc1	764373666	LLLYAXRVKNBYJC-ZDUSSCGKSA-N	438.481	1.422	50	20	IDGD	
O=C(CCC(=O)N1CCN(c2ccccn2)CC1)NNC(=O)Cc1c[nH]c2ccccc12	764551714	IYPPNWIBVAEVLG-UHFFFAOYSA-N	434.500	1.382	50	20	IDGD	
CN(CCC#N)c1ccc(C=NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cc1	764819946	UFPWILAAVIYGLG-UHFFFAOYSA-N	432.528	1.945	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)Nc3cccc(C)c3)CC2)cc1	765313478	QPYYHJVQQLHVID-UHFFFAOYSA-N	445.545	1.463	50	20	IDGD	
CCS(=O)(=O)NCc1ccc(C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)cc1	765569334	ZFINYKMQHPDFLT-UHFFFAOYSA-N	433.515	1.652	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)CNC(=O)CCC3CCCC3)n[nH]2)cc1OC	765598257	YLASXLKONATRHW-UHFFFAOYSA-N	443.504	1.942	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1ccccc1Cn1cccn1	766640747	FTPZQAKQYOFZFW-UHFFFAOYSA-N	446.511	1.150	50	20	IDGD	
CNS(=O)(=O)c1cccc([C@@H](C)NC(=O)NNc2ccccc2S(C)(=O)=O)c1	766944887	NOBLTSPPHLLJOI-GFCCVEGCSA-N	426.520	1.386	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCCn1cc([N+](=O)[O-])cn1	768517100	ROIXARMXNCOGKB-JTQLQIEISA-N	441.242	1.352	50	20	IDGD	
COc1cc(N[C@H]2CCCN(CC(=O)NNC(=O)Cc3nc(C)cs3)C2)cc(OC)c1	768552360	MSENFVNMVVEUCD-HNNXBMFYSA-N	447.561	1.735	50	20	IDGD	
CCS(=O)(=O)c1cccc(CC(=O)NNc2c(OC)cccc2S(C)(=O)=O)c1	768629313	QMBZECDDVAARHQ-UHFFFAOYSA-N	426.516	1.578	50	20	IDGD	
CC[C@@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1	770212720	RSAUMTXHWXWVFA-OAHLLOKOSA-N	442.538	1.066	50	20	IDGD	
Cc1cc2c(N3CCC[C@@H]3C(=O)NNC(=O)COc3ccccc3O)ncnc2s1	770953446	BCKUVSBPLCBYQB-CQSZACIVSA-N	427.486	1.901	50	20	IDGD	
CN(C)S(=O)(=O)c1ccsc1C(=O)NNc1nc(O)c2cnn(C(C)(C)C)c2n1	770967565	QPFUQOGFMDNYFF-UHFFFAOYSA-N	439.523	1.356	50	20	IDGD	
C[C@H](NS(=O)(=O)c1ccc(C(N)=O)cc1)C(=O)NNc1ccc(-c2ccccc2)nn1	771027432	DVIQRCIVYNAMEW-ZDUSSCGKSA-N	440.485	1.053	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CN2C(=O)N[C@](C)(c3ccc(Br)cc3)C2=O)o1	771277988	XHGVYMXKGZHMFS-GOSISDBHSA-N	449.261	1.579	50	20	IDGD	
Cc1cc(S(=O)(=O)NCCNC(=O)NNC(=O)COc2ccccc2F)c(C)s1	771945973	FSZMMNLWGAEXJJ-UHFFFAOYSA-N	444.510	1.192	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCCN(C)S(=O)(=O)c2cccs2)cc1OC	771955613	UVUOXQBNGKMLFQ-UHFFFAOYSA-N	442.519	1.030	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)c1cccc(CS(=O)(=O)NC(C)(C)C)c1	772062728	CLIZULPEBOFLST-AWEZNQCLSA-N	441.550	1.643	50	20	IDGD	
COc1cc(OC)cc(N2C[C@H](C(=O)O[C@H](C)C(=O)NNC(=O)CC(C)C)CC2=O)c1	772180188	AKEINRBFSLIBMT-ZIAGYGMSSA-N	435.477	1.182	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)c1cnc(Oc2ccccc2)cn1	773185684	FAQAVXGAGHWMHR-UHFFFAOYSA-N	426.458	1.637	50	20	IDGD	
O=C(CN[C@H](c1ccc2c(c1)OCCO2)C1CC1)NNC(=O)c1ccc([N+](=O)[O-])cc1	776013781	ZJWYSSSIKVHJFK-FQEVSTJZSA-N	426.429	1.868	50	20	IDGD	
CC(C)C[C@H](C(=O)NNc1cccc(S(C)(=O)=O)c1)N1C(=O)[C@H]2CC=CC[C@H]2C1=O	776540883	DCNSOYSCAGQEBQ-FGTMMUONSA-N	433.530	1.899	50	20	IDGD	
Cc1occc1C(=O)Nc1nc(CC(=O)NNC(=O)CNC(=O)OC(C)(C)C)cs1	778445064	DLNUSQYSPPHUKC-UHFFFAOYSA-N	437.478	1.511	50	20	IDGD	
CN(C)C(=O)COc1ccccc1C(F)(F)C(=O)NNC(=O)[C@@H]1COc2ccccc2O1	778523871	HYWWCEWRVBNFQA-KRWDZBQOSA-N	449.410	1.233	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N[C@@H](CO)CC(F)(F)F	778587563	DHHVFZCXELOXNR-PSASIEDQSA-N	428.205	1.860	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)[C@H](O)[C@@H](O)c1nc2ccccc2s1	779540975	VFXBVEDFBISBBA-IAGOWNOFSA-N	433.511	1.639	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)NCc2ccccc2CN2CC[C@H](O)C2)cc1C	781950783	DYTAYAVLORQUQC-FQEVSTJZSA-N	439.516	1.339	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)Cc2cncs2)c1	782659635	RDFOTSVICBCMTF-UHFFFAOYSA-N	446.510	1.956	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCc2cn(C)nc2-c2ccccc2)nc1	782752501	VBSVRYYWCIRRJQ-UHFFFAOYSA-N	443.533	1.995	50	20	IDGD	
O=C(CN1CCOCC1)Nc1ccc(NC(=O)C(=O)NNc2ccc(F)cc2F)cc1	783340144	OKXILIPTEGTFEZ-UHFFFAOYSA-N	433.415	1.317	50	20	IDGD	
C[S@](=O)c1cccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)c1	783409439	UQGPROCZTWLVHH-NDEPHWFRSA-N	449.432	1.799	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNc2ccc(-n3cccn3)nn2)cc1Cl	783433686	YRZRHGRYECRNTG-UHFFFAOYSA-N	431.840	1.423	50	20	IDGD	
N#Cc1ccc(NNC(=O)C(=O)Nc2ccc(OCCC(N)=O)cc2)cc1C(F)(F)F	784231588	DLQOURPBJZFMHM-UHFFFAOYSA-N	435.362	1.913	50	20	IDGD	
Cc1c(CS(C)(=O)=O)cccc1NC(=O)C(=O)NNc1ccc(Br)cn1	784339931	NLVBGEOBYCBXDU-UHFFFAOYSA-N	441.307	1.779	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)c(OCc2ccccc2)c1	784462411	GUQXNDLSHLUEOV-OAHLLOKOSA-N	433.486	1.862	50	20	IDGD	
COC(=O)c1cc(N2CCOCC2)ccc1NC(=O)C(=O)NNc1ncccc1Cl	784813500	CMLXCOUSWUEPOL-UHFFFAOYSA-N	433.852	1.440	50	20	IDGD	
CCNS(=O)(=O)c1ccc2c(c1)N(C(=O)C(=O)NNc1ccc(C#N)c(Cl)c1)CC2	785094456	GKVOKJQPDMXKRU-UHFFFAOYSA-N	447.904	1.542	50	20	IDGD	
O=C(Nc1cccc(S(F)(F)(F)(F)F)c1)C(=O)N1CCN2C(=O)C(=O)NC[C@@H]2C1	785211837	NSFPJKKBUNGHTC-SNVBAGLBSA-N	442.366	1.452	50	20	IDGD	
Cn1ncc(C(=O)NNC(=O)c2cccc(S(=O)(=O)Nc3ccccc3Cl)c2)n1	785670107	NAEIJCQLZBXPHH-UHFFFAOYSA-N	434.865	1.344	50	20	IDGD	
COC1(C(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)CCOCC1	785768832	SCWPTNQDNCJDKI-UHFFFAOYSA-N	436.472	1.345	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cc(C#N)cn2C(C)(C)C)cc1	789741218	RCVOCNKXQCVOIF-AWEZNQCLSA-N	439.472	1.871	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@H]2CCN(Cc3ccccc3)C2)c1	792228864	GDRZJCIUTURHRR-QGZVFWFLSA-N	430.530	1.556	50	20	IDGD	
O=C(NNc1nc2ccccn2n1)Nc1ccc(F)c(S(=O)(=O)N2CCOCC2)c1	792249084	VTXJUMCTCXVPMT-UHFFFAOYSA-N	435.441	1.038	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc2[nH]c(C(=O)NC)cc2c1	792352685	GAUVFSHVHGCUSW-UHFFFAOYSA-N	437.456	1.255	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2[C@H]3[C@H]4C[C@@H]5[C@H]6[C@@H](C[C@H]53)[C@@H]2[C@@H]64)c1	792774835	YCXGAZHAEAMWIQ-MMERRTHSSA-N	443.569	1.872	50	20	IDGD	
CC(C)Oc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc3ccccc3c2)nn1	793021642	HVHURBQQJNLQFD-AWEZNQCLSA-N	437.456	1.970	50	20	IDGD	
O=C(NNC(=O)[C@H](O)c1cccc(C(F)(F)F)c1)c1csc(N2CCOCC2)n1	794779238	FNYFSORMWNITLA-CYBMUJFWSA-N	430.408	1.493	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNS(=O)(=O)c1cc([N+](=O)[O-])cc(Cl)c1F	795312805	RLJQDJCEYKDCCC-UHFFFAOYSA-N	436.830	1.188	50	20	IDGD	
O=C(CN[C@@H](CO)c1ccc(Br)c(F)c1)NNC(=O)c1ccc(F)cc1	795331791	DVYJPGROOXIKGB-HNNXBMFYSA-N	428.233	1.812	50	20	IDGD	
Cn1nc(SCC(=O)NN=Cc2cc(Cl)ccc2OCC2CC2)c(=O)n(C)c1=O	797400673	KGTJFQQCKKUULZ-UHFFFAOYSA-N	437.909	1.164	50	20	IDGD	
NC(=O)[C@@H]1CN(S(=O)(=O)c2ccc(OCCBr)cc2)c2ccccc2O1	799520235	PMEJVKQFDWCPCP-INIZCTEOSA-N	441.303	1.902	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)NCCS(=O)(=O)CCc1ccccc1	800757646	CPVJDPXSLLEEDK-OAHLLOKOSA-N	437.493	1.581	50	20	IDGD	
O=C(/C=C\c1ccccc1)NCCCNC(=O)NNC(=O)c1nnc(O)c2ccccc12	800759185	KOJLISBTRCIOCG-QXMHVHEDSA-N	434.456	1.499	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)N[C@@H](C)CCNS(=O)(=O)c1ccccc1	802527508	GOCVFNHBCOCWTM-INIZCTEOSA-N	448.545	1.715	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)[C@@H]1CS[C@H](Cc2ccccc2F)C(=O)N1	804951430	ROGGUNISLSFJAM-LSDHHAIUSA-N	427.465	1.087	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(OC)c(OC)c2C)cc1OC	805589682	LRKLJGITBYDKFC-UHFFFAOYSA-N	432.429	1.647	50	20	IDGD	
COc1ccc2cc(NC(=O)C(=O)NNC(=O)c3nnc(O)c4ccccc34)ccc2c1	806974844	VVNOPXNLLMOVTF-UHFFFAOYSA-N	431.408	1.897	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C2(S(=O)(=O)c3ccccc3)CCOCC2)cc1	808300133	YBVZXALNKKTSOI-UHFFFAOYSA-N	446.525	1.798	50	20	IDGD	
CCc1cc(NNC(=O)CNS(=O)(=O)c2c(C)noc2C)nc(-c2ccccn2)n1	810385467	UBZZSEKCQUMTCU-UHFFFAOYSA-N	431.478	1.127	50	20	IDGD	
O=C(CNS(=O)(=O)c1cccc(C(F)(F)F)c1)NNc1nc(O)c2ccccc2n1	810517179	KYKCOUJQVZRHCX-UHFFFAOYSA-N	441.391	1.776	50	20	IDGD	
C[C@H]1Oc2ccccc2[C@@H]1NC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	812430048	FAWMKIHFBALFGC-AUUYWEPGSA-N	446.533	1.166	50	20	IDGD	
CCOC(=O)c1ccc(NNC(=O)CCC(=O)N2CCN(c3ncccn3)CC2)cc1C	812718914	AXSYPKFGKNIJJN-UHFFFAOYSA-N	440.504	1.534	50	20	IDGD	
Cc1ccc(NNC(=O)C(=O)Nc2ccc3c(c2)CN(C(=O)OC(C)(C)C)CCO3)nn1	812984578	LEGDSYMHUABGCC-UHFFFAOYSA-N	442.476	1.996	50	20	IDGD	
COC(=O)C12CCC(C(=O)NNC(=O)c3ccc(Cl)c(S(N)(=O)=O)c3)(CC1)CC2	814365415	JKKAYJAVBPKAEF-UHFFFAOYSA-N	443.909	1.262	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2nc(CC(F)(F)F)cs2)c(OC)c1	815569374	QQQGBVAPJIKDHY-UHFFFAOYSA-N	432.380	1.665	50	20	IDGD	
COC(=O)N1CCN(c2ccc(NC(=O)C(=O)NNc3ccc4ccccc4n3)cn2)CC1	815573321	GAWTVJULHPWXMT-UHFFFAOYSA-N	449.471	1.600	50	20	IDGD	
O=C(NNc1cccc(Cl)n1)C(=O)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1	815727143	JVKFICMQFSPTEE-UHFFFAOYSA-N	437.909	1.991	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(N2C[C@H](C(=O)NNC(=O)CC3CC3)CC2=O)cc1	819109849	MIZIQHBTFWXXNG-OAHLLOKOSA-N	436.534	1.018	50	20	IDGD	
Cc1ccc(S(=O)(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)c(Cl)c1	824974006	QHTQFEZHNIZFPC-UHFFFAOYSA-N	438.314	1.573	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCCCN1CCc2ccccc21	913463257	ZBXAFIFBERNOHG-UHFFFAOYSA-N	444.561	1.685	50	20	IDGD	
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC(=NNC(=O)Cn2cnc3ccccc32)CC1	914559313	ISWZSKGGQJBPFH-UHFFFAOYSA-N	429.506	1.333	50	20	IDGD	
O=C(Cn1nnc(-c2ccccc2)n1)NN=Cc1cc2ccccc2nc1N1CCOCC1	915907267	VOWDATDLFQGZEI-UHFFFAOYSA-N	442.483	1.875	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)NCCN1CCN(c2ccc(F)cc2)CC1	916513758	QMHBYSHSVZNSNB-UHFFFAOYSA-N	439.495	1.548	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)NCCOc2ccc3c(c2)OCO3)cc1	916647245	WJQWKRNOYPSSTR-AWEZNQCLSA-N	431.445	1.991	50	20	IDGD	
Cc1ccc(S(C)(=O)=O)cc1S(=O)(=O)NNC(=O)C12CC3CC(CC(C3)C1)C2	917720147	CXUIIKMDDLLIKP-UHFFFAOYSA-N	426.560	1.924	50	20	IDGD	
O=C(NCc1ccc(N2CCOCC2)c(F)c1)NNC(=O)c1ccc2c(c1)OCCO2	918223750	KJFYNGWXHPEHCY-UHFFFAOYSA-N	430.436	1.578	50	20	IDGD	
COc1ccc(S(N)(=O)=O)cc1C(=O)NNC(=O)c1ccc(F)cc1Br	918341575	PHIVJPUXFIKKGR-UHFFFAOYSA-N	446.254	1.319	50	20	IDGD	
COC(=O)c1ccc(C)c(NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)c1	920931317	KJQYOGXEORWUEE-UHFFFAOYSA-N	448.501	1.563	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H](C)OC[C@@H]2CCCO2)c1	921020120	RPEPMEZTVKRUHE-ZBFHGGJFSA-N	427.523	1.062	50	20	IDGD	
CN(C)C(=O)COc1cccc(CNC(=O)NNC(=O)c2cncn2-c2ccccc2)c1	1317976891	UGUKTDOYTFHHGI-UHFFFAOYSA-N	436.472	1.484	50	20	IDGD	
Cc1ccc2c(c1)S[C@H](C(=O)NNC(=O)CN1CCN(C(=O)c3ccccc3)CC1)C2	1319201570	SLKPLZZWJMMPGF-FQEVSTJZSA-N	438.553	1.617	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(CCN(C(=O)c3n[nH]c4ccc(F)cc34)C2)C1	1778623117	IMLJUAMMEHTQHG-HXUWFJFHSA-N	434.544	1.997	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCc2nc(N)n[nH]2)C1	1779238636	WPUBZXILXCRHDS-BFUOFWGJSA-N	426.949	1.098	50	20	IDGD	
N[C@@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Br)C1)c1ccccn1	1780771524	JUGAEEAKRQUIJY-ZXFNITATSA-N	443.317	1.286	50	20	IDGD	
CC(=O)N[C@H](C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Cl)CCO2)c1ccc(F)cc1	1780908945	POZZXJHNLGDKHR-TXPKVOOTSA-N	429.851	1.367	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cccnc3CS(C)(=O)=O)CCO2)C1	1781212899	AESYBMBWQXFFSE-BEFAXECRSA-N	443.953	1.087	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(S(C)(=O)=O)c(F)c3)CCO2)C1	1781223630	QPEXIIRZAQYEQB-KUHUBIRLSA-N	446.928	1.690	50	20	IDGD	
N[C@H](C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1)c1cccc(Cl)c1	1781331396	QATRHFKRLFUJGL-JJRVBVJISA-N	448.720	1.860	50	20	IDGD	
CC(C)(C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1)c1ccccn1	1781333887	HDEZPAVMXCWZCS-KBXCAEBGSA-N	428.302	1.880	50	20	IDGD	
Cc1cccc2c(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)[C@@H](O)CCl)C4)n[nH]c12	1781386034	AQGUEROPEUGPNR-GCKMJXCFSA-N	434.924	1.599	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(CCN(C(=O)c3cccc(F)c3[N+](=O)[O-])C2)C1	1781768900	MULSJWXNUCMNOF-QGZVFWFLSA-N	444.257	1.962	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(=O)cco1)C2	1781996487	LWJCBGXUWMMVAG-WBHUJUFNSA-N	427.295	1.551	50	20	IDGD	
CCOC(=O)C(C)(C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)Br)C1	1782001298	DAXGQXULGCGNSJ-PJIJBLCYSA-N	447.370	1.873	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](Cl)COC)C1	1782179264	ITSHFACOWAGDED-ZOMKSWQUSA-N	439.778	1.928	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnn4c3OCCC4)C2)C1	1782273724	JVWGXKHXZPNFKL-ACJLOTCBSA-N	441.326	1.140	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3c(O)cc(O)cc3O)CCO2)C1	1783353474	OUDOIQLXNWGGES-KZULUSFZSA-N	443.294	1.420	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)C#CC3(O)CCCCC3)CCO2)C1	1783533714	GDZCRKRVYNOOFH-BEFAXECRSA-N	427.339	1.298	50	20	IDGD	
CC[C@H]1CC[C@H](C(=O)N2CC[C@]3(CN(C(=O)c4cnccc4C(=O)NN)CCO3)C2)CC1	1783607762	BJJIQYGWOWOOQZ-SEPYTNNBSA-N	443.548	1.345	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(C)(C)CCl)[C@H]2C1)[C@@H]1SC(=N)NC1=O	1783850433	HLVVIAAHXRFJDW-PEDHHIEDSA-N	444.985	1.034	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(F)nc3F)C[C@@H]21	1783963828	AJKCVLPGQHBMRL-IMIFBBOLSA-N	446.292	1.984	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc(Cl)nc3)C[C@@H]21	1783964462	UJHTXRWICSBUDV-XWUBHJNHSA-N	445.745	1.754	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccn(-c4ccccc4)n3)C[C@@H]21)[C@@H](O)CCl	1784092815	MPADEAIXOSXDDT-CBVHJVASSA-N	432.908	1.065	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccn(CCOC)n3)C[C@@H]21	1784617841	GTDPGPOAVGELFS-CUSZFKRNSA-N	426.945	1.530	50	20	IDGD	
O=C(CS(=O)(=O)N1CCCC1)NC1(c2ccc(NC(=O)[C@H](O)CCl)cc2)CCC1	1786132124	KJEQKNYRQZLBCW-MRXNPFEDSA-N	443.953	1.146	50	20	IDGD	
O=C(NC1(c2ccc(NC(=O)[C@@H](O)CCl)cc2)CCC1)c1cc(=O)nc2cccnn12	1786136786	QJYINQLHNQGBQH-INIZCTEOSA-N	441.875	1.437	50	20	IDGD	
C[C@@H](Br)C(=O)NC1(c2ccc(NC(=O)CC[C@H](N)C(N)=O)cc2)CCC1	1788058824	HPLHDFDYGYQUSR-RISCZKNCSA-N	425.327	1.497	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC1(c2ccc(NC(=O)CC[C@@H](N)C(N)=O)cc2)CCC1	1788059922	BPIZHHJSLHESBD-RDTXWAMCSA-N	429.348	1.950	50	20	IDGD	
NC(=O)[C@@H](N)CCC(=O)Nc1ccc(C2(NC(=O)[C@H](F)Br)CCC2)cc1	1788059931	BPWYDPHFDYFXRI-JSGCOSHPSA-N	429.290	1.404	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCCCn3cccc3)[C@H]2C1	1788712380	PDBVPCLWYCGPLF-OKYOBFRVSA-N	425.957	1.892	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnncc3C(=O)O)[C@H]2C1	1788889520	UMVREKCTFHEDKK-PCPUYYKTSA-N	445.303	1.004	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)c1ccc(OC(F)F)cc1	1790099320	HRVFKDWPOQJXPJ-HNKHHVNMSA-N	432.851	1.481	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CCc4nc[nH]c4C3)C[C@@H]21	1791064653	BIPGNNSYXUCPHB-WLZFUECHSA-N	439.354	1.278	50	20	IDGD	
Cc1cnn([C@@H](C)C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]32)c1	1791596919	MSXNOYFENYMOKL-SIBFUHKCSA-N	431.364	1.969	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C=C/c3cnccn3)[C@H]2C1	1791699529	JXVSUOMXPXHHCB-KOJYPYIBSA-N	437.338	1.643	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc3[nH]ncc3c1)C2	1792870748	KJVZTXGMMJYCCQ-HPEDKQMDSA-N	436.310	1.192	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1CC(O)C1	1793012079	PZYPFZXNMGASRC-PYGQZDJESA-N	429.945	1.528	50	20	IDGD	
Cc1ccc(S(=O)(=O)CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](O)CCl)cc1	1793109583	BXMVASLZVAVEMK-JYYAWHABSA-N	428.938	1.007	50	20	IDGD	
O=C(CCS(=O)(=O)c1ccccc1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2	1795301814	ZWSXHWVYURWBPZ-YWVIFJGQSA-N	449.356	1.244	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc[nH]c2nccc1-2	1796186378	HNSKCNZGXKUOBY-VZAMPYOESA-N	435.322	1.891	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](NC(C)C)C(C)C)C2	1796892269	UWCLVFZTTQVFAP-HFYDSOEISA-N	444.580	1.781	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2n(n1)CCCNC2=O	1797968323	QIGMTKCVPOGWSV-FVCCEPFGSA-N	438.326	1.052	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(Cl)cc2nn[nH]c12	1798619737	OOCHJFIUZGJAGL-FJHTZYQYSA-N	426.304	1.832	50	20	IDGD	
COc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Br)C3)c(OC)c1	1798822593	ZVCYTYVWSNZIDZ-OXUXUCFPSA-N	445.285	1.598	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)c1ccc(O)cc1	1799301639	VYVUOKSFJOYWQY-RPVAFNKOSA-N	425.323	1.869	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3nonc3c1)C2)[C@H](F)Br	1799346856	CUCDSARKMLUBOR-DJBIQUGXSA-N	427.230	1.117	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cn3c(F)cccc3n1)C2)[C@@H](F)Br	1799347882	YSEPKJAPDXPXNG-ANGCBRKESA-N	443.248	1.367	50	20	IDGD	
CCOC(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Br)OCC	1799351974	HAMASQKZMDSSNO-BAESOJJISA-N	425.295	1.056	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1[nH]nc3ccncc13)C2	1800640230	ZYAABSHIWWNIHZ-NDPMZMCLSA-N	436.310	1.335	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)CN(CC)CC)C2	1800643619	YISZRQHLRFUSTD-KSWRQPAISA-N	432.403	1.727	50	20	IDGD	
C[C@H](Oc1ccccc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)Br	1800762121	OHSONAPGPNFUBY-LBKYZSNHSA-N	425.323	1.827	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@H]1CCN(C(=O)C(=O)N(C)C)[C@H]1c1cccnc1	1803009514	WNKIYZUQRSWYRL-YUELXQCFSA-N	425.327	1.207	50	20	IDGD	
COc1ccccc1OCC(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]1c1cccnc1	1803136586	DBTZOXDSTOOYGD-LZJOCLMNSA-N	447.919	1.775	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)c2cnnn2C)[C@@H]1c1cccnc1	1804745555	AVNLJOKZEIOUMJ-DZKIICNBSA-N	435.326	1.703	50	20	IDGD	
Cc1cc(C(=O)NC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)c(C)o1	1805566769	MXKQHCZNXUMHRA-AVRDEDQJSA-N	441.532	1.984	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)CCN2CCN(C)CC2)[C@@H]1c1cccnc1	1806918089	YPUKQJZAEJJYNP-ZJOUEHCJSA-N	436.000	1.742	50	20	IDGD	
COc1nccc(C(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@H]2c2cccnc2)c1F	1807711227	KDTSLPRHAJGQQV-LXZKKBNFSA-N	436.871	1.544	50	20	IDGD	
C[C@H](C(=O)NC[C@@H]1CCN(C(=O)C(Cl)Cl)[C@@H]1c1cccnc1)N1CCN(C)CC1	1807877479	IWXWYFXLCULJOC-HYVNUMGLSA-N	442.391	1.527	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1CCN(C(=O)[C@H]2CNC(=O)C2)[C@@H]1c1cccnc1	1808317797	KPSICLWJZZMDKC-ZDXGLAPJSA-N	427.332	1.460	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2ccncc2F)[C@H]1c1cccnc1	1808887103	UMMOXWPIUCJTNW-HRAATJIYSA-N	442.495	1.308	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)c1cccc2c1OCCO2	1809232358	DKZWXZGLJVYNPM-IEZWGBDMSA-N	445.903	1.772	50	20	IDGD	
Cn1cc(CC(=O)N2CC[C@H](CNC(=O)CO[Si](C)(C)C)[C@@H]2c2cccnc2)cn1	1810547991	LAMVGRQMTMZTMT-NQIIRXRSSA-N	429.597	1.915	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)CSC(=N)N)[C@@H]1c1cccnc1	1812775561	ACZXHPBDZNVACL-VNHYZAJKSA-N	442.383	1.888	50	20	IDGD	
O=C(CN1CCCCC1=O)NC[C@@H]1CCN(C(=O)C(Cl)Cl)[C@H]1c1cccnc1	1812976498	GOHKOXPPOQJFGM-YOEHRIQHSA-N	427.332	1.904	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2cn3ncccc3n2)[C@H]1c1cccnc1	1813031287	SBEOMUDUMFDUDH-GJYPPUQNSA-N	442.907	1.698	50	20	IDGD	
Cc1nocc1C(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1813070572	JONPGKLBCYOIPW-JXFKEZNVSA-N	428.493	1.071	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)C(F)(F)Cl)[C@@H]1c1cccnc1	1813215639	ZQRADKNXLVVXTK-CJNGLKHVSA-N	431.871	1.292	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc3cccnc3nc2O)[nH]n1)[C@H](O)CCl	1814875001	LKQUAEPZIGTDLK-HUUCEWRRSA-N	444.879	1.964	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc[nH]n2)n[nH]1	1815372275	VSJJQXFLIOVRSZ-UPVZUOOXSA-N	437.464	1.573	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(C=O)s3)sc2C1	1815376465	DUPHBATWVYUSRA-NSHDSACASA-N	449.558	1.616	50	20	IDGD	
Cc1ccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)nc1	1816540692	AFTVAUAOMAQLES-LJQANCHMSA-N	433.277	1.413	50	20	IDGD	
O=C(N[C@H]1CCc2nc(NC(=O)[C@@H](F)Cl)sc2C1)c1cnc2c(c1)CCNCC2	1817134469	NVJDYAZYURJXPR-BLLLJJGKSA-N	437.928	1.987	50	20	IDGD	
N[C@@H](Cc1cscn1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1	1817976135	MDCDTGSGRRMAGU-FPMFFAJLSA-N	426.930	1.028	50	20	IDGD	
Cc1cc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)[C@H](O)CCl)[nH]n2)ncc1[N+](=O)[O-]	1818262466	UDCGJUJZWXIXBM-DZGCQCFKSA-N	436.856	1.927	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)Cc2ccccn2)[nH]n1	1819403142	WABAXEBLEINLEK-GOSISDBHSA-N	448.487	1.352	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)C2=COCCC2)[nH]n1	1819404789	YZYKAACWDAVZNP-KRWDZBQOSA-N	439.476	1.408	50	20	IDGD	
Cc1nc(C)c(C(=O)Nc2cc([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)o1	1819803214	CPIBKRAXVBGIFY-OAHLLOKOSA-N	431.497	1.693	50	20	IDGD	
CCc1nc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)co1	1819897611	PENWWYQPWCYBQG-HNNXBMFYSA-N	431.497	1.639	50	20	IDGD	
CS(=O)(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](F)Br)n[nH]1	1820936522	BGZICBFMDKPWGU-MFKMUULPSA-N	439.307	1.527	50	20	IDGD	
COc1ccc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@H](O)CCl)CC3)cc1OC	1822102610	WDIBSTNIIIYWTB-WCQYABFASA-N	439.921	1.986	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(C#N)c[nH]2)[nH]n1	1822415136	UKSCHCNSFLJCIH-MRXNPFEDSA-N	426.481	1.288	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2CCC(=O)NC2)CC1	1823842850	GNAKNCDJKJCOPU-IMJJTQAJSA-N	428.371	1.916	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)C(O)O)CC1	1824025182	VYQDOFHCFBBDFX-KRWDZBQOSA-N	449.460	1.064	50	20	IDGD	
Cc1cccnc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1	1824701406	AENJXULLXXBVCY-LJQANCHMSA-N	429.565	1.996	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)COc2cccnc2)CC1	1825067762	BVQJYYAQESNFKP-FQEVSTJZSA-N	445.564	1.453	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)C[C@@H]2NC(=O)NC2=O)CC1	1825069936	GHKFUXREJRMWBM-GJZGRUSLSA-N	426.945	1.469	50	20	IDGD	
COC(=O)C1(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)CCBr)CC3)CC1	1825273814	SZXHSPXHEKWAPJ-SECBINFHSA-N	430.324	1.793	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](CC)NC(N)=O)CC2	1825446887	KCLHNSSEIYJOQI-KXUCPTDWSA-N	446.371	1.676	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1nc[nH]c1[N+](=O)[O-])CC2	1825641086	MTBUHGINSLZEKH-BQBZGAKWSA-N	443.283	1.784	50	20	IDGD	
C=C(C(=O)N[C@@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1)C(F)(F)F	1826090177	YJVWHNHJFCDMJM-SNVBAGLBSA-N	433.456	1.547	50	20	IDGD	
C[C@@]1(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2ccc(B(O)O)cc2)CC3)CC=CCC1	1827221563	SDAIHAYQTUYPPT-KSFYIVLOSA-N	439.346	1.795	50	20	IDGD	
O=C(C(Cl)Cl)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CCc3ccoc3C1)CCO2	1830940301	IDLPITNYJCGJKG-IFXJQAMLSA-N	431.316	1.645	50	20	IDGD	
CNC(=S)NCCC(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H](Cl)COC)CC1	1831830480	CYEFATFVODUMLO-JKSUJKDBSA-N	433.018	1.344	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CNC(=O)c2ccco2)CC1	1831830871	XZCOPDYHAZNJCK-DLBZAZTESA-N	439.940	1.883	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)C(=O)c2cccn2C)CC1	1831876270	CIRXSVSRADEJMU-SFHVURJKSA-N	445.564	1.201	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2C[C@@]2(F)Cl)CC1	1831959278	SFINUHIXZROCAE-WFXMLNOXSA-N	436.720	1.524	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)/C=C/c3ccco3)CCO2)C1	1833069216	LJNBVJHGVZZCQK-LTGPNDRFSA-N	441.322	1.780	50	20	IDGD	
CC(C)(CCl)C(=O)NC1CCN(C2CCN(C(=O)CCc3nc(N)n[nH]3)CC2)CC1	1833214591	GJBZCRBMLIXEPR-UHFFFAOYSA-N	439.992	1.156	50	20	IDGD	
Cc1noc(C)c1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1834068690	IHWUBTJWAQGOLM-CZUORRHYSA-N	434.262	1.052	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1)c1cnccn1	1834123236	PUNGKLCGSQHUAA-OAHLLOKOSA-N	428.306	1.352	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC(N2CCC(NC(=O)CC(F)(F)C(=O)O)CC2)CC1	1835074074	FYIVYRLYYOBSBT-UHFFFAOYSA-N	449.571	1.520	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CC(F)(F)F)CCO2)C1	1835336216	BLUFUVAYZYAATF-SMDDNHRTSA-N	431.249	1.569	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)NC(=O)OCC)CC2)CC1	1835642769	QYIRSQIVBHCUPS-SJLPKXTDSA-N	446.976	1.030	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3cscn3)CCO2)C1	1836037488	MMYDCOYNHLOMGX-DYVFJYSZSA-N	446.367	1.173	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCC(OC2CCN(C(=O)Cn3ccncc3=O)CC2)CC1	1836624217	GRIINVJZKKZACH-UHFFFAOYSA-N	438.956	1.507	50	20	IDGD	
O=C([C@@H](O)CCl)N1CCC(OC2CCN(C(=O)[C@@H]3CCc4nc[nH]c4C3)CC2)CC1	1836720356	RDNLHOGXSLHNBV-KUHUBIRLSA-N	438.956	1.113	50	20	IDGD	
O=C(c1cc(Cl)cc(Cl)n1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1838240003	FXNDEDRCAKEAEB-CJNGLKHVSA-N	440.686	1.993	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccccc3OC)CCO2)C1	1838877770	XYVURPPEGIEHLO-UZLBHIALSA-N	426.897	1.019	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(F)c(F)c3)CCO2)C1	1839011743	XXZDVUFATJTICL-XIKOKIGWSA-N	447.276	1.818	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnn(C(C)(C)C)c3)C2)C1	1839143253	PYACOZZQBYMUGA-UZLBHIALSA-N	426.945	1.726	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc4cccnn4c3)CCO2)C1	1839559514	LZVQIDDATASGHF-RXVVDRJESA-N	434.924	1.812	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)/C=C/c3cccnc3)C2)C1	1840031000	BYXUEVUHZWWXEC-UPILZFLTSA-N	438.322	1.335	50	20	IDGD	
C/C(=C\c1cccnc1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840190741	KVFSXTPTANUAKN-CECLQJIQSA-N	428.316	1.745	50	20	IDGD	
O=C(c1ccc(OC(F)(F)F)cc1)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843014618	GWZSOSXHJPALTI-UHFFFAOYSA-N	448.206	1.396	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1ccnc3ccccc13)C2	1844264145	KTKYOHLUXSFQIU-UHFFFAOYSA-N	430.468	1.364	50	20	IDGD	
CN(CC(=O)N1CCCC12CN(C(=O)c1nccs1)C2)NC(=O)NCc1ccccc1	1845038423	AOUFFZGMXSMEHV-UHFFFAOYSA-N	442.545	1.306	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CCc1c(C)noc1C	1848227966	VSQDEMKHPFOTMS-XLXMKANJSA-N	440.504	1.560	50	20	IDGD	
O=C(CCN1C(=O)c2ccccc2C1=O)NNC(=O)COc1ccc(Br)cc1	3069546	GLUKGBWNKYNNPL-UHFFFAOYSA-N	446.257	1.662	50	20	IDGD	
CSCC[C@@H](NC(=O)c1ccc(Cl)cc1Cl)C(=O)NNC(=O)C(=O)NC1CC1	9889198	VXCGXGAUHKLOKQ-CYBMUJFWSA-N	447.344	1.271	50	20	IDGD	
O=C(COC(=O)COc1ccc2ccccc2c1)NNC(=O)[C@H]1COc2ccccc2O1	10592019	ILUSIUXUSUCZBJ-HXUWFJFHSA-N	436.420	1.749	50	20	IDGD	
Cc1nnc(NNC(=O)CCc2ccc(S(=O)(=O)N3CCCCCC3)cc2)[nH]c1=O	11548005	LCCNDLHEGRMDIY-UHFFFAOYSA-N	434.522	1.114	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@H](C(=O)NNC(=O)CCc3ccccc3O)C2)cc1	21775933	SLPCQTAPLCASKQ-SFHVURJKSA-N	445.541	1.882	50	20	IDGD	
COc1cccc(CCC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c1	28028408	KGJAHSIPMRLXAD-UHFFFAOYSA-N	447.513	1.110	50	20	IDGD	
CC(C)Cn1c(SCC(=O)NNC(=O)c2ccc(F)cc2)nnc1N1CCOCC1	45427451	IICZPCIUAMZZNR-UHFFFAOYSA-N	436.513	1.463	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN(Cc2ccccc2)[C@@H](C)CN2CCOCC2)n1	111054557	GTMMATNWDRLELS-SFHVURJKSA-N	445.589	1.364	50	20	IDGD	
CCS(=O)(=O)Nc1ccccc1C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	726862788	BCUAPLNAJXKZDE-UHFFFAOYSA-N	438.531	1.646	50	20	IDGD	
O=C(NCCc1cccc(O)c1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	727239389	BMOMYSFRDXBGCA-UHFFFAOYSA-N	432.502	1.363	50	20	IDGD	
CN(C)Cc1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1	727870077	ZFIGVZSSYPYRDO-UHFFFAOYSA-N	430.530	1.608	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(CCNC(=O)NNC(=O)CCCc2ccccc2)CC1	727941339	RFMPILXYGUNHJW-UHFFFAOYSA-N	433.553	1.892	50	20	IDGD	
NC(=O)c1ccc(/C=C\C(=O)N2CCC[C@H]2C(=O)NNc2nc(-c3ccccc3)no2)cc1	728079374	GWHUTBPPGIAVFI-GFBZKKKVSA-N	446.467	1.983	50	20	IDGD	
CCCCNC(=O)NNS(=O)(=O)c1ccc(S(=O)(=O)N2C[C@@H](C)C[C@@H](C)C2)cc1	728263258	WIFWXMQRJDLCRW-GASCZTMLSA-N	446.595	1.646	50	20	IDGD	
CCCN(C)c1ccc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1	728338508	KUVFULYJOTYUET-LJQANCHMSA-N	427.457	1.677	50	20	IDGD	
O=C(COC(=O)c1ccccc1OCC1CC1)NNC(=O)[C@@H]1COc2ccccc2O1	728344965	UVVMNSUWUGVMPE-IBGZPJMESA-N	426.425	1.620	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)CSc3ccc(C#N)cc3)cc2)CC1	728607014	UMYRNLYFSCTJDY-UHFFFAOYSA-N	445.570	1.730	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)C2(c3ccc(F)cc3)CCOCC2)n1	728729950	WCBURKRHPOVORW-UHFFFAOYSA-N	435.477	1.572	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)NCCc2cccc(C(N)=O)c2)c1	728751009	DQDYYHDHAGKBEZ-UHFFFAOYSA-N	435.278	1.743	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)c2sccc2S(=O)(=O)N2CCSCC2)c1	728826562	NXHIPUJHZUMGBO-UHFFFAOYSA-N	436.540	1.432	50	20	IDGD	
Cc1ccc(-c2noc(CN3CCN(C(=O)NNC(=O)Cc4cccnc4)CC3)n2)cc1	728957531	XGPQOALDJFJLKY-UHFFFAOYSA-N	435.488	1.541	50	20	IDGD	
Cc1nn(Cc2ccccc2Cl)c(Cl)c1C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O	729276550	GOKJWFSDYZBBHB-SNVBAGLBSA-N	448.332	1.245	50	20	IDGD	
O=C(CCSCc1nc(O)c2c3c(sc2n1)CCCC3)NNC(=O)c1cnn[nH]1	729456596	UYWLSULAUSQUKU-UHFFFAOYSA-N	433.519	1.478	50	20	IDGD	
O=C(NNC(=O)[C@@H](c1ccccc1)N1CCC(O)CC1)C1CCN(c2ncccn2)CC1	729536950	OZDQYOOOFAFPOW-HXUWFJFHSA-N	438.532	1.038	50	20	IDGD	
Cc1ccc([C@H](CNC(=O)NNC(=O)Cn2ccc3ccccc32)N2CCOCC2)o1	729585370	DJZAQTWRWFKJQL-IBGZPJMESA-N	425.489	1.947	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)N(C)C1CC1	729617677	SIGFYYXWRUAFCD-OAHLLOKOSA-N	437.566	1.288	50	20	IDGD	
CN(C)c1ccc(NC(=S)NNC(=O)c2cccc(S(=O)(=O)NC3CC3)c2)cc1	729690567	CTWMSMWYYDOBSK-UHFFFAOYSA-N	433.559	1.825	50	20	IDGD	
O=C(NCCN1CCN(Cc2ccccc2)CC1)NNC(=O)c1cccc2ncccc12	730113631	XVPKCHBMCFOTAJ-UHFFFAOYSA-N	432.528	1.997	50	20	IDGD	
CC/C=C(\C)C(=O)N1CSC[C@@H]1C(=O)OCC(=O)NNC(=O)c1cccc(Cl)c1	730318752	BTJQOVNZFIBZOY-FDYAIDJWSA-N	439.921	1.902	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)[C@H](CC(C)C)/N=C1/NS(=O)(=O)c2ccccc21	731494164	RECNBMKVQHFMAP-INIZCTEOSA-N	444.513	1.610	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)N1CCN(C(=O)c2ccc(OCc3ccccc3)cc2)CC1	732197104	CSRXBOVWZLLIKI-SFHVURJKSA-N	438.528	1.969	50	20	IDGD	
CN(CC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)[C@H]1CCN(c2ccccc2Cl)C1=O	732206961	IAAWAOLFIBSDQM-KRWDZBQOSA-N	445.863	1.747	50	20	IDGD	
Cc1ccccc1-n1ccnc1SCC(=O)NNC(=O)CCN1C[C@H](C)O[C@H](C)C1	732265147	ZVQKAKWTEVJUGA-CALCHBBNSA-N	431.562	1.920	50	20	IDGD	
Cc1cc(C(=O)NNc2ccccc2S(C)(=O)=O)cc(S(=O)(=O)N(C)C)c1C	732303938	OQAVDPUAJVOITQ-UHFFFAOYSA-N	425.532	1.714	50	20	IDGD	
C[C@@]1(c2ccccc2)NC(=O)N(CC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)C1=O	733110450	MJMQWEFNFFNXTE-QFIPXVFZSA-N	432.440	1.101	50	20	IDGD	
CC(C)CNS(=O)(=O)c1ccc(C(=O)NNc2nc3ccccc3c(=O)n2C)cc1	733261097	JRZITEPVYCIFNI-UHFFFAOYSA-N	429.502	1.625	50	20	IDGD	
Cc1noc(C)c1[C@@H](C)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	733851408	XWKLILXMTSFSJM-GFCCVEGCSA-N	435.506	1.781	50	20	IDGD	
Cc1c(NC(=O)[C@@H](C)SCC(=O)NNc2cnccn2)c(=O)n(-c2ccccc2)n1C	734245210	MKVOGFDWNCBWGH-CQSZACIVSA-N	441.517	1.478	50	20	IDGD	
Cc1nc2nc(N)nn2c(C)c1CC(=O)NNc1ccccc1S(=O)(=O)NC(C)(C)C	734251403	DXUOOPHOXIIYIG-UHFFFAOYSA-N	446.537	1.086	50	20	IDGD	
CC(C)Oc1ccc([C@H](O)CNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1	734862100	URWWCWOWKTUSSS-LJQANCHMSA-N	442.520	1.544	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)[C@@H](Cc1ccccc1)NC(=O)c1cccnc1	737926935	PRHLQCYAMUTLBT-OAQYLSRUSA-N	432.480	1.787	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)c1ccc(F)c(S(=O)(=O)N2CCCCC2)c1	740851700	RKMZDZQNLXSHGH-UHFFFAOYSA-N	442.513	1.066	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)[C@H]1CSCN1C(=O)c1ccc(Cl)cc1	740852075	JKJUTXVIHRLFJK-CQSZACIVSA-N	426.926	1.307	50	20	IDGD	
COc1ccc([C@H](CC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)NC(C)=O)cc1	743830448	FHCVJSDBZMPTMZ-SFHVURJKSA-N	448.501	1.519	50	20	IDGD	
COc1cc(C=O)ccc1OCC(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	744621032	MNIJEBXRDWJZLE-UHFFFAOYSA-N	449.485	1.051	50	20	IDGD	
Cc1ccccc1O[C@H](C)CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	745887571	OPZDGKLTFGVRKW-OAHLLOKOSA-N	434.518	1.657	50	20	IDGD	
Cc1ccc(N2CCC[C@H](NC(=O)NNC(=O)c3csc(N4CCOCC4)n3)C2)cc1	745888175	NILFEJRBMMFSFN-INIZCTEOSA-N	444.561	1.901	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)N(C)CC(=O)NNc2cc(F)c(F)c(F)c2)cc1	746704092	SQXKCNBLHUZGJG-UHFFFAOYSA-N	430.408	1.826	50	20	IDGD	
N#Cc1ccc(NNC(=O)[C@H]2CC(=O)N(CCN3CCOCC3)C2)cc1C(F)(F)F	746895016	ASFQXYBHZXJPDN-AWEZNQCLSA-N	425.411	1.201	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1=O	747586823	OKTVADCAUCTZAG-MRXNPFEDSA-N	433.415	1.752	50	20	IDGD	
CN(C)Cc1cccc(NC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)c1	747823037	FAYLYIRZSREUGS-UHFFFAOYSA-N	446.577	1.833	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)(F)F)cc1)[C@@H]1CC[C@@H](C(F)(F)F)NC1=O	748517978	BWQKXFONBODJDU-ZJUUUORDSA-N	433.330	1.880	50	20	IDGD	
Cc1nc([N+](=O)[O-])cn1CCC(=O)NNC(=O)c1ccc(CSc2nncn2C)cc1	748696699	QDSLWUJDZCHTRD-UHFFFAOYSA-N	444.477	1.372	50	20	IDGD	
CC(C)S(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)NC2CCCCC2)cc1F	749751870	VRKMESNZHDLIFG-UHFFFAOYSA-N	436.531	1.801	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C2=NN(c3ccccc3)[C@H](C(C)=O)C2)c2ccccc2c1=O	750863277	ZUSSMVPVKFQIJN-IBGZPJMESA-N	446.467	1.401	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-]	751206757	SIWIMNQYFXPDSX-UHFFFAOYSA-N	446.363	1.788	50	20	IDGD	
CSCC[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)NNC(=S)N[C@@H](C)C1CC1	751618663	IUXFBKNLRZDEOE-XHDPSFHLSA-N	439.563	1.740	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1	752238542	RRZMDXMHSDTKFN-AWEZNQCLSA-N	447.473	1.160	50	20	IDGD	
COc1cc(C(=O)NNC(=O)COc2cc(C)ccc2C(C)C)sc1S(N)(=O)=O	754188220	COGXTBQQOCMGQH-UHFFFAOYSA-N	441.531	1.676	50	20	IDGD	
N#C/C(=C/c1ccc(O)cc1)C(=O)OCC(=O)N(C[C@@H]1CCCO1)[C@H]1CCS(=O)(=O)C1	754536537	KLYWZULWJBZRGX-BUDCBXOLSA-N	448.497	1.037	50	20	IDGD	
C[C@@H]1CCCN(S(=O)(=O)c2ccc(NC(=O)NNC(=O)Cc3cccnc3)cc2)C1	755447171	JSOFQVACBSKCII-OAHLLOKOSA-N	431.518	1.898	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N(C)C[C@@H](O)C2CC2)cc1	755519619	XCCDNCYIUFXYLH-FVECTHPASA-N	437.500	1.570	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)n([C@@H]2CCS(=O)(=O)C2)n1	755530184	FUKZFISQUSBSGV-GXTWGEPZSA-N	439.469	1.310	50	20	IDGD	
Cc1oc(C(=O)NNC(=O)[C@@H](C)Oc2cccc(Br)c2)cc1S(N)(=O)=O	755625174	GSPUZTHAOHNKCR-SECBINFHSA-N	446.279	1.226	50	20	IDGD	
NC(=O)c1ccc(NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc1F	756350935	HROAJOPYFFVYEG-UHFFFAOYSA-N	449.464	1.176	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)CNC(=O)c2ccccc2C(F)(F)F)cc1	756728630	VOZMMAKDVHQXGP-UHFFFAOYSA-N	448.357	1.311	50	20	IDGD	
CNC(=O)Cn1ccc2ccc(NC(=O)NNC(=O)c3cc(OC)cc(OC)c3)cc21	756762679	QHTMBHVAUDXAHX-UHFFFAOYSA-N	425.445	1.871	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)Nc1ccc(S(=O)(=O)NCC2CC2)cc1	756782370	BBQIBMBXQBAOTM-UHFFFAOYSA-N	433.446	1.750	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)Nc2c(C)nn([C@H]3CCS(=O)(=O)C3)c2C)c1	757871252	HFJPDKOKXYMAAZ-HNNXBMFYSA-N	435.506	1.400	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)c2cccc(I)c2O)c1O	757873998	OFXJZSAXXMEFFN-UHFFFAOYSA-N	428.182	1.786	50	20	IDGD	
Cc1cc([N+](=O)[O-])c(C)c(S(=O)(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)c1	758164128	TXUBOZSTOGWHLV-UHFFFAOYSA-N	440.865	1.491	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)C(C)(C)NC(=O)C(F)(F)F	759122705	KAHNJRLCQUMYQN-UHFFFAOYSA-N	439.774	1.110	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2cc(S(=O)(=O)N(C)C)ccc2N2CCCCC2)n[nH]1	763137380	RMZIAFUXIDWNPR-UHFFFAOYSA-N	434.522	1.034	50	20	IDGD	
Cc1cc([N+](=O)[O-])c(S(=O)(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)cc1C	763438531	AHAXEXQORRELFT-UHFFFAOYSA-N	430.483	1.826	50	20	IDGD	
O=C(Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccncc2)cc1)Nc1ccccc1F	763465081	VTOWZKWHWGRMAQ-UHFFFAOYSA-N	435.415	1.802	50	20	IDGD	
CN1CCC(N(C)c2ccc(NC(=O)C(=O)NNC(=O)c3ccccc3O)cc2)CC1	763530806	IDJRXJWDLOLWGX-UHFFFAOYSA-N	425.489	1.322	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(N3CCSCC3)cc2)c1	763619622	YURLDRCCOHGGLC-UHFFFAOYSA-N	428.514	1.713	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cc(Cl)ccc2C(=O)N(C)C)cc1C	763667808	VVAVLFWQBUXHDE-UHFFFAOYSA-N	446.891	1.824	50	20	IDGD	
CCCOc1ccccc1NC(=O)C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	763718984	SRVUHKJEAZQFSY-UHFFFAOYSA-N	448.501	1.125	50	20	IDGD	
Cc1nc(COc2ccc(NC(=O)C(=O)NNC(=O)c3cc4c(s3)CCC4)cc2)no1	763783078	ZZUKJIYRAOKUCH-UHFFFAOYSA-N	441.469	1.907	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2cc(OC)ccc2Cl)c2ccccc2c1=O	763785042	BLCKTNYXDOYCIS-UHFFFAOYSA-N	443.847	1.478	50	20	IDGD	
COCC[S@@](=O)Cc1cccc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCC3)c1	763786202	XDAYBKUMVPOFKQ-SSEXGKCCSA-N	449.554	1.532	50	20	IDGD	
Cc1nc2ccc(NC(=O)C(=O)NNC(=O)c3nn(C(C)C)c(=O)c4ccccc34)cc2o1	763790482	KAQDFNXTWVAMRY-UHFFFAOYSA-N	448.439	1.827	50	20	IDGD	
CC[C@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)cc1	763806938	JTMNWZSIJLQOBH-AWEZNQCLSA-N	437.456	1.251	50	20	IDGD	
Cc1cc(C(=O)NCC(C)C)ccc1NC(=O)C(=O)NNC(=O)COc1ccc(F)cc1	763838277	RZCUHDWOEWQVAB-UHFFFAOYSA-N	444.463	1.685	50	20	IDGD	
CC(=O)N(C)c1cccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)c1	763851336	SFEHXLXQSVHLNU-OAHLLOKOSA-N	426.473	1.840	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccn(CCc2ccncc2)n1	763865881	SHAHIUGHBWCDCG-AWEZNQCLSA-N	440.435	1.213	50	20	IDGD	
CCNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(C(C)=O)cc2)c1	763871644	GRMQLKIRFCJSOB-CQSZACIVSA-N	440.456	1.192	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cccc3c2OCCC3=O)cc1	763872270	MZTBUFMNLXLPOX-ZDUSSCGKSA-N	439.424	1.408	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cnc(N(C)C)nc2)ccc1OCCC(C)C	763914448	LRWHFMDALYQOCG-UHFFFAOYSA-N	444.492	1.376	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)C(=O)Nc1nc(-c2cccs2)cs1	763917310	UJVCLSJZIQUNAR-UHFFFAOYSA-N	440.470	1.247	50	20	IDGD	
CCNC(=O)N1CCc2ccc(NC(=O)C(=O)NNC(=O)c3cc(Cl)ccc3O)cc21	763974828	YPYXRMQVMDNDJQ-UHFFFAOYSA-N	445.863	1.537	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)CCN2C(=O)OC(C)(C)C	763998057	FKRWJCVEHWLJHC-UHFFFAOYSA-N	427.461	1.722	50	20	IDGD	
Cc1nccc(-c2cccc(NC(=O)C(=O)NNC(=O)c3ccc4c(c3)OCCO4)c2)n1	764003600	IWISBFONQSZFAQ-UHFFFAOYSA-N	433.424	1.623	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(N3C[C@H](C)O[C@H](C)C3)nc2)c(O)c1	764104607	BQECSDWZYGBUJS-OKILXGFUSA-N	427.461	1.109	50	20	IDGD	
C[C@H](c1cccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)c1)N1CCOCC1	764117189	OHQKWKSPPHQMBZ-CYBMUJFWSA-N	446.891	1.839	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2cnn(-c3ccccc3F)c2)cc1	764124513	JPEMNANOWMVHDA-UHFFFAOYSA-N	425.420	1.739	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccccc2OC)cc1Cl	764136481	RBGNKSJMAIPZTH-UHFFFAOYSA-N	435.864	1.702	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)sc2c1CCC2	764164490	QNKJMKGHKQDKGH-CQSZACIVSA-N	443.481	1.503	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)C(=O)Nc2cccnc2Cl)c1	764231301	OCTSOIQYORYVPP-UHFFFAOYSA-N	427.642	1.906	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)ccc1O)C(=O)Nc1ccc(C(F)(F)F)nc1	764281001	VPLLCEUFGGQSEO-UHFFFAOYSA-N	447.167	1.968	50	20	IDGD	
CCOCC(=O)NNC(=O)C(=O)Nc1c(Br)cc(F)cc1Br	764325709	RHUICHPEKCDCAV-UHFFFAOYSA-N	441.051	1.473	50	20	IDGD	
Cc1ccc(NC(=O)Nc2ccccc2)cc1NC(=O)C(=O)NNC(=O)c1cnn(C)c1	764359205	MICHWTNSXXXCGM-UHFFFAOYSA-N	435.444	1.772	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2cccc(CN(C)C)c2)n[nH]1	764377978	UMHQMFJNDYJLSN-UHFFFAOYSA-N	436.472	1.547	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc(-n4cccn4)nc3)n[nH]2)cc1	764384723	KCNJUSMHZBUWTR-UHFFFAOYSA-N	444.455	1.620	50	20	IDGD	
COc1nccnc1NNC(=O)[C@@H](CCSC)NS(=O)(=O)/C=C/c1ccccc1	764465495	YIXARMWOJVJCDB-BMQCOBNYSA-N	437.547	1.640	50	20	IDGD	
CC(C)(C)NS(=O)(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)OC(C)(C)C)c1	765398050	DKKOGWOJFNPBDW-UHFFFAOYSA-N	428.511	1.399	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)C[C@H]2CN(C(=O)OC(C)(C)C)CCO2)cn1	765450924	YQFYTYAWFZQFBM-ZDUSSCGKSA-N	425.511	1.434	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)c3ccc(Cl)o3)CC2)cc1	765729395	QKGFZJGRXKKVDD-UHFFFAOYSA-N	440.909	1.009	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cc(-c4ccccn4)no3)CC2)cc1	766647231	BQOPJPSPNIIOFW-UHFFFAOYSA-N	434.500	1.624	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)CN1CCCN(C(=O)Cc2cccc(F)c2)CC1	766914283	VTRXQELRUHWQGI-UHFFFAOYSA-N	440.519	1.601	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CO[C@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1OC	767778730	CSLKSMJBSGIZIM-HNNXBMFYSA-N	437.493	1.881	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1C	767825846	UOVIXZSLSNGBCI-UHFFFAOYSA-N	435.502	1.159	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)Nc1ccc(C)c(S(N)(=O)=O)c1	769243177	VZTFRQMTQLOSSL-UHFFFAOYSA-N	428.492	1.203	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1cnn(-c2ccccc2)c1C(F)(F)F	769266275	MRRLPNSKBRQRPL-LLVKDONJSA-N	443.382	1.029	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)N[C@@H]1CCCN(CC(F)(F)F)C1=O	770659363	RDODQYSTUBTRBC-ZWNOBZJWSA-N	436.818	1.991	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)[C@@H]2CC(=O)N(c3c(F)cccc3F)C2)c1	771152654	BEJAKKCHMJEFET-CQSZACIVSA-N	442.378	1.194	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)c1ccc2c(c1)C(=O)N(Cc1ccco1)C2=O	771854732	FDTFGWLKXOLCBD-CYBMUJFWSA-N	441.440	1.815	50	20	IDGD	
COC(=O)c1cc(N2CCOCC2)ccc1NC(=O)C(=O)NNc1ccc([N+](=O)[O-])cc1	773639495	QOIJIRZMSFVRHL-UHFFFAOYSA-N	443.416	1.300	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNc2ccc(C#N)cc2)cc(OC)c(OC)c1OC	773697486	RGMVODFTEIITBP-UHFFFAOYSA-N	442.428	1.843	50	20	IDGD	
O=C(NNC(=O)N1CC[C@]2(C1)C(=O)Nc1ccccc12)C1CCN(c2ncccn2)CC1	777508227	MAHNWSNXWIPIFW-JOCHJYFZSA-N	435.488	1.030	50	20	IDGD	
O=C1CCCN1Cc1ccc(C(=O)N2CCN(S(=O)(=O)CBr)CC2)cc1	777831717	IDTXZTUGJRETEA-UHFFFAOYSA-N	444.351	1.249	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2c(Cl)cccc2S(C)(=O)=O)cc(OC)c1OC	777840797	LTUMPXJDLODJPV-UHFFFAOYSA-N	442.877	1.844	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)[C@@H]1CCCN(C(=O)CCOc2ccccc2)C1	778437246	WFYMQXBUZZBORN-MRXNPFEDSA-N	448.520	1.366	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@H]2CC(=O)N(c3ccc(F)c(C)c3)C2)cc(OC)c1OC	779719945	OXSARAGBYMFJMM-AWEZNQCLSA-N	445.447	1.974	50	20	IDGD	
Cc1cc(Br)cc(S(=O)(=O)NNC(=O)CNC(=O)c2cccs2)c1	780383140	SIZXNRXHUGOICB-UHFFFAOYSA-N	432.321	1.559	50	20	IDGD	
CCNC(=O)N(C)NC(=O)c1cc(S(=O)(=O)N2CCc3ccccc32)ccc1OC	780708621	IDXKVRMMIDIECL-UHFFFAOYSA-N	432.502	1.753	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(OC3COC3)cc2)ccc1OC(C)C	782120559	JSIFOMUGBRFOBG-UHFFFAOYSA-N	443.456	1.660	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)cc1)C(=O)Nc1cc(Br)cnc1-n1cccn1	782834589	YVWSCWJDVPBNBD-UHFFFAOYSA-N	445.233	1.135	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)C(=O)Nc1ccccc1OCC(F)(F)F	785067154	HQWJTIRXJINRMB-UHFFFAOYSA-N	435.362	1.604	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1ccccc1N1CCCC1	785330418	HCGWSRUBXISDRM-UHFFFAOYSA-N	432.502	1.781	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cc([N+](=O)[O-])ccc3N)CC2)cc1	787127162	QSZXUNGKDCFACN-UHFFFAOYSA-N	426.477	1.064	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COCCO1)C(=O)Nc1ccc(-c2ccc(Cl)cc2Cl)nc1	789586551	PVAJBKOGSFRWBT-HNNXBMFYSA-N	439.255	1.557	50	20	IDGD	
COc1cc(NNC(=O)C(=O)Nc2ccc(OC)c(-n3nnnc3C)c2)ccc1Cl	789796482	WQNOQZJSYZUONL-UHFFFAOYSA-N	431.840	1.723	50	20	IDGD	
CNS(=O)(=O)c1cccc(NC(=O)C(=O)NNc2ccc(Cl)c(OC)c2)c1C	789796856	LRGYRBFPQSBQLD-UHFFFAOYSA-N	426.882	1.647	50	20	IDGD	
CCOC(=O)c1ccccc1NC(=O)C(=O)NNC(=O)[C@H]1OCC[C@H]1c1ccccc1	789810951	ATWKFGRTVASPJC-YJBOKZPZSA-N	425.441	1.522	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(N2C[C@@H](C(=O)NNc3ncccc3C)CC2=O)cc1	791224095	OXXYOOKPICCBDV-INIZCTEOSA-N	445.545	1.917	50	20	IDGD	
O=C(NNC(=O)[C@H](NC(=O)c1ccccc1)c1ccccc1)c1ccc(-n2cnnn2)cc1	793120355	BEKRFDSXPRVXSP-HXUWFJFHSA-N	441.451	1.595	50	20	IDGD	
CCC[C@](C)(CC)C(=O)NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1	793673102	CXXOBAJTICUTCU-NRFANRHFSA-N	438.594	1.665	50	20	IDGD	
CS(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)c2cc3c(s2)CCCCCC3)cn1	794576481	KEJAGASEGZNUQG-UHFFFAOYSA-N	443.572	1.829	50	20	IDGD	
Cn1cc(-c2cc(F)ccc2NC(=O)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cn1	796991800	PCRGLDBBQNTMHF-UHFFFAOYSA-N	426.364	1.534	50	20	IDGD	
Cc1ccccc1NC(=O)NNC(=O)Cc1ccc(S(=O)(=O)N2CCOCC2)s1	798311924	KYUNIDVYBDOTMR-UHFFFAOYSA-N	438.531	1.473	50	20	IDGD	
CCCn1c(=O)nc(O)c2c(C(=O)NNC(=O)NCC(F)(F)F)cc(C(C)C)nc21	798314682	WTAFMPVWPUMADS-UHFFFAOYSA-N	430.387	1.537	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@@H]1CC(C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)=NO1	798986523	QJGOIRRYCJYPGI-JTQLQIEISA-N	434.478	1.569	50	20	IDGD	
CCc1cccc(C)c1NNC(=O)C(=O)Nc1ccc(CC(=O)N2CCN(C)CC2)cc1	799843327	UVNUNPCLDMMTSM-UHFFFAOYSA-N	437.544	1.956	50	20	IDGD	
CC[C@](O)(C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1)c1cccc(Cl)c1	800320188	SZKMKZFSOSFMLL-DYESRHJHSA-N	448.859	1.468	50	20	IDGD	
Cc1c([N+](=O)[O-])ccc(F)c1NC(=O)C(=O)NNC(=O)CNC(=O)OCc1ccccc1	800634302	GYBHEEVQLRBVMY-UHFFFAOYSA-N	447.379	1.055	50	20	IDGD	
COC(=O)c1c(F)cc(NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1F	801843284	JTRSFHHTLCXOSQ-UHFFFAOYSA-N	434.403	1.611	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N1CCOC[C@@H]1[C@H]1CCCO1	804881926	ZLVIFFLOBPZZFO-APHBMKBZSA-N	442.310	1.837	50	20	IDGD	
O=S(=O)(CBr)N1CCN(S(=O)(=O)c2ccc(C(F)F)cc2)CC1	805060515	DANAIZUVXWFHLD-UHFFFAOYSA-N	433.296	1.613	50	20	IDGD	
CS(=O)(=O)CCOCCNC(=O)NNc1ccc(-c2cccc(C(F)(F)F)c2)nn1	805150551	FXTPLHBSZMIFMG-UHFFFAOYSA-N	447.439	1.850	50	20	IDGD	
O=C(COCc1cccnc1)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	805191752	QIJDISFIYMBIIP-UHFFFAOYSA-N	431.924	1.217	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)nn1-c1ccc(F)cc1F	808934401	DDFCDEUIGBCWFR-UHFFFAOYSA-N	447.373	1.763	50	20	IDGD	
N#Cc1cccc(S(=O)(=O)NCC(=O)NNc2nc(-c3ccccn3)nc3c2CCC3)c1	810442351	QBAWKTRJPPJQQZ-UHFFFAOYSA-N	449.496	1.321	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)N1CCC(c2noc3cc(F)ccc23)CC1	811871842	IMIRJLYCWMUNIE-UHFFFAOYSA-N	429.408	1.910	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)NCc2ccc(CC(N)=O)cc2)c2ccccc2c1=O	812481579	NRBPOGXAADUYJI-UHFFFAOYSA-N	436.472	1.149	50	20	IDGD	
Cc1nn(C)c2cc(NC(=O)C(=O)NNc3ccc(S(=O)(=O)NC4CC4)cc3)ccc12	812985154	JVWMMVBHXDTSLC-UHFFFAOYSA-N	442.501	1.404	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)Nc3cn(C)nn3)c2)cc1	813011661	LVRAUDFUTGMARC-UHFFFAOYSA-N	445.461	1.091	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)c(C)c(OC)c1	813033013	AIGHEFPYKUIKOT-UHFFFAOYSA-N	436.490	1.344	50	20	IDGD	
CNC(=O)c1cc(Oc2cccc(NC(=O)C(=O)NNC(=O)c3cccnc3)c2)ccn1	815563911	RKUTULZEJPGGLQ-UHFFFAOYSA-N	434.412	1.028	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2ccc3[nH]c4c(c3c2)CN(C)CC4)c2ccccc2c1=O	816806143	TWRKUFBVYGVWSN-UHFFFAOYSA-N	444.495	1.960	50	20	IDGD	
COc1ccc(C(=O)NNc2ccccc2S(=O)(=O)N(C)C)cc1N1CCNC1=O	817055306	WDKQRTBPDJXSES-UHFFFAOYSA-N	433.490	1.232	50	20	IDGD	
CCC1CCC2(CC1)NC(=O)N(CC(=O)NNC(=O)CNc1ccccc1OC)C2=O	825615201	MMSBXKRGMDRDEF-UHFFFAOYSA-N	431.493	1.145	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1	860475625	SGKUUGSLWOSCIV-KRWDZBQOSA-N	425.470	1.708	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)[C@@H]1CCCCN1S(C)(=O)=O	896317295	RUGJVVYYODYEEN-RISCZKNCSA-N	448.339	1.178	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2CC(=O)N(c3ccc4c(c3)CCC4)C2)cc1C	913898016	LKYQASNHUWAMGA-GOSISDBHSA-N	434.496	1.931	50	20	IDGD	
N#C/C(=C/c1cn(CCC(N)=O)nc1-c1cccc(Br)c1)C(=O)NCCCO	914531416	PXJJZOVQKRXTLD-ZROIWOOFSA-N	446.305	1.594	50	20	IDGD	
COc1cc(-n2cnnn2)c(Cl)cc1C(=O)NNC(=O)[C@@H](C)Oc1ccccc1F	916037536	RTWQODNXHSBOHF-SNVBAGLBSA-N	434.815	1.692	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@@H](c2ccccc2)c2nccn2C)c2ccccc2c1=O	916220518	LAONCEJQCOEBKA-SFHVURJKSA-N	445.483	1.884	50	20	IDGD	
CCN(CC)c1ccc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cn1	916389778	DPCUINCVCIGHFV-UHFFFAOYSA-N	448.549	1.322	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCCCCN1CCC[C@@H](C)C1	916503884	JISNWFGRMYKKSQ-OAHLLOKOSA-N	438.598	1.744	50	20	IDGD	
COc1cc(CNC(=O)NNC(=O)c2cc3c(s2)CC[C@H](C)C3)ccc1OCC(N)=O	916641149	ZOSKBTHXIUHYFE-LBPRGKRZSA-N	446.529	1.890	50	20	IDGD	
O=C(NCCS(=O)(=O)NCc1ccccc1)NNC(=O)C12CC3CC(CC(C3)C1)C2	916645347	SGFKONICFKBTCH-UHFFFAOYSA-N	434.562	1.653	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(C)c(C(=O)NNC(=O)C(=O)Nc2ccc(C)cc2)c1	916830799	XSDXKQOWOAPFOD-UHFFFAOYSA-N	446.529	1.734	50	20	IDGD	
Cc1nn(-c2ccc(Cl)cc2)c(C)c1/C=C(/C#N)C(=O)c1c(N)n(C)c(=O)n(C)c1=O	917623547	SEQXRMHVOPAAQB-LCYFTJDESA-N	438.875	1.912	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NC[C@H](c2ccc(F)cc2)N(C)C)nc1	918087720	GTBHAXRMDVZYFZ-QGZVFWFLSA-N	438.529	1.836	50	20	IDGD	
CC[C@H](NC(=O)NNC(=O)COc1ccc(C#N)cc1)c1ccccc1OCC(=O)NC	918221716	MCHYKUULPOYTHN-SFHVURJKSA-N	439.472	1.544	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)CCCN(C)S(=O)(=O)c1ccc(F)cc1	919822596	YBMCUWQAIAIJRJ-UHFFFAOYSA-N	437.493	1.625	50	20	IDGD	
O=C(NNC(=O)c1cn(Cc2ccccc2)c2ccccc12)N[C@H]1CCS(=O)(=O)C1	919888940	IEYPAEYMEQMCPU-INIZCTEOSA-N	426.498	1.821	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2CC(=O)N(c3cc(F)cc(F)c3)C2)cc1C	920210745	LFUGCMQOPONPIM-ZDUSSCGKSA-N	430.411	1.721	50	20	IDGD	
CO[C@H](CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)c1ccc(F)cc1	1116227922	YTYXETDAWCDSHA-QGZVFWFLSA-N	438.481	1.408	50	20	IDGD	
O=C(NCc1ccc2c(c1)CCS2(=O)=O)NNC(=O)c1cncn1-c1ccccc1	1116252734	KRBZVBPZFFNEFQ-UHFFFAOYSA-N	425.470	1.346	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1)n1nnc(-c2ccccc2)n1	1322170022	PPLBIYICWIBLAO-AWEZNQCLSA-N	443.508	1.696	50	20	IDGD	
CC(C)CC(=O)N1CCC(NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)CC1	1322480033	RCSVFZQTTGBVMA-UHFFFAOYSA-N	431.541	1.061	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N2CCC3(CC2)CNC(=O)O3)cc1Br	1341386360	YFETYPJWYBTMLC-UHFFFAOYSA-N	427.255	1.387	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Br)C2	1778105687	GITZWWUFOUDZRI-MBMVNNNZSA-N	436.322	1.058	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnc3ccccn23)C1	1778587386	CQYZVLQUEQZYMC-QLVMHMETSA-N	434.924	1.716	50	20	IDGD	
O=C(c1n[nH]c2ccc(F)cc12)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1778624293	JPEMLYBDYLGQJT-YOEHRIQHSA-N	443.248	1.836	50	20	IDGD	
C=CC[C@H](C(=C)C)C(=O)N1CC[C@]2(CN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CCO2)C1	1778882137	RPNRWAHHHIPPRV-YRBPKABKSA-N	441.532	1.719	50	20	IDGD	
C[C@H]1CCC[C@@H]1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnccc1C(=O)NN)C2	1778896253	CRNSMHPBOWKCOA-NBZRVGKJSA-N	443.548	1.249	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc3[nH]ccc3n2)C1	1779000689	HVYKDJBJSFYPEZ-FIKMYACPSA-N	434.924	1.944	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)c(OC)c1	1780536894	PYNMDFMVVOSDBN-ORAYPTAESA-N	441.322	1.931	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@]3(CN(C(=O)CCBr)CCO3)C2)cc1OC	1780651251	MMLJMVNSTYYTDT-IBGZPJMESA-N	441.322	1.932	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1ncccn1)C2	1780709998	AUXXKSFPUMFQOQ-MDASCCDHSA-N	429.348	1.769	50	20	IDGD	
Cc1cnc2c(C(=O)N3CCO[C@@]4(CCN(C(=O)[C@](C)(Cl)CCl)C4)C3)cnn2c1	1781230621	WJRARXNYJAFNGS-MOPGFXCFSA-N	440.331	1.718	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(C(N)=O)cc3)CCO2)C1	1781233947	PAORADIRYISRKG-MOPGFXCFSA-N	428.316	1.465	50	20	IDGD	
C[C@@H]1CCc2c(C(=O)N3CCO[C@]4(CCN(C(=O)[C@H](F)Br)C4)C3)n[nH]c21	1781330365	WXYSSFGPAQMPEY-SEHCQNQUSA-N	429.290	1.593	50	20	IDGD	
Cn1nc2c(c1C(=O)N1CCO[C@]3(CCN(C(=O)[C@@H](F)Br)C3)C1)CCC2	1781332788	JICWGQNOXBNKNL-PBHICJAKSA-N	429.290	1.043	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cccc4nccn34)C2)C1	1782356878	ZKISJFPUZWYDMO-IFXJQAMLSA-N	435.322	1.809	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H]3Cc4[nH]nc(C(F)(F)F)c4C3)C2)C1	1782847622	AYULPLBHLBHQOB-FNFWKMNBSA-N	448.873	1.991	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(NC(C)=O)o3)CCO2)C1	1783349666	QSMRKHDTLXOASU-SCLBCKFNSA-N	442.310	1.855	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)CN3CCCCC3=O)CCO2)C1	1783354573	CLTGEYZJUHELPO-RDTXWAMCSA-N	430.343	1.002	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)COc3ccccc3F)C2)C1	1783360721	NVYJPHZGTZSBHV-SCLBCKFNSA-N	429.286	1.818	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)c3ccco3)[C@H]2C1	1783566062	RNEDJWSFKBNASG-IGNRKKQASA-N	429.311	1.466	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)COCc3ccc(OC)cc3)CCO2)C1	1783879433	SVQDFBISDDHEAK-RXVVDRJESA-N	440.924	1.296	50	20	IDGD	
C[C@@H]1Oc2ccc(C(=O)N3CCO[C@@]4(CCN(C(=O)C(Cl)Cl)C4)C3)cc2NC1=O	1783948279	HRBSCPKPFNURDG-JEOXALJRSA-N	442.299	1.653	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)N1CCO[C@@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783951954	MCAZGYWLFRBDPE-SFHVURJKSA-N	438.352	1.925	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]3C2)nc2ccccc12	1784093170	QZFDKCODFQXVCP-QHERXFFYSA-N	431.920	1.736	50	20	IDGD	
COc1cc(F)ccc1CC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1785657138	JWUHQAMOMJYFQB-WMZOPIPTSA-N	447.276	1.897	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnn(-c4cccnc4)c3)[C@H]2C1	1785731591	HIIWRIGYFSITJD-QZHFEQFPSA-N	431.924	1.878	50	20	IDGD	
CCc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]32)n(C)n1	1788945906	PYMHOSQBQSCALL-HAHWVIBASA-N	431.364	1.812	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccnc4c3OCO4)[C@H]2C1	1789181004	OYFJBXZIFYYUGL-MDWPOOTQSA-N	444.315	1.640	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnn4ncccc34)C[C@@H]21	1789866549	REDRCYCLRXUGQK-BCRCDCHUSA-N	440.331	1.559	50	20	IDGD	
Cc1cnn([C@H](C)C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]3C2)c1	1789872483	GICACCYMNHNKMK-CUGJGTHOSA-N	431.364	1.969	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21	1790611715	MCNPARGJWMPPFC-QNWJLWSRSA-N	439.278	1.218	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc(C#N)cc3)C[C@@H]21	1791054923	YRMBWODISJMWDP-MGHWNKPDSA-N	434.334	1.864	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cc(F)ccc3F)C[C@@H]21	1791256053	DOXFBEMLANHJAS-RPZXMPESSA-N	430.879	1.741	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CSc1ncccn1)C2	1792868189	TVNVHZHWHKBJGN-GUIRCDHDSA-N	443.367	1.189	50	20	IDGD	
CC(=O)O[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)CBr)C(C)C	1792870292	BFECNWZPQUDHAG-SLZITWOASA-N	433.343	1.195	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C=C/c1ccoc1	1793922151	IFSUQPNVDMBDIS-KHBBLPJUSA-N	439.472	1.016	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2)c1ccc(-n2cnnc2)cc1	1795493263	XGHTZPYWVZAAQG-JLVBRIDZSA-N	448.321	1.256	50	20	IDGD	
CN1CCN(C2(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)CCBr)CC2)CC1	1795495485	QBYVMMWRYIIIJD-MUJYYYPQSA-N	427.387	1.190	50	20	IDGD	
CC[C@H](NC)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)C2	1795728219	KRKLODBFTNKYKL-DRZPZYELSA-N	432.471	1.459	50	20	IDGD	
CN1CCc2cc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@@H](F)Br)C4)ccc21	1797019237	MUEIYTQRLPGNHR-YALNPMBYSA-N	440.313	1.573	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CO[Si](C)(C)C	1797959364	NUVKMXBWALCCFB-JLVBRIDZSA-N	443.617	1.342	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cncc2cnccc12	1798453547	GSFKSSAIHKVXHI-LJGDNWOOSA-N	447.333	1.864	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CS[C@H]1CCCCO1	1798477796	HAGURMKIOKLBRO-YGTYGHESSA-N	447.561	1.197	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1n[nH]c3c(F)cccc13)C2)[C@H](F)Br	1799349014	FXPHWAXZGXKFEK-GDGVSTKUSA-N	443.248	1.596	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3n(n1)CCCC3)C2	1800641750	IQSGUAWZYHOKND-YXPYIKCWSA-N	439.354	1.596	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)Oc1cccnc1)C2	1800644243	OUDJCZPGMJCRQM-QZLJAVCYSA-N	440.338	1.612	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(-n3cccn3)cc1)C2	1800759788	HYXYPCXHYIYLBR-SCNOPHJPSA-N	447.333	1.859	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3sc(N)nc3c1)C2	1800975746	SRWCMIAEIBVNLF-OQMKEHIESA-N	438.937	1.336	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(F)c(N(C)C)c(F)c1)C2	1800979746	YOSKCNYKBRGWAY-LOUJCGABSA-N	445.894	1.488	50	20	IDGD	
Cc1cnn([C@H](C)C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)CBr)C3)c1	1801335574	PTZLIPZMLWKCTM-DGXTUMSLSA-N	427.343	1.373	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1cccc(F)c1F)c1ccc(B(O)O)cc1	1801825946	FZTJIDKHCMHRSJ-BCDXTJNWSA-N	428.244	1.139	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H]1Cc3ccccc3CN1C)C2	1802333445	WWTUSECMCUBNCY-PLACYPQZSA-N	441.576	1.054	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)[C@@H]1CC=CCC1	1803026604	QLIVTIMXWSBZGO-PIPMEXSNSA-N	433.317	1.437	50	20	IDGD	
Cc1csc(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)c1	1803770585	JCFJKXWVQFAECI-NQIIRXRSSA-N	449.341	1.765	50	20	IDGD	
O=C(CCc1ccco1)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1804585119	RYDDEFTZHXUUOA-XXBNENTESA-N	447.300	1.307	50	20	IDGD	
O=C(CCn1c(=O)oc2ccccc21)N1CCC2(CCCN(C(=O)[C@@H](O)CCl)C2)CC1	1805518363	RQXJSFSXZREPMA-KRWDZBQOSA-N	449.935	1.816	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)N1CC[C@H](CNC(=O)[C@H](F)Br)[C@H]1c1cccnc1	1808662269	JTBHOGLDVCVNSJ-RQJABVFESA-N	444.305	1.225	50	20	IDGD	
CN[C@H](CC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](C)CBr)n[nH]1)C(=O)O	1814779972	BRNXOCURQASMLM-RAIGVLPGSA-N	444.330	1.496	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](F)Cl)CC2)c1n[nH]c2c1CS(=O)(=O)C2	1815851688	UWIQMZXMPCQUGF-QTTZVWFDSA-N	447.901	1.055	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCC#N)CC2	1817279784	DWRZAIAKFBRMKI-JBBSTVMTSA-N	427.490	1.493	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)C(C)(F)F)CC2	1817279853	ITPWDWMOBOCRHT-QQUKTLKZSA-N	438.460	1.844	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)CC[C@H]2CCOC2)[nH]n1)c1cccc(B(O)O)c1	1817479528	PATWJZGHWHYVLT-KXBFYZLASA-N	440.309	1.212	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)CCBr)[nH]n1)c1cc(O)nc(O)n1	1818029208	YKXLVRVKMMCJIQ-LLVKDONJSA-N	439.270	1.702	50	20	IDGD	
Cc1cc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2ccc(B(O)O)cc2)CC3)ccn1	1820482404	HXBFQDWLMRNYRY-MRXNPFEDSA-N	436.302	1.066	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc(O)cc2)n[nH]1	1820577759	PLDQKEBEWCOWKY-GOSISDBHSA-N	449.471	1.734	50	20	IDGD	
C[C@H](C(=O)Nc1cc([C@H]2CCCCN2C(=O)C(Cl)Cl)[nH]n1)N1CCN(C)CC1	1820790153	XUGHJEZTTLCWOD-TZMCWYRMSA-N	431.368	1.841	50	20	IDGD	
CCc1cc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@H](Cl)COC)CC3)nn1C	1820971960	OROMHABTWJKXDY-CMPLNLGQSA-N	425.942	1.919	50	20	IDGD	
CC(C)c1nc(CC(=O)N2CCC([C@H]3CCCCN3C(=O)[C@H](O)CCl)CC2)no1	1824178183	DXXMBTXBNQKGHL-HZPDHXFCSA-N	426.945	1.955	50	20	IDGD	
Cc1ncccc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1	1825842383	CAJYFDSVXZCRPO-QFIPXVFZSA-N	435.333	1.617	50	20	IDGD	
CCOCCC(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1	1828925571	LSCTZNIYTMTAPC-LJQANCHMSA-N	431.537	1.345	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnn4cccnc34)C2)C1	1830362046	JOTXAJZOMKLDON-FQEVSTJZSA-N	435.912	1.064	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)[C@H](O)CCl)CC2)nc2nccn12	1830925816	CVIXWSYWQYPALY-ZWKOTPCHSA-N	433.940	1.871	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(CC)nn3C)C2)C1	1831651520	QKENUUWSSVIUQL-JXFKEZNVSA-N	426.945	1.460	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(F)(F)C(F)F)CCO2	1832194018	WCPUPLQOPHSVTE-YGRLFVJLSA-N	449.239	1.517	50	20	IDGD	
C=CCSCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1832458701	WRNYXFFHSFSRGW-DZGCQCFKSA-N	425.320	1.053	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnn(C(C)(C)C)c3)CCO2)C1	1833455621	WYJDNJPKZKXQKH-JXFKEZNVSA-N	426.945	1.726	50	20	IDGD	
CC[C@H](C)[C@H](N)C(=O)N1CCC(N2CCC(NC(=O)CCBr)CC2)CC1	1834421892	RQGRTERKAIKTIV-KSSFIOAISA-N	431.419	1.716	50	20	IDGD	
O=C(CCc1ccccc1)N1CCOC[C@]2(C1)CN(C(=O)CCBr)CCO2	1834822248	DXGYBVTTXOPFEK-FQEVSTJZSA-N	439.350	1.861	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCC(N2CCC(NC(=O)c3cc(O)no3)CC2)CC1	1835976343	VXIVNGWDLDBCLJ-SFHVURJKSA-N	433.336	1.802	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)Cc1ccc(F)cn1)CCO2	1836033828	HWJDQMYDAOXOTN-HXUWFJFHSA-N	439.560	1.071	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3cccs3)CCO2)C1	1836092057	OJRXUHAYBRTHIG-MAUKXSAKSA-N	445.379	1.921	50	20	IDGD	
COc1ccc(C(=O)N2CCOC[C@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)nc1	1837713330	XJFIWVFZPKJRLD-FQEVSTJZSA-N	437.569	1.012	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3cccc(OC)n3)C2)C1	1839142418	NVIZJYBDTUGPIW-DYESRHJHSA-N	439.940	1.497	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)ccn1	1839153898	VQPDJNKFGQMHHE-MOPGFXCFSA-N	430.332	1.696	50	20	IDGD	
O=C(Cc1ccccc1F)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839199076	IJCWLLRQDWVTQO-AEFFLSMTSA-N	447.276	1.515	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc4c3NC(=O)C4)CCO2)C1	1839573845	DBGFOFYPVGQMJV-IIBYNOLFSA-N	435.908	1.269	50	20	IDGD	
O=C(c1cnn2cccc(F)c12)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1839619055	PVKCWNFINYQPJY-MAUKXSAKSA-N	428.823	1.078	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(C)cn3)C2)C1	1839963503	MNTOKSNISSXZLH-BEFAXECRSA-N	440.338	1.634	50	20	IDGD	
Cc1noc(C)c1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)Br)CCO2	1840031655	YHKHAGRLIQOIMR-GTNSWQLSSA-N	430.299	1.145	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3cccc(C)n3)C2)C1	1840150086	FHZADVUUNZSZEP-RXVVDRJESA-N	439.940	1.033	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C)cc(C#N)c3)C2)C1	1840154691	CWRJJFKLDTYGAS-GHTZIAJQSA-N	435.908	1.191	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)Cc3ccccc3)C2)C1	1840156015	MFWHCWBNKYPPJS-LQBOVUBWSA-N	438.952	1.575	50	20	IDGD	
Cc1cc(C)cc(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)c1	1840304667	KSOBRTNFAPOAHE-KNQAVFIVSA-N	438.952	1.292	50	20	IDGD	
Cc1ccc(/C=C/C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)s1	1840394586	UEPOBAAQYJAYEP-QDYBUIJZSA-N	428.938	1.126	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(C(N)=O)cc3)CCO2)C1	1840646077	BLXJADSCSOBQPF-UWJYYQICSA-N	437.924	1.263	50	20	IDGD	
C[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1)c1ccccc1	1840892998	OVJZBYYEXCPPLS-URLQWDBASA-N	443.313	1.937	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)CCc2cnc3ccccc3c2)C1	1841253635	LVTACNJTKVKZQO-UHFFFAOYSA-N	437.544	1.744	50	20	IDGD	
O=C(c1cccc2nc(C(F)(F)F)[nH]c12)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1	1841351422	PORJQBYFSSAWAO-GFCCVEGCSA-N	430.814	1.998	50	20	IDGD	
O=C(c1cc(Br)cnc1Cl)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1	1841352022	RQXCBMADAQLAMN-NSHDSACASA-N	437.121	1.914	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC2(CCCN2C(=O)[C@H](CCO)NC(=O)OC(C)(C)C)C1	1841431951	UNZBBKKHXYKIGB-OLZOCXBDSA-N	448.358	1.249	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC2(CCCN2C(=O)Cn2c(=O)n(C)c3ccccc32)C1	1843858869	SSZMZXYTQAZNKZ-CQSZACIVSA-N	449.349	1.574	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1csc3c1CCCO3)C2	1844264247	YDRQTBSUEUAARM-UHFFFAOYSA-N	441.513	1.202	50	20	IDGD	
CCN(CC)C[C@@H](C)C(=O)N1CCCC12CN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2	1845783008	OHYFKQGHXFGDNG-LXUZAUPUSA-N	430.553	1.302	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC12CN(C(=O)[C@@H]1CC(=O)N(C3CCCC3)C1)C2	1846175811	UDZDBJUCBYFHKD-UONOGXRCSA-N	426.355	1.764	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)cc2Cl)C1	1846300447	ASMZMEHTMTYQEQ-VMPITWQZSA-N	434.924	1.635	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1C)C2	1846362757	UPUVGYUZXPMTGG-HRCADAONSA-N	443.972	1.947	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)c1ccnc(Br)c1)C2	1846385302	NZQLNVJBBCNKQJ-UHFFFAOYSA-N	438.326	1.034	50	20	IDGD	
CCN1CCC(C(=O)N2CCCC23CN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C3)CC1	1847111842	LCXZUFLFWNZMPC-LFVJCYFKSA-N	428.537	1.056	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)C(F)(F)C(F)(F)C(=O)O	1847493809	JJLLRZRAYOMWDA-CIUDSAMLSA-N	433.196	1.574	50	20	IDGD	
O=C(CNC(=O)c1ccc(Br)o1)NNC(=O)c1nn(-c2ccccc2)cc1O	10159666	IAAAOYWPNZJBNG-UHFFFAOYSA-N	448.233	1.124	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)cc(Cl)c1OCC(N)=O	10402365	AXFQDDQRQFAGHH-JTQLQIEISA-N	439.827	1.580	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Cc2cc(Cl)c3c(c2)OCCO3)c2ccccc2c1=O	10708466	JLLXXYBWNSTOHZ-UHFFFAOYSA-N	442.859	1.845	50	20	IDGD	
CC(=O)c1cccc(S(=O)(=O)NCCC(=O)NNC(=O)c2cc(Cl)ccc2O)c1	11366000	SUNXNUIBZKHXSX-UHFFFAOYSA-N	439.877	1.378	50	20	IDGD	
Cn1c(N)c(C(=O)/C(C#N)=C/c2cc3ccccc3nc2N2CCCCC2)c(=O)n(C)c1=O	16881460	ITRRDVPCPNDVAG-GHRIWEEISA-N	444.495	1.995	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc2nc(O)cc(C(=O)NNC(=O)c3ccccn3)c2c1	17329006	MOFJEEGZIQLBCD-UHFFFAOYSA-N	443.485	1.441	50	20	IDGD	
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)[C@@H](C)Oc1ccc(F)cc1	24296708	LQYJVXGTQBNMFV-XCLFUZPHSA-N	426.448	1.969	50	20	IDGD	
O=C(CCn1c(=O)[nH]c(=O)c2ccccc21)NNC(=O)c1ccc(Br)s1	27318990	VHMCTJSETYOCET-UHFFFAOYSA-N	437.275	1.365	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)c2cccc(CN3C(=O)CNC3=O)c2)cc1OC	28080611	GGODRBHRIWWFEA-UHFFFAOYSA-N	440.456	1.611	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)CCNS(=O)(=O)/C=C/c2ccccc2)cc1	196508084	BOYGIKPEIPQRNX-WYMLVPIESA-N	432.502	1.235	50	20	IDGD	
Cc1nn(-c2ccccc2)cc1C(=O)NNC(=O)c1sc(N2CCOCC2)nc1C	726522392	IRBVBCBIXSWUOA-UHFFFAOYSA-N	426.502	1.857	50	20	IDGD	
CCOC(=O)C1CCN(C(=O)CN(C)C(=O)/C(C#N)=C/c2cc(C#N)n(C)c2C)CC1	726539731	LJXIVRQPHYXKDM-VCHYOVAHSA-N	425.489	1.372	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1cccc(N(C)C)c1)c1cccc(S(=O)(=O)N(C)C)c1	727610096	PYVCLPOJYYPPKR-AWEZNQCLSA-N	433.534	1.708	50	20	IDGD	
CCc1noc(-c2ccc(CCNC(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)cc2)n1	727843776	SLPQGWLFLISMQV-UHFFFAOYSA-N	447.459	1.461	50	20	IDGD	
O=C(NNc1nc(-c2cccnc2)no1)[C@@H]1CCCN(S(=O)(=O)c2ccccc2)C1	728078936	CDXXFGYQBVYYIO-OAHLLOKOSA-N	428.474	1.676	50	20	IDGD	
Cn1ncc2c(O)nc(CCC(=O)NNC(=O)c3cc(F)ccc3Br)nc21	728549990	WRYZDULTQHKOJF-UHFFFAOYSA-N	437.229	1.364	50	20	IDGD	
CC(C)(C)CC(=O)NNC(=O)c1ccc(Cl)c(S(=O)(=O)NC[C@H]2CCCO2)c1	728609246	UQULSESYLIPXKA-CYBMUJFWSA-N	431.942	1.995	50	20	IDGD	
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	728889618	LFENZKVVDCHVHE-FQEVSTJZSA-N	449.515	1.069	50	20	IDGD	
Cc1ccc([C@H](CNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)N(C)C)cc1	728961404	HIZUUDVVDILQTI-IBGZPJMESA-N	425.537	1.635	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)[C@@H]2CCCN(C(N)=O)C2)c2ccccc2c1=O	731808266	NNVXASOTXLDWMY-CQSZACIVSA-N	428.493	1.138	50	20	IDGD	
COC(=O)Cc1cc(=O)n(-c2ccc(C(=O)NNc3nc(-c4cccnc4)no3)cc2)[nH]1	732110824	PCRIBTIZVGELBW-UHFFFAOYSA-N	435.400	1.083	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)CCNS(=O)(=O)c1ccc(NC(C)=O)cc1)c1ccccc1	732306945	GWCZDHBLHMBGPG-IBGZPJMESA-N	446.529	1.655	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)N[C@H]2CCN(c3ccccc3Cl)C2=O)nc2ccccc21	732469426	DSQYCJCSHKZYHD-HNNXBMFYSA-N	440.891	1.905	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)NNC(=O)NC[C@@]1(N2CCOCC2)CCSC1	732996347	GYSHCNNYZCQOEJ-SFHVURJKSA-N	427.958	1.561	50	20	IDGD	
Cc1cc(C(=O)N2CCC[C@@H]2C(=O)NNC(=O)COCc2ccccc2)ccc1[N+](=O)[O-]	737634602	IKFZRSFAWUUQQF-LJQANCHMSA-N	440.456	1.872	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H]1CCC[C@H]1C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	739552934	XSQBPTHSKIVCES-CVEARBPZSA-N	432.525	1.534	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)[C@@H]1CCCN(C(=O)COc2ccccc2)C1	741172009	GKEMDZXUNYRXDM-OXQOHEQNSA-N	439.468	1.291	50	20	IDGD	
Cc1nn(C)c(C)c1S(=O)(=O)N[C@@H](C)C(=O)NNC(=O)c1c(Cl)cccc1Cl	742063729	JDVIDSPKIVUWAK-VIFPVBQESA-N	448.332	1.472	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)CC[S@](=O)c2ccc3c(c2)OCCO3)o1	742246854	FMCLSUQXDOPYPS-HKBQPEDESA-N	449.529	1.852	50	20	IDGD	
CC(C)c1nn([C@@H]2CCS(=O)(=O)C2)cc1C(=O)NNC(=O)c1cc2c(s1)CCC2	742473882	IYARFWWWRPVPBH-CYBMUJFWSA-N	436.559	1.991	50	20	IDGD	
NC(=O)Cn1cc(C(=O)NNC(=O)c2cc(-c3ccc(Cl)cc3)nc3ccccc23)nn1	742517003	VGMPURIHVZUZER-UHFFFAOYSA-N	449.858	1.707	50	20	IDGD	
CCN1CCC[C@H]1CN1C[C@@H](C(=O)NNC(=O)c2cccc(Br)c2)CC1=O	742773254	RTFHMOXYGCUWFM-HOCLYGCPSA-N	437.338	1.543	50	20	IDGD	
COc1ccc(N2C[C@H](C(=O)NNC(=O)Nc3ccc(S(C)(=O)=O)cc3)CC2=O)cc1	743830381	TVYUHLGUVCBGDK-CYBMUJFWSA-N	446.485	1.305	50	20	IDGD	
Cc1cccc(C)c1C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	744351432	LJCZNCNNCYNKGF-UHFFFAOYSA-N	445.541	1.718	50	20	IDGD	
CCCc1ccc(N2C[C@H](C(=O)OCC(=O)NNC(=O)c3cccc(C#N)c3)CC2=O)cc1	744682611	MMWHLJSTXHNZGK-LJQANCHMSA-N	448.479	1.868	50	20	IDGD	
CC(C)(CNC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)NC(=O)OC(C)(C)C	745926984	ZHRJXPOYOWADQN-UHFFFAOYSA-N	428.511	1.337	50	20	IDGD	
CO[C@]1(C)C[C@@H](NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)C1(C)C	745930209	BMRLATROQSDYRZ-DNVCBOLYSA-N	426.539	1.150	50	20	IDGD	
CCN(Cc1ccc(OC)cc1OC)C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	746203087	DLCZSBUKUZTDMX-UHFFFAOYSA-N	425.449	1.556	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)c1nccnc1C(=O)NCc1ccc(F)cc1	746637565	PWSBGDOYSWKDEX-UHFFFAOYSA-N	447.430	1.197	50	20	IDGD	
CN(CCO)S(=O)(=O)c1ccc(C(=O)NNC(=O)c2ccc(Cl)cc2F)cc1	747523383	IRRGXTVSIYSWCK-UHFFFAOYSA-N	429.857	1.167	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)[C@H](C)NS(=O)(=O)c2cccs2)o1	747715845	PPJFOURKLKPPIX-LBPRGKRZSA-N	428.536	1.311	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)CCCC#N)cc2)cc1OC	748161953	RFHXPBBSUANRCH-UHFFFAOYSA-N	431.470	1.856	50	20	IDGD	
Cc1cc(C(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)nc2nc(O)nc(O)c12	748517999	DFHCOMMYDUVBKK-UHFFFAOYSA-N	443.363	1.795	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)c2ccc3ncc(I)n3c2)n1	749336204	IFUNXXNRFDJZLF-UHFFFAOYSA-N	438.229	1.213	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)c1cccc(F)c1I	749806167	IDFSUFSAHRERDW-UHFFFAOYSA-N	431.161	1.214	50	20	IDGD	
Cc1ccc(C(=O)N2CCC[C@H](C(=O)NNC(=O)CNC(=O)c3cccs3)C2)cc1	751208629	HQDXNDSOLNQYLT-INIZCTEOSA-N	428.514	1.486	50	20	IDGD	
CCNS(=O)(=O)c1ccc(F)c(C(=O)NNC(=S)NCCc2cccs2)c1	753078000	NRUUHZVSPVMUGT-UHFFFAOYSA-N	430.552	1.537	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)Nc2nc3c(s2)COCC3)c2ccccc2c1=O	756630540	WOHITYMOGUIGIS-UHFFFAOYSA-N	428.474	1.973	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)Nc2ccc(NS(C)(=O)=O)cc2)cc1	756703418	ATLNDOHZYIJULW-CYBMUJFWSA-N	434.474	1.881	50	20	IDGD	
CS(=O)(=O)Nc1ccc(NC(=O)NNC(=O)COc2ccccc2C#N)cc1Cl	756704624	IJUFKLAIRRVNEH-UHFFFAOYSA-N	437.865	1.815	50	20	IDGD	
CCOC(=O)c1cnn2c(C(=O)NNC(=O)[C@H](C)Oc3cccc(C)c3C)ccnc12	757987939	ISNUCAQYLVNENA-AWEZNQCLSA-N	425.445	1.751	50	20	IDGD	
CCc1cccc2c3c([nH]c12)[C@](CC)(CC(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1)OCC3	758145283	YQSROEFLOREUFI-QRQCRPRQSA-N	447.557	1.881	50	20	IDGD	
COC[C@@H](NC(=O)NNC(=O)C(=O)Nc1ccccn1)c1cccc(C(F)(F)F)c1	758795980	GLSXXGFTRDNRCF-CYBMUJFWSA-N	425.367	1.757	50	20	IDGD	
COCCc1noc(CN(C)C(=O)NNC(=O)c2ccc(COc3ccccc3)o2)n1	758835157	WQLOHXVYDHEZPF-UHFFFAOYSA-N	429.433	1.917	50	20	IDGD	
CN1C(=O)C[C@@H](C(=O)NNC(=O)CNC(=O)c2ccco2)[C@@H]1c1ccc(Cl)c(F)c1	758960134	KPYQOEQADMUQSI-DIFFPNOSSA-N	436.827	1.169	50	20	IDGD	
O=C(NC[C@@H]1CSCCN1Cc1ccccc1)NNC(=O)c1cc([N+](=O)[O-])ccc1O	759325343	XAXRVAVJNZZPQK-MRXNPFEDSA-N	445.501	1.862	50	20	IDGD	
CN(C)c1nccc(NNC(=O)C(=O)Nc2cc3ccccc3nc2Br)n1	760315986	UGPPCVHIWKEMQD-UHFFFAOYSA-N	430.266	1.935	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)CCC(=O)N1CC(=O)Nc2ccccc21	762349408	HZWZLJMYZPKPEU-UHFFFAOYSA-N	442.497	1.700	50	20	IDGD	
CC(=NNC(=O)[C@H](C)CN1C[C@H](C)O[C@H](C)C1)c1c(C)nn(CCS(C)(=O)=O)c1C	763155216	IWJCDFAADNOWGF-KFWWJZLASA-N	441.598	1.130	50	20	IDGD	
COCCOc1ccc(S(=O)(=O)NNC(=O)CSc2ccccc2O)cc1C	763408926	HIVAKJWELSQCPN-UHFFFAOYSA-N	426.516	1.828	50	20	IDGD	
C[S@@](=O)Cc1ccccc1NC(=O)C(=O)NNC(=O)c1cc2ccccc2cc1O	763528862	UKEBJNJNFOXZGS-SSEXGKCCSA-N	425.466	1.824	50	20	IDGD	
O=C(NC[C@H]1CCCO1)Nc1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2F)cc1	763555620	IQYFICIEOXRPGO-OAHLLOKOSA-N	443.435	1.526	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)cc1N1CCOC1=O	763557412	AZHBCQFPBJMTEP-UHFFFAOYSA-N	426.385	1.080	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)COc2cccc(C)c2)cc1Cl	763622861	HBRDFZSQEMJJTP-UHFFFAOYSA-N	449.847	1.365	50	20	IDGD	
CC(C)Cn1cc(NC(=O)C(=O)NNC(=O)COc2ccc(Br)cc2)cn1	763692391	AZWWETXTIXQSFV-UHFFFAOYSA-N	438.282	1.467	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)[C@H]3C[C@]34CCOC4)c2)cc1	763731634	BGNSLQCGMZUJBX-NQIIRXRSSA-N	445.497	1.684	50	20	IDGD	
CN(C)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)cc1Cl	763837415	FMOLWVNQUOCJGV-UHFFFAOYSA-N	436.827	1.346	50	20	IDGD	
Cc1nc(-c2ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc3cccc(C)c3C)cc2)n[nH]1	763848434	HOXHXHFTILSRTD-CQSZACIVSA-N	436.472	1.950	50	20	IDGD	
COc1ccc(N2C[C@@H](C(=O)NNC(=O)CSc3ccccc3O)CC2=O)c(OC)c1	764043046	NXDHUEZQNMCXJU-ZDUSSCGKSA-N	445.497	1.702	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cncc(Br)c3)n[nH]2)cc1	764111811	UERYFBUJOVPSKL-UHFFFAOYSA-N	443.261	1.942	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2ccc(C(=O)NCC(C)C)cc2)cc1	764128013	XRJDTPPTVRARNV-UHFFFAOYSA-N	440.500	1.800	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2O1)C(=O)Nc1ccccc1OC[C@@H]1CCCCO1	764151241	IEGOAYYUYPQEMQ-OXJNMPFZSA-N	439.468	1.724	50	20	IDGD	
Cc1cc(I)ccc1NC(=O)C(=O)NNC(=O)c1scnc1C	764244329	FJNSSMSDVONPSR-UHFFFAOYSA-N	444.254	1.764	50	20	IDGD	
CCN1CCN(c2ccc(NC(=O)C(=O)NNC(=O)Cc3ccccc3F)c(C)c2)CC1	764319273	NRRKEHDVWWZAGB-UHFFFAOYSA-N	441.507	1.605	50	20	IDGD	
O=C(NNC(=O)c1cc2ccccc2o1)C(=O)Nc1cccc(N2CCCS2(=O)=O)c1	764332640	WBWODOPUTFWQNE-UHFFFAOYSA-N	442.453	1.372	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cc(C)[nH]c3C(=O)OC)n[nH]2)cc1	764385141	SSXYPXCPYQPGAB-UHFFFAOYSA-N	438.444	1.462	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)NCc1cccnc1OCC(F)F	764510745	DWXZOCHYYDYVOD-UHFFFAOYSA-N	425.348	1.543	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1ccc(C#N)cc1)C(=O)NNC(=O)Cc1c[nH]c2ccccc12	764554026	VHLRKOOVKFUHMZ-CYBMUJFWSA-N	425.470	1.096	50	20	IDGD	
CC(C)(C)OC(=O)N1CCO[C@@H](CC(=O)NNC(=O)c2cc(Br)c[nH]2)C1	764605529	COAYWTVQNQTYAN-NSHDSACASA-N	431.287	1.564	50	20	IDGD	
Cc1n[nH]c(C)c1CCC(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	766662907	HFMGHAJFYRACHO-UHFFFAOYSA-N	432.956	1.578	50	20	IDGD	
CCOC1CC(CNC(=O)NNC(=O)NCc2ccc(Cl)cc2)(N2CCOCC2)C1	767888265	QVDCLDFEDNTACK-UHFFFAOYSA-N	439.944	1.623	50	20	IDGD	
CCCS(=O)(=O)N1CCCC[C@H]1C(=O)NNC(=O)c1cc(-c2ccccc2OC)[nH]n1	768273931	KWUGCSUDSXQBDZ-KRWDZBQOSA-N	449.533	1.441	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2nnn(C3CCN(C(=O)OC(C)(C)C)CC3)c2C)n[nH]1	768278836	WAHHLVZHIHGUQF-UHFFFAOYSA-N	432.485	1.265	50	20	IDGD	
CNS(=O)(=O)c1ccc(Cl)c(C(=O)NNc2c(OC)cccc2S(C)(=O)=O)c1	768641623	UHVNWWADCOGPMV-UHFFFAOYSA-N	447.922	1.417	50	20	IDGD	
C[C@]1(c2cccc(C(=O)NNC(=O)c3cc(-c4ccc(F)cc4)[nH]n3)c2)NC(=O)NC1=O	769280294	MVVHOMANKJKYEM-OAQYLSRUSA-N	436.403	1.345	50	20	IDGD	
CO[C@H](CNC(=O)OC(C)(C)C)CC(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	769845083	DLZWZZFFNAVNEX-AWEZNQCLSA-N	433.465	1.269	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1Br)C(=O)NNc1nc(O)c2cnn(C)c2n1	770972022	ORVXJPSNGAYSMD-ZETCQYMHSA-N	425.218	1.881	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CC(=O)N(c2c(F)cccc2F)C1)c1nn(-c2ccccc2)cc1O	771302710	LMUULVQXDUERFC-GFCCVEGCSA-N	441.394	1.670	50	20	IDGD	
CC(=O)N1CCN(C(=O)CCNC(=O)NNc2ccc(Br)c(F)c2)CC1	771328270	RJLHNAZOPWVRJN-UHFFFAOYSA-N	430.278	1.295	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCCS1(=O)=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1	772614895	PJLHUXLHTLEJQK-NHCUHLMSSA-N	441.553	1.728	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1O)Nc1cnn(Cc2nnc3n2CCCC3)c1	772636464	QQTFZLYMRGXNGA-UHFFFAOYSA-N	430.856	1.685	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccc3ccccc3n2)cc1	773662105	QAQDJWCOVWPDHU-UHFFFAOYSA-N	443.485	1.241	50	20	IDGD	
CS(=O)(=O)c1cccc(Cl)c1C(=O)OCC(=O)NNC(=O)c1ccc(C#N)cc1	775917226	YHJIXLBOFLJEGD-UHFFFAOYSA-N	435.845	1.233	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)CNC(=O)c2ccc(Br)s2)c1	776534327	HOOHBKSRMSXMCO-UHFFFAOYSA-N	432.321	1.787	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NC[C@H]2COC3(CCCCCC3)O2)c2ccccc2c1=O	777764152	MAVFJZMEVKLTES-HNNXBMFYSA-N	443.504	1.826	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)[C@@H](C)n2nnnc2C(C)(C)C)c2ccccc2c1=O	777840831	MZVZRGZVCQXUFM-GFCCVEGCSA-N	426.481	1.113	50	20	IDGD	
CC(C)(C)OC(=O)NCc1cc(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)co1	780601592	XZYBARWCIRQPPH-UHFFFAOYSA-N	444.492	1.772	50	20	IDGD	
CC(=O)N1CCN(c2cccc(NC(=O)NNC(=O)COc3ccc(C#N)cc3)c2)CC1	782082194	NVRMKNLOMUIXNQ-UHFFFAOYSA-N	436.472	1.458	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C(=O)Nc2c(F)cccc2-n2cccn2)nc2ccccc21	782895220	XKMQIVBIOSTCKH-UHFFFAOYSA-N	435.419	1.227	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)C(=O)Nc1ccc(Cl)cc1Cl	782897759	TWXFGLYKZZERNT-UHFFFAOYSA-N	444.300	1.686	50	20	IDGD	
O=C(NNc1ncnc2ccsc12)C(=O)Nc1ccc2c(c1)C(=O)N(CC1CC1)C2=O	783254040	XEKPIXULOYPJMB-UHFFFAOYSA-N	436.453	1.779	50	20	IDGD	
O=C(NNc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1cccc(Cn2cccnc2=O)c1	783291643	NSFVKNDDNBNFPX-UHFFFAOYSA-N	442.819	1.935	50	20	IDGD	
Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)C(=O)NN[C@]1(C)CCS(=O)(=O)C1	783423935	BOTGFFMMSMJDJI-HXUWFJFHSA-N	443.485	1.191	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)c(F)c1	784231222	VRMGQJCGQBSSPY-UHFFFAOYSA-N	449.508	1.152	50	20	IDGD	
CN1CCN(CCOc2ccc(NC(=O)C(=O)NNc3cccnc3Cl)cc2)CC1	784842201	NERCJKBEDCLHRN-UHFFFAOYSA-N	432.912	1.443	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)C(=O)Nc2cccc(-n3nnnc3SC)c2)c1	784853980	SNTCDEGWLIITNI-UHFFFAOYSA-N	427.446	1.253	50	20	IDGD	
COC(=O)c1scc(C)c1S(=O)(=O)NNC(=O)CCCNC(=O)OC(C)(C)C	785488881	UPHJOYMPFOXNMT-UHFFFAOYSA-N	435.524	1.458	50	20	IDGD	
Cc1nc(Cn2cc(C(=O)NNc3ccc(S(=O)(=O)C(F)(F)F)cc3)nn2)no1	787461808	PSDPFSMMABNGNO-UHFFFAOYSA-N	431.356	1.068	50	20	IDGD	
O=C(NNC(=O)C(=O)Nc1ccccn1)N[C@H]1CCN(c2ccc(Cl)cc2Cl)C1	788905647	KIANWFMDROVECG-LBPRGKRZSA-N	437.287	1.936	50	20	IDGD	
O=C(NNC(=O)[C@H]1OCC[C@H]1c1ccccc1)C(=O)Nc1cccc(Oc2cnccn2)c1	789814080	ZSPMVJVMJHAULZ-ICSRJNTNSA-N	447.451	1.928	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)ccc1C	789815194	BJYBEIORRKZCDU-WMZOPIPTSA-N	425.441	1.440	50	20	IDGD	
COc1ccnc(NNC(=O)C23CCC(C(=O)NNc4nccc(OC)n4)(CC2)CC3)n1	789893941	UEYVITAZHGOHDE-UHFFFAOYSA-N	442.480	1.211	50	20	IDGD	
CCc1c(C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)cnn1-c1ccccc1Cl	790490043	JSLVSMIHOIXLBE-NSHDSACASA-N	425.898	1.219	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)[C@](C)(O)Cn2cc(C(F)(F)F)ccc2=O)cc1	792633168	PTPHFSXJVDSLGE-LJQANCHMSA-N	441.406	1.407	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)N(C)CCCC(=O)NNC(=O)c2cccc(C)n2)cc1	794089633	HWTYNHDLSSUYER-UHFFFAOYSA-N	432.502	1.455	50	20	IDGD	
Cc1nnnn1/C(=C\c1ccc(F)cc1)C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	794718019	VQVNQMSRQOKZAS-PDGQHHTCSA-N	445.480	1.512	50	20	IDGD	
CC(C)S(=O)(=O)c1ccccc1C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	794730544	MNCSZTVTMZKCAA-UHFFFAOYSA-N	425.532	1.876	50	20	IDGD	
COc1ccccc1N1C[C@H](C(=O)NNc2ccccc2S(=O)(=O)N(C)C)CC1=O	795169568	QOZGDTXMHASFAK-CQSZACIVSA-N	432.502	1.442	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(OC)c(OC)c(C)c1OC	796992760	XCBYZIFTUYPURW-UHFFFAOYSA-N	447.444	1.194	50	20	IDGD	
N#Cc1cc(NC(=O)C(=O)NNC(=O)CNC(=O)OCc2ccccc2)ccc1Cl	797368923	JEIMVPXYQRKYCN-UHFFFAOYSA-N	429.820	1.224	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2cc(Br)ccc2-n2cccn2)n1	797370651	RCEPDRCWUWHAON-UHFFFAOYSA-N	443.261	1.738	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NC[C@@H]3CCC(F)(F)C3)nc2)CC1	797558628	CVPJUDXEPIYSQT-CYBMUJFWSA-N	432.497	1.079	50	20	IDGD	
C=C(C)[C@H]1OCC[C@H]1CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(CC)CC)c1	798117511	CFOQELCWNUCMNW-FUHWJXTLSA-N	438.550	1.642	50	20	IDGD	
COC(=O)c1ccc(S(=O)(=O)NNC(=O)c2cccc(Br)c2)cc1OC	799123511	YSNAXLIQJVCGRW-UHFFFAOYSA-N	443.275	1.868	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@@H]2CCCCN2C(=O)c2ccco2)cc1	802066841	BHSYNGUAPBNJQM-HNNXBMFYSA-N	434.474	1.531	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)C(=O)Nc2ccc(OC(F)F)cc2F)c2ccccc2c1=O	802566498	SEOWFZBMIQCIMZ-UHFFFAOYSA-N	449.345	1.074	50	20	IDGD	
CC(C)(C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1)c1cc(F)cc(C#N)c1	803926252	RMJNNFBQVXGJSU-SFHVURJKSA-N	441.415	1.506	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)Nc1ccc(F)c(N2C(=O)CCC2=O)c1	806744281	VTUIUQNYPROFQF-INIZCTEOSA-N	428.376	1.472	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)N[C@H](C)c1nc2ccccc2[nH]1	807129212	KPHBJKYZUCPTBW-GFCCVEGCSA-N	429.506	1.870	50	20	IDGD	
CCS(=O)(=O)N1CCC([C@@H](C)N(C)CC(=O)NNC(=O)c2cccc(Cl)c2)CC1	808775877	MKJSQHHKKMOBJO-CQSZACIVSA-N	444.985	1.483	50	20	IDGD	
COc1cc(F)cc(NNC(=O)C(=O)Nc2cc(C(N)=O)ccc2OCC(F)F)c1	810400458	HDEZCJDQBUDENS-UHFFFAOYSA-N	426.351	1.659	50	20	IDGD	
Cc1nc(-c2cccnc2)nc(NNC(=O)CNS(=O)(=O)c2cccc(C#N)c2)c1C	810421568	GKEVVJKDIPRPBE-UHFFFAOYSA-N	437.485	1.449	50	20	IDGD	
NS(=O)(=O)c1ccc2c(c1)C(=NNC(=O)Cc1csc(N3CCOCC3)n1)CCC2	811635954	RUHAOHRKMXVRHY-UHFFFAOYSA-N	449.558	1.026	50	20	IDGD	
CC(=O)N1CCc2ccccc2[C@H]1CC(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	812728407	LGQFDBKXNPNSBP-HXUWFJFHSA-N	430.530	1.916	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)Nc1cccc(CN2C(=O)CNC2=O)c1	813837643	REIUCHKGQIZVDT-UHFFFAOYSA-N	446.489	1.137	50	20	IDGD	
CCOc1cc(NC(=O)NNC(=O)[C@H]2CCc3nncn3C2)c([N+](=O)[O-])cc1OCC	814523750	JYDSMSSVHCTULE-NSHDSACASA-N	433.425	1.399	50	20	IDGD	
N#Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2O)ccc1Br	815569422	SOGPUJBRIDXIDY-UHFFFAOYSA-N	433.218	1.191	50	20	IDGD	
CC(C)(C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1)c1ccc2c(c1)OCO2	815734483	IWFCYLNLHFZPBO-UHFFFAOYSA-N	447.513	1.857	50	20	IDGD	
COc1ccc(-n2cnnc2SCC(=O)NNC(=O)COc2ccc(C)cc2)cc1	818849996	PBXLSTDWYAHNNM-UHFFFAOYSA-N	427.486	1.903	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCCCN1CCOCC1	838499157	ZQNANMSRZUSCDV-ZDUSSCGKSA-N	429.315	1.269	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)[C@H](C)N2C(=O)[C@@H]3CCCC[C@H]3C2=O)cc1OC	913069811	NGQOCJFYNXHLHT-NUEKZKHPSA-N	431.489	1.809	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)c2c(C)oc(C)c2S(N)(=O)=O)cc1OC	916144390	JSZNTMSTLRDWFT-UHFFFAOYSA-N	425.463	1.416	50	20	IDGD	
CC(C)NC(=O)Nc1ccc(CNC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1	916602316	KINCWJIZBANIRL-UHFFFAOYSA-N	437.464	1.336	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2ccc(C)cc2O)cc1S(=O)(=O)N1CCCC1	918340806	FFZGUFKGUWYXSR-UHFFFAOYSA-N	433.486	1.569	50	20	IDGD	
CCn1c(CCC(=O)NNC(=O)CC(F)(F)F)nc2cc(S(=O)(=O)N(C)C)ccc21	918364788	UMPMEUVYLCAFAG-UHFFFAOYSA-N	449.455	1.339	50	20	IDGD	
CCN(CCCNC(=O)/C(C#N)=C\c1cc(C)n(C[C@@H]2CCCO2)c1C)S(C)(=O)=O	918670046	HNUOETUIQPPTBL-DTBYZMGXSA-N	436.578	1.979	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@@H](C)Cc2ccccc2F)cc1	919782564	ZBTSIWIZJSPXDJ-HNNXBMFYSA-N	436.509	1.716	50	20	IDGD	
O=C(CN1CCC(NC(=O)NC2CCCCC2)CC1)NNC(=O)c1cccc([N+](=O)[O-])c1	919803210	XPUOEPDVGRDTKO-UHFFFAOYSA-N	446.508	1.452	50	20	IDGD	
N#Cc1ccccc1COc1ccc(C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)cc1	919886816	VHYWQNDHAUCOAK-KRWDZBQOSA-N	428.470	1.268	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)NCC[C@@](O)(c2nccn2C)C(F)(F)F)cc1	920044615	MTTDQHQNACLZQX-GOSISDBHSA-N	443.426	1.532	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)Nc3nc4ccccc4s3)nc2)CC1	920273497	JZSXCTXOJVTCCG-UHFFFAOYSA-N	447.546	1.776	50	20	IDGD	
CCNC(=O)CN1CCCN(C(=O)/C(C#N)=C\c2cc(C)n([C@H](C)COC)c2C)CC1	920455981	KKMSHZFLDLAZPN-LZAZYHHXSA-N	429.565	1.890	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)Nc1ccc2c(c1)C(=O)NC2=O	920940392	HIWJNMUHCBBNDH-UHFFFAOYSA-N	431.474	1.796	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)CO[C@H]3CCOC3)c2)cc1	1116201373	QCNPQPALQCUVME-KRWDZBQOSA-N	449.485	1.063	50	20	IDGD	
CCCNS(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)c2ccccc2Cl)cc1	1117532117	YKKCMDUPKWSZIT-UHFFFAOYSA-N	431.923	1.652	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc4n(n3)CCCO4)C2)C1	1778553333	AKSOWVYJQIUEKK-SCLBCKFNSA-N	441.326	1.140	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4c(c3)CNC4=O)C2)C1	1778725696	FLEZCJIZCPRWCP-VQTJNVASSA-N	440.327	1.610	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](COC(C)=O)OC(C)=O)C1	1779404934	NYTYLVJZZFWAIN-WOCWXWTJSA-N	446.928	1.013	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(O)no2)C1	1779801358	LOJACJOKJQRHEW-CJBNDPTMSA-N	430.299	1.539	50	20	IDGD	
O=C(c1cccc(-c2cnccn2)c1)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1780184844	BMKHOESKYHCKMH-NQIIRXRSSA-N	430.892	1.187	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H]2CC[C@@H]3CCC(=O)N3C2)C1	1780609493	IFGOZXAMWLCJSL-AISJGGJLSA-N	439.984	1.919	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H]3CC[C@H]4CCC(=O)N4C3)C2)C1	1781054831	XOWOXPSCYDTFQG-JJDSTIRJSA-N	425.957	1.625	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)CCC(=O)N3CCCC3)CCO2)C1	1781224720	NJHNOUHLMSGQJE-RTBURBONSA-N	434.364	1.455	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc([N+](=O)[O-])cc3F)C2)C1	1781555379	ZHNDPYDRQZGICC-KDOFPFPSSA-N	429.832	1.431	50	20	IDGD	
CC(C)c1cc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CCC(=O)NN(C)C)C2)on1	1782212344	VJEARHBHFPVXPH-XMSQKQJNSA-N	449.552	1.299	50	20	IDGD	
Cc1cnn([C@@H](C)C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](F)Br)C3)c1	1782514133	JSTVGTBBERNUQG-LUXYFRNMSA-N	445.333	1.957	50	20	IDGD	
O=C(c1cnn2cccc(F)c12)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1782554251	UMHRNDZBGXCUIO-YOEHRIQHSA-N	443.248	1.607	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCn2ccnn2)C1	1782557412	DJUTYPBTNFIDGW-IIDMSEBBSA-N	442.358	1.213	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H]3Cc4ccccc4N3)C2)C1	1782838056	WVMNNCDTUNDRPE-VHFSOBRXSA-N	436.350	1.884	50	20	IDGD	
O=C(c1cnc[nH]1)N1CCO[C@]2(CCN(C(=O)[C@H](Br)Cc3ccccc3)C2)C1	1783019620	YCOPLXRYMLVGGD-UZLBHIALSA-N	447.333	1.859	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](C)Oc1ccccn1)CCO2	1783354013	LXSCTNONCCTIPI-DOXZYTNZSA-N	440.338	1.852	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)CNC(=O)OC(C)(C)C)C2)C1	1783401305	MCZLWSVOKVRWKC-YVEFUNNKSA-N	434.331	1.124	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cccc4c3cnn4C)CCO2)C1	1783534756	YSOQCYWLXWDDGB-DJJJIMSYSA-N	435.322	1.800	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cnc4snnc4c3)CCO2)C1	1783537288	NIDGXLFLTZRYAJ-QFYYESIMSA-N	440.323	1.313	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc4ncccc4c3)C[C@@H]21)[C@@H](O)CCl	1784085861	QLKWLZBRAVXDDK-ZULIPRJHSA-N	431.920	1.357	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3cnc4[nH]ccc4c3)C[C@@H]21)[C@H](O)CCl	1784093828	GRGCSZTWZPBOFC-FJIDUMEYSA-N	434.924	1.075	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc4c3NC(=O)C4=O)C[C@@H]21	1784617920	QLWWDHQLVAYPHN-STECZYCISA-N	447.919	1.822	50	20	IDGD	
C[C@H](CBr)C(=O)Nc1ccc(C2(NC(=O)CN3CCNC3=N)CCC2)cc1	1786068981	GJLBWPVONRWFDW-CYBMUJFWSA-N	436.354	1.991	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc4ccnn34)C[C@@H]21	1786407293	OBZCOPAWJHQLGK-QRTARXTBSA-N	435.322	1.713	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)c1cccc2c[nH]nc12	1787321133	GYSAHTYHQZTYLK-BPUTZDHNSA-N	435.322	1.941	50	20	IDGD	
N=C1NCCN1CC(=O)Nc1ccc(C2(NC(=O)[C@@H](F)Br)CCC2)cc1	1788014621	XWNVAXRXBGPEQB-CQSZACIVSA-N	426.290	1.651	50	20	IDGD	
Cc1nnsc1C(=O)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1	1788141192	OZWSGCWHWUCVAZ-UHFFFAOYSA-N	436.302	1.588	50	20	IDGD	
O=C(CCc1cn[nH]c1)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1	1788144967	IGEGZJHONCJKHW-UHFFFAOYSA-N	432.289	1.470	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc4n(n3)CCC4)[C@H]2C1	1788415035	POSINJHJIURUGO-BCRCDCHUSA-N	429.348	1.659	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc[nH]c4nccc3-4)C[C@@H]21)[C@H](F)Br	1789923225	YVOUVHGNMFHDEK-HJPIBITLSA-N	439.285	1.798	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1ccc(C2(NC(=O)CCN3CCCC3)CCC2)cc1	1791603370	ULJCEGHBYQOZRU-UHFFFAOYSA-N	429.565	1.979	50	20	IDGD	
Cc1nccn1[C@@H](C)C(=O)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1	1791929644	NXUHTFXJRRQOIY-INIZCTEOSA-N	446.316	1.880	50	20	IDGD	
CC(C)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(S(C)(=O)=O)c1	1792695491	YBDNHJRWGYRKQX-SCAQPMJSSA-N	442.965	1.558	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccn3nccc13)C2	1792874370	NPKOEJBZSGFRHX-ZJOBFFGXSA-N	435.322	1.569	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(C)(C)NC(=O)OC(C)(C)C	1793629586	JLFXTLLGSFRNJM-XGUBFFRZSA-N	431.961	1.897	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccon1)C2	1793880619	BSMZCMRPWJBDHX-NEBZKDRISA-N	442.900	1.010	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1c(F)ccc(F)c1F)c1cccc(B(O)O)c1	1793881223	NARPHQVZBCJRRH-MUJYYYPQSA-N	446.234	1.278	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccnnc1	1795020313	XAVLZADQIBQOAH-FZKCQIBNSA-N	437.928	1.861	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1ccc(F)nc1)C2	1795111489	SBISMOQCHJEZDJ-ZSBFGKGUSA-N	428.302	1.528	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1noc2c1CCCC2	1796617695	WLUAIVXQZOUCKX-BTTYYORXSA-N	438.488	1.118	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc2ccn(C)c12	1797587583	QDLWBWCFELYNOV-BCDXTJNWSA-N	425.533	1.803	50	20	IDGD	
Cc1nc2sccn2c1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CO[Si](C)(C)C	1797956869	IIWSURFFYNMJLU-MIFYACCESA-N	436.610	1.759	50	20	IDGD	
CCOc1c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](Cl)CC)cnc2c1cnn2C	1799270150	RREJBEAWMOZPPM-DLTLXFJOSA-N	449.939	1.588	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](O)CCl)C3)C1	1800019217	FZCIHMVTAJDBRG-ZOFXXKQRSA-N	443.972	1.871	50	20	IDGD	
CC[C@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C[C@@H](O)CNC(=O)OC(C)(C)C)C2	1800074521	DRCMZCIKYVMVLC-JKJDWNRSSA-N	431.961	1.918	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCNC(=O)OC(C)(C)C	1800169131	MNPKEXOEIXRLHE-QRJUGERDSA-N	447.960	1.154	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)CBr)C2	1800754952	YYWFQKUINPKTHU-MJDLHHQISA-N	426.149	1.390	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc(C(C)(C)C)cn1)C2	1800756584	ASUXKKCWECJHNF-NFFDBFGFSA-N	439.354	1.761	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCOc1ccc(F)cc1)C2	1800974293	URUKFNSCEOSMBP-CSHUHZATSA-N	428.888	1.438	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc(F)cc1OC)C2	1800983155	PXKJIIWIYWJZNY-MVWRLGRASA-N	428.888	1.220	50	20	IDGD	
C/C(=C/C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)C2)C(=O)O	1802016237	WRKJHXOAECFWDR-IACVHUAVSA-N	445.422	1.492	50	20	IDGD	
COc1ccc([C@H]2C[C@H]2C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CCC(=O)NN(C)C)cc1	1802334974	UTBBVPKAGYKEPO-XOPFUANDSA-N	442.560	1.810	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)Cn2nc(C)cc2C)[C@@H]1c1cccnc1	1804579102	BVOZEYVWAIJASJ-BJLQDIEVSA-N	433.940	1.855	50	20	IDGD	
O=C(CC1CCCC1)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1806190320	VBENIMJUWZDULD-NFBKMPQASA-N	435.333	1.661	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2cc(=O)n3[nH]cnc3n2)[C@@H]1c1cccnc1	1807356537	CFCPDWHDVFCVDK-KEYYUXOJSA-N	443.895	1.150	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)c2ccno2)[C@H]1c1cccnc1	1808415019	RFQOQAJRSWPZSA-YRJCQSRDSA-N	449.471	1.523	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)C2(C#N)CC2)[C@H]1c1cccnc1	1808415395	VQMMCPYZFZRAFO-CRICWCDVSA-N	447.499	1.525	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)[C@H](C)S)[C@H]1c1cccnc1	1808416879	SFSSNBWMGZMURH-NGTHKXITSA-N	442.545	1.540	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC2(CCCN(C(=O)c3cc(C)on3)C2)CC1	1808557720	RXFCACNYAUSGPJ-LFVJCYFKSA-N	440.504	1.962	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC2(CCCN(C(=O)CCN(C)C)C2)CC1	1809534662	KGWHRTJAVMIXFK-JJIBRWJFSA-N	430.553	1.303	50	20	IDGD	
O=C(CCC(F)(F)F)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1	1809976907	WXANYPPFZBLEEI-UHFFFAOYSA-N	426.244	1.554	50	20	IDGD	
Cc1noc(CC(=O)N2CC[C@@H](CNC(=O)CO[Si](C)(C)C)[C@@H]2c2cccnc2)n1	1810542826	ZZSFMDLSPXXUJK-JXFKEZNVSA-N	431.569	1.873	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2cc3cccnn3n2)[C@@H]1c1cccnc1	1811269544	GLRIPCDGBHBIBO-IEZWGBDMSA-N	442.907	1.698	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H](CNC(=O)[C@@H](C)n2ccnn2)[C@H]1c1cccnc1	1812394503	AXAGOMYOMPKIAH-MUIFIZLQSA-N	449.353	1.971	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)[C@H](C)Cn2cccn2)[C@@H]1c1cccnc1	1813028514	RPMFRCGGUOMTBZ-XGXHKWSGSA-N	433.940	1.874	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)Cc3ccccc3F)sc2C1	1813841777	HHOVIGBMHURTSY-CQSZACIVSA-N	447.536	1.810	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1coc(Cl)n1)CC2)c1ccc(B(O)O)cc1	1815337028	JGBANOCKTSUZCV-LLVKDONJSA-N	446.681	1.004	50	20	IDGD	
O=C(Cn1ccccc1=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](F)Br)CC2	1815448959	XJINFDOVCBPCLU-LKFCYVNXSA-N	443.298	1.608	50	20	IDGD	
Cc1ncsc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1	1816493081	QQNDYCXEHNNMIF-AWEZNQCLSA-N	433.538	1.854	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCN2CCOCC2)n[nH]1	1817180581	AIUJWZXAPBDSLB-HIFRSBDPSA-N	442.358	1.908	50	20	IDGD	
C[C@H](C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1)c1ccccn1	1817480005	YZJZLIVOXOZRON-YWZLYKJASA-N	447.304	1.594	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)Cn2cccc([N+](=O)[O-])c2=O)[nH]n1)[C@H](F)Cl	1818043215	IDNXZTQFQHOMQV-NHYWBVRUSA-N	440.819	1.706	50	20	IDGD	
C[C@@H]1CCC[C@H]1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(B(O)O)cc1)CC2	1818876559	OYORUQBMXVAIIC-UHOFOFEASA-N	427.335	1.485	50	20	IDGD	
C[C@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@](C)(Cl)CCl)n[nH]1)n1cnnn1	1820869621	XDFQXLYNOHUWGC-NSODJVPESA-N	429.312	1.886	50	20	IDGD	
CC(=O)N/C(=C\c1ccco1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1	1821223526	WQEZMHFPSURPRU-JWULFMQYSA-N	449.895	1.772	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1)c1cc(O)cc([N+](=O)[O-])c1	1821263022	ZBUWAIIPAJPSRF-GJZGRUSLSA-N	437.840	1.929	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H]2CC[C@H](O)CC2)[nH]n1	1822416520	GOCRBGJWJYIYJB-ZOBUZTSGSA-N	434.541	1.326	50	20	IDGD	
CC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CNC(=O)C(F)(F)F)CC2	1822856856	WHHDSSFIGTZFSU-JGVFFNPUSA-N	426.848	1.751	50	20	IDGD	
CC(C)(C)n1cc(C(=O)N2CCC([C@H]3CCCCN3C(=O)[C@H](O)CCl)CC2)nn1	1824184725	DGAGNBAZEOUSRI-IAGOWNOFSA-N	425.961	1.866	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)CCc2cnc[nH]2)CC1	1825137120	CXNYCBGCTNZYCI-IBGZPJMESA-N	432.569	1.335	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccnnc1O)CC2	1825643123	ZQQXHHNPHDTZMB-HTQZYQBOSA-N	426.296	1.648	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CN1CCSCC1)CC2	1825991451	KSFFRRZCQLUNIS-VXGBXAGGSA-N	432.999	1.358	50	20	IDGD	
O=C(c1cncs1)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827050990	JLBYFLSJFGJTBE-GOSISDBHSA-N	427.335	1.370	50	20	IDGD	
Cc1cccc(/C=C/C(=O)N2CCO[C@@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)n1	1829728102	FCGJAZSLSRBSPM-UEKDZROGSA-N	428.316	1.663	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ncccc3F)C2)C1	1830542678	BIVJBEZCASPIDL-FZKQIMNGSA-N	444.301	1.322	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)c2cc(F)c[nH]2)CC1	1831706874	MOEUMQUKGCZNAS-HXUWFJFHSA-N	427.285	1.381	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)[C@H](F)c1ccccc1	1833652231	BKGONECAXPULJJ-RTBURBONSA-N	425.932	1.869	50	20	IDGD	
Cc1ncoc1C(=O)NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1834260783	DXXLFPSRNGBTMN-OAHLLOKOSA-N	431.306	1.859	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc4c(s3)CCC4)CCO2)C1	1834547565	BXDVQJGFRFGEEZ-FOIQADDNSA-N	442.965	1.561	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)CN3CCCC3=O)CC2)CC1	1834625296	WOFHBFNXRJRGLG-SFHVURJKSA-N	426.989	1.588	50	20	IDGD	
CCc1cc(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](Cl)COC)CC3)CC2)n[nH]1	1834924323	XXYNHZRYABYOHB-KRWDZBQOSA-N	425.961	1.411	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)Cn3ccc(C)n3)CC2)CC1	1837193069	LMEHXUJTDJLTAP-GOSISDBHSA-N	426.945	1.444	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](C)NC=O)CC2)CC1	1838640508	YZPZEFCFYNJHDZ-CZUORRHYSA-N	432.359	1.293	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(Cl)nc3F)C2)C1	1839142607	UEDFCQGHJBHPIV-FZKQIMNGSA-N	434.295	1.962	50	20	IDGD	
O=C(/C=C/C1CCCC1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1839180709	ZBDHFXCFPMDBLV-WXFDERKXSA-N	433.318	1.880	50	20	IDGD	
O=C(c1ccc(F)s1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839198423	ZXFSTTTWKPOSDM-WFASDCNBSA-N	439.278	1.648	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1CC(c3ccccc3)=NN1)CCO2	1839636070	HHCGYRKAGFNFIN-LQBOVUBWSA-N	448.951	1.226	50	20	IDGD	
C=C(C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](Br)CC)CCO2)C(F)(F)F	1839966939	UUXLMONBHVMBKF-SWLSCSKDSA-N	443.260	1.735	50	20	IDGD	
CC[C@H]1CC[C@H](C(=O)N2CCOC[C@]3(CN(C(=O)[C@@H](Cl)COC)CCO3)C2)CC1	1840156504	TZUGTTBCXOSHAQ-RYLXDESZSA-N	430.973	1.913	50	20	IDGD	
O=C(Cc1cccc([N+](=O)[O-])c1)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840187199	MEAGDHFLEDTTBB-GOSISDBHSA-N	446.287	1.397	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)Cc2ccc(F)cn2)C1	1843047279	HDTWXRXZHNJEBG-AFUMVMLFSA-N	426.452	1.101	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)Cc2cccc(C(F)(F)F)c2)C1	1845923917	FAZCFMSXGGMTPW-UHFFFAOYSA-N	440.466	1.824	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC2(CCCN2C(=O)CSCC(=O)O)C1	1846391593	FBXXZMMLUHVKCY-MKMNVTDBSA-N	435.452	1.893	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)C[C@H](O)CNC(=O)OC(C)(C)C	1847870156	NBGLHYXAFJUCGZ-FZKCQIBNSA-N	431.961	1.871	50	20	IDGD	
CSCC[C@H](NC(=O)c1ccco1)C(=O)NNC(=O)c1cc(-c2ccccc2)n[nH]1	17519531	XRLLHUULDCKFQY-AWEZNQCLSA-N	427.486	1.982	50	20	IDGD	
CS(=O)(=O)Cc1nc2ccccc2n1CC(=O)NNC(=O)Cc1ccc(Cl)cc1	27095002	GBISBWOABKIYAF-UHFFFAOYSA-N	434.905	1.624	50	20	IDGD	
CCCS(=O)(=O)NC1CCN(C(=O)NNC(=O)c2cccc(OC(F)F)c2)CC1	728598627	JJYFQUVRABEQNV-UHFFFAOYSA-N	434.465	1.436	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)Cc2cccc(Br)c2)n1	728730731	URYFGECQQOSIKQ-UHFFFAOYSA-N	426.292	1.690	50	20	IDGD	
O=C(NCc1ccnc(OC2CCCC2)c1)NNC(=O)C1CCN(c2ncccn2)CC1	728949919	WHNRHRIEABSCNV-UHFFFAOYSA-N	439.520	1.940	50	20	IDGD	
CN(C)[C@H](CNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)c1ccc(F)cc1	728959962	TVFKQPLHSAWKKO-GOSISDBHSA-N	429.500	1.465	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)NC[C@H]2CN3CCC[C@H]3CO2)c1	729617603	FFZILNNALSLOGQ-AAEUAGOBSA-N	427.299	1.265	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)NCc1nnnn1-c1ccccc1	730582511	XNZSJYANFWZYHV-UHFFFAOYSA-N	446.265	1.334	50	20	IDGD	
COC1CCN(C2(CNC(=O)NNC(=O)[C@H]3COc4ccccc4O3)CCCC2)CC1	730914493	QICITNRQQXBEHJ-LJQANCHMSA-N	432.521	1.580	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NNC(=O)c2cccc(C#N)c2)cc1Br	732247026	BAHYHGDNCLCGTH-UHFFFAOYSA-N	432.234	1.618	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1Cl)C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	733124060	QATSBAYAUCBGMA-NSHDSACASA-N	443.884	1.958	50	20	IDGD	
O=C(CCNS(=O)(=O)c1cccc(Cl)c1)NNC(=O)c1cnn(-c2ccccc2)c1	733170045	NSWPVJSNQCTPHP-UHFFFAOYSA-N	447.904	1.655	50	20	IDGD	
O=C(CNC(=O)NNC(=O)c1cnn(-c2ccccc2)c1)Nc1ccc(-n2cccn2)cc1	733349991	MPMQXOZBPRKZGI-UHFFFAOYSA-N	444.455	1.641	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NCC(=O)NNc2nccc3sccc23)c1	734246629	FMCYDTKTVQGRLQ-UHFFFAOYSA-N	433.515	1.420	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2ccc(C(F)(F)F)nc2)CC1	735117286	OYAGCFHQUVYMQP-UHFFFAOYSA-N	444.439	1.188	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN2CCN(CCN3[C@H](C)CC[C@H]3C)CC2)cc1C	738308188	FCQYYBSAWNKTQB-QZTJIDSGSA-N	435.638	1.870	50	20	IDGD	
CCOc1ccc(C(=O)NNS(=O)(=O)c2cnn(-c3ccccc3OC)c2)cc1OC	743250552	FTUUEIOZCNYICN-UHFFFAOYSA-N	446.485	1.912	50	20	IDGD	
CCN(CC)[C@H](CNC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)c1ccco1	743341870	STPDKWBTUIPDKX-MRXNPFEDSA-N	426.477	1.554	50	20	IDGD	
O=C(CCCNS(=O)(=O)c1ccc2c(c1)OCCCO2)NNC(=O)NC1CCCC1	744052931	YYXMWUHZWHBURW-UHFFFAOYSA-N	440.522	1.179	50	20	IDGD	
CCN(C(=O)[C@H](C)OC(=O)/C(C#N)=C\c1cc(C#N)n(C)c1C)[C@@H]1CCS(=O)(=O)C1	744633059	SYOQHVSSDAASMC-CLCCNSGSSA-N	432.502	1.079	50	20	IDGD	
C[C@@H](CN1CCN(c2ccccc2)CC1)NC(=O)NNC(=O)COc1ccccc1C#N	745840069	TWLXVQKKBYZYTR-SFHVURJKSA-N	436.516	1.478	50	20	IDGD	
Cc1nc(CNC(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)no1	745855293	VGAROVMMDPNCJS-UHFFFAOYSA-N	433.428	1.280	50	20	IDGD	
CCN(Cc1ccc(OC)cc1OC)C(=O)NNC(=O)c1csc(N2CCOCC2)n1	746204361	ZSMKFUWIKHLKNN-UHFFFAOYSA-N	449.533	1.873	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)NCCNS(=O)(=O)c2cccs2)c1C	747133559	PLLDPCMEEUMZCJ-SFQUDFHCSA-N	436.559	1.815	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCCC[C@H]2C)cc1C(=O)NNC(=O)Cc1ccncc1	747324010	WKALWFSBXWRFLK-MRXNPFEDSA-N	430.530	1.957	50	20	IDGD	
Cc1cc(Br)ccc1C(=O)N1CCC[C@@H](C(=O)NNc2nccn(C)c2=O)C1	747938343	RTTIRIYNYZCYNS-CYBMUJFWSA-N	448.321	1.847	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)n1	748014116	HBWPFPWQSYZCPP-UHFFFAOYSA-N	449.514	1.529	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(N2C[C@@H](C(=O)O)CC2=O)cc1)c1cc2ccccc2o1	749867475	YIQPUXRHYRBFGT-ZDUSSCGKSA-N	443.437	1.494	50	20	IDGD	
COc1cc(OC)cc(N2C[C@@H](C(=O)NNC(=O)COc3ccccc3OC)CC2=O)c1	752502878	JCIUYHPLSPEAGV-AWEZNQCLSA-N	443.456	1.292	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)N2CCC(O)(CN3CCOCC3)CC2)c1C	752740048	YTDCIBLMNJWOAF-QNGOZBTKSA-N	430.549	1.344	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)c1noc(Cc2ccccc2)n1	753053127	YGPACJZKVNCDFU-ZDUSSCGKSA-N	443.485	1.769	50	20	IDGD	
COc1cccc(-c2noc([C@H](C)NCC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)n2)c1	755052293	CEPJDWKVJKCNFZ-LBPRGKRZSA-N	440.416	1.765	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1	755361052	SRIUPWGVULYBAV-GOSISDBHSA-N	448.501	1.710	50	20	IDGD	
COC(=O)CNC(=O)c1ccc(NC(=O)NNC(=O)COc2ccc(Cl)cc2)cc1	755550441	VYXNXDNZYKLZNQ-UHFFFAOYSA-N	434.836	1.475	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)Nc1cc(C(F)(F)F)ccc1-n1cccn1	755558254	PRPQPJDSEPMNBI-SNVBAGLBSA-N	431.396	1.479	50	20	IDGD	
COCCOC(=O)Nc1cccc(NC(=O)NNC(=O)c2nnc(O)c3ccccc23)c1	756220340	DTLWYUFIIGEBQJ-UHFFFAOYSA-N	440.416	1.997	50	20	IDGD	
CCCn1cc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)cn1	756781541	GKTNFQGIZCTVCS-UHFFFAOYSA-N	434.522	1.934	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2scnc2Br)ccc1Cl	757716256	TXWXFODVLQEWSO-UHFFFAOYSA-N	439.700	1.281	50	20	IDGD	
COCc1nc2n(n1)C[C@H](NC(=O)NNC(=O)c1ccc(OC(C)C)c(OC)c1)CC2	757791653	ZOPYMJYDZYHIDJ-CQSZACIVSA-N	432.481	1.179	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)c3cc(C)ncn3)c2)cc1	758042933	GPQCQWCKBWXEQN-UHFFFAOYSA-N	441.469	1.669	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)N[C@@H]2CN(C(=O)OC(C)(C)C)C[C@H]2C#N)cc1	758770400	LDXNTPJZYAZOCT-NVXWUHKLSA-N	431.493	1.717	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)N=c1cc[nH]cc1I	760034385	NLTIICDQGIGKRK-UHFFFAOYSA-N	426.214	1.478	50	20	IDGD	
CCOC(=O)C[C@@H](C)CNC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	760877168	DNVQOUKHWSIMNP-CQSZACIVSA-N	440.522	1.004	50	20	IDGD	
O=C(COC(=O)Cc1cccc(I)c1)NNC(=O)c1ccccc1	761497481	LDBYTEDHJMXLJA-UHFFFAOYSA-N	438.221	1.838	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H]1[C@H]1COCCC1=NNC(=O)C(=O)Nc1ccccn1	762434534	QANXSKOOQVKALS-GOEBONIOSA-N	431.493	1.928	50	20	IDGD	
Cc1nn(-c2ccc(Br)cc2)cc1C=NNC(=O)Cc1cc(O)nc(O)n1	763364620	SACKYVVCIMIQRW-UHFFFAOYSA-N	431.250	1.837	50	20	IDGD	
COC(=O)c1ccc(OC)c(S(=O)(=O)NNC(=O)CSc2ccccc2O)c1	763413522	QRFIBKLIQACRRO-UHFFFAOYSA-N	426.472	1.289	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2cc(C)cc(C)c2)c1	763507791	FIPDROUGLQVWFL-UHFFFAOYSA-N	446.529	1.734	50	20	IDGD	
CN1C(=O)COc2ccc(NC(=O)C(=O)NNC(=O)c3cc4ccccc4cc3O)cc21	763518765	YCYONSABCNZCOS-UHFFFAOYSA-N	434.408	1.300	50	20	IDGD	
C[C@@H](Cn1ncc2ccccc2c1=O)NC(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	763549715	ZSGCNZUXFYEGAP-AWEZNQCLSA-N	447.455	1.321	50	20	IDGD	
O=C(NNC(=O)c1ccccc1F)C(=O)Nc1cc(Br)cnc1-n1cccn1	763562590	XTCIWSWFYHAPIB-UHFFFAOYSA-N	447.224	1.569	50	20	IDGD	
CC[C@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1	763573013	PMTLCICWNZIWLF-SCLBCKFNSA-N	440.456	1.141	50	20	IDGD	
O=C(CSc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1ccccc1-n1cncn1	763732290	BKFOEQATJMRZKE-UHFFFAOYSA-N	430.877	1.799	50	20	IDGD	
CCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)CSc2ccc(Cl)cc2)cc1	763732631	DRCFTTPRYHEALE-UHFFFAOYSA-N	434.905	1.968	50	20	IDGD	
COCc1ccccc1NC(=O)C(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12	763791434	RLPGFNXBEOGLDP-UHFFFAOYSA-N	437.456	1.524	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2sccc2C(=O)OC)cc1	763861298	NPCGTTRMZJPKHM-LLVKDONJSA-N	435.458	1.487	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)N(C)CCO3)cc1	763862524	XWHZHIQZZXYDJP-AWEZNQCLSA-N	442.472	1.467	50	20	IDGD	
CC(=O)N1CCCc2cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc3ccc(F)cc3)ccc21	763866679	QUOZBMXXIMGBOJ-CYBMUJFWSA-N	442.447	1.678	50	20	IDGD	
COc1cc(F)c(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(C(C)=O)cc2)cc1F	763872572	OMBXTVOHOVFXRN-NSHDSACASA-N	435.383	1.729	50	20	IDGD	
COC(=O)c1csc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(C(C)=O)cc2)c1C	763879002	VKKHCUYBWPQSAG-GFCCVEGCSA-N	447.469	1.599	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccc(Br)c(Cl)c2)n1	763893773	ZUYUFQIGSVBQMD-UHFFFAOYSA-N	428.674	1.702	50	20	IDGD	
CCOc1cc(Cl)ccc1NC(=O)C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	763916960	LQRCDOYEAVBSJI-UHFFFAOYSA-N	429.824	1.114	50	20	IDGD	
O=C(Cc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1ccc(N2C(=O)CCCC2=O)cc1	763932894	VEKGWTABSKZSFJ-UHFFFAOYSA-N	442.859	1.712	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)Cc2ccc(Cl)cc2)c(=O)n(-c2ccccc2)n1C	763936092	CYQHJKJAXYXYTE-UHFFFAOYSA-N	441.875	1.466	50	20	IDGD	
COCCOc1ccc(C#N)cc1NC(=O)C(=O)NNC(=O)c1cc(Cl)ccc1O	763974670	VRPNBPPSKQMBDR-UHFFFAOYSA-N	432.820	1.342	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)on2)c(OC)c1OC	764004453	WOQZGFBEZKZLJU-UHFFFAOYSA-N	440.412	1.767	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)Nc1ccc(N2CCCC2=O)cc1	764004664	KYGSBFSJYDRVRF-UHFFFAOYSA-N	448.277	1.314	50	20	IDGD	
Cc1cn(-c2ccccc2)nc1NC(=O)C(=O)NNC(=O)c1cc(Br)cn1C	764005306	XUTXMJWKOOZSIK-UHFFFAOYSA-N	445.277	1.681	50	20	IDGD	
COC(=O)c1ccc(OC)cc1NC(=O)C(=O)NNC(=O)c1ccc(Cl)cc1OC	764012557	SHIXZQKNJWCUGQ-UHFFFAOYSA-N	435.820	1.544	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)cc1F	764126676	OECBTUHRUGEFMW-UHFFFAOYSA-N	425.800	1.610	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccc(Oc2ncccn2)cc1C	764136813	UDPLXKGJXPUXAO-UHFFFAOYSA-N	435.440	1.915	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2O1)C(=O)Nc1ccc(C(=O)NC2CCCC2)cc1	764165455	ZAOBANZQAQTBLX-IBGZPJMESA-N	436.468	1.449	50	20	IDGD	
CCN(Cc1ccccc1NC(=O)C(=O)NNC(=O)Cn1ccc2ccccc21)C(C)=O	764239241	IHHFGJPYZJTPFV-UHFFFAOYSA-N	435.484	1.796	50	20	IDGD	
Cc1cnn(Cc2cc(F)ccc2F)c1NC(=O)C(=O)NNC(=O)c1scnc1C	764247626	VBJPHNXGHDNYAL-UHFFFAOYSA-N	434.428	1.683	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2scnc2C)ccc1-n1nnnc1C(C)C	764248159	ZTYKMPGIPZYWHF-UHFFFAOYSA-N	428.478	1.259	50	20	IDGD	
O=C(NNC(=O)c1cccc(OC(F)F)c1)C(=O)Nc1cccnc1OCC(F)F	764259091	CHUKEQCMIFMYNM-UHFFFAOYSA-N	430.314	1.727	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)COc3ccccc3O)cc2)C[C@@H](C)O1	764276692	ASIUBJNKXJBECT-GASCZTMLSA-N	442.472	1.171	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)CCc2ccccc2O)cc1Cl	764277717	GUGOMUCJKDOJQF-UHFFFAOYSA-N	449.847	1.316	50	20	IDGD	
CC(C)(C(=O)NNC(=O)C(=O)Nc1cccc(Cn2cccnc2=O)c1)c1ccccc1	764314675	YAUCMLKZTNTVOG-UHFFFAOYSA-N	433.468	1.355	50	20	IDGD	
CC(=O)Nc1cc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c(F)cc1F	764343617	TXBAGVGUIRNUFV-UHFFFAOYSA-N	442.382	1.509	50	20	IDGD	
Cc1ccc(N2CCOC2=O)cc1NC(=O)C(=O)NNC(=O)C(F)(F)Oc1ccccc1	764377228	BEUPWKCCURGDGR-UHFFFAOYSA-N	448.382	1.709	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cccc(C(=O)OC)c3)n[nH]2)cc1	764384760	LDGIHBLCRPJTEQ-UHFFFAOYSA-N	435.440	1.825	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc(-n4cncn4)nc3)n[nH]2)cc1	764384981	PXSFNUVUJIFTFL-UHFFFAOYSA-N	445.443	1.015	50	20	IDGD	
CC(C)(C)CC(=O)NNC(=O)c1cc(C(=O)NNC(=O)CC(C)(C)C)cc([N+](=O)[O-])c1	764464376	YYFFDLCNJZLIQI-UHFFFAOYSA-N	435.481	1.989	50	20	IDGD	
COc1ccc(CNC(=S)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cc1	764514222	LPWWDRIRWRUCIL-UHFFFAOYSA-N	441.557	1.149	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)Nc1nc(CS(C)(=O)=O)no1	765244658	FGEAPFHGDFAPSY-UHFFFAOYSA-N	436.475	1.513	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C[C@H](NC(N)=O)c2cccs2)n[nH]1	765601690	SBDWFYNWWJVKNT-ZDUSSCGKSA-N	428.474	1.708	50	20	IDGD	
COC(=O)c1cccc(C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)n1	765756562	XYRSTRBNCRYGJC-UHFFFAOYSA-N	445.907	1.100	50	20	IDGD	
Cc1cc(S(=O)(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)ccc1C#N	766546206	AQVPTQKOKYEXDJ-UHFFFAOYSA-N	448.526	1.275	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)c1nn(-c2ccc(F)cc2)ccc1=O	767347856	UJRSWDURIHNGIX-UHFFFAOYSA-N	438.415	1.227	50	20	IDGD	
COc1ccc(NNC(=O)CNC(=O)[C@H]2c3ccccc3C(=O)N2C2CC2)c([N+](=O)[O-])c1	768335199	HIRTXJXEHLZQGI-LJQANCHMSA-N	439.428	1.522	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	768635614	HEIVYBNRVSKLFT-UHFFFAOYSA-N	427.504	1.106	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)[C@@H](Cc1ccccc1)n1nnnc1C	768645636	RLLWPSPQEMCDKS-OAHLLOKOSA-N	430.490	1.321	50	20	IDGD	
CCc1c(C(=O)NNC(=O)CCN2C[C@H](C)O[C@@H](C)C2)cnn1-c1ccccc1OC	769648826	SQDKLHGJWXROKI-HOTGVXAUSA-N	429.521	1.704	50	20	IDGD	
COc1cc2ncn(CCCC(=O)NNC(=S)NCCSC)c(=O)c2cc1OC	769768123	YXKCDFUSSJIXGT-UHFFFAOYSA-N	439.563	1.052	50	20	IDGD	
CN(CCc1ccccn1)C(=O)CNC(=O)NNc1nc(O)c2cnn(C(C)(C)C)c2n1	770374685	ZWPOSADAPIKRKD-UHFFFAOYSA-N	441.496	1.009	50	20	IDGD	
COC(=O)CCN1CCN(C(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)[C@H](C)C1	770655601	FTZUBLCCXNVWSY-ZIAGYGMSSA-N	426.901	1.417	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)Cc2cc(F)ccc2Br)n1	771404067	XDLWWZXWSVQWQQ-UHFFFAOYSA-N	444.282	1.829	50	20	IDGD	
CN(C)C(=O)COc1ccc(NC(=O)C(=O)NNc2ccc(C(F)(F)F)cn2)cc1	773679525	GXDIKDAKMHWFIQ-UHFFFAOYSA-N	425.367	1.649	50	20	IDGD	
Cc1cc(S(=O)(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c(C)o1	776272210	QGHZSWJDWZZIOB-UHFFFAOYSA-N	427.504	1.304	50	20	IDGD	
CCOC(=O)N1CCC[C@H]([C@@H](C)NC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)C1	776934440	GZJKYOYYUNWHTD-CABCVRRESA-N	444.492	1.779	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCC(Oc3cncc(Cl)n3)CC2)cc1OC	778185606	MGRLSURXUWIREY-UHFFFAOYSA-N	449.895	1.452	50	20	IDGD	
COc1ccc(N2CCN(C(=O)/C=C\C(=O)NNc3nc(-c4ccncc4)no3)CC2)cc1	778255422	VUDWYFIRONEEJI-SREVYHEPSA-N	449.471	1.488	50	20	IDGD	
CCOC(=O)c1cc(F)cc(S(=O)(=O)NNC(=O)CSc2ccccc2O)c1	778643277	NUGZUPJVSGHSBV-UHFFFAOYSA-N	428.463	1.810	50	20	IDGD	
Cc1nc([C@@H]2COCCN2C(=O)CCC(=O)C(C#N)=C2N(C)c3ccccc3N2C)no1	779694479	XQMNDHUJPCIMLD-SFHVURJKSA-N	436.472	1.949	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCC[C@@H]2CCCCO2)c1	780908176	RIOKLBWBNKTJDH-INIZCTEOSA-N	426.539	1.620	50	20	IDGD	
Cc1ccc(CNC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c(N2CCCC2)n1	781385733	PQWXYMUYNDSJNM-UHFFFAOYSA-N	435.488	1.381	50	20	IDGD	
CCN1CCN(C(=O)Cc2ccc(NC(=O)C(=O)NNc3ccccc3F)cc2)CC1	782706932	GFOGXJVUYCNSIZ-UHFFFAOYSA-N	427.480	1.614	50	20	IDGD	
CCOc1ncccc1NC(=O)C(=O)NNc1ccccc1S(=O)(=O)NC(C)(C)C	784833223	LVCPFZYLGDSWMS-UHFFFAOYSA-N	435.506	1.639	50	20	IDGD	
CC(=O)Nc1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)cc1	784835958	MDZMTLMMTXDMSA-UHFFFAOYSA-N	426.401	1.723	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)C(=O)Nc2cccn(Cc3ccc(F)cc3)c2=O)c1	784850748	BRRLSTLHMCIZRI-UHFFFAOYSA-N	438.415	1.904	50	20	IDGD	
O=C1CN(c2ccc(NC(=O)C(=O)NNc3cc(F)c(F)c(F)c3)cc2Cl)CCN1	785083060	CMVZHDRPEGJFSQ-UHFFFAOYSA-N	441.797	1.775	50	20	IDGD	
COCC(=O)N1CCc2cc(NC(=O)C(=O)NNc3nc(C(F)(F)F)cs3)ccc21	785147413	GLPNPIWNVJEIIM-UHFFFAOYSA-N	443.407	1.779	50	20	IDGD	
O=C(COC(=O)Cc1cc(-c2ccccc2)on1)NNC(=O)[C@H]1COc2ccccc2O1	785972282	ASTFAIHQPOAVBG-LJQANCHMSA-N	437.408	1.415	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(N3CCNC3=O)c2C)cc1C	787540576	ARIXZIBLWQXCHT-UHFFFAOYSA-N	439.472	1.306	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)Nc2ccc(Cl)c(S(C)(=O)=O)c2)cc1	788308350	VBZQFFJBCAHMEJ-UHFFFAOYSA-N	427.866	1.984	50	20	IDGD	
CN(C)[C@H]1CCOc2c(NC(=O)C(=O)NNC(=O)c3ccc4c(c3)OCCO4)cccc21	789731441	HUHXIKBMNFTEBY-INIZCTEOSA-N	440.456	1.243	50	20	IDGD	
CC(C)Cn1c(=O)nc(O)c2c(C(=O)NNc3nc4ccccn4n3)cc(C3CC3)nc21	791258535	QUZFCKSVHDNQOX-UHFFFAOYSA-N	434.460	1.830	50	20	IDGD	
N#Cc1ccc(C[C@@H](C#N)C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)cc1	792209259	MKIVKWLNFMYXEG-SFHVURJKSA-N	439.497	1.405	50	20	IDGD	
COc1ccccc1NC(=O)CN1CCN(C(=O)NNC(=O)c2cccc(C)n2)CC1	793229268	UWYTXTIQYRTZAX-UHFFFAOYSA-N	426.477	1.009	50	20	IDGD	
CS(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)c2cc3c(s2)CCCCC3)cn1	794576451	JRUCEOYSPQHSDD-UHFFFAOYSA-N	429.545	1.439	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNc2ccccc2[N+](=O)[O-])(S(C)(=O)=O)CC1	794739099	AFDSDDWXLQDSFH-UHFFFAOYSA-N	442.494	1.852	50	20	IDGD	
Cc1ccc(CS(=O)(=O)N2CCN(S(=O)(=O)CBr)CC2)c(F)c1	795156409	NNKNIWJENGLNBK-UHFFFAOYSA-N	429.333	1.264	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)[C@](C)(NC(C)=O)c1ccc(S(C)(=O)=O)cc1)c1ccccc1	797449360	OAFIEZYEPFQFGV-DENIHFKCSA-N	445.541	1.783	50	20	IDGD	
CC(=O)N[C@@](C)(C(=O)NNc1ncnc2ccsc12)c1ccc(S(C)(=O)=O)cc1	797744601	ZJKUVVUEIYMMAN-GOSISDBHSA-N	433.515	1.589	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNS(=O)(=O)c1ccc(Cl)cc1Br	799122537	AFDIACKGRUCUIQ-UHFFFAOYSA-N	426.720	1.717	50	20	IDGD	
CSC[C@@H](C)C(=O)N1CCC(C(=O)OCC(=O)NNC(=O)c2cccc(C)c2)CC1	799539092	SUDGZQPRXWWWKO-OAHLLOKOSA-N	435.546	1.537	50	20	IDGD	
COC(=O)Cc1cc(=O)n(-c2ccc(C(=O)NNc3ccc4c(=O)[nH]ccc4c3)cc2)[nH]1	803435330	VEOOAPSEEUSPJN-UHFFFAOYSA-N	433.424	1.480	50	20	IDGD	
O=C(NC[C@H](c1cccc(F)c1)N1CCOCC1)NNc1ccc(-n2ccnc2)nn1	805003844	HSMGQOBHBKVAIT-QGZVFWFLSA-N	426.456	1.501	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(F)c(N3CCOCC3)cc2F)cc1F	806988442	ZYFJBIWJOVCKSN-UHFFFAOYSA-N	436.390	1.649	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)CCNS(=O)(=O)c1ccc2ccccc2c1	807368423	GLYMWWZPAQAEJQ-UHFFFAOYSA-N	437.518	1.445	50	20	IDGD	
COc1cc(NC(C)=O)c(Cl)cc1S(=O)(=O)NNC(=O)c1ccc(C)cc1O	808079045	MJTZKJUZXMHBEQ-UHFFFAOYSA-N	427.866	1.944	50	20	IDGD	
CCc1cc(NNC(=O)CNS(=O)(=O)c2ccc(C)cc2)nc(-c2ccccn2)n1	810384879	JVHSSKWIXMCSSD-UHFFFAOYSA-N	426.502	1.831	50	20	IDGD	
CNS(=O)(=O)c1ccc(O)c(NC(=O)/C(C#N)=C\c2cc(C)n(CCOC)c2C)c1	812361023	LMNDWXUFOCXXHJ-YBEGLDIGSA-N	432.502	1.911	50	20	IDGD	
COC(=O)c1cc(C)ccc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	813033952	SOEJPULOSUKPKQ-UHFFFAOYSA-N	434.474	1.114	50	20	IDGD	
N#Cc1ccc(O[C@H]2CCN(C(=O)NNC(=O)CNC(=O)OCc3ccccc3)C2)nc1	814328491	YQBIPXFFRDJBCT-KRWDZBQOSA-N	438.444	1.074	50	20	IDGD	
COC(=O)C(C)(C)c1csc(NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)n1	815569519	XJAHBVQDWZVZBD-UHFFFAOYSA-N	443.485	1.335	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@H]1CCO[C@@H](c2ccccc2)O1	816827746	CWGLEDCVGHWKAF-DNVCBOLYSA-N	432.502	1.553	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNS(=O)(=O)c3cc(C(=O)O)cc(C(=O)O)c3)cc2C1	832100109	ZHKBYFDXJFEVEB-VIFPVBQESA-N	438.483	1.893	50	20	IDGD	
CCCOc1ccc(C(=O)NNS(=O)(=O)c2ccc(S(C)(=O)=O)cc2)cc1OC	874075809	XUUJOXMIACONLJ-UHFFFAOYSA-N	442.515	1.511	50	20	IDGD	
CCOC(=O)N1CCC[C@H](C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)C1	912893543	LVUIMVGXHCFZFI-SFHVURJKSA-N	431.537	1.215	50	20	IDGD	
O=C(CCSc1ccc(F)cc1)NNC(=O)CNS(=O)(=O)c1c(F)cccc1F	913035350	XVAFSNJNXMNOIV-UHFFFAOYSA-N	447.460	1.712	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C2=NN(c3ccc(F)cc3)[C@@H](C(N)=O)C2)c1	913081419	OESXWYNAQQISBV-GOSISDBHSA-N	427.436	1.089	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)CNS(=O)(=O)c1ccc(Br)cc1	913263425	CKZVTOMRGBQLRL-UHFFFAOYSA-N	426.292	1.497	50	20	IDGD	
CCOC(=O)N1CCC(NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)CC1	915878829	KHLXRBGUIDROAX-UHFFFAOYSA-N	446.552	1.150	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2cccc(N(C)C)c2)cc1	915924743	FGYOPPMDAMVZFV-UHFFFAOYSA-N	447.561	1.927	50	20	IDGD	
CCO[C@@H]1C[C@@H]1C(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2OC)c1	916095370	GPGPYIYYUKPXGH-MAUKXSAKSA-N	433.486	1.682	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)Cc1cc2ccccc2nc1O	916099418	YLDDAGAXGSGJTO-UHFFFAOYSA-N	433.512	1.843	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCCN2CCCCC2)c1	916195996	JRHLXEFTLVFVMH-UHFFFAOYSA-N	439.582	1.537	50	20	IDGD	
Cc1ccc([C@H](CNC(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)N2CCOCC2)o1	916227566	CLJUJUPLTRBSHL-WBVHZDCISA-N	434.468	1.898	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)c2cnn(-c3ccccc3)n2)cc1	916550561	PVRLPMQWLASIMR-UHFFFAOYSA-N	434.485	1.763	50	20	IDGD	
O=C(Cn1cnc([N+](=O)[O-])n1)NNC(=O)c1ccc(COc2ccc(Cl)cc2)cc1	916733799	NOONXDMBEYHHCU-UHFFFAOYSA-N	430.808	1.880	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1	918001743	HIYXUGSEIVIJPN-KRWDZBQOSA-N	449.515	1.489	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)C2=NN(Cc3ccc(F)cc3)C(=O)CC2)cc1	919366126	QMSNMWKMAYPXRP-UHFFFAOYSA-N	440.431	1.617	50	20	IDGD	
COc1ccc(-n2ccc(CNC(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)n2)cc1	919916133	CMYVZYLGKBFDSH-UHFFFAOYSA-N	447.455	1.272	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)[C@@H]2CCCN(C(=O)C(C)(C)C)C2)cc1OC	920720795	QQKHDSBEBYCKTA-OAHLLOKOSA-N	449.504	1.293	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)Nc2cccc(CN3CCC[C@@H]3C(N)=O)c2)cc1C	920930310	FUFPFGCKBZMJET-HXUWFJFHSA-N	439.516	1.985	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)C1(Sc2ccccc2)CC1	1116363049	DVDVNYCKLXASTD-UHFFFAOYSA-N	438.553	1.917	50	20	IDGD	
O=C(NNC(=O)c1n[nH]c2c1CCCC2)c1cn(-c2ccccc2Br)nn1	1317800839	XKPVPRKPHPJKQN-UHFFFAOYSA-N	430.266	1.707	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)N[C@H]2CCN(c3cnn(C)c3)C2)cc1OC	1318623935	SXFZUDRGPBRXGL-INIZCTEOSA-N	430.509	1.831	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)[C@H]2CN(Cc3ccccc3)CCO2)CC1	1318683313	UKCKMUHINHDGJF-LJQANCHMSA-N	446.548	1.682	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccc(F)cc2C1)c1ccc(S(=O)(=O)N2CCCC2)cc1	1319668347	LRRKYFIDMZHQNJ-INIZCTEOSA-N	447.488	1.623	50	20	IDGD	
Cn1cc(S(=O)(=O)NNC(=O)c2ccccc2Cl)cc1C(=O)NCC(F)(F)F	1320057954	HZJURBGPPJDNIE-UHFFFAOYSA-N	438.815	1.594	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)c2ccc(NC(=O)c3ccc(O)nc3)cc2)C[C@@H](C)O1	1321730464	KAIHHQYXBJCBJK-HUUCEWRRSA-N	441.488	1.300	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cccc(-n3ccc(C)n3)c2)cc1	1322080293	KTTXDDHUFARBBS-UHFFFAOYSA-N	441.513	1.571	50	20	IDGD	
C[C@H]1Cc2cc(S(=O)(=O)NNC(=O)C3CCN(C(=O)OC(C)(C)C)CC3)ccc2O1	1322956812	DZSYOJIOQBARIG-ZDUSSCGKSA-N	439.534	1.967	50	20	IDGD	
O=C(NNC(=O)c1c[nH]c2ccccc12)NC1CCN(S(=O)(=O)C2CCOCC2)CC1	1323039012	JCGVKQGAKPLKPB-UHFFFAOYSA-N	449.533	1.085	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)Nc2cccc(S(C)(=O)=O)c2)CC1	1323811946	QJYXXVQUCSXVSJ-UHFFFAOYSA-N	440.522	1.890	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(Cl)nc(OC)c3)C2)C1	1779794472	LQAQNCIVJVYNSN-FZKQIMNGSA-N	432.304	1.441	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)c3cnc4ncccn34)CCO2)C1	1781229116	CCPUNPQWRMSGNV-QZTJIDSGSA-N	426.304	1.409	50	20	IDGD	
O=C(c1onc2ccccc12)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781334763	ZUTLHVKOUGQEKE-YOEHRIQHSA-N	426.242	1.962	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2)[C@@H]1CCc2ccccc2C1	1781937179	XZZKACHILXZIKS-VLVHOKLOSA-N	434.964	1.905	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](C)Br)C2)n(C)n1	1781996879	XCJMYFHWBWHJCH-DDUZABMNSA-N	427.343	1.639	50	20	IDGD	
CCOC(=O)O[C@@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](Cl)COC)C1	1782178575	AVTWWQZLTXGXDW-NRTGNBEESA-N	434.917	1.316	50	20	IDGD	
O=C(c1ncc[nH]1)N1CCO[C@@]2(CCN(C(=O)[C@@H](Br)Cc3ccccc3)C2)C1	1783018609	NRXMWSFNFRCNBM-OXJNMPFZSA-N	447.333	1.859	50	20	IDGD	
CN(C)CC(=O)N1CCO[C@]2(CCN(C(=O)[C@H](Br)Cc3ccccc3)C2)C1	1783024059	SZDRGFIOBYNVQW-YLJYHZDGSA-N	438.366	1.384	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccn4cncc4c3)CCO2)C1	1783349966	XKRYBARUVUIMQF-APWZRJJASA-N	435.322	1.951	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(O)ccc3O)CCO2)C1	1783354320	YCWQLFHMSXAMPM-KDOFPFPSSA-N	427.295	1.715	50	20	IDGD	
COC(=O)c1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](C)Br)C3)C2)cn1	1783534041	CXCNXPISCBTBTQ-SGTLLEGYSA-N	440.294	1.095	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cccc(F)c3[N+](=O)[O-])CCO2)C1	1783538089	SZDUODLXWZLDHE-DIFFPNOSSA-N	444.257	1.961	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)Cc3c[nH]c4cc(OC)ccc34)CCO2)C1	1783871168	NINYVMLQUCBYBD-XMSQKQJNSA-N	449.935	1.803	50	20	IDGD	
CC(C)(C)OC(=O)N1C(=O)CC[C@@H]1C(=O)N1CC[C@@]2(CN(C(=O)[C@@H](F)Cl)CCO2)C1	1784192997	ULZIEGNCRJQTTI-TVZGQMOCSA-N	447.891	1.277	50	20	IDGD	
O=C([C@H](F)Cl)N1CC[C@H]2CO[C@@H](CNC(=O)C3(C(=O)Nc4ccccc4)CC3)[C@H]2C1	1784560439	FTNXWBRNZSEAKF-HJWJTTGWSA-N	437.899	1.919	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)CCCNC(=O)OC(C)(C)C)C2)C1	1785570178	HPFHIRGVVNRUNC-MGPUTAFESA-N	447.960	1.375	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](N)Cc3cccnc3)[C@H]2C1	1787474559	AWZNAUCXWWXCFL-LLYLOPHFSA-N	443.375	1.167	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21)c1cn2cc(F)ccc2n1	1788345780	RZHICFDXPKJCBG-JKOKRWQUSA-N	429.279	1.870	50	20	IDGD	
C[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]21)N1C[C@@H]2C[C@H]2C1	1788513613	ZGEUMQHCUPKMCR-NHAGCDNQSA-N	432.392	1.543	50	20	IDGD	
CN(C)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]2C1	1789922238	IQCUUMGVCUEJQY-DLKVLKDVSA-N	443.317	1.431	50	20	IDGD	
Cc1cnn([C@@H](C)C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)Br)C[C@@H]32)c1	1791597906	FIVSFQQQWGYSFR-QXKUPLGCSA-N	427.343	1.516	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1ccc(C2(NC(=O)C(C)(C)NCCC#N)CCC2)cc1	1791599407	KCQGJHWGIZPELT-UHFFFAOYSA-N	442.564	1.775	50	20	IDGD	
C[C@H](Cn1cncn1)C(=O)NC1(c2ccc(NC(=O)CCC(=O)NN(C)C)cc2)CCC1	1791601183	SRRLWZMMCRAMMW-MRXNPFEDSA-N	441.536	1.421	50	20	IDGD	
C[C@H](Oc1ccccn1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21	1791618659	KTSKPFKQXXUESW-VGWMRTNUSA-N	440.338	1.614	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(Cl)cnc1O	1792386509	VFJYVQHLIUKCFO-NJBDSQKTSA-N	446.729	1.675	50	20	IDGD	
C[C@H](NNc1ccccc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CO[Si](C)(C)C)C2	1792507185	YXJKTBYIJOTBLP-LJCCNALRSA-N	434.613	1.433	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CCN1C(=O)OC(C)(C)C)C2	1793447838	NKUQDZNHINNJAQ-NNXHMXCWSA-N	443.972	1.993	50	20	IDGD	
O=C(/C=C/c1cccc(C(F)(F)F)c1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2	1793698740	ZLLWJRLRXPNVQJ-YJCYCJFJSA-N	446.853	1.908	50	20	IDGD	
O=C(/C=C/C(=O)c1cccs1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1	1796190975	KEGGEYAJWYITIP-VOHBNYOCSA-N	438.314	1.119	50	20	IDGD	
COc1ccc2oc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3cccc(B(O)O)c3)cc2c1	1796191532	UXUKZBFHJGSEGM-REPLKXPHSA-N	448.284	1.687	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccoc1C(F)(F)F)c1ccc(B(O)O)cc1	1797016936	OLZNDWBOAKZTHN-QDMKHBRRSA-N	436.195	1.544	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2nc[nH]c2c1	1797410453	FGPDFTIPSILCEE-UMPJEAMMSA-N	435.322	1.940	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc3c(c1)OCO3)C2)[C@H](F)Br	1799346716	XZABWWAKRKXTIO-LZDSYCOUSA-N	443.269	1.238	50	20	IDGD	
CC(C)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CC(c2ccccc2)=NN1	1800152754	DKSPHWCYVNDDED-NBMJBFSESA-N	432.952	1.607	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c[nH]c3ccc(OC)nc13)C2	1800979180	WCMKMZMLKYCZSV-IFOZYUSPSA-N	436.896	1.029	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)[C@H]2CCCCO2)[C@@H]1c1cccnc1	1802586571	AQYIEELNVUNYPR-OPYAIIAOSA-N	431.537	1.030	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cccc3[nH]ncc23)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803139906	XGUKXSLLDHBORR-ZOCIIQOWSA-N	427.892	1.877	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CC23CCCN2CCC3)[C@H]1c1cccnc1)[C@@H](O)CCl	1803140383	CYIHNFSZOKVROC-BJLQDIEVSA-N	434.968	1.706	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)CN2C(=O)C=CC2=O)[C@@H]1c1cccnc1	1803694731	LVFGZBNPBZAQGM-TWOQFEAHSA-N	432.908	1.420	50	20	IDGD	
CC(C)(C)OC(=O)CC(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1	1803896762	RVSZJUATMQJJSZ-MPGHIAIKSA-N	425.913	1.419	50	20	IDGD	
CCOCC(=O)N1CC[C@@H](CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@H]1c1cccnc1	1808413470	BBDZPDNIIYBDCL-YVIKVBFHSA-N	440.504	1.258	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cc(O)n[nH]2)[C@H]1c1cccnc1)[C@@H](F)Br	1808662413	ZZDSRWUAGSGFHJ-LEWSCRJBSA-N	426.246	1.520	50	20	IDGD	
CCc1cc(C(=O)N2CCC3(CCCN(C(=O)c4ccc(B(O)O)cc4)C3)CC2)no1	1809971254	NNIMBUWLTVOCDI-UHFFFAOYSA-N	425.294	1.075	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2ccnc3c2OCO3)[C@H]1c1cccnc1	1813031343	LUUDEGXCIUZGDK-PVAVHDDUSA-N	446.891	1.779	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)C(=O)Nc2cccnc2)[C@@H]1c1cccnc1	1813031394	NCWWBZDLROWYMM-BPQIPLTHSA-N	445.907	1.375	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)CCc2ccc(O)nn2)[C@@H]1c1cccnc1	1813034091	AHLIUGMVBCTMCX-RIFZZMRRSA-N	447.923	1.470	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)C(F)(F)Cl)[C@@H]1c1cccnc1	1813215633	ZQRADKNXLVVXTK-BBRMVZONSA-N	431.871	1.292	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@H](C(=O)N2CCCC[C@H]2c2cc(NC(=O)[C@H](O)CCl)n[nH]2)C1	1814877843	LZNWYPUISOIRKY-LQKXBSAESA-N	440.928	1.981	50	20	IDGD	
CC(C)Cc1cc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@H](O)CCl)CC3)n(C)n1	1815992846	GNJSCAQRXOXQCV-XHDPSFHLSA-N	439.969	1.901	50	20	IDGD	
CC[C@H](C)[C@H](N)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1817266482	WTJQUOYRYWHDJL-IWEFOYFVSA-N	442.524	1.088	50	20	IDGD	
CC(C)NCCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1817441917	UHEPRNOSQRVYMX-KRWDZBQOSA-N	442.524	1.102	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1)c1ccc2c(n1)OCCO2	1817960378	OSTDOYPNGYBPDR-ZIAGYGMSSA-N	435.868	1.482	50	20	IDGD	
Cc1[nH]ccc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819402709	IDBXFSJSIVANCL-KRWDZBQOSA-N	436.476	1.664	50	20	IDGD	
Cn1nc(C(=O)N[C@H]2CCc3nc(NC(=O)[C@@H](F)Br)sc3C2)cc1O	1823003168	WHUANCVNSQBODR-UPONEAKYSA-N	432.275	1.499	50	20	IDGD	
CCOC(=O)/C=C/C(=O)N[C@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1	1823003758	NVIVWSBPXYKJDE-NZDDEIPXSA-N	434.287	1.865	50	20	IDGD	
CN(CC(=O)N1CCC([C@@H]2CCCCN2C(=O)C(C)(C)CCl)CC1)C(=O)C(=O)O	1824014767	CLKCTMQWOUCSRK-HNNXBMFYSA-N	429.945	1.414	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)CN3CCCCC3=O)sc2C1	1825867738	JEUVLGFJVCCRSP-RYUDHWBXSA-N	428.942	1.321	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](Cl)COC)sc2C1	1826000105	KWPWRFRVOWFKEU-VWYCJHECSA-N	431.946	1.017	50	20	IDGD	
C[C@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](C)n3cncn3)sc2C1	1826797118	FCXXJOBLRITJBW-AEJSXWLSSA-N	427.328	1.691	50	20	IDGD	
O=C(C(Cl)Cl)N1CCC([C@@H]2CCCCN2C(=O)CNCP(=O)(O)O)CC1	1826808228	QPKNHMBKQXJALR-LBPRGKRZSA-N	430.269	1.135	50	20	IDGD	
CC(C)(C)OCC(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827050050	FSBNAVDKZFKCRK-HXUWFJFHSA-N	430.354	1.415	50	20	IDGD	
O=C([C@@H](F)Cl)N1CCC([C@@H]2CCCCN2C(=O)c2n[nH]c3c2CS(=O)(=O)C3)CC1	1827270645	UITYZNOJWPWRHY-GOEBONIOSA-N	446.932	1.606	50	20	IDGD	
Cc1n[nH]c(C)c1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1	1829165803	CNJLFNONJWDYNZ-HXUWFJFHSA-N	438.337	1.253	50	20	IDGD	
Cn1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)c2cccnc21	1830361927	HCAMLSMKLHFIGF-JOCHJYFZSA-N	448.951	1.908	50	20	IDGD	
O=C([C@H](F)Cl)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CC(c3ccccc3)=NO1)CCO2	1831254133	FWDCHXHCYCDFFJ-UWVAXJGDSA-N	439.871	1.170	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccn4cncc4c3)C2)C1	1831649706	AIKTWFMGBNXACE-RXVVDRJESA-N	434.924	1.812	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)C(F)(F)Cl)CC1	1832016807	DNQJQODDQYUNGD-MRXNPFEDSA-N	428.672	1.431	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(N(C)C)cn3)CCO2)C1	1833643370	QHYDUZISTMXELJ-DYESRHJHSA-N	438.956	1.625	50	20	IDGD	
Cc1nscc1C(=O)N1CCO[C@]2(COCCN(C(=O)CCBr)C2)C1	1833742774	KEFAKTADIBGYNZ-INIZCTEOSA-N	432.340	1.307	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)c3ccccc3)CC2)CC1	1834586079	SWWPFVYEHVOEMI-VQTJNVASSA-N	437.968	1.545	50	20	IDGD	
CNc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)cc1	1835608233	UNVTVHFZZVXVBX-YJBOKZPZSA-N	444.301	1.489	50	20	IDGD	
C[C@H](C(=O)N1CCC(N2CCC(NC(=O)CO[Si](C)(C)C)CC2)CC1)n1cncn1	1835837940	UMPSYDZCRPGDRY-MRXNPFEDSA-N	436.633	1.262	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3cccs3)CCO2)C1	1836091974	JZAOYCGWBKYJDT-GUYCJALGSA-N	431.352	1.530	50	20	IDGD	
Cc1cc(CC(=O)N2CCC(N3CCC(NC(=O)[C@H](F)Br)CC3)CC2)no1	1836414640	VKKYEKXPNZYKFY-KRWDZBQOSA-N	445.333	1.788	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC(OC2CCN(C(=O)Cc3cnc[nH]3)CC2)CC1	1836670166	BFMPACSHMVDJBT-AWEZNQCLSA-N	441.370	1.982	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)[C@@H]3CC=CCC3)CC2)CC1	1836679986	PSIFVBZNHJFPQM-GOSISDBHSA-N	434.581	1.714	50	20	IDGD	
O=C(C[C@@H]1CNc2ccccc2O1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1837352207	ZDBKAIHYVVYVOS-DJKXOVBDSA-N	441.887	1.240	50	20	IDGD	
CC(C)N1CCC[C@H]1C(=O)N1CCOC[C@@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1837718175	ZBDZULFEWJLSIA-GHTZIAJQSA-N	441.645	1.167	50	20	IDGD	
O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)c1ccncc1Cl)CCO2	1837884985	NCFDTIZYYFECOL-QGZVFWFLSA-N	446.729	1.590	50	20	IDGD	
C[C@@H](C(=O)N1CCC(OC2CCN(C(=O)[C@@H](C)Br)CC2)CC1)n1cnnn1	1838773350	BZERLZOHXLSHEV-OLZOCXBDSA-N	443.346	1.016	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(OC)cc3C)CCO2)C1	1839026378	WETZQVQBBWKXCA-GHTZIAJQSA-N	440.924	1.327	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccn(-c4ccccc4)n3)C2)C1	1839145660	BUJWIGJIPOGPPA-PGRDOPGGSA-N	446.935	1.960	50	20	IDGD	
Cc1ccnc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)c1	1839152451	ZUGBMOMDCUMRRH-OALUTQOASA-N	430.332	1.696	50	20	IDGD	
C=C(CC(=O)OCC)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](Cl)CCC)C2)C1	1839173314	JWSKCVUIWSZJNF-JXFKEZNVSA-N	430.929	1.360	50	20	IDGD	
Cc1cc(C#N)cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)c1	1839454158	XHJLBOXZGGIFIZ-IBGZPJMESA-N	426.300	1.740	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)c(C)o1	1840031455	QPUXEBVVIPLMDN-SCLBCKFNSA-N	429.311	1.750	50	20	IDGD	
C[C@H](Sc1ccccn1)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1840393051	FFEWHFTYTSMJCV-UGSOOPFHSA-N	448.372	1.822	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(NC(C)=O)cc3)CCO2)C1	1840727402	FDJKYLFWHTVHET-RXVVDRJESA-N	437.924	1.732	50	20	IDGD	
O=C(c1cc(Cl)nc2ccccc12)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843011188	AGPKXFRWECBIQP-UHFFFAOYSA-N	449.703	1.699	50	20	IDGD	
COc1ccc2[nH]cc(C(=O)N3CCCC34CN(C(=O)CCC(=O)NN(C)C)C4)c2c1	1844051767	GYZIFUJAZIPRSK-UHFFFAOYSA-N	427.505	1.367	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)Cc2ccncc2)C1	1845050507	LOKADJKDJAOKAT-UHFFFAOYSA-N	438.440	1.975	50	20	IDGD	
COc1ccc(OC)c(C(=O)CCC(=O)N2CCCC23CN(C(=O)[C@H](O)CCl)C3)c1	1846354268	ROSIZBDGJPPVMD-QGZVFWFLSA-N	438.908	1.470	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](C(=O)N1CC2(CCCN2C(=O)C(Cl)Cl)C1)C(C)(C)O	1846389498	WHOHVHYXJQJRKD-LLVKDONJSA-N	438.352	1.658	50	20	IDGD	
CCN(C)[C@H](C)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1848098788	ZCLDBPOOTLPWBQ-UGUYLWEFSA-N	430.977	1.661	50	20	IDGD	
CCn1c(=O)n(CC(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)c2ccccc21	10750403	YTGWKNFUFBPHPV-UHFFFAOYSA-N	428.445	1.310	50	20	IDGD	
Cc1c([N+](=O)[O-])cc(C(=O)NNC(=O)c2cc(Br)cn2C)cc1[N+](=O)[O-]	12393481	UMTXVPRBPPRJPP-UHFFFAOYSA-N	426.183	1.987	50	20	IDGD	
O=C(CN1CCC(C(=O)Nc2ccccc2)CC1)NNC(=O)c1ccc([N+](=O)[O-])cc1	15550781	ZHRUOTBWMCVGLP-UHFFFAOYSA-N	425.445	1.707	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Cc2csc(N3CCCC3=O)n2)c2ccccc2c1=O	17190456	KNGAIJLYGGSFQK-UHFFFAOYSA-N	440.485	1.003	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)Cn1c(=O)cnc2ccccc21	23785723	HWVNLMWENBVMGQ-GFCCVEGCSA-N	445.273	1.774	50	20	IDGD	
N#Cc1ccc(N2CCN(C(=O)NNC(=O)CNC(=O)c3cccs3)CC2)c(F)c1	725872579	DQUKFGNQFBUNHI-UHFFFAOYSA-N	430.465	1.052	50	20	IDGD	
C#Cc1cccc(NC(=S)NNC(=O)c2cc(S(=O)(=O)NCCOC)ccc2C)c1	727497664	GAOSQYNRFUYRNV-UHFFFAOYSA-N	446.554	1.532	50	20	IDGD	
O=C1NC(=O)C2(CCC(C(=O)NNC(=O)c3ccc(COc4ccccc4)o3)CC2)N1	727764778	MWQMNJSINRFDDH-UHFFFAOYSA-N	426.429	1.388	50	20	IDGD	
O=C(CCNS(=O)(=O)c1cccc(Br)c1)NNC(=S)NCC1CCC1	727866660	TUPIYGAIVKTHOY-UHFFFAOYSA-N	449.396	1.413	50	20	IDGD	
CCCC[C@@H](/N=C1/NS(=O)(=O)c2ccccc21)C(=O)NNC(=O)c1cccc(C#N)c1	728872596	OAGKQJUJAQETSP-QGZVFWFLSA-N	439.497	1.617	50	20	IDGD	
O=C(CNC(=O)c1cccc([N+](=O)[O-])c1)NNc1ccc(S(=O)(=O)C(F)F)cc1	728974282	LDTHZJHWYVQKDF-UHFFFAOYSA-N	428.373	1.464	50	20	IDGD	
O=C(NNC(=O)c1csc(I)c1)c1ccc(-n2cnnn2)cc1	730769264	RNHCNUOHFQDVRZ-UHFFFAOYSA-N	440.226	1.403	50	20	IDGD	
CCn1cc(C=NNC(=O)C[C@@H]2c3cc(OC)c(OC)cc3CCN2S(C)(=O)=O)cn1	732527657	DVIHQCWRPCXBIU-QGZVFWFLSA-N	449.533	1.319	50	20	IDGD	
Cc1nc(-c2cnn(C)c2)sc1C(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	734605781	XHBRYOJLIGFCNW-UHFFFAOYSA-N	444.429	1.378	50	20	IDGD	
COc1ccc([C@@H]2[C@@H](C(=O)OCC(=O)NNC(=O)c3ccccc3)CCC(=O)N2C)cc1	734618259	TYYVSNYKBAGTIC-GHTZIAJQSA-N	439.468	1.609	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	735118785	YQDFXYFZDBBFAJ-UHFFFAOYSA-N	439.925	1.437	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)c2cc(S(=O)(=O)NC3CC3)c(Cl)cc2Cl)cn1	735470632	FRQHKBZOOXFWLY-UHFFFAOYSA-N	432.289	1.242	50	20	IDGD	
COc1cc(OC)cc([C@H](O)CNC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c1	735681233	BGRSGGGWCBVOQW-LJQANCHMSA-N	425.445	1.567	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCCc2ccc(O)cc2)c1	735760980	HJUHBXZKFQWOMW-UHFFFAOYSA-N	448.545	2.000	50	20	IDGD	
C[C@H]1OC(C)(C)N(C(=O)OC(C)(C)C)[C@@H]1C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	735876488	SCANSHYJTARBLO-DOMZBBRYSA-N	445.480	1.184	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN2CCC(N(CC)S(C)(=O)=O)CC2)cc1C	736309472	AMZXHXQOYOZWML-UHFFFAOYSA-N	430.596	1.126	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3cnc(-c4ccccc4)[nH]3)cc2)CC1	736677255	YUWYTJWASAHLEZ-UHFFFAOYSA-N	440.529	1.770	50	20	IDGD	
O=C(NNC(=O)N1CCn2c(nnc2C(F)(F)F)C1)c1ccc(Br)s1	740025486	GYQCLHUGACMYJI-UHFFFAOYSA-N	439.217	1.991	50	20	IDGD	
CCCC[C@H](/N=C1/NS(=O)(=O)c2ccccc21)C(=O)NNc1ccnc(N(C)C)n1	740103464	QPHSDRMQCCKYIQ-AWEZNQCLSA-N	431.522	1.283	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)[C@@H](c2ccccc2)N2CCSCC2)c1	745088530	GMTFDYJLXQVXPC-HXUWFJFHSA-N	438.509	1.653	50	20	IDGD	
Cc1nn(-c2ccc(F)cc2)nc1C(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	745469801	QICXOVXXGMFIIP-UHFFFAOYSA-N	442.363	1.241	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])n1	745567403	JAKLQYAMTBUFNW-UHFFFAOYSA-N	446.363	1.925	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@@H](C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)C1	746093629	RMRLPPCQSFBAOE-GDBMZVCRSA-N	437.518	1.212	50	20	IDGD	
O=C(CN1CCN(c2ccccn2)CC1)NNC(=O)NCc1cccc(C(F)(F)F)c1	746173426	UMJSKNJFUQOSKM-UHFFFAOYSA-N	436.438	1.753	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)[C@@]2(C)CCN(C(C)=O)C2)c2ccccc2c1=O	746820625	CLIRKUZFXNABDK-QFIPXVFZSA-N	427.505	1.606	50	20	IDGD	
O=C(CC12CC3CC(CC(C3)C1)C2)NNC(=O)NCCNS(=O)(=O)c1cccs1	747438170	QZCULAYDVDUBPM-UHFFFAOYSA-N	440.591	1.963	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(C(=O)CCC(=O)NNc3cccc(F)c3)CC2)cc1	748090432	RIBTTYXNTNKWKB-UHFFFAOYSA-N	448.520	1.891	50	20	IDGD	
O=C(NNC(=O)c1nc(-c2cccs2)n(-c2ccc(F)cc2)n1)C(=O)N1CCCC1	748247585	RWUCFWNCRIITMK-UHFFFAOYSA-N	428.449	1.518	50	20	IDGD	
Cc1cc(S(N)(=O)=O)sc1C(=O)NNc1ccccc1S(=O)(=O)NC(C)(C)C	748602902	QIRGCGCJQDJGHI-UHFFFAOYSA-N	446.576	1.538	50	20	IDGD	
CC[S@](=O)[C@@H]1CCC[C@H](NC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)C1	750267721	OKJMEEOENGYRAN-ODNVZBEZSA-N	443.595	1.312	50	20	IDGD	
COc1cc(OC)cc(-n2nnnc2CN(C)C(=O)NNC(=O)c2ccccc2C)c1	751999788	NRHDMJCDYKNYKZ-UHFFFAOYSA-N	425.449	1.474	50	20	IDGD	
CC[C@@H](CS(=O)(=O)c1ccccc1)NC(=O)NNC(=O)c1nnc(O)c2ccccc12	752703900	LPCFUOWLQGODEB-ZDUSSCGKSA-N	443.485	1.532	50	20	IDGD	
Nc1ccc(C(=O)OCC(=O)NNC(=O)c2cccs2)c(I)c1	754589772	UZFBZMTUPGLKSY-UHFFFAOYSA-N	445.238	1.553	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)CNC(=O)c2ccccc2C(F)(F)F)C[C@@H](C)O1	755681920	HFDOLFBTQMCRGC-BETUJISGSA-N	430.427	1.082	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)NC2CCN(S(=O)(=O)C(F)(F)F)CC2)cc(C#N)n1C	755690598	NOBYZTWCGLWZGM-QPEQYQDCSA-N	429.424	1.542	50	20	IDGD	
COC(=O)c1cc(NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)ccc1F	756054154	NYPRXGBSNPGHOO-UHFFFAOYSA-N	443.479	1.977	50	20	IDGD	
O=C(Cc1cc[nH]n1)NNC(=O)Nc1cccc(CS(=O)(=O)Cc2ccccc2)c1	756594033	OLKQQPUEEYCDLE-UHFFFAOYSA-N	427.486	1.920	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)ccc1OC1CCOCC1	756671486	FJEIXNFFYQETFQ-UHFFFAOYSA-N	437.460	1.995	50	20	IDGD	
C[C@@H]1CN(C(=O)Cn2cc(NC(=O)NNC(=O)CCCc3ccccc3)cn2)C[C@@H](C)O1	756838162	LXEKRXQOLCBLBV-IAGOWNOFSA-N	442.520	1.695	50	20	IDGD	
CCCc1cnc(NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)s1	757926524	URMPZYBLYUOFBC-UHFFFAOYSA-N	425.536	1.877	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)N[C@@H]2CN(C(=O)OC(C)(C)C)C[C@@H]2C#N)cc1	758756319	XXFJGBGINPROLO-XJKSGUPXSA-N	431.497	1.847	50	20	IDGD	
Cc1noc(C[C@@H](NC(=O)NNC(=O)CNC(=O)c2cccs2)c2ccccc2)n1	758956959	LPJZOZMDPQKVBE-CQSZACIVSA-N	428.474	1.484	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNS(=O)(=O)c2cc(C)c(Cl)c(C(=O)O)c2)c1	759093982	GGCKCCJSJJYKSW-UHFFFAOYSA-N	428.850	1.987	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NC[C@@H](C[C@H](C)O)c1ccccc1	759611716	OWQGSOBZDIDHOA-WMLDXEAASA-N	447.561	1.787	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccnn2[C@@H](C)C2CC2)cc1	760277442	LHDNGKWJCSMEJB-GXTWGEPZSA-N	427.461	1.610	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cccnc3OCC(F)F)CC2)cc1	760738145	XFRDOXIOTITEEO-UHFFFAOYSA-N	447.486	1.613	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NN=Cc1ccc(C)cn1)N(S(C)(=O)=O)CC2	761804668	DWACZYMTQCDLHT-SFHVURJKSA-N	446.529	1.806	50	20	IDGD	
Nc1c(Br)cc(Br)cc1C=NNC(=O)[C@@H]1CCS(=O)(=O)C1	763408359	QYCQSMOMPIJDAU-SSDOTTSWSA-N	439.129	1.679	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)c(Br)c1	763569681	AEPVIJOQLGUBLF-OAHLLOKOSA-N	434.246	1.683	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(-n2nc(C)cc2C)nc1	763658677	ZZYQEBBHQYCMIJ-UHFFFAOYSA-N	438.444	1.058	50	20	IDGD	
CCOC(=O)c1cc(F)c(F)cc1NC(=O)C(=O)NNC(=O)COc1ccccc1CC	763717200	QRYCDNRWDFBDMR-UHFFFAOYSA-N	449.410	1.869	50	20	IDGD	
COCCn1ccc2ccc(NC(=O)C(=O)NNC(=O)CN3CCCc4ccccc43)cc21	763727374	DKJVEWMPEVJMPR-UHFFFAOYSA-N	449.511	1.826	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)C(=O)Nc2ccccc2Cl)cc1	763737225	PNCRCDZVUVWNRS-UHFFFAOYSA-N	438.893	1.055	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1c(F)cccc1-n1cccn1	763865220	NTQBTDVPVAUUIL-LBPRGKRZSA-N	429.383	1.704	50	20	IDGD	
CCn1ncc2ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc3ccc(C(C)=O)cc3)cc21	763877070	HIPPKSCETQUGAX-CQSZACIVSA-N	437.456	1.812	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)NC(C)C)cc2)cc1OC	763900364	ISMHBDSNVIWMKH-UHFFFAOYSA-N	442.472	1.632	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(CN(C)C)ccc2OC)cc1OC	763901326	NRYBKTVSGLBJMJ-UHFFFAOYSA-N	444.488	1.564	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(-c3ncon3)cc2)ccc1OC(C)C	763916658	RATSCSIHPKFWJO-UHFFFAOYSA-N	439.428	1.932	50	20	IDGD	
NC(=O)c1ccc(F)c(NC(=O)C(=O)NNC(=O)c2ccc(Br)s2)c1	763942152	WDTCPFHEPDNCNI-UHFFFAOYSA-N	429.227	1.148	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc(C)c(S(=O)(=O)NC2CC2)c1C	763961191	ZECBITVLXRGWIM-UHFFFAOYSA-N	444.513	1.452	50	20	IDGD	
O=C(NNC(=O)c1cnccn1)C(=O)Nc1cc(Br)cc(C(F)(F)F)c1	764023707	DLIMAURVZCUJOQ-UHFFFAOYSA-N	432.156	1.658	50	20	IDGD	
CN1C(=O)c2ccc(NC(=O)C(=O)NNC(=O)c3cccc(Br)c3)cc2C1=O	764062774	CXXFYYWBHCLWLR-UHFFFAOYSA-N	445.229	1.075	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc4c(c3)OCCCO4)n[nH]2)cc1	764109722	APZNRTVFFLVAHJ-UHFFFAOYSA-N	435.440	1.946	50	20	IDGD	
Cc1cccc(C)c1Oc1ccccc1NC(=O)C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O	764234465	YBPRRJLBTWCXAB-CQSZACIVSA-N	448.501	1.119	50	20	IDGD	
C[C@H]1CN(C(=O)c2ccc(NC(=O)C(=O)NNC(=O)c3cccc(C#N)c3)cc2)C[C@H](C)O1	764236840	GMBXDLVJJYRBCH-GJZGRUSLSA-N	449.467	1.207	50	20	IDGD	
CC(C)(C)[S@](=O)Cc1cccc(NC(=O)C(=O)NNC(=O)COc2ccccc2O)c1	764275717	RNFNSBUORLSXRZ-WJOKGBTCSA-N	447.513	1.604	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)ccc1O)C(=O)Nc1ccnn1-c1ccccc1	764280384	NYXUOJFZGRKBMU-UHFFFAOYSA-N	444.245	1.740	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C(=O)Nc1ccc(CS(C)(=O)=O)c(F)c1)c1ccccc1	764330964	ZRDMBBBAAFTTHP-INIZCTEOSA-N	435.477	1.650	50	20	IDGD	
COc1cc(OC)cc(C(=O)NCC(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)c1	764333617	KUGGNOIJNUBMPK-UHFFFAOYSA-N	448.426	1.747	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)[C@@H]1CCCN(c2nc3ccccc3s2)C1	764345846	YUKZAEAFDDPNOH-OAHLLOKOSA-N	438.513	1.485	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)C(=O)Nc1cnc(-c2ccccc2)nc1	764345924	MGNSDBCIORUTTR-UHFFFAOYSA-N	427.424	1.729	50	20	IDGD	
COc1ccc(COc2cccc(F)c2)cc1NC(=O)C(=O)NNC(=O)c1cnn(C)c1	764359212	MQYPJPGKQHQPDG-UHFFFAOYSA-N	441.419	1.547	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)C(=O)Nc1ccc(OC2CCCC2)nc1	764394628	UVNIPJVVNJQPKE-UHFFFAOYSA-N	430.486	1.987	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)C(=O)Nc2cnn(CC(C)C)c2C(C)C)c1	764434749	XZIFXLGHFMCAOB-UHFFFAOYSA-N	429.481	1.416	50	20	IDGD	
Cn1nc2c(c1C(=O)NNC(=O)c1cccc(S(=O)(=O)N3CCCC3)c1)CCCC2	764466849	TWZBAVJJICAVLT-UHFFFAOYSA-N	431.518	1.158	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)CCC(=O)N1CCN(c2ccccc2)CC1	764605539	CRPFHPZTRHXSKQ-UHFFFAOYSA-N	434.500	1.533	50	20	IDGD	
O=C(NCC1(N2CCOCC2)CC1)NNC(=O)c1ccc(Br)cc1Cl	764778869	JOQXZSUGVWDHOX-UHFFFAOYSA-N	431.718	1.911	50	20	IDGD	
O=C(CCC(=O)N1CCN(c2ccccn2)CC1)NNC(=O)c1cccc2ncccc12	765436419	DRZPNAQTESDIMO-UHFFFAOYSA-N	432.484	1.520	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3ccc(NC(=O)C4CC4)cc3)CC2)cc1	765749572	YXSLVPRCCGOKNK-UHFFFAOYSA-N	449.555	1.922	50	20	IDGD	
C[C@H](CN1CCN(c2ccccn2)CC1)NC(=O)NNc1ccccc1S(C)(=O)=O	765779264	IMRXUWUKYMDKOG-MRXNPFEDSA-N	432.550	1.322	50	20	IDGD	
COc1ccccc1NC(=O)c1ccc(NC(=O)C(=O)NNc2nccnc2OC)cc1	766264329	IQURNGBIHQKCBH-UHFFFAOYSA-N	436.428	1.828	50	20	IDGD	
COC(=O)c1cc(C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)ccn1	766664364	PXOBLPMZQCZVQA-UHFFFAOYSA-N	445.907	1.100	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2OC)c2ncccc12	768233834	NPFXBVNHDPWFDG-UHFFFAOYSA-N	438.440	1.807	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)[C@H](C)N3C(=O)[C@H]4CCCC[C@H]4C3=O)n[nH]2)cc1	768268198	LLLUECOPJFLNDA-RRQGHBQHSA-N	437.500	1.964	50	20	IDGD	
CC(=O)Nc1ccc(O)c(C(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)c1	768292371	YMULOKWVSXRBSH-UHFFFAOYSA-N	439.516	1.238	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)NCc3cccc(NS(C)(=O)=O)c3)nc21	770342017	QDEYVRIFKAWPHV-UHFFFAOYSA-N	448.509	1.485	50	20	IDGD	
CCNC(=O)N(C)NC(=O)c1ccccc1NS(=O)(=O)c1ccc2nc(O)[nH]c2c1	770549929	UUOQEIBMRXFSDK-UHFFFAOYSA-N	432.462	1.375	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1ccc(OCC(=O)N2[C@@H](C)CCC[C@H]2C)cc1	771853394	SSVFQOFCOLPEIQ-OWCLPIDISA-N	433.505	1.958	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1ccccc1NS(=O)(=O)c1ccc(OC)cc1	771895512	YUYBETKCAJGDHT-ZDUSSCGKSA-N	449.485	1.599	50	20	IDGD	
O=C(CCCc1ccc2c(c1)CC(=O)N2)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772896968	DOJDQQYARGRHMI-UHFFFAOYSA-N	428.876	1.621	50	20	IDGD	
CN1CCC[C@H](N(C)C(=O)c2ccc(NC(=O)C(=O)NNc3cccc(C#N)c3)cc2)C1	773682772	NKPQBBRIRVJBCL-FQEVSTJZSA-N	434.500	1.806	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(CN3C(=O)CSC3=O)cc2)cc1F	773888862	MJCKUSBZOQHXCO-UHFFFAOYSA-N	444.444	1.729	50	20	IDGD	
COCCN1C(=O)c2ccc(C(=O)NNc3ccc(C(F)(F)F)cn3)cc2S1(=O)=O	775255231	KXGRSDLDBLQDRF-UHFFFAOYSA-N	444.391	1.648	50	20	IDGD	
CO[C@@H](c1ccccc1F)[C@H](C)NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	776078320	YKHLVSSCMPZJSG-KPZWWZAWSA-N	427.436	1.793	50	20	IDGD	
Cc1nc(S(=O)(=O)N2CCC(C(=O)NNc3ccc4ccccc4n3)CC2)cn1C	777465593	RGTNKPYCVBLJST-UHFFFAOYSA-N	428.518	1.821	50	20	IDGD	
C=CCOc1ccc(C(=O)N2CCN(S(=O)(=O)CBr)CC2)cc1OC	777777120	FLQMRXXOCLTZJW-UHFFFAOYSA-N	433.324	1.700	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNS(=O)(=O)c1cc(F)ccc1Br	777938729	FFLKCXYMWIZOKU-UHFFFAOYSA-N	426.264	1.422	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)c3c[nH]c(C#N)c3)c2)cc1	778521035	AQZUDNHAKDXBGP-UHFFFAOYSA-N	439.453	1.771	50	20	IDGD	
Cc1nn([C@@H]2CCS(=O)(=O)C2)c(Cl)c1C=NNC(=O)CCNC(=O)OC(C)(C)C	779807536	BMSVJOGOOPFRLE-GFCCVEGCSA-N	447.945	1.569	50	20	IDGD	
CCn1cc(CC(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)cn1	780214079	NKNBOKMCUNXSMT-UHFFFAOYSA-N	433.515	1.769	50	20	IDGD	
O=C(COc1ccccc1O)NNS(=O)(=O)c1ccc(NC(=O)c2ccncc2)cc1	782465980	WDZDEZDWZLWXIT-UHFFFAOYSA-N	442.453	1.428	50	20	IDGD	
CNC(=O)c1ccc(OC)c(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2Cl)c1	782927940	VXYCMTQHVDOXEE-UHFFFAOYSA-N	439.255	1.761	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNc2cccc(F)c2)ccc1S(=O)(=O)N1CCCC1	783039443	DYWJLJFUOWKNEM-UHFFFAOYSA-N	436.465	1.701	50	20	IDGD	
COCCN1C(=O)CCc2cc(NC(=O)C(=O)NNc3ncnc4ccsc34)ccc21	783253968	UVMIFXTVPUQHHS-UHFFFAOYSA-N	440.485	1.699	50	20	IDGD	
CO[C@@H](C)c1cccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)c1	783263697	JVSFRPDAMXOUMB-ZDUSSCGKSA-N	435.506	1.558	50	20	IDGD	
CCOC(=O)C(C)(C)n1cc(NC(=O)C(=O)NNc2ccc(Cl)cc2[N+](=O)[O-])cn1	783288900	ABFWPLYPWHPRRY-UHFFFAOYSA-N	438.828	1.825	50	20	IDGD	
CC(C)OCCCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	783326375	GOCSQQTVJGFJFU-UHFFFAOYSA-N	426.539	1.620	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2cccc(Cl)c2SC(F)F)CCS(=O)(=O)C1	783426682	JOHGKVXAUKRMRG-CQSZACIVSA-N	427.882	1.791	50	20	IDGD	
CCOc1ccc(C(=O)N2CCCCC2)cc1NC(=O)C(=O)NNc1cc(C)ncn1	783948296	LGBRMRITXLOIPR-UHFFFAOYSA-N	426.477	1.892	50	20	IDGD	
Cc1cc(Br)ccc1NNC(=O)C(=O)Nc1ccc(N2CCNC(=O)C2)cc1	784414839	PLUWOUVJMZKPQU-UHFFFAOYSA-N	446.305	1.776	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)NC[C@H]1CCCCS1(=O)=O	784444247	FYTPQHFWSVAZIQ-CYBMUJFWSA-N	434.312	1.126	50	20	IDGD	
CN(C)CC1CCN(c2ccc(NC(=O)C(=O)NNc3nccnc3Cl)cc2)CC1	784782578	YETWPABZNUWWOG-UHFFFAOYSA-N	431.928	1.990	50	20	IDGD	
CCNC(=O)COc1cccc(NC(=O)C(=O)NNc2ccnc(Br)c2)c1	784836899	BEEJIFXYPWIIRO-UHFFFAOYSA-N	436.266	1.441	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNc2ccnc(F)c2)cc(OC)c(OC)c1OC	784851394	BUBDBMUGJCYFHP-UHFFFAOYSA-N	436.396	1.505	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)C(=O)Nc1ccc(Cl)cc1OC(F)F	785066678	GFNNVOUONPFDES-UHFFFAOYSA-N	437.790	1.918	50	20	IDGD	
COc1ncc(NC(=O)C(=O)NNc2nc3cc(Cl)ccc3cc2C)cc1C(N)=O	785161037	LFWLRJMJBCDZBE-UHFFFAOYSA-N	428.836	1.781	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N2CCc3nn[nH]c3C2)cc1	787077101	GQGFSIDCRPUTHE-GDNBJRDFSA-N	446.471	1.044	50	20	IDGD	
COc1cc(F)ccc1NNC(=O)C1CCN(S(=O)(=O)c2cn(C)c(C)n2)CC1	788192251	BEXZVGPTHHVKCW-UHFFFAOYSA-N	425.486	1.420	50	20	IDGD	
CC(C)n1nc(-c2ccco2)cc1NC(=O)C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	789740291	FHEPAJMOUGKJLB-UHFFFAOYSA-N	449.431	1.099	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)Cn1ccc2ccccc2c1=O	790465598	GBHZUBZXWVFDPH-UHFFFAOYSA-N	430.258	1.990	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C2(NC(=O)NC(C)C)CCCCC2)cc(OC)c1OC	792010605	CTQCYBGBRLWZTE-UHFFFAOYSA-N	436.509	1.884	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(CCC(=O)NNC(=O)COc2ccc(C#N)cc2)CC1	792017381	ISPZCOQRDAYMCX-UHFFFAOYSA-N	431.493	1.027	50	20	IDGD	
CCOc1ccc(-c2nc(CC)c(C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)s2)cc1	792642057	NCWXROIQTPFWOS-LLVKDONJSA-N	440.547	1.470	50	20	IDGD	
COc1ccc(Cn2cc(NC(=O)C(=O)NNC(=O)CCc3ccccc3O)cn2)cc1	793025610	MTBNWJRDJOTUEX-UHFFFAOYSA-N	437.456	1.364	50	20	IDGD	
COc1ccc(CCC(=O)N2CCN(C(=O)NNC(=O)c3cccc(C)n3)CC2)cc1	793220338	NQVXNULUQPAETC-UHFFFAOYSA-N	425.489	1.530	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)C(C)C)cc1	801109351	KNQOJSXKTJBMPG-FQEVSTJZSA-N	449.511	1.946	50	20	IDGD	
CC(C)(C)CC(=O)N1CSC[C@@H]1C(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	802063646	NRJAKMNORVFDLC-CQSZACIVSA-N	442.563	1.581	50	20	IDGD	
CSC[C@H](C(=O)NNC(=O)Nc1ccc2c(c1)OCO2)N1C(=O)[C@H]2CCCC[C@H]2C1=O	802104814	LACQKMOSPACJFG-HZSPNIEDSA-N	448.501	1.475	50	20	IDGD	
C[C@H](NS(=O)(=O)c1cccc(C#N)c1)C(=O)NNC(=O)Nc1ccc(N(C)C)cc1	802121265	WPMJUVPVKFNVBX-ZDUSSCGKSA-N	430.490	1.144	50	20	IDGD	
CN(NC(=O)[C@@]1(O)CCc2ccccc2C1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	803101050	CMENQAHYHHWLNC-JOCHJYFZSA-N	432.521	1.542	50	20	IDGD	
Cc1cc([N+](=O)[O-])ccc1NNC(=O)[C@@H]1CC(=O)N(c2cccc(S(N)(=O)=O)c2)C1	805382720	VNTQEZFSRDCIRP-GFCCVEGCSA-N	433.446	1.047	50	20	IDGD	
Cc1cc(F)ccc1NNC(=O)C(=O)N1C[C@H](C[C@@H]2COCC(=O)N2)c2ccccc21	807001990	OQCYGFDHMCUJIB-GOEBONIOSA-N	426.448	1.613	50	20	IDGD	
CN(Cc1ccc(Br)s1)C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	807135610	QJSGHBJPXCZQEX-UHFFFAOYSA-N	436.295	1.973	50	20	IDGD	
O=C(NNC(=O)c1cc(F)ccc1Br)C(=O)Nc1cccc2c1COC2=O	808935123	KBGJVFKKACFGFS-UHFFFAOYSA-N	436.193	1.658	50	20	IDGD	
O=C(NNC(=O)c1cc2n(n1)CCO2)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	809986811	OWKCFDHPMPGOSW-UHFFFAOYSA-N	430.428	1.052	50	20	IDGD	
Cc1c(Cl)c(C(F)(F)F)nn1CC(=O)OCC(=O)NNC(=O)c1ccc(C#N)cc1	811246857	XBULHFFCJYTRPF-UHFFFAOYSA-N	443.769	1.740	50	20	IDGD	
C/C(C=NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C)=C\c1ccccc1OC(F)F	811645701	WDGAEAPAUVIGFM-VOPJKUCHSA-N	446.414	1.241	50	20	IDGD	
COc1ccc(Cl)c(NC(=O)NNC(=O)C(=O)N2CCN(c3ccccc3)CC2)c1	813575139	PIVWOWDGMOAIRF-UHFFFAOYSA-N	431.880	1.850	50	20	IDGD	
Cc1ccc(NC(=O)NNc2ccccc2S(=O)(=O)N(C)C)cc1NS(C)(=O)=O	814637172	SOKHJZMPUGJMNN-UHFFFAOYSA-N	441.535	1.765	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(OC(=O)NC)c2)o1	815568606	OGDJXGFQMPTBBD-UHFFFAOYSA-N	431.449	1.239	50	20	IDGD	
O=C(CN1CCCCCCC1)Nc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2CCCO2)cc1	815779167	URVYBGLTHASHET-GOSISDBHSA-N	445.520	1.156	50	20	IDGD	
CCOc1ccc(NNC(=O)C(=O)Nc2ccc(N3CCC(C(N)=O)CC3)cc2)cc1	815815995	BXCGSRJCOHIJDA-UHFFFAOYSA-N	425.489	1.869	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)C(=O)Nc2ncn(C(C)(C)C)n2)c1	815866083	OBOSHHLBZGRTCI-UHFFFAOYSA-N	439.270	1.664	50	20	IDGD	
C=C1c2ccccc2C(=O)N1CC(=O)NNC(=O)[C@H]1CCCN(C(=O)OC(C)(C)C)C1	816510896	JEXLMFNUQNJYAO-HNNXBMFYSA-N	428.489	1.908	50	20	IDGD	
O=C(NNC(=O)N1CCN(S(=O)(=O)c2ccc3c(c2)CCC3)CC1)c1ccccc1	913632766	UYQYFEPLDOCAGO-UHFFFAOYSA-N	428.514	1.536	50	20	IDGD	
COc1ccc(NCC(=O)NN=C(C)c2ccc(S(=O)(=O)N3CCNCC3)cc2)cc1	915916180	NJPIFTSBUFZNFE-UHFFFAOYSA-N	445.545	1.241	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)N[C@@H](CCSC)c2nnc3ccccn23)cc1	916224255	XXFPQJSQOJKXCO-INIZCTEOSA-N	444.517	1.942	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)NNC(=O)NCCc1ccc(OCC(=O)NC2CC2)cc1	918107670	SHOSWTBGBWRJKN-UHFFFAOYSA-N	449.511	1.941	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CN2C(=O)c3ccc(Br)cc3C2=O)c(O)c1	918340836	FVEACPKBJDWXSU-UHFFFAOYSA-N	432.230	1.520	50	20	IDGD	
Cc1nn(C)c2nc(-c3ccccc3)cc(C(=O)NNC(=O)N[C@H]3CCS(=O)(=O)C3)c12	919889829	VEEYPCPMBKOMRF-AWEZNQCLSA-N	442.501	1.075	50	20	IDGD	
C[C@H]1C[C@@H](C)CN(C[C@H](C)NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)C1	919924798	XLCBXCJMNWXGMW-XHSDSOJGSA-N	439.582	1.247	50	20	IDGD	
CC(C)(C)OC(=O)NNC(=O)c1cc(I)ccc1-n1cnnn1	920402458	CEXHYFVBPJKTAU-UHFFFAOYSA-N	430.206	1.436	50	20	IDGD	
Cc1nn(-c2ccc(Br)cc2)c(C)c1C(=O)NNC(=O)CN1CCCC1=O	920432919	JURHJAQIOTUFDE-UHFFFAOYSA-N	434.294	1.635	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)N[C@@H]2CCCN(C(=O)c3ccccc3)C2)c2ccccc2c1=O	1115946655	PCWINNGOWQSWOH-MRXNPFEDSA-N	448.483	1.182	50	20	IDGD	
Cn1ccc(NNC(=O)C2CCN(S(=O)(=O)c3cccc(OC(F)(F)F)c3)CC2)n1	1116837793	XITYARVLNFALAN-UHFFFAOYSA-N	447.439	1.863	50	20	IDGD	
CN(C)N(C(=O)c1nn(-c2ccccc2F)cc1Br)[C@H]1CCS(=O)(=O)C1	1323086943	GDBVSQQPLQDVTF-NSHDSACASA-N	445.314	1.880	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3nnc4cc(C)nn4c3C)C2)C1	1777778973	GSYQJTBVBAURGP-MGPUTAFESA-N	434.928	1.592	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H](C(=O)N2CC[C@@]3(CN(C(=O)[C@H](F)Cl)CCO3)C2)C1	1778233990	LIRUTLGZCCKLBH-TYILLQQXSA-N	433.908	1.608	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4nncn4c3)C2)C1	1778600233	GWRQYFLSQMIVFH-RDTXWAMCSA-N	436.310	1.346	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(=O)ccn3C)C2)C1	1780107041	XNBCXLJYTGPUHU-KDOFPFPSSA-N	426.311	1.002	50	20	IDGD	
COc1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@](C)(Cl)CCl)C3)nn1C	1780245029	BWIYTSZEPFLPCR-NIKGAXFTSA-N	447.363	1.793	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H]2CC[C@H]3CCC(=O)N3C2)C1	1780609501	IFGOZXAMWLCJSL-MDRIIXRWSA-N	439.984	1.919	50	20	IDGD	
COc1nccnc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Br)C1	1780771198	VYZOESUIHOPWJG-CJBNDPTMSA-N	445.289	1.303	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1CC(=O)N(C3CCCC3)C1)CCO2	1781214965	GPMRVXLGUQVCHK-KUDFPVQQSA-N	425.957	1.625	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)Cc3ccc(F)c(C#N)c3)C2)C1	1781300275	PNGTVRVNHPQQEW-YJYMSZOUSA-N	438.297	1.853	50	20	IDGD	
Cc1ncccc1CCC(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781325516	DQGYNCQWHVPAGL-WMZOPIPTSA-N	428.302	1.843	50	20	IDGD	
C[C@H](Nc1nccs1)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781332110	ZUYPGTSOVGWJDD-RWSFTLGLSA-N	435.319	1.464	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)Cn1ccnc1)C2	1782178500	NEZDAHVJVVCQRP-WOCWXWTJSA-N	426.945	1.287	50	20	IDGD	
CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](Cl)COC)C2)C1	1783885312	YPHWFNTZRUIARY-AUSJPIAWSA-N	447.960	1.373	50	20	IDGD	
C[C@H](C(=O)N1CCO[C@]2(CCN(C(=O)C(Cl)Cl)C2)C1)N(C)C(=O)OC(C)(C)C	1783947254	QJWCPWFVOBFQSV-XIKOKIGWSA-N	438.352	1.875	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)C(Cl)Cl)C3)C2)cc1O	1783949966	QHPUQAARBXWANU-SFHVURJKSA-N	430.288	1.598	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(F)n3)C[C@@H]21	1783969475	GQDFKYWZARFYFW-ABHRYQDASA-N	428.302	1.845	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CC[C@H](C(F)(F)F)CC3)C[C@@H]21)[C@H](O)CCl	1784096437	GGMHORQSRMEFOE-SBOZNWLOSA-N	440.890	1.935	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnnc(Cl)c3)[C@H]2C1	1785452307	MGNYKQIGMLURIJ-DEQVHRJGSA-N	445.745	1.897	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCBr)[C@H]2C1)N1C[C@H]2C[C@H]2C1	1786406501	XBBBVDZAOYRSJY-DZTUFKMZSA-N	428.371	1.091	50	20	IDGD	
C[C@@H](CBr)C(=O)NC1(c2ccc(NC(=O)CC[C@H](N)C(N)=O)cc2)CCC1	1788054602	JVYJQTOOZAMEME-WFASDCNBSA-N	439.354	1.744	50	20	IDGD	
CCc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]32)n(C)n1	1788945904	PYMHOSQBQSCALL-BCRCDCHUSA-N	431.364	1.812	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(-n4cncn4)c3)C[C@@H]21	1789865590	YOUMRBOQQKBIFX-KANFNMMFSA-N	431.924	1.878	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc4c[nH]nc34)C[C@@H]21)[C@H](F)Br	1789923063	RMZFFNROXYOISZ-PCBIJLKTSA-N	439.285	1.847	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CNc4ccccc43)C[C@@H]21	1791057517	FAJACTOWGPRGAI-NWCAJXEZSA-N	436.350	1.959	50	20	IDGD	
C[C@@H](Oc1ccccn1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CO[Si](C)(C)C)C[C@@H]21	1791622749	FBLYVSJDBQBZRS-OWSLCNJRSA-N	435.597	1.680	50	20	IDGD	
O=C(C#Cc1ccc(Cl)cc1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2	1792838223	VOADYSTZRYUXRE-DLTLXFJOSA-N	443.700	1.972	50	20	IDGD	
Cc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)CBr)cc(O)n1	1792867904	KRRNSAUOIWFVDW-HPAJIGNASA-N	426.311	1.330	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](O)CCl)C1	1793116853	XHYUSRMFCGHMMD-NQNKBUKLSA-N	443.972	1.871	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CC(=O)Nc1cc(C)on1)C2	1793446639	GTWFNPYCADQUCZ-AHXJXLJNSA-N	426.901	1.309	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1(c2ccc(F)cc2)CC1)c1cccc(B(O)O)c1	1794041936	OAGRGZBCMWJYTG-WKCHPHFGSA-N	436.292	1.489	50	20	IDGD	
COC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1794142761	NIWWEQVHMIXNTE-XGUBFFRZSA-N	445.944	1.710	50	20	IDGD	
COc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCBr)cc(Cl)n1	1795115663	FGFPQBHBDSHBIH-DRXBFXEBSA-N	446.729	1.732	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)c1cc2ccc(Cl)cc2nn1	1796241053	ZBNHWNQEQTWLEP-CZAMWMTLSA-N	439.299	1.086	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cn2ccccc2n1	1796830944	MYDJBQXJXOBDRL-UESRRSCYSA-N	425.316	1.774	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccnn1C(C)C)C2	1796891751	JPIFPCMBGXVEKO-OSSGZSMMSA-N	439.520	1.850	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cn2c(Cl)cccc2n1	1797374384	DWQPGBCBSRZGPF-QDMKHBRRSA-N	446.939	1.613	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)no1	1798205533	LFRVITLHMHPXLT-RMRMTIIFSA-N	444.394	1.469	50	20	IDGD	
Cn1cc2cc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3cnccc3C(=O)NN)ccc2n1	1798443219	YNZKVYDJIXOSID-BJWYYQGGSA-N	447.499	1.137	50	20	IDGD	
Cc1ccc(=O)n(C(C)(C)C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](F)Br)C3)n1	1798587697	JHAMSSCPICTGCI-XFMPKHEZSA-N	443.317	1.616	50	20	IDGD	
COC(=O)c1ccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)C(C)(C)CCl)C3)s1	1799043369	ZSGGLNWSGKIQDG-FVCICTRLSA-N	442.965	1.932	50	20	IDGD	
CC[C@@H](CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2)NC(=O)OC(C)(C)C	1799368161	ZDBWKYNUDYINRN-AKIOZOGOSA-N	435.924	1.804	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccc(F)cc1F	1800659839	HSPBEFNULVNAOK-MMPOEDRJSA-N	431.277	1.880	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(-c3ccncc3)[nH]n1)C2	1800760655	YMRRCBGHBFMJEE-MBMVNNNZSA-N	448.321	1.458	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(SC)c1O)C2	1800979240	XYCHLCUACNKEPK-FAXLKDOZSA-N	428.938	1.571	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1cccc([N+](=O)[O-])c1)C2)C(Cl)Cl	1801015285	BGFAFCCNTNFXEH-YWVIFJGQSA-N	430.288	1.921	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)Oc1ccccn1	1801369156	MGOQLSQMXZIDNZ-IPVBOJNNSA-N	426.311	1.222	50	20	IDGD	
Cc1c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](O)CCl)C3)cccc1C(F)(F)F	1801842234	JNOVRLVGNUFHSP-NOXHYTERSA-N	434.842	1.817	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1nc(OC)ccc1[N+](=O)[O-])C2	1802274424	XNBDWAJVMMWBLF-YVECIDJPSA-N	426.857	1.504	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cccc3nccn23)[C@H]1c1cccnc1)[C@H](O)CCl	1803146554	BPPBXSMRHAWCBI-WDYCEAGBSA-N	427.892	1.649	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cnc3ccc(F)cn23)[C@H]1c1cccnc1)[C@H](O)CCl	1803147453	HTHRTTKAEBZTJH-YJLNNSPDSA-N	445.882	1.788	50	20	IDGD	
Cc1nc(CC(=O)N2CC[C@@H](CNC(=O)CCBr)[C@@H]2c2cccnc2)no1	1806342190	KKOVTGZQHLMMRN-KSSFIOAISA-N	436.310	1.807	50	20	IDGD	
CC(=O)N[C@H](C)C(=O)N1CC[C@H](CNC(=O)CCBr)[C@H]1c1cccnc1	1806346205	BLYAZAMCOSELPI-SRCQZFHVSA-N	425.327	1.397	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)c1cccc2[nH]ncc12	1808027469	OTQSQAHTHRHXNH-GDIGMMSISA-N	427.892	1.877	50	20	IDGD	
COCCn1nccc1C(=O)NC[C@@H]1CCN(C(=O)[C@@H](Cl)COC)[C@@H]1c1cccnc1	1808638877	FTJYLIDNNMLMAK-JENIJYKNSA-N	449.939	1.498	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cc(O)no2)[C@@H]1c1cccnc1)[C@H](F)Br	1808667907	GRVYDWIHGGBAKK-GDLCADMTSA-N	427.230	1.785	50	20	IDGD	
Cc1nocc1C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1	1810297420	CBDDMJDZIVLWCE-DNVCBOLYSA-N	449.471	1.010	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)c2cccnc2)[C@H]1c1cccnc1	1810298568	IVCTVOFLGOMOPE-UZLBHIALSA-N	445.483	1.109	50	20	IDGD	
C#CCCCCC(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1	1810304213	ASPQOOSWXHXGEK-PGRDOPGGSA-N	448.527	1.593	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2nccnc2C(N)=O)[C@@H]1c1cccnc1	1811182440	NXHCKOIZJSLDJX-MPGHIAIKSA-N	444.923	1.698	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)C23CC(C(=O)OC)(C2)C3)[C@@H]1c1cccnc1	1813032503	CPNINVYMKALYGS-XYOLMSGHSA-N	449.935	1.685	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)C2CCC(O)CC2)[C@@H]1c1cccnc1	1813075034	WXQVZHQUXOOEAW-DQXZDLPLSA-N	445.564	1.012	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)Cn2cc(C)c(O)nc2=O)[C@H]1c1cccnc1	1814040487	MTTIETCADCLLOK-SOLBZPMBSA-N	447.923	1.376	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnc(Cl)nc2)n[nH]1	1814330402	RHZLNYMJANOLIS-AWEZNQCLSA-N	448.915	1.532	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc3cccnc3nc2O)[nH]n1)[C@@H](O)CCl	1814874999	LKQUAEPZIGTDLK-CABCVRRESA-N	444.879	1.964	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1ccc(F)cn1	1816587468	IOHXGTYNMMEJNU-GOSISDBHSA-N	437.240	1.243	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CN2CCOCC2)n[nH]1	1817148761	CMOLTXSBKOFPMG-KSSFIOAISA-N	432.352	1.970	50	20	IDGD	
Cc1cccc(CC(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)n1	1817473817	BLUOHURGLDRFCX-FQEVSTJZSA-N	447.304	1.342	50	20	IDGD	
C[C@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1)c1ccccn1	1817479998	YZJZLIVOXOZRON-MGPUTAFESA-N	447.304	1.594	50	20	IDGD	
CS(=O)(=O)N1CCC(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)[C@H](F)Cl)n[nH]2)CC1	1818039061	JGNPLWPQJLCGBE-HIFRSBDPSA-N	449.936	1.608	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H]2CC2(F)F)n[nH]1	1818839069	WJECDCHCVOMIRN-JSGCOSHPSA-N	433.419	1.369	50	20	IDGD	
C=C[C@@H](O)C(C)(C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1	1819368588	WFYOGWRWVOKFKV-HZPDHXFCSA-N	434.541	1.348	50	20	IDGD	
O=C(C#CC1(O)CCCCC1)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](O)CCl)CC2	1819841866	SOZZTWVHPYIKMF-GXTWGEPZSA-N	425.938	1.353	50	20	IDGD	
CN(C)C(=O)NCC(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@](C)(Cl)CCl)n[nH]1	1820863507	ZZDAYFJZEADKTL-YVEFUNNKSA-N	433.340	1.909	50	20	IDGD	
C[C@@H](C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1)c1ccccn1	1822897206	DWKPDIDBPWSVHC-CRAIPNDOSA-N	441.536	1.974	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1	1823003790	MEYUFSABDSGNLS-FWWHASMVSA-N	436.307	1.193	50	20	IDGD	
C=CCNC(=O)/C=C\C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H](Cl)COC)CC1	1823749408	NPEOKNGKDKGOQO-MZIIKBMYSA-N	425.957	1.718	50	20	IDGD	
Cc1nnc(CCC(=O)N2CCC([C@H]3CCCCN3C(=O)[C@H](O)CCl)CC2)s1	1824180738	MQDFEDVEOFRYDZ-HZPDHXFCSA-N	428.986	1.999	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCn1cncn1)CC2	1825647563	QAQQVGDUNZQOSB-VHSXEESVSA-N	427.328	1.520	50	20	IDGD	
CCn1nccc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1	1826097790	NXUFPHLJMSOPRJ-HXUWFJFHSA-N	438.337	1.130	50	20	IDGD	
O=C(COc1ccc(O)nn1)N[C@H]1CCc2nc(NC(=O)C(Cl)Cl)sc2C1	1826103435	MQWXKALLDQEBNS-ZETCQYMHSA-N	432.289	1.433	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)CN2CCCCC2)CC1	1826701242	NLGKPICFWNHAKS-JOCHJYFZSA-N	441.381	1.086	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCC([C@H]2CCCCN2C(=O)CN2CCNC2=N)CC1	1826874390	NPBBDZINPGAUKF-BEFAXECRSA-N	432.396	1.682	50	20	IDGD	
O=C(C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1)c1ccccc1	1827051175	OTYKTEYFZGGVCP-QFIPXVFZSA-N	448.328	1.483	50	20	IDGD	
C[C@@H]1CC[C@H](C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)O1	1827051745	CQZYHHHAUXMWFS-TYCQWZJGSA-N	428.338	1.167	50	20	IDGD	
Cc1cccc(CC(=O)N2CCC([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)n1	1827055899	NSQRVMIRBWQFNV-HSZRJFAPSA-N	449.360	1.546	50	20	IDGD	
Cc1ncncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827057372	DFAVETNLHZAXCN-NRFANRHFSA-N	436.321	1.012	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)COc3ccc(OC)cc3)CCO2)C1	1830243460	CIHCKBUIFHYVIS-WIYYLYMNSA-N	440.924	1.548	50	20	IDGD	
CN1CCN(C2(C(=O)N3CCCC[C@@H]3C3CCN(C(=O)[C@@H](F)Cl)CC3)CC2)CC1	1830247856	ZSALMPCEUUBGBG-QZTJIDSGSA-N	428.980	1.921	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(C)nc3OC)C2)C1	1831652277	XODDBDKHXLIPCE-DYESRHJHSA-N	439.940	1.876	50	20	IDGD	
Cc1cc(C(=O)N2CCC([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)cc(O)n1	1831870757	FHTQRDBHTUDNNO-LJQANCHMSA-N	445.564	1.702	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)COc2cccnc2)CC1	1831870822	HLZGTVCCFRZQNY-HXUWFJFHSA-N	445.564	1.453	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H]2C[C@H]3CC[C@@H]2O3)CC1	1831874105	BDKVASMRVMMZJW-WTGUMLROSA-N	434.581	1.547	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)/C=C/c2cnccn2)CC1	1831876598	LLQUHMWKVKSZFT-CPSHHHPTSA-N	442.564	1.483	50	20	IDGD	
Cc1cc(CCC(=O)N2CCC(N3CCC(NC(=O)[C@H](O)CCl)CC3)CC2)ccn1	1833308281	PFRZGTJZWZJWDR-HXUWFJFHSA-N	436.984	1.494	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3ccc4c(c3)COC4)CC2)CC1)[C@@H](O)CCl	1833310031	GJLGHAQPDBQEFO-FQEVSTJZSA-N	435.952	1.502	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3ccc(OC)nc3)CC2)CC1	1833600885	XOYSXYZQXRAOMF-SFHVURJKSA-N	438.956	1.529	50	20	IDGD	
Cc1noc(C)c1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)Br)C2)C1	1834067911	AHJXYPROEHKGBY-GTNSWQLSSA-N	430.299	1.145	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)c1ccnc(Cl)c1	1834193746	FCQCRLLSJGGEBO-MRXNPFEDSA-N	429.348	1.520	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)CNC(C)(C)C)CC2)CC1	1834699906	NAYKTAMEWOERAO-CQSZACIVSA-N	431.419	1.730	50	20	IDGD	
O=C(C(Cl)Cl)N1CCOC[C@@]2(C1)CN(C(=O)C1(C(F)(F)F)CCC1)CCO2	1835474392	SNHWGIWBZUUPFF-CQSZACIVSA-N	433.254	1.979	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@H](C)n3ccccc3=O)CC2)CC1	1835824675	AKBXECRZQSVQRI-QFBILLFUSA-N	436.984	1.998	50	20	IDGD	
CCOC(=O)N[C@H](O)C(=O)N1CCC(OC2CCN(C(=O)C(C)(C)CCl)CC2)CC1	1836623235	DLNIGABRDYFLTC-MRXNPFEDSA-N	447.960	1.315	50	20	IDGD	
C[C@@H](Nc1ccccn1)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836718477	PMZUCQUOQTZSAZ-QAPCUYQASA-N	438.956	1.480	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cc(Cl)ncn1)CCO2	1838257694	NJKZGRQHVIGDGH-SFHVURJKSA-N	442.976	1.052	50	20	IDGD	
CCc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@](C)(Cl)CCl)C3)C2)nn1C	1838276384	VIEAADVNGAPTBG-MOPGFXCFSA-N	447.363	1.289	50	20	IDGD	
N#Cc1cccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)c1Cl	1838596369	XBXJBTLSBQMMRB-CRAIPNDOSA-N	430.263	1.816	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@@H]3CCCN(C)C3)CC2)CC1	1838617701	ZTYYVUVRGDULHA-VQIMIIECSA-N	429.989	1.581	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cccs3)C2)C1	1839963961	BFMZVLCDTRMWCY-CRAIPNDOSA-N	445.379	1.921	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)C(C)(F)F)C2)C1	1840030633	QZZMHTGKICSUAW-PXAZEXFGSA-N	441.313	1.908	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3c(C)c[nH]c3C)C2)C1	1840150757	RDPVJVZCDAOKLA-RXVVDRJESA-N	441.956	1.274	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCCC(F)(F)F)C2)C1	1840151187	XCFSDSKTHXDOAJ-CZUORRHYSA-N	430.851	1.429	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)N2CCOC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)c1	1840186378	GOUNTWNAKMOKHW-FQEVSTJZSA-N	445.343	1.942	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)CN2CCCCC2)C1	1842819395	IYBUYKAFNBSKDQ-UHFFFAOYSA-N	444.488	1.823	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@](F)(C(=O)N2CCCC23CN(C(=O)[C@@H](O)CCl)C3)C1	1843953453	ZWVDTDZUHNLJPL-DJJJIMSYSA-N	433.908	1.139	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1ccc3cnccc3c1)C2	1844264493	YKPLHODSGUAHEM-UHFFFAOYSA-N	430.468	1.364	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)[C@H](C)Nc2ccccn2)C1	1844389821	SHYMLTOMZXUMSG-CXEIWHQESA-N	437.504	1.219	50	20	IDGD	
COc1nc(C)ccc1C(=O)N1CCCC12CN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2	1844542695	PEIKUDDXLAZRIX-MFKUBSTISA-N	438.488	1.350	50	20	IDGD	
Cc1cc[nH]c1C(=O)N1CC2(CCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)C1	1845038475	HFJPWPKNFBECFU-UHFFFAOYSA-N	438.532	1.486	50	20	IDGD	
C[C@@H]1[C@H](C(=O)N2CCCC23CN(C(=O)[C@H](O)CCl)C3)CCN1C(=O)OC(C)(C)C	1847162115	ZQUBUSVONHKKHB-RBSFLKMASA-N	429.945	1.435	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H]1CC[C@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](O)CCl)CC1	1847557444	YVJGFBGKJZRLGX-WOYTXXSLSA-N	443.972	1.871	50	20	IDGD	
CCCCn1c(N)c(N(C)C(=O)/C(C#N)=C/c2cc(C)n(CCOC)c2C)c(=O)[nH]c1=O	10442465	SQBIZUFLFSEORL-SFQUDFHCSA-N	442.520	1.554	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1cccc(C[S@](C)=O)c1	10777827	QFMIKGZPYBHJKJ-GDLZYMKVSA-N	438.889	1.845	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)CCNC2=NS(=O)(=O)c3ccccc32)cc1	12673785	INVGILKEUPMDLC-UHFFFAOYSA-N	432.527	1.363	50	20	IDGD	
CSCC[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)NNC(=S)NC(C)(C)C	14895119	TYQFZMBZBBDYBS-CYBMUJFWSA-N	427.552	1.740	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2C1)c1cccc(S(=O)(=O)N2CCCC2)c1	16960291	SHVIGLRFZIDWQA-KRWDZBQOSA-N	429.498	1.483	50	20	IDGD	
CCS(=O)(=O)N1CCC(C(=O)NNC(=O)COc2ccccc2-c2ccccc2)CC1	17202175	HWUFCUOMRMIFHJ-UHFFFAOYSA-N	445.541	1.942	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2[nH]c(C)c(C(C)=O)c2C)c1	23710484	OGSZBISAEQWYAT-UHFFFAOYSA-N	434.518	1.939	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CC(=O)N(c2ccc3c(c2)OCCO3)C1)c1cc(-c2ccccc2)on1	27259899	BJSVRGPTAHRPHO-OAHLLOKOSA-N	448.435	1.927	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)CN2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)cc1	108077609	QCMSVOWCRPWGNM-UHFFFAOYSA-N	444.557	1.325	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)CCn2c(C)csc2=O)c1	725898985	RTUJJJNHYKPAIB-UHFFFAOYSA-N	440.547	1.100	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)/C(=C\c2ccccc2)NC(C)=O)c2ccccc2c1=O	726071747	RBAXRKAZWWNDIM-XMHGGMMESA-N	433.468	1.745	50	20	IDGD	
CC(C)(C)OC(=O)NCCc1ccc(CNC(=O)NN[C@@]2(C)CCS(=O)(=O)C2)cc1	726275187	XWQNGLYKJOXBMP-FQEVSTJZSA-N	440.566	1.635	50	20	IDGD	
Nc1nc(Cl)c(C=NNC(=O)C2CCN(c3ncccn3)CC2)c(N2CCCC2)n1	728783615	AKMCFKMJLPBJJU-UHFFFAOYSA-N	429.916	1.469	50	20	IDGD	
C[C@H](CC(=O)NNC(=O)c1nnc(O)c2ccccc12)S(=O)(=O)c1ccc(F)cc1	729299808	ICTJZRURIDDPNS-LLVKDONJSA-N	432.433	1.488	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)CC[C@H]1NC(=O)N(c2ccc(Cl)cc2)C1=O	730748070	HPRQENSCTPISRL-MRXNPFEDSA-N	444.875	1.944	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)CC[C@@H]2NC(=O)N(c3ccc(Cl)cc3)C2=O)cc1	730774071	RXDBRBHAVCWTPK-INIZCTEOSA-N	425.832	1.878	50	20	IDGD	
Cc1c(C(=O)NNC(=O)COc2ccc(C#N)cc2)nnn1-c1cccc2cccnc12	731470085	NAYDSFYLSKLIPF-UHFFFAOYSA-N	427.424	1.836	50	20	IDGD	
CCCc1c(C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)nnn1-c1cccc(Cl)c1	731617767	SCCXNJQAKVMSTP-LBPRGKRZSA-N	440.913	1.004	50	20	IDGD	
CC(=O)c1cccc(O[C@H](C)C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c1	732333783	VDNSBERMPTZQBC-CYBMUJFWSA-N	429.385	1.569	50	20	IDGD	
CC(C)(C)OC(=O)N1CCCC[C@@H](NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)C1	733336495	UTEJOPFBKKJFNS-OAHLLOKOSA-N	444.496	1.396	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NN=C2C(=O)Nc3ccc([N+](=O)[O-])cc32)CC1	734749696	LYILARIMEIPDEH-UHFFFAOYSA-N	432.437	1.950	50	20	IDGD	
CC(=NNC(=O)c1cccc([N+](=O)[O-])c1)c1cccc(S(=O)(=O)N2CCOCC2)c1	739403784	YTQWYNHFLDRZMU-UHFFFAOYSA-N	432.458	1.770	50	20	IDGD	
O=C(Cc1ccc(S(=O)(=O)C(F)F)cc1)NNC(=O)c1ccc2c(c1)OCCO2	740645653	KOZDMTHUJMWMGE-UHFFFAOYSA-N	426.397	1.458	50	20	IDGD	
COc1cc(C(=O)NNC(=O)N[C@@H]2CCC[C@@H](S(C)(=O)=O)C2)cc(OC)c1OC	740902930	SXRWNVOGJUIYSY-CHWSQXEVSA-N	429.495	1.012	50	20	IDGD	
O=C(COC(=O)C1CCN(Cc2ccccc2)CC1)NNC(=O)c1cccc([N+](=O)[O-])c1	741327724	BPSDHMOBNWWHLD-UHFFFAOYSA-N	440.456	1.811	50	20	IDGD	
CC(=O)N[C@@H](CC(=O)NNC(=O)Cc1nc2ccccc2n1C)c1ccc(F)cc1F	741659704	DNNNPWJSJVTNOS-KRWDZBQOSA-N	429.427	1.809	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)CSc2nnc(COc3ccc(F)cc3)n2N)cc1	742452129	GHMOIUPHBQVXLA-UHFFFAOYSA-N	441.448	1.135	50	20	IDGD	
COCCOCc1cc(C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)ccc1F	743292930	NLOVNRFQJZDWNT-UHFFFAOYSA-N	428.420	1.955	50	20	IDGD	
O=C(NCCc1ccn(-c2ccc(F)cc2)n1)NNC(=O)c1ccc(-n2cnnn2)cc1	743509814	KSHNHWGSWRQBEH-UHFFFAOYSA-N	435.423	1.174	50	20	IDGD	
CCCNC(=O)c1cccc(CNC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)c1	743547671	DMSHTPCJGAMTGO-UHFFFAOYSA-N	447.517	1.766	50	20	IDGD	
COc1ccccc1OCCCNC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	743593754	XLZIUOJSYMEKCS-UHFFFAOYSA-N	436.490	1.904	50	20	IDGD	
COc1cccc(-c2noc([C@H](C)NC(=O)NNC(=O)COc3ccccc3O)n2)c1	743706032	XIKICCRBTVNSDQ-LBPRGKRZSA-N	427.417	1.921	50	20	IDGD	
Cc1cc(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)c2c(C)nn(C)c2n1	744622269	YYONXBKNZKKMFU-UHFFFAOYSA-N	444.517	1.363	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)CCc2nnc(-c3ccsc3)o2)cc1	744654241	UDUFTYMHDCSQPF-UHFFFAOYSA-N	425.426	1.607	50	20	IDGD	
Cc1ccc(S(=O)(=O)Nc2ccccc2F)cc1C(=O)NNC(=O)N1CCOCC1	745992440	AAXCKHNAWFPUQW-UHFFFAOYSA-N	436.465	1.622	50	20	IDGD	
CC(C)(C(=O)NNC(=O)Cc1ccncc1)S(=O)(=O)c1ccc(Br)cc1	747322657	JAYURWQPDWXOHX-UHFFFAOYSA-N	440.319	1.787	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)NCc1cccc(NC(=O)c2cccc(F)c2)c1	748616648	FCQNLRQRDGWQTF-CQSZACIVSA-N	432.452	1.960	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)NCC(=O)Nc1cc(Br)ccc1C	748625935	VZHVBYRKYCSXCT-LLVKDONJSA-N	431.287	1.078	50	20	IDGD	
CCc1c(C(=O)NNc2ccc(S(=O)(=O)Nc3nccs3)cc2)[nH]c(C)c1C(N)=O	749258714	SRIZMNVPRNECNA-UHFFFAOYSA-N	448.530	1.999	50	20	IDGD	
COc1cc([N+](=O)[O-])ccc1OC(=O)C1CCN(S(=O)(=O)c2cn(C)c(C)n2)CC1	751167780	YOMLDMUTNSTMIF-UHFFFAOYSA-N	438.462	1.652	50	20	IDGD	
C[C@H](C[S@@](C)=O)NC(=O)/C(C#N)=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	753152152	GSOLHWUWYUABSQ-YOEQKUHHSA-N	447.948	1.869	50	20	IDGD	
CCn1nccc1C=NNC(=O)C[C@H]1c2cc(OC)c(OC)cc2CCN1S(C)(=O)=O	753689147	BEJJBBCARAEBSU-KRWDZBQOSA-N	449.533	1.319	50	20	IDGD	
C[C@H](Sc1ccccn1)C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	754220471	RQCZOSHVCRLKJY-AWEZNQCLSA-N	434.543	1.808	50	20	IDGD	
CCCNC(=O)NNS(=O)(=O)c1cc(Br)c(C)c([N+](=O)[O-])c1OC	755003144	PRTOMECINVWFAZ-UHFFFAOYSA-N	425.261	1.577	50	20	IDGD	
CCCCNC(=O)NNS(=O)(=O)c1cc(Br)c(C)c([N+](=O)[O-])c1OC	755003163	PZRAOZHWRNEFJT-UHFFFAOYSA-N	439.288	1.967	50	20	IDGD	
CC(C)C[C@@H](C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1)N1CCCCC1=O	755050423	YZNMKQISFWQEKS-AWEZNQCLSA-N	444.941	1.176	50	20	IDGD	
COc1cccc(-c2noc([C@@H](C)NCC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)n2)c1	755056266	ZUXSVQGHIJTEPY-GFCCVEGCSA-N	440.416	1.765	50	20	IDGD	
Cc1cc(=O)n(CC(=O)NC(C)C)c(C)c1C(=O)NNc1ccc(C(F)(F)F)nn1	755194003	LLGKXWLBUKSZBL-UHFFFAOYSA-N	426.399	1.555	50	20	IDGD	
CN(C)C(=O)Cc1ccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1	755916305	IFSMGQPHTBASGD-UHFFFAOYSA-N	447.517	1.034	50	20	IDGD	
COc1cc(CN2CC[C@H](NC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)C2)cc(OC)c1	756103118	SBVVVYBYAGBVPH-INIZCTEOSA-N	443.460	1.831	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Nc2ccccc2CS(C)(=O)=O)cc(OC)c1OC	756269029	IFHDEURZTMOZES-UHFFFAOYSA-N	437.474	1.724	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1cccc2c1CCN2C(=O)OC(C)(C)C	757620501	JQVXZPJYOPWWBQ-LLVKDONJSA-N	441.510	1.075	50	20	IDGD	
CCOC(=O)c1cnn2c(C(=O)NNC(=O)[C@@H](C)Oc3cccc(C)c3C)ccnc12	757987940	ISNUCAQYLVNENA-CQSZACIVSA-N	425.445	1.751	50	20	IDGD	
COc1ccc([C@H](C)NC(=O)NNC(=O)C(=O)Nc2ccccn2)cc1Br	758680991	FSGRTOYIMLKLBA-JTQLQIEISA-N	436.266	1.883	50	20	IDGD	
CC(C)[C@@H](NC(=O)C12CC3CC(CC(C3)C1)C2)C(=O)NNC(=O)C(=O)Nc1ccccn1	758827916	OWOHFOJESGEJLI-FBXSJCODSA-N	441.532	1.525	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)NC[C@@H]1CN(Cc2ccccc2)CCCO1	759228930	JVXJKFFDPQUHIE-HXUWFJFHSA-N	436.516	1.498	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)c2cnn(C)c2Br)cc1C	759629143	OONGSOJXVZHDCE-UHFFFAOYSA-N	429.296	1.733	50	20	IDGD	
NC(=O)[C@H]1CC[C@@H](CNC(=O)NNC(=O)Nc2ccc(Br)cc2Cl)O1	759771777	DECFSUXTOLMSMS-GZMMTYOYSA-N	434.678	1.471	50	20	IDGD	
Cc1nn(-c2ccccc2)c2sc(C(=O)NNC(=O)NC[C@H]3CC[C@H](C(N)=O)O3)cc12	760204314	QHZSJVASYFQLDM-UKRRQHHQSA-N	442.501	1.372	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ccncc2)c(Br)cc1F	763467073	QMRGODHPGLBXKW-UHFFFAOYSA-N	439.197	1.170	50	20	IDGD	
CCOc1cc2c(cc1NC(=O)C(=O)NNC(=O)c1ccc(OC)c(OC)c1)O[C@@H](C)C2	763544555	YJACSRWOLCNKPE-LBPRGKRZSA-N	443.456	1.826	50	20	IDGD	
COc1ccc(NC(C)=O)cc1NC(=O)C(=O)NNC(=O)c1ccc(OC)c(OC)c1	763550394	FIKLJSYBZJWRQS-UHFFFAOYSA-N	430.417	1.071	50	20	IDGD	
CC(C)(C)c1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(-n3nccn3)cc2)cc1	763600095	MOHCYYOKGMOBPW-UHFFFAOYSA-N	436.472	1.730	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(C#N)ccc1OC(C)C	763646998	LKPUZVQMCJUATP-UHFFFAOYSA-N	426.429	1.519	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(OC)c(NC(C)=O)c1	763680542	GOVSVJZJBRNBQH-UHFFFAOYSA-N	444.444	1.217	50	20	IDGD	
Cc1nc(N2CCOCC2)ccc1NC(=O)C(=O)NNC(=O)COc1ccc(Cl)cc1	763693990	DDWJNGMZKXZCCG-UHFFFAOYSA-N	447.879	1.045	50	20	IDGD	
O=C(CSc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1ccc(Cn2cncn2)cc1	763732697	FCARYVVFMLYIQW-UHFFFAOYSA-N	444.904	1.858	50	20	IDGD	
NS(=O)(=O)c1cccc(NC(=O)C(=O)NNC(=O)CC23CC4CC(CC(C4)C2)C3)c1	763735426	NPZIVQPODZPRTK-UHFFFAOYSA-N	434.518	1.026	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)C(=O)Nc1ccc2c3c(cccc13)CC2	763791575	VZBUBKHPKIQYDJ-UHFFFAOYSA-N	427.420	1.987	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(OCC(=O)OC)c(Cl)c2)cc1	763829611	IGSXQORSEBZKFC-UHFFFAOYSA-N	433.848	1.854	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccn(CC(F)(F)F)n2)c1C	763848080	GWVOBIKYMUANTL-GFCCVEGCSA-N	427.383	1.616	50	20	IDGD	
CC(=O)N(C)c1ccccc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1cccc(C)c1C	763852008	UAVZADGDRJICGC-HNNXBMFYSA-N	426.473	1.840	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)C(=O)Nc1ccnc(C(=O)N(C)C)c1	763852401	IMWHTTUBZWIZGR-AWEZNQCLSA-N	449.467	1.490	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)N2CCc3cc(F)c(F)cc32)cc1	763877999	NSSAUUVVJQLJQJ-GFCCVEGCSA-N	431.395	1.671	50	20	IDGD	
O=C(CC(F)(F)F)NNC(=O)C(=O)Nc1cc(Br)cnc1-n1cccn1	764115676	DYWDBAZTYZESRB-UHFFFAOYSA-N	435.160	1.068	50	20	IDGD	
Cc1cccc(NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)c1C(=O)N1CCCC1	764153567	LVWDWEMYFDXIMF-GOSISDBHSA-N	436.468	1.321	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)C(=O)Nc2ccnn2C(C)(C)C)c1	764234471	YCPSCXCNGKKTIM-UHFFFAOYSA-N	438.282	1.809	50	20	IDGD	
C[C@@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3cccc(C#N)c3)cc2F)C[C@@H](C)O1	764234823	KTLBTYDNMCCPKN-ZIAGYGMSSA-N	439.447	1.711	50	20	IDGD	
C[S@@](=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cccc(OC(F)F)c2)cc1F	764259176	FDTVSRCCYSDAAF-GDLZYMKVSA-N	429.376	1.564	50	20	IDGD	
CCN(CC)CCn1ccc2cc(NC(=O)C(=O)NNC(=O)Cc3cc[nH]n3)ccc21	764294036	SUZDPANRWDDKRR-UHFFFAOYSA-N	425.493	1.035	50	20	IDGD	
CCOCC(=O)NNC(=O)C(=O)Nc1ccc(C(=O)N2CCC[C@H]2c2ccccc2)cc1	764319088	JRWOHMTZEUMRDV-IBGZPJMESA-N	438.484	1.786	50	20	IDGD	
COC(=O)[C@H]1CN(C(=O)C(=O)NNC(=O)CCCc2cccs2)c2ccccc2O1	764339206	GOHXZNQEOVZMBU-MRXNPFEDSA-N	431.470	1.185	50	20	IDGD	
Cc1cc(-c2nc3cc(F)ccc3n2C)ccc1NC(=O)C(=O)NNC(=O)c1cnn(C)c1	764358810	IUVPTMHSXOWMCI-UHFFFAOYSA-N	449.446	1.821	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2cccc(-n3ccnn3)c2)n[nH]1	764376720	GFGBXIUTEWGGBC-UHFFFAOYSA-N	446.427	1.066	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccn(-c4ccncc4)n3)n[nH]2)cc1C	764387936	WCHRYPFINZCSTK-UHFFFAOYSA-N	444.455	1.674	50	20	IDGD	
CS(=O)(=O)[C@H]1CCCCC1=NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	764841109	QTFPJOIKVQRPNN-IBGZPJMESA-N	440.997	1.917	50	20	IDGD	
COC(=O)c1cccc(C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)n1	765750625	BFVSCNADADDSBD-UHFFFAOYSA-N	445.907	1.100	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1ccc(N2CCOCC2)cc1C(F)(F)F	766261363	VVDWRUPVHVRLHS-UHFFFAOYSA-N	440.382	1.422	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3ccnc(-n4ccnc4)c3)n[nH]2)cc1OC	768276606	LIOJQPBTBIACCN-UHFFFAOYSA-N	433.428	1.749	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)Nc1cccc(OCC(N)=O)c1	769953038	JFVBDJPJXTUCEU-UHFFFAOYSA-N	435.506	1.776	50	20	IDGD	
NS(=O)(=O)c1cccc(NC(=O)C(=O)NNc2ccc(Br)c(F)c2)c1	770815031	ADDVVWOSRJNQRQ-UHFFFAOYSA-N	431.243	1.317	50	20	IDGD	
Cc1cccc2c(=O)n(CCC(=O)NNC(=O)C(=O)NCc3ccc(Cl)cc3)cnc12	772188780	WZWXLQXLWJEJDK-UHFFFAOYSA-N	441.875	1.212	50	20	IDGD	
C[C@H](CN(C)C(=O)OC(C)(C)C)C(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772195074	ILSXBAVCJULEID-GFCCVEGCSA-N	426.901	1.607	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)on1)Nc1cnn(Cc2nnc3n2CCCC3)c1	772636986	ZWILIPMUDPMZQD-UHFFFAOYSA-N	447.459	1.981	50	20	IDGD	
CC(C)[C@H](C(=O)NNC(=O)c1ccc(F)cc1Br)N1CCCS1(=O)=O	772671756	SSRJNGSQWCWSJS-CYBMUJFWSA-N	436.303	1.409	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)Cn2c(=O)cnc3ccccc32)C1	773418662	LAXVPUWHVKJSCE-AWEZNQCLSA-N	429.477	1.191	50	20	IDGD	
CC(C)c1nccnc1NNC(=O)C(=O)Nc1ccc(CN2C(=O)CSC2=O)cc1	773993042	YCNBAADYGVJVMX-UHFFFAOYSA-N	428.474	1.877	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)CNC(=O)c2cccc(Br)c2)c1	776529722	NXQTUFCWDOXPMQ-UHFFFAOYSA-N	426.292	1.726	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H](C)NC(=O)CC(C)(C)C)c1	778282133	FABZUEVQRFSHDV-AWEZNQCLSA-N	440.566	1.419	50	20	IDGD	
Cc1ccc(CNC(=O)NNC(=O)CNC(=O)OC(C)(C)C)c(OC[C@H]2CCCO2)c1	778702816	UFCHQKDNUQBVBF-MRXNPFEDSA-N	436.509	1.908	50	20	IDGD	
O=C(Cc1cc(O)nc(S)n1)NN=C1CCC(N2C(=O)c3ccccc3C2=O)CC1	780207496	GIIZYEUQOLGHSK-UHFFFAOYSA-N	425.470	1.724	50	20	IDGD	
O=C(N[C@]1(C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)CCOC1)OCc1ccccc1	780848264	BMLFAAWSPHGOJQ-HXUWFJFHSA-N	428.401	1.441	50	20	IDGD	
COCc1noc(CN2CCN(S(=O)(=O)c3ccc(CCCCl)cc3)CC2)n1	780902073	NQEFUFOAYJYDEY-UHFFFAOYSA-N	428.942	1.894	50	20	IDGD	
COc1cc(Cl)ccc1NC(=O)C(=O)NNC(=O)c1csc(N2CCOCC2)n1	782897183	LYQOUSFDKJRBHW-UHFFFAOYSA-N	439.881	1.041	50	20	IDGD	
COC(=O)CCOc1ccc(NC(=O)C(=O)NN=c2sc3ccccc3n2C)cc1	783351366	CZVIFXJWQGJKRR-UHFFFAOYSA-N	428.470	1.752	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)C(=O)Nc1cccc(COC2CCCCC2)c1	784002802	UQAMHIYKERGYPA-UHFFFAOYSA-N	442.472	1.645	50	20	IDGD	
O=C1CN(c2ccc(NC(=O)C(=O)NNc3ccc([N+](=O)[O-])cc3Cl)cc2)CCN1	784390749	BSCLRFMEGHDXCE-UHFFFAOYSA-N	432.824	1.266	50	20	IDGD	
CC(C)CCNS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccc(Cl)nn2)cc1	784791883	DVORYIOOKDQYSU-UHFFFAOYSA-N	440.913	1.536	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2cccc([N+](=O)[O-])c2)cc1	784829526	SWLJBIZYUYVJGV-UHFFFAOYSA-N	435.462	1.707	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)C(=O)Nc2c3c(nn2-c2ccccc2)CCC3)c1	784839879	RTKFXGPXPFETPI-UHFFFAOYSA-N	439.497	1.846	50	20	IDGD	
O=C(NNc1c(F)cc(C(=O)NC2CC2)cc1F)C(=O)Nc1cccc(-c2nnco2)c1	785100171	SKMDBHZIUOATBZ-UHFFFAOYSA-N	442.382	1.989	50	20	IDGD	
COc1cc(C(=O)OCC(=O)NNC(=O)Cc2nc(C)cs2)cnc1Br	786736371	GCXSRCXSSKLZMP-UHFFFAOYSA-N	443.279	1.165	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cc(C#N)cn2C(C)(C)C)cc(OC)c1OC	789730713	ZBAODWIJTFGMON-UHFFFAOYSA-N	443.460	1.540	50	20	IDGD	
O=C1CSc2ccc(NC(=O)C(=O)NNC(=O)[C@H]3OCC[C@H]3c3ccccc3)cc2N1	789812690	MHXPDRCGTRFCMN-KSSFIOAISA-N	440.481	1.389	50	20	IDGD	
CCS(=O)(=O)c1ccc([C@@H](C)NC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1	790988035	LWDJGMAEEPGNOW-FZKQIMNGSA-N	433.486	1.712	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cc([N+](=O)[O-])c(N(C)C)cc2F)cc(OC)c1OC	791196545	IWCHTAPSFUJFDH-UHFFFAOYSA-N	436.396	1.901	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)c2cnn3c2C[C@@H](CNC(C)=O)CC3)cc1	792736839	RPGDXXNHBGVDRO-HOCLYGCPSA-N	443.504	1.209	50	20	IDGD	
CO[C@@H]1CCC[C@@H](CC(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)C1	795107820	FSXJIBBDRWRGMX-HZPDHXFCSA-N	425.555	1.056	50	20	IDGD	
O=C(NC[C@H]1CCC(F)(F)C1)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	797554025	NVEYLISJQDABMG-ZDUSSCGKSA-N	430.477	1.851	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(NC(=O)NNC(=O)CNC(=O)OCc2ccccc2)c1	797606375	BMFLABCDJOJJSE-UHFFFAOYSA-N	449.489	1.016	50	20	IDGD	
O=C(CS(=O)(=O)Nc1ccc(N2CCCCC2)cc1)NNC(=O)NCC(F)(F)F	798315068	NBOPAKUPTKRCRA-UHFFFAOYSA-N	437.444	1.311	50	20	IDGD	
C[C@@H](c1ccc(S(N)(=O)=O)cc1)N(C)C(=O)NNC(=O)Cn1ccc2ccccc21	799920163	CNQPWCVGBBLLBK-AWEZNQCLSA-N	429.502	1.723	50	20	IDGD	
COc1ccc(Cl)c(NC(=O)NNC(=O)[C@](C)(O)CN2Cc3ccccc3C2=O)c1	802113562	WAIUCTUQBBGRKT-HXUWFJFHSA-N	432.864	1.908	50	20	IDGD	
COc1ccc(C2=NO[C@@H](CNC(=O)NNC(=O)COc3ccccc3OC)C2)cc1C	802349649	URXHAFMNIQEEPC-MRXNPFEDSA-N	442.472	1.915	50	20	IDGD	
CC(C)c1ccccc1NC(=S)NNC(=O)CNS(=O)(=O)c1c[nH]c2ncccc12	803273310	SRQYSWUMFHTBOE-UHFFFAOYSA-N	446.558	1.982	50	20	IDGD	
CS(=O)(=O)CC[C@H](NC(=O)c1ccc(Cl)cc1)C(=O)NNc1cccc(F)n1	804764646	ZBPBVPJPFJUXHC-ZDUSSCGKSA-N	428.873	1.551	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)O[C@@H](C)c2nncn2C)cc1	805361296	VJINYRMMWNIXGC-FBKCMUNRSA-N	449.471	1.774	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)[C@]2(C)CC(c3ccccc3Cl)=NO2)c2ccccc2c1=O	806272919	NBJGZSPCKFLDTL-NRFANRHFSA-N	439.859	1.931	50	20	IDGD	
N[C@@](C(=O)NNC(=O)c1csc(N2CCOCC2)n1)(c1cccc(F)c1)C(F)(F)F	806338247	NXTSUDFXHHKYEC-MRXNPFEDSA-N	447.414	1.296	50	20	IDGD	
C[C@H](C#N)S(=O)(=O)c1ccc(NC(=O)NNC(=O)c2cc(Br)c[nH]2)cc1	806457720	ARIGYLSDWHLMBC-SECBINFHSA-N	440.279	1.929	50	20	IDGD	
O=C1COC[C@H](C[C@H]2CN(C(=O)C(=O)NNc3cc(F)c(F)c(F)c3)c3ccccc32)N1	807020806	RNTGKJOEVGZBAK-AAEUAGOBSA-N	448.401	1.583	50	20	IDGD	
C=CCOc1ccc(CNC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1	807416458	GPGQAGCGLPEDOM-UHFFFAOYSA-N	446.529	1.711	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc2ccccc2c1)NNC(=O)c1cc(Cl)ccc1O	809992311	LUQPARYCJZZPNP-UHFFFAOYSA-N	433.873	1.938	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)CNS(=O)(=O)c3ccc(C)cc3)n[nH]2)cc1	810583917	IEXZEDIIXRFMBD-UHFFFAOYSA-N	441.513	1.687	50	20	IDGD	
O=C(NC[C@@H]1CCN(c2ccccc2F)C1)NNC(=O)C1CCN(c2ncccn2)CC1	812883079	OTMZNIVBQLFQOU-INIZCTEOSA-N	441.511	1.689	50	20	IDGD	
CC(=NNC(=O)Nc1ccc2c(c1)OCO2)c1cccc(S(=O)(=O)N2CCOCC2)c1	814992960	UFHMAFYSKPGTKA-UHFFFAOYSA-N	446.485	1.982	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)C2CCC(OC[C@@H]3CCCO3)CC2)cc1	816596700	MMNYVGNVQQLSBH-PREGVCBESA-N	439.534	1.997	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)c1c(Cl)cccc1S(C)(=O)=O	817054378	HNRIUEMMWVPXGI-UHFFFAOYSA-N	431.923	1.751	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)c2ccc(-n3cccn3)nc2)cc1	871148359	LUMZRUPQZKYYQT-UHFFFAOYSA-N	434.485	1.763	50	20	IDGD	
CCCCN(C(=O)COC(=O)/C(C#N)=C\c1cc(C#N)n(C)c1C)[C@@H]1CCS(=O)(=O)C1	913286905	MWGVQRPXNSZXKK-ZTXRYZOMSA-N	446.529	1.471	50	20	IDGD	
C[C@]12CCC(=O)N1c1ccccc1C(=O)N2CC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	913553275	PDUIGDHPVRXTNB-OAQYLSRUSA-N	437.412	1.355	50	20	IDGD	
CC(C)c1cccc(OCC(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1	914875614	BBJYELLHMDNRGI-LJQANCHMSA-N	428.441	1.719	50	20	IDGD	
O=C(CSCc1cccnc1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	915128566	GUXGFKDDBFPHGY-UHFFFAOYSA-N	434.543	1.561	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NC[C@H](Cc2ccccc2)N(C)C)c2ccccc2c1=O	915900991	MSNFGXKVALPVAF-KRWDZBQOSA-N	436.516	1.533	50	20	IDGD	
Cn1ccnc1[C@H](NC(=O)NNC(=O)c1nnc(O)c2ccccc12)c1cccc(F)c1	916224710	PTBWEIRDQISZEZ-MRXNPFEDSA-N	435.419	1.942	50	20	IDGD	
CCOC(=O)c1c(S(=O)(=O)NNC(=O)c2ccc(COc3ccccc3)o2)n[nH]c1C	917726382	FTMXUYQEEWYTLB-UHFFFAOYSA-N	448.457	1.690	50	20	IDGD	
COc1cc(-c2noc(CCC(=O)NNC(=O)C(=O)NC(C)C)n2)cc(Cl)c1OC	918147382	ISGLQIOIDAUAHV-UHFFFAOYSA-N	439.856	1.012	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)NC3CCOCC3)c2)cc1	918233239	KFUGKCZHSXYDPW-UHFFFAOYSA-N	448.501	1.619	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)[C@@H]2CCCN(S(=O)(=O)CC)C2)cc1	918548622	HLJXDDXWUQSAAA-HUUCEWRRSA-N	427.523	1.062	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)C1=NO[C@H](c2ccccc2)C1	919684854	MBPRQCKZEJMYID-IBGZPJMESA-N	442.497	1.750	50	20	IDGD	
CSCC[C@@H](NC(=O)c1ccc([N+](=O)[O-])o1)C(=O)NNC(=O)c1c[nH]c2ccccc12	919810542	KLLNFLUAVGOQMO-CQSZACIVSA-N	445.457	1.982	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)Nc1ccccc1CN1C(=O)CNC1=O	920933400	OCAGIJMEVOSEFX-GFCCVEGCSA-N	429.408	1.498	50	20	IDGD	
COc1cc(C=NNC(=O)CSc2nnc(O)nc2O)c(Br)cc1O	921258208	ALOZUUPTQKWUFP-UHFFFAOYSA-N	430.240	1.002	50	20	IDGD	
O=C(NCc1ccccc1CN1CCCC1=O)NNC(=O)c1nnc(O)c2ccccc12	1115854029	PXGFUVDUUJPOAV-UHFFFAOYSA-N	434.456	1.602	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@@H]2CCCCN2Cc2ccncc2)c2ccccc2c1=O	1116024312	QCQDFSHGLKEAKL-IBGZPJMESA-N	434.500	1.627	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCC(=O)NNc2nc3ccccc3c(=O)n2CC)cc1	1317749808	WUOQYNVKIGKKKD-UHFFFAOYSA-N	445.501	1.237	50	20	IDGD	
O=C(NNC(=O)c1csc(Cc2ccc(Cl)cc2)n1)N[C@@H]1CCS(=O)(=O)C1	1318049939	XVBAKRUDYDFLPW-GFCCVEGCSA-N	428.923	1.518	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)N1CCC([C@@H]2C(=O)Nc3ccccc32)CC1	1318338941	RQAKLBBGLMHYHW-SFHVURJKSA-N	425.445	1.198	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2ccc(C(=O)O)cc2Br)cc1	1318966874	ZIWIKTVOXWURIE-UHFFFAOYSA-N	429.248	1.779	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@@H](C(=O)NNC(=O)c2ccccc2Cl)[C@H](C)O)cc1	1319920862	WBGQKJDJMRJHTI-BLLLJJGKSA-N	425.894	1.137	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2n[nH]c3c2CCCC3)nnn1-c1ccc(OC(F)F)cc1	1321636500	KSKIIHVYKBJVAZ-UHFFFAOYSA-N	431.403	1.854	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)[C@H]1CC(=O)N(c2ccc(C#N)cc2)C1	1324021020	GCQBECHBRHZATI-SFHVURJKSA-N	434.452	1.153	50	20	IDGD	
CSCC[C@H](C(=O)NNC(=O)c1n[nH]c2c1CCCC2)N1C(=O)[C@H]2CCCC[C@@H]2C1=O	1337223320	UIBIIMYKOKISSG-HEHGZKQESA-N	447.561	1.346	50	20	IDGD	
Cc1cc2nnc(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)[C@@H](F)Cl)C4)c(C)n2n1	1778561418	SVYSGBXHMGQMHZ-VVFCZOMOSA-N	438.891	1.403	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cccn4ccnc34)C2)C1	1778577801	KJQJHVSOCQQHKN-IFXJQAMLSA-N	435.322	1.809	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3n[nH]c4c(F)cccc34)C2)C1	1778636758	FAAHTIORGHKSMP-ZMZPIMSZSA-N	439.285	1.929	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Cl)C2)[C@@H]1ON=C(c2ccccc2)O1	1779260816	RPXGRQCGMCIUCX-XWYPRVOQSA-N	439.871	1.769	50	20	IDGD	
O=C(c1cc(-c2cccs2)on1)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1779563293	GLNUYMXECKMBSP-FZKQIMNGSA-N	425.894	1.446	50	20	IDGD	
COc1nn(C)cc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@](C)(Cl)CCl)C1	1780710315	OXSCEZNUMDXQSO-NIKGAXFTSA-N	447.363	1.793	50	20	IDGD	
CC(C)NC(=O)OC(C)(C)C(=O)N1CC[C@@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1781022391	JQCBIAUBGSMRLA-HXUWFJFHSA-N	443.617	1.581	50	20	IDGD	
Cc1nccn1CCCC(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781334389	MXJHOVRJQDIFQS-WBVHZDCISA-N	431.306	1.492	50	20	IDGD	
COC(=O)C1(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](C)CBr)C3)CC1	1781811371	ZLZKNKUYCOEMON-HBUWYVDXSA-N	445.354	1.485	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)cc1O	1782135038	CUODRNRTIVFYSY-GOSISDBHSA-N	430.288	1.598	50	20	IDGD	
CN(C)C(=O)c1cccc(C(=O)N2CCO[C@@]3(CCN(C(=O)C(Cl)Cl)C3)C2)c1	1783952901	WPHBVOAYOHPQNC-LJQANCHMSA-N	428.316	1.636	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccnc3S)C[C@@H]21	1783964127	KRQWBIVJCRVICL-JURCDPSOSA-N	442.379	1.995	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ncccc3-c3ccccc3)C[C@@H]21)[C@@H](O)CCl	1784090719	LOJCTIPTEBPACO-LEAZDLGRSA-N	443.931	1.942	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)C3(F)CN(C(=O)OC(C)(C)C)C3)C2)C1	1785687164	KHAODJFQRZMJHU-LIRRHRJNSA-N	447.935	1.793	50	20	IDGD	
COC(C)(C)C(=O)Nc1ccc(C2(NC(=O)c3cnccc3C(=O)NN)CCC2)cc1	1785891818	BIYCMOHKZGZMIT-UHFFFAOYSA-N	425.489	1.858	50	20	IDGD	
Cc1noc(C)c1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)CBr)C[C@@H]21	1785974494	VOGSZQIJFBGOEE-KJEVXHAQSA-N	428.327	1.916	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCBr)[C@H]3C2)cn1	1786400987	KPAFEQSPQOOJQI-KKUMJFAQSA-N	426.311	1.469	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)C[C@@H]21)[C@H](F)Cl	1787451242	CDWMNPSNOWBJTQ-FGLOERETSA-N	428.844	1.331	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)[C@H](O)c3ccccc3)CCC2)cc1)c1ccc(B(O)O)cc1	1788140715	NLZMUOQYNKKIBW-JOCHJYFZSA-N	444.296	1.848	50	20	IDGD	
CCc1cnc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Br)C[C@@H]32)s1	1788772861	ZYFNPBAWMGTRMK-XYJRDEOASA-N	434.331	1.989	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)c1cc(-c2cccs2)on1	1788908143	PDHCVKNDQPJKGC-DUPGQFARSA-N	439.921	1.596	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ncccc3C(F)(F)F)[C@H]2C1	1788997968	RMGGZDZDUMYAHL-VIRABCJISA-N	449.857	1.948	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cn3ccccc3=O)C[C@@H]21	1789866354	PUVPCJJBHXUQAT-XLPNERPQSA-N	430.332	1.064	50	20	IDGD	
CC(C)c1nc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]3C2)no1	1789868683	IZPWYWXMRHRTNU-WFTHSTBKSA-N	447.363	1.952	50	20	IDGD	
Cc1n[nH]c(C)c1CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)Br)C[C@@H]21	1789976546	CVWBTSNSKSOWPT-NZBMOFRJSA-N	427.343	1.332	50	20	IDGD	
COC(=O)[C@H]1CCC[C@H](C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]3C2)C1	1791298536	ZAITYCQAFOHJFW-YTFOTSKYSA-N	435.348	1.749	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)Oc3cccnc3)[C@H]2C1	1791654362	PYUQSOUEIKOTPD-AUOOEQCUSA-N	440.338	1.612	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1(C)CCC1	1792446689	NKMSAYDRYUYXLW-CCWDJLKJSA-N	445.472	1.914	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C(=O)c1ccc(Cl)cc1)c1cccc(B(O)O)c1	1793080696	XGIPLCNLMFAINX-REPLKXPHSA-N	440.692	1.155	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCl	1793116803	URYZRSXCXSJHMQ-XFIYOXNOSA-N	429.945	1.624	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(S(C)(=O)=O)cn1	1794426672	VQOWBMYTPSFDTQ-YXPYIKCWSA-N	443.953	1.096	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H](O)[C@H](C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](F)Cl)C1	1796812220	ZYGCTUBYVNMHCZ-QLKXBERHSA-N	433.908	1.387	50	20	IDGD	
Cc1cc(C(=O)NCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@](C)(Cl)CCl)C3)no1	1798509637	SRFGKPQZSKQQCW-YFQWEKLQSA-N	431.320	1.587	50	20	IDGD	
CC(C)c1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)CBr)C3)n[nH]1	1798665788	RPGPINXQSIFDPQ-NFFDBFGFSA-N	427.343	1.767	50	20	IDGD	
C[C@@H]1CCc2c(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@](C)(Cl)CCl)n[nH]c21	1799275329	PQYGRVKMBRACRU-FOHZDRRLSA-N	429.348	1.899	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3ccnn3c1)C2)[C@@H](F)Br	1799346567	CVFCNKIDRAMJBW-AYRXBEOTSA-N	425.258	1.228	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/c1cccc(O)c1)C2)[C@H](F)Br	1799346736	FSJHRLGQYZVKIN-CYYRZDKHSA-N	427.270	1.686	50	20	IDGD	
CC(C)(C)n1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Br)cn1	1799347350	GHZVKNIIGQEMAQ-CRWXNKLISA-N	431.306	1.532	50	20	IDGD	
COC(=O)c1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](F)Br)cn1	1800159577	JWTHNBIBNBJNPE-OPDFLTKYSA-N	428.258	1.811	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(OC)cn1)C2	1800641328	YSMVSXGNUYYIJP-FAXLKDOZSA-N	426.311	1.467	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccnc(OC)c1)C2	1800642036	SMVWCRVYPKKGOJ-FQLMCAECSA-N	426.311	1.467	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COc1ccc(F)cc1)C2	1800757413	YIRRTXDVBJKCCR-KOFHJDLBSA-N	429.286	1.578	50	20	IDGD	
COc1cc(C)c(C)cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(B(O)O)cc1)C2	1800797135	INRMKTRTVNWSIC-ACDBMABISA-N	436.317	1.557	50	20	IDGD	
COC[C@H](NC(C)=O)C(=O)N1CC[C@H](CNC(=O)C(C)(C)CCl)[C@@H]1c1cccnc1	1802900943	IEGPZPQEXLTSJX-SQNIBIBYSA-N	438.956	1.504	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)CSC1=S)[C@@H](F)Br	1804336169	ZFRBARWFLDUNTP-JXVAYASWSA-N	438.344	1.175	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2ccccc2O)[C@@H]1c1cccnc1	1805205728	FASZSKXYJBWLLK-JTSKRJEESA-N	439.516	1.480	50	20	IDGD	
CC(=O)NC(C)(C)C(=O)N1CC[C@@H](CNC(=O)CCBr)[C@@H]1c1cccnc1	1806341707	FGLUAQOZZIHGIM-RDJZCZTQSA-N	439.354	1.787	50	20	IDGD	
Cc1cccc(C(=O)N2CCCC3(CCN(C(=O)c4cnccc4C(=O)NN)CC3)C2)n1	1808198971	PNNNEBQOFJXHIK-UHFFFAOYSA-N	436.516	1.547	50	20	IDGD	
CC(C)CNC(=O)C(=O)NC[C@@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1	1808444379	RYICCTXIXGZEKB-DOTOQJQBSA-N	439.354	1.645	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2cnn3cccnc23)[C@H]1c1cccnc1	1809745330	OYWWKCRUPQJLQV-BPQIPLTHSA-N	442.907	1.698	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)C2=NNC(=O)C2)[C@@H]1c1cccnc1	1810224177	CBHYYZMKRJUPCF-XEZPLFJOSA-N	436.310	1.137	50	20	IDGD	
C/C=C/C=C\C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1	1810305960	RKNBXDMIHQWVMO-VHDLWDKBSA-N	434.500	1.532	50	20	IDGD	
Cc1cncc(C(=O)N2CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)c1	1813070359	ICTFAIJHVAUOFD-AVRDEDQJSA-N	438.532	1.478	50	20	IDGD	
O=C(O)c1cc(C(=O)N2CC[C@@H](CNC(=O)C(Cl)Cl)[C@@H]2c2cccnc2)ncn1	1813078219	RGRRCMKBJOUZDI-FZMZJTMJSA-N	438.271	1.693	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2n[nH]cc2[N+](=O)[O-])[C@H]1c1cccnc1)C(Cl)Cl	1813079226	WPIUCLMMNZOUNW-GWCFXTLKSA-N	427.248	1.836	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc3cccnc3nc2O)[nH]n1)[C@@H](O)CCl	1814875000	LKQUAEPZIGTDLK-GJZGRUSLSA-N	444.879	1.964	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(Cl)o2)[nH]n1)c1cccc(B(O)O)c1	1817475409	QHPYORPSGODDKO-HNNXBMFYSA-N	442.668	1.956	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)CCBr)[nH]n1)c1cnc(O)nc1O	1818019727	ODVZZNXJYUIDOC-NSHDSACASA-N	439.270	1.702	50	20	IDGD	
C=CCSCC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819401777	RYTUECPKGYASAJ-INIZCTEOSA-N	443.533	1.633	50	20	IDGD	
Cc1n[nH]cc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819403540	SERFGBGYCCEOBU-INIZCTEOSA-N	437.464	1.059	50	20	IDGD	
O=C(Cn1ccncc1=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](F)Br)[nH]n1	1821656859	RAOXUAZKDYZMLD-NHYWBVRUSA-N	441.261	1.349	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)/C=C/c2cnc[nH]2)n[nH]1	1822659711	AMZSDEJDGBDLTI-BDUNBXCCSA-N	449.475	1.151	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)[C@H]1CCCSC1	1823453304	SFKQZKXTONIMKR-YJBOKZPZSA-N	442.350	1.539	50	20	IDGD	
O=C(Cn1cc([N+](=O)[O-])cn1)N1CCC([C@H]2CCCCN2C(=O)[C@H](O)CCl)CC1	1824179419	RLITUYLCGMBACD-HZPDHXFCSA-N	427.889	1.011	50	20	IDGD	
C=C(C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCC(=O)NN(C)C)CC2)C(F)(F)F	1825270600	SYNANPQFWKNHEH-SNVBAGLBSA-N	433.456	1.547	50	20	IDGD	
COc1nccnc1C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](C)Br)sc2C1	1825636477	GLRSXLNDCIEFGG-RKDXNWHRSA-N	440.323	1.951	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](C)n1cnnn1)CC2	1825648075	XVFKQAGYRDXCRU-CIUDSAMLSA-N	428.316	1.086	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)c2ccsc2)CC1	1825796186	XUCHFKCIIBPVQD-HXUWFJFHSA-N	426.347	1.975	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@H]1CCc2nc(NC(=O)C3=COCC3)sc2C1	1827236993	JLSUINOTQPGNBU-BTIIEKFUSA-N	442.501	1.493	50	20	IDGD	
O=C(Cn1cccc([N+](=O)[O-])c1=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H](F)Cl)CC1	1827615188	XHCIMAVRPJGLCN-YOEHRIQHSA-N	442.875	1.911	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](O)CCl)CC2	1827968981	DXUPOBSJMUADAX-ZYHUDNBSSA-N	446.957	1.570	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)C3=CCCS3)C2)C1	1830536082	XUZZEKCMMJLGEK-SUMWQHHRSA-N	433.368	1.495	50	20	IDGD	
CCc1nc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)co1	1830539496	HOPADLPLDMEDTK-FZKQIMNGSA-N	444.326	1.338	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)COc3cccnc3)C2)C1	1831640571	NSPMTRNUYLLGRG-FXAWDEMLSA-N	425.913	1.324	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(C)o3)CCO2)C1	1831801871	WDDRJYDUELQSPT-RDTXWAMCSA-N	429.311	1.832	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)C(=O)c2cccn2C)CC1	1831876268	CIRXSVSRADEJMU-GOSISDBHSA-N	445.564	1.201	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)C23CC(C2)C3)CC1	1832468844	BAHSUQYGGKESJY-PELQFQBLSA-N	425.533	1.719	50	20	IDGD	
O=C(CCc1ccco1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1833051292	REZSRZONASUNSE-WBVHZDCISA-N	433.274	1.359	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cnn4ccccc34)CC2)CC1)[C@@H](O)CCl	1833310038	GRDOAHKWZAIPAL-IBGZPJMESA-N	433.940	1.119	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3csnn3)CC2)CC1	1833559147	OGTKWNBWUMFCKH-CQSZACIVSA-N	444.399	1.897	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cc(C(=O)O)ncn3)CC2)CC1	1833969595	UEQLBPSITBWBLY-HNNXBMFYSA-N	437.928	1.377	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(F)cn3)CCO2)C1	1834473804	OVABFRQVTRZJHD-UGSOOPFHSA-N	444.301	1.322	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3csc(C)c3C)CCO2)C1	1834541396	KVJMFPGLKUPKGG-VQIMIIECSA-N	430.954	1.689	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3cc(O)n[nH]3)CC2)CC1	1834772449	FRGPKWKAPGEKAO-AWEZNQCLSA-N	442.358	1.474	50	20	IDGD	
O=C(CCc1ccsc1)N1CCOC[C@@]2(C1)CN(C(=O)CCBr)CCO2	1834822281	FEUQHQJQAFRPIG-GOSISDBHSA-N	445.379	1.922	50	20	IDGD	
Cc1nc2ncccn2c1C(=O)NC1CCN(C2CCN(C(=O)[C@@H](F)Cl)CC2)CC1	1835373790	LZKRYDJGJKHHKB-QGZVFWFLSA-N	436.919	1.757	50	20	IDGD	
CCNC(=O)N[C@@H](C)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](Cl)CC)CC2)CC1	1836397352	XYVOWVRITMKCMB-YOEHRIQHSA-N	429.993	1.283	50	20	IDGD	
CCN(C)[C@H](C)C(=O)N1CCC(N2CCC(NC(=O)[C@H](F)Br)CC2)CC1	1836413993	SYISFLNQFOJEJB-CJNGLKHVSA-N	435.382	1.589	50	20	IDGD	
COc1ccc(C(=O)N2CCC(OC3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)cn1	1836713874	NAZXYFSSXLEFEC-KRWDZBQOSA-N	425.913	1.302	50	20	IDGD	
CC(C)c1nc(CC(=O)N2CCC(OC3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)no1	1836715180	MBWJYNAZNMJIIT-INIZCTEOSA-N	442.944	1.334	50	20	IDGD	
CN(C)c1ccc(C(=O)N2CCC(OC3CCN(C(=O)[C@H](O)CCl)CC3)CC2)cn1	1836718661	YLJPKKNJRPKKCC-GOSISDBHSA-N	438.956	1.360	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cnn(C)c3C)CC2)CC1	1837544965	MTNGIBCCONVAJL-SFHVURJKSA-N	426.945	1.595	50	20	IDGD	
CCc1nc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)co1	1838135403	LKJKJFDBBVVCHY-LJQANCHMSA-N	425.558	1.159	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(F)c3F)CCO2)C1	1839000275	XCIARHHFSRMMIM-XIKOKIGWSA-N	447.276	1.818	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3csc(N)n3)C2)C1	1839152200	RAYUNWVRLHPPST-CVEARBPZSA-N	437.349	1.032	50	20	IDGD	
Cc1ccnc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)c1	1839200165	CXYMGLSZRCAYFI-PBHICJAKSA-N	430.274	1.151	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)OC(C)C)C2)C1	1839965148	OCYZMWCNFCQUQJ-VKJFTORMSA-N	435.359	1.430	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccncc3)C2)C1	1839965836	MHDAPGJTYKBIRT-VQIMIIECSA-N	440.338	1.254	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)C3CCSCC3)C2)C1	1839967301	IDRKEZBNLMMWJE-QAPCUYQASA-N	449.411	1.760	50	20	IDGD	
O=C(COc1ccccc1F)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1839970150	HOTRWGSTCODUDF-GOSISDBHSA-N	435.279	1.465	50	20	IDGD	
Cc1nn(C)c(C)c1CC(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1840435292	RPHJIAVVOWIAOY-NRFANRHFSA-N	440.972	1.301	50	20	IDGD	
CC[C@@H](NC(C)=O)C(=O)N1CCCC12CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2	1841088135	UUQBJWYSCYSXER-QGZVFWFLSA-N	446.460	1.252	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H]2C[C@H]2C[C@@H]1C(=O)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1	1841354840	ZNABXKCAYSTELK-BYNSBNAKSA-N	427.929	1.187	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCCC12CN(C(=O)CCc1ncc[nH]1)C2	1841925439	VVKNFCYPSXHIPW-AWEZNQCLSA-N	439.944	1.678	50	20	IDGD	
Cc1nn2cc(CC(=O)N3CC4(CCCN4C(=O)CCBr)C3)nc2s1	1842637503	XKWPKQSITQZIDF-UHFFFAOYSA-N	426.340	1.630	50	20	IDGD	
CC#C[C@@H](CC(=O)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1)c1ccc(O)cc1	1843012459	QTHQHMAGZIFMAW-FQEVSTJZSA-N	446.312	1.086	50	20	IDGD	
O=C(c1cc(Cl)sc1Cl)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843014319	XFSXYYODKFPREG-UHFFFAOYSA-N	439.129	1.866	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)c2cccnc2-c2ccccc2)C1	1843498214	CSRKSHWCWHXMRQ-UHFFFAOYSA-N	441.296	1.559	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)[C@@H]1CCCN(C)C1)C2	1844693023	OSLVZRLGOFJFHB-MRXNPFEDSA-N	444.488	1.679	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@H](O)CCNC(=O)OC(C)(C)C)C1	1845221392	SWZKBVYBBDXMRH-GJZGRUSLSA-N	431.961	1.873	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCCC12CN(C(=O)[C@H]1CCC(=O)NC1)C2	1845870270	YDSSLUFHXUXFLV-MDNIKOHYSA-N	428.439	1.601	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)C[C@H]2CCS(=O)(=O)C2)cc(OCC)c1OCC	24127261	SWULIUHWZSCIIY-CYBMUJFWSA-N	428.507	1.469	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)c3ccccn3)CC2)cc1	27694525	JOKQHLYOZWLCBP-UHFFFAOYSA-N	432.502	1.342	50	20	IDGD	
CNS(=O)(=O)c1ccc(C(=O)NNC(=O)COc2ccccc2-c2ccccc2)o1	31637275	IOVCEBVIHXGUQF-UHFFFAOYSA-N	429.454	1.695	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)c2ccc(C(N)=O)s2)c2ccccc2c1=O	116418439	YIMZDCPTISFKRN-UHFFFAOYSA-N	427.486	1.822	50	20	IDGD	
O=C(CC12C[C@H]3C[C@@H](CC(Br)(C3)C1)C2)NNC(=O)[C@H]1CCS(=O)(=O)C1	302771753	ZGTIWIGOHSFREX-LZULQBLISA-N	433.368	1.693	50	20	IDGD	
CC(C)(C)OC(=O)N1CCCC[C@H]1CNC(=O)NNC(=O)CNC(=O)c1cccs1	725872337	CJUDISUJICFZRA-ZDUSSCGKSA-N	439.538	1.598	50	20	IDGD	
C[C@H]1CCCCN1C(=O)[C@@H](C)NC(=O)NNC(=O)COc1ccc(Br)cc1	726615478	AUIDXSAARCRZFJ-QWHCGFSZSA-N	441.326	1.948	50	20	IDGD	
CCN(CC)C(=O)N1CCC(C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)CC1	728209818	MFFZYDAMZQFDCN-UHFFFAOYSA-N	437.566	1.744	50	20	IDGD	
C[C@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(S(=O)(=O)NNC(=O)c3ccc[nH]3)cc2)C1	728260583	JLSWAMHTELMHGD-OKILXGFUSA-N	440.547	1.305	50	20	IDGD	
CC(C)(C)n1nc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1C1CC1	728329893	XKYSDNBDMLSUNO-GOSISDBHSA-N	442.472	1.660	50	20	IDGD	
CC(=O)NCC(=O)N1CCC[C@H]1C(=O)NNC(=O)COc1ccccc1-c1ccccc1	728456632	UFLUXQYPSPKAAG-IBGZPJMESA-N	438.484	1.007	50	20	IDGD	
CCOC(=O)C1=NN(c2ccccc2)[C@H](C(=O)NNC(=O)Cn2ccc3ccccc32)C1	729540651	JODLGJSZDQNUKL-FQEVSTJZSA-N	433.468	1.987	50	20	IDGD	
COc1ccc(C(C)(C)CNC(=O)NNC(=O)CNC(=O)c2cccs2)cc1OC	730025658	PGAZEOAUVJVERU-UHFFFAOYSA-N	434.518	1.803	50	20	IDGD	
CCc1ccc(-n2nc(C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)c3c2CCC3)cc1	730769699	WOWLBTSQIMVWPB-UHFFFAOYSA-N	442.483	1.974	50	20	IDGD	
O=C(CCc1nc(O)c2cnn(-c3ccccc3)c2n1)NNC(=O)COc1ccccc1O	730781017	BUPNCBAXIUYFLH-UHFFFAOYSA-N	448.439	1.386	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1cncc(-c2cnn(C)c2)c1	731185032	AXFDULYAZZYIOZ-UHFFFAOYSA-N	427.490	1.158	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)c1ccc(OC)c(S(=O)(=O)NC(C)(C)C)c1	731493345	WXINPSIOIKBMCV-UHFFFAOYSA-N	435.502	1.855	50	20	IDGD	
O=C(NNC(=O)c1ccc2nccn2c1)c1cccc(S(=O)(=O)N2CCCCC2)c1	731595465	GOLXRENAGKHEFS-UHFFFAOYSA-N	427.486	1.584	50	20	IDGD	
Cc1c(C(=O)NNC(=O)CCN2C[C@H](C)O[C@@H](C)C2)nnn1-c1cccc2ncccc12	732263324	LTLVAAJWUVAZIL-GJZGRUSLSA-N	437.504	1.384	50	20	IDGD	
CN1CCC(N2CC[C@@H](NC(=O)NNC(=O)c3ccc(Br)s3)C2)CC1	734281768	PMIZWSOZNAFLPL-LLVKDONJSA-N	430.372	1.623	50	20	IDGD	
CN(C)[C@@H](CNC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)c1c(F)cccc1F	734675737	LWXFOVIQMAMTEL-INIZCTEOSA-N	440.472	1.615	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)[C@@H]2CCC[C@@H]2NC(=O)OC(C)(C)C)n1	740296518	LBVRVTZECUNYNV-OLZOCXBDSA-N	440.522	1.378	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNS(=O)(=O)c3ccccc3S(N)(=O)=O)cc2C1	740705593	JGVWPZSRUQCUSQ-JTQLQIEISA-N	429.545	1.144	50	20	IDGD	
CCc1ccccc1CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	741091185	AUUAMSFYTIUOHZ-UHFFFAOYSA-N	446.529	1.414	50	20	IDGD	
N#Cc1ccc(S(=O)(=O)NNC(=O)c2cc(F)ccc2Br)c([N+](=O)[O-])c1	741205124	UMJCRTUPCJEWPA-UHFFFAOYSA-N	443.210	1.991	50	20	IDGD	
N#Cc1ccc(S(=O)(=O)NNC(=O)c2ccccc2Br)c([N+](=O)[O-])c1	741205415	YNLDNGSBJGRHFD-UHFFFAOYSA-N	425.220	1.852	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)c2ccc(CNS(=O)(=O)CC)cc2)cc1OC	741658856	IHNQUYCNZGJQQB-UHFFFAOYSA-N	449.529	1.998	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2cc(=O)n(-c3ccc(C)cc3)[nH]2)c2ccccc2c1=O	742241489	JJHNIJPHVJJIBG-UHFFFAOYSA-N	446.467	1.669	50	20	IDGD	
CC(C)(C)C(=O)Nc1nc(CC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cs1	742534270	DDQNQPXZAYBEHF-UHFFFAOYSA-N	438.531	1.535	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN(C)[C@H](C)c2ccc(S(N)(=O)=O)cc2)cc1C	744385760	VPIDTXZEJMGFPU-CYBMUJFWSA-N	438.575	1.720	50	20	IDGD	
CCO[C@H](C)c1nc(CN2CCN(CC(=O)NNC(=O)c3ccc(F)cc3)CC2)cs1	744412607	HBXQUVJIYAVKIS-OAHLLOKOSA-N	449.552	1.959	50	20	IDGD	
Cc1ccc(N2C(=O)C[C@H](C(=O)NNC(=O)C(=O)NC(C)C)[C@@H]2c2cccs2)cc1	744446524	BVUXTRLXYSUPNA-MAUKXSAKSA-N	428.514	1.823	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(CC(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)C1	746097234	DCGFEIYBLBOIIW-UHFFFAOYSA-N	446.913	1.005	50	20	IDGD	
O=C(NCCNS(=O)(=O)c1cccs1)NNC(=O)c1cccc(Br)c1	746731583	RYJABMNGJJROPU-UHFFFAOYSA-N	447.336	1.433	50	20	IDGD	
COC(=O)c1cn(CC(=O)NNC(=O)c2ccc(COc3ccc(Cl)cc3)cc2)nn1	747344710	GJUYAHNNJPTSHL-UHFFFAOYSA-N	443.847	1.758	50	20	IDGD	
Cn1c(=O)nc(O)c2nc(CCC(=O)NNc3ccc(Br)cc3F)[nH]c21	748190973	ICBYLLATBULLGA-UHFFFAOYSA-N	425.218	1.340	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)CCc2ccccc2)sc1Br	750093681	BGQZTFYSRCWXLU-UHFFFAOYSA-N	432.321	1.552	50	20	IDGD	
COc1ccc2c(C)c(CCC(=O)NNC(=O)CNC(=O)c3ccco3)c(=O)oc2c1	751204953	SZERZJBUYYZJQT-UHFFFAOYSA-N	427.413	1.213	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)c1ccc(CS(C)(=O)=O)o1	751292191	DQDVSGPLOOQSKV-JTQLQIEISA-N	445.291	1.815	50	20	IDGD	
CCOC(=O)[C@@H]1Cc2cc(S(=O)(=O)NNC(=O)COc3ccccc3CC)ccc2O1	751539398	XJTVQWPMPODEPA-IBGZPJMESA-N	448.497	1.504	50	20	IDGD	
COc1ccc(C(=O)CCC(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)cc1F	751718382	YAUICTPLYYSJKX-UHFFFAOYSA-N	427.388	1.673	50	20	IDGD	
Cn1c(NNC(=O)CCNS(=O)(=O)c2cccc(Cl)c2)nc2ccccc2c1=O	752907629	LTGZWHLVAAVVBK-UHFFFAOYSA-N	435.893	1.399	50	20	IDGD	
O=C(NC[C@H]1CCCCS1(=O)=O)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1	753259846	DYDMLECZQXUPMT-GFCCVEGCSA-N	429.442	1.574	50	20	IDGD	
Cc1ncc(S(=O)(=O)NNC(=O)c2nn(CCC(C)C)c(=O)c3ccccc23)s1	754746415	YNJMUQSUCOIGEZ-UHFFFAOYSA-N	435.531	1.831	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(OC)c(NC(=O)NNC(=O)Cc2cccnc2)c1	755408156	ACMKWPALNKABCK-UHFFFAOYSA-N	435.506	1.516	50	20	IDGD	
CO[C@@H](C)C(=O)Nc1cccc(NC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])c1	756228958	XWLMGSCBWLSKDS-LBPRGKRZSA-N	431.405	1.800	50	20	IDGD	
Cc1ccc(N2CCOC2=O)cc1NC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	756822148	ZWUTUUUFKTUQJN-UHFFFAOYSA-N	432.458	1.822	50	20	IDGD	
O=C(NN=c1cc[nH]cc1Cl)C1CCN(S(=O)(=O)c2cc(F)ccc2F)CC1	757413771	MFDZSALSKKAXQZ-UHFFFAOYSA-N	430.864	1.979	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)C(=O)Nc1ccccn1)c1cc(F)ccc1N1CCN(C)CC1	758744844	CCYMCAKCTPMTPI-CQSZACIVSA-N	443.483	1.003	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)CCc2nnc(C3CCCC3)o2)ccc1Cl	760281942	MXPDLYSVAXHGDZ-UHFFFAOYSA-N	441.897	1.422	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)c1noc(-c2ccccc2)n1	761795658	DCCSZKHCRBTXSB-GFCCVEGCSA-N	433.428	1.689	50	20	IDGD	
Cn1ccc([C@@H](NC(=O)NNC(=O)CNC(=O)c2cccs2)c2ccc(Cl)cc2)n1	762571043	JVGIJAMDCXAGQY-KRWDZBQOSA-N	446.920	1.985	50	20	IDGD	
CN(C)S(=O)(=O)c1ccsc1C(=O)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	763174033	UQHPJJVEIZEYEP-UHFFFAOYSA-N	437.478	1.602	50	20	IDGD	
Cc1cc([N+](=O)[O-])cc(S(=O)(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)c1F	763439921	YKDAZHIWAJCFSV-UHFFFAOYSA-N	434.446	1.657	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(NC(=O)[C@H]2CCCO2)cc1	763444585	VDKHSFGOQIHQTG-MRXNPFEDSA-N	441.400	1.112	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)N3CCOCC3)c(Cl)c2)c(C)o1	763587205	UINPKWRGLZZQRS-UHFFFAOYSA-N	448.863	1.422	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CNC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)C1CC1	763588811	JWZFWTPOMSSFIG-HNNXBMFYSA-N	440.522	1.337	50	20	IDGD	
CCCS(=O)(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2cc(C)oc2C)c1C	763602900	UCHXGNPXTYPUHK-UHFFFAOYSA-N	436.490	1.756	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc2nc(C(F)F)[nH]c2c1	763645897	DGUCYSHMZYZCNJ-UHFFFAOYSA-N	433.371	1.674	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2ccccc2O[C@H]2CCOC2)c1	763647987	RROHKZXGCCBMNP-INIZCTEOSA-N	427.457	1.636	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(N(C)C(=O)OC)cc1	763713184	VWHGJJSUYYZYSA-UHFFFAOYSA-N	428.445	1.617	50	20	IDGD	
O=C(CSc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1cccnc1-n1cccn1	763731338	ADNXXYUDHCOMRU-UHFFFAOYSA-N	430.877	1.799	50	20	IDGD	
CCC(=O)Nc1ccc(C)c(NC(=O)C(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])c1	763802345	BOJDENBAJCCAEX-UHFFFAOYSA-N	443.416	1.417	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])cc1-c1ncco1	763803935	PDZFGWCTRDZAJD-UHFFFAOYSA-N	439.384	1.723	50	20	IDGD	
CCn1cc(NC(=O)C(=O)NNC(=O)c2nc(-c3ccccc3)n(-c3ccccc3)n2)cn1	763806130	ZLZYVISYMZAQNI-UHFFFAOYSA-N	444.455	1.550	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(OC[C@H]3CCCO3)c2)cc1	763809769	PARMTEHXJZKHSN-LJQANCHMSA-N	427.457	1.718	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)C(=O)Nc1cnn(CC(F)F)c1	763851516	DEHWWNVCWNMYQH-GFCCVEGCSA-N	431.399	1.855	50	20	IDGD	
COC(=O)c1ccc(OC)cc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccccc1F	763856263	GIBWIQAIFNRABV-NSHDSACASA-N	433.392	1.174	50	20	IDGD	
CCN(CC)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)cc1	763867536	WLMZYVRYVKKQDN-CQSZACIVSA-N	444.463	1.861	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccc(C(=O)NCc3ccccc3)cc2)n1	763886407	XMWWTDILGDQXEE-UHFFFAOYSA-N	448.483	1.216	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccc(C(=O)OC(C)(C)C)cc2F)n1	763891234	NBDMEFLWNAZEPI-UHFFFAOYSA-N	433.440	1.380	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)ccc1Cl	764005199	WGVJPZZRAHDYCG-UHFFFAOYSA-N	447.831	1.688	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(F)(F)F)cc2)c1	764078435	USMVDSVHKGSONU-UHFFFAOYSA-N	429.376	1.509	50	20	IDGD	
CS(=O)(=O)c1ccc(F)c(NC(=O)C(=O)NNC(=O)Cc2ccc3ccccc3c2)c1	764085108	YTFGVLCZRVPXRZ-UHFFFAOYSA-N	443.456	1.711	50	20	IDGD	
CC(C)(C)OC(=O)c1ccccc1NC(=O)C(=O)NNC(=O)[C@H]1Cc2ccccc2O1	764168556	QTNOIUQCVNSJMW-QGZVFWFLSA-N	425.441	1.732	50	20	IDGD	
Cc1cn2cc(NC(=O)C(=O)NNC(=O)c3cc(Br)ccc3O)ccc2n1	764279708	DAVBXZOAHCORIH-UHFFFAOYSA-N	432.234	1.511	50	20	IDGD	
CCOCC(=O)NNC(=O)C(=O)Nc1sc2c(c1C(=O)OC(C)C)CC[C@H](C)C2	764317092	INSDMGCIGPVSKA-NSHDSACASA-N	425.507	1.561	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2cc3ccccc3o2)cc1C	764331228	ROFFMFIWHYVPEY-UHFFFAOYSA-N	444.469	1.903	50	20	IDGD	
CCN(CC)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)cc1	764400830	IOBZLFXZQKKSMG-UHFFFAOYSA-N	444.513	1.752	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)C(=O)Nc1cccc(Cn2cccn2)c1	764405665	WLEQHOTWNSUZQY-UHFFFAOYSA-N	425.470	1.515	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNS(=O)(=O)c3cc4ccccc4o3)CC2)cc1	765127810	RBMHTPKCDOVXMD-UHFFFAOYSA-N	442.541	1.869	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(C(=O)NNC(=O)CSc2ccccc2O)cc1	765249284	ROMZHEBRIILIKF-UHFFFAOYSA-N	437.543	1.976	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2cccs2)[nH]n1)Nc1ccccc1CN1C(=O)CNC1=O	765306412	CYXLXJUINMVCJV-UHFFFAOYSA-N	439.457	1.657	50	20	IDGD	
COc1cc(OC)cc(N2CC[C@H](NC(=O)NNc3ccccc3S(C)(=O)=O)C2=O)c1	767069122	QFHCERKDYRVTKZ-KRWDZBQOSA-N	448.501	1.539	50	20	IDGD	
CN(C)C(=O)c1cc(F)ccc1NC(=O)C(=O)NNC(=O)c1cccc(OC(F)F)c1	768238537	BXNBJHVAVGEWJZ-UHFFFAOYSA-N	438.362	1.529	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@@H]2CCOC3(CCCC3)C2)cc1	769177475	YUSVSPMOMUWWQU-MRXNPFEDSA-N	438.550	1.438	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)Nc1cnn(CCN2CCOCC2)c1	770544692	KPICVBXRJZJZJW-AWEZNQCLSA-N	436.900	1.489	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)c2ncccc12	770774596	RNFSPWJYRMOEOM-GFCCVEGCSA-N	426.404	1.936	50	20	IDGD	
C[C@H]1CN(C(=O)NNC(=O)c2c(Cl)cccc2Cl)CCN1c1nccn2cnnc12	771206352	DDVXVBRFRKNQGN-NSHDSACASA-N	449.302	1.996	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)NCCNS(=O)(=O)c2ccc(C)s2)c1	771945487	CEYZLUVYOIYUPO-UHFFFAOYSA-N	426.520	1.053	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)c1nnn(C2CC2)c1C(F)(F)F	772884453	MQMJPWVJMWBDQD-UHFFFAOYSA-N	430.774	1.363	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1cccc(-c2nncn2C)c1	774008006	DLLINDSUOZGOCY-GFCCVEGCSA-N	442.863	1.689	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN[C@@H](c2ccc3c(c2)OCCO3)C2CC2)cc1OC	776014105	GRBDMKGMZZNFHV-JOCHJYFZSA-N	441.484	1.977	50	20	IDGD	
CC1CCC2(CC1)OC[C@H](CNC(=O)NNC(=O)C1CCN(c3ncccn3)CC1)O2	776907281	LCGSKWNQMZURNO-LBKMDBTOSA-N	432.525	1.345	50	20	IDGD	
COc1cccc(NNC(=O)Nc2ccc(N(C)C(=O)CN3CCN(C)CC3)cc2)n1	780551163	FIRMSEXQEMWBLE-UHFFFAOYSA-N	427.509	1.449	50	20	IDGD	
CCSc1cccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)c1	783264388	OMDUUFCTUOEFRO-UHFFFAOYSA-N	437.547	1.962	50	20	IDGD	
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)NNC(=O)c1cc(OC)cc(OC)c1	783806721	QNWBNHUVHZVWKZ-UHFFFAOYSA-N	439.402	1.022	50	20	IDGD	
COCCn1nc(C)c(NC(=O)C(=O)NNc2nc(-c3ccc(Cl)cc3)no2)c1C	784799561	JVKWCKCVINIZPG-UHFFFAOYSA-N	433.856	1.932	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)NCc1ccnc(Oc2ccccc2F)c1	787382479	FJMRDIVRIBBZSK-UHFFFAOYSA-N	427.392	1.866	50	20	IDGD	
Cn1nc(-c2ccsc2)cc1NC(=O)C(=O)NNC(=O)[C@H]1COc2ccccc2O1	787541440	RZUAUTDCCJNXTC-OAHLLOKOSA-N	427.442	1.075	50	20	IDGD	
O=C(NCCc1ccccc1OC(F)F)NNC(=O)C1CCN(c2ncccn2)CC1	788103493	WXOSIKSZXWJSBB-UHFFFAOYSA-N	434.447	1.868	50	20	IDGD	
CCNc1ccc(Cl)cc1C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	791533047	AXIJOBIYWPNWGH-QGZVFWFLSA-N	433.848	1.916	50	20	IDGD	
CC(C)(C)OC(=O)Nc1ccc(CC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)nc1	792029864	LCTYNAQFDFGWOG-UHFFFAOYSA-N	438.448	1.408	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)cnc1C	793429288	OXQFKYVZHHSWME-LLVKDONJSA-N	427.866	1.607	50	20	IDGD	
CN(C(=O)OC(C)(C)C)[C@H](C(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)c1cnn(C)c1	794711752	GCLNQHPQWTXKLR-HNNXBMFYSA-N	432.437	1.698	50	20	IDGD	
CN(C(=O)OC(C)(C)C)[C@H](C(=O)NNC(=O)COCc1ccccc1)c1cnn(C)c1	796579070	OXDIMRLMZQEGEN-SFHVURJKSA-N	431.493	1.692	50	20	IDGD	
C=CCNC(=S)NNC(=O)[C@H](CCS(C)(=O)=O)Cc1cccc(Br)c1	798305410	OGNBSJOBCCZOTJ-CYBMUJFWSA-N	448.408	1.724	50	20	IDGD	
O=C(Cn1ncn2nccc2c1=O)NNc1c(Br)cccc1Br	801501352	NTEVSOMOKJMIPK-UHFFFAOYSA-N	442.071	1.559	50	20	IDGD	
CN(C)C(=O)Cn1cc(C(=O)NNC(=O)Nc2c(Cl)cc(Cl)cc2Cl)nn1	802069799	ZUVOIYUWASHBGI-UHFFFAOYSA-N	434.671	1.793	50	20	IDGD	
NC(=O)c1ccc(/C=C/C(=O)N2CCC[C@H]2C(=O)NNc2ccc3c(=O)[nH]ccc3c2)cc1	803430887	NJBOAFSYPCOLBP-JOCSGSGBSA-N	445.479	1.775	50	20	IDGD	
O=C(COCc1cccnc1)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	805152312	RJJOCPJUWHMRJR-UHFFFAOYSA-N	443.463	1.818	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccc(Cl)cc2OCC(F)F)n1	806975208	QQTHYXJCNQYION-UHFFFAOYSA-N	429.811	1.583	50	20	IDGD	
COCCN(C)NC(=O)CCc1nc2cc(S(=O)(=O)N3CCCCC3)ccc2n1C	808073714	OYQAFUCEKDOFQO-UHFFFAOYSA-N	437.566	1.290	50	20	IDGD	
COC[C@]1(C(=O)NNC(=O)COc2ccccc2OC)CCN(C(=O)OC(C)(C)C)C1	809933692	QTGVWKOGHGMLBS-NRFANRHFSA-N	437.493	1.495	50	20	IDGD	
COC(=O)c1ccc(Cl)c(C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)c1	809979795	BQJQRDGAEYZAGY-UHFFFAOYSA-N	438.893	1.803	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)CNS(=O)(=O)c3c(F)cccc3F)n[nH]2)cc1	810147312	IYAVRDBBTWGZRT-UHFFFAOYSA-N	449.439	1.403	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2O1)C(=O)Nc1ccc(Br)c([N+](=O)[O-])c1	810386970	ZICAUPXXWSAELA-CQSZACIVSA-N	449.217	1.447	50	20	IDGD	
Cc1ccc(S(=O)(=O)NC2CC2)cc1C(=O)NNC(=O)Cn1cnc2ccccc21	811955936	IINCSYIBMPETJS-UHFFFAOYSA-N	427.486	1.247	50	20	IDGD	
COc1ccc(N2C[C@H](C(=O)NNc3ccc(S(=O)(=O)N(C)C)cc3)CC2=O)cc1	812731761	TVOGQOWAEFXCJS-CQSZACIVSA-N	432.502	1.442	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)cnn1-c1ccccc1	813033069	CXUFOMKPGGRBAY-UHFFFAOYSA-N	442.501	1.513	50	20	IDGD	
CCOc1ccc(NNC(=O)C(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)cc1	815814920	CEFVUCAISUAICM-UHFFFAOYSA-N	432.502	1.402	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(Cl)s1)NNC(=S)NCCc1cccs1	819427987	YORGTJZEISUUOI-UHFFFAOYSA-N	439.009	1.479	50	20	IDGD	
Cc1cc(Br)c(S(=O)(=O)N2CC[C@H](B(O)O)C2)c(Br)c1	864231726	RAZBRAXZFRSFMQ-QMMMGPOBSA-N	426.923	1.757	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)CCc1c(C)nn(CCC#N)c1C	883990612	VGNVBFYDOQOMHM-UHFFFAOYSA-N	445.549	1.409	50	20	IDGD	
C=CCNC(=S)NNC(=O)c1cccc(S(=O)(=O)Nc2ccc3c(c2)OCO3)c1	913435782	SBYOLLWLYUOGQC-UHFFFAOYSA-N	434.499	1.511	50	20	IDGD	
C[C@H]1CN(c2ccc(C(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)cn2)C[C@@H](C)O1	914877313	SAMBWZAPBJGBEF-OKILXGFUSA-N	436.472	1.017	50	20	IDGD	
CCCNC(=O)CN1CCC(NC(=O)NNC(=O)CCSc2ccc(F)cc2)CC1	916518652	BGIRIUJFQYKBNI-UHFFFAOYSA-N	439.557	1.629	50	20	IDGD	
C[C@@H](c1nc(-c2ccccc2)no1)N1CCN(CC(=O)NNC(=O)c2cccs2)CC1	917112060	CXEGVTKGDOHZDG-HNNXBMFYSA-N	440.529	1.938	50	20	IDGD	
CC(C)NC(=O)C(=O)NNC(=O)Cc1csc(-c2cc(Br)cs2)n1	917622043	HINCYLVDFSBRPH-UHFFFAOYSA-N	431.337	1.849	50	20	IDGD	
CC(=O)Nc1ccc(F)c(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)c1	919690607	QMCLNPHNDBHFPQ-UHFFFAOYSA-N	428.829	1.160	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)c(C)n1CCC(C)C	919889005	KDOZBIAZSOCIMD-BHEJFATLSA-N	435.550	1.576	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NN=Cc2cc3c(cc2[N+](=O)[O-])OCCO3)c1	920363163	UIUKKHHTXUCINI-UHFFFAOYSA-N	434.430	1.380	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)NCc2cc(C)on2)cc1	920850831	KBIGTZKICMKCMQ-MHWRWJLKSA-N	434.456	1.954	50	20	IDGD	
COc1ccc(C(=O)CNC(=O)CCC(=O)NNC(=O)c2cncn2-c2ccccc2)cc1	1318169772	IADMDZTZEVCVFV-UHFFFAOYSA-N	449.467	1.421	50	20	IDGD	
C[C@@H]1C[C@@H](C)CC2(C1)NC(=O)N(CC(=O)NNC(=O)c1cncn1-c1ccccc1)C2=O	1319504489	IAWFBTMZNUVDDQ-HUUCEWRRSA-N	438.488	1.380	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@@H](c2ccccc2)c2cnn(C)c2)c2ccccc2c1=O	1320206226	WZYUTNLFEGHFCY-IBGZPJMESA-N	445.483	1.884	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4nonc4c3)C2)C1	1777718608	BZDJFCJRJKXQIJ-QZTJIDSGSA-N	427.288	1.903	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3c(Cl)ccc4c3OCO4)C2)C1	1777802829	BYNAYMVYWCQQBY-ORAYPTAESA-N	445.299	1.766	50	20	IDGD	
C[C@@H]1CCc2c(C(=O)N3CC[C@]4(CN(C(=O)CCBr)CCO4)C3)n[nH]c21	1777850294	LHJSIUHPTJNOOT-XIKOKIGWSA-N	425.327	1.688	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3nn(C)c4c3CCC4)C2)C1	1777963940	ALMIGGUQNJHFRT-LIRRHRJNSA-N	439.354	1.526	50	20	IDGD	
O=C(/C=N/O[C@H]1CCCCO1)N1CC[C@@]2(C1)CN(C(=O)CCBr)CCO2	1779101146	KHCCEJFXVDVQOK-XOKFLVCFSA-N	432.315	1.130	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)N1CCO[C@]2(CCN(C(=O)CO[Si](C)(C)C)C2)C1	1779301026	GVLUKAIUWLXEEP-IBGZPJMESA-N	429.590	1.193	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)CC34CCCN3CCC4)C2)C1	1781130561	BGCDSAHTUBTCND-OXQOHEQNSA-N	442.398	1.866	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H]1CCNC(=O)C1)C2	1781905658	SSILMHGMEJGNAO-NXEZDXNNSA-N	444.370	1.200	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1c(C)n[nH]c1C)C2	1782179771	UGUMPVALYQADLH-MBOZVWFJSA-N	426.945	1.337	50	20	IDGD	
C[C@@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C(Cl)Cl)C1)n1ccccc1=O	1782218052	OEVKVMNRWBBBMX-IQUTYRLHSA-N	430.332	1.727	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)Cc3cnc4ccccn34)CCO2)C1	1783341891	FFCMCBSOMQTFIM-OXJNMPFZSA-N	449.349	1.880	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3c(F)c(C)nn3C)CCO2)C1	1783343114	FNAZPYPJYISEFV-YVEFUNNKSA-N	431.306	1.485	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)N1CC[C@@]2(CN(C(=O)[C@@H](F)Cl)CCO2)C1	1783576441	MJWXWNUTUHPYJY-LPMFXHHGSA-N	433.908	1.750	50	20	IDGD	
CC(C)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3ON=C(c4ccccc4)O3)C[C@@H]21	1783852211	UQDLYVAHUBNCGG-BOSXTWCSSA-N	449.935	1.966	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H]3CCC[C@H](C(=O)OC)C3)C2)C1	1783869888	XDHUXPBJDMBLHO-ULMVMLMRSA-N	430.929	1.050	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)COc3ccc(Cl)c(F)c3)CCO2)C1	1783871782	VNKAZACHCFFBKS-DNVCBOLYSA-N	449.306	1.942	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3[C@H]4C=CS[C@H]43)C[C@@H]21	1783975119	ZYLGLLLICLTHCU-RMCMBSFLSA-N	429.380	1.872	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3cnc4ccccn34)[C@H]2C1	1784047553	JANPCMYSFZNTHR-WDSOQIARSA-N	444.608	1.708	50	20	IDGD	
COc1cc(Cl)ccc1CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]2C1	1784094814	STRBMLXXQOCFAI-MBGYTDRXSA-N	445.343	1.471	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cn3nc(C)cc3C)[C@H]2C1	1785343053	PBECALHVDQUCFK-QAETUUGQSA-N	441.370	1.653	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H]3CCCSC3)C2)C1	1785473137	NWRGVLOKHIQJJA-IAXJDVGUSA-N	447.561	1.094	50	20	IDGD	
C[C@@H](NC(=O)c1ccccc1)C(=O)N1CC[C@]2(CN(C(=O)C(Cl)Cl)CCO2)C1	1785561421	KUINSQNEAKCOEQ-BFUOFWGJSA-N	428.316	1.439	50	20	IDGD	
CCOC(=O)C1(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCBr)[C@H]3C2)CC1	1786407086	FSDJIGCEUIMYNW-IHRRRGAJSA-N	431.327	1.094	50	20	IDGD	
COc1ncccc1C(=O)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1	1787358832	AMEQNNIATKIRDH-UHFFFAOYSA-N	445.284	1.832	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)c1ccc2cc(O)ccc2n1	1787867031	YRQSDRDPSDOJPR-JOQQVMPUSA-N	433.892	1.133	50	20	IDGD	
O=C(CCc1cnccn1)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1	1788145096	FXQCOBCGJJSCFH-UHFFFAOYSA-N	444.300	1.537	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(-n4cccn4)nc3)C[C@@H]21	1789863332	NCOADVBSWIDNIP-FJIDUMEYSA-N	431.924	1.878	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3nc4ccc(F)cn4n3)[C@H]2C1	1790526854	ILIQKGAMPNNZLY-TUUVXOQKSA-N	437.903	1.869	50	20	IDGD	
O=C(C[C@H]1NC(=O)NC1=O)NC1(c2ccc(NC(=O)[C@@H](F)Br)cc2)CCC1	1790532883	WKPWNNZVXZDNCC-DGCLKSJQSA-N	441.257	1.409	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)Cn3cccn3)C[C@@H]21	1791056962	JFRFYEPNDVRZHL-QXKUPLGCSA-N	427.343	1.282	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc4c3OCC4)C[C@@H]21	1791057143	DXJOGKILQDDROM-QCPWZWHMSA-N	437.334	1.998	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4cccnn4c3)C[C@@H]21	1791063676	PEZYTNNZABPNRP-PYTWLRIVSA-N	435.322	1.711	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCOCCOCCOC)[C@H]2C1	1791132530	QQNYVFDLQRHXPY-VJANTYMQSA-N	448.988	1.443	50	20	IDGD	
Cc1c(Br)c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](O)CCl)nn1C	1793113558	NRSQYHLCUGXHMQ-WRWGMCAJSA-N	433.734	1.343	50	20	IDGD	
Cc1nc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](C)CBr)C3)c(=O)[nH]c1C	1794609673	KYFIIEZNTZSHIX-WBMYTEFPSA-N	425.327	1.670	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)COCc1ccccc1	1795422798	HJUKRBRYQFIRNF-VYCZESIESA-N	439.350	1.824	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)c1cc(O)nc2ccccc12	1796189029	NRJGELSANWZWLV-BCDXTJNWSA-N	445.284	1.186	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1cc(F)cc(F)c1)c1cccc(B(O)O)c1	1796280498	LKHVVHDLMRXWHV-ACDBMABISA-N	428.244	1.139	50	20	IDGD	
C[C@@H]1CCc2c(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@@](C)(Cl)CCl)C4)n[nH]c21	1796972415	SHPBDTGQHCYHMT-RFKGOXMFSA-N	429.348	1.899	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2c(cnn2C)c1	1797085643	DLSNKOZUNQCJSS-DFGXFYAUSA-N	449.349	1.950	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cncc2cnccc12	1798458727	WBKNZFALPXDBQG-CWPLJXCYSA-N	428.565	1.685	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccccc1C(=O)OCCO	1798565598	RTTNDKQGONSFTB-LTCOOKNTSA-N	438.908	1.056	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccn2nccc12	1799974025	BDLCTTKHVQSKQQ-IARIHHJXSA-N	435.322	1.711	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnn3cccc(F)c13)C2	1800761981	LHKKYEITOZRNCP-OHTBPHCPSA-N	439.285	1.460	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Oc1cccnc1)C2	1800762891	JITNZMGHSKIRTE-QKDZRIPBSA-N	426.311	1.222	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2nn[nH]c2C(F)(F)F)[C@H]1c1cccnc1)[C@H](O)CCl	1803140562	GUOFNTAOWADTIM-LOWVWBTDSA-N	446.817	1.138	50	20	IDGD	
O=C([C@H](F)Cl)N1CC[C@H](CNC(=O)C(F)(F)C(F)(F)C(=O)O)[C@@H]1c1cccnc1	1804042158	GZZSLZPHXALDFQ-VWYCJHECSA-N	443.756	1.977	50	20	IDGD	
Cc1occc1C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1805615384	LCARKUCXAHWFAH-NQIIRXRSSA-N	433.273	1.296	50	20	IDGD	
O=C(CC12CCCN1CCC2)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1	1808020709	BEMKTLXTVAIEBO-CMKODMSKSA-N	434.968	1.706	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)c1cccc2[nH]ncc12	1808027473	OTQSQAHTHRHXNH-KYNGSXCRSA-N	427.892	1.877	50	20	IDGD	
N[C@@H](Cc1cccnc1)C(=O)NC[C@@H]1CCN(C(=O)C(Cl)Cl)[C@@H]1c1cccnc1	1808365686	WRQOUMKFCCTMDV-YESZJQIVSA-N	436.343	1.856	50	20	IDGD	
Cn1ccc(CC(=O)N2CC[C@H](CNC(=O)[C@H](F)Br)[C@@H]2c2cccnc2)n1	1808661244	HMIKUPPYTUCDKG-COXVUDFISA-N	438.301	1.754	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)Cc2cnccn2)[C@@H]1c1cccnc1	1812864967	YWQRYWSUFXJSIX-JCKWVBRZSA-N	432.322	1.904	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2cccc(=O)n2O)[C@@H]1c1cccnc1	1813029504	ODMGEIYPSKFOHY-RLFYNMQTSA-N	434.880	1.054	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)/C=C\C(=O)NC2CC2)[C@@H]1c1cccnc1	1813030557	DEVYBKQGUVOZHY-PWCCKZLBSA-N	434.924	1.176	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2ccc(F)cn2)[C@@H]1c1cccnc1	1813070023	DGACRPZHXXRNNG-HRAATJIYSA-N	442.495	1.308	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@H]1CCc2nc(NC(=O)CC3CC3)sc2C1	1814255791	OSHOVELUOCXGDD-BTIIEKFUSA-N	428.518	1.989	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)Cn2nnc3ccccc32)[nH]n1)[C@@H](O)CCl	1814867955	SJOQCBOGOBKCCX-ZBFHGGJFSA-N	431.884	1.446	50	20	IDGD	
Cc1cc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)cn1C	1815340046	CLCBNDZCMUMTQF-MRXNPFEDSA-N	438.318	1.009	50	20	IDGD	
Cc1cccnc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1	1815400132	RFQHAZLUMGQRBE-MRXNPFEDSA-N	427.509	1.792	50	20	IDGD	
COC(=O)[C@H]1CC[C@H](C(=O)Nc2cc([C@@H]3CCCCN3C(=O)[C@@H](O)CCl)[nH]n2)CC1	1815465318	FNDABNNDDBHLFM-SDADXPQNSA-N	440.928	1.981	50	20	IDGD	
Nc1n[nH]c(CCC(=O)N2CCCC[C@H]2c2cc(NC(=O)CCBr)n[nH]2)n1	1816781549	CCBUBYCVJLXCTD-NSHDSACASA-N	439.318	1.520	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)c3cnc(O)nc3O)sc2C1	1817090093	SXGCFJORPCJOBW-RQJHMYQMSA-N	442.295	1.354	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)CCBr)[nH]n1)c1ccc(B(O)O)cc1	1817471278	KKZQWOVUEINGCV-OAHLLOKOSA-N	449.114	1.180	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)CCN3CCOC3=O)sc2C1	1818697160	NIICVSSFNPABQQ-WDEREUQCSA-N	430.914	1.151	50	20	IDGD	
Cn1cccc1C(=O)N[C@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1	1819795130	IGXXZGIXIJUPFX-NSHDSACASA-N	439.501	1.020	50	20	IDGD	
CC(C)n1ccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)n1	1820338899	HAEDMTXCUMJELH-QGZVFWFLSA-N	444.540	1.866	50	20	IDGD	
O=C(Cn1ccncc1=O)Nc1cc([C@@H]2CCCCN2C(=O)CCBr)[nH]n1	1821654850	VCYKMXGDXYIGDX-ZDUSSCGKSA-N	437.298	1.444	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)COc2ccc(O)nn2)[nH]n1	1822376629	NROSBSBYIWBHFG-YPMHNXCESA-N	438.872	1.230	50	20	IDGD	
CC(C)=CCCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(B(O)O)cc1)CC2	1822730889	PVVVBSWHNWUQRU-INIZCTEOSA-N	427.335	1.795	50	20	IDGD	
O=C(N[C@@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1)c1cc(O)nc(O)c1	1823003379	ILTMEPXELZKPPK-JMCQJSRRSA-N	445.270	1.866	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)CCc2cnc[nH]2)CC1	1825137121	CXNYCBGCTNZYCI-LJQANCHMSA-N	432.569	1.335	50	20	IDGD	
C[C@@H](C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCC(=O)NN(C)C)CC2)n1cccc1	1826599746	PEBUXZHBJGQIQC-UONOGXRCSA-N	432.550	1.491	50	20	IDGD	
C=C[C@@H](O)C(C)(C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1	1828882949	TTYWFHHAUXATKS-LEWJYISDSA-N	442.365	1.173	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H](O)c3ccco3)CCO2)C1	1829828270	BSAWWUSBCOKSMI-WBAXXEDZSA-N	435.304	1.006	50	20	IDGD	
O=C(/C=C/c1cc2ccccc2o1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1830730895	GMUJISIVEDSQNB-JNQOSRSFSA-N	448.903	1.502	50	20	IDGD	
C[Si](C)(C)C#CCCCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1830731594	MTODHJWHIBPDLF-YLJYHZDGSA-N	445.032	1.094	50	20	IDGD	
CC(C)[C@H](S)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1831492893	OKGINIFPCPYJTI-HUBLWGQQSA-N	427.336	1.088	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(F)c[nH]2)CC1	1831708852	UHZXZMVAPHPLLK-LJQANCHMSA-N	442.495	1.699	50	20	IDGD	
Cc1ccc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)cn1	1831871414	DXNPEIPPKYTDFO-FQEVSTJZSA-N	429.565	1.996	50	20	IDGD	
COc1nn(C)cc1C(=O)N1CCC([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1	1831871424	FESKNTAKOQAXMM-GOSISDBHSA-N	448.568	1.035	50	20	IDGD	
Cc1noc(C)c1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)Br)C2)C1	1834067910	AHJXYPROEHKGBY-DIFFPNOSSA-N	430.299	1.145	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)CBr)C3)C2)on1	1834218247	SMQNLBRXJIACEQ-SJKOYZFVSA-N	430.299	1.084	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCC(OC2CCN(C(=O)[C@H]3CCNC(=O)C3)CC2)CC1	1838637964	LVURUEPLKHQLPV-XOBRGWDASA-N	448.391	1.748	50	20	IDGD	
CC(C)n1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCBr)C3)C2)n1	1838783560	DXTBIZRLXMJNAL-GOSISDBHSA-N	443.342	1.319	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccccc3-n3nccn3)CCO2)C1	1839381404	RMDBNHLKEHZAQP-LAUBAEHRSA-N	447.923	1.355	50	20	IDGD	
O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1[C@H]3SC=C[C@H]31)CCO2	1839696715	UYXUKHPYQMJULU-GUSZCTEKSA-N	431.352	1.103	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3nc(C)sc3C)C2)C1	1840150868	SIHWPYUJULJDBK-KXBFYZLASA-N	445.969	1.013	50	20	IDGD	
C=CCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)C1	1840171985	KORDEJXQPKREEU-YWZLYKJASA-N	445.944	1.151	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(OC)c3F)CCO2)C1	1840794753	UEZGSJGOHQTQGV-QRWLVFNGSA-N	444.887	1.158	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)C3CCSCC3)CCO2)C1	1840926320	JJZQTBMROVLDIW-CXAGYDPISA-N	435.384	1.369	50	20	IDGD	
O=C(c1cnn2c(-c3cccs3)ccnc12)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1	1841351044	JSOBBLLVUXIKJU-OAHLLOKOSA-N	445.932	1.875	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)C23CCC(C(=O)OC)(CC2)CC3)C1	1843943224	PFSLFXZGITVDJM-VMEOHVCESA-N	426.941	1.957	50	20	IDGD	
Cc1cc(C(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)nc2ccccc12	1844264487	YBEZFWLOCDINCT-UHFFFAOYSA-N	444.495	1.673	50	20	IDGD	
C[C@H](Br)C(=O)N1CC2(CCCN2C(=O)[C@@H](C)NC(=O)c2ccc(F)cc2)C1	1845004504	POWXTESTGCCKTK-QWHCGFSZSA-N	440.313	1.931	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)(C)O)C2	1845168547	LVAIRTPWKPYMEL-ZIAGYGMSSA-N	431.961	1.871	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC12CN(C(=O)[C@@H](C)NC(=O)c1ccc(F)cc1)C2	1846178473	ZPFQXJUMPFFQIW-CHWSQXEVSA-N	440.313	1.931	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@H]1COCCN1C(=O)OC(C)(C)C)C2	1846362001	BGUHGRALANBGHW-GJZGRUSLSA-N	445.944	1.080	50	20	IDGD	
C[C@H]1[C@@H](C(=O)N2CCCC23CN(C(=O)[C@@H](O)CCl)C3)CCN1C(=O)OC(C)(C)C	1847158639	ZQUBUSVONHKKHB-KKUMJFAQSA-N	429.945	1.435	50	20	IDGD	
Cc1cc(Br)c(N)cc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl	1847558355	JTKANBWZPMRGTE-SOUVJXGZSA-N	430.730	1.755	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@]2(C(=O)N3CC[C@H]4[C@@H]3CCN4C(=O)[C@@H](O)CCl)C[C@H]2C1	1847563075	MINRKPCMHGXPEW-GVZUZGFXSA-N	441.956	1.435	50	20	IDGD	
O=C(NNC(=O)C1CC1)c1cc(S(=O)(=O)N2CCCCC2)ccc1Br	15794095	XYKQPPVVSVZSSO-UHFFFAOYSA-N	430.324	1.795	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccc(C(=O)OCC(=O)NNC(=O)c2ccccc2)cc1	24202531	PMXNXNRFQOGAIZ-UHFFFAOYSA-N	433.486	1.381	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(\C#N)C(=O)N2CCN(CC(=O)NC(C)C)CC2)c1C	207243349	QSNWVLKBTZDFRB-IUOVYFEOSA-N	429.565	1.888	50	20	IDGD	
O=C(COC(=O)/C=C\c1ccc([N+](=O)[O-])cc1)NNC(=O)[C@@H]1COc2ccccc2O1	212302581	INWJYDBGYGCWFH-JEZWAEDTSA-N	427.369	1.139	50	20	IDGD	
C[C@H](C(=O)NNC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1)N1C(=O)CCC1=O	727723496	PSTYTGAMYNWVDB-CQSZACIVSA-N	432.440	1.233	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)COc1ccc(Br)cc1)[C@@H](C)N1CCOCC1	729624501	XIWHDWIANWLHMP-CHWSQXEVSA-N	429.315	1.268	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCN(c2ccc3c(c2)OCCO3)C1=O)c1cccc(OC(F)F)c1	730545536	JDGOLQFUCXZALX-HNNXBMFYSA-N	447.394	1.873	50	20	IDGD	
N#C/C(=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)N1CCS(=O)CC1	731008210	MWCPBOAWYPSSHC-RVDMUPIBSA-N	445.932	1.577	50	20	IDGD	
CC(C)(C(=O)NNS(=O)(=O)c1cccc(S(=O)(=O)NC2CC2)c1)c1ccccc1	731177359	CTPUPHMQQCSYFA-UHFFFAOYSA-N	437.543	1.415	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)[C@H]2CCCN(C(=O)c3ccccc3)C2)n1	731273520	GDTQPKLRPTVAIK-INIZCTEOSA-N	444.513	1.237	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)N[C@H]1CCN(c2ccccc2C(N)=O)C1	732575768	JRCIPIKNQCNRNZ-ZDUSSCGKSA-N	431.880	1.670	50	20	IDGD	
COc1cccc(/C=C(\C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)n2nnnc2C)c1	733110462	MMDSUTHZWKAZCZ-UDWIEESQSA-N	444.455	1.635	50	20	IDGD	
Cc1c(C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)nnn1-c1ccccc1Cl	734242116	UBIHERZDINZSQF-UHFFFAOYSA-N	437.888	1.698	50	20	IDGD	
Cc1cc(NNC(=O)CCNS(=O)(=O)c2cn(C)c(C)n2)ccc1Br	734252694	BPIBZMDTJKTQKR-UHFFFAOYSA-N	430.328	1.611	50	20	IDGD	
C[C@@H](NC(=O)NNc1ccc(S(=O)(=O)NC2CCCCCCC2)cn1)C(=O)N(C)C	735580693	WRDZJMNHTHRXQP-CQSZACIVSA-N	440.570	1.576	50	20	IDGD	
C[C@H]1CCCN(S(=O)(=O)c2cc(C(=O)NNC(=O)COCc3ccccc3)n(C)c2)C1	737634425	CZPVUWOVWYEIOU-INIZCTEOSA-N	448.545	1.424	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CN(C)CCN2CCN(C(=O)OC(C)(C)C)CC2)cc1	738329107	LHSRFFUBSZAMBB-UHFFFAOYSA-N	433.553	1.241	50	20	IDGD	
CN(CCN1CCN(c2ccccc2)CC1)CC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	738341421	PPCPXAWPDFKJOY-UHFFFAOYSA-N	440.504	1.110	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2coc(-c3ccccc3)n2)cc1OC	738841550	NBXDJGLMVIQZCJ-UHFFFAOYSA-N	425.397	1.977	50	20	IDGD	
O=C(NNC(=O)c1cccc(F)c1Cl)c1cccc(S(=O)(=O)N2CCOCC2)c1	742465078	BVTFZIXLZUKJIG-UHFFFAOYSA-N	441.868	1.575	50	20	IDGD	
O=C(CNC(=O)c1cc2ccccc2[nH]1)NNc1ccc(S(=O)(=O)NC2CC2)cc1	742619333	SBYLEUFLJIJZFE-UHFFFAOYSA-N	427.486	1.482	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)CN(C)C(C)C)c1	742782192	OVXBMZWZXBQZLG-UHFFFAOYSA-N	434.518	1.597	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)N[C@@H]1CC(=O)N([C@H]2C[C@H]2c2ccccc2)C1	743510502	XIRFKCKFCGCHGA-RYRKJORJSA-N	426.448	1.692	50	20	IDGD	
CNS(=O)(=O)c1ccc(C(=O)NNC(=O)Nc2cc(Cl)c(OC)cc2OC)o1	743834759	SGWWCNOGEFFPDF-UHFFFAOYSA-N	432.842	1.325	50	20	IDGD	
COc1ccccc1O[C@H](C)CNC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	745901524	LNMFEEKGKFBXPU-CYBMUJFWSA-N	425.445	1.354	50	20	IDGD	
CC(C)(C)NS(=O)(=O)Cc1cccc(C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c1	746385406	BNYJMRPJXAXNNF-UHFFFAOYSA-N	434.474	1.888	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NCC(=O)NNc2cc(F)c(F)c(F)c2)c1	746709392	IQLZRHYWBFNGOA-UHFFFAOYSA-N	430.408	1.227	50	20	IDGD	
C[C@H](NC(=O)c1ccc(Cl)cc1)C(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	748127119	SJPFPEUPBOQELO-NSHDSACASA-N	448.819	1.371	50	20	IDGD	
Cc1ccc(C)c(NNC(=O)[C@@H](CCS(C)(=O)=O)NS(=O)(=O)c2ccccc2)c1	748413238	WBZZBWFXCORPPG-QGZVFWFLSA-N	439.559	1.528	50	20	IDGD	
CC(C)Cn1[nH]c(CC(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)cc1=O	751205815	XQEMCSVETFLCGK-UHFFFAOYSA-N	426.477	1.127	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)COc1ccc(Br)cc1F	751210886	JZIIJSVMTLIRKL-UHFFFAOYSA-N	430.255	1.606	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2c[nH]c(C(=O)O)c2)ccc1OCCC(C)C	751263700	NRQCQDQXAJFDOR-UHFFFAOYSA-N	425.463	1.770	50	20	IDGD	
COc1cc(OC)cc(N2C[C@H](C(=O)NNC(=S)Nc3ccc(OC)nc3)CC2=O)c1	752521520	PGPHCVWSMWLAOJ-GFCCVEGCSA-N	445.501	1.478	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCc1ccc([S@](C)=O)cc1	753051490	OPOMULCBPGDSQZ-LJAQVGFWSA-N	437.547	1.170	50	20	IDGD	
CC[C@@H](CNC(=O)NNC(=O)c1csc(N2CCOCC2)n1)Oc1cccc(F)c1	753345902	GDSHCSJAVOMFMT-AWEZNQCLSA-N	437.497	1.920	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)Nc1ncc(Cc2ccc(F)c(F)c2)s1	755477634	LNVJTWRTMXDVQG-SNVBAGLBSA-N	430.458	1.600	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CN(C)C(=O)OCc2ccccc2)cc(OC)c1OC	756407376	IYNAIQIXELEKES-UHFFFAOYSA-N	431.445	1.742	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@H](C)C(=O)NNC(=O)Nc1cnn(CC(=O)N(C)C)c1	756796054	ISVULKVLSWYTFZ-CYBMUJFWSA-N	436.900	1.862	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)N[C@@H]2CN(C3CC3)C[C@@H]2C)c2ccccc2c1=O	757789629	IUMJWCLYYOQVMY-KBXCAEBGSA-N	426.521	1.623	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)c(I)c1)C(=O)Nc1ccccn1	758829096	BIDJGQGKVLCZLX-UHFFFAOYSA-N	444.616	1.739	50	20	IDGD	
O=C(NCCCc1ccc2c(c1)OCCO2)NNC(=O)c1csc(N2CCOCC2)n1	758832919	ATHMWTIHAYOHOB-UHFFFAOYSA-N	447.517	1.328	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@@]2(C)CCCS2)c1	758861116	KJQDVQPQORFSMQ-GOSISDBHSA-N	428.580	1.947	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)Nc2cc(N3CCCS3(=O)=O)ccc2O)cc(C#N)n1C	759702431	ILDUZDLGSGLBSN-NVNXTCNLSA-N	425.470	1.996	50	20	IDGD	
COC(=O)CS(=O)(=O)Cc1ccc(CNC(=O)NNc2cncc(Cl)n2)cc1	760198961	IVIGWUWHPRFFKD-UHFFFAOYSA-N	427.870	1.044	50	20	IDGD	
CC(C)(C)OC(=O)NC1(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)CC1	760233330	QQSDMTUATYFZCV-UHFFFAOYSA-N	431.537	1.403	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)CCNS(=O)(=O)/C=C/c1ccccc1	761632846	DWZONGLFZAVQJZ-WYMLVPIESA-N	449.554	1.915	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)NCc1ccc(S(N)(=O)=O)s1	761641994	PKPNDLVNSRXBSF-UHFFFAOYSA-N	430.533	1.027	50	20	IDGD	
C[C@@H](C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1)c1cccc([N+](=O)[O-])c1	763400561	XPYXYVZYIUDOGQ-PXAZEXFGSA-N	429.385	1.229	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)ccc1N1CCCC1=O	763442146	MBXOXQDZZZQESO-UHFFFAOYSA-N	441.400	1.130	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(F)c(Br)c1	763466773	MRVWIDUHRPMCTN-UHFFFAOYSA-N	425.170	1.896	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)NCCN1CCN(c2ccc(F)cc2)CC1	763480181	XKPCNAGXHKDOJO-UHFFFAOYSA-N	447.536	1.776	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cc3ccccc3cc2O)ccc1C(=O)N(C)C	763517388	JKVFEEKFGWOWOE-UHFFFAOYSA-N	434.452	1.955	50	20	IDGD	
CC(C)N(C)C(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)c2ccccc2O)c1	763527425	JNHZRDISLUNFFB-UHFFFAOYSA-N	432.864	1.926	50	20	IDGD	
C[C@H](Cn1ncc2ccccc2c1=O)NC(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	763549716	ZSGCNZUXFYEGAP-CQSZACIVSA-N	447.455	1.321	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)C(=O)Nc1cc(F)ccc1OC[C@H]1CCCO1	763551923	USRKGNWCZOHLQC-CQSZACIVSA-N	445.403	1.512	50	20	IDGD	
CC(=O)N(Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)cc1)C(C)C	763558934	NSWNHCXMGLWFPB-UHFFFAOYSA-N	440.456	1.572	50	20	IDGD	
CC(C)(C)c1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(S(C)(=O)=O)cc2)cc1	763600041	LZUSTGDFAOGLAR-UHFFFAOYSA-N	447.513	1.553	50	20	IDGD	
CCOC(=O)c1cc(C)sc1NC(=O)C(=O)NNC(=O)c1c(C)nc2ccccn12	763627541	BINBJFSDYGKTDJ-UHFFFAOYSA-N	429.458	1.589	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2ccc(NC(=O)C3CC3)nc2)c1	763648977	HPSTYMYWLCCPPI-UHFFFAOYSA-N	425.445	1.212	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cc3c(cc2Cl)OCCO3)cc1	763659490	OYTCOQZOZBNXPG-UHFFFAOYSA-N	435.820	1.285	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(-c2csnn2)cc1	763664202	SOECMQRJNMHXQB-UHFFFAOYSA-N	427.442	1.379	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccccc2C(C)(C)C)c1	763719463	YKAJRMREWHSYCS-UHFFFAOYSA-N	446.529	1.634	50	20	IDGD	
COC(=O)c1cc(Cl)cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)c1	763867186	SNJXUMQFDKWEKT-SNVBAGLBSA-N	437.811	1.819	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c(Br)c1	763917077	PAODVHYSBQTIDE-UHFFFAOYSA-N	444.249	1.133	50	20	IDGD	
C[C@H](c1ccc(NC(=O)C(=O)NNC(=O)Cc2ccc(F)cc2)cc1)N1CCOCC1	763919810	YTGKQWMFTMUAPB-OAHLLOKOSA-N	428.464	1.548	50	20	IDGD	
COC(=O)c1ccc(NC(=O)NNC(=O)CSc2ccccc2O)cc1C(=O)OC	763967968	MIDBGDKJHXOQCP-UHFFFAOYSA-N	433.442	1.910	50	20	IDGD	
CCOc1cc2c(cc1NC(=O)C(=O)NNC(=O)c1cccc(OC)c1O)O[C@H](C)C2	764131087	GDCXORSCKBYWKS-LLVKDONJSA-N	429.429	1.523	50	20	IDGD	
CN(C)C1CCN(c2ccc(NC(=O)C(=O)NNC(=O)CCc3ccco3)cc2)CC1	764171385	KHUCJENKPIQZCW-UHFFFAOYSA-N	427.505	1.529	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(F)ccc2OC[C@@H]2CCCO2)cc1	764177654	SIJOQKZCTJGPDR-INIZCTEOSA-N	426.404	1.655	50	20	IDGD	
O=C(CCc1ccccc1)NNC(=O)C(=O)Nc1ccc(C(=O)NCC(F)(F)F)cc1	764185987	QXUJKNRBDHRZHJ-UHFFFAOYSA-N	436.390	1.697	50	20	IDGD	
CCS(=O)(=O)c1cc(F)ccc1NC(=O)C(=O)NNC(=O)CCc1ccccc1O	764278592	RUULWYKRXYQWEA-UHFFFAOYSA-N	437.449	1.044	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(NC(=O)C(C)C)cc2)c(OC)c1	764284555	OAKQVMRICWGZJZ-UHFFFAOYSA-N	428.445	1.698	50	20	IDGD	
CCOCC(=O)NNC(=O)C(=O)Nc1cc(OCC)c(OCC)cc1Br	764320415	XNPGAMDWUJAEHH-UHFFFAOYSA-N	432.271	1.369	50	20	IDGD	
CN(C1CCCCC1)S(=O)(=O)c1cccc(NC(=O)C(=O)NNC(=O)C2CCC2)c1	764339364	REGPMGNELADZAD-UHFFFAOYSA-N	436.534	1.526	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2cccs2)[nH]n1)C(=O)Nc1ccc(Br)nc1	764376400	CXYAIWVQPJTBGA-UHFFFAOYSA-N	435.263	1.695	50	20	IDGD	
COc1ccc(C#N)cc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccc(C)c(C)c2)[nH]n1	764389189	ZHNUNDDXRIUSEY-UHFFFAOYSA-N	432.440	1.974	50	20	IDGD	
Cc1ccc(F)c(OCC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1	764544345	HGJDGTYGWJEVQK-UHFFFAOYSA-N	435.477	1.759	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)CSc1nnc(-c2ccncc2)n1Cc1ccco1	764610358	YZNKLCRQHUFEGN-UHFFFAOYSA-N	437.485	1.873	50	20	IDGD	
COCCOc1c(Cl)cc(NC(=O)C(=O)NNc2nccnc2OC)cc1Cl	766264574	MHGIMQYMCBXHHB-UHFFFAOYSA-N	430.248	1.899	50	20	IDGD	
CC(=O)Nc1ccc(NS(C)(=O)=O)c(C(=O)NNc2ccccc2S(C)(=O)=O)c1	766661493	DCABEUHSLVSVHD-UHFFFAOYSA-N	440.503	1.177	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)c1cccn(Cc2ccccc2)c1=O	767314325	ZHWGNOLHKHMKIY-UHFFFAOYSA-N	433.464	1.752	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)[C@@H]1CC(=O)N(c2ccc(F)cc2)C1	767332908	FDGAZADWTHAKJQ-MRXNPFEDSA-N	427.432	1.420	50	20	IDGD	
Cc1cc(F)ccc1-n1cc(C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)nn1	767389182	IESYRVFJTBJLEG-UHFFFAOYSA-N	430.465	1.912	50	20	IDGD	
O=C(NNS(=O)(=O)c1cncc(Cl)c1)c1cccc(S(=O)(=O)N2CCCC2)c1	768262355	JELAEDIHVGRJJB-UHFFFAOYSA-N	444.922	1.143	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCC2(CCOC)CC2)c1	769208427	KUMNQIPELQUYLK-UHFFFAOYSA-N	426.539	1.478	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)c2ccc(S(C)(=O)=O)c(Br)c2)c1	769615695	AUWJSTIAOYFCMY-UHFFFAOYSA-N	440.319	1.993	50	20	IDGD	
CCCCCCn1cc(S(=O)(=O)NNC(=O)c2cccc3ncccc23)c(O)nc1=O	769631935	DGXAVGNDUBBWJH-UHFFFAOYSA-N	445.501	1.701	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)N[C@H]1CCN(c2ccccc2C(N)=O)C1	770514659	PYYJINSWOUXNFW-ZFWWWQNUSA-N	445.907	1.816	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(C(=O)OC(C)(C)C)cc2)c1	770575604	RGVLDNHIFBGFSR-UHFFFAOYSA-N	447.513	1.967	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)[C@H]3CS[C@@]4(c5ccc(F)cc5)CCC(=O)N34)nc21	770973594	NMHWFPANYLZXAC-BFUOFWGJSA-N	443.464	1.242	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCCC(=O)O[C@@H](C)C(=O)NNC(=O)CC(C)C)cc1C	771844985	GIULYHKHDAHAKC-HNNXBMFYSA-N	427.523	1.097	50	20	IDGD	
COC(=O)[C@@H](NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)c1cccnc1	771897583	GPMFYRHFQCWCPD-SFHVURJKSA-N	432.502	1.405	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1ccc(S(=O)(=O)N2CCCC[C@@H]2C)cc1	771939429	OPYJJTYYDMNOEC-UONOGXRCSA-N	425.507	1.352	50	20	IDGD	
Cn1nc(-c2cc(F)cc(F)c2)cc1NC(=O)C(=O)NNC(=O)C1=S=C2CCCC2=C1	773522297	AKQNSGBKBIWADJ-UHFFFAOYSA-N	445.451	1.653	50	20	IDGD	
CCOc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NNC(=O)c1ccc(C)c(F)c1	773887946	CNFBHYMEQNRFQT-UHFFFAOYSA-N	430.436	1.634	50	20	IDGD	
C[C@H](OC[C@@H]1CCCCO1)C(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776201842	MHNLSPCHHDNXHU-HOTGVXAUSA-N	428.530	1.596	50	20	IDGD	
CN(NC(=O)CNC(=O)c1ccc(F)cc1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776204134	BUAAXARDKGPHPS-UHFFFAOYSA-N	437.472	1.191	50	20	IDGD	
COC(=O)N1CCC[C@@H]([C@@H](C)NC(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)C1	776241218	QGPPETGFNDQNSR-ZIAGYGMSSA-N	442.542	1.261	50	20	IDGD	
CCO[C@@H]1C[C@@H](NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)[C@@H]1Oc1ccccc1	776530991	JPUYAUSCPAJVFN-QRVBRYPASA-N	447.513	1.659	50	20	IDGD	
O=C1Nc2ccccc2C[C@@H]1CCC(=O)N1CCN(S(=O)(=O)CBr)CC1	777777116	FISPDNAADIRVRN-AWEZNQCLSA-N	444.351	1.404	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2cnn([C@@H](C)C3CC3)c2)cc1	779504375	JTPNKCSRRGBPKY-AWEZNQCLSA-N	434.522	1.636	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)CCNS(=O)(=O)c2ccc(NC(C)=O)cc2)c1	780795749	BUVMROKHXXZVRC-UHFFFAOYSA-N	434.474	1.243	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNc2nc3ccccc3s2)cc(S(C)(=O)=O)c1	782814650	SFNNGSLQSOSIOW-UHFFFAOYSA-N	448.482	1.568	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)N2C[C@@H](C(=O)N3CCCCC3)Oc3ccccc32)nc(C)n1	783324339	HVQVTYKNXAIEJC-SFHVURJKSA-N	438.488	1.343	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2ccc(N3CCSCC3)c(Cl)c2)CCS(=O)(=O)C1	783426456	HKPQSYKLBSXYJR-KRWDZBQOSA-N	446.982	1.030	50	20	IDGD	
Cc1cc(C(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)c2c(O)nn(C)c2n1	783704748	RPFRFBBBBNZKEH-UHFFFAOYSA-N	447.496	1.232	50	20	IDGD	
CCc1c(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)cnn1CC(C)C	784216106	NBFLMXIGPFYOQJ-UHFFFAOYSA-N	448.549	1.624	50	20	IDGD	
O=C(NNc1ccc(Br)cn1)C(=O)Nc1ccccc1CN1C(=O)CCC1=O	784339094	JLBRQMWVDZNNSM-UHFFFAOYSA-N	446.261	1.575	50	20	IDGD	
Cc1ccc(C(=O)NCC2CC2)cc1NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	784476216	PQZQFLYMLRPEGK-UHFFFAOYSA-N	434.460	1.577	50	20	IDGD	
C[C@H]1CN(C(=O)c2ccc(NC(=O)C(=O)NNc3cccc([N+](=O)[O-])c3)cc2)C[C@@H](C)O1	784827350	AYGJCDGUKPQKEY-OKILXGFUSA-N	441.444	1.926	50	20	IDGD	
O=C(NNc1cc(F)c(F)cc1F)C(=O)Nc1ccc(C(=O)N2CCOCC2)c(F)c1	784886931	WVPGIUIRVZCCMH-UHFFFAOYSA-N	440.353	1.797	50	20	IDGD	
CN(C)c1nccc(NNC(=O)C(=O)Nc2cc3c(cc2Br)OCCO3)n1	784970209	UHOPJZLEXSNVMR-UHFFFAOYSA-N	437.254	1.158	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)C(=O)Nc1cccc(CN2CCCCC2=O)c1	785068125	UFSYPFUECRDLSI-UHFFFAOYSA-N	448.483	1.175	50	20	IDGD	
CCS(=O)(=O)CCn1cc(C)c(NC(=O)NNC(=O)CSc2ccc(C)cc2)n1	786723139	LWIRUAMPFSEXBE-UHFFFAOYSA-N	439.563	1.880	50	20	IDGD	
N#C/C(=C\c1ccc(O)cc1)C(=O)N[C@@H]1CCCN(c2cc(N3CCOCC3)ncn2)C1	787352162	ZYDYFKVDCUQDEC-TVNWYLLRSA-N	434.500	1.711	50	20	IDGD	
CN1C[C@@H](C(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)c2ccccc2C1=O	787513461	FSEPOTVQVRRZAN-QGZVFWFLSA-N	445.520	1.492	50	20	IDGD	
CCNC(=O)Nc1ccc(C)c(NC(=O)C(=O)NNC(=O)c2cccc(N(C)C)c2)c1	787541040	JNRWEVFIBWXIAG-UHFFFAOYSA-N	426.477	1.602	50	20	IDGD	
CCC1CCC2(CC1)NC(=O)N(CC(=O)NNc1nnc(-c3ccccn3)s1)C2=O	788558535	NYZZZUJQKHDVRI-UHFFFAOYSA-N	429.506	1.934	50	20	IDGD	
NC(=O)[C@H]1CC(C(=O)NNc2nnc(-c3ccccn3)s2)=NN1c1ccc(F)cc1	788566957	OPWQADBRMQHNON-CQSZACIVSA-N	426.437	1.303	50	20	IDGD	
CC(C)Oc1cc(NC(=O)C(=O)NNC(=O)c2cccc(N(C)C)c2)ccc1C(N)=O	789733271	WXIBHUOHZDKIPN-UHFFFAOYSA-N	427.461	1.038	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)c1cc(I)ccc1O	790091473	RYPZCWIIFCRRIN-AWEZNQCLSA-N	440.193	1.598	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)C1CCC(NC(=O)C2CC2)CC1	792810996	UFMCYAXYJCKJTA-UHFFFAOYSA-N	435.550	1.134	50	20	IDGD	
Cc1cccc(N2CCN(CCC(=O)NNc3ccc(S(=O)(=O)N(C)C)cc3)CC2)c1	794732089	UWWMRMVCLVYVQV-UHFFFAOYSA-N	445.589	1.901	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C[C@H]1COCCN1C(=O)OC(C)(C)C	795168219	JYSXFTDLZQVFSB-AWEZNQCLSA-N	442.538	1.406	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)cc1OC	796992572	SNTDMDNHPWYDRY-UHFFFAOYSA-N	437.412	1.272	50	20	IDGD	
Cn1cc(-c2cc(F)ccc2NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)cn1	796999657	SEEJRHJLWKTVEF-UHFFFAOYSA-N	439.403	1.397	50	20	IDGD	
COc1ccccc1-n1nccc1C=NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	797401288	GYAFEVGSRIQTRA-UHFFFAOYSA-N	446.511	1.789	50	20	IDGD	
Cc1ccc(N2CCOCC2)cc1NC(=O)C(=O)NNC(=O)COc1ccc(F)cc1	797536288	YYWZFBGDODMSDO-UHFFFAOYSA-N	430.436	1.136	50	20	IDGD	
C[C@@H](NC(=O)CCc1ccccc1)C(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	799424889	QULAKDYNCUGORH-CQSZACIVSA-N	430.892	1.241	50	20	IDGD	
CC(C)[C@H](C(=O)NNc1cc([N+](=O)[O-])ccc1Br)N1CCCS1(=O)=O	800620728	ATWKWLYCPIIFFP-CYBMUJFWSA-N	435.300	1.861	50	20	IDGD	
Cc1ccc(F)c(-n2cc(O)c(C(=O)OCC(=O)NNC(=O)Cc3ccccc3C)n2)c1	801416695	LCMHMCJVILUHKV-UHFFFAOYSA-N	440.431	1.881	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)Cc2ccnc(O)c2Br)cc1	802067471	FHWBCHNELKHRGX-UHFFFAOYSA-N	443.279	1.349	50	20	IDGD	
O=C(Cc1nc(-c2ccccc2)cs1)NNC(=O)CN1C(=O)[C@@H]2[C@@H](C1=O)[C@H]1C=C[C@H]2C1	802577950	XWJSMPLZMJVQEO-FEBSWUBLSA-N	436.493	1.307	50	20	IDGD	
COC(=O)c1cn(CCNC(=O)/C(C#N)=C\c2cc(C)n(C[C@H]3CCCO3)c2C)nn1	803644189	VDIBDXKYHSOTQF-DAIOKFOQSA-N	426.477	1.385	50	20	IDGD	
N#Cc1ccc(N2CC[C@H](C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)C2)c(F)c1	804347309	CYZNEHGMTILREC-KRWDZBQOSA-N	437.479	1.378	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1cccc2cc(Br)cnc12	806561886	CKKZZLXTAQHKFJ-MRVPVSSYSA-N	430.284	1.088	50	20	IDGD	
O=C1COC[C@H](C[C@H]2CN(C(=O)C(=O)NNc3cccc([N+](=O)[O-])c3)c3ccccc32)N1	806968183	ALVLPTFVYXTNAT-ZFWWWQNUSA-N	439.428	1.073	50	20	IDGD	
O=C(CN1CCCc2ccccc21)NNC(=O)C(=O)Nc1nc2c(s1)CSCC2	806973478	CVADDDVSAJMHDY-UHFFFAOYSA-N	431.543	1.471	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2ccc(OCCC(C)C)c(OC)c2)ccn1	806975917	UPYPPFWMBBFTSY-UHFFFAOYSA-N	430.461	1.923	50	20	IDGD	
O=C(NCCC1(O)CCC1)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	807265536	FDRGRGSVCDQPPC-UHFFFAOYSA-N	438.531	1.798	50	20	IDGD	
CCOC(=O)c1cc(S(=O)(=O)NNC(=O)c2cccn2C)cc(Br)c1C	811680827	XUSSRGNSRYRYAR-UHFFFAOYSA-N	444.307	1.896	50	20	IDGD	
CC(C)N(C)C[C@H](C)NC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	812512062	CBAVEKGWDZCPSU-HNNXBMFYSA-N	425.555	1.144	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)Cn2nc(-c3ccccc3)ccc2=O)cc1	812729751	SUCIUAUWWJQYIU-UHFFFAOYSA-N	427.486	1.304	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)COc1ccc(C#N)cc1)c1ccc(N2CCCNC2=O)cc1	813240514	SKVGQPDTICZFJP-HNNXBMFYSA-N	436.472	1.948	50	20	IDGD	
COC[C@@]1(C(=O)NNC(=O)C(=O)Nc2ccc(C)cc2)CCN(C(=O)OC(C)(C)C)C1	813374126	UGRLKUFTAPUTRV-OAQYLSRUSA-N	434.493	1.355	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)C1CCC(OC[C@@H]2CCCO2)CC1	815346656	LSSPTGSHFBLCBK-UUKMXZOPSA-N	432.517	1.983	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)C(=O)Nc1ccc([C@H]2CCOC2)cc1	815595136	IOQDLAHSKBBSFF-HNNXBMFYSA-N	444.513	1.713	50	20	IDGD	
CCOc1ccc(NNC(=O)C(=O)Nc2cc(S(=O)(=O)N(C)C)ccc2OC)cc1	815814878	AMKJCEFXAFGILT-UHFFFAOYSA-N	436.490	1.426	50	20	IDGD	
COCc1cc(NC(=O)C(=O)NNc2cc(C(=O)OC)ccc2Br)ncn1	815866222	UDKJXUJZKDILOW-UHFFFAOYSA-N	438.238	1.254	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)Cc1ccc(F)cc1)N1C(=O)c2ccc(Br)cc2C1=O	894432459	MBRJMYGHICJEPY-JTQLQIEISA-N	448.248	1.963	50	20	IDGD	
CCn1c(=O)nc(O)c2c(C(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)cc(C3CC3)nc21	913962205	KAXPYBDPMKLGSV-UHFFFAOYSA-N	438.400	1.377	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN1C(=O)c1cc(Cl)cc(Cl)c1)[C@@H]1CCS(=O)(=O)C1	914719755	PQVIXLPIFLOLOD-YGRLFVJLSA-N	448.328	1.180	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)c2cc(S(N)(=O)=O)ccc2Br)cc1	915773969	CNMYFFMZCBVMHG-UHFFFAOYSA-N	442.291	1.245	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NC[C@H]2CN(Cc3ccccc3)CCO2)cc1	915894070	HBXBYUUQYCRHJH-FQEVSTJZSA-N	428.489	1.305	50	20	IDGD	
Cc1nn(-c2ccccc2)c2sc(C(=O)NNC(=O)NCCNC(=O)C3CC3)cc12	915906603	YKBALFNSIDBVDU-UHFFFAOYSA-N	426.502	1.866	50	20	IDGD	
CCCCS(=O)(=O)N1CCC[C@@H]1C(=O)NNC(=O)COc1ccccc1OCC	916032982	LKCOVZAMJNZJTJ-OAHLLOKOSA-N	427.523	1.206	50	20	IDGD	
COCCN(CCOC)S(=O)(=O)c1ccc(C(=O)NNc2ccc(F)cc2)cc1	916162726	IHYDOYXMBCLZRM-UHFFFAOYSA-N	425.482	1.866	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)NCc1ccc(N2CCN(C)CC2)nc1	916245570	JPNSFBNQDFBVDM-OAHLLOKOSA-N	430.484	1.270	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCCCCN2CCC[C@@H](C)C2)nc1	916503848	HFUMUEUACLBWRV-MRXNPFEDSA-N	426.587	1.907	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)NCCNS(=O)(=O)Cc2ccccc2)c1C	916516548	FQEDBRVVCMXRGJ-QGZVFWFLSA-N	448.545	1.521	50	20	IDGD	
COc1cc(C(=O)NNC(=O)COc2ccc(C=O)cc2[N+](=O)[O-])cc(OC)c1OC	916587129	CJFIKTOPEXKIPT-UHFFFAOYSA-N	433.373	1.273	50	20	IDGD	
COc1cccc(CCNC(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)c1OC	918217596	GSJZLWNKWHEFBG-UHFFFAOYSA-N	437.522	1.654	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCc2ccc([N+](=O)[O-])cc2)c1	919780969	VZDKFIABJFABLX-UHFFFAOYSA-N	435.462	1.032	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)NCc1ccc(N2CCOCC2)cc1	919789782	DJDIMXKNJYVEIA-UHFFFAOYSA-N	429.433	1.341	50	20	IDGD	
CCOc1ccc(C2(CNC(=O)NNC(=O)Cn3nc(C)cc3C)CCOCC2)cc1	919923292	PRUYDEQOZGPHAI-UHFFFAOYSA-N	429.521	1.977	50	20	IDGD	
O=C(Cc1csc(-c2ccc(Cl)s2)n1)NNC(=O)N[C@@H]1CCS(=O)(=O)C1	920037176	ZZCBMUIZCLQMAM-MRVPVSSYSA-N	434.952	1.585	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@@H]2CCCN2C(=O)Cc2ccccc2)cc(OC)c1OC	920216653	MXUWNNIEKSUNTL-KRWDZBQOSA-N	441.484	1.707	50	20	IDGD	
O=C(CCN1CCN(C(c2ccccc2)c2ccccc2)CC1)NNC(=O)[C@@H]1CCOC1	921146178	MTZSVBHNTCKSOH-JOCHJYFZSA-N	436.556	1.968	50	20	IDGD	
CCOc1ccc(/C=C(/C#N)C(=O)NCCNS(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1	921167652	GMWGOXVCHZVARZ-VBKFSLOCSA-N	444.469	1.995	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)NCCNC(=O)c2ccccc2C(F)(F)F)n1	1317871595	MLAVNSRUQGBBOE-UHFFFAOYSA-N	426.399	1.279	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)N[C@H]2CCN(CC(F)(F)F)C2)CC1	1321919635	FQJLMSJMPZTOGZ-ZDUSSCGKSA-N	437.463	1.601	50	20	IDGD	
Cn1c(C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)cc(Br)c1C=O	1341404880	MCRYEPSTRGOFHK-UHFFFAOYSA-N	431.287	1.666	50	20	IDGD	
Cn1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](O)CCl)C3)c(C(F)F)n1	1778358922	RHPNHFFWGKNQRB-SNUQEOBHSA-N	434.871	1.085	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc3nccn3c2)C1	1778704221	KBWCUCYTCVKYFJ-CSODHUTKSA-N	434.924	1.716	50	20	IDGD	
Cc1cccc(C)c1C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1	1779036810	GDAQDSRKLMKDPL-HSZRJFAPSA-N	437.500	1.059	50	20	IDGD	
COc1cc(OC)cc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)c1	1780662326	VWEGRDLWNMLOQK-DJJJIMSYSA-N	441.322	1.931	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc4c(c3)CNC4=O)CCO2)C1	1781229490	DVHDVXGKNKPASA-UXHICEINSA-N	440.327	1.610	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](F)Br)C3)C2)n1	1781326493	PNKVZNFAYSKSFG-WMLDXEAASA-N	443.273	1.174	50	20	IDGD	
COc1ccc(F)c(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)c1	1781335640	YJZLGPAJEIEIAM-RHSMWYFYSA-N	433.249	1.968	50	20	IDGD	
O=C(c1ccc(O)c([N+](=O)[O-])c1)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1781539963	DLAAXAVPAHMVEY-BBRMVZONSA-N	446.229	1.434	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)C2)C1	1781938244	FFFVBXOETNVRAO-QZTJIDSGSA-N	446.287	1.980	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnc(OC)c(F)c1)C2	1782171301	ZCFLDXRKVAZCJE-AKCHCHLHSA-N	443.903	1.611	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1c(C)nn(C)c1C)C2	1782172098	OTHYFSCMYDULMU-RZQQEMMASA-N	426.945	1.418	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](C)Oc1cccnc1)CCO2	1783353996	LAAZJBDDSZLTOE-SIXWZSSISA-N	440.338	1.852	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cnc(C(F)(F)F)cn3)CCO2)C1	1783874209	ANBQROXGKIFMCK-BZNIZROVSA-N	436.818	1.193	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c(F)c1F	1785052160	DUOMVNBUIXHWJZ-NRFANRHFSA-N	438.475	1.090	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3[nH]nc4ncccc34)C[C@@H]21	1786406175	XHURLBIERIEGEO-UBHSHLNASA-N	436.310	1.336	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(F)F)[C@H]2C1	1786458484	LOJIVZXSOZKTGT-PJODQICGSA-N	441.387	1.379	50	20	IDGD	
Cc1cnn(CC(=O)Nc2ccc(C3(NC(=O)c4cnccc4C(=O)NN)CCC3)cc2)c1	1788286367	LIWDPKGZRWBYRG-UHFFFAOYSA-N	447.499	1.638	50	20	IDGD	
Cc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Br)C[C@@H]32)c(C)n1C	1789121616	DEUXCLRWZNBCTF-QCEMKRCNSA-N	430.318	1.926	50	20	IDGD	
C=C(CC(=O)OCC)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)Br)C[C@@H]21	1789891907	WKWSIHCSUPYFOH-QPSCCSFWSA-N	431.327	1.259	50	20	IDGD	
CCc1ccnc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]3C2)c1	1789922698	LHHXBRGZYBGMPC-SDADXPQNSA-N	428.302	1.928	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CC3CCN(C)CC3)C[C@@H]21	1791054472	JFCSURHDTJFJAY-IWCQGFGOSA-N	430.387	1.481	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c[nH]c3cnccc13)C2	1792870675	IICYQEZSZSNFKU-JRATXPSKSA-N	435.322	1.797	50	20	IDGD	
CC(C)(C)n1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCBr)C3)n1	1794418732	BZYNQGKPPRIGAA-YWVIFJGQSA-N	427.343	1.626	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1c[nH]c2nccc-2c1	1796649251	MSPITEYUUNQXIG-MUJYYYPQSA-N	433.472	1.079	50	20	IDGD	
Cc1nc2ccncc2cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Br)C2	1797362198	KJLJANBCULKFAA-ZKRNXSKHSA-N	447.333	1.925	50	20	IDGD	
COc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)Br)C3)c(C)c1	1799025212	DNBBUVNKJUXEPL-VWPFQQQWSA-N	425.323	1.990	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(=O)nc2cccnn12	1799189805	BVPNNYBFTGYMSO-FVCCEPFGSA-N	434.294	1.125	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H]1C[C@@H](O)C1)C2	1799219699	IYWDFGUPAHLSAW-WIBPJOOCSA-N	431.445	1.543	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1c(F)cccc1F	1799735850	SELJMYNFCUVLEY-BTTYYORXSA-N	443.454	1.458	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)CBr)C2	1800754957	YYWFQKUINPKTHU-NGDQXYMTSA-N	426.149	1.390	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cn(C)nc1C(F)F)C2	1800758168	SUTREIGOFPSYQY-MWGHHZFTSA-N	435.269	1.344	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(F)cc(Cl)c1	1801759146	QDPGSXGZAFSILY-HBCWATKFSA-N	440.903	1.055	50	20	IDGD	
COc1cccc(/C=C/C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CCC(=O)NN(C)C)C3)c1	1801849566	MNQMMLXAEBPASC-JNYVGJRZSA-N	428.533	1.720	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)Cc2ncccn2)[C@@H]1c1cccnc1	1804692918	CTZRQRGJBGMEGS-YEWWUXTCSA-N	432.322	1.904	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H]1C(=O)N1CCCC2(CCN(C(=O)[C@H](O)CCl)CC2)C1	1806405458	NPHRLXWGYRBMNV-JKSUJKDBSA-N	443.972	1.827	50	20	IDGD	
CC(C)N[C@@H](C(=O)N1CCCC2(CCN(C(=O)CCC(=O)NN(C)C)CC2)C1)C(C)C	1809949891	PXPNNVKECQRSIH-OAQYLSRUSA-N	437.629	1.613	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)Cc2c(C)n[nH]c2C)[C@@H]1c1cccnc1	1813033503	UDFROWYULQXKHB-XKGZKEIXSA-N	433.940	1.924	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)C(Cl)Cl)[C@@H]1c1cccnc1	1813073960	MOWPDNHTKDOSRF-CZUORRHYSA-N	430.336	1.264	50	20	IDGD	
NC(=O)c1ncccc1C(=O)N1CC[C@@H](CNC(=O)C(Cl)Cl)[C@@H]1c1cccnc1	1813078663	VGBODKDKHNMUTL-WFASDCNBSA-N	436.299	1.699	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)C2=COCCC2)[C@H]1c1cccnc1	1813118278	HKXCHBATGWFNGQ-DYESRHJHSA-N	429.521	1.155	50	20	IDGD	
Cc1nscc1C(=O)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1	1815355142	OSCRKOFQJZZOFX-CYBMUJFWSA-N	442.331	1.127	50	20	IDGD	
CN[C@H](CC(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](F)Br)[nH]n1)C(=O)O	1817372303	PMNFNIMQTHLMOY-BREBYQMCSA-N	434.266	1.155	50	20	IDGD	
CCC1(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cnccc3C(=O)NN)n[nH]2)COC1	1819403737	CJQBVOCKPRTTHK-MRXNPFEDSA-N	441.492	1.141	50	20	IDGD	
Cc1nc(F)ccc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1	1819987246	QUJABRYQVGZZHR-MRXNPFEDSA-N	445.499	1.931	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccnc2C(N)=O)[nH]n1	1822186349	KYXIPJPRBHOPDP-ZWNOBZJWSA-N	449.309	1.993	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(F)nc2F)[nH]n1	1822411961	GBMIBSBXIAZCIU-AWEZNQCLSA-N	449.462	1.762	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H]1CCC(=O)NC1)CC2	1822857171	DBUVWJAMYCMGKD-KEYDSSBGSA-N	433.361	1.818	50	20	IDGD	
Cn1ccc(=O)cc1C(=O)N[C@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1	1823006407	FBNWAIIAEBQYFD-SDBXPKJASA-N	443.298	1.758	50	20	IDGD	
CSCC[C@H](O)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](C)Br)sc2C1	1825646651	BDAOTZOKHWQKBS-KKZNHRDASA-N	436.397	1.953	50	20	IDGD	
COc1ncccc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1	1825904553	ZOMMMRXUDAAXFH-LJQANCHMSA-N	445.564	1.697	50	20	IDGD	
O=C(O)CSCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](F)Br)CC2	1826119598	APHYPXNSUBPNJU-KBUNVGBDSA-N	440.316	1.563	50	20	IDGD	
C=CCO[C@H](C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827056079	RVHHASIFDVOLFZ-UTKZUKDTSA-N	428.338	1.191	50	20	IDGD	
Cc1cccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)n1	1830537457	IQJBTHUOROESIY-LIRRHRJNSA-N	440.338	1.491	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc([N+](=O)[O-])o3)C2)C1	1831639143	MMHOHQPNVYAVJR-SCLBCKFNSA-N	429.857	1.665	50	20	IDGD	
Cc1ncccc1CCC(=O)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1832640072	MAKVPVJRPITLPB-IBGZPJMESA-N	430.332	1.583	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)COc3ccc(F)cc3)CC2)CC1)[C@H](O)CCl	1833308985	HHANOBJTQHGPFP-LJQANCHMSA-N	441.931	1.376	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccns3)CCO2)C1	1833769981	ATTRIXPCOPAHSW-WBMJQRKESA-N	432.340	1.244	50	20	IDGD	
Cc1[nH]nc(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](F)Br)CC3)CC2)c1F	1834019094	DKUYUSQGQBDYHL-OAHLLOKOSA-N	448.312	1.733	50	20	IDGD	
O=C(CCBr)NC1CCN(C2CCN(C(=O)CCc3cnc[nH]3)CC2)CC1	1834422280	BCEGXMPAGBTQFH-UHFFFAOYSA-N	440.386	1.699	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)C[C@@H]3CCCCO3)C2)C1	1834818929	FIYYIEAIHSBELQ-YJBOKZPZSA-N	433.343	1.187	50	20	IDGD	
CSCC(C)(C)C(=O)N1CCOC[C@@]2(CN(C(=O)CCBr)CCO2)C1	1834818972	FXWINDAHMISESB-QGZVFWFLSA-N	437.400	1.617	50	20	IDGD	
Cc1cc(C(=O)NC2CCN(C3CCN(C(=O)[C@H](F)Br)CC3)CC2)n[nH]1	1836147075	BALPDOVUFZHEBV-HNNXBMFYSA-N	430.322	1.594	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC(OC2CCN(C(=O)[C@@H]3C=CCN3)CC2)CC1	1836670913	LNTOHIMEZXIUBO-YOEHRIQHSA-N	428.371	1.544	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cccnc3C(N)=O)CC2)CC1	1837250921	UFBQOIZRXOSXHK-KRWDZBQOSA-N	436.940	1.810	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3ccccn3)C2)C1	1837710294	TTZVQXPOSCSQLO-OAQYLSRUSA-N	435.597	1.322	50	20	IDGD	
Cc1nc(C)c(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](C)CBr)C3)C2)o1	1837999535	GHDIHHCBVWJQIP-SGTLLEGYSA-N	444.326	1.392	50	20	IDGD	
CCC(C)(C)C(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1	1838394546	IIECBLXRGROPQA-UHFFFAOYSA-N	445.564	1.734	50	20	IDGD	
C=CC[C@@H](C)C(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1	1838394811	ZITUTISPFFWLSP-MRXNPFEDSA-N	443.548	1.510	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(Cl)cc3)CCO2)C1	1838960237	CADIYWVDOBZAGS-VQIMIIECSA-N	431.316	1.664	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cc(F)cc(F)c1)CCO2	1839002120	TTXGMOACCWVIOZ-FQEVSTJZSA-N	442.535	1.886	50	20	IDGD	
Cc1cnc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)cn1	1839151149	JMMVWIUJQGCRLC-QZTJIDSGSA-N	431.320	1.091	50	20	IDGD	
O=C([C@H](F)Br)N1CCO[C@]2(COCCN(C(=O)[C@H]3CCCSC3)C2)C1	1839203202	CYAABXBCBPZQGO-XEZPLFJOSA-N	439.347	1.277	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(F)c(C)c3)CCO2)C1	1839321751	SBCJIPYEYVWGRS-OXJNMPFZSA-N	428.888	1.458	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3coc(Cl)n3)C2)C1	1840031026	DGLJGGWPHMBGGO-BONVTDFDSA-N	436.690	1.181	50	20	IDGD	
Cc1nc(C(=O)N2CCCC23CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C3)co1	1842455053	RLSZOYYSZJFSQN-ZDUSSCGKSA-N	426.901	1.932	50	20	IDGD	
O=C(c1cc(-c2cccs2)on1)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843014304	WIAJGMUCWRPNED-UHFFFAOYSA-N	437.286	1.214	50	20	IDGD	
O=C(c1cccc(C(F)(F)F)c1)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843014358	AUCUICKSCRRJPD-UHFFFAOYSA-N	432.207	1.516	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)c2ccc(C(=O)OC)cc2[N+](=O)[O-])C1	1845537008	ZLBJQULMXUAYFF-CQSZACIVSA-N	439.852	1.452	50	20	IDGD	
O=C1C[C@@H](C(=O)N2CCCC23CN(C(=O)[C@H](Br)Cc2ccccc2)C3)CN1	1846000431	IVBCQDPNDWCHKB-HZPDHXFCSA-N	434.334	1.332	50	20	IDGD	
CN(CC(=O)N1CC2(CCCN2C(=O)[C@]2(C)CC2(F)F)C1)NC(=O)NCc1ccccc1	1846987768	BTYKMOUVEHSUNY-FQEVSTJZSA-N	449.502	1.581	50	20	IDGD	
C[C@@H]1CN(C(C)(C)CNC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)C[C@@H](C)O1	9732202	MASAZAQSYIRONU-HUUCEWRRSA-N	430.509	1.410	50	20	IDGD	
COc1ccc(Cl)cc1N1C[C@H](C(=O)NNC(=O)c2ccc3c(c2)OCO3)CC1=O	15663099	GTYJUQDIBZAKPX-GFCCVEGCSA-N	431.832	1.891	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)Cn1cnc2c(oc3ccccc32)c1=O	15726954	GMTGPLONIUHIIM-UHFFFAOYSA-N	444.451	1.902	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)CCNC(=O)NC23CC4CC(CC(C4)C2)C3)cc1	15888658	TYWPCCNMCDAIJK-UHFFFAOYSA-N	439.516	1.743	50	20	IDGD	
Cc1noc(C)c1CC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	24068761	CDHCQFNFYFNJDM-UHFFFAOYSA-N	442.497	1.774	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2ccc3nc(C)c(C)nc3c2)cc1	105183241	NGCISQPFBOZTCL-UHFFFAOYSA-N	441.513	1.637	50	20	IDGD	
CCCS(=O)(=O)N1CCCC[C@H]1C(=O)NNC(=O)c1ccc(Br)s1	108751900	UTKNTMFZYRZBMT-JTQLQIEISA-N	438.369	1.866	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)c2cc(Cl)c(-n3cnnn3)cc2OC)o1	109421737	DUFDZKLZWZAJBW-UHFFFAOYSA-N	447.883	1.834	50	20	IDGD	
O=C(Cn1nc(C2CC2)cc(C(F)(F)F)c1=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	117503143	GTCWNIVTPSURRK-UHFFFAOYSA-N	425.323	1.509	50	20	IDGD	
CS(=O)(=O)N1CCC[C@H]1C(=O)OCC(=O)NN=C(c1ccccc1)c1ccccc1	117658668	RQOFNECFLQQLGN-SFHVURJKSA-N	429.498	1.522	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NN=Cc3c[nH]c4ccccc34)CC2)cc1	252621585	NCBLEAPQJJTXPT-UHFFFAOYSA-N	439.541	1.933	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)NCC(=O)Nc1cc(Cl)ccc1Cl	726082862	CLELWGOYXJCNQW-UHFFFAOYSA-N	428.232	1.285	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NCCN2CCOC(C)(C)C2)c2ccccc2c1=O	726262351	CAHNFSAOJKNPPN-UHFFFAOYSA-N	444.536	1.251	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)NCCc2nc(C)no2)c2ccccc2c1=O	726271365	QQWLJPKNUWEMFB-UHFFFAOYSA-N	427.465	1.465	50	20	IDGD	
O=C(COC(=O)c1cc2ccc(Cl)cc2[nH]1)NNC(=O)[C@H]1COc2ccccc2O1	728322484	IBIURHUXHWKYHS-QGZVFWFLSA-N	429.816	1.966	50	20	IDGD	
O=C(COC(=O)c1cc(-c2cccc(F)c2)no1)NNC(=O)[C@H]1COc2ccccc2O1	728329292	VDWLQFXTDWMDLR-GOSISDBHSA-N	441.371	1.625	50	20	IDGD	
CC(=NNC(=O)[C@@H](C)NS(C)(=O)=O)c1cccc(OCc2cn3ccccc3n2)c1	728435349	ZAMKTUSOYNHNLP-OAHLLOKOSA-N	429.502	1.691	50	20	IDGD	
COc1ccc(Nc2nc(Cl)c(C=NNC(=O)[C@H](C)NS(C)(=O)=O)s2)cc1	728437256	OHNWKHWYOCMXHM-VIFPVBQESA-N	431.927	1.937	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCCN(C)C(=O)OC(C)(C)C)cc(OC)c1OC	729221543	SHAQQUKNKBTIEI-UHFFFAOYSA-N	426.470	1.523	50	20	IDGD	
O=C(NNC(=O)[C@@H]1C[C@@H](O)CN1C(=O)OCc1ccccc1)c1cc(-c2ccccc2)[nH]n1	729284290	RZJJXFOENIBTFG-XLIONFOSSA-N	449.467	1.610	50	20	IDGD	
O=C(/C=C\c1cncc(F)c1)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	729295134	CIAGPQDOJQZASJ-FPLPWBNLSA-N	432.477	1.870	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)c2cc(S(=O)(=O)NC(C)C)ccc2F)cn1	729692725	ZOEFSCTUVCCGGY-UHFFFAOYSA-N	441.510	1.547	50	20	IDGD	
CNC(=O)C1(C(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)CCC1	729966333	ITLQNVZNHKAAKB-UHFFFAOYSA-N	436.515	1.226	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)c2cc(S(=O)(=O)N3CCC[C@@H](C)C3)cn2C)cc1	730274020	JOOYSKBXDALSHB-MRXNPFEDSA-N	447.561	1.627	50	20	IDGD	
COc1ccccc1C(=O)NNS(=O)(=O)c1ccc(C(=O)NCC(F)(F)F)cc1	731493871	OAQQKXLDHBNALC-UHFFFAOYSA-N	431.392	1.611	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)CN2C(=O)COc3ccc([N+](=O)[O-])cc32)cc1OC	731809390	HPCDXYLPDHKNFU-UHFFFAOYSA-N	444.400	1.189	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)CCCS(=O)(=O)c1ccc(Br)cc1	732084398	DXUQZFHMNVZIOI-UHFFFAOYSA-N	429.296	1.496	50	20	IDGD	
O=C(NCCCNC(=O)c1cccc(F)c1)NNC(=O)c1nnc(O)c2ccccc12	732468681	BQEVVSATDABITQ-UHFFFAOYSA-N	426.408	1.239	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)N[C@H](Cc2ccccc2)CN2CCOCC2)c1	732476836	YQUSKSZNGVAUAM-OAQYLSRUSA-N	440.544	1.956	50	20	IDGD	
CC(C)(C)OC(=O)NCc1nc(C(=O)NNC(=O)COc2ccc(C#N)cc2)cs1	732750539	UEFFHBOOKWOMMN-UHFFFAOYSA-N	431.474	1.879	50	20	IDGD	
CCOc1ccc(NC(=S)NNC(=O)[C@@H]2CC(=O)N(C[C@@H]3CCCN3CC)C2)cc1	733358378	UBGAUSGCGNNCBN-WBVHZDCISA-N	433.578	1.736	50	20	IDGD	
CCO[C@@H](C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1)c1ccccc1	735117110	BMBOXJHTLLLYAN-GOSISDBHSA-N	433.534	1.239	50	20	IDGD	
CC(C)CCn1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)nn1	740812696	WKGIMARZZOOWLV-UHFFFAOYSA-N	448.549	1.574	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)[C@H]2CN(Cc3ccccc3)CCO2)cc1	741174038	YZTUULBWPJCPLK-LAUBAEHRSA-N	427.501	1.901	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@H](NC(=O)NNC(=O)c1nnc(O)c2ccccc12)C1CC1	741424428	FSASYDPUNFLHQB-AWEZNQCLSA-N	430.465	1.583	50	20	IDGD	
NS(=O)(=O)c1ccc(NC(=O)NNC(=S)Nc2ccc(OC(F)F)cc2)cc1	741870101	MURUCKKADNGKAE-UHFFFAOYSA-N	431.446	1.959	50	20	IDGD	
Cc1nn(C)c(C)c1S(=O)(=O)N[C@@H](C)C(=O)NNC(=O)C12CC3CC(CC(C3)C1)C2	742034357	XYNZFKUZRCPRIT-USPTXHSUSA-N	437.566	1.068	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNS(=O)(=O)c2ccc(C(=O)O)cc2F)cc1	743250136	BEWCTMTVJRRNOB-NSHDSACASA-N	426.422	1.700	50	20	IDGD	
COc1cccc(O[C@@H](C)CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)c1	743510000	OECSQPPSDPQYSI-ZDUSSCGKSA-N	435.506	1.400	50	20	IDGD	
COc1cccc(CCNC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)c1OC	743541405	PFMIQENLLLASTF-UHFFFAOYSA-N	436.490	1.686	50	20	IDGD	
C[C@@H]1Oc2ccccc2N(CC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)C1=O	743829367	NLNONDOUNYXSHL-LBPRGKRZSA-N	432.458	1.057	50	20	IDGD	
O=C(CS(=O)(=O)Nc1ccc(N2CCCCC2)cc1)NNC(=O)NCc1ccco1	743900755	JRWALVCHTPGFFG-UHFFFAOYSA-N	435.506	1.542	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)NCc2ccccc2OCCN2CCOCC2)c1	744292084	REIBXVHKAFTMEB-UHFFFAOYSA-N	442.516	1.615	50	20	IDGD	
C[C@@H]1CN(CC(=O)NNC(=O)c2cccs2)CCN1C(=O)Cc1cccc(Cl)c1	744420122	XFNNGWBAQFASRQ-CQSZACIVSA-N	434.949	1.938	50	20	IDGD	
COc1ccc(CCC(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)cc1F	744621014	KYGQYWVRDCKSAK-UHFFFAOYSA-N	437.493	1.931	50	20	IDGD	
COc1cc(C=NNC(=O)CN2CCCC2=O)cc(I)c1OC	744999851	ZAKASOBCJHEOIH-UHFFFAOYSA-N	431.230	1.381	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)N[C@H]1C[C@@H](C)N(c2ccccc2)C1=O	745881405	IVQOMPHAHGMRKJ-WBVHZDCISA-N	426.473	1.989	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCc2ccc(F)cc2F)cc1	746964425	WPISKMCSKURRIT-UHFFFAOYSA-N	426.445	1.424	50	20	IDGD	
CC(C)(C)OC(=O)NC1(CC(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)CCC1	747059661	TXTJLFJOBBKWIB-UHFFFAOYSA-N	430.461	1.700	50	20	IDGD	
CN1CCC(N2CCC(NC(=O)NNC(=O)c3cc(Br)c[nH]3)CC2)CC1	747990174	CHOJIJOUPKICCO-UHFFFAOYSA-N	427.347	1.280	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)N2CCCC2)c([N+](=O)[O-])cc1OCc1cscn1	748239489	HQBVNZFKLUQWGG-UHFFFAOYSA-N	449.445	1.022	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)Cc2cnn(C)c2)c1	751280290	FQYFPAQEHAJSCW-UHFFFAOYSA-N	443.485	1.233	50	20	IDGD	
Cc1c(Br)cc(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1[N+](=O)[O-]	753398074	VDDXKXXDFPKXSH-UHFFFAOYSA-N	446.221	1.716	50	20	IDGD	
Nc1nc(Cl)cc(NNC(=O)[C@H]2CC(=O)N(CCOc3ccccc3Cl)C2)n1	753454280	QREBHYFWHAHXOW-JTQLQIEISA-N	425.276	1.736	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)N[C@H]2CCN(Cc3ccc(C#N)cc3)C2=O)c1	753733444	QFUYMYLCXRZMDR-IBGZPJMESA-N	435.484	1.685	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)N[C@@H]1CCN(Cc2ccc(C#N)cc2)C1=O	753736986	AKGBUVHANKJNFS-AUUYWEPGSA-N	439.447	1.596	50	20	IDGD	
COCC(=NNC(=O)C[C@H]1c2cc(OC)c(OC)cc2CCN1S(C)(=O)=O)C1CC1	754256469	CIYPPAIXRSFBBL-KRWDZBQOSA-N	439.534	1.481	50	20	IDGD	
O=C(CO)NNC(=O)Nc1ccc(S(=O)(=O)N2CCC(Cc3ccccc3)CC2)cc1	755448021	XXWSPAZNODOHCZ-UHFFFAOYSA-N	446.529	1.475	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NN=Cc2c(-n3ccnc3)nc3ccccn23)c1	755507224	BQKQORIDULXBEJ-UHFFFAOYSA-N	437.485	1.534	50	20	IDGD	
CCOCC(=O)NNC(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)[C@@H]2C[C@H]3CC[C@H]2C3)cc1	755512533	MHGZJWVYBYEVJY-XSWJXKHESA-N	438.550	1.979	50	20	IDGD	
C[C@@H]1CN(C2CC2)CC1=NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	755878949	FPHRULBZQGBETO-MRXNPFEDSA-N	434.562	1.226	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNS(=O)(=O)c1cc(F)c(F)c(C(=O)OC)c1	755953625	BPXNPHSFIDNOPM-UHFFFAOYSA-N	444.412	1.539	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)N[C@H]2CCN(c3c(F)cccc3F)C2=O)c1	756211505	MYGLCLDAPPQUKQ-INIZCTEOSA-N	434.399	1.732	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)Nc1ccc(N2CCSCC2)c(Cl)c1	756279749	GWYVSJYDMBPXMX-LLVKDONJSA-N	432.955	1.481	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Nc2cnn(Cc3ccccn3)c2)cc(OC)c1OC	756739539	OWZMQCCTIIUEJW-UHFFFAOYSA-N	426.433	1.819	50	20	IDGD	
NC(=O)c1ccc(NNC(=O)CSCc2nc(O)c3c4c(sc3n2)CCC4)nn1	757409007	YCXYJGMEQNZVLU-UHFFFAOYSA-N	431.503	1.151	50	20	IDGD	
CN1Cc2ccccc2[C@@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)C1	757734426	NILPSSOWCDFGIR-SFHVURJKSA-N	431.518	1.068	50	20	IDGD	
O=C(COc1ccc(OCc2ccccc2)cc1)NNC(=O)N[C@H]1CCCS(=O)(=O)C1	758659385	UDKIJZFDWMFTDJ-KRWDZBQOSA-N	447.513	1.552	50	20	IDGD	
CCOCCCn1c(NNC(=O)Cn2c(C)cc(O)cc2=O)nc2ccccc2c1=O	759791103	QESHPZDPTKSDOC-UHFFFAOYSA-N	427.461	1.142	50	20	IDGD	
C[C@@H]1Oc2ccccc2N(CCC(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)C1=O	761185814	ZDUWNMHRGFNSAF-ZDUSSCGKSA-N	445.859	1.848	50	20	IDGD	
O=C(NNC(=O)c1ccccn1)C(=O)Nc1ccc(C(=O)N2CCc3ccccc32)cc1	763464879	WPELMJQHLWEWQY-UHFFFAOYSA-N	429.436	1.684	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)n([C@@H]2C[C@H]3CC[C@H]2C3)n1	763552003	UXEQZYBGVRFZAX-KCQAQPDRSA-N	425.445	1.681	50	20	IDGD	
CC(C)(C)OCc1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1	763574351	ZDDKVPAHCATKCN-SFHVURJKSA-N	427.457	1.928	50	20	IDGD	
COCCOc1ccc(C#N)cc1NC(=O)C(=O)NNC(=O)COc1cc(C)cc(C)c1	763649770	KGEYOUCBYQVSHR-UHFFFAOYSA-N	440.456	1.365	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)C(=O)N1CCc2ccc(Br)cc21	763681113	ZMRBKIBBLMGWRV-UHFFFAOYSA-N	436.237	1.704	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2cccc(Cl)c2-n2cncn2)c1	763775861	WMLUHSBEXHCKND-UHFFFAOYSA-N	444.835	1.338	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc2oc(C(F)(F)F)nc2c1	763807873	HQIUHTGVSZKFNC-UHFFFAOYSA-N	447.329	1.883	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)COc3ccc(F)cc3)cc2)C[C@H](C)O1	763840833	YMBNGQDKGMJRTC-GJZGRUSLSA-N	444.463	1.604	50	20	IDGD	
CSc1nnnn1-c1cccc(NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)c1	763974637	UEUSZBJKOYIAMD-UHFFFAOYSA-N	447.864	1.143	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)C(=O)Nc1ccc(N=Nc2ccccc2)cc1	763996986	HRCYFGIKFXLWED-ZDUSSCGKSA-N	429.458	1.623	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)C(=O)Nc1ccc(OC2CCCC2)c(Cl)c1	763998547	PVQKJAUCZHGUJJ-LLVKDONJSA-N	443.909	1.182	50	20	IDGD	
COC(=O)c1ccc(F)c(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)c1	763998595	QFLANBGMIFMWGF-UHFFFAOYSA-N	427.186	1.103	50	20	IDGD	
CNC(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2OC)c1	764012441	QVKOUCGGPNCPSD-UHFFFAOYSA-N	439.255	1.761	50	20	IDGD	
C[C@H]1Oc2ccc(NC(=O)C(=O)NNC(=O)c3cccc(Br)c3)cc2NC1=O	764062981	IGKRXDXHALTEFP-SECBINFHSA-N	447.245	1.568	50	20	IDGD	
C[S@](=O)c1cccc(NC(=O)C(=O)NNC(=O)c2ccc(F)cc2Br)c1	764084758	HGMXAFAKZICAQT-SANMLTNESA-N	442.266	1.725	50	20	IDGD	
CNS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)Cc2ccc3ccccc3c2)cc1	764091347	JCOXMFJGKPQRDJ-UHFFFAOYSA-N	440.481	1.077	50	20	IDGD	
CC(=O)N(Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)cc1)C(C)C	764163108	HMTADVXBHDYTFE-HXUWFJFHSA-N	438.484	1.533	50	20	IDGD	
CCCNC(=O)[C@@H]1CN(C(=O)C(=O)NNC(=O)CCc2ccccc2)c2ccccc2O1	764193993	XNCBPRXGBMUCFR-IBGZPJMESA-N	438.484	1.087	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)C(=O)Nc1cccc(CN2CCCC2=O)c1	764239814	WKBGYPFSTUHKBG-UHFFFAOYSA-N	433.468	1.550	50	20	IDGD	
Cc1cc(C(=O)N2CCCC2)ccc1NC(=O)C(=O)NNC(=O)COc1ccccc1O	764275104	IXORQWLBUQWYTN-UHFFFAOYSA-N	440.456	1.102	50	20	IDGD	
COc1cc(Br)c(NC(=O)C(=O)NNC(=O)c2ccc(C)o2)cc1OC	764370189	ONPXAHMGHPLJFG-UHFFFAOYSA-N	426.223	1.767	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cscc3C)n[nH]2)cc1OC	764378691	LVVOCPDKXWRDAQ-UHFFFAOYSA-N	429.458	1.864	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1)C(=O)Nc1ccn(Cc2ccccc2)n1	764388555	UEULDNWZAYRRGQ-UHFFFAOYSA-N	447.430	1.860	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1cccc(-c2nncn2C)c1	764398564	UCEGRHRAZUXANC-UHFFFAOYSA-N	440.485	1.369	50	20	IDGD	
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	765315101	AQTUGHUKPCUHFG-BEFAXECRSA-N	430.530	1.555	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)c3ccc(F)c(C)c3)CC2)cc1	765730816	XQDWMNFLCXOTFS-UHFFFAOYSA-N	448.520	1.210	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCC[C@@H](c3n[nH]c(C4CC4)n3)C2)cc1OC	766255418	AGKHABUFYKQPJR-OAHLLOKOSA-N	428.493	1.340	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)CCc1nc(-c2ccsc2)no1	767264212	JRHDUFHFWIFZRD-UHFFFAOYSA-N	428.470	1.972	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)CCCn3ccccc3=O)n[nH]2)cc1OC	768276566	KTSXQXYWIGBYBL-UHFFFAOYSA-N	425.445	1.497	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C1=NN(c2ccccc2)[C@H](C(C)=O)C1	768613608	WWSBOLVOGLHVHZ-INIZCTEOSA-N	430.486	1.766	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)N1CCN(C(=O)NC(C)(C)C)CC1	770647843	OEIYZKIUAGQZER-ZDUSSCGKSA-N	425.917	1.974	50	20	IDGD	
C[C@@]1(c2ccc(Br)cc2)NC(=O)N(CC(=O)NNC(=O)c2ccncc2)C1=O	771216330	OFUCQPAGBKNUDC-SFHVURJKSA-N	446.261	1.072	50	20	IDGD	
O=C(Cn1cc(C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)cn1)NC1CCCC1	772477760	SFCWJSZMEPDHMY-UHFFFAOYSA-N	446.458	1.869	50	20	IDGD	
COC(=O)c1ccc(S(=O)(=O)NNC(=O)c2cccc(Br)c2)cc1F	773253039	SDVNGZVBDZQIOP-UHFFFAOYSA-N	431.239	1.998	50	20	IDGD	
CS(=O)(=O)Cc1ccc(Cl)cc1S(=O)(=O)NNC(=O)c1cccc(C#N)c1	774618774	OMWBPGFUEFAIFJ-UHFFFAOYSA-N	427.891	1.380	50	20	IDGD	
CN(C)C(=O)[C@@H]1CC[C@H](CNC(=O)NNC(=O)c2ccc(Br)cc2Cl)O1	774699687	HSENOCMPWIYQKS-MFKMUULPSA-N	447.717	1.682	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN[C@H](C)c2ccc(S(=O)(=O)NC)cc2)cc1C	775238865	SJONQSYUACDPMI-CYBMUJFWSA-N	438.575	1.639	50	20	IDGD	
Cc1ccc(S(=O)(=O)C[C@@H](C)NC(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)cc1	776195027	PPJTVIPQPRVEER-MRXNPFEDSA-N	446.529	1.743	50	20	IDGD	
O=C(NNc1ccc(OC(F)F)cc1)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(F)cc1	780950354	FNMAABABNOKBBV-CJNGLKHVSA-N	445.419	1.694	50	20	IDGD	
N#Cc1cccnc1OC1CCC(NC(=O)NNC(=O)CNC(=O)c2cccs2)CC1	783034721	GREIGVFIUYKPRJ-UHFFFAOYSA-N	442.501	1.465	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)N[C@H]1COc2cc(F)cc(F)c21	784574323	CTXDHGJDQOISKL-LBPRGKRZSA-N	439.444	1.644	50	20	IDGD	
COC(=O)CCNC(=O)c1ccc(NC(=O)C(=O)NNc2ccc(F)c(F)c2F)cc1	784810481	ISLWVMKZNGMCSU-UHFFFAOYSA-N	438.362	1.479	50	20	IDGD	
CCNC(=O)N(C)NC(=O)C(=O)Nc1ccc(Oc2ccccc2S(=O)(=O)CC)cc1	784916219	VUKGUUDIXYYJPF-UHFFFAOYSA-N	448.501	1.904	50	20	IDGD	
COc1cc(Br)c(NC(=O)C(=O)NNc2ccnc(N(C)C)n2)cc1OC	784969527	OAZBJCJZXDTREJ-UHFFFAOYSA-N	439.270	1.404	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(C(=O)COC(=O)/C(C#N)=C/C3CC3)CC2)cc1C	786668735	IFGDCXHBONFZOY-LDADJPATSA-N	431.514	1.540	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)COc3cccc(I)c3)nc21	787358319	ACGVZQBJHYJGBQ-UHFFFAOYSA-N	440.201	1.196	50	20	IDGD	
Cc1ccc(N2CCNC2=O)cc1NC(=O)C(=O)NNc1ccc(Br)cn1	787554330	DHGQWFQLAVDFSQ-UHFFFAOYSA-N	433.266	1.764	50	20	IDGD	
Cc1c(Br)ccc(NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)c1F	789733942	XLMGGTSVLYCWBU-CQSZACIVSA-N	436.237	1.986	50	20	IDGD	
COCCC[C@H](Cc1ccccc1)NC(=O)NNC(=O)c1csc(N2CCOCC2)n1	792286175	SJXQXLUTVOEZDU-QGZVFWFLSA-N	447.561	1.962	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2cnn(Cc3ccc(OC)cc3)c2)n1	793054807	DRLOCYRHVXLFEI-UHFFFAOYSA-N	438.492	1.658	50	20	IDGD	
CCOc1cc(NC(=O)C(=O)NNC(=O)c2cccc(C)n2)c([N+](=O)[O-])cc1OCC	797370374	AMNCPTRSECQMJY-UHFFFAOYSA-N	431.405	1.495	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3[nH]nnc3-c3ccccc3)n[nH]2)cc1OC	797749445	ZBUXMGQVVQQTBD-UHFFFAOYSA-N	433.428	1.954	50	20	IDGD	
COc1ccc(Cl)c(NC(=O)NNC(=O)c2ccc([C@]3(C)NC(=O)NC3=O)cc2)c1	802113337	NCCVVRXSLPATRD-IBGZPJMESA-N	431.836	1.870	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)CCCCC(N)=O)c1	802427117	UACYLWKYYZFIBM-UHFFFAOYSA-N	448.501	1.303	50	20	IDGD	
O=C(CNS(=O)(=O)c1c[nH]c2ncccc12)NNc1ccc(OCC(F)(F)F)cc1	802830065	HOMMIPOJYCDCRL-UHFFFAOYSA-N	443.407	1.926	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cn(C)c3ccccc23)cc2[nH]ccc12	808934736	SSGSTCVMUGVGQB-UHFFFAOYSA-N	433.424	1.846	50	20	IDGD	
Cc1cnc(Br)c(NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)c1	812980127	LLYUPGALGUVPBN-UHFFFAOYSA-N	443.204	1.910	50	20	IDGD	
CCOC(=O)Nc1scnc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	813365348	ASACRWHFQZOMMS-UHFFFAOYSA-N	441.491	1.037	50	20	IDGD	
COc1cccc(NNC(=O)C(=O)Nc2nnn(CCOc3ccc(F)cc3)c2C)n1	815559102	XVCZAUABTRBCNI-UHFFFAOYSA-N	429.412	1.290	50	20	IDGD	
Cc1ccc(Oc2ccc(NC(=O)C(=O)NNC(=O)[C@@H]3CCc4nncn4C3)cc2)nc1	815692948	GTRHQCGRMQETKA-CQSZACIVSA-N	435.444	1.122	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1ccc2c(c1)CC(C)(C)O2	815751894	SYVRMDZXUTUVND-UHFFFAOYSA-N	432.502	1.732	50	20	IDGD	
Cc1cc(Cn2nnc(C(=O)NNc3ccc(S(=O)(=O)C(F)(F)F)cc3)c2C)on1	815853963	ITXISYSKXSASSR-UHFFFAOYSA-N	444.395	1.982	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)N2CCN(S(=O)(=O)c3cc[nH]n3)CC2)c(C)n1CC(C)C	816326970	QWJJJEYWHISRQT-UNOMPAQXSA-N	444.561	1.924	50	20	IDGD	
C[C@H]1CN(c2ccnc(C(=O)NNc3ccccc3S(=O)(=O)N(C)C)c2)C[C@@H](C)O1	817054363	GKFCWYDTZVKXHB-GASCZTMLSA-N	433.534	1.702	50	20	IDGD	
CC(C)(C)c1ccc(S(=O)(=O)NCCC(=O)NNC(=O)CNc2ccccc2)cc1	823328313	FKDBDAHMDXNFNK-UHFFFAOYSA-N	432.546	1.912	50	20	IDGD	
COc1nc(N)nc(N2CCCC2)c1C=NNC(=O)c1sc(N2CCOCC2)nc1C	863966683	KQRQTWIPOINYRI-UHFFFAOYSA-N	446.537	1.033	50	20	IDGD	
O=C(NCc1ccccc1)NC1(C(=O)NNC(=O)c2nnc(O)c3ccccc23)CCCC1	876313225	OGKPKEAFBXVKMI-UHFFFAOYSA-N	448.483	1.909	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)CSCc2cc(=O)n3ccsc3n2)c1	887557290	GNMJDSUKZFNDOV-UHFFFAOYSA-N	434.499	1.468	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CNS(=O)(=O)c2ccc(C)cc2)ccc1OC(C)C	913153594	FPOUESRNBBNAPH-UHFFFAOYSA-N	435.502	1.530	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)NCCCN2CCN(c3ncccn3)CC2)c2ccccc21	913638478	SLNDIPRKZNGYNM-UHFFFAOYSA-N	436.520	1.125	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)CCc2ccc(S(=O)(=O)NC3CC3)cc2)c1	913900976	IIZGLNQKHYKGRX-UHFFFAOYSA-N	445.541	1.903	50	20	IDGD	
CC(C)CNS(=O)(=O)c1ccc(C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)cc1	914749816	MGWGWYXXOXJNDO-AWEZNQCLSA-N	437.493	1.989	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)C[C@@H]2Oc3ccccc3NC2=O)c2ccccc2c1=O	916852309	ZTWRFTYEWNYBAZ-KRWDZBQOSA-N	435.440	1.528	50	20	IDGD	
O=C(CC(F)(F)F)NNC(=O)c1cc(S(=O)(=O)NC2CC2)ccc1Br	918364353	NGXCVIZESSRRIS-UHFFFAOYSA-N	444.229	1.603	50	20	IDGD	
CC(C)Oc1ccc(NS(=O)(=O)CC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1	918399875	ZKVVCYMOZYLSBE-UHFFFAOYSA-N	436.446	1.585	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)[C@H](C)NC(=O)C1CCCC1	919353843	CXJCIVPYZKBQIO-NSHDSACASA-N	425.869	1.348	50	20	IDGD	
CC(C)[C@@H](C(=O)NNC(=O)c1nnc(O)c2ccccc12)n1nnc(-c2ccccc2)n1	919692864	YQBYBZHNCDVUAQ-KRWDZBQOSA-N	432.444	1.647	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)CCCNS(=O)(=O)c1ccc(C)c(C)c1	919819938	AAAJCOBGLAXACR-UHFFFAOYSA-N	433.530	1.761	50	20	IDGD	
Cc1nccn1-c1ccc(CNC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1F	920240105	YPFLXRXNTBTBQT-UHFFFAOYSA-N	449.446	1.711	50	20	IDGD	
O=C(NN=Cc1cn(Cc2ccccc2)nc1-c1cccnc1)N[C@@H]1CCS(=O)(=O)C1	920381985	UWKGMZQMQJBOJZ-LJQANCHMSA-N	438.513	1.814	50	20	IDGD	
CC(C)(C)OC(=O)NNC(=O)c1ccc2c(c1)S(=O)(=O)N(C[C@@H]1CCCO1)C2=O	920402609	GUIATRXDKQLHJL-LBPRGKRZSA-N	425.463	1.180	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)NCc2cccnc2N2CCN(C)CC2)c2ccccc2n1	921247961	OJLKSGXKESSGEB-UHFFFAOYSA-N	433.516	1.834	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)NCc3cccnc3N3CCN(C)CC3)n[nH]2)cc1	921248438	YVXYNLRSJASJCD-UHFFFAOYSA-N	448.531	1.676	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)c2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1	1317984771	DAQYJKNGXOJVMY-INIZCTEOSA-N	425.489	1.270	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cnn(C3CCCC3)c2C)cc1OC	1319598817	CQOFWKFBLGLNLH-UHFFFAOYSA-N	430.461	1.942	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1cnn(C2CCCCC2)c1	1340542927	CCQDBCXGAOOSQG-UHFFFAOYSA-N	438.532	1.607	50	20	IDGD	
O=C(c1cc2cc[nH]c2cc1Cl)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1777997395	XRSPXISCVCVKPJ-LPHOPBHVSA-N	426.300	1.865	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc3n(n2)CCCO3)C1	1779036416	RIAPLHUDTSXPLA-YYFZDKIDSA-N	440.928	1.047	50	20	IDGD	
C[C@@H](Cn1cncn1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@](C)(Cl)CCl)C1	1780712883	XKOOMOPLRPXPLI-OSGQAZFXSA-N	446.379	1.664	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@H](C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](F)Br)C3)C2)C1	1781334174	MPSFIQWCCIRRRM-MOROJQBDSA-N	449.317	1.486	50	20	IDGD	
CC(=O)NCCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)CBr)C2	1781790438	FOANNPJXLZTNBJ-DDUZABMNSA-N	432.359	1.058	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)CCc3ccc(O)nn3)C2)C1	1782635166	GUCNBRMKRBZBQP-QZTJIDSGSA-N	431.320	1.181	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H]3C[C@@H]3F)C2)C1	1782930154	RIAPJMYPLIXCCT-MNUAXYBXSA-N	433.908	1.306	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cn(C)nc3OC)CCO2)C1	1783345001	VQLZOVOFWKPXRA-SUMWQHHRSA-N	429.315	1.046	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H]1CC(c3ccccc3)=NN1)CCO2	1783535331	BJSYEBHSUIFAOW-JNAXZKDPSA-N	449.349	1.366	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)c3ccco3)[C@H]2C1	1783554636	NXEBXVNDFRERQH-YOPIWALVSA-N	429.311	1.324	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ncccn3)C[C@@H]21	1783969785	PVDIERPEFJEYOV-AJNGGQMLSA-N	425.327	1.030	50	20	IDGD	
CC(C)N1CCC[C@H]1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2	1784801840	ZKUHKKASGDBEIX-BXWFABGCSA-N	430.387	1.720	50	20	IDGD	
C[C@@H](NC(=O)c1ccccc1)C(=O)N1CC[C@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1785557468	LLWQYMSTBBTUBE-VGSWGCGISA-N	447.608	1.486	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(C)n(C)n3)[C@H]2C1	1786007952	BQMITWRLVNVQEJ-AYDFFVQHSA-N	427.343	1.495	50	20	IDGD	
O=C(NC1(c2ccc(NC(=O)[C@@H](O)CCl)cc2)CCC1)c1cc2n(n1)CCCNC2=O	1786134475	JJGPBBCYAUJQKN-KRWDZBQOSA-N	445.907	1.364	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)c3ccccc3)[C@H]2C1	1786666597	ZKZJHYGGVVIEOJ-LLYLOPHFSA-N	429.344	1.936	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)c1ncccc1-c1ccccc1	1787682742	VVURJNLZFDUQLZ-LEAZDLGRSA-N	443.931	1.942	50	20	IDGD	
C[C@H](C(=O)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1)N1C[C@@H]2C[C@H]2C1	1788142183	IWWXFCYVKXRKHY-NEWSRXKRSA-N	447.344	1.454	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc4ccccn34)C[C@@H]21	1788762519	DJMYEBDPKWAPFX-BQFCYCMXSA-N	430.581	1.779	50	20	IDGD	
CCOC(CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]2C1)OCC	1788766153	QZYVQNBSJSRSAN-ULQDDVLXSA-N	430.618	1.607	50	20	IDGD	
CCCCC[C@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21	1790893328	IMBOTPDDQONINO-FVCZOJIISA-N	445.564	1.495	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)Cc3ccccc3)[C@H]2C1	1790957571	SNKKKVSYXBVSEO-HILJTLORSA-N	439.350	1.353	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccnc(Cl)n3)C[C@@H]21	1791058630	ACDADNBPSFOHSO-BLFANLJRSA-N	431.718	1.507	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(-c4ccccn4)[nH]n3)C[C@@H]21	1791255066	CXCQYWYUZXSKEM-XLPNERPQSA-N	447.923	1.319	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc4ncnn4c3)C[C@@H]21)C(Cl)Cl	1791296619	NVQNQCMMECVLEP-IHRRRGAJSA-N	426.304	1.055	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/C(=O)NCc1ccccc1)C2	1793448014	VDALBIIUOZACMN-GXZUIMCBSA-N	447.963	1.856	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnc(-c2ccccn2)nc1	1794261194	LJPZHNJEWIJHMR-DFGXFYAUSA-N	429.908	1.759	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cccs1	1795826164	YLMBNIAGXUQKFM-BHTPPFENSA-N	443.529	1.014	50	20	IDGD	
Cc1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)cc2c[nH]nc12	1796189484	SZTCRVAIDBVOOO-ACDBMABISA-N	432.289	1.117	50	20	IDGD	
COc1ccc([C@@H]2C[C@H]2C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)cc1	1796189952	NRQFBBWTROKSBN-XLGPZGCCSA-N	448.328	1.431	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)c1ccnn1-c1ccccc1	1796191111	ZZQRKBVOJOSLBV-NUZGMZIFSA-N	444.300	1.118	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCc1cnn(C)c1	1796218193	LZWWPMQWSXUKBW-DHMPJCMBSA-N	439.520	1.125	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2n(n1)CCCC2	1797442971	AEHKBQCPZMEMAX-JFILPPLUSA-N	425.327	1.206	50	20	IDGD	
CC(C)(C)c1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)c[nH]1	1798440825	WYULBBBIRIWGMW-MUJYYYPQSA-N	438.532	1.876	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc3ccoc3c1)C2	1798443048	OQZQAKTZTLQJIP-BJWYYQGGSA-N	433.468	1.997	50	20	IDGD	
CC(C)n1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)CBr)C3)n1	1798721405	SPOYXQHIVPIEQN-AYDFFVQHSA-N	427.343	1.698	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc3[nH]ncc3c1)C2	1799277573	YIZBOEVRRHYMCD-KYZVSKTDSA-N	426.304	1.397	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)Cc1ccccc1)C2	1799279795	UAYVVDUIUHJQAY-YPLULLRNSA-N	429.344	1.416	50	20	IDGD	
COc1ccc([C@H](O)C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Br)cc1	1799343163	OQQGAXRJESKQHE-URLPEUOOSA-N	445.285	1.009	50	20	IDGD	
COc1cccc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Br)n1	1799344938	YMAYYSKWWZWYCU-LZDSYCOUSA-N	444.301	1.303	50	20	IDGD	
CN(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C(C)(C)F)C2)NC(=O)NCc1ccccc1	1799864840	QDDZWFWMZCTNCR-BCDXTJNWSA-N	433.528	1.719	50	20	IDGD	
COc1ccc(F)c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)Br)c1	1800762466	BOTMMJYCFXKRRV-OVZMXSCWSA-N	429.286	1.821	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccnc(Br)c1)C2	1800977064	QKSKQFNTRJETMG-XFMPKHEZSA-N	446.729	1.301	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(-c3ccccc3)[nH]n1)C2	1800978333	ALUPORYIFSHXPK-RCJHGTSTSA-N	432.908	1.534	50	20	IDGD	
CCCNC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)[C@@H](Cl)COC)[C@H]1c1cccnc1	1803449222	ZGEHMGQTXNFDPS-ZWOKBUDYSA-N	438.956	1.648	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)CSC1=S	1804334594	TVMJFBZZMHFKQY-WISYIIOYSA-N	448.408	1.516	50	20	IDGD	
O=C([C@H](O)CCl)N1CCCC2(CCN(C(=O)[C@@H]3CC(c4ccccc4)=NN3)CC2)C1	1805525853	HDTJHWNEBHIKHF-RBUKOAKNSA-N	432.952	1.584	50	20	IDGD	
C[C@@H](CS(C)(=O)=O)C(=O)N1CCCC2(CCN(C(=O)[C@@H](F)Br)CC2)C1	1806046591	MBEGNDCTQHLOII-QWHCGFSZSA-N	441.363	1.589	50	20	IDGD	
O=C(CNc1ccc(F)cc1)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1	1807060955	FFNHYLAQJJPBOS-ZAAXVRCTSA-N	434.899	1.938	50	20	IDGD	
Cc1cccc(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)n1	1807361630	GTKWAHSWCKYSKV-DENIHFKCSA-N	444.300	1.098	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)N1CC[C@@H](CNC(=O)CO[Si](C)(C)C)[C@@H]1c1cccnc1	1810545646	BWNNURIGJVHBBO-SYNHAJSKSA-N	432.597	1.630	50	20	IDGD	
O=C(COc1ccc(O)nn1)NC[C@H]1CCN(C(=O)C(Cl)Cl)[C@H]1c1cccnc1	1812353462	QBGRREZDYFXNDK-WBMJQRKESA-N	440.287	1.466	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2c(F)c(C)nn2C)[C@@H]1c1cccnc1	1813029527	OPWDWCMGSVDFPI-HLLBOEOZSA-N	437.903	1.836	50	20	IDGD	
Cc1ccc(CC(=O)NC[C@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)o1	1813515036	PZZCTINZKZYZPP-JPYJTQIMSA-N	441.532	1.605	50	20	IDGD	
COC1(CC(=O)NC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)CCC1	1813676710	XXDHCRVYBMWCBC-AVRDEDQJSA-N	445.564	1.420	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3[nH]nc4ccncc34)sc2C1	1816866431	WZSWNSKGHAGMLB-MWLCHTKSSA-N	434.909	1.894	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cncs2)[nH]n1)c1ccc(B(O)O)cc1	1817471366	WNDQFXDUKFMXLL-HNNXBMFYSA-N	425.279	1.166	50	20	IDGD	
N#Cc1ccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)cc1	1817476931	UGPYIOFAXSFZPA-FQEVSTJZSA-N	443.272	1.581	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2c[nH]c(=O)cn2)[nH]n1)[C@@H](F)Br	1820935868	WBNLWEJELCEIAD-GXFFZTMASA-N	427.234	1.489	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H]2CNC(=O)C2)n[nH]1	1821962362	ROEMZLNWKHBUSE-NTZNESFSSA-N	426.315	1.711	50	20	IDGD	
COc1cc(OC)cc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@H](O)CCl)CC3)c1	1822110429	IKOUJVRBRCACCA-IAQYHMDHSA-N	439.921	1.986	50	20	IDGD	
Cc1cc(C(=O)NCC(=O)N2CCCC[C@H]2c2cc(NC(=O)C(Cl)Cl)n[nH]2)no1	1822423752	KCDHBUNGAAXHEG-LBPRGKRZSA-N	443.291	1.932	50	20	IDGD	
O=C(/C=C/C1CCCC1)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(B(O)O)cc1)CC2	1822936705	VOZPZPXPGSPYQS-QJXUFPCYSA-N	439.346	1.795	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CNCP(=O)(O)O)CC1	1824614045	DPWGRTKBBMTXCF-HOTGVXAUSA-N	437.905	1.738	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CSc1ncccn1)CC2	1825998929	KFOJWYMXWXCCQV-QWRGUYRKSA-N	441.966	1.891	50	20	IDGD	
N#Cc1cccc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)c1	1827056987	ZMNWCXZFBGGGRP-QHCPKHFHSA-N	445.328	1.785	50	20	IDGD	
C[C@@]1(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)CC2)CC1(F)F	1828925272	IDWXBNWTQPROSQ-UWJYYQICSA-N	449.502	1.964	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3CNc4ccccc43)C2)C1	1830359085	LIUCBOCXLZJXRG-VGOFRKELSA-N	435.952	1.917	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccnc(Cl)n3)C2)C1	1831652365	ZJGGWFSDIUTYAL-SCLBCKFNSA-N	431.320	1.608	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)n3ccnc3C)C2)C1	1831658822	IORKLGASWXUDOZ-KNBMTAEXSA-N	426.945	1.616	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3ccc4c(c3)OCO4)CC2)CC1)[C@H](O)CCl	1833310558	RLTWTZSSBDGLAL-QGZVFWFLSA-N	437.924	1.200	50	20	IDGD	
Cc1ncoc1C(=O)N1CCC(N2CCC(NC(=O)CCBr)CC2)CC1	1834421249	WOVOPJUQHLSRTA-UHFFFAOYSA-N	427.343	1.953	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)CCc3cnn(C)c3)CC2)CC1	1834821528	PQLKHUQGWHLDTI-IBGZPJMESA-N	439.988	1.178	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)c3cc(O)ccc3F)C2)C1	1834824228	YNYLILXCYLAHPR-GOSISDBHSA-N	445.285	1.386	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccccc3)CCO2)C1	1834990895	TXRFEZVVEWCCOV-UZLBHIALSA-N	439.350	1.717	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)CCc3ccc(O)nn3)CC2)CC1)[C@@H](F)Cl	1835081407	OUHKXYCQKLUCAL-GOSISDBHSA-N	427.908	1.221	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCN3CCCCC3)CCO2)C1	1835128838	ONUFFDTZJGSDEY-NQIIRXRSSA-N	429.989	1.726	50	20	IDGD	
C[C@H](Nc1cnccn1)C(=O)NC1CCN(C2CCN(C(=O)C(Cl)Cl)CC2)CC1	1835750493	LOJLMJPUNDIAFA-ZDUSSCGKSA-N	443.379	1.652	50	20	IDGD	
C[C@H](Cn1ccnc1)C(=O)N1CCC(N2CCC(NC(=O)CO[Si](C)(C)C)CC2)CC1	1835837373	FOZIMLNMNUNNMJ-GOSISDBHSA-N	449.672	1.942	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC1CCN(C2CCN(C(=O)CC3(O)CCC3)CC2)CC1	1835837426	HATFKZITIDBNAC-UHFFFAOYSA-N	425.646	1.715	50	20	IDGD	
O=C(Cc1ccc2c(c1)CCCO2)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1836680085	QHDAWAYLZYBMPV-CTNGQTDRSA-N	440.899	1.545	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)C#CC3(O)CCCCC3)CCO2)C1	1837492078	ABFQUYZAYRJWMU-UTKZUKDTSA-N	426.941	1.159	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)OC(C)C)CCO2	1837604046	SFFZWHZJDZJNEW-VKJFTORMSA-N	435.359	1.430	50	20	IDGD	
C/C=C/C=C\C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1	1837920095	LNJWWXVCQAYUMB-IAROGAJJSA-N	426.322	1.111	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3[nH]cc4c3CCC4)C2)C1	1839153695	OOKKOLMGFYZDIQ-UXHICEINSA-N	444.359	1.810	50	20	IDGD	
O=C(/C=C/c1ccco1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839197660	DUEAVQCMPBMMPU-GILVVUIESA-N	431.258	1.440	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc4cccnn4c3)CCO2)C1	1839559075	MPRALRCXYWJJDX-OAQYLSRUSA-N	434.924	1.669	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(F)cc(F)c3)C2)C1	1840034357	ISGWOWJGTJRMAV-SGTLLEGYSA-N	447.276	1.818	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)c(F)c1	1840034654	SBFBHUIOHNCCDF-LIRRHRJNSA-N	443.313	1.988	50	20	IDGD	
C[C@@H]1CCc2c(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)C(Cl)Cl)CCO4)n[nH]c21	1840188501	NGMYNXMMDHGBCT-ADLMAVQZSA-N	431.320	1.333	50	20	IDGD	
N#Cc1ccc(F)c(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)c1	1840189206	CPMZMSMYDPTZHV-SFHVURJKSA-N	430.263	1.571	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2cc(-c3ccccc3)on2)C1	1840994789	JDYLJNZMZZVZQX-UHFFFAOYSA-N	446.467	1.471	50	20	IDGD	
Cc1cc(Br)c(N)cc1C(=O)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1	1841350767	WRCOYDOPGJBPGG-AWEZNQCLSA-N	430.730	1.756	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@H]1C[C@@H](O)CN1C(=O)OC(C)(C)C)C2	1841671032	YZSGFAMIZBWNNU-PMPSAXMXSA-N	443.972	1.968	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)CCc2ccc(C)nc2)C1	1842023724	GCPPOHLWHIVTBB-YZSQISJMSA-N	436.516	1.660	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC2(CCCN2C(=O)c2cc(O)n[nH]2)C1	1842982610	ASKIOPHQLMXTSX-LBPRGKRZSA-N	427.889	1.064	50	20	IDGD	
O=C(NC1(C(=O)N2CCCC23CN(C(=O)[C@H](O)CCl)C3)CC1)OCc1ccccc1	1843927479	OOEBDWQVQXZNQQ-MRXNPFEDSA-N	435.908	1.249	50	20	IDGD	
O=C([C@@H](O)CCl)N1CC2(CCCN2C(=O)c2cn3cc(Br)ccc3n2)C1	1844097221	RRPYBYNNVSIUGF-ZDUSSCGKSA-N	441.713	1.514	50	20	IDGD	
COc1ccc(C(=O)N2CCCC23CN(C(=O)[C@@H](O)CCl)C3)nc1Br	1844612725	VIXUSTCJGMXWNU-NSHDSACASA-N	432.702	1.269	50	20	IDGD	
CCc1cc(C(=O)N2CC3(CCCN3C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)n[nH]1	1844692257	BAKZGINBSFYTMP-UHFFFAOYSA-N	441.444	1.936	50	20	IDGD	
C[C@H]1Oc2ccc(C(=O)N3CCCC34CN(C(=O)[C@@H](F)Br)C4)cc2NC1=O	1844730162	BMYFCHVQMKFKRH-QMTHXVAHSA-N	440.269	1.914	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)CN2CCN(C(=O)OC(C)(C)C)CC2)C1	1846967015	HSSWUZSUZZFUDH-INIZCTEOSA-N	442.988	1.760	50	20	IDGD	
O=C(CCSc1ccc(F)cc1)NNC(=O)CCn1c(=O)[nH]c(=O)c2ccccc21	12683266	MQRMWEMKUDCJIO-UHFFFAOYSA-N	430.461	1.549	50	20	IDGD	
CC(=O)Nc1ccc(C=NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1	12727699	MNPLFNOFDCZDFL-UHFFFAOYSA-N	430.486	1.430	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)C1=Cc2ccccc2OC1	15633410	KKAKLGGXSLUFKO-UHFFFAOYSA-N	427.482	1.708	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)CCc2cnn(-c3ccccc3)c2)c1	16177999	SQSOFLKOUPXOPH-UHFFFAOYSA-N	441.513	1.516	50	20	IDGD	
Cc1cc(Cl)ccc1O[C@H](C)C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	104497428	BACIVKZLXHDQOZ-ACJLOTCBSA-N	448.859	1.946	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NC[C@@H](O)c1ccccc1C(F)(F)F	725873752	QRDXBFPSLVFMCL-GFCCVEGCSA-N	430.408	1.561	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=S)NCC(N)=O)c3ccccc3n2)cc1OC	727068441	WAESWBSEYGGTIL-UHFFFAOYSA-N	439.497	1.513	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cnc(-c3ccccn3)s2)cc1	727671686	IRQONNKXJHRHKB-UHFFFAOYSA-N	445.526	1.595	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2c(Cl)cccc2Cl)cc1	727804633	KIUFRKIEBAPYQK-UHFFFAOYSA-N	446.312	1.993	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(n2cc(C(=O)NNC(=S)NCC3CCC3)nn2)CC1	727865426	PBTVETMCULTRKS-UHFFFAOYSA-N	437.570	1.759	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)N([C@H]2CCS(=O)(=O)C2)N(C)C)ccc1C	728179556	LWRCBXZABQSUEN-INIZCTEOSA-N	431.580	1.131	50	20	IDGD	
Cc1cccc(C)c1OCC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	728213005	QPRSPYJYPCZALX-UHFFFAOYSA-N	432.546	1.762	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)CCc3nc4ccccc4[nH]3)cc2)CC1	728213298	JBVWTZUKGLNCOT-UHFFFAOYSA-N	442.545	1.575	50	20	IDGD	
COC(=O)[C@@H](C)Sc1ccccc1C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	728845917	PVPSDEIIMFJBCP-CQSZACIVSA-N	443.529	1.808	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NNC(=O)c1cccc(C#N)c1	728942273	NVRHNVIIYMYIJO-LLVKDONJSA-N	446.261	1.763	50	20	IDGD	
O=C(Cc1cc[nH]n1)NNC(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1	730102453	DTTFCBJLWMVPKQ-UHFFFAOYSA-N	440.382	1.943	50	20	IDGD	
CC(C)[C@@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1)N(C)C	730104323	RARFVFJMKIKQSV-IBGZPJMESA-N	432.546	1.512	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2cccc3ncccc23)c(C(=O)OC)s1	730204075	QWDVXUDTCAXCFB-UHFFFAOYSA-N	449.466	1.493	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCCC(=O)NNC(=O)c2cccc3ncccc23)cc1C	730227991	TYMCSYQHORMDSU-UHFFFAOYSA-N	426.498	1.981	50	20	IDGD	
COc1cccc([C@H](CNC(=O)NNC(=O)COc2ccccc2O)N2CCCC2)c1	730904747	PFIYYEYZEBCXIU-SFHVURJKSA-N	428.489	1.947	50	20	IDGD	
COC1CCN(C2(CNC(=O)NNC(=O)Cc3nc4ccccc4n3C)CCCC2)CC1	730913633	HPTUOPZIZLIEHL-UHFFFAOYSA-N	442.564	1.870	50	20	IDGD	
C[C@H](C(=O)NNC(=O)c1nnc(O)c2ccccc12)N1CCN(c2ccc(F)cc2)CC1	732257051	CVVXCAYIVIFVIL-CQSZACIVSA-N	438.463	1.446	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)c2cccc(NC(=O)c3cccnc3)c2)C[C@@H](C)O1	732261489	MYZDSBFQWUCPJH-HZPDHXFCSA-N	425.489	1.594	50	20	IDGD	
CC(C)C[C@H](C(=O)NNc1ccccc1S(C)(=O)=O)N1C(=O)[C@H]2CC=CC[C@H]2C1=O	732305270	GHKCKKCVYVMXQM-HLLBOEOZSA-N	433.530	1.899	50	20	IDGD	
N#Cc1ccc(N2C(=O)N[C@H](CCC(=O)NNC(=O)Cn3ccc4ccccc43)C2=O)cc1	733760464	ASVPMELXODKWJO-GOSISDBHSA-N	444.451	1.566	50	20	IDGD	
Cc1nc2c(c(C)nn2C)c(C)c1CC(=O)NNC(=O)NCCNC(=O)OC(C)(C)C	734240820	USQPMIVRCQKXFA-UHFFFAOYSA-N	433.513	1.291	50	20	IDGD	
Cn1ncc(C(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)c1-n1cccc1	734825403	DRJUBWQLQZSDCI-UHFFFAOYSA-N	431.497	1.554	50	20	IDGD	
O=C(COC(=O)[C@@H]1C[C@H]1c1c(F)cccc1F)NNC(=O)[C@H]1COc2ccccc2O1	734924240	SKBUNXKAFYJWFZ-PSTGCABASA-N	432.379	1.599	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)[C@@H]2CCC[C@H](C(F)(F)F)C2)CC1	735118891	ZKTBRYIYKRFSOG-KGLIPLIRSA-N	449.499	1.830	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)N[C@@H]2CCN(c3cnn(C)c3)C2=O)N(C)c2ccccc21	735477791	VALKBVOCJLAPAQ-QGZVFWFLSA-N	447.499	1.312	50	20	IDGD	
CCO[C@H]1CC(=NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)C1(C)C	736429573	XMXPMFSRUUKORD-IBGZPJMESA-N	437.562	1.947	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)Cc1ccc(S(=O)(=O)N2CCCC2)s1	737629381	OLMRMVUCRIYENZ-UHFFFAOYSA-N	437.543	1.439	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)CC[S@@](=O)c2ccc3c(c2)OCCO3)cc1C	740749347	VUGCULHJGJSWBQ-SSEXGKCCSA-N	432.498	1.799	50	20	IDGD	
CC(=O)N[C@@H](Cc1c[nH]c2ccc(Br)cc12)C(=O)NNC(=O)c1ccc[nH]1	742037947	BJSMMQPBHWHKIQ-INIZCTEOSA-N	432.278	1.767	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2ccc(C(=O)O)cc2F)ccc1OC(C)C	743251737	VXTNXPZAXYPLHW-UHFFFAOYSA-N	426.422	1.943	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC(C(=O)NNc3ncnc4[nH]cnc34)CC2)c(C)c1	743471110	RDSPYZSTQUPVIZ-UHFFFAOYSA-N	429.506	1.514	50	20	IDGD	
NS(=O)(=O)c1cnn(CC(=O)NNc2c(Cl)cc(Br)cc2Cl)c1	743719129	XAPDWDNIBDVTIC-UHFFFAOYSA-N	443.110	1.743	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)CNc2ccccc2[N+](=O)[O-])c1	743841882	CMYJDCLERWVXOJ-UHFFFAOYSA-N	449.489	1.498	50	20	IDGD	
CCOc1ccc(OCC(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)cc1	744620228	HICPCSMTNFSDSF-UHFFFAOYSA-N	435.502	1.628	50	20	IDGD	
C[C@H](CCc1cccc(F)c1)C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	745585713	SYTLABQACFDGDF-KUHUBIRLSA-N	430.432	1.925	50	20	IDGD	
Cc1ccc(S(=O)(=O)Nc2ccc(F)cc2)cc1C(=O)NNC(=O)C(=O)N1CCCC1	748247110	ULXHWBMTFMDPPN-UHFFFAOYSA-N	448.476	1.318	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)Cc3n[nH]c4ccccc34)cc2)CC1	748620883	VGGHVHVPKQDEJD-UHFFFAOYSA-N	428.518	1.185	50	20	IDGD	
CNS(=O)(=O)c1csc(C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)c1	748689122	HKFBGDCQUMUVCI-UHFFFAOYSA-N	449.514	1.022	50	20	IDGD	
C[C@@H](Sc1ccnc2cc(Cl)ccc12)C(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1	749927695	UTCGHBANAJDWHA-ZYHUDNBSSA-N	442.950	1.886	50	20	IDGD	
CN(C)C(=O)[C@@H](NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)c1ccccc1	750155743	SJZRKGQHARINAH-FQEVSTJZSA-N	444.557	1.925	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)ccc1[N+](=O)[O-]	751042317	ADWWKGJKXWGMEL-UHFFFAOYSA-N	427.461	1.577	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2ccc3[nH]c(=O)ccc3c2)cc(OC)c1OC	751142890	UUIBUHSNSXDLJQ-UHFFFAOYSA-N	433.442	1.177	50	20	IDGD	
C[C@H](NC(=S)NNC(=O)CCCNS(=O)(=O)c1ccc2c(c1)CCCC2)C1CC1	751619095	SLDILQMICWMYID-AWEZNQCLSA-N	438.619	1.918	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1)S(C)(=O)=O	754098815	BFBWPDUSNCQLSS-UZLBHIALSA-N	444.557	1.377	50	20	IDGD	
COc1cc(CN2CC[C@@H](NC(=O)NNC(=O)c3ccccc3OC)C2)cc(OC)c1	755156900	JVAYGQRRFVXEAR-MRXNPFEDSA-N	428.489	1.931	50	20	IDGD	
COC(=O)CNC(=O)c1ccc(NC(=O)NNC(=O)c2ccc(OC)c(OC)c2)cc1	755547225	NQGKFFXFYUGWSY-UHFFFAOYSA-N	430.417	1.073	50	20	IDGD	
C#CCOc1cc(F)ccc1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	756741088	BQSDFXHVSXZYMY-UHFFFAOYSA-N	434.449	1.555	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)Nc1ccc(C(=O)NC2CCOCC2)cc1	757618974	IUKFPQRABKIFIO-UHFFFAOYSA-N	427.417	1.970	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)N[C@H](CC(N)=O)C2CCOCC2)c(C)n1C[C@H]1CCCO1	757694884	ZUBUGRHJJFQDQG-OXWYEDHGSA-N	428.533	1.978	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)Nc1cccc(C(=O)NCc2ccccc2)c1	757802081	ZOJHITCEEKCCIS-MRXNPFEDSA-N	430.486	1.204	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2cccc3c2OCCC3=O)cc1	757978779	SDZYIJVBYLIKJL-UHFFFAOYSA-N	446.485	1.434	50	20	IDGD	
CCN(CC)[C@H](C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)c1cccc(C(F)(F)F)c1	758043676	JGWDUDORLUKEHY-RISCZKNCSA-N	438.472	1.173	50	20	IDGD	
N#Cc1ccc(N2CCC[C@@H]2C(=O)N2CCN(S(=O)(=O)CBr)CC2)cc1	758514098	ZHTCHSXKZBVQAH-MRXNPFEDSA-N	441.351	1.353	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)c1ccc([C@@]2(C)NC(=O)NC2=O)cc1	762350623	PPWMWOQJJDAKOU-HXUWFJFHSA-N	428.470	1.303	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)c2ccc3nnc(O)n3c2)cc(OCC)c1OCC	762679952	CPZVEILROBFMTR-UHFFFAOYSA-N	429.433	1.706	50	20	IDGD	
COC(=O)c1ccc(N2CCCC2)c(NC(=O)C(=O)NNC(=O)c2cc(C)oc2C)c1	763575980	CLXQSLSMHXKWOR-UHFFFAOYSA-N	428.445	1.683	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2ccc(C(=O)c3nccn3C)cc2)c1	763645280	TWMFPAYVCHFTME-UHFFFAOYSA-N	449.467	1.433	50	20	IDGD	
CCCc1ccccc1NC(=O)C(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1	763739094	ZGXVKIMNDQVNDT-UHFFFAOYSA-N	446.529	1.354	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CNC(=O)c2cccnc2)ccc1OCc1ccccc1	763819222	VKEFJLPUVKQHDU-UHFFFAOYSA-N	434.452	1.860	50	20	IDGD	
CCc1nnc(-c2ccc(NC(=O)C(=O)NNC(=O)COc3ccc(F)cc3)cc2)o1	763841542	SKYQOLYQRNKOKE-UHFFFAOYSA-N	427.392	1.603	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccccc1C(=O)N1CCCC1	763863741	BPRLFQQHCXHYCJ-AWEZNQCLSA-N	442.447	1.615	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1cccc(C(=O)NC(C)(C)C)c1	763865404	PNORYRREKCNFKY-ZDUSSCGKSA-N	444.463	1.907	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(Cl)c(C#N)c2)cc1	763872517	NWPMXOYVZKPCPP-GFCCVEGCSA-N	428.832	1.968	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccn(CCC(C)C)n2)cc1	763872578	OQCKRZSSOIAKJF-OAHLLOKOSA-N	429.477	1.685	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1ccc(O[C@H]2CCOC2)cc1	764003664	FYJFOAIERSWYJO-INIZCTEOSA-N	427.413	1.025	50	20	IDGD	
CS(=O)(=O)CCc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3c2)cc1	764064049	BZAMZVGMXBIBHJ-UHFFFAOYSA-N	439.493	1.827	50	20	IDGD	
CC(C)Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc(F)cc2Br)n(C)n1	764084865	IZOUKVKUMDNJLW-UHFFFAOYSA-N	440.273	1.920	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)nc1)C(=O)Nc1ccc(CN2C(=O)CSC2=O)cc1	764100290	LSWGSKIXBRZWNJ-UHFFFAOYSA-N	447.860	1.330	50	20	IDGD	
CCN(CC)CCOc1ccccc1NC(=O)C(=O)NNC(=O)c1ccc(Cl)nc1	764101132	OLNQSHRQNYHJMC-UHFFFAOYSA-N	433.896	1.855	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2cccc(CS(C)(=O)=O)c2C)cc1	764124994	PXHXCYCMXRGMPM-UHFFFAOYSA-N	447.513	1.267	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1cc(F)c(N2CCCC2)c(F)c1	764138401	DBSBIICBOZRIGS-UHFFFAOYSA-N	432.427	1.902	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(-n3cccn3)c(F)c2)o1	764138676	HQWTTZIICZSNLG-UHFFFAOYSA-N	442.451	1.846	50	20	IDGD	
Cc1ccc(-n2c(NNC(=O)[C@H]3CN4CCCN3CC4)nc3ccccc3c2=O)c(C)c1	764238150	SVCFXEWTQXAKKZ-OAQYLSRUSA-N	432.528	1.836	50	20	IDGD	
O=C1CCc2cc(F)c(NC(=O)C(=O)NNC(=O)c3cccc(OC(F)F)c3)cc2N1	764250812	NYUIEBLSIYPOGI-UHFFFAOYSA-N	436.346	1.712	50	20	IDGD	
O=C(NNC(=O)c1cccc2ncccc12)C(=O)Nc1ccccc1CN1C(=O)CCC1=O	764260294	PCWJIFFYAQBSCK-UHFFFAOYSA-N	445.435	1.284	50	20	IDGD	
COC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2cc(F)ccc2Br)c1	764270295	KOIXAJCHLFZVHP-UHFFFAOYSA-N	438.209	1.775	50	20	IDGD	
CC(C)Cc1cc(NC(=O)C(=O)NNC(=O)c2cc(F)ccc2Br)n(C)n1	764270695	QGDYIOKMUOKSSO-UHFFFAOYSA-N	440.273	1.920	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)CCc2ccccc2O)ccc1N1CCSCC1	764281462	XMLYSCQQESAXOY-UHFFFAOYSA-N	442.541	1.973	50	20	IDGD	
CNC(=O)COc1ccc(C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)cc1OC	764329182	SEZOUBDASIGNCW-UHFFFAOYSA-N	448.426	1.747	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C(=O)Nc1ccc(S(=O)(=O)NC2CC2)cc1)c1ccccc1	764329253	VTXYCYRKBBFEHZ-SFHVURJKSA-N	444.513	1.407	50	20	IDGD	
CCCNS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@H](CC)c2ccccc2)cc1	764329832	OUISOGOMKNLBES-GOSISDBHSA-N	446.529	1.655	50	20	IDGD	
COCCOc1cc(C)ccc1NC(=O)C(=O)NNC(=O)c1cnn(-c2ccccc2)c1	764345738	JSBAGIOTSFVNQG-UHFFFAOYSA-N	437.456	1.606	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)c(Cl)c1)C(=O)Nc1ccccc1CN1CCSCC1	764349597	QUCOVMBYTMTYTQ-UHFFFAOYSA-N	448.932	1.994	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cc(C(=O)OC)cs3)n[nH]2)cc1	764385157	TYAYXFSXLXJNCK-UHFFFAOYSA-N	441.469	1.887	50	20	IDGD	
COC(=O)Cc1ccccc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccc(C)c(C)c2)[nH]n1	764388609	UCVXORDRXHDJBH-UHFFFAOYSA-N	449.467	1.809	50	20	IDGD	
O=C(NNC(=O)N1Cc2ccc(Br)cc2C1)c1ccc(-n2cnnn2)cc1	765195398	QPHIURBHUSHDLY-UHFFFAOYSA-N	428.250	1.795	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3cccc(-n4cccn4)n3)n[nH]2)cc1OC	765597386	SBERADHTAGGKOC-UHFFFAOYSA-N	433.428	1.749	50	20	IDGD	
CC(=O)Nc1ccc(F)c(C(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)c1	765748716	FWCGZDMYPZTRRF-UHFFFAOYSA-N	441.507	1.671	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2cc([N+](=O)[O-])c(C)cc2C)cc1	766241106	JAOIVHSOKFFEQZ-UHFFFAOYSA-N	449.489	1.993	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)CN1CCO[C@H]([C@H](C)NC(=O)OC(C)(C)C)C1	766946068	XERJTOPNKQWIQJ-WMZOPIPTSA-N	434.537	1.299	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cccc(-c3nc[nH]n3)c2)c1	767187749	VYRPCICNVZUDIH-UHFFFAOYSA-N	442.501	1.577	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)c1ccc(N2C[C@@H](C)O[C@H](C)C2)nc1	767281744	FNIOJUZTSBWUTC-IAGOWNOFSA-N	440.500	1.551	50	20	IDGD	
COc1ccc(NNC(=O)c2ccc(S(=O)(=O)CC(=O)N(C)C)cc2)c([N+](=O)[O-])c1	768338117	FYLFUZBPAZGFIX-UHFFFAOYSA-N	436.446	1.222	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(Br)s1)NN=c1cc[nH]cc1Cl	768444092	MDKNESJGZGKNGP-UHFFFAOYSA-N	425.717	1.403	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)Nc1ccc(-n2ncn(C)c2=O)cc1	769239425	GDEPVZDYVQIHEG-UHFFFAOYSA-N	432.462	1.132	50	20	IDGD	
C[C@@]1(c2ccc(F)c(Cl)c2)NC(=O)N(CC(=O)NNC(=S)NCC2CCC2)C1=O	770227580	NWCWPXRVRVVAPG-SFHVURJKSA-N	441.916	1.542	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)COc1ccccc1Cc1ccccc1)[C@@H]1CN(C)CCO1	770434931	IQPZBJGRFCISFU-UWJYYQICSA-N	426.517	1.706	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)N[C@H]1CCN(c2ccccc2C(N)=O)C1	770514470	PYYJINSWOUXNFW-HIFRSBDPSA-N	445.907	1.816	50	20	IDGD	
COC(=O)c1cc(C)ccc1S(=O)(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	771606897	YWRXVHAOGWROGG-UHFFFAOYSA-N	439.877	1.061	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)[C@@H]1CC(=O)N(c2ccccc2Br)C1	771986274	VWHXXULRGJSLHQ-WDEREUQCSA-N	426.267	1.291	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)[C@H]1CCCN1C(=O)c1ccc2c(c1)OCO2	772066631	ZLOMKYHPEPHHEI-UKRRQHHQSA-N	433.461	1.145	50	20	IDGD	
CCn1cc(S(=O)(=O)NNC(=O)c2cc(C)n(-c3ccccc3)c2C)c([N+](=O)[O-])n1	772569198	RDEHGFVQWRFLHN-UHFFFAOYSA-N	432.462	1.842	50	20	IDGD	
CCOc1ccc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)c3nc[nH]n3)cc2)cc1	773251158	JBJPRGDTJRRBLA-UHFFFAOYSA-N	430.446	1.079	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(I)cn2)c(C)o1	773519471	HUTQCWGPNIVZJF-UHFFFAOYSA-N	428.186	1.296	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccnn1Cc1ccccn1	774000963	AWECAYHWDNRXEK-CYBMUJFWSA-N	442.863	1.533	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)Nc2cnn(Cc3nnc4n3CCCC4)c2)nc2ccccc21	775207270	SOTVCQGHVGQNID-UHFFFAOYSA-N	448.491	1.141	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)Nc1ccc(C[C@H]2NC(=O)NC2=O)cc1	775702688	MDINNBWAILHMEW-CQSZACIVSA-N	443.485	1.391	50	20	IDGD	
CN(NC(=O)CCNC(=O)C1CCCCC1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776205484	MAVRGDGUPOVCBX-UHFFFAOYSA-N	439.557	1.709	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)[C@H]1CC(=O)N(C2CC2)[C@H]1c1cccc(OC)c1	776707755	UNDIFDCSUIBNMZ-HKUYNNGSSA-N	430.505	1.199	50	20	IDGD	
CCOc1ccc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)c3ccncn3)cc2)cc1	778285260	ZMIQHMCUMOODKT-UHFFFAOYSA-N	441.469	1.751	50	20	IDGD	
CCOc1cc(/C=C/C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)ccc1O	780957307	SBMPBHDDULEHSF-CSKARUKUSA-N	447.513	1.968	50	20	IDGD	
O=C(c1cn(-c2cccc(Cl)c2)nn1)N1CCN(S(=O)(=O)CBr)CC1	780990901	IXYJNHKMPNHSPG-UHFFFAOYSA-N	448.730	1.361	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)CN1CCC[C@H](S(=O)(=O)NC2CCCC2)C1	782056180	QHPVCOFFSZVCGZ-IBGZPJMESA-N	436.578	1.011	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C(=O)Nc2ccnn2Cc2ccccc2)nc2ccccc21	782888747	VYEIXGBQEFWAPS-UHFFFAOYSA-N	431.456	1.147	50	20	IDGD	
O=C(NNc1ncccc1C(F)(F)F)C(=O)Nc1cccc(S(=O)(=O)NC2CC2)c1	783119319	BCSFLKVIQYKHMC-UHFFFAOYSA-N	443.407	1.623	50	20	IDGD	
O=C(Cn1cc(NC(=O)C(=O)NNc2c(Cl)cc(F)cc2Cl)cn1)NC1CC1	784880924	HZRZSXDZDHJCJF-UHFFFAOYSA-N	429.239	1.689	50	20	IDGD	
COC(=O)CNC(=O)c1ccc(NC(=O)C(=O)NNc2cccc(C(F)(F)F)n2)cc1	784951252	GMSRXYALSZKNGU-UHFFFAOYSA-N	439.350	1.085	50	20	IDGD	
CC(C)OC(=O)c1c(NC(=O)C(=O)NNc2nccn(C)c2=O)sc2c1CC[C@H](C)C2	785090448	RXCUQHJSTFLAPS-NSHDSACASA-N	447.517	1.614	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2ccc(N3CCOCC3)cc2C)n1	785226506	IBAREETWFWKTSQ-UHFFFAOYSA-N	427.509	1.550	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1ccc(N(C)C)c(Cl)c1	785337519	GITLDKOHFJHKMQ-UHFFFAOYSA-N	440.909	1.900	50	20	IDGD	
C[C@H](O)C(=O)NNC(=O)CN(Cc1ccccc1)S(=O)(=O)c1ccc(Cl)cc1	786688619	TZUCSXDCTPVPRH-ZDUSSCGKSA-N	425.894	1.059	50	20	IDGD	
CS(=O)(=O)[C@H]1CCCC(=NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)C1	788433479	BAVQAEAVCYPJCK-SFHVURJKSA-N	440.997	1.917	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2ccc3c(c2)CCN(C(C)=O)CC3)cc1OC	790050211	NWWZQNJZKMZCHF-UHFFFAOYSA-N	447.513	1.274	50	20	IDGD	
O=C(NNc1nc2ccccn2n1)C(=O)Nc1ccn(-c2ncccc2C(F)(F)F)n1	792393980	JKSZHOZYDQIXEC-UHFFFAOYSA-N	431.338	1.411	50	20	IDGD	
CCOc1cc(C(=O)NNS(=O)(=O)c2c(C)cnn2C)cc(OCC)c1OCC	795280155	CXXTVBPAJWLRQE-UHFFFAOYSA-N	426.495	1.548	50	20	IDGD	
CCNC(=O)OC[C@@H]1CCCCN1CC(=O)NNC(=O)c1cc(Cl)ccc1OC	796171769	NFROHGRVPMZLKG-AWEZNQCLSA-N	426.901	1.710	50	20	IDGD	
O=C(NCCN1CCC2(CCCCC2)CC1)NNC(=O)c1ccc(-n2cnnn2)cc1	799353686	TYVCLTZJPKRPOO-UHFFFAOYSA-N	426.525	1.653	50	20	IDGD	
C[C@]1(c2cccc(C(=O)NNC(=O)Nc3ccc(OC(F)F)cc3)c2)NC(=O)NC1=O	802046991	YWZBPUUCHNOARZ-LJQANCHMSA-N	433.371	1.809	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)[C@@H]2CC(=O)N(c3ccc4c(c3)OCCO4)C2)cc1	802059611	MBIZAIAXLAMBFM-CYBMUJFWSA-N	426.429	1.672	50	20	IDGD	
COc1ccc(Cl)c(NC(=O)NNC(=O)c2cc(S(=O)(=O)N(C)C)c(C)o2)c1	802114282	YENURSPQHFDPMQ-UHFFFAOYSA-N	430.870	1.967	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NC[C@@H]2CC(c3ccc(OC)c(F)c3)=NO2)cc1	802342670	LVFUVAWUBKTHMW-INIZCTEOSA-N	446.435	1.745	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NN=c2cc[nH]cc2Cl)(S(C)(=O)=O)CC1	803110595	FLPUPFQOJIHUFE-UHFFFAOYSA-N	432.930	1.414	50	20	IDGD	
CCc1nnc(NC(=O)[C@H](C)[C@@H](C)NC(=O)NNC(=O)COc2cccc(C)c2)s1	804867052	FGWPSQMEEIMUFG-CHWSQXEVSA-N	434.522	1.781	50	20	IDGD	
C[C@@H]1[C@H](NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)CCN1Cc1ccccc1	807619828	BXFRRRLXMYOGII-DNVCBOLYSA-N	434.500	1.541	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)NCC(=O)NNc2ccc(Cl)cc2[N+](=O)[O-])cc1	810153848	FMYMHMHADJZAEW-UHFFFAOYSA-N	441.853	1.628	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)CNS(=O)(=O)c3c(C)noc3C)n[nH]2)c1	810584775	VCYHWTUVSJHHQQ-UHFFFAOYSA-N	446.489	1.038	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)c2csc(S(C)(=O)=O)c2)C1	819658059	HQYAYUMYYAHISE-NSHDSACASA-N	431.536	1.560	50	20	IDGD	
O=C(Cn1cnnn1)NNC(=O)c1ccc(CN2C(=O)c3cccc4cccc2c34)cc1	862057173	FTQYDYJWOMZEAG-UHFFFAOYSA-N	427.424	1.448	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@H](C)C(=O)NNC(=O)c1cnc2c(c1)c(O)nc(=O)n2C	893054655	HNSYBDVUDSMSEF-LLVKDONJSA-N	445.863	1.533	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2cccc(S(C)(=O)=O)c2)ccc1OC(C)C	903957305	MEWDGHRUVQULTM-UHFFFAOYSA-N	442.515	1.509	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)NCCc2ccc(S(N)(=O)=O)cc2)c1C	915883756	HQLIESHCGVUCOP-OAHLLOKOSA-N	434.518	1.291	50	20	IDGD	
CC(=NNC(=O)Cn1nnc(-c2ccccc2)n1)c1ccc(OCC(=O)N2CCCC2)cc1	915906968	JKEKUGJRZHTPNO-UHFFFAOYSA-N	447.499	1.882	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2cc(-c3c(C)nn(C)c3C)[nH]n2)c2ccccc2c1=O	916123322	ZKBHFBGFBRFNTQ-UHFFFAOYSA-N	434.460	1.232	50	20	IDGD	
O=C(NCc1ccc(N2CCCCCC2)nc1)NNC(=O)c1ccc(-n2cnnn2)cc1	916392675	HJQUTICUDCRSJA-UHFFFAOYSA-N	435.492	1.582	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNS(=O)(=O)c2cc(C(=O)O)cc3c2CCCC3)c1	917723575	QOHGQGXJGXCUAE-UHFFFAOYSA-N	434.470	1.904	50	20	IDGD	
Cc1nc(-c2ncccn2)sc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	917909151	MXHVUDKNQKWKCZ-UHFFFAOYSA-N	446.514	1.234	50	20	IDGD	
CS(=O)(=O)Nc1ccc(O)c(C(=O)NNC(=O)c2ccc(F)cc2Br)c1	919818739	RXLIWQPYNAUFHU-UHFFFAOYSA-N	446.254	1.740	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C2=NN(c3ccccc3)C(=O)[C@@H](C)N2)o1	920248706	PEBICGXUVGPWFN-CQSZACIVSA-N	426.477	1.221	50	20	IDGD	
CC[C@@H]1CN(C(=O)/C(C#N)=C/c2cn(CCC(N)=O)nc2-c2ccc(OC)cc2)CCO1	920854214	WKKRASAJGYDUKU-XYSGSMRZSA-N	437.500	1.978	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)Nc2cccc(CN3C(=O)CNC3=O)c2)c1	920930875	YNQMRJICSXILCC-UHFFFAOYSA-N	427.417	1.222	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)OCC(=O)N2CCC(C(N)=O)CC2)c(C)n1C[C@@H]1CCCO1	1115811384	AIJBYSVBIHYCSL-FHTAPLDASA-N	442.516	1.458	50	20	IDGD	
CCCNC(=O)CN1CCC(NC(=O)NNC(=O)c2ccc(Br)cc2)CC1	1317914340	LGYGEDPRTNFDNE-UHFFFAOYSA-N	440.342	1.384	50	20	IDGD	
CN(C)c1ccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)c2ccccc12	1777813465	FUBJMWMTZFZMOO-NZQKXSOJSA-N	445.947	1.949	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnn4cccnc34)C2)C1	1778445722	JEPNEPBFEZCPDB-QZTJIDSGSA-N	426.304	1.409	50	20	IDGD	
O=C(c1ccc2ncncc2c1)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1778603756	FXMVXTDMZWDEBV-QAPCUYQASA-N	437.269	1.764	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(CCN(C(=O)c3n[nH]c4ccc(F)cc34)C2)C1	1778622887	YQLRNEFBWMRFNC-GOSISDBHSA-N	439.285	1.931	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(CCN(C(=O)[C@H]3ON=C(c4ccccc4)O3)C2)C1	1778873529	QIYPUJZSTAKAKQ-NHCUHLMSSA-N	447.564	1.403	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(Cl)nn3)C2)C1	1779428916	STJCZNBDXFTFOP-BZNIZROVSA-N	431.718	1.605	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(CCN(C(=O)c3cc(-c4cccnc4)[nH]n3)C2)C1	1779607097	BEXSPYRZEPPIBK-IBGZPJMESA-N	448.321	1.700	50	20	IDGD	
C=C(CC(=O)OCC)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](Br)CC)CCO2	1781271555	DSTNYOIRNAKGPS-KDOFPFPSSA-N	431.327	1.499	50	20	IDGD	
O=C(c1cccn2nccc12)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781332007	CQNXQEBCULFUNN-YOEHRIQHSA-N	425.258	1.468	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CN1CCCC1=O)C2	1781900372	OGQKMAXUPLOMJO-QMTMVMCOSA-N	444.370	1.296	50	20	IDGD	
CCOc1cnc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](Cl)COC)C2)cn1	1782170835	ARNJPKUYGAVRKF-AKCHCHLHSA-N	440.928	1.257	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCC(=O)N1CCCC1)C2	1782171959	HYQINLVVXGBSKI-CSODHUTKSA-N	443.972	1.157	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cccc4c3cnn4C)CCO2)C1	1783534759	YSOQCYWLXWDDGB-YJYMSZOUSA-N	435.322	1.800	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cc(Cl)nc4n[nH]cc34)CCO2)C1	1783875715	PLCKRVKLKRRVAT-FZKQIMNGSA-N	442.303	1.309	50	20	IDGD	
CCOC(=O)c1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](Cl)COC)C3)C2)cc1	1783879724	AEEHEDQINMKLCY-UWJYYQICSA-N	438.908	1.561	50	20	IDGD	
Cc1ccc(CCC(=O)N2CCO[C@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc1	1783937480	SFYCXXDOHZPTAO-QHCPKHFHSA-N	430.549	1.131	50	20	IDGD	
Cc1ccn(C)c1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]2C1	1783969892	LRURXLDYHNGYPE-UGUYLWEFSA-N	426.355	1.958	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3CC=CCC3)[C@H]2C1	1783984392	QNOYNPQWOTXFAW-OWDVSOMSSA-N	441.532	1.456	50	20	IDGD	
CC#C[C@@H](CC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2)c1ccc(O)cc1	1784015478	ZAQSCPGNKILMNE-KPLVRAHFSA-N	434.920	1.319	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)Cc3cc(F)ccc3OC)C2)C1	1784087809	QRFPLLJJTJOHET-JXFKEZNVSA-N	428.888	1.461	50	20	IDGD	
C[C@H](Oc1cccnc1)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2	1784547620	INTSSUOAZILPMP-ZOCIIQOWSA-N	430.332	1.915	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)c3ccccc3)[C@H]2C1	1786668694	ZAZPGWKNXFJVRU-PEJOBZMASA-N	439.350	1.731	50	20	IDGD	
CC(=O)O[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]21)C(C)C	1788480731	YLRXRQGMDDOJLA-SIBFUHKCSA-N	437.364	1.790	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ncc(Cl)cn3)C[C@@H]21	1788760744	ANMLBXZEQLJPJA-QEJZJMRPSA-N	426.977	1.575	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ncccc3C(F)(F)F)[C@H]2C1	1788997967	RMGGZDZDUMYAHL-JURCDPSOSA-N	449.857	1.948	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(C)C)C[C@@H]21	1789222370	WTYHNCGBGHWDID-FNHZYXHNSA-N	433.461	1.769	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)[C@H](F)Br	1789923246	AMVVTIALMANOHC-BQHMLIOBSA-N	434.075	1.347	50	20	IDGD	
N#CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](Br)Cc3ccccc3)[C@H]2C1	1790779407	CVZWXIDGJZSEQV-XSLAGTTESA-N	434.334	1.886	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(C)n(C)n3)C[C@@H]21	1790961196	LLHRJIQIWLLURS-YXWQFLTLSA-N	427.343	1.495	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)Nc3cnccn3)C[C@@H]21	1791056291	RAGQFGMOWSTTNS-YTFOTSKYSA-N	440.342	1.040	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3ccc(OC)c(F)c3)[C@H]2C1	1791746005	IJBVXHMMKIXTJB-GGXPGOJBSA-N	442.915	1.610	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC1(c2ccc(NC(=O)CCc3ncc[nH]3)cc2)CCC1	1791758658	LRSVBQMIRVRNJJ-UHFFFAOYSA-N	447.499	1.789	50	20	IDGD	
O=C(CCNC(=O)c1ccccc1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Cl)C[C@@H]21	1792120858	UWMFITPMEKFZQR-NBOOPKSLSA-N	425.888	1.321	50	20	IDGD	
Cc1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)cc1Cl	1792731356	FJCXCPYMQITTFZ-REPLKXPHSA-N	426.709	1.894	50	20	IDGD	
CC(C)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CNC(=O)c1cccs1)C2	1792782452	QQFDWZCZSWIPDA-YWVIFJGQSA-N	427.954	1.333	50	20	IDGD	
Cc1nc[nH]c1CSCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(C)(C)CCl	1792783546	WUBRUEWSQSJKRO-XOIINTDNSA-N	428.986	1.806	50	20	IDGD	
O=C(C#Cc1ccc(Cl)cc1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2	1792838224	VOADYSTZRYUXRE-RMHZUWNSSA-N	443.700	1.972	50	20	IDGD	
CC(=O)N[C@H](Cc1cccc(F)c1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCl	1793117778	DIYZHBXJCVKXMM-RHQZKXFESA-N	439.915	1.111	50	20	IDGD	
CC(C)N1CCC(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@](C)(Cl)CCl)C3)CC1	1793799710	WMWQBGKDIRSMCR-CLWJZODNSA-N	434.408	1.933	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1cccc(F)c1	1795638154	KIAVPGSPDPZEHJ-BJWYYQGGSA-N	425.464	1.319	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CS(=O)(=O)N1CCCC1	1796888234	OBXSSKVRJIKJRG-UMPJEAMMSA-N	440.393	1.287	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)C(Cl)Cl)C3)C1	1797147692	QQEYLRRHSFIGRV-CLLJXQQHSA-N	436.336	1.247	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1n[nH]c2ccccc12	1797412771	MTDLUTSQLIJCAW-JFILPPLUSA-N	435.322	1.797	50	20	IDGD	
COC(=O)C12CCC(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)[C@@H](O)CCl)C4)(CC1)CC2	1797880520	IRFJRTCEBIDDPV-FWBCYNTJSA-N	426.941	1.738	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1COc3ccccc3O1)C2	1797952712	ICFHPZYQDRVVLF-BAAGSCJXSA-N	434.565	1.268	50	20	IDGD	
C[C@@H](Sc1cccs1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc(B(O)O)c1)C2	1798280361	NIAYOXLSCMLAMY-NKGKWGDASA-N	444.387	1.861	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cncc2cnccc12	1798458887	IYNAOWLUQVHVBZ-MBMVNNNZSA-N	433.306	1.616	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc3snnc3c1)C2	1799276807	LTABECQDHXRBGM-WYFUGZQLSA-N	444.344	1.526	50	20	IDGD	
CC(C)Oc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](O)CCl)C3)c(F)c1	1799804068	XZHRLDMAKCZWIZ-GGNLRSJOSA-N	428.888	1.416	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1cn2c(nc1=O)SCC2	1799838980	JHCAEQDKARFXMU-QKPAOTATSA-N	438.981	1.937	50	20	IDGD	
CCS(=O)(=O)c1ccc(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](O)CCl)C3)cc1	1801562546	SZRKFMJNBUCXGY-DFGXFYAUSA-N	442.965	1.261	50	20	IDGD	
NC(=O)NCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCCCCCCCCCCl)C2	1802164572	DSGBHJGFTQWKOL-XEMDLRDOSA-N	445.004	1.994	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CC[C@H]1CCOC1	1803346591	SFIAHLDFXVWGMY-DXFUESDRSA-N	429.521	1.575	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)/C=C/c2ccco2)[C@H]1c1cccnc1	1804613021	GDOCUVULDZLHMO-PWISXXLXSA-N	439.516	1.767	50	20	IDGD	
Cc1cc(C(=O)NC[C@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)no1	1805837400	NXGGJFJFPXKZRZ-BEFAXECRSA-N	449.471	1.010	50	20	IDGD	
O=C(CCN1CCOCC1)NC[C@H]1CCN(C(=O)C(Cl)Cl)[C@H]1c1cccnc1	1806957205	RJRYLNCBUFAKAA-WBVHZDCISA-N	429.348	1.613	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)Cc2ccsc2)[C@@H]1c1cccnc1	1807565321	ZITRBSQACYVQGT-GCJKJVERSA-N	443.573	1.765	50	20	IDGD	
O=C(CCBr)N1CCCC2(CCN(C(=O)c3nc4ncccn4n3)CC2)C1	1809065825	VUGHOFVHMWKDLM-UHFFFAOYSA-N	435.326	1.754	50	20	IDGD	
Cc1cnoc1C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1	1811246329	MLBOLXKWJFUCKG-MAUKXSAKSA-N	449.471	1.010	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)c2c[nH]c(=O)cn2)[C@H]1c1cccnc1	1812868074	YLDHQAPLHDQYOU-RBOXIYTFSA-N	434.294	1.268	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)CCc2ccc(O)nn2)[C@H]1c1cccnc1	1813034089	AHLIUGMVBCTMCX-KNBMTAEXSA-N	447.923	1.470	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2ccc(F)s2)[C@H]1c1cccnc1	1813070126	GEVGQLLQRKPWFP-YWZLYKJASA-N	447.536	1.975	50	20	IDGD	
Cc1c[nH]cc1C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1813070542	JZWFJLWSZSGIQB-UTKZUKDTSA-N	426.521	1.411	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cnc(O)nc2O)[C@H]1c1cccnc1)C(Cl)Cl	1813079785	JEMBJBFHEUIRPS-JQWIXIFHSA-N	426.260	1.406	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccnc2S)n[nH]1	1814449185	SUANVBXUNMYPJF-HNNXBMFYSA-N	445.549	1.772	50	20	IDGD	
Cc1nscc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1816259570	BRXCEHUHDAONQH-KRWDZBQOSA-N	439.306	1.474	50	20	IDGD	
O=C(CCBr)N[C@H]1CCc2nc(NC(=O)c3cc(O)nc(O)n3)sc2C1	1817100673	HNLGNOGASYCNGI-ZETCQYMHSA-N	442.295	1.355	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CC[C@H](N)C(N)=O)n[nH]1	1817358156	CABYPEVULPQGGM-GVXVVHGQSA-N	443.346	1.168	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)C(Cl)Cl)[nH]n1)c1cc(=O)n2[nH]cnc2n1	1817468949	QRWNNRFKZGPUAH-JTQLQIEISA-N	439.263	1.250	50	20	IDGD	
COc1ccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)nc1	1817471872	SYMGHCLWBFTKLQ-IBGZPJMESA-N	449.276	1.113	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc(F)nc2)[nH]n1)c1ccc(B(O)O)cc1	1817472099	HUPRCKAXDNFRCU-QGZVFWFLSA-N	437.240	1.243	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](Br)CC)CC2	1820148460	LTANEVCVEOMLDQ-GMTAPVOTSA-N	443.367	1.919	50	20	IDGD	
O=C1CC[C@H](C(=O)N2CCCC[C@H]2c2cc(NC(=O)[C@@H](F)Br)n[nH]2)CN1	1820934700	OZOSRMWCYJEETO-NURSFMCSSA-N	430.278	1.619	50	20	IDGD	
COc1ccc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)CCBr)CC3)nn1	1821066404	SSQVZKBBNMRMCG-SECBINFHSA-N	440.323	1.953	50	20	IDGD	
O=C(CCBr)N[C@H]1CCc2nc(NC(=O)c3cc(CO)on3)sc2C1	1821698125	ZFBVSYNLFLUJSI-QMMMGPOBSA-N	429.296	1.634	50	20	IDGD	
CC(=O)C[C@@H](C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1822335407	JEOSXPSHJXBVHY-ACJLOTCBSA-N	426.282	1.011	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2CCCS2(=O)=O)[nH]n1	1822377682	YLSLSHQAXRIHAP-UBHSHLNASA-N	432.930	1.233	50	20	IDGD	
C[C@@](O)(CC(=O)O)CC(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCBr)[nH]n1	1822402936	APRWDCSGCBRZNT-SJCJKPOMSA-N	445.314	1.803	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(=O)ccn1C)CC2	1825645847	JTRQHKQEAHROBD-UWVGGRQHSA-N	439.335	1.851	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc3n(n2)CCNC3=O)CC1	1826197245	HJFUKECRGZKDJX-RDJZCZTQSA-N	435.956	1.877	50	20	IDGD	
CCc1cc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)no1	1827052179	BSJLXVBXFYMQHJ-OAQYLSRUSA-N	439.321	1.464	50	20	IDGD	
O=C(c1ccsc1)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827056071	OQVLAGUJRRATRA-FQEVSTJZSA-N	426.347	1.975	50	20	IDGD	
CC(=O)C(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)[C@@H](F)Cl)C2)C1	1828792146	MLBVFPXEERKBSM-UZLBHIALSA-N	439.871	1.562	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccco2)CC1	1828926030	XVSJOIYGEDUUDG-SFHVURJKSA-N	425.489	1.825	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccc4ncnn4c3)C2)C1	1831654475	LBVGVSXOJCYBCD-UWJYYQICSA-N	449.939	1.136	50	20	IDGD	
C[C@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H](F)Br)CC1)n1cnnn1	1832293687	LGFMSIYUUXAPND-KWCYVHTRSA-N	431.310	1.544	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)C(=O)c2cccn2C)CC1	1832299782	LENCLUPNPGTCBG-SFHVURJKSA-N	445.564	1.201	50	20	IDGD	
C[C@]1(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1(F)F	1832802022	MHGRUPFPMVGMKD-GHTZIAJQSA-N	434.292	1.645	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3ccnc(Cl)c3)CC2)CC1)[C@H](O)CCl	1833309105	NOEXPLPLOKDTFN-MRXNPFEDSA-N	429.348	1.520	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cc(Cl)ccn3)CC2)CC1)[C@@H](O)CCl	1833311690	AIPPFBOYNLCXSX-KRWDZBQOSA-N	429.348	1.520	50	20	IDGD	
Cc1ncc(C(=O)NC2CCN(C3CCN(C(=O)[C@H](F)Br)CC3)CC2)cn1	1834064555	QADKGVPDRJOMSK-INIZCTEOSA-N	442.333	1.661	50	20	IDGD	
Cc1cc(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](C)Br)CC3)CC2)on1	1834209983	QOCRKBGHYXHMAZ-CYBMUJFWSA-N	427.343	1.952	50	20	IDGD	
COc1ncc(C(=O)NC2CCN(C3CCN(C(=O)[C@H](O)CCl)CC3)CC2)cc1C	1834331360	CKOJTALSCRLZOY-GOSISDBHSA-N	438.956	1.184	50	20	IDGD	
C=C[C@@H](O)C(C)(C)C(=O)N1CCC(N2CCC(NC(=O)CCBr)CC2)CC1	1834424009	UKUKGCOXLCXRKY-QGZVFWFLSA-N	444.414	1.916	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)CCN(C)C)CC2)CC1	1834614433	CTPHEMOIKZEMFZ-OAHLLOKOSA-N	431.419	1.541	50	20	IDGD	
C[C@H](Nc1cccnc1)C(=O)NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1834718489	IQYJJZWTZLWYMO-HNAYVOBHSA-N	437.972	1.053	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)Cc3ccc(F)cc3)C2)C1	1834822534	SZTZAJDMNHJFNY-LJQANCHMSA-N	443.313	1.610	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCBr)CCO3)C2)ccc1F	1834823817	LSTBUOYYUBWIJI-LJQANCHMSA-N	443.313	1.989	50	20	IDGD	
C/C=C(\C)C(=O)N1CCC(N2CCC(NC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CC2)CC1	1835117807	MRCRTBDKBHYVHX-AKIMIPFTSA-N	442.564	1.658	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)Cc3cc[nH]n3)CC2)CC1)[C@H](F)Br	1836413503	FTKFFERVFVIOBW-INIZCTEOSA-N	430.322	1.214	50	20	IDGD	
Cc1ncc(C(=O)N2CCC(N3CCC(NC(=O)[C@H](F)Br)CC3)CC2)[nH]1	1836413574	JVNUPVAZXSIASA-HNNXBMFYSA-N	430.322	1.594	50	20	IDGD	
O=C(c1c[nH]c2cnccc12)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836717351	UOZLBMOFPIVOML-LJQANCHMSA-N	434.924	1.775	50	20	IDGD	
O=C(c1cn2ccsc2n1)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1837051749	ITSJYEDDIVKLBO-INIZCTEOSA-N	433.317	1.270	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@H](O)c3ccccc3)CC2)CC1	1837779738	KBDBDUWLKDHFCT-WOJBJXKFSA-N	438.952	1.972	50	20	IDGD	
O=C(c1cc2cc[nH]c2cc1F)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1838571747	AXEFJPGNEKBJIK-QFBILLFUSA-N	427.835	1.911	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)C3(C(=O)OC)CC3)CC2)CC1	1838758328	ZHAACUOPEFCKNI-INIZCTEOSA-N	430.929	1.192	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)n3cccc3C=O)C2)C1	1839143719	GMSQJNWNIRXWIC-OXFYSEKESA-N	425.913	1.335	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccc(O)cn3)C2)C1	1839156206	HQKXIIDEESMADN-OALUTQOASA-N	446.331	1.022	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cncc(O)c3)CCO2)C1	1840064330	GBYBKBRHQSXQNK-MAUKXSAKSA-N	442.310	1.031	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccnc4ccccc34)C2)C1	1840152187	AOTGZERJLNANOL-AVRDEDQJSA-N	447.919	1.559	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(C)c(F)c3)C2)C1	1840154218	PMIDIXUWBIRSGM-OXJNMPFZSA-N	428.888	1.458	50	20	IDGD	
COc1ccc(F)cc1CC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1840250407	XZBQAXVJTFLMNN-IEBWSBKVSA-N	432.851	1.368	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)/C=C/c3cnc[nH]3)CCO2)C1	1840344299	DEAJLCOJOPWTKZ-FDFOOHLBSA-N	441.326	1.053	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)n1cccn1)CCO2	1840444086	CQQAPNUDICVFAV-RLFYNMQTSA-N	443.342	1.074	50	20	IDGD	
N#Cc1cccc(CCC(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)c1	1841259978	OSYYQQQFBBBCAW-UHFFFAOYSA-N	432.484	1.007	50	20	IDGD	
COC(=O)C[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)[C@H](F)Cl)C1	1843366822	SBVMGVJGCBVVOV-AAEUAGOBSA-N	435.880	1.181	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)[C@@H](C)Oc1cccnc1)C2	1843417292	RYAVXSKTJWOYJR-FYHAJLKWSA-N	438.488	1.186	50	20	IDGD	
O=C([C@@H](O)CCl)N1CC2(CCCN2C(=O)c2c[nH]c3ncc(C(F)(F)F)cc23)C1	1844068338	UDVYMFIMKGXYLM-ZDUSSCGKSA-N	430.814	1.998	50	20	IDGD	
COC[C@@H](NC(C)=O)C(=O)N1CCCC12CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)C2	1844387064	OMELKOCPKLNYQQ-DDBXPCSUSA-N	446.454	1.226	50	20	IDGD	
CN(CC(=O)N1CCCC12CN(C(=O)c1ccsc1)C2)NC(=O)NCc1ccccc1	1845038516	MITOUPLECOOSCP-UHFFFAOYSA-N	441.557	1.911	50	20	IDGD	
C=CC(=O)N[C@@H](C)C(=O)N1CC2(CCCN2C(=O)[C@@H](Br)Cc2ccccc2)C1	1845941494	BRECIASYLKOURW-RDJZCZTQSA-N	448.361	1.887	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)[C@H]1Oc2ccccc2O[C@@H]1C	10948627	RIXARGIGHGCMMD-ZMZPIMSZSA-N	434.832	1.881	50	20	IDGD	
Cc1ccc(C)c(S(=O)(=O)NCCC(=O)NNC(=S)NCCc2cccs2)c1	21125091	BEKXSBFITMQZSY-UHFFFAOYSA-N	440.616	1.771	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2ccc(N3C[C@@H](C)O[C@H](C)C3)nc2)cc(OC)c1OC	30018305	JHFYGMCUPSMCTD-ZIAGYGMSSA-N	444.488	1.796	50	20	IDGD	
CCn1c(=O)nc(O)c2c(C(=O)NNc3nc(-c4ccncc4)no3)cc(C3CC3)nc21	726369821	GYYMSDOOTBMFSM-UHFFFAOYSA-N	434.416	1.596	50	20	IDGD	
CC(C)N(CCC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)C(=O)OC(C)(C)C	727114375	RAZSVOWINBQEFX-UHFFFAOYSA-N	431.493	1.730	50	20	IDGD	
CNS(=O)(=O)c1cccc([C@H](C)NC(=O)NNC(=O)COc2ccc(OC)cc2)c1	727608890	ZRZMJFGXUJDYDL-ZDUSSCGKSA-N	436.490	1.074	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)c2cc(Cl)c(-n3cnnn3)cc2OC)c1	728206484	QGFWSEMPDOWNDI-UHFFFAOYSA-N	431.840	1.206	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)CCNC(=O)Cc2ccccc2)c1	728529607	GTHLJFPRUWAQKJ-UHFFFAOYSA-N	434.290	1.968	50	20	IDGD	
COc1ccc(/C=C(/C#N)C(=O)O[C@@H](C)C(=O)Nc2cccc(S(N)(=O)=O)c2)cc1	728881757	OSMXUHVLGFXGRD-OJNRTJSBSA-N	429.454	1.820	50	20	IDGD	
Cc1c(-c2ccccc2)oc2c(C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)cccc2c1=O	729276463	FTIITUYAEODWBJ-ZDUSSCGKSA-N	443.481	1.467	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)[C@@H]2CCN(c3ccc4c(c3)OCCO4)C2=O)c1	730513020	UGEKXBIMSDVQPY-KRWDZBQOSA-N	425.441	1.346	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(C)c(C(=O)NNC(=O)COc2ccccc2O)c1	730778578	QRSJFQVDAXDEPF-UHFFFAOYSA-N	435.502	1.571	50	20	IDGD	
COc1cc(OC)c(CCNC(=O)NNC(=O)c2ccc3c(c2)OCCO3)c(OC)c1	731045769	HNKASBDSVLDALZ-UHFFFAOYSA-N	431.445	1.670	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)c2ccc(-c3nc(=O)o[nH]3)cc2)c1	732285796	IAHVRNULQKZATL-UHFFFAOYSA-N	433.218	1.876	50	20	IDGD	
N#Cc1ccc(N2CCC[C@H]2C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1	732336220	CTFRONCHHAPOKL-SFHVURJKSA-N	437.412	1.440	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)N[C@@H]1CCCN(c2cc(CC)ncn2)C1	732913917	HQCQMJPHWOWGFO-QGZVFWFLSA-N	442.520	1.816	50	20	IDGD	
N#Cc1cccc(OCc2cccc(C(=O)NNC(=O)N[C@@H]3CCS(=O)(=O)C3)c2)c1	734428362	POTRHDCJDCIBKX-QGZVFWFLSA-N	428.470	1.268	50	20	IDGD	
COc1ccc2c(c1)C[C@H](C(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1)CO2	734825333	YWLBZKOGUJZRLK-HNNXBMFYSA-N	448.520	1.976	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)c2c(O)nn(C)c2n1	734825523	IYDHLNZWJXIOAY-UHFFFAOYSA-N	447.496	1.326	50	20	IDGD	
CC(C)Oc1ccc([C@@H](O)CNC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1	734855952	UCZKMMBZPAPPFI-SFHVURJKSA-N	425.449	1.127	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NC2CCN(C[C@@H]3CCOC3)CC2)ccc1OC(C)C	736394658	MNIXETGCZNIGEO-INIZCTEOSA-N	434.537	1.927	50	20	IDGD	
Cc1ccccc1NC(=O)NNC(=O)NC1CCN(S(=O)(=O)C2CCOCC2)CC1	736405215	FCUKANIILKIYCQ-UHFFFAOYSA-N	439.538	1.304	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CN2CCN(C(=O)[C@H](C)Oc3ccccc3C)CC2)cc1	736622633	AGRPZZGRPDDNAX-IBGZPJMESA-N	438.528	1.676	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)Cc2ccc(S(=O)(=O)C(F)F)cc2)c1	740641380	KYPREFZPUJQWJZ-UHFFFAOYSA-N	428.413	1.704	50	20	IDGD	
CC[C@H]1CCC[C@@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)C1	741093023	JNBXPZMBXCGZBT-DOTOQJQBSA-N	438.550	1.620	50	20	IDGD	
C[C@H](OC(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccccc1)C(=O)N1CCNC1=O	741818878	HCTWOBVDSSINRZ-YSKWHIJTSA-N	432.440	1.854	50	20	IDGD	
CC(C)c1nn([C@@H]2CCS(=O)(=O)C2)cc1C(=O)NNC(=O)Cc1c[nH]c2ccccc12	742477440	HDUVNUYXIXVFLX-OAHLLOKOSA-N	443.529	1.851	50	20	IDGD	
CCS(=O)(=O)Nc1ccccc1C(=O)NNC(=O)c1cc(OC)c(OC)c(OC)c1	743734341	OUDPXTWGHHECLN-UHFFFAOYSA-N	437.474	1.549	50	20	IDGD	
CS(=O)(=O)Cc1ccc(C(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)cc1	743830039	LFOBUIKIZUOFKC-UHFFFAOYSA-N	425.488	1.101	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NC[C@H](C)Oc2ccccc2C)cc1	745887147	LGTCIZCOUNMNGV-KRWDZBQOSA-N	448.545	1.722	50	20	IDGD	
Cc1ccc(C)n1-c1ccc(C(=O)NNC(=O)N[C@@H]2C[C@H](C)N(c3cnn(C)c3)C2=O)cc1	745916716	FUVZWWHOEJNYFA-OXJNMPFZSA-N	449.515	1.966	50	20	IDGD	
Cc1ccc(C)n1-c1ccc(C(=O)NNC(=O)N[C@@H]2C[C@@H](C)N(c3cnn(C)c3)C2=O)cc1	745916719	FUVZWWHOEJNYFA-OXQOHEQNSA-N	449.515	1.966	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)Cc1cn2ccccc2n1)[C@@H]1CN(Cc2ccccc2)CCO1	746766986	IBDNHDGHBKJDDC-PXNSSMCTSA-N	436.516	1.497	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)CN2CCN(C(=O)OCc3ccccc3)CC2)c1	747200194	OWSVCJGJFNUSRF-UHFFFAOYSA-N	439.516	1.468	50	20	IDGD	
O=C(NNC(=O)/C(=C/c1cccs1)n1nnnc1-c1ccccc1)C(=O)N1CCCC1	748240462	GIQUGXKCBBQMQY-SSZFMOIBSA-N	437.485	1.170	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)(F)F)cc1)[C@H]1CC(=O)N(Cc2ccccn2)C1	748519836	FGHLYCQVJZPCET-LBPRGKRZSA-N	442.419	1.867	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3cc(F)ccc3[N+](=O)[O-])cc2)CC1	748620516	QOCMRVFZJYXPSR-UHFFFAOYSA-N	437.453	1.427	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)s1	749308839	OVHRNILNMQXTCV-UHFFFAOYSA-N	448.526	1.034	50	20	IDGD	
COc1cccc2c1OCC(C(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1)=C2	750715795	CGGHBHMUMUNZSJ-UHFFFAOYSA-N	445.497	1.248	50	20	IDGD	
CCn1ncc2c(C(=O)NNC(=O)CNC(=O)c3ccco3)cc(-c3ccccc3)nc21	751204691	MQNPPUIMKRHRNA-UHFFFAOYSA-N	432.440	1.902	50	20	IDGD	
O=C(NNS(=O)(=O)CCCN1C(=O)c2ccccc2C1=O)c1c[nH]c2ccccc12	753021652	XERQGSUASVFKBF-UHFFFAOYSA-N	426.454	1.418	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H]2C[C@@H](OC)C2(C)C)c1	753549697	HKSKJVPFQXWIDN-HZPDHXFCSA-N	426.539	1.475	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N[C@H](C)CO[C@@H]1CCOC1	753814249	XSSZKEQOSMLOHR-TYNCELHUSA-N	430.299	1.741	50	20	IDGD	
CCc1nnc(O)c(CNC(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)c1CC	754668309	JXHUPJIQXRBAOZ-UHFFFAOYSA-N	437.526	1.215	50	20	IDGD	
COC(=O)c1nscc1S(=O)(=O)NNC(=O)NCc1cccc(C(F)(F)F)c1	755967498	OIJVLEBYTBNJRY-UHFFFAOYSA-N	438.409	1.641	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C(=O)Nc2ncc(Cc3ccccc3)s2)nc2ccccc21	756175551	XANXGJORKIPQQE-UHFFFAOYSA-N	448.508	1.949	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Nc2ccc(F)c(-n3nnnc3C)c2)cc(OC)c1OC	756336292	UNWXHWOCRFPRCI-UHFFFAOYSA-N	445.411	1.602	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)cc1-n1cnnn1	756747407	OXSFJVFSIDTNED-AWEZNQCLSA-N	425.449	1.908	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1ccc([C@@H](C)NC(=O)OC(C)(C)C)cc1	756813751	CIXKEKDOXONCCX-VXGBXAGGSA-N	443.526	1.363	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)Nc2cccc3c2oc(=O)n3C)c2ccccc2c1=O	757758407	UZZVPZAWZFXMSW-UHFFFAOYSA-N	436.428	1.889	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1cc(NC(=O)CC(C)(C)C)ccc1Cl	758047686	YXSHCZGOVDSHKI-JTQLQIEISA-N	432.930	1.413	50	20	IDGD	
O=C(NNC(=O)c1ccc(Br)cc1-n1cncn1)c1ccc2c(c1)OCO2	758054882	NKJNUBAVNWKZOY-UHFFFAOYSA-N	430.218	1.833	50	20	IDGD	
COc1ccc(C(=O)Nc2ccc(C(=O)NNC(=O)C(=O)Nc3ccccn3)s2)cc1	758847419	SGEBVSKLVMLHNW-UHFFFAOYSA-N	439.453	1.804	50	20	IDGD	
Cc1cc(S(C)(=O)=O)cc(C(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)c1C	758941840	GPTGKFYBFFHJRA-UHFFFAOYSA-N	438.889	1.978	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)c2sccc2S(=O)(=O)N2CCSCC2)nc1	759728810	KEQWTEASVQRMDZ-UHFFFAOYSA-N	442.544	1.424	50	20	IDGD	
CC(C)(C)OC(=O)NCC1(C(=O)N2CCN(S(=O)(=O)CBr)CC2)CC1	760024932	QPWKEEKETMNCBC-UHFFFAOYSA-N	440.360	1.118	50	20	IDGD	
COCCS(=O)(=O)c1ccc(CNC(=O)/C(C#N)=C\c2cc(C#N)n(C)c2C)cc1	760564361	ZFTIZVGZSAFZFW-ZDLGFXPLSA-N	426.498	1.849	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)c1nc(-c2ccccc2)no1	760856000	MYKXDNZSJOQMQB-ZDUSSCGKSA-N	447.455	1.731	50	20	IDGD	
Cc1ccc(C(=O)NC2CC2)cc1NC(=O)C(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	763472495	VAGIFMXRWNKGIE-UHFFFAOYSA-N	425.401	1.195	50	20	IDGD	
Cc1nc(N2CCOCC2)ccc1NC(=O)C(=O)NNC(=O)c1cc2ccccc2cc1O	763526799	KUDUXMYQEOJADN-UHFFFAOYSA-N	449.467	1.485	50	20	IDGD	
CCOCc1cccc(NC(=O)C(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)c1	763538926	GTPWCTYYWVIWSH-UHFFFAOYSA-N	431.445	1.649	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1ccc(C(=O)N(C)C)c(Cl)c1	763630173	VUQWKMLDDKDEIU-UHFFFAOYSA-N	442.863	1.398	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(OC[C@@H]3CCCO3)cc2)cc1	763659069	IIZOIECJXJGGLB-IBGZPJMESA-N	443.456	1.418	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cc(C)nn2[C@@H]2C[C@H]3CC[C@H]2C3)cc1	763662658	YXPLSGGICANWJV-RLFYNMQTSA-N	441.488	1.726	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(OC)c2ncccc12	763681382	KTFPTFYQPROEGS-UHFFFAOYSA-N	438.440	1.807	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)C(=O)Nc1ccccc1C(=O)N1CCCC1	763682134	XSOQVFOUVRSQBJ-UHFFFAOYSA-N	428.420	1.227	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccccc1O[C@@H]1CCOC1	763712200	OFMLTDNFFQDEOL-MRXNPFEDSA-N	427.457	1.582	50	20	IDGD	
Cc1ccc(Cl)c(NC(=O)C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1	763718393	KQJODZPNMJIZER-UHFFFAOYSA-N	438.893	1.298	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2ccc3cnn(CC)c3c2)c2ccccc2c1=O	763785118	FQJVCTBKOVUQFZ-UHFFFAOYSA-N	447.455	1.186	50	20	IDGD	
CC(C)CCc1ccc(NC(=O)C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1	763790819	PIBHBXJJBOMJOJ-UHFFFAOYSA-N	435.484	1.922	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccccc1CN1CCSCC1	763837271	DDROLYHESLFESI-UHFFFAOYSA-N	446.504	1.539	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)nc(C)n3C)cc1	763876507	FYZBQOATRSCWFO-ZDUSSCGKSA-N	437.456	1.638	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(-c3ncon3)cc2)cc1	763877904	MFSFOXJZELPDCO-ZDUSSCGKSA-N	437.412	1.493	50	20	IDGD	
CNC(=O)c1cc(NC(=O)C(=O)NNC(=O)CSc2ccc(C)cc2)ccc1Cl	763898150	LTYNMSULRGBBMJ-UHFFFAOYSA-N	434.905	1.886	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)C(=O)Nc2cccc(N3CCOC3=O)c2)cc1	763898615	YMOWPEUGPQRNRX-UHFFFAOYSA-N	428.470	1.830	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cnn(CC(F)F)c2)cc1OC	763911370	LJQRHTDKXAZAJG-UHFFFAOYSA-N	425.392	1.345	50	20	IDGD	
COc1ccc(OC)c(NC(=O)C(=O)NNC(=O)c2ccc(Br)s2)c1	763942140	VLKAXSVGPMDXGQ-UHFFFAOYSA-N	428.264	1.928	50	20	IDGD	
O=C(NNC(=O)c1cc(Cl)ccc1O)C(=O)Nc1ccnn1Cc1ccccc1F	763979348	UDWISFGIVXMYGZ-UHFFFAOYSA-N	431.811	1.829	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)Nc1ccccc1OCC1CC1	764001686	CAHCWXHOPNYAKF-UHFFFAOYSA-N	435.278	1.976	50	20	IDGD	
Cc1ccc(C(=O)N2CCSCC2)cc1NC(=O)C(=O)NNC(=O)Cc1ccsc1	764034572	HOTAXBJXDQNYFU-UHFFFAOYSA-N	446.554	1.574	50	20	IDGD	
C[C@@H]1CN(Cc2ccccc2NC(=O)C(=O)NNC(=O)Cc2ccsc2)C[C@@H](C)O1	764034680	TYZPKTMSCUCTJV-HUUCEWRRSA-N	430.530	1.686	50	20	IDGD	
C[C@H]1Oc2ccc(NC(=O)C(=O)NNC(=O)c3cccc(C(F)(F)F)c3)cc2NC1=O	764039902	CHNQIHMEAMCVPJ-SECBINFHSA-N	436.346	1.825	50	20	IDGD	
CC[C@@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(-c2csc(N3CCOCC3)n2)cc1	764084868	PCLAHOKVKYHOST-CYBMUJFWSA-N	431.518	1.779	50	20	IDGD	
O=C(CC1CCCC1)NNC(=O)C(=O)Nc1cccc(S(=O)(=O)N2CCCCC2)c1	764179842	WTHOONORXZETID-UHFFFAOYSA-N	436.534	1.527	50	20	IDGD	
CC(C)C[C@H](C)n1nccc1NC(=O)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	764261036	WAJDJJFYOUKQEF-HNNXBMFYSA-N	442.524	1.283	50	20	IDGD	
CN1CCN(C(=O)c2ccccc2NC(=O)C(=O)NNC(=O)c2cc3ccccc3o2)CC1	764332774	YSMGXKFTFOEKHD-UHFFFAOYSA-N	449.467	1.220	50	20	IDGD	
Cc1nnc(-c2cccc(NC(=O)C(=O)NNC(=O)CCCc3cccs3)c2)n1C	764342034	SNHHMPFYMIUMQT-UHFFFAOYSA-N	426.502	1.961	50	20	IDGD	
Cc1cnc(O)n1-c1ccccc1NC(=O)C(=O)NNC(=O)c1ccc(O)c(Cl)c1	764349613	RAFGHWUAIUVRAV-UHFFFAOYSA-N	429.820	1.645	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cccc(C#N)c3C)n[nH]2)cc1OC	764377392	DEEIVLYRFKLYOU-UHFFFAOYSA-N	448.439	1.674	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)cc(OC)c1OC	764404292	HNYJNONZFSHEHV-UHFFFAOYSA-N	435.458	1.296	50	20	IDGD	
Cn1c(=NNC(=O)CCC(=O)N2CCN(c3ncccn3)CC2)sc2ccccc21	764718324	WXVCAINHDGSAER-UHFFFAOYSA-N	425.518	1.091	50	20	IDGD	
COc1nc2sccn2c1C=NNC(=O)CN1CCN(Cc2ccc(C)cc2)CC1	764826368	FFYLWGNJZOBNFX-UHFFFAOYSA-N	426.546	1.981	50	20	IDGD	
CC(C)(C)OC(=O)N1CCO[C@H](CC(=O)NNC(=S)NCCc2cccs2)C1	765395043	SCIFQFFIFXQAIM-CYBMUJFWSA-N	428.580	1.812	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)c3cccc(CS(N)(=O)=O)c3)n[nH]2)cc1C	765567307	OBQQBZSKHCLMKP-UHFFFAOYSA-N	427.486	1.557	50	20	IDGD	
O=C(Cc1noc2ccccc12)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	765754568	KXQXRSDCPMXWAW-UHFFFAOYSA-N	441.919	1.989	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)c2cc(S(=O)(=O)N(C)C)ccc2O)c1	766954208	WZQYCQBBFYSZQY-UHFFFAOYSA-N	449.529	1.914	50	20	IDGD	
Cc1cc2nc(C)c(CCC(=O)OCC(=O)NNC(=O)Cc3ccccc3C)c(C)n2n1	767273277	QRUUFIMIHMRDCH-UHFFFAOYSA-N	437.500	1.829	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(F)cc2C(=O)N(C)C)c2ccccc2n1	768234571	UZUQKIMSUVXRIP-UHFFFAOYSA-N	437.431	1.784	50	20	IDGD	
N#Cc1cccc(C(=O)NNS(=O)(=O)c2cc3nc(O)[nH]c3cc2Br)c1	768498650	AZWJFKIFFHLANN-UHFFFAOYSA-N	436.247	1.526	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NNc2nc3ccccc3[nH]2)o1	768514788	KXKJGWIGAVJTNV-AWEZNQCLSA-N	447.473	1.629	50	20	IDGD	
CN(C)C(=O)COc1ccc(C(F)(F)C(=O)NNC(=O)CCc2ccccc2O)cc1	769651123	QGCSWEUWRCOBKW-UHFFFAOYSA-N	435.427	1.731	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N[C@H](C)[C@@H]1CN(C)CCO1	769967576	PIDLZSOPLLKPSN-XUJVJEKNSA-N	429.315	1.266	50	20	IDGD	
Cn1ncc(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c1Cc1ccccc1	770076727	YBTXKVWOYHARNB-UHFFFAOYSA-N	446.555	1.984	50	20	IDGD	
CCN1CCN(CCCCNC(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)CC1	770181599	WKLMOJLLIBPFIH-INIZCTEOSA-N	425.961	1.855	50	20	IDGD	
C[C@H]1CN(Cc2ccc(CNC(=O)NNc3nc(O)c4cnn(C)c4n3)cc2)C[C@H](C)O1	770341297	MFSXKAIHFXMKSP-KBPBESRZSA-N	440.508	1.504	50	20	IDGD	
C[C@H]1C[C@@H](NC(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)CCO1	770354503	HJTSPDFFUTXIHP-RDJZCZTQSA-N	435.484	1.956	50	20	IDGD	
CCN1CCN(c2cccc(NC(=O)C(=O)NNC(=O)CCc3ccccc3O)c2)CC1	770771229	JTZPOCPWIIXYOV-UHFFFAOYSA-N	439.516	1.253	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)[C@@H]3CC(=O)N(c4ccccc4Br)C3)nc21	770973627	NWJBRPMGMUEFPH-SECBINFHSA-N	446.265	1.328	50	20	IDGD	
CCn1c(SCC(=O)NNc2nc(O)c3cnn(C)c3n2)nnc1-c1ccccc1C	770982102	FAPAGQCZAGSQAU-UHFFFAOYSA-N	439.505	1.891	50	20	IDGD	
CC(=O)N1CCN(S(=O)(=O)c2ccc(C(=O)NNc3c(C)cccc3F)cc2)CC1	771689514	YOGYZXMVKOFWRG-UHFFFAOYSA-N	434.493	1.744	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1ccccc1S(=O)(=O)N(C)c1ccccc1	771861437	XXGFJHMIVYZWOI-AWEZNQCLSA-N	433.486	1.614	50	20	IDGD	
COc1cccc(/C=C(/C(=O)O[C@@H](C)C(=O)NNC(=O)CC(C)C)n2nnnc2C)c1	771922859	PWLLDCZVXYJCLY-MFVBVHDHSA-N	430.465	1.113	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)[C@@H](NC(=O)c1cc(Cl)ccc1F)[C@H](C)O	772041362	KHYIRDWGKQVKEO-MMPTUQATSA-N	445.875	1.084	50	20	IDGD	
CC(C)(C)OC(=O)N1CSC[C@@H]1C(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772896937	DIFTZRQRPATGTJ-CYBMUJFWSA-N	442.925	1.414	50	20	IDGD	
COC(=O)N1CCC[C@@H]([C@H](C)NC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)C1	773567215	MALPBVWOGWKNCO-QWHCGFSZSA-N	441.510	1.293	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2cnn(C)c2Cc2ccccc2)n1	773590613	FLAPLAJNUTZFKV-UHFFFAOYSA-N	427.486	1.323	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)[C@@H]3C[C@]3(C)C(C)C)CC2)cc1	773857761	NZDKREKQXUSLQI-GHTZIAJQSA-N	436.578	1.131	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccc(-n2nccn2)cc1	774002521	QTJTVKDDFXOFSH-GFCCVEGCSA-N	428.836	1.474	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)N[C@@H](CS(C)(=O)=O)c2ccccc2)cc1OC	774279794	NATPPEXJHHRXSW-INIZCTEOSA-N	435.502	1.824	50	20	IDGD	
Cc1cc(=O)c(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cn1C1CC1	774328838	DXBXQVOUCBPNSF-UHFFFAOYSA-N	444.513	1.351	50	20	IDGD	
CC(=O)c1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c(F)c1	776730992	UFSLYJUQMDCWNL-UHFFFAOYSA-N	433.461	1.888	50	20	IDGD	
COCCO[C@H]1COCC[C@H]1NC(=O)NNC(=O)c1cc(C)n(-c2ccccc2)c1C	777275157	NMTKDSZQDCEVGB-UXHICEINSA-N	430.505	1.859	50	20	IDGD	
COc1ccc2nc(NNC(=O)[C@@H]3CC(=O)N(CCN4CCOCC4)C3)c(C)cc2c1	778479361	WRVJYKPYUTYJAA-QGZVFWFLSA-N	427.505	1.176	50	20	IDGD	
CCC(CC)[C@H]1C[C@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)CCO1	779394146	AMXMKSITJVORKR-SJLPKXTDSA-N	440.566	1.865	50	20	IDGD	
CC(C)(C)OC(=O)N=c1cc[nH]cc1C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	780347931	PSOKASYIHSZJAS-UHFFFAOYSA-N	434.474	1.329	50	20	IDGD	
CCN(CC)C(=O)CCC1CCN(CC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)CC1	782521289	ZSDLNSVHWSQOJL-UHFFFAOYSA-N	433.509	1.716	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)Cc3ccn(C)n3)c2)cc1	782548590	HGGZTJHRCJJXRJ-UHFFFAOYSA-N	443.485	1.233	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C(=O)N2CC3(CCC3)c3c(F)cccc32)nc2ccccc21	782895235	XVRUSBZSXIRIKG-UHFFFAOYSA-N	435.459	1.871	50	20	IDGD	
Cc1csc(Sc2ccc(NC(=O)C(=O)NNC(=O)C(=O)NC3CC3)c(C)c2)n1	782968227	ZQTRDDDEUPUXKD-UHFFFAOYSA-N	433.515	1.276	50	20	IDGD	
O=C(COCCNC(=O)c1ccccc1)NNC(=O)c1ccc(Br)s1	784589728	XOIGVESONQINOE-UHFFFAOYSA-N	426.292	1.718	50	20	IDGD	
CN1CCN(C(=O)c2ccccc2NC(=O)C(=O)NNc2cccc([N+](=O)[O-])c2)CC1	784828779	KBMWSYCFMRCPPI-UHFFFAOYSA-N	426.433	1.064	50	20	IDGD	
CCOc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NNc1cccc(C(=O)OC)c1	784851641	MUCPONMQUCCPGS-UHFFFAOYSA-N	428.445	1.656	50	20	IDGD	
Cc1ccc(CNC(=O)NNC(=O)COc2ccccc2O)c(-n2cc(Cl)cn2)n1	786836044	UIQNJYQHEDHZGW-UHFFFAOYSA-N	430.852	1.844	50	20	IDGD	
Cc1nn([C@H]2CCS(=O)(=O)C2)c(C)c1/C=C(/C#N)C(=O)NCc1ccc([N+](=O)[O-])cc1	787148143	RTIIAGDGRUBABT-VUZIPCMWSA-N	443.485	1.991	50	20	IDGD	
CN1CCN(c2ccc(NC(=O)C(=O)NNc3ncccn3)cc2Br)CC1	787894825	CQEAYFJKXSQGPV-UHFFFAOYSA-N	434.298	1.073	50	20	IDGD	
Cc1ccc([C@]2(C)NC(=O)N(CC(=O)NNc3nnc(-c4ccccn4)s3)C2=O)cc1	788563916	VJEXXZHMONUPRU-FQEVSTJZSA-N	437.485	1.819	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)c2cccc(NN3C(=O)[C@H]4CC=CC[C@@H]4C3=O)c2)n1	788631455	XBJLCVDGVRCTGQ-ROUUACIJSA-N	436.472	1.239	50	20	IDGD	
Cc1nc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)ccc1Br	789811982	HZSYJWAWQBZDPS-BBRMVZONSA-N	447.289	1.811	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2cc(C)ccc2-n2cnnc2)c2ccccc2c1=O	789938868	HKADQDDNBJXFED-UHFFFAOYSA-N	431.456	1.770	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccc2c1OCC[C@@H]2OC	790950978	AKUOPFJMQBYTAV-SFHVURJKSA-N	427.457	1.884	50	20	IDGD	
CSSCCNC(=O)c1cc(O)nc2ccc(S(=O)(=O)N3CCOCC3)cc12	791156790	FFTFZZVLPPLZIO-UHFFFAOYSA-N	443.572	1.702	50	20	IDGD	
Cc1ccc(-n2ncc(NC(=O)C(=O)NNC(=O)Cn3nc(C)cc3C)c2C(C)C)cc1	792269287	PKCGINPOZNXXKH-UHFFFAOYSA-N	437.504	1.904	50	20	IDGD	
CN(C)C(=O)CNC(=O)c1ccc(NC(=O)NNc2nc3ccccn3n2)cc1Cl	792333599	OBDJCLDGMJMDBY-UHFFFAOYSA-N	430.856	1.349	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)cccc1NC(=O)N(C)C	792355037	NUMQHAJDGQGBNG-ZDUSSCGKSA-N	445.451	1.781	50	20	IDGD	
O=C(NNC(=O)c1cc(Cl)ccc1O)C(=O)Nc1cccc(N2C(=O)CCCC2=O)c1	792355198	RDJIGHYROBNRSB-UHFFFAOYSA-N	444.831	1.489	50	20	IDGD	
O=C(CCc1cnccn1)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	792803544	BRJOYZNMGLANBG-UHFFFAOYSA-N	428.452	1.629	50	20	IDGD	
CC(=NNC(=O)c1nn(C)c(=O)c2ccccc12)c1cc(S(N)(=O)=O)c(C)cc1C	794472137	YSKTXNSWGYYZQS-UHFFFAOYSA-N	427.486	1.352	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)[C@H]2[C@@H]3[C@@H]4[C@H]5[C@H]6C[C@@H]4[C@H]2[C@@H]6C[C@H]53)cc1OC	796324192	NQZMUVZTWVZCSY-HZGDKJAHSA-N	426.469	1.402	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)N[C@@H]1C[C@H]1c1cc(F)c(F)c(F)c1	798063893	OEBDXZNYKDSCIQ-XJKSGUPXSA-N	434.422	1.997	50	20	IDGD	
CCOC(=O)[C@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)c1cc(C)nc2ccccc12	799009296	SPEVWBLIEUPCDE-MRXNPFEDSA-N	430.461	1.761	50	20	IDGD	
O=C(NCCNS(=O)(=O)c1ccc(Cl)cc1F)NNC(=O)c1ccccc1O	799665945	QDLCSTZDZFLLGF-UHFFFAOYSA-N	430.845	1.107	50	20	IDGD	
O=C(/C=C/c1ccccc1)NCCCNC(=O)NNC(=O)c1nnc(O)c2ccccc12	800759186	KOJLISBTRCIOCG-VAWYXSNFSA-N	434.456	1.499	50	20	IDGD	
CCOc1ccc(-c2nnc(S)n2CCC(=O)NNC(=O)N=c2cc[nH]cc2)cc1	802025431	GHXHLIJHCKVFQI-UHFFFAOYSA-N	427.490	1.692	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)c2cn(C)nc2-c2cnn(C)c2)cc1Cl	802072391	MXGGSQNPCWAOKB-UHFFFAOYSA-N	433.856	1.958	50	20	IDGD	
COc1cccc(C[C@@H](C(=O)NNC(=O)Nc2ccc(N(C)C)cc2)n2nnnc2C)c1	802120342	PZZGLUIRQFNOGF-IBGZPJMESA-N	438.492	1.693	50	20	IDGD	
COc1cccc(CCC(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)c1F	802762809	MMWPIQZIZCSYSW-UHFFFAOYSA-N	442.491	1.372	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)CCCS(=O)(=O)c2ccc(Cl)cc2)C[C@H](C)O1	806340191	OKQSYUXBHQGJOT-GJZGRUSLSA-N	445.969	1.541	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)N[C@@H]1CCN(Cc2ccccc2)C1	807007342	DADPXMNJSJSZNM-QGZVFWFLSA-N	444.561	1.507	50	20	IDGD	
COC(=O)Cc1cc(Br)ccc1S(=O)(=O)NNC(=O)c1ccccc1F	811675702	LQXXMOIERYJYHA-UHFFFAOYSA-N	445.266	1.927	50	20	IDGD	
C[C@H]1CCCN(c2cc(C(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)ccn2)C1	812446121	NUNSIIVXBOYLDH-HNNXBMFYSA-N	445.545	1.643	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N1CC[C@@]2(CCN(C)C2)C1	814270598	AFONOCQLZWUSEF-SCLBCKFNSA-N	425.327	1.985	50	20	IDGD	
Cc1cc(CC(C)(C)C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)ccc1Br	814620524	UZGWZINNAHXPPC-ZDUSSCGKSA-N	446.367	1.844	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2O)cc1)[C@@H]1C[C@@H]1C	815569330	PADCDTGSLNEULM-SUMWQHHRSA-N	440.456	1.318	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2cccc3ncccc23)nnn1Cc1ccccc1F	815569459	VCBPWHATFSBQJU-UHFFFAOYSA-N	447.430	1.722	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCc2nncn2C1)C(=O)Nc1ccc(C(F)(F)C(F)(F)F)cc1	815691052	DJIBCPDPGDDEGQ-SECBINFHSA-N	446.336	1.281	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCO1)C(=O)Nc1ccc(Oc2cccc(Br)c2)nc1	815778201	GYCZJMOMQBRNPR-CQSZACIVSA-N	449.261	1.901	50	20	IDGD	
COC(=O)c1cc(NNC(=O)c2ccc(S(=O)(=O)CC(=O)N(C)C)cc2)ccc1C	816689136	UIBTUDGCPQCUMF-UHFFFAOYSA-N	433.486	1.400	50	20	IDGD	
CC[C@H](C)[C@H](NC(=O)N1CCCC1)C(=O)NNc1ccccc1S(=O)(=O)N(C)C	817054822	ZUZAPEHGLSEVBL-YOEHRIQHSA-N	425.555	1.600	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)CN(C)c2ncnc3[nH]cnc23)c1	818751290	YWIJUSMFAWPJBF-UHFFFAOYSA-N	434.254	1.482	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)CN2C(=O)N[C@@]3(C[C@@H](C)CC(C)(C)C3)C2=O)c1	825776112	BPDGPNWRCXRVKE-RCDICMHDSA-N	445.520	1.391	50	20	IDGD	
CCc1ccc(NS(=O)(=O)c2cc(C(=O)N3CC[C@@H](B(O)O)C3)ccc2OC)cc1	864234518	SEPLWVVWKTXMHG-MRXNPFEDSA-N	432.307	1.747	50	20	IDGD	
CC(C)C[C@H](C(=O)NNC(=O)COc1ccc(F)cc1)N1C(=O)[C@@H]2CC=CC[C@H]2C1=O	910865370	TWYUREXRBLOYFF-KZNAEPCWSA-N	431.464	1.718	50	20	IDGD	
Cc1cc(Br)cc2c1NC(=O)C2=NNC(=O)c1ccc(-n2cnnn2)cc1	915048814	HVAGJTBXXUPMGM-UHFFFAOYSA-N	426.234	1.819	50	20	IDGD	
COc1cccc([C@@H](CNC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])N(C)C)c1	915902450	ULJQKIKKCCIHOA-QGZVFWFLSA-N	431.449	1.616	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCc2nnc3ccc(C(F)(F)F)cn23)cc1OC	916222648	JNKDRMPGBYQFOS-UHFFFAOYSA-N	438.366	1.910	50	20	IDGD	
CC(=NNC(=O)c1cccnc1)c1ccc(S(=O)(=O)N2CCCC[C@H]2C(=O)O)cc1	916251341	GHEFVFZZBUVYNP-SFHVURJKSA-N	430.486	1.863	50	20	IDGD	
CN(C)CCN1CCC(NC(=O)NNC(=O)COc2ccc(Br)cc2)CC1	916382613	LOBINBCCLRVEBK-UHFFFAOYSA-N	442.358	1.184	50	20	IDGD	
CN1CCN(C(=O)c2ccc(CNC(=O)NNC(=O)c3cccc(N(C)C)c3)cc2)CC1	916390349	LEMGALLIPFZWGX-UHFFFAOYSA-N	438.532	1.284	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)NCCCOCC(F)(F)F)c2ccccc2c1=O	916459405	DJENKXTXZITQBC-UHFFFAOYSA-N	429.399	1.890	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C2CCN(C3=NS(=O)(=O)c4ccccc43)CC2)c(O)c1	918341061	LJUIATVOLWLEJG-UHFFFAOYSA-N	442.497	1.323	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)CN3C(=O)N[C@@](C)(c4ccccc4)C3=O)n[nH]2)cc1	918695207	PVMUQCDDNMMGKN-QHCPKHFHSA-N	446.467	1.613	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)c1ccc(OC)c(S(=O)(=O)N2CCCC2)c1	919820035	HNNZDGRLPNYYII-UHFFFAOYSA-N	447.513	1.492	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)c2ccc(N3CCCS3(=O)=O)cc2)o1	920272229	FWNZTAPGZUIWCX-UHFFFAOYSA-N	434.518	1.736	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)c1ccc(N2CCOC2=O)cc1	920989602	JXHUNDDUZPAHCD-ZDUSSCGKSA-N	436.432	1.324	50	20	IDGD	
CCCNC(=O)NNC(=O)c1ccc(CNS(=O)(=O)c2ccc(NC(C)=O)cc2)cc1	921042857	RAXCYAMTJLQAEI-UHFFFAOYSA-N	447.517	1.478	50	20	IDGD	
CCCNC(=O)NNC(=O)c1ccc(Cl)c(S(=O)(=O)N2C[C@H](C)O[C@H](C)C2)c1	921042961	XAIYACJDVDGUJB-TXEJJXNPSA-N	432.930	1.492	50	20	IDGD	
Cc1cc(C)cc(NNC(=O)[C@@H](CCS(C)(=O)=O)NS(=O)(=O)c2ccccc2)c1	932436960	GMJNLQFMLXETQV-GOSISDBHSA-N	439.559	1.528	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)cc1	1115853265	SIIUHXLHDMDJLU-UHFFFAOYSA-N	441.532	1.860	50	20	IDGD	
O=C(NCC1CCN(S(=O)(=O)C(F)(F)F)CC1)NNC(=O)c1ccccc1Cl	1251798869	TZQRGCYLYMHOPF-UHFFFAOYSA-N	442.847	1.846	50	20	IDGD	
Nc1cnnc(NNC(=O)c2cc([N+](=O)[O-])ccc2I)c1Cl	1319220807	WDIYQZKJTNLUEA-UHFFFAOYSA-N	434.581	1.982	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cc3c(c(S(N)(=O)=O)c2)CCC3)ccc1OC(C)C	1323040948	REYAVPNKOKIWLO-UHFFFAOYSA-N	447.513	1.693	50	20	IDGD	
COc1ccc([C@H](O)C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](F)Cl)C2)cc1	1778022652	NOGDLTQGMBCXTA-NHAYFPRASA-N	428.888	1.777	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccc3cnccc3n1)CCO2	1779295376	KYRWKKMRNBMJIU-OAQYLSRUSA-N	428.565	1.925	50	20	IDGD	
Cn1ncc2c(C(=O)N3CCO[C@]4(CCN(C(=O)CO[Si](C)(C)C)C4)C3)cccc21	1779297239	XOZFTCANCGOVHD-NRFANRHFSA-N	430.581	1.868	50	20	IDGD	
CC(C)n1cnc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CO[Si](C)(C)C)C2)n1	1779544039	IBHHQQFEXDMHOG-OXQOHEQNSA-N	437.617	1.838	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc(OC)cc2O)C1	1780323571	UAYUNNFCTKEEGM-YRISNDGFSA-N	440.924	1.782	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc3n(n1)CCC3)C2)[C@H](F)Br	1780775100	ZWWKEUSIVOMTCQ-RVKKMQEKSA-N	443.317	1.647	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(N4CCN(C)CC4)cc3)CCO2)C1	1781210963	FHYPZKFGXTYPOW-NZQKXSOJSA-N	448.995	1.899	50	20	IDGD	
O=C(c1cccc2nc[nH]c12)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781331762	VWSHCMJMWXLZQB-PBHICJAKSA-N	425.258	1.697	50	20	IDGD	
C[C@@H](C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@](C)(Cl)CCl)C2)n1ccnn1	1781548338	CXDGFCLBKVRBMB-IHETXDGRSA-N	432.352	1.589	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccn3cncc3c1)C2	1782175665	OSRJNPXUJHJLRQ-DBXWQHBBSA-N	434.924	1.716	50	20	IDGD	
Cc1ccn2c(C(=O)N3CC[C@]4(CN(C(=O)CO[Si](C)(C)C)CCO4)C3)cnc2c1	1782490859	YNJUGIORWNOQJM-NRFANRHFSA-N	430.581	1.938	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C=C/C(C)C)C1	1782829283	IAUWLOPZLJGOHN-VABFRFCASA-N	443.548	1.847	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H]2CCCSC2)C1	1783205665	QGZJJJWHXKYBQU-CSODHUTKSA-N	440.610	1.017	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(-n4ccnc4)ccn3)CCO2)C1	1783537555	OMTNUJNWRUWYJK-KUHUBIRLSA-N	448.321	1.494	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3c(-c4ccncn4)noc3C)CCO2)C1	1783883849	ZUKPZJVNQDLTLE-VBKZILBWSA-N	449.895	1.137	50	20	IDGD	
C#CCCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2	1785418020	HTAFOHXFUJBRMA-YWZLYKJASA-N	427.929	1.362	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)N1CC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1785570242	KIMLMKXCNRNXDW-SFHVURJKSA-N	438.352	1.925	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)nc(Cl)c3)C[C@@H]21	1786400909	FLWDDKDHQSGCEC-DRZSPHRISA-N	446.729	1.819	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCBr)[C@H]2C1	1786404845	WKAWQGDVIIIZJW-VOAKCMCISA-N	440.176	1.782	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc([N+](=O)[O-])o3)C[C@@H]21	1786404911	ZIBZFPIABPARAP-GVXVVHGQSA-N	430.255	1.566	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CC(F)(F)C(=O)O)[C@H]2C1	1787435646	AIEPEOYBKMYCKJ-YFKTTZPYSA-N	441.269	1.250	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)c1cnn2cccnc12	1788293976	TYFHPSSJOBSKSD-PYJNHQTQSA-N	440.273	1.013	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)c1ccn2ccnc2c1	1788357997	RZLBIPRHLRENDZ-JYJNAYRXSA-N	435.322	1.713	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc4n(n3)CCC4)[C@H]2C1	1788415036	POSINJHJIURUGO-HAHWVIBASA-N	429.348	1.659	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)c1cc2n(n1)CCC2	1788415052	RGJQSGCZPVCGQA-HQRZJTNHSA-N	429.290	1.113	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc4c(c3)OCO4)C[C@@H]21	1788761360	URCGHSIXZFIPIW-ZWOKBUDYSA-N	448.592	1.789	50	20	IDGD	
O=C(CC12CCCN1CCC2)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21	1789823212	UPSUBHBXJFMESH-JKQORVJESA-N	446.361	1.675	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4[nH]ccc4n3)C[C@@H]21)[C@H](F)Br	1789925737	IKXMLOOQEPPYPK-GREKMHCPSA-N	439.285	1.847	50	20	IDGD	
C[C@H](Cn1ccnc1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]2C1	1789926899	KMNBCSBRFIVLSY-QTVXIADOSA-N	431.306	1.189	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC1(c2ccc(NC(=O)c3ccnnc3O)cc2)CCC1	1789973163	PJIYSEPPVSDOLC-UHFFFAOYSA-N	426.477	1.303	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3ccc(O)nn3)[C@H]2C1	1790566207	CVECCJYOSZYDDS-XPVILTJLSA-N	445.347	1.331	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(Cl)nn3)C[C@@H]21	1790960308	ACPBIJUUTUGQID-FMSGJZPZSA-N	445.745	1.897	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3[nH]cnc3-c3cccnc3)C[C@@H]21	1791255614	XEYNTPWKOOTNSA-NXOAAHMSSA-N	447.923	1.319	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cc(C)cc(F)c3)C[C@@H]21	1791257446	GZVSWELCOGOSHI-WNHJNPCNSA-N	426.916	1.910	50	20	IDGD	
CCS(=O)(=O)N[C@@H](C)C(=O)NC1(c2ccc(NC(=O)[C@@H](Cl)COC)cc2)CCC1	1791565618	SMQBHBLQNSDRCN-BBRMVZONSA-N	445.969	1.702	50	20	IDGD	
C[C@H](C(=O)Nc1ccc(C2(NC(=O)CCC(=O)NN(C)C)CCC2)cc1)n1cccn1	1791885340	LXUPBTALZOKDJH-MRXNPFEDSA-N	426.521	1.951	50	20	IDGD	
Cc1cc(Cl)ccc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(B(O)O)cc1)C2	1792737801	PFMXONFLEQITCM-REPLKXPHSA-N	426.709	1.894	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccnc(C(F)F)c1)c1ccc(B(O)O)cc1	1794566264	LFLHIIUCZDZBLZ-BJWYYQGGSA-N	429.232	1.265	50	20	IDGD	
CCn1nc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)c2ccccc21	1796189332	ZCCNEJIKXMDOQF-REPLKXPHSA-N	446.316	1.302	50	20	IDGD	
C[C@H]1CC[C@@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Cl)N1C(=O)OC(C)(C)C	1796361781	UDAMXLDOHUAPCO-KXKVQDCLSA-N	447.935	1.898	50	20	IDGD	
CC(C)(C)OC(=O)NCC(C)(C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Cl	1796369742	BWQOLAJMIPVDRY-XJFOESAGSA-N	435.924	1.661	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cc1ccc(C)o1)C2	1796893008	GRSKFODNNAHTEA-GSWMANSFSA-N	425.489	1.903	50	20	IDGD	
Cc1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)nn1C(F)F	1798439993	RPTIIFVXSYDOPB-CLLJXQQHSA-N	447.446	1.151	50	20	IDGD	
COc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCBr)C3)c(C)c1	1799024119	TXQXNXXWZBDMLS-ZSBFGKGUSA-N	425.323	1.992	50	20	IDGD	
COc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@](C)(Cl)CCl)c(O)c1	1799276419	GJANZTSAJCQSBF-FIXGWNCBSA-N	431.316	1.840	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc([N+](=O)[O-])ccc1N(C)C	1799798063	LRDVCDAXMPTDGI-VLWCASSMSA-N	438.912	1.881	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)c2ccc(O)nn2)[C@@H]1c1cccnc1	1805271167	VBDWTHRQNRLORH-RBOXIYTFSA-N	434.294	1.680	50	20	IDGD	
Cc1ncccc1C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1805503869	GCDIPZAWBRTAJI-AVRDEDQJSA-N	438.532	1.478	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC2(CCCN(C(=O)[C@H](C)CS(C)(=O)=O)C2)CC1	1806047658	NWFIFZMLRSUPBW-KGLIPLIRSA-N	437.400	1.682	50	20	IDGD	
COCCOCC(=O)N1CC[C@H](CNC(=O)CCBr)[C@@H]1c1cccnc1	1806340650	ITFDOAAVNKXTGE-QAPCUYQASA-N	428.327	1.535	50	20	IDGD	
COc1ccc(C(=O)N2CCCC3(CCN(C(=O)CCC(=O)NN(C)C)CC3)C2)s1	1807504909	VTSQNIIMADBEKZ-UHFFFAOYSA-N	436.578	1.975	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC2(CCCN(C(=O)C3CCOCC3)C2)CC1	1809366603	BBHKAZDFOHORHB-KOEQRZSOSA-N	443.548	1.778	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCC2(CCCN(C(=O)c3cc(=O)n4[nH]cnc4n3)C2)CC1	1809963887	ZQDCGWHIYXZIQF-CQSZACIVSA-N	434.928	1.670	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)CC(N)=O)[C@@H]1c1cccnc1	1812865420	OTPFNFLYQVENKV-LMRQPLJMSA-N	425.327	1.382	50	20	IDGD	
Cc1cc[nH]c1C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1813069734	BBCCTQUFUFLTPQ-UTKZUKDTSA-N	426.521	1.411	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)CNC(=O)C(F)(F)F)[C@@H]1c1cccnc1)C(Cl)Cl	1813081979	IIPWVEOXIXPABD-ZYHUDNBSSA-N	441.237	1.570	50	20	IDGD	
Cn1cccc1C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1	1819795128	IGXXZGIXIJUPFX-LLVKDONJSA-N	439.501	1.020	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](F)Br)CC2)c1ccnnc1O	1821102313	TWJCFGBAPOBFDP-LHLIQPBNSA-N	430.259	1.555	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnc(O)nc2O)[nH]n1	1822187628	YBAYXKZPBMJINN-KCJUWKMLSA-N	439.270	1.700	50	20	IDGD	
C[C@@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)C(Cl)Cl)n[nH]1)N1CCN(C)CC1	1822420942	GPUTWFPZHQAKSK-GXTWGEPZSA-N	431.368	1.841	50	20	IDGD	
O=C(COc1ccccc1F)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](O)CCl)CC2	1825455220	QAKURUUWNZFYAI-ZWNOBZJWSA-N	427.885	1.873	50	20	IDGD	
C=CCC(F)(F)C(=O)N[C@@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1	1826089622	HWSDNCYAXGCWTM-LLVKDONJSA-N	429.493	1.640	50	20	IDGD	
Cc1ccc(CC(=O)Nc2nc3c(s2)C[C@@H](NC(=O)CCC(=O)NN(C)C)CC3)o1	1827091179	VTLFDRKWTAHOQT-ZDUSSCGKSA-N	433.534	1.572	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)Cc2cscn2)CC1	1827124910	FPDLPARXKDJVKZ-FQEVSTJZSA-N	441.362	1.299	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(=O)n3[nH]cnc3n2)CC1	1830305876	FEHOKBGFBCJXKN-ZBFHGGJFSA-N	434.928	1.668	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(F)nc3F)C2)C1	1831640015	WUEUXCQFIBFGHY-IFXJQAMLSA-N	431.867	1.837	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H](N)c2ccccn2)CC1	1831870839	GONMIWRRVLSTTP-DENIHFKCSA-N	444.580	1.074	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2cnc[nH]2)CC1	1832096981	RTCKDKBWOFTSNW-QQUYBBDPSA-N	436.321	1.036	50	20	IDGD	
CC[C@@H](NC(C)=O)C(=O)NC1CCN(C2CCN(C(=O)[C@H](C)Br)CC2)CC1	1833097315	LXOIAIDQOHDWDM-SUMWQHHRSA-N	445.402	1.256	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](C)n3ccnc3)CC2)CC1	1833378985	ZTSQERRFQJKCET-LSDHHAIUSA-N	440.386	1.799	50	20	IDGD	
CCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](Br)Cc3ccccc3)C2)C1	1834816128	YHERAIHFWKTBCY-YLJYHZDGSA-N	439.350	1.859	50	20	IDGD	
C#CCCC(=O)N1CCC(N2CCC(NC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CC2)CC1	1835118123	RVBYYFLHYZEKKZ-YZSQISJMSA-N	440.548	1.105	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3ccc(C)nc3O)CC2)CC1	1836151583	MSJJPOJTAGMBMA-GOSISDBHSA-N	438.956	1.535	50	20	IDGD	
CC(C)c1cc(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)on1	1836179464	XRSQXSAYTZBSTP-KRWDZBQOSA-N	426.945	1.583	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccnc(OC)c3F)CCO2)C1	1836237918	OJYKSFFNFDQBRE-IFXJQAMLSA-N	429.876	1.317	50	20	IDGD	
Cc1nc(CC(=O)N2CCC(OC3CCN(C(=O)CO[Si](C)(C)C)CC3)CC2)no1	1837156121	GGVAZZFGDLOSPQ-UHFFFAOYSA-N	438.601	1.771	50	20	IDGD	
Cn1cc(C(=O)N2CCC(OC3CCN(C(=O)[C@H](F)Br)CC3)CC2)cn1	1837467695	MUUVAMJJFPXKME-HNNXBMFYSA-N	431.306	1.723	50	20	IDGD	
CC(C)c1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)n[nH]1	1838698744	XESQPCSAEHJBPZ-OALUTQOASA-N	447.363	1.839	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cc(F)cc(F)c3)C2)C1	1839144315	VEVHLJLSCCMRPD-PXNSSMCTSA-N	430.879	1.981	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)COc3ccccc3C#N)C2)C1	1839149578	LVZFTJGSEQKWLT-LAUBAEHRSA-N	435.908	1.411	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)n(C)n1	1839151228	LJTQIQVHQKRWNM-MSOLQXFVSA-N	433.336	1.035	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3cncnc3)C2)C1	1839151811	DUDLUXHWPOIYIB-RTBURBONSA-N	445.347	1.102	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3c(C)noc3C)C2)C1	1839963113	ACYZADQWDYZUKQ-KBXCAEBGSA-N	444.326	1.535	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccccc3)C2)C1	1840031966	JDVUUKRWTYZFMG-DNVCBOLYSA-N	425.323	1.469	50	20	IDGD	
CCOc1ccccc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](Cl)COC)CCO2	1840154198	PCHPVUIAZFXMAU-LAUBAEHRSA-N	440.924	1.409	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cccc(F)c3F)C2)C1	1840156159	OOMJFWAAZYJJEU-MGPUTAFESA-N	446.878	1.218	50	20	IDGD	
O=C(C(Cl)Cl)N1CCO[C@]2(COCCN(C(=O)C3(C(F)(F)F)CCC3)C2)C1	1840188066	MARMZRZAJWUCOT-CQSZACIVSA-N	433.254	1.979	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)/C=C/c3cnccn3)CCO2)C1	1840488186	XFIDJYSJYXCVPW-KTBRJVSMSA-N	443.331	1.183	50	20	IDGD	
CCSc1ncccc1C(=O)N1CCCC12CN(C(=O)c1ccc(B(O)O)cc1)C2	1840989526	XTHVWRLRFWUFQT-UHFFFAOYSA-N	425.319	1.004	50	20	IDGD	
O=C(c1cn2cc(Br)ccc2n1)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1	1841351228	JLCQUOKBHXIYKQ-ZDUSSCGKSA-N	441.713	1.514	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@H]2CCN(C(=O)OC(C)(C)C)C2)C1	1843904123	RFPIPEQTIYYNAA-HUUCEWRRSA-N	429.945	1.701	50	20	IDGD	
Cc1cccc2[nH]c(C(=O)N3CC4(CCCN4C(=O)c4cnccc4C(=O)NN)C3)cc12	1844264460	VGMIJQCWNVIXCH-UHFFFAOYSA-N	432.484	1.606	50	20	IDGD	
CN(CC(=O)N1CC2(CCCN2C(=O)c2cc(C#N)c[nH]2)C1)NC(=O)NCc1ccccc1	1844796316	GTEKCUQKZFHBDR-UHFFFAOYSA-N	449.515	1.050	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@](O)(C(=O)N2CCCC23CN(C(=O)C(C)(C)CCl)C3)C1	1846410312	MEFMPEDRPVYJQN-NRFANRHFSA-N	443.972	1.827	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H]1C[C@H]1c1ccc(F)cc1	1847457909	UVIXBRRPTBOUKV-ZULIPRJHSA-N	437.475	1.443	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)C[C@H]1OCCc2ccccc21	1847755757	AVBREXGCFNKSEH-SLFFLAALSA-N	428.533	1.265	50	20	IDGD	
Cc1nn(Cc2ccccc2)c(C)c1CNC(=O)NNC(=O)c1n[nH]c(=O)c2ccccc12	9754498	ONKWDJTYZUEPSD-UHFFFAOYSA-N	445.483	1.929	50	20	IDGD	
Cc1c(C(=O)NNC(=O)[C@H]2COc3ccccc3O2)sc2nc3n(c(=O)c12)CCC3	15663378	LAUHJQIMXDLWHN-CYBMUJFWSA-N	426.454	1.314	50	20	IDGD	
CC(=O)N/C(=C/c1ccccc1)C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	21186137	YYHUUYKYPHLNLS-RELWKKBWSA-N	435.528	1.523	50	20	IDGD	
CCOc1ccc(CN2CCN(CC(=O)NNC(=O)Cc3nc(C)cs3)CC2)cc1	27568782	ZISXAWQZUDGSDT-UHFFFAOYSA-N	431.562	1.358	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)N/N=C1/C(=O)Nc2ccccc21	45295969	WOMKGZYLPYJHHF-UHFFFAOYSA-N	442.497	1.113	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)nnn1-c1cccc(Cl)c1	108300395	AIPGQVMKGFHVBQ-UHFFFAOYSA-N	447.908	1.597	50	20	IDGD	
CN(C[C@H]1CCCN(CC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)C1)C(=O)OC(C)(C)C	727135539	ZYPBDIYZIGRRSY-OAHLLOKOSA-N	449.508	1.935	50	20	IDGD	
CN(C)Cc1ccc(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)cc1	728213599	AZAZGCUKAUETSD-UHFFFAOYSA-N	431.562	1.441	50	20	IDGD	
O=C(CCC(=O)N1CCC(c2ccccc2)=N1)NNC(=O)C1CCN(c2ncccn2)CC1	728847989	RVLPMJJOCJMVOQ-UHFFFAOYSA-N	449.515	1.257	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)[C@H](c2ccccc2)N2CCN(C)CC2)o1	729528384	VCUJEWNCVKYIBF-NRFANRHFSA-N	427.549	1.871	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@H](C(=O)NNC(=O)COc2ccccc2O)C(C)C)cc1	730780175	JHMCNPDTSVAAKT-IBGZPJMESA-N	435.502	1.230	50	20	IDGD	
O=C(COc1ccccc1O)NNS(=O)(=O)c1cccc(C(=O)NCC(F)(F)F)c1	730814074	QDQPELKLEKEURU-UHFFFAOYSA-N	447.391	1.073	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)OCCN(C)S(=O)(=O)N(C)C)c(C)n1C[C@@H]1CCCO1	731143964	HQYYHSZGNDKOKW-GQEMFKIVSA-N	438.550	1.472	50	20	IDGD	
Cc1cc(Cl)ccc1OCCCC(=O)NNC(=O)C1CCC2(CC1)NC(=O)NC2=O	731470093	NRLWTVSTCJLBHW-UHFFFAOYSA-N	436.896	1.723	50	20	IDGD	
CC(=NNC(=O)c1ccnc(N(C)C)c1)c1ccc(S(=O)(=O)N2CCOCC2)cc1	731562237	RNWMIWZLTJXMOG-UHFFFAOYSA-N	431.518	1.323	50	20	IDGD	
O=C(NNC(=O)[C@@H](O)c1cccnc1)c1cccc(S(=O)(=O)NCc2ccccc2)c1	731866184	ZTOJKAITVAOCKV-IBGZPJMESA-N	440.481	1.055	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])o2)cc1OC	731957507	OJKVDLDKPRJIMR-GFCCVEGCSA-N	432.389	1.271	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)cc1OC	731957663	VONFPIULFIXMEU-LBPRGKRZSA-N	448.457	1.739	50	20	IDGD	
CC(C)c1ccc(-c2nc(CC(=O)NNC(=O)N[C@H]3CCS(=O)(=O)C3)cs2)cc1	732061140	CPTUJRVBJJCSKK-HNNXBMFYSA-N	436.559	1.994	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@H](NC(=O)NNC(=O)C(=O)N1CCCC1)C1CCCCC1	732472998	OQPWFLWODMGWPA-HNNXBMFYSA-N	425.530	1.413	50	20	IDGD	
NC(=O)c1ccccc1N1CC[C@H](NC(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)C1	732576164	QKLCRQFXDVNEIA-YWWNBQKISA-N	425.533	1.911	50	20	IDGD	
CN(CCNC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1)C1CC1	732891503	KSTSUJQWWMWQNL-UHFFFAOYSA-N	437.547	1.587	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2sc(-c3cnn(C)c3)nc2C)n1	734604506	NAYDBCJZYFSIRT-UHFFFAOYSA-N	434.503	1.164	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2ccc3c(c2)N(C(C)=O)CCC3)cc1OC	736063326	HAWPUFAWSNOSIA-UHFFFAOYSA-N	433.486	1.626	50	20	IDGD	
COc1cc2ncn(CCCC(=O)NNc3ccnc(N(C)C)n3)c(=O)c2cc1OC	740112999	WIZPZDOAYMKABN-UHFFFAOYSA-N	427.465	1.193	50	20	IDGD	
CN(C)CCN1C[C@@H](C(=O)NNC(=O)c2cc(-c3ccco3)nc3ccccc23)CC1=O	742241508	LACDQZQBKFALDC-HNNXBMFYSA-N	435.484	1.666	50	20	IDGD	
C/C(=C/C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)C(C)(C)C	742487182	LPZRZDZIGRBFJG-NXVVXOECSA-N	437.562	1.780	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)NCC(C)(C)N2CCOCC2)cc1Cl	743504632	IHXJBZZPFGYGRM-UHFFFAOYSA-N	429.905	1.804	50	20	IDGD	
CN(C)[C@@H](CNC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)C1CCCCC1	743613639	HXJNTPGQDXBZOX-KRWDZBQOSA-N	425.555	1.936	50	20	IDGD	
CC(C)C(=O)NNC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(Br)s1	743737967	MTDJVECWYOPYGG-JTQLQIEISA-N	438.369	1.857	50	20	IDGD	
CC(=O)N[C@@H](CC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)c1ccc(C)cc1	743831311	VGMQFWCKJWFLGV-SFHVURJKSA-N	432.502	1.819	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)C(=O)C2)cc1	744404810	XRBTXGIOQIIZNE-UHFFFAOYSA-N	425.876	1.317	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)CCNC(=O)c2ccc([N+](=O)[O-])cc2)c1	744472525	WPDYNWPSTPAUEG-UHFFFAOYSA-N	428.401	1.028	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)[C@@H]2CCCN(C(=O)c3ccc(F)cc3)C2)c1	744531180	LZFDOLNHEHMFFQ-GOSISDBHSA-N	441.459	1.991	50	20	IDGD	
C[C@@H](OC[C@@H]1CCCCO1)C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	744619867	BHRNOAILKQAVQN-CVEARBPZSA-N	427.523	1.125	50	20	IDGD	
COC(=O)c1ccc(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)s1	744622215	QSTJWHNNCUIXFN-UHFFFAOYSA-N	425.488	1.313	50	20	IDGD	
CC(C)c1nc(C#N)c(NNC(=O)[C@@H]2CCCN2C(=O)/C=C\c2ccc(C(N)=O)cc2)o1	746526323	ZSBOLNZUKMKLPL-JEZWAEDTSA-N	436.472	1.916	50	20	IDGD	
COc1ccc2c(c1)OC[C@H](C(=O)OCC(=O)NNC(=O)c1cc(Cl)ccc1OC)C2	747528542	YXSPNKUONYFBDC-CYBMUJFWSA-N	448.859	1.913	50	20	IDGD	
COc1cc(OC)c(S(=O)(=O)NNC(=O)Cc2cccnc2)cc1Br	747613607	RVPKJTMBQBVDKG-UHFFFAOYSA-N	430.280	1.414	50	20	IDGD	
O=C(NNc1ccc(F)cc1Br)[C@H]1CC(=O)N([C@@H]2CCS(=O)(=O)C2)C1	748073768	YHLQOGGMIOSIAI-GXSJLCMTSA-N	434.287	1.067	50	20	IDGD	
N#Cc1ccc(NNC(=O)c2ccc3c(c2)S(=O)(=O)N(C[C@@H]2CCCO2)C3=O)cc1	748101060	UYRIVVJDEVQRCH-INIZCTEOSA-N	426.454	1.639	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)NC1CCN(Cc2coc(-c3ccccc3)n2)CC1	748627959	NGMKKROAUBSYCL-INIZCTEOSA-N	445.520	1.688	50	20	IDGD	
CC(C)(CNC(=O)NNC(=O)COc1ccc(OCc2ccccc2)cc1)S(C)(=O)=O	748968736	HUIHCKVOHRWTOV-UHFFFAOYSA-N	449.529	1.798	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCCNC(=O)C(C)(C)C	749420242	JRBWZPBLVSQYJE-LLVKDONJSA-N	429.315	1.709	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)c1cnn(-c2ccc(F)cc2)c1-n1cccc1	751201481	JWHQATAPIMHDTQ-UHFFFAOYSA-N	436.403	1.586	50	20	IDGD	
O=C(NNS(=O)(=O)c1cnn([C@H]2CCOC2)c1)c1cc(F)ccc1Br	751548457	RFNNWEMSCSLGEH-JTQLQIEISA-N	433.259	1.369	50	20	IDGD	
CN1C(=O)N[C@@]2(CCC[C@@H]2CNC(=O)NNC(=O)CSc2ccc(Cl)cc2)C1=O	753024642	OQEVBTAOBFCVPD-ADLMAVQZSA-N	439.925	1.483	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)[C@@]3(C)CCOC3)c2)cc1	754826965	BXBQRGZTXQETOX-FQEVSTJZSA-N	433.486	1.684	50	20	IDGD	
O=C(CSc1nnc(-c2ccncc2)n1Cc1ccco1)NNC(=O)Cc1cc[nH]n1	755276183	LIMHTHRQMNPBKW-UHFFFAOYSA-N	438.473	1.187	50	20	IDGD	
CCCc1c(C(=O)NNC(=O)Cc2cc[nH]n2)nnn1Cc1cccc(Br)c1	755283577	ZGWLFKONNKWSRR-UHFFFAOYSA-N	446.309	1.768	50	20	IDGD	
O=C(CSc1nnc(-c2ccncc2)n1-c1ccccc1)NNC(=O)Cc1cc[nH]n1	755289127	DTZMKLGKWJHUED-UHFFFAOYSA-N	434.485	1.535	50	20	IDGD	
COC(=O)CNC(=O)Cc1ccc(NC(=O)NNC(=O)c2cc(OC)cc(OC)c2)cc1	755863819	VKURLNRDXBLLDP-UHFFFAOYSA-N	444.444	1.002	50	20	IDGD	
CCN(CC)CCOc1cc(NC(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)ccc1OC	756279419	CRVMZPVWEGIEBP-CQSZACIVSA-N	442.538	1.003	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2ccc(O)c(Cl)c2)cc1NS(C)(=O)=O	756782159	OSDKJGYEASPOLG-UHFFFAOYSA-N	428.854	1.892	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)Nc2cnn(CC(=O)NC3CCCC3)c2)cc1	756794370	FUYXCDCHJKDOMM-UHFFFAOYSA-N	425.449	1.045	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)Nc1cnc(Br)c(Br)c1	757673252	AUYSOQKEOZOKDB-ZETCQYMHSA-N	440.092	1.811	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCCCC2)c1)C(=O)Nc1ccccn1	758833888	KBEKVNRULATIMU-UHFFFAOYSA-N	445.501	1.046	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1cc2ccccc2nc1Br	760291901	QSDLUNFJLJQZLG-SNVBAGLBSA-N	439.266	1.135	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)[C@@H](Cc1ccccc1)n1nnnc1C	762408067	FSSUPSBHKIHOCC-MRXNPFEDSA-N	426.502	1.714	50	20	IDGD	
Cn1ccc([C@@H](NC(=O)NNC(=O)CNC(=O)c2ccco2)c2ccc(Cl)cc2)n1	762571881	PYDCPWPWAJHLGY-KRWDZBQOSA-N	430.852	1.516	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)c2ccc3c(c2)SC2=NS(=O)(=O)CCN23)n1	762901415	IOWKGDYHLGYNRY-UHFFFAOYSA-N	447.546	1.691	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccccc2C)c1	763509907	VZLTUQUFGXHVSG-UHFFFAOYSA-N	432.502	1.425	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)C(=O)Nc1cc(F)ccc1Cl	763532357	XAWCFOYKDUXQFK-UHFFFAOYSA-N	447.898	1.777	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(NC(=O)C(C)C)cc2)cc1OC	763551742	ZTGAYLUZDAZZPL-UHFFFAOYSA-N	428.445	1.698	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1)c1c(F)cccc1F	763588675	IBHGCIWGNZXEJB-OAHLLOKOSA-N	430.455	1.674	50	20	IDGD	
Cc1nc(C)n(-c2ccccc2NC(=O)C(=O)NNC(=O)c2c(C)nc3ccccn23)n1	763628647	LDYGHUOYMFBFAT-UHFFFAOYSA-N	432.444	1.240	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2ccc(N3CCCC3=O)c(F)c2)c1	763646717	IQKZIBYFJNASMO-UHFFFAOYSA-N	442.447	1.734	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2ccc3c(c2)NC(=O)CS3)c1	763669197	UWWXECHDSNGTGR-UHFFFAOYSA-N	428.470	1.513	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccnn1C1CCCCC1	763682680	TXZUQCBJYBFIGR-UHFFFAOYSA-N	429.477	1.952	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(C(=O)NC)ccc1Cl	763713103	LGDGKNFLJOEEFO-UHFFFAOYSA-N	432.864	1.427	50	20	IDGD	
COC(=O)[C@@H](C)Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc(OC)cc(OC)c2)cc1	763774890	ISHIWVHKAGHCTO-ZDUSSCGKSA-N	443.456	1.455	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)CCC(=O)N3)cc1OC	763910285	BKEGHBQKTKSIFF-UHFFFAOYSA-N	440.456	1.768	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)cnc1Br	763977934	YIXMRNZLBDKLSC-UHFFFAOYSA-N	427.642	1.911	50	20	IDGD	
C[C@H](C#N)Oc1ccccc1NC(=O)C(=O)NNC(=O)c1cc(Br)cn1C	764004628	JHXLDYXFCGYPKN-SNVBAGLBSA-N	434.250	1.478	50	20	IDGD	
CC[C@@H](C)C(=O)NNC(=O)C(=O)Nc1c(C)cnn1[C@H]1CCN(Cc2ccccc2)C1	764081924	KTGMCWHYZMJOJE-QAPCUYQASA-N	426.521	1.771	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)c2cc(C)[nH]n2)sc2c1CC[C@H](CC)C2	764106332	JHSAFGHSWDQJDG-NSHDSACASA-N	447.517	1.871	50	20	IDGD	
CC(C)(C)c1cc(NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)n(-c2ccccn2)n1	764166278	ANKCGOGMKNYBJV-MRXNPFEDSA-N	448.483	1.654	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)C(=O)Nc1cnc(-c2ccccc2)nc1	764205100	ZAVCSZPXYKGWDM-UHFFFAOYSA-N	442.476	1.534	50	20	IDGD	
COc1ccc(Cn2nccc2NC(=O)C(=O)NNC(=O)c2cccc3ncccc23)cc1	764260902	SRPFUGQMHFXXCZ-UHFFFAOYSA-N	444.451	1.888	50	20	IDGD	
O=C(Cc1ccccn1)NNC(=O)C(=O)Nc1ccc(Cl)cc1C(=O)N1CCCC1	764267124	ONGKKUWHSBDXBX-UHFFFAOYSA-N	429.864	1.300	50	20	IDGD	
C[S@](=O)Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2O)ccc1Cl	764276031	WROSWJRRKOCTLA-LJAQVGFWSA-N	439.877	1.089	50	20	IDGD	
CSc1nnnn1-c1cccc(NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)c1	764349364	KCHYXSZZDNXXJQ-UHFFFAOYSA-N	447.864	1.143	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)C(=O)Nc1ccc(OCC(F)(F)C(F)F)nc1	764354549	RIEAEXNREOKEEI-UHFFFAOYSA-N	429.330	1.084	50	20	IDGD	
CCOc1cc(C(=O)N(C)C)ccc1NC(=O)C(=O)NNC(=O)COCc1ccccc1	764366763	PZOBPYYWDGQWKT-UHFFFAOYSA-N	442.472	1.090	50	20	IDGD	
CN1CCCN(c2ccc(NC(=O)C(=O)NNC(=O)COCc3ccccc3)cc2)CC1	764367099	IYFMSUSIXQFUHY-UHFFFAOYSA-N	439.516	1.131	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2cccc(-n3cccn3)c2)n[nH]1	764379178	RNOPFLBCIBUYOY-UHFFFAOYSA-N	445.439	1.671	50	20	IDGD	
CCOC(=O)c1c(F)cccc1NC(=O)C(=O)NNC(=O)CSc1ccccc1OC	764392987	BHLSDRIXMXBPCB-UHFFFAOYSA-N	449.460	1.889	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)N2CCC3(CC2)NC(=O)N(C)C3=O)c(C)n1C[C@@H]1CCCO1	764406809	LIFFRRNCCUBKAB-GQEMFKIVSA-N	439.516	1.734	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NN=Cc3cc(C#N)cs3)CC2)cc1	764817208	OKWWYXXPIWPNBB-UHFFFAOYSA-N	431.543	1.385	50	20	IDGD	
CCNS(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)CSc2ccccc2O)c1	765248069	OMLMRVPCBSOAQH-UHFFFAOYSA-N	427.479	1.383	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)CNC(=O)c3ccc4c(c3)OCO4)n[nH]2)c1	765582109	SIGCXJSQXZWMFI-UHFFFAOYSA-N	435.440	1.613	50	20	IDGD	
O=C(/C=C/c1ccc(Cl)cc1)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765739248	RMPGIYJEQORSKB-DHZHZOJOSA-N	426.904	1.959	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)c1cc(F)cc([N+](=O)[O-])c1	765757237	ASQRASNXDQCPAS-UHFFFAOYSA-N	449.870	1.966	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc([N+](=O)[O-])c2cccnc12)[C@@H]1COc2ccccc2O1	766354373	BGIMQSIDODFRGI-HNNXBMFYSA-N	430.398	1.293	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@H]3CCCN3C(=O)C(C)(C)C)CC2)cc1	766648897	LPJITTLPBJXEFY-HXUWFJFHSA-N	443.592	1.297	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)c1ccnc(OCC(F)(F)F)c1	767344844	OHBLAJWIGMLFMW-UHFFFAOYSA-N	425.363	1.878	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)NC1CCN([C@H]2CCCC[C@@H]2O)CC1	767946899	HQISUCYLOFZSIV-PMACEKPBSA-N	426.521	1.584	50	20	IDGD	
CCCS(=O)(=O)N1CCCC[C@@H]1C(=O)NNC(=O)c1cc(-c2cccs2)[nH]n1	768261412	SWTJNRKJHDNGPD-CQSZACIVSA-N	425.536	1.494	50	20	IDGD	
Cc1nn(CC(=O)OC(C)C)c(C)c1C=NNC(=O)c1csc(N2CCOCC2)n1	768350728	VIOSHZQHGCMBOW-UHFFFAOYSA-N	434.522	1.509	50	20	IDGD	
NS(=O)(=O)c1cccc2c(C(=O)NNC(=O)c3cc(-c4ccccc4)[nH]n3)nccc12	768469789	WMOOEOGNOSMIQD-UHFFFAOYSA-N	436.453	1.347	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)NCCc2ccon2)cc1	770101800	OPSXTBAVWCYQHY-FOWTUZBSSA-N	434.456	1.688	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N[C@H]2CCO[C@]3(CCOC3)C2)cc1Br	771444773	POLKEEOUGJGQMY-YVEFUNNKSA-N	428.283	1.740	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNS(=O)(=O)c1ccc2c(c1)OCCCO2	771605744	BLSAAFQIIZHIQF-UHFFFAOYSA-N	439.877	1.127	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)CCC[S@](=O)c1ccc(Br)cc1	772135523	HKWYXKJFDNZYED-NDHGSNPTSA-N	433.324	1.826	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2O1)C(=O)Nc1ccc2c(c1)CCC(=O)N2CC1CC1	773497606	YVJRIGNPVCSQNY-HXUWFJFHSA-N	448.479	1.465	50	20	IDGD	
CN1CCC/C1=N/S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccc(C#N)cc2)cc1	773693099	VXQLZHOUPZOFEN-BWAHOGKJSA-N	440.485	1.453	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)N[C@@H](CS(C)(=O)=O)c2ccccc2)cc1	774285122	YUEMZAFYBXGVMV-KXBFYZLASA-N	449.529	1.969	50	20	IDGD	
COc1cc(OC)cc(N2C[C@H](C(=O)NNc3cccc(S(C)(=O)=O)c3)CC2=O)c1	776534608	MEAXCMZCTWTLHS-CYBMUJFWSA-N	433.486	1.604	50	20	IDGD	
COCc1cccc(CC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1	777758920	VGOOLPINTURPQA-UHFFFAOYSA-N	431.514	1.621	50	20	IDGD	
Cc1cc(C)cc(C(=O)N2CCC[C@@H](C(=O)NNC(=O)CNC(=O)OC(C)(C)C)C2)c1	778436472	KZHOLCNKBJTPIG-MRXNPFEDSA-N	432.521	1.828	50	20	IDGD	
O=C(NNc1cc(Cl)ccn1)c1ccc2c(c1)S(=O)(=O)N(C[C@H]1CCCO1)C2=O	778446388	AEMWTYSZMQOETF-CYBMUJFWSA-N	436.877	1.815	50	20	IDGD	
Cc1cccc([C@@H](CNC(=O)NNC(=O)CNC(=O)OC(C)(C)C)N2CCOCC2)c1	778602785	PNQIULFDEKDJFV-QGZVFWFLSA-N	435.525	1.223	50	20	IDGD	
COc1ccc(Cn2ccc(NC(=O)C(=O)NNC(=O)COCc3ccccc3)n2)cc1	778713501	KIPNXBLGECWWNI-UHFFFAOYSA-N	437.456	1.243	50	20	IDGD	
CCC(CC)[C@@H]1C[C@@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)CCO1	779394147	AMXMKSITJVORKR-WMZOPIPTSA-N	440.566	1.865	50	20	IDGD	
COc1ccc(-n2cc(O)c(C(=O)NNC(=O)C(=O)NCc3ccc(Cl)cc3)n2)cc1	779546016	AIYGLBHPKSYWCG-UHFFFAOYSA-N	443.847	1.317	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2ccc(C#N)cc2Cl)cc(OC)c1OC	779830524	XFAVGFNIQTZUIF-UHFFFAOYSA-N	425.850	1.861	50	20	IDGD	
O=S(=O)(CBr)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1	782424212	YKIDJSNRWLWUAE-UHFFFAOYSA-N	444.330	1.714	50	20	IDGD	
Cc1cc(Cl)ncc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)NC(C)C)cn1	783263163	IAMWKAYKVNRRAY-UHFFFAOYSA-N	426.886	1.207	50	20	IDGD	
COc1cc(C)c(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)cc1F	783263865	MDYAWUMBKYNHNJ-UHFFFAOYSA-N	439.469	1.306	50	20	IDGD	
Cc1ccc(C)c(NNC(=O)C(=O)Nc2cnn(-c3ccccc3S(C)(=O)=O)c2)c1	783366722	PSVFMWMNPKKYPC-UHFFFAOYSA-N	427.486	1.974	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)CCS(=O)(=O)C1	783425878	JKLCKPFAYFVDFS-FQEVSTJZSA-N	428.470	1.487	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2cccc(Cl)c2Oc2cccnc2)CCS(=O)(=O)C1	783428026	VYZRJQITIQGDBX-SFHVURJKSA-N	438.893	1.664	50	20	IDGD	
COc1ccc(S(=O)(=O)C(F)(F)F)cc1NC(=O)C(=O)NNc1ccc(C)nn1	783951752	XEEFLGFAGOBKOQ-UHFFFAOYSA-N	433.368	1.169	50	20	IDGD	
NC(=O)CCOc1ccc(NC(=O)C(=O)NNc2ccc(OC(F)(F)F)cc2)cc1	784803383	BMGWCYBBBQJJSC-UHFFFAOYSA-N	426.351	1.921	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)C(=O)Nc2cc(S(C)(=O)=O)ccc2Cl)c1	784853743	OIGKKFZPEGQZSJ-UHFFFAOYSA-N	425.850	1.612	50	20	IDGD	
CN(C)C(=O)Cn1ccc(NC(=O)C(=O)NNc2c(F)cc(F)cc2Br)n1	785007571	HPXOOOFHZDSCPD-UHFFFAOYSA-N	445.224	1.094	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)C(=O)Nc3cnn(-c4ccncc4)c3)n[nH]2)c1	785127249	DPKGKCPMFOALFW-UHFFFAOYSA-N	444.455	1.674	50	20	IDGD	
COc1cc(F)cc(NNC(=O)C(=O)Nc2cccc(OCCS(C)(=O)=O)c2)c1	785245449	IJDKQQKBEQJKNY-UHFFFAOYSA-N	425.438	1.340	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)[C@H]2Cc3cc(C)c(C)cc3O2)cc1OC	786399608	NAROMFNCKNNDCS-LJQANCHMSA-N	428.441	1.629	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)NNc1ccccc1S(N)(=O)=O	788232767	YGZFWEGCCGEMGY-INIZCTEOSA-N	434.518	1.913	50	20	IDGD	
NC(=O)c1cc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)ccc1Cl	789810822	QSAGEXRKTIIIQF-BBRMVZONSA-N	430.848	1.098	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)c1n[nH]c2c1CCCCC2	789813070	FFPZVHORTZHTHC-UHFFFAOYSA-N	444.967	1.911	50	20	IDGD	
Cc1c(C(=O)N2CCN(S(=O)(=O)CBr)CC2)nnn1CC1CCCC1	790014338	VKQYYLVNNCFIJM-UHFFFAOYSA-N	434.360	1.217	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc([N+](=O)[O-])c1C	790113248	LXFJBWDOXBAWLN-UHFFFAOYSA-N	436.446	1.237	50	20	IDGD	
O=C(NNc1nc2ccccn2n1)NC1CCN(S(=O)(=O)Cc2ccccc2)CC1	790372707	OJJXQYMXOLEJSP-UHFFFAOYSA-N	429.506	1.350	50	20	IDGD	
Cc1ccc(CN2CC[C@H](NC(=O)NNC(=O)c3nnc(O)c4ccccc34)C2=O)cc1	790693364	BHQMHRWXRBUKFP-KRWDZBQOSA-N	434.456	1.389	50	20	IDGD	
Cc1cccc([C@@H](CC(=O)NNC(=O)CNC(=O)OCc2ccccc2)NC(N)=O)c1	794062082	SSEJJIKDRKOWFO-QGZVFWFLSA-N	427.461	1.168	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)Cc2c(C)nc(-c3ncccn3)nc2O)c2ccccc2n1	799009044	IIEWTCJTRHISTB-UHFFFAOYSA-N	429.440	1.808	50	20	IDGD	
COc1ccc(S(C)(=O)=O)cc1S(=O)(=O)NNC(=O)c1cccc2ncccc12	802722087	PYGMXVAKBZDOMG-UHFFFAOYSA-N	435.483	1.270	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@H](C)CNC(=O)OC(C)(C)C)CC2)cc1	802762378	DNWWBRIJYIJEJZ-GOSISDBHSA-N	447.580	1.421	50	20	IDGD	
Cc1cc([N+](=O)[O-])ccc1NNC(=O)[C@@H]1CCCC[C@@H]1C(=O)N[C@H]1CCS(=O)(=O)C1	805386000	CXQTZOCOBOXQJY-CWRNSKLLSA-N	438.506	1.456	50	20	IDGD	
CC(C)(C)c1ncc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cn1	806306212	JJCONRUTQJKMDL-UHFFFAOYSA-N	431.518	1.633	50	20	IDGD	
COCCOc1ccc(S(C)(=O)=O)cc1NC(=O)NNC(=O)c1ccccc1F	806735902	FUEUFTXOHHKMKP-UHFFFAOYSA-N	425.438	1.721	50	20	IDGD	
CCN(C)C(=O)c1cccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)c1	806974902	HVQQDGHNLFRQEV-INIZCTEOSA-N	440.500	1.949	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1nc(C2CCOCC2)cs1	806975275	SIZNIPGDEMLCNI-LLVKDONJSA-N	436.465	1.730	50	20	IDGD	
Cn1ncc(NC(=O)C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)c1-c1ccccc1	806975808	PKYVJQTWCGWUTQ-UHFFFAOYSA-N	445.439	1.378	50	20	IDGD	
COC(=O)c1c(C)csc1NC(=O)C(=O)NNC(=O)c1cnn(-c2ccccc2)c1	806980114	OYFRMHKSJOXKTC-UHFFFAOYSA-N	427.442	1.429	50	20	IDGD	
CC(C)Oc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)C(=O)NNc1cccc(F)n1	807392191	IUZGRIZCBLQILY-UHFFFAOYSA-N	439.469	1.340	50	20	IDGD	
Cc1cc(Br)c(F)cc1NC(=O)C(=O)NNc1ccc(-n2ccnc2)nn1	807429027	OBXSNWAHWTYZHD-UHFFFAOYSA-N	434.229	1.954	50	20	IDGD	
CCOc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NNc1nccnc1C1CCC1	807462292	SQNJPQFDMIDJQE-UHFFFAOYSA-N	426.477	1.926	50	20	IDGD	
CC(C)S(=O)(=O)CCNC(=O)NNC(=O)c1ccc(Br)cc1Cl	808264665	KFZDHCGEPUQIGZ-UHFFFAOYSA-N	426.720	1.870	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)n1	809984773	YXOJEGKXOMSLAS-UHFFFAOYSA-N	427.467	1.890	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)CNS(=O)(=O)c1ccc(OC)c(OC)c1)c1ccccc1	810379151	QMSUXEKRWFVZDV-INIZCTEOSA-N	435.502	1.323	50	20	IDGD	
O=C1CN(Cc2cccc(NC(=O)C(=O)NNc3ccc(C(F)(F)F)cc3)c2)CCN1	812982342	SQXVQUPCQWOYJA-UHFFFAOYSA-N	435.406	1.719	50	20	IDGD	
Cc1nnsc1CNC(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	813849573	MEGMDURQECXWLP-UHFFFAOYSA-N	449.496	1.749	50	20	IDGD	
CC[C@H](C)C(=O)NNC(=O)C(=O)Nc1nnn(Cc2ccc(C(F)(F)F)cc2)c1C	815567674	HGVPMQZWROFHTG-JTQLQIEISA-N	426.399	1.786	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cc(C)c4nccn4c3)n[nH]2)cc1	815570092	QUEDWMFOTGWMJY-UHFFFAOYSA-N	431.456	1.995	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)c2cnn(-c3ccccn3)c2N)CC1	815634962	UQGAHQGBEKKBPT-UHFFFAOYSA-N	444.496	1.193	50	20	IDGD	
Cc1nc(-c2ccc(NC(=O)C(=O)NNC(=O)[C@H]3CCc4nncn4C3)cc2)cs1	815691594	VGVHPZUDSJZNHG-ZDUSSCGKSA-N	425.474	1.059	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C1CCN(C2CCN(CC)CC2)CC1	816810274	GEEHIQSLJYDJKA-UHFFFAOYSA-N	432.565	1.808	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1ccc(C(=O)NNC(=O)c2ccncc2)cc1	912769402	MLXJBKQIQJLDFT-UHFFFAOYSA-N	426.454	1.966	50	20	IDGD	
O=C(Cc1csc(Cc2cccc(Cl)c2)n1)NNC(=O)[C@@H]1CCS(=O)(=O)C1	915142220	ZYRPNZLBCWBZLM-GFCCVEGCSA-N	427.935	1.512	50	20	IDGD	
Cc1nnnn1[C@H](Cc1cccc(F)c1)C(=O)NNC(=O)c1ccc2c(c1)OCCO2	915695950	CVUJELSYUDZWDK-MRXNPFEDSA-N	426.408	1.137	50	20	IDGD	
CN1CCN(C(=O)c2ccc(CNC(=O)NNC(=O)Cc3c[nH]c4ccccc34)cc2)CC1	916391061	ZZPPNSGZUXKSDV-UHFFFAOYSA-N	448.527	1.629	50	20	IDGD	
C[C@@H](Cc1ccc(Br)cc1)NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	916645366	ANUCHEOHCKQABA-LBPRGKRZSA-N	444.293	2.000	50	20	IDGD	
O=C(NNC(=O)c1c[nH]n2c1nc(=O)c1ccccc12)c1nn(-c2ccccc2)cc1O	919743408	FTQRZUQDIHMDDM-UHFFFAOYSA-N	429.396	1.142	50	20	IDGD	
Cc1nccn1-c1ncccc1CNC(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	919779608	OFJDAASISVZIJJ-UHFFFAOYSA-N	432.444	1.611	50	20	IDGD	
O=C(Nc1ccccc1)Nc1ccc(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)cc1	919883177	BKAGORIWFXJHDT-MRXNPFEDSA-N	431.474	1.462	50	20	IDGD	
Nc1nc(Cl)c(C=NNC(=O)c2nnc(-c3ccccc3)o2)c(N2CCOCC2)n1	920385796	YTKBRCFKPKVWOF-UHFFFAOYSA-N	428.840	1.363	50	20	IDGD	
O=C(C[C@@H](NC(=O)c1ccccc1Cl)c1ccccc1)NNC(=O)CN1CCCC1=O	920825469	BDGCNIFUCRGVRD-GOSISDBHSA-N	442.903	1.971	50	20	IDGD	
O=C(NCCc1cccs1)NN=Cc1c(N2CCOCC2)nc2ccccn2c1=O	920830601	JBCCHJCUMCGMFK-UHFFFAOYSA-N	426.502	1.468	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2cnc(-c3ccccc3)nc2)c1	920931431	PZHNWDLHICMEOH-UHFFFAOYSA-N	440.485	1.860	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)NCc2cccnc2N2CCN(C)CC2)c1	921248417	YQUZIGINMGFMGB-UHFFFAOYSA-N	426.521	1.360	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)c1n[nH]cc1I	1116643714	GYDYACNEGCLUDS-UHFFFAOYSA-N	430.202	1.253	50	20	IDGD	
O=C(NNc1ccc(C(F)(F)F)nn1)c1ccc(F)c(S(=O)(=O)Cc2ncon2)c1	1253632610	HOJPBIUXFDWZCZ-UHFFFAOYSA-N	446.342	1.748	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)C(F)(F)c2ccccc2C)cc1	1319599361	YDRPDQFGMVMSSL-UHFFFAOYSA-N	425.457	1.863	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2ccc(C(C)(C)C)nn2)cc1	1320260078	RMYPKUFXGKHNIP-UHFFFAOYSA-N	434.522	1.556	50	20	IDGD	
Cc1c(C(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)cnn1-c1ccncc1	1320547550	NHWCRMIWVXZNDB-UHFFFAOYSA-N	443.508	1.825	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)c1cn(-c2ccc(Br)cc2)nn1	1323331199	UKIBBLCYZYRPOH-UHFFFAOYSA-N	426.238	1.762	50	20	IDGD	
COc1c(C(=O)OCC(=O)NNC(=O)Cc2nc(C)cs2)cnn1-c1ccccc1	1324063628	CXJTVKIXRDRANB-UHFFFAOYSA-N	429.458	1.193	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cncc(OCC(F)F)c2)cc1	1324129304	SULPXHAHTDIYOF-UHFFFAOYSA-N	442.444	1.116	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4ncnn4c3)C2)C1	1778744334	XZQYNMAEYMXMCM-KDOFPFPSSA-N	436.310	1.346	50	20	IDGD	
Cn1cc(C(=O)N2CC[C@]3(CN(C(=O)CCBr)CCO3)C2)c2cccnc21	1778767163	HGNIVBOWLDLVGA-IBGZPJMESA-N	435.322	1.802	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccnc4c3OCO4)C2)C1	1780030138	SOBIWHWSIBIRAZ-DIFFPNOSSA-N	426.267	1.037	50	20	IDGD	
COc1cccc(OC)c1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1780541620	ANJJNKRHAUGMIJ-QAPCUYQASA-N	445.285	1.838	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc3c(n1)OCCO3)C2	1780702791	SGVUWBWTJMNCKG-SOIKWTOOSA-N	437.924	1.998	50	20	IDGD	
O=C(CSc1ncccn1)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781332114	ZVNDWRVUJRISRH-DOMZBBRYSA-N	433.303	1.089	50	20	IDGD	
O=C(/C=C/c1cnc[nH]1)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCBr)C2	1782428572	XBVXMLLHECVRFK-YPXCQQABSA-N	425.327	1.722	50	20	IDGD	
C[C@H](NC(=O)c1ccccn1)C(=O)N1CC[C@@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1782667218	RRAJKJKDQRJSTL-YCRPNKLZSA-N	436.940	1.295	50	20	IDGD	
Cc1ccccc1CCC(=O)N1CCO[C@@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1	1783937915	YLTZWRDTBWOHSF-HSZRJFAPSA-N	430.549	1.131	50	20	IDGD	
CCC[C@H]1CC[C@H](C(=O)N2CCO[C@@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)CC1	1783937924	YPBZYYXCQVMSGO-DNVFCKCGSA-N	436.597	1.796	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(C(F)(F)F)n3)C[C@@H]21)[C@H](O)CCl	1784091035	HHFRNUXYHBSMCQ-VTPLQMEGSA-N	435.830	1.293	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)Cc3ccc(O)cn3)C2)C1	1784644575	LENNTVZKLIUCGF-MAUKXSAKSA-N	426.311	1.333	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3ccc(OC)nc3)[C@H]2C1	1785097676	WLIGLTBTNNKPAB-FJIDUMEYSA-N	439.940	1.256	50	20	IDGD	
COC(=O)c1ccc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]3C2)s1	1787449323	PFOPDWGQDQXXDX-SDPXSBNPSA-N	432.901	1.591	50	20	IDGD	
Cc1nc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](O)CCl)C[C@@H]32)c(C(F)(F)F)o1	1787481087	VXJKXIUPRPIUDJ-BJDJZHNGSA-N	439.818	1.195	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(Cl)nn3)[C@H]2C1	1788837753	BIQKBQXYVDUBPR-ZPFDUUQYSA-N	431.718	1.507	50	20	IDGD	
Cc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)Br)C[C@@H]32)c(O)n1	1789311479	CWBYVBLHVFXIHJ-DHMWGJHJSA-N	426.311	1.472	50	20	IDGD	
COc1ccc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)C(Cl)Cl)C[C@@H]32)c(C#N)c1	1789843285	DFMPEXLUPBAABP-JQFCIGGWSA-N	440.327	1.893	50	20	IDGD	
COc1cc(C(=O)Nc2ccc(C3(NC(=O)c4ccc(B(O)O)cc4)CCC3)cc2)nn1C	1790193764	UWNHGZOGQZKPGB-UHFFFAOYSA-N	448.288	1.170	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Cl)C[C@@H]21)c1nc2cc([N+](=O)[O-])ccc2[nH]1	1790319946	INAQRMHSIRFWHO-LHAJWOIZSA-N	439.831	1.599	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4ccsc4[nH]3)C[C@@H]21	1791293914	NZQRAANGHHQJMV-ZOBUZTSGSA-N	447.561	1.196	50	20	IDGD	
C[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]2C1)[S@](=O)c1ccccc1	1791295876	JXJQTICQPJNATN-NPFDEDBGSA-N	447.384	1.966	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)COc1ccc(O)cc1	1792778745	YBGLKAYQZRYCRA-ZDFLXESQSA-N	441.322	1.534	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/c1cc(F)c(F)c(F)c1)C2)[C@@H](O)CCl	1792982998	XSACICNYSCCNLM-HWWWCQEQSA-N	432.826	1.306	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(Cl)c(Cl)cc1F)C2)[C@@H](O)CCl	1792983553	OSODNADZPSSUDX-QTGCHDBNSA-N	439.698	1.935	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@](F)(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](O)CCl)C1	1793111834	YCTUMGOUFGHRNG-UPYQZRRNSA-N	447.935	1.573	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cncn1-c1ccncc1)C2	1793445972	YHYVRUSTOZPXDA-LORHWOILSA-N	431.924	1.878	50	20	IDGD	
COc1ccc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@](C)(Cl)CCl)C3)cn1	1793894135	ZKEPLFAPNRBJTG-ZDUSMZPESA-N	444.359	1.849	50	20	IDGD	
CC(C)c1nc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)CBr)C3)no1	1793995988	DDCKDDXCZDOKOV-JFILPPLUSA-N	443.342	1.356	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H]1CCCO1)C2	1794142789	QSEMVGGUJJRGQF-XFIYOXNOSA-N	429.945	1.936	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1snnc1C1CC1	1796706888	WCIAODADYVKBDO-UZTWBRENSA-N	433.361	1.855	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(O)cc1F)C2	1796892845	ZUOREZKYTDFDJO-SSJPOKSSSA-N	441.463	1.917	50	20	IDGD	
CN1CCc2cc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)c3cnccc3C(=O)NN)C4)ccc21	1797545920	IPBTUJMOKIVCNT-BCDXTJNWSA-N	448.527	1.243	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C[C@@H]1CNc2ccccc2O1	1797677622	JLWKRZQREMAMGF-HWEQFAERSA-N	437.924	1.093	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](O)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CO[Si](C)(C)C	1798628375	YPPLWAKUIYVQCQ-LOUJCGABSA-N	429.590	1.319	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c(c1)SCC(=O)N3)C2	1799269708	KJCZQCQRTQQDMO-KYZVSKTDSA-N	437.949	1.951	50	20	IDGD	
COc1nccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@](C)(Cl)CCl)c1F	1799274629	BADKNXJJDUOMTI-MSNRECKUSA-N	434.295	1.669	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cn3ccccc3n1)C2)[C@@H](F)Br	1799347780	SFALOFRKVSGVAF-BAESOJJISA-N	425.258	1.228	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(C(F)(F)F)[nH]1)C2)[C@H](F)Br	1799349832	LPVZFGXKFBZLQI-VVJJBPBLSA-N	442.207	1.927	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(Cl)nc(OC)c1)C2	1800978319	AITKBNXUVSMFCY-ZWUHOBOKSA-N	432.304	1.201	50	20	IDGD	
Cc1ccc2[nH]c(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)CCC(=O)NN(C)C)cc2c1	1801011617	VYCSQWWPMPYNQN-FAQVEIGNSA-N	441.532	1.053	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1c(Cl)cccc1OC	1801802974	OXLUTMCZARFQRT-IFOZYUSPSA-N	431.316	1.806	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cccn3cncc23)[C@@H]1c1cccnc1)[C@H](O)CCl	1803142683	GYGBYHLTQKJTFI-KFKAGJAMSA-N	427.892	1.649	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1	1803146952	FHJJHXZAQIHHFX-VYDXJSESSA-N	440.928	1.212	50	20	IDGD	
COc1cc(Cl)cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CCC(=O)NN(C)C)C3)c1	1803770513	UWAJSNBJDQNMCA-BJWYYQGGSA-N	436.940	1.973	50	20	IDGD	
COc1nccnc1C(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)Br)[C@H]1c1cccnc1	1804983279	YWNYSAVXZKCSKR-INWMFGNUSA-N	448.321	1.983	50	20	IDGD	
O=C(CCBr)NC[C@@H]1CCN(C(=O)CCn2ccnn2)[C@H]1c1cccnc1	1806346237	CRMPPPLDFSUIHQ-YJBOKZPZSA-N	435.326	1.554	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H](CNC(=O)[C@H](C)NC=O)[C@H]1c1cccnc1	1808381720	DOCDCAZDPACURR-DRPJVOAASA-N	425.327	1.395	50	20	IDGD	
Cc1ccncc1C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1808784671	NHLVKSBKEAQKEJ-KNQAVFIVSA-N	444.300	1.098	50	20	IDGD	
CC(F)(F)C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1	1810303986	YTBCWOICDHGPEE-CJNGLKHVSA-N	432.431	1.055	50	20	IDGD	
Cc1ccc(CC(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)o1	1813509463	KOXTVCZACMMGRU-CVDCTZTESA-N	447.300	1.225	50	20	IDGD	
O=C(CN1CCOCC1)Nc1nc2c(s1)C[C@H](NC(=O)CCBr)CC2	1814561607	QLJIRYQHJSOBKT-LLVKDONJSA-N	431.356	1.172	50	20	IDGD	
Cc1ccc(=O)n(C(C)(C)C(=O)N[C@@H]2CCc3nc(NC(=O)[C@H](F)Cl)sc3C2)n1	1817125364	MIXCTZNAZBFQOA-YGRLFVJLSA-N	441.916	1.890	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CN2CCN(C)CC2)n[nH]1	1818915217	PDBHYFFQALPHJV-HIFRSBDPSA-N	441.374	1.433	50	20	IDGD	
Cc1cc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cnccc4C(=O)NN)sc3C2)c[nH]1	1819796994	LAMMABLEVYVBCZ-GFCCVEGCSA-N	439.501	1.318	50	20	IDGD	
CN1CCN(CC(=O)N[C@@H]2CCc3nc(NC(=O)CO[Si](C)(C)C)sc3C2)CC1	1820166041	ZGEIMHCIMOCTIR-CQSZACIVSA-N	439.658	1.154	50	20	IDGD	
Cc1n[nH]cc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1820270798	QGIPBDWKCXYHEJ-INIZCTEOSA-N	437.464	1.059	50	20	IDGD	
CC(C)=NO[C@@H](C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1820968893	HXIBTQXSGDPUSD-KBXCAEBGSA-N	441.297	1.196	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)CCN2CCCCC2)[nH]n1	1822412683	DXLMKLAHXBSYTD-GOSISDBHSA-N	447.584	1.651	50	20	IDGD	
CC(C)N[C@@H](C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1)C(C)C	1822413941	IYMIHPXWLMBWLJ-LAUBAEHRSA-N	449.600	1.797	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)[C@@H]1CCCS1	1823010398	YQBVAMKPWQLLDF-SJORKVTESA-N	428.323	1.291	50	20	IDGD	
Cc1cn(CC(=O)Nc2cc([C@@H]3CCCCN3C(=O)[C@H](F)Cl)[nH]n2)c(=O)nc1O	1823366817	DIENOWYPMMDAKV-FZMZJTMJSA-N	426.836	1.207	50	20	IDGD	
O=C(Cn1nnc2ccccc21)N1CCC([C@@H]2CCCCN2C(=O)[C@H](O)CCl)CC1	1824177846	ADEJCRPUTYAPEB-PKOBYXMFSA-N	433.940	1.651	50	20	IDGD	
Cc1ocnc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827052514	MIFBGNDXMGOYTP-IBGZPJMESA-N	425.294	1.210	50	20	IDGD	
O=C(C1CCSCC1)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827054506	GOZZVTCUYRDAMI-OAQYLSRUSA-N	444.406	1.743	50	20	IDGD	
Cc1ccc(CC(=O)N2CCC([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)cn1	1827056564	YMDSHICPXCWHOE-HSZRJFAPSA-N	449.360	1.546	50	20	IDGD	
Cc1cnc2c(C(=O)N3CCCC[C@H]3C3CCN(C(=O)[C@@H](O)CCl)CC3)cnn2c1	1828594014	GRLPIYAVIPNKNP-ROUUACIJSA-N	433.940	1.871	50	20	IDGD	
Cc1nnc(CCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)s1	1830358011	KKPKRPMNUNLYIZ-LJQANCHMSA-N	444.985	1.501	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3sccc3F)C2)C1	1830535286	LQWOILOEYXOOSV-SJKOYZFVSA-N	449.342	1.988	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(F)nc3F)C2)C1	1831640017	WUEUXCQFIBFGHY-LIRRHRJNSA-N	431.867	1.837	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CSc3ncccn3)C2)C1	1831646546	MMULEGYTPIKEMR-BEFAXECRSA-N	442.969	1.433	50	20	IDGD	
Cc1nscc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)CBr)C2)C1	1833740507	NVBUBIHUIUUQHA-YVEFUNNKSA-N	446.367	1.553	50	20	IDGD	
Cc1nc(CC(=O)NC2CCN(C3CCN(C(=O)CCBr)CC3)CC2)no1	1833809334	YOBNFIIUJNGWAL-UHFFFAOYSA-N	442.358	1.277	50	20	IDGD	
C[C@@H](Cn1cccn1)C(=O)NC1CCN(C2CCN(C(=O)C(Cl)Cl)CC2)CC1	1833889019	GOAPATMEOZSKCM-AWEZNQCLSA-N	430.380	1.895	50	20	IDGD	
CCn1nc(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](Cl)COC)CC3)CC2)cc1C	1835992244	QBJKSXDAJZVSOH-SFHVURJKSA-N	439.988	1.650	50	20	IDGD	
CC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)CN3CCCCC3=O)CC2)CC1	1836397312	DCEAZGPEEYVEBB-SFHVURJKSA-N	426.989	1.588	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)[C@@H]3CCC(=O)N3)CC2)CC1	1837738299	FCESKGHSTJGTKT-DOMZBBRYSA-N	430.343	1.047	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccnc(C)c3)CCO2)C1	1837941483	LHTMDONIMDGAMM-LPHOPBHVSA-N	440.338	1.634	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(F)c3F)CCO2)C1	1839000100	STNWISUVUODVFM-KUHUBIRLSA-N	432.851	1.289	50	20	IDGD	
CCCOc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)cc1	1839011071	JMGCQYYSQFVSEC-GHTZIAJQSA-N	440.924	1.145	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(CC(C)C)nn3C)C2)C1	1839144334	VOGRMGPONMBGHA-UTKZUKDTSA-N	440.972	1.706	50	20	IDGD	
CCn1nc(C)cc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2	1839152165	PSAIGWBNHLSWBS-OALUTQOASA-N	447.363	1.518	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3CCCS3)C2)C1	1839156227	IEDTVNDNBZQHIP-RRQGHBQHSA-N	425.378	1.575	50	20	IDGD	
O=C(COc1ccccc1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839199250	LACGIQLFGNSANR-WMZOPIPTSA-N	445.285	1.212	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc([N+](=O)[O-])cc3F)CCO2)C1	1839278453	ONNYJJYSYHTUOQ-KXBFYZLASA-N	443.859	1.821	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3(F)CCCCC3)C2)C1	1840033495	HSPMZLDXBOFLKA-PBHICJAKSA-N	435.334	1.899	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)ccc1O	1840035560	VUZWCMVAVDMLOJ-IFXJQAMLSA-N	441.322	1.554	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3ccc(F)cc3)CCO2)C1	1840056236	UDMXPTAQCYTLRM-GHTZIAJQSA-N	442.915	1.469	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCOc3ccccc3)C2)C1	1840151064	VQDIWQNJNGIOGE-GHTZIAJQSA-N	440.924	1.166	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4ccccc4o3)C2)C1	1840152696	PWUMMYBWTUMVRZ-KKSFZXQISA-N	436.892	1.757	50	20	IDGD	
CCOc1cccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)c1O	1840189500	VKGLCUDWGNDRDH-LJQANCHMSA-N	447.315	1.665	50	20	IDGD	
Cc1cc(C)n(CCC(=O)N2CCOC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)n1	1840190643	FVYFKPFPCDRVRV-SFHVURJKSA-N	433.336	1.150	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)c1cccs1)CCO2	1840378138	IEWZMEMMJVDHKU-ZRGWGRIASA-N	430.954	1.562	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)[C@H](O)C(C)(C)C)C1	1841315362	JVQHHSMVWISKHS-KRWDZBQOSA-N	433.461	1.744	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)c2cc3cc(F)c(F)cc3[nH]2)C1	1844010987	KHDSSXAQKFCMDB-UHFFFAOYSA-N	439.227	1.257	50	20	IDGD	
CN(CC(=O)N1CCCC12CN(C(=O)[C@@H]1CC1(F)F)C2)NC(=O)NCc1ccccc1	1845038875	CFNOTLVONFBRNS-INIZCTEOSA-N	435.475	1.191	50	20	IDGD	
O=C([C@H](O)CCl)N1CC2(CCCN2C(=O)[C@@H](Br)Cc2ccccc2)C1	1845940179	BFHSLLWVTDLEJB-LSDHHAIUSA-N	429.742	1.796	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@H]1COCCN1C(=O)OC(C)(C)C)C2	1846360230	BGUHGRALANBGHW-HUUCEWRRSA-N	445.944	1.080	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CC1(O)CCC1	1848098864	HTZOFIYAZNXXQJ-KKUMJFAQSA-N	429.945	1.625	50	20	IDGD	
CCn1c(NNC(=O)[C@H](C)NS(=O)(=O)c2ccc(C)cc2)nc2ccccc2c1=O	11164487	VOOIQRFGUPHBID-AWEZNQCLSA-N	429.502	1.535	50	20	IDGD	
CCn1c(NNC(=O)c2ccc(S(=O)(=O)NCCOC)cc2)nc2ccccc2c1=O	11165864	LNZFFSCMVUWKLJ-UHFFFAOYSA-N	445.501	1.098	50	20	IDGD	
O=C(Cn1cnc2c(oc3ccccc32)c1=O)NNC(=O)c1cc(-c2ccccc2)n[nH]1	15664990	RNTSGEJOKVQJHK-UHFFFAOYSA-N	428.408	1.994	50	20	IDGD	
CC(C)N(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)Cc2nc3ccccc3n2C)cc1	26539710	WQKUGVFSRYCFCF-UHFFFAOYSA-N	443.529	1.606	50	20	IDGD	
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)NNC(=O)c1ccc(Cl)cc1	27770465	OXUZAEKQASKZJI-INIZCTEOSA-N	432.864	1.662	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CSc1nnnn1-c1ccc(O)cc1	28856375	IIQBDNYVNLBGEY-UHFFFAOYSA-N	434.865	1.583	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)Nc2ccc(S(N)(=O)=O)cc2)cc1OC	29314531	QWRDTJNPRAGFRM-UHFFFAOYSA-N	436.490	1.988	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)c2ccc(S(=O)(=O)N(C)C(C)C)cc2)cc1	105457594	KUYNXADEDAMWCS-UHFFFAOYSA-N	434.518	1.597	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(CNC(=O)NNC(=O)CNC(=O)c2cccs2)CC1	725873256	MFKROOHKFDZIMD-UHFFFAOYSA-N	439.538	1.455	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)NCC(=O)N2CCc3ccccc3C2)cc1	726714147	DLSDKSBGXPLPID-INIZCTEOSA-N	440.500	1.768	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNS(=O)(=O)c2cc3c(cc2Cl)NC(=O)C3)cc1C	728014864	HZQWWBGZGQXVQU-UHFFFAOYSA-N	436.877	1.400	50	20	IDGD	
CC[C@H](NC(=O)NNC(=O)Cc1nc2ccccc2n1C)c1cccc(S(N)(=O)=O)c1	729613103	NPYMARIFOUSSTB-HNNXBMFYSA-N	444.517	1.245	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)[C@@H]2CCCN(S(=O)(=O)Cc3ccccc3)C2)c1	730447367	LRKYHPHKWNRKDO-LJQANCHMSA-N	444.557	1.756	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCc2ccc(F)c(COC)c2)c2ccccc2c1=O	730907162	XRQXCFWTKKOPCB-UHFFFAOYSA-N	427.436	1.846	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1CNC(=O)NNC(=O)Cc1ccccc1F	731361827	YVCITEFOVASJKP-UHFFFAOYSA-N	436.509	1.976	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)N[C@@H](C)C(=O)N2CCS(=O)(=O)CC2)c(C)n1CCC(C)C	731477579	XVBHJGOWWVBZQB-IZQLPPHKSA-N	448.589	1.820	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)NCc1ccc(S(=O)(=O)NCCOC)cc1)c1ccccc1	732239736	VXWFPGCITMZZKP-LJQANCHMSA-N	448.545	1.636	50	20	IDGD	
C[C@@H](Oc1ccccc1Br)C(=O)NNC(=O)CNC(=O)c1cccs1	732735721	JNTRUKWXUZZUCI-SNVBAGLBSA-N	426.292	1.855	50	20	IDGD	
CCc1cc(N2CCC[C@@H](NC(=O)NNC(=O)COc3ccccc3CC)C2)ncn1	732914099	JVIWHYNQRHGYRL-GOSISDBHSA-N	426.521	1.980	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)c1ccc(S(=O)(=O)NC2CC2)cc1	733107229	WSCKCZJQAOIYOP-UHFFFAOYSA-N	425.470	1.388	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCC2(N(C)C)CCOCC2)cc1Br	733850099	CDHFGCIEDVGMRU-UHFFFAOYSA-N	429.315	1.513	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)C[C@H]2Oc3ccccc3NC2=O)CC1	734825522	IWQNLLVSVWRKJE-MRXNPFEDSA-N	447.492	1.506	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NCC3Cc4ccccc4C3)nc2)CC1	735387365	VBYPBUUBDBGPGQ-UHFFFAOYSA-N	444.561	1.059	50	20	IDGD	
Cc1ccc(N(C)S(=O)(=O)c2cccc(C(=O)NNC(=O)c3cnn(C)c3)c2)cc1	735445108	HZFLOYSZQLFOET-UHFFFAOYSA-N	427.486	1.628	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)[C@H]2CC[C@H](C(F)(F)F)NC2=O)cc1C	736775041	ITEWKWOIXBGNNT-JOYOIKCWSA-N	435.424	1.380	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C[C@H]1CN(Cc2ccccc2)CCO1	740699551	VGVPWTAAQSMLDH-IBGZPJMESA-N	427.501	1.903	50	20	IDGD	
CC(C)c1nn(C)c(Cl)c1C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	741659667	HRIRVIZUBNSUNZ-UHFFFAOYSA-N	427.914	1.522	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)[C@H](C)NC(=O)c2cc3c(C)nn(C)c3s2)c(C)c1	743295896	SHVFPSAIAFSZHT-AWEZNQCLSA-N	442.545	1.938	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)NNC(=O)c1cccc2ccccc12	743509869	MIKXYIDVQFGCHI-UHFFFAOYSA-N	440.485	1.422	50	20	IDGD	
COc1cc(C(=O)NNC(=O)N[C@@H]2CCN(Cc3ccccc3)C2=O)cc(OC)c1OC	744877915	KWDJDMWTXASJJK-MRXNPFEDSA-N	442.472	1.458	50	20	IDGD	
CCc1ccc([C@H](COC)NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)o1	745847163	MMPOSLRKECLURR-INIZCTEOSA-N	438.506	1.424	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1)[C@@H]1CCOC1	745861045	HXFJAZCNCCVHAL-MAUKXSAKSA-N	446.529	1.534	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@H](C)CCc2cccn2C)cc1	745874876	GNYVVODKLVCPKB-MRXNPFEDSA-N	435.550	1.306	50	20	IDGD	
O=C(NCC1CC1)NNC(=O)[C@@H]1CCCN1C(=O)NCc1cccc(Br)c1	746167156	PIFASAFJEXBXKV-HNNXBMFYSA-N	438.326	1.864	50	20	IDGD	
COc1ccc(NNC(=O)c2ccc3c(c2)S(=O)(=O)N(C[C@H]2CCCO2)C3=O)cc1	746883036	KTZVTZVJARFLEC-MRXNPFEDSA-N	431.470	1.776	50	20	IDGD	
N#C/C(=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)NCC1(CO)COC1	747525834	JLGBRESLRDPPGQ-CHHVJCJISA-N	443.891	1.111	50	20	IDGD	
CN(C)c1nc(CNC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cs1	747589101	LMCCTWDLPUKBDV-UHFFFAOYSA-N	431.566	1.252	50	20	IDGD	
O=C(CN1C(=O)c2ccccc2S1(=O)=O)NNc1ccc(F)cc1Br	748075445	YMJFPWOIYLHRJX-UHFFFAOYSA-N	428.239	1.876	50	20	IDGD	
O=C(NNc1ccc(F)cc1Br)c1ccc(S(=O)(=O)N2CCOCC2)o1	748077157	HVEQLRUSAQPGAW-UHFFFAOYSA-N	448.270	1.959	50	20	IDGD	
Cc1ccc(CCC(=O)NCC(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)cc1	749160229	GUJSSCCYKJEHQL-UHFFFAOYSA-N	449.511	1.796	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)NNC(=O)[C@H]1CCCN1S(=O)(=O)c1cccs1	749162072	VWOPLGTUUAJNJB-MRXNPFEDSA-N	432.527	1.773	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc2c(c1)OCCCO2)NNC(=O)c1cc2ccccc2o1	749544818	LQZLYFUNBPIUHD-UHFFFAOYSA-N	445.453	1.334	50	20	IDGD	
Cc1cccc2c(=O)n(CC(=O)NNc3nc(Br)cn4ccnc34)cnc12	750246741	GUSABDJKVLXMFD-UHFFFAOYSA-N	428.250	1.653	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2ccc3[nH]c(=O)ccc3c2)ccc1OC(C)C	751143195	WYGQQTFNSHTACZ-UHFFFAOYSA-N	431.470	1.947	50	20	IDGD	
Nc1nc(Cl)cc(NNC(=O)CCc2nc(O)c3cnn(-c4ccccc4)c3n2)n1	753456901	GQWJSZKEULHRIA-UHFFFAOYSA-N	425.840	1.623	50	20	IDGD	
O=C(NCCS(=O)(=O)NC[C@@H]1CCCCO1)NNc1cc(C(F)(F)F)ccc1F	754644092	HZTVUBZWUSYXKY-LBPRGKRZSA-N	442.435	1.959	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc(OC)c1	755375232	SBCIIYLGHMNAQV-UHFFFAOYSA-N	436.490	1.486	50	20	IDGD	
COCC(=O)NNC(=O)Nc1ccc(NC(=O)c2cccc(S(C)(=O)=O)c2)c(C)c1	755623407	OQIPNMCQEDFFNE-UHFFFAOYSA-N	434.474	1.450	50	20	IDGD	
Cn1ccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)n1	756292506	BRFDYONCZIPHKI-UHFFFAOYSA-N	428.474	1.365	50	20	IDGD	
O=C(Cc1ccc(NC(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)cc1)Nc1ccccc1F	756339761	HPFCBNGUKRSKBK-AWEZNQCLSA-N	448.476	1.594	50	20	IDGD	
CCn1cc(C(=O)C(=O)NNC(=O)c2nc(-c3ccccc3)n(-c3ccccc3)n2)cn1	758088325	DUGUHOCJWKIXOP-UHFFFAOYSA-N	429.440	1.795	50	20	IDGD	
CCn1cc(C(=O)C(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)cn1	758151218	URDUMKMTABQFOH-UHFFFAOYSA-N	447.498	1.409	50	20	IDGD	
Cc1cc(Br)cn2cc(CCNC(=O)NN[C@]3(C)CCS(=O)(=O)C3)nc12	758694098	BRRCGZKXCSWXRJ-MRXNPFEDSA-N	444.355	1.329	50	20	IDGD	
O=C(CCCCC/N=C1/NS(=O)(=O)c2ccccc21)NNc1ncccc1[N+](=O)[O-]	759298001	SXNCUMSAOJKKLQ-UHFFFAOYSA-N	432.462	1.732	50	20	IDGD	
O=C(NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)N[C@H]1Cc2cccc(O)c2C1	759461411	GXFQWHWAPUZPID-INIZCTEOSA-N	444.513	1.288	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)c2ccc(S(=O)(=O)NC[C@@H]3CCCO3)cc2)nc1	759734713	OPVYPNIQRYXHQO-HNNXBMFYSA-N	434.474	1.082	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)C[C@@H]1CN(C(=O)OC(C)(C)C)CCO1	760437065	BEHHSHQGARFDPU-CYBMUJFWSA-N	430.502	1.075	50	20	IDGD	
NS(=O)(=O)c1ccc(C(=O)NNC(=O)c2ccccc2OCc2ccc(F)cc2)cn1	762736169	FRBVQUYZIUZDOC-UHFFFAOYSA-N	444.444	1.522	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCC2CN(C(=O)OC(C)(C)C)C2)nc1	763056932	QWLBIYQBVHZLNA-UHFFFAOYSA-N	442.542	1.261	50	20	IDGD	
COc1ccc(NC(=O)c2cccc(NC(=O)C(=O)NNC(=O)c3ccncc3)c2)cn1	763462580	PKOINFUKHNBNRS-UHFFFAOYSA-N	434.412	1.137	50	20	IDGD	
O=C(NNC(=O)c1ccccn1)C(=O)Nc1cc(F)c(F)cc1I	763464928	YOZSZPMLCPBIBF-UHFFFAOYSA-N	446.151	1.364	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(Cl)c(F)c2)cc(OC)c1OC	763539032	HTOOUAZCOHRGJR-UHFFFAOYSA-N	425.800	1.905	50	20	IDGD	
Cc1ccc(Oc2ccc(NC(=O)C(=O)NNC(=O)[C@H]3COc4ccccc4O3)cc2)nn1	763574445	BGJPWVYZPOTDDW-GOSISDBHSA-N	449.423	1.503	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)c(F)cc1F	763604829	MQIRYPXUIQZQBG-UHFFFAOYSA-N	443.366	1.541	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)COc2cccc(C(F)(F)F)c2)c(Cl)n1	763640488	YSVADWFNONGMGQ-UHFFFAOYSA-N	446.769	1.927	50	20	IDGD	
Cc1nc(Br)ccc1NC(=O)C(=O)NNC(=O)COc1ccc(Cl)cc1	763695106	OUOKDXDTDMUQGB-UHFFFAOYSA-N	441.669	1.971	50	20	IDGD	
CO[C@H](C)C(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)c1	763866864	YHXYVJMXYXMLFE-CHWSQXEVSA-N	446.435	1.353	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccccc1O[C@H]1CCOC1	763867294	UUQSRHULVMVLOR-BBRMVZONSA-N	431.420	1.547	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(-c3ncon3)cc2)cc1	763877902	MFSFOXJZELPDCO-CYBMUJFWSA-N	437.412	1.493	50	20	IDGD	
CC(C)Oc1ccc(NC(=O)C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc1C#N	763945361	XANQEROPUYZMGK-UHFFFAOYSA-N	448.439	1.636	50	20	IDGD	
O=C(NNC(=O)C1CCCC1)C(=O)Nc1ccnn1Cc1ccc(Br)cc1	764066300	JJZZAEQBMGPOQC-UHFFFAOYSA-N	434.294	1.970	50	20	IDGD	
O=C(NNC(=O)c1ccc(F)cc1Br)C(=O)Nc1cnc2c(c1)COCC2	764086370	RJYVJFXYUKNMDT-UHFFFAOYSA-N	437.225	1.456	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cc(C(F)(F)F)cnc3O)n[nH]2)cc1	764110486	KIDBCFDDXSMMSM-UHFFFAOYSA-N	448.361	1.904	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccccc2C(=O)OC(C)(C)C)c1O	764132147	LAIJULCCWRTRQT-UHFFFAOYSA-N	429.429	1.756	50	20	IDGD	
Cc1cc(C)nc(Sc2ccc(NC(=O)C(=O)NNC(=O)Cc3ccccn3)cc2)n1	764271306	ZOWYCLQMAAKLJN-UHFFFAOYSA-N	436.497	1.968	50	20	IDGD	
Cn1cc(Br)cc(NC(=O)C(=O)NNC(=O)CCCc2cccs2)c1=O	764340072	RPXYKLWDRBVIHG-UHFFFAOYSA-N	441.307	1.318	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2cccs2)[nH]n1)C(=O)Nc1ccc(N2CCOC2=O)cc1	764377871	RJYKSCNVVBHNAJ-UHFFFAOYSA-N	440.441	1.495	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2cccs2)[nH]n1)C(=O)Nc1ccccc1O[C@@H]1CCOC1	764382990	UCFOFMOFEBAJMU-GFCCVEGCSA-N	441.469	1.706	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1cccc(C(=O)Nc2ccccc2)c1C	764398333	FNQMLLULQPJDFA-OAHLLOKOSA-N	442.472	1.385	50	20	IDGD	
CS(=O)(=O)N1CCN(CC(=O)NNC(=O)c2ccccc2Cl)Cc2ccccc21	764461216	ZHLHLBVPNRVTQN-UHFFFAOYSA-N	436.921	1.383	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=S)NCCc3ccccn3)CC2)cc1	764518506	FWEPQTKXUFYJKL-UHFFFAOYSA-N	426.590	1.246	50	20	IDGD	
COC(=O)NNC(=O)C(=O)Nc1cc(OC)c(OC)cc1C(=O)N1[C@H](C)CCC[C@H]1C	765377626	YCWAOJRVCZBSCG-VXGBXAGGSA-N	436.465	1.433	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)CCn3nnc4ccccc4c3=O)n[nH]2)cc1	765575815	MOBWTBPTOHAZID-UHFFFAOYSA-N	431.456	1.595	50	20	IDGD	
Cc1ccc(Br)c(S(=O)(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)c1	765646494	FJYKGSATJQQATE-UHFFFAOYSA-N	430.236	1.995	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)c1ccc2c(c1)COC2	765752988	TYCQIXAYWXYKMT-UHFFFAOYSA-N	428.920	1.949	50	20	IDGD	
CN1CCO[C@H]([C@@H](NC(=O)NNc2nc(O)c3cnn(C)c3n2)c2ccc(Cl)cc2)C1	766319491	LVPSDXMADYJVMR-GJZGRUSLSA-N	446.899	1.420	50	20	IDGD	
O=C(CSc1cccc[n+]1[O-])NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	766660769	RLGLNEMNQYAHLR-UHFFFAOYSA-N	449.964	1.031	50	20	IDGD	
CCOc1ccc(NC(=O)CN2CCN(CC(=O)NNC(=O)c3cccs3)CC2)cc1	767057524	AKGFWODQJOOBOR-UHFFFAOYSA-N	445.545	1.164	50	20	IDGD	
COc1cccc(-c2cc(C(=O)OCC(=O)NNC(=O)Cc3nc(C)cs3)n[nH]2)c1	767604705	RXCMYDGTYHANQY-UHFFFAOYSA-N	429.458	1.397	50	20	IDGD	
COc1cc2c(cc1NC(=O)C(=O)NNC(=O)c1cc(Cl)ccc1O)NC(=O)CC2	768236381	BHVMAFBUDOQTCQ-UHFFFAOYSA-N	432.820	1.339	50	20	IDGD	
CCOc1ccc(N(C)S(=O)(=O)c2ccc(C)c(C(=O)NNC(=O)C(C)(C)O)c2)cc1	768260911	IAEVQXUZQPJLQF-UHFFFAOYSA-N	449.529	1.751	50	20	IDGD	
COc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)cc1	768268399	PJVVGLNUWAQWIQ-NSHDSACASA-N	449.514	1.275	50	20	IDGD	
O=C(NNC(=O)c1ncn(-c2ccccc2)n1)c1ccc(S(=O)(=O)N2CCCC2)cc1	768284421	HGDJVNPAHZTBCT-UHFFFAOYSA-N	440.485	1.127	50	20	IDGD	
O=C(CS(=O)(=O)c1cccc(Br)c1)NNC(=S)Nc1ccccn1	768584496	RVTSRECJKKBADF-UHFFFAOYSA-N	429.321	1.636	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)CN2C(=O)N[C@]3(CCCC(C)(C)C3)C2=O)c1	768701526	DOPXROZQOAGBAE-QFIPXVFZSA-N	444.488	1.190	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)Nc1ccc(C[C@H]2CC(=O)NC2=O)cc1	769241448	KLGRWMUYNIVROL-ZDUSSCGKSA-N	446.485	1.453	50	20	IDGD	
CCCn1c(=O)nc(O)c2c(C(=O)NNC(=S)NCCSC)cc(C3CC3)nc21	770245281	BPWLZSYTKHIQBR-UHFFFAOYSA-N	436.563	1.256	50	20	IDGD	
CCNC(=O)c1cccc(CNC(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)c1	770348489	ZSYDTGMENVKIBG-UHFFFAOYSA-N	426.481	1.863	50	20	IDGD	
CCN1CCN(C[C@H](C)CNC(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)CC1	770531822	BCOVRAXJSHGDFX-HZPDHXFCSA-N	425.961	1.711	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1ccc(Cl)c(S(=O)(=O)N2CCCC2)c1	771880676	IKPYNPQJGSKRJT-NSHDSACASA-N	431.898	1.227	50	20	IDGD	
COc1cc(C(=O)NNC(=O)N[C@@H]2CC(=O)N(C3CCCCC3)C2)cc(OC)c1OC	772550709	RFMZKYFIJYQKFF-CQSZACIVSA-N	434.493	1.590	50	20	IDGD	
CC[C@@]1(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)CCCN1C(=O)OC(C)(C)C	772563981	IAGUHBOLWGGJES-FQEVSTJZSA-N	429.481	1.603	50	20	IDGD	
Cc1ocnc1CNC(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	775453036	ALDGLXPPFUBASK-UHFFFAOYSA-N	432.444	1.829	50	20	IDGD	
CC(C)NC(=O)C(=O)NNC(=O)[C@H]1CC(=O)N(C(C)C)[C@H]1c1ccc(Cl)c(F)c1	776703496	XGJKAVMWURRPGP-LRDDRELGSA-N	426.876	1.449	50	20	IDGD	
COCCO[C@@H]1COCC[C@H]1NC(=O)NNC(=O)Nc1cc(Cl)c(OC)cc1OC	776939806	RZRPDVAAIFFMDW-MLGOLLRUSA-N	446.888	1.513	50	20	IDGD	
CC(=O)N1CCC(=NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)c2ccccc2C1	778540899	YHVWIGNKEWFEME-UHFFFAOYSA-N	434.905	1.874	50	20	IDGD	
Cc1nc(O)c(C(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)cc1Br	779050588	VDMQVZSAHTXZEB-UHFFFAOYSA-N	441.669	1.589	50	20	IDGD	
CS(=O)(=O)NCc1ccc(C(=O)NNc2ccc([N+](=O)[O-])cc2Br)o1	779136083	FEBCJAJGTYNZIH-UHFFFAOYSA-N	433.240	1.756	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)[C@H]2CCN2C(=O)OC(C)(C)C)cc1C	781331937	MLXNTUDPUHUYHK-GFCCVEGCSA-N	425.507	1.933	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(O)cc2)cc1S(=O)(=O)NC(C)(C)C	782833042	BLWXBUOSEVNKPD-UHFFFAOYSA-N	448.501	1.177	50	20	IDGD	
N#C/C(=C/c1cn(Cc2cccnc2)nn1)C(=O)Nc1cc2c(cc1[N+](=O)[O-])OCCO2	783700665	ULNQQZGVARQXHW-NSIKDUERSA-N	433.384	1.946	50	20	IDGD	
Cc1cc([N+](=O)[O-])c(Cl)c(S(=O)(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c1	783804510	DEFQQVHCWZKIHC-UHFFFAOYSA-N	437.825	1.156	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)[C@@H]2CC=CC[C@@H]2C(=O)N2CCOCC2)cc1OC	784297603	YOXULQRMFJZROO-SJORKVTESA-N	431.489	1.296	50	20	IDGD	
CCOC(=O)C(C)(C)n1cc(NC(=O)C(=O)NNc2ccc(Br)cn2)cn1	784339483	KUOIPRCQLKKSJL-UHFFFAOYSA-N	439.270	1.421	50	20	IDGD	
O=C(NNC(=O)c1cccc(Br)c1)N[C@H]1CCCN(Cc2ccccn2)C1=O	784343677	KNTPXHDMVGPACF-INIZCTEOSA-N	446.305	1.979	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Cc2cccc(N3CCCC3=O)c2)c1	784695562	NZQLEZMMGBJARX-UHFFFAOYSA-N	444.513	1.067	50	20	IDGD	
CN1CCCN(S(=O)(=O)c2cccc(NC(=O)C(=O)NNc3ccccc3)c2)CC1	784765384	YLVIHGYIIQFIHP-UHFFFAOYSA-N	431.518	1.095	50	20	IDGD	
O=C(NNc1ccc(Br)nc1)C(=O)Nc1cccc(CN2CCOC2=O)c1	784806216	CXTLNSRYPHCCPR-UHFFFAOYSA-N	434.250	1.878	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1ccc2c(c1)OCCCO2	785330003	BQMQXPUSXWJDKK-UHFFFAOYSA-N	435.458	1.342	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2cccc3c2OC(C)(C)C3)c2ccccc2c1=O	789586002	IKAGKRKUMAUVFE-UHFFFAOYSA-N	449.467	1.530	50	20	IDGD	
CCOC(=O)c1ncn(C2CCN(C(=O)/C(C#N)=C\c3cc(C#N)n(C)c3C)CC2)c1N	791236699	RAUWEGGLIADQRU-SXGWCWSVSA-N	435.488	1.931	50	20	IDGD	
CNC(=O)c1cc2cc(NC(=O)C(=O)NNC(=O)c3cc4c(s3)CCC4)ccc2[nH]1	792352777	JXSFQVUZKHNPRN-UHFFFAOYSA-N	425.470	1.477	50	20	IDGD	
CCn1ncnc1CNC(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	793456364	RFRGBRQAJSUYIM-UHFFFAOYSA-N	446.471	1.200	50	20	IDGD	
CCc1cc(C)cc(CC)c1NC(=O)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	797006861	LEMABAXVNXHIKL-UHFFFAOYSA-N	438.532	1.912	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccc(S(=O)(=O)C(F)F)cc2)cc1	801106798	HSUDQEHPEVTLGS-UHFFFAOYSA-N	425.413	1.320	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(C(=O)NNC(=O)CSc2ccccc2O)ccc1F	801179962	LGJZVWUMKXVTEO-UHFFFAOYSA-N	427.479	1.335	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2ccc(N3C(=O)CCC3=O)c([N+](=O)[O-])c2)cc1	802052960	UZGKJDQYIBBMBO-UHFFFAOYSA-N	427.373	1.723	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)c2cnc3nc(O)nc(O)c3c2)c(OC)cc1Cl	802078063	IXIJKGXGGYRQMO-UHFFFAOYSA-N	434.796	1.573	50	20	IDGD	
CS(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)c2ccccc2O)c(Br)c1	802720765	LHPYHDZLCJXPCF-UHFFFAOYSA-N	449.304	1.182	50	20	IDGD	
CCOC1(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)CCOCC1	803650108	ZCHUIOWRDGEZNM-UHFFFAOYSA-N	439.534	1.208	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)[C@H]1CCN(c2ccc(C#N)cc2F)C1	804527123	OYUUSNNMMZKNIM-HNNXBMFYSA-N	433.484	1.976	50	20	IDGD	
CCc1nnc(NC(=O)[C@@H](C)[C@@H](C)NC(=O)NNC(=O)c2ccc3c(c2)OCCO3)s1	805878760	SBLZAMKSABBTKP-WDEREUQCSA-N	448.505	1.479	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(NC(=O)C(=O)NNc2ccc(C#N)c(Cl)c2)ccc1F	807019831	ARORGGHWPJJBAJ-UHFFFAOYSA-N	439.856	1.683	50	20	IDGD	
Cc1ccc([C@@H](CNC(=O)NNC(=O)c2nnc(O)c3ccccc23)N2CCOCC2)o1	807023192	DVPMNEKNRQXMEC-MRXNPFEDSA-N	440.460	1.254	50	20	IDGD	
Cc1ccccc1[C@H]([C@H](C)NC(=O)NNC(=O)c1csc(N2CCOCC2)n1)N(C)C	807406715	AZRFYVFUPAKOIS-YJBOKZPZSA-N	446.577	1.924	50	20	IDGD	
Cn1cncc1C(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2Cl)c1	809555522	AAALIUXVCJWJAG-UHFFFAOYSA-N	433.877	1.949	50	20	IDGD	
Cc1cc(=O)cc(C)n1CCCC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	809937603	CIPSDZRZTQSSKG-UHFFFAOYSA-N	439.560	1.605	50	20	IDGD	
CCOc1cc(Br)c(F)cc1NC(=O)NNC(=O)[C@H](C)NS(C)(=O)=O	810339936	TXHHMOCCBZUAQQ-ZETCQYMHSA-N	441.279	1.077	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](C(=O)OCC(=O)NNC(=O)c1ccc(C#N)cc1)C(F)(F)F	811425336	UQUFMLGNVKCPDM-CYBMUJFWSA-N	444.366	1.318	50	20	IDGD	
COCCOCc1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1	812446399	AUENFGKXVBHUMX-UHFFFAOYSA-N	435.502	1.175	50	20	IDGD	
O=C(NNC(=O)c1cccc(F)c1Br)c1csc(N2CCOCC2)n1	814225324	SKYBLSUETRQHPV-UHFFFAOYSA-N	429.271	1.956	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2nsc3ccc(C)cc23)cc1	814723719	LBBUPAKDNPHRGZ-UHFFFAOYSA-N	432.527	1.995	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@@H](C)Cc2cnc3ccccc3n2)c2ccccc2c1=O	814729421	PHALQLYQRLRHHE-AWEZNQCLSA-N	430.468	1.999	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(N(C(C)=O)C2CC2)cc1	815565328	KJDHXVYQENZECI-UHFFFAOYSA-N	440.456	1.375	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)nc2)cc1)[C@H]1C[C@H]1C	815567621	FUQQRZUNYVDCHD-BZNIZROVSA-N	429.864	1.896	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NNC(=O)c2ccc(C(N)=O)c(Cl)n2)C1	816510885	IXHGZBKVKLNUJL-SNVBAGLBSA-N	425.873	1.242	50	20	IDGD	
CCOC(=O)Cc1csc(NC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)n1	875383958	OVNCFCZRTAZGPS-UHFFFAOYSA-N	430.446	1.607	50	20	IDGD	
O=C(CN1CCCCCCC1=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	915685895	QLMNOPOKLQAPJC-UHFFFAOYSA-N	436.534	1.025	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2ccc3c(c2)OCCO3)ccc1OCC(=O)NC(C)C	916044213	IWLGYXLHDWAVTD-UHFFFAOYSA-N	443.456	1.445	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)CCOc2ccc(F)cc2Cl)c1	916110053	BXWYTFJKDATSNV-UHFFFAOYSA-N	443.884	1.960	50	20	IDGD	
C[C@@H](NC(=O)c1ccoc1)C(=O)NNC(=O)c1ccc(CSc2nncn2C)cc1	917021794	TYZBRWHBVPPAKV-GFCCVEGCSA-N	428.474	1.280	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)C(=O)N(C[C@@H]1CCCO1)C2=O)c1ccc(Cl)nc1	917249049	NMSFEKGGHODAOV-ZDUSSCGKSA-N	428.832	1.585	50	20	IDGD	
Cc1[nH]c(-c2ccncc2)nc(=O)c1CC(=O)NNC(=O)c1ccc(Br)s1	917926469	UIXCMGFAAKBYAZ-UHFFFAOYSA-N	448.302	1.968	50	20	IDGD	
C[C@@H](Cc1ccc(O)cc1)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	919911500	PCSQQJAWUYNHNH-HNNXBMFYSA-N	446.529	1.752	50	20	IDGD	
CSCC[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)NNC(=O)NCc1ccco1	920856456	KYGBNGSYEVSPMQ-OAHLLOKOSA-N	435.462	1.570	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)Nc1cccc(CN2C(=O)CNC2=O)c1	920931383	MRZBGSSYXOVXCF-UHFFFAOYSA-N	425.445	1.533	50	20	IDGD	
C[C@@H](Cc1cccc(F)c1)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	920999182	HTHMULRYGSCZOC-HNNXBMFYSA-N	449.504	1.486	50	20	IDGD	
Nc1cnnc(NNC(=O)[C@@H]2CC(=O)N(c3cccc(Br)c3)C2)c1Cl	1116298123	KOYWIFDTMIIUKR-MRVPVSSYSA-N	425.674	1.971	50	20	IDGD	
COc1ccc(S(=O)(=O)CCC(=O)NNC(=O)c2ccc(Cl)cc2OC)cc1	1248474821	ONSNNRKOGDSBON-UHFFFAOYSA-N	426.878	1.982	50	20	IDGD	
COc1ccc(S(=O)(=O)C[C@@H](C)C(=O)NNC(=O)c2cncn2-c2ccccc2)cc1	1251902239	GOEVCDJSZAITPO-OAHLLOKOSA-N	442.497	1.752	50	20	IDGD	
CO[C@@H](CNC(=O)NNc1ccc(S(=O)(=O)NC(C)C)cn1)c1ccc(F)cc1	1252728622	ZFMHMSUBZZHDDA-INIZCTEOSA-N	425.486	1.921	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)(C)O)cc1	1261224406	HGUYLRBNBNZPFJ-CQSZACIVSA-N	430.527	1.044	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)CN(C)C(=O)OC(C)(C)C	1318715350	DDJYGAYVIVSRJD-CYBMUJFWSA-N	446.508	1.381	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN2CCC(NC(=O)c3cc(C)on3)CC2)cc1C	1319374727	KZTIEDXPLCYDBH-UHFFFAOYSA-N	433.534	1.571	50	20	IDGD	
O=C(NNC(=O)c1cccc(Br)c1)N[C@@H]1CCO[C@]2(CCS(=O)(=O)C2)C1	1319833404	WFUUHPFYFFUKDZ-CZUORRHYSA-N	446.323	1.129	50	20	IDGD	
CCOC(=O)[C@H]1CN(C(=O)OC(C)(C)C)CCN1CC(=O)NNC(=O)c1ccc(C)cc1	1322786562	PTKLZNILLMEFCL-QGZVFWFLSA-N	448.520	1.240	50	20	IDGD	
C[C@@H]1Cc2cc(S(=O)(=O)NNC(=O)C3CCN(C(=O)OC(C)(C)C)CC3)ccc2O1	1322956810	DZSYOJIOQBARIG-CYBMUJFWSA-N	439.534	1.967	50	20	IDGD	
O=C(c1c[nH]c2cc(Cl)ccc12)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1777787645	SPOYRKNPYRBGBJ-QFBILLFUSA-N	426.300	1.865	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CC(F)(F)C(=O)O)C1	1778013334	REBOIJBTIIGXAS-HFBAOOFYSA-N	445.290	1.847	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)c2cc(O)ccc2n1	1778423062	IXCFJVBFMPZGOM-NQIIRXRSSA-N	433.892	1.292	50	20	IDGD	
Cc1cnc2c(C(=O)N3CC[C@@]4(C3)CN(C(=O)[C@@](C)(Cl)CCl)CCO4)cnn2c1	1778525416	FUMIQYXIDGWGGL-RBUKOAKNSA-N	440.331	1.718	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc3cccnc3[nH]2)C1	1779063831	RUEKHGMMVQQTGL-LUQKVYGDSA-N	434.924	1.944	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)/C=N/O[C@H]3CCCCO3)C2)C1	1779098280	FXGHOPSSEHMAAZ-DKNRJFKUSA-N	446.342	1.376	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)C/N=C/c3ccco3)C2)C1	1779137739	DOPSQCMAVCIFCM-GYMQQHCDSA-N	426.311	1.702	50	20	IDGD	
COc1ccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](C)Br)C3)nn1	1779954883	RJPWFNFQOSKIOS-WPKBUWHJSA-N	441.326	1.396	50	20	IDGD	
CN(C)c1ccc([N+](=O)[O-])c(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](F)Cl)CCO3)c1	1780117156	GDWXWCCBJDSKDY-YJBOKZPZSA-N	428.848	1.639	50	20	IDGD	
O=C(c1cc2n(n1)CCCC2)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781331283	HTODIWKGCGMOBL-YOEHRIQHSA-N	429.290	1.353	50	20	IDGD	
Cn1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)c2cccnc21	1781331854	QZWCDLHAVWHPFW-RDTXWAMCSA-N	439.285	1.707	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H]1CCC(=O)N1C)C2	1781902671	DLWWQVHGHIVKRC-XTDOFWJNSA-N	444.370	1.295	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cccc(-n4cncn4)c3)C2)C1	1782019405	VBKGREGTCILKKD-LIRRHRJNSA-N	448.321	1.494	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)n1cc(C)cn1)C2	1782178520	NUHWHQIVEMFHLX-MIALQEHNSA-N	426.945	1.520	50	20	IDGD	
Cc1ccc(F)c(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CCC(=O)NN(C)C)C2)c1	1782213440	RCGLYHFSWSJFMA-AUSIDOKSSA-N	448.539	1.635	50	20	IDGD	
O=C(c1cc2cccnc2nc1O)N1CC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1782267781	NHAXGQXZDLYWJH-SFHVURJKSA-N	425.272	1.583	50	20	IDGD	
CCC(=O)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](Br)Cc3ccccc3)C2)C1	1783021584	CRLRNXCXAZKBQS-JXFKEZNVSA-N	437.334	1.802	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)CCc3cnccn3)CCO2)C1	1783354311	PGCKWGNJBMGURX-YJBOKZPZSA-N	425.327	1.413	50	20	IDGD	
COc1ccc(CC(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](C)Br)C3)C2)cc1	1783533558	ZZLMUEFYQGYFIG-AUUYWEPGSA-N	425.323	1.851	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)Cc3ccc(C(=O)OC)cc3)CCO2)C1	1783879468	VFLFMPWYSOZRAY-LAUBAEHRSA-N	438.908	1.099	50	20	IDGD	
C[C@H](C(=O)N1CCO[C@@]2(CCN(C(=O)C(Cl)Cl)C2)C1)N(C)C(=O)OC(C)(C)C	1783947252	QJWCPWFVOBFQSV-KZULUSFZSA-N	438.352	1.875	50	20	IDGD	
CC#C[C@@H](CC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2)c1ccc(O)cc1	1784015479	ZAQSCPGNKILMNE-LQBOVUBWSA-N	434.920	1.319	50	20	IDGD	
CCc1cc(C(=O)NC2(c3ccc(NC(=O)c4ccc(B(O)O)cc4)cc3)CCC2)n(C)n1	1788142233	LEBRIXXVGPFFLP-UHFFFAOYSA-N	446.316	1.724	50	20	IDGD	
Cc1n[nH]c(C)c1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)CBr)C[C@@H]21	1788815533	QMBRCFZKNJCNPQ-KJEVXHAQSA-N	427.343	1.651	50	20	IDGD	
CC[S@](=O)CCC(=O)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1	1789420398	WVEXVSZBEPNMNS-HKBQPEDESA-N	442.346	1.273	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc4ccc(F)cn34)[C@H]2C1	1790473600	MISRQCYHDRSNPY-ZVZYQTTQSA-N	448.571	1.918	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4nn[nH]c4c3)[C@H]2C1	1790534954	LACHCBSNBQYXAN-MPGHIAIKSA-N	431.569	1.403	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3c(F)ccnc3Cl)C[C@@H]21	1791252675	RHEYOCYNSKMXBH-MNXVOIDGSA-N	434.295	1.721	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(C)nc3OC)C[C@@H]21	1791255120	FZYMQQKOJPLRAI-HJWJTTGWSA-N	425.913	1.246	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(NC(C)=O)c(O)c1)C2	1793453695	QYINBOAJUISIQR-RCJHGTSTSA-N	437.924	1.961	50	20	IDGD	
CCCNC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2	1793462756	CRKYVWJNXAEPBJ-OSSGZSMMSA-N	444.536	1.065	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CNC(=O)c1cccs1	1794119074	WOKMLWQUVOPVFZ-ABXQLRGKSA-N	448.372	1.304	50	20	IDGD	
N#Cc1cccc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCBr)c1	1795113015	JABPGZHSUVZIGE-XEMDLRDOSA-N	434.334	1.865	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CCC(=O)N1	1795702273	JMZFVPTUDZWZNU-LOUJCGABSA-N	444.444	1.051	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)c1cc2cc[nH]c2cc1F	1796188476	LSAVOMAJEPOACP-BCDXTJNWSA-N	435.264	1.552	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1ccc2nonc2c1	1796885030	SMNAHSYOMUUGJY-DJBIQUGXSA-N	427.230	1.117	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)[C@H]1Cc2ccccc2O1	1797227075	NTBDBAFMMSXLJD-UDUPFKKZSA-N	427.270	1.270	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2c(c1)CC(=O)N2	1797331680	QJIKZXHANAFJIF-MJRMRKOOSA-N	436.306	1.168	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(=O)nc2cccnn12	1799189806	BVPNNYBFTGYMSO-RVMXOQNASA-N	434.294	1.125	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1cccc2nccn12	1799995304	QEYUWAUBXKIGQN-JLUCKKNBSA-N	425.258	1.228	50	20	IDGD	
CN(C)[C@@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)c1ccc(Cl)cc1	1800303990	LUWXTHXCXDOJKY-WTNVTLLGSA-N	444.359	1.132	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc3ccccn13)C2	1800640736	FZGQWSRRMKZYCM-UMPJEAMMSA-N	435.322	1.711	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CCCN1Cc1ccccc1	1801192679	FVYNTHWQIXKGCY-SSTJLMRISA-N	449.979	1.494	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccnc3c2OCO3)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803140801	IHNCYMFLBQCEDX-CWRNSKLLSA-N	432.864	1.125	50	20	IDGD	
Cc1ccn2c(C(=O)N3CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]3c3cccnc3)cnc2c1	1803146558	BQCUSYHFKUUDPE-IMFGXOCKSA-N	441.919	1.957	50	20	IDGD	
CC(C)(C)CC(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1	1806306392	JFLUJGGWXHSLMY-JXFKEZNVSA-N	438.532	1.836	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC2(CCCN(C(=O)Cn3cc([N+](=O)[O-])cn3)C2)CC1	1806935990	YUZMFCHFBYJIHA-OAHLLOKOSA-N	427.889	1.276	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2cc(=O)n3[nH]cnc3n2)[C@H]1c1cccnc1	1807356534	CFCPDWHDVFCVDK-GRDNDAEWSA-N	443.895	1.150	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2nn(C)c3c2CCC3)[C@H]1c1cccnc1	1809367702	UOKHTIMWDBBGQW-RIFZZMRRSA-N	445.951	1.877	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2ccc3ncnn3c2)[C@H]1c1cccnc1	1813030731	GDNQOWPENOXMLQ-AYBZRNKSSA-N	442.907	1.698	50	20	IDGD	
C=C(CC(=O)OCC)C(=O)N1CC[C@H](CNC(=O)[C@H](Cl)COC)[C@H]1c1cccnc1	1813032136	GHNLBPYCPRWNCN-ZHALLVOQSA-N	437.924	1.851	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)Cc2cccs2)[C@@H]1c1cccnc1	1813070089	DGOSITRJHVDBCH-VGOFRKELSA-N	443.573	1.765	50	20	IDGD	
Cc1nc(C)c(C(=O)N2CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)o1	1813073871	PKQBHDBTKNIPQY-XLIONFOSSA-N	442.520	1.379	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)CSc2nc[nH]n2)[C@@H]1c1cccnc1	1813349978	FCDZYKBEXXAOEG-YCPHGPKFSA-N	438.941	1.252	50	20	IDGD	
C[C@]1(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)CC=CCC1	1813579100	JMIRAXMMDCQPEO-LFAGZIFBSA-N	447.344	1.827	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H]3CCC(=O)N3)sc2C1	1814061508	HDLYIOJVMMYKTQ-KKZNHRDASA-N	429.340	1.507	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)C2CCC3(CC2)OCCO3)[nH]n1)[C@@H](O)CCl	1814874685	AGGYCCKPSNSXBJ-CVEARBPZSA-N	440.928	1.935	50	20	IDGD	
N#Cc1ccccc1OCC(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](O)CCl)n[nH]1	1814875508	BCCLKJCVFWGFOS-JKSUJKDBSA-N	431.880	1.952	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC[C@@H]1c1cc(NC(=O)C23CC(F)(C2)C3)n[nH]1	1815285885	YOKNWQIQCIGDKS-YMTQGWHGSA-N	426.257	1.288	50	20	IDGD	
CCC[C@@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(=O)n3[nH]cnc3n2)[nH]n1	1815317842	KDIXYWQOWWXQAQ-BXUZGUMPSA-N	446.899	1.854	50	20	IDGD	
CCc1cc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)no1	1819887553	YBYXGARMEWVRLT-GOSISDBHSA-N	437.265	1.260	50	20	IDGD	
CC(C)n1ccc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)CCC(=O)NN(C)C)CC3)n1	1821681241	NIJCYNKYGBVSHN-CYBMUJFWSA-N	447.565	1.519	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN2CCSCC2)[nH]n1	1822367132	NOKVGEKYPZMRJR-ZFWWWQNUSA-N	429.974	1.704	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](C)CS(C)(=O)=O)[nH]n1	1822369470	GUQDSJZQCKSVFI-DYEKYZERSA-N	434.946	1.336	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ncc(F)cc2F)[nH]n1	1822410204	BQRLQENBLXDRLW-HNNXBMFYSA-N	449.462	1.762	50	20	IDGD	
Cc1cccc(CC(=O)N2CCCC[C@@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)n1	1822412518	RIWJZCMAUGBLMV-GOSISDBHSA-N	441.536	1.721	50	20	IDGD	
O=C(c1cnc2snnc2c1)N1CCC([C@@H]2CCCCN2C(=O)[C@H](O)CCl)CC1	1824185590	KDVJOQDTRIBEFG-JKSUJKDBSA-N	437.953	1.919	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](O)CCl)CC2)c1n[nH]c2cccc(F)c12	1824293085	MCSCHTZVQMZVKN-UFBFGSQYSA-N	437.884	1.984	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](N)CCC(N)=O)CC1	1826817967	PLXDYRVTONATQU-KBMXLJTQSA-N	445.402	1.230	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ncon2)CC1	1827678974	BXLLWDBXXYITFV-PTZPRWATSA-N	441.492	1.437	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)c2ccncc2F)CC1	1827952676	MWJZKULONCZXEJ-NRFANRHFSA-N	439.296	1.448	50	20	IDGD	
O=C1NCCCn2nc(C(=O)N3CCCC[C@@H]3C3CCN(C(=O)[C@@H](F)Cl)CC3)cc21	1828500299	MZJUPOOXHIJUDF-NVXWUHKLSA-N	439.919	1.784	50	20	IDGD	
CCOc1ncccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1829545518	QDRFWGCLFIYLJL-SFHVURJKSA-N	432.304	1.354	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(F)nc3)C2)C1	1830539173	DNPJLJOISFSSQI-SCLBCKFNSA-N	444.301	1.322	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3CCSCC3)C2)C1	1830545564	KWZLZYLGWKKTEZ-KDOFPFPSSA-N	449.411	1.617	50	20	IDGD	
CC[C@@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1)N(CC)CC	1831669346	GYUFUDCIDLUIMI-GHTZIAJQSA-N	443.661	1.415	50	20	IDGD	
O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)C[C@@H]1CCCCO1)CCO2	1832340993	PJBSMHMKNIAYFY-YJBOKZPZSA-N	433.343	1.187	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3cnsn3)CC2)CC1	1833980430	NFFIPYLWJYFGOB-NSHDSACASA-N	430.372	1.507	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3ccncc3O)CC2)CC1	1835877028	BEXDXNRYRMBTRG-CYBMUJFWSA-N	439.354	1.756	50	20	IDGD	
CCc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](Br)CC)C3)C2)n[nH]1	1836281844	HLSBZOFQIQGFFJ-KBXCAEBGSA-N	443.342	1.216	50	20	IDGD	
O=C([C@@H](F)Br)N1CCOC[C@]2(C1)CN(C(=O)C1(F)CCCCC1)CCO2	1836617633	NHPMZMRMNLFWCL-CJNGLKHVSA-N	439.297	1.806	50	20	IDGD	
COc1cccc(C(=O)N2CCC(OC3CCN(C(=O)[C@H](O)CCl)CC3)CC2)n1	1836715777	ZNNUZVVJBPBYLS-QGZVFWFLSA-N	425.913	1.302	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)C(=O)c3ccco3)CC2)CC1	1837111656	DBWWCDHIFXONOC-INIZCTEOSA-N	426.897	1.715	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(Cl)nn3)CCO2)C1	1837833286	XNMOLPBABYXBJF-SFHVURJKSA-N	431.320	1.465	50	20	IDGD	
Cc1nccnc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1	1838217011	QMEMPISCTGZQIX-ROUUACIJSA-N	431.320	1.091	50	20	IDGD	
O=C(c1cc(O)no1)N1CCC(OC2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1838481839	LEXQHBQDFDGVCR-CQSZACIVSA-N	434.262	1.683	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)[C@@]3(C)CC3(F)F)CC2)CC1	1838789425	OZNSWSWTWLVJFC-HXUWFJFHSA-N	444.523	1.403	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(F)cc3F)CCO2)C1	1839006858	WIXGPQSZCJZBMZ-BEFAXECRSA-N	432.851	1.289	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(O)ccc1F)CCO2	1839295566	QMPGUWSIZPQGHZ-HXUWFJFHSA-N	440.544	1.453	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccns3)C2)C1	1839962359	BRHJUYNHLYZWRB-MLGOLLRUSA-N	432.340	1.387	50	20	IDGD	
C[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1)n1cccn1	1840442960	SZIXCZJNKFGFSH-OLMNPRSZSA-N	433.336	1.137	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3c(C)cccc3F)CCO2)C1	1840652254	JKQXDWXFEAYTBS-QRWLVFNGSA-N	428.888	1.458	50	20	IDGD	
O=C(CCc1c[nH]c2ncccc12)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1840871130	TZAJCSXOASOUKQ-YLJYHZDGSA-N	438.887	1.486	50	20	IDGD	
Cc1c(C(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)oc2ccccc12	1844264117	GXOANJILHLWQIZ-UHFFFAOYSA-N	433.468	1.871	50	20	IDGD	
CC[C@@H](C)[C@@H](O)C(=O)N1CC2(CCCN2C(=O)c2cc([N+](=O)[O-])ccc2OC(C)=O)C1	1844692014	YGTJHPMDWXIYHM-FZKQIMNGSA-N	433.461	1.744	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)c2ccccc2N2CCCCC2)C1	1845512212	CFENBOHCBLWMDI-UHFFFAOYSA-N	441.576	1.867	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@H](Cc2cccc(F)c2)NC(C)=O)C1	1847014407	LFMJNVRCBWKLTK-ZWKOTPCHSA-N	439.915	1.330	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H]1C[C@@H]1c1ccc(F)c(F)c1	1847612345	DAOJLIBMMDBEKU-LTDCPUDJSA-N	434.487	1.643	50	20	IDGD	
Cc1cc(C)c(OCC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2ccc(B(O)O)cc2)c(C)c1	1847733842	RDTNTUUFSCYZQM-SFTDATJTSA-N	436.317	1.186	50	20	IDGD	
Cn1nncc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](Br)Cc1ccccc1	1848282050	YVEQVZVLMVAEFY-JYJNAYRXSA-N	432.322	1.637	50	20	IDGD	
O=C(COC(=O)CNS(=O)(=O)c1ccc2ccccc2c1)NNC(=O)c1ccccc1	3381289	DYQXIKRVUAQLAN-UHFFFAOYSA-N	441.465	1.123	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)c2ccc3c(c2)CCN3S(C)(=O)=O)cc1OC	14936166	BNWQNTHSDGVIJT-UHFFFAOYSA-N	433.486	1.491	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)c1ccc(S(=O)(=O)NC(C)C)cc1	22616926	ZZVRMFCBSAKTLE-UHFFFAOYSA-N	435.502	1.612	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CNc2ccc(C)cc2)ccc1OCC(=O)NC(C)C	110888975	FHIKBTOCOLZVNT-UHFFFAOYSA-N	428.489	1.780	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(N2CCCS2(=O)=O)cc1)c1cccc(Cl)c1	726764143	ATKDIEIBJWLGNW-UHFFFAOYSA-N	429.907	1.503	50	20	IDGD	
C[C@H](NC(=O)OCc1ccccc1)C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	728210269	ZPGPLKRRGIUNSF-AWEZNQCLSA-N	432.502	1.885	50	20	IDGD	
Nc1c(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)ccc(Cl)c1Cl	728330277	NWFDLNLQHMAXCO-ZDUSSCGKSA-N	440.239	1.720	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NNC(=O)CC(C)(C)C)o1	728609833	IZPHSKYWIWGJEL-LBPRGKRZSA-N	429.495	1.193	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)NCC(C)(C)N2CCN(C)CC2)c1	728743017	XCPRQPCVYPFHLF-UHFFFAOYSA-N	442.358	1.428	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cccc(C#N)c2)cc1S(=O)(=O)NC(C)(C)C	728827372	NGEUEDVXVJOGFB-UHFFFAOYSA-N	430.486	1.718	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)CC1	728951248	DMCYCWZEYZQQDF-UHFFFAOYSA-N	447.540	1.423	50	20	IDGD	
CC(=O)Nc1ccc(CCNC(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)cc1	729059554	ZGYJHHHKKHMENT-UHFFFAOYSA-N	434.522	1.596	50	20	IDGD	
CCCN(CC)C(=O)c1ccc(C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1	729299765	HDZDHOJIIFDYNP-UHFFFAOYSA-N	435.484	1.880	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)Cc2ccccc2Br)n1	729730254	IKGARZRAGBCETA-UHFFFAOYSA-N	426.292	1.690	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)NCCOc2ccc(S(C)(=O)=O)cc2)c1C	730066545	LLVXJPCAXILBEQ-INIZCTEOSA-N	449.529	1.884	50	20	IDGD	
CCOCC(=O)NNC(=O)NCc1ccnc(N2CCN(c3ccc(F)cc3)CC2)c1	731280999	MCCMXCGOSMEQDD-UHFFFAOYSA-N	430.484	1.414	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCCC(=O)NNc2ccccc2S(C)(=O)=O)cc1	732306122	ZBWDPXBZARKHJB-UHFFFAOYSA-N	441.531	1.301	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)COCCNC(=O)OC(C)(C)C)c2ccccc2c1=O	732548378	GDJLBFMTNSEHSE-UHFFFAOYSA-N	447.492	1.280	50	20	IDGD	
CCc1cc(N2CCC[C@@H](NC(=O)NNC(=O)CCc3ccc(OC)cc3)C2)ncn1	732915076	YYKZRXDSSNUJHJ-GOSISDBHSA-N	426.521	1.980	50	20	IDGD	
CC(C)c1ccc(-n2c(NNC(=O)CN3C(=O)CN(C)C3=O)nc3ccccc3c2=O)cc1	733264119	JFSXBAFZDAABCD-UHFFFAOYSA-N	448.483	1.846	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)NCc2cc(C)[nH]n2)cc1	733286238	UYRQHLOCZOJJFW-MHWRWJLKSA-N	433.472	1.689	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)N[C@H]2CCN(c3ccc(C(F)(F)F)cc3)C2=O)n1	733850553	ILXFMDQHGQNYBC-HNNXBMFYSA-N	438.410	1.655	50	20	IDGD	
O=C(CCCn1ccccc1=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	735027905	DRDPWPKCGCKEJH-UHFFFAOYSA-N	446.529	1.264	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCC[S@](=O)Cc2ccccc2)cc(OC)c1OC	735087788	OCHOMHVLFOZUOY-PMERELPUSA-N	435.502	1.605	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)c2sccc2S(=O)(=O)NCc2cccs2)cn1	735470973	ILXNMPFTWIICBM-UHFFFAOYSA-N	425.517	1.096	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NC[C@H](O)c1cc(Cl)cc(Cl)c1	735682295	GGAAOUNQRMWLAU-LBPRGKRZSA-N	431.301	1.849	50	20	IDGD	
Cc1cc(NNC(=O)c2ccc3c(c2)S(=O)(=O)N(C[C@H]2CCCO2)C3=O)nc(C)n1	736718582	OWYJYPYEIQZPLA-CQSZACIVSA-N	431.474	1.174	50	20	IDGD	
CC(=NNC(=O)COCc1ccccc1)c1ccc(OCC(=O)N2CCOCC2)cc1	737438862	MEAIJVCVFJNTNK-UHFFFAOYSA-N	425.485	1.981	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)CCc2nc(-c3ccoc3)no2)cc1	739678974	OIWKKKMODCQLMQ-UHFFFAOYSA-N	447.473	1.039	50	20	IDGD	
O=C(NNc1ncnc2[nH]cnc12)c1ccc(Cl)c(S(=O)(=O)N2CCCCC2)c1	740746460	GDMSLBPZGGTKHZ-UHFFFAOYSA-N	435.897	1.938	50	20	IDGD	
C[C@@H]1CN(CC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)CC[C@@H]1NC(=O)OC(C)(C)C	740880349	XASIQKHIOGJSDN-CJNGLKHVSA-N	435.481	1.591	50	20	IDGD	
C[C@@H]1CN(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)CC[C@H]1NC(=O)OC(C)(C)C	740903238	LHDNVVZIVCVPLP-CZUORRHYSA-N	444.496	1.252	50	20	IDGD	
Cc1oncc1C(=O)Nc1ccc(C(=O)OCC(=O)NNC(=O)c2ccccc2)c(O)c1	741009186	QSMBVDVZDVWHGT-UHFFFAOYSA-N	438.396	1.559	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)COc1ccc(F)cc1)[C@@H]1CN(Cc2ccccc2)CCO1	741436001	SSXMNBPRDZATSW-JXFKEZNVSA-N	430.480	1.824	50	20	IDGD	
CC(=O)N[C@H](CC(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)c1ccc(F)cc1F	741693921	UNXUMIGXDOCVEO-OAHLLOKOSA-N	443.451	1.387	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)c2cc(=O)n(-c3nc(C)cc(C)n3)[nH]2)cc1	741741558	YLQBZZMEBBJRON-CQSZACIVSA-N	440.460	1.200	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)[C@H]1CCCN(C(=O)c2ccncc2)C1	741884010	ZNUOYMYDQIRSLP-KRWDZBQOSA-N	426.473	1.559	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCc2c[nH]nc2C1)c1ccccc1NS(=O)(=O)c1cccs1	742489032	JNIAFANEZQWTBJ-LBPRGKRZSA-N	445.526	1.838	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)[C@H]2CS[C@H](Cc3ccccc3F)C(=O)N2)cc1	743828829	JHRMJZQZFAENRY-QZTJIDSGSA-N	445.520	1.887	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNc3ccccc3S(=O)(=O)N3CCOCC3)n[nH]2)o1	744622574	ZQBAJYWEWKUHEJ-UHFFFAOYSA-N	431.474	1.756	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)[C@@H](c2ccccc2)N2CCC(O)CC2)c1	744963251	ISZJJNJVQPAHQE-OAQYLSRUSA-N	436.468	1.060	50	20	IDGD	
O=C(COC(=O)[C@H]1SCCc2sccc21)NNC(=O)[C@H]1COc2ccccc2O1	745636810	OCQBVNHYDXZWIJ-PBHICJAKSA-N	434.495	1.609	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)CN[C@H](c2ccccc2)C(F)(F)F)c2ccccc2c1=O	746097131	VQYCKCSYZPHEJA-QGZVFWFLSA-N	433.390	1.588	50	20	IDGD	
COCCS(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=O)c2cccn2C)c1Cl	746103038	GHMZYVSLJDQIHD-UHFFFAOYSA-N	434.301	1.827	50	20	IDGD	
Cc1cc(C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)cc(S(N)(=O)=O)c1C	746201161	UHOYBPFMOVGIAK-UHFFFAOYSA-N	438.531	1.148	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)NCC(=O)NNc2nc(-c3ccccc3)no2)cc1	746242576	XWENPLYRHDWJCQ-UHFFFAOYSA-N	445.457	1.335	50	20	IDGD	
COc1cc(N2C[C@@H](C(=O)NNC(=O)c3ccc(C#N)cc3)CC2=O)cc(OC)c1OC	747176070	IYAQEOTZHFPFKB-HNNXBMFYSA-N	438.440	1.398	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)c1ccc2c(c1)C(=O)N(CCc1ccccc1)C2=O	747320105	RMOKUSUFMUIUAG-UHFFFAOYSA-N	428.448	1.924	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Cc2ccncc2)cc1S(=O)(=O)NC1CCCC1	747323942	UGPMLDZBJWCUBB-UHFFFAOYSA-N	432.502	1.315	50	20	IDGD	
COc1ccc(S(=O)(=O)Nc2ccccc2C(=O)NNC(=O)Cc2ccncc2)cc1	747429190	GMQCKAVGDXSXAA-UHFFFAOYSA-N	440.481	1.895	50	20	IDGD	
C[C@@H](c1ccncc1)N1CCC(NC(=O)NNC(=O)[C@H]2COc3ccccc3O2)CC1	748020464	HPIYAQQYSZUQDM-MGPUTAFESA-N	425.489	1.777	50	20	IDGD	
Cc1cccc(NC(=S)NNC(=O)c2cnc3c(c2C)c(=O)n(C)c(=O)n3C)c1C	748048989	GXSSKHSCIOIIKC-UHFFFAOYSA-N	426.502	1.189	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)Cc3ccc([N+](=O)[O-])cc3)cc2)CC1	748621070	XKFNJIIFRBMFBV-UHFFFAOYSA-N	433.490	1.217	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)NCC3CCN(S(C)(=O)=O)CC3)n[nH]2)cc1	749017606	PYXOMZWEMCQWQK-UHFFFAOYSA-N	434.522	1.001	50	20	IDGD	
CC(C)n1nc(C(=O)NNS(=O)(=O)c2cc(F)cc(C(=O)O)c2)c2ccccc2c1=O	749143536	XRRJKDFSVSYCHO-UHFFFAOYSA-N	448.432	1.438	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N[C@H]2CCN(CCCc3ccccc3)C2=O)cc1OC	750271342	BMSVLDWFPPMXGR-SFHVURJKSA-N	440.500	1.882	50	20	IDGD	
O=C(COC(=O)CC12C[C@H]3C[C@@H](CC(O)(C3)C1)C2)NNC(=O)[C@H]1COc2ccccc2O1	750512608	FMESITFYRNNTKU-HLGIAFBFSA-N	444.484	1.238	50	20	IDGD	
COc1cc(OC)cc(N2C[C@H](C(=O)NNC(=O)c3cc(Cl)ccc3O)CC2=O)c1	752789169	KQTCUINMAHRVSI-LLVKDONJSA-N	433.848	1.877	50	20	IDGD	
COc1ccc(C(=O)NNc2nc3ccccc3c(=O)n2C)cc1S(=O)(=O)NC1CC1	752909777	VTHNJXHZIYKOMB-UHFFFAOYSA-N	443.485	1.140	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)NC[C@@H]2CCN(S(C)(=O)=O)C2)N(C)c2ccccc21	753690047	PGUQCQPDJFWLOB-HNNXBMFYSA-N	445.545	1.055	50	20	IDGD	
CCc1noc(CC)c1CC(=O)NNC(=O)c1cccc(S(=O)(=O)N(CC)CC)c1	755036316	BUVUHYWKZOATNB-UHFFFAOYSA-N	436.534	1.834	50	20	IDGD	
CN(C)CCOc1cccc(NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1	755926085	FWUAOYZBYWKEFO-UHFFFAOYSA-N	427.509	1.486	50	20	IDGD	
O=C(Cc1cccc2ccccc12)NNC(=O)NCCN1C(=O)[C@@H]2[C@@H](C1=O)[C@H]1C=C[C@H]2C1	756096404	PSFKQFQSYMZIIC-USNOLKROSA-N	432.480	1.520	50	20	IDGD	
CN1CCCCC/C1=N\S(=O)(=O)c1cccc(NC(=O)NNC(=O)c2cnn(C)c2)c1	756164038	BJCXGXPFZVGPCW-JJIBRWJFSA-N	447.521	1.480	50	20	IDGD	
COc1ccc(C(=O)N2CCCC2)cc1NC(=O)NNC(=O)[C@H]1COc2ccccc2O1	756262772	RHWUEPXDWDOBSI-LJQANCHMSA-N	440.456	1.924	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)Nc1ccc(S(=O)(=O)NC2CC2)cc1	756775000	GBFUKTHLMXKRDS-UHFFFAOYSA-N	434.474	1.368	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2c[nH]c3ccccc23)cc1	756783242	FXQHITCGWCJMBX-UHFFFAOYSA-N	431.474	1.559	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1)Nc1cccnn1	757661838	SUPBQKVTXZAFCT-UHFFFAOYSA-N	426.458	1.422	50	20	IDGD	
C[C@H]1C[C@@H](NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)CN1Cc1ccccc1	757737610	DZAGIHURDHVPIZ-FXAWDEMLSA-N	437.548	1.686	50	20	IDGD	
CCCc1csc(NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)n1	757924043	URSYBWRPLDZSLA-UHFFFAOYSA-N	425.536	1.877	50	20	IDGD	
Cc1noc(C[C@H](NC(=O)NNC(=O)CNC(=O)c2cccs2)c2ccccc2)n1	758956928	LPJZOZMDPQKVBE-AWEZNQCLSA-N	428.474	1.484	50	20	IDGD	
CO[C@](C)(C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1)c1ccccc1F	759294930	QLQMLOXNJWNJMU-UTKZUKDTSA-N	432.404	1.218	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2cccc(C(=O)NNc3ncccc3[N+](=O)[O-])c2)C[C@@H](C)O1	759300336	BTWUZNHUFURNSP-BETUJISGSA-N	435.462	1.545	50	20	IDGD	
COc1ccc(/C=C(/C#N)C(=O)OCC(=O)Nc2cc(S(N)(=O)=O)ccc2OC)cc1	759859891	DDCYDROXAWBDKS-ZROIWOOFSA-N	445.453	1.440	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)[C@H](C)NS(=O)(=O)c2cccc(C(F)(F)F)c2)nc1	760788472	IQPUUJZWYBDEOM-JTQLQIEISA-N	446.407	1.697	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)C#Cc2ccc3c(c2)OCO3)CC1	762223614	SDLSYNCXZWAIMV-UHFFFAOYSA-N	430.461	1.497	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)N2CCC[C@H](n3cc(C(=O)OC)nn3)C2)c1C	762728534	PLYYHDFACXVDHV-MVDPLZLPSA-N	440.504	1.900	50	20	IDGD	
O=C(NNC(=O)[C@H]1CN2CCCN1CC2)c1nc(-c2ccccc2)n(-c2ccccc2)n1	763270294	ITHUEGVLLXUONP-LJQANCHMSA-N	431.500	1.085	50	20	IDGD	
Cc1c(F)cccc1NC(=O)C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	763532338	VXYGXYLODMOZHI-UHFFFAOYSA-N	427.480	1.432	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(OC(C)C)cc2)cc(OC)c1OC	763539218	KGVYJGZVSGSBAC-UHFFFAOYSA-N	431.445	1.899	50	20	IDGD	
Cc1nccc(-c2cccc(NC(=O)C(=O)NNC(=O)[C@@H]3COc4ccccc4O3)c2)n1	763577782	LOTDRVDYJOOWMT-IBGZPJMESA-N	433.424	1.378	50	20	IDGD	
CCOC(=O)c1cc(CC)sc1NC(=O)C(=O)NNC(=O)COc1ccc(C#N)cc1	763674169	MUBKTPNTFYCIPQ-UHFFFAOYSA-N	444.469	1.524	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(Cl)ccc1C(=O)N(C)C	763716497	HVUZOEILZLYHBM-UHFFFAOYSA-N	446.891	1.769	50	20	IDGD	
CC(=O)N(Cc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(N(C)C)c2)cc1)C(C)C	763760416	NPIDWLWSURACES-UHFFFAOYSA-N	439.516	1.909	50	20	IDGD	
Cc1nc2c3ccccc3nn2c(C)c1CCC(=O)NNC(=O)CNC(=O)c1cccnc1	763818235	DDHHCSAWSDNDNK-UHFFFAOYSA-N	445.483	1.404	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(N3CCOCC3)c(F)c2)cc1	763820435	HIQWABMRAQWJRK-UHFFFAOYSA-N	430.436	1.136	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccn(CCc2ccncc2)n1	763872162	KLWGDNSDMPFETJ-CQSZACIVSA-N	440.435	1.213	50	20	IDGD	
O=C(NNC(=O)c1ccc(Br)s1)C(=O)Nc1cnn(C[C@H]2CCCO2)c1	763940595	KJJKBJNYPPTANE-SNVBAGLBSA-N	442.295	1.286	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)C2=S=C3CC[C@@H](C)CC3=C2)ccc1C(=O)N(C)C	763941942	ZIXVVEBBWBWWKC-GFCCVEGCSA-N	442.541	1.621	50	20	IDGD	
C#CCOc1cc(F)ccc1NC(=O)C(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	763947966	HWEVPZLHLMRKOP-UHFFFAOYSA-N	437.387	1.129	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)C(=O)Nc2cnn(-c3ncccc3C#N)c2)c2ccccc21	763982033	WPIWXEGQPDMPOX-UHFFFAOYSA-N	428.412	1.030	50	20	IDGD	
CN(C)c1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	764086429	UAFGFPTZCODPCL-UHFFFAOYSA-N	438.893	1.209	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)nc1)C(=O)Nc1ccccc1I	764093595	VZKARLMSTAYHGJ-UHFFFAOYSA-N	444.616	1.739	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2O1)C(=O)Nc1cccc(OCc2cccnc2)c1	764155301	XWNLMRKVJWGFOD-HXUWFJFHSA-N	432.436	1.750	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2O1)C(=O)Nc1ccc2c(c1)nc1n2CCCCC1	764168527	QJXILIUJOKFJOD-LJQANCHMSA-N	433.468	1.852	50	20	IDGD	
O=C(CCc1ccco1)NNC(=O)C(=O)Nc1cccc(F)c1I	764177326	NIEHXUCRJLTBBB-UHFFFAOYSA-N	445.188	1.742	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(-c3noc(C(F)F)n3)cc2)cc1	764183413	XYFWONZDSLJQGZ-UHFFFAOYSA-N	426.339	1.946	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)CCCc2ccccc2)c(=O)n(-c2ccccc2)n1C	764223740	KXLISQJQCAWKSU-UHFFFAOYSA-N	435.484	1.593	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)c(OCCN(C)C)c1	764239042	BNHQCCXZETZSQF-UHFFFAOYSA-N	437.500	1.676	50	20	IDGD	
Cc1cnc(O)n1-c1ccccc1NC(=O)C(=O)NNC(=O)c1cccc2ncccc12	764257526	KKXUAXSVHKASFD-UHFFFAOYSA-N	430.424	1.834	50	20	IDGD	
Cc1nc2ccc(NC(=O)C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)cc2s1	764258879	CAFLRSLCNVNGCK-UHFFFAOYSA-N	439.501	1.397	50	20	IDGD	
CC(=O)Nc1cc(NC(=O)C(=O)NNC(=O)c2cc(Br)ccc2O)ccc1C	764280439	PFUOJMXPXYJCBR-UHFFFAOYSA-N	449.261	1.821	50	20	IDGD	
C[C@H](c1ccc(NC(=O)C(=O)NNC(=O)CCc2ccccc2O)cc1)N1CCOCC1	764289250	QDSSFDFQLJFCMF-MRXNPFEDSA-N	440.500	1.504	50	20	IDGD	
CC(C)(C(=O)NNC(=O)C(=O)Nc1ccc(F)cc1CS(C)(=O)=O)c1ccccc1	764308807	GHTBECMDSIUWNT-UHFFFAOYSA-N	435.477	1.434	50	20	IDGD	
CNC(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)c1	764378228	WGTWAXYZYMSJER-UHFFFAOYSA-N	446.876	1.551	50	20	IDGD	
CCCNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)c1	764392980	BGFHVCHIYOVRQB-UHFFFAOYSA-N	430.486	1.410	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)CCC(=O)N1CCN(c2ccccn2)CC1	764564400	SDABKKFYYOFLDJ-MRXNPFEDSA-N	443.479	1.264	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ccncc2)cc(Br)c1F	764664266	UJBGKZBESDAVRK-UHFFFAOYSA-N	439.197	1.170	50	20	IDGD	
Cc1ccc(CN2C(=O)CC[C@H]2C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)cc1	765312822	CBUIUISCZVCJAN-KRWDZBQOSA-N	432.521	1.938	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3cnn(-c4ccccc4)n3)n[nH]2)cc1OC	765601882	UWUGNWAMBWVNSR-UHFFFAOYSA-N	433.428	1.749	50	20	IDGD	
COC(=O)c1nccc2c(S(=O)(=O)NNC(=O)c3ccc4c(c3)OCO4)cccc12	766308426	QTRXCUWSEBAPSY-UHFFFAOYSA-N	429.410	1.373	50	20	IDGD	
COc1nc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cc2ccccc12	766641581	HMOYJMWEDDBCFF-UHFFFAOYSA-N	447.495	1.462	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(-n3cnc4ccccc43)nc2)c1	768316266	BUSUOQMIHUVJTM-UHFFFAOYSA-N	435.465	1.899	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(O)c(C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)c1	768364099	FHIYNCYTJRKXDK-UHFFFAOYSA-N	435.487	1.169	50	20	IDGD	
CC(C)[C@H](NC(=O)OC(C)(C)C)C(=O)NCC(=O)NNc1ccccc1S(C)(=O)=O	768402545	LMFMTPJTELOHFV-INIZCTEOSA-N	442.538	1.199	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)NC2CCCC2)c(NS(=O)(=O)C(F)F)c1	769624819	LDRKBMHHVXZJMB-UHFFFAOYSA-N	442.466	1.095	50	20	IDGD	
C[C@@H](CN1CCOCC1)C(=O)NNC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1	769684680	LOEIKUDOMZPLBS-KRWDZBQOSA-N	434.500	1.664	50	20	IDGD	
COc1cccc([C@@H](CNC(=O)NNc2nc(O)c3cnn(C)c3n2)N2CCCC2)c1	770343619	NBBNVEYNEDKGHZ-MRXNPFEDSA-N	426.481	1.541	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)NC3CCN([C@H]4CCC[C@H]4O)CC3)nc21	770413667	USTIMTUBKMKNTP-LSDHHAIUSA-N	432.529	1.291	50	20	IDGD	
Cc1oncc1C(=O)Nc1ccc(O)c(C(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1	770467307	YYQIEPSQPMKQIO-GOSISDBHSA-N	438.396	1.542	50	20	IDGD	
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNc1nc(O)c2cnn(C)c2n1	770975315	URCMHESKNFIFCK-INIZCTEOSA-N	436.476	1.377	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1cccc(C(F)(F)F)c1)C(=O)NNc1ncccc1[N+](=O)[O-]	771029852	CAKOWZJAMHNHGN-SECBINFHSA-N	433.368	1.819	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)Cc1cc(Br)ccc1F	771270293	UAMJZPSHEHMDMT-UHFFFAOYSA-N	433.278	1.986	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)[C@H]1CCCN(C(=O)c2ccccc2)C1	772182401	JYEKHJMWJYVLCK-KRWDZBQOSA-N	442.903	1.656	50	20	IDGD	
CNC(=O)COc1cccc(CC(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)c1	772352590	LADRRVRGVGCYLF-UHFFFAOYSA-N	433.848	1.012	50	20	IDGD	
Cc1cc2ccccc2nc1NNC(=O)C(=O)Nc1cnn(Cc2nnc3n2CCCC3)c1	773711023	QIQIQFODABXLBD-UHFFFAOYSA-N	445.487	1.798	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2ccc(C)c(S(=O)(=O)N3CCCCC3)c2)n1	773732222	YFTDLJQGNVZBJX-UHFFFAOYSA-N	448.505	1.050	50	20	IDGD	
CCN(CC)C(=O)COc1cccc(NC(=O)C(=O)NNc2nccnc2C(C)C)c1	773991388	GSRUONRWFMTFSY-UHFFFAOYSA-N	428.493	1.929	50	20	IDGD	
COC(=O)c1cc(OC)ccc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1cccc(Cl)c1	774009019	NVDIEDWRCDLMER-NSHDSACASA-N	449.847	1.689	50	20	IDGD	
O=C(NCc1cnn(-c2ccc(Br)cc2)c1)NNC(=O)C(=O)N1CCCC1	775205845	JQMXUAQRSPWXIC-UHFFFAOYSA-N	435.282	1.088	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNS(=O)(=O)c2cnn(CC(F)(F)F)c2)cc1	775252345	VZIMCHZTLOGQQU-NSHDSACASA-N	436.412	1.621	50	20	IDGD	
CN(NC(=O)c1cc(-c2ccncc2)on1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776200887	CEHFSUFIVKMGDD-UHFFFAOYSA-N	430.465	1.986	50	20	IDGD	
COC(=O)C1(CNC(=O)NNC(=O)[C@H]2Cc3ccccc3CN2Cc2ccccc2)CC1	776865391	FRPYHFAMQNWRSJ-HXUWFJFHSA-N	436.512	1.897	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)[C@]2(F)CCN(C(=O)OCc3ccccc3)C2)c1O	776972181	KVRHPDSMMFNLAI-NRFANRHFSA-N	431.420	1.913	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)c2ccc(S(=O)(=O)NC(C)(C)C)cc2)nc1C	778422495	PMFGEPXUIUCLFU-UHFFFAOYSA-N	435.506	1.795	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)c1csc(I)c1	778440504	HUQCWHSJKMDFIG-UHFFFAOYSA-N	425.248	1.638	50	20	IDGD	
C[C@@H]1C(=O)CC[C@@H](C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)C1(C)C	780171134	IBPYOWAXRDJKHI-PBHICJAKSA-N	435.546	1.874	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccccc1S(=O)(=O)NC1CC1)c1cccc2ncccc12	780386113	CHTYOMIWLQVDGO-UHFFFAOYSA-N	446.510	1.299	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN(C)Cc2ccc(N3CCOCC3)cc2)cc1OC	781983662	RUXGFUIZWRJIJS-UHFFFAOYSA-N	442.516	1.433	50	20	IDGD	
Cc1cc(Br)c(NC(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)cc1Cl	782070433	AEVBYVULRJFKEB-SSDOTTSWSA-N	427.708	1.501	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2cc(OC)c(OC)cc2Br)nc1	782145165	FZHFMVFNXSBKFL-UHFFFAOYSA-N	425.239	1.952	50	20	IDGD	
CS(=O)(=O)NCc1ccc(NC(=O)C(=O)NNc2ccc(Cl)cc2[N+](=O)[O-])cc1	783289120	GASPHVWGSOEXGD-UHFFFAOYSA-N	441.853	1.379	50	20	IDGD	
Cc1csc(Sc2ccc(NC(=O)C(=O)NN[C@@]3(C)CCS(=O)(=O)C3)cc2)n1	783428514	WUTMPHQZDKQZLL-KRWDZBQOSA-N	440.572	1.739	50	20	IDGD	
CCC(C)(C)OCc1ccccc1NC(=O)C(=O)NNC(=O)CNC(=O)c1ccco1	784005064	YRFLGCIODGQAQA-UHFFFAOYSA-N	430.461	1.501	50	20	IDGD	
Cc1c(NNC(=O)C(=O)Nc2ccc3oc(=O)n(CCN(C)C)c3c2)cccc1[N+](=O)[O-]	784352036	IMKMYNCEPGEBPY-UHFFFAOYSA-N	442.432	1.455	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNc2cccc([N+](=O)[O-])c2C)c(OC)c(OC)c1	784357579	DLKQRZVOUWORHG-UHFFFAOYSA-N	432.389	1.789	50	20	IDGD	
CCNC(=O)COc1cccc(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2Cl)c1	784383820	DTOVTDHYFPVLLQ-UHFFFAOYSA-N	435.824	1.845	50	20	IDGD	
CO[C@H](C)C(=O)Nc1cccc(NC(=O)C(=O)NNc2ccc(Br)nc2)c1	784812416	ODGSZKQOWOKELH-SNVBAGLBSA-N	436.266	1.899	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)cc1[N+](=O)[O-]	784836077	OTASLTRVNPEBQJ-UHFFFAOYSA-N	428.373	1.981	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)[C@H](c1ccccc1)N1CCC(O)CC1	785019469	JBRCZDAOSCYLOV-QHCPKHFHSA-N	435.528	1.944	50	20	IDGD	
NC(=O)CNC(=O)c1cccc(NC(=O)C(=O)NNc2cc(C(F)(F)F)ccc2F)c1	785167244	RIIBOIPJYWTOMU-UHFFFAOYSA-N	441.341	1.141	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2ccc(C)c(NS(C)(=O)=O)c2)n1	785226432	UKVZZIDTTLUQCF-UHFFFAOYSA-N	435.510	1.085	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)N[C@@H]2CCCN(C3CCCCC3)C2=O)c2ccccc2c1=O	785920211	ATCJQNWYRUUCIP-QGZVFWFLSA-N	440.504	1.201	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCCC[C@@H]2C)cc1C(=O)NNC(=O)N1CCN(C)CC1	788165879	KRQKMSVNUHBXJN-INIZCTEOSA-N	437.566	1.160	50	20	IDGD	
O=C(NNc1nnc(-c2ccccn2)s1)c1ccccc1S(=O)(=O)N1CCOCC1	788556358	JNSGEXLUNYHQCT-UHFFFAOYSA-N	446.514	1.378	50	20	IDGD	
CCOC(=O)C1(CC(=O)NNC(=O)c2ccc(CSc3nncn3C)cc2)CCC1	789138978	XDYNWFAEPDXHJC-UHFFFAOYSA-N	431.518	1.992	50	20	IDGD	
CC(C)n1ncc2cc(NC(=O)C(=O)NNC(=O)[C@H]3OCC[C@H]3c3ccccc3)cnc21	789809964	IRPJCVHNUZCZFE-ROUUACIJSA-N	436.472	1.671	50	20	IDGD	
O=C(NNC(=O)N1CCC(Oc2ccc(F)nc2)CC1)C1CCN(c2ncccn2)CC1	791019464	KDNVJIUHFUNFDO-UHFFFAOYSA-N	443.483	1.511	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(CCC(=O)NNC(=O)c2cccc3ncccc23)CC1	792146454	AEVBWZPYPFRGDT-UHFFFAOYSA-N	427.505	1.939	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2scnc2C)cc(N2CCN(C(C)C)CC2)c1	792268914	PIICHCPWJNTWJE-UHFFFAOYSA-N	444.561	1.690	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)cccc1NC(=O)N(C)C	792356085	ZSMUMTIVPZZQDN-UHFFFAOYSA-N	431.424	1.393	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNC(=O)NC1CCN(C(=O)c2ccoc2)CC1	792806712	VGHNWMDUDQCISF-UHFFFAOYSA-N	443.460	1.141	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCC3)c(OC)c(C)c1OC	796989917	LSJLVFLZVKMHLD-UHFFFAOYSA-N	433.486	1.971	50	20	IDGD	
CC(C)Oc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)cc1C(N)=O	796990373	RJUZLHMANKNEGR-GFCCVEGCSA-N	446.435	1.265	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cccc(C)n2)ccc1C	797370101	UKCIAFOYAKBXJZ-UHFFFAOYSA-N	447.517	1.129	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2ccn(-c3cccc(C#N)c3)n2)cc1OC	798796785	FGTLQTWEAWBYOK-UHFFFAOYSA-N	449.423	1.379	50	20	IDGD	
COC(=O)c1cccc(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)c1OC(C)C	799259169	PXRWUXJXRUMWSS-KRWDZBQOSA-N	441.440	1.350	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)CN2C(=O)N[C@]3(C[C@@H](C)CC(C)(C)C3)C2=O)cc1	802058678	LJWYJJOVDHYPBV-ZSEKCTLFSA-N	431.493	1.985	50	20	IDGD	
COc1ccc(Cl)c(NC(=O)NNC(=O)CSc2nnnn2CC(F)(F)F)c1	802111975	VCERXAMPDMDUEO-UHFFFAOYSA-N	439.807	1.842	50	20	IDGD	
CSSCCNC(=O)CCC(=O)N1CCN(S(=O)(=O)c2ccc(F)cc2)CC1	803472262	XRGHQECRLYBVSG-UHFFFAOYSA-N	449.595	1.566	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)C(=O)Nc1nc(C2CC2)cs1	806973897	NNGMGOHIAJVXNS-UHFFFAOYSA-N	439.291	1.948	50	20	IDGD	
COC(=O)CCNC(=O)c1ccc(NC(=O)C(=O)NNc2nccnc2C2CCC2)cc1	807462704	NPADCWRLZSLWAR-UHFFFAOYSA-N	440.460	1.119	50	20	IDGD	
C#CC[C@@]1(C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)CCCN1C(=O)OC(C)(C)C	809605468	JTLLNMHCSGNMLI-NRFANRHFSA-N	449.529	1.644	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2ccc3c(c2)CCCCC3=O)cc1	809983172	CLZCIFUEMPGQKV-UHFFFAOYSA-N	443.525	1.986	50	20	IDGD	
COc1ccc(S(=O)(=O)NCC(=O)NNc2ncccc2C(F)(F)F)cc1OC	810427046	ZNOYRCUFJVJJEL-UHFFFAOYSA-N	434.396	1.539	50	20	IDGD	
COc1ccc([C@H](O)C2CCN(C(=O)NNC(=O)CNC(=O)c3ccco3)CC2)cc1	812881837	DJAWWYHXWHMYBR-IBGZPJMESA-N	430.461	1.204	50	20	IDGD	
C[C@H](C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1)[C@H]1OCCc2sccc21	814222700	RRRXSBPOCDDVKH-BJOHPYRUSA-N	443.934	1.760	50	20	IDGD	
COC(=O)c1ccc(C=NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)n1C	814879541	WDMFYPKSUAKFMC-UHFFFAOYSA-N	431.924	1.733	50	20	IDGD	
O=C(NNc1ncncc1F)C(=O)Nc1ccc(CC(=O)N2CCc3ccccc32)cc1	815766316	VSUFLVJJPFEYOP-UHFFFAOYSA-N	434.431	1.829	50	20	IDGD	
C[C@@H](CC(=O)NNC(=O)[C@H]1CCCN(C(=O)OC(C)(C)C)C1)NC(=O)c1ccccc1	816510429	VZEKNNHOABADAU-RDJZCZTQSA-N	432.521	1.990	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)C[C@@H](c1ccccc1)c1ncc[nH]1	816828846	RPQVQEGGORYZSY-INIZCTEOSA-N	440.529	1.994	50	20	IDGD	
CCOc1ccc(-n2c(C)cc(/C=C(/C#N)C(=O)NCC(=O)NCC(=O)OC)c2C)cc1	819577947	VRONKUGJRZLCBP-WQRHYEAKSA-N	438.484	1.805	50	20	IDGD	
O=C(Cc1cccc2ccccc12)NCC(=O)OCC(=O)NNC(=O)c1cccs1	849197849	AFKMDACDLPPJHC-UHFFFAOYSA-N	425.466	1.564	50	20	IDGD	
O=C(COC(=O)[C@H](NC(=O)c1ccco1)c1ccccc1)NNC(=O)c1cccs1	905575362	AKAIORFASLKVMT-QGZVFWFLSA-N	427.438	1.817	50	20	IDGD	
COc1ccc2c(c1)C[C@H](C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1)CO2	914781749	NWCWKAGXAOXISU-LBPRGKRZSA-N	439.877	1.008	50	20	IDGD	
CS(=O)(=O)NCCCNC(=O)C(=O)Nc1ccccc1S[C@H](Cl)C(F)(F)F	915775396	IFQZOXRIPHACAE-ZDUSSCGKSA-N	447.888	1.900	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)NCCN1CCN(Cc2ccccc2)CC1	915901504	IUCRIMQAAQEAML-UHFFFAOYSA-N	441.532	1.222	50	20	IDGD	
CCC(CC)[C@H](CNC(=O)NNC(=O)c1nn(-c2ccccc2)cc1O)N1CCOCC1	916256338	SKMFJXHIAMDSRR-SFHVURJKSA-N	444.536	1.659	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)CCCNC(=O)OCc2ccccc2)c1	917108589	MMZSXMFGKUAKRQ-UHFFFAOYSA-N	433.486	1.558	50	20	IDGD	
COc1ccc([C@@]2(C)NC(=O)N(CC(=O)NNC(=O)c3ccc(Cl)cc3O)C2=O)cc1	918357707	LTTFKSZNLGDMRP-HXUWFJFHSA-N	446.847	1.282	50	20	IDGD	
CCCCCCn1nc(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)c2ccccc2c1=O	919883091	ASCVCFQXEYBUKA-CQSZACIVSA-N	449.533	1.108	50	20	IDGD	
Cc1cccc(-n2ccnc2SCC(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)c1C	919885179	NGJLPQBKAFTNSO-AWEZNQCLSA-N	437.547	1.099	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)N[C@@H]2CCCN(S(C)(=O)=O)C2)c(C)n1C[C@H]1CCCO1	920292075	LPSDMOATFQKZJO-LDWJFSKOSA-N	434.562	1.731	50	20	IDGD	
COc1ccc(-c2nn(CCC#N)cc2/C=C(\C#N)C(=O)NCCNC(C)=O)cc1OC	920428138	XXYFRJOCOHQSQH-GZTJUZNOSA-N	436.472	1.640	50	20	IDGD	
Cc1nnnn1[C@@H](Cc1ccc(F)cc1)C(=O)NNC(=O)c1cncn1-c1ccccc1	1317876071	ZLTNBQWWESXVQL-SFHVURJKSA-N	434.435	1.551	50	20	IDGD	
O=C(NCCCn1nc2n(c1=O)CCCC2)NNC(=O)c1ccc(Br)cc1	1319053329	KEWCGWDKPRRPCJ-UHFFFAOYSA-N	437.298	1.178	50	20	IDGD	
COc1cccc(C[C@@H](O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(Br)c2)c1	1320740178	RGXKZEKKWRQIGW-SJKOYZFVSA-N	437.290	1.976	50	20	IDGD	
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)NNC(=O)c1ccc(Br)cc1	1323441714	MYLHJLSQOQXHLP-UHFFFAOYSA-N	430.236	1.989	50	20	IDGD	
COc1ccc(C(=O)NN=C(C)c2cccc(N(S(C)(=O)=O)S(C)(=O)=O)c2)cc1	1338637822	RPPKKZIFVPFHGL-UHFFFAOYSA-N	439.515	1.575	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNS(=O)(=O)c2ccc3c(c2)CC(=O)N3)CC1	1339205058	QJRPUEDENYOTHE-UHFFFAOYSA-N	438.506	1.138	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2)c1nnsc1C1CC1	1778287954	AAQIVKWHYYZPHQ-VEVIJQCQSA-N	428.942	1.143	50	20	IDGD	
C=CCNC(=O)/C=C\C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CO[Si](C)(C)C)C1	1779538706	FKRYSWXCLWNRNI-UXTXJKSZSA-N	437.613	1.210	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(-c4ccccn4)[nH]n3)C2)C1	1779632268	YOMSJYWTQWTFIO-VLIAUNLRSA-N	433.896	1.169	50	20	IDGD	
COc1cc(C#N)cc(C(=O)N2CC[C@]3(CN(C(=O)CCBr)CCO3)C2)c1	1780167791	GOIGOXATWXBYLN-IBGZPJMESA-N	436.306	1.795	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)[C@H]3C[C@@]34C(=O)Nc3ccccc34)CCO2)C1	1781221357	CPVGQUXIEFBXCQ-AJAKECSLSA-N	431.920	1.744	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)c3ccn(C(F)F)n3)CCO2)C1	1781230762	ZPAUXTCCWPRXGZ-HOTGVXAUSA-N	425.263	1.958	50	20	IDGD	
O=C(c1cn2ccccc2n1)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781329872	MFPPPIADSXFLNU-WMLDXEAASA-N	425.258	1.468	50	20	IDGD	
O=C(c1cc2n(n1)CCCC2)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781331278	HTODIWKGCGMOBL-RHSMWYFYSA-N	429.290	1.353	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)Cc1ccccc1)C2	1782178591	BHUFFJOITROGKJ-JZJXAQOMSA-N	438.952	1.358	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cnc(N(C)C)o3)CCO2)C1	1783342465	ADXSCEDBAUSCBV-SJCJKPOMSA-N	429.315	1.358	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)CS[C@H]3CCCCO3)CCO2)C1	1783534664	XUUGASZSBPRNDG-QRTARXTBSA-N	435.384	1.860	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cc4ccc(OC)cc4[nH]3)CCO2)C1	1783875190	OSEYRCGUZXUQRE-HRAATJIYSA-N	435.908	1.874	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(-c4ccccc4)nc3)C[C@@H]21)[C@@H](O)CCl	1784091438	UIBIRDIDDJSKNS-QIJZPMMNSA-N	443.931	1.942	50	20	IDGD	
C[Si](C)(C)C#CCCCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]2C1	1784092550	MROVGCWSDJFOOK-XSLAGTTESA-N	429.033	1.617	50	20	IDGD	
CCC(=O)N[C@@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](Br)CC)C[C@@H]21	1784369272	BQISKJLZZKKMBE-LXFSFDBISA-N	432.359	1.054	50	20	IDGD	
C/C(=C/C(=O)N1CC[C@]2(C1)CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)CCO2)C(=O)O	1785416719	HNUOCBNPMOZQDZ-VRSIDFBBSA-N	445.422	1.733	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)/C=C/c3ccccc3[N+](=O)[O-])C2)C1	1785551358	UULKVMMGUVKDPU-BGJVTSJYSA-N	437.880	1.692	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(C(F)F)no3)C[C@@H]21	1786406028	MNAGIAKJYBDJKE-KWBADKCTSA-N	436.253	1.991	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCN3CCN(C)CC3)[C@H]2C1	1786725949	NKOMOCFAHSXYHU-OKYOBFRVSA-N	429.005	1.011	50	20	IDGD	
Cn1c(=O)c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]3C2)nc2ccccc21	1787446702	AFQMBTWOZPZVJJ-HJXMPXNTSA-N	436.871	1.061	50	20	IDGD	
Cc1ccn(CC(=O)NC2(c3ccc(NC(=O)c4cccc(B(O)O)c4)cc3)CCC2)n1	1788144954	HPIQBFWOEDZMIN-UHFFFAOYSA-N	432.289	1.319	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C=N/O[C@H]3CCCCO3)[C@H]2C1	1788660902	RFRNXNMYFLKKCB-KMUFLGAISA-N	446.342	1.279	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3n[nH]c4c(C)cccc34)[C@H]2C1	1790480106	VMSSFUZCEPPOFV-LLLHUVSDSA-N	434.924	1.718	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4c(c3)NC(=O)CC4)[C@H]2C1	1790503935	GLRVOJNOWMCMDJ-BMFAXAFESA-N	449.935	1.418	50	20	IDGD	
O=C(COc1ccccc1F)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21	1790967340	QKNOHZCGXMLKQI-WXRXAMBDSA-N	447.276	1.875	50	20	IDGD	
COC(=O)C12CC(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)CO[Si](C)(C)C)C[C@@H]43)(C1)C2	1791017407	UNENYFFQJVLACB-VICSCYKQSA-N	438.597	1.161	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21	1791061000	NXSOYCIZHSURPZ-ORMBPQIASA-N	430.112	1.440	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cccnc3Cl)C[C@@H]21	1791252214	DPVPZGQPPKPYSL-VGWMRTNUSA-N	430.332	1.511	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1ccc(C2(NC(=O)c3cc4n(n3)CCNC4=O)CCC2)cc1	1791563516	YFPUQXBEVFLJND-OAHLLOKOSA-N	445.907	1.628	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(O)c([N+](=O)[O-])c1)C2	1793451891	KZJOBIJVDSGXSZ-LOUJCGABSA-N	425.869	1.911	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCc1ccco1	1794402387	FXPISXREDRCDBT-GSWMANSFSA-N	425.489	1.984	50	20	IDGD	
C[C@@H](Sc1ccccn1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1	1796190537	JSIUFUUAQRXRJC-DQEVTTJGSA-N	439.346	1.194	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CCC[C@H]1C	1797292335	CNVLIGOFBOJARH-VOCBBQRYSA-N	429.521	1.146	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc2ncccc12)c1ccc(B(O)O)cc1	1797317919	JINMCFSUZGLKKZ-REPLKXPHSA-N	429.285	1.480	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CCc3ccccc3[C@H]1O)C2	1797953980	ZOHMIWNSPQBWJE-OYPHABEOSA-N	446.620	1.724	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2cccnn2n1	1799103616	ZIUKLMJPTAAUMO-MVRRYPJTSA-N	448.487	1.115	50	20	IDGD	
Cc1cncc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Br)c1	1799344680	QOAFXGLCZYGRJU-YALNPMBYSA-N	428.302	1.603	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1n[nH]c3c1CCCC3)C2)[C@@H](F)Br	1799346145	FOQLQAFLUVQAFW-YJKIEOBBSA-N	429.290	1.182	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2)c1ccc(Br)cc1O	1799475772	MSOJRPGYCRXYDM-HZZFPTLFSA-N	435.677	1.892	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)Br)cc1	1800763510	CFASAWDMSAZFHJ-RMIITELYSA-N	438.322	1.632	50	20	IDGD	
COC(=O)C12CCC(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)C(Cl)Cl)(CC1)CC2	1801014772	FPXNTOXSDFQXIA-XUWXVTPTSA-N	447.359	1.893	50	20	IDGD	
Cc1cc(C)n2ncc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)C(Cl)Cl)c2n1	1801014903	SIYCKYOWBCAXPK-DABQJJPHSA-N	426.304	1.353	50	20	IDGD	
COc1ccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCBr)C3)cc1F	1801499771	CTQULBMYSJXAGR-HBCWATKFSA-N	443.313	1.751	50	20	IDGD	
CCOc1ncccc1C(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1	1802314115	PZUMVGNVOIYIRO-RYQLBKOJSA-N	432.908	1.795	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc3c(c2)OCO3)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803138727	DWFSKTGYCZJHNN-TXPKVOOTSA-N	431.876	1.730	50	20	IDGD	
CC(C)[C@H](S)C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1803598103	JOYYVXUWGCDYGD-IHPCNDPISA-N	441.362	1.035	50	20	IDGD	
C[C@H](CC(N)=O)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@H]1c1cccnc1	1803672646	ZEBZGHOZGALKIX-UEEZHKSASA-N	429.290	1.289	50	20	IDGD	
O=C1Nc2ccccc2/C1=C/C(=O)N1CCC2(CCCN(C(=O)[C@@H](O)CCl)C2)CC1	1805522360	HBBMZDUUXVAKSK-XOQYZJNISA-N	431.920	1.853	50	20	IDGD	
O=C(CCBr)NC[C@H]1CCN(C(=O)CCn2cncn2)[C@@H]1c1cccnc1	1806346268	DXMYQQHLYAVULL-CRAIPNDOSA-N	435.326	1.554	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)C2CC(F)(F)C2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1	1807364535	JBBJYWAKURQXOB-LPHOPBHVSA-N	443.259	1.126	50	20	IDGD	
Cc1occc1C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1807369721	SPMDKWVFNAPJNU-WIYYLYMNSA-N	433.273	1.296	50	20	IDGD	
Cc1ncccc1C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1807369950	ZJNSGZAVHKJZAU-UGKGYDQZSA-N	444.300	1.098	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC2(CCCN(C(=O)c3cncc(N(C)C)c3)C2)CC1	1807432332	CMMYEYBEMHYBQW-UHFFFAOYSA-N	444.580	1.365	50	20	IDGD	
COCCOCC(=O)N1CC[C@H](CNC(=O)[C@@](C)(Cl)CCl)[C@@H]1c1cccnc1	1808295875	MWUSTTNQHWIGEY-AYBZRNKSSA-N	432.348	1.987	50	20	IDGD	
C[C@H](Cn1cncn1)C(=O)NC[C@@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1	1810474620	DVBLILLJMFWZKS-HFTRVMKXSA-N	449.353	1.800	50	20	IDGD	
COC(=O)C1(C(=O)N2CC[C@H](CNC(=O)[C@H](C)Br)[C@@H]2c2cccnc2)CC1	1812868282	XEGPRJNNBWQJLM-CFVMTHIKSA-N	438.322	1.824	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)[C@H]2CCCS2)[C@@H]1c1cccnc1	1813074454	RVHNFGGKDVBLAO-SQGPQFPESA-N	433.578	1.356	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)CNC(=O)C(F)(F)F)[C@@H]1c1cccnc1	1813099822	IWPBAKVLYYJNIL-IPYPFGDCSA-N	434.846	1.783	50	20	IDGD	
CCOC(=O)N[C@H](O)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)C(C)(C)CCl)n[nH]1	1814697095	LYEBVKVNKPWIAY-TZMCWYRMSA-N	429.905	1.731	50	20	IDGD	
C[C@@H](CBr)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2c[nH]c(=O)cn2)[nH]n1	1814782297	QRUQNESCJOMMES-GXFFZTMASA-N	437.298	1.830	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cncn2-c2ccncc2)[nH]n1)[C@@H](O)CCl	1814869218	LVUWRZZBYQHMMA-RDJZCZTQSA-N	443.895	1.896	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@H]2ON=C(c3ccccc3)O2)[nH]n1)[C@@H](O)CCl	1814872205	FNBFTFZQGSMRRH-AUSJPIAWSA-N	447.879	1.736	50	20	IDGD	
Cc1cscc1C(=O)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1	1815354830	SNVRPAKVOGNOAW-CQSZACIVSA-N	441.343	1.732	50	20	IDGD	
Cc1nnc(CCC(=O)Nc2cc([C@@H]3CCCCN3C(=O)[C@H](O)CCl)[nH]n2)s1	1815913157	NMVGFXRVBPJHAY-QWHCGFSZSA-N	426.930	1.794	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CN2CCCC2=O)n[nH]1	1817161769	PJIUOTJAXSWVPB-AAEUAGOBSA-N	426.315	1.808	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)C2CCSCC2)[nH]n1)c1ccc(B(O)O)cc1	1817475488	OTVKJZRRWXYTRH-GOSISDBHSA-N	442.350	1.539	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(Cl)o3)sc2C1	1817924072	HQWDHNLEVAUNCC-JTQLQIEISA-N	439.925	1.988	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccn3c(O)nnc23)n[nH]1	1817967845	ANRWPHBOSQAKJR-GXTWGEPZSA-N	447.883	1.718	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@H](O)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](F)Cl)n[nH]1	1818035554	NUZLVZNERVIFJO-DYEKYZERSA-N	447.895	1.822	50	20	IDGD	
CC1=CC[C@H](C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2ccc(B(O)O)cc2)CC3)CC1	1818623116	YCSYAFKUMJVIKO-WMLDXEAASA-N	439.346	1.795	50	20	IDGD	
CC(C)O[C@@H](C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1819507236	MDUGRKRQXLGUFG-GUYCJALGSA-N	443.508	1.528	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)CCc3nc(N)n[nH]3)sc2C1	1819561987	VAXWRNUYCNLWBQ-JGVFFNPUSA-N	442.343	1.172	50	20	IDGD	
CC[C@H](C)CC(=O)N[C@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1	1819792974	FPJFODJHTBKSIF-RYUDHWBXSA-N	430.534	1.804	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](C)Cn3cncn3)sc2C1	1820078498	MSHCIFQROSSFTM-UTUOFQBUSA-N	426.930	1.237	50	20	IDGD	
O=C(COc1cc(Cl)ccn1)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](O)CCl)CC2	1820080515	RTJGAJNKBNRFLE-JQWIXIFHSA-N	445.328	1.782	50	20	IDGD	
CN1CCN(C2(C(=O)Nc3cc([C@@H]4CCCCN4C(=O)[C@@H](F)Cl)[nH]n3)CC2)CC1	1820794613	CEGTWEHFUSOSIY-GOEBONIOSA-N	426.924	1.716	50	20	IDGD	
C[C@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)c3c[nH]c(=O)cn3)sc2C1	1821474682	VEMOSNRAQHPEHM-YUMQZZPRSA-N	426.296	1.236	50	20	IDGD	
C[C@@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1)n1cccc1	1822416975	UONYMPSELNIJEF-DOTOQJQBSA-N	429.525	1.838	50	20	IDGD	
O=C(CN1C(=O)CSC1=S)N1CCC([C@H]2CCCCN2C(=O)[C@@H](O)CCl)CC1	1824186708	AVVQSZUHUFIUFJ-KGLIPLIRSA-N	448.010	1.066	50	20	IDGD	
Cc1ncc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)[nH]1	1824704416	DJHUDLFYPXPHAQ-IBGZPJMESA-N	439.520	1.264	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCc1cccnc1)CC2	1826085231	KOZRBPXCAHYMEJ-HNNXBMFYSA-N	444.561	1.456	50	20	IDGD	
N#Cc1ccc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)cc1	1827052577	PLHNUJLIPDSWHU-QHCPKHFHSA-N	445.328	1.785	50	20	IDGD	
CC1=C(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CCO1	1827281242	MKYRNNCQTXPVLU-NRFANRHFSA-N	426.322	1.294	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3CC[C@H](O)CC3)C2)C1	1830544041	LQNIMXJGTQNXNA-YKTARERQSA-N	447.370	1.025	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)ccc2O)CC1	1830765889	QJBWGKMKUKMUBQ-LJQANCHMSA-N	446.548	1.704	50	20	IDGD	
O=C(CCBr)N1CCC([C@@H]2CCCCN2C(=O)Cn2ccncc2=O)CC1	1831104047	NHBCELIESCHRFI-INIZCTEOSA-N	439.354	1.648	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc4ncccn34)C2)C1	1831647815	YRPIDEZLVILKSD-YWZLYKJASA-N	435.912	1.207	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@H](COC)NC(C)=O)CC1	1831830352	AGEBFULAEVTKSL-BZSNNMDCSA-N	431.961	1.011	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)/C=C/c3cccnc3)CC2)CC1	1833858873	VIKSATRIGVAWBE-SGSXCFNPSA-N	434.968	1.920	50	20	IDGD	
Cc1[nH]nc(C(=O)N2CCC(N3CCC(NC(=O)CCBr)CC3)CC2)c1F	1834421191	PDKXCAZCNXSFAJ-UHFFFAOYSA-N	444.349	1.827	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC1CCN(C2CCN(C(=O)Cn3ccccc3=O)CC2)CC1	1835833496	KDFYMBVVCMZKLC-UHFFFAOYSA-N	448.640	1.271	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)c1ccn(C(F)F)n1	1835951038	LNFFYABSEOWBOW-OAHLLOKOSA-N	433.887	1.063	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)/C=C/c3cccs3)CCO2)C1	1835968400	IIEKEFUHYROODZ-BSCWQEJHSA-N	428.938	1.472	50	20	IDGD	
CCn1nc(C(=O)N2CCC(OC3CCN(C(=O)[C@H](O)CCl)CC3)CC2)cc1C	1836717923	FHYXCNAJAQGQKW-GOSISDBHSA-N	426.945	1.423	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc4sccc4[nH]3)CCO2)C1	1837132583	FSINEEMHEMRNDO-YJYMSZOUSA-N	441.937	1.553	50	20	IDGD	
C[C@H](C(=O)N1CCC(OC2CCN(C(=O)CCBr)CC2)CC1)n1cnnn1	1837654782	WBSNPPGHUXTJJN-CYBMUJFWSA-N	443.346	1.018	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(-c4ccncc4)[nH]n3)CCO2)C1	1838012613	QLAYJZPMKIDODN-IERDGZPVSA-N	447.923	1.559	50	20	IDGD	
CC(=O)N/C(C)=C/C(=O)N1CCC(OC2CCN(C(=O)CO[Si](C)(C)C)CC2)CC1	1838431990	IVRSOUJLPSRSSK-JQIJEIRASA-N	439.629	1.876	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(O)ccc3F)CCO2)C1	1839296822	YJPXRHADTQVDQZ-XIKOKIGWSA-N	445.285	1.385	50	20	IDGD	
C=CCC(F)(F)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1	1839889863	UDJRFIVNIFLKTH-HOTGVXAUSA-N	429.291	1.891	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3cc(C)cs3)C2)C1	1840150398	KKBWRAZKFGZDOT-PXNSSMCTSA-N	444.981	1.699	50	20	IDGD	
C[C@H](Oc1ccccn1)C(=O)N1CCOC[C@]2(CN(C(=O)C(Cl)Cl)CCO2)C1	1840190602	DFIHYXWKBPRWBP-SCLBCKFNSA-N	432.304	1.109	50	20	IDGD	
Cc1cc(F)ccc1C(=O)N1CCO[C@]2(COCCN(C(=O)CCBr)C2)C1	1840776629	MHQSWOPNXMSQMG-IBGZPJMESA-N	443.313	1.989	50	20	IDGD	
COCCOCCOCCOCCC(=O)N1CC2(CCCN2C(=O)C(C)(C)CCl)C1	1841226947	MMSRAFXXZJCWMH-UHFFFAOYSA-N	448.988	1.541	50	20	IDGD	
CC[C@@H](C)[C@@H](O)C(=O)N1CCCC12CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2	1841635275	MPJRQAVOHWTERB-FZKQIMNGSA-N	433.461	1.744	50	20	IDGD	
C[C@H](Br)C(=O)N1CC2(CCCN2C(=O)[C@H]2CC(=O)N(C3CCCC3)C2)C1	1841860522	ZOHPQEQVMIVWCV-KBPBESRZSA-N	426.355	1.764	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCCC12CN(C(=O)c1ccc[n+]([O-])c1)C2	1841924141	AQUWSIJKWGIFKS-HNNXBMFYSA-N	438.912	1.269	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)Cc2ccc(F)c(F)c2)C1	1842742355	HWVQJBYQLNVVSO-UHFFFAOYSA-N	429.427	1.023	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)c2ccc(CS(C)(=O)=O)nc2)C1	1843215412	PORWXZBAUHYDEI-INIZCTEOSA-N	427.954	1.851	50	20	IDGD	
CC(C)(C)OC(=O)N1CCCO[C@@H](C(=O)N2CC3(CCCN3C(=O)[C@@H](F)Cl)C2)C1	1843363955	JSLHMPNFEKAIPP-ZIAGYGMSSA-N	433.908	1.750	50	20	IDGD	
Cc1cc(C(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)nc2ccccc12	1843739311	MFUYYGURDPSHBT-UHFFFAOYSA-N	444.495	1.673	50	20	IDGD	
Cc1ccc2cc(C(=O)N3CCCC34CN(C(=O)c3cccc(B(O)O)c3)C4)ccc2n1	1843751468	IIWXBNKZTLXZKM-UHFFFAOYSA-N	429.285	1.354	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1ccnn1-c1ccccc1)C2	1844264226	VSYVIGSOTNWMMW-UHFFFAOYSA-N	445.483	1.002	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2cc(Cl)ncn2)C1	1844573099	FVNIJDADOMCNGY-WYMPLXKRSA-N	429.868	1.081	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)c1cnn(C)c1)C2	1844692147	MYBXXKOWIQXEFG-UHFFFAOYSA-N	427.417	1.384	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)C1(CNC(=O)OC(C)(C)C)CC1)C2	1846359796	KLIGDTKTPNQVTL-AWEZNQCLSA-N	429.945	1.749	50	20	IDGD	
CC(C)(C)OC(=O)NC1CCC(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](O)CCl)CC1	1847568583	YVJGFBGKJZRLGX-LMNGEROHSA-N	443.972	1.871	50	20	IDGD	
Cc1cc(=O)c(C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)nn1-c1ccccc1	10159803	LYCPEYSMEGPMJS-UHFFFAOYSA-N	430.424	1.507	50	20	IDGD	
CSCC[C@H](NC(=O)c1ccco1)C(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	10159949	CCZKRIXIWZKFIU-AWEZNQCLSA-N	443.485	1.484	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)COc1ccc(N2CCCC2=O)cc1	15727038	BVURJNPZFLMKGY-UHFFFAOYSA-N	435.484	1.952	50	20	IDGD	
Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12	16095347	KSLCUCQMPANIQB-UHFFFAOYSA-N	445.457	1.817	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)N1CCCN(C(=O)c2ccccc2)CC1	725873091	JZKCGTNZAJEGTL-UHFFFAOYSA-N	429.502	1.067	50	20	IDGD	
COc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NNC(=O)Cc2ccc(Cl)cc2)cc1	726190088	CHQVLLPHQRRIPU-LBPRGKRZSA-N	425.894	1.406	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@@H]2CSCN2C(=O)C(C)(C)C)cc(OC)c1OC	728150985	NILXOXMWMFKYKR-LBPRGKRZSA-N	425.507	1.421	50	20	IDGD	
COc1cccc(OC)c1C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	728215463	FMNGLCGPWFCAMS-UHFFFAOYSA-N	434.518	1.397	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNS(=O)(=O)c2ccc(C)c(C(N)=O)c2)c1	728508616	WCGVRZZMPSZDFF-UHFFFAOYSA-N	442.291	1.488	50	20	IDGD	
CCC(CC)N1C[C@H](C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)CC1=O	729299341	AKNUDRRCJGVJTM-CQSZACIVSA-N	427.505	1.776	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)[C@H]1CCCN(S(=O)(=O)Cc2ccccc2)C1	730591142	MOSKDAWAVKGTND-IBGZPJMESA-N	445.541	1.714	50	20	IDGD	
O=C(CCCN1CCN(c2ccccc2)CC1)NNC(=O)CNC(=O)c1cccs1	731987902	ZMBDZNSLPKVSAN-UHFFFAOYSA-N	429.546	1.228	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)CCn2c(S)nnc2-c2cccs2)C[C@@H](C)O1	732261368	MPVJUGWMZALCGD-BETUJISGSA-N	438.579	1.332	50	20	IDGD	
CN1C(=O)CC[C@@H](C(=O)NNC(=O)C(=O)NC2CC2)[C@@H]1c1ccc(C(F)(F)F)cc1	734418348	KJJHWJPVDJOERI-HIFRSBDPSA-N	426.395	1.041	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNS(=O)(=O)c2ccc3c(c2)N(C(C)=O)CC3)cc1	734420181	ZCHWLQMFCPZYRI-CQSZACIVSA-N	447.513	1.771	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CS(=O)(=O)c2ccc(C(C)=O)c(F)c2)cc1OC	734808608	CWNUIGRWVMXQRU-UHFFFAOYSA-N	438.433	1.280	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)N1CCN(c2ccccc2OCCN(C)C)CC1	738472987	WTUCCHXMEXIKIY-UHFFFAOYSA-N	441.532	1.812	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)c1ccccc1S(=O)(=O)N(C)c1ccccc1	740849510	BAJXUZNUPPBHFA-UHFFFAOYSA-N	446.529	1.578	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCCN1C(=O)c1ccc(O)nn1)c1cc2c(s1)CCCCC2	741746972	MYPJFBVMYZTFDP-HNNXBMFYSA-N	443.529	1.969	50	20	IDGD	
O=Cc1ccc(OCC(=O)NNC(=O)c2nnc(O)c3ccccc23)c(Br)c1	742474512	QWIYSZBBXBRGHK-UHFFFAOYSA-N	445.229	1.750	50	20	IDGD	
Cc1cccc(NC(=O)CN2CCN(CC(=O)NNC(=O)c3cccc(C#N)c3)CC2)c1C	744384358	BQJIDFQNFBFPSR-UHFFFAOYSA-N	448.527	1.192	50	20	IDGD	
C[C@H]1Oc2ccccc2N(CCC(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)C1=O	744531593	PGYXBKTXLRQEQQ-CQSZACIVSA-N	436.424	1.067	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)c2c(Br)ccc(F)c2N)c1	744916647	FGHGSKRRGUVPIM-UHFFFAOYSA-N	435.209	1.660	50	20	IDGD	
CNS(=O)(=O)c1ccc(CNC(=O)NNC(=O)Nc2ccc(OC(F)F)cc2)s1	745407419	NZKYBYFEZQAJMM-UHFFFAOYSA-N	449.461	1.794	50	20	IDGD	
COc1ccccc1N1CC[C@H](CNC(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)C1	745792319	IXWBSYBEQXNBNF-CYBMUJFWSA-N	429.433	1.780	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NCC(C)(C)NC(=O)OC(C)(C)C)c2ccccc2c1=O	745926758	LXIVXOINIPRUBR-UHFFFAOYSA-N	432.481	1.181	50	20	IDGD	
CCC1(CNC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)CCOCC1	745934313	WJAGHNPKVCZXBT-UHFFFAOYSA-N	426.539	1.153	50	20	IDGD	
O=C(CC[S@@](=O)c1ccc2c(c1)OCCO2)NNC(=O)Cn1ccc2ccccc21	746224645	QAVVFHLNCZAQRT-SSEXGKCCSA-N	427.482	1.758	50	20	IDGD	
Cc1nn(C)c(C)c1S(=O)(=O)N[C@@H](C)C(=O)NNc1ccc(C#N)c(C(F)(F)F)c1	746888904	IITKKEUSJGSTKI-JTQLQIEISA-N	444.439	1.738	50	20	IDGD	
O=C(CCN1C(=O)[C@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O)NNc1nc(-c2ccccn2)nc2c1CCC2	748341587	UZPZSWQXNCRYJJ-FPAYPSAMSA-N	448.483	1.023	50	20	IDGD	
C[C@]1(c2ccc(C(=O)NNC(=O)c3ccc(F)cc3Br)cc2)NC(=O)NC1=O	748523416	BFHPZEVKUZLFES-GOSISDBHSA-N	449.236	1.718	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)N[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	748637267	ZCFGSJWKHDLSED-XJKSGUPXSA-N	432.443	1.662	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCn2cncc2C1)c1cccc(S(=O)(=O)N2CCCCC2)c1	750827938	FSLGOIVIQZZJAI-MRXNPFEDSA-N	431.518	1.081	50	20	IDGD	
Cc1cc(S(=O)(=O)NNC(=O)CNC(=O)c2cccs2)ccc1Br	751281095	ZKECUVGETIMVTP-UHFFFAOYSA-N	432.321	1.559	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NC[C@H]1CCCO[C@@H]1C(C)C	752001280	ZDFICYCUDOQANW-HUUCEWRRSA-N	425.555	1.683	50	20	IDGD	
CC(C)CC(C)(C)CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	753043850	YVODZDLNUVCTMZ-UHFFFAOYSA-N	440.566	1.724	50	20	IDGD	
CCOC(=O)c1ccc(N2CC(NC(=O)NNC(=O)COc3ccc(C)c(C)c3)C2)nc1	753278700	GBGOUESLWBAIKV-UHFFFAOYSA-N	441.488	1.473	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2ccc(CNS(C)(=O)=O)o2)cc1Br	753605930	KGTJVBPUZXZJTA-UHFFFAOYSA-N	446.279	1.175	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1Cl)NC1CCN(S(=O)(=O)C2CC2)CC1	753967077	LPVYOUMTYHCLJJ-UHFFFAOYSA-N	435.333	1.894	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)c2ccnc(O[C@@H]3CCOC3)c2)c2ccccc2c1=O	754844767	XHHKKRIKPVBQQN-OAHLLOKOSA-N	437.456	1.615	50	20	IDGD	
CCN(CC)c1ccc(S(=O)(=O)N2CCCCC2)cc1NC(=O)NNC(=O)COC	755440902	PSPCQHQFGRRHHE-UHFFFAOYSA-N	441.554	1.507	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)Nc2cccnc2-n2cncn2)c2ccccc2c1=O	756292960	UWBUFMAGHOFLST-UHFFFAOYSA-N	433.432	1.420	50	20	IDGD	
CN1CCOc2ccc(NC(=O)NNC(=O)CCN3CCN(c4ccccc4)CC3)cc21	756851251	QXCRKBYVXYPCAK-UHFFFAOYSA-N	438.532	1.880	50	20	IDGD	
CCCN(C(=O)c1ccccc1NC(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)C(C)C	757738526	NXKMZQBBTHFNGT-ZDUSSCGKSA-N	427.527	1.038	50	20	IDGD	
CCOC(=O)Cc1nnc(NC(=O)NNC(=O)[C@H](C)Oc2ccc(C(C)=O)cc2)s1	757755306	TXBMBWBFGJKCCH-NSHDSACASA-N	435.462	1.467	50	20	IDGD	
Cc1cc(C)c2c(-n3cccc3)c(C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)sc2n1	758044979	AYVMOZZOCPDQFG-LBPRGKRZSA-N	435.531	1.403	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N[C@@H]1CCCS(=O)(=O)C1	758661491	XSMCINQGKRLHTF-ZYHUDNBSSA-N	434.312	1.124	50	20	IDGD	
CC1(C)C(=O)N(C[C@](C)(O)C(=O)NNc2ccccc2S(C)(=O)=O)c2ccccc21	760451184	ZEYWOJXWDFIXIU-NRFANRHFSA-N	431.514	1.609	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)c2cc(N3CCCC3=O)ccc2Cl)cc1	760651035	IXBLZZIUCYGXKY-UHFFFAOYSA-N	440.843	1.956	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCCC(=O)NNC(=O)c1ccc(C#N)cc1	760808760	LDJOCCCZFSXPCD-MRXNPFEDSA-N	429.477	1.225	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCCC(=O)NNC(=S)Nc1ccccn1	760826113	WCZXSXHMZDNPRV-CYBMUJFWSA-N	436.538	1.305	50	20	IDGD	
O=C(NNc1ncc(F)cn1)c1ccccc1NS(=O)(=O)c1ccc2nc(O)[nH]c2c1	760911934	KIYUNQGGFLNNHT-UHFFFAOYSA-N	443.420	1.755	50	20	IDGD	
CC[C@H](OC1CCCCC1)C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	761568393	QSWLUGQZBTYHCA-KRWDZBQOSA-N	439.582	1.589	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)N[C@@H]1CCCN(c2ccccc2F)C1=O	761815697	GQKGYNIXICVLFE-CQSZACIVSA-N	445.407	1.639	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)Cc3c(C)[nH]c(-c4ccncc4)nc3=O)n[nH]2)cc1	762956310	RFVGJDVSRZCBJQ-UHFFFAOYSA-N	443.467	1.843	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1c[nH]c2cccc([N+](=O)[O-])c12	762986545	AOGKWRQLYUYOPO-UHFFFAOYSA-N	445.457	1.854	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNS(=O)(=O)c2cc(Cl)cc(C(=O)O)c2C)c1	763417526	XSPKJJWQUNIIME-UHFFFAOYSA-N	428.850	1.987	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)C(=O)Nc1cccc(N2CCCCC2=O)c1	763445413	HEQOXDAYTVYJCS-UHFFFAOYSA-N	425.401	1.511	50	20	IDGD	
O=C(NNC(=O)c1ccccn1)C(=O)Nc1ccnn1Cc1ccc(Br)cc1	763466149	DVSSIOPNYIYLGH-UHFFFAOYSA-N	443.261	1.489	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(C)cc2C)c1	763507770	CZQPYLQLWNBRLE-UHFFFAOYSA-N	446.529	1.734	50	20	IDGD	
Cc1ccc(C)c(-n2ncc(NC(=O)C(=O)NNC(=O)[C@H]3COc4ccccc4O3)c2C)c1	763572588	SJRPLDVAVOUCJG-HXUWFJFHSA-N	449.467	1.723	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cnn1-c1ccccc1F	763572708	URQJPFUNYWSUMR-SFHVURJKSA-N	439.403	1.246	50	20	IDGD	
CC(C)(C)c1ccc(OCC(=O)NNC(=O)C(=O)Nc2cc(C(N)=O)ccc2F)cc1	763594804	MSJVBXRAZKRQEG-UHFFFAOYSA-N	430.436	1.387	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(C(=O)NC3CCCC3)cc2)c1	763624281	LUNUFBIZZXETQU-UHFFFAOYSA-N	438.484	1.832	50	20	IDGD	
COCCOc1cc(C)ccc1NC(=O)C(=O)NNC(=O)CN1CCCc2ccccc21	763733825	HTWRXQCBVZSBNF-UHFFFAOYSA-N	440.500	1.559	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)Nc2cc3c(cc2[N+](=O)[O-])OCCCO3)cc1	763830961	GBLJHLPMPKWRRC-UHFFFAOYSA-N	428.401	1.718	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccccc2S(C)(=O)=O)c1C	763841261	PNDRBUZHHRWLOX-CQSZACIVSA-N	433.486	1.260	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)cc1[N+](=O)[O-]	763855180	UXCZNQHDLBLZEG-CYBMUJFWSA-N	430.417	1.774	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cnn(-c3ccccc3)n2)cc1	763864587	DDSXTELSDRVKRJ-AWEZNQCLSA-N	438.444	1.219	50	20	IDGD	
Cc1nc(Br)ccc1NC(=O)C(=O)NNC(=O)Cc1c[nH]c2ccccc12	763865773	WAKCHWSXEXMYOG-UHFFFAOYSA-N	430.262	1.962	50	20	IDGD	
COC(=O)c1cc(Cl)ccc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccc(F)cc1	763873208	SIKJJJNQYIQHHK-JTQLQIEISA-N	437.811	1.819	50	20	IDGD	
CCOC(=O)C(C)(C)n1cc(NC(=O)C(=O)NNC(=O)CSc2ccc(C)cc2)cn1	763897411	YULRORIUMMORRY-UHFFFAOYSA-N	447.517	1.368	50	20	IDGD	
CCCN1Cc2cccc(NC(=O)C(=O)NNC(=O)c3nn(-c4ccccc4)cc3O)c2C1	763948303	JDFLKGADPVFTBQ-UHFFFAOYSA-N	448.483	1.703	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3cccc(Cn4cncn4)c3)cc2C1	763949316	OHGCUOBMLGIQTE-CYBMUJFWSA-N	438.513	1.912	50	20	IDGD	
COc1ccc(I)c(NC(=O)C(=O)NNC(=O)c2ccc[nH]2)c1	763981035	RGNQOCWSKQEYQX-UHFFFAOYSA-N	428.186	1.028	50	20	IDGD	
Cc1ccc(S(=O)(=O)NC2CC2)cc1C(=O)NNC(=O)CSc1ccccc1O	764037265	CAFLGEGLUDYVFH-UHFFFAOYSA-N	435.527	1.695	50	20	IDGD	
COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NNC(=O)c1cccc(Br)c1	764063749	XLTRGHWFVXSANE-UHFFFAOYSA-N	437.206	1.766	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(N(C)C3CCN(C)CC3)cc2)c(O)c1	764111718	PLWDFFXFIPSRKT-UHFFFAOYSA-N	439.516	1.631	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1O)C(=O)Nc1ccccc1CN1CCSCC1	764124741	OPFZDZLYVYLQAZ-UHFFFAOYSA-N	448.932	1.994	50	20	IDGD	
CN(C)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)cc1Cl	764127500	WIHWLOLQTQHQPS-UHFFFAOYSA-N	439.255	1.801	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2O1)C(=O)Nc1ccc(Cl)c(C(=O)NC2CC2)c1	764153621	MPAHRYIBNRDSPM-KRWDZBQOSA-N	442.859	1.322	50	20	IDGD	
CCC(C)(C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2c[nH]nc2C)cc1Cl	764297458	RPGQIQHCMVQSOB-UHFFFAOYSA-N	434.884	1.690	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)C(=O)Nc1ccccc1C(=O)N1CCCCC1	764318881	KJMVJVWCNMQWCJ-UHFFFAOYSA-N	426.448	1.780	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](Cc1ccccc1)C(=O)NNC(=O)CNC(=O)c1cccnc1	764345335	RIBYUNCLVAJSLT-QGZVFWFLSA-N	441.488	1.095	50	20	IDGD	
Cc1ccc(NC(=O)C(C)C)cc1NC(=O)C(=O)NNC(=O)COCc1ccccc1	764366392	LCKUWULPOHNXKZ-UHFFFAOYSA-N	426.473	1.892	50	20	IDGD	
CC[C@@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)COCc2ccccc2)cc1	764367614	YPBSMTWSYZNWIT-OAHLLOKOSA-N	426.473	1.518	50	20	IDGD	
CC(C)n1nnnc1-c1ccccc1NC(=O)C(=O)NNC(=O)COCc1ccccc1	764368542	YKOZZIUMJGQFIX-UHFFFAOYSA-N	437.460	1.224	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)C(=O)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1	764385775	IXHUNPOXHPIAEX-GOSISDBHSA-N	447.499	1.433	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)C(=O)Nc2cc(NC(=O)C(C)C)ccc2C)c1	764433091	JNGXDQUYWKZWNX-UHFFFAOYSA-N	440.460	1.343	50	20	IDGD	
C[C@@H](Cc1ccc(F)c(Br)c1)C(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1	765070411	IYJQDWQMKVUAEL-GXSJLCMTSA-N	436.303	1.284	50	20	IDGD	
CC(C)(C)OC(=O)N1CCO[C@@H](CC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)C1	765464788	YJPXCFDADJFVBQ-KRWDZBQOSA-N	429.477	1.659	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2cccs2)[nH]n1)c1ccc(S(=O)(=O)NC2CC2)cc1	765566307	URGDISRTPLPBIZ-UHFFFAOYSA-N	431.499	1.654	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)/C=C\c3cccs3)CC2)cc1	765727962	KDMIWCCXUOOJHT-TWGQIWQCSA-N	448.570	1.224	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)N[C@H]1CCN(C(=O)CCc2ccccc2)C1	765832191	XLWNMAXSLRZQFI-KRWDZBQOSA-N	430.530	1.950	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCN(C(C)=O)C3(CCCCC3)C2)cc1OC	766251716	DQNVGLFLAMOFFT-UHFFFAOYSA-N	432.521	1.332	50	20	IDGD	
CCCN(C)c1ccc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cc1	766647705	VIFZGXHDSMARLM-UHFFFAOYSA-N	437.544	1.752	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)C[C@@H]1CCCN(C(=O)NCC(C)C)C1	767343087	BUXYSXOEOBEIJJ-SFHVURJKSA-N	446.548	1.696	50	20	IDGD	
CC[C@@H](N=c1nn[nH]n1-c1ccccc1)C(=O)NNC(=O)c1cc(-c2cccs2)[nH]n1	768267788	COXHNJVYEMXNHM-CYBMUJFWSA-N	437.489	1.188	50	20	IDGD	
C[C@@]1(c2ccc(F)c(Cl)c2)NC(=O)N(CC(=O)NNC(=O)NC2CCCC2)C1=O	770224438	XTAVVKBRHVGDKY-SFHVURJKSA-N	425.848	1.519	50	20	IDGD	
C=CCNc1ncc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(CC)CC)c2)s1	770957121	ZOCHMLQXSCRJTN-UHFFFAOYSA-N	437.547	1.846	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)CSc1nnnn1CC(F)(F)F	772990615	ORBWNKLMPTXBGZ-QMMMGPOBSA-N	438.819	1.596	50	20	IDGD	
Cc1ccc(S(=O)(=O)C[C@H](C)NC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1	773289860	DTRFQVMXQXRSRG-INIZCTEOSA-N	441.513	1.987	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NNC(=O)C[C@H]2Oc3ccccc3NC2=O)C1	773411761	QYDHHILBUVFAKX-CZUORRHYSA-N	432.477	1.571	50	20	IDGD	
Cn1nc(-c2cc(F)cc(F)c2)cc1NC(=O)C(=O)NNC(=O)c1ccc(Cl)nc1	773540093	IIYYNMUUXILMBN-UHFFFAOYSA-N	434.790	1.813	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1cccc(OCCN(C)C)c1	774006140	AYTZYSNVUQJHNF-AWEZNQCLSA-N	448.907	1.834	50	20	IDGD	
CCN(c1ccccc1)S(=O)(=O)c1ccc(OC)c(NC(=O)NNC(=O)CN(C)C)c1	775446402	ZRAXCANOLAJPSO-UHFFFAOYSA-N	449.533	1.625	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc3c(c2)CCN3C)c1	778281770	CJLRYMBOTUGJFJ-UHFFFAOYSA-N	430.530	1.784	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@H](O)Cc2cccc(C(F)(F)F)c2)c2ccccc2c1=O	778296430	WQBAFLRMRMGQBQ-MRXNPFEDSA-N	448.401	1.800	50	20	IDGD	
C[C@@H](SCC(=O)Nc1ccc(F)cc1)C(=O)NNC(=O)CNC(=O)OC(C)(C)C	778436061	CLIWOZFTYFBGLB-LLVKDONJSA-N	428.486	1.558	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)c1ccccc1NS(=O)(=O)C(F)(F)F	778437928	HFXANSKBJWVKLP-UHFFFAOYSA-N	440.400	1.234	50	20	IDGD	
C[C@H](O)[C@@H](NC(=O)C1CC1)C(=O)NNC(=O)c1ccc(COc2ccc(Cl)cc2)cc1	779490594	CBZPTPPJJXEBDF-ORAYPTAESA-N	445.903	1.956	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)[C@@H](O)[C@H](O)c3nc4ccccc4s3)nc21	779518348	WYWYBFIIOLFUMC-STQMWFEESA-N	443.489	1.434	50	20	IDGD	
CCO[C@@H]1C[C@@](NC(=O)OC(C)(C)C)(C(=O)NNC(=O)Cn2nc(C)cc2C)C1(C)C	780171231	HTYHZXQMXBVONH-QVKFZJNVSA-N	437.541	1.746	50	20	IDGD	
COc1cccc(C(=O)c2ccc(C(=O)NNC(=O)N[C@@H]3CCS(=O)(=O)C3)cc2)c1	780458557	CTCVSCLMPVYOKY-MRXNPFEDSA-N	431.470	1.057	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)CCn1c(S)nnc1-c1cccs1	780973753	GAIFRLYCQLOUAJ-UHFFFAOYSA-N	440.551	1.748	50	20	IDGD	
O=C(NNc1ncccc1C(F)(F)F)C(=O)Nc1ccc(C(=O)N2CCOCC2)cc1	783119057	YZLAMTMPCNRCJC-UHFFFAOYSA-N	437.378	1.655	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)C(=O)Nc1ccc(Cl)c(OC(F)F)c1	784002417	OWGMPNHGYJVOFD-UHFFFAOYSA-N	430.751	1.050	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)c2cc(N3CCOCC3)ccn2)CC1	784415176	LSULXTAGOSEPQU-UHFFFAOYSA-N	448.524	1.262	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H]2CN(CC(=O)NNC(=O)c3cccc(C#N)c3)C[C@@H]21	784522497	HYRUEQZSPURZPQ-CEXWTWQISA-N	441.532	1.944	50	20	IDGD	
COc1ccc(S(=O)(=O)NC(C)(C)C)cc1NC(=O)C(=O)NNc1ccc(F)cc1	784786450	VJSLHGPQQUGALT-UHFFFAOYSA-N	438.481	1.993	50	20	IDGD	
COC(=O)[C@@H]1CCCCN1C(=O)c1cccc(NC(=O)C(=O)NNc2ccccn2)c1	784792996	OVVIBOHKZAQZHH-INIZCTEOSA-N	425.445	1.331	50	20	IDGD	
COCCNC(=O)c1ccc(NC(=O)C(=O)NNc2cc(Cl)ccn2)cc1Cl	784856059	DQVOLDWTTMWOFB-UHFFFAOYSA-N	426.260	1.846	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)C(=O)Nc1ccc(Cl)cc1-c1ccccc1	785992070	VRHYRCZEXDETIE-LLVKDONJSA-N	438.893	1.031	50	20	IDGD	
COc1nc(Br)ccc1NC(=O)C(=O)NNC(=O)COc1cccc(C)c1	789586385	NMFHLPRMWDMCTA-UHFFFAOYSA-N	437.250	1.326	50	20	IDGD	
O=C(NNC(=O)N1CCC[C@H](N2CCCS2(=O)=O)C1)c1cccc(OC(F)F)c1	789840058	RFPLNJQKQYKBPV-ZDUSSCGKSA-N	432.449	1.142	50	20	IDGD	
COc1cc(NNC(=O)[C@@H](NS(=O)(=O)c2ccc(C)cc2)[C@H](C)O)ccc1Cl	790179475	RHNSFDKFGYJAKX-SJCJKPOMSA-N	427.910	1.828	50	20	IDGD	
CSSCCNC(=O)CCC(=O)N1CCN(S(=O)(=O)c2ccc(C)cc2)CC1	791098038	UHQLXUWBFKWZEW-UHFFFAOYSA-N	445.632	1.736	50	20	IDGD	
Cc1ccc2c(c1)CC[C@@H](C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1)O2	793589865	HACBUHXHWJKDCV-IBGZPJMESA-N	431.514	1.853	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN([C@H]2CCN(CC(=O)NNC(=O)c3ccccc3)C2)CC1	796621766	QHNDDHCGOHMEID-SFHVURJKSA-N	431.537	1.075	50	20	IDGD	
CCC(=O)c1cccc(NC(=O)C(=O)NNC(=O)CNC(=O)OCc2ccccc2)c1	797368582	DTCZJJNMFQMVNW-UHFFFAOYSA-N	426.429	1.292	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)C2(c3cncc(Br)c3)CC2)c2ccccc2c1=O	798829522	HJKXXXFPOHOBPX-UHFFFAOYSA-N	442.273	1.584	50	20	IDGD	
CC[C@](O)(C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1)c1cccc(Cl)c1	800320189	SZKMKZFSOSFMLL-LAUBAEHRSA-N	448.859	1.468	50	20	IDGD	
Cn1c(=O)c2cc(C(=O)NNC(=O)Nc3ccc(-c4ccccc4)cc3)n(C)c2n(C)c1=O	802038128	XSDBCUDJBWDGJF-UHFFFAOYSA-N	446.467	1.709	50	20	IDGD	
COc1ccc(Cl)c(NC(=O)NNC(=O)[C@H](C)NS(=O)(=O)c2cccs2)c1	802108239	KZQLERWIJYENSR-VIFPVBQESA-N	432.911	1.930	50	20	IDGD	
O=C(NNc1nc(Br)cn2ccnc12)[C@H]1CCS(=O)(=O)c2ccccc21	807014423	FPYKQESFNGOAJR-NSHDSACASA-N	436.291	1.896	50	20	IDGD	
C[C@H](NS(=O)(=O)c1cccc(C(=O)NNC(=O)N2CCN(C)CC2)c1)c1ccccc1	807381221	JGCRLTHVQDAVHK-INIZCTEOSA-N	445.545	1.328	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)Cc1cc2c(cc1Br)OCCO2	808045339	IJRIHOPSPANENB-UHFFFAOYSA-N	431.283	1.699	50	20	IDGD	
O=C(NNC(=O)C1(S(=O)(=O)c2ccccc2)CCOCC1)c1ccc2c(c1)OCCO2	808056532	YMNJVYUOOQNYQA-UHFFFAOYSA-N	446.481	1.242	50	20	IDGD	
CCCNS(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)NCCc2cccs2)cc1	808080760	JRHYVMDTUMQSPP-UHFFFAOYSA-N	446.576	1.172	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)CCc2ccccc2O)nn1-c1ccc(F)cc1F	808935141	KTDJAFADZGPUED-UHFFFAOYSA-N	443.410	1.883	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)c3c(O)cnc4c(Br)cccc34)nc21	810400431	GRQAXKVFRNYDLB-UHFFFAOYSA-N	430.222	1.842	50	20	IDGD	
Cc1nc(-c2ccccn2)nc(NNC(=O)CNS(=O)(=O)c2c(F)cccc2F)c1C	810408084	VFNLBWGMNFLALK-UHFFFAOYSA-N	448.455	1.855	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)c2cc(S(=O)(=O)NC3CC3)ccc2C)cc1	811841281	ZJTWOBXIECUQLT-UHFFFAOYSA-N	445.497	1.362	50	20	IDGD	
COc1ccc(CNC(=O)NNC(=O)c2cc(C)nc3ccccc23)cc1S(N)(=O)=O	812429854	ZVWKPSLXXLDCIL-UHFFFAOYSA-N	443.485	1.343	50	20	IDGD	
Cc1ccc(C(=O)NNS(=O)(=O)CCCCN2C(=O)c3ccccc3C2=O)c(O)c1	814211055	OUPDFCPCZGMCOM-UHFFFAOYSA-N	431.470	1.341	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCc2nncn2C1)C(=O)Nc1cc(C(F)(F)F)ccc1Cl	815693229	PNHFRJWMHZWDCO-MRVPVSSYSA-N	430.774	1.299	50	20	IDGD	
COC(=O)c1ccc(OCc2ccccc2)c(NC(=O)C(=O)NNC(=O)[C@H]2CCCO2)c1	815778220	HVJQBAJZFORCNO-GOSISDBHSA-N	441.440	1.317	50	20	IDGD	
Cn1c(=NNC(=O)CN2C(=O)N[C@](C)(c3ccc(F)cc3)C2=O)sc2ccccc21	818419165	ZPUBVIAFJNWAFT-HXUWFJFHSA-N	427.461	1.778	50	20	IDGD	
CC(C)(C)c1ccc(C(=O)N[C@@H](CCS(C)(=O)=O)C(=O)NNC(=O)CC2CC2)cc1	819131691	LXDZUEDFVREACF-KRWDZBQOSA-N	437.562	1.465	50	20	IDGD	
CC(=O)N[C@@H](CC(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)c1cccs1	829359524	JUKWDEZQAGUUDZ-AWEZNQCLSA-N	434.430	1.228	50	20	IDGD	
Cc1cccc(NNC(=O)[C@@H](CCS(C)(=O)=O)NS(=O)(=O)c2ccccc2)c1	849610675	MSFGKVBEKWMOKH-QGZVFWFLSA-N	425.532	1.220	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)[C@H](CSC)N1C(=O)[C@H]2CCCC[C@@H]2C1=O	864001342	YEOILBVSDCGZNZ-KKUMJFAQSA-N	449.529	1.128	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)CN2C(=O)[C@@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2=O)c(C)n1-c1ccccc1	913419370	NLLVEAMGMJCXPN-LVNJIZSUSA-N	432.480	1.662	50	20	IDGD	
COc1ccc(-c2nn(CCC#N)cc2/C=C(/C#N)C(=O)NNC(=O)C2CC2)cc1OC	914457009	KNWBHVPGCOPEIB-YBEGLDIGSA-N	434.456	1.945	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)c1cn(-c2ccc(Cl)cc2)nn1	914749101	BVYRXYQFJLKFLI-UHFFFAOYSA-N	433.881	1.289	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)[C@H]2CCCN(C(=O)c3ccccc3OC(F)F)C2)n1	914876503	DWXCOWXIVMQENC-HNNXBMFYSA-N	449.458	1.801	50	20	IDGD	
CC(C)[C@H](C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)N1C(=O)c2ccccc2C1=O	915163747	AHIITPOHIVJAQM-QGZVFWFLSA-N	443.481	1.172	50	20	IDGD	
CNS(=O)(=O)c1cccc(C(C)=NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)c1	915953131	GFRNEUKATVFJGW-UHFFFAOYSA-N	444.922	1.050	50	20	IDGD	
C[C@H](CN1CCOCC1)C(=O)NN=Cc1cc(Br)ccc1OCC(=O)O	915953423	WGVFXTGJOPGQIM-GFCCVEGCSA-N	428.283	1.331	50	20	IDGD	
CC(C)COCCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	916208447	FRXDCOODGPLAGP-UHFFFAOYSA-N	440.566	1.868	50	20	IDGD	
O=C(NCc1cn2ccsc2n1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	916219165	YZIHHCOPODZECV-UHFFFAOYSA-N	448.530	1.325	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2ccccc2O)s1	916233385	VSHKSISBLNEPIJ-UHFFFAOYSA-N	426.520	1.628	50	20	IDGD	
COc1cc(C=NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)ccc1OCC(=O)O	916306229	PRQIIXYAEVZQFV-UHFFFAOYSA-N	435.458	1.173	50	20	IDGD	
COc1cc(C=NNC(=O)Cc2ccc(F)cc2)ccc1OCC(=O)N1CCOCC1	916350922	QLQBZCDFVIRQRN-UHFFFAOYSA-N	429.448	1.765	50	20	IDGD	
Cc1ccc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)cn1	916515755	AOBZVKBAVXSORF-UHFFFAOYSA-N	431.518	1.709	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)c3ccc(S(=O)(=O)N(C)C)cc3)n[nH]2)cc1	917176015	QNRAYKIOLQZCTQ-UHFFFAOYSA-N	427.486	1.710	50	20	IDGD	
CCCC(=O)NCC(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccc(OC)cc2)c1	917391576	AGJKATSLCOLXQG-UHFFFAOYSA-N	448.501	1.173	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNS(=O)(=O)c1cc(S(C)(=O)=O)ccc1C	917721233	VDRXYXJMYHEPLP-UHFFFAOYSA-N	442.515	1.186	50	20	IDGD	
COCCCNC(=O)NN=C(C)c1ccc(S(=O)(=O)N2CCCC[C@H]2C(=O)O)cc1	920830399	VTQNAIZBESJQLV-KRWDZBQOSA-N	440.522	1.374	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCOc2ccc3c(c2)CCC3)c1	1317920226	FRMHXWUBXDVGMB-UHFFFAOYSA-N	446.529	1.449	50	20	IDGD	
Cc1c(CC(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)nnn1-c1ccccc1	1328653314	KKBTZHNGNIGLOC-UHFFFAOYSA-N	442.520	1.913	50	20	IDGD	
CC(C)Cc1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](O)CCl)C3)n(C)n1	1777764175	IITKIQFVDLYQBD-WAOWUJCRSA-N	440.972	1.346	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3c(C)cc(C(N)=O)cc3C)C2)C1	1779012545	YJSKKVYJRICHFL-KKSFZXQISA-N	437.924	1.100	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)C(=O)Nc3cccnc3)C2)C1	1779204137	AXTHMAIVDNAKQB-ROUUACIJSA-N	429.304	1.086	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(COC)c[nH]3)C2)C1	1780079156	NACQAIUIEVCELT-KSSFIOAISA-N	428.327	1.778	50	20	IDGD	
CN1CCC[C@@H](C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](F)Br)C3)C1	1780576126	ZRPAWZKUXSOLKC-ATNYBXOESA-N	434.350	1.533	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc[n+]([O-])cc1)C2)[C@H](F)Br	1780773642	KFLAXWMGNLHFDA-JKIFEVAISA-N	430.274	1.138	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](CCO)NC(=O)OC(C)(C)C)CCO2	1781211509	VYXGHQJOIXLFKZ-MDOVXXIYSA-N	447.960	1.109	50	20	IDGD	
O=C(c1cccn2cncc12)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781331157	DTPPENMMPCDIOR-WMLDXEAASA-N	425.258	1.468	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)N(C)C(C)=O)C2	1781899921	DGEPLDULCCYHRC-HWLIBYHHSA-N	446.386	1.541	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H]1C[C@H]3CC[C@@H]1O3)C2	1782002835	XUIQCXPCKCLOJV-UGRJFSIRSA-N	429.355	1.851	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H]1CCc3nc[nH]c3C1)C2	1782179252	WDMTZWFLCDMKIR-JTQINKHRSA-N	438.956	1.282	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cnc(Cl)nc3)CCO2)C1	1783338304	GFCOCDGPHLMOOS-WBMJQRKESA-N	431.718	1.747	50	20	IDGD	
COc1nccc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](C)Br)C3)C2)c1F	1783532031	CAWPUDIIKPLZTF-APPDUMDISA-N	430.274	1.456	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc4cnccc4n3)CCO2)C1	1783534800	OYXNZHBKBAEIPK-DJJJIMSYSA-N	433.306	1.857	50	20	IDGD	
Cc1ccn2c(C(=O)N3CCO[C@]4(CCN(C(=O)[C@@H](C)Br)C4)C3)cnc2c1	1783538006	VIBYPPGMOMMOJG-KUHUBIRLSA-N	435.322	1.870	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)CCc3ncccc3OC)CCO2)C1	1783872750	GVKKEGHFIPPPJU-FOIQADDNSA-N	425.913	1.107	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)[C@@H]3CCCN3Cc3ccccc3)CCO2)C1	1783878627	IFYRHFSONWTVSQ-ZRCGQRJVSA-N	449.979	1.735	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN3CCSCC3)C[C@@H]21	1783964124	KLGWUVHIHCAOPY-VGWMRTNUSA-N	448.427	1.046	50	20	IDGD	
Cc1nccn1CCCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](C)CBr)CCO2	1784405831	GJJQSQMYBOLJPE-BEFAXECRSA-N	441.370	1.833	50	20	IDGD	
Cc1cc(Cl)cc(C(=O)N2CC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)c1	1785042143	FSIPIRWILLHSNL-JOCHJYFZSA-N	442.708	1.086	50	20	IDGD	
COc1cc(C(=O)N2CC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)ccc1[N+](=O)[O-]	1785182098	DDLVSJAMAMJGHP-QGZVFWFLSA-N	432.260	1.851	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4cccnc4[nH]3)C[C@@H]21	1786406776	DHTWCOLBBIIEOY-DZKIICNBSA-N	435.322	1.941	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C=C/C(=O)NCc3ccco3)[C@H]2C1	1788718405	BCLYINIEMNLCKA-XABQTDMUSA-N	437.924	1.449	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(-n4cccn4)nc3)[C@H]2C1	1788985525	MQGPIRYGXYDTGF-FJIDUMEYSA-N	447.923	1.114	50	20	IDGD	
CC(C)n1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]3C2)n1	1789924596	OIPLAMHSRXYIKU-JURCDPSOSA-N	431.306	1.748	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CCOC3)C[C@@H]21	1790695525	NKHOSQKAWXAKMS-WJAIEZPQSA-N	445.466	1.888	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3cn[nH]c3)C[C@@H]21	1790961829	UZYFIIWZDZLTLM-JONQDZQNSA-N	427.343	1.496	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C/N=C/c3ccco3)C[C@@H]21	1791056419	XSSFKPLOEQTHBJ-KYFJBTDQSA-N	426.311	1.462	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C#Cc3ccc(Cl)cc3)C[C@@H]21	1791250088	YXMIJBWSIRCRQQ-KANFNMMFSA-N	439.339	1.925	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CCC[C@H](C(=O)OC)C3)C[C@@H]21	1791257388	CPYNVTLPAINZSM-QQCJEOGWSA-N	444.956	1.199	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cncc3cnccc13)C2	1792872594	QEULRBQVDUSXHC-LJGDNWOOSA-N	447.333	1.864	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnco1	1793561847	OHOWCTIGOTVFPL-XFMPKHEZSA-N	442.900	1.010	50	20	IDGD	
CN(C)c1cncc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Br)C3)c1	1794297168	PKFAWCUYFKIOKH-NEBZKDRISA-N	429.290	1.041	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(C(=O)O)ncn1	1794680900	SNFUQMWGCJZKSD-USZNOCQGSA-N	425.283	1.600	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCc1cnn(C)c1	1795769640	JOFSPIFTCBFSIS-JYYAWHABSA-N	427.343	1.116	50	20	IDGD	
N#Cc1cccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)c1Cl	1796191884	KRTPBXSIWRZDRT-BCDXTJNWSA-N	437.692	1.457	50	20	IDGD	
N#Cc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Cl)c(C(F)(F)F)n1	1796363642	VDIFIKIYQSUNTE-XSPYEYLBSA-N	434.777	1.710	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1coc([Si](C)(C)C)c1	1797727488	RXQUXHOLOAWACK-JYYAWHABSA-N	428.989	1.282	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(C(C)(C)C)n[nH]1	1798134546	KTMDOVXQRUCSHW-MCYUEQNJSA-N	427.343	1.694	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccnc3ncccc13)C2	1798443119	UHEUYJCSOMKZPZ-QDMKHBRRSA-N	445.483	1.194	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1csc(C(F)(F)F)n1	1798953454	FZDVXQKLDSYUAI-ZSBIGDGJSA-N	447.483	1.787	50	20	IDGD	
Cn1nc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@](C)(Cl)CCl)c2c1CCC2	1799275360	QETHQUDGQRBNMF-RHQBZFHZSA-N	429.348	1.348	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc2nccn12	1799992522	XTUYSFUGGJUNFW-VWPFQQQWSA-N	435.322	1.569	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc(Cl)nc1)C2	1800637797	IHDZKHVMYIFISA-RNJOBUHISA-N	431.718	1.507	50	20	IDGD	
Cc1c[nH]c(C)c1CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)Br	1800754028	CPKPOZYSSIWMBO-LJGDNWOOSA-N	426.355	1.937	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c(F)ccnc1Cl)C2	1800757252	BYCYGJIMXLQXGS-ORXSELOVSA-N	434.693	1.861	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(CO)c(F)c1)C2	1800764272	ZLAVYKAOHZGCMM-HPAJIGNASA-N	429.286	1.305	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)Oc1ccccn1	1801368761	IMCHPUONTBKRAJ-XGYYKPKNSA-N	440.338	1.612	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1C[C@@]12C(=O)Nc1ccccc12	1801929684	FKOLJBMYAZPZPM-XEURPQGBSA-N	431.920	1.788	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(C(F)(F)F)ccn1)C2	1802337798	STQDTAIQXLCSCF-QDMKHBRRSA-N	441.454	1.725	50	20	IDGD	
C[C@H](C#N)c1cccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)c1	1803680204	AAGAPFHGZMJRJE-DQEVTTJGSA-N	446.511	1.878	50	20	IDGD	
CC(C)N1CCC(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)CC1	1804143073	ZNWKBFVYPAZNGI-UFYCRDLUSA-N	436.984	1.808	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC2(CCCN(C(=O)CNC(=O)N(C)C)C2)CC1	1805040155	PTIQZLLDIPKGQG-CQSZACIVSA-N	431.375	1.662	50	20	IDGD	
Cc1onc(C(=O)N2CCCC3(CCN(C(=O)c4cnccc4C(=O)NN)CC3)C2)c1C	1806349951	PAMMWMMZOMAOMF-UHFFFAOYSA-N	440.504	1.449	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)c1cccc2[nH]ncc12	1808027476	OTQSQAHTHRHXNH-ZOCIIQOWSA-N	427.892	1.877	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)Cc2cncnc2)[C@@H]1c1cccnc1)[C@@H](F)Br	1808651397	KVVFBRLXHQPNNS-USXIJHARSA-N	436.285	1.811	50	20	IDGD	
C[C@H](C(=O)N1CC[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]1c1cccnc1)n1cncn1	1810548463	RATYSWYIPQMUBI-HHXXYDBFSA-N	430.585	1.792	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)CCSC(=N)N)[C@@H]1c1cccnc1	1812864805	RLGOBWJYSNSZAZ-CORIIIEPSA-N	442.383	1.888	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)CO[Si](C)(C)C)[C@H]1c1cccnc1	1813072836	HBDOMUNIXXPEBO-UWJYYQICSA-N	449.628	1.312	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)[C@@H](C)Cn2ccnc2)[C@H]1c1cccnc1	1813416859	JCCCFJRJYDIVST-WZGPROSRSA-N	433.940	1.874	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)CCS(C)(=O)=O)[C@@H]1c1cccnc1	1813576009	AUCCBJQOOYULIX-NOLJZWGESA-N	446.367	1.306	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)CCN3CCOCC3)sc2C1	1814648135	BNANDBVUDOHRPY-STQMWFEESA-N	430.958	1.031	50	20	IDGD	
CC(C)(CCl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(=O)n3[nH]cnc3n2)[nH]n1	1814693839	FBTNMNHNVKTFFC-ZDUSSCGKSA-N	446.899	1.712	50	20	IDGD	
CSCC(C)(C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1815265270	KPBAVTPOBTURAG-KRWDZBQOSA-N	444.366	1.785	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)cnc1C	1817471390	XWLKJXVRMNCKDJ-FQEVSTJZSA-N	447.304	1.721	50	20	IDGD	
Cc1cc2nnc(C(=O)Nc3nc4c(s3)C[C@@H](NC(=O)[C@H](O)CCl)CC4)c(C)n2n1	1818244752	JNYMHJGXBCSJHN-CMPLNLGQSA-N	449.924	1.023	50	20	IDGD	
COc1cc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)ccn1	1819782814	LKMPPLWGUVWJEZ-SFHVURJKSA-N	449.276	1.113	50	20	IDGD	
C#CCCCCC(=O)N[C@@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1	1819801901	VLDPFKAWSWYHJC-CYBMUJFWSA-N	440.529	1.561	50	20	IDGD	
O=C(Cc1ccc2ncnn2c1)Nc1cc([C@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1	1820699528	KEBLNUCCXUSYRO-HUUCEWRRSA-N	431.884	1.287	50	20	IDGD	
CC(C)/C=C/C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1823086137	BXELNHOHAUIZOX-DKRLNXSXSA-N	425.493	1.926	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)Cn1nccn1)CC2	1825451196	GQDPAXDLMHYCPV-UWVGGRQHSA-N	427.328	1.520	50	20	IDGD	
CC(C)(CCl)C(=O)N[C@@H]1CCc2nc(NC(=O)CNC(=O)C(F)(F)F)sc2C1	1826139431	QSOZGEYIFZEZLL-MRVPVSSYSA-N	440.875	1.999	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC([C@H]2CCCCN2C(=O)CN2CCNC2=N)CC1	1826873596	NCXHQFWLKOHRPA-HZPDHXFCSA-N	442.402	1.620	50	20	IDGD	
Cc1ccncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1	1827902697	ZPZKGSRIRXXRMO-FQEVSTJZSA-N	429.565	1.996	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc4ccnn34)C2)C1	1830365229	BNRAVWZXWMVAGC-NRFANRHFSA-N	434.924	1.669	50	20	IDGD	
CN1CCCC[C@@H]1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1	1830760770	OTYCXUOYVHFNDX-LZQZEXGQSA-N	436.380	1.163	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)[C@H]2CC[C@H](O)CC2)CC1	1831997287	ZEVAMAFTQOYLEB-STZQEDGTSA-N	442.365	1.151	50	20	IDGD	
O=C(/C=C/c1ccoc1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1832651894	ZQDLPUIIMTWSKP-XGERFZHZSA-N	431.258	1.440	50	20	IDGD	
Cc1ccncc1CCC(=O)N1CCO[C@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1	1833012251	DIJWSQAOSXAEFB-JOCHJYFZSA-N	449.624	1.631	50	20	IDGD	
CC(C)(CCl)C(=O)NC1CCN(C2CCN(C(=O)c3cnc(O)nc3O)CC2)CC1	1833215448	SGLNDDGDMDMGRT-UHFFFAOYSA-N	439.944	1.338	50	20	IDGD	
COc1ncccc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1	1834131225	STWXQNKOGIJSKR-RTBURBONSA-N	446.331	1.397	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CCC(F)(F)F)CCO2)C1	1835328930	FLOJPSSMURRCCP-WFASDCNBSA-N	445.276	1.959	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC1CCN(C2CCN(C(=O)CC(F)(F)C(=O)O)CC2)CC1	1835837920	ZMJAZSAVWBWJJX-UHFFFAOYSA-N	449.571	1.520	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)c1cc(F)cnc1Cl	1835885592	LNTIOMBUEXFFPD-INIZCTEOSA-N	447.338	1.659	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc4c(c3)CC(=O)N4)CCO2)C1	1836789592	MEUYHOGOSZOSQX-KKSFZXQISA-N	435.908	1.269	50	20	IDGD	
C=C[C@H](O)C(C)(C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1	1837400868	QGKPLMBSBRSMSR-JVPBZIDWSA-N	437.364	1.252	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)ccn1	1837941825	XBCQVKPCURFVNF-KDOFPFPSSA-N	426.311	1.243	50	20	IDGD	
COc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)cc(Cl)n1	1838230404	BGQOYYZFOZNDPX-WMLDXEAASA-N	436.267	1.348	50	20	IDGD	
Cc1nc(F)ccc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1838268080	ZGRYEQNEHLFJKK-WMLDXEAASA-N	448.264	1.290	50	20	IDGD	
CN1C(=O)CC[C@H]1C(=O)N1CCC(OC2CCN(C(=O)[C@](C)(Cl)CCl)CC2)CC1	1838638971	PTIWTGQHXNVKDS-OXJNMPFZSA-N	448.391	1.842	50	20	IDGD	
Cc1nccn1CC(=O)N1CCC(OC2CCN(C(=O)[C@@H](C)Br)CC2)CC1	1838731012	VEKDJZXCCFHXQX-CQSZACIVSA-N	441.370	1.974	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(Cl)nc3F)C2)C1	1839142606	UEDFCQGHJBHPIV-ACJLOTCBSA-N	434.295	1.962	50	20	IDGD	
C[C@H](C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2)N1C[C@H]2C[C@@H]2C1	1839153098	AZLZZEQMWPJNAG-BIQFIRCYSA-N	448.391	1.019	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCCn3cccc3)C2)C1	1839154947	DFDQALMGNNAUIF-UXHICEINSA-N	446.375	1.961	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc4ccoc4c3)CCO2)C1	1839536815	ADODQIFIJGOELC-UWJYYQICSA-N	436.892	1.757	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCNC(C)C)C2)C1	1839963929	AMHIOCNYPKXPHZ-CRAIPNDOSA-N	434.375	1.004	50	20	IDGD	
Cc1nccn1[C@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1	1840494060	OQRSERKZLVXOCF-MDASCCDHSA-N	447.363	1.445	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CC3(OC)CCC3)CCO2)C1	1840617394	AZKAITPSENSDIG-BEFAXECRSA-N	447.370	1.576	50	20	IDGD	
CC(=O)N[C@@H](C(=O)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1)c1cccc(Cl)c1	1841352303	HAHMEQQRMHUGFW-JKSUJKDBSA-N	428.316	1.320	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@]2(C[C@@H]2C(=O)N2CC3(CCCN3C(=O)[C@H](O)CCl)C2)C1	1841353547	DDGWEVRLFKZENE-SXGZJXTBSA-N	441.956	1.437	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)c2cc(O)ncn2)C1	1841693225	BWNPGEYZMOTIFM-UHFFFAOYSA-N	441.400	1.147	50	20	IDGD	
CSc1cccc(C(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)c1O	1844264626	QUHCYQIZDXYXDH-UHFFFAOYSA-N	441.513	1.243	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2cc(F)c(F)cc2F)C1	1845328343	OPOLGEBWJWAMCJ-UHFFFAOYSA-N	433.390	1.233	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@H]2C[C@@](C)(O)CN2C(=O)OC(C)(C)C)C1	1846231263	KCVXDMSFJLSJJC-AUSJPIAWSA-N	443.972	1.968	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)CCCn2ccnc2)C1	1846570938	QEKCYVNUTFCYQD-LFVJCYFKSA-N	425.493	1.001	50	20	IDGD	
O=C(Cn1c(=O)[nH]c(=O)c2ccccc21)NNC(=O)c1cc2c(s1)CCCCCC2	10289409	BCDILIRLHMZUGL-UHFFFAOYSA-N	426.498	1.872	50	20	IDGD	
CCn1c(NNC(=O)c2ccc(OC)c(S(=O)(=O)N(C)C)c2)nc2ccccc2c1=O	11155487	CVDAKWHRBKTVMJ-UHFFFAOYSA-N	445.501	1.432	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(C(=O)NNC(=O)Cc2nc3ccccc3n2C)cc1	15926210	ONUKEZUTYQSIGK-UHFFFAOYSA-N	429.502	1.264	50	20	IDGD	
Cc1cnc2c(S(=O)(=O)NNC(=O)c3csc(N4CCOCC4)n3)cccc2c1	23371700	TWRXGWNWMUQOOL-UHFFFAOYSA-N	433.515	1.460	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)C(=O)N(Cc1ccco1)C2=O)c1ccc2c(c1)OCO2	26963190	JMJSDYGNOPZGMV-UHFFFAOYSA-N	433.376	1.879	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)N1CCN(CCOc2ccccc2Cl)CC1	725873044	UFYSNRFYXWDTAU-UHFFFAOYSA-N	449.895	1.100	50	20	IDGD	
COc1cccc([C@H](CNC(=O)NNC(=O)CNC(=O)c2cccs2)N2CCCC2)c1	726085824	LOIWNOOAVGHZDJ-KRWDZBQOSA-N	445.545	1.654	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2ccc(C)c(C(=O)NNC(=O)C(=O)NC(C)C)c2)cc1	726612336	BTBPJKRVJHPWGX-UHFFFAOYSA-N	448.501	1.090	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)NC[C@H]1CCN(CCc2ccccc2)C1	728715128	JWHBALSTHFGUGX-LJQANCHMSA-N	426.517	1.969	50	20	IDGD	
Cc1nc2cc(O)nn2c(C)c1CC(=O)NNC(=O)COc1ccc(Br)cc1	729509444	OODLBFCJTMNSJF-UHFFFAOYSA-N	448.277	1.583	50	20	IDGD	
CC(=O)Nc1cccc(OCCNC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])c1	729614995	VQJRKTMTSKLRPI-UHFFFAOYSA-N	431.405	1.341	50	20	IDGD	
COC1CCN(C2(CNC(=O)NNC(=O)COc3ccc(C#N)cc3)CCCC2)CC1	730914555	SDQZEYZBRIQIJL-UHFFFAOYSA-N	429.521	1.691	50	20	IDGD	
O=C(CC12CC3CC(CC(C3)C1)C2)NNC(=O)NCCS(=O)(=O)NCC1CCC1	731686066	NGEIUWNJXZOVRX-UHFFFAOYSA-N	426.583	1.643	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)[C@@H](C)N1CCN(c2ccc(F)cc2)CC1	731863859	HQNZLABPIILWFU-QGZVFWFLSA-N	444.507	1.961	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])o1	732054950	OMQSQHPYKFNZKM-LBPRGKRZSA-N	436.808	1.916	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)N[C@H]2CCN(c3ccccc3C(N)=O)C2)cc1C	732595374	PKTPRINHTXKQHF-INIZCTEOSA-N	425.489	1.390	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)NCCN(C)CC(F)(F)F)c2ccccc2c1=O	732703922	NVLSRIOKQXVHSR-UHFFFAOYSA-N	428.415	1.416	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)/C(=C/c1cccnc1)NC(=O)c1ccccc1	733152638	PJGBVEOYLHWZPZ-AQTBWJFISA-N	432.436	1.785	50	20	IDGD	
Cc1nn(CCCl)c(C)c1C(=O)N1CCN(Cc2cc(=O)n3ccsc3n2)CC1	733914833	JARBSTCXINFDRT-UHFFFAOYSA-N	434.953	1.766	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NC[C@@H]2CCCN2Cc2ccccc2)c2ccccc2c1=O	734217891	NRJMFUMOLNTSPK-KRWDZBQOSA-N	434.500	1.542	50	20	IDGD	
Cc1cc(NNC(=O)c2ccc(Cl)c(S(=O)(=O)N3C[C@H](C)O[C@@H](C)C3)c2)ncn1	734256308	CUUIDGKAPHIKQI-STQMWFEESA-N	439.925	1.993	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)NCCCc1ccc(Br)cc1F	734858644	CEISDKMMCOGOKC-UHFFFAOYSA-N	441.257	1.874	50	20	IDGD	
COc1ccc(S(=O)(=O)C[C@H](C)C(=O)NNC(=O)COc2ccc(C#N)cc2)cc1	735028639	MZBSTHJXGYNAEY-AWEZNQCLSA-N	431.470	1.203	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2csc(-c3ccoc3)n2)CC1	735116821	HMRJLQOYUIYYLO-UHFFFAOYSA-N	448.530	1.491	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)[C@H]2CN(Cc3ccccc3)CCO2)c2ccccc2c1=O	741173704	STXHRNFBQBASMC-HXUWFJFHSA-N	449.511	1.469	50	20	IDGD	
COCC[C@@H](Cc1cccc(Br)c1)C(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1	741176467	VCYMYDONRYLANU-UONOGXRCSA-N	447.351	1.226	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN(C[C@H]2CCCO2)C(=O)OC(C)(C)C)cc1OC	741880120	BZHIIOTXDYVJLL-OAHLLOKOSA-N	437.493	1.881	50	20	IDGD	
CC(=O)Nc1cccc(OCCNC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)c1	743591262	BPCAYWSPFPFEKT-UHFFFAOYSA-N	449.489	1.463	50	20	IDGD	
C[C@@H](NC(=O)c1cccs1)C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	744621550	SNXABGNQJXRJBL-CYBMUJFWSA-N	438.531	1.031	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NCc2nc(-c3ccccc3)n[nH]2)cc1	745838579	NQUJIDSWMLAWSE-UHFFFAOYSA-N	429.462	1.411	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F)c1ccc2c(c1)OCO2	746592301	WALIAWUYBKOPQA-UHFFFAOYSA-N	433.320	1.966	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)c2cnn(CC(=O)NC3CCCCC3)c2)cc1	746687091	DPXXGONNIMWGJN-UHFFFAOYSA-N	427.505	1.734	50	20	IDGD	
CC(C)C[C@@H](C(=O)NNC(=O)CCOc1ccccc1)N1C(=O)[C@H]2CC=CC[C@H]2C1=O	747182539	JMHPOPCIDWHQGO-OTWHNJEPSA-N	427.501	1.969	50	20	IDGD	
COc1cc(/C=C(\C#N)C(=O)c2c(N)n(C)c(=O)n(C)c2=O)ccc1OCC(F)(F)F	750893083	OJCNJXJIGPEYTG-IZZDOVSWSA-N	438.362	1.406	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)cc([N+](=O)[O-])c1Cl)C(=O)Nc1ccccn1	750904654	GOCUTKFEGWSROS-UHFFFAOYSA-N	442.613	1.805	50	20	IDGD	
O=C(NNS(=O)(=O)c1cccc2c1OCCO2)c1ccc(F)cc1Br	751269578	GVPNVHUKNVRTLH-UHFFFAOYSA-N	431.239	1.983	50	20	IDGD	
O=C(CN1CCCN(C(=O)CCc2ccccc2)CC1)NNC(=O)c1ccc(F)cc1	751484153	RGFGNEIGOAWTCW-UHFFFAOYSA-N	426.492	1.754	50	20	IDGD	
COC(=O)COc1c(C)cc(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1C	752502283	DEDJEMQGDFTFDH-UHFFFAOYSA-N	448.501	1.223	50	20	IDGD	
COc1cc(OC)cc(N2C[C@@H](C(=O)NNC(=O)c3c(C)nc4ccccn34)CC2=O)c1	752505594	WMURKXUFZNRYBG-AWEZNQCLSA-N	437.456	1.474	50	20	IDGD	
Cc1oc(S(=O)(=O)N(C)C)cc1C(=O)NNC(=O)c1cccc(Br)c1	753235307	XEKKHPMYARNIIQ-UHFFFAOYSA-N	430.280	1.676	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)Cn2c(=O)ccn(Cc3ccccc3)c2=O)c2ccccc2n1	754777552	NDMWCQQXIGYTSF-UHFFFAOYSA-N	443.463	1.376	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2ccc(CCNS(C)(=O)=O)cc2)c2ccccc2n1	754778133	WOANKFDAUMWWOT-UHFFFAOYSA-N	426.498	1.710	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@]2(C)CCOC2)c1	754828729	JWSKCANSIRVWTI-HXUWFJFHSA-N	433.486	1.684	50	20	IDGD	
CCc1noc(CC)c1CC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	755038097	ZVORFSAHKLJBAP-UHFFFAOYSA-N	434.518	1.588	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1ccccc1S[C@H](Cl)C(F)(F)F	755612922	FNWJGOBFXJODNQ-CPCISQLKSA-N	448.876	1.996	50	20	IDGD	
COc1cc(C)ccc1Oc1ccc(NC(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)cn1	755884793	CGXQYXGAWFFAEI-CYBMUJFWSA-N	434.474	1.778	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)c2coc(S(=O)(=O)N(C)C)c2)n[nH]1	756145465	MSVUCZPKOMZZMV-UHFFFAOYSA-N	433.446	1.003	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1C	756514118	DYIZNZURYFCEDK-UHFFFAOYSA-N	434.474	1.994	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1cccc(Cl)c1SCC(F)F	756676414	OUSMJCUWQVZGAJ-SSDOTTSWSA-N	430.886	1.788	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1S(=O)(=O)NC1CC1	756682813	PWUMSYQSTGMPNG-UHFFFAOYSA-N	449.445	1.511	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)[C@@](C)(O)CN3Cc4ccccc4C3=O)n[nH]2)cc1	756878290	GXANLHCZTNGIEQ-DEOSSOPVSA-N	447.495	1.807	50	20	IDGD	
CCc1nnc(O)c(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(CC)CC)c2)c1CC	758150329	JDOVUOBRZHHXRQ-UHFFFAOYSA-N	449.533	1.412	50	20	IDGD	
C[C@H](Oc1ccc2c(c1)CCC2)C(=O)N1CCN(S(=O)(=O)CBr)CC1	758526446	CQSDESOFUYDQJX-ZDUSSCGKSA-N	431.352	1.769	50	20	IDGD	
O=C(NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)NNC(=O)c1ccc(Cl)cc1	758691968	CCHBWCHBZJNUFF-UHFFFAOYSA-N	426.838	1.666	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)N[C@H]2CCO[C@H](c3ccc(F)cc3)C2)c2ccccc2c1=O	758715373	QJJQTVCULPWZNC-YJBOKZPZSA-N	439.447	1.937	50	20	IDGD	
Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	760794565	SFSIBNWCBFSNAA-HNNXBMFYSA-N	449.803	1.701	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCCC(=O)NNC(=O)c1c[nH]c2ccccc12	760799414	NPFODIKAASJGJW-KRWDZBQOSA-N	443.504	1.835	50	20	IDGD	
CC(C)[C@H](NS(=O)(=O)c1ccc2c(c1)OCCCO2)C(=O)NNc1ncc(F)cn1	760906363	TZTKWVWVAOTYMX-INIZCTEOSA-N	439.469	1.223	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)N[C@@H]1CC[C@@H]2SCCS[C@@H]21	763064402	SFUADBXDDVQDTE-WSTZPKSXSA-N	449.646	1.909	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)C(=O)Nc1cccc2c1CN(c1ccccn1)C2	763443234	YFKBWWFMNJHLQJ-UHFFFAOYSA-N	446.423	1.910	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(OCC(F)(F)F)nc1	763446270	PXDULEKAWOHJMM-UHFFFAOYSA-N	427.295	1.331	50	20	IDGD	
COCCOc1c(Cl)cc(NC(=O)C(=O)NNC(=O)c2ccncc2)cc1Cl	763465383	YIJCLHMTUIYACR-UHFFFAOYSA-N	427.244	1.813	50	20	IDGD	
CC(=O)N(Cc1ccc(NC(=O)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1)C1CC1	763467413	FMDIVSVENBNJTG-UHFFFAOYSA-N	439.428	1.505	50	20	IDGD	
Cc1cccc(NC(=O)C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)c1	763511390	BOCHMXSDELBUBI-UHFFFAOYSA-N	444.513	1.569	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)C(=O)Nc1ccnc(Sc2ccccn2)c1	763550483	AKWALQBHLXLTNC-UHFFFAOYSA-N	437.437	1.756	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)NC(=O)CO3)c(C)n1-c1ccccc1	763600771	BICQDFLLCYBSIQ-UHFFFAOYSA-N	447.451	1.825	50	20	IDGD	
O=C1CCc2cc(F)c(NC(=O)C(=O)NNC(=O)c3cc(-c4ccccc4)[nH]n3)cc2N1	763604855	NZOUEJRXPYWGHJ-UHFFFAOYSA-N	436.403	1.500	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(N2CCOC[C@@H]2C)cc1	763648951	YTJNRGRZHHGKQW-HNNXBMFYSA-N	442.472	1.085	50	20	IDGD	
O=C(NNC(=O)c1cccc(Cl)c1)C(=O)Nc1ccc(C(=O)NC2CCOCC2)cc1	763753330	SHALBIUEBVKMKG-UHFFFAOYSA-N	444.875	1.649	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(-c3n[nH]c(C4CC4)n3)cc2)c1	763760182	GKQODCCYONZSAI-UHFFFAOYSA-N	433.472	1.815	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2cc(C)nn2-c2ccccc2F)c1	763771718	FEVKCQAIQQTRFH-UHFFFAOYSA-N	441.419	1.737	50	20	IDGD	
COC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)cc1F	763870999	CIBRDNPBYHRYJN-SNVBAGLBSA-N	436.371	1.697	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccn(-c2ncccc2F)n1	763873321	VNNHQZKOWYMENB-NSHDSACASA-N	430.371	1.099	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)C(=O)Nc1ccnn1Cc1c(Cl)cccc1Cl	763993457	QNJYPLIBHQQWDG-UHFFFAOYSA-N	435.271	1.976	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1ccc(Cn2cncn2)cc1	764011583	JLDIAIPHHIHPKY-UHFFFAOYSA-N	428.836	1.388	50	20	IDGD	
CC[C@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(NC(=O)[C@H]2CCCO2)cc1C(F)(F)F	764082390	NKAACIMJWOWWSX-IINYFYTJSA-N	444.410	1.955	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)nc1)C(=O)Nc1ccc([S@](=O)C(F)(F)F)cc1	764100204	ISXVEGUFACENBI-NDEPHWFRSA-N	434.783	1.762	50	20	IDGD	
O=C(CC1CC1)NNC(=O)C(=O)Nc1ccc(CCn2cc(Br)cn2)cc1	764143034	NQHZJTYAYWHAMP-UHFFFAOYSA-N	434.294	1.774	50	20	IDGD	
O=C(NNC(=O)c1cccc2ncccc12)C(=O)Nc1cc(F)cc(N2CCOCC2)c1	764258146	WBXAYBWNIYTVPS-UHFFFAOYSA-N	437.431	1.610	50	20	IDGD	
O=C(Cc1ccccn1)NNC(=O)C(=O)Nc1ccccc1CN1CCc2ccccc21	764266481	FEGVLQGAQQWFFP-UHFFFAOYSA-N	429.480	1.973	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1cc(F)ccc1N1CCCCC1	764275213	KNIDMDXYSRNXDY-UHFFFAOYSA-N	430.436	1.687	50	20	IDGD	
C=CCNC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)COCc2ccccc2)cc1	764362356	DWFBBIJPPUIMLR-UHFFFAOYSA-N	425.445	1.297	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)C(=O)Nc2cnccc2-c2ccc(C(F)(F)F)cc2)cn1	764362382	FICLJLIGUYAJPZ-UHFFFAOYSA-N	432.362	1.901	50	20	IDGD	
CC(=NNC(=O)c1cccc(S(C)(=O)=O)c1)c1ccc(Cl)c(S(N)(=O)=O)c1	764682289	KRQWCEFZGUZAMQ-UHFFFAOYSA-N	429.907	1.545	50	20	IDGD	
CNC(=O)c1cc(Oc2ccccc2NC(=O)C(=O)NNC(=O)OC(C)(C)C)ccn1	765391903	YGKOQFTWFCZJNO-UHFFFAOYSA-N	429.433	1.728	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)CSc2nnc(-c3ccco3)n2Cc2ccco2)n[nH]1	765588248	KYLQUIHPKVBCKC-UHFFFAOYSA-N	427.446	1.764	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)N[C@@H]1CC(=O)N([C@H]2C[C@H]2c2ccccc2)C1	765799329	GWAKHXJLRUWPIH-RYRKJORJSA-N	428.514	1.873	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)C(C)(C)Oc2ccc(C#N)cc2)cc1OC	767631625	DLCQJXINIIGORZ-UHFFFAOYSA-N	441.440	1.737	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)NC1CCN([C@@H]2CCCC[C@H]2O)CC1	767936658	AMNREUKCMRIXGK-HUUCEWRRSA-N	428.331	1.489	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)ccc1OC(C)C	768238811	FSWCIKGGVMRZLA-UHFFFAOYSA-N	429.429	1.653	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3ncn(-c4ccccc4)n3)CC2)cc1	768459459	ASSQUBQVUHNDMO-UHFFFAOYSA-N	433.516	1.155	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)Nc1ccccc1CN1CCNC1=O	769247667	HELONSXPJCJGMI-UHFFFAOYSA-N	433.490	1.773	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)Nc2ccc(Cl)c(S(=O)(=O)N3CCOCC3)c2)n1	769923007	PMTBHNBZYJEDAT-UHFFFAOYSA-N	440.913	1.916	50	20	IDGD	
COCCOc1cc2c(cc1C=NNC(=O)C(=O)NCc1ccc(Cl)cc1)OCO2	771567157	GJTLDINHJVOASO-UHFFFAOYSA-N	433.848	1.860	50	20	IDGD	
O=C(CN1C(=O)CSc2ccccc21)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772197796	HTZFQFZENCBQPA-UHFFFAOYSA-N	432.889	1.243	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H]1CC(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772885060	UFOWZVKAZXJDKF-OAHLLOKOSA-N	438.912	1.893	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)c(Br)n1	772889025	NSSLTGKQHZMULS-UHFFFAOYSA-N	425.670	1.883	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)[C@@H]1CCCC[C@H]1C(=O)N1CCCC1	772890093	VURVAJBRUCXACW-IAGOWNOFSA-N	434.924	1.532	50	20	IDGD	
COc1cccc(CC(=O)N2CCc3ccc(NC(=O)C(=O)NNc4ncccn4)cc32)c1	773723651	COLOTEAIDAIEEN-UHFFFAOYSA-N	446.467	1.699	50	20	IDGD	
CS(=O)(=O)Nc1ccc(OCCNC(=O)NNC(=O)c2cccc3ncccc23)cc1	773785699	MIFMWJJNFFXOAT-UHFFFAOYSA-N	443.485	1.629	50	20	IDGD	
COC(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)cc1	774001026	DCDGCQICWFIICP-LBPRGKRZSA-N	433.848	1.609	50	20	IDGD	
COc1ccc(O)c(S(=O)(=O)NNC(=O)c2ccc(CSc3nncn3C)cc2)c1	775669166	GYDUZTLWRMFLLA-UHFFFAOYSA-N	449.514	1.445	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1[nH]cnc1C(=O)c1ccccc1	776319765	IOJNMKBRZDDQPB-UHFFFAOYSA-N	440.485	1.317	50	20	IDGD	
Cc1cc(Br)c([N+](=O)[O-])cc1S(=O)(=O)NNC(=O)Cc1cccnc1	777623652	IAHLMNNJUWDBKC-UHFFFAOYSA-N	429.252	1.613	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)c2ccccc2c1=O	778218732	YCNGHDZEACZRTR-UHFFFAOYSA-N	431.355	1.878	50	20	IDGD	
CC[C@@H](NC(=O)NNC(=O)CNC(=O)OC(C)(C)C)[C@@H]1CN(Cc2ccccc2)CCO1	778699109	FIGKFSJEMOYVHM-MSOLQXFVSA-N	449.552	1.521	50	20	IDGD	
O=C(NNC(=O)C(=O)N1CCCC1)N[C@H]1CCN(c2ccc(Cl)c(Cl)c2)C1=O	779379777	IPNJFZDYCBWBGL-ZDUSSCGKSA-N	428.276	1.052	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)N[C@@H]2CCCN(c3ccc(C#N)cc3)C2=O)cc1	780897287	VLMMSTAJCXQRPA-LJQANCHMSA-N	437.456	1.472	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NCc2nnc(SC)s2)c2ccccc2c1=O	783061331	WYDJUXMSRIVXJL-UHFFFAOYSA-N	447.546	1.914	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ncnc3ccsc23)cc1	783254975	PFAXNOCVCQVBFJ-UHFFFAOYSA-N	448.530	1.804	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2cc(Cl)ccc2F)nc1	783262445	DCOQXAZUJCCLIA-UHFFFAOYSA-N	429.861	1.643	50	20	IDGD	
CC(C)Oc1ccc(Br)cc1NC(=O)C(=O)NN[C@]1(C)CCS(=O)(=O)C1	783429078	ZOHQGKXGUBQUQT-MRXNPFEDSA-N	448.339	1.373	50	20	IDGD	
CN(NC(=O)CSc1nnc2ccccn12)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	783704269	NAZJYFWTZOANAK-UHFFFAOYSA-N	449.537	1.457	50	20	IDGD	
CC(C)N(C)S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2nccnc2Cl)cc1	784777621	BKHIPTVYHLMDBT-UHFFFAOYSA-N	426.886	1.241	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)C(=O)Nc2cc(F)cc(N3CCOCC3)c2)c1	784842216	VGJWDQJBPDUUPR-UHFFFAOYSA-N	436.465	1.148	50	20	IDGD	
CN(C)CCn1ccc(NC(=O)C(=O)NNc2c(F)cc(F)cc2Br)n1	785007627	IAWMTDDTZKMAEY-UHFFFAOYSA-N	431.241	1.567	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2ccccc2CN2CCOCC2)n1	785225037	BASCRWDVHBTQGN-UHFFFAOYSA-N	427.509	1.237	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1ccc2c(c1)N(C)CCO2	785330701	KLEGZPCOEXMNOR-UHFFFAOYSA-N	434.474	1.009	50	20	IDGD	
C[C@H](OC(=O)/C(C#N)=C/c1ccccc1)C(=O)NCCc1ccc(S(N)(=O)=O)cc1	785364550	QGELDEKFZMNFJW-VUODPORTSA-N	427.482	1.532	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(C(=O)OC)c(C)cc1C	788330437	GXKIBQJZRNJZBU-UHFFFAOYSA-N	443.456	1.654	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccc(Cc2nnc3n2CCC3)cc1	792268157	JOKCAVVHFVLXJH-UHFFFAOYSA-N	448.483	1.152	50	20	IDGD	
COc1ccc(Cn2cc(NC(=O)C(=O)NNC(=O)c3ccc4c(c3)OCO4)cn2)cc1	793022838	CZSNSPFWNPVKQN-UHFFFAOYSA-N	437.412	1.068	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1cccc(Br)n1	793026847	UBDYVTSPFVIRFH-UHFFFAOYSA-N	427.642	1.906	50	20	IDGD	
C[C@H](Oc1ccc(C=NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1)C(=O)O	794880001	OZTBHQOGDZLBAX-JTQLQIEISA-N	425.850	1.603	50	20	IDGD	
COC(=O)c1cc(F)cc(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)c1F	796991019	YQLATSNAWRPRGQ-UHFFFAOYSA-N	425.319	1.055	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2cc(C)ccc2C)cc1OC	796991860	KBQOVAMLYXGUEX-UHFFFAOYSA-N	429.429	1.264	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)C(=O)Nc2cc(-c3cccnc3)ccc2C)c1	797011945	NKABFOVCCUQVOS-UHFFFAOYSA-N	432.440	1.810	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)c2nn(-c3cc(Cl)ccc3[N+](=O)[O-])cc2O)n1	798152714	ACDDXNCEXGDFBO-UHFFFAOYSA-N	433.812	1.414	50	20	IDGD	
C=CCNC(=S)NNC(=O)CNC(=O)[C@H]1c2ccccc2C(=O)N1Cc1ccccc1	798305575	VOPKNUIXECLWTB-LJQANCHMSA-N	437.525	1.181	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C1CCN(C(=O)[C@@H](C)CSC)CC1	799295034	WKLNDLRMSDSXRO-HNNXBMFYSA-N	437.562	1.849	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CSc2nnc(-c3cccs3)n2C)cc1	801111114	LOXANHRUFRYMIT-UHFFFAOYSA-N	430.515	1.730	50	20	IDGD	
CC(C)[C@H](NC(=O)NC(C)(C)C)C(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	802066126	QQZDROTUZKZNQE-AWEZNQCLSA-N	427.527	1.365	50	20	IDGD	
O=C(CCNC(=O)N1CCc2ccccc2C1)NNC(=O)Nc1ccc2c(c1)OCO2	802096352	NCOXPUJYXRSGCN-UHFFFAOYSA-N	425.445	1.726	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N1CCOC[C@H]1[C@@H]1CCCO1	804881929	ZLVIFFLOBPZZFO-RCBQFDQVSA-N	442.310	1.837	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNc3nccnc3C3CCC3)CC2)cc1	805461936	SLWMHJWVFVBOBV-UHFFFAOYSA-N	444.561	1.502	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cnc(C(F)(F)F)cc2C)c(OC)c1	810387105	FWQULKFMCKQCDT-UHFFFAOYSA-N	426.351	1.826	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2ccc(-n3ccc(C(F)(F)F)n3)cc2)CCS(=O)(=O)C1	810393436	NGYWFXGNOSSLKA-MRXNPFEDSA-N	445.423	1.028	50	20	IDGD	
CC(C)CC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)NNC(=O)c1cccc(Br)c1	810448946	AJIMSFDLLQIDDV-HNNXBMFYSA-N	436.310	1.707	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNS(=O)(=O)c3ccc4c(c3)NC(=O)CC(=O)N4)cc2C1	812548235	IERWZBQFLTWASV-JTQLQIEISA-N	448.526	1.777	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CN2C(=O)[C@H]3CC=CC[C@H]3C2=O)ccc1OCCC(C)C	814760289	IFIKMMVBPOABHR-CALCHBBNSA-N	443.500	1.832	50	20	IDGD	
Nc1nc(Cl)c(C=NNC(=O)Nc2ccc(S(N)(=O)=O)cc2)c(N2CCCC2)n1	814967538	OQOQVGQHLJGPMM-UHFFFAOYSA-N	438.901	1.115	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2cc(Cl)ccc2OC(F)(F)F)n1	815567138	PTORTJWDPGRWMY-UHFFFAOYSA-N	433.774	1.838	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCc2nncn2C1)C(=O)Nc1cc(Cl)ccc1OCC1CCC1	815692113	JNUYEQFODWZUGP-CYBMUJFWSA-N	446.895	1.459	50	20	IDGD	
CCOc1c(Cl)cc(NC(=O)C(=O)NNC(=O)[C@@H]2CCc3nncn3C2)cc1Cl	815692336	ONVXPVBODLRZLQ-SECBINFHSA-N	441.275	1.332	50	20	IDGD	
COc1cc(Cl)ccc1NC(=O)C(=O)NNc1ccccc1S(=O)(=O)N(C)C	815750447	BBPXYVVVFOVIFX-UHFFFAOYSA-N	426.882	1.681	50	20	IDGD	
Cc1nn(C)c2sc(C(=O)OCC(=O)NNC(=O)[C@@H]3COc4ccccc4O3)cc12	878443445	IIDMSTOLSJJAAO-AWEZNQCLSA-N	430.442	1.087	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)cc1	912643178	GESNGGCTUCUJPQ-UHFFFAOYSA-N	444.513	1.894	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNC(=O)c2ccc3c(=O)n(C)c(=O)n(C)c3n2)cc1	914222200	XOZNHKQMBDZZIM-UHFFFAOYSA-N	439.472	1.132	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)C3CCCC3)CC2)cc1OC	914842306	BAWCIDJWBFWIKO-UHFFFAOYSA-N	439.534	1.442	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)N1CCC(NS(=O)(=O)c2ccc(F)cc2)CC1	915258528	QXGVOFORVSEXBF-UHFFFAOYSA-N	434.493	1.931	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)c2cc(S(=O)(=O)Nc3ccccc3F)c[nH]2)n1	916140072	YKEAZUSLZBEJCT-UHFFFAOYSA-N	434.453	1.229	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)no1	916160624	SSXCZQKJMMZDAZ-UHFFFAOYSA-N	449.470	1.245	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)NCc2ccc(C(=O)N3CCCC3)cc2)nc2ccccc21	916252703	MXNJEPOCDBQHBO-UHFFFAOYSA-N	434.500	1.882	50	20	IDGD	
O=C(CC(F)(F)F)NNC(=O)c1cc(S(=O)(=O)N2CCOCC2)ccc1Cl	918703609	DLEAGVQQDJDQOB-UHFFFAOYSA-N	429.804	1.074	50	20	IDGD	
Cc1nn2c(=O)c3ccccc3[nH]c2c1C=NNC(=O)c1nn(C)c(=O)c2ccccc12	918709852	ZDOZYQIYZFGCJQ-UHFFFAOYSA-N	427.424	1.495	50	20	IDGD	
CS(=O)(=O)NC[C@H]1CCCN(C(=O)NNC(=O)c2ccc(Br)s2)C1	918778669	LXBJKCIWASLJHF-SECBINFHSA-N	439.357	1.126	50	20	IDGD	
O=C(COC(=O)CCn1c(=O)nc(O)c2ccccc21)NNC(=O)c1cccc(Cl)c1	918922037	LQLPNHDXBZTCFL-UHFFFAOYSA-N	444.831	1.150	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)c1ccc(N2CCOC2=O)cc1	920969994	DLVIIKHPJJFMGE-CYBMUJFWSA-N	446.485	1.752	50	20	IDGD	
COC(=O)C(=O)NNC(=O)NCc1ccccc1CN1CCN(c2ccccc2)CC1	1116187574	RFYJVWNOJWCMDK-UHFFFAOYSA-N	425.489	1.012	50	20	IDGD	
O=C(CNS(=O)(=O)c1c(Cl)cccc1Cl)NNC(=O)c1n[nH]c2c1CCCC2	1317734342	YQNFQQOEKKDJTK-UHFFFAOYSA-N	446.316	1.335	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)NNC(=O)N[C@H]1CCO[C@]2(CCS(=O)(=O)C2)C1	1319836000	ISVRWBJYGBKOCS-WMLDXEAASA-N	430.914	1.090	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCc2ccc(C[S@](C)=O)cc2)c2ccccc2c1=O	1326920272	QBBDONDJWLDUPC-HKBQPEDESA-N	441.513	1.439	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnc4cc(C)ccn4c3=O)C2)C1	1777993839	CGLNWGADHWQVOT-JTSKRJEESA-N	446.935	1.854	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccn4cncc4c3)C2)C1	1778653144	JHZUKZRRIPCATM-LIRRHRJNSA-N	435.322	1.809	50	20	IDGD	
O=C(c1ccncc1-c1ccccc1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1779852951	KYUIOOLVWLFSAD-SIKLNZKXSA-N	429.904	1.792	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(C)nc3O)C2)C1	1780276494	XOUSTKFDQOFOBT-KDOFPFPSSA-N	426.311	1.713	50	20	IDGD	
O=C(Cc1ccc(Br)nc1)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Cl)CCO2	1780875055	VMOSOEKKVCWEOG-ZBFHGGJFSA-N	434.693	1.751	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)CN3CCc4sccc4C3)CCO2)C1	1781215432	PSFCHDWFJFPHBG-UZLBHIALSA-N	425.982	1.954	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](C)NC(=O)c1ccc(F)cc1)CCO2	1781218272	OMHUQYJPMYOSMT-DAESXHAQSA-N	439.915	1.791	50	20	IDGD	
O=C(Cc1cccnc1Cl)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781325691	HMKNDBMXHZIWKM-CJNGLKHVSA-N	434.693	1.798	50	20	IDGD	
COc1ncc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](F)Br)C3)C2)cc1C	1781328717	XCDZFEWSVWJFQW-GUYCJALGSA-N	430.274	1.533	50	20	IDGD	
CCN(CC)C[C@H](C)C(=O)N1CC[C@]2(CN(C(=O)[C@H](C)CBr)CCO2)C1	1782685487	DDCMKZSRPLKKGG-JTDSTZFVSA-N	432.403	1.825	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)Cc3nnc(C)s3)CCO2)C1	1783342029	IDHNKTKKWGVYBC-LRDDRELGSA-N	431.356	1.392	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3n[nH]c(C4CC4)c3F)CCO2)C1	1783532517	PATHLGHNSOUWPB-BMLIUANNSA-N	429.290	1.653	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](C)Br)C3)C2)n(C(F)F)n1	1783535592	ALTIZIMXECJCLB-MEDUHNTESA-N	435.269	1.814	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)COc3ccccc3OC)CCO2)C1	1783869122	OBKLLGDMQNCWBV-QRWLVFNGSA-N	426.897	1.158	50	20	IDGD	
CC#C[C@H](CC(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](Cl)COC)C2)C1)c1ccc(O)cc1	1783879157	PDCQPJHKXULPFL-RFWXGWTQSA-N	448.947	1.973	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3n[nH]c4ccc(C#N)cc34)CCO2)C1	1783882851	QZOWFCBNECRLIN-QRWLVFNGSA-N	431.880	1.132	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)C(C)(C)Cc1ccccc1)CCO2	1783933359	VVIMZPBPQSYGQV-DEOSSOPVSA-N	444.576	1.458	50	20	IDGD	
Cc1cc(Cl)cc(C(=O)N2CC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)c1	1785043148	NRDFCCPYBXWCGY-JOCHJYFZSA-N	442.708	1.086	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1)C(=O)c1ccco1	1786754375	NRZMGZUWBHAHRL-UHFFFAOYSA-N	432.241	1.590	50	20	IDGD	
COCc1oncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)CBr)C[C@@H]21	1787719260	NKCIZBVPMWCTOO-JURCDPSOSA-N	444.326	1.445	50	20	IDGD	
Cc1noc(CC(=O)NC2(c3ccc(NC(=O)c4ccc(B(O)O)cc4)cc3)CCC2)n1	1788140680	JMNGMGGMMXWRKX-UHFFFAOYSA-N	434.261	1.048	50	20	IDGD	
CC(=O)Nc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]3C2)ccn1	1788762711	PHKGTNDZNZGUPU-BZSNNMDCSA-N	448.596	1.485	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(C(N)=O)cc3)C[C@@H]21	1788765887	BTKCSJAVCHTYSK-BZSNNMDCSA-N	433.581	1.230	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccncc3O)[C@H]2C1	1788827477	AOIYZPQSFCWNET-ZIEJDFEHSA-N	426.311	1.554	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(OC)n(C)n3)C[C@@H]21	1790962812	CESACBPEDCPAJO-ABHRYQDASA-N	443.342	1.196	50	20	IDGD	
O=C(CN1CCCCC1=O)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1	1791513377	LRDFTPRXRXWSBG-UHFFFAOYSA-N	449.316	1.127	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)Sc3ccccn3)[C@H]2C1	1791580773	QWWVVPUIXANGFK-HMDCTGQHSA-N	441.981	1.796	50	20	IDGD	
COc1ccc([C@@H](O)C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Br)C3)cc1	1792716383	UJLMSFRLXVOCFJ-IPQWEPCOSA-N	445.285	1.009	50	20	IDGD	
COc1cnc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)CBr)c(F)c1	1792870476	PJGXRLFSIZEPPT-MCYUEQNJSA-N	444.301	1.464	50	20	IDGD	
Cc1oc2cc(O)ccc2c1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1	1796189034	OHUOMYTUDPBIQU-BCDXTJNWSA-N	448.284	1.692	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)c1ccnc(C(F)F)c1	1796190756	HZJAQOPRKACIGH-BJWYYQGGSA-N	429.232	1.265	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1[nH]nc2ccncc12	1796657663	JFASMKGAJGMFMI-SSJPOKSSSA-N	448.487	1.344	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1cnc2ccccn12	1796953988	WKEZZAGWBYNAMH-JLUCKKNBSA-N	425.258	1.228	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cn(C)cc1C(F)(F)F	1797159129	JZLPMRQETXPIJM-BTTYYORXSA-N	443.470	1.669	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1nnc(-c2ccccc2)o1	1798501609	LRIRPEPMKIBRLO-BJWYYQGGSA-N	440.504	1.361	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C/N=C/c1ccco1	1798518776	WRQGXKIBGPNYDZ-YOGHELERSA-N	438.488	1.471	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc[nH]1)C2	1798524963	SPHQNPKDPODKEQ-HBCWATKFSA-N	442.428	1.365	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(C)cc1-n1nccn1	1798630427	HFKOFSDHUTUCCQ-HIRMHNASSA-N	431.924	1.796	50	20	IDGD	
CN(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1(C)COC1)C2)NC(=O)NCc1ccccc1	1799865543	ASWMAEFKUXAXEZ-REPLKXPHSA-N	443.548	1.007	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1csnn1)C2	1800332536	UIXADIKEJYYTJG-XSDCOXNMSA-N	445.451	1.627	50	20	IDGD	
COc1cc(OC)cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CCC(=O)NN(C)C)c1	1802337462	XVOQDZDJZYIVSM-BJWYYQGGSA-N	432.521	1.329	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cnc(OCF)cn2)[C@H]1c1cccnc1)[C@@H](O)CCl	1803142012	VAOMDLJCDKOYDF-QRTARXTBSA-N	437.859	1.097	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cc3cn[nH]c3cn2)[C@H]1c1cccnc1)[C@H](O)CCl	1803142919	MVMWFJFASAIUSA-VHSSKADRSA-N	428.880	1.272	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cnn3cccnc23)[C@@H]1c1cccnc1)[C@H](O)CCl	1803143302	ZSFAFJYAZWRHGD-USXIJHARSA-N	428.880	1.044	50	20	IDGD	
Cc1cc(C)n(CCC(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)n1	1803145820	INDROFRUUSRWAW-WSTZPKSXSA-N	433.940	1.591	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)[C@@H](C)CC(N)=O)[C@H]1c1cccnc1	1803672722	UYWLWSJOQHSDQL-CAVOSLQRSA-N	425.327	1.382	50	20	IDGD	
C=CCSCC(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1804176774	SLQHJSAQNNMZLY-LAUBAEHRSA-N	433.578	1.380	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2cccnc2C(N)=O)[C@@H]1c1cccnc1	1804816632	QCRJIZIMMRUHQO-HFTRVMKXSA-N	445.907	1.149	50	20	IDGD	
Cc1cnc(C(=O)NC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)s1	1805245107	RNWDGJZNQHMSAL-LPHOPBHVSA-N	444.561	1.539	50	20	IDGD	
CCC1(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)CCC1	1807360761	CANXWCLGVCCKTG-FPOVZHCZSA-N	435.333	1.661	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2cnncc2C(=O)O)[C@H]1c1cccnc1	1808264416	YCTHZXJKRJKEOM-COXVUDFISA-N	431.880	1.907	50	20	IDGD	
Cc1cc(/C=C/C(=O)N2CCC3(CCCN(C(=O)c4ccc(B(O)O)cc4)C3)CC2)no1	1809970763	AOGYYNGUUXOVJB-BQYQJAHWSA-N	437.305	1.221	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC2(CCCN(C(=O)c3[nH]nc4ccncc34)C2)CC1	1810659936	RUHRVKGTVYJYQH-UHFFFAOYSA-N	441.536	1.176	50	20	IDGD	
Cc1cc(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)ccn1	1810786052	ANAQYJOCHGVBNA-IFMALSPDSA-N	444.300	1.098	50	20	IDGD	
CCc1nc(C(=O)NC[C@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)co1	1811013119	HCTWTUZFGJFHHF-IIBYNOLFSA-N	442.520	1.325	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1	1812808434	PCUNHYPWOROQRB-ZMSDIMECSA-N	440.928	1.212	50	20	IDGD	
C=CCC(F)(F)C(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1813074016	NSOIOBCIUALFPE-QFBILLFUSA-N	437.491	1.672	50	20	IDGD	
C[C@H]1CC[C@H](C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)CC1	1813546344	OYEWVRGHTFWYJG-ZVEOBBNSSA-N	449.360	1.907	50	20	IDGD	
Cc1cscc1C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1	1815340984	RMGCHXPHBBEICQ-CQSZACIVSA-N	441.343	1.732	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)Cc2cscn2)[nH]n1)c1cccc(B(O)O)c1	1817475682	XZTOSDCJXCDILB-KRWDZBQOSA-N	439.306	1.095	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CC2CCC2)[nH]n1	1819404359	IGDRGHHQFVSRAR-KRWDZBQOSA-N	425.493	1.904	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(C(=O)O)ncn2)[nH]n1	1822367832	SUDPLWOHACJHTC-HZMBPMFUSA-N	436.856	1.458	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)C2CC(F)(F)C2)[nH]n1	1822411935	DUDQPYKJEZQFBH-AWEZNQCLSA-N	426.468	1.820	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)COCCOC)CC2	1825444981	HNBNDANZADTWQI-MNOVXSKESA-N	434.356	1.892	50	20	IDGD	
C[C@@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1)c1ccccn1	1827055245	SOZADORUJZUSQX-JPYJTQIMSA-N	449.360	1.798	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)CC(F)(F)C(=O)O)CC1	1827597652	VJMZOLGKUJITAQ-HNNXBMFYSA-N	446.495	1.089	50	20	IDGD	
CCS(=O)(=O)N[C@H](C)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@H](F)Cl)CC1	1827608269	NWIWVRZNLNRBSC-YUELXQCFSA-N	425.954	1.468	50	20	IDGD	
Cc1cccc(/C=C/C(=O)N2CCO[C@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)n1	1829728104	FCGJAZSLSRBSPM-ZMBJWTFHSA-N	428.316	1.663	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CC3CCN(C)CC3)CCO2)C1	1829996057	GRAQNUKKEBZRKU-WIYYLYMNSA-N	429.989	1.582	50	20	IDGD	
O=C(c1cc(C2CC2)on1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1830198837	UCVQJRLJRJUPRC-RHSMWYFYSA-N	446.273	1.313	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3c[nH]c4nccc-4c3)C2)C1	1830357757	JZJALKQBOQTJNL-OAQYLSRUSA-N	434.924	1.850	50	20	IDGD	
CCn1nc(C)cc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830357846	MJWLMAFIEHVDIH-FQEVSTJZSA-N	426.945	1.546	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)C3=CCCS3)C2)C1	1830536074	XUZZEKCMMJLGEK-CXAGYDPISA-N	433.368	1.495	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CC[C@H](O)CC3)C2)C1	1830544037	LQNIMXJGTQNXNA-NNFUDEMPSA-N	447.370	1.025	50	20	IDGD	
CC(C)(Cc1ccccc1)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1	1830547244	IMPLDTNHBNAWMU-GCJKJVERSA-N	438.952	1.311	50	20	IDGD	
C=CCC(CC=C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)Br)C2)C1	1830644896	ZPRZHMQTCFTYCQ-HNAYVOBHSA-N	429.355	1.995	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3CCc4nc[nH]c4C3)C2)C1	1831657960	RTVWJBSTSJZLEA-QYWGDWMGSA-N	438.956	1.379	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)C2CCC(O)CC2)CC1	1831875472	WCOYIKUHEJNINY-SOAGJPPSSA-N	436.597	1.530	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H]3CCCCC3(F)F)CC2)CC1)[C@@H](O)CCl	1833305890	BYPCIDFRMDYPDR-IRXDYDNUSA-N	435.943	1.983	50	20	IDGD	
CC[C@H](C)[C@H](O)C(=O)NC1CCN(C2CCN(C(=O)CO[Si](C)(C)C)CC2)CC1	1833499160	WZHKDZDPPMOKBK-JXFKEZNVSA-N	427.662	1.817	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)/C=C/c3ccco3)CC2)CC1	1833853050	YXGQHLMEGCXILX-AATRIKPKSA-N	445.564	1.237	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cnc(N(C)C)o3)CC2)CC1	1834098787	LGMUDSCMWVAAHW-MRXNPFEDSA-N	441.960	1.180	50	20	IDGD	
Cc1nc(C)c(C(=O)N2CCOC[C@]3(CN(C(=O)CCBr)CCO3)C2)s1	1834818828	CMRYOHJSMSLQIR-KRWDZBQOSA-N	446.367	1.615	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)[C@@H]3C=CCN3)CC2)CC1	1835048327	IBJTYSNCIGSUAC-YOEHRIQHSA-N	427.387	1.117	50	20	IDGD	
O=C(CNc1ccc(F)cc1)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1835584490	FMRYMOIMWGCSEC-GOSISDBHSA-N	434.295	1.498	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3ccc[nH]3)CCO2)C1	1836018097	VENSNQLTRWTSDC-LPHOPBHVSA-N	442.354	1.577	50	20	IDGD	
Cc1cc(C(=O)NC2CCN(C3CCN(C(=O)[C@H](O)CCl)CC3)CC2)nn1C(F)F	1836160460	HMDIDWODAOEBMP-MRXNPFEDSA-N	447.914	1.372	50	20	IDGD	
CCOc1ccc(C(=O)NC2CCN(C3CCN(C(=O)[C@H](F)Cl)CC3)CC2)nn1	1836198751	LHEDJQYHTZSWIM-KRWDZBQOSA-N	427.908	1.595	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3nc4ccccn4n3)CCO2)C1	1836393604	WCYYJYDIYOGKIC-MGPUTAFESA-N	435.912	1.207	50	20	IDGD	
O=C([C@H](O)CCl)N1CCC(OC2CCN(C(=O)[C@H]3CCc4nc[nH]c4C3)CC2)CC1	1836720354	RDNLHOGXSLHNBV-IFXJQAMLSA-N	438.956	1.113	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)CN3CCOC3=O)CC2)CC1	1836787764	GOGJASXUWPDIPK-ZDUSSCGKSA-N	446.342	1.221	50	20	IDGD	
COC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1837662418	KAPCZWZDUXEMNB-MRXNPFEDSA-N	437.306	1.629	50	20	IDGD	
Cc1csc(C(=O)N2CCOC[C@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)c1	1837710135	KLQQXIWJIZPKKS-IBGZPJMESA-N	426.611	1.978	50	20	IDGD	
Cc1nc(F)ccc1C(=O)N1CCOC[C@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1837715495	UATQKQJMEQCTRR-FQEVSTJZSA-N	439.560	1.451	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)C(F)(F)c3ccco3)C2)C1	1837715875	PFFYXIXZKPYJEA-GOSISDBHSA-N	446.523	1.679	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(C#N)c3)CCO2)C1	1838907891	UUODPTFYAAHRLG-PMACEKPBSA-N	440.327	1.865	50	20	IDGD	
CN(C)c1cccc(C(=O)N2CCO[C@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)c1	1838924787	IKZSKLZYDFGDDZ-QFIPXVFZSA-N	449.624	1.674	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(F)cc1F)CCO2	1839005254	HHTOHMFIRRCFBX-HXUWFJFHSA-N	442.535	1.886	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ncccc3F)C2)C1	1839153947	WHPIYFPIKFDHJW-QZTJIDSGSA-N	434.295	1.527	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc4nn[nH]c4c3)CCO2)C1	1839628171	SQOVQRRSQXIEJK-FOIQADDNSA-N	435.912	1.435	50	20	IDGD	
C=CCSCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](Br)CC)CCO2	1839962778	QTESHQUKBYTRAO-RHSMWYFYSA-N	435.384	1.536	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(F)nc3F)C2)C1	1840029867	SWCLGZPRXUVRQS-GTNSWQLSSA-N	448.264	1.213	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3cccs3)C2)C1	1840030908	AJOIRGYKEAUNQU-RDTXWAMCSA-N	445.379	1.921	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3[C@H]4C=CS[C@H]43)C2)C1	1840035015	DFKDVFPWJAOYQX-BAHXQUAYSA-N	431.352	1.101	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cn3cnc4ccccc43)CCO2)C1	1840102806	WMLNUMRAHHEVMV-IERDGZPVSA-N	434.924	1.510	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3coc(C(C)C)n3)C2)C1	1840151272	ZIZDDTKDWZCISK-AUUYWEPGSA-N	429.901	1.122	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3c(C)cccc3F)C2)C1	1840155518	ACOSRAHNPCXHEI-MGPUTAFESA-N	428.888	1.458	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3c(C)cccc3F)C2)C1	1840155522	ACOSRAHNPCXHEI-YWZLYKJASA-N	428.888	1.458	50	20	IDGD	
O=C(c1ccc2n[nH]cc2c1)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840187782	WTFZLPOWZISAOB-SFHVURJKSA-N	427.288	1.437	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3ccoc3)CCO2)C1	1840516346	KHPIEZQEHYPIPP-RTBURBONSA-N	433.332	1.905	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccccc3C3CC3)CCO2)C1	1840658305	WQPWLBASYSYNJB-UGKGYDQZSA-N	436.936	1.888	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1)C1CC1	1841348518	VGDUZNXMXMNFFN-GJZGRUSLSA-N	429.945	1.483	50	20	IDGD	
CN(CC(=O)N1CCCC12CN(C(=O)C1=CCCC1)C2)NC(=O)NCc1ccccc1	1845038433	BMXOXRVNYYJIIK-UHFFFAOYSA-N	425.533	1.646	50	20	IDGD	
O=C1CC(C(=O)N2CC3(CCCN3C(=O)[C@@H](Br)Cc3ccccc3)C2)=NN1	1845941468	AHEDWGRXCWJNAU-AWEZNQCLSA-N	433.306	1.072	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC12CN(C(=O)c1cc(=O)nc3sccn13)C2	1846071447	SWMVBZSFHIPFLC-NSHDSACASA-N	439.335	1.747	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@H](C)NC(=O)OCc2ccccc2)C1	1846166633	UUUSRUWKJSJJLA-WBVHZDCISA-N	437.924	1.759	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cncc(N(C)C)c1	1848312210	OJTGHJNXEYPTHQ-YEUFIRJSSA-N	437.504	1.097	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)c2ccccc2c1=O	13082292	YLSJZFCSDSQOFX-UHFFFAOYSA-N	432.440	1.944	50	20	IDGD	
O=C(Cn1c(=O)ccn(Cc2ccccc2)c1=O)NNC(=O)c1ccc2ccccc2n1	21767812	WLDWTDLOGPELIY-UHFFFAOYSA-N	429.436	1.068	50	20	IDGD	
CCOc1ccc(N2C[C@@H](C(=O)NNC(=O)c3cc(Br)c[nH]3)CC2=O)cc1	23914361	MTZCGEPATCZVJK-NSHDSACASA-N	435.278	1.990	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)c1sccc1S(=O)(=O)N1CCCC1	25318458	WMXFBDCBTPGNPQ-GFCCVEGCSA-N	441.506	1.900	50	20	IDGD	
COc1ccc(C(=O)NCC(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)cc1[N+](=O)[O-]	25376565	GLVIFNVNZLRCRY-NSHDSACASA-N	434.380	1.087	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])c(O)c1)c1cccc(S(=O)(=O)N2CCCC2)c1	28196591	LMQMFWMVDWATKU-UHFFFAOYSA-N	434.430	1.160	50	20	IDGD	
O=C(NNC(=O)[C@H]1CC[C@@H](C(F)(F)F)NC1=O)c1ccc(F)cc1Br	195571186	ZZYOGDRJNYIGCI-WPRPVWTQSA-N	426.164	1.806	50	20	IDGD	
COc1cccc2c1OCC[C@H]2NC(=O)NNC(=O)c1csc(N2CCOCC2)n1	725874681	LRQFGRXWIGHXKX-CYBMUJFWSA-N	433.490	1.456	50	20	IDGD	
CN1CCN([C@@H](C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)c2ccccc2)CC1	727765757	QHKWVOJCTNAUJE-OAQYLSRUSA-N	434.500	1.328	50	20	IDGD	
Cc1noc(C)c1S(=O)(=O)N1CCC(C(=O)NNc2nc(-c3cccnc3)no2)CC1	728079181	OHNJLPABVXHHDA-UHFFFAOYSA-N	447.477	1.280	50	20	IDGD	
C[C@H](C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1)N1C(=O)[C@H]2CCCC[C@@H]2C1=O	728210075	QFAUNQHLYFQVJG-DQYPLSBCSA-N	434.518	1.134	50	20	IDGD	
COc1cccc(N2CC[C@@H](NC(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)C2)c1	728221469	VEEMPMCLNWFLEX-CQSZACIVSA-N	436.472	1.165	50	20	IDGD	
O=C(NCCc1ccc2c(c1)OCCO2)NNC(=O)C1CCN(c2ncccn2)CC1	728940515	ATMHJFIUHZSMSS-UHFFFAOYSA-N	426.477	1.037	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2F)cc1O)c1csc(N2CCOCC2)n1	729282378	UQKDSVOIKCYCDS-UHFFFAOYSA-N	432.437	1.085	50	20	IDGD	
CC(=O)N1c2ccc(S(=O)(=O)NNC(=O)Cn3ccc4ccccc43)cc2C[C@H]1C	729667784	XHOWLRGNSHRHBE-CQSZACIVSA-N	426.498	1.949	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCCC(=O)NNC(=O)c2cccc3ncccc23)cc1	730227602	HKLVSPSHBFRTJQ-UHFFFAOYSA-N	442.497	1.763	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)c1ccc(S(=O)(=O)N2C[C@H](C)O[C@H](C)C2)cc1	731491074	JZKADXLMKRVLKL-GASCZTMLSA-N	447.513	1.568	50	20	IDGD	
COC(=O)c1c(S(=O)(=O)NNC(=O)c2sc(-c3ccccc3)nc2C)n[nH]c1C	732045382	JMBQMEBUASZDPB-UHFFFAOYSA-N	435.487	1.560	50	20	IDGD	
O=C(CCCN1CCN(c2ccccc2)CC1)NNC(=O)c1nn(-c2ccccc2)cc1O	732262243	QFKITQLFSOAQQZ-UHFFFAOYSA-N	448.527	1.941	50	20	IDGD	
COc1cc(CCNC(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)ccc1O	734215673	MXEMNVMXYCLOBQ-UHFFFAOYSA-N	439.472	1.878	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)CN2C(=O)[C@@H](C)Oc3ccccc32)cc1C	736771652	SRIZDPDBEYXUFY-CYBMUJFWSA-N	445.497	1.737	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)c2c[nH]c(C(=O)N3CCCC3)c2)cc1C	736795692	ORHOBMLUALQQFT-UHFFFAOYSA-N	432.502	1.801	50	20	IDGD	
C[C@H](CC(=O)NNc1ccccc1S(C)(=O)=O)/N=C1/NS(=O)(=O)c2ccccc21	743366766	AIYAYDBAHLREDJ-GFCCVEGCSA-N	436.515	1.051	50	20	IDGD	
O=C(CCCS(=O)(=O)c1ccc(Br)cc1)NNc1ncnc2[nH]cnc12	743473005	INLSVVXKUSMXHC-UHFFFAOYSA-N	439.295	1.813	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)N[C@H]1CC(=O)N(CCOc2ccccc2)C1	743639638	XLCNNGGWGGNBCN-KRWDZBQOSA-N	426.473	1.248	50	20	IDGD	
Cc1cc(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)n2nc(C)cc2n1	744450321	RBUMTXMJUBYTHJ-UHFFFAOYSA-N	430.490	1.124	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)C[C@@H](c2ccccc2)N2CCOC2=O)cc1	744950406	LQIMXUMJHSLISP-SFHVURJKSA-N	436.424	1.446	50	20	IDGD	
CCc1ccc(C(=O)NNS(=O)(=O)c2ccc(OCCS(=O)(=O)CC)cc2)cc1	746352753	VKWMVQDHXNUJNU-UHFFFAOYSA-N	440.543	1.686	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)NCCOc1ncccc1F	747448898	BAVNQUJMOPUGIP-UHFFFAOYSA-N	430.484	1.142	50	20	IDGD	
O=C(NNS(=O)(=O)c1cccc(S(=O)(=O)NC2CC2)c1)c1ccc(Cl)cc1F	747617257	BHXOKKSICKQKIL-UHFFFAOYSA-N	447.897	1.543	50	20	IDGD	
CC(C)N1CCN(c2ccc(C(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)cc2)CC1	749160895	ORWZRYMFUBAGIM-UHFFFAOYSA-N	448.527	1.539	50	20	IDGD	
O=C(COC(=O)[C@H]1CCCN1C(=O)c1ccc2c(c1)OCO2)NNC(=O)c1ccccc1	750175200	CKJASJWKFGGNJK-MRXNPFEDSA-N	439.424	1.024	50	20	IDGD	
Cc1noc(C(F)(F)F)c1C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	750240006	PNDRROWAXUOBDW-UHFFFAOYSA-N	447.439	1.695	50	20	IDGD	
CNS(=O)(=O)CC(=O)NNC(=O)c1ccc(CSc2ccc(Cl)cc2)cc1	751558406	UFSNSSTWESYZSB-UHFFFAOYSA-N	427.935	1.943	50	20	IDGD	
C[C@@H]1CN(S(=O)(=O)c2cccc(C(=O)NNC(=S)N[C@H](C)C3CC3)c2)C[C@@H](C)O1	751619676	WIPLVGFMPGMFHB-MGPQQGTHSA-N	440.591	1.392	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2nc(-c3cnn(C)c3)oc2C)cc1OC	752604398	YWTOXLAJZDDOEX-UHFFFAOYSA-N	443.416	1.019	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)Cc2ccc(Cl)cc2)c(C)c([N+](=O)[O-])c1	753840776	NNRDWXCBHRAPLM-UHFFFAOYSA-N	448.819	1.672	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc(C(F)(F)F)c1	753841970	WIJLFMQQQSMLAQ-UHFFFAOYSA-N	447.373	1.660	50	20	IDGD	
COc1cc(C(=O)NNC(=O)N[C@H]2CCN(c3ncccc3F)C2)cc(OC)c1OC	755075258	PDFFCQGIXZGNFA-ZDUSSCGKSA-N	433.440	1.469	50	20	IDGD	
O=C(NNc1nc(C(F)(F)F)cs1)c1cccc(S(=O)(=O)N2CCOCC2)c1	755858167	NQIOXSRBXUKVIR-UHFFFAOYSA-N	436.437	1.940	50	20	IDGD	
COC(=O)c1nscc1S(=O)(=O)NNC(=O)c1ccc(OCCC(C)C)cc1	755959404	SPRBNUXVJMBGTJ-UHFFFAOYSA-N	427.504	1.978	50	20	IDGD	
COC(=O)c1cc(NC(=O)NNC(=O)c2c(C)nc3ccccn23)c(OC)c(OC)c1	756742812	PFRUVYRWROZACR-UHFFFAOYSA-N	427.417	1.913	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)Nc1ccc(OC)c(-n2cnnn2)c1	756744577	BIBCKCKMLKBEDB-UHFFFAOYSA-N	427.421	1.301	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Nc2ccc3c(c2)S(=O)(=O)CC3)cc(OC)c1OC	757708122	GAPXHFCTJZPFGS-UHFFFAOYSA-N	435.458	1.509	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)NCc2ccc3c(c2)CCS3(=O)=O)cc1	757739447	AEVWMVLYADFTDH-CQSZACIVSA-N	447.513	1.713	50	20	IDGD	
COCc1nc2n(n1)C[C@@H](NC(=O)NNC(=O)c1ccc(-n3c(C)ccc3C)cc1)CC2	757789397	RMJAYBTWUMPWIX-KRWDZBQOSA-N	437.504	1.791	50	20	IDGD	
Cc1nn([C@@H]2CCS(=O)(=O)C2)c(C)c1NC(=O)NNC(=O)CCc1ccccc1O	757871894	QTECGWJSCBNBGP-OAHLLOKOSA-N	435.506	1.351	50	20	IDGD	
NS(=O)(=O)c1ccc(NC(=O)C2CCN(CCI)CC2)cc1	759324430	VAOCZDYUMMGKFU-UHFFFAOYSA-N	437.303	1.420	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)[C@H]2CCCN(S(=O)(=O)c3ccc(C)s3)C2)nc1	759730237	GBAOVZQHZAPGCM-AWEZNQCLSA-N	438.531	1.782	50	20	IDGD	
COCCCNC(=O)NNC(=O)c1ccc(C)c(S(=O)(=O)Nc2ccc(F)cc2)c1	760450112	NZMDGHNPAIQRIQ-UHFFFAOYSA-N	438.481	1.915	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1)c1ccc(-n2cnnn2)cc1	763148236	BEYWAWGKBGNQDE-SFHVURJKSA-N	435.444	1.225	50	20	IDGD	
Cc1nnnn1/C(=C\c1ccccc1)C(=O)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	763173148	KQPXWFHVVLTRIB-ODLFYWEKSA-N	432.419	1.970	50	20	IDGD	
Cc1nc(C)n(-c2ccccc2NC(=O)C(=O)NNC(=O)c2ccc3ccccc3n2)n1	763449355	BPAMTPAGEQQBLA-UHFFFAOYSA-N	429.440	1.832	50	20	IDGD	
C[C@H]1CN(Cc2ccccc2NC(=O)C(=O)NNC(=O)c2ccccc2O)C[C@H](C)O1	763529733	LSRZCLSTZPLDNX-GJZGRUSLSA-N	426.473	1.401	50	20	IDGD	
Cc1cc(C(=O)N2CCSCC2)ccc1NC(=O)C(=O)NNC(=O)c1ccccc1F	763562024	RNVBLQXTSLZZSV-UHFFFAOYSA-N	444.488	1.723	50	20	IDGD	
CC(C)(C)c1ccc(OCC(=O)NNC(=O)C(=O)Nc2cnn(-c3ncccn3)c2)cc1	763599279	DHHGVZSHQQYMSF-UHFFFAOYSA-N	437.460	1.125	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)[nH]n1)C(=O)Nc1ccc(-c2csnn2)cc1	763613157	JKTLPGHWHAZDMS-UHFFFAOYSA-N	433.453	1.995	50	20	IDGD	
C=CCNC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)cc1	763674154	LPAYGISTWDJZNY-UHFFFAOYSA-N	436.428	1.031	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(C)n(-c2ccccc2)n1	763680457	FWEMVPKMJQDOGN-UHFFFAOYSA-N	437.456	1.744	50	20	IDGD	
Cc1ccc(C)c(-n2ncc(NC(=O)C(=O)NNC(=O)COc3ccc(C#N)cc3)c2C)c1	763681530	LFUAACNPDBATEK-UHFFFAOYSA-N	446.467	1.834	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(NC(=O)OC)c(F)c1	763684898	QBCJAXRNWLIZHD-UHFFFAOYSA-N	448.407	1.568	50	20	IDGD	
COc1cc(OC)c(OC)cc1NC(=O)C(=O)NNC(=O)COc1ccc(Cl)cc1	763685961	GRDMJZUHYYTWCR-UHFFFAOYSA-N	437.836	1.531	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)C(=O)Nc2cccc3cnccc23)c2ccccc2c1=O	763789884	FCTWMAUOKNNVSX-UHFFFAOYSA-N	444.451	1.925	50	20	IDGD	
CC(C)S(=O)(=O)c1ccccc1NC(=O)C(=O)NNC(=O)COc1ccc(F)cc1	763842153	CZSZRZHKBRASFV-UHFFFAOYSA-N	437.449	1.173	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)NNC(=O)C(=O)Nc1cccc(-c2nnnn2C2CC2)c1	763864541	DAJSXGNOXUAGPO-UHFFFAOYSA-N	444.455	1.485	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccccc2C[S@@](C)=O)cc1	763878669	SLZLSNGDVQSDCC-JKGBWWFKSA-N	445.497	1.321	50	20	IDGD	
O=C(CCSc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccc(-n2nccn2)cc1	763904198	YPLMCISIDHFIAF-UHFFFAOYSA-N	428.449	1.675	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(-c3nnco3)c2)cc1OC	763910276	BBKZGSPQMDDXSA-UHFFFAOYSA-N	439.428	1.934	50	20	IDGD	
CCN(Cc1cccc(NC(=O)C(=O)NNC(=O)c2cnccn2)c1)C(=O)OC(C)(C)C	764023717	DUUMKVVDFXIBTH-UHFFFAOYSA-N	442.476	1.633	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccccc1CN1C[C@H](C)O[C@H](C)C1	764047636	JPNAQPIZQZMHSY-IYBDPMFKSA-N	440.500	1.704	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)C2CCCC2)sc2c1CCSC2	764070006	HIZHFTPQRWGFTR-UHFFFAOYSA-N	425.532	1.990	50	20	IDGD	
CCC(CC)NC(=O)[C@H]1CN(C(=O)C(=O)NNC(=O)CC(F)(F)F)c2ccccc2O1	764114426	ARWRRCVCKFWZGX-CQSZACIVSA-N	444.410	1.185	50	20	IDGD	
CCOC(=O)N(C)c1ccc(NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)cc1	764154198	PBGDYUVLYNCOAP-QGZVFWFLSA-N	426.429	1.369	50	20	IDGD	
CCC(CC)NC(=O)[C@H]1CN(C(=O)C(=O)NNC(=O)c2ccoc2)c2ccccc2O1	764163286	IGMBIOYYKGUNMW-QGZVFWFLSA-N	428.445	1.140	50	20	IDGD	
CC(C)(C)CC(=O)NNC(=O)C(=O)Nc1cnc2c(c1)CN(C(=O)OC(C)(C)C)CC2	764198114	BWKAOGQUTGAGCJ-UHFFFAOYSA-N	433.509	1.897	50	20	IDGD	
CN(C)CC(=O)NNC(=O)C(=O)Nc1ccc(Oc2cccc(F)c2)c2ccncc12	764205057	XVCRXPOAFCXZIY-UHFFFAOYSA-N	425.420	1.814	50	20	IDGD	
Cc1ncsc1C(=O)NNC(=O)C(=O)Nc1cccc(CN2C[C@H](C)O[C@@H](C)C2)c1	764247205	ORVFYSSXGHZYRH-STQMWFEESA-N	431.518	1.460	50	20	IDGD	
COC(=O)c1sccc1NC(=O)C(=O)NNC(=O)c1cc(Br)ccc1O	764279853	GEUAGFWWWDDKGU-UHFFFAOYSA-N	442.247	1.403	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C(=O)Nc1ccc(F)cc1S(=O)(=O)CC)c1ccccc1	764328190	CFGVHWQQWYHLEQ-HNNXBMFYSA-N	435.477	1.899	50	20	IDGD	
Cc1ccc(NC(=O)C2CC2)cc1NC(=O)C(=O)NNC(=O)c1cnn(-c2ccccc2)c1	764350432	GIHDFHVMVHFEHB-UHFFFAOYSA-N	446.467	1.929	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2cccc3c2OCCO3)n[nH]1	764378291	YBFFOLCVKTWQMT-UHFFFAOYSA-N	437.412	1.256	50	20	IDGD	
Cc1nn(-c2ccccc2)cc1NC(=O)C(=O)NNC(=O)CSc1ccccc1O	764404287	HNWLSAWUQZAVFW-UHFFFAOYSA-N	425.470	1.765	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C2CCN(S(=O)(=O)c3ccc4c(c3)CCCC4)CC2)n[nH]1	765586499	YPLMVKPLYOTEBJ-UHFFFAOYSA-N	445.545	1.459	50	20	IDGD	
CS(=O)(=O)N1CCc2cc(C(=O)NNC(=O)c3cc(-c4ccc(F)cc4)[nH]n3)ccc21	765620011	UTQYAZUAKQSSAG-UHFFFAOYSA-N	443.460	1.613	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)NC[C@@H](c1ccc(F)cc1)N1CCOCC1	765626612	LVYSIJZLOMTEQX-SFHVURJKSA-N	436.509	1.929	50	20	IDGD	
O=C(NC[C@@H]1CCCCN1C1CC1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	765663877	RRAXXBRORFAXKA-SFHVURJKSA-N	449.577	1.432	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)CCCc3nc(C4CC4)no3)CC2)cc1	766649427	OZKPHNVITQKPKY-UHFFFAOYSA-N	440.548	1.543	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)[C@H](C)NS(=O)(=O)c2ccc(C#N)cc2)c(C)c1	767853055	LYPQETWWRZFSDM-HNNXBMFYSA-N	429.502	1.101	50	20	IDGD	
O=C1C[C@H](Cc2ccc(C(=O)NNC(=O)c3cc(-c4ccc(F)cc4)[nH]n3)cc2)C(=O)N1	768278560	HYXNMMBDYIULDR-HNNXBMFYSA-N	435.415	1.496	50	20	IDGD	
COc1cccc(C(=O)NNS(=O)(=O)c2cc([N+](=O)[O-])ccc2Br)c1O	768500558	XFCVQYIRXPFCJI-UHFFFAOYSA-N	446.235	1.695	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)[C@H]1CC(c2ccccc2[N+](=O)[O-])=NO1	768641597	SZKGRPYODRRSKD-OAHLLOKOSA-N	434.430	1.643	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)[C@H](Cc1ccccc1)n1nnnc1C	768645635	RLLWPSPQEMCDKS-HNNXBMFYSA-N	430.490	1.321	50	20	IDGD	
CC[C@H]1Oc2cc([C@H](C)NC(=O)NNc3nc(O)c4cnn(C)c4n3)ccc2NC1=O	770402039	NWFMTKSMFFSREN-TVQRCGJNSA-N	426.437	1.566	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)NCC(=O)N(C)CCc1ccccn1	770503335	LFSDIYVGABVPNZ-AWEZNQCLSA-N	433.896	1.534	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)N1CCC[C@H](CNS(C)(=O)=O)C1	770658833	PWWPQQSIAGKQGV-CHWSQXEVSA-N	432.930	1.109	50	20	IDGD	
CC(C)(C)OC(=O)N1CCSC[C@@H]1CC(=O)NNC(=O)COc1ccc(C#N)cc1	772048584	WPVCIRFKCKRIJD-HNNXBMFYSA-N	434.518	1.827	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)c1ccc(N2CCCS2(=O)=O)cc1Cl	772138703	GBFKLDVVHQETNF-LBPRGKRZSA-N	445.925	1.619	50	20	IDGD	
Cc1nn(C)c2sc(C(=O)N[C@@H](C)C(=O)O[C@@H](C)C(=O)NNC(=O)CC(C)C)cc12	772152192	AGKQDWBCLYLDEL-RYUDHWBXSA-N	437.522	1.187	50	20	IDGD	
O=C(CCc1nc(-c2ccsc2)no1)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772188720	TUYVSZBMUHDZGM-UHFFFAOYSA-N	433.877	1.848	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)N[C@H]1CCCO[C@H]1CC(C)C	773133238	XAPIEFVXPBRAIB-GJZGRUSLSA-N	425.555	1.826	50	20	IDGD	
COc1ccc(Cn2nccc2NC(=O)C(=O)NNc2nc(C)cc(C)n2)c(OC)c1	773482626	PMLIIPVYBWKIBZ-UHFFFAOYSA-N	425.449	1.437	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(NC(=O)C(=O)NNc2cnc3ccccc3n2)ccc1Cl	773715941	BCLBNADBLLWRJW-UHFFFAOYSA-N	448.892	1.615	50	20	IDGD	
O=C(NNc1cnc2ccccc2n1)Nc1cccc(S(=O)(=O)N2CCOCC2)c1	775416026	ZPITUMGBWYRACZ-UHFFFAOYSA-N	428.474	1.799	50	20	IDGD	
CN(NC(=O)CCc1cccc2c1OCO2)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776202096	QIAUPJXEYSDSET-UHFFFAOYSA-N	434.493	1.984	50	20	IDGD	
CNc1ccc(C(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)cc1[N+](=O)[O-]	776204751	FTLNGOPJDBERKR-UHFFFAOYSA-N	436.469	1.886	50	20	IDGD	
Cc1ccnc2c(S(=O)(=O)NNC(=O)c3csc(N4CCOCC4)n3)cccc12	777597664	WGGZLXOVUZXAJJ-UHFFFAOYSA-N	433.515	1.460	50	20	IDGD	
COC(=O)c1ccccc1NNC(=O)/C=C/C(=O)N1CCN(c2ccc(OC)cc2)CC1	778419560	MBZBMRBXUDCJKN-VAWYXSNFSA-N	438.484	1.830	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)[C@H]1CC(=O)N(c2cccc3ccccc23)C1	778432968	FFVHBDXUYNFXBA-HNNXBMFYSA-N	426.473	1.865	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)c2cc(S(=O)(=O)N(C)C)cn2C)cc1OC	778539215	YKWOTEBUUYCEGJ-UHFFFAOYSA-N	438.506	1.148	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccnn2Cc2ccc(F)cc2)c1	779458512	OPRMHQCSZAVTBA-UHFFFAOYSA-N	431.449	1.941	50	20	IDGD	
Cn1nnc2cc(C(=O)NNC(=O)c3nc(-c4ccccc4)n(-c4ccccc4)n3)cnc21	780979866	YIHUMCBTPNYASB-UHFFFAOYSA-N	439.439	1.686	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)Cc2cccc(N3CCCC3=O)c2)c2ccccc2c1=O	781864318	BGNVXFCAYILFRH-UHFFFAOYSA-N	447.495	1.937	50	20	IDGD	
COC(=O)c1ccc(NC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)c(OC)c1	782079818	OUHZFNXTCHYHKF-UHFFFAOYSA-N	425.401	1.840	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)c(OC)c1	782121118	UDYCODPARFBUQU-NSHDSACASA-N	433.392	1.174	50	20	IDGD	
CCCc1nc(C)c(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)s1	783264464	QULVEZHEWHNHAJ-UHFFFAOYSA-N	440.551	1.568	50	20	IDGD	
Cc1nn(-c2ccccc2)c(C)c1NC(=O)C(=O)NNC(=O)CNC(=O)c1cccs1	784004324	WICXJMYXQZBMQE-UHFFFAOYSA-N	440.485	1.067	50	20	IDGD	
CCOC(=O)c1cn(C)nc1NC(=O)C(=O)NNc1ccc(F)cc1Br	784802976	XWXKSNMATBOTSB-UHFFFAOYSA-N	428.218	1.580	50	20	IDGD	
Cc1ccc(-n2nc(-c3ccco3)cc2NC(=O)C(=O)NNc2nccn(C)c2=O)cc1	785086509	REHVCWCUIFIMHA-UHFFFAOYSA-N	433.428	1.616	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2cccc(N3C(=O)CN(C)C3=O)c2)cc1Cl	785117558	SUAUBTNXLCNMPO-UHFFFAOYSA-N	431.836	1.829	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)[C@H](Cc1ccccc1)n1nnnc1C	786133605	MMCKMKYSHSZRBZ-IBGZPJMESA-N	436.472	1.007	50	20	IDGD	
CCOC(=O)[C@](C)(CNC(=O)NNC(=O)[C@H]1COc2ccccc2O1)c1ccccc1	787311735	YSXDXQDXNPGWNA-XMSQKQJNSA-N	427.457	1.678	50	20	IDGD	
Cc1cc(F)cc(-n2cc(C(=O)OCC(=O)NNC(=O)c3ccc(Cl)cc3)nn2)c1	789057276	DZHPZBXLJYWTNC-UHFFFAOYSA-N	431.811	1.986	50	20	IDGD	
CC1(C)COc2c(C(=O)OCC(=O)NNC(=O)[C@@H]3COc4ccccc4O3)cccc21	789244958	JWTNZQJJWWWTOZ-KRWDZBQOSA-N	426.425	1.501	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc3c2OCC[C@@H]3OC)o1	790951442	FMSQRWGYFXHUNH-KRWDZBQOSA-N	444.488	1.991	50	20	IDGD	
CN(CC(N)=O)C(=O)c1cccc(NC(=O)C(=O)NNc2cc(Cl)ccc2Cl)c1	793035214	DAIFVSGYKAWWKB-UHFFFAOYSA-N	438.271	1.633	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C[C@@H]2COCCN2C(=O)OC(C)(C)C)cc1OC	794783056	BWKVBEULVMPAHM-OAHLLOKOSA-N	437.493	1.881	50	20	IDGD	
O=C(COC(=O)CCc1cnc2ccccc2c1)NNC(=O)[C@@H]1COc2ccccc2O1	795803740	DDTRBVHYFXAMQL-FQEVSTJZSA-N	435.436	1.698	50	20	IDGD	
Cc1cc(C)c(NC(=O)C(=O)NNC(=O)CNC(=O)OCc2ccccc2)c(Cl)c1	797369481	ZETJFPOMDRCNAV-UHFFFAOYSA-N	432.864	1.969	50	20	IDGD	
O=C(COC(=O)c1ccc(Br)cc1)NNC(=O)[C@H]1COc2ccccc2O1	797606150	BOPLTYYBKCONGP-OAHLLOKOSA-N	435.230	1.593	50	20	IDGD	
CC(C)[C@H](C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1)c1cccnc1	797949179	JOPCNPNRLATEMT-FQEVSTJZSA-N	431.562	1.901	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)c2nnn(CCOc3ccc(F)cc3)c2C)c1	800334025	FGTSPVNIAWNCGG-UHFFFAOYSA-N	441.423	1.233	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2ccc(OCC(F)(F)F)c(Cl)c2)CCS(=O)(=O)C1	800627613	NJYFYQVFHCZRMZ-CQSZACIVSA-N	443.831	1.418	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)/C=C/c1ccccc1)C(=O)NNC(=O)N=c1cc[nH]cc1	802030876	VLZQRILILXXBQW-SHRNQRGKSA-N	449.558	1.368	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)CCNS(=O)(=O)c2ccc(F)c(F)c2)cc1	802057235	OKLDODOQRZDIJM-UHFFFAOYSA-N	428.417	1.495	50	20	IDGD	
COc1ccc(C2=NO[C@@H](CNC(=O)NNC(=O)COc3ccccc3OC)C2)cc1F	802340281	HBEGJEMPPIVUBT-CQSZACIVSA-N	446.435	1.745	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1ccc(C(F)(F)F)nc1C	802573083	PWODYIRJOYETFX-UHFFFAOYSA-N	446.407	1.903	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCc2ccc(C[S@@](C)=O)cc2)cc(OC)c1OC	804865780	NXGXQHRUEUAVGG-SSEXGKCCSA-N	435.502	1.735	50	20	IDGD	
CCS(=O)(=O)N1CCN(C(=O)NNC(=O)c2ccc(Br)s2)[C@H](C)C1	804872860	UTKGJFSZLQRCCZ-SECBINFHSA-N	439.357	1.221	50	20	IDGD	
COCCn1cc(C(=O)NNC(=O)c2ccc(OC)c(Br)c2)c(=O)cc1C	806841297	VVZITLQPYXRPER-UHFFFAOYSA-N	438.278	1.649	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2cccc3cc(Br)cnc23)n1	806975172	PQHXMPRBSHMUEB-UHFFFAOYSA-N	445.277	1.597	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)C(=O)Nc1cc(Cl)cc2c1OCC(=O)N2	806978742	JLSGWRMISWAWNX-UHFFFAOYSA-N	441.831	1.412	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)C(=O)Nc1cc(Cl)cc2c1OCC(=O)N2)c1ccccc1	806979766	FXLXKKASPBLYGZ-CYBMUJFWSA-N	430.848	1.951	50	20	IDGD	
CCc1cc(NC(=O)C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)ccc1F	806992056	AJWFZGZXLBQUPC-UHFFFAOYSA-N	435.481	1.389	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(NC(=O)C(=O)NNc2nccnc2C2CCC2)ccc1F	807462016	GNIOUIGPFYDJKB-UHFFFAOYSA-N	436.469	1.215	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cnc3c(cnn3C(C)C)c2)cc1OC	811623425	KOAUNSHRUBIKCE-UHFFFAOYSA-N	441.444	1.647	50	20	IDGD	
CC1(C)NC(=O)N(c2cccc(NC(=O)NNC(=O)COc3ccc(C#N)cc3)c2)C1=O	812973009	QUOMWSKHHSPGGZ-UHFFFAOYSA-N	436.428	1.625	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCc2nncn2C1)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	814266747	YPLLMQUFXKYIRP-GOSISDBHSA-N	443.471	1.004	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)CSc2nnc3ccc(Br)cn23)cc1	814787666	SPFKDEWVRRXAHJ-UHFFFAOYSA-N	431.275	1.917	50	20	IDGD	
O=C(CC1CC1)NNC(=O)C(=O)Nc1ccc([N+](=O)[O-])c(I)c1	815568281	BRVSADTYNJVCBG-UHFFFAOYSA-N	432.174	1.085	50	20	IDGD	
O=C(NNc1ccnc(F)c1)C(=O)Nc1ccc([N+](=O)[O-])c(I)c1	815600811	FRULFYRTEAORLB-UHFFFAOYSA-N	445.148	1.815	50	20	IDGD	
COC(=O)c1scc(-c2ccc(C)cc2)c1NC(=O)C(=O)NNC(=O)[C@H]1CCCO1	815778775	FOHZAOJUDRDAQY-CQSZACIVSA-N	431.470	1.775	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3nn(C)cc3Br)CC2)cc1	815827161	OFQNQUXTYPDXSQ-UHFFFAOYSA-N	449.353	1.070	50	20	IDGD	
CC(C)CN1CCO[C@@H](CNC(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)C1	915922999	SDXACAZTYAASCN-INIZCTEOSA-N	444.536	1.278	50	20	IDGD	
CC(C)NC(=O)C(=O)NNC(=O)c1cccc(NC(=O)c2ccc(Br)cc2)c1	916111037	UIXSJSFNWXXDKD-UHFFFAOYSA-N	447.289	1.987	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NCCCN2C(=O)NC3(CCCCC3)C2=O)cc1	916267810	HWQOIECYGIOHFG-UHFFFAOYSA-N	431.493	1.349	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)NCC[C@@](O)(c1nccn1C)C(F)(F)F	916377581	DDRLYIRVSTUOPN-PIGZYNQJSA-N	447.389	1.497	50	20	IDGD	
COc1ncccc1CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	916399233	SPIIMLCJBIBXLM-UHFFFAOYSA-N	433.490	1.019	50	20	IDGD	
CC(=O)Nc1ccc(S[C@H](C)C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1	917108372	IRFBINAQQDPKLN-GFCCVEGCSA-N	435.527	1.990	50	20	IDGD	
O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)NNc1ccc(-n2cccn2)nn1	918220904	LTFFXKWYSOWULH-UHFFFAOYSA-N	426.456	1.589	50	20	IDGD	
O=C(NCc1cccc(CN2CCOCC2)c1)NNC(=O)c1ccc2c(c1)OCCO2	918223822	NPIYESSUXKNJFK-UHFFFAOYSA-N	426.473	1.434	50	20	IDGD	
COc1cccc(/C=C(/C#N)C(=O)OCc2nnnn2-c2ccc(S(C)(=O)=O)cc2)c1	918977142	RNLXHFIKEVDLPL-GDNBJRDFSA-N	439.453	1.725	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)CCNS(=O)(=O)c2ccc(F)c(F)c2)cc1	919835899	UOPFUXSRIJVBLA-UHFFFAOYSA-N	441.456	1.422	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)c2ccc(F)c(S(=O)(=O)NC(C)C)c2)cc1	920012328	NMZGYZWNZSBYLZ-UHFFFAOYSA-N	437.493	1.915	50	20	IDGD	
CCCNC(=O)CNC(=O)/C(C#N)=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	920852513	QKIVAJLLJKAUNM-GDNBJRDFSA-N	442.907	1.628	50	20	IDGD	
NC(=O)[C@H]1CCCN1Cc1cccc(NC(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)c1	920932989	ZFJQAUIGLIHCFV-HXUWFJFHSA-N	447.499	1.993	50	20	IDGD	
CCOCCCN1CC[C@@H](NC(=O)NNC(=O)c2cncn2-c2ccccc2)[C@H](C)C1	1116080431	ITUAMFDOCACGNP-IEBWSBKVSA-N	428.537	1.953	50	20	IDGD	
CCn1cc(C(=O)OCC(=O)NNC(=O)Cc2nc(C)cs2)c(=O)c2ccc(C)nc21	1251614640	IJFZXSXJMXTIDG-UHFFFAOYSA-N	443.485	1.037	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2cnn3ccccc23)c1	1261096147	DOWOEXCXJBKPFS-UHFFFAOYSA-N	444.517	1.509	50	20	IDGD	
COc1ccc2c(c1)OC[C@@H](NC(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1)C2	1319911590	NOHLQGIIRGMPAW-INIZCTEOSA-N	448.520	1.976	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc3c(c2)CNC3=O)C1	1779162078	JKLSSFKUSSAWKI-JBYIUTFZSA-N	449.935	1.311	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)CC34CCCN3CCC4)C2)C1	1781130560	BGCDSAHTUBTCND-OXJNMPFZSA-N	442.398	1.866	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)Cc3ccc(S(C)(=O)=O)cc3)CCO2)C1	1781212807	HJDREVJJMJVSQK-FXAWDEMLSA-N	442.965	1.480	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnn3ncccc13)C2)C(Cl)Cl	1782217635	RONBXLXWRMIMSI-RDTXWAMCSA-N	426.304	1.661	50	20	IDGD	
O=C1Cc2cccc(C(=O)N3CC[C@@]4(CN(C(=O)CCBr)CCO4)C3)c2N1	1782406238	CPFBNRHMKADSIG-LJQANCHMSA-N	436.306	1.410	50	20	IDGD	
Cc1cccn2ncc(C(=O)N3CC[C@@]4(C3)CN(C(=O)[C@H](F)Br)CCO4)c12	1782522165	UUPODZOWAGSLOW-MAUKXSAKSA-N	439.285	1.777	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](C)Br)C3)C2)c(O)c1	1783535756	CKDBBHVILAYIID-KPZWWZAWSA-N	427.295	1.628	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3occc3Br)CCO2)C1	1783874342	CZSQORXZXWVDOX-MLGOLLRUSA-N	435.702	1.739	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cc(C(F)(F)F)nn3C)CCO2)C1	1783877034	DMDDLTPHRVVQRI-MEDUHNTESA-N	438.834	1.136	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cc4cccnc4nc3O)CCO2)C1	1783880971	IVSYJGMVHLMPEB-MGPUTAFESA-N	434.880	1.033	50	20	IDGD	
Cc1ccc([C@@H](C)C(=O)N2CCO[C@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc1	1783936049	BJAASIUDRRNBLT-JPYJTQIMSA-N	430.549	1.301	50	20	IDGD	
O=C(c1cc2cccnc2nc1O)N1CCO[C@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783949848	MDOSIBHRHQEMER-SFHVURJKSA-N	425.272	1.583	50	20	IDGD	
CCOC(=O)N(CC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Cl)CCO2)Cc1ccco1	1784302906	MHFOKYJVUHEIFC-VQIMIIECSA-N	445.875	1.602	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(S(C)(=O)=O)cn3)[C@H]2C1	1785711034	XQNCOSUZQULVPD-FAYQHZLMSA-N	443.953	1.096	50	20	IDGD	
COc1ccnc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCBr)[C@H]3C2)c1	1786406490	WADDXDACFXBRQJ-NOLJZWGESA-N	426.311	1.469	50	20	IDGD	
C[C@H](Nc1ccccn1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)Br)C[C@@H]21	1788783334	QNJOYAXIKZCNLO-YXMSTPNBSA-N	439.354	1.645	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(O)c([N+](=O)[O-])c3)C[C@@H]21	1789867152	YMLHEQGMTNDOBZ-WSMBLCCSSA-N	425.869	1.911	50	20	IDGD	
COC(=O)Nc1cccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Cl)C[C@@H]32)c1	1789981741	SBDIAURLYYOIIT-QCEMKRCNSA-N	427.860	1.993	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(=O)ccn3C)C[C@@H]21	1790963486	TZDJHGXOLAPWPV-QEWYBTABSA-N	440.338	1.152	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)Oc3ccccn3)[C@H]2C1	1791627522	XIJHIGODXPIURK-VIQHNZTISA-N	425.913	1.082	50	20	IDGD	
CC(C)N1CCC[C@H]1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)Br)C[C@@H]21	1791811264	NJFPNUZUOQXJHK-WOYTXXSLSA-N	430.387	1.622	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Cl)C[C@@H]21	1792256350	LJXYPSCPCIRQLR-RZLSGREXSA-N	435.924	1.805	50	20	IDGD	
Cc1ccc(CCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)cc1F	1796187911	LKHXPAZUZTWBRU-WKCHPHFGSA-N	438.308	1.699	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ncn(-c3cccc(F)c3)n1)C2)[C@@H](F)Cl	1796361959	SLOJRWLSZZXLRO-BAESOJJISA-N	425.823	1.144	50	20	IDGD	
COc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)CBr)C3)nc1	1796727624	SPEGPIRINXZPAT-JFILPPLUSA-N	426.311	1.324	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(=O)C[C@H]1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](F)Cl	1796804909	RKSIHEGMNUPZND-XXUMUBMXSA-N	431.892	1.738	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H](C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](O)CCl)C3)C1	1797816684	ONCUNRNGISTVLO-IBEHDNSVSA-N	429.945	1.481	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1n[nH]c3ccc(C#N)cc13)C2	1797957255	JFBBSASZGBBYET-CCWDJLKJSA-N	441.564	1.489	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCNC(=O)OC(C)(C)C	1800170564	SUIKZHKLCFJPEY-JKJDWNRSSA-N	431.961	1.918	50	20	IDGD	
C[C@@H](CN)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](Br)Cc1ccccc1	1800436290	URXAXTYAEZVPPX-MWTISTBLSA-N	438.366	1.177	50	20	IDGD	
O=C1CC(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](Br)Cc2ccccc2)C1	1800436502	MCWZRCJHTFEZBB-UKBAYJJMSA-N	449.345	1.561	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1C[C@@H]1F)C2)[C@@H](Br)Cc1ccccc1	1800436630	NBPIQLWGOQLARJ-BQULAQKPSA-N	439.325	1.940	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Nc1cccnc1)C2	1800640194	YQEUVVMUFQOQKQ-BDLOOMQFSA-N	439.354	1.645	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc3c(c1)OCO3)C2	1800756268	LMJPWRVWMVRUDO-NASWQRNTSA-N	439.306	1.331	50	20	IDGD	
Cc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)Br)nn1C(F)F	1800760444	OKIHXNFUFRTRDY-HNCHTBHHSA-N	435.269	1.573	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc3snnc3c1)C2	1800760593	VCMMEVSXHSHWDG-MGAJZRQESA-N	440.323	1.073	50	20	IDGD	
CCOC(=O)c1ncn2c1CC[C@@H](C(=O)N1[C@H]3CC[C@@H]1C[C@H](NC(=O)[C@H](F)Cl)C3)C2	1801422433	URZKFJQPOLIWRA-MPZWGZMNSA-N	440.903	1.795	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C#Cc1ccc(Cl)cc1)C2	1802333831	CUOHERFNNNGQPC-REPLKXPHSA-N	430.936	1.703	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc3nc[nH]c3c2)[C@H]1c1cccnc1)[C@@H](O)CCl	1803143118	UKIDLCJRNSPFMP-SNRMKQJTSA-N	427.892	1.877	50	20	IDGD	
C[C@H](Cc1ccncc1)C(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]1c1cccnc1	1803148890	YEAFSKWJNHHQRC-XLNTUCKNSA-N	430.936	1.961	50	20	IDGD	
O=C(CCC1CCC1)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1803370120	JQMDEYHILXQWCM-NFBKMPQASA-N	435.333	1.661	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC2(CCCN(C(=O)C(=O)C3CC3)C2)CC1	1805426524	STUYZUKIBBRYGV-BUVRLJJBSA-N	427.505	1.331	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@H](CNC(=O)CCN2CCOCC2)[C@@H]1c1cccnc1	1806951900	ISRJOEOCCAJQBK-UGKGYDQZSA-N	448.640	1.661	50	20	IDGD	
C[C@]1(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)CC=CCC1	1807375603	UFHNORJCYLNVFF-LFAGZIFBSA-N	447.344	1.827	50	20	IDGD	
CCc1ccc(C(=O)N2CCC3(CCCN(C(=O)c4cccc(B(O)O)c4)C3)CC2)cn1	1809974880	FJFUUXAYTVRIPS-UHFFFAOYSA-N	435.333	1.482	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2cccc(=O)n2C)[C@@H]1c1cccnc1	1813029142	CIICUAFBMVFGSO-TXPKVOOTSA-N	432.908	1.354	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H]3CCC(=O)N3)sc2C1	1814061510	HDLYIOJVMMYKTQ-NGZCFLSTSA-N	429.340	1.507	50	20	IDGD	
CCOC(=O)C(C)(C)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1	1814166735	IYXGESYIPWZTSQ-HRCADAONSA-N	425.913	1.276	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)CCSC(=N)N)sc2C1	1814952166	PQLRYFHWCHKVHK-JGVFFNPUSA-N	434.385	1.855	50	20	IDGD	
COc1ccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)cn1	1815441341	UYDZHOAPHUQFBZ-SFHVURJKSA-N	449.276	1.113	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)C(F)(F)C(F)(F)C(=O)O)CC2)[C@H](F)Cl	1817116379	XHBOHGGKWUGCOV-FFWSUHOLSA-N	435.758	1.945	50	20	IDGD	
CC(C)O[C@H](C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1	1817476142	HHKSOKZRHHEZBI-RDTXWAMCSA-N	428.298	1.209	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCN(C)C)[nH]n1	1818111795	IADVICZEWSCEQC-PTZPRWATSA-N	442.524	1.488	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3ccc4ncnn4c3)sc2C1	1819402817	QGGADOCFRDJJKC-NWDGAFQWSA-N	434.909	1.665	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2C[C@@]2(F)Cl)[nH]n1	1819404779	YRRSXDYYTPQGKB-PJFSTRORSA-N	449.874	1.639	50	20	IDGD	
CNC(=S)NCCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)C(C)(C)CCl)CC2	1819801469	MRMBXXVKPBKNCU-JTQLQIEISA-N	432.015	1.804	50	20	IDGD	
COC(=O)CSCC(=O)N[C@@H]1CCc2nc(NC(=O)CO[Si](C)(C)C)sc2C1	1820159966	CQIXXCBZIGBENZ-LLVKDONJSA-N	445.639	1.813	50	20	IDGD	
Cc1cc(C)cc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2ccc(B(O)O)cc2)CC3)c1	1822155011	GHEVYHMHHPFKIL-GOSISDBHSA-N	449.341	1.979	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CNC(=O)c2cccnc2)[nH]n1	1822366983	GFENZSGXPDBQDT-GOEBONIOSA-N	448.911	1.481	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](N)Cc2cccnc2)[nH]n1	1822368923	JPCAKUXRKQNYQE-YQQAZPJKSA-N	434.928	1.621	50	20	IDGD	
Cc1cn(CC(=O)Nc2cc([C@H]3CCCCN3C(=O)[C@@H](F)Cl)[nH]n2)c(=O)nc1O	1823366810	DIENOWYPMMDAKV-BXUZGUMPSA-N	426.836	1.207	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)C2=CCCS2)CC1	1824564132	XRUTUCICWOQRGV-IBGZPJMESA-N	428.363	1.621	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CN2CC(=O)NC2=O)CC1	1824968554	QDYUNLULQFMJMJ-HNNXBMFYSA-N	426.945	1.423	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CNC(=O)N(C)C)CC2	1825632117	PKINLGAOEKBSBX-IUCAKERBSA-N	432.344	1.110	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1nc[nH]c1[N+](=O)[O-])CC2	1825999482	XAHVQFNLQCDGAT-YUMQZZPRSA-N	428.858	1.254	50	20	IDGD	
C#CCCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1)CC2	1828091848	VSPAEQBPOWDRQS-CJCQAYSXSA-N	426.502	1.603	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccc(OC)c(O)c3)CCO2)C1	1830246102	CMMGNVXDQVZEFU-KKSFZXQISA-N	440.924	1.417	50	20	IDGD	
Cc1cc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)on1	1830535643	RPQITNWKGJDDDY-ACJLOTCBSA-N	444.326	1.013	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CC=CCC3)C2)C1	1830543326	PYLONSZEOWEGFX-GJYPPUQNSA-N	429.355	1.830	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3Cc4ccccc4O3)C2)C1	1831651822	SWGSOWBRBPLEQU-KPLVRAHFSA-N	436.936	1.854	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc4c3NC(=O)C4)C2)C1	1831653277	DFNZENHVQXRFGT-VGOFRKELSA-N	449.935	1.659	50	20	IDGD	
O=C(c1c(F)ccnc1Cl)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1833257564	SVXSUFYERVPEOM-INIZCTEOSA-N	440.686	1.748	50	20	IDGD	
CC(C)N(C)CC(=O)N1CCC(N2CCC(NC(=O)[C@H](C)CBr)CC2)CC1	1833266324	ZIQGNXPCPPWGBB-MRXNPFEDSA-N	445.446	1.929	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)Cc3nc(C)no3)CC2)CC1	1833532415	OBNTXJQZAVATON-KRWDZBQOSA-N	425.961	1.900	50	20	IDGD	
C[C@@H](Cn1cccn1)C(=O)NC1CCN(C2CCN(C(=O)CO[Si](C)(C)C)CC2)CC1	1833889919	HKANGTNNCRXITJ-SFHVURJKSA-N	449.672	1.942	50	20	IDGD	
Cn1cccc1C(=O)NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1834100564	RZUICBJVZSABSN-MRXNPFEDSA-N	429.334	1.901	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(O)n3)CCO2)C1	1834197706	VKASFADZOTZPPV-ACJLOTCBSA-N	442.310	1.031	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cc(F)cn3C)CC2)CC1	1835249599	YDXIRSCRVUFYJF-KRWDZBQOSA-N	428.936	1.603	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC1CCN(C2CCN(C(=O)c3cccnn3)CC2)CC1	1836400194	YPELBLJZJUQLFY-IBGZPJMESA-N	428.364	1.898	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)c3ncn(C)n3)CC2)CC1	1837383554	VCMQFYJYTNNAOA-OAHLLOKOSA-N	442.358	1.601	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3c[nH]c4cnccc34)C2)C1	1837713109	HRCBVLGWRGOUHS-OAQYLSRUSA-N	446.580	1.484	50	20	IDGD	
CCc1cnc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCBr)C3)C2)s1	1837720078	CBOLWEAYQRRUMH-QGZVFWFLSA-N	446.367	1.561	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(-c4ccncc4)[nH]n3)CCO2)C1	1838012617	QLAYJZPMKIDODN-KKSFZXQISA-N	447.923	1.559	50	20	IDGD	
Cc1ccn(C)c1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1838821355	KQFFGGIAMYGVEZ-RHSMWYFYSA-N	432.290	1.094	50	20	IDGD	
Cc1ccccc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1838900167	OWCVUOCWWPQUQT-CRAIPNDOSA-N	429.286	1.756	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(N(C)C)c3)CCO2)C1	1838925452	UQIPEOXZDOHQSI-WIYYLYMNSA-N	439.940	1.076	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C=C/c3ccoc3)C2)C1	1839150264	HHUNZXKDIUPCPX-CJIROOEOSA-N	431.316	1.986	50	20	IDGD	
O=C(Cc1ccc([N+](=O)[O-])cc1F)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1839788367	DAKQHNMUVQNIPR-FUHWJXTLSA-N	447.822	1.267	50	20	IDGD	
C=CCOCCCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](Br)CC)CCO2	1839962480	GYOYUSASDRWCQL-VQIMIIECSA-N	447.370	1.599	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3occc3C)C2)C1	1839964065	FJQTWWKPNKKHHZ-KBXCAEBGSA-N	429.311	1.832	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccc(F)cn3)C2)C1	1840031915	GTGZDJDCFLAZJJ-SCLBCKFNSA-N	444.301	1.003	50	20	IDGD	
Cc1cc(/C=C/C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)no1	1840033609	LDJWCQSUGLSFEF-MRSWZFEJSA-N	442.310	1.236	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)c(F)c1	1840034653	SBFBHUIOHNCCDF-KUHUBIRLSA-N	443.313	1.988	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)Cn1ccnc1)CCO2	1840429524	VYTXBQOMHZPUGM-FUHIMQAGSA-N	426.945	1.383	50	20	IDGD	
COc1ccc(Cl)c(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)c1	1840653077	NRDOBQWTNRASRN-VQIMIIECSA-N	447.315	1.018	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC12CN(C(=O)[C@H](O)NC(=O)OC(C)(C)C)C2	1841288574	CXFYYSQCVGEQPD-NEPJUHHUSA-N	434.331	1.064	50	20	IDGD	
CC(=O)N(C)[C@@H](C)C(=O)N1CC2(CCCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C1	1841924894	MSOKABLQNJUNNV-ZFWWWQNUSA-N	444.960	1.189	50	20	IDGD	
CS(=O)(=O)c1ccc(C(=O)N2CCCC23CN(C(=O)CCBr)C3)nc1	1842254490	IOCGOOBPXLZUPH-UHFFFAOYSA-N	430.324	1.087	50	20	IDGD	
COc1ccc(CC(=O)N2CC3(CCCN3C(=O)c3cccc(B(O)O)c3)C2)c(Cl)c1	1843013074	FTKCCCLZTULIKO-UHFFFAOYSA-N	442.708	1.088	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2cccc(C(F)(F)F)n2)C1	1844454051	KYNMXWCKXPXEEF-UHFFFAOYSA-N	448.405	1.230	50	20	IDGD	
COc1cc(N2CCC(C(=O)N3CC[C@H]4[C@@H]3CCN4C(=O)C(Cl)Cl)CC2)ncn1	1847667910	HVPKUDDDQMULRK-KBPBESRZSA-N	442.347	1.707	50	20	IDGD	
COc1ccc(C(=O)NCC(=O)NNC(=O)c2cn(C)c3ccccc23)cc1[N+](=O)[O-]	26938297	RGLPOQDSBYTSNW-UHFFFAOYSA-N	425.401	1.286	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCN(Cc3cccc(C)c3)CC2)cc1OC	29052606	YIQFZLYNMUAZEF-UHFFFAOYSA-N	426.517	1.591	50	20	IDGD	
Cc1nn(C)c(C)c1CCC(=O)NNC(=O)c1ccc(CSc2nncn2C)cc1	38663654	KMUWGWQOAYWPHN-UHFFFAOYSA-N	427.534	1.852	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)CCNS(=O)(=O)c2ccc3c(c2)CCCC3)c1	104747802	SBIPFUYQLYVTEN-UHFFFAOYSA-N	445.541	1.769	50	20	IDGD	
CC(C)[C@H](NC(=O)NNC(=O)CNC(=O)c1cccs1)c1ccc2c(c1)OCCO2	725871757	KXKQHWCOCLVZIR-SFHVURJKSA-N	432.502	1.977	50	20	IDGD	
O=C(CCN1C(=O)CCC1=O)NNC(=O)COc1ccc(OCc2ccccc2)cc1	726002490	QJOVWVJHZRJOFU-UHFFFAOYSA-N	425.441	1.331	50	20	IDGD	
C[C@H](NC(=O)NNc1ccc(-n2cccn2)nn1)c1cc(F)ccc1N1CCN(C)CC1	726278657	LMXUWJWKNMSDNA-HNNXBMFYSA-N	439.499	1.941	50	20	IDGD	
C[C@H](C(=O)NNC(=O)c1ccc(COc2ccccc2)o1)N1C(=O)NC2(CCCC2)C1=O	726523273	MIGCWROVOXOOTO-CQSZACIVSA-N	440.456	1.873	50	20	IDGD	
Cc1nc(S(=O)(=O)NCCC(=O)NNC(=S)Nc2ccccc2C(C)C)cn1C	727174432	NTJJSEXVJHZPRF-UHFFFAOYSA-N	438.579	1.538	50	20	IDGD	
CN(C)CCNC(=O)c1cccc(CNC(=O)NNC(=O)c2cc3c(s2)CCC3)c1	727480130	VJNBTYBBCJEYSD-UHFFFAOYSA-N	429.546	1.672	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)CCn2c(=O)nc(O)c3ccccc32)cc1F	727498083	IBPVNPLJVBTYCL-UHFFFAOYSA-N	431.449	1.658	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@@H](c2ccccc2)N2CCN(C)CC2)c2ccccc2c1=O	727765120	HJXWGYHGGOILFM-OAQYLSRUSA-N	448.527	1.166	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2c(Cl)cccc2Cl)cc1	727860972	LKXRRQQEMUIOPU-UHFFFAOYSA-N	444.296	1.936	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)CCc3nc4ccccc4o3)cc2)CC1	728213285	IKDDKYUYUFRQKD-UHFFFAOYSA-N	443.529	1.840	50	20	IDGD	
Cc1nc(C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)nn1-c1c(Cl)cccc1Cl	728234298	OWNVSOWXNMEVCJ-SECBINFHSA-N	432.289	1.078	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)c1ccc2c(c1)CC(=O)N2C	728307937	QCLSKWBYAGSCDV-LBPRGKRZSA-N	430.486	1.314	50	20	IDGD	
N#Cc1ccc(N2CCC[C@H]2C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1	728348269	MJEZOPACGQROPQ-SFHVURJKSA-N	437.412	1.440	50	20	IDGD	
O=C(CN1C(=O)[C@@H]2[C@@H](C1=O)[C@H]1C=C[C@H]2C1)NNC(=O)c1cc(F)ccc1Br	728549691	NUYRPLJLMSIYEP-DMAMZFHHSA-N	436.237	1.156	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2cnn(C)c2-n2c(C)ccc2C)n1	728729575	PZQNTZHONSDKFC-UHFFFAOYSA-N	430.490	1.139	50	20	IDGD	
CN1CCN(C(=O)c2ccc(CNC(=O)NNC(=O)Cn3ccc4ccccc43)cc2)CC1	729498186	WPPWCXUZIVOZMN-UHFFFAOYSA-N	448.527	1.560	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)c1cccc(CN2CCS(=O)(=O)CC2)c1	730032678	DHQHGAGQRUKIAS-UHFFFAOYSA-N	431.514	1.016	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)c1ccc(S(=O)(=O)NC[C@H]2CCCO2)cc1	730034223	CSYCXBGPFHFLKF-QGZVFWFLSA-N	447.513	1.243	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)NCCCN1CCCCC1=O	730129404	OTRRRDIODKNYLF-UHFFFAOYSA-N	427.299	1.561	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCN(c2ccc3c(c2)OCCO3)C1=O)c1cc(Cl)ccc1O	730585515	GWADDZAHKDLFPU-ZDUSSCGKSA-N	431.832	1.631	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)[C@H](c2ccccc2)N2CCC(O)CC2)cc1	731249559	TWSIZYDMFKYBIV-NRFANRHFSA-N	425.485	1.497	50	20	IDGD	
C[C@@H](NC(=O)CCC(=O)NNC(=O)c1ccc[nH]1)C(=O)c1ccc(Br)cc1	732053008	WACRPQZXKXMZQM-LLVKDONJSA-N	435.278	1.706	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)CCC[S@@](=O)c2ccc(Br)cc2)n1	732259855	YUBQOAOUWKWFBP-AREMUKBSSA-N	441.351	1.998	50	20	IDGD	
C[C@H](C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)N1CCN(c2ccc(F)cc2)CC1	732269605	IHYFFODYFAPOAW-OAHLLOKOSA-N	448.520	1.201	50	20	IDGD	
O=C(COC(=O)c1ccc2c(c1)CCCC(=O)N2)NNC(=O)c1cccc([N+](=O)[O-])c1	732327824	MCDKIOFJYVNOKQ-UHFFFAOYSA-N	426.385	1.488	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccccc1F)NNC(=O)NCc1ccc(Cl)cc1	733003919	SXYHBIXMOIXALV-UHFFFAOYSA-N	428.873	1.678	50	20	IDGD	
CCOCCCn1c(NNC(=O)[C@@H](C)NC(=O)c2ccoc2)nc2ccccc2c1=O	733266971	RJKOABZWHWZGDU-CQSZACIVSA-N	427.461	1.678	50	20	IDGD	
C[C@H]1CN(Cc2ccccn2)CCC1=NNC(=O)Cc1csc(N2CCOCC2)n1	734364328	YUMBVJNRNOPNQO-INIZCTEOSA-N	428.562	1.931	50	20	IDGD	
COc1ccc([C@@H]2[C@@H](C(=O)NNc3nc4ccccc4c(=O)n3C)CCC(=O)N2C)cc1	734438747	QKRBUYWWWYFSQM-FXAWDEMLSA-N	435.484	1.995	50	20	IDGD	
NS(=O)(=O)c1ccc(F)c(CNC(=O)NNC(=O)CCSc2ccc(F)cc2)c1	734674226	RUMVOCYTWKQGFC-UHFFFAOYSA-N	444.485	1.625	50	20	IDGD	
C[C@H](Oc1cccc(F)c1)C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	735117751	HOOKISUYJHUUFD-AWEZNQCLSA-N	437.497	1.067	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cnn(C)c2)cc1S(=O)(=O)N1C[C@@H](C)C[C@@H](C)C1	735445448	VKWQIFTVRYNHJQ-OKILXGFUSA-N	449.533	1.170	50	20	IDGD	
C[C@H]1CN([C@H](CNC(=O)NNC(=O)c2cnn(C)c2)c2c(F)cccc2Cl)CCO1	735580208	RYRAXPWKPYZEGY-BLLLJJGKSA-N	438.891	1.619	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cccc(-n3cccn3)n2)c1	736543391	JHKHNHWCQDBDQZ-UHFFFAOYSA-N	442.501	1.373	50	20	IDGD	
CC(C)(CC(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1)NC(=O)OC(C)(C)C	739681442	ZFUYSCSPTYRSOL-UHFFFAOYSA-N	448.929	1.442	50	20	IDGD	
CCn1c(NNC(=O)CC[S@](=O)c2ccc3c(c2)OCCO3)nc2ccccc2c1=O	740739980	SFCFIBAWBFBIFX-HKBQPEDESA-N	442.497	1.829	50	20	IDGD	
COc1nc(N)nc(N2CCCC2)c1C=NNC(=O)c1cc(Br)ccc1O	741771060	ZFCNTYJPSRBCJB-UHFFFAOYSA-N	435.282	1.900	50	20	IDGD	
O=C(NN=Cc1c(N2CCOCC2)nc2ccccn12)c1nn(-c2ccccc2)cc1O	741812470	VCFUTVUXWXCHPW-UHFFFAOYSA-N	431.456	1.826	50	20	IDGD	
O=S(=O)(Cc1ccon1)N1CCN(S(=O)(=O)c2ccc(CCCl)cc2)CC1	742334890	VESFYXPZJNFRAC-UHFFFAOYSA-N	433.939	1.292	50	20	IDGD	
CCn1c(=O)c(C(=O)/C(C#N)=C\c2cnn(CCOC)c2)c(N)n(Cc2ccccc2)c1=O	742350189	SGXHGXZFKGXFND-WQRHYEAKSA-N	448.483	1.293	50	20	IDGD	
Cn1ccc(N2CCC[C@H](NC(=O)NNC(=O)c3ccc(Br)s3)C2=O)n1	743518715	QNFLNKITYADRMD-VIFPVBQESA-N	441.311	1.384	50	20	IDGD	
CS(=O)(=O)c1cc(C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)ccc1Cl	744549695	RLJSYJQSHFMCES-UHFFFAOYSA-N	435.845	1.233	50	20	IDGD	
Cc1ccc(N2CC[C@H](NC(=O)NNC(=O)COc3ccccc3[N+](=O)[O-])C2=O)cc1	745860095	ZCZOIJDIQQYVBV-HNNXBMFYSA-N	427.417	1.418	50	20	IDGD	
C[C@@H](CC(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)C(=O)c1cccc(F)c1	746088170	QVYKLRQOOPSWSF-LBPRGKRZSA-N	431.376	1.947	50	20	IDGD	
O=C(NCc1ccc(F)cc1F)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	746963835	NWIZACZLZYIHBA-UHFFFAOYSA-N	438.456	1.894	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@@H]1CCCN1Cc1ccc(F)cc1	747348867	XAJMLBSSJAUKTB-KRWDZBQOSA-N	447.536	1.853	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)NCc1cc(Br)ccc1OC(F)F	748628399	VLYQRCWKIYMPRM-SECBINFHSA-N	440.241	1.932	50	20	IDGD	
COCCNS(=O)(=O)c1c[nH]c(C(=O)NNc2ccc(OCC(F)(F)F)cc2)c1	748694957	XANAYFDUDWGTHS-UHFFFAOYSA-N	436.412	1.637	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)Cn3cc(Br)c(O)nc3=O)cc2C1	751442524	KLHCGKRZHJMKDI-MRVPVSSYSA-N	441.307	1.359	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)NCc2ccc([S@](C)=O)cc2)c2ccccc2c1=O	753053171	YYNPKJJBZUPZGQ-HKBQPEDESA-N	441.513	1.859	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)N[C@H]1CCCN(Cc2ccccn2)C1=O	753299309	QKPDGYKFFZBLPM-YOEHRIQHSA-N	429.452	1.510	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)c1ccc(S(C)(=O)=O)cc1	753310568	VLMBYRKNSZKEBF-GFCCVEGCSA-N	428.511	1.049	50	20	IDGD	
COC(=O)c1cc2c(cc1NC(=O)C(=O)NNc1ccc(Br)cn1)OCO2	753853978	ZSFNEXNVYPCVBP-UHFFFAOYSA-N	437.206	1.441	50	20	IDGD	
O=C(Cc1cc[nH]n1)NNC(=O)C1CCN(C(=O)c2ccc(Br)cc2)CC1	755285451	DAYGGGZTRFTKNP-UHFFFAOYSA-N	434.294	1.415	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)Nc2cccc(S(=O)(=O)N3CCOCC3)c2)c1	755353520	JSYBAZBKOJEPFI-UHFFFAOYSA-N	448.501	1.248	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccc3c(c2)CCC(=O)N3)c1	755637382	SYDUOHUUZPFIEI-UHFFFAOYSA-N	431.474	1.288	50	20	IDGD	
C#CCOc1ccc(F)cc1NC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1	756758158	SHHWHVFSUSZGFO-UHFFFAOYSA-N	448.476	1.620	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1N1CCOC1=O	756814021	XDDJGQSNPKQRDW-UHFFFAOYSA-N	448.457	1.522	50	20	IDGD	
COc1ccccc1N1CC[C@H](NC(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)C1=O	757287895	UTOQQWYNDFNDNC-ZDUSSCGKSA-N	429.389	1.059	50	20	IDGD	
CCOC(=O)Cn1cccc(NC(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)c1=O	757766044	YHAVQNWDCUDJMY-UHFFFAOYSA-N	442.407	1.407	50	20	IDGD	
O=C(NCc1cccc(NC(=O)c2ccccc2)c1)NNC(=O)C(=O)Nc1ccccn1	758685788	LPUCOWQARWLUOC-UHFFFAOYSA-N	432.440	1.803	50	20	IDGD	
O=C(NNC(=O)C(=O)Nc1ccccn1)N[C@H]1CCN(c2ccc(C(F)(F)F)cc2)C1	758784300	CLNONOQYGGCNMS-ZDUSSCGKSA-N	436.394	1.648	50	20	IDGD	
Nc1cc(C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)ccc1Br	760546843	YXPMXTXJTOMNQQ-UHFFFAOYSA-N	437.206	1.558	50	20	IDGD	
CCn1c(CCC(=O)NNc2ncc(F)cn2)nc2cc(S(=O)(=O)N(C)C)ccc21	760912000	KZRWJDIYRYPZQY-UHFFFAOYSA-N	435.485	1.312	50	20	IDGD	
O=C(Cc1csc(NC(=O)c2ccco2)n1)NNc1nccc(N2CCOCC2)n1	762853751	VFTYKQJJYYCPGZ-UHFFFAOYSA-N	429.462	1.301	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)c2ccc3c(c2)C(=O)N(C[C@H]2CCCO2)C3=O)n1	762909726	VNHXNEPJRJXUJJ-OAHLLOKOSA-N	438.488	1.855	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cccc(OC(F)(F)F)c2)c1	763117520	VSTYEPBJKHWABS-UHFFFAOYSA-N	431.392	1.910	50	20	IDGD	
Cc1cc(N2CCOCC2)ccc1NC(=O)C(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	763444764	AHMYAEMYNDXTCG-UHFFFAOYSA-N	427.417	1.140	50	20	IDGD	
CN(C)CCOc1ccc(NC(=O)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1Cl	763468632	OPZAEWADFSYMCW-UHFFFAOYSA-N	449.851	1.588	50	20	IDGD	
CCOc1cc2c(cc1NC(=O)C(=O)NNC(=O)c1ccc3c(c1)OCO3)O[C@H](C)C2	763550587	GKPXVVXWZBQFAU-LLVKDONJSA-N	427.413	1.537	50	20	IDGD	
O=C(NNC(=O)C1CC1)C(=O)Nc1ccc(NC(=O)[C@@H]2CCCO2)cc1C(F)(F)F	763559060	XLDNMSKUCPXCIR-ZDUSSCGKSA-N	428.367	1.319	50	20	IDGD	
COC(=O)c1ccc(N2CCCC2)c(NC(=O)C(=O)NNC(=O)c2ccccc2F)c1	763568929	POIVJLDBHIFRTM-UHFFFAOYSA-N	428.420	1.612	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(NS(C)(=O)=O)c(Cl)c2)c(C)o1	763584120	SCXVUXVKOQYPNY-UHFFFAOYSA-N	428.854	1.321	50	20	IDGD	
COC(=O)c1cc(F)ccc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccccc2)[nH]n1	763603979	GEMJGLSVJLKOHO-UHFFFAOYSA-N	425.376	1.402	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCOC[C@H]1C[C@@H](O)c1ccccc1	763636766	SWFCPTJVZSIGDR-IEBWSBKVSA-N	447.919	1.934	50	20	IDGD	
CN1CCc2ccc(NC(=O)C(=O)NNC(=O)COc3cccc(C(F)(F)F)c3)cc21	763640021	NRTCOOIIQNJDJD-UHFFFAOYSA-N	436.390	1.863	50	20	IDGD	
Cn1cnnc1-c1cccc(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)c1	763686466	MLAUNOCSLLLGSE-UHFFFAOYSA-N	428.836	1.300	50	20	IDGD	
O=C(NNC(=O)C12CC3CC(CC(C3)C1)C2)C(=O)Nc1cc(-n2cnnn2)ccc1F	763728559	WJRZLBCYKNTBSQ-UHFFFAOYSA-N	427.440	1.104	50	20	IDGD	
Cn1ccnc1-c1csc(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)n1	763746493	YPMWUDDVRKAINJ-UHFFFAOYSA-N	439.501	1.082	50	20	IDGD	
COC(=O)c1c(C2CC2)csc1NC(=O)C(=O)NNC(=O)COc1ccccc1C#N	763809552	WRYYOOSBGFXJEA-UHFFFAOYSA-N	442.453	1.449	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cccc3c2OCCO3)cc1	763859811	GBABCIPIGYCKCH-CYBMUJFWSA-N	429.429	1.410	50	20	IDGD	
CC[C@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)cc1	763864251	HKCMXGWNOKZINP-UONOGXRCSA-N	444.463	1.907	50	20	IDGD	
Cc1nnc(-c2cccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc3ccccc3F)c2)o1	763864477	JSSMVGVEWPKGLQ-LLVKDONJSA-N	427.392	1.738	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cccc(C(=O)N(C)C)c2)ccc1OC(C)C	763916025	GESIUFYXRKLDLF-UHFFFAOYSA-N	442.472	1.584	50	20	IDGD	
CNC(=O)c1ccc(C)c(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CC[C@@H](C)C3)c1	763941972	ZTVNHRRVLHXUNO-LLVKDONJSA-N	428.514	1.941	50	20	IDGD	
CC(C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cccc(Br)c2)cc1	764059412	UTBGKMMIDMUAES-UHFFFAOYSA-N	447.289	1.987	50	20	IDGD	
O=C(NNC(=O)c1ccc(F)cc1Br)C(=O)Nc1ccc(-n2ccnc2)nc1	764086970	ZFSNOQADDDVYSX-UHFFFAOYSA-N	447.224	1.569	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2cccc(NC(=O)c3ccoc3)c2)c1O	764133482	VTJQJPJCHIMLFS-UHFFFAOYSA-N	438.396	1.646	50	20	IDGD	
CCN1CCN(c2ccc(NC(=O)C(=O)NNC(=O)c3ccc(C#N)cc3)c(C)c2)CC1	764177719	UNKKTPOWCNGSLO-UHFFFAOYSA-N	434.500	1.408	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)C(C)(C)c2ccccc2)ccc1N1C(=O)CCC1=O	764303254	TUJIWURVQKXZHD-UHFFFAOYSA-N	436.468	1.712	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc3c2OCO3)cc1Br	764326472	KATYBYUVXRGRJB-UHFFFAOYSA-N	436.218	1.586	50	20	IDGD	
O=C1CCc2cc(F)c(NC(=O)C(=O)NNC(=O)c3cc(-c4cccs4)[nH]n3)cc2N1	764383107	WBIOHBSSNCRAMF-UHFFFAOYSA-N	442.432	1.562	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)n(-c2ccccc2F)n1	764394642	VAXZVUZZFXVBHQ-UHFFFAOYSA-N	443.460	1.904	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1ccc2nc(-c3ccc(F)cc3)oc2c1	764398062	CLTJZBPACHDUPH-LBPRGKRZSA-N	444.419	1.771	50	20	IDGD	
CCOC(=O)c1cnn2c(C(=O)NNC(=O)c3cc(-c4ccccc4OC)[nH]n3)ccnc12	764751183	LSJYHTOHBOIHBV-UHFFFAOYSA-N	449.427	1.380	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NN=Cc1cnc(N2CCCC2)nc1	764830631	JCQMTIBGGOIGBB-UHFFFAOYSA-N	441.967	1.998	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNS(=O)(=O)c1cccs1	765120002	YFKCWDYTAOXHEY-UHFFFAOYSA-N	428.967	1.529	50	20	IDGD	
COCCOc1ccc(Br)cc1NC(=O)C(=O)NNC(=O)OC(C)(C)C	765391741	GSQLYZPWWWDQFO-UHFFFAOYSA-N	432.271	1.969	50	20	IDGD	
CC(C)n1ncc2cc(C(=O)NNC(=O)CN3CCN(C(=O)c4ccccc4)CC3)cnc21	765737398	FHQXRUURBSIDOI-UHFFFAOYSA-N	449.515	1.231	50	20	IDGD	
Cc1cc(O)c([N+](=O)[O-])cc1S(=O)(=O)NNC(=O)c1cc(Br)cn1C	766313099	WGMIXTIAVDQBDR-UHFFFAOYSA-N	433.240	1.333	50	20	IDGD	
CN1CCO[C@@H]([C@H](NC(=O)NNC(=O)CNC(=O)c2ccco2)c2ccc(Cl)cc2)C1	766321928	SVSLZIYAXAWZAF-SJLPKXTDSA-N	449.895	1.065	50	20	IDGD	
COc1cccc(/C=C(/C(=O)NNc2ccccc2S(C)(=O)=O)n2nnnc2C)c1	766669225	PEPVOIZRVVIEOK-ATVHPVEESA-N	428.474	1.535	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)c1cc(N2CCNC2=O)ccc1F	767345150	KIVIGSZKZKBXKA-UHFFFAOYSA-N	428.420	1.211	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)C[C@H]1CN(Cc2ccccc2)CCO1	767346966	ZODWZPVGPKCEBW-NRFANRHFSA-N	439.512	1.519	50	20	IDGD	
COc1ccc2c(c1)OC[C@@H](NC(=O)NNc1ccc(S(=O)(=O)NC(C)C)cn1)C2	768112093	OHLRRHBBWYBYBU-AWEZNQCLSA-N	435.506	1.407	50	20	IDGD	
C[C@H](NS(=O)(=O)c1ccc(C#N)cc1)C(=O)NNC(=O)c1cc(-c2cccs2)[nH]n1	768259827	AGYXLRQAUCTQSS-NSHDSACASA-N	444.498	1.138	50	20	IDGD	
C[C@]1(c2cccc(C(=O)NNc3c(F)cc(C(=O)NC4CC4)cc3F)c2)NC(=O)NC1=O	769249610	DQAMXJIWLWEDHE-OAQYLSRUSA-N	443.410	1.669	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)c3ccc(CN4C(=O)CCC4=O)cc3)nc21	770967692	RSVFGSZFOGTLHK-UHFFFAOYSA-N	437.460	1.693	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)Nc1cnn(-c2ccccc2)c1C(F)(F)F	771193676	GIWPIARHFYSBBA-JTQLQIEISA-N	431.396	1.479	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)Cc2cccc(OCc3cccnc3)c2)C[C@@H](C)O1	771295383	DCBWQODGYXZVPG-HDICACEKSA-N	426.517	1.850	50	20	IDGD	
COC(=O)c1cccc(S(=O)(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)c1C	771609255	YKYZDUKLFKWHRZ-UHFFFAOYSA-N	439.877	1.061	50	20	IDGD	
Cc1nc(-c2c(C)c(C)nn(C)c2=O)sc1C(=O)O[C@H](C)C(=O)NNC(=O)CC(C)C	772006084	SXUBVGRTYPXVRI-CYBMUJFWSA-N	449.533	1.568	50	20	IDGD	
CC(C)(C)OC(=O)N1CCSC[C@@H]1CC(=O)NNC(=O)c1ccc2c(c1)OCCO2	772029254	JZSGNBNVTOZFHK-AWEZNQCLSA-N	437.518	1.961	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)ncc1Br	773540844	PIPHOVJHMOQVRO-UHFFFAOYSA-N	427.642	1.911	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ccc(C(F)(F)F)cn2)cc1-n1nnnc1C	773675368	KUCBNLQXNWCOBL-UHFFFAOYSA-N	436.354	1.475	50	20	IDGD	
COC(=O)c1cccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)c1C	774010252	WYUFVWZTNMXCRP-GFCCVEGCSA-N	433.848	1.988	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)N[C@@H]2CCO[C@]3(CCS(=O)(=O)C3)C2)c(Cl)c1	776076578	NFBGIYDVVWBHJN-SJKOYZFVSA-N	430.914	1.720	50	20	IDGD	
C[C@H](NC(=O)C1CCCC1)C(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776206290	SFNBCQQCAVYGCT-AWEZNQCLSA-N	425.530	1.317	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)[C@@H](C)n2nnnc2C(C)(C)C)c2ccccc2c1=O	777787480	USQIXRRRUBFIGX-GFCCVEGCSA-N	426.481	1.284	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N[C@H](CO)CC(F)(F)F	778587568	DHHVFZCXELOXNR-SCZZXKLOSA-N	428.205	1.860	50	20	IDGD	
COC[C@@H](C)n1ccc(NC(=O)C(=O)NNC(=O)CSc2ccc(Cl)cc2)n1	778706973	JJYCZDNNMSIDLG-LLVKDONJSA-N	425.898	1.622	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@@H](C(=O)NNC(=O)c2ccc(Cl)cc2F)[C@H](C)O)cc1	779532891	XCFBDCWCNMWEPI-MEDUHNTESA-N	443.884	1.276	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)c1ccccc1F)C(=O)NNc1ncncc1Cl	781804407	IAPGONZAKAWSAV-GFCCVEGCSA-N	433.918	1.812	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN[C@@H](CCO)c2ccccc2Br)n1	782104294	ZUEJDAMCXGHJJT-AWEZNQCLSA-N	441.351	1.617	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCC(Oc3cc(C)ccn3)CC2)cc1OC	782514221	MGIKBHUFEDDDRE-UHFFFAOYSA-N	428.489	1.712	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2cnn(-c3ccccc3)c2C(F)(F)F)CCS(=O)(=O)C1	783425853	FCEOFRRUCBXBEI-MRXNPFEDSA-N	445.423	1.028	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1cnn(-c2ccccc2Cl)c1	784004300	FAIWIGSDYGKVCY-UHFFFAOYSA-N	446.876	1.103	50	20	IDGD	
CNC(=O)c1ccc(Cl)c(NC(=O)C(=O)NNc2ccc(Br)cn2)c1	784340001	RUHITYLLWUZLEW-UHFFFAOYSA-N	426.658	1.939	50	20	IDGD	
Cc1nc(Cn2nnc(C(=O)NNC(=O)c3sc(-c4ccccc4)nc3C)c2C)no1	784743300	VWKJYJAZMGFVDR-UHFFFAOYSA-N	438.473	1.833	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)C(=O)Nc2ccc(S(=O)(=O)N3CCCC3)cc2)c1	784855369	ZPDNOXBSTLCQLY-UHFFFAOYSA-N	446.485	1.340	50	20	IDGD	
CCNC(=O)COc1cccc(NC(=O)C(=O)NNc2cccc(C(F)(F)F)n2)c1	784952995	XMTABJCEXSUHAL-UHFFFAOYSA-N	425.367	1.697	50	20	IDGD	
COc1cccc(C[C@H](O)C(=O)OCC(=O)NNC(=O)c2cc(Cl)ccc2OC)c1	785707166	OMTRFLSSTLHMKV-INIZCTEOSA-N	436.848	1.265	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cnn(-c2ccc(C)cc2C)c1	786413453	AARBRHZMCPDCQK-UHFFFAOYSA-N	437.456	1.663	50	20	IDGD	
C[C@H]1[C@H](C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)CCN1C(=O)OC(C)(C)C	786686840	CBLZEQBYDDKHCL-QWHCGFSZSA-N	429.477	1.340	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)N(C)CC(=O)NNc2ccc(F)c([N+](=O)[O-])c2)cc1	788148430	KDSHWYSRMSPOKG-UHFFFAOYSA-N	439.425	1.456	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)CCc2c(C)nc3nc(N)nn3c2C)c1	790179247	UQVPFLMSCDMGEV-UHFFFAOYSA-N	439.520	1.914	50	20	IDGD	
CNC(=O)c1cc2cc(NC(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)ccc2[nH]1	791929399	YOGRMQRUQLUQAK-UHFFFAOYSA-N	429.458	1.398	50	20	IDGD	
COc1cc(C)cnc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	792570243	CLQSYIRUXXCPNU-UHFFFAOYSA-N	432.502	1.648	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)[C@]1(O)CCc2ccccc2C1	792790273	KHIPDTIRUSAKCG-NRFANRHFSA-N	432.860	1.573	50	20	IDGD	
Cc1ccc2c(c1)CC[C@H](C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1)O2	793589866	HACBUHXHWJKDCV-LJQANCHMSA-N	431.514	1.853	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)c1ccc(C)cc1)C(=O)NNC(=O)c1cccc(C)n1	794080384	LWAKJAJDAKTBBP-QGZVFWFLSA-N	436.559	1.560	50	20	IDGD	
COc1ccccc1N1C[C@@H](C(=O)NNc2ccccc2S(=O)(=O)N(C)C)CC1=O	795169567	QOZGDTXMHASFAK-AWEZNQCLSA-N	432.502	1.442	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(N3CCSCC3)c(Cl)c2)n1	797370210	IGLZVGXLPOZNFO-UHFFFAOYSA-N	433.921	1.996	50	20	IDGD	
Cc1ccc(N2CCOCC2)cc1NC(=O)C(=O)NNC(=O)c1ccc2c(c1)OCCO2	797535927	SANIIMQVPOEOAF-UHFFFAOYSA-N	440.456	1.003	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2occc2CS(=O)(=O)c2ccccc2)cc1	798149527	YAWQJDBWEUNRFL-UHFFFAOYSA-N	441.465	1.962	50	20	IDGD	
C[C@]1(CNC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)CCN(Cc2ccccc2)C1	798483336	BUIXZQNAQINUMJ-JOCHJYFZSA-N	444.557	1.946	50	20	IDGD	
CC(=O)NC[C@@H]1CCn2ncc(C(=O)NNC(=O)Nc3ccc(Br)cc3)c2C1	802000527	URSRFLOXMZITAU-GFCCVEGCSA-N	449.309	1.811	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@H]2CCCCN2C(=O)c2ccccc2)cc1	802065858	DKWAKFPRNNQSLH-GOSISDBHSA-N	444.513	1.938	50	20	IDGD	
COc1ccc(C2=NO[C@@H](CNC(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)C2)cc1	802368494	UWNWGQCAXZPOKX-MRXNPFEDSA-N	446.485	1.236	50	20	IDGD	
COC(=O)c1cc(C)c(NC(=O)C(=O)NNC(=O)c2ccc(Cl)nc2)c(Cl)c1	806976232	JSGGRZSFBOAVIM-UHFFFAOYSA-N	425.228	1.883	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)Cc2ccccn2)c(C)cc1Br	806978865	MMAFJBWPTOLXTK-UHFFFAOYSA-N	449.261	1.268	50	20	IDGD	
CC[C@@H](C)N[C@H](CNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)c1ccco1	807439976	BFFYVFJHRBKZOD-NVXWUHKLSA-N	429.525	1.746	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)F)cc1)C(=O)Nc1ccc2c(c1)C(=O)OC2	808933662	QSDHKEBGNXJWEO-UHFFFAOYSA-N	425.369	1.435	50	20	IDGD	
C=C[C@@](C)(O)CC(=O)NNC(=O)c1ccc(NS(=O)(=O)c2ccc(OCC)cc2)cc1	809982093	IINTXRRGOALIHK-OAQYLSRUSA-N	447.513	1.974	50	20	IDGD	
COC(=O)c1c(F)ccc(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)c1C	810384234	HRHSEDURONRNJL-UHFFFAOYSA-N	441.213	1.411	50	20	IDGD	
O=C(CNS(=O)(=O)c1cccc(Br)c1)NNc1ncnc2ccsc12	810594813	QUVMJNPMFMQRSO-UHFFFAOYSA-N	442.320	1.875	50	20	IDGD	
CC(C)Oc1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)cc1C#N	813033391	RAHVRDLNOMUDPM-UHFFFAOYSA-N	445.501	1.678	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2cccc(-n3cccn3)c2)cc1	813033639	CYEHDGXVSSWTBS-UHFFFAOYSA-N	428.474	1.204	50	20	IDGD	
Cc1ccc([C@H](CN2CCOCC2)NC(=O)NNC(=O)COc2ccccc2C#N)cc1	813495257	TYJKDZLHMLSVAG-FQEVSTJZSA-N	437.500	1.649	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1cccc(-c2nccn2C)c1	815752444	SLAHKAVPCCDYBE-UHFFFAOYSA-N	442.501	1.419	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)C(=O)Nc2cnn(C)c2C(F)F)c1	815866882	SMNUWXWWIUHDCQ-UHFFFAOYSA-N	446.208	1.989	50	20	IDGD	
O=C1CNC(=O)c2ccc(C(=O)NNc3ccc([N+](=O)[O-])cc3Br)cc2N1	816198301	DHIOGSIJWGEFMD-UHFFFAOYSA-N	434.206	1.796	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C2CCN([C@@H]3CCSC3)CC2)c2ccccc2c1=O	816805936	MXCFGLSIVUBSAU-OAHLLOKOSA-N	429.546	1.395	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)CCc2nc3ccccc3oc2=O)c2ccccc2c1=O	824318048	PTEDFUMTVAIVCD-UHFFFAOYSA-N	447.451	1.873	50	20	IDGD	
CCOc1ccccc1N1C[C@H](C(=O)NNC(=O)CNc2ccccc2OC)CC1=O	825615461	XVVLVRYSSPPQCA-OAHLLOKOSA-N	426.473	1.706	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)[C@@H]2CC(=O)N(Cc3ccccc3Cl)C2)c1	849366694	XVMXPAYKOYSVDK-OAHLLOKOSA-N	430.892	1.957	50	20	IDGD	
CCn1nc(C(=O)NN=Cc2c(Cl)nc(N)nc2N2CCCC2)c2ccccc2c1=O	863965114	GTBFKVXJBIYNDX-UHFFFAOYSA-N	440.895	1.806	50	20	IDGD	
CC(=O)c1cccc(S(=O)(=O)NCC(=O)NNC(=O)CSc2ccc(C)cc2)c1	913033758	UHZMICFAZCWRMA-UHFFFAOYSA-N	435.527	1.416	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCOCC2)o1	914753007	LUDUPYQBSUIZKX-UHFFFAOYSA-N	443.865	1.037	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)[C@@H]1CC[C@@H](C(F)(F)F)NC1=O	914829710	NHLUYTGSIBWVJV-MNOVXSKESA-N	438.200	1.432	50	20	IDGD	
N#Cc1ccc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1	916409912	NOMRBDRHMNIGSF-UHFFFAOYSA-N	427.486	1.487	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cnn(-c3ccccc3)n2)c1	916556232	LTXAVWUPXICZAD-UHFFFAOYSA-N	442.501	1.373	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C(C)C)N2C(=O)c3ccccc3C2=O)cc1C	916562989	XLTUDWLTMXUYTQ-SFHVURJKSA-N	436.468	1.710	50	20	IDGD	
O=C(NC[C@@H]1CCN(c2ccccc2)C1)NNC(=O)c1csc(N2CCOCC2)n1	916580041	SSXGWCXFPZGIGZ-HNNXBMFYSA-N	430.534	1.450	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNS(=O)(=O)c1cccc(Cl)c1F	917724486	ZCEAQQMPRPKURM-UHFFFAOYSA-N	434.902	1.704	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNC(=O)N[C@@H]2CCCN(S(C)(=O)=O)C2)cc1	920238482	FOCCXCNKIHTZBU-MRXNPFEDSA-N	426.539	1.480	50	20	IDGD	
CN(C)C(=O)CN(C)C(=O)/C(C#N)=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	920852569	QTVVZXIVJJYUKX-GDNBJRDFSA-N	442.907	1.532	50	20	IDGD	
CCNC(=O)COc1ccc(CNC(=O)NNC(=O)c2ccc(OC)cc2)cc1OC	1317910768	OSBCCMIADWLIAU-UHFFFAOYSA-N	430.461	1.363	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)Cn2nnc(-c3ccccc3)n2)CC1	1318668175	PLGWNOLYNMDINA-UHFFFAOYSA-N	429.481	1.135	50	20	IDGD	
CCS(=O)(=O)c1ccccc1C(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1	1321910291	OIRBXOQJWNDQNX-UHFFFAOYSA-N	439.534	1.888	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CC(C)CC(=O)NNC(=O)c2ccc(OC)cc2)cc1	1324686856	PTQOTRVYQHSIOK-UHFFFAOYSA-N	442.472	1.342	50	20	IDGD	
Cc1cc(C)nc(SCc2ccc(C(=O)NNC(=O)CN3C(=O)CCC3=O)cc2)n1	1527517912	SALCPKZXMHRFBB-UHFFFAOYSA-N	427.486	1.296	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccnc3c2OCO3)C1	1780025656	PTSMKCGTQSDYBJ-STXHMFSFSA-N	439.896	1.192	50	20	IDGD	
O=C(Cc1ccc(Br)nc1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Cl)CCO2	1780875052	VMOSOEKKVCWEOG-GDBMZVCRSA-N	434.693	1.751	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)C3(N4CCN(C)CC4)CC3)C2)C1	1781106348	PVOBANHNPJBKGC-XLIONFOSSA-N	426.989	1.004	50	20	IDGD	
O=C([C@H]1CCc2ccoc2C1)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781325208	KZWOLPITAZCNRT-DHSIGJKJSA-N	429.286	1.905	50	20	IDGD	
O=C(c1c[nH]c2ncccc12)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781329884	MQFIBNVINYRLMB-GUYCJALGSA-N	425.258	1.697	50	20	IDGD	
COc1cc(C#N)cc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)c1	1781334438	NWKYDDQAWUXKDL-QAPCUYQASA-N	440.269	1.701	50	20	IDGD	
O=C(COc1ccccc1F)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781335227	WKQJXYJVYYJMEX-NVXWUHKLSA-N	433.249	1.725	50	20	IDGD	
O=C(c1ccc(OCC2CC2)cc1F)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1781435516	VIBUJMWNAIAUGV-NQIIRXRSSA-N	440.899	1.658	50	20	IDGD	
C[C@@H](C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@](C)(Cl)CCl)C2)n1ccnn1	1781548341	CXDGFCLBKVRBMB-MJSCVDMRSA-N	432.352	1.589	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@](C)(Cl)CCl)C2	1782178471	JUWWJSOHXVPJBY-UWWPHRKUSA-N	429.772	1.990	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccnn3CCOC)CCO2)C1	1783347290	FNYFQNSJXJGLBG-KSSFIOAISA-N	443.342	1.147	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)C1(Br)CC1)CCO2	1783354205	WNAYVMTZGIQTRF-RISCZKNCSA-N	438.160	1.917	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)CCc3ccc(O)nn3)CCO2)C1	1783355830	YDYMTQYQLBDOSS-KBXCAEBGSA-N	441.326	1.118	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(-c4cccnc4)[nH]n3)CCO2)C1	1783536158	FGHQRGAJXJHULX-DJJJIMSYSA-N	448.321	1.699	50	20	IDGD	
Cc1cc(C)cc(CCC(=O)N2CCO[C@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)c1	1783937393	IZFGOXWKMGILFD-DEOSSOPVSA-N	444.576	1.439	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](C)Oc3ccccn3)C2)C1	1784490827	DOGYUUQUSDVWFY-SUNYJGFJSA-N	426.311	1.462	50	20	IDGD	
O=C(c1ccc(F)c(C(F)(F)F)c1)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1785207890	HFUMOIPVQGVHCH-YOEHRIQHSA-N	438.805	1.888	50	20	IDGD	
Cc1noc(C)c1CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)Br)C[C@@H]21	1785361624	UCXIQEMPEXRLEF-UMPQAUOISA-N	442.354	1.987	50	20	IDGD	
C#CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]2C1	1787451275	FLQDALDSHWPUEE-ARKGTOAJSA-N	445.919	1.417	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)c1cccnc1-c1ccccc1	1787606143	KSKWBOHELFZSTJ-FFGOWVMKSA-N	443.931	1.942	50	20	IDGD	
O=C(/C=C/c1cnc[nH]1)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1	1788143811	WEJDITCQJYWSQP-ZHACJKMWSA-N	430.273	1.551	50	20	IDGD	
C=C[C@@H](O)C(C)(C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](Br)CC)C[C@@H]21	1788575739	BTUPOGGDIACZNY-UVPYHEFZSA-N	431.371	1.713	50	20	IDGD	
C[C@H](Cn1cncn1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]2C1	1789870538	MHGDDXHGJSUHNV-ZVZLPEGASA-N	432.352	1.130	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)COc3ccccc3)C[C@@H]21)[C@@H](F)Br	1789922160	DNPJIKOQWFFGMP-NZUILWFCSA-N	429.286	1.736	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21)[C@H]1C[C@@]12C(=O)Nc1ccccc12	1791038045	QAEYQHMFJFXHBJ-ZTSZXRIDSA-N	435.883	1.411	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)N3C[C@@H]4C[C@H]4C3)C[C@@H]21	1791056392	WKLVBHVIQMUFQI-TYXVVTFGSA-N	428.371	1.090	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4nc[nH]c4c3)C[C@@H]21	1791056416	XQKQWNHTFKBNNE-MJFSBKNWSA-N	435.322	1.940	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccnc4c3OCO4)C[C@@H]21	1791059224	RTZVAFCWXPSDOC-IMIFBBOLSA-N	440.294	1.187	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3CC[C@H](O)CC3)[C@H]2C1	1791400849	HPKYOGXDXWBZPA-JHMPBIJASA-N	431.371	1.548	50	20	IDGD	
Cc1ccc(C(=O)NCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)C(C)(C)CCl)C[C@@H]32)cc1	1792250314	FLIYTTYVZRYJDE-FHWLQOOXSA-N	449.979	1.970	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)c1ccc(Br)cc1F	1792688730	GHHUFPQJEQZLOV-ANGCBRKESA-N	449.704	1.391	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2)c1cnc(-c2ccccn2)nc1	1794259905	PLQVCUQTLYRFPL-AGGWBTHJSA-N	436.299	1.546	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)c1ccc(Cl)nc1F	1796188349	SJNNXFCMMNDRPH-QDMKHBRRSA-N	431.660	1.120	50	20	IDGD	
Cc1cc(C)n2ncc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)CO[Si](C)(C)C)C4)c2n1	1796920422	SFPQKFMQICWHIG-HGKCTWBKSA-N	445.596	1.401	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)c1cc(Cl)nc2ccccc12	1796940909	OJQZINILSHGKIL-XBCDXLOZSA-N	438.311	1.691	50	20	IDGD	
CCOC(=O)O[C@@H](C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@](C)(Cl)CCl	1799279451	OQGYOQZLNAWALG-QLLRCSDMSA-N	425.309	1.374	50	20	IDGD	
C[C@@H](Oc1ccccc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Br	1799347612	SQOARBTWXMZWOC-CNRIWFPOSA-N	429.286	1.734	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3cncn3c1)C2)[C@@H](F)Br	1799349912	OFSCXQJCEUXNCR-AYRXBEOTSA-N	425.258	1.228	50	20	IDGD	
C[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(Cl)Cl)[S@@](=O)c1ccccc1	1801016537	HRCSNXPNPVFFIZ-MVKLEHQWSA-N	433.357	1.576	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1(F)CN(C(=O)OC(C)(C)C)C1	1802201308	JVLZBBRNEOLTGC-LXTVHRRPSA-N	447.935	1.552	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2coc(Cl)n2)[C@@H]1c1cccnc1	1805020878	CHSARNORKYWYJM-KSSFIOAISA-N	448.911	1.416	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H](CNC(=O)c2ncnn2C)[C@@H]1c1cccnc1	1805273099	LKUXALNWXZGXOG-YUELXQCFSA-N	435.326	1.561	50	20	IDGD	
O=C(c1ccc(O)c([N+](=O)[O-])c1)N1CCC2(CCCN(C(=O)[C@@H](O)CCl)C2)CC1	1805527116	SETAQDPMJPHAID-INIZCTEOSA-N	425.869	1.745	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@H](C(=O)N2CCC3(CCCN(C(=O)[C@@H](O)CCl)C3)CC2)C1	1805527871	FTGBCTBKVYIOCG-BBWFWOEESA-N	428.957	1.797	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)CC2CCCC2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807366215	XSEHLZUMQWNTCP-NFBKMPQASA-N	435.333	1.661	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1807367059	PTYUMZMFKSJZMQ-NZSAHSFTSA-N	429.713	1.098	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)c1ccc2nccn2c1	1809415274	WXAYSAQCRSZBJW-VDZJLULYSA-N	427.892	1.649	50	20	IDGD	
O=C(c1ccc2nc[nH]c2c1)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1	1809972040	KTIVOVQLUNDFFC-UHFFFAOYSA-N	446.316	1.401	50	20	IDGD	
N#CCc1ccc(C(=O)N2CCC3(CCCN(C(=O)c4cccc(B(O)O)c4)C3)CC2)cc1	1809980790	TXUJQWLBPZQHIE-UHFFFAOYSA-N	445.328	1.591	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1)c1cc[n+]([O-])cc1	1811190464	KUKWLWXAUFJGOS-FUHWJXTLSA-N	433.306	1.820	50	20	IDGD	
C=CCC(F)(F)C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1812667543	FLIFRCKQNMRFMW-PKOBYXMFSA-N	443.259	1.292	50	20	IDGD	
O=C(CCNC(=O)c1ccc[nH]1)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1	1815848677	NGFMRZHTNHQKRX-GJZGRUSLSA-N	436.900	1.150	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@H](O)CCl)CC2)c1cnc(C(F)(F)F)cn1	1816084419	KQVGBWNMKANGMS-GMSGAONNSA-N	449.842	1.777	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)CN3CCN(C(C)=O)CC3)sc2C1	1818896879	KYAWXRKVLRCKAC-ZIAGYGMSSA-N	441.985	1.237	50	20	IDGD	
Cc1cc(CC(=O)Nc2cc([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)n[nH]1	1819500231	DPSGRIOPMQSWBN-INIZCTEOSA-N	430.513	1.049	50	20	IDGD	
CCc1noc(C)c1C(=O)N[C@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1	1826088020	NOCYVTYUJSZBBL-LBPRGKRZSA-N	448.549	1.601	50	20	IDGD	
C[C@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)CSc3nc[nH]n3)sc2C1	1826674354	BYQMQBACGFSBKW-YUMQZZPRSA-N	445.368	1.749	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H]2CCCO2)CC1	1827679436	CHFAFVSRPFPMKC-TZPGLHDLSA-N	443.548	1.919	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)/C=N/N2CCCCC2)CC1	1828918456	MMVWZIFDHMNPNZ-AYBPGSHHSA-N	448.612	1.451	50	20	IDGD	
C[C@H](O)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Cl)CCN2C(=O)OCc1ccccc1	1829057583	ZHCARNAQHJCYKS-DKICVRJWSA-N	441.887	1.354	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3Cc4ccccc4CN3)C2)C1	1830358803	ZVTDFEJXIILHBU-WMZHIEFXSA-N	449.979	1.422	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3CC(F)(F)C3)C2)C1	1830534151	XJADJJXVKKRJIM-LRDDRELGSA-N	439.297	1.519	50	20	IDGD	
C=CCO[C@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](Br)CC)C2)C1	1831434516	YNKAAJWJXJCTOL-VKJFTORMSA-N	433.343	1.207	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H]2CCCO2)CC1	1831620581	IJYOFTAASBXBNC-MOPGFXCFSA-N	429.521	1.097	50	20	IDGD	
Cc1cc(C(=O)N2CCC([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)n(C)n1	1831872003	KECZWLSRZSMADE-GOSISDBHSA-N	432.569	1.335	50	20	IDGD	
C[C@H](Cn1ccnc1)C(=O)N1CCC([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1	1831876949	NTBQOGSXDHNEKL-UYAOXDASSA-N	446.596	1.512	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ncc(F)cc3F)CCO2)C1	1831956360	ASGMKVIUVQKDPT-KUHUBIRLSA-N	431.867	1.837	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3c(C)nn(C)c3C)CC2)CC1	1833573173	BVPVTQNUYIKERW-GOSISDBHSA-N	439.988	1.476	50	20	IDGD	
CC(=O)N(C)[C@@H](C)C(=O)N1CCC(N2CCC(NC(=O)CCBr)CC2)CC1	1834421645	AWCPVGBDRJOCHU-AWEZNQCLSA-N	445.402	1.210	50	20	IDGD	
CC(C)(C)NCC(=O)N1CCC(N2CCC(NC(=O)CCBr)CC2)CC1	1834421877	QZFDTGXGJFSHIS-UHFFFAOYSA-N	431.419	1.731	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)C(C)(C)NCCC#N)CC2)CC1	1834716778	XAVXMODAPQQPDO-SFHVURJKSA-N	426.005	1.857	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3ccnn3CCOC)CC2)CC1	1835181471	XRMWGEIBILEUSO-GOSISDBHSA-N	439.988	1.732	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3c(C)n[nH]c3C)CC2)CC1	1835870957	SPOJPUWGUDHXRR-KRWDZBQOSA-N	425.961	1.466	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)CNC(=O)c3cccnc3)CC2)CC1	1836395088	RODQSOWJEIIFKI-LJQANCHMSA-N	449.983	1.400	50	20	IDGD	
CCC(=O)N[C@@H](C)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](F)Br)CC2)CC1	1836413560	JGEQDFGJLVAOQN-BLLLJJGKSA-N	449.365	1.163	50	20	IDGD	
O=C(c1ccn2nccc2c1)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1837161530	CXLWUEMRWIRKNX-GOSISDBHSA-N	427.288	1.208	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3nccnc3OC)CC2)CC1	1837292530	VXUQRWITUTYJNI-INIZCTEOSA-N	440.928	1.351	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)c3ncn(C)n3)CC2)CC1	1837383473	OYDXUHFTKMSVTO-LBPRGKRZSA-N	428.331	1.211	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)c3nccn3C)CC2)CC1	1837537930	KUPLJMSSLRLVPX-ZDUSSCGKSA-N	427.343	1.816	50	20	IDGD	
C[C@@H](Cc1ccccn1)C(=O)N1CCOC[C@@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1837717805	ONJKGZAGYWFMCS-PGRDOPGGSA-N	449.624	1.568	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(C(C)(C)C)n[nH]3)CCO2)C1	1837991427	KSAJFGMBIQICLJ-XOBRGWDASA-N	426.945	1.795	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(C)n(CC)n3)CCO2)C1	1838147219	WRDBUYXJRCTORH-UZLBHIALSA-N	426.945	1.689	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(OC)cc(OC)c3)C2)C1	1839146070	JLYYJHBNUOFJJL-GHTZIAJQSA-N	440.924	1.791	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3F)C2)C1	1839152148	PEHJQOZNSVHTSQ-MSOLQXFVSA-N	434.295	1.527	50	20	IDGD	
Cc1cccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)c1	1839202032	RNIKEVSPOUNZJK-QAPCUYQASA-N	429.286	1.756	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cccn3nccc13)CCO2	1839539285	GRKBJIHCEWTELP-NRFANRHFSA-N	446.580	1.256	50	20	IDGD	
CCN(CC)C[C@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCBr)C2)C1	1839675416	CJZHKIWMTWCGIS-QFBILLFUSA-N	448.402	1.206	50	20	IDGD	
COc1ccc(/C=C/C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)c(F)c1	1840074899	CSBQKORTYIESQV-JXHQFBSOSA-N	444.862	1.838	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccncc3Cl)C2)C1	1840153675	XLHVYQNGGDRWFR-QAPCUYQASA-N	432.304	1.059	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)Nc3ccccc3)C2)C1	1840153681	XRAXPORQZBUKAQ-BLIXFSHQSA-N	439.940	1.197	50	20	IDGD	
O=C(c1ccc2nccnc2c1)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840188669	WPIPIEHKJSDTRV-IBGZPJMESA-N	439.299	1.504	50	20	IDGD	
Cc1c(Cl)cccc1C(=O)N1CCCC12CN(C(=O)c1cnccc1C(=O)NN)C2	1841157484	QQKZQVCANNOPPX-UHFFFAOYSA-N	427.892	1.778	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N1CC2(CCCN2C(=O)[C@H](F)Cl)C1	1843367354	WIDXQUNQRANIPQ-KBPBESRZSA-N	443.907	1.583	50	20	IDGD	
Cc1noc(-c2ccccc2)c1C(=O)N1CCCC12CN(C(=O)CCC(=O)NN(C)C)C2	1843440559	NUXTYWJFZJBPRK-UHFFFAOYSA-N	439.516	1.840	50	20	IDGD	
COc1ccc2oc(C(=O)N3CCCC34CN(C(=O)CCC(=O)NN(C)C)C4)cc2c1	1844019904	WWTRCQSHBPAGSK-UHFFFAOYSA-N	428.489	1.631	50	20	IDGD	
Cc1n[nH]c(C)c1C(=O)N1CCCC12CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1844413830	YOUGDPZBOOORFA-AWEZNQCLSA-N	439.944	1.976	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2ccnc3c(O)cccc23)C1	1845702725	SUJZKOWHCYHLSO-UHFFFAOYSA-N	446.467	1.070	50	20	IDGD	
CCC1(C(=O)N2CCCC23CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C3)COC1	1845908174	SVLHYWWUCVJKJZ-AWEZNQCLSA-N	429.945	1.749	50	20	IDGD	
CN(CC(=O)N1CC2(CCCN2C(=O)[C@@H]2CCCS2)C1)NC(=O)NCc1ccccc1	1846720618	MSBGEMJDSLGFMN-SFHVURJKSA-N	445.589	1.432	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc2n(n1)CCCN(C)C2	1847501892	GXAMJGPIFBFOHW-JQFCIGGWSA-N	438.370	1.565	50	20	IDGD	
CCc1nn(C)c(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](O)CCl)c1Br	1847560157	MALPOFJAAZKBDJ-SRVKXCTJSA-N	433.734	1.160	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cnsn1	1848095962	ZPDSGFGCAWQGDJ-DRZSPHRISA-N	429.930	1.486	50	20	IDGD	
O=C(COC(=O)CSc1ncnc2sccc12)NNC(=O)c1cccc([N+](=O)[O-])c1	9719114	DZVRRLQNBPQVJO-UHFFFAOYSA-N	447.454	1.696	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1ccc(S(C)(=O)=O)cc1	9837664	KZVDOQBJXREURT-UHFFFAOYSA-N	440.861	1.370	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C2CCN(S(=O)(=O)CC)CC2)cc1	18071637	QWHQZSPXXGGDAK-AWEZNQCLSA-N	427.523	1.062	50	20	IDGD	
CS(=O)(=O)NCCc1ccc(C(=O)NNC(=O)CSc2ccc(Cl)cc2)cc1	26772521	XAONWEQJUGJDFT-UHFFFAOYSA-N	441.962	1.985	50	20	IDGD	
CC(=O)N1CCc2ccccc2[C@@H]1CC(=O)NNC(=O)c1csc(N2CCOCC2)n1	105106223	CCABMSYSVHIIFQ-SFHVURJKSA-N	443.529	1.277	50	20	IDGD	
COc1ccc(/C=C(/C#N)C(=O)OCC(=O)NCCc2ccc(S(N)(=O)=O)cc2)cc1	206992187	JGGWYNPPMYVEPH-ATVHPVEESA-N	443.481	1.152	50	20	IDGD	
CCN(CCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)C(C)C	726714908	YHJLMHJUAFORKK-UHFFFAOYSA-N	439.582	1.536	50	20	IDGD	
O=C1Cc2cc(S(=O)(=O)NNC(=O)c3cc(Br)c[nH]3)c(Cl)cc2N1	728016318	WWBXLVQEEIWEFC-UHFFFAOYSA-N	433.671	1.549	50	20	IDGD	
Cc1ccc(-c2nn(-c3ccccc3)cc2C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)o1	728375707	AZNJNGRHYSKKNU-AWEZNQCLSA-N	428.470	1.636	50	20	IDGD	
COc1ccc(CCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1F	728400469	RILFRWQVRKVVLD-UHFFFAOYSA-N	438.481	1.271	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NNC(=O)CCc2ccccc2O)cc1	730034059	PMGRBBUWFKEHFN-SFHVURJKSA-N	431.514	1.634	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)N2CCN(Cc3nnnn3-c3ccccc3)CC2)cc(C#N)n1C	730776357	AZHPGWZVVKLBCH-UNOMPAQXSA-N	441.499	1.432	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)N1CCN(S(=O)(=O)Cc2ccccc2)CC1	731499939	RUCAKYMDNHXNRZ-UHFFFAOYSA-N	432.502	1.197	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)[C@@H]1CCCN1S(=O)(=O)c1cccc([N+](=O)[O-])c1	732951608	AGODGVXPOFQDHQ-KRWDZBQOSA-N	432.458	1.518	50	20	IDGD	
O=C(Cc1ccc(Cl)cc1)NNC(=O)NCC1CCN(S(=O)(=O)C(F)F)CC1	733045586	OVXJRTSIZINELM-UHFFFAOYSA-N	438.884	1.477	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(OCC(=O)NNc2cc(C)ncn2)c([N+](=O)[O-])c1	734256289	BQQNNARRIDAXDE-UHFFFAOYSA-N	438.466	1.246	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)CC1	734822324	UULBVPIEZTZZND-UHFFFAOYSA-N	439.473	1.256	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c(C)c1C	735266027	WFFXJLHFKCMYMZ-UHFFFAOYSA-N	441.531	1.186	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)N[C@@H]1CCN(c2ccc(Cl)cc2)C1=O	740484285	RDNKPTFDHKNUCL-OAHLLOKOSA-N	440.847	1.738	50	20	IDGD	
CCCn1c(SCC(=O)NNC(=O)C(C)(C)C)nc2cc(S(N)(=O)=O)ccc21	742450202	ZFFKGRYPSCYBIF-UHFFFAOYSA-N	427.552	1.379	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)NC2CC2)c1)c1cccc(Br)c1	742770226	WOPKHQRUXVHKBY-UHFFFAOYSA-N	438.303	1.965	50	20	IDGD	
COc1ccccc1-n1cc(S(=O)(=O)NNC(=O)c2nnc(-c3ccccc3)o2)cn1	743254752	UTYUHMAIOPEMQJ-UHFFFAOYSA-N	440.441	1.554	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)OCc2nc(CS(C)(=O)=O)no2)c(C)n1C[C@H]1CCCO1	744553008	XVMOMQZQGIZBPF-QOTSWMAJSA-N	448.501	1.862	50	20	IDGD	
COc1ccc2c(c1)OC[C@H](C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1)C2	744621769	GBEQLQJLUXWJRM-MRXNPFEDSA-N	447.513	1.411	50	20	IDGD	
CS(=O)(=O)c1cccc([C@@H](NC(=O)NNC(=O)C(=O)N2CCCC2)c2ccccc2)c1	745908145	WPFYQFGNFPJZCA-SFHVURJKSA-N	444.513	1.132	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN(C)C2CCN(CCc3ccccn3)CC2)n1	746458878	YXPVKYYVSHMQQZ-UHFFFAOYSA-N	430.578	1.175	50	20	IDGD	
COc1ccc(-c2nnc(S)n2CC(=O)NNC(=O)NCCc2cccs2)cc1	746592706	UDQOLLNLIKDRLI-UHFFFAOYSA-N	432.531	1.877	50	20	IDGD	
CN1C(=C(C#N)C(=O)COC(=O)c2cnc3c(c2)c(O)nc(=O)n3C)N(C)c2ccccc21	746914376	HOPJKALWFGCTMD-UHFFFAOYSA-N	446.423	1.081	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)[C@@H]1CCCN1c1ncccn1	747347798	GQYMLQMCJQOKIZ-WFASDCNBSA-N	434.294	1.823	50	20	IDGD	
O=C(COC(=O)c1cc(Br)c2c(c1)OCCO2)NNC(=O)c1cccs1	748927090	MKEJWDFJHFBIGO-UHFFFAOYSA-N	441.259	1.900	50	20	IDGD	
Cc1cccc(CCNC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)c1	749185537	KMSBNCVXSUJPDE-UHFFFAOYSA-N	432.550	1.195	50	20	IDGD	
CNS(=O)(=O)C[C@@H]1CCCN1C(=O)/C(C#N)=C\c1cc(C)n(C[C@@H]2CCCO2)c1C	749510087	KKNWYRIVLZUHSH-CKMYNJMQSA-N	434.562	1.731	50	20	IDGD	
Cc1noc(C)c1S(=O)(=O)N1CCC(C(=O)NNC(=O)CCc2ccccc2)CC1	749802639	LXGODLJHTBRFHE-UHFFFAOYSA-N	434.518	1.472	50	20	IDGD	
CCCn1nc(C(=O)NNS(=O)(=O)c2cn(CC(C)C)cn2)c2ccccc2c1=O	749864659	QAJLACNLMYAKTE-UHFFFAOYSA-N	432.506	1.282	50	20	IDGD	
Cc1nc(CCCC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)cs1	750239710	OEXVUDLPBDUXSD-UHFFFAOYSA-N	437.591	1.854	50	20	IDGD	
CC[C@@H](C)C(=O)N1CCC[C@H](C(=O)NNC(=O)c2nn(CC)c(=O)c3ccccc23)C1	751291474	WFCAUBPXDCQOSV-CABCVRRESA-N	427.505	1.462	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2cnn([C@@H]3CCOC3)c2)cc1Br	751547681	LWVUGBIYGKWGIC-LLVKDONJSA-N	445.295	1.239	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=S)N[C@@H](C)C3CC3)CC2)c(C)c1	751619538	OJKPSEZEDPEELU-HNNXBMFYSA-N	438.619	1.998	50	20	IDGD	
O=C(CN1CCOC[C@@H]1C[C@@H](O)c1cccs1)NNC(=O)c1ccc([N+](=O)[O-])cc1	753860780	ANMHQEWCJRBGAD-JKSUJKDBSA-N	434.474	1.242	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c1Cl	754877119	UXXHULFMYHSQDU-UHFFFAOYSA-N	437.905	1.744	50	20	IDGD	
COc1ccc(C(=O)NNc2ccc(C(F)(F)F)nn2)cc1S(=O)(=O)NC(C)C	755197715	RSNZSUOKSJCRCI-UHFFFAOYSA-N	433.412	1.948	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)Nc1cccc(N2CCCS2(=O)=O)c1	755886235	TUUNLWSAKOOYIY-QGZVFWFLSA-N	432.458	1.219	50	20	IDGD	
CNC(=O)COc1ccc(NC(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)cc1	756445091	YJTRRDIBZNESGD-UHFFFAOYSA-N	426.408	1.807	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)Nc2cnn(C[C@@H]3CCCO3)c2)c2ccccc2c1=O	756737700	YBPCLSZOMWOAAK-HNNXBMFYSA-N	439.476	1.819	50	20	IDGD	
O=C(CCSc1ccc(F)cc1)NNC(=O)Nc1cnn(CCN2CCOCC2)c1	756826884	MLYGZOFBFIATDW-UHFFFAOYSA-N	436.513	1.690	50	20	IDGD	
CCOCCCn1c(NNC(=O)c2nn(CC)cc2[N+](=O)[O-])nc2ccccc2c1=O	756832615	XXEPZJTVEUGIPS-UHFFFAOYSA-N	429.437	1.705	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)ncn1	758061015	RAKLGOXJAQMQSJ-UHFFFAOYSA-N	425.470	1.338	50	20	IDGD	
O=C(NNC(=O)C(=O)Nc1ccccn1)N[C@H]1CCN(c2ccc(Br)cc2)C1	758742553	GMYULFOPGDKFQZ-ZDUSSCGKSA-N	447.293	1.392	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)N=c2cc[nH]cc2I)c1	760035656	ZZRWBEDNLVQOBV-UHFFFAOYSA-N	440.241	1.957	50	20	IDGD	
O=C(NCc1ccn2ccnc2c1)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	762402982	RGEDMMIQMVGPOT-UHFFFAOYSA-N	442.501	1.263	50	20	IDGD	
CC(C)CCNS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2)cc1	763422554	DSZABYVTJDBWRN-UHFFFAOYSA-N	432.502	1.411	50	20	IDGD	
Cc1ccc(NC(=O)C2CC2)cc1NC(=O)C(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	763441805	KAAZNNULPCNHPE-UHFFFAOYSA-N	425.401	1.651	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)C(=O)Nc1cnn(Cc2ccc(Cl)cc2)c1	763445788	KVARASXWSLBCFW-UHFFFAOYSA-N	442.819	1.893	50	20	IDGD	
O=C(NNC(=O)c1ccccn1)C(=O)Nc1ccnn1Cc1ccc(C(F)(F)F)cc1	763468577	ZCLMRMJLOYQFIR-UHFFFAOYSA-N	432.362	1.745	50	20	IDGD	
O=C(NNC(=O)c1cc2ccccc2cc1O)C(=O)Nc1cnn(Cc2ccccn2)c1	763522027	MEJHZJWTBOQBAC-UHFFFAOYSA-N	430.424	1.585	50	20	IDGD	
O=C(NNC(=O)c1cc2ccccc2cc1O)C(=O)Nc1ccccc1CN1CCNC1=O	763527118	MCRVAWAMBQSPOE-UHFFFAOYSA-N	447.451	1.470	50	20	IDGD	
Cc1nc(Br)ccc1NC(=O)C(=O)NNC(=O)c1c(C)nc2ccccn12	763628590	BEJMNZGHUVOZHX-UHFFFAOYSA-N	431.250	1.508	50	20	IDGD	
COC(=O)c1cc(Cl)cc(NC(=O)C(=O)NNC(=O)c2c(C)nc3ccccn23)c1	763628965	NIECXVLSPQZQCL-UHFFFAOYSA-N	429.820	1.482	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccc(-c2nccs2)c1	763663547	VEQDKZAYPNMZHX-UHFFFAOYSA-N	426.454	1.984	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1nc(-c2nccn2C)cs1	763682258	PXCBVXALJUPDEZ-UHFFFAOYSA-N	444.473	1.107	50	20	IDGD	
O=C(NCc1ccc(N2CCCS2(=O)=O)cc1)NNC(=O)c1cc2c(s1)CCC2	763702705	VQYIYQMGFUDTLB-UHFFFAOYSA-N	434.543	1.921	50	20	IDGD	
O=C(CN1CCCc2ccccc21)NNC(=O)C(=O)Nc1ccc(C(=O)NC2CC2)cc1	763728789	RBFTUOIHUARXLU-UHFFFAOYSA-N	435.484	1.118	50	20	IDGD	
Cc1cnc(O)n1-c1ccccc1NC(=O)C(=O)NNC(=O)CN1CCCc2ccccc21	763745772	KCYYMEHMTOCFFZ-UHFFFAOYSA-N	448.483	1.425	50	20	IDGD	
CC(C)CNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)cc1	763807737	RAIWAESXDZESCA-UHFFFAOYSA-N	437.456	1.109	50	20	IDGD	
CCCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)cc1	763841340	QKUPGLQCOAKJLA-INIZCTEOSA-N	440.500	1.997	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)C[C@@H](OC)C3)cc1OC	763900261	HZCGUJMZWJSWCO-KRWDZBQOSA-N	427.457	1.607	50	20	IDGD	
Cc1ccc(C(=O)N2C[C@@H](C)C[C@@H](C)C2)cc1NC(=O)C(=O)NNC(=O)c1ccc[nH]1	763978777	FCUGDQMBSWEPIC-OKILXGFUSA-N	425.489	1.841	50	20	IDGD	
CC(C)C[C@H](C)n1nccc1NC(=O)C(=O)NNC(=O)c1cc(Br)c[nH]1	763994863	IGWOAMRGMASCQV-JTQLQIEISA-N	425.287	1.981	50	20	IDGD	
COC(=O)N(C)Cc1ccc(NC(=O)C(=O)NNC(=O)CCc2ccc(OC)cc2)cc1	764132179	QDFNEQLFNVTZKO-UHFFFAOYSA-N	442.472	1.612	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C)c(C)c(NC(=O)C(=O)NNC(=O)CCC(C)C)c1	764202604	FPMKDXXHYYBCGZ-UHFFFAOYSA-N	440.566	1.856	50	20	IDGD	
C[S@@](=O)Cc1cc(NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)ccc1Cl	764239246	ILBZFVASHZLRLQ-SSEXGKCCSA-N	446.916	1.959	50	20	IDGD	
CC[C@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)cc1	764242617	JPGSHKRASPQTEP-HNNXBMFYSA-N	435.484	1.956	50	20	IDGD	
CC(C)CCn1ccc(NC(=O)C(=O)NNC(=O)c2cc(Br)ccc2O)n1	764276943	JQKRZRPEAZSDNB-UHFFFAOYSA-N	438.282	1.797	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)ccc1O)C(=O)Nc1ccnn1-c1ccncc1	764279130	YSFCTERBBHOYHL-UHFFFAOYSA-N	445.233	1.135	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNS(=O)(=O)c3cccc(F)c3C)CC2)cc1	765124486	AWKSZYLHWBWFEZ-UHFFFAOYSA-N	434.537	1.570	50	20	IDGD	
CCNS(=O)(=O)c1ccc(C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)cc1	765313183	NVAGZTMAFWJPLL-UHFFFAOYSA-N	428.511	1.051	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNS(=O)(=O)c1ccc([N+](=O)[O-])c2cccnc12	766354863	RURGFDWEGPMDSS-UHFFFAOYSA-N	426.414	1.722	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@H](C)Sc3ccccn3)CC2)cc1	766651161	ZZSZCJFOASSQTM-SFHVURJKSA-N	427.574	1.836	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)c2cc(COc3ccccc3F)on2)c2ccccc2c1=O	767297858	ZVIYTLYGNCHYNS-UHFFFAOYSA-N	437.387	1.714	50	20	IDGD	
O=C(NNC(=O)c1cccc(OC(F)F)c1)NC1CCN([C@@H]2CCCC[C@@H]2O)CC1	767943481	NXSQVFQSAQNUGO-SJORKVTESA-N	426.464	2.000	50	20	IDGD	
CCCCCCn1cc(S(=O)(=O)NNC(=O)c2cccc(Cl)c2)c(O)nc1=O	769621406	PAECQEDOJBYQLF-UHFFFAOYSA-N	428.898	1.806	50	20	IDGD	
CCOC(=O)CON=C(C(=O)NNC(=O)c1cc2c(s1)CC[C@H](C)C2)c1cc[nH]n1	770823287	MHRDFCVNXMIGLN-NSHDSACASA-N	433.490	1.341	50	20	IDGD	
CCS(=O)(=O)Nc1ccccc1C(=O)NNc1nc(O)c2cnn(C(C)(C)C)c2n1	770969188	STOJUEAAALSIFC-UHFFFAOYSA-N	433.494	1.805	50	20	IDGD	
O=C(NCc1nc(COc2ccccc2)n[nH]1)NNC(=O)c1nn(-c2ccccc2)cc1O	771375917	GUNPTGTXFXAJRO-UHFFFAOYSA-N	448.443	1.419	50	20	IDGD	
Cc1ccc(-n2nccc2NC(=O)C(=O)NNC(=O)Cc2cccc3ccccc23)nn1	773500935	XRGRBZGBCFLBRZ-UHFFFAOYSA-N	429.440	1.453	50	20	IDGD	
Cn1cc(NC(=O)C(=O)NNC(=O)c2cccc(Br)c2)c(C(F)(F)F)n1	773532419	IEEOGJPEEFJMCB-UHFFFAOYSA-N	434.172	1.601	50	20	IDGD	
COc1ccc(C(=O)N2CCN(C)CC2)cc1NC(=O)C(=O)NNc1cccc(C#N)c1	773698167	AEQPQMMBCFIXHF-UHFFFAOYSA-N	436.472	1.036	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)ccc1F	774010254	XAWUCOIBQNUTFP-JTQLQIEISA-N	437.811	1.819	50	20	IDGD	
O=C(COc1ccc(Cl)cc1)NNC(=O)Nc1ccnn1[C@H]1CCS(=O)(=O)C1	776052496	AADYHWJWVWSIGF-LBPRGKRZSA-N	427.870	1.128	50	20	IDGD	
O=C(NNC(=O)N1CCC(Oc2cncc(Cl)n2)CC1)c1ccc(-n2cnnn2)cc1	777411821	IMNPNKSQYRDJRN-UHFFFAOYSA-N	443.855	1.004	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N[C@H](C)c2ncon2)cc1	778408979	HOQKVFOQPAPHAB-GULXKOIASA-N	435.444	1.601	50	20	IDGD	
COC(=O)c1cnc(C(=O)NNC(=O)[C@H]2Cc3ccccc3CN2Cc2ccccc2)cn1	779661635	WEYIIOLQXXSCBC-OAQYLSRUSA-N	445.479	1.651	50	20	IDGD	
O=C(NNC(=O)N1CC[C@@H](COc2ccccc2)C1)c1csc(N2CCOCC2)n1	779963631	BHMZFRPYYDZHCG-OAHLLOKOSA-N	431.518	1.735	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)NCc1ccc2c(c1)CN(C(=O)OC(C)(C)C)C2	780773898	HEPJFBYDJFWMHR-CQSZACIVSA-N	436.509	1.819	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)CN2C(=O)N[C@@](C)(c3ccccc3OC)C2=O)c1	780793011	PIFICQQYURPSEA-NRFANRHFSA-N	426.429	1.392	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)c2ccc(N3CCN(C(C)=O)CC3)c([N+](=O)[O-])c2)c1	780802637	YRNRPKOJWGSXHQ-UHFFFAOYSA-N	441.444	1.807	50	20	IDGD	
Cc1ccc(CNC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c(N2CCCC2)n1	781387908	XKEBPNZMXVKLQE-UHFFFAOYSA-N	431.518	1.538	50	20	IDGD	
O=C(NCc1ccccc1CN1CC[C@H](O)C1)NNC(=O)c1cc([N+](=O)[O-])ccc1O	781955357	POUKFDBZXVZDHR-INIZCTEOSA-N	429.433	1.011	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Nc2nnc(-c3c[nH]nc3C)s2)cc(OC)c1OC	782092490	FSKIQCNMYHFVPZ-UHFFFAOYSA-N	433.450	1.729	50	20	IDGD	
CC(C)[C@@H]1C[C@H](CC(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)CCO1	782118263	TWGRSVKFVMOANG-SJORKVTESA-N	439.582	1.302	50	20	IDGD	
Cc1nnnn1-c1cccc(NC(=O)C(=O)NNc2ccc(Br)cc2F)c1	783086697	SDWBLAWKTHPYAT-UHFFFAOYSA-N	434.229	1.954	50	20	IDGD	
CC[C@H](C)NS(=O)(=O)c1cccc(NC(=O)C(=O)NNc2ncnc3ccsc23)c1	783255295	QJOAJEPVVZFRCK-NSHDSACASA-N	448.530	1.850	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NC(=O)C(=O)NN=c2sc3ccccc3n2C)cc1	783349212	CVEJVBCGHVWZDL-UHFFFAOYSA-N	447.542	1.497	50	20	IDGD	
Cc1ccc(NNC(=O)C(=O)Nc2cc(C)nn2[C@@H]2CCN(Cc3ccccc3)C2)nn1	783953559	XVRMKDYAOBJOGQ-GOSISDBHSA-N	434.504	1.819	50	20	IDGD	
COC[C@H](C)NS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccccc2Cl)cc1	784773605	HVKLIYQAPRBBQR-LBPRGKRZSA-N	440.909	1.735	50	20	IDGD	
O=C(NNc1ccc(Cl)nn1)C(=O)Nc1ccc(-n2nccn2)cc1C(F)(F)F	784790138	WBEFUVCDLRBQHU-UHFFFAOYSA-N	426.746	1.811	50	20	IDGD	
C[C@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(NC(=O)C(=O)NNc3ccccn3)cc2)C1	784801516	QMGRPPIFLKSWEP-GASCZTMLSA-N	431.518	1.830	50	20	IDGD	
CCC(CC)NC(=O)[C@H]1CN(C(=O)C(=O)NNc2ccnc(F)c2)c2ccccc2O1	784847784	BWJFBWUXNUTJGI-QGZVFWFLSA-N	429.452	1.763	50	20	IDGD	
O=C(NNc1cc(Cl)ccn1)C(=O)Nc1ccc(C(=O)N2CCOCC2)c(Cl)c1	784861278	UENSJJKOWKDOGY-UHFFFAOYSA-N	438.271	1.943	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)Nc1ccccc1CC(F)(F)F	785023549	KXJYVRXPISMZBT-UHFFFAOYSA-N	426.307	1.805	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)C(=O)Nc1cccc(OC[C@@H]2CCCO2)c1	785067190	ILAGRSYPOJUYID-SFHVURJKSA-N	437.456	1.221	50	20	IDGD	
CS(=O)(=O)N1CCc2c(NC(=O)C(=O)NNc3cc(F)c(F)c(F)c3)cccc21	785088577	SLZKUQAMVFAFPU-UHFFFAOYSA-N	428.392	1.508	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)Nc1ccc(Oc2cccc(F)c2F)nc1	786097380	RECGLWACPGGIEX-SNVBAGLBSA-N	426.401	1.740	50	20	IDGD	
CN1CCC/C1=N/S(=O)(=O)c1ccc(NC(=O)NNc2cc(Cl)nc(N)n2)cc1	789051917	RIZASCOYXHRQMR-OYKKKHCWSA-N	438.901	1.674	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)c2cc(-c3ccccc3)on2)c1	791042769	VNIBUKKTLCXAQO-UHFFFAOYSA-N	432.433	1.806	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)[C@](C)(O)Cn2cc(C(F)(F)F)ccc2=O)cc1	792016415	OPEJEPQPRUEWEX-GOSISDBHSA-N	427.379	1.153	50	20	IDGD	
Cc1cc(O[C@@H]2CCN(C)C2=O)ccc1NC(=O)C(=O)NNc1ccc2c(=O)[nH]ccc2c1	793070010	LEDWHILYPVYXSQ-LJQANCHMSA-N	449.467	1.528	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2[C@@H](C)CN(C(=O)C(C)(C)C)C[C@@H]2C)cc1OC	795140374	CHRFMRSDGGHKFR-GJZGRUSLSA-N	434.537	1.432	50	20	IDGD	
Cc1ccccc1NC(=O)NNC(=O)[C@@H]1CCCN(S(=O)(=O)c2c(C)n[nH]c2C)C1	798312666	HYAXUHUIKGYJEG-OAHLLOKOSA-N	434.522	1.589	50	20	IDGD	
C[C@]1(CNC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)CCN(Cc2ccccc2)C1	798481802	NUQZWCURSDMDCD-JOCHJYFZSA-N	434.504	1.519	50	20	IDGD	
CNC(=O)CNC(=O)c1cccc(NC(=O)NNC(=O)COc2ccc(C)c(C)c2)c1	800596617	OGIZFQBZMSCJFD-UHFFFAOYSA-N	427.461	1.011	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NCCS(=O)(=O)CCc1ccccc1	800756924	QJFMGYJFNXKECU-HNNXBMFYSA-N	437.493	1.581	50	20	IDGD	
CN1C(=C(C#N)C(=O)COC(=O)CCC[C@@]2(C)NC(=O)NC2=O)N(C)c2ccccc21	801428985	JUDNNUJQOGUNEH-OAQYLSRUSA-N	425.445	1.188	50	20	IDGD	
Cc1c(NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)nnn1Cc1ccccc1F	801807933	IOOXJHYWAXVHPU-UHFFFAOYSA-N	436.411	1.216	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)[C@@H]2CCCN(S(=O)(=O)c3ccccc3)C2)cc1	802061120	KQJVFJXDSRYTRH-OAHLLOKOSA-N	432.502	1.949	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)CN2C(=O)[C@@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2=O)c(OC)cc1Cl	802086533	XHGSZJDTSMWJLP-DIRVTVSLSA-N	448.863	1.317	50	20	IDGD	
COC[C@@]1(CNC(=O)NNc2ccc(-n3ccnc3)nn2)CCCN1C(=O)OC(C)(C)C	805860218	CWVWCOCMQXJNNO-FQEVSTJZSA-N	446.512	1.705	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2cc(CS(C)(=O)=O)ccc2OC)cc1Cl	807022054	YWLJAUUBGIPOSP-UHFFFAOYSA-N	441.893	1.984	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)(F)F)cc1)NC1CCC2(CC1)NC(=O)NC2=O	807546475	OAKIUUYKJJWHTO-UHFFFAOYSA-N	449.411	1.127	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)c1ccc(N2CCCCC2=O)cc1	811851875	WQICBXINCNPIOO-HNNXBMFYSA-N	448.487	1.884	50	20	IDGD	
C[C@@]1(NNC(=O)NCCc2c[nH]c3cccc(Br)c23)CCS(=O)(=O)C1	812514557	AOFYFDCYJHQXTE-MRXNPFEDSA-N	429.340	1.854	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)COc2ccc(N3CCCC3=O)cc2)cc1	812728724	XHNVNKHJCOGBHM-UHFFFAOYSA-N	432.502	1.586	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)C1CCN(S(=O)(=O)c2ccccc2)CC1	825615130	JKZGFRXOROWWIE-UHFFFAOYSA-N	446.529	1.355	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)c1cc(C)c(C)c(S(=O)(=O)N(C)C)c1	825630916	UBKXLWHBIIKTPR-UHFFFAOYSA-N	434.518	1.435	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)c1ccc2ccccc2c1)C(=O)N1CC[C@@H](B(O)O)C1	864232339	ZZYDKACUWOBFHN-SJLPKXTDSA-N	436.364	1.315	50	20	IDGD	
O=C(COc1ccc(F)cc1)NN=Cc1c(N2CCOCC2)nc2ccccn2c1=O	874077193	PRCXBIAGINPKFR-UHFFFAOYSA-N	425.420	1.199	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)[C@H]2Cc3ccccc3CN2C(C)=O)cc1	912608286	XBQNQLWGMXRUMU-QVKFZJNVSA-N	425.485	1.973	50	20	IDGD	
C[C@H](Oc1ccccc1Cl)C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	914587033	MYJGOFQIWUBMFO-SJCJKPOMSA-N	434.832	1.638	50	20	IDGD	
COc1cc(C)c(S(=O)(=O)NNC(=O)c2csc(N3CCOCC3)n2)c(C)c1	914845890	YIBNJWWXVISZBU-UHFFFAOYSA-N	426.520	1.228	50	20	IDGD	
Cn1cc(S(=O)(=O)N2CCCCC2)cc1C(=O)NNC(=O)Cn1cnc2ccccc21	914846492	LXQHYQCTXCUFRO-UHFFFAOYSA-N	444.517	1.011	50	20	IDGD	
O=C(NCCNS(=O)(=O)Cc1ccccc1)NNC(=O)c1ccc2ccccc2n1	916517171	WEIVOVHREMKMPA-UHFFFAOYSA-N	427.486	1.298	50	20	IDGD	
COc1cccc(/C=C(\C#N)C(=O)OCC(=O)NNC(=O)c2ccc(OC)c(OC)c2)c1	916595464	LAHKITLNHWLALP-CXUHLZMHSA-N	439.424	1.624	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)COc1ccccc1[N+](=O)[O-])N1CCc2ccccc2C1	916605131	SMSRKHSAJBIGSS-OAHLLOKOSA-N	427.461	1.751	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccnc(-n3ccnc3)c2)c1	916734479	NMTUAPKMAIJUEO-UHFFFAOYSA-N	442.501	1.373	50	20	IDGD	
Cc1ccc(N2C(=O)C[C@H](C(=O)NNC(=O)CN3CCCC3=O)[C@@H]2c2cccs2)cc1	916758498	BISXQHWJSVYUHI-HRAATJIYSA-N	440.525	1.921	50	20	IDGD	
O=C(CN1C(=O)COc2cc(Br)ccc21)NNC(=O)c1ccc(Cl)nc1	917252703	XUVUPIWIOMLDJX-UHFFFAOYSA-N	439.653	1.684	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@@H](C)c2c(F)cccc2F)cc1	918101013	GGHBPLXTADOJAB-ZDUSSCGKSA-N	440.472	1.985	50	20	IDGD	
COc1ccc(CCCN(C)C(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1	918779237	IKRXDQIENLNHDM-UHFFFAOYSA-N	433.534	1.907	50	20	IDGD	
CS(=O)(=O)Nc1ccc(O)c(C(=O)NNC(=O)CSc2ccc(Cl)cc2)c1	919805646	DRHOKSAKYBEBOS-UHFFFAOYSA-N	429.907	1.970	50	20	IDGD	
O=C(COC(=O)[C@H]1CCN(c2ccc(F)cc2)C1=O)NNC(=O)c1ccc(Cl)cc1	920570397	TXRMXXWNOKQJAL-INIZCTEOSA-N	433.823	1.836	50	20	IDGD	
O=C(COC(=O)Cn1cc(C(F)(F)F)ccc1=O)NNC(=O)c1cccc(Cl)c1	1317696852	OYVLWMJGNJIEJT-UHFFFAOYSA-N	431.754	1.525	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2sccc2S(=O)(=O)Nc2cnn(C)c2)cc1	1318119963	AGCCPSKTSFIFPH-UHFFFAOYSA-N	435.487	1.366	50	20	IDGD	
CN(CC(=O)NNC(=O)c1ccccc1Cl)S(=O)(=O)c1cccc([N+](=O)[O-])c1	1323065198	HLSZOQCSFGNHEU-UHFFFAOYSA-N	426.838	1.330	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C(=O)Nc2cccnc2)C1	1779488244	DKHLGNGBOIXGRU-DYESRHJHSA-N	448.596	1.386	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc(O)nc2)C1	1780130856	KRNWNMAIYYGJIS-WPKBUWHJSA-N	426.311	1.698	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnn3c2CCC3)C1	1781286351	XACREMSEUUKCIR-VVFCZOMOSA-N	439.354	1.740	50	20	IDGD	
CCOC(=O)C1(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](C)Br)C3)CC1	1781627387	YWWDMZWLUFLYCX-HBUWYVDXSA-N	445.354	1.627	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)n(C)n1)C2	1781901741	VAVMWTWEKAGTNY-RVZJWNSFSA-N	443.342	1.427	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCc1cc(F)ccn1)C2	1782172283	SDNLRVIZTMOAFS-WAOWUJCRSA-N	441.931	1.921	50	20	IDGD	
C#CCO[C@H](C)C(=O)N1CCO[C@@]2(CCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1	1782861966	NNYAUKJLLNAIQM-AHFQKUAASA-N	443.450	1.740	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cccnc3S)CCO2)C1	1783338641	JQVUHZJCXIOEMX-GUYCJALGSA-N	428.352	1.987	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](C)Nc1cccnc1)CCO2	1783341887	HOMPQUNPLDYODA-ALKREAHSSA-N	439.354	1.885	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccnc(OC)c3)CCO2)C1	1783350090	ZYIVCYMPNRCQQT-KBXCAEBGSA-N	426.311	1.707	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@@H](C(=O)N2CC[C@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)C1	1783863868	NIMIPDXUDJZILC-LZJOCLMNSA-N	440.613	1.647	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)Cc3ccc(OC)c(O)c3)CCO2)C1	1783867752	AEMNOHBMECFAHX-QRWLVFNGSA-N	426.897	1.027	50	20	IDGD	
C[C@@H](CC(=O)N1CCO[C@@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1)Oc1ccccc1	1783937795	XUXKIAXXMDMFNV-FDDCHVKYSA-N	446.548	1.047	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cncc(F)c3)C[C@@H]21	1783967108	BRTMHENMATVREA-APYUEPQZSA-N	428.302	1.845	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](C)Sc3ccccn3)C2)C1	1784417380	GZQODMJZKLTIRB-DOXZYTNZSA-N	427.954	1.646	50	20	IDGD	
CCc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)CBr)C[C@@H]32)n[nH]1	1787165837	CVYCYLNQDJCUGX-DSPQJCBJSA-N	427.343	1.596	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(F)n3)[C@H]2C1	1788865573	DSPRQYYXHGIJKW-ABHRYQDASA-N	428.302	1.845	50	20	IDGD	
Cc1ccc(O)c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Br)C[C@@H]32)c1	1789493131	SOPLTSIWGFPUOG-DLKVLKDVSA-N	429.286	1.984	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(C)c4n[nH]cc4c3)[C@H]2C1	1790363692	AKABKHDUMZSIDW-RUGDWHBFSA-N	434.924	1.718	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)c1cnn2c1CCC2	1790390500	MANHCKNDDWMFHT-LVGORTOPSA-N	429.290	1.113	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)Nc1ccc(C2(NC(=O)C[C@@H]3NC(=O)NC3=O)CCC2)cc1	1790489789	YQEUWIRUUAOFDK-SCLBCKFNSA-N	441.315	1.955	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCSC)C[C@@H]21	1790964489	YLLBLGQSWDHSBX-AHDPXTMNSA-N	437.400	1.254	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4ncccn4n3)C[C@@H]21	1791055668	CRXGOOGXQFERCD-OSFYFWSMSA-N	436.310	1.106	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3n[nH]c(C4CC4)c3F)C[C@@H]21	1791252402	JZFPYFMISVIZOF-XUXIUFHCSA-N	428.892	1.273	50	20	IDGD	
COC(=O)C1(C(=O)Nc2ccc(C3(NC(=O)CCC(=O)NN(C)C)CCC3)cc2)CC1	1791310734	ZQVUUUMRIYFZEB-UHFFFAOYSA-N	430.505	1.447	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCCn3ccnc3)[C@H]2C1	1791566096	CZUPODLPDYCQKD-QAETUUGQSA-N	441.370	1.817	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)c1ccco1	1792593381	ZVXJAUPPAOOZNB-ZEVQPODASA-N	427.461	1.085	50	20	IDGD	
CC(C)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CC[C@H]3CCC(=O)N3C1)C2	1792784314	DNAQTWXKWGKLME-RPUYLAQPSA-N	425.957	1.242	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1CCc2ccccc2[C@H]1O	1793182787	HYKLXJXNKATQSX-JDHLRREYSA-N	442.560	1.294	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CC(c2ccccc2)=NO1	1793281249	OWLMZHDTNVCCOK-MGGVOPSTSA-N	435.908	1.023	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1Cc3ccccc3CN1)C2	1795112348	ARCFEINZPZVYFK-SFNKJDCFSA-N	436.350	1.076	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1sc(N)nc1C	1795670213	ZOXSNNOYZLJNIP-USZNOCQGSA-N	431.356	1.410	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCn1c(=O)oc3ccccc31)C2)[C@H](F)Cl	1796361799	NVGONUSXVFFCTO-LZDSYCOUSA-N	425.844	1.109	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H](CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Cl)C1	1796368043	BETZKWTZCOLZIP-GFISCPRKSA-N	447.935	1.758	50	20	IDGD	
COCc1oncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)CBr)C2	1796684846	XOUVRLKRPBVCPU-MCYUEQNJSA-N	430.299	1.055	50	20	IDGD	
COc1cccnc1CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CO[Si](C)(C)C	1797952975	VVQQKXGXPUISNE-VPTLXERWSA-N	435.597	1.464	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1nc2ccccc2o1	1799908975	QBOWOYFNHVJXIS-RDBQEKCUSA-N	426.242	1.722	50	20	IDGD	
CCC[C@H]1CC[C@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCC(=O)NN(C)C)C3)CC1	1800653421	BERRXUDFFXDXAA-UGEWPGMYSA-N	436.597	1.556	50	20	IDGD	
COc1cncc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)Br)c1	1800756769	IJWPKPNUPOBKTF-FRQROOTJSA-N	440.338	1.396	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COc1ccc(F)cc1)C2	1800757410	YIRRTXDVBJKCCR-JRATXPSKSA-N	429.286	1.578	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3cc(OC)ccc3n1)C2	1800978262	QHQKTSQICQUJIA-MQJTVSLUSA-N	447.919	1.700	50	20	IDGD	
COC(=O)CCCCCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2	1801075218	LCPBQLJCOXBEMJ-NOXHYTERSA-N	437.306	1.390	50	20	IDGD	
COCCOCCOCCOCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C(Cl)Cl)C2	1802100700	ZUDJMFDAUFPCIA-QDMKHBRRSA-N	441.352	1.125	50	20	IDGD	
C[C@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCC(=O)NN(C)C)[S@](=O)c1ccccc1	1802338007	HATPZBXKVFVVEH-NHBUCKSFSA-N	448.589	1.194	50	20	IDGD	
O=C1CC[C@H](C(=O)NC[C@@H]2CCN(C(=O)[C@H](F)Br)[C@@H]2c2cccnc2)CN1	1802611232	SCXWGYVPORUWGY-UGQVUOCMSA-N	441.301	1.304	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2c(F)ccc(O)c2F)[C@H]1c1cccnc1)[C@H](O)CCl	1803141788	UJEQUEIJKNUMQM-PNPHSEOMSA-N	439.846	1.985	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)C2(N3CCN(C)CC3)CC2)[C@@H]1c1cccnc1	1808275577	SKNBIZOTNATFOE-SLFFLAALSA-N	448.011	1.885	50	20	IDGD	
Cc1cc(NC(=O)CC(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@H]2c2cccnc2)no1	1808391336	FXMNBPGSBOJNII-KHYOSLBOSA-N	449.895	1.012	50	20	IDGD	
Cc1cc(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)cn1C	1808723157	CJERJZIPRBXUHF-SIKLNZKXSA-N	446.316	1.042	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@H]1c1cccnc1)c1cc[n+]([O-])cc1	1811197217	BHHXKKKMTNVCEA-JYJNAYRXSA-N	437.269	1.725	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)CCNC(C)=O)[C@@H]1c1cccnc1	1812662733	CHHLUCJPNBMNGW-BQFCYCMXSA-N	439.354	1.787	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cnc(O)nc2O)[C@@H]1c1cccnc1)C(Cl)Cl	1813079784	JEMBJBFHEUIRPS-CMPLNLGQSA-N	426.260	1.406	50	20	IDGD	
C[C@@H](CBr)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)C2=NNC(=O)C2)[nH]n1	1814782495	VOHTZOHPCUPNBU-CABZTGNLSA-N	425.287	1.309	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCC#N)CC2	1817279783	DWRZAIAKFBRMKI-BTQGWNRHSA-N	427.490	1.493	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H]2C[C@H]2F)[nH]n1	1818112976	XZTFQQCCJNJFHE-YHGAKORUSA-N	429.456	1.894	50	20	IDGD	
CCNC(=O)N[C@@H](C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CO[Si](C)(C)C)[nH]n1	1819353164	MDMZARDOQVLJED-ZFWWWQNUSA-N	438.605	1.961	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](O)N2CCOCC2)n[nH]1	1819441868	OJJCZIGFOKSQLK-WMLDXEAASA-N	427.933	1.317	50	20	IDGD	
COC[C@H](NC(C)=O)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CO[Si](C)(C)C)[nH]n1	1819611083	VAPLWPAWTTWNDU-HOTGVXAUSA-N	439.589	1.404	50	20	IDGD	
CNC(=S)NCCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](C)Br)CC2	1819810452	DWWXEMXRSHRHHD-RKDXNWHRSA-N	448.412	1.323	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](O)CCl)CC2)c1cc(-c2cccnc2)[nH]n1	1820607203	BLXGSHDVOSYHLC-NHYWBVRUSA-N	446.920	1.754	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(O)ccc2F)n[nH]1	1821081155	SFSPICZAWSRFCT-QGZVFWFLSA-N	446.483	1.933	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](F)Br)CC2)c1c[nH]c(=O)cn1	1821472498	NUVWZYNHPDHPDZ-KSBSHMNSSA-N	430.259	1.143	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](C)N2CCN(C)CC2)[nH]n1	1822374627	YLGZGVCMSNDDGA-BFYDXBDKSA-N	440.976	1.292	50	20	IDGD	
COc1cnc(C(=O)N[C@@H]2CCc3nc(NC(=O)[C@@H](F)Br)sc3C2)cn1	1823003127	IUBXFDXVZRTDCI-JMCQJSRRSA-N	444.286	1.858	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnc(O)nc1O)CC2	1825640905	KWLWJPKNFJDLBZ-RQJHMYQMSA-N	442.295	1.354	50	20	IDGD	
COC(=O)C1(C(=O)N[C@@H]2CCc3nc(NC(=O)[C@H](C)Br)sc3C2)CC1	1825647059	MOOVYODIBYPRBK-DTWKUNHWSA-N	430.324	1.792	50	20	IDGD	
Cc1cccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)n1	1825855166	YUMTYJJIHZNHKU-FQEVSTJZSA-N	429.565	1.996	50	20	IDGD	
Cc1nccn1CCCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](O)CCl)CC2	1826692089	LIPSDKPBWSGPBG-GXTWGEPZSA-N	425.942	1.640	50	20	IDGD	
O=C(c1cscn1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827051056	MGOHVLSZVLRLBL-IBGZPJMESA-N	427.335	1.370	50	20	IDGD	
O=C(c1ccns1)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827056549	XUGDEXATICTFHC-SFHVURJKSA-N	427.335	1.370	50	20	IDGD	
CC(C)(C)[C@H](O)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1	1828923273	BCXJRCXWDSVJBU-RBUKOAKNSA-N	445.564	1.325	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)c2[nH]cc3c2CCC3)CC1	1829584363	GDCHGJCWLPCPKL-JOCHJYFZSA-N	449.360	1.730	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(Cl)ccc3F)CCO2)C1	1830192023	MMRJWJFLSCJDDI-HNAYVOBHSA-N	449.306	1.803	50	20	IDGD	
COC(=O)[C@@H]1CC[C@H](C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)C1	1830353608	GOKILIYJHXAYQI-GCKMJXCFSA-N	444.956	1.297	50	20	IDGD	
COc1cccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)n1	1830359194	WEYVLNJQCCPYNV-HXUWFJFHSA-N	425.913	1.425	50	20	IDGD	
O=C(c1cc(O)nc(O)n1)N1CCC([C@H]2CCCCN2C(=O)[C@@H](F)Br)CC1	1830379004	ZPIHBFBXHIKOBZ-TZMCWYRMSA-N	445.289	1.812	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cn4ncccc4n3)C2)C1	1831646302	JYDGGVHLHAATLS-FOIQADDNSA-N	435.912	1.207	50	20	IDGD	
O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)c1ncc(F)cc1F)CCO2	1831960336	SSWRNMWLHKJCGQ-QGZVFWFLSA-N	448.264	1.215	50	20	IDGD	
CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H](F)Cl)CC1	1832139355	WLSBMIRXCBFIKT-KZNAEPCWSA-N	441.935	1.611	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnc(C)nc3)CCO2)C1	1833817060	IJDIZVGBKRDYKT-YJBOKZPZSA-N	441.326	1.029	50	20	IDGD	
O=C(CCBr)NC1CCN(C2CCN(C(=O)[C@@H](O)c3ccco3)CC2)CC1	1834421815	WOMBOZVFGWZIPE-SFHVURJKSA-N	442.354	1.670	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)[C@@H]1Cc2ccccc2O1	1835474700	IBOYVVBPYKYGLV-QUCCMNQESA-N	435.952	1.161	50	20	IDGD	
CC[C@@H](NC(C)=O)C(=O)N1CCC(N2CCC(NC(=O)[C@H](F)Br)CC2)CC1	1836413760	OTDZAAOMMCGBLB-CVEARBPZSA-N	449.365	1.163	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1Cc3ccccc3O1)CCO2	1836649762	AMJHWAAOMJTVGJ-DENIHFKCSA-N	448.592	1.298	50	20	IDGD	
CCc1cnc(C(=O)N2CCC(OC3CCN(C(=O)[C@H](O)CCl)CC3)CC2)s1	1836717087	HKXNVXREZCTMIM-MRXNPFEDSA-N	429.970	1.917	50	20	IDGD	
CCc1[nH]nc(C(=O)N2CCC(OC3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)c1Cl	1836717730	HYVUBXAIKWKEQO-HNNXBMFYSA-N	447.363	1.837	50	20	IDGD	
Cc1nc(C)c(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)o1	1838006000	HRWDEGBJLPCVNG-CZUORRHYSA-N	434.262	1.052	50	20	IDGD	
Cn1ccc(=O)cc1C(=O)N1CCC(OC2CCN(C(=O)C(Cl)Cl)CC2)CC1	1838529799	ZZUHGDLVLSWKDX-UHFFFAOYSA-N	430.332	1.801	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(Cl)cnc3OC)C2)C1	1839141533	KRWQZRUOGUDINB-KXBFYZLASA-N	446.331	1.831	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccc(C)o3)C2)C1	1839967681	UIZFBWDOSYAXMU-VQIMIIECSA-N	443.338	1.760	50	20	IDGD	
CC[C@H](C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](C)Br)CCO2)C1)N(CC)CC	1840030197	DCPHJRNDEDQTAT-FCEWJHQRSA-N	448.402	1.347	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)C[C@H]3CCCCO3)C2)C1	1840030669	SCPQSIXEUUVHRY-DAYGRLMNSA-N	433.343	1.185	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(F)c3F)C2)C1	1840154069	KLBUHOSBANLVLP-AUUYWEPGSA-N	432.851	1.289	50	20	IDGD	
Cc1ncccc1CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840187097	VGQDWKVTMOUHJI-IBGZPJMESA-N	430.332	1.583	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(C)cc3OC)CCO2)C1	1840680225	PUBVMIPSAZOMNM-UWJYYQICSA-N	440.924	1.327	50	20	IDGD	
CN(CC(=O)N1CC2(CCCN2C(=O)[C@@H]2C[C@H]2C2CC2)C1)NC(=O)NCc1ccccc1	1841273252	SATVXAGWFSJLNM-VQTJNVASSA-N	439.560	1.582	50	20	IDGD	
CCCN1CCN(c2ccc(C(=O)N3CC4(CCCN4C(=O)[C@H](O)CCl)C3)cc2)CC1	1841353167	IEZZHIXDUZEHSJ-HXUWFJFHSA-N	448.995	1.635	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CCCC[C@H]1C(=O)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1	1841354836	ZKHITEGUYAKHKU-BZUAXINKSA-N	443.972	1.873	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)CCOCCOCCOCCOC)C1	1845246083	GCKCHMPADCBVLR-KRWDZBQOSA-N	434.961	1.294	50	20	IDGD	
C=CCCc1ccc(C(=O)N2CC3(CCCN3C(=O)CCC(=O)NN(C)C)C2)c(O)n1	1846384404	PBGYKXWRCVWXBI-UHFFFAOYSA-N	429.521	1.096	50	20	IDGD	
O=C(c1ccc2[nH]nc(C(F)(F)F)c2c1)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl	1847562364	DEDCZUWMNRDXJQ-IHRRRGAJSA-N	430.814	1.997	50	20	IDGD	
CCn1ccc(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)n1	1848095665	LUPXDWVYYWWKLF-JYJNAYRXSA-N	439.944	1.851	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)Cc2c(C)nc3nc(SC)nn3c2C)c1	18082333	CUFVMAIPHRSHAR-UHFFFAOYSA-N	430.490	1.484	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CSc1nnc(SCC(N)=O)s1	24453307	HOYNQIZKVJUAAD-UHFFFAOYSA-N	447.951	1.331	50	20	IDGD	
O=C(CNC(=O)c1ccc(Br)o1)NNC(=O)c1cc(-c2ccccc2)on1	28791983	BREVVMBJICJHQO-UHFFFAOYSA-N	433.218	1.888	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN(C(=O)CCOc2ccccc2)C1)c1ccc2c(c1)OCO2	108617369	BHEVUBGMXKASGI-QGZVFWFLSA-N	439.468	1.884	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)C2=NO[C@@H](c3ccccc3)C2)cc1	108756348	RPYNKOZCJLJNBT-GOSISDBHSA-N	430.486	1.281	50	20	IDGD	
Cn1c(S)nc2cc(C(=O)NNc3ccc(S(=O)(=O)NC4CC4)cc3)ccc2c1=O	726863474	VHKWEPDGUAWKAL-UHFFFAOYSA-N	445.526	1.420	50	20	IDGD	
CC(C)CC(=O)N[C@H](C(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)c1ccccc1	727365836	ZAWCPCHEFLYRDY-IBGZPJMESA-N	435.484	1.598	50	20	IDGD	
COCCN1C[C@H](C(=O)NNc2ccc(S(=O)(=O)Nc3ccccc3)cc2)CC1=O	728217636	KBZQEUQVOMJHKE-OAHLLOKOSA-N	432.502	1.425	50	20	IDGD	
CCOC(=O)C1=NN(c2ccccc2)[C@@H](C(=O)NNC(=O)c2cc(OC)cc(OC)c2)C1	728457839	RQFDYGFNGHTJSL-LJQANCHMSA-N	440.456	1.663	50	20	IDGD	
O=C(NC[C@H]1CCN(c2ccc(F)cc2)C1)NNC(=O)C1CCN(c2ncccn2)CC1	728950691	YMZALSLCPCARIR-MRXNPFEDSA-N	441.511	1.689	50	20	IDGD	
O=C(NC[C@H]1CN2CCC[C@@H]2CO1)NNC(=O)c1ccc(Br)cc1Cl	729500628	VAHUQJPPOLYUFJ-NEPJUHHUSA-N	431.718	1.910	50	20	IDGD	
CS(=O)(=O)Nc1cccc(CC(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)c1	730338870	DDYXZCCZFZKLBR-UHFFFAOYSA-N	439.877	1.258	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)c1ccc2c(c1)C(=O)N(Cc1ccncc1)C2=O	731491648	RZVSYHYTSBKNGF-UHFFFAOYSA-N	430.420	1.961	50	20	IDGD	
Cc1cc(C)nc(SCc2ccc(C(=O)NNC(=O)CN3CCN(C)CC3)cc2)n1	731865790	IDSVKFOXFZEHPW-UHFFFAOYSA-N	428.562	1.394	50	20	IDGD	
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC(C(=O)NNc2nc(-c3ccncc3)no2)CC1	732068298	PCTBACRFCXTHJW-UHFFFAOYSA-N	446.493	1.016	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)CNS(=O)(=O)c1ccc2c(c1)OCCCO2)c1ccccc1	732291256	DJSDVZJIMZPPBM-QGZVFWFLSA-N	447.513	1.467	50	20	IDGD	
Cc1ccccc1-n1cc(C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)cn1	732653969	QYGFPOKFKMEUQK-UHFFFAOYSA-N	426.502	1.857	50	20	IDGD	
CC(=O)NCCc1ccc(S(=O)(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1	733123024	NHZIGEPWBMVPJJ-UHFFFAOYSA-N	427.486	1.174	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)CSCC(=O)Nc1cccc(Br)c1	735516305	NVQRTDVGJXXQMO-UHFFFAOYSA-N	426.296	1.614	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)NC[C@@H](c2ccc(C(F)(F)F)cc2)N2CCOCC2)cn1	735580217	QNMWPUKHDWRKDU-INIZCTEOSA-N	440.426	1.456	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)Cn1cnc2sc(-c3ccccc3)cc2c1=O	740852680	ICNCOIZXSKWSGH-UHFFFAOYSA-N	441.513	1.577	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)[C@H](C)NC(=O)c2cc3c(C)nn(C)c3s2)c1	742033248	LELHSOQQISBAIF-AWEZNQCLSA-N	443.529	1.905	50	20	IDGD	
Cc1c(S(=O)(=O)NNC(=O)COc2ccccc2O)cnn1-c1ccc(Cl)cc1	742292388	XFTKLFGFSSZLCV-UHFFFAOYSA-N	436.877	1.928	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C[C@@H](C)/N=C1/NS(=O)(=O)c2ccccc21	742478393	NPGBFJNIFFKARM-OLZOCXBDSA-N	448.476	1.258	50	20	IDGD	
O=C(NNc1ncnc2[nH]cnc12)[C@H]1CCCN(C(=O)c2ccccc2OC(F)F)C1	743471072	PRLZJTMYBDIITG-NSHDSACASA-N	431.403	1.950	50	20	IDGD	
COc1ccccc1O[C@@H](C)CNC(=O)NNC(=O)c1csc(N2CCOCC2)n1	743509864	MFOMXHFNRUDHMQ-ZDUSSCGKSA-N	435.506	1.400	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NCC(=O)N2CCCc3ccccc32)cc1	743560660	GWVZLGJINQKFGI-UHFFFAOYSA-N	445.501	1.405	50	20	IDGD	
CN(CC(=O)NNC(=O)c1cccc(C#N)c1)[C@@H]1CCN(c2ccccc2Cl)C1=O	744400013	BJTDNHJQHHDUNV-GOSISDBHSA-N	425.876	1.710	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)CCCNC(=O)c2ccc(Cl)cc2)c1	744481396	DUSLKXBOUWLSKU-UHFFFAOYSA-N	442.859	1.726	50	20	IDGD	
C[C@H](CC(=O)c1cccc(F)c1)C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	745398254	BARLAVWGCXJPBC-BFUOFWGJSA-N	444.415	1.565	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)NCCOc2ccc(S(C)(=O)=O)cc2)cc1	745809704	UHWRZGZADXVKEG-UHFFFAOYSA-N	435.506	1.571	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)N[C@H]1CC(=O)N(CCOc2ccccc2)C1	745845799	AIJZUVSKASOCJG-WBVHZDCISA-N	444.463	1.603	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2ccc(C)c(C(=O)NNC(=O)N3CCOCC3)c2)cc1	745992900	MNUFBFCOOCDTDG-UHFFFAOYSA-N	432.502	1.791	50	20	IDGD	
CC[C@H](Nc1c([N+](=O)[O-])c(C)nn1C)C(=O)NNC(=O)Cc1nc2ccccc2n1C	746095613	VKTYYKONNFCTBE-LBPRGKRZSA-N	428.453	1.104	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)OCC(=O)N2CCC2)cc1	746934594	IDSFCNBOGIEBNA-LFIBNONCSA-N	437.456	1.117	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)N[C@H]1CCN(CC(F)(F)F)C1	747308137	MASHSMQEUQKDEL-NSHDSACASA-N	439.232	1.795	50	20	IDGD	
COC(=O)c1csc(S(=O)(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)c1	749151890	KKMGVJCNFIZGPN-UHFFFAOYSA-N	430.460	1.184	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)NCc3cccc(COCC(F)(F)F)c3)nc21	750445572	OYMZILJPWVQRFE-UHFFFAOYSA-N	425.371	1.974	50	20	IDGD	
O=C(Cc1ccc2c(c1)COC2)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	753998949	ODQKGDBHDLZJSP-UHFFFAOYSA-N	429.498	1.505	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccc(CN3CCOC3=O)cc2)c1	756111228	UKQRJRONMJABHG-UHFFFAOYSA-N	432.458	1.509	50	20	IDGD	
Cc1c(NC(=O)NNC(=O)COc2ccccc2C#N)cccc1C(=O)N1CCOCC1	756184643	IQJSXHSXJREUCR-UHFFFAOYSA-N	437.456	1.571	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)Cn2ccc3ccccc32)cc1NS(C)(=O)=O	756786421	LIBUNAAJUCHOHK-UHFFFAOYSA-N	431.474	1.874	50	20	IDGD	
COc1ccc(OC(F)F)c(CNC(=O)NNC(=O)CNC(=O)c2cccs2)c1	756931460	KXUGGXVYSLLRGI-UHFFFAOYSA-N	428.417	1.619	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)CN2C(=O)NC3(C[C@@H](C)C[C@H](C)C3)C2=O)c1	757833762	CVWOAJUMAAVKNE-GJZGRUSLSA-N	444.488	1.046	50	20	IDGD	
Cc1ccc(-c2nc(C(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)cs2)n1C	758056529	WKYCQEWZNCGYDA-UHFFFAOYSA-N	447.542	1.782	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)[C@@H]1CC(=O)N(c2ccc3c(c2)CCC3)C1	760440077	QMDJPMCQFSPCCM-MRXNPFEDSA-N	430.505	1.590	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)CN2C(=O)N[C@](C)(c3ccc4ccccc4c3)C2=O)nc1	760789648	NTBPXQJYXBBKSH-HSZRJFAPSA-N	447.451	1.932	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)CCNC(=O)[C@H]2CCCN2C(=O)OC(C)(C)C)cc1	760801866	WHHARPDNUOZKGK-QGZVFWFLSA-N	448.520	1.427	50	20	IDGD	
O=C(Cc1cccc(I)c1)NNc1nccc(N2CCOCC2)n1	762854308	YDWAECQKWMHQLF-UHFFFAOYSA-N	439.257	1.604	50	20	IDGD	
O=Cc1ccc(OCCn2cc(C(=O)NNC(=O)Cc3ccncc3)nn2)c(Cl)c1	763439491	FNNLEBLWXQCLPC-UHFFFAOYSA-N	428.836	1.222	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)[nH]n1)C(=O)Nc1ccccc1CN1CCOCC1	763600461	IRRSVXOQWBLVSE-UHFFFAOYSA-N	448.483	1.309	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)C(=O)Nc2cc(C(N)=O)ccc2F)c1	763601936	NXGPAQVFMCTYHR-UHFFFAOYSA-N	430.436	1.521	50	20	IDGD	
CNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2-c2ccccc2)cc1	763643683	JAJSQLWFMMMXKT-UHFFFAOYSA-N	446.463	1.878	50	20	IDGD	
Cc1ccc(-n2cc(C)cn2)c(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)c1	763678133	DEYVPGIHHFIZFW-UHFFFAOYSA-N	432.440	1.526	50	20	IDGD	
O=C(CN1CCCc2ccccc21)NNC(=O)C(=O)Nc1cncc(Br)c1	763745691	ILYDOVXHQXNAHD-UHFFFAOYSA-N	432.278	1.383	50	20	IDGD	
CC(C)n1nnnc1-c1ccccc1NC(=O)C(=O)NNC(=O)c1cccc(N(C)C)c1	763760186	GLSQCLIUACYKQE-UHFFFAOYSA-N	436.476	1.387	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(N(C)C)c2)cc1N1CCOC1=O	763761012	YFCPPYGLIQYLBU-UHFFFAOYSA-N	441.444	1.118	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2ccccc2C(=O)N2CCCC2)c1	763771941	ILYXAAHAFOMAGP-UHFFFAOYSA-N	440.456	1.340	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)C(=O)Nc1ccc(F)c(C(F)(F)F)c1	763792005	ZVQYWYRVRNSSDZ-UHFFFAOYSA-N	437.309	1.893	50	20	IDGD	
CNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc3ccccc3c2)c1	763851462	CUKFBJQPCZEIKP-CQSZACIVSA-N	434.452	1.753	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1cccc(Cn2cccn2)c1	763873632	WTUFGRDXANDDNM-CQSZACIVSA-N	425.420	1.624	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)OCCCO3)cc1	763878694	SUBAACWFUIUYRV-CQSZACIVSA-N	441.440	1.604	50	20	IDGD	
CCN1CCC(n2nccc2NC(=O)C(=O)NNC(=O)CSc2ccc(C)cc2)CC1	763897119	VMTJFIDCCYDPPA-UHFFFAOYSA-N	444.561	1.727	50	20	IDGD	
Cn1nc(CC(C)(C)C)cc1NC(=O)C(=O)NNC(=O)c1cc(Br)c[nH]1	763995003	CAWASCKGVJOTBP-UHFFFAOYSA-N	425.287	1.499	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NNC(=O)CSc2ccccc2O)cc1	764045812	ALBQCLXDVBDXMR-INIZCTEOSA-N	449.554	1.793	50	20	IDGD	
COC(=O)C(C)(C)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)cc1	764117049	NUUJZFGJSADXLE-UHFFFAOYSA-N	433.848	1.896	50	20	IDGD	
COC(=O)c1cc(C(C)(C)C)sc1NC(=O)C(=O)NNC(=O)[C@H]1Cc2ccccc2O1	764167738	MAUFWZWGWLMFIM-CQSZACIVSA-N	445.497	1.922	50	20	IDGD	
O=C(CCc1ccccc1)NNC(=O)C(=O)Nc1ccc(F)c(-n2nnnc2C2CC2)c1	764192868	LVVGSWOHBYKKSK-UHFFFAOYSA-N	437.435	1.398	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)CCC2CCCCC2)c(C(=O)N(C)C)cc1OC	764215543	YDIMDNZCZFVMGB-UHFFFAOYSA-N	448.520	1.852	50	20	IDGD	
O=C(NNC(=O)C1CCC1)C(=O)Nc1ccc(-c2csc(N3CCOCC3)n2)cc1	764335484	SNEAACCAQDSMNL-UHFFFAOYSA-N	429.502	1.533	50	20	IDGD	
COC(=O)c1c(NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)sc(C)c1C	764349479	LHJMMOPFQZHFPD-UHFFFAOYSA-N	425.850	1.910	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)C(=O)Nc1ccc(-n2cccn2)cc1C(F)(F)F	764353980	NZFOZLKAJYCYPO-UHFFFAOYSA-N	432.362	1.615	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)C(=O)Nc2cc(-c3ccccc3)cnc2C)c1	764433166	LDCCZAZGUUWKNZ-UHFFFAOYSA-N	432.440	1.810	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2cccs2)[nH]n1)Nc1nc(CN2CCOCC2)cs1	765306694	IIFIJFSUNICONJ-UHFFFAOYSA-N	433.519	1.893	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)Nc2cccc(S(=O)(=O)NCCN(C)C)c2)cc(C#N)n1C	765722066	ABGIPHFJNCDAFM-YVLHZVERSA-N	440.529	1.591	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	766636349	NWRFZLZFKSUTEB-UHFFFAOYSA-N	448.321	1.007	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)O[C@@H]2CCCNC2=O)cc1	767268590	QVYOIUYHZSZDIX-VHUCWBOISA-N	437.456	1.163	50	20	IDGD	
COc1ccc(NNC(=O)[C@@H]2CCN(c3ccc4c(c3)OCCO4)C2=O)c([N+](=O)[O-])c1	768332323	WBXDEIDNKCGHEY-AWEZNQCLSA-N	428.401	1.871	50	20	IDGD	
CC1(C)CCC[C@@]2(C1)NC(=O)N(CC(=O)NNC(=O)c1cc(-c3cccs3)[nH]n1)C2=O	768572757	YMSWMZGDMFREEF-FQEVSTJZSA-N	444.517	1.790	50	20	IDGD	
O=C(NNC(=O)c1cccnc1I)c1ccc2c(c1)OCCO2	770468625	JNMSINWYYDIHGL-UHFFFAOYSA-N	425.182	1.532	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)N1CCO[C@H](C(=O)OC(C)(C)C)C1	770659430	SDIDCNZKUYIOGZ-DOMZBBRYSA-N	427.885	1.891	50	20	IDGD	
O=C(NNc1ccc(Br)c(F)c1)[C@H]1CC(=O)N([C@@H]2CCS(=O)(=O)C2)C1	771682137	HXLZGILTQKJGIK-GXSJLCMTSA-N	434.287	1.067	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)c1ccc(F)c(S(=O)(=O)NC(C)C)c1	771991329	XYOQOTAIJGBZNB-GFCCVEGCSA-N	431.486	1.251	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)[C@H]1CC(=O)N(c2ccccc2Cl)C1	772191129	BMMINELBNPARKH-ZDUSSCGKSA-N	449.294	1.810	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)N[C@@H]1[C@H]2CCc3ccccc3[C@@H]21	772631886	SWOMQLRZLZYQCZ-YESZJQIVSA-N	427.530	1.961	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NNC(=O)c2cc(F)cc([N+](=O)[O-])c2N)C1	773422668	XLWZPIGKTJTDJC-SNVBAGLBSA-N	425.417	1.724	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2ccc(NC(=O)OC(C)(C)C)c(OC)c2)n1	773724041	LAGOYMGKWNHLCS-UHFFFAOYSA-N	432.437	1.923	50	20	IDGD	
COc1cccc(C2(NCC(=O)NNC(=O)Cc3nc(C)cs3)CCOCC2)c1F	773992626	YOABQRFMKQUQNX-UHFFFAOYSA-N	436.509	1.585	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)NC[C@@H]2CC[C@@H](C(=O)N(C)C)O2)c(C)n1-c1ccccc1	775460364	IXFQYIRRECDADL-HKUYNNGSSA-N	427.505	1.674	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2c(F)ccc(F)c2F)CC1	776148702	RWUNSZZEHNNVAU-UHFFFAOYSA-N	429.424	1.192	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)[C@@H]2CCCN2C(=O)C(F)(F)F)c2ccccc2c1=O	776598631	SUWQMMGVUAOUPY-ZDUSSCGKSA-N	439.394	1.121	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc3nsnc3c2)c1	776701415	DJMSHDKQURKQFA-UHFFFAOYSA-N	433.515	1.797	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)c2nnn(-c3cccc([N+](=O)[O-])c3)c2C)nc1C	778429397	KCIPVHXXRQBDMU-UHFFFAOYSA-N	426.393	1.516	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)c2cc(S(=O)(=O)NC)ccc2Cl)nc1C	778429944	NSCILTNBTMGQCH-UHFFFAOYSA-N	427.870	1.280	50	20	IDGD	
COC[C@H](C)n1ccc(NC(=O)C(=O)NNC(=O)COc2cccc(C(F)(F)F)c2)n1	778708005	ZDVQNFCDERWSPQ-NSHDSACASA-N	443.382	1.274	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CC[C@@H]([C@@H](C)NC(=O)OC(C)(C)C)C2)n1	778985540	YTGMFWZUYYDDFI-ZIAGYGMSSA-N	425.555	1.377	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)[C@H]2CC(=O)N(c3ccc(F)c(C)c3)C2)n1	780178922	AONURWQQSUUNPQ-ZDUSSCGKSA-N	448.476	1.185	50	20	IDGD	
CNC(=O)[C@@H]1CN(C(=O)C(=O)NNc2ccc(Br)cc2)c2ccccc2O1	783005658	BRHUJJCFEZFFQG-HNNXBMFYSA-N	433.262	1.432	50	20	IDGD	
CC(=O)N/C(=C\c1ccccc1)C(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	783704558	OZHNVQHAUJHTHG-SDXDJHTJSA-N	445.520	1.799	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NN=C(C)[C@@H]1CCCO1)N(S(C)(=O)=O)CC2	783809357	CBSYQIGJWQBLGS-SJORKVTESA-N	439.534	1.624	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1ccc2nc(C3CC3)sc2c1	784003183	BLCIAPIWBBKWES-UHFFFAOYSA-N	443.510	1.751	50	20	IDGD	
COc1cc(C#N)ccc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	784210616	YFRHASBROXSCCL-UHFFFAOYSA-N	429.458	1.089	50	20	IDGD	
Cc1cc(N(C)C)ccc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	784215444	IRQOCQXERCSGOK-UHFFFAOYSA-N	431.518	1.584	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)cc1F	784217616	VNRRDWFCRPDKFJ-UHFFFAOYSA-N	436.465	1.747	50	20	IDGD	
Cc1cc(F)ccc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	784231366	YTLIJBXYHFJHSM-UHFFFAOYSA-N	449.508	1.152	50	20	IDGD	
O=C(CN1CCOCC1)Nc1ccc(NC(=O)C(=O)NNc2ccccc2Cl)cc1	784780469	WJSNWGGEEPOJJX-UHFFFAOYSA-N	431.880	1.693	50	20	IDGD	
COC(=O)c1cc(C)ccc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)C(F)F)cc1	784834252	ZEKHOQWGYDYHQO-UHFFFAOYSA-N	441.412	1.860	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)C(=O)Nc2ccccc2CN2CCSCC2)c1	784845042	XCOMNNQFNWTMCZ-UHFFFAOYSA-N	448.570	1.721	50	20	IDGD	
COc1cccc(NNC(=O)C(=O)Nc2cccc(S(=O)(=O)N3CCCCC3)c2)n1	784847894	ONGULUZTOXUHQC-UHFFFAOYSA-N	433.490	1.347	50	20	IDGD	
CN(C)c1ccc(C(F)(F)F)cc1NC(=O)C(=O)NNC(=O)Cc1cn2ccccc2n1	785068013	RALQHZRVIMOBOQ-UHFFFAOYSA-N	448.405	1.748	50	20	IDGD	
CC(C)(C)[C@H]1CCc2nc(NC(=O)C(=O)NN[C@@]3(C)CCS(=O)(=O)C3)sc2C1	789751300	VLASUXMOZMCUJH-VOJFVSQTSA-N	428.580	1.431	50	20	IDGD	
CCCNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)c1	789809963	IQUSYUUTQYNQEG-OALUTQOASA-N	438.484	1.485	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)NCc2ccc(S(=O)(=O)CCO)cc2)c1C	791969912	XHIDUQXWNYXTHV-DEDYPNTBSA-N	445.541	1.741	50	20	IDGD	
O=C(O)c1ccc(S(=O)(=O)NNC(=O)c2ccc(Cl)nc2)c(OC(F)(F)F)c1	792700013	WQDRWQBNRUVMGK-UHFFFAOYSA-N	439.755	1.955	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNc2ccc3c(=O)[nH]ccc3c2)cc1C(=O)OC	793069197	ILLSIURXCMGEND-UHFFFAOYSA-N	438.396	1.183	50	20	IDGD	
COc1cccc(C(=O)CCCC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1	794186091	SRWKTHMKRAANIG-UHFFFAOYSA-N	447.513	1.760	50	20	IDGD	
O=C(CCCS(=O)(=O)c1ccc(Cl)cc1)NNC(=O)CNC(=O)c1ccco1	795956033	FCORYDPWFHGCDO-UHFFFAOYSA-N	427.866	1.064	50	20	IDGD	
CCNC(=O)N(C)c1cccc(NC(=O)C(=O)NNC(=O)c2cccc3ncccc23)c1	797009164	QQPQTXOMUQDGQM-UHFFFAOYSA-N	434.456	1.800	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccnc(OCC(F)(F)C(F)F)c2)n1	797371555	YVVTVDQSOGLJMG-UHFFFAOYSA-N	429.330	1.464	50	20	IDGD	
Cc1ncsc1C(=O)NNC(=O)C(=O)Nc1ccc(Cl)c(CN2CCOCC2)c1	797534648	CPXOOBHQNZPYAL-UHFFFAOYSA-N	437.909	1.337	50	20	IDGD	
COC(=O)c1cc(Cl)c(Cl)cc1NC(=O)C(=O)NNC(=O)c1ccc(O)cc1	797537358	KBMMWNQCOFIPPA-UHFFFAOYSA-N	426.212	1.885	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)Cc2ccc([S@@](C)=O)cc2)cc1	797789312	NNNPWLPQPPAXHV-SSEXGKCCSA-N	443.554	1.849	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(Cl)c(CN(C)C)c1	799257054	FVSDLBRTBRHFPY-UHFFFAOYSA-N	434.880	1.575	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(-c2ccnn2C)ccc1C	799257669	OKEZVFLMRBKBOY-UHFFFAOYSA-N	437.456	1.569	50	20	IDGD	
O=C(CN1CCS(=O)(=O)CC1)NNc1c(Br)cccc1Br	801504990	KTNRNLBRXIUYOM-UHFFFAOYSA-N	441.145	1.385	50	20	IDGD	
COC(=O)c1c(F)cc(NC(=O)C(=O)NNc2ccnc(Br)c2)cc1F	802571738	LAJFBQJPXUNVGP-UHFFFAOYSA-N	429.177	1.991	50	20	IDGD	
C=CCn1c(=O)c2ccccc2n2c(SCC(=O)NNc3cccc(F)n3)nnc12	804766091	IVATVFPIZOJLBL-UHFFFAOYSA-N	425.449	2.000	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N(C)C[C@@H](C)OC)cc1	804839153	YJVSNPRPGDSNNO-QJISPJEISA-N	425.489	1.834	50	20	IDGD	
CCC(C)(C)[C@@H]1CCc2nc(NC(=O)C(=O)NNC(=O)[C@@H](C)OCCOC)sc2C1	806978975	KIRSJMKFPBBBTB-CHWSQXEVSA-N	440.566	1.822	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)C(=O)Nc1cc(F)c(N2CCOCC2)cc1F	806979036	QBOFNGTZBICTNH-UHFFFAOYSA-N	448.426	1.226	50	20	IDGD	
O=C1COC[C@@H](C[C@@H]2CN(C(=O)C(=O)NNc3c(F)cccc3Cl)c3ccccc32)N1	806983324	ODTVQAVQVPZDPP-CHWSQXEVSA-N	446.866	1.958	50	20	IDGD	
O=C(COc1ccccc1Cc1ccccc1)NNC(=O)NC[C@@H]1CCCS(=O)(=O)C1	807582412	YZRUXWYRBYOQBT-SFHVURJKSA-N	445.541	1.811	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)CNS(=O)(=O)c1ccc2ccccc2c1	810194140	NQNWKJPWJGCJJQ-UHFFFAOYSA-N	427.482	1.517	50	20	IDGD	
COC[C@]1(CNC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)OCCc2ccccc21	811880994	SFGVDGKLGVWTIF-QHCPKHFHSA-N	435.484	1.931	50	20	IDGD	
CN(C)c1noc(CNC(=O)NNC(=O)[C@H]2Cc3ccccc3CN2Cc2ccccc2)n1	812220258	DPZNNVNVKNCZNE-LJQANCHMSA-N	449.515	1.593	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)cc(OC)c1C	815583116	XOXUBPRKWPZILU-UHFFFAOYSA-N	425.445	1.228	50	20	IDGD	
COC(=O)c1cc(NNC(=O)CCC(=O)Nc2ccc3c(n2)n(C)c(=O)n3C)ccc1C	816689034	PZWNFUXALZNRRW-UHFFFAOYSA-N	440.460	1.229	50	20	IDGD	
Cc1nc(COc2ccc(F)cc2)sc1C(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1	818028308	FDCREYAWIRJCHT-NSHDSACASA-N	427.479	1.365	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(S(=O)(=O)N2CCCCC2)cc1)c1ccccc1O	906371978	VRLGYJPXGORKTF-UHFFFAOYSA-N	439.515	1.190	50	20	IDGD	
CSCC[C@H](C(=O)NNC(=O)Cn1nc(C)cc1C)N1C(=O)c2ccccc2C1=O	913025848	HUYOHKVOMFDOMY-MRXNPFEDSA-N	429.502	1.065	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)c1nn(-c2ccccc2)cc1O)N1CCc2ccccc2C1	914533316	WZNYLOKZBRUVTG-MRXNPFEDSA-N	434.500	1.969	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(N3C[C@H](C)O[C@H](C)C3)nc2)cc1C	914882101	VBNIVPUMPIDVAT-IYBDPMFKSA-N	425.489	1.712	50	20	IDGD	
O=C(COC(=O)COc1cccc(NC(=O)c2ccco2)c1)NNC(=O)c1cccs1	914982481	GZGQHNKZMGZYCF-UHFFFAOYSA-N	443.437	1.977	50	20	IDGD	
COc1cccc(/C=C(/C#N)C(=O)OCC(=O)N2CCN(c3oc(C)nc3C#N)CC2)c1	915378074	YCUKEIBBLWPCML-YVLHZVERSA-N	435.440	1.662	50	20	IDGD	
O=C(COC(=O)C1CCN(C(=O)N2CCCC2)CC1)NNC(=O)c1cccc(Cl)c1	915554765	JNLNBWSTNQIBFI-UHFFFAOYSA-N	436.896	1.572	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NC[C@H]2CN(Cc3ccccc3)CCO2)cc1OC	915895261	YYDFBOCAJWMEJP-SFHVURJKSA-N	428.489	1.549	50	20	IDGD	
CCCCS(=O)(=O)N1CCC[C@H]1C(=O)NNC(=O)[C@@H](C)Oc1ccc(OCC)cc1	916036900	GUOBOJFZIXACQJ-QAPCUYQASA-N	441.550	1.594	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)NCCCN2C(=O)NC3(CCCCC3)C2=O)c1	916268800	TZHVAKNLBLEDTO-UHFFFAOYSA-N	447.492	1.293	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)NCc3ccnc(N4CCN(C)CC4)c3)n[nH]2)cc1	916390152	MJDGURUBLXMEIQ-UHFFFAOYSA-N	448.531	1.676	50	20	IDGD	
CCCCN(C(=O)COC(=O)/C(C#N)=C\c1ccc(OC)cc1)[C@H]1CCS(=O)(=O)C1	916613224	UISJDKRWTXMHJE-FSEPTYSPSA-N	434.514	1.961	50	20	IDGD	
CCN1C(=O)c2ccc(C(=O)NNC(=O)c3cc(Br)c[nH]3)cc2S1(=O)=O	917521212	RZJBHONMEBGPCC-UHFFFAOYSA-N	441.263	1.016	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNS(=O)(=O)c2ccc(C(=O)OC)s2)cc1	917723444	FIRVLSYIUORFBL-NSHDSACASA-N	428.488	1.710	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCc2ccc(OC)c([N+](=O)[O-])c2)c2ccccc2c1=O	918127875	PCDZNRNAECVBEZ-UHFFFAOYSA-N	440.416	1.477	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2nc3ncc(Br)cn3n2)ccc1OC(C)C	919810137	ZZPIRPRBTMGGKW-UHFFFAOYSA-N	449.265	1.757	50	20	IDGD	
Cc1ccc(OCc2nc(CC(=O)NNC(=O)N[C@@H]3CCS(=O)(=O)C3)cs2)cc1	919889441	MCAVODSHJBESOS-CYBMUJFWSA-N	438.531	1.091	50	20	IDGD	
COc1ccc(OC)c(CC(=O)OCC(=O)NNC(=O)c2cc(Cl)ccc2OC)c1	921183247	YFWYZTBRXYGZCW-UHFFFAOYSA-N	436.848	1.913	50	20	IDGD	
CCOc1ccc(C(=O)NNS(=O)(=O)c2cc(S(C)(=O)=O)ccc2F)cc1OC	921295531	RRLVCGYCJUEHHI-UHFFFAOYSA-N	446.478	1.260	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CCS(=O)(=O)c2ccc3c(c2)OCCCO3)cc1	1116122345	SPMWXJRXNKZYLQ-UHFFFAOYSA-N	434.470	1.482	50	20	IDGD	
CN(NC(=O)[C@@H]1CC(=O)N(C)c2ccccc21)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	1116724119	JYFSHISXQJWSGX-MRXNPFEDSA-N	445.520	1.772	50	20	IDGD	
COC(=O)[C@H]1CS(=O)(=O)CCN1C(=O)/C(C#N)=C/c1cc(C)n(CCC(C)C)c1C	1120800337	YFBZPCOBIGAUJJ-WAGPWIPHSA-N	435.546	1.857	50	20	IDGD	
O=C(CO[C@H]1CCOC1)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	1319056365	WJUJENPLYXATAG-LBPRGKRZSA-N	425.488	1.115	50	20	IDGD	
Cc1cc2cccc(C(=O)N3CC[C@@]4(CN(C(=O)CCC(=O)NN(C)C)CCO4)C3)c2[nH]1	1777873651	CIVSSOCWMUJLNU-HSZRJFAPSA-N	441.532	1.293	50	20	IDGD	
COCCOCCOCCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Cl)C1	1778028491	LFHHUEQTBSCMAR-SZVBFZGTSA-N	438.924	1.104	50	20	IDGD	
Cc1nccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](F)Br)C3)n1	1778309847	QFNNXHLYZZGJME-CKEIUWERSA-N	429.290	1.603	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)/C=N/O[C@@H]3CCCCO3)C2)C1	1779098282	FXGHOPSSEHMAAZ-JJKOTBSUSA-N	446.342	1.376	50	20	IDGD	
Cc1nc[nH]c1CSCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Cl)C2	1779287898	UCMJUARLMVSNDA-QGPMSJSTSA-N	432.949	2.000	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(OC)n(C)n3)C2)C1	1780436339	PCQGOEKALZUABZ-PXAZEXFGSA-N	429.315	1.046	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)[C@@H](N)Cc3cscn3)CCO2)C1	1781227041	FXTREVNTVKFDJV-JQFCIGGWSA-N	435.377	1.079	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)/C=C/C3CCCCC3)C2)C1	1781285464	AHSNBMDCWPVSLR-YQTDCCHMSA-N	441.532	1.265	50	20	IDGD	
Cn1nc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)c2c1CCC2	1781329148	AGRPZVFRQQTFHN-RHSMWYFYSA-N	429.290	1.043	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Cl)C2)c1nc2ccc(F)cn2n1	1781433663	PPXHRYFGSMGVMG-RVZJWNSFSA-N	427.839	1.530	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cccn4cncc34)CCO2)C1	1783349444	LVHQROCNBJEHQI-KXBFYZLASA-N	435.322	1.951	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cn4c(F)cccc4n3)CCO2)C1	1783538535	XYTJRBGLJMOYLW-SGTLLEGYSA-N	439.285	1.700	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cccn(C(F)F)c3=O)CCO2)C1	1783539157	XXWGGALVCOWYEY-GTNSWQLSSA-N	448.264	1.470	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](C)Br)C2)C1	1783539903	OUQITABOCFUYRD-UHIISALHSA-N	426.149	1.773	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3c(Cl)ccc4c3OCO4)CCO2)C1	1783876251	XSLUCOPZUICARX-ORAYPTAESA-N	445.299	1.766	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4ccnn4c3)C[C@@H]21	1783973301	XXDQTJATIPMYTG-KCMWZYNZSA-N	449.349	1.959	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CC[C@@H]3CNc4ccccc4C3)C[C@@H]21)[C@@H](O)CCl	1784090234	VFAZPHIOPHESIP-OMBLBEMTSA-N	449.979	1.630	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4c(n3)NC(=O)CC4)C[C@@H]21	1784618649	OUGXMEMULUWJIK-CUSZFKRNSA-N	448.951	1.967	50	20	IDGD	
CC(C)c1nc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCBr)[C@H]3C2)no1	1786400903	DZBNLRCOASQSRQ-IHRRRGAJSA-N	443.342	1.500	50	20	IDGD	
Cc1nnc(CCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCBr)[C@H]3C2)s1	1786401215	UNRVPQRFCAIQEM-IHRRRGAJSA-N	445.383	1.544	50	20	IDGD	
O=C(CCBr)Nc1ccc(C2(NC(=O)CN(CCO)CCO)CCC2)cc1	1787674350	CLEAFBQFYJLEEA-UHFFFAOYSA-N	442.354	1.192	50	20	IDGD	
Cn1ncc(Br)c1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Cl)C[C@@H]21	1787776665	KOTRPYSSWARRHB-LKAMGYQZSA-N	437.697	1.310	50	20	IDGD	
CN1CCC(C(=O)NC2(c3ccc(NC(=O)c4ccc(B(O)O)cc4)cc3)CCC2)CC1	1788140332	NHJCDZHKHLVYQB-UHFFFAOYSA-N	435.333	1.456	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3CCC[C@H]3C)[C@H]2C1	1788235086	CTDYKDXVBWULSN-LSTDIUBPSA-N	443.548	1.536	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CNC(=O)c3ccc(C)cc3)C[C@@H]21	1789864173	MWEJOIMHVSONPO-VJANTYMQSA-N	435.952	1.722	50	20	IDGD	
Cc1n[nH]c(C)c1CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]21	1789976935	SDOYLZLNHPJXKD-FJXLLPKBSA-N	431.364	1.785	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3ccc(O)cn3)[C@H]2C1	1791711045	GAQRWDFMWOQMKR-STECZYCISA-N	440.338	1.483	50	20	IDGD	
C[C@@H](NNc1ccccc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2	1792508413	NAHUKGPTYIYMSD-QUEVPRLRSA-N	443.317	1.272	50	20	IDGD	
COc1ccc([C@@H](O)C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)Br)C3)cc1	1792715518	JXIMSVDGMXLFOZ-BQHCWPDZSA-N	441.322	1.102	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3cccnn3c1)C2	1792873477	ATIRGWCFBRIHBL-FAYQHZLMSA-N	435.322	1.569	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cncc(S(C)(=O)=O)c1	1794318773	PVZCFYVMDFFBFZ-FSDCSDTHSA-N	443.953	1.096	50	20	IDGD	
COc1cccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)CBr)C3)c1	1795239594	OBDNSZRBKOGZPB-AMVTXUCVSA-N	439.350	1.858	50	20	IDGD	
O=C(Cc1ccc(Cl)s1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1	1796189815	DKNJWZNIBBARJW-MUJYYYPQSA-N	432.738	1.576	50	20	IDGD	
CCOc1cccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)c1	1798441942	PECDYRBIEPUOHQ-BJWYYQGGSA-N	437.500	1.649	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc3ccsc3[nH]1)C2	1798442835	IRIOFXYXRZQQBL-BTTYYORXSA-N	438.513	1.794	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(-c2cnccn2)c1	1798588737	ISRWRCWWQUPGLK-AJYBTWMASA-N	444.919	1.601	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1nn[nH]c1C(F)(F)F	1798712269	ZFIUUZPIFNOHOL-KSCJFIISSA-N	444.241	1.263	50	20	IDGD	
COc1ccnc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@](C)(Cl)CCl)C3)c1OC	1798771298	VNJIVISITIMJRU-NMRSOGARSA-N	446.331	1.538	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc([N+](=O)[O-])c2c1OCO2	1799345333	XDJMPYWXLUOEBR-OPDFLTKYSA-N	439.852	1.829	50	20	IDGD	
C=CC[C@@H](C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2	1800492082	WVUJMENWWBYZJO-BCEDRHLLSA-N	445.472	1.936	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@](C)(Cl)CCl)C2	1800642630	SQFSYRNIVYBKJW-NVGYGPBWSA-N	430.170	1.986	50	20	IDGD	
C#CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(Cl)Cl	1801021575	XLWREAADHBQCEZ-CRWXNKLISA-N	448.347	1.296	50	20	IDGD	
CCOc1c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](Cl)COC)cnc2c1cnn2C	1802276637	IGEIAXCKQWOXBG-LOUJCGABSA-N	449.939	1.873	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@H]1CCN(C(=O)[C@H]2CCC(=O)N2)[C@H]1c1cccnc1	1803010023	ZKDIHNKFAMIWTN-MMTVNHQJSA-N	437.338	1.397	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cccc3c2OCC3)[C@H]1c1cccnc1)[C@H](O)CCl	1803139067	KBEBKOJMCVTCQD-UHOSZYNNSA-N	429.904	1.936	50	20	IDGD	
CCC(=O)N[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@@H]1c1cccnc1	1803434955	YPAXBTBTKZADRO-WXYCVUISSA-N	443.317	1.693	50	20	IDGD	
C[C@H](CC(N)=O)C(=O)NC[C@@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1	1803663377	FLMZJTDXXHLJPR-HACGYAERSA-N	425.327	1.384	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2cccc(=O)n2O)[C@H]1c1cccnc1	1804949940	HLLXZCDKCUANTN-RVKKMQEKSA-N	434.880	1.054	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2nccnc2OC)[C@H]1c1cccnc1	1804979804	CPGSWJZQGXHBEL-HLLBOEOZSA-N	433.896	1.454	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)N1CCC2(CCCN(C(=O)[C@H](O)CCl)C2)CC1	1805528950	BMCALVMQLPQJIY-OAHLLOKOSA-N	431.961	1.732	50	20	IDGD	
COc1ccc(CC(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@H]2c2cccnc2)cc1	1806582846	FDCHDVPSEBBQCY-DSKINZAPSA-N	431.920	1.938	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)CN2CCOCC2)[C@@H]1c1cccnc1	1806913074	PPNNQCXPQRLBIT-ZVZYQTTQSA-N	439.354	1.203	50	20	IDGD	
N=C(N)SCC(=O)NC[C@@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1	1807003743	DJGPDASZEMMDGG-WFASDCNBSA-N	428.356	1.499	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2cnc3[nH]ncc3c2)[C@@H]1c1cccnc1	1809712209	CDCHWOUMYCSVAM-JLSDUUJJSA-N	442.907	1.926	50	20	IDGD	
CCS(=O)(=O)CC(=O)N1CC[C@@H](CNC(=O)CO[Si](C)(C)C)[C@@H]1c1cccnc1	1810537928	QLJVDGZBMBFIIM-LPHOPBHVSA-N	441.626	1.374	50	20	IDGD	
CCOc1ccc(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](Cl)COC)[C@@H]2c2cccnc2)nn1	1811625640	ACFAFOUNNOFDQI-TXPKVOOTSA-N	447.923	1.844	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)c2cccc(=O)n2O)[C@@H]1c1cccnc1	1812865675	RUAMJZOIEVFJAE-DXCKQFNASA-N	449.305	1.584	50	20	IDGD	
CCOC(=O)C1(C(=O)N2CC[C@H](CNC(=O)[C@H](Cl)COC)[C@@H]2c2cccnc2)CC1	1813034671	UMELTEVFCSVGBO-ZACQAIPSSA-N	437.924	1.685	50	20	IDGD	
C[C@H](NC(=O)OC(C)(C)C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1	1814674835	YHRIXSCXBMPNJB-UBHSHLNASA-N	443.932	1.915	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@H]1CCc2nc(NC(=O)c3cc(O)nc(O)n3)sc2C1	1817103451	ARZBSPIOCXQUPA-VIFPVBQESA-N	437.554	1.422	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)c3nc[nH]c3[N+](=O)[O-])sc2C1	1817205390	LTXVTMDDMDAETL-NKWVEPMBSA-N	443.283	1.784	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)CCl)CC2)c1cnnc2ccccc12	1818179019	FYUXNKYIUFZZNB-BMIGLBTASA-N	431.905	1.912	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](COC(C)=O)OC(C)=O)n[nH]1	1819432169	ARPDKYIVACWFAQ-NUEKZKHPSA-N	442.900	1.914	50	20	IDGD	
C[C@H](C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](F)Br)n[nH]1)n1cnnn1	1820936923	HYSFIJGTPBDHQD-QRTLGDNMSA-N	429.254	1.340	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCc2cnn(C)c2)[nH]n1	1822414256	OUIVGARJINJLSJ-KRWDZBQOSA-N	444.540	1.141	50	20	IDGD	
O=C(CCN1CCOC1=O)N[C@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1	1823006503	CDZPMEVKJZJKHB-QPUJVOFHSA-N	449.302	1.588	50	20	IDGD	
Cc1cn(CC(=O)Nc2cc([C@H]3CCCCN3C(=O)[C@H](F)Cl)[nH]n2)c(=O)nc1O	1823366819	DIENOWYPMMDAKV-RISCZKNCSA-N	426.836	1.207	50	20	IDGD	
Cc1cc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@H](O)CCl)CC3)nc2nccn12	1824111374	RCTHSMNAHYKLEF-GXFFZTMASA-N	434.909	1.320	50	20	IDGD	
Cc1ccc(CC(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)cn1	1825295984	ZTWUXEFWGZZPNR-QHCPKHFHSA-N	449.360	1.546	50	20	IDGD	
CC(=O)N(C)CCC(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](C)Br)sc2C1	1825635771	KLAXYUSFWUJKKC-KOLCDFICSA-N	431.356	1.707	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)N[C@@H]1CCc2nc(NC(=O)C(Cl)Cl)sc2C1	1826093212	HPDMACSIYYZCJA-SNVBAGLBSA-N	442.328	1.684	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1CCc2nc(NC(=O)CCS(C)(=O)=O)sc2C1	1827212036	SMIPRFWVIYELQQ-PSLIRLAXSA-N	442.390	1.726	50	20	IDGD	
CCOC(=O)N[C@@H](O)C(=O)N1CCC([C@H]2CCCCN2C(=O)CO[Si](C)(C)C)CC1	1829102893	QWGIXQCLMQNILN-AEFFLSMTSA-N	443.617	1.522	50	20	IDGD	
N#Cc1cccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)c1	1829952768	YFUZCCZGCOWGAF-QHCPKHFHSA-N	445.328	1.785	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc4ccccn34)C2)C1	1830361840	GHZZUSQZWLWQCO-NRFANRHFSA-N	434.924	1.669	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3CC3(F)F)C2)C1	1830540287	PIZSREBOTMUQLV-XUJVJEKNSA-N	425.270	1.129	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3nsnc3NC)C2)C1	1831638200	BWQCHEXQUGSUBU-SJKOYZFVSA-N	431.946	1.057	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](NC(C)=O)C(C)(C)C)C2)C1	1831639913	GWUSNOGDKLTFIN-CSODHUTKSA-N	445.988	1.401	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)Cn2cc([N+](=O)[O-])cn2)CC1	1831829007	XBDSUKBFVCPASO-DLBZAZTESA-N	441.916	1.665	50	20	IDGD	
Cc1[nH]nc(C(=O)N2CCC([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)c1F	1831872420	VRQIJTPLJMRGCO-MRXNPFEDSA-N	436.532	1.464	50	20	IDGD	
O=C(c1cc(=O)n2[nH]cnc2n1)N1CCC([C@@H]2CCCCN2C(=O)C(Cl)Cl)CC1	1831879545	YHRWPOJXVHVHHR-ZDUSSCGKSA-N	441.319	1.455	50	20	IDGD	
O=C1C[C@H](C(=O)N2CCCC[C@H]2C2CCN(C(=O)CCBr)CC2)CCN1	1831936085	WBIFPHONGBXNHX-CVEARBPZSA-N	428.371	1.917	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)[C@H]2CC[C@H](O)CC2)CC1	1831996146	GYOBBTJRDIHFBY-BVSLBCMMSA-N	442.365	1.151	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)[C@H]1CNc2ccccc21	1834726077	DEYAYYCMNNYEPY-ICSRJNTNSA-N	434.968	1.367	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H]3Cc4ccccc4CN3)CC2)CC1)[C@H](F)Cl	1835079759	QCOZWCFJYVHDPG-PMACEKPBSA-N	436.959	1.807	50	20	IDGD	
Cc1ncncc1C(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)Br)CC2)CC1	1835974945	SMDCHNQWRZYTQM-CYBMUJFWSA-N	438.370	1.754	50	20	IDGD	
CC[C@@H](Br)C(=O)NC1CCN(C2CCN(C(=O)Cn3ccnn3)CC2)CC1	1836542031	SWGWJJIUVVOLHE-MRXNPFEDSA-N	441.374	1.023	50	20	IDGD	
CC(C)n1ccc(C(=O)N2CCC(OC3CCN(C(=O)[C@H](O)CCl)CC3)CC2)n1	1836718517	QNMHJHBDAZTESX-GOSISDBHSA-N	426.945	1.676	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)C(C)(C)CNC(C)=O)CC2)CC1	1836932729	YPFGZUPPUOKWSV-SFHVURJKSA-N	445.988	1.401	50	20	IDGD	
O=C(c1cn2cc(F)ccc2n1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1836960477	QACQAIUVFTVGAS-MAUKXSAKSA-N	428.823	1.078	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3[nH]cc4c3CCC4)CCO2)C1	1838454843	VDAVQAXYBMMYGW-WOJBJXKFSA-N	444.359	1.810	50	20	IDGD	
C/C=C/C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)CCO2	1838528175	JUMQCJVMCPATMX-YEFOHOTDSA-N	447.444	1.166	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)c(O)n1	1838667746	SVLFWTPRPZOXBE-HXUWFJFHSA-N	425.913	1.431	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)C#CC(=O)O)CC2)CC1	1838764382	JIKUIYAPFOQCIF-HNNXBMFYSA-N	429.311	1.247	50	20	IDGD	
Cc1ccn(C)c1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)Br)C2)C1	1838822091	AYSDBHIWEXJJAO-RDTXWAMCSA-N	428.327	1.187	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CSCc3[nH]cnc3C)C2)C1	1839145365	FPBKBCBXYVFWQN-KXBFYZLASA-N	444.985	1.425	50	20	IDGD	
Cc1cnc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)cn1	1839151150	JMMVWIUJQGCRLC-ROUUACIJSA-N	431.320	1.091	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccncc3F)C2)C1	1839152464	ABFAWKHMRBUQCX-ROUUACIJSA-N	434.295	1.527	50	20	IDGD	
Cc1n[nH]c(C)c1CC(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1839238513	QMGJLHXDOMGNTI-FQEVSTJZSA-N	426.945	1.290	50	20	IDGD	
CC(=O)N1CCOC[C@]2(C1)CN(C(=O)/C(C#N)=C/c1ccc(Br)cc1)CCO2	1839743659	JBPWPNJRFSZORB-YZILGEIOSA-N	448.317	1.832	50	20	IDGD	
C#CC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](Br)Cc3ccccc3)C2)C1	1839810224	LYWOCYRUWGKLQM-PXNSSMCTSA-N	435.318	1.082	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3n[nH]c(C)c3F)C2)C1	1839962699	OLUGGJZZZUZDMA-SJKOYZFVSA-N	447.305	1.101	50	20	IDGD	
C=C(C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)Br)CCO2)C(F)(F)F	1840034956	BJXQDBSOYGBTFR-FZMZJTMJSA-N	429.233	1.345	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCCC(F)(F)F)C2)C1	1840151189	XCFSDSKTHXDOAJ-XJKSGUPXSA-N	430.851	1.429	50	20	IDGD	
O=C(c1cc(-c2ccco2)no1)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840187479	DFRLLWHDNGEITA-GOSISDBHSA-N	444.271	1.808	50	20	IDGD	
O=C(/C=C/C(=O)N1CCCC12CN(C(=O)[C@H](F)Br)C2)NCc1ccccc1	1841329163	GQPZVOAYEHPPFH-OZSKJFCKSA-N	438.297	1.753	50	20	IDGD	
O=C([C@@H]1C[C@@H]1c1ccc(F)c(F)c1)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843012745	LDDWCDYJFDNNAN-QZTJIDSGSA-N	440.255	1.265	50	20	IDGD	
Cc1c(C(=O)N2CCCC23CN(C(=O)[C@@](C)(Cl)CCl)C3)cn2[nH]cnc(=O)c12	1844656621	MILGJHMGGFQYGE-KRWDZBQOSA-N	426.304	1.384	50	20	IDGD	
CN(CC(=O)N1CC2(CCCN2C(=O)C(Cl)Cl)C1)NC(=O)NCc1ccccc1	1846388183	DFOGKDGKWNIDHH-UHFFFAOYSA-N	442.347	1.340	50	20	IDGD	
Cc1cc(Cl)ccc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cnccc1C(=O)NN	1847363019	INBHEGVKSKZDIR-ROUUACIJSA-N	427.892	1.776	50	20	IDGD	
CCn1c(=O)n(CC(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)c2ccccc21	12929696	ZJJGYRAEQVFUMC-UHFFFAOYSA-N	430.848	1.481	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=O)c2cc(-c3ccccc3)n[nH]2)n(C)c1	15590217	WATCFLILKKMVFG-UHFFFAOYSA-N	444.517	1.521	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)CN2C(=O)COc3ccccc32)c2ccccc2c1=O	17196537	VFTKYANMTZSAEI-UHFFFAOYSA-N	435.440	1.164	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)c1ccc(CSc2ncn[nH]2)cc1	21438917	BECQYIMEDUHYBF-UHFFFAOYSA-N	445.530	1.465	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)[C@@H]2CCCN2S(=O)(=O)c2cccs2)c(C)c1	110889788	VONQVEDLQHIBNP-INIZCTEOSA-N	436.559	1.778	50	20	IDGD	
C[C@@H](CC(=O)NNC(=O)c1cc(Br)c[nH]1)S(=O)(=O)c1ccc(F)cc1	303240502	JHKONHXVVZRSEJ-VIFPVBQESA-N	432.271	1.930	50	20	IDGD	
O=C(NNc1ccccc1[N+](=O)[O-])[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(Cl)cc1	725891072	PWWYZCDSFOFFCS-WBMJQRKESA-N	440.865	1.515	50	20	IDGD	
CC/C=C(\C)C(=O)N1CSC[C@H]1C(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	728066047	XHNAIHKJXROWDA-COSNYCCFSA-N	429.502	1.597	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)CCc2c(C)nc3c(c(OC)nn3C)c2C)c1	728205827	GXDQVRLGASXTFG-UHFFFAOYSA-N	440.504	1.794	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)C2CCN(S(=O)(=O)c3cc(F)ccc3F)CC2)c1	728828746	YRSYGOLQNXOZRQ-UHFFFAOYSA-N	448.451	1.698	50	20	IDGD	
CCCC[C@@H](/N=C1/NS(=O)(=O)c2ccccc21)C(=O)NNC(=O)Cc1cccnc1	728891912	KFIOCTKZABHNKX-MRXNPFEDSA-N	429.502	1.069	50	20	IDGD	
CC(C)(C)OC(=O)NC1CCN(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)CC1	728959484	MOWZQRKFRFZKRV-UHFFFAOYSA-N	447.540	1.423	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)N1CCN(Cc2ccc3c(c2)OCCO3)CC1	729510793	MYZXNACPODKICA-UHFFFAOYSA-N	449.511	1.971	50	20	IDGD	
CC(C)(C(=O)NNC(=O)NCc1cccnc1N1CCC(C(N)=O)CC1)c1ccccc1	731220370	FBDHIPGIEXCNAC-UHFFFAOYSA-N	438.532	1.592	50	20	IDGD	
CC1CCC(N2C[C@H](C(=O)NNC(=O)c3nn(-c4ccccc4)cc3O)CC2=O)CC1	731366042	UKBJDYTXJJIAFQ-HWOWSKLDSA-N	425.489	1.766	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@H](C)C(=O)NNC(=O)C1CCC2(CC1)NC(=O)NC2=O	731470510	FHXZTTWOOVDDGB-CIQOGTPDSA-N	436.896	1.640	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)N1CCN(CCCc2nc(-c3cccs3)no2)CC1	732197721	XKZZYPYRAAUFKD-MRXNPFEDSA-N	448.593	1.930	50	20	IDGD	
O=C(COC(=O)C1CCN(C(=O)c2ccoc2)CC1)NNC(=O)c1cccc([N+](=O)[O-])c1	732324065	VVPNTARASSILOL-UHFFFAOYSA-N	444.400	1.044	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCCc1cccc(F)c1F	732820438	NYUUAGRKWHAYJA-UHFFFAOYSA-N	425.461	1.753	50	20	IDGD	
Cc1ccc(-n2c(NNC(=O)Cn3cnc([N+](=O)[O-])n3)nc3ccccc3c2=O)c(C)c1	733263058	GDFXXZHHSVIXRY-UHFFFAOYSA-N	434.416	1.646	50	20	IDGD	
CCN(CC)C(=O)N1CCC(C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)CC1	734241077	BUIWVNFYHXIKOX-UHFFFAOYSA-N	428.534	1.015	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCCOC[C@@H]1CCCO1	734518989	MJNBXXXDVIEXGG-WFASDCNBSA-N	430.299	1.742	50	20	IDGD	
Cc1cccc(NC(=O)NCC(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)c1	734825611	JNDYKYHIRCPCTF-UHFFFAOYSA-N	448.524	1.846	50	20	IDGD	
CS[C@H]1CCC[C@@H](NC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)C1	735385359	YHHQZRQRROAEJJ-CABCVRRESA-N	442.611	1.318	50	20	IDGD	
Cn1cc(C(=O)NNS(=O)(=O)c2ccc(Br)cc2Br)cn1	735461490	JSBWLRKVVCIINK-UHFFFAOYSA-N	438.101	1.568	50	20	IDGD	
COc1ccc(N2C(=O)/C(=C/NNC(=O)c3cnn(C)c3)c3ccccc3C2=O)cc1OC	735462843	XPXLZNQMBLMGJS-LDADJPATSA-N	447.451	1.900	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)c3ncccn3)c2)cc1	735836034	BLQZJKJDWPVTCT-UHFFFAOYSA-N	427.442	1.361	50	20	IDGD	
CCCCS(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)NCc2ccco2)cc1	737757141	URJZCRAOWSWBMD-UHFFFAOYSA-N	430.508	1.514	50	20	IDGD	
O=C(COC(=O)Cc1csc(-c2ccoc2)n1)NNC(=O)c1ccc([N+](=O)[O-])cc1	738853915	XPTYWWUBBNODKR-UHFFFAOYSA-N	430.398	1.858	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCc2ccco2)cc1C(=O)NNc1ccnc(N(C)C)n1	740107882	OIUMPSLJIGLSRF-UHFFFAOYSA-N	430.490	1.679	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)c1ccc(OCC(=O)N2[C@H](C)CCC[C@H]2C)cc1	740850992	JZIHJFXYPGJUCJ-HZPDHXFCSA-N	446.548	1.921	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)c1ccc(S(=O)(=O)Nc2ccccc2C)cc1	740852166	OCLZKCNTONALJR-UHFFFAOYSA-N	446.529	1.862	50	20	IDGD	
COc1ccc(C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)cc1N1CCNC1=O	742062093	NONMCINNKFGWDP-UHFFFAOYSA-N	445.501	1.422	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)CN(C[C@H]2CCCO2)C(=O)OC(C)(C)C)C[C@@H](C)O1	743290064	ABDZLOOIRQDMFA-IXDOHACOSA-N	442.557	1.049	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)NCCc1ccn(-c2ccc(F)cc2)n1	743510596	ZERKBVZWMAZSGH-UHFFFAOYSA-N	427.436	1.972	50	20	IDGD	
Cc1cc(N2CC[C@H](NC(=O)NNC(=O)c3cc4c(s3)CC[C@H](C)C4)C2=O)n(C)n1	743511688	OKBQSSNHUXYZAK-FZMZJTMJSA-N	430.534	1.664	50	20	IDGD	
O=C(CCc1nc(-c2ccco2)no1)NNc1ccccc1S(=O)(=O)N1CCOCC1	744619568	SLTFNSWPCZJOHR-UHFFFAOYSA-N	447.473	1.426	50	20	IDGD	
O=C(COC(=O)c1cc(N2CCCC2=O)ccc1F)NNC(=O)c1cccc([N+](=O)[O-])c1	745190754	YCLXULLAHJHYBW-UHFFFAOYSA-N	444.375	1.479	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2cc(C)n(-c3ccccc3)c2C)cn1C	745976091	DXEKFOWBMTZBKU-UHFFFAOYSA-N	430.486	1.843	50	20	IDGD	
O=C(NNC(=O)c1ccc(Sc2ccccc2Cl)nn1)N[C@@H]1CCS(=O)(=O)C1	746164621	YTZKBSIQKJGILY-SNVBAGLBSA-N	441.922	1.412	50	20	IDGD	
CCCN(CC)CCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	746772265	YMUNKUWHFAIUIL-UHFFFAOYSA-N	439.582	1.537	50	20	IDGD	
CSCC[C@H](C(=O)NNC(=O)c1ccc(C#N)cc1)N1C(=O)[C@H]2CCCC[C@H]2C1=O	747176063	HSSYKFIIPMSFQW-IXDOHACOSA-N	428.514	1.616	50	20	IDGD	
CC(=O)N1CCc2cc(S(=O)(=O)NNC(=O)C(=O)Nc3ccc(C)c(C)c3)ccc21	747849004	RWTPUYDHLUCGBJ-UHFFFAOYSA-N	430.486	1.161	50	20	IDGD	
O=C1C[C@H](Cc2ccc(C(=O)NNc3nc(-c4ccccn4)nc4c3CCC4)cc2)C(=O)N1	748341076	NNVLWCXSTIUKFL-INIZCTEOSA-N	442.479	1.989	50	20	IDGD	
CCOC(Cn1cc(C(=O)NNC(=O)c2cc(-c3ccc(C)cc3)[nH]n2)nn1)OCC	748558298	IHWYDNPGDXYAKM-UHFFFAOYSA-N	427.465	1.451	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)[C@H]2CCc3nnc(C)n3C2)c2ccccc2c1=O	750712834	BLYGQECDYSYAAF-HNNXBMFYSA-N	437.504	1.510	50	20	IDGD	
O=C(O)COc1ccc(S(=O)(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)cc1F	751262144	MXACQJDKDWCXKY-UHFFFAOYSA-N	426.466	1.815	50	20	IDGD	
O=C(NCC#Cc1ccc(C(F)(F)F)cc1)NNC(=O)c1ccc(-n2cnnn2)cc1	752000332	RIUMXHOVIUUMKN-UHFFFAOYSA-N	429.362	1.677	50	20	IDGD	
COc1cc(OC)cc(N2C[C@H](C(=O)NNC(=O)Cc3c[nH]c4ccccc34)CC2=O)c1	752399682	SYBOKLSUBUVSQD-OAHLLOKOSA-N	436.468	1.928	50	20	IDGD	
COc1cc(OC)cc(N2C[C@H](C(=O)NNC(=O)Nc3ccc(N(C)C)cc3)CC2=O)c1	752522014	YEUYGDFRCYITIL-CQSZACIVSA-N	441.488	1.976	50	20	IDGD	
CC(C)(C)OC(=O)NC1(CNC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)CCC1	753334280	MFFHMFNMFGTMOU-UHFFFAOYSA-N	430.469	1.054	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)NC[C@H]2CCN(S(C)(=O)=O)C2)N(C)c2ccccc21	753690062	PGUQCQPDJFWLOB-OAHLLOKOSA-N	445.545	1.055	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1	755358697	GKTLFYWDEPFTRP-LURJTMIESA-N	436.334	1.815	50	20	IDGD	
Cc1sc2nc(CC(=O)NN=Cc3cnc(N4CCN(C)CC4)nc3)nc(O)c2c1C	755541397	VRFDEWFZSRFGOL-UHFFFAOYSA-N	440.533	1.248	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)NCCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)cc(C#N)n1C	756309940	NFPVFMVTUSRIHH-DHDCSXOGSA-N	427.442	1.610	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)Nc2ccc(NC(=O)NC[C@@H]3CCCO3)cc2)n1	756510577	KLGPLRMCYPMDJB-KRWDZBQOSA-N	429.481	1.653	50	20	IDGD	
Cc1oc(-c2cccc(C(F)(F)F)c2)nc1C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O	758030422	QGRXRFKXLLJEBC-MRVPVSSYSA-N	434.396	1.368	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@H](C)n2nnnc2C(C)(C)C)cc1Br	758147394	XHPIUHAXBYZIFI-VIFPVBQESA-N	425.287	1.764	50	20	IDGD	
COc1ccc2c(ccn2CC(=O)N2CCN(S(=O)(=O)CBr)CC2)c1	758527067	FZRLTHSQDNXBQA-UHFFFAOYSA-N	430.324	1.476	50	20	IDGD	
O=C([C@H]1CCN(c2ccc(F)cc2)C1=O)N1CCN(S(=O)(=O)CBr)CC1	758534063	APPOHXYDOQCGDD-CQSZACIVSA-N	448.314	1.005	50	20	IDGD	
COCCS(=O)(=O)c1ccc(CNC(=O)NNc2ccccc2S(C)(=O)=O)cc1	759295169	SWXNUXWNHXJBQE-UHFFFAOYSA-N	441.531	1.337	50	20	IDGD	
O=C(NC[C@H]1CC(=O)N(Cc2ccccc2)C1)NNC(=O)c1cc([N+](=O)[O-])ccc1O	759684719	WYKDIARBDAHXKM-CQSZACIVSA-N	427.417	1.293	50	20	IDGD	
Cc1nnc([C@H](C)NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)s1	760135682	AEHFZJGNMDXJNT-NSHDSACASA-N	438.535	1.336	50	20	IDGD	
COC(=O)c1cn([C@H]2CCN(C(=O)NNC(=O)c3c(Cl)cccc3Cl)C2)nn1	760671784	WVOKOTFGGGPNKX-VIFPVBQESA-N	427.248	1.673	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)c2ccc(Cl)nc2)c(OC)c1	761270745	CRISLNDVFWLMLZ-UHFFFAOYSA-N	448.910	1.129	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1)c1cccc(C(=O)c2ccccc2)c1	761431896	VHSPDDJTZLDMGJ-RDTXWAMCSA-N	429.498	1.539	50	20	IDGD	
O=C(NNC(=O)c1ccccc1)C(=O)Nc1cc(F)c(F)cc1I	763430097	FFFHFCLMXGUSSQ-UHFFFAOYSA-N	445.163	1.969	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)C(=O)N1CCc2ccc(Br)cc21	763446053	OLODKQZMRWRAMT-UHFFFAOYSA-N	433.218	1.708	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1cc(N2CCCC2=O)ccc1F	763472568	YLKOANWYDTWQIQ-UHFFFAOYSA-N	429.364	1.260	50	20	IDGD	
Cc1cc(C)c(NC(=O)C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c(C)c1	763530804	ICVZACPEAZVXNG-UHFFFAOYSA-N	437.544	1.910	50	20	IDGD	
COC(=O)c1cc2cc(NC(=O)C(=O)NNC(=O)COc3cccc(C)c3)ccc2o1	763622917	HYAROGXPPSUADT-UHFFFAOYSA-N	425.397	1.693	50	20	IDGD	
CSc1cc2c(cc1NC(=O)C(=O)NNC(=O)COc1ccc(C)cc1)OCCO2	763810026	XDLBOCMQWDOSKY-UHFFFAOYSA-N	431.470	1.653	50	20	IDGD	
N#Cc1ccc(OCc2cccc(C(=O)NNC(=O)CNC(=O)c3cccnc3)c2)cc1	763821187	UARYXUUGEWTLIA-UHFFFAOYSA-N	429.436	1.723	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cc(F)cc(F)c2OC)cc1	763860659	JUYGZERARLBVKW-LLVKDONJSA-N	437.399	1.926	50	20	IDGD	
Cc1ccnn1-c1ccccc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccc(F)cc1	763865597	LREAQEDZPRULTK-AWEZNQCLSA-N	425.420	1.873	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccc(Cn2cncn2)cc1	763866229	VBINNQLMIKXHGA-CYBMUJFWSA-N	426.408	1.019	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)ccc1C(=O)N(C)C	763867991	ZOLNNRXYTDSURQ-CYBMUJFWSA-N	430.436	1.389	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)C(=O)Nc2ccc(C)c(S(C)(=O)=O)c2)cc1	763897685	BIYWDPDFMBLHIE-UHFFFAOYSA-N	435.527	1.585	50	20	IDGD	
O=C(NNC(=O)c1ccc(Br)s1)C(=O)Nc1ccc2c(c1)OCCO2	763940222	FRBQJBSNPQFTBT-UHFFFAOYSA-N	426.248	1.682	50	20	IDGD	
CN(C)c1c(Cl)cccc1NC(=O)C(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	763948485	KKSYZGQJCNAKEQ-UHFFFAOYSA-N	442.863	1.697	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)[C@H](NC(=O)c2cccs2)C(C)C)n1	764032919	JVIGQRJQVOMMGV-MRXNPFEDSA-N	438.531	1.201	50	20	IDGD	
C[C@H]1C[C@H](C)CN(C(=O)c2ccccc2NC(=O)C(=O)NNC(=O)CC(F)(F)F)C1	764111302	DYJYPWLBZNPPFE-RYUDHWBXSA-N	428.411	1.843	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2cc(C(=O)NC(C)C)ccc2Cl)c1O	764132430	WGORXQHJQSCQTI-UHFFFAOYSA-N	448.863	1.592	50	20	IDGD	
COCC(=O)NNC(=O)C(=O)Nc1cccc(NC(=O)Nc2cccc3c2CCCC3)c1	764302513	DTBZKMJJDSUVMT-UHFFFAOYSA-N	439.472	1.942	50	20	IDGD	
CN(C)C1CCN(c2ccc(NC(=O)C(=O)NNC(=O)Cc3ccccc3F)cc2)CC1	764319305	OIMXRGOKBLYPLK-UHFFFAOYSA-N	441.507	1.685	50	20	IDGD	
CC(C)n1ncc2cc(NC(=O)C(=O)NNC(=O)c3cnn(-c4ccccc4)c3)cnc21	764342207	DBTYBHNGMXCACJ-UHFFFAOYSA-N	432.444	1.598	50	20	IDGD	
CCn1nnnc1-c1cccc(NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)c1	764348975	BGOUHBPCATTZOB-UHFFFAOYSA-N	429.824	1.119	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C)c(S(=O)(=O)N3CCCCC3)c2)o1	764367051	IHEBHUHLERNJTN-UHFFFAOYSA-N	448.501	1.471	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)C(=O)Nc1cccc(C(=O)N2CCSCC2)c1C	764385826	LOQNQRCBKNFFPJ-UHFFFAOYSA-N	441.513	1.287	50	20	IDGD	
COc1nc2sccn2c1C=NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	764829995	JGROVSQBVBTYIW-UHFFFAOYSA-N	426.502	1.313	50	20	IDGD	
O=C(CSc1nnc(-c2ccncc2)n1Cc1ccco1)NNC(=O)NCC1CC1	765121116	PUTZIGCYNKYTRV-UHFFFAOYSA-N	427.490	1.814	50	20	IDGD	
Cc1nnc(-c2ccccc2C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)o1	765729400	QNWPAONMIMIQRI-UHFFFAOYSA-N	443.485	1.823	50	20	IDGD	
Cc1nn(C)c2sc(C(=O)NNC(=O)CN3CCN(C(=O)c4ccccc4)CC3)cc12	765739278	RULOYMKVDRLLGD-UHFFFAOYSA-N	440.529	1.162	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1cc(C)nn1-c1ccc(C(F)(F)F)cn1	768243485	DKYWOYQKBQUMRV-UHFFFAOYSA-N	436.354	1.475	50	20	IDGD	
Cc1ccc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)C(C)(C)O)cc2)cc1[N+](=O)[O-]	768248065	UROZYEYLLAHRJK-UHFFFAOYSA-N	436.446	1.236	50	20	IDGD	
Cc1ccc(C(=O)NCCC(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)c(O)c1	768278186	ZELVAXXQTYDDME-UHFFFAOYSA-N	425.420	1.811	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@@H](C(=O)NNC(=S)Nc3ccccn3)C2)cc1	768578189	DCEWAICNEVEQKI-OAHLLOKOSA-N	433.559	1.809	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)[C@@H](Cc3ccccc3)n3nnnc3C)n[nH]2)cc1	768849003	ZMQRXBQZEAWVHG-HXUWFJFHSA-N	430.472	1.925	50	20	IDGD	
COCCC(=O)N1CCC(NC(=O)NNC(=O)CCSc2ccc(F)cc2)CC1	769163761	FYKCKDONKIWHFO-UHFFFAOYSA-N	426.514	1.666	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)c3cccc(S(=O)(=O)N4CCCCC4)c3)nc21	770971569	KVLSRISPJHZYRO-UHFFFAOYSA-N	431.478	1.000	50	20	IDGD	
Cc1sc(=O)n(CC(=O)NNc2nc(O)c3cnn(C)c3n2)c1-c1ccc(F)cc1	770974484	LKQMKVQVSQKPSC-UHFFFAOYSA-N	429.437	1.550	50	20	IDGD	
Cn1c(=O)c2cc(NC(=O)NNc3ccc(Br)c(F)c3)cnc2n(C)c1=O	771115506	JZRVVBRRTVNIKC-UHFFFAOYSA-N	437.229	1.682	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)c1ccc2c(c1)C[C@H](C)N2S(C)(=O)=O	771967896	ITMFHCZSZRYSSB-QWHCGFSZSA-N	425.507	1.136	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)c1cc(Br)c2c(c1)OCCO2	772067255	XLMDRKBJLPWUBC-JTQLQIEISA-N	429.267	1.959	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@@H]2[C@@H]3CCc4ccccc4[C@@H]32)cc1	772630378	OZELCJZTDZCBBC-HLAWJBBLSA-N	442.541	1.674	50	20	IDGD	
CC[C@H](C)C(=O)N1CSC[C@H]1C(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772898555	SACHQJKNRNDDBJ-FZMZJTMJSA-N	426.926	1.051	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1cccc(N2CCOC2=O)c1	774006148	BGSFMLMPDQTZAG-GFCCVEGCSA-N	446.847	1.850	50	20	IDGD	
C[C@H]1C[C@H](C(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)CCO1	776338947	PZQSQAUJZPQUMT-MAUKXSAKSA-N	431.514	1.741	50	20	IDGD	
CC(C)N(C)S(=O)(=O)c1ccc(C(=O)NNc2cccc(S(C)(=O)=O)c2)cc1	776541301	OHQSNOXZYONEHW-UHFFFAOYSA-N	425.532	1.876	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cnc(C(F)(F)F)nc2)c1	777767108	XSAZTEAOZSKQTH-UHFFFAOYSA-N	445.423	1.601	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)c1cc(OCC(F)F)ccn1	777881991	VHYDYCRYFVRSSV-UHFFFAOYSA-N	433.459	1.699	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)[C@H](O)Cc1cccc(C(F)(F)F)c1	779047775	FYYSJHCTBMHJAS-OAHLLOKOSA-N	443.809	1.726	50	20	IDGD	
CNC(=O)Cn1nc(NC(=O)NNc2ccc([N+](=O)[O-])cc2Br)cc1C	779446190	WPNHEIUJBMLSEF-UHFFFAOYSA-N	426.231	1.757	50	20	IDGD	
COc1ccc(NNC(=O)C2CCN(S(=O)(=O)c3cc([N+](=O)[O-])ccc3C)CC2)nc1	781526738	JKBQVLMJHSWBQC-UHFFFAOYSA-N	449.489	1.851	50	20	IDGD	
O=C(NNc1nc2ccccc2s1)C(=O)Nc1ccc(C(=O)N2CCOCC2)cc1	782813375	JCZVYXWLAIJQHW-UHFFFAOYSA-N	425.470	1.851	50	20	IDGD	
COc1cccc(CC(C)=NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)n1	782894063	SBCRVRFIKTYIMF-UHFFFAOYSA-N	432.502	1.460	50	20	IDGD	
O=C(NNc1ccc(-n2cccn2)nn1)C(=O)Nc1cc(F)c(N2CCCC2)c(F)c1	783435982	GFFKYXMMFHPFLU-UHFFFAOYSA-N	428.403	1.623	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)C(=O)Nc1cccc(C#Cc2ccccc2)c1	784001677	AYJWJWZTGZTBED-UHFFFAOYSA-N	430.420	1.195	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1cccc(Br)c1	784003724	NCODRUSIKWUPNU-UHFFFAOYSA-N	425.264	1.027	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)[C@H]2CC=CC[C@H]2C(=O)N2CCOCC2)c1C	784293131	GHZQYFRUWVGWII-CEXWTWQISA-N	429.517	1.659	50	20	IDGD	
CS(=O)(=O)c1ccc(F)c(NC(=O)C(=O)NNc2ccc(Br)nc2)c1	784808027	QZZFLTDLIVJOKZ-UHFFFAOYSA-N	431.243	1.469	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)C(=O)Nc2ccc(C(=O)N3CCOCC3)cc2)c1	784853953	RSFYXPKXATVUHL-UHFFFAOYSA-N	426.429	1.027	50	20	IDGD	
C[C@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(NC(=O)C(=O)NNc3cccnn3)cc2)C1	784858385	LEEQHOJGUKBLNC-OKILXGFUSA-N	432.506	1.225	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)Nc1ccc(F)c(C(F)(F)F)c1	785023641	MVBJEOIQMXTOAI-UHFFFAOYSA-N	430.270	1.858	50	20	IDGD	
CS(=O)(=O)CCOc1cccc(NC(=O)C(=O)NNc2ccc(Cl)c(F)c2)c1	785187007	UISFOBRDFYTHOW-UHFFFAOYSA-N	429.857	1.984	50	20	IDGD	
COc1cc(F)cc(NNC(=O)C(=O)Nc2ccc(CN3CCN(C(C)=O)CC3)cc2)c1	785236851	JIBPVFCZSXGUDI-UHFFFAOYSA-N	443.479	1.580	50	20	IDGD	
Cc1ccc(C(=O)NCC2CC2)cc1NC(=O)C(=O)NNC(=O)[C@@H]1Cc2ccccc2O1	785990079	BWPFDWSWTMKJGM-IBGZPJMESA-N	436.468	1.224	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(c2ncc(NC(=O)NNC(=O)c3ccncc3)cn2)CC1	786184127	UWZWFGITFZJVHB-UHFFFAOYSA-N	442.480	1.395	50	20	IDGD	
Cn1nc([C@H]2CCCO2)cc1NC(=O)C(=O)NNC(=O)C1=S=C2CCCCCCC2=C1	789740287	FENMEKASXXHJOM-OAHLLOKOSA-N	445.545	1.730	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCc2ccco2)cc1C(=O)NNc1nc2ccccn2n1	791245525	XNNDWJJHEXKJCV-UHFFFAOYSA-N	426.458	1.866	50	20	IDGD	
C[C@@H]1CN(C(=O)NNC(=O)[C@@H](C)Oc2cccc(Br)c2)C[C@@]2(CCOC2)O1	792782089	YXWRIPXZEBIHPI-SNUQEOBHSA-N	442.310	1.837	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)Nc2cccc(S(=O)(=O)/N=C3\CCCN3C)c2)n1	797615611	CRRYUHOVRZADQX-JJIBRWJFSA-N	430.490	1.669	50	20	IDGD	
C=C(C)[C@H]1OCC[C@H]1CNC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	798116043	BHHIMXRBRQWSEA-FUHWJXTLSA-N	436.534	1.396	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)[C@H](C)Oc2ccc(Br)cc2)C[C@H](C)O1	799101124	LEEGCRVIVOLZMH-IHRRRGAJSA-N	428.327	1.863	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1sc(N2CCOCC2)nc1-c1ccccc1	799564000	GFQBUXJSUMFSSG-CYBMUJFWSA-N	432.502	1.749	50	20	IDGD	
Cc1c(C(=O)NNC(=O)COc2ccccc2F)nnn1CCOc1ccc(F)cc1	800313382	CLJJAPIGZVZBBQ-UHFFFAOYSA-N	431.399	1.784	50	20	IDGD	
CC(C)[C@@H](NC(=O)c1ccc(Cl)s1)C(=O)NNC(=O)CNC(=O)c1ccco1	800873269	BXYIAZZNARFTIW-CQSZACIVSA-N	426.882	1.326	50	20	IDGD	
CC(=O)NCC(=O)N1CCc2cc(C(=O)NNC(=O)Nc3cc(F)cc(F)c3)ccc21	802006730	PIYKMSRVJWOSKO-UHFFFAOYSA-N	431.399	1.457	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)NCc1ccccc1S(N)(=O)=O	807605626	UQHOTJQLEZEFPY-LLVKDONJSA-N	426.882	1.285	50	20	IDGD	
COc1ccc2c(c1F)CCC2=NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	807944333	XEGRRNIOMKASBR-UHFFFAOYSA-N	447.488	1.936	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cncc(C(F)(F)F)c2)cc1	808375201	PNJJTAOSLHYINF-UHFFFAOYSA-N	430.408	1.491	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCC(=O)NNc2cnnc3ccccc23)cc1OCC	810404320	NLQMAFWUFSHSRM-UHFFFAOYSA-N	445.501	1.849	50	20	IDGD	
CCC(CC)NC(=O)[C@H]1CN(C(=O)C(=O)NNc2ncncc2F)c2ccccc2O1	815765167	IADXCUHGTFCEMV-MRXNPFEDSA-N	430.440	1.158	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)[C@@H]1CC(c2ccccc2[N+](=O)[O-])=NO1	817055186	PZLSVFZMPGDFTD-INIZCTEOSA-N	433.446	1.481	50	20	IDGD	
Cc1ccc(N(C)S(=O)(=O)c2cccc(C(=O)NNc3nnc(C)c(O)n3)c2)cc1	817282215	WLDPOJZHEGVPFI-UHFFFAOYSA-N	428.474	1.776	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)[C@@H](C)N2C(=O)c3ccc(Br)cc3C2=O)n1	893368151	GVMHULBJZFLEJX-LLVKDONJSA-N	448.277	1.095	50	20	IDGD	
C=CCNC(=S)NNC(=O)c1ccc(NS(=O)(=O)c2ccc3c(c2)OCCO3)cc1	913437960	BPKXGHXQWYZAGW-UHFFFAOYSA-N	448.526	1.554	50	20	IDGD	
CSC[C@@H](C(=O)NNC(=O)Cc1c[nH]c2ccccc12)N1C(=O)[C@H]2CCCC[C@H]2C1=O	915787682	OEIMQFQBOOIGSY-JZXOWHBKSA-N	442.541	1.765	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)NCCc2ccc(S(N)(=O)=O)cc2)c1	915883567	AINTZMLWYOZZFK-UHFFFAOYSA-N	448.545	1.718	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2ccc(OCC(=O)NC(C)C)c(OC)c2)cc1OC	916034579	SQJLINZCCQEXOK-UHFFFAOYSA-N	445.472	1.691	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)NCc2cccnc2N2CCOCC2)cc1	916400066	OUKPJAZOMRGYAK-INIZCTEOSA-N	443.504	1.615	50	20	IDGD	
O=C(NCc1cccc(C(=O)NC2CC2)c1)NNC(=O)c1csc(N2CCOCC2)n1	916648095	AZRZMTNEUHCZLM-UHFFFAOYSA-N	444.517	1.016	50	20	IDGD	
NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)cc2)C1	918117820	JYXADYRDGWPYED-MRXNPFEDSA-N	440.460	1.441	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)NCCN2CCN(c3ncccn3)CC2)c1C	918623385	NPHOHENOEWOEPW-LTGZKZEYSA-N	437.548	1.387	50	20	IDGD	
O=C(/C=C\c1ccsc1)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	919647905	JICREMRIADEOCP-YWEYNIOJSA-N	449.554	1.562	50	20	IDGD	
CCC(=O)N[C@H](C)C(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccc(OC)cc2)c1	920400210	FSHUVJOTGXAAHQ-CYBMUJFWSA-N	448.501	1.172	50	20	IDGD	
CCn1c(NNC(=O)/C(=C\c2cccc(OC)c2)n2nnnc2C)nc2ccccc2c1=O	920444205	BODRJJKPMSOOCO-CPNJWEJPSA-N	446.471	1.861	50	20	IDGD	
CN(C)C1(CNC(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)CCOCC1	1318619600	YWXSIRGWJYYJTK-UHFFFAOYSA-N	427.546	1.075	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2nccc3nc[nH]c23)C1	1777926234	DQUQTPSINYCFNI-IIBYNOLFSA-N	445.596	1.937	50	20	IDGD	
CC(=O)O[C@@H](C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)Br)C2)C(C)C	1779210773	HHJOQTCCUSRIJQ-NVQRDWNXSA-N	447.370	1.871	50	20	IDGD	
CC(=O)N[C@@H](C(=O)N1CCO[C@@]2(CCN(C(=O)CO[Si](C)(C)C)C2)C1)C(C)(C)C	1779293946	HWWUOSCIOGUYSS-FXAWDEMLSA-N	427.618	1.219	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(OCCCO)cc3)C2)C1	1780126538	LTOKIVRUTUAPNS-RXVVDRJESA-N	440.924	1.145	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(OC)cc(OC)c3F)C2)C1	1780132514	JDQDEAXFWBVXTR-MGPUTAFESA-N	444.887	1.540	50	20	IDGD	
COc1ccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](O)CCl)C3)c(O)c1	1780319633	KHZWPZUPOJOSBO-SQGPQFPESA-N	426.897	1.128	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc([N+](=O)[O-])[nH]3)C2)C1	1780418745	CGKMWMYLTMQKKW-ZBEGNZNMSA-N	429.271	1.540	50	20	IDGD	
C=C(CC(=O)OCC)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Br)C1	1780774012	RVMPEKSHIDSNDD-QIIPPGSGSA-N	449.317	1.700	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2)c1ccc2c(c1)C(=O)CC2	1781276708	GOZCZOHNLBSZJV-NNMXDRDESA-N	434.920	1.543	50	20	IDGD	
COc1nc(C)ccc1C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781332168	UYDZSJZYBDBENO-SUMWQHHRSA-N	430.274	1.533	50	20	IDGD	
COc1cc(F)cc(/C=C/C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)c1	1783692767	MFNVUGFVYIVMTR-QBAWUGGESA-N	426.872	1.277	50	20	IDGD	
Cn1cc(C(=O)N2CCO[C@]3(CCN(C(=O)C(Cl)Cl)C3)C2)c(C(F)(F)F)n1	1783946388	MOQSLVDTBRYRLM-AWEZNQCLSA-N	429.226	1.686	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ncccc3Br)C[C@@H]21)[C@@H](O)CCl	1784090788	BKSCTAATLSQRSF-IMIFBBOLSA-N	446.729	1.037	50	20	IDGD	
COc1ccc(/C=C/C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]3C2)c(F)c1	1784094819	TZVSCIMBXZOPFG-UPFQJNFKSA-N	440.899	1.427	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)Cc3ccc(O)cn3)C2)C1	1784637480	GXBZDVDFQVVPEA-UGSOOPFHSA-N	426.311	1.191	50	20	IDGD	
O=C(CCc1ccccn1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21	1785433649	JJCFEYJFXFHFIW-QEWYBTABSA-N	428.302	1.684	50	20	IDGD	
CCc1[nH]nc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)Br)C[C@@H]32)c1F	1785793944	AVRDUBGWLVPOHA-ZPFDUUQYSA-N	431.306	1.488	50	20	IDGD	
Cn1c(C(=O)Nc2ccc(C3(NC(=O)c4ccc(B(O)O)cc4)CCC3)cc2)cccc1=O	1787245115	RFRAQEIJHUFAII-UHFFFAOYSA-N	445.284	1.127	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)c1nc2ccccn2n1	1787263250	AVWYYFJKKMHQBT-MNXVOIDGSA-N	440.273	1.013	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3=NN(c4ccccc4)C(=O)C3)[C@H]2C1	1787540242	PVJPJRGKRMYDSH-XPYUAMARSA-N	446.935	1.776	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccn(CCOC)n3)[C@H]2C1	1787635090	HEOIVDRROCWXBU-CUSZFKRNSA-N	426.945	1.530	50	20	IDGD	
CCn1nc(C)cc1C(=O)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1	1788423421	KPAFOCHZYHEFKW-UHFFFAOYSA-N	446.316	1.953	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc([N+](=O)[O-])[nH]3)[C@H]2C1	1789392879	MKQGVIMHKGEGSS-FMSGJZPZSA-N	443.298	1.690	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3sc4nccnc4c3N)C[C@@H]21	1789860225	LVZPIXIVHGCIGC-CYDGBPFRSA-N	437.953	1.884	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC1(c2ccc(NC(=O)c3cnn4c3CCC4)cc2)CCC1	1790890418	HPGZRSNSEIXCOJ-UHFFFAOYSA-N	438.532	1.950	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cn(C)c4ncccc34)C[C@@H]21	1791255337	MPJLNBIVEHLBDN-PLYYQAHHSA-N	434.924	1.420	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)COc3ccccc3C#N)C[C@@H]21	1791256267	KVMLEGPTAVCENI-BMFAXAFESA-N	435.908	1.171	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@]3(F)CCCC=C3F)C[C@@H]21	1791292596	XNFJIAZMSOPJOA-VCAMNPENSA-N	442.507	1.085	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1ccc(C2(NC(=O)COc3cccnc3)CCC2)cc1	1791600052	WJTHLVKMWKZQCX-UHFFFAOYSA-N	439.516	1.968	50	20	IDGD	
COc1ccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@](C)(Cl)CCl)C3)cc1O	1792730526	IGTGRHQCYXWTLZ-VLBMKZOESA-N	445.343	1.769	50	20	IDGD	
CC(=O)N[C@@H](Cc1cccc(F)c1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCl	1793117777	DIYZHBXJCVKXMM-PJVZLEMVSA-N	439.915	1.111	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CC=CC[C@H]1C(=O)OC)C2	1793452600	CMLXOUFZHDGZKI-NWCWSAAOSA-N	426.941	1.739	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cn1nnc2ccccc21	1793714598	YTTPFGWEOIWEPQ-JBYDNAENSA-N	440.331	1.257	50	20	IDGD	
CC(C)(C)n1ncc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](O)CCl)C3)c1Cl	1794430335	UBXRHTWJCZJLDD-ZMJPVWNMSA-N	433.336	1.094	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)c1cc(-c2ccccc2)no1	1796192001	ZICQKRHLUQBVTQ-ACDBMABISA-N	445.284	1.587	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)c1ccc2c(c1)C(=O)CC2	1796193218	WEUTWFCHKJQUMP-ACDBMABISA-N	432.285	1.061	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CC1CCN(C)CC1)C2	1796889710	NNOFKHVMOJAGEG-JAEJZPAFSA-N	442.564	1.491	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1sc3nccnc3c1N)C2	1797954994	XSOPJHGHPFBBNL-JJLQDPRZSA-N	449.609	1.328	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CN(Cc3ccccc3)CCO1)C2	1799267906	HXTRQPLNYQRORN-FDKIHUSFSA-N	449.979	1.494	50	20	IDGD	
Cc1ncccc1CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Br	1799344332	IFQWIMMMHOPPIZ-FSDCSDTHSA-N	428.302	1.603	50	20	IDGD	
CC(C)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccccc1-n1nccn1	1799670866	QLOJVZTZPPTPDD-JLVBRIDZSA-N	431.924	1.736	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)[S@](=O)c1ccccc1	1800217137	RDRSQWDATBQBAF-HGRCCOKLSA-N	426.966	1.790	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1[C@H]3COC[C@H]31)C2	1800334016	CVQPNWCECGDKDO-ALPRRHJNSA-N	443.450	1.354	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nc3ccccc3[nH]1)C2	1800641201	QZHAUZYNFHDOQN-ZWUHOBOKSA-N	435.322	1.940	50	20	IDGD	
C=C1CC(C(=O)NC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)C1	1802414395	ORUCXGKKDHQMPL-JXFKEZNVSA-N	434.500	1.366	50	20	IDGD	
CNc1nsnc1C(=O)NC[C@@H]1CCN(C(=O)[C@H](Cl)COC)[C@@H]1c1cccnc1	1802477818	LXXFKGRGUSCZHQ-GZBFAFLISA-N	438.941	1.548	50	20	IDGD	
CC1(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)CCCC1	1802618650	GULLEYUICJXCJD-FPOVZHCZSA-N	435.333	1.661	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC2(CCCN(C(=O)[C@@H](C)NS(=O)(=O)CC)C2)CC1	1805954210	RRTAWSXGFXKYHI-CVEARBPZSA-N	436.018	1.953	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC2(CCCN(C(=O)C3=NN(C)C(=O)CC3)C2)CC1	1806617240	WZEMAWYYANDBFC-CQSZACIVSA-N	441.370	1.857	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2[nH]nc3ncccc23)[C@H]1c1cccnc1	1808116042	BCWHOIWDGYQLIY-QILLFSRXSA-N	442.907	1.926	50	20	IDGD	
O=C1CC[C@H](C(=O)N2CC[C@H](CNC(=O)[C@@H](F)Br)[C@H]2c2cccnc2)CN1	1808648739	BDLWFRYOYVDJGG-OCVGTWLNSA-N	441.301	1.304	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)c1cccc2c1OCC2	1808998500	PCAFYDFYRVDRGJ-QXAKKESOSA-N	429.904	1.936	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)CNC(=S)NCC)[C@@H]1c1cccnc1	1812328677	JFPQISDQGHTEMV-BQFCYCMXSA-N	440.013	1.979	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CCN2CCOC2=O)[C@H]1c1cccnc1)C(Cl)Cl	1813079286	WXFMGWRCQCKCOT-ZFWWWQNUSA-N	429.304	1.733	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCSC)[C@@H]1c1cccnc1	1813094658	BZMMZTBSJOOFGY-QZWWFDLISA-N	429.970	1.455	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)CCc2cnccn2)[C@@H]1c1cccnc1	1813447814	YSTRLGUWRNLVOR-QRFRQXIXSA-N	431.924	1.764	50	20	IDGD	
COC(=O)NCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](C)CBr)n[nH]1	1814783960	YKTRBNDNMPZGSA-CMPLNLGQSA-N	430.303	1.789	50	20	IDGD	
Cc1ccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)cn1	1816371074	MFQCTRHWLDDTLR-LJQANCHMSA-N	433.277	1.413	50	20	IDGD	
O=C(CCBr)N[C@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1	1816722483	IOEQEVOZWKETTR-VIFPVBQESA-N	441.307	1.960	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CN2CCOCC2)n[nH]1	1817144190	GBOVUGGGVHLRBZ-UKRRQHHQSA-N	442.358	1.765	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc3n(n2)CCCO3)n[nH]1	1819091092	PBDWAMNKLDTQEG-SWLSCSKDSA-N	436.900	1.948	50	20	IDGD	
Cc1ocnc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819403240	AOOHXLISRQGYJM-HNNXBMFYSA-N	438.448	1.324	50	20	IDGD	
O=C(Cc1ccncc1)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1820716290	TWGGKLZSSGMTKS-IBGZPJMESA-N	433.277	1.033	50	20	IDGD	
CN(C)C(=O)NCC(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](F)Br)n[nH]1	1820934858	RCNGJMRDERPPEU-GWCFXTLKSA-N	433.282	1.364	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H]2CCCS2(=O)=O)n[nH]1	1821834144	IBRZULGEORQOLU-GJZGRUSLSA-N	442.614	1.831	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CSCC(=O)OC)[nH]n1	1822371398	RQAVFXBHJVEQQK-DGCLKSJQSA-N	432.930	1.562	50	20	IDGD	
CC(C)c1cc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)n[nH]1	1822414977	PUFKURGJDWSVKZ-KRWDZBQOSA-N	444.540	1.935	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@]2(C)CC2(F)F)n[nH]1	1823399490	SBZORCPWVWBPLD-SCLBCKFNSA-N	426.468	1.820	50	20	IDGD	
O=C(CCc1ccc(O)nn1)Nc1nc2c(s1)C[C@@H](NC(=O)C(Cl)Cl)CC2	1824491462	GQLFUDRFLQAQOR-VIFPVBQESA-N	430.317	1.987	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)Cn1nnc3ccccc31)CC2	1825994943	QVFNMHFLKLPGDB-NEPJUHHUSA-N	448.936	1.754	50	20	IDGD	
Cc1cc(/C=C/C(=O)N2CCCC[C@@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)no1	1828992838	AYMDDDQJKUCBEH-FHVRUZERSA-N	445.564	1.989	50	20	IDGD	
CN1CCC[C@@H](C(=O)N2CCCC[C@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)C1	1830184211	IQCHHYBVLXXKDH-UXHICEINSA-N	435.613	1.321	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)COc3ccc(O)cc3)CCO2)C1	1830339457	SONWZMQQERDATJ-GHTZIAJQSA-N	440.924	1.635	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ncccc2F)CC1	1831873816	ZFJFMEZLMCZYDT-SFHVURJKSA-N	433.528	1.827	50	20	IDGD	
C[C@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H](F)Br)CC1)n1cnnn1	1832293692	LGFMSIYUUXAPND-MRVWCRGKSA-N	431.310	1.544	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)CC[C@H]2CCOC2)CC1	1832450880	ATHJOAPLEUIPIX-AVRDEDQJSA-N	442.365	1.416	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)COc3cccnc3)CCO2)C1	1832679628	BJOBBHKHLDYWJW-RTBURBONSA-N	446.331	1.153	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3ncccc3OC)CCO2)C1	1832865390	IECOLSDRILPUFL-IIBYNOLFSA-N	439.940	1.497	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3cn[nH]c3)CCO2)C1	1832942180	IVEHGUMGCKJILT-ZWKOTPCHSA-N	433.336	1.035	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCC(N2CCC(NC(=O)CN3CCSCC3)CC2)CC1	1833060952	INZPUNVVJSVIER-UHFFFAOYSA-N	445.073	1.872	50	20	IDGD	
CSCC[C@H](O)C(=O)N1CCC(N2CCC(NC(=O)C(C)(C)CCl)CC2)CC1	1833216083	UBFJIDNJVCAOIF-KRWDZBQOSA-N	434.046	1.937	50	20	IDGD	
COc1ccsc1C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)CCl)CC2)CC1	1833311781	DSRKXEMCRREIAH-OAHLLOKOSA-N	429.970	1.542	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccs3)CCO2)C1	1833930215	IVINNWDFCPRNEO-SUMWQHHRSA-N	431.352	1.849	50	20	IDGD	
CC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)n3ccccc3=O)CC2)CC1	1836396874	ODEWGYGPCKYJCN-APWZRJJASA-N	436.984	1.998	50	20	IDGD	
CN1CCC[C@H]1C(=O)N1CCC(N2CCC(NC(=O)[C@H](F)Br)CC2)CC1	1836413463	FQDUSFHGDPNKCQ-HOTGVXAUSA-N	433.366	1.343	50	20	IDGD	
Cc1cnn([C@@H](C)C(=O)N2CCC(OC3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)c1	1836720031	HBXYGFQMAUYVDQ-YJBOKZPZSA-N	426.945	1.351	50	20	IDGD	
O=C(c1ccc2nc[nH]c2c1)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1836934211	JCVBGCUCHMQHIN-GOSISDBHSA-N	427.288	1.437	50	20	IDGD	
Cc1ccc(C(=O)N2CCC(OC3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)o1	1836953043	GIJKREOGIINOFU-UHFFFAOYSA-N	440.305	1.194	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc4sccc4[nH]3)CCO2)C1	1837132581	FSINEEMHEMRNDO-ORAYPTAESA-N	441.937	1.553	50	20	IDGD	
Cn1nc(C(=O)N2CCC(OC3CCN(C(=O)[C@@](C)(Cl)CCl)CC3)CC2)cc1O	1837270273	JPEMHHVKAWKQAU-IBGZPJMESA-N	447.363	1.974	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)c3cnsn3)CC2)CC1	1837298328	AYOBCJCETKTLDV-LLVKDONJSA-N	431.356	1.934	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)C(=O)N(C)C)CC2)CC1	1837814622	WSSVTBYTGYYJSU-HNNXBMFYSA-N	432.359	1.247	50	20	IDGD	
CO[C@@H](C)C(=O)N1CCC(OC2CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CC2)CC1	1838103238	SAWVNVQQLCAXDT-WTJYETQFSA-N	447.536	1.154	50	20	IDGD	
Cc1cccc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)c1	1839199625	RCTPGQLOEPTZJJ-IEBWSBKVSA-N	443.313	1.684	50	20	IDGD	
Cc1ccncc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839200259	FCLXOLTUXBHPHJ-RHSMWYFYSA-N	430.274	1.151	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](S)C(C)C)C2)C1	1839963105	ZZESKWVOAHAPAN-GRDNDAEWSA-N	437.400	1.571	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccccc3)C2)C1	1839963554	OELNBSHQPCFYEC-YLJYHZDGSA-N	439.350	1.859	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)C(=O)c3ccccc3)C2)C1	1840031954	HRGHVRAMQUZMQC-IFXJQAMLSA-N	439.306	1.109	50	20	IDGD	
O=C(c1cccn2nccc12)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840189756	KMRQYJOTYJPUHR-SFHVURJKSA-N	427.288	1.208	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CCc3ccccc31)CCO2	1840260651	WCXZBUXBMIETQR-XQBPLPMBSA-N	436.936	1.427	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)c2cc(-c3ccccc3)on2)C1	1840994233	QFGLPRXQTBZKHT-UHFFFAOYSA-N	431.257	1.152	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1[C@H](C(=O)N1CC3(CCCN3C(=O)[C@@H](O)CCl)C1)C2	1841354660	NDYZHUSLLIQMLK-FZKCQIBNSA-N	441.956	1.578	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(F)(C(=O)N2CC3(CCCN3C(=O)CCBr)C2)C1	1842639392	KZDRJDNFWAUUDB-UHFFFAOYSA-N	448.333	1.934	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1n[nH]c3ccccc13)C2	1843416262	PWCBNRVKFSMLGJ-ZVHZXABRSA-N	433.472	1.514	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@]13C[C@@H](CO1)N(C(=O)OC(C)(C)C)C3)C2	1845166094	ATBLJEWOCWVQHT-ZSDSOXJFSA-N	441.956	1.986	50	20	IDGD	
C[C@@H](C(=O)N1CC2(CCCN2C(=O)[C@@H](Br)Cc2ccccc2)C1)n1cnnn1	1845943054	QJXVRLYLBHOQNJ-HOCLYGCPSA-N	447.337	1.444	50	20	IDGD	
Cc1ccc(S(=O)(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)cc1[N+](=O)[O-]	16095394	QOFXXEFGHBNAKY-UHFFFAOYSA-N	445.457	1.817	50	20	IDGD	
CN1C(=C(C#N)C(=O)COC(=O)CN2C(=O)c3ccccc3C2=O)N(C)c2ccccc21	16209411	CXQCBMHHRTXSTK-UHFFFAOYSA-N	430.420	1.716	50	20	IDGD	
CCCn1c(=O)n(CCC(=O)OCC(=O)NNC(=O)c2cccs2)c2ccccc21	16541662	JVBVPKCCKVXESA-UHFFFAOYSA-N	430.486	1.669	50	20	IDGD	
O=C(Cc1csc(N2CCOCC2)n1)N/N=C1\C(=O)Nc2cc3c(cc21)OCCCO3	17414612	AGORVHGHSNOCDX-UHFFFAOYSA-N	443.485	1.156	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc2c1O[C@H](C)C2	21779078	JFDZMQZGYYTNMY-CQSZACIVSA-N	447.513	1.409	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(C(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)cc1	26070418	PBXUQUFDMSVGKE-MRXNPFEDSA-N	449.529	1.457	50	20	IDGD	
O=C(Cn1cc(Br)c(O)nc1=O)NNc1nc(-c2ccc(Cl)cc2)no1	303509757	NTKFISYEXSYDIJ-UHFFFAOYSA-N	441.629	1.558	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)Cc1cn2cc(Cl)cc(Cl)c2n1	725902836	VDRQXEYVSAHVNT-UHFFFAOYSA-N	426.285	1.823	50	20	IDGD	
COc1ccc(CCN2C[C@@H](C(=O)NNC(=S)NCC3CCC3)CC2=O)cc1OC	727866846	CFCXQXVRPRIZRM-INIZCTEOSA-N	434.562	1.390	50	20	IDGD	
CC(=O)Nc1ccc(NS(C)(=O)=O)c(C(=O)NNC(=O)Cc2ccc(Cl)cc2)c1	728151527	JUSNVYVGFZMPDQ-UHFFFAOYSA-N	438.893	1.674	50	20	IDGD	
Cc1nn(Cc2ccc(C(=O)N([C@@H]3CCS(=O)(=O)C3)N(C)C)cc2)c(C)c1[N+](=O)[O-]	728179728	UPDMSGIZFWTNEF-QGZVFWFLSA-N	435.506	1.562	50	20	IDGD	
O=C(CCc1nc(-c2ccsc2)no1)NNC(=O)C1CCN(c2ncccn2)CC1	728847991	RWFUQWFEPYOLQK-UHFFFAOYSA-N	427.490	1.585	50	20	IDGD	
CS(=O)(=O)Nc1cccc(CC(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)c1	730219236	XGUKCVMLTBNXPQ-UHFFFAOYSA-N	438.531	1.185	50	20	IDGD	
CCC(=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O)c1cc(Cl)cc(Cl)c1O	730568881	FVANZVVVFBBQHD-UHFFFAOYSA-N	446.316	1.514	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)CCNC(=O)N1CCc2ccccc2C1	732257023	BOARPIMXNBXBMH-UHFFFAOYSA-N	426.473	1.379	50	20	IDGD	
C[C@H](C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1)N1CCc2ccccc2C1	732259919	LCTKSHXNXIDFMV-GFCCVEGCSA-N	436.921	1.195	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@@H](NC(=O)NN[C@]1(C)CCS(=O)(=O)C1)C1CCCCC1	732474367	BWTQTUINVDJZET-DNVCBOLYSA-N	432.587	1.841	50	20	IDGD	
O=C(CNc1ccccc1)NNC(=O)[C@@H]1CCCN1S(=O)(=O)c1cccc([N+](=O)[O-])c1	732996930	PTPKRWCLOPTYQI-KRWDZBQOSA-N	447.473	1.007	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc21)c1cccc(S(=O)(=O)N2CCCCC2)c1	733252106	DKSXAIHPFCFVDU-SFHVURJKSA-N	429.498	1.798	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)CC[C@@H]2NC(=O)N(c3ccc(C#N)cc3)C2=O)c1	733774094	HGWDENUSJQHODB-SFHVURJKSA-N	449.467	1.607	50	20	IDGD	
Cc1ccc2oc(C(=O)NNc3ncccc3S(=O)(=O)N3CCN(C)CC3)cc2c1	735116883	JQIMDEMJXTYGIF-UHFFFAOYSA-N	429.502	1.829	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)c2cc(-n3cccn3)ccn2)cc1	736066407	GPUWKVAULOWZOB-UHFFFAOYSA-N	434.485	1.763	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)cc1OC	740392662	ZJIYQWVADMQLHI-UHFFFAOYSA-N	445.428	1.894	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](C(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1cccc(Cl)c1	740815047	IABQZOWRJLTBQH-OCCSQVGLSA-N	445.925	1.488	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCN([C@@H](C)c2cccnc2)CC1	741789167	VTZNSZSRQDEBSN-HNNXBMFYSA-N	431.924	1.883	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NCCN2CCc3sccc3C2)cc1	743556477	LBYYWYTWUNUMIZ-UHFFFAOYSA-N	437.547	1.546	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)CCCN2C(=O)NC(C)(C)C2=O)cc1Cl	743834464	HADYULOSRMBTFV-UHFFFAOYSA-N	441.872	1.621	50	20	IDGD	
COc1ccc(CCC(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)cc1OC	744621151	SEVSIBFJZDJNBX-UHFFFAOYSA-N	449.529	1.801	50	20	IDGD	
Cc1cc(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)c2c(C)noc2n1	744622011	MBBBWHWEDPCVAU-UHFFFAOYSA-N	431.474	1.617	50	20	IDGD	
C[C@]12CCC(=O)N1c1ccccc1C(=O)N2CC(=O)NNC(=O)COc1ccc(C#N)cc1	746580247	TXSPPZPTBWYIHN-HSZRJFAPSA-N	447.451	1.083	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)NCCC(=O)NNc2cccc([N+](=O)[O-])c2C)cc1	749289406	QBNMOIBGFPYHDR-UHFFFAOYSA-N	435.462	1.673	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)[C@H]2CCCN2Cc2ccc(F)cc2)n1	750503142	NCEGCUVJHXVDEM-MRXNPFEDSA-N	434.493	1.488	50	20	IDGD	
CNS(=O)(=O)[C@@H]1CCN(C(=O)/C(C#N)=C\c2cn(CCC#N)nc2-c2ccccc2)C1	750515931	KFHYPPDDNNDERO-LYPXWFNGSA-N	438.513	1.521	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)N[C@@H]2CC(=O)N(C(C)(C)C)C2)nc1	750662930	QIVHQWHEQCRMBN-CYBMUJFWSA-N	426.543	1.138	50	20	IDGD	
Cc1cc(C)c(N2C[C@H](C(=O)NNC(=O)CNC(=O)c3cccs3)CC2=O)c(C)c1	751208686	HXQWIBBIWJNQMS-OAHLLOKOSA-N	428.514	1.604	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)NNC(=S)Nc2cccc(Br)c2)c(C)o1	751611518	LZEYLHXLQBWBRW-UHFFFAOYSA-N	447.336	1.890	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)[C@H]3CC(=O)N(CCOc4ccccc4Cl)C3)nc21	751966733	YJFMJAXTPWFCCU-NSHDSACASA-N	445.867	1.093	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)Cc1ccc(I)cc1	753458259	IVCOCJQKOLUBDY-LLVKDONJSA-N	432.258	1.959	50	20	IDGD	
O=C(NNc1ccc(-c2ccccc2)nn1)c1ccc(S(=O)(=O)N2CCOCC2)o1	754470617	WZDJFBPXTYNPSD-UHFFFAOYSA-N	429.458	1.514	50	20	IDGD	
CCc1c(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cnn1CC(C)C	755380902	JUOJZQFTNCQMPN-UHFFFAOYSA-N	447.561	1.961	50	20	IDGD	
CNS(=O)(=O)c1cc(NC(=O)NNC(=O)CSc2ccccc2OC)ccc1C	755516188	QHAZWFXRMJFDBW-UHFFFAOYSA-N	438.531	1.857	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)Nc1ccc(N2CCNC(=O)C2)c(Cl)c1	755938553	SPCPTFJXAFHMQY-UHFFFAOYSA-N	431.880	1.680	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)Nc1ccc(C(=O)NCc2ccccc2F)cc1	755957628	XPBWDRWBQRWRSD-OAHLLOKOSA-N	448.476	1.343	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)Nc1cccc(COCCOc2ccccc2)c1	755981437	MPKLGTQBCZIOIN-QGZVFWFLSA-N	447.513	1.870	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2ccc3ccccc3n2)cc1	756784392	MSVMNTHRXIIMSB-UHFFFAOYSA-N	443.485	1.626	50	20	IDGD	
C[C@H]1CN(C(=O)Cn2cc(NC(=O)NNC(=O)C(C)(C)c3ccccc3)cn2)C[C@@H](C)O1	756840551	WQGRDMNKPYDVFC-IYBDPMFKSA-N	442.520	1.649	50	20	IDGD	
CCn1cc(S(=O)(=O)NNC(=O)c2ccc(OCCC(C)C)cc2)c([N+](=O)[O-])n1	756929622	IPJYXRDIECQPPO-UHFFFAOYSA-N	425.467	1.859	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)CN2C(=O)N[C@]3(C[C@@H](C)C[C@@H](C)C3)C2=O)o1	756949487	HWUWICWUZDIVPS-YEZVWNJWSA-N	447.536	1.629	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1)c1cn[nH]c1	757722049	NGDMTEGXVFGWPH-AWEZNQCLSA-N	431.460	1.817	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2ccn(-c3ncccc3F)n2)c2ccccc2c1=O	757783024	ONBQBVJJLKNWRI-UHFFFAOYSA-N	436.407	1.603	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2cc(C(N)=O)ccc2-n2cc(C)cn2)c(OC)c1	757875206	MYYOGIAWZPFPPW-UHFFFAOYSA-N	438.444	1.763	50	20	IDGD	
Cn1c(N)c(C(=O)/C(C#N)=C\c2ccc(OCC(F)(F)F)c(F)c2)c(=O)n(C)c1=O	757919566	LFSZCEOCAOJNIU-YHYXMXQVSA-N	426.326	1.536	50	20	IDGD	
COCCS(=O)(=O)c1ccc(CNC(=O)NNC(=O)COc2ccccc2F)cc1	758851987	DATKNMMEZWWGFT-UHFFFAOYSA-N	439.465	1.155	50	20	IDGD	
CCNS(=O)(=O)c1ccc(CC(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)cc1	759973502	MIYJDJWJFFOUEJ-UHFFFAOYSA-N	447.485	1.667	50	20	IDGD	
NC(=O)[C@@H]1CC[C@H](CNC(=O)NNC(=O)COc2ccccc2Cc2ccccc2)O1	760204838	UMNGBCHBVJLCLI-MJGOQNOKSA-N	426.473	1.020	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2noc(-c3cccc(OC)c3)n2)c2ccccc2c1=O	760273602	BCBWDPNXVDBLGZ-UHFFFAOYSA-N	434.412	1.550	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2ccnn2[C@@H](C)C2CC2)n[nH]1	760289026	AUICVQANAYKXJC-LBPRGKRZSA-N	437.460	1.653	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCCC(=O)NNC(=O)c1c[nH]c2ccccc12	760799417	NPFODIKAASJGJW-QGZVFWFLSA-N	443.504	1.835	50	20	IDGD	
CN(Cc1ccccc1NC(=O)C(=O)NNC(=O)c1ccccn1)C(=O)OC(C)(C)C	763466038	FZPUFDZEWHUJOY-UHFFFAOYSA-N	427.461	1.848	50	20	IDGD	
COc1ccccc1NC(=O)Nc1cc(NC(=O)C(=O)NNC(=O)C2CC2)ccc1OC	763558006	LVGUYBJALGKNDR-UHFFFAOYSA-N	441.444	1.844	50	20	IDGD	
Cc1ccnc(-c2cccc(NC(=O)C(=O)NNC(=O)c3c(C)nc4ccccn34)c2)n1	763628728	FEFCZLOBRVSFKN-UHFFFAOYSA-N	429.440	1.808	50	20	IDGD	
Cc1cc(C)n(-c2ccc(NC(=O)C(=O)NNC(=O)COc3ccccc3F)cn2)n1	763679512	MXBUMCJXOKHTFO-UHFFFAOYSA-N	426.408	1.188	50	20	IDGD	
Cc1ccc(NC(=O)C2CC2)cc1NC(=O)C(=O)NNC(=O)COc1ccccc1F	763681130	KMDZPXZATKPKPG-UHFFFAOYSA-N	428.420	1.648	50	20	IDGD	
O=C(CN1CCCc2ccccc21)NNC(=O)C(=O)Nc1ccc2c(cnn2C(F)F)c1	763729393	YGVMMTFOWQMCBS-UHFFFAOYSA-N	442.426	1.970	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)nc(C2CC2)n3C)c1	763772101	MCNGZWAVIGUSNG-UHFFFAOYSA-N	437.456	1.868	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)c2cc(OC)cc(OC)c2)c(C)c1	763774917	JYFPRUAPPXXMRW-UHFFFAOYSA-N	431.445	1.437	50	20	IDGD	
CCn1cnnc1-c1cccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)c1	763866377	VSZSZOSTZLUGDS-ZDUSSCGKSA-N	440.435	1.658	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccc(F)cc2OCC(F)(F)F)n1	763892623	GATJCSAFGFZNSM-UHFFFAOYSA-N	431.346	1.366	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CCSc2ccc(F)cc2)cc1-n1cnnn1	763903486	SIXFCMJITWOCNI-UHFFFAOYSA-N	443.464	1.378	50	20	IDGD	
C[C@@H]1CN(c2ccccc2NC(=O)C(=O)NNC(=O)Cc2ccc(F)cc2)C[C@@H](C)O1	763919978	XEVXEBMLGFCHJD-HUUCEWRRSA-N	428.464	1.768	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C)c(C)c(NC(=O)C(=O)NNC(=O)c2ccc[nH]2)c1	763979127	HRGQSWOJMGROFO-UHFFFAOYSA-N	435.506	1.062	50	20	IDGD	
CNS(=O)(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2cccc3ccccc23)c1C	764049580	TZAJWKRDKPYTNS-UHFFFAOYSA-N	440.481	1.456	50	20	IDGD	
CCN1CCN(Cc2ccc(NC(=O)C(=O)NNC(=O)c3ccc(C)cc3O)cc2)CC1	764104993	KJPOKMTZPYIXQA-UHFFFAOYSA-N	439.516	1.238	50	20	IDGD	
O=C(CCCc1ccccc1)NNC(=O)C(=O)Nc1ccccc1S(=O)(=O)C(F)F	764223248	FAUZAGHWYAFRLP-UHFFFAOYSA-N	439.440	1.792	50	20	IDGD	
CN1CCN(Cc2cccc(NC(=O)C(=O)NNC(=O)CCCc3ccccc3)c2)CC1	764225148	YYKOOSMBVYDYID-UHFFFAOYSA-N	437.544	1.543	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(C#N)c2)c2ccccc12	764235057	PTRLPIDDFDRWHF-UHFFFAOYSA-N	446.419	1.663	50	20	IDGD	
CC(C)S(=O)(=O)c1ccccc1NC(=O)C(=O)NNC(=O)C(C)(C)c1ccccc1	764301302	AHRPMICYQCWUCA-UHFFFAOYSA-N	431.514	1.932	50	20	IDGD	
O=C(CCN1C(=O)[C@H]2CCCC[C@@H]2C1=O)NNc1c(F)cc(C(=O)NC2CC2)cc1F	764333087	DKPDPURTZONPOA-KBPBESRZSA-N	434.443	1.865	50	20	IDGD	
C[C@@H]1CCCCN1C(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cnn(C)c2)cc1Cl	764362717	HHYYPLCRQQWYNX-GFCCVEGCSA-N	446.895	1.488	50	20	IDGD	
COc1ccc(Cn2nccc2NC(=O)C(=O)NNC(=O)COCc2ccccc2)cc1	764367223	KPDHYPPKUNVFCR-UHFFFAOYSA-N	437.456	1.243	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc(-n4ccnc4)nc3)n[nH]2)cc1	764385366	ZFMSYOAZVBDYCE-UHFFFAOYSA-N	444.455	1.620	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)[C@H]2CN(C(=O)OC(C)(C)C)CCO2)cc1	764560646	XTZCMQFSUUJFID-WMLDXEAASA-N	437.493	1.636	50	20	IDGD	
O=C(O)CCOc1cccc(C=NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)c1	764828173	QGVRKQACFYNHNP-UHFFFAOYSA-N	438.484	1.448	50	20	IDGD	
Cc1ccc(C)c(S(=O)(=O)NCCC(=O)NNC(=O)CSc2ccccc2O)c1	765251889	KMLNZANXRDDSLN-UHFFFAOYSA-N	437.543	1.617	50	20	IDGD	
COC(=O)Cc1csc(NC(=O)NNC(=O)c2cc(-c3ccccc3OC)[nH]n2)n1	765311942	SUKBLQAMKNWIGE-UHFFFAOYSA-N	430.446	1.724	50	20	IDGD	
COc1ccc2[nH]cc(CC(=O)NNC(=O)CN3CCN(C(=O)c4ccccc4)CC3)c2c1	765736426	RXYSRHJOMMMFBW-UHFFFAOYSA-N	449.511	1.324	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)[C@H]2CC(=O)N(c3ccc(Cl)c(F)c3)C2)C[C@@H](C)O1	767148482	VBJOECOMKZONBY-MJBXVCDLSA-N	440.903	1.479	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)[C@H]2CC[C@@H](C(F)(F)F)NC2=O)n[nH]1	768275390	BBCUSTOABVOUCY-HZMBPMFUSA-N	425.367	1.303	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)c1cc(S(C)(=O)=O)ccc1Cl	768611367	HBOGRMGVQVBDQA-UHFFFAOYSA-N	432.907	1.913	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)NC1[C@@H]2[C@H]3CC[C@@H](C3)[C@@H]12	769200311	OMXDYJOZDKWLGJ-LBTBCDHLSA-N	432.546	1.850	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)NCc1ccc(S(N)(=O)=O)s1	770098003	DICONSDPQXELER-SECBINFHSA-N	432.911	1.347	50	20	IDGD	
CC[C@H]1Oc2cc([C@@H](C)NC(=O)NNc3nc(O)c4cnn(C)c4n3)ccc2NC1=O	770402031	NWFMTKSMFFSREN-NOZJJQNGSA-N	426.437	1.566	50	20	IDGD	
Cc1cc2c(cc1C)[C@@H](C(=O)NNc1ccc(S(=O)(=O)N3CCN(C)CC3)cc1)CO2	771432205	RBOZSAWQQMHJCA-FQEVSTJZSA-N	444.557	1.859	50	20	IDGD	
COC(=O)c1ccc(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c(F)c1	771853693	JGCVZJGLVSPYIL-UHFFFAOYSA-N	428.464	1.586	50	20	IDGD	
COC(=O)c1c(F)cccc1NNC(=O)C1CCN(S(=O)(=O)c2cccnc2)CC1	773619751	KBCGZHDFNQPEPS-UHFFFAOYSA-N	436.465	1.551	50	20	IDGD	
COC(=O)c1ccc(-n2cc(C)cn2)c(NC(=O)C(=O)NNc2nccnc2C(C)C)c1	773992554	QSJCCWDLINJASW-UHFFFAOYSA-N	437.460	1.963	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@H](C(C)(C)C)C(F)(F)F)cc1	775977905	CQNRJYUTJJPJDJ-CQSZACIVSA-N	438.472	1.923	50	20	IDGD	
Cn1nc(SCC(=O)NN=Cc2ccc(Cl)c(Br)c2)c(=O)n(C)c1=O	776185937	OIGZSWVNXOBYQM-UHFFFAOYSA-N	446.714	1.137	50	20	IDGD	
CC(C)CN1N=C(C(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)CCC1=O	776205773	OIPBEPZNRKWWLD-UHFFFAOYSA-N	438.529	1.257	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2cnc3scc(C)n3c2=O)c2ccccc2c1=O	776288974	LGYMPXFBQSQORY-UHFFFAOYSA-N	438.469	1.259	50	20	IDGD	
O=C(Cc1ccc(F)cc1Br)NNC(=O)c1csc(N2CCOCC2)n1	776963784	FAYBLWGULLDDPK-UHFFFAOYSA-N	443.298	1.885	50	20	IDGD	
CCNS(=O)(=O)c1ccccc1S(=O)(=O)NNC(=O)c1cccc2ncccc12	777625540	JOJGAZIILCKWGJ-UHFFFAOYSA-N	434.499	1.156	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)COc1ccc(Br)cc1)n1nnnc1C(C)(C)C	777786597	HAWMITSTFBTGBH-JTQLQIEISA-N	425.287	1.521	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)c1ccc2c(c1)nc(O)n2CC(F)(F)F	778438306	OMGPMQBMIGCNCC-UHFFFAOYSA-N	431.371	1.590	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@]2(C[C@@H]2C(=O)NNC(=O)c2nnc(O)c3ccccc23)C1	780171285	KCOANTNUJBABLN-SPLOXXLWSA-N	427.461	1.744	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)c1n[nH]c2c1CN(C(=O)OC(C)(C)C)CC2	782418127	NZDHCIBQUOVUDR-GFCCVEGCSA-N	437.497	1.442	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)c1n[nH]c2c1CN(C(=O)OC(C)(C)C)CC2	782418129	NZDHCIBQUOVUDR-LBPRGKRZSA-N	437.497	1.442	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(NC(=O)C(=O)NN=c2cc[nH]cc2)ccc1Cl	783376896	STBKNSXZYXNVLN-UHFFFAOYSA-N	425.898	1.269	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2cc(F)ccc2SCC(F)F)CCS(=O)(=O)C1	783428625	XUHGWXVDRHZXKQ-HNNXBMFYSA-N	425.454	1.319	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NN(C)c2ccccc2)cc1S(=O)(=O)N1CCCC1	783431408	FGXODNPFHMMOSN-UHFFFAOYSA-N	446.529	1.976	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNS(=O)(=O)c1c(F)c(F)c(F)c(F)c1F	783842853	ZKKZYFJPJUUQLY-UHFFFAOYSA-N	447.382	1.997	50	20	IDGD	
C[C@@H]1CCCN(Cc2ccc(NC(=O)C(=O)NNC(=O)CNC(=O)c3ccco3)cc2)C1	784002886	WFTQIRNCIRZRNT-OAHLLOKOSA-N	441.488	1.027	50	20	IDGD	
CCOc1cc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)ccc1C	784213417	MJVKLDGXLSJHTM-UHFFFAOYSA-N	432.502	1.916	50	20	IDGD	
O=C(Cn1cc(NC(=O)C(=O)NNc2ccc(OCC(F)(F)F)cc2)cn1)NC1CC1	784370388	RDBSYKQAEJWIPI-UHFFFAOYSA-N	440.382	1.185	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNc2nccnc2Cl)cccc1S(=O)(=O)NC(C)(C)C	784780929	UFXXVAJSLYUGRB-UHFFFAOYSA-N	440.913	1.597	50	20	IDGD	
COC(=O)c1sccc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)C(F)F)cc1	784835711	UVTPAOBNUXSDJB-UHFFFAOYSA-N	433.414	1.613	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1cccc(NC(=O)C(=O)NNc2cccnc2Cl)c1	784837868	MJJZVURTMLNISH-UHFFFAOYSA-N	425.898	1.894	50	20	IDGD	
COCCN1C(=O)CCc2cc(NC(=O)C(=O)NNc3cc(F)cc(OC)c3)ccc21	785237626	VMEDDDRVVLZFBM-UHFFFAOYSA-N	430.436	1.842	50	20	IDGD	
COc1ccnc(NNC(=O)Nc2cnc(N3CCN(C(=O)OC(C)(C)C)CC3)nc2)n1	786188118	URJIDKKTVCWHCZ-UHFFFAOYSA-N	445.484	1.481	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)C(=O)Nc1cc(Cl)ccc1OCC1CCC1	786413644	DZWCALLJHFGFTP-GFCCVEGCSA-N	443.909	1.040	50	20	IDGD	
CN1CCC(n2ccc(NC(=O)C(=O)NNC(=O)CC34CC5CC(CC(C5)C3)C4)n2)CC1	787541904	XZKVHAJLICKWDO-UHFFFAOYSA-N	442.564	1.842	50	20	IDGD	
COc1ccc(OC)c([C@@H]2C[C@@H]2C(=O)NNC(=O)c2csc(N3CCOCC3)n2)c1	788092801	RYDDFEWFASYKPC-ZFWWWQNUSA-N	432.502	1.562	50	20	IDGD	
COc1ccccc1C(=O)N[C@@H](CCSC)C(=O)NNc1ccc(-n2ccnc2)nn1	788178673	SGFJGNYEHKTTSQ-HNNXBMFYSA-N	441.517	1.666	50	20	IDGD	
COc1cc(NNC(=O)Nc2ccc(S(=O)(=O)N3CCOCC3)cn2)ccc1Cl	788673165	YKDSRLVVEDGZHE-UHFFFAOYSA-N	441.897	1.913	50	20	IDGD	
CC(C)(C)OC(=O)N1CC2(C[C@@H]2C(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)C1	789210379	MDAFULCGTXZGET-CQSZACIVSA-N	436.896	1.361	50	20	IDGD	
CC(C)(C)OC(=O)N1CC2(C[C@H]2C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)C1	789284811	JGXDTRFGQCWZMM-HNNXBMFYSA-N	428.445	1.119	50	20	IDGD	
CCOC(=O)C1(CC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)CCC1	789818229	FJWPENLKHYXFNX-UHFFFAOYSA-N	438.550	1.189	50	20	IDGD	
O=C(NNc1cccc(F)c1[N+](=O)[O-])C(=O)Nc1ccc(CN2C(=O)CCC2=O)cc1	790998086	GNFQPBHJVDGSMT-UHFFFAOYSA-N	429.364	1.465	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N2CCO[C@@]3(CCO[C@H]3C)C2)cc1Br	792930807	AZICWKYKBBEBKQ-GTNSWQLSSA-N	428.283	1.692	50	20	IDGD	
N#Cc1ccc(OC2CCN(CC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)CC2)c(F)c1	796517339	WBGHYYIGSNIZNI-UHFFFAOYSA-N	441.419	1.910	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNC(=O)C(=O)Nc1cccc(C(F)(F)F)c1	797368839	HRPDBQLROJVDOK-UHFFFAOYSA-N	438.362	1.718	50	20	IDGD	
CCNc1ccc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1[N+](=O)[O-]	797668496	CIRGIJMVORLULH-QGZVFWFLSA-N	444.400	1.171	50	20	IDGD	
N#Cc1ccc(NNC(=O)C(=O)Nc2ccc3[nH]nc(C(N)=O)c3c2)c(C(F)(F)F)c1	799842136	YGIOBLQNMZALCK-UHFFFAOYSA-N	431.334	1.634	50	20	IDGD	
CSC[C@@H](C)C(=O)N1CCC(C(=O)NNC(=O)CCNC(=O)OC(C)(C)C)CC1	799844017	NAUYRLDUDFPPEJ-CYBMUJFWSA-N	430.571	1.286	50	20	IDGD	
Cc1c(I)cc([N+](=O)[O-])cc1C(=O)NNC(=O)Cc1cc[nH]n1	801152286	OLLIGMIYNLGZMZ-UHFFFAOYSA-N	429.174	1.235	50	20	IDGD	
COc1cccc(C2=NO[C@H](C(=O)NNC(=O)Nc3ccc(S(C)(=O)=O)cc3)C2)c1	802067186	OYZQVTHDVQRBIB-KRWDZBQOSA-N	432.458	1.445	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)N[C@H]2CCN(C(=O)Nc3ccccc3)C2)cc1	802498532	HWURIJXSLJCYRU-INIZCTEOSA-N	427.461	1.711	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)[C@@H]1CCCN1C(=O)C(F)(F)F	806863368	HGHGPBQECJKXOG-LBPRGKRZSA-N	436.456	1.760	50	20	IDGD	
COC(=O)c1scc(-c2ccc(C)cc2)c1NC(=O)C(=O)NNc1nccn(C)c1=O	807020822	RUNKQVBVENTVHE-UHFFFAOYSA-N	441.469	1.686	50	20	IDGD	
C=CCOc1ccc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1	807417532	ZZRMREOVOQJLGM-UHFFFAOYSA-N	432.502	1.646	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCC(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)cc1	810563250	AWZJNBNQSBJWMI-UHFFFAOYSA-N	438.456	1.587	50	20	IDGD	
COc1ccc(CNC(=O)NNC(=O)c2ccc(C(C)(C)C)cc2)cc1S(N)(=O)=O	812428802	ADPLETBKZRRYPK-UHFFFAOYSA-N	434.518	1.784	50	20	IDGD	
Cc1cnc(Br)c(NC(=O)C(=O)NNC(=O)COc2cc(C)ccc2C)c1	812980707	ZKZDSVJXXCORGJ-UHFFFAOYSA-N	435.278	1.934	50	20	IDGD	
Cn1ncc(C=NNC(=O)CN(Cc2ccccc2)S(=O)(=O)c2ccc(Cl)cc2)n1	814732339	IELQHIHRCVYLLG-UHFFFAOYSA-N	446.920	1.810	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2ccncc2)nnn1Cc1ccc(C(F)(F)F)cc1	815563432	BTWULLONLKLDIO-UHFFFAOYSA-N	447.377	1.448	50	20	IDGD	
CN(C)N(C(=O)c1ccn(-c2ccc(Br)cc2)n1)[C@H]1CCS(=O)(=O)C1	816776955	MOHYEPHWEGGEAO-AWEZNQCLSA-N	427.324	1.741	50	20	IDGD	
COc1cc(C(=O)NNC(=O)/C(=C\c2ccccc2)n2nnnc2C)cc(OC)c1OC	859244807	UWWPUHBZJAQBGG-MHWRWJLKSA-N	438.444	1.467	50	20	IDGD	
Cc1cc(F)ccc1S(=O)(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	874056711	ATDZGZLOFJGREW-UHFFFAOYSA-N	441.506	1.542	50	20	IDGD	
CCn1c(NNC(=O)c2ccc(F)c(S(=O)(=O)NC(C)C)c2)nc2ccccc2c1=O	914756207	MCZKUAAWFWSHPL-UHFFFAOYSA-N	447.492	1.999	50	20	IDGD	
O=C(NCCCN1CCc2ccccc2C1)NNC(=O)c1csc(N2CCOCC2)n1	914827926	JOQQJSUIBCQIJQ-UHFFFAOYSA-N	444.561	1.372	50	20	IDGD	
CC(C)(C)Cc1noc2nc(C3CC3)cc(C(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)c12	915617655	UISDCKVGVILLCZ-GFCCVEGCSA-N	434.518	1.885	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2cncc(C(=O)NNC(=O)c3cc(C)oc3C)c2)c(C)o1	915808157	MVOPBFFGLUVESJ-UHFFFAOYSA-N	439.428	1.651	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)NCc1nnc2ccc(C(F)(F)F)cn12	916222730	NMNRNBHGFMNXST-UHFFFAOYSA-N	432.366	1.848	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N[C@@H](C(N)=O)c1ccccc1	916233425	XHTNFNJFSLCEHQ-IAQYHMDHSA-N	435.278	1.773	50	20	IDGD	
CC(=NNC(=O)COc1ccccc1F)c1ccc(S(=O)(=O)N2CCNCC2)cc1	916300382	CGVYMHHINQMILO-UHFFFAOYSA-N	434.493	1.339	50	20	IDGD	
CC(C)Oc1ncccc1CNC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	916512167	XLSKWQNUJFCLHE-UHFFFAOYSA-N	440.548	1.912	50	20	IDGD	
CC[C@@H](C)C(=O)Nc1cccc(CNC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c1	916648152	CAAJYZWYYBVDDL-CQSZACIVSA-N	436.476	1.791	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)C(C)(C)C)CC2)cc1OC	917180252	KIKCZYJWYRFYPS-UHFFFAOYSA-N	427.523	1.298	50	20	IDGD	
O=C(NC1CC1)c1cccc(S(=O)(=O)NNC(=O)c2cc(Br)c[nH]2)c1	917732542	OQMPROBIUJAUAM-UHFFFAOYSA-N	427.280	1.293	50	20	IDGD	
COc1cc(-c2noc(CCC(=O)NNc3nnc(C)c(O)n3)n2)cc(Cl)c1OC	918319204	IXXYLVNWZZUMSO-UHFFFAOYSA-N	435.828	1.682	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)NCc1ccccc1-n1ccnc1	919920650	ICKODRUULACSSR-UHFFFAOYSA-N	447.543	1.915	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NCc2cccc(NC(=O)[C@H]3CCCO3)c2)cc1	920238352	VQHWYCFHWKUIRV-LJQANCHMSA-N	442.472	1.722	50	20	IDGD	
Cc1nn(Cc2ccc(F)cc2)c(Cl)c1C=NNC(=O)N[C@H]1CCS(=O)(=O)C1	920380209	HZLLHUVYKJQYBQ-AWEZNQCLSA-N	427.889	1.853	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)c1ccc(N2CCOCC2)cc1	920872550	UDTNCJHXBUYBGB-HNNXBMFYSA-N	446.529	1.632	50	20	IDGD	
O=C(NNC(=O)c1cncn1-c1ccccc1)N[C@@H]1CC(=O)N(c2c(F)cccc2F)C1	1116457328	NAQPCRAADKPANR-CYBMUJFWSA-N	440.410	1.900	50	20	IDGD	
Cc1nn([C@H]2CCS(=O)(=O)C2)c(Cl)c1C=NNC(=O)Cc1nc2ccccc2n1C	1248410442	GPFXFUBFZSLJQA-ZDUSSCGKSA-N	448.936	1.784	50	20	IDGD	
CC(C)(C)C(=O)N1CCC(NC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)CC1	1349823703	OORNXQMUHJNKDR-UHFFFAOYSA-N	439.538	1.463	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc4cccn4cn3)C2)C1	1778051645	NTYWYNBGUVZXFG-HNAYVOBHSA-N	435.322	1.951	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(C(F)(F)F)ccn3)C2)C1	1779663607	CYDJNGJQFGUZIL-DYVFJYSZSA-N	435.830	1.798	50	20	IDGD	
Cc1cc(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](F)Br)C2)no1	1780777512	UWNBADCMALNDBX-UKPHBRMFSA-N	432.290	1.730	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)c3cnn4ccncc34)CCO2)C1	1781230247	ROMMBXKGVZTZEP-ROUUACIJSA-N	426.304	1.409	50	20	IDGD	
O=C(c1cn2cc(F)ccc2n1)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781331423	KGTJRDJXTWTVDP-RHSMWYFYSA-N	443.248	1.607	50	20	IDGD	
O=C(c1cnc2ccc(F)cn12)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781333875	TTYFAWGYIQSLBB-PBHICJAKSA-N	443.248	1.607	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3c(O)cc(O)cc3O)C2)C1	1781818603	NAXRWXOARDBYIO-KPZWWZAWSA-N	443.294	1.420	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@]3(CN(C(=O)CCBr)CCO3)C2)nc2nccn12	1782351416	UGCVISVRDBACEY-SFHVURJKSA-N	436.310	1.266	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3c[nH]c4cccc(OC)c34)C2)C1	1782375539	KKJSJJSNPGPFEJ-VFNWGFHPSA-N	435.908	1.874	50	20	IDGD	
C[C@H](CC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2)c1ccccc1	1783280579	OPOQXIPUIUAYOL-HOYKHHGWSA-N	436.317	1.004	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ncc(Cl)cn3)CCO2)C1	1783343371	HLKWKXNTTKFJOW-BLLLJJGKSA-N	431.718	1.747	50	20	IDGD	
CCc1cc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](Br)CC)C3)C2)n(C)n1	1783349217	KAQQBQLGTNPLEJ-KDOFPFPSSA-N	427.343	1.600	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cc3c(s1)CCCC3)CCO2	1783935308	PSQLVIDBMLAMEN-QFIPXVFZSA-N	448.589	1.443	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cncc(O)c3)C[C@@H]21	1783973812	DFCKQKWMKJEFKC-APYUEPQZSA-N	426.311	1.412	50	20	IDGD	
CN(CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21)C(=O)c1ccccc1	1784347642	WQOPHMHANKWGEB-OVWQWFNUSA-N	425.888	1.273	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)c(Cl)c1	1785033025	HUTBIVAQEKPFDS-JOCHJYFZSA-N	442.708	1.086	50	20	IDGD	
CCCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)[C@H]2C1	1785075294	DSDMJDHHVQMUES-VGWMRTNUSA-N	431.961	1.898	50	20	IDGD	
CCN(CC)C[C@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCBr)[C@H]2C1	1786407088	FUSUUBGPDSZXKV-QAETUUGQSA-N	432.403	1.729	50	20	IDGD	
O=C(COCc1ccccc1)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21	1786709185	SLHGEESVVBLVSB-BZSNNMDCSA-N	439.350	1.968	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC1(c2ccc(NC(=O)CCc3cnc[nH]3)cc2)CCC1	1786807100	IPGKPAPDWJMFLS-UHFFFAOYSA-N	447.499	1.789	50	20	IDGD	
CC(=O)N[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21)c1ccc(F)cc1	1789699490	HNELCQCVXJWLTA-FUJDEKNSSA-N	443.878	1.517	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CC(=O)N(C4CCCC4)C3)C[C@@H]21	1789859109	YSTSCUMVCUWQAK-PTIUUAQKSA-N	439.984	1.775	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3cncnc3)C[C@@H]21)[C@@H](F)Br	1789922921	UMGWKODCTDBJEG-RZLSGREXSA-N	429.290	1.079	50	20	IDGD	
CCc1cnc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]3C2)s1	1789926411	WVEJTJXNAODHJI-XYJRDEOASA-N	434.331	1.989	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc[n+]([O-])c3)C[C@@H]21	1790961095	JEWZVFGICGXTAV-VGWMRTNUSA-N	426.311	1.087	50	20	IDGD	
Cc1nc[nH]c1CSCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]2C1	1791298154	FKRAMLPAGHLYFC-OBJOEFQTSA-N	435.377	1.735	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccc2c(c1)OCO2	1795313312	WMOIKNOUUNTLDJ-VPTLXERWSA-N	434.565	1.399	50	20	IDGD	
O=C(Cn1cccc([N+](=O)[O-])c1=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCBr	1795495049	RSBHNDFVHTXKDG-CLLJXQQHSA-N	441.282	1.180	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](CN)c1ccccc1	1795676997	WEQVKCCQKYGACJ-MDMSPXHWSA-N	438.366	1.492	50	20	IDGD	
C[C@H](NC(=O)c1cnccn1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCBr)C2	1798548163	CYQILPPVAZTNMA-FQUUOJAGSA-N	438.326	1.018	50	20	IDGD	
Cc1cc(F)cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)c1	1800367245	PVUZBOXYLQGFKM-BJWYYQGGSA-N	425.464	1.698	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3ccccc3o1)C2	1801011514	RNZJKSVPCFJDHT-VPTLXERWSA-N	428.489	1.009	50	20	IDGD	
O=C1COc2ccc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)C(Cl)Cl)cc2N1	1801017119	QJYSBQJOUBFYRY-QHBPRCKVSA-N	428.272	1.024	50	20	IDGD	
O=C(Cn1nccn1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](Br)Cc1ccccc1	1801570749	VNBPJNZNFAZZIA-XMTFNYHQSA-N	446.349	1.923	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1nn(C)c(C)c1Br)C2	1802279001	HLUBGDYUYNEUFD-YVECIDJPSA-N	447.761	1.997	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccn3cncc3c2)[C@H]1c1cccnc1)[C@H](O)CCl	1803142777	IZGXAUMNKKEIKC-UHOSZYNNSA-N	427.892	1.649	50	20	IDGD	
O=C(O)c1cc(C(=O)NC[C@H]2CCN(C(=O)C(Cl)Cl)[C@H]2c2cccnc2)ncn1	1804974281	RBXVNTQEZJGQRE-RISCZKNCSA-N	438.271	1.693	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC2(CCN(C(=O)c3c[nH]c(=O)cn3)CC2)C1	1805387305	IFPIISRXHKYKHI-CYBMUJFWSA-N	425.327	1.646	50	20	IDGD	
O=C(c1cnc2c(c1)CCNCC2)N1CCC2(CCCN(C(=O)[C@H](O)CCl)C2)CC1	1805526485	SNIMYOWJRHUJNX-LJQANCHMSA-N	434.968	1.214	50	20	IDGD	
O=C(COc1ccc(F)cc1)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1	1806475394	UFJJUJWQJTUQAW-QSFXBCCZSA-N	435.883	1.905	50	20	IDGD	
O=C1CC[C@@H](C(=O)NC[C@@H]2CCN(C(=O)[C@H](F)Br)[C@@H]2c2cccnc2)N1	1806641585	OYMTZNFPSNQDBB-VIRABCJISA-N	427.274	1.057	50	20	IDGD	
Cc1ccn2ncc(C(=O)NC[C@@H]3CCN(C(=O)[C@@H](O)CCl)[C@H]3c3cccnc3)c2c1	1808157758	BWPZTPCORMMHOB-VDGAXYAQSA-N	441.919	1.957	50	20	IDGD	
COC(=O)NCC(=O)N1CC[C@H](CNC(=O)[C@](C)(Cl)CCl)[C@@H]1c1cccnc1	1808315729	JSIHZOKOLMOCNY-QIIPPGSGSA-N	431.320	1.680	50	20	IDGD	
Cc1noc(N)c1C(=O)N1CC[C@H](CNC(=O)[C@@H](F)Br)[C@@H]1c1cccnc1	1808660780	CZMVFLFRHLEJJK-KWCYVHTRSA-N	440.273	1.970	50	20	IDGD	
O=C(C(=O)N1CCCC2(CCN(C(=O)c3ccc(B(O)O)cc3)CC2)C1)c1ccccc1	1808980287	MOQQZYWQJXGIOL-UHFFFAOYSA-N	434.301	1.094	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)c1cc2cccn2cn1	1809446931	RBYRMEGHAARDII-SNRMKQJTSA-N	427.892	1.649	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC2(CCCN(C(=O)[C@@H](O)c3ccccc3)C2)CC1	1809457418	GZYYBOPMYXIWGZ-NRFANRHFSA-N	430.549	1.324	50	20	IDGD	
CCc1cnc(C(=O)N2CCC3(CCCN(C(=O)c4cccc(B(O)O)c4)C3)CC2)s1	1809978324	ARTDKJIXYBFYPO-UHFFFAOYSA-N	441.362	1.544	50	20	IDGD	
O=C(/C=C/c1cccs1)N1CCCC2(CCN(C(=O)c3ccc(B(O)O)cc3)CC2)C1	1810001126	AWEQKTZOPLGJMD-CMDGGOBGSA-N	438.358	1.986	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2cc(=O)ccn2C)[C@@H]1c1cccnc1	1811367000	QURABDPMTTYYTM-AYBZRNKSSA-N	432.908	1.354	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)[C@@H](O)Cc1ccccc1	1812769405	XXIPGRPBBKJYBO-HAGHYFMRSA-N	431.920	1.291	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1	1813016917	IILYRIBFMKXYFZ-OYSTVDSJSA-N	449.935	1.443	50	20	IDGD	
Cc1cc[nH]c1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1816171347	DWNOZWQZDVMMAJ-MRXNPFEDSA-N	436.476	1.664	50	20	IDGD	
C[C@H](C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](F)Cl)sc2C1)[C@H]1SC(=N)NC1=O	1817121912	UIKGWKZXJFFTEO-ZRVLKLQWSA-N	433.918	1.392	50	20	IDGD	
C[C@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1)n1ccnc1	1822411965	GELNLCUBWKZFBQ-GDBMZVCRSA-N	430.513	1.233	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@H](O)CCl)CC2)c1cccc(-n2cncn2)c1	1823717805	FXPQYWIDOCQWJW-IUODEOHRSA-N	446.920	1.549	50	20	IDGD	
C=C(C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCC(=O)NN(C)C)CC2)C(F)(F)F	1825270597	SYNANPQFWKNHEH-JTQLQIEISA-N	433.456	1.547	50	20	IDGD	
CNc1nsnc1C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](Cl)COC)sc2C1	1825991294	IRFXUTMCCIXQCG-HTQZYQBOSA-N	430.943	1.516	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(C(N)=O)cc1)CC2	1826008781	HDOJOFRNPVKLED-OLZOCXBDSA-N	436.921	1.722	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(O)cc1)CC2	1826088691	JVIFWEATGRSIRL-CYBMUJFWSA-N	431.518	1.448	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)CNCP(=O)(O)O)CC1	1826800746	IOQWWYXUZSMWAL-JKSUJKDBSA-N	437.905	1.738	50	20	IDGD	
Cc1noc(C)c1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827056431	UXKHDVDFVPNKGO-FQEVSTJZSA-N	439.321	1.518	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cscn3)C2)C1	1830538995	YDFUULFOCIUEHN-CXAGYDPISA-N	446.367	1.173	50	20	IDGD	
COC(=O)[C@@H]1CC[C@H](C(=O)N2CCO[C@@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)C1	1830704930	CJIMIQHFDVGWAY-MRUHUIDDSA-N	444.956	1.297	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](NC(C)=O)C(C)(C)C)CCO2	1831082177	DPGGOEADMXBFQB-FIKGOQFSSA-N	445.988	1.401	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3c(C)nn(C)c3C)CCO2)C1	1831803286	BAWISBWLCCSMHQ-OXJNMPFZSA-N	426.945	1.514	50	20	IDGD	
Cc1onc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)CBr)C3)C2)c1C	1831972139	XQCROEGGBKWOCY-KZULUSFZSA-N	444.326	1.392	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3ccc(Cl)cn3)CC2)CC1)[C@@H](O)CCl	1833312598	RIHNUBRHMNJOMS-KRWDZBQOSA-N	429.348	1.520	50	20	IDGD	
CC(C)(C)c1cc(C(=O)N2CCC(N3CCC(NC(=O)[C@H](O)CCl)CC3)CC2)[nH]n1	1833312643	UQMDNNPYPQKIPP-QGZVFWFLSA-N	439.988	1.492	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(O)nc(Cl)c3)CCO2)C1	1833581385	RQHZKTOLPXXEHW-ACJLOTCBSA-N	432.304	1.528	50	20	IDGD	
Cc1cnn(CC(=O)NC2CCN(C3CCN(C(=O)[C@H](F)Br)CC3)CC2)c1	1834895324	RQWIMLLQWJSQDN-KRWDZBQOSA-N	444.349	1.454	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)c1ccc2n[nH]cc2c1	1834992577	AUERYBFVWIJLJO-LJQANCHMSA-N	433.940	1.348	50	20	IDGD	
O=C([C@@H](O)CCl)N1CCC(OC2CCN(C(=O)[C@H]3Cc4ccccc4CN3)CC2)CC1	1836717501	DJGZCIZVUXTGBF-RTWAWAEBSA-N	449.979	1.299	50	20	IDGD	
C[C@H](CC(N)=O)C(=O)N1CCC(OC2CCN(C(=O)CCBr)CC2)CC1	1836908269	WHGHJDMPNZDSQQ-CYBMUJFWSA-N	432.359	1.282	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)Nc1ccccc1)CCO2	1837341738	LAEKNSGLVSMCSP-HGHGUNKESA-N	439.940	1.197	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1	1838031683	CLMZKZPSRRMPJZ-MRXNPFEDSA-N	441.912	1.359	50	20	IDGD	
Cc1ccn(C)c1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)CBr)C2)C1	1838815504	HOSWSYSFRVCNEC-HNAYVOBHSA-N	442.354	1.435	50	20	IDGD	
CCSc1cccnc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1838847258	TXXRYGRKVYJBKK-MAUKXSAKSA-N	431.917	1.798	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cncc(F)c3)C2)C1	1839150928	CHTCDBLIJQBXTC-MSOLQXFVSA-N	434.295	1.527	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3ccc[nH]3)C2)C1	1839152369	XFVOFJNSPSDQNT-RTBURBONSA-N	432.348	1.640	50	20	IDGD	
C=C[C@H](O)C(C)(C)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2	1839153981	XGYHEPURMNYFKW-ZOCIIQOWSA-N	437.364	1.252	50	20	IDGD	
C[C@H](C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2)n1cccc1	1839154875	APMSLULRIBPVNC-AYOQOUSVSA-N	432.348	1.742	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(F)c3[N+](=O)[O-])CCO2)C1	1839356703	SPCVXYVSPZUIDV-IFXJQAMLSA-N	443.859	1.821	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)C3(F)CCCCC3)C2)C1	1840033496	HSPMZLDXBOFLKA-RHSMWYFYSA-N	435.334	1.899	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)c(C)n1C	1840034540	OLGAGQQNKBOZCJ-IFXJQAMLSA-N	442.354	1.495	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C=C/c3ccsc3)C2)C1	1840150266	IJOSKJYNFRCXKJ-CUKLOCQMSA-N	428.938	1.472	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)COc3ccc(C)cc3)C2)C1	1840151574	GRCSLFUVXNVJQT-NQIIRXRSSA-N	440.924	1.084	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)/C(C)=C/c3ccc(C)o3)C2)C1	1840153170	GQEKLNVICNEGQV-KJDCMORTSA-N	440.924	1.702	50	20	IDGD	
Cc1cc(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@](C)(Cl)CCl)C3)C2)no1	1840369100	BAYUQBOAAPJSQI-QZTJIDSGSA-N	434.320	1.218	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)Cc1ccco1)CCO2	1840472527	JRAWYGHSOASWBB-OXFYSEKESA-N	428.913	1.168	50	20	IDGD	
CCOC(=O)C(C)(C)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1840882094	FIEQBJQHLFOGAS-HXUWFJFHSA-N	432.945	1.297	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)c2c(Cl)cncc2Cl)C1	1840997327	ALKOCYJWHGMHSS-UHFFFAOYSA-N	428.320	1.578	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@@H](C)C(=O)N2CCCC23CN(C(=O)C(Cl)Cl)C3)cc1	1841369773	TVYVAASVEOXLDS-ZDUSSCGKSA-N	448.372	1.669	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)c2cc(C)on2)C1	1842497324	AWCCLSQWSYPDNT-UHFFFAOYSA-N	428.401	1.947	50	20	IDGD	
C[C@@H](C(=O)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1)c1ccc(Cl)cc1	1843010305	BDVSUFUHJBVRAA-OAHLLOKOSA-N	426.709	1.641	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)[C@@H](NC(C)C)C(C)C)C2	1843415823	RKRFSBWNCRSESA-LEBHPONQSA-N	430.553	1.346	50	20	IDGD	
CCOc1ccsc1C(=O)N1CC2(CCCN2C(=O)c2cnccc2C(=O)NN)C1	1844263244	JPDOIHRRERVBAI-UHFFFAOYSA-N	429.502	1.276	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@]13C[C@@H](CO1)N(C(=O)OC(C)(C)C)C3)C2	1845166093	ATBLJEWOCWVQHT-GXZWQRSESA-N	441.956	1.986	50	20	IDGD	
CN1N=C(C(=O)N2CC3(CCCN3C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)CCC1=O	1845870412	KKOJMNXHVUDESL-OQLLNIDSSA-N	441.438	1.683	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCCC2)cc1)NNC(=O)COc1ccccc1F	15706807	ZONSOQXNEOIIJH-UHFFFAOYSA-N	449.504	1.769	50	20	IDGD	
CC(C)[C@H](NC(=O)COc1ccccc1)C(=O)NNC(=O)[C@H](C)Oc1ccccc1F	26534315	JNKPBZDYEVYFMI-YWZLYKJASA-N	431.464	1.960	50	20	IDGD	
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)NNC(=O)c1c[nH]c2ccccc12	28662176	WOPHVYXKROKUDK-SFHVURJKSA-N	437.456	1.489	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@@H](c2ccccc2)n2cccn2)cc1	109764413	PZELEPQMGXDURM-HXUWFJFHSA-N	441.513	1.249	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)c1cccc(S(=O)(=O)N(C)C)c1	727609131	HJHIOUCLEWMMDA-GFCCVEGCSA-N	435.462	1.550	50	20	IDGD	
O=C(CCN1C(=O)CCC1=O)NNC(=O)c1cn(-c2ccccc2)nc1-c1ccccc1	727940716	UGJHMQZETQISLJ-UHFFFAOYSA-N	431.452	1.839	50	20	IDGD	
CN(C)N(C(=O)c1ccc2c(c1)S(=O)(=O)c1ccccc1C2=O)[C@@H]1CCS(=O)(=O)C1	728178966	NEFRYBOPUQPQFV-CQSZACIVSA-N	448.522	1.170	50	20	IDGD	
CCOc1ccc(/C=C(\C#N)C(=O)OCC(=O)NNC(=O)Cc2nc(C)cs2)cc1	728720919	OCMMABUAQLYRGQ-OVCLIPMQSA-N	428.470	1.691	50	20	IDGD	
O=C(COCc1nc2ccccc2s1)NNC(=O)C1CCN(c2ncccn2)CC1	728847428	DYWUGFVFEONONB-UHFFFAOYSA-N	426.502	1.667	50	20	IDGD	
CC(C)(C)OC(=O)N1CCCC[C@@H]1C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	728889563	CEYWDEJXUQKOBV-MRXNPFEDSA-N	432.525	1.630	50	20	IDGD	
NC(=O)C1CCN(c2ncccc2CNC(=O)NNC(=O)c2cccc(Cl)c2)CC1	729229644	BASFUGMSCQLANW-UHFFFAOYSA-N	430.896	1.581	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)NCc2ccco2)cc1Br	729343538	XKJMKFJHMQTSIC-UHFFFAOYSA-N	445.295	1.437	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)N(C)C1CC1	729617676	SIGFYYXWRUAFCD-HNNXBMFYSA-N	437.566	1.288	50	20	IDGD	
Cc1cccc(-c2nnc(S)n2CCC(=O)NNC(=O)COc2ccccc2O)c1	730835311	FSXHIKPQFMYNLQ-UHFFFAOYSA-N	427.486	1.864	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)c2nnn(-c3ccc4c(c3)OCCO4)c2C)c1	731453853	QQPZGHDJDLODPH-UHFFFAOYSA-N	439.428	1.439	50	20	IDGD	
COc1ccc(Cl)c(S(=O)(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)c1	732747568	QXMJNLRKKFBIEF-UHFFFAOYSA-N	446.938	1.573	50	20	IDGD	
CCc1cc(N2CCC[C@H](NC(=O)NNC(=O)c3nnc(O)c4ccccc34)C2)ncn1	732913618	BSHGVEFQGJDGFY-AWEZNQCLSA-N	436.476	1.301	50	20	IDGD	
O=C(NCCNC(=O)c1c(F)cccc1F)NNC(=O)c1cc(Br)c[nH]1	732992788	ZXOKMYPWAJODAN-UHFFFAOYSA-N	430.209	1.429	50	20	IDGD	
COc1ccc([C@H]2[C@@H](C(=O)NNC(=O)COCc3ccccc3)CCC(=O)N2C)cc1	737634939	QHQBLMJUZMIBMS-UGKGYDQZSA-N	425.485	1.969	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COCc2ccccc2)cc1S(=O)(=O)NC(C)C	737635256	XBDQDTULOOQLIO-UHFFFAOYSA-N	435.502	1.360	50	20	IDGD	
O=C(NNc1ncnc2[nH]cnc12)[C@H]1CCCN1C(=O)c1ccc(Br)cc1	740746577	QVNUYKIWWVUCAS-GFCCVEGCSA-N	430.266	1.863	50	20	IDGD	
COc1ccc(S(=O)(=O)CCC(=O)NNc2nc(-c3cccnc3)no2)cc1OC	740825992	WJGFJKDCJNFBSE-UHFFFAOYSA-N	433.446	1.456	50	20	IDGD	
CS(=O)(=O)CC[C@H](Cc1cccc(Br)c1)C(=O)NNC(=O)c1ccc[nH]1	741207524	FZHZWNQMPNWLIY-CYBMUJFWSA-N	442.335	1.832	50	20	IDGD	
O=C(CN1CCN(c2ncnc3ccsc23)CC1)NNC(=O)c1ccccc1Cl	741793952	PRWNCMYKCBPCFZ-UHFFFAOYSA-N	430.921	1.928	50	20	IDGD	
C[C@@]1(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)CCCN(C(=O)c2ccccc2)C1	742035231	CYBLMZKECVIICN-JOCHJYFZSA-N	433.472	1.366	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N[C@H]2CC(=O)N(CCOc3ccccc3)C2)cc1OC	743520141	DMDXBMISCULXJA-INIZCTEOSA-N	442.472	1.328	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NC[C@@H]2CCN(CC(F)(F)F)C2)cc1	743552746	WMUPWDWKEJAFJM-NSHDSACASA-N	437.444	1.310	50	20	IDGD	
CCN(C[C@@H]1CCN(Cc2ccccc2)C1)C(=O)NNC(=O)CNC(=O)c1ccco1	743576683	IWKDGFDTXHBNFJ-GOSISDBHSA-N	427.505	1.594	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCn3c(nnc3-c3ccccc3)C2)cc1OC	744427184	UKFPVAWOMQYWQQ-UHFFFAOYSA-N	436.472	1.239	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)[C@@H](C)N2CCN(c3ccc(F)cc3)CC2)c1	745055247	NUAKXAAOVZDYHM-QGZVFWFLSA-N	442.491	1.649	50	20	IDGD	
NC(=O)[C@H]1CCCN(CCCNC(=O)NNC(=O)c2cc3c(s2)CCCCCC3)C1	745833627	ZDNICFJSSMDPDA-INIZCTEOSA-N	435.594	1.939	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1cc([N+](=O)[O-])ccc1O)[C@@H]1CN(Cc2ccccc2)CCO1	745836632	UAJWEIVKSBNZFZ-KUHUBIRLSA-N	443.460	1.534	50	20	IDGD	
CN1CCC(=O)Nc2cc(C(=O)NNc3ccc(S(=O)(=O)NC4CC4)cc3)ccc21	746200488	KVZSHTDBZHAFES-UHFFFAOYSA-N	429.502	1.663	50	20	IDGD	
COc1cc(C)nc(NNC(=O)NC2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)n1	746746013	BFSCCDYOFIBRLM-UHFFFAOYSA-N	434.522	1.581	50	20	IDGD	
COc1cc(C(C)=NNC(=O)[C@H](C)CN2C[C@H](C)O[C@@H](C)C2)ccc1S(C)(=O)=O	747042495	QQTJZJMTESOGHK-ILXRZTDVSA-N	425.551	1.684	50	20	IDGD	
COc1ccc(Cn2ncc3cc(C(=O)NNC(=O)Cc4ccncc4)cnc32)c(OC)c1	747323774	PLVOODUDMAOKMS-UHFFFAOYSA-N	446.467	1.896	50	20	IDGD	
CC(C)(CO)[C@H](CNC(=O)NNC(=O)c1csc(N2CCOCC2)n1)c1ccccc1	747462839	KKWXDUOOFTXCAI-MRXNPFEDSA-N	447.561	1.726	50	20	IDGD	
CCc1nc(C)c(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)s1	747622196	KJVAEDIEQREELJ-UHFFFAOYSA-N	438.531	1.110	50	20	IDGD	
O=C(NCc1nnc2n1CCC2)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1	747981915	ZFKVBXLHOSCPPK-HXUWFJFHSA-N	445.527	1.682	50	20	IDGD	
CC(=O)N1CCN(S(=O)(=O)c2cccc(C(=O)NNc3ccc(F)cc3C)c2)CC1	748562588	JRMRETNZPZUJSZ-UHFFFAOYSA-N	434.493	1.744	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)[C@H](Cc2c[nH]c3cc(F)ccc23)NC(C)=O)c1	749330220	LWVFCPOMZQOOCG-FQEVSTJZSA-N	442.447	1.833	50	20	IDGD	
CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)NNC(=O)c1cccc(N(C)C)c1	749334458	GJMDMPQIXAAOEA-HXUWFJFHSA-N	425.464	1.881	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@@H](C)NC(=O)CC2CCCCC2)c2ccccc2c1=O	749837413	DNLQMMIRMUDBLZ-CQSZACIVSA-N	427.505	1.653	50	20	IDGD	
Cc1nc(S(=O)(=O)N2CCN(C(=O)NNC(=O)c3cc4ccccc4o3)CC2)cs1	750284122	BVYSZVRLGMXFQG-UHFFFAOYSA-N	449.514	1.559	50	20	IDGD	
C[C@H](NC(N)=O)C(=O)NNC(=O)c1ccc(CN2C(=O)c3cccc4cccc2c34)cc1	750551542	HIRVNSCQZPYFHO-ZDUSSCGKSA-N	431.452	1.818	50	20	IDGD	
CSCC[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)NNC(=S)N[C@H](C)C1CC1	751618658	IUXFBKNLRZDEOE-ABAIWWIYSA-N	439.563	1.740	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CN2CCN([C@@H](C(N)=O)c3ccc(Cl)cc3)CC2)c1	754235146	GHYAYCQGSXUFMI-HXUWFJFHSA-N	443.935	1.254	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)Nc2cccc(S(=O)(=O)N3CCOCC3)c2)cc1	755354581	QSPUZFNDAFSOBL-UHFFFAOYSA-N	448.501	1.248	50	20	IDGD	
CCC(=O)Nc1ccc(NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1	755913520	IXGPNKUMONLFAO-UHFFFAOYSA-N	447.517	1.817	50	20	IDGD	
Cc1nccc(NCc2cccc(C(=O)NNC(=O)CCN3C[C@H](C)O[C@@H](C)C3)c2)n1	757716253	TXBUHXXYYSAEBH-HOTGVXAUSA-N	426.521	1.657	50	20	IDGD	
CNS(=O)(=O)c1cccc(NC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)c1C	757726637	LYANTFODFTVDED-UHFFFAOYSA-N	444.473	1.261	50	20	IDGD	
Cc1c(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cnn1-c1ccccc1	757740727	QGVWHMBDHOELRY-UHFFFAOYSA-N	442.501	1.898	50	20	IDGD	
Cc1c(C(=O)NNC(=O)[C@H]2COc3ccccc3O2)cnn1CCO[C@H]1CCCCO1	758053174	FLWWEPXOURKPCB-MOPGFXCFSA-N	430.461	1.336	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)N[C@H]2CN(C(=O)OC(C)(C)C)C[C@H]2C#N)c1	758770522	LIGLZYWUXUHYBO-WBVHZDCISA-N	431.493	1.772	50	20	IDGD	
CN(NC(=O)c1cn(Cc2cccs2)nn1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758787594	TWZBNCPMNFTEBN-UHFFFAOYSA-N	449.537	1.637	50	20	IDGD	
CCCCn1ncc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1CC	758909739	TZVNKEXTJBHRAR-GOSISDBHSA-N	430.461	1.390	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CN2CCO[C@H](c3cccc(OC(F)F)c3)C2)c1	759365906	WNINVJIMQQKBJI-SFHVURJKSA-N	430.411	1.994	50	20	IDGD	
COc1ccc(OC)c(CCCNC(=O)NNC(=O)c2nnc(O)c3ccccc23)c1	759619045	PKNWJXJZNDFDKR-UHFFFAOYSA-N	425.445	1.929	50	20	IDGD	
CN(C)c1ccc2c(c1)N(C)C(=O)C2=NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	761829794	WFXDIQNMKDLLQU-UHFFFAOYSA-N	448.527	1.007	50	20	IDGD	
CC(=NNC(=O)CSc1nc(C)cc(C)n1)c1c(C)nn(CCS(C)(=O)=O)c1C	763120854	JYLKIPQHFBNYLO-UHFFFAOYSA-N	438.579	1.584	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(-c3ncco3)cc2)cc(OC)c1OC	763538490	CLPXAXPUSPPKLP-UHFFFAOYSA-N	440.412	1.767	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cc(C)n(-c3ccccc3)c2C)n(CCC#N)n1	763602136	OUZZKPYALODZTE-UHFFFAOYSA-N	433.472	1.912	50	20	IDGD	
CCNC(=O)N1CCc2ccc(NC(=O)C(=O)NNC(=O)COc3ccccc3F)cc21	763681253	OBXDNVFWGDOQAZ-UHFFFAOYSA-N	443.435	1.083	50	20	IDGD	
CN(C)c1nc2cc(NC(=O)C(=O)NNC(=O)CN3CCCc4ccccc43)ccc2o1	763727290	BMDHQSQLISLLHM-UHFFFAOYSA-N	436.472	1.433	50	20	IDGD	
CC(=O)N(C)c1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)cc1	763841368	QRELUCZAPCCYFW-OAHLLOKOSA-N	426.473	1.840	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(Br)c2)cn1	763883843	RJPFWHRYODVYNO-JTQLQIEISA-N	437.250	1.406	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)C(=O)Nc1cccc(N2CCN(CC3CC3)CC2)c1	763956715	VHNWRJSCZIXSJE-UHFFFAOYSA-N	435.528	1.927	50	20	IDGD	
NC(=O)c1n[nH]c2ccc(NC(=O)C(=O)NNC(=O)c3cccc(C(F)(F)F)c3)cc12	764036893	DEOOSIVWAXUBIX-UHFFFAOYSA-N	434.334	1.080	50	20	IDGD	
CC(=O)N1CCCc2cc(NC(=O)C(=O)NNC(=O)c3ccc(Cl)cc3O)ccc21	764116402	FQCIURFBLJPYPL-UHFFFAOYSA-N	430.848	1.744	50	20	IDGD	
CC[C@@H](C)NS(=O)(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)CC(C)(C)C)c1	764197880	ICHDCKHFAFSFMK-CYBMUJFWSA-N	426.539	1.427	50	20	IDGD	
COC(=O)c1ccc(C(F)(F)F)cc1NC(=O)C(=O)NNC(=O)c1scnc1C	764247186	OIRLZQJPUOSAIU-UHFFFAOYSA-N	430.364	1.657	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cccc3ncccc23)ccc1N1CCOCC1	764259998	MJUDODZCGZHJNG-UHFFFAOYSA-N	433.468	1.780	50	20	IDGD	
CCN(CC)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2O)cc1	764278307	VGZDERXTHVCARC-UHFFFAOYSA-N	428.445	1.039	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)C(=O)Nc1cccc(NC(=O)c2ccoc2)c1	764281604	ZSVXUANOZBNYRG-UHFFFAOYSA-N	436.424	1.956	50	20	IDGD	
Cc1noc(C)c1CSc1ncccc1C(=O)NNC(=O)CNC(=O)c1cccnc1	764343713	RGEWOBSJJCCAHL-UHFFFAOYSA-N	440.485	1.565	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cnc3c(c2)CN(C(=O)OC(C)(C)C)CC3)o1	764370640	GTJPCROTSBWSCE-UHFFFAOYSA-N	443.460	1.676	50	20	IDGD	
O=C(NNC(=O)C(F)(F)Oc1ccccc1)C(=O)Nc1ccccc1O[C@H]1CCOC1	764379333	BXMJZYAUNOFAKV-AWEZNQCLSA-N	435.383	1.612	50	20	IDGD	
CC(C)Oc1cncc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1	764462986	IEORWVCWCLWQEL-UHFFFAOYSA-N	432.502	1.728	50	20	IDGD	
O=C(CCC(=O)N1CCN(c2ccccc2)CC1)NNC(=O)[C@H]1COc2ccccc2O1	764516736	UBCRTIGONPIPAR-HXUWFJFHSA-N	438.484	1.103	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)[C@@]1(F)CCN(C(=O)OC(C)(C)C)C1	765312903	GUPQKQHQFAEOST-LJQANCHMSA-N	432.493	1.788	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cn(Cc4ccccc4)nn3)CC2)cc1	765749804	UDQMGBISTMNMET-UHFFFAOYSA-N	447.543	1.214	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)Cc1ccc(S(=O)(=O)N2CCCC2)s1	766664252	ZPOLSLVHIYHQRQ-UHFFFAOYSA-N	443.572	1.622	50	20	IDGD	
CSc1cc(C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)ccc1F	767149922	DNDFWWPTWPEWFP-UHFFFAOYSA-N	439.538	1.636	50	20	IDGD	
Cc1nc(-c2ccccc2)ncc1C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	767625163	STCURKZZZQJOEN-IBGZPJMESA-N	448.435	1.596	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1cc2c(cc1F)NC(=O)CC2	768117722	NXCXCYLPCNAERP-UHFFFAOYSA-N	449.822	1.990	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)c1nccc2c(S(N)(=O)=O)cccc12	768461371	BRHXRWYFZYEFBV-UHFFFAOYSA-N	444.469	1.121	50	20	IDGD	
O=C(NNC(=O)c1cc(F)ccc1Br)NC1CCN([C@@H]2CCC[C@H]2O)CC1	769154484	KLPGDZPWWZQCSU-HZPDHXFCSA-N	443.317	1.910	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)c3ccc(S(=O)(=O)NC)nc3)n[nH]2)cc1	770245240	LCUDMEUMIMXYPH-UHFFFAOYSA-N	428.474	1.017	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)NCCN1C(=O)[C@@H]2[C@@H](C1=O)[C@H]1C=C[C@H]2C1	770545096	KRXRIEVYEWUQDY-HLNSEHPISA-N	446.891	1.245	50	20	IDGD	
Cc1nnnn1[C@@H](Cc1ccccc1)C(=O)NNc1nc(O)c2cnn(C(C)(C)C)c2n1	770965529	LBVHWGVOHIWBQA-HNNXBMFYSA-N	436.480	1.509	50	20	IDGD	
Cc1ccc(-n2cnnc2SCC(=O)NNc2nc(O)c3cnn(C)c3n2)cc1Cl	770971105	HBXAHGLASLJQAS-UHFFFAOYSA-N	445.896	1.847	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1cc(C)c(OCC(=O)N2CCCCC2)c(C)c1	772158581	LQTUFYTXXVAMRX-MRXNPFEDSA-N	433.505	1.797	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)c1ccc(N2CCOCC2)c(F)c1	772884459	MWZBGZBFBMJWSG-UHFFFAOYSA-N	434.855	1.393	50	20	IDGD	
CN(Cc1ccccc1)[C@H](CNC(=O)NNC(=O)CNC(=O)c1cccs1)C1CC1	773263338	CNOOBUDLCSHVPA-QGZVFWFLSA-N	429.546	1.719	50	20	IDGD	
O=C(NNc1ccccc1[N+](=O)[O-])C(=O)Nc1ccc(S(=O)(=O)C[C@H]2CCCO2)cc1	773651025	MOFQCDHMTUJHIG-CQSZACIVSA-N	448.457	1.629	50	20	IDGD	
COc1ccc(C(=O)N2CCN(C)CC2)cc1NC(=O)C(=O)NNc1c(F)cccc1F	773718066	IXYMJIJLWDOGNO-UHFFFAOYSA-N	447.442	1.443	50	20	IDGD	
CC(C)c1nccnc1NNC(=O)C(=O)Nc1ccc(S(=O)(=O)N2CCCC2)cc1	773992589	RZYQUGWWGJBYLD-UHFFFAOYSA-N	432.506	1.466	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1cnn(C[C@H]2CCCO2)c1	774002274	PIMZVMSQUPVKNU-BLLLJJGKSA-N	435.868	1.269	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN[C@H](C)c2cccc(S(=O)(=O)NC)c2)cc1C	775333058	DBPWZISDMSENTB-CYBMUJFWSA-N	438.575	1.639	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN[C@H](C)c2cc(F)ccc2N2CCC(O)CC2)n1	775355610	DRXUVQIMCGKOPV-CQSZACIVSA-N	449.552	1.592	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cnc3scc(C)n3c2=O)cc1Br	776321204	UVFUDZRKDCPMBB-UHFFFAOYSA-N	437.275	1.910	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN([C@H]2CCCN(S(=O)(=O)CBr)C2)C(=O)C1	776788125	JLNBWYORVPVDRA-LBPRGKRZSA-N	440.360	1.212	50	20	IDGD	
CC(C)CS(=O)(=O)N1CCC(NC(=O)NNC(=O)c2ccc3ccccc3n2)CC1	777765178	IBAMLXNSERXZFU-UHFFFAOYSA-N	433.534	1.629	50	20	IDGD	
CN1C(=O)c2cccc3c(S(=O)(=O)NNC(=O)CNC(=O)OC(C)(C)C)ccc1c23	777939280	KUQQOZGQMXDKFW-UHFFFAOYSA-N	434.474	1.264	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc(C(=O)N2CCOCC2)c(F)c1	778709821	LOMGWFKXNLBGET-UHFFFAOYSA-N	428.420	1.006	50	20	IDGD	
O=C(CCN1CCN(C(=O)[C@@H]2CCCO2)CC1)NNc1ccccc1OC(F)(F)F	779200863	JKTKTWJZKPFZTE-INIZCTEOSA-N	430.427	1.742	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)N[C@H]2CCN(c3cc(OC)cc(OC)c3)C2=O)c1	780842255	SUZQLTJADWEKSF-SFHVURJKSA-N	428.445	1.922	50	20	IDGD	
CC(C)(C)[C@H]1CCc2sc(C(=O)NNC(=O)NCCNC(=O)c3cc[nH]n3)cc2C1	780881119	ZXPCNQYBGCRIRH-ZDUSSCGKSA-N	432.550	1.996	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc(OC4COC4)cc3)n[nH]2)cc1	782118509	XYAAPUVANIBXRX-UHFFFAOYSA-N	435.440	1.562	50	20	IDGD	
Cc1cnc2c(S(=O)(=O)N3CCN(S(=O)(=O)CBr)CC3)cccc2c1	782411070	JZEPLXIHAKVJJE-UHFFFAOYSA-N	448.364	1.532	50	20	IDGD	
CNS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccc(Br)c(C)c2)cc1	783923057	LDNFNYMRHWSGBJ-UHFFFAOYSA-N	441.307	1.747	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)[C@@H]3CC=CC[C@@H]3C(=O)N3CCOCC3)n[nH]2)cc1	784345441	BGZMENPMIYMEON-MSOLQXFVSA-N	437.500	1.587	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)F)cc1)C(=O)Nc1cnn(-c2ccccn2)c1	784833713	RORSPSYNCDMAPA-UHFFFAOYSA-N	436.400	1.345	50	20	IDGD	
CC(C)(C)NC(=O)c1cccc(NC(=O)C(=O)NNc2cccc(S(C)(=O)=O)c2)c1	784842056	UOEYUCXCMYCHEZ-UHFFFAOYSA-N	432.502	1.700	50	20	IDGD	
CCOc1cc(N2CCN(C)CC2)ccc1NC(=O)C(=O)NNc1cccc(OC)n1	784846125	LFYXFLRRFCJFOI-UHFFFAOYSA-N	428.493	1.323	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)C(=O)Nc2ccc(S(C)(=O)=O)c(C(F)F)c2)c1	784851661	MSLZOKBTPFEHBS-UHFFFAOYSA-N	441.412	1.896	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNc2cccc(C(F)(F)F)n2)c(OC)c(OC)c1	784951917	CAIDKCKIFPVBJU-UHFFFAOYSA-N	442.350	1.986	50	20	IDGD	
COc1c(Br)cc(Cl)cc1NC(=O)C(=O)NNc1nccn(C)c1=O	785086285	LZZNWRCEXYVHDX-UHFFFAOYSA-N	430.646	1.287	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1ccc2c(c1)CCC(=O)N2C	785330466	HXUWQURTTPXUMJ-UHFFFAOYSA-N	446.485	1.090	50	20	IDGD	
CN(NC(=O)Nc1cnn(-c2ccccn2)c1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	785860039	ZCGJIQVKESNSHJ-UHFFFAOYSA-N	444.496	1.908	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)Nc2ccc(-c3cnn(C)c3)nn2)cc1	788786435	NBUHAELOSSXFNU-ZDUSSCGKSA-N	425.449	1.896	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)C(=O)Nc1nc2c(s1)CCCC2	789734551	DAFLBOJNKWJFKP-UHFFFAOYSA-N	425.511	1.413	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2cc(C(=O)O)c(OC)cc2Cl)c(OC)c1	790389385	LMEJJNLIPSAFHN-UHFFFAOYSA-N	444.849	1.687	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)cc(Cl)c1F	792266683	BSRIITFVKOVBKZ-AWEZNQCLSA-N	435.795	1.355	50	20	IDGD	
CC(CN1Cc2ccccc2C1)=NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	792631707	KYOYXCYHQSLZRP-UHFFFAOYSA-N	442.541	1.829	50	20	IDGD	
COC(=O)[C@H]1CC[C@H](C(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)CC1	797985270	RITSFRLPVWUSHD-SHTZXODSSA-N	426.514	1.602	50	20	IDGD	
Cc1onc(-c2cccc(Cl)c2Cl)c1C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O	798109359	QJTOIAMDWXIGBE-SSDOTTSWSA-N	435.289	1.656	50	20	IDGD	
C[C@H](Cn1ccc2ccccc21)C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	803794220	AOAOYRTZIPSKSX-QRWLVFNGSA-N	437.452	1.808	50	20	IDGD	
COC(=O)c1c(C)csc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccc(C)cc2)[nH]n1	806976137	GBJAHLZREFPBSC-UHFFFAOYSA-N	441.469	1.941	50	20	IDGD	
COc1cc(C(=O)NNC(=O)N[C@H]2CCN(Cc3ccccc3)C2)cc(OC)c1OC	807007967	SYNUUNGDQVTGKH-KRWDZBQOSA-N	428.489	1.931	50	20	IDGD	
C[C@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(NC(=O)C(=O)NNc3cccc(F)n3)cc2)C1	807392477	QAHBZPIICMEIPT-OKILXGFUSA-N	449.508	1.969	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)C(=O)Nc1c2c(nn1-c1ccccc1)CCC2	807428502	HGFYZABGCAOOLC-UHFFFAOYSA-N	429.444	1.419	50	20	IDGD	
CC[C@@H](C)N[C@@H](CNC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)c1ccco1	807439985	JJRQOBDXAYHGLB-CJNGLKHVSA-N	426.477	1.600	50	20	IDGD	
Cc1cc([N+](=O)[O-])ccc1NNC(=O)C(=O)Nc1ccc(N2C(=O)CCC2=O)c(C)c1	807456506	AXUKAFKRGXGZJD-UHFFFAOYSA-N	425.401	1.947	50	20	IDGD	
O=C1O[C@H](c2ccccc2)C[C@@H]1C(=O)N1CCN(S(=O)(=O)CBr)CC1	809750493	YASWGIJMYGHIGU-KGLIPLIRSA-N	431.308	1.117	50	20	IDGD	
COC(=O)Cc1occ(C)c1C(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12	809933204	VXQXCIPJEVAMSH-UHFFFAOYSA-N	426.429	1.669	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)c2c(Br)nnn2C)c1	810343635	NMPWOLKJOJUQPY-UHFFFAOYSA-N	433.060	1.424	50	20	IDGD	
O=C(NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12)c1cc2n(n1)CCO2	810541014	KRJRIIPGPGDYES-UHFFFAOYSA-N	430.424	1.109	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NC[C@]2(C)OCCc3sccc32)nc1	812550619	JSBHDJRPEBBOBS-SFHVURJKSA-N	439.563	1.944	50	20	IDGD	
CCn1ccnc1C(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	813364284	MHTMODURBWGDOX-UHFFFAOYSA-N	427.486	1.456	50	20	IDGD	
COc1cc(C(=O)NN=Cc2ccc(Cl)c(S(N)(=O)=O)c2)cc(OC)c1OC	814698720	PKOHNJYITKEIMV-UHFFFAOYSA-N	427.866	1.777	50	20	IDGD	
CN(C)c1ccc(Cl)cc1NC(=O)C(=O)NNc1ccccc1S(=O)(=O)N(C)C	815751480	AZDOLXUTWTYPLL-UHFFFAOYSA-N	439.925	1.738	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc2c(c1)CCCC2)NNC(=O)CNc1ccccc1	823328404	OFRZHJVOYVCMHT-UHFFFAOYSA-N	430.530	1.493	50	20	IDGD	
CNS(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)c2ccc(Cl)cc2Cl)cc1	906443194	JDOYUZLJMILTTF-UHFFFAOYSA-N	438.314	1.525	50	20	IDGD	
O=C(NCCn1ccnc1)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	915905590	VWPXPIJXOPCWOU-UHFFFAOYSA-N	431.456	1.286	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NN=Cc1ccc(O)c(O)c1	915915055	LOLPWGAWNYDOIW-UHFFFAOYSA-N	433.486	1.202	50	20	IDGD	
O=C(NNC(=O)c1ccccc1NC(=O)c1cccc(Br)c1)C(=O)NC1CC1	916127590	ONPZDBZZGIEJDY-UHFFFAOYSA-N	445.273	1.741	50	20	IDGD	
O=C(NCc1nnc2ccc(C(F)(F)F)cn12)NNC(=O)[C@@H]1COc2ccccc2O1	916222412	CHBFNDXBRFFZJP-ZDUSSCGKSA-N	436.350	1.419	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)NCc2cccc(NS(C)(=O)=O)c2)cc1OC	916246369	FLQHSWVKKRJOAM-UHFFFAOYSA-N	436.490	1.610	50	20	IDGD	
O=C(COc1ccc(OCc2ccccc2)cc1)NNC(=O)NC[C@H]1CCS(=O)(=O)C1	916375232	PJBYIEIVEINIQI-QGZVFWFLSA-N	447.513	1.410	50	20	IDGD	
CC[C@H](C)NC(=O)c1cccc(CNC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1	916477283	WZCFBVCYJNNTLS-LIRRHRJNSA-N	426.473	1.885	50	20	IDGD	
O=C(NCc1ccc(S(=O)(=O)N2CCCC2)cc1)NNc1ccc(-n2cccn2)nn1	916648045	TUXJINJMJKOCCI-UHFFFAOYSA-N	442.505	1.273	50	20	IDGD	
O=C(NNC(=O)c1ccnc(-n2ccnc2)c1)c1ccc(S(=O)(=O)N2CCCC2)cc1	916734671	KLYLJWLLRLHHIX-UHFFFAOYSA-N	440.485	1.127	50	20	IDGD	
O=C(Cc1ccc2ccccc2c1)NNC(=O)CN1C(=O)N[C@]2(CCc3ccccc32)C1=O	917195171	DTCVBJBABIDKIN-VWLOTQADSA-N	442.475	1.923	50	20	IDGD	
Cc1cc(Cl)ccc1S(=O)(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	917719670	KTOFKUCAOLLGRJ-UHFFFAOYSA-N	431.923	1.522	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)N[C@@H](C)c2cccc(NS(C)(=O)=O)c2)cc1C	918088158	XYYBEGCYVCDSJC-AWEZNQCLSA-N	447.517	1.705	50	20	IDGD	
Cc1cc(C)n2nc(C)c(C(=O)NNC(=O)c3ccc(Cl)c(S(N)(=O)=O)c3)c2n1	918203747	IJQFDZRMJLVQDC-UHFFFAOYSA-N	436.881	1.030	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2cccn2Cc2cccs2)ccc1Cl	918204107	RNPDXCLQXCQSNL-UHFFFAOYSA-N	438.918	1.974	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1C	918223895	MCRXLUIVTMJNPQ-UHFFFAOYSA-N	443.479	1.748	50	20	IDGD	
CC(C)Oc1ccc(NS(=O)(=O)CC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1	918398619	CZMKXCHOEIIPQC-SFHVURJKSA-N	449.485	1.203	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)CCc2ccc(S(=O)(=O)NC)cc2)o1	920272397	SQHGJTVWTYEFAE-UHFFFAOYSA-N	436.534	1.423	50	20	IDGD	
Cc1cc(N2CCN(C)CC2)ccc1NC(=O)NNC(=O)COc1ccccc1[N+](=O)[O-]	920930421	MFHUSDAJDNDEPZ-UHFFFAOYSA-N	442.476	1.887	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2cn(C)cc2C(F)(F)F)CC1	1160865257	LHXBWKSYUFPSIE-UHFFFAOYSA-N	446.455	1.132	50	20	IDGD	
CC(C)[C@H](C(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1)N1C[C@@H](C)O[C@H](C)C1	1318667451	FMSRJHYZKWCBAL-JFIYKMOQSA-N	440.585	1.915	50	20	IDGD	
COc1cc(C=NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)ccc1F	1319571171	GCHRNWGCUWXDKE-UHFFFAOYSA-N	449.504	1.938	50	20	IDGD	
Nc1cnnc(NNC(=O)c2cc(S(=O)(=O)N3CCOCC3)ccc2Cl)c1Cl	1319776176	FEMATTBYOPJNBC-UHFFFAOYSA-N	447.304	1.143	50	20	IDGD	
Cc1c(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cnn1C1CCCC1	1323148938	FOWSFYIUQRWQKO-GOSISDBHSA-N	428.445	1.451	50	20	IDGD	
CC(=NNC(=O)CCN1CCC(C)CC1)c1cccc(S(=O)(=O)N2CCOCC2)c1	1329072945	HILPSAGPVHGINP-UHFFFAOYSA-N	436.578	1.670	50	20	IDGD	
N#Cc1ccc(N2CCC[C@H](NC(=O)NNC(=O)c3cncn3-c3ccccc3)C2=O)cc1	1342037881	SSDGLCKHOPHVMO-IBGZPJMESA-N	443.467	1.884	50	20	IDGD	
Cc1cnc2c(C(=O)N3CC[C@]4(C3)CN(C(=O)[C@H](C)Br)CCO4)cnn2c1	1778529040	XGEFXUJTOKAKHS-UGSOOPFHSA-N	436.310	1.265	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cccn(C(F)F)c3=O)C2)C1	1779354336	DVOISZYXIARGLF-IBGZPJMESA-N	431.867	1.952	50	20	IDGD	
O=C(C/N=C/c1ccco1)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Br)C2	1779445631	IRVDDNYSORLHPM-SDJHHXBBSA-N	444.301	1.903	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccnn1CCOC)C2	1780702287	BHTWUYPFHNSDDG-WRWLIDTKSA-N	426.945	1.674	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)ncn1)C2)[C@H](F)Br	1780770385	LFURLSSLZIZMBV-PVXIVEMSSA-N	431.262	1.000	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1cnn(C)c1)C2	1782002197	OAEBJJCVXLRFRS-JCKWVBRZSA-N	427.343	1.260	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(C)n(C(F)F)n1)C2	1782173677	MIHGZHDVINFGBL-ZXYWRSMDSA-N	448.898	1.968	50	20	IDGD	
CSCC[C@@H](O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Br)C2	1782232271	DXAWIKVRGKNDKT-NFFDBFGFSA-N	441.363	1.305	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)c1ccccc1)CCO2	1783343925	XAOARCIYVPGEQF-FRQCXROJSA-N	425.323	1.723	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)CCc3ncccc3OC)CCO2)C1	1783872753	GVKKEGHFIPPPJU-MGPUTAFESA-N	425.913	1.107	50	20	IDGD	
Cc1cc(C)c(C(=O)N2CCO[C@@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)c(C)c1	1783936994	CGSGZHNNKSDOMQ-HSZRJFAPSA-N	430.549	1.428	50	20	IDGD	
CC#C[C@H](CC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2)c1ccc(O)cc1	1784016791	ZAQSCPGNKILMNE-LZNRXBQRSA-N	434.920	1.319	50	20	IDGD	
CN(C)c1c(F)cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]3C2)cc1F	1784092260	LQAYLZQRBKKSBN-SCTFDZSOSA-N	445.894	1.224	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cn3nnc4ccccc43)C[C@@H]21	1784615958	DPHIHYNWTWVUGM-FPXQBCRKSA-N	433.940	1.819	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)c1cnnc(Cl)c1	1785452719	COMCISKGUIFPGU-DJFWLOJKSA-N	435.681	1.414	50	20	IDGD	
C[C@H](Cn1cccn1)C(=O)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1	1786968405	QOJAEZMTMMDVDN-QGZVFWFLSA-N	446.316	1.647	50	20	IDGD	
Cc1oc2cc(O)ccc2c1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21	1787970222	YXYCSUQFRXLUDN-RPZXMPESSA-N	436.892	1.640	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21)c1cc(-c2ccncc2)[nH]n1	1788926519	LNWRKRHOKVVPPF-XEZPLFJOSA-N	438.315	1.869	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](CN)c3ccccc3)C[C@@H]21	1789865677	BDCZMBJIIGWSQI-ZZAJSIFASA-N	442.387	1.945	50	20	IDGD	
Cc1nc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]3C2)cs1	1791057071	NZNWWDSMRRREDG-WCUVEOEZSA-N	430.368	1.757	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)COc3ccc(F)cc3)C[C@@H]21	1791057441	DCCRFIGYGFUYSM-PYTWLRIVSA-N	443.313	1.968	50	20	IDGD	
COc1ccnc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](C)Br)[C@H]3C2)c1	1791058926	MIBFXLPZGISWSB-DUPGQFARSA-N	426.311	1.467	50	20	IDGD	
Cc1n[nH]c(C)c1CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]2C1	1791061596	YJENPQKQWAFAGK-AFCVYNCWSA-N	427.343	1.332	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)NC(=O)OC(C)(C)C)[C@H]2C1	1791157387	IYJDKGASXNYHHM-YXMSTPNBSA-N	431.961	1.897	50	20	IDGD	
C[C@@H](Cn1ccnc1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)CBr)C[C@@H]21	1791625412	SSDNRSZRWJIZQC-XAJHFOFHSA-N	441.370	1.530	50	20	IDGD	
COc1ccc(OCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@](C)(Cl)CCl)C3)cc1	1792725421	PGAHFSMLSHAHRE-ZZXMYQEDSA-N	445.343	1.900	50	20	IDGD	
Cc1noc(C)c1CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2	1794137925	RXTQULNLOBNXFU-NOXHYTERSA-N	432.290	1.504	50	20	IDGD	
Cc1nc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)ccc1F	1794663713	YRRZBBKDMMQPGN-BTTYYORXSA-N	426.452	1.093	50	20	IDGD	
Cc1ccc(OCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)CBr)C3)cc1	1795305180	BYFPLSBSNOTPMT-GGXPGOJBSA-N	439.350	1.994	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](F)Cl)C(C)(C)O	1796810777	AXAAOFAHDGGHNW-XVIXHAIJSA-N	435.924	1.823	50	20	IDGD	
COC1(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)CCC1	1796893163	MUJVDVHQEMVRLC-GSWMANSFSA-N	429.521	1.718	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(N2CCOCC2)n1)C(Cl)Cl	1797092135	GOXSZIMIULICDW-BTTYYORXSA-N	427.332	1.974	50	20	IDGD	
Cc1nc2ccncc2cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2	1797364234	XNCHYZGIJYTZEW-CCWDJLKJSA-N	447.333	1.926	50	20	IDGD	
CCn1nc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)CBr)C3)cc1C	1798230767	SCYAIXIUJGVUDV-OEYIWLLWSA-N	427.343	1.446	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c(c1)COC3)C2)[C@@H](F)Br	1799346975	HBZILOVXACFMOJ-QKPAOTATSA-N	427.270	1.611	50	20	IDGD	
CCOc1ccccc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnccc1C(=O)NN)C2	1799568835	KNFKDLGBVKPNMP-MUJYYYPQSA-N	437.500	1.649	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C1\C(=O)Nc3ccccc31)C2	1800759107	HTUSJTPHHKBVFD-UELPNOEYSA-N	448.317	1.395	50	20	IDGD	
CC(C)NC(=O)OC(C)(C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)Br	1800760054	YPIBGUJSPPNEBY-YIYPIFLZSA-N	448.358	1.273	50	20	IDGD	
COc1cccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)Br)C3)c1F	1801927395	QWMWDLDMZVFVAH-OVZMXSCWSA-N	429.286	1.821	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(-c3ccccc3)no1)C2	1802337583	POBQSXNDPDFQLG-BCDXTJNWSA-N	439.516	1.966	50	20	IDGD	
Cc1ccc(C(=O)NC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)cn1	1805459845	NJQMHBJTWMPKGP-AVRDEDQJSA-N	438.532	1.478	50	20	IDGD	
O=C([C@H]1CC(=O)N(C2CCCC2)C1)N1CCC2(CCCN(C(=O)[C@@H](O)CCl)C2)CC1	1805517400	HARBSGVTFMWQGW-WMZOPIPTSA-N	439.984	1.608	50	20	IDGD	
O=C(Cc1ccsc1)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1807559797	QOUMKQYOEYINNG-SIKLNZKXSA-N	449.341	1.385	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2cc(F)cn2C)[C@H]1c1cccnc1	1808872572	QCVAZFAVJHIBMV-IIBYNOLFSA-N	444.511	1.252	50	20	IDGD	
CCc1ccnc(C(=O)N2CCC3(CCCN(C(=O)c4cccc(B(O)O)c4)C3)CC2)c1	1809977880	KPCJRHUBOROFFD-UHFFFAOYSA-N	435.333	1.482	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)Cn2cncn2)[C@@H]1c1cccnc1	1812867594	SPEUGBNBODVCNG-NXNVCVFFSA-N	449.353	1.799	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)c(C)o1	1813070114	FGLTUMVVLJLRAX-XMSQKQJNSA-N	441.532	1.984	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CNC(=O)N(C)C)n[nH]1	1814566639	KLULVCVRUHWULT-AAEUAGOBSA-N	443.346	1.847	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2COc3ccccc3O2)[nH]n1)[C@@H](O)CCl	1814867142	GOQFOECDBOVKCL-ZQIUZPCESA-N	434.880	1.842	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3ccnc4c3OCO4)sc2C1	1821235881	VHFNRGXYWPKBTD-ONGXEEELSA-N	438.893	1.746	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cn(C(C)(C)C)nn3)sc2C1	1821638382	MVUPMRPRQPMIIR-GHMZBOCLSA-N	440.957	1.969	50	20	IDGD	
Cc1ccc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cccc(B(O)O)c2)CC3)c(C)c1	1822017853	DDHBHNCTENZWER-KRWDZBQOSA-N	449.341	1.979	50	20	IDGD	
CC(=O)NCC(C)(C)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1	1822998921	KVBBLERAENNDJX-SKDRFNHKSA-N	449.346	1.908	50	20	IDGD	
COC1(CC(=O)Nc2cc([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)CCC1	1823072914	NXEYGSOJQCSDOD-MRXNPFEDSA-N	434.541	1.734	50	20	IDGD	
C[C@]1(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)[nH]n2)CC1(F)F	1823397589	DCJXCAVOVYPWHX-IFXJQAMLSA-N	447.446	1.759	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCC([C@H]2CCCCN2C(=O)CN2CC(=O)NC2=O)CC1	1824968556	QDYUNLULQFMJMJ-OAHLLOKOSA-N	426.945	1.423	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)C13CC(C(=O)OC)(C1)C3)CC2	1826005054	ZHPCEJIBUFHWHM-QSMDCUAPSA-N	441.937	1.652	50	20	IDGD	
Cc1ccc(CC(=O)N[C@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)cn1	1826080776	YFFYQHUDHRQRLB-HNNXBMFYSA-N	444.561	1.374	50	20	IDGD	
CC(C)n1nccc1C(=O)N[C@@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1	1826087482	DZXDZYFCPQEUIS-CYBMUJFWSA-N	447.565	1.519	50	20	IDGD	
COC(=O)CCCCCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](O)CCl)CC2	1826232188	SZFVGOFEFKGKOI-WCQYABFASA-N	431.942	1.778	50	20	IDGD	
Cc1noc(C)c1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827051047	LZZIXHMXDKHGLS-FQEVSTJZSA-N	439.321	1.518	50	20	IDGD	
CC(C)[C@@H](S)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827055562	CZJFYFNXPGAJDO-VQTJNVASSA-N	432.395	1.554	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)n2)CC1	1827602733	UFNRKMBHRJITCT-HIFRSBDPSA-N	426.901	1.375	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(F)nc2)CC1	1829192050	NBZKAMXARAIKEH-FQEVSTJZSA-N	439.296	1.448	50	20	IDGD	
Cc1nccnc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1	1829437564	UHCUXNVIFTVJFE-FQEVSTJZSA-N	436.321	1.012	50	20	IDGD	
O=C(c1ccc(Cl)cc1F)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1	1830080400	XHDSPVYTVMGSQJ-YJBOKZPZSA-N	435.279	1.149	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CNc4ccccc43)C2)C1	1830359087	LIUCBOCXLZJXRG-VGSWGCGISA-N	435.952	1.917	50	20	IDGD	
O=C(Cc1ccc2ccccc2c1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1830724884	JEAOIBQTDMGFDE-NZQKXSOJSA-N	446.931	1.438	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(O)cn2)CC1	1831872035	LQDPKEFISFHKBI-IBGZPJMESA-N	431.537	1.394	50	20	IDGD	
O=C([C@@H](F)Cl)N1CCOC[C@]2(C1)CN(C(=O)C1(c3ccc(F)cc3)CC1)CCO2	1832386869	DNZLIMCRPPIGBU-APWZRJJASA-N	428.863	1.848	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)CNc3ccc(F)cc3)CC2)CC1)[C@@H](O)CCl	1833309056	KYYDATOWHHICPX-IBGZPJMESA-N	440.947	1.409	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)/C=C/c3cccc(O)c3)CC2)CC1)[C@@H](O)CCl	1833312381	SBYFRQSCWJCGCV-SGSXCFNPSA-N	435.952	1.577	50	20	IDGD	
COc1ncc(C(=O)N2CCO[C@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)cc1F	1833487291	GBTCRFXAFOIXSH-QGZVFWFLSA-N	436.267	1.103	50	20	IDGD	
Cc1ncccc1CCC(=O)NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1833747652	NODPYYKJJNSGAT-FQEVSTJZSA-N	436.984	1.494	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3nc(C)c(C)[nH]c3=O)CC2)CC1	1833939543	DRFZWFAVSWKJIA-QGZVFWFLSA-N	437.972	1.589	50	20	IDGD	
CC(C)c1cc(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)no1	1834304117	OXJUAIMQNRQAIJ-KRWDZBQOSA-N	426.945	1.583	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(F)cn3)CCO2)C1	1834480442	KZMWRPXHAZPXLX-KBXCAEBGSA-N	444.301	1.464	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)CCN3CCN(C)CC3)CC2)CC1	1834624923	PTFRMTDQAWUXOU-HXUWFJFHSA-N	442.048	1.213	50	20	IDGD	
COc1nccc(C(=O)N2CCC(N3CCC(NC(=O)[C@H](F)Cl)CC3)CC2)c1F	1835079837	VREJLFWCHHVWMH-INIZCTEOSA-N	430.883	1.949	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)c1cnnc2ccccc12	1835321960	KGFOWGAONJZRNU-FQEVSTJZSA-N	445.951	1.415	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@](C)(O)C(F)(F)F)CC2)CC1	1837018760	PFGZKCDSVCTTGX-YOEHRIQHSA-N	444.878	1.552	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)CC3CCOCC3)C2)C1	1837711391	GHDCBWZVSAHJDA-FQEVSTJZSA-N	428.602	1.111	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc(C(C)(C)C)cn3)C2)C1	1839144506	CDNUSIPHHANCIX-VFNWGFHPSA-N	438.956	1.862	50	20	IDGD	
C=CCSCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839199021	QIDDWOJQOBEJHE-HIFRSBDPSA-N	425.320	1.053	50	20	IDGD	
Cc1nc(C)c(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)o1	1840033872	SZOXIZODCALJEQ-DIFFPNOSSA-N	430.299	1.145	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3C[C@]3(F)Cl)C2)C1	1840036003	BYYYTGGBZMHHRX-UOVKNHIHSA-N	427.698	1.151	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(C)c3F)C2)C1	1840149768	ZPIHIEFYNHTOMT-OXJNMPFZSA-N	428.888	1.458	50	20	IDGD	
O=C(CSc1ccncc1)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840186894	QYDAVSYVNHAUBC-QGZVFWFLSA-N	434.345	1.434	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)C3CCSCC3)CCO2)C1	1840926332	JJZQTBMROVLDIW-GUYCJALGSA-N	435.384	1.369	50	20	IDGD	
O=C(c1cnc2cccc(Cl)c2c1)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843014870	KRWYFYUKZGGMQF-UHFFFAOYSA-N	449.703	1.699	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1cc(O)ccc1F)C2	1843416653	JUPUWPYBNUWKNP-ZMOGYAJESA-N	427.436	1.482	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2cccc3c2OCC3)C1	1843631293	YZOOIYPPDWYMBA-MFKUBSTISA-N	435.484	1.573	50	20	IDGD	
C[C@H](C(=O)N1CCCC12CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)C2)n1cncn1	1846601676	WQCXCZGUARHCQB-OUAKBRRNSA-N	426.427	1.928	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@](F)(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](O)CCl)C1	1847563902	RHEVNCNRPDSSJG-VPCSNGCSSA-N	447.935	1.527	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)CN(C)NC(=O)NCc2ccccc2)o1	1847904866	IWHHOVQIMAEZGE-OALUTQOASA-N	439.516	1.750	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)Cc1cnc[nH]1	1848100179	VWIIRBCRRHAFLN-KKUMJFAQSA-N	425.917	1.286	50	20	IDGD	
Cc1ccc(C(=O)NNc2nnc(C)c(=O)[nH]2)cc1S(=O)(=O)NCc1ccccc1	11548250	XLQRRTUCPLIFBG-UHFFFAOYSA-N	428.474	1.017	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)c1ccc2c(c1)C[C@H](C)N2S(C)(=O)=O	14842325	MNCMCOBXAXMYSW-LBPRGKRZSA-N	427.486	1.428	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)n(C)c1	16203370	LZEYMFIYYBPQDT-CYBMUJFWSA-N	440.497	1.423	50	20	IDGD	
CCCOc1ccc(C(=O)NNS(=O)(=O)c2ccsc2C(=O)OC)cc1OC	28790675	OUUCWJDVOYTIRO-UHFFFAOYSA-N	428.488	1.955	50	20	IDGD	
COc1ccc([N+](=O)[O-])c(C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)c1	60064506	DSTOEACWBVSBHK-UHFFFAOYSA-N	425.401	1.969	50	20	IDGD	
CCOc1ccc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)c3cnc[nH]3)cc2)cc1	725879496	IESWEGCKIMFFAI-UHFFFAOYSA-N	429.458	1.684	50	20	IDGD	
COCCCNC(=S)N(C)NC(=O)CSc1nnc(C)n1-c1ccccc1OC	726077289	VCIDGQBTQRFLLJ-UHFFFAOYSA-N	438.579	1.550	50	20	IDGD	
CC(=O)Nc1ccc(CC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)cc1	728213050	CLKHCYXNDDJDAK-UHFFFAOYSA-N	445.545	1.267	50	20	IDGD	
O=C(CN1CCN(CC(=O)NC2CCCCC2)CC1)NNC(=O)c1cccc(Cl)c1	728573322	MOBPEEYWMZOLEL-UHFFFAOYSA-N	435.956	1.168	50	20	IDGD	
Cc1[nH]c(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c(C)c1C(=O)OC(C)C	728890173	YUFIPHRCIYCXLK-UHFFFAOYSA-N	428.493	1.664	50	20	IDGD	
C#CCNS(=O)(=O)c1ccc(C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)cc1	728974589	VQEVREZTJBASEL-UHFFFAOYSA-N	443.453	1.351	50	20	IDGD	
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC[C@@H](C(=O)NNC(=O)NC2CCCCC2)C1	729297995	MZQKXZQMVQAMFO-CQSZACIVSA-N	426.543	1.090	50	20	IDGD	
CN(CC(=O)NNC(=O)CNc1ccccc1)C(=O)c1ccc(Br)s1	729513689	IUYJZBXLSKZMOT-UHFFFAOYSA-N	425.308	1.842	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Cc2cc[nH]n2)cc1S(=O)(=O)N1C[C@@H](C)C[C@@H](C)C1	730103004	UPNUIHLUDIXJSK-OKILXGFUSA-N	449.533	1.089	50	20	IDGD	
CCC[C@H](NC(=O)Cc1ccccc1)C(=O)NNC(=O)c1csc(N2CCOCC2)n1	732653940	QDLPYRVHAHNWRT-INIZCTEOSA-N	445.545	1.268	50	20	IDGD	
COc1cccc(C[C@@H](C(=O)NNc2nc3ccccc3c(=O)n2C)n2nnnc2C)c1	733260588	IZHXZVBDYJAROH-SFHVURJKSA-N	434.460	1.164	50	20	IDGD	
CC(C)N(C)S(=O)(=O)c1ccc(F)c(C(=O)NNc2nc3ccccc3c(=O)n2C)c1	733263184	MUZQAFDKCZQHTC-UHFFFAOYSA-N	447.492	1.858	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)NNC(=O)c1cc(Br)c[nH]1	733335828	DPMMQHXWZGSNTP-UHFFFAOYSA-N	432.238	1.252	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)C[C@@H]2CCc3ccccc32)CC1	735118531	WHYMVSBBGOGWRB-KRWDZBQOSA-N	429.546	1.581	50	20	IDGD	
CC(C)CNC(=O)N1CCC[C@H](CC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)C1	741284494	RFJTUSPDEYCTHB-MRXNPFEDSA-N	442.520	1.807	50	20	IDGD	
O=C(COC(=O)[C@@H]1CCCN(C(=O)COc2ccccc2)C1)NNC(=O)c1ccccc1	741372305	SGJJXROVHIKJEP-GOSISDBHSA-N	439.468	1.308	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCN([C@H](C)c2cccnc2)CC1	741789168	VTZNSZSRQDEBSN-OAHLLOKOSA-N	431.924	1.883	50	20	IDGD	
O=C(CN1C(=O)[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)NNc1c(F)cc(F)cc1Br	741978479	JOSYZSSWILVQMJ-JIQLLMHVSA-N	426.217	1.978	50	20	IDGD	
C[C@@H]1CCN(C(=O)NNC(=O)CNC(=O)c2cccs2)CCN1Cc1ccccc1	743578532	MCKDISULWCTDPM-MRXNPFEDSA-N	429.546	1.815	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)[C@H]1CC(c2cccc(F)c2)=NO1	744620750	NEANOPBLCAFYCR-GOSISDBHSA-N	448.476	1.483	50	20	IDGD	
C[C@](O)(C(=O)OCC(=O)NNC(=O)c1cccc(C#N)c1)c1cccc(C(F)(F)F)c1	745104610	NZOGXQSUUBATTG-LJQANCHMSA-N	435.358	1.789	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)[C@@H](c2cccc(F)c2)N2CCOCC2)c1	745425986	ZYBQQXVCQNXCJY-HXUWFJFHSA-N	440.431	1.075	50	20	IDGD	
CCSCC[C@H](C)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	745922182	AXCLDKKYKLADAJ-AWEZNQCLSA-N	444.579	1.183	50	20	IDGD	
C[C@@H](SCC(=O)Nc1ccc(F)cc1)C(=O)NNC(=O)Cc1cn2ccccc2n1	746552975	BOTFDKGNZOZILH-CYBMUJFWSA-N	429.477	1.924	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)NCc2cccc(CS(C)(=O)=O)c2)cc1	749192583	RGBMICIEBGMYLL-HNNXBMFYSA-N	449.529	1.928	50	20	IDGD	
C[C@@H](OC(=O)/C(C#N)=C\c1ccc(O)cc1)C(=O)NCCc1ccc(S(N)(=O)=O)cc1	754541460	ODQIRLACYATGSV-MTOJCTJASA-N	443.481	1.237	50	20	IDGD	
CC(=O)N[C@@H](Cc1c[nH]c2ccc(Br)cc12)C(=O)NNC(=O)Cc1cc[nH]n1	755282715	PVCSUYRJDGCAOY-INIZCTEOSA-N	447.293	1.091	50	20	IDGD	
CN1CCN(C(=O)c2ccccc2NC(=O)NNC(=O)c2ccc3c(c2)OCCO3)CC1	755623835	RDRWAWNPMDPHSB-UHFFFAOYSA-N	439.472	1.312	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2cc(OC)cc(OC)c2)c(Cl)cc1F	755959329	ZXSBSTSSSSJMAX-UHFFFAOYSA-N	446.840	1.906	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)Nc1cccc(COCCOc2ccccc2)c1	755981433	MPKLGTQBCZIOIN-KRWDZBQOSA-N	447.513	1.870	50	20	IDGD	
CC(C)CNC(=O)c1ccc(NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1	756016162	WPGANKRPXRTDOJ-UHFFFAOYSA-N	436.472	1.786	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)Nc1ccc(C(=O)NC2CCOCC2)cc1	757621765	RQAAVGOALJAQAG-UHFFFAOYSA-N	440.456	1.833	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c(C)n1	757684367	WRIJJFOAZZXZFL-UHFFFAOYSA-N	433.490	1.650	50	20	IDGD	
NC(=O)c1ccc(NC(=O)NNC(=O)COc2ccc(OCc3ccccc3)cc2)cn1	757699908	LQTQUVBGMCDYRI-UHFFFAOYSA-N	435.440	1.991	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)Nc2nnc(CC(F)(F)F)s2)c2ccccc2c1=O	757720883	NERWNADAUCRPSW-UHFFFAOYSA-N	427.368	1.356	50	20	IDGD	
O=C(NNC(=O)[C@@H](c1ccc(Br)cc1)N1CCCC1)[C@H]1CCS(=O)(=O)C1	758154965	MVCMDAULQBWTHG-DZGCQCFKSA-N	444.351	1.168	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)[C@@H]2COc3ccc(Br)cc32)c1	758656898	VHHZEMCTZOTGLB-OAHLLOKOSA-N	444.241	1.801	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)N[C@@H]2CN(C(=O)OC(C)(C)C)C[C@H]2C#N)cc1OC	758777772	PQUMFIMZQCXUCL-HUUCEWRRSA-N	447.492	1.797	50	20	IDGD	
CCCC(=O)N1CCCC[C@H]1C(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758786524	NDVUSUJOAMOCIZ-INIZCTEOSA-N	439.557	1.803	50	20	IDGD	
Cc1ccc(CNC(=O)NNC(=O)c2nnc(O)c3ccccc23)c(O[C@@H]2CCOC2)c1	758902241	SGWTULKHBSJRIT-OAHLLOKOSA-N	437.456	1.956	50	20	IDGD	
CC1(Cn2cc(C(=O)NNC(=O)COc3ccccc3Cc3ccccc3)nn2)COC1	759001119	UYTKNFBUNRKLBA-UHFFFAOYSA-N	435.484	1.745	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN([C@@H]2CCCN(CCI)C2)C(=O)C1	759453407	WGWGWKBFHBIVKY-CYBMUJFWSA-N	437.322	1.965	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)c2cc(F)c(F)cc2I)n1	760293553	YRHTWSDSBTVVQS-UHFFFAOYSA-N	434.184	1.844	50	20	IDGD	
Cc1nn(CC(F)F)c(C)c1C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	760799860	BFSIHYOIENWVDW-UHFFFAOYSA-N	434.491	1.738	50	20	IDGD	
O=C(NNc1ccc(OC(F)(F)F)cc1)c1ccc(S(=O)(=O)N2CCOCC2)o1	761600337	VQRZCISDLRGRSZ-UHFFFAOYSA-N	435.380	1.956	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)[C@@]23CCC(=O)N2c2ccccc2S3)n1	761611465	QYLCSFZYLKMRPG-IBGZPJMESA-N	446.510	1.314	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)c1	761790223	KCOSFVVJHHIALT-IBGZPJMESA-N	426.473	1.839	50	20	IDGD	
O=C(NC[C@H](O)c1ccc(Cl)c(F)c1)NNC(=O)c1csc(N2CCOCC2)n1	762530524	YQMLGGRXJVRNIO-AWEZNQCLSA-N	443.888	1.450	50	20	IDGD	
Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)C(=O)NNC(=O)c1ccncc1	763461790	DTVAERSCUUOFJU-IBGZPJMESA-N	447.499	1.433	50	20	IDGD	
O=C(NNC(=O)c1ccccn1)C(=O)Nc1cccc(COc2ccc3c(c2)OCO3)c1	763463362	GXADMDLRKVNGSB-UHFFFAOYSA-N	434.408	1.789	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(F)c(C(=O)N(C)C)c2)c2ccccc2n1	763615700	OYLLSXIDXPTRSW-UHFFFAOYSA-N	437.431	1.784	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cnc(Br)c(C)c1	763664132	RFOATNRIUWUHSC-UHFFFAOYSA-N	437.250	1.326	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)C(=O)N2C[C@@H](C)Oc3ccccc32)c2ccccc2c1=O	763790627	MAXVCOULQJRWRN-CQSZACIVSA-N	449.467	1.553	50	20	IDGD	
COC(=O)[C@H](C)Cc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C)cc2)cc1	763821407	PKSKKHHQXNQHMF-OAHLLOKOSA-N	427.457	1.512	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccn(-c2ncccc2F)n1	763857279	MIEVTKAHQWPJMM-NSHDSACASA-N	430.371	1.099	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2c(C)cc(Cl)cc2C)n(CCC#N)n1	763876454	DDTIMMHOBZGIJD-CQSZACIVSA-N	446.895	1.929	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccccc2-n2ccc(C)n2)cc1	763876469	DMGNCZYVUYCYEB-INIZCTEOSA-N	449.467	1.937	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccccc1C(=O)N1CCCCC1	763920416	JPEMIOTWANOIPP-UHFFFAOYSA-N	426.448	1.780	50	20	IDGD	
CC(C)Oc1c(F)cc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1F	764006010	IBHIOSQCGDJWAS-UHFFFAOYSA-N	435.383	1.923	50	20	IDGD	
CN1C(=O)COc2ccc(NC(=O)C(=O)NNC(=O)c3cccc(C(F)(F)F)c3)cc21	764039851	AQJDZFRZLDFZGH-UHFFFAOYSA-N	436.346	1.460	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)ccc1N1CCSCC1	764166896	FYSTXHQPOQERQN-LJQANCHMSA-N	440.525	1.638	50	20	IDGD	
Cc1conc1NC(=O)C(=O)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1	764178780	JLCMMIMYRCANEW-IBGZPJMESA-N	433.468	1.696	50	20	IDGD	
CCS(=O)(=O)c1cc(F)ccc1NC(=O)C(=O)NNC(=O)CCCc1ccccc1	764226689	QNDFNUVJURUBJS-UHFFFAOYSA-N	435.477	1.728	50	20	IDGD	
COCCOc1ccc(C#N)cc1NC(=O)C(=O)NNC(=O)Cn1ccc2ccccc21	764239556	OPFBAXNEWCTCRX-UHFFFAOYSA-N	435.440	1.324	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cccc1N1CCOC1=O	764344102	ZIKOJIYYVFXAEH-UHFFFAOYSA-N	448.439	1.537	50	20	IDGD	
CCOC(=O)c1c(CC(C)C)csc1NC(=O)C(=O)NNC(=O)Cc1ccncc1	764355795	JCVZLVCSPRKSIL-UHFFFAOYSA-N	432.502	1.847	50	20	IDGD	
COc1ccc(OC(F)F)c(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)c1	764401952	UITDJQCZZACZRG-UHFFFAOYSA-N	441.412	1.880	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1cccc(C(F)(F)F)c1	765733735	QYLOAPWNLALXBR-UHFFFAOYSA-N	434.418	1.924	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)c1cc(F)ccc1NS(C)(=O)=O	768627872	IEDDRAVMRAYOOW-UHFFFAOYSA-N	431.467	1.366	50	20	IDGD	
CNc1nc(C(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)cs1	769470383	DLGLJWJKKGEAMA-UHFFFAOYSA-N	434.485	1.961	50	20	IDGD	
O=C(COCc1ccccc1)NNS(=O)(=O)c1sc(C(=O)O)cc1Br	769631484	VOFZIKUBXHAWOG-UHFFFAOYSA-N	449.304	1.735	50	20	IDGD	
CC(C)N1CCC(N2CCN(C(=O)NNC(=O)c3cnn(-c4ccccc4)c3)CC2)CC1	771216526	PPOQXSKXQWDKOX-UHFFFAOYSA-N	439.564	1.717	50	20	IDGD	
C[C@]1(c2ccc(Br)cc2)NC(=O)N(CC(=O)NNC(=O)C2CCCC2)C1=O	771249030	DZWMBIZZUPSAFN-GOSISDBHSA-N	437.294	1.554	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1cccc(S(=O)(=O)N(C)c2ccc(C)cc2)c1	771875788	UKMHRZYOVVZTPB-OAHLLOKOSA-N	447.513	1.923	50	20	IDGD	
Cc1nc(COc2ccccc2C(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)no1	772884842	PTZLMQAFZLXZPG-UHFFFAOYSA-N	443.847	1.688	50	20	IDGD	
COc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NNc1ccc(C(F)(F)F)cn1	773666803	GTRUMLHSANQFJH-UHFFFAOYSA-N	425.367	1.893	50	20	IDGD	
CN(C1CC1)S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2cnc3ccccc3n2)cc1	773716512	KSPXRDIKNRZDAQ-UHFFFAOYSA-N	440.485	1.495	50	20	IDGD	
COC(=O)CNC(=O)Cc1ccc(NC(=O)C(=O)NNc2cccc(Cl)c2C)cc1	773767684	CBRMVFRVVYQFHU-UHFFFAOYSA-N	432.864	1.562	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN[C@@H](C)c2cccc(S(=O)(=O)NC)c2)cc1C	775333061	DBPWZISDMSENTB-ZDUSSCGKSA-N	438.575	1.639	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)NCCC(=O)NNc2ccc(C(F)(F)F)cn2)cc1	776262877	AUFAMFLQWQMASY-UHFFFAOYSA-N	445.423	1.871	50	20	IDGD	
COc1cc(NC(=O)NNc2cccc(S(C)(=O)=O)c2)ccc1S(=O)(=O)N(C)C	776479005	OLAPYMQEKTXVHD-UHFFFAOYSA-N	442.519	1.498	50	20	IDGD	
COCCO[C@@H]1COCC[C@H]1NC(=O)NNC(=O)c1ccc(-n2c(C)ccc2C)cc1	777278984	LSDYIZLJOFRLOL-WOJBJXKFSA-N	430.505	1.859	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)N1CCC(Oc2cncc(Cl)n2)CC1	777409291	WWPUMSCKVHBSKR-UHFFFAOYSA-N	429.868	1.984	50	20	IDGD	
COC(=O)Nc1ccc(S(=O)(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)cc1	777647859	FJCIJHOZFUICIH-UHFFFAOYSA-N	440.865	1.144	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)Cc2ccc(S(=O)(=O)C(F)F)cc2)nc1C	778421585	NZJUMBZCKYBDDH-UHFFFAOYSA-N	428.417	1.644	50	20	IDGD	
COC[C@@H](C)n1ccc(NC(=O)C(=O)NNC(=O)c2ccc(OC(C)C)c(OC)c2)n1	778709893	MYGALAVVWCFRDU-CYBMUJFWSA-N	433.465	1.286	50	20	IDGD	
COc1ccc(Cn2cc(C(=O)NNC(=O)CCN3C[C@H](C)O[C@H](C)C3)cn2)cc1OC	779370556	HZNRWBKAEMGXAS-IYBDPMFKSA-N	445.520	1.209	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(\C#N)C(=O)N2CC(n3cc(C(=O)OC)nn3)C2)c1C	779550932	YSPCYYARSFVCRC-NOICUEDQSA-N	426.477	1.681	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2c[nH]nc2-c2ccsc2)ccc1Cl	780174203	XKAZOYPZLXQNOA-UHFFFAOYSA-N	425.879	1.514	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNS(=O)(=O)c1ccc(NC(C)=O)c(Br)c1	780389898	VJHOTWSHEAHSAF-UHFFFAOYSA-N	449.327	1.022	50	20	IDGD	
COc1cccc(NNC(=O)CN2C(=O)N[C@](C)(c3ccc(Br)cc3)C2=O)n1	780770822	WFTNCTFRIVDNND-GOSISDBHSA-N	448.277	1.763	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNS(=O)(=O)c1ccccc1-c1ccno1	782258720	OGVIASIPWQBMDS-UHFFFAOYSA-N	434.861	1.621	50	20	IDGD	
Cc1ccc(C)c(NNC(=O)C(=O)Nc2cnn(CC(=O)N3C[C@H](C)O[C@@H](C)C3)c2)c1	783361308	DWZVIZATEFMAQQ-HOTGVXAUSA-N	428.493	1.218	50	20	IDGD	
O=C(NNc1cc(Cl)ccc1Cl)C(=O)Nc1ccnn1[C@@H]1CCS(=O)(=O)C1	783369857	SHYKJRNVQOIIMP-SNVBAGLBSA-N	432.289	1.631	50	20	IDGD	
CC(C)c1cc(Br)ccc1NC(=O)C(=O)NN[C@@]1(C)CCS(=O)(=O)C1	783426005	FMJWHDATTXKEMU-INIZCTEOSA-N	432.340	1.709	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2ccc(CN3CCc4ccccc43)cc2)CCS(=O)(=O)C1	783427098	PRTBSGZNTOGVOI-QFIPXVFZSA-N	442.541	1.386	50	20	IDGD	
O=C(NNc1ccc(C(F)(F)F)nn1)C(=O)Nc1cnn(-c2cnc3ccccc3n2)c1	784887836	MBACLEMVDFOCHC-UHFFFAOYSA-N	443.349	1.706	50	20	IDGD	
CCNC(=O)N(C)NC(=O)C(=O)Nc1ccc(S(=O)(=O)N(C)C2CCCCC2)cc1	784916550	QPFGIHGUYKHYBV-UHFFFAOYSA-N	439.538	1.271	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNc2ccnc(N(C)C)n2)cc(OC)c1Br	784971012	PUNNIVFBDKMCLF-UHFFFAOYSA-N	439.270	1.404	50	20	IDGD	
C[C@H](OC(=O)/C(C#N)=C/C1CC1)C(=O)Nc1cccc(S(=O)(=O)N2CCOCC2)c1	786679127	WYFASRYWMIRRSM-LUYJPIOASA-N	433.486	1.438	50	20	IDGD	
CCc1c(C(=O)OCC(=O)NNC(=O)c2ccccc2)nnn1Cc1ccc(F)cc1	787165738	KCLHCKBFIZRGJA-UHFFFAOYSA-N	425.420	1.646	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)C(=O)Nc1ccc(Cl)cc1-n1cccn1	788332419	FGVKIHSINMXYSO-UHFFFAOYSA-N	427.848	1.828	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)C(=O)Nc1cccc2ccn(C)c12	788338636	YIDYVUMPLRHHQR-UHFFFAOYSA-N	442.501	1.180	50	20	IDGD	
CCc1nn(C)c(CC)c1CC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	790117162	VWVAWTUDKUEXRK-UHFFFAOYSA-N	447.561	1.333	50	20	IDGD	
CCCCOc1cc(OCCC)ccc1C(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1	790490916	FSTPIFQIQHKIMP-AWEZNQCLSA-N	427.523	1.785	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Nc2cc([C@H]3CCCOC3)nn2C)cc(OC)c1OC	790546054	KJXHNRFSPBPPRH-LBPRGKRZSA-N	433.465	1.806	50	20	IDGD	
COc1ccc(Cn2nccc2NC(=O)C(=O)NNc2ccc3c(=O)[nH]ccc3c2)cc1	793070107	NCZWTFJPTGAHNQ-UHFFFAOYSA-N	432.440	1.863	50	20	IDGD	
COC[C@H](CO)NC(=O)/C(C#N)=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	794100397	DUTZUEUJQUNEBE-AAKUMTKESA-N	431.880	1.109	50	20	IDGD	
CC[C@H](C)[C@H](NC(C)=O)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	794740753	HUFBFGLMKHPARD-KSSFIOAISA-N	438.550	1.173	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H]2CN(CC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)CC[C@H]21	795098637	DXUWYJKSHNYLBC-NVXWUHKLSA-N	447.492	1.687	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@@H]2C(=O)NNC(=O)CNc2cccc(OC)c2)cc1	799098507	MEZLCZPLMZLSCZ-LJQANCHMSA-N	426.473	1.568	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)NCCCNC(=O)/C=C\c2ccccc2)c1	800073343	QRMGXUDTFBUUFC-KTKRTIGZSA-N	426.473	1.868	50	20	IDGD	
O=C(NCc1ccsc1Br)NNC(=O)c1csc(N2CCOCC2)n1	800983291	FKPXSXDDAALOAW-UHFFFAOYSA-N	446.352	1.948	50	20	IDGD	
COc1nnc(NC(=O)NNC(=O)c2nn(CCC(C)C)c(=O)c3ccccc23)s1	801746544	YZNBIOURIPFKBQ-UHFFFAOYSA-N	431.478	1.769	50	20	IDGD	
COc1nnc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)s1	801748435	AOBGGXJAPVNLQK-UHFFFAOYSA-N	440.507	1.188	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cccc(C(C)(C)O)c2)cc1	806975427	YQCQWXRZHWVYCA-CQSZACIVSA-N	427.457	1.670	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)NC[C@H](c1cccs1)N1CCOCC1	806993733	HOTPVIRTRJJOTB-OAHLLOKOSA-N	428.518	1.722	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)[C@H](c2cnn(C)c2)N(C)C(=O)OC(C)(C)C)c1	807117012	RSRFRKCHRSSYSB-INIZCTEOSA-N	445.480	1.143	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)[C@H](c1ccccc1)N(C)C	807399033	GYUIVHVULQCFMP-QFBILLFUSA-N	425.537	1.715	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)[C@H]1C[C@@H](c2ccccc2)OC1=O	809702907	ASSUQHLSGDUFBD-AEFFLSMTSA-N	445.497	1.455	50	20	IDGD	
Cc1nc2ccc(NC(=O)C(=O)NNC(=O)c3cc(-c4ccc(C)c(C)c4)[nH]n3)cn2n1	810387048	CSVZBDOAVABIIM-UHFFFAOYSA-N	432.444	1.444	50	20	IDGD	
NC(=O)c1ccc(NC(=O)C(=O)NNc2ccc(C(F)(F)F)cn2)c(OCC(F)F)c1	810388356	FYPGQMSMLSGIEH-UHFFFAOYSA-N	447.320	1.925	50	20	IDGD	
Cc1noc2nc(C3CC3)cc(C(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)c12	813468813	FJUYKCKFCGYBAC-UHFFFAOYSA-N	443.485	1.734	50	20	IDGD	
N#C[C@H]1CCCC(=NNC(=O)[C@@H](CC(=O)NN=C2CCC[C@@H](C#N)C2)N2CCOCC2)C1	814854994	COSKCZKSQYOZEC-FUHIMQAGSA-N	441.536	1.449	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H](CN2CCCC2)c2ccccc2)c1	816810489	NMYRUYVKVQOAPN-HXUWFJFHSA-N	444.557	1.578	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)CN2C(=O)N[C@@]3(C[C@H](C)CC(C)(C)C3)C2=O)cc1C	864001800	KGLSJDYGXXVFDH-QKFKETGDSA-N	444.532	1.966	50	20	IDGD	
O=C(C1CCN(S(=O)(=O)c2ccccc2C(F)(F)F)CC1)N1CC[C@H](B(O)O)C1	864234340	QGHLYFACOUIVEL-ZDUSSCGKSA-N	434.245	1.181	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2ccccc2I)C[C@@H](C)O1	912920952	GUGNOKDSDBLEAN-TXEJJXNPSA-N	431.274	1.552	50	20	IDGD	
CN1C(=C(C#N)C(=O)COC(=O)c2cc(S(=O)(=O)N(C)C)c[nH]2)N(C)c2ccccc21	915409847	QLOHUXBQCHYFBR-UHFFFAOYSA-N	443.485	1.312	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)[C@H]2CC(=O)N(Cc3cccc(C(F)(F)F)c3)C2)n1	915690962	YPQMEURNEYSYFJ-HNNXBMFYSA-N	437.422	1.715	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)Cc2c(C)[nH]c(-c3ccncc3)nc2=O)c1C	915790514	KGTXHFNFJLIHCF-INIZCTEOSA-N	435.484	1.915	50	20	IDGD	
CC(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1	916136287	KUOSPVHKYDAZNA-UHFFFAOYSA-N	438.531	1.237	50	20	IDGD	
CCN(CC)C(=O)c1ccc(CNC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])cc1	916389670	MWCRAHZTIDGVPJ-UHFFFAOYSA-N	443.460	1.986	50	20	IDGD	
COCc1cccc(CNC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c1	916426444	MIJKXQXQBGTCBJ-UHFFFAOYSA-N	425.533	1.876	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NCc2cccc(C(N)=O)c2)c2ccccc2c1=O	916483152	ANIHDBUICNXGHI-UHFFFAOYSA-N	436.472	1.440	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)[C@@H]2CC(=O)N(c3ccc(Cl)cc3)C2)c2ccccc2c1=O	917387614	FESRAKJQYWZMJK-GFCCVEGCSA-N	439.859	1.401	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)c2ccc3c(c2)S(=O)(=O)N(C[C@@H]2CCCO2)C3=O)n1	918557302	VPWFHTNIGITRMP-AWEZNQCLSA-N	431.474	1.174	50	20	IDGD	
O=C(CC(F)(F)F)NNC(=O)C1CCN(S(=O)(=O)c2ccc(F)c(F)c2)CC1	918703884	MYPPGXVZJVBHQH-UHFFFAOYSA-N	429.367	1.465	50	20	IDGD	
O=C(COC(=O)CCCOc1cccc(F)c1)NNC(=O)[C@H]1COc2ccccc2O1	918772558	XCZRBZBIAKSHDR-GOSISDBHSA-N	432.404	1.515	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NCC(=O)Nc2ccc(Cl)cc2)c2ccccc2c1=O	919783049	KJYZZLZCHIIOQW-UHFFFAOYSA-N	428.836	1.170	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccn2)nc2ccccc12)N[C@H]1CCS(=O)(=O)C1	919883056	ADWUGPIQOJQZDK-ZDUSSCGKSA-N	425.470	1.428	50	20	IDGD	
COC(=O)CCOc1ccc(S(=O)(=O)NNC(=O)c2nnc(-c3ccccc3)o2)cc1	919961944	QBSFFEIBHICLLP-UHFFFAOYSA-N	446.441	1.302	50	20	IDGD	
CCCCN1C(=O)CC[C@H](C(=O)NNC(=O)CN2CCCC2=O)[C@@H]1c1ccc(OC)cc1	920436225	ZDZZGTBQBGXAGR-AVRDEDQJSA-N	444.532	1.545	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cnc(-c3ccccc3)nc2)cc1OC	921212278	UQWWFONIUDQYFM-UHFFFAOYSA-N	436.424	1.779	50	20	IDGD	
CCc1ccccc1OCC(=O)NNS(=O)(=O)c1cc(S(C)(=O)=O)ccc1F	921295225	JWUSHBBAJGRAJE-UHFFFAOYSA-N	430.479	1.180	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c(C(F)(F)F)c1	1320210797	ZOITYKLELGGBET-UHFFFAOYSA-N	444.435	1.903	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnn4cccnc34)C2)C1	1778444970	AFCZHMXTQNAJBI-KDOFPFPSSA-N	436.310	1.346	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cnc3ccc(F)cn13)CCO2	1779299433	TXGQFEUKVAGDLN-HXUWFJFHSA-N	434.544	1.768	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3[nH]cnc3-c3cccnc3)C2)C1	1780055932	GIHMVBXRSZBCEG-FOIQADDNSA-N	433.896	1.169	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccccc3C(=O)OCCO)C2)C1	1780156735	VNDDGWLTZVEFQT-UWJYYQICSA-N	438.908	1.297	50	20	IDGD	
C[C@@H]1CCc2c(C(=O)N3CCO[C@@]4(CCN(C(=O)[C@H](F)Br)C4)C3)n[nH]c21	1781330364	WXYSSFGPAQMPEY-OVWKYPIYSA-N	429.290	1.593	50	20	IDGD	
C[Si](C)(C)c1cc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)co1	1781331674	PCSXVKMPVQDLCA-PBHICJAKSA-N	447.377	1.959	50	20	IDGD	
O=C(c1cccc2nccn12)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781332181	DRRHKHXCCGVSAI-RHSMWYFYSA-N	425.258	1.468	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H]1C[C@H]3CC[C@@H]1O3)C2	1782002833	XUIQCXPCKCLOJV-ACZMQLADSA-N	429.355	1.851	50	20	IDGD	
COCc1oncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](Cl)COC)C1	1782172372	ANXNOUVWPCHQSC-IDHHARJASA-N	429.901	1.202	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccnn1C(C)C)C2	1782176019	UNQRCXVOXVQRQK-WRWLIDTKSA-N	426.945	1.845	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)nc2nccn12	1782355047	PPBLMEXXNUZODT-GUYCJALGSA-N	440.273	1.172	50	20	IDGD	
C[C@H](CN)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](Br)Cc3ccccc3)C2)C1	1783022935	MZFVQSWFVFVPEJ-SYNHAJSKSA-N	438.366	1.417	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)CCCn3ccnc3)CCO2)C1	1783351861	BYNTUVNPPGIKBV-MAUKXSAKSA-N	427.343	1.667	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)COc3ccc(F)cc3)CCO2)C1	1783532614	LIDMKVFOLPXSIK-ACJLOTCBSA-N	429.286	1.818	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc4c(c3)OCO4)CCO2)C1	1783535138	ZHEUEUWCUNLGFF-SGTLLEGYSA-N	425.279	1.642	50	20	IDGD	
COc1cc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](C)Br)C3)C2)ccc1O	1783538951	ZDAMVGFJEYDOBB-SGTLLEGYSA-N	427.295	1.628	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc([N+](=O)[O-])c(OC)c3)C2)C1	1785182545	ILDFJBSVQHYLCI-KUHUBIRLSA-N	441.868	1.301	50	20	IDGD	
Cc1noc(C)c1CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21	1785357182	HHXVJJHCBZCJQM-XIRDDKMYSA-N	442.354	1.989	50	20	IDGD	
COc1ncc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCBr)C[C@@H]32)cc1F	1785638371	SFCCEHKFNNDVOU-WHOFXGATSA-N	444.301	1.608	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3csc(N)n3)[C@H]2C1	1786910545	FDXPIHAOPVDWCI-BLFANLJRSA-N	431.356	1.350	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21)c1cccc(N2CCOCC2)n1	1787657648	AMHYGEXQAWCDKI-DNUAJFIVSA-N	440.903	1.046	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)c1cnc(Cl)c(Cl)c1	1788871550	TWJUTHDHYCCOLJ-RETIQXCHSA-N	436.723	1.581	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3c(F)cncc3F)[C@H]2C1	1789007990	WGHULXAPWOLPNS-XEZPLFJOSA-N	427.524	1.805	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21)c1cc(=O)nc2sccn12	1789139405	KBUKZNZNFHCIBD-NHCYSSNCSA-N	445.328	1.153	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1ccc(C2(NC(=O)CCc3cn[nH]c3)CCC2)cc1	1789521093	FSFWKYVFQNJYOO-UHFFFAOYSA-N	447.499	1.789	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CC[S@@](=O)CC)C[C@@H]21	1790960734	RCFSROXRDIAOCY-ZHKNHGQWSA-N	437.400	1.298	50	20	IDGD	
CN[C@@H](CC(=O)NC1(c2ccc(NC(=O)[C@@H](C)Br)cc2)CCC1)C(=O)O	1791434812	ZVMUXHSTEZTKLL-RISCZKNCSA-N	426.311	1.967	50	20	IDGD	
COc1ccc([C@H](O)C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)Br)C3)cc1	1792715523	JXIMSVDGMXLFOZ-VKPHEEHNSA-N	441.322	1.102	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Cl)C3)C[C@@H]2C[C@@H]21	1792995195	FAJFJHNLERGVGG-NDTOZGPPSA-N	445.919	1.508	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(-n3cnnc3)cc1)C2	1793447514	SCIRRTNWOADEBX-NBMJBFSESA-N	431.924	1.878	50	20	IDGD	
CN1Cc2ccccc2C[C@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2	1793830464	DHGGTSSGFJYGQI-YVSFHVDLSA-N	426.344	1.436	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(F)cc1F)c1cccc(B(O)O)c1	1793919348	FZMPWYBYNUBFSM-YWRWEQHZSA-N	440.255	1.610	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)c1c(Cl)cncc1Cl	1796189565	DBJBZCFJTNBGPG-QDMKHBRRSA-N	448.115	1.634	50	20	IDGD	
CSCC(C)(C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1	1796439615	RIAXPJKUCPMOCG-AMFOTSNXSA-N	449.577	1.099	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cn(C)cc1C(F)(F)F	1796678716	KPZHSCHMGZTERI-BAESOJJISA-N	437.846	1.501	50	20	IDGD	
O=C1CN(c2cccc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)[C@@H](F)Cl)n2)CCCN1	1796804168	MYCVQCWVYBCDOB-KYZVSKTDSA-N	437.903	1.194	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@](C)(Cl)CCl)C3)o1	1797746423	CVWDUVAKJRNNRS-ABXQLRGKSA-N	432.304	1.678	50	20	IDGD	
Cc1nc(F)ccc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)CBr)C2	1798310008	QHAIBNHWHLPNLH-YGSHXTJESA-N	428.302	1.763	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1(c3ccccc3)CC1)C2	1798440225	RCUWZGMJKVBWHM-BCDXTJNWSA-N	433.512	1.669	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3ccoc3cn1)C2)[C@H](F)Br	1799349603	ZTBPRQANMFGTTC-JLUCKKNBSA-N	426.242	1.722	50	20	IDGD	
COc1ccc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Cl)C3)c(OC)c1	1800415781	FSBXJODYVWGNOM-GTYSZEQSSA-N	428.888	1.760	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCCC(=O)OC(C)(C)C)C2	1800971273	SXEWBBDXARFVCS-BASYENTBSA-N	432.945	1.342	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc(OC)cc1Cl)C2	1800973828	HYMOLXSEHSBKIP-QOIYZWAUSA-N	445.343	1.735	50	20	IDGD	
COC[C@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(N3CCOCC3)cn1)C2	1802273443	LTDDZYOQBLPTRP-DFGXFYAUSA-N	436.940	1.424	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cn(C)nc1C(F)(F)F)C2	1802336929	BSJPIGXUSOQXQR-CLLJXQQHSA-N	444.458	1.064	50	20	IDGD	
COc1ncc(C(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]2c2cccnc2)cc1F	1803140175	BCYHWAMIKPFBHQ-KBRIMQKVSA-N	436.871	1.544	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cn3ccsc3n2)[C@H]1c1cccnc1)[C@H](O)CCl	1803142874	LOCXVPMJOMDRJB-IMJJTQAJSA-N	433.921	1.710	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccn3ccnc3c2)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803142940	OWJHTCGRVJFGRH-JENIJYKNSA-N	427.892	1.649	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)c2cnco2)[C@@H]1c1cccnc1	1803858022	CNRLBZSIERHGOB-VQMZYRHSSA-N	449.471	1.523	50	20	IDGD	
CN1N=C(C(=O)NC[C@@H]2CCN(C(=O)C(Cl)Cl)[C@@H]2c2cccnc2)CCC1=O	1804124747	VWRPPPTXEXMHLP-SWLSCSKDSA-N	426.304	1.499	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)COCCOC)[C@H]1c1cccnc1	1806763005	XTWKWOWBSQCWJL-XYJFISCASA-N	442.354	1.924	50	20	IDGD	
Cc1ccc(CC(=O)N2CCCC3(CCN(C(=O)CCC(=O)NN(C)C)CC3)C2)cn1	1807194784	WSROWXKXTYKBSK-UHFFFAOYSA-N	429.565	1.537	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)CCc2ccc[nH]2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1	1807371086	PGVZTKJWVTUSTH-XXBNENTESA-N	446.316	1.042	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)Cc2ccccn2)[C@@H]1c1cccnc1	1807655673	LCVGHHAGAGIFDQ-MBSDFSHPSA-N	438.532	1.098	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)c1cc2cccnc2[nH]1	1809895312	FTVQPOPHDNGZAV-CGTJXYLNSA-N	427.892	1.877	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)C(Cl)(Cl)Cl)CC2)C1	1809973403	JXMUHLQBYPZDCD-UHFFFAOYSA-N	447.555	1.581	50	20	IDGD	
Cc1ccoc1C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1	1810303383	RHNNUVZCGMUXSF-LPHOPBHVSA-N	448.483	1.615	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2ccc(C#N)cc2)[C@@H]1c1cccnc1	1811893499	IFAJBUKGMIIQKN-OFNKIYASSA-N	448.527	1.646	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2nn(C)c3c2CCC3)[C@@H]1c1cccnc1	1813030160	GOBYFTBACCDNCD-OXFYSEKESA-N	445.951	1.877	50	20	IDGD	
C[C@H](C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)n1cccc1	1813308622	DHBOURODFWJWKF-AGHHOFFYSA-N	446.316	1.144	50	20	IDGD	
C#CCCC(=O)NC[C@@H]1CCN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@H]1c1cccnc1	1814103235	IFTXLMILMMZIBG-YCYMQERHSA-N	434.500	1.635	50	20	IDGD	
CCC[C@@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CNCP(=O)(O)O)[nH]n1	1815317559	AHTGCMBUSHSERP-YPMHNXCESA-N	435.849	1.534	50	20	IDGD	
COc1cnc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)[C@H](O)CCl)[nH]n2)c(F)c1	1816212529	SKJKATNLTLRBPQ-UONOGXRCSA-N	425.848	1.858	50	20	IDGD	
CC(=O)OC[C@H](OC(C)=O)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](F)Cl)n[nH]1	1818039998	NSICFMWGTKGJSI-VNHYZAJKSA-N	432.836	1.431	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc4cn[nH]c4cn3)sc2C1	1819453831	LJXPDMIQIYYUIC-MNOVXSKESA-N	434.909	1.894	50	20	IDGD	
C[C@H](NC(=O)c1cnccn1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](F)Cl)[nH]n1	1819514617	QRZUXDMYPAQSIO-VZJVUDMVSA-N	437.863	1.545	50	20	IDGD	
C=CC[C@H](C(=C)C)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(B(O)O)cc1)CC2	1819598124	UJSUZKWPHGHIFQ-DLBZAZTESA-N	439.346	1.817	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H]2C[C@H](O)CN2)n[nH]1	1820746671	OSCGYDKTDOMFPG-IMIFBBOLSA-N	428.331	1.156	50	20	IDGD	
CC[C@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CS(=O)(=O)N2CCCC2)[nH]n1	1820857234	QWJQNCDSFMWSOV-ZFWWWQNUSA-N	445.973	1.845	50	20	IDGD	
COc1cc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@H](C)Br)CC3)nn1C	1821777173	ACMFACAZBKJZPG-DTWKUNHWSA-N	442.339	1.894	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)CCc2ccc[nH]2)[nH]n1	1822413953	JHLOYFMTXNMIIJ-QGZVFWFLSA-N	429.525	1.736	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1	1823006371	ACADTCOYSDNXGP-DNSOKLHBSA-N	433.303	1.436	50	20	IDGD	
COC(=O)C12CC(C(=O)N3CCC([C@@H]4CCCCN4C(=O)[C@@H](O)CCl)CC3)(C1)C2	1824184711	CUFAWUAHSIARQP-RKAKKKFESA-N	426.941	1.549	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](C)Cn3ccnc3)sc2C1	1826833522	AWHDUFZMHXVTMI-AVGNSLFASA-N	425.942	1.842	50	20	IDGD	
C[C@@H](Cc1ccco1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCC(=O)NN(C)C)CC2	1826966594	USCIGFIRLVZWAU-UONOGXRCSA-N	447.561	1.900	50	20	IDGD	
Cc1ncc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)s1	1827053140	WOZSOCRUUGNMLG-IBGZPJMESA-N	441.362	1.678	50	20	IDGD	
O=C(c1ncccc1F)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827058263	WFYSMPWVVDCOAQ-HXUWFJFHSA-N	439.296	1.448	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cnc(Cl)nc1)CCO2	1829519752	QEPUYTCXMFNWKP-SFHVURJKSA-N	442.976	1.052	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(OC)c(F)c3)CCO2)C1	1830151117	JGPSGPSZZVPKTL-QRWLVFNGSA-N	428.888	1.922	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)Cn2cc(C)c(O)nc2=O)CC1	1830314154	BYJVPEHCJHCMSI-IRXDYDNUSA-N	438.956	1.894	50	20	IDGD	
CN(C)c1ccncc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830358736	RLTFPNUQGIOSQF-OAQYLSRUSA-N	438.956	1.483	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CC34CCCN3CCC4)C2)C1	1830363645	GMJDWRLCLLWPJT-JOCHJYFZSA-N	442.000	1.726	50	20	IDGD	
O=C(c1cccc(-c2cnco2)c1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1830733746	SIXPDOXOHPVZPR-DYESRHJHSA-N	449.891	1.011	50	20	IDGD	
CCNC(=S)NCC(=O)N1CCC([C@H]2CCCCN2C(=O)[C@H](C)Br)CC1	1831655764	AOQSIPYYYJLUBN-DZGCQCFKSA-N	447.443	1.874	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3c(C)nn(C)c3C)C2)C1	1831659194	OEAIZTHCSKEZMX-RXVVDRJESA-N	440.972	1.443	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3ccccn3)CCO2)C1	1833188100	GOKCVQLVAFKYDG-UXHICEINSA-N	444.359	1.707	50	20	IDGD	
CCc1nn(C)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](Cl)CC)C3)C2)c1Cl	1833595927	KOHFOOIYEGMLNC-ORAYPTAESA-N	447.363	1.723	50	20	IDGD	
Cc1nscc1C(=O)N1CCO[C@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1	1833746394	YWKHRINDVHTAJP-SFHVURJKSA-N	427.599	1.373	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)c1ccnc(C(F)F)c1	1833921415	NKEXONASPIQPLL-QGZVFWFLSA-N	444.910	1.804	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cccnc3OC)CC2)CC1	1834178295	MLLHLSDDGYWAPM-GOSISDBHSA-N	438.956	1.529	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)CSC3CCCC3)C2)C1	1834819838	YOXPTSIGEQTDPZ-SFHVURJKSA-N	449.411	1.904	50	20	IDGD	
Cn1cc(CCC(=O)NC2CCN(C3CCN(C(=O)C(Cl)Cl)CC3)CC2)cn1	1834821091	CBVJHAZUPCPYGE-UHFFFAOYSA-N	430.380	1.728	50	20	IDGD	
Cc1noc(CC(=O)NC2CCN(C3CCN(C(=O)C(C)(C)CCl)CC3)CC2)n1	1834849380	WXBNUMQBCHGQKG-UHFFFAOYSA-N	425.961	1.757	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H]3CC[C@H]4CCC(=O)N4C3)CC2)CC1)[C@H](F)Cl	1835082206	VQZHAHSIWULVFH-LJHODMEESA-N	442.963	1.493	50	20	IDGD	
O=C1Cc2cc(C(=O)NC3CCN(C4CCN(C(=O)[C@@H](F)Cl)CC4)CC3)ccc2N1	1835517351	URTLBENSGSFGHB-LJQANCHMSA-N	436.915	1.901	50	20	IDGD	
CC(C)N[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)Br)C2)C1)C(C)C	1835900932	LTQDSHSOFGMODT-BXWFABGCSA-N	448.402	1.249	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccc(F)cn3)CCO2)C1	1836034670	OYFOOJXFJJLJPA-RBUKOAKNSA-N	448.322	1.456	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cc(C(F)F)no1)CCO2	1836246051	HRILLJPJBCJTJO-SFHVURJKSA-N	447.511	1.534	50	20	IDGD	
N#Cc1ccc(F)c(C(=O)NC2CCN(C3CCN(C(=O)[C@H](O)CCl)CC3)CC2)c1	1836464146	BHEPAQNVZZAROW-LJQANCHMSA-N	436.915	1.482	50	20	IDGD	
Cc1n[nH]c(C)c1CC(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836717551	GACHTMKYHVFABS-SFHVURJKSA-N	426.945	1.167	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccn4cncc34)CCO2)C1	1837107566	IQWHLTXUIHYNDD-UTKZUKDTSA-N	434.924	1.812	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CC=CCC1)CCO2	1839126533	IUILNONXIJMKET-TXPKVOOTSA-N	429.355	1.830	50	20	IDGD	
Cc1n[nH]c(C)c1CC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1	1839241341	KEDHXJGLXWGWBA-RBUKOAKNSA-N	447.363	1.262	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccnc(F)c3)C2)C1	1839962917	VHYQNMWHJJGBBX-KBXCAEBGSA-N	444.301	1.464	50	20	IDGD	
C=C(C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](Br)CC)CCO2)C(F)(F)F	1839966940	UUXLMONBHVMBKF-WFASDCNBSA-N	443.260	1.735	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccnc(F)c3)C2)C1	1840030116	ANBIABKJNQXUAG-YVEFUNNKSA-N	430.274	1.074	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3ccsc3)C2)C1	1840032130	OFHYJSQCDLELQQ-KDOFPFPSSA-N	445.379	1.921	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CC=CC[C@H]1C(=O)OC)CCO2	1840143561	YAQGACDLIHOUKI-GRXQJBFDSA-N	442.940	1.216	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4[nH]ccc4s3)C2)C1	1840152547	LYRNIGLAXZKUIV-BFUOFWGJSA-N	441.937	1.553	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3ccoc3)CCO2)C1	1840516808	NNHJLRVCUYDEFZ-QFBILLFUSA-N	443.338	1.842	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(C(N)=O)cc3)CCO2)C1	1840645843	QHJYKEWERKSECK-OAQYLSRUSA-N	437.924	1.121	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCN3CCCC3)CCO2)C1	1840940466	KOKCXAKKGJQEAU-RTBURBONSA-N	436.380	1.165	50	20	IDGD	
CC[C@H](NC(C)=O)C(=O)N1CCCC12CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2	1841088134	UUQBJWYSCYSXER-KRWDZBQOSA-N	446.460	1.252	50	20	IDGD	
COc1ccnc(C(=O)N2CC3(CCCN3C(=O)[C@@H](C)CBr)C2)c1OC	1841288497	XUJGVICDIXOLJO-LBPRGKRZSA-N	426.311	1.947	50	20	IDGD	
CC(C)[C@@H](CC(=O)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1)NC(=O)OC(C)(C)C	1841354144	JXLTVFANYPWICB-HUUCEWRRSA-N	431.961	1.729	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)C1CCOCC1)C2	1844692378	QDWMQLLHFFXDHV-UHFFFAOYSA-N	431.445	1.764	50	20	IDGD	
O=C(CCBr)N1CC2(CCCN2C(=O)[C@@H]2C[C@@]23C(=O)Nc2ccccc23)C1	1846182483	HLWZOPSNDDGJDJ-XOBRGWDASA-N	432.318	1.885	50	20	IDGD	
O=C(Cc1ccc(F)cc1Cl)N1CC[C@H]2[C@@H]1CCN2C(=O)c1ccc(B(O)O)cc1	1848016941	HQOFFOFVZAWHTG-OALUTQOASA-N	430.672	1.217	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(C(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)cc1	3486030	GSMCEZLKUSRXBN-UHFFFAOYSA-N	439.877	1.208	50	20	IDGD	
CCn1c(NNC(=O)Cn2c(=O)n(CC)c(=O)c3ccccc32)nc2ccccc2c1=O	11163029	HLLHRZDGTUMEJQ-UHFFFAOYSA-N	434.456	1.056	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)[C@@H]1CC(=O)Nc2cc(F)ccc21	14280231	CNEXJVBCJYVULT-LJQANCHMSA-N	439.491	1.611	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21	14842832	SLEPUQICOPABHC-UHFFFAOYSA-N	444.400	1.518	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2cccc(C(=O)NNC(=S)NC(C)(C)C)c2)C[C@@H](C)O1	14895276	DIMLPUOOEAHVFY-BETUJISGSA-N	428.580	1.392	50	20	IDGD	
Cn1nc(SCC(=O)NN=C(Cc2ccccc2)Cc2ccccc2)c(=O)n(C)c1=O	18887379	ARDWJBKODGUTDD-UHFFFAOYSA-N	437.525	1.529	50	20	IDGD	
Cc1ccc(OCCNC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)c(C)c1	28853584	FPDVJIKQVBWGCG-UHFFFAOYSA-N	433.534	1.928	50	20	IDGD	
O=C(NNC(=O)c1cc(S(=O)(=O)N2CCSCC2)c[nH]1)c1ccc2ccccc2n1	109205244	MDLCXWKKVQKXTO-UHFFFAOYSA-N	445.526	1.375	50	20	IDGD	
Cc1ccc([C@H](CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)N2CCCC2)o1	725871211	DONXBNONOUMKGR-INIZCTEOSA-N	448.549	1.662	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)N1CCC(NC(=O)c2ccc(F)cc2)CC1	725872083	APKASNPTUUSYGD-UHFFFAOYSA-N	447.492	1.252	50	20	IDGD	
COc1ccc(CN2C[C@@H](C(=O)NNC(=O)COc3cc(C)cc(C)c3)CC2=O)cc1	726521104	AHSYBIAOLLUSFM-SFHVURJKSA-N	425.485	1.887	50	20	IDGD	
N#Cc1ccc(N2CCC(NC(=O)NNC(=O)COc3ccccc3[N+](=O)[O-])CC2)nc1	727605128	ACXVGDMRGDZAKM-UHFFFAOYSA-N	439.432	1.240	50	20	IDGD	
Cc1cc(NS(=O)(=O)c2cccc(C(=O)NNc3nc(-c4ccncc4)no3)c2)no1	728073474	ILOWBYZTUGHCAJ-UHFFFAOYSA-N	441.429	1.986	50	20	IDGD	
CC(C)(C)c1ccc(N)c(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1	728334397	GZPIVHCZLURKCG-SFHVURJKSA-N	427.457	1.711	50	20	IDGD	
COc1ccc(/C=C(\C#N)C(=O)O[C@H](C)C(=O)Nc2cccc(S(N)(=O)=O)c2)cc1	728881758	OSMXUHVLGFXGRD-QQFZQELXSA-N	429.454	1.820	50	20	IDGD	
CC[C@H](NC(=O)NNC(=O)COc1ccc(C#N)cc1)c1cccc(S(N)(=O)=O)c1	729613862	WVVPHGFCSACNSR-KRWDZBQOSA-N	431.474	1.066	50	20	IDGD	
C[C@H](CN1CCN(C)CC1)NC(=O)NNC(=O)COc1ccccc1Cc1ccccc1	730129886	DGYGGSCDNGUFTO-LJQANCHMSA-N	439.560	1.623	50	20	IDGD	
CC1CCN(S(=O)(=O)c2ccc(C(=O)NNC(=O)COc3ccccc3O)cc2)CC1	730779502	BQEACKSCRSQDHX-UHFFFAOYSA-N	447.513	1.653	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCCNC(=O)c2ccc(C)cc2)cc(OC)c1OC	732236579	SEQGZZQLHOESJT-UHFFFAOYSA-N	430.461	1.395	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)[C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)cc1	732263225	AUVGMKPXOBKBMM-CQSZACIVSA-N	431.474	1.829	50	20	IDGD	
CSCC[C@H](NC(=O)c1ccco1)C(=O)NNC(=O)c1cnn(-c2ccccc2)c1	733170197	SAFXEMBNBIIABW-INIZCTEOSA-N	427.486	1.778	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCCCCC3)cc2)cn1	735445868	DCURAROOLCVXRI-UHFFFAOYSA-N	433.534	1.379	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)c2ccnc(N3CCCCC3)n2)c2ccccc2c1=O	739679165	QJONOABLWAUAQC-UHFFFAOYSA-N	435.488	1.833	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(S(=O)(=O)NNC(=O)c2cccc3ccccc23)c1	741656500	XJHXDZJDWSIULO-UHFFFAOYSA-N	433.511	1.713	50	20	IDGD	
CN(C)[C@@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)c1ccccc1	744313705	JDUNCUAAUGNTNF-HXUWFJFHSA-N	444.557	1.925	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CN2CCN(C(=O)Cc3ccccc3Cl)CC2)c1	744391251	QOIQNNAPYNRHFJ-UHFFFAOYSA-N	428.920	1.796	50	20	IDGD	
Cc1c(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)cnn1-c1ccccc1	744619105	HVVRFOGMCYBTFS-UHFFFAOYSA-N	441.513	1.959	50	20	IDGD	
CCc1noc2ncc(C(=O)NNc3ccccc3S(=O)(=O)N3CCOCC3)cc12	744621716	ZPIKZLVRTCWDRF-UHFFFAOYSA-N	431.474	1.563	50	20	IDGD	
CN(C)C(=O)[C@H]1CCCN1CCCNC(=O)NNC(=O)Nc1ccc(OC(F)F)cc1	745796374	RIAMBAFIXGHSIU-OAHLLOKOSA-N	442.467	1.566	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1noc(-c2cccc(F)c2)n1	746097261	DTSHJFPRPQDNPQ-UHFFFAOYSA-N	432.437	1.552	50	20	IDGD	
CN(c1ccc(OCC(=O)NNC(=O)c2ccc[nH]2)cc1)S(=O)(=O)c1cccs1	747654690	ZMJVSAINDZKLBB-UHFFFAOYSA-N	434.499	1.741	50	20	IDGD	
CCOC(=O)c1sc(CNC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)nc1C	750285729	KTVBXSZPNLVNSU-UHFFFAOYSA-N	428.474	1.958	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)/C(C#N)=C\c2ccc(O)cc2)cc1OC	750664156	ROKSRUAWCJDXAQ-DHDCSXOGSA-N	425.397	1.321	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CCN2C[C@H](C)O[C@H](C)C2)cc(OC)c1Br	751425095	DXZWEGWKISRESN-TXEJJXNPSA-N	444.326	1.727	50	20	IDGD	
COCCCOc1cccc(CNC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c1	752685421	VKPVMHKOJPLJPU-UHFFFAOYSA-N	439.472	1.493	50	20	IDGD	
Cn1c(NNC(=O)c2ccc3c(c2)CCCN3S(C)(=O)=O)nc2ccccc2c1=O	752906503	JWMFTKAPZSSARL-UHFFFAOYSA-N	427.486	1.403	50	20	IDGD	
CC(=NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1)c1cc(O)cc(O)c1	753714433	NWMUKGNCULDJJU-UHFFFAOYSA-N	446.529	1.253	50	20	IDGD	
N#Cc1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)ccc1Cl	754000106	UVGBOZJBYJXTFX-UHFFFAOYSA-N	448.888	1.307	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c(OC)c1	755390759	FRRZYMALNFVGJJ-UHFFFAOYSA-N	448.501	1.955	50	20	IDGD	
Cc1ccc(N2CCOC2=O)cc1NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1	756820749	KDJGRXDVNPRTFV-UHFFFAOYSA-N	439.476	1.811	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)[C@](C)(O)CN3Cc4ccccc4C3=O)n[nH]2)c1	756879880	NWLPQWSVDKYJHD-XMMPIXPASA-N	447.495	1.862	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(F)(F)[C@H](C(=O)NNC(=O)CNC(=O)c2cccs2)C1	757909575	QDAPQIPLLKWVRB-NSHDSACASA-N	446.476	1.518	50	20	IDGD	
O=C(NC[C@H]1CC(=O)N(Cc2ccccc2)C1)NNC(=O)c1nn(-c2ccccc2)cc1O	758984737	OHZLGGDBBWWRBA-QGZVFWFLSA-N	448.483	1.571	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccnc(Sc2ccccn2)c1	763442420	PMAJTCWLBFVSDN-UHFFFAOYSA-N	438.425	1.936	50	20	IDGD	
CC(C)(C)NS(=O)(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)c2ccccc2O)c1	763530494	WOEIAZGFGXBWJF-UHFFFAOYSA-N	448.501	1.010	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)Nc1cccc(N2CCCCCC2)c1	763570779	FZBOFGBSSRXOGJ-FQEVSTJZSA-N	438.484	1.993	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)Nc1ccc(OC2CCCC2)nc1	763573000	PGSXGYUDXWSVBD-QGZVFWFLSA-N	426.429	1.329	50	20	IDGD	
C[C@@H](C#N)CSc1ccccc1NC(=O)C(=O)NNC(=O)[C@H]1COc2ccccc2O1	763578342	ORHMASNRXQFARA-SUMWQHHRSA-N	440.481	1.864	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)Nc1cc(F)ccc1Br	763579096	UPNNBMJSJPOBDW-AWEZNQCLSA-N	438.209	1.514	50	20	IDGD	
CCOC(=O)c1ccsc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccccc2)[nH]n1	763601490	RJDQLFSPOCVUNR-UHFFFAOYSA-N	427.442	1.715	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cccc(-n3cnnn3)c2C)c2ccccc2n1	763615111	KZYRCFPTOGUGKS-UHFFFAOYSA-N	430.428	1.227	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(C)c(Br)c1	763661801	CKXIHRPSEUPIAA-UHFFFAOYSA-N	436.262	1.931	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2c(F)cccc2Br)cc1	763662660	YZDKEJYQJBKRHW-UHFFFAOYSA-N	440.225	1.762	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2cccc(CN3CCCC3=O)c2)c1	763669277	WAKCEWVRBIEVSE-UHFFFAOYSA-N	438.484	1.591	50	20	IDGD	
CCOC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)cc1	763674159	LXPMDTPFUNJBRX-UHFFFAOYSA-N	425.401	1.292	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)C(=O)Nc1cccc(Cl)c1-n1cncn1	763680787	BNZOAEQUSVBIPJ-UHFFFAOYSA-N	432.799	1.225	50	20	IDGD	
CCOC(=O)c1cc(C)sc1NC(=O)C(=O)NNC(=O)CN1CCCc2ccccc21	763727408	FJVYVACTQUUUEC-UHFFFAOYSA-N	444.513	1.772	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)C(=O)Nc1ccc(Br)cc1	763803309	GOARSFOUNNBJTP-UHFFFAOYSA-N	437.206	1.522	50	20	IDGD	
CC(C)COc1cccc(NC(=O)C(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])c1	763805016	QRKBUUGOUDJNAW-UHFFFAOYSA-N	430.417	1.795	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(OCCN(C)C)c(Cl)c2)cc1	763821433	PZFPXVPTSRAPRH-UHFFFAOYSA-N	448.907	1.754	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccc(-c2csnn2)cc1	763872251	MVFNCWYVCNLURV-NSHDSACASA-N	429.433	1.898	50	20	IDGD	
CN(C)CCCOc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccc(Cl)cc2)cc1	763931398	FZJJZLKGTAWCDQ-UHFFFAOYSA-N	432.908	1.999	50	20	IDGD	
CCN(c1ccc(NC(=O)C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1)C(C)C	764076593	CCSIPALLZRPUFI-UHFFFAOYSA-N	446.529	1.725	50	20	IDGD	
COC(=O)c1cc(F)c(F)cc1NC(=O)C(=O)NNC(=O)CCc1ccc(OC)cc1	764125728	AZDIULQNJDKEEX-UHFFFAOYSA-N	435.383	1.479	50	20	IDGD	
CN1C(=O)c2ccc(NC(=O)C(=O)NNC(=O)c3c(Cl)cccc3Cl)cc2C1=O	764220709	ABRSFZLEPJQQIZ-UHFFFAOYSA-N	435.223	1.619	50	20	IDGD	
C[C@@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)CCCc3ccccc3)cn2)C[C@@H](C)O1	764225113	YJBXMNNOZSLMRZ-IAGOWNOFSA-N	439.516	1.804	50	20	IDGD	
CCS(=O)(=O)c1cc(F)ccc1NC(=O)C(=O)NNC(=O)Cn1ccc2ccccc21	764243787	ZJHSPDJNIQDOIE-UHFFFAOYSA-N	446.460	1.360	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)ccc1O)C(=O)Nc1cccc(-n2ccnc2)c1	764281039	WEDNBSQVOQPGGU-UHFFFAOYSA-N	444.245	1.740	50	20	IDGD	
C[C@H]1CN(c2ccccc2NC(=O)C(=O)NNC(=O)Cc2ccccc2F)C[C@H](C)O1	764320015	WDCZKWNKEBSOSH-GJZGRUSLSA-N	428.464	1.768	50	20	IDGD	
O=C(NNC(=O)c1cc2ccccc2o1)C(=O)Nc1ccc(CN2C(=O)CCCC2=O)cc1	764331776	ZQXJKIRVTOMOQU-UHFFFAOYSA-N	448.435	1.872	50	20	IDGD	
NC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)ccc1Cl	764388596	UVEJTAOKXAASLK-UHFFFAOYSA-N	444.810	1.368	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1cccc(-c2nccn2C)c1	764392645	JPDOKBNXSYHLII-UHFFFAOYSA-N	439.497	1.974	50	20	IDGD	
CC(C)C(CCc1ccc(Cl)cc1)=NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C	764812507	MGDWEYREABMMNP-UHFFFAOYSA-N	444.923	1.848	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)CCc2nc(-c3cc(Br)cs3)no2)n[nH]1	765588987	XWGOJKCAVNLWPU-UHFFFAOYSA-N	425.268	1.986	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cc(-c3ccccc3OC)[nH]n2)cc1OCCO	765598746	DDPFBLMYSYFMAX-UHFFFAOYSA-N	426.429	1.540	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCCc2nc3c(s2)CCCC3)nc1	766265823	CBXYYWZCTBUXTE-UHFFFAOYSA-N	438.579	1.972	50	20	IDGD	
CCN(C)[C@H](C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1)c1ccccc1	766643652	REPGGJCINYOLEO-QFIPXVFZSA-N	437.544	1.285	50	20	IDGD	
O=C(Cn1cc(Br)cc([N+](=O)[O-])c1=O)NNC(=O)c1ccc(Cl)cc1	767209435	YYMCUGNNTFLVCH-UHFFFAOYSA-N	429.614	1.634	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)c2ncccc12	768234596	VUCGVTXBYJRSCL-GOSISDBHSA-N	436.424	1.559	50	20	IDGD	
O=C(CCCNS(=O)(=O)c1ccc2c(c1)OCCCO2)NNc1nc2ccccc2[nH]1	768514609	HXYPIBJQJLIQPC-UHFFFAOYSA-N	445.501	1.926	50	20	IDGD	
C[C@H]1CCC[C@@H]1CC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	768964174	CEASIXOUHFRYDJ-FUHWJXTLSA-N	437.562	1.614	50	20	IDGD	
COC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(NC(=O)NNC(=O)C(C)(C)C)cc2)C1	769943978	XZDCPHKUBJYSCY-CYBMUJFWSA-N	440.522	1.459	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)Cn3ncc4ccc([N+](=O)[O-])cc43)nc21	770954770	GYQLZXREXLPENF-UHFFFAOYSA-N	425.409	1.688	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)[C@@H]3CCCN3C(=O)Cc3ccccc3)nc21	770965676	MPWNPOBTYHCLSD-INIZCTEOSA-N	437.504	1.964	50	20	IDGD	
Cn1c(N)c(C(=O)/C(C#N)=C\c2ccc3ccc(Br)cc3n2)c(=O)n(C)c1=O	771520491	MGQSBDQEQMLGHT-XFFZJAGNSA-N	440.257	1.767	50	20	IDGD	
O=C(NNc1ccnc(Br)c1)c1cccc(CN2CCS(=O)(=O)CC2)c1	771559878	AJGLRYAMQOOBKM-UHFFFAOYSA-N	439.335	1.831	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)C[C@H](NC(C)=O)c1ccc(Br)cc1	771900548	DYHZQUKUMPSXAD-YGRLFVJLSA-N	428.283	1.506	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)c1nc(N2CCCC2)ncc1Cl	772884406	KVTCVAWEMALAFG-UHFFFAOYSA-N	437.287	1.461	50	20	IDGD	
Cc1sc(=O)n(CCC(=O)NNC(=O)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)c1C	773416518	BTHUMNUBVDGGRY-CQSZACIVSA-N	426.539	1.711	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)NCCOc1ccc(NS(C)(=O)=O)cc1	773446248	AZUQDZKUKXWZEW-UHFFFAOYSA-N	446.489	1.037	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1ccc(Br)cn1	773730025	KZIFGZSLSDGFTH-UHFFFAOYSA-N	443.279	1.338	50	20	IDGD	
O=C(NNc1ccc(C(F)(F)F)cn1)c1ccc(S(=O)(=O)N2CCOCC2)cc1	775251227	MNJLDPZYTKCAQZ-UHFFFAOYSA-N	430.408	1.878	50	20	IDGD	
CC(C)(C)OC(=O)N(CC(=O)NNc1cccc(S(C)(=O)=O)c1)C[C@H]1CCCO1	776527281	DKYNVKVCPNNWLR-OAHLLOKOSA-N	427.523	1.949	50	20	IDGD	
C[C@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	777412757	YSKQIDWSZWNPGX-XJKSGUPXSA-N	444.496	1.252	50	20	IDGD	
O=C(Cc1cccnc1)NNS(=O)(=O)c1cc(Cl)ccc1OC[C@H]1CCOC1	777623910	OLKRHJMOUCIDGD-AWEZNQCLSA-N	425.894	1.703	50	20	IDGD	
COC(=O)CNC(=O)NNS(=O)(=O)c1ccc(-c2ccc(Br)cc2)cc1	779844936	MCDXQZITJRVFBW-UHFFFAOYSA-N	442.291	1.782	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)Cc2ccc(S(=O)(=O)C(C)C)cc2)cc1	781306761	BJFHVZVOGJTZDE-UHFFFAOYSA-N	432.498	1.724	50	20	IDGD	
CC(=O)N1CCN(Cc2ccccc2NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2)CC1	782125200	XIMSEKJRBGFTLH-UHFFFAOYSA-N	440.460	1.341	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2ccc(C(=O)N3C[C@@H](C)O[C@H](C)C3)cc2)nc1	782148340	LGCLVJIHKHPMKW-ZIAGYGMSSA-N	427.461	1.421	50	20	IDGD	
COCCOc1ccc(C(F)(F)F)cc1NC(=O)C(=O)NNC(=O)c1ccc(O)cc1	782831919	IVBYLOPSCWIXAG-UHFFFAOYSA-N	441.362	1.836	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)cc1Cl	782888593	VSQJICSVLBEFTB-UHFFFAOYSA-N	429.864	1.954	50	20	IDGD	
CCCCOc1cccc(NC(=O)C(=O)NNC(=O)c2csc(N3CCOCC3)n2)c1	782897996	VITXZMYQWPMEGN-UHFFFAOYSA-N	447.517	1.558	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccc(F)c(Cl)c2)nc1	783262336	CNLHQOBWIJKDME-UHFFFAOYSA-N	429.861	1.643	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(NC(=O)C(=O)NNc2cc(C)ncn2)ccc1Cl	783945287	KAEVSZREABOIBP-UHFFFAOYSA-N	440.913	1.551	50	20	IDGD	
Cc1ccc(NNC(=O)C(=O)Nc2ccc(OCCNC(=O)OC(C)(C)C)cc2)nn1	783954147	WTCQWWSLDYIDIA-UHFFFAOYSA-N	430.465	1.770	50	20	IDGD	
O=C(NNc1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(C(=O)N2CCOCC2)c(Cl)c1	784831976	VNVGRCNUOYKBNA-UHFFFAOYSA-N	447.835	1.802	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2cccc(S(C)(=O)=O)c2)c(OCCN(C)C)c1	784839870	RJJNZKWTNQNKEF-UHFFFAOYSA-N	434.518	1.421	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)C(=O)Nc2cccc(Cl)c2S(C)(=O)=O)c1	784853069	VZMVQXWVIKKOQL-UHFFFAOYSA-N	425.850	1.612	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccccc2-n2ccnn2)c1	784976332	OHVZUWVOHHZURZ-UHFFFAOYSA-N	442.501	1.373	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)C(=O)Nc1ccc(Oc2ccncc2)cc1	785060806	NAOKYTCDIBKWGN-UHFFFAOYSA-N	430.424	1.850	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2ccc(S(=O)(=O)C(F)F)cc2)n1	785227038	NFHVXUXPSSGWQX-UHFFFAOYSA-N	442.448	1.401	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNS(=O)(=O)C[C@H]2CCCOC2)cc1	788140009	SYQNYAFCASBDHJ-AWEZNQCLSA-N	425.536	1.098	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)CC1CCC2(CC1)OCCO2	788174928	SUZJVYNBAPUKFD-UHFFFAOYSA-N	440.880	1.976	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(C(=O)NNc2nnc(-c3ccccn3)s2)cc1	788563812	RYOOPJTYRTYHBG-UHFFFAOYSA-N	434.503	1.282	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@H](C(=O)NNC(=O)Cc2ccc(Cl)cc2)[C@@H](C)O)cc1	789165873	BJAGDGOLHJPTDQ-ACJLOTCBSA-N	439.921	1.066	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2nc3c(s2)CCC3)cc1Br	789734859	PIVLIAAQDBQGJW-UHFFFAOYSA-N	439.291	1.803	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)c2nnn(Cc3ccc(F)cc3F)c2C)cn1	791120243	FAVLIDOIEGCYPS-UHFFFAOYSA-N	433.444	1.948	50	20	IDGD	
O=C(NNc1ccc2c(=O)[nH]ccc2c1)C(=O)Nc1ccc(NC(=O)[C@H]2CCCO2)cc1	793068683	BGSGMYJVODLJQD-GOSISDBHSA-N	435.440	1.727	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)c2cccc(C)n2)cc1	794599756	MBQDSFIOXMGKLI-UHFFFAOYSA-N	426.520	1.044	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)[C@@H]2[C@H]3[C@H]4C[C@@H]5[C@@H]6[C@H]4[C@H]2[C@@H]6C[C@H]53)cc1OC	796324197	NQZMUVZTWVZCSY-NMJJRMFNSA-N	426.469	1.402	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)COc2ccc(C)c(C)c2)c(OC)c(C)c1OC	796992151	NYPLQFIFWUMEHR-UHFFFAOYSA-N	445.472	1.803	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccc(Cl)c(CN2CCOCC2)c1	797536292	ZBZIXVXTQOYLIG-UHFFFAOYSA-N	448.882	1.640	50	20	IDGD	
CN(CCNC(=O)NNC(=O)CCCc1ccccc1)S(=O)(=O)c1ccc(F)cc1	798062207	XJZOQXNGEOLAPT-UHFFFAOYSA-N	436.509	1.800	50	20	IDGD	
NC(=O)c1cc(Br)cc(S(=O)(=O)NNC(=O)c2ccc3ccccc3n2)c1	799518191	FUBSXSPGWMDOSI-UHFFFAOYSA-N	449.286	1.720	50	20	IDGD	
CCCCNS(=O)(=O)c1ccc(C)c(NC(=O)C(=O)NNC(=O)c2ccccc2O)c1	799834034	IGNAJCOJDRMYHE-UHFFFAOYSA-N	448.501	1.179	50	20	IDGD	
O=C(CN1C(=O)[C@H]2CCCC[C@@H]2C1=O)NNc1cc([N+](=O)[O-])ccc1Br	800618566	BGUUXGWPUKABEL-QWRGUYRKSA-N	425.239	1.976	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3ccc(NCC4CC4)nc3)CC2)cc1	800693634	WWVCUJWDXJARFO-UHFFFAOYSA-N	436.560	1.791	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)Cc2c(C)nn(-c3nc(C)cc(C)n3)c2C)cc1	801110501	BCQGMHMDOPVPMT-UHFFFAOYSA-N	435.488	1.533	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2ccc3c(c2)OCO3)cc1S(=O)(=O)NC1CC1	802092969	KJMKNIJEACLSAE-UHFFFAOYSA-N	448.457	1.331	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CS[C@H](Cc2ccccc2F)C(=O)N1)Nc1ccc2c(c1)OCO2	802102648	ARKCEFVOJJHCKB-WMLDXEAASA-N	446.460	1.550	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)c1cccc(NN2C(=O)[C@@H]3CC=CC[C@H]3C2=O)c1	804955975	YULAJEWLQZKCDP-IAGOWNOFSA-N	444.455	1.697	50	20	IDGD	
COCCCOc1ccc(CNC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1	805759862	SFJLMPWNDZTBJK-UHFFFAOYSA-N	435.502	1.650	50	20	IDGD	
COC(=O)c1csc(S(=O)(=O)N2CCN(C(=O)NCCSSC)CC2)c1	807229437	XSFOVGNXPWZTSG-UHFFFAOYSA-N	439.606	1.562	50	20	IDGD	
Cc1cc([N+](=O)[O-])ccc1NNC(=O)C(=O)Nc1cccc(S(=O)(=O)NC2CC2)c1	807454921	BGXVVQXFDOMBNI-UHFFFAOYSA-N	433.446	1.426	50	20	IDGD	
C[C@H]1[C@H](NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)CCN1Cc1ccccc1	807619829	BXFRRRLXMYOGII-HNAYVOBHSA-N	434.500	1.541	50	20	IDGD	
CCO[C@@H]1CC(=NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)[C@H]1SC	807944291	WDQZLCCGFZNHJD-IAGOWNOFSA-N	427.548	1.334	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cccc4c3COC4=O)n[nH]2)cc1	808935194	MCQHBFYCHPCVJU-UHFFFAOYSA-N	433.424	1.709	50	20	IDGD	
COc1cccc(NC(=O)CN(C)C(=O)COC(=O)/C(C#N)=C\c2cc(C#N)n(C)c2C)c1	809303681	SFNAHSBKXGQLEI-IUXPMGMMSA-N	449.467	1.761	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)C(=O)Nc1cnn(-c2ccc(F)cc2)c1C(F)(F)F	810387064	DEMQNMLYYKZOAC-UHFFFAOYSA-N	439.329	1.461	50	20	IDGD	
CN(C)S(=O)(=O)CCNC(=O)C(=O)Nc1ccccc1S[C@@H](Cl)C(F)(F)F	810494870	DEFOASIXFJLEOP-CYBMUJFWSA-N	447.888	1.852	50	20	IDGD	
CN(C(=O)OC(C)(C)C)c1ccc(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)s1	810581199	MIJYMZUBKDEEBA-SNVBAGLBSA-N	432.524	1.251	50	20	IDGD	
CCOCC(C)(C)CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	812433611	QASMNQQSDAHXDX-UHFFFAOYSA-N	426.539	1.478	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)C1(S(=O)(=O)c2ccccc2)CCOCC1	813611359	TVVJTBQBQHBZQQ-UHFFFAOYSA-N	428.474	1.129	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)c1ccn(-c2ccc(Br)cc2)n1	814313649	ZXTIJQIAIDAYSH-UHFFFAOYSA-N	448.302	1.887	50	20	IDGD	
Cn1c(=O)c(CNC(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)cc2ccccc21	814403607	HCIXLJCUTATUIK-UHFFFAOYSA-N	431.493	1.674	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)C(=O)Nc1ccc([C@H]2CCOC2)cc1	815566264	NRTCNDDFSAVXJV-AWEZNQCLSA-N	428.401	1.264	50	20	IDGD	
Cc1ccc(NC(=O)Nc2ccccc2)cc1NC(=O)C(=O)NNC(=O)[C@H]1CCCO1	815779429	FTLWORAMVYONMI-QGZVFWFLSA-N	425.445	1.904	50	20	IDGD	
CNC(=O)c1ccc(NC(=O)C(=O)NNc2cc(C(=O)OC)ccc2Br)cc1	815866389	YVFZFAWFYKHJSQ-UHFFFAOYSA-N	449.261	1.677	50	20	IDGD	
CC(C)[C@H](NS(=O)(=O)c1ccc(Br)cc1)C(=O)NNc1cnnn1C	816769447	IVCRKDGRECUZCC-ZDUSSCGKSA-N	431.316	1.024	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)CN2C(=O)N[C@@](C)(c3ccc(F)cc3)C2=O)c(C)c1	818580982	ROGFMBAGAUONPY-QFIPXVFZSA-N	441.463	1.469	50	20	IDGD	
N#C/C(=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)NNC(=O)CC1CC1	819135682	BAKHFYNGILXKCG-XNTDXEJSSA-N	440.891	1.933	50	20	IDGD	
CCOC(=O)NCCC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	915046000	QLQDYDWRNNHSDH-UHFFFAOYSA-N	440.503	1.446	50	20	IDGD	
CC(F)(F)CCC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	915808029	JPKZWDDSOCTEPZ-UHFFFAOYSA-N	433.477	1.223	50	20	IDGD	
CCOc1ncccc1CNC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	916400822	VOKSYGPVRSYACA-UHFFFAOYSA-N	447.517	1.409	50	20	IDGD	
CNC(=O)CN1CCC(NC(=O)NNC(=O)[C@@H](C)Oc2ccc3ccccc3c2)CC1	916516778	KJJBSFMPCMEAJC-OAHLLOKOSA-N	427.505	1.148	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)c1nnc(O)c2ccccc12)N1CCc2sccc2C1	916620247	VVJDHJNNFMACDC-GFCCVEGCSA-N	426.502	1.788	50	20	IDGD	
C[C@@H](c1nc(-c2ccccc2)no1)N1CCN(CC(=O)NNC(=O)c2ccccc2)CC1	917110179	XMSNUZTXGGVVLW-KRWDZBQOSA-N	434.500	1.876	50	20	IDGD	
Cc1cc(NC(=O)c2cccc(F)c2)sc1C(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1	917625738	XEENNZSXGMBIEY-LBPRGKRZSA-N	439.490	1.644	50	20	IDGD	
O=C1CCC(=O)N(c2ccc(C(=O)NNC(=O)c3ccc(F)cc3Br)cc2)N1	920292353	GRQLARBLRIYXFS-UHFFFAOYSA-N	449.236	1.821	50	20	IDGD	
O=C(COC(=O)[C@@H]1CCCN(CC(F)(F)F)C1)NNC(=O)c1ccc([N+](=O)[O-])cc1	920647036	XWWSYIIWNXNLLO-GFCCVEGCSA-N	432.355	1.173	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2cccc(N3CCOC3=O)c2)c1	920931245	IIXMYLPVSYBIML-UHFFFAOYSA-N	447.473	1.360	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)ccc1N1CCN(C)CC1	1320106320	SDWDNBCSBIVDEZ-UHFFFAOYSA-N	435.492	1.189	50	20	IDGD	
COc1cc(Br)c(OC)c(C(=O)NNC(=O)CNC(=O)OC(C)(C)C)c1	1320142596	NCOCORUAKGHIQX-UHFFFAOYSA-N	432.271	1.752	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnc4ccccn34)C2)C1	1777818021	SQYCJOMEPUYVNB-LIRRHRJNSA-N	435.322	1.809	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)C(C)(C)n3nc(C)ccc3=O)C2)C1	1779232056	BDTZMDXGSCTKFE-IERDGZPVSA-N	438.956	1.524	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@]3(CN(C(=O)CCBr)CCO3)C2)c(OC)c1	1780530165	ADDVDIFASFZRNE-IBGZPJMESA-N	441.322	1.932	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)C[C@@H](N)c3cccnc3)CCO2)C1	1781227334	JGOOYJZAQNAKGG-MNEFBYGVSA-N	429.348	1.538	50	20	IDGD	
CC(=O)Nc1ccccc1C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781333931	ICAPTCPVEJDALW-CRAIPNDOSA-N	442.285	1.779	50	20	IDGD	
O=C(c1nc2ccc(F)cn2n1)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781335321	XNRAJCSDQAGNRR-LRDDRELGSA-N	444.236	1.002	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C/N=C/c1ccco1)C2	1782175048	BDCYRAPYASYACX-ONHDISHQSA-N	425.913	1.466	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1c[nH]c3cnccc13)C2	1782176022	UOKJWXPTSHXZSP-YRISNDGFSA-N	434.924	1.944	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCC(=O)NN(C)C)C1)c1ccccn1	1782214644	XSKDCHSBVAJTSJ-GEQKSPFYSA-N	445.564	1.072	50	20	IDGD	
O=C([C@H](F)Br)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H]2CC[C@H](O)CC2)C1	1782325614	BSTFKHUQNDPADR-ZURLZEQWSA-N	435.334	1.742	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3c(C)nn(C)c3C)CCO2)C1	1783344534	UNKCAYKGEABJHH-KDOFPFPSSA-N	427.343	1.654	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cn4ccc(Cl)cc4n3)CCO2)C1	1783874060	CDZUMOANGBEXFE-AUUYWEPGSA-N	441.315	1.685	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccnc(Br)c3)CCO2)C1	1783878010	UNXXTNMPAIFVGQ-DYVFJYSZSA-N	446.729	1.541	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3n[nH]c4ccc(C#N)cc34)CCO2)C1	1783882848	QZOWFCBNECRLIN-MGPUTAFESA-N	431.880	1.132	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@](C)(O)C(F)(F)F)C[C@@H]21	1783969897	QUHVCTPRXWPNCR-SQRMYFJTSA-N	445.276	1.310	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cc(F)ccc3Cl)C[C@@H]21)[C@@H](O)CCl	1784085268	DYISGUYLWUOZFH-GQGQLFGLSA-N	433.307	1.601	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccnn3-c3ccccc3)C[C@@H]21)[C@H](O)CCl	1784090581	IPXSCMRDAUGVKY-WQCNXYOZSA-N	432.908	1.065	50	20	IDGD	
CC(C)[C@H](O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C[C@@H]21	1784187302	DIFJBMZRYRLXRY-OQTPAQLSSA-N	447.482	1.868	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)COc3cccnc3)[C@H]2C1	1785147900	SGUZWQXOTKTASH-HJWJTTGWSA-N	440.338	1.614	50	20	IDGD	
Cc1ccncc1CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21	1785321062	CZCPSMGFYQAQLC-OVWQWFNUSA-N	442.329	1.993	50	20	IDGD	
Cn1nc(C(=O)Nc2ccc(C3(NC(=O)c4cnccc4C(=O)NN)CCC3)cc2)cc1O	1787051394	VFSGCCVXWHTUMM-UHFFFAOYSA-N	449.471	1.186	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3F)[C@H]2C1	1787192619	CPCJIHPSVGXOQL-DUPGQFARSA-N	428.302	1.845	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](N)Cc3cscn3)[C@H]2C1	1787397398	XCOVUSMWDBXIRK-RKOFLFEYSA-N	428.986	1.400	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]2C1)[S@@](=O)c1ccccc1	1787450677	TVZCJJVBDQJBQR-PPHQJTDHSA-N	430.929	1.697	50	20	IDGD	
CCn1nccc1C(=O)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1	1788140167	LLUOFMVUJTXUIT-UHFFFAOYSA-N	432.289	1.644	50	20	IDGD	
C[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)N1C[C@H]2C[C@@H]2C1	1788509052	KRHLBAJFFRFMRO-NEMWNAMBSA-N	428.371	1.091	50	20	IDGD	
Cc1cc(/C=C/C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Br)C[C@@H]32)no1	1788675391	SCJOHJVACBRJMC-MKZIQFNVSA-N	430.274	1.666	50	20	IDGD	
CCCC(=O)N[C@@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)Br)C[C@@H]21	1788743588	DNMGDDSBUYKOPI-YTFOTSKYSA-N	432.359	1.054	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1ccc(C2(NC(=O)c3cc(O)ncn3)CCC2)cc1	1789519915	QRSOZRCZHOHRNN-UHFFFAOYSA-N	447.455	1.242	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3C[C@@]34C(=O)Nc3ccccc34)C[C@@H]21	1789864908	KDWBQPPSDSCXRE-FNQLGUPJSA-N	445.947	1.894	50	20	IDGD	
Cn1c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]3C2)cccc1=O	1789865717	ADEVFGSZQOYJFP-NGOJXBLDSA-N	430.332	1.215	50	20	IDGD	
COc1cc(C)c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](O)CCl)C[C@@H]32)cc1OC	1790192134	NLKUFZINKRCRIS-FJXLLPKBSA-N	440.924	1.205	50	20	IDGD	
CN(C)[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](O)CCl)c1ccc(Cl)cc1	1792983172	BRFVHFITCUDEBU-WTNVTLLGSA-N	444.359	1.132	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cn1ccc2c(F)cccc21	1793060523	ZNHFKILDISBLKZ-BJWYYQGGSA-N	443.523	1.792	50	20	IDGD	
O=C(C[C@@H]1COc2ccccc2O1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2	1793269018	DRTVDTATOKTKTD-IPJQOSJUSA-N	429.300	1.610	50	20	IDGD	
CN1CCC[C@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)C2	1793640796	NBQNFCRJIQYZNY-NWLQTXJVSA-N	444.482	1.556	50	20	IDGD	
COc1cc(F)ccc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCBr	1795117141	OZIKYPXEADQJLA-DPIQGUFMSA-N	429.286	1.823	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CSc1ncccn1	1795837608	CLDHFUOUHPQHBT-IFOZYUSPSA-N	433.361	1.395	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1n[nH]c2c1CCCC2	1796166161	FLYSHUAFXPNLCH-MCYUEQNJSA-N	425.327	1.275	50	20	IDGD	
CSc1ncccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1	1796191932	QZTKEJGLLAKKSP-BJWYYQGGSA-N	425.319	1.049	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Cl)C1	1796367751	SUKMXDOTMRGDGW-ARKGTOAJSA-N	447.935	1.758	50	20	IDGD	
COC(=O)c1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@](C)(Cl)CCl)C3)cn1	1796563812	IMXRAUNUIQJAER-FCIKYMEBSA-N	444.315	1.308	50	20	IDGD	
Cc1nc2cccc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)c3cccc(B(O)O)c3)C4)c2s1	1797383574	SOIDEXXUTLNECX-BCDXTJNWSA-N	449.341	1.850	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cn1cccc([N+](=O)[O-])c1=O	1801358337	OTIWNVDZZWVYEX-SJBDTSRBSA-N	445.303	1.631	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccccc1OC(F)F	1801816021	MMYYYEMUDDBROL-FAXLKDOZSA-N	432.851	1.745	50	20	IDGD	
C[C@@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(=O)nc3sccn13)C2	1801963976	VHLDROTZKQPRTG-WISYIIOYSA-N	439.335	1.791	50	20	IDGD	
C[C@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN1C(=O)CSC1=S)C2	1801968060	HHSIDNKZOCQNIV-MMWGEVLESA-N	434.381	1.268	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)COCCOCCOCCOC	1802097181	WWEBFLGNHGIVSN-FCGDIQPGSA-N	448.988	1.728	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(-c3ccco3)no1)C2	1802333213	ORXXXRZGFWJRQX-QDMKHBRRSA-N	429.477	1.559	50	20	IDGD	
C[C@H](Cc1ccco1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnccc1C(=O)NN)C2	1803075594	YZHMDIJPSGJTKW-LVQVYYBASA-N	425.489	1.409	50	20	IDGD	
C[C@H](C(=O)N1CCCC2(CCN(C(=O)c3cnccc3C(=O)NN)CC2)C1)C1(O)CCC1	1804837367	YTEDBDXPYVJRJW-MRXNPFEDSA-N	443.548	1.081	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H](CNC(=O)CS(C)(=O)=O)[C@H]1c1cccnc1	1806768623	JUYTZZSEWGCKJY-UNEWFSDZSA-N	436.361	1.368	50	20	IDGD	
N[C@H](C(=O)NC[C@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1)c1ccccn1	1807161513	GARITWYLNWZPGZ-AYOQOUSVSA-N	446.349	1.967	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)n1cccc1	1807373805	GSEFVCPSNVXXSM-ZNLUXHQJSA-N	446.316	1.144	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)cn1C	1807374838	JPGZNYQWMDUTSG-KNQAVFIVSA-N	446.316	1.042	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)C(C)(F)F)[C@@H]1c1cccnc1	1808414478	JESIEOUDLIHSPO-KEXANBGTSA-N	446.458	1.877	50	20	IDGD	
O=C(Cc1ccccc1O)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1	1809980600	WYFWJEDWCZUKJH-UHFFFAOYSA-N	436.317	1.160	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)c2cc(O)ncn2)[C@@H]1c1cccnc1	1812865236	NAKZAEBRWMWEEO-NORZTCDRSA-N	434.294	1.680	50	20	IDGD	
COC(=O)C1(C(=O)N2CC[C@H](CNC(=O)[C@@H](C)Br)[C@H]2c2cccnc2)CC1	1812868281	XEGPRJNNBWQJLM-BPLDGKMQSA-N	438.322	1.824	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)CCN2CCOCC2)[C@@H]1c1cccnc1)C(Cl)Cl	1813076372	PSCSUIAWAGKLNA-NVXWUHKLSA-N	429.348	1.613	50	20	IDGD	
C=C(C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1)C(F)(F)F	1817474939	JMEXCNKXFZZTIU-OAHLLOKOSA-N	436.199	1.514	50	20	IDGD	
Cc1nccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)n1	1818324811	JUBANEGTMGDJNT-MRXNPFEDSA-N	428.497	1.187	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1ccc(O)cc1	1820579054	XLLWSOPVFBHHQJ-LJQANCHMSA-N	434.261	1.415	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H]2CCC(=O)N2)CC1	1824094672	XUWGCYFLWBBGRZ-BPUTZDHNSA-N	428.371	1.916	50	20	IDGD	
CCNC(=S)NCC(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](C)Br)sc2C1	1825647651	UKWSIKMCDLZKRX-DTWKUNHWSA-N	448.412	1.323	50	20	IDGD	
Cc1cccc(C(=O)N[C@@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)n1	1826080516	PCHDNWNLMUHMTA-CYBMUJFWSA-N	430.534	1.445	50	20	IDGD	
Cc1cnc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)cn1	1827055666	BVOMEEBQSKRCET-NRFANRHFSA-N	436.321	1.012	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)Cc2cscn2)CC1	1827124870	CDZOOEBZRHLTTC-FQEVSTJZSA-N	441.362	1.299	50	20	IDGD	
O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)c1ccc([N+](=O)[O-])o1)CCO2	1829480382	NGVBWWUVFAEQNW-INIZCTEOSA-N	446.254	1.043	50	20	IDGD	
CC[C@@H](C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2)N(CC)CC	1830354464	YZNVFTBDEMHGKC-UWJYYQICSA-N	432.005	1.828	50	20	IDGD	
O=C(CN1C(=O)C=CC1=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H](F)Br)CC1	1830381432	JSIWULLTGXOGNC-CXAGYDPISA-N	444.301	1.222	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cscn3)C2)C1	1830538113	VZIFGCOFVVEJKY-MLGOLLRUSA-N	432.340	1.244	50	20	IDGD	
CC(=O)N[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1)C(C)(C)C	1831083624	SETJOKRDYLRXSG-IIBYNOLFSA-N	445.988	1.259	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)/C=C/c3cc(C)on3)C2)C1	1831651339	ORBWSBVCWRMDKS-YWMZBHJASA-N	425.913	1.860	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2nc[nH]c2[N+](=O)[O-])CC1	1831832374	GQGWHVIFUGGNRB-KGLIPLIRSA-N	427.889	1.805	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@H]2CCCS2(=O)=O)CC1	1831835105	OEFQYSDKPCGQLC-YESZJQIVSA-N	434.986	1.437	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CN2C(=O)C=CC2=O)CC1	1831987438	HYDXAEDZFDDFJG-HIFRSBDPSA-N	440.338	1.315	50	20	IDGD	
COc1ccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)cc1C	1832090514	VVEDVIXJRPDIAK-QUCCMNQESA-N	428.888	1.537	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)C3(c4ccc(O)cc4)CC3)CC2)CC1)[C@@H](O)CCl	1833305862	AQOMXWPBZCIBGH-FQEVSTJZSA-N	449.979	1.595	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3ccc4nccn4c3)CC2)CC1)[C@@H](O)CCl	1833310332	QKISMIBKJBLAAY-SFHVURJKSA-N	433.940	1.119	50	20	IDGD	
C[C@H](Oc1cccnc1)C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)CCl)CC2)CC1	1833313096	VIKRXDNKOWGWLU-HNAYVOBHSA-N	438.956	1.020	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)c3csnn3)CC2)CC1	1833556173	IZWWIEYKZWJESS-GFCCVEGCSA-N	444.399	1.754	50	20	IDGD	
CN(C)c1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)nc1	1833649578	UZBAXKNYIZGNPX-SFHVURJKSA-N	431.320	1.021	50	20	IDGD	
O=C(/C=C/C1CCCC1)N1CCOC[C@]2(C1)CN(C(=O)CCBr)CCO2	1834824051	RTZQHBITOYPWPL-UEKDZROGSA-N	429.355	1.974	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3cccs3)CCO2)C1	1836083654	OCFAZQIJCLHJJD-RDTXWAMCSA-N	445.379	1.778	50	20	IDGD	
O=C(c1ccc(Cl)nn1)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836718577	UIEIAQGJTJVLHB-HNNXBMFYSA-N	431.320	1.342	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC(OC2CCN(C(=O)C3CCCC3)CC2)CC1	1837605330	WSHZBCISGLCBKK-UHFFFAOYSA-N	428.338	1.169	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(F)n3)C2)C1	1837715319	JOCKZQUYXSUQOT-IBGZPJMESA-N	425.533	1.142	50	20	IDGD	
Cc1nc(F)ccc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)Br)C2)C1	1838268633	RRAODRZBWZGHLD-SGTLLEGYSA-N	444.301	1.383	50	20	IDGD	
O=C(c1ccc(O)cc1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1838971065	AIDSTTORIPBWCR-PBHICJAKSA-N	431.258	1.153	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccnc3SC)C2)C1	1839146879	ZHALLTDTGJDARC-KXBFYZLASA-N	427.954	1.891	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccccc3C(N)=O)CCO2)C1	1839349615	GTCBXKFFFAWNEO-UWJYYQICSA-N	437.924	1.263	50	20	IDGD	
COc1c(C)cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)cc1C	1839392218	BCGCMKISOLJYKL-PXNSSMCTSA-N	428.888	1.916	50	20	IDGD	
O=C(/C=C/c1cccc(O)c1)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1839926004	FMZLDEIKIZYGBU-PXPVJAHISA-N	429.300	1.666	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccc4c(c3)CCO4)CCO2)C1	1839998857	PTGGLUONYINFGI-XMSQKQJNSA-N	436.936	1.638	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(Cl)cc3F)C2)C1	1840149517	RNRLISYWEHBPNB-HNAYVOBHSA-N	449.306	1.803	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(F)ccc3Cl)C2)C1	1840154768	FSRPJIPKVGSJCE-LPHOPBHVSA-N	449.306	1.803	50	20	IDGD	
O=C(C(Cl)Cl)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CCc4ccccc43)C2)C1	1840190846	QJJICZFLIOPHSU-OXJNMPFZSA-N	427.328	1.977	50	20	IDGD	
O=C([C@H](F)Cl)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)c1ccccc1Cl)CCO2	1840317217	OLAZHBFVOLASPP-VKJFTORMSA-N	435.279	1.364	50	20	IDGD	
N#Cc1cc(C(=O)N2CC3(CCCN3C(=O)[C@@H](O)CCl)C2)ccc1Br	1841353016	ZFEZEEJDJOBMHS-AWEZNQCLSA-N	426.698	1.737	50	20	IDGD	
O=C([C@H](Br)Cc1ccccc1)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1	1841353960	ZTDDELCXAPUEAS-HUUCEWRRSA-N	429.742	1.796	50	20	IDGD	
C[C@@H]1CCCN(C(=O)OC(C)(C)C)[C@@H]1C(=O)N1CCCC12CN(C(=O)[C@H](O)CCl)C2	1843985849	YULSMJYZUVRXEI-OAGGEKHMSA-N	443.972	1.825	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1cc3cccnc3s1)C2	1844264205	SOWDVHOHGBUPKV-UHFFFAOYSA-N	436.497	1.426	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1cc3ccoc3s1)C2	1844264259	ZKYARMNYDVINTO-UHFFFAOYSA-N	425.470	1.624	50	20	IDGD	
C[C@@H](CC(N)=O)C(=O)N1CC2(CCCN2C(=O)[C@@H](Br)Cc2ccccc2)C1	1845940584	YJIPSOUVIGYFGU-HOCLYGCPSA-N	436.350	1.708	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)CC2CN(C(=O)OC(C)(C)C)C2)C1	1847026737	VYGVBDFLMURHPC-OAHLLOKOSA-N	429.945	1.701	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cccc(S(C)(=O)=O)c1	1847383166	OJXIRWPHWLFKQT-RCBQFDQVSA-N	443.363	1.937	50	20	IDGD	
Cc1cccc(C)c1-n1nnnc1SCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	15520522	MGVBYAFAZJRBOV-UHFFFAOYSA-N	427.446	1.741	50	20	IDGD	
CCOc1ccc(N2C[C@H](C(=O)OCC(=O)NNC(=O)c3ccc(C)cc3)CC2=O)cc1	21166467	AOHPKNWYFKVYFP-QGZVFWFLSA-N	439.468	1.751	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)NCCC(=O)N2CCN(C)CC2)c(C)n1C[C@H]1CCCO1	195592029	GRMUWBPGNAYKLF-JCZXDDDQSA-N	427.549	1.471	50	20	IDGD	
CCN1CCN(c2ccc(F)cc2[C@H](C)NC(=O)NN[C@@]2(C)CCS(=O)(=O)C2)CC1	726279683	QTWBUAQRVYHBLQ-YWZLYKJASA-N	441.573	1.410	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NCc1ccc([C@@]2(C)NC(=O)NC2=O)cc1	726283129	WZSKBZPBPITBCO-XUSGNXJCSA-N	443.435	1.178	50	20	IDGD	
CSc1nnc(CCCNC(=O)NNC(=O)Cn2nc(C)cc2C)n1C1CCCC1	728135431	UZJXVYCQIOYIPG-UHFFFAOYSA-N	434.570	1.892	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3cnn(C)c3C(F)(F)F)cc2)CC1	728216320	WENAFMONDHOYSX-UHFFFAOYSA-N	446.455	1.132	50	20	IDGD	
O=C(COC(=O)C(F)(F)c1cccc(Cl)c1)NNC(=O)[C@@H]1COc2ccccc2O1	728333803	UEKKJOIGUCXZHK-HNNXBMFYSA-N	440.786	1.962	50	20	IDGD	
Cc1nn2c(nc(N3CCCC3)c3ccccc32)c1C=NNC(=O)[C@H](C)NS(C)(=O)=O	728434703	PDNIQCLJUWGKRV-AWEZNQCLSA-N	443.533	1.179	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNS(=O)(=O)c2cccc(C(=O)O)c2)c1	728508547	RTRQNXPSFJEXMB-UHFFFAOYSA-N	429.248	1.779	50	20	IDGD	
CS(=O)(=O)Nc1ccc(O)c(C(=O)NNC(=O)c2cc(F)ccc2Br)c1	728610140	AKKICPHVFCBIFR-UHFFFAOYSA-N	446.254	1.740	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)CCCC(=O)NC(C)C)c1	729510333	YHXWDHUFMWEDCY-UHFFFAOYSA-N	426.539	1.173	50	20	IDGD	
C[C@H]1CN(C[C@@H](C)C(=O)NN=C2CCS(=O)(=O)c3cc(F)c(F)cc32)C[C@@H](C)O1	731924925	MVOGYYHUWPUVMM-UPJWGTAASA-N	429.489	1.708	50	20	IDGD	
Cc1ccc(S(=O)(=O)n2ccc(C(=O)NNC(=O)CCN3C[C@H](C)O[C@H](C)C3)c2)cc1	732263920	PTYAFCBXSIHFFG-CALCHBBNSA-N	448.545	1.294	50	20	IDGD	
CS(=O)(=O)c1ccc(OCCCC(=O)NNc2ccccc2S(C)(=O)=O)cc1	732301950	OWUSUGGIRFUGCB-UHFFFAOYSA-N	426.516	1.796	50	20	IDGD	
COc1ccc(Br)c(C(=O)NCCCNC(=O)NNC(=O)C2CCC2)c1	732462867	HQELMESPYHFMST-UHFFFAOYSA-N	427.299	1.708	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2C1)c1cccc(S(=O)(=O)N2CCCCC2)c1	732911336	UCRHWSFBFWKDCT-SFHVURJKSA-N	443.525	1.874	50	20	IDGD	
CNS(=O)(=O)[C@@H]1CCCN(C(=O)/C(C#N)=C\c2cc(C)n(C[C@@H]3CCCO3)c2C)C1	733279216	RIAVNNXZKCGMCB-OHBNSYPMSA-N	434.562	1.731	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2ccc(N3CCC(O)CC3)cc2)c2ccccc2c1=O	735833626	LXMBGSHFWWVHAE-UHFFFAOYSA-N	435.484	1.452	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(/C#N)C(=O)N2CCC[C@H](CNS(N)(=O)=O)C2)c1C	739696507	IVYDUHRSUCTTJD-MTSVDCDHSA-N	437.566	1.251	50	20	IDGD	
CS(=O)(=O)NC1(CNC(=O)NNC(=O)Nc2ccc(OC(F)F)cc2)CCCCC1	745425748	BVFOPEKNXVVEHN-UHFFFAOYSA-N	449.480	1.876	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)[C@H](c2cccc(F)c2)N2CCOCC2)c1	745425985	ZYBQQXVCQNXCJY-FQEVSTJZSA-N	440.431	1.075	50	20	IDGD	
CCC(CC)(CNC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)NC(=O)OC(C)(C)C	745998576	MZNAGIUZBGSLJL-UHFFFAOYSA-N	446.512	1.690	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)[C@H]1CCCN(S(=O)(=O)c2ccccc2)C1	746553774	RRHWIWOLBCOGIC-INIZCTEOSA-N	441.513	1.125	50	20	IDGD	
Cc1csc([C@](O)(CC(=O)NNC(=O)Cc2cn3ccccc3n2)C(F)(F)F)n1	746642453	YFHKHURLGLTKES-MRXNPFEDSA-N	427.408	1.629	50	20	IDGD	
N#Cc1ccc(NNC(=O)c2ccc3c(c2)S(=O)(=O)N=C2N=CNN23)cc1C(F)(F)F	746893010	BMDUCYLZGDADQE-UHFFFAOYSA-N	449.374	1.745	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2ccc(Cl)cc2F)cc1	747429105	GLOYDESMNFPUFS-UHFFFAOYSA-N	429.857	1.479	50	20	IDGD	
O=C(CCOC[C@@H]1CCCO1)NNc1ccc(S(=O)(=O)Nc2nccs2)cc1	747943648	LBFRXEOMEUIXIP-AWEZNQCLSA-N	426.520	1.973	50	20	IDGD	
CCS[C@H]1CCC[C@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)C1	748964762	CSPDNCCZZSJVOK-GJZGRUSLSA-N	428.580	1.945	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NCCC1CCN(CC(F)(F)F)CC1	748964820	BRFSKSYYMDYXMP-UHFFFAOYSA-N	435.472	1.473	50	20	IDGD	
CCn1c(=O)c(C(=O)/C(C#N)=C\c2ccc(C(=O)OC)o2)c(N)n(Cc2ccccc2)c1=O	749451470	HWPWVIHQHDXMGE-PTNGSMBKSA-N	448.435	1.830	50	20	IDGD	
Cc1nn(-c2cncc3nnnn23)c(C)c1CC(=O)NNc1ccc(OC(F)F)cc1	750428751	REQRURIWOMVBNB-UHFFFAOYSA-N	429.391	1.609	50	20	IDGD	
COc1cc(OC)cc(N2C[C@@H](C(=O)NNC(=O)Cn3cnc4ccccc43)CC2=O)c1	752503959	SPEMKUQZTKEYHJ-AWEZNQCLSA-N	437.456	1.254	50	20	IDGD	
O=C(NNC(=O)N1CCS(=O)(=O)[C@H]2CCCC[C@@H]21)c1cccc(Br)c1	753919564	VHMQEIRLZFRIFX-KBPBESRZSA-N	430.324	1.845	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@@H](C)[C@H](C)NC(=O)OC(C)(C)C	755312374	DMPMXMRWLOZZMI-RYUDHWBXSA-N	441.554	1.598	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)Nc1cc(C2CC2)nn1[C@H]1CCS(=O)(=O)C1	756857280	UBFHEUBULFXWCL-AWEZNQCLSA-N	448.461	1.495	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1)c1cn[nH]c1	757714591	PMZIGGAJWISTPC-AWEZNQCLSA-N	442.501	1.593	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)c2cnc3nccnc3c2)c2ccccc2c1=O	758998492	OLRGFACSOGRYKA-UHFFFAOYSA-N	431.456	2.000	50	20	IDGD	
C[C@H]1CN(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)C[C@@H](c2ccsc2)O1	759747100	CTSUROPWXFVKPS-YOEHRIQHSA-N	430.534	1.957	50	20	IDGD	
O=C(COC(=O)c1cccc([C@H]2CCOC2)c1)NNC(=O)[C@@H]1COc2ccccc2O1	761546910	IKLWKXLMNCCLRM-LPHOPBHVSA-N	426.425	1.335	50	20	IDGD	
COC(=O)c1cc(F)ccc1S(=O)(=O)NNC(=O)CCCNC(=O)OC(C)(C)C	763439229	JHLBGKYROPESLP-UHFFFAOYSA-N	433.458	1.227	50	20	IDGD	
O=C(NNC(=O)c1ccccn1)C(=O)Nc1ccc(-c2n[nH]c(-c3ccccc3)n2)cc1	763464407	LMLLZXXLFHEYFN-UHFFFAOYSA-N	427.424	1.933	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)cc1Cl	763538389	AXIRKNXWFMFLFW-UHFFFAOYSA-N	437.836	1.774	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(N3CCOCC3)c(C)c2)c1	763625481	RMZKSPLXXSYXKG-UHFFFAOYSA-N	426.473	1.305	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1ccnc(Sc2ccccn2)c1	763629124	OVOGAVVUVWLCPM-UHFFFAOYSA-N	447.480	1.984	50	20	IDGD	
CS(=O)(=O)[C@@H]1CCCN(C(=O)NNC(=O)c2ccc(Br)cc2Cl)C1	763661452	BRRWKRMUVJIVOQ-SNVBAGLBSA-N	438.731	1.966	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(OC2CCCC2)nc1	763681752	MTRYMRQYZSDPHP-UHFFFAOYSA-N	442.472	1.967	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc2c(c1)OCCCO2	763682328	QVYQOWFIDUJQDZ-UHFFFAOYSA-N	429.429	1.412	50	20	IDGD	
CSc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1	763719253	WLJWNZUFEHTWFZ-UHFFFAOYSA-N	436.515	1.059	50	20	IDGD	
COc1ccc(NC(C)=O)cc1NC(=O)C(=O)NNC(=O)C12CC3CC(CC(C3)C1)C2	763734897	MLKGYSHELMFTTO-UHFFFAOYSA-N	428.489	1.956	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)C(=O)Nc2cccc(Cl)c2-n2cccn2)c1	763759608	ZVXSUZJZOKEOPK-UHFFFAOYSA-N	426.864	1.991	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(C(=O)NC(C)(C)C)cc2)cc1	763810868	CVNVOQQLWSMMMZ-UHFFFAOYSA-N	426.473	1.688	50	20	IDGD	
COC(=O)c1cc(F)c(F)cc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1cccc(C)c1C	763850744	PFHPIXAAKXHSEC-GFCCVEGCSA-N	449.410	1.922	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cc3c(cc2C)OCO3)cc1	763866054	NTPIFXJZLIFWCF-ZDUSSCGKSA-N	429.429	1.676	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(C(=O)NC)ccc2C)cc1OC	763912810	VKJPLAAORAHVAO-UHFFFAOYSA-N	442.472	1.552	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(N(C)C(C)=O)cc2)ccc1OC(C)C	763915655	CDWXPFWCHYICFS-UHFFFAOYSA-N	442.472	1.865	50	20	IDGD	
COC(=O)c1ccc(OC)cc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccccc2)on1	764016096	GEDMFZHMZNEHPN-UHFFFAOYSA-N	438.396	1.537	50	20	IDGD	
Cc1nc(CC(C)C)c(NC(=O)C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)s1	764077125	HOUBVKXICYZARM-UHFFFAOYSA-N	438.531	1.453	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(C)cc2OC[C@@H]2CCCO2)c1O	764130111	BBDHOOJVWFIOMD-AWEZNQCLSA-N	443.456	1.667	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)NC3CCCC3)cc2)c1O	764130476	IRUQYPVNXLAWDX-UHFFFAOYSA-N	440.456	1.473	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2cccn(Cc3ccccc3)c2=O)cc1	764131700	MKEVELKEINTRJU-UHFFFAOYSA-N	448.479	1.624	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)CCc2ccccc2)cc1N1CCCCC1=O	764185500	OWOUJIXMLKMXEZ-UHFFFAOYSA-N	438.484	1.931	50	20	IDGD	
CN(C)CC(=O)NNC(=O)C(=O)Nc1ccc(OCc2ccccc2)c(Br)c1	764203437	HUYCUPZZYDDLCX-UHFFFAOYSA-N	449.305	1.676	50	20	IDGD	
CC(C)CCC(=O)NNC(=O)C(=O)Nc1ccc(S(=O)(=O)N2CCC[C@H](C)C2)cc1	764203808	XBVRCLFQEZIVJX-HNNXBMFYSA-N	438.550	1.629	50	20	IDGD	
Cc1ncsc1C(=O)NNC(=O)C(=O)Nc1ccc(C(=O)N2CCCCCC2)cc1	764247427	XEIGKCJINYSJCZ-UHFFFAOYSA-N	429.502	1.867	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)C(=O)Nc1ccc(N2CCc3sccc3C2)nc1	764296419	ZXKYIDVXYJNQLE-UHFFFAOYSA-N	425.474	1.137	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2c[nH]nc2C)n(-c2cccc(Br)c2)n1	764297906	IMBBWAQKJVJRBD-UHFFFAOYSA-N	446.265	1.374	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3nc(C)cs3)n[nH]2)cc1OC	764378741	NDDKZKQDCMOEQJ-UHFFFAOYSA-N	430.446	1.259	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1ccccc1C(=O)N(C)C	764397771	MRHQUJQJWJOBJP-UHFFFAOYSA-N	430.486	1.275	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(C)cc1-c1nc(C2CC2)no1	764398398	HACHVTUEDIZAFR-GFCCVEGCSA-N	431.449	1.060	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1c(C)cnn1[C@@H]1CCCc2ccccc21	764400250	OXFNIHJGBBHLBN-MAUKXSAKSA-N	443.504	1.255	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H](O)CCc2ccccc2)c1	764583750	BPJATALKMOEWPU-IBGZPJMESA-N	433.530	1.472	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2cccs2)[nH]n1)Nc1cccc(CN2C(=O)CNC2=O)c1	765308113	WIZUTLFLCFJFFP-UHFFFAOYSA-N	439.457	1.657	50	20	IDGD	
C[C@H](NS(=O)(=O)c1ccc(C#N)cc1)C(=O)NNC(=O)Cn1ccc2ccccc21	765428046	PVMUJRPYTRRFDS-AWEZNQCLSA-N	425.470	1.027	50	20	IDGD	
Cc1ccn2ncc(C(=O)NNC(=O)CN3CCN(Cc4ccc(Cl)cc4)CC3)c2c1	766856916	QGUJFECPGRDUSD-UHFFFAOYSA-N	440.935	1.875	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)CN1CCn2c(CCc3ccccc3)nnc2C1	766897738	GPVCCXHZTFMSST-UHFFFAOYSA-N	432.528	1.577	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1	767283345	FPODJBARHHUUBN-UHFFFAOYSA-N	437.412	1.636	50	20	IDGD	
O=C(NNC(=O)c1c[nH]c2c(OC(F)(F)F)cccc2c1=O)C(=O)Nc1ccccn1	768029949	GBNFTDMEWYZWGS-UHFFFAOYSA-N	435.318	1.221	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NC[C@@]2(C)CCO[C@@H]2C2CC2)nc1	768535737	QUJHENAPVFBWOQ-IEBWSBKVSA-N	425.555	1.943	50	20	IDGD	
COC(=O)C[C@@]1(NC(=O)CCC(=O)C(C#N)=C2N(C)c3ccccc3N2C)CCOC1	768546506	CESXYPUZOWQXEW-QFIPXVFZSA-N	426.473	1.495	50	20	IDGD	
O=C(COC(=O)CCC(=O)c1ccc(Cl)cn1)NNC(=O)c1ccc([N+](=O)[O-])cc1	769180721	MSANIMWTIJVIQN-UHFFFAOYSA-N	434.792	1.611	50	20	IDGD	
CN(C)[C@H](CNC(=O)NNC(=O)C(=O)Nc1ccccn1)c1cccc(C(F)(F)F)c1	769535712	QTJMWRCRQJIYML-CQSZACIVSA-N	438.410	1.672	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)N1CCC[C@@H]1C(=O)NNC(=S)NCCSC	770240054	LYISWNIORGOWHL-CYBMUJFWSA-N	430.983	1.812	50	20	IDGD	
CCOC(=O)Cn1cccc(NC(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)c1=O	770624866	LWXDOEZFCDSJIE-LBPRGKRZSA-N	436.852	1.685	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)c3ccn(-c4cccc(Br)c4)n3)nc21	770971144	IAHZOSAMPQDBCR-UHFFFAOYSA-N	429.238	1.774	50	20	IDGD	
C[C@@H]1CN(C(=O)NNC(=O)c2c(Cl)cccc2Cl)CCN1c1nccn2cnnc12	771206351	DDVXVBRFRKNQGN-LLVKDONJSA-N	449.302	1.996	50	20	IDGD	
N#Cc1cc(S(=O)(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)ccc1Cl	771605727	BDGRAYCWPFPBTR-UHFFFAOYSA-N	427.269	1.491	50	20	IDGD	
Cc1cc(S(=O)(=O)NCCNC(=O)NNC(=O)c2cccc(N(C)C)c2)c(C)s1	772627872	ZGNJLPLWMHDHJG-UHFFFAOYSA-N	439.563	1.353	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)c1ccc(C[C@H]2CC(=O)NC2=O)cc1	772971377	ZCOLACIDZAXYNU-WFASDCNBSA-N	429.860	1.774	50	20	IDGD	
CCCNC(=O)[C@H]1CN(C(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2)c2ccccc2O1	773643341	OOSNKMNGDSPPIX-QGZVFWFLSA-N	427.417	1.358	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2ccc(C(N)=O)c(Cl)n2)c2ccccc2c1=O	773711292	DZLJNLSVGVBBSZ-UHFFFAOYSA-N	428.836	1.029	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNc2nccc(OC)n2)c(OCC(F)(F)F)c1	773730083	FDMAVQKDXIOHGA-UHFFFAOYSA-N	443.338	1.295	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1cccc([C@@H]2CNC(=O)C2)c1	774010031	UOAWTOCZDRQWMN-OCCSQVGLSA-N	444.875	1.497	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1cccc(Br)n1	775611750	XOMWQNCPNUGLDQ-UHFFFAOYSA-N	441.307	1.622	50	20	IDGD	
CCO[C@@H]1C[C@H](NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)[C@H]1Oc1ccccc1	776472923	LPFISYATHUNHSQ-IPMKNSEASA-N	437.460	1.231	50	20	IDGD	
COCc1nnc(-c2cccc(C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)c2)o1	776706291	KINRZUBOVGCZDH-UHFFFAOYSA-N	434.453	1.352	50	20	IDGD	
COC(=O)c1cc(Br)c(S(=O)(=O)NNC(=O)c2ccc(C)cc2O)s1	777612001	PCRKQGQKUVIHPE-UHFFFAOYSA-N	449.304	1.935	50	20	IDGD	
O=C(NC[C@H]1COC2(CCOCC2)O1)NNC(=O)c1ccc(F)cc1Br	777754491	KFUUEGUTPGEQDU-NSHDSACASA-N	432.246	1.454	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)[C@H](CC(C)C)N2C(=O)[C@H]3CC=CC[C@H]3C2=O)nc1C	778428565	NMEKOWQEVDIBBD-UXLLHSPISA-N	443.504	1.771	50	20	IDGD	
Cc1c(Br)cc(C(=O)NNC(=O)CNC(=O)OC(C)(C)C)cc1[N+](=O)[O-]	778437618	HKNPFWCJCLGTBZ-UHFFFAOYSA-N	431.243	1.951	50	20	IDGD	
COc1ccc(CN2CCC(CNC(=O)NNC(=O)CNC(=O)OC(C)(C)C)CC2)cc1	778635317	HYSURAWJMCDIBG-UHFFFAOYSA-N	449.552	1.762	50	20	IDGD	
O=C(CN1CCC(n2ccc(C(F)(F)F)n2)CC1)NNC(=O)c1cccc([N+](=O)[O-])c1	778968914	YGYGAFVIZOAUCU-UHFFFAOYSA-N	440.382	1.908	50	20	IDGD	
COc1ccc(NNC(=O)[C@@H](CCS(C)(=O)=O)NC(=O)c2ccc(Cl)cc2)nc1	781515587	FJZGCUALYZWJKH-OAHLLOKOSA-N	440.909	1.420	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)[C@@H]1C[C@@]12CCN(C(=O)OC(C)(C)C)C2	781969185	CZELMDGEKZNLIX-RNODOKPDSA-N	426.514	1.696	50	20	IDGD	
Cc1cccc(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)c1Br	782894166	NRJIYIBNRHPHKB-UHFFFAOYSA-N	444.289	1.973	50	20	IDGD	
CC(C)Oc1ccc(NC(=O)C(=O)NNC(=O)CNC(=O)c2cccs2)c(Cl)c1	784004538	XRDOWISESSBPJG-UHFFFAOYSA-N	438.893	1.705	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)Nc2ccn(C3CCN(C)CC3)n2)cc1	786678743	GUFKWMMUZPTZBU-HNNXBMFYSA-N	428.493	1.973	50	20	IDGD	
CCOC(=O)c1ccc(C)c(S(=O)(=O)NNC(=O)c2cc(Br)c[nH]2)c1	788742594	BWUZZSXMQINNGJ-UHFFFAOYSA-N	430.280	1.886	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)[C@H]3CCC(=O)c4cccn43)cc2)CC1	790001331	WVKKHCOKLXYZNZ-GOSISDBHSA-N	431.518	1.085	50	20	IDGD	
Cn1nc(SCC(=O)NN=CCCc2c(Cl)cccc2Cl)c(=O)n(C)c1=O	790155876	UGLABVYZTJYTHK-UHFFFAOYSA-N	430.317	1.613	50	20	IDGD	
O=C(NNC(=O)N1CC(=O)N(C2CC2)C1)[C@H]1Cc2ccccc2CN1Cc1ccccc1	790505795	ZDDRCDPZXUXFFF-OAQYLSRUSA-N	433.512	1.618	50	20	IDGD	
CO[C@@H]1CCOc2c(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc3ccc(F)cc3)cccc21	790952897	XLDDZMLDAJJOAA-SJKOYZFVSA-N	431.420	1.849	50	20	IDGD	
C[C@](O)(Cn1cc(C(F)(F)F)ccc1=O)C(=O)NNC(=O)c1cccc2ncccc12	792149939	SUXBGMCYSUPBBW-IBGZPJMESA-N	434.374	1.628	50	20	IDGD	
COc1cc(C(F)(F)F)ncc1NC(=O)C(=O)NNc1cccc(S(C)(=O)=O)c1	792265900	VCCBJDVVBXUORU-UHFFFAOYSA-N	432.380	1.594	50	20	IDGD	
CNC(=O)c1cc2cc(NC(=O)C(=O)NNC(=O)COc3cc(C)ccc3C)ccc2[nH]1	792352721	HPHIUPAKQJGMHX-UHFFFAOYSA-N	437.456	1.309	50	20	IDGD	
COC(=O)c1ccc(NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c(N(C)C)c1	792408902	DFIZFETVJXJUIF-UHFFFAOYSA-N	438.444	1.253	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)[C@H]2Cc3cc(Br)ccc3O2)C[C@@H](C)O1	792629482	POSSMLFIULHAQF-BFQNTYOBSA-N	426.311	1.399	50	20	IDGD	
CC(C)(C)OC(=O)Nc1ccc(CC(=O)NNc2nccc(N3CCOCC3)n2)nc1	792650737	RUXCLHCAFCATPB-UHFFFAOYSA-N	429.481	1.741	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H]2C[C@@]2(C=NNC(=O)Cc2csc(N3CCOCC3)n2)C1	792939073	DEMVPMTXCQCYLB-JLTOFOAXSA-N	435.550	1.881	50	20	IDGD	
CSSCCNC(=O)C(=O)Nc1cc(S(=O)(=O)N(C)C)ccc1OC(C)C	793078615	FWSPQWSGGQXHRS-UHFFFAOYSA-N	435.593	1.790	50	20	IDGD	
O=C(CNS(=O)(=O)c1c[nH]c2ncccc12)NNC(=O)c1c(Cl)cccc1Cl	796076921	JVNKAEPKPLCDFW-UHFFFAOYSA-N	442.284	1.609	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)CN2CCC[C@@H](CNC(=O)OCc3ccccc3)C2)cc1	796466466	QHTONNFZHAQPID-FQEVSTJZSA-N	449.511	1.958	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccc(F)c(N2CCOC2=O)c1	797003048	VTUUOOBXARVCMY-UHFFFAOYSA-N	430.392	1.120	50	20	IDGD	
O=C(NCC(F)(F)F)NNC(=O)[C@]12CCC(=O)N1c1ccccc1C(=O)N2C1CC1	798314239	CNMGMPGMWXBOCZ-KRWDZBQOSA-N	425.367	1.021	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2sccc2S(N)(=O)=O)ccc1OCCC(C)C	800577569	SASYIAJUNVOMTQ-UHFFFAOYSA-N	441.531	1.904	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)NCc2cccc(CS(N)(=O)=O)c2)c(Cl)c1	800717730	PXAOOOVGRFTMGS-UHFFFAOYSA-N	425.898	1.973	50	20	IDGD	
COCCCOc1ccc(CNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1	805068750	RAUQEGOPFJGMEC-UHFFFAOYSA-N	442.520	1.639	50	20	IDGD	
CN(C)S(=O)(=O)C[C@@H](NC(=O)NN=c1sc2ccccc2n1C)C(F)(F)F	805767554	LGFKRXUNVIKJEI-LLVKDONJSA-N	425.458	1.177	50	20	IDGD	
O=C(NNC(=O)c1ccccn1)C(=O)Nc1cc(C(F)(F)F)cc(Br)n1	806972244	MYLURXQSAJRSIY-UHFFFAOYSA-N	432.156	1.658	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cnn(CC(C)C)c2C2CC2)cc1OC	806972928	RYGSKSYGPKLITN-UHFFFAOYSA-N	429.477	1.833	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)C(=O)Nc1cc(F)c(N2CCOCC2)cc1F	806980484	QJCPJHZNXHOEBG-UHFFFAOYSA-N	432.427	1.438	50	20	IDGD	
Cc1cc([N+](=O)[O-])ccc1NNC(=O)C(=O)Nc1cccc(OCC(=O)N2CCCC2)c1	807456849	VTPIHARLDMKXOW-UHFFFAOYSA-N	441.444	1.986	50	20	IDGD	
Cc1cc(Cl)ccc1S(=O)(=O)NCCNC(=O)NNC(=O)c1ccccc1O	807547693	KBZUKGDVGNKEQZ-UHFFFAOYSA-N	426.882	1.277	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccccc1F)NNc1nc(-c2ccccn2)nc2c1CCC2	810442252	LYHPTHOJISTXNN-UHFFFAOYSA-N	442.476	1.588	50	20	IDGD	
CC(C)N(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)Cn2cnc3ccccc32)cc1	811956487	QRINCUDMTGOLKX-UHFFFAOYSA-N	429.502	1.526	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)c2cccc(N3CCCS3(=O)=O)c2)cc1	812731702	QZTZDSNJMXRANH-UHFFFAOYSA-N	438.531	1.234	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)N3CCN([C@H](C)C(=O)NC4CC4)CC3)cc2C1	813496838	SUUIAEDKLYWPEO-ZIAGYGMSSA-N	433.578	1.512	50	20	IDGD	
O=C(CCc1ccccc1O)NNS(=O)(=O)CCCCN1C(=O)c2ccccc2C1=O	814210956	MJIKAUPFHRJKSS-UHFFFAOYSA-N	445.497	1.352	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2O)cc1)[C@H]1C[C@@H]1C	815569329	PADCDTGSLNEULM-GUYCJALGSA-N	440.456	1.318	50	20	IDGD	
O=C(C[C@H]1SC(N2CCCCC2)=NC1=O)Nc1cccc(C(=O)NNc2nc[nH]n2)c1	816632049	QXQHDOJBZFVDGY-CQSZACIVSA-N	442.505	1.374	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)c2cnc3n(c2=O)CCS3)c1	818757144	QOBKGWNDOUAUHU-UHFFFAOYSA-N	425.264	1.655	50	20	IDGD	
O=C(Cc1csc(-c2ccc(C(F)(F)F)cc2)n1)NNC(=O)[C@@H]1CCS(=O)(=O)C1	818854259	ZEYOBMUUEZBXDH-LLVKDONJSA-N	447.460	1.954	50	20	IDGD	
Cc1nc2ccccc2c(=O)n1CC(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12	913623819	FSCVLQOJANBHFF-UHFFFAOYSA-N	446.467	1.457	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CCS(=O)(=O)c2ccc3c(c2)CCC3)cc1C	915595534	OXHYICHAWRCKKE-UHFFFAOYSA-N	443.525	1.742	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)CNS(=O)(=O)c1ccc(Cl)cc1	915789155	SPRNALCXGSZBHM-LLVKDONJSA-N	429.857	1.372	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(-c3ccccc3)nc2O)c1	916095272	TWVXJSIFYBKVML-UHFFFAOYSA-N	440.481	1.779	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)NC1CCN(S(C)(=O)=O)CC1	916237702	FFWSPPLJJBWCPV-CQSZACIVSA-N	434.518	1.362	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NC[C@@H](C)N(C)c1ccccc1	916452377	ZFPBNAXIPSTIQQ-CQSZACIVSA-N	432.550	1.757	50	20	IDGD	
O=C(NNC(=O)c1ccc(C(=O)NNC(=O)c2ccccc2)c([N+](=O)[O-])c1)c1ccccc1	916828573	JYINFDVNTQUTQS-UHFFFAOYSA-N	447.407	1.744	50	20	IDGD	
Cn1cc(S(=O)(=O)N2CCOCC2)cc1C(=O)NNc1ccc(Cl)cc1[N+](=O)[O-]	917214048	HYONAHROUALKQO-UHFFFAOYSA-N	443.869	1.365	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2cc3ccccc3cc2O)cc1	917372052	NRDHEHMYRDKBBI-UHFFFAOYSA-N	441.465	1.488	50	20	IDGD	
O=C(NNC(=O)N1CCC(Oc2ccc(F)cc2F)CC1)c1ccc(-n2cnnn2)cc1	918002077	OKQNOHPXHUWQBY-UHFFFAOYSA-N	443.414	1.838	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)NCc2cccc(CN3CCOCC3)c2)c1	918223207	FJUHGAMGOLBPPF-UHFFFAOYSA-N	428.489	1.680	50	20	IDGD	
CS(=O)(=O)NCCCOC(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccccc1	1116479229	OHMLPBNKXOWCSX-LGMDPLHJSA-N	427.486	1.853	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)c2ccc(Br)cc2)c1	1317707424	LDGWBSPQHIXTSA-UHFFFAOYSA-N	444.282	1.913	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)CC1(CC(=O)N2CCOCC2)CCCC1	1317709768	DFNLZTFEVMXEJC-MRXNPFEDSA-N	435.496	1.940	50	20	IDGD	
CNS(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2ccc(Br)cc2)s1	1317871314	MWTQAURKOMLAES-UHFFFAOYSA-N	447.336	1.563	50	20	IDGD	
COC(=O)c1ccsc1N1CC[C@H](NC(=O)NNC(=O)c2ccc(OC)cc2)C1=O	1339818873	NBUCNXQKOUXDHH-AWEZNQCLSA-N	432.458	1.293	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccn4ccnc4c3)C2)C1	1778564647	OZQDGWZAVWJUPT-LIRRHRJNSA-N	435.322	1.809	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc4n(n3)CCC4)C2)C1	1778664558	GBTGHMROTGNQJX-UGSOOPFHSA-N	425.327	1.304	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cn3ncccc3n2)C1	1778667279	ZTPAFTMHMPVGJN-YYFZDKIDSA-N	435.912	1.111	50	20	IDGD	
Cn1ccc2cccc(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)[C@H](O)CCl)C4)c21	1778675039	CZQSHRPIZASQCK-JBYIUTFZSA-N	433.936	1.906	50	20	IDGD	
C[C@H](C(=O)N1CC[C@@]2(CN(C(=O)CCBr)CCO2)C1)n1ccccc1=O	1779267369	ZTGZPAGYIRSAPG-RDTXWAMCSA-N	426.311	1.024	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@]2(C1)CN(C(=O)c1ccc3cnccc3n1)CCO2	1779295375	KYRWKKMRNBMJIU-NRFANRHFSA-N	428.565	1.925	50	20	IDGD	
O=C(CS[C@H]1CCCCO1)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2	1779403821	MEFIMLBFGXWZGW-IIHSZXCVSA-N	434.986	1.360	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1nccc3nc[nH]c13)C2	1779543465	CKCYSUDXTRJIMM-IIBYNOLFSA-N	445.596	1.937	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@](C)(Cl)CCl)C1	1780714810	IQRLLODNWOZOLT-UWWPHRKUSA-N	429.772	1.990	50	20	IDGD	
COc1cc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)ccc1O	1780752259	KZBYHVDEVXEBKE-KZULUSFZSA-N	427.295	1.628	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)n1	1781326487	PNKVZNFAYSKSFG-PBHICJAKSA-N	443.273	1.174	50	20	IDGD	
CCN(CC)C[C@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](Cl)COC)C2	1781507823	JDUSTVGYXGLEKS-XKGFGPFHSA-N	432.005	1.732	50	20	IDGD	
O=C(c1ccc(Br)cc1O)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1781522088	AGNUKANYWDOVRA-YOEHRIQHSA-N	447.713	1.198	50	20	IDGD	
Cc1cccc(C)c1C(=O)N1CC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1	1781802175	VBHMNLAKRFZESN-QHCPKHFHSA-N	437.500	1.059	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(C4CC4)cc3)C2)C1	1782022608	JYYDXGNCZDGWGA-XMMPIXPASA-N	449.511	1.320	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cn3cccnc3n1)C2	1782175337	HOKFVWQLJULSHY-AKCHCHLHSA-N	435.912	1.111	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)n2cncn2)C1	1782532925	DEHTVALJTUBCEO-ATNYBXOESA-N	442.358	1.527	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H]2[C@H]3COC[C@H]32)C1	1782800857	RJHNMVUYQVBAAV-XPYFFNBCSA-N	429.355	1.566	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1783351551	BTBWSPPOUUJCNR-OUJBWJOFSA-N	430.112	1.680	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)C3CCN(CC)CC3)CCO2)C1	1783352387	GAQRDTWUXJIHJR-QFBILLFUSA-N	430.387	1.722	50	20	IDGD	
O=C(CCc1c[nH]c2ccc(F)cc12)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1783671663	IFENAUYXNRPZLS-NQIIRXRSSA-N	437.899	1.669	50	20	IDGD	
CSc1ccc(CC(=O)N2CCO[C@@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc1	1783938090	SSHKTFATMHGZGG-JOCHJYFZSA-N	448.589	1.154	50	20	IDGD	
Cc1nccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]3C2)n1	1783965832	VIWFUAUWPGOOPE-DSRCVFDASA-N	425.327	1.409	50	20	IDGD	
COc1ccc(F)cc1CC(=O)N1CC[C@]2(CN(C(=O)CCBr)CCO2)C1	1784080396	ZSXZVKAOUUXTKC-LJQANCHMSA-N	443.313	1.992	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cn4[nH]cnc(=O)c4c3C)C[C@@H]21	1784621079	YIXNEKJAIPWHOW-HJWJTTGWSA-N	449.939	1.332	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccnc3S)C[C@@H]21	1786404284	BTROVUUYVXHAKH-UBHSHLNASA-N	428.352	1.749	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nc4ccccc4[nH]3)C[C@@H]21	1786407231	SJSMIOQABNFQDE-XEZPLFJOSA-N	435.322	1.941	50	20	IDGD	
Cc1nc(N)sc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)Br)C[C@@H]21	1786919157	MEYICEMBLXSCEA-QTKMDUPCSA-N	431.356	1.410	50	20	IDGD	
Cn1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]3C2)c(C(F)(F)F)n1	1787447944	MKTZLWIPHJRAGN-PZEZNAACSA-N	426.798	1.567	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(CO)c(F)c3)C[C@@H]21)[C@H](F)Br	1789926968	MHTLYFDQPVQZOU-SDADXPQNSA-N	447.276	1.602	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3cnccn3)C[C@@H]21	1790963366	GPANNVKHIKWBLX-LLLHUVSDSA-N	439.354	1.562	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3n[nH]c4c3CCCC4)C[C@@H]21	1791057427	LXNFIJNWKVYMKS-DSPQJCBJSA-N	439.354	1.665	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nc(Cl)ccc3F)C[C@@H]21	1791252250	GBBIRLXQIZCCRG-MNXVOIDGSA-N	434.295	1.721	50	20	IDGD	
C[C@@H](C(=O)NC1(c2ccc(NC(=O)CCC(=O)NN(C)C)cc2)CCC1)n1cccn1	1791603375	UNKSMRVKKPSWMH-INIZCTEOSA-N	426.521	1.951	50	20	IDGD	
CC(C)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c(n1)NC(=O)CC3)C2	1792783299	NMEGKSUQLRGQFT-XOIINTDNSA-N	434.924	1.435	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3nc[nH]c3c1)C2	1792870660	HSKIZDXTEGFRSO-DPYKFYPSSA-N	435.322	1.797	50	20	IDGD	
CC(C)[C@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCC(=O)NN(C)C)C2)c1ccccc1	1793057859	AWXFIFVYIQIYOQ-YDLSIGKMSA-N	444.576	1.389	50	20	IDGD	
COc1ccccc1C(=O)N1CC(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](O)CCl)C1	1793105921	GVJCFEARNFYVON-DFGXFYAUSA-N	449.935	1.005	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)Cn1cccn1	1794203097	DDGKALGGZUESGI-DGXTUMSLSA-N	427.343	1.140	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cn[nH]c1	1796574005	LXWWCGPAHKTYHF-IANMSCASSA-N	427.411	1.498	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](F)Cl)c1n[nH]cc1I	1796807526	PQXMWZZNJHPGKA-FBSDJGSXSA-N	440.644	1.801	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(C(F)(F)F)n1	1798086075	HEJLWVOYSRBZKR-OXIQGZBJSA-N	435.830	1.557	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccccc1Cl)C2	1798439911	NJTOMXOJWOURHK-BTTYYORXSA-N	427.892	1.904	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C(F)(F)C(F)(F)C(=O)O)C2	1798625780	WQNNQXPRZZNZAE-JGPRNRPPSA-N	428.455	1.831	50	20	IDGD	
CSc1cccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)c1O	1799261567	JOVQECWNGOGWNK-BJWYYQGGSA-N	440.330	1.360	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(N3C(=O)C=CC3=O)cc1)C2	1799271622	VAUFPBCMEGWNCH-DOHHPOSVSA-N	445.903	1.337	50	20	IDGD	
Cc1ncc(/C=C/C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Br)s1	1799352280	NULQFGCCQMBCDU-ZTJYCSGJSA-N	432.315	1.745	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1snnc1C1CC1)C2	1800640896	LGYRRKYHTJVCJB-YVECIDJPSA-N	443.367	1.792	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1c(F)ccc(O)c1F	1800657438	XIBGCMCYFWICQO-ZSBIGDGJSA-N	445.426	1.235	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc(F)c(F)c1)C2	1800755965	AZXMCHAZCBETOU-MMPOEDRJSA-N	431.277	1.880	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(OC)c(OC)c1)C2	1800978727	IKZJGPJVVWNMJM-BASYENTBSA-N	426.897	1.161	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1nc3ccccc3n(C)c1=O)C2	1802273200	LZBAZOXBSVEQCV-LXTVHRRPSA-N	432.908	1.439	50	20	IDGD	
Cc1ccc(CCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CCC(=O)NN(C)C)c(C)n1	1802339891	SBXFXDQEKVOYLH-ACDBMABISA-N	429.565	1.642	50	20	IDGD	
O=C1Cc2cc(C(=O)N3CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]3c3cccnc3)ccc2N1	1803143233	XMINEGIZZKLBSY-MOXGXCLJSA-N	442.903	1.496	50	20	IDGD	
Cc1ncoc1C(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1805863047	UHQOYILSRRTYLU-VQIMIIECSA-N	428.493	1.071	50	20	IDGD	
O=C(/C=C/c1cccnc1)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1	1809969388	UJIFXPKCIHVJNE-RUDMXATFSA-N	433.317	1.320	50	20	IDGD	
CCOC(CC(=O)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1)OCC	1809972215	FBKVADVBJNMDNA-UHFFFAOYSA-N	446.353	1.000	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CCN(C(=O)CN)[C@@H]1c1cccnc1	1811357937	CMSKEDWEJXDNPB-MGPUTAFESA-N	441.444	1.193	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2nn(C)c3c2CCC3)[C@@H]1c1cccnc1	1813030162	GOBYFTBACCDNCD-RIFZZMRRSA-N	445.951	1.877	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)CCc2ccc[nH]2)[C@@H]1c1cccnc1	1813071139	NUMWFMAUWNJGOM-FDDCHVKYSA-N	440.548	1.421	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2cccc(F)n2)[C@H]1c1cccnc1	1813074233	RKZVYYWIGBIHMB-IERDGZPVSA-N	442.495	1.308	50	20	IDGD	
O=C(Cc1cccs1)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1817576252	JMXDXJQJFLCNDW-GOSISDBHSA-N	438.318	1.700	50	20	IDGD	
O=C(Cc1ccc2ncnn2c1)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1	1820699527	KEBLNUCCXUSYRO-GJZGRUSLSA-N	431.884	1.287	50	20	IDGD	
CN1C(=O)CC[C@H]1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](F)Br)CC2	1823051227	GSSYQHAILQDLTO-VFWDIBGWSA-N	433.303	1.366	50	20	IDGD	
O=C(/C=N/O[C@@H]1CCCCO1)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)CC1	1824185727	GQPXJQZRXCCJGZ-BRBGHOHISA-N	429.945	1.735	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CN2C(=O)CNC2=O)CC1	1824899328	REYSXCLFIIJSOO-HOTGVXAUSA-N	426.945	1.565	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2cccnc2)CC1	1825280473	YQKBBPRZGBLVME-VMMLISQSSA-N	447.344	1.708	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ncccn2)CC1	1826014178	KETOZOVMOIQBOP-SFHVURJKSA-N	437.504	1.022	50	20	IDGD	
COC(=O)c1ccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)[C@@H](O)CCl)CC2)cn1	1827789341	WARCVTKBHGGMQL-ROUUACIJSA-N	437.924	1.701	50	20	IDGD	
COC(C)(C)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1	1828922077	LDSNOXMEICSTMF-GOSISDBHSA-N	431.537	1.343	50	20	IDGD	
CN[C@H](CC(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@](C)(Cl)CCl)CC1)C(=O)O	1830317643	WQBKIJUJADHSJF-CLCXKQKWSA-N	436.380	1.905	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@H](F)Br)CC1	1830381586	HVCZKYVWFVRPLV-XPKDYRNWSA-N	432.334	1.987	50	20	IDGD	
Cn1c(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)cc2ccccc21	1830433278	MGAIGLORHXDGCG-CTNGQTDRSA-N	437.899	1.712	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)C(C)=O)CCO2	1831130974	RMOKEWJFIWFYII-KDOFPFPSSA-N	433.343	1.232	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCN3CCCCC3)C2)C1	1831647031	PWUXSBXVFBYUSK-GHTZIAJQSA-N	429.989	1.726	50	20	IDGD	
O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)CCCC(F)(F)F)CCO2	1832257366	RDKUTTNUCODYQY-OAHLLOKOSA-N	445.276	1.960	50	20	IDGD	
CC(C)NCCC(=O)N1CCC(N2CCC(NC(=O)CCBr)CC2)CC1	1834421570	AFVUBYIWSRTNLE-UHFFFAOYSA-N	431.419	1.731	50	20	IDGD	
COc1ncc(C(=O)N2CCC(N3CCC(NC(=O)[C@H](F)Cl)CC3)CC2)cc1F	1835078718	UDBWZMGEHGOHLO-INIZCTEOSA-N	430.883	1.949	50	20	IDGD	
CCNC(=O)N[C@@H](C)C(=O)NC1CCN(C2CCN(C(=O)[C@H](Cl)CC)CC2)CC1	1835709007	NOQTWKHOJFVITG-WMLDXEAASA-N	429.993	1.283	50	20	IDGD	
Cn1ccc(=O)cc1C(=O)N1CCC(N2CCC(NC(=O)CO[Si](C)(C)C)CC2)CC1	1835836120	KFVYMDQWSOFSQI-UHFFFAOYSA-N	448.640	1.422	50	20	IDGD	
Cc1ncncc1C(=O)NC1CCN(C2CCN(C(=O)[C@H](C)Br)CC2)CC1	1835974948	SMDCHNQWRZYTQM-ZDUSSCGKSA-N	438.370	1.754	50	20	IDGD	
CC(C)c1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)n[nH]1	1838698696	UXLCZHVJIFRYET-RHSMWYFYSA-N	447.305	1.294	50	20	IDGD	
O=C(CCc1ccco1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839197761	HWRYJCBQVYBWIZ-NVXWUHKLSA-N	433.274	1.359	50	20	IDGD	
O=C(c1ccc(-c2cc[nH]n2)cc1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1839396100	WXTJWIALMMIEET-XLIONFOSSA-N	436.871	1.681	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H]3Cc4ccccc4N3)CCO2)C1	1839733681	UUWDUERDRCBCSE-LZNRXBQRSA-N	435.952	1.887	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)C3(COC)CC3)C2)C1	1839962661	NBPUDRHROJOLIX-KBXCAEBGSA-N	433.343	1.043	50	20	IDGD	
O=C(c1cnc2ccc(F)cn12)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840189859	PXFPETYKAMTJPP-GOSISDBHSA-N	445.278	1.347	50	20	IDGD	
Cc1nccn1[C@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1840489105	JXHVGRHFRRGSJF-FOIQADDNSA-N	426.945	1.474	50	20	IDGD	
O=C([C@@H](F)Cl)N1CCOC[C@]2(C1)CN(C(=O)C1(c3ccccc3F)CC1)CCO2	1840858661	LEWKCYQJCDXGDD-APWZRJJASA-N	428.863	1.848	50	20	IDGD	
COc1cc(C(=O)N2CC3(CCCN3C(=O)[C@@H](O)CCl)C2)cc([N+](=O)[O-])c1OC	1841353299	OWUGMGMOOWAKHU-ZDUSSCGKSA-N	427.841	1.029	50	20	IDGD	
CCc1cc(C(=O)N2CCCC23CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C3)n[nH]1	1843145421	YSYPDOGHRATIAN-HNNXBMFYSA-N	439.944	1.921	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)c2csc(-c3ccccc3)n2)C1	1843570639	JEYLPDAOBXLLHY-UHFFFAOYSA-N	447.325	1.621	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCCC12CN(C(=O)Cc1cn3c(nc1=O)SCC3)C2	1845171953	GKNCCMGSCRARAU-KRWDZBQOSA-N	445.372	1.331	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@]2(NC(=O)OC(C)(C)C)CCOC2)C1	1845208650	RAIHCVWIVNYXKC-VBKZILBWSA-N	429.945	1.891	50	20	IDGD	
O=C1C[C@H](C(=O)N2CC3(CCCN3C(=O)[C@H](Br)Cc3ccccc3)C2)CN1	1845942385	CRZXEQVBRJKOJZ-JKSUJKDBSA-N	434.334	1.332	50	20	IDGD	
CC/C=C(\C)C(=O)N1CCCC12CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2	1846759272	KQQLXVMCCRVEGG-GIJQJNRQSA-N	427.549	1.892	50	20	IDGD	
Cc1nnsc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1848100153	SEDIKTFJXDZWPT-AVGNSLFASA-N	443.957	1.794	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2cccc(C(=O)NNC(=O)c3ccccc3F)c2)C[C@H](C)O1	15794808	RBPQHAINENRDNB-KBPBESRZSA-N	435.477	1.698	50	20	IDGD	
Cn1nc(C(=O)NN=C2C(=O)Nc3cccc(Br)c32)c2ccccc2c1=O	17651010	YZINJRUFYRNCBO-UHFFFAOYSA-N	426.230	1.782	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(C(=O)NNC(=O)Cc2c[nH]c3ccccc23)cc1	26070458	SIUBSORBUUERMA-UHFFFAOYSA-N	430.486	1.096	50	20	IDGD	
CN(C)C(=O)[C@@H]1CCCN1CCCNC(=O)NNC(=O)CC12CC3CC(CC(C3)C1)C2	726278354	WESZEXAQVZTASB-HJGBXLFDSA-N	433.597	1.866	50	20	IDGD	
CCOc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)C(=O)NC(C)C)c2)cc1	726613831	RTGHLQPBFGDVBZ-UHFFFAOYSA-N	448.501	1.172	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Cc2csc(C(C)(C)C)n2)cc1	726767264	MHKLGXZZBCWOAL-UHFFFAOYSA-N	438.575	1.760	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(C)c(C(=O)NNC(=O)CCCc2ccccc2)c1	727741582	ZZCMAMXFTSPHFR-UHFFFAOYSA-N	433.530	1.704	50	20	IDGD	
CN(CCO)S(=O)(=O)c1ccc(C(=O)NNC(=O)c2c(Cl)cccc2Cl)cc1	728313102	BHIKZWYRXBKQCR-UHFFFAOYSA-N	446.312	1.681	50	20	IDGD	
COc1ccc(N(C(C)=O)c2nc(C=NNC(=O)[C@H](C)NS(C)(=O)=O)cs2)cc1	728436475	PCKZXLGWYMNOGT-NSHDSACASA-N	439.519	1.224	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)c1cc(S(=O)(=O)NC2CC2)c(Cl)cc1Cl	728893443	MUQGLQUTNOWKSA-UHFFFAOYSA-N	443.312	1.833	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)c1ccc(I)c(F)c1	729181576	XNAPOTHZRSMIFF-UHFFFAOYSA-N	431.161	1.214	50	20	IDGD	
CC(=O)N1CCC(CNC(=O)NNC(=O)COc2ccc(Br)cc2)CC1	729624243	RSHUKXVVTMCYPO-UHFFFAOYSA-N	427.299	1.417	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)c2cc(Cl)c(-n3cnnn3)cc2OC)cn1	729691961	GLVHQAXJQSNECS-UHFFFAOYSA-N	434.869	1.359	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)c1ccc(N2CCOCC2)c(F)c1	730204793	DJFKFYIJJWTPSH-UHFFFAOYSA-N	435.481	1.030	50	20	IDGD	
O=C(CCCc1ccc2nc(O)[nH]c2c1)NNC(=O)c1csc(N2CCOCC2)n1	730204985	HVJIAZMRYQAPFN-UHFFFAOYSA-N	430.490	1.346	50	20	IDGD	
CC[C@H](C)C(=O)N1Cc2ccccc2C[C@H]1C(=O)NNC(=O)COc1ccccc1O	730781229	IHSQJEVZVDBXSI-YJBOKZPZSA-N	425.485	1.918	50	20	IDGD	
N#Cc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)Cc3ccccc3F)CC2)cc1	731328789	YHTYUYJONWQIBQ-UHFFFAOYSA-N	444.488	1.488	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)[C@@H](CCSC)N1C(=O)[C@H]2CCCC[C@H]2C1=O	731491148	CQHPEWVHFGCDAM-IJEWVQPXSA-N	433.530	1.753	50	20	IDGD	
COc1ncnc(OC)c1C(=O)NNC(=O)[C@@H](C)Oc1cccc(Br)c1	732052723	ZFEKFPMHOOXSSL-SECBINFHSA-N	425.239	1.485	50	20	IDGD	
COc1ccc2c(ccn2CC(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c1	732325643	QGIMRSKTDYKBBJ-UHFFFAOYSA-N	426.385	1.563	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)/C(=C/c1cccnc1)NC(=O)c1ccccc1	733145652	VOQDLDKKUGUFQA-ATVHPVEESA-N	449.492	1.491	50	20	IDGD	
Cc1ccc(C#N)cc1S(=O)(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	734118026	BRDGBKQUIGLXRX-UHFFFAOYSA-N	448.526	1.275	50	20	IDGD	
CCc1cc(NNC(=O)CN(C)S(=O)(=O)c2ccccc2)nc(-c2ccccn2)n1	734356922	NBEZQQILPZUTQI-UHFFFAOYSA-N	426.502	1.865	50	20	IDGD	
Cc1ccc(SCC(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)c(C)c1	735117189	CMBSGDLPUSVPNQ-UHFFFAOYSA-N	449.602	1.870	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)CN1CCN(C(=O)OC(C)(C)C)CC1=O	741210725	DIXDGUBHAAXQNW-UHFFFAOYSA-N	440.884	1.189	50	20	IDGD	
COCC(=O)N[C@H](C(=O)NNc1ccc(S(=O)(=O)Nc2ccccc2)cc1)C(C)C	741283299	TZWRJEJBAOGSNV-IBGZPJMESA-N	434.518	1.718	50	20	IDGD	
CCCn1nc(C(=O)NNS(=O)(=O)c2cc(C(=O)O)oc2C)c2ccccc2c1=O	742231382	DERUJDBADAUWHP-UHFFFAOYSA-N	434.430	1.029	50	20	IDGD	
COc1cc(C=NNC(=O)Cc2cc(O)nc(O)n2)ccc1OC(=O)c1ccccc1F	743447657	LHRVNDHKQSWUPK-UHFFFAOYSA-N	440.387	1.948	50	20	IDGD	
C[C@H]1CCN(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)CCN1Cc1ccccc1	743512554	WJPFTBPAVBEXQP-KRWDZBQOSA-N	434.504	1.613	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCc1cccc2cccnc12	745182951	JFZRHKAPXSHBCO-UHFFFAOYSA-N	426.502	1.981	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)N[C@@H]1CCCN(CC(F)(F)F)C1=O	746340161	WLGLFURDSQMFIM-GFCCVEGCSA-N	432.399	1.348	50	20	IDGD	
Cc1[nH]nc(C(=O)NNC(=O)c2nc(-c3ccccc3)n(-c3ccccc3)n2)c1[N+](=O)[O-]	747326371	FZZMSLMXHJZNBZ-UHFFFAOYSA-N	432.400	1.949	50	20	IDGD	
O=C(NCCNS(=O)(=O)c1cccs1)NNC(=O)NCc1ccc(Cl)cc1	747437231	FFVVZAPNOWWGOJ-UHFFFAOYSA-N	431.927	1.393	50	20	IDGD	
Cn1ccnc(NNC(=O)c2cccc(S(=O)(=O)Nc3ccccc3Cl)c2)c1=O	747942599	IKSXBOMGGYRBFX-UHFFFAOYSA-N	433.877	1.991	50	20	IDGD	
Cc1nn(C)c(C)c1S(=O)(=O)N[C@H](C)C(=O)NNc1cccc(Br)c1	748020036	FPEOTHPFHIVKBR-SNVBAGLBSA-N	430.328	1.610	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)N2CCC[C@@H]2C(=O)NNc2cccc(F)c2)o1	748090242	HEXAHPJTJBLHIJ-CQSZACIVSA-N	425.438	1.892	50	20	IDGD	
CCc1c(C(=O)NNC(=O)C(=O)N2CCCC2)cnn1-c1ccc(Br)cc1	748239559	IPNMNTQWNLDWMY-UHFFFAOYSA-N	434.294	1.581	50	20	IDGD	
CC[C@@H](Oc1ccccc1F)C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	748287354	LPISNKVGIGPXOE-CYBMUJFWSA-N	429.857	1.745	50	20	IDGD	
COc1ccccc1[C@@]1(C)NC(=O)N(CC(=O)NNc2cccc([N+](=O)[O-])c2C)C1=O	748673992	VPCYCJGMBSQMBI-HXUWFJFHSA-N	427.417	1.822	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1cnc(-c2ncccn2)s1	750193201	AOIBEHFDJYZGNS-UHFFFAOYSA-N	447.860	1.880	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)NCCNC(=O)c2cccc(Br)c2)c1	750330329	BNEVUWMSZAXFEM-UHFFFAOYSA-N	448.321	1.889	50	20	IDGD	
CCS[C@@H]1CCCC[C@H]1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	750675208	IMNASTWCTSLRKL-HZPDHXFCSA-N	428.580	1.945	50	20	IDGD	
Cc1c(C=NNC(=O)CNC(=O)c2cccs2)c(=O)n2c([nH]c3ccccc32)c1C#N	750948832	XPPAQQPJPDJHAH-UHFFFAOYSA-N	432.465	1.903	50	20	IDGD	
COC(=O)c1c(Br)ccc(NC(=O)C(=O)NNC(=O)Cc2ccccn2)c1C	753839764	DJAKUARXAUEUIR-UHFFFAOYSA-N	449.261	1.268	50	20	IDGD	
C[C@@H]1C[C@H](NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)CN1C1CC1	753942643	ATALFGZLIPCSGG-ZBFHGGJFSA-N	435.550	1.040	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)c1ccc([N+](=O)[O-])cc1F	754848161	WQHDGFBWEYALOM-LLVKDONJSA-N	438.437	1.549	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNS(=O)(=O)c1cccc(Cl)c1Br	755004277	YNSDYIBIDFHATH-UHFFFAOYSA-N	436.671	1.435	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)Nc1cccc(S(=O)(=O)NC2CC2)c1	755584629	DWYASVNRELQOOP-GFCCVEGCSA-N	436.465	1.887	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Nc2ccc(-n3cnnn3)c(C)c2)cc(OC)c1OC	755681554	WCNOKQLYVHIAGO-UHFFFAOYSA-N	427.421	1.463	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Nc2cccc(-n3nnnc3C)c2)cc(OC)c1OC	755757107	ABPPEFJOFWDIEA-UHFFFAOYSA-N	427.421	1.463	50	20	IDGD	
COC(=O)Nc1cc(NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)ccc1F	756328031	YYRHTXMUHBFEOH-UHFFFAOYSA-N	431.428	1.863	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)Nc2ccn(CCN3CCOCC3)n2)cc1	756647955	XORRVSAWUWFNDC-INIZCTEOSA-N	444.492	1.038	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2ccc([S@](C)=O)c(F)c2)c2ccccc2c1=O	756769961	HFEODTPMEGEMOX-PMERELPUSA-N	431.449	1.759	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)Nc2cnn(CCN3CCOCC3)c2)cc1	756827698	VQJGCOBVDFWSGE-MRXNPFEDSA-N	446.508	1.234	50	20	IDGD	
CCc1ncc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)cn1	757749606	UGAAXEUFOWFJIB-UHFFFAOYSA-N	432.506	1.680	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)Cc2ccc(Cl)cc2)ccc1S(=O)(=O)N(C)C	757777094	VGZHYFZAXXFLBF-UHFFFAOYSA-N	440.909	1.994	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2ccc(C(=O)N3CCOCC3)cc2C)cc1OC	757831082	QEMLCJAHYMJEOX-UHFFFAOYSA-N	442.472	1.951	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cnn1CCO[C@H]1CCCCO1	759104987	ZAILKQLJDANHGQ-FQEVSTJZSA-N	438.488	1.995	50	20	IDGD	
CN(CC(=O)NNC(=O)CCNC(=O)OC(C)(C)C)C(=O)c1ccc(Br)o1	760439225	HOGXSZGFCFCHNA-UHFFFAOYSA-N	447.286	1.176	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)NC[C@@H]2[C@H](C)OC(C)(C)N2C(=O)OC(C)(C)C)n1	762330789	QGWZBBNXQHAAEZ-LSDHHAIUSA-N	438.529	1.591	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2ccc(S(N)(=O)=O)nc2)ccc1OCCC(C)C	762736856	IWWWJARAJVRYDV-UHFFFAOYSA-N	436.490	1.237	50	20	IDGD	
C[C@@H](C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1)c1cccc([N+](=O)[O-])c1	762870503	HUNIJEWUBOVEAI-CQSZACIVSA-N	448.505	1.173	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)N[C@@H]1CCN(C(=O)C2CCCC2)C1	763527930	RBDUMNDVUFKONU-OAHLLOKOSA-N	425.530	1.413	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)C(=O)Nc1ccc(C2CC2)cc1	763530242	GFPJTRHJBYUPRL-UHFFFAOYSA-N	435.528	1.862	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(OC(F)F)c(F)c1	763663691	YDGGMBCCTVXLAH-UHFFFAOYSA-N	427.335	1.601	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2cccc([N+](=O)[O-])c2C)c2ccccc2c1=O	763786542	QBANRMIOHDMGPR-UHFFFAOYSA-N	438.400	1.033	50	20	IDGD	
CCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)c(C)c1	763851787	VONHRYSLCGNRER-CYBMUJFWSA-N	430.436	1.437	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccn(-c3ccccc3)n2)cc1	763861376	OSSHZKQRPPXCLE-OAHLLOKOSA-N	437.456	1.824	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)OC(F)(F)O3)cc1OC	763901151	LNBWLJMQIFAXPR-UHFFFAOYSA-N	437.355	1.815	50	20	IDGD	
CN1C(=O)COc2ccc(NC(=O)C(=O)NNC(=O)Cc3cccc4ccccc34)cc21	764020439	YKABKRFMHNSBIQ-UHFFFAOYSA-N	432.436	1.524	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cccc(S(C)(=O)=O)c3)n[nH]2)cc1	764110903	MMRLHIPIZVYOIP-UHFFFAOYSA-N	441.469	1.188	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)nn1-c1cccc(Cl)c1	764164854	UMKNKNXIJFPJOZ-QGZVFWFLSA-N	439.859	1.924	50	20	IDGD	
C[C@@H](C#N)Oc1ccccc1NC(=O)C(=O)NNC(=O)c1cc(Br)ccc1O	764280764	SPBJWVYJCZJFBD-JTQLQIEISA-N	447.245	1.845	50	20	IDGD	
Cc1ccc(Cn2nccc2NC(=O)C(=O)NNC(=O)CCc2ccccc2O)s1	764289953	ZUQFNEYYLMIFAB-UHFFFAOYSA-N	427.486	1.726	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3nc(C)cn3c2)cc1Br	764326370	GHRCSIGIAAHBSI-UHFFFAOYSA-N	446.261	1.814	50	20	IDGD	
CCNC(=O)COc1cccc(NC(=O)C(=O)NNC(=O)[C@@H](CC)c2ccccc2)c1	764328340	PBCRMDKDVPFBCL-SFHVURJKSA-N	426.473	1.481	50	20	IDGD	
O=C(CCCc1cccs1)NNC(=O)C(=O)Nc1ccc(S(=O)(=O)C(F)F)cc1	764342050	AFCWEUMUWBYLIH-UHFFFAOYSA-N	445.469	1.853	50	20	IDGD	
Cc1ccc(N2CCOC2=O)cc1NC(=O)C(=O)NNC(=O)c1cnn(-c2ccccc2)c1	764345230	DBGQPXWSYXHXFV-UHFFFAOYSA-N	448.439	1.537	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)C(=O)Nc1ccn(-c2cccc(C(F)(F)F)c2)n1	764356067	QEMSXUDMTKHUGB-UHFFFAOYSA-N	432.362	1.615	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C[C@@H]2CN(C(=O)OC(C)(C)C)CCO2)cc1OC	764576488	ZOWQHCZZADPZBQ-OAHLLOKOSA-N	437.493	1.881	50	20	IDGD	
N#Cc1ccc(CS(=O)(=O)CC(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)cc1	765620457	XEZPCCUVUNKFTA-UHFFFAOYSA-N	441.444	1.463	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2ccc3c(C=O)n[nH]c3c2)cc1OC	766172021	CWQMBOUPRYRHLK-UHFFFAOYSA-N	426.385	1.011	50	20	IDGD	
Cc1noc(CCCC(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)n1	766662731	DFWZDVUPUJNJHH-UHFFFAOYSA-N	434.928	1.319	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)CO[C@H]2CCCN(C(=O)OC(C)(C)C)C2)nc2ccccc21	767823399	DNGSMYJOSRLLJM-HNNXBMFYSA-N	445.520	1.679	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)C(=O)Nc1ccc(Cc2nnc3n2CCCCC3)cc1	768242056	MSFKCMDOZCSLHW-UHFFFAOYSA-N	447.499	1.698	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)[C@H](C)N3C(=O)NC4(CCCC4)C3=O)n[nH]2)cc1	768268626	QDGHXPFURXWQOS-ZDUSSCGKSA-N	438.488	1.653	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3ccc4c(c3)nc(O)n4C)n[nH]2)cc1OC	768278281	XGDULITWZOGGIS-UHFFFAOYSA-N	436.428	1.761	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)N[C@@H]2CCO[C@]3(CCSC3)C2)nc1	769235047	CULFKFISEZUYDO-RDTXWAMCSA-N	443.595	1.793	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)N2CCC(C(=O)NCCCO)CC2)c(C)n1C[C@@H]1CCCO1	769333666	FHGGCOFJKPTFPC-BHJKQYKASA-N	442.560	1.928	50	20	IDGD	
N#Cc1cccc(C(=O)NNS(=O)(=O)c2sc(C(=O)O)cc2Br)c1	769633224	NAEFVFOSQVEIJW-UHFFFAOYSA-N	430.261	1.704	50	20	IDGD	
O=C(c1ncoc1-c1ccc(F)cc1)N1CCN(S(=O)(=O)CBr)CC1	771447910	QNQJVLCNWYGPCA-UHFFFAOYSA-N	432.271	1.921	50	20	IDGD	
O=C(CCN1C(=O)CCc2ccccc21)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772188753	VZBQLOGCOJTNSF-UHFFFAOYSA-N	428.876	1.473	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)Nc2cnn(Cc3nnc4n3CCCC4)c2)c1O	772642290	WNOOHBDKMHDWGS-UHFFFAOYSA-N	426.437	1.040	50	20	IDGD	
CCCCCn1nc(C(=O)NN=C(C)c2cn(CC(=O)OC)nn2)c2ccccc2c1=O	772837256	PUWQCGICZIRCKF-UHFFFAOYSA-N	439.476	1.505	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)[C@H]1CCCN1C(=O)c1ccccc1	772896568	ADGYNUQRBQEPDY-QGZVFWFLSA-N	428.876	1.408	50	20	IDGD	
COC(=O)c1cncc(C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)c1	774336190	XJEDDEDXMJLKCQ-UHFFFAOYSA-N	445.907	1.100	50	20	IDGD	
CC(=O)Nc1cc(C)c(S(=O)(=O)NNC(=O)Cc2cccnc2)cc1Br	774617719	FUERPSRGADWNQB-UHFFFAOYSA-N	441.307	1.663	50	20	IDGD	
CCO[C@@H]1C[C@@H](NC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])[C@H]1Oc1ccccc1	776534405	PNNQAHDAKBJVES-XFQXTVEOSA-N	444.444	1.929	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)c1	776534987	YIIQLKGERRPWGB-ZDUSSCGKSA-N	438.487	1.808	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)Cc2ccc(F)cc2Br)c1	776778361	STIALXGLVVQXTL-UHFFFAOYSA-N	429.267	1.995	50	20	IDGD	
CC[C@H](C)Oc1cc(CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)ccn1	776885539	LETNJDPMHTWSQG-ZDUSSCGKSA-N	434.522	1.696	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NN=Cc1c(N2CCCCC2)nc2ccccn2c1=O	777904616	SONLLKBOVUHLII-UHFFFAOYSA-N	428.493	1.660	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)nc1C	778424353	OKVNDEJMJKBJMW-UHFFFAOYSA-N	433.490	1.503	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)CNC(=O)c1ccc(Oc2ccccc2)cc1	778517488	KDXNKTDDDRBHRP-UHFFFAOYSA-N	442.472	1.881	50	20	IDGD	
COC[C@H](C)n1ccc(NC(=O)C(=O)NNC(=O)c2ccc(COc3ccccc3)o2)n1	778709178	DABDQJHPJHBGQC-AWEZNQCLSA-N	441.444	1.662	50	20	IDGD	
O=C(NNC(=O)[C@H](O)[C@H](O)c1nc2ccccc2s1)c1cc(-c2cccs2)[nH]n1	779539422	DBNIMIVELRKKFJ-CABCVRRESA-N	429.483	1.603	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)cc1)C(=O)Nc1cnn(-c2ccccc2)c1C(F)(F)F	782834070	QEIUQGCHEXMFJU-UHFFFAOYSA-N	433.346	1.996	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2ccc(CN3CCN(C(C)=O)CC3)cc2)cc1	783034902	LRAXVAVCDOHPFN-UHFFFAOYSA-N	425.489	1.441	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNc2cc(C)cc(C)c2)cc(S(C)(=O)=O)c1	783357374	SBLQVDWTNVXTHO-UHFFFAOYSA-N	433.486	1.965	50	20	IDGD	
Cc1cccn2cc(-c3ccc(NC(=O)C(=O)NN[C@]4(C)CCS(=O)(=O)C4)cc3)nc12	783424375	CXVMPYXBYUZHRD-OAQYLSRUSA-N	441.513	1.446	50	20	IDGD	
CCn1nc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)NC(C)(C)C)cc1C1CC1	784833204	LFLPYXFOCDUKNE-UHFFFAOYSA-N	448.549	1.939	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(NC(=O)C(=O)NNc2cccc([N+](=O)[O-])c2)ccc1Cl	784833560	OJMVBEYGTCRSBY-UHFFFAOYSA-N	441.853	1.580	50	20	IDGD	
COc1cc(F)c(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)cc1OC	784835784	HVKMCQULUAVZRV-UHFFFAOYSA-N	447.391	1.921	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)C(=O)Nc2ccc(F)c(-n3nnnc3C3CC3)c2)c1	784850775	CTROBCMVABEIQA-UHFFFAOYSA-N	439.407	1.547	50	20	IDGD	
CC1CCN(c2cccc(NC(=O)C(=O)NNC(=O)c3cc([N+](=O)[O-])ccc3O)c2)CC1	785023204	LWCJDJFZVQPHQX-UHFFFAOYSA-N	441.444	1.936	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNc2c(OC)cccc2S(C)(=O)=O)c(F)c1	785336732	AVRLNVAHGIKPPL-UHFFFAOYSA-N	439.421	1.106	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)ccc1O	785613914	PIJYJYWFJHZAER-UHFFFAOYSA-N	432.908	1.633	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)c1ccc2cncn2c1	786394171	XUZNOAZXXMTVIU-UHFFFAOYSA-N	426.908	1.567	50	20	IDGD	
COC(=O)CCc1cccc(NC(=O)C(=O)NNC(=O)c2cccc(Br)c2)c1	786417183	ODCTXWXPECEWHH-UHFFFAOYSA-N	448.273	1.954	50	20	IDGD	
CN(C)[C@H]1CCOc2c(NC(=O)C(=O)NNC(=O)c3ccc(Cl)cc3O)cccc21	789733633	QRXWXYMPYLOUHD-HNNXBMFYSA-N	432.864	1.831	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc3c2OCC[C@H]3N(C)C)c(OC)c1	789734648	MPEGWXRLMQTTIZ-QGZVFWFLSA-N	442.472	1.489	50	20	IDGD	
CC(C)(C)n1cc(C#N)cc1NC(=O)C(=O)NNC(=O)c1cc(-c2cccs2)[nH]n1	789739218	INVHWAREGFCUKD-UHFFFAOYSA-N	425.474	1.966	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)Cn2ccc3ccccc3c2=O)cc1	790514592	KJBPVUBBVDFUOO-UHFFFAOYSA-N	448.508	1.884	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)NCc2cccc(N3C(=O)N[C@@](C)(C4CC4)C3=O)c2)o1	790893155	FNYROHUPZVMXQK-NRFANRHFSA-N	425.445	1.957	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Cn2c(C)nc3cc(F)c(F)cc32)c2ccccc2c1=O	792811921	PKCYPZFAGXRHMZ-UHFFFAOYSA-N	440.410	1.814	50	20	IDGD	
O=C(NNc1ccc2c(=O)[nH]ccc2c1)C(=O)Nc1ccc(NC(=O)[C@@H]2CCCO2)cc1	793068686	BGSGMYJVODLJQD-SFHVURJKSA-N	435.440	1.727	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)[C@H]2COCCN2C2CCCC2)c1	793414360	RDSOEPLEWFIKCL-MRXNPFEDSA-N	426.311	1.862	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)c2cnnn2-c2c(Cl)cccc2Cl)C[C@@H](C)O1	794898772	GGUOWOBEERPJJW-VXGBXAGGSA-N	441.319	1.834	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)c1nccn2c(Br)cnc12	795168431	PFYVONASRUPIHP-UHFFFAOYSA-N	439.295	1.499	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)Nc2ccc(NS(=O)(=O)Cc3ccccc3)cn2)n[nH]1	797653827	LDKNUOTUCOCKNM-UHFFFAOYSA-N	429.462	1.522	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3ccc4c(c3)OCC(=O)N4C)cc2C1	799259247	WKGQZODHQNBCDJ-NSHDSACASA-N	442.497	1.628	50	20	IDGD	
O=C(/C=C/c1ccccc1)NCCCNC(=O)NNC(=O)c1cc(Br)c[nH]1	799857486	PZNFOLZJAWCWFH-BQYQJAHWSA-N	434.294	1.941	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NCCCNC(=O)/C=C/c2ccccc2)c2ccccc2c1=O	800758602	BBDISPBTCRHOSK-OUKQBFOZSA-N	448.483	1.097	50	20	IDGD	
CCC[C@H](CCCS(C)(=O)=O)C(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	802068044	XTIJJFMHQONTAM-CYBMUJFWSA-N	433.552	1.484	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1N1CCOCC1)Nc1ccc2c(c1)OCO2	802101491	ONNJCJLQUOWJJW-UHFFFAOYSA-N	429.389	1.627	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2nc3c(s2)CSCC3)cc1	806974746	GKJJKJPMSLXPOW-NSHDSACASA-N	448.526	1.688	50	20	IDGD	
COC(=O)c1scc(-c2ccc(C)cc2)c1NC(=O)C(=O)NNC(=O)Cc1cc[nH]n1	806980572	ZRKDESFFZDZZOQ-UHFFFAOYSA-N	441.469	1.562	50	20	IDGD	
CNC(=O)c1cccc(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2)c1Br	806984278	HUPIVUXZKJQEPX-UHFFFAOYSA-N	436.222	1.799	50	20	IDGD	
CCS(=O)(=O)c1ccc([C@@H](C)NC(=O)NNC(=O)COc2ccc(OC)cc2)cc1	807270766	XZTKSDDKHGMHHY-CQSZACIVSA-N	435.502	1.959	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)NCc1ccncc1OC[C@H]1CCOC1	807614859	ALFQTNCHFKMOHP-GJZGRUSLSA-N	432.452	1.934	50	20	IDGD	
Cc1nc2ccc(NC(=O)C(=O)NNC(=O)c3cc(F)ccc3Br)cn2n1	810387460	XDNLSOPZDNQWCU-UHFFFAOYSA-N	435.213	1.339	50	20	IDGD	
CCCN(CC)C[C@H](C)NC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1	812701965	HTAWLCOSRSHEOK-INIZCTEOSA-N	427.571	1.066	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](NC(=O)NNC(=O)C(=O)Nc2ccccn2)CC12CCC2	813797994	YGLLQOOASRPAQE-AWEZNQCLSA-N	446.508	1.673	50	20	IDGD	
CCCN1C(=O)c2ccccc2N2C(=O)CC[C@]12C(=O)NNC(=O)c1ccccc1OC	815542567	KOYUOZYIKBQKJR-QHCPKHFHSA-N	436.468	1.845	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(C(C)=O)cc2)cc(OC)c1C	815566392	SCWAWDNUCKBUNJ-CQSZACIVSA-N	443.456	1.768	50	20	IDGD	
CCN(C)C(=O)c1cccc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)N(C)C)c1	815751626	HSUTWCJMGXZNPL-UHFFFAOYSA-N	447.517	1.111	50	20	IDGD	
CS(=O)(=O)Nc1cccc(C(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)c1	844772426	APPHTPOKLZTQSY-UHFFFAOYSA-N	425.850	1.330	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)CNS(=O)(=O)c2ccc(C)c(C)c2)cc1OC	913070652	XVFBKFQCMZNYTA-UHFFFAOYSA-N	449.529	1.840	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)NCC(=O)NNC(=O)COc2cc(C)cc(C)c2)cc1	913446159	YSQVGLANPMLVDE-UHFFFAOYSA-N	433.486	1.011	50	20	IDGD	
O=C(NNC(=O)C1CCN(S(=O)(=O)c2ccccc2F)CC1)NC1CCCCC1	913451485	YFQXVIMGPTYZHY-UHFFFAOYSA-N	426.514	1.890	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])c1	915187944	ZFONPPNTXJFHHO-UHFFFAOYSA-N	433.851	1.275	50	20	IDGD	
CC(=NNC(=O)c1ccccn1)c1ccc(S(=O)(=O)N2CCC(C(=O)O)CC2)cc1	916245326	NEXBITIEFKUGPN-UHFFFAOYSA-N	430.486	1.721	50	20	IDGD	
CN1CCN(c2ccc(CNC(=O)NNC(=O)CCSc3ccc(F)cc3)cn2)CC1	916245575	JUTAWFBYTFDGOY-UHFFFAOYSA-N	446.552	1.985	50	20	IDGD	
NC(=O)COc1ccc(NC(=O)NNC(=O)COc2ccc(Br)cc2)cc1	916375456	CZQSDHSAXIIJTQ-UHFFFAOYSA-N	437.250	1.545	50	20	IDGD	
C[C@@H](NC(=O)c1ccc(Br)s1)C(=O)NNC(=O)c1ccc2c(c1)OCO2	916728393	GWAHQJJXDKLYOM-MRVPVSSYSA-N	440.275	1.819	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(Br)c(C(=O)NNC(=O)C(C)(C)C)c1	917182412	FNIAUANZOOGNAG-UHFFFAOYSA-N	436.328	1.181	50	20	IDGD	
Cc1ccn(-c2ccc(C(=O)NNC(=O)c3ccc(Cl)c(S(N)(=O)=O)c3)cc2)n1	918203710	GXAWXDHZQHXZOQ-UHFFFAOYSA-N	433.877	1.556	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2ccc(Cl)cc2O)cc1S(=O)(=O)NC(C)C	918358433	QBHDZLGSRDZZBE-UHFFFAOYSA-N	441.893	1.816	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)Nc2ccc3c(c2)N(S(N)(=O)=O)CC3)c1C	918639117	CYHDYPQCRSMTOA-WOJGMQOQSA-N	443.529	1.863	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)c2sc(N3CCCC3)nc2Cl)c2ccccc2c1=O	920275391	BQRVKNKLSVVWNX-UHFFFAOYSA-N	432.893	1.718	50	20	IDGD	
CCCCn1c(C)cc(/C=C(/C#N)C(=O)N(C)CC(=O)N[C@H]2CCS(=O)(=O)C2)c1C	920291296	UUNJGWNKOWOAOB-LOHYDARVSA-N	434.562	1.574	50	20	IDGD	
CC(C)(C)c1ccccc1OCC(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	921181539	QGCYBXAMFZRQJL-LJQANCHMSA-N	442.468	1.894	50	20	IDGD	
Cc1nn([C@@H]2CCS(=O)(=O)C2)c(C)c1NC(=O)NNC(=O)c1ccccc1Cl	1116570319	STASAPVHGGUTRE-GFCCVEGCSA-N	425.898	1.979	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)[C@@H]2COc3ccc(F)cc3C2)ccc1Cl	1253776627	YCXKDSCWPKPHFW-NSHDSACASA-N	427.841	1.139	50	20	IDGD	
CC(C)(C)c1ccc(NNC(=O)[C@@H]2CN(Cc3nc(O)c4ccccc4n3)CCO2)nn1	1319184003	JARGWWHRGSPHST-INIZCTEOSA-N	437.504	1.767	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@H](C)COc2ccccc2F)c2ccccc2c1=O	1319914229	CGAFKFCGPQMPKX-CYBMUJFWSA-N	427.436	1.967	50	20	IDGD	
COc1ccc(N2CCN(C(=O)/C=C\C(=O)NNc3nncc(N)c3Cl)CC2)cc1	1337364646	FCMYXODYHGRUKK-SREVYHEPSA-N	431.884	1.069	50	20	IDGD	
COc1ccc(OCC(=O)N2CCO[C@@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)cc1	1779294754	MMQNNHADOZTQCI-OAQYLSRUSA-N	436.581	1.755	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C(=O)Nc2cccnc2)C1	1779489020	UKCYKCUMHOUFQX-IIBYNOLFSA-N	436.940	1.799	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1[nH]nc3ncccc13)C2	1779543819	RDMQPXNTQHOXBY-IIBYNOLFSA-N	445.596	1.937	50	20	IDGD	
N[C@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Br)C1)c1ccccn1	1780771522	JUGAEEAKRQUIJY-BASYENTBSA-N	443.317	1.286	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)CC(=O)Nc3ccc(F)cc3)C2)C1	1780883990	RKDKRUZMOCHLOH-OXQOHEQNSA-N	441.887	1.238	50	20	IDGD	
Cc1cnc2c(C(=O)N3CCO[C@@]4(CCN(C(=O)[C@H](F)Br)C4)C3)cnn2c1	1781331181	FZGICEINNUKRJH-SUMWQHHRSA-N	440.273	1.172	50	20	IDGD	
Cc1nc[nH]c1CSCC(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781331410	JWWAENQOIHSITH-GDBMZVCRSA-N	449.346	1.472	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(CCN(C(=O)C3CCC4(CC3)OCCO4)C2)C1	1782942195	SOZCHJOWJZFDLE-HXUWFJFHSA-N	440.613	1.601	50	20	IDGD	
O=C(COc1ccccc1F)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1783361874	WSLQAADUHVXOFN-NVXWUHKLSA-N	433.249	1.725	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)CS[C@H]3CCCCO3)CCO2)C1	1783534660	XUUGASZSBPRNDG-JLJPHGGASA-N	435.384	1.860	50	20	IDGD	
Cc1cc(F)c(C(=O)N2CCO[C@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc1F	1783937971	QNPPBBANEWJTLM-NRFANRHFSA-N	438.475	1.090	50	20	IDGD	
O=C(/C=C/C(=O)N1CCO[C@]2(CCN(C(=O)C(Cl)Cl)C2)C1)NCc1ccccc1	1783940591	XQJXMWUYRBKMPF-ROUKRRSUSA-N	440.327	1.493	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ncc(Cl)cc3Cl)C[C@@H]21)[C@H](O)CCl	1784084467	SYHOBNBCWGXNJU-VMXABPDPSA-N	436.723	1.581	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)COc3cc(C)ccc3C)[C@H]2C1	1785007207	JAQHNNZAXFHGKG-JPLJXNOCSA-N	438.952	1.916	50	20	IDGD	
Cc1nn(C)c(C)c1C(=O)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1	1788144904	AYCAZQOPQGDOGW-UHFFFAOYSA-N	446.316	1.778	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21)c1n[nH]c2c1CCc1ncccc1-2	1789185472	UFAXQFLWCFOUMU-FUELBLBUSA-N	447.898	1.698	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3nccc(Cl)c3OC)[C@H]2C1	1789341781	LFSCWTHOCOFYAB-JURCDPSOSA-N	446.331	1.591	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)Nc1ccc(C2(NC(=O)C[C@@H]3NC(=O)NC3=O)CCC2)cc1	1790489794	YQEUWIRUUAOFDK-UGSOOPFHSA-N	441.315	1.955	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)n3ccnc3C)C[C@@H]21	1790963970	QIZLIYXYEHVNJK-DWBZUHSKSA-N	441.370	1.906	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(Cl)cnc3OC)C[C@@H]21	1791250845	NWWRTJGDAGIBEK-DDWPSWQVSA-N	446.331	1.591	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3n[nH]c4cccc(F)c34)C[C@@H]21	1791256917	LTMWIALUPOZBOC-JFILPPLUSA-N	438.887	1.549	50	20	IDGD	
CN(C)c1cccc(OCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]3C2)c1	1791294285	UTMWJUYWASAAEJ-JQFCIGGWSA-N	444.359	1.915	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3CCC(O)CC3)[C@H]2C1	1791404271	HPKYOGXDXWBZPA-PTBAZYHNSA-N	431.371	1.548	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc(F)cc1)C2	1792867980	PCROGYVUUORNAB-LJGDNWOOSA-N	427.314	1.989	50	20	IDGD	
CC(=O)N[C@@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCl)c1cccc(Cl)c1	1793115320	IYWZEOQPJQHPOG-CWQOZTLDSA-N	442.343	1.755	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C[C@@H]1OCCc2ccccc21	1793274994	VBGKHOMWIRGNPE-KVNUXVDHSA-N	436.936	1.534	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2	1793447044	TWGNITQSTJXSQW-WJYJWUEYSA-N	437.928	1.118	50	20	IDGD	
Cc1nnc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Br)C3)s1	1794107500	GNPNNKNKWBVUOU-RDBQEKCUSA-N	435.319	1.059	50	20	IDGD	
Cc1c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)CBr)C3)nc2ccccn12	1796844464	JMVAIIBBYATZIA-FRQROOTJSA-N	449.349	1.877	50	20	IDGD	
C=C[C@H](O)C(C)(C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C(C)=N/NC(=O)c1ccc[nH]1	1796891634	BWPDMHMNRYNVPI-FDMNTINTSA-N	429.521	1.332	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1C[C@@H](O)C1	1797151314	BAXMHMABORNMIX-OOQXEWCUSA-N	431.439	1.232	50	20	IDGD	
Cc1nc[nH]c1CSCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@](C)(Cl)CCl)C2	1797663699	CACFEGNQPKACEC-ZDFLXESQSA-N	449.404	1.777	50	20	IDGD	
NC[C@H](N)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCCCCCCCCCCl	1799224359	TWRGGFYXTOBYHM-DMUMMCEESA-N	431.021	1.612	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccc(F)c(C#N)c1	1799327483	DGCDEUVTKYEBJE-UPHUGPLXSA-N	433.556	1.681	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cnc3ccccn13)C2)[C@H](F)Br	1799341998	BQHUGMXGWLGDHI-LZDSYCOUSA-N	439.285	1.157	50	20	IDGD	
Cn1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Br)c2cccnc21	1799349682	JVMSIAQJBOZEBD-BAESOJJISA-N	439.285	1.467	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(-n2cccn2)cc1	1799600587	LDMKZMVQCPVCNG-RMFSNUHRSA-N	442.592	1.927	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3sc(C)cc3[nH]1)C2	1800979751	YTVKPDFCSHQSLZ-LKQDWFRTSA-N	425.938	1.995	50	20	IDGD	
C[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(Cl)Cl)N(C)C(=O)OC(C)(C)C	1801017408	WGSVFMPUVYOCAQ-FVCCEPFGSA-N	438.352	1.635	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc3nccn3c2)[C@H]1c1cccnc1)[C@H](O)CCl	1803142672	GSEXIVDAIXHMNE-WDYCEAGBSA-N	427.892	1.649	50	20	IDGD	
Cc1csc(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)c1	1803770638	KOHAKORTWFDHIX-RXVVDRJESA-N	449.341	1.765	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)C[C@H]2NC(=O)NC2=O)[C@H]1c1cccnc1	1804341645	LBDSDXCYOPJJPT-JYYAWHABSA-N	435.912	1.093	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2cn(C)nc2OC)[C@H]1c1cccnc1	1805308896	WPBBTIGOJAZHJF-HYVNUMGLSA-N	435.912	1.397	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)c1[nH]nc2ccncc12	1808095155	LNWNKIRSGMCHRE-QANKJYHBSA-N	428.880	1.272	50	20	IDGD	
Cc1cc(C(=O)NC[C@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)cn1C	1808731145	SAEOOZJINIVZPV-XMSQKQJNSA-N	440.548	1.421	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)CSC(=N)N)[C@@H]1c1cccnc1	1812865699	ZFEHSWDUJXUZOI-VHRBIJSZSA-N	428.356	1.497	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](N)Cc2cccnc2)[C@H]1c1cccnc1	1813030567	JJIBJBOFDVHESF-MUGJNUQGSA-N	445.951	1.306	50	20	IDGD	
O=C(CSc1nc[nH]n1)NC[C@H]1CCN(C(=O)C(Cl)Cl)[C@H]1c1cccnc1	1813351855	SRWSQLZRCVIJSX-YPMHNXCESA-N	429.333	1.802	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H]2CCCCO2)n[nH]1	1814505820	HPNUUECYHQXIHN-IRXDYDNUSA-N	441.492	1.283	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@H]1CCc2nc(NC(=O)CSC(=N)N)sc2C1	1814717846	ZJIZCLUMXNBSBF-YUMQZZPRSA-N	434.385	1.713	50	20	IDGD	
COc1cnc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)[C@H](O)CCl)[nH]n2)c(F)c1	1816212531	SKJKATNLTLRBPQ-ZIAGYGMSSA-N	425.848	1.858	50	20	IDGD	
CCS(=O)(=O)CC(=O)N1CCCC[C@H]1c1cc(NC(=O)CCBr)n[nH]1	1816781794	LVBKCYJMJZJLHP-LBPRGKRZSA-N	435.344	1.622	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](F)Cl)sc2C1	1817122272	XBEKBVMUIAPOQC-YXUOLVMDSA-N	440.888	1.724	50	20	IDGD	
CC(C)O[C@H](C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1	1817476140	HHKSOKZRHHEZBI-KDOFPFPSSA-N	428.298	1.209	50	20	IDGD	
O=C(CCN1CCOC1=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](F)Br)CC2	1818694430	JTJYCGFTRWOERZ-PRHODGIISA-N	449.302	1.588	50	20	IDGD	
CCOc1ccc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@H](Cl)COC)CC3)nn1	1821760219	CGMUBMQECJWVLZ-GHMZBOCLSA-N	439.925	1.811	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](C)Br)n[nH]1	1822186761	IWKKTMYJNSGWLK-JFGNBEQYSA-N	429.319	1.632	50	20	IDGD	
C[C@H](Br)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCS(C)(=O)=O)[nH]n1	1822192384	SWBAKMUWASDRFK-JQWIXIFHSA-N	435.344	1.620	50	20	IDGD	
CCn1nc(C)cc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1	1822413935	IBGNAWYNTSSOAJ-MRXNPFEDSA-N	444.540	1.613	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CNC(=O)N(C)C)CC1	1824090282	ZYEXKAMXMACLPK-HOCLYGCPSA-N	445.402	1.908	50	20	IDGD	
O=C(COc1ccccc1F)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](O)CCl)CC2	1825455209	QAKURUUWNZFYAI-GWCFXTLKSA-N	427.885	1.873	50	20	IDGD	
CC(C)CNC(=O)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](C)Br)sc2C1	1825642301	VKZJRRWRTWBVEN-VHSXEESVSA-N	431.356	1.611	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)Cc2cccnc2)CC1	1827205353	JUFQHNHRFUMQDG-FQEVSTJZSA-N	429.565	1.617	50	20	IDGD	
NCC(=O)N1CC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCN2C(=O)OCc1ccccc1	1829359917	MECPJMMZAWRCHK-IBGZPJMESA-N	443.331	1.201	50	20	IDGD	
Cc1ncccc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2	1830537451	IQAIKUBKVCYFGM-IFXJQAMLSA-N	440.338	1.491	50	20	IDGD	
CCc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)n[nH]1	1830538985	XELLUCMGBKIYKH-SCLBCKFNSA-N	443.342	1.073	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CCCCN1C)CCO2	1830762906	LPHKCQCUCYBQNY-GPMSIDNRSA-N	446.386	1.101	50	20	IDGD	
C[C@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)c3nccn3C)CC2)CC1	1833262228	KSPKGVHKHLZOLO-CQSZACIVSA-N	440.386	1.636	50	20	IDGD	
C[C@H](C(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)CCl)CC2)CC1)c1ccc(O)cc1	1833313889	ROPVINDOTMJHRK-YWZLYKJASA-N	437.968	1.667	50	20	IDGD	
CCc1ncccc1C(=O)N1CCO[C@]2(COCCN(C(=O)CCBr)C2)C1	1833514509	OKZHARVQFBJAFD-IBGZPJMESA-N	440.338	1.499	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1	1833534544	DHKFGKBUKQIOOS-GOSISDBHSA-N	444.020	1.339	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnc(C)cn3)CCO2)C1	1834087133	BYTKNYYEWOHWPB-RDTXWAMCSA-N	441.326	1.029	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CNC(C)(C)C)CCO2)C1	1835619591	FBWVTASLCINLAM-KDOFPFPSSA-N	434.375	1.004	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC(OC2CCN(C(=O)Cn3cncn3)CC2)CC1	1836670454	FSEQNLYTXOQBNF-AWEZNQCLSA-N	442.358	1.308	50	20	IDGD	
CCCC(=O)N[C@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](Cl)CCC)C2)C1	1837671019	ZDKRBJGNILOYIS-JXXFODFXSA-N	431.961	1.155	50	20	IDGD	
CCc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)n(C)n1	1838044857	HICFQZLLRSWJCB-RBUKOAKNSA-N	447.363	1.289	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)Cn3ccnc3C)CC2)CC1	1838731082	WACXXWLOMLQNBC-GOSISDBHSA-N	426.945	1.444	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(F)cc3F)CCO2)C1	1839006832	UOFGVJQPWKDERJ-SGTLLEGYSA-N	447.276	1.818	50	20	IDGD	
O=C([C@@H](F)Br)N1CCO[C@]2(COCCN(C(=O)C3(F)CCCCC3)C2)C1	1839201484	ZDABASDWLKDTKT-CZUORRHYSA-N	439.297	1.806	50	20	IDGD	
O=C([C@@H]1[C@H]2C=CS[C@H]21)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839202355	CGSABOQOMMNEHW-MXOJCPGVSA-N	435.315	1.008	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc4ccnn4c3)CCO2)C1	1839569336	YJPLZVOXMLKHOH-NRFANRHFSA-N	434.924	1.669	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3oncc3C)C2)C1	1839966071	TZPMQAWEEPIKIE-GUYCJALGSA-N	430.299	1.227	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(Cl)nc3)C2)C1	1840149626	VWJFTHPOYYSFEQ-RDTXWAMCSA-N	432.304	1.059	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccccc3OC)C2)C1	1840153713	ACUWHRCZQUKOOT-UZLBHIALSA-N	426.897	1.019	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCCn3ccnc3)CCO2)C1	1840383264	NWWDLWLGNJIMLF-FXAWDEMLSA-N	426.945	1.527	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc([C@@H](C)C#N)c3)CCO2)C1	1840716721	RCNJIKNZUXKDBA-BPXKWBHBSA-N	449.935	1.637	50	20	IDGD	
CO[C@H](C(=O)N1CCCC12CN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2)c1ccccc1	1842788553	UIQVDNQXPNIGAK-PTFSYIGCSA-N	437.500	1.712	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)c2cc(-c3cccs3)on2)C1	1844473519	RHMFTZCHUWVVNK-UHFFFAOYSA-N	437.286	1.214	50	20	IDGD	
O=C(c1cc(Cl)c2nncn2c1)N1CC2(CCCN2C(=O)[C@@H](F)Br)C1	1845218355	ZGCREBDYKJMIGD-LLVKDONJSA-N	430.665	1.890	50	20	IDGD	
CC(C)Oc1ccc(C(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)c(F)c1	1845525423	BEFDVLMAYJUGHZ-UHFFFAOYSA-N	440.280	1.424	50	20	IDGD	
CCOC(=O)c1ncn2c1CC[C@H](C(=O)N1CCCC13CN(C(=O)[C@@H](F)Cl)C3)C2	1845862476	ULUJWUZFPKSRJD-SWLSCSKDSA-N	426.876	1.360	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC2(CCCN2C(=O)[C@H]2CCCS2(=O)=O)C1	1845915015	UUKVJOVDDCTBPD-IKFRKZOMSA-N	449.479	1.652	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC12CN(C(=O)[C@H]1CC(=O)N(C3CCCC3)C1)C2	1846175810	UDZDBJUCBYFHKD-KGLIPLIRSA-N	426.355	1.764	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)/C=C/c2cc(F)c(F)c(F)c2)C1	1846274209	CFYBZMDQWQJUPJ-AATRIKPKSA-N	444.218	1.314	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)CS(=O)(=O)c1ccc(C)cc1)C2	1846361147	BCGGIBVPJGPMEV-MRXNPFEDSA-N	428.938	1.226	50	20	IDGD	
CSC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)[C@H](O)CCl)C2	1846951133	ZXTMYAJBHKUBHB-QWHCGFSZSA-N	435.974	1.046	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CCO2)C1	1847152840	VHVFSOKLJUVSLM-LSDHHAIUSA-N	445.944	1.080	50	20	IDGD	
O=C1CC[C@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](Br)Cc2ccccc2)CN1	1847323868	BPFPJRCKIVSBQD-XSLAGTTESA-N	448.361	1.721	50	20	IDGD	
O=C(c1cnc2ccc(C(F)(F)F)cn12)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl	1847563599	MQIQEUVMVTXDHK-SGMGOOAPSA-N	430.814	1.768	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CCN1C(=O)c2ccccc2C1=O	1848087247	QRPVKZGKYZNKAZ-ULQDDVLXSA-N	433.892	1.128	50	20	IDGD	
N#Cc1ccc(-c2ccc(OCC(=O)NNC(=O)c3ccc(OCC(N)=O)cc3)cc2)cc1	16593571	FUNRGUQTMIBFCY-UHFFFAOYSA-N	444.447	1.929	50	20	IDGD	
O=C(CN1C(=O)COc2ccc(Cl)cc21)NNC(=O)c1cc(Br)c[nH]1	23445593	IPAWTEXEIQVZIS-UHFFFAOYSA-N	427.642	1.617	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)c1ccc(S(=O)(=O)NC2CC2)cc1	24124421	JXLBSKBZXHSJOV-UHFFFAOYSA-N	427.280	1.293	50	20	IDGD	
Cc1c(NC(=O)[C@H](C)SCC(=O)NNC(=O)CC(C)C)c(=O)n(-c2ccccc2)n1C	25635509	YWZSOGZZFGSOJE-HNNXBMFYSA-N	447.561	1.738	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCO[C@H](c3ccc(F)c(F)c3)C2)cc1OC	727438240	YNNZUIOTZQCPPZ-IBGZPJMESA-N	435.427	1.817	50	20	IDGD	
CN1CCN(C[C@H](NC(=O)NNC(=O)c2ccc3c(c2)OCCO3)c2ccccc2)CC1	727944500	DMAVKVVKYMHYLQ-IBGZPJMESA-N	439.516	1.391	50	20	IDGD	
COc1ccc(C(=O)Oc2ccc(C=NNC(=O)[C@H](C)NS(C)(=O)=O)cc2OC)cc1	728436820	SWLSUJZRUUTBKY-ZDUSSCGKSA-N	449.485	1.311	50	20	IDGD	
Cn1c(=O)oc2cc(S(=O)(=O)NNC(=O)c3cc(F)ccc3Br)ccc21	728509882	RFYKVNLMMLILLU-UHFFFAOYSA-N	444.238	1.656	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)CN2C(=O)[C@@H]3CCCC[C@H]3C2=O)c1	728528479	JCCXRWRINCNDOW-VXGBXAGGSA-N	438.278	1.394	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)Cc2nc(-c3ccsc3)oc2C)n1	728730876	ZAPOBXQMAKFPEY-UHFFFAOYSA-N	434.499	1.952	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2cn(-c3ccccc3Cl)nn2)n1	728734165	WAEMVHCNWBXHKK-UHFFFAOYSA-N	434.865	1.233	50	20	IDGD	
CC(C)(C)C1CCC2(CC1)NC(=O)N(CC(=O)NNC(=O)c1cccc(C#N)c1)C2=O	728871694	AUAKIHPEBKHEOQ-UHFFFAOYSA-N	425.489	1.846	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1cnc(S)n1-c1ccc(F)cc1	728889952	UNEIGZIQOKLODC-UHFFFAOYSA-N	441.492	1.768	50	20	IDGD	
C[C@H](NC(=O)CCC(=O)C(C#N)=C1N(C)c2ccccc2N1C)[C@@H](C)N1CCOCC1	729447756	ZYLHGHODTFVHRF-DLBZAZTESA-N	425.533	1.882	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)c1ccc2c(c1)S(=O)(=O)N(C1CC1)C2=O	729453801	ACUGDDUDHUBRGQ-UHFFFAOYSA-N	438.465	1.409	50	20	IDGD	
CC(C)(C)C(=O)N1CSC[C@@H]1C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	730077260	QKEZBPWYLOYBQK-OAHLLOKOSA-N	426.564	1.518	50	20	IDGD	
COc1cc2c(cc1OC)CN(C(=O)CCCNC(=O)NNC(=O)C1CCCC1)CC2	731120018	XTZMKHQGERXPGG-UHFFFAOYSA-N	432.521	1.889	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)c1ccc2c(c1)C(=O)N(C[C@@H]1CCCO1)C2=O	731329396	KLMUGYLUWWGVTP-HNNXBMFYSA-N	425.416	1.604	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)C(=O)N1CCCC1)Sc1ccc(Br)cc1	731762662	JFNUGQHGISZJMG-NSHDSACASA-N	429.340	1.883	50	20	IDGD	
COc1ccc(C(=O)NN=C2CCN(CCN3CCOCC3)CC2)cc1Br	731934561	DLDVWTUGEQVIEH-UHFFFAOYSA-N	439.354	1.972	50	20	IDGD	
CSC[C@@H](C(=O)NNc1ccccc1S(C)(=O)=O)N1C(=O)[C@H]2CCCC[C@H]2C1=O	732304533	ZNQMUKYSBCGMEM-GUTXKFCHSA-N	439.559	1.440	50	20	IDGD	
CCOc1ncc(C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1Cl	732750432	PGDIQELGLUBQQX-UHFFFAOYSA-N	440.909	1.524	50	20	IDGD	
CCOC(=O)N1CCC[C@@H](C(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)C1	734824956	OOAKNRHORSVCSD-CQSZACIVSA-N	441.529	1.585	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)N[C@H](C)CN2CCN(c3ccccn3)CC2)c1	735585197	BZTBYRZOUXOEDQ-LJQANCHMSA-N	440.548	1.618	50	20	IDGD	
CC(=NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)[C@@H]1CN(Cc2ccccc2)CCO1	735610301	MRHOGIVUIIXCJK-NRFANRHFSA-N	444.557	1.944	50	20	IDGD	
CCOCC(=O)NNC(=O)NCC(C)(C)S(=O)(=O)c1ccc(Br)cc1	735763027	VSJFPRGLDUUCKG-UHFFFAOYSA-N	436.328	1.368	50	20	IDGD	
CN(C)Cc1c(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)oc2ccccc12	735833775	AUFBBIYOASQPIB-UHFFFAOYSA-N	444.513	1.820	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H]1CCC[C@H]1C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	739511817	OCRQITKZQSBPRO-CABCVRRESA-N	425.507	1.545	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNS(=O)(=O)c1ccc(N2CCOC2=O)cc1	740809845	GXDCLDXVZRIJSZ-UHFFFAOYSA-N	425.850	1.929	50	20	IDGD	
CSc1ccc(O[C@@H](C)C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1	740813340	DPPWQEXARALQOR-ZDUSSCGKSA-N	437.543	1.887	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)N[C@@H](C)[C@H](C)N2CCOCC2)cc1Cl	743627061	RTKAFLJXMHPIAR-RYUDHWBXSA-N	429.905	1.802	50	20	IDGD	
COc1ccc(CN2CCN(CC(=O)NNC(=O)c3cccc(C#N)c3)CC2)cc1F	744385482	NXJUABZOXILDTO-UHFFFAOYSA-N	425.464	1.285	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)C(=O)c2c(C)nn(-c3ccccc3)c2C)c1	744523037	XFHGILNEOSZWSI-UHFFFAOYSA-N	434.452	1.985	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)CSc2ncnc3sccc23)cc1	744610911	IMUNBKZTSNCREN-UHFFFAOYSA-N	427.467	1.659	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NCCCOC2CCOCC2)c2ccccc2c1=O	745845155	JZFCPPGMTLUPSC-UHFFFAOYSA-N	445.520	1.726	50	20	IDGD	
CCO[C@@H]1C[C@@H](NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)C12CCC2	745851915	XVZNKLQAHAKDMY-IAGOWNOFSA-N	438.550	1.294	50	20	IDGD	
COc1ccccc1N(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)N2CCOCC2)cc1	745992902	MPMPWICUVAAZMV-UHFFFAOYSA-N	448.501	1.207	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@@H](C(=O)NNC(=O)c2ccc(CSc3nncn3C)cc2)C1	746093369	PEBQYELRWOYBQN-HZPDHXFCSA-N	431.518	1.848	50	20	IDGD	
C[C@@H](CN(C)C(=O)OC(C)(C)C)C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	746823255	XBHBKZOYNCBMOL-JTQLQIEISA-N	448.929	1.251	50	20	IDGD	
CC(C)[C@H](NC(=O)NC(C)(C)C)C(=O)OCC(=O)NNC(=O)c1cccc(Cl)c1	747039360	HMUYAFFEQQLACD-HNNXBMFYSA-N	426.901	1.767	50	20	IDGD	
NC(=O)[C@H]1CCCN1Cc1cccc(NC(=O)NNC(=O)CCOc2ccccc2)c1	747099856	NIHJBPVTLGJDJH-LJQANCHMSA-N	425.489	1.758	50	20	IDGD	
Cn1ccnc1[C@@](O)(CCNC(=O)NNC(=O)c1ccc(Cl)cc1F)C(F)(F)F	747500557	KECNDZXLXSQBEO-HNNXBMFYSA-N	437.781	1.997	50	20	IDGD	
O=C(CCc1ccco1)NNC(=O)[C@H]1CCC[C@H](C(=O)NNC(=O)CCc2ccco2)C1	748260972	CBIXKRVBJPIYHF-HOTGVXAUSA-N	444.488	1.539	50	20	IDGD	
O=C(NCC1CCOCC1)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	749187584	XNLDTWUVPCITKT-UHFFFAOYSA-N	446.529	1.536	50	20	IDGD	
CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)NNC(=O)COCc1ccccc1	749399732	KOQRERSZTQHRNR-FQEVSTJZSA-N	426.448	1.718	50	20	IDGD	
COc1ccccc1N1CC[C@H](CNC(=O)NNC(=O)[C@H]2COc3ccccc3O2)C1	749932228	RQDRBMOJISCJKY-FOIQADDNSA-N	426.473	1.692	50	20	IDGD	
CO[C@@H](C)c1noc(CN2CCCN(C(=O)/C(C#N)=C\c3cc(C#N)n(C)c3C)CC2)n1	750114913	UJRPZNXLYFHBFU-PMFHANACSA-N	437.504	1.937	50	20	IDGD	
CCOc1ccccc1N1C[C@H](C(=O)NNC(=O)CNC(=O)c2cccs2)CC1=O	751211668	UIAJFLUSPFSMEV-CYBMUJFWSA-N	430.486	1.077	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@@H](C(=O)NNC(=S)N[C@@H](C)C3CC3)C2)s1	751620628	KOPNOFIHKFCXIK-GXTWGEPZSA-N	430.621	1.751	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)Cn2c(C)cc(O)cc2=O)cc(OCC)c1OCC	753082332	NLIHYXUYGGDIOS-UHFFFAOYSA-N	433.461	1.520	50	20	IDGD	
CCOC(=O)c1ccc(N2CC(NC(=O)NNC(=O)c3cc4c(s3)CCC4)C2)nc1	753278226	CPFWZLUKZDXCGV-UHFFFAOYSA-N	429.502	1.641	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNS(=O)(=O)c2cc(C(=O)O)cc(C)c2Cl)c1	753769065	IALADMVTAZBBQS-UHFFFAOYSA-N	428.850	1.987	50	20	IDGD	
CCN1CCN(c2ccc(Cl)cc2NC(=O)NNC(=O)[C@H](C)OCCOC)CC1	755447014	UYOPERADVPXRDS-AWEZNQCLSA-N	427.933	1.686	50	20	IDGD	
CCS(=O)(=O)c1ccc(NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1	755600033	RBOWRDWVAGJQLH-UHFFFAOYSA-N	432.506	1.340	50	20	IDGD	
CCNC(=O)c1ccc(C)c(NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1	755826218	ALOQEZJADHTPGJ-UHFFFAOYSA-N	425.493	1.604	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)NNC(=O)Nc2cc(Cl)c(OC)cc2OC)co1	756143254	NTTYDCRDNJSLPL-UHFFFAOYSA-N	432.842	1.325	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1ccc(OCc2cccc(F)c2)c(F)c1	756379558	PCKRFWHWZKGABB-NSHDSACASA-N	442.444	1.634	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)c1ccc(Br)cc1-n1cncn1	759251200	HYZMVCOMBQZDCF-UHFFFAOYSA-N	440.261	1.681	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)[C@@](C)(O)CN2C(=O)C(C)(C)c3ccccc32)c1	760052231	AUKZNMHOZNVNME-DEOSSOPVSA-N	439.512	1.905	50	20	IDGD	
CC1(C)C(=O)N(C[C@@](C)(O)C(=O)NNC(=O)CSc2ccccc2O)c2ccccc21	760482874	DQGPQQIOXLSOLA-JOCHJYFZSA-N	443.525	1.707	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1cccnc1OCC(F)F	760646543	CLTDXYOBOVTILV-UHFFFAOYSA-N	442.444	1.503	50	20	IDGD	
O=C(NNC(=O)c1cc2ccccc2cc1O)C(=O)Nc1ncn(Cc2ccccc2)n1	763525951	FUBKXSASDNNORY-UHFFFAOYSA-N	430.424	1.585	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c(F)c1	763531328	MOAYWJCJZJGQLJ-UHFFFAOYSA-N	427.480	1.432	50	20	IDGD	
NC(=O)CCSc1ccccc1NC(=O)C(=O)NNC(=O)c1c[nH]c2ccccc12	763536505	RWFPUMMMKCEDHA-UHFFFAOYSA-N	425.470	1.535	50	20	IDGD	
CCN(Cc1ccccc1NC(=O)C(=O)NNC(=O)c1ccc(OC)c(OC)c1)C(C)=O	763550166	JUCIENWVXOQJGD-UHFFFAOYSA-N	442.472	1.472	50	20	IDGD	
CCOc1cc2c(cc1NC(=O)C(=O)NNC(=O)COc1ccccc1OC)O[C@@H](C)C2	763645775	BALJIDMACRMCPT-ZDUSSCGKSA-N	443.456	1.582	50	20	IDGD	
CCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C)c(C)c2)c(C)c1	763664786	HATRURJJZVPADT-UHFFFAOYSA-N	426.473	1.526	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)C(=O)Nc1c2c(nn1-c1ccccc1)CCC2	763681879	KANPROLJVWTXIZ-UHFFFAOYSA-N	437.431	1.665	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)cc1C(=O)N(C)C	763728228	KFGDPANNOUMCKJ-UHFFFAOYSA-N	437.500	1.236	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])nn1[C@@H](C)C1CC1	763807700	FKKXGZTZTZYHEL-LBPRGKRZSA-N	430.421	1.236	50	20	IDGD	
CSc1ncc(C(=O)NNC(=O)CNC(=O)c2cccnc2)n1-c1ccc(F)cc1	763815057	RBZPVDVTBXUGDK-UHFFFAOYSA-N	428.449	1.319	50	20	IDGD	
CC(C)CC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)cc1	763838674	BCAULSJNSGCJNR-UHFFFAOYSA-N	430.436	1.975	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)c(C)c1	763866603	WSKVVNFSLBREAB-CQSZACIVSA-N	433.436	1.713	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)C(=O)Nc2cccc(CN3CCOC3=O)c2)cc1	763897711	CNDXPWLYRNNASZ-UHFFFAOYSA-N	442.497	1.825	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)Nc1cccc(C(=O)NC2CC2)c1	764005074	TXKVYXXJUKXJKL-UHFFFAOYSA-N	448.277	1.080	50	20	IDGD	
NC(=O)c1n[nH]c2ccc(NC(=O)C(=O)NNC(=O)Cc3cccc4ccccc34)cc12	764028901	QOZCAQSRMNPDCN-UHFFFAOYSA-N	430.424	1.144	50	20	IDGD	
C[C@@H]1Oc2ccc(NC(=O)C(=O)NNC(=O)Cc3ccc4ccccc4c3)cc2NC1=O	764083320	BEQGMNYQYNCHRO-ZDUSSCGKSA-N	432.436	1.888	50	20	IDGD	
O=C(NNC(=O)c1ccc(F)cc1Br)C(=O)Nc1ccc2c(c1)OCCO2	764085632	NEKVZUHGVDQGDU-UHFFFAOYSA-N	438.209	1.759	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2ccoc2)c(C(=O)N2CCCCC2)cc1OC	764159445	BWTJHJFLIZRFCX-UHFFFAOYSA-N	444.444	1.323	50	20	IDGD	
COCc1c(Br)cccc1NC(=O)C(=O)NNC(=O)c1cccc(C#N)c1	764237022	HZZQRQNGTFOEQG-UHFFFAOYSA-N	431.246	1.867	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)C(=O)Nc1cccc(-c2nnnn2C2CC2)c1	764239094	FGQILELAFLIOPE-UHFFFAOYSA-N	444.455	1.416	50	20	IDGD	
O=C(NNC(=O)c1cccc2ncccc12)C(=O)Nc1ccc(N2CCCC2=O)c(F)c1	764257344	CXSQDAHOZGQHGR-UHFFFAOYSA-N	435.415	1.900	50	20	IDGD	
Cc1csc(-c2ccc(NC(=O)C(=O)NNC(=O)COc3ccccc3O)cc2)n1	764278155	TZLAUAFLAPDVMT-UHFFFAOYSA-N	426.454	1.989	50	20	IDGD	
CC(C)(C(=O)NNC(=O)C(=O)Nc1cccc(-c2nnnn2C2CC2)c1)c1ccccc1	764309839	WGXGJBALAULMRQ-UHFFFAOYSA-N	433.472	1.739	50	20	IDGD	
CCOCC(=O)NNC(=O)C(=O)Nc1ccc(OC)c(NC(=O)c2cccc(F)c2)c1	764325362	KZPKWAJILXRUMX-UHFFFAOYSA-N	432.408	1.209	50	20	IDGD	
O=C(CCNc1ncc(C(F)(F)F)cc1Cl)NNC(=O)CNC(=O)c1cccnc1	764341019	AOWIYCJEDWDAHN-UHFFFAOYSA-N	444.801	1.528	50	20	IDGD	
C[C@@H]1Cc2ccccc2N1Cc1ccoc1C(=O)NNC(=O)CNC(=O)c1cccnc1	764343324	OPIKZUOEEWHQPD-OAHLLOKOSA-N	433.468	1.817	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2cccc(OC)n2)c(I)c1	765698167	LNJULGLHKBWVEC-UHFFFAOYSA-N	442.213	1.785	50	20	IDGD	
CC(Cc1ccncc1)=NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	767749795	XUELIZHLQOXUCB-UHFFFAOYSA-N	430.530	1.770	50	20	IDGD	
O=C(NN=Cc1ccc(OC(F)F)c(Br)c1)N[C@H]1CCS(=O)(=O)C1	768360052	JFWDGIPCXCEZBS-VIFPVBQESA-N	426.239	1.871	50	20	IDGD	
CS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1Br	769570996	WKNIXVHVMSGZGP-UHFFFAOYSA-N	442.247	1.836	50	20	IDGD	
C[C@@H](C(=O)NNc1ncccc1[N+](=O)[O-])N1C(=O)c2ccc(Br)cc2C1=O	769652161	CQYHNYIPHOVSOX-QMMMGPOBSA-N	434.206	1.880	50	20	IDGD	
COCCOc1ccc(C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c(Cl)c1	770208301	LPKWPSLSNOXSLY-UHFFFAOYSA-N	430.848	1.687	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)N[C@H]1CC(=O)N(c2c(F)cccc2F)C1	770753346	GIIOZKNPQCZUFM-VIFPVBQESA-N	442.220	1.805	50	20	IDGD	
CN1CCN(Cc2cccc(C(=O)NNc3nc(O)c4cnn(C(C)(C)C)c4n3)c2)CC1	770968183	SUAQQVBPIUZXQK-UHFFFAOYSA-N	438.536	1.791	50	20	IDGD	
CCOC(=O)c1cccc(S(=O)(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)c1	771605850	SJTQIXXASZVZGW-UHFFFAOYSA-N	439.877	1.143	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)[C@@H]1CCCN1S(=O)(=O)c1cccs1	772064698	NGSMPQWFJPIYID-STQMWFEESA-N	431.536	1.026	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)sc1S(N)(=O)=O	772971907	QJZAZIOEDZSYSY-QMMMGPOBSA-N	433.895	1.286	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)cc1-n1cnnn1	774003473	WHWZNUCQBIRHJF-LBPRGKRZSA-N	443.851	1.178	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)c2cnc3sc(C)c(C)n3c2=O)cc1C	775956334	YMVGTFVPKYFQGF-UHFFFAOYSA-N	448.526	1.923	50	20	IDGD	
CSCc1noc(CCC(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)n1	776214533	WTSRPOWMFBDEQP-UHFFFAOYSA-N	442.542	1.501	50	20	IDGD	
O=C(CN1c2cccc3cccc(c23)S1(=O)=O)NN=Cc1ccc(O)c(C(=O)O)c1	777428507	CDMOTBUCNRKKHU-UHFFFAOYSA-N	425.422	1.903	50	20	IDGD	
NS(=O)(=O)Cc1cccc(C(=O)NNc2ccc([N+](=O)[O-])cc2Br)c1	779140244	FXSPPPCLFQISKA-UHFFFAOYSA-N	429.252	1.903	50	20	IDGD	
O=C(NN=c1cc[nH]cc1)[C@@H]1CCCN(S(=O)(=O)c2ccc(Br)s2)C1	780757040	RDHMFEFOACSDLD-LLVKDONJSA-N	445.364	1.872	50	20	IDGD	
COc1cccc(NNC(=O)c2ccc(Cl)c(S(=O)(=O)NC[C@@H]3CCCO3)c2)n1	780772064	RUYPYDLMHVNIHL-ZDUSSCGKSA-N	440.909	1.958	50	20	IDGD	
COc1ccc(CN(CC(=O)NNC(=O)c2ccccc2)[C@@H]2CCS(=O)(=O)C2)cc1	781348657	MISHOIQUMBWBPI-GOSISDBHSA-N	431.514	1.146	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2cc(S(=O)(=O)N3CCCCC3)ccc2C)nc1	782145511	SSMSSPIDILFKJX-UHFFFAOYSA-N	447.517	1.655	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2ccc(CC(=O)N3CCSCC3)cc2)nc1	782146021	SNGNZGNABKHHLB-UHFFFAOYSA-N	429.502	1.290	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)cnc1Br	782893923	OYBPEZMFAIHQBK-UHFFFAOYSA-N	445.277	1.368	50	20	IDGD	
CN(C)c1ccc(S(=O)(=O)N(C)C)cc1NC(=O)C(=O)NNc1ccc(Cl)cc1	783339409	FWHMSYUNMBJEJG-UHFFFAOYSA-N	439.925	1.738	50	20	IDGD	
CCOC(=O)c1c(C(C)C)csc1NC(=O)C(=O)NN[C@@]1(C)CCS(=O)(=O)C1	783424886	GGRHXRSOBIFPEG-KRWDZBQOSA-N	431.536	1.185	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)C(=O)Nc1ccc(Cl)cc1C(F)(F)F	784002906	WWJROMGDSGTUQD-UHFFFAOYSA-N	432.742	1.468	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1ccc(-n2cccn2)c(Cl)c1	784004689	JGIJGXQEFQCYJC-UHFFFAOYSA-N	446.876	1.103	50	20	IDGD	
O=C(NNC(=O)[C@H]1CC=CC[C@H]1C(=O)N1CCOCC1)c1cc(-c2cccs2)[nH]n1	784456278	LROUMACTUQDEHM-UONOGXRCSA-N	429.502	1.340	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNc2ccc(Cl)nn2)cccc1C(=O)N1CCSCC1	784792409	RLFZLDCDHBBXBC-UHFFFAOYSA-N	434.909	1.709	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2cccc(Cn3cccnc3=O)c2)n1	785225339	GILOTEFFIFEHTP-UHFFFAOYSA-N	436.476	1.010	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)[C@H]1[C@H](C(F)(F)F)[C@H]2CC[C@H]1O2	785443413	XFBPBXYAXPRRJD-PSBWJHGTSA-N	440.466	1.702	50	20	IDGD	
CC(C)C[C@@H](C(=O)NNc1ccccc1S(N)(=O)=O)N1C(=O)[C@H]2CC=CC[C@H]2C1=O	788223415	JEEOBVRVIRODPN-LZWOXQAQSA-N	434.518	1.143	50	20	IDGD	
NS(=O)(=O)c1ccccc1NNC(=O)[C@@H]1CCCN(C(=O)CCOc2ccccc2)C1	788229098	SAYMGRRCXSBJMA-MRXNPFEDSA-N	446.529	1.485	50	20	IDGD	
COc1cc(C=O)c([N+](=O)[O-])cc1OCC(=O)NNc1nnc(-c2ccccn2)s1	788556903	VGKNROBRQILTKD-UHFFFAOYSA-N	430.402	1.852	50	20	IDGD	
COc1nc(Br)ccc1NC(=O)C(=O)NNC(=O)Cn1ccc2ccccc21	789585053	WHOSVMYYBUTGHN-UHFFFAOYSA-N	446.261	1.594	50	20	IDGD	
O=C(NNc1cccc(F)c1[N+](=O)[O-])Nc1ccc(S(=O)(=O)N2CCOCC2)cn1	790528776	XBSONXRCPNWMQP-UHFFFAOYSA-N	440.413	1.298	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)[C@](C)(O)Cn1cc(C(F)(F)F)ccc1=O	792024044	YJYFXAPUFKBCCB-ADLMAVQZSA-N	445.369	1.372	50	20	IDGD	
Cn1ccnc1[C@@H]1CN(C(=O)OC(C)(C)C)CCN1CC(=O)NNC(=O)c1cccs1	792910771	GVVXXOMUJWRVLA-AWEZNQCLSA-N	448.549	1.537	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)/C=C\c1ccccc1)C(=O)NNC(=O)c1cccc(C)n1	794081025	YTJAUZZDDWSPAA-FFWXCITRSA-N	448.570	1.863	50	20	IDGD	
CCNC(=O)N(C)c1cccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)c1	796990680	VHDVRDIAWKUDCV-CYBMUJFWSA-N	445.451	1.545	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc([N+](=O)[O-])c3cccnc23)cc1C	798307065	JCOCJZFGPYGLCF-UHFFFAOYSA-N	437.412	1.925	50	20	IDGD	
CCCCS(=O)(=O)N1CCC(C(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)CC1	798310112	SOOZBLXVJBUIGQ-UHFFFAOYSA-N	438.550	1.231	50	20	IDGD	
CC1=C(C(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)[C@H](C)n2ncnc2N1C	798992534	CUPPUAKICAOCIZ-AWEZNQCLSA-N	448.528	1.199	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)C2CCN(C(=O)[C@H](C)CSC)CC2)cn1	799414110	HZBKUBRENWGGCO-GFCCVEGCSA-N	425.580	1.646	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(S(=O)(=O)NNC(=O)NC2CCCCC2)c1	800830876	LQDSTUYRTJOHEJ-UHFFFAOYSA-N	432.568	1.542	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)N[C@H]2CCN(C(=O)Nc3ccccc3)C2)c2ccccc2c1=O	802500830	WKBQNAIPICXZFW-HNNXBMFYSA-N	449.471	1.184	50	20	IDGD	
C[C@H](CCNS(=O)(=O)c1ccccc1)NC(=O)NNC(=O)Cc1c[nH]c2ccccc12	802527140	VMNGCSVXDCUKPO-OAHLLOKOSA-N	443.529	1.798	50	20	IDGD	
C[C@](O)(CSc1cccc(F)c1)C(=O)OCC(=O)NNC(=O)c1cccc(C#N)c1	803803852	ZGOVFCTZZUINMR-FQEVSTJZSA-N	431.445	1.545	50	20	IDGD	
COC(=O)N(C)NC(=O)c1cccc(NS(=O)(=O)c2ccc3c(c2)OCCCO3)c1	804121960	SJYGJLJCBBPPLL-UHFFFAOYSA-N	435.458	1.992	50	20	IDGD	
O=C(CN1CCS(=O)(=O)CC1)NNc1ccc(-c2cccc(C(F)(F)F)c2)nn1	804209333	VQUWMWSIXSHRFQ-UHFFFAOYSA-N	429.424	1.336	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NNc2ccc(-n3ccnc3)nn2)ccc1C	804956035	WLONVYBCACJZOR-UHFFFAOYSA-N	429.506	1.758	50	20	IDGD	
O=C(NNc1nccnc1C1CCC1)c1cccc(S(=O)(=O)NC[C@@H]2CCCO2)c1	807783030	ZYMOFLMQVAUIEP-INIZCTEOSA-N	431.518	1.958	50	20	IDGD	
O=C(CN1CC[C@@](CO)(Cc2ccc(F)cc2)C1)NNC(=O)c1cccc([N+](=O)[O-])c1	808794289	IVZWOWWOFCJBBA-OAQYLSRUSA-N	430.436	1.422	50	20	IDGD	
COC[C@H](C)[C@H](C)C(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	812452092	BYXWDRLPSXKUSP-HOTGVXAUSA-N	433.530	1.845	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccc3c(c2)C(=O)CCC3)cc1	813033037	BBDGUHWTLJKEBS-UHFFFAOYSA-N	430.486	1.538	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)C(=O)Nc2ccc(Cl)c(F)c2)cc1	813576108	LNACQMIMBUIOGI-UHFFFAOYSA-N	428.829	1.674	50	20	IDGD	
Cc1cc(CNC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)nc(N2CCCC2)n1	813856787	MNAKALPHSZHHMN-UHFFFAOYSA-N	447.521	1.325	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1ccnc(NC(=O)C(C)C)c1	815482754	CZCFLKHHLWWSPC-UHFFFAOYSA-N	448.863	1.956	50	20	IDGD	
CNC(=O)c1cc(Oc2cccc(NC(=O)C(=O)NNC(=O)c3ccccc3O)c2)ccn1	815563964	TWCAAAJOPHAAPC-UHFFFAOYSA-N	449.423	1.339	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2c[nH]nc2C)cc1S(=O)(=O)C1CCCC1	815569534	YAELJANDXGUGGG-UHFFFAOYSA-N	433.490	1.143	50	20	IDGD	
O=C(CSc1nnc(N2CCOCC2)n1C1CC1)NNC(=O)c1ccccc1Cl	821682162	HSIYLCZCTPGICJ-UHFFFAOYSA-N	436.925	1.656	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)[C@@H]2CCCN(S(=O)(=O)c3ccc(F)cc3)C2)cc1	825600646	NOVPGEKDERRJAP-MRXNPFEDSA-N	448.520	1.794	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)CCNS(=O)(=O)/C=C\c1ccccc1	825649613	YYXFJCLWVYTYNU-OWBHPGMISA-N	432.502	1.235	50	20	IDGD	
Cc1cccc(-c2nnc(-c3ccc(C(=O)NNC(=O)[C@H]4CCS(=O)(=O)C4)cc3)o2)c1	880177260	PVQIGYNSMDBFEN-KRWDZBQOSA-N	440.481	1.908	50	20	IDGD	
CC(C)NS(=O)(=O)c1cc(C(=O)NNC(=O)c2cc(Br)c[nH]2)ccc1F	914751212	OFMVZVJYAJECJU-UHFFFAOYSA-N	447.286	1.678	50	20	IDGD	
COc1cc2cc(C(=O)NNC(=O)[C@H]3COc4ccccc4O3)[nH]c2c(OC)c1OC	914780504	NCOJSAJOSXNIHM-MRXNPFEDSA-N	427.413	1.795	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)c1nc(NCc2ccco2)ncc1Cl	915806234	JWFAAZQTZUCAFW-OAHLLOKOSA-N	429.820	1.936	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)NC[C@@H](c2ccco2)N(C)C)c2ccccc2c1=O	915897101	VGVUYZQXMAUGCE-INIZCTEOSA-N	426.477	1.817	50	20	IDGD	
C[C@@H](CN1CCCCC1)C(=O)NNC(=S)Nc1cccc(S(=O)(=O)N(C)C)c1	916117694	IEDPPSYZCZDWBU-AWEZNQCLSA-N	427.596	1.377	50	20	IDGD	
O=C(NCCCN1C(=O)NC2(CCCCC2)C1=O)NNC(=O)c1ccc2c(c1)OCCO2	916266940	PGLPWLSDRRZMIY-UHFFFAOYSA-N	445.476	1.047	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)c1cccc(Cn2ccnc2)c1	916294640	QVYDHQXXVUHHGO-UHFFFAOYSA-N	432.528	1.905	50	20	IDGD	
O=C(CCSc1ccc(F)cc1)NNC(=O)NCCNS(=O)(=O)c1ccccc1	916295174	LINNKTXWSXQOGX-UHFFFAOYSA-N	440.522	1.617	50	20	IDGD	
CCn1cnc2c1c(=O)n(CC(=O)NN=Cc1ccc(F)cc1)c(=O)n2Cc1ccccc1	916332408	VHXNGVBIURJVLM-UHFFFAOYSA-N	448.458	1.717	50	20	IDGD	
COCc1cccc(CNC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)c1	916426439	LTOCJPSRONIGEG-UHFFFAOYSA-N	434.518	1.293	50	20	IDGD	
CCOC(=O)N[C@@H](CNC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)CC(C)C	916631184	LJAWYHRTLWZBMK-CQSZACIVSA-N	428.511	1.195	50	20	IDGD	
O=C(NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)C1=NO[C@@H](c2ccccc2)C1	917496712	KIHBJDJFLHOMGS-LJQANCHMSA-N	442.497	1.750	50	20	IDGD	
CCC[C@@H](C)N1C[C@H](C(=O)NNC(=O)c2nn(CCC)c(=O)c3ccccc23)CC1=O	917519035	HDZTYSTWQMYJPE-HUUCEWRRSA-N	427.505	1.605	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2ccc(S(N)(=O)=O)o2)ccc1OCCC(C)C	917924482	VZBJUBCYGAQMQB-UHFFFAOYSA-N	425.463	1.435	50	20	IDGD	
NC(=O)c1ncn2c(C(=O)NNC(=O)c3ccc(Cl)nc3)cc(-c3ccco3)nc12	918597325	ULAXEMHMEZVTTQ-UHFFFAOYSA-N	425.792	1.211	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2CC(=O)N(c3cc(F)cc(F)c3)C2)cc1C	920210744	LFUGCMQOPONPIM-CYBMUJFWSA-N	430.411	1.721	50	20	IDGD	
CCS(=O)(=O)Nc1cccc(C(=O)NNc2c(OC)cccc2S(C)(=O)=O)c1	1320290312	WPKLIIDQTHNBPZ-UHFFFAOYSA-N	427.504	1.617	50	20	IDGD	
CN(NC(=O)C12C[C@H]3C[C@@H](CC(O)(C3)C1)C2)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	1320420406	FYTFFMFIILRUDO-KILAXVPQSA-N	436.553	1.953	50	20	IDGD	
Cc1nc(C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)ccc1C#N	1322679652	PTHKAVHXSRZUNC-UHFFFAOYSA-N	426.908	1.494	50	20	IDGD	
CN(C)N(C(=O)c1cn(-c2ccc(Br)cc2)nn1)[C@H]1CCS(=O)(=O)C1	1322696652	CHCJIWKCFFWGGV-ZDUSSCGKSA-N	428.312	1.136	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCCN2C(=O)COc3ccccc32)cc(OC)c1OC	1324169897	FTOXMEGQSGEYHB-UHFFFAOYSA-N	444.444	1.082	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)NCCc2cn3c(n2)CCCC3)CC1	1339211364	DGZUVJBYQRDKPB-UHFFFAOYSA-N	434.541	1.739	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1)c1nnnn1C	1348020119	WUHFDWBBWGZJHQ-KXBFYZLASA-N	434.504	1.229	50	20	IDGD	
O=C(c1c[nH]c2ncccc12)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1777710910	NNQFLOJCRHBKGK-SUMWQHHRSA-N	425.258	1.697	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cccc4c3OCCO4)C2)C1	1777839931	IREBDXNXGKMGEQ-DJJJIMSYSA-N	439.306	1.685	50	20	IDGD	
O=C(c1cc2cccn2cn1)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1778051159	NRCGAWFRHTVLLD-YOEHRIQHSA-N	425.258	1.468	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3n[nH]c4ccc(F)cc34)C2)C1	1778623194	UQNJYWBBKFXYJU-VOJFVSQTSA-N	439.285	1.929	50	20	IDGD	
CCCCC[C@H](C)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1	1779033818	FGECGMVKWVPJDP-KSFYIVLOSA-N	431.537	1.345	50	20	IDGD	
Cc1cc(C)n2ncc(C(=O)N3CCO[C@@]4(CCN(C(=O)CO[Si](C)(C)C)C4)C3)c2n1	1779295516	QHZMCHLCDRBDOQ-OAQYLSRUSA-N	445.596	1.641	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Br)C2)c1ccc(CO)o1	1779712856	PWSJKKPUSBBEGC-CKEIUWERSA-N	433.274	1.590	50	20	IDGD	
COc1c(Cl)ccnc1C(=O)N1CC[C@@]2(CN(C(=O)CCBr)CCO2)C1	1780326312	MAZSWJMQXAYXJD-QGZVFWFLSA-N	446.729	1.972	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CC(F)(F)C(=O)O)C2	1780711511	GONBEJSALYMNTH-XFBWCDHKSA-N	445.290	1.847	50	20	IDGD	
Cn1nc2c(c1C(=O)N1CCO[C@@]3(CCN(C(=O)[C@@](C)(Cl)CCl)C3)C1)CCC2	1781233637	VRXMOJNJPCRCSM-OALUTQOASA-N	429.348	1.589	50	20	IDGD	
NCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](Br)Cc2ccccc2)C1	1781684651	XVAIDNFGFPLGHZ-MBOZVWFJSA-N	438.366	1.465	50	20	IDGD	
Cc1cccc(Cl)c1C(=O)N1CC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1	1781723488	PKFXNMMDFRIQBF-QFIPXVFZSA-N	442.708	1.086	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cn(C)cn1)C2	1781899650	BRJYXPNTMUKFTQ-DDUZABMNSA-N	427.343	1.721	50	20	IDGD	
C=C[C@@H](O)C(C)(C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)Br)C1	1781997948	OVMNFJOIBXQNGC-NRTGNBEESA-N	431.371	1.857	50	20	IDGD	
Cc1nccn1CC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)Br)C1	1782001313	DGQRUOAJYIVPRJ-JCKWVBRZSA-N	427.343	1.489	50	20	IDGD	
COC(=O)CCCCCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2	1782275332	GRNZSIZTTIHDOS-JXXFODFXSA-N	432.945	1.224	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)CCc3ccc(O)nn3)C2)C1	1782635168	GUCNBRMKRBZBQP-ROUUACIJSA-N	431.320	1.181	50	20	IDGD	
COC[C@@H](C)C(=O)N1CCO[C@@]2(CCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1	1782862107	PBUOARQMYOGNME-GDYRARJKSA-N	433.455	1.984	50	20	IDGD	
CCC(=O)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](Br)Cc1ccccc1)CCO2	1783095043	QPLFOTJUIFEHPY-JXFKEZNVSA-N	437.334	1.802	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cn4ccccc4n3)CCO2)C1	1783347830	POJQVPQHSAACAU-KUHUBIRLSA-N	435.322	1.951	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ncn(C(C)C)n3)CCO2)C1	1783348024	SBXSCUYBEAKRQK-DYVFJYSZSA-N	428.331	1.476	50	20	IDGD	
C=CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@]2(CN(C(=O)[C@H](F)Cl)CCO2)C1	1783766656	NEVLFAOZSBIINH-BIENJYKASA-N	433.908	1.820	50	20	IDGD	
Cc1cc(C)c(C(=O)N2CCO[C@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)c(C)c1	1783936997	CGSGZHNNKSDOMQ-QHCPKHFHSA-N	430.549	1.428	50	20	IDGD	
Cc1ccc(COCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]3C2)cc1C	1784091293	YXFYWZSHALIWGX-HAGHYFMRSA-N	438.952	1.399	50	20	IDGD	
COc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)CBr)C[C@@H]32)cn1	1784757624	LLILCACVZRCELD-OEAJRASXSA-N	440.338	1.715	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccccc3OC(F)F)C2)C1	1785149171	YDKWANNVJCXNAE-KUHUBIRLSA-N	432.851	1.985	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3Cc4ccccc4O3)C[C@@H]21	1786407219	RFTQGOJVIGTJRD-LAQRGFTBSA-N	437.334	1.755	50	20	IDGD	
Cn1nccc1C(=O)Nc1ccc(C2(NC(=O)c3cnccc3C(=O)NN)CCC2)cc1	1787408376	JDVILYPOZWFDBJ-UHFFFAOYSA-N	433.472	1.480	50	20	IDGD	
CC(C)n1cnc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)CBr)C[C@@H]32)n1	1787665828	APGGAFPJPJBGOU-QPSCCSFWSA-N	442.358	1.483	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4c(cnn4C)c3)[C@H]2C1	1788062432	MZGAKWYSMDBXNM-XJOINEQPSA-N	449.349	1.950	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)c3ccncc3F)CCC2)cc1)c1cccc(B(O)O)c1	1788145703	RAUAFFUOEHYVEL-UHFFFAOYSA-N	433.248	1.962	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)[C@@H]1[C@@H]2Sc3ccccc3[C@H]21	1788618894	YDCNFYQLZXQADS-ACHSSLTPSA-N	436.961	1.454	50	20	IDGD	
O=C(NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])[nH]3)cc2)CCC1)c1ccc(B(O)O)cc1	1790185285	MVAXZNQSOVZRLO-UHFFFAOYSA-N	448.244	1.664	50	20	IDGD	
CC(C)N[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)Br)[C@H]2C1)C(C)C	1791058107	POVSJKRNSLOZNC-WOYTXXSLSA-N	432.403	1.772	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)C[C@@H]21	1791256750	HCGSBLJPKATCBM-SPOWBLRKSA-N	443.859	1.581	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCCCCC(=O)OC)C[C@@H]21	1791257474	IVHYNTRWAWWNON-QAETUUGQSA-N	432.945	1.343	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3CCc4ccccc43)[C@H]2C1	1791392623	NYELMFXTPMBZLL-NRDMVMEKSA-N	442.560	1.069	50	20	IDGD	
Cn1nc(C(F)(F)F)cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(C)(C)CCl	1792784049	LKJCIUILPCLMET-GNXNZQSNSA-N	436.862	1.907	50	20	IDGD	
COC(=O)C12CC(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)[C@H](C)CBr)(C1)C2	1792993945	VBBDSZAYEMWNLH-CPBSFBEJSA-N	427.339	1.999	50	20	IDGD	
COc1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](O)CCl)cc([N+](=O)[O-])c1OC	1793114363	DNEWUJDXBUZCIU-XFMPKHEZSA-N	441.868	1.464	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccncn1)C2	1794142399	YUZKASCEMPVTRN-FQLMCAECSA-N	437.928	1.861	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1n[nH]c3ccc(F)cc13)C2	1795115718	IWPISUAQVGMBIY-CULMDFNYSA-N	439.285	1.690	50	20	IDGD	
Cc1ccc(OCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCBr)C3)cc1	1795306703	GHYIXAFVJCIBPB-CCWDJLKJSA-N	425.323	1.748	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCN1Cc2ccccc2C1=O	1797183504	SJPBTZZBSFUJOM-YNVMFWSZSA-N	433.936	1.640	50	20	IDGD	
C[C@@H](Oc1ccccc1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnccc1C(=O)NN	1798441781	KHBASSKNRIDSPK-WCXIOVBPSA-N	437.500	1.404	50	20	IDGD	
Cc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Br)cc2c[nH]nc12	1799349265	SGTSTBYYEDVBRH-OCVGTWLNSA-N	439.285	1.765	50	20	IDGD	
CN(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnc[nH]1)C2)NC(=O)NCc1ccccc1	1799864737	MHOQRIVIMFOSTA-BCDXTJNWSA-N	439.520	1.008	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3ccccn3n1)C2	1800640584	ABDZUKMHYGBWOU-IARIHHJXSA-N	435.322	1.711	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cc(F)cc(F)c1)C2	1800756135	GNGLHORENZEHBT-MMPOEDRJSA-N	431.277	1.880	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)Sc1ccccn1	1801323106	RKJOMNDWZWQTHO-JBXGNFEISA-N	427.954	1.406	50	20	IDGD	
CCC[C@H](NC(C)=O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](Br)CC)C2	1802037808	IYZIEWILSUZHDR-QRJUGERDSA-N	432.359	1.054	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H](CNC(=O)C(OC)OC)[C@H]1c1cccnc1	1803357711	XGPVIYQDMQUYMV-QLFBSQMISA-N	428.327	1.880	50	20	IDGD	
C#CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](O)CCl)C2	1804371177	YWSXHHZGOBLPSM-XFIYOXNOSA-N	427.929	1.141	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)N1CC[C@H](CNC(=O)CCBr)[C@@H]1c1cccnc1	1806340587	GRSPDHBFUNMART-YCPHGPKFSA-N	440.342	1.319	50	20	IDGD	
Cc1cc(C(=O)NC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)c[nH]1	1808779404	XRCCMMGTBZQBIB-OXJNMPFZSA-N	447.499	1.350	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)c3ccncc3Cl)CC2)C1	1809978072	UQDYCEHYPYYGES-UHFFFAOYSA-N	441.724	1.573	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)c1cccn2nccc12	1812150878	CSMWMZLWHLXVBZ-ZYSHUDEJSA-N	427.892	1.649	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@H](CNC(=O)[C@@H](C)Br)[C@@H]2c2cccnc2)nn1	1812866865	MJMJQEYUEGUBTK-MRRJBJDNSA-N	448.321	1.983	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3sc(N)nc3C)sc2C1	1815148578	LMLJYSQUYPIDNO-IUCAKERBSA-N	429.955	1.970	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](F)Cl)sc2C1	1817122269	XBEKBVMUIAPOQC-KGVFOJOVSA-N	440.888	1.724	50	20	IDGD	
C=C(Oc1ccccc1O)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](O)CCl)CC2	1817258158	RRLXOYCHKOPDGK-FZMZJTMJSA-N	437.905	1.953	50	20	IDGD	
CCc1cc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)no1	1817472652	YBCROKPENJKXCL-SFHVURJKSA-N	437.265	1.260	50	20	IDGD	
CC(C)(C)[C@H](O)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819401543	GZZBYAHGASHDLJ-DOTOQJQBSA-N	443.508	1.121	50	20	IDGD	
COc1ccnc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)c1	1819765445	ATAJSFCLUFHIIS-IBGZPJMESA-N	449.276	1.113	50	20	IDGD	
CCC1(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cnccc4C(=O)NN)sc3C2)CCC1	1819796738	CCWZGMVXSLSXKL-GFCCVEGCSA-N	442.545	1.948	50	20	IDGD	
CC[C@H](NC(C)=O)C(=O)N[C@H]1CCc2nc(NC(=O)CO[Si](C)(C)C)sc2C1	1820158423	LOPHLJXBJBKDEA-STQMWFEESA-N	426.615	1.821	50	20	IDGD	
Cc1cc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)[nH]n2)n[nH]1	1820260294	UGNXFNVXNGBTGT-MRXNPFEDSA-N	437.464	1.059	50	20	IDGD	
CC(C)N(C)CC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1822993752	KMFDQWPQBJDIET-QGZVFWFLSA-N	442.524	1.054	50	20	IDGD	
O=C(CC1CCOCC1)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827055224	VJSQTXZEFAIZDQ-QFIPXVFZSA-N	442.365	1.416	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)CCc2nc(N)n[nH]2)CC1	1828806520	KZCJIJKCRUFWKC-HUUCEWRRSA-N	426.949	1.193	50	20	IDGD	
Cc1ccnc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)c1	1830538535	IQLPGYYPLXVROH-BEFAXECRSA-N	440.338	1.491	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cccc(OC)n3)C2)C1	1831640513	NCLKGWWQPLWGPQ-DYESRHJHSA-N	439.940	1.497	50	20	IDGD	
C[C@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1)N1C[C@@H]2C[C@H]2C1	1831873744	VUHWISZSWJRMIL-HZEGPAAWSA-N	447.624	1.319	50	20	IDGD	
C[C@@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1)n1cccn1	1831876921	MHLVEZNQWDIJHC-PKOBYXMFSA-N	432.569	1.437	50	20	IDGD	
CCCc1onc(C)c1C(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)CCl)CC2)CC1	1833310945	YNZRMJCMZRMRQR-KRWDZBQOSA-N	440.972	1.720	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)CCCCn3cccc3)CC2)CC1)[C@@H](O)CCl	1833312212	JUBPKGHPXXJUOY-FQEVSTJZSA-N	439.000	1.830	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)nc1	1834378675	SUVRHKOJIDYSFM-KSSFIOAISA-N	426.311	1.243	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3Cl)C2)C1	1834823263	LVYNCUIDMJAFBK-KRWDZBQOSA-N	446.729	1.590	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@H](C)N3C[C@H]4C[C@@H]4C3)CC2)CC1	1835676418	DAZIZPMTKZUMNT-XLSPSMHOSA-N	441.016	1.152	50	20	IDGD	
O=C(c1cnn2ccccc12)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836717492	DFMOKRSKHAAPJI-IBGZPJMESA-N	434.924	1.546	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)CS(=O)(=O)CC)CC2)CC1	1836846339	MSWDGCFPBAZSBC-QGZVFWFLSA-N	437.002	1.827	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3ccc(=O)oc3)CC2)CC1	1837589895	IZDRENVUJKQQHM-QGZVFWFLSA-N	426.897	1.506	50	20	IDGD	
COc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)ccn1	1837973853	INBLTDPLMGHEJN-HXUWFJFHSA-N	425.913	1.425	50	20	IDGD	
CC(C)CNC(=O)C(=O)N1CCC(OC2CCN(C(=O)CO[Si](C)(C)C)CC2)CC1	1838107472	MWEJOQONIYXPIM-UHFFFAOYSA-N	441.645	1.609	50	20	IDGD	
CSCC[C@@H](O)C(=O)N1CCC(OC2CCN(C(=O)C(Cl)Cl)CC2)CC1	1838789704	UVKJTJRLZSFGAI-CQSZACIVSA-N	427.394	1.903	50	20	IDGD	
CCc1ncccc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2	1839150891	AWOUHZKJCAIVGP-WOJBJXKFSA-N	444.359	1.950	50	20	IDGD	
Cc1onc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)c1C	1839198440	DMEZBSPHVWURSU-BBRMVZONSA-N	434.262	1.052	50	20	IDGD	
Cc1nc(F)ccc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839200073	DBJWYNBJDPQVAR-PBHICJAKSA-N	448.264	1.290	50	20	IDGD	
Cc1ccc(F)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCBr)C3)C2)c1	1839311448	UHWVKOXNZFHQEM-LJQANCHMSA-N	443.313	1.989	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cn3cnc4ccccc43)CCO2)C1	1840100886	LZJJPKUXUZTZHN-VGSWGCGISA-N	448.951	1.900	50	20	IDGD	
CC(C)(C)n1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)n1	1840187032	ZWSNJCHFQPIUHL-SFHVURJKSA-N	433.336	1.512	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H]3C[C@]3(F)Cl)CCO2)C1	1840246533	FSXVYSZZDLZQHD-VCOSZWKGSA-N	431.719	1.604	50	20	IDGD	
C[C@@H](Cc1ccccn1)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1840330733	NNTWQRANCWOKFD-JTSKRJEESA-N	437.968	1.982	50	20	IDGD	
C[C@]1(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCBr)C3)C2)CC1(F)F	1840825028	UKHNIIFBXLUYJZ-HUUCEWRRSA-N	425.270	1.273	50	20	IDGD	
CC(C)(C(=O)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1)c1ncc(Br)cn1	1841348144	LTQVQTDNNDETIK-GFCCVEGCSA-N	445.745	1.320	50	20	IDGD	
Cn1cnc(C(=O)N2CCCC23CN(C(=O)[C@H](F)Br)C3)c1C(F)(F)F	1843520105	YEQVLMDIUVIAEY-JTQLQIEISA-N	427.196	1.946	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC12CN(C(=O)CCS(=O)(=O)c1ccccc1)C2	1846176125	OAGZRSNMTNJZPG-AWEZNQCLSA-N	443.363	1.837	50	20	IDGD	
Cc1ccc(=O)n(C(C)(C)C(=O)N2CC3(CCCN3C(=O)[C@@H](C)Br)C2)n1	1846177861	PWZXOBTWECOIBZ-CYBMUJFWSA-N	425.327	1.274	50	20	IDGD	
Cc1nc2cc(C(=O)N3CC4(CCCN4C(=O)CCC(=O)NN(C)C)C3)ccc2s1	1846384893	WGUOKUIMYWKAJN-UHFFFAOYSA-N	429.546	1.795	50	20	IDGD	
CC#C[C@H](CC(=O)N1CCCC12CN(C(=O)CCC(=O)NN(C)C)C2)c1ccc(O)cc1	1846416801	BNYYGXIQIDFGPJ-LJQANCHMSA-N	440.544	1.466	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)[C@@H]2CCCN2Cc2ccccc2)C1	1846504698	HCBWSUCDRIQOOK-FQEVSTJZSA-N	441.576	1.227	50	20	IDGD	
COc1ccc([C@H]2C[C@H]2C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2cnccc2C(=O)NN)cc1	1847780123	LWRIHEKHGJMOAP-QCFAMHMHSA-N	449.511	1.313	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cncc(S(C)(=O)=O)c1	1848329364	GBEYTCHUZCVFMZ-BPNCWPANSA-N	430.324	1.084	50	20	IDGD	
O=C(COC(=O)[C@@H]1CCCN(C(=O)c2ccc(F)cc2)C1)NNC(=O)c1cccs1	11060373	KCWXAOVGFCSDNE-CQSZACIVSA-N	433.461	1.744	50	20	IDGD	
Cc1ccc(C)c(S(=O)(=O)Oc2ccc(C(=O)NNC(=O)C(=O)NC3CC3)cc2)c1	17806016	XUBLCXSJQWKSNR-UHFFFAOYSA-N	431.470	1.111	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)CCc1nc(-c2cccs2)no1	24290988	UHJVFZLQOBYUAE-UHFFFAOYSA-N	448.530	1.793	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)c2ccc(N3CCCS3(=O)=O)cc2)cc1	24352036	JCBFNNVLZUIXSV-HNNXBMFYSA-N	447.513	1.854	50	20	IDGD	
CSc1cccc(N2C[C@H](C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)CC2=O)c1	27094038	DXODGUPKZHTPIQ-CQSZACIVSA-N	437.485	1.198	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc2c3c(cccc13)C(=O)N2)c1ccc2c(c1)OCCO2	106184950	KKSBBCNNHKVVOH-UHFFFAOYSA-N	425.422	1.800	50	20	IDGD	
CN(C)c1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1F	109340646	NEWJJEDSUOPJHY-UHFFFAOYSA-N	434.493	1.751	50	20	IDGD	
CC(=O)[C@H]1CC(C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)=NN1c1ccccc1	110889118	RYVJYQZRESVDKF-HXUWFJFHSA-N	441.513	1.794	50	20	IDGD	
CC(C)NC(=O)C(=O)NNC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)c1cccc(Cl)c1	726157341	SVOPTKVTGXNKHS-JQFCIGGWSA-N	434.924	1.785	50	20	IDGD	
CCCC(=O)N1CSC[C@H]1C(=O)NNC(=O)c1ccc(CSc2nncn2C)cc1	727364032	JDLKNSKDCNIOJT-HNNXBMFYSA-N	448.574	1.570	50	20	IDGD	
CSc1nc(C)c(CCC(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)c(O)n1	728210218	YMFAUXCSPMJTAX-UHFFFAOYSA-N	437.547	1.729	50	20	IDGD	
Cc1occc1C(=O)NCC(=O)NNc1nc2ccccc2c(=O)n1CCCOC(C)C	729279668	NDBSBHOZJBZVNF-UHFFFAOYSA-N	441.488	1.986	50	20	IDGD	
CC(C)[C@H](NC(=O)NC(C)(C)C)C(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12	729281905	RXECYKODXPGKQA-INIZCTEOSA-N	444.536	1.861	50	20	IDGD	
CCN(CC)[C@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)c1ccccc1	729283503	TYPZGPORNUQDTK-IBGZPJMESA-N	432.546	1.781	50	20	IDGD	
CN(CCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)C1CCCC1	729622584	OMLSCYURJXJSGJ-UHFFFAOYSA-N	437.566	1.290	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)CSc2nnnn2CC(F)(F)F)c1	729944449	OFAALCMLCIRFHN-UHFFFAOYSA-N	446.455	1.986	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)C[C@H](C)O1	732261064	JUZPCMGAOGZSPG-STQMWFEESA-N	433.490	1.979	50	20	IDGD	
CC(C)OCCCn1c(NNC(=O)[C@H]2CCCN(C(N)=O)C2)nc2ccccc2c1=O	733265631	HYKUAPDFQFBZDX-HNNXBMFYSA-N	430.509	1.445	50	20	IDGD	
C[C@H]1CN(C(=O)NNC(=O)CNC(=O)c2cccs2)C[C@H](C)N1C(=O)OC(C)(C)C	733342885	PDLLNYCSBCWJJY-STQMWFEESA-N	439.538	1.548	50	20	IDGD	
CCOc1cccc(N2CCN(CC(=O)NNC(=O)c3cc(C)c(CC)s3)CC2)n1	736310349	PWKJWBZCOHYCOU-UHFFFAOYSA-N	431.562	1.996	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)c1cnn(-c2ccccc2F)c1-n1cccc1	740852033	HYJGDFSFYMJRLA-UHFFFAOYSA-N	426.452	1.868	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)Cc1csc(NC(=O)C(C)(C)C)n1	742675836	CSXFZHGYGRQMKK-UHFFFAOYSA-N	442.542	1.525	50	20	IDGD	
Cc1cccc(NC(=S)NNC(=O)c2ccc(S(=O)(=O)CC(=O)N(C)C)cc2)c1C	743297073	MNRDORCOQPCONH-UHFFFAOYSA-N	448.570	1.797	50	20	IDGD	
CCOC(=O)COc1ccc(CCNC(=O)NNC(=O)c2c(C)nc3ccccn23)cc1	743509327	BIWOPNJJCJOXDC-UHFFFAOYSA-N	439.472	1.771	50	20	IDGD	
C[C@@H]1C[C@@H](NC(=O)NNC(=O)c2csc(N3CCOCC3)n2)C(=O)N1c1ccccc1	743510015	OOQBLOWCDNMSRH-UKRRQHHQSA-N	444.517	1.118	50	20	IDGD	
C[C@H](CN1CCN(c2ccccc2)CC1)NC(=O)NNC(=O)COc1ccccc1O	743633407	NWOIBPPQBTVXSQ-QGZVFWFLSA-N	427.505	1.312	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)c2ccc(N3C[C@H](C)O[C@@H](C)C3)nc2)c1	744715915	VZXLLOBVBGGWMT-HOTGVXAUSA-N	426.473	1.622	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)C[C@@H](c2ccccc2)N2CCOC2=O)c1	744949964	GCGXRQQJKKIORU-SFHVURJKSA-N	425.441	1.883	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cn(Cc3cccs3)nn2)cc1OC	745560047	AXSVPKVBQHOPNO-UHFFFAOYSA-N	445.457	1.023	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)N[C@@H]1CC(=O)N(CCOc2ccccc2)C1	745847555	OWJGRYHXUMVZFF-HZPDHXFCSA-N	444.463	1.603	50	20	IDGD	
Cc1cc(C)nc(SCc2ccc(C(=O)NNC(=O)[C@H](C)CS(C)(=O)=O)cc2)n1	746826295	SCZHHOWRENQYAA-GFCCVEGCSA-N	436.559	1.827	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)C[C@](O)(c2nc(C)cs2)C(F)(F)F)cc1	746863984	JPHDHBASXYTNRM-INIZCTEOSA-N	432.424	1.860	50	20	IDGD	
Cc1cc(F)cc(S(=O)(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1	747595700	FHKMOODVJWTVTG-UHFFFAOYSA-N	441.506	1.542	50	20	IDGD	
C[C@@H](OC[C@H]1CCCO1)C(=O)NNc1ccc(S(=O)(=O)Nc2nccs2)cc1	747943496	ZEPIWVBHKADJAV-TZMCWYRMSA-N	426.520	1.971	50	20	IDGD	
CC1=C(C(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)C(=O)OC1(C)C	748546020	BVAICHFVTYQXHV-UHFFFAOYSA-N	446.467	1.801	50	20	IDGD	
COC(=O)c1[nH]c(C)c(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)c1C	748620494	QIDLCYBUGFPJKW-UHFFFAOYSA-N	449.533	1.111	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)NCCNC(=O)c2cccc(Br)c2)n1	750331394	UBPJBTLYHQSUFE-UHFFFAOYSA-N	437.298	1.023	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2ccc(F)c(NS(C)(=O)=O)c2)cc(OC)c1OC	750716439	PWBPKBCPJPKYGE-UHFFFAOYSA-N	441.437	1.298	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)c2cn(-c3ccc(C(F)(F)F)cn3)nn2)c1	751050385	FIAUIGZIJWZSKZ-UHFFFAOYSA-N	436.350	1.773	50	20	IDGD	
C[C@H](NC(=S)NNC(=O)c1cc(S(N)(=O)=O)c(Br)s1)C1CC1	751619557	OSUFKKPUSBWUPR-YFKPBYRVSA-N	427.371	1.065	50	20	IDGD	
COC(=O)COc1c(C)cc(C(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)cc1C	752519370	QGWBMRPVPWCIOP-UHFFFAOYSA-N	427.457	1.872	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)NC[C@@H]2CCC[C@]23NC(=O)N(C)C3=O)c1	753023296	MWSWDNFYNNGJFD-NYHFZMIOSA-N	445.520	1.548	50	20	IDGD	
O=C(O)c1cc(F)c(Br)c(S(=O)(=O)NNC(=O)c2ccccc2O)c1	753524307	OVJFLTAQVCNOHN-UHFFFAOYSA-N	433.211	1.615	50	20	IDGD	
O=C(NCCN1C(=O)[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)NNC(=O)NCc1ccc(Cl)cc1	755257104	KGBFESOQVXXYIZ-WMHQRMGPSA-N	431.880	1.161	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)COc2ccccc2C#N)cc1S(=O)(=O)N(C)C	755391545	AODYETJROXBURL-UHFFFAOYSA-N	431.474	1.349	50	20	IDGD	
Cc1cc(C)nc(-n2nc(C)cc2NC(=O)NNC(=O)c2nnc(O)c3ccccc23)n1	755516204	OBVZPOLXONDMON-UHFFFAOYSA-N	433.432	1.703	50	20	IDGD	
COC(=O)CNC(=O)c1ccc(NC(=O)NNC(=O)c2cc(Br)c[nH]2)cc1	755548391	QOQSUYSFBANZKE-UHFFFAOYSA-N	438.238	1.147	50	20	IDGD	
CC[C@@H](C)C(=O)NNC(=O)Nc1ccc(S(=O)(=O)N2CCC[C@@H](C(=O)OC)C2)cc1	755559296	SJBBNOFIWPCXCR-ZIAGYGMSSA-N	440.522	1.459	50	20	IDGD	
Cc1nn(C)c(N2CCOCC2)c1C=NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	755731427	RSYFVUAIZXMKDJ-UHFFFAOYSA-N	449.556	1.598	50	20	IDGD	
COC(=O)[C@H](CO)NC(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccc(Cl)cc1	755862331	OQSSUNCZMCZRKZ-DZXKJOIRSA-N	427.848	1.674	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)c1ccc(-n2ccnn2)cc1	756105465	HEAPKPDZYMWEGU-CYBMUJFWSA-N	443.489	1.768	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccccc2CN2CCOCC2)c1	756115208	NSSWVPQXUWUSHJ-UHFFFAOYSA-N	432.502	1.389	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)[C@@H](C)CS(=O)(=O)c2ccc(F)cc2)c1	756709095	CBFIRAKPUPMPOJ-AWEZNQCLSA-N	436.461	1.548	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCCC[C@@H]2C)cc1C(=O)NNc1ccc(C(N)=O)nn1	757402186	JRNUEZTZGIEKDT-ZDUSSCGKSA-N	432.506	1.204	50	20	IDGD	
CC(C)n1nnnc1-c1ccccc1NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	758013465	DQJQSXRMLHJAGK-UHFFFAOYSA-N	447.459	1.634	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H](C#N)[C@@H](NC(=O)NNC(=O)c2nnc(O)c3ccccc23)C1	758761465	QZZYJNZPKAXUMQ-FZMZJTMJSA-N	441.448	1.038	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)[C@H](C)N2C(=O)c3ccc(Br)cc3C2=O)nc1	759725414	PKGZQMCKHBGIDT-VIFPVBQESA-N	447.245	1.759	50	20	IDGD	
CCc1ccc(S(C)(=O)=O)cc1C(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	759789171	QYEBXPBANJEGDH-UHFFFAOYSA-N	439.515	1.523	50	20	IDGD	
Cc1c(C(=O)NNC(=O)CCNC(=O)OC(C)(C)C)nnn1-c1cccc2ncccc12	760442577	MCHXUPJZDZGILV-UHFFFAOYSA-N	439.476	1.800	50	20	IDGD	
COCCOc1ccc(CC(=O)N2CCN(S(=O)(=O)CBr)CC2)cc1	760490322	NPQYYWGNDWPOHT-UHFFFAOYSA-N	435.340	1.081	50	20	IDGD	
CCS(=O)(=O)c1ccc(C(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)c(N)c1	761251046	OLNWXCXXUYCRHK-UHFFFAOYSA-N	439.877	1.334	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)cc1OC	761793432	HIQLTVVFMXRUDM-KRWDZBQOSA-N	426.473	1.839	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccnn2Cc2cccc(C)c2)cc1OC	763552247	XSUFKOBISSLNBW-UHFFFAOYSA-N	437.456	1.657	50	20	IDGD	
CCNS(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2c(C)nc3ccccn23)cc1	763659511	UHIXYBIGNBQJGH-UHFFFAOYSA-N	430.490	1.085	50	20	IDGD	
C[C@H](c1ccccc1)n1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2F)n1	763681667	XKVDASKHBRHACX-CQSZACIVSA-N	425.420	1.796	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CSc2ccc(Cl)cc2)cc1-n1cnnn1	763739010	XNFZXPRBLHKFCM-UHFFFAOYSA-N	445.892	1.502	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)cc1Br	763806433	CZDNYTSUAJTJDQ-UHFFFAOYSA-N	447.245	1.494	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C)cc2)c(Br)c1	763820438	HNFBYFFACQQJJQ-UHFFFAOYSA-N	436.262	1.931	50	20	IDGD	
CCOC(=O)/C=C\c1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)cc1	763855651	AASKWGNCHWWPIO-QLKUMGTLSA-N	443.431	1.955	50	20	IDGD	
Cc1cn(-c2ccccc2)nc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccccc1F	763857651	NTEXUMRMRPETFO-AWEZNQCLSA-N	425.420	1.873	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccc(C(=O)NC2CC2)cc1	763867208	SXYMWEHUTIHKSV-LBPRGKRZSA-N	428.420	1.271	50	20	IDGD	
Cc1ccn(C)c(=O)c1NC(=O)C(=O)NNC(=O)c1sc(-c2ccccc2)nc1C	763902588	NVCKJTKLPDWZOX-UHFFFAOYSA-N	425.470	1.525	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3ccc4c(c3)n(C)c(=O)n4C)cc2C1	763940297	DUKZDENNIYHRLJ-NSHDSACASA-N	441.513	1.463	50	20	IDGD	
Cc1nn(C)c2ncc(NC(=O)C(=O)NNC(=O)c3cc4c(s3)CC[C@@H](C)C4)cc12	763940496	SFPVXIPWPFHPIG-SNVBAGLBSA-N	426.502	1.863	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)Nc1cccc(N2CCCC2)c1	764004277	BMBPIHUCWGFVKO-UHFFFAOYSA-N	434.294	1.788	50	20	IDGD	
COC(=O)[C@H](C)Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)cc1	764127588	XSDABHUBJUACPO-LLVKDONJSA-N	433.848	1.797	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)n(-c2cccc(Cl)c2)n1	764152770	FUCJOPZZBJXWDK-QGZVFWFLSA-N	439.859	1.924	50	20	IDGD	
O=C(CCc1ccco1)NNC(=O)C(=O)Nc1cccc(N2C(=O)c3ccccc3C2=O)c1	764171156	FRLOQZYHBPTUCS-UHFFFAOYSA-N	446.419	1.799	50	20	IDGD	
CCCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)CCc2ccccc2)cc1	764191692	AYLIJPAYAOHELO-UHFFFAOYSA-N	432.502	1.557	50	20	IDGD	
O=C(NNC(=O)c1cccc(OC(F)F)c1)C(=O)Nc1ccccc1O[C@H]1CCOC1	764260181	RZBHZGUCQPOVPX-AWEZNQCLSA-N	435.383	1.855	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)C(=O)Nc1ccc(CCN2CCOCC2)cc1	764314377	VNVQLDAWDAHXRF-UHFFFAOYSA-N	428.464	1.029	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C(=O)Nc1ccc(CN2C(=O)CCC2=O)cc1)c1ccccc1	764327607	CLULPNKTUWJEEE-SFHVURJKSA-N	436.468	1.615	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cnn(C)c2)nn1-c1ccc(Cl)cc1Cl	764358970	LISZCZMEBBCFGA-UHFFFAOYSA-N	436.259	1.621	50	20	IDGD	
CCOc1ccc(C#N)cc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccccc2OC)[nH]n1	764378415	ZPLJPODWAQMKIC-UHFFFAOYSA-N	448.439	1.755	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(C(=O)N2CCC(C)CC2)cc1C	764397740	MKIOLNKRQALZIL-INIZCTEOSA-N	448.520	1.005	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)[C@@H]1CC(=O)N(c2ccc(F)cc2F)C1	765310841	NBGHBNNBMLEJBX-GFCCVEGCSA-N	440.447	1.770	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)CN3C(=O)CCc4ccccc43)n[nH]2)cc1OC	765597412	SPFBYEWGDXRZPS-UHFFFAOYSA-N	449.467	1.834	50	20	IDGD	
COC(=O)c1cc(Br)c(F)cc1NC(=O)C(=O)NNc1nccnc1OC	766260282	CIPAOFQURCJDEQ-UHFFFAOYSA-N	442.201	1.255	50	20	IDGD	
CS(=O)(=O)NCC(=NNC(=O)CCN1CCN(c2ccccc2)CC1)c1ccccc1	766682405	PDSNLUXOJJIIHE-UHFFFAOYSA-N	443.573	1.268	50	20	IDGD	
Cc1nc(-c2ccccn2)nc(NNC(=O)CNC(=O)CNC(=O)OC(C)(C)C)c1C	767150454	XIFRPGQFZYLPCI-UHFFFAOYSA-N	429.481	1.239	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)cc1C	768290085	CYGSKLUDCMQHIJ-UHFFFAOYSA-N	440.544	1.656	50	20	IDGD	
COc1ncnc(N(C)C)c1NC(=O)NNc1ccccc1S(=O)(=O)NC(C)(C)C	770073539	LMKOKXYYZLXCEV-UHFFFAOYSA-N	437.526	1.777	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)cc1OC	770485319	PNTMOJGCFGZMLP-NSHDSACASA-N	436.852	1.800	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)c2cccn3c(O)nnc23)cc(OCC)c1OCC	770550123	PWKXRGWXUHFWTD-UHFFFAOYSA-N	429.433	1.706	50	20	IDGD	
CCNS(=O)(=O)c1ccc(C(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)cc1	770968583	MGNOQEBNLIYFJZ-UHFFFAOYSA-N	433.494	1.342	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)c2ccccc2NS(C)(=O)=O)C1	773412804	XNVSIFGBJGVLBT-ZDUSSCGKSA-N	440.522	1.466	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)C(=O)Nc2ccc(C(=O)N3CCSCC3)cc2C)n1	773482643	ZIXIQGVSADLXLG-UHFFFAOYSA-N	428.518	1.673	50	20	IDGD	
Cc1cc(S(N)(=O)=O)cc(NC(=O)C(=O)NNc2ncc(Cl)cc2Cl)c1C	773678315	NWJYLCNJFXZIAV-UHFFFAOYSA-N	432.289	1.734	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)NC[C@H]2CC[C@@H](C(=O)N(C)C)O2)cc1Cl	774773224	WLHFAGDSYIBSLE-MFKMUULPSA-N	443.888	1.329	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN[C@H](C)c1ccc2c(c1)CC(=O)N2C	775350630	JAMXCKRRPUIAFK-GFCCVEGCSA-N	430.892	1.979	50	20	IDGD	
Cc1c(C(=O)NNc2cccc(S(C)(=O)=O)c2)nnn1-c1cccc2c1CCN(C)C2	776530999	QLQXZMUOMJVNBA-UHFFFAOYSA-N	440.529	1.724	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cc3c(cc2F)NC(=O)CC3)c2ccccc2n1	778706725	CYDZVXKGKUYYLD-UHFFFAOYSA-N	435.415	1.967	50	20	IDGD	
O=C(NNC(=O)c1cnccn1)C(=O)Nc1cc(Cl)ccc1OC[C@H]1CCCCO1	778709206	DPNFCCLFLKFZEN-CYBMUJFWSA-N	433.852	1.478	50	20	IDGD	
COCC(=O)N1CCc2cc(NC(=O)C(=O)NNC(=O)c3cccc4ccccc34)ccc21	778710216	PJDPPFVBOPYVOV-UHFFFAOYSA-N	446.463	1.775	50	20	IDGD	
O=C(Cc1cc[nH]n1)NNC(=O)C(=O)Nc1cc(Cl)ccc1OC[C@@H]1CCCCO1	778715637	ZEOAPNLKVSQZOF-AWEZNQCLSA-N	435.868	1.340	50	20	IDGD	
C[C@@]1(NNC(=O)N[C@H]2CCN(c3ccc(Cl)c(Cl)c3)C2=O)CCS(=O)(=O)C1	779380415	RPBFHKZBIAJSEP-XJKSGUPXSA-N	435.333	1.480	50	20	IDGD	
CCN1CCN(c2ccc(NC(=O)C(=O)NNC(=O)c3ccc(O)cc3)c(C)c2)CC1	782833045	XIJZVBUYEDKHPJ-UHFFFAOYSA-N	425.489	1.242	50	20	IDGD	
CC[C@H](C)Oc1ccc(NC(=O)C(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1	782897179	LXYUFTGUJXYFHP-ZDUSSCGKSA-N	447.517	1.557	50	20	IDGD	
CC(C)(C)OC(=O)Nc1cnc(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cn1	783045315	NDYQNEBDJYINPB-UHFFFAOYSA-N	442.480	1.291	50	20	IDGD	
COC[C@@H](C)NS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2cc(C)cc(C)c2)cc1	783356985	PNMPZUYGRGJXFT-OAHLLOKOSA-N	434.518	1.698	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)CCS(=O)(=O)C1	783428662	YAKHNLOIEWIBKY-WIYYLYMNSA-N	426.498	1.479	50	20	IDGD	
CCNS(=O)(=O)c1ccc2c(c1)N(C(=O)C(=O)NNc1cccc3c1CCCC3)CC2	783451875	YLASGACLHNATBD-UHFFFAOYSA-N	442.541	1.896	50	20	IDGD	
O=C(NNS(=O)(=O)c1c(F)c(F)c(F)c(F)c1F)c1cc([N+](=O)[O-])ccc1O	783834356	VWDMEQBNVQMYQV-UHFFFAOYSA-N	427.263	1.619	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2ccc(C)c(S(N)(=O)=O)c2)ccc1Br	783923714	XKLYMFORCQCAAR-UHFFFAOYSA-N	441.307	1.795	50	20	IDGD	
COc1ccc(OC(C)C)c(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)c1	785061622	ZACPMNVYMNGIAG-UHFFFAOYSA-N	425.445	1.459	50	20	IDGD	
CCCc1c(NC(=O)C(=O)NNC(=O)Cc2ccccn2)cnn1-c1cccc(C#N)c1	785990593	JXTHLDVVVOJBRU-UHFFFAOYSA-N	431.456	1.420	50	20	IDGD	
C[C@H]1[C@H](C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)CCN1C(=O)OC(C)(C)C	786251497	WRIDASWWDKIGKS-QWHCGFSZSA-N	429.518	1.487	50	20	IDGD	
CCN(C(=O)c1cc(NC(=O)C(=O)NNC(=O)Cc2cccnc2)ccc1Cl)C(C)C	787542582	OFXDCLVLVGADBO-UHFFFAOYSA-N	445.907	1.934	50	20	IDGD	
CC(C)CN1C[C@@H]2CN(C(=O)NNC(=O)c3cccc(Br)c3)CCN2C1=O	787858504	COHMYTRHVOLXJU-HNNXBMFYSA-N	438.326	1.881	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(/C#N)C(=O)NCCCn2c(=O)ccn(C)c2=O)c1C	788219767	GOEBHXMONVMSTQ-JJBLJPBOSA-N	427.505	1.286	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCc2cccc([N+](=O)[O-])c2C)cc1	790559577	NNRKZGHNEKCEHW-UHFFFAOYSA-N	449.489	1.363	50	20	IDGD	
O=C(CCCOc1ccc(Cl)cc1Cl)NNC(=O)NCc1nnc2n1CCOC2	790679468	YLEMNBCZQFASIR-UHFFFAOYSA-N	443.291	1.805	50	20	IDGD	
Cc1ccc(CN2CC[C@@H](NC(=O)NNC(=O)c3cnn(-c4ccccc4)c3)C2=O)cc1	790700875	KFSSXVAEQZARKS-HXUWFJFHSA-N	432.484	1.926	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)COc2cccc(C)c2)cc(Cl)c1F	792267951	JEPCKFZJTHWCHZ-UHFFFAOYSA-N	437.811	1.739	50	20	IDGD	
CCn1c(CCC(=O)NNC(=O)OC(C)(C)C)nc2cc(S(=O)(=O)N(C)C)ccc21	792594059	MUDDJDYARCGOMP-UHFFFAOYSA-N	439.538	1.795	50	20	IDGD	
Cc1nc2cc(C(=O)NNc3ncccc3S(=O)(=O)N3CCN(C)CC3)ccc2o1	792639840	ZPHTYGDQMYHZPR-UHFFFAOYSA-N	430.490	1.224	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@@H]2CCc3cc(C)ccc3O2)cc1	792804134	LFWKLLUCQTUOMB-IBGZPJMESA-N	431.514	1.465	50	20	IDGD	
CCn1nc(C(=O)NN=C2CCCc3c2cnn3-c2ncccn2)c2ccccc2c1=O	792924316	CAPBORRQKIZNLI-UHFFFAOYSA-N	428.456	1.863	50	20	IDGD	
CCOC(=O)c1ccc(F)c(S(=O)(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c1	795326214	RENWOLZARDZGCO-UHFFFAOYSA-N	432.433	1.811	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCCC[C@H]1COC(=O)N(C)C	796554984	PFZHECURNOKFHT-AWEZNQCLSA-N	426.901	1.662	50	20	IDGD	
Cn1c(=NNC(=O)C(=O)Nc2ccc(F)c(N3CCOC3=O)c2)sc2ccccc21	797047087	SLWGMHGVKYYLEF-UHFFFAOYSA-N	429.433	1.906	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)N3CCC(C)CC3)cc2C)n1	797370806	VEABBROFGMDOMA-UHFFFAOYSA-N	437.500	1.970	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(N(C)C)c(NC(=O)NNC(=O)c2cccc(C)n2)c1	797609258	XAUYLGNSJFYOJX-UHFFFAOYSA-N	448.549	1.953	50	20	IDGD	
COc1ccccc1CCNC(=O)CNC(=O)NNC(=O)[C@H](C)Oc1cccc(Cl)c1	798078753	ZYTKVDWTARRFTB-AWEZNQCLSA-N	448.907	1.805	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H]2C[C@H](c3ccccc3F)C2)c1	798115385	NOHADNOPHZUUQR-SHTZXODSSA-N	434.493	1.966	50	20	IDGD	
C[C@@H]1[C@@H](NC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])CC(=O)N1Cc1ccccc1	798530730	SBKNTFDOJFALLJ-ZBFHGGJFSA-N	441.444	1.494	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)C2(c3cncc(Br)c3)CC2)C[C@@H](C)O1	799102301	XUUPPSKAXBRVCJ-CHWSQXEVSA-N	425.327	1.522	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNS(=O)(=O)c1cccc(Br)c1F	799122278	ZXSBTDYQMDSINU-UHFFFAOYSA-N	436.284	1.389	50	20	IDGD	
CCCCNS(=O)(=O)c1ccc(C)c(NC(=O)C(=O)NNc2cncc(Cl)n2)c1	799836092	WCHIDJKONVRWMI-UHFFFAOYSA-N	440.913	1.599	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@@H](C)C(=O)NNC(=O)c1sccc1S(N)(=O)=O	800577243	LSPQOWMTAVUSJR-JTQLQIEISA-N	431.923	1.894	50	20	IDGD	
CC1(C)NC(=O)N(CCCC(=O)NNC(=O)Nc2ccc(Br)cc2)C1=O	801994806	LKEKTDMNUFLLIS-UHFFFAOYSA-N	426.271	1.712	50	20	IDGD	
O=C(NNc1ccc2c(=O)[nH]ccc2c1)[C@H]1CN(Cc2nc(O)c3ccccc3n2)CCO1	803432135	KGAKWBDMVARSAG-LJQANCHMSA-N	446.467	1.521	50	20	IDGD	
O=C(NC[C@H](N1CCOCC1)C(F)(F)F)NNC(=O)Nc1ccc(OC(F)F)cc1	805846445	LIRMCDSVXJAKJS-LBPRGKRZSA-N	441.357	1.887	50	20	IDGD	
COCCCOc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(C#N)cc2)cc1OC	806977971	HHARZSNFLDJRLA-UHFFFAOYSA-N	426.429	1.382	50	20	IDGD	
COC(=O)c1cc(Br)c(OC)cc1NC(=O)C(=O)NNc1ncccc1F	807301392	ICKJQGWSYOZSDM-UHFFFAOYSA-N	441.213	1.860	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)N[C@H]2CCCN(C(=O)N3CCCC3)C2)nc2ccccc21	807461104	OVAFYYGZTVOEJM-HNNXBMFYSA-N	427.509	1.126	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)cc2[nH]ccc12	808934853	BNWYHRYHRKXUMP-UHFFFAOYSA-N	433.424	1.695	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)C(=O)Nc2ccc(C#N)c(F)c2)c1	810386611	JRIDMMKGJAMAOZ-UHFFFAOYSA-N	435.209	1.868	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)C(=O)Nc1ccc(-n2ccc(C(F)(F)F)n2)cc1	810387509	YWGRFHLROOLSQY-UHFFFAOYSA-N	432.362	1.615	50	20	IDGD	
CNS(=O)(=O)c1ccc(-c2ccc(C=NNC(=O)[C@H](C)CN3CCOCC3)o2)cc1	812440710	GYCCWFHAZUPKMY-OAHLLOKOSA-N	434.518	1.273	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)[C@](C)(O)C3CCC3)c2)cc1	813363545	LWJPNTPHJGZMIJ-OAQYLSRUSA-N	447.513	1.808	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)[nH]n1)C(=O)Nc1cn(Cc2ccccc2)nn1	815564975	YWQLDXYQTOQYNB-UHFFFAOYSA-N	430.428	1.116	50	20	IDGD	
Cn1ccnc1[C@@H](NC(=O)NNC(=O)c1csc(N2CCOCC2)n1)c1ccccc1	840461907	MJSBJCAPCFMFGF-INIZCTEOSA-N	441.517	1.447	50	20	IDGD	
O=C(NNC(=O)[C@@H](O)[C@H](O)c1nc2ccccc2s1)c1cc(Br)c[nH]1	843450684	PIZMVKNHCCKYGS-RYUDHWBXSA-N	425.264	1.242	50	20	IDGD	
C[C@@H](CN1CCCCC1)C(=O)NN=Cc1c(N2CCOCC2)nc2ccccn2c1=O	874091580	SBZPWKUMBJXPJM-KRWDZBQOSA-N	426.521	1.103	50	20	IDGD	
COc1cccc(OC)c1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	912642915	IRBKSNFLWNEFFJ-UHFFFAOYSA-N	433.486	1.563	50	20	IDGD	
CC(C)[C@H](NS(=O)(=O)c1ccc(Br)cc1)C(=O)NNc1ncccn1	913044409	WUPIKDJQNMXKMZ-ZDUSSCGKSA-N	428.312	1.685	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)C1CCN(c2cnccn2)CC1	914109837	LHBCBULGXRMEOW-UHFFFAOYSA-N	434.294	1.682	50	20	IDGD	
COC[C@@H](C)n1c(C)cc(/C=C(/C#N)C(=O)N2CCN(S(=O)(=O)N(C)C)CC2)c1C	914504178	QTAWIFHCUHPVIV-BKAYVGFPSA-N	437.566	1.170	50	20	IDGD	
COc1c(C)cc(S(=O)(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)cc1C	915184940	NWMVHMLJMIGVKV-UHFFFAOYSA-N	440.547	1.537	50	20	IDGD	
O=C(NCCN1CCN(Cc2ccccc2)CC1)NNC(=O)c1nnc(O)c2ccccc12	915901248	GEYCRDUYDCOUCU-UHFFFAOYSA-N	449.515	1.097	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc([C@H](C)NC(=O)NN[C@]2(C)CCS(=O)(=O)C2)cc1	915901803	LKYQRSHBTFJVGG-KBXCAEBGSA-N	446.595	1.159	50	20	IDGD	
COc1cc(C=NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc2c1OCO2	916323548	LXTSKNBWYOQBPJ-UHFFFAOYSA-N	431.470	1.972	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)NCc2cccnc2N2CCOCC2)cc1OC	916400263	ZTAAZWPHWYZGJB-UHFFFAOYSA-N	429.477	1.470	50	20	IDGD	
O=C(NCC(F)(F)F)c1cccc(S(=O)(=O)NNC(=O)c2ccc3c(c2)OCO3)c1	917718025	RHEMGYZLAAISSK-UHFFFAOYSA-N	445.375	1.331	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(S(=O)(=O)NC2CC2)cc1)c1ccc2ccccc2c1	917749058	BWJLPGHQNHPGAJ-UHFFFAOYSA-N	445.522	1.904	50	20	IDGD	
O=C1Cc2cc(S(=O)(=O)NNC(=O)c3ccc(F)cc3Br)ccc2N1	917754901	NATLHPSITIGSPW-UHFFFAOYSA-N	428.239	1.706	50	20	IDGD	
CCOc1ccc(-c2nc(CC(=O)NNC(=O)N[C@@H]3CCS(=O)(=O)C3)cs2)cc1	919884629	HFLNFBCWPLRIDZ-CYBMUJFWSA-N	438.531	1.269	50	20	IDGD	
NC(=O)c1ccc(/C=C\C(=O)N2CCC[C@@H]2C(=O)NNC(=O)c2ccc(Cl)cc2)cc1	920020398	UZQNFVLXXNNQRU-OHMHXEGESA-N	440.887	1.904	50	20	IDGD	
C[C@H]1CN(Cc2cccc(CNC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)c2)CCO1	920238399	WQTIZDCKZFJHJH-HNNXBMFYSA-N	427.461	1.960	50	20	IDGD	
CC(C)C(=O)NNC(=O)c1ccc(NC(=O)C[C@@H]2SC(N3CCCC3)=NC2=O)cc1	920954265	LGYITNHDJKVBFF-HNNXBMFYSA-N	431.518	1.526	50	20	IDGD	
O=C(NNC(=O)C12C[C@H]3C[C@@H](CC(O)(C3)C1)C2)c1ccc(S(=O)(=O)N2CCCC2)cc1	1317729409	XGAVGYCUFCYQDN-KILAXVPQSA-N	447.557	1.563	50	20	IDGD	
O=C(NN=Cc1nc(-c2ccccc2)c[nH]1)c1cccc(S(=O)(=O)N2CCOCC2)c1	1318462450	GHPBWNVZFUWGTC-UHFFFAOYSA-N	439.497	1.862	50	20	IDGD	
CC(C)(C)OC(=O)NCCN(CC(=O)NNC(=O)N1CCOCC1)Cc1ccccc1	1320220869	JDTOGDXNYKBMTO-UHFFFAOYSA-N	435.525	1.086	50	20	IDGD	
CCOC(=O)c1sc(CNC(=O)NNC(=O)c2cncn2-c2ccccc2)nc1C	1322355917	DMXAHAPUOANVPG-UHFFFAOYSA-N	428.474	1.958	50	20	IDGD	
Nc1cnnc(NNC(=O)CCNS(=O)(=O)c2c(Cl)cccc2Cl)c1Cl	1322655292	LDMVEKCKMVLUFS-UHFFFAOYSA-N	439.712	1.831	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)Cc3c[nH]c4cnccc34)cc2)CC1	1327964277	HBNHKOMRFARIJH-UHFFFAOYSA-N	428.518	1.185	50	20	IDGD	
Cc1ccc(-c2nnn(CC(=O)NNC(=O)C3CCN(C(=O)OC(C)(C)C)CC3)n2)cc1	1328654778	XTIXDNJSDUZSNU-UHFFFAOYSA-N	443.508	1.443	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2)c1ccnc2ccccc12	1778423221	JVECFOSMPLHGLX-NNMXDRDESA-N	431.920	1.962	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cccn4cncc34)C2)C1	1778688847	QMNZFFQCJMOKRX-KXBFYZLASA-N	435.322	1.951	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)cc1	1779300630	XDFFAGFANOUQQH-NRFANRHFSA-N	433.581	1.940	50	20	IDGD	
C=CC[C@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1	1779374543	OBUHUHJNMKBQCV-QXATTWAWSA-N	429.521	1.025	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2)c1cc(-c2cccnc2)[nH]n1	1779753891	ROIOYUVDKQJPCO-WAOWUJCRSA-N	447.923	1.199	50	20	IDGD	
O=C(c1cncc2cnccc12)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1780014428	ITJHKFXCEFWOQQ-QAPCUYQASA-N	437.269	1.764	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3cn(C(C)(C)C)nn3)C2)C1	1780351054	HUFBGFZQZMYHMG-ACJLOTCBSA-N	442.358	1.508	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3nc4cc([N+](=O)[O-])ccc4[nH]3)CCO2)C1	1781220344	YRLLRZBOUFTMEO-DJJJIMSYSA-N	435.868	1.932	50	20	IDGD	
Cc1cc(NC(=O)CC(=O)N2CCO[C@]3(CCN(C(=O)[C@](C)(Cl)CCl)C3)C2)no1	1781229526	IJDKZUBWUJBJID-QZTJIDSGSA-N	447.319	1.378	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Br)C2)c1cnn2c1CCC2	1781287193	GWEOVLQVXZKONQ-IIDMSEBBSA-N	443.317	1.647	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCc1cncnc1)C2	1781998222	PQMSBPZQJMCGJF-IDHHARJASA-N	439.354	1.707	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnoc1C1CC1)C2	1782170954	JDWADYDNEUFPSR-RZQQEMMASA-N	425.913	1.933	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C1(Br)CC1)C2	1782179785	UNDUOKXNGIHNBI-WOSRLPQWSA-N	437.762	1.682	50	20	IDGD	
C[C@@H](C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Br)C2)n1cccn1	1782557911	MYDMHMPWWCCYJQ-QDEZUTFSSA-N	431.306	1.649	50	20	IDGD	
C[C@H](CC(=O)N1CCO[C@@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1)Oc1ccccc1	1783937811	XUXKIAXXMDMFNV-WZONZLPQSA-N	446.548	1.047	50	20	IDGD	
Cc1ccc(C)c(C(=O)N2CC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c1	1784972345	BMDWTAJIYMANTA-HSZRJFAPSA-N	437.500	1.059	50	20	IDGD	
CN(C)c1cncc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Br)C[C@@H]32)c1	1785555053	QFPGSPZLQOUOHV-VCOSZWKGSA-N	443.317	1.431	50	20	IDGD	
Cc1nc(O)c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CO[Si](C)(C)C)C[C@@H]32)nc1C	1785574048	MEMXCJLONWHALK-JYJNAYRXSA-N	436.585	1.244	50	20	IDGD	
C[C@@H](Br)C(=O)NC1(c2ccc(NC(=O)CN3C(=O)CNC3=O)cc2)CCC1	1786643657	BYWJLEYAIJKBJU-LLVKDONJSA-N	437.294	1.456	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc4ccoc4s3)[C@H]2C1	1787281060	SOLBMPXIHBZHSY-JYJNAYRXSA-N	448.545	1.461	50	20	IDGD	
Cc1nc2cccc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)[C@H](O)CCl)C[C@@H]43)c2s1	1787869396	ZKABVMIDXSPBIY-SDNTUTLCSA-N	437.949	1.798	50	20	IDGD	
O=C(CN1CCCCC1)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1	1787895652	QWBKCMCZUQUESR-UHFFFAOYSA-N	435.333	1.600	50	20	IDGD	
C[C@H]1CCc2c(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)CO[Si](C)(C)C)C[C@@H]43)n[nH]c21	1787953356	UCCUGQRWGPRRKO-OTRWWLKZSA-N	434.613	1.904	50	20	IDGD	
O=C(Cc1ccccn1)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1	1788140801	YJWVDUNZLXTZCA-UHFFFAOYSA-N	429.285	1.752	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)C1=NO[C@@H](c2ccccc2)C1	1788141522	KORFJGMLYGQIPN-OBQKDBCYSA-N	435.908	1.083	50	20	IDGD	
Cc1noc(CC(=O)Nc2ccc(C3(NC(=O)CCC(=O)NN(C)C)CCC3)cc2)n1	1788224679	GDZGIPKWXSVHRZ-UHFFFAOYSA-N	428.493	1.428	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3c(F)cncc3F)[C@H]2C1	1789011522	BFIYPIFAVWLQQC-RMIALFOJSA-N	432.265	1.737	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc4n(n3)CCCN(C)C4)[C@H]2C1	1790523587	BSUWLZIFKKKWFD-RMRDIRSESA-N	437.972	1.329	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)n3cc(C)cn3)C[C@@H]21	1790963773	LXPUBLKFIVOSBZ-WOYTXXSLSA-N	441.370	1.906	50	20	IDGD	
COc1ncc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]3C2)cc1F	1791057232	QIYCVOVROCPOID-MPXAEWJHSA-N	444.301	1.606	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(C)c4n[nH]cc4c3)C[C@@H]21	1791257169	RJGPLAVNEKXUJW-RUGDWHBFSA-N	434.924	1.718	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2C1)c1ccccc1	1791292147	AOPVQBDAGYRXTP-LEAZDLGRSA-N	430.549	1.143	50	20	IDGD	
CCNC(=O)N[C@@H](C)C(=O)NC1(c2ccc(NC(=O)CCC(=O)NN(C)C)cc2)CCC1	1791600980	CHQMCQKGUNPFRH-HNNXBMFYSA-N	446.552	1.201	50	20	IDGD	
C[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(C)(C)CCl)C2	1792760034	FMFYICCLOIBBDS-XQLPTFJDSA-N	431.961	1.754	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CS[C@H]1CCCCO1)C2	1792871203	RIBGFOUMURBMTH-BIYBGRMPSA-N	449.411	1.867	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](NC(C)=O)C(C)(C)C	1793197892	WXPYNXCBHKEMLR-JKJDWNRSSA-N	446.386	1.300	50	20	IDGD	
COc1ccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CO[Si](C)(C)C)C3)cc1C	1793654847	QUEBEWNQBAGZAD-OPMZPASUSA-N	434.609	1.987	50	20	IDGD	
CC(C)(C)NCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)C2	1795566848	GSVJVWIXVMPKRC-RNCDSHHQSA-N	446.498	1.849	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1[nH]nc2ncccc12	1796213420	BIBDHGUCXUTUTA-FMSGJZPZSA-N	436.310	1.192	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc([N+](=O)[O-])cc1F)C2	1797956413	UCOIAGZPOIDBTC-IVWMJMPLSA-N	439.516	1.789	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2n(n1)CCCNC2=O	1797968324	QIGMTKCVPOGWSV-RVMXOQNASA-N	438.326	1.052	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)c1cnc(-c2ccccc2)s1	1798253473	AVTQUSPYFSJBEX-JYYAWHABSA-N	435.933	1.613	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CS(=O)(=O)c1ccc(C)cc1)C2	1799266118	WKYQJNUQWZACRH-LORHWOILSA-N	442.965	1.376	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CCN(C(=O)OC(C)(C)C)C1)C2	1799267786	FXIHTJZICQTESE-NQNKBUKLSA-N	443.972	1.850	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1onc3ccccc13)C2)[C@@H](F)Br	1799346492	AMDHXGHRBZFCSQ-YJKIEOBBSA-N	426.242	1.722	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3cccnc3[nH]1)C2)[C@H](F)Br	1799350426	ZZYDLGODPYANPS-XCCSTKFXSA-N	425.258	1.457	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1nn[nH]c1C(F)(F)F)[C@H](F)Br	1799441329	SDSQKVLFFQHNKV-XIVUIJJLSA-N	428.184	1.766	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1c(O)cc(O)cc1O	1799658110	ZOJFVYVIPHEUEL-DKUFLPSKSA-N	433.288	1.243	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)c(O)c(Cl)c1	1799768313	RLPKRUBQBBAFQT-CBRVECNMSA-N	447.713	1.738	50	20	IDGD	
O=C(/C=C/c1cc(F)c(F)c(F)c1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2	1800867880	VSLGZIZZKMRQMR-HWWWCQEQSA-N	432.826	1.306	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c(F)cc(OC)cc1F)C2	1800977075	HUPYCGPIIFNDBB-WYFUGZQLSA-N	432.851	1.430	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnc3cc(Cl)ccn13)C2	1802333455	YAIOSMAOUXXGGH-MUJYYYPQSA-N	446.939	1.613	50	20	IDGD	
Cc1c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CCC(=O)NN(C)C)ccc2c1OCCO2	1802333516	ZRACNDJOCDMMKF-BJWYYQGGSA-N	444.532	1.391	50	20	IDGD	
Nc1ccccc1/C=C/C(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1	1803138906	PJPCSMUSBBXNEI-IMLDXQGBSA-N	428.920	1.983	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2cc(C(=O)O)ncn2)[C@@H]1c1cccnc1	1804969763	ZKBURYGBZZMEOE-KEYYUXOJSA-N	431.880	1.907	50	20	IDGD	
COC(=O)CCC(=O)N1CC[C@@H](CNC(=O)CCBr)[C@@H]1c1cccnc1	1806339491	MWGSTDSGAGKKSG-KSSFIOAISA-N	426.311	1.826	50	20	IDGD	
CCOC(=O)/C=C/C(=O)N1CC[C@H](CNC(=O)[C@H](F)Br)[C@H]1c1cccnc1	1808662376	YXQBBJNAUMQYGC-OOLREGJWSA-N	442.285	1.897	50	20	IDGD	
CC1=CC[C@H](C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)CC1	1809478516	OCDXFXCRRKHKEQ-AVCGJXAMSA-N	447.344	1.827	50	20	IDGD	
CN1CCN(CCC(=O)N2CCCC3(CCN(C(=O)CCBr)CC3)C2)CC1	1809550363	POWGYWMVMWJCLP-UHFFFAOYSA-N	443.430	1.640	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@H](CNC(=O)C2=NNC(=O)C2)[C@@H]1c1cccnc1	1810221060	FUBCJLCVXSEZQV-QITLCBANSA-N	426.304	1.200	50	20	IDGD	
Cc1ccccc1C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1811775548	CZPAHTXGTUAMBA-NFBKMPQASA-N	443.312	1.703	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)Cc2ncccn2)[C@@H]1c1cccnc1	1812865857	YMRLJHBIAIGCRE-JCKWVBRZSA-N	432.322	1.904	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)[C@@H]2CC=CCC2)[C@@H]1c1cccnc1	1813068408	MJXGRSSFJUYNMK-ZWCUEREDSA-N	427.549	1.817	50	20	IDGD	
C[C@H]1CC[C@H](C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)CC1	1813546338	OYEWVRGHTFWYJG-CFFRYYMNSA-N	449.360	1.907	50	20	IDGD	
COc1ncc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)[C@H](O)CCl)n[nH]2)cc1F	1814867474	LVMYOVSTYPUNPS-ZIAGYGMSSA-N	425.848	1.858	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H]1CCC(F)(F)C1)CC2)c1ccc(B(O)O)cc1	1815336002	WFEXGUVERWEOCF-TZMCWYRMSA-N	449.288	1.484	50	20	IDGD	
Cc1ccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)nc1	1816540455	XPKVFPHFGZCWIH-IBGZPJMESA-N	433.277	1.413	50	20	IDGD	
O=C(N[C@H]1CCc2nc(NC(=O)[C@@H](F)Cl)sc2C1)c1cc(=O)nc2sccn12	1817125442	OJZIMZGABNYHDL-JVXZTZIISA-N	441.897	1.973	50	20	IDGD	
CC(C)=NO[C@H](C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1	1817477157	NPFNOHWCYPSAQD-KDOFPFPSSA-N	441.297	1.196	50	20	IDGD	
COCCn1ccc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@@H](Cl)COC)CC3)n1	1817618092	KFSSACUFLUSYMX-RYUDHWBXSA-N	441.941	1.466	50	20	IDGD	
CN[C@@H](CC(=O)N1CCCC[C@@H]1c1cc(NC(=O)CO[Si](C)(C)C)n[nH]1)C(=O)O	1819593463	ILHOGKAGXUFJJE-UONOGXRCSA-N	425.562	1.316	50	20	IDGD	
COC[C@H](NC(C)=O)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@](C)(Cl)CCl)[nH]n1	1819611686	KTVGTWYSZUWZMA-IYOUNJFTSA-N	448.351	1.789	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1	1819801077	YLQFDAOJKVODCU-BXKDBHETSA-N	436.925	1.385	50	20	IDGD	
NC(=O)c1nccnc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)C(Cl)Cl)[nH]n1	1820027232	XEMMSQQNQLTUKQ-VIFPVBQESA-N	426.264	1.408	50	20	IDGD	
Cc1ccc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)CCC(=O)NN(C)C)CC3)c(O)n1	1821518122	AJMJVMKHVOIHEQ-GFCCVEGCSA-N	446.533	1.151	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)C[C@H](NC)C(=O)O)[nH]n1	1822087145	GOSWZKQVWMMEGH-DRZSPHRISA-N	444.330	1.638	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnc(N(C)C)o1)CC2	1825994743	YRFPJZMJODEGAD-VHSXEESVSA-N	427.914	1.677	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](C)Cn1cncn1)CC2	1825999926	GPGHBMFOADFTJB-WOPDTQHZSA-N	426.930	1.237	50	20	IDGD	
O=C(CC(F)(F)F)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827051064	MIHQVCLAXUKFFC-KRWDZBQOSA-N	426.244	1.552	50	20	IDGD	
Cc1ncc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)s1	1827059168	HWUIBGCIKDKHAK-LJQANCHMSA-N	441.362	1.678	50	20	IDGD	
C/C=C/C(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)[C@@H](O)CCl)C2)C1	1829269483	VDQIFRWXEPUMRF-CKCUPWHLSA-N	449.935	1.614	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)C3CC(F)(F)C3)CCO2)C1	1829983511	QZFYUMZOPIXXAC-MLGOLLRUSA-N	439.297	1.519	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cn(C(C)(C)C)nn3)C2)C1	1830364665	OGPMAPSSDGCVOT-FQEVSTJZSA-N	441.960	1.368	50	20	IDGD	
CCC[C@H](NC(C)=O)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830370610	NJJOFSOYNLEUEL-JXFKEZNVSA-N	431.961	1.013	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)CBr)C2)C1	1831639340	QOHVKBFMBKLKAL-GRDNDAEWSA-N	439.778	1.881	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(C)o3)CCO2)C1	1831801870	WDDRJYDUELQSPT-KSSFIOAISA-N	429.311	1.832	50	20	IDGD	
Cc1noc(C)c1C(=O)N1CCC([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1	1831871993	JSLRXUZWRFIHDB-SFHVURJKSA-N	433.553	1.898	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)/C=N/N2CCCCC2)CC1	1831873439	LCDSOZVIGLLETI-AYBPGSHHSA-N	448.612	1.451	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)N2CCO[C@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)c1	1832442722	DKFSOYDTFFWWKV-HXUWFJFHSA-N	445.343	1.942	50	20	IDGD	
CN1Cc2ccccc2C[C@@H]1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1832468833	SILBPZGRBVLPFO-DBXWQHBBSA-N	439.915	1.034	50	20	IDGD	
C[C@H](C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)CCl)CC2)CC1)n1cccc1C=O	1833310474	KSGBUHCTXKTEIM-DNVCBOLYSA-N	438.956	1.033	50	20	IDGD	
CC(C)c1nc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)co1	1833348223	MFTIDBBMEXEVKN-UGSOOPFHSA-N	444.326	1.651	50	20	IDGD	
C=CCO[C@@H](C)C(=O)NC1CCN(C2CCN(C(=O)[C@H](C)Br)CC2)CC1	1833477102	UJDFKOAANCZYAN-GJZGRUSLSA-N	430.387	1.933	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)n3cnnn3)CC2)CC1	1833535607	ZEMBMOHHQBBBND-PBHICJAKSA-N	425.965	1.213	50	20	IDGD	
COc1cnc(C(=O)N2CCO[C@@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)c(F)c1	1833635270	OEYYGJVRBDMDIL-KRWDZBQOSA-N	436.267	1.103	50	20	IDGD	
Cc1cc(C(=O)NC2CCN(C3CCN(C(=O)[C@H](C)Br)CC3)CC2)nn1C	1834175950	SZNKSFHXCFTDKT-AWEZNQCLSA-N	440.386	1.697	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)c3ccnc(F)c3)C2)C1	1834819088	HSNVYZVJKWFLIV-QGZVFWFLSA-N	430.274	1.076	50	20	IDGD	
Cn1cc(CCC(=O)NC2CCN(C3CCN(C(=O)CO[Si](C)(C)C)CC3)CC2)cn1	1834820855	YBDZJYQJXITECN-UHFFFAOYSA-N	449.672	1.776	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)c1c(F)cncc1F	1835995581	KBGWIEAEYHOUJB-INIZCTEOSA-N	430.883	1.145	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(N2CCC(NC(=O)C3(F)CC3)CC2)CC1	1836517725	CEDVOWLGCOOGGT-CVKSISIWSA-N	446.527	1.194	50	20	IDGD	
CN(C)c1cncc(C(=O)N2CCC(OC3CCN(C(=O)[C@H](O)CCl)CC3)CC2)c1	1836715701	WRIHVFSCDCHQAH-LJQANCHMSA-N	438.956	1.360	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3ccsc3)C2)C1	1837711786	PSOVPCDFTULINH-HXUWFJFHSA-N	440.638	1.989	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(C)n(CC)n3)CCO2)C1	1838147218	WRDBUYXJRCTORH-OXQOHEQNSA-N	426.945	1.689	50	20	IDGD	
Cc1ccccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)Br)C2)C1	1838900412	DYARJEYVFALLLV-DNVCBOLYSA-N	425.323	1.848	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)COc3ccc(OC)cc3)C2)C1	1839141186	AEPFNVRHQHOVQU-GHTZIAJQSA-N	440.924	1.548	50	20	IDGD	
C[C@H](C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2)n1cccn1	1839155533	WKADZXCXJNWPOC-OLMNPRSZSA-N	433.336	1.137	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccc(O)cn3)C2)C1	1839156207	HQKXIIDEESMADN-RBUKOAKNSA-N	446.331	1.022	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CCCS3)C2)C1	1839156226	IEDTVNDNBZQHIP-JQFCIGGWSA-N	425.378	1.575	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CCC(F)(F)F)C2)C1	1839963352	IIHJKBKWEQFMJH-WFASDCNBSA-N	445.276	1.959	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(Cl)nc3)C2)C1	1840149625	VWJFTHPOYYSFEQ-KSSFIOAISA-N	432.304	1.059	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CSc3ccccc3)C2)C1	1840151706	MAVQGDJOUZIMCO-PXNSSMCTSA-N	442.965	1.489	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(OC)c3C)CCO2)C1	1840645221	JJKAIFXTSRBQSQ-UWJYYQICSA-N	440.924	1.327	50	20	IDGD	
O=C(C(Cl)Cl)N1CCOC[C@@]2(C1)CN(C(=O)[C@@]1(F)CCCC=C1F)CCO2	1840951388	LJSHLRQCKIKJFM-IAGOWNOFSA-N	427.275	1.992	50	20	IDGD	
CC(C)(C(=O)N1CCCC12CN(C(=O)[C@@H](O)CCl)C2)c1ncc(Br)cn1	1841452721	CCVFURYEYFQWAN-LBPRGKRZSA-N	445.745	1.320	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2coc(C(C)C)n2)C1	1842166457	QIKGLOWRWRCOPS-ZVHZXABRSA-N	426.477	1.749	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)c2cn(C)cn2)C1	1842527608	JVSIUEGBKGGBOQ-UHFFFAOYSA-N	427.417	1.384	50	20	IDGD	
O=C(/C=C/c1cc2ccccc2o1)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843011373	WPJFOTZDBAAHGW-ZHACJKMWSA-N	430.269	1.643	50	20	IDGD	
COc1ccc2nc(C(=O)N3CCCC34CN(C(=O)c3ccc(B(O)O)cc3)C4)ccc2c1	1843747027	SIALFESNZGGMAN-UHFFFAOYSA-N	445.284	1.054	50	20	IDGD	
Cn1c(=O)n(CC(=O)N2CCCC23CN(C(=O)[C@](C)(Cl)CCl)C3)c2ccccc21	1843860233	AZRQKOQQHWZRJZ-LJQANCHMSA-N	439.343	1.780	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCCC12CN(C(=O)c1cccc(N3CCOCC3)n1)C2	1844378199	QUZKTPPUAOVOTR-UHFFFAOYSA-N	432.597	1.587	50	20	IDGD	
COc1ccsc1C(=O)N1CCCC12CN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2	1844583785	FFOVWKHUNXPYMK-LPYMAVHISA-N	429.502	1.708	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC2(CCCN2C(=O)Cn2ccncc2=O)C1	1845768244	GLWOOCIJFGFAFS-LZYBPNLTSA-N	439.422	1.332	50	20	IDGD	
CCOC(CC(=O)N1CCCC12CN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2)OCC	1846478004	RNMFNYMBFJIDTA-HZHRSRAPSA-N	433.509	1.113	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CCCC[C@H]1C(=O)N1CCCC12CN(C(=O)[C@H](O)CCl)C2	1846950087	SETKIAIOKNXFAS-BZUAXINKSA-N	443.972	1.873	50	20	IDGD	
Cc1noc(N)c1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1848099844	YYYKICDIVSSALW-AVGNSLFASA-N	441.916	1.513	50	20	IDGD	
O=C(NNC(=O)c1n[nH]c(=O)c2ccccc12)C1=Cc2cc(Br)ccc2OC1	10372729	NIWWYYHYZVXZIC-UHFFFAOYSA-N	441.241	1.923	50	20	IDGD	
O=C(CCNC1=NS(=O)(=O)c2ccccc21)NNC(=O)c1cc(-c2ccccc2)on1	28793108	MSBBJCAEPIEZBM-UHFFFAOYSA-N	439.453	1.231	50	20	IDGD	
Cc1nc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)nc2ccccc12	726715207	LOKSMMJAEMDYDH-UHFFFAOYSA-N	442.501	1.333	50	20	IDGD	
C[C@@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)NNC(=O)CCCc2ccccc2)C1=O	727717392	OXLCJFRXNYJKLC-QFIPXVFZSA-N	426.448	1.763	50	20	IDGD	
O=C(NCCCN1CCN(c2ncccn2)CC1)NNC(=O)c1cccc(OC(F)F)c1	728594077	DRODTGJQBAXNBJ-UHFFFAOYSA-N	449.462	1.234	50	20	IDGD	
CC(C)S(=O)(=O)c1ccccc1C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	728845892	OUVROUSSISNRBS-UHFFFAOYSA-N	431.518	1.336	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)C1CCN(c2ncccn2)CC1	728847667	KHNSTWQZMYLFFV-INIZCTEOSA-N	442.545	1.597	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)[C@H]2CCCN(S(=O)(=O)c3ccccc3)C2)cn1	729692750	PIQOQXPZNSMANJ-AWEZNQCLSA-N	449.558	1.509	50	20	IDGD	
CC(=NNC(=O)Cc1csc(C)n1)c1cccc(N(S(C)(=O)=O)S(C)(=O)=O)c1	729816783	OOJPXRHBBNVUIW-UHFFFAOYSA-N	444.560	1.260	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccccc1	730034498	WDFWPRHBFMKHAL-SFHVURJKSA-N	431.514	1.716	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1ccc(C(=O)NNC(=O)Cc2cc[nH]n2)cc1	730102550	QQECXNVKCMIDBX-UHFFFAOYSA-N	429.458	1.223	50	20	IDGD	
CCOc1ccc(-c2noc(CCC(=O)NNC(=O)COc3ccccc3O)n2)cc1	730779822	KMCTVYOMFPBBOO-UHFFFAOYSA-N	426.429	2.000	50	20	IDGD	
COc1cc(C=NNC(=O)c2ccnc(N(C)C)c2)ccc1OCC(=O)N1CCOCC1	731561921	CTUSBJASJDQAMV-UHFFFAOYSA-N	441.488	1.158	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)c1cccc(CN2CCS(=O)(=O)CC2)c1)c1ccccc1	731995836	BLQCUCBVDSTGGN-FQEVSTJZSA-N	429.542	1.872	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCc2ccc(N(C)S(C)(=O)=O)cc2)cc1OC	732237177	DBZYQWSSOIJTKM-UHFFFAOYSA-N	436.490	1.244	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)NCCCN1CCN(c2ncccn2)CC1)c1ccccc1	732238561	OAUVQRXPOHAKGK-IBGZPJMESA-N	425.537	1.513	50	20	IDGD	
Cn1cc(C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c(C2CCCCC2)n1	732335410	IKTPENBDJTXJSN-UHFFFAOYSA-N	429.433	1.994	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)NCCNC(=O)c2ccc(C)cc2)cc1	732468520	UTQGKKDVACGEHS-INIZCTEOSA-N	428.489	1.921	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@H](NC(=O)NN[C@]1(C)CCS(=O)(=O)C1)C1CCCCC1	732474368	BWTQTUINVDJZET-HNAYVOBHSA-N	432.587	1.841	50	20	IDGD	
O=C(NCC1CCN(S(=O)(=O)C(F)F)CC1)NNC(=O)C12CC3CC(CC(C3)C1)C2	733042644	SYLWWHMZYGFOET-UHFFFAOYSA-N	448.536	1.798	50	20	IDGD	
CN(C)C(=O)[C@@H]1CCC[C@H](NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)C1	734220750	JKTGDJHZRMCNSG-MOPGFXCFSA-N	444.580	1.176	50	20	IDGD	
CC(=O)NCC(=O)N1CCc2cc(C(=O)NNC(=O)COc3cc(C)cc(C)c3)ccc21	735646991	PHKJMEVKLKWWJM-UHFFFAOYSA-N	438.484	1.169	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN2CCN(CC(=O)N3CCCCCC3)CC2)cc1C	736307783	CBNIGLOFBKPKIZ-UHFFFAOYSA-N	449.621	1.400	50	20	IDGD	
O=C(COC(=O)c1cc(N2CCNC2=O)ccc1F)NNC(=O)c1ccc(Cl)cc1	738699186	OCWMMCLDGRIYRC-UHFFFAOYSA-N	434.811	1.627	50	20	IDGD	
NC(=O)CNS(=O)(=O)c1ccc(C(=O)NN(Cc2ccccc2)c2ccccc2)o1	741145997	YXBPOPQAEYVKQE-UHFFFAOYSA-N	428.470	1.395	50	20	IDGD	
CC(C)c1nn([C@@H]2CCS(=O)(=O)C2)cc1C(=O)NNC(=O)Cn1cnc2ccccc21	742470843	BATAZAZXJMLXCW-CQSZACIVSA-N	444.517	1.177	50	20	IDGD	
Cc1nn(C)c(C)c1S(=O)(=O)N[C@H](C)C(=O)NNc1ccc(Br)cc1	743299841	UOQXKPMISROUSA-SNVBAGLBSA-N	430.328	1.610	50	20	IDGD	
C[C@H](COCC(F)(F)F)NC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	743341354	KQYZUBLHHLWSDK-OAHLLOKOSA-N	431.459	1.497	50	20	IDGD	
O=C(Cc1cc(O)nc(O)n1)NN=Cc1cc(Br)cc(Br)c1O	743445733	FCHAJNNAIASBBW-UHFFFAOYSA-N	446.055	1.811	50	20	IDGD	
C[S@@](=O)Cc1cccc(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)c1	744619442	OXBSIIDJGBEEMQ-MUUNZHRXSA-N	437.543	1.343	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)[C@@H]1CN(Cc2nc(O)c3ccccc3n2)CCO1	746097861	BXYWQCNXXXLGEX-SFHVURJKSA-N	439.447	1.065	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)c2ccc(=O)n(-c3ccc(F)cc3)n2)o1	746391785	HCCMFYBURZEZRU-UHFFFAOYSA-N	427.436	1.881	50	20	IDGD	
CCCOc1ccc(CC(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)cc1OCCC	746833742	GCRIBYPUUQVALX-HNNXBMFYSA-N	427.523	1.324	50	20	IDGD	
COC(=O)/C=C\c1cc(OC)c(OC)c(S(=O)(=O)NNC(=O)c2ccc(C#N)cc2)c1	747072596	HEFWVAYHQDFMIS-TWGQIWQCSA-N	445.453	1.385	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)Cc2ccncc2)cc1Br	747326706	UFMZBFWHIDYOJM-UHFFFAOYSA-N	441.307	1.098	50	20	IDGD	
C[C@H]1CN(C(=O)c2ccc(CNC(=O)NNC(=O)Cc3ccncc3)cc2)C[C@H](C)O1	747581912	RHSVZSUWFHXRFO-HOTGVXAUSA-N	425.489	1.404	50	20	IDGD	
Cc1ccc(-n2cnnn2)cc1NC(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	747823408	JNANLFQSAVEZGN-UHFFFAOYSA-N	428.478	1.560	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCOCC2)cc1C(=O)NNc1cc(Cl)nc(C)n1	747983305	NFHNUILDOYZTBC-UHFFFAOYSA-N	441.897	1.225	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)NC2CCN(C3CCN(C)CC3)CC2)cc1	747990665	URPMUUYKLROXSE-KRWDZBQOSA-N	447.580	1.742	50	20	IDGD	
Cn1nc(Br)c2c(=O)n(CC(=O)NNc3ccc(OC(F)F)cc3)cnc21	748656584	YHCPUULVPDYGJY-UHFFFAOYSA-N	443.208	1.637	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2ccc(O)c(NC(C)=O)c2)ccc1OC(C)C	748674288	OZPYZBWSUDEMGS-UHFFFAOYSA-N	437.474	1.770	50	20	IDGD	
CO[C@H](C)c1nc(C)c(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)s1	749333214	KFWYDHROKVNLGJ-MRVPVSSYSA-N	432.911	1.535	50	20	IDGD	
N#Cc1ccc(N2C(=O)N[C@H](CCC(=O)NNC(=O)c3cc4ccccc4o3)C2=O)cc1	749473774	MPMDBBBXFBATRL-MRXNPFEDSA-N	431.408	1.971	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N[C@H]1CC(=O)N(C(C)(C)C)C1	750660177	PGCQRRRAVIJXHQ-YPMHNXCESA-N	441.326	1.946	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN(C(=O)c2ccc3n[nH]cc3c2)C1)c1cccc([N+](=O)[O-])c1	751282701	NZZHIAVTDBQHFM-HNNXBMFYSA-N	436.428	1.785	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)c1ccc(=O)n(CCOc2ccccc2Cl)c1	751894611	RPDGBIBDDUZWDW-UHFFFAOYSA-N	426.860	1.979	50	20	IDGD	
CN1C(=O)c2cccc3c(S(=O)(=O)NNC(=O)c4ccc5c(c4)OCO5)ccc1c23	753767599	ADQDSRACXPXWTH-UHFFFAOYSA-N	425.422	1.782	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H]2C[C@H](C)N(C3CC3)C2)c1	753943514	PBONWJCPDXZODX-GOEBONIOSA-N	437.566	1.286	50	20	IDGD	
C[C@H](CS(=O)(=O)c1ccc(F)cc1)C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	755160979	UFSSQYXBSBOQLM-GFCCVEGCSA-N	442.490	1.100	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)Nc1cccc(S(=O)(=O)NC2CC2)c1	755585066	GILKHOKRSBLRCL-UHFFFAOYSA-N	449.445	1.267	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)c2nnc(O)c3ccccc23)ccc1N1CCCC1=O	755590929	BSWVVMAFLLHMOJ-UHFFFAOYSA-N	436.428	1.937	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)Nc1ccc(F)c(-n2nnnc2C2CC2)c1	756776965	FBWZELJGMJKAPS-UHFFFAOYSA-N	441.423	1.919	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2ccc3c(c2)N(C)C(=O)CO3)c2ccccc2c1=O	756828970	ARLWZCDCOLGXSN-UHFFFAOYSA-N	436.428	1.238	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2ccc(C(=O)NNc3ccc(C(N)=O)nn3)cc2)cc1C	757409012	YDNGLJXHMPWHIS-UHFFFAOYSA-N	440.485	1.750	50	20	IDGD	
Cc1nn(CCCl)c(C)c1C(=O)N1CCN(S(=O)(=O)CBr)CC1	758522946	LSYQIVVEUBNTEK-UHFFFAOYSA-N	427.752	1.179	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NCCOc1cccc(C(F)(F)F)n1	758747555	UAJWAAKFAZPRTJ-UHFFFAOYSA-N	431.396	1.301	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN(C(=O)Nc2ccccc2F)C1)C(=O)Nc1ccccn1	758831903	DSYGXMSHUYSEGS-CYBMUJFWSA-N	428.424	1.251	50	20	IDGD	
CCOc1nc(C(F)(F)F)ccc1C(=O)OCC(=O)NNC(=O)Cc1nc(C)cs1	759300650	XCZVBVFBXNHMQI-UHFFFAOYSA-N	446.407	1.811	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)c3ccc(=O)n(-c4cnn(C)c4)c3)n[nH]2)cc1	760824962	OWEWLAWDYBAVMG-UHFFFAOYSA-N	431.456	1.598	50	20	IDGD	
O=C(CSCC(F)(F)F)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	761486684	GBTHEVMBIZPNHN-UHFFFAOYSA-N	438.903	1.901	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)[C@@H](C)NC(=O)c2cc3c(C)nn(C)c3s2)n1	762893540	HSMLLDXIIRUZHN-GFCCVEGCSA-N	430.538	1.841	50	20	IDGD	
O=C(CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@H]12)NNC(=O)c1cc(-c2cccs2)[nH]n1	763157867	MAIGBIGHCMJRFQ-NOLJZWGESA-N	434.547	1.625	50	20	IDGD	
CC(C)S(=O)(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c1	763442056	KVCRWPWQWQLQPJ-UHFFFAOYSA-N	448.457	1.318	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(OCc2ccncc2)cc1	763470486	IVOXLXVVIYPTEV-UHFFFAOYSA-N	435.396	1.969	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2Br)cc1[N+](=O)[O-]	763482830	KZVXRBBJPZFJPC-UHFFFAOYSA-N	437.206	1.766	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2Br)cc1C(=O)N(C)C	763484118	YCJJNKBUUATOAZ-UHFFFAOYSA-N	447.289	1.859	50	20	IDGD	
CC(C)OC(=O)c1c(NC(=O)C(=O)NNC(=O)c2cccnc2)sc2c1CCCC2	763494465	DOPDCADXYBXKKH-UHFFFAOYSA-N	430.486	1.987	50	20	IDGD	
O=C(NNC(=O)c1c[nH]c2ccccc12)C(=O)Nc1ccc2c(c1)C(=O)N(CC1CC1)C2=O	763534103	BBNLEFFICUXUEH-UHFFFAOYSA-N	445.435	1.574	50	20	IDGD	
Cc1coc(-c2ccc(C)c(NC(=O)C(=O)NNC(=O)[C@@H]3COc4ccccc4O3)c2)n1	763572085	LOTJFJUMXSWNRO-SFHVURJKSA-N	436.424	1.884	50	20	IDGD	
O=C(COc1cccc(C(F)(F)F)c1)NNC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1	763639341	LTUPWCRIEZBLDN-UHFFFAOYSA-N	426.307	1.779	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(-c3nnnn3C3CC3)c2)cc1C	763678714	ASSKCWDUCJBXMA-UHFFFAOYSA-N	449.471	1.457	50	20	IDGD	
COc1cc2nc(C)sc2cc1NC(=O)C(=O)NNC(=O)COc1ccc(C#N)cc1	763682550	VXVZYRNQBFPQLZ-UHFFFAOYSA-N	439.453	1.650	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(N2CCOC2=O)ccc1C	763716228	DRGJJOOYPMZGGA-UHFFFAOYSA-N	440.456	1.679	50	20	IDGD	
Cc1cnc(O)n1-c1ccccc1NC(=O)C(=O)NNC(=O)c1cc2c(s1)CCC2	763783390	NEOLZYRBWLTWKW-UHFFFAOYSA-N	425.470	1.836	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccc(Oc2ccccn2)c1	763807483	CLQPAMTYZOQXIU-UHFFFAOYSA-N	431.408	1.910	50	20	IDGD	
COC(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)cc1	763839265	CWBBRCKKSKVHFZ-HNNXBMFYSA-N	427.457	1.572	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccc2oc(N(C)C)nc2c1	763849903	MFHAMUWGEBRKAX-LLVKDONJSA-N	429.408	1.586	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cnc3c(c2)c(C)nn3C)cc1	763872143	KRMIDBKTUGEQQA-CYBMUJFWSA-N	438.444	1.033	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cnn(-c3ccccc3)c2)cc1	763878723	TVPDCZLXDHOUAH-HNNXBMFYSA-N	435.440	1.628	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)cc1OC	763901205	HJZJSYLGIXBKRM-UHFFFAOYSA-N	432.389	1.410	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(C)nc2N(C)C)ccc1OC(C)C	763916716	UDIIFGHBILZPTM-UHFFFAOYSA-N	429.477	1.652	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)C(=O)Nc1ccn(Cc2ccccc2)n1	763943385	GGTYRFGOYXQGLM-UHFFFAOYSA-N	445.439	1.222	50	20	IDGD	
CN(C)c1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)c1cc(Br)cn1C	764004519	FVZWKVNXOYCYTN-UHFFFAOYSA-N	442.701	1.907	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)on1)C(=O)Nc1cccc(Cn2cncn2)c1	764012092	NJWCNZBWCOASLY-UHFFFAOYSA-N	431.412	1.381	50	20	IDGD	
C[C@@H](CS(=O)(=O)c1ccc(F)cc1)C(=O)NNC(=O)CSc1ccccc1O	764047679	VIEIFVLFPZRYIY-LBPRGKRZSA-N	426.491	1.881	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccc3ccccc3c2)cc1	764081674	KRLPRJYZIXOJDM-UHFFFAOYSA-N	435.436	1.720	50	20	IDGD	
CCCCn1nccc1NC(=O)C(=O)NNC(=O)c1ccc(F)cc1Br	764083712	AGNPGNOESJAPQL-UHFFFAOYSA-N	426.246	1.985	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1O)C(=O)Nc1ccc(CN2CCOC2=O)cc1	764125029	QHPZSXLNBSTJBN-UHFFFAOYSA-N	432.820	1.398	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cc3c(cc2Cl)OCO3)o1	764139656	XKKGNRNLZLUUSV-UHFFFAOYSA-N	436.852	1.903	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2O1)C(=O)Nc1ccc(N2CCCC2=O)c(F)c1	764168261	PBRVVSZGXUOWGK-KRWDZBQOSA-N	426.404	1.042	50	20	IDGD	
COC(=O)N(C)Cc1ccc(NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)cc1	764240031	XZKPECPVDSTGAR-UHFFFAOYSA-N	437.456	1.626	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)C(=O)Nc1ccc(F)c(NC(=O)C2CCCCC2)c1	764295108	IXFVUCJWOXQEPC-UHFFFAOYSA-N	430.440	1.776	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(C)c(C)c3)[nH]n2)n(CCC#N)n1	764387761	MHYBPJLEXNAROG-UHFFFAOYSA-N	434.460	1.512	50	20	IDGD	
CCOC(=O)c1ccsc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	764388495	TVCNEZDIPXOBSE-UHFFFAOYSA-N	445.432	1.854	50	20	IDGD	
Cc1ccc([C@H](C)[C@H](O)C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)cc1	765129083	YJNZXQHBBXUBTI-JXFKEZNVSA-N	433.530	1.624	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)Nc3cccc(F)c3)CC2)cc1	765312269	BSHQABFQHWIPFQ-UHFFFAOYSA-N	449.508	1.293	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)CNC(=O)c3ccc4c(c3)OCO4)n[nH]2)cc1	765575300	LCFUEVCUMKUKER-UHFFFAOYSA-N	435.440	1.559	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)Cc2cccc(NS(C)(=O)=O)c2)n[nH]1	765602699	WCDXQFXFFLWZPO-UHFFFAOYSA-N	443.485	1.461	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)N1CCNC(=O)[C@@H]1c1cccc(Br)c1	766246367	CIQIVVSIELQBRT-LRDDRELGSA-N	425.327	1.504	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)CN1CCN(C(=O)COc2ccc(F)cc2)CC1	766845398	NGCYLRQGHHKQBZ-UHFFFAOYSA-N	442.491	1.047	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)N1CCN(c2c(Cl)cccc2Cl)CC1	767317414	HJOIFJZOSRYRNX-UHFFFAOYSA-N	440.287	1.879	50	20	IDGD	
CN1CC(=O)N(Cc2ccc(C(N)=O)cc2NC(=O)[C@@H](Br)C(C)(C)C)C1=O	768225448	FDCJRUYDJCJKBI-CQSZACIVSA-N	439.310	1.928	50	20	IDGD	
Cc1nn(CC(=O)OC(C)C)c(C)c1C=NNC(=O)C1CCN(c2ncccn2)CC1	768363801	CXOHMITXQVSHQM-UHFFFAOYSA-N	427.509	1.608	50	20	IDGD	
COc1cc(F)cc(CNC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)c1	770303441	WLPGZBACZNQRBD-UHFFFAOYSA-N	438.481	1.294	50	20	IDGD	
CNS(=O)(=O)c1ccc(C(=O)OCC(=O)C(C#N)=C2N(C)c3ccccc3N2C)cn1	770464460	PKWSOWDGTHRLSU-UHFFFAOYSA-N	441.469	1.037	50	20	IDGD	
COc1cc(OC)cc(C(=O)NCC(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)c1	771010453	XFNGOTUXTNREBH-UHFFFAOYSA-N	443.464	1.177	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)c1cccc(S(=O)(=O)N(C)C(C)C)c1	771860180	SLVXJONIUVXLTA-CQSZACIVSA-N	427.523	1.454	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNS(=O)(=O)c1cc(C(=O)O)cc([N+](=O)[O-])c1	773252615	VSAYBMVXSAIAQX-SECBINFHSA-N	443.821	1.723	50	20	IDGD	
Cc1cc(O)c(C(=O)O)cc1S(=O)(=O)NNC(=O)[C@@H](C)Oc1cccc(Cl)c1	773267815	XHBSSTWORQYXTL-SNVBAGLBSA-N	428.850	1.829	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2cnc(Br)c(Br)c2)n1	773727346	XEDCPQXXYMBDRD-UHFFFAOYSA-N	446.059	1.487	50	20	IDGD	
CC(C)c1nccnc1NNC(=O)C(=O)Nc1ccc(C(=O)N2C[C@H](C)O[C@H](C)C2)cc1	774000288	SFRWOJGTGYYNMY-GASCZTMLSA-N	440.504	1.931	50	20	IDGD	
COc1ccc(NC(C)=O)cc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1cccc(Cl)c1	774008203	JSXSUKHSYWTHID-NSHDSACASA-N	448.863	1.860	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1c[nH]nc1-c1ccccn1	774009729	SJCZQUXOQGIGHX-NSHDSACASA-N	428.836	1.679	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)NC[C@H]2COC3(CCCC3)O2)c2ccccc2c1=O	774306771	BSYHTJXEHDZWEM-AWEZNQCLSA-N	429.477	1.607	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)N[C@@H]2CCO[C@@]3(CCS(=O)(=O)C3)C2)c(Cl)c1	776076572	NFBGIYDVVWBHJN-PXAZEXFGSA-N	430.914	1.720	50	20	IDGD	
CN(NC(=O)c1ccccc1N1CCOCC1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776204738	FGNNISFBXPSESB-UHFFFAOYSA-N	447.536	1.773	50	20	IDGD	
C[C@H]1[C@@H](C)N(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)CCN1C(=O)OC(C)(C)C	776316027	DZAGIVWRAPPSGW-KGLIPLIRSA-N	444.496	1.346	50	20	IDGD	
COc1cccc([C@H]2[C@@H](C(=O)NNC(=O)c3ccc4c(c3)OCO4)CC(=O)N2C2CC2)c1	776447827	OWRXKVLDIWTLBB-UWJYYQICSA-N	437.452	1.937	50	20	IDGD	
CC(=O)c1cc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c(C)nc1C	777100159	YLXHPHOCLIPZDC-UHFFFAOYSA-N	444.513	1.760	50	20	IDGD	
COCCO[C@@H]1COCC[C@@H]1NC(=O)NNC(=O)c1ccc(F)cc1Br	777274227	HVYXYQWISOGIAT-UONOGXRCSA-N	434.262	1.353	50	20	IDGD	
COCCCNC(=O)NNS(=O)(=O)c1cc(Cl)ccc1OC[C@H]1CCCCO1	777616038	BUSXCBMZUVKNRN-CQSZACIVSA-N	435.930	1.817	50	20	IDGD	
C[C@@H]1OC(C)(C)N(C(=O)OC(C)(C)C)[C@@H]1C(=O)NNC(=O)CNC(=O)OC(C)(C)C	778445933	XDUCAYCSAFAQKV-AAEUAGOBSA-N	430.502	1.419	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@@H](C(=O)NNc3cc(Cl)nc(N)n3)C2)s1	779374867	HNUGBDVQEUDUAK-SNVBAGLBSA-N	430.943	1.626	50	20	IDGD	
N#Cc1ccc(C(=O)NNS(=O)(=O)c2ccc(S(=O)(=O)C(F)(F)F)cc2)cc1	780382847	IBSSKECPYVARSN-UHFFFAOYSA-N	433.389	1.475	50	20	IDGD	
Cc1c(C(=O)N([C@@H]2CCS(=O)(=O)C2)N(C)C)nnn1Cc1ccc(C(F)(F)F)cc1	782005636	BTXVYBSCHZSSCV-OAHLLOKOSA-N	445.467	1.760	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NN=c2sc3ccccc3n2C)cc1-n1nnnc1C	783349967	RURHXGMLDVAYCS-UHFFFAOYSA-N	438.473	1.103	50	20	IDGD	
COc1ccc(C(=O)N2CCOCC2)cc1NC(=O)C(=O)NNc1ccc(F)cc1C	783447552	IILMDPQBXWRTCX-UHFFFAOYSA-N	430.436	1.697	50	20	IDGD	
O=C(COC(=O)CCN1C(=O)[C@H]2CCCC[C@H]2C1=O)NNC(=O)c1cccc(Cl)c1	784374847	HKIVEJSUOXDJBM-GASCZTMLSA-N	435.864	1.210	50	20	IDGD	
CC(C)(C)NS(=O)(=O)Cc1cccc(NC(=O)C(=O)NNc2cccc([N+](=O)[O-])c2)c1	784827766	ITNNGTBXKUBSKZ-UHFFFAOYSA-N	449.489	1.895	50	20	IDGD	
CCc1cc(Br)ccc1NNC(=O)C(=O)Nc1cc(C)n(CC(=O)NC)n1	785098999	KUPNZLOSQMSORQ-UHFFFAOYSA-N	437.298	1.344	50	20	IDGD	
O=C(NNc1nc(C(F)(F)F)cs1)C(=O)Nc1ccc(N2CCCS2(=O)=O)cc1	785143957	FPOCGPIEHODUAF-UHFFFAOYSA-N	449.436	1.784	50	20	IDGD	
O=C(COC(=O)[C@H]1CC=CC[C@@H]1C(=O)N1CCOCC1)NNC(=O)c1ccc(Cl)cc1	785721670	LAMFSVJLSKQEEV-IRXDYDNUSA-N	449.891	1.085	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)N[C@@H]1CCCN(C2CCCCC2)C1=O	785920987	CEMTYXLRWPVEGO-OAHLLOKOSA-N	433.465	1.628	50	20	IDGD	
Cc1ccc(C(=O)NCC2CC2)cc1NC(=O)C(=O)NNC(=O)Cc1ccc(F)cc1	785990497	HRRJICGVEQJNHQ-UHFFFAOYSA-N	426.448	1.603	50	20	IDGD	
Cn1cc(-c2ncccc2NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)cn1	786417556	RFQYGTYUNMBQRP-UHFFFAOYSA-N	430.371	1.240	50	20	IDGD	
O=C(NNC(=O)C1CCN(C2CC2)CC1)c1cccc(S(=O)(=O)N2CCCCC2)c1	786614648	PIEJXXHXGHLALE-UHFFFAOYSA-N	434.562	1.497	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2cccc([N+](=O)[O-])c2C)cc1C(=O)N1CCOCC1	787554753	HIHSZCUQHCYAFB-UHFFFAOYSA-N	441.444	1.766	50	20	IDGD	
O=C(NC[C@@H](O)c1cc(F)cc(Cl)c1)NNC(=O)c1csc(N2CCOCC2)n1	787737780	YEBLIKSPYDKBKV-CQSZACIVSA-N	443.888	1.450	50	20	IDGD	
O=C(COc1ccc(I)cc1)NNc1ccc(-n2ccnc2)nn1	788179533	XGFSPFULVKRXLP-UHFFFAOYSA-N	436.213	1.789	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NN=C3CCC[C@@H](N(C)C)C3)CC2)cc1	788434852	KKJRUSVIJHDXOD-LJQANCHMSA-N	435.594	1.278	50	20	IDGD	
CCN(C)C(=O)[C@H](C)NC(=O)NNC(=O)COc1ccc(OCc2ccccc2)cc1	788886016	JIGMHZXJPFNZEF-INIZCTEOSA-N	428.489	1.842	50	20	IDGD	
Cc1cc(-n2cccn2)ccc1NC(=O)C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C	789584855	RTUXFUIOVXAMHJ-UHFFFAOYSA-N	444.492	1.572	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2nc(C3CCC3)cs2)c2ccccc2c1=O	789732064	LGLTXIZSYRVBAE-UHFFFAOYSA-N	440.485	1.540	50	20	IDGD	
C#CCOc1ccc(F)cc1NC(=O)C(=O)NNC(=O)[C@H]1OCC[C@H]1c1ccccc1	789810490	OUTSWAPAGXQKHS-LPHOPBHVSA-N	425.416	1.496	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNc2cccc(F)c2[N+](=O)[O-])cc1	790997990	YZTDEBKTLJXZMF-UHFFFAOYSA-N	425.398	1.577	50	20	IDGD	
CC(=O)NC[C@H]1CCn2ncc(C(=O)NNC(=O)c3cc4c(s3)CC[C@@H](C)C4)c2C1	792736192	LMOWEIGKQCMIAM-OCCSQVGLSA-N	429.546	1.843	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)nnn1Cc1ccncc1	794774943	KDPMJAPALABLGN-UHFFFAOYSA-N	446.471	1.395	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2cccc(F)c2I)n1	797370912	WGVQWQNHJDGAKC-UHFFFAOYSA-N	442.188	1.533	50	20	IDGD	
CCC1CCC2(CC1)NC(=O)N(CC(=O)NNC(=O)C(=O)Nc1ccc(C)c(C)c1)C2=O	798307939	JIUXLVNWXSTOPG-UHFFFAOYSA-N	443.504	1.280	50	20	IDGD	
CCN1CCN(c2ccc(C(=O)NNC(=O)C(=O)Nc3ccc(C)c(C)c3)cc2F)CC1	798308007	MIRNAYFUTLMDPX-UHFFFAOYSA-N	441.507	1.984	50	20	IDGD	
COc1ccc(C2=NO[C@@H](CNC(=O)NNC(=O)C(=O)Nc3ccc(C)c(C)c3)C2)cc1	802368245	WLLFYSODNVFBGH-GOSISDBHSA-N	439.472	1.774	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCCC(=O)OC2CCCCC2)c2ccccc2c1=O	802451046	KUTLSWMHYAXWTB-UHFFFAOYSA-N	429.477	1.626	50	20	IDGD	
COc1cccc(C2(C(=O)NNc3ccc(S(=O)(=O)N4CCN(C)CC4)cc3)CC2)c1	802828313	ZLDBOLHHZSSORU-UHFFFAOYSA-N	444.557	1.806	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)[C@@H]1CCCN(C(=O)c2ccc3n[nH]cc3c2)C1	804958914	RVYUEELCVCFZJX-OAHLLOKOSA-N	431.460	1.534	50	20	IDGD	
COc1ccc(CS(C)(=O)=O)cc1NC(=O)NNC(=O)COc1ccccc1C#N	806633962	AZUBLHKUEYIIDY-UHFFFAOYSA-N	432.458	1.343	50	20	IDGD	
Cc1cccn(Cc2c(F)cccc2NC(=O)C(=O)NNC(=O)Cc2cccnc2)c1=O	806978486	DCNNCVMOGYZXHL-UHFFFAOYSA-N	437.431	1.068	50	20	IDGD	
O=C1COC[C@H](C[C@H]2CN(C(=O)C(=O)NNc3ccc4ccccc4n3)c3ccccc32)N1	806984704	QGTRJHVQTWNDRP-IRXDYDNUSA-N	445.479	1.713	50	20	IDGD	
C[C@@]1(C2CC2)NC(=O)N(c2cccc(CNC(=O)NNC(=O)CC(F)(F)F)c2)C1=O	807236325	ILMWCNCWHSDBKQ-KRWDZBQOSA-N	427.383	1.694	50	20	IDGD	
CN1CCC[C@H](N(C)C(=O)c2ccc(NC(=O)C(=O)NNc3cccc(F)n3)cc2)C1	807391349	NXIFBZIRZHUAAS-INIZCTEOSA-N	428.468	1.469	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNc2cccc(S(C)(=O)=O)c2)cc2[nH]ccc12	808933927	WSJXFJUDVHGQLC-UHFFFAOYSA-N	430.442	1.440	50	20	IDGD	
CC(=O)c1cccc(S(=O)(=O)NCC(=O)NNc2ccc(Cl)cc2[N+](=O)[O-])c1	810154677	ZHRSYJHTKVDYSX-UHFFFAOYSA-N	426.838	1.872	50	20	IDGD	
COC[C@]1(C(=O)NNc2ccccc2S(C)(=O)=O)CCN(C(=O)OC(C)(C)C)C1	810385557	UDZRFDXMEUKKPC-IBGZPJMESA-N	427.523	1.807	50	20	IDGD	
N#Cc1cccc(S(=O)(=O)NCC(=O)NNC(=O)c2cccc(Br)c2)c1	810449191	IBPFZSVWQRBAPN-UHFFFAOYSA-N	437.275	1.060	50	20	IDGD	
NS(=O)(=O)c1ccc2c(c1)C(=NNC(=O)C(=O)NCc1ccc(Cl)cc1)CCC2	811646493	BCANTQYPOLCMER-UHFFFAOYSA-N	434.905	1.460	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)Nc2cccc(CN3C(=O)CNC3=O)c2)cc1	812313710	MTUSQHQKGXUWDA-UHFFFAOYSA-N	446.489	1.137	50	20	IDGD	
N#Cc1ccc(NNC(=O)C(=O)Nc2cccc(CN3CCNC(=O)C3)c2)cc1Cl	812987906	QOQDABMUOMSXAU-UHFFFAOYSA-N	426.864	1.225	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)[C@H]1OCCc2sccc21	813866258	NFXPUWPHKWETKX-APPDUMDISA-N	427.486	1.642	50	20	IDGD	
CC(C)COC(=O)N1CCC(=NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)CC1	814746819	NOFQHWDEURICLQ-UHFFFAOYSA-N	430.914	1.962	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2ccc3c(c2)NC(=O)CNC3=O)cc1Br	815564551	MBKYSIQPDSJSET-UHFFFAOYSA-N	447.245	1.214	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)Nc1ccc([C@H]2CCOC2)cc1	815567809	MTIANJJJXKUBSP-LBPRGKRZSA-N	435.278	1.691	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1cn(Cc2ccccc2)nn1	815571279	ZPMATZFDNWWVLG-UHFFFAOYSA-N	440.485	1.213	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)C1=NN(c2ccccc2)C(=O)CC1	856534572	UYPUGBHVDVFZEG-UHFFFAOYSA-N	448.527	1.529	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)N2CCC(C(=O)NNc3ncccn3)CC2)cc1	913044196	YTSVUEGHUPTBIB-UHFFFAOYSA-N	433.490	1.197	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)NCc1cccc(S(=O)(=O)NC(C)C)c1	913625732	DMQWAPKDAKVAFR-UHFFFAOYSA-N	444.517	1.474	50	20	IDGD	
Cc1c(NC(=O)CSCC(=O)NNC(=O)C2CCCC2)c(=O)n(-c2ccccc2)n1C	914842901	VRNIAFUNASFQRV-UHFFFAOYSA-N	445.545	1.494	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)NCc2ccccc2S(=O)(=O)N(C)C)c1	916237592	DHJSFVCIISHYHT-UHFFFAOYSA-N	436.490	1.098	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)NC2CCN(S(=O)(=O)CC)CC2)cc1OC	916260055	OLENWMMWARIGFZ-UHFFFAOYSA-N	442.538	1.242	50	20	IDGD	
CC(C)(C)OC(=O)NNC(=O)NCc1ccc(S(=O)(=O)NC[C@H]2CCCO2)cc1	916649922	XFGPSUZNUAFWDY-CQSZACIVSA-N	428.511	1.383	50	20	IDGD	
O=C(CCCn1cncn1)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	917392953	ZXBQZQVXRCPZOA-UHFFFAOYSA-N	431.460	1.221	50	20	IDGD	
CC(=O)N1CCc2cc(Br)c(S(=O)(=O)NNC(=O)c3ccccc3)cc21	917716033	HMRGFUTUHFUFRJ-UHFFFAOYSA-N	438.303	1.981	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)c2ccc(F)cc2Br)cc1C(N)=O	917753953	USJFBIUYNCXCRP-UHFFFAOYSA-N	446.254	1.319	50	20	IDGD	
O=C(COc1ccccc1CNC(=O)NNc1ccc(Cl)nn1)NC[C@H]1CCCO1	918218575	XLBLEXQSXYMSAT-CQSZACIVSA-N	434.884	1.630	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2ccn(-c3ccccc3)n2)c1	919658831	NHGZWPQIWYITKD-UHFFFAOYSA-N	442.501	1.267	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)NCc1cccc(CN2CCO[C@H](C)C2)c1	920236603	DJCZGIOHISSRRS-QGZVFWFLSA-N	442.516	1.825	50	20	IDGD	
O=C(NCCc1cccs1)NNS(=O)(=O)c1ccc(Br)c(C(=O)O)c1	920832824	CWDDEAHBYWRUTQ-UHFFFAOYSA-N	448.320	1.944	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)COc1ccccc1[N+](=O)[O-])c1ccc(N2CCOCC2)cc1	920921568	MIAQWRWZEJQCES-OAHLLOKOSA-N	443.460	1.902	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NC[C@@H](c2cccc(F)c2)N2CCOCC2)cc1	921247257	CIUAVCFVVICAIA-FQEVSTJZSA-N	446.479	1.617	50	20	IDGD	
CC(C)c1ccc(-n2c(NNC(=O)CN3C(=O)CNC3=O)nc3ccccc3c2=O)cc1	1321800229	BZVPDVBIQHHOFV-UHFFFAOYSA-N	434.456	1.504	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(CCN(C(=O)c3ccc4nccnc4c3)C2)C1	1777973879	HHJAOCXQGYEZHO-LJQANCHMSA-N	433.306	1.858	50	20	IDGD	
O=C([C@H](F)Cl)N1CCO[C@@]2(CCN(C(=O)[C@H]3CN(Cc4ccccc4)CCO3)C2)C1	1778277404	YVUYNUZBMVHCGO-LVCYWYKZSA-N	439.915	1.252	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](C)N3C[C@@H]4C[C@H]4C3)C2)C1	1778867007	YNVIIWQAGINHPQ-GMHRPJKWSA-N	428.371	1.330	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](OC(C)=O)C(C)C)C1	1779207363	FENVYVHNSPVAGZ-PFRQMTDMSA-N	432.945	1.342	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cccc(-n3cncn3)c1)CCO2	1779299071	OQRRMAJUZGVVQU-NRFANRHFSA-N	443.580	1.562	50	20	IDGD	
C=C[C@H](O)C(C)(C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)Br)C2	1779339212	GVCCFMMTZOISQX-XTDOFWJNSA-N	431.371	1.857	50	20	IDGD	
CCOC(=O)C(C)(C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CO[Si](C)(C)C)C1	1779546482	MKNYWXATKFWHQA-IIBYNOLFSA-N	442.629	1.941	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](CCN)NC(=O)OC(C)(C)C)CCO2	1781213927	VYQLQRGZCACNCR-MDOVXXIYSA-N	446.976	1.076	50	20	IDGD	
O=C(c1ccc2n[nH]cc2c1)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781331063	KIMLFWCIPUVZBZ-RHSMWYFYSA-N	425.258	1.697	50	20	IDGD	
C[C@H](C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Br)C2)n1cccn1	1782557914	MYDMHMPWWCCYJQ-VMUDFCTBSA-N	431.306	1.649	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2)c1cc(F)cc(F)c1F	1782973961	JSLFDGNUQJKQRT-SPYBWZPUSA-N	434.842	1.831	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cnn(-c4cccnc4)c3)CCO2)C1	1783533289	YWXLHYWTRDFKNO-AUUYWEPGSA-N	448.321	1.494	50	20	IDGD	
COc1ccc([C@@H](C)C(=O)N2CCO[C@@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc1	1783933007	OGJCRXHZQQYMOM-UZUQRXQVSA-N	446.548	1.002	50	20	IDGD	
CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783950398	WHFROXRCXOVOPD-GOSISDBHSA-N	445.303	1.908	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CCCCN3C)C[C@@H]21	1783964503	WNXPBVDLJVTEBE-HMDCTGQHSA-N	430.387	1.481	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](C)Oc3ccccn3)C2)C1	1784490825	DOGYUUQUSDVWFY-IYOUNJFTSA-N	426.311	1.462	50	20	IDGD	
CCOC(=O)N1CCC(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]3C2)CC1	1787451411	OHJBLQPJFADGBK-VGWMRTNUSA-N	433.908	1.369	50	20	IDGD	
C[C@H](Sc1cccs1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21	1788483446	ZISZPXPIYIMUMH-YTFOTSKYSA-N	432.995	1.808	50	20	IDGD	
C[C@H](C(=O)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1)N1C[C@H]2C[C@H]2C1	1789440680	GCUJJSBAQFKLNE-QRQLOZEOSA-N	447.344	1.454	50	20	IDGD	
Cc1cc(C)n(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]3C2)n1	1789869019	WACMQMGJHIMKMI-FPXQBCRKSA-N	431.364	1.716	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc4nccn34)[C@H]2C1	1790413182	UKRZOOKKBLINCF-BQFCYCMXSA-N	430.581	1.779	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3C[C@H]3c3ccccc3)[C@H]2C1	1791211075	VAMBNHVLSJRNFF-SXYSDOLCSA-N	442.560	1.143	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)COc3cc(Cl)ccn3)C[C@@H]21	1791255701	YPXHUILCACBTDA-TUUVXOQKSA-N	446.331	1.347	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3C[C@@]3(F)Cl)[C@H]2C1	1791367675	RLWGVWVJVSHMRE-RQXQIDNZSA-N	425.726	1.922	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3ccc(O)cn3)[C@H]2C1	1791706748	RTBOVUBVPBFRGE-OQUILHJVSA-N	440.338	1.340	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(C(=O)N(C)C)c1)C2	1793455649	PLUHJDQWIGNJMA-FCGDIQPGSA-N	435.952	1.999	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccs1	1794621170	NRCUMPUFNMBWCS-MGRLTOJPSA-N	429.502	1.085	50	20	IDGD	
Cc1nn[nH]c1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)C2	1795980641	AJUZYJZVQYADBO-BJUDCHGJSA-N	442.426	1.202	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1noc2c1CCCC2	1796155248	KIUOCUAFWCLFNY-LMWOUKEDSA-N	440.338	1.930	50	20	IDGD	
Cc1ccc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Br)nc1	1799344916	XUMLMNVYRKYHRP-RMHZUWNSSA-N	428.302	1.603	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1CN(C(=O)OC(C)(C)C)C[C@H]1O	1799985083	GIDQUJNKCOVZCL-FHULIHMCSA-N	443.972	1.870	50	20	IDGD	
O=C1CCc2ccc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)[C@@H](F)Br)nc2N1	1800158874	DRVWYUAQCVMKHA-NWJSVONSSA-N	439.285	1.909	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Nc1nccs1)C2	1800639494	GCZMXFHVVRQLMB-RKQHYHRCSA-N	445.383	1.707	50	20	IDGD	
COC(=O)C12CC(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@](C)(Cl)CCl)C4)(C1)C2	1800704738	VYZAMPWGNOLVAD-APCPSTPWSA-N	433.332	1.156	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(F)c1[N+](=O)[O-])C2	1800977082	IBPUFGGSMLVIRD-WJNVRWDZSA-N	429.832	1.191	50	20	IDGD	
C[C@@H](CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCC(=O)NN(C)C)C2)Oc1ccccc1	1801453383	FNZBVXNRUXGDHS-OKYOBFRVSA-N	430.549	1.855	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCc1c[nH]c3ncccc13)C2	1802344345	XFULFBLCBNBFKU-BCDXTJNWSA-N	440.548	1.507	50	20	IDGD	
CCS(=O)(=O)CC(=O)N1CC[C@H](CNC(=O)C(C)(C)CCl)[C@@H]1c1cccnc1	1802896612	DFTAVXOKEIILKS-WBVHZDCISA-N	429.970	1.787	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)Cc2cccc([N+](=O)[O-])c2)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803137859	UGZQICCCTUTDPP-XKGZKEIXSA-N	446.891	1.838	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCCC2(CCN(C(=O)CN3CCN(C(C)=O)CC3)CC2)C1	1806159321	BBGNDPRIVGFCQS-IBGZPJMESA-N	441.016	1.789	50	20	IDGD	
Cc1c(C(=O)N2CC[C@H](CNC(=O)[C@@H](F)Cl)[C@@H]2c2cccnc2)cn2[nH]cnc(=O)c12	1808315448	NNJDWOLIWMALSE-XOKHGSTOSA-N	446.870	1.580	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H](CNC(=O)c2nc[nH]c2[N+](=O)[O-])[C@H]1c1cccnc1	1808370853	FFUPKFLMIMMYRE-RHSMWYFYSA-N	446.540	1.884	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC2(CCCN(C(=O)C[C@@H](NC)C(=O)O)C2)CC1	1809839108	MNTUVQUXUKBRLB-UONOGXRCSA-N	432.359	1.454	50	20	IDGD	
Cc1ncoc1C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1	1810299919	VMWCWOHHEZHZNS-MAUKXSAKSA-N	449.471	1.010	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)[C@H]1C[C@@]1(F)Cl	1813153173	OWJKHTQGQVTUMF-VZRKHXGSSA-N	445.687	1.006	50	20	IDGD	
COC(=O)NCC(=O)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@H]1c1cccnc1	1813266891	MWMGZDSQRCOGGD-UBHSHLNASA-N	431.262	1.134	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](O)CCl)n[nH]1	1814877754	KHDHNQCIJGKYIN-XRGAULLZSA-N	438.912	1.757	50	20	IDGD	
CCS(=O)(=O)N[C@@H](C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)C(C)(C)CCl)[nH]n1	1815165000	OLGYAXMZCQOPEW-JSGCOSHPSA-N	447.989	1.995	50	20	IDGD	
Cc1cccc(C)c1C(=O)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1	1815360518	RXSVZZSHCAJZCI-KRWDZBQOSA-N	449.341	1.979	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CNC(=O)c2cccnc2)n[nH]1	1815785893	CUIWVRYTGYARRZ-HOCLYGCPSA-N	448.911	1.481	50	20	IDGD	
CCn1nc(C)cc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCC(=O)NN(C)C)CC2	1816717229	DJSZLAUXTFEQGV-CYBMUJFWSA-N	447.565	1.267	50	20	IDGD	
COc1ccnc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)c1	1817472699	ZYNGGZICEDNMTI-LJQANCHMSA-N	449.276	1.113	50	20	IDGD	
CC(C)CNC(=O)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](F)Br)[nH]n1	1818134700	KNBGAEKTVQIPSU-WCQYABFASA-N	432.294	1.865	50	20	IDGD	
COC[C@H](NC(C)=O)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CO[Si](C)(C)C)[nH]n1	1819611085	VAPLWPAWTTWNDU-JKSUJKDBSA-N	439.589	1.404	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1)c1cccn(C(F)F)c1=O	1819636790	SNPZNFJQJZVOHJ-OLZOCXBDSA-N	443.838	1.872	50	20	IDGD	
CC(=O)N(C)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](F)Br)n[nH]1	1820930891	KEEOMEDDTSOVAW-DOMZBBRYSA-N	432.294	1.961	50	20	IDGD	
COc1ccc2[nH]cc(C(=O)Nc3nc4c(s3)C[C@@H](NC(=O)[C@@H](O)CCl)CC4)c2n1	1821244454	VMPCNXFYUJBDDK-ZANVPECISA-N	449.920	1.854	50	20	IDGD	
O=C(COc1cccnn1)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](F)Br)[nH]n1	1822754991	XYMJRZSKZJGTHB-NHYWBVRUSA-N	441.261	1.961	50	20	IDGD	
Cc1nc(CC(=O)N[C@H]2CCc3nc(NC(=O)[C@@H](F)Br)sc3C2)no1	1823001326	CRXOOGAHBSIFLO-JVXZTZIISA-N	432.275	1.680	50	20	IDGD	
Cc1ncc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)[nH]1	1824704422	DJHUDLFYPXPHAQ-LJQANCHMSA-N	439.520	1.264	50	20	IDGD	
C=CC[C@@H](C)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnccc1C(=O)NN)CC2	1825125948	AWWSGQXEZWJOIL-NEPJUHHUSA-N	428.518	1.580	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](O)Cc3ccccc3)sc2C1	1825440409	ZJGHYKWASNBBTO-IJEWVQPXSA-N	437.949	1.913	50	20	IDGD	
C[C@@H](C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2)n1cccc1	1826589199	ZLSNBSIKXVCVJH-XJKSGUPXSA-N	438.318	1.111	50	20	IDGD	
Cc1cncc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)c1	1827051424	YTDOGYXNRPGJKO-JOCHJYFZSA-N	435.333	1.617	50	20	IDGD	
O=C(c1ccccc1O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827055643	AZCMYFGWBNOBTL-NRFANRHFSA-N	436.317	1.619	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)cn1C	1827865817	VQYRZAXLRHYVNN-JOCHJYFZSA-N	437.349	1.560	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H]2CC2(F)F)CC1	1828924427	SEMVMHOTQFMDCX-IAGOWNOFSA-N	435.475	1.574	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)C23CC(C2)C3)CC1	1828925884	SLDDFWJBAXGJDC-HVWVKJRRSA-N	425.533	1.719	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)C3CC(F)(F)C3)CCO2)C1	1829983508	QZFYUMZOPIXXAC-BLLLJJGKSA-N	439.297	1.519	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)NC(=O)OC(C)(C)C)CCO2	1830303709	KTLXNOSLLYSMKC-AUSJPIAWSA-N	447.960	1.373	50	20	IDGD	
CCc1noc(C)c1C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830364707	QZLOMJGSANQBFO-FQEVSTJZSA-N	427.929	1.880	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3[C@H]4C=CS[C@H]43)C2)C1	1830544199	QHZYFYSGOGJODQ-VFCJXBEMSA-N	445.379	1.349	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H]2CCCS2(=O)=O)CC1	1831286315	VYQYSAZMKXFKEG-IMJJTQAJSA-N	449.411	1.967	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCC(=O)N3CCCC3)C2)C1	1831639762	DRRQBLSMAHIOED-LAUBAEHRSA-N	443.972	1.253	50	20	IDGD	
C[C@H](C(=O)NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1)n1ccnc1	1833375241	BAQXTVBAYYARIF-OAHLLOKOSA-N	440.386	1.801	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](O)NC(=O)OCC)CC2)CC1	1833533753	ORXBZENTNQNUHC-FUHWJXTLSA-N	446.976	1.030	50	20	IDGD	
Cc1ncccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1	1834039663	JQFAVPFRKAIBNK-MOPGFXCFSA-N	430.332	1.696	50	20	IDGD	
Cc1ccccc1C(=O)N1CCOC[C@@]2(CN(C(=O)CCBr)CCO2)C1	1834824157	UENWQFDSBBMBJI-LJQANCHMSA-N	425.323	1.850	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cn4ccccc4n3)CC2)CC1	1835300828	HUAQDELCFCZPSV-SFHVURJKSA-N	447.967	1.773	50	20	IDGD	
C=CC(=O)N[C@@H](C)C(=O)NC1CCN(C2CCN(C(=O)[C@@](C)(Cl)CCl)CC2)CC1	1835833109	VJGYVYXSTXHACF-XOBRGWDASA-N	447.407	1.485	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](N)Cc3cccnc3)CC2)CC1	1836393922	BTSWKRGDYQIAHD-UXHICEINSA-N	436.000	1.540	50	20	IDGD	
COc1ccc(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)c(F)c1	1836692858	CGRMSWNAMAUUOU-ICSRJNTNSA-N	446.878	1.758	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccncc3O)CCO2)C1	1837819528	ORUGXKBOPNPKJF-MSOLQXFVSA-N	432.304	1.094	50	20	IDGD	
CCC(C)(C)C(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1	1837921349	BXUBKWNTKCLOFJ-UHFFFAOYSA-N	430.354	1.415	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@H]3CCCS3(=O)=O)CC2)CC1	1838637381	NUIMBCMRAQRFDT-DLBZAZTESA-N	434.986	1.580	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)cc1N(C)C	1839115993	QMVBMHKAXLBKEM-FXAWDEMLSA-N	443.903	1.366	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccc(F)cc3OC)C2)C1	1839149320	BQAWIHJVEFIKMP-LAUBAEHRSA-N	442.915	1.851	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)COc3ccccc3C#N)C2)C1	1839149577	LVZFTJGSEQKWLT-DYESRHJHSA-N	435.908	1.411	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3cncnc3)C2)C1	1839151809	DUDLUXHWPOIYIB-OALUTQOASA-N	445.347	1.102	50	20	IDGD	
Cc1cc(/C=C/C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)no1	1839154026	ZEAYFZISGBEDHW-CZHQAMEJSA-N	446.331	1.689	50	20	IDGD	
Cc1cc(/C=C/C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)no1	1839154029	ZEAYFZISGBEDHW-YQHFQFMOSA-N	446.331	1.689	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)s1	1839198181	WNHKXXWGNQJJKJ-CJNGLKHVSA-N	435.315	1.817	50	20	IDGD	
Cc1cc(C#N)cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)c1	1840189979	WDQZEGFKWXEPLJ-IBGZPJMESA-N	426.300	1.740	50	20	IDGD	
CC(C)[C@@H](S)C(=O)N1CCCC12CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2	1841626832	FFAFEJOHAQYKGX-LJQANCHMSA-N	447.605	1.490	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)c2cn(C)nc2C)C1	1841718549	BQLJIYRHIHKMKD-UHFFFAOYSA-N	441.444	1.693	50	20	IDGD	
C=CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)[C@@H](Cl)COC)C2	1841748446	XEOHEAKRLHTRGQ-GJZGRUSLSA-N	429.945	1.913	50	20	IDGD	
CCOC(=O)c1ncn2c1CC[C@@H](C(=O)N1CCCC13CN(C(=O)[C@@H](Cl)CC)C3)C2	1845863350	VGKWGVMYEJPCKJ-CABCVRRESA-N	436.940	1.843	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)c2c(F)ccc(Cl)c2F)C1	1846867163	XCGYQHYCLFPWTR-UHFFFAOYSA-N	434.635	1.429	50	20	IDGD	
CCOC(=O)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)[C@@H](Cl)CC)C2	1847044952	YYFXLSSAUXGALW-UONOGXRCSA-N	445.944	1.664	50	20	IDGD	
COC(=O)c1ccc(OCC(=O)N2CCCC23CN(C(=O)[C@H](C)Br)C3)cc1	1847149907	MXKUERFORVJDOO-ZDUSSCGKSA-N	439.306	1.839	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(C(=O)NNC(=S)NCCc2cccs2)cc1	11523811	LRRQFRSEXDRRSL-UHFFFAOYSA-N	442.588	1.024	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)COc2ccc(N3CCCC3=O)cc2)c2ccccc2c1=O	15721020	ACFGNJFMRDFISL-UHFFFAOYSA-N	449.467	1.383	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	20901182	OGZIFQIDDNAYCY-UHFFFAOYSA-N	440.522	1.147	50	20	IDGD	
CCC1CCC2(CC1)NC(=O)N(CC(=O)NNC(=O)Cc1c[nH]c3ccccc13)C2=O	105281976	UPHNQFLZROVKEX-UHFFFAOYSA-N	425.489	1.749	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc2c(c1)C(=O)NC2=O)c1ccc(COc2ccccc2)o1	111135415	GHOWKQJTCVNMSC-UHFFFAOYSA-N	441.421	1.366	50	20	IDGD	
COCCCNC(=S)N(C)NC(=O)c1ccc(S(=O)(=O)N2CCCC[C@H]2C)cc1	726077319	WDCNODIHVLWHKH-OAHLLOKOSA-N	442.607	1.737	50	20	IDGD	
CNS(=O)(=O)c1cccc([C@H](C)NC(=O)NNC(=O)CCc2ccc(OC)cc2)c1	727609313	JJAAMOQYGDQIJS-AWEZNQCLSA-N	434.518	1.628	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)Cc3ccccc3[N+](=O)[O-])cc2)CC1	728213337	JVKCNULHHNICGF-UHFFFAOYSA-N	433.490	1.217	50	20	IDGD	
COc1ccc2cc(C(=O)NNc3ccc(S(=O)(=O)N4CCN(C)CC4)cc3)[nH]c2c1	728214106	LNZLQKYHCFVYPL-UHFFFAOYSA-N	443.529	1.870	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3ccc(C(F)(F)F)cn3)cc2)CC1	728214521	QRAPXHLLQRFXCY-UHFFFAOYSA-N	443.451	1.793	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)C3=NO[C@@H](c4ccccc4)C3)cc2)CC1	728216251	VWCMJYYYKSHBBO-HXUWFJFHSA-N	443.529	1.583	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)CNC(=O)c2ccc(C#N)cc2)c1	728609167	QKLWJQROGMALRI-UHFFFAOYSA-N	431.246	1.520	50	20	IDGD	
O=C(CNC(=O)c1cccc([N+](=O)[O-])c1)NNC(=O)c1cc(F)ccc1Br	728611252	XWCOQEOOIWCBQQ-UHFFFAOYSA-N	439.197	1.687	50	20	IDGD	
COCCCn1c(S)nc2cc(C(=O)NNC(=O)c3cccc(C#N)c3)ccc2c1=O	728873537	ZHJHARMUGRFBNS-UHFFFAOYSA-N	437.481	1.668	50	20	IDGD	
COc1ccc([C@H](CNC(=O)NNC(=O)Cc2cccnc2)N2CCOCC2)cc1OC	728944498	ZXLVMFSFMFAZKS-SFHVURJKSA-N	443.504	1.045	50	20	IDGD	
COc1ccc(OC)c(CCNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1	728961782	PFVQXWHYGHNLEK-UHFFFAOYSA-N	428.493	1.283	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCCn2c(=O)oc3ccccc32)nc1	730128818	FJVSMRYFDVHOBO-UHFFFAOYSA-N	448.505	1.346	50	20	IDGD	
O=C(NNS(=O)(=O)c1cccc(S(=O)(=O)NC2CC2)c1)c1cccc2ncccc12	730203803	KQNNDHOXYRFXKB-UHFFFAOYSA-N	446.510	1.299	50	20	IDGD	
CCNC(=O)NNC(=O)[C@H](Cc1cn(Cc2ccccc2)cn1)NC(=O)OC(C)(C)C	730532065	IBNCVWRJBNWHJD-KRWDZBQOSA-N	430.509	1.718	50	20	IDGD	
O=C(NNC(=O)[C@@H](O)c1cccnc1)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	731866150	RBVMIXUJBIPPIJ-IBGZPJMESA-N	429.440	1.278	50	20	IDGD	
COC(=O)N1CCC[C@@H](NC(=O)NNC(=O)c2ccc(OC)c(Br)c2)C1	732245402	UHAPBCLCSYPIGF-LLVKDONJSA-N	429.271	1.633	50	20	IDGD	
NS(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)NCc2cccc(C(F)(F)F)c2)c1	733369481	POPXKAVTMCEASH-UHFFFAOYSA-N	434.371	1.636	50	20	IDGD	
NS(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)c2cc(F)ccc2Br)c1	733370476	CMWPMNGYVLIAHC-UHFFFAOYSA-N	434.218	1.450	50	20	IDGD	
Cc1cc(NNC(=O)C2CCN(S(=O)(=O)c3ccc4c(c3)OCCCO4)CC2)ncn1	734253535	FNQKAGSXIMSEHT-UHFFFAOYSA-N	447.517	1.490	50	20	IDGD	
CC(=NNC(=O)c1cnn(C)c1)c1ccc(S(=O)(=O)N2CCC(C(=O)O)CC2)cc1	735411111	LXNUHOUCXLVVER-UHFFFAOYSA-N	433.490	1.059	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)CCNC(=O)N1CCc2ccccc2C1	735647133	HSRFUQRGUIKQLW-UHFFFAOYSA-N	448.527	1.904	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNS(=O)(=O)c1ccc(C#N)cc1[N+](=O)[O-]	741203145	CVWGLGUJSLTTFI-UHFFFAOYSA-N	428.224	1.191	50	20	IDGD	
Cc1cc(N2CCCS2(=O)=O)ccc1C(=O)NNC(=O)c1nnc(O)c2ccccc12	741659858	GCZQXOZWRQTMNV-UHFFFAOYSA-N	441.469	1.259	50	20	IDGD	
C[C@H](CC(=O)NNC(=O)C12CC3CC(CC(C3)C1)C2)/N=C1/NS(=O)(=O)c2ccccc21	742471661	IICHIBVCZYBXKS-ZHHULCEESA-N	444.557	1.868	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2ccc(Br)cc2Cl)c[nH]1	743257715	OUXBFEYILNUEOX-UHFFFAOYSA-N	436.671	1.841	50	20	IDGD	
C[C@@H]1CCN(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)CCN1Cc1ccccc1	743512556	WJPFTBPAVBEXQP-QGZVFWFLSA-N	434.504	1.613	50	20	IDGD	
CC(C)NC(=O)C(=O)NNC(=O)/C(=C\c1cccs1)n1nnnc1-c1ccccc1	744447056	UJZAGHXOKVOLPD-RVDMUPIBSA-N	425.474	1.072	50	20	IDGD	
O=C(/C=C/c1ccc([N+](=O)[O-])cc1)NNc1ccccc1S(=O)(=O)N1CCOCC1	744620177	GPESILSKJYMDAN-JXMROGBWSA-N	432.458	1.772	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)[C@@H]2CCCN2C(=O)Cc2ccccc2)c1	744862409	NNFNGKWLYNJAIC-IBGZPJMESA-N	434.452	1.096	50	20	IDGD	
C[C@@H](CC(=O)OCC(=O)NNC(=O)c1ccc(C#N)cc1)S(=O)(=O)c1ccc(F)cc1	744959662	YVTHRZALMDWCPY-ZDUSSCGKSA-N	447.444	1.254	50	20	IDGD	
O=C(COC(=O)[C@@H]1CCCN(c2ncnc3sccc23)C1)NNC(=O)c1ccccc1	745533557	ISBQAPNTRVTZGC-OAHLLOKOSA-N	439.497	1.912	50	20	IDGD	
Cc1nn(CCCl)c(C)c1C(=O)N1CCN(Cc2nnnn2-c2ccccc2)CC1	746210630	RAAQQSZCKBQCIE-UHFFFAOYSA-N	428.928	1.672	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)NCCNS(=O)(=O)c2cccs2)c2ccccc2n1	747437482	JLXRDIJSTVRPBV-UHFFFAOYSA-N	433.515	1.527	50	20	IDGD	
O=C(CNC(=O)c1cc(-c2ccccc2)on1)NNC(=O)c1nnc(O)c2ccccc12	749715076	JGSBRXRIWLJDGP-UHFFFAOYSA-N	432.396	1.181	50	20	IDGD	
C/C(=C/C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1)c1ccc([N+](=O)[O-])cc1	752351753	RGMSDWRPZWDTCH-GFBZKKKVSA-N	441.396	1.529	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)N2CCC(O)(CN3CCOCC3)CC2)c1C	752740049	YTDCIBLMNJWOAF-RCCKNPSSSA-N	430.549	1.344	50	20	IDGD	
Cc1ccccc1-n1nccc1[C@H]1OCC[C@@H]1C(=O)NNC(=O)C(=O)Nc1ccccn1	753179171	QBTJKROVWPBAMX-KXBFYZLASA-N	434.456	1.439	50	20	IDGD	
COc1ccc(-c2noc(CN3CCN(C(=O)NNC(=O)C4CCCC4)CC3)n2)cc1	753345557	QDZUSXHDCFHXTI-UHFFFAOYSA-N	428.493	1.794	50	20	IDGD	
CC(C)c1c(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cnn1-c1ccccc1	753838786	BLUAEKHKVKMBOQ-IBGZPJMESA-N	449.467	1.922	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)C(=O)Nc2cc(C(=O)OC)cc([N+](=O)[O-])c2C)c1	753839316	JYCVXEULCISGGT-UHFFFAOYSA-N	430.373	1.558	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCN(c3ccccc3Cl)CC2)cc1OC	754636284	MCQCLZLHZKUNSQ-UHFFFAOYSA-N	432.908	1.940	50	20	IDGD	
Cc1cc(I)ccc1NC(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1	755352980	CSFDLRCIMHMZGS-VIFPVBQESA-N	437.259	1.187	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3cc(F)c(F)c(O)c3F)cc2)CC1	755573027	NGGSMMIDVLIEKC-UHFFFAOYSA-N	444.435	1.503	50	20	IDGD	
CN(C)C(=O)Cn1ccc(NC(=O)NNC(=O)c2ccc(COc3ccccc3)o2)n1	756310713	GYWAZGZLUTZZOW-UHFFFAOYSA-N	426.433	1.610	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1	756610560	PIYPEBZIDITWAN-NSHDSACASA-N	437.434	1.478	50	20	IDGD	
CC(C)CSCCNC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	756751735	AENNTSUZOLFCET-UHFFFAOYSA-N	430.600	1.033	50	20	IDGD	
CC(C)CN1CC[C@@H](CNC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)C1	757292771	VZLOUASPLBJMMR-FQEVSTJZSA-N	430.597	1.507	50	20	IDGD	
COc1ccc(C(=O)CC(C)(C)CC(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)cc1	759368576	IPOLEYUXPSBUFS-CQSZACIVSA-N	425.507	1.202	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN2CCC(n3cc(C(=O)OC)nn3)CC2)cc1C	759888663	FTDPHXNVJKHNRY-UHFFFAOYSA-N	434.522	1.095	50	20	IDGD	
Cc1cc(C)nc(-n2nccc2NC(=O)C(=O)NNC(=O)c2cccc(C(F)(F)F)c2)n1	760276319	CXFAJGJWPSCPQY-UHFFFAOYSA-N	447.377	1.698	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)C(=O)Nc1ccnn1Cc1ccc(F)cc1	760312083	CYVIYKGVWAOYEM-UHFFFAOYSA-N	435.419	1.047	50	20	IDGD	
COc1c(C)c2c(c(O)c1C/C=C(\C)CCC(=O)NNc1nnc(C)c(O)n1)C(=O)OC2	760792555	BBLFTGMGTYSLFR-BJMVGYQFSA-N	443.460	1.991	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)c1ccc(I)c(O)c1	760797884	CRDZNELLKAOJPQ-UHFFFAOYSA-N	430.173	1.976	50	20	IDGD	
CN(C)c1ccc2c(c1)NC(=O)C2=NNC(=O)CN1c2cccc3cccc(c23)S1(=O)=O	761776501	AHCBEMDSDKCFGY-UHFFFAOYSA-N	449.492	1.887	50	20	IDGD	
O=C(NNc1nccc(N2CCOCC2)n1)c1nc(NCc2ccco2)ncc1Cl	762855833	OLYRYIRTGXKQOE-UHFFFAOYSA-N	430.856	1.719	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)CN(C)C(=O)c2ccc(Br)o2)n1	762914871	HHZCRENDASJIHP-UHFFFAOYSA-N	425.287	1.894	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)CCCC[C@@H]3SC[C@@H]4NC(=O)N[C@@H]34)n[nH]2)cc1	762952943	OCCVJHJXPRYMCD-JENIJYKNSA-N	442.545	1.872	50	20	IDGD	
CN(C)CCCOc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3n2)cc1	763450490	OKAWFYGMNQOBTJ-UHFFFAOYSA-N	435.484	1.965	50	20	IDGD	
Cc1cnn(-c2ccc(NC(=O)C(=O)NNC(=O)[C@H]3COc4ccccc4O3)cc2F)c1	763570610	GYWBHVPXOVYVQF-GOSISDBHSA-N	439.403	1.246	50	20	IDGD	
COCCn1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2-c2ccccc2)cn1	763644716	XGWQNYMLTGDNCA-UHFFFAOYSA-N	437.456	1.361	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2OC)ccc1Cl	763646966	KSABOVCWANZIST-UHFFFAOYSA-N	449.847	1.690	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)N[C@H]2CCCC[C@@H]2N2CCOCC2)cc1	763656597	OQHQOIQGNFCRQL-IRXDYDNUSA-N	439.538	1.069	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(-c3noc(C)n3)c2)cc1	763660491	DWHHUVHZONYAHZ-UHFFFAOYSA-N	425.401	1.219	50	20	IDGD	
Cc1c(Br)cccc1NC(=O)C(=O)NNC(=O)COc1ccc(C#N)cc1	763674990	SNIGMIULHNPOIQ-UHFFFAOYSA-N	431.246	1.794	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cnn(-c3ccccc3Cl)c2)cc1	763681997	ZDJSHBXXDPYKOX-UHFFFAOYSA-N	438.831	1.562	50	20	IDGD	
O=C(COc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1ccc(C(=O)N2CCCC2)cc1	763686794	UGXUJMZAUULIGZ-UHFFFAOYSA-N	444.875	1.741	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)ccc1C(=O)N(C)C	763723441	OMCQXBDALMADSY-UHFFFAOYSA-N	426.517	1.999	50	20	IDGD	
CCc1nc2cc(NC(=O)C(=O)NNC(=O)c3nn(CC)c(=O)c4ccccc34)ccc2o1	763785546	HSGLYIWUNTUOFD-UHFFFAOYSA-N	448.439	1.520	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2cnc(Cl)c(C)c2)c2ccccc2c1=O	763785569	IHDKMBDFRJDCPE-UHFFFAOYSA-N	428.836	1.173	50	20	IDGD	
CCSCc1cccc(NC(=O)C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c1	763790352	HYPHXYVUZLFFAW-UHFFFAOYSA-N	439.497	1.586	50	20	IDGD	
Cc1cccc(Cn2nccc2NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)c1	763872562	OJWOHJRQVGDEFM-OAHLLOKOSA-N	439.447	1.932	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)cc(OC)c1OC	763873398	SGWFMQPGCTXACU-NSHDSACASA-N	435.408	1.405	50	20	IDGD	
CC(C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)cc1	763995029	DLUZZBNSWZOXDP-UHFFFAOYSA-N	436.266	1.315	50	20	IDGD	
C[C@@H]1Cc2cc(C(=O)NNC(=O)CSc3ccccc3O)ccc2N1S(C)(=O)=O	764045226	FLNGYCIVXFNAHL-GFCCVEGCSA-N	435.527	1.656	50	20	IDGD	
CN1CCN(Cc2cccc(NC(=O)C(=O)NNC(=O)c3cccc4ccccc34)c2)CC1	764057858	KMQLDGBHKHNTPY-UHFFFAOYSA-N	445.523	1.987	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1C(F)(F)F	764078621	YNZUUNKAQMZUJT-UHFFFAOYSA-N	443.403	1.817	50	20	IDGD	
CCCn1ccc2ccc(NC(=O)C(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)cc21	764084813	IFMLXNDCXIJMSY-UHFFFAOYSA-N	442.497	1.855	50	20	IDGD	
CC(C)COC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)c1	764152053	OEBSVJQGIHVADJ-GOSISDBHSA-N	440.456	1.981	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2O1)C(=O)Nc1ccc(F)cc1OCC(F)(F)F	764169506	WLEYEDXYNDTJHF-HNNXBMFYSA-N	441.337	1.856	50	20	IDGD	
CC1CCN(S(=O)(=O)c2ccc(NC(=O)C(=O)NNC(=O)CC(C)(C)C)cc2)CC1	764201842	GSYITVIWDFEDEY-UHFFFAOYSA-N	438.550	1.629	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)Cc2cccnc2)n(-c2ccccc2C(F)(F)F)n1	764268388	LHYAJUOPNMACCS-UHFFFAOYSA-N	446.389	1.923	50	20	IDGD	
CC(C)N1CCN(c2cccc(NC(=O)C(=O)NNC(=O)Cc3ccccc3F)c2)CC1	764319302	OGDJCIQKJNXJHM-UHFFFAOYSA-N	441.507	1.685	50	20	IDGD	
C#CCOc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(OC)c(Br)c2)c1	764326483	KFLUYUIHGGXYJM-UHFFFAOYSA-N	446.257	1.869	50	20	IDGD	
CC(C)(C)NC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)c1	764349475	LFNDCAXKPMQZNR-UHFFFAOYSA-N	432.864	1.974	50	20	IDGD	
COc1ccc(F)cc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccccc2OC)[nH]n1	764377233	LTQSOQIGZDILKH-UHFFFAOYSA-N	427.392	1.633	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1cccnc1Oc1cccc(C)c1C	764398930	YRPKQGGPHZVIBK-OAHLLOKOSA-N	430.461	1.628	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)[C@H](O)CCc3ccccc3)cc2)CC1	765198229	KVYPLPNHFODNKG-HXUWFJFHSA-N	432.546	1.060	50	20	IDGD	
CCOc1ccc(C(=O)NCC(=O)NNC(=O)c2cc(-c3ccccc3OC)[nH]n2)cc1	765588496	RHNMONNKBYJLEL-UHFFFAOYSA-N	437.456	1.675	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)c1ccc(F)cc1[N+](=O)[O-]	765751043	HLPZGQUTOCFKJM-UHFFFAOYSA-N	449.870	1.966	50	20	IDGD	
Cc1nnc2ccc(C(=O)NNC(=O)CN3CCN(Cc4ccccc4Cl)CC3)cn12	766659680	FGLGRDIPMAHMRA-UHFFFAOYSA-N	441.923	1.270	50	20	IDGD	
CC(C)(C)[C@H](Br)C(=O)N1CCC(C(=O)NCCCN2CCOCC2)CC1	768178850	DSTPZAGOBAXHEN-MRXNPFEDSA-N	432.403	1.873	50	20	IDGD	
CCn1c(SCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)nnc1-c1ccccn1	768413523	YXCZEPNADAUROL-UHFFFAOYSA-N	427.446	1.822	50	20	IDGD	
C[C@@]1(c2cccc(C(=O)NNc3ccc(S(=O)(=O)C(F)F)cc3)c2)NC(=O)NC1=O	769020700	OQQUWIDIJCMYFA-SFHVURJKSA-N	438.412	1.494	50	20	IDGD	
C[C@H](NS(=O)(=O)c1ccc(C(N)=O)cc1)C(=O)NNc1ccc(OC(F)(F)F)cc1	771038116	OLFVZUZMAHNKNE-JTQLQIEISA-N	446.407	1.494	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)CN(C)S(=O)(=O)c1ccc(Cl)cc1	771850825	OUJGHNVUHMPINV-GFCCVEGCSA-N	433.914	1.086	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1cc(Br)cc(Br)c1N	771967224	RQLLXWVFJWQVOK-ZCFIWIBFSA-N	437.088	1.897	50	20	IDGD	
O=C(CN[C@@H](c1ccccc1)C(F)(F)F)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772897406	HJIHGACTPAGYCE-INIZCTEOSA-N	442.825	1.997	50	20	IDGD	
O=C(COc1cccc(NC(=O)C2CC2)c1)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772905732	OWNPZDPJFZXCDH-UHFFFAOYSA-N	444.875	1.531	50	20	IDGD	
C[C@@H](C1CC1)n1cc(NC(=O)C(=O)NNC(=O)c2cc(Br)ccc2O)cn1	778709948	LEYGLPFNNNROJL-VIFPVBQESA-N	436.266	1.722	50	20	IDGD	
CN(C)C(=O)COc1ccccc1C(F)(F)C(=O)OCC(=O)NNC(=O)c1ccccc1	778923980	VBPRZGFDPPAKJB-UHFFFAOYSA-N	449.410	1.250	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)[C@H]2CCN2C(=O)OC(C)(C)C)cc1OC	781331865	NUKWXJOBULVNGX-CYBMUJFWSA-N	437.449	1.017	50	20	IDGD	
O=C(NNc1ncncc1Cl)[C@H]1CCCCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1	781818675	FTLWHYWKCPEURK-CQSZACIVSA-N	440.869	1.725	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2ccc(S(=O)(=O)N3CCC[C@H](C)C3)cc2)nc1	782139807	BYZSHGFHXAMWQG-AWEZNQCLSA-N	447.517	1.593	50	20	IDGD	
CCN1CCN(c2ccc(NC(=O)C(=O)NNc3ncnc4ccsc34)cc2)CC1	783254669	JOWDHIHWRMMXFP-UHFFFAOYSA-N	425.518	1.915	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2cccc(OC(F)F)c2)nc1	783264390	OPGJGMWBUUTFDD-UHFFFAOYSA-N	443.432	1.452	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2ccc(Br)c3ccccc23)CCS(=O)(=O)C1	783427117	LRBLNSPPNWYEDA-KRWDZBQOSA-N	440.319	1.739	50	20	IDGD	
Cn1cc(CNC(=O)/C(C#N)=C/c2cn(CCC(N)=O)nc2-c2ccc(Cl)cc2)nn1	783619646	ZDJJDMAOLIGRLF-RIYZIHGNSA-N	438.879	1.431	50	20	IDGD	
Cc1ccccc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	784231073	UWXDMHJBVFFCOX-UHFFFAOYSA-N	431.518	1.013	50	20	IDGD	
COc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)C(=O)NNc1ccccc1Cl	784777593	WXEISZWIOFLRHW-UHFFFAOYSA-N	426.882	1.681	50	20	IDGD	
COCCOc1ccccc1NC(=O)C(=O)NNc1c(OC)cccc1S(C)(=O)=O	785331582	WCOXBLRGVPNPHD-UHFFFAOYSA-N	437.474	1.206	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cc(C(=O)NCC3CC3)ccc2C)cc1	785992259	YFHQLQQWNAZYSC-UHFFFAOYSA-N	438.484	1.608	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)Nc1nn(CCS(=O)(=O)CC)cc1C	786718663	ULNRISDNSMKMPS-UHFFFAOYSA-N	437.522	1.420	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)Cc1ccc(Br)c(Cl)c1	787329744	FABJJYMTJBIMFG-UHFFFAOYSA-N	425.670	1.617	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NN=C1C(=O)Nc2ccc(Br)c(Cl)c21	788020670	RFIJSIDNRHUEHS-UHFFFAOYSA-N	425.626	1.898	50	20	IDGD	
CCc1[nH]nc(C(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)c1Br	789867132	LRFSTCHWSLLMJX-UHFFFAOYSA-N	427.255	1.835	50	20	IDGD	
Cc1c(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)nnn1CC1CCCC1	789970694	OSIYMALTLLQFJY-UHFFFAOYSA-N	448.549	1.555	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)NCCCn2c(=O)ccn(C)c2=O)c(C)n1C[C@@H]1CCCO1	791263288	VJRWKORIDLFRAF-DTBYZMGXSA-N	439.516	1.258	50	20	IDGD	
CCOC(=O)c1nn(C)cc1/C=C(\C#N)C(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1	792865151	BIXSCKVQHXIGIY-NTCAYCPXSA-N	438.444	1.761	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)c1cc(I)c(C)cc1C	793556895	YCEUKXZBKAZFQG-UHFFFAOYSA-N	431.274	1.974	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)[C@@H](C)CNC(=O)OC(C)(C)C)c2ccccc2c1=O	794776407	WGBGTOHXNYVLMR-ZDUSSCGKSA-N	431.493	1.899	50	20	IDGD	
CC[C@H](C)CCC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	794809958	OBXSNTQLGVWNMQ-INIZCTEOSA-N	425.551	1.614	50	20	IDGD	
Cc1cc2nc(C)c(CCC(=O)NNc3ccccc3S(=O)(=O)N(C)C)c(C)n2n1	795180736	BITZWCDXMKIFHK-UHFFFAOYSA-N	430.534	1.981	50	20	IDGD	
NC(=O)Cc1occc1C(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1	795864522	FUWLGSWXGURDDE-HXUWFJFHSA-N	432.480	1.696	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2cc(OC)c(C)cc2C)c2ccccc2c1=O	796991070	ZSCHXNDHKYUAQJ-UHFFFAOYSA-N	437.456	1.442	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)N1CCC(O)(c2scnc2Br)CC1	797524338	NZKYISSKPYTFQB-LLVKDONJSA-N	433.372	1.771	50	20	IDGD	
Cc1ccc([C@H](NCC(=O)NNC(=O)Cc2nc(C)cs2)[C@@H](C)S(C)(=O)=O)cc1	797996929	FXFWSRZMMKVUKO-AUUYWEPGSA-N	438.575	1.214	50	20	IDGD	
CN(NC(=O)C(=O)Nc1cnc(N2CCOCC2)c(Br)c1)c1ccccc1	799261303	WZHRUSFUPBFXKX-UHFFFAOYSA-N	434.294	1.787	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1nc2c(s1)C[C@@H](c1ccccc1)CC2	799437618	QQFFDIXEDYKTON-YPMHNXCESA-N	437.547	1.506	50	20	IDGD	
COc1ccc(-c2nc(C)c(C(=O)NNC(=O)N[C@H]3CCS(=O)(=O)C3)s2)c(F)c1	800328326	LJTUBGFAJRYJKG-JTQLQIEISA-N	442.494	1.397	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cc3c(cc2N)CCCC3)cc1OC	801452385	IBBUWZDTLQDBKA-UHFFFAOYSA-N	427.457	1.783	50	20	IDGD	
O=C(NC[C@@H](c1cccc(F)c1)N1CCOCC1)NNc1ccc(-n2ccnc2)nn1	805003841	HSMGQOBHBKVAIT-KRWDZBQOSA-N	426.456	1.501	50	20	IDGD	
COc1ccccc1O[C@@H]1CCCN(C(=O)NNC(=O)CNC(=O)c2cccs2)C1	805044456	SUIPGMJYYPKKOI-CQSZACIVSA-N	432.502	1.771	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)NCC(=O)NNc2ccc([N+](=O)[O-])cc2C)cc1	805376442	AWNDVIPTZSKJOH-UHFFFAOYSA-N	436.446	1.502	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2cnn(CCN(C)C)c2-c2ccccc2)C[C@H](C)O1	806340028	MPDUEORQWMTQKI-ROUUACIJSA-N	442.564	1.372	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1cccc2cc(Br)cnc12	806979026	LBCCSGXYTOSQNN-SNVBAGLBSA-N	439.266	1.135	50	20	IDGD	
CN(C)CCC(=O)Nc1ccc(NC(=O)C(=O)NNc2nccnc2C2CCC2)cc1	807462831	UHUSJWOVCTYHRL-UHFFFAOYSA-N	425.493	1.716	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)NCCC(=O)NNc2ccc([N+](=O)[O-])cc2C)cc1	807778299	UGWOLRLHISUYDX-UHFFFAOYSA-N	435.462	1.673	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNS(=O)(=O)c1ccc(C(F)F)cc1	808069699	GXWMOYAMWMWEOM-UHFFFAOYSA-N	432.474	1.849	50	20	IDGD	
O=C(CNS(=O)(=O)c1c(Cl)cccc1Cl)NNC(=O)Cc1ccccc1F	810373407	SSSGBGNNQILJBZ-UHFFFAOYSA-N	434.276	1.801	50	20	IDGD	
Cc1ccccc1NC(=O)NNC(=O)C(=O)Nc1cc(C(N)=O)ccc1OCC(F)F	810393842	UCRZWSSSXLMTPO-UHFFFAOYSA-N	435.387	1.529	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)Nc1ccc2c(c1)OCCO2	813464857	HZWBQGOFESPAJO-UHFFFAOYSA-N	425.489	1.823	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2cc([N+](=O)[O-])ccc2C(F)(F)F)n1	815511605	PWRBUPUMCSPADE-UHFFFAOYSA-N	446.363	1.925	50	20	IDGD	
CNC(=O)Oc1cccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)c1	815626114	WBMIAZMYSGYXAY-LLVKDONJSA-N	434.836	1.612	50	20	IDGD	
O=C(NNC(=O)[C@H]1OCC[C@H]1c1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	815629003	PZPUXMPAKKOPOF-STQMWFEESA-N	442.419	1.907	50	20	IDGD	
COC(=O)c1c(F)cccc1NNC(=O)CN1C(=O)N[C@@](C)(c2ccc(OC)cc2)C1=O	819711512	XTENKHIBZWITDN-NRFANRHFSA-N	444.419	1.531	50	20	IDGD	
O=C(CCc1nc(O)c2c3c(sc2n1)CCC3)NNC(=O)[C@H]1COc2ccccc2O1	821955608	YUTAPYMQQATZSH-CQSZACIVSA-N	440.481	1.806	50	20	IDGD	
O=C(CN1CCN(Cc2cn3ccccc3n2)CC1)NNC(=O)c1ccccc1Cl	821985858	WFYOGZFBZUYXAC-UHFFFAOYSA-N	426.908	1.567	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)[C@H]2CS[C@@H](Cc3ccccc3F)C(=O)N2)c1	891387465	BCWUKWLKOZPYKW-MSOLQXFVSA-N	447.488	1.447	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)[C@H]3CCC(=O)N3)c3ccccc3n2)cc1OC	912913666	UVWVBNQETDMYAF-QGZVFWFLSA-N	434.452	1.959	50	20	IDGD	
CC(C)C[C@@H](/N=C1/NS(=O)(=O)c2ccccc21)C(=O)NNC(=O)NC1CCCCC1	913451098	MSYMCQABBPJZBA-MRXNPFEDSA-N	435.550	1.803	50	20	IDGD	
C[C@@H]1C[C@@H]1C(=O)Nc1ccc(C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1	915407630	FTKJTBDNVZPJQE-PXAZEXFGSA-N	440.412	1.807	50	20	IDGD	
COc1cccc(C[C@H](C(=O)NNC(=O)Cc2ccc(Cl)cc2)n2nnnc2C)c1	915686484	CWURQZZPEYMFHR-GOSISDBHSA-N	428.880	1.817	50	20	IDGD	
Cc1cc(C)c(C)c(S(=O)(=O)NCC(=O)NNC(=O)COc2ccc(F)cc2)c1C	915785324	ALEGKNXBEYPDQE-UHFFFAOYSA-N	437.493	1.564	50	20	IDGD	
O=C(Cc1cccc(F)c1)NCC(=O)NNC(=O)COc1ccc(Br)cc1	916095256	SCQONENFGNOQJT-UHFFFAOYSA-N	438.253	1.473	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)NCCCN1C(=O)NC2(CCCCC2)C1=O	916266675	PWDKASLVGFPMND-UHFFFAOYSA-N	435.456	1.180	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)NCc2ccnc(N3CCOCC3)c2)cc1OC	916389311	VXCSHUGCODSVRD-UHFFFAOYSA-N	443.504	1.860	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(F)cc3nc[nH]c23)c1	916734611	RLQPOKLNXXWOJT-UHFFFAOYSA-N	433.465	1.807	50	20	IDGD	
CC(=NNC(=O)CC(F)(F)F)c1ccc(S(=O)(=O)N2CCC(C(=O)O)CC2)cc1	917551155	OLPXVXKDVWCNKV-UHFFFAOYSA-N	435.424	1.965	50	20	IDGD	
Cc1ccc(F)cc1S(=O)(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	917721735	GCDPNMKDPYPELG-UHFFFAOYSA-N	441.506	1.542	50	20	IDGD	
COc1cc(CNC(=O)/C(C#N)=C/c2cc(C#N)n(C)c2C)ccc1OCC(=O)N(C)C	918579090	OLOCSCORCHBTLG-GIJQJNRQSA-N	435.484	1.904	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)c1ccc(NC2CC2)nc1	919969835	CSHPBMWFGZWBAQ-UHFFFAOYSA-N	443.529	1.905	50	20	IDGD	
CCS(=O)(=O)N1CCC(C(=O)NNC(=O)NCc2ccco2)(c2ccccc2)CC1	920857890	WXBKMSMQJTWPIK-UHFFFAOYSA-N	434.518	1.494	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)c2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1	1115884981	IQDCRHWPLRJWOA-OAHLLOKOSA-N	426.473	1.480	50	20	IDGD	
O=C(CN1C(=O)Cn2c(cc3ccccc32)C1=O)NNC(=O)c1cncn1-c1ccccc1	1115906011	XRFYUKAEPYSJLV-UHFFFAOYSA-N	442.435	1.271	50	20	IDGD	
COc1cc(F)cc(F)c1S(=O)(=O)NNC(=O)c1sc(N2CCOCC2)nc1C	1318703885	CTPSEEXDMDRZAA-UHFFFAOYSA-N	448.473	1.198	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@@H]3CC(=O)N(C)c4ccccc43)CC2)cc1	1319208759	MFQODPLBRLCICP-OAQYLSRUSA-N	449.555	1.410	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)o1	1779031214	QZIXHTZDDOTPQQ-PIGZYNQJSA-N	428.283	1.465	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(CCN(C(=O)c3cc(-c4ccccn4)[nH]n3)C2)C1	1779628309	QQELCPFHDIXLSR-LJQANCHMSA-N	448.321	1.700	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(OC)nn3)C2)C1	1779902436	QZFNRRZPIGLRLT-YVEFUNNKSA-N	427.299	1.102	50	20	IDGD	
CCSc1cccnc1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](Cl)COC)CCO2	1780465328	LNMJSTNEHAWYSR-AUUYWEPGSA-N	427.954	1.891	50	20	IDGD	
Cn1cc(F)cc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Br)C1	1780773537	OEXBNEZITLZUCN-CKEIUWERSA-N	434.281	1.982	50	20	IDGD	
CC[S@](=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)Br)C1	1781997579	CPMDNALNLNTGRE-SXPIZGJPSA-N	437.400	1.442	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1nc[nH]c1[N+](=O)[O-])C2	1781998724	GERDFRHICAEMNZ-GLKRBJQHSA-N	444.286	1.229	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(OC)nc1)C2	1782172007	KKVQCFKEDTWFCM-JXXFODFXSA-N	425.913	1.472	50	20	IDGD	
O=C(c1nc2ccc(F)cn2n1)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1782569923	VJPQUNYUZVELKJ-LRDDRELGSA-N	444.236	1.002	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)C3CCC4(CC3)OCCO4)C2)C1	1782943673	KKQFSWNZEFNROK-VQIMIIECSA-N	430.929	1.003	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](O)Cc3ccccc3)C2)C1	1783335827	CTPFGXYTPKCKMR-SYNHAJSKSA-N	439.350	1.451	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)COc3cccnc3)CCO2)C1	1783343768	PUUYQUHPQICMAQ-QAPCUYQASA-N	426.311	1.464	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(C(N)=O)cc3)CCO2)C1	1783354174	NRQQRENDVIMERU-KXBFYZLASA-N	438.322	1.403	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc([N+](=O)[O-])o3)[C@H]2C1	1783364253	GDUPURPPLLOMSR-BLFANLJRSA-N	430.255	1.565	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)CCc3cccc(O)c3)CCO2)C1	1783539468	JXUQPYYZMRSOER-AUUYWEPGSA-N	425.323	1.938	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)Cc3ccc(C)c([N+](=O)[O-])c3)CCO2)C1	1783882208	WIOUCJLHJKNLKG-UZLBHIALSA-N	439.896	1.529	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(F)c(N(C)C)c(F)c3)CCO2)C1	1783882985	RYOVZFDGMSQNDY-XOBRGWDASA-N	445.894	1.728	50	20	IDGD	
O=C(C(Cl)Cl)N1CC[C@]2(C1)CN(C(=O)[C@H]1ON=C(c3ccccc3)O1)CCO2	1783946102	IMTBQGCQDGCCJW-MSOLQXFVSA-N	428.272	1.355	50	20	IDGD	
O=C(c1cc(Cl)nc2n[nH]cc12)N1CCO[C@@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783946237	YZPVIALGCFJZBI-MRXNPFEDSA-N	432.695	1.859	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCC3CCC3)[C@H]2C1	1784303067	QRNCUHXZYUATSR-QXDWZXEQSA-N	443.548	1.680	50	20	IDGD	
COc1cccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCBr)[C@H]3C2)n1	1786404436	PZPPMHUJCMMCPL-YDHLFZDLSA-N	426.311	1.469	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(F)cc([N+](=O)[O-])c3)[C@H]2C1	1790132735	BSJAYLBYESSDDJ-SPOWBLRKSA-N	443.859	1.581	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)Cn3cncn3)C[C@@H]21	1790960896	SVLCNWBIYPZTAZ-YXMSTPNBSA-N	442.358	1.067	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COc1ccc(O)cc1)C2	1792866485	ATYXVGFXLLWHLJ-ZUMXRPEOSA-N	441.322	1.392	50	20	IDGD	
C[C@@H](CBr)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc3n(n1)CCCO3)C2	1792987588	VFPDTSACBZJECU-FQUUOJAGSA-N	425.327	1.948	50	20	IDGD	
COc1ccc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Cl)C3)cc1OC	1793657266	JFNSIUGDGWBWFS-FTUNRGFVSA-N	428.888	1.760	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1c(F)ccnc1Cl	1794237545	BYMMTKAPIXMWSK-IWXIMVSXSA-N	438.656	1.768	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(C(=O)O)ncn1	1794676980	NCHYLOHHCYKOQK-YFKTTZPYSA-N	425.283	1.458	50	20	IDGD	
C[C@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@](C)(Cl)CCl)C2)n1cccc1C=O	1795750260	JISGUJBOGXUQSL-TWAUDHPGSA-N	430.332	1.688	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](CC1CC1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Cl	1796368211	FXPRNUWYISUEPS-JKJDWNRSSA-N	447.935	1.804	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1Cc2ccccc2O1	1797226720	HFMXMQPTDCQTOS-ACSCVQKFSA-N	427.328	1.816	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(C(C)(C)C)n[nH]1	1798132254	DRYIIECNHAEKFA-NFFDBFGFSA-N	441.370	1.941	50	20	IDGD	
C[C@H](NC(=O)c1ccc(F)cc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2	1799050913	GUOPJCYJVCHRFU-LLKOPVJYSA-N	429.851	1.068	50	20	IDGD	
Cc1ccn2c(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@@H](F)Br)C4)cnc2c1	1800084713	SEKAJHDTFIRPON-NOXHYTERSA-N	439.285	1.536	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@H]1CCN(C(=O)c2ncn(C)n2)[C@@H]1c1cccnc1	1803008163	HJWXWEKRWKQDHC-BPLDGKMQSA-N	435.326	1.561	50	20	IDGD	
O=C(/C=C/c1ccco1)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1804614942	QAAWGODSWHIAEZ-PFTYNZSZSA-N	445.284	1.387	50	20	IDGD	
Cc1ncoc1C(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1805863042	UHQOYILSRRTYLU-APWZRJJASA-N	428.493	1.071	50	20	IDGD	
O=C(Cc1cccs1)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1807542607	JNEMPWMFRLWCML-GCJKJVERSA-N	449.341	1.385	50	20	IDGD	
C[C@@H](CN)C(=O)N1CCCC2(CCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CC2)C1	1809643699	JTYCZQLGLMSHAM-HOTGVXAUSA-N	445.004	1.945	50	20	IDGD	
CN(C)C(=O)NCC(=O)N1CC[C@H](CNC(=O)CO[Si](C)(C)C)[C@H]1c1cccnc1	1810537375	DJZBGFHEIGRKSQ-VQIMIIECSA-N	435.601	1.210	50	20	IDGD	
COc1ccc([C@H](O)C(=O)N2CCCC[C@H]2c2cc(NC(=O)[C@@H](O)CCl)n[nH]2)cc1	1814863957	DJOMKSSSJGPRRI-BQFCYCMXSA-N	436.896	1.744	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1CCc2nc(NC(=O)CCSC(=N)N)sc2C1	1814946192	UKSNGXUCQMKYIQ-SNVBAGLBSA-N	429.644	1.923	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(F)s2)[nH]n1)c1ccc(B(O)O)cc1	1817471098	RQPFLUSEJVCDGM-HNNXBMFYSA-N	442.281	1.910	50	20	IDGD	
O=C(Cc1cccs1)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1817575938	GECBMBKVTDOBEH-SFHVURJKSA-N	438.318	1.700	50	20	IDGD	
CC(=O)N1CCN(CC(=O)Nc2cc([C@@H]3CCCCN3C(=O)C(Cl)Cl)[nH]n2)CC1	1818967690	VFBSHMICZKJNIN-AWEZNQCLSA-N	445.351	1.370	50	20	IDGD	
C[C@@](O)(CC(=O)O)CC(=O)N[C@H]1CCc2nc(NC(=O)CO[Si](C)(C)C)sc2C1	1820169622	ZUIIYZUIJVSSJM-VOJFVSQTSA-N	443.598	1.522	50	20	IDGD	
CCS(=O)(=O)CC(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](C)Br)n[nH]1	1822183971	IJEXZLNULQXHEW-PWSUYJOCSA-N	435.344	1.620	50	20	IDGD	
C[C@H](Br)C(=O)Nc1cc([C@H]2CCCCN2C(=O)C[C@@](C)(O)CC(=O)O)[nH]n1	1822191959	OVESZRZLEAQOMC-GSDQYQHOSA-N	445.314	1.801	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCc2ccc(O)nn2)[nH]n1	1822377540	XTGATSRRUAIDQT-DZGCQCFKSA-N	436.900	1.784	50	20	IDGD	
O=C1C[C@H](C(=O)Nc2cc([C@@H]3CCCCN3C(=O)CCBr)[nH]n2)CCN1	1822478028	FJWFJLKNZUBRJZ-YPMHNXCESA-N	426.315	1.713	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CN1CCNC1=N)CC2	1822863974	WFOCPFUMTWEZOU-ABKXIKBNSA-N	433.365	1.131	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1	1823003019	GLEAIXQEDHLYQL-JWKOBGCHSA-N	435.319	1.612	50	20	IDGD	
O=C(N[C@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1)c1n[nH]cc1[N+](=O)[O-]	1823006491	BCOMJDMOPVWHLB-XUOSJQGZSA-N	447.246	1.691	50	20	IDGD	
C[C@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1)C1(O)CCC1	1823737763	XJNLTAFMRMWDDV-IEBWSBKVSA-N	436.597	1.530	50	20	IDGD	
CC(=O)NCCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](C)CBr)CC2	1825232369	NUNLNJUZSRKTKR-ONGXEEELSA-N	431.356	1.612	50	20	IDGD	
CCS(=O)(=O)N[C@@H](C)C(=O)N[C@@H]1CCc2nc(NC(=O)C(Cl)Cl)sc2C1	1826092874	NJKFJVJYKZTNNU-JGVFFNPUSA-N	443.378	1.187	50	20	IDGD	
CC1=C(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)CCO1	1827054983	RDDPOOFBFTVZCS-OAQYLSRUSA-N	426.322	1.294	50	20	IDGD	
Cc1[nH]nc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)c1F	1827056226	RVBABKSKNLMYNH-SFHVURJKSA-N	442.300	1.084	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cnc[nH]2)CC1	1827680749	GVHQWKJJEPWQDP-UAHQCSBISA-N	439.520	1.777	50	20	IDGD	
O=C(CCc1ccc(F)c(F)c1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1830271928	MENGNWAQFGWKPZ-IEBWSBKVSA-N	434.842	1.888	50	20	IDGD	
Cc1nnc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)s1	1830358199	SEBDATBIAABQOO-GOSISDBHSA-N	430.958	1.110	50	20	IDGD	
CC(C)[C@@H](S)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)CBr)C2)C1	1831482997	JEHFRYOAYJYZBQ-CPUCHLNUSA-N	437.400	1.428	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCCn3ccnc3C)C2)C1	1831657222	MVEHIWORXZENOI-WIYYLYMNSA-N	440.972	1.836	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CN2CCCCC2=O)CC1	1831768525	NIXPKCODESEGHN-ROUUACIJSA-N	427.973	1.872	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@](C)(Cl)CCl)C3)C2)cn1	1831952978	PQKABZRLASENCY-MOPGFXCFSA-N	446.331	1.397	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)[C@H]2CC[C@H](O)CC2)CC1	1831996148	GYOBBTJRDIHFBY-CEMLEFRQSA-N	442.365	1.151	50	20	IDGD	
Cc1cccnc1CCC(=O)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1832780789	BFFXXNOOFSYQAU-IBGZPJMESA-N	430.332	1.583	50	20	IDGD	
CN1CCCC[C@H]1C(=O)NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1833322034	QOYUMLKTXJETPJ-DLBZAZTESA-N	447.393	1.733	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](CC)NC(N)=O)CC2)CC1	1833532614	ZGTCBTHLVCLWIA-IAGOWNOFSA-N	429.993	1.412	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccnc(Cl)c3)CCO2)C1	1834185435	IADKWNJZYCBMMM-RDTXWAMCSA-N	432.304	1.059	50	20	IDGD	
C[C@@H](Nc1cccnc1)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](F)Cl)CC2)CC1	1834719281	HTTXSIFRJWRZSM-RDTXWAMCSA-N	425.936	1.988	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)Cn3cccn3)CC2)CC1	1834884813	PLTIZMQYGKPXNN-QGZVFWFLSA-N	440.386	1.628	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)CN3CCCCC3)CCO2)C1	1835378023	LHCMGRPMSALCEP-RTBURBONSA-N	436.380	1.165	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC1CCN(C2CCN(C(=O)c3cnn4c3CCC4)CC2)CC1	1835837374	IWXJWZXWDDKPMM-UHFFFAOYSA-N	447.656	1.866	50	20	IDGD	
Cn1cc(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@](C)(Cl)CCl)C3)C2)cn1	1835988514	ZIEIPHWKPAIGPF-MOPGFXCFSA-N	447.363	1.045	50	20	IDGD	
C[C@@H](C(=O)N1CCC(N2CCC(NC(=O)[C@H](F)Br)CC2)CC1)n1ccnc1	1836414073	VXNQNPPXVVBCMB-BBRMVZONSA-N	444.349	1.706	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1Cc3ccccc3O1)CCO2	1836643779	KXFJFDWJWLWZPB-JLMWRMLUSA-N	436.936	1.854	50	20	IDGD	
COC(OC)C(=O)N1CCC(OC2CCN(C(=O)[C@H](C)CBr)CC2)CC1	1836671125	XSZIIOWVASJZSS-CYBMUJFWSA-N	435.359	1.635	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)/C=C/c3cc(C)on3)CCO2)C1	1837552326	KQIBLCQHTZJVPZ-YWMZBHJASA-N	425.913	1.860	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(F)n3)CCO2)C1	1837902402	WXAIKBTWFJYSNF-UGSOOPFHSA-N	444.301	1.322	50	20	IDGD	
C=C[C@H](O)C(C)(C)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](Cl)COC)CC2)CC1	1838386195	BVKCERHUDYTCQG-ROUUACIJSA-N	430.973	1.812	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCSC)CC2)CC1	1838786663	PTLWJMRRPWANGA-IAGOWNOFSA-N	437.002	1.353	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C=C/c3cnc(C)s3)C2)C1	1839148500	ANXQDCYATBGKLM-CHYGHELMSA-N	427.954	1.939	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc([N+](=O)[O-])[nH]3)C2)C1	1839153494	IKPSTLBYSUXCQA-IRXDYDNUSA-N	449.291	1.229	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3ccco3)C2)C1	1839962573	KUVCJMSABIXBIX-APWZRJJASA-N	443.338	1.842	50	20	IDGD	
Cc1onc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)c1C	1840030118	AOHMHCHCWQIZRM-SJCJKPOMSA-N	430.299	1.145	50	20	IDGD	
O=C(C(Cl)Cl)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CNc4ccccc43)C2)C1	1840188150	QXOOOIFUXDTRSL-IFXJQAMLSA-N	428.316	1.456	50	20	IDGD	
O=C(c1ccc(O)c([N+](=O)[O-])c1)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840189355	MWEYURXYAUZNHE-KRWDZBQOSA-N	448.259	1.174	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC2(CCCN2C(=O)c2cccc(S(C)(=O)=O)c2)C1	1841171146	RLAKVNXFMBDTQD-CYBMUJFWSA-N	443.363	1.938	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)N2CCCC23CN(C(=O)[C@H](F)Br)C3)c1	1841172294	MIDVNSKPKAAZCE-ZDUSSCGKSA-N	433.299	1.598	50	20	IDGD	
CN(CC(=O)N1CC2(CCCN2C(=O)c2ccccn2)C1)NC(=O)NCc1ccccc1	1842387296	XTVMQPBZGYWPKV-UHFFFAOYSA-N	436.516	1.245	50	20	IDGD	
CS(=O)(=O)Cc1ccc(C(=O)N2CCCC23CN(C(=O)[C@@H](F)Br)C3)cn1	1843216432	HDHNGOYKCVHYJY-CYBMUJFWSA-N	448.314	1.134	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC2(CCCN2C(=O)[C@@H]2CN(Cc3ccccc3)CCO2)C1	1843924886	IXOVVTGXWBTJRA-FQEVSTJZSA-N	445.636	1.942	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2cc3cccnc3[nH]2)C1	1844084922	DSBDICOPTCCGLT-VULFUBBASA-N	433.472	1.514	50	20	IDGD	
C[C@@H](C(=O)N1CCCC12CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)n1ccnn1	1845812146	WRIGGPFWEFXSJS-KBPBESRZSA-N	440.932	1.175	50	20	IDGD	
CC(C)[C@H](C(=O)N1CCCC12CN(C(=O)c1ccc(B(O)O)cc1)C2)c1ccc(F)cc1	1846283565	RFAVPVBWHLQSBE-NRFANRHFSA-N	438.308	1.762	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@H](O)c1cccc(Br)c1)C2	1846363543	PBPDBOUZPYUQHF-CABCVRRESA-N	445.741	1.940	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1c(C)nn(-c2ccccc2)c1O	1848333708	KPUADPQKNVDPBP-IKGGRYGDSA-N	432.908	1.956	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ccc3nnc(C(F)(F)F)n3n2)CC1)c1ccccn1	10091899	LCLHZNHLATZKBN-UHFFFAOYSA-N	434.382	1.216	50	20	IDGD	
COc1cc(C(=O)OCC(=O)NNC(=O)c2cccs2)c([N+](=O)[O-])cc1OC(F)F	10209278	KWMIOFYRFNAISB-UHFFFAOYSA-N	445.356	1.884	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)Cn2c(=O)n(CC)c3ccccc32)cc1	10752829	VRQLIZBTOUIHDG-OAHLLOKOSA-N	426.473	1.837	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)c2ccc3c(=O)n(-c4ccccc4)c(=O)[nH]c3c2)c1	16233860	AYIVJNPQJXMFCA-UHFFFAOYSA-N	443.463	1.820	50	20	IDGD	
C#CCNS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H](C)Oc2ccc(OCC)cc2)c1	18072059	PAEBHSYBRWWABW-OAHLLOKOSA-N	445.497	1.225	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2ccc(S(N)(=O)=O)c(Cl)c2)ccc1OC(C)C	725907588	MMZFLPFKBRDAGP-UHFFFAOYSA-N	441.893	1.858	50	20	IDGD	
O=C(CN1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1)NNC(=O)c1cccc([N+](=O)[O-])c1	726187203	OFKGXNAAHBDLGC-INIZCTEOSA-N	444.423	1.391	50	20	IDGD	
COc1cccc2c1OCC[C@@H]2NC(=O)NNc1ccc(S(=O)(=O)NC(C)C)cn1	726273421	DKKFXXNFLYQELS-HNNXBMFYSA-N	435.506	1.927	50	20	IDGD	
COC(=O)Nc1cccc(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c1	728454295	NGDPJOKQVOVNJE-UHFFFAOYSA-N	425.489	1.838	50	20	IDGD	
N#Cc1ccc(SCC(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1	728675303	BLQFMPFQJQPRDX-QGZVFWFLSA-N	427.438	1.181	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)CS(=O)(=O)Cc1ccc(Br)cc1	728851664	SBERJIPOIFOIIC-UHFFFAOYSA-N	426.292	1.149	50	20	IDGD	
COc1cc(Cl)ccc1S(=O)(=O)NNC(=O)C1CCN(c2ncccn2)CC1	728853789	BFYSNTYFYLPRDJ-UHFFFAOYSA-N	425.898	1.365	50	20	IDGD	
CC(C)Oc1ccc(-c2nc(C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)cs2)cc1	729276388	DNOOZJMEJYZVQL-NSHDSACASA-N	426.520	1.296	50	20	IDGD	
CC[C@H](NC(=O)NNC(=O)Cn1ccc2ccccc21)c1cccc(S(N)(=O)=O)c1	729499960	CGTSOINIXOZLBW-KRWDZBQOSA-N	429.502	1.770	50	20	IDGD	
NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NNC(=O)Cn3ccc4ccccc43)cc2)C1	729507072	NTUIMLBQXRHEGW-LJQANCHMSA-N	448.527	1.874	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)N[C@@H](C)[C@@H](C)N2CCOCC2)c2ccccc2c1=O	729624671	WMOYFYLMJNKYIM-LSDHHAIUSA-N	430.509	1.031	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)NCC1CCN(Cc2ccccc2Cl)CC1	730134346	YRECBEAWYYTHKI-UHFFFAOYSA-N	447.923	1.905	50	20	IDGD	
C[C@H](NC(=O)OC(C)(C)C)C1CCN(CC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)CC1	730267403	NYXNYMYNBRJAOE-AWEZNQCLSA-N	449.508	1.981	50	20	IDGD	
CC(C)(C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCOCC2)cc1)c1ccccc1	731172927	CXUWYGKSBROYNJ-UHFFFAOYSA-N	431.514	1.446	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)C(C)(C)c2ccccc2)cc1	731177245	AWLGXVCNWHAQRT-UHFFFAOYSA-N	425.532	1.224	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)c1ccc(S(=O)(=O)N=c2cc[nH]cc2)cc1	731494084	JMSBSUUIKMOJBZ-UHFFFAOYSA-N	426.454	1.388	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Cn2c(C)nc3ccccc3c2=O)cc1Br	732036097	VQMMLXPSBAELFM-UHFFFAOYSA-N	445.273	1.937	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(Br)cc2)C1)C1CCC1	732142548	DRABJOFIXHXRSJ-CYBMUJFWSA-N	444.351	1.797	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)N1CCN(S(=O)(=O)c2cccc(Cl)c2)CC1	732195145	IHLRBWHPNRQORN-AWEZNQCLSA-N	430.958	1.228	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc(C(=O)O)c(F)cc1Cl)c1cnn(-c2ccccc2)c1	733122932	JDMCAOPSKUKJAL-UHFFFAOYSA-N	438.824	1.986	50	20	IDGD	
Cc1ccc(-n2c(NNC(=O)CN3C(=O)CN(C)C3=O)nc3ccccc3c2=O)c(C)c1	733265455	REALIMJHPSFSCZ-UHFFFAOYSA-N	434.456	1.340	50	20	IDGD	
Cc1cc(NNC(=O)C2=NN([C@H]3CCS(=O)(=O)C3)C(=O)CC2)ccc1Br	734252911	LRJVFSCOHBPUMG-LBPRGKRZSA-N	443.323	1.366	50	20	IDGD	
COc1ccc(CN2CC[C@H](NC(=O)NNC(=O)[C@H](C)Oc3ccccc3F)C2=O)cc1	734685817	VVTUNGLASPTDKY-KSSFIOAISA-N	444.463	1.733	50	20	IDGD	
O=C(NCC[S@@](=O)Cc1ccccc1)NNC(=O)c1nn(-c2ccccc2)cc1O	735106818	CSLZXRPHRLLHQQ-SSEXGKCCSA-N	427.486	1.471	50	20	IDGD	
CCOc1ccc(C(=O)NNS(=O)(=O)c2ccc(F)c(NC(C)=O)c2)cc1OC	736539888	QARYZDUOSMKTCI-UHFFFAOYSA-N	425.438	1.815	50	20	IDGD	
O=C(NNc1cccnn1)[C@H]1CCCN(S(=O)(=O)c2ccc(Br)s2)C1	736698277	HLPZSYNHYLJJIF-JTQLQIEISA-N	446.352	1.845	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@H](C)Cc2c(C)noc2C)cc1	739051093	XHHQWIIQFBCDSL-CYBMUJFWSA-N	437.522	1.182	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)NCc1cc(F)ccc1N1CCOCC1	741093124	MYKRICKPYCGIQY-UHFFFAOYSA-N	447.423	1.480	50	20	IDGD	
COC(=O)c1cc(OC(=O)CN2CCN(C(=O)OC(C)(C)C)CC2=O)ccc1[N+](=O)[O-]	741189324	ZXVJVBOEIHTVEN-UHFFFAOYSA-N	437.405	1.366	50	20	IDGD	
Cc1nn(C)c2sc(C(=O)N[C@@H](C)C(=O)NNC(=O)Nc3ccc(N(C)C)cc3)cc12	743828935	PDLYUMVXVVADBO-LBPRGKRZSA-N	443.533	1.980	50	20	IDGD	
CC(C)(C)c1nc(CN2CCN(CC(=O)NNC(=O)c3cccc(C#N)c3)CC2)cs1	744387884	YWGPLPDTCNBCSC-UHFFFAOYSA-N	440.573	1.891	50	20	IDGD	
C[C@H]1CN(CC(=O)NNC(=O)c2cccs2)CCN1C(=O)Cc1cccc(Cl)c1	744420120	XFNNGWBAQFASRQ-AWEZNQCLSA-N	434.949	1.938	50	20	IDGD	
O=C(NC[C@H](c1ccccc1)N1CCOCC1)NNC(=O)c1cc([N+](=O)[O-])ccc1O	745512974	NPRRIAPBPBXWDZ-QGZVFWFLSA-N	429.433	1.318	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCN(C(=O)c2cccc(O)c2)CC1	746461450	DWFVAGWBDKGINY-UHFFFAOYSA-N	446.891	1.273	50	20	IDGD	
O=C(NNC(=O)c1cnc(-c2ccc(C(F)(F)F)cc2)s1)N[C@H]1CCS(=O)(=O)C1	746594315	NNURPTCHESIRES-NSHDSACASA-N	448.448	1.960	50	20	IDGD	
COc1cc([C@H](C)NC(=O)NNC(=O)Cc2cn3ccccc3n2)cc(OC)c1OC	746749545	BZBCSSKUYBXXIT-ZDUSSCGKSA-N	427.461	1.994	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(C(=O)O)c(Br)c1)c1cccc([N+](=O)[O-])c1	747595535	QAFDTZFGYQAKTE-UHFFFAOYSA-N	444.219	1.679	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)(F)F)cc1)c1ccc(N2CCOCC2)nc1	748518011	DOFITWPPOOAYTQ-UHFFFAOYSA-N	430.408	1.969	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@H]2CCCN(Cc3cccnc3)C2)c2ccccc2c1=O	749160748	OGPHTVMJEQYRDI-KRWDZBQOSA-N	434.500	1.485	50	20	IDGD	
CC1CCC(NS(=O)(=O)CC(=O)NNc2nc(Br)cn3ccnc23)CC1	750248017	JAMQYDNYXGIJDP-UHFFFAOYSA-N	445.343	1.433	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O	751070331	IVTTZEAAMRIDJP-UHFFFAOYSA-N	432.483	1.653	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)Cn1c2ccccc2c(=O)c2ccccc21	751208608	HIUQQINBAYHANV-UHFFFAOYSA-N	434.477	1.794	50	20	IDGD	
CNS(=O)(=O)c1cccc(NC(=O)[C@H](C)NC(=O)/C(C#N)=C\c2ccc(F)cc2)c1	752056097	CUOXTKVBRLAFIB-OJNRTJSBSA-N	430.461	1.784	50	20	IDGD	
COc1cc(NC(=O)CN(C)CC(=O)NNC(=O)c2ccccc2Cl)cc(OC)c1	752331495	MNQKADYUGJZJDH-UHFFFAOYSA-N	434.880	1.689	50	20	IDGD	
C[C@@H]1C[C@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)CN1C1CC1	753943799	QQEAEIBAXPABRX-ZBFHGGJFSA-N	435.550	1.040	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1C	755330684	TWFNPUKVNSGMKT-UHFFFAOYSA-N	432.502	1.791	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NC(=O)NNC(=O)c2cccc(OC)c2O)cc1	755360330	PQPBVXRNTGOSQW-UHFFFAOYSA-N	436.490	1.898	50	20	IDGD	
CN(CC(=O)O)c1ccc(C(F)(F)F)cc1C=NNC(=O)N[C@@H]1CCS(=O)(=O)C1	755665290	UVKAUSRPPYRPQE-GFCCVEGCSA-N	436.412	1.046	50	20	IDGD	
Cc1sc(Br)cc1S(=O)(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	755957998	PBVMGPVEYCFTDI-UHFFFAOYSA-N	443.308	1.418	50	20	IDGD	
Cc1cc(OCc2cccc(F)c2)ccc1NC(=O)NNC(=O)[C@H](C)NS(C)(=O)=O	756339284	FJUVXJYXJSVLTK-ZDUSSCGKSA-N	438.481	1.804	50	20	IDGD	
COCC(=O)NNC(=O)Nc1ccc(Br)c(I)c1	756344765	VIWKROFDBXFBFY-UHFFFAOYSA-N	428.024	1.853	50	20	IDGD	
COC(=O)CN1CCN(c2ccc(NC(=O)NNC(=O)CCc3ccccc3)cc2)CC1	756393773	QOQGYTPVPQJRCH-UHFFFAOYSA-N	439.516	1.767	50	20	IDGD	
CNS(=O)(=O)c1ccc(C)c(NC(=O)NNC(=O)c2nnc(O)c3ccccc23)c1	756524539	GQQUXNNKAGACPB-UHFFFAOYSA-N	430.446	1.018	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)Nc2cc(C3CC3)nn2[C@H]2CCS(=O)(=O)C2)c1	756855683	LUKFVNDYQHVMMT-INIZCTEOSA-N	446.533	1.653	50	20	IDGD	
CCOc1ccccc1C(=O)NCC(=O)OCC(=O)NNC(=O)c1cccc(Cl)c1	757670864	LFOINXMKYDFQEJ-UHFFFAOYSA-N	433.848	1.473	50	20	IDGD	
COCCCS(=O)(=O)c1ccc(NC(=O)NNC(=O)COc2ccc(F)cc2)cc1	757824037	WKEICAOREZRDEE-UHFFFAOYSA-N	439.465	1.868	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1ccc(Br)c(C(F)(F)F)c1	758027790	XEBQIGOFIIADHL-LURJTMIESA-N	432.218	1.167	50	20	IDGD	
CCCc1[nH]nc(C(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)c1[N+](=O)[O-]	758787621	UJXKISGTPVWANP-UHFFFAOYSA-N	439.473	1.520	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NC[C@H]1CC(=O)N(Cc2ccccc2)C1	759684635	VQHHYDJTBFXAAL-NVXWUHKLSA-N	428.464	1.972	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)CN(C)C(=O)c2ccc(Br)s2)nc1	759721095	AJIQKZQUFNJZDY-UHFFFAOYSA-N	427.280	1.908	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)c2cc(S(N)(=O)=O)c(Br)s2)nc1	759731380	SHDLYFXZZWJSOF-UHFFFAOYSA-N	435.281	1.097	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2cccc([N+](=O)[O-])c2C#N)ccc1OC(C)C	760335016	OWPGSMOGDDBHAK-UHFFFAOYSA-N	434.430	1.886	50	20	IDGD	
CC(=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O)c1ccc(F)cc1Br	763150739	GRBLXJKUVNRXOG-UHFFFAOYSA-N	444.286	1.013	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)CN(C)[C@H]2CCSC2)c2ccccc2c1=O	763270909	ZBZBIOZDWLDMHZ-HNNXBMFYSA-N	431.562	1.785	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)c(F)c1	763540753	YZRWNSJTDXTZLL-UHFFFAOYSA-N	449.391	1.038	50	20	IDGD	
C[C@H](C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1)c1c(F)cccc1F	763588674	IBHGCIWGNZXEJB-HNNXBMFYSA-N	430.455	1.674	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(OCc3cccnc3)cc2)cc1	763682280	UKUVAWYNIKNDAM-UHFFFAOYSA-N	445.435	1.697	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)C(=O)Nc1ccc(OCc2ccccc2)nc1	763682349	ZXWFYRHTXCJGNY-UHFFFAOYSA-N	438.415	1.965	50	20	IDGD	
Cc1cc(S(C)(=O)=O)ccc1NC(=O)C(=O)NNC(=O)COc1ccc(Cl)cc1	763685305	AHPWMRHTKXYPQA-UHFFFAOYSA-N	439.877	1.217	50	20	IDGD	
COC(=O)CSCc1cccc(NC(=O)C(=O)NNC(=O)c2cccc(N(C)C)c2)c1	763754827	VNDOEDLIIRPGTA-UHFFFAOYSA-N	444.513	1.559	50	20	IDGD	
COC(=O)c1c(C2CC2)csc1NC(=O)C(=O)NNC(=O)c1cc(OC)cc(OC)c1	763772095	LXCRWEHJASKKTB-UHFFFAOYSA-N	447.469	1.829	50	20	IDGD	
COC(=O)[C@@H](C)Cc1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)cc1	763812013	ASOXDKKKQTZJPA-AWEZNQCLSA-N	438.440	1.075	50	20	IDGD	
CNC(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)c1	763842221	XJHNQKMNIIZECD-ZDUSSCGKSA-N	446.891	1.870	50	20	IDGD	
CCc1noc(-c2cc(Cl)ccc2NC(=O)C(=O)NNC(=O)Cn2nc(C)cc2C)n1	763884165	BLFMVKVNZNQRCF-UHFFFAOYSA-N	445.867	1.552	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)Cc2ccc(Cl)cc2)cccc1N1CCOC1=O	763933118	XNOFAIBOLLZMFA-UHFFFAOYSA-N	430.848	1.934	50	20	IDGD	
CSCc1ccc(NC(=O)C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc1	763943262	AYXABPYNSZHNCA-UHFFFAOYSA-N	425.470	1.841	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)C(=O)Nc1ccc(-c2cc[nH]n2)cc1	763949033	MGAVHFDNEPFZPK-UHFFFAOYSA-N	431.412	1.368	50	20	IDGD	
Cc1nnnn1-c1cccc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCCCC3)c1	763961533	HBKHCAFIUVDPDO-UHFFFAOYSA-N	439.501	1.701	50	20	IDGD	
O=C(NNC(=O)c1ccc[nH]1)C(=O)Nc1cc(C(F)(F)F)ccc1N1CCOCC1	763980316	QBCYHDIDVJNITM-UHFFFAOYSA-N	425.367	1.270	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(Cl)c(Cl)c2)c1	764077695	MBNGYHJECWCKME-UHFFFAOYSA-N	430.269	1.797	50	20	IDGD	
CC[C@@H](C)C(=O)NNC(=O)C(=O)Nc1ccccc1S(=O)(=O)N(C)C1CCCCC1	764084802	WKLWZPIGMHQKAL-CQSZACIVSA-N	438.550	1.772	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(C(=O)NCc3ccccn3)c2)c(O)c1	764105553	ULNBMSZTMISQJX-UHFFFAOYSA-N	447.451	1.425	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccc(Oc2ccc(C)nn2)cc1	764133066	STBDUOCTMXPGND-UHFFFAOYSA-N	435.440	1.915	50	20	IDGD	
CC(C)(C)CC(=O)NNC(=O)C(=O)N1C[C@H](C(=O)N2CCCCC2)Oc2ccccc21	764198592	HSFNRYJANHCRRY-QGZVFWFLSA-N	430.505	1.377	50	20	IDGD	
COC(=O)c1cc(Br)c(F)cc1NC(=O)C(=O)NNC(=O)CCC(C)C	764202407	CDJZDAQEYDZJSC-UHFFFAOYSA-N	432.246	1.897	50	20	IDGD	
CCc1nc2cc(NC(=O)C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)ccc2o1	764203522	MPDSFILTPGQYEI-UHFFFAOYSA-N	433.465	1.781	50	20	IDGD	
O=C(CCC1CCCCC1)NNC(=O)C(=O)Nc1ncn(CC(=O)N2CCCCCC2)n1	764214692	BNNHDSNMOHESGY-UHFFFAOYSA-N	447.540	1.127	50	20	IDGD	
COc1ccccc1NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)Cc2ccccn2)cc1	764264986	WQHOVBXVWRNTOE-UHFFFAOYSA-N	447.451	1.671	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2O)c(OCC(F)(F)F)c1	764276065	YEKKKNAHTHIMBX-UHFFFAOYSA-N	441.362	1.807	50	20	IDGD	
CCCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2cc3ccccc3o2)cc1	764330502	AMBLYQKRFPZVGQ-UHFFFAOYSA-N	444.469	1.984	50	20	IDGD	
Cn1ncc2c(O)nc(CCC(=O)NNc3c(F)cc(C(=O)NC4CC4)cc3F)nc21	764332054	BOVJLNQUUOYMSZ-UHFFFAOYSA-N	431.403	1.315	50	20	IDGD	
CCc1ccc(NC(=O)C(=O)NNC(=O)CCCc2cccs2)cc1S(N)(=O)=O	764339557	NYIQVRJJVHNKII-UHFFFAOYSA-N	438.531	1.067	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2ccc3ccn(C)c3c2)n[nH]1	764376573	FRBPXNLQHMDWGU-UHFFFAOYSA-N	432.440	1.977	50	20	IDGD	
Cc1nnc(-c2ccc(NC(=O)C(=O)NNC(=O)CSc3ccccc3O)cc2)o1	764404788	NXPSPSSOMDCLLN-UHFFFAOYSA-N	427.442	1.629	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNS(=O)(=O)c3ccc(F)c(C)c3)CC2)cc1	765128483	VXOPXOYESLFUHT-UHFFFAOYSA-N	434.537	1.570	50	20	IDGD	
CCS(=O)(=O)N1CCC(C(=O)NNC(=O)c2cc(-c3cc(C)ccc3C)[nH]n2)CC1	765581668	QNTXNLAMZVCAAO-UHFFFAOYSA-N	433.534	1.516	50	20	IDGD	
CC(C)OC(=O)CCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	765904660	ATGRWINBYMETSL-UHFFFAOYSA-N	440.522	1.147	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H]2C[C@H]2c2cc(F)c(F)c(F)c2)c1	766631483	MJLYEPQYRRVXIV-KBPBESRZSA-N	441.431	1.919	50	20	IDGD	
CC(C)c1cc(C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)nn1C	766667669	BRAFPALQXYYLCL-UHFFFAOYSA-N	432.956	1.776	50	20	IDGD	
COc1ccc(S(=O)(=O)C[C@H](C)C(=O)NNc2ccccc2S(C)(=O)=O)cc1	766670968	XSHWRPVLXGVKNG-ZDUSSCGKSA-N	426.516	1.652	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCC[C@@H]1C[C@@H](O)c1cnn(C)c1	766945451	KNDGPDGJPLJVKS-NVXWUHKLSA-N	435.912	1.431	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)c2ccccc2S(=O)(=O)CCN(C)C)c1	767192043	RACUQUWAAJUQBU-UHFFFAOYSA-N	433.530	1.479	50	20	IDGD	
CCCCCn1cc(CNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c(C)n1	767212583	IFDSJVXKKSOAAU-UHFFFAOYSA-N	428.541	1.919	50	20	IDGD	
CS(=O)(=O)N1CCN(c2ccc(NC(=O)NNc3cccc([N+](=O)[O-])c3)cn2)CC1	770027314	NAGKLQAFGLFVHO-UHFFFAOYSA-N	435.466	1.220	50	20	IDGD	
CSCCNC(=S)NNC(=O)C1(NS(=O)(=O)c2cccc(F)c2)CCCCC1	770239076	FLOCDIPGSVOERI-UHFFFAOYSA-N	448.611	1.665	50	20	IDGD	
CCN1CCN(C[C@@H](C)CNC(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)CC1	770531820	BCOVRAXJSHGDFX-HOTGVXAUSA-N	425.961	1.711	50	20	IDGD	
O=C(NNS(=O)(=O)CCC1CC1)c1nn(Cc2ccccc2)c(=O)c2ccccc12	770636923	XFAJKCFPSWLFNG-UHFFFAOYSA-N	426.498	1.809	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)CN3C(=O)CCOc4ccccc43)nc21	770958863	QOQFFAQWEBPTCG-UHFFFAOYSA-N	425.449	1.546	50	20	IDGD	
CC[C@@H](C)[C@H](NC(=O)N1CCCC1)C(=O)NNc1nc(O)c2cnn(C(C)(C)C)c2n1	770966822	TXPILZDNNALJPY-OCCSQVGLSA-N	432.529	1.950	50	20	IDGD	
O=C(CN1CCC[C@H](c2nnc3n2CCCCC3)C1)NNC(=O)c1cccc([N+](=O)[O-])c1	771791789	UADXTBYSLFVHFG-INIZCTEOSA-N	441.492	1.553	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)c1cc2ccccc2cc1NS(C)(=O)=O	771912340	HDLRKXYHLKSGGW-ZDUSSCGKSA-N	435.502	1.950	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)CSc1nnc(-c2cccs2)n1C	772075301	KNUMJVDOAZQOAX-LLVKDONJSA-N	425.536	1.761	50	20	IDGD	
O=C(Cc1ccnc(O)c1Br)NNc1ccc(S(=O)(=O)NC2CC2)cc1	772179526	UJWVIHNMRKHVNY-UHFFFAOYSA-N	441.307	1.676	50	20	IDGD	
O=C(CCCc1nc(O)c2ccccc2n1)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772195725	FZJVUKMHWNTKGR-UHFFFAOYSA-N	441.875	1.775	50	20	IDGD	
COc1ccc(Cl)cc1NCC(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772892811	TUCYINKPPQXRHD-UHFFFAOYSA-N	425.272	1.878	50	20	IDGD	
Cc1nc2nc(N)nn2c(C)c1CCC(=O)NNC(=O)[C@H](C)Oc1cccc(Cl)c1	772967652	PDKZNPOSXFMSJM-LBPRGKRZSA-N	431.884	1.524	50	20	IDGD	
Cc1nc2ccccc2n1CCC(=O)N1CCN(S(=O)(=O)CBr)CC1	773610571	DWRDZPVOKRAOHV-UHFFFAOYSA-N	429.340	1.561	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)cnn1C1CCCC1	773641456	XFUCMIMGQBRSBR-UHFFFAOYSA-N	449.537	1.470	50	20	IDGD	
CN1CCN(C(=O)c2ccc(NC(=O)C(=O)NNc3ccccc3[N+](=O)[O-])cc2)CC1	773655955	WIDFXTOBZOZTOV-UHFFFAOYSA-N	426.433	1.064	50	20	IDGD	
CON(C)S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2cccc(Cl)c2C)cc1	773766760	TXLWJZDMKSJSKZ-UHFFFAOYSA-N	426.882	1.912	50	20	IDGD	
CCCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(C)c(F)c2)cc1	773887353	AJZAEJHTZIWFPD-UHFFFAOYSA-N	436.465	1.686	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1Cl)N[C@@H]1CCO[C@@]2(CCS(=O)(=O)C2)C1	776077049	PWZDHPJFZHLZQZ-BZNIZROVSA-N	436.317	1.674	50	20	IDGD	
NS(=O)(=O)c1cccc(N2C[C@@H](C(=O)NNc3ccc4ccccc4n3)CC2=O)c1	777465706	YPCCWLBBXCXMME-AWEZNQCLSA-N	425.470	1.378	50	20	IDGD	
CC(=O)c1ccc(OCCCC(=O)N2CCN(S(=O)(=O)CBr)CC2)cc1	777779226	GDDRUECVROHYPN-UHFFFAOYSA-N	447.351	1.875	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)CCNS(=O)(=O)/C=C/c2ccccc2)nc1C	778422991	XYWIROJIXUGAMS-ZRDIBKRKSA-N	433.490	1.385	50	20	IDGD	
CS(=O)(=O)NCc1ccc(NC(=O)C(=O)NNc2ccccc2OC(F)(F)F)cc1	778804426	WXWDGRAWIWWNCI-UHFFFAOYSA-N	446.407	1.716	50	20	IDGD	
Nc1nc(Cl)cc(NNC(=O)CCc2ccc(S(=O)(=O)N3CCCCC3)cc2)n1	779373113	AAEMJZUZIBZRMQ-UHFFFAOYSA-N	438.941	1.963	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2cnc(-c3ccccc3)nc2)cc(OC)c1OC	780364983	HXCKMACZSDBQIC-UHFFFAOYSA-N	444.469	1.793	50	20	IDGD	
CCOc1ccc(C(=O)NNS(=O)(=O)c2cc(F)cc(C(=O)OC)c2)cc1OC	782249149	JAIRDRSNXBCYOV-UHFFFAOYSA-N	426.422	1.643	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(NC(=O)C(=O)NNc2cc(C)nc(C)n2)ccc1C	783324867	DMIOKUDEOSTCQG-UHFFFAOYSA-N	434.522	1.514	50	20	IDGD	
Cc1c(NNC(=O)C(=O)Nc2cccc(CN3C(=O)CNC3=O)c2)cccc1[N+](=O)[O-]	784358551	WSZDIAFULUXVPT-UHFFFAOYSA-N	426.389	1.037	50	20	IDGD	
Cc1cccc(NC(=O)C(=O)NNc2cccc(S(C)(=O)=O)c2)c1C(=O)N1CCCC1	784841618	MTDMOHGZQBWYSD-UHFFFAOYSA-N	444.513	1.716	50	20	IDGD	
CCN1CCN(Cc2ccc(NC(=O)C(=O)NNc3cccc(C(=O)OC)c3)cc2)CC1	784851132	GGVNFPOHNUDWOT-UHFFFAOYSA-N	439.516	1.693	50	20	IDGD	
CCN(CC)CCNC(=O)c1cccc(NC(=O)C(=O)NNc2ccc(Cl)nc2)c1	784870280	LDYSLJCWBZZDRW-UHFFFAOYSA-N	432.912	1.888	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1cncc(Br)c1	785331129	PCAHTWRWEQMHPP-UHFFFAOYSA-N	443.279	1.338	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NCc2nc(-c3cccc(F)c3)no2)cc1	787404169	NZYVXKQXHXPBRM-UHFFFAOYSA-N	448.436	1.815	50	20	IDGD	
CN1CCC(n2ccc(NC(=O)C(=O)NNC(=O)Cc3cccc4ccccc34)n2)CC1	787542553	ALOPJKVQNCXKPB-UHFFFAOYSA-N	434.500	1.632	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(CC(=O)NNc2nnc(-c3ccccn3)s2)C(=O)C1	788559331	ZLCGCQQYZIFTIF-UHFFFAOYSA-N	433.494	1.123	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cn(C)nc2OC)ccc1OCCC(C)C	789584061	CEHADEPGBKOGLG-UHFFFAOYSA-N	433.465	1.262	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc(-n2cccn2)c1	791970861	XGJAWYMMKAMSRE-UHFFFAOYSA-N	433.428	1.594	50	20	IDGD	
CCOC(=O)c1csc([C@H]2CCCN2CC(=O)NNC(=O)c2ccc(C#N)cc2)n1	792470899	MQCYZTSOQVZSAD-MRXNPFEDSA-N	427.486	1.790	50	20	IDGD	
COC(=O)NNC(=O)c1cc(O)nc2ccc(S(=O)(=O)Nc3ccc(F)cc3)cc12	792609087	DPCKPOPDZHHQSQ-UHFFFAOYSA-N	434.405	1.881	50	20	IDGD	
CC(C)(O)[C@@H](Oc1ccccc1)C(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	795763552	LOWGBHWKPFZMAM-KRWDZBQOSA-N	431.401	1.118	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)Nc2ccc(F)c(S(=O)(=O)N3CCOCC3)c2)n1	797616756	SGZQYVXJENMSPX-UHFFFAOYSA-N	437.453	1.017	50	20	IDGD	
Cc1ccc(-n2cnnc2)c(C(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)c1	797985006	KZXYVWYMEYYJEQ-UHFFFAOYSA-N	443.508	1.825	50	20	IDGD	
Cc1nc2ccccc2c(C)c1CC(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	798694084	BJPIWRFZEILJRH-NRFANRHFSA-N	449.463	1.925	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNC(=O)C(=O)Nc1ccc(F)c(C2CC2)c1	799263426	OOTQMWXZJBWXAL-UHFFFAOYSA-N	428.420	1.715	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)NNc2cc([N+](=O)[O-])ccc2Br)c(C)o1	800620648	YAUQWTIDUOPFRO-UHFFFAOYSA-N	433.240	1.924	50	20	IDGD	
O=C(NNC(=O)c1ccc(N2C(=O)CCC2=O)c([N+](=O)[O-])c1)Nc1cc(F)cc(F)c1	802000329	MIVJYOYZZLYHJS-UHFFFAOYSA-N	433.327	1.993	50	20	IDGD	
CN(CC(=O)NNC(=O)Nc1ccc2c(c1)OCO2)C(=O)c1ccc(Br)o1	802104590	GOFPCRBTLNFMGI-UHFFFAOYSA-N	439.222	1.696	50	20	IDGD	
CC(C)(C(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)c1cc(F)cc(C#N)c1	803925399	ZOCZDPAKFJPMFZ-UHFFFAOYSA-N	428.376	1.888	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)NC[C@@H](N1CCOCC1)C(F)(F)F	805369484	YKPPQWRUXQHSEQ-BXUZGUMPSA-N	438.834	1.701	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)[C@H]2CCC(=O)c3ccccc32)CC1	806872644	MCYXBLOBNZGVHV-KRWDZBQOSA-N	443.529	1.221	50	20	IDGD	
COC(=O)c1scc(-c2ccc(C)cc2)c1NC(=O)C(=O)NNC(=O)[C@H]1COCCO1	806980399	OWQWJNKYLGMABX-CQSZACIVSA-N	447.469	1.011	50	20	IDGD	
CNC(=O)c1cccc(NC(=O)C(=O)NNc2cccnc2Cl)c1Br	807013461	SVUGUGPLZVWXCB-UHFFFAOYSA-N	426.658	1.939	50	20	IDGD	
CC(C)c1nccnc1NNC(=O)C(=O)N1C[C@@H](C[C@@H]2COCC(=O)N2)c2ccccc21	807065068	CNBVNFXGPTUZNJ-HUUCEWRRSA-N	438.488	1.079	50	20	IDGD	
Cc1sc2nc(CC(=O)NN=Cc3ccc(F)c(S(N)(=O)=O)c3)nc(O)c2c1C	807951649	CUUWKOJLNYOKCI-UHFFFAOYSA-N	437.478	1.493	50	20	IDGD	
O=C(Cn1c(-c2ccc(F)c(Cl)c2)noc1=O)NNC(=O)c1cccc([N+](=O)[O-])c1	809963971	AZHCFLBGLNWEFZ-UHFFFAOYSA-N	435.755	1.665	50	20	IDGD	
C[C@H](NCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)c1ccc(N2CCCNC2=O)cc1	812900806	MLKIZRYEQHTSRO-AWEZNQCLSA-N	440.460	1.626	50	20	IDGD	
CC(C)(C)c1n[nH]cc1C(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	815827120	MTYHKQDUDDBAIG-UHFFFAOYSA-N	432.956	1.939	50	20	IDGD	
Cn1ncc2c(O)nc(CCC(=O)NNC(=O)Cc3nc(-c4ccccc4)cs3)nc21	885399346	LWHOUOYEPCMFIL-UHFFFAOYSA-N	437.485	1.515	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)C2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)cc1	913156735	FYRAXJHXCIEREK-UHFFFAOYSA-N	444.557	1.964	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1ccc2c(O)nc(S)nc2c1	915046150	WNARAHFHFIQIEW-UHFFFAOYSA-N	446.514	1.300	50	20	IDGD	
O=C(NNC(=O)c1ccccc1S(=O)(=O)N1CCOCC1)c1ccc2ccccc2n1	915191042	WXQMAJSFMBBUQU-UHFFFAOYSA-N	440.481	1.331	50	20	IDGD	
COc1cc(C=NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc(OC)c1OC(C)=O	916305383	HDHIUBLYULWALC-UHFFFAOYSA-N	449.485	1.643	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCCCN2C[C@@H](C)C[C@H](C)C2)nc1	916460615	OEJHLJIGIJSDAW-HOTGVXAUSA-N	426.587	1.762	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)NCCN2CCN(c3ccccc3)CC2)cc1C	916514709	JZSHSQTWGVTRLX-UHFFFAOYSA-N	438.532	1.395	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(OCC2CCCCC2)cc1)[C@H]1CCS(=O)(=O)C1	917730515	BTCVNTKSPNQAHP-HNNXBMFYSA-N	430.548	1.390	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)c2ccc(F)c(S(=O)(=O)N(C)C)c2)cc1	918686091	SMBCGBAPZMJQJE-UHFFFAOYSA-N	425.507	1.938	50	20	IDGD	
CCN(CC)C(=O)c1ccc(S(=O)(=O)NNC(=O)c2nnc(-c3ccccc3)o2)cc1	920313884	NRFPFMCNGSQFRG-UHFFFAOYSA-N	443.485	1.842	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)c2cc(F)ccc2NS(C)(=O)=O)cc1	920421863	IUZNDBGLIITXLT-GFCCVEGCSA-N	439.465	1.824	50	20	IDGD	
O=C1COc2ccc(S(=O)(=O)NNC(=O)NCc3cccc(C(F)(F)F)c3)cc2N1	921298049	MCQZEKWAKLSJNN-UHFFFAOYSA-N	444.391	1.729	50	20	IDGD	
C[C@H](NC(=O)CCC(=O)C(C#N)=C1N(C)c2ccccc2N1C)C(=O)NCC(F)(F)F	1115887906	RWROSYJHOCRUPL-LBPRGKRZSA-N	437.422	1.840	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)CCc2ccc3c(c2)CCO3)cc1OC	1116247011	KKXFQCJZGLUCJX-UHFFFAOYSA-N	428.441	1.576	50	20	IDGD	
CN1/C(=C(/C#N)C(=O)CSc2nnc([C@@H]3CCS(=O)(=O)C3)n2C)Nc2ccccc21	1317716943	DBFCIRVJGAZSEU-XKORNODESA-N	444.542	1.675	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)CN(C)C(=O)OC(C)(C)C	1318409332	GENKPBTVFISFNC-CYBMUJFWSA-N	442.538	1.537	50	20	IDGD	
CC(C)C[C@@H](C(=O)NNC(=O)c1cncn1-c1ccccc1)N1C(=O)[C@H]2CC=CC[C@H]2C1=O	1321490781	ALZWAPZQAVJALS-OTWHNJEPSA-N	449.511	1.999	50	20	IDGD	
C#CCCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C1	1778095085	SKFKFZRHSCZNJS-UPRBLEQPSA-N	427.505	1.048	50	20	IDGD	
Cc1scc(C(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1C	1779031207	NOHPSSSIAFCQOC-NRFANRHFSA-N	443.529	1.121	50	20	IDGD	
Cc1cccc(C)c1NC(=O)C(=O)N1CCO[C@@]2(CCN(C(=O)CO[Si](C)(C)C)C2)C1	1779299841	GVCQBELYGOPEBA-JOCHJYFZSA-N	447.608	1.923	50	20	IDGD	
O=C(CS[C@@H]1CCCCO1)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2	1779403811	MEFIMLBFGXWZGW-BUIAKZPTSA-N	434.986	1.360	50	20	IDGD	
O=C(c1ccc([N+](=O)[O-])c2c1OCO2)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Cl)CCO2	1780235075	NFLRPMPXMLIWAL-WMLDXEAASA-N	429.788	1.301	50	20	IDGD	
Cc1cnn(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@](C)(Cl)CCl)C2)c1	1780713006	JPORWYNSMBRQAP-ATZDWAIDSA-N	431.364	1.942	50	20	IDGD	
CCCOc1ccc(C(=O)N2CC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)cc1	1780839071	LFOCATKLSARXMM-QHCPKHFHSA-N	446.548	1.292	50	20	IDGD	
CN1CCCn2nc(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)[C@H](F)Cl)C4)cc2C1	1781428861	PHIUMHWZLMMOCD-FUHIMQAGSA-N	441.935	1.381	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C2(F)CC2)C1	1781615635	XKNXNIFAPKTVCL-JPMRSZNZSA-N	433.484	1.136	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](Br)CC)C1	1781901322	KUXIHDQDDDNLSS-DEXNDLTESA-N	444.370	1.365	50	20	IDGD	
Cc1nn(C)c(C)c1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)Br)C1	1781997065	ARRIYVBXYFSUBW-KPAZRMRSSA-N	441.370	1.948	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3c4c(nn3C)CCC4)C2)C1	1782434318	HAKUGICWCIMUFQ-DJJJIMSYSA-N	439.354	1.383	50	20	IDGD	
Cn1nc2c(c1C(=O)N1CC[C@@]3(C1)CN(C(=O)[C@H](F)Br)CCO3)CCC2	1782439780	MCFYGRUJJXYOLY-WMLDXEAASA-N	429.290	1.043	50	20	IDGD	
C/C=C(\C)C(=O)N1CC[C@@]2(CN(C(=O)CN(C)NC(=O)NCc3ccccc3)CCO2)C1	1783071673	PDUSJRLAENTNNC-PKSGZFLJSA-N	443.548	1.129	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](CN)c1ccccc1)CCO2	1783341064	BDISGQQJTUTVAY-ABSDTBQOSA-N	438.366	1.732	50	20	IDGD	
CCSc1ncccc1C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](Cl)COC)C2)C1	1783869065	NKYHBMYLGBPLMS-BEFAXECRSA-N	427.954	1.891	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](C)S)C2)C1	1783899856	WUCYCXJNTZEQPD-BUXKBTBVSA-N	437.474	1.282	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)Br)C[C@@H]21	1783974558	QAZBRSYOZSFPFJ-BNDIWNMDSA-N	440.176	1.781	50	20	IDGD	
CC(C)(C)n1ncc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]3C2)c1Cl	1784086457	MEULAMZZSLMYQB-MHEUCROKSA-N	447.363	1.485	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccccc3C(F)(F)F)C[C@@H]21)[C@@H](O)CCl	1784090100	RANQQMFPTWBAPG-OTRWWLKZSA-N	448.869	1.827	50	20	IDGD	
C=CC[C@H](NC(=O)OC(C)(C)C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21	1784786012	QFTKDSIYWOSKEP-QXKUPLGCSA-N	447.935	1.970	50	20	IDGD	
CN(CCCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Cl)CCO2)C(=O)OC(C)(C)C	1785585362	BMVXCSLTXOQWCB-HNAYVOBHSA-N	435.924	1.998	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC1(c2ccc(NC(=O)c3cnccn3)cc2)CCC1	1787289086	ORTXOQLEIVTLLM-UHFFFAOYSA-N	431.456	1.537	50	20	IDGD	
COC(=O)c1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)C(C)(C)CCl)C[C@@H]32)cn1	1787604140	ZDERWNGKCYRUBA-ZOBUZTSGSA-N	437.924	1.727	50	20	IDGD	
C[C@@H](C(=O)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1)n1ccnc1	1788145284	WLGIKPVESBJTTO-INIZCTEOSA-N	432.289	1.572	50	20	IDGD	
Cc1cnn([C@@H](C)C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]3C2)c1	1789872487	GICACCYMNHNKMK-SIBFUHKCSA-N	431.364	1.969	50	20	IDGD	
CCOC(=O)C1(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]3C2)CC1	1789872673	YGMGVKBONMTXMU-NUXNZHGMSA-N	435.348	1.546	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)c1ccc2sccc2c1O	1790441813	UBAOVYVMHAZGDY-DDWPSWQVSA-N	438.933	1.800	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1ccc(C2(NC(=O)C[C@@](C)(O)CC(=O)O)CCC2)cc1	1791602554	MTMSSVIEWHOYEH-OAQYLSRUSA-N	448.520	1.109	50	20	IDGD	
Cc1nccn1[C@@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)Br)C[C@@H]21	1791707138	AFQQIJVIBJGICE-MLEONAHRSA-N	427.343	1.516	50	20	IDGD	
O=C(CCOc1ccc(F)cc1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2	1792731203	INVIBMMDWFDAMA-HBCWATKFSA-N	443.313	1.969	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)Cc1ccccn1)C2	1792872146	NVTDLUGVROQCSB-RIUYPTKQSA-N	438.366	1.881	50	20	IDGD	
O=C(CCc1cnccc1C(F)(F)F)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2	1793970387	VJCDVFYJFWTLIM-IARIHHJXSA-N	449.857	1.222	50	20	IDGD	
CCC[C@H]1CC[C@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2ccc(B(O)O)cc2)CC1	1795736643	AWNGGYXEQXPJPV-BUUIKWLOSA-N	442.365	1.176	50	20	IDGD	
Cc1ccc(S(=O)(=O)CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](O)CCl)C3)cc1	1795746746	LVNFWYSBAFNJFW-IVSAIRAKSA-N	428.938	1.007	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(-c2ccco2)no1)c1cccc(B(O)O)c1	1796591308	XURZGBMYICQQMV-BJWYYQGGSA-N	435.245	1.180	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccn2c(O)nnc12	1796725526	DSOAFDYRDVJSJU-DBYGNECLSA-N	426.304	1.923	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1ccc2cnccc2n1	1796893332	BUPXJKCXOWVBKO-NOXHYTERSA-N	437.269	1.524	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C=N/O[C@@H]1CCCCO1	1797815262	LXDPIBNXXGHCJR-JGNDYJHSSA-N	436.336	1.341	50	20	IDGD	
CC(=O)N[C@@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2)c1ccc(F)cc1	1799057327	JEAUGPCICSGKFG-OCVGTWLNSA-N	446.306	1.396	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccc(OC)cc1[N+](=O)[O-]	1799403988	OBWUOPHLOQMSHV-MVWRLGRASA-N	439.896	1.753	50	20	IDGD	
COc1ccc(C)c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCBr)C3)c1	1799635708	ZMJZERWJOYLNOZ-ZSBFGKGUSA-N	425.323	1.992	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2nn(C)cc2c1	1799910672	QPIMRHNWGXCUSS-GMLZMKKNSA-N	449.349	1.808	50	20	IDGD	
C/C=C(/C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1800468004	WESIMJPHULHPCR-RITUNRGESA-N	429.945	1.674	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc3c[nH]nc13)C2	1800640097	UYZOPJXJPDPPCI-OCVGTWLNSA-N	435.322	1.940	50	20	IDGD	
O=C(Cc1cccc(F)c1F)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2	1800664086	BPGOYEFDQOVJOT-IVWMJMPLSA-N	431.277	1.882	50	20	IDGD	
Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCC(=O)NN(C)C)C2	1800698742	CWJPXTLTFMFJCS-QDMKHBRRSA-N	449.483	1.667	50	20	IDGD	
COc1cncc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)Br)c1	1800756771	IJWPKPNUPOBKTF-LJGDNWOOSA-N	440.338	1.396	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnnc3ccccc13)C2	1800757697	OTAZYUJAROHWGS-JRATXPSKSA-N	433.306	1.616	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ncc(Cl)cc1Cl)C2	1800974231	ROBVAJOLQZJBNT-DJBIQUGXSA-N	436.723	1.845	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](N)c1cccc(Cl)c1)C2	1800975948	YSVLZUOIKMPGOB-IMPMIVQMSA-N	430.332	1.183	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cn3ccc(Cl)cc3n1)C2	1800977678	COBIJMDRNWHYKW-DMVWFOPNSA-N	441.315	1.445	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)COc1ccccc1C#N	1801991893	GJPCFCDJZXQQFW-UPHUGPLXSA-N	431.565	1.378	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCCNC(=O)OC(C)(C)C	1802122406	NLHHZRDHSMBHDE-IVSAIRAKSA-N	431.961	1.898	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)CN2CCN(C)CC2)[C@H]1c1cccnc1	1803692960	BETQONGQXILHSJ-ZJOUEHCJSA-N	436.000	1.742	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2coc(Cl)n2)[C@H]1c1cccnc1	1805020881	CHSARNORKYWYJM-RDTXWAMCSA-N	448.911	1.416	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2ccsc2)[C@@H]1c1cccnc1	1805424832	KVPWMBUGFCXJBT-JXFKEZNVSA-N	429.546	1.836	50	20	IDGD	
Cc1ncccc1C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1805494332	BPUSFUXNTSIIAP-KNQAVFIVSA-N	444.300	1.098	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)N1CC[C@H](CNC(=O)CCBr)[C@H]1c1cccnc1	1806340668	JJOHRXDZJUDKIW-MZMPZRCHSA-N	439.354	1.739	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)CCC#N)[C@@H]1c1cccnc1	1806863955	UPJYOULTRXQZFF-PWCMAEROSA-N	435.488	1.525	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)c2cccc(F)c2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1	1807375265	NOVUSCBNDLKMFX-KNQAVFIVSA-N	447.275	1.534	50	20	IDGD	
C=CCOCCCC(=O)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1	1809977282	DIUOPYNRWWSHJF-UHFFFAOYSA-N	428.338	1.194	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)c3cc4ccccn4n3)CC2)C1	1809977749	FVLHQZWKDXQWKV-UHFFFAOYSA-N	446.316	1.173	50	20	IDGD	
C[C@H](C(=O)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@H]1c1cccnc1)n1ccnn1	1812398997	ZTYXZONQEAPSSB-UNQGMJICSA-N	439.289	1.631	50	20	IDGD	
C=CCNC(=O)/C=C\C(=O)N1CC[C@H](CNC(=O)[C@H](Cl)COC)[C@@H]1c1cccnc1	1813028137	LMFYYIUGWRWCHU-MOWHTXJNSA-N	434.924	1.200	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2ccccc2F)[C@@H]1c1cccnc1	1813072679	IYAPYGKDDPSNPA-VGOFRKELSA-N	441.507	1.913	50	20	IDGD	
C[C@H](CBr)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CNC(=O)N(C)C)[nH]n1	1814776155	JLHKZETYMHRWFE-DGCLKSJQSA-N	443.346	1.704	50	20	IDGD	
C[C@@H](Cn1cccn1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1	1816017346	KWZBHEYZTRUBNE-DOTOQJQBSA-N	444.540	1.308	50	20	IDGD	
Cc1cc(/C=C/C(=O)Nc2cc([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)no1	1819473651	CWFLVOHLUZFSRU-OZSKJFCKSA-N	443.508	1.785	50	20	IDGD	
O=C(C#CC1(O)CCCCC1)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)CCl)CC2	1819841871	SOZZTWVHPYIKMF-OCCSQVGLSA-N	425.938	1.353	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)c3cccc(F)n3)sc2C1	1820449449	HFSLVFMLDYLXSM-LLVKDONJSA-N	434.497	1.276	50	20	IDGD	
Cc1nccnc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1	1822415430	ZPOBHEAAHSFUPH-OAHLLOKOSA-N	428.497	1.187	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CNC(=O)C(F)(F)F)n[nH]1	1822444184	KVIHDLUVPXLKHN-GXSJLCMTSA-N	439.822	1.334	50	20	IDGD	
O=C(CC12CCCN1CCC2)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](O)CCl)CC2	1822749548	ZEVPEQUILBBOPF-JSGCOSHPSA-N	426.970	1.673	50	20	IDGD	
O=C(CC[C@@H]1CCOC1)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1823028495	NAXJPBYMEBRWMV-DNVCBOLYSA-N	440.309	1.212	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)CN2CCCC2)CC1	1823797937	BFTVWRSKCAVQMV-HXUWFJFHSA-N	442.564	1.014	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)/C=C/c1cccnc1)CC2	1826080438	KSACHRHUOGVNIZ-PXTSUWAFSA-N	442.545	1.537	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](N)CCC(N)=O)CC1	1826817965	PLXDYRVTONATQU-BPUTZDHNSA-N	445.402	1.230	50	20	IDGD	
COC[C@@H](NC(C)=O)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CO[Si](C)(C)C)CC1	1829116500	SAQANFGKWYRWGA-MOPGFXCFSA-N	441.645	1.609	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3nsnc3NC)CCO2)C1	1829748671	CYWXGIQXQBAHEW-YVEFUNNKSA-N	431.946	1.057	50	20	IDGD	
C[C@H](Nc1ccccn1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830364295	FIYFKOPPRSFSNR-HRAATJIYSA-N	438.956	1.603	50	20	IDGD	
Cc1cnn([C@@H](C)C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)c1	1830370316	QAARBOPFVIJODV-OXJNMPFZSA-N	426.945	1.474	50	20	IDGD	
O=C1CC[C@H](C(=O)N2CCC([C@@H]3CCCCN3C(=O)[C@@H](F)Br)CC2)CN1	1830379219	QFBPVFGAWNMDED-OFQRWUPVSA-N	432.334	1.823	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)CC3CCOCC3)C2)C1	1830537830	PZVMETDUBISBBF-KXBFYZLASA-N	447.370	1.291	50	20	IDGD	
CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H](F)Cl)CC1	1832139341	WLSBMIRXCBFIKT-FGTMMUONSA-N	441.935	1.611	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3cnccc3C)CCO2)C1	1833015209	OACGZYOTFJWWNP-WIYYLYMNSA-N	439.940	1.033	50	20	IDGD	
C[C@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)c3cc(O)n[nH]3)CC2)CC1	1833263427	LDOVLKMFKOAQQO-GFCCVEGCSA-N	442.358	1.332	50	20	IDGD	
Cc1cccn2ncc(C(=O)N3CCC(N4CCC(NC(=O)[C@@H](O)CCl)CC4)CC3)c12	1833312592	ZCVSEUUMJNBSQK-IBGZPJMESA-N	447.967	1.428	50	20	IDGD	
Cc1nscc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1	1833746871	GHXXRAAGGXKEAF-DLBZAZTESA-N	436.361	1.758	50	20	IDGD	
Cn1ccc(CC(=O)NC2CCN(C3CCN(C(=O)CCBr)CC3)CC2)n1	1834846582	YQLVOEYSJIXPHF-UHFFFAOYSA-N	440.386	1.319	50	20	IDGD	
COCCn1nccc1C(=O)N1CCC(N2CCC(NC(=O)[C@@H](F)Cl)CC2)CC1	1835079818	UJNBMURBHVALHA-QGZVFWFLSA-N	429.924	1.249	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)C1(F)CCCCC1)CCO2	1836617731	UOFRDUPZHHUWAY-LJQANCHMSA-N	430.593	1.967	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccn4cncc4c3)CCO2)C1	1837074120	UPTPUNNICOIKTO-NQIIRXRSSA-N	434.924	1.812	50	20	IDGD	
Cn1ncnc1C(=O)N1CCC(OC2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1837371587	JMVRLTFYUUAILH-CYBMUJFWSA-N	432.294	1.118	50	20	IDGD	
CCn1nc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCBr)C3)C2)cc1C	1838147769	JPRHGYBQPYIHCI-GOSISDBHSA-N	443.342	1.066	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)cc1O	1839267238	OVIWAVRFILJFQD-MAUKXSAKSA-N	445.285	1.461	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)ccc1F	1839321829	WQKICTWMPXYMIK-LIRRHRJNSA-N	443.313	1.988	50	20	IDGD	
Cc1ccn(C)c1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2	1840034154	BRLXSFUOBWMWSV-RDTXWAMCSA-N	428.327	1.187	50	20	IDGD	
Cc1cc(F)cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)c1	1840034829	YKKMDHKHBZFSNO-AUUYWEPGSA-N	443.313	1.988	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(C)cc3F)C2)C1	1840155275	VVQCBJHUIWWXPW-JXFKEZNVSA-N	428.888	1.458	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(C(N)=O)cc3)CCO2)C1	1840645842	QHJYKEWERKSECK-NRFANRHFSA-N	437.924	1.121	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(C)cc3Cl)CCO2)C1	1840697389	VDMBUZVZLAJHTA-FXAWDEMLSA-N	445.343	1.972	50	20	IDGD	
O=C1CC[C@H](C(=O)N2CCCC23CN(C(=O)[C@@H](Br)Cc2ccccc2)C3)CN1	1841115051	YWRTUQABHPZCSO-IRXDYDNUSA-N	448.361	1.722	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)CCc2cnc[nH]2)C1	1842002649	DXTQUXXYDGPRBC-UHFFFAOYSA-N	441.444	1.693	50	20	IDGD	
Cc1cnc(Cl)c(C(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)c1	1842561117	LLVKQHSTLHARHK-UHFFFAOYSA-N	428.880	1.173	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC12CN(C(=O)C1(c3ccccc3)CCCC1)C2	1843010455	RRSNCSPUYAPGGT-UHFFFAOYSA-N	432.329	1.695	50	20	IDGD	
CN(CC(=O)N1CCCC12CN(C(=O)C1CC(C)(C)C1)C2)NC(=O)NCc1ccccc1	1845039483	SWALZSKLTAPEFG-UHFFFAOYSA-N	441.576	1.972	50	20	IDGD	
O=C(c1cc(=O)nc2sccn12)N1CC2(CCCN2C(=O)[C@H](F)Br)C1	1845218732	YMPOXPXBOAABEH-NSHDSACASA-N	429.271	1.264	50	20	IDGD	
COc1cc(CC(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc(OC)c1OC	12803063	PUOVVEIPOBOBHB-UHFFFAOYSA-N	436.490	1.009	50	20	IDGD	
CN(CC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)S(=O)(=O)c1ccc(Cl)cc1	17329803	IXKPGODPGVAMAQ-UHFFFAOYSA-N	426.838	1.330	50	20	IDGD	
COc1ccc(-c2nnc(S)n2CC(=O)NNC(=O)[C@H](C)Oc2ccccc2F)cc1	18055360	LNVFSOVFVFZIIH-LBPRGKRZSA-N	445.476	1.996	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CSc2nc3ccsc3c(=O)n2C)cc1OC	26102714	WTCSZACUUXKWSB-UHFFFAOYSA-N	434.499	1.566	50	20	IDGD	
CC(C)(C)NC(=S)NNC(=O)CCNS(=O)(=O)c1cccc(Br)c1	28716621	FYCDGZREQPGSBD-UHFFFAOYSA-N	437.385	1.411	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2cccc(Br)c2)c2c1CCCC2)C(=O)NC1CC1	71925134	SWMOVMVDRRQQPX-UHFFFAOYSA-N	446.305	1.553	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCCN(C(=O)OCC(C)C)CC2)cc1OC	110188206	VQBUTKVXVWDLGR-UHFFFAOYSA-N	436.509	1.265	50	20	IDGD	
CC(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1	117278208	FMVGNXVTTCHILM-UHFFFAOYSA-N	428.470	1.190	50	20	IDGD	
COc1ccccc1C=NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1	254288587	MMFQAAXXSGVZNU-UHFFFAOYSA-N	430.530	1.460	50	20	IDGD	
Cc1nc(C(=O)N([C@H]2CCS(=O)(=O)C2)N(C)C)nn1-c1c(Cl)cccc1Cl	728234689	RKPSTIGCTPVYNV-NSHDSACASA-N	432.333	1.988	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cccc(OC(F)F)c2)cc1S(=O)(=O)N(C)C	728488495	MTXOQBJZONBXQI-UHFFFAOYSA-N	443.428	1.622	50	20	IDGD	
NS(=O)(=O)c1ccc(CCC(=O)NNC(=O)c2cc(F)ccc2Br)cc1	728549732	OLIPMEMLMLAFHO-UHFFFAOYSA-N	444.282	1.629	50	20	IDGD	
CN(C(=O)CN1CCN(CC(=O)NNC(=O)c2cccc(Cl)c2)CC1)C1CCCCC1	728575062	MZZYWRNQOPHAAF-UHFFFAOYSA-N	449.983	1.510	50	20	IDGD	
C[C@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(C(=O)NNC(=O)Cc3cccnc3)cc2)C1	728852159	PLMHBWQNUZGJHI-IYBDPMFKSA-N	430.530	1.752	50	20	IDGD	
C[C@H]1CN(C(=O)c2ccc(CNC(=O)NNC(=O)c3cccc(C#N)c3)cc2)C[C@H](C)O1	728953616	SIJCSSLEFRZGMZ-HOTGVXAUSA-N	435.484	1.952	50	20	IDGD	
COc1cccc2c1OC[C@H](NC(=O)NNC(=O)C1CCN(c3ncccn3)CC1)C2	729051856	AAGYKSXDFBVAHJ-MRXNPFEDSA-N	426.477	1.036	50	20	IDGD	
O=C(CSc1ccc(Cl)cc1)NNC(=O)CSc1nnnn1CC(F)(F)F	729965667	ABTGLTTVYIYMQJ-UHFFFAOYSA-N	440.860	1.921	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)NC[C@H]2CCCN2C(=O)OC(C)(C)C)cc1C	730909867	QUZZINRTDVRLPQ-MRXNPFEDSA-N	433.509	1.972	50	20	IDGD	
CC1CCC(N2C[C@@H](C(=O)OCC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)CC2=O)CC1	731385524	NMXBRLKDMLOWSP-SIWZUTFBSA-N	446.460	1.326	50	20	IDGD	
COc1ccccc1CC(=O)N1CCC(NC(=O)NNC(=O)c2ccccc2OC)CC1	731544730	OULKUSOUGGGATL-UHFFFAOYSA-N	440.500	1.882	50	20	IDGD	
Cn1nc(SCC(=O)NN=C2CCSc3c(Cl)cccc32)c(=O)n(C)c1=O	731926275	UVWUIPYMVUIXLE-UHFFFAOYSA-N	425.923	1.241	50	20	IDGD	
O=C(NNC(=O)c1ccnc(C2CC2)n1)c1cccc(S(=O)(=O)N2CCCCC2)c1	732653944	QDZONLFYELMKSA-UHFFFAOYSA-N	429.502	1.603	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NCCN(C)CC(F)(F)F)c2ccccc2c1=O	732703985	NYWDKHXUEGQTLV-UHFFFAOYSA-N	442.442	1.635	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)C(=O)c1cnn(-c2ccccc2)c1	733774130	IWROHIDUMIXOEM-UHFFFAOYSA-N	440.485	1.118	50	20	IDGD	
CCN(CC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)C(=O)OC(C)(C)C	734313551	SABDZUZUVYFDGT-UHFFFAOYSA-N	433.553	1.603	50	20	IDGD	
COc1ccc([C@@H]2[C@@H](C(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)CCC(=O)N2C)cc1	734315076	GLJORRCKKILBHX-PKOBYXMFSA-N	426.429	1.974	50	20	IDGD	
CCOc1ccc(C(=O)NNS(=O)(=O)c2ccc3c(c2)N(C(C)=O)CC3)cc1OC	734419858	SJBXJFYUSHLZRI-UHFFFAOYSA-N	433.486	1.626	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)N[C@@H](C)CN2CCN(c3ccccn3)CC2)cc1C	735587107	RSNXIVSXLFHRHJ-IBGZPJMESA-N	440.548	1.618	50	20	IDGD	
CCc1cccc(CC)c1S(=O)(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	736063897	NPQHCHUGEUZSBH-UHFFFAOYSA-N	439.559	1.685	50	20	IDGD	
COc1ccc(OC)c(CN2CCN(C(=O)NNC(=O)COCc3ccccc3)CC2)c1	738495089	DIAWJLUNBCFTNO-UHFFFAOYSA-N	442.516	1.779	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)[C@@H]1CCCN(C(=O)CCOc2ccccc2)C1	740851920	BBKVGGIVIYTGAL-MRXNPFEDSA-N	432.521	1.146	50	20	IDGD	
CC[C@@H]1CCC[C@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)C1	741093029	JNBXPZMBXCGZBT-WBVHZDCISA-N	438.550	1.620	50	20	IDGD	
CN(C)Cc1cccc(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)c1	741283322	VLZMQLLSWIEMPX-UHFFFAOYSA-N	431.562	1.441	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)[C@H]3CCCCN3C(=O)c3ccc(O)nn3)cc2C1	741740462	AIKUIXDZBFJRKO-SWLSCSKDSA-N	443.529	1.824	50	20	IDGD	
O=C(CN1CCN(c2ccccn2)CC1)NNC(=O)c1ccc(F)cc1Br	743314323	QSHDWYVMMBRZGC-UHFFFAOYSA-N	436.285	1.566	50	20	IDGD	
O=C(NNc1ncnc2[nH]cnc12)[C@@H]1CCCN(C(=O)c2ccccc2OC(F)F)C1	743471071	PRLZJTMYBDIITG-LLVKDONJSA-N	431.403	1.950	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CN2CCC(C(=O)NCc3ccc(F)cc3)CC2)c1	744386479	FXHSBCBRJBZTBR-UHFFFAOYSA-N	426.492	1.924	50	20	IDGD	
CS[C@@H]1CC[C@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)C1	745896125	GRTXVEYZIDYZEA-LSDHHAIUSA-N	426.564	1.699	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)N[C@@H]1CC(=O)N([C@@H]2C[C@H]2c2ccccc2)C1	745915374	YOFYESKUEPPBGQ-CEXWTWQISA-N	433.468	1.424	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@H](C)C(=O)NNC(=O)CCN/C(O)=C1/N=CC=CC1=O	746098629	WJMZWYJXWYYVDN-PWLTZZKVSA-N	434.880	1.788	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)NCCNS(=O)(=O)c2cccnc2)c(Cl)c1	746325152	AWZORTAPELNYFS-UHFFFAOYSA-N	426.886	1.358	50	20	IDGD	
CC(C)NC(=O)CSc1ccccc1C(=O)NNC(=O)Cc1cn2ccccc2n1	746553199	HKBPUZWGOYPZTK-UHFFFAOYSA-N	425.514	1.955	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)CCc2nc(CSC)no2)c2ccccc2c1=O	746780566	GMNPYXNQASKVNR-UHFFFAOYSA-N	430.490	1.446	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)NC[C@H]3CCCO3)cc2)cc1	747175191	AFZUJYAGYBMWHC-QGZVFWFLSA-N	428.470	1.090	50	20	IDGD	
COc1ccc(Br)c(S(=O)(=O)NNC(=O)COCc2ccccc2)c1	747619217	VOEAFCMYKXAZGB-UHFFFAOYSA-N	429.292	1.984	50	20	IDGD	
CC(C)(C(N)=O)N1CCN(C(=O)/C(C#N)=C\c2cn(CCC#N)nc2-c2ccccc2)CC1	747922702	UHEUDKSXPVCEBR-CYVLTUHYSA-N	445.527	1.779	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)CNc3ccccc3[N+](=O)[O-])cc2)CC1	748620855	UJEQUUJWDMJCIN-UHFFFAOYSA-N	448.505	1.086	50	20	IDGD	
COC(=O)c1cc(OC)c(S(=O)(=O)NNC(=O)c2cccc(OC(F)F)c2)s1	749009938	CHFJXVHTTHXEEY-UHFFFAOYSA-N	436.414	1.768	50	20	IDGD	
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	749581709	BNELUMJIIQWAJF-OXQOHEQNSA-N	448.527	1.788	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)c2cccc(F)c2I)C[C@@H](C)O1	750530813	WGZBQIOLAGCAOP-GHMZBOCLSA-N	449.264	1.691	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)c1ccc(=O)n(-c2cccc(F)c2)c1	751360566	MAYHDHYMPIFZBM-UHFFFAOYSA-N	433.399	1.943	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)NNC(=S)Nc2ccc(N(C)C)cc2)ccc1F	752520964	GGUHUTYWDQYWCM-UHFFFAOYSA-N	425.511	1.431	50	20	IDGD	
CN1C(=O)N[C@]2(CCC[C@H]2CNC(=O)NNC(=O)CSc2ccc(Cl)cc2)C1=O	753024647	OQEVBTAOBFCVPD-VOJFVSQTSA-N	439.925	1.483	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@H](CCOC)Cc2ccco2)c2ccccc2c1=O	753279239	LGAQERQYZXWRFU-CQSZACIVSA-N	427.461	1.601	50	20	IDGD	
Cc1ccc(Cc2cnc(NC(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)s2)cc1Cl	755474063	BIYUDNBQEHDSEH-JTQLQIEISA-N	445.954	1.786	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)[C@H](C)Oc2ccccc2F)n([C@H]2CCS(=O)(=O)C2)n1	755538127	ZQYKNLFFSOAZSU-STQMWFEESA-N	439.469	1.310	50	20	IDGD	
CCc1c(C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)cnn1CC(C)C	756773173	SOMCDBKNAMDJCU-UHFFFAOYSA-N	449.581	1.190	50	20	IDGD	
O=C(Cn1cc(NC(=O)NNC(=O)c2cc(Br)ccc2O)cn1)NC1CC1	756795747	LQIUHUWUGRYDDV-UHFFFAOYSA-N	437.254	1.096	50	20	IDGD	
CC(CC1CCOCC1)=NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	757561546	SGBIOHYVRMNPFI-UHFFFAOYSA-N	437.562	1.949	50	20	IDGD	
Cc1c(C(=O)N2CCN(S(=O)(=O)CBr)CC2)c(=O)oc2ccccc12	758522943	LSLZPPLXDVTLCZ-UHFFFAOYSA-N	429.292	1.541	50	20	IDGD	
COc1ccc(C(=O)CNC(=O)CCC(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)cc1	762936738	GZODHLLRUJCHIV-UHFFFAOYSA-N	449.467	1.626	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)/C(C#N)=C\c2cc(C#N)n(C)c2C)n[nH]1	763150929	CSIJSNZSKFTEBH-NVNXTCNLSA-N	429.440	1.972	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(OC3CCCC3)nc2)cc1OC	763543104	LCCWOAZNBINXPS-UHFFFAOYSA-N	428.445	1.820	50	20	IDGD	
Cc1cc(C)n(-c2ccc(NC(=O)C(=O)NNC(=O)c3c(C)nc4ccccn34)cn2)n1	763627502	BFTSHARBZVHVGF-UHFFFAOYSA-N	432.444	1.240	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)C(=O)Nc1ccc(Oc2cccnc2)nc1	763682036	VLTNJZKGHXRTSP-UHFFFAOYSA-N	425.376	1.573	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)C(=O)Nc1cc(F)c(N2CCCC2)c(F)c1	763682937	RRWIXFZTYSDJKW-UHFFFAOYSA-N	436.390	1.869	50	20	IDGD	
CC(C)Oc1ccc(F)cc1NC(=O)C(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	763790808	PBTJWKYVCZDPHB-UHFFFAOYSA-N	441.419	1.260	50	20	IDGD	
CN(C)c1nnc(-c2ccc(NC(=O)C(=O)NNC(=O)COc3ccc(F)cc3)cc2)o1	763839044	YAZSGGMOLQCLJX-UHFFFAOYSA-N	442.407	1.107	50	20	IDGD	
COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1cccc(C)c1C	763852046	UJXVOHDFJZGHHU-ZDUSSCGKSA-N	430.417	1.774	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccc(CN2CCCC2=O)cc1	763871640	ICWWIOAUXXVVTI-CQSZACIVSA-N	442.447	1.502	50	20	IDGD	
COC(=O)c1ccc(OC)cc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccc(F)cc1	763872751	OOMATMXENJKEPT-LLVKDONJSA-N	433.392	1.174	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(N(C)C)c(C)c2)cc1	763875748	ABFDYVDDERHDGM-OAHLLOKOSA-N	426.473	1.817	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccnn2-c2ccccc2C)cc1OC	763904028	XVPDJNBGCXGRQB-UHFFFAOYSA-N	437.456	1.988	50	20	IDGD	
CS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccsc2)cc1Cl	764036016	WCBVZNQUSYIKJO-UHFFFAOYSA-N	430.895	1.102	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2cnc(-c3ccccc3)s2)c1	764077159	HXGRBWDICLNDNP-UHFFFAOYSA-N	444.494	1.613	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2ccc(C)c(N3CCOC3=O)c2)cc1	764131145	GYDIYLWDZOUVAI-UHFFFAOYSA-N	440.456	1.679	50	20	IDGD	
CCN1CCN(c2ccc(NC(=O)C(=O)NNC(=O)Cc3ccccc3OC)cc2)CC1	764136102	OBEXHQNPKFDAOS-UHFFFAOYSA-N	439.516	1.166	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(I)cc2)c1	764235971	UJOXPBPDMFWLLI-UHFFFAOYSA-N	434.193	1.563	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)C(=O)Nc1ccc(Cl)cc1C(=O)N1CCCC1	764263605	JDAVBILHEXPLBL-UHFFFAOYSA-N	429.864	1.300	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)C(=O)Nc1ccc(C(=O)N2CCCCC2)c(Cl)c1	764297871	HQCAHRPAFGMWFM-UHFFFAOYSA-N	432.868	1.397	50	20	IDGD	
COC(=O)[C@H]1CN(C(=O)C(=O)NNC(=O)C(C)(C)c2ccccc2)c2ccccc2O1	764301904	GORFXINCFSTGAL-QGZVFWFLSA-N	425.441	1.079	50	20	IDGD	
Cc1cc(Br)c(NC(=O)C(=O)NNC(=O)Cc2ccncc2)cc1[N+](=O)[O-]	764352977	GFJYITKXAVHFOS-UHFFFAOYSA-N	436.222	1.389	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)C(=O)Nc1cccc(OCc2cccnc2)c1	764367317	UZFSOFYCTSZCPC-UHFFFAOYSA-N	434.452	1.963	50	20	IDGD	
COc1ccc(CN(C)C)cc1NC(=O)C(=O)NNC(=O)C(F)(F)Oc1ccccc1	764379756	JHCQAWGHHLMWJH-UHFFFAOYSA-N	436.415	1.515	50	20	IDGD	
CCCc1c(NC(=O)C(=O)NN[C@@]2(C)CCS(=O)(=O)C2)cnn1-c1ccccc1C	764671736	BEDFILYPOXFFKQ-FQEVSTJZSA-N	433.534	1.270	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)CN(C)S(=O)(=O)c3ccccc3)n[nH]2)c1	765575618	KZMDCYLMTSIMQJ-UHFFFAOYSA-N	441.513	1.775	50	20	IDGD	
CCC(CC)(CC)C(=O)NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1	766637155	YZZKWBCFHYMSLO-UHFFFAOYSA-N	438.594	1.665	50	20	IDGD	
C[C@@H]1Cc2cc(S(N)(=O)=O)ccc2N1C(=O)COC(=O)[C@@H](Br)C(C)(C)C	766750499	RLFVTBUHIFCVGW-MEBBXXQBSA-N	447.351	1.964	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NN=Cc2sc(N(C)C)nc2Cl)cc1	767033859	PDSWMDSIULHQSP-UHFFFAOYSA-N	429.955	1.942	50	20	IDGD	
CC(C)c1cc(NC(=O)C(=O)NNC(=O)Cc2c[nH]c3ccccc23)n(-c2ncccn2)n1	768238606	RIEHKDLINLJSMQ-UHFFFAOYSA-N	446.471	1.596	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(C)(C)O)cc1S(=O)(=O)N[C@H]1CCCC[C@H]1C	768245768	FXCBCCVKVBNYJQ-OCCSQVGLSA-N	427.523	1.084	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)CCc2cccc3c2OCO3)ccc1Cl	770209961	XLUIPCMBWJOBJW-UHFFFAOYSA-N	425.850	1.110	50	20	IDGD	
CN1C(=O)c2ccc(NC(=O)C(=O)NNc3ccc(Br)c(F)c3)cc2C1=O	770814945	BPRBOUMBUVGJPG-UHFFFAOYSA-N	435.209	1.896	50	20	IDGD	
Cc1cccc(F)c1NNC(=O)C(=O)Nc1cccc(S(=O)(=O)N2CCOCC2)c1	770821774	JATJURFSIRRKEW-UHFFFAOYSA-N	436.465	1.237	50	20	IDGD	
COc1ccccc1[C@@]1(C)NC(=O)N(CC(=O)NNC(=O)c2ccc3ccccc3n2)C1=O	771217189	YCLNTBFFHZRSPF-HSZRJFAPSA-N	447.451	1.472	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1ccccc1NS(=O)(=O)c1ccc(C)cc1	772137399	ZKHULULPZPJHBC-CQSZACIVSA-N	433.486	1.899	50	20	IDGD	
Cc1c(C(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)nnn1-c1cccc(Cl)c1	772182913	NNKXFDBLTPRYHN-UHFFFAOYSA-N	447.282	1.960	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)CCC(=O)N3CC2CC2)c1	773496589	OUUNRAOYRJKDHR-UHFFFAOYSA-N	431.452	1.647	50	20	IDGD	
Cc1ccc(I)cc1NC(=O)C(=O)NNC(=O)c1cccc(C#N)c1	773496952	RYZGWBLROXWVQL-UHFFFAOYSA-N	448.220	1.871	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(Br)c(C)n2)cc1C	773524163	FLQRZDVCSRQGEM-UHFFFAOYSA-N	435.278	1.934	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2N2CCOCC2)cc1C	776560226	OVPXZHWFKRUMFL-UHFFFAOYSA-N	428.445	1.888	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)COC2CCN(C(=O)OC(C)(C)C)CC2)nc2ccccc21	777097025	KSPCEYDWWLNJCO-UHFFFAOYSA-N	445.520	1.679	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)[C@H](C)NS(=O)(=O)c2ccc(Cl)cc2)nc1C	778424879	FLKQPKDPRCTSCE-NSHDSACASA-N	441.897	1.425	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)[C@@H]2CC(=O)N(c3ccccc3OCC)C2)nc1C	778425034	JYDGIFFYPCMGNZ-CQSZACIVSA-N	427.461	1.857	50	20	IDGD	
COc1ccccc1C(=O)N[C@H](CCS(C)(=O)=O)C(=O)NNc1cc(Cl)ccn1	778453360	SJYUHOVJOBYNCI-CQSZACIVSA-N	440.909	1.420	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2ccc(Cl)cc2F)c1	779661067	MCILPWDMUKJITK-UHFFFAOYSA-N	428.873	1.874	50	20	IDGD	
CC(C)(C)OC(=O)N1CCc2[nH]nc(C(=O)OCC(=O)NNC(=O)c3ccccc3)c2C1	782418753	WPMLIBRNEFBPJO-UHFFFAOYSA-N	443.460	1.321	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)c2cccc(NC(=O)c3cccnc3)c2)cc1	782764505	GSBWEJNVGROQEL-UHFFFAOYSA-N	443.419	1.824	50	20	IDGD	
O=C(Cn1cc(NC(=O)C(=O)NNc2nc3ccccc3s2)cn1)NC1CCCC1	782813303	ZNLHMSWKUWYYEI-UHFFFAOYSA-N	427.490	1.633	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)C(=O)Nc1ccc(Cl)c(F)c1	782896480	JCVNGNIDTJTUIJ-UHFFFAOYSA-N	427.845	1.172	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccc(C(F)(F)F)cc2)nc1	783263730	KQKITSLWIDCTEM-UHFFFAOYSA-N	445.423	1.869	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2cccc(Cn3nc4ccccn4c3=O)c2)nc(C)n1	783326494	XANSRWAKBQGLCA-UHFFFAOYSA-N	432.444	1.033	50	20	IDGD	
CC(=NNC(=O)c1ccc(-n2cnnn2)cc1)[C@@H]1CN(C(=O)OCc2ccccc2)CCO1	783809928	HWZMXFIRJWOPAX-FQEVSTJZSA-N	449.471	1.806	50	20	IDGD	
Cc1ccc(NNC(=O)C(=O)Nc2cnc(Br)c(Br)c2)nn1	783954466	VUFRQOGYQYOGSI-UHFFFAOYSA-N	430.060	1.787	50	20	IDGD	
O=C(NNC(=O)C(=O)N1CCCC1)C(=O)Nc1ccc(OCc2ccccc2Cl)cc1	783999117	KARFCMGROXWTQQ-UHFFFAOYSA-N	444.875	1.627	50	20	IDGD	
CN(Cc1cccc(NC(=O)C(=O)NNc2nccnc2Cl)c1)C(=O)C(F)(F)F	784780564	BQFMBGUPRXGUBU-UHFFFAOYSA-N	430.774	1.733	50	20	IDGD	
CCOC(=O)c1cc(C)sc1NC(=O)C(=O)NNc1cccc(S(C)(=O)=O)c1	784843760	CUOHUNFYWUAHGU-UHFFFAOYSA-N	425.488	1.719	50	20	IDGD	
CN(C)c1nccc(NNC(=O)C(=O)Nc2cc(Cl)ccc2OC[C@@H]2CCCO2)n1	784971209	VVHBXZODDUNCLW-ZDUSSCGKSA-N	434.884	1.836	50	20	IDGD	
O=C(NNc1cc(F)c(F)c(F)c1)C(=O)Nc1cccc(N2CCS(=O)(=O)CC2)c1	785083358	QUACEBKHSDYUDS-UHFFFAOYSA-N	442.419	1.421	50	20	IDGD	
COC(=O)CCc1cccc(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)c1	786414834	SJQLSMQUCNWKOW-UHFFFAOYSA-N	433.848	1.611	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCc1ncnn1-c1ccccc1	787351475	WTTSVEQPKKLEPX-UHFFFAOYSA-N	442.505	1.013	50	20	IDGD	
CCC1(CC)Oc2ccc(NC(=O)C(=O)NNC(=O)[C@H]3COc4ccccc4O3)cc2O1	787894596	ONRJIAFPRPYARG-GOSISDBHSA-N	441.440	1.900	50	20	IDGD	
Cc1ccc(CN2CC[C@@H](NC(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)C2=O)cc1	790703566	YQHJLZQSOODEAP-GOSISDBHSA-N	444.513	1.144	50	20	IDGD	
COc1cc(C(=O)N2CCN(S(=O)(=O)CBr)CC2)cc([N+](=O)[O-])c1C	790850916	KJGORZJGIYZKHQ-UHFFFAOYSA-N	436.284	1.352	50	20	IDGD	
Cn1c(=NNC(=O)[C@](C)(O)Cn2cc(C(F)(F)F)ccc2=O)sc2ccccc21	792044311	LLHCVQSQPXNFER-QGZVFWFLSA-N	426.420	1.803	50	20	IDGD	
O=C(Cc1cc[nH]n1)NNC(=O)Nc1ccc(NS(=O)(=O)Cc2ccccc2)cn1	797654087	YHYPOGWIMGKLNR-UHFFFAOYSA-N	429.462	1.142	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)c1sccc1S(=O)(=O)N1CCCCC1	799853100	JDKPOAXAGJDZMG-UHFFFAOYSA-N	441.506	1.902	50	20	IDGD	
Cc1c(C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)nnn1CCOc1ccc(F)cc1	799856440	FCVBSMKCCLYXHD-SFHVURJKSA-N	441.419	1.406	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccc(OCC(F)(F)F)c(F)c2)n1	800621785	AFTDXSZOULHSMO-UHFFFAOYSA-N	431.346	1.366	50	20	IDGD	
Cc1ccc(O)c(C(=O)Nc2nc(CC(=O)NNC(=O)N=c3cc[nH]cc3)cs2)c1	802025978	KQOBWDDGEDSGIZ-UHFFFAOYSA-N	426.458	1.622	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)Cn2nnc(-c3ccc(Cl)cc3)n2)cc1	802067638	XWPIQCZXPRZWBZ-UHFFFAOYSA-N	449.880	1.250	50	20	IDGD	
COc1ccc(C2=NO[C@H](CNC(=O)NNC(=O)c3cc([N+](=O)[O-])ccc3O)C2)cc1C	802357897	XHKDPIKEWXUOPS-AWEZNQCLSA-N	443.416	1.755	50	20	IDGD	
C#Cc1cc(F)c(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)c(F)c1	802570904	AMEKYVWKKQOZDG-UHFFFAOYSA-N	434.424	1.469	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)CNS(=O)(=O)c2c[nH]c3ncccc23)c(Cl)c1	803394934	UHGVTGORKKLLKU-UHFFFAOYSA-N	436.881	1.656	50	20	IDGD	
CCN1CCN(Cc2ccccc2CNC(=O)NNc2ccc(-n3ccnc3)nn2)CC1	804949660	WWQZZXWWTMFPQJ-UHFFFAOYSA-N	435.536	1.626	50	20	IDGD	
Cc1cccc(F)c1NNC(=O)C(=O)N1C[C@@H](C[C@@H]2COCC(=O)N2)c2ccccc21	806982710	CXLOBXWSHCRSIC-HUUCEWRRSA-N	426.448	1.613	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)[C@H](c1ccccc1)N(C)C	807403966	FQPIUPWIJMMBCI-HNAYVOBHSA-N	447.561	1.572	50	20	IDGD	
CC(C)NC(=O)c1ccc(Cl)c(NC(=O)C(=O)NNc2ccc(-n3ccnc3)nn2)c1	807429522	UOEOJBICNPGHSJ-UHFFFAOYSA-N	442.867	1.536	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)C1(c2cccc(Br)c2)CC(=O)C1	811399816	QGYVHQPNOCAQJT-UHFFFAOYSA-N	427.295	1.986	50	20	IDGD	
CN1C(=C(C#N)C(=O)COC(=O)c2ccc3c(c2)NC(=O)CNC3=O)N(C)c2ccccc21	814521748	LINZGCOIRLFDKR-UHFFFAOYSA-N	445.435	1.416	50	20	IDGD	
CCOc1ccccc1OCC(=O)NN=C(C)c1ccc(S(=O)(=O)CC(N)=O)cc1	814723955	YHRLEWVTKUVTEW-UHFFFAOYSA-N	433.486	1.264	50	20	IDGD	
O=C(NNC(=O)C(F)(F)Oc1ccccc1)C(=O)Nc1cn(Cc2ccccc2)nn1	815569737	FYIHYHLJINVUGT-UHFFFAOYSA-N	430.371	1.084	50	20	IDGD	
COCCNC(=O)c1ccc(NC(=O)C(=O)NNc2cccc(Cl)n2)cc1Cl	815725946	HIWFTDUBVNTHGR-UHFFFAOYSA-N	426.260	1.846	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(N2C[C@@H](C(=O)NCC(Cl)Cl)CC2=O)cc1	816605457	ZLDYLPBCJNJDIX-LBPRGKRZSA-N	436.361	1.990	50	20	IDGD	
COC(=O)c1cc(NNC(=O)CN2C(=O)N[C@@](C)(c3ccc(OC)cc3)C2=O)ccc1C	816686729	CEGCTJNINIGBQM-QFIPXVFZSA-N	440.456	1.701	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2nc(F)ccc2Br)c1	816810591	RZZDXTHUTJDYTI-UHFFFAOYSA-N	445.270	1.308	50	20	IDGD	
C[C@@H]1Cc2c[nH]nc2[C@H](C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)C1	816829932	JYNITXFPNPLPQO-CXAGYDPISA-N	431.518	1.321	50	20	IDGD	
CN(CC(=O)NNC(=O)[C@H]1CCCN(C(=O)OC(C)(C)C)C1)c1ccccc1[N+](=O)[O-]	819659687	ZJGRIUKRSALFIB-AWEZNQCLSA-N	435.481	1.826	50	20	IDGD	
CCCCn1c(N)c(N(CC)CC(=O)NNC(=O)c2ccccc2Cl)c(O)nc1=O	822025550	ZQTDZRGWSDPDSQ-UHFFFAOYSA-N	436.900	1.272	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)[C@@H]2Cc3ccccc3CN2C(C)=O)cc1	912608285	XBQNQLWGMXRUMU-BTYIYWSLSA-N	425.485	1.973	50	20	IDGD	
COc1ccccc1NC(=S)NNC(=O)CNS(=O)(=O)c1ccc(Cl)cc1	913440042	KVQRPLXMNVQCPQ-UHFFFAOYSA-N	428.923	1.645	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)c1	914714693	BDODDXIACTWKPH-LBPRGKRZSA-N	441.456	1.880	50	20	IDGD	
C[C@H](C(=O)NNC(=O)COc1ccc(OCc2ccccc2)cc1)N1C(=O)CCC1=O	915671439	ZEWDBPOTDVGLMN-OAHLLOKOSA-N	425.441	1.329	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)[C@H]1COc2ccccc2O1)N1CCN(c2ccccc2)CC1	916514601	HLMGLASXGBZXHA-DYESRHJHSA-N	439.516	1.368	50	20	IDGD	
NS(=O)(=O)c1ccc(N2CCN(S(=O)(=O)c3ccc(CCCl)cc3)CC2)cc1	917740796	YXSAHSDCPLNLSF-UHFFFAOYSA-N	443.978	1.626	50	20	IDGD	
O=C(NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)Nc1nnc(C2CC2)s1	918542071	RYLXKHYEZGLVIS-UHFFFAOYSA-N	436.519	1.667	50	20	IDGD	
C[C@@H](NC(=O)COC(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccccc1)C(=O)N(C)C	918805332	SPWRDWMHMDBBRC-YAJBTMAUSA-N	448.483	1.507	50	20	IDGD	
C[C@@H]1CCCN(C(C)(C)CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)C1	919797449	MXAIMEWRFDRNEZ-OAHLLOKOSA-N	439.582	1.391	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)Nc2cccc(CN3C(=O)CNC3=O)c2)c1C	920932666	AIGJAKLKSXDVCP-OAHLLOKOSA-N	439.472	1.975	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Cn2cnc3ccc(Br)cc3c2=O)cc1	1317892729	WBCIVSSKYHIFRW-UHFFFAOYSA-N	431.246	1.629	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)[C@@H]1CC(=O)N(C)c2ccccc21	1318572772	KMTRAPOJYKIYHK-CQSZACIVSA-N	445.859	1.803	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)c1ccc(N2CCC[C@@H](C(N)=O)C2)cc1	1324034114	NFAFRJNBAZBSNY-QGZVFWFLSA-N	448.527	1.762	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)CNC(=O)c3ccc(C)s3)n[nH]2)cc1OC	1333547435	DMKRXIJCSBWESU-UHFFFAOYSA-N	443.485	1.655	50	20	IDGD	
Cc1nn(C)cc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Br)C1	1780770411	MYUTXEKDEJNRLT-CKEIUWERSA-N	431.306	1.547	50	20	IDGD	
Cn1ccc(=O)cc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Br)C1	1780773649	KSBSBJFLNVFDMV-IIDMSEBBSA-N	444.301	1.203	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(-n4c(O)nnc4O)cc3)CCO2)C1	1781217375	IOIYNTAOLSBBIQ-FOIQADDNSA-N	449.895	1.139	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)c3cc4cccnn4n3)CCO2)C1	1781231261	IWODCEHKQNLAOQ-ROUUACIJSA-N	426.304	1.409	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)Oc1ccccn1)C2	1782179459	XSSHRWOASCORAI-BIZBXSGISA-N	439.940	1.617	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1ccsc1)C2	1782211840	BDXTVBLESUQNFA-DYESRHJHSA-N	436.578	1.178	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3c(F)ccc(OC)c3OC)CCO2)C1	1783881790	UEWLCYKTJTWVIL-ZUOKHONESA-N	444.887	1.540	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3noc(C)n3)[C@H]2C1	1785276865	WXQOBGKHLLNFKO-FQUUOJAGSA-N	429.315	1.074	50	20	IDGD	
CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@]2(CN(C(=O)C(Cl)Cl)CCO2)C1	1785348859	UAIBEFXDLNMSAG-KPZWWZAWSA-N	438.352	1.923	50	20	IDGD	
Cc1nn(C)c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCBr)C[C@@H]32)c1F	1785775685	NMANIANREWNZJS-AVGNSLFASA-N	431.306	1.246	50	20	IDGD	
CC(C)(C)n1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCBr)[C@H]3C2)nn1	1786408798	BLQMDBULTOPTLV-YDHLFZDLSA-N	442.358	1.411	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)[C@@H](O)c1ccccc1	1786666577	WREPDYZSBSYXOT-QXKUPLGCSA-N	429.286	1.390	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](N)c3ccccn3)[C@H]2C1	1786866489	QVSIJXKPNPZMQW-JBJRXJHCSA-N	439.354	1.092	50	20	IDGD	
Cn1c(=O)n(C)c2cc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)[C@@H](F)Cl)C[C@@H]43)ccc21	1787959826	MHLGZRHVWBWWJX-MGBSGCIJSA-N	438.887	1.005	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3c[nH]c4cnccc34)[C@H]2C1	1788457020	NIAQJSHYEXPOOF-LMMLAZSQSA-N	435.322	1.940	50	20	IDGD	
C[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)N1C[C@@H]2C[C@H]2C1	1788509055	KRHLBAJFFRFMRO-NQCBRMCBSA-N	428.371	1.091	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cn4ccsc4n3)C[C@@H]21	1788764591	OLVGHLDUKKWQAI-DZKIICNBSA-N	436.610	1.841	50	20	IDGD	
C[C@@H](Nc1nccs1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]2C1	1789922997	PWBDJTQZQBSYTI-MOLYVOAJSA-N	449.346	1.614	50	20	IDGD	
CCn1nc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]3C2)cc1C	1789924449	DNZXBHHBGFDUAF-NZBPQXDJSA-N	431.306	1.495	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3(Br)CC3)[C@H]2C1	1789932989	BDVMVQQYYPVEIS-RHYQMDGZSA-N	438.160	1.677	50	20	IDGD	
CN(C)c1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Cl)C[C@@H]21	1790267804	HXZRNSCMPVHHKJ-YJOCZYATSA-N	442.875	1.789	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(C)nc(O)c3)C[C@@H]21	1790960860	BUYCXBRTVDSSTA-HNKHHVNMSA-N	440.338	1.862	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCOc3ccc(C)cc3)C[C@@H]21	1791251208	ZHPAAMBWTRDYNT-FFGOWVMKSA-N	438.952	1.997	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(F)c3[N+](=O)[O-])C[C@@H]21	1791256621	DMIPXLMJGGDLSO-PCBIJLKTSA-N	443.859	1.581	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccnc4ncccc34)C[C@@H]21	1791257145	QQVHLDUSPNPJOU-RUGDWHBFSA-N	432.908	1.477	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc4c3OCCO4)C[C@@H]21)C(Cl)Cl	1791294797	LRKZKMSEHWTZGH-WHOFXGATSA-N	429.300	1.855	50	20	IDGD	
CN1CCN(c2ccc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@@H](F)Cl)C4)cc2)CC1	1792457115	ZEFWYXCNWSYVGN-UKBAYJJMSA-N	438.931	1.176	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(C(F)F)no1)C2	1792867556	FLMOXMUVEDBDIA-XHSYRHOGSA-N	436.253	1.846	50	20	IDGD	
COc1nc(C)ccc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)CBr	1792872632	SCWYCTDXKIMXCB-ZIEJDFEHSA-N	440.338	1.633	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c(Cl)ccnc3c1)C2)[C@@H](O)CCl	1792980208	NPGUFAQTBTXYCN-GGNLRSJOSA-N	438.311	1.691	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CCc2ccccc2[C@H]1O	1793036101	FYZARSHLCVTREI-BPEACIIKSA-N	436.936	1.126	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCl)C1CCN(c2ccc(F)cn2)CC1	1793112413	HXOBJOUBPPJIRL-MHORFTMASA-N	438.931	1.675	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(S(C)(=O)=O)cn1	1794426671	VQOWBMYTPSFDTQ-IARIHHJXSA-N	443.953	1.096	50	20	IDGD	
COc1ccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Br)C3)cc1	1795259991	QVXINUZWTUWANK-DLTLXFJOSA-N	429.286	1.518	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccoc1Cl)C2	1796441356	CSLWZCPHILMHNT-NNGSTNBRSA-N	447.879	1.270	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc[nH]c2nccc1-2	1796644399	OGNNBTLDKJLFHU-CWNKPHDYSA-N	447.499	1.900	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccn2c(O)nnc12	1796723152	LTURGLWGVMJMLM-FVCCEPFGSA-N	436.310	1.718	50	20	IDGD	
CC(C)(C)c1cnc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Br)C3)cn1	1796759366	YSEFFUFFDRLJSG-BAESOJJISA-N	443.317	1.668	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1cnc[nH]1	1796771557	QLKSYYRSSLRPJQ-RBVVOMGSSA-N	441.444	1.738	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cc1ccc(F)cn1)C2	1796892067	DHJLJYXZJFHCRY-DIWZVOJHSA-N	440.479	1.535	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)n1ccccc1=O	1797937343	KOFAQPOHVGTNJS-JBXGNFEISA-N	440.338	1.172	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(N(C)C)nc1	1798268625	XQEQRXLEUFUAPG-OEYIWLLWSA-N	425.327	1.134	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](COC)NC(=O)OC(C)(C)C)C2	1799269571	IFEHRAUQJCYXKP-QRJUGERDSA-N	447.960	1.133	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nccc3nc[nH]c13)C2	1799275522	VHJQMAIQTHPZEJ-IMEWIIRVSA-N	426.304	1.397	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(O)cc1F	1800443209	NQYMNFBQKUEWOO-CLLJXQQHSA-N	427.436	1.095	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CC(c3ccccc3)=NO1)C2	1800971256	SPCKGVKWOQBTKB-LMCLKVLCSA-N	435.908	1.023	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cc(F)ccc1OC	1801101229	AZCNSKBTUDEORB-MVWRLGRASA-N	428.888	1.220	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnn2cccc(F)c12	1801177967	KNIVXMDFUOUFGA-QDMKHBRRSA-N	430.484	1.098	50	20	IDGD	
CC[C@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCNC(=O)c1ccc[nH]1)C2	1801798963	LTKYTKXKORJAIZ-XGUBFFRZSA-N	439.354	1.946	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)COc1cccc(N(C)C)c1)C2	1802333055	LJGAIDYRKNTWBR-GGPHIMKMSA-N	445.564	1.143	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1CCN(C(=O)c2cnnn2C)[C@@H]1c1cccnc1	1803009012	OFSPNDCSTGRNPE-IVMMDQJWSA-N	435.326	1.561	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@H]1CCN(C(=O)c2ccc(O)nn2)[C@@H]1c1cccnc1	1803009504	RFCQUPOGRBETEQ-SUYBPPKGSA-N	448.321	1.928	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)[C@H](O)NC(=O)OCC)[C@@H]1c1cccnc1	1803691862	MIIOVGSQYANDII-CUSZFKRNSA-N	440.928	1.559	50	20	IDGD	
Cc1ccc(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)s1	1805409423	PYONBNQOCIILOW-GHTZIAJQSA-N	449.341	1.765	50	20	IDGD	
Cc1oncc1C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1805803286	DMAJWWWEZUESSB-JXFKEZNVSA-N	428.493	1.071	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)cc1	1807364702	GPGTUWCPECMKMZ-GGAORHGYSA-N	443.312	1.703	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)cc1	1807364708	GPGTUWCPECMKMZ-GMAHTHKFSA-N	443.312	1.703	50	20	IDGD	
O=C(CSc1ncccn1)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1	1807569645	RKJQCQYMHJGUQA-YQQAZPJKSA-N	435.937	1.269	50	20	IDGD	
CN1CCN(CC(=O)NC[C@H]2CCN(C(=O)CO[Si](C)(C)C)[C@@H]2c2cccnc2)CC1	1809598326	HAFOIIYRFRKTNZ-DENIHFKCSA-N	447.656	1.186	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)[C@@H]3CCC(F)(F)C3)CC2)C1	1809968428	XMGLQOGFQHDDSK-QGZVFWFLSA-N	434.292	1.647	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)[C@@]3(F)CCCC=C3F)CC2)C1	1809972053	AFXPVZNYMDOFCQ-HSZRJFAPSA-N	446.303	1.957	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)c3ccncc3F)CC2)C1	1809972637	WQAWVGSSHOAHQY-UHFFFAOYSA-N	425.269	1.059	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1CCN(C(=O)CSc2nc[nH]n2)[C@H]1c1cccnc1	1810548432	QXVFEZGAKKQOEH-YJBOKZPZSA-N	448.625	1.849	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)c2cc(O)ncn2)[C@H]1c1cccnc1	1812865239	NAKZAEBRWMWEEO-RBOXIYTFSA-N	434.294	1.680	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)N1CC[C@H](CNC(=O)[C@H](Cl)COC)[C@H]1c1cccnc1	1813030656	FFQRJRVTNLYAPA-MWQQHZPXSA-N	439.944	1.049	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)nc1	1813069774	BUPDRRFABVMNHU-AVRDEDQJSA-N	438.532	1.478	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)Cc2cccnc2)[C@H]1c1cccnc1	1813070779	JUHYMBFKXOWDLT-XXBNENTESA-N	438.532	1.098	50	20	IDGD	
C=CCNC(=O)/C=C\C(=O)N1CC[C@@H](CNC(=O)C(Cl)Cl)[C@H]1c1cccnc1	1813074253	PORGJCLZJHAGLU-XGRZMECZSA-N	425.316	1.750	50	20	IDGD	
COC[C@@H](NC(C)=O)C(=O)N1CCCC[C@H]1c1cc(NC(=O)C(C)(C)CCl)n[nH]1	1814697000	HSSKMMPFLFBGKS-CABCVRRESA-N	427.933	1.818	50	20	IDGD	
Cc1nc2ncccn2c1C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](O)CCl)n[nH]1	1814871289	LXVVQYFPBVKABW-KBPBESRZSA-N	431.884	1.666	50	20	IDGD	
O=C(C[C@@H]1CCCCO1)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1	1815350298	OXJXFQRQAIKPEP-HOTGVXAUSA-N	443.334	1.008	50	20	IDGD	
CN1CCN(CCC(=O)Nc2cc([C@H]3CCCCN3C(=O)C(Cl)Cl)[nH]n2)CC1	1817156445	WGTHDTIFSAGQGO-CQSZACIVSA-N	431.368	1.843	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](C)n2cnnn2)n[nH]1	1822858432	AJRLPKWJLSLLBS-MDZLAQPJSA-N	439.318	1.823	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)[C@H]2CCCCO2)CC1	1823819554	YACZMPGNOXVTFQ-LEWJYISDSA-N	428.338	1.169	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC([C@H]2CCCCN2C(=O)C2CC(O)C2)CC1	1824113384	MCSRQNIXSNGLCJ-QRPGEEMDSA-N	443.548	1.511	50	20	IDGD	
O=C(CN1C(=O)CSC1=S)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)CC1	1824186703	AVVQSZUHUFIUFJ-KBPBESRZSA-N	448.010	1.066	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CNC(=O)OC(C)(C)C)CC2	1826004921	UYQGFHBGCLIDAP-MNOVXSKESA-N	446.957	1.834	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)CC2CCOCC2)CC1	1826733143	VYDVUWGXEQNACT-JOCHJYFZSA-N	442.365	1.416	50	20	IDGD	
C[C@@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1)n1cccn1	1827059625	FCYKJRKGIQSOEI-LAUBAEHRSA-N	438.337	1.057	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccnn2)CC1	1829210067	CFNGVHKWLVEPDA-LJQANCHMSA-N	437.504	1.022	50	20	IDGD	
O=C(c1c(Cl)cncc1Cl)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1829599134	OECKVCJGGDPRLH-CZUORRHYSA-N	440.686	1.993	50	20	IDGD	
Cc1ccc(F)cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)CCBr)C2)C1	1830071789	XTINKXUOLCSKSL-LJQANCHMSA-N	443.313	1.989	50	20	IDGD	
C[C@H](C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2)n1ccccc1=O	1830364723	RHHYLGOHVFWHCN-IIBYNOLFSA-N	439.940	1.131	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)CCc2ccc(O)nn2)CC1	1831087375	BGPOQVJPAPJVDU-QZTJIDSGSA-N	438.956	1.988	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc([N+](=O)[O-])o3)C2)C1	1831639142	MMHOHQPNVYAVJR-FZKQIMNGSA-N	429.857	1.665	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3[nH]nc4ncccc34)C2)C1	1831646966	PFWFKOAANCVVOY-FOIQADDNSA-N	435.912	1.435	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cn(C)nc2OC)CC1	1831828738	TYQREBJRUZDYJZ-DLBZAZTESA-N	426.945	1.916	50	20	IDGD	
COc1cncc(CCC(=O)N2CCO[C@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)c1	1832919879	UOILKVRDKDWZLV-LJQANCHMSA-N	446.331	1.283	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)C3CCN(C)CC3)CC2)CC1	1833105837	RKWDFSOQGVXHBZ-LJQANCHMSA-N	429.005	1.154	50	20	IDGD	
COc1ccc([C@H](O)C(=O)NC2CCN(C3CCN(C(=O)[C@H](F)Cl)CC3)CC2)cc1	1833184414	QEHLVACVAIPSPD-OALUTQOASA-N	441.931	1.835	50	20	IDGD	
N#Cc1ccc(CCC(=O)N2CCC(N3CCC(NC(=O)[C@H](O)CCl)CC3)CC2)cc1	1833307049	LTNMTGXEIDPZPZ-OAQYLSRUSA-N	446.979	1.662	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1coc(Cl)n1)CCO2	1833557006	XTGNPWJBSGGOSS-KRWDZBQOSA-N	431.949	1.250	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccn(C)c3)CCO2)C1	1833847754	JRSAWKLSADNZSW-KSSFIOAISA-N	428.327	1.126	50	20	IDGD	
O=C(c1ccc(C(F)(F)F)nc1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1834274347	BORJNSYRBUZMCL-CJNGLKHVSA-N	439.793	1.705	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)Cc3nnc(C)s3)CC2)CC1	1834854128	QEBBSNLSQUIUBV-INIZCTEOSA-N	444.001	1.214	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)c1ccc2nccnc2c1	1835401767	UJUMAFXKIXUQIE-FQEVSTJZSA-N	445.951	1.415	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)/C=C/c3cnc[nH]3)CC2)CC1)[C@H](F)Br	1836414702	ZACTWNNNPXADRQ-IMLGJKEDSA-N	442.333	1.685	50	20	IDGD	
O=C([C@H]1CCc2ccoc2C1)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836713601	HXFKHXSFZDFFED-LPHOPBHVSA-N	438.952	1.983	50	20	IDGD	
CCn1nc(C(=O)N2CCC(OC3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)cc1C	1836717924	FHYXCNAJAQGQKW-SFHVURJKSA-N	426.945	1.423	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(O)c(F)c3)C2)C1	1837714927	RKQYRLDTGVTSSN-HXUWFJFHSA-N	440.544	1.453	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)C(Cl)(Cl)Cl)C2)C1	1837716051	YRJQHIOOOLUWKP-AWEZNQCLSA-N	447.819	1.665	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(OC)c(OC)c3)CCO2)C1	1838932170	SLUOVCSDJXQQTF-KKSFZXQISA-N	440.924	1.791	50	20	IDGD	
O=C(/C=C/c1cccnc1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839197934	NEKNDNGVZXPUOF-SCQSPADBSA-N	442.285	1.242	50	20	IDGD	
O=C([C@H](F)Br)N1CCO[C@]2(COCCN(C(=O)C(F)(F)C(F)F)C2)C1	1839199583	YCHKRQPOPSTVBZ-QPUJVOFHSA-N	439.175	1.034	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc4c3NC(=O)C4)CCO2)C1	1839572223	MHKGJVFFASDHCY-VGOFRKELSA-N	449.935	1.659	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc4c(c3)NC(=O)CC4)CCO2)C1	1839609270	ATTXUKGYKCLCGC-VGSWGCGISA-N	449.935	1.659	50	20	IDGD	
CCN(CC)C[C@@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCBr)C2)C1	1839675417	CJZHKIWMTWCGIS-VQIMIIECSA-N	448.402	1.206	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C=C/c3ccoc3)C2)C1	1840031125	GILRIOLRQHJXJR-AMVWBUNWSA-N	427.295	1.533	50	20	IDGD	
Cc1ccn(C)c1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)Br)CCO2	1840034153	BRLXSFUOBWMWSV-KSSFIOAISA-N	428.327	1.187	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3coc(C(C)C)n3)C2)C1	1840151276	ZIZDDTKDWZCISK-KUHUBIRLSA-N	429.901	1.122	50	20	IDGD	
O=C(CCOc1ccccc1)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840187918	FBGSESOWPWNDBS-LJQANCHMSA-N	431.316	1.716	50	20	IDGD	
O=C(c1c[nH]c2cnccc12)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840188609	SUXMWZIUFFSSCI-GOSISDBHSA-N	427.288	1.437	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)/C=C/c3cnc[nH]3)CCO2)C1	1840343786	ZVOXWODWOUCIMU-QLVMYSCWSA-N	431.320	1.116	50	20	IDGD	
CC[C@H](C)[C@H](O)C(=O)N1CC2(CCCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C1	1841923996	LRFLAYDDQAWRIX-KKUMJFAQSA-N	431.961	1.729	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)CS(=O)(=O)c2ccc(C)cc2)C1	1842758814	BKEBUPZLXQNIEU-INIZCTEOSA-N	428.938	1.226	50	20	IDGD	
Cc1ccc2nc(C(=O)N3CC4(CCCN4C(=O)c4ccc(B(O)O)cc4)C3)ccc2c1	1843011294	PNJQOJGVQZADCJ-UHFFFAOYSA-N	429.285	1.354	50	20	IDGD	
Cc1ncncc1C(=O)N1CCCC12CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1844512581	OLEHMSQOFXDJQL-HNNXBMFYSA-N	437.928	1.734	50	20	IDGD	
O=C([C@H](O)CCl)N1CC2(CCCN2C(=O)c2cccc(Br)c2[N+](=O)[O-])C1	1845468332	YXLJOTWWLOEDKU-GFCCVEGCSA-N	446.685	1.774	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC12CN(C(=O)c1ccc3c(n1)NC(=O)CC3)C2	1846069857	ACGWOMAFQMGVQR-ZDUSSCGKSA-N	435.322	1.957	50	20	IDGD	
CC(C)(C)OC(=O)NC12CC(C(=O)N3CCCC34CN(C(=O)[C@@H](O)CCl)C4)(C1)C2	1846108947	MQINNQWDJTYHFB-MDAWKPQNSA-N	427.929	1.237	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC12CN(C(=O)[C@@H]1CCN1C(=O)OC(C)(C)C)C2	1846175828	UTJOMZKZMLVVQY-STQMWFEESA-N	430.343	1.983	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(CC(=O)N2CCCC23CN(C(=O)[C@@H](F)Cl)C3)CC1	1846968730	WTOGTYBLSDEGNE-OAHLLOKOSA-N	432.924	1.277	50	20	IDGD	
O=C(COC(=O)[C@H]1CCCN(C(=O)Nc2ccccc2)C1)NNC(=O)c1cccs1	11014636	JLDFIBHROBSNOM-AWEZNQCLSA-N	430.486	1.996	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)CCNC3=NS(=O)(=O)c4ccccc43)cc2C1	15557122	GCDBCCMZMKDIGU-LBPRGKRZSA-N	446.554	1.763	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=O)COc2cc(C)cc(C)c2)n(C)c1	16232901	BKVFEMPBCRZJII-UHFFFAOYSA-N	436.534	1.512	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cccc(N3CCCC3=O)c2)cc1OC	19480934	JKMVQEJOSNWEPA-UHFFFAOYSA-N	441.440	1.449	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)Cc2cnn(-c3ccccc3)c2)cc1OC	23344576	QUIDVSRMUMVXSH-UHFFFAOYSA-N	438.440	1.436	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)NC(C)(C)C)o2)cc1OC	31590846	PSPZCCJXXOZCMQ-UHFFFAOYSA-N	425.463	1.448	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCCN1CCO[C@H](C)C1	726258559	XJXIZFLBIRVUHD-OLZOCXBDSA-N	429.315	1.268	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)N[C@H](C)c2cc(F)ccc2N2CCN(C)CC2)n1	726279554	PXCPHZSXYAWREF-MRXNPFEDSA-N	431.516	1.482	50	20	IDGD	
COc1ccccc1N1C[C@H](C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)CC1=O	726863345	OEUBKKQKRYMYMI-CQSZACIVSA-N	444.513	1.632	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1NS(=O)(=O)c1ccccc1)C(=O)NC1CC1	727801507	YDUZXOAQTVSXFD-UHFFFAOYSA-N	436.877	1.180	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)N[C@H](CN1CCN(C)CC1)c1ccccc1	727945010	IGJHIEPFUGYFDE-DYESRHJHSA-N	443.523	1.912	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)CN(C)C(=O)[C@H](C)n2cccn2)c1	728526345	RVAVMISCFBOFBX-NSHDSACASA-N	438.282	1.135	50	20	IDGD	
Cc1cccc(N2C[C@H](C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)CC2=O)c1C	728846253	VTNIQZWMAZDNSF-GOSISDBHSA-N	436.516	1.510	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)Cc2cccnc2)c1	728893434	MJDRUTSRFATTAJ-UHFFFAOYSA-N	440.481	1.895	50	20	IDGD	
CCC(CC)[C@H](CNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)N1CCCC1	729047032	KPMTZPWGPSRYHE-IBGZPJMESA-N	431.585	1.924	50	20	IDGD	
CC[C@@H](NC(=O)NNC(=O)c1c(C)nc2ccccn12)c1cccc(S(N)(=O)=O)c1	729221564	SPORILXMEAIHTP-OAHLLOKOSA-N	430.490	1.385	50	20	IDGD	
CC[C@H](N=c1nn[nH]n1-c1ccccc1)C(=O)NNC(=O)[C@H](C)Oc1ccc(F)cc1	729281789	DNOZWHVEDSOCKQ-GUYCJALGSA-N	427.440	1.029	50	20	IDGD	
C=CCNS(=O)(=O)c1cccc(C(=O)NNC(=S)Nc2ccc(N(C)C)cc2)c1	729689598	OCTHHABRYJJPPX-UHFFFAOYSA-N	433.559	1.848	50	20	IDGD	
CSCC[C@@H](NC(=O)NNC(=O)COc1ccccc1O)c1nnc2ccccn12	730901342	BHCSKMAPYKYYIG-CYBMUJFWSA-N	430.490	1.639	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cc(S(N)(=O)=O)ccc2C)cc1Br	732173767	FFKJZVIXISGZLF-UHFFFAOYSA-N	442.291	1.488	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)[C@H]2CC(c3cc(F)ccc3F)=NO2)c2ccccc2c1=O	732653727	GTDFMTMIGKJPIA-MRXNPFEDSA-N	427.367	1.166	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCC[C@@H]1C(=O)N1CCCC1)C1CCN(c2ncccn2)CC1	732761938	QMOLWYXRDQCJLU-ROUUACIJSA-N	428.537	1.269	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc2c(c1)nc(CCC(=O)NNc1nccnc1Cl)n2C	734260858	VEQUEAWTFAEEQH-UHFFFAOYSA-N	437.913	1.343	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2sc(-c3cnn(C)c3)nc2C)c2ccccc2c1=O	734417801	UUSAJLQRJZNKCA-UHFFFAOYSA-N	437.485	1.657	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NN=C(C)c1cnccn1)N(S(C)(=O)=O)CC2	734744547	AECAPHBYFMBGGS-QGZVFWFLSA-N	447.517	1.283	50	20	IDGD	
CS[C@H]1CCC[C@H](NC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)C1	735385361	YHHQZRQRROAEJJ-GJZGRUSLSA-N	442.611	1.318	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCCCCC2)cc1C(=O)NNC(=O)c1cnn(C)c1	735446197	CTJOJZJXZMLJLV-UHFFFAOYSA-N	435.506	1.068	50	20	IDGD	
COc1ccccc1[C@H]1CCN(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)C1	738449512	CYQNNSGCBOWPML-AWEZNQCLSA-N	431.518	1.832	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)N[C@H]2CCC[C@H](S(C)(=O)=O)C2)nc1	741093158	NPGQSLJMGFTDHA-KBPBESRZSA-N	447.583	1.094	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N[C@H](C)[C@H]2CN(Cc3ccccc3)CCO2)cc1OC	741270069	OPXGCOXQGSFTJT-IIBYNOLFSA-N	442.516	1.937	50	20	IDGD	
Cc1nn(C)c2sc(C(=O)N[C@@H](C)C(=O)NNC(=O)[C@@H](C)Oc3ccc(F)cc3)cc12	742036128	FNZUVSADRXBEAT-NWDGAFQWSA-N	447.492	1.816	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@H]2Cc3cc(C)c(C)cc3O2)cc1	742473121	YVLSSDFEYAXKNR-LJQANCHMSA-N	431.514	1.383	50	20	IDGD	
COCCOC[C@H]1CCN(C(=O)NNC(=O)[C@H](C)Oc2cccc(Br)c2)C1	743522130	VVLMCDUKLGOLOY-KBPBESRZSA-N	444.326	1.942	50	20	IDGD	
COc1ccc2c(c1)OCC[C@H]2NC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	743650251	SFQHMEOVAYYUHC-MRXNPFEDSA-N	434.474	1.958	50	20	IDGD	
Cc1ccc(N2CCC[C@@H](NC(=O)NNC(=O)c3nnc(O)c4ccccc34)C2=O)cc1	745881525	QDLXGNZYLOQUAZ-QGZVFWFLSA-N	434.456	1.783	50	20	IDGD	
Cc1ccc(N2CCC[C@H](NC(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)C2=O)cc1	745885369	QVTGZCNIBVPEEQ-SFHVURJKSA-N	444.513	1.538	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)NCCOCc1ccccc1	747588068	BUCGWQBRBYBKHM-UHFFFAOYSA-N	425.533	1.746	50	20	IDGD	
CCOCCCn1c(NNC(=O)Cn2ccc(=O)c([N+](=O)[O-])c2)nc2ccccc2c1=O	747886264	PTESGBJYBNQEOC-UHFFFAOYSA-N	442.432	1.036	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NC[C@]1(N(C)C)CCSC1	748647566	PNWRLEOBIXWRFT-SJKOYZFVSA-N	445.383	1.984	50	20	IDGD	
CC(=O)[C@H]1CC(C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)=NN1c1ccccc1	750864782	DBNTYPYPGADAHU-GOSISDBHSA-N	432.440	1.563	50	20	IDGD	
CCCOc1ccc(C(=O)NNS(=O)(=O)c2ccc3[nH]c(=O)ccc3c2)cc1OC	751142443	OUNLMPCEVKUBFF-UHFFFAOYSA-N	431.470	1.949	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)c1cc(S(=O)(=O)N(C)C)oc1C	753179800	BIDMVGVHWUXCCP-UHFFFAOYSA-N	425.463	1.077	50	20	IDGD	
Nc1nc(Cl)cc(NNC(=O)c2ccc3c(c2)S(=O)(=O)c2ccccc2C3=O)n1	753455474	RWNAYZZVDDMWDA-UHFFFAOYSA-N	429.845	1.846	50	20	IDGD	
Cc1c(Br)cc(C(=O)NNC(=O)CCN2C[C@H](C)O[C@@H](C)C2)cc1[N+](=O)[O-]	753767397	HAGUGPICZYKFCU-QWRGUYRKSA-N	443.298	1.926	50	20	IDGD	
Cc1noc(C)c1[C@H](C)CC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	754084560	LEGUGXPUWYDOKV-CQSZACIVSA-N	435.550	1.864	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N(CC)CC)cc1NC(=O)NNC(=O)c1c[nH]nc1C	755442121	QKWGTWZZWZYUGJ-UHFFFAOYSA-N	438.510	1.614	50	20	IDGD	
CCOc1ccc(NC(=O)NNC(=O)[C@@H](C)CC)cc1S(=O)(=O)N1CCOCC1	755545545	IOUVWOUEXWFXIB-ZDUSSCGKSA-N	428.511	1.305	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)Nc1ccc(CC(=O)N2CCOCC2)cc1	755861218	CERPOUMJMXGLRR-UHFFFAOYSA-N	440.456	1.326	50	20	IDGD	
CC[C@H](C)NC(=O)c1ccc(NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1	756186165	HREXNFXIYYQEOA-ZDUSSCGKSA-N	436.472	1.928	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)cc2)C[C@@H](C)O1	756273644	JZLBYFYYVIPQBD-GASCZTMLSA-N	436.476	1.742	50	20	IDGD	
Cc1cccn2c(NC(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)c(-c3ccccc3)nc12	756285813	CLPYUIQPKBWALM-ZDUSSCGKSA-N	430.490	1.400	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)Nc1ccc(CN2C(=O)CSC2=O)cc1	756300690	MJGXTUUBQDGIDU-MRXNPFEDSA-N	442.453	1.875	50	20	IDGD	
C[C@H](c1cccc(NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c1)N1CCOCC1	756418498	CONLMWYIAHJDCV-OAHLLOKOSA-N	436.476	1.522	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CN(Cc2ccc(C(=O)NC3CC3)cc2)C2CC2)c1	756480565	GGQNMGFQQMDGMW-UHFFFAOYSA-N	431.496	1.876	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)Nc1ccc(S(=O)(=O)NC2CC2)cc1	756777456	XZKXHZMKIFIVTH-UHFFFAOYSA-N	432.502	1.921	50	20	IDGD	
Cc1nnc(-c2ccc(NC(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)cc2)o1	756833741	AFFWIHDRSVGFFH-UHFFFAOYSA-N	444.473	1.762	50	20	IDGD	
CCOc1cc(C(=O)N(C)C)ccc1NC(=O)NNC(=O)COc1ccc(C#N)cc1	756867666	AGHCGLSJFUOMAU-UHFFFAOYSA-N	425.445	1.890	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)Nc2ccccc2OCC(=O)N2CCOCC2)cc1	756874574	SBXXNQVAWHMSEN-UHFFFAOYSA-N	426.473	1.953	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)N=c1cc[nH]cc1Br	757806972	XLKXKVRGCXETGM-UHFFFAOYSA-N	447.337	1.631	50	20	IDGD	
CCOC(=O)c1cnc(C)c(NC(=O)NNC(=O)c2nn(CC)c(=O)c3ccccc23)c1	757810898	QOAVGSZLZCALHW-UHFFFAOYSA-N	438.444	1.763	50	20	IDGD	
Cc1nn([C@H]2CCS(=O)(=O)C2)c(C)c1NC(=O)NNC(=O)COc1ccccc1F	757872286	XFYBSAOITNUPER-ZDUSSCGKSA-N	439.469	1.230	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)N2CCN(c3nc(N)ns3)CC2)c(C)n1C[C@@H]1CCCO1	758588850	LRTAIVWYNHKTOG-PNDHZVEESA-N	441.561	1.973	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NC[C@H](C)c2nc(C)cs2)cc1	758682940	BVTNJBKRJRZHSD-ZDUSSCGKSA-N	439.563	1.515	50	20	IDGD	
COc1cc(Br)c(N)c(C(=O)OCC(=O)NNC(=O)c2ccc(C)cc2)c1	759316077	FOXYYPLECNOZQH-UHFFFAOYSA-N	436.262	1.966	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)[C@@](C)(O)CN2C(=O)C(C)(C)c3ccccc32)cc1	760068052	YNKCBYTWDMWDQI-QHCPKHFHSA-N	425.485	1.597	50	20	IDGD	
NC(=O)CC[C@@H](NC(=O)OCc1ccccc1)C(=O)NNC(=O)c1ccc2ccccc2n1	760116351	BXUCTNGGLJXUEC-LJQANCHMSA-N	449.467	1.556	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccc(C(=O)NNC(=O)CCNC(=O)OC(C)(C)C)cc1	760439300	BVFPKWPDISRGCG-UHFFFAOYSA-N	442.538	1.439	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)N[C@@H]2CCCN(c3ccccc3F)C2=O)nc2ccccc21	761815673	FQCOTHTTWWBVOJ-MRXNPFEDSA-N	438.463	1.781	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ccccc2)ccc1F	763422242	AVOBAEACBNQHGL-UHFFFAOYSA-N	436.465	1.302	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)ccc1OC1CCOCC1	763468892	XHAKHKSDWPKWKR-UHFFFAOYSA-N	442.428	1.861	50	20	IDGD	
CC(C)Cn1ncc(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1C(F)F	763570910	GXDVOLFXZGSFKT-CQSZACIVSA-N	437.403	1.403	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2F)c(OCCN(C)C)c1	763680981	CZHADZFVIHIVOG-UHFFFAOYSA-N	432.452	1.239	50	20	IDGD	
CC[C@H](C)Oc1cccc(NC(=O)C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c1	763787084	VPKXPPQBMTXSTO-ZDUSSCGKSA-N	437.456	1.511	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccccc2C(=O)OC)cc1	763860697	KQVXOBWIRZIWDE-CYBMUJFWSA-N	429.429	1.425	50	20	IDGD	
CCc1nn(C)cc1NC(=O)C(=O)NNC(=O)c1ccc(OCCC(C)C)c(OC)c1	763914484	NLSHOHIXWPHCOL-UHFFFAOYSA-N	431.493	1.816	50	20	IDGD	
CN(C)CCC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)cc1	763978558	LKMJJTAPRTXKAF-UHFFFAOYSA-N	447.879	1.336	50	20	IDGD	
COc1c(F)cc(NC(=O)C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)cc1F	764203558	NAEDCXDMWYRDSQ-UHFFFAOYSA-N	430.408	1.364	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1ccc(N2CCSCC2)cc1	764280974	VEJOIVWNABPFAY-UHFFFAOYSA-N	430.486	1.110	50	20	IDGD	
Cc1nc(COc2ccc(NC(=O)C(=O)NNC(=O)Cc3ccccc3F)cc2)no1	764314554	ZEMQBXODTXZECE-UHFFFAOYSA-N	427.392	1.425	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)CCCc3cccs3)cn2)C[C@H](C)O1	764342523	ZPZLXZWRHDIOTQ-GJZGRUSLSA-N	445.545	1.866	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)cnn1-c1ccccc1	764370243	PNVFVDAQXYAYCM-UHFFFAOYSA-N	429.383	1.938	50	20	IDGD	
CC(C)(C)NC(=O)c1ccccc1NC(=O)C(=O)NNC(=O)CSc1ccccc1O	764401141	LOPCKIQFKJAQGR-UHFFFAOYSA-N	444.513	1.799	50	20	IDGD	
CC(C)(C)c1nc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cs1	765739599	ZIVUNDJOWPIZTK-UHFFFAOYSA-N	429.546	1.660	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	765759678	WKYKGUYFDVVAPT-UHFFFAOYSA-N	430.936	1.822	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)o1	768639399	PUANFJJEYIRSGI-UHFFFAOYSA-N	443.503	1.233	50	20	IDGD	
CCOC(=O)c1n[nH]c(C2CCN(CC(=O)NNC(=O)c3cccc(Cl)c3)CC2)n1	770034396	PNDOUDOOLVFQID-UHFFFAOYSA-N	434.884	1.275	50	20	IDGD	
Cc1ccc(N2N=C(Br)C[C@@H]2C(=O)NNc2nc(O)c3cnn(C)c3n2)cc1	770971436	JDZDOCXGLAVEFN-GFCCVEGCSA-N	445.281	1.808	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)[C@H]2CC(=O)N(c3c(F)cccc3F)C2)c1	771157189	NUEUBQVRBAHOCG-AWEZNQCLSA-N	431.395	1.631	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)Cc2cccc(OCc3cccnc3)c2)C[C@@H](C)O1	771295386	DCBWQODGYXZVPG-QZTJIDSGSA-N	426.517	1.850	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1c(Cl)ccc(S(=O)(=O)CC)c1Cl	772114039	KIIFIDIBMHUPDL-MRVPVSSYSA-N	425.290	1.890	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1cccc2cncc(Br)c12	773543864	AAUXCVFQPZWEBE-JTQLQIEISA-N	439.266	1.135	50	20	IDGD	
O=C(Cc1cc[nH]n1)NNC(=O)C(=O)Nc1ccc(OCC(F)F)c(C(F)(F)F)c1	773548982	DEQFGRMFTYRALW-UHFFFAOYSA-N	435.309	1.401	50	20	IDGD	
CCOC(=O)c1cnn(-c2cccc(NC(=O)C(=O)NNc3nccc(OC)n3)c2)c1C	773724511	PXVOAGLKPCMFQG-UHFFFAOYSA-N	439.432	1.238	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN2CCO[C@@H](CNC(=O)OC(C)(C)C)C2)cc1C	775850705	OXSAKYIHQJAJPI-AWEZNQCLSA-N	440.566	1.605	50	20	IDGD	
O=C(Cc1cccc2ccccc12)NNC(=O)Nc1ccnn1[C@H]1CCS(=O)(=O)C1	776058492	CGXZERQXVKEMKG-INIZCTEOSA-N	427.486	1.791	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)Nc2ccc(S(=O)(=O)N3CCOCC3)cn2)cc1	776061579	LJUYQHBYMBDCKW-UHFFFAOYSA-N	433.490	1.131	50	20	IDGD	
COCCOc1cc(C(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)ccn1	777403623	HQIUYYCKGKHTRB-UHFFFAOYSA-N	437.497	1.450	50	20	IDGD	
CC(C)N1CC[C@H](NC(=O)NNC(=O)C(=O)N2CCCC2)[C@H]1c1ccc(Cl)c(F)c1	777750904	XSBMYPDUIQIKJN-DLBZAZTESA-N	439.919	1.956	50	20	IDGD	
O=C(CCCOCCc1ccccc1)N1CCN(S(=O)(=O)CBr)CC1	777778142	YPZCWOQQXSCICY-UHFFFAOYSA-N	433.368	1.852	50	20	IDGD	
COc1ccc(Cl)cc1N1C[C@H](C(=O)NNC(=O)CNC(=O)OC(C)(C)C)CC1=O	778433227	GRCQLWOBZKLBTN-LLVKDONJSA-N	440.884	1.374	50	20	IDGD	
CCC(CC)[C@@H]1C[C@@H](NC(=O)NNC(=O)c2csc(N3CCOCC3)n2)CCO1	778587668	BDGPDBJJVZTLRD-HOCLYGCPSA-N	425.555	1.908	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)C(=O)Nc1cc(Cl)ccc1OC[C@H]1CCCCO1	778713367	JCYWYFSTHDPBKN-CYBMUJFWSA-N	435.868	1.719	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)N2CC[C@H](C(=O)OC)C[C@@H]2C(=O)OC)c1C	780138074	URXSQHZJYKXYFZ-KHSLMGARSA-N	431.489	1.612	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)N[C@H]2CCN(c3sccc3C(=O)OC)C2=O)c1	780837899	NESOOTRFYSZOCU-AWEZNQCLSA-N	432.458	1.753	50	20	IDGD	
COC[C@@H](C)NS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccc(Cl)cc2)cc1	783339658	MIURNTDYBACRAP-GFCCVEGCSA-N	440.909	1.735	50	20	IDGD	
CC(=O)Nc1ccc(C)c(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)c1	784213987	RYXRYFXWUIHDOK-UHFFFAOYSA-N	445.501	1.476	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@H]2CC=CC[C@@H]2C(=O)N2CCOCC2)ccc1OC(C)C	784295300	FKLPUEXORCQFCX-ROUUACIJSA-N	445.516	1.685	50	20	IDGD	
O=C(NNc1ccccc1Cl)C(=O)Nc1ccc(N2CCN(C(=O)C3CC3)CC2)nc1	784778477	GZSSNFZYAKXCQW-UHFFFAOYSA-N	442.907	1.875	50	20	IDGD	
CCN1CCC(n2nccc2NC(=O)C(=O)NNc2ccc(Br)nc2)CC1	784809517	QYINWSHGSLYYJN-UHFFFAOYSA-N	436.314	1.779	50	20	IDGD	
O=C(NNc1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(CC(=O)N2CCOCC2)cc1	784828699	IRYSAELDRHMSLD-UHFFFAOYSA-N	427.417	1.078	50	20	IDGD	
Cc1cc(C(=O)N2CCOCC2)ccc1NC(=O)C(=O)NNc1cc(F)c(F)cc1F	784892030	OQKVLCHMEUBAPK-UHFFFAOYSA-N	436.390	1.967	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@H]2C)ccc1NC(=O)C(=O)NNc1ccnc(N(C)C)n1	784969013	GZAUDIPVKDTNIF-OAHLLOKOSA-N	439.520	1.947	50	20	IDGD	
CCCN(C(=O)c1ccccc1NC(=O)C(=O)NNc1ccnc(N(C)C)n1)C(C)C	784969836	QSUHIRUNIXCLQM-UHFFFAOYSA-N	427.509	1.885	50	20	IDGD	
CC(=O)Nc1cc(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)ccc1Cl	785061139	TVRDVJVQXANUEH-UHFFFAOYSA-N	428.836	1.275	50	20	IDGD	
Cc1nnnn1-c1cc(NC(=O)C(=O)NNc2nc(C(F)(F)F)cs2)ccc1F	785147763	RGQHJBPRKWJXRV-UHFFFAOYSA-N	430.347	1.667	50	20	IDGD	
COc1ccc2nc(NNC(=O)C(=O)Nc3cccc(S(N)(=O)=O)c3)c(C)cc2c1	785162786	PMASKDBEOMSTAR-UHFFFAOYSA-N	429.458	1.281	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)N2CCN(C)CC2)cc1S(=O)(=O)NCc1ccccc1	788167238	ZKAOFCGNUMHVAY-UHFFFAOYSA-N	445.545	1.075	50	20	IDGD	
N#Cc1ccc(N2C(=O)N[C@@H](CCC(=O)NNc3nnc(-c4ccccn4)s3)C2=O)cc1	788565659	TZOWTPRILPEUJV-HNNXBMFYSA-N	448.468	1.820	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1ccc(O[C@@H]2CCOC2)cc1	788724316	HGFQZQAFAMAETI-MRXNPFEDSA-N	432.502	1.531	50	20	IDGD	
CCCn1nc(C(=O)NNS(=O)(=O)C2=Cc3ccccc3OC2)c2ccccc2c1=O	788743173	FMTFMWWHZVFQCM-UHFFFAOYSA-N	440.481	1.804	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)c1ccc2c(=O)n(C)c(S)nc2c1	789334284	HPZXONPAPDPYPT-UHFFFAOYSA-N	436.497	1.596	50	20	IDGD	
CN(NC(=O)[C@@H]1CC(c2cccnc2)=NO1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	790886544	YYZBDWIVHTTZNP-INIZCTEOSA-N	432.481	1.210	50	20	IDGD	
C[C@@H](CN1CCOCC1)C(=O)NN=C(c1ccc(Cl)c(S(N)(=O)=O)c1)C1CC1	794479716	ZRQCXXDFFNCGMM-LBPRGKRZSA-N	428.942	1.186	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)CCCC[C@@H]2SC[C@@H]3NC(=O)N[C@H]23)cc1	794719404	JFLOPJDSSUNYMA-ZOBUZTSGSA-N	441.579	1.106	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)c2cccc(C)n2)ccc1S(=O)(=O)N1CCCC1	797628517	YODYENCOGTUXKV-UHFFFAOYSA-N	433.490	1.650	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)Nc1ccc(NS(=O)(=O)Cc2ccccc2)cn1	797653747	IPPAJUCMMWKLTP-UHFFFAOYSA-N	440.485	1.814	50	20	IDGD	
COCCN1C(=O)c2ccc(C(=O)NNC(=O)Nc3ccccc3C)cc2S1(=O)=O	798312709	JFAAEIPVTRHYEF-UHFFFAOYSA-N	432.458	1.252	50	20	IDGD	
C=CC[C@H](CC)NC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	798496836	UZKGAKMFVSEQCE-KRWDZBQOSA-N	438.550	1.325	50	20	IDGD	
Cn1nnc(COC(=O)/C(C#N)=C\c2cn(CCC(N)=O)nc2-c2ccc(Cl)cc2)n1	799453687	SXKUOGZYQLXMQP-JYRVWZFOSA-N	440.851	1.253	50	20	IDGD	
Cc1c(C(=O)NNC(=O)CCc2ccccc2O)nnn1CCOc1ccc(F)cc1	800329645	JHYNEEJBVRZDGN-UHFFFAOYSA-N	427.436	1.904	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1ccccc1S[C@@H](C)C(N)=O	801104276	HOUNDRPDKKXXEX-LBPRGKRZSA-N	449.558	1.329	50	20	IDGD	
C[C@H]1CC(C)(C)C[C@@]2(C1)NC(=O)N(CC(=O)NNC(=O)Nc1ccc3c(c1)OCO3)C2=O	802100871	AVWFDIZBGPJHMZ-LAJNKCICSA-N	445.476	1.705	50	20	IDGD	
COc1ccc(Cl)c(NC(=O)NNC(=O)c2cc(C)c3c(=O)n(C)c(=O)n(C)c3n2)c1	802112351	DUCYWDYNTGAKPI-UHFFFAOYSA-N	446.851	1.069	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)NC[C@@H]2CC(c3ccc4c(c3)CCO4)=NO2)nc2ccccc21	802338265	SLCOIIVKUXDOOZ-INIZCTEOSA-N	448.483	1.574	50	20	IDGD	
COc1ccc(C2=NO[C@H](CNC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)C2)cc1F	802341048	BEDVYCNLNODEGL-AWEZNQCLSA-N	431.380	1.880	50	20	IDGD	
COc1ccc(C2=NO[C@@H](CNC(=O)NNC(=O)c3cc(OC)cc(OC)c3)C2)cc1	802370197	DSOPTKCUICLFFT-GOSISDBHSA-N	428.445	1.850	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)C(=O)Nc1cc2n(n1)CCCC2	806974142	WWUQPEHUUFXLEN-UHFFFAOYSA-N	436.266	1.147	50	20	IDGD	
CC[C@H](C)C(=O)NNC(=O)C(=O)Nc1cc(OC)c(Br)cc1C(=O)OC	806976086	CYYHRFSQYDWBKZ-QMMMGPOBSA-N	430.255	1.376	50	20	IDGD	
CNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)CCc2ccco2)c1Br	806977684	UZBMLTPDNRKXHP-UHFFFAOYSA-N	437.250	1.120	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2cccc(C(C)(C)O)c2)nc1	806997254	BJSWKYYRTRDHCG-UHFFFAOYSA-N	435.506	1.078	50	20	IDGD	
C[C@@]1(C2CC2)NC(=O)N(c2cccc(CNC(=O)NNC(=O)c3ccccc3O)c2)C1=O	807237735	IZUSVYIXBOATGN-QFIPXVFZSA-N	437.456	1.761	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2nc(C)n(C)c2Br)cc1OC	808068684	GIHXERUDULTTOF-UHFFFAOYSA-N	433.284	1.132	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)CNS(=O)(=O)c2ccc(Cl)cc2)cc1	810196489	YLBULHIPMZRUHS-UHFFFAOYSA-N	425.894	1.407	50	20	IDGD	
CNC(=O)c1cc(Oc2ccc(NC(=O)NNC(=O)c3cc(C)[nH]n3)cc2F)ccn1	810311921	HMJKHMJDKGRKHB-UHFFFAOYSA-N	427.396	1.871	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(Br)s1)NN=c1cc[nH]c2ccccc12	810360814	BZZWPVHGAKBEDV-UHFFFAOYSA-N	441.332	1.902	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)cc1C	810585217	OCRORTFZXAWFNV-UHFFFAOYSA-N	433.515	1.495	50	20	IDGD	
CCOC(=O)C(C)(C)n1cc(NC(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)cn1	812955104	MOECKSKYPCULHR-UHFFFAOYSA-N	438.510	1.580	50	20	IDGD	
Cn1cc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)Nc3ccccc3Cl)c2)nn1	813009362	NTZITRBLIZKFSE-UHFFFAOYSA-N	449.880	1.736	50	20	IDGD	
CC(C)Oc1ccc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)N(C)C)c(F)c1	815751506	CBKTXGOPOSUAAN-UHFFFAOYSA-N	438.481	1.945	50	20	IDGD	
COc1ccccc1NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@H]2CCCO2)cc1	815778583	YIAKVHSBKFSRSX-QGZVFWFLSA-N	426.429	1.212	50	20	IDGD	
CC(C)C(=O)Nc1cc(C(=O)N2CCN(S(=O)(=O)CBr)CC2)ccn1	815964851	UFXRTYHSJOCTGH-UHFFFAOYSA-N	433.328	1.116	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)C2(S(C)(=O)=O)CCOCC2)cc1Cl	816596843	TVAFDNSDIXBAOD-UHFFFAOYSA-N	435.886	1.104	50	20	IDGD	
CCCN1C(=O)c2ccccc2N2C(=O)CC[C@@]12C(=O)NNC(=O)c1cccc(N(C)C)c1	821780680	FVXDXPVSUVQKKW-XMMPIXPASA-N	449.511	1.903	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CN2C(=O)COc3ccc(Cl)cc32)cc1C	849195601	HTWKFTYYNLLWLZ-UHFFFAOYSA-N	430.848	1.468	50	20	IDGD	
O=C(NNC(=O)C1(c2cccc(Br)c2)CCCC1)[C@@H]1CCS(=O)(=O)C1	887555004	NVTKWRFOPGTMMX-GFCCVEGCSA-N	429.336	1.843	50	20	IDGD	
O=C(NCc1ccccc1CN1CCCC1=O)NNC(=O)c1nn(-c2ccccc2)cc1O	913640703	KGXNRHGUABINGP-UHFFFAOYSA-N	448.483	1.845	50	20	IDGD	
CCn1c(=O)nc(O)c2c(C(=O)NNC(=O)COc3ccc(C)cc3)cc(C(C)C)nc21	914324178	SOWLFARFJMXQTM-UHFFFAOYSA-N	439.472	1.789	50	20	IDGD	
CCCCC[C@@H](C)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	915885838	LICUGHPSLOZMTP-OAHLLOKOSA-N	426.539	1.620	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)c2c(C)oc(C)c2S(N)(=O)=O)cc1OC	916144443	UFKNEDRGOMUXRV-UHFFFAOYSA-N	439.490	1.806	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)NCc2nnc3ccc(C(F)(F)F)cn23)cc1C	916222644	IYNKFUFOLDDLDV-UHFFFAOYSA-N	449.393	1.834	50	20	IDGD	
Cn1ccnc1[C@@H](NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)c1ccccc1F	916223806	DPNSNSNQMUPHGX-KRWDZBQOSA-N	449.446	1.540	50	20	IDGD	
COc1cc(C=NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc([N+](=O)[O-])c1O	916320544	AJYSGFNMRVVHPN-UHFFFAOYSA-N	448.457	1.857	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NCc2cccc(CN3CCCC3=O)c2)cc1	916414385	AHRNVIUSZUTIJZ-UHFFFAOYSA-N	426.473	1.727	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c2cccnc12	917737757	NRFHLEXUWIUENG-UHFFFAOYSA-N	435.483	1.270	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CC(=O)N(c2ccc(Cl)cc2)C1)c1ccc(-n2cnnn2)cc1	917924964	HERNLRDTXWUPNO-CYBMUJFWSA-N	425.836	1.130	50	20	IDGD	
O=C(NC[C@H]1Cc2ccccc21)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	919658003	IJDDASNSMXKCCL-QGZVFWFLSA-N	428.514	1.755	50	20	IDGD	
CS(=O)(=O)Nc1ccc(O)c(C(=O)NNC(=O)c2ccc(Br)s2)c1	919809739	CXKHWUVPFHBIMP-UHFFFAOYSA-N	434.293	1.663	50	20	IDGD	
CC(C)c1ccc(CNC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)cc1	919923467	RXFKZFGDVVWXJE-UHFFFAOYSA-N	446.577	1.967	50	20	IDGD	
COc1cc(S(=O)(=O)NNC(=O)c2nnc(-c3ccccc3)o2)cc(C(=O)O)c1OC	919961550	BPNFBEOEHGBVLE-UHFFFAOYSA-N	448.413	1.075	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)C1CCN(Cc2ccccc2)CC1	919963926	UWTRSWAVULHHEO-UHFFFAOYSA-N	443.573	1.961	50	20	IDGD	
Cn1c(=NNC(=O)[C@H]2CCCN2C(=O)/C=C/c2ccc(C(N)=O)cc2)sc2ccccc21	920017868	GFSOSSAZULUZGV-ZNOLPIRQSA-N	449.536	1.975	50	20	IDGD	
O=C(NNC(=O)C1(c2cccc(Br)c2)CCCC1)N[C@@H]1CCS(=O)(=O)C1	920745763	OXWSGJHMJFYOLU-CQSZACIVSA-N	444.351	1.778	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2cccc(OC(F)F)c2)cc2c1CCC2	1318972145	LIMLQAPCDMWUFT-UHFFFAOYSA-N	425.413	1.499	50	20	IDGD	
COc1ccccc1[C@@]1(C)NC(=O)N(CC(=O)NNc2ccc(C(C)(C)C)nn2)C1=O	1319305428	GGKLYWOHPQJQDO-OAQYLSRUSA-N	426.477	1.693	50	20	IDGD	
C[S@](=O)Cc1ccc(CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1	1322802719	PKYASVXEZMLNRK-LJAQVGFWSA-N	437.547	1.002	50	20	IDGD	
CSC[C@H](C)C(=O)N1CCC(C(=O)NNC(=O)c2cncn2-c2ccccc2)CC1	1325157829	NPUCFRKBNSEABI-HNNXBMFYSA-N	429.546	1.871	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)c2cncn2-c2ccccc2)ccc1OCC(=O)OC	1338516988	CMHMHRIXEYEUCX-UHFFFAOYSA-N	438.440	1.898	50	20	IDGD	
Cc1cc(NC(=O)CC(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)C(Cl)Cl)C3)no1	1778075499	VRHYINVWPITCTH-KZULUSFZSA-N	447.319	1.629	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccccc1)C2	1779374110	ADONTNSXEXNGBO-AUSIDOKSSA-N	437.500	1.126	50	20	IDGD	
C[C@H](Cn1cncn1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@](C)(Cl)CCl)C1	1780712881	XKOOMOPLRPXPLI-OHDICMOHSA-N	446.379	1.664	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc3n(n1)CCC3)C2)[C@@H](F)Br	1780775099	ZWWKEUSIVOMTCQ-IIDMSEBBSA-N	443.317	1.647	50	20	IDGD	
Cc1n[nH]c(C)c1CC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Br)C2	1780826589	CIVFVPYZLNMUPF-QGPMSJSTSA-N	445.333	1.773	50	20	IDGD	
C/C=C(/C)C(=O)N1CCO[C@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1	1780968229	GYFQOMVMTLADOS-SILSAOTNSA-N	443.548	1.129	50	20	IDGD	
COc1ccc(OCC(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](F)Br)C3)C2)cc1	1781324619	BAMXOXOPMLBTLC-WMZOPIPTSA-N	445.285	1.594	50	20	IDGD	
Cc1c(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)cc(Cl)cc1[N+](=O)[O-]	1781999402	PKBPZJWSUIBOHF-YJBOKZPZSA-N	446.287	1.600	50	20	IDGD	
C=C(CC(=O)OCC)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](Cl)COC)C1	1782178117	FTMJDAIOIJDGMG-JXXFODFXSA-N	430.929	1.264	50	20	IDGD	
CCOC(=O)C1(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](Cl)COC)C2)CC1	1782179650	KTQCPVLJWACTEM-SPYBWZPUSA-N	430.929	1.097	50	20	IDGD	
O=C(CCc1ncc[nH]1)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Br)C2	1782412003	ORFJZIIATDJHHB-ISTRZQFTSA-N	431.306	1.547	50	20	IDGD	
COCC(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](Br)Cc3ccccc3)C2)C1	1783024001	SKOZINZGULLQQK-QFBILLFUSA-N	425.323	1.469	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(OC)nn3)CCO2)C1	1783353698	ZFZPTKNIRVNIKT-YVEFUNNKSA-N	427.299	1.102	50	20	IDGD	
O=C(C1=NN(c2ccccc2)C(=O)C1)N1CCO[C@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783946000	VZSSOLRPYJMIQR-IBGZPJMESA-N	439.299	1.413	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H]1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21	1784819564	KRBZAOSNWYWHQN-RMEBNNNOSA-N	433.908	1.510	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCN(C)C(C)=O)[C@H]2C1	1784936925	HKCHPRVKJYZXJL-JONQDZQNSA-N	432.359	1.008	50	20	IDGD	
Cc1nnc(CCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Br)C[C@@H]32)s1	1785325560	OQIHPEVTNITUMO-ASHKBJFXSA-N	449.346	1.449	50	20	IDGD	
C[C@H](Cn1cccn1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21	1785442562	UEEMVVAHKSYKKM-CAEXGNQWSA-N	431.306	1.189	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(=O)oc3)[C@H]2C1	1786276515	DAEGDQFJWMWSHA-JURCDPSOSA-N	427.295	1.264	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4c[nH]nc4c3)[C@H]2C1	1787319201	CPDVKQQQLWHLMW-SIUGBPQLSA-N	435.322	1.940	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4c(n3)OCCO4)[C@H]2C1	1787380549	HRTBNFAANXMSET-AFIMGQEJSA-N	437.924	1.854	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccn(C(F)F)n3)[C@H]2C1	1788938218	NLHWAAXQJNPPHD-UHXUPSOCSA-N	449.296	1.903	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)c1ncccc1Br	1788960154	ROIMASPAQCKSSX-IMIFBBOLSA-N	446.729	1.037	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3[C@@H]4C=CS[C@@H]34)[C@H]2C1	1790622547	NQPYTRYVRZYLKP-UQYNZRTDSA-N	429.380	1.872	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3snnc3C3CC3)C[C@@H]21	1791057086	AZWCNZYVEUWRDO-BQUFFADESA-N	443.367	1.792	50	20	IDGD	
C[C@H](NC(=O)c1ccccc1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21	1792247678	ORGBSYBMOLVUJW-SRQBIAJPSA-N	425.888	1.319	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Cc1ccncc1)C2	1792872096	LXSZGWGXKOKVPU-CENPHQPOSA-N	438.366	1.881	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc(-c3ccccc3)s1)C2)[C@H](O)CCl	1792981430	ZPTGVYFNCAZXAY-JYYAWHABSA-N	435.933	1.613	50	20	IDGD	
COC(=O)[C@H]1CC[C@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCBr)C3)CC1	1793607291	AQFBQWKRFAHSBW-KATPRTFMSA-N	445.354	1.340	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1csnn1)C2	1794141660	XQAXNPYLMBEAGP-RNJOBUHISA-N	443.957	1.922	50	20	IDGD	
COc1cccnc1CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCBr	1795111641	ZQHDELHSBYDCSP-HBCWATKFSA-N	440.338	1.397	50	20	IDGD	
CC(C)(C)OC(=O)N1CC=C(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Cl)C1	1796365477	XROGCOHGYUKNLW-XGUBFFRZSA-N	431.892	1.288	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)c1ccccc1Cl)C2	1797956550	KWQQZWRTTWUOPI-GTYSZEQSSA-N	441.000	1.815	50	20	IDGD	
C#CCCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O	1798525538	DOUHYIVPIRFBED-YVWYUNDQSA-N	429.429	1.137	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@]1(C)C[C@@H]1C	1799165591	WPYCTHJDBHBBMP-MRRNNNFUSA-N	445.472	1.769	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(=O)nc2cccnn12	1799189989	VLBSRVVTGIHDDZ-CRWXNKLISA-N	448.321	1.515	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)cc([N+](=O)[O-])c1)C2	1799276643	OOQRXKDCMMPSSX-ABXQLRGKSA-N	446.287	1.740	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc3ccc(F)cn13)C2	1799279928	XRWLGXRFVCATKL-JZGBQWHFSA-N	443.306	1.913	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](F)Br)c1cc(=O)nc2cccnn12	1800160753	HAFPASIIBSDDNT-DDIVZENXSA-N	438.257	1.032	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccn(C(F)F)n1)C2	1800642101	WTLQHDVZNYCPKQ-NOHGZBONSA-N	435.269	1.655	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(C)nn1C(F)F)C2	1800642684	WRFNMHWAAMAHBR-GFQSEFKGSA-N	449.296	1.963	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CCCN1C(=O)OC(C)(C)C	1800784567	WRTANDHWSBAAPB-BPKGMFCQSA-N	443.972	1.993	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(C)ccc1-n1ccnn1)C2	1800979573	PQIGBEZJWRXKGK-LORHWOILSA-N	447.923	1.033	50	20	IDGD	
COC[C@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H]1C[C@@]13C(=O)Nc1ccccc13)C2	1802284954	STBHIMIYBYLGBA-HUWURKSSSA-N	431.920	1.788	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C[C@@H]1OCCc3ccccc31)C2	1802334122	IQOCVEFAANBCEJ-JTJHWIPRSA-N	442.560	1.702	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1CCN(C(=O)[C@@H]2CNC(=O)C2)[C@@H]1c1cccnc1	1803016169	SWLDQRLYHJBSTH-VWNJHIHFSA-N	437.338	1.255	50	20	IDGD	
C[C@@H](Cc1ccco1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnccc1C(=O)NN)C2	1803075588	YZHMDIJPSGJTKW-JONQDZQNSA-N	425.489	1.409	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]1c1cccnc1	1803147817	MDLJRQBTZIXSPN-BARDWOONSA-N	432.746	1.861	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)c2ccco2)[C@H]1c1cccnc1	1805377637	PXFCVZVKTVJTBM-HNAYVOBHSA-N	434.456	1.307	50	20	IDGD	
Cc1ccc(C(=O)NC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)cn1	1805459850	NJQMHBJTWMPKGP-PGRDOPGGSA-N	438.532	1.478	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)Cc2ccsc2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807362777	JGRHCVQVXIULGR-KNQAVFIVSA-N	449.341	1.385	50	20	IDGD	
C[C@H](NC(=O)c1ccccn1)C(=O)N1CC[C@H](CNC(=O)[C@H](F)Cl)[C@@H]1c1cccnc1	1808322763	XHNFEELEPTXDFO-DHXZDTOLSA-N	447.898	1.835	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)c2cocn2)[C@H]1c1cccnc1	1808414839	MDUDSWSPAZXSBC-YRJCQSRDSA-N	449.471	1.523	50	20	IDGD	
Cn1ccc(C(=O)N2CC[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)c1	1810299954	VSNYHDVRNCESBV-OXJNMPFZSA-N	447.499	1.052	50	20	IDGD	
O=C(/C=N/O[C@@H]1CCCCO1)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1	1810358338	RUBZDWYXCKQLCX-MNNSWCIVSA-N	438.912	1.216	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1ccccc1	1811664499	WCUYOBARKLAAJA-IRLDBZIGSA-N	429.285	1.395	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)c1cc(O)cc([N+](=O)[O-])c1	1811677511	VITTZZOTLNSNBF-VHSSKADRSA-N	448.863	1.615	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H](CNC(=O)[C@@H](C)NC(C)=O)[C@H]1c1cccnc1	1812651991	JIAMSDDGWDUCJK-VDNDLQMASA-N	439.354	1.786	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)CS(C)(=O)=O)[C@H]1c1cccnc1	1812774735	FHONKTHJKQXSGN-YCPHGPKFSA-N	446.367	1.306	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)CNC(C)=O)[C@@H]1c1cccnc1	1812779302	SCCXURWGJNJBAU-YQQAZPJKSA-N	425.327	1.397	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)C[C@H](N)c2cccnc2)[C@H]1c1cccnc1	1813032031	UFONXSDZWBKKMA-IWFBPKFRSA-N	445.951	1.826	50	20	IDGD	
Cc1noc(C)c1C(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1813070146	GLKPVVRZXCELSR-UWJYYQICSA-N	442.520	1.379	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2nccs2)[C@@H]1c1cccnc1	1813070353	IAZJNDNJJQWOAN-MAUKXSAKSA-N	430.534	1.231	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2C[C@]2(F)Cl)[nH]n1	1819404780	YRRSXDYYTPQGKB-PTAUBWNISA-N	449.874	1.639	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)C/N=C/c2ccco2)n[nH]1	1819481655	YXWGEXGJVDUBQQ-KOWBDXASSA-N	443.508	1.487	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](C)Br)[nH]n1	1819585785	KRBFOWPGMHHKGG-NQBHXWOUSA-N	426.315	1.876	50	20	IDGD	
Cc1ccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)c(O)n1	1820264095	FXTWQHUHFPJGPO-GOSISDBHSA-N	449.276	1.118	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1	1823013770	JEKBVKCWIUBFMA-MHYGZLNHSA-N	428.711	1.999	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3c(O)cc(O)cc3O)sc2C1	1823529544	JEHPLMVARGIJKD-SCZZXKLOSA-N	441.893	1.740	50	20	IDGD	
Cc1cc(NC(=O)CC(=O)N2CCC([C@H]3CCCCN3C(=O)[C@H](O)CCl)CC2)no1	1824182441	CEDSRXVGNNUUKL-HZPDHXFCSA-N	440.928	1.531	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1c(C)nn(C)c1C)CC2	1825994939	QUDLCMXQPIFOKM-RYUDHWBXSA-N	425.942	1.973	50	20	IDGD	
Cc1cc(C(=O)N[C@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)c(C)o1	1826080547	QFHICSVTHCNUOR-ZDUSSCGKSA-N	433.534	1.952	50	20	IDGD	
CCO/C=C/C(=O)Nc1nc2c(s1)C[C@H](NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1)CC2	1826464891	XQBNRLLDUAZXBB-WFYFWWQASA-N	444.517	1.739	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](C)n3cncn3)sc2C1	1826797122	FCXXJOBLRITJBW-IVZWLZJFSA-N	427.328	1.691	50	20	IDGD	
CNc1ccc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)cc1	1827051013	KLWJPYYFFFAHQU-QHCPKHFHSA-N	449.360	1.955	50	20	IDGD	
O=C(Cc1cccs1)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827055178	UOUCFVXJNQTOMZ-NRFANRHFSA-N	440.374	1.904	50	20	IDGD	
O=C(Cc1cscn1)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827055268	WPFNQXIIVNWMNJ-HXUWFJFHSA-N	441.362	1.299	50	20	IDGD	
COCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Cl)CCN2C(=O)OCc1ccccc1	1829052239	ITMMKGFEQVYZBZ-PXNSSMCTSA-N	441.887	1.619	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(=O)c4ccccc4o3)CCO2)C1	1830312974	VFGIANSQOXIZGR-AOMKIAJQSA-N	448.903	1.880	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4ncncc4c3)C2)C1	1830362425	WVUAIXQXJSAQTR-QFIPXVFZSA-N	446.935	1.965	50	20	IDGD	
O=C1CC[C@H](C(=O)N2CCC([C@H]3CCCCN3C(=O)[C@@H](F)Br)CC2)CN1	1830379220	QFBPVFGAWNMDED-SQWLQELKSA-N	432.334	1.823	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccc(C#N)cc3)C2)C1	1831638112	AWDCTGSXNAYBQD-UGKGYDQZSA-N	433.936	1.965	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(C(=O)O)ncn2)CC1	1831829006	WYXSSCGXLFTUIX-YOEHRIQHSA-N	438.912	1.662	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CCN2CCN(C)CC2)CC1	1831830020	HDDDQXVMDXZQJH-UXHICEINSA-N	443.032	1.497	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)Cc2ccccc2O)CC1	1831875078	RBXKQZRHXXQFCD-HXUWFJFHSA-N	444.576	1.927	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)Cc3cccc(Cl)n3)CC2)CC1)[C@@H](O)CCl	1833307974	FSZPCVLYNWKQLR-KRWDZBQOSA-N	443.375	1.449	50	20	IDGD	
C[C@H](Nc1cccnc1)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](F)Cl)CC2)CC1	1835080297	OUMRGVXXAFZWEJ-KBXCAEBGSA-N	425.936	1.988	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](O)Cc3ccccc3)CC2)CC1)[C@@H](F)Cl	1835083789	UVXYEPVCFWVXDF-RTBURBONSA-N	425.932	1.696	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC1CCN(C2CCN(C(=O)Cn3cncn3)CC2)CC1	1836398641	PNFKYODDJKSJEF-GOSISDBHSA-N	431.368	1.086	50	20	IDGD	
O=C(C1=CCCC1)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1	1837615368	DDJIRJIAVFNSAM-UHFFFAOYSA-N	426.322	1.089	50	20	IDGD	
O=C(CC1CCC1)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1	1837922103	LRBDUHINIAQFJE-UHFFFAOYSA-N	428.338	1.169	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(O)ccc3O)CCO2)C1	1839448845	YNHNDEWSKMYHPK-OALUTQOASA-N	447.315	1.404	50	20	IDGD	
O=C(c1ccc2occc2c1O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1839564367	INRKIKJUAOQHIB-LPHOPBHVSA-N	426.828	1.743	50	20	IDGD	
C=CCC(F)(F)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](Br)CC)C2)C1	1839890503	DFOQIIFCKAOVOU-CJNGLKHVSA-N	439.297	1.828	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@]3(C)CC3(F)F)C2)C1	1840035806	GNLGNOKPBWPKEL-TUKIKUTGSA-N	425.270	1.272	50	20	IDGD	
O=C(/C=C/C(=O)N1CCCC12CN(C(=O)[C@@H](F)Br)C2)NCc1ccccc1	1841329162	GQPZVOAYEHPPFH-IWAYRVGRSA-N	438.297	1.753	50	20	IDGD	
O=C([C@H](O)CCl)N1CC2(CCCN2C(=O)c2cc(=O)c(OCc3ccccc3)c[nH]2)C1	1842131070	IRTTUXHNPLFNJD-GOSISDBHSA-N	445.903	1.371	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1cnc3ccccc3n1)C2	1843416071	VOEIHLMXJIKJQK-JFLMPSFJSA-N	445.483	1.581	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@H](O)CC(=O)N1CC2(CCCN2C(=O)CO[Si](C)(C)C)C1	1844378786	HUXYDOGQPHCGNQ-OAHLLOKOSA-N	443.617	1.317	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2ccc(F)c(F)c2)C1	1844973027	MVZMYHNIIKLMLH-DHRITJCHSA-N	429.427	1.916	50	20	IDGD	
COc1ccc(Cl)c(C(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)c1	1846776260	PXXFFKOOSNGSAL-UHFFFAOYSA-N	443.891	1.478	50	20	IDGD	
CC(C)[C@@H](CC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl)NC(=O)OC(C)(C)C	1847563420	IMGZZXCGVJOHBZ-FXUDXRNXSA-N	431.961	1.727	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CCCN1C(=O)c2ccccc2C1=O	1848091169	PQSHXPSOHOKPID-SQNIBIBYSA-N	447.919	1.518	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)Cc1cccnc1	1848099128	GLZVEVKIOMFYAH-ULQDDVLXSA-N	436.940	1.958	50	20	IDGD	
COc1cc(NC(=O)C(C)C)c(C(=O)OCC(=O)NNC(=O)c2ccccc2)cc1OC	9922374	MAXSOMBJCFSTSZ-UHFFFAOYSA-N	443.456	1.916	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)COc2ccc3ccc(=O)oc3c2)c2ccccc2c1=O	17196190	MWOBQGSWAFOVOB-UHFFFAOYSA-N	448.435	1.924	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)cn1	17521273	ZEUIUSRUMTVVRO-UHFFFAOYSA-N	440.481	1.644	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(C(=O)NNC(=O)c2cc(Br)c[nH]2)cc1	23914056	YSHKRZFRFYVUCJ-UHFFFAOYSA-N	443.323	1.883	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](CNC(=O)NNC(=O)c2nnc(O)c3ccccc23)C1	726265237	DCRBIOPEXAVIKU-CYBMUJFWSA-N	444.492	1.927	50	20	IDGD	
COC(=O)N1CCC[C@@H](NC(=O)NNC(=O)COc2ccc(Br)cc2)C1	726620254	VVJHYAPGNXAPHT-GFCCVEGCSA-N	429.271	1.389	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)Cc2ccc(C(=O)NNS(=O)(=O)C3CC3)cc2)cc1	727350874	XEQKNHHUQKYOAF-UHFFFAOYSA-N	437.543	1.542	50	20	IDGD	
CN(CCCC(=O)NNc1nc(-c2cccnc2)no1)S(=O)(=O)c1ccc(F)cc1	728078521	IUGXOGBEHBNMQA-UHFFFAOYSA-N	434.453	1.815	50	20	IDGD	
O=C(COC(=O)CCNC(=O)c1n[nH]c2ccccc12)NNC(=O)c1ccc(Cl)cc1	728102871	RNQYALUCENHVAY-UHFFFAOYSA-N	443.847	1.341	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)COc3ccccc3[N+](=O)[O-])cc2)CC1	728214139	YTTXFBRIQFIUPU-UHFFFAOYSA-N	449.489	1.053	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3ccc4ncccc4c3)cc2)CC1	728215605	HSULBHLDMZQRAS-UHFFFAOYSA-N	425.514	1.928	50	20	IDGD	
COc1ccc2[nH]cc(CC(=O)OCC(=O)NNC(=O)[C@@H]3COc4ccccc4O3)c2c1	728328200	QLWSMBKQBZPYNG-IBGZPJMESA-N	439.424	1.250	50	20	IDGD	
Cc1noc(C)c1S(=O)(=O)N1CCC(C(=O)NNC(=O)c2cccc(C#N)c2)CC1	728828532	SEHNLMZNMSBVGF-UHFFFAOYSA-N	431.474	1.025	50	20	IDGD	
CC(=O)CCc1ccc(OCC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1	728845294	FWALETNHPGOZRX-UHFFFAOYSA-N	425.489	1.441	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(CCNC(=O)NNc2nccc(OC)n2)s1	729613773	HYTUBXXPBXYQRQ-UHFFFAOYSA-N	428.540	1.446	50	20	IDGD	
O=C(Cc1cc[nH]n1)NNC(=O)c1cccc(S(=O)(=O)N2CCCc3ccccc32)c1	730102372	OUUBOMFRFGRNLC-UHFFFAOYSA-N	439.497	1.555	50	20	IDGD	
Cc1cccc(N2C(=O)N[C@H](CCC(=O)NNC(=O)[C@@H](C)Oc3ccc(F)cc3)C2=O)c1	730769362	SVFIRIGRZDVRFE-RDTXWAMCSA-N	442.447	1.954	50	20	IDGD	
CCOc1ccccc1C(=O)NCCCC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	731853519	HKBUVQZBYPVRLQ-UHFFFAOYSA-N	437.460	1.032	50	20	IDGD	
Cc1cc(=O)c(C(=O)NNc2nc(-c3cccnc3)no2)nn1-c1ccccc1[N+](=O)[O-]	732111029	XSJCUWDLSVNSTG-UHFFFAOYSA-N	434.372	1.651	50	20	IDGD	
CSCC[C@@H](NC(=O)Cc1ccccc1)C(=O)NNC(=O)c1ccc2c(c1)OCCO2	732752178	BZYYZASTZIHGKI-QGZVFWFLSA-N	443.525	1.699	50	20	IDGD	
NS(=O)(=O)c1ccc(CCNC(=O)NNC(=O)NCc2ccc(Cl)cc2)cc1	733036870	XWCVXSPNEXYYDC-UHFFFAOYSA-N	425.898	1.244	50	20	IDGD	
COc1ccc2[nH]cc(CCNC(=O)NNC(=O)C3CCN(c4ncccn4)CC3)c2c1	733346395	DOTLUADWEPITMO-UHFFFAOYSA-N	437.504	1.756	50	20	IDGD	
O=C1CN(S(=O)(=O)c2cccc(C(=O)NNc3nccc4sccc34)c2)CCN1	734246874	LQBMFWFJHBCXDH-UHFFFAOYSA-N	431.499	1.174	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)CCCS(=O)(=O)N1CCCC1	734250682	DUONJWYBODKOEY-UHFFFAOYSA-N	446.595	1.412	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNS(=O)(=O)c2ccc3c(c2)CCO3)CC1	734806979	DQRDPQWABKSHDB-UHFFFAOYSA-N	440.522	1.514	50	20	IDGD	
COc1ccc2cc(C(=O)NNc3ncccc3S(=O)(=O)N3CCN(C)CC3)[nH]c2c1	735118289	QKVIOECGCADDDD-UHFFFAOYSA-N	444.517	1.265	50	20	IDGD	
CC(=O)N1CCCc2ccc(S(=O)(=O)NNC(=O)c3nnc(-c4ccccc4)o3)cc21	736064016	QLWLUPSVOXPJQU-UHFFFAOYSA-N	441.469	1.659	50	20	IDGD	
Cc1ccc([C@@H](CNC(=O)NNC(=O)COCc2ccccc2)N2CCOCC2)cc1	738987800	XVDAOBCRWGZAHJ-OAQYLSRUSA-N	426.517	1.916	50	20	IDGD	
CCCn1nc(C(=O)NNS(=O)(=O)c2ccc(C#N)cc2F)c2ccccc2c1=O	739671060	RWYFEEKMRGDNSL-UHFFFAOYSA-N	429.433	1.441	50	20	IDGD	
C[C@@H]1CN(CC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)CC[C@H]1NC(=O)OC(C)(C)C	740881708	AYMXNLKOMRIWDQ-CZUORRHYSA-N	435.481	1.591	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(CC(=O)NNC(=S)Nc2cccc(Cl)c2)C(=O)C1	741298406	DEJHIMMWZBXTSZ-UHFFFAOYSA-N	441.941	1.737	50	20	IDGD	
CCCc1c(C(=O)NNC(=O)c2cnn(C)c2)nnn1Cc1cccc(Br)c1	741568344	NQCZTNBGGFTEDU-UHFFFAOYSA-N	446.309	1.850	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@@H]2CCC(=O)N2Cc2ccc(C)cc2)c2ccccc2c1=O	742473533	CKEPJGNAAMNGAV-IBGZPJMESA-N	447.495	1.677	50	20	IDGD	
O=C(CCSc1ccc(F)cc1)NNC(=O)CCN1C(=O)[C@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O	742479911	CIKPJSNKOYNMMY-KNCCTNLNSA-N	435.477	1.008	50	20	IDGD	
CCCn1nc(C(=O)NNS(=O)(=O)c2ccc(C(=O)O)cc2F)c2ccccc2c1=O	743249669	JUEPQSGZLNCEPZ-UHFFFAOYSA-N	448.432	1.267	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)NNC(=O)C(F)(F)Oc1ccccc1	743632822	USDWQMSNUHKLGC-UHFFFAOYSA-N	446.370	1.225	50	20	IDGD	
NS(=O)(=O)c1ccc(C(=O)NNC(=O)Nc2ccc(Br)cc2Cl)o1	743831818	YYXROWDLFYOWPZ-UHFFFAOYSA-N	437.659	1.809	50	20	IDGD	
C[C@@H]1CCN(CC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)CCN1Cc1ccccc1	744427767	XZPSTJCWNLHNAQ-QGZVFWFLSA-N	425.489	1.952	50	20	IDGD	
CCOc1ccc(N2C[C@@H](C(=O)OCC(=O)NNC(=O)c3cccc(C)c3)CC2=O)cc1	744461605	KEZSQJJZQSAKLP-KRWDZBQOSA-N	439.468	1.751	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)[C@@H]2CC(=O)N(c3ccccc3Cl)C2)c1	744563362	BQJSYBHVCRALKF-OAHLLOKOSA-N	440.843	1.569	50	20	IDGD	
CSCc1nc2ccccc2n1CC(=O)OCC(=O)NNC(=O)c1ccc(C#N)cc1	744600492	PANVIPBSVXPMRP-UHFFFAOYSA-N	437.481	1.775	50	20	IDGD	
Cc1nc(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)nn1-c1ccccc1	744620144	DETMUJCZBAYXLN-UHFFFAOYSA-N	442.501	1.354	50	20	IDGD	
C[C@H]1C[C@H](NC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])C(=O)N1c1ccccc1	745880777	BAWZBPJWHHFSRV-ZFWWWQNUSA-N	427.417	1.498	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)NCC(=O)NNC(=O)[C@H](CC)c2ccccc2)cc1	746248594	SXYWJTSJASQTAJ-GOSISDBHSA-N	447.513	1.483	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)NNC(=O)c1ccc(Br)s1	747490247	HDDMQOIYUNCBIQ-UHFFFAOYSA-N	437.279	1.376	50	20	IDGD	
COc1cc(OC)cc(N2CC[C@H](NC(=O)NNC(=O)CCc3ccccc3)C2=O)c1	747954199	JVNUOMKJFSLEEG-IBGZPJMESA-N	426.473	1.772	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)NC3CCN(C4CCN(C)CC4)CC3)n[nH]2)cc1	747990672	UTTSOGCTYDBAIH-UHFFFAOYSA-N	439.564	1.888	50	20	IDGD	
Cc1nc(Cl)cc(NNC(=O)[C@H]2CCCN2C(=O)/C=C\c2ccc(C(N)=O)cc2)n1	748333197	BXUKTKJIMVYYFJ-WUKHSURWSA-N	428.880	1.685	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)c(N)c([N+](=O)[O-])c1	749395241	CUWCHFHFXIBMQG-UHFFFAOYSA-N	436.469	1.829	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1	751211711	UKKAWKKHDUGWQK-UHFFFAOYSA-N	431.474	1.838	50	20	IDGD	
C/C(=C\C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1)c1ccc([N+](=O)[O-])cc1	752351755	RGMSDWRPZWDTCH-HGZMWJMZSA-N	441.396	1.529	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1)N[C@H]1CC[C@H](O)CC1	753713983	LZQWELSEWFHVSR-WGSAOQKQSA-N	435.488	1.636	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)c2cc(OC)c(S(N)(=O)=O)s2)cc1	754185740	YLBUYZPMEYABOX-JTQLQIEISA-N	443.503	1.031	50	20	IDGD	
CC(C)C(=O)NCCCNC(=O)NNC(=O)[C@@H](C)Oc1cccc(Br)c1	756050727	MKKPMHWQJRBMNI-GFCCVEGCSA-N	429.315	1.709	50	20	IDGD	
COCCn1ccc(NC(=O)NNC(=O)c2cc(-c3ccc(OC)c(OC)c3)[nH]n2)n1	756310618	FVBCCKFINONPMZ-UHFFFAOYSA-N	429.437	1.403	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)Nc1ccc(F)c(N2CCCS2(=O)=O)c1	756498248	WKGWBEGXQNYDOH-UHFFFAOYSA-N	437.409	1.740	50	20	IDGD	
CNS(=O)(=O)c1ccc(C)c(NC(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)c1	756528047	UGSPRJZQKLHGMN-UHFFFAOYSA-N	443.526	1.361	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2c[nH]nc2-c2ccccc2F)cc1OC	756607850	QWJXUHSMLHZMKH-UHFFFAOYSA-N	442.403	1.851	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCCCSCC(C)C)cc1	756749648	QQYYBKQGCOTETK-UHFFFAOYSA-N	430.596	1.725	50	20	IDGD	
CCOC(=O)[C@@H](C)NC(=O)c1ccc(NC(=O)NNC(=O)Cc2ccc(F)cc2)cc1	756791603	WCAINXONXFENCX-CYBMUJFWSA-N	430.436	1.903	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2nc(SC)ns2)c1	757589622	QXIUSMVTASZESJ-UHFFFAOYSA-N	444.564	1.757	50	20	IDGD	
Cc1nn([C@@H]2CCS(=O)(=O)C2)c(C)c1NC(=O)NNC(=O)c1ccc(O)c(Cl)c1	757871876	QMFOCEKEDWZFEA-GFCCVEGCSA-N	441.897	1.685	50	20	IDGD	
O=C(CC12C[C@H]3C[C@@H](CC(O)(C3)C1)C2)N1CCN(S(=O)(=O)CBr)CC1	758518056	OIEIUIORFCGBFE-QBBMROGASA-N	435.384	1.534	50	20	IDGD	
Cc1cc(Br)ccc1NC(=O)CNC(=O)NNC(=O)C(=O)Nc1ccccn1	758673540	ZOPUDQHIVNJROD-UHFFFAOYSA-N	449.265	1.060	50	20	IDGD	
CC[C@@H](C)NS(=O)(=O)c1ccc(C(=O)NNc2nccc(N3CCOCC3)n2)cc1	762847357	HASOWXWAFYDMAQ-CQSZACIVSA-N	434.522	1.147	50	20	IDGD	
CCCCCn1nc(C(=O)NNc2nccc(N3CCOCC3)n2)c2ccccc2c1=O	762856000	QIRFBTQXPJUYDG-UHFFFAOYSA-N	437.504	1.970	50	20	IDGD	
O=C(NNC(=O)c1ccc2ccccc2n1)C(=O)Nc1ccnc(OCC(F)(F)F)c1	763450635	PDYYACUOKJAPDI-UHFFFAOYSA-N	433.346	1.971	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(-n2cccn2)c(Cl)c1	763453845	CDAQQANXNPYZSC-UHFFFAOYSA-N	428.792	1.834	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2O)cc1N1CCCCC1=O	763530555	XKRCVILXPUQRGA-UHFFFAOYSA-N	426.429	1.317	50	20	IDGD	
O=C(COc1ccccc1-c1ccccc1)NNC(=O)C(=O)Nc1cnn(CC(F)F)c1	763643506	GHWXIPTWLDRFBP-UHFFFAOYSA-N	443.410	1.980	50	20	IDGD	
COC(=O)c1cc(Cl)cc(NC(=O)C(=O)NNC(=O)COc2ccc(C)c(C)c2)c1	763666526	IFWFOWDCROVURH-UHFFFAOYSA-N	433.848	1.908	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2F)n([C@H]2C[C@H]3CC[C@H]2C3)n1	763679867	DWRMVDIXZNRDHO-DZKIICNBSA-N	429.452	1.857	50	20	IDGD	
CCn1nc(C)c(NC(=O)C(=O)NNC(=O)COc2ccc(Br)cc2)c1C	763695537	NRUPAJHAIVKKAT-UHFFFAOYSA-N	438.282	1.447	50	20	IDGD	
O=C(CN1CCCc2ccccc21)NNC(=O)C(=O)Nc1ccc(Br)nc1	763728149	IOYHSORSOXKQKV-UHFFFAOYSA-N	432.278	1.383	50	20	IDGD	
O=C(CSc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1ccn(Cc2ccncc2)n1	763734586	MMQRNBQPRPGSIN-UHFFFAOYSA-N	444.904	1.858	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2ccc(C)c(N3CCOC3=O)c2)c1	763775932	ZGWNTULMYDWOTR-UHFFFAOYSA-N	442.428	1.369	50	20	IDGD	
Cc1cc(C)n(-c2ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc3ccccc3F)cn2)n1	763849365	IUGBOKNHQITDPC-AWEZNQCLSA-N	440.435	1.577	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)C(=O)N(C)CC3)c1C	763849659	LRCHHMQOOCRWDP-OAHLLOKOSA-N	438.484	1.485	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1cccc(N2CCCNC2=O)c1	763872885	PSJGJORYTBITSJ-ZDUSSCGKSA-N	443.435	1.299	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2cc(N3CCCC3=O)ccc2Cl)n1	763886160	RYMLHJXRZJAYLN-UHFFFAOYSA-N	432.868	1.066	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccc(-c3cn4cccc(C)c4n3)cc2)n1	763886824	ZDICPMJSGRGKMX-UHFFFAOYSA-N	445.483	1.909	50	20	IDGD	
COCCn1nc(C)c(NC(=O)C(=O)NNC(=O)CCSc2ccc(F)cc2)c1C	763901397	GFOBTUMMIQQCEP-UHFFFAOYSA-N	437.497	1.554	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(-n3nccn3)cc2)cc1OC	763910300	CWYBDVWNJSXTJB-UHFFFAOYSA-N	438.444	1.464	50	20	IDGD	
CC1(C)CN(C(=O)C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c2cccc(Cl)c21	763921880	RFPMHVYDYLXTCB-UHFFFAOYSA-N	439.863	1.401	50	20	IDGD	
CCOc1cc(N2CCN(C)CC2)ccc1NC(=O)C(=O)NNC(=O)c1ccccc1C	763963167	YALGHNKFOZGZQI-UHFFFAOYSA-N	439.516	1.545	50	20	IDGD	
O=C(NNC(=O)c1cc(Cl)ccc1O)C(=O)Nc1cccc(Cl)c1-n1cncn1	763977467	RIRIVSYUCLPUNZ-UHFFFAOYSA-N	435.227	1.679	50	20	IDGD	
CSc1cc2c(cc1NC(=O)C(=O)NNC(=O)c1cc(Cl)ccc1O)OCCO2	763978194	FYESOOCZKKBHNG-UHFFFAOYSA-N	437.861	1.938	50	20	IDGD	
O=C(NNC(=O)c1ccc[nH]1)C(=O)Nc1ccnn1Cc1ccc(Br)cc1	763979969	PHUQTEQOBLTCGP-UHFFFAOYSA-N	431.250	1.422	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)C(=O)Nc1cnc(-c2ccccc2)nc1	763998265	NZCIJTDUUYNZCU-UHFFFAOYSA-N	429.234	1.634	50	20	IDGD	
COc1cc(Oc2ccccc2)ccc1NC(=O)C(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1	764002679	PVVIKPKLUGODFM-ZDUSSCGKSA-N	447.469	1.008	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(S(=O)(=O)N(C)C(C)C)cc2)c(O)c1	764110002	FDFNDBDYQWHJHR-UHFFFAOYSA-N	448.501	1.129	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(N3CCO[C@@H](C)C3)cc2)c1O	764131500	HKRGEVVNWMEHHN-ZDUSSCGKSA-N	428.445	1.026	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2O1)C(=O)Nc1cccc(Cl)c1-n1cncn1	764162699	DWFBFLMJMYWICQ-HNNXBMFYSA-N	426.820	1.010	50	20	IDGD	
CCN1CCN(c2ccc(NC(=O)C(=O)NNC(=O)c3scnc3C)c(C)c2)CC1	764245803	AYLNKFLROQILFD-UHFFFAOYSA-N	430.534	1.302	50	20	IDGD	
O=C(NNC(=O)c1cc(F)ccc1Br)C(=O)Nc1cnc2c(c1)COCC2	764270216	IJQBGAQVQWAFQU-UHFFFAOYSA-N	437.225	1.456	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccccc2-c2noc(C)n2)c(OC)c1	764284076	IJMPYQUZFVRVNY-UHFFFAOYSA-N	425.401	1.462	50	20	IDGD	
CN1CCN(C(=O)c2ccc(NC(=O)C(=O)NNC(=O)c3cc4ccccc4o3)cc2)CC1	764331013	LXKOMPXVGKSBEL-UHFFFAOYSA-N	449.467	1.220	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2nnc(C(C)(C)C)s2)n[nH]1	764376809	IDODVVPIZKBZNC-UHFFFAOYSA-N	443.489	1.634	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)COc2ccc3c(c2)CCCC3)ccc1Cl	764552299	LPAVMFOBHLTSEO-UHFFFAOYSA-N	437.905	1.706	50	20	IDGD	
CCOC(=O)c1cnn2c(C(=O)NNC(=O)c3cc(-c4ccc(CC)cc4)[nH]n3)ccnc12	764753841	YMSREVCHIQWEFW-UHFFFAOYSA-N	447.455	1.933	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)c(OC)c1	765755952	JKSJQHCZQQMCBV-UHFFFAOYSA-N	446.935	1.936	50	20	IDGD	
CCC(CC)NC(=O)[C@H]1CN(C(=O)C(=O)NNc2nccnc2OC)c2ccccc2O1	766260452	FQSKXMWVYFTWEW-MRXNPFEDSA-N	442.476	1.027	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNS(=O)(=O)c2ccc([N+](=O)[O-])c3cccnc23)c1	766353591	KSKHAWSXVNZLKQ-UHFFFAOYSA-N	432.414	1.784	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)[C@H]1CCc2c[nH]nc2C1	766661183	SMKXIGGGYWYDAI-HNNXBMFYSA-N	430.940	1.133	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1csc(S(C)(=O)=O)c1	767044045	LAMSYLOBXVLHQL-UHFFFAOYSA-N	446.890	1.432	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(COc3ccccc3F)on2)c1	767072924	UWPJFMWJLJJHHJ-UHFFFAOYSA-N	433.417	1.871	50	20	IDGD	
Cc1nc(-c2cccnc2)nc(NNC(=O)CNC(=O)CNC(=O)OC(C)(C)C)c1C	767150161	MPVJIDYBUUFXNU-UHFFFAOYSA-N	429.481	1.239	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)c1cc(Cl)ccc1-n1cnnn1	767282676	MUZMOKNQPOKDHU-UHFFFAOYSA-N	428.836	1.171	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1cc(F)cc2cccnc12	767354936	VGOSOPVAIBAOSM-UHFFFAOYSA-N	435.459	1.593	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)Cc2ccncc2)n(-c2ccc(C(F)(F)F)cn2)n1	768242553	SLOMHJDFHUBNDT-UHFFFAOYSA-N	447.377	1.318	50	20	IDGD	
Cc1ccc(-c2cc(-c3nnc(SCC(=O)NNC(=O)C(C)(C)C)n3N)n[nH]2)cc1	768456032	SEDSWESDFIUZTQ-UHFFFAOYSA-N	428.522	1.643	50	20	IDGD	
Cc1cccc(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)c1Br	769252913	KLADJZPJRHRAJY-UHFFFAOYSA-N	431.246	1.794	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)NCC(=O)N3CCc4ccccc4C3)nc21	770369319	HXUHYFRPWZHAAN-UHFFFAOYSA-N	438.492	1.498	50	20	IDGD	
COc1ccc(N2C[C@H](C(=O)NNC(=O)c3ccc4c(c3)OCCO4)CC2=O)c(OC)c1	770392507	VMNCWDVTGSZKQU-CQSZACIVSA-N	441.440	1.289	50	20	IDGD	
CCNC(=O)N(C)NC(=O)[C@@H](CCSC)NC(=O)c1ccccc1Br	770548177	BGBKSEVTXOPLLB-CYBMUJFWSA-N	431.356	1.993	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)C1CCN(C(=O)c2ccc(F)cc2F)CC1	771900263	HRFIGXDWJXCSNN-CYBMUJFWSA-N	439.459	1.942	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C[C@@H]2CSCCN2C(=O)OC(C)(C)C)c1O	772221172	LSZCAFHSHRCJTM-GFCCVEGCSA-N	425.507	1.904	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)C(=O)Nc2ccc(C)c(S(=O)(=O)N3CCCCC3)c2)n1	773479473	WYMOYDIGYUOLDW-UHFFFAOYSA-N	446.533	1.658	50	20	IDGD	
Cc1nc(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)ccc1Br	773613141	OQILGYXSSQNUOO-UHFFFAOYSA-N	445.277	1.368	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)N[C@H](CS(C)(=O)=O)c1ccccc1	774281195	VGLRWIXQVAIVRS-MRXNPFEDSA-N	435.502	1.580	50	20	IDGD	
Cc1cc(CNC(=O)NNC(=O)c2cccc(OC(F)F)c2)ccc1S(N)(=O)=O	775221224	GHGIVYPHIPYCAP-UHFFFAOYSA-N	428.417	1.388	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@H](C)C2CN(C(=O)OC(C)(C)C)C2)c2ccccc2c1=O	776315780	ZEODPNJXIZPOBD-CYBMUJFWSA-N	443.504	1.680	50	20	IDGD	
COc1cc(C(=O)NNc2cccc(S(C)(=O)=O)c2)ccc1OCC(=O)NC(C)C	776527149	RPABUHOWIVMXOU-UHFFFAOYSA-N	435.502	1.759	50	20	IDGD	
COC(=O)c1ccccc1NNC(=O)c1sccc1S(=O)(=O)N1CCOCC1	777828742	OUEIYVXUNAQDOU-UHFFFAOYSA-N	425.488	1.313	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNS(=O)(=O)c1cc(Cl)c(F)c(C(=O)O)c1	777939260	KLTSYKYTTHBZLH-UHFFFAOYSA-N	425.822	1.012	50	20	IDGD	
COc1cc(C=NNC(=O)CNC(=O)c2cccnc2)c([N+](=O)[O-])cc1OCC(F)F	778545354	RRCYSUKGVINBCI-UHFFFAOYSA-N	437.359	1.522	50	20	IDGD	
O=C(NNC(=O)c1cc(I)ccc1N1CCOCC1)NC1CC1	778586365	RCPPULFINOJSQA-UHFFFAOYSA-N	430.246	1.234	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)N[C@@H]1CCN(c2ccc(Cl)c(Cl)c2)C1	778639340	CKSIXPRFSBXEFU-LLVKDONJSA-N	440.287	1.926	50	20	IDGD	
COC(=O)c1scc(C)c1NC(=O)C(=O)NNC(=O)C(F)(F)Oc1ccccc1	782125297	ZLKKEAWMQFITFO-UHFFFAOYSA-N	427.385	1.601	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNc3ncnc4ccsc34)cn2)C[C@@H](C)O1	783254642	IJJQVPRYTONFJK-TXEJJXNPSA-N	427.490	1.782	50	20	IDGD	
CS(=O)(=O)NCc1ccc(NC(=O)C(=O)NNc2ccccc2C(F)(F)F)cc1	784824808	NMVADFKVBLDGGA-UHFFFAOYSA-N	430.408	1.836	50	20	IDGD	
O=C(NNc1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc2nc(N3CCOCC3)oc2c1	784830766	CNTBTRMYSZFOIY-UHFFFAOYSA-N	426.389	1.654	50	20	IDGD	
CC(=O)N(C)c1cccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)c1	784832952	IKADPVXODIMGRM-UHFFFAOYSA-N	440.428	1.747	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)C(=O)Nc2ccc(C(=O)OC)cc2OC(F)F)c1	784853960	RYWAWXCEMUIMLX-UHFFFAOYSA-N	437.355	1.943	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)N1CC2(CCC2)c2c(F)cccc21	785023459	JCWFADSBPCEABL-UHFFFAOYSA-N	428.376	1.669	50	20	IDGD	
Cc1cc2c(cc1C)O[C@H](C(=O)OCC(=O)NNC(=O)[C@H]1COc3ccccc3O1)C2	786392419	VVWOMOHMGKXAFX-RBUKOAKNSA-N	426.425	1.138	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@@H](C)C(=O)NNC(=O)c1cc(N2CCNC(=O)C2)ccn1	786690019	ZRVOKTWTKGHKCO-AWEZNQCLSA-N	445.907	1.517	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1cc(-c2ccsc2)nn1C	787542920	FURKUJCPCBKUSL-LLVKDONJSA-N	431.449	1.841	50	20	IDGD	
COc1cccc(C[C@H](C(=O)NNc2nnc(-c3ccccn3)s2)n2nnnc2C)c1	788566631	JHVZFBXHUHDTOW-MRXNPFEDSA-N	437.489	1.831	50	20	IDGD	
COc1cc(NNC(=O)NC2CCN(S(=O)(=O)c3cnn(C)c3)CC2)ccc1Cl	789043030	YYINHWDUWPIFBP-UHFFFAOYSA-N	442.929	1.562	50	20	IDGD	
O=C(NNC(=O)[C@H]1CC(=O)c2ccccc21)c1cccc(S(=O)(=O)N2CCCC2)c1	789604895	MZZFHKVTEHPODX-SFHVURJKSA-N	427.482	1.602	50	20	IDGD	
CC[C@@H]1CCc2nc(NC(=O)C(=O)NNC(=O)CNC(=O)c3cccs3)sc2C1	789758316	SCOMPMDEWDQNNS-SNVBAGLBSA-N	435.531	1.235	50	20	IDGD	
O=C(NCc1ccc(S(=O)(=O)CCO)cc1)NNC(=O)c1c(Cl)cccc1Cl	790769216	ZRRZYURYFRXENY-UHFFFAOYSA-N	446.312	1.904	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NC[C@H]2N(C)CCCC2(C)C)cc1	790893400	WBUSSPKJTONMOR-QGZVFWFLSA-N	439.582	1.066	50	20	IDGD	
O=C(CSc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1cccc(N2CCC2=O)c1	790952144	ORSQIHIXIWCSHC-UHFFFAOYSA-N	432.889	1.955	50	20	IDGD	
Cc1nn(-c2ccc(Cl)cc2)c(NC(=O)C(=O)NN[C@]2(C)CCS(=O)(=O)C2)c1C	792279300	ZNDQBVTZRAJQKE-GOSISDBHSA-N	439.925	1.279	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2I)n1	794079597	ARGZACNTCOHDJX-UHFFFAOYSA-N	426.170	1.978	50	20	IDGD	
N#Cc1ccc(N2CCC(C(=O)NNC(=O)CNC(=O)c3cccs3)CC2)c(F)c1	795959462	SUNYVXVKOONBIX-UHFFFAOYSA-N	429.477	1.553	50	20	IDGD	
Cc1ccc(F)c(NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)c1Br	797002694	QSQXNDGZHDZWRM-CYBMUJFWSA-N	436.237	1.986	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)c2ccc(F)c(S(=O)(=O)N3CCOCC3)c2)c1	801186981	ZMAXGCSSBRMAID-UHFFFAOYSA-N	437.449	1.390	50	20	IDGD	
CCCN(C(=O)CCC(=O)C(C#N)=C1N(C)c2ccccc2N1C)[C@@H]1CC(=O)N(C)C1=O	801508663	XZARUGSPKJDFKK-GOSISDBHSA-N	437.500	1.653	50	20	IDGD	
CC(C)[C@@H](NC(=O)c1ccc(Cl)s1)C(=O)NNC(=O)CCN1C[C@H](C)O[C@H](C)C1	801599933	IFTGXRHADNHDJO-IIYDPXPESA-N	444.985	1.803	50	20	IDGD	
O=C(N=c1cc[nH]cc1)NNC(=O)c1ccc(NS(=O)(=O)c2ccc(F)cc2)cc1	802023501	UGIBRIRTQVASEU-UHFFFAOYSA-N	429.433	1.910	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)Nc1ccc(N2CCN(C(=O)C3CC3)CC2)nc1	806247739	OJRUECUHMVIHLJ-UHFFFAOYSA-N	448.491	1.265	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc3c(c2)N(C)CCO3)c1	806305896	AUMXBSOFEMPIOY-UHFFFAOYSA-N	446.529	1.621	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(C(=O)CNC(=O)NNc2ccc3c(=O)[nH]ccc3c2)CC1	806499799	LHNIRPSBRPRIQZ-UHFFFAOYSA-N	444.492	1.234	50	20	IDGD	
O=C1COC[C@@H](C[C@H]2CN(C(=O)C(=O)NNc3ccc(F)cc3F)c3ccccc32)N1	806997357	LHVMZAJXLVPWGO-GXTWGEPZSA-N	430.411	1.443	50	20	IDGD	
Cn1c(=NNC(=O)C(=O)Nc2cc(Cl)cc3c2OCC(=O)N3)sc2ccccc21	806997402	NFQKXTRTRIOSEV-UHFFFAOYSA-N	431.861	1.795	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1csc(N2CCOCC2)n1)[C@@H](c1ccccc1)N(C)C	807402263	FASMUSAYINOBOF-YOEHRIQHSA-N	432.550	1.615	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCCCn2cc(Br)cn2)c1	807613852	SGYKTVFSZVVUPE-UHFFFAOYSA-N	444.311	1.083	50	20	IDGD	
CNC(=O)c1cc(Oc2ccc(NC(=O)NNC(=O)[C@@H](C)OCCOC)cc2F)ccn1	810313023	ZMYGTMWOSFHYCF-GFCCVEGCSA-N	449.439	1.577	50	20	IDGD	
NC(=O)c1ccc(NC(=O)C(=O)NNc2cccc(C(F)(F)F)n2)c(OCC(F)F)c1	810394768	DDUVIERWOSQMSS-UHFFFAOYSA-N	447.320	1.925	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccccc1C(F)(F)F)NNc1ccc(C(F)(F)F)nn1	810728316	QXJMXADAJPSSMU-UHFFFAOYSA-N	443.329	1.936	50	20	IDGD	
COC[C@@]1(CNC(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)OCCc2ccccc21	812476922	CEQWDZLSDFSJDM-HXUWFJFHSA-N	430.417	1.359	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ncc(C(F)(F)F)s1	812980706	ZHZIMWZZHKKQQT-UHFFFAOYSA-N	432.380	1.726	50	20	IDGD	
COC(=O)C(C)(C)c1csc(NC(=O)C(=O)NNC(=O)COc2cc(C)cc(C)c2)n1	815565459	OVAICSGDEMJTHL-UHFFFAOYSA-N	448.501	1.375	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1)C1CC1	815567797	MLPBWKZZCCESOO-UHFFFAOYSA-N	438.440	1.373	50	20	IDGD	
COc1c(Cl)cccc1NC(=O)C(=O)NNc1ccccc1S(=O)(=O)N(C)C	815751963	WJKSJSVSDDHPCW-UHFFFAOYSA-N	426.882	1.681	50	20	IDGD	
O=C(NNC(=O)C1CCN(S(=O)(=O)c2cccnc2)CC1)c1ccc2ccccc2n1	914831332	ILPUUGXHCLFKOE-UHFFFAOYSA-N	439.497	1.492	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)NC[C@H]2CN(Cc3ccccc3)CCO2)nc2ccccc21	915895266	ZBFLPXNXXLZRRG-SFHVURJKSA-N	436.516	1.347	50	20	IDGD	
O=C(NC[C@@H](c1ccccc1)N1CCOCC1)NNC(=O)c1nnc(O)c2ccccc12	916509480	PHAOQIMTHKVQSK-SFHVURJKSA-N	436.472	1.353	50	20	IDGD	
O=C(CN1CCN(C(=O)Cc2c[nH]c3ccccc23)CC1)NNC(=O)c1cccs1	917152947	ZUPKNOTVZOZNOG-UHFFFAOYSA-N	425.514	1.377	50	20	IDGD	
Cc1ccc(NC(=O)[C@@H]2CCCN(C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)C2)nc1	918001916	JOZISHWPEFQVTO-MRXNPFEDSA-N	449.475	1.071	50	20	IDGD	
O=C(CNC(=O)NNC(=O)c1csc(N2CCOCC2)n1)Nc1ccc(Cl)cc1	919783847	XSQYTTIMMHVCHR-UHFFFAOYSA-N	438.897	1.216	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)Nc2cccc(CN3C(=O)CNC3=O)c2)c1C	920932664	AIGJAKLKSXDVCP-HNNXBMFYSA-N	439.472	1.975	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2cc3ccccc3cc2O)cc1	1317737843	ZKGKYKAOUCVMNF-UHFFFAOYSA-N	443.481	1.684	50	20	IDGD	
CCN1C(=O)c2ccc(C(=O)NNC(=O)c3cncn3-c3ccccc3)cc2S1(=O)=O	1317960327	AVTJNSNTIBSODW-UHFFFAOYSA-N	439.453	1.112	50	20	IDGD	
Cc1cnn(CC2CC2)c1NC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	1320411289	LKGYWZAIIKOEML-UHFFFAOYSA-N	425.537	1.967	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCCNC(=O)NNC(=O)c2cncn2-c2ccccc2)s1	1340788398	WAJHBYDATXQVBQ-UHFFFAOYSA-N	448.530	1.165	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnn4cccnc34)C2)C1	1778442754	YAEMEUCUUTZYAS-SCLBCKFNSA-N	436.310	1.204	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnn3ccccc23)C1	1778491636	GFVDRHVNEYKYHA-HGHGUNKESA-N	434.924	1.716	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc4n(n3)CCCC4)C2)C1	1778564135	GQHQEIHKMNTXRI-ACJLOTCBSA-N	425.327	1.446	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@]2(C1)CN(C(=O)C(F)(F)C(F)(F)C(=O)O)CCO2	1779294416	RAHJXLRYGYFHOL-AWEZNQCLSA-N	444.454	1.023	50	20	IDGD	
C[C@@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CO[Si](C)(C)C)C1)C1(O)CCC1	1779538745	GRTIOIRJSGFXKF-SQGPQFPESA-N	426.630	1.903	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(C1)CN(C(=O)C1(F)CCC1)CCO2	1780099111	SUNYAIPVVYVHMK-HXUWFJFHSA-N	449.435	1.856	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cn1nnc3ccccc31)C2	1780700095	MAVPEQICXMKKQH-FQELHTAISA-N	433.940	1.963	50	20	IDGD	
CC[C@@H](NC(C)=O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@](C)(Cl)CCl)C1	1780706226	UEELFENGFWUFMF-OHDICMOHSA-N	436.380	1.651	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](F)Br)C2)n(C)n1	1780771117	DOWXRXYJJSVSGO-CKEIUWERSA-N	431.306	1.547	50	20	IDGD	
Cc1ccn2ncc(C(=O)N3CCO[C@@]4(CCN(C(=O)[C@@H](F)Br)C4)C3)c2c1	1781330912	IRUHVWQJCZKLCT-CRAIPNDOSA-N	439.285	1.777	50	20	IDGD	
C#CCO[C@@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](Br)CC)C1	1781897100	AMKFGYRTXPNWSN-YIOZNXECSA-N	429.355	1.712	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1noc(C)n1)C2	1781901436	MUMVLQCWGGWYSF-PMUMKWKESA-N	443.342	1.608	50	20	IDGD	
O=C(CCc1cnc2[nH]ccc2c1)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2	1782062266	WLWRMLQBOJNOJQ-JBYIUTFZSA-N	448.951	1.609	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)n1cccc1C=O)C2	1782170276	GNLBQZNKQYJQEI-LNNXQNCSSA-N	439.940	1.629	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C=C/c1cc(C)on1)C2	1782175290	GFMLXNQFVQOROL-VFTRUVIOSA-N	425.913	1.764	50	20	IDGD	
C[C@@H](C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Br)C2)n1cccn1	1782557924	MYDMHMPWWCCYJQ-ZOMKSWQUSA-N	431.306	1.649	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)COc3ccc(F)cc3)CCO2)C1	1783532620	LIDMKVFOLPXSIK-UGSOOPFHSA-N	429.286	1.818	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](C)Oc1ccccn1)CCO2	1783540336	UFQNSOPCKPQGOK-SUNYJGFJSA-N	426.311	1.462	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)CSCc3[nH]cnc3C)CCO2)C1	1783877920	RZRKWQDEWXZAOR-KBXCAEBGSA-N	430.958	1.035	50	20	IDGD	
CCOC(=O)c1cc(C(=O)N2CCO[C@]3(CCN(C(=O)C(Cl)Cl)C3)C2)ccn1	1783948525	RSVCMQCUKHVFDK-SFHVURJKSA-N	430.288	1.506	50	20	IDGD	
Cc1nn(C)c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Br)C[C@@H]32)c1F	1785778756	FQOLGCPYWCIDEI-AYGWYOGXSA-N	435.269	1.151	50	20	IDGD	
Cn1c(C(=O)Nc2ccc(C3(NC(=O)c4cccc(B(O)O)c4)CCC3)cc2)cccc1=O	1787244605	LNMBQJMDSHMISW-UHFFFAOYSA-N	445.284	1.127	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)c1cccc2[nH]ncc12	1787309208	SRHUYZFXQROHQX-NUTKFTJISA-N	435.322	1.941	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccn4cncc4c3)[C@H]2C1	1788407770	MRCBCXXCKIYCLU-QCPWZWHMSA-N	435.322	1.711	50	20	IDGD	
COc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)Br)C[C@@H]32)c(O)c1	1789482147	BRBCBICYVYDJRO-LMMLAZSQSA-N	441.322	1.778	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4n(n3)CCC4)C[C@@H]21	1789868174	PRMULJQXSSVGRB-HAHWVIBASA-N	429.348	1.659	50	20	IDGD	
CCn1nc(C)cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]2C1	1789922306	CTOKGAHFSPGKQI-JURCDPSOSA-N	431.306	1.495	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]2C1	1789923394	KZXBQQQXSDNEET-MMROJZCPSA-N	434.133	1.893	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4cccnn4c3)C[C@@H]21)[C@H](F)Br	1789925167	PKIFIRWDNUMHEY-DDWPSWQVSA-N	439.285	1.618	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1ccc(C2CC2)cc1	1790252168	YWWVZYZIMXDXBF-PMVMPFDFSA-N	448.328	1.151	50	20	IDGD	
C=C[C@@H](O)C(C)(C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](Br)CC)[C@H]2C1	1790960681	PVAKXMIWMUPIOJ-UVPYHEFZSA-N	431.371	1.713	50	20	IDGD	
CCOc1ccsc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](Cl)COC)[C@H]2C1	1791250696	JIDXPKNMWUEGRB-YXWQFLTLSA-N	430.954	1.994	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(C#N)cc(OC)c3)C[C@@H]21	1791253694	GEWHLYVTINTBNG-QZHFEQFPSA-N	435.908	1.414	50	20	IDGD	
CCC[C@H](NC(=O)c1ccccc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2	1793066202	AUTVOWFHHUBTBO-FLXSYLCISA-N	439.915	1.709	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1(C#N)CC1)C2	1793880727	FAFVUGHSDNSWBP-XGUBFFRZSA-N	440.928	1.012	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CC(=O)N(Cc2cccs2)C1)[C@@H](O)CCl	1794239444	GXPUQWDRVXUYQK-GAGVYUBLSA-N	439.965	1.335	50	20	IDGD	
O=C1Cc2cccc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)CCBr)c2N1	1795116429	HJKFHDQTADYONM-FVCICTRLSA-N	436.306	1.169	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1scnc1C(F)(F)F	1795360374	HHQUXKOQXIQJBV-ZSBIGDGJSA-N	447.483	1.787	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CNc2ccccc21	1795620407	NFENZTOWMKWTKR-BHUQQCALSA-N	436.350	1.816	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnn(C)c1C)C2	1796889858	MQSQEKKMTJMZNI-XMOXNHLCSA-N	425.493	1.114	50	20	IDGD	
C[C@@H](NC(=O)c1ccccc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CO[Si](C)(C)C	1797958925	BIKREJGFNPAQOK-PHXBYCTMSA-N	447.608	1.246	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1nccc(OC)c1OC	1798765041	OMGBEYRCHIOBID-FQLMCAECSA-N	425.913	1.710	50	20	IDGD	
CCC1(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)/C(C#N)=C/c2ccc(F)cc2F)COC1	1800334516	MXIGRPVEKSTONS-GKEMIQDWSA-N	445.466	1.888	50	20	IDGD	
COC(=O)N(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2)Cc1ccccc1	1800851782	TVYDYCVIKUPXSO-CYGHRXIMSA-N	441.887	1.379	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CCc2ccccc2C1	1801844744	VBUARSRJSSZHRL-MXEMCNAFSA-N	426.561	1.803	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)C#CC2(O)CCCCC2)[C@@H]1c1cccnc1)[C@H](O)CCl	1803142090	ABBHBXDPJPWARF-NLWGTHIKSA-N	433.936	1.386	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC2(CCCN(C(=O)c3cnsn3)C2)CC1	1807604171	OBZKWSNLBVBXOZ-OEAKJJBVSA-N	443.533	1.517	50	20	IDGD	
Cc1[nH]ccc1C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1	1808751079	HBHFOWYMPJIOGI-JXFKEZNVSA-N	447.499	1.350	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)CCN2CCOC2=O)[C@H]1c1cccnc1	1809531014	BBVNQLQWERRCTR-XYJFISCASA-N	438.912	1.184	50	20	IDGD	
COc1ccccc1C(=O)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1	1809970028	ZEHVKJVENFPAIA-UHFFFAOYSA-N	436.317	1.534	50	20	IDGD	
O=Cc1ccc(C(=O)N2CCC3(CCCN(C(=O)c4cccc(B(O)O)c4)C3)CC2)s1	1809976612	KHYSAKAPCAKXPX-UHFFFAOYSA-N	440.330	1.399	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1ccc(O)cc1	1811932694	MVHKELGBZKPWBG-KNQAVFIVSA-N	445.284	1.100	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)c1cnn2cccc(F)c12	1812280601	NQXJFCOMTXQZDT-QGTPRVQTSA-N	445.882	1.788	50	20	IDGD	
CC1(C)CC(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)C1	1813126880	YDLQMIYBKGUXRA-RXVVDRJESA-N	435.333	1.517	50	20	IDGD	
C[C@H](CBr)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCS(C)(=O)=O)[nH]n1	1814783623	QXVJSVIBCUKQLE-YPMHNXCESA-N	449.371	1.868	50	20	IDGD	
C[C@@H]1CCC[C@@H]1C(=O)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1	1815356690	LJDSZPSNAXOQHD-WQVCFCJDSA-N	427.335	1.485	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2nc(C)c(C)[nH]c2=O)n[nH]1	1816116076	ZJWRARBNFCFCKO-JSGCOSHPSA-N	436.900	1.670	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1ccccc1O	1816263295	HWEVLCGBFUCDJM-GOSISDBHSA-N	434.261	1.415	50	20	IDGD	
Cc1cncc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)c1	1816496717	RHOPRERNHKLXDF-IBGZPJMESA-N	433.277	1.413	50	20	IDGD	
C[C@H](C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](F)Cl)sc2C1)[C@@H]1SC(=N)NC1=O	1817121906	UIKGWKZXJFFTEO-KXOWCNOMSA-N	433.918	1.392	50	20	IDGD	
O=C(CN1CCOCC1)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](F)Br)[nH]n1	1817149068	DXERFVUATNZCNO-IUODEOHRSA-N	432.294	1.425	50	20	IDGD	
O=C1CCc2ccc(C(=O)Nc3cc([C@H]4CCCCN4C(=O)[C@H](O)CCl)[nH]n3)nc2N1	1817809130	KRPSRUXJHUDBOU-HUUCEWRRSA-N	446.895	1.595	50	20	IDGD	
CC(C)O[C@@H](C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1819507237	MDUGRKRQXLGUFG-SUMWQHHRSA-N	443.508	1.528	50	20	IDGD	
COC[C@H](NC(C)=O)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CO[Si](C)(C)C)n[nH]1	1819595707	YLHXGYICAXFXCP-HOTGVXAUSA-N	439.589	1.404	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCCC[C@H]1c1cc(NC(=O)CCS(C)(=O)=O)n[nH]1	1822969800	AVXCTZAWDWJMIG-AWEZNQCLSA-N	430.603	1.688	50	20	IDGD	
O=C(c1cnc2c(c1)CCNCC2)N1CCC([C@H]2CCCCN2C(=O)[C@H](O)CCl)CC1	1824188954	WUFSNWMOQLUGFI-NHCUHLMSSA-N	448.995	1.603	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1c(O)cc(O)cc1O)CC2	1826007153	RZTJULLFMYKSAP-WPRPVWTQSA-N	441.893	1.740	50	20	IDGD	
COC1(CC(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cccc(B(O)O)c2)CC3)CCC1	1827405143	XQWGFVXZSOWJBH-HNNXBMFYSA-N	443.334	1.008	50	20	IDGD	
Cc1cc(/C=C/C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)no1	1830364669	OKBZVKDVEWKCHK-DPZZJQGRSA-N	425.913	1.718	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cncc(N(C)C)c3)C2)C1	1831644338	VRKOLTCQXPYXFP-NQIIRXRSSA-N	438.956	1.625	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)Nc3nccs3)C2)C1	1831645585	CMTDPYUXOJZDFN-VCBZYWHSSA-N	444.985	1.807	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)CN2CCCCC2)CC1	1831870783	GJLKDDGEVMMNHD-HXUWFJFHSA-N	435.613	1.465	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1	1831874422	JFAXPFGUMRODAK-GDBMZVCRSA-N	445.402	1.763	50	20	IDGD	
CCc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@](C)(Cl)CCl)C3)C2)cn1	1833892839	UWUJXXXAWCHHKU-WOJBJXKFSA-N	444.359	1.950	50	20	IDGD	
CN(C)c1ncc(C(=O)N2CCO[C@@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)o1	1833895475	ASVOWTWEVSHHJI-IBGZPJMESA-N	428.917	1.076	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cncc(F)c3)CC2)CC1	1834256821	FQEJEIAHVXYUJT-GOSISDBHSA-N	426.920	1.660	50	20	IDGD	
Cc1cncc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)c1	1834285424	PIRPLRXPZJSUSK-YOEHRIQHSA-N	430.274	1.151	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCC(N2CCC(NC(=O)c3cc(O)n[nH]3)CC2)CC1	1834770698	LKKRKWBBTNGRQN-GOSISDBHSA-N	432.352	1.537	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3[nH]nc4ncccc34)CCO2)C1	1836451395	WGNBSODIFXRCPX-QRWLVFNGSA-N	435.912	1.435	50	20	IDGD	
Cc1cccnc1C(=O)N1CCC(OC2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1	1836961293	TYTNLQJEMPPDJE-UHFFFAOYSA-N	445.564	1.375	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)c3ccccc3)CC2)CC1	1837778720	KBDBDUWLKDHFCT-PMACEKPBSA-N	438.952	1.972	50	20	IDGD	
CCc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)nn1C	1838276385	VIEAADVNGAPTBG-OALUTQOASA-N	447.363	1.289	50	20	IDGD	
CC(=O)NCCC(=O)N1CCC(OC2CCN(C(=O)[C@](C)(Cl)CCl)CC2)CC1	1838638655	IQTVUSQWQVWBCW-LJQANCHMSA-N	436.380	1.748	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCBr)C3)C2)cc1	1838964969	MMKGESXFOKQEHU-LJQANCHMSA-N	441.322	1.550	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CN(C)C(=O)OC(C)(C)C)C2)C1	1839143977	NFOKSEKXFUWWJH-MGPUTAFESA-N	447.960	1.327	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1839680500	JNSBRPJCWNUNKL-AUUYWEPGSA-N	434.917	1.269	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ncccc3F)C2)C1	1840034657	SCGSLYOPXCRBCK-SJKOYZFVSA-N	430.274	1.074	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3cccc(O)c3)C2)C1	1840155531	DWUFMDDTUXRGSB-WIYYLYMNSA-N	440.924	1.035	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(F)(F)Cl)CCO2	1840286611	GFTVLGCQOAMHPK-GWCFXTLKSA-N	433.677	1.448	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CCCOC1)CCO2	1840878450	HRACCOGVWWGWQV-MPGHIAIKSA-N	433.343	1.043	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@]2(C(=O)N3CC4(CCCN4C(=O)[C@H](O)CCl)C3)C[C@@H]2C1	1841353497	AHKMOCLQQVVCJT-PZPWOCDFSA-N	441.956	1.437	50	20	IDGD	
C[C@H](Br)C(=O)N1CC2(CCCN2C(=O)Cc2ccc(S(C)(=O)=O)cc2)C1	1842811467	KLPFOHMAFCUMFC-ZDUSSCGKSA-N	443.363	1.619	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC2(CCCN2C(=O)c2ccc3c(n2)NC(=O)CC3)C1	1843233373	LCAXKHBODZCOOZ-ZDUSSCGKSA-N	435.322	1.957	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1ccc3c(c1)COC3)C2	1843415945	GUEGYLIQWAEDST-MFKUBSTISA-N	435.484	1.668	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC2(CCCN2C(=O)Cn2c(=O)n(C)c3ccccc32)C1	1843860200	HXYZYNQLRWHKCZ-AWEZNQCLSA-N	449.349	1.717	50	20	IDGD	
CN(CC(=O)N1CCCC12CN(C(=O)c1cccnc1)C2)NC(=O)NCc1ccccc1	1845038617	ZQEPILSDJIHIIH-UHFFFAOYSA-N	436.516	1.245	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)c1cnc3c(F)c(F)ccc3c1)C2	1846385646	DHQJRNMDJJOWAG-UHFFFAOYSA-N	445.470	1.703	50	20	IDGD	
CCn1c(NNC(=O)c2ccc3c(c2)CCCN3S(C)(=O)=O)nc2ccccc2c1=O	9857375	OSFOJBOPZAJOQQ-UHFFFAOYSA-N	441.513	1.886	50	20	IDGD	
Cn1cc(/C=C/C(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)cn1	15427604	IJGLLFZVDWHKIH-ZHACJKMWSA-N	439.497	1.373	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2ccc(CS(C)(=O)=O)cc2)c2ccccc2c1=O	17189292	OECOWXROEHBSQK-UHFFFAOYSA-N	428.470	1.036	50	20	IDGD	
CCOC(=O)NNC(=O)c1cccc(NC(=O)C[C@H]2SC(N3CCCCC3)=NC2=O)c1	21771981	HDQXSOCLWYDEPL-OAHLLOKOSA-N	447.517	1.890	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)CN(C)C(=O)c2cccs2)c2ccccc2c1=O	28428844	IGZRDCKSJXFSPE-UHFFFAOYSA-N	427.486	1.572	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)CCc2nc(-c3ccccc3)no2)c2ccccc2c1=O	28580438	PCZHUPALACZMFU-UHFFFAOYSA-N	432.440	1.860	50	20	IDGD	
COc1ccccc1C(=O)NCC(=O)OCC(=O)NNC(=O)c1cc(Cl)ccc1OC	28853487	UGQGQIOPSBOVPC-UHFFFAOYSA-N	449.847	1.091	50	20	IDGD	
O=C(NNC(=O)[C@@H]1C[C@@H]1c1ccc(Br)cc1)c1ccc(-n2cnnn2)cc1	109764439	SQXBOVWXCMISFV-HZPDHXFCSA-N	427.262	1.990	50	20	IDGD	
O=C(NCCc1ccn(-c2ccccc2)n1)NNC(=O)c1nn(-c2ccccc2)cc1O	725867756	KOUJTOXDPZCBDG-UHFFFAOYSA-N	431.456	1.950	50	20	IDGD	
COC(=O)N1CCC[C@@H](NC(=O)NNC(=O)[C@@H](C)Oc2cccc(Br)c2)C1	726610555	LNYJMCBGJPNTMR-DGCLKSJQSA-N	443.298	1.778	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@H](c2ccccc2)N2CCN(C)CC2)c2ccccc2c1=O	727765119	HJXWGYHGGOILFM-NRFANRHFSA-N	448.527	1.166	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)c2cc(Cl)c(OCC(N)=O)c(OC)c2)cn1	729692003	HHSZDFLFDSWLRQ-UHFFFAOYSA-N	439.881	1.248	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)N2CCN(CC(=O)N[C@@H]3CCC[C@@H](C)C3)CC2)cc(C#N)n1C	731198681	JOKWQPYMNZVOKA-GBGLKESISA-N	436.560	1.951	50	20	IDGD	
Cc1c(C(=O)NNC(=O)Cn2ccc3ccccc32)nnn1-c1cccc2c1CCN(C)C2	731462740	UIWPUNZGPMLNDE-UHFFFAOYSA-N	443.511	1.980	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@@H]2C(=O)NNC(=O)c2ccccc2OC)c(OC)c1	731493451	YRGPTKZUBXRYKX-QGZVFWFLSA-N	427.457	1.778	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])o1)c1cc(Br)c[nH]1	731875203	WAYQOWKBDMEIGP-JTQLQIEISA-N	440.210	1.344	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)Sc1nnc(-c2ccc(OC(F)F)cc2)n1N	731904699	PHBMCJHEWAKVAA-SNVBAGLBSA-N	428.465	1.934	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN(C)[C@H]2CCN(c3ccccc3Cl)C2=O)n1	732206847	HNRWQKOCYJBAED-HNNXBMFYSA-N	435.937	1.532	50	20	IDGD	
CN(CC(=O)NNc1ccccc1S(=O)(=O)NC(C)(C)C)c1ncnc2[nH]cnc12	734252162	GCHFMNCERACMCH-UHFFFAOYSA-N	432.510	1.009	50	20	IDGD	
Cc1nc(-c2ccccn2)nc(NNC(=O)CNC(=O)c2c[nH]c3ccccc3c2=O)c1C	734257134	GSSPJJCYQRBVRA-UHFFFAOYSA-N	443.467	1.870	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNS(=O)(=O)c2ccc(Cl)nc2)CC1	734807460	QLOKEDCLJQNGMC-UHFFFAOYSA-N	433.918	1.627	50	20	IDGD	
CC(C)n1cnnc1SCC(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	734825708	MUZOXCULBPYQSH-UHFFFAOYSA-N	441.558	1.681	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@H]2CCCc3nc(C)ncc32)cc1	734953533	JNWDBUBSQSWCNH-SFHVURJKSA-N	446.533	1.122	50	20	IDGD	
CC(C)Cc1ccc(C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)cc1	735117539	WAGYBUPAEPZDDS-UHFFFAOYSA-N	431.562	1.973	50	20	IDGD	
CSc1ccc(C)c(C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)c1	735118519	WCTDOILGZNLUNQ-UHFFFAOYSA-N	435.575	1.805	50	20	IDGD	
C[C@@H]1OC(C)(C)N(C(=O)OC(C)(C)C)[C@H]1C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	735876490	SCANSHYJTARBLO-SWLSCSKDSA-N	445.480	1.184	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2cn(CC(=O)C(C)(C)C)nn2)c2ccccc2c1=O	742242350	YUIWJZGUEZNXDU-UHFFFAOYSA-N	439.476	1.088	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCCN(C)C(=O)/C(C#N)=C\c2cc(C#N)n(C)c2C)cc1	742892503	UCHGSCAFGHCKIQ-WQRHYEAKSA-N	425.514	1.858	50	20	IDGD	
CN(C)C(=O)c1cccc(S(=O)(=O)NNC(=O)c2cccc(Br)c2)c1	743264450	UFICHOAROQXPLA-UHFFFAOYSA-N	426.292	1.774	50	20	IDGD	
C[C@H](C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1)n1cnc2ccccc21	744619762	XNPHVGGAZFXATR-OAHLLOKOSA-N	429.502	1.762	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)C(=O)Nc1ccc(Cl)cc1	744620856	PHTSCSWKGYHHRN-UHFFFAOYSA-N	438.893	1.443	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(\C#N)C(=O)NC[C@@H]2CCC[C@@]23NC(=O)NC3=O)c1C	744625547	AWRWMULFTPFWAY-HSRCFYJQSA-N	427.505	1.714	50	20	IDGD	
CC(C)c1nnc(CCC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)o1	746812949	KZPQYGJJWGZSLQ-UHFFFAOYSA-N	435.506	1.371	50	20	IDGD	
CS(=O)(=O)CCCNC(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1	747867563	ZKWRJCNIJAPRGW-HXUWFJFHSA-N	444.557	1.379	50	20	IDGD	
C[C@]1(c2ccc(C(=O)NNC(=O)Cc3nc(-c4ccccc4)cs3)cc2)NC(=O)NC1=O	748518419	BRHVMOKPROJHFA-JOCHJYFZSA-N	449.492	1.868	50	20	IDGD	
NS(=O)(=O)c1ccc(N2CCOCC2)c(C(=O)NNc2cc(F)c(F)c(F)c2)c1	748813183	XECCESKBRFYOTC-UHFFFAOYSA-N	430.408	1.345	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(CS(=O)(=O)C(F)F)cc2)c1	751564233	PBHPNSZVPIRILI-UHFFFAOYSA-N	446.453	1.302	50	20	IDGD	
Cc1cc(F)cc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1[N+](=O)[O-]	752556033	VVSFLTHKQWPQHP-HNNXBMFYSA-N	433.348	1.187	50	20	IDGD	
C[C@H]1C[C@@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)CN1C1CC1	753942867	IDFNUQCJHGMNNF-DOTOQJQBSA-N	449.577	1.430	50	20	IDGD	
CC(C)CCn1nc(C(=O)NNS(=O)(=O)c2cn(C(C)C)cn2)c2ccccc2c1=O	753949604	QRSIHLNXIQMEPY-UHFFFAOYSA-N	446.533	1.843	50	20	IDGD	
CON(C)S(=O)(=O)c1ccc(NC(=O)NNC(=O)c2cc(Br)c[nH]2)cc1	755535541	PWCWRXZFCZDPET-UHFFFAOYSA-N	446.283	1.426	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)ccc1N1C(=O)CCC1=O	756556646	PIOUFZHSQBIIBX-UHFFFAOYSA-N	434.416	1.091	50	20	IDGD	
CCCS(=O)(=O)Nc1ccc(NC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1	756571719	JRWOCYPDVWTTIM-QGZVFWFLSA-N	434.474	1.831	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)Nc1ccc2c(c1)C(=O)NCC2	756618253	RSNPOKNKOYQMTQ-UHFFFAOYSA-N	433.262	1.967	50	20	IDGD	
C[C@@H]1CCc2c(sc3nc(CCC(=O)NNc4ccc(C(N)=O)nn4)nc(O)c23)C1	757399099	MIVSAHHVDDPCBH-SECBINFHSA-N	427.490	1.487	50	20	IDGD	
COC(=O)c1csc(NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)c1	757680385	PDTOAQLSYXBKBW-UHFFFAOYSA-N	440.503	1.317	50	20	IDGD	
C#CC[C@@H](NC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1)c1ccccc1	757759536	DRRSCBVTYPHTAM-LJQANCHMSA-N	428.514	1.711	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)c2cc(Br)ccc2n1	758046739	JQVWBCNDWDTIMI-VIFPVBQESA-N	429.296	1.004	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCCCSc1nccs1	759601833	PCUCZOLDYMNURS-UHFFFAOYSA-N	442.592	1.871	50	20	IDGD	
C[C@H](CO)CCCNC(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	759634431	XEPBDJLYUZPPER-INIZCTEOSA-N	437.504	1.741	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)N=c1cc[nH]cc1I	760034972	RLVSJJBAIXELTB-UHFFFAOYSA-N	436.213	1.531	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)c1cccc(S(=O)(=O)NC2CC2)c1	761625161	FMUXLRHUWQFLNU-UHFFFAOYSA-N	435.527	1.689	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)NCc1ccc2c(c1)CCS2(=O)=O	761735316	TZWBXVDJBKWGOE-UHFFFAOYSA-N	435.527	1.648	50	20	IDGD	
C[C@H](NS(=O)(=O)c1ccc(C(N)=O)cc1)C(=O)NNC(=O)c1cccc2ccccc12	763051638	GLLHPEHDPCSONB-ZDUSSCGKSA-N	440.481	1.067	50	20	IDGD	
COc1ccc(NC(=O)c2cccc(NC(=O)C(=O)NNC(=O)c3cccnc3)c2)cn1	763491767	NKKQNPMWLBYZQU-UHFFFAOYSA-N	434.412	1.137	50	20	IDGD	
COC1CCN(c2ccc(NC(=O)C(=O)NNC(=O)C3CC3)cc2C(F)(F)F)CC1	763558466	QHYMDYFYRNFMKK-UHFFFAOYSA-N	428.411	1.817	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(OCC(F)(F)F)nc1	763647800	QREDKLKWELJTDR-UHFFFAOYSA-N	442.350	1.196	50	20	IDGD	
CCn1nnnc1-c1cccc(NC(=O)C(=O)NNC(=O)COc2ccc(C)c(C)c2)c1	763667070	PCRJJIHSHCGYTO-UHFFFAOYSA-N	437.460	1.142	50	20	IDGD	
O=C(COc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1cccn(CC(F)(F)F)c1=O	763686727	RFIOTIOEKVKBSD-UHFFFAOYSA-N	446.769	1.229	50	20	IDGD	
COC(=O)Nc1cc(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)ccc1F	763746298	RXOLFFZTXGHIOU-UHFFFAOYSA-N	443.435	1.543	50	20	IDGD	
Cc1nc(-c2ccc(NC(=O)C(=O)NNC(=O)CN3CCCc4ccccc43)cc2)n[nH]1	763746396	UDGWOYVGKCIYPQ-UHFFFAOYSA-N	433.472	1.319	50	20	IDGD	
CO[C@H](C)C(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2cccc(N(C)C)c2)c1	763758059	MZWKSPYKRSWZSN-CYBMUJFWSA-N	427.461	1.126	50	20	IDGD	
CN1CCCN(c2ccc(NC(=O)C(=O)NNC(=O)c3cccc(N(C)C)c3)cc2)CC1	763760925	WLSGQRQHXLRCQM-UHFFFAOYSA-N	438.532	1.294	50	20	IDGD	
Cc1cccc(NC(=O)C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)c1C#N	763790269	HTIZHMHQIURSRK-UHFFFAOYSA-N	432.440	1.557	50	20	IDGD	
Cc1coc(-c2ccc(C)c(NC(=O)C(=O)NNC(=O)COc3ccccc3C#N)c2)n1	763806851	FMKCLFDWWZWPAA-UHFFFAOYSA-N	433.424	1.995	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cc(C(=O)OC)cs2)cc1	763861853	RFHBBFIYNQDGLM-NSHDSACASA-N	435.458	1.487	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccccc1SCCC(N)=O	763864579	KVGYBWFWIDHXLI-LBPRGKRZSA-N	448.476	1.347	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)NNC(=O)C(=O)Nc1ccc(CN2CCOC2=O)cc1	763865747	UIGXBKMKZYCWPV-UHFFFAOYSA-N	435.440	1.449	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)CC(C)C)n([C@H]2CCN(Cc3ccccc3)C2)n1	763888781	QQGDHRXKVLGBQQ-SFHVURJKSA-N	426.521	1.771	50	20	IDGD	
O=C(NNC(=O)c1ccc(Br)s1)C(=O)Nc1ccn(Cc2ccncc2)n1	763941277	PLIITCYMXOBPFF-UHFFFAOYSA-N	449.290	1.550	50	20	IDGD	
Cc1ccc(C(=O)N2CCSCC2)cc1NC(=O)C(=O)NNC(=O)c1ccccc1C	763956816	XTLZERJPAGTWAZ-UHFFFAOYSA-N	440.525	1.892	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3cc(Cl)ccc3O)cn2)C[C@H](C)O1	763973547	BBBQNBODJSYNLM-RYUDHWBXSA-N	447.879	1.454	50	20	IDGD	
Cc1nc(-c2cccc(NC(=O)C(=O)NNC(=O)c3cc(Br)c[nH]3)c2)no1	763995058	LCEHSUDITIDOQZ-UHFFFAOYSA-N	433.222	1.535	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)n(-c2ccc(F)cc2)n1	764003643	KUYCUDKLVMKTAM-UHFFFAOYSA-N	439.403	1.491	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1ccc(OCCC(N)=O)cc1	764013537	ZCWDNLHYAGPBMW-UHFFFAOYSA-N	434.836	1.003	50	20	IDGD	
O=C(NNC(=O)c1cccc(C(F)(F)F)c1)C(=O)Nc1ccc(C(=O)NC2CC2)cc1	764041210	XDIMOJJRJWVMHV-UHFFFAOYSA-N	434.374	1.997	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ccc(F)cc2Br)cn1C	764085694	YQEFMYQBBYYMKG-UHFFFAOYSA-N	441.213	1.113	50	20	IDGD	
COc1ccc(Cn2nccc2NC(=O)C(=O)NNC(=O)c2cccc(OC)c2O)cc1	764131090	MUVFIBDNELJAIF-UHFFFAOYSA-N	439.428	1.054	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2O1)C(=O)Nc1ccc(-n2cncn2)c(Cl)c1	764167794	MIXWHYRZUGVHSU-MRXNPFEDSA-N	426.820	1.010	50	20	IDGD	
COc1cccc(-c2nsc(NC(=O)C(=O)NNC(=O)CCc3ccccc3O)n2)c1	764288514	JBICJOMQYCDXLR-UHFFFAOYSA-N	441.469	1.638	50	20	IDGD	
C[C@H]1COCCN1c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)cc1	764346134	UKGIRMFFWGJAAA-LBPRGKRZSA-N	432.864	1.670	50	20	IDGD	
Cc1ccc(C(=O)Nc2ccccc2)cc1NC(=O)C(=O)NNC(=O)Cc1ccncc1	764356277	SWRONAHPJFJIQV-UHFFFAOYSA-N	431.452	1.971	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)C(=O)Nc1ccnn1Cc1ccccc1F	764366165	KLMFQAKAUQONQM-UHFFFAOYSA-N	425.420	1.373	50	20	IDGD	
COC(=O)c1c(C2CC2)csc1NC(=O)C(=O)NNC(=O)CSc1ccccc1O	764394182	PBNJPJAMYVMPHE-UHFFFAOYSA-N	449.510	1.996	50	20	IDGD	
COc1ccccc1COc1cccc(NC(=O)C(=O)NNC(=O)[C@@H]2COCCO2)c1C	764431936	GYCMBIKUAFFYOO-IBGZPJMESA-N	443.456	1.084	50	20	IDGD	
CCOc1cc2c(cc1NC(=O)C(=O)NNC(=O)c1cncc(NC(C)=O)c1)O[C@@H](C)C2	764432567	GFKWDMCYMOUIAE-NSHDSACASA-N	441.444	1.162	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N[C@H](C)[C@H]2CCOC2)cc1	765097675	MTKLCKDLGFLQNI-HVVZCKNESA-N	437.500	1.882	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3ccc(C(=O)N(C)C)cc3)CC2)cc1	765749863	VKSKAVKLNGALLY-UHFFFAOYSA-N	437.544	1.276	50	20	IDGD	
COC(=O)c1coc(C(C)=NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c1	766428399	FUYIVLJROKPROG-UHFFFAOYSA-N	435.458	1.241	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3c(C)c4ccccc4oc3=O)CC2)cc1	766647304	DFWSIBPLCZHPSD-UHFFFAOYSA-N	448.523	1.989	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)Cc2cc(F)c(F)cc2F)CC1	768095772	ZWYXMWDYWYPPQW-UHFFFAOYSA-N	443.451	1.121	50	20	IDGD	
COc1cc2c(cc1NC(=O)C(=O)NNC(=O)COc1ccc(Cl)cc1)NC(=O)CC2	768233328	NETCRAHHVYKXNM-UHFFFAOYSA-N	446.847	1.398	50	20	IDGD	
COc1cc2c(cc1NC(=O)C(=O)NNC(=O)c1cc(-c3ccccc3)[nH]n1)NC(=O)CC2	768234312	SGIRXALEVFDLGJ-UHFFFAOYSA-N	448.439	1.370	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)c2ncccc12	768239327	KCMGPOMROBDTMQ-UHFFFAOYSA-N	436.424	1.804	50	20	IDGD	
O=C(NNC(=S)Nc1ccccn1)[C@H]1CCCN(S(=O)(=O)Cc2ccccc2)C1	768584127	KNGUSRYEUQZILE-INIZCTEOSA-N	433.559	1.641	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CN2C(=O)N[C@](C)(c3ccc(F)c(Cl)c3)C2=O)c(O)c1	770223434	SEPSWPZKYBQNRV-HXUWFJFHSA-N	448.838	1.721	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)N1CCN(C(=O)c2ccccn2)CC1	770647597	NGYAWOBFMRMRSV-CQSZACIVSA-N	431.880	1.701	50	20	IDGD	
CCN1CCN(c2cccc(NC(=O)C(=O)NNC(=O)C(C)(C)c3ccccc3)c2)CC1	770771689	MIKSTIZLJWUCIF-UHFFFAOYSA-N	437.544	1.892	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)C1(S(=O)(=O)c2ccc(Cl)cc2)CCCC1	771974433	KWILUNRFHHFZNH-LBPRGKRZSA-N	430.910	1.916	50	20	IDGD	
COc1ccc([C@@H]2[C@H](C(=O)O[C@@H](C)C(=O)NNC(=O)CC(C)C)CCC(=O)N2C)cc1	772136631	MWEBIDRJCGMRLJ-JNAXZKDPSA-N	433.505	1.730	50	20	IDGD	
CNC(=O)COc1cccc(CC(=O)NNC(=O)c2cc(Br)ccc2O)c1	772460786	NDMICZOZPXHMQE-UHFFFAOYSA-N	436.262	1.283	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCCNC(=O)NNC(=O)[C@H](C)Oc2ccccc2F)s1	772632058	VOXLZJWZMLPYFL-LBPRGKRZSA-N	444.510	1.272	50	20	IDGD	
CC(C)OCCCn1c(NNC(=O)c2nn(C)cc2[N+](=O)[O-])nc2ccccc2c1=O	772916739	HZHXNGKHYBHNBE-UHFFFAOYSA-N	429.437	1.610	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)Nc1ccc(C[C@@H]2NC(=O)NC2=O)cc1	775708098	NFFHCFUDSMWUQU-KRWDZBQOSA-N	433.428	1.089	50	20	IDGD	
COC(=O)C1(c2ccc(S(=O)(=O)NNC(=O)[C@@H]3COc4ccccc4O3)cc2)CC1	776271909	LLPFLKRFILMCBN-KRWDZBQOSA-N	432.454	1.041	50	20	IDGD	
C[C@H]1CN(C(=O)CCC(=O)C(C#N)=C2N(C)c3ccccc3N2C)CCN1S(C)(=O)=O	776720749	IKSVSAMZIMIGMF-HNNXBMFYSA-N	445.545	1.149	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H](CC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)C1	777773902	JZVZWFIIINSBLN-ZDUSSCGKSA-N	425.507	1.498	50	20	IDGD	
CCO[C@H]1C[C@](NC(=O)OC(C)(C)C)(C(=O)NNC(=O)Cn2nc(C)cc2C)C1(C)C	780171228	HTYHZXQMXBVONH-BTYIYWSLSA-N	437.541	1.746	50	20	IDGD	
COCC(=NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1)C1CCCC1	780235482	KKRKUXVKGAZFMJ-UHFFFAOYSA-N	436.578	1.610	50	20	IDGD	
Cc1c(C(=O)NNC(=O)CCNC(=O)OC(C)(C)C)nnn1-c1cccc2cccnc12	780971284	NERDQMDRKLZQRY-UHFFFAOYSA-N	439.476	1.800	50	20	IDGD	
COC(=O)c1cc(C(=O)NNC(=O)[C@@H]2Cc3ccccc3CN2Cc2ccccc2)on1	781421509	GUYQTWAGOOJQGV-IBGZPJMESA-N	434.452	1.849	50	20	IDGD	
CCNC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)c1	782894141	MNWTWSNMIQCIQX-UHFFFAOYSA-N	437.460	1.043	50	20	IDGD	
Cc1cn(-c2ccccc2)nc1NC(=O)C(=O)NNC(=O)Cc1nc2ccccc2n1C	782894415	UQNKRWTWHFUDBF-UHFFFAOYSA-N	431.456	1.396	50	20	IDGD	
CCN1CCN(c2ccc(NC(=O)C(=O)NNc3ccc(-n4cccn4)nn3)c(C)c2)CC1	783433191	NQRLGKWGPGMWDY-UHFFFAOYSA-N	449.519	1.194	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNC(=O)CNC(=O)c2ccco2)c(C(F)(F)F)c1	784005034	XIMHIMWENNBHAI-UHFFFAOYSA-N	442.350	1.213	50	20	IDGD	
CN(C)C(=O)Cn1cc(NC(=O)C(=O)NNc2ccc(Br)cc2Cl)cn1	784840625	BWQRKNRUOHWMMN-UHFFFAOYSA-N	443.689	1.469	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)C(=O)N1CCc2ccc(Br)cc21	785061471	XIRWLZXBVXKEEK-UHFFFAOYSA-N	442.273	1.376	50	20	IDGD	
C[C@H](CNC(=O)C(=O)Nc1ccccc1S[C@H](Cl)C(F)(F)F)S(N)(=O)=O	785300588	VPUVHFYUADEZAO-KRTXAFLBSA-N	433.861	1.638	50	20	IDGD	
CC(C)OCCCn1c(NNC(=O)[C@H]2CCC[C@H](C(N)=O)C2)nc2ccccc2c1=O	786979244	KNAFUCVKSGZTEP-HOTGVXAUSA-N	429.521	1.946	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NCc2nc(-c3cccc(F)c3)no2)c2ccccc2c1=O	787410613	LWKRIWZVIZVEQG-UHFFFAOYSA-N	437.391	1.267	50	20	IDGD	
Cc1nc(Cn2nnc(C(=O)NNc3ccc([N+](=O)[O-])cc3Br)c2C)no1	787540586	GYMGHOVJSBHKHM-UHFFFAOYSA-N	437.214	1.754	50	20	IDGD	
Cc1ccc(CN2CC[C@@H](NC(=O)NNC(=O)C(=O)Nc3ccc(C)c(C)c3)C2=O)cc1	790695313	NAOXBYBHCWUVSF-LJQANCHMSA-N	437.500	1.682	50	20	IDGD	
COc1cc(C(F)(F)F)ncc1NC(=O)C(=O)NNC(=O)[C@H]1COc2ccccc2O1	792268724	PSPTUPDBRZUJOD-CYBMUJFWSA-N	440.334	1.035	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(C)(C)[C@H]1C(=O)NNC(=O)c1csc(N2CCOCC2)n1	792811654	ZUDDRCHDWFMHGK-CYBMUJFWSA-N	439.538	1.386	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(C)(C)[C@@H]1C(=O)NNC(=O)c1csc(N2CCOCC2)n1	792811656	ZUDDRCHDWFMHGK-ZDUSSCGKSA-N	439.538	1.386	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)N([C@@H]2CCS(=O)(=O)C2)N(C)C)N(C)c2ccccc21	792855338	REXBISVNRWJRKC-OAHLLOKOSA-N	445.545	1.149	50	20	IDGD	
O=C(NNC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1)C(=O)Nc1cccc(F)n1	793022316	VGDJLPQHJTWSFN-UHFFFAOYSA-N	445.414	1.868	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)NCCCCn1cc(Br)cn1	793117076	NZVMQNQVXRRBIB-UHFFFAOYSA-N	433.307	1.281	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(C)(C)[C@@H]1C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	793424654	SXQYQRQJUCSCHW-HNNXBMFYSA-N	432.525	1.486	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNS(=O)(=O)c1ccsc1	795336409	SEMFPSVYVMNDFG-UHFFFAOYSA-N	428.967	1.529	50	20	IDGD	
CCNC(=O)N(C)NS(=O)(=O)c1cc(C(=O)OCC)c(Br)cc1F	795933392	RKGZLFSPVPYLOB-UHFFFAOYSA-N	426.264	1.620	50	20	IDGD	
N#Cc1ccc(NNC(=O)C(=O)Nc2cc(S(=O)(=O)N3CCCC3)ccn2)cc1Cl	797092438	IZKPJBKRILUPAA-UHFFFAOYSA-N	448.892	1.473	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)C2(c3cccc(Cl)c3)CC(=O)C2)n1	798687038	UCYHVCMPMWQZMT-UHFFFAOYSA-N	435.889	1.639	50	20	IDGD	
O=C(CSCC(=O)N1CCOCC1)NNc1cc([N+](=O)[O-])ccc1Br	800620551	UHJCJBDULMRYKT-UHFFFAOYSA-N	433.284	1.392	50	20	IDGD	
CCn1c(NNC(=O)c2ccc(F)c(S(=O)(=O)N(C)C)c2)nc2ccccc2c1=O	801115141	SSFGHBGPCGNZBE-UHFFFAOYSA-N	433.465	1.563	50	20	IDGD	
Cn1cnc(S(=O)(=O)NCC(=O)NNC(=O)Nc2ccc(-c3ccccc3)cc2)c1	802037234	AROFKQKLABDXIL-UHFFFAOYSA-N	428.474	1.218	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)c2ccc3c(c2)S(=O)(=O)N(C2CC2)C3=O)cc1	802123652	UKLZBVLRWROOGT-UHFFFAOYSA-N	443.485	1.526	50	20	IDGD	
Cc1ccc(Br)c(S(=O)(=O)NCCNC(=O)NNC(=O)C(C)(C)C)c1	805096400	PFHANXIMCQELBV-UHFFFAOYSA-N	435.344	1.412	50	20	IDGD	
COc1ccc([C@H](CNC(=O)NNC(=O)COc2ccccc2F)N2CCOCC2)cc1	806999067	XXIVBDZIXCYANK-IBGZPJMESA-N	446.479	1.617	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1c(C)c(C(F)(F)F)nn1C	807027528	WKGVTAMSNOATTE-UHFFFAOYSA-N	449.411	1.241	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@@H]1C[C@@H](c2ccccc2)OC1=O	809556817	OKKIMHGLHIIQTL-GJZGRUSLSA-N	430.486	1.354	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)CNS(=O)(=O)c2c(Cl)cccc2Cl)nc1	810755587	XHXWAZBSCJNGMG-UHFFFAOYSA-N	433.273	1.597	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)NCc2ccc(CC(N)=O)cc2)cc1Cl	811921478	CCGZNJZHRQBBAJ-UHFFFAOYSA-N	435.868	1.921	50	20	IDGD	
CCOCc1nc([C@H](C)NC(=O)NNC(=O)COc2ccc(Br)cc2)no1	812569188	YNLZXBQFCUZYMX-JTQLQIEISA-N	442.270	1.839	50	20	IDGD	
CCC[C@@H](NC(=O)Cc1ccccc1)C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	812729725	SBMUXHLZZLAEFY-LJQANCHMSA-N	432.546	1.908	50	20	IDGD	
Cc1cc(C)c(S(=O)(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)s1	814209938	HKAOXOIERXDMBX-UHFFFAOYSA-N	443.572	1.773	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)Nc1cc(Br)c(=O)n(C)c1	814668430	RXYQKUORLGIZGO-UHFFFAOYSA-N	444.311	1.547	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)Cn2nc(C)cc2C)cc1)[C@@H]1C[C@H]1C	815566653	ALGMMVMEKGGAFM-KZULUSFZSA-N	426.477	1.047	50	20	IDGD	
O=C(CC1CC1)NNC(=O)C1CCN(S(=O)(=O)c2ccc3c(c2)OCCCO3)CC1	819118306	QIYUDUAXMUAIQT-UHFFFAOYSA-N	437.518	1.196	50	20	IDGD	
C[C@@H](Oc1ccccc1Cl)C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	914587034	MYJGOFQIWUBMFO-SJKOYZFVSA-N	434.832	1.638	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)c2cc(S(=O)(=O)N3CCCCC3)cn2C)cc1C	914846615	RCLFWNVKJINZJS-UHFFFAOYSA-N	448.545	1.657	50	20	IDGD	
O=C(CCn1ccccc1=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	915045985	PDRVEBVSFBKAGJ-UHFFFAOYSA-N	446.510	1.562	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)CNC(=O)c1c[nH]c2ccccc2c1=O	915357506	QREJJWFOUVURDC-LBPRGKRZSA-N	426.404	1.012	50	20	IDGD	
Cc1nc2ccccc2n1CCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	916196113	YABCFFZQIFNKEN-UHFFFAOYSA-N	444.517	1.239	50	20	IDGD	
CNS(=O)(=O)c1ccc(CNC(=O)NNC(=O)COc2cc(C)cc(C)c2)s1	916233418	XDKRXSYFEHKAAL-UHFFFAOYSA-N	426.520	1.182	50	20	IDGD	
CN(C)CCOc1cccc(CNC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c1	916387743	WNYWMVPRLSKTFP-UHFFFAOYSA-N	438.488	1.018	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NC[C@@H](C)N2CCC[C@@H](C)C2)nc1	916450228	HNYBOPLFWQPCMY-HZPDHXFCSA-N	426.587	1.859	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)COc1ccccc1F)N1CCN(c2ccccc2)CC1	916514981	WIXMHUPLQWWKOR-QGZVFWFLSA-N	429.496	1.746	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=S)Nc2cccc(S(=O)(=O)N(C)C)c2)cc1C	916546734	YLQBIWGLIZSXPG-UHFFFAOYSA-N	449.558	1.510	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)N1CCc2ccccc2C1	916605082	OSNBNDPISAKMFA-HNNXBMFYSA-N	434.500	1.324	50	20	IDGD	
CCCOc1ccc(C(=O)NNS(=O)(=O)c2cccc(C(=O)N(C)C)c2)cc1OC	917727178	FSBANDPHBZHPNM-UHFFFAOYSA-N	435.502	1.809	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)CNC(=O)c2ccc(F)c(F)c2)c2ccccc2c1=O	918277250	ASYVSBSXDJQDOV-UHFFFAOYSA-N	443.410	1.276	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2ccccn2)cc1S(=O)(=O)Cc1cc(C)no1	919805384	SLFRVNPJGGRMHM-UHFFFAOYSA-N	430.442	1.435	50	20	IDGD	
Cc1cc(-c2cc(C(=O)NNC(=O)N[C@@H]3CCS(=O)(=O)C3)c3c(C)noc3n2)c(C)o1	919889783	UDTVMXGTLIRFRB-GFCCVEGCSA-N	447.473	1.539	50	20	IDGD	
O=C(Cc1coc(-c2ccccc2)n1)N1CCN(S(=O)(=O)CBr)CC1	1254721315	QBWUMDQRHNVJAN-UHFFFAOYSA-N	428.308	1.711	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Nc2ccccc2S(=O)(=O)N1)c1ccc(Br)s1	1322337307	BJRGRYXXIBVEPV-LLVKDONJSA-N	431.293	1.002	50	20	IDGD	
Cc1cn2c(=O)c(C(=O)NNC(=O)C3CCN(C(=O)OC(C)(C)C)CC3)cnc2s1	1341682988	HOPHPWDMKXXNPR-UHFFFAOYSA-N	435.506	1.473	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4cnccc4n3)C2)C1	1777736600	YHZSPJJBALNRQM-YJYMSZOUSA-N	433.306	1.857	50	20	IDGD	
O=C1Cc2cc(C(=O)N3CC[C@]4(C3)CN(C(=O)[C@@H](F)Br)CCO4)ccc2N1	1778392669	IKIJYWPMAWMGIJ-QAPCUYQASA-N	440.269	1.315	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4c(c3)NC(=O)CO4)C2)C1	1778574181	OLRKEUZMMNUMNA-OAQYLSRUSA-N	435.908	1.726	50	20	IDGD	
COCc1c[nH]c(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](Cl)COC)C3)c1	1780050810	UBHHSUFFTMASMU-WRWLIDTKSA-N	427.929	1.542	50	20	IDGD	
COC(=O)c1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)cn1	1781329344	DWWJKMVUIBMASS-DYVFJYSZSA-N	444.257	1.002	50	20	IDGD	
O=C(c1cc2ncccc2[nH]1)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781333835	SCDHUCQSSDDBHW-RHSMWYFYSA-N	425.258	1.697	50	20	IDGD	
O=C(c1ccc(N2CCCCC2)cc1)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1781711931	WFDZJBRCTDHSGA-KNQAVFIVSA-N	435.952	1.720	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCSC(=N)N)C2	1781998009	MHOMPFUUMDLQJS-XHBSWPGZSA-N	435.388	1.300	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(N(C)C)cn1)C2	1782171256	WAIGIKBGDAIUPB-YRISNDGFSA-N	438.956	1.529	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cn1nc(C)cc1C)C2	1782171313	ZQMGKHKJKKFNOG-MBOZVWFJSA-N	426.945	1.268	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)Cn1ccnc1)C2	1782178499	NEZDAHVJVVCQRP-TVKQPGBESA-N	426.945	1.287	50	20	IDGD	
CSCC[C@@H](O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@](C)(Cl)CCl)C2	1782232280	FHXYEPMHJUFZDX-DTTOXWODSA-N	441.421	1.851	50	20	IDGD	
COc1ccc(CCC(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)c(OC)c1	1782991787	UNNVUFUOFOPVAN-UWJYYQICSA-N	440.924	1.066	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cn4cccnc4n3)CCO2)C1	1783349228	KGDRUXBQBDFYRJ-ACJLOTCBSA-N	436.310	1.346	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H]3CCCO3)C2)C1	1783480942	DPNOTOXSFWUAKF-WIYYLYMNSA-N	447.444	1.143	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)CCc3ccc4c(c3)OCO4)CCO2)C1	1783876059	LRXLDKAPVADEJT-HRAATJIYSA-N	438.908	1.432	50	20	IDGD	
C[C@H](S)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2	1783886544	RHTBGMAGRFCFQK-LXIYXOSZSA-N	435.974	1.267	50	20	IDGD	
CCN1CCC(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]3C2)CC1	1783975012	CZMQDMLQBXJCMS-UBDQQSCGSA-N	444.414	1.729	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3CCC3)[C@H]2C1	1786301545	MNHPFPYLUQLUCJ-QAETUUGQSA-N	443.972	1.898	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)c3ccccc3)[C@H]2C1	1786671808	XDLYWPSBEHKVHX-JVNPIMRCSA-N	425.323	1.483	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc4ccnn34)C[C@@H]21	1788763376	COPYWNPMDZQDCL-IEZWGBDMSA-N	430.581	1.779	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cn4cccnc4n3)C[C@@H]21	1788764212	DGEXLGDPMMLMMZ-ZOBUZTSGSA-N	431.569	1.174	50	20	IDGD	
Cc1n[nH]c(C)c1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)CBr)C[C@@H]21	1788815530	QMBRCFZKNJCNPQ-HJPIBITLSA-N	427.343	1.651	50	20	IDGD	
CCCNC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]2C1	1791055176	MQLKICIRVXXFIK-QPSCCSFWSA-N	432.359	1.056	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3C[C@]3(F)Cl)[C@H]2C1	1791367677	RLWGVWVJVSHMRE-TUIVPAFXSA-N	425.726	1.922	50	20	IDGD	
NC(=O)c1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Br)C[C@@H]32)cc1	1791897307	LETJHKBNIZARHR-AJNGGQMLSA-N	442.285	1.069	50	20	IDGD	
COc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)CBr)nc1	1792867804	HVXFUYONEOFESQ-NFFDBFGFSA-N	426.311	1.324	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(C=O)s1)C2	1792867852	NCFZRCHLHNVVCG-MCYUEQNJSA-N	429.336	1.795	50	20	IDGD	
CC(C)(CCl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1n[nH]c3c1CS(=O)(=O)C3)C2	1792881987	IKFGTPCHTIAJLZ-ZSBIGDGJSA-N	428.942	1.355	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CCc2ccccc2[C@@H]1O	1793182791	HYKLXJXNKATQSX-JMGGBPHFSA-N	442.560	1.294	50	20	IDGD	
CC(C)N1CCC(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)CC1	1794053115	HQWHBUJVKTWOOH-BCDXTJNWSA-N	442.564	1.057	50	20	IDGD	
CN(CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1(C#N)CC1)NC(=O)NCc1ccccc1	1795849235	FESAZGOAXTXXOM-REPLKXPHSA-N	438.532	1.275	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc(Cl)cc1[N+](=O)[O-])C2)[C@H](F)Cl	1796361356	ONXYCYJEHDLMPA-OJXGSEEGSA-N	434.251	1.915	50	20	IDGD	
Cn1ncc2c(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)c3cnccc3C(=O)NN)C4)cccc21	1797633683	AGPJQZZSOUNCTD-QDMKHBRRSA-N	447.499	1.137	50	20	IDGD	
C[C@@H](Nc1ccccn1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2	1797973120	UEIDZKBRYCZFOH-VWPFQQQWSA-N	425.327	1.257	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cn2cccnc2n1	1798043213	OSHWXNPZCKSWLI-LCFLCXBCSA-N	448.487	1.115	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccncn1)C2	1799219677	GHJCDTYSHSNGTO-QDMKHBRRSA-N	439.428	1.876	50	20	IDGD	
C[C@H](Cc1ccccn1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Br	1799351844	COVZHDATHUZRDH-QUEVPRLRSA-N	428.302	1.540	50	20	IDGD	
COc1cc(C)cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Br)C3)c1	1799452397	XFCKZMFZPFIDFM-XRGAULLZSA-N	429.286	1.897	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1ccc(O)c([N+](=O)[O-])c1	1799483297	HKTUZROVGSOHJT-RDBQEKCUSA-N	446.229	1.194	50	20	IDGD	
Cc1cc(C)n2ccc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@@H](C)Br)C4)c2n1	1800138470	VDGDLCHBYVTKOV-PNBKFKSVSA-N	449.349	1.938	50	20	IDGD	
COc1ccc(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](O)CCl)C3)c([N+](=O)[O-])c1	1800235199	KBVWWSHFOBEFCK-UMPJEAMMSA-N	425.869	1.384	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnn2c1CCC2	1800977597	HEPMIQLCBZJJQX-MVRRYPJTSA-N	437.504	1.215	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)CNCP(=O)(O)O)[C@@H]1c1cccnc1	1803688437	BOYXWJKIHRNKKW-HLLBOEOZSA-N	446.872	1.220	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccccc1[N+](=O)[O-]	1804344962	PPCRTXLNGBPAIA-KHHBSJNCSA-N	443.504	1.619	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@H]1c1cccnc1)c1ccc[n+]([O-])c1	1804783586	HRMNPJACVHLVJC-BPUTZDHNSA-N	437.269	1.725	50	20	IDGD	
Cn1nc(C(F)(F)F)cc1C(=O)N1CCC2(CCCN(C(=O)[C@H](O)CCl)C2)CC1	1805522020	CWGSTLHZAPTXBQ-CYBMUJFWSA-N	436.862	1.883	50	20	IDGD	
CCS(=O)(=O)CC(=O)N1CC[C@@H](CNC(=O)CCBr)[C@H]1c1cccnc1	1806342316	MIMLQTWFNKQIJP-WMLDXEAASA-N	446.367	1.307	50	20	IDGD	
O=C(CN1CCCC1=O)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@@H]1c1cccnc1	1806926313	YRYMTKVCUNKEIH-XKQJLSEDSA-N	441.301	1.400	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)C2CC3(CCC3)C2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807366852	HPZXKBLTMHCIMP-KNQAVFIVSA-N	447.344	1.661	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)c1cnn2ncccc12	1808167147	NDJHDAYPLIUIIF-BMGDILEWSA-N	428.880	1.044	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2ncn(C(C)C)n2)[C@@H]1c1cccnc1	1808721515	NICJESKREYEIRJ-IKGGRYGDSA-N	434.928	1.827	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)c1ccc2nonc2c1	1809126438	DMUBUCICFYGHGT-JCGIZDLHSA-N	429.864	1.537	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC2(CCCN(C(=O)C[C@@H](N)c3cccnc3)C2)CC1	1809895520	VCAUXDMJPPLPFW-LJQANCHMSA-N	444.580	1.076	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1CCN(C(=O)CCN2CCOC2=O)[C@H]1c1cccnc1	1810546037	LIJRYBDBAXCUOM-PXNSSMCTSA-N	448.596	1.781	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCC2(CCCN(C(=O)[C@@H](N)CN)C2)CC1	1810858812	JHSKCVMVKRLWAP-XLCPLWEUSA-N	431.487	1.389	50	20	IDGD	
Cc1ccn(C)c1C(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1813072370	GRQPQMSNKKVVIO-AVRDEDQJSA-N	440.548	1.421	50	20	IDGD	
O=C(Cn1ccccc1=O)Nc1nc2c(s1)C[C@H](NC(=O)CCBr)CC2	1815442792	BWQXKJMBRWKWLI-LLVKDONJSA-N	439.335	1.702	50	20	IDGD	
COc1ccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)cn1	1815443909	ISIVCOIOUALLRD-MRXNPFEDSA-N	443.508	1.492	50	20	IDGD	
Cc1noc(CC(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@H](F)Br)CC3)n1	1815565910	RODONVRLVPSWCC-KRTXAFLBSA-N	432.275	1.680	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)COc2ccccc2)n[nH]1	1816861753	AHZJNTJMJDNORD-GOSISDBHSA-N	442.520	1.854	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)CC(F)(F)C(=O)O)sc2C1	1817095789	NWDXFCPPRANBHJ-RNFRBKRXSA-N	440.266	1.949	50	20	IDGD	
O=C(CC(F)(F)C(=O)O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](F)Br)CC2	1817096354	MQMJJCUEYZPUCY-CDUCUWFYSA-N	444.229	1.856	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)cc(O)n1	1817471891	UTPMOOIBLKFPKX-SFHVURJKSA-N	449.276	1.118	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)CCc2cccnc2)n[nH]1	1817637025	ZEMNETGXERHZOT-SFHVURJKSA-N	441.536	1.803	50	20	IDGD	
Cc1cc(C(=O)NCC(=O)Nc2cc([C@H]3CCCCN3C(=O)[C@H](F)Cl)[nH]n2)no1	1819466898	IAZSLTWSSSEVBR-DOMZBBRYSA-N	426.836	1.663	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](C)O)CC2	1821305035	YZMBRFRORRIXKW-MWLCHTKSSA-N	448.457	1.583	50	20	IDGD	
O=C(N[C@@H]1CCc2nc(NC(=O)c3ccccc3F)sc2C1)c1cccc(B(O)O)c1	1821849014	XUVTUKHMFASFMG-CQSZACIVSA-N	439.277	1.502	50	20	IDGD	
COc1cc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)n(C)n1	1825478408	GEXIUFMTTUJQGL-QGZVFWFLSA-N	448.568	1.035	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnoc1C1CC1)CC2	1826080322	AYZUDRHBDGFMLG-GFCCVEGCSA-N	446.533	1.607	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H]3CCc4nc[nH]c4C3)sc2C1	1826626156	RQOMJGVYVZBZPT-WOPDTQHZSA-N	437.953	1.837	50	20	IDGD	
CCc1cc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)n[nH]1	1827054882	NYKHRZRCQUKPIS-NRFANRHFSA-N	438.337	1.199	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2nc[nH]n2)CC1	1827680939	YNVLKUANWKJKAJ-YSGZUTGPSA-N	440.508	1.172	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)COC(=O)C(F)(F)F)CC1	1828834247	DIJZPIPOKHGAAB-UONOGXRCSA-N	442.862	1.965	50	20	IDGD	
COC(=O)C12CC(C(=O)N3CCOC[C@@]4(CN(C(=O)C(C)(C)CCl)CCO4)C3)(C1)C2	1830365903	JJYHYJJEKFRGBC-XVAXZDLZSA-N	442.940	1.051	50	20	IDGD	
O=C([C@H]1C[C@H]1c1ccc(F)cc1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1830423047	YTGMZGBTQLGBCM-OGNFBWPZSA-N	428.863	1.920	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)c1ccccc1)CCO2	1832231993	LQOFGGHTOSVHEF-SQGPQFPESA-N	428.888	1.407	50	20	IDGD	
COc1cscc1C(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)CCl)CC2)CC1	1833310781	SDQPLOPFCUJBNW-INIZCTEOSA-N	429.970	1.542	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC(N2CCC(NC(=O)Cc3cnccn3)CC2)CC1	1833372602	QANNVBRCMKBAIX-UHFFFAOYSA-N	433.629	1.442	50	20	IDGD	
Cc1nc(C(=O)N2CCO[C@]3(COCCN(C(=O)CCBr)C3)C2)ccc1F	1833460252	CJGUTPJBZJLDJV-SFHVURJKSA-N	444.301	1.384	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)[C@@H]3CCC(=O)N3C)CC2)CC1	1833532965	CCIWAEBZNBTHHF-MSOLQXFVSA-N	426.989	1.586	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)s1	1833959271	CBAWSVWIMKSLSC-XJKSGUPXSA-N	435.315	1.817	50	20	IDGD	
O=C(Cn1ccnc1)NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1834266734	GVYWXPYDZXJHGZ-MRXNPFEDSA-N	430.322	1.145	50	20	IDGD	
Cc1ncsc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1834267673	FLAOTQPDCMXONP-WFASDCNBSA-N	436.303	1.212	50	20	IDGD	
C[C@@H](Cc1ccco1)C(=O)N1CCOC[C@]2(CN(C(=O)CCBr)CCO2)C1	1834826691	TWMJEDZTEHASSW-KXBFYZLASA-N	443.338	1.700	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3ccc(-n4cccn4)nc3)CC2)CC1)[C@@H](F)Cl	1835083950	BJQPJGLCEMJPPE-LJQANCHMSA-N	448.930	1.987	50	20	IDGD	
Cc1cc(CC(=O)NC2CCN(C3CCN(C(=O)[C@@H](C)Br)CC3)CC2)n[nH]1	1835788757	ZTFIQFNQWBYDDI-CQSZACIVSA-N	440.386	1.616	50	20	IDGD	
COc1cc(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)ccc1O	1836302326	RFCZVGIFNNDYHI-SFHVURJKSA-N	439.940	1.186	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C1(F)CCCCC1)CCO2	1836620379	OLVAZGUDZOJPJI-YOEHRIQHSA-N	435.334	1.899	50	20	IDGD	
O=C(C1CCC(CO)CC1)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836715056	IDQQCHFTDFVITL-LADRWXRNSA-N	430.973	1.383	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3c[nH]c4nccc-4c3)C2)C1	1837711666	NDPKENPPDLFHEG-OAQYLSRUSA-N	446.580	1.436	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(F)nc1)CCO2	1837847179	PMAHKOCHXBJPAU-LJQANCHMSA-N	425.533	1.142	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(F)n1)CCO2	1837907713	AMFPSZLFLPHKDS-LJQANCHMSA-N	425.533	1.142	50	20	IDGD	
Cc1nc(F)ccc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)Br)C2)C1	1838268634	RRAODRZBWZGHLD-XIKOKIGWSA-N	444.301	1.383	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3nnsc3C3CC3)C2)C1	1839144900	ODATUERNLNIULT-ACJLOTCBSA-N	428.942	1.503	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4ncsc4[nH]3)C2)C1	1839145634	NRRUFXGHWIYHRS-XIKOKIGWSA-N	426.926	1.712	50	20	IDGD	
C[C@H](Cn1cccn1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2	1839150573	QFSMRQHXCZYFPB-AYOQOUSVSA-N	447.363	1.212	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1	1839153656	NKNJTLSUDJMWOF-IRXDYDNUSA-N	441.428	1.531	50	20	IDGD	
O=C(/C=C/C1CCCC1)N1CCO[C@]2(COCCN(C(=O)CCBr)C2)C1	1839178243	QYWKRLWMLQJLJT-UEKDZROGSA-N	429.355	1.974	50	20	IDGD	
O=C([C@@H](F)Br)N1CCO[C@@]2(COCCN(C(=O)C3(F)CCCCC3)C2)C1	1839201483	ZDABASDWLKDTKT-CJNGLKHVSA-N	439.297	1.806	50	20	IDGD	
CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)/C(C#N)=C/c1ccc(Br)cc1)CCO2	1839743658	JBPWPNJRFSZORB-OTJDAXFFSA-N	448.317	1.832	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)(Cl)Cl)CCO2	1839923268	VRUOCORZSOFZKO-MFKMUULPSA-N	438.135	1.067	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3CCCCN3C)C2)C1	1839961867	LQOWFKDNTUNWQT-BXWFABGCSA-N	446.386	1.101	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccccn3)C2)C1	1839964624	XMUPDGDFBMORTE-VQIMIIECSA-N	440.338	1.254	50	20	IDGD	
Cc1noc(C)c1CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)Br)CCO2	1840030333	IVXVZOLGLVZPSF-KPZWWZAWSA-N	444.326	1.074	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(F)nc3)C2)C1	1840033564	IZJIEFIBRJGGHV-SJCJKPOMSA-N	430.274	1.074	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@](F)(C(=O)N2CC3(CCCN3C(=O)[C@H](O)CCl)C2)C1	1841351089	FZYWSNGTXMYTQT-BFUOFWGJSA-N	433.908	1.139	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC2(CCCN2C(=O)c2c(Br)cnn2C)C1	1843605428	MFOGTGFFLWVQLV-SECBINFHSA-N	434.132	1.783	50	20	IDGD	
COc1ccc([C@@H]2C[C@@H]2C(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)cc1	1844263523	NHUFGHAGUMPHNY-OALUTQOASA-N	449.511	1.314	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)C1CN(C(=O)c3ccccc3OC)C1)C2	1845162731	LGHUGOBENGYMAA-KRWDZBQOSA-N	433.936	1.988	50	20	IDGD	
Cc1cc2nnc(C(=O)N3CC4(CCCN4C(=O)[C@](C)(Cl)CCl)C3)c(C)n2n1	1845170672	IUYZUDLPOGPCAK-QGZVFWFLSA-N	425.320	1.794	50	20	IDGD	
O=C([C@H](O)CCl)N1CC2(CCCN2C(=O)c2cn3cccc(Br)c3n2)C1	1845650964	OBOUIPRUQWECFL-CYBMUJFWSA-N	441.713	1.514	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC12CN(C(=O)[C@@H](CCO)NC(=O)OC(C)(C)C)C2	1846175157	IGKAERXDPRUUHY-CHWSQXEVSA-N	448.358	1.249	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@H](NC(C)=O)c1ccc(F)cc1)C2	1846363336	CVIASAQYHBAKDM-IAGOWNOFSA-N	425.888	1.460	50	20	IDGD	
O=C(c1n[nH]c2ccc(Br)cc12)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl	1847560635	YLTZFJOYZYQQMX-IHRRRGAJSA-N	441.713	1.741	50	20	IDGD	
C=CCO[C@H](C)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O	1847811775	SJLZKZYKKGGBCM-BVGQSLNGSA-N	431.445	1.927	50	20	IDGD	
CC(C)CC(=O)NNC(=O)c1cccc(NS(=O)(=O)c2ccc3nnn(O)c3c2)c1	10160819	WISIHHRMEOJQDK-UHFFFAOYSA-N	432.462	1.277	50	20	IDGD	
Cc1oc(-c2ccccc2)nc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	16593836	CICAALCCSISREL-UHFFFAOYSA-N	428.470	1.975	50	20	IDGD	
COc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NNC(=O)Cc2c[nH]c3ccccc23)cc1	21969872	VIQLJJZAWRWGFZ-ZDUSSCGKSA-N	430.486	1.233	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)c1cn(Cc2ccccc2)nn1	24633043	UEHJENSOYDUKGD-UHFFFAOYSA-N	433.516	1.300	50	20	IDGD	
N#CCCNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cc(-c3ccccc3)on2)cc1	27261558	SYDWLIKMNIOIJM-UHFFFAOYSA-N	439.453	1.608	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNS(=O)(=O)c1cc([N+](=O)[O-])ccc1OC	28808109	WXMRRBAXUZWCGQ-UHFFFAOYSA-N	425.419	1.391	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2ccc(S(=O)(=O)C(C)C)cc2)cc(OC)c1OC	46899622	QXIJABIIJSNFCO-UHFFFAOYSA-N	436.486	1.969	50	20	IDGD	
CCn1c(S)nc2cc(C(=O)NNC(=O)[C@H]3COc4ccccc4O3)ccc2c1=O	103437317	LBMJVOMXGFTGKV-MRXNPFEDSA-N	426.454	1.306	50	20	IDGD	
CC1(C)CC(=O)c2cc(C(=O)NNc3ccc(S(=O)(=O)NC4CC4)cc3)c(=O)[nH]c2C1	111157455	XSRMAMSWKXGKND-UHFFFAOYSA-N	444.513	1.728	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C1CCN(C(=O)/C=C\c2ccccc2)CC1	214022282	BIADLKCJPZZOLR-XPTLAUCJSA-N	435.480	1.926	50	20	IDGD	
O=C(NNC(=O)c1ccc[nH]1)c1ccc(NS(=O)(=O)c2ccc3c(c2)OCCO3)cc1	726629603	KMAQCHXEJVMINJ-UHFFFAOYSA-N	442.453	1.662	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(C(=O)CNC(=O)NNc2ccc(OC(F)F)cc2)CC1	726707513	CRQQSDSWVFUUEK-UHFFFAOYSA-N	443.451	1.993	50	20	IDGD	
CC[C@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	727114410	RGWQFLHMSXGWIH-AWEZNQCLSA-N	428.511	1.001	50	20	IDGD	
CC[C@@H](C)C(=O)NNS(=O)(=O)c1cc(S(=O)(=O)N(CC)CC)ccc1Cl	728260908	WFONQEJXNUXSLW-LLVKDONJSA-N	425.960	1.726	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C[C@@H](c2ccccc2)N2CCOC2=O)c2ccccc2c1=O	728264155	AIXAYHWQPKZBNV-SFHVURJKSA-N	449.467	1.761	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNS(=O)(=O)c2cccc3c2OCCO3)c1	728508211	KYDVIYHTPAJZNL-UHFFFAOYSA-N	443.275	1.852	50	20	IDGD	
O=C(CCC(=O)c1ccc2c(c1)OCCO2)NNC(=O)C1CCN(c2ncccn2)CC1	728889690	MFMDZRJTVNEMTC-UHFFFAOYSA-N	439.472	1.275	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1	730825661	RNTDWOKQQKNNIQ-MRXNPFEDSA-N	447.540	1.423	50	20	IDGD	
COc1ccc(-c2nnc(S)n2CC(=O)NNC(=O)COc2ccccc2O)cc1	730836506	RXIVLCMOQXZFRY-UHFFFAOYSA-N	429.458	1.174	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCc3sccc3C2)c1	731853143	RTYCTAHODUGVKB-UHFFFAOYSA-N	445.526	1.601	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)c2ccc(COc3ccc(C#N)cc3)o2)C[C@@H](C)O1	732261721	FNVHFIRWXXAVSG-HZPDHXFCSA-N	426.473	1.991	50	20	IDGD	
Cc1nc2c(c(C)nn2C)c(C)c1CCC(=O)NNC(=O)CCN1C[C@@H](C)O[C@H](C)C1	732262974	YJJYYYNPMQCDAT-ZIAGYGMSSA-N	430.553	1.473	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CNC(=O)c2ccc(F)cc2F)cc1Br	732305554	NZMMAROTTJTVAY-UHFFFAOYSA-N	442.216	1.927	50	20	IDGD	
CCn1c(S)nc2cc(C(=O)NNC(=O)c3cnn(-c4ccccc4)c3)ccc2c1=O	733170890	GUCHFDGUMFMLKA-UHFFFAOYSA-N	434.481	1.966	50	20	IDGD	
Cn1c(NNC(=O)CCS(=O)(=O)c2ccc3c(c2)OCCO3)nc2ccccc2c1=O	733263563	JEAKDECCUNBOEF-UHFFFAOYSA-N	444.469	1.012	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNS(=O)(=O)c2ccccc2[N+](=O)[O-])CC1	734807536	UJHNDDONAMKUPX-UHFFFAOYSA-N	443.482	1.487	50	20	IDGD	
CN(CC(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1)C(=O)OC(C)(C)C	734825237	WOZJNUPBJBALHC-UHFFFAOYSA-N	429.518	1.583	50	20	IDGD	
Cc1ccc(-n2c(NNC(=O)c3cn(C)c(=O)n(C)c3=O)nc3ccccc3c2=O)c(C)c1	735054895	ZUJJOQIRKZLWRY-UHFFFAOYSA-N	446.467	1.157	50	20	IDGD	
CNC(=O)CCCNC(=O)NNc1ccc(S(=O)(=O)NC2CCCCCCC2)cn1	735582780	RGXLSKAHPASTOA-UHFFFAOYSA-N	440.570	1.625	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)c3nonc3C)c2)cc1	735836618	LOKKXGZKVCHQRB-UHFFFAOYSA-N	431.430	1.262	50	20	IDGD	
O=C(COC(=O)c1cc2c(nc1O)CCCCC2)NNC(=O)c1cccc([N+](=O)[O-])c1	738754180	HZCHQDABVBAXGK-UHFFFAOYSA-N	428.401	1.582	50	20	IDGD	
Cc1cccc([C@@H](C)C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c1	739471719	MCVYHXOSRDBIAZ-MRXNPFEDSA-N	431.514	1.581	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)CN2CCN(C(=O)OC(C)(C)C)CC2=O)cc1	741206980	HWAFEQJYJDEWIW-UHFFFAOYSA-N	436.534	1.314	50	20	IDGD	
Cc1nn(C)c2sc(C(=O)N[C@@H](C)C(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)cc12	742031964	UPHRDKYOWDOELL-JTQLQIEISA-N	430.446	1.431	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CSc2nnc(N3CCOCC3)n2CC(C)C)c1	742451491	QOGANXWTNTVARF-UHFFFAOYSA-N	432.550	1.632	50	20	IDGD	
CC(C)(C)OC(=O)N(CC(=O)NNC(=O)c1nn(-c2ccccc2)cc1O)CC1CC1	743292653	HPNJTEHKIYFVQQ-UHFFFAOYSA-N	429.477	1.986	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)CCNS(=O)(=O)/C=C/c2ccccc2)c1	744561176	OGWSCLNIEFJGDM-ACCUITESSA-N	445.497	1.280	50	20	IDGD	
CC(=O)[C@@H]1CC(C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)=NN1c1ccccc1	745030032	RVSODHHXELZIGD-IBGZPJMESA-N	433.424	1.086	50	20	IDGD	
CC[C@H](NC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)c1ccncc1	745835797	DCPHXNBGHAQTPR-KRWDZBQOSA-N	433.538	1.190	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)N[C@@H]2CC(=O)N(CCOc3ccccc3)C2)c1	745848239	SKJQXPMPQVTOHR-GOSISDBHSA-N	440.500	1.693	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)COc2ccc(Br)cc2)nc2nc(O)nc(O)c12	746094627	NVCJFNJVVUQJHL-UHFFFAOYSA-N	448.233	1.347	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1)[C@H]1CCS(=O)(=O)C1	747787795	VXHYUZHBGNXDPZ-VQTJNVASSA-N	427.526	1.196	50	20	IDGD	
COc1cc(OC)cc(N2CC[C@H](N(C)CC(=O)NNC(=O)c3ccc(C)cc3)C2=O)c1	747967250	QEDFZBIVIOFJCM-FQEVSTJZSA-N	440.500	1.511	50	20	IDGD	
COc1cc(OC)cc(C(=O)NCC(=O)NNc2nc(-c3ccccn3)nc3c2CCC3)c1	748337695	LYVYUSSQQRJCLV-UHFFFAOYSA-N	448.483	1.918	50	20	IDGD	
COc1ccc(-c2nnc(S)n2CC(=O)NNC(=O)COc2ccccc2OC)cc1	751202143	JLFOYFSNUMDNJJ-UHFFFAOYSA-N	443.485	1.477	50	20	IDGD	
CCN1CCc2nc3ccccc3c(C(=O)NNC(=O)CNC(=O)c3cccs3)c2C1	751206536	NRHQESUDZLZFST-UHFFFAOYSA-N	437.525	1.865	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)NNC(=O)c2cc3c(s2)CC[C@H](C)C3)ccc1F	752399074	FOOCURYDSSQCIN-JTQLQIEISA-N	425.507	1.995	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCCC(=O)NNc2nc3ccccc3c(=O)n2C)cc1	752909327	SWSOERTXHHJNRU-UHFFFAOYSA-N	445.501	1.144	50	20	IDGD	
CO[C@@H](C)c1nc(CNC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cs1	753059019	WGJNWONENBDCIZ-INIZCTEOSA-N	446.577	1.893	50	20	IDGD	
CC(C)C[C@@H](CCO)CNC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	754373663	FSUNHKHXGQYBMZ-MRXNPFEDSA-N	440.566	1.460	50	20	IDGD	
CC[C@]1(c2ccccc2)NC(=O)N(NC(=O)COC(=O)/C(C#N)=C\c2ccc(O)cc2)C1=O	754538580	UWUCEGJZHSLQLR-UKQURCRRSA-N	448.435	1.731	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)NNC(=O)[C@H](C)Oc2c(C)cc(Cl)cc2C)co1	755413523	VWTZCTRQBQRYBY-NSHDSACASA-N	429.882	1.686	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N2CCCCC2)cc1NC(=O)NNC(=O)c1cnccn1	755435785	UBLFGXVFPNEVNC-UHFFFAOYSA-N	448.505	1.516	50	20	IDGD	
Cc1sc(Br)cc1S(=O)(=O)NNC(=O)CNC(=O)c1cccs1	755966901	TZQPKBNXAAZMET-UHFFFAOYSA-N	438.350	1.620	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)Nc2cccc(N3C(=O)CN(C)C3=O)c2)c1	755993668	UGCPGRVTAZQXGZ-UHFFFAOYSA-N	425.445	1.934	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)Nc1ccc(C(=O)NCCc2ccccc2)cc1	756186663	LQRQSFAPZAIZNU-KRWDZBQOSA-N	444.513	1.247	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2C(=O)N[C@]3(C[C@@H](C)C[C@@H](C)C3)C2=O)cc1OC	756857926	SQKQFMWTILKHFH-NGVSDPCNSA-N	432.477	1.212	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c(N(C)C)n1	757762266	RVXNFSYXVGUKEC-UHFFFAOYSA-N	425.537	1.821	50	20	IDGD	
CCc1nnc(O)c(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1CC	758152648	ZQBKRJBHQCAJFJ-UHFFFAOYSA-N	447.517	1.166	50	20	IDGD	
C[C@@H]1Oc2c(cccc2C(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)NC1=O	758785179	BWDAWSCWRSQBSU-ZDUSSCGKSA-N	447.492	1.655	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(F)(F)[C@@H](C(=O)NNC(=O)COc2ccccc2O)C1	760296491	NQLBBTQFCVZYEK-GFCCVEGCSA-N	429.420	1.811	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccc(C(=O)NNC(=O)CCNC(=O)OC(C)(C)C)o1	760439366	DLAWCMHDZRGFPK-UHFFFAOYSA-N	432.499	1.032	50	20	IDGD	
C[C@@H](NC(=O)OC(C)(C)C)[C@H]1CN(C(=O)NNC(=O)Cn2ccc3ccccc32)CCO1	760758265	XJNNMHVFHZCLNK-CRAIPNDOSA-N	445.520	1.996	50	20	IDGD	
Cn1ccc(CCNC(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)n1	761010017	DPOUKTBXMLUXAQ-UHFFFAOYSA-N	445.483	1.365	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)NCc1ccc(C(=O)Nc2ccc(F)cc2)cc1	761781993	ZZDQUSLAMVJPBO-AWEZNQCLSA-N	432.452	1.960	50	20	IDGD	
COc1ccc(OC)c(CN2CCN(CC(=O)NNC(=O)c3cccc(Cl)c3)CC2)c1	762550222	VTTZCKJAAWWUFF-UHFFFAOYSA-N	446.935	1.936	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)N[C@@H]1CCO[C@H](C(C)(C)C)C1	763461012	QAZNAQLMMVBAOP-KGLIPLIRSA-N	425.555	1.826	50	20	IDGD	
COC(=O)C(C)(C)c1ccc(NC(=O)C(=O)NNC(=O)COc2cc(C)ccc2C)cc1	763665932	RRJWOXGJXPSPOA-UHFFFAOYSA-N	441.484	1.919	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(NC(C)=O)ccc1C	763681851	NWLSBHWERQVHPA-UHFFFAOYSA-N	428.445	1.517	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)C(=O)Nc1ccc2[nH]ncc2c1	763692758	CEMNLMSMXKPBPE-UHFFFAOYSA-N	432.234	1.490	50	20	IDGD	
COC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)cc1F	763695333	RCHXLIBCXYGBEU-UHFFFAOYSA-N	438.799	1.822	50	20	IDGD	
COc1ccc(NC(C)=O)cc1NC(=O)C(=O)NNC(=O)CN1CCCc2ccccc21	763746040	PFPOUWFSPQRQLA-UHFFFAOYSA-N	439.472	1.192	50	20	IDGD	
C=C(C)COc1cccc(NC(=O)C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c1	763790158	GHEBWZMZEUOJHE-UHFFFAOYSA-N	435.440	1.288	50	20	IDGD	
CNC(=O)c1ccc(C)c(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)c1	763841920	VBNGHCWSGFZUNY-OAHLLOKOSA-N	426.473	1.525	50	20	IDGD	
COc1ccc(NC(C)=O)cc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1cccc(C)c1C	763851056	QEBCRKDECXXRQQ-CQSZACIVSA-N	442.472	1.824	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2scc(C(=O)OC)c2C)cc1	763860746	LHSMGFOIMXOBCP-LBPRGKRZSA-N	449.485	1.795	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccc(N2CCSCC2)cc1	763864677	FLCPTXDBTOAHKG-AWEZNQCLSA-N	446.504	1.932	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ncn(Cc2ccccc2)n1	763867333	ZYXZUBALVLHVLQ-ZDUSSCGKSA-N	426.408	1.019	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)C(=O)NCC3)cc1OC	763912387	YXVGALJRABNMFH-UHFFFAOYSA-N	440.456	1.170	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)C(=O)Nc1cccc(-n2cccn2)c1	763947240	AGWPDVVLZWOELY-UHFFFAOYSA-N	431.412	1.163	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)C(=O)Nc1ccnn1Cc1ccccc1Br	763993720	QVMZANZHXJPBHA-UHFFFAOYSA-N	445.277	1.432	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)[C@H]1CCCN(C(=O)COc2ccccc2)C1	764049584	KKFYVYWLOLZOPP-INIZCTEOSA-N	443.525	1.949	50	20	IDGD	
CN(C)C(=O)C[C@@H]1CN(C(=O)C(=O)NNC(=O)CC(F)(F)F)c2ccc(Cl)cc21	764117661	TUBKMKXKQHCYBN-SECBINFHSA-N	434.802	1.348	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)cc1Br	764152249	CNVLMMATGSPMRJ-OAHLLOKOSA-N	434.246	1.547	50	20	IDGD	
Cc1cn(-c2ccc(C#N)cn2)nc1NC(=O)C(=O)NNC(=O)CCOc1ccccc1	764166201	HNJUWYSZWRONMF-UHFFFAOYSA-N	433.428	1.002	50	20	IDGD	
CC(=O)N(Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)cc1)C1CC1	764169945	XJIYWJTYDZLSDC-HXUWFJFHSA-N	436.468	1.287	50	20	IDGD	
CCn1cnnc1-c1cccc(NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)c1	764240072	ZQHKGFXZQOIVLT-UHFFFAOYSA-N	431.456	1.706	50	20	IDGD	
CC(C)(C(=O)NNC(=O)C(=O)Nc1cc(F)cc(N2CCOCC2)c1)c1ccccc1	764309197	NFTQUYCKBOVVRI-UHFFFAOYSA-N	428.464	1.726	50	20	IDGD	
O=C(NNC(=O)c1cc2ccccc2o1)C(=O)Nc1ccc(S(=O)(=O)C(F)F)cc1	764340964	BITUMERJGPDHBO-UHFFFAOYSA-N	437.380	1.829	50	20	IDGD	
CCOc1cc(C(=O)N(C)C)ccc1NC(=O)C(=O)NNC(=O)c1ccc(O)c(Cl)c1	764348952	ATEHRUAIYGAIJG-UHFFFAOYSA-N	448.863	1.546	50	20	IDGD	
Cc1ccc(N2CCOC2=O)cc1NC(=O)C(=O)NNC(=O)c1ccc(O)c(Cl)c1	764349176	KODCEINXNBGTMW-UHFFFAOYSA-N	432.820	1.710	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)C(=O)Nc1ccc(=O)n(Cc2ccccc2Cl)c1	764385762	ICUYNWBCVDWAOJ-UHFFFAOYSA-N	439.859	1.653	50	20	IDGD	
C[C@H](CC(=O)NNC(=O)C(=O)Nc1ccccn1)C1CCN(C(=O)OC(C)(C)C)CC1	765507303	UVLQPJOFDIFMBU-CQSZACIVSA-N	433.509	1.841	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)c3cc(S(N)(=O)=O)ccc3OC)n[nH]2)cc1	765571599	LASOCGQKKIXYHA-UHFFFAOYSA-N	443.485	1.370	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)c1c[nH]n2c1nc(=O)c1ccccc12	767292624	PGROTZRYUHFGCC-UHFFFAOYSA-N	433.424	1.031	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)c2ccc(CN3CCN(C)CC3)cc2)n[nH]1	768273851	KRZQUZGUXNPCJB-UHFFFAOYSA-N	448.527	1.908	50	20	IDGD	
CN(C)c1ccc(C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)cc1	768292145	WQOCFDCNDQYLAE-UHFFFAOYSA-N	429.952	1.985	50	20	IDGD	
CCOc1cccc(-c2nnc(SCC(=O)NNC(=O)c3cccc(C)c3)n2N)c1	768424346	PYFRFZWOOVGXLE-UHFFFAOYSA-N	426.502	1.919	50	20	IDGD	
N#Cc1cc(Cl)nc(NNC(=O)c2cccc(S(=O)(=O)NC[C@@H]3CCCO3)c2)c1	768711771	DPKCHFUZQWZSHT-AWEZNQCLSA-N	435.893	1.821	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)C(C)(C)c2ccc(F)cc2)CC1	769105631	MXCZCOKDZHOYCT-UHFFFAOYSA-N	435.525	1.578	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)NC3CCN(C[C@@H]4CCOC4)CC3)nc21	770402525	XZNMJVFQMHKCGG-ZDUSSCGKSA-N	432.529	1.414	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1cc(S(=O)(=O)N2CCCCC2)ccc1C	771876862	ZDRJKZDDRHPYHY-CQSZACIVSA-N	425.507	1.272	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)[C@H]1CCCN(C(=O)N2CCc3sccc3C2)C1	772159333	PJVHBLZULSUEFB-ZFWWWQNUSA-N	436.534	1.427	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)[C@@H]1CSCN1C(=O)C1CCCC1	772883813	FONDQFSJMRIMBT-HNNXBMFYSA-N	438.937	1.195	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCCc1nn(C)c2ccccc12	773130078	ATABAOANVGADEK-UHFFFAOYSA-N	443.533	1.362	50	20	IDGD	
CCNC(=O)COc1ccc(NC(=O)C(=O)NNc2ccc(C(F)(F)F)cn2)cc1	773669847	PCPDCVLPOFQPSV-UHFFFAOYSA-N	425.367	1.697	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccccc1-n1ccnn1	774001821	KDVZPGPODCRMOH-GFCCVEGCSA-N	428.836	1.474	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCCc2nn(C)c3ccccc23)nc1	776178484	SIKXAFORMDENCX-UHFFFAOYSA-N	445.549	1.868	50	20	IDGD	
COc1nc(C)c(Br)cc1C(=O)OCC(=O)NNC(=O)c1ccc(C#N)cc1	777115938	ZOTOURFVAINETF-UHFFFAOYSA-N	447.245	1.651	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)c2ccccc2S(=O)(=O)N2CCCCC2)nc1C	778428507	NGRLAAGSDDYMKS-UHFFFAOYSA-N	447.517	1.893	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)CCNC(=O)c1ccc(Br)cc1	778437799	CYPYXMPIHVZNFY-UHFFFAOYSA-N	443.298	1.241	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cc(Cl)ccc2OC[C@@H]2CCCCO2)n[nH]1	778714113	RLSHOMYRHJUHGQ-ZDUSSCGKSA-N	435.868	1.719	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)c2cnc3ncc(Br)cc3c2)c1	780347509	KWGWMRYSNLCAMH-UHFFFAOYSA-N	449.286	1.871	50	20	IDGD	
CCNC(=O)N(C)NC(=O)c1ccc(OC)c(S(=O)(=O)N[C@@H]2CCCC[C@@H]2C)c1	780711476	LWLKNHJOMSVYHJ-DZGCQCFKSA-N	426.539	1.858	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2ccc(NC(=O)NC[C@H]3CCCO3)cc2)nc1	782145093	AYBBHCNYSYWRMI-MRXNPFEDSA-N	428.449	1.473	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(CNC(=O)NNC(=O)Cc2c[nH]c3ccccc23)c1	782770581	SXQYHMJMJRPESK-UHFFFAOYSA-N	429.502	1.491	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1ccc2c(c1)OCCO2	784833701	LIEKWBFMIFFOLN-UHFFFAOYSA-N	448.501	1.616	50	20	IDGD	
CC[C@@H](C)NS(=O)(=O)c1cccc(NC(=O)C(=O)NNc2cc(F)cc(OC)c2)c1	785235254	RLHBHYCBFWRSDB-GFCCVEGCSA-N	438.481	1.993	50	20	IDGD	
C[C@H]1[C@H](C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)CCN1C(=O)OC(C)(C)C	786251650	OUIIZVVLBGLWFG-GOEBONIOSA-N	432.525	1.486	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)C(=O)Nc1ccc(Cl)cc1-n1cccn1	788334542	XBWKGPIOEVLJRP-UHFFFAOYSA-N	427.848	1.950	50	20	IDGD	
CC(=O)Nc1ccc(NS(C)(=O)=O)c(C(=O)NNc2nnc(-c3ccccn3)s2)c1	788567527	OEPJBDNOXPQGFT-UHFFFAOYSA-N	447.502	1.687	50	20	IDGD	
CCNC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)COCc2ccccc2)c1C	789738267	CDJULRCCTIOLEE-UHFFFAOYSA-N	427.461	1.439	50	20	IDGD	
O=C1CCCc2cc(NC(=O)C(=O)NNC(=O)[C@H]3OCC[C@H]3c3ccccc3)ccc2N1	789809606	BIIHDGIXYGIYAA-PXNSSMCTSA-N	436.468	1.620	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)c(F)c1	790384734	BHJNSLQWYNECAR-UHFFFAOYSA-N	430.483	1.059	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)C(=O)Nc1cccc(N2C(=O)CCCC2=O)c1	792356969	WGVGYGFFVUIBDR-UHFFFAOYSA-N	438.440	1.033	50	20	IDGD	
CN(C)N(C(=O)c1cccc(NN2C(=O)[C@H]3CC=CC[C@H]3C2=O)c1)[C@H]1CCS(=O)(=O)C1	792851215	UJIIEMBOSAAJKK-OKZBNKHCSA-N	446.529	1.071	50	20	IDGD	
Cn1ccc2ccc(NC(=O)C(=O)NNC(=O)CSc3ccccc3O)cc2c1=O	793024205	CZILVGYIYNGCDO-UHFFFAOYSA-N	426.454	1.122	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)[C@H](C)CNC(=O)OC(C)(C)C)c2ccccc2c1=O	794776406	WGBGTOHXNYVLMR-CYBMUJFWSA-N	431.493	1.899	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)CN(C)c2cc(Br)ccc2[N+](=O)[O-])n1	794784501	VOKCROZNZFCAGX-UHFFFAOYSA-N	439.270	1.454	50	20	IDGD	
C=C(CBr)COC(=O)[C@H](C)NC(=O)c1ccc(S(=O)(=O)N(C)C)cc1	795416982	PDFHLFGVGSCRHV-LBPRGKRZSA-N	433.324	1.550	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)C(=O)Nc1cccc2c1CCO2	796999949	PSXWYZQFEWJEGK-NSHDSACASA-N	448.273	1.937	50	20	IDGD	
Cc1nn(CCS(C)(=O)=O)c(C)c1COC(=O)/C(C#N)=C/c1cc(C#N)n(C)c1C	797859917	XAAHQEZGNXDOAJ-CAOOACKPSA-N	429.502	1.714	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NCC3CCC(F)(F)CC3)nc2)CC1	800741819	CULUFODKXRUABX-UHFFFAOYSA-N	446.524	1.469	50	20	IDGD	
CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)NNC(=O)C(=O)Nc1ccc(C)cc1	801110118	PIVDKYBXBSEHRH-LJQANCHMSA-N	439.447	1.449	50	20	IDGD	
Cn1c(=O)c2ccc(C(=O)NNC(=O)Nc3ccc(-c4ccccc4)cc3)nc2n(C)c1=O	802038956	UGZCQFWOYZTZIP-UHFFFAOYSA-N	444.451	1.766	50	20	IDGD	
CCOC(=O)C(C)(C)CC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	805153449	AXKGFFBAJHAVJF-UHFFFAOYSA-N	425.507	1.212	50	20	IDGD	
COc1ccc(CN2CC[C@@H](NC(=O)NNC(=O)Cc3ccccc3F)C2=O)c(OC)c1	806027366	JYEQAFQVGXQBON-GOSISDBHSA-N	444.463	1.517	50	20	IDGD	
C[C@@H]1CN(C(=O)Cn2cc(NC(=O)NNc3nccnc3C3CCC3)cn2)C[C@@H](C)O1	806325424	FJLJKMOSWFZSFR-ZIAGYGMSSA-N	428.497	1.725	50	20	IDGD	
Nc1nc(C2CC2)ncc1C(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	807093353	MBAHGBTWQQYWID-UHFFFAOYSA-N	443.939	1.168	50	20	IDGD	
Cc1cccc(CCCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)n1	807428385	FDYXXXNXJUWNCU-UHFFFAOYSA-N	445.545	1.751	50	20	IDGD	
CCCS(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)c2cccc(OC)c2O)cc1	808080030	DRJIOIPETDRTMT-UHFFFAOYSA-N	428.488	1.208	50	20	IDGD	
COc1cccc2c(C(=O)NNC(=O)CN3CCN(Cc4ccc(C)cc4)CC3)n[nH]c12	809723957	BZEHHKOGRNSVDN-UHFFFAOYSA-N	436.516	1.459	50	20	IDGD	
O=C(CNS(=O)(=O)c1cccc(Br)c1)NNc1cccc([N+](=O)[O-])c1	810679091	KBCOZLRZLXHABK-UHFFFAOYSA-N	429.252	1.779	50	20	IDGD	
C[C@]1(NNC(=O)NCc2ccc(C(=O)OCc3ccccc3)cc2)CCS(=O)(=O)C1	812538855	VQYCEFFMUUSFAF-NRFANRHFSA-N	431.514	1.925	50	20	IDGD	
Cc1nnc(CC(=O)NNC(=O)c2cccc(S(=O)(=O)Nc3ccccc3Cl)c2)o1	813363515	LPEDQMDHVNRBCM-UHFFFAOYSA-N	449.876	1.836	50	20	IDGD	
O=C(Nc1ccc(Cl)c(F)c1)C(=O)N1CCN(S(=O)(=O)CBr)CC1	813510027	MRUQFWNCFRSSQP-UHFFFAOYSA-N	442.694	1.244	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)C[C@H]2CCCS(=O)(=O)C2)c2ccccc2c1=O	814733686	NWCJBMAZSJIRAP-OAHLLOKOSA-N	448.545	1.563	50	20	IDGD	
COc1ccc(C(CCC(C)C)=NNC(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)cc1	814877429	OAZGXPWLEPQNAY-UHFFFAOYSA-N	440.504	1.399	50	20	IDGD	
COC(=O)N1CCN(c2ccc(NC(=O)C(=O)NNc3cccc(Cl)c3)cn2)CC1	815574067	CVFNTBWCNUQVJM-UHFFFAOYSA-N	432.868	1.705	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCc2nncn2C1)C(=O)Nc1ccc(Br)c(Cl)c1	815693019	JMCSRGMQTRQDND-MRVPVSSYSA-N	441.673	1.043	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCc2nn[nH]c21)c1ccccc1NS(=O)(=O)c1cccs1	816830697	QMWBXFHFXBYMAE-LBPRGKRZSA-N	446.514	1.548	50	20	IDGD	
CC(=O)N[C@@H](CC(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)c1cccs1	829359572	LWLCWGNOHGZEGW-AWEZNQCLSA-N	434.430	1.228	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@@H](C)C(=O)NNC(=O)c1cnc2c(c1)c(O)nc(=O)n2C	893054661	HNSYBDVUDSMSEF-NSHDSACASA-N	445.863	1.533	50	20	IDGD	
CCOc1ccc(NC(=S)NNC(=O)c2ccc(OC)c(S(=O)(=O)NC)c2)cc1	913443983	PKDHGVQFDTUFFA-UHFFFAOYSA-N	438.531	1.633	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)CNS(=O)(=O)c2c(C)c(C)cc(C)c2C)c1	913531854	YYMMAWUHCJFRDF-UHFFFAOYSA-N	449.529	1.677	50	20	IDGD	
CS(=O)(=O)c1ccc(N2CCN(C(=O)NNC(=O)c3ccccc3)CC2)c([N+](=O)[O-])c1	913632636	LBWLMSNWSZOVPM-UHFFFAOYSA-N	447.473	1.175	50	20	IDGD	
CNC(=O)CN1CCC(NC(=O)/C(C#N)=C\c2cn(CCC#N)nc2-c2ccccc2)CC1	914782322	QOPFKNHOZDQXDH-RGEXLXHISA-N	445.527	1.697	50	20	IDGD	
CN(C)[C@@H](CNC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)c1ccco1	915896792	LANBSAMAONRUPA-KRWDZBQOSA-N	449.533	1.311	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)NCCc1ccc2c(c1)OCO2	915932486	OIGXORKGMQODRO-UHFFFAOYSA-N	439.516	1.501	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2CC(c3ccccc3)=NO2)c1	916096284	MKOGQBUIRIVAFP-IBGZPJMESA-N	444.513	1.671	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)[C@@H]3CCC(=O)NC3)c2)c(C)c1	916097484	GIHFUURWMZLEAX-MRXNPFEDSA-N	444.513	1.391	50	20	IDGD	
COc1cc(C=NNC(=O)CCN2CCN(c3ccccc3)CC2)ccc1OCC(=O)O	916271949	MCRDZCGKCOEXLZ-UHFFFAOYSA-N	440.500	1.821	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCCNC(=O)NNC(=O)Cc2cccc3ccccc23)cc1	916276389	ZKFZPUVVDCOMDG-UHFFFAOYSA-N	440.525	2.000	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NN=Cc1ccncc1)N(S(C)(=O)=O)CC2	916354597	GJPZFNWMVIWRRU-KRWDZBQOSA-N	432.502	1.498	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)NCc1ccc(CN2CCN(C)CC2)cc1	916387577	FOWAGJPPBOXJSS-QGZVFWFLSA-N	443.523	1.871	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NC[C@H](C)N2CCN(c3ccccc3)CC2)cc1	916514273	AFFWAIRYGFUODM-IBGZPJMESA-N	425.533	1.915	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)Cc1nc2ccccc2n1C)N1CCc2sccc2C1	916619984	JLTPVZPSZXDMEW-CQSZACIVSA-N	426.546	1.955	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C[C@@](O)(c3nccn3C)C(F)(F)F)n[nH]2)cc1	917178405	KMQWUHKCOZZFKJ-GOSISDBHSA-N	436.394	1.720	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNS(=O)(=O)c2cccc(C(=O)N(C)C)c2)cc1	917725920	WRHLIDKPHBUUKY-AWEZNQCLSA-N	435.502	1.564	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)NC1CCN(Cc2ccc(F)cc2)CC1	918223483	RUFHMUOHOIECLX-UHFFFAOYSA-N	438.467	1.410	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)CNS(=O)(=O)c2c[nH]c3ncccc23)c1C	918758467	SOIOZCRQYVQWJI-AWEZNQCLSA-N	445.501	1.073	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2cccnc2N2CCCC2)cc1	920417715	RJTZOQLYIFEMLX-UHFFFAOYSA-N	446.533	1.464	50	20	IDGD	
COc1cccc(C[C@H](C(=O)NNC(=O)c2cncn2-c2ccccc2)n2nnnc2C)c1	1317886611	UPFDWAVUHVVHKZ-LJQANCHMSA-N	446.471	1.421	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2cnn(-c3ccncc3)c2C)c2ccccc2c1=O	1320282413	UOGDRDDRDOYXIR-UHFFFAOYSA-N	431.456	1.770	50	20	IDGD	
CCOC(=O)c1[nH]c(C)c(S(=O)(=O)NNC(=O)c2cncn2-c2ccccc2)c1C	1340608328	OINYUTHLINIRMQ-UHFFFAOYSA-N	431.474	1.617	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cnc(C(F)(F)F)cn1)CCO2	1779296384	QIMBPIBQBSJYNS-KRWDZBQOSA-N	446.502	1.790	50	20	IDGD	
CN(C)c1ccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)cn1	1779762876	CBWYMYOSVXFAFM-RTBURBONSA-N	429.348	1.827	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccnc4c3OCO4)C2)C1	1780030792	ZWKWIZBRVKJYKW-SCLBCKFNSA-N	440.294	1.427	50	20	IDGD	
COC(=O)C1(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](F)Br)C2)CC1	1780777328	WUCKQJUKCWKRTD-BFQNTYOBSA-N	435.290	1.144	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cccnc3CS(C)(=O)=O)CCO2)C1	1781212906	AESYBMBWQXFFSE-KXBFYZLASA-N	443.953	1.087	50	20	IDGD	
COCCn1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@](C)(Cl)CCl)C3)C2)n1	1781229577	JAFMUXBXXSJRGH-QZTJIDSGSA-N	433.336	1.209	50	20	IDGD	
NC[C@H](C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1)c1ccccc1	1781331355	PAOHLWQATCLCLM-HDMKZQKVSA-N	428.302	1.249	50	20	IDGD	
O=C(Cc1ccc2c(c1)CCO2)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781332582	BTCPRLIEMPVTGI-HKUYNNGSSA-N	441.297	1.684	50	20	IDGD	
Cc1ccc(C(=O)C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](F)Br)C3)C2)cc1	1781334132	MJEXIYARAXVPET-YJBOKZPZSA-N	427.270	1.698	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C[C@@](C)(O)CC(=O)O)C1	1782203187	NROVIGPRTXDXJQ-KQEPKPNTSA-N	432.945	1.524	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4ccnn4c3)C2)C1	1782405826	GUSPOTXFCBMAAA-LIRRHRJNSA-N	435.322	1.809	50	20	IDGD	
O=C1CCc2ccc(C(=O)N3CC[C@]4(C3)CN(C(=O)C(Cl)Cl)CCO4)cc2N1	1782515016	PYILVGZGRZUWBE-IBGZPJMESA-N	426.300	1.819	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2	1782708889	YJVXGCWKJFLURZ-CSMYWGQOSA-N	425.309	1.614	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@]2(C1)CN(C(=O)c1cnsn1)CCO2	1782864133	RCQFFOYGJCFTGG-FZXOMJPYSA-N	445.451	1.867	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)CCC(=O)N3CCCC3)CCO2)C1	1783342432	IUMLAIFHIZUXEB-BEFAXECRSA-N	444.370	1.392	50	20	IDGD	
CCOC(=O)C(C)(C)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](Br)CC)C2)C1	1783352253	DTQYKURCCJXPNR-SCLBCKFNSA-N	433.343	1.579	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)Cn3ccc4c(F)cccc43)CCO2)C1	1783870672	FHYMZKNDACQSFP-IIBYNOLFSA-N	437.899	1.864	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)/C=C/c3ccccc3[N+](=O)[O-])CCO2)C1	1783884454	SDTWFGSWFXQJHR-ZSUOFZKHSA-N	437.880	1.692	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1ccc(Cl)s1)CCO2	1783936820	VAIGZDWHMQVOBT-SFHVURJKSA-N	428.942	1.218	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1ccccc1C1CC1)CCO2	1783938289	WMIYPYGEVJGACV-QHCPKHFHSA-N	428.533	1.381	50	20	IDGD	
COc1ccc(CC(=O)N2CCO[C@@]3(CCN(C(=O)C(Cl)Cl)C3)C2)c(C#N)c1	1783946951	JYEBPYXUKOQSIA-IBGZPJMESA-N	426.300	1.743	50	20	IDGD	
C[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]2C1)n1ccnc1	1783964459	UEFRPWSUIGNYBJ-QXKUPLGCSA-N	427.343	1.455	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccnc3-c3ccccc3)C[C@@H]21)[C@H](O)CCl	1784090800	NILXLCQVTMKAEV-FFGOWVMKSA-N	443.931	1.942	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](C)Sc3ccccn3)C2)C1	1784417382	GZQODMJZKLTIRB-YZVOILCLSA-N	427.954	1.646	50	20	IDGD	
O=C([C@H](O)CCl)N1CCO[C@@]2(CCN(C(=O)[C@H]3CC[C@H](C(F)(F)F)CC3)C2)C1	1785380576	IYTPLHRZRIJIHO-VMUDFCTBSA-N	426.863	1.785	50	20	IDGD	
O=C(CCNC(=O)c1ccc[nH]1)NC1(c2ccc(NC(=O)[C@@H](O)CCl)cc2)CCC1	1786128990	CNVHKMYLEHCAHW-KRWDZBQOSA-N	432.908	1.868	50	20	IDGD	
Cn1nc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCBr)[C@H]3C2)c2c1CCC2	1786406819	IBCQKNGMNTZKPB-NOLJZWGESA-N	439.354	1.287	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc4[nH]ncc4c3)[C@H]2C1	1788277180	MPNIAHLKYKTMDD-GVARAGBVSA-N	436.310	1.335	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnn(C)c3Cl)[C@H]2C1	1789083555	PLAUTNVAXRPWNG-DEQVHRJGSA-N	447.761	1.840	50	20	IDGD	
CC(C)c1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCBr)C[C@@H]32)n[nH]1	1789322245	SPIIKIRGKLPJCJ-XEZPLFJOSA-N	427.343	1.911	50	20	IDGD	
COc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Br)C[C@@H]32)ccc1O	1789602849	DMHOTOKMCBKAFZ-APYUEPQZSA-N	445.285	1.685	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)COc3ccc(F)cc3)C[C@@H]21)[C@H](F)Br	1789922120	CPQYVOFNCXMUOO-SIUGBPQLSA-N	447.276	1.875	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3c(C)n[nH]c3C)C[C@@H]21	1790960379	DHSWLIYHOVVNBO-XQLPTFJDSA-N	427.343	1.793	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN3CCCCC3=O)[C@H]2C1	1791179449	XYCBPFZVMWPDLI-UGUYLWEFSA-N	444.370	1.010	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(OC)cc3OC)C[C@@H]21	1791253821	KKBJAPOHSMYAHQ-KUZCPNRJSA-N	440.924	1.551	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]3C2)cc1F	1791290616	BXMFSCZYWZRMCB-LNLFQRSKSA-N	434.512	1.100	50	20	IDGD	
CC#C[C@@H](CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)c1ccc(O)cc1	1791331277	QHYQZYLVZGGAFI-XYYCENQHSA-N	448.947	1.469	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(C)(C)C#N	1792633518	ZQTUKODOLQUARO-ZSBFGKGUSA-N	444.444	1.273	50	20	IDGD	
Cc1ccc(CCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)s1	1794310680	GSRBQSSXHOKFNE-MUJYYYPQSA-N	441.557	1.940	50	20	IDGD	
COCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](Br)Cc1ccccc1)C2	1795206744	HSJNHELQXKPPOX-KYHPRHEASA-N	425.323	1.229	50	20	IDGD	
CCOc1c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Cl)C3)cnc2c1cnn2C	1796073501	WDWJBWRJKLLNKS-YHYOWMERSA-N	439.875	1.105	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CC(=O)N(Cc3ccccc3)C1)C2)[C@@H](F)Cl	1796364745	LLQSIEDJHYHMME-WCWVYFQPSA-N	437.899	1.159	50	20	IDGD	
CCC[C@H](NC(=O)c1ccccc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Cl	1796364838	NDSHIIFQNOBBQV-FLXSYLCISA-N	439.915	1.709	50	20	IDGD	
Cc1ccc2oc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)CCC(=O)NN(C)C)C4)cc2n1	1796401831	WPNLESVGHDJJPJ-MUJYYYPQSA-N	427.505	1.761	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccn2ccnc2c1	1797443524	JOAGSMCHDBWKCO-JJAZEVLHSA-N	435.322	1.569	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc2c1NC(=O)C2=O	1797538832	ZUJJDLZGUFXPJV-VZAMPYOESA-N	433.892	1.432	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@]1(F)CCCCC1(F)F	1797804626	AOVOFDPZUVYZEW-NXEZDXNNSA-N	432.487	1.915	50	20	IDGD	
C[C@H](Cc1ccccn1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnccc1C(=O)NN	1798443705	YJUZENLRQVAKLG-NRSFXHEJSA-N	436.516	1.211	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(=O)nc3sccn13)C2	1798627110	PSYPBERYHRHTEU-BTTYYORXSA-N	434.594	1.859	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(O)c([N+](=O)[O-])c1	1799486676	OJIPLIAFCLZFPL-BTABJRDXSA-N	442.266	1.287	50	20	IDGD	
CCOc1cnc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](Br)CC)cn1	1800639134	ISSPSNJXHSRODK-OQMKEHIESA-N	441.326	1.252	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(F)c(F)c1OC)C2	1800977430	OHCZYRYYEVLPLZ-DDFXLWFNSA-N	432.851	1.430	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(OC)cc(OC)c1F)C2	1800978365	BJXPPLRXUBYQBS-TYYYEBLRSA-N	444.887	1.300	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3ccoc3c1)C2	1801013238	YGIWESHQGSVWEX-UPHUGPLXSA-N	428.489	1.009	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1ccc(F)cc1F)c1ccc(B(O)O)cc1	1801821680	KJSQQDRBBXYFSW-REPLKXPHSA-N	428.244	1.139	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc3c(cnn3C)c1)C2	1802336793	ZFUCJFCTMXINNQ-BCDXTJNWSA-N	426.521	1.198	50	20	IDGD	
O=C(Cc1cccc([N+](=O)[O-])c1)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1	1802378163	NRPUKUQWJJLPTF-ILZDJORESA-N	446.891	1.838	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2c[nH]c3cnccc23)[C@H]1c1cccnc1)[C@H](O)CCl	1803142678	GXTGCHQILAGSRN-KYNGSXCRSA-N	427.892	1.877	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)o1	1803143082	SURZAMBRSOTLBT-RVKKMQEKSA-N	434.880	1.552	50	20	IDGD	
CC(C)[C@H](S)C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1803599284	WLFKABWXWKWJQP-IHPCNDPISA-N	441.362	1.035	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCc1c[nH]c2ncccc12)c1cccc(B(O)O)c1	1804262515	FVMNCZFMKHCIQS-ACDBMABISA-N	446.316	1.127	50	20	IDGD	
Cc1ncoc1C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1805863044	UHQOYILSRRTYLU-LPHOPBHVSA-N	428.493	1.071	50	20	IDGD	
O=C(CCBr)NC[C@H]1CCN(C(=O)CN2CCOC2=O)[C@H]1c1cccnc1	1806341876	HWJAUYALENAZRG-PBHICJAKSA-N	439.310	1.325	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1CCN(C(=O)Cn2nccn2)[C@@H]1c1cccnc1	1808305971	XXAOUFSXVKRMBE-LESCRADOSA-N	425.320	1.615	50	20	IDGD	
C[C@H](C(=O)NC[C@@H]1CCN(C(=O)[C@H](F)Cl)[C@H]1c1cccnc1)[C@@H]1SC(=N)NC1=O	1808403497	WTYUBBAPJUEKLR-YGTGSIHKSA-N	441.916	1.424	50	20	IDGD	
C/C(=C/C(=O)N1CC[C@H](CNC(=O)[C@H](F)Br)[C@H]1c1cccnc1)C(=O)O	1808681483	UBMKBVSDAJPGJF-HOHRPOLTSA-N	428.258	1.809	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)c3cn4ccccc4n3)CC2)C1	1809972629	VLNBHMBLXBFPSZ-UHFFFAOYSA-N	446.316	1.173	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H](CNC(=O)/C=C\C(=O)NC2CC2)[C@H]1c1cccnc1	1810129120	CDKOUQSOGUBZRT-JZACPFSMSA-N	444.608	1.774	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)CCNC(=S)NC)[C@H]1c1cccnc1	1810314723	JNRZBTVTIKCNBV-HLLBOEOZSA-N	425.986	1.589	50	20	IDGD	
COC[C@H](NC(C)=O)C(=O)NC[C@@H]1CCN(C(=O)C(Cl)Cl)[C@@H]1c1cccnc1	1810564231	KBHPBYXPHDKEGS-SOUVJXGZSA-N	431.320	1.042	50	20	IDGD	
COC(=O)CCC(=O)N1CC[C@H](CNC(=O)[C@H](C)Br)[C@@H]1c1cccnc1	1812864075	KCSGQAHIFLUNJN-QEORTHHSSA-N	426.311	1.824	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2cc3n(n2)CCC3)[C@H]1c1cccnc1	1813031012	IQJSHBWMZYFKBN-IEZWGBDMSA-N	431.924	1.798	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)C2CCC(O)CC2)[C@H]1c1cccnc1	1813075031	WXQVZHQUXOOEAW-BBLWZBATSA-N	445.564	1.012	50	20	IDGD	
O=C(O)CSCC(=O)NC[C@@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1	1813084544	ZUJLPAIGPFCLEZ-GUYCJALGSA-N	444.351	1.690	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)COC(=O)C(F)(F)F)[nH]n1)[C@H](O)CCl	1814873750	UCMRCHSNEPCTQF-NXEZZACHSA-N	426.779	1.107	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](N)Cc3cscn3)sc2C1	1816989425	KRNPAYJPRKNXOX-WCQGTBRESA-N	443.982	1.335	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3cc(O)nc(O)n3)sc2C1	1817099606	YQFXWDAOIPBXBV-DTWKUNHWSA-N	425.898	1.978	50	20	IDGD	
CS(=O)(=O)c1cncc(C(=O)N[C@H]2CCc3nc(NC(=O)[C@H](F)Cl)sc3C2)c1	1817116864	GPXZPEFIFVCPIS-ZANVPECISA-N	446.913	1.702	50	20	IDGD	
C=CCC(F)(F)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1	1817475779	SUNUARLSRPBULE-MRXNPFEDSA-N	432.236	1.607	50	20	IDGD	
C[C@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](F)Cl)[nH]n1)[C@@H]1SC(=N)NC1=O	1818099689	YXNHQZMSDGCKGB-JMWNJNDNSA-N	430.893	1.739	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)Cn2cnnn2)[nH]n1	1822086969	DOQVAEUHJZKLEH-JQWIXIFHSA-N	425.291	1.262	50	20	IDGD	
CC(=O)N(C)CCC(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1	1823003331	YJFDIRZFJMDTAB-NOZJJQNGSA-N	435.319	1.614	50	20	IDGD	
Cc1cccnc1C(=O)N[C@@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1	1826083806	SKAOJMAHXOBHPL-CYBMUJFWSA-N	430.534	1.445	50	20	IDGD	
O=C(CCC(F)(F)F)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827051311	RJJMAQCDHDFRBT-SFHVURJKSA-N	440.271	1.942	50	20	IDGD	
O=C([C@H]1CCCSC1)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827059388	AAVJETXDNIPUAD-PZJWPPBQSA-N	444.406	1.743	50	20	IDGD	
C[C@@H]1CCc2c(C(=O)N3CCOC[C@]4(C3)CN(C(=O)C(C)(C)CCl)CCO4)n[nH]c21	1830362127	MBHADIIBAPYSBG-SZNDQCEHSA-N	438.956	1.794	50	20	IDGD	
Cc1nocc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)CBr)CCO2	1830537182	CKWSKVWQKQCRPE-PXAZEXFGSA-N	430.299	1.084	50	20	IDGD	
Cc1ccncc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2	1830538474	GISVTJWRCAZTNH-KXBFYZLASA-N	440.338	1.491	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H]2CCCS2(=O)=O)CC1	1831286228	STHMDJIGBWMADG-YESZJQIVSA-N	434.986	1.437	50	20	IDGD	
O=C(CCc1cc(F)ccn1)NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1833792909	YSLVDKRWGJAQAN-LJQANCHMSA-N	440.947	1.325	50	20	IDGD	
Cc1cccc(CC(=O)N2CCOC[C@]3(CN(C(=O)CCBr)CCO3)C2)c1	1834822201	DIWFWXUTIRFTPK-FQEVSTJZSA-N	439.350	1.779	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccc(F)c(F)c3)CCO2)C1	1835144386	USPRBOLRFGWSPH-FOIQADDNSA-N	446.878	1.218	50	20	IDGD	
COCCC(=O)N1CCO[C@]2(COCCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1	1835233754	BOMBLRQHTDCZAT-IHSQGBLNSA-N	449.454	1.365	50	20	IDGD	
CN(C)c1ccc(C(=O)N2CCC(OC3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)cn1	1836718662	YLJPKKNJRPKKCC-SFHVURJKSA-N	438.956	1.360	50	20	IDGD	
O=C([C@H](O)CCl)N1CCC(OC2CCN(C(=O)C(F)(F)c3ccco3)CC2)CC1	1836719538	WFXQECWUGHBIJP-OAHLLOKOSA-N	434.867	1.970	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccccc3F)CCO2)C1	1838853556	VNIIYSGBKFQQCZ-KUHUBIRLSA-N	443.313	1.927	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc(OC)c(C)c3)C2)C1	1839143141	MLJNKZITCKYJGT-UZLBHIALSA-N	425.913	1.486	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(-c4ccccn4)[nH]n3)C2)C1	1839145892	HFNQAIVSTFQDBR-VFNWGFHPSA-N	447.923	1.559	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)COc3ccccc3C#N)C2)C1	1839149580	LVZFTJGSEQKWLT-UWJYYQICSA-N	435.908	1.411	50	20	IDGD	
Cc1ccn(C)c1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2	1839153678	OETKILHBBQWRMJ-MOPGFXCFSA-N	432.348	1.640	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3ncc[nH]3)C2)C1	1839154905	BEKCDAXUMAGJOM-ZWKOTPCHSA-N	433.336	1.035	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)c(F)c1	1839293052	NWHOWOKJKALLNL-GOSISDBHSA-N	435.279	1.708	50	20	IDGD	
Cc1csc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)c1	1840030830	XZTHXMOKXDKHIE-DYVFJYSZSA-N	431.352	1.910	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4c(s3)CCC4)C2)C1	1840150230	IAESITOGLQBXSP-YWZLYKJASA-N	442.965	1.561	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3c(C)cc(C)cc3C)C2)C1	1840156823	VEYSSZBWGOIPON-GCJKJVERSA-N	438.952	1.936	50	20	IDGD	
O=C(c1cc(C(F)F)no1)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840187927	FSMXCOJYJQDQHS-HNNXBMFYSA-N	428.219	1.486	50	20	IDGD	
O=C(Cc1ccc(F)cc1F)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840189949	URSWTSQRVUVJCT-GOSISDBHSA-N	437.270	1.767	50	20	IDGD	
C[C@@H](Cc1ccccn1)C(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1840330732	NNTWQRANCWOKFD-HTAPYJJXSA-N	437.968	1.982	50	20	IDGD	
Cc1cc(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](C)CBr)C3)C2)no1	1840366403	JVJHBPQOFJAXRG-SCLBCKFNSA-N	444.326	1.013	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCCn3ccnc3)CCO2)C1	1840383716	AFGSDLGFAGCPHQ-RBUKOAKNSA-N	447.363	1.356	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)/C=C/c3cnc(C)s3)CCO2)C1	1840519610	OSXYPDLTVQYLQE-FPZJGVQBSA-N	443.953	1.175	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](CCO)C(=O)N1CC2(CCCN2C(=O)C(C)(C)CCl)C1	1841224986	IMLUPKSTGDLLQO-CQSZACIVSA-N	431.961	1.731	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC2(CCCN2C(=O)c2ccc(CS(C)(=O)=O)nc2)C1	1843216504	QHUWKOLALRXDLM-KRWDZBQOSA-N	448.372	1.680	50	20	IDGD	
COc1ccc(C(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)cc1Cl	1844265468	GNWBAHQQDBRQJQ-UHFFFAOYSA-N	443.891	1.478	50	20	IDGD	
O=C(/C=C/C(=O)N1CC2(CCCN2C(=O)[C@@H](F)Br)C1)NCc1ccccc1	1845215981	OSELWOYADAWDAG-IWAYRVGRSA-N	438.297	1.753	50	20	IDGD	
CCN(CC)C[C@H](C)C(=O)N1CCCC12CN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2	1845783007	OHYFKQGHXFGDNG-FWGBXFHKSA-N	430.553	1.302	50	20	IDGD	
CS(=O)(=O)c1ccc(C(=O)N2CCCC23CN(C(=O)CCBr)C3)cc1F	1846892737	BUGBKROCDGNPQO-UHFFFAOYSA-N	447.326	1.831	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cncc(S(C)(=O)=O)c1	1847495012	CSEJMEFODQRPHP-CQDKDKBSSA-N	444.351	1.332	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)CCn2c(=S)[nH]c3ccccc3c2=O)cc1	105488943	NMDJEFACBSRUTA-UHFFFAOYSA-N	427.486	1.717	50	20	IDGD	
CC(C)[C@@H](NC(=O)NNC(=O)COc1ccccc1[N+](=O)[O-])c1nnc2ccccn12	726283183	XTPCSVKWRFJWPX-QGZVFWFLSA-N	427.421	1.744	50	20	IDGD	
CC(C)N(CCC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)C(=O)OC(C)(C)C	727130438	FSCOAHWESKNECV-UHFFFAOYSA-N	427.523	1.887	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)N2CCC(NS(=O)(=O)c3cccs3)CC2)c1	728954481	FZDCYCLAWYAZGJ-UHFFFAOYSA-N	433.515	1.417	50	20	IDGD	
Cc1[nH]nc(C(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)c1[N+](=O)[O-]	729298827	UZTRKHYVYSBBNA-UHFFFAOYSA-N	447.411	1.459	50	20	IDGD	
O=C(CC1(CC(=O)NNC(=O)c2cccnc2)CCCCC1)NNC(=O)c1cccnc1	729834271	YFRAYAWWRVEDHP-UHFFFAOYSA-N	438.488	1.430	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)NCCc1ccc(Br)cc1F	731044289	PKZVCWCFJZZVBN-UHFFFAOYSA-N	427.230	1.484	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)CCNC(=O)N1CCc2ccccc2C1	731864521	ZEQPBIXGWNVGPA-UHFFFAOYSA-N	440.500	1.770	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2cccc(CSc3nccn3C)c2)C[C@@H](C)O1	732263110	JVXNHWBZYXHJER-IYBDPMFKSA-N	431.562	1.973	50	20	IDGD	
CCOc1ncc(C(=O)OCC(=O)NNC(=O)c2ccc(OC)c(OC)c2)cc1Cl	732845143	HLENBAYRUVXLTN-UHFFFAOYSA-N	437.836	1.769	50	20	IDGD	
C[C@H](CC(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)c1ccccc1	732861803	QMDIOKKANQPMML-KDOFPFPSSA-N	426.425	1.426	50	20	IDGD	
CCN1CCN([C@@H](C)CNC(=O)CCC(=O)C(C#N)=C2N(C)c3ccccc3N2C)CC1	733162917	XHXGKQZARDMACD-SFHVURJKSA-N	438.576	1.799	50	20	IDGD	
CCOCCCn1c(NNC(=O)C2CCN(C(=O)N(C)C)CC2)nc2ccccc2c1=O	733267979	DPZXPQWEJIRPOU-UHFFFAOYSA-N	444.536	1.660	50	20	IDGD	
COc1cccc(C(=O)N2CCN(C(=O)NNC(=O)c3cnn(-c4ccccc4)c3)CC2)c1	733349222	YLECZHSYYIYZNX-UHFFFAOYSA-N	448.483	1.693	50	20	IDGD	
O=C(COC(=O)Cc1coc(-c2ccc(F)cc2)n1)NNC(=O)c1ccc([N+](=O)[O-])cc1	733605713	OIIJZPGNCGBCKI-UHFFFAOYSA-N	442.359	1.936	50	20	IDGD	
N#Cc1ccc(N2C(=O)N[C@H](CCC(=O)NNC(=O)c3cc4c(s3)CCC4)C2=O)cc1	733775001	WBVHIXRRKIPMBA-OAHLLOKOSA-N	437.481	1.775	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)ccc1[N+](=O)[O-]	734825626	JXIDBYUEOUTSDK-UHFFFAOYSA-N	437.453	1.947	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)c2ccc(N3CCCC3)nn2)CC1	734825899	QFJMCDPIARMQQG-UHFFFAOYSA-N	433.513	1.420	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)cc1	735055595	HTKHBBNVUYRLGI-UHFFFAOYSA-N	435.481	1.364	50	20	IDGD	
CN(C)c1nccc(NNC(=O)CCCN2C(=O)c3ccc(Br)cc3C2=O)n1	740112802	QECTUVOTNJMWCH-UHFFFAOYSA-N	447.293	1.825	50	20	IDGD	
Cn1c(=O)n(C)c2cc(S(=O)(=O)NNC(=O)NC3CCCC3)c(Br)cc21	741654228	WZNDWSZKGPYVSQ-UHFFFAOYSA-N	446.327	1.075	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@@H]2C[C@@H]2c2cccc(F)c2F)cc1	741660778	OAHOYGQCHGMRSR-HZPDHXFCSA-N	437.468	1.845	50	20	IDGD	
O=C(CCNc1ncc(C(F)(F)F)cc1Cl)NNC(=O)[C@@H]1CCS(=O)(=O)C1	742037377	ZITWGALSEGSCLR-MRVPVSSYSA-N	428.820	1.138	50	20	IDGD	
C[C@H](CC(=O)NNC(=O)NCCc1cccs1)/N=C1/NS(=O)(=O)c2ccccc21	742582996	GZCCALZHVBHHDW-GFCCVEGCSA-N	435.531	1.138	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)c1cc(N2CCOCC2)ccn1	743861472	UHPBTRPYCOKUBJ-UHFFFAOYSA-N	435.278	1.521	50	20	IDGD	
Cc1cc(=O)c(C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)nn1-c1ccccc1	744524207	CMIQQAXYMOQIBI-UHFFFAOYSA-N	431.408	1.031	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)[C@@H]1CN(Cc2nc(O)c3ccccc3n2)CCO1)c1ccccc1	746247809	PJSWIURTTGEREP-XLIONFOSSA-N	449.511	1.877	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCCCN(C(C)C)C(C)C)cc1	746422457	RTKWQWIYKMENQJ-UHFFFAOYSA-N	441.598	1.455	50	20	IDGD	
CCC[C@H](C)CC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	748604872	ODUDHXAPCAFALV-INIZCTEOSA-N	425.551	1.614	50	20	IDGD	
CC[C@@H](NC(=O)NNC(=O)c1csc(N2CCOCC2)n1)c1nnc2n1CCCCC2	749579588	LUKILZKGSUZZQI-CYBMUJFWSA-N	448.553	1.393	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@H](C)NC(=O)CC2CCCCC2)c2ccccc2c1=O	749837412	DNLQMMIRMUDBLZ-AWEZNQCLSA-N	427.505	1.653	50	20	IDGD	
O=C(NNC(=O)N1CCN(c2cc(F)ccc2F)CC1)c1ccc(-n2cnnn2)cc1	750265357	COOKHEXWOUZJFW-UHFFFAOYSA-N	428.403	1.117	50	20	IDGD	
CCCc1ccc(N2C[C@H](C(=O)NNC(=O)CNC(=O)c3cccs3)CC2=O)cc1	751209542	RLZXNQIQEWBUOP-OAHLLOKOSA-N	428.514	1.631	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCN(c3ccc(C(F)(F)F)cc3)CC2)n1	752087686	FYSFWIKCFJJVKT-UHFFFAOYSA-N	441.479	1.982	50	20	IDGD	
O=C(CCCc1ccccc1)NNC(=O)NC[C@H](O)CS(=O)(=O)c1cccs1	752161354	UCVDVDLHKAEUAX-HNNXBMFYSA-N	425.532	1.236	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)NCc2ccccc2OCC(=O)NC[C@@H]2CCCO2)o1	752362812	ORARXYKTDQXLIH-INIZCTEOSA-N	430.461	1.406	50	20	IDGD	
CCCC[C@@H](NC(=O)[C@@H](C)NC(=O)C(C)(C)C)C(=O)NNC(=O)NC1CCCCC1	755036546	VKTCSTIQILAYTO-GDBMZVCRSA-N	425.574	1.875	50	20	IDGD	
O=C(Cc1ccc2ccccc2c1)NNC(=O)NCCN1C(=O)[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O	755259208	SLIAWHZFIRDPDT-FMWKFLBASA-N	432.480	1.520	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)CCc2ccccc2O)c(Cl)cc1F	755974210	LMKGQRIJTWUHLX-UHFFFAOYSA-N	430.841	1.914	50	20	IDGD	
O=C(NNC(=O)N1CCC[C@@H]1Cn1cnc2ccccc21)C1CCN(c2ncccn2)CC1	756060866	CLKGOIXVPUUOKY-GOSISDBHSA-N	448.531	1.948	50	20	IDGD	
COCCn1ncc2ccc(NC(=O)NNC(=O)COc3ccccc3[N+](=O)[O-])cc21	756269962	VNHICUMJIGLKBS-UHFFFAOYSA-N	428.405	1.823	50	20	IDGD	
C[C@](O)(CN1Cc2ccccc2C1=O)C(=O)NNC(=O)c1ccc(Br)s1	756798550	YQMJFLOPLLBVQH-KRWDZBQOSA-N	438.303	1.679	50	20	IDGD	
COc1ccccc1N1CC[C@@H](NC(=O)NNC(=O)c2cc(Br)c[nH]2)C1=O	756914833	SRKUKWDTQYDKIE-LLVKDONJSA-N	436.266	1.535	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2sc(COC)nc2C)c1	758043618	NQHVEUOPSHPIPE-UHFFFAOYSA-N	440.547	1.703	50	20	IDGD	
O=C(NNC(=O)C(=O)Nc1ccccn1)N[C@@H]1CCCN(c2ccccc2Cl)C1=O	758804696	QBHITVONOSHNAV-CYBMUJFWSA-N	430.852	1.200	50	20	IDGD	
COc1cc(S(=O)(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)ccc1[N+](=O)[O-]	759164308	WHFVRNRECKXART-UHFFFAOYSA-N	441.418	1.253	50	20	IDGD	
Cc1cc(C)nc(-n2nccc2NC(=O)C(=O)NNC(=O)c2cccc3cccnc23)n1	760278257	VMZKCBRVOPPNOR-UHFFFAOYSA-N	430.428	1.227	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)c1cccc(CN2C(=O)CSC2=O)c1	760439338	JWYFOEVEUARDPP-UHFFFAOYSA-N	436.490	1.558	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)CCNC(=O)[C@@H]2CCCN2C(=O)OC(C)(C)C)nc1	760922376	KNKOSWSLZJTGQO-AWEZNQCLSA-N	435.481	1.217	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)[C@@H]2CCCN2S(=O)(=O)c2ccc(C)s2)n1	762913504	QSRDQNFEIBFOQY-AWEZNQCLSA-N	438.579	1.989	50	20	IDGD	
CC(C)Cc1ccc(S(=O)(=O)N2CCN(S(=O)(=O)CBr)CC2)cc1	763205798	GEERICUEBBPETR-UHFFFAOYSA-N	439.397	1.874	50	20	IDGD	
CSc1cc2c(cc1NC(=O)C(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)OCCO2	763472561	YIBPFMYLGHDPPG-UHFFFAOYSA-N	432.414	1.488	50	20	IDGD	
CCc1ccc(NC(=O)C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1F	763528780	AJUBOUFALOJKOH-UHFFFAOYSA-N	441.507	1.686	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)NCC(C)C)cc2)cc1OC	763551180	UASQTUWIXWVCHP-UHFFFAOYSA-N	442.472	1.489	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2cc(C)nc3ccccc23)cc1NC(C)=O	763615895	RENCHROKTJXYAH-UHFFFAOYSA-N	435.440	1.910	50	20	IDGD	
COC(=O)NCc1ccc(NC(=O)C(=O)NNC(=O)COc2cc(C)cc(C)c2)cc1	763648249	AWTBUGDYROJGEI-UHFFFAOYSA-N	428.445	1.324	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2ccc(C(=O)NC(C)C)cc2C)c1	763665604	KVFXCKPAVGUNLS-UHFFFAOYSA-N	440.500	1.915	50	20	IDGD	
O=C(CN1CCCc2ccccc21)NNC(=O)C(=O)Nc1ccc(NC(=O)C2CC2)cc1	763728866	SAEMJLBBBLAONU-UHFFFAOYSA-N	435.484	1.574	50	20	IDGD	
CCOC(=O)/C=C\c1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)cc1	763855656	AASKWGNCHWWPIO-ZVHGMHCTSA-N	443.431	1.955	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccc(OCCN(C)C)cc1	763856219	FNCJWINQKGCTJN-AWEZNQCLSA-N	432.452	1.320	50	20	IDGD	
C[C@@H](c1cccc(NC(=O)C(=O)NNC(=O)Cc2c[nH]c3ccccc23)c1)N1CCOCC1	763861283	QHLVLPMWXQTPKE-INIZCTEOSA-N	449.511	1.890	50	20	IDGD	
CCCN1CCN(c2ccc(NC(=O)C(=O)NNC(=O)c3ccc[nH]3)cc2Cl)CC1	763980365	SPAFPKRDQJCDGX-UHFFFAOYSA-N	432.912	1.600	50	20	IDGD	
Cc1ccc(-c2nnco2)cc1NC(=O)C(=O)NNC(=O)c1cc(Br)c[nH]1	763994328	CHADKHCZCIPVTB-UHFFFAOYSA-N	433.222	1.535	50	20	IDGD	
COCCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)Cc2ccsc2)cc1Cl	764036069	WXOPKYYZCTZJQB-UHFFFAOYSA-N	438.893	1.106	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2cc(Cl)ccc2C(=O)N(C)C)cc1	764128111	ZLNKAVMQUYGCBC-UHFFFAOYSA-N	446.891	1.769	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(F)cc2OCC#N)o1	764139485	UUXIQABIUPDWQV-UHFFFAOYSA-N	431.424	1.563	50	20	IDGD	
O=C(CC1CC1)NNC(=O)C(=O)Nc1ccc(CN2CCN(Cc3ccccc3)CC2)cc1	764142873	LZXGZDRHSFCJAM-UHFFFAOYSA-N	449.555	1.890	50	20	IDGD	
CCOCCOc1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)[C@@H]1Cc2ccccc2O1	764169420	VZVHKWJLSMKPPS-SFHVURJKSA-N	447.875	1.845	50	20	IDGD	
CC(=O)N1CCCc2cc(NC(=O)C(=O)NNC(=O)Cn3ccc4ccccc43)ccc21	764241604	CLOQBFFAOLISOX-UHFFFAOYSA-N	433.468	1.727	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2O)n(-c2cccc(Cl)c2)n1	764278295	UZPCPRGNQNIDFF-UHFFFAOYSA-N	443.847	1.705	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C(=O)Nc1ccc(CNS(C)(=O)=O)cc1)c1ccccc1	764327969	IECXORQXECLXIW-KRWDZBQOSA-N	432.502	1.016	50	20	IDGD	
CCN(CC)c1nc2sc(C(=O)NNC(=O)CNC(=O)c3cccnc3)cc2s1	764345842	YPXYOPUUTRDJMK-UHFFFAOYSA-N	432.531	1.790	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)Cc2ccncc2)ccc1NC(=O)OC(C)(C)C	764354584	UEBYAQIJNWFCNB-UHFFFAOYSA-N	443.460	1.766	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)C(=O)Nc1ccn(-c2cccc(C(F)(F)F)c2)n1	764389283	QZKHPWBLKFGEBZ-UHFFFAOYSA-N	432.362	1.994	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1cc(-c2nnco2)ccc1C	764392398	FJXBVGKNGIHZNL-UHFFFAOYSA-N	441.469	1.932	50	20	IDGD	
CNC(=O)Cn1ccc2ccc(NC(=O)C(=O)NNC(=O)c3ccc(Cl)cc3F)cc21	764410651	LVQPQBQQAZKBNF-UHFFFAOYSA-N	445.838	1.580	50	20	IDGD	
C[C@@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3ccc(Cl)cc3F)cn2)C[C@@H](C)O1	764411363	VXLKXGLEMNCYGW-VXGBXAGGSA-N	449.870	1.887	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)[C@H]2CN(C(=O)OC(C)(C)C)CCO2)cc1	764560640	XTZCMQFSUUJFID-RHSMWYFYSA-N	437.493	1.636	50	20	IDGD	
Cc1c(C(=O)NNC(=O)CSc2ccccc2O)nnn1-c1ccc2c(c1)OCCO2	765248423	RRXFTSLFANPZHT-UHFFFAOYSA-N	441.469	1.606	50	20	IDGD	
COc1cc(OC)cc(N2CC[C@@H](NC(=O)NNc3ccccc3S(C)(=O)=O)C2=O)c1	767069123	QFHCERKDYRVTKZ-QGZVFWFLSA-N	448.501	1.539	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3cc(F)cc(Cl)c3O)cc2)CC1	769018230	YLAITFVEVSZSSA-UHFFFAOYSA-N	442.900	1.878	50	20	IDGD	
O=C(CN1CCC(O)(Cc2cccc(F)c2)CC1)NNC(=O)c1ccc([N+](=O)[O-])cc1	770699820	HZEFMGVBEMPDHC-UHFFFAOYSA-N	430.436	1.565	50	20	IDGD	
Cc1cccc2c(=O)n(CCC(=O)NNc3nc(O)c4cnn(C(C)(C)C)c4n3)cnc12	770959780	ZJVMSOBAAYSGRN-UHFFFAOYSA-N	436.476	1.839	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)c3ccc4c(c3)CCN4S(C)(=O)=O)nc21	770966062	JVHDIKUWQWIWAY-UHFFFAOYSA-N	445.505	1.366	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)c3ccc(-n4ncc(C#N)c4N)cc3)nc21	770966502	UUXXXORGNVZXND-UHFFFAOYSA-N	432.448	1.683	50	20	IDGD	
CCc1nnc(O)c(C(=O)NNC(=O)c2cc(-c3ccc(OC)c(OC)c3)[nH]n2)c1CC	771046228	RNNWVGSWVDZGCK-UHFFFAOYSA-N	440.460	1.789	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3ccc(-c4nc[nH]n4)cc3)n[nH]2)cc1OC	771439810	HQFJAURIXBJFFR-UHFFFAOYSA-N	433.428	1.954	50	20	IDGD	
COc1ccc(COCCNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1	771906103	USNHCOMPRHKOBV-UHFFFAOYSA-N	435.506	1.149	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)[C@H]1CCCN(S(=O)(=O)c2ccccc2)C1	771988158	JBLFQHDTYYPOKY-HOTGVXAUSA-N	439.534	1.213	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)c1ccc(F)c(S(=O)(=O)NC2CC2)c1	771992885	IEPSKZKGPDJCII-NSHDSACASA-N	429.470	1.005	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)c1c[nH]c2ccc(I)cc2c1=O	772655960	AORRFLKILLBSFZ-UHFFFAOYSA-N	437.197	1.239	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cnc(C3CCCC3)nc2N)cc1OC	772684687	UNTCQUHFWFWLTA-UHFFFAOYSA-N	443.460	1.352	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)c1c[nH]c2ccc(I)cc2c1=O	772746487	PFHFKTZHQFJZAN-UHFFFAOYSA-N	448.220	1.531	50	20	IDGD	
COc1c([N+](=O)[O-])ccc(C=NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1O	772989782	JRNSOGVULUNUAD-UHFFFAOYSA-N	448.457	1.857	50	20	IDGD	
Nc1nc(Cl)cc(NNC(=O)CS(=O)(=O)Nc2ccc(N3CCCCC3)cc2)n1	773867055	ONOWSRHHZDCRCY-UHFFFAOYSA-N	439.929	1.588	50	20	IDGD	
CC(=O)Nc1cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)ccc1F	774007885	CLMORLAASXKMEV-JTQLQIEISA-N	436.827	1.991	50	20	IDGD	
CS(=O)(=O)Cc1ccc(Cl)cc1S(=O)(=O)NNC(=O)c1ccc(C#N)cc1	774616430	SYJCKMQEHSQDEO-UHFFFAOYSA-N	427.891	1.380	50	20	IDGD	
CN(C)CC(=O)NNC(=O)Nc1ccc(CC(=O)N2CCN(c3ccccc3)CC2)cc1	775479885	LHCMSFWHRHKARW-UHFFFAOYSA-N	438.532	1.292	50	20	IDGD	
Cc1sc2ncc(C(=O)NNc3ccc(S(=O)(=O)NC4CC4)cc3)c(=O)n2c1C	775695612	PBHVSDBUTOYACW-UHFFFAOYSA-N	433.515	1.570	50	20	IDGD	
CN(NC(=O)CSC[C@H]1CCCCO1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776204680	DSHDGWFSDPSJCO-OAHLLOKOSA-N	430.571	1.924	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)CCC/N=C2/NS(=O)(=O)c3ccccc32)c1	776530747	OMTGXEATTCHNRT-UHFFFAOYSA-N	436.515	1.052	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)[C@H]2CCCN(S(=O)(=O)c3ccccc3)C2)c1	776538559	IRSMFOAYZGFXIL-HNNXBMFYSA-N	437.543	1.634	50	20	IDGD	
CSc1nc(C2CC2)nc(C)c1C(=O)N1CCN(S(=O)(=O)CBr)CC1	777832573	NEOVFMQHSPQOHP-UHFFFAOYSA-N	449.396	1.824	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)[C@@H](C)NC(=O)CC(C)(C)C	778494852	PUMZMXSYRLPLCF-LLVKDONJSA-N	427.885	1.594	50	20	IDGD	
COCC(=O)N1CCc2cc(NC(=O)C(=O)NNC(=O)c3ccc4ccccc4n3)ccc21	778706582	WYZPYLSSXZNAHH-UHFFFAOYSA-N	447.451	1.170	50	20	IDGD	
CC(C)(C)OC(=O)NCC(F)(F)CNC(=O)NNC(=O)COc1ccccc1C#N	779669282	MXSAMCDOKLQNNY-UHFFFAOYSA-N	427.408	1.427	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(I)c(C(=O)N2CC=C(C#N)CC2)c1	780687998	UAFUPBXEYDXFOM-UHFFFAOYSA-N	445.282	1.837	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)c2cnc3c(c2)nnn3C)c2ccccc2c1=O	780978416	GDOOIZLKIFGXOM-UHFFFAOYSA-N	434.460	1.338	50	20	IDGD	
COC(=O)CCCC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	780979854	XRHUSFIIHAOUGG-UHFFFAOYSA-N	425.488	1.653	50	20	IDGD	
O=C1CN(c2ccc(NC(=O)C(=O)NN(Cc3ccccc3)c3ccccc3)cn2)CCN1	782822308	ZMJHNEUASQGJTA-UHFFFAOYSA-N	444.495	1.694	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)c2cccnc12	783265644	WGOXUZPFXOJFSE-UHFFFAOYSA-N	442.501	1.707	50	20	IDGD	
CN(c1ccccc1NC(=O)C(=O)NNC(=O)CNC(=O)c1ccco1)C1CCCC1	784004133	IQNXAFMBXHZSBR-UHFFFAOYSA-N	427.461	1.174	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ccc(F)c(F)c2F)cc1S(=O)(=O)N(C)C	784813635	RWJFXMSZRJPHAX-UHFFFAOYSA-N	430.408	1.744	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)C(=O)Nc1ccc(CCN2CCCC2)cc1	785066535	CZEUKUGFNMVDHM-UHFFFAOYSA-N	434.500	1.301	50	20	IDGD	
CCOc1cc(F)ccc1NC(=O)C(=O)NNc1c(OC)cccc1S(C)(=O)=O	785330893	NTLJMEPQJDVBHR-UHFFFAOYSA-N	425.438	1.718	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@@H]2CC(c3c(F)cccc3F)=NO2)c2ccccc2c1=O	785688803	JCOSQVKCHJETFE-INIZCTEOSA-N	441.394	1.649	50	20	IDGD	
O=C(NC[C@H](O)c1cc(F)cc(Cl)c1)NNC(=O)C1CCN(c2ncccn2)CC1	787857708	JJHXSAOCPIHSIL-INIZCTEOSA-N	436.875	1.550	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccc2c1OC(C)(C)C2	789587417	XQQOTFPPVYYEFC-UHFFFAOYSA-N	427.457	1.964	50	20	IDGD	
CCNC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(OC)c(OC)c2)c1C	789729689	FLNBXFGLSDNPSQ-UHFFFAOYSA-N	443.460	1.553	50	20	IDGD	
COc1c(C)cnc(Cn2cnc(NC(=O)C(=O)NNc3cccnc3Cl)n2)c1C	789764591	ZKPDRQZDOBWDBH-UHFFFAOYSA-N	430.856	1.477	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)NC[C@@H]2CC[C@@H](O)C2)cc1	789856725	BRYMGRHRTBZYOX-FOJINDKQSA-N	437.500	1.618	50	20	IDGD	
O=C(CCC(=O)c1ccc(I)cc1)NNC(=O)CN1CCCC1=O	789857644	ZGWTZFPVZGDIBJ-UHFFFAOYSA-N	443.241	1.024	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)[C@@H](CCS(C)(=O)=O)c2ccccc2)nc2ccccc21	789869755	XKANHLZEFXXQHH-INIZCTEOSA-N	428.514	1.482	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@H]12	789911105	HGMMZPVKQVHNAS-NOLJZWGESA-N	426.926	1.835	50	20	IDGD	
COCCN(C)c1ccc(C=NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cn1	790141451	HCGYCJNSOUKRGX-UHFFFAOYSA-N	445.545	1.713	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)c2nnn(Cc3ccc(F)cc3F)c2C)c1	792216140	QMPDLCHUBJCVNO-UHFFFAOYSA-N	430.415	1.795	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)Cc2ccccn2)n(-c2nc3ccccc3s2)n1	793025970	OVYQJIAXIQHBCB-UHFFFAOYSA-N	435.469	1.514	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3ccn(C)c(=O)c3c2)o1	793026928	VLOORNKDPDBDQH-UHFFFAOYSA-N	439.472	1.373	50	20	IDGD	
CC[C@H](C)[C@H](NC(C)=O)C(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	794955750	BKDWYWYTMKPOMB-YWZLYKJASA-N	449.515	1.700	50	20	IDGD	
CC[C@@](NCC(=O)NNC(=O)Cc1nc(C)cs1)(C(=O)OC)c1ccc(Cl)cc1	796446730	BKICREGIJRFXOJ-IBGZPJMESA-N	438.937	1.863	50	20	IDGD	
Cc1ccc(N2CCOCC2)cc1NC(=O)C(=O)NNC(=O)CSc1ccccc1O	797535661	PIKZIJKOYCTZDL-UHFFFAOYSA-N	444.513	1.415	50	20	IDGD	
Cc1ccc(N2CCOCC2)cc1NC(=O)C(=O)NNC(=O)c1cc2c(s1)CCC2	797535681	PNYBBWMZBYFPSQ-UHFFFAOYSA-N	428.514	1.782	50	20	IDGD	
C=CCNC(=S)NNC(=O)c1ccccc1NS(=O)(=O)c1cccc([N+](=O)[O-])c1	798307064	JADALFKWVIAYIQ-UHFFFAOYSA-N	435.487	1.691	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)NCCN2CCN(C)C(C)(C)C2)cc1OC	799397350	WGJLXRWFVPOGOT-UHFFFAOYSA-N	435.569	1.844	50	20	IDGD	
CC(=NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)c1cc(C)n(C)n1	799868257	USGBFGAYZZHZGW-UHFFFAOYSA-N	433.534	1.222	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)c2cncc(-n3ccnn3)c2)cc(OCC)c1OCC	801798599	XSJVKWBSZNTCGY-UHFFFAOYSA-N	440.460	1.933	50	20	IDGD	
O=C(CNS(=O)(=O)c1cccs1)NNC(=O)Nc1ccc(Br)cc1	801997417	DUHVUDICMLOEPL-UHFFFAOYSA-N	433.309	1.642	50	20	IDGD	
COc1cccc(C2=NO[C@@H](C(=O)NNC(=O)Nc3ccc(S(C)(=O)=O)cc3)C2)c1	802067187	OYZQVTHDVQRBIB-QGZVFWFLSA-N	432.458	1.445	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)c2ccc(=O)n(-c3cnn(C)c3)c2)c(OC)cc1Cl	802082995	VSSNFVLQJPQOTH-UHFFFAOYSA-N	446.851	1.708	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)CN2C(=O)[C@@H]3CCCC[C@H]3C2=O)c(OC)cc1Cl	802084771	JIOSCHPJYKVKDR-GHMZBOCLSA-N	438.868	1.685	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@H]2C(=O)NNC(=O)Nc2ccc3c(c2)OCO3)cc1	802102440	QJMSZHIDJFLVAU-INIZCTEOSA-N	426.429	1.881	50	20	IDGD	
COc1ccc(C2=NO[C@@H](CNC(=O)NNC(=O)COc3ccc(C#N)cc3)C2)cc1F	802348085	OOPPXEACHKTZBM-MRXNPFEDSA-N	441.419	1.608	50	20	IDGD	
COc1cnc(NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)s1	806515716	VAUHNODRWIWXTA-UHFFFAOYSA-N	425.492	1.403	50	20	IDGD	
COc1cc(C)c(NC(=O)C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c(C)c1C	806976796	XBZONSANPFIDIC-UHFFFAOYSA-N	433.486	1.424	50	20	IDGD	
COc1cc(F)cc(NNC(=O)C(=O)Nc2cc(CS(C)(=O)=O)ccc2OC)c1	807026016	ZJMQWLQECNOGLK-UHFFFAOYSA-N	425.438	1.469	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@](C(=O)NNC(=O)CNC(=O)c2ccco2)(C(F)(F)F)C1	808344386	UZSMDJXBUPQXBV-KRWDZBQOSA-N	448.398	1.346	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2cc(C)nc3c2cnn3C(C)C)n1	809116108	XOSDARGIUIFJGO-UHFFFAOYSA-N	430.490	1.632	50	20	IDGD	
COC(=O)Cc1occ(C)c1C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	809937698	DRALUAOFEQYZKJ-UHFFFAOYSA-N	428.489	1.277	50	20	IDGD	
CNC(=O)c1cc(Oc2ccc(NC(=O)C(=O)NNc3cc(C)ncn3)cc2F)ccn1	810394405	WXIXKNVGZMXLPS-UHFFFAOYSA-N	439.407	1.553	50	20	IDGD	
O=C(COc1cc(C(F)(F)F)cc(C(F)(F)F)c1)NNC(=O)[C@@H]1CCS(=O)(=O)C1	812205430	NCFPRDGYRKCMFZ-MRVPVSSYSA-N	448.341	1.685	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2ccnc(N3CCC[C@H](C)C3)c2)n1	812652409	FCHJETGUUHTEKN-ZDUSSCGKSA-N	431.518	1.630	50	20	IDGD	
Cc1nnnn1-c1cc(NC(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)ccc1F	812932804	GPARUXAKRRROKS-UHFFFAOYSA-N	434.457	1.509	50	20	IDGD	
Cc1nn(-c2ccccc2)cc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	813033911	QWCQDXPFUAOZCC-UHFFFAOYSA-N	442.501	1.513	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)cc1)[C@@H]1C[C@H]1C	815564421	IKSQBUUZOYZGOT-SJKOYZFVSA-N	438.440	1.576	50	20	IDGD	
CC(C)c1nc2ccc(NC(=O)C(=O)NNC(=O)[C@@H]3CCc4nncn4C3)cc2s1	815691408	PHMLIACXXNZNNM-LLVKDONJSA-N	427.490	1.360	50	20	IDGD	
Cn1c(NNC(=O)c2ccc(S(=O)(=O)NC[C@H]3CCCO3)cc2)nc2ccccc21	816577359	JFORFVNFMQVDSC-OAHLLOKOSA-N	429.502	1.788	50	20	IDGD	
CCOc1ccc(NNC(=O)[C@H](CCC(N)=O)NS(=O)(=O)c2ccc(C)c(C)c2)cc1	817925340	CBGATYBVDKCBKG-IBGZPJMESA-N	448.545	1.758	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(C(F)(F)F)nc2O)c1	821910939	QINRFGHYYKNUCK-UHFFFAOYSA-N	432.380	1.131	50	20	IDGD	
CCCCn1c(N)c(N(CC)CC(=O)NNC(=O)c2cccc(Cl)c2)c(O)nc1=O	822025433	WBBSPAUNXFDIEH-UHFFFAOYSA-N	436.900	1.272	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)c1cc(S(=O)(=O)NC2CC2)ccc1C	825649204	HFACEOQBVOWTHH-UHFFFAOYSA-N	432.502	1.317	50	20	IDGD	
COc1ccc(N2C(=O)/C(=C/NNC(=O)CCCO)c3ccccc3C2=O)cc1OC	912752985	HWTDPGIEDUUCOQ-GHRIWEEISA-N	425.441	1.625	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)[C@H]2CC(=O)N(c3ccc(F)c([N+](=O)[O-])c3)C2)c1	913120341	HCVCYUVSUAVFRP-ZDUSSCGKSA-N	429.408	1.614	50	20	IDGD	
N#Cc1ccnc(N2CCN(C(=O)NNC(=O)c3ccc(Br)s3)CC2)c1	913630413	UFQUHHSOTURCAB-UHFFFAOYSA-N	435.307	1.954	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)NC[C@H](c1cccs1)N1CCN(C)CC1	915902070	PINIJCNTIPOEKO-MRXNPFEDSA-N	447.561	1.455	50	20	IDGD	
Cc1cc(C)nc(SCC(=O)NN=C2C(=O)Nc3cc(N4CCOCC4)ccc32)n1	915937024	KDTUQKTXVCHNTL-UHFFFAOYSA-N	426.502	1.495	50	20	IDGD	
CC(=NNC(=O)Cn1nnc(-c2ccccc2)n1)c1cccc(S(=O)(=O)N(C)C)c1	915938435	VUJPJKAJOLYDKR-UHFFFAOYSA-N	427.490	1.131	50	20	IDGD	
O=C(NCCN1CCN(c2ccc(F)cc2)CC1)NNc1ccc(-n2cccn2)nn1	916514383	BQVUBHTYKZXNEQ-UHFFFAOYSA-N	425.472	1.250	50	20	IDGD	
Cc1n[nH]cc1CNC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	916578298	CPLMXXFQIAAAGV-UHFFFAOYSA-N	442.501	1.341	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)NCc1cccc(S(N)(=O)=O)c1	916623915	DEAMJWDYGCJSQZ-CQSZACIVSA-N	442.497	1.785	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)NCCS(=O)(=O)NCc1ccccc1	916645466	XICSWRVCWVFYLK-UHFFFAOYSA-N	434.518	1.078	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(CNC(=O)NNC(=O)Nc2ccccc2C)cc1	916649110	IMVAXWNRRQSSDC-UHFFFAOYSA-N	435.506	1.456	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)CCNS(=O)(=O)c1cccc(Cl)c1	919820017	GVPGRZXXARABRT-UHFFFAOYSA-N	425.894	1.407	50	20	IDGD	
CC(C)(C)c1ccc(S(=O)(=O)NCCC(=O)NNc2nncc(N)c2Cl)cc1	1319207347	GCNDNNRVYRNXKF-UHFFFAOYSA-N	426.930	1.821	50	20	IDGD	
O=C(CN1C(=O)CNC1=O)NNC(=O)c1ccc(CSc2ccc(Cl)cc2)cc1	1322111606	YJNQVMNYLZYIEN-UHFFFAOYSA-N	432.889	1.945	50	20	IDGD	
N#Cc1ccc(CN2CC[C@H](NC(=O)NNC(=O)c3cncn3-c3ccccc3)C2=O)cc1	1338989489	YUZXZTXOSGADJC-IBGZPJMESA-N	443.467	1.489	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc3cccnc3nc1O)C2)[C@@H](F)Cl	1778028424	JIYAZVHDEQQWBO-STXHMFSFSA-N	436.871	1.997	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)nn1C(F)F	1780306855	PQOWIXKCWQOHMZ-BZNIZROVSA-N	435.269	1.814	50	20	IDGD	
CCOc1ccc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)nn1	1780429204	GTQOZDYSIGSAIN-PXAZEXFGSA-N	427.299	1.102	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@@]3(CN(C(=O)CCBr)CCO3)C2)cc1OC	1780651253	MMLJMVNSTYYTDT-LJQANCHMSA-N	441.322	1.932	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)C1CCC(CO)CC1)C2)[C@H](F)Br	1780771218	WRESACHTFPRQQU-CRUJUIQGSA-N	449.361	1.990	50	20	IDGD	
Cc1cc(C)n(CCC(=O)N2CCO[C@@]3(CCN(C(=O)[C@](C)(Cl)CCl)C3)C2)n1	1781233869	OCTPISGOBBMUPF-MOPGFXCFSA-N	431.364	1.956	50	20	IDGD	
Cc1cncc(CCC(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)c1	1781325677	GYBMTPZMHVSIAF-SJLPKXTDSA-N	428.302	1.843	50	20	IDGD	
O=C([C@@H]1COc2ccccc2O1)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781326569	QHAOSCNGIBCBLA-MPGHIAIKSA-N	443.269	1.347	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)Cc3ccc(OC)cc3[N+](=O)[O-])C2)C1	1781412082	TWWQXRIAUJPYMD-OXJNMPFZSA-N	439.896	1.993	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnc3c(c2)CCNCC3)C1	1781526306	DJIGUVNPSWBDJK-JXHRLWIKSA-N	448.995	1.915	50	20	IDGD	
O=C(Cc1cc(F)ccc1F)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2	1783118316	RZEMUIHEXSTPAN-MBOZVWFJSA-N	430.879	1.621	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)Cc3cccc([N+](=O)[O-])c3)CCO2)C1	1783527240	ALKQUCAKCBSILG-UGSOOPFHSA-N	440.294	1.751	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)/C=C3\C(=O)Nc4ccccc43)CCO2)C1	1783534516	VNZJDAKVSANQQR-NWADFXISSA-N	448.317	1.635	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(OC(F)F)cc3)CCO2)C1	1783880944	NSIVZFOHVGDWBX-DNVCBOLYSA-N	432.851	1.985	50	20	IDGD	
O=C(C(Cl)Cl)N1CC[C@]2(C1)CN(C(=O)[C@@H]1CC(c3ccccc3)=NN1)CCO2	1783949277	IMCBFUIKPZDLHD-KXBFYZLASA-N	425.316	1.386	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4c(F)cc(F)cc4[nH]3)C[C@@H]21)[C@H](O)CCl	1784090436	GDBNGBBVXAGLKD-NQVRKPIFSA-N	441.862	1.639	50	20	IDGD	
CC(=O)N[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CO[Si](C)(C)C)C[C@@H]21)C(C)(C)C	1784313767	FDPRAUTWWKBINP-DWRORGKVSA-N	441.645	1.368	50	20	IDGD	
Cc1nn(C)c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)Br)C[C@@H]32)c1F	1785779392	UVPHTTFHMVNZCX-BQUFFADESA-N	431.306	1.244	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CSc3ncccn3)[C@H]2C1	1787072953	YLXXEQGZPIOEKS-JONQDZQNSA-N	426.970	1.956	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CNC(=O)c3ccco3)[C@H]2C1	1787080781	LCTCCSGJJKTLAJ-JKQORVJESA-N	425.913	1.397	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]2C1	1787451382	LYDYPKJAVRYKIQ-RZLSGREXSA-N	435.924	1.805	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc4ncccn34)[C@H]2C1	1788006326	SAVPCUWSDHSEQR-ABHRYQDASA-N	436.310	1.106	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)C[C@@H]21	1789865982	KCIMQQKFRHROJI-YCTNLIARSA-N	432.304	1.322	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4cn[nH]c4cn3)C[C@@H]21	1789867702	DABCWQIFGULQCM-NPWXVWPOSA-N	440.331	1.788	50	20	IDGD	
CC[S@](=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]2C1	1789867725	DWDACLMNMINJNL-DKFQIZQTSA-N	427.394	1.361	50	20	IDGD	
C[C@H](Nc1ccccn1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]2C1	1789926067	MCHKXUIRPBFKQG-YGJAXBLXSA-N	443.317	1.552	50	20	IDGD	
C[C@]1(C(=O)Nc2ccc(C3(NC(=O)c4cnccc4C(=O)NN)CCC3)cc2)CCCN1	1790462388	FXMMSVSPELSQOY-JOCHJYFZSA-N	436.516	1.575	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3c(C)noc3C)C[C@@H]21	1791252052	AALFAVFIROOSAZ-OWLYRPNTSA-N	427.929	1.458	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cncc(C(F)(F)F)c3)C[C@@H]21	1791255321	LNBDEBIIBNILEH-KSYCFECVSA-N	449.857	1.948	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)C[C@@H]21)C(Cl)Cl	1791297872	JTRLRKYRBKKJCC-VWSXDQIGSA-N	445.299	1.600	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)c1cc2ccc(Cl)cc2[nH]1	1792415261	SVBWJCNGNDRQLV-CZAMWMTLSA-N	426.300	1.624	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CC(=O)OC(C)(C)C)C2	1792869035	YYFRZMOVKDPXIY-NFFDBFGFSA-N	433.343	1.339	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(C(F)(F)F)c1F)C2)[C@H](O)CCl	1792980117	LUZZGMNNPSWVPI-YJKIEOBBSA-N	438.805	1.647	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CC[C@H](C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](O)CCl)C1	1793106671	GUPMDOHHPCMLEW-NEXGVSGLSA-N	443.972	1.918	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1C[C@H]1c1ccc(OC)cc1	1793301269	ILVRBQMRWCPLFU-ZNRYJCSXSA-N	436.936	1.642	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1n[nH]c3c1CS(=O)(=O)C3)C2	1793681633	YTSNQHMEJWUMFO-OPDFLTKYSA-N	428.942	1.497	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccnnc1)C2	1794141421	YSKIBBLICDLVMM-FZKCQIBNSA-N	437.928	1.861	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cn1cc([N+](=O)[O-])cn1	1794273982	AUYVIUPNHODQEH-FVCCEPFGSA-N	428.287	1.461	50	20	IDGD	
Cc1csc(CCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)c1	1794355870	RCVXZWIJMMYJFR-REPLKXPHSA-N	426.347	1.621	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(F)c1[N+](=O)[O-])C2	1795115109	JPZZXKIVKMZPBO-QHBPRCKVSA-N	444.257	1.722	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CS(=O)(=O)c1ccc(C)cc1	1795747168	BUCPQEWIYVXCNH-DFGXFYAUSA-N	442.965	1.661	50	20	IDGD	
Cc1nc2ccncc2cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1	1796191437	LRSQRVWXSOYXFD-ACDBMABISA-N	444.300	1.184	50	20	IDGD	
Cn1c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Cl)cc2c1-c1ncccc1OC2	1796363388	QWZSDHJPIHHVRU-UESRRSCYSA-N	448.882	1.717	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](F)Cl)[C@H](O)C1	1796803674	AEAAHCBGHHOQKG-VNAATALASA-N	447.935	1.777	50	20	IDGD	
CC(=O)O[C@@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2)C(C)C	1798273539	GUDQUFYKRYUCKK-LGZBGAKXSA-N	445.520	1.346	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CC[C@H]3CCC(=O)N3C1)C2	1799277385	YQJFMWDDFWALAT-FDWMWLBGSA-N	446.375	1.213	50	20	IDGD	
COc1cc(C#N)cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Br)c1	1799349304	WFNJWHULWNTOFD-XRGAULLZSA-N	440.269	1.461	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)CBr)C2	1800637626	FLMGRFIAWATAOE-WJTVCTBASA-N	440.176	1.781	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)COc1ccccc1F	1800647276	AZBAHCFXOVHVGX-KYZVSKTDSA-N	443.313	1.968	50	20	IDGD	
COc1nc(C)ccc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)Br	1800760392	MWFAODXMHINGHJ-GUIRCDHDSA-N	426.311	1.385	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Br)C3)C1	1800967206	BVKKVTZPAYMMRZ-DEPYFDJDSA-N	449.317	1.246	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(-c3cc[nH]n3)cc1)C2	1800976881	CCSHZGISFZWGTJ-SFNKJDCFSA-N	432.908	1.534	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(C(N)=O)cc1	1801658132	IUFWFFXZUNVCCO-FZKCQIBNSA-N	438.322	1.162	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H](CNC(=O)[C@H]2CCC(=O)NC2)[C@H]1c1cccnc1	1802611308	SUFXWOWAGQYYPA-MJEZEWASSA-N	441.359	1.850	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cc3cn[nH]c3cn2)[C@H]1c1cccnc1)[C@@H](O)CCl	1803142917	MVMWFJFASAIUSA-KKXDTOCCSA-N	428.880	1.272	50	20	IDGD	
O=C([C@@H](O)CCl)N1CCC2(CCCN(C(=O)[C@@H]3CC(=O)N(C4CCCC4)C3)C2)CC1	1806604149	MRQSKSPVSGJKPT-AEFFLSMTSA-N	439.984	1.608	50	20	IDGD	
Cc1cccc(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)c1	1807375423	OPEVEFDSGWHXCY-GMAHTHKFSA-N	443.312	1.703	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2cccnc2C(N)=O)[C@H]1c1cccnc1	1808251309	QVNWZNGTISFQMU-HFTRVMKXSA-N	429.908	1.913	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)c1cccc2c1OCCO2	1809232361	DKZWXZGLJVYNPM-KVSKMBFKSA-N	445.903	1.772	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)c1ccc2[nH]ccc2n1	1809788749	VQEJSMJYIXKGKA-ZOCIIQOWSA-N	427.892	1.877	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)c1ccn2cncc2c1	1809965795	FIZTWSMWJFBPEI-YTQUADARSA-N	427.892	1.649	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)C(Cl)(Cl)Cl)CC2)C1	1809979901	DWQYYIQAJMTZDQ-UHFFFAOYSA-N	447.555	1.581	50	20	IDGD	
COc1ccc(C(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)c(O)c1	1811749777	HYEGZXAYUVRQTD-GDIGMMSISA-N	433.892	1.715	50	20	IDGD	
Cc1nc(C(=O)N2CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)cs1	1813070446	JATYFPWSWSISHS-UZLBHIALSA-N	444.561	1.539	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@H]1CCc2nc(NC(=O)CC(F)(F)F)sc2C1	1814450391	WCLUFKYCILRWBQ-QMMMGPOBSA-N	442.423	1.320	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H]2CCC(=O)N2)n[nH]1	1816965924	IMMDGECXUCUOAS-NTZNESFSSA-N	426.315	1.711	50	20	IDGD	
O=C(Cc1cccs1)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1817575937	GECBMBKVTDOBEH-GOSISDBHSA-N	438.318	1.700	50	20	IDGD	
C[C@@H]1C[C@]1(C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819403825	HXOJLOXBFWVJEU-PKQAIAMASA-N	425.493	1.760	50	20	IDGD	
CNC(=S)NCCC(=O)Nc1cc([C@H]2CCCCN2C(=O)CO[Si](C)(C)C)[nH]n1	1819407574	QUEVEDWTYDJPRE-CQSZACIVSA-N	440.646	1.737	50	20	IDGD	
C[C@@H]1C[C@@]1(C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1820770699	VEUVEKHRDZKEFM-PTPDTQQLSA-N	425.493	1.760	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](C)N2CCN(C)CC2)n[nH]1	1820793747	SLEWRZOYISJLBR-INMHGKMJSA-N	440.976	1.292	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2n[nH]cc2[N+](=O)[O-])[nH]n1	1822372809	NLCYLAZMQHHLDX-MWLCHTKSSA-N	425.833	1.601	50	20	IDGD	
O=C(COc1cccnn1)N[C@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1	1823013990	MECDJZZWELFKFH-SDBXPKJASA-N	444.286	1.615	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc4nn[nH]c4c3)sc2C1	1824416708	XWGGIGUSJAEXRF-GHMZBOCLSA-N	434.909	1.894	50	20	IDGD	
C[C@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1)C1(O)CCC1	1827056153	UOWWWQUZDHTBLR-DYESRHJHSA-N	442.365	1.151	50	20	IDGD	
Cc1occc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2	1830537778	OEGCCRGOMFKLMK-UGSOOPFHSA-N	429.311	1.689	50	20	IDGD	
Cc1nc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)cs1	1830538094	VRNLKLPWFJCBQN-YVEFUNNKSA-N	446.367	1.553	50	20	IDGD	
COC1(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)CCC1	1830545737	MGGZBZYSCFPHTM-KXBFYZLASA-N	447.370	1.433	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnn4ccccc34)C2)C1	1831646094	FNHJIDJGKFRLPI-DYESRHJHSA-N	434.924	1.812	50	20	IDGD	
CC(F)(F)C(C)(C)C(=O)N1CCO[C@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1	1831682771	PBHFVKMEXZKMHH-IBGZPJMESA-N	436.572	1.976	50	20	IDGD	
Cc1csc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)c1	1831778718	GBHVKFJHEVYIER-CJNGLKHVSA-N	435.315	1.817	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccnc(F)c3)CCO2)C1	1831907114	GXIXHVKZRULOMY-YVEFUNNKSA-N	430.274	1.074	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3cccc(OC)n3)CCO2)C1	1832762758	GHSDOBIBMSFWJE-UTKZUKDTSA-N	439.940	1.497	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)C3(C(F)(F)F)CCC3)CC2)CC1)[C@@H](O)CCl	1833309464	WTVRJCYSGSAGPN-HNNXBMFYSA-N	439.906	1.890	50	20	IDGD	
COCC1(C(=O)NC2CCN(C3CCN(C(=O)CO[Si](C)(C)C)CC3)CC2)CC1	1833461549	RZIIMWANMFTLQR-UHFFFAOYSA-N	425.646	1.836	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)C3=NN(C)C(=O)CC3)CC2)CC1	1833688463	PBDMZWYMPOZGEZ-QGZVFWFLSA-N	439.988	1.574	50	20	IDGD	
C=CCCc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)c(O)n1	1833699175	UILLOHYQGRNMAI-JXFKEZNVSA-N	441.887	1.510	50	20	IDGD	
O=C(CNc1ccc(F)cc1)NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1834680254	VXTWKJTXSPZEHP-LJQANCHMSA-N	440.947	1.409	50	20	IDGD	
CC[C@H](C)[C@H](N)C(=O)NC1CCN(C2CCN(C(=O)[C@H](C)CBr)CC2)CC1	1834681737	GKPKHBYIWLHDIR-DAYGRLMNSA-N	445.446	1.962	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](OC)c1ccccc1)CCO2	1834928136	NUWWGHNNQDZAOA-WAOWUJCRSA-N	440.924	1.084	50	20	IDGD	
O=C(CCN1CCOC1=O)NC1CCN(C2CCN(C(=O)C(Cl)Cl)CC2)CC1	1835456212	DUJQINNGIHKCJP-UHFFFAOYSA-N	435.352	1.204	50	20	IDGD	
O=C(c1cnc2cc(Cl)ccn12)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1836369133	ZIPYAOSZLLONQV-CRAIPNDOSA-N	445.278	1.592	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC1CCN(C2CCN(C(=O)[C@H]3CCC(=O)N3)CC2)CC1	1836398448	KOGVDBOEAKDMLW-BEFAXECRSA-N	433.380	1.073	50	20	IDGD	
O=C(CCN1CCCCC1)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836716692	JIILLCDQZIJFGE-IBGZPJMESA-N	429.989	1.461	50	20	IDGD	
O=C(c1cccc2[nH]ncc12)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836717832	KVSLSWJSKYCUET-LJQANCHMSA-N	434.924	1.775	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)c3ncnn3C)CC2)CC1	1837371809	JMJJMVGPCDSPIG-OAHLLOKOSA-N	442.358	1.601	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)CN3CCOCC3)CC2)CC1	1837805253	AJCKGNLFXFDZKV-HNNXBMFYSA-N	446.386	1.101	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(F)cnc3Cl)CCO2)C1	1837859523	HMSLOSSQBSRWAV-RDTXWAMCSA-N	434.295	1.962	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)ccn1	1837940676	LTJVUUYFVYVQIG-YOEHRIQHSA-N	430.274	1.151	50	20	IDGD	
O=C(c1cccn2c(O)nnc12)N1CCC(OC2CCN(C(=O)[C@@H](F)Cl)CC2)CC1	1838061503	PWTPPBSTRPPXFA-OAHLLOKOSA-N	439.875	1.582	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(OC)cc3O)CCO2)C1	1838887702	RBXJTIOGKZCXNL-UWJYYQICSA-N	440.924	1.878	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ncc(OC)cc3F)C2)C1	1839143064	KLPQCKVBQWKXPX-KUHUBIRLSA-N	429.876	1.317	50	20	IDGD	
CC(C)n1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)n1	1839153758	RLTFRFCAZWKMNB-MOPGFXCFSA-N	447.363	1.770	50	20	IDGD	
CCN(CC)C[C@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)Br)C2)C1	1839680036	VVQTVTOFSFCYLO-FCEWJHQRSA-N	448.402	1.204	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCCn3cccc3)CCO2)C1	1840459418	GMAQANHILGHWCB-OAQYLSRUSA-N	425.957	1.990	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(F)c(F)c3C)CCO2)C1	1840705565	UBKDIVOQPRJAEX-MGPUTAFESA-N	446.878	1.597	50	20	IDGD	
CCN1CCC(C(=O)N2CCO[C@@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)CC1	1840926054	NFPOZJNTOZKJQC-NRFANRHFSA-N	429.989	1.440	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@H](NC(=O)c1ccccc1)[C@@H](C)O)C2	1841666634	OSSNDLMUCKQRCN-NJAFHUGGSA-N	435.952	1.777	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2c(F)cccc2F)C1	1844857745	UFTXZFZEDRPTOT-DHRITJCHSA-N	429.427	1.916	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC2(CCCN2C(=O)C2(N3CCN(C)CC3)CC2)C1	1845103144	FLYIXPPLHYEXBK-HNNXBMFYSA-N	427.387	1.143	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)[C@H](F)Br)C1	1845217496	CQJHNRAHNJQHII-QDBSGRMGSA-N	428.262	1.014	50	20	IDGD	
O=C([C@H](O)CCl)N1CC2(CCCN2C(=O)c2c(C(F)(F)F)nc3ccc(F)cn23)C1	1845723126	DDILUBWWDHCSCQ-LLVKDONJSA-N	448.804	1.909	50	20	IDGD	
CCOC(=O)N1CCC(C(=O)N2CC3(CCCN3C(=O)[C@H](C)Br)C2)CC1	1846180207	SXPZBPPQGZWHTC-ZDUSSCGKSA-N	430.343	1.842	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)N2CCCC23CN(C(=O)[C@H](O)CCl)C3)C1	1846186025	SNUFKSHXOAVUDD-HUUCEWRRSA-N	429.945	1.437	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@](C)(NC(C)=O)c1ccccc1F)C2	1846363825	GTQPMQLUTIZWIS-OXJNMPFZSA-N	439.915	1.634	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1csnn1	1847894668	ZZTHEPRRUGEHEO-GJZGRUSLSA-N	431.430	1.501	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)Cc2c(C)nc3nc(N)nn3c2C)cc1OC	12695473	YHDBEUAEJJUYFM-UHFFFAOYSA-N	441.492	1.515	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2ccccc2O)cc1S(=O)(=O)NC1CCCC1	17526224	ZTOJAIIJEIPBRS-UHFFFAOYSA-N	433.486	1.697	50	20	IDGD	
CCOc1ccccc1N1CCN(CC(=O)NNC(=O)c2ccc(OC)c(OC)c2)CC1	28906054	MEYIRRNYGKMULB-UHFFFAOYSA-N	442.516	1.686	50	20	IDGD	
O=C(NNC(=O)[C@@H](c1ccccc1)N1CCCCC1=O)c1csc(N2CCOCC2)n1	110946871	BMTPKZWLXVGWNL-GOSISDBHSA-N	443.529	1.495	50	20	IDGD	
Cc1ccccc1C(=O)N[C@H](CC(C)C)C(=O)NNC(=O)CNC(=O)c1cccs1	725741462	NMNVXGQFSZXBJI-MRXNPFEDSA-N	430.530	1.778	50	20	IDGD	
COc1ccc(CN2CCCN(C(=O)NNC(=O)CNC(=O)c3cccs3)CC2)cc1	725872054	ALAXMVNQFLZWNW-UHFFFAOYSA-N	445.545	1.435	50	20	IDGD	
CC[C@@H](C)C(=O)N1CCC[C@H](C(=O)OCC(=O)NNC(=O)c2ccc(OC)c(OC)c2)C1	726040889	ZSBBSFQMOPPHGZ-ZBFHGGJFSA-N	449.504	1.293	50	20	IDGD	
CC(=O)N[C@@H](CC(=O)NNC(=O)Cc1nc2ccccc2n1C)c1c(F)cccc1F	727365320	PRLYXHYUHAJECX-INIZCTEOSA-N	429.427	1.809	50	20	IDGD	
C#Cc1cccc(NC(=S)NNC(=O)c2cc(S(=O)(=O)N3CCCCC3)cn2C)c1	727500723	CBULQJVAPPJRLE-UHFFFAOYSA-N	445.570	1.812	50	20	IDGD	
CC(C)NC(=O)C(=O)NNS(=O)(=O)c1ccc(Br)cc1Br	728170223	AXCGICIUDFSRKN-UHFFFAOYSA-N	443.117	1.046	50	20	IDGD	
C[C@@H](Oc1ccc2c(c1)CCC2)C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	728326002	ATRQOUBBYBHJPE-JLTOFOAXSA-N	440.452	1.473	50	20	IDGD	
O=C(COC(=O)[C@@H]1CCCN1c1ncnc2sccc12)NNC(=O)c1ccccc1	728673188	OXWOJYDEUXBADM-HNNXBMFYSA-N	425.470	1.665	50	20	IDGD	
Cc1cccc(NC(=O)CSCC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1	728845638	NRIOXDZTFCAMCH-UHFFFAOYSA-N	442.545	1.521	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCCC(=O)NNC(=O)Cn2ccc3ccccc32)cc1	729449786	CENKSHVWYPSCQZ-UHFFFAOYSA-N	444.513	1.556	50	20	IDGD	
COc1cc(C=NNC(=O)CCc2ccccc2O)ccc1OCC(=O)N1CCOCC1	729937710	AMTCTNUYPAPIBW-UHFFFAOYSA-N	441.484	1.721	50	20	IDGD	
NC(=O)C1(C(=O)NNC(=O)CCN2CCN(C(c3ccccc3)c3ccccc3)CC2)CC1	731597985	ZOXBQQDMOCBSLW-UHFFFAOYSA-N	449.555	1.197	50	20	IDGD	
O=C(NN=C1CCOC1)c1ccc(S(=O)(=O)N2CCN(Cc3ccccc3)CC2)cc1	731925190	RXRVQJRZYARJNU-UHFFFAOYSA-N	442.541	1.699	50	20	IDGD	
O=C1N[C@H](C(=O)NNc2nc(-c3ccncc3)no2)CS[C@H]1Cc1ccccc1F	732065628	RVYDHPVHNNOJTE-GJZGRUSLSA-N	428.449	1.557	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)N[C@@H]2CCN(C3CCN(C)CC3)C2)cc1OC	734281149	BPWJPJVRJDSTIB-QGZVFWFLSA-N	433.553	1.597	50	20	IDGD	
CN(C)c1nccc(NNC(=O)CCNS(=O)(=O)c2ccc(Br)cc2)n1	740113097	ZUPKDZRCRZGBFP-UHFFFAOYSA-N	443.327	1.117	50	20	IDGD	
COc1ccc(S(=O)(=O)CCC(=O)NNC(=O)c2c[nH]c3ccccc23)cc1OC	740814177	LBFRWUFJQWJLCN-UHFFFAOYSA-N	431.470	1.810	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)c1cnn(-c2ccc(F)cc2)c1-n1cccc1	740850949	HVXIMNWYVDPKEL-UHFFFAOYSA-N	426.452	1.868	50	20	IDGD	
C[C@H](C(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1)[C@@H](NC(=O)OC(C)(C)C)c1ccccc1	742489419	BKYFFNNGAJPNRT-NUEKZKHPSA-N	439.534	1.471	50	20	IDGD	
CO[C@@H](CNC(=O)NNC(=O)c1csc(N2CCOCC2)n1)c1ccc(Cl)cc1	743509736	JSTOQQVRDVZDHE-HNNXBMFYSA-N	439.925	1.965	50	20	IDGD	
O=C(NC[C@@]1(N2CCOCC2)CCSC1)NNC(=O)Nc1ccc(OC(F)F)cc1	743557694	RZZPVOGQBCAJAX-SFHVURJKSA-N	445.492	1.832	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)[C@H]2CC(=O)N(c3ccc4c(c3)CCC4)C2)c1	744681806	DZKCTSGAYMUYJN-IBGZPJMESA-N	435.480	1.841	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)c1cnn(C)c1	745840826	ZXSDOYDLPFBUNZ-AWEZNQCLSA-N	434.522	1.300	50	20	IDGD	
O=C(CCN/C(O)=C1\N=CC=CC1=O)NNC(=O)c1ccc(F)cc1Br	746136261	KEBSLPPLOUTBIE-JQIJEIRASA-N	425.214	1.266	50	20	IDGD	
O=C(/C=C/c1ccc(I)o1)NNC(=O)Cc1cn2ccccc2n1	746549614	CEFMGKLUSPPRCC-FNORWQNLSA-N	436.209	1.935	50	20	IDGD	
O=C(NCCOCc1ccccc1)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	747589415	OTAFKNXYIVEMFC-UHFFFAOYSA-N	446.529	1.632	50	20	IDGD	
COc1ccc(-c2nn(-c3ccccc3)cc2C(=O)NNC(=O)C(=O)N2CCCC2)cc1	748246519	BSEHGJHOKANVAK-UHFFFAOYSA-N	433.468	1.931	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)N[C@@H](C)c1cc(F)ccc1N1CCC(O)CC1	748634493	XJAGTDDGCLYXIK-UONOGXRCSA-N	426.489	1.230	50	20	IDGD	
COc1cc(OC)cc(N2CC[C@H](NC(=O)NNC(=O)c3cccc(N(C)C)c3)C2)c1	748659598	BNFVWWZWDCJJRS-INIZCTEOSA-N	427.505	1.993	50	20	IDGD	
O=C(NNc1nc(-c2ccncc2)no1)c1cc(S(=O)(=O)N2CCC2)ccc1Cl	748708181	FEAAYLYNASNBPL-UHFFFAOYSA-N	434.865	1.936	50	20	IDGD	
O=C(NCCn1cccc1)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	753050238	SDHKJOFPEXAHHD-UHFFFAOYSA-N	430.472	1.834	50	20	IDGD	
CCS(=O)(=O)N1CCC(CNC(=O)NNC(=O)c2cc3c(s2)CC[C@@H](C)C3)CC1	754135957	SCVHSTKKZKGCRY-CYBMUJFWSA-N	442.607	1.879	50	20	IDGD	
CCS(=O)(=O)N1CCC(CNC(=O)NNC(=O)c2c(Cl)cccc2Cl)CC1	754189656	NXWZJONBENNKQB-UHFFFAOYSA-N	437.349	1.999	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NCc2cn(-c3ccccc3)nn2)cc1	755220236	KBNLXBWUXXHYNS-UHFFFAOYSA-N	429.462	1.207	50	20	IDGD	
O=C(NN=Cc1cnc2ncccn12)c1cccc(S(=O)(=O)NCc2ccccc2)c1	755487774	HATYGROBVIRFNC-UHFFFAOYSA-N	434.481	1.972	50	20	IDGD	
CNS(=O)(=O)c1cc(NC(=O)NNC(=O)c2cc(Br)c[nH]2)ccc1C	755515433	MFJPNJNMWFZBHC-UHFFFAOYSA-N	430.284	1.460	50	20	IDGD	
Cc1sc(Br)cc1S(=O)(=O)NNC(=O)[C@@H]1COc2ccccc2O1	755960395	YKQJKOJUHDKEON-NSHDSACASA-N	433.305	1.969	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2ccc(Cl)c(C(=O)NC)c2)c2ccccc2c1=O	756035054	CLTGUPFGUDRVBU-UHFFFAOYSA-N	442.863	1.896	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)Nc2ccc3c(c2)OCC(=O)N3)c2ccccc2c1=O	756116211	WYKPHQFWGPDFLU-UHFFFAOYSA-N	436.428	1.775	50	20	IDGD	
O=C(CC(F)(F)F)NNC(=O)Nc1ccc2c(ccn2CC(=O)N2CCOCC2)c1	756293856	KTCAZLVUVWFDIE-UHFFFAOYSA-N	427.383	1.605	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)c1ccnc(OCC(F)F)c1	758039253	BNSUTCSCSGXYFO-UHFFFAOYSA-N	433.459	1.699	50	20	IDGD	
COC(=O)c1coc(C=NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1	758074085	QXGJTSBJTQXAIJ-UHFFFAOYSA-N	449.485	1.170	50	20	IDGD	
O=C(c1cc(F)cc2nc(S)[nH]c12)N1CCN(S(=O)(=O)CBr)CC1	758512481	MJDRHHBCKNQESD-UHFFFAOYSA-N	437.316	1.431	50	20	IDGD	
COc1ccc2c(c1)C[C@@H](C(=O)N1CCN(S(=O)(=O)CBr)CC1)CO2	758528361	SLRZOERVKQTIIT-CYBMUJFWSA-N	433.324	1.073	50	20	IDGD	
O=C([C@H](c1ccccc1)n1cccn1)N1CCN(S(=O)(=O)CBr)CC1	758534128	CIOJKBBCSQGHNK-HNNXBMFYSA-N	427.324	1.299	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCC[C@H]([C@H](C)NC(=O)OC(C)(C)C)C2)n1	758780771	UITVVFWLVMIBAW-GJZGRUSLSA-N	439.582	1.767	50	20	IDGD	
C[C@H](CC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1ccncc1	759038590	DSPYJLFZSLFQRP-OAHLLOKOSA-N	432.502	1.057	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)N2CC=C(C#N)CC2)ccc1I	759082050	QUOXFZULEGYTQH-UHFFFAOYSA-N	432.239	1.922	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)c2sc(-c3c(C)c(C)nn(C)c3=O)nc2C)nc1	759725286	KPKCUFJWXZCTQZ-UHFFFAOYSA-N	428.474	1.768	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(Br)c(C(=O)NNc2ncc(F)cn2)c1	760911866	IJDZELSBIUBKDA-UHFFFAOYSA-N	448.274	1.060	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(OC[C@@H]2CCCO2)cc1	763446020	NVGHIRLJUGXNSW-KRWDZBQOSA-N	428.401	1.552	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)c2cccnc2)sc2c1CC[C@H](C)C2	763489174	VPXJWBPJQNBKOD-NSHDSACASA-N	430.486	1.844	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)C(=O)Nc1cccc(OCc2cccnc2)c1	763548156	LECDCSZOPRERHH-UHFFFAOYSA-N	434.408	1.789	50	20	IDGD	
COC(=O)C(C)(C)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(OC)c(OC)c2)cc1	763549973	CIGJAZFNCQFQHG-UHFFFAOYSA-N	443.456	1.554	50	20	IDGD	
CC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1Cl	763574471	BRFYWNMWHHPVJX-INIZCTEOSA-N	432.820	1.224	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2ccccc2-c2nnnn2C(C)C)c1	763624756	NDUUIMPZPPNNCY-UHFFFAOYSA-N	437.460	1.394	50	20	IDGD	
O=C(COc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1cnn(Cc2ccccc2)c1	763685925	ZVGGUYJXGVDYLC-UHFFFAOYSA-N	427.848	1.750	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)C(=O)Nc2cccc(OC[C@@H]3CCCO3)c2)c1	763753746	JKMIKBROYXIHJH-IBGZPJMESA-N	426.473	1.710	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cccc(N(C)C)c2)ccc1C(=O)NC(C)C	763757115	CMKADDKWAOAKDX-UHFFFAOYSA-N	425.489	1.599	50	20	IDGD	
CC(C)C(=O)NNC(=O)C(=O)Nc1ccccc1N1CCN(CCc2ccncc2)CC1	763832363	OMGVAMSEDRSOTR-UHFFFAOYSA-N	438.532	1.188	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)cc1N1CCOC1=O	763841511	RZBRUDIFDABZST-UHFFFAOYSA-N	430.392	1.256	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)cc1F	763848458	IAQKNMFWRVLEDW-ZDUSSCGKSA-N	431.420	1.783	50	20	IDGD	
CC(=O)Nc1c(C)ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)c1C	763864687	FVPJPUDSKZPJBS-CYBMUJFWSA-N	430.436	1.954	50	20	IDGD	
CC(=O)Nc1ccc(Cl)c(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)c1	763868037	ZWJDDVVRMYSDQC-SNVBAGLBSA-N	436.827	1.991	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2c(C)cc(Cl)cc2C)ccc1C(N)=O	763881392	DKGFGIXAZOTNMC-ZDUSSCGKSA-N	446.891	1.918	50	20	IDGD	
COCCOc1ccc(F)cc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccccc2)on1	764003876	POXMQUUGXSKGBV-UHFFFAOYSA-N	442.403	1.906	50	20	IDGD	
CC(=O)N(C)c1ccc(NC(=O)C(=O)NNC(=O)c2cccc(Br)c2)cc1	764059795	ZMCBYQMOAQKPPT-UHFFFAOYSA-N	433.262	1.832	50	20	IDGD	
CCOC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccccc2OC)cc1C#N	764136084	NMFADDYJLHHMKR-UHFFFAOYSA-N	439.428	1.464	50	20	IDGD	
Cc1ccc(C(=O)NC2CC2)cc1NC(=O)C(=O)NNC(=O)c1cccc2ncccc12	764258229	WRHSVYPODFKBDL-UHFFFAOYSA-N	431.452	1.835	50	20	IDGD	
CCCn1ccc2cc(NC(=O)C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)ccc21	764267351	UCHVTEKDFKVYDV-UHFFFAOYSA-N	449.515	1.844	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1ccnn1-c1ccc(Cl)cc1	764277626	LHCLTIPQOAPIIQ-UHFFFAOYSA-N	429.820	1.396	50	20	IDGD	
C[C@H]1CCCC[C@]12NC(=O)N(CC(=O)NNc1c(F)cc(C(=O)NC3CC3)cc1F)C2=O	764332069	BVDHGVIETJLUKW-MQJDWESPSA-N	449.458	1.801	50	20	IDGD	
Cc1cc(Br)ncc1NC(=O)C(=O)NNC(=O)c1ccc(O)c(Cl)c1	764350045	ZCQDOAWSELDQFA-UHFFFAOYSA-N	427.642	1.911	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl	764351985	VGILWJJYFQOBOT-UHFFFAOYSA-N	428.792	1.834	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(Oc2ccc(Cl)cn2)cc1	764397173	GNVKYSNSONSLKX-GFCCVEGCSA-N	436.852	1.665	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNS(=O)(=O)c1ccccc1F	765120186	ZSQYNEZVGSLWAN-UHFFFAOYSA-N	440.928	1.606	50	20	IDGD	
Cc1cccc(OCCCC(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)c1	765737476	ZWLIGJALDFIELR-UHFFFAOYSA-N	438.528	1.759	50	20	IDGD	
CC(C)(C)OC(=O)N[C@]1(C)CCCC[C@@H]1C(=O)NNC(=O)CNC(=O)c1cccnc1	766229961	ZCFMQKKVRJZNIY-QVKFZJNVSA-N	433.509	1.432	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)CN1CCCCCC1=O	766664174	ORMXXEFDMNFNKF-UHFFFAOYSA-N	435.956	1.008	50	20	IDGD	
Cn1ncc([N+](=O)[O-])c1C(=O)NNC(=O)COc1ccc(OCc2ccccc2)cc1	766758095	VLWPLVZLPFTGQY-UHFFFAOYSA-N	425.401	1.747	50	20	IDGD	
CCn1cc(S(=O)(=O)NNC(=O)c2ccc(CSc3nncn3C)cc2)nc1C	768036522	QKPAPAIYUOMMLS-UHFFFAOYSA-N	435.535	1.256	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(OC(C)C)c(OC)c1	768231911	IDYCNWAWKQUBSN-UHFFFAOYSA-N	431.445	1.656	50	20	IDGD	
Nc1c(C(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)ccnc1Br	768597607	SATZRVJDYLNXQJ-UHFFFAOYSA-N	427.642	1.698	50	20	IDGD	
CC(C)Cc1nnc(NC(=O)CCC(=O)NNC(=O)c2ccc3c(c2)OCCO3)s1	769470956	ZTLQTQQSPVHITL-UHFFFAOYSA-N	433.490	1.688	50	20	IDGD	
CSCCNC(=S)NNC(=O)[C@@H]1CCN(c2ccccc2Br)C1=O	770239118	GKNDHFGQUQNYHM-JTQLQIEISA-N	431.381	1.660	50	20	IDGD	
Cc1cc2c(N3CCC[C@H]3C(=O)NNC(=O)[C@H]3COc4ccccc4O3)ncnc2s1	770446086	FJOASENRBHMUBQ-WMLDXEAASA-N	439.497	1.956	50	20	IDGD	
C[C@H](C(=O)NNc1nc(O)c2cnn(C(C)(C)C)c2n1)N1C(=O)[C@H]2CCCC[C@H]2C1=O	770958044	GWCIWSCMGRKBHC-UTUOFQBUSA-N	429.481	1.294	50	20	IDGD	
COc1ccc(-c2nc(CC(=O)NNc3nc(O)c4cnn(C)c4n3)cs2)cc1OC	770974810	QREOJVRWUBTQGD-UHFFFAOYSA-N	441.473	1.895	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NN=Cc3cccc4nccn34)CC2)cc1	771098150	JXWAJNNZQRMJQC-UHFFFAOYSA-N	440.529	1.099	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2C[C@H](C)N(C(=O)OC(C)(C)C)C[C@H]2C)n1	772330471	LCWMZZNLLBEDQL-KGLIPLIRSA-N	425.555	1.471	50	20	IDGD	
CCC(CC)NC(=O)[C@@H]1CN(C(=O)C(=O)NNc2nccc(OC)n2)c2ccccc2O1	773724394	PETQQPJIBYKXDL-INIZCTEOSA-N	442.476	1.027	50	20	IDGD	
C=CCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)cc1	774007546	BOFISZODKDQGIS-ZDUSSCGKSA-N	444.875	1.809	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccccc1-n1cncn1	774008657	KOYGMCSPKGEBED-GFCCVEGCSA-N	428.836	1.474	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)c(OC)c1	774010225	WOWWYPKGLIXPFB-NSHDSACASA-N	449.847	1.689	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCc2ccc(OC(F)F)cn2)c2ccccc2c1=O	775219259	GPNPEMDWHFLSLI-UHFFFAOYSA-N	432.387	1.557	50	20	IDGD	
CCOc1ccc(NC(=O)NNc2ncc(F)cn2)cc1S(=O)(=O)N1CCOCC1	775467753	JDMOQGLBCSBEPT-UHFFFAOYSA-N	440.457	1.184	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2cc(Cl)ccc2O)nc1	776063895	ZHPZUHXGRKKTNC-UHFFFAOYSA-N	441.897	1.984	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@@](N)(c2ccccc2OC)C(F)(F)F)cc1OC	776103271	UFPOJMKWIXXXQO-SFHVURJKSA-N	427.379	1.890	50	20	IDGD	
CCNC(=O)N(C)NC(=O)CS[C@@H](C)C(=O)Nc1c(C)n(C)n(-c2ccccc2)c1=O	780710097	WIFCWKWPXVWZIK-AWEZNQCLSA-N	448.549	1.237	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)NCc2cccc(CN3CCC[C@@H](C(N)=O)C3)c2)c1	780827102	GHLPSQPUCYUKKD-LJQANCHMSA-N	439.516	1.997	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)cc1)C(=O)Nc1ccc(OCCN2CCCCC2)cc1	782833384	HNKZPNJCEBGBQN-UHFFFAOYSA-N	426.473	1.657	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C(=O)Nc2ccc(OC(F)(F)F)cc2)nc2ccccc21	782888678	XWHGOXBVFTZXEE-UHFFFAOYSA-N	435.362	1.801	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1ccc(Oc2ccncc2)cc1	784004331	WUWFMEHHAUIMBD-UHFFFAOYSA-N	439.453	1.451	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)C(=O)Nc1nc2c3c(ccc2s1)CCCC3	784005084	ZDZQWMPLIBTXCP-UHFFFAOYSA-N	441.469	1.284	50	20	IDGD	
COCCn1ncc2ccc(NC(=O)C(=O)NNc3cccc(S(C)(=O)=O)c3)cc21	784841405	IJRGYNISCYYFPZ-UHFFFAOYSA-N	431.474	1.168	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)C(=O)Nc2ccc(F)cc2OCC(F)F)c1	784844935	UOMVFMRFPZPFAN-UHFFFAOYSA-N	431.392	1.955	50	20	IDGD	
COc1cccc(NNC(=O)C(=O)Nc2cccc(Cn3nc4ccccn4c3=O)c2)n1	784847096	ZPIINGSILUDJCL-UHFFFAOYSA-N	433.428	1.030	50	20	IDGD	
Cc1cc(N2CCCC2)ccc1NC(=O)C(=O)NNC(=O)c1cc([N+](=O)[O-])ccc1O	785024520	VQFWPMCSJCXGAX-UHFFFAOYSA-N	427.417	1.609	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)C(=O)Nc1cnn(-c2ccccc2Cl)c1	785067777	NBWJWVXOBYNHED-UHFFFAOYSA-N	437.847	1.502	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2cc(N3CCNC3=O)ccc2C)c1	787541433	RXOFZZQGGNMCQT-UHFFFAOYSA-N	439.472	1.306	50	20	IDGD	
COc1ccc(Br)cc1C(=O)CCC(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1	788023257	JXKPBHCRZWUMBY-SNVBAGLBSA-N	447.307	1.003	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)CCc2ccc(OC)cc2)c(C)cc1C	788334546	XEGRRHRKHPKUQS-UHFFFAOYSA-N	427.457	1.817	50	20	IDGD	
CC(C)Oc1cc(NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)ccc1C(N)=O	788776403	CKXABDNDFLIYCT-UHFFFAOYSA-N	441.492	1.432	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2ccc(C(N)=O)c(OC(C)C)c2)c1	789732219	MNTBDJPQKOTNKC-UHFFFAOYSA-N	442.472	1.354	50	20	IDGD	
O=C(CCn1c(S)nc2ccccc2c1=O)NNC(=O)[C@@H]1COc2ccccc2O1	790092315	ZRCKYUAKRUHGQN-INIZCTEOSA-N	426.454	1.063	50	20	IDGD	
CCOc1nc(C)ccc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	790103893	NSFFYHMJHRNZTQ-UHFFFAOYSA-N	432.502	1.648	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(/C#N)C(=O)N2CCN([C@H]3CCS(=O)(=O)C3)CC2)c1C	790252236	LOXGHRHEZUNUNY-JFQZUNIRSA-N	448.589	1.551	50	20	IDGD	
Cc1c(C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)nnn1-c1cccc([N+](=O)[O-])c1	790328006	MSBVPYBIPKWXMS-HKUYNNGSSA-N	436.428	1.818	50	20	IDGD	
O=C(NNC(=O)N1CCc2cc(Br)ccc2C1)c1ccc(-n2cnnn2)cc1	791010822	YSGXAEIOQDRWDD-UHFFFAOYSA-N	442.277	1.838	50	20	IDGD	
CCOC(=O)c1cc(Cl)cc(S(=O)(=O)NNC(=O)CNC(=O)OC(C)(C)C)c1	793415181	JEKSTUGIXCUGAU-UHFFFAOYSA-N	435.886	1.351	50	20	IDGD	
C[C@@H](Oc1ccc(C=O)cc1)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	794743082	WIFLIPDBVHRLBG-OAHLLOKOSA-N	445.497	1.512	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2cnnn2-c2c(Cl)cccc2Cl)C[C@@H](C)O1	794898771	GGUOWOBEERPJJW-TXEJJXNPSA-N	441.319	1.834	50	20	IDGD	
COc1ccccc1-n1nccc1C=NNC(=O)Cc1csc(N2CCOCC2)n1	797401051	YZIJGGUDZMLNQD-UHFFFAOYSA-N	426.502	1.867	50	20	IDGD	
CS(=O)(=O)Cc1ccc(NC(=O)NNC(=O)CNC(=O)OCc2ccccc2)cc1	797619992	DZALFVJXGGNLPS-UHFFFAOYSA-N	434.474	1.310	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)C2=NN(Cc3ccc(F)cc3)C(=O)CC2)cc1C	798308716	MCQPZZPKWMCEMZ-UHFFFAOYSA-N	439.447	1.707	50	20	IDGD	
N#Cc1cccc(-n2ccc(C(=O)N3CCN(S(=O)(=O)CBr)CC3)n2)c1	798988881	DLECFLXPYGTNHG-UHFFFAOYSA-N	438.307	1.184	50	20	IDGD	
COC(=O)c1ccc(S(=O)(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)cc1OC	799123885	JZLAONWCBGRDPT-NSHDSACASA-N	442.877	1.912	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)C(=O)Nc1ccc(F)c(C2CC2)c1	799260332	NJHMSEBTTPBKAG-UHFFFAOYSA-N	433.465	1.396	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)N1CCC(S(=O)(=O)N2CCCC2)CC1	799921551	UIZCHCUOCHNQCT-UHFFFAOYSA-N	433.534	1.272	50	20	IDGD	
CNC(=O)CNC(=O)c1cccc(NC(=O)NNC(=O)c2cc3c(s2)CCCCC3)c1	800596606	OEZPYYPTQLOYCH-UHFFFAOYSA-N	443.529	1.959	50	20	IDGD	
Cc1c(NC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])nnn1Cc1ccccc1F	801806440	IIXBSXMOLJYWFE-UHFFFAOYSA-N	443.395	1.914	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)N[C@@H]1CCCN(C(=O)N2CCCC2)C1	805110445	UWANYBKKHGGNHI-QGZVFWFLSA-N	425.493	1.497	50	20	IDGD	
N#CCCCCCC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	805156166	KJWSMPDDLCLQLS-UHFFFAOYSA-N	436.534	1.262	50	20	IDGD	
COc1ccccc1[C@@]1(C)NC(=O)N(CC(=O)NNc2ccc([N+](=O)[O-])cc2C)C1=O	805387056	SHEMDCONYXQAJV-HXUWFJFHSA-N	427.417	1.822	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(NC(=O)NNC(=O)c2ccc3c(c2)OCCO3)ccc1F	806542658	XCFREHUYIFHNAF-UHFFFAOYSA-N	438.437	1.314	50	20	IDGD	
COC(=O)c1cc(Br)c(OC)cc1NC(=O)C(=O)NNC(=O)OC(C)(C)C	806980415	PHQPANNSLXDNFH-UHFFFAOYSA-N	446.254	1.739	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)C(=O)Nc1ccc2nc(C(F)F)sc2c1	807004844	XFLJFQZNJOANCX-UHFFFAOYSA-N	437.384	1.343	50	20	IDGD	
O=C(NCc1cnc2n1CCCC2)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	807264386	KCSFPFANXMVXPU-UHFFFAOYSA-N	446.533	1.148	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2c[nH]nc2-c2ccccn2)c1	809957692	UMOLMMAEBKIUJJ-UHFFFAOYSA-N	442.501	1.577	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CNS(=O)(=O)c2ccc(Br)cc2)c(O)c1	810172442	JKZYHQNLKSUSSF-UHFFFAOYSA-N	442.291	1.203	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)Nc1nc2cc(Cl)ccn2n1	810248316	WQEZWALZABOLMG-UHFFFAOYSA-N	442.911	1.748	50	20	IDGD	
C[C@H]1Oc2ccccc2[C@@H]1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	812432154	VHERNMNYQRXFIU-AUUYWEPGSA-N	444.513	1.937	50	20	IDGD	
CN(C)S(=O)(=O)CCNC(=O)NNC(=O)c1ccccc1OCc1ccc(F)cc1	812693897	KDWDOUGUYDDPJV-UHFFFAOYSA-N	438.481	1.240	50	20	IDGD	
Cn1cc(NC(=O)C(=O)NNC(=O)COc2ccc(Br)cc2)c(C2CC2)n1	812980239	QBIZFLYDGRLTBO-UHFFFAOYSA-N	436.266	1.225	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2cnn(C)c2-c2ccccc2)cc1	813033607	BFONXZDRJIIUFH-UHFFFAOYSA-N	442.501	1.419	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)c2c(I)cnn2C)c1	814102878	REEVLOOSBZZUNZ-UHFFFAOYSA-N	428.230	1.482	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NN=C(CNS(C)(=O)=O)c2ccccc2)C1	814973155	DEDKSTIZIQKMGV-INIZCTEOSA-N	438.550	1.703	50	20	IDGD	
CC(=NNC(=O)Nc1ccc2c(c1)OCO2)c1ccc(S(=O)(=O)NCCC(=O)O)cc1	814993417	ZNXWEPKYKLGJMZ-UHFFFAOYSA-N	448.457	1.714	50	20	IDGD	
Cc1ccnc(Oc2cc(NC(=O)C(=O)NNC(=O)[C@H]3CCc4nncn4C3)ccc2C)c1	815691851	CWFWXNPNUIERQF-HNNXBMFYSA-N	449.471	1.431	50	20	IDGD	
Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)C(=O)NNc1ncncc1F	815765325	NIGLSVSOVNWDOP-MRXNPFEDSA-N	438.467	1.649	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCO1)C(=O)Nc1ccc(NC(=O)c2cccc(Cl)c2)c(F)c1	815779130	RZGYHDONIVPWHV-MRXNPFEDSA-N	448.838	1.996	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCO1)C(=O)Nc1ccc(CC(=O)N2CCc3ccccc32)cc1	815780027	GRPPBMDRHZHVRU-LJQANCHMSA-N	436.468	1.083	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCc2nncn2C1)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1	816876560	ZLRABNDKVMHRJN-MRXNPFEDSA-N	435.444	1.822	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)c2sccc2S(=O)(=O)N2CCOCC2)c2ccccc21	818515725	SQAKKRVUFWMISV-UHFFFAOYSA-N	448.526	1.336	50	20	IDGD	
O=C(CNc1ccccc1)NNC(=O)CN1C(=O)c2ccc(Br)cc2C1=O	823327976	SMPZGMUSIUZCMP-UHFFFAOYSA-N	431.246	1.305	50	20	IDGD	
O=C(NNC(=O)c1cc2ccc(Br)cc2[nH]1)c1ccc(-n2cnnn2)cc1	913081850	IXPRKJKQYPESBF-UHFFFAOYSA-N	426.234	1.981	50	20	IDGD	
Cc1ccc(C)c(S(=O)(=O)NCC(=O)NNC(=O)c2ccc(Br)s2)c1	913164682	UQUJZTWQXCMLTP-UHFFFAOYSA-N	446.348	1.867	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)Cc1ccc(-n2cccn2)cc1	915804951	SLSSGCGAUDPLJP-UHFFFAOYSA-N	432.528	1.775	50	20	IDGD	
CCn1nc(C(=O)NN=C(C)c2cccc(S(=O)(=O)N(C)C)c2)c2ccccc2c1=O	915947212	JOSQZZUHNGCSFX-UHFFFAOYSA-N	441.513	1.821	50	20	IDGD	
CC(=NNC(=O)Cn1cnc2ccccc21)c1ccc(S(=O)(=O)N2CCOCC2)cc1	916273711	CDGMDMKQPAXJLO-UHFFFAOYSA-N	441.513	1.598	50	20	IDGD	
CCCS(=O)(=O)N1CCC(NC(=O)NNC(=O)COc2ccc(C)c(C)c2)CC1	916383658	LYMWAFYMYFJIKL-UHFFFAOYSA-N	426.539	1.217	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)NCc2ccc(N3CCO[C@H](C)C3)nc2)cc1OC	916392513	ABAORYVQENCQGK-OAHLLOKOSA-N	443.504	1.858	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(C(=O)N2CCOCC2)cc1)c1ccc2ccccc2c1	917749781	XSNYGRHOLOVGBV-UHFFFAOYSA-N	439.493	1.936	50	20	IDGD	
COc1ccc(C(=O)NCCNC(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)cc1	918222541	XGMKQRZBDMAGLL-MRXNPFEDSA-N	428.489	1.840	50	20	IDGD	
O=C(NNc1ccccc1[N+](=O)[O-])c1ccc2c(c1)S(=O)(=O)N(C[C@H]1CCCO1)C2=O	918549195	GRONFXUUEWSMME-CYBMUJFWSA-N	446.441	1.675	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)c2ccc(Cl)c(S(=O)(=O)N(C)C)c2)cc1	920011549	SUXOFLRIKVKBAV-UHFFFAOYSA-N	439.921	1.993	50	20	IDGD	
CCOC(=O)CCc1c(C)c(C=NNC(=O)N[C@H]2CCS(=O)(=O)C2)c2ccccn12	920378728	BCDIYRNUZHJNHD-HNNXBMFYSA-N	434.518	1.564	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)NCc2ccnc(C)n2)cc1	920854908	UMDWTHSMEMVICG-GZTJUZNOSA-N	445.483	1.756	50	20	IDGD	
O=C(NCC1CC1)NNC(=O)c1cccc(S(=O)(=O)NCc2ccc3c(c2)OCO3)c1	920860194	MTDHDHRCCXKEER-UHFFFAOYSA-N	446.485	1.248	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)Nc1cccc(N2C(=O)CNC2=O)c1	920928559	QBDYEZSHWBSNLR-UHFFFAOYSA-N	435.400	1.101	50	20	IDGD	
O=C(CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@@H]12)NNC(=O)c1ccc(Br)s1	921303224	UOAWMUONAKTGFX-MWODSPESSA-N	447.380	1.997	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@H](C)NS(=O)(=O)c2cccc(C(F)(F)F)c2)cc1	1116320885	ULDDGQGRQKJQFT-NSHDSACASA-N	445.419	1.842	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)c2ccc(S(=O)(=O)NC[C@@H](C)O)cc2)c(Cl)c1	1120728651	IZPCRNCDPPMLDG-GFCCVEGCSA-N	440.909	1.774	50	20	IDGD	
COc1cc(CNC(=O)NNC(=O)c2cncn2-c2ccccc2)ccc1OCCO	1317922560	GFXXMQZIRMZFIP-UHFFFAOYSA-N	425.445	1.396	50	20	IDGD	
CC(=O)N(c1nc(C=NNC(=O)[C@H]2CCS(=O)(=O)C2)cs1)c1ccc(F)cc1F	1337047428	VCTSCKINEZNWGN-NSHDSACASA-N	442.469	1.991	50	20	IDGD	
CN(CC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Cl)C1)C(=O)OC(C)(C)C	1778023297	WVVVFGWGXLYAND-FRIZHTMISA-N	435.924	1.902	50	20	IDGD	
Cc1cnc2c(C(=O)N3CC[C@@]4(C3)CN(C(=O)[C@H](C)Br)CCO4)cnn2c1	1778529039	XGEFXUJTOKAKHS-SCLBCKFNSA-N	436.310	1.265	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc4n(n3)CCCO4)C2)C1	1778553331	AKSOWVYJQIUEKK-ACJLOTCBSA-N	441.326	1.140	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(CCN(C(=O)c3cc(-c4ccccn4)[nH]n3)C2)C1	1779628306	QQELCPFHDIXLSR-IBGZPJMESA-N	448.321	1.700	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)C3=Cc4ccccc4NC(=O)C3)C2)C1	1779991516	VIRNJLLUDKGCBT-HTAPYJJXSA-N	447.919	1.496	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)[C@H]3Cc4ccccc4CN3)CCO2)C1	1781229823	MJFFZSARQWGEQY-QMMLZNLJSA-N	440.371	1.767	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(-n4cccn4)cc3)C2)C1	1781719929	WXDKHIXKQJZBIN-RXVVDRJESA-N	432.908	1.570	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cccc(-n4cncn4)c3)C2)C1	1782019400	VBKGREGTCILKKD-AUUYWEPGSA-N	448.321	1.494	50	20	IDGD	
O=C(c1cnn2cccc(F)c12)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1782554247	UMHRNDZBGXCUIO-WMLDXEAASA-N	443.248	1.607	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)C1(C(=O)Nc3ccccc3)CC1)CCO2	1783871945	WZGMJBVLQIFLJF-UWJYYQICSA-N	449.935	1.489	50	20	IDGD	
COC(=O)N[C@@H](C(=O)N1CCO[C@@]2(CCN(C(=O)C(Cl)Cl)C2)C1)c1ccccc1	1783939142	AMHBFYGBJPGQBB-AUUYWEPGSA-N	444.315	1.717	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)Cc3cc(F)ccc3OC)C2)C1	1784087813	QRFPLLJJTJOHET-UZLBHIALSA-N	428.888	1.461	50	20	IDGD	
Cc1cc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)Br)C[C@@H]32)nn1C	1784243200	ZDEXJAFUMPVXLW-SDADXPQNSA-N	427.343	1.034	50	20	IDGD	
Cc1ccc(/C=C/C(=O)N2CC[C@]3(C2)CN(C(=O)CCC(=O)NN(C)C)CCO3)s1	1784432811	VFMCDTWJNHJBCA-PVHVJQTOSA-N	434.562	1.273	50	20	IDGD	
C[C@H](C#N)c1cccc(C(=O)N2CC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c1	1785084759	WXXQRHASLCQOCM-UZUQRXQVSA-N	441.532	1.130	50	20	IDGD	
O=C(COCc1ccccc1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21	1786712016	YNHCXZRORWRVGR-OVWQWFNUSA-N	443.313	1.873	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)Nc1ccc(C2(NC(=O)C(O)O)CCC2)cc1	1786713874	BCTQQESBJZLAIZ-AWEZNQCLSA-N	441.912	1.563	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccnc4c3OCO4)C[C@@H]21	1788763333	KUHRPUWJQXUWFS-BPUTZDHNSA-N	435.553	1.255	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)c1cc(-c2ccccc2)no1	1788916093	LNIFYHNWYDFYFT-BVYOLEPJSA-N	433.892	1.535	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc4cccnn4n3)[C@H]2C1	1789142603	WUOSZGWFJJVJNW-DSPQJCBJSA-N	436.310	1.106	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cn(C)c4ncccc34)C[C@@H]21	1791055671	DCVZUYPBEVJMLP-HPZZRFSDSA-N	449.349	1.950	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3c(OC)cccc3OC)C[C@@H]21	1791254279	RXECGRMGBDTLPT-AFIMGQEJSA-N	440.924	1.551	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(CO)c(F)c3)C[C@@H]21	1791256378	OSJXOIWALQHSNM-CUSZFKRNSA-N	428.888	1.165	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc3ccccc3n1)C2	1792868374	WCEWTSOPEYEZFP-FLTUCWPJSA-N	447.333	1.864	50	20	IDGD	
CCc1ncsc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)CBr	1792872628	SCCHEWPIKCAHTQ-NRWUCQMLSA-N	430.368	1.940	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2)C1CC1	1793064175	SPMDVQFHPNGELI-QZCUMHFISA-N	447.935	1.804	50	20	IDGD	
C[C@@H](Sc1ccccc1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc(B(O)O)c1)C2	1793436466	GHMNWIYNAKCVJT-GEALJGNFSA-N	438.358	1.799	50	20	IDGD	
O=C(CCCOc1ccc(Cl)cc1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2	1793849539	JSLPRKQBDMHLOV-QOIYZWAUSA-N	445.343	1.688	50	20	IDGD	
COc1cncc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@](C)(Cl)CCl)C3)c1	1794055936	RYVQYNHHUUWRSV-ZDUSMZPESA-N	444.359	1.849	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)c1c(F)ccc(Cl)c1F	1796190696	ZNMHSCFABPTBMC-QDMKHBRRSA-N	448.662	1.864	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H]2C[C@H]2C[C@@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Cl	1796370697	KZFMWZDHUWULNS-YOBHKWJMSA-N	445.919	1.508	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1nnsc1C1CC1	1796641689	LMGDWFKNAIOYHA-SYEHKZFSSA-N	443.367	1.650	50	20	IDGD	
O=C(CCN1C(=O)Cc2ccccc2C1=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](F)Cl	1796804266	JGEDPABLCUSQED-NXEZDXNNSA-N	435.883	1.774	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)c1cc2cc[nH]c2cc1Cl	1797067143	PVZBSJDUVYRABW-CZAMWMTLSA-N	426.300	1.624	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2cccn2cn1	1797097488	YORPNIGAPMZZPI-ZJOBFFGXSA-N	435.322	1.569	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccn2ccnc12	1797454272	PTXAMJKDJYMQRC-HGTKMLMNSA-N	435.322	1.569	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2nncn2c1	1797465575	YVHTWVWLDWHJGL-HLPPOEQASA-N	436.310	1.106	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(-c2ccccn2)[nH]n1	1798173214	JNXNEAZOQBQQDK-KOFHJDLBSA-N	448.321	1.458	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3n(n1)CCCO3)C2	1799277135	SCRNEYTYNSBMNN-TYYYEBLRSA-N	431.320	1.105	50	20	IDGD	
N#Cc1ccc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Br)cc1	1799342010	CSGRBNCVHSBDFL-MVJTYMMSSA-N	438.297	1.771	50	20	IDGD	
COc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Br)cc1F	1799343139	OKLQHVGOZCIKGN-JLUCKKNBSA-N	433.249	1.728	50	20	IDGD	
C[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Br)n1cccc1C=O	1799346616	SWXAZAINCNRMPA-GGUBGCTKSA-N	430.274	1.142	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(F)ccc1F	1799527245	AOYIFIQXERGWDT-BTTYYORXSA-N	429.427	1.529	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(F)c(F)cc1F	1800378337	JLAPDCNWCJXVHQ-CLLJXQQHSA-N	426.439	1.729	50	20	IDGD	
C=CC[C@@H](C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1800491034	JUJNBCBKRGIRTG-UHDSXZAQSA-N	443.972	1.920	50	20	IDGD	
CC(C)(C)OC(=O)N1C(=O)CC[C@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2	1801158504	MWWQMDXJMDQSSX-CUZKYEQNSA-N	447.891	1.037	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)n1cc(C)cn1	1801344152	MGBLMPYVOPARDK-RBGFHDKUSA-N	427.343	1.516	50	20	IDGD	
CC(C)c1nc(CC(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@H]2c2cccnc2)no1	1804404631	AJAQOXVBQWVVJE-DAYGRLMNSA-N	435.912	1.436	50	20	IDGD	
NC(=O)NCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](Br)Cc1ccccc1)C2	1804479851	PDKSMGWNFQSHKE-QKPAOTATSA-N	437.338	1.299	50	20	IDGD	
CC(=O)N/C(C)=C/C(=O)N1CC[C@H](CNC(=O)CCBr)[C@@H]1c1cccnc1	1806346517	JXKBAXZVQMIHPC-OLBRDBERSA-N	437.338	1.912	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)CN2CCCC2=O)[C@@H]1c1cccnc1	1806926349	QOJCQXGGOIIWMN-JOQOYGCGSA-N	437.338	1.493	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CCC2CCC2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807359681	KYSZQTYGTLEOAL-NZQKXSOJSA-N	435.333	1.661	50	20	IDGD	
Cc1ccnc(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)c1	1807374206	FGIFOXJHBRHESK-UGKGYDQZSA-N	444.300	1.098	50	20	IDGD	
O=C(Cn1cc(Cl)cn1)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1	1807404123	SBFOVUURIQKHKV-LXZKKBNFSA-N	426.304	1.237	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)NC[C@@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1	1808225369	BILNVEAPSMBVDZ-DZKIICNBSA-N	440.342	1.319	50	20	IDGD	
O=C(/C=C\C(=O)NC1CC1)NC[C@H]1CCN(C(=O)C(Cl)Cl)[C@@H]1c1cccnc1	1810133701	KKAUFWXMLOTXTN-UTUKGBSRSA-N	425.316	1.726	50	20	IDGD	
CC(=O)NC(C)(C)C(=O)N1CC[C@H](CNC(=O)[C@@H](C)Br)[C@@H]1c1cccnc1	1812865855	YLTNTMAKLDAKPO-WQVCFCJDSA-N	439.354	1.786	50	20	IDGD	
Cc1ccn2ncc(C(=O)Nc3nc4c(s3)C[C@@H](NC(=O)[C@@H](O)CCl)CC4)c2c1	1816930608	AYAJNDBMNBKFGW-NHYWBVRUSA-N	433.921	1.925	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)C#Cc2ccccc2)n[nH]1	1816960120	CTRZUJNAGRLJPB-LJQANCHMSA-N	436.516	1.827	50	20	IDGD	
CN[C@H](CC(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](C)CBr)[nH]n1)C(=O)O	1817361370	HBNBJSJRIYBRAQ-RTXFEEFZSA-N	444.330	1.496	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc(CO)on2)[nH]n1)[C@H](F)Br	1820939023	DBYFDMWLRDINIJ-YPMHNXCESA-N	430.234	1.886	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1	1822374331	JGDIKJRUMBAXEV-OCCSQVGLSA-N	428.921	1.029	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)C1CC2(CCC2)C1	1823052981	BBIHGDAKWZJSPF-LJQANCHMSA-N	436.321	1.976	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H]3C[C@@H]3F)sc2C1	1824887386	XTPDNAMCJGTFIE-DYDUWRGWSA-N	432.481	1.547	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)C[C@@H]1CCCCO1)CC2	1826082740	CBRCMVWWQCFEAM-KGLIPLIRSA-N	437.566	1.387	50	20	IDGD	
O=C(CCn1cncn1)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](F)Br)CC2	1826608628	OVGQUPYVYBXUPR-PRHODGIISA-N	431.291	1.427	50	20	IDGD	
Cc1cc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)on1	1827050625	AWJCYDKJEFAUIR-IBGZPJMESA-N	425.294	1.210	50	20	IDGD	
CCOCC(=O)N1CCC([C@@H]2CCCCN2C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)CC1	1827681409	UYXJORGKTVWGQK-JWGRYVKWSA-N	431.537	1.777	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(C4CC4)on3)CCO2)C1	1830193531	SYCSCJQUHUTUGD-HXUWFJFHSA-N	425.913	1.887	50	20	IDGD	
COc1nc(C)ccc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830364267	DRTMETPXMFINTJ-OAQYLSRUSA-N	439.940	1.734	50	20	IDGD	
CN1C(=O)CC[C@H]1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H](F)Br)CC1	1830400546	GJUCKXKQLJKZGX-IJEWVQPXSA-N	432.334	1.917	50	20	IDGD	
CC(C)=NO[C@H](C)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](C)CBr)CCO2)C1	1830543275	OMRPUVYXNKZVPI-IIDMSEBBSA-N	448.358	1.275	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ncc(F)cc3F)C2)C1	1831641014	UMJBXGTYZAMMHL-KUHUBIRLSA-N	431.867	1.837	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cnc(O)nc2O)CC1	1831652720	INPFDQSLTPYYCQ-SMDDNHRTSA-N	441.326	1.905	50	20	IDGD	
CC(=O)C[C@@H](C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1	1831801011	YXUBXQLNACZBMN-QRWLVFNGSA-N	443.548	1.534	50	20	IDGD	
COc1ncccc1C(=O)N1CCC([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1	1831871361	BCUOARHVUAMDBO-LJQANCHMSA-N	445.564	1.697	50	20	IDGD	
COc1ccc(CCC(=O)N2CCO[C@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)cn1	1832585846	OYERLOLBEQOKAK-LJQANCHMSA-N	446.331	1.283	50	20	IDGD	
C[C@@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)[C@H]3C[C@@H](O)C3)CC2)CC1	1833262975	DDSYYWZCJVTREZ-GRDNDAEWSA-N	430.387	1.360	50	20	IDGD	
CCc1noc(C)c1C(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)CCl)CC2)CC1	1833312507	PRACTRCNASKVDW-KRWDZBQOSA-N	426.945	1.330	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](CC)NC(C)=O)CC2)CC1	1833529956	KGOFBSNPJKMPRP-RTBURBONSA-N	429.005	1.880	50	20	IDGD	
Nc1ccccc1/C=C/C(=O)NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1834741929	ZEIJMPFIIGZQPV-XJDXJNMNSA-N	434.968	1.453	50	20	IDGD	
O=C(CCc1ccsc1)N1CCOC[C@]2(C1)CN(C(=O)CCBr)CCO2	1834822282	FEUQHQJQAFRPIG-SFHVURJKSA-N	445.379	1.922	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)[C@H]3[C@H]4SC=C[C@H]43)C2)C1	1834825480	YIMXLIOHNAQMTE-PWXKEOIMSA-N	431.352	1.103	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)COc3ccc(F)cc3)CCO2)C1	1834959850	YAMWTPQYZLSOOI-NRFANRHFSA-N	442.915	1.926	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)c1c[nH]c2cnccc12	1835633538	QRVVVTKDDOBAJI-IBGZPJMESA-N	433.940	1.348	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1)c1cc(CO)on1	1836188914	LZBZOGKRZLBDDD-OAHLLOKOSA-N	447.305	1.043	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)N1CCC(N2CCC(NC(=O)[C@@](C)(Cl)CCl)CC2)CC1	1836398103	FCLOGMGLGPXMSS-VLIAUNLRSA-N	449.423	1.661	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc4n(n3)CCCC4)CCO2)C1	1836974218	QRHOCQOPFSXXTA-UWJYYQICSA-N	438.956	1.697	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)CC3CC3)CC2)CC1	1837760637	DOARKPIFFGJMQJ-UHFFFAOYSA-N	429.521	1.097	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3c(C)nc4ccccn34)C2)C1	1839144446	ACJZHGZMYOPNDC-IIBYNOLFSA-N	434.924	1.730	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)c(C)n1C	1839153431	HXXVGEVEWPZFNT-UXHICEINSA-N	446.375	1.948	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3CC[C@H](O)CC3)C2)C1	1839155303	QIAUABPQNDLKRG-RGCFKVTRSA-N	437.364	1.230	50	20	IDGD	
O=C(c1ccc(F)cc1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839201537	AKDRLSVBBOEAJE-YOEHRIQHSA-N	433.249	1.586	50	20	IDGD	
CCOC(=O)C1(C(=O)N2CCO[C@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)CC1	1839759220	HOIIGIGBAFXSNT-IBGZPJMESA-N	430.929	1.051	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4ccoc4s3)C2)C1	1840151657	JRWZEANBDOUHMV-AUUYWEPGSA-N	442.921	1.818	50	20	IDGD	
CN(C)c1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)nc1	1840186339	JTDKEQJRZDBVNF-GOSISDBHSA-N	431.320	1.021	50	20	IDGD	
CO[C@H](C(=O)N1CCOC[C@@]2(CN(C(=O)C(Cl)Cl)CCO2)C1)c1ccccc1	1840188030	KLUJPAHSUGDJGC-KXBFYZLASA-N	431.316	1.634	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@H](CCO)NC(=O)OC(C)(C)C)C1	1841428943	AONGQVJFJDZUJZ-LSDHHAIUSA-N	431.961	1.873	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)[C@H]2CCc3ccoc3C2)C1	1841450174	NXTFVAWFLYMCDU-STPJHCLOSA-N	437.500	1.722	50	20	IDGD	
O=C([C@@H]1C[C@@H]1c1ccc(F)c(F)c1)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843010437	PVRKOFIAAWCTML-QZTJIDSGSA-N	440.255	1.265	50	20	IDGD	
O=C(c1ccc(OC(F)F)cc1F)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843014486	PLLKFMYQKYCKEB-UHFFFAOYSA-N	448.206	1.238	50	20	IDGD	
C[C@H]1C[C@@]1(C)C(=O)N1CC2(CCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)C1	1845039273	YPOABBIFPKNQDF-HTAPYJJXSA-N	427.549	1.582	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC12CN(C(=O)[C@H]1CCN1C(=O)OC(C)(C)C)C2	1846175825	UTJOMZKZMLVVQY-CHWSQXEVSA-N	430.343	1.983	50	20	IDGD	
Cc1cccc(C)c1SCC(=O)N1CC2(CCCN2C(=O)CCC(=O)NN(C)C)C1	1846385186	AGEVMTBFYVHTSK-UHFFFAOYSA-N	432.590	1.972	50	20	IDGD	
O=C(CCc1nc(-c2ccc(F)cc2)no1)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl	1847556006	BJCVTMSNOIYHFT-HRCADAONSA-N	436.871	1.610	50	20	IDGD	
C=C1c2ccccc2C(=O)N1CC(=O)NNC(=O)c1nn(CCC)c(=O)c2ccccc12	11148104	CTPLAJNWQRUTRJ-UHFFFAOYSA-N	431.452	1.694	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)CNC(=O)c2ccc(OC)c([N+](=O)[O-])c2)cc1OC	15475881	OADFMIPFAHQIET-UHFFFAOYSA-N	446.416	1.202	50	20	IDGD	
Cc1ccc(C)c(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1	16128583	YISSKVGVDGPRFX-UHFFFAOYSA-N	437.543	1.711	50	20	IDGD	
Cc1cc(Cl)ccc1OCCCC(=O)NNC(=O)Cn1nnc2ccccc2c1=O	17396254	UXBYZUDEUOGFQN-UHFFFAOYSA-N	429.864	1.760	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N(C)C(C)C)cc2)cc1OC	26068695	LNUSVJLPCZWEPT-UHFFFAOYSA-N	435.502	1.808	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)[C@@H](C)NC(=O)c2cccs2)c2ccccc2c1=O	105452040	IBLYHVHPUPWKIB-GFCCVEGCSA-N	427.486	1.448	50	20	IDGD	
Cc1nn(C)c2nc(C3CC3)cc(C(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)c12	115503765	QPAATUROXPPWAS-UHFFFAOYSA-N	431.456	1.476	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)c2ccc(S(N)(=O)=O)c(Cl)c2)cc1	725907373	IWVUSTDQFJLNGT-LLVKDONJSA-N	441.893	1.615	50	20	IDGD	
Cc1csc([C@](O)(CC(=O)OCC(=O)NNC(=O)c2cccs2)C(F)(F)F)n1	725929458	JHPZRLPJGFMIJU-CQSZACIVSA-N	437.421	1.657	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)NCc2cccc(S(=O)(=O)N3CCCCC3)c2)cc1	726271969	ASPMAPRDBBCNCX-UHFFFAOYSA-N	441.513	1.877	50	20	IDGD	
C[C@@H](NC(=O)NN[C@@]1(C)CCS(=O)(=O)C1)c1cc(F)ccc1N1CCN(C)CC1	726280899	ZETXOSSJALRBMM-KUHUBIRLSA-N	427.546	1.020	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C[C@@H]2c3ccccc3CCN2C(C)=O)c2ccccc2c1=O	728000440	PJLAOUMDXWCEGQ-HXUWFJFHSA-N	447.495	1.713	50	20	IDGD	
CS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cccc(OC(F)F)c2)cc1[N+](=O)[O-]	728488633	NXXRGTAPCDVBLU-UHFFFAOYSA-N	429.357	1.675	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2nc(N3CCCC3)ncc2Cl)n1	728729526	QJHHABAAUXLHDR-UHFFFAOYSA-N	438.897	1.042	50	20	IDGD	
O=C(NNC(=O)N1CCO[C@H](c2ccc(F)c(F)c2)C1)C1CCN(c2ncccn2)CC1	728961951	SJLWQFAKZRIOKO-SFHVURJKSA-N	446.458	1.786	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)N[C@H](C)[C@@H](C)N2CCOCC2)c1	729624750	ZALBMBKIMZCKGU-VXGBXAGGSA-N	429.315	1.511	50	20	IDGD	
CN(C)c1ccc(NC(=S)NNC(=O)CN2C(=O)N[C@@](C)(c3ccccc3)C2=O)cc1	729688954	KWPCMMPRYZNHKN-NRFANRHFSA-N	440.529	1.537	50	20	IDGD	
Cc1cccc(N2CCN(CCCNC(=O)NNC(=O)COc3ccccc3O)CC2)c1	730823276	ROTLKIDYLMTOGK-UHFFFAOYSA-N	441.532	1.622	50	20	IDGD	
COC(=O)c1ccc(OCCNC(=O)NNC(=O)Cc2nc3ccccc3n2C)cc1	731283819	LHVPYLYQFCGEBC-UHFFFAOYSA-N	425.445	1.312	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)CCCc2nc(-c3ccc(F)cc3)no2)C[C@H](C)O1	732259930	LIXOYRQXQOWTFJ-GJZGRUSLSA-N	433.484	1.845	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2ccc(CNC(=O)C3CCCC3)cc2)C[C@@H](C)O1	732263035	YYRPQCADMIFJHV-CALCHBBNSA-N	430.549	1.753	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)NCCN1CCN(C(=O)C2CCCCC2)CC1	733351166	SBEKSKBCVCGKPP-UHFFFAOYSA-N	445.564	1.293	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)c1cccc(NC(=O)c2cccnc2)c1	734239499	PZXYVBBAOCXVDF-UHFFFAOYSA-N	442.476	1.803	50	20	IDGD	
CC[C@H](C)[C@H](NC(=O)N1CCCC1)C(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	736834795	ZPMXQYGMSWPQJE-GUYCJALGSA-N	449.464	1.119	50	20	IDGD	
O=C(CCNS(=O)(=O)c1cccc([N+](=O)[O-])c1)NNC(=O)c1cccc2ccccc12	741696229	QQEUAWZYWADTDS-UHFFFAOYSA-N	442.453	1.878	50	20	IDGD	
O=C(NNC(=O)[C@H](c1cccc(F)c1)N1CCOCC1)C1CCN(c2ncccn2)CC1	741923200	NTIKJEHTEKHSPV-IBGZPJMESA-N	442.495	1.053	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)C[C@H](C)/N=C2/NS(=O)(=O)c3ccccc32)cc1	743293546	BKEMGNPOVWGMBL-AWEZNQCLSA-N	429.502	1.072	50	20	IDGD	
COc1ccccc1-c1noc([C@H](C)NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)n1	743510055	PBHVGFWNANRCGZ-LBPRGKRZSA-N	449.431	1.426	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)NCCCN2CCN(c3ncccn3)CC2)c(Cl)c1	743524256	XGTKEYLZSQEIMD-UHFFFAOYSA-N	446.943	1.986	50	20	IDGD	
O=C(NCC(F)(F)F)NNC(=O)[C@@H]1CCCN(C(=O)N2CCc3sccc3C2)C1	743822295	BNEGTZXSOPHEME-GFCCVEGCSA-N	433.456	1.831	50	20	IDGD	
CC/C=C(/C)C(=O)N1CSC[C@H]1C(=O)OCC(=O)NNC(=O)c1cccc(C#N)c1	744973904	QIVUADPVPUFOAJ-VGEAAAHDSA-N	430.486	1.120	50	20	IDGD	
Cc1ccc([C@@H](CN2CCOCC2)NC(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)cc1	745359161	XJLBJLDSRMBQNA-GOSISDBHSA-N	443.460	1.626	50	20	IDGD	
Cc1ccc2c(CCC(=O)OCC(=O)NNC(=O)[C@@H]3COc4ccccc4O3)c[nH]c2c1	745761301	SCQBIMCZSVDVDA-FQEVSTJZSA-N	437.452	1.940	50	20	IDGD	
CC(C)(C)OC(=O)N(CCCNC(=O)NNC(=O)Cc1cn2ccccc2n1)C1CC1	746750688	ACMCKOAQYAANDB-UHFFFAOYSA-N	430.509	1.997	50	20	IDGD	
CCOc1ccc(C(=O)NNS(=O)(=O)c2cc(C(=O)OC)ccc2OC)cc1OC	747597482	YNTLMIQQPZOQLW-UHFFFAOYSA-N	438.458	1.512	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCCc2cc(F)cc(F)c2)cc1	749020182	LMIYFUIELWVINP-UHFFFAOYSA-N	440.472	1.467	50	20	IDGD	
COc1cc(S(=O)(=O)NNC(=O)c2ccc3c(c2)OCO3)c(Cl)cc1C(=O)O	749141420	JMYKQZMAHWKEGS-UHFFFAOYSA-N	428.806	1.399	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)c1ccc(CNC(=O)c2cccs2)cc1	751206123	DBXBKADSDWKZLE-UHFFFAOYSA-N	442.522	1.931	50	20	IDGD	
C[C@@H]1CCCN(S(=O)(=O)c2cc(C(=O)NNC(=S)N[C@H](C)C3CC3)n(C)c2)C1	751617810	LEQXYMAMQQYNTQ-CHWSQXEVSA-N	427.596	1.353	50	20	IDGD	
CSCC[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)NNC(=S)N[C@H](C)C1CC1	751618660	IUXFBKNLRZDEOE-IAQYHMDHSA-N	439.563	1.740	50	20	IDGD	
CN1C(=O)N[C@@]2(CCC[C@@H]2CNC(=O)NNC(=O)CCSc2ccc(F)cc2)C1=O	753023723	OIMGQIYCSKGDKX-CWTRNNRKSA-N	437.497	1.359	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)NCCn2c(O)nc3ccccc32)c2ccccc2c1=O	753036816	DVZYXNIZSNAVGU-UHFFFAOYSA-N	449.471	1.677	50	20	IDGD	
Cc1cc(Br)cn2cc(CCNC(=O)NNC(=O)Cc3ccncc3)nc12	754268868	FBTJNZNEFFSMDV-UHFFFAOYSA-N	431.294	1.916	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)Nc3cnn(C)c3)c2)cc1	755492573	GLMRAELCEQBHFS-UHFFFAOYSA-N	444.473	1.696	50	20	IDGD	
CS(=O)(=O)CCOc1cccc(NC(=O)NNC(=O)c2cc(Cl)ccc2O)c1	756297579	MCHXUPJTBYQDRQ-UHFFFAOYSA-N	427.866	1.936	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2cc(Cl)ccc2O)cc1	756783223	FTOOEAHBQXHMFM-UHFFFAOYSA-N	442.881	1.437	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)Nc1ccc(C[C@H]2CC(=O)NC2=O)cc1	756813526	BIQCQVWBKLTWBW-AWEZNQCLSA-N	447.492	1.349	50	20	IDGD	
Cc1nc(-c2cccc(C(F)(F)F)c2)[nH]c1C(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1	756870579	LSSNUDADXPELMG-NSHDSACASA-N	430.408	1.600	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)N[C@@H]2CCN(c3ccccc3OC)C2=O)cc1	757288395	YWXMNPZLFTXXGX-QGZVFWFLSA-N	426.473	1.772	50	20	IDGD	
CNC(=O)Cn1nc(NC(=O)NNC(=O)c2ccc(OCCC(C)C)c(OC)c2)cc1C	757824347	YUWJFEUSGJKTAM-UHFFFAOYSA-N	446.508	1.838	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cccnc2Br)c1	758152662	ZVNTXPOIHARION-UHFFFAOYSA-N	427.280	1.169	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)c1nccs1	758724954	RUXCZRSJKGNXME-ZDUSSCGKSA-N	437.547	1.675	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCCN1C(=O)OCc1ccccc1)C(=O)Nc1ccccn1	758818878	BGVLSGSNJKKQFF-MRXNPFEDSA-N	425.445	1.359	50	20	IDGD	
CCNS(=O)(=O)c1ccc(CC(=O)NNC(=O)c2ccc(OC(C)C)c(OC)c2)cc1	759355722	AHPMLMBGFGBUMI-UHFFFAOYSA-N	449.529	1.784	50	20	IDGD	
Cc1cc(C)nc(-n2nccc2NC(=O)C(=O)NNC(=O)c2ccc3ccccc3c2)n1	760277758	QMKFOVRBCWNKNF-UHFFFAOYSA-N	429.440	1.832	50	20	IDGD	
Cc1ccc(O)c(C(=O)Nc2nc(CC(=O)NNC(=O)Cc3ccncc3)cs2)c1	760909165	ZFGNOEGCJARQRK-UHFFFAOYSA-N	425.470	1.737	50	20	IDGD	
C[C@@]1(NNC(=O)NCc2ccc(C(=O)Nc3ccc(F)cc3)cc2)CCS(=O)(=O)C1	761780589	TWOCWAXYRNCWBJ-HXUWFJFHSA-N	434.493	1.959	50	20	IDGD	
O=C(NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)N[C@@H]1CCC[C@@H]2OCC[C@@H]21	761795568	WIBKRWDAOCHIQD-KURKYZTESA-N	436.534	1.373	50	20	IDGD	
COc1cc2ccccc2cc1C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	762373061	GFMKZMOSHAARAV-HXUWFJFHSA-N	436.420	1.993	50	20	IDGD	
CCCCS(=O)(=O)N1CCC[C@@H]1C(=O)NNC(=O)CSc1ccccc1OC	762408274	KIWGHHAAGOONIA-CQSZACIVSA-N	429.564	1.529	50	20	IDGD	
CCOc1cc(C(=O)N2CCN(S(=O)(=O)CBr)CC2)cc(Cl)c1O	762631688	FNOTUSOCPXUMPD-UHFFFAOYSA-N	441.731	1.884	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)CNC(=O)OCC(F)(F)F)n[nH]2)cc1OC	763149287	PNKFTYIIXDBCQA-UHFFFAOYSA-N	445.354	1.143	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)[C@@H]2CSCN2C(=O)C(C)(C)C)n[nH]1	763152614	HUUJMLKINIJSRY-HNNXBMFYSA-N	431.518	1.794	50	20	IDGD	
CNC(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3n2)c1	763454936	KKBQTZGUKSMZIN-UHFFFAOYSA-N	425.832	1.648	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cccnc2)n([C@H]2CCN(Cc3ccccc3)C2)n1	763491516	LNKBAVWFLFBUHX-IBGZPJMESA-N	447.499	1.433	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(C)nc2O)cc(OCC)c1OCC	763541719	ARVJLBROICOCOE-UHFFFAOYSA-N	446.460	1.691	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)Nc1cccc(CCN2CCCC2)c1	763579063	TWTNIWFRBFMGPW-FQEVSTJZSA-N	438.484	1.251	50	20	IDGD	
COC(=O)c1cc(Cl)cc(NC(=O)C(=O)NNC(=O)COc2cc(C)ccc2C)c1	763665652	MBUCLAZGSBPDHJ-UHFFFAOYSA-N	433.848	1.908	50	20	IDGD	
CCC(C)(C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2F)cc1	763679563	NUCLOPXGHQQPTG-UHFFFAOYSA-N	444.463	1.909	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccnn1Cc1ccccc1F	763710741	CAMZRMPDABOSGV-UHFFFAOYSA-N	439.447	1.798	50	20	IDGD	
O=C(CN1CCCc2ccccc21)NNC(=O)C(=O)Nc1cnc(-c2ccccc2)nc1	763735698	QLHMZKFWERBVNY-UHFFFAOYSA-N	430.468	1.682	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)cc1OCC(F)F	763812034	BKSQNPMEHGALRB-UHFFFAOYSA-N	432.383	1.676	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccnc(Oc2ccccc2)c1	763814345	SFVGSRYUNDZKDL-UHFFFAOYSA-N	431.408	1.910	50	20	IDGD	
COC(=O)c1cc(F)ccc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1cccc(C)c1C	763850060	NWWWODKHZRQBAF-CYBMUJFWSA-N	431.420	1.783	50	20	IDGD	
O=C(CCSc1ccc(F)cc1)NNC(=O)C(=O)Nc1cccnc1-n1cccn1	763903333	QVYJIORRNBAQCL-UHFFFAOYSA-N	428.449	1.675	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cccc([S@](C)=O)c2)ccc1OC(C)C	763916618	PUBMRCMTPLNZQR-PMERELPUSA-N	433.486	1.620	50	20	IDGD	
Cc1nc(-c2cccc(NC(=O)C(=O)NNC(=O)c3cc(Br)c[nH]3)c2)n[nH]1	763995413	HWAAKJYNRYPNJQ-UHFFFAOYSA-N	432.238	1.270	50	20	IDGD	
O=C(NNC(=O)c1cnccn1)C(=O)Nc1cnccc1-c1ccc(C(F)(F)F)cc1	764023711	DORLLHHKBZKTBG-UHFFFAOYSA-N	430.346	1.957	50	20	IDGD	
CCC(C)(C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)cc1	764152100	PJUXATVNADRUES-GOSISDBHSA-N	438.484	1.695	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)NCC(F)(F)F)cc2)cc1	764182493	NKNGPWPWIWGAQL-UHFFFAOYSA-N	433.346	1.250	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)C(=O)Nc1ccc2c(c1)OC(F)(F)O2	764203008	HIULXYFNTNKCKV-UHFFFAOYSA-N	444.391	1.399	50	20	IDGD	
Cc1cc(C)n(-c2ccc(C(F)(F)F)cc2NC(=O)C(=O)NNC(=O)CN(C)C)n1	764212888	RCRDNSWYCKNUCH-UHFFFAOYSA-N	426.399	1.155	50	20	IDGD	
CN1CCN(c2ccccc2NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)CC1	764242343	DYBXRELTRKZGFL-UHFFFAOYSA-N	434.500	1.179	50	20	IDGD	
C[C@H]1CN(Cc2cccc(NC(=O)C(=O)NNC(=O)Cc3ccccc3F)c2)C[C@H](C)O1	764319410	QPUPFRLPODWUDT-HOTGVXAUSA-N	442.491	1.764	50	20	IDGD	
CCS(=O)(=O)N1CCC[C@H](C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)C1	764328703	IBQJKBHKVJMCMA-NSHDSACASA-N	430.477	1.362	50	20	IDGD	
COc1ccccc1NC(=S)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	764519877	ZXFWSRXJWIKWHL-UHFFFAOYSA-N	427.530	1.471	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)[C@@H](C)NS(=O)(=O)c2ccc(C#N)cc2)c1C	764553991	UOMFJCAXJGRQOU-CVEARBPZSA-N	444.513	1.457	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=O)CSc2ccccc2O)c1	765248963	MQYNNOICDQJWEY-UHFFFAOYSA-N	443.934	1.849	50	20	IDGD	
COc1ccc(CN2C[C@H](C(=O)NNC(=O)c3cc(-c4cccs4)[nH]n3)CC2=O)cc1	765570226	WZJALDBPPMSPLE-CQSZACIVSA-N	439.497	1.957	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)c3cc(C)cc(C)c3)CC2)cc1	765727790	IMNNEFSGQPHTGH-UHFFFAOYSA-N	444.557	1.379	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1ccc(Cl)cc1I	766263877	BYMZCQQWEAANLW-UHFFFAOYSA-N	447.620	1.825	50	20	IDGD	
COc1cc(CN2CCN(CC(=O)NNC(=O)Cc3ccccc3C)CC2)cc(OC)c1	766907787	LTVBEPSYZKTPTM-UHFFFAOYSA-N	440.544	1.520	50	20	IDGD	
Cc1cc(F)ccc1-n1cc(C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)nn1	767821947	ZGHODAZRPYFMBU-UHFFFAOYSA-N	442.363	1.241	50	20	IDGD	
O=C(NNC(=O)c1cccc(OC(F)F)c1)NC1CCN([C@@H]2CCCC[C@H]2O)CC1	767943477	NXSQVFQSAQNUGO-IAGOWNOFSA-N	426.464	2.000	50	20	IDGD	
CCOCC(=O)NNC(=O)N[C@@H]1CCCN(c2ccc(Br)c(C)c2)C1=O	768432149	YMQATAURPDYKHL-CQSZACIVSA-N	427.299	1.620	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)CN2CCC(NC(=O)OC(C)(C)C)CC2)c1	769042511	VPVRIFOOQYPSKP-UHFFFAOYSA-N	434.537	1.819	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)N[C@H]2CCO[C@]3(CCSC3)C2)nc1	769239752	MOPVXHBZNZVDAB-SUMWQHHRSA-N	429.568	1.449	50	20	IDGD	
Cn1ccnc1[C@H](O)[C@H]1CCCN(C(=O)NNC(=O)c2cccc(Br)c2)C1	770017476	ACVRCLDRATZLCE-DZGCQCFKSA-N	436.310	1.983	50	20	IDGD	
CC(C)S(=O)(=O)c1cccc(C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c1	770434726	NHRKYKHQQNHPAU-UHFFFAOYSA-N	449.441	1.395	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)Cc2cccc(OCc3cccnc3)c2)C[C@H](C)O1	771295389	DCBWQODGYXZVPG-ROUUACIJSA-N	426.517	1.850	50	20	IDGD	
O=C(CNC(=O)c1ccc(Br)cc1)NNC(=O)CSc1ccccc1O	771439782	NMQXEPZBTIPIFO-UHFFFAOYSA-N	438.303	1.824	50	20	IDGD	
COC(=O)c1c(OC)ccc(S(=O)(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c1OC	771588506	HADGBHIAWLBOQL-UHFFFAOYSA-N	439.402	1.022	50	20	IDGD	
Cc1ccc(S(C)(=O)=O)cc1S(=O)(=O)NNC(=O)[C@H](C)Oc1cccc(Cl)c1	773268453	ZWOLEZFBHDQCCC-LBPRGKRZSA-N	446.934	1.829	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1-n1cnnn1	773422889	ZMUQNSDBIURPEZ-CQSZACIVSA-N	445.480	1.079	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cn(C)nc2C(F)(F)F)cc1	773527749	MWWBWMGPFXCASL-JTQLQIEISA-N	441.366	1.195	50	20	IDGD	
COC(=O)c1c(F)cccc1NNC(=O)[C@H](Cc1cccc(OC)c1)n1nnnc1C	773641493	OHFHCHIAZRTPBX-KRWDZBQOSA-N	428.424	1.843	50	20	IDGD	
COc1cccc(C(=O)NCC(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)c1	776213612	PQYGWPQYCXKXRF-UHFFFAOYSA-N	449.508	1.061	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)Cc3cncn3C)c2)cc1	776320978	PMNVUBXKDCIFFK-UHFFFAOYSA-N	443.485	1.233	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(C(F)(F)F)cc2O)c1	776446732	IULUTXLFQYVFFC-UHFFFAOYSA-N	431.392	1.736	50	20	IDGD	
O=C(Cc1n[nH]c2c1CCCC2)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	777180144	FPCAYOHGIJIZFP-UHFFFAOYSA-N	445.545	1.467	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)N[C@@H]2CCCOc3cc(F)ccc32)c2ccccc2c1=O	777750056	CTMCLUOZBPHUCW-MRXNPFEDSA-N	425.420	1.931	50	20	IDGD	
CCOC(=O)c1cc(F)cc(S(=O)(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c1	778566558	PUOJXGNAGIPXFJ-UHFFFAOYSA-N	432.433	1.811	50	20	IDGD	
O=C(NNC(=O)[C@@H](O)[C@H](O)c1nc2ccccc2s1)c1cc(-c2cccs2)[nH]n1	779539423	DBNIMIVELRKKFJ-GJZGRUSLSA-N	429.483	1.603	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(Br)c(C(=O)NNc2ccnc(F)c2)c1	781358310	KSENXPRAZNKXJJ-UHFFFAOYSA-N	447.286	1.665	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)CCCCNC(=O)OC(C)(C)C)c2ccccc2c1=O	781662939	LNAJNAWUOPFWPM-UHFFFAOYSA-N	431.493	1.872	50	20	IDGD	
CCS(=O)(=O)c1ccc(Br)c(C(=O)NNC(=S)NCCSC)c1	781715239	HMSPXGHWBFYZSY-UHFFFAOYSA-N	440.410	1.715	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNc2ccc(OC)cn2)c(OCC(F)(F)F)c1	782145010	KDEZLMWWUNBRSO-UHFFFAOYSA-N	442.350	1.900	50	20	IDGD	
COC(=O)c1ccccc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1	783409875	YQUIXMJHASNIQD-UHFFFAOYSA-N	445.375	1.849	50	20	IDGD	
CC(C)(C)OC(=O)N[C@]1(C(=O)NNc2ccc(C(N)=O)nn2)[C@@H]2CCCO[C@H]2C1(C)C	783902265	XNWBJOTZNVJLFO-GIQGCJHYSA-N	434.497	1.117	50	20	IDGD	
Cc1cc(O[C@@H](C)c2ccccc2)ccc1NC(=O)C(=O)NNC(=O)C(=O)N1CCCC1	784000129	WTMIRABVIPRXIA-INIZCTEOSA-N	438.484	1.843	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNc2ccccc2Cl)cc(S(C)(=O)=O)c1	784771214	WWCWZTXWRASJGR-UHFFFAOYSA-N	425.850	1.612	50	20	IDGD	
COc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)C(=O)NNc1ncccc1Cl	784817961	NKPBZCOPRQOWPY-UHFFFAOYSA-N	427.870	1.076	50	20	IDGD	
CS(=O)(=O)NCc1ccc(NC(=O)C(=O)NNc2cccc(C(F)(F)F)n2)cc1	784956972	AXFGAODFVZZXES-UHFFFAOYSA-N	431.396	1.231	50	20	IDGD	
COc1ccc(Cl)cc1N1C[C@@H](C(=O)NNc2ccc(-n3ccnc3)nn2)CC1=O	788177147	BQYAGKCIEQEJPA-LBPRGKRZSA-N	427.852	1.821	50	20	IDGD	
COc1cc(NNC(=O)NCCNS(=O)(=O)c2ccccc2[N+](=O)[O-])ccc1Cl	789028476	RZVXNHDVQXRLTM-UHFFFAOYSA-N	443.869	1.861	50	20	IDGD	
CN(C)[C@@H]1CCOc2c(NC(=O)C(=O)NNC(=O)C(F)(F)Oc3ccccc3)cccc21	789738244	BWCILDPJSRTWSF-MRXNPFEDSA-N	448.426	1.830	50	20	IDGD	
O=C(NN=Cc1c(O)ccc(Cl)c1F)c1cccc(S(=O)(=O)N2CCOCC2)c1	790141523	LNKZHIDSIWHTQC-UHFFFAOYSA-N	441.868	1.970	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)Nc1ccnn1-c1ccc(Br)cn1	790580262	UHIYFLRPSGEEKX-SNVBAGLBSA-N	427.259	1.234	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(/C#N)C(=O)N2CCN(C(=O)C(=O)NC(C)C)CC2)c1C	790903404	CRNJABCGCWWTSN-BRLDDBHUSA-N	443.548	1.415	50	20	IDGD	
COc1cc(C(F)(F)F)ncc1NC(=O)C(=O)NNC(=O)c1cnn(-c2ccccc2)c1	792265808	JKRFOVQRMFDTLS-UHFFFAOYSA-N	448.361	1.694	50	20	IDGD	
C[C@H](CN1CCOCC1)C(=O)NN=C(c1ccc(Cl)c(S(N)(=O)=O)c1)C1CC1	794479714	ZRQCXXDFFNCGMM-GFCCVEGCSA-N	428.942	1.186	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NN=C1CSC[C@@H]1C)N(S(C)(=O)=O)CC2	794881584	LNFCNJNUXYTQOO-BLLLJJGKSA-N	441.575	1.808	50	20	IDGD	
CCc1[nH]nc(C(=O)OCC(=O)NNC(=O)c2cc(Cl)ccc2OC)c1[N+](=O)[O-]	795615353	VWFIGQMAMKUYFD-UHFFFAOYSA-N	425.785	1.160	50	20	IDGD	
CCNC(=O)N(C)c1cccc(NC(=O)C(=O)NNC(=O)c2ccc(OC)c(OC)c2)c1	796991240	BIXGDQXIVNVKBX-UHFFFAOYSA-N	443.460	1.269	50	20	IDGD	
CNC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccc(Cl)cc2)c(C)c1	797000587	TXBAMIUVWPPLSV-UHFFFAOYSA-N	432.864	1.102	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)NCC2(OCCO)CCOCC2)c(C)n1C[C@@H]1CCCO1	800670035	YUDGQCCYJHKXQC-MSTPFNHUSA-N	431.533	1.865	50	20	IDGD	
COc1cc(I)c(C(=O)NNC(=O)N=c2cc[nH]cc2)cc1OC	802033799	OKVRWRXQNQYNQX-UHFFFAOYSA-N	442.213	1.592	50	20	IDGD	
CC(C)[C@H](C(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)N1C[C@H](C)O[C@H](C)C1	802067754	ZFHUGSLQAXCNGU-JKIFEVAISA-N	426.539	1.377	50	20	IDGD	
C#Cc1cc(F)c(NC(=O)C(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)c(F)c1	802565613	BWIUGISFEFZZKE-UHFFFAOYSA-N	433.367	1.372	50	20	IDGD	
CS(=O)(=O)CC[C@H](NC(=O)c1ccc(Cl)cc1)C(=O)NNc1ncccc1F	804211175	HQUKOKCKUPBIAO-AWEZNQCLSA-N	428.873	1.551	50	20	IDGD	
O=C(NNC(=O)C1CCN(CC(F)F)CC1)c1cccc(S(=O)(=O)N2CCCC2)c1	806307043	WVIJJGCQSNLQJU-UHFFFAOYSA-N	444.504	1.209	50	20	IDGD	
O=C1COC[C@@H](C[C@@H]2CN(C(=O)C(=O)NNc3ccc(Cl)c(F)c3)c3ccccc32)N1	807022987	XFQPPFVUXZFPLW-TZMCWYRMSA-N	446.866	1.958	50	20	IDGD	
Cc1c(C(=O)NNC(=O)N2CCN(C)CC2)nnn1Cc1ccc(C(F)(F)F)cc1	807380161	CIVBZMFLWBJTMU-UHFFFAOYSA-N	425.415	1.255	50	20	IDGD	
NS(=O)(=O)c1ccccc1CNC(=O)NNC(=O)c1cccc(Br)c1	807604510	HSWJAFJCUSGBJR-UHFFFAOYSA-N	427.280	1.241	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)C(=O)Nc2ccccc2-n2cnc(C#N)n2)c2ccccc21	810384968	SSFPSBMXTSGOGF-UHFFFAOYSA-N	428.412	1.030	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N1C[C@H](C)S(=O)(=O)[C@H](C)C1	811853255	RRKKYLWNVFTWRH-TUAOUCFPSA-N	448.339	1.465	50	20	IDGD	
CSC1(CNC(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)CCN(C)CC1	812547945	CNKUKXTVWPZIAZ-UHFFFAOYSA-N	446.577	1.749	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)cc1	812729871	WQIPIKCSBIZZSS-UHFFFAOYSA-N	430.446	1.788	50	20	IDGD	
CC(C)(O)CN1CCC(=NNC(=O)CN2c3cccc4cccc(c34)S2(=O)=O)CC1	814216832	ZTKNICDATDEXII-UHFFFAOYSA-N	430.530	1.687	50	20	IDGD	
CC(C)CC(=O)N1CCN(C(=O)CCCCCNC(=O)NNc2ncncc2F)CC1	814294622	OOAPTNZHICOKKW-UHFFFAOYSA-N	437.520	1.519	50	20	IDGD	
Cc1c(C(=O)NNC(=O)COc2ccccc2-c2ccccc2)nnn1-c1ccn(C)n1	814364262	XVVBBPOLHIPUFI-UHFFFAOYSA-N	431.456	1.816	50	20	IDGD	
C[C@@](O)(C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1)c1ccc(Cl)cc1	815498646	KHOCTSSEPQGIOP-UZLBHIALSA-N	434.832	1.078	50	20	IDGD	
CNC(=O)Oc1cccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(C(C)=O)cc2)c1	815566356	RAWNODAFSDXKND-ZDUSSCGKSA-N	442.428	1.161	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc(OC)c1C	815566851	HITDRXXBIIOVHP-UHFFFAOYSA-N	439.428	1.303	50	20	IDGD	
CCOc1ccc(NNC(=O)C(=O)Nc2cccc(S(=O)(=O)N3CCCC3)c2)cc1	815815195	ORJKJIBKXCSHJJ-UHFFFAOYSA-N	432.502	1.952	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3ccc4c(c3)CCCC4=O)cc2)CC1	815854952	XUGHOVXHMPTHSZ-UHFFFAOYSA-N	442.541	1.899	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)N2CCC(n3cnc(C(N)=O)c3N)CC2)c1C	819680890	RWEWQHHSNDQPCJ-BOPFTXTBSA-N	439.520	1.400	50	20	IDGD	
Cc1nn(C)c2nc(-c3cccs3)cc(C(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)c12	841751089	WPZFRZVXVHQBON-LLVKDONJSA-N	433.515	1.201	50	20	IDGD	
O=C(NNC(=O)c1ccc(C(F)(F)F)cn1)c1cccc(S(=O)(=O)N2CCCC2)c1	844254458	XOXRUSLIORJVEL-UHFFFAOYSA-N	442.419	1.960	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)CSCc2cc(=O)n3ccsc3n2)c1	887694998	BHPFRTIYJYIWHV-UHFFFAOYSA-N	432.527	1.832	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)[C@@H]2CS[C@@H](Cc3ccccc3F)C(=O)N2)c1	888346189	BFHTVWMUABJAKU-OALUTQOASA-N	445.516	1.812	50	20	IDGD	
COc1ccc(C(=O)NNC(=S)Nc2cccc(S(=O)(=O)N(C)C)c2)cc1OC	913445731	CSWHUSXITHJQJO-UHFFFAOYSA-N	438.531	1.586	50	20	IDGD	
COc1ccc([C@@H](CNC(=O)NNC(=O)C(=O)NC2CC2)c2c[nH]c3ccccc23)cc1	915890688	CYXSVSNRGWYAKC-GOSISDBHSA-N	435.484	1.917	50	20	IDGD	
Cc1oc(C(=O)NNC(=O)COc2ccc(C#N)cc2)cc1S(=O)(=O)N1CCCC1	916108195	RYFQIVBPWAMKMH-UHFFFAOYSA-N	432.458	1.084	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)NCc1ccc(N2CCCC2=O)cc1	916218705	OPNVYUCFVKODBC-UHFFFAOYSA-N	427.417	1.631	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)NC2CCN(C(=O)c3ccoc3)CC2)cc1C	916261491	IKRQKCPFWNOBMP-UHFFFAOYSA-N	427.461	1.470	50	20	IDGD	
Cc1nn(CCC(=O)NNC(=O)C(C)(C)C)c(C)c1CCC(=O)NNC(=O)C(C)(C)C	917182711	XAUODGSAMORSKH-UHFFFAOYSA-N	436.557	1.210	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCCN1S(=O)(=O)c1cccs1)c1ccc(Cl)nc1	917253583	BPVKTBDPNGEUEV-LBPRGKRZSA-N	428.923	1.801	50	20	IDGD	
COC1(C(=O)NNC(=O)c2cc(Br)c[nH]2)CCN(C(=O)OC(C)(C)C)CC1	917938847	QPHCBKWMUMGOTC-UHFFFAOYSA-N	445.314	1.954	50	20	IDGD	
O=C(NNC(=O)c1ccc(Br)s1)NNC(=O)[C@@H]1COc2ccccc2O1	918778450	FTPYSCVRTHYFMS-JTQLQIEISA-N	441.263	1.326	50	20	IDGD	
COc1ccc(Br)c2[nH]c(C(=O)NNC(=O)N[C@H]3CCS(=O)(=O)C3)cc12	919888462	DELNRGJKSOURQV-QMMMGPOBSA-N	445.295	1.070	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)c1NC(=O)c1ccccc1F	920432806	DTAMCJQCEFIXHO-CYBMUJFWSA-N	433.461	1.582	50	20	IDGD	
O=C(CN1CCN(C(=O)Cc2ccccc2F)CC1)NNC(=O)c1cccc(Cl)c1	921191669	KKIKHOFRMRPJMW-UHFFFAOYSA-N	432.883	1.627	50	20	IDGD	
COc1cc(C#N)ccc1S(=O)(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1	1323987775	AZUNGYFTIGKFQY-UHFFFAOYSA-N	438.506	1.523	50	20	IDGD	
O=C(NNC(=O)c1cnc(C2CC2)[nH]1)c1cccc(S(=O)(=O)NCc2ccccc2)c1	1332399293	IFNTZIZBDHSXGA-UHFFFAOYSA-N	439.497	1.840	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc4cn[nH]c4cn3)C2)C1	1778770597	ZALDYIIGWVOYRX-SGTLLEGYSA-N	436.310	1.432	50	20	IDGD	
Cc1nc(CC(=O)N2CCO[C@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)c(C)s1	1779296442	QQOSZGIJAVTULX-IBGZPJMESA-N	425.627	1.984	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cccc(-c4cnccn4)c3)C2)C1	1780186282	HVJMNLWDNYPJAY-GCJKJVERSA-N	444.919	1.841	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc4nn[nH]c4c3)CCO2)C1	1781233217	RKJDRKWSJWGKOG-QZTJIDSGSA-N	426.304	1.638	50	20	IDGD	
COc1ccc(CCC(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)cn1	1781325336	BPMICCWYRZLEFL-SJLPKXTDSA-N	444.301	1.543	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3c(O)cc(O)cc3O)C2)C1	1781818988	SKYLVVBECHJYDP-DYZYQPBXSA-N	429.267	1.030	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1n[nH]c(C3CC3)c1F)C2	1782170911	FSJUZVNDMWSSTA-ARGWCVDVSA-N	442.919	1.808	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H]1CCC(F)(F)C1)C2	1782210305	NZYLZTMKHNVOQC-JXXFODFXSA-N	444.523	1.309	50	20	IDGD	
CCC[C@@H](NC(C)=O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](Cl)COC)C2	1783191010	PPEFVPQKKHAPDT-TVKQPGBESA-N	431.961	1.059	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)/C=C3\C(=O)Nc4ccccc43)CCO2)C1	1783534518	VNZJDAKVSANQQR-UPJOISEZSA-N	448.317	1.635	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](C)Br)C3)C2)n(C(F)F)n1	1783535582	ALTIZIMXECJCLB-BDJLRTHQSA-N	435.269	1.814	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)CCc3cnc4[nH]ccc4c3)CCO2)C1	1783879182	PHOQGYRLIAYTRF-UTKZUKDTSA-N	434.924	1.579	50	20	IDGD	
CCCNC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]2C1	1783963810	AAMQFJXRSBXTSO-UGUYLWEFSA-N	446.386	1.304	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(F)(F)C(F)F)C[C@@H]21	1783970365	YABIDSFZQMGNEE-NAKRPEOUSA-N	433.240	1.898	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccncc3C(F)(F)F)C[C@@H]21)[C@H](O)CCl	1784091207	XGGKQESUKNICQS-FATJJJSSSA-N	435.830	1.293	50	20	IDGD	
CCOCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C[C@@H]21	1786502311	MEHHOLIUCNOVKT-FNHZYXHNSA-N	449.460	1.150	50	20	IDGD	
C[C@H](Cn1cccn1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]2C1	1789869084	XDMOSNSHQFVMLD-XZLOLGPPSA-N	431.364	1.735	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3c(C)n[nH]c3C)[C@H]2C1	1789976595	JSCYWOIWACBBAO-LLLHUVSDSA-N	441.370	1.722	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@H](C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]3C2)C1	1791298533	ZAITYCQAFOHJFW-AICCOOGYSA-N	435.348	1.749	50	20	IDGD	
C[C@H](CBr)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)COc1ccc(O)nn1)C2	1792990856	OCGFBSHWSQLMGX-FVCCEPFGSA-N	427.299	1.230	50	20	IDGD	
CC[C@H](CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCl)NC(=O)OC(C)(C)C	1793115271	GSJGHTGRPGPBCF-IBEHDNSVSA-N	431.961	1.918	50	20	IDGD	
CC(C)(C)OC(=O)N1CC=C(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)C(Cl)Cl)C3)C1	1793226761	ZWALLIADDZKJBT-BTTYYORXSA-N	448.347	1.557	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc([N+](=O)[O-])o1	1793277701	PULONTNYPHJGCY-SYLDHANKSA-N	433.465	1.212	50	20	IDGD	
COc1ccc([C@@H]2C[C@H]2C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)cc1	1793521735	ZYKICHAMQMWIRD-XLGPZGCCSA-N	448.328	1.431	50	20	IDGD	
O=C(CCc1ccc(F)c(F)c1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1	1796189679	ONHCZWBCKBTGBR-REPLKXPHSA-N	442.271	1.529	50	20	IDGD	
CCn1nc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)c2ccccc21	1796481742	YTESGZRRHDVPLJ-REPLKXPHSA-N	446.316	1.302	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1c(F)cccc1F)C2	1798439926	NVQJWESJKUCGLO-CLLJXQQHSA-N	429.427	1.529	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccc(C(=O)OC)s1	1799047498	KVNUHCFCCDVFSX-DMVWFOPNSA-N	428.938	1.684	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc3c(c1)NC(=O)CS3)C2	1799272696	XIDXGHUDYGTGMD-OQMKEHIESA-N	438.937	1.346	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)c1ccc(N2CCCCC2)cc1	1799594120	QAKGNOLUPHYQTM-PIKOESSRSA-N	435.952	1.480	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc2ccoc12	1800055273	PJHYHLCCLYCTTL-CWPLJXCYSA-N	428.489	1.009	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc3c1cnn3C)C2	1800759170	JCRPOORTIKNBQE-KOFHJDLBSA-N	435.322	1.560	50	20	IDGD	
C[C@H](Nc1ccccn1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)Br	1800759570	WKSSXXDTXORYRN-YMSVYLFOSA-N	425.327	1.255	50	20	IDGD	
CC(=O)N(C)CCC(=O)NC[C@H]1CCN(C(=O)CO[Si](C)(C)C)[C@H]1c1cccnc1	1804069733	KVCYKQNDJJSMCY-NQIIRXRSSA-N	434.613	1.807	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H]2CC=CCC2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807363951	DJPRWNIGCOMOBW-VCOUNFBDSA-N	433.317	1.437	50	20	IDGD	
Cc1noc(CC(=O)NC[C@@H]2CCN(C(=O)CCBr)[C@H]2c2cccnc2)n1	1807523140	VNUJPWXYMYQJAA-KSSFIOAISA-N	436.310	1.807	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1CCN(C(=O)C2=NNC(=O)C2)[C@@H]1c1cccnc1	1808305759	AFHAUSWOLFYLPZ-PNPHSEOMSA-N	426.304	1.200	50	20	IDGD	
Cc1ccn(CC(=O)N2CC[C@H](CNC(=O)[C@@H](F)Br)[C@@H]2c2cccnc2)n1	1808650807	FZDNZBYDOSSSSR-HYVNUMGLSA-N	438.301	1.983	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)Cn2cncn2)[C@@H]1c1cccnc1)[C@H](F)Br	1808662162	WYPJOWCHNPOPNQ-CFVMTHIKSA-N	425.262	1.070	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)c3cccc4nccn34)CC2)C1	1809973314	GWAOSFKXYTUWKT-UHFFFAOYSA-N	446.316	1.173	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)NC[C@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1	1810527304	PFMKHPVVZGDVCX-DDUZABMNSA-N	437.338	1.563	50	20	IDGD	
COc1nn(C)cc1C(=O)N1CC[C@@H](CNC(=O)C(Cl)Cl)[C@H]1c1cccnc1	1813077280	IPMSHGDZWPMAMD-GXTWGEPZSA-N	426.304	1.947	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@@H](CNC(=O)CN2C(=O)C=CC2=O)[C@@H]1c1cccnc1	1813175998	NUMYNKVUQURPAA-KXBFYZLASA-N	432.908	1.277	50	20	IDGD	
C[C@H](C(=O)NC[C@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1)n1cncn1	1813400084	KVWBHSRXQXYKQT-FRFSOERESA-N	435.326	1.725	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)[nH]n1)[C@H](F)Cl	1818045617	ZDFNQKMQSIIHTL-RNCFNFMXSA-N	433.918	1.797	50	20	IDGD	
C[C@@H]1CCC[C@H]1C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1	1819796978	KMIJOTFQFLKULC-JHJVBQTASA-N	442.545	1.804	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H]2CCCS2(=O)=O)n[nH]1	1821835703	JUDLVENDQQJUDM-IACUBPJLSA-N	432.930	1.233	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1cc(F)c[nH]1	1822236055	BEWAENKXRQAPCU-KRWDZBQOSA-N	425.229	1.176	50	20	IDGD	
CCCC(=O)N[C@H](C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1	1822414912	NUIBSDHCELQKPJ-ZBFHGGJFSA-N	449.556	1.080	50	20	IDGD	
C[C@]1(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)[nH]n2)CC1(F)F	1823397588	DCJXCAVOVYPWHX-AUUYWEPGSA-N	447.446	1.759	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@]2(C)CC2(F)F)n[nH]1	1823399491	SBZORCPWVWBPLD-UGSOOPFHSA-N	426.468	1.820	50	20	IDGD	
C=CCSCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1	1824957590	MGJWBPNGGNMICZ-HXUWFJFHSA-N	430.379	1.519	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1c(O)cc(O)cc1O)CC2	1826007152	RZTJULLFMYKSAP-WCBMZHEXSA-N	441.893	1.740	50	20	IDGD	
Cc1ncoc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1	1826064163	YSVHBNSVJSLREN-IBGZPJMESA-N	425.294	1.210	50	20	IDGD	
Cc1ccc(CC(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)o1	1827054954	NFUVOUGOZLJMEX-JOCHJYFZSA-N	438.333	1.744	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827055945	PEZDDEYVEBERBK-IBGZPJMESA-N	434.773	1.865	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)c2ccc(F)nc2)CC1	1829191530	FTBRPNDXTYJDRB-HXUWFJFHSA-N	439.296	1.448	50	20	IDGD	
Cc1nccn1[C@H](C)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830370225	MUTIRDJKGJZVRI-FOIQADDNSA-N	426.945	1.474	50	20	IDGD	
C=CCC(CC=C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1830642377	AGCCUJFARHNTBW-CRAIPNDOSA-N	433.318	1.902	50	20	IDGD	
CCC[C@H]1CC[C@H](C(=O)N2CCOC[C@@]3(CN(C(=O)[C@@H](O)CCl)CCO3)C2)CC1	1830736002	OWVTUATUHLVOTC-NTLWEQJWSA-N	430.973	1.649	50	20	IDGD	
C[C@@]1(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1(F)F	1832802023	MHGRUPFPMVGMKD-NQIIRXRSSA-N	434.292	1.645	50	20	IDGD	
COc1cccc(CCC(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)n1	1832821010	LTGYOKNJYSNBNE-IEBWSBKVSA-N	429.876	1.014	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)C3(C)COC3)CC2)CC1	1833138125	GCKUZYNHALWLJN-CQSZACIVSA-N	430.387	1.626	50	20	IDGD	
C[C@H](Cn1cccn1)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1	1833200514	BWYHYIRKDVFMES-LZQZEXGQSA-N	447.363	1.212	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cc(O)ccc3F)CC2)CC1)[C@H](O)CCl	1833313545	LGLUOGZHYULNTO-GOSISDBHSA-N	427.904	1.316	50	20	IDGD	
Cn1nccc1C(=O)NC1CCN(C2CCN(C(=O)[C@](C)(Cl)CCl)CC2)CC1	1834212755	JXCHKEZMYBPJRH-LJQANCHMSA-N	430.380	1.842	50	20	IDGD	
C[C@@H](C(=O)NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)n1cccc1C=O	1834805610	QIPXUXNEYWJBMV-KXBFYZLASA-N	438.956	1.033	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)C(Cl)Cl)CC2)CC1)c1[nH]nc2ncccc12	1835022611	UJUSRSIUVPXZDC-UHFFFAOYSA-N	439.347	1.947	50	20	IDGD	
O=C(NCC(=O)N1CCC(N2CCC(NC(=O)[C@H](F)Cl)CC2)CC1)c1cccs1	1835078500	JOOZDWNRUHFXFX-KRWDZBQOSA-N	444.960	1.584	50	20	IDGD	
Cc1n[nH]cc1C(=O)NC1CCN(C2CCN(C(=O)[C@H](C)Br)CC2)CC1	1836154933	YQZALVAALRZBCW-LBPRGKRZSA-N	426.359	1.687	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccnc(OC)c3F)CCO2)C1	1836233946	GUXVPYBPNHTACT-MGPUTAFESA-N	443.903	1.707	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)COc3ccc(O)nn3)CC2)CC1	1836397271	BUTHYKHHOGUNBL-MRXNPFEDSA-N	439.944	1.150	50	20	IDGD	
CCCC(=O)N[C@H](C)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](Cl)COC)CC2)CC1	1838425947	JWVQKKLRNXGWCZ-QAPCUYQASA-N	445.988	1.544	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC(OC2CCN(C(=O)CSCC(=O)O)CC2)CC1	1838431935	DSXOHKSEPSHZPD-UHFFFAOYSA-N	446.642	1.654	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(COCCN(C(=O)C3CC3)C2)C1	1838528352	SIMYCJIWTFTUKN-NRFANRHFSA-N	447.444	1.000	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(OC)cc3O)CCO2)C1	1838887699	RBXJTIOGKZCXNL-DYESRHJHSA-N	440.924	1.878	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnn4cccc(F)c34)C2)C1	1839148077	LOYVMMSOBRVYPK-MGPUTAFESA-N	438.887	1.561	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)c(F)c1	1839260811	HJXHVJSRUOJWGX-AUUYWEPGSA-N	443.313	1.988	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(F)ccc3F)C2)C1	1840154359	VEANBQRPOATYEY-HNAYVOBHSA-N	432.851	1.289	50	20	IDGD	
Cn1ccc(CC(=O)N2CC3(CCCN3C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)n1	1841924553	YZAVQJLWXPNFQC-HNNXBMFYSA-N	439.944	1.298	50	20	IDGD	
Cc1ccc2[nH]cc(CC(=O)N3CCCC34CN(C(=O)CCC(=O)NN(C)C)C4)c2c1	1841975794	MJHFSCYXORGONA-UHFFFAOYSA-N	425.533	1.595	50	20	IDGD	
O=C([C@H](O)CCl)N1CC2(CCCN2C(=O)c2nc3ccc(C(F)(F)F)cn3n2)C1	1843154664	RFXZHHWCXKNYPK-LLVKDONJSA-N	431.802	1.165	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC2(CCCN2C(=O)c2nc(O)n3c2CCCC3)C1	1844397861	SHLZUZWYXBVCAG-GFCCVEGCSA-N	425.327	1.916	50	20	IDGD	
Cc1ncoc1C(=O)N1CC2(CCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)C1	1845038515	MIKDBORNAXEODA-UHFFFAOYSA-N	440.504	1.146	50	20	IDGD	
O=C1CSc2ncc(C(=O)N3CC4(CCCN4C(=O)[C@@H](F)Br)C3)cc2N1	1845219217	BEFPGSXBMTZUPR-GFCCVEGCSA-N	443.298	1.633	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC2(CCCN2C(=O)c2cnc3c(c2)NC(=O)CS3)C1	1845669648	ARKAQQFXZXORII-UHFFFAOYSA-N	434.594	1.794	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCCC12CN(C(=O)[C@@H](O)NC(=O)OC(C)(C)C)C2	1846071935	WCQXJODHEDBIQA-VXGBXAGGSA-N	434.331	1.206	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)CN2CCN(C(=O)OC(C)(C)C)CC2)C1	1846967017	HSSWUZSUZZFUDH-MRXNPFEDSA-N	442.988	1.760	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)Cc1c(F)ccc(F)c1F	1847965667	ACOWJCBHHSQOIZ-IRXDYDNUSA-N	447.417	1.161	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1	16128545	VBFJIIUMPHMHCB-UHFFFAOYSA-N	439.515	1.103	50	20	IDGD	
CCOC(=O)c1c(C)[nH]c(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1C	16593965	IOAXRJWSCUSLNV-UHFFFAOYSA-N	436.490	1.133	50	20	IDGD	
CC[C@H](C)[C@@H](C(=O)OCC(=O)NNC(=O)c1ccccc1)N1C(=O)c2ccccc2C1=O	18362882	MQQUXLPUAWXCHA-LIRRHRJNSA-N	437.452	1.702	50	20	IDGD	
O=C(CCCc1ccccc1)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	46810939	UNDPQBYALSKPTI-UHFFFAOYSA-N	431.514	1.491	50	20	IDGD	
O=C(COC(=O)c1cc(F)c(F)cc1Cl)NNC(=O)[C@@H]1COc2ccccc2O1	104556378	KTIYLAGZZNZYGL-HNNXBMFYSA-N	426.759	1.762	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(n2cc(C(=O)NNC(=O)NCC(F)(F)F)nn2)CC1	725907811	YQRPROOKALTMJC-UHFFFAOYSA-N	435.407	1.356	50	20	IDGD	
CC1CCN(c2ccc(C(=O)NNC(=O)c3csc(N4CCOCC4)n3)cn2)CC1	727099363	SQFFOPAUCVKABI-UHFFFAOYSA-N	430.534	1.686	50	20	IDGD	
CN(C[C@@H]1CCCN(CC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)C1)C(=O)OC(C)(C)C	727135167	SDCWJTDSRARPAL-HNNXBMFYSA-N	449.508	1.935	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)NNC(=O)c2c(Cl)cccc2Cl)ccc1OC	727804569	HADWGZIMHKLIMF-UHFFFAOYSA-N	432.285	1.985	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3ccnc4ccccc34)cc2)CC1	728213073	DLKMZXWDPSUVCJ-UHFFFAOYSA-N	425.514	1.928	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)CSc3ccc(F)cc3)cc2)CC1	728213330	YJUORNLCSARWED-UHFFFAOYSA-N	438.550	1.997	50	20	IDGD	
CCOC(=O)C1=NN(c2ccccc2)[C@H](C(=O)NNC(=O)CNc2cccc(OC)c2)C1	728713544	WDZUNBFQMYFHHO-IBGZPJMESA-N	439.472	1.453	50	20	IDGD	
CC(C)C[C@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	728889352	DSMFRZKQYYFWPE-INIZCTEOSA-N	434.541	1.780	50	20	IDGD	
O=C(Cc1ccc(S(=O)(=O)N2CCCC2)s1)NNC(=O)Cn1ccc2ccccc21	729448328	KRMALYBXVVYFTQ-UHFFFAOYSA-N	446.554	1.877	50	20	IDGD	
COC(=O)Cc1cc(=O)n(-c2ccc(C(=O)NNC(=O)Cn3ccc4ccccc43)cc2)[nH]1	729450823	UXKBBJJITMQJES-UHFFFAOYSA-N	447.451	1.297	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)C[C@H](C)S(=O)(=O)c2ccc(F)cc2)cc1C	729688063	SAISKUPVUFTYSN-AWEZNQCLSA-N	435.477	1.781	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N2CCO[C@@H](C#N)C2)cc1	729979587	LVUFDEMMDWDOEG-LZOLKVDOSA-N	434.456	1.092	50	20	IDGD	
CS(=O)(=O)c1ccc(OCCNC(=O)NNC(=O)c2ccc3ccccc3n2)cc1	730067020	SOOVGCQLVDMMTC-UHFFFAOYSA-N	428.470	1.661	50	20	IDGD	
C[C@@H](CN1CCN(C)CC1)NC(=O)NNC(=O)[C@@H](C)Oc1cccc(Br)c1	730130846	NMWRXLVXTKTPNR-UONOGXRCSA-N	442.358	1.183	50	20	IDGD	
C[C@H]1CCCN(S(=O)(=O)c2cc(C(=O)NNC(=O)c3ccc(C#N)cc3)n(C)c2)C1	730215066	ACHPKAAMRRQZLV-AWEZNQCLSA-N	429.502	1.392	50	20	IDGD	
CC/C=C(/C)C(=O)N1CSC[C@H]1C(=O)OCC(=O)NNC(=O)c1cccc(Cl)c1	730318754	BTJQOVNZFIBZOY-LGVHXXEASA-N	439.921	1.902	50	20	IDGD	
O=C(NNc1nc(-c2ccncc2)no1)[C@@H]1CCCN(S(=O)(=O)Cc2ccccc2)C1	730589983	SFTRDLXHYZGKCV-QGZVFWFLSA-N	442.501	1.817	50	20	IDGD	
CCOCC(=O)NNC(=O)NCc1ccccc1CN1CCN(c2ccccc2)CC1	731281177	XXISRJCWBFXHHY-UHFFFAOYSA-N	425.533	1.876	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)CCCNC(=O)C(C)(C)C)CC1	734822531	ZCMNVGWHIHWWKT-UHFFFAOYSA-N	427.546	1.659	50	20	IDGD	
Cc1ccn2c(=O)c(C(=O)NNC(=O)NC3CCN(C(=O)OC(C)(C)C)CC3)cnc2c1	734826022	TWJYMAMHDJJFGK-UHFFFAOYSA-N	444.492	1.346	50	20	IDGD	
C[C@H]1CN(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)CC[C@@H]1NC(=O)OC(C)(C)C	740903236	LHDNVVZIVCVPLP-BBRMVZONSA-N	444.496	1.252	50	20	IDGD	
CC(C)(C)NC(=O)Nc1ccc(Cl)c(C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)c1	741663119	WUSDZGIMTBZAID-JTQLQIEISA-N	430.914	1.456	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCN(C(=O)OC(C)(C)C)[C@@H](C)C2)cc1OC	741804426	QEUYVSSJMMMCCX-AWEZNQCLSA-N	436.509	1.406	50	20	IDGD	
O=C(CN1C(=O)[C@H]2[C@H](C1=O)[C@H]1CC[C@H]2O1)NNC(=O)c1cc2c(s1)CCCCCC2	742480713	NGTGUITWJBWNCY-XHSVMWQWSA-N	431.514	1.331	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1cccc(Br)c1	743263272	ATHKUBWQAXVTEX-UHFFFAOYSA-N	445.207	1.889	50	20	IDGD	
CCO[C@H](C)c1nc(CN2CCN(CC(=O)NNC(=O)c3cccs3)CC2)cs1	744412317	GGTLBSQAPZSXAY-CQSZACIVSA-N	437.591	1.881	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)CNC(=O)c2cc(-c3ccccc3)on2)c1	744904678	NYODNYGVUGOLMZ-UHFFFAOYSA-N	436.424	1.384	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H]1CCC[C@H]1C(=O)OCC(=O)NNC(=O)c1cccc(C#N)c1	745074873	SOWRPOGIGUZUKM-CVEARBPZSA-N	430.461	1.556	50	20	IDGD	
O=C(NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1)N[C@H]1CCSC1	745899244	JBUZGXALRUOZRE-NSHDSACASA-N	426.545	1.998	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NN=Cc2ccc(OCC(N)=O)cc2)c1	745984074	LPWXIHGZFHONCM-UHFFFAOYSA-N	432.502	1.345	50	20	IDGD	
NC(=O)N[C@H](CC(=O)NNC(=O)N1CCOCC1)c1cccc(Oc2ccccc2)c1	745992445	AHMFLOUULMPCBF-GOSISDBHSA-N	427.461	1.651	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)C1(NC(=O)OC(C)(C)C)Cc2ccccc2C1	746294078	ZOOUEJTXIGASBW-UHFFFAOYSA-N	432.521	1.501	50	20	IDGD	
O=C(CNC(=O)NCc1ccc([N+](=O)[O-])cc1)NNC(=O)Cc1cccc2ccccc12	748213201	XKYGQTLZUWKECZ-UHFFFAOYSA-N	435.440	1.937	50	20	IDGD	
Cc1c(NNC(=O)[C@@H]2CC(=O)N(c3cccc(S(N)(=O)=O)c3)C2)cccc1[N+](=O)[O-]	748683171	RRDCENHQACEJQV-GFCCVEGCSA-N	433.446	1.047	50	20	IDGD	
COc1cc(Br)ccc1C(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	748697705	QGEDADAQWOLXGP-UHFFFAOYSA-N	431.246	1.779	50	20	IDGD	
O=C(CNC(=O)NCc1ccc(F)cc1)NNc1c(F)cc(C(=O)NC2CC2)cc1F	748826709	AUSZPRIDZLUYFO-UHFFFAOYSA-N	435.406	1.939	50	20	IDGD	
Cc1nc(C)c(S(=O)(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)s1	751206904	CTWFODQLYDCLEF-UHFFFAOYSA-N	444.560	1.168	50	20	IDGD	
C[C@@H]1C[C@H](CCNC(=O)NNC(=O)CNC(=O)c2ccco2)CN1Cc1ccccc1	753046568	MAQVVLIGLVOGNO-AEFFLSMTSA-N	427.505	1.641	50	20	IDGD	
N#Cc1ccc(CN2CC[C@H](NC(=O)NNC(=O)Cc3ccc(Cl)cc3)C2=O)cc1	753292966	WBUUQBKLWLVZPD-SFHVURJKSA-N	425.876	1.886	50	20	IDGD	
COCCN1C(=O)c2ccc(C(=O)NNc3ccc(C(F)(F)F)nn3)cc2S1(=O)=O	755183642	RKWPWDAWHHTICJ-UHFFFAOYSA-N	445.379	1.043	50	20	IDGD	
O=C(CN1CCOCC1)Nc1ccc(NC(=O)NNC(=O)c2ccc(Cl)nc2)cc1	755598299	GIDVMFVHOIKLEC-UHFFFAOYSA-N	432.868	1.472	50	20	IDGD	
CCOc1ccc(OCC)c(NC(=S)NNC(=O)c2cc(S(N)(=O)=O)c(C)o2)c1	755653443	KIBKPXSKOAXAIY-UHFFFAOYSA-N	442.519	1.664	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Nc2ccc(CC(=O)N(C)C)cc2)cc(OC)c1OC	755917009	ONCIHPXGLXPDNZ-UHFFFAOYSA-N	430.461	1.810	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)Nc2ccc(C(=O)N3CCOCC3)cc2)cc1	755932536	BCCSAQVRGILBPK-UHFFFAOYSA-N	426.473	1.953	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)Nc1ccc(C[C@@H]2CC(=O)NC2=O)cc1	756813528	BIQCQVWBKLTWBW-CQSZACIVSA-N	447.492	1.349	50	20	IDGD	
C[C@@H]1C[C@@H](C)CC2(C1)NC(=O)N(CC(=O)NNC(=O)[C@@H](C)Oc1ccc(F)cc1)C2=O	756867088	IQUWPPFHCDOYAH-MGPQQGTHSA-N	434.468	1.487	50	20	IDGD	
C[C@H]1CCC[C@@H](C)N1C(=O)COc1ccc(C(=O)NNc2ccc(C(N)=O)nn2)cc1	757402713	OJINZCGPMHIOSD-OKILXGFUSA-N	426.477	1.501	50	20	IDGD	
CN1C(=O)C[C@H](C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)[C@@H]1c1ccc(Cl)c(F)c1	758055876	UCHMMEIPARHPRB-KHDYIWLOSA-N	447.850	1.986	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)Nc2cnn(C3CCN(C(=O)OC(C)(C)C)CC3)c2)cn1	758195279	DLXPQCMKQIQTTD-UHFFFAOYSA-N	432.485	1.655	50	20	IDGD	
O=C(NNC(=O)C(=O)Nc1ccccn1)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1	758815469	QLQUIDMQJMWMQG-CYBMUJFWSA-N	448.430	1.621	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCN(c2ccc(Cl)c(Cl)c2)C1=O)C(=O)Nc1ccccn1	758832813	JHHFUBITSGRYNG-LLVKDONJSA-N	436.255	1.527	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)NC2CCN(c3cccnn3)CC2)cc1	759612188	FYERQMDLCBJZFR-HNNXBMFYSA-N	428.493	1.642	50	20	IDGD	
Cc1cc([N+](=O)[O-])cc(S(=O)(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1F	760361787	ADIOQZNKMQHPQN-UHFFFAOYSA-N	438.441	1.058	50	20	IDGD	
NC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ccccc2Br)ccc1Cl	763482839	LGAKVHZSHKFSQP-UHFFFAOYSA-N	439.653	1.601	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)Nc1cc(Br)ccc1F	763572629	SVZHHSILWVMSEW-CQSZACIVSA-N	438.209	1.514	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(CN3CCOC3=O)cc2)c1	763623139	COVKPUMILMDWEC-UHFFFAOYSA-N	426.429	1.112	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccc(N2CCOC2=O)c1C	763646637	JLNHUCZCVOXILW-UHFFFAOYSA-N	442.428	1.125	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(NC(C)=O)c(Cl)c1	763681829	JPWOHHIGIPUFNG-UHFFFAOYSA-N	448.863	1.862	50	20	IDGD	
O=C(COc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1ccc(-n2cccn2)c(F)c1	763684498	MPOZASZAZFSNOK-UHFFFAOYSA-N	431.811	1.830	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)C(=O)Nc1c(F)cccc1F	763694823	LFKCPELKDJUQOG-UHFFFAOYSA-N	428.189	1.892	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ncn(C3CCCCC3)n2)cc1	763862127	UQNBOISTAPLXGI-AWEZNQCLSA-N	444.492	1.735	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)oc(=O)n3C)cc1OC	763911589	HPKVDVMCWGNDRU-UHFFFAOYSA-N	442.428	1.329	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)N(C)CC3)cc1OC	763911887	PPYXESQIYRFQRL-UHFFFAOYSA-N	426.473	1.876	50	20	IDGD	
CCOC(=O)c1cn(C)nc1NC(=O)C(=O)NNC(=O)c1cc2c(s1)CC[C@@H](C)C2	763938120	AMEDBZCXOXQRQF-SNVBAGLBSA-N	433.490	1.183	50	20	IDGD	
Cc1nc(-c2cccc(NC(=O)C(=O)NNC(=O)c3cc(Br)cn3C)c2)no1	764004593	IOCOGJVJYTXYBL-UHFFFAOYSA-N	447.249	1.546	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1cc2c(cc1F)CCC(=O)N2	764010871	DPXJBPJMGKNYGS-UHFFFAOYSA-N	434.811	1.772	50	20	IDGD	
O=C(Cc1cccc2ccccc12)NNC(=O)C(=O)Nc1ccn(Cc2ccncc2)n1	764036273	MCQKCIHXYLESBC-UHFFFAOYSA-N	428.452	1.808	50	20	IDGD	
CC[C@@H](C)C(=O)NNC(=O)C(=O)Nc1cc(S(=O)(=O)N(CC)CC)cc(C)c1C	764084153	LXTRBSAQRDTBLT-GFCCVEGCSA-N	426.539	1.466	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccnn3-c3ccccc3)n[nH]2)cc1	764109702	AMYHLUVEOFIOGC-UHFFFAOYSA-N	429.440	1.971	50	20	IDGD	
CCN(CC)C(=O)COc1ccc(NC(=O)C(=O)NNC(=O)c2ccoc2)cc1Cl	764160125	OSSNQLILXKBZKB-UHFFFAOYSA-N	436.852	1.580	50	20	IDGD	
Cc1ncsc1C(=O)NNC(=O)C(=O)Nc1ccc(-c2noc(C(F)(F)F)n2)cc1	764247009	TUGHLLDQTBMCCD-UHFFFAOYSA-N	440.363	1.920	50	20	IDGD	
O=C(NNC(=O)c1cccc(OC(F)F)c1)C(=O)Nc1cc(C(F)(F)F)cnc1O	764251708	XOEQQRJRUCIJOA-UHFFFAOYSA-N	434.277	1.807	50	20	IDGD	
C[C@H]1C[C@H](C)CN(C(=O)c2ccccc2NC(=O)C(=O)NNC(=O)Cc2ccccn2)C1	764264794	UNAQHSWENWGOGO-HOTGVXAUSA-N	437.500	1.528	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)C(=O)Nc1cccc(C(=O)Nc2ccc(Cl)cn2)c1	764297379	QBSOOJOQINTUSL-UHFFFAOYSA-N	441.835	1.419	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)c(Cl)c1)C(=O)Nc1ccc(OCC(F)(F)F)nc1	764345660	IEOUHWQIKYWFMM-UHFFFAOYSA-N	432.742	1.781	50	20	IDGD	
COC(=O)c1cc(OC)ccc1NC(=O)C(=O)NNC(=O)c1cnn(-c2ccccc2)c1	764346036	RRMUPCCWBINGNY-UHFFFAOYSA-N	437.412	1.067	50	20	IDGD	
N#Cc1cccc(COc2ccc(NC(=O)C(=O)NNC(=O)Cc3ccncc3)cc2F)c1	764355844	KEEJRJRHPDOEQF-UHFFFAOYSA-N	447.426	2.000	50	20	IDGD	
COC(=O)[C@H](C)Cc1ccc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)cc1	764404175	GIYNTDHRHVSREE-CYBMUJFWSA-N	445.497	1.622	50	20	IDGD	
COc1ccc(NC(C)=O)cc1NC(=O)C(=O)NNC(=O)CSc1ccccc1O	764404496	KJGREBAHOQKZHF-UHFFFAOYSA-N	432.458	1.237	50	20	IDGD	
CCCc1c(NC(=O)C(=O)NN[C@]2(C)CCS(=O)(=O)C2)cnn1-c1ccc(C)cc1	764674163	VNQJYGQESSOZMK-HXUWFJFHSA-N	433.534	1.270	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765731874	DFLSEGDWYCUUFH-INIZCTEOSA-N	428.464	1.198	50	20	IDGD	
CC(C[C@H]1COCCN1C(=O)OC(C)(C)C)=NNC(=O)c1ccc(-n2cnnn2)cc1	767368784	VKMFVEWELHMWHC-KRWDZBQOSA-N	429.481	1.794	50	20	IDGD	
CC(=NNC(=O)Cc1cc(C)[nH]n1)c1ccc(S(=O)(=O)N(C)CCCC(=O)O)cc1	767409949	KWAOPTQQWKUFOC-UHFFFAOYSA-N	435.506	1.286	50	20	IDGD	
O=C(CCNC(=O)c1n[nH]c2ccccc12)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	768278633	ISWTYWGKDRIIGU-UHFFFAOYSA-N	435.419	1.673	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)[C@H](C)c1ccc(S(C)(=O)=O)cc1	768630309	QFGOHEGPCHQOIC-GFCCVEGCSA-N	426.516	1.749	50	20	IDGD	
N#Cc1cc(Cl)nc(NNC(=O)[C@@H]2CN(Cc3nc(O)c4ccccc4n3)CCO2)c1	768708396	XPEFOSLUBJLOQN-HNNXBMFYSA-N	439.863	1.600	50	20	IDGD	
C[C@H]1Oc2ccccc2N(CC(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)C1=O	770967284	FRJHGQLPNCGDKP-LLVKDONJSA-N	425.449	1.544	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)NNc2nc(O)c3cnn(C)c3n2)c(C)n1C[C@H]1CCCO1	770990164	MCLVLCCQXMPVJV-MVMZHWFQSA-N	436.476	1.717	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1ccc(OCC(=O)N2[C@H](C)CCC[C@H]2C)cc1	771853392	SSVFQOFCOLPEIQ-OAGGEKHMSA-N	433.505	1.958	50	20	IDGD	
CC(C)(C)OC(=O)N1CCSC[C@@H]1CC(=O)NNC(=O)CNC(=O)c1cccs1	772103236	WTEVVYNSSBTGIC-LBPRGKRZSA-N	442.563	1.368	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)c2cc(F)cc([N+](=O)[O-])c2N)C1	773422665	XLWZPIGKTJTDJC-JTQLQIEISA-N	425.417	1.724	50	20	IDGD	
O=C(NNc1ccc(C(F)(F)F)cn1)C(=O)Nc1ccc(CN2C(=O)CCC2=O)cc1	773669785	OGKZJAWMEKDMIC-UHFFFAOYSA-N	435.362	1.831	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1cccc(NC(=O)C(=O)NNc2cnc3ccccc3n2)c1	773716127	FSANIXIYNFOUOX-UHFFFAOYSA-N	442.501	1.788	50	20	IDGD	
CS(=O)(=O)C[C@H](NC(=O)NNC(=O)c1cnn(-c2ccccc2)c1)c1ccccc1	774283574	PZIITXHLLRQRLB-SFHVURJKSA-N	427.486	1.602	50	20	IDGD	
CCc1cnccc1[C@H](C)NC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	774336573	ZCUCOJDZCMKNHF-HNNXBMFYSA-N	447.565	1.362	50	20	IDGD	
COc1ccc(SC)c(OC)c1C(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	775959257	NNPNHPDFUHHEDS-UHFFFAOYSA-N	449.441	1.952	50	20	IDGD	
COC(=O)c1ccccc1NNC(=O)CN1C(=O)N[C@](C)(c2ccc(OC)cc2)C1=O	777772688	IUSIFOLHGZDQHH-OAQYLSRUSA-N	426.429	1.392	50	20	IDGD	
O=C(c1ccn(-c2ccc(F)cc2)n1)N1CCN(S(=O)(=O)CBr)CC1	777778075	VVAOFSYGYYGHPT-UHFFFAOYSA-N	431.287	1.451	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@H](C(=O)NNc2cccc(Br)c2)[C@@H](C)O)cc1	779535805	FKYFRNMKGZKAIK-WBMJQRKESA-N	442.335	1.929	50	20	IDGD	
O=C(NCc1ccc(S(=O)(=O)NC[C@H]2CCCO2)cc1)NNc1ncncc1Cl	780965182	XFPMHPNRUFPHQL-CYBMUJFWSA-N	440.913	1.414	50	20	IDGD	
CC(C)Oc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c(Cl)c1	782121106	SRPZELKQIPNIBG-UHFFFAOYSA-N	443.851	1.503	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N2CCN(S(=O)(=O)CBr)CC2)cc1	782397484	AHXOGVQFGYRJLY-UHFFFAOYSA-N	427.342	1.074	50	20	IDGD	
COCCn1cc(C(=O)NNC(=O)[C@@H](C)Oc2cccc(Br)c2)c(C)n1	782538493	XXXUDMZYKGUHOR-GFCCVEGCSA-N	425.283	1.829	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)cc1)C(=O)Nc1ccc(=O)n(Cc2ccccc2Cl)c1	782833463	JCMSLYSNPAFHEK-UHFFFAOYSA-N	440.843	1.655	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)cc1)C(=O)Nc1ccc(C(=O)NCCc2ccccc2)cc1	782837313	HZYHFYZPMYYQMW-UHFFFAOYSA-N	446.463	1.764	50	20	IDGD	
CN(c1ccccc1NC(=O)C(=O)NNc1ccc(Br)cc1)S(C)(=O)=O	783009336	LPGXFICVNLVEKE-UHFFFAOYSA-N	441.307	1.927	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)(F)F)cc1)C(=O)Nc1ccnn1CC1CC1	783408747	NAXYTORICHTLLK-UHFFFAOYSA-N	431.396	1.668	50	20	IDGD	
Cc1ccc(NC(=O)OC(C)(C)C)cc1NC(=O)C(=O)NN[C@@]1(C)CCS(=O)(=O)C1	783425896	JWQGKUUYEMCVEB-IBGZPJMESA-N	440.522	1.479	50	20	IDGD	
CNS(=O)(=O)c1ccc2c(c1)N(C(=O)C(=O)NNc1nccc3sccc13)CC2	783435734	NKMFWFIRGCNZIU-UHFFFAOYSA-N	431.499	1.237	50	20	IDGD	
Cc1ccc(NNC(=O)C(=O)Nc2ccc(C)c(S(=O)(=O)N3CCCCCC3)c2)nn1	783949432	JYXIERGTAAOXID-UHFFFAOYSA-N	446.533	1.740	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CCOCC1)c1cc(-c2ccc(F)cc2)[nH]n1	784456880	PFMSQFOQUYVWKW-SJORKVTESA-N	441.463	1.418	50	20	IDGD	
NC(=O)c1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)c(F)c1	784835472	OXSZSTCEOUDKLQ-UHFFFAOYSA-N	430.364	1.003	50	20	IDGD	
CCN1CCN(C(=O)c2ccc(NC(=O)C(=O)NNc3cc(F)c(F)cc3F)cc2)CC1	784892172	XHBUFQFZGCPMQD-UHFFFAOYSA-N	449.433	1.963	50	20	IDGD	
CN(C)c1nccc(NNC(=O)C(=O)Nc2cc(Cl)ccc2OC[C@H]2CCOC2)n1	784969909	CLKQXBUMEGKKGD-LBPRGKRZSA-N	434.884	1.693	50	20	IDGD	
COc1ccc(OC(F)F)c(NC(=O)C(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)c1	785023628	MIIPDHYBXDJRJU-UHFFFAOYSA-N	440.315	1.310	50	20	IDGD	
N#Cc1ccc(NNC(=O)C(=O)Nc2ccc(C(=O)N3CCOCC3)c(F)c2)cc1Cl	785095369	VRWFYUWJBSNWMT-UHFFFAOYSA-N	445.838	1.905	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)[C@H]1CCN(C(=O)OC(C)(C)C)[C@@H]1C	786378919	SCVOPAABNNDCFE-WBVHZDCISA-N	433.505	1.874	50	20	IDGD	
O=C(NNc1nnc(-c2ccccn2)s1)[C@@H]1C[C@@H](O)CN1C(=O)OCc1ccccc1	788558298	KZHLNPWQKAFBOF-ZBFHGGJFSA-N	440.485	1.815	50	20	IDGD	
CN(C)[C@@H]1CCOc2c(NC(=O)C(=O)NNC(=O)c3cn(C)c4ccccc34)cccc21	789731109	CKPQCSMDZIFVOG-GOSISDBHSA-N	435.484	1.963	50	20	IDGD	
CC(C)Oc1cc(NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)ccc1C(N)=O	789731451	HYYQVKWFZVTVFL-UHFFFAOYSA-N	434.836	1.331	50	20	IDGD	
O=C(NNS(=O)(=O)c1cnc2onc(-c3ccccc3)c2c1)[C@H]1CCc2nncn2C1	793452357	YBHTVCNUELRNQR-ZDUSSCGKSA-N	439.457	1.053	50	20	IDGD	
NS(=O)(=O)c1cc(C(=NNC(=O)CNC(=O)c2cccs2)C2CC2)ccc1Cl	794502212	OVCMBVWSMGTNIB-UHFFFAOYSA-N	440.934	1.709	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc(Br)c(F)cc1[N+](=O)[O-])c1ccccc1O	795277133	MHIZWUPNHUAKFT-UHFFFAOYSA-N	434.199	1.825	50	20	IDGD	
Cc1cn(-c2ccc(Cl)cc2)nc1NC(=O)C(=O)NNC(=O)[C@@H]1Cc2ccccc2O1	799258755	IBEREYVDFPBDPK-KRWDZBQOSA-N	439.859	1.924	50	20	IDGD	
COCCN1C[C@@H](C(=O)NNC(=O)Nc2ccc(Br)cc2Cl)CC1=O	802043164	RTOPKXZYTLSMCG-VIFPVBQESA-N	433.690	1.750	50	20	IDGD	
COc1ccc(OC)c(C2=NO[C@@H](C(=O)NNC(=O)Nc3ccc4c(c3)OCO4)C2)c1	802103562	UOXHRLMQJNPLAC-GOSISDBHSA-N	428.401	1.778	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)N[C@@H]1CCCN(C(=O)Cc2ccccc2)C1	802478181	NWDUPOBSNAIILU-GOSISDBHSA-N	438.484	1.636	50	20	IDGD	
CCNS(=O)(=O)CCNC(=O)NNc1ccc(-c2cccc(C(F)(F)F)c2)nn1	805097025	HZPZGIDCPLRANO-UHFFFAOYSA-N	432.428	1.728	50	20	IDGD	
O=C(COC(=O)c1ncsc1Br)NNC(=O)c1cccc([N+](=O)[O-])c1	805709003	NVWYSSNZFFKDQW-UHFFFAOYSA-N	429.208	1.432	50	20	IDGD	
CCCNS(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)c2ccc(Cl)cc2F)cc1	808096303	JBNZTHIBUPRDQA-UHFFFAOYSA-N	449.913	1.791	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1n[nH]c2c(OC)cccc12	808674268	DGRLFBDCUVXSPM-UHFFFAOYSA-N	432.820	1.852	50	20	IDGD	
Cc1cc(O)nc2cc(C(=O)NNC(=O)CN3CCN(C(=O)c4ccccc4)CC3)ccc12	809724603	RFNGFVWJDZORGQ-UHFFFAOYSA-N	447.495	1.468	50	20	IDGD	
CCN(CC)c1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)cn1	813033561	ZHPCJZSRICIVKM-UHFFFAOYSA-N	434.522	1.260	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1)[C@H]1OCCc2sccc21	814222702	RRRXSBPOCDDVKH-RFAUZJTJSA-N	443.934	1.760	50	20	IDGD	
CC(C)(C)c1csc(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)c1C#N	815565918	DZHJCLXGAULLBE-UHFFFAOYSA-N	425.470	1.954	50	20	IDGD	
COCc1cc(NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)cc(C(=O)OC)c1	815567081	OAEOKCSDCFMXLV-UHFFFAOYSA-N	435.820	1.378	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)/C=C/CN(C)CC(F)(F)F)cc2)CC1	815854860	UGJKTBXNDYXRFT-ONEGZZNKSA-N	449.499	1.116	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2ccc(OCc3noc(C)n3)cc2)n1	825331387	FPNMXOQFTHNJAZ-UHFFFAOYSA-N	445.457	1.269	50	20	IDGD	
CCOc1ccc(C(=O)NNS(=O)(=O)c2cc(C(=O)O)cc(C(=O)O)c2)cc1OC	832086599	ZHXZYXVOFZABBB-UHFFFAOYSA-N	438.414	1.114	50	20	IDGD	
CSC[C@H](C(=O)NNC(=O)COc1cc(C)cc(C)c1)N1C(=O)[C@H]2CCCC[C@@H]2C1=O	863998491	YWNTVHYNOKMRHD-OKZBNKHCSA-N	447.557	1.736	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)[C@H](C)N2C(=O)[C@H]3CCCC[C@@H]3C2=O)cc1OC	913069809	NGQOCJFYNXHLHT-BPUTZDHNSA-N	431.489	1.809	50	20	IDGD	
Cc1cc(C)n(-c2ccc(C(=O)NNC(=O)c3ccc(Cl)c(S(N)(=O)=O)c3)cn2)n1	915188845	YQTYXTVRXTZNCU-UHFFFAOYSA-N	448.892	1.260	50	20	IDGD	
Cn1ncc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1C(F)(F)F	916125404	MQLCOGCMRCLSPJ-UHFFFAOYSA-N	445.423	1.298	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2cccc(Cn3ccnc3)c2)c1	916405590	GJICUGAMEXDXKL-UHFFFAOYSA-N	427.486	1.479	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NC[C@H](c2ccccc2)N2CCOCC2)cc1	916509050	JTDXETJEJDPMFZ-HXUWFJFHSA-N	428.489	1.478	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)Cc1nc2ccccc2n1C)N1CCN(c2ccccc2)CC1	916514835	PDPJWWUVOFFCIW-SFHVURJKSA-N	449.559	1.657	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)NCCCn3nc4n(c3=O)CCCC4)cc2C1	916649593	INKHUTNFGOIDIC-CYBMUJFWSA-N	432.550	1.602	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccc([N+](=O)[O-])s3)CC2)cc1	917107823	VZKWRXVLZMTJFW-UHFFFAOYSA-N	431.474	1.184	50	20	IDGD	
C[C@@H](C(=O)Nc1cccc(F)c1)N1CCN(CC(=O)NNC(=O)c2ccccc2)CC1	917124337	LMZIFGCYCGFWBD-INIZCTEOSA-N	427.480	1.232	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)[C@H]2CCN(c3cccc(Br)c3)C2=O)n1	917391848	JNJYZLGDKMIKER-OAHLLOKOSA-N	434.294	1.463	50	20	IDGD	
N#CCOc1ccccc1C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	919810570	NOGNZDKIXWHGOU-UHFFFAOYSA-N	428.470	1.448	50	20	IDGD	
O=C(NCCNC(=O)c1ccc(F)cc1)NNC(=O)c1nn(-c2ccccc2)cc1O	919916463	MKFZUBQWPRCJAN-UHFFFAOYSA-N	426.408	1.091	50	20	IDGD	
COCCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2C[C@@H](C)C[C@@H](C)C2)c1	920863108	YSGAMCNEIBYYAS-GASCZTMLSA-N	426.539	1.334	50	20	IDGD	
O=C(CCO)NNC(=O)Nc1cc(I)ccc1Br	1320275973	NZVOYBFWKVNZCO-UHFFFAOYSA-N	428.024	1.589	50	20	IDGD	
CN(CCO)S(=O)(=O)c1ccc(C(=O)NNC(=O)Nc2ccc(Cl)cc2)cc1	1327936459	LGRULRRTHFUIOP-UHFFFAOYSA-N	426.882	1.419	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)CNS(=O)(=O)c3ccccc3)n[nH]2)cc1	1343534477	NNWAEGSSLRWALA-UHFFFAOYSA-N	427.486	1.379	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)N[C@@H]2COc3c(F)cc(F)cc3C2)cc1	1527968409	FVYFDXTYAPUZRT-ZDUSSCGKSA-N	440.428	1.708	50	20	IDGD	
CCc1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1	1779032682	QZJYBOSWXKHHCM-HSZRJFAPSA-N	437.500	1.005	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccnn2C(C)C)C1	1779750456	GILNTIHWOLLLDZ-XAUMDUMWSA-N	426.945	1.845	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(=O)nc3cccnn23)C1	1780040587	YGOMGOUGWKDCIA-CMPZQBNXSA-N	447.923	1.234	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H]1CCCO1)CCO2	1780097241	TXPOLGCUEMOQEJ-WIYYLYMNSA-N	447.444	1.143	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Cl)C2)c1cccc(-n2cncn2)c1	1781124967	SWYJEZLDAAPJRS-FUHIMQAGSA-N	435.887	1.929	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)Cn3c(=O)n(C)c4ccccc43)CCO2)C1	1781219360	OQCOLUXTYSOJIA-BTYIYWSLSA-N	434.924	1.187	50	20	IDGD	
Cc1nc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)c(=O)[nH]c1C	1781225434	WVAOJDLUJNJZLS-ZWKOTPCHSA-N	431.320	1.067	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Cl)C2)c1cc2cccnc2nc1O	1781249292	CYRQBGNQNRMSRI-STXHMFSFSA-N	436.871	1.997	50	20	IDGD	
O=C(Cc1cccc([N+](=O)[O-])c1)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781324640	BHEDMOINGISWJK-DOTOQJQBSA-N	444.257	1.658	50	20	IDGD	
O=C([C@H](F)Br)N1CC[C@]2(C1)CN(C(=O)[C@@H]1CCc3ccoc3C1)CCO2	1781325214	KZWOLPITAZCNRT-XUWXXGDYSA-N	429.286	1.905	50	20	IDGD	
CCN(C)[C@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)CBr)C2	1781451336	WZERAKTTXINGLD-WFXMFSGNSA-N	432.403	1.872	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(=O)ccn1C)C2	1781998381	ZMADTURXCOFKNT-URKNILKWSA-N	440.338	1.296	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccnc1OC)C2	1782171230	UNSDWQIIYVERMS-RZQQEMMASA-N	425.913	1.472	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)C3CCC4(CC3)OCCO4)C2)C1	1782944273	RKNGMAYGKYFOFN-KDOFPFPSSA-N	445.354	1.533	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)CCc3cnn(C)c3)CCO2)C1	1783342797	OREOYWJIVPRZCT-MAUKXSAKSA-N	427.343	1.356	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccn(CCOC)n3)CCO2)C1	1783348228	XBXPCXWSQQBAHA-KSSFIOAISA-N	443.342	1.147	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(CO)c(F)c3)CCO2)C1	1783352777	IFLKSPRQXRIZBU-KXBFYZLASA-N	443.313	1.935	50	20	IDGD	
COc1cc(CCC(=O)N2CCO[C@]3(CCN(C(=O)[C@H](C)Br)C3)C2)ccn1	1783530265	WGTMRQQIQBKCNI-IFXJQAMLSA-N	440.338	1.636	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H]1CCc3nc[nH]c3C1)CCO2	1783540424	WKFIIAYSCINTFH-LXIYXOSZSA-N	425.327	1.128	50	20	IDGD	
C[C@@H](CNC(=O)OC(C)(C)C)C(=O)N1CCO[C@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783940119	QZFBXHIXSNFCNC-SGTLLEGYSA-N	438.352	1.781	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)C3(O)CCC3)C[C@@H]21	1783963878	BMOOTZZINSTYKX-YXMSTPNBSA-N	431.371	1.548	50	20	IDGD	
CC(C)N1CCC[C@H]1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]2C1	1783975852	XSUYGOVYCLKJGF-ATIWLJMLSA-N	444.414	1.870	50	20	IDGD	
O=C(c1ccc(OCC2CC2)c(F)c1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1785254070	SAKGEBSNJAPJRS-LAUBAEHRSA-N	440.899	1.658	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC1(c2ccc(NC(=O)CN3CCCC3)cc2)CCC1	1785870787	AIXVCJORRFNMNH-UHFFFAOYSA-N	436.516	1.529	50	20	IDGD	
COc1cnc(C(=O)Nc2ccc(C3(NC(=O)c4cccc(B(O)O)c4)CCC3)cc2)cn1	1787559589	NPGVQOMJBTUTCK-UHFFFAOYSA-N	446.272	1.227	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)c1cnc2ccccn12	1787934003	OIWFDUHJINJOGE-LMRQPLJMSA-N	439.285	1.618	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)c1n[nH]c2ccccc12	1788332577	OFRCFJKGLSOMEL-YLUJIRGKSA-N	439.285	1.847	50	20	IDGD	
COCc1oncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]2C1	1788762566	GGPQAAQPLNAOBA-BPUTZDHNSA-N	425.558	1.266	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3ccc(F)nc3)C[C@@H]21	1788765963	XLPOXGVOXPXXLH-BZSNNMDCSA-N	437.588	1.985	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(-n4ccnc4)ccn3)[C@H]2C1	1789376066	LZFSWGMATVFMIO-XPYUAMARSA-N	447.923	1.114	50	20	IDGD	
Cc1ncc(C(=O)NC2(c3ccc(NC(=O)c4cnccc4C(=O)NN)cc3)CCC2)cn1	1789521085	FFLOLQRLUFTBBW-UHFFFAOYSA-N	445.483	1.845	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C[C@@H]21	1789860179	KOGZGVGDPZXWIC-WFHGCUKPSA-N	437.928	1.118	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cn4ncccc4n3)C[C@@H]21	1789868024	LIRUQXWFSVSHRW-VODUFIJXSA-N	440.331	1.559	50	20	IDGD	
CN1CCC[C@@H](C(=O)Nc2ccc(C3(NC(=O)c4cccc(B(O)O)c4)CCC3)cc2)C1	1790391632	XWRKVMKSKYRUAH-GOSISDBHSA-N	435.333	1.456	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4c(c3)NC(=O)CC4)[C@H]2C1	1790503936	GLRVOJNOWMCMDJ-DWRORGKVSA-N	449.935	1.418	50	20	IDGD	
CCOc1ncccc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]2C1	1791054354	CEQZBTURCMPPKJ-VRKREXBASA-N	440.338	1.857	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)COc3ccccc3C#N)C[C@@H]21	1791256268	KVMLEGPTAVCENI-DWRORGKVSA-N	435.908	1.171	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(F)c(F)c3OC)C[C@@H]21	1791256607	CZIOESBXBQCJCL-PCBIJLKTSA-N	446.878	1.821	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ncn(-c4ccccc4)n3)C[C@@H]21)C(Cl)Cl	1791295428	GEHBGAZHBIJUIV-QEJZJMRPSA-N	438.315	1.664	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1ccc(C2(NC(=O)[C@H]3CCC(=O)NC3)CCC2)cc1	1791595749	NKKXUOLQBWMZIC-HNNXBMFYSA-N	429.521	1.020	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3cnccn3)[C@H]2C1	1791660624	AJIRSKNDBBXRBT-VRKREXBASA-N	425.327	1.172	50	20	IDGD	
CC(C)c1nc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)CBr)no1	1792868729	NDTYGJJMQLYQTM-NFFDBFGFSA-N	443.342	1.356	50	20	IDGD	
CCOC(=O)c1ncn2cc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)[C@@H](O)CCl)ccc12	1793110938	YXYXFRZULXRZLO-IVSAIRAKSA-N	448.907	1.363	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnn(C(C)(C)C)c1	1794351345	VFMDBHJKNHWRPK-REBRKWNGSA-N	427.343	1.625	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccnc(Cl)c1	1795118276	SEYFADNZSZVCEW-BTTYYORXSA-N	428.880	1.299	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(C)(C)NCCC#N	1795601232	WJNVBSDQGLQMCU-XGUBFFRZSA-N	429.359	1.031	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)c1ccc2cc(O)ccc2n1	1796188929	BZCZEHIVUWYTSR-REPLKXPHSA-N	445.284	1.186	50	20	IDGD	
COC(=O)c1ccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CO[Si](C)(C)C)cc1	1797956526	IENBEFSPXXKKMC-RMFSNUHRSA-N	448.592	1.457	50	20	IDGD	
Cc1ccc(OCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Br)cc1	1799346440	QQALEJSYZSAVHH-RMHZUWNSSA-N	429.286	1.654	50	20	IDGD	
CC[C@H](CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2)NC(=O)OC(C)(C)C	1799368198	ZDBWKYNUDYINRN-STGWMILLSA-N	435.924	1.804	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnsn1)C2	1800332282	ARADLLVINQENSU-XSDCOXNMSA-N	445.451	1.627	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(C)nc1O)C2	1800642352	FLMQBKZLPQCNHH-AYRXBEOTSA-N	426.311	1.472	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@](C)(Cl)CCl)C3)C1	1800968623	GUPLIAFEBYNRLB-YHEOXHNVSA-N	449.375	1.792	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Cc1ccc(F)cc1)C2	1800979735	YAVHHRQYUNERIL-GJSASXELSA-N	426.916	1.848	50	20	IDGD	
COC(=O)N[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(Cl)Cl)c1ccccc1	1801014074	CVMAXRVZMYZWOC-LXTVHRRPSA-N	444.315	1.477	50	20	IDGD	
CC(C)(C)n1cc(C(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)nn1	1803141360	NKDKFIJHCGIOKO-HYVNUMGLSA-N	434.928	1.347	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)CCc2nc(N)n[nH]2)[C@@H]1c1cccnc1	1803691697	IXLFCILREBNOJY-RLFYNMQTSA-N	433.944	1.828	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)[C@H]1COc2ccccc2O1	1804195872	JGMZWRQOGPYNJG-FIYPYCPBSA-N	445.903	1.527	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)N1CCC2(CCCN(C(=O)[C@H](C)CBr)C2)CC1	1805385342	WQTDQZAQELWMEU-HUUCEWRRSA-N	445.402	1.956	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@@H](CNC(=O)CCBr)[C@H]2c2cccnc2)nn1	1806343339	PPJBUIQMAGXEPM-KBXCAEBGSA-N	448.321	1.985	50	20	IDGD	
O=C(CN1CCOCC1)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@H]1c1cccnc1	1806908442	HDQCCDGYAPKSBI-XIRDDKMYSA-N	443.317	1.110	50	20	IDGD	
COc1cnc(C(=O)N2CCCC3(CCN(C(=O)CCC(=O)NN(C)C)CC3)C2)c(F)c1	1807725490	KOXXTYQPEMIOIA-UHFFFAOYSA-N	449.527	1.447	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC2(CCCN(C(=O)c3cnccc3F)C2)CC1	1810335233	QSJAVBRBSFBONG-UHFFFAOYSA-N	425.269	1.059	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H](CNC(=O)c2c[nH]c(=O)cn2)[C@@H]1c1cccnc1	1811446578	GBDOPOVZRRUPLQ-MRRJBJDNSA-N	448.321	1.516	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)CNC(=O)N(C)C)[C@@H]1c1cccnc1	1812862625	AWHPKNZNZMDOQW-DUVNUKRYSA-N	440.342	1.142	50	20	IDGD	
CC(=O)NCCC(=O)N1CC[C@H](CNC(=O)[C@@H](C)Br)[C@H]1c1cccnc1	1812868174	TVWPYWYWSMNYJQ-SRCQZFHVSA-N	425.327	1.397	50	20	IDGD	
COC1(CC(=O)NC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)CCC1	1813676712	XXDHCRVYBMWCBC-PGRDOPGGSA-N	445.564	1.420	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](O)c2ccco2)n[nH]1	1814463687	IYGPHSCDIGGRMM-KUHUBIRLSA-N	432.481	1.101	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@H]2Cc3ccccc3CN2)[nH]n1)[C@H](O)CCl	1814871476	PWLSOWCHDCQQOQ-FGTMMUONSA-N	431.924	1.716	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H]1CCOC1)CC2	1817282726	LCXJKSAIFKIBFW-ZXWLHBBBSA-N	444.517	1.226	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@H]2CCCS2)[nH]n1)c1ccc(B(O)O)cc1	1817475860	XAAPAEWBJICILB-DLBZAZTESA-N	428.323	1.291	50	20	IDGD	
CC(=O)N[C@H]1CCc2nc(NC(=O)CN(C)NC(=O)NCc3ccccc3)sc2C1	1822518354	NDYITEUWKDONID-HNNXBMFYSA-N	430.534	1.421	50	20	IDGD	
CC(C)CNC(=O)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](C)Br)sc2C1	1825642296	VKZJRRWRTWBVEN-NXEZZACHSA-N	431.356	1.611	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CN1CCOCC1)CC2	1825642863	WFVOQGAYBCGZFO-WDEREUQCSA-N	431.356	1.171	50	20	IDGD	
O=C(CCc1ccc(O)nn1)N[C@@H]1CCc2nc(NC(=O)C(Cl)Cl)sc2C1	1826103896	XTLCGWLCOYPEOR-SECBINFHSA-N	430.317	1.987	50	20	IDGD	
C=CCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCN2C(=O)OCc1ccccc1	1828551975	YLTSHQAEMJHEIF-AVRDEDQJSA-N	449.935	1.614	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC([C@@H]2CCCCN2C(=O)C2=NNC(=O)C2)CC1	1828858431	GLESMMOXQBWFTR-WFASDCNBSA-N	427.343	1.513	50	20	IDGD	
O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(F)nc1F)CCO2	1829527982	QFZUTWQDZKVBSR-KRWDZBQOSA-N	448.264	1.215	50	20	IDGD	
C/C(=C\c1cccs1)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1	1829696734	IDQKPQITKCRYHT-VMAJJHQASA-N	428.938	1.208	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(C=O)s3)C2)C1	1830358140	QYEFGTHJZRCJAR-LJQANCHMSA-N	428.938	1.896	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)CNc3ccc(F)cc3)C2)C1	1830359842	WGXQGYLSDIQLHM-NRFANRHFSA-N	441.931	1.959	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4cccn4cn3)C2)C1	1830361779	CQXKEMMUGQSOAG-NRFANRHFSA-N	434.924	1.669	50	20	IDGD	
O=C(CCc1cc(F)ccn1)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1832854366	NZHWWEWVKYVFQK-SFHVURJKSA-N	434.295	1.413	50	20	IDGD	
Cc1[nH]nc(C(=O)NC2CCN(C3CCN(C(=O)CCBr)CC3)CC2)c1F	1834020001	VGWDNHKKZZFXDB-UHFFFAOYSA-N	444.349	1.827	50	20	IDGD	
COCCOCC(=O)N1CCC(N2CCC(NC(=O)CCBr)CC2)CC1	1834421188	OLXLDJPIDSXKBT-UHFFFAOYSA-N	434.375	1.006	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cccn4c(O)nnc34)CC2)CC1)[C@H](F)Cl	1835079515	BZQVCOVNRLIZAN-HNNXBMFYSA-N	438.891	1.155	50	20	IDGD	
C=CC[C@@H](C(=C)C)C(=O)NC1CCN(C2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1	1835683364	BVHVOALXMOPAIK-NRFANRHFSA-N	447.624	1.699	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3ccc(CO)o3)CC2)CC1	1835928578	BGZIMRKMWNJSQK-ZDUSSCGKSA-N	442.354	1.741	50	20	IDGD	
CCCC(=O)N[C@@H](C)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](Cl)CC)CC2)CC1	1836396859	NOJGTRHKKBAZMN-YJBOKZPZSA-N	429.005	1.880	50	20	IDGD	
CC(C)n1cnc(C(=O)N2CCC(OC3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)n1	1836718108	SDSPBNXKHIRVPG-INIZCTEOSA-N	427.933	1.071	50	20	IDGD	
Cc1nc(CC(=O)N2CCC(OC3CCN(C(=O)[C@@H](C)Br)CC3)CC2)no1	1837156201	FMZBWQIIMBTREV-GFCCVEGCSA-N	443.342	1.703	50	20	IDGD	
Cc1ccncc1CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)CO[Si](C)(C)C)CCO2	1837710024	CPKMKDMGIRFMNM-QFIPXVFZSA-N	449.624	1.631	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccncc3O)CCO2)C1	1837820846	DHOLYJJTPCNYFW-RDTXWAMCSA-N	442.310	1.031	50	20	IDGD	
O=C(Cc1cc[nH]n1)N1CCC(OC2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1838647953	AWELGLWUNLYQND-MRXNPFEDSA-N	431.306	1.641	50	20	IDGD	
CCOc1ncccc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](Cl)CC)CCO2	1839141307	DPHZQPUYUDTQQX-UZLBHIALSA-N	425.913	1.568	50	20	IDGD	
CC(C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2	1839150025	AEQFMFOSELQNLT-QZTJIDSGSA-N	425.353	1.494	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccc(F)c(C#N)c3)CCO2)C1	1839187520	HPDYHAYOZIQZGG-UWJYYQICSA-N	437.899	1.714	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccncc3O)C2)C1	1839964839	GBONKRWUUPTZIO-KSSFIOAISA-N	442.310	1.031	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCCc3ccncc3)C2)C1	1840150801	QPYZFPDKWVERMS-RXVVDRJESA-N	439.940	1.115	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccncc3Cl)C2)C1	1840153676	XLHVYQNGGDRWFR-YJBOKZPZSA-N	432.304	1.059	50	20	IDGD	
O=C(c1cncc2cnccc12)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840188980	PFJVLDJMCZIUTQ-LJQANCHMSA-N	439.299	1.504	50	20	IDGD	
Cc1cnn([C@H](C)C(=O)N2CCO[C@@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)c1	1840404726	BORPLDSDVCDFDW-YLJYHZDGSA-N	438.601	1.060	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CCCC[C@@H]1C(=O)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1	1841354838	ZKHITEGUYAKHKU-XHSDSOJGSA-N	443.972	1.873	50	20	IDGD	
C[C@@H](NC(=O)c1ccc(F)cc1)C(=O)N1CC2(CCCN2C(=O)CCBr)C1	1842638759	DOVHHGREBMFCAT-CYBMUJFWSA-N	440.313	1.932	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1ccc(Cl)nc1Cl)C2	1844264630	RJQRHGLFEWJMLK-UHFFFAOYSA-N	449.298	1.518	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCCC12CN(C(=O)Cc1cn3c(nc1=O)SCC3)C2	1845171954	GKNCCMGSCRARAU-QGZVFWFLSA-N	445.372	1.331	50	20	IDGD	
CCN(C)[C@H](C)C(=O)N1CCCC12CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1845746033	ZYAKYNBDLSVXOP-CABCVRRESA-N	430.977	1.662	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@H]2[C@@H](O)CCN2Cc2ccccc2)C1	1845836996	ASMZMLANMXLRPV-QYZOEREBSA-N	435.952	1.079	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NN[C@@H](C(=O)NC1CC1)c1ccc(F)cc1	10830454	YAQALMVPGNRSME-MRXNPFEDSA-N	433.509	1.682	50	20	IDGD	
CCn1c(NNC(=O)c2cccc(N3CCCS3(=O)=O)c2)nc2ccccc2c1=O	11166731	WNXHSOJREFYJJU-UHFFFAOYSA-N	427.486	1.713	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2nn(-c3ccccc3)c(C)cc2=O)c2ccccc2c1=O	15856866	WUTGCDSZOFOPSW-UHFFFAOYSA-N	444.451	1.346	50	20	IDGD	
Cn1c(N)c(C(=O)/C(C#N)=C/c2c(-c3ccccc3)nc3sccn23)c(=O)n(C)c1=O	16881653	BGPYBZFTQSNTHP-JLHYYAGUSA-N	432.465	1.832	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1OC(F)F	46903620	MGANMMUAUVGHBT-UHFFFAOYSA-N	428.417	1.665	50	20	IDGD	
Cc1cc(C)cc(C(=O)N2CCC[C@@H](C(=O)NNC(=O)c3n[nH]c(=O)c4ccccc34)C2)c1	107908235	WKQXAENLMCYUOI-MRXNPFEDSA-N	447.495	1.853	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)c2cc(Cl)c(OCC(N)=O)c(OC)c2)cc1	137968322	KASORUGMTCAGIE-UHFFFAOYSA-N	436.852	1.094	50	20	IDGD	
O=C(COC(=O)/C=C\c1ccc([N+](=O)[O-])cc1)NNC(=O)[C@H]1COc2ccccc2O1	212302514	INWJYDBGYGCWFH-CGQZWFTASA-N	427.369	1.139	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCCc2ccc(OC)c(F)c2)c2ccccc2c1=O	728400049	PMLWXEMIDCTOJA-UHFFFAOYSA-N	427.436	1.751	50	20	IDGD	
O=C(Cn1cnc2sccc2c1=O)NNC(=O)c1cc(F)ccc1Br	728549609	LMUUCAROQXFIFB-UHFFFAOYSA-N	425.239	1.821	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)CS(=O)(=O)Nc1ccc(N2CCCCC2)cc1	728893254	OISSAXAOZWXNTJ-UHFFFAOYSA-N	431.518	1.204	50	20	IDGD	
Cc1cc(C(=O)N2CCC[C@H]2C(=O)NNC(=O)CCc2ccccc2O)ccc1[N+](=O)[O-]	730032607	CGSMPFXSIZRDCL-SFHVURJKSA-N	440.456	1.994	50	20	IDGD	
Cc1ccc(C)c(S(=O)(=O)Nc2cccc(C(=O)NNC(=O)Cc3cc[nH]n3)c2)c1	730102415	BNNOPGLQMKSIJM-UHFFFAOYSA-N	427.486	1.831	50	20	IDGD	
COC(=O)c1ccc(C(F)(F)F)cc1S(=O)(=O)NNC(=O)c1ccc2c(c1)OCO2	730203900	YYWWZMPVURWCIT-UHFFFAOYSA-N	446.359	1.844	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc2c(c1)CCCC2)NNC(=O)COc1ccccc1O	730777701	AMMWUDMNORAISV-UHFFFAOYSA-N	447.513	1.166	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)[C@H](CCSC)N1C(=O)c2ccccc2C1=O	731492271	FJIJWEXDCBZWKS-INIZCTEOSA-N	427.482	1.874	50	20	IDGD	
CS(=O)(=O)CCN1CCC(NC(=O)NNC(=O)c2ccc(Cl)cc2Cl)CC1	731761509	PGWBOUCCOQWZTE-UHFFFAOYSA-N	437.349	1.446	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)c2ccc(C(=O)NNC(=O)c3c[nH]nc3C)cc2)cc1	731853295	ZSDCSGFCBRSBID-UHFFFAOYSA-N	427.486	1.926	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1	732050263	PWHXQBSITFYBOM-LBPRGKRZSA-N	436.421	1.626	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCC(CN3CCCCC3=O)CC2)cc1OC	735872455	ZTZXXOYFCCFULK-UHFFFAOYSA-N	432.521	1.189	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)CNC(=O)c2ccccc2OC)cc1C	736757368	NKJRBDKPZLXHSR-UHFFFAOYSA-N	433.486	1.362	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)N[C@@H]1CC=CCC1	737063187	DQIJNDWKMZPOTH-QGZVFWFLSA-N	436.534	1.079	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cc3c(nc2O)CCCCC3)cc1OC	738754806	LGCSKROCXQPXHJ-UHFFFAOYSA-N	443.456	1.691	50	20	IDGD	
Cc1nn(C)cc1[C@H](C)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	739033938	HNYPRXRUTKJGOK-AWEZNQCLSA-N	448.549	1.608	50	20	IDGD	
O=C(O)CNC(=O)c1ccc(S(=O)(=O)NNC(=O)c2cccc3ccccc23)cc1	741654954	CKTKHRLPXNMQTF-UHFFFAOYSA-N	427.438	1.278	50	20	IDGD	
Cc1oc(C)c(S(N)(=O)=O)c1C(=O)NNC(=O)NCc1cccc(C(F)(F)F)c1	742453609	XBIOKASIKAXQQM-UHFFFAOYSA-N	434.396	1.707	50	20	IDGD	
C[C@@H](CN1CCN(c2ccccn2)CC1)NC(=O)NNC(=O)Nc1ccc(N(C)C)cc1	743618790	KZRRVXIURBLHBL-KRWDZBQOSA-N	440.552	1.694	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)/C(=C\c2cccc(F)c2)n2nnnc2C)c1	744545102	GLOWUDZDOAWTPD-WOJGMQOQSA-N	438.419	1.432	50	20	IDGD	
C[C@]1(C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)CCCN(C(=O)c2ccccc2)C1	745345968	AGVWYQNHBAUFGV-DEOSSOPVSA-N	448.479	1.805	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)N[C@H]1CCCN(c2ccccc2Cl)C1=O	745848635	UXGOOZSVZLMRSP-AWEZNQCLSA-N	432.864	1.950	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)N[C@@H]1CC(=O)N([C@@H]2C[C@@H]2c2ccccc2)C1	745915375	YOFYESKUEPPBGQ-GUDVDZBRSA-N	433.468	1.424	50	20	IDGD	
CC(C)c1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)n(C)n1	746578848	BDJQAPVJOFLOIV-UHFFFAOYSA-N	433.534	1.793	50	20	IDGD	
CC(C)(C)OC(=O)NC1(CC(=O)NNC(=O)c2csc(N3CCOCC3)n2)CCC1	746822176	NWMYXFJDHKLUQV-UHFFFAOYSA-N	439.538	1.578	50	20	IDGD	
O=C1CC(=O)Nc2cc(S(=O)(=O)NNC(=O)c3cccc4cccnc34)ccc2N1	747408108	ODVXPZRVLJQNJS-UHFFFAOYSA-N	425.426	1.139	50	20	IDGD	
NS(=O)(=O)c1ccc(C(=O)NNC(=O)NCCc2cccs2)cc1Br	748066454	VZZDOBSHXDMXRL-UHFFFAOYSA-N	447.336	1.345	50	20	IDGD	
O=C(CCCS(=O)(=O)N1CCCC1)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1	748521645	XWHHTGNYMXGZSX-UHFFFAOYSA-N	443.469	1.629	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)NCc1nnc2c(Cl)cc(C(F)(F)F)cn12	748616101	MMOJKUFUXUIHPG-QMMMGPOBSA-N	438.794	1.283	50	20	IDGD	
CN(C)Cc1ccsc1C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	748619999	NTYYVDVXDRJRSW-UHFFFAOYSA-N	437.591	1.503	50	20	IDGD	
CCc1cc(N2CCC(NC(=O)NNC(=O)c3cnn(-c4ccccc4)c3)CC2)ncn1	748663549	NZVQRZZDOFCVDB-UHFFFAOYSA-N	434.504	1.838	50	20	IDGD	
COC(=O)[C@H](C)NC(=O)/C(C#N)=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	751315398	HCLZEYNOYAYJQZ-IGVUGNCQSA-N	429.864	1.664	50	20	IDGD	
CCOC(=O)[C@@H]1Cc2cc(S(=O)(=O)NNC(=O)c3ccc4ccccc4n3)ccc2O1	751538858	QADDLRZJABWQPJ-IBGZPJMESA-N	441.465	1.725	50	20	IDGD	
N#Cc1ccc(CN2CC[C@@H](NC(=O)NNC(=O)c3cnn(-c4ccccc4)c3)C2=O)cc1	753134310	CXNJKDGIEKAPHI-HXUWFJFHSA-N	443.467	1.489	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2cc(F)ccc2Br)c(C)o1	754748973	NDBFZHZZHYUJGR-UHFFFAOYSA-N	435.227	1.900	50	20	IDGD	
COC[C@@](C)(O)C(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccc(C)cc2C)c1	754974902	UFOORZQBEVEDLC-HXUWFJFHSA-N	435.502	1.263	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(N(C)C)c(NC(=O)NNC(=O)c2c[nH]nc2C)c1	755435846	VMHJJOWZMVIRKO-UHFFFAOYSA-N	437.526	1.281	50	20	IDGD	
COC(=O)c1nscc1S(=O)(=O)NNC(=O)c1ccc(OC(C)C)c(OC)c1	755958048	QBKLMZZGVVLHPV-UHFFFAOYSA-N	429.476	1.349	50	20	IDGD	
O=C(CO)NNC(=O)Nc1ccc(S(=O)(=O)c2ccc(Br)cc2)cc1	756072663	MLZVEXFSCVEFSH-UHFFFAOYSA-N	428.264	1.427	50	20	IDGD	
Cc1ccc(C(N)=O)cc1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	756258252	FKDQLJLGOUKRFC-UHFFFAOYSA-N	445.501	1.345	50	20	IDGD	
CS(=O)(=O)Nc1ccc(NC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1Cl	756709542	ZJXHSGSYJRWIIY-HNNXBMFYSA-N	440.865	1.704	50	20	IDGD	
C[C@H]1C[C@H](C)CC2(C1)NC(=O)N(CC(=O)NNC(=O)c1cc(-c3ccccc3)on1)C2=O	756901055	HWJPQXGFEZMTDG-KBPBESRZSA-N	439.472	1.849	50	20	IDGD	
COc1ccccc1N1CC[C@H](NC(=O)NNC(=O)COc2cc(C)ccc2C)C1=O	757285413	IDPPOSYTOGFVPD-INIZCTEOSA-N	426.473	1.827	50	20	IDGD	
Cn1cc(Br)cc(NC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c1=O	757597188	IGRMINIWHPHQFQ-UHFFFAOYSA-N	431.250	1.800	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H]1CCc2ncc(NC(=O)NNC(=O)Cc3cc[nH]n3)cc2C1	757928660	UUOXIERPUUZTGX-ZDUSSCGKSA-N	429.481	1.582	50	20	IDGD	
CCCOc1ccc(-c2nc(C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)cs2)cc1	758054937	OYAGLJWQYGMENR-NSHDSACASA-N	426.520	1.298	50	20	IDGD	
N#CCCn1cc(/C=C(/C#N)C(=O)NS(=O)(=O)c2cnccn2)c(-c2ccccc2)n1	758579970	YSDYTXPVJQTAIB-WJDWOHSUSA-N	433.453	1.666	50	20	IDGD	
C[C@H]1CN(Cc2ccc(CNC(=O)NNC(=O)C(=O)Nc3ccccn3)cc2)C[C@H](C)O1	758687728	RDHPSDWJZXVOTF-HOTGVXAUSA-N	440.504	1.160	50	20	IDGD	
CCc1ccc(S(C)(=O)=O)cc1C(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	758924452	CNYXOFWABMPDOX-UHFFFAOYSA-N	449.441	1.179	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)N=c1cc[nH]cc1I	760024189	IZPPSBMLMZSXBD-UHFFFAOYSA-N	426.214	1.599	50	20	IDGD	
CCc1ccc(S(C)(=O)=O)cc1C(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	760117695	CSITUUUZTDGITL-UHFFFAOYSA-N	428.470	1.619	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)CCNC(=O)[C@@H]1CCCN1C(=O)OC(C)(C)C	760798658	BYLXLKCPILDPGA-INIZCTEOSA-N	448.520	1.291	50	20	IDGD	
CN(C)c1ccc2c(c1)N(C)C(=O)C2=NNC(=O)CCN1CCN(c2ccccc2)CC1	761742879	IKQVPNYGBQYCQC-UHFFFAOYSA-N	434.544	1.762	50	20	IDGD	
CN(NC(=O)c1cccnc1OCC(F)F)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	763283749	QWHZJWZUHYFOJO-UHFFFAOYSA-N	443.451	1.975	50	20	IDGD	
O=C(NNC(=O)c1ccccc1O)C(=O)Nc1cccc(I)c1	763528089	VMQSOBHAMCNAOF-UHFFFAOYSA-N	425.182	1.397	50	20	IDGD	
COc1cc(OC)c(NC(=O)C(=O)NNC(=O)c2ccc(OC)c(OC)c2)cc1Cl	763549927	BODJAJVXWVICBU-UHFFFAOYSA-N	437.836	1.774	50	20	IDGD	
CCNS(=O)(=O)c1ccc(CNC(=O)NNC(=O)Nc2ccc(N(C)C)cc2)cc1	763655455	QGGZXFLCUZDRNI-UHFFFAOYSA-N	434.522	1.587	50	20	IDGD	
Cc1cccc(Cn2nccc2NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)c1	763814945	XMMPUTGYTXIWTQ-UHFFFAOYSA-N	432.440	1.276	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccccc1C(=O)N1CCCCC1	763840291	PULQOAZOLRKMQB-UHFFFAOYSA-N	442.447	1.617	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(CS(C)(=O)=O)cc2)c1C	763850337	OJBDUFNHXLVNSX-HNNXBMFYSA-N	447.513	1.401	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cc(C)nn2C(C)(C)C)cc1	763872990	QLSCFCMUGLIEFP-CQSZACIVSA-N	429.477	1.703	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)C(=O)Nc2cccc(CS(C)(=O)=O)c2)cc1	763891237	NLCDHVOMTSNJJU-UHFFFAOYSA-N	435.527	1.418	50	20	IDGD	
N#CCCCOc1cccc(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)c1	763996062	UHZHNJYVFGBUSC-UHFFFAOYSA-N	434.250	1.859	50	20	IDGD	
CN(Cc1ccccc1NC(=O)C(=O)NNC(=O)c1cccn1C)C(=O)OC(C)(C)C	763997010	TYKCFXQZMMCSHM-UHFFFAOYSA-N	429.477	1.792	50	20	IDGD	
CON(C)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cccc(C(F)(F)F)c2)cc1	764037887	WPWBRIOVYDGBCZ-UHFFFAOYSA-N	438.362	1.739	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cccc(C(=O)N3CCc4ccccc43)c2)n[nH]1	764097966	IGLDNIWFHIJMDA-UHFFFAOYSA-N	432.440	1.321	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc(-c4n[nH]c(C)n4)cc3)n[nH]2)cc1	764112138	WOAMXHOZADJKDT-UHFFFAOYSA-N	444.455	1.878	50	20	IDGD	
CC(=O)N(Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)cc1)C1CC1	764125924	BDUCXGKZZUAXHJ-UHFFFAOYSA-N	444.875	1.956	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2cc(N3CCCC3=O)ccc2F)cc1	764127959	VTWHCWQQOFDTOU-UHFFFAOYSA-N	442.447	1.680	50	20	IDGD	
COc1cc(Br)cc(NC(=O)C(=O)NNC(=O)Cc2ccccc2OC)c1	764135990	LAJVMBZZZXJMGW-UHFFFAOYSA-N	436.262	1.795	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(CN(C)C)ccc2C)o1	764138854	LDZFPNMCDJJZTF-UHFFFAOYSA-N	429.521	1.891	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)[C@@H]3Cc4ccccc4O3)cc2)C[C@@H](C)O1	764155226	WZXDRMMYRXJSBF-MDOVXXIYSA-N	438.484	1.390	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccoc2)n([C@@H]2CCN(Cc3ccccc3)C2)n1	764164657	XNPAOTKDVYZANL-GOSISDBHSA-N	436.472	1.631	50	20	IDGD	
O=C(CCc1ccco1)NNC(=O)C(=O)Nc1ccc(F)cc1I	764178007	XRYBFULZRCXBAF-UHFFFAOYSA-N	445.188	1.742	50	20	IDGD	
Cc1ccc(NC(=O)c2ccccc2)cc1NC(=O)C(=O)NNC(=O)Cc1ccccn1	764268319	RBKJMPZYNHVSBI-UHFFFAOYSA-N	431.452	1.971	50	20	IDGD	
CCOCC(=O)NNC(=O)C(=O)Nc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(C(F)(F)F)c1	764325308	IRSFFMJPEQGECC-VXGBXAGGSA-N	446.426	1.441	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)c(Cl)c1)C(=O)Nc1cccc(CN2CCOC2=O)c1	764349804	QUGIYXGTJKLPDN-UHFFFAOYSA-N	432.820	1.398	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)C(=O)Nc1cccc(C[S@@](=O)C2CCCCC2)c1	764354086	OVCZUUVGSKFOJY-WJOKGBTCSA-N	442.541	1.992	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)C(=O)Nc1cccc(CN(C)C(=O)C(F)(F)F)c1	764389441	RUSFBWPIMQPJRL-UHFFFAOYSA-N	437.378	1.310	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(Sc2nc(C)cc(C)n2)cc1	764397690	LYYWQKHVUKQLRQ-CQSZACIVSA-N	447.517	1.382	50	20	IDGD	
COC(=O)CCc1ccc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)cc1	764404609	NEAGASONDGFNPF-UHFFFAOYSA-N	431.470	1.376	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H]2CCO[C@H](C(C)(C)C)C2)c1	764512262	ITKDGCYREXHQCR-HOCLYGCPSA-N	426.539	1.475	50	20	IDGD	
O=C(NN=C1CCN(c2nccs2)CC1)c1cccc(S(=O)(=O)N2CCOCC2)c1	764648724	IYWUTSZXLCAQDJ-UHFFFAOYSA-N	449.558	1.550	50	20	IDGD	
C[C@H](OC1CCCCCC1)C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765733640	OHGIOHTXUSIIHY-SFHVURJKSA-N	430.549	1.720	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)C[C@@H]3OC(=O)c4ccccc43)CC2)cc1	765756308	TXUNOUSZINXIDB-NRFANRHFSA-N	436.512	1.562	50	20	IDGD	
Cc1ccc(N2CCCC2)c(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)c1	766646747	DDFJQQAWTHPLIT-UHFFFAOYSA-N	449.555	1.814	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3c[nH]nc3-c3ccncc3)CC2)cc1	766647888	FXVJVTHJYXNWSL-UHFFFAOYSA-N	433.516	1.359	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)C1CCN(C(=O)OC(C)(C)C)CC1	767273287	RDMWZJACJKTWSM-UHFFFAOYSA-N	433.505	1.875	50	20	IDGD	
CC(=NNC(=O)c1ccc2c(c1)OCCO2)c1ccc(OCC(=O)N2CCOCC2)cc1	767489927	XCKBBBOQKNLKOC-UHFFFAOYSA-N	439.468	1.849	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)CC[C@H]2NC(=O)N(c3ccc(Cl)c(Cl)c3)C2=O)n[nH]1	768276647	AZZHXXHNCSHZNX-GFCCVEGCSA-N	439.259	1.691	50	20	IDGD	
COC(=O)c1ccc(S(=O)(=O)NNC(=O)c2ccc(F)cc2Br)cn1	769626967	UFNMZHRJFHMUAB-UHFFFAOYSA-N	432.227	1.393	50	20	IDGD	
CSCCNC(=S)NNC(=O)c1ccnc(Cl)c1I	770247682	QHHIZJVYSQHNST-UHFFFAOYSA-N	430.724	1.812	50	20	IDGD	
COc1cccc(-c2nc(C(=O)NNC(=O)C(=O)NCc3ccc(Cl)cc3)no2)c1	772887558	ARHRLIGKKITEFO-UHFFFAOYSA-N	429.820	1.476	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cc(I)ccc2C)n[nH]1	773497579	XTVAHMNKUWCEJJ-UHFFFAOYSA-N	427.202	1.031	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc(I)cn1	773535264	SNDYSPYRGPHGIX-UHFFFAOYSA-N	440.197	1.095	50	20	IDGD	
CN(C)C(=O)[C@@H]1CC[C@H](CNC(=O)CCC(=O)C(C#N)=C2N(C)c3ccccc3N2C)O1	775576728	NDPIEPZHRBDLHS-QRWLVFNGSA-N	439.516	1.409	50	20	IDGD	
Cn1cc([C@H](NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c2ccc(F)cc2)cn1	776194641	ARAVCNGGNBBHBN-GOSISDBHSA-N	449.446	1.540	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2c(C)nn(C)c2-n2cc(C)cn2)c2ccccc2c1=O	777413786	NFUZGSYZGRRAQD-UHFFFAOYSA-N	448.487	1.417	50	20	IDGD	
CCC(CC)[C@H]1C[C@H](NC(=O)NNC(=O)c2csc(N3CCOCC3)n2)CCO1	778587663	BDGPDBJJVZTLRD-GDBMZVCRSA-N	425.555	1.908	50	20	IDGD	
O=C(NNC(=O)c1cnccn1)C(=O)Nc1cc(Cl)ccc1OC[C@@H]1CCCCO1	778709208	DPNFCCLFLKFZEN-ZDUSSCGKSA-N	433.852	1.478	50	20	IDGD	
O=C(NNc1ccc([N+](=O)[O-])cc1Br)C(=O)Nc1cnn(-c2ncccn2)c1	778750921	FCUAIKUONPMXQY-UHFFFAOYSA-N	447.209	1.415	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2ccc(Br)c(O)c2)n1	778826800	MGTCFKZUBRQOFV-UHFFFAOYSA-N	428.264	1.467	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@](C)(C#N)CC(=O)OC(C)(C)C)c2ccccc2c1=O	780315285	QQNLMAIHUDYYBD-NRFANRHFSA-N	427.461	1.439	50	20	IDGD	
C[C@@H](CS(=O)(=O)c1ccc(F)cc1)C(=O)NNC(=O)CCNC(=O)OC(C)(C)C	780978200	NCGSHJKYMPWVNA-LBPRGKRZSA-N	431.486	1.298	50	20	IDGD	
CCOC(=O)c1c(C(C)C)csc1NC(=O)C(=O)NN[C@]1(C)CCS(=O)(=O)C1	783424888	GGRHXRSOBIFPEG-QGZVFWFLSA-N	431.536	1.185	50	20	IDGD	
Cc1c(NNC(=O)C(=O)Nc2ccc(S(=O)(=O)C(F)F)cc2)cccc1[N+](=O)[O-]	784349770	BJWKJBQIPDXXJU-UHFFFAOYSA-N	428.373	1.981	50	20	IDGD	
CNS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccc(OCC(F)(F)F)cc2)cc1	784368279	HERSWRLURMUKBT-UHFFFAOYSA-N	446.407	1.618	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H]2CN(CC(=O)NNC(=O)c3cccc(C#N)c3)C[C@H]21	784522499	HYRUEQZSPURZPQ-GUDVDZBRSA-N	441.532	1.944	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1ccc2[nH]ncc2c1	784834262	ZXYXTLHUWKXSBV-UHFFFAOYSA-N	430.490	1.722	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)C(=O)Nc2cccc(-c3n[nH]c(C4CC4)n3)c2)c1	784844482	JGQHVIGZAHMFGB-UHFFFAOYSA-N	440.485	1.834	50	20	IDGD	
CCN1CCN(C(=O)Cc2ccc(NC(=O)C(=O)NNc3cc(Cl)ccn3)cc2)CC1	784856484	NLLWWDIGXOLZOC-UHFFFAOYSA-N	444.923	1.523	50	20	IDGD	
O=C(NNc1cccnn1)C(=O)Nc1ccc(CN2CCN(c3ccccn3)CC2)cc1	784863630	ZXURGQSOFVMNSU-UHFFFAOYSA-N	432.488	1.276	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2cc(C3CC3)nn2-c2ncccn2)n1	785226416	GVIFJRWSAIVHQH-UHFFFAOYSA-N	436.480	1.258	50	20	IDGD	
COc1cc(F)cc(NNC(=O)C(=O)Nc2cc(C(N)=O)ccc2-n2cc(C)cn2)c1	785242325	XHDMQAWLBDCQQD-UHFFFAOYSA-N	426.408	1.509	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl	785330040	CDWZCOCSVFVCPP-UHFFFAOYSA-N	442.837	1.742	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1C	785442499	AZBPAUVJCSHUSL-UHFFFAOYSA-N	444.513	1.813	50	20	IDGD	
CCOC(=O)[C@@](C)(CNC(=O)NNC(=O)[C@H]1COc2ccccc2O1)c1ccccc1	787311731	YSXDXQDXNPGWNA-GCJKJVERSA-N	427.457	1.678	50	20	IDGD	
Cc1ccc(-n2cccn2)cc1NC(=O)C(=O)NNC(=O)c1cnn(-c2ccccc2)c1	789586259	NQXJIKDORYPCSW-UHFFFAOYSA-N	429.440	1.766	50	20	IDGD	
COc1c(C)cnc(Cn2cnc(NC(=O)C(=O)NNc3ccc(F)c(F)c3F)n2)c1C	789725145	AELCTPBLEHYXPY-UHFFFAOYSA-N	449.393	1.846	50	20	IDGD	
CN(C)[C@@H]1CCOc2c(NC(=O)C(=O)NNC(=O)COc3ccccc3C#N)cccc21	789732429	PTINJINCNVQFLV-QGZVFWFLSA-N	437.456	1.108	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)C(=O)Nc1ncc(C(C)(C)C)s1	789734685	FXAOLUTVHLDSDA-UHFFFAOYSA-N	427.527	1.831	50	20	IDGD	
C[S@](=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)cc1F	789809944	HUZBMCZIHUSCIS-XGODZNJDSA-N	433.461	1.222	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNc2cccc(F)c2[N+](=O)[O-])sc1Br	790585430	PRKYKMBMKXMDKD-UHFFFAOYSA-N	439.244	1.962	50	20	IDGD	
O=C(NNc1nc2ccccn2n1)C(=O)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1	792395935	WGTBBTOBCGYKNB-QGZVFWFLSA-N	445.487	1.455	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)N1CCC[C@@H](C=NNC(=O)COc2ccc(C#N)cc2)C1	794473119	YTYKWIVHOJOFSV-KRWDZBQOSA-N	443.504	1.802	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)Nc2cccc(S(=O)(=O)/N=C3/CCCN3C)c2)n1	797615612	CRRYUHOVRZADQX-ULJHMMPZSA-N	430.490	1.669	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)Cc2ccc([S@](C)=O)cc2)cc1	797789311	NNNPWLPQPPAXHV-PMERELPUSA-N	443.554	1.849	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)[C@](C)(O)Cn2cc(C(F)(F)F)ccc2=O)c2ccccc2n1	799010324	XGMZFOOCZSNCCN-HXUWFJFHSA-N	448.401	1.936	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)C2CCN(C(=O)[C@@H](C)CSC)CC2)cn1	799414111	HZBKUBRENWGGCO-LBPRGKRZSA-N	425.580	1.646	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1nc2c(s1)C[C@H](c1ccccc1)CC2	799437616	QQFFDIXEDYKTON-WCQYABFASA-N	437.547	1.506	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](c2cnn(C)c2)N(C)C(=O)OC(C)(C)C)cc1	801111376	PGCIJFUPGJMBJS-MRXNPFEDSA-N	444.492	1.423	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2cc([N+](=O)[O-])cc(I)c2C)n[nH]1	801165244	UIRMWLMZXVDXNQ-UHFFFAOYSA-N	429.174	1.614	50	20	IDGD	
C[C@@H]1CN(c2ccnc(C(=O)NNC(=O)Nc3ccc(S(C)(=O)=O)cc3)c2)C[C@@H](C)O1	802068231	FXCLPASKCRAJDM-ZIAGYGMSSA-N	447.517	1.565	50	20	IDGD	
COc1cc(N)c(C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)cc1Br	803951454	DQMDQNIOLXEUSH-UHFFFAOYSA-N	447.245	1.530	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N2C[C@H](N3CCOCC3)C[C@@H]2C)cc1Br	805104228	NRULXXGMPIDTRX-GXTWGEPZSA-N	441.326	1.607	50	20	IDGD	
COC(=O)c1cc(C)c(NC(=O)C(=O)NNC(=O)c2cc(OC)cc(OC)c2)c(Cl)c1	806974334	FPZOSPFMFLOASK-UHFFFAOYSA-N	449.847	1.852	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)CN(C)c1cc(Br)ccc1[N+](=O)[O-]	807369839	MEOUVIPUCGGZFU-UHFFFAOYSA-N	447.286	1.730	50	20	IDGD	
CC(C)Oc1ccc([C@H](CNC(=O)NNc2nc(O)c3cnn(C)c3n2)N(C)C)cc1	807588837	QGGDOHNUQNCEJX-INIZCTEOSA-N	428.497	1.785	50	20	IDGD	
CN(C)CCOc1ccc(/C=C/C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1	808371236	OZESCCQOKYGLBI-RMKNXTFCSA-N	438.532	1.494	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1cncc(C(F)(F)F)c1	808408644	WOPSWHPXMSPYER-UHFFFAOYSA-N	435.406	1.319	50	20	IDGD	
CC(C)(C)c1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccc3c2COC3=O)cc1	808934555	KUNKEUHFZPJOFD-UHFFFAOYSA-N	425.441	1.819	50	20	IDGD	
Cc1c(NNC(=O)C(=O)Nc2cc(C(N)=O)ccc2OCC(F)F)cccc1[N+](=O)[O-]	810394547	CAMQGONMSQRBPG-UHFFFAOYSA-N	437.359	1.728	50	20	IDGD	
O=C1CC(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)(c2ccccc2)C1	810461874	HDCILTJSCXPPNC-UHFFFAOYSA-N	429.498	1.452	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2cccc(-n3cccc3)c2)cc1	813033870	PADIOLRAUKNNIG-UHFFFAOYSA-N	427.486	1.809	50	20	IDGD	
Cc1cc(-c2cc(C(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)c3c(C)noc3n2)c(C)o1	813529302	YCIQGQGAVMVRRB-GFCCVEGCSA-N	432.458	1.604	50	20	IDGD	
CCS(=O)(=O)c1ccc(NC(=O)NNc2ccccc2S(=O)(=O)N(C)C)cc1	814532763	BWHULOCPFYESMQ-UHFFFAOYSA-N	426.520	1.879	50	20	IDGD	
CO[C@H]1C[C@H](c2ccccc2)CCC1=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O	814785234	OCFKFPKSZJOTAO-ZBFHGGJFSA-N	431.518	1.026	50	20	IDGD	
CC1(C)C(=O)Nc2cc(C(=O)OCC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)ccc21	815410878	ULYMSFYMJANIPT-UHFFFAOYSA-N	426.385	1.443	50	20	IDGD	
COCc1cc(NC(=O)C(=O)NNC(=O)CSc2ccc(C)cc2)cc(C(=O)OC)c1	815567191	QYIKUDWUMLDZLT-UHFFFAOYSA-N	445.497	1.806	50	20	IDGD	
O=C(NNC(=O)C1CCCC1)C(=O)Nc1ccc([N+](=O)[O-])c(I)c1	815567842	NRBPDGJJFDBNCU-UHFFFAOYSA-N	446.201	1.476	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CS[C@@H](Cc2ccccc2F)C(=O)N1)c1ccc2c(c1)OCCO2	900255577	LJQQNTJGCFSHTJ-YJBOKZPZSA-N	445.472	1.201	50	20	IDGD	
NC(=O)CSc1ccccc1NC(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	915931159	IFZWWIULILCHCC-UHFFFAOYSA-N	426.458	1.622	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)c1cc(Cl)c(-n2cnnn2)cc1OC	916032584	BTKQMVBVIXMNGA-UHFFFAOYSA-N	446.851	1.563	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)CCCn2cnc3ccccc32)c1	916095186	QDGSINWBLWYYMQ-UHFFFAOYSA-N	429.502	1.528	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)CS(=O)(=O)Cc1ccc(C#N)cc1	916132547	FIRMSGWRVSMKEP-UHFFFAOYSA-N	439.497	1.233	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NC2CCN(CC(C)C)CC2)nc1	916250828	YYCMJGJGEZLJQQ-UHFFFAOYSA-N	426.587	1.859	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCc2csc(C)n2)c1	916254708	KNSJJHNFVYEGIQ-UHFFFAOYSA-N	439.563	1.669	50	20	IDGD	
CC(=NNC(=O)Cn1cnc2ccccc21)c1ccc(S(=O)(=O)N2CCNCC2)cc1	916274687	ZHOSYNRBDQNSGS-UHFFFAOYSA-N	440.529	1.171	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NC[C@H](C)N(C)c1ccccc1	916452376	ZFPBNAXIPSTIQQ-AWEZNQCLSA-N	432.550	1.757	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)[C@@H]2Cc3ccccc3C(=O)O2)cc1	916550499	KRRDMSOIEFTZOV-KRWDZBQOSA-N	437.481	1.650	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H](CC(C)C)N2C(=O)[C@H]3CC=CC[C@H]3C2=O)cc1	916830419	WRMOHPOWPTWAKV-KSZLIROESA-N	440.500	1.447	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NN=Cc2c(C)nn([C@H]3CCS(=O)(=O)C3)c2Cl)cc1	917031500	KYVIBIYKWXWQGX-AWEZNQCLSA-N	437.909	1.602	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCC(NC(=O)OC(C)(C)C)CC2)cc1OC	917126937	TXOMCYKUBVMMQW-UHFFFAOYSA-N	436.509	1.454	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1n[nH]c(C)c1Br	917501253	LQXBDRKSLDASMD-UHFFFAOYSA-N	429.300	1.157	50	20	IDGD	
Cc1cc(NC(=O)CN2CCN(S(=O)(=O)c3ccc(CCCl)cc3)CC2)no1	917868857	JRKBTOPYZCBNKM-UHFFFAOYSA-N	426.926	1.709	50	20	IDGD	
CCNC(=O)COc1cccc(CNC(=O)NNC(=O)Cc2nc3ccccc3n2C)c1	918091086	OIMQEGMWBHNICZ-UHFFFAOYSA-N	438.488	1.161	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)NNC(=O)c1ccc(Br)s1	918778809	RWDDCUQSXANTOF-UHFFFAOYSA-N	441.263	1.571	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)N3CCC[C@@H](CNS(C)(=O)=O)C3)cc2C1	918779517	YAXJLGWAXRIYNV-OLZOCXBDSA-N	428.580	1.489	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)[C@@H]2CCN(c3ccc(Cl)cc3)C2=O)nc2ccccc21	919690367	RYEOCCFVTBYRIP-HNNXBMFYSA-N	425.876	1.970	50	20	IDGD	
CSCC[C@@H](NC(=O)c1ccc([N+](=O)[O-])o1)C(=O)NNC(=O)c1ccc(Cl)nc1	919814740	OUFRIMQWOAZIKH-SNVBAGLBSA-N	441.853	1.549	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@H](C)CN2C[C@H](C)C[C@@H](C)C2)c2ccccc2c1=O	919924584	OMUCUYZLUITPFA-BZUAXINKSA-N	428.537	1.727	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)C2(c3cccc(F)c3)CCOCC2)c1	919971640	MACNWISJGFKFFO-UHFFFAOYSA-N	449.504	1.585	50	20	IDGD	
O=C(NNC(=O)c1sccc1S(=O)(=O)N1CCSCC1)NC1CCCCC1	921299193	JWCMAGBUISTWMM-UHFFFAOYSA-N	432.593	1.762	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)[C@H]2CSCN2C(=O)C(C)(C)C)CC1	1116083764	LCOVVSYZNRYXKO-CQSZACIVSA-N	442.582	1.729	50	20	IDGD	
Cn1nc(C(C)(C)C)cc1NC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	1254683984	BJOHFYRIPWCFGA-UHFFFAOYSA-N	448.549	1.969	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)N[C@@H]2CCN(c3cnn(C)c3)C2)c1	1318625225	AKJGZGHOEUQVQN-LLVKDONJSA-N	437.298	1.414	50	20	IDGD	
CC(C)C[C@H](C(=O)NNC(=O)c1cncn1-c1ccccc1)N1C(=O)[C@@H]2CC=CC[C@H]2C1=O	1321490779	ALZWAPZQAVJALS-GUDVDZBRSA-N	449.511	1.999	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2)[C@H](F)Cl	1778028179	SGNHPBXCQSWVOY-SNCOMPKDSA-N	442.871	1.865	50	20	IDGD	
CN1CCC[C@@H](C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)CCBr)C3)C1	1780573380	YODCGTZCGRBQPV-GPMSIDNRSA-N	430.387	1.627	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)CC34CCCN3CCC4)C2)C1	1781134090	CWUJJOSVLRKJDI-DNVCBOLYSA-N	428.371	1.618	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(N4CCOCC4)cn3)CCO2)C1	1781213631	LFKYCLVJAUBHTM-LAUBAEHRSA-N	436.940	1.379	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccccc3C(N)=O)C2)C1	1781761324	FCBKZYSCCUYWQQ-DNVCBOLYSA-N	438.322	1.403	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(N(C)C)nc1)C2	1782173439	BABMMESZLGWEAR-CBGDNZLLSA-N	438.956	1.529	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C=N/N1CCCCC1)C2	1782175314	GVAPYRLNNCNRIN-BZLZVXNVSA-N	428.961	1.226	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc3c(c1)CC(=O)N3)C2	1782175987	TXIVTIUOUGCKLC-RADWXHQJSA-N	449.935	1.563	50	20	IDGD	
CCN(CC)[C@H](C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2)c1ccccc1	1782813118	PCGWWHJCBYUNGH-IPJJNNNSSA-N	437.968	1.499	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@@]2(CN(C(=O)Cc3cnc[nH]3)CCO2)C1	1782865998	GJUGOMVMDYQPDD-QESPPMFYSA-N	441.438	1.667	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)CSCc3[nH]cnc3C)CCO2)C1	1783877923	RZRKWQDEWXZAOR-KSSFIOAISA-N	430.958	1.035	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(C)ccc3-n3ccnn3)CCO2)C1	1783883969	XIMCVLLJASVFOZ-UWJYYQICSA-N	447.923	1.273	50	20	IDGD	
CC(C)(C)OC(=O)CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21	1784781099	NDWWENXAPADSKX-JUFZMCDQSA-N	437.306	1.388	50	20	IDGD	
Cn1cc(C(=O)Nc2ccc(C3(NC(=O)c4cnccc4C(=O)NN)CCC3)cc2)cn1	1787379507	DIXSMDPLKRMQGY-UHFFFAOYSA-N	433.472	1.480	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc4ccccn4n3)[C@H]2C1	1787846358	OSMLBHREVFYZHC-RMRKRWHISA-N	435.322	1.711	50	20	IDGD	
C[C@@H]1CCc2c(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)CO[Si](C)(C)C)C[C@@H]43)n[nH]c21	1787953355	UCCUGQRWGPRRKO-OHFALNGGSA-N	434.613	1.904	50	20	IDGD	
CN[C@H](CC(=O)Nc1ccc(C2(NC(=O)[C@@H](F)Br)CCC2)cc1)C(=O)O	1788063906	CQIDHUZTJWOLOU-TZMCWYRMSA-N	430.274	1.874	50	20	IDGD	
CC(C)N[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]2C1)C(C)C	1788765254	WMVXIJRHPYWNOZ-JPLJXNOCSA-N	427.662	1.840	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)[C@@H](F)Br	1789922663	NOTYOBLKVXCGTG-QFOLPQNPSA-N	430.112	1.442	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4ccnn4c3)C[C@@H]21)[C@H](F)Br	1789924907	GZZNIDSJEGNRCZ-TUUVXOQKSA-N	439.285	1.618	50	20	IDGD	
CN(CC(=O)NC1(c2ccc(NC(=O)[C@H](F)Br)cc2)CCC1)C(=O)C(=O)O	1790536192	HOKDGOCPAWJAKH-ZDUSSCGKSA-N	444.257	1.354	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CNC(=O)OC(C)(C)C)[C@H]2C1	1790987190	MLSJWUDOQHLGRC-JONQDZQNSA-N	431.961	1.898	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)N3C[C@H]4C[C@H]4C3)C[C@@H]21	1791056393	WKLVBHVIQMUFQI-XAMOXFFSSA-N	428.371	1.090	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]2C1	1791063643	OMJZYTZUIPVQCG-SJHCENCUSA-N	440.176	1.923	50	20	IDGD	
CC(=O)c1cc(C(=O)NC2(c3ccc(NC(=O)CCC(=O)NN(C)C)cc3)CCC2)n[nH]1	1791599184	CIHVISVXYIGSSW-UHFFFAOYSA-N	440.504	1.733	50	20	IDGD	
O=C(CC[C@H]1CCOC1)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1	1792021430	LHKGHZGFEXNLDD-KRWDZBQOSA-N	436.317	1.931	50	20	IDGD	
CN(C)C(=O)c1cccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)C(Cl)Cl)C[C@@H]32)c1	1792101448	YTDOYVBNMUSXNW-JYJNAYRXSA-N	442.343	1.785	50	20	IDGD	
Cc1noc(-c2ccccc2)c1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](O)CCl	1792978416	UROJTKILATXRNY-DFGXFYAUSA-N	433.892	1.453	50	20	IDGD	
COc1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](O)CCl)cc(C(F)(F)F)n1	1793113160	DARDNOPVLNMSMY-RNJOBUHISA-N	435.830	1.961	50	20	IDGD	
CC[C@H](C)[C@@H](O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)C2	1793398810	CMGDSCSLMYAOOO-PFDWVEPPSA-N	447.482	1.868	50	20	IDGD	
COC(=O)[C@H]1CC[C@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Br)C3)CC1	1793609084	SJMSJDKMWIBTDO-PLJUSGQGSA-N	449.317	1.246	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc[nH]n1)C2	1794141431	KPUNJDHABTZRFI-XFMPKHEZSA-N	425.917	1.794	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)[C@@H]1C[C@H]1c1ccc(Cl)cc1	1797189783	UZFLAJASROEGCZ-NLHADHJGSA-N	427.328	1.633	50	20	IDGD	
Cc1c[nH]c(C)c1CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Br	1799343375	UDYNLDKZPITXDW-DLTLXFJOSA-N	430.318	1.844	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccnc(OC)c1F)C2	1800639690	MDBPQAGGOSQLOC-WJNVRWDZSA-N	444.301	1.606	50	20	IDGD	
COc1cc(C)cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)Br)c1	1800759709	DBJQCYCWUSPRAJ-JJAZEVLHSA-N	425.323	1.990	50	20	IDGD	
C=CCCc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](Cl)COC)c(O)n1	1800974330	SSZASQGNUGQCQC-LTCOOKNTSA-N	437.924	1.363	50	20	IDGD	
C[C@H](CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCC(=O)NN(C)C)Oc1ccccc1	1802338644	VNGHZVQNUBZCTJ-AKHDSKFASA-N	430.549	1.855	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cnc3ccccc3n2)[C@@H]1c1cccnc1)[C@H](O)CCl	1803139249	MYEBTVZQGJEKMN-CWFSZBLJSA-N	439.903	1.944	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)n(C(F)F)n1	1803142529	ZISNQHXZSGIIMA-BMFZPTHFSA-N	441.866	1.901	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)CN2CCN(C)CC2)[C@@H]1c1cccnc1	1803692959	BETQONGQXILHSJ-SVFBPWRDSA-N	436.000	1.742	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC2(CCCN(C(=O)[C@@H]3C[C@H]3C3CC3)C2)CC1	1805360336	RWRZCQBUQNXPCW-ZWKOTPCHSA-N	425.533	1.576	50	20	IDGD	
Cn1nc(C(=O)N2CC[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]2c2cccnc2)cc1O	1810538911	AXCPBOAJVZFJLD-HNAYVOBHSA-N	431.569	1.692	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1ccc(O)cc1	1811932698	MVHKELGBZKPWBG-UGKGYDQZSA-N	445.284	1.100	50	20	IDGD	
C=CCC(F)(F)C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1812671446	GDYCKRDRKKVCCO-LPHOPBHVSA-N	437.491	1.672	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)NC=O)[C@@H]1c1cccnc1	1812776770	IDLVSQIHINGJKK-SYAUCNOPSA-N	425.327	1.395	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)cn1	1813069789	BWOZHIAHYPODNA-GCJKJVERSA-N	438.532	1.478	50	20	IDGD	
CC1=C(C(=O)N2CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)CCO1	1813069873	AKQPSPMFBKJFKB-UWJYYQICSA-N	429.521	1.155	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@H]1CCc2nc(NC(=O)CN3CCOCC3)sc2C1	1814557312	BFDQRZSTOMTFDP-NEPJUHHUSA-N	445.383	1.418	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](O)CCl)n[nH]1	1814875678	GPGSNCLAIHPIBR-KBPBESRZSA-N	443.932	1.916	50	20	IDGD	
CC1(C(=O)N[C@@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)CCCC1	1815335584	GMBDAJCXUIJAGL-OAHLLOKOSA-N	427.335	1.629	50	20	IDGD	
O=C(/C=C/c1ccccc1)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1	1815355146	PHFHHPZSZJPSTA-PEKVBPLLSA-N	447.325	1.762	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2nc(C)c(C)[nH]c2=O)n[nH]1	1816116078	ZJWRARBNFCFCKO-TZMCWYRMSA-N	436.900	1.670	50	20	IDGD	
O=C(N[C@@H]1CCc2nc(NC(=O)[C@H](F)Cl)sc2C1)c1cc(=O)nc2cccnn12	1817128819	QVUDKKKRZKWMHG-CLAHSXSESA-N	436.856	1.306	50	20	IDGD	
CN1CCC[C@H](C(=O)Nc2cc([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)C1	1820727930	GSTSILRXSRULQT-RDJZCZTQSA-N	433.557	1.117	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(C=O)s2)[nH]n1	1822413975	JNCBQRXUPSUVAV-HNNXBMFYSA-N	446.533	1.963	50	20	IDGD	
CS(=O)(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](F)Br)[nH]n1	1822973134	UPMAYBHZGBZPJY-GWCFXTLKSA-N	439.307	1.527	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1nccc3nc[nH]c13)CC2	1825998871	NWVNMTVHNPDCSE-ZJUUUORDSA-N	434.909	1.894	50	20	IDGD	
Cc1ccn(C)c1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827052531	MZTDRIGWMSZCHQ-OAQYLSRUSA-N	437.349	1.560	50	20	IDGD	
C[C@]1(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)CC1(F)F	1827060034	MSKVPURHPQYQCY-WIYYLYMNSA-N	434.292	1.645	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc3n(n2)CCC3)CC1	1828691097	JJKSOODSXPPQMK-HXUWFJFHSA-N	444.580	1.436	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCCn3ccnc3)C2)C1	1831656397	FCCIMGVQEPFRIZ-FXAWDEMLSA-N	426.945	1.527	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cn3nnc4ccccc43)CCO2)C1	1832199011	PWNYJJCQUOOHIX-IIBYNOLFSA-N	449.939	1.295	50	20	IDGD	
CC(C)N[C@H](C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)CCl)CC2)CC1)C(C)C	1833310801	SYMITLZXSUUPLY-MOPGFXCFSA-N	431.021	1.180	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)C[C@H]3C[C@@H]4CC[C@H]3C4)CC2)CC1)[C@H](O)CCl	1833311889	GRYALZLAOIPLRH-AXVVYFOYSA-N	426.001	1.984	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnc(OCC)cn3)CCO2)C1	1833430069	OXWKOOHMJNXQAD-YWZLYKJASA-N	440.928	1.353	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)c3ccncc3F)C2)C1	1834821674	TUOYZUREVUUBSK-KRWDZBQOSA-N	430.274	1.076	50	20	IDGD	
Cc1nc(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)sc1C	1836072595	GFAPKOMUIYUNDT-INIZCTEOSA-N	428.986	1.545	50	20	IDGD	
CC1=C(C(=O)N2CCC(N3CCC(NC(=O)[C@H](F)Br)CC3)CC2)CCO1	1836412256	AWTCIXLURXVHCL-INIZCTEOSA-N	432.334	1.943	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cc(O)ncn3)CC2)CC1)[C@H](F)Br	1836413774	PISKLWTWLLTBFB-HNNXBMFYSA-N	444.305	1.058	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)C3=COCCC3)CC2)CC1)[C@@H](F)Br	1836414571	RJGCTMFNJBJBDJ-MRXNPFEDSA-N	432.334	1.943	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836719490	UEXCIXXTXOBAAE-CJNGLKHVSA-N	434.917	1.146	50	20	IDGD	
CCc1nc(C(=O)N2CCO[C@]3(COCCN(C(=O)CCBr)C3)C2)co1	1838132621	JOKAIEQCDFDXRF-KRWDZBQOSA-N	430.299	1.092	50	20	IDGD	
CC(C)c1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)CCBr)C3)C2)n[nH]1	1838695102	DJTRLHKDNIGIEF-SFHVURJKSA-N	443.342	1.388	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)C3CCC(O)CC3)CC2)CC1	1838785453	GGYREHNVTANDPK-LADRWXRNSA-N	430.973	1.790	50	20	IDGD	
Cc1cncc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)c1	1839151009	FKAGBDPZGDDAIA-OALUTQOASA-N	430.332	1.696	50	20	IDGD	
Cc1noc(C)c1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2	1839151423	QWGPICPTOHBXDV-ZWKOTPCHSA-N	434.320	1.598	50	20	IDGD	
CC(C)=NO[C@H](C)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2	1839154193	GBYHMWYFTXCWBC-ZTFGCOKTSA-N	438.352	1.480	50	20	IDGD	
O=C(CCC(F)(F)F)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839199484	ORNLVZWUYXSFLW-YPMHNXCESA-N	435.212	1.476	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(O)cn3)C2)C1	1839963722	UBMCNQYWAZNVRG-KDOFPFPSSA-N	442.310	1.031	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3CCSCC3)C2)C1	1839967300	IDRKEZBNLMMWJE-MAUKXSAKSA-N	449.411	1.760	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)C[C@H]3C[C@@H]4CC[C@H]3C4)C2)C1	1840155407	BCDBOXWKNKITPD-ATOXUGOLSA-N	428.957	1.523	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C1(C#N)CCC1)CCO2	1840812483	UJHQRPSBSDYATN-KBXCAEBGSA-N	428.327	1.168	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC12CN(C(=O)C1(N3CCN(C)CC3)CC1)C2	1841288139	CINHXTVLMBFVAG-OAHLLOKOSA-N	427.387	1.001	50	20	IDGD	
Cn1cnc(C(=O)N2CCCC23CN(C(=O)[C@@H](F)Br)C3)c1C(F)(F)F	1843520106	YEQVLMDIUVIAEY-SNVBAGLBSA-N	427.196	1.946	50	20	IDGD	
O=C([C@@H](F)Br)N1CC2(CCCN2C(=O)c2cccc(N3CCOCC3)n2)C1	1843528125	BRNSUEJAOMKCPJ-OAHLLOKOSA-N	441.301	1.426	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)Cc2ccc3c(c2)CCCO3)C1	1843918963	AJBUBJOSTPOYDG-UHFFFAOYSA-N	449.511	1.070	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1scnc1C1CC1)C2	1844263820	YMKYFINRPDEVFT-UHFFFAOYSA-N	426.502	1.150	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)c2n[nH]cc2I)C1	1844466541	HESYMPBZXMQKHJ-VIFPVBQESA-N	436.681	1.849	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)c2cc(Cl)sc2Cl)C1	1844565688	RHQMDBGZLHYYOJ-UHFFFAOYSA-N	439.129	1.866	50	20	IDGD	
O=C([C@@H](F)Br)N1CC2(CCCN2C(=O)[C@H]2C[C@@]23C(=O)Nc2ccccc23)C1	1846153631	BSDHORNTLGQKGS-TVZGQMOCSA-N	436.281	1.790	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@]2(C(=O)N3CC[C@H]4[C@@H]3CCN4C(=O)[C@@H](O)CCl)C[C@@H]2C1	1847563084	MINRKPCMHGXPEW-UITRFSOLSA-N	441.956	1.435	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H]2C[C@@]21C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl	1847563613	LENMHVRVNKMPIV-UEELHNSWSA-N	427.929	1.187	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc(Br)ccc1Br)c1cnccn1	23397819	QSFSRZDLAHONFW-UHFFFAOYSA-N	436.085	1.625	50	20	IDGD	
C[C@@H](SCC(=O)Nc1ccc(F)cc1)C(=O)NNC(=O)[C@@H]1COc2ccccc2O1	23712878	CVURKEQKTNKYST-PXAZEXFGSA-N	433.461	1.873	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)c1ccc2c(c1)CCN2S(C)(=O)=O	26792793	UWRUKZVDNRFHFJ-UHFFFAOYSA-N	441.513	1.382	50	20	IDGD	
O=C(CC[C@@H]1CCCO1)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	106011947	MWEPTWCIJPXWCE-SFHVURJKSA-N	431.514	1.885	50	20	IDGD	
O=C(O)COc1ccc(S(=O)(=O)NNC(=O)c2ccc3ccccc3n2)cc1Cl	109766081	AMUSKTMZGZEHCQ-UHFFFAOYSA-N	435.845	1.975	50	20	IDGD	
COc1ccc(OC)c(-n2nnnc2SCC(=O)NNC(=O)c2cccc(Cl)c2)c1	726432243	DVFIZBSMNUSYAY-UHFFFAOYSA-N	448.892	1.886	50	20	IDGD	
COc1ccc(CN2C[C@@H](C(=O)OCC(=O)NNC(=O)c3ccccc3)CC2=O)cc1	726681761	MWUFEGRILLDNEW-KRWDZBQOSA-N	425.441	1.048	50	20	IDGD	
CCOC(=O)N[C@@H](CNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)CC(C)C	728958929	HATSJXAOMZORMJ-MRXNPFEDSA-N	435.529	1.184	50	20	IDGD	
CC(C)(C)c1ccc(C(=O)NCC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1	728980757	FOCUHPQURLRCLG-UHFFFAOYSA-N	438.532	1.568	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)NCc1ccc(CN2CCC(O)CC2)cc1	729621378	KNUJHARLMVSDJN-UHFFFAOYSA-N	430.480	1.692	50	20	IDGD	
C=CCN1CCC(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(CC)CC)c2)CC1	730124970	JNJOEEJEWDPCGT-UHFFFAOYSA-N	437.566	1.312	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)CCCc2ccc3nc(O)[nH]c3c2)c1	730206532	QJSASWIDUBUMAX-UHFFFAOYSA-N	445.501	1.303	50	20	IDGD	
C[C@]1(c2ccccc2)NC(=O)N(CC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)C1=O	733110447	MJMQWEFNFFNXTE-JOCHJYFZSA-N	432.440	1.101	50	20	IDGD	
Cc1cc(NNC(=O)c2ccc(Cl)c(S(=O)(=O)N3C[C@H](C)O[C@H](C)C3)c2)ncn1	734256306	CUUIDGKAPHIKQI-BETUJISGSA-N	439.925	1.993	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)[C@H]2CC(=O)N(C(C)(C)C)C2)CC1	734826020	TVIQVLXVSMZKDA-ZDUSSCGKSA-N	425.530	1.363	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)c2cc3c(cc2[N+](=O)[O-])OCCO3)cc1C	736762041	NLBJQQIXILSNRA-UHFFFAOYSA-N	449.441	1.916	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)NCCCCN1CCN(C)CC1	737064115	CZYCVMKYVDDPSC-GOSISDBHSA-N	427.549	1.965	50	20	IDGD	
NC(=O)[C@H]1CCCN1Cc1cccc(NC(=O)NNC(=O)COCc2ccccc2)c1	738438936	BHYCJMOULBJKEG-LJQANCHMSA-N	425.489	1.506	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)NCCNC(=O)c1ccc(Br)cc1	738496863	BLXPZNLCVBZSHR-UHFFFAOYSA-N	449.305	1.726	50	20	IDGD	
Cc1cc(-n2cncn2)ccc1C(=O)NNC(=O)c1sc(N2CCOCC2)nc1C	742037549	YSACYQGQJBRIJR-UHFFFAOYSA-N	427.490	1.252	50	20	IDGD	
O=C(NNC(=O)[C@H](c1ccccc1F)N1CCOCC1)c1nnc(O)c2ccccc12	742474505	QUXGGARPBQFMNE-SFHVURJKSA-N	425.420	1.309	50	20	IDGD	
C[C@@H](CCN(C)C)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	744866392	TUUZUAXYHMKYFW-HNNXBMFYSA-N	425.555	1.145	50	20	IDGD	
CC(C)(C)c1ncc(/C=C/C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)s1	745682667	YOOKLBXRIHUJRS-FDMDGMSGSA-N	445.497	1.984	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)C1CCN(C(=O)/C=C/c2ccccc2)CC1	746547986	ATJJIZLCVQTOGF-MDZDMXLPSA-N	431.496	1.976	50	20	IDGD	
CC(=NNC(=O)c1ccc(C#N)cc1)c1ccc(S(=O)(=O)NCCCN(C)C)cc1	747049375	ODMZSTIGSIDDKA-UHFFFAOYSA-N	427.530	1.942	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(Cl)c(N3CCNC3=O)c2)cc1	747722842	NNEMMYNSGNCZED-UHFFFAOYSA-N	430.848	1.796	50	20	IDGD	
Cn1nc(Br)c2c(=O)n(CC(=O)NNc3cccc4cnccc34)cnc21	748769215	HHOVDEBPYPAPDB-UHFFFAOYSA-N	428.250	1.584	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN1C1CCCC1)c1cccc(S(=O)(=O)N2CCCC2)c1	749174572	AXCYXQMXIVPXGJ-IBGZPJMESA-N	434.562	1.639	50	20	IDGD	
O=C(Cn1cccc(C(F)(F)F)c1=O)NNc1nc(Br)cn2ccnc12	750250441	SOIDBJQULCVBGH-UHFFFAOYSA-N	431.172	1.816	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)[C@@H]2CCc3nnc(C)n3C2)c2ccccc2c1=O	750712848	BLYGQECDYSYAAF-OAHLLOKOSA-N	437.504	1.510	50	20	IDGD	
CCC1CCC2(CC1)NC(=O)N(CC(=O)NNC(=S)NCCc1cccs1)C2=O	753014367	GWDYKVWLJXCNJH-UHFFFAOYSA-N	437.591	1.677	50	20	IDGD	
CC[C@@H](NC(=O)NNC(=O)c1ccc(COc2ccccc2)o1)C(=O)N1CCOCC1	753057241	MAMCXILMXYGRHY-QGZVFWFLSA-N	430.461	1.440	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)N[C@@H]1[C@H]2CCO[C@@H]2C12CCCC2	755091734	VOMIDHZWQNFWTR-FCEUIQTBSA-N	441.576	1.877	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)Nc1ccc(F)c(S(=O)(=O)N2CCOCC2)c1	756031207	KHTHCDGYXDTWHK-UHFFFAOYSA-N	436.465	1.622	50	20	IDGD	
COc1ccccc1OCC(=O)Nc1cccc(NC(=O)NNC(=O)Cc2cc[nH]n2)c1	756098504	VYZARFYPSGTZKD-UHFFFAOYSA-N	438.444	1.831	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])ccc1N1C(=O)CCC1=O	756552017	BUOQDAXLRVUTKX-UHFFFAOYSA-N	441.400	1.788	50	20	IDGD	
CC(C)C[C@H](C(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)N1CCCCC1=O	756578390	SSMSQXKDOWYXNZ-MRXNPFEDSA-N	434.449	1.326	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)NNC(=O)Cc1ccc(F)cc1	756674167	JSTOOSIQGDTGQG-UHFFFAOYSA-N	438.481	1.870	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)Nc1ccc(F)c(-n2nnnc2C2CC2)c1	756777613	JVTWYEOTPZTERJ-KRWDZBQOSA-N	439.407	1.672	50	20	IDGD	
COc1ccccc1N1CC[C@@H](NC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])C1=O	757287248	RRWVMCQUNPCQMD-CYBMUJFWSA-N	443.416	1.118	50	20	IDGD	
CCOc1ccc(N2C(=O)c3ccc(C(=O)NNc4ccc(C(N)=O)nn4)cc3C2=O)cc1	757390118	ARXZWVZEDCHAPH-UHFFFAOYSA-N	446.423	1.532	50	20	IDGD	
COC(=O)c1c(F)cccc1S(=O)(=O)NNC(=O)c1cccc(Br)c1	757657048	RCVLXOGSWCNQQM-UHFFFAOYSA-N	431.239	1.998	50	20	IDGD	
Cn1ccnc(NC(=O)NNC(=O)c2nc(-c3ccccc3)n(-c3ccccc3)n2)c1=O	757907547	VXPAGZYDLXCAFY-UHFFFAOYSA-N	430.428	1.495	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2nnc(O)c3ccccc23)cnn1CCO[C@H]1CCCCO1	758072326	RRGNUGQTWIMSBC-KRWDZBQOSA-N	440.460	1.458	50	20	IDGD	
CN(C)[C@H](C(=O)N1CCN(S(=O)(=O)CBr)CC1)c1cccc(Cl)c1	758526981	DXEZJEWASJXHHV-AWEZNQCLSA-N	438.775	1.769	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)NC[C@@H]1CSCCN1Cc1ccccc1	759199782	DOANUUIDRGOXFN-LJQANCHMSA-N	438.557	1.825	50	20	IDGD	
COc1ccc(-c2nn(CCC#N)cc2/C=C(\C#N)C(=O)N(C)[C@H]2CCNC2=O)cc1OC	760103089	HTNYCEKPLDWNTL-FYXHJSOBSA-N	448.483	1.735	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNS(=O)(=O)c1cccc([N+](=O)[O-])c1C#N	760337880	ANRZITJXVBHVJJ-UHFFFAOYSA-N	428.224	1.191	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3ccc(-n4ccnn4)cc3)n[nH]2)cc1OC	760404879	YPZWBGFPRVKTHF-UHFFFAOYSA-N	433.428	1.749	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)c2ccc(OC)c(Cl)c2)c2ccccc2c1=O	760796956	BXHZANQCTZJFAZ-UHFFFAOYSA-N	428.832	1.722	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCCC(=O)NNc1nc(O)c2ccccc2n1	761097859	BFSVNVJCTJPECA-HNNXBMFYSA-N	444.492	1.684	50	20	IDGD	
COC(=O)N[C@@H](C)C(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	761221804	XEMIPFJWBOZDSR-JTQLQIEISA-N	426.476	1.054	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)NC1CCN([C@@H]2CCCC[C@H]2O)CC1	761743585	VRERHYNSBFYCES-IAGOWNOFSA-N	436.578	1.886	50	20	IDGD	
COC(=O)COc1ccc(S(=O)(=O)NNC(=O)CSc2ccccc2O)cc1	763411651	VXDRTCYKDCOMQS-UHFFFAOYSA-N	426.472	1.046	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3n2)c(F)cc1F	763449845	JVUODXWYYZHTKK-UHFFFAOYSA-N	428.351	1.699	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)C(=O)Nc1ccc2c(c1)CCC2	763532364	XIYJESBLVLPTNN-UHFFFAOYSA-N	435.528	1.474	50	20	IDGD	
C[C@@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3ccc4c(c3)OCO4)cc2)CCO1	763552061	WBAWULDAWDHTSU-CYBMUJFWSA-N	426.429	1.040	50	20	IDGD	
Cc1nn(-c2ccccc2)cc1NC(=O)C(=O)NNC(=O)COc1ccccc1[N+](=O)[O-]	763807460	CDAXQFFNQUZTQY-UHFFFAOYSA-N	438.400	1.254	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(OCC(F)(F)F)nc1	763807673	FBPLYWNCSMQZAL-UHFFFAOYSA-N	437.334	1.059	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(C2CC2)nn1-c1ccccc1	763808425	VYDCYFBYWUSOOM-UHFFFAOYSA-N	444.451	1.786	50	20	IDGD	
CCS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)cc1	763852439	WANXGMASCNFKDV-OAHLLOKOSA-N	447.513	1.650	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(C)n(-c3ccccc3)n2)cc1OC	763900109	ALGJQEZERWFZKR-UHFFFAOYSA-N	437.456	1.988	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc([C@@H](C)N2CCOCC2)cc1	764048310	OIOOCDUHKUDBGI-OAHLLOKOSA-N	426.473	1.488	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(N3CCOC[C@@H]3C)cc2)c1O	764132088	JJCAMHGBHGHAMO-ZDUSSCGKSA-N	428.445	1.026	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccccc1-c1nncn1C(C)C	764133678	YYHDPQVIVOAUCC-UHFFFAOYSA-N	436.472	1.863	50	20	IDGD	
CN1CCN(Cc2cccc(NC(=O)C(=O)NNC(=O)CCC3CCCCC3)c2)CC1	764215469	TZPYJNVJBDTMBI-UHFFFAOYSA-N	429.565	1.880	50	20	IDGD	
O=C(NNC(=O)c1cccc(OC(F)F)c1)C(=O)Nc1ccc(CN2CCOC2=O)cc1	764251222	RNNTWEJGKAFOJD-UHFFFAOYSA-N	448.382	1.640	50	20	IDGD	
C[C@@H](NC(=O)OC(C)(C)C)c1ccc(NC(=O)C(=O)NNC(=O)Cc2cccnc2)cc1	764268379	KXTHSVNKUHOSHR-CQSZACIVSA-N	441.488	1.996	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)ccc1O)C(=O)Nc1c[nH]nc1-c1ccccn1	764279707	CZVPRIKVWVQVSI-UHFFFAOYSA-N	445.233	1.340	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)C(=O)Nc1ccc(-n2cccn2)c(F)c1	764343671	VDMWETOFACGPKW-UHFFFAOYSA-N	433.403	1.597	50	20	IDGD	
O=C(NNC(=O)C(F)(F)Oc1ccccc1)C(=O)Nc1cnn(Cc2ccccc2)c1	764369753	JCOBUGHLPJFIER-UHFFFAOYSA-N	429.383	1.689	50	20	IDGD	
CS(=O)(=O)NCCc1ccc(C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)cc1	765567536	HIWZTWUZOQWVRY-UHFFFAOYSA-N	433.515	1.305	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)[C@H]2CC(=O)N(c3ccccc3OC)C2)n[nH]1	765593228	UYJPNUXBACNAIQ-AWEZNQCLSA-N	449.467	1.908	50	20	IDGD	
COC(=O)[C@H]1CCC[C@@H](C(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)C1	766642412	HODHNXXDBRSTST-UXHICEINSA-N	430.549	1.239	50	20	IDGD	
CCC1(CC)[C@@H](OC)C[C@H]1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	767162675	YHPKFUKOKNVUNI-CVEARBPZSA-N	426.539	1.475	50	20	IDGD	
COC(=O)c1cc(C(=O)OCC(=O)NNC(=O)Cc2ccccc2C)cc([N+](=O)[O-])c1	767255787	DKTVDPKVUWVVEJ-UHFFFAOYSA-N	429.385	1.237	50	20	IDGD	
Cn1c(N)c(C(=O)/C(C#N)=C\c2ccc(Br)cc2[N+](=O)[O-])c(=O)n(C)c1=O	767717408	LWYOHZFYZYXFLN-UITAMQMPSA-N	434.206	1.127	50	20	IDGD	
C[C@H](C(=O)NNc1ccc(S(=O)(=O)C(F)F)cc1)S(=O)(=O)C1CCOCC1	767956868	BWZPEOSLCYRHGW-SNVBAGLBSA-N	426.463	1.108	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)[C@@H]3CC(=O)N(CC(C)C)C3)n[nH]2)cc1OC	768275299	AKZLKUWRFWSKRW-CQSZACIVSA-N	429.477	1.359	50	20	IDGD	
COc1cc(O)c(C=NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc1OC	768350657	UNACPAZZVUAVHJ-UHFFFAOYSA-N	433.486	1.958	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)c1ccc(F)c(NS(C)(=O)=O)c1	768645983	WHIPGVJNQORMHJ-UHFFFAOYSA-N	431.467	1.366	50	20	IDGD	
Cc1cnn(Cc2ccccc2F)c1NC(=O)C(=O)NNC(=O)c1c(C)nc2ccccn12	769252831	JJDCIXUYVKAZGJ-UHFFFAOYSA-N	449.446	1.735	50	20	IDGD	
CCOC(=O)c1cnn2c(C(=O)OCC(=O)NNC(=O)c3cccc(Cl)c3)ccnc12	769857427	KRWRRBHYGKWWCC-UHFFFAOYSA-N	445.819	1.177	50	20	IDGD	
N#Cc1ccc(N2CCN(CC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)CC2)c(Cl)c1	769921724	UHECDTSRIIITLQ-UHFFFAOYSA-N	442.863	1.703	50	20	IDGD	
CSCCNC(=S)NNC(=O)[C@@H]1CCCN1C(=O)Nc1ccc2c(c1)OCCO2	770248862	VDNFJYUXLBAWHS-ZDUSSCGKSA-N	439.563	1.312	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)c1cc(-c2ccc3c(c2)CCO3)no1	771496012	VJZHQHHLDRFZED-UHFFFAOYSA-N	431.449	1.745	50	20	IDGD	
CN(CCNC(=O)NNC(=O)c1cccc(OC(F)F)c1)S(=O)(=O)c1cccs1	771981353	VGRCXCXCJVPYJA-UHFFFAOYSA-N	448.473	1.614	50	20	IDGD	
COc1cc(C(=O)NNC(=O)N[C@H]2CC(=O)N(C3CCCCC3)C2)cc(OC)c1OC	772550706	RFMZKYFIJYQKFF-AWEZNQCLSA-N	434.493	1.590	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)[C@@H](C(C)C)N2CCCS2(=O)=O)c1	772696091	ZFLBQLPQILPSJS-CQSZACIVSA-N	448.339	1.279	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)c1cnc(O)c(Br)c1	772888107	FTBARIOEYSKFIG-UHFFFAOYSA-N	427.642	1.281	50	20	IDGD	
Cn1cc(NC(=O)C(=O)NNC(=O)CSc2ccc(Cl)cc2)c(C(F)(F)F)n1	773524137	MDVAVUMAULJMDB-UHFFFAOYSA-N	435.815	1.971	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(C(F)(F)F)cn2)cc1	773531311	YQVSOZZTHOFUOT-LLVKDONJSA-N	438.362	1.856	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNc2ccccc2[N+](=O)[O-])cc1OC	773650385	JIIWCOBWROYGGD-UHFFFAOYSA-N	437.434	1.447	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2ccc(CC(=O)N(C)c3ccccc3)cc2)n1	773731850	WRSKAUHDKGOGBB-UHFFFAOYSA-N	434.456	1.773	50	20	IDGD	
C[C@]1(NNC(=O)NCc2cnn(-c3ccc(Br)cc3)c2)CCS(=O)(=O)C1	775205818	ISFISTVVVUXIJH-INIZCTEOSA-N	442.339	1.516	50	20	IDGD	
COc1cc(C(=O)NCC(=O)NNc2ccc(C(F)(F)F)cn2)cc(OC)c1OC	775264281	JDGRDWUZHJPHGS-UHFFFAOYSA-N	428.367	1.999	50	20	IDGD	
CCc1ccccc1S(=O)(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	777597090	MBOAPARPQJHFSR-UHFFFAOYSA-N	437.543	1.657	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3cnc(C(F)(F)F)nc3)n[nH]2)cc1OC	777812558	HKPDAXSACZEBER-UHFFFAOYSA-N	436.350	1.978	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)c1ccc(CNC(=O)c2cccs2)cc1	778433836	TXAOLNZGKJQLEA-UHFFFAOYSA-N	432.502	1.964	50	20	IDGD	
COCCCN1C(=O)C(=NNC(=O)NCC(=O)OC)c2cc(Br)ccc21	779820580	GAXYUPXWBCNILE-UHFFFAOYSA-N	427.255	1.009	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)C2CCN(S(=O)(=O)c3ccc(C#N)cc3)CC2)c1	780789886	LUNDCGYUIZKBCN-UHFFFAOYSA-N	442.497	1.889	50	20	IDGD	
COc1ccc(Cn2ncc(C)c2NC(=O)C(=O)NNc2cncc(Cl)n2)cc1OC	783259758	LTKXJNOTQVOUES-UHFFFAOYSA-N	445.867	1.782	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ccc(OCC(F)(F)F)cc2)cc1-n1cnnn1	784370003	CCHACEGFHVMGEL-UHFFFAOYSA-N	435.366	1.994	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNc2ccccn2)c(C(=O)N2CCCCC2)cc1OC	784797081	RZFZDJXDUNWHQK-UHFFFAOYSA-N	427.461	1.807	50	20	IDGD	
CCOC(=O)N(C)c1ccc(NC(=O)C(=O)NNc2cccc(S(C)(=O)=O)c2)cc1	784840867	FXUDCQLSBIXTQR-UHFFFAOYSA-N	434.474	1.765	50	20	IDGD	
CNC(=O)Cn1cc(NC(=O)C(=O)NNc2ccc(Br)cc2Cl)cn1	784841162	LVSFAGUKXNBXQV-UHFFFAOYSA-N	429.662	1.127	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(OC(F)F)c2)cc1N1CCNC1=O	787542813	RPYWUAPOIKHSJI-UHFFFAOYSA-N	447.398	1.526	50	20	IDGD	
COc1cc(NNC(=O)C(=O)Nc2cc(Br)c(=O)n(C)c2)ccc1Cl	789796313	RVTUGOQHJNAMLR-UHFFFAOYSA-N	429.658	1.892	50	20	IDGD	
CC(C)c1ccc(-n2cnnc2SCC(=O)N([C@@H]2CCS(=O)(=O)C2)N(C)C)cc1	792853460	DTFGJLUCUWFQKT-QGZVFWFLSA-N	437.591	1.975	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(-n3ccc(C)n3)cc2)cc1	793021809	KGXCSIYLBSHDBP-MRXNPFEDSA-N	449.467	1.937	50	20	IDGD	
Cc1oc(C(C)C)nc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	794741926	QFOPERRVFIMNKL-UHFFFAOYSA-N	436.490	1.202	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN2CCn3c(Br)cnc3C2)cc1C	796049951	ZPLFCTHEALFHSL-UHFFFAOYSA-N	426.340	1.855	50	20	IDGD	
NS(=O)(=O)c1ccc(CC(=O)NNC(=O)Nc2ccc(Br)cc2)s1	801994783	KFDPEKHPEXKFKY-UHFFFAOYSA-N	433.309	1.553	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)NNC(=O)Nc2ccc(Br)cc2)ccc1F	801995420	JKHWTBFNHJWHJR-UHFFFAOYSA-N	445.270	1.963	50	20	IDGD	
COc1ccc(Cl)c(NC(=O)NNC(=O)CNC(=O)CNC(=O)OC(C)(C)C)c1	802113494	SXLKKATYNGKPBX-UHFFFAOYSA-N	429.861	1.142	50	20	IDGD	
Cc1cc([N+](=O)[O-])cc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1F	803457320	DUUMBSRBCHLASG-OAHLLOKOSA-N	433.348	1.187	50	20	IDGD	
COc1ccc(CS(C)(=O)=O)cc1NC(=O)C(=O)NNc1ccc(F)c(F)c1F	806967940	SGOVTEAOWXBWAM-UHFFFAOYSA-N	431.392	1.739	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(NC(=O)CN(CC)CC)c2)cc1	806974418	KKPGZZMWGQYADK-UHFFFAOYSA-N	439.516	1.929	50	20	IDGD	
O=C(NNc1cccc(F)n1)C(=O)N1CCc2cc(S(=O)(=O)N3CCCCC3)ccc21	807392664	GMEXCJFVISNLHC-UHFFFAOYSA-N	447.492	1.428	50	20	IDGD	
C[C@@H]1CN(c2ccccc2NC(=O)C(=O)NNc2ccc(-n3ccnc3)nn2)C[C@@H](C)O1	807429034	OFZBMWZMWDQXDB-HUUCEWRRSA-N	436.476	1.358	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@H](C)C(=O)NN=Cc1c(N(C)C)n(C)c(=O)n(C)c1=O	807954792	DBWOWQRNPLHVAH-CYBMUJFWSA-N	435.912	1.338	50	20	IDGD	
Cc1cc(C(F)(F)F)ncc1NC(=O)C(=O)NNC(=O)COc1ccccc1[N+](=O)[O-]	810386352	WDFXJENZZLIJHK-UHFFFAOYSA-N	441.322	1.482	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)ccc1O)C(=O)N1CCN(c2ccccc2)CC1	812522792	GQNVGTIACFELKJ-UHFFFAOYSA-N	447.289	1.265	50	20	IDGD	
COc1ccc(CN2C[C@@H](C(=O)NNc3ccc(S(=O)(=O)N(C)C)cc3)CC2=O)cc1	812728936	FRNGHJQMDXVSPM-INIZCTEOSA-N	446.529	1.437	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C2CCN(C(=O)c3cccnc3)CC2)cc1	812729718	RVXJTCHCXIROPZ-UHFFFAOYSA-N	431.518	1.327	50	20	IDGD	
Cc1ccc(NNC(=O)C(=O)Nc2ccc([N+](=O)[O-])c(I)c2)nc1	815590740	HDFCBDFRTVTYCU-UHFFFAOYSA-N	441.185	1.985	50	20	IDGD	
CC(C)(C)c1nc2cc(NC(=O)C(=O)NNC(=O)[C@@H]3CCc4nncn4C3)ccc2o1	815692368	POAYLDYDCKLCCI-LLVKDONJSA-N	425.449	1.065	50	20	IDGD	
CC(C)[C@@H](C(=O)NNc1ccccc1S(=O)(=O)N(C)C)n1nnc(-c2ccccc2)n1	817054257	AUTWWRFQSKFRMH-SFHVURJKSA-N	443.533	1.931	50	20	IDGD	
O=C(CCc1nc(O)c2c3c(sc2n1)CCC3)NNC(=O)[C@@H]1COc2ccccc2O1	821955607	YUTAPYMQQATZSH-AWEZNQCLSA-N	440.481	1.806	50	20	IDGD	
O=C(CNc1ccccc1)NNC(=O)C1CCN(C2=NS(=O)(=O)c3ccccc32)CC1	823327724	BUGYBIDRLSCEOR-UHFFFAOYSA-N	441.513	1.107	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)CN1C(=O)N[C@@](C)(c2ccc(C)cc2)C1=O	825615421	VUICFTBRTYKCHL-QFIPXVFZSA-N	439.472	1.030	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)CSc2nnnn2C2CCCC2)c2ccccc2c1=O	906487257	SPWCYHDGMDYGNP-UHFFFAOYSA-N	442.505	1.071	50	20	IDGD	
COCCN1C[C@@H](C(=O)NNC(=O)CCCOc2ccc(Cl)cc2Cl)CC1=O	914458579	FYYWWJKPIWKGPM-LBPRGKRZSA-N	432.304	1.795	50	20	IDGD	
CCn1c(NNC(=O)c2cccc(S(=O)(=O)NCC3CC3)c2)nc2ccccc2c1=O	914604762	ONRWLAQFPGXMQD-UHFFFAOYSA-N	441.513	1.862	50	20	IDGD	
COc1ccc2[nH]cc(CC(=O)NNC(=O)c3ccc(Cl)c(S(N)(=O)=O)c3)c2c1	915287283	ARSIHALKRCOQNJ-UHFFFAOYSA-N	436.877	1.481	50	20	IDGD	
COc1ccc([C@H](CNC(=O)NNc2ccc(Cl)nn2)N2CCOCC2)cc1OC	915894493	BNUWJKSHLSMGKO-AWEZNQCLSA-N	436.900	1.847	50	20	IDGD	
COc1cc(C=NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc([N+](=O)[O-])c1O	916277075	XDGJBTGGNPJBPH-UHFFFAOYSA-N	436.446	1.388	50	20	IDGD	
CCn1nc(C(=O)NN=C2CCS(=O)(=O)c3ccc(F)cc32)c2ccccc2c1=O	916321732	ZUAGMRVMPRKRHO-UHFFFAOYSA-N	428.445	1.867	50	20	IDGD	
CCNC(=O)COc1ccc(C=NNC(=O)[C@@H](C)CN2C[C@H](C)O[C@H](C)C2)cc1OC	916365860	LYRPASFLNXAPTK-YESZJQIVSA-N	434.537	1.406	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCCCN2CCc3ccccc3C2)c1	916459215	LRDPFVMJAQOZOA-UHFFFAOYSA-N	430.530	1.483	50	20	IDGD	
O=C(NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)N[C@@H]1CCN2CCC[C@@H]2C1	916574193	WZFAHGVQHJDICX-IAGOWNOFSA-N	435.550	1.042	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NC[C@@H]1CCN(c2ccccc2)C1	916579715	MRFZNDKOEHQOLK-INIZCTEOSA-N	444.561	1.759	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)COc1ccccc1[N+](=O)[O-])N1CCc2ccccc2C1	916605130	SMSRKHSAJBIGSS-HNNXBMFYSA-N	427.461	1.751	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)CSCc2ccccn2)c1	916734774	WITXXGLFWSUBAQ-UHFFFAOYSA-N	436.559	1.807	50	20	IDGD	
CCCCS(=O)(=O)N1CCC(C(=O)NNc2nc3ccccc3c(=O)n2CC)CC1	916740263	MBZHDQVZGSFYFZ-UHFFFAOYSA-N	435.550	1.701	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCCc3c(NC(C)=O)cccc32)cc1OC	917411856	VHHYQPFJDAKFKX-UHFFFAOYSA-N	426.473	1.876	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCCN2CCc3sccc3C2)cc(OC)c1OC	919784084	AZFMMVRXCPDWLU-UHFFFAOYSA-N	434.518	1.776	50	20	IDGD	
CCn1c(NNC(=O)c2nc3ncc(Br)cn3n2)nc2ccccc2c1=O	919811123	JGIAKNMTGWYGID-UHFFFAOYSA-N	429.238	1.374	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@H]2C(=O)NNC(=O)Cc2ccccc2OC)c(OC)c1	919822986	YLWUZBQQVIQMQV-SFHVURJKSA-N	441.484	1.707	50	20	IDGD	
Cc1cc(C)cc(OCCNC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)c1	919916520	KKPGZIMIPPKRRL-UHFFFAOYSA-N	433.534	1.928	50	20	IDGD	
Cc1ccc(C(=O)NCCNC(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1	1318578973	LHZWDHPNKMVGEI-UHFFFAOYSA-N	447.536	1.702	50	20	IDGD	
CN1C[C@@H](C(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)c2ccccc2C1=O	1320906132	RXIMZVOBMAMHIY-QGZVFWFLSA-N	430.505	1.650	50	20	IDGD	
CN1CCN(c2ncccc2CNC(=O)NNC(=O)c2cncn2-c2ccccc2)CC1	1337900355	GEQRUZKZSQXMMN-UHFFFAOYSA-N	434.504	1.163	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2cc(Cl)c(NC(C)=O)cc2OC)cc1	1346859968	FVYKBWSKYDDXDU-UHFFFAOYSA-N	427.866	1.939	50	20	IDGD	
O=C1CCc2ccc(C(=O)N3CC[C@H]4OCCC[C@@]4(CNC(=O)[C@H](F)Cl)C3)nc2N1	1778025839	HDNHQDZUPSHXKF-PTSWNOGYSA-N	438.887	1.628	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4c(c3)CNC4=O)C2)C1	1778729052	NLUBAKJLVKTNDB-HXPMCKFVSA-N	436.306	1.157	50	20	IDGD	
O=C(CS[C@@H]1CCCCO1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1779083434	SYUXBZXWDHHORR-IIAWOOMASA-N	439.347	1.767	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(CCN(C(=O)[C@@H]3CC(c4ccccc4)=NN3)C2)C1	1782602014	YHOZQDADKGXLND-FXAWDEMLSA-N	449.349	1.368	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@@]2(C1)CN(C(=O)c1cnsn1)CCO2	1782864131	RCQFFOYGJCFTGG-CDXDBMBRSA-N	445.451	1.867	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H]1Cc3ccccc3O1)CCO2	1783349650	QESBCKLUOLGXHC-VPWXQRGCSA-N	437.334	1.994	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(C)n(CC)n3)CCO2)C1	1783352763	SMLSKRCNHVYRKC-KSSFIOAISA-N	427.343	1.828	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)COc3cccc4ccccc34)C[C@@H]21)[C@@H](O)CCl	1784085741	OOHQAEDNMQQORU-WBKMXMRLSA-N	446.931	1.798	50	20	IDGD	
CC(=O)OC[C@@H](OC(C)=O)C(=O)NC1(c2ccc(NC(=O)[C@H](O)CCl)cc2)CCC1	1786134189	BGXMUKJYKBKOHN-IAGOWNOFSA-N	440.880	1.215	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CC3CC3)[C@H]2C1	1786629526	MFNJUNJNIRIDDC-QSFXBCCZSA-N	445.472	1.914	50	20	IDGD	
CCn1nc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](O)CCl)C[C@@H]32)c2ccccc21	1787213136	VEXFNAZHGVEOJD-PLYYQAHHSA-N	434.924	1.249	50	20	IDGD	
O=C(CN1CCS(=O)(=O)CC1)NC1(c2ccc(NC(=O)[C@@H](F)Cl)cc2)CCC1	1788582567	OCZKZIFSSGZSJW-MRXNPFEDSA-N	431.917	1.385	50	20	IDGD	
C=C(C)CC(C)(C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21	1788735572	ZKLBSLWYGXFBNA-SNRMKQJTSA-N	443.548	1.271	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CC34CCCN3CCC4)C[C@@H]21)[C@@H](F)Br	1789923287	DEFNUFMYWXGTOX-QBYUYEEZSA-N	446.361	1.675	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4nn[nH]c4c3)C[C@@H]21)[C@H](F)Br	1789924710	BQQCSPRYPQAKQS-GVARAGBVSA-N	440.273	1.242	50	20	IDGD	
Cc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Br)C[C@@H]32)cc1O	1790015398	QFCDXZYFDHXZJG-DARAHFNDSA-N	429.286	1.984	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)[C@H](O)N3CCOCC3)CCC2)cc1)[C@@H](F)Br	1790536626	VOUZJIJGFYQMDH-PBHICJAKSA-N	444.301	1.462	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3[nH]nc4ccncc34)C[C@@H]21	1791057188	GYKJVUUTNOZLCG-UHXUCMFUSA-N	436.310	1.335	50	20	IDGD	
Cc1nnc(CCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]3C2)s1	1791057335	SRGOFNAGJUDVAT-SAXRGWBVSA-N	445.383	1.542	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(C)(C)OC(=O)NC(C)C)C[C@@H]21	1791254204	PUECSXBCSBOUJS-VGWMRTNUSA-N	447.960	1.133	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1cnccn1)C2	1792873151	MTXRPULWLOXNIX-ZJOBFFGXSA-N	425.327	1.030	50	20	IDGD	
CC(=O)Nc1ccc(Cl)c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](O)CCl)c1	1792983577	PMFQAWURYSOONM-LZDSYCOUSA-N	444.315	1.101	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@](C)(O)C(F)(F)F	1793929172	ZFMVXYUIHUJFKZ-LLMVKABESA-N	443.426	1.072	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc(F)c(F)c1)C2	1795112613	OSQDXLCQFXXFEI-IVWMJMPLSA-N	431.277	1.882	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)cc([N+](=O)[O-])c1)C2	1795115301	WBLGEUYAFUMRIE-DRXBFXEBSA-N	442.266	1.289	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)COc1ccccc1	1795190431	DXYMRXBBRCBIBK-CXHZTBPHSA-N	425.323	1.829	50	20	IDGD	
O=C(Cc1ccc(F)cc1F)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1	1796192086	HFNWPIKCLYENJG-REPLKXPHSA-N	428.244	1.139	50	20	IDGD	
CCOC(=O)c1c(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Cl)c[nH]c1C	1796364323	HLGHARGMSSRMJR-LTCOOKNTSA-N	443.903	1.556	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1ccc2c(c1)CCCO2)c1ccc(B(O)O)cc1	1797843609	GENOLDOMEQFUNZ-KOUNCHBCSA-N	448.328	1.186	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cc1ccc(Cl)cc1)C2	1798439143	HIWUUHREMSDBDR-BJWYYQGGSA-N	441.919	1.833	50	20	IDGD	
COc1c(Cl)ccnc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Br)C2	1798690264	WMYAATVAGRLDQE-HNCHTBHHSA-N	446.729	1.730	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCC(N)=O)C2	1799222015	YXMWHIUZQWNVCS-BTTYYORXSA-N	432.433	1.037	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc3ccccc3n1)C2)[C@@H](F)Br	1799346879	DGEAVXILPCACAD-OXUXUCFPSA-N	437.269	1.524	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COc1ccc(O)cc1)C2	1800638089	PTYKFRBCYGTLSC-VLWCASSMSA-N	441.322	1.534	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)c1ccccc1)C2	1800640187	YEKWMFVYMUHINK-JJTUDDRGSA-N	425.323	1.483	50	20	IDGD	
COc1ccc(/C=C/C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](O)CCl)C3)c(F)c1	1800832362	OSLMAOIYANSECX-FTBITFSUSA-N	426.872	1.037	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C12CC(C1)C2	1801592840	OWUPHWLJYZVOJS-KYOJRIDYSA-N	443.456	1.523	50	20	IDGD	
C[C@@H](NC(=O)c1ccccc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(C)(C)CCl)C2	1802113400	WXUUMGXHNFLHDA-NRSFXHEJSA-N	435.952	1.660	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)COc1cc(Cl)ccn1)C2	1802337138	HJDRJXSQAXNAMT-MUJYYYPQSA-N	437.928	1.125	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc3nncn3c2)[C@H]1c1cccnc1)[C@@H](O)CCl	1803142851	KWDLOQYUUWYPRL-ZVZYQTTQSA-N	428.880	1.044	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](F)Cl)C2)C(C)(C)O	1804433078	BKOGLTDMIQDMPS-XVIXHAIJSA-N	435.924	1.823	50	20	IDGD	
O=C(Cc1ncccn1)NC[C@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1	1804689352	ODVIILFCAWFKSI-BEFAXECRSA-N	432.322	1.905	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2cccc(=O)n2O)[C@@H]1c1cccnc1	1804949945	HLLXZCDKCUANTN-VKJFTORMSA-N	434.880	1.054	50	20	IDGD	
Cc1ccc(C(=O)NC[C@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)cn1	1805459848	NJQMHBJTWMPKGP-GCJKJVERSA-N	438.532	1.478	50	20	IDGD	
O=C(CC(F)(F)F)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1806835356	CSKNTEIHSDXKTN-MAUKXSAKSA-N	435.211	1.033	50	20	IDGD	
Cc1ccsc1C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1807369913	YVDZLHMLMBYDPV-QUCCMNQESA-N	449.341	1.765	50	20	IDGD	
CN1CCN(CCC(=O)N2CC[C@H](CNC(=O)[C@@H](F)Cl)[C@H]2c2cccnc2)CC1	1808308123	ASNMKXOVDTULNK-BHIYHBOVSA-N	425.936	1.259	50	20	IDGD	
COC(=O)NCC(=O)N1CC[C@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]1c1cccnc1	1808315706	JSIHZOKOLMOCNY-DDUZABMNSA-N	431.320	1.680	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)c1snnc1C1CC1	1808850357	KUZMSNRUNXJEFH-LZWOXQAQSA-N	435.937	1.730	50	20	IDGD	
CC(C)(C)CC(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1	1810298405	IBYUFZJAJWEQCR-OXQOHEQNSA-N	438.532	1.836	50	20	IDGD	
CC/C=C(\C)C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1	1810307049	CMUKITZURNTKMT-JOICGQAWSA-N	436.516	1.756	50	20	IDGD	
C[C@H](CBr)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)Cn2cnnn2)[nH]n1	1814780041	FDXFPGZXRQXQKF-PWSUYJOCSA-N	425.291	1.120	50	20	IDGD	
C[C@@H](C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1)n1ccnc1	1815006650	GHUJKJUVDMQTQR-GOEBONIOSA-N	430.513	1.233	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCc2nc(N)n[nH]2)n[nH]1	1819286026	WTQRWTUDPGDFIK-MWLCHTKSSA-N	439.318	1.518	50	20	IDGD	
C=CCSCC(=O)N[C@@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1	1819793156	LLAZIZCXGFGJBO-LLVKDONJSA-N	446.558	1.287	50	20	IDGD	
CC(C)NC(=O)OC(C)(C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1	1820739355	FXNDMHGOMAEBNV-KBPBESRZSA-N	443.932	1.915	50	20	IDGD	
O=C(O)CSCC(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1	1823014249	RBLAHTDEJFUTHN-UPONEAKYSA-N	440.316	1.563	50	20	IDGD	
O=C1Nc2c(cccc2C(=O)N2CCC([C@H]3CCCCN3C(=O)[C@H](O)CCl)CC2)C1=O	1824184885	AOJBJZLGHICTTM-IAGOWNOFSA-N	447.919	1.654	50	20	IDGD	
O=C(C(Cl)Cl)N1CCC([C@@H]2CCCCN2C(=O)CCN2C(=O)C=CC2=O)CC1	1824774101	MVFCJKGEDSFNOR-AWEZNQCLSA-N	430.332	1.725	50	20	IDGD	
Cc1ccc(C(=O)N[C@@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)nc1	1826080424	JTXQBXNTGDLQBM-CYBMUJFWSA-N	430.534	1.445	50	20	IDGD	
Cc1nc(F)ccc1C(=O)N[C@@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1	1826087968	MGOMENKBIJYBBG-GFCCVEGCSA-N	448.524	1.584	50	20	IDGD	
COC(=O)CSCC(=O)N[C@H]1CCc2nc(NC(=O)C(Cl)Cl)sc2C1	1826092644	HBPWXXYMTJOEEQ-ZETCQYMHSA-N	426.347	1.765	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(F)cn2)CC1	1826138113	AUVRLYSMWNFNBW-NRFANRHFSA-N	439.296	1.448	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H]3CCNC(=O)C3)sc2C1	1826210177	NQEQJLBKSWXOMK-MXWKQRLJSA-N	443.367	1.612	50	20	IDGD	
CC(C)NCCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1	1827019908	JVGGLUKXHOUVOZ-FQEVSTJZSA-N	444.580	1.307	50	20	IDGD	
Cc1cc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)cn1C	1827059391	OQQRKPGQPMVCDE-JOCHJYFZSA-N	437.349	1.560	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cccnc1S)CCO2	1829796525	BZRFFAWWHQAFEC-LJQANCHMSA-N	439.610	1.292	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3nccc4[nH]ccc34)C2)C1	1830358159	RGXNCHZZBHBGLM-NRFANRHFSA-N	434.924	1.898	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc4ncccn34)C2)C1	1830362137	MGTXCWUKNOFNGB-HXUWFJFHSA-N	435.912	1.064	50	20	IDGD	
O=C(c1ccc(Cl)c(F)c1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1830732981	CSUVWHNVROBUCE-CRAIPNDOSA-N	435.279	1.149	50	20	IDGD	
CCN(C)[C@@H](C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1	1831073424	KPKSDBVFFFKDTK-JXFKEZNVSA-N	444.580	1.259	50	20	IDGD	
C=CCO[C@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)CBr)C2)C1	1831419000	JBUUCYDDHCOLDN-DAYGRLMNSA-N	433.343	1.065	50	20	IDGD	
C=CCO[C@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)CBr)C2)C1	1831419005	JBUUCYDDHCOLDN-RKVPGOIHSA-N	433.343	1.065	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)[C@H](C)CC)CCO2	1831517999	LRYNJHXKVXOGIQ-LLDVTBCESA-N	435.359	1.023	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(OC)cn3)C2)C1	1831647648	XYXYFOPSDMPCPG-OXQOHEQNSA-N	425.913	1.568	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(OC)cc3O)C2)C1	1831655270	VKJJZBARXGUZOH-UWJYYQICSA-N	440.924	1.878	50	20	IDGD	
CNC(=S)NCCC(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H](Cl)COC)CC1	1831830477	CYEFATFVODUMLO-CVEARBPZSA-N	433.018	1.344	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cnncc2C(=O)O)CC1	1831831367	WNNSLQOCCWTLQC-DLBZAZTESA-N	438.912	1.662	50	20	IDGD	
Cc1cnn([C@@H](C)C(=O)N2CCC([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)c1	1831876500	GSXOOTYBVPYVKN-AZUAARDMSA-N	446.596	1.745	50	20	IDGD	
Cc1ccc(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)cn1	1832912108	DQNQCPGJAYWSNF-IBGZPJMESA-N	430.332	1.583	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3ccc4nonc4c3)CC2)CC1)[C@H](O)CCl	1833310258	NTQHHRUNJSGIPE-GOSISDBHSA-N	435.912	1.008	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H]3CCc4ccccc43)CC2)CC1)[C@H](O)CCl	1833313118	WROIXTMTMDYJRK-LEWJYISDSA-N	433.980	1.888	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cc(F)cc(F)c3)CC2)CC1)[C@H](O)CCl	1833313505	IDBNAQKKDDJBGY-GOSISDBHSA-N	429.895	1.750	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cncc(N(C)C)c3)CCO2)C1	1833358782	UXTFNJAVEWKXAW-NQIIRXRSSA-N	438.956	1.625	50	20	IDGD	
CCn1ccc(C(=O)NC2CCN(C3CCN(C(=O)[C@H](Cl)COC)CC3)CC2)n1	1834274453	NAUMRQKRUPXOFU-QGZVFWFLSA-N	425.961	1.342	50	20	IDGD	
CCn1nccc1C(=O)NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1834277590	WBNWYTKSOPYJAV-MRXNPFEDSA-N	444.349	1.779	50	20	IDGD	
O=C(CCBr)NC1CCN(C2CCN(C(=O)CN3CCCC3)CC2)CC1	1834421866	ZZPFCOHITQUGRM-UHFFFAOYSA-N	429.403	1.439	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CSc3ccccc3)CCO2)C1	1835094267	OLAKENPGJFTWOK-XLIONFOSSA-N	442.965	1.489	50	20	IDGD	
Cc1n[nH]cc1C(=O)NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1	1836152266	HSMAKGLKKZPODW-UHFFFAOYSA-N	426.359	1.688	50	20	IDGD	
Cc1cc(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)n(C(F)F)n1	1836163042	ADAYDTIQZKIENN-INIZCTEOSA-N	447.914	1.372	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccccn3)CCO2)C1	1836190782	GVDQOMGPLWSYKI-LPHOPBHVSA-N	440.338	1.254	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3ccc([N+](=O)[O-])[nH]3)CC2)CC1	1836197840	MZGIUFDGTLFREI-OAHLLOKOSA-N	441.916	1.362	50	20	IDGD	
CCc1[nH]nc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](Cl)CC)C3)C2)c1Cl	1836230777	DXXYTRMVUTXVMR-KPZWWZAWSA-N	433.336	1.713	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)c3cc(O)nc(O)n3)CC2)CC1	1836394400	UTMNAELWLCQWOT-CQSZACIVSA-N	425.917	1.090	50	20	IDGD	
C=C(CC(=O)OCC)C(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836718054	PIGNXSSVTBACBO-QGZVFWFLSA-N	430.929	1.094	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccn4cncc34)C2)C1	1837713132	JFXCKRDVTMAWFG-NRFANRHFSA-N	446.580	1.256	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](C)N3CCN(C)CC3)CC2)CC1	1838627089	ISXHWOKVOLKHQZ-YLJYHZDGSA-N	443.032	1.638	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3coc(Cl)n3)C2)C1	1839151551	WAEFDVZONJSBGP-JKSUJKDBSA-N	440.711	1.634	50	20	IDGD	
CCc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)cn1	1839197814	JDDUEDAAVLVWIG-QAPCUYQASA-N	444.301	1.405	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)c(O)c1OC	1839376697	NFDFDTPPRCIDAY-VQIMIIECSA-N	446.859	1.014	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(O)c(O)c(Cl)c3)CCO2)C1	1839433620	MHPIDFUNTGRWSW-BFUOFWGJSA-N	447.315	1.839	50	20	IDGD	
Cc1cc2[nH]c(C(=O)N3CCO[C@@]4(COCCN(C(=O)[C@@H](O)CCl)C4)C3)cc2s1	1839523576	PPNSSTLRAMXWPC-KXBFYZLASA-N	441.937	1.208	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3cc(C)ccc3C)CCO2)C1	1839936277	QYTUTHDAYNSNHN-UGKGYDQZSA-N	438.952	1.556	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ncccc3F)C2)C1	1840034655	SCGSLYOPXCRBCK-PXAZEXFGSA-N	430.274	1.074	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCCC12CN(C(=O)c1nc3c(=O)[nH]c4ccccc4n3n1)C2	1841226126	JVGCEWJKKARKQS-UHFFFAOYSA-N	442.907	1.653	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC2(CCCN2C(=O)c2ccc(O)nn2)C1	1842340075	OQYQWSQAHWLPCV-RIYZIHGNSA-N	425.395	1.885	50	20	IDGD	
Cn1c(=O)n(CC(=O)N2CCCC23CN(C(=O)CO[Si](C)(C)C)C3)c2ccccc21	1843860026	OIGGTQHLMQDHAL-UHFFFAOYSA-N	430.581	1.395	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCNC(=O)OC(C)(C)C	1847870150	MYPUWIOZKYGGKI-UGUYLWEFSA-N	431.961	1.871	50	20	IDGD	
CC(=O)N(C)CCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1848019899	DGTSTUYHXKPZMY-JYJNAYRXSA-N	444.960	1.189	50	20	IDGD	
COc1ccc([C@]2(C)NC(=O)N(CC(=O)NNC(=O)c3cc(Cl)ccc3O)C2=O)cc1	10600872	SICDJMKMPLZJTB-FQEVSTJZSA-N	446.847	1.282	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)CCc2c(C)nc3nc(N)nn3c2C)c1C	18103410	UZDPFJAMTPREHK-HNNXBMFYSA-N	425.493	1.488	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1	28604872	URTWEFWMQVWQOZ-UHFFFAOYSA-N	431.514	1.410	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)CNC(=O)c2cccs2)cc1	196462442	HJSWOATUMBHENH-UHFFFAOYSA-N	430.515	1.360	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCCNC(=O)CC2CCCCC2)cc(OC)c1OC	725859227	CHYMPZGBUMPSGG-UHFFFAOYSA-N	436.509	1.743	50	20	IDGD	
CC(C)(C)OC(=O)N1CCCN(C(=O)NNC(=O)CNC(=O)c2cccs2)CC1	725874018	WFFGZLAQTDMOGO-UHFFFAOYSA-N	425.511	1.162	50	20	IDGD	
CCN1CCN(c2ccc(F)cc2[C@H](C)NC(=O)NNC(=O)Cn2nc(C)cc2C)CC1	726278562	JBQZPROZOFVQND-KRWDZBQOSA-N	445.543	1.873	50	20	IDGD	
CCC(C)(C)C(=O)NNC(=O)C[C@H]1c2cc(OC)c(OC)cc2CCN1S(C)(=O)=O	726798458	XSQLRVQJKPXBAD-HNNXBMFYSA-N	441.550	1.536	50	20	IDGD	
CC(C)(C)OC(=O)NC1(C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)CCCC1	727130474	HBAIRCULDFJZBS-UHFFFAOYSA-N	425.507	1.689	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)COc1ccc(C#N)cc1)c1cccc(S(=O)(=O)N(C)C)c1	727610431	QQVQCBCHKKWQGN-AWEZNQCLSA-N	445.501	1.279	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(Br)cc1[N+](=O)[O-])c1ccc2c(c1)OCO2	727749237	UDDRDIICVDPDMC-UHFFFAOYSA-N	444.219	1.709	50	20	IDGD	
COc1ccc(CCNC(=O)NNC(=O)c2nnc(O)c3ccccc23)c(OC)c1OC	727946248	UPGRHZJQIQSYAD-UHFFFAOYSA-N	441.444	1.548	50	20	IDGD	
CCCCC(=O)N1CSC[C@H]1C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	727981902	AAYWMTFAPNQCCM-IBGZPJMESA-N	447.605	1.438	50	20	IDGD	
Cc1ccc(-n2c(C)cc(/C=C(\C#N)C(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)c2C)cc1	728384413	JDQZUKQDZXMDIM-HDZGYNCQSA-N	440.525	1.892	50	20	IDGD	
CCCNC(=O)CN1CCC(NC(=O)NNC(=O)c2cccc(OC(F)F)c2)CC1	728595740	UHMKNPFRDUNNFP-UHFFFAOYSA-N	427.452	1.223	50	20	IDGD	
CC[C@H](NC(=O)NNC(=O)COc1ccccc1C#N)c1cccc(S(N)(=O)=O)c1	729613400	RASXAASUUXQEBD-INIZCTEOSA-N	431.474	1.066	50	20	IDGD	
O=C(CCN1CCN(C(c2ccccc2)c2ccccc2)CC1)NNC(=O)[C@H]1CCC(=O)N1	729833326	FGUYLJVGIKTHJT-OAQYLSRUSA-N	449.555	1.210	50	20	IDGD	
CNC(=O)C1(C(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)CCC1	729966425	RPDKRYCJGDYUDX-UHFFFAOYSA-N	433.468	1.122	50	20	IDGD	
COc1cc(C(=O)NCC(=O)NNC(=O)CCc2ccccc2O)ccc1OC(F)F	730034186	ZSRAFJGDDKGZHK-UHFFFAOYSA-N	437.399	1.512	50	20	IDGD	
CCNS(=O)(=O)CCNC(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccccc1	731647440	KGCZWLHQWZABOU-GHRIWEEISA-N	426.502	1.426	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N[C@@H](CCSC)C(=O)NNC(=O)C2CCC2)cc1	732142318	WIOMPYHRQZTXPR-INIZCTEOSA-N	429.564	1.433	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2ccc(F)c(S(N)(=O)=O)c2)cc1Br	732176644	WSQYLAYCRUFJCI-UHFFFAOYSA-N	446.254	1.319	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C[C@H](C)O1	732259888	ZLTZGZMQKKKLEP-LNLFQRSKSA-N	448.564	1.769	50	20	IDGD	
O=C(COC(=O)c1cccc(NC(=O)NC2CC2)c1)NNC(=O)c1cccc([N+](=O)[O-])c1	732328618	BUNOLRFPGFLAOL-UHFFFAOYSA-N	441.400	1.497	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N[C@H]2CCN(c3ccccc3C(N)=O)C2)cc1OC	732573515	SJWZUCBTKDQFDB-AWEZNQCLSA-N	427.461	1.026	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N[C@@H](CCSC)C(=O)NNc2cnccn2)cc1	734245021	CHCIYOCDKKEDAM-HNNXBMFYSA-N	425.536	1.419	50	20	IDGD	
CN(CC(=O)NNc1nccnc1Cl)S(=O)(=O)c1ccc(Br)cc1	734262205	BDHANHSEDWLXCG-UHFFFAOYSA-N	434.703	1.656	50	20	IDGD	
COCCN1C(=O)c2ccc(C(=O)NNc3cc(F)c(F)cc3F)cc2S1(=O)=O	734553292	KSUQBYPSIWFRQC-UHFFFAOYSA-N	429.376	1.652	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)N[C@@H]2CCN(CC3CC3)C2)c2ccccc2c1=O	739036453	VEBZOMADWVBVPM-MRXNPFEDSA-N	426.521	1.625	50	20	IDGD	
CN(C)c1nccc(NNC(=O)CCNC(=O)c2cc(F)ccc2Br)n1	740114594	ZPWMATAKCIENLU-UHFFFAOYSA-N	425.262	1.707	50	20	IDGD	
CCS(=O)(=O)NCc1ccc(C(=O)NNC(=O)c2cc(-c3ccccc3)on2)cc1	741664806	LDPAGGWVXUEQBU-UHFFFAOYSA-N	428.470	1.856	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2ccccc2C(C)(C)C)c1	742024753	AVGIJFVQKRAZFW-UHFFFAOYSA-N	439.559	1.858	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(F)c(Br)c1)[C@H]1COc2ccccc2O1	743252307	VZRZDOCEXOVZES-CQSZACIVSA-N	431.239	1.738	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)o1	744619446	OXJVORBVQJZBJP-UHFFFAOYSA-N	436.534	1.899	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)N[C@H]2CCN(c3ccccc3F)C2=O)cc1	745817318	YEPUIPFUFNEIBI-HNNXBMFYSA-N	449.464	1.370	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12)[C@H]1CCOC1	745862317	UZSIZDXMAPFXFZ-WBVHZDCISA-N	435.484	1.814	50	20	IDGD	
COC(C)(C)C[C@H](C)NC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	745865058	HJEWQNIBEKOYJK-AWEZNQCLSA-N	426.539	1.619	50	20	IDGD	
Cc1cc(F)ccc1S(=O)(=O)Nc1ccccc1C(=O)NNC(=O)N1CCOCC1	745992273	YGERYPLNRAUKNF-UHFFFAOYSA-N	436.465	1.622	50	20	IDGD	
CSCc1noc(CCC(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)n1	746851000	LLNONNUFOONTJO-UHFFFAOYSA-N	442.542	1.595	50	20	IDGD	
COc1ccc2c(c1)OC[C@@H](C(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1)C2	747409026	MWJBWBSDUJKIRZ-INIZCTEOSA-N	447.513	1.023	50	20	IDGD	
O=C(CSCC(=O)Nc1cccc(Br)c1)NNC(=O)Cc1ccncc1	747516055	WMVVGRRMIBEACS-UHFFFAOYSA-N	437.319	1.906	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)c2ccc(Cl)c(N3CCNC3=O)c2)c1	747723912	VJZFWTOSEDRXDO-UHFFFAOYSA-N	441.831	1.359	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cc(C(=O)NNc3nccn(C)c3=O)ccc2C)cc1	747941419	DJZZSCSXLGKYPN-UHFFFAOYSA-N	443.485	1.655	50	20	IDGD	
CCc1cccc(NC(=O)CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1	748461225	KGTIRIFITYGZQJ-UHFFFAOYSA-N	447.517	1.082	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)NNC(=O)c2ccc(OC)c(Br)c2)o1	748644383	WXJMJOHFXBBRFI-UHFFFAOYSA-N	447.263	1.851	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCC(C(=O)Nc3cccc(C#N)c3)CC2)n1	749250082	JJRPULRJGOTRAC-UHFFFAOYSA-N	440.529	1.364	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)N[C@H]2CCN(c3cccc(Cl)c3)C2)c2ccccc2c1=O	751103539	QYZWYHNVPFZTMT-AWEZNQCLSA-N	440.891	1.810	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(CCNC(=O)NNC(=O)c2ccc(C)o2)s1	752370579	OSZGGZMKUQKGEE-UHFFFAOYSA-N	428.536	1.867	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)NC[C@@]3(C)CCCN(C(=O)OC(C)(C)C)C3)nc21	753371479	KMTUGIAGGCBUOS-LJQANCHMSA-N	434.501	1.732	50	20	IDGD	
C[C@@]1(c2ccc3ccccc3c2)NC(=O)N(CC(=O)NNc2cc(Cl)nc(N)n2)C1=O	753449282	CTXMIIXOSNEFQD-FQEVSTJZSA-N	439.863	1.776	50	20	IDGD	
COC(=O)c1cc2c(cc1NC(=O)C(=O)NNc1cccc(C(F)(F)F)n1)OCO2	753853919	XOHMEDPGFMLZLE-UHFFFAOYSA-N	426.307	1.698	50	20	IDGD	
Cn1nc(SCC(=O)NN=Cc2ccc(Sc3ccccc3)cc2)c(=O)n(C)c1=O	753924582	VPACHEFBTAPEMZ-UHFFFAOYSA-N	441.538	1.873	50	20	IDGD	
C[C@@H]1Cc2cc(S(N)(=O)=O)ccc2N1C(=O)COC(=O)/C(C#N)=C\c1ccc(O)cc1	754538106	CFSLISBMJITONO-WPBJZHHJSA-N	441.465	1.468	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1)c1cnc2[nH]nnc2c1	755202901	PJDCWWFOJVDJPC-FQEVSTJZSA-N	427.468	1.741	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)Nc1ccc(F)c(F)c1	755375942	TUZIXHWQQPPPMM-UHFFFAOYSA-N	440.428	1.452	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)Nc1ccc(C)c(S(=O)(=O)NC)c1	755516634	VBONOJIEZLMOKR-UHFFFAOYSA-N	436.490	1.534	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)Nc2cc(S(=O)(=O)N(C)C)ccc2N(C)C)cc1	755529520	DHNVKHHMQMKVHJ-UHFFFAOYSA-N	449.533	1.543	50	20	IDGD	
CC(C)c1cnc(NC(=O)C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)s1	756163389	HKMGKYMXIMDBBA-UHFFFAOYSA-N	442.501	1.957	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)cc2)C[C@H](C)O1	756273645	JZLBYFYYVIPQBD-GJZGRUSLSA-N	436.476	1.742	50	20	IDGD	
COC(=O)[C@H](c1cc(F)c(F)c(F)c1)N(C)CC(=O)NNC(=O)c1cccc(C#N)c1	756613538	PRSSEGAFRLVONN-SFHVURJKSA-N	434.374	1.583	50	20	IDGD	
CC[C@H](C)NS(=O)(=O)c1cccc(NC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1	757709636	OOSLEWBMLXYTFS-SCLBCKFNSA-N	448.501	1.756	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)NCc2ccc3c(c2)CCS3(=O)=O)cc1	757739446	AEVWMVLYADFTDH-AWEZNQCLSA-N	447.513	1.713	50	20	IDGD	
O=C(NC[C@@H]1CC(=O)N(Cc2ccccc2)C1)NNC(=O)c1cnn(-c2ccccc2)c1	758786611	OTUBUWOLJGHHOX-SFHVURJKSA-N	432.484	1.865	50	20	IDGD	
CCc1ccc(S(C)(=O)=O)cc1C(=O)OCC(=O)NNC(=O)c1ccc(Cl)cc1	758942147	WZSHPUZQOVSJNI-UHFFFAOYSA-N	438.889	1.924	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN[C@H](Cc2nc(C)no2)c2ccccc2)cc1OC	759938126	VITHALMTKSYCHX-QGZVFWFLSA-N	439.472	1.730	50	20	IDGD	
COC(=O)CS(=O)(=O)Cc1ccc(CNC(=O)NNC(=O)c2ccccc2F)cc1	760192950	ATFPSTSVDABYFE-UHFFFAOYSA-N	437.449	1.058	50	20	IDGD	
COc1cccc2c1CC[C@@H]2NC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1	760208515	ZZGHBAGTKQPHHQ-SFHVURJKSA-N	446.529	1.642	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)c2ccc(=O)n(-c3cnn(C)c3)c2)n[nH]1	760825011	PYDAXIFZFKATDB-UHFFFAOYSA-N	433.428	1.045	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCCC[C@H]2CCCCO2)cc1	761036987	SSEPGRFMEBJMIG-MRXNPFEDSA-N	426.539	1.295	50	20	IDGD	
Cc1nnnn1[C@H](Cc1ccc(F)cc1)C(=O)NNC(=O)c1cc(-c2cccs2)[nH]n1	763157592	IKPRTRHDOUCGPL-MRXNPFEDSA-N	440.464	1.817	50	20	IDGD	
O=C(NNC(=O)c1ccncc1)C(=O)Nc1ccc(C(=O)NCc2ccccc2F)cc1	763462113	JZVGQFKGPPOMNZ-UHFFFAOYSA-N	435.415	1.550	50	20	IDGD	
CCc1ccccc1NC(=O)C(=O)NNC(=O)c1cccc(S(=O)(=O)N(CC)CC)c1	763509840	UNBREQJFJHGKDV-UHFFFAOYSA-N	446.529	1.679	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1F	763529443	BCJOIYLPBUMTRB-UHFFFAOYSA-N	427.480	1.432	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(C)nc2)cc(OCC)c1OCC	763543731	NQPMXIILRGSOKX-UHFFFAOYSA-N	430.461	1.986	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)C(=O)Nc1ccc(OCc2cccnc2)cc1	763550533	CQBLFXNWKRZSAR-UHFFFAOYSA-N	434.408	1.789	50	20	IDGD	
COC(=O)CCSc1cccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)c1	763550881	IOWKTNLAMLCCAV-UHFFFAOYSA-N	445.453	1.470	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)n(-c2ccccc2F)n1	763570869	GEUMDKNEBBJRKH-QGZVFWFLSA-N	439.403	1.246	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)N1CC2(CCC2)c2c(F)cccc21	763657437	MDVNFHIMJBCVDW-UHFFFAOYSA-N	427.432	1.829	50	20	IDGD	
COc1ccc(CN(C)C)cc1NC(=O)C(=O)NNC(=O)COc1cc(C)ccc1C	763666058	WAJKHLZBJRAEHZ-UHFFFAOYSA-N	428.489	1.539	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(Oc3cccnc3)nc2)cc1	763681573	LPGBOZAONDZWFF-UHFFFAOYSA-N	432.396	1.305	50	20	IDGD	
CCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2OCC)c(C)c1	763682380	RXHMMWMZRLUQLE-UHFFFAOYSA-N	442.472	1.308	50	20	IDGD	
Cc1ccnc(-c2ccc(NC(=O)C(=O)NNC(=O)COc3ccccc3C#N)cc2)n1	763806878	GYMHESOQDZUUBV-UHFFFAOYSA-N	430.424	1.489	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)c(Br)n1	763866230	NVCRWDRVTOVKPB-JTQLQIEISA-N	439.241	1.845	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)N(C)CCO3)cc1	763877231	ITLRZMVTEGAITK-AWEZNQCLSA-N	440.456	1.271	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2cccc(CNC(=O)OC(C)(C)C)c2)n1	763886360	WAGNQCZZVGAACO-UHFFFAOYSA-N	444.492	1.311	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccc(-n3cccn3)cc2C(F)(F)F)n1	763892703	HZOALGBCOJBKSI-UHFFFAOYSA-N	449.393	1.491	50	20	IDGD	
COCCOc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(Br)s2)c1	763942139	VKJGJDSPARWGAI-UHFFFAOYSA-N	442.291	1.936	50	20	IDGD	
O=C(NNC(=O)c1ccc[nH]1)C(=O)Nc1ccc(Cl)cc1I	763979824	NCHIIPFMOPXAKQ-UHFFFAOYSA-N	432.605	1.672	50	20	IDGD	
CNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)on2)cc1Cl	764017209	URZLCCWBAPRXJO-UHFFFAOYSA-N	441.831	1.754	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(Br)cc2)c1	764077191	INQKRKITSYBZMV-UHFFFAOYSA-N	440.275	1.252	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2ccnn2Cc2cccc(C)c2)cc1	764132880	XZUXBBPJEYECIH-UHFFFAOYSA-N	435.484	1.967	50	20	IDGD	
Cc1ccc(-n2nc(-c3ccco3)cc2NC(=O)C(=O)NNC(=O)c2c[nH]nc2C)cc1	764297330	OOJDFDBJVUQFPC-UHFFFAOYSA-N	433.428	1.872	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)c(Cl)c1)C(=O)Nc1cc(F)cc(N2CCOCC2)c1	764350063	ZTAOCNXHIRQZJD-UHFFFAOYSA-N	436.827	1.421	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)C(=O)Nc1cccc(C[S@@](=O)c2ccccc2)c1	764355030	YDAHITJGZYYZOJ-WJOKGBTCSA-N	436.493	1.718	50	20	IDGD	
CCN1CCc2ccc(NC(=O)C(=O)NNC(=O)c3cc(-c4ccccc4OC)[nH]n3)cc21	764377822	QNMVKFZEAOWLRM-UHFFFAOYSA-N	448.483	1.867	50	20	IDGD	
Cc1nc(C)n(-c2ccccc2NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)n1	764379321	BSQIWVASOBDXMD-UHFFFAOYSA-N	444.398	1.642	50	20	IDGD	
COc1ccc(C(=O)NNc2nccnc2OC)cc1S(=O)(=O)N1C[C@@H](C)C[C@@H](C)C1	764465511	NEBRSAFJOPOYLB-OKILXGFUSA-N	449.533	1.917	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C[C@@H]2CN(C(=O)OC(C)(C)C)CCO2)nc2ccccc21	764547643	OKUQOWKGOXIGEN-CQSZACIVSA-N	431.493	1.289	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	766664314	PHEJONMXJSHTJT-UHFFFAOYSA-N	440.935	1.495	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)CN1CCN(C(=O)c2ccc(Cl)cc2)CC1	766850695	XANFJWBXDUPLDQ-UHFFFAOYSA-N	428.920	1.796	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)c1ccccc1S(=O)(=O)CCN(C)C	767203893	DGVXOELRPRKUNQ-UHFFFAOYSA-N	429.502	1.053	50	20	IDGD	
Cc1ccc(NC(=O)N(C)C)c(C(=O)OCC(=O)NNC(=O)Cc2ccccc2C)c1	767342183	OTTGFEUFYIHIHU-UHFFFAOYSA-N	426.473	1.944	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)c2cccc([C@@]3(C)NC(=O)NC3=O)c2)n[nH]1	769279864	FKSUTLDJLPSPEJ-JOCHJYFZSA-N	448.439	1.215	50	20	IDGD	
COc1ccc(NNC(=O)c2ccccc2S(=O)(=O)N2CCOCC2)c([N+](=O)[O-])c1	769312604	QCVFHKCFWLNFIH-UHFFFAOYSA-N	436.446	1.381	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)NCc3cccc(NC(=O)[C@@H]4CCCO4)c3)nc21	770354488	FQHAGUJPPPORHO-AWEZNQCLSA-N	426.437	1.013	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)CN3C(=O)NC4(CCC(C(C)(C)C)CC4)C3=O)nc21	770982571	IQMKLYWZERINCC-UHFFFAOYSA-N	444.496	1.039	50	20	IDGD	
Cc1cc(C(=O)O[C@H](C)C(=O)NNC(=O)CC(C)C)cc(S(=O)(=O)N(C)C)c1C	771953409	WGDNRWHCKBVMRJ-CQSZACIVSA-N	427.523	1.293	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)[C@H]1CCCN1C(=O)c1cc(Cl)ccc1OC	771996009	ZBVUQZODUIGTBV-BXUZGUMPSA-N	425.869	1.442	50	20	IDGD	
CC(=O)[C@H]1CC(C(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)=NN1c1ccccc1	772898281	POVLIKAPBYDUJA-GOSISDBHSA-N	441.875	1.328	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ncn(Cc2ccccc2)n1	774009742	SJUKPPRKELBXCX-ZDUSSCGKSA-N	442.863	1.533	50	20	IDGD	
CN(C)C(=O)[C@H]1CC[C@@H](CNC(=O)NNC(=O)c2ccc(COc3ccccc3)o2)O1	774659291	NGEDZQCZOFKNCZ-MAUKXSAKSA-N	430.461	1.438	50	20	IDGD	
CCOC1CC(CNC(=O)NNC(=O)Cc2c[nH]c3ccccc23)(N2CCOCC2)C1	775159976	SUTZBWOFLPUJMN-UHFFFAOYSA-N	429.521	1.311	50	20	IDGD	
O=C(NNC(=O)c1ccccc1)Nc1ccc(Cl)c(S(=O)(=O)N2CCOCC2)c1	775277720	BCJIFSQPEUULFO-UHFFFAOYSA-N	438.893	1.827	50	20	IDGD	
CC(C)c1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc(O)n1	775521398	JIZXSGFVCZTPET-UHFFFAOYSA-N	432.502	1.770	50	20	IDGD	
CN(NC(=O)CCCNC(=O)c1cccnc1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776206366	TUCAISFLGWDTKN-UHFFFAOYSA-N	448.524	1.227	50	20	IDGD	
C[C@H]1Sc2ccc(C(=O)N3CCN(S(=O)(=O)CBr)CC3)cc2NC1=O	777777482	JMVNUKFTRZPXII-SNVBAGLBSA-N	448.364	1.559	50	20	IDGD	
CNS(=O)(=O)c1ccc(-c2ccc(C=NNC(=O)CNC(=O)OC(C)(C)C)o2)cc1	777900062	GYQQIMJFRIWKTQ-UHFFFAOYSA-N	436.490	1.830	50	20	IDGD	
CN1CCc2cc(C(=O)NNC(=O)c3cccc(S(=O)(=O)N4CCCC4)c3)ccc21	778284849	WZUFWPPOJLCNDL-UHFFFAOYSA-N	428.514	1.538	50	20	IDGD	
C[C@@H]1CCN(C(=O)OC(C)(C)C)[C@@H](C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)C1	778413179	POGNAEOLQVLOGB-RHSMWYFYSA-N	444.488	1.898	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)[C@@H]2CC(=O)N(c3cc(C)ccc3OC)C2)nc1C	778421900	IGYPYJGZTFUFIR-CQSZACIVSA-N	427.461	1.775	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)c1cc(S(=O)(=O)N2CCC2)ccc1Cl	778441438	VHQRRECEONCZRU-UHFFFAOYSA-N	446.913	1.020	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cnn([C@@H](C)C3CC3)c2)cc(OC)c1OC	778706494	SKNMFVDFSJQGCR-NSHDSACASA-N	431.449	1.280	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)N[C@H]1CCc2nnc(-c3ccc(F)cc3)n2C1	780907462	VNQOFMHQPQJTOK-HNNXBMFYSA-N	439.407	1.951	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2cc(Br)cnc2-n2cccn2)nc1	782145269	PCRWDSJRVQFNPZ-UHFFFAOYSA-N	432.238	1.515	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2nc3ccccc3s2)cc1NS(C)(=O)=O	782814420	PQJHLHNKGGFKQO-UHFFFAOYSA-N	435.487	1.758	50	20	IDGD	
C[C@H](Oc1ccccc1NC(=O)C(=O)NN[C@@]1(C)CCS(=O)(=O)C1)c1ccccc1	783426003	LANKPRXJHMUGLW-BTYIYWSLSA-N	431.514	1.963	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2cccc(OCCc3ccccc3)c2)CCS(=O)(=O)C1	783427373	RWOAEMSESIMBSN-NRFANRHFSA-N	431.514	1.445	50	20	IDGD	
CN(C)C(=O)C[C@H]1CN(C(=O)C(=O)NNc2ccc(Cl)nn2)c2ccc(Cl)cc21	784789039	DDLGWDJWELRUCN-JTQLQIEISA-N	437.287	1.835	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2cccc(C(F)(F)F)n2)cc1NS(C)(=O)=O	784958675	PKYLJPIXOBTKAO-UHFFFAOYSA-N	447.395	1.562	50	20	IDGD	
CCN(CC)CCn1ccc2cc(NC(=O)C(=O)NNc3ccnc(N(C)C)n3)ccc21	784970716	MEGKJWFIMBMDKL-UHFFFAOYSA-N	438.536	1.921	50	20	IDGD	
CC1CCN(c2ccc(NC(=O)C(=O)NNC(=O)c3cc([N+](=O)[O-])ccc3O)cc2)CC1	785022956	DGPQLBJYJRJGAX-UHFFFAOYSA-N	441.444	1.936	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)cc1	785099534	IAVKVUFHNFKYHY-UHFFFAOYSA-N	448.426	1.964	50	20	IDGD	
COc1cc(F)cc(NNC(=O)C(=O)Nc2cccc(S(=O)(=O)NC(C)(C)C)c2)c1	785237524	TXDGHGYRGSYEJN-UHFFFAOYSA-N	438.481	1.993	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1ccc(-n2cccn2)c(F)c1	785331698	YMZJWTLSXXDZRL-UHFFFAOYSA-N	447.448	1.505	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1C	785747164	KIVSLSDFWWKGQE-GOSISDBHSA-N	427.413	1.098	50	20	IDGD	
O=C(NNC(=O)C(=O)N1CCCC1)N[C@H]1CCCN(c2ccc(Cl)cc2Cl)C1=O	788918390	UOPCRGIYLUAVAZ-ZDUSSCGKSA-N	442.303	1.442	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)N2CCC[C@@H](N3CCCS3(=O)=O)C2)c1C	790222352	PMZJUPQRDMODRX-QRRJMBGHSA-N	434.562	1.685	50	20	IDGD	
N#CCCn1cc(/C=C(\C#N)C(=O)N2CCC[C@]3(C2)NC(=O)NC3=O)c(-c2ccccc2)n1	790237009	FDMHFXGEVJQGGU-XUUSCSPLSA-N	443.467	1.571	50	20	IDGD	
CNC(=O)c1cc2cc(NC(=O)C(=O)NNC(=O)c3cc(C)nc4ccccc34)ccc2[nH]1	792351259	SKYCDOFRLKNUBL-UHFFFAOYSA-N	444.451	1.784	50	20	IDGD	
CN(C)N(C(=O)[C@H]1CCCN(C(=O)Nc2ccccc2F)C1)[C@H]1CCS(=O)(=O)C1	792855046	NMBQPPPYTNTOPI-GJZGRUSLSA-N	426.514	1.562	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2cc(C(=O)NCC(F)(F)F)ccc2C)n1	797369599	AMGUARSBQSVMPL-UHFFFAOYSA-N	437.378	1.390	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)Nc2ccc(S(=O)(=O)N3C[C@H](C)O[C@H](C)C3)cc2)n1	797607828	BWYORIPTIFLETE-GASCZTMLSA-N	447.517	1.654	50	20	IDGD	
C=CCNC(=S)NNC(=O)CNC(=O)[C@@H]1c2ccccc2C(=O)N1Cc1ccccc1	798305574	VOPKNUIXECLWTB-IBGZPJMESA-N	437.525	1.181	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])o2)cc1C	798307020	HBIJPTDSIJCYRI-CQSZACIVSA-N	443.416	1.195	50	20	IDGD	
CC(C)OCCS(=O)(=O)NCC(=O)NNc1cc([N+](=O)[O-])ccc1Br	800618094	GZJOIXUCNIYWQL-UHFFFAOYSA-N	439.288	1.145	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)S(=O)(=O)N(C1CC1)C2=O)Nc1cc(F)cc(F)c1	802006362	LOJWNOSFODLAQF-UHFFFAOYSA-N	436.396	1.738	50	20	IDGD	
Cc1nn(Cc2ccccc2)c(N)c1C(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	802998409	HYGBQKHLXYGREC-UHFFFAOYSA-N	440.891	1.553	50	20	IDGD	
COCCOc1ccc(S(C)(=O)=O)cc1NC(=O)C(=O)NNc1ccc(F)cc1C	807001441	AJEAECCCYWRUMG-UHFFFAOYSA-N	439.465	1.645	50	20	IDGD	
O=C(NC[C@H](c1ccco1)N1CCCC1)NNC(=O)c1csc(N2CCOCC2)n1	807003314	KSIHGYPYUADCDQ-OAHLLOKOSA-N	434.522	1.354	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNS(=O)(=O)c2ccc(C(F)F)cc2)cc1	808068969	LJPODAQLIAONFM-UHFFFAOYSA-N	447.485	1.563	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@H](C)C(=O)NNC(=O)CNS(=O)(=O)c1cccnc1	809980784	UXMVGTJNUJUNHS-CYBMUJFWSA-N	440.909	1.245	50	20	IDGD	
COc1ccc(S(=O)(=O)NCC(=O)NNc2ccc(OC(F)F)cc2)cc1OC	810686134	MADUCWAGODTZTM-UHFFFAOYSA-N	431.417	1.727	50	20	IDGD	
O=C(NNS(=O)(=O)CCc1ccccc1Br)c1cc([N+](=O)[O-])ccc1O	812270516	IPFBKORSAGNULM-UHFFFAOYSA-N	444.263	1.870	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)c1c(I)cnn1C	814101049	HJSNMJCEWLFKGE-QMMMGPOBSA-N	432.193	1.392	50	20	IDGD	
CCOC(=O)c1nc(NC(=O)C(=O)NN=c2sc3ccccc3n2C)sc1C(C)=O	815588389	MWQHDUCJGGKYKM-UHFFFAOYSA-N	447.498	1.646	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCO1)C(=O)Nc1ccnn1Cc1ccc(OC(F)(F)F)cc1	815780125	JZXSMEYITRIUIF-CYBMUJFWSA-N	441.366	1.095	50	20	IDGD	
Cn1nncc1NNC(=O)c1ccc(NS(=O)(=O)c2ccc3c(c2)OCCO3)cc1	816769359	DMOVYUQOTFBIQW-UHFFFAOYSA-N	430.446	1.144	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)c1ccc(N2C(=O)CCC2=O)cc1	871044729	LKCMIWDOJNUPNB-UHFFFAOYSA-N	446.257	1.943	50	20	IDGD	
O=C(NNC(=O)c1cc2c(C(F)(F)F)cc(O)nc2o1)c1ccc(-n2cnnn2)cc1	894390642	LNZHWCANYQQJOL-UHFFFAOYSA-N	433.306	1.603	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)[C@@H]2CS[C@H](Cc3ccccc3F)C(=O)N2)c1	896299569	FQUDAGPMRYHZSX-ZWKOTPCHSA-N	430.505	1.496	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)CN2C(=O)N[C@@]3(C[C@H](C)CC(C)(C)C3)C2=O)cc1	901393844	OWRRXDKIOONUJG-IVZQSRNASA-N	430.505	1.658	50	20	IDGD	
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC(=NNC(=O)[C@H](C)CN2CCC(C)CC2)CC1	914555020	GJAIXNMUAIDHKW-OAHLLOKOSA-N	438.598	1.651	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c(C)n1Cc1ccccn1	915190982	XSGIIFWUKBDZPA-UHFFFAOYSA-N	430.468	1.870	50	20	IDGD	
CN(CC(=O)NNC(=S)NC(C)(C)C)S(=O)(=O)c1ccc(Br)cc1	915595560	CSISTTFBKYSEGH-UHFFFAOYSA-N	437.385	1.363	50	20	IDGD	
CNS(=O)(=O)Cc1ccc(CNC(=O)NNC(=O)COc2cc(C)ccc2C)cc1	916229137	RPIXICNUXMMXOP-UHFFFAOYSA-N	434.518	1.262	50	20	IDGD	
CN(C)[C@@H](CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)c1ccsc1	916449822	OOFPXCGRCRWIJR-INIZCTEOSA-N	439.563	1.245	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)NCCCN1CCN(c2ccccc2)CC1	916490117	WGVZFZAMEJDHTF-UHFFFAOYSA-N	441.532	1.617	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2cc(Cl)c3c(c2)OCCO3)c1	916628415	NTYDUVBKLUQJCZ-UHFFFAOYSA-N	439.877	1.659	50	20	IDGD	
C[C@@H](CC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)CC(C)(C)C	916726583	OQBOOOZBUDNTNR-HNNXBMFYSA-N	425.551	1.931	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNS(=O)(=O)c2cccc(C(=O)N(C)C)c2)cc1	917725921	WRHLIDKPHBUUKY-CQSZACIVSA-N	435.502	1.564	50	20	IDGD	
COC(=O)c1ccc(S(=O)(=O)NNC(=O)c2ccc(F)cc2Br)cc1	917755295	SPXGPSZLIPWKHJ-UHFFFAOYSA-N	431.239	1.998	50	20	IDGD	
Cc1ccc([C@H](CNC(=O)NNC(=O)c2ccc3c(c2)OCCO3)N2CCOCC2)cc1	918099481	PDHSENWPFFLNDF-IBGZPJMESA-N	440.500	1.784	50	20	IDGD	
Cc1cccc(C)c1OC[C@H](C)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	919923265	FHPYXSBWXPSGFY-INIZCTEOSA-N	448.545	1.965	50	20	IDGD	
O=C(Cc1ccc(S(=O)(=O)N2CCOCC2)s1)NNC(=O)c1c[nH]c2ccccc12	920211715	PTGKRXATEQJANU-UHFFFAOYSA-N	448.526	1.254	50	20	IDGD	
O=C(CN1C(=O)Cn2c(cc3ccccc32)C1=O)NNC(=O)C12CC3CC(CC(C3)C1)C2	920254124	KYHLWBDFNZPWGS-UHFFFAOYSA-N	434.496	1.988	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1cn(C)nc1-c1cccnc1	920274919	IRZHTPHYYAPBPT-UHFFFAOYSA-N	427.490	1.158	50	20	IDGD	
Cc1ccccc1NC(=O)NNC(=O)c1cccc(S(=O)(=O)NC[C@H]2CCCO2)c1	920437517	XKTZXAVDGZAGCK-MRXNPFEDSA-N	432.502	1.919	50	20	IDGD	
O=C(NC[C@@H](c1cccc(F)c1)N1CCOCC1)NNC(=O)c1ccc2c(c1)OCCO2	921199409	KTGASWKALHIOOT-SFHVURJKSA-N	444.463	1.614	50	20	IDGD	
O=C(NCCOc1ccc2c(c1)CCC2)NNC(=O)c1csc(N2CCOCC2)n1	1115868451	DQLMGHNXSPAVIS-UHFFFAOYSA-N	431.518	1.491	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCC(NC(=O)c2cc(C)on2)CC1	1322836115	IHLKIFPWCFKQHP-UHFFFAOYSA-N	449.895	1.300	50	20	IDGD	
O=C(NNC(=O)c1n[nH]c2c1CCCC2)c1cccc(I)c1O	1325350811	ASPNXPLEUIDVBY-UHFFFAOYSA-N	426.214	1.674	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2ccnn2C[C@H]2CCOC2)c2ccccc2c1=O	1338342345	WCOZWPXGNIDCRE-CYBMUJFWSA-N	425.449	1.116	50	20	IDGD	
Cc1nc2ncccn2c1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2	1777903160	HCNIUJWTOWXDNJ-XIKOKIGWSA-N	436.310	1.265	50	20	IDGD	
Cc1cn2c(=O)c(C(=O)N3CC[C@]4(C3)CN(C(=O)C(Cl)Cl)CCO4)cnc2s1	1777990908	YOAPVQNZVKPFOY-KRWDZBQOSA-N	445.328	1.312	50	20	IDGD	
COc1ccnc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](F)Cl)C2)c1OC	1778025593	UCOFTTAAFHAQNO-VVFCZOMOSA-N	429.876	1.761	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)CCN3Cc4ccccc4C3=O)C2)C1	1778184075	XRADAGYEBVFMFZ-AVRDEDQJSA-N	433.936	1.880	50	20	IDGD	
O=C(C[C@H]1CNc2ccccc2O1)N1CC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1778931440	HYBZUXGWDUHWDS-ORAYPTAESA-N	428.316	1.883	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](C)S)CCO2	1780098491	MWISULIDCHOEHN-BLVKFPJESA-N	437.474	1.282	50	20	IDGD	
O=C1Cc2cccc(C(=O)N3CCO[C@@]4(CCN(C(=O)[C@@H](F)Br)C4)C3)c2N1	1781333043	LGTVWBXWXAIPOW-CRAIPNDOSA-N	440.269	1.315	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C23CC(C(=O)OC)(C2)C3)C1	1781960679	FHPIFZJTQSITGE-ROIMBAQASA-N	426.941	1.861	50	20	IDGD	
CC(=O)NCC(C)(C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)Br)C1	1781997332	RFENYTMGAUZKAJ-ZBQZNYHESA-N	446.386	1.446	50	20	IDGD	
CCOC(=O)c1ccc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](Cl)COC)CCO3)cc1	1782041297	SLDGAQYUNVMXKB-UWJYYQICSA-N	438.908	1.561	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCCn1ccnc1)C2	1782178029	FZKOHFOJZDBPIZ-SQGPQFPESA-N	426.945	1.431	50	20	IDGD	
C/C=C(/C)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2	1783077134	VPHXREJNXMMCKC-NSZDCLSGSA-N	429.945	1.915	50	20	IDGD	
C[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(C)(C)CCl)[C@H]2C1)[C@@H]1SC(=N)NC1=O	1783850436	HLVVIAAHXRFJDW-QMVSFRDZSA-N	444.985	1.034	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3c(Cl)cncc3Cl)C[C@@H]21)[C@@H](O)CCl	1784084062	KWSGWQDEOIGATE-NUZBWSBOSA-N	436.723	1.581	50	20	IDGD	
Cc1noc(-c2ccccc2)c1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]2C1	1784091164	WSFLNYHKNRXTCP-FJIDUMEYSA-N	447.919	1.843	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3CCCCN3C)[C@H]2C1	1784105989	UGJSHMDHKDCDQL-HMDCTGQHSA-N	430.387	1.481	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cn3nnc4ccccc43)C[C@@H]21	1784615961	DPHIHYNWTWVUGM-GGXPGOJBSA-N	433.940	1.819	50	20	IDGD	
CO[C@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)[C@H]2C1	1785078950	FURVZACYOVWERY-YXMSTPNBSA-N	447.960	1.133	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN(C)C(=O)OC(C)(C)C)[C@H]2C1	1786625827	ULGRUSRIOVTCBX-JONQDZQNSA-N	431.961	1.850	50	20	IDGD	
Cn1ccnc1C(=O)Nc1ccc(C2(NC(=O)c3cnccc3C(=O)NN)CCC2)cc1	1787490824	RDZBNFJNDSUACE-UHFFFAOYSA-N	433.472	1.480	50	20	IDGD	
COc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Br)C[C@@H]32)nc1	1787760445	FJGSBVHKRVNMIO-LVGORTOPSA-N	430.274	1.374	50	20	IDGD	
C[C@H](Nc1cccnc1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]2C1	1788764039	GJMJSANYYRYTMC-CAMMJAKZSA-N	434.613	1.713	50	20	IDGD	
CC(C)(NCCC#N)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]2C1	1789866199	LJUUVOYPNYAQSS-XMDUPGNXSA-N	433.380	1.484	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Cl)C[C@@H]21)c1cccc(N2CCOCC2)c1	1790119529	VDODNPBJXCIUGN-DSLXNQLJSA-N	439.915	1.651	50	20	IDGD	
COc1ncc(Cl)cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCBr	1795113663	JRWGKHYLHBEFPJ-QHBPRCKVSA-N	446.729	1.732	50	20	IDGD	
C[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCBr)c1ccc(O)cc1	1795115358	ZOLLAPJCZOGUIM-FRQROOTJSA-N	425.323	1.870	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1sccc1C)C2	1796441298	VOCKGUAKEHJIMG-AMFOTSNXSA-N	443.529	1.394	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc3ccccn13)C2	1799275370	QLYKUXOZNQJFPK-AODNKKSCSA-N	425.316	1.774	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(Cl)nc1Cl)C2	1800977116	RTHUSWOQDLYNQN-IQOUGMIPSA-N	436.723	1.845	50	20	IDGD	
Cn1ccc(CC(=O)N2CC[C@@H](CNC(=O)CCBr)[C@H]2c2cccnc2)n1	1806340327	BYWCWOCPTIJADZ-HNAYVOBHSA-N	434.338	1.849	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)C[C@H](N)c2cccnc2)[C@@H]1c1cccnc1	1807267655	TYABDTYQBVJRPG-JKBKZWBZSA-N	445.951	1.826	50	20	IDGD	
Cc1cncc(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)c1	1807369303	FNEVNSZVNAHYAR-KNQAVFIVSA-N	444.300	1.098	50	20	IDGD	
CCOC(=O)N[C@H](O)C(=O)N1CC[C@H](CNC(=O)[C@@H](Cl)CC)[C@@H]1c1cccnc1	1808264531	YSMGNRWTWGOEHC-WBTNSWJXSA-N	426.901	1.169	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cnc(O)[nH]2)[C@H]1c1cccnc1)[C@H](F)Br	1808668138	IZTBQIGETLLISS-DRZSPHRISA-N	426.246	1.520	50	20	IDGD	
Cc1nc(C)c(C(=O)N2CCC3(CCCN(C(=O)c4ccc(B(O)O)cc4)C3)CC2)s1	1809967682	DUDHIPXDGUUOJJ-UHFFFAOYSA-N	441.362	1.598	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)c2ccccc2)[C@H]1c1cccnc1	1810303559	VGIGOTGFQLGPTE-RXVVDRJESA-N	444.495	1.714	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)N1CC[C@H](CNC(=O)[C@@H](C)Br)[C@@H]1c1cccnc1	1812865202	VGPAUANYTLSSAU-RZFFKMDDSA-N	440.342	1.318	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)[C@H]2[C@H]3SC=C[C@H]32)[C@H]1c1cccnc1	1813073792	MJHBTUFHGXFYLF-BQEVRZRTSA-N	443.573	1.336	50	20	IDGD	
C#CCCCCC(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1813228219	UCNLCGMBUWTRGS-CVDCTZTESA-N	427.549	1.654	50	20	IDGD	
Cc1nnc(CCC(=O)N2CCCC[C@H]2c2cc(NC(=O)[C@H](O)CCl)n[nH]2)s1	1814868372	YYOURQYZFFCHKG-QWHCGFSZSA-N	426.930	1.794	50	20	IDGD	
C[C@@H](CS(C)(=O)=O)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCBr)n[nH]1	1816781182	FXOQELDWFOMJBZ-WCQYABFASA-N	449.371	1.868	50	20	IDGD	
Cn1c(C(=O)N[C@@H]2CCc3nc(NC(=O)CO[Si](C)(C)C)sc3C2)cccc1=O	1820160977	MQVZDPHOEKPPIZ-GFCCVEGCSA-N	434.594	1.919	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)C(C)=O)CC2	1821303173	WHIXXUDTBBOCOV-NSHDSACASA-N	446.441	1.791	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(C#N)c[nH]2)[nH]n1	1822415134	UKSCHCNSFLJCIH-INIZCTEOSA-N	426.481	1.288	50	20	IDGD	
Cc1nccn1[C@@H](C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1	1822416586	IWJRVOJADQOZJD-WMLDXEAASA-N	444.540	1.541	50	20	IDGD	
C[C@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](F)Br)[nH]n1)n1cncn1	1822768427	GCURNWCTMKVLOX-SUZMYJTESA-N	428.266	1.945	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCc2cnccn2)n[nH]1	1822824980	PIIXBQJAJLSLMU-QGZVFWFLSA-N	442.524	1.198	50	20	IDGD	
N[C@@H](Cc1cscn1)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H](O)CCl)CC1	1824183166	PVMORODGGDBECS-YESZJQIVSA-N	428.986	1.232	50	20	IDGD	
Cc1nc2ncccn2c1C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H](O)CCl)CC1	1824186227	LOOVDLACZGLDBY-DLBZAZTESA-N	433.940	1.871	50	20	IDGD	
O=C([C@H](O)CCl)N1CCC([C@H]2CCCCN2C(=O)Cn2nnc3ccccc32)CC1	1824849357	BXEDUKQZYFEZNG-IEBWSBKVSA-N	433.940	1.651	50	20	IDGD	
Cc1[nH]nc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)c1F	1825606718	PSVOHJPITWSRGY-GOSISDBHSA-N	442.300	1.084	50	20	IDGD	
Cc1ccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)nc1	1826074936	JNCOYZSAUXECCO-HXUWFJFHSA-N	429.565	1.996	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cnc(O)nc2O)CC1	1827592914	YACMGIWJCLCGCY-GJZGRUSLSA-N	426.901	1.375	50	20	IDGD	
O=C([C@@H](O)CCl)N1CCC([C@@H]2CCCCN2C(=O)Cc2ccc3ncnn3c2)CC1	1830154763	WGGZOXJZMYVGRP-ROUUACIJSA-N	433.940	1.491	50	20	IDGD	
O=C(Cc1cccc2ncccc12)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1831351324	XDJADKWXGBJQCV-CTNGQTDRSA-N	435.883	1.768	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)n3cccc3C=O)C2)C1	1831647799	YYKNTRUOSSXMDU-MMOPVJDHSA-N	439.940	1.726	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3(C(=O)OCC)CC3)C2)C1	1831656114	AXFOGMRJFKMVQD-BEFAXECRSA-N	430.929	1.194	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2C[C@]2(F)Cl)CC1	1831957866	BGLKPFNAFJITLN-BBTUJRGHSA-N	436.720	1.524	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)CCCn2ccnc2)CC1	1832159197	ZWGMPWVHYKLJNF-FQEVSTJZSA-N	446.596	1.656	50	20	IDGD	
Cc1ccc(CCC(=O)NC2CCN(C3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)nc1	1833823015	ASQAXVIWMTXTKA-FQEVSTJZSA-N	436.984	1.494	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3sc(C)nc3C)CCO2)C1	1834079407	KEBHEQPOLYAZNB-KBXCAEBGSA-N	431.942	1.084	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)C1CCCCC1	1834375631	UMGRSOPMJOBKFJ-UHFFFAOYSA-N	441.381	1.132	50	20	IDGD	
CCn1nccc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)CBr)C2)C1	1834411172	HQHBIXSAEXONBK-KSSFIOAISA-N	443.342	1.004	50	20	IDGD	
COCCOCC(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)CBr)CC2)CC1	1834565386	RAHJANSKWQGPNB-HNNXBMFYSA-N	448.402	1.252	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H]3CNc4ccccc43)CCO2)C1	1835705352	GXWHQQYHRIORMG-VGSWGCGISA-N	435.952	1.917	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3ccsc3)CCO2)C1	1836007359	INABPRWUHQTCHA-RDTXWAMCSA-N	445.379	1.921	50	20	IDGD	
COc1ccc(C(=O)NC2CCN(C3CCN(C(=O)CO[Si](C)(C)C)CC3)CC2)nn1	1836057637	LFJBBHBBDVCZPP-UHFFFAOYSA-N	449.628	1.522	50	20	IDGD	
CCC(=O)N[C@H](C)C(=O)N1CCC(N2CCC(NC(=O)[C@H](F)Br)CC2)CC1	1836413563	JGEQDFGJLVAOQN-WBMJQRKESA-N	449.365	1.163	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCC(OC2CCN(C(=O)[C@@H]3CCCS3(=O)=O)CC2)CC1	1836624150	CITXQWGPUARUPP-KRWDZBQOSA-N	449.013	1.827	50	20	IDGD	
C[C@@H](Cn1cccn1)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836715740	YLZGKDBMOZVPIY-YJBOKZPZSA-N	426.945	1.118	50	20	IDGD	
CSc1cccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)c1O	1838564232	DRQICCIQRBAKRX-CRAIPNDOSA-N	432.901	1.719	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](C)n3ccnn3)CC2)CC1	1838730378	OQNYHMUDIPBZDQ-PBHICJAKSA-N	427.933	1.092	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc([N+](=O)[O-])[nH]3)CCO2)C1	1838827507	RFBBHICPZSTAQW-IRXDYDNUSA-N	449.291	1.229	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3CC[C@H](C(=O)OC)C3)C2)C1	1839141465	JKNMJTMSTXHJEX-ULMVMLMRSA-N	430.929	1.050	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc4snnc4c3)C2)C1	1839146767	VPMHDYGGWIDARI-UGSOOPFHSA-N	439.925	1.174	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CC(c4ccccc4)=NN3)C2)C1	1839148265	SNPWQNJTLRROSY-KPLVRAHFSA-N	448.951	1.226	50	20	IDGD	
CCCCC[C@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1	1839905809	XXJDALJXVPXVGW-AVRDEDQJSA-N	440.585	1.032	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](O)Cc3ccccc3)CCO2)C1	1839956315	MGQDIOOMESJPKO-XMSQKQJNSA-N	438.952	1.311	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(C)no3)C2)C1	1839963845	YGKMJNKYVSPYGR-CXAGYDPISA-N	430.299	1.227	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3ccccc3C)C2)C1	1840155428	BPKLZGZPQHBWMO-UGKGYDQZSA-N	438.952	1.638	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cc(C)cc(F)c3)C2)C1	1840156381	RLBAZPLKWMAEPH-NQIIRXRSSA-N	442.915	1.387	50	20	IDGD	
O=C(C(Cl)Cl)N1CCO[C@@]2(COCCN(C(=O)C3(c4ccccc4)CC3)C2)C1	1840187409	YMSNOLSOOZQQNA-IBGZPJMESA-N	427.328	1.978	50	20	IDGD	
O=C(c1nc2ccccc2[nH]1)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840187583	KSNJXWBBKJYWKU-GOSISDBHSA-N	427.288	1.437	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CC[C@H]3CCOC3)CCO2)C1	1840590558	SKVRSCPSGBAKAX-MPGHIAIKSA-N	433.343	1.043	50	20	IDGD	
COc1ccc(CC(=O)N2CC3(CCCN3C(=O)[C@H](O)CCl)C2)c(Br)c1	1841347725	CNSJXPHZWVWNRG-OAHLLOKOSA-N	445.741	1.803	50	20	IDGD	
CC(C)(C)OC(=O)N1CC2(CC2)C[C@H]1C(=O)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1	1841348124	LODWWLSYNMIRAO-LSDHHAIUSA-N	441.956	1.579	50	20	IDGD	
O=C(c1cc(Br)ncc1Cl)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1	1841350380	YHJONAWCISSNHH-NSHDSACASA-N	437.121	1.914	50	20	IDGD	
CS(=O)(=O)c1ccc(F)c(C(=O)N2CC3(CCCN3C(=O)CCBr)C2)c1	1842638445	DRAGKDQDUZJCGC-UHFFFAOYSA-N	447.326	1.831	50	20	IDGD	
O=C([C@@H]1[C@H]2Sc3ccccc3[C@@H]21)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843011630	XSGRJQDTJOAVHO-AABGKKOBSA-N	434.326	1.071	50	20	IDGD	
O=C([C@H](Br)Cc1ccccc1)N1CC2(CCCN2C(=O)Cn2ccnn2)C1	1843103209	YJXOXGLLNBQTOP-MRXNPFEDSA-N	432.322	1.488	50	20	IDGD	
COc1cnc(C(=O)N2CC3(CCCN3C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)c(F)c1	1843415671	YXYWUBFZGVKGRM-DHRITJCHSA-N	442.451	1.180	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2ccc(F)cc2F)C1	1844970230	FUCXVVAYPBZMJO-DHRITJCHSA-N	429.427	1.916	50	20	IDGD	
O=C([C@H](O)CCl)N1CC2(CCCN2C(=O)[C@H](O)c2cccc(Br)c2)C1	1845039762	NOSBVDGDGIQNGG-ZIAGYGMSSA-N	431.714	1.286	50	20	IDGD	
O=C([C@@H](O)CCl)N1CC2(CCCN2C(=O)c2cccc(I)c2)C1	1845303845	XHUXARMIKXJOIH-ZDUSSCGKSA-N	448.688	1.708	50	20	IDGD	
CCN(CC)[C@@H](C(=O)N1CCCC12CN(C(=O)c1ccc(B(O)O)cc1)C2)c1ccccc1	1845838530	AYDGJGOHFTYDKI-JOCHJYFZSA-N	449.360	1.267	50	20	IDGD	
C[C@H](Br)C(=O)N1CC2(CCCN2C(=O)[C@@H]2C[C@@]23C(=O)Nc2ccccc23)C1	1846183683	RLRPVMXRGPTDCB-SIFORAMQSA-N	432.318	1.883	50	20	IDGD	
CN(CC(=O)N1CC2(CCCN2C(=O)[C@@]2(C)CC2(F)F)C1)NC(=O)NCc1ccccc1	1846987769	BTYKMOUVEHSUNY-HXUWFJFHSA-N	449.502	1.581	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](CC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl)C1CC1	1847557508	DOBIDVZUICRGSU-UGUYLWEFSA-N	429.945	1.481	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@](F)(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](O)CCl)C1	1847559968	WCZAOSJFSHJOCU-MNUAXYBXSA-N	433.908	1.137	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@]1(O)CCN(C(=O)OC(C)(C)C)C1	1847867880	LVBPZHZZGMNDNW-JXSLOMFPSA-N	443.972	1.968	50	20	IDGD	
COc1ccc(-n2nnnc2SCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1	10861246	MHXYMDQIZNRYPH-UHFFFAOYSA-N	429.418	1.132	50	20	IDGD	
CCn1c(NNC(=O)c2cc(S(=O)(=O)NC3CC3)ccc2C)nc2ccccc2c1=O	11165909	NOTNTLYXXKRVJG-UHFFFAOYSA-N	441.513	1.922	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)Cn2nnc3ccccc3c2=O)cc1OC	12695732	XINADHFLTLWSBU-UHFFFAOYSA-N	425.445	1.440	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)c2ccc3c(c2)CCCN3S(C)(=O)=O)cc1	17148955	FZBYPQUEAULXFL-UHFFFAOYSA-N	445.497	1.325	50	20	IDGD	
Cc1cccc(NC(=O)CN2CCN(CC(=O)NNC(=O)c3ccc(F)cc3)CC2)c1C	19537631	OBKIEMGVXKBVBG-UHFFFAOYSA-N	441.507	1.460	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C2CCN(S(=O)(=O)c3ccccc3)CC2)cc1OC	26959735	PIHPSLRVJGLCDE-UHFFFAOYSA-N	447.513	1.566	50	20	IDGD	
CNS(=O)(=O)c1ccc(C(=O)NNC(=S)Nc2cccc(Br)c2)cc1	27010710	GPRCOGSVQYECKG-UHFFFAOYSA-N	443.348	1.989	50	20	IDGD	
Cn1c(=O)c2ccc(C(=O)NNC(=O)c3cc4c(s3)CCCCC4)nc2n(C)c1=O	105813332	VDRDSUXYIMRDJI-UHFFFAOYSA-N	427.486	1.037	50	20	IDGD	
CSCC[C@H](NC(=O)c1cccc(C)c1)C(=O)NNC(=O)CNC(=O)c1ccco1	725739946	PFBDQCNTIYLYNQ-HNNXBMFYSA-N	432.502	1.017	50	20	IDGD	
CC[C@H](C)C(=O)N1CCC[C@H](C(=O)OCC(=O)NNC(=O)c2ccc(OC)c(OC)c2)C1	726040885	ZSBBSFQMOPPHGZ-HOCLYGCPSA-N	449.504	1.293	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)CNC(=O)c1cccs1)c1ccc(N2CCOCC2)cc1	726247966	VYPIFDBHXZEQIP-CQSZACIVSA-N	431.518	1.406	50	20	IDGD	
C[C@@H](CC(=O)NNC(=O)c1ccc(CSc2nncn2C)cc1)NC(=O)C1CCCC1	727098520	CEWZKHRCGNLAKP-AWEZNQCLSA-N	444.561	1.953	50	20	IDGD	
COCCNC(=O)CN1CCN(C(=O)/C(C#N)=C/c2cc(C)n(CCC(C)C)c2C)CC1	728195565	IQOSOVSNAWOSGK-PXLXIMEGSA-N	443.592	1.965	50	20	IDGD	
CNS(=O)(=O)c1cccc([C@@H](C)NC(=O)NNC(=O)c2cccc(OC(F)F)c2)c1	728755462	OEHDVSHZTHGCFD-LLVKDONJSA-N	442.444	1.901	50	20	IDGD	
O=C(NCc1ccc2c(c1)OCCCO2)NNC(=O)C1CCN(c2ncccn2)CC1	728954976	AKUKCQLVYNPMBK-UHFFFAOYSA-N	426.477	1.385	50	20	IDGD	
O=C(NCc1cccc(OCC(F)F)c1)NNC(=O)C1CCN(c2ncccn2)CC1	728955485	YIGGMDNFXDEGHJ-UHFFFAOYSA-N	434.447	1.868	50	20	IDGD	
CC1CCN(S(=O)(=O)c2ccc(C(=O)NNC(=O)NCC(F)(F)F)s2)CC1	730291329	RBUTWSLHCLNATG-UHFFFAOYSA-N	428.458	1.675	50	20	IDGD	
COc1ccc(C(=O)N2CCOCC2)cc1NC(=O)NNC(=O)COc1ccccc1O	730899792	RARVDBVJXRYPAW-UHFFFAOYSA-N	444.444	1.105	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCCC2)cc1	731493173	UIIIFWWLZZADGX-UHFFFAOYSA-N	431.514	1.874	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN(C)c2ncnc3[nH]cnc23)cc1Br	732033464	HYJJEOUIPFFKIH-UHFFFAOYSA-N	434.254	1.021	50	20	IDGD	
C#CCN1CCC[C@H]1C(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	732051156	YEKVDFSEALNODF-FQEVSTJZSA-N	429.480	1.303	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2c[nH]nc2C)cc1S(=O)(=O)Nc1ccc(C)cc1	732082847	PJLVNYJQYVWUDP-UHFFFAOYSA-N	443.485	1.911	50	20	IDGD	
O=C(NCCN1CCN(C(=O)C2CCCCC2)CC1)NNC(=O)c1cccc([N+](=O)[O-])c1	733652080	TZCUSRKLFGJUII-UHFFFAOYSA-N	446.508	1.263	50	20	IDGD	
C[C@@H](CS(C)(=O)=O)NC(=O)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1	733662565	NHNCZSFYLJFDSZ-JXFKEZNVSA-N	444.557	1.377	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)CNC(=O)N1CCc2ccccc2C1	735027774	DETXGONJDSPUOH-UHFFFAOYSA-N	434.500	1.514	50	20	IDGD	
CCOc1ccc(/C=C(/C#N)C(=O)NCCNS(=O)(=O)c2ccccc2[N+](=O)[O-])cc1	735060749	UTPIAPWIELNODN-SSZFMOIBSA-N	444.469	1.995	50	20	IDGD	
CCc1nc(C(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)nn1-c1ccccc1	735422639	WKHVDSSXBSCLIL-UHFFFAOYSA-N	425.445	1.930	50	20	IDGD	
Cc1cc(CC(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)no1	735840332	GDHDCBRYBISHPB-UHFFFAOYSA-N	428.470	1.465	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN2CCN(C(=O)Cc3ccccc3F)CC2)cc1C	736308417	JNEPNDVBLYERDZ-UHFFFAOYSA-N	446.548	1.906	50	20	IDGD	
CN1CCN(CCCCNC(=O)NNC(=O)c2cc(F)ccc2Br)CC1	737065020	MMURRPOLDOGYSO-UHFFFAOYSA-N	430.322	1.560	50	20	IDGD	
CCn1nc(C)c(S(=O)(=O)NNC(=O)c2cc(OC)ccc2Br)c1C	741657599	TZJOFGVUSJFIEE-UHFFFAOYSA-N	431.312	1.914	50	20	IDGD	
Cn1nc(SCC(=O)NN=Cc2cc(Cl)ccc2Br)c(=O)n(C)c1=O	743434517	YRANLYUJPNYPNX-UHFFFAOYSA-N	446.714	1.137	50	20	IDGD	
CS(=O)(=O)N1CCC(CNC(=O)NNC(=O)c2cccc(Br)c2)CC1	743576082	RQMRVSNXOWGRLO-UHFFFAOYSA-N	433.328	1.065	50	20	IDGD	
O=C(NNC(=O)c1cccc(CN2C(=O)CNC2=O)c1)Nc1ccc(OC(F)F)cc1	743832749	ZHRGZUYUPHHNAR-UHFFFAOYSA-N	433.371	1.806	50	20	IDGD	
O=C(NNC(=O)c1ccc(Br)cc1O)c1csc(N2CCOCC2)n1	744315193	UJGSPNFMSVRATO-UHFFFAOYSA-N	427.280	1.523	50	20	IDGD	
COc1ccc(CN2C[C@H](C(=O)OCC(=O)NNC(=O)c3cccc(C)c3)CC2=O)cc1	744926816	MNJDLUKAAJWZDU-GOSISDBHSA-N	439.468	1.357	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)N[C@H]1CCN(c2ccccc2Cl)C1=O	745813046	IHTUZXAMLHFOOY-ZDUSSCGKSA-N	433.808	1.703	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2ccc(-c3n[nH]c(C)n3)cc2)cc1	746094522	YOZAVVUUGYYWSL-UHFFFAOYSA-N	442.501	1.170	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NNC(=O)Cc2cn3ccccc3n2)cc1	746544940	AVDPWHRAJQGHRY-SFHVURJKSA-N	441.513	1.186	50	20	IDGD	
Cc1c(C(=O)NNC(=S)Nc2cccc(Cl)c2)cnc2c1c(=O)n(C)c(=O)n2C	748048127	FJKGSGUVGIYDGH-UHFFFAOYSA-N	432.893	1.225	50	20	IDGD	
CCCC(O)(CCC)CC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	748621271	ZFTGFKIWQNDQGV-UHFFFAOYSA-N	426.583	1.787	50	20	IDGD	
COc1cccc(C(=O)NNS(=O)(=O)c2ccc(OCC(=O)O)c(Cl)c2)c1O	748691003	IPXHPQGMGDWKMK-UHFFFAOYSA-N	430.822	1.141	50	20	IDGD	
O=C(NNc1c(F)cc(F)cc1Br)[C@H]1Nc2ccccc2S(=O)(=O)N1	750046655	GIFPZJCLXLBJIP-ZDUSSCGKSA-N	433.234	1.901	50	20	IDGD	
CC(C)(C)OC(=O)NCCCn1ccc2cc(C(=O)NNC(=O)C(=O)NC3CC3)ccc21	751308170	GBESAJNBOOVZNX-UHFFFAOYSA-N	443.504	1.596	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3ccc4nc(O)n(C)c4c3)n[nH]2)cc1OC	752313574	AXSOKDJSYOFQEJ-UHFFFAOYSA-N	436.428	1.761	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)N3CCN([C@H](C)C(=O)N4CCCC4)CC3)cc2C1	755086053	JVTYTSUBKBNWAS-HZPDHXFCSA-N	447.605	1.856	50	20	IDGD	
O=C(NNc1ccc(C(F)(F)F)nn1)C1CCN(S(=O)(=O)c2cccnc2)CC1	755197297	FYFRGDMKTIUDJJ-UHFFFAOYSA-N	430.412	1.434	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)Nc1ccc(NC(=O)[C@H]2CCCO2)cc1	755640632	KHKUVVYWZXJTMY-QZTJIDSGSA-N	426.429	1.797	50	20	IDGD	
COCc1cccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c1	755687496	QHYRXKOTVWRSAQ-UHFFFAOYSA-N	448.501	1.320	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2cc(C(=O)OC)ccc2F)c2ccccc2c1=O	755846499	ACXMRCUGDLCQQV-UHFFFAOYSA-N	427.392	1.809	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)Nc2cccc(OCCS(C)(=O)=O)c2)cc1	756297085	IGELDMQSZBOPSF-UHFFFAOYSA-N	435.502	1.904	50	20	IDGD	
Cc1nc(-c2cccc(NC(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)c2)n[nH]1	756355939	XRTXBCSIZANAJR-UHFFFAOYSA-N	443.489	1.497	50	20	IDGD	
C[C@H]1CN(C(=O)Cn2cc(NC(=O)NNC(=O)c3ccc(Cl)nc3)cn2)C[C@@H](C)O1	756837078	FMEABXBXLJETKD-TXEJJXNPSA-N	435.872	1.034	50	20	IDGD	
CC[C@H](C)n1nc(NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1C	757910718	NSJUQBSUPAZTDY-AWEZNQCLSA-N	436.538	1.944	50	20	IDGD	
CS(=O)(=O)N1CCc2c(NC(=O)NNC(=O)c3cc(-c4cccs4)[nH]n3)cccc21	758301063	UEBXFTXRHPVTAS-UHFFFAOYSA-N	446.514	1.927	50	20	IDGD	
O=C(NNc1nccc(N2CCOCC2)n1)c1cccc(I)c1O	758354752	QDYZIRZXMFHFHI-UHFFFAOYSA-N	441.229	1.380	50	20	IDGD	
CC1(C)C(=O)N(C[C@](C)(O)C(=O)OCC(=O)NNC(=O)c2ccccc2)c2ccccc21	758876990	DXRGRFQBIVXAFU-QHCPKHFHSA-N	439.468	1.066	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)NC1CCC(O)(c2ccccc2)CC1	760670961	VGJUDFUBNLALDN-UHFFFAOYSA-N	438.532	1.854	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNC(=O)C(C)(C)C)cc1S(=O)(=O)N(CC)CC	761071806	GGZMOJQZFMTHCK-UHFFFAOYSA-N	442.538	1.248	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)c2cc(NS(C)(=O)=O)c(OC)c(OC)c2)n1	762907854	INCPSODKQPPYTP-UHFFFAOYSA-N	438.510	1.468	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)[nH]n1)c1cnc2c(c1)c(O)nc(=O)n2C1CC1	762932505	QBSGNAQBCSZCCS-UHFFFAOYSA-N	431.412	1.297	50	20	IDGD	
CCC(=O)NNC(=O)C(=O)Nc1ccc(Br)c(I)c1	763444648	YRRXBXMLBMEJKT-UHFFFAOYSA-N	440.035	1.550	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1	763531809	RSIWDKNSHRYNBG-UHFFFAOYSA-N	439.516	1.384	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNC(=O)c2c(C)nc3ccccn23)cc1OCC	763627649	CKSFRLRECAZBJF-UHFFFAOYSA-N	425.445	1.840	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2c(F)cccc2-n2cccn2)c1	763665985	RVHJOXLWNMUEEE-UHFFFAOYSA-N	425.420	1.793	50	20	IDGD	
CC(C)Cn1ncc(NC(=O)C(=O)NNC(=O)COc2ccccc2F)c1C(F)F	763681101	ZEMIUMIRLCOJDG-UHFFFAOYSA-N	427.383	1.781	50	20	IDGD	
O=C(NNC(=O)C1=S=C2CCCC2=C1)C(=O)Nc1ccc([S@@](=O)C(F)(F)F)cc1	763782951	IXBKABDAJZRVTP-GDLZYMKVSA-N	445.444	1.602	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2ccccc2SC)c2ccccc2c1=O	763785111	FIVDRLJYIPJKBO-UHFFFAOYSA-N	425.470	1.538	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc2c(c1)nc1n2CCCCC1	763808031	TXECCBHYJDIGFR-UHFFFAOYSA-N	446.467	1.799	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(S(=O)(=O)N(C)C3CC3)cc2)cc1	763832174	RYGYCVNQKCMWSM-UHFFFAOYSA-N	444.513	1.432	50	20	IDGD	
CCOC(=O)N(C)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)cc1	763838765	AEBAJLRHPXZVOM-UHFFFAOYSA-N	432.408	1.583	50	20	IDGD	
Cc1cc(S(C)(=O)=O)ccc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccc(F)cc1	763867209	TUJZUSJBAKHANU-GFCCVEGCSA-N	437.449	1.091	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)C(=O)Nc1cccc(C(N)=O)c1	763884789	XUUNMUHSCIIRRN-SNVBAGLBSA-N	449.261	1.101	50	20	IDGD	
CCCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)Cc2ccc(F)cc2)cc1Cl	763920580	MDLFKOFRSMMFMN-UHFFFAOYSA-N	434.855	1.948	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3ccc(-n4cnnn4)cc3)cc2C1	763940850	JGOAJFUCZLXJPW-NSHDSACASA-N	425.474	1.248	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3ccc4c(c3)NC(=O)[C@@H](C)O4)cc2C1	763943081	QRDHXCNNXYXXRC-GHMZBOCLSA-N	442.497	1.992	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ccc[nH]2)c(Br)cc1F	763979947	AASXAHMLGIRSGP-UHFFFAOYSA-N	427.186	1.103	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc[nH]2)c(OCC(F)(F)F)c1	763981244	YNAWMSYDEWRHQG-UHFFFAOYSA-N	428.323	1.142	50	20	IDGD	
CN(C)CCc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(Br)c2)cc1	764063517	QINYFDBOOPMQQB-UHFFFAOYSA-N	433.306	1.953	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc([C@H](C)N3CCOCC3)cc2)c1O	764130978	LUTCEBCJXNAUNQ-AWEZNQCLSA-N	442.472	1.194	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2O1)C(=O)Nc1ccc(C(=O)NC2CCCC2)cc1	764165457	ZAOBANZQAQTBLX-LJQANCHMSA-N	436.468	1.449	50	20	IDGD	
CS(=O)(=O)N1CCc2c(NC(=O)C(=O)NNC(=O)CCCc3ccccc3)cccc21	764228303	XIRSXKUJHIRCPZ-UHFFFAOYSA-N	444.513	1.118	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)ccc1O)C(=O)Nc1cccc(-c2nnco2)c1	764280404	OKYQIMBNHSSHDI-UHFFFAOYSA-N	446.217	1.604	50	20	IDGD	
COC(=O)c1cc(OC)ccc1NC(=O)C(=O)NNC(=O)CSc1ccccc1O	764403863	DUVNGMZCASBMMV-UHFFFAOYSA-N	433.442	1.066	50	20	IDGD	
O=C(CCC(=O)N1CCN(c2ncccn2)CC1)NNC(=O)C12CC3CC(CC(C3)C1)C2	764534511	RKJWONHUWQQKIC-UHFFFAOYSA-N	440.548	1.269	50	20	IDGD	
CC(=NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C)c1ccc2c(c1)Cc1ccccc1-2	764820362	ZZSXMRUZTJFXJZ-UHFFFAOYSA-N	442.479	1.545	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCN([C@@H](C)c3ccsc3)CC2)cc1OC	765074236	CQXAWNRFWPSQLV-HNNXBMFYSA-N	432.546	1.905	50	20	IDGD	
CNc1c(C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cccc1[N+](=O)[O-]	765371439	XHFMTJTUEMRJKD-UHFFFAOYSA-N	435.462	1.027	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1ccc(C)c(C(=O)NNC(=O)c2cc(C)[nH]n2)c1	765585920	JNNQNMAXSWGWRZ-UHFFFAOYSA-N	443.485	1.911	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)CC(F)(F)F)c(I)c1	765698721	QJWQNLLUGMJIML-UHFFFAOYSA-N	445.135	1.338	50	20	IDGD	
N#Cc1ccc(CC(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)cc1	765753440	YPXXUMGHLSJNQR-UHFFFAOYSA-N	425.920	1.719	50	20	IDGD	
O=C(CCOCC(F)(F)F)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	766662664	AFYWRELZKVLUSZ-UHFFFAOYSA-N	436.862	1.574	50	20	IDGD	
Cc1ccc([C@@H](CNC(=O)NNc2nc(O)c3cnn(C)c3n2)N2CCOCC2)cc1	770351697	TVIFGWIQASPOPG-MRXNPFEDSA-N	426.481	1.077	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2ccc3nc(C(F)(F)F)cn3c2)n1	770432414	UQNPYJXCRSRUED-UHFFFAOYSA-N	441.391	1.665	50	20	IDGD	
Cc1cc(Br)c(F)cc1NC(=O)C(=O)NNC(=O)COc1ccccc1C#N	770772922	CAMJRGRCBLYDRZ-UHFFFAOYSA-N	449.236	1.933	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)N[C@@H]1CC(=O)N(c2c(F)cccc2F)C1	771436266	VGCLJECTFDXJFK-CYBMUJFWSA-N	429.383	1.351	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)C3(O)CCOCC3)c2)c(C)c1	771852362	IGZRISLDWGTFGW-UHFFFAOYSA-N	447.513	1.407	50	20	IDGD	
COc1cc(C(=O)NNC(=O)N[C@H]2CCCN(CC(F)(F)F)C2=O)cc(OC)c1OC	772972936	ZUTVAFPVWIGLHR-NSHDSACASA-N	448.398	1.210	50	20	IDGD	
CC(C)[C@@H](C(=O)NNC(=O)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1)N1C[C@@H](C)O[C@H](C)C1	773417828	IHKDGZMVEGBKSJ-TVFCKZIOSA-N	440.585	1.915	50	20	IDGD	
Cc1nc(NC(=O)C(=O)NNC(=O)COc2ccccc2F)ccc1Br	773526067	SASNKCDJFGEMPB-UHFFFAOYSA-N	425.214	1.457	50	20	IDGD	
O=C1CN(S(=O)(=O)c2ccc(C(=O)NNc3ncc(Cl)cc3Cl)cc2)CCN1	775276632	OBOUXYCCTNZUOK-UHFFFAOYSA-N	444.300	1.266	50	20	IDGD	
Cc1sc2ncc(C(=O)NNc3nc(O)c4cnn(C(C)(C)C)c4n3)c(=O)n2c1C	775735215	NHFQBDFOUMQKOU-UHFFFAOYSA-N	428.478	1.730	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NC[C@@H]2COC3(CCCCC3)O2)nc1	776069380	OPYBFMBARHJFMC-CQSZACIVSA-N	427.527	1.470	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)N[C@@H](C)CS(=O)(=O)c2ccc(C)cc2)cc1	776194381	LSAUGJSTBVTKPT-HNNXBMFYSA-N	435.502	1.575	50	20	IDGD	
CC(C)CS(=O)(=O)N1CCC(NC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)CC1	776912036	LCCMPNUHTVQOJP-UHFFFAOYSA-N	448.549	1.267	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1scnc1Br	777795781	HLCLFNJRIRPADP-UHFFFAOYSA-N	432.325	1.582	50	20	IDGD	
COc1ccc(Br)c(CNC(=O)NNC(=O)CNC(=O)OC(C)(C)C)c1	778613359	LKEMMRYSTOEMNU-UHFFFAOYSA-N	431.287	1.813	50	20	IDGD	
COCC(=O)N1CCc2cc(NC(=O)C(=O)NNC(=O)c3ccc4ccccc4c3)ccc21	778714704	XQPMRNMCRHFVQM-UHFFFAOYSA-N	446.463	1.775	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)N[C@H]1CCn2ccnc2C1	779664782	BWDSZVCWQAQVBC-INIZCTEOSA-N	446.533	1.017	50	20	IDGD	
Cc1noc(-c2ccccc2)c1NC(=O)C(=O)NNC(=O)Cc1nc2ccccc2n1C	782888076	RXNWYEJWFRHUKY-UHFFFAOYSA-N	432.440	1.865	50	20	IDGD	
CN(C)C(=O)COc1cccc(NC(=O)C(=O)NNc2ccc(Br)nc2)c1	784806596	LAJNNXLGSQUBFJ-UHFFFAOYSA-N	436.266	1.393	50	20	IDGD	
CN(C)c1nccc(NNC(=O)C(=O)Nc2cccc(N3C(=O)c4ccccc4C3=O)c2)n1	784971309	YGHCNUQFBIUJOU-UHFFFAOYSA-N	445.439	1.425	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2cccc(CN3CCCCC3=O)c2)n1	785225981	BPPHXGSPOBYMNF-UHFFFAOYSA-N	439.520	1.917	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2ccc(C(=O)NCC(C)C)cc2)n1	785227927	ZXAQIHLERAYDRV-UHFFFAOYSA-N	427.509	1.790	50	20	IDGD	
CC[C@]1(C)Oc2ccc(NC(=O)C(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)cc2O1	785990235	CVMWLTODUGPFMU-HXUWFJFHSA-N	447.469	1.387	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)C(=O)Nc2ccc(Cl)cc2-n2cccn2)c1	788332396	CYZCOCGADWTJKG-UHFFFAOYSA-N	441.835	1.279	50	20	IDGD	
CC(C)(C)c1cc(NC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)n(-c2ncccn2)n1	789272899	MZFHSNIHTBISCP-HNNXBMFYSA-N	437.460	1.953	50	20	IDGD	
CC(C)(C)OC(=O)N1CC2(C[C@H]2C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)C1	789283617	FBNIBYTUCZQODS-AWEZNQCLSA-N	448.432	1.156	50	20	IDGD	
COc1ccc(NNC(=O)NC[C@H](Cc2cccc(F)c2)C(=O)N2CCOCC2)nc1	789841940	UHRMISQVJMULNU-INIZCTEOSA-N	431.468	1.573	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)[C@H]1CCCN(S(=O)(=O)c2ccccc2)C1	790062950	DMVLGVDDUQXHRW-HNNXBMFYSA-N	427.523	1.024	50	20	IDGD	
Cc1c(C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)nnn1Cc1ccc(F)cc1F	790111748	PEGYZHZAZYSTLG-KRWDZBQOSA-N	429.383	1.514	50	20	IDGD	
CC(C)(C)n1cc(C(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)nn1	790115723	XCNDVSXNIGIIDM-UHFFFAOYSA-N	445.483	1.866	50	20	IDGD	
COC(=O)c1ccccc1S(=O)(=O)N1CCC(C(=O)NNc2ncccc2C)CC1	791224152	PVQVAJIZWPGETB-UHFFFAOYSA-N	432.502	1.721	50	20	IDGD	
C[C@@](O)(Cn1cc(C(F)(F)F)ccc1=O)C(=O)NNC(=O)C12CC3CC(CC(C3)C1)C2	792016772	AHDBVXLSAHDRPV-SVXLOUQOSA-N	441.450	1.982	50	20	IDGD	
C[C@](O)(Cn1cc(C(F)(F)F)ccc1=O)C(=O)NNC(=O)c1cc2c(s1)CCC2	792017385	IWCCYOHCVVCQMT-KRWDZBQOSA-N	429.420	1.630	50	20	IDGD	
COc1cc(C(F)(F)F)ncc1NC(=O)C(=O)NNC(=O)COc1ccc(F)cc1	792268795	JPNWGSMFAJREDO-UHFFFAOYSA-N	430.314	1.413	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNc2ccc3c(=O)[nH]ccc3c2)c(OC(F)F)c1	793064739	DLIKGIPYKQZSQJ-UHFFFAOYSA-N	446.366	1.998	50	20	IDGD	
Cc1cc(NNC(=O)[C@@](C)(O)CN2C(=O)NC3(CCCC3)C2=O)ccc1Br	793712488	VEPWWMJLNRPNNX-KRWDZBQOSA-N	439.310	1.816	50	20	IDGD	
CNS(=O)(=O)c1ccccc1S(=O)(=O)NNC(=O)c1cc2c(s1)CCCCC2	799520150	LIEVZMWZAPAHIC-UHFFFAOYSA-N	443.572	1.548	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)NCc1cccc(CS(N)(=O)=O)c1	799982841	NXJDRWPJRRGDKP-LBPRGKRZSA-N	440.909	1.426	50	20	IDGD	
Cc1c(I)cc([N+](=O)[O-])cc1C(=O)NNC(=O)c1cnn(C)c1	800894985	VGQPIMNLWLIPDW-UHFFFAOYSA-N	429.174	1.316	50	20	IDGD	
CCS(=O)(=O)N[C@H](CCSC)C(=O)NNC(=O)Nc1cc(OC)ccc1Cl	802114827	MQBQFUZCKUXEKB-GFCCVEGCSA-N	438.959	1.562	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)CNS(=O)(=O)c2c[nH]c3ncccc23)cc1Cl	803095548	OWNZBNVXJGEBDO-UHFFFAOYSA-N	437.865	1.425	50	20	IDGD	
NS(=O)(=O)c1ccc(OCCSCC(=O)NNc2ccc3c(=O)[nH]ccc3c2)cc1	803435017	GXYZTSOYCAFWQH-UHFFFAOYSA-N	448.526	1.431	50	20	IDGD	
COC(=O)c1cn(CCNC(=O)/C(C#N)=C/c2cc(C)n(C[C@H]3CCCO3)c2C)nn1	803644191	VDIBDXKYHSOTQF-WAFWZSCLSA-N	426.477	1.385	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1nc(Cc2ccccc2)cs1	806973129	ALDAKIHONHKQHT-UHFFFAOYSA-N	440.481	1.907	50	20	IDGD	
Cc1cc(I)cc(NC(=O)C(=O)NNC(=O)c2cccc(C#N)c2)c1	806978131	OBBICQIBBVUDCW-UHFFFAOYSA-N	448.220	1.871	50	20	IDGD	
CCOC(=O)C1CCN(S(=O)(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)CC1	808112439	UZKKPESXPFROGQ-GFCCVEGCSA-N	433.914	1.248	50	20	IDGD	
O=C(NNC(=O)c1ccccc1O)C(=O)Nc1ccc(-n2ccc(C(F)(F)F)n2)cc1	810385629	VZAZGGWEQOWHHI-UHFFFAOYSA-N	433.346	1.996	50	20	IDGD	
O=C(CNS(=O)(=O)c1cc(C(F)(F)F)ccc1Cl)NNc1ncc(F)cn1	810776988	QFUOXGGWBRIGPD-UHFFFAOYSA-N	427.767	1.710	50	20	IDGD	
CC(=O)Nc1cc(NC(C)=O)cc(C(=O)OCC(=O)NNC(=O)c2ccc(C)cc2)c1	812499151	AHBBUAHTRGXEKD-UHFFFAOYSA-N	426.429	1.530	50	20	IDGD	
CC1(C)NC(=O)N(c2cccc(NC(=O)NNC(=O)c3nnc(O)c4ccccc34)c2)C1=O	812973638	FBCBGFBHPRVYLZ-UHFFFAOYSA-N	449.427	1.637	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)NCc3ccc(S(N)(=O)=O)s3)cc2C1	813497096	YJYGUHOYVRHGCF-VIFPVBQESA-N	428.561	1.726	50	20	IDGD	
CCOc1ccc(NNC(=O)C(=O)N2C[C@@H](C[C@H]3COCC(=O)N3)c3ccccc32)cc1	815817121	DJKSISWLTMFYLB-WBVHZDCISA-N	438.484	1.564	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNS(=O)(=O)c3ccc(S(C)(=O)=O)cc3)cc2C1	874076186	AOPGZWHFGUTWSC-LLVKDONJSA-N	428.557	1.900	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H](NC(=O)NCc2ccccc2)C(C)C)cc1	893071308	ABSFOIXYNOCEPM-GOSISDBHSA-N	425.489	1.605	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N[C@@H](CN2CCOCC2)c2ccccc2)cc1OC	914601287	RHRMFYDTAOZPIC-SFHVURJKSA-N	428.489	1.721	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)[C@H]2CC(=O)N(C3CCCCC3)C2)c2ccccc2c1=O	914713106	HVASSYAAFAGDBE-HNNXBMFYSA-N	439.516	1.749	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2ccn(-c3ccccc3F)n2)cc1OC	915460445	PBCMHUATDFGTLU-UHFFFAOYSA-N	442.403	1.647	50	20	IDGD	
CN(C)N(C(=O)[C@@H]1CC(=O)N(Cc2cccc(C(F)(F)F)c2)C1)[C@@H]1CCS(=O)(=O)C1	915830350	XWYCLPYRRGAFLD-GDBMZVCRSA-N	447.479	1.546	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)NC[C@H](c2ccco2)N(C)C)c2ccccc2c1=O	915897102	VGVUYZQXMAUGCE-MRXNPFEDSA-N	426.477	1.817	50	20	IDGD	
C[C@H]1CN(c2ccc(CNC(=O)NNC(=O)Cc3nc4ccccc4n3C)cn2)CCO1	916392756	KEZVPMWOTJECSA-HNNXBMFYSA-N	437.504	1.267	50	20	IDGD	
C[C@@H]1CCCN(CCNC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)C1	916452226	CGMMQUQMMOASKH-MRXNPFEDSA-N	437.566	1.147	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCCNc2ncc(Cl)cc2Cl)c1	916521800	NQSMJURHBZQKKM-UHFFFAOYSA-N	446.316	1.848	50	20	IDGD	
O=C(NNC(=O)C1CC1)c1cc(S(=O)(=O)NCCOc2ccccc2)ccc1Cl	916559301	DUWPOOPYBRMLAG-UHFFFAOYSA-N	437.905	1.868	50	20	IDGD	
O=C(NCCS(=O)(=O)c1ccccc1)NNC(=O)c1ccc(Br)s1	918229751	PBFOUJBMXCOOJN-UHFFFAOYSA-N	432.321	1.929	50	20	IDGD	
CC(=O)N1CCN(c2ccc(C(=O)NNC(=O)c3ccc(C)cc3O)cc2[N+](=O)[O-])CC1	918341259	QMJZFRWUSZCNTM-UHFFFAOYSA-N	441.444	1.352	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCCC(=O)NNC(=O)c2ccc(Cl)cc2O)cc1	918358400	YEZJNSBGFUWUDY-UHFFFAOYSA-N	441.893	1.574	50	20	IDGD	
CC(C)c1c(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)cnn1-c1cccc(Cl)c1	919886578	SMZGRYWDYXKZFX-CYBMUJFWSA-N	439.925	1.780	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)NCc1cccc(C(=O)N2CCOCC2)c1	920419682	KBIYYNHFPDTPEL-UHFFFAOYSA-N	426.473	1.241	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)C(C)(C)NC(=O)OC(C)(C)C)c1	921301592	FAVFKPQGMOZPMU-UHFFFAOYSA-N	428.511	1.001	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@H]1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Cl)C1	1778030491	UGTHDMYZFRYUHF-QHXDDQSASA-N	430.904	1.790	50	20	IDGD	
Cn1cc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)c2cccnc21	1778768347	FNVHPSBCZBXNKD-RDTXWAMCSA-N	439.285	1.707	50	20	IDGD	
CCOC(=O)C1(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CO[Si](C)(C)C)C2)CC1	1779546425	WTOXTAPHUDIIAZ-OXQOHEQNSA-N	440.613	1.695	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnc(O)[nH]3)C2)C1	1779645397	NQENDUITPBBQFU-MYHKYFONSA-N	443.410	1.444	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H]1C[C@@H]1F)CCO2	1780095079	FHAINFYCAPBTHZ-PTSWNOGYSA-N	435.408	1.322	50	20	IDGD	
CC(C)n1ccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)n1	1780376885	IJRLMOZZXUUBCI-KBXCAEBGSA-N	427.343	1.939	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1n[nH]cc1[N+](=O)[O-])C2	1780712933	ZDIANJIDWFPUTG-OAUYIBNBSA-N	448.307	1.682	50	20	IDGD	
Cc1cc(C)n(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](F)Br)C2)n1	1780771190	VPBUDWCPPKPCSM-UWWQBHOKSA-N	445.333	1.704	50	20	IDGD	
C[C@@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Br)C1)n1cccn1	1780777065	LWMWHUBDBZVQHN-QDEZUTFSSA-N	431.306	1.649	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)c3cnn4ncccc34)CCO2)C1	1781227340	JKGYRXGHQSHZLU-ZWKOTPCHSA-N	426.304	1.409	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)/C=N/O[C@H]3CCCCO3)CCO2)C1	1781229478	DPTBMJRMAOJJSS-BKYXWZFNSA-N	436.336	1.582	50	20	IDGD	
CC(C)(C)c1cnc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)cn1	1781329631	ICFDZFFIASNEEK-KDOFPFPSSA-N	443.317	1.908	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1ncccn1)C2	1781901816	XRABXAPUGLFFLI-SPYBWZPUSA-N	439.354	1.707	50	20	IDGD	
Cc1c(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](C)Br)C2)cnn1C	1781996899	XRICIWZOBQCTJD-WBHUJUFNSA-N	427.343	1.639	50	20	IDGD	
Cn1cc2cc(C(=O)N3CC[C@@]4(CN(C(=O)CCBr)CCO4)C3)ccc2n1	1782239855	HWJXCWUXDVHFGD-LJQANCHMSA-N	435.322	1.802	50	20	IDGD	
Cn1cc2cc(C(=O)N3CC[C@@]4(C3)CN(C(=O)[C@@H](F)Br)CCO4)ccc2n1	1782244641	GGKRMTKOODWBQE-CRAIPNDOSA-N	439.285	1.707	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3cccn4nccc34)C2)C1	1782328301	BFGWAWAXOTUUEQ-KUHUBIRLSA-N	435.322	1.809	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)Cn2ccnc2)C1	1782549988	ZXDOQGMFNHMIEE-MIALQEHNSA-N	426.945	1.287	50	20	IDGD	
O=C([C@H](O)CCl)N1CCO[C@@]2(CCN(C(=O)[C@H]3CCc4cccc(Cl)c43)C2)C1	1782852644	FBKOYUICQICUQM-YYFZDKIDSA-N	427.328	1.799	50	20	IDGD	
COC(=O)[C@H]1CC=CC[C@H]1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(C)(C)CCl)[C@H]2C1	1783856258	UCPJEIKHCBUFBG-ADHGMGHFSA-N	440.968	1.987	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cc4ccc(OC)cc4[nH]3)CCO2)C1	1783875201	OSEYRCGUZXUQRE-KKSFZXQISA-N	435.908	1.874	50	20	IDGD	
COCc1c[nH]c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]3C2)c1	1783969830	LLPHABAHMCPAHX-DYWXZXKOSA-N	442.354	1.785	50	20	IDGD	
O=C(Cc1cc(F)ccc1[N+](=O)[O-])N1CC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1785530799	CPQBSYCKUDCSPI-KRWDZBQOSA-N	434.251	1.910	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)c1cc2n(n1)CCCC2	1788355468	LHKDUURCKSTBMK-MZGVZZPPSA-N	443.317	1.503	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)Cn3ccnc3)C[C@@H]21	1791064707	FCUJWWWSCUSCSF-YXMSTPNBSA-N	427.343	1.282	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(C(F)(F)F)n3)C[C@@H]21	1791255437	QUTZCSNBWQTWJY-ABHRYQDASA-N	449.857	1.948	50	20	IDGD	
COc1nn(C)cc1C(=O)NC1(c2ccc(NC(=O)CCC(=O)NN(C)C)cc2)CCC1	1791599396	JTSPVASCOPFXMB-UHFFFAOYSA-N	442.520	1.549	50	20	IDGD	
CCn1nc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)CBr)cc1C	1792872423	GLILAZTVMYYWQH-OEYIWLLWSA-N	427.343	1.446	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cncc3cnccc13)C2	1792872593	QEULRBQVDUSXHC-FRQROOTJSA-N	447.333	1.864	50	20	IDGD	
O=C(NC1(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](O)CCl)CC1)OCc1ccccc1	1793111499	LFEXINTWTCBLBM-XMTFNYHQSA-N	449.935	1.683	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1noc(C(C)C)n1	1794002935	IKUCAYHUSJYCIA-ZWUHOBOKSA-N	443.342	1.499	50	20	IDGD	
Cc1noc(C)c1CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2	1794137926	RXTQULNLOBNXFU-VZAMPYOESA-N	432.290	1.504	50	20	IDGD	
N[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCBr)c1cccc(Cl)c1	1795112501	HJSRPTBJXNUAQS-RMHZUWNSSA-N	444.757	1.714	50	20	IDGD	
Cc1c(F)ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)CBr)C3)c1N	1795699958	DVTDEYGVGHALOZ-MMPOEDRJSA-N	442.329	1.951	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1nccc2nc[nH]c12	1796239272	RFYYIZMJCZOQPG-IMEWIIRVSA-N	426.304	1.397	50	20	IDGD	
C[C@H](Nc1nccs1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2	1796414723	DTXSFBIZWVPQAW-HHHUOAJASA-N	435.319	1.224	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccn2cncc2c1	1797506465	YJPCHYSSCALUHD-MVWRLGRASA-N	425.316	1.774	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CCCN1C(=O)OC(C)(C)C)C2	1799270210	LAQCHFHOEPWEJA-NNXHMXCWSA-N	443.972	1.993	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1snnc1C1CC1)C2	1799275092	KMPDULKKFNQKST-UZTWBRENSA-N	433.361	1.855	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2cccnn2c1	1800006634	NMAJHZSVSKWYGA-FAYQHZLMSA-N	435.322	1.569	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnnc(Cl)c1)C2	1800639936	CNUXGHFOCWBXMW-OPDFLTKYSA-N	431.718	1.507	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)n1ccnc1C)C2	1800644449	UKCIJJJHBUDLOY-SLZITWOASA-N	427.343	1.516	50	20	IDGD	
COc1cc(F)cc(/C=C/C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](O)CCl)C3)c1	1800853678	SGGATHRUCAUVCN-LCXKQCPHSA-N	426.872	1.037	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CCOC1	1801517642	RLVGZONAXOENJN-KVUUAWEYSA-N	431.439	1.498	50	20	IDGD	
COc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCBr)C3)ccc1F	1801710172	NHKJKWLQLIJEPL-FVCICTRLSA-N	429.286	1.823	50	20	IDGD	
C#CCCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](Br)Cc1ccccc1)C2	1802023523	DKMNGRWJJPNESR-DMUMMCEESA-N	433.346	1.996	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H](CNC(=O)[C@@H]2CCC(=O)NC2)[C@@H]1c1cccnc1	1802607966	FCWBRYBGHFGBCA-HLIPFELVSA-N	432.597	1.465	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)[C@H]2CCC(=O)NC2)[C@H]1c1cccnc1	1802613325	QZKUUBHGGDXPJK-PWXKEOIMSA-N	437.338	1.397	50	20	IDGD	
CCc1ccc(C(=O)N2CCCC3(CCN(C(=O)c4cccc(B(O)O)c4)CC3)C2)cn1	1808013345	CAUMCTJOTRHUQE-UHFFFAOYSA-N	435.333	1.482	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1CCN(C(=O)CN2CCOCC2)[C@H]1c1cccnc1	1808295412	HTKYXNBDKAZISC-QRFRQXIXSA-N	443.375	1.656	50	20	IDGD	
Cc1nc2ncccn2c1C(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1	1809294499	KIYXGKGSXAXYNQ-BQFCYCMXSA-N	442.907	1.352	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2cnncc2C(=O)O)[C@H]1c1cccnc1	1810804522	PVHPGWFZSXSWRE-RRQGHBQHSA-N	447.879	1.143	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)CNC(=O)OC)[C@@H]1c1cccnc1	1812779133	PDIYPQGTBNLKOX-IJEWVQPXSA-N	441.326	1.617	50	20	IDGD	
Cc1nscc1C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1813071062	OKOOPQBIXHLERM-OXQOHEQNSA-N	444.561	1.539	50	20	IDGD	
Cc1nc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)ccc1F	1816145137	MPISTQWPFIAATG-QGZVFWFLSA-N	445.499	1.931	50	20	IDGD	
Cc1ccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)[nH]n2)cn1	1816371417	RJLQWDGTWNVIMH-SFHVURJKSA-N	448.487	1.731	50	20	IDGD	
COCCOCCOCCC(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](F)Cl)sc2C1	1817133430	FRXBLYWENBSSRD-ABAIWWIYSA-N	437.921	1.659	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)c(C)o1	1817470605	FHIDMSASSYXIAX-IBGZPJMESA-N	436.277	1.919	50	20	IDGD	
O=C(CCc1ccc[nH]1)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1817529644	FWBAKRLVMASRLH-LJQANCHMSA-N	435.293	1.356	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)Cn2cnnn2)n[nH]1	1817613555	RYBRGLAWZBYUEQ-CMPLNLGQSA-N	425.291	1.120	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](O)CCl)CC2)c1[nH]cnc1-c1cccnc1	1821257465	YSCBJKUFBYNWFT-AAEUAGOBSA-N	446.920	1.754	50	20	IDGD	
CC(C)CNC(=O)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](C)Br)n[nH]1	1822187670	YPPWADNVRQKLJU-DGCLKSJQSA-N	428.331	1.957	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)C2CC(F)(F)C2)CC1	1823853533	FMPXZWYBZDUOTK-LJQANCHMSA-N	434.292	1.645	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)Cc1ccn(C)n1)CC2	1825642488	QZYZCJVHVZMJAF-VHSXEESVSA-N	426.340	1.815	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCn1cncn1)CC2	1825647564	QAQQVGDUNZQOSB-ZJUUUORDSA-N	427.328	1.520	50	20	IDGD	
Cc1nc(C(=O)N[C@H]2CCc3nc(NC(=O)C(Cl)Cl)sc3C2)c(=O)[nH]c1C	1826093399	MILLBXXTEFGYRN-QMMMGPOBSA-N	430.317	1.873	50	20	IDGD	
O=C(CCBr)N1CCC([C@H]2CCCCN2C(=O)CN2CCOCC2)CC1	1826715085	KIJFOYSHKQKZEX-QGZVFWFLSA-N	430.387	1.723	50	20	IDGD	
CC[C@H](C)[C@@H](O)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827050750	XKXKHXLHAZOWHX-ORYQWCPZSA-N	430.354	1.007	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CNC(=O)c2ccco2)CC1	1827185591	RKRUMNNRXFUKMN-IRXDYDNUSA-N	439.940	1.883	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)Cn3cc(C)c(O)nc3=O)sc2C1	1827994945	WBFYNEBNLPLJDR-GHMZBOCLSA-N	439.925	1.343	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(C)=O)CCN2C(=O)OCc2ccccc2)C1	1828894058	BMMRRNXSPTULBR-GHTZIAJQSA-N	437.924	1.712	50	20	IDGD	
C[C@@H]1CC[C@H](C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)CC2)O1	1828923971	DTASDXIKDYECLT-CDHQVMDDSA-N	443.548	1.486	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)CN2CCOC2=O)CC1	1829099227	GCAGUHVIHZWTMP-QGZVFWFLSA-N	425.602	1.910	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnoc3C3CC3)C2)C1	1830359008	JIIKHYCFMFKGBY-HXUWFJFHSA-N	425.913	1.887	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3Cc4ccccc4O3)C2)C1	1830362394	UYSWZUQKPVNHSI-AVRDEDQJSA-N	436.936	1.712	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)C#Cc3ccccc3)C2)C1	1830537567	KMWSNEGZCSQVOI-UTKZUKDTSA-N	449.345	1.526	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)C(O)O)CC1	1831223331	XNLIXMXXHGEPNE-KZIRBZLESA-N	433.455	1.802	50	20	IDGD	
COc1nccnc1C(=O)N1CCC([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1	1831871385	CJMZWIBCRYUSQD-QGZVFWFLSA-N	446.552	1.092	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)C(Cl)Cl)CC1	1831878480	HRHFFQUWJWAOFS-INIZCTEOSA-N	427.137	1.403	50	20	IDGD	
CCC(=O)N[C@@H](C)C(=O)NC1CCN(C2CCN(C(=O)C(C)(C)CCl)CC2)CC1	1833418330	WQURDEGQTOJDHK-HNNXBMFYSA-N	429.005	1.738	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)c3cnc(O)nc3O)CC2)CC1	1833532157	FWCGYBNNQJBDHP-INIZCTEOSA-N	439.944	1.481	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)CN3CCCCC3=O)CC2)CC1	1833535580	YIPDYVMNTQVVJU-LJQANCHMSA-N	441.016	1.978	50	20	IDGD	
Cc1noc(C)c1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)CBr)C2)C1	1834061923	AOZIUELHFWKHEC-SGTLLEGYSA-N	444.326	1.392	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](C)CBr)C3)C2)c(C)o1	1834090624	OCGCPQJJZNKDDS-YJYMSZOUSA-N	443.338	1.997	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(N2CCC(NC(=O)C(C)(C)C)CC2)CC1	1834449924	YYYGXXLNTWTFPV-WGOQTCKBSA-N	444.580	1.738	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)c3ccc(F)nc3F)C2)C1	1834820091	MTEDBOKZGXKHHD-QGZVFWFLSA-N	448.264	1.215	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)c3ccccc3F)CC2)CC1	1836222000	FCAARXUATGNRFK-UHFFFAOYSA-N	447.555	1.384	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC1CCN(C2CCN(C(=O)Cc3cnc[nH]3)CC2)CC1	1836398682	XLPFLRNNWYJCMA-LJQANCHMSA-N	430.380	1.760	50	20	IDGD	
Cc1nccn1[C@@H](C)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836720570	XFVOPHOPDDPQKX-KSSFIOAISA-N	426.945	1.351	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](CN)c3ccccc3)C2)C1	1837711877	VDUCDTKWXNDCTD-DENIHFKCSA-N	449.624	1.037	50	20	IDGD	
CCn1nc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)cc1C	1838152617	OVRVDIIQOQSOHG-KBXCAEBGSA-N	443.342	1.065	50	20	IDGD	
COC(=O)C1(C(=O)N2CCC(OC3CCN(C(=O)[C@H](C)Br)CC3)CC2)CC1	1838758123	SBPMMJFVPJMVOD-ZDUSSCGKSA-N	445.354	1.722	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)c1ccc(C)cc1)CCO2	1839949036	OKYCXEASKXHZPR-JLMWRMLUSA-N	438.952	1.809	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ncc(C)s3)C2)C1	1839963781	VRTDSABSEGWMHC-CXAGYDPISA-N	446.367	1.695	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc[nH]c3C)C2)C1	1839963977	BMLKQGHCOXOXOF-CRAIPNDOSA-N	428.327	1.567	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3CCCS3)C2)C1	1839967444	MJJGEGWJXOJKCT-ZQIUZPCESA-N	435.384	1.512	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(Cl)nc3)C2)C1	1840029335	AVUSVDPFSWPHHM-SJKOYZFVSA-N	446.729	1.588	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccsc3)C2)C1	1840031898	GJPGKDOZJRVLSZ-DYVFJYSZSA-N	431.352	1.530	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3cccc(C)n3)C2)C1	1840150084	FHZADVUUNZSZEP-GHTZIAJQSA-N	439.940	1.033	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3ncccc3C)C2)C1	1840151101	VGCCJNUVCJIUNF-UWJYYQICSA-N	439.940	1.033	50	20	IDGD	
Cc1cccc(CCC(=O)N2CCOC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)n1	1840186390	GVMFPMAWLLXRTB-IBGZPJMESA-N	430.332	1.583	50	20	IDGD	
Cc1cc(C(=O)N2CC3(CCCN3C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)nn1C	1841924320	XSIWSPSLJVEXPS-HNNXBMFYSA-N	439.944	1.678	50	20	IDGD	
O=C(CCBr)N1CC2(CCCN2C(=O)c2ccc(N3CCOCC3)cn2)C1	1842265359	MCHUARHPJUGIPG-UHFFFAOYSA-N	437.338	1.520	50	20	IDGD	
Cc1nc2cc(C(=O)N3CCCC34CN(C(=O)c3cccc(B(O)O)c3)C4)ccc2s1	1843764789	CRLODSBVBHFGPS-UHFFFAOYSA-N	435.314	1.415	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)c2cnc3cccc(Cl)c3c2)C1	1845700138	IANNIAJFSKXCCT-UHFFFAOYSA-N	449.703	1.699	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCCC12CN(C(=O)CCn1ccnn1)C2	1845871986	NJZIBZQZEAVQSX-MHWRWJLKSA-N	426.427	1.757	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H]2OC[C@@H](C(=O)N3CCCC34CN(C(=O)[C@H](F)Cl)C4)[C@H]2C1	1846161240	IMUACXWGEPQVHN-TUVASFSCSA-N	445.919	1.606	50	20	IDGD	
COc1cc(OC)c(F)c(C(=O)N2CC3(CCCN3C(=O)CCC(=O)NN(C)C)C2)c1	1846385189	BEHZYEXCHHVELK-UHFFFAOYSA-N	436.484	1.033	50	20	IDGD	
Cc1ccc(CC(=O)N2CC3(CCCN3C(=O)CCC(=O)NN(C)C)C2)cc1[N+](=O)[O-]	1846385550	SIBFLKVLMDZTDA-UHFFFAOYSA-N	431.493	1.022	50	20	IDGD	
COc1ccc([C@H]2C[C@@H]2C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2cnccc2C(=O)NN)cc1	1847780132	LWRIHEKHGJMOAP-ZFMNYDKASA-N	449.511	1.313	50	20	IDGD	
CCn1c(SCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)nnc1-c1ccco1	8619954	KGTPONMZQALSRB-HNNXBMFYSA-N	429.458	1.638	50	20	IDGD	
CN(c1ccc(OCC(=O)NNC(=O)c2ccccn2)cc1)S(=O)(=O)c1cccs1	17329029	CAHWJKYFYQJRFP-UHFFFAOYSA-N	446.510	1.808	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc2ccccc2c1)NNC(=O)COc1ccc(F)cc1	18101813	IICCDRHCTNRVCM-UHFFFAOYSA-N	445.472	1.874	50	20	IDGD	
C[C@@H](NC(=O)c1cccs1)C(=O)NNC(=O)c1ccc(CSc2nncn2C)cc1	21291371	GOOJENGKYDTUSR-GFCCVEGCSA-N	444.542	1.748	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)NCCC(=O)N2CCN(c3ccccn3)CC2)cc(C#N)n1C	216348938	SXAZOADXFYTNMI-UYRXBGFRSA-N	431.500	1.362	50	20	IDGD	
COc1ccc(Cl)cc1CN1CCN(C(=O)NNC(=O)CNC(=O)c2ccco2)CC1	725871941	ISJRCRKDLPJFNM-UHFFFAOYSA-N	449.895	1.230	50	20	IDGD	
NC(=O)CNC(=S)NNC(=O)CSc1nnc(-c2ccccc2)n1-c1ccccc1	727065092	TWRGGRIMJPBWLL-UHFFFAOYSA-N	441.542	1.007	50	20	IDGD	
CC(C)Oc1ccc(NC(=S)NNC(=O)CN2C(=O)c3ccccc3S2(=O)=O)cc1	727495742	WELIIFDZALREFJ-UHFFFAOYSA-N	448.526	1.636	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)CNC(=O)c2ccc(OC)c(OC)c2)cc1F	727500444	YULKOVDEVYDPIL-UHFFFAOYSA-N	436.465	1.599	50	20	IDGD	
O=C(NNC(=O)[C@H]1Nc2ccccc2S(=O)(=O)N1)c1ccc(COc2ccccc2)o1	727764751	KPUQSKWMIYCEIA-SFHVURJKSA-N	442.453	1.350	50	20	IDGD	
O=C(CNC(=O)c1ccccc1I)NNC(=S)NCC1CCC1	727867021	LKGKGUMNQFULJG-UHFFFAOYSA-N	446.314	1.316	50	20	IDGD	
COc1cccc(N2CC[C@H](NC(=O)NNC(=O)C3CCN(c4ncccn4)CC3)C2)c1	728954414	YKJRNSINWDVXGC-KRWDZBQOSA-N	439.520	1.311	50	20	IDGD	
COc1cccc(C[C@@H](C(=O)NNC(=O)COc2ccccc2OC)n2nnnc2C)c1	729297455	LKGLSHPODDJDCJ-KRWDZBQOSA-N	440.460	1.009	50	20	IDGD	
O=C(NCCOCC1CC1)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	731118445	DDNOZPVYYLLNNL-UHFFFAOYSA-N	435.484	1.815	50	20	IDGD	
O=C(COC(=O)c1cn(-c2cccc([N+](=O)[O-])c2)nn1)NNC(=O)c1cccc(Cl)c1	731526127	OCTNEGPWXDVGRN-UHFFFAOYSA-N	444.791	1.447	50	20	IDGD	
O=C(CCS(=O)(=O)c1ccc2c(c1)OCCO2)NNc1nc(-c2ccccc2)no1	732113174	NDGOHQNPAYDYAQ-UHFFFAOYSA-N	430.442	1.815	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)c2cc(C(N)=O)n(-c3ccccc3)n2)cc1OC	732259807	XHEXLBRXJKDRBO-UHFFFAOYSA-N	437.456	1.843	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)NNC(=O)c1cnn(-c2ccccc2)c1	733348809	UFRFYINMCDMJAO-UHFFFAOYSA-N	430.428	1.347	50	20	IDGD	
COc1ccc(Cl)cc1NCC(=O)OCC(=O)NNC(=O)Cc1nc(C)cs1	733500753	LBMPWKYZYDGLIU-UHFFFAOYSA-N	426.882	1.459	50	20	IDGD	
N#Cc1ccc(N2C(=O)N[C@@H](CCC(=O)NNC(=O)c3ccc4ccccc4n3)C2=O)cc1	733774730	QZNRLSHQDHRAFE-IBGZPJMESA-N	442.435	1.773	50	20	IDGD	
CCCCS(=O)(=O)N1CCC[C@@H]1C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	734126856	GOXPBZDFTNOKDR-QGZVFWFLSA-N	444.579	1.165	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NN=Cc2ccccc2OCC(=O)NCC2CC2)c1	734745120	CKEPVRWHMUCXIB-UHFFFAOYSA-N	429.498	1.759	50	20	IDGD	
Cn1cc(N2CC[C@H](NC(=O)NNC(=O)c3cc(F)ccc3Br)C2=O)cn1	735584702	YAGVGAWVWDZRHR-ZDUSSCGKSA-N	439.245	1.071	50	20	IDGD	
COCCN(CCOC)S(=O)(=O)c1ccc(C(=O)NNc2cc(C)nc(C)n2)cc1	736716526	IQGMDTOAMJCAES-UHFFFAOYSA-N	437.522	1.134	50	20	IDGD	
CC(C)N(C)S(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)COCc2ccccc2)c1	737638446	XTXRRRBPUHOCHL-UHFFFAOYSA-N	437.493	1.832	50	20	IDGD	
O=C(COC(=O)C[C@H]1CN(Cc2ccccc2)CCO1)NNC(=O)c1ccc(Cl)cc1	741354990	OGIWTWLPRAGRLI-IBGZPJMESA-N	445.903	1.935	50	20	IDGD	
O=C(NNc1ccc(Cl)cc1Cl)C(=O)Nc1ccnn1[C@@H]1CCS(=O)(=O)C1	742904130	AEOUMPDLZYFQGE-SNVBAGLBSA-N	432.289	1.631	50	20	IDGD	
O=C(NNC(=O)N1CCOCC1)c1ccc(NC(=O)c2ccc(Br)o2)cc1	745986253	PQPUCBDPVJZAOO-UHFFFAOYSA-N	437.250	1.981	50	20	IDGD	
NC(=O)c1cc(S(=O)(=O)NCC(=O)NN(Cc2ccccc2)c2ccccc2)c[nH]1	746016863	ZXLPGVQUEJZIDY-UHFFFAOYSA-N	427.486	1.130	50	20	IDGD	
O=C(CN1CCn2c(CCc3ccccc3)nnc2C1)NNC(=O)c1ccccc1Cl	746477620	VXKOHSAYJZVZGG-UHFFFAOYSA-N	438.919	1.994	50	20	IDGD	
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC[C@H](C(=O)NNc2cc(F)c(F)c(F)c2)C1	746707179	ZVFTYEILEFEISL-NSHDSACASA-N	431.440	1.988	50	20	IDGD	
CSC[C@H](C(=O)NNC(=O)c1cccc2cccnc12)N1C(=O)[C@H]2CCCC[C@@H]2C1=O	747427148	CJFVNHCFVULMOM-YQQAZPJKSA-N	440.525	1.903	50	20	IDGD	
CN(CC(C)(C)CNC(=O)OC(C)(C)C)C(=O)NNC(=O)CNC(=O)c1ccco1	747502240	JZDNHHGMSAXCNN-UHFFFAOYSA-N	425.486	1.233	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)c1cc(S(=O)(=O)N2CCC2)ccc1Cl	748696263	TYDZKLQMBNUWEZ-UHFFFAOYSA-N	447.904	1.765	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@@H](C)NC(=O)CC1CCCCC1	749838898	XNTRPODKUZODFH-CQSZACIVSA-N	437.566	1.524	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)CNc3ccccc3Cl)cc2)CC1	750240466	WOWXBERKYVRQBX-UHFFFAOYSA-N	437.953	1.831	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)N[C@H]1CCN(CCCc2ccccc2)C1=O	750290440	BUZCBPLSEBBWST-IBGZPJMESA-N	434.500	1.441	50	20	IDGD	
COC(=O)c1c(Br)ccc(NC(=O)C(=O)NNC(=O)CC(F)(F)F)c1C	753840803	OAOGJJMGOBEJRA-UHFFFAOYSA-N	440.172	1.582	50	20	IDGD	
CS(=O)(=O)c1ccccc1-n1cc(NC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cn1	756706253	OBAIMAOCFSYQGG-UHFFFAOYSA-N	444.429	1.651	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)[C@@H](C)NS(=O)(=O)c2cccc(C#N)c2)c(OC)c1	757188613	UROLODVQWHRXBZ-GFCCVEGCSA-N	432.458	1.164	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)N1CCC(C(=O)NNc2ccc(C(N)=O)nn2)CC1	757402987	SAUPWVUYXRKFEX-UHFFFAOYSA-N	432.868	1.233	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)NCc2ccc3c(c2)CCS3(=O)=O)cc1C	757752079	XMXSQRLEONEULG-UHFFFAOYSA-N	430.486	1.102	50	20	IDGD	
CCOC(=O)Cc1nnc(NC(=O)NNC(=O)c2cc(-c3ccc(C)cc3)[nH]n2)s1	757756265	QTZHHQPYYRLHGW-UHFFFAOYSA-N	429.462	1.809	50	20	IDGD	
CN(NC(=O)c1cccc(N2CCOC2=O)c1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758787625	UNTIUJGDEOEJKK-UHFFFAOYSA-N	447.492	1.893	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)CC[C@H]2CCN(C(=O)OC(C)(C)C)C2)C[C@@H](C)O1	760119366	HIVSIAGTCRCEBQ-ZACQAIPSSA-N	426.558	1.670	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)CCNC(=O)[C@@H]2CCCN2C(=O)OC(C)(C)C)c1	760945425	XZANIFQRPCWSEJ-INIZCTEOSA-N	434.493	1.822	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C3=NN(c4ccccc4)C(=O)[C@H](C)N3)n[nH]2)cc1	763166578	UYWHBRKFUPLSQC-AWEZNQCLSA-N	445.483	1.739	50	20	IDGD	
C[C@H]1NC(C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)=NN(c2ccccc2)C1=O	763174872	ZDMNPCZTYWLKSD-GFCCVEGCSA-N	435.419	1.315	50	20	IDGD	
O=C(NNC(=O)c1ccnc(Cl)c1F)c1cccc(S(=O)(=O)N2CCCC2)c1	763385480	DJZAJLJCBHGUFQ-UHFFFAOYSA-N	426.857	1.733	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3n2)c(OCCN(C)C)c1	763450808	QSGVWOKPQGVANG-UHFFFAOYSA-N	435.484	1.883	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)C(=O)Nc1ccc(OCC2CCOCC2)cc1	763547594	FXCWYFFPRNJEDJ-UHFFFAOYSA-N	441.440	1.620	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)C(=O)Nc1ccnc(OCC(F)(F)F)c1	763550544	DBQFHAOUXOUMNV-UHFFFAOYSA-N	426.307	1.151	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)[nH]n1)C(=O)Nc1ccc(NC(=O)C2CC2)nc1	763604854	NYCPATQGAMDNSJ-UHFFFAOYSA-N	433.428	1.220	50	20	IDGD	
N#CCCn1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2-c2ccccc2)n1	763643731	JPMGTMAKXMOTAA-UHFFFAOYSA-N	432.440	1.629	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cnn(-c2ccccc2F)c1	763682308	LZQRZKZPIGKVST-UHFFFAOYSA-N	441.419	1.575	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)c(Br)n1	763684135	FSJXYVRLMUMZSZ-UHFFFAOYSA-N	441.669	1.971	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(CN(C)C)ccc1OC	763713069	UQKPFAQNACYOBG-UHFFFAOYSA-N	428.489	1.484	50	20	IDGD	
O=C(NNC(=O)C12CC3CC(CC(C3)C1)C2)C(=O)Nc1ccccc1CN1CCOCC1	763722474	BEVWRPXIUVZNGB-UHFFFAOYSA-N	440.544	1.821	50	20	IDGD	
CS(=O)(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(Cl)c2)cc1F	763752567	IXRNUCARFLTORP-UHFFFAOYSA-N	427.841	1.423	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)Cc1csc(Cc2ccc(F)cc2)n1	763819217	VDPGCHAVDRNDKI-UHFFFAOYSA-N	427.461	1.388	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)NNC(=O)C(=O)Nc1ccc(=O)n(Cc2ccccc2)c1	763856178	DEIZTRKGIFUILB-UHFFFAOYSA-N	443.463	1.707	50	20	IDGD	
C[S@@](=O)c1ccc(NC(=O)C(=O)NNC(=O)CCSc2ccc(F)cc2)cc1F	763895139	LETQWQSPJWMHHF-GDLZYMKVSA-N	441.481	1.971	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cccc(N(C)C(C)=O)c2)ccc1OC(C)C	763915684	DKKOPLSHHSMAOA-UHFFFAOYSA-N	442.472	1.865	50	20	IDGD	
O=C(NNC(=O)c1ccc(Br)s1)C(=O)Nc1cnn(C[C@@H]2CCCO2)c1	763940593	KJJKBJNYPPTANE-JTQLQIEISA-N	442.295	1.286	50	20	IDGD	
CCc1nnc(-c2ccc(NC(=O)C(=O)NNC(=O)c3ccc4c(c3)OCCO4)cc2)o1	764004125	SATHBAGLXJPFCF-UHFFFAOYSA-N	437.412	1.470	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)c2cnccn2)sc2c1CC[C@H](CC)C2	764025896	ZYWKZIKGZDLDMI-NSHDSACASA-N	445.501	1.629	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)nc1)C(=O)Nc1cc2c(cc1[N+](=O)[O-])OCCCO2	764101805	VZBUOVPDESWOSM-UHFFFAOYSA-N	435.780	1.204	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1O)C(=O)Nc1ccc(NC(=O)[C@H]2CCCO2)cc1	764114900	HEFPXEWSMNKEQX-MRXNPFEDSA-N	446.847	1.563	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cc3c(cc2F)CCC(=O)N3)o1	764139383	RWDVOIAEAVNNBV-UHFFFAOYSA-N	445.451	1.545	50	20	IDGD	
Cc1ccc(Cn2cccc(NC(=O)C(=O)NNC(=O)[C@@H]3Cc4ccccc4O3)c2=O)cc1	764168877	RNHHIABDLBUUMJ-FQEVSTJZSA-N	446.463	1.295	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(-c3nnc4n3CCCCC4)cc2)c1	764235114	QLVYGPCPEBLQPM-UHFFFAOYSA-N	443.467	1.943	50	20	IDGD	
O=C(NNC(=O)c1cccc(OC(F)F)c1)C(=O)Nc1ccnn1Cc1ccccc1	764250734	MNXFIONZMJPIPD-UHFFFAOYSA-N	429.383	1.933	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)C(=O)Nc1cccc(C(F)(F)F)c1	764259314	FOYIVIOBYDBKHO-UHFFFAOYSA-N	436.394	1.498	50	20	IDGD	
Cc1nn(C)c2ncc(NC(=O)C(=O)NNC(=O)c3cc(F)ccc3Br)cc12	764270000	APNCPIZNOCRNGD-UHFFFAOYSA-N	449.240	1.578	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1cccc(Cl)c1N1CCOCC1	764274835	DPPXOBVGPGBUEQ-UHFFFAOYSA-N	448.863	1.047	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1ccc(OCC2CCOCC2)cc1	764278588	ZZKQVJNPVSORSM-UHFFFAOYSA-N	443.456	1.363	50	20	IDGD	
CCN(Cc1ccccc1)C(=O)c1cc(NC(=O)C(=O)NNC(=O)COC)ccc1Cl	764300851	YYFIKPAIWXZQSR-UHFFFAOYSA-N	446.891	1.735	50	20	IDGD	
CC(C)(C(=O)NNC(=O)C(=O)Nc1ccn(-c2cccc(F)c2C#N)n1)c1ccccc1	764302459	MIRKPZOHCMTBKQ-UHFFFAOYSA-N	434.431	1.947	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(C(=O)NCC(F)(F)F)ccc2C)o1	764367901	MVDMQOFFBAEQRB-UHFFFAOYSA-N	426.351	1.588	50	20	IDGD	
CCS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)cc1	764382176	GMEKUHOJUUQETB-UHFFFAOYSA-N	447.498	1.332	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NCc2noc(C3CC3)n2)c2ccccc2c1=O	764466736	VRVOBFYTOGPKEH-UHFFFAOYSA-N	425.449	1.601	50	20	IDGD	
Cc1cc(=O)c(C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)nn1-c1ccccc1F	765318763	PIUUJYHIDYAPMM-UHFFFAOYSA-N	447.467	1.746	50	20	IDGD	
Cc1cccc2c(=O)n(CCC(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)cnc12	765320174	MFIYFVFMJOFLSZ-UHFFFAOYSA-N	431.493	1.547	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)o1	765569252	XILWQPNTYDDLJH-UHFFFAOYSA-N	437.503	1.883	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)CCNS(=O)(=O)c2cccs2)n[nH]1	765592067	ICOGTGZYBXNCGW-UHFFFAOYSA-N	449.514	1.276	50	20	IDGD	
Cc1c(Br)cc(C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)c(=O)n1C	765816943	OPZCRIDLCQQKLQ-UHFFFAOYSA-N	446.261	1.422	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)c1ccc(=O)n(-c2ccccc2F)n1	765886344	NSGDFNDBBXXVDF-UHFFFAOYSA-N	433.440	1.438	50	20	IDGD	
CC/C=C(\C)C(=O)N1CSC[C@H]1C(=O)OCC(=O)NNC(=O)Cc1ccccc1C	767335037	RHHFMNMCCSFERA-QRMGNNRRSA-N	433.530	1.486	50	20	IDGD	
CC(C)C[C@@H](NC(=O)OCc1ccccc1)C(=O)N([C@H]1CCS(=O)(=O)C1)N(C)C	768127271	PARMAGYKRGKVNY-ZWKOTPCHSA-N	425.551	1.820	50	20	IDGD	
COc1cc2c(cc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccc(F)cc1)NC(=O)CC2	768239397	YXVCTOSKYYEQMX-NSHDSACASA-N	444.419	1.272	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)c2ccc(C[C@@H]3CC(=O)NC3=O)cc2)n[nH]1	768274356	RLWZUXIGJJSEHE-OAHLLOKOSA-N	447.451	1.365	50	20	IDGD	
COc1ccccc1C(=O)N[C@H](CCSC)C(=O)NNC(=S)Nc1ccccn1	768578347	OUTBVEOMMPQASQ-CQSZACIVSA-N	433.559	1.960	50	20	IDGD	
CC[C@H](NC(=O)NNc1nc(O)c2cnn(C)c2n1)[C@@H]1CN(Cc2ccccc2)CCO1	770410086	GYZIILTUYYEDIQ-IRXDYDNUSA-N	440.508	1.375	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCc2cccc3c2OCCCO3)nc1	770426418	REKGGSBEABVWCJ-UHFFFAOYSA-N	435.506	1.756	50	20	IDGD	
CCC1(CC)[C@H](NC(=O)NNC(=O)c2csc(N3CCOCC3)n2)[C@H](C)[C@H]1OC	770753847	OACKSPCOUMNZEW-NWANDNLSSA-N	425.555	1.763	50	20	IDGD	
Cc1cc(C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)c(C(F)(F)F)o1	771734984	KXANCNLNECTTQL-UHFFFAOYSA-N	447.439	1.695	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)CCC(=O)c1ccc(I)cc1	771838531	LLTKDOOESHRYLX-JTQLQIEISA-N	446.241	1.743	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1ccc(S(=O)(=O)Nc2ccc(C)cc2)cc1	771966748	DHXFZEQQDFWOQU-AWEZNQCLSA-N	433.486	1.899	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)C1CCN(C(=O)COc2ccccc2)CC1	771988869	NKAOZLAXHFATFG-INIZCTEOSA-N	433.505	1.429	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)Cc1ccnc(O)c1Br	772488247	LXFCKHHVZLKUHL-UHFFFAOYSA-N	431.287	1.545	50	20	IDGD	
CS(=O)(=O)CCc1ccc(NC(=O)C(=O)NNc2ccc(C(F)(F)F)cn2)cc1	773667925	VIGPHZBSFQBYPY-UHFFFAOYSA-N	430.408	1.769	50	20	IDGD	
CS(=O)(=O)C[C@H](NC(=O)NNC(=O)COc1ccccc1[N+](=O)[O-])c1ccccc1	774286074	ZVOYYKVSYDUGJX-AWEZNQCLSA-N	436.446	1.090	50	20	IDGD	
CO[C@H](c1ccc(Br)cc1)[C@@H](C)NC(=O)NN[C@]1(C)CCS(=O)(=O)C1	774338761	BBOQCXSUPBIHLO-DIOULYMOSA-N	434.356	1.906	50	20	IDGD	
COc1ccc(N2CCN(C(=O)/C=C/C(=O)NNC(=O)c3cccc(C#N)c3)CC2)cc1	778261812	LVYDBHNHPXYJBL-MDZDMXLPSA-N	433.468	1.233	50	20	IDGD	
COc1cccc2[nH]cc(CC(=O)OCC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)c12	778867100	HJDZPRHAFKJYHA-UHFFFAOYSA-N	426.385	1.632	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CC[C@H]([C@H](C)NC(=O)OC(C)(C)C)C2)n1	778985537	YTGMFWZUYYDDFI-KBPBESRZSA-N	425.555	1.377	50	20	IDGD	
NS(=O)(=O)c1ccc(NC(=O)C2CCN(S(=O)(=O)CCCCCl)CC2)cc1	780683143	PJKYNRXGPTYXRA-UHFFFAOYSA-N	437.971	1.333	50	20	IDGD	
COC(=O)c1ccccc1NNC(=O)CCCN(C)C1=NS(=O)(=O)c2ccccc21	780737506	CFWOVXONVXYMPB-UHFFFAOYSA-N	430.486	1.777	50	20	IDGD	
C[C@@H](NCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)c1cccc(NS(C)(=O)=O)c1	781910775	NOGLITMPBNBSHL-GFCCVEGCSA-N	435.462	1.078	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2cc(Cl)ncc2Cl)CC1	781932178	GBXCPTLXIOLLJZ-UHFFFAOYSA-N	445.332	1.476	50	20	IDGD	
COc1cc([N+](=O)[O-])ccc1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	782071370	QDTWWQFMRSEXHP-UHFFFAOYSA-N	437.434	1.320	50	20	IDGD	
CC(=O)N1CCN(Cc2cccc(NC(=O)C(=O)NNc3c(F)cccc3F)c2)CC1	782123174	CFNQKPVXACZOET-UHFFFAOYSA-N	431.443	1.711	50	20	IDGD	
COc1ccc(-c2nn(CCC#N)cc2/C=C(\C#N)C(=O)NCCn2ccnn2)cc1OC	782828826	YTANNUWUUBGPRE-SFQUDFHCSA-N	446.471	1.796	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)cc1)C(=O)Nc1ccccc1I	782832666	RFVXGUIWCNUADH-UHFFFAOYSA-N	425.182	1.397	50	20	IDGD	
N#Cc1cccnc1OC1CCC(NC(=O)NNC(=O)COc2ccccc2O)CC1	783039969	UWKIIMPMEJJVTD-UHFFFAOYSA-N	425.445	1.758	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)C(=O)Nc1ccc(F)cc1OC1CCCC1	784002598	SKLQEUWMCXHWAB-UHFFFAOYSA-N	432.408	1.256	50	20	IDGD	
CN(c1ccccc1NC(=O)C(=O)NNc1ccc(OC(F)F)cc1)S(C)(=O)=O	784310410	DIDVXTSJWOTQHU-UHFFFAOYSA-N	428.417	1.766	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(NC(=O)C(=O)NNc2nccnc2Cl)ccc1C	784780934	UILIQMIGKHLCJH-UHFFFAOYSA-N	440.913	1.551	50	20	IDGD	
COc1ccc(OC(F)F)c(NC(=O)C(=O)NNc2cccc(S(C)(=O)=O)c2)c1	784843721	CLZSPMCACFCXFG-UHFFFAOYSA-N	429.401	1.782	50	20	IDGD	
COc1ccc(Cn2nccc2NC(=O)C(=O)NNc2ccnc(F)c2)c(OC)c1OC	784848668	KMUNVNSMJRURSZ-UHFFFAOYSA-N	444.423	1.573	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2ccc(CN3CCCC3=O)cc2)n1	785227614	VCTJHBSLRUVFQD-UHFFFAOYSA-N	425.493	1.527	50	20	IDGD	
COC(=O)CCc1cccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)c1	786415087	WJCDBQCSLZHBPF-UHFFFAOYSA-N	435.440	1.582	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCC3)cc1N1CCNC1=O	787540654	CHUCUYVNPZQTOA-UHFFFAOYSA-N	427.486	1.475	50	20	IDGD	
CC1=C(C(=O)NNC(=O)COc2ccc(Br)cc2)[C@@H](C)n2ncnc2N1C	788260792	HJTVNVZTHTVLHE-LLVKDONJSA-N	435.282	1.552	50	20	IDGD	
CCCn1c(CCC(=O)NNC(=O)OC)nc2cc(S(=O)(=O)N(CC)CC)ccc21	792605735	SESPVABXJJVHAX-UHFFFAOYSA-N	439.538	1.797	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNC(=O)c1cc(Cl)ccc1-n1cnnn1	794063133	JCFXNGLVTVNQID-UHFFFAOYSA-N	429.824	1.003	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)/C=C/c1ccccc1)C(=O)NNC(=O)c1cccc(C)n1	794081028	YTJAUZZDDWSPAA-SZEUEKNRSA-N	448.570	1.863	50	20	IDGD	
CC(C)O[C@H](C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1)c1ccccc1	796416337	JHRSZKDSCIYGBN-QUCCMNQESA-N	428.441	1.683	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN(CCO)Cc1cccnc1Cl	796560641	CRHYTHJKYFXHTB-UHFFFAOYSA-N	427.288	1.653	50	20	IDGD	
C#Cc1cncc(C(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)c1	798153744	CVZLIPIPMZPSDY-UHFFFAOYSA-N	434.477	1.616	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1)n1cnc(C#N)n1	798842371	AQSGUQXTRDIXCA-NSHDSACASA-N	445.486	1.034	50	20	IDGD	
Cc1cc(O[C@@H]2CCN(C)C2=O)ccc1NC(=O)C(=O)NNc1nccnc1C(C)C	799263841	YZEGNCVYUYOTBC-MRXNPFEDSA-N	426.477	1.600	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)OCc2ncnn2C)cc1	801209493	KCKWXKQQZRCRKS-DHDCSXOGSA-N	435.444	1.213	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)CN2C(=O)NC3(CCCC3)C2=O)c(OC)cc1Cl	802080788	OSLNCPKTAMACHM-UHFFFAOYSA-N	439.856	1.375	50	20	IDGD	
O=C(NNC(=O)C1=NN(Cc2ccc(F)cc2)C(=O)CC1)Nc1ccc2c(c1)OCO2	802097346	RYDZUHOBPUXBJR-UHFFFAOYSA-N	427.392	1.886	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NC[C@H]2CC(c3ccc(OC)c(C)c3)=NO2)cc1	802352385	IHHTXKGGKIAJBH-GOSISDBHSA-N	442.472	1.915	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)c1ccc2oc(O)nc2c1	805191629	MKFSVKIKDWBUHA-UHFFFAOYSA-N	443.891	1.766	50	20	IDGD	
CC(C)Cn1ncc(NC(=O)C(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])c1C1CC1	806974717	SBTUCKABUSAHME-UHFFFAOYSA-N	444.448	1.490	50	20	IDGD	
CCOC(=O)[C@@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNc2ncccc2F)cc1F	807300151	BDPARTGBPRZWNG-SNVBAGLBSA-N	435.387	1.123	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)C(=O)Nc1cc(F)ccc1OC[C@@H]1CCCO1	807429274	QZYUQBURSKDSMR-AWEZNQCLSA-N	441.423	1.441	50	20	IDGD	
CCc1nnc(NC(=O)[C@@H](C)[C@H](C)NC(=O)NNC(=O)COc2ccc(F)cc2)s1	807565852	QWVOFRURJHBQOB-QWRGUYRKSA-N	438.485	1.612	50	20	IDGD	
C[C@H](CCOCc1ccccc1)NC(=O)NNC(=O)c1csc(N2CCOCC2)n1	807607605	RBPYBKFEEGBUAN-OAHLLOKOSA-N	433.534	1.919	50	20	IDGD	
NS(=O)(=O)c1ccc(C=NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1Cl	807944488	CSNIURXRAZAQNU-UHFFFAOYSA-N	449.964	1.650	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)Nc2ccc3c(c2)C(=O)N(CC2CC2)C3=O)cc1	808832874	SERMPUDMEUWBRY-UHFFFAOYSA-N	433.424	1.796	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)Nc1cc(C(N)=O)ccc1OCC(F)F	810343487	ZDUFBIZWQWZCIP-UHFFFAOYSA-N	438.387	1.670	50	20	IDGD	
CC(=NNC(=O)c1ccc(Br)s1)c1ccc(S(=O)(=O)CC(N)=O)cc1	814759982	WAYHAYJVFKHKMB-UHFFFAOYSA-N	444.332	1.924	50	20	IDGD	
CC(C)(C)[C@H]1CCc2nc(NC(=O)C(=O)NNC(=O)[C@@H]3CCc4nncn4C3)sc2C1	815692492	SBGQSGHKSBIQAF-NEPJUHHUSA-N	445.549	1.234	50	20	IDGD	
C[C@H](C(=O)NNc1ccccc1S(=O)(=O)N(C)C)S(=O)(=O)c1ccc(F)cc1	817054599	PQMGWKCPJPWMIT-GFCCVEGCSA-N	429.495	1.382	50	20	IDGD	
CN(C)N(C(=O)[C@@H]1CC(=O)N(c2ccccc2Br)C1)[C@H]1CCS(=O)(=O)C1	914438451	YYOZHMLKSNYNNU-OLZOCXBDSA-N	444.351	1.294	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)C3=NN(c4ccccc4)C(=O)[C@@H](C)N3)cc2C1	915188930	ISOCSSXSEADEAU-QWHCGFSZSA-N	425.514	1.972	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)CS(=O)(=O)CCCc1ccccc1	915287435	QRXKJEFNQFQTSV-UHFFFAOYSA-N	442.541	1.794	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)NC[C@@H]1CN(Cc2ccccc2)CCO1	915895275	ZUWMQRKCSJDGMO-QGZVFWFLSA-N	443.460	1.205	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)c1nc2ccccc2[nH]1	915926580	GABGZGQBDMSCCO-LBPRGKRZSA-N	430.490	1.518	50	20	IDGD	
O=C(COc1cccc(Br)c1)NNC(=O)C1CCN(c2ncccn2)CC1	916095083	SRFNPYCYMYJFPO-UHFFFAOYSA-N	434.294	1.682	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NCc2ccccc2Cn2ccnc2)c2ccccc2c1=O	916230883	PWSANZNNUUXISK-UHFFFAOYSA-N	431.456	1.323	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)NCc2ccc(CN3CCN(C)CC3)cc2)c1	916387588	FTKRJAWROQBUHF-UHFFFAOYSA-N	441.532	1.595	50	20	IDGD	
O=C(NCCN1CCN(c2ccccc2)CC1)NNC(=O)c1nnc(O)c2ccccc12	916514580	GOPZQSKQPYEDIT-UHFFFAOYSA-N	435.488	1.102	50	20	IDGD	
COc1cccc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1OC	918233390	DOHCGQUCPUOTFG-UHFFFAOYSA-N	436.490	1.098	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2ccc(OCC(=O)OC)cc2)c2ccccc2c1=O	918277792	KWBJTKRFWVPUGM-UHFFFAOYSA-N	438.440	1.433	50	20	IDGD	
CCCn1c(C)cc(/C=C(\C#N)C(=O)N2CCN(C(=O)CN3C(=O)CCC3=O)CC2)c1C	918701527	CWWRWYMLFBWMSY-CPNJWEJPSA-N	439.516	1.242	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)[C@H](C)NC(=O)C1CCCCC1	919636735	YNXGLVQUCCJFGU-LBPRGKRZSA-N	439.896	1.738	50	20	IDGD	
Cc1cc(C)cc(N2CC[C@H](C(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)C2=O)c1	919692563	QAIQZBFKOLMGCR-GOSISDBHSA-N	433.468	1.364	50	20	IDGD	
Cc1cccc(OC[C@@H](C)NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1	919781334	LACQUPYXMFWHKV-OAHLLOKOSA-N	434.518	1.657	50	20	IDGD	
Cc1ccc([C@]2(C)NC(=O)N(CC(=O)NNC(=O)NCCc3cccs3)C2=O)cc1	920860173	MMRIYXYNRHXMPG-FQEVSTJZSA-N	429.502	1.397	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(CC(=O)NNc2cncc(Br)c2)C(=O)C1	1116399651	HQQXWGFRHWLFRR-UHFFFAOYSA-N	428.287	1.367	50	20	IDGD	
CC(=NNC(=O)c1n[nH]c2c1CCCC2)c1ccc(S(=O)(=O)N2CCOCC2)cc1	1317748669	WPGOVWKBHBQGGL-UHFFFAOYSA-N	431.518	1.463	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1	1317920344	HHIBJEVRRLYSAP-QGZVFWFLSA-N	425.489	1.541	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)NCCC(=O)Nc2ccccc2)CC1	1322976444	UQWLYPYHBFJMSG-UHFFFAOYSA-N	433.509	1.993	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4cnccc4n3)C2)C1	1777736595	YHZSPJJBALNRQM-BFUOFWGJSA-N	433.306	1.857	50	20	IDGD	
COc1ccc2cc(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)[C@H](O)CCl)C4)[nH]c2c1	1778550360	HYLGYANDYBUNRN-WOIUINJBSA-N	449.935	1.904	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1nc(O)n3c1CCCC3)CCO2	1779297813	ALSHTIVQJWPEPT-HXUWFJFHSA-N	436.585	1.220	50	20	IDGD	
Cn1nc(C(F)(F)F)cc1C(=O)N1CCO[C@]2(CCN(C(=O)CO[Si](C)(C)C)C2)C1	1779299331	XGVSOJKPJDYBSR-KRWDZBQOSA-N	448.518	1.734	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](C)Nc3ccccn3)C2)C1	1779332343	VGHUPXJMVBCXNN-DOXZYTNZSA-N	439.354	1.885	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc[n+]([O-])cc2)C1	1779946087	PTHFNDDNJOMUSL-FRQCXROJSA-N	440.338	1.621	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(OC)cc(OC)c3)C2)C1	1780663270	BLBARBBNVBVDDI-PXNSSMCTSA-N	426.897	1.401	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@](C)(Cl)CCl)C1	1780711615	KAKTWHXQLZNZLP-QIZIZJAASA-N	437.368	1.184	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)C3CCC4(CC3)OCCO4)CCO2)C1	1781231865	GMFZHKDMBKGGCT-RBUKOAKNSA-N	449.375	1.986	50	20	IDGD	
O=C([C@@H](F)Br)N1CCO[C@]2(CCN(C(=O)[C@@H]3Cc4ccccc4N3)C2)C1	1782841622	FPIXVRICEABZQC-DAYGRLMNSA-N	426.286	1.544	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)/C=N/O[C@H]3CCCCO3)CCO2)C1	1783349548	NGOMCZOXSLOACD-IMUBYKMJSA-N	446.342	1.519	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)c1cccnc1S	1783546601	BPXGXJYNHWALJH-BQUFFADESA-N	432.315	1.654	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(=O)c4ccccc4o3)CCO2)C1	1783870159	VFSLSLOIMVXSCM-VFNWGFHPSA-N	434.876	1.490	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCN3CCCC3)C[C@@H]21	1783975170	HKDGHVVPPJWHRI-QAETUUGQSA-N	430.387	1.483	50	20	IDGD	
COc1ccc(F)cc1CC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](C)Br)CCO2	1784087854	ROVPZCOKDUMHLI-ORAYPTAESA-N	443.313	1.990	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CSc3ccncc3)[C@H]2C1	1785162696	XILRZYJCMLMQPN-VRKREXBASA-N	442.379	1.937	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3coc(Cl)n3)[C@H]2C1	1785672923	JSIWBHOOHVDQMJ-BLFANLJRSA-N	434.718	1.952	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CSc3ncccn3)[C@H]2C1	1787072767	WRHIOMSNAINIQI-KKUMJFAQSA-N	426.970	1.813	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc([N+](=O)[O-])cc4c3OCC4)C[C@@H]21)[C@H](F)Cl	1787448210	YFRAJCOFCUMUCZ-SIUGBPQLSA-N	441.843	1.657	50	20	IDGD	
O=C([C@@H](O)CCl)N1CC[C@H]2CO[C@@H](CNC(=O)[C@]3(F)CCCCC3(F)F)[C@H]2C1	1788172111	SPXLVHNRQWSKDA-GGOFEBJYSA-N	426.863	1.483	50	20	IDGD	
Cn1ncc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]3C2)c1Cl	1789924789	WSQBFOZSBAPIOC-VGDYDELISA-N	437.697	1.357	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3n[nH]c(C4CC4)c3F)C[C@@H]21	1791056939	IOIAEPQYLRIAQT-BQUFFADESA-N	443.317	1.803	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4c(c3)C(=O)CC4)C[C@@H]21	1791256789	HZBWLZJETUBWNB-CAIZAGQASA-N	434.920	1.663	50	20	IDGD	
CC[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2C1)c1ccccc1	1791288823	WEEGENNOGQAKTR-WOZUAGRISA-N	444.576	1.533	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)C[C@@H]21)C(Cl)Cl	1791296748	IHZONZXOMXEEFS-HERUPUMHSA-N	432.260	1.697	50	20	IDGD	
COC(C)(C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN(C)NC(=O)NCc1ccccc1)C2	1792653488	QRDYYXRHPXKPTF-REPLKXPHSA-N	445.564	1.396	50	20	IDGD	
Cc1nc(F)ccc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)CBr	1792872679	WFBYWLQKHOKUEQ-VFFTVRQLSA-N	428.302	1.763	50	20	IDGD	
COc1ccc(C2(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@@H](O)CCl)CCC2)cc1	1792978520	FKZGERVDBJWTFH-QXGSTGNESA-N	436.936	1.306	50	20	IDGD	
CO[C@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](O)CCl)C2	1793836362	LWSVHTIGYMSGPI-AQGHMYMLSA-N	447.960	1.153	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1scnc1C1CC1)c1cccc(B(O)O)c1	1794843907	FLDINHWNUCBVFY-BJWYYQGGSA-N	425.319	1.266	50	20	IDGD	
Cc1cnc(Cl)c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Br)C3)c1	1794968013	QZBWEYOZVXATRF-LYIQGSDWSA-N	434.693	1.937	50	20	IDGD	
Cc1cnc(Cl)c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)c1	1795344029	SWJMKMXNBNZQFD-BJWYYQGGSA-N	427.697	1.289	50	20	IDGD	
CC(C)(C)CCCCCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(B(O)O)cc1	1795736782	KEAZGASCOXTHOB-HATOLVCRSA-N	444.381	1.566	50	20	IDGD	
COc1nccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@](C)(Cl)CCl)C3)c1F	1795910341	FOUIIMRSWUPFFU-WZTYKQCMSA-N	434.295	1.669	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2c(c1)CCN2C	1797019826	NCZJKBPPBIQYDK-GMLZMKKNSA-N	436.350	1.666	50	20	IDGD	
Cc1nc2ccc(F)cn2c1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2	1799955355	NOHNFQCNFYJYKM-GNXNZQSNSA-N	429.279	1.789	50	20	IDGD	
CC(C)(C)OC(=O)NCCOCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C(Cl)Cl)C2	1800057786	LHSGFRMOIFOKSO-CLLJXQQHSA-N	438.352	1.970	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)COc1ccc(O)nn1	1801269899	UFTWKKGGVZIRBQ-RNJOBUHISA-N	427.299	1.373	50	20	IDGD	
O=C(CCBr)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cn1cccc([N+](=O)[O-])c1=O	1801354764	CMARREQOWYANDR-CLLJXQQHSA-N	441.282	1.180	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H]1C[C@@]13C(=O)Nc1ccccc13)C2	1802284952	STBHIMIYBYLGBA-HODVPAKSSA-N	431.920	1.788	50	20	IDGD	
C[C@H](Sc1ccccn1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc(B(O)O)c1)C2	1802889997	RJKSIIIODATDBT-FZDIXFNVSA-N	439.346	1.194	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H]2Cc3ccccc3CN2)[C@H]1c1cccnc1)[C@H](O)CCl	1803138580	CRPRJQVFHHXKCZ-BURNTYAHSA-N	442.947	1.402	50	20	IDGD	
Cn1cc(CC(=O)N2CC[C@H](CNC(=O)CCBr)[C@H]2c2cccnc2)cn1	1806346487	IBJQZXIZFFMJFB-VQIMIIECSA-N	434.338	1.849	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC2(CCCN(C(=O)[C@@H](F)c3ccccc3)C2)CC1	1806515186	MHBDYGJJWXZEQT-NRFANRHFSA-N	438.308	1.922	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)CNC(=O)c2cc(C)on2)[C@@H]1c1cccnc1	1808263855	PZBGKVRYINPCNK-TXPKVOOTSA-N	447.923	1.831	50	20	IDGD	
C=C(Oc1ccccc1O)C(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1	1808400854	PGNCENZCENQOTJ-HQRMLTQVSA-N	445.903	1.985	50	20	IDGD	
CC[C@@H](NC(C)=O)C(=O)N1CC[C@H](CNC(=O)[C@@H](F)Br)[C@H]1c1cccnc1	1808649490	SIAMPOJQHKGDSD-KLHDSHLOSA-N	443.317	1.693	50	20	IDGD	
Cc1cnn(CC(=O)N2CC[C@H](CNC(=O)[C@@H](F)Br)[C@H]2c2cccnc2)c1	1808662882	SKRWQWQPCVKGPO-DJIMGWMZSA-N	438.301	1.983	50	20	IDGD	
CC(C)c1cc(C(=O)N2CCCC3(CCN(C(=O)c4cccc(B(O)O)c4)CC3)C2)no1	1808738309	YFNPOYGGFJKKCJ-UHFFFAOYSA-N	439.321	1.636	50	20	IDGD	
C[C@@H]1CCC[C@@H]1C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1809656371	KAYCDVDRQJOYSK-MWRLGJARSA-N	435.333	1.517	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1	1810527311	PFMKHPVVZGDVCX-XUWXXGDYSA-N	437.338	1.563	50	20	IDGD	
Cc1ocnc1C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1811076560	QLYZJESBUUPNEC-OXJNMPFZSA-N	428.493	1.071	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)c2c[nH]c(=O)cn2)[C@H]1c1cccnc1	1811458208	LQICQWTXFCKOCW-DETPVDSQSA-N	434.294	1.268	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)c1cc2ncccc2[nH]1	1812074170	SLHHXGREUWEAGD-GDIGMMSISA-N	427.892	1.877	50	20	IDGD	
COc1cnc(C(=O)N2CC[C@H](CNC(=O)[C@H](C)Br)[C@@H]2c2cccnc2)cn1	1812863555	FGTXWGVAXYRUSQ-QEORTHHSSA-N	448.321	1.983	50	20	IDGD	
CC(C)[C@H](S)C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1813069091	UZCXVONTEVTVMF-UXPWSPDFSA-N	435.594	1.415	50	20	IDGD	
O=C(/C=C/c1ccccc1)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1	1815339414	DYGZONQZPADHEI-QPEODSHDSA-N	447.325	1.762	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](C)CBr)CC2	1817010540	JXORKYZHEITJHQ-BBBLOLIVSA-N	446.371	1.533	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)cc(O)n1	1817471890	UTPMOOIBLKFPKX-GOSISDBHSA-N	449.276	1.118	50	20	IDGD	
Cn1cc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)[C@H](O)CCl)[nH]n2)c(C(F)F)n1	1818368386	KLEGCROTTKVZJQ-VXGBXAGGSA-N	430.843	1.986	50	20	IDGD	
C[C@H](Cn1cncn1)C(=O)N[C@H]1CCc2nc(NC(=O)CO[Si](C)(C)C)sc2C1	1820165379	FHGVIMUNXOJVKR-OLZOCXBDSA-N	436.614	1.834	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)C2CC(F)(F)C2)CC1	1823852232	REEIBWWLJNJEQJ-GOSISDBHSA-N	449.502	1.964	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1c[nH]c(=O)cn1)CC2	1825645706	ILLPNCKERDKTOE-YUMQZZPRSA-N	426.296	1.236	50	20	IDGD	
Cc1ccc(CC(=O)N[C@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)cc1	1826085369	OMUCYOMYNABWGM-INIZCTEOSA-N	443.573	1.979	50	20	IDGD	
CN1CCC(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@](C)(Cl)CCl)C3)C2)CC1	1829894611	QHJRLMJXFYKLER-MOPGFXCFSA-N	436.380	1.021	50	20	IDGD	
O=C(C1CC(F)(F)C1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1829991768	VYFASQUIMOHMTF-BXUZGUMPSA-N	429.233	1.179	50	20	IDGD	
CC[C@H](O)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1	1830526776	LUDBUFGQEFBOPB-IVXLGNKDSA-N	449.454	1.099	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)[C@H]2[C@H]3SC=C[C@H]32)CC1	1831153158	OVQOANRCJIYITC-BURNTYAHSA-N	440.374	1.475	50	20	IDGD	
CNCCCC(=O)N1CCC(N2CCC(NC(=O)[C@@H](C)CBr)CC2)CC1	1833263790	SLTZDIRXMUDEMI-HNNXBMFYSA-N	431.419	1.589	50	20	IDGD	
C[C@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)[C@@]3(C)CCCN3)CC2)CC1	1833264986	TUKRDCOSAWZECF-FOIQADDNSA-N	443.430	1.731	50	20	IDGD	
C[C@@H](Nc1nccs1)C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)CCl)CC2)CC1	1833310406	GODRSICODANVSU-CZUORRHYSA-N	444.001	1.115	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cscn3)CCO2)C1	1834260014	UVVWINBHELITOW-BLLLJJGKSA-N	432.340	1.387	50	20	IDGD	
Cc1nn(C)cc1C(=O)N1CCC(N2CCC(NC(=O)CCBr)CC2)CC1	1834422503	QNQFGIBSIBUPLP-UHFFFAOYSA-N	440.386	1.699	50	20	IDGD	
O=C(/C=C/c1cccs1)NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1834809131	IGPVLCSRACEOEK-OAJJDEHYSA-N	425.982	1.933	50	20	IDGD	
Cc1nn[nH]c1C(=O)NC1CCN(C2CCN(C(=O)[C@H](C)CBr)CC2)CC1	1834931877	XGBYHNFJFILNFY-GFCCVEGCSA-N	441.374	1.329	50	20	IDGD	
CC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](Br)Cc3ccccc3)C2)C1	1835204352	AZEOLDFPMRNWLU-HKUYNNGSSA-N	425.323	1.469	50	20	IDGD	
C=CC(=O)N[C@@H](C)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](Cl)CCC)CC2)CC1	1835827825	YSFNHYYWMITEHL-YJBOKZPZSA-N	426.989	1.656	50	20	IDGD	
CC[C@H](Br)C(=O)NC1CCN(C2CCN(C(=O)c3ccncn3)CC2)CC1	1836541994	RDDXCFSXTFGGCT-INIZCTEOSA-N	438.370	1.835	50	20	IDGD	
CC(=O)N[C@@H](C(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)C(C)(C)C	1836713330	DQNGPFBNELPNOM-ROUUACIJSA-N	445.988	1.136	50	20	IDGD	
Cc1cc(C)n(CCC(=O)N2CCC(OC3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)n1	1836720239	MROMWUPGWCSZQY-IBGZPJMESA-N	440.972	1.488	50	20	IDGD	
CC(C)(C)OC(=O)CC(=O)N1CCOC[C@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1837710292	SVQIMUCYXUGTFT-HXUWFJFHSA-N	444.601	1.026	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccsc3)C2)C1	1837711662	NBBXIEFPZRWNGD-IBGZPJMESA-N	426.611	1.599	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnoc3C3CC3)C2)C1	1837712424	QAUCFECUBWGBEQ-FQEVSTJZSA-N	437.569	1.474	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(OC2CCN(C(=O)[C@H]3C[C@H]3F)CC2)CC1	1838102808	ANWREUAPZBTPAE-GSPMAKAHSA-N	447.511	1.477	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)N1CCC(OC2CCN(C(=O)[C@H](F)Br)CC2)CC1	1838427725	FACWPFCSYORFTI-WBMJQRKESA-N	448.333	1.366	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cc(O)ccc3O)CC2)CC1	1838690299	JLQYIKFEIFIPDG-GOSISDBHSA-N	440.924	1.964	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)cc1	1838967856	ZOGGKFFDIONFHW-IFXJQAMLSA-N	441.322	1.549	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CS[C@@H]3CCCCO3)C2)C1	1839145419	HGDABOQDWFUAMF-KVSKMBFKSA-N	434.986	1.720	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3n[nH]c4c(F)cccc34)C2)C1	1839145973	SJBFUZTUUJFRMI-VBKZILBWSA-N	438.887	1.789	50	20	IDGD	
C=C[C@H](O)C(C)(C)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2	1839153980	XGYHEPURMNYFKW-KYNGSXCRSA-N	437.364	1.252	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)ccc1F	1839321827	WQKICTWMPXYMIK-IFXJQAMLSA-N	443.313	1.988	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc4cccnc4nc3O)CCO2)C1	1839514138	XMVVUSIFIVRQKR-HRAATJIYSA-N	448.907	1.423	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cccnc3)C2)C1	1839964130	HOZYFCQBNAFWDI-LPHOPBHVSA-N	440.338	1.254	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(O)cc3F)C2)C1	1840035128	GWMXSRARJPMKNW-KZULUSFZSA-N	445.285	1.385	50	20	IDGD	
O=C(c1cn2ccccc2n1)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840187648	OZFIDNPMYAJENM-SFHVURJKSA-N	427.288	1.208	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1C[C@@]1(F)Cl)CCO2	1840248232	YNWYSHBSVDFPBS-JLUCKKNBSA-N	427.698	1.151	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCCn3ccnc3C)CCO2)C1	1840386398	YMMLPBHQCLDZIU-WIYYLYMNSA-N	440.972	1.836	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@H]1C(=O)N1CC2(CCCN2C(=O)[C@H](C)CBr)C1	1841289643	LRPPQWGTCXPZNC-RBSFLKMASA-N	427.339	1.976	50	20	IDGD	
COc1ccc(CCC(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)cc1	1842646699	LHVVWKHSWHSPCW-UHFFFAOYSA-N	437.500	1.144	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC2(CCCN2C(=O)c2ccc3c(n2)NC(=O)CC3)C1	1843231539	DRYUTNUVEGLFAP-LBPRGKRZSA-N	435.322	1.814	50	20	IDGD	
Cc1ccc(COCC(=O)N2CCCC23CN(C(=O)c2ccc(B(O)O)cc2)C3)cc1C	1843435377	VGPPOEAJGPBOAL-UHFFFAOYSA-N	436.317	1.017	50	20	IDGD	
O=C(C(Cl)Cl)N1CC2(CCCN2C(=O)c2n[nH]cc2I)C1	1844466930	XTTQFGWNZSDDJM-UHFFFAOYSA-N	443.072	1.635	50	20	IDGD	
CC(C)[C@H](S)C(=O)N1CC2(CCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)C1	1845038178	AVZXDWZWROZANP-IBGZPJMESA-N	447.605	1.490	50	20	IDGD	
C=CC[C@H](C)C(=O)N1CC2(CCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)C1	1845039376	JLFRCVXXSCGWTL-SFHVURJKSA-N	427.549	1.748	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)c2ccc(OC(F)F)cc2)C1	1845377585	QNQLWVZAQHFIDL-UHFFFAOYSA-N	430.216	1.099	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@H]1CC13CN(C(=O)OC(C)(C)C)C3)C2	1846365023	WJCGUDGBLHVPTD-LSDHHAIUSA-N	441.956	1.701	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)/C=C/c2cnc[nH]2)C1	1846533032	LWKYKQABZRIWIV-ZZXKWVIFSA-N	439.428	1.774	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CCc1cnc2ccccc2c1	1847466767	VOLKTPUVKRYQNP-SFTDATJTSA-N	437.544	1.742	50	20	IDGD	
COc1ccc(-c2noc(CCC(=O)NNC(=O)c3n[nH]c(=O)c4ccccc34)n2)cc1	14346921	FCLMMUSEIHJRHN-UHFFFAOYSA-N	434.412	1.376	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)c1cnc2sccn2c1=O	15762848	VATCRNSWRPHMHU-SECBINFHSA-N	437.275	1.747	50	20	IDGD	
CSCC[C@H](C(=O)NNC(=O)COc1cccc(C)c1)N1C(=O)c2ccccc2C1=O	16005560	YJKLBLIIFFHWAV-GOSISDBHSA-N	441.509	1.939	50	20	IDGD	
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)[C@@H](C)Oc1ccccc1F	23567124	JIYISWWYZBFQNY-YJYMSZOUSA-N	426.448	1.969	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=O)c2cc(Br)c[nH]2)c1	23914793	GKLJGHIQUYWXSN-UHFFFAOYSA-N	449.714	1.756	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)CN2C(=O)N[C@]3(CCCC[C@H]3C)C2=O)cc1	195489465	MEIJXMHLNGHORJ-HLFMIMNKSA-N	446.504	1.501	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCCN1CCOC(C)(C)C1	726262800	RJJSHQHIYJAPCZ-ZDUSSCGKSA-N	443.342	1.658	50	20	IDGD	
O=C(CSC[C@@H]1CCCCO1)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	727365396	RIKQBZOZJAMVSF-INIZCTEOSA-N	441.575	1.534	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)c2cc(C)c(C)c(S(N)(=O)=O)c2)cc1F	727499179	NYVJYMVUYMRRCT-UHFFFAOYSA-N	426.495	1.730	50	20	IDGD	
CNS(=O)(=O)c1cccc([C@@H](C)NC(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)c1	727607760	JAPKQGWZFBEFOD-CQSZACIVSA-N	447.517	1.242	50	20	IDGD	
COC(=O)c1ccc(COc2ccc(C=NNC(=O)[C@@H](C)NS(C)(=O)=O)cc2)cc1	728437972	ZATHLWYSFUFUBJ-CQSZACIVSA-N	433.486	1.440	50	20	IDGD	
CNC(=O)c1ccc(C(=O)NNC(=O)COc2ccc(OCc3ccccc3)cc2)cn1	728511187	CNTMCFJRLWAFEU-UHFFFAOYSA-N	434.452	1.860	50	20	IDGD	
Cc1cccc(-n2ncc(C(=O)OCC(=O)NNC(=O)Cc3nc(C)cs3)c2C)c1	728721010	RPKSKGOQDUFREE-UHFFFAOYSA-N	427.486	1.801	50	20	IDGD	
O=C(CN1CCN(Cc2nc(-c3cccs3)no2)CC1)NNC(=O)c1ccccc1	729469840	IHLWVNYJHXLLBB-UHFFFAOYSA-N	426.502	1.377	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCCN1CCOC[C@@H]1C	729614204	JQYCREMEMYARFR-STQMWFEESA-N	429.315	1.268	50	20	IDGD	
O=C(NCCCN1CCN(c2ccncc2)CC1)NNC(=O)c1cccc2ncccc12	730125839	OOCMYHXRXQMOOA-UHFFFAOYSA-N	433.516	1.786	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])cc1C	731059057	PBIDKQLEKSCSSH-UHFFFAOYSA-N	447.835	1.381	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)NCCCN1CCN(C(=O)OC(C)(C)C)CC1	731544660	ZBVQJJXKGHDGHU-UHFFFAOYSA-N	435.525	1.582	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)N2CCN(S(N)(=O)=O)CC2)c(C)n1-c1ccc(F)cc1	732069470	XJJTYVMJEOULCG-SFQUDFHCSA-N	431.493	1.488	50	20	IDGD	
Cc1ccc(C(=O)N2CCC[C@@H](C(=O)NNC(=O)CCN3C[C@H](C)O[C@H](C)C3)C2)cc1	732261708	OPWCAZNCGWMCQP-WSTZPKSXSA-N	430.549	1.494	50	20	IDGD	
Cc1c(NC(=O)[C@H](C)SCC(=O)NNc2cnccn2)c(=O)n(-c2ccccc2)n1C	734245208	MKVOGFDWNCBWGH-AWEZNQCLSA-N	441.517	1.478	50	20	IDGD	
CCC(CSc1ccc(Cl)cc1)=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O	734299013	OOMBCFNKNCYBKX-UHFFFAOYSA-N	441.966	1.899	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNC(=O)N[C@@H]2CCN(CCN3CCOCC3)C2)cc1	734686708	SMQIKGJSQABHLJ-HXUWFJFHSA-N	447.580	1.462	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)Cc2ccc(OCC#N)cc2)CC1	734820980	CHPHWQCWZFCEOY-UHFFFAOYSA-N	431.493	1.861	50	20	IDGD	
CS[C@@H]1CCC[C@H](NC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)C1	735385364	YHHQZRQRROAEJJ-LSDHHAIUSA-N	442.611	1.318	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)Cn2c(C(F)(F)F)ccc(C(N)=O)c2=O)cc1C	735980065	XAFFJPKXSUKFLO-UHFFFAOYSA-N	430.408	1.360	50	20	IDGD	
O=C(COC(=O)c1cc(Cl)cc([N+](=O)[O-])c1)NNC(=O)[C@H]1COc2ccccc2O1	736862251	DJPAAUQWJCPHQS-OAHLLOKOSA-N	435.776	1.392	50	20	IDGD	
CSCC[C@@H](C)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	737063526	HLUYRJUNFSWVJC-CQSZACIVSA-N	428.580	1.947	50	20	IDGD	
Cc1nn(C)cc1[C@H](C)NC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	739033413	CBLAVJMSFPMEIP-ZDUSSCGKSA-N	434.522	1.218	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)CCCc2nc(C3CC3)no2)CC1	739733158	KLRPZTIWMVMZAD-UHFFFAOYSA-N	436.513	2.000	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)[C@@H]1CN(Cc2ccccc2)CCO1	741172065	IGZKOTINMSBRDR-SFHVURJKSA-N	448.317	1.876	50	20	IDGD	
O=C(Cc1csc(N2CCOCC2)n1)NNC(=S)N[C@@H]1CCOc2ccccc21	741475887	ILZLODOFPYIQDO-OAHLLOKOSA-N	433.559	1.541	50	20	IDGD	
CC(C)(C)CNC(=O)c1ccc(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1	741558789	LSFDIXIZFSYFLP-UHFFFAOYSA-N	438.532	1.930	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)c2ccc(Cl)c(N3CCCC3=O)c2)c1	744590032	OUSBOLWBZORBTA-UHFFFAOYSA-N	440.843	1.956	50	20	IDGD	
CCO[C@H]1C[C@@H](NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)C12CCC2	745851332	OVLVBSUVSLIKEX-UXHICEINSA-N	429.565	1.877	50	20	IDGD	
Cc1nc2c(c(O)nn2C)c(C)c1CCC(=O)NNC(=O)c1cc(Br)c[nH]1	746103166	QMXYSZVIWLIXPX-UHFFFAOYSA-N	435.282	1.775	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)N[C@@H]3CCCN(CC(F)(F)F)C3=O)n[nH]2)cc1	746338689	GLCNHHZROFCEIY-CYBMUJFWSA-N	438.410	1.882	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)CC[C@@H]2Cc3ccccc3NC2=O)n1	746920978	ZQWNRKJEKXBURG-CQSZACIVSA-N	430.486	1.276	50	20	IDGD	
O=C(Cn1nc(Br)nc1Br)NNC(=O)c1cccc(Cl)c1	748626160	CTWFIFAJVBPLLE-UHFFFAOYSA-N	437.479	1.918	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1Cl	748640164	SXSCWVFGTICEIT-MRXNPFEDSA-N	425.850	1.448	50	20	IDGD	
O=C(NNc1ccc(OCC(F)(F)F)cc1)C1CCN(c2ccc3nnnn3n2)CC1	748702663	KJLSYXSRMPTIDG-UHFFFAOYSA-N	436.398	1.820	50	20	IDGD	
COCCNS(=O)(=O)c1c[nH]c(C(=O)NNc2ccc(Br)cc2C)c1	748736872	JCDHZMHYAMSONG-UHFFFAOYSA-N	431.312	1.767	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNc2nc(Br)cn3ccnc23)c1	750246964	KCWDPCUNFNIPNX-UHFFFAOYSA-N	439.295	1.499	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)C[C@H](O)c2ccc(Cl)cc2)cc1OC	750370287	BIQTZJVSASTMTQ-HNNXBMFYSA-N	436.848	1.785	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)c1ccc(-n2ccnc2)nn1	750663934	RJZGYPULMSUECS-LLVKDONJSA-N	431.250	1.653	50	20	IDGD	
CCC(=O)NCc1cc(S(=O)(=O)NNC(=O)c2ccc3ccccc3n2)ccc1OC	751539542	ZVQFURBRCLUDKV-UHFFFAOYSA-N	442.497	1.893	50	20	IDGD	
C[C@H](NC(=S)NNC(=O)c1ccc(S(=O)(=O)N(C)C)c(Br)c1)C1CC1	751616371	CCYHKUITSGFSOE-VIFPVBQESA-N	449.396	1.607	50	20	IDGD	
O=C(NNc1cccnn1)c1cc(S(=O)(=O)N2CCCCC2)ccc1N1CCOCC1	753099060	KATPWPCMBRALKX-UHFFFAOYSA-N	446.533	1.245	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)NCCCc3nc(-c4ccc(F)cc4)no3)nc21	753260225	DEPIOPMEIMUEQS-UHFFFAOYSA-N	427.400	1.517	50	20	IDGD	
CC(=O)c1c(C)[nH]c(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1C(C)C	753388329	LMMYOHVSHWYNMZ-UHFFFAOYSA-N	434.518	1.974	50	20	IDGD	
O=C(CO)NNC(=O)Cc1cn(-c2ccccc2)nc1-c1ccc(Br)cc1	753436783	CJOUBWLIANVNPI-UHFFFAOYSA-N	429.274	1.984	50	20	IDGD	
O=C(CO)NNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc2ccccc2c1	753451389	DQLRTBUHNMJQNV-NRFANRHFSA-N	430.464	1.802	50	20	IDGD	
CS(=O)(=O)NCc1ccc(C(=O)NNC(=O)C2=S=C3CCCCCCC3=C2)o1	753566237	PLVMEOYBCZQNQH-UHFFFAOYSA-N	425.532	1.462	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNS(=O)(=O)c2cc(Cl)cnc2N)c1	754748533	FLFFSAIEFGIPPP-UHFFFAOYSA-N	435.687	1.712	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2ccc(C[C@@H]3CC(=O)NC3=O)cc2)cc1OC	756815526	LVFQHZAYFLVNLN-CQSZACIVSA-N	426.429	1.376	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2cnn(-c3ccccc3)c2)ccc1Cl	757478184	TYHULBJEONLKMM-UHFFFAOYSA-N	434.861	1.936	50	20	IDGD	
COC(=O)c1cc(NC(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)cn1C	757672287	YCOVYNSRLSRKEY-UHFFFAOYSA-N	426.433	1.569	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2ccc(C(=O)OC)c(F)c2)c2ccccc2c1=O	757696401	PAWWSRGYBOQOHD-UHFFFAOYSA-N	427.392	1.809	50	20	IDGD	
CN(C)N(C(=O)c1ccc2c(=O)n(-c3ccccc3)c(O)nc2c1)[C@@H]1CCS(=O)(=O)C1	757866958	PCMQYNCORAXJBP-MRXNPFEDSA-N	442.497	1.197	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)Nc2c(C)nn([C@H]3CCS(=O)(=O)C3)c2C)cc1	757872377	XWNNKXGAONIZMQ-HNNXBMFYSA-N	435.506	1.400	50	20	IDGD	
COc1ccc(C(=O)N[C@H](C(=O)NNC(=O)C(=O)Nc2ccccn2)c2ccccc2)cc1	758827788	NJKXBEWJXUEBFY-IBGZPJMESA-N	447.451	1.347	50	20	IDGD	
COCCS(=O)(=O)c1ccc(CNC(=O)NNC(=O)COc2ccc(F)cc2)cc1	759400496	WQAIGGTXWZFQNK-UHFFFAOYSA-N	439.465	1.155	50	20	IDGD	
CCO[C@@H]1C[C@H](NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)[C@@]12CCCO2	760141250	HKCMONULQSRVBQ-MZKRTTBSSA-N	445.564	1.256	50	20	IDGD	
COC(=O)CS(=O)(=O)Cc1ccc(CNC(=O)NNc2ccc(Cl)nn2)cc1	760198873	GWSNCYOWBQLBJK-UHFFFAOYSA-N	427.870	1.044	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccnn2-c2cc(C)ccn2)cc1OC	760277699	PMZCEIZZFMBTTR-UHFFFAOYSA-N	438.444	1.383	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc([N+](=O)[O-])c(C(=O)O)c1)c1ccccc1Br	760336485	FVJGKLKHOFLKRC-UHFFFAOYSA-N	444.219	1.679	50	20	IDGD	
CCOc1ccccc1C(=O)N1CCC[C@@H]1C(=O)NNC(=O)CCNC(=O)OC(C)(C)C	760440394	XCUVYWBFKWLDFC-MRXNPFEDSA-N	448.520	1.752	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)C3(N(C)C)CCC3)c2)cc1	762964539	NTEGQLYMRFWBKR-UHFFFAOYSA-N	446.529	1.741	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cccc1C(=O)N1CCCC1	763442850	UITSLNIHXGWZHO-UHFFFAOYSA-N	439.428	1.539	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1cccc2c1CN(c1ccccn1)C2	763470489	IXCYSPGIWXDARL-UHFFFAOYSA-N	446.423	1.910	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)Nc1ccc(F)cc1Br	763571259	KXGMOWJPBAJKBY-CQSZACIVSA-N	438.209	1.514	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)Nc1ccc(CCN2CCCC2)cc1	763575566	XLCOVBNDLWTAGK-HXUWFJFHSA-N	438.484	1.251	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cccc(CN3CCOC3=O)c2)c2ccccc2n1	763615215	LYKJQGZNVIJTDI-UHFFFAOYSA-N	447.451	1.895	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)C(=O)N(C)CC3)c2ccccc2n1	763615775	HQURZFFQXNBEBG-UHFFFAOYSA-N	431.452	1.571	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccc(CCN2CCCC2)c1	763663481	JIPBMXLRJPCTRW-UHFFFAOYSA-N	440.500	1.498	50	20	IDGD	
Cc1cccc(C(=O)N2CCCC2)c1NC(=O)C(=O)NNC(=O)COc1ccccc1F	763679526	NDIDMGCPADMFHU-UHFFFAOYSA-N	442.447	1.535	50	20	IDGD	
O=C(CN1CCCc2ccccc21)NNC(=O)C(=O)Nc1ccc(OC(F)F)c(F)c1	763746026	OXGYNWVFXVLCQO-UHFFFAOYSA-N	436.390	1.966	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(N3C(=O)CCCC3=O)cc2)cc1	763812042	BLWVOYIURYWBBK-UHFFFAOYSA-N	438.440	1.203	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cccc(CN(C)C)c2)cc1	763872204	LTNLOJGRESCHMZ-OAHLLOKOSA-N	426.473	1.504	50	20	IDGD	
CCn1cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2c(C)cc(Cl)cc2C)ccc1=O	763884370	VNWYQNMATOMYNU-ZDUSSCGKSA-N	434.880	1.692	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ncn(C3CCCCC3)n2)cc1OC	763910352	FRTUCXMREGPZPX-UHFFFAOYSA-N	444.492	1.980	50	20	IDGD	
Cc1noc(COc2ccc(NC(=O)C(=O)NNC(=O)Cc3ccc(F)cc3)cc2)n1	763918365	BLCIWHQCMIHTPV-UHFFFAOYSA-N	427.392	1.425	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)Cc2ccc(Cl)cc2)c(OC)c(OC)c1	763935770	AXFJSXMNCHGWGW-UHFFFAOYSA-N	449.847	1.472	50	20	IDGD	
CC(C)(C)OC(=O)N1CCc2c(cccc2NC(=O)C(=O)NNC(=O)c2ccc[nH]2)C1	763980161	VUFZWOJFMOGBDW-UHFFFAOYSA-N	427.461	1.708	50	20	IDGD	
CC[C@@H](C)NS(=O)(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2ccccc2OC)c1	764049177	WBDQQLVQCFKRHV-CYBMUJFWSA-N	448.501	1.172	50	20	IDGD	
CCOC(=O)c1ccccc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccc(C)cc2)[nH]n1	764111247	DWEGJHVQTCRCJV-UHFFFAOYSA-N	435.440	1.962	50	20	IDGD	
Cc1ccc(C(=O)N2CCSCC2)cc1NC(=O)C(=O)NNC(=O)CC(F)(F)F	764116936	QBZBFAJMFSTXDX-UHFFFAOYSA-N	432.424	1.222	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2cc(N3CCOC3=O)ccc2C)cc1	764130596	ACXKQXZWDQKJRH-UHFFFAOYSA-N	440.456	1.679	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)CCc2ccco2)cccc1C(=O)N1CCSCC1	764177648	RNJMQVHPCBFWQD-UHFFFAOYSA-N	444.513	1.496	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(NC(=O)C(=O)NNC(=O)CCC(C)C)ccc1Cl	764202748	JBOHDPCGVFZQIU-UHFFFAOYSA-N	446.957	1.893	50	20	IDGD	
CO[C@@H](C)C(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)CCc2ccccc2O)c1	764281207	MOICVCWEMWQUAQ-ZDUSSCGKSA-N	428.445	1.084	50	20	IDGD	
O=C(NNC(=O)C(F)(F)Oc1ccccc1)C(=O)Nc1ccccc1CN1CCOCC1	764370957	UGPWEECROMQXQF-UHFFFAOYSA-N	448.426	1.277	50	20	IDGD	
CCNC(=O)NNC(=O)CSc1nnc(COc2ccccc2)n1Cc1ccco1	765119924	VBLBALLAMGZCCD-UHFFFAOYSA-N	430.490	1.941	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)c1ccc(=O)n(-c2ccccc2F)n1	765528390	HEYRFLZCIUCYPA-UHFFFAOYSA-N	426.404	1.610	50	20	IDGD	
COc1ccc(-c2ncc(C(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)s2)cc1OC	766375456	WLWBEGYNXGFHDM-NSHDSACASA-N	425.488	1.023	50	20	IDGD	
CC[C@@H](OC1CCCCC1)C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	766642137	JSPPVAMDZGNKSJ-HXUWFJFHSA-N	430.549	1.720	50	20	IDGD	
CCC(=O)N1CCCC[C@H]1C(=O)NNC(=O)CN1CCN(Cc2ccc(C)cc2)CC1	766642483	RNNWRSUZGUZDPL-FQEVSTJZSA-N	429.565	1.051	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)c1ccc(=O)n(-c2ccc(F)cc2)n1	767281970	JQQAYZJRVQSYNJ-UHFFFAOYSA-N	438.415	1.227	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1cn(C)nc1-c1cccs1	768278228	GSWYLDYWZQOVLG-UHFFFAOYSA-N	432.531	1.825	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNS(=O)(=O)c2ccc(C(=O)O)c(F)c2)c1	768501047	YCJRNEXTCVUABQ-UHFFFAOYSA-N	447.238	1.918	50	20	IDGD	
COc1ccc(-c2nnc(S)n2CCC(=O)NNC(=S)NCCSC)cc1	770240780	RINZXKHIHPDCOM-UHFFFAOYSA-N	426.593	1.491	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)cn1	771435971	IZWULNQLNGLBJP-UHFFFAOYSA-N	439.444	1.259	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)C(=O)Nc2ccc(N3CCC(N(C)C)CC3)c(F)c2)n1	773478175	JWKZXDNCOGYKJH-UHFFFAOYSA-N	429.500	1.845	50	20	IDGD	
CC[C@H](C)NS(=O)(=O)Cc1cccc(NC(=O)C(=O)NNc2nc(C)cc(C)n2)c1	773482359	XKSGIJAFUSOLED-LBPRGKRZSA-N	434.522	1.393	50	20	IDGD	
CON(C)S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccc3ccccc3n2)cc1	773662271	OWBKFOKTRKGFOZ-UHFFFAOYSA-N	429.458	1.499	50	20	IDGD	
O=C(NNC(=O)c1c(Cl)cccc1Cl)N[C@H]1CCO[C@]2(CCS(=O)(=O)C2)C1	776075768	DVFGOKXYJSLEFB-MGPLVRAMSA-N	436.317	1.674	50	20	IDGD	
CC[C@@H](C)Oc1cc(C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)ccn1	777523360	KVEIHFCGRQOXTB-OAHLLOKOSA-N	448.549	1.347	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NN=Cc1ccc(OCC(=O)O)c(Br)c1	777898277	KCNWTHHMHZWJFS-UHFFFAOYSA-N	430.255	1.887	50	20	IDGD	
COc1ccc2nc(NNC(=O)Cn3cc(Br)c(O)nc3=O)c(C)cc2c1	778481190	ZMKJORUNASBVDA-UHFFFAOYSA-N	434.250	1.720	50	20	IDGD	
C[C@@H](NC(=O)OC(C)(C)C)[C@@H]1CCN(CC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)C1	778980954	ZPLXDMFWFGYRCE-UKRRQHHQSA-N	435.481	1.591	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@@](C)(C#N)CC(=O)OC(C)(C)C)c2ccccc2c1=O	780315286	QQNLMAIHUDYYBD-OAQYLSRUSA-N	427.461	1.439	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1)c1ncn(C)n1	780700676	PHVPAQMDICKIGJ-AWEZNQCLSA-N	446.475	1.222	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)N[C@@H]2CCN(c3sccc3C(=O)OC)C2=O)c1	780837904	NESOOTRFYSZOCU-CQSZACIVSA-N	432.458	1.753	50	20	IDGD	
N#Cc1ccc(N2CCC[C@@H](NC(=O)NNC(=O)c3ccc4c(c3)OCCO4)C2=O)cc1	780895105	WKSKXHUKEYZIMD-QGZVFWFLSA-N	435.440	1.469	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cnn(C)c2C(F)(F)F)o1	782116461	BFKDWZKLGIOEQU-UHFFFAOYSA-N	430.387	1.273	50	20	IDGD	
CC(=O)N1CCN(c2cccc(NC(=O)C(=O)NNc3ccc([N+](=O)[O-])cc3)c2)CC1	782125246	YIALFKIVTGJDRF-UHFFFAOYSA-N	426.433	1.345	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNS(=O)(=O)c2c(C)cc(C)c(CC(=O)O)c2C)c1	782250624	ZFXIJMIDEUSIOL-UHFFFAOYSA-N	436.486	1.879	50	20	IDGD	
Cc1ccc(-n2nccc2NC(=O)C(=O)NNc2ccc(Br)cc2F)nn1	783080591	IFWMONKJGBUKEJ-UHFFFAOYSA-N	434.229	1.954	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(C)(OCC(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)C1	783623725	VPYFLGJORNRFPF-UHFFFAOYSA-N	449.512	1.756	50	20	IDGD	
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)NNC(=O)c1cn(C)c2ccccc12	783807387	RPIZKXGVMZXWKN-UHFFFAOYSA-N	432.414	1.496	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)C(=O)Nc1ccc(Cl)cc1Br	784005036	XJWOEAZVUANGEE-UHFFFAOYSA-N	443.641	1.211	50	20	IDGD	
Cn1c(=O)n(C)c2cc(NC(=O)C(=O)NNc3ccc(C#N)c(C(F)(F)F)c3)ccc21	784238697	RWYISCYSPJWPKB-UHFFFAOYSA-N	432.362	1.849	50	20	IDGD	
CN1CC(=O)N(c2cccc(NC(=O)C(=O)NNc3ccc([N+](=O)[O-])cc3Cl)c2)C1=O	784382782	MVYNCVDXROVKDB-UHFFFAOYSA-N	446.807	1.728	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)N[C@H]1COc2cc(F)cc(F)c21	784575118	NWTGMRFKZFVADE-NSHDSACASA-N	425.417	1.336	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(OC)c(NC(=O)C(=O)NNc2ccc(F)cc2)c1	784786415	SBJLDKOXBMMXAX-UHFFFAOYSA-N	438.481	1.947	50	20	IDGD	
Cc1nc(Cn2nnc(C(=O)NNC(=O)CCCOc3ccc(Cl)cc3C)c2C)no1	784810527	HWFBWQXEEUJZND-UHFFFAOYSA-N	447.883	1.908	50	20	IDGD	
C[C@@H]1CN(c2ccccc2NC(=O)C(=O)NNc2cccc(S(C)(=O)=O)c2)C[C@@H](C)O1	784841410	IOJPSXYSEJJFRH-HUUCEWRRSA-N	446.529	1.786	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)C(=O)Nc2ccc(N3C[C@H](C)O[C@H](C)C3)nc2)c1	784850697	ADRGNRSJRAZKEN-OKILXGFUSA-N	427.461	1.564	50	20	IDGD	
CNS(=O)(=O)c1ccc2c(c1)N(C(=O)C(=O)NNc1cc(F)c(F)cc1F)CC2	784886980	YKJHZOZAVFFNGJ-UHFFFAOYSA-N	428.392	1.044	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)C(=O)Nc1ccc(Oc2ccccn2)cc1	785061562	XTBQMVYNKYNMLT-UHFFFAOYSA-N	430.424	1.850	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNc2cc(F)c(F)c(F)c2)cc(S(C)(=O)=O)c1	785088397	LDJQNNBGLUCFKR-UHFFFAOYSA-N	445.375	1.376	50	20	IDGD	
O=C(NNc1c(F)cc(C(=O)NC2CC2)cc1F)C(=O)Nc1ccc(-n2nccn2)cc1	785100071	OKXPAAKBNOQNDR-UHFFFAOYSA-N	441.398	1.520	50	20	IDGD	
COC(=O)c1ccsc1NC(=O)C(=O)NNc1c(F)cc(C(=O)NC2CC2)cc1F	785100093	PGFGNMMMPAEAQY-UHFFFAOYSA-N	438.412	1.787	50	20	IDGD	
O=C(COC(=O)Cc1ccc([N+](=O)[O-])cc1Cl)NNC(=O)[C@H]1COc2ccccc2O1	785949175	SUNKHXWCPJVBLI-MRXNPFEDSA-N	449.803	1.321	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cnn(-c3ccc(C)cc3C)c2)cc1	786415096	WOEFEUMNOLLVAN-UHFFFAOYSA-N	437.456	1.663	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)[C@@H]2CCC[C@@H](C(N)=O)C2)c2ccccc2c1=O	786688721	RWFMXIHXCQMAJD-HUUCEWRRSA-N	427.505	1.639	50	20	IDGD	
CS(=O)(=O)c1ccc(NCCNC(=O)/C(C#N)=C/c2ccc(O)cc2)c([N+](=O)[O-])c1	786762383	DSFMXPHBZNNIFV-GXDHUFHOSA-N	430.442	1.839	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)Nc1ccc2ccc(=O)n(C)c2c1	787543389	JORVOAYSTJDHHJ-UHFFFAOYSA-N	446.261	1.039	50	20	IDGD	
CN(C)NC(=O)Nc1cccc(NC(=O)C2=NN(c3ccc(F)cc3)[C@H](C(N)=O)C2)c1	788254420	IDDOUMNJVQDFAO-KRWDZBQOSA-N	427.440	1.483	50	20	IDGD	
CN(C)NC(=O)Nc1cccc(NC(=O)c2ccc(S(=O)(=O)N3CCOCC3)cc2)c1	788256572	XYMYDGBWNUXLLC-UHFFFAOYSA-N	447.517	1.558	50	20	IDGD	
O=C(NNc1nnc(-c2ccccn2)s1)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])o1	788556441	NCITWRKDYUTMTE-NSHDSACASA-N	429.418	1.849	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2ccc(O[C@H]3CCOC3)cc2)cc1	788719509	GHOPUPBWUAKBDE-SFHVURJKSA-N	447.513	1.244	50	20	IDGD	
O=C(NNC(=O)[C@H]1OCC[C@H]1c1ccccc1)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1	789823982	YFEUMBASVHHMAZ-BBRMVZONSA-N	432.820	1.907	50	20	IDGD	
Cc1ccn(C[C@@](C)(O)C(=O)NNC(=O)c2ccc(COc3ccccc3)o2)c(=O)c1	790483809	SOKXOWHKPDTDSC-JOCHJYFZSA-N	425.441	1.541	50	20	IDGD	
O=C(NNC(=O)N1CC(=O)N(C2CC2)C1)[C@@H]1Cc2ccccc2CN1Cc1ccccc1	790505794	ZDDRCDPZXUXFFF-NRFANRHFSA-N	433.512	1.618	50	20	IDGD	
Cc1ccc(CN2CC[C@@H](NC(=O)NNC(=O)c3cc(Br)c[nH]3)C2=O)cc1	790694753	JQJNOHQHOYJSOA-CQSZACIVSA-N	434.294	1.831	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)N[C@H]1CCN(Cc2ccc(C)cc2)C1=O	790698996	UXNDTXMQHOONAC-KRWDZBQOSA-N	426.473	1.514	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNS(=O)(=O)c2ccccc2CC#N)CC1	794591360	YEXUXLLEIMOAJH-UHFFFAOYSA-N	437.522	1.645	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCN(C)c3cc(Br)ccc32)n1	796375537	JUGPXFMIJJCYTC-UHFFFAOYSA-N	438.351	1.860	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1O)Nc1cc(S(=O)(=O)N2CCCC2)ccn1	797675212	FAKXCDSEYOLMSS-UHFFFAOYSA-N	439.881	1.692	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](Cc2ccc(F)cc2)n2nnnc2C)cc1C	798307680	BRKKXXORWVPXDK-GOSISDBHSA-N	439.451	1.307	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2c(F)ccc([N+](=O)[O-])c2C)o1	800622425	FBMFJLYHIYHRSI-UHFFFAOYSA-N	435.412	1.877	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)CN2C(=O)N[C@@](C)(c3ccccc3OC)C2=O)cc1	802056463	PCYNNFFQRPUCOM-NRFANRHFSA-N	441.444	1.324	50	20	IDGD	
CC1(C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)CCN(c2ccc(Cl)cc2C#N)CC1	804185149	VVDRQLCGRMHBOJ-ZDUSSCGKSA-N	438.937	1.400	50	20	IDGD	
CCCc1nnc(SCC(=O)NNC(=O)COc2ccc(Br)cc2)n1N	808054545	ZOWFYAKFNNXHCY-UHFFFAOYSA-N	443.327	1.025	50	20	IDGD	
CCS(=O)(=O)N1CCC([C@H](C)N(C)C(=O)NNC(=O)Cn2ccc3ccccc32)CC1	808267232	ZCRSCLTVACTCQG-INIZCTEOSA-N	449.577	1.764	50	20	IDGD	
CC[C@@H]1[C@H](C(=O)NNC(=O)CCN2C[C@@H](C)O[C@H](C)C2)CCN1C(=O)OC(C)(C)C	809981608	QWHVOKKYEGDAET-QBPKDAKJSA-N	426.558	1.669	50	20	IDGD	
CC(C)(C)n1cnc(C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)n1	812534771	RFAOYQVTNNDKFI-UHFFFAOYSA-N	433.944	1.265	50	20	IDGD	
CCOC(=O)c1ccc(NNC(=O)CCc2c(C)nc(N3CCOCC3)nc2O)cc1C	812720630	NMRRBLNVUIDSGW-UHFFFAOYSA-N	443.504	1.888	50	20	IDGD	
CC(C)OCc1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)cc1	813033213	JUYPSPCUBKXIGV-UHFFFAOYSA-N	434.518	1.944	50	20	IDGD	
NS(=O)(=O)c1cc(C=NNC(=O)c2csc(N3CCOCC3)n2)ccc1Cl	814749860	PVRZWVFNPAEMSQ-UHFFFAOYSA-N	429.911	1.044	50	20	IDGD	
Cc1nc(NC(=O)C(=O)NNC(=O)c2cn(-c3ccccc3)nc2-c2ccccc2)nn1C	815564177	AAGKSVWAISPLDY-UHFFFAOYSA-N	444.455	1.376	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)cc(OC)c1C	815569864	KKLRMTKWVZKVBR-UHFFFAOYSA-N	441.419	1.941	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)c2cccnc2N2CCOCC2)C1	816510059	LKJBXWKZFYABMV-HNNXBMFYSA-N	433.509	1.326	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)c2ccc(OC)c(-n3cnnn3)c2)c1	818750071	DDVGQMLNENVZAP-UHFFFAOYSA-N	447.249	1.977	50	20	IDGD	
CCCn1c(=O)n(CCC(=O)NNC(=O)CNc2ccccc2OC)c2ccccc21	825644222	ZERDBQUDXVRRRK-UHFFFAOYSA-N	425.489	1.871	50	20	IDGD	
CC(C)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCN(Cc3ccccc3)CC2)c1	915775797	RBHLGTMGMLAPRO-UHFFFAOYSA-N	444.557	1.610	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)CNS(=O)(=O)c1ccc(Cl)cc1	915776475	XDDXZVDYSVBELS-UHFFFAOYSA-N	449.920	1.378	50	20	IDGD	
CC1(C)CC(NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)CC(C)(C)N1	915882123	JUIDXTPPDWLERE-UHFFFAOYSA-N	430.597	1.838	50	20	IDGD	
CC(=NNC(=O)c1ccc(CSc2nncn2C)cc1)c1cccc(S(N)(=O)=O)c1	915938839	JWYJIEBZKKWKTQ-UHFFFAOYSA-N	444.542	1.909	50	20	IDGD	
N#Cc1ccc(CSCC(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1	917262316	REOYWAVKVRTIPL-GOSISDBHSA-N	441.465	1.322	50	20	IDGD	
CCN(CCCNC(=O)NNC(=O)c1cc(C)n(-c2ccccc2)c1C)S(C)(=O)=O	918119364	UAMHQZALDCMNFS-UHFFFAOYSA-N	435.550	1.710	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)NC[C@H]3CCCO3)cc2)c(O)c1	918337114	BWVGXAWQXHFWJX-OAHLLOKOSA-N	433.486	1.233	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc(C#N)n1C	918645717	XEIULIKXOGLJQI-ODLFYWEKSA-N	437.525	1.663	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)CCNC(=O)c2ccsc2)cc1	919585386	KSPBNGDIKBTZCE-UHFFFAOYSA-N	444.542	1.750	50	20	IDGD	
CC(C)C[C@@H](NC(=O)c1ccc(Cl)cc1)C(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1	919885916	PQSURZUHDUXPRQ-HUUCEWRRSA-N	444.941	1.002	50	20	IDGD	
Cc1nc(CSc2ccc(C(=O)NNC(=O)N[C@@H]3CCS(=O)(=O)C3)cc2)cs1	919888217	AXDUWYBBJMSRPN-CYBMUJFWSA-N	440.572	1.875	50	20	IDGD	
CN(C)C(=O)COc1ccccc1C=NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	920362572	FQRGAZOLUJPHAR-UHFFFAOYSA-N	432.502	1.168	50	20	IDGD	
C[C@H]1CN(Cc2csc(NC(=O)NNC(=O)[C@H]3COc4ccccc4O3)n2)C[C@@H](C)O1	920932982	ZAAFIGKTQCULLN-IIYDPXPESA-N	447.517	1.745	50	20	IDGD	
COC(=O)c1ccc(S(=O)(=O)NNC(=O)c2n[nH]c3c2CCCC3)cc1C(F)(F)F	1117057003	STXLCPRVSALSPW-UHFFFAOYSA-N	446.407	1.717	50	20	IDGD	
O=C(NNC(=S)NC[C@H]1CCOC1)c1cccc(NC(=S)NC[C@@H]2CCOC2)c1	1319380811	MJPNCDFTLTXLSZ-UONOGXRCSA-N	437.591	1.155	50	20	IDGD	
CNS(=O)(=O)c1ccc(CC(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)cc1	1320995482	TVIWQQNLMOODTQ-LBPRGKRZSA-N	425.894	1.406	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)c1ccc(N2CCC[C@H](C(N)=O)C2)cc1	1324036099	FQCMBPMMUABHBG-HOCLYGCPSA-N	428.464	1.756	50	20	IDGD	
COC(=O)c1ccc(C(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)o1	1324130156	ZLDWIHSAFZQROW-UHFFFAOYSA-N	446.419	1.899	50	20	IDGD	
O=C(NNC(=O)c1cncn1-c1ccccc1)c1cc([N+](=O)[O-])ccc1N1CCOCC1	1337038687	MBFOUSFQFFIOPQ-UHFFFAOYSA-N	436.428	1.692	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)c2ccc(S(=O)(=O)NC[C@H](C)O)cc2)c1C	1346622048	YGQKSAVXRPHPAA-GOEBONIOSA-N	449.529	1.191	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](F)Cl)C3)C1	1778758218	FWBWKVRJZVVIEE-QEEYODRMSA-N	447.935	1.902	50	20	IDGD	
CN(C)c1cncc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)c1	1781224137	HYVIOTBCORXHLY-RBUKOAKNSA-N	429.348	1.827	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)c3cc4n(n3)CCCC4)CCO2)C1	1781229921	LHVJUMFKLNHGLH-MOPGFXCFSA-N	429.348	1.899	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)N1CCO[C@@]2(CCN(C(=O)[C@@](C)(Cl)CCl)C2)C1	1781231778	FHICZSDNDQPJPU-ROUUACIJSA-N	438.352	1.577	50	20	IDGD	
Cc1nc(CC(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)c(C)s1	1781326153	KUZRJNDXTLPEEN-GDBMZVCRSA-N	434.331	1.823	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1	1782004260	ARWOCGNLXYGTRE-KRWDZBQOSA-N	447.713	1.980	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnc3ccccn13)C2	1782172386	ATPVJOPEHNSEKR-QLVMHMETSA-N	434.924	1.716	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2)[C@H](O)c1ccccc1Cl	1782388914	NMLJYMIMDGKTRP-TVKQPGBESA-N	445.343	1.487	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](O)Cc3ccccc3)C2)C1	1783340982	FXGYBZWRKBIXDR-GMBSWORKSA-N	425.323	1.203	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)C34CC(C(=O)OC)(C3)C4)C2)C1	1783446158	JLFUSXYOMRJOEL-CYBNEDPLSA-N	443.338	1.333	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(Cl)cnc3O)CCO2)C1	1783528416	NRUPLHCTLRJVON-HWPZZCPQSA-N	432.702	1.668	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cccnc1C(C)(C)C)CCO2	1783933546	AAXCDRIZKGASDU-QHCPKHFHSA-N	445.564	1.196	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1c(F)cccc1Cl)CCO2	1783934988	MKSUCFXQIQSOMV-FQEVSTJZSA-N	440.903	1.296	50	20	IDGD	
C[C@H](CC(=O)N1CCO[C@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1)c1ccccc1	1783937550	URUXETCABHESSU-JPYJTQIMSA-N	430.549	1.383	50	20	IDGD	
Cc1cn2c(=O)c(C(=O)N3CCO[C@]4(CCN(C(=O)C(Cl)Cl)C4)C3)cnc2s1	1783947450	CCYOQJQEJXCPIF-KRWDZBQOSA-N	445.328	1.312	50	20	IDGD	
COC(=O)[C@@H]1CC[C@@H](C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]32)C1	1784088115	VOBAYOUBUBKFEB-SOZFZDDXSA-N	449.375	1.792	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3cc(C)n(C)n3)[C@H]2C1	1784243106	VWAXWOLOWOXTJK-HJWJTTGWSA-N	441.370	1.424	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3ccc(OC)c(C)c3)[C@H]2C1	1784843388	OHETZYAJJQMMST-JPLJXNOCSA-N	438.952	1.780	50	20	IDGD	
C[C@H](CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21)NC(=O)OC(C)(C)C	1787467211	ADOAQISZSIVSDS-BLDNINTCSA-N	435.924	1.804	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4c(c3)CC(=O)N4)C[C@@H]21	1788764646	QPDCKAWEOKJMEW-IEZWGBDMSA-N	445.592	1.626	50	20	IDGD	
Cc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]32)c(O)n1	1789311071	UDWXFPAYTGKOBB-XPVILTJLSA-N	430.332	1.925	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3c(F)cccc3F)[C@H]2C1	1789631174	FILVJUBRMWFKLR-FRQROOTJSA-N	430.879	1.741	50	20	IDGD	
C[Si](C)(C)OCC(=O)Nc1ccc(C2(NC(=O)CN3C(=O)C=CC3=O)CCC2)cc1	1789650028	AFLGTVULURRIFI-UHFFFAOYSA-N	429.549	1.897	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CSCC(=O)O)C[C@@H]21	1789873310	UNTNKTDMAPYFIF-YWDSYVAPSA-N	427.350	1.020	50	20	IDGD	
CN(C)c1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]3C2)nc1	1789922950	YVGIWLRIDRWXOK-DLKVLKDVSA-N	443.317	1.431	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4ncsc4[nH]3)C[C@@H]21)[C@H](F)Br	1789926380	VWWGUZWGYCTDGL-VDUILEQBSA-N	445.314	1.908	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCCn3cccc3)C[C@@H]21)[C@H](F)Br	1789926945	LUQMMNVVCXHNSR-JKQORVJESA-N	430.318	1.939	50	20	IDGD	
Cc1c([N+](=O)[O-])ccc(F)c1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21	1790237433	IJBYVBVJAJICIV-RKLWJJNISA-N	443.859	1.235	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN3CCCCC3=O)C[C@@H]21	1790963866	MYTAKXSYRFOKDH-VGWMRTNUSA-N	444.370	1.152	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)c3ccccc3Cl)C[C@@H]21	1791256419	QFKPFFMYEAYJBF-FZGQVQIUSA-N	445.343	1.607	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1ccc(C2(NC(=O)CNCP(=O)(O)O)CCC2)cc1	1791561961	ACHOAODVSUYJQX-AWEZNQCLSA-N	433.829	1.099	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccn3cncc3c1)C2	1792870383	GARWWLDXRKPFGI-FAYQHZLMSA-N	435.322	1.569	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2)[C@@H]1CC(=O)N(Cc2ccccc2)C1	1793206592	UGKONBDDJGBWLS-VYDRJQSISA-N	437.899	1.159	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cn1c(=O)n(C)c3ccccc31)C2	1793449824	NCPZJMNJTAUMFZ-UIVXKWKOSA-N	448.951	1.337	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(OC)n1	1794531824	YFBGCKBTHOAPAG-OQMKEHIESA-N	426.311	1.467	50	20	IDGD	
COc1c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCBr)ccc(F)c1F	1795115326	YPJWRGUSMMCJMO-CULMDFNYSA-N	447.276	1.962	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)c1ccc(-c2ncc[nH]2)cc1	1796190679	XTPVFPPAANDYDL-WKCHPHFGSA-N	444.300	1.322	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CC(=O)N(Cc3cccs3)C1)C2)[C@@H](F)Cl	1796361502	GZLAMYRLGFAXJA-XIUQWWLSSA-N	443.928	1.221	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(Br)nc1F)C2)[C@H](F)Cl	1796361941	RURCJVGWXZDGRS-VVJJBPBLSA-N	438.656	1.721	50	20	IDGD	
CC(C)(C)OC(=O)N1CC2(C[C@H]2C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Cl)C1	1796370085	HFPPOAQAYIXRRA-AICCOOGYSA-N	445.919	1.367	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1nnsc1C1CC1	1796645561	QOIYDMJDYGGCNG-UZTWBRENSA-N	433.361	1.855	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc2cc(O)ccc2n1	1797381693	GYEWXVDGYKAAPY-BJWYYQGGSA-N	439.516	1.565	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1c(C)nc2sccn12	1797546085	IEYQUCYWYKQKQF-XJFOESAGSA-N	426.926	1.161	50	20	IDGD	
C[C@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@](C)(Cl)CCl)C2)n1ccccc1=O	1797935498	IIOFQTWYNVSRBA-HUYPOWGKSA-N	430.332	1.235	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnn2cccnc12	1798020244	KJKWBTLSHLGECI-LCFLCXBCSA-N	448.487	1.115	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cn1ccnc1)C2	1799220091	NNXOAYIUXUCWMK-MUJYYYPQSA-N	441.444	1.669	50	20	IDGD	
C[C@H](Nc1cccnc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@](C)(Cl)CCl	1799275042	LUUDWXCRSMEUJA-MABMQTIPSA-N	429.348	1.708	50	20	IDGD	
Cc1ccccc1NCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Br	1799346471	RKSISNNUUKOAAY-DLTLXFJOSA-N	428.302	1.687	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(O)c([N+](=O)[O-])c1	1799483832	ONWQKYZETHGZIM-ABXQLRGKSA-N	446.287	1.740	50	20	IDGD	
COc1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CCC(=O)NN(C)C)C3)cc1OC	1799638680	GQOPRZVXIUBLLZ-BJWYYQGGSA-N	432.521	1.329	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(F)c(N(C)C)c(F)c1	1799836231	XVTZKOSTMPTSGK-LOUJCGABSA-N	445.894	1.488	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1cnn2cccc(F)c12	1800123651	HENFUXPWECZAQA-YJKIEOBBSA-N	443.248	1.367	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1C[C@@H]1F)C2)[C@@H](Br)Cc1ccccc1	1800436704	NBPIQLWGOQLARJ-COZGXFGHSA-N	439.325	1.940	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](O)c1ccccc1Cl	1801199364	DDRRMTVBGJCAFZ-GTYSZEQSSA-N	441.000	1.815	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)Cn1ccnc1	1801375578	GQTWIHNTXWQPJA-IBEHDNSVSA-N	427.343	1.282	50	20	IDGD	
C[C@H](Cc1ccccn1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnccc1C(=O)NN)C2	1802735416	ODDRPNPCNMPHDR-NRSFXHEJSA-N	436.516	1.211	50	20	IDGD	
CC(C)(CCl)C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1802899411	ARQZMXHPQGGYTD-HKUYNNGSSA-N	443.740	1.346	50	20	IDGD	
C[C@H](Oc1cccnc1)C(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]1c1cccnc1	1803145851	JCATXGOKJPQKRB-WLWJZTKJSA-N	432.908	1.550	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)c1ccc2c(n1)OCCO2	1808180301	BPBBPQXQOQLIFU-QILLFSRXSA-N	446.891	1.167	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)Cc2ccc3ncnn3c2)[C@H]1c1cccnc1)[C@@H](F)Cl	1808314974	LOOVFASBQLLAKP-ZYSHUDEJSA-N	430.871	1.907	50	20	IDGD	
O=C(c1ccc2nc[nH]c2c1)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1	1809978718	LTBRULUZQSNAJA-UHFFFAOYSA-N	446.316	1.401	50	20	IDGD	
CCCC(=O)N[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)[C@H](Cl)COC)[C@H]1c1cccnc1	1810513886	IGNOIDOJDKPLOJ-XZKMEQPCSA-N	438.956	1.646	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1)c1ccnnc1O	1811222539	MOJPWHBDSCOFMI-XJKSGUPXSA-N	434.294	1.682	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)C2=NNC(=O)C2)[C@H]1c1cccnc1	1812776633	TYPYVJOFKFSCCO-XEZPLFJOSA-N	436.310	1.137	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2cccc(=O)n2C)[C@H]1c1cccnc1	1813029140	CIICUAFBMVFGSO-GJYPPUQNSA-N	432.908	1.354	50	20	IDGD	
Cc1cc[nH]c1C(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1813069733	BBCCTQUFUFLTPQ-LAUBAEHRSA-N	426.521	1.411	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)CCc2ccoc2)[C@@H]1c1cccnc1	1813074044	NYEMYLZUTYVCSW-WMZHIEFXSA-N	441.532	1.686	50	20	IDGD	
C[C@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1)C1(O)CCC1	1814428981	RGQNOTRBOOFUJS-ZBFHGGJFSA-N	434.541	1.326	50	20	IDGD	
CNc1nsnc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](Cl)COC)[nH]n1	1814434631	JLLKWCBLRDUVGT-GXSJLCMTSA-N	427.918	1.863	50	20	IDGD	
O=C(CN1CCCC1=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](F)Br)CC2	1814597298	AFZIEUBTCSDGJX-SDBXPKJASA-N	433.303	1.368	50	20	IDGD	
Cc1ccc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)cc1	1815343841	RROKVVWHLPCVIK-QGZVFWFLSA-N	435.314	1.671	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)Cn3cncn3)sc2C1	1815670317	HRKAPFCXLAIYFA-UWVGGRQHSA-N	427.328	1.520	50	20	IDGD	
CNCCCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[nH]n1	1817309085	XCEZBLBUXQOXPW-YSGZUTGPSA-N	442.524	1.535	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)CCBr)[nH]n1)c1nc2ncccn2n1	1818616681	AKUCGCMFHQGVBG-LBPRGKRZSA-N	447.297	1.938	50	20	IDGD	
Cc1nocc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819402285	ZKDRKHNOKKWCBZ-INIZCTEOSA-N	438.448	1.324	50	20	IDGD	
COc1cccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)c1	1820514007	JSBGLLPNLWFDJN-HXUWFJFHSA-N	448.288	1.718	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)COc2ccccc2)[nH]n1	1822412958	LPYHSSTTXNLPTD-SFHVURJKSA-N	442.520	1.854	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)[C@@H]1CCCSC1	1823452378	GCUFBVRFAWSEDC-QAPCUYQASA-N	442.350	1.539	50	20	IDGD	
CCCC(=O)N[C@H](C)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](Cl)COC)sc2C1	1826000450	SXCFZWYIOAKLSN-IJLUTSLNSA-N	430.958	1.614	50	20	IDGD	
CN1CCN(CC(=O)N2CCC([C@H]3CCCCN3C(=O)CCBr)CC2)CC1	1826358822	MHJHZCIOKLPDAS-GOSISDBHSA-N	443.430	1.639	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cn4ncccc4n3)C2)C1	1830362185	NNJKTWWSTWHVCL-FQEVSTJZSA-N	435.912	1.064	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)n3cccc3)C2)C1	1830545900	ODETZOHXUCZMQA-JTDSTZFVSA-N	442.354	1.537	50	20	IDGD	
Cc1cc2cccc(C(=O)N3CCOC[C@]4(C3)CN(C(=O)[C@@H](O)CCl)CCO4)c2[nH]1	1830728045	NNBQHTMNTKMEAX-UWJYYQICSA-N	435.908	1.146	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CSC3CCCC3)CCO2)C1	1831365109	ZXBFUCXDTUHFDJ-APWZRJJASA-N	434.986	1.372	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(O)nc(O)n2)CC1	1831652900	MGNUVGMHWYIUIU-SMDDNHRTSA-N	441.326	1.905	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3c(O)cc(O)cc3O)C2)C1	1831654092	QHKVZOAZAAISPJ-VLIAUNLRSA-N	442.896	1.281	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H]2[C@H]3SC=C[C@H]32)CC1	1831874578	KIBKVHSDCKIKPO-NLEAXPPASA-N	434.606	1.854	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cn3nnc4ccccc43)CCO2)C1	1832199010	PWNYJJCQUOOHIX-IERDGZPVSA-N	449.939	1.295	50	20	IDGD	
CC(=O)N[C@H](C(=O)NC1CCN(C2CCN(C(=O)[C@H](F)Cl)CC2)CC1)C(C)(C)C	1833402537	QUYRUTSJKQTMKE-SJORKVTESA-N	432.968	1.643	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3scnc3C3CC3)CCO2)C1	1833732258	RHKOVHXZAUGQBV-IFXJQAMLSA-N	443.953	1.344	50	20	IDGD	
Cc1nc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)CBr)C3)C2)co1	1834203791	NQZWQDKQYIVZRG-SJKOYZFVSA-N	430.299	1.084	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cscn3)CCO2)C1	1834260015	UVVWINBHELITOW-LRDDRELGSA-N	432.340	1.387	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cncc(F)c3)CCO2)C1	1834358808	FOURGWFVZUBOQO-CRAIPNDOSA-N	444.301	1.464	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnc(OC)c(C)c3)CCO2)C1	1834574409	DEEVVKVILJNSFD-LAUBAEHRSA-N	439.940	1.876	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccc(F)c(F)c3)CCO2)C1	1835144388	USPRBOLRFGWSPH-QRWLVFNGSA-N	446.878	1.218	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)c1cccn2cncc12	1835613434	AKRCPCRBYKPGDT-IBGZPJMESA-N	433.940	1.119	50	20	IDGD	
COC[C@H](NC(C)=O)C(=O)N1CCC(OC2CCN(C(=O)C(C)(C)CCl)CC2)CC1	1836623874	ZZBXWOMREGMOSS-SFHVURJKSA-N	445.988	1.401	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](CC)NC(N)=O)CC2)CC1	1836920175	YVEUPXLZEHVPMN-IAGOWNOFSA-N	430.977	1.839	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(Cl)nc(OC)c3)CCO2)C1	1838233019	ZQRKHRVSHHJPOR-KUHUBIRLSA-N	446.331	1.831	50	20	IDGD	
CCNC(=O)N[C@@H](C)C(=O)N1CCC(OC2CCN(C(=O)[C@H](Cl)CC)CC2)CC1	1838383019	VOXTUTJLPMQRDJ-WMLDXEAASA-N	430.977	1.710	50	20	IDGD	
CCCC(=O)N[C@H](C)C(=O)N1CCC(OC2CCN(C(=O)[C@H](Cl)COC)CC2)CC1	1838425945	JWVQKKLRNXGWCZ-CRAIPNDOSA-N	445.988	1.544	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4c(c3)CC(=O)N4)C2)C1	1839146460	ZHNSVGCEEGFRBQ-KKSFZXQISA-N	435.908	1.269	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CC3CCOCC3)C2)C1	1839151930	IJZPDEVERHQBMQ-RBUKOAKNSA-N	437.364	1.496	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc([N+](=O)[O-])[nH]3)C2)C1	1839153497	IKPSTLBYSUXCQA-SJORKVTESA-N	449.291	1.229	50	20	IDGD	
Cc1ccn(C)c1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839201718	HKRIOUBEXRIHDI-PBHICJAKSA-N	432.290	1.094	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc4c3NC(=O)C4)CCO2)C1	1839571897	RZGJYPLKSFHMQO-JOCHJYFZSA-N	449.935	1.516	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCO[C@]2(COCCN(C(=O)C3(F)CC3)C2)C1	1839744035	LFEXAXNQAFZADC-ZZKIFARHSA-N	449.429	1.830	50	20	IDGD	
CCc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)cn1	1840030912	AJSHEHLWMVZDEO-LIRRHRJNSA-N	440.338	1.497	50	20	IDGD	
CCN(C)[C@H](C)C(=O)N1CC2(CCCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C1	1841925291	IHYGLGXSDBMPRY-CABCVRRESA-N	430.977	1.662	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1cccc3ccccc13)C2	1844264265	ZQNPTMYGULWCNY-UHFFFAOYSA-N	429.480	1.969	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)[C@@H]1CCCCO1)C2	1844691962	SLBNYHMOHHJICE-SFHVURJKSA-N	431.445	1.906	50	20	IDGD	
O=C([C@H](O)CCl)N1CC2(CCCN2C(=O)c2cc(Br)ccc2[N+](=O)[O-])C1	1845363943	PYHLQFNACROTIP-CYBMUJFWSA-N	446.685	1.774	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)c1n[nH]c3c(Cl)cccc13)C2	1846385628	AVYNNTVPQSHYFR-UHFFFAOYSA-N	432.912	1.406	50	20	IDGD	
CCN1CCN(c2ccc(C(=O)N3CCCC34CN(C(=O)[C@@H](Cl)COC)C4)cc2)CC1	1846897963	NOZSUBJOMVEEBW-FQEVSTJZSA-N	448.995	1.899	50	20	IDGD	
O=C(c1nn(-c2ccccc2)c2c1COC2)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl	1847559722	KFTTZOFATQIVHW-BQFCYCMXSA-N	430.892	1.318	50	20	IDGD	
COc1cc(/C=C/C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](O)CCl)cc(OC)c1OC	1847563864	RAFQDEVGAMKBLI-TXSMSCQPSA-N	438.908	1.527	50	20	IDGD	
Cc1noc(C)c1S(=O)(=O)N1CCC(C(=O)NNC(=O)c2cccc(Cl)c2)CC1	15605160	XTZGDKGWDMSQOU-UHFFFAOYSA-N	440.909	1.807	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)CN1C(=O)N[C@@]2(C[C@H](C)CC(C)(C)C2)C1=O	21199791	ZDMSLOGNRWTERV-MCMMXHMISA-N	440.504	1.541	50	20	IDGD	
COc1ccc(OC)c(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1	23138894	OOOQGBWCZUPRSO-UHFFFAOYSA-N	433.486	1.563	50	20	IDGD	
Cc1ccccc1S(=O)(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	727349748	HWWUXHQWMKVZOR-UHFFFAOYSA-N	437.543	1.793	50	20	IDGD	
COc1cccc(-n2c(CC(=O)NNC(=O)CN(C)C)csc2=NCc2ccco2)c1	727365164	NMNSOBLDRSRDEK-UHFFFAOYSA-N	443.529	1.493	50	20	IDGD	
CC(C)c1noc2nc(-c3ccco3)cc(C(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)c12	727707851	NHMAZKCTGBFQDW-LLVKDONJSA-N	432.458	1.802	50	20	IDGD	
COc1ccc([C@]2(C)NC(=O)N(CC(=O)NNC(=O)CCCc3ccccc3)C2=O)cc1	727717054	ROLOVJLACPSGLQ-QHCPKHFHSA-N	438.484	1.633	50	20	IDGD	
CN1CCN(C[C@@H](NC(=O)NNC(=O)COc2ccc(C#N)cc2)c2ccccc2)CC1	727945756	LXRSOPGEROCQDT-OAQYLSRUSA-N	436.516	1.256	50	20	IDGD	
NC(=O)c1ccc(/C=C/C(=O)N2CCC[C@@H]2C(=O)NNc2nc(-c3ccncc3)no2)cc1	728072198	ZPBAGGSFMDVAMI-ZGRWHYIRSA-N	447.455	1.378	50	20	IDGD	
C[C@@H]1CC(C)(C)C[C@]2(C1)NC(=O)N(CC(=O)NNc1nc(-c3cccnc3)no1)C2=O	728078900	AHXSFXDCAVIQDT-ODXCJYRJSA-N	427.465	1.712	50	20	IDGD	
Cc1occc1C(=O)Nc1cc(Cl)ccc1C(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1	728169829	ASDRTKPVYOPKHG-LLVKDONJSA-N	439.877	1.689	50	20	IDGD	
Cc1c(CC(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)nnn1-c1ccccc1	728211173	JYYQDQLDGMYOFC-UHFFFAOYSA-N	426.502	1.702	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)C[C@H](C)S(=O)(=O)c2ccc(F)cc2)cc1	729128895	IZQFBGXUYCKQDD-AWEZNQCLSA-N	436.461	1.691	50	20	IDGD	
CN(C)c1ccc(NC(=S)NNC(=O)c2ccc(F)c(NS(C)(=O)=O)c2)cc1	729690277	XOLVOEWJMPUQOD-UHFFFAOYSA-N	425.511	1.895	50	20	IDGD	
COc1nn(C)c2nc(C)c(CCC(=O)NNC(=O)COc3ccccc3O)c(C)c12	730778026	IEXPBDNKFWCOKF-UHFFFAOYSA-N	427.461	1.458	50	20	IDGD	
CC1CCC(N2C[C@@H](C(=O)NNc3ccc(S(=O)(=O)NC4CC4)cc3)CC2=O)CC1	731344095	PGWSFEAWRNIECG-CSLYMUCUSA-N	434.562	1.998	50	20	IDGD	
CCOc1ccc(S(=O)(=O)Nc2cccc(C(=O)NNC(=O)c3c[nH]nc3C)c2)cc1	731852605	CYCQDXWDXYNPGO-UHFFFAOYSA-N	443.485	1.992	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2C(=O)[C@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2=O)cc1Br	732034113	ZCPJLRHCKBMCOP-VUKUWZNJSA-N	448.273	1.026	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2ccc3[nH]c(=O)c(=O)[nH]c3c2)cc1Br	732173860	JRHXQIGTVSRWBD-UHFFFAOYSA-N	433.218	1.062	50	20	IDGD	
Cc1nn(-c2ccccc2)c(C)c1C(=O)C(=O)NNC(=O)CCN1C[C@H](C)O[C@@H](C)C1	732259298	CIYQHLDUVJMIBS-GJZGRUSLSA-N	427.505	1.319	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2ccc(F)cc2I)C[C@@H](C)O1	732263467	MXXJPWAZSFFJME-PHIMTYICSA-N	449.264	1.691	50	20	IDGD	
COc1cccc2c1OCC(C(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)=C2	732336735	XRZOMENNUFSRIA-UHFFFAOYSA-N	427.369	1.384	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)NCC1CCN(S(=O)(=O)C(F)(F)F)CC1	732675795	IFLFPICWNOKAEJ-UHFFFAOYSA-N	438.428	1.201	50	20	IDGD	
Cc1ccc(-n2c(NNC(=O)CCNS(C)(=O)=O)nc3ccccc3c2=O)c(C)c1	733265268	YZIBDAXJGRXAOU-UHFFFAOYSA-N	429.502	1.385	50	20	IDGD	
CN(C)c1nc2sc(C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)cc2s1	734241760	JTPFUZWMMVADQX-UHFFFAOYSA-N	428.540	1.893	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)c1sccc1S(=O)(=O)C(F)F	734241765	JVPXNBALTXAPAH-UHFFFAOYSA-N	442.466	1.213	50	20	IDGD	
CN(CC(=O)NNc1ccc(Cl)cc1[N+](=O)[O-])S(=O)(=O)c1cccc([N+](=O)[O-])c1	737802187	JHPALOSUGIGSRQ-UHFFFAOYSA-N	443.825	1.920	50	20	IDGD	
O=C(NNC(=O)c1ccn(-c2cccc(C(F)(F)F)c2)n1)N[C@@H]1CCS(=O)(=O)C1	737808729	SRGHBNGOUJKZSG-LLVKDONJSA-N	431.396	1.022	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)NCc1cccc(NC(=O)[C@@H]2CCCO2)c1	738461315	PQPREONKHHYLLV-IBGZPJMESA-N	426.473	1.851	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@H](C)NC(=O)c2cc3c(C)nn(C)c3s2)cc1OC	742033276	MDORHGXIBDNTPX-NSHDSACASA-N	445.501	1.540	50	20	IDGD	
O=C(Cc1csc(N2CCCC2=O)n1)NNC(=O)c1cc(Br)ccc1O	743730428	XGRCFBWJEHNLRX-UHFFFAOYSA-N	439.291	1.742	50	20	IDGD	
Cc1oc(C(=O)NNC(=O)Nc2ccc(N(C)C)cc2)cc1S(=O)(=O)N1CCCC1	743828545	RRCVQPXUEPEWPG-UHFFFAOYSA-N	435.506	1.905	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)CCS(=O)(=O)c2ccc(Cl)cc2)c1	744465011	IWFJBZWCJRYGPJ-UHFFFAOYSA-N	438.889	1.817	50	20	IDGD	
N#Cc1ccc(CSCC(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)cc1	744618838	FHIOHTZVRMDGKT-UHFFFAOYSA-N	446.554	1.956	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1cc(-c2ccccc2)[nH]n1	744619600	SYZLVPRPWTYXTI-UHFFFAOYSA-N	427.486	1.855	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NCc2ccccc2OCCN2CCOCC2)cc1	744869226	REGYPKABBPJDDA-UHFFFAOYSA-N	442.516	1.615	50	20	IDGD	
Cc1ccc(N(C)C(C)C)c(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1	745121330	GYPMAZKSZSJQIJ-FQEVSTJZSA-N	441.484	1.984	50	20	IDGD	
COc1ccc(Br)cc1C(=O)OCC(=O)NNC(=O)c1ccc(C#N)cc1	745121597	PYRVFDNQXZNBTF-UHFFFAOYSA-N	432.230	1.947	50	20	IDGD	
NS(=O)(=O)c1ccc(F)c(CNC(=O)NNC(=O)Nc2ccc(OC(F)F)cc2)c1	745825736	NAUUJWBDHRHBQX-UHFFFAOYSA-N	447.395	1.610	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)NCCOc1ncccc1C(F)(F)F	747446801	IACXCHOSEZQRFD-UHFFFAOYSA-N	443.338	1.797	50	20	IDGD	
COc1ccccc1N(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)c2cccn2C)cc1	747599311	QXUUUPVESAQQNA-UHFFFAOYSA-N	442.497	1.934	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)NCCS(=O)(=O)N2CCOCC2)c(C)n1CCC(C)C	748047481	NMUJAVDICAWALM-XSFVSMFZSA-N	436.578	1.836	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)[C@@](C)(O)[C@H](C)c2ccccc2)cc1OC	748484864	UICCQSOLTDNLED-PEBXRYMYSA-N	430.457	1.563	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)CNc2ccccc2Cl)CC1	750242579	SQFOQWZXULKCDE-UHFFFAOYSA-N	438.941	1.226	50	20	IDGD	
COc1cc(OC)cc(N2C[C@H](C(=O)NNC(=O)[C@@H](C)Oc3ccc(F)cc3)CC2=O)c1	752400870	WEOXGOVQMBTBIA-ZIAGYGMSSA-N	445.447	1.811	50	20	IDGD	
COc1cc(OC)cc(N2C[C@H](C(=O)NNC(=O)Cn3cnc4ccccc43)CC2=O)c1	752503960	SPEMKUQZTKEYHJ-CQSZACIVSA-N	437.456	1.254	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2ccc(C)o2)cc1S(=O)(=O)Cc1cc(C)no1	752781088	LWXNIHWMJGFKLR-UHFFFAOYSA-N	433.442	1.942	50	20	IDGD	
C[C@@H](Cc1cc(Br)ccc1F)NC(=O)NNC(=O)CNC(=O)c1ccco1	754851775	WYCYZCZEVAPMRT-JTQLQIEISA-N	441.257	1.873	50	20	IDGD	
C[C@]1(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)CCCO1	756084412	NEBGPGCNIMAGES-OAQYLSRUSA-N	446.529	1.678	50	20	IDGD	
COc1ccc(C(=O)N2CCOCC2)cc1NC(=O)NNC(=O)COc1ccccc1F	756259706	ZKWJABJITPHIKG-UHFFFAOYSA-N	446.435	1.538	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1cccc(C[S@@](=O)c2ccccc2)c1	756593443	ZFFSWSZICUUYLI-DBDZUICISA-N	438.531	1.085	50	20	IDGD	
Cc1ccc(SCC(F)(F)F)c(NC(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)c1	756664839	QQKZGFMVOVSSRW-VIFPVBQESA-N	428.458	1.740	50	20	IDGD	
C[C@@H]1CN(C(=O)Cn2cc(NC(=O)NNC(=O)c3cccc(Cl)c3)cn2)C[C@@H](C)O1	756838485	MZVWFUPQMBLSDL-CHWSQXEVSA-N	434.884	1.639	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)Nc1c(C)nn([C@H]2CCS(=O)(=O)C2)c1C	757871307	JGTHXUIRANPFPD-INIZCTEOSA-N	449.533	1.654	50	20	IDGD	
COc1ccc(C[C@H](C)C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1	758567007	BYRZJRIAAISQPC-IFXJQAMLSA-N	428.441	1.404	50	20	IDGD	
Cc1ccc(F)c(NNC(=O)c2cc(S(=O)(=O)N(C)C)ccc2N2CCOCC2)c1	760137653	METGTFSGSAZNKL-UHFFFAOYSA-N	436.509	1.978	50	20	IDGD	
Cn1ccc(CCNC(=O)NNC(=O)[C@H]2Cc3ccccc3CN2Cc2ccccc2)n1	760669275	MPLSXBVROFYKJL-JOCHJYFZSA-N	432.528	1.920	50	20	IDGD	
CC(C)(C)C(=O)NNC(=O)C(=O)Nc1ccc(CN2CCN(c3ccccn3)CC2)cc1	761072328	LWJLRTKHFSOZLP-UHFFFAOYSA-N	438.532	1.536	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)[C@]2(O)CCN(Cc3ccccc3)C2)n[nH]1	763152442	GSSIMHYVLDYBLM-QHCPKHFHSA-N	435.484	1.483	50	20	IDGD	
CC(C)(C)OC(=O)NCCOc1cccc(NC(=O)C(=O)NNC(=O)c2ccncc2)c1	763462060	IVFLCWIHXGFWBJ-UHFFFAOYSA-N	443.460	1.385	50	20	IDGD	
COC(=O)Nc1cc(NC(=O)C(=O)NNC(=O)c2ccc(OC)c(OC)c2)ccc1F	763550097	FEELYUJDLDJDRW-UHFFFAOYSA-N	434.380	1.421	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)Nc1ccccc1N1CCCCCC1	763570197	DFAZWZSMAWPKHP-FQEVSTJZSA-N	438.484	1.993	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)Nc1cccc(C#Cc2ccccn2)c1	763575464	WBPCDWYZJOTYRE-NRFANRHFSA-N	442.431	1.407	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2cccc(N3CCOC3=O)c2)c1	763668116	IZPMBHHGEDZSDK-UHFFFAOYSA-N	426.429	1.425	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1csc(-c2ccccn2)n1	763680771	HQYZVTKUXVYBMG-UHFFFAOYSA-N	441.469	1.769	50	20	IDGD	
O=C(COc1ccc(Cl)cc1)NNC(=O)C(=O)N1C[C@@H]2CCCN2c2ccccc21	763685957	GLTBWMBLMDAEOE-HNNXBMFYSA-N	428.876	1.882	50	20	IDGD	
O=C(COc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1cc2c(cc1F)CCC(=O)N2	763686899	WZTXTKUTCCNAEY-UHFFFAOYSA-N	434.811	1.529	50	20	IDGD	
CNC(=O)CCOc1ccc(NC(=O)C(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)cc1	763735313	QDCFKNJABQGTSD-UHFFFAOYSA-N	442.516	1.504	50	20	IDGD	
CN(C)c1nnc(-c2ccc(NC(=O)C(=O)NNC(=O)C3=S=C4CCCC4=C3)cc2)o1	763781921	OPKRDRBDIIHTCP-UHFFFAOYSA-N	440.485	1.090	50	20	IDGD	
CSc1cccc(NC(=O)C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c1C	763790421	IJVBFAYQDKDSKA-UHFFFAOYSA-N	425.470	1.364	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)c(C(F)(F)F)c1	763814957	XUXDVQQQKZBCAH-UHFFFAOYSA-N	436.346	1.751	50	20	IDGD	
COc1ccc(-c2nc(C(=O)NNC(=O)CNC(=O)c3cccnc3)cs2)cc1OC	763818119	APVGPFPQTUJIJU-UHFFFAOYSA-N	441.469	1.413	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ncn(Cc3ccc(Cl)cc3)n2)cc1	763819728	BRJYFTGLAXBKFJ-UHFFFAOYSA-N	442.863	1.453	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc3ccccc3c2)c(OC)n1	763856054	XUZPTQVTGCKGEA-ZDUSSCGKSA-N	438.440	1.805	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1cccc(N2CCOC2=O)c1	763864426	JBGYCLSZNGSFJU-LBPRGKRZSA-N	430.392	1.336	50	20	IDGD	
COC(=O)C(C)(C)c1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)cc1	763864861	LJNLDPAWEMYRIA-CYBMUJFWSA-N	445.447	1.830	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)CSc2ccc(C)cc2)c(C)c1	763896610	PAPDGVGBAGPQEQ-UHFFFAOYSA-N	445.497	1.733	50	20	IDGD	
O=C(NNC(=O)c1cc(Cl)ccc1O)C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F	763974736	WURBBPUCHZZVQQ-UHFFFAOYSA-N	444.734	1.955	50	20	IDGD	
O=C(NNC(=O)c1cccc(C(F)(F)F)c1)C(=O)Nc1cnn(C[C@H]2CCCO2)c1	764041190	WKYXVKDDTPDUQR-CQSZACIVSA-N	425.367	1.481	50	20	IDGD	
CNC(=O)CCOc1ccc(NC(=O)C(=O)NNC(=O)c2cccc3ccccc23)cc1	764051950	QOJKRIUCLBPVTI-UHFFFAOYSA-N	434.452	1.754	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccccc2CN(C)C(=O)OC(C)(C)C)n[nH]1	764109304	RSJNEPWZRWMPIV-UHFFFAOYSA-N	430.465	1.485	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)c(Br)n1	764117926	USZKZKLVBUKINU-UHFFFAOYSA-N	427.642	1.911	50	20	IDGD	
COCCOc1ccc(F)cc1NC(=O)C(=O)NNC(=O)c1ccc(Cl)cc1O	764118274	ZPLSUHMCFAKQBN-UHFFFAOYSA-N	425.800	1.610	50	20	IDGD	
CCOC(=O)Cn1ccc2cc(NC(=O)C(=O)NNC(=O)c3cccc(C#N)c3)ccc21	764233578	BJUFXEPTAJOBJM-UHFFFAOYSA-N	433.424	1.476	50	20	IDGD	
Cc1ncsc1C(=O)NNC(=O)C(=O)Nc1ccc(=O)n(Cc2ccccc2Cl)c1	764245214	ADPWFSHNUKKAOF-UHFFFAOYSA-N	445.888	1.715	50	20	IDGD	
Cc1ncsc1C(=O)NNC(=O)C(=O)Nc1ccn(-c2ccc(C#N)cc2Cl)n1	764247651	VZQOGNTZJRKYDW-UHFFFAOYSA-N	429.849	1.562	50	20	IDGD	
CC(C)(C)OC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2O)cc1	764276911	FBSHUXPIJHPEQB-UHFFFAOYSA-N	444.444	1.904	50	20	IDGD	
COc1ccc(C(=O)N2CCCCCC2)cc1NC(=O)C(=O)NNC(=O)c1c[nH]nc1C	764297995	LGFHMJYGOVIVML-UHFFFAOYSA-N	442.476	1.143	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)C(=O)Nc1cc(Br)c(=O)n(C)c1)c1ccccc1	764327892	HAEIJKJZSWDRHB-CYBMUJFWSA-N	435.278	1.428	50	20	IDGD	
Cc1ccc(C)c(-n2ccnc2SCC(=O)NNC(=O)CNC(=O)c2cccnc2)c1	764341788	KJHRCLDXFLFUSJ-UHFFFAOYSA-N	438.513	1.554	50	20	IDGD	
O=C(NNC(=O)C(F)(F)Oc1ccccc1)C(=O)Nc1ccc(C(=O)NC2CC2)cc1	764371082	WSMKRDLBTVUKEZ-UHFFFAOYSA-N	432.383	1.337	50	20	IDGD	
O=C(Cc1cccc([N+](=O)[O-])c1)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	765756674	NNWLVSSWQBAAQJ-UHFFFAOYSA-N	445.907	1.756	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)N[C@@H]1CC(=O)N(c2ccc(Cl)c(F)c2)C1	766551707	GENRLMMKAFRKTH-LLVKDONJSA-N	436.827	1.699	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)CCSCc3ccccn3)CC2)cc1	766642260	PZIHXWJWGBOUKR-UHFFFAOYSA-N	441.601	1.979	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)N2CCN(C(=O)[C@H](Br)C(C)(C)C)CC2)C[C@@H](C)O1	767028363	CNPXUDPOIZGLFX-MJBXVCDLSA-N	440.404	1.294	50	20	IDGD	
CC(=O)[C@@H]1CC(C(=O)OCC(=O)NNC(=O)Cc2ccccc2C)=NN1c1ccccc1	767345851	MYLQGHKQHYKLAH-FQEVSTJZSA-N	436.468	1.452	50	20	IDGD	
COc1cc(C(=O)OCC(=O)NNC(=O)c2cc(Cl)ccc2OC)c(F)cc1N	767719965	AILTWBWMUJTNPY-UHFFFAOYSA-N	425.800	1.697	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)[C@H](C)N3C(=O)[C@@H]4CCCC[C@H]4C3=O)n[nH]2)cc1	768268193	LLLUECOPJFLNDA-IAOVAPTHSA-N	437.500	1.964	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)c1ccc(=O)n(Cc2ccccc2)n1	768634072	CXGNNFWNBDJLHS-UHFFFAOYSA-N	428.470	1.461	50	20	IDGD	
CCCS(=O)(=O)N1CCCC[C@@H]1C(=O)NNc1c(OC)cccc1S(C)(=O)=O	768636542	SXFSLTRRZZANAT-CYBMUJFWSA-N	433.552	1.136	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)N[C@H]1CCOC2(CCOCC2)C1	769208318	WANXLOOBPOTZPY-AWEZNQCLSA-N	442.310	1.887	50	20	IDGD	
COc1cccc(-c2noc([C@H](C)NC(=O)NNc3nc(O)c4cnn(C)c4n3)n2)c1	770400640	QSESPXVROGFRGY-VIFPVBQESA-N	425.409	1.515	50	20	IDGD	
CS(=O)(=O)c1cc(S(=O)(=O)NNC(=O)Cn2ccc3ccccc32)c(Cl)s1	770635412	NBOLDJYZNIMZJQ-UHFFFAOYSA-N	447.947	1.769	50	20	IDGD	
CS(=O)(=O)CCn1cccc(NC(=O)NNc2ccc(Br)c(F)c2)c1=O	771175695	FRNYILGUUZDEIO-UHFFFAOYSA-N	447.286	1.943	50	20	IDGD	
CN1CCN(Cc2cccc(C(=O)NNC(=O)C(=O)NCc3ccc(Cl)cc3)c2)CC1	772891715	MCZDHVLAZAXNCH-UHFFFAOYSA-N	443.935	1.165	50	20	IDGD	
C[C@@H]1Oc2c(cccc2C(=O)NNC(=O)[C@H]2CCCN(C(=O)OC(C)(C)C)C2)NC1=O	773412038	TTXSWDCAVKCEAA-STQMWFEESA-N	432.477	1.814	50	20	IDGD	
CCOC(=O)[C@@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNc2ccc(C#N)cc2)cc1F	773692970	PIIJHACNRGLPBK-GFCCVEGCSA-N	441.419	1.461	50	20	IDGD	
COC(=O)CCNC(=O)c1ccc(NC(=O)C(=O)NNc2cnc3ccccc3n2)cc1	773722536	HDMAXIYRQLNWIR-UHFFFAOYSA-N	436.428	1.005	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc([C@H](C)N3CCOCC3)cc2)cc1F	773884866	DCXXXYNFOFHFTB-HNNXBMFYSA-N	428.464	1.927	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cc(OCC(F)F)ccn3)CC2)cc1	777995132	RMABKJJHLALOPO-UHFFFAOYSA-N	447.486	1.613	50	20	IDGD	
COCc1ccccc1S(=O)(=O)NNC(=O)CN1CCN(Cc2ccc(C)cc2)CC1	778564515	CFQWWQPHCNBYNR-UHFFFAOYSA-N	446.573	1.269	50	20	IDGD	
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1	779389307	RIFSOSYCQYLJHG-AWEZNQCLSA-N	435.529	1.327	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)nn1-c1cccc(C#N)c1	779902791	AEBQRUGOGZUZCP-UHFFFAOYSA-N	430.472	1.520	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1	780971610	PCELLOQBDUOENF-UHFFFAOYSA-N	435.481	1.873	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(CNC(=O)NNc2ccccc2S(C)(=O)=O)c1	782538572	FRCOMJHCMWRNED-UHFFFAOYSA-N	426.520	1.167	50	20	IDGD	
CON(C)S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ncccc2C(F)(F)F)cc1	783121054	DVUHWVXUYBBTLW-UHFFFAOYSA-N	447.395	1.364	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNc2ccc(F)cc2C)cc(S(C)(=O)=O)c1	783444858	PLHBUFKJTSQPFN-UHFFFAOYSA-N	437.449	1.796	50	20	IDGD	
CCN1CCN(S(=O)(=O)c2cccc(NC(=O)C(=O)NNc3ccccc3)c2)CC1	784767032	GKPOKIZKJIARGD-UHFFFAOYSA-N	431.518	1.095	50	20	IDGD	
O=C(NNc1ccc(Cl)nn1)C(=O)Nc1cc(Br)cnc1-n1cccn1	784792224	JKLSOMJXOQULFG-UHFFFAOYSA-N	437.645	1.555	50	20	IDGD	
O=C(NNc1ncc(F)cn1)C(=O)Nc1ccc(CCn2nnc(-c3ccccc3)n2)cc1	784949078	DHCWNMMGGYDEGW-UHFFFAOYSA-N	447.434	1.594	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2ccc(C)c(N3CCNC3=O)c2)n1	787575830	LYKRSGNNSPRLRS-UHFFFAOYSA-N	426.481	1.243	50	20	IDGD	
CN(NS(=O)(=O)c1cccc2nonc12)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	788914273	BXFGORGODXWOAY-UHFFFAOYSA-N	440.482	1.021	50	20	IDGD	
COc1cc(NNC(=O)C(=O)Nc2cccc(N3CCCS3(=O)=O)c2)ccc1Cl	789804710	MABMRAPMSWCATA-UHFFFAOYSA-N	438.893	1.970	50	20	IDGD	
CN(Cc1ccc(F)cc1Br)C(=O)NNC(=O)CNC(=O)c1ccco1	791022251	JANQNECQDPKLFZ-UHFFFAOYSA-N	427.230	1.784	50	20	IDGD	
O=C(NNc1cccc(F)c1[N+](=O)[O-])[C@@H]1CCCC[C@H]1C(=O)N[C@H]1CCS(=O)(=O)C1	791150297	LLVKJQGTMXDIFZ-YNEHKIRRSA-N	442.469	1.287	50	20	IDGD	
COC(=O)CNC(=O)c1ccc(NC(=O)C(=O)NNc2cc(Cl)cc(Cl)c2)cc1	792438416	UPMMQNZJKMBGNP-UHFFFAOYSA-N	439.255	1.978	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(OC(C)C)nn2)cc1	793022403	XHENHVQCEMTMFT-ZDUSSCGKSA-N	429.433	1.020	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNC(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2	794077212	RFLSZKHIOKOQRU-UHFFFAOYSA-N	430.373	1.053	50	20	IDGD	
CCS(=O)(=O)Nc1ccccc1C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	794717570	PYAWHDXKAIPXFJ-UHFFFAOYSA-N	426.520	1.455	50	20	IDGD	
CC(C)(C)OC(=O)Nc1ccc(CC(=O)OCC(=O)NNC(=O)c2ccccc2)nc1	795886551	UXPHFEQPUXAWKP-UHFFFAOYSA-N	428.445	1.976	50	20	IDGD	
N#Cc1ccc(NC(=O)C(=O)NNC(=O)CNC(=O)OCc2ccccc2)c(Cl)c1	797368499	BNXGORRWXQVLRF-UHFFFAOYSA-N	429.820	1.224	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)Nc2cc(S(=O)(=O)N3CCCC3)ccn2)c1	797675316	NIKPKOCFTFRAPY-UHFFFAOYSA-N	439.519	1.418	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2ccncc2OCC(F)(F)F)c1	798522664	AZFRJDYYPHHLAU-UHFFFAOYSA-N	446.407	1.570	50	20	IDGD	
O=C1CC(C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)(c2cccc(Cl)c2)C1	798685109	HQOJNQHESLJTCR-UHFFFAOYSA-N	445.815	1.853	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=O)CNC(=O)OC(C)(C)C)ccc1F	801184574	YSANOIJIQMATPM-UHFFFAOYSA-N	446.501	1.142	50	20	IDGD	
CCOC(=O)c1cnn2c(C(=O)NNC(=O)Nc3ccc(OC(F)F)cc3)ccnc12	802047615	FNNBEDRWALGYIU-UHFFFAOYSA-N	434.359	1.974	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)CCCN2C(=O)NC(C)(C)C2=O)c(OC)cc1Cl	802078961	ZQQGFYQOBDAYPY-UHFFFAOYSA-N	441.872	1.621	50	20	IDGD	
COCCN1C(=O)c2ccc(C(=O)NNc3ccc4c(=O)[nH]ccc4c3)cc2S1(=O)=O	803434875	ZXERUMQSKNRKQR-UHFFFAOYSA-N	442.453	1.076	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(Br)c(C(=O)NNc2ncccc2F)c1	804215455	QVCXYOGVCCPCNP-UHFFFAOYSA-N	447.286	1.665	50	20	IDGD	
O=C(NNc1ncccc1F)C(=O)Nc1c(C(=O)N2CCOCC2)oc2ccccc12	807301539	CAWVPPUULMSYQL-UHFFFAOYSA-N	427.392	1.521	50	20	IDGD	
Cn1ccnc1Sc1ccc(NC(=O)C(=O)NNc2ccc(-n3ccnc3)nn2)cc1	807428345	BGGHBUMUCPBOTQ-UHFFFAOYSA-N	435.473	1.629	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)Nc2ccc(C(N)=O)cc2OCC(F)F)c1	810302523	SXUIHRUWIQSDTK-UHFFFAOYSA-N	428.417	1.982	50	20	IDGD	
O=C(NNc1ccc(-n2cccn2)nn1)C(=O)Nc1ccc(Br)c([N+](=O)[O-])c1	810394079	WUSPGWIBAXDCDM-UHFFFAOYSA-N	447.209	1.415	50	20	IDGD	
O=C1CC(C(=O)NNC(=O)CNC(=O)c2cccnc2)(c2cccc(Br)c2)C1	810572835	WLSBEJYMDDFFMA-UHFFFAOYSA-N	445.273	1.022	50	20	IDGD	
Cc1ncc2n1CC[C@@H](C(=O)NNC(=O)CN1CCN(Cc3ccc(Cl)cc3)CC1)C2	810594297	ZYZCOFJLBMDKPY-GOSISDBHSA-N	444.967	1.373	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCc1nc(N(C)C)no1	812218267	BXQQGFILLLVJTA-VIFPVBQESA-N	427.259	1.196	50	20	IDGD	
COc1ccc(CNC(=O)NNC(=O)c2ccc(Cl)cc2Cl)cc1S(N)(=O)=O	812429079	FMFFCKAKUIFEQD-UHFFFAOYSA-N	447.300	1.794	50	20	IDGD	
CC(=NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)c1ccc(N)nc1	814709451	BUPVHMCAGHEECO-UHFFFAOYSA-N	431.518	1.158	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)C(=O)Nc1cccc(S(=O)(=O)C2CCCCC2)c1	815570143	SPEAOMCTTGRVDK-UHFFFAOYSA-N	444.513	1.517	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)C(=O)Nc1cccc(S(=O)(=O)C2CCCCC2)c1	815570397	BCQPOOAKHIBFOE-UHFFFAOYSA-N	444.513	1.896	50	20	IDGD	
Cc1ccc(S(=O)(=O)c2ccc(NNC(=O)CN(C)CC(=O)NC(C)C)cc2)cc1	830727582	VYYFDYSCSKQPGV-UHFFFAOYSA-N	432.546	1.727	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H](NC(=O)NCc2ccccc2)C(C)C)cc1C	896035757	BDMYTEZVSWQZEV-LJQANCHMSA-N	439.516	1.913	50	20	IDGD	
COc1ccc(N(C)S(=O)(=O)c2cccc(C(=O)NNC(=O)c3cccnc3)c2)cc1	912630097	JZQHXHNPAWCYCF-UHFFFAOYSA-N	440.481	1.990	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)CN1C(=O)[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O	913037238	RELACPOXTUUQTL-NXNVCVFFSA-N	436.493	1.687	50	20	IDGD	
Cc1ccc(C(=O)OCC(=O)C(C#N)=C2N(C)c3ccccc3N2C)cc1S(N)(=O)=O	913242766	OIUPWAACEWQKCA-UHFFFAOYSA-N	440.481	1.690	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCCCN(C)Cc1ccccc1	913635825	IIAJRLXKFZDYSO-UHFFFAOYSA-N	446.577	1.754	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)NCCNS(=O)(=O)c2cccc(Cl)c2)cc(C#N)n1C	914503410	HNDWTWDZISGUNT-NVNXTCNLSA-N	431.905	1.860	50	20	IDGD	
O=C(COc1cccc(NC(=O)C2CC2)c1)NNC(=O)c1csc(N2CCOCC2)n1	914749133	DCAJZVRWVCXIQA-UHFFFAOYSA-N	445.501	1.168	50	20	IDGD	
COc1cc(CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)ccc1OC(C)C	914857506	ZRTIJUMSGHGMRF-UHFFFAOYSA-N	449.533	1.920	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NN=Cc2ccccc2OCC(=O)N2CCCC2)c1	915052624	RUXXBIRSGZBKGY-UHFFFAOYSA-N	429.498	1.855	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCOc2ccc(Cl)cc2)c1	915919147	XUFPHZQYCAWTCI-UHFFFAOYSA-N	440.909	1.613	50	20	IDGD	
Cc1n[nH]c(C)c1C=NNC(=O)c1cc(S(=O)(=O)NCc2ccccc2)ccc1O	915957163	PLCNTBZIJQRIKO-UHFFFAOYSA-N	427.486	1.975	50	20	IDGD	
CC(C)Oc1ccc(CNC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cn1	916511915	FOWNRCJGTSWADG-UHFFFAOYSA-N	440.548	1.912	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1ccc(NC(=O)NC(C)C)cc1	916746265	GWYARQXOALVOJN-UHFFFAOYSA-N	446.533	1.893	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)N[C@@H](c1ccc(F)cc1)[C@H]1CCCO1	918126140	HCOLGWYNWVJRRZ-SJORKVTESA-N	449.508	1.983	50	20	IDGD	
CN(CCCNC(=O)NNC(=O)c1csc(N2CCOCC2)n1)c1ccccc1F	918130096	GOSRNYNQWLMZGZ-UHFFFAOYSA-N	436.513	1.589	50	20	IDGD	
CC[C@H](NC(=O)NNC(=O)c1ccc(OC)c(OC)c1)c1ccccc1OCC(=O)NC	918222556	XRUPSWBOWHGWCY-INIZCTEOSA-N	444.488	1.924	50	20	IDGD	
CC(C)C[C@H](NC(=O)c1ccc(Cl)cc1)C(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1	919885915	PQSURZUHDUXPRQ-GJZGRUSLSA-N	444.941	1.002	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Cc2nnn(-c3ccccc3)c2C)cc(OC)c1OC	919962102	IOFCAVOWQGYBDQ-UHFFFAOYSA-N	425.445	1.605	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N(C)Cc2cnn(C)c2)cc1	920854756	POHVSLOVOPIQSN-ZDLGFXPLSA-N	447.499	1.733	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NN/C=C1\C(=O)NC(=S)N(CC(C)C)C1=O	920979039	RCZATLSEAICEIT-UKTHLTGXSA-N	428.518	1.003	50	20	IDGD	
C[C@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	921298877	OKIFXQPYDILUHI-ZDUSSCGKSA-N	440.522	1.145	50	20	IDGD	
Cc1nn([C@H]2CCS(=O)(=O)C2)c(C)c1NC(=O)NNC(=O)c1ccccc1Cl	1116570320	STASAPVHGGUTRE-LBPRGKRZSA-N	425.898	1.979	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNS(=O)(=O)c2cn3c(n2)CCCC3)CC1	1323582627	PYSGDGPNLDELSQ-UHFFFAOYSA-N	427.527	1.176	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)CNS(=O)(=O)c3ccccc3)n[nH]2)c1	1343534814	PSKDGYKTGUIJBY-UHFFFAOYSA-N	427.486	1.433	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4c(c3)CCN4C)C2)C1	1777921621	JQMAIYHSTKUOTC-XOBRGWDASA-N	436.350	1.906	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)c(OC)c1	1780535947	WYKWMMSAAAOKHI-QAPCUYQASA-N	445.285	1.838	50	20	IDGD	
CSc1ncccc1C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781331250	HENYYVXAMUWEAW-WBMJQRKESA-N	432.315	1.938	50	20	IDGD	
C[C@H](Oc1cccnc1)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781335519	UIPAYIROHQJBQS-RVSPLBMKSA-N	430.274	1.369	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1ccccc1)C2	1782210687	CJSSXWRIYVFFCI-AUSIDOKSSA-N	430.549	1.116	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)Cc2c(C)nn(C)c2C)C1	1782553388	MJJMEVCDTIINBI-WAOWUJCRSA-N	440.972	1.347	50	20	IDGD	
CN(C)[C@H](C(=O)N1CC[C@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1)c1ccccc1Cl	1782829399	IGFQYARQPUUBBA-FUHIMQAGSA-N	444.359	1.372	50	20	IDGD	
CC(=O)NCCC(=O)N1CC[C@]2(C1)CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)CCO2	1783192044	XQBJLEUDEXFJRQ-BPNKPRMTSA-N	446.454	1.228	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)CC(F)(F)C(=O)O)CCO2)C1	1783348002	RLRQSQYDWABXGQ-YGRLFVJLSA-N	427.242	1.100	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccc4ccnn4c3)CCO2)C1	1783351498	BFBIJZFTKCBFKT-QFBILLFUSA-N	435.322	1.951	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cn(C)nc3C(F)(F)F)CCO2)C1	1783877899	RKLFMPANGGWJFE-LRDDRELGSA-N	438.834	1.136	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3c(F)ccc([N+](=O)[O-])c3C)CCO2)C1	1783881667	SODUYRRWCJZPOG-YJYMSZOUSA-N	443.859	1.740	50	20	IDGD	
CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCO[C@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783952909	WQSOVZLWHHADEA-SGTLLEGYSA-N	438.352	1.923	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc4ccccn34)C[C@@H]21	1783967792	WZASVJDGIYLJJD-AESZEHBQSA-N	449.349	1.959	50	20	IDGD	
COc1ccc(F)c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]3C2)c1OC	1784092911	XOIGJCDRRJKIPP-DUPGQFARSA-N	444.887	1.036	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](CC(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](F)Cl)CCO3)C1	1784149233	NXATUEUOHJUAEU-PTSWNOGYSA-N	447.935	1.998	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4c(n3)OCCO4)C[C@@H]21	1784618534	MGNIJBHEEUMKEG-AFIMGQEJSA-N	437.924	1.854	50	20	IDGD	
Cn1ncc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Cl)C[C@@H]32)c1C(F)(F)F	1785526736	FKQGDVSDDGHZKH-DJFWLOJKSA-N	426.798	1.567	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)CCCNC(=O)OC(C)(C)C)C2)C1	1785570179	HPFHIRGVVNRUNC-QRWLVFNGSA-N	447.960	1.375	50	20	IDGD	
C#CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Cl)CCO2	1785574415	JFZPLGKQDNLIBL-CKFHNAJUSA-N	431.892	1.267	50	20	IDGD	
COc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCBr)[C@H]3C2)ccn1	1786405975	BBHMZWMYHPJCAR-KKUMJFAQSA-N	426.311	1.469	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccn4cncc4c3)[C@H]2C1	1788404801	KDXSBASBAYHGIS-IKICRFKJSA-N	449.349	1.959	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(F)nc3)[C@H]2C1	1788842785	IDDSYHRMXAVUPH-XQLPTFJDSA-N	428.302	1.988	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1ccc(C2(NC(=O)[C@H]3CCCOC3)CCC2)cc1	1789523540	GLQDGUWEJDTGSZ-HNNXBMFYSA-N	437.500	1.859	50	20	IDGD	
CNC(=S)NCCC(=O)Nc1ccc(C2(NC(=O)[C@@H](Cl)COC)CCC2)cc1	1789527631	JNFUCWUTQWHJIM-HNNXBMFYSA-N	426.970	1.858	50	20	IDGD	
C[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]2C1)n1ccccc1=O	1789926379	VVQJLJGHQFJQSK-YGJAXBLXSA-N	444.301	1.080	50	20	IDGD	
CN(C)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C(C#N)=C/c3ccc(F)cc3F)[C@H]2C1	1790693245	BACMMERXBMHRDJ-VWZYDEGLSA-N	446.498	1.803	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ncccc3F)C[C@@H]21	1790960600	NIEOMPCMTLRGCY-XPCVCDNBSA-N	428.302	1.988	50	20	IDGD	
COc1ccc([C@H](O)C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]3C2)cc1	1791292520	WISGKKSAWQIQHJ-TUUVXOQKSA-N	431.316	1.512	50	20	IDGD	
COC(=O)[C@@H]1CC[C@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@](C)(Cl)CCl)C3)C1	1792974128	XLCIJZMJSXAUES-ZNRJKYBQSA-N	435.348	1.402	50	20	IDGD	
Cc1nn(-c2ccccc2)c(O)c1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCl	1793111065	ZOXMRAHJPNBDBZ-XLNGHYISSA-N	432.908	1.738	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H]2[C@@H](C1)[C@@H]2C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCl	1793116888	YGHYJQUNXRHETR-DKGRAKJVSA-N	441.956	1.337	50	20	IDGD	
Cc1cccc(C)c1N1C[C@H](C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](O)CCl)C3)CC1=O	1794130199	YJYPYBLGQYPPRT-UJWQCDCRSA-N	447.963	1.894	50	20	IDGD	
Cc1nc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](C)CBr)C3)c(=O)[nH]c1C	1794609676	KYFIIEZNTZSHIX-WTDIUWLJSA-N	425.327	1.670	50	20	IDGD	
Cc1cc(C)n2ccc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)CCBr)c2n1	1795116631	ZRXAZOSRAKROAJ-JLVBRIDZSA-N	449.349	1.939	50	20	IDGD	
C[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Cl	1796364989	OELDMEOJDOFJQV-IATJYDTKSA-N	447.935	1.613	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2ncnn2c1	1797561504	JOEKUTKUVMPWTI-FQLMCAECSA-N	436.310	1.106	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Br)C3)o1	1797748184	XPJHFMOAKRTPJJ-RDBQEKCUSA-N	432.246	1.132	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCOc1ccccc1)C2	1798439244	RRZQFQDBKVAGRU-BJWYYQGGSA-N	437.500	1.406	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc([N+](=O)[O-])c(O)cc1C)C2	1799271788	BZXDLLSRVKJLGT-DMVWFOPNSA-N	425.869	1.829	50	20	IDGD	
COC(=O)[C@H]1CC[C@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@](C)(Cl)CCl)CC1	1799274264	UOWHLDNLNVFMOO-NOYYPJHYSA-N	449.375	1.792	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(F)c1Cl)c1cccc(B(O)O)c1	1800455833	WYYNEHYGDLGRKU-MUJYYYPQSA-N	430.672	1.725	50	20	IDGD	
COC(=O)[C@H]1CC=CC[C@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(C)(C)CCl)C2	1800951415	DBBGPCWSNWILKF-BPKGMFCQSA-N	426.941	1.596	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1cccc(O)c1	1801743540	KZONVPLQQZAGDK-SRXHPEDYSA-N	435.484	1.356	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc3c(n2)OCCO3)[C@H]1c1cccnc1)[C@@H](O)CCl	1803138687	DNJPYVOIEFLVCO-ZVZYQTTQSA-N	446.891	1.167	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc3nc[nH]c3c2)[C@H]1c1cccnc1)[C@H](O)CCl	1803143116	UKIDLCJRNSPFMP-IPELMVKDSA-N	427.892	1.877	50	20	IDGD	
O=C(CCC1CCC1)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1803370125	JQMDEYHILXQWCM-OFNKIYASSA-N	435.333	1.661	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H](CNC(=O)c2cnnn2C)[C@H]1c1cccnc1	1804745557	AVNLJOKZEIOUMJ-IJEWVQPXSA-N	435.326	1.703	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)C(Cl)Cl)[C@@H]1c1cccnc1)c1cccc(=O)n1O	1804951697	PGUIBYPZEYBHJA-SWLSCSKDSA-N	425.272	1.604	50	20	IDGD	
CSCC[C@H](O)C(=O)N1CC[C@H](CNC(=O)CCBr)[C@@H]1c1cccnc1	1806346465	HODPLHFCMNGDGF-VYDXJSESSA-N	444.395	1.986	50	20	IDGD	
Cc1cc2nnc(C(=O)N3CC[C@H](CNC(=O)[C@@H](F)Cl)[C@H]3c3cccnc3)c(C)n2n1	1808312838	JXAKRKQUXGCMHI-ZTFGCOKTSA-N	445.886	1.990	50	20	IDGD	
COCc1oncc1C(=O)NC[C@@H]1CCN(C(=O)[C@@H](Cl)COC)[C@H]1c1cccnc1	1808824246	XHIWECGIZOOLNK-ZVZYQTTQSA-N	436.896	1.789	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)c1cnc2ccc(F)cn12	1812237943	LZGJUTNNWAGKSI-YJLNNSPDSA-N	445.882	1.788	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)Cc2cncnc2)[C@H]1c1cccnc1	1812864602	JDIUNKDMNGWFKY-OWQGQXMQSA-N	432.322	1.904	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)/C=C\C(=O)NC2CC2)[C@H]1c1cccnc1	1813030556	DEVYBKQGUVOZHY-MUFWYDAFSA-N	434.924	1.176	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)COc2cccnn2)[C@H]1c1cccnc1	1813033368	MGLDSJVCJRPDHJ-BXWFABGCSA-N	433.896	1.210	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)CCc2ccc(O)nn2)[C@@H]1c1cccnc1	1813034090	AHLIUGMVBCTMCX-OXFYSEKESA-N	447.923	1.470	50	20	IDGD	
O=C(CC(F)(F)F)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2	1814446657	TXGCYWMCRSLOKG-LLVKDONJSA-N	427.213	1.001	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2nccs2)n[nH]1	1816570659	ZBYRONKEVJIFPZ-AWEZNQCLSA-N	440.489	1.484	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)C2CC3(CCC3)C2)[nH]n1)c1cccc(B(O)O)c1	1817478859	CMZXPFSHDZDJHE-IBGZPJMESA-N	436.321	1.976	50	20	IDGD	
CCc1cc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@@H](Cl)COC)CC3)n(C)n1	1820636486	LEBZJVUWXXMVSV-RYUDHWBXSA-N	425.942	1.919	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cn(C(C)(C)C)nn3)sc2C1	1821638387	MVUPMRPRQPMIIR-MNOVXSKESA-N	440.957	1.969	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CNC(=O)C(F)(F)F)[nH]n1	1822375043	RTYYGCGRYSRGNM-GXSJLCMTSA-N	439.822	1.334	50	20	IDGD	
CCc1nc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)co1	1822414397	DPRCXUZSCWSVQR-OAHLLOKOSA-N	431.497	1.639	50	20	IDGD	
O=C(NCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H](O)CCl)CC1)c1cccnc1	1825087855	KOFMBHJAFNCSLT-QZTJIDSGSA-N	436.940	1.031	50	20	IDGD	
C[C@@](O)(CC(=O)O)CC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCBr)CC2	1826069675	VGUCHJTWHIEAKG-FVMDXXJSSA-N	448.339	1.456	50	20	IDGD	
C[C@@H](C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCBr)CC2)n1cncn1	1826787320	UOUXRCWBKWPBPO-UWVGGRQHSA-N	427.328	1.693	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3n[nH]c4c3CCCC4)C2)C1	1830358442	VJVCYPVLBYGUTI-OAQYLSRUSA-N	438.956	1.624	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](CN)c3ccccc3)C2)C1	1830359320	MTKWSFFFGQSDNR-PGRDOPGGSA-N	437.968	1.450	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)COC(C)(C)C)C2)C1	1830535640	ROQGDIXVNUBHKS-KSSFIOAISA-N	435.359	1.289	50	20	IDGD	
Cc1ccc2[nH]cc(CC(=O)N3CCOC[C@@]4(C3)CN(C(=O)[C@@H](O)CCl)CCO4)c2c1	1830726206	PJBUHTYQTBHIQY-SIKLNZKXSA-N	449.935	1.075	50	20	IDGD	
C[C@H](Sc1ccccc1)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1	1831149791	IIVUTGBCHWKCFB-XAUMDUMWSA-N	442.965	1.223	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1	1831875203	VJNRWIMOCLPPMT-IRXDYDNUSA-N	430.977	1.233	50	20	IDGD	
O=C(c1cc(O)nc(Cl)c1)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1833583278	XOSHUCUYSCMDBT-MRXNPFEDSA-N	438.695	1.314	50	20	IDGD	
O=C(c1cccnc1OCC1CC1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1833625337	PVPALVNGVGSVKR-UZLBHIALSA-N	441.887	1.475	50	20	IDGD	
C[C@]1(C(=O)N2CCC(N3CCC(NC(=O)CCBr)CC3)CC2)CCCN1	1834423246	LOPWUMJRINHRBD-LJQANCHMSA-N	429.403	1.485	50	20	IDGD	
O=C(CCBr)NC1CCN(C2CCN(C(=O)[C@H]3CCCOC3)CC2)CC1	1834423269	AQNHRDFGNLRLML-HNNXBMFYSA-N	430.387	1.770	50	20	IDGD	
O=C(CCBr)NC1CCN(C2CCN(C(=O)C3CCC(O)CC3)CC2)CC1	1834423523	PFXLXLIRGUKRGG-UHFFFAOYSA-N	444.414	1.894	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)NC1CCN(C2CCN(C(=O)C(Cl)Cl)CC2)CC1	1835711402	MIBVGNYARHBLKD-GFCCVEGCSA-N	436.384	1.069	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)/C=N/N3CCCCC3)CC2)CC1	1835732524	GQLXJXIZKUQWFV-SYVPYPDPSA-N	442.004	1.284	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC1CCN(C2CCN(C(=O)[C@H](N)c3ccccn3)CC2)CC1	1835833356	BEHYDWLFPKFWMK-OAQYLSRUSA-N	447.656	1.505	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnn4cc(C)cnc34)CCO2)C1	1836944792	WJVXGGHDYNSPEM-UWJYYQICSA-N	449.939	1.515	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)CC[C@H]3CCOC3)C2)C1	1837717713	MKTJUISQRDNVNE-PXNSSMCTSA-N	428.602	1.111	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccncc3Cl)CCO2)C1	1837890659	CSLSLQVOABLCRR-YVEFUNNKSA-N	446.729	1.588	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)C3CC4(CCC4)C3)CC2)CC1	1838788803	ANJVIAMYUAGCSD-UHFFFAOYSA-N	448.608	1.938	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(F)ccc3F)CCO2)C1	1838860445	HUOCXGIXAJLXFF-KXBFYZLASA-N	432.851	1.289	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(O)cc3)CCO2)C1	1838971645	KGWJNPQBQHTUAR-ACJLOTCBSA-N	427.295	1.246	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4nccnc4c3)C2)C1	1839144714	JEEGSEGMNSWXLH-IIBYNOLFSA-N	432.908	1.717	50	20	IDGD	
Cc1c(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)cnn1C	1839151183	KGGOTOLSRXLATG-ZWKOTPCHSA-N	433.336	1.035	50	20	IDGD	
CC(C)n1nccc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2	1839153578	KULFPXSYBZUQJP-MOPGFXCFSA-N	447.363	1.770	50	20	IDGD	
Cc1n[nH]c(C)c1CC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2	1839154234	HXDSANLRVCBISD-MOPGFXCFSA-N	447.363	1.262	50	20	IDGD	
O=C(c1cc(C2CC2)on1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839197269	OHUSHIVVJPEQAB-YOEHRIQHSA-N	446.273	1.313	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)cc1O	1839202276	YYOXLRPEAKQEBS-QAPCUYQASA-N	445.285	1.461	50	20	IDGD	
C=C(C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2)C(F)(F)F	1839203106	ZWRJUZWOYCMXFP-ZWNOBZJWSA-N	433.196	1.252	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CCN3CCCC3)C2)C1	1839967544	PYCPLXKHFIAJDT-LPHOPBHVSA-N	446.386	1.102	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4occc4c3)C2)C1	1840152566	MIUZFYVHEOMDSQ-UWJYYQICSA-N	436.892	1.757	50	20	IDGD	
Cc1noc(C)c1CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840186171	FKGUTDGXQNMDSO-SFHVURJKSA-N	434.320	1.484	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3cccc(O)c3)CCO2)C1	1840268281	PJADOYUTFPAJOF-GHTZIAJQSA-N	440.924	1.035	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@]1(C)CC=CCC1)CCO2	1840557871	GEUITGROEGDJKI-IPELMVKDSA-N	429.355	1.973	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(F)cc(Cl)c3)CCO2)C1	1840711003	BYLFLKBLRZJQHW-QFBILLFUSA-N	449.306	1.803	50	20	IDGD	
CC[C@H](NC(C)=O)C(=O)N1CCCC12CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)C2	1841089399	QRJKCYRPANHJIU-HVRVZBDQSA-N	430.455	1.990	50	20	IDGD	
C[C@H](C(=O)N1CCCC12CN(C(=O)c1ccc(B(O)O)cc1)C2)c1ccc(Cl)cc1	1841197293	APZGVXALUQGQPH-HNNXBMFYSA-N	426.709	1.641	50	20	IDGD	
O=C(c1cc2cc(F)ccc2s1)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843011533	MXHQMBITIJLSJE-UHFFFAOYSA-N	438.289	1.851	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC2(CCCN2C(=O)c2ccc3nc(CO)[nH]c3c2)C1	1843669452	VUVLTBWOSZLRRZ-LBPRGKRZSA-N	435.322	1.903	50	20	IDGD	
COC(=O)c1ccc(CC(=O)N2CC3(CCCN3C(=O)[C@@H](F)Br)C2)cc1	1845220192	GLIRWYKGJSEDNP-OAHLLOKOSA-N	427.270	1.910	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)COc1ccc(Cl)c(F)c1)C2	1846383925	IVRXWVFSTSIELY-UHFFFAOYSA-N	440.903	1.434	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)C1(c3cccc(Cl)c3)CC1)C2	1846385067	QPVSTNCOCWCZJF-UHFFFAOYSA-N	432.952	1.948	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)nn1C	1848095670	MBNDLNWQDXYXLD-JYJNAYRXSA-N	439.944	1.676	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)c1cc2c(cc1[N+](=O)[O-])OCCO2	10159457	QGWUKTWCFLDCJX-UHFFFAOYSA-N	425.357	1.332	50	20	IDGD	
COc1ccc(CN2C[C@@H](C(=O)NNC(=O)c3ccc4c(c3)OCCO4)CC2=O)cc1	726499556	HIIMRJFNCTWPRC-INIZCTEOSA-N	425.441	1.276	50	20	IDGD	
CN(CC(=O)NNC(=S)NCC1CCC1)S(=O)(=O)c1ccc(Br)cc1	727866202	UVZFYLKMNXCVQN-UHFFFAOYSA-N	449.396	1.365	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)CSc2ccc(C#N)cc2)cc1OC	728679502	FKLGFJADVIUMCK-UHFFFAOYSA-N	429.454	1.672	50	20	IDGD	
Cc1c(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cnn1-c1ccc(F)cc1F	728845919	PWKVNZWNDQRHIF-UHFFFAOYSA-N	441.442	1.927	50	20	IDGD	
CCc1ccc([C@H](CNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)N(C)C)cc1	729044531	LJQSPWUJBFWUGE-FQEVSTJZSA-N	439.564	1.889	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCCOc2ccc(F)c(F)c2)nc1	730129285	UAOKSNGPIBNKGQ-UHFFFAOYSA-N	429.449	1.752	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])o1	731874859	SHBCJZWOTRIRKZ-AAEUAGOBSA-N	434.380	1.546	50	20	IDGD	
CN(C)[C@@H](C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1)c1cccc(Cl)c1	732260646	XCHUSTFWUSKUEU-OAHLLOKOSA-N	445.328	1.705	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2ccc(F)cc2I)C[C@H](C)O1	732263468	MXXJPWAZSFFJME-QWRGUYRKSA-N	449.264	1.691	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NN=C(C)CS(C)(=O)=O)c1	732527412	UQDQGUVUQRNKMU-UHFFFAOYSA-N	439.515	1.646	50	20	IDGD	
CCN(C(=O)CCC(=O)C(C#N)=C1N(C)c2ccccc2N1C)[C@H](C)CS(C)(=O)=O	732976521	QUPZJBWQTPCYPZ-OAHLLOKOSA-N	432.546	1.939	50	20	IDGD	
CC(C)(C(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12)S(C)(=O)=O	733124121	SYZXDRWMYMQJIF-UHFFFAOYSA-N	442.497	1.029	50	20	IDGD	
COc1cc(C(=O)NNc2nc3ccccc3c(=O)n2C)ccc1OCC(=O)NC(C)C	733261000	WEVUHWRVVMBFJK-UHFFFAOYSA-N	439.472	1.602	50	20	IDGD	
CCc1ccccc1OCC(=O)NNS(=O)(=O)c1ccc(CS(C)(=O)=O)cc1	734806900	OWNLQUCNACNJSA-UHFFFAOYSA-N	426.516	1.182	50	20	IDGD	
CCCC(=O)N1CCC[C@@H](C(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)C1	734825994	SAXFAWCLGIYWFU-OAHLLOKOSA-N	439.557	1.755	50	20	IDGD	
CN(C)c1cccc(-c2nnc(SCC(=O)NNC(=O)c3ccc(F)cc3)n2N)c1	735983174	SFUKFWLLHKOIGS-UHFFFAOYSA-N	429.481	1.417	50	20	IDGD	
O=C(NNC(=O)c1cccc(-n2cccn2)n1)c1ccc(S(=O)(=O)N2CCCC2)cc1	736543477	LQKQLJQNLVKXNV-UHFFFAOYSA-N	440.485	1.127	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)[C@@H]1CCCN1C(=O)c1ccc2c(c1)OCO2	737629472	ROUGUMRGBKGZGG-KRWDZBQOSA-N	425.441	1.384	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)CSc1nnc(C)n1-c1ccc(OC)cc1	740853380	PZBOELGAOFBMEG-UHFFFAOYSA-N	434.522	1.129	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H]2[C@@H]3CCO[C@H]3C2(C)C)c1	741426612	VVFWXBFYGBMNHL-GVDBMIGSSA-N	438.550	1.475	50	20	IDGD	
CCn1nc(C)c(S(=O)(=O)NNC(=O)c2ccc(CSc3nncn3C)cc2)c1C	741645692	BNPYGFIVZCGNNZ-UHFFFAOYSA-N	449.562	1.564	50	20	IDGD	
CC(C)c1nn([C@@H]2CCS(=O)(=O)C2)cc1C(=O)NNC(=O)c1cccc2ncccc12	742645964	AWDOTMOWAUYIHS-CQSZACIVSA-N	441.513	1.989	50	20	IDGD	
CC(C)(C)C(=O)NNC(=O)CN1CCN(S(=O)(=O)c2ccc3ccccc3c2)CC1	744385342	VYRZLCVMEGYKOD-UHFFFAOYSA-N	432.546	1.340	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N2CCN(CC#N)CC2)cc1	744554322	GCVNJVSDSLCXQT-NBVRZTHBSA-N	447.499	1.009	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2ccc(NNC(=O)c3ncccn3)c([N+](=O)[O-])c2)cc1	746090767	PYPOSHUSFHOEJG-UHFFFAOYSA-N	444.429	1.951	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CC(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1)c1ccccc1	746139324	OXLHJMWLJNOSML-GJZGRUSLSA-N	440.522	1.160	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C2CCN(C(=O)c3cccnc3)CC2)o1	746391756	FUDCZLHNKODFHD-UHFFFAOYSA-N	427.505	1.830	50	20	IDGD	
Cc1cccn2cc(CCNC(=O)NNC(=O)CCN3CCN(c4ccccc4)CC3)nc12	746776820	YNMBYTRLAIHDRU-UHFFFAOYSA-N	449.559	1.728	50	20	IDGD	
CC(C)[C@H](NC(=O)NC(C)(C)C)C(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	747045445	XNDREVLIHQMWGE-HNNXBMFYSA-N	437.453	1.021	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)c2ccc(C#N)cc2)cc1	747072586	FQPOMIGMDPHACU-UHFFFAOYSA-N	436.515	1.212	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)CN1CCN(C(=O)OCc2ccccc2)CC1	747348304	NNVKDIMNBAZXCF-UHFFFAOYSA-N	428.464	1.470	50	20	IDGD	
COC(=O)[C@@H](O)C1CCN(C(=O)CCC(=O)C(C#N)=C2N(C)c3ccccc3N2C)CC1	747521510	VCIZSJWIDZWZEH-NRFANRHFSA-N	440.500	1.430	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2cc(C(=O)NNC(=O)c3ccc[nH]3)ccc2Cl)C[C@@H](C)O1	747663601	NDOXIRDHTNRRSU-TXEJJXNPSA-N	440.909	1.541	50	20	IDGD	
CC(=O)c1cccc(NC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)c1	747822929	BABCBUUIIFXTAP-UHFFFAOYSA-N	431.518	1.974	50	20	IDGD	
COc1cc(OC)cc(N2CC[C@H](NC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)C2=O)c1	747954084	GDHMXWVLJWGZPJ-KRWDZBQOSA-N	443.416	1.362	50	20	IDGD	
COc1cc(OC)cc(N2CC[C@H](NC(=O)NNC(=O)Cc3ccccc3OC)C2=O)c1	747956844	WSSCSTXJXYCVSF-SFHVURJKSA-N	442.472	1.391	50	20	IDGD	
CCn1cc(S(=O)(=O)NC(=O)/C(C#N)=C\c2cc(C)n(C[C@@H]3CCCO3)c2C)cn1	749216276	GYZSQCOSBIGBTA-XUKORKDYSA-N	431.518	1.912	50	20	IDGD	
O=C(NNC(=O)[C@H]1OCCc2ccccc21)c1cccc(S(=O)(=O)N2CCCC2)c1	749590546	OEMMGGXWCBKOAE-IBGZPJMESA-N	429.498	1.546	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@@H]2CCC[C@@H]([S@@](=O)CC)C2)c2ccccc2c1=O	750670837	NEWRFGKMOWDIOS-GKXFIBDASA-N	433.534	1.440	50	20	IDGD	
CN1CCc2cc(C=NNC(=O)c3cccc(S(=O)(=O)N4CCOCC4)c3)ccc21	752718667	OHQBDUZJFOVKFY-UHFFFAOYSA-N	428.514	1.464	50	20	IDGD	
O=C(CO)NNC(=O)COc1c(I)cc(Cl)c2cccnc12	753442134	ABAFWBMSADSHMP-UHFFFAOYSA-N	435.605	1.011	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1cccc(C(F)(F)F)c1)C(=O)NNc1cc(Cl)nc(N)n1	753463226	CCJGHAHHSKBZBI-SSDOTTSWSA-N	438.819	1.541	50	20	IDGD	
Cc1oc(S(N)(=O)=O)cc1C(=O)NNC(=S)Nc1cccc(Br)c1	754183543	RFKYYGXEMYTOLA-UHFFFAOYSA-N	433.309	1.629	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NC(=O)NNC(=O)c2cncc(NC(C)=O)c2)cc1	755358987	IZQPEYBFKIYRCC-UHFFFAOYSA-N	448.505	1.537	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2ccc(NC(=O)NNC(=O)c3ccncc3)cc2)C[C@@H](C)O1	755425151	ZFDQNQISOKODRV-OKILXGFUSA-N	433.490	1.346	50	20	IDGD	
Cc1nnnn1-c1cccc(NC(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)c1	755757968	ISFZPAHYNGBDFS-UHFFFAOYSA-N	447.459	1.728	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ncc(Cc3ccccc3)s2)c1O	756154863	IYIKJGYWEPCOPH-UHFFFAOYSA-N	426.454	1.848	50	20	IDGD	
CCCc1cnc(NC(=O)C(=O)NNC(=O)c2nn(CC)c(=O)c3ccccc23)s1	756165481	VTNOWIWFNOYXEA-UHFFFAOYSA-N	428.474	1.225	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)COc2cccc(C)c2)cc1S(=O)(=O)NC1CC1	756683847	WBDWDAHZONFFJD-UHFFFAOYSA-N	448.501	1.676	50	20	IDGD	
CCCS(=O)(=O)Nc1cccc(NC(=O)NNC(=O)c2cncc(NC(C)=O)c2)c1	756686439	RYMJLCLNJIUKTH-UHFFFAOYSA-N	434.478	1.658	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)Nc1cccc(S(=O)(=O)Nc2nccs2)c1	756874146	OMBARKSMBQOYBO-LLVKDONJSA-N	443.507	1.148	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)Nc1ccccc1OCC(=O)N1CCOCC1	756876268	ZPSBWJPSIFPFJS-UHFFFAOYSA-N	446.435	1.295	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N[C@@H]2CCN(C(=O)CCc3ccccc3)C2)cc1OC	756915511	KYPIYZRZFBXYEK-GOSISDBHSA-N	440.500	1.882	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N2CC[C@@]3(CCOC3)C2)cc1	757006980	SNOQTUNVIJXUTC-IDJAJCJQSA-N	449.511	1.980	50	20	IDGD	
CC[C@H]1CN(CC(=O)NNC(=O)Cc2nc(C)cs2)CC[C@H]1NC(=O)OC(C)(C)C	757110297	MJTVAMOIWRYPDG-LSDHHAIUSA-N	439.582	1.767	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)N[C@H]1CCN(c2ccccc2OC)C1=O	757284088	CDNDBVGDNUCQMX-HNNXBMFYSA-N	442.472	1.609	50	20	IDGD	
Cc1nn([C@H]2CCS(=O)(=O)C2)c(C)c1NC(=O)NNC(=O)c1ccc2c(c1)OCO2	757872214	WLZAESFYAKUYLK-ZDUSSCGKSA-N	435.462	1.055	50	20	IDGD	
CCOc1ccc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)c3cn(C)cn3)cc2)cc1	758040728	LEEZKTUGRTUOFD-UHFFFAOYSA-N	443.485	1.694	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)N[C@H]1CN(C(=O)OC(C)(C)C)C[C@H]1C#N	758760782	POLDQKDKLSRWCW-ZENOOKHLSA-N	435.456	1.682	50	20	IDGD	
NC(=O)[C@H]1CC[C@@H](CNC(=O)NNC(=O)CCCOc2ccc(Cl)cc2Cl)O1	760204894	VUPYNTIMPWRAPV-SMDDNHRTSA-N	433.292	1.516	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3c(C)nn(CC(F)F)c3C)CC2)cc1	760921253	ZEAUGZIXEBYBDK-UHFFFAOYSA-N	448.518	1.652	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1cccc([C@H]2CCOC2)c1	761815071	VYEQMEAVIGALKO-SFHVURJKSA-N	431.514	1.968	50	20	IDGD	
CC(C)(C)NS(=O)(=O)Cc1cccc(C(=O)NNc2nccc(N3CCOCC3)n2)c1	762855060	FCBWUYYHDGQQRH-UHFFFAOYSA-N	448.549	1.288	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(C(=O)N2CCCC2)cc1	763446655	VOJGOTFIHGOBNP-UHFFFAOYSA-N	425.401	1.231	50	20	IDGD	
O=C(NNC(=O)c1ccccc1Br)C(=O)Nc1cccc(N2CCCC2=O)c1	763482926	OHXMAWMCECOXTI-UHFFFAOYSA-N	445.273	1.976	50	20	IDGD	
O=C(NNC(=O)c1ccccc1O)C(=O)Nc1ccn(-c2cccc(C(F)(F)F)c2)n1	763528677	RARZVYNDHXSBNM-UHFFFAOYSA-N	433.346	1.996	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc3nc(N4CCOCC4)oc3c2)c(C)o1	763603052	VLECRYWZVDNOKF-UHFFFAOYSA-N	427.417	1.274	50	20	IDGD	
Cc1ccc(-c2nnco2)cc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccccc2)[nH]n1	763603941	CPUJEPRTXWHXDA-UHFFFAOYSA-N	431.412	1.835	50	20	IDGD	
CSc1cnn(-c2ccccc2)c1NC(=O)C(=O)NNC(=O)c1c(C)nc2ccccn12	763630284	XQJFJAYCDHEOPH-UHFFFAOYSA-N	449.496	1.950	50	20	IDGD	
CCOC(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)c2cc(OC)cc(OC)c2)c1	763773601	ZIADOGJSQCOWCX-UHFFFAOYSA-N	429.429	1.209	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)C(=O)Nc1ccc(F)cc1C(F)(F)F	763806111	ZIDZATJDWZXONS-UHFFFAOYSA-N	444.297	1.918	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(N3CCNC(=O)C3)c(Cl)c2)cc1	763831389	JGXRRPLRMDCOJF-UHFFFAOYSA-N	443.891	1.238	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccn(Cc2ccncc2)n1	763873488	UKGLUMWNWWGKDU-CYBMUJFWSA-N	426.408	1.019	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccccc2-n2cncn2)ccc1OC(C)C	763916751	VPXMTCIYFHOYTL-UHFFFAOYSA-N	438.444	1.463	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)C(=O)Nc1nc(-c2ccccc2)cs1	763917490	VCGTUOVMKYUCMF-UHFFFAOYSA-N	434.441	1.186	50	20	IDGD	
CCc1ccc(Cl)c(CC)c1NC(=O)C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	763917582	YMWJTFUDMQBCEN-UHFFFAOYSA-N	441.879	1.840	50	20	IDGD	
Cc1nc(Br)ccc1NC(=O)C(=O)NNC(=O)c1cc(Cl)ccc1O	763974635	UBWNFZAVSOPRIE-UHFFFAOYSA-N	427.642	1.911	50	20	IDGD	
COCCOc1ccccc1NC(=O)C(=O)NNC(=O)c1cc(Br)c[nH]1	763994374	CLLJKHJLHJPBLB-UHFFFAOYSA-N	425.239	1.202	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)C(=O)Nc1cccc(CS(=O)(=O)C2CCCCC2)c1	763996186	MOKVAGGCWJFEIC-UHFFFAOYSA-N	446.529	1.672	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)Nc1ccc(-n2cccn2)cc1	764003091	YDTLYCRXFHNZQA-UHFFFAOYSA-N	431.250	1.373	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1OC(F)F	764078401	SMSHRQDQIVFWQE-UHFFFAOYSA-N	441.412	1.400	50	20	IDGD	
CN(C)CCC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)cc1	764117835	SWRJWVBZIUAXEQ-UHFFFAOYSA-N	447.879	1.336	50	20	IDGD	
CN1CCC/C1=N/S(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)CC2CCCC2)cc1	764188133	NYCFFVPCNOZTEG-ULJHMMPZSA-N	449.533	1.166	50	20	IDGD	
CO[C@@H]1Cc2ccc(NC(=O)C(=O)NNC(=O)c3cc(Br)ccc3O)cc2C1	764279119	YOEFOZHTAJRUGY-CQSZACIVSA-N	448.273	1.668	50	20	IDGD	
CC(C)(C(=O)NNC(=O)C(=O)Nc1cccc2c1CCN2S(C)(=O)=O)c1ccccc1	764321166	RZUQJZIXJYIJCG-UHFFFAOYSA-N	444.513	1.072	50	20	IDGD	
Cc1nn(-c2ccccc2)cc1NC(=O)C(=O)NNC(=O)c1cnn(-c2ccccc2)c1	764345302	FPSLPAUKNFTWNK-UHFFFAOYSA-N	429.440	1.766	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc(C(N)=O)c(F)c3)n[nH]2)cc1C	764386673	KPFFITXHKBVZKP-UHFFFAOYSA-N	438.419	1.331	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NC[C@H](NC(=O)OC(C)(C)C)C2CC2)c2ccccc2c1=O	764557905	LEJZUQVSVUGTMT-HNNXBMFYSA-N	444.492	1.181	50	20	IDGD	
O=C(CCn1c(S)nc2ccccc2c1=O)NNC(=O)CSc1ccccc1O	765249800	QSGYIOFYVBNYPY-UHFFFAOYSA-N	430.511	1.721	50	20	IDGD	
Cc1c(Br)cc(C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)c(=O)n1C	765479390	MFHRYWNPHKCHEO-UHFFFAOYSA-N	445.314	1.522	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)NCc1nnc2ccc(C(F)(F)F)cn12	765632083	ASOAOWGRHZGRNC-UHFFFAOYSA-N	428.396	1.978	50	20	IDGD	
CC(C)N1CCC(C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)CC1	766669145	NNJWFALCNCEOIX-UHFFFAOYSA-N	436.000	1.725	50	20	IDGD	
O=C(COC(=O)CCCC(=O)c1ccc2c(c1)OCCO2)NNC(=O)c1cccs1	766754608	JQWBWTWXSPDQID-UHFFFAOYSA-N	432.454	1.877	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)Cc3c(C)nc4nc(N)nn4c3C)n[nH]2)cc1C	768260774	NWBGVAVDACLUPY-UHFFFAOYSA-N	433.476	1.334	50	20	IDGD	
Cc1ccc(F)c(NC(=S)NNC(=O)c2nccc3c(S(N)(=O)=O)cccc23)c1	768481004	DBVBPIXDTGROEZ-UHFFFAOYSA-N	433.490	1.961	50	20	IDGD	
COc1ccc(N2C[C@H](C(=O)NNc3c(OC)cccc3S(C)(=O)=O)CC2=O)cc1	768629259	HAKZDAKJSGEXRP-CYBMUJFWSA-N	433.486	1.604	50	20	IDGD	
CC(C)(C)OC(=O)Nc1ccc(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c(O)c1	769618473	YGNUDHZXOLCTSQ-UHFFFAOYSA-N	439.432	1.790	50	20	IDGD	
CC(C)c1nccnc1NNC(=O)Nc1ccc(N(C)C(=O)CN2CCN(C)CC2)cc1	770418738	WWWDJLVJTDDXLJ-UHFFFAOYSA-N	440.552	1.959	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)[C@@H]1CCCC[C@@H]1C(=O)N1CCCC1	772890101	VURVAJBRUCXACW-SJORKVTESA-N	434.924	1.532	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)CCNC(=O)c1n[nH]c2ccccc12	772969252	KVESAMKJYHKLIY-LBPRGKRZSA-N	429.864	1.951	50	20	IDGD	
O=C(NNc1ccc(C(F)(F)F)cn1)C(=O)Nc1ccc(C(=O)N2CCOCC2)cc1	773666794	RXJPOHQWPQMEAK-UHFFFAOYSA-N	437.378	1.655	50	20	IDGD	
CN1C(=C(C#N)C(=O)COC(=O)c2sccc2S(N)(=O)=O)N(C)c2ccccc21	774805080	VLJKEVQBQAELED-UHFFFAOYSA-N	432.483	1.443	50	20	IDGD	
C[C@H](OC[C@H]1CCCCO1)C(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776201846	MHNLSPCHHDNXHU-JKSUJKDBSA-N	428.530	1.596	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)c2ccc(F)c(S(=O)(=O)N3CCCC3)c2)c1	776720876	JPHQZQWKYLABTF-UHFFFAOYSA-N	441.506	1.771	50	20	IDGD	
CC(=NNC(=O)CSc1nnc(O)nc1O)c1cc(Br)cc(C)c1O	777430865	SLIALQKNQHSUKT-UHFFFAOYSA-N	428.268	1.692	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)c1nnn(-c2ccccc2F)c1C(F)(F)F	778433338	LTBUKPSIPWLGRH-UHFFFAOYSA-N	446.361	1.711	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN[C@@H](C)c1cccc(S(N)(=O)=O)c1	781427094	HBOWKPWMUHMYCF-NSHDSACASA-N	440.909	1.108	50	20	IDGD	
C[C@@H]1C[C@@H](C)CN(C(=O)CN2CCN(CC(=O)NNC(=O)c3cccc(Cl)c3)CC2)C1	782100611	HAXMSFSJBQIDSR-IAGOWNOFSA-N	449.983	1.223	50	20	IDGD	
CN(C)c1c(Cl)cccc1NC(=O)C(=O)NNC(=O)Cc1nc2ccccc2n1C	782888596	VUVXJNTUZDNFAJ-UHFFFAOYSA-N	428.880	1.621	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)C(=O)Nc1ccc2occ(C)c2c1	782896455	IOJSLZYZDFEAIO-UHFFFAOYSA-N	443.485	1.742	50	20	IDGD	
CS(=O)(=O)Cc1ccccc1NC(=O)C(=O)NNC(=O)c1ccc(Cl)cc1Cl	782924155	AEOJCKPDULJZLF-UHFFFAOYSA-N	444.296	1.938	50	20	IDGD	
Cc1ccc(NNC(=O)C(=O)Nc2ccc(Cl)c(S(=O)(=O)N3CCCC3)c2)nn1	783949847	NYHMIZKAYHWLSP-UHFFFAOYSA-N	438.897	1.305	50	20	IDGD	
Cc1ccc(Oc2ccccc2)c(NC(=O)C(=O)NNC(=O)CNC(=O)c2ccco2)c1	784001696	BRGKXIOBJQHPPJ-UHFFFAOYSA-N	436.424	1.896	50	20	IDGD	
CCCOc1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)cc1	784216745	PGGWENLPHAKGFS-UHFFFAOYSA-N	432.502	1.998	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNc3ccc(Br)cn3)cn2)C[C@H](C)O1	784340307	AAVJTJAYRBFGMX-RYUDHWBXSA-N	449.309	1.935	50	20	IDGD	
CC(C)(C)c1ccc(NNC(=O)C(=O)Nc2ccn(CC(=O)N3CCOCC3)n2)cc1	784804619	MFECOLWYAZKQRM-UHFFFAOYSA-N	428.493	1.121	50	20	IDGD	
COC(=O)c1cc(F)c(F)cc1NC(=O)C(=O)NNc1ccc(Br)nc1	784809543	RPNXRFNQDYVICB-UHFFFAOYSA-N	429.177	1.991	50	20	IDGD	
Cc1nccc(-c2cccc(NC(=O)C(=O)NNC(=O)Cc3cn4ccccc4n3)c2)n1	785067208	IZQJZEUAJPDAQK-UHFFFAOYSA-N	429.440	1.428	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2ccc(=O)n(Cc3ccccc3)c2)n1	785226643	KIKRBRUFHWUIPF-UHFFFAOYSA-N	435.488	1.615	50	20	IDGD	
O=C(Cc1ccccc1CO)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	786642630	ZGKHTXDUCPBMBV-UHFFFAOYSA-N	442.475	1.941	50	20	IDGD	
NS(=O)(=O)c1ccccc1NNC(=O)c1ccc(NS(=O)(=O)c2ccccc2)cc1	788223170	GJRKYBVBPANCPF-UHFFFAOYSA-N	446.510	1.892	50	20	IDGD	
NS(=O)(=O)c1ccccc1NNC(=O)c1cccc(NS(=O)(=O)c2ccccc2)c1	788230283	LYJSJGVJSKUDTL-UHFFFAOYSA-N	446.510	1.892	50	20	IDGD	
O=C(CCCCCn1c(S)nc2ccccc2c1=O)NNC(=O)CN1CCCC1=O	789857271	CGVGPEDXXDUZDK-UHFFFAOYSA-N	431.518	1.015	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)COc2ccccc2-c2ccccc2)c(=O)c2cnn(C)c21	791195224	LIVOCVZYXVXBNQ-UHFFFAOYSA-N	431.452	1.779	50	20	IDGD	
CN(C)N(C(=O)c1cccc(NN2C(=O)[C@@H]3CC=CC[C@H]3C2=O)c1)[C@@H]1CCS(=O)(=O)C1	792851212	UJIIEMBOSAAJKK-KZNAEPCWSA-N	446.529	1.071	50	20	IDGD	
CCS(=O)(=O)c1ccc(N2CCC(NC(=O)NNC(=O)c3cccc(C)n3)CC2)cc1	792953139	ZPULJBSWFNVELL-UHFFFAOYSA-N	445.545	1.797	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)c2ccc3c(c2)OCO3)c(Br)c1	794578190	GNWYBXMJJOZQGK-UHFFFAOYSA-N	429.248	1.810	50	20	IDGD	
CC(C)(C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1)c1ccccc1[N+](=O)[O-]	796445630	NLRJOBUMPFHSNY-QGZVFWFLSA-N	443.412	1.403	50	20	IDGD	
COC(=O)c1cc(F)cc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)c1F	797003259	ZEGVFJMMBJBULM-UHFFFAOYSA-N	427.747	1.510	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNC(=O)C(=O)Nc1cnccc1-c1ccccc1	797368615	FODYTCIXAHPGOJ-UHFFFAOYSA-N	447.451	1.761	50	20	IDGD	
CN(C)c1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)CNC(=O)OCc1ccccc1	797369354	SYQSORWDLRSEJJ-UHFFFAOYSA-N	447.879	1.418	50	20	IDGD	
COc1cccc(/C=C(\C(=O)NNC(=O)C(=O)Nc2ccc(C)cc2)n2nnnc2C)c1	801107166	ONPFJLZCYDLMDG-LDADJPATSA-N	435.444	1.083	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@@H]2C(=O)NNC(=O)N=c2cc[nH]cc2)cc1	802025207	WRSSJQWLIBBEHA-GOSISDBHSA-N	445.501	1.102	50	20	IDGD	
CCCCS(=O)(=O)N1CCC(C(=O)NNC(=O)Nc2ccc(N(C)C)cc2)CC1	802124875	IMAYUQRKCFFYQT-UHFFFAOYSA-N	425.555	1.747	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@](C)(O)C2CC2)c1	804146353	PZSSBURBXPZMKB-HXUWFJFHSA-N	433.486	1.418	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)N2CCC[C@@H]2C[C@]2(C)NC(=O)NC2=O)c1C	804555474	PNIVZBWIGBWVEM-JWUHQKRGSA-N	427.505	1.638	50	20	IDGD	
CCN(C)C(=O)c1cccc(NC(=O)C(=O)NNC(=O)CSc2ccc(C)cc2)c1	806974983	JNMZDWLKGRCDJM-UHFFFAOYSA-N	428.514	1.965	50	20	IDGD	
COc1ccc(F)cc1CN1CCN(C(=O)NNC(=O)c2c(C)nc3ccccn23)CC1	807113407	DMPSQPSIVCAFFC-UHFFFAOYSA-N	440.479	1.963	50	20	IDGD	
O=C(NNc1nccnc1C1CCC1)C(=O)Nc1ccc(F)c(-n2nnnc2C2CC2)c1	807462329	VPIPNMDVPFQZNY-UHFFFAOYSA-N	437.439	1.818	50	20	IDGD	
O=C1CC(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)(c2ccccc2)C1	809983432	JWGAQLWKOMPAGD-UHFFFAOYSA-N	441.509	1.533	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@H]2c3ccccc3O[C@@H]2C)cc1	812430778	RNKIEDWPOTVKID-AUUYWEPGSA-N	432.502	1.468	50	20	IDGD	
CCOC(=O)c1nc(NC(=O)C(=O)NNC(=O)[C@@H](CC)c2ccccc2)sc1C(C)=O	815569675	CFCNWJSCTOAFSW-ZDUSSCGKSA-N	446.485	1.802	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)[C@@H]1C[C@H]2C[C@H]2N1C(=O)OC(C)(C)C	815623113	NXKBUZMNZMHIQK-UPJWGTAASA-N	427.502	1.239	50	20	IDGD	
CC(C)COc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2CCc3nncn3C2)cc1Cl	815692682	YHXVYQAZQCLBGU-LBPRGKRZSA-N	434.884	1.315	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)CCn2nnc3ccccc3c2=O)c1	816717987	YVABFXDLEAHEQG-UHFFFAOYSA-N	446.261	1.874	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@H](C(=O)Nc2cccc(NC(=O)NN(C)C)c2)[C@@H](C)O)cc1	819552593	YTUYEEHFBGIFSB-KDOFPFPSSA-N	449.533	1.260	50	20	IDGD	
O=C(Cc1ccc([N+](=O)[O-])cc1)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	912643227	KHBDLYZBUDEXNI-UHFFFAOYSA-N	446.485	1.773	50	20	IDGD	
O=C(CN1CCCC1=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2F)c1	913654832	UYIITRILIFHILM-UHFFFAOYSA-N	434.449	1.010	50	20	IDGD	
COc1ccnc(NNC(=O)CCNS(=O)(=O)c2ccc(OC(F)(F)F)cc2)n1	914861229	BFCSYUJNEBIHMX-UHFFFAOYSA-N	435.384	1.196	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)[C@@H]2CC(=O)N(c3ccccc3)C2)cc1OC	914989702	UCTLBUKYCWRQPL-OAHLLOKOSA-N	441.440	1.061	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)CNS(=O)(=O)c2c(F)cccc2F)c1C	915787873	KZGIONYXPWYAPF-CYBMUJFWSA-N	441.456	1.475	50	20	IDGD	
COc1ccc(C(=O)NCCNC(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)cc1	918222540	XGMKQRZBDMAGLL-INIZCTEOSA-N	428.489	1.840	50	20	IDGD	
Cc1ccc([C@H](C)NC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)s1	919787145	MWZVXARXZARWMN-AWEZNQCLSA-N	438.579	1.775	50	20	IDGD	
O=C(NNC(=O)c1nc(-c2ccccc2)n2c1CCCCC2)N[C@@H]1CCS(=O)(=O)C1	919885291	KTZFVSWIPXDTJJ-OAHLLOKOSA-N	431.518	1.408	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)[C@@H]2CC(=O)N(c3ccc(F)c([N+](=O)[O-])c3)C2)cc1	920012744	YQVSLBUFCIIUEL-CQSZACIVSA-N	444.419	1.876	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)c3cc([N+](=O)[O-])cc(S(C)(=O)=O)c3)n[nH]2)cc1	920299340	BBYZTZSYLSHLHT-UHFFFAOYSA-N	443.441	1.772	50	20	IDGD	
COC(=O)CN(C)C(=O)/C(C#N)=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	920853252	MUMWTIYLTSRYPC-ZROIWOOFSA-N	429.864	1.617	50	20	IDGD	
CNS(=O)(=O)c1ccc(Br)c(C(=O)NNc2cc(Cl)nc(C)n2)c1	1252537612	KVIXYAOMKAJDRJ-UHFFFAOYSA-N	434.703	1.866	50	20	IDGD	
CS(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)c2cncn2-c2ccccc2)cc1F	1340363062	DPTOFTYZQLVLHC-UHFFFAOYSA-N	438.462	1.038	50	20	IDGD	
Cc1cc2nnc(C(=O)N3CC[C@@]4(CN(C(=O)CO[Si](C)(C)C)CCO4)C3)c(C)n2n1	1777783078	VORQXQIUIKGXMT-HXUWFJFHSA-N	446.584	1.036	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C1(F)CC1)C2	1778092937	WRQTYKUVHMFDPL-JPMRSZNZSA-N	433.484	1.136	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@]2(C1)CN(C(=O)C[C@H]1COc3ccccc3O1)CCO2	1779293808	CYPIJEFPGCJKLS-HTAPYJJXSA-N	448.592	1.898	50	20	IDGD	
COc1ccnc(C(=O)N2CCO[C@@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)c1OC	1779300751	XTZAEGMCYZYIPZ-HXUWFJFHSA-N	437.569	1.394	50	20	IDGD	
C=C[C@H](O)C(C)(C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CO[Si](C)(C)C)C2	1779336020	PFTQVAUMNCPNIT-CSODHUTKSA-N	426.630	1.925	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(CCN(C(=O)c3cccn(C(F)F)c3=O)C2)C1	1779359556	SBGITCNHADXRAB-LJQANCHMSA-N	443.523	1.538	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2)c1ncccc1C(F)(F)F	1779828498	MPRUGYNZLUTAFE-HBUWYVDXSA-N	449.857	1.828	50	20	IDGD	
CCOc1ccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](Cl)COC)C3)nn1	1780239852	RVOJJVJOFPUWAS-AKCHCHLHSA-N	440.928	1.257	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)ccc1Br	1780869342	NQLRXXLWUOWHBC-CRAIPNDOSA-N	445.741	1.801	50	20	IDGD	
O=C([C@@H](O)CCl)N1CCO[C@@]2(CCN(C(=O)C3(c4ccc(F)c(F)c4)CC3)C2)C1	1780922611	PZASRMSHKXSMEW-LPHOPBHVSA-N	428.863	1.426	50	20	IDGD	
O=C(c1cc2ncsc2[nH]1)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781332459	YYPKSFWLPMVZOR-XHDPSFHLSA-N	431.287	1.758	50	20	IDGD	
COc1cc(C)c(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)cc1OC	1781889676	VXZOLIPNKAYTSD-YWZLYKJASA-N	426.897	1.055	50	20	IDGD	
O=C(c1cc2ncccc2[nH]1)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1782211642	XHYQFMHUADJOAH-WMLDXEAASA-N	425.258	1.697	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CCC(=O)NN(C)C)C2)c(C)n1	1782212292	POTREENXCAORBR-AUSIDOKSSA-N	445.564	1.199	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](C)NC(=O)c3ccccn3)C2)C1	1782665879	CCBJYCTXLSHUEW-MRUHUIDDSA-N	436.940	1.437	50	20	IDGD	
CC(=O)N[C@H](C)C(=O)N1CCO[C@]2(CCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1	1782867658	WNLJEKNNAQBICB-JPIHKZNQSA-N	446.454	1.226	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccnc(Br)c3)CCO2)C1	1783878009	UNXXTNMPAIFVGQ-CXAGYDPISA-N	446.729	1.541	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)CC(C)(C)C(=O)OC(C)(C)C)CCO2)C1	1783881318	KTIZQOVCOXYXFF-YCRPNKLZSA-N	446.972	1.828	50	20	IDGD	
O=C(C(Cl)Cl)N1CC[C@@]2(C1)CN(C(=O)C1CCN(c3ccccn3)CC1)CCO2	1783948298	IMHNMFJFOVKZSY-HXUWFJFHSA-N	441.359	1.932	50	20	IDGD	
O=C([C@H](F)Br)N1CCO[C@@]2(CCN(C(=O)[C@@H]3CCc4nc[nH]c4C3)C2)C1	1784351702	NARYTIJZIJHXBG-HYSWKAIVSA-N	429.290	1.035	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]3C2)cc1O	1787449536	GPNUTSRFAOAHAW-PYTWLRIVSA-N	427.860	1.478	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)COc3ccccc3C#N)C[C@@H]21	1788766150	QYCHYBQPKHIPCV-BJLQDIEVSA-N	445.592	1.768	50	20	IDGD	
CCOc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)Br)C[C@@H]32)nn1	1789398753	SXNQAQKGKLBCLL-ABHRYQDASA-N	441.326	1.252	50	20	IDGD	
O=C([C@H](O)CCl)N1CC[C@H]2CO[C@@H](CNC(=O)C3(c4ccc(F)c(F)c4)CC3)[C@H]2C1	1789703827	KCERSEACANFTIR-KYABYICQSA-N	442.890	1.576	50	20	IDGD	
CC(=O)NCC(C)(C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]2C1	1789867783	JMWBLVDZZCWETP-XMDUPGNXSA-N	436.380	1.365	50	20	IDGD	
Cc1nc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]3C2)c(C)s1	1789922395	MBZVLBHRUGLYJC-DUPGQFARSA-N	448.358	1.973	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc4c[nH]nc34)C[C@@H]21)[C@@H](F)Br	1789923062	RMZFFNROXYOISZ-ATVPRXPUSA-N	439.285	1.847	50	20	IDGD	
COc1cc(C(=O)Nc2ccc(C3(NC(=O)c4cccc(B(O)O)c4)CCC3)cc2)nn1C	1790193656	HBNBMTJRLUZYTI-UHFFFAOYSA-N	448.288	1.170	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4c(n3)OCCO4)C[C@@H]21)C(Cl)Cl	1791295726	XCLRMDDXWFPDHL-MJVIPROJSA-N	430.288	1.250	50	20	IDGD	
CC[C@@H](O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](Br)Cc1ccccc1)C2	1792864867	DMPADPZMPVZNCN-CWQOZTLDSA-N	439.350	1.353	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)Cc1ccccc1)C2	1792871979	GPBOCIJCABIOKU-SOVHRIKKSA-N	439.350	1.211	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H]2C[C@@]21C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCl	1793115943	BOSKTJMOJZJKCJ-YFYQZICJSA-N	441.956	1.624	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CSc1ccc(F)cc1F	1793292126	DZBQUPYUBLJKED-AZGFTEDZSA-N	448.919	1.900	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cncc(N(C)C)c1	1794296702	LVMTZCSWHBNGOI-ZIEJDFEHSA-N	425.327	1.134	50	20	IDGD	
O=C(Cc1ccccc1C(F)(F)F)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2	1795231140	VDVHYOMXQNKUGD-IARIHHJXSA-N	434.842	1.437	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CC[C@@H](N)C(N)=O	1796087353	WRBCIPRZUUJPJP-HDAOGJMZSA-N	445.470	1.103	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)c1ccnc(C(F)F)c1	1796188288	MAFFEPZIQQYPRT-BJWYYQGGSA-N	429.232	1.265	50	20	IDGD	
COc1cc(C)c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)c(C)c1	1796189479	SACGBBHHLVMGDC-ACDBMABISA-N	436.317	1.557	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)[C@@H]1[C@H]2Sc3ccccc3[C@@H]21	1796191453	OASZBUWTRLLVPY-JUOVRFQDSA-N	448.353	1.506	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1n[nH]c3cc(Cl)ccc13)C2)[C@@H](F)Cl	1796367404	HVOHKBMPJOLPGX-OBSGGCNASA-N	429.279	1.883	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2c(c1)OCO2	1796787437	SBONHGOCKSUVOZ-YGSHXTJESA-N	425.279	1.402	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C=C/c1cc(C)on1	1797834540	NZUGLSNHVXJRKG-UEVDSIMOSA-N	426.311	1.759	50	20	IDGD	
C[C@@H](Cc1ccccc1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnccc1C(=O)NN	1798443554	HQRPTUFECUYXAW-KANFNMMFSA-N	435.528	1.816	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCc1ccccc1F)C2	1798443690	WOACFWUSSANSNB-BJWYYQGGSA-N	439.491	1.709	50	20	IDGD	
Cn1cc2cc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@H](F)Br)C4)ccc2n1	1799910984	XJHRVDCABDJKLO-XRGAULLZSA-N	439.285	1.467	50	20	IDGD	
O=C(Cn1cnc2ccccc21)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2	1800888714	AQXRCVDUAIJUHR-HBCWATKFSA-N	435.322	1.411	50	20	IDGD	
O=C(CCc1cncc(C(F)(F)F)c1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2	1801232398	KAWQNWVSQLSXHW-YXPYIKCWSA-N	449.857	1.222	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H]1C[C@H]1c1ccc(F)cc1)C2	1802334866	QPXXGELPQVMMDO-WPVAHCMFSA-N	430.524	1.940	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1CC[C@H](O)CC1	1802557149	DTJNQMGFQZLQBW-HMAARASZSA-N	429.521	1.310	50	20	IDGD	
CN(C)C(=O)NCC(=O)NC[C@H]1CCN(C(=O)CO[Si](C)(C)C)[C@@H]1c1cccnc1	1802679266	HHNYQZRVAZPYGO-VQIMIIECSA-N	435.601	1.210	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)CCN2C(=O)C=CC2=O)[C@H]1c1cccnc1	1803920183	UOQYACXLSWIXIM-GQIGUUNPSA-N	432.908	1.420	50	20	IDGD	
O=C(Cc1ncccn1)NC[C@@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1	1804689355	ODVIILFCAWFKSI-KXBFYZLASA-N	432.322	1.905	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC2(CCCN(C(=O)c3cccnc3C(N)=O)C2)CC1	1807378379	LWQNNTNOCXEWKI-UHFFFAOYSA-N	432.597	1.877	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)C(Cl)Cl)[C@H]1c1cccnc1)c1nc2ncccn2n1	1809237093	LILGXDHNDWLYQZ-OLZOCXBDSA-N	434.287	1.643	50	20	IDGD	
O=C(CCN1CCOCC1)N1CCCC2(CCN(C(=O)[C@H](F)Br)CC2)C1	1809588412	MDLOLCWDFWKTSZ-INIZCTEOSA-N	434.350	1.630	50	20	IDGD	
CC(C)n1nccc1C(=O)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1	1809977547	DELQUFNDVGAMFN-UHFFFAOYSA-N	438.337	1.302	50	20	IDGD	
C=C(C(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1)C(F)(F)F	1812682073	JLQRJWCMXOVCMA-QAPCUYQASA-N	441.454	1.579	50	20	IDGD	
CCC(=O)N[C@H](C)C(=O)N1CC[C@H](CNC(=O)[C@@H](C)Br)[C@H]1c1cccnc1	1812863803	CYCOOOIWEHZZGW-GKLJAUDBSA-N	439.354	1.786	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)c2ccc(O)nn2)[C@H]1c1cccnc1	1812865623	XKVBTQOXAAZOJE-RBOXIYTFSA-N	434.294	1.680	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)CSCC(=O)OC)[C@H]1c1cccnc1	1813028526	RVRXEDAEEFZTRN-VKJFTORMSA-N	443.953	1.247	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)on1	1813070391	ILXBWKMBSDPZBS-JXFKEZNVSA-N	428.493	1.071	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](C)CBr)n[nH]1	1814780044	FFLQERLTOJZKRG-GVXVVHGQSA-N	443.346	1.880	50	20	IDGD	
Cc1ccc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)cn1	1815355124	NQHGVPOOCWTKMX-INIZCTEOSA-N	436.302	1.066	50	20	IDGD	
O=C(CCBr)Nc1cc([C@H]2CCCCN2C(=O)CN2C(=O)C=CC2=O)[nH]n1	1816784552	ITEFRLXWDAOJRE-GFCCVEGCSA-N	438.282	1.112	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CN2CCNC2=N)n[nH]1	1817298793	QCJVTHRVWBFEKC-ZYHUDNBSSA-N	426.319	1.025	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@H]2CCCS2)[nH]n1)c1ccc(B(O)O)cc1	1817475861	XAAPAEWBJICILB-IAGOWNOFSA-N	428.323	1.291	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](O)CCl)CC2)c1ccc2cccnc2n1	1818972501	XHISMCLZFDXTEU-SMDDNHRTSA-N	431.905	1.912	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)Cn2ccncc2=O)[nH]n1	1820868568	JOZSRCJEGLPZRN-FZKQIMNGSA-N	441.319	1.895	50	20	IDGD	
COCC(=O)N[C@@H]1CCc2nc(NC(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)sc2C1	1821303138	UUBVBZCQXQRHRQ-LLVKDONJSA-N	448.457	1.849	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1)c1nc2ccc(F)cn2n1	1821595186	AJADXGSEGIBLPW-STQMWFEESA-N	435.847	1.497	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2nc3ncccn3n2)[nH]n1	1822371437	WKAKZSPAECXGDN-DGCLKSJQSA-N	432.872	1.407	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(C(=O)O)ncn2)CC1	1825508350	RAAXWMGRYFVPGL-YOEHRIQHSA-N	438.912	1.662	50	20	IDGD	
COc1cc(C(=O)N[C@H]2CCc3nc(NC(=O)[C@H](C)Br)sc3C2)nn1C	1825645941	LWHMVRVXLVCKFX-IUCAKERBSA-N	442.339	1.894	50	20	IDGD	
CCc1nc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)co1	1827057329	CIMRLSRUMWBISD-HXUWFJFHSA-N	439.321	1.464	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@H](O)CCl)CC3)cc1	1827726347	CVPIIIULFSBOHL-UKRRQHHQSA-N	436.921	1.927	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H](F)Br)CC1	1829091619	IIVFIMLHDJQNRG-IVMMDQJWSA-N	432.334	1.987	50	20	IDGD	
Cc1ccc(F)cc1C(=O)N1CCO[C@]2(COCCN(C(=O)CCBr)C2)C1	1830071788	XTINKXUOLCSKSL-IBGZPJMESA-N	443.313	1.989	50	20	IDGD	
Cc1nscc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2	1830534963	FYXGMKVOXZQEII-YVEFUNNKSA-N	446.367	1.553	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(F)cn3)C2)C1	1830537180	CITWDBNBMJBMSV-SCLBCKFNSA-N	444.301	1.322	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccsc3)C2)C1	1830537422	HQEBASMUFJPWLM-CXAGYDPISA-N	431.352	1.849	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3CC3(F)F)C2)C1	1830540278	PIZSREBOTMUQLV-LALPHHSUSA-N	425.270	1.129	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CC=CCC1)CCO2	1830568138	NSQDBYFSFAXYFF-JTDSTZFVSA-N	429.355	1.973	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4nonc4c3)C2)C1	1831645631	CTGCDBONIWQUTL-YWZLYKJASA-N	436.896	1.700	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@](C)(O)C(F)(F)F)CCO2	1832149605	APPZMHGBYBICOY-RCBQFDQVSA-N	430.851	1.164	50	20	IDGD	
Cc1ccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)cn1	1833132376	BFRRGFIYWQEXOQ-PMACEKPBSA-N	444.359	1.625	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)CC3CCCC3)CC2)CC1	1834365459	VPZHGIGZYJTHMD-UHFFFAOYSA-N	435.613	1.511	50	20	IDGD	
CCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](Br)Cc3ccccc3)C2)C1	1834816127	YHERAIHFWKTBCY-XLIONFOSSA-N	439.350	1.859	50	20	IDGD	
CCc1noc(C)c1C(=O)N1CCOC[C@]2(CN(C(=O)CCBr)CCO2)C1	1834823040	FSPGPWGDSMODFY-SFHVURJKSA-N	444.326	1.400	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3ccn(C(F)F)n3)CC2)CC1	1835955273	KBCRKYPCFJGKKT-OAHLLOKOSA-N	447.914	1.717	50	20	IDGD	
O=C(c1csc2c1CCCC2)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1	1836896342	ZXUNXHNQERUGSS-OXQOHEQNSA-N	442.965	1.297	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1c[nH]c3cnccc13)CCO2	1837176615	UWSHEQGUPHIPFJ-NRFANRHFSA-N	446.580	1.484	50	20	IDGD	
Cc1ccn(CC(=O)N2CCC(OC3CCN(C(=O)[C@@H](F)Br)CC3)CC2)n1	1837192066	XLEMNZCHCQHEKQ-QGZVFWFLSA-N	445.333	1.881	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)CC[C@H]3CCOC3)C2)C1	1837717712	MKTJUISQRDNVNE-FXAWDEMLSA-N	428.602	1.111	50	20	IDGD	
C/C(=C\c1cccnc1)C(=O)N1CCOC[C@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1837717909	RASORDCZGAMLTN-JMOSNPTESA-N	447.608	1.793	50	20	IDGD	
O=C(NCC(=O)N1CCC(OC2CCN(C(=O)[C@H](F)Cl)CC2)CC1)c1ccco1	1837962478	SFDYDJXKDBPEFJ-KRWDZBQOSA-N	429.876	1.542	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccn(C(F)F)n3)CCO2)C1	1838034302	XCRSCPOIIQGORI-SCLBCKFNSA-N	434.871	1.756	50	20	IDGD	
Cc1ccn(C)c1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1838821354	KQFFGGIAMYGVEZ-PBHICJAKSA-N	432.290	1.094	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3CC(c4ccccc4)=NN3)C2)C1	1839148267	SNPWQNJTLRROSY-LRXVAGHRSA-N	448.951	1.226	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(O)n3)C2)C1	1839151341	OKZRZRNTNYWMEF-QZTJIDSGSA-N	432.304	1.094	50	20	IDGD	
C[C@]1(C(=O)N2CCOC[C@]3(CN(C(=O)[C@@H](F)Br)CCO3)C2)CC1(F)F	1839203488	MNXRNVQWOFRXIS-HONMWMINSA-N	429.233	1.179	50	20	IDGD	
COc1cccc(/C=C/C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)c1	1839994772	FBSUNWZBCIKQPX-RJOJHWARSA-N	426.872	1.699	50	20	IDGD	
Cc1cc(/C=C/C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)no1	1840033607	LDJWCQSUGLSFEF-DIMNXIJWSA-N	442.310	1.236	50	20	IDGD	
CCc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)no1	1840033838	SDIQXFPDYJKZLG-YVEFUNNKSA-N	430.299	1.090	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(F)cc3OC)C2)C1	1840155631	BUIBTIFACXLYSA-OXJNMPFZSA-N	444.887	1.158	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3ccc(C)cc3)C2)C1	1840156447	SIUJJUXUSOKDSG-SIKLNZKXSA-N	438.952	1.638	50	20	IDGD	
Cc1cc(Br)c(N)cc1C(=O)N1CCCC12CN(C(=O)[C@@H](O)CCl)C2	1842855217	MGFGQFGCPMPMAP-AWEZNQCLSA-N	430.730	1.756	50	20	IDGD	
COc1ccc2nc(C(=O)N3CC4(CCCN4C(=O)c4cccc(B(O)O)c4)C3)ccc2c1	1843013912	BYFNWITYRGERNH-UHFFFAOYSA-N	445.284	1.054	50	20	IDGD	
CC(C)CNC(=O)C(=O)N1CCCC12CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1843432012	FKUHDGVPRKDJAZ-AWEZNQCLSA-N	444.960	1.094	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)c2cc(Br)cs2)C1	1843446957	VIALSXRJXKIIAN-UHFFFAOYSA-N	443.367	1.701	50	20	IDGD	
Cn1ccc2cccc(C(=O)N3CCCC34CN(C(=O)c3cnccc3C(=O)NN)C4)c21	1843777482	COMKMNZVKZGKMC-UHFFFAOYSA-N	432.484	1.308	50	20	IDGD	
CN(CC(=O)N1CCCC12CN(C(=O)c1cscn1)C2)NC(=O)NCc1ccccc1	1845038503	JSZRCHVGHDDUSI-UHFFFAOYSA-N	442.545	1.306	50	20	IDGD	
O=C(Cc1c(F)cccc1Cl)N1CC[C@H]2[C@@H]1CCN2C(=O)c1ccc(B(O)O)cc1	1847417017	RIXUPEQVJMSFFA-OALUTQOASA-N	430.672	1.217	50	20	IDGD	
CC(=O)N[C@@H](C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl)c1cccc(Cl)c1	1847565776	XNRWAOLDROQOMK-MWDXBVQZSA-N	428.316	1.319	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cnn(Cc3ccccc3)c2)cc1OC	12854774	POEGTAWNKOIRPY-UHFFFAOYSA-N	438.440	1.567	50	20	IDGD	
CCOc1cc([N+](=O)[O-])c(C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1OC	15721144	LKLIXZZXGGZSKE-UHFFFAOYSA-N	441.400	1.324	50	20	IDGD	
COc1ccc(-c2nnc(SCC(=O)NNC(=O)c3ccc(Cl)cc3)n2N)cc1	20853224	CSSULLLKAAZKJO-UHFFFAOYSA-N	432.893	1.874	50	20	IDGD	
CC[C@H](C)NS(=O)(=O)c1ccc(C(=O)OCC(=O)NNC(=O)c2ccccc2)cc1	24203894	LPCQOJOXLQTFOQ-AWEZNQCLSA-N	433.486	1.381	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)c3cccc(CN4C(=O)CNC4=O)c3)cc2C1	27331925	RVXIITCXXMWFFS-GFCCVEGCSA-N	426.498	2.000	50	20	IDGD	
O=C(CCC(=O)c1ccccc1)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	28028265	HYGJHGHMRSFWEB-UHFFFAOYSA-N	445.497	1.132	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)NCC3CC3)c2)cc1OC	29065309	WSLGQERMXPRNGJ-UHFFFAOYSA-N	433.486	1.467	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)COc2cccc(C(C)C)c2)cc1	30034279	MHYJSQQAUBQUEX-UHFFFAOYSA-N	433.530	1.965	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)N2CCCN(CC(=O)N3CCCC3)CC2)c1C	725882337	BFJMSPYBRIDRDR-JWGURIENSA-N	441.576	1.815	50	20	IDGD	
CN(C)C(=O)[C@@H]1CSCN1C(=O)CCC(=O)C(C#N)=C1N(C)c2ccccc2N1C	727383576	XFEITYKZJNSVOA-KRWDZBQOSA-N	427.530	1.647	50	20	IDGD	
COc1cc(/C=C\C(=O)N([C@H]2CCS(=O)(=O)C2)N(C)C)cc(Br)c1O	728178992	GRYNCZUYKKRMOI-RXNFCKPNSA-N	433.324	1.669	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)c2ccc(F)c(S(=O)(=O)N3CCCCC3)c2)c1	728828325	STPMNKFFHRNGBY-UHFFFAOYSA-N	430.461	1.947	50	20	IDGD	
Nn1c(COc2ccccc2)nnc1SCC(=O)NNC(=O)c1cccc(Cl)c1	729032336	FALLEUOEJUSBJZ-UHFFFAOYSA-N	432.893	1.778	50	20	IDGD	
CC(=O)c1cccc(S(=O)(=O)NCCC(=O)NNC(=O)CCc2ccccc2O)c1	730033528	CIBKKGIRZGEXRO-UHFFFAOYSA-N	433.486	1.043	50	20	IDGD	
CCN1CCN(c2ccc(CNC(=O)NNC(=O)COc3ccccc3O)cc2F)CC1	730910484	KETBEUKGROGKOZ-UHFFFAOYSA-N	445.495	1.583	50	20	IDGD	
N#CCCN(C(=O)CCC(=O)NNC(=O)CNC(=O)c1cccs1)c1ccccc1	731225911	YUQJKNZXXBARTD-UHFFFAOYSA-N	427.486	1.352	50	20	IDGD	
O=C(NNC(=O)C(=O)N1CCCC1)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	731404197	IZGSPICIKXIQDU-UHFFFAOYSA-N	442.347	1.911	50	20	IDGD	
CN1CCCC[C@H]1C(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	731865690	RKFMJVKXBDRZMF-IBGZPJMESA-N	430.530	1.410	50	20	IDGD	
O=C(CCNC(=O)N1CCc2ccccc2C1)NNC(=O)c1cnn(-c2ccccc2)c1	733364284	JLGTVLHVTOEURI-UHFFFAOYSA-N	432.484	1.791	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNc1nccnc1Cl	734261463	BVVKSSGYEMKCEE-UHFFFAOYSA-N	425.898	1.227	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)NCc2n[nH]cc2Br)cc1	739022063	ZGIJWSHQPPOSNQ-JTQLQIEISA-N	426.271	1.869	50	20	IDGD	
CC(=NNC(=O)c1cc(N)cc([N+](=O)[O-])c1)c1cccc(S(=O)(=O)N2CCOCC2)c1	739412604	FIZCLCWMASDZKE-UHFFFAOYSA-N	447.473	1.352	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNS(=O)(=O)c2ccc(C#N)cc2[N+](=O)[O-])cc1	741204288	MCSHZZMMIMDXCE-LBPRGKRZSA-N	434.430	1.642	50	20	IDGD	
C[C@@H]1CCC[C@@H](C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)C1	741513868	DDCRZPVBGVAXRF-SJLPKXTDSA-N	437.562	1.614	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)[C@@H]1CCN(c2cccc(Cl)c2)C1=O	742075593	FGUZGPPQCBCSCK-AWEZNQCLSA-N	439.900	1.548	50	20	IDGD	
O=C(Cc1cccc2cccnc12)NNc1ccccc1S(=O)(=O)N1CCOCC1	744619414	NPTAGXRJBOFYOY-UHFFFAOYSA-N	426.498	1.942	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)c2ccc(N3C[C@H](C)O[C@H](C)C3)nc2)c1	744715917	VZXLLOBVBGGWMT-IYBDPMFKSA-N	426.473	1.622	50	20	IDGD	
Cc1nc(C)c(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)s1	745861486	MPGLTGVJQGGQMN-UHFFFAOYSA-N	437.547	1.689	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)N[C@H]2C[C@@H](C)N(c3ccccc3)C2=O)nc1	745882500	OYMMTINSHUYFIR-PBHICJAKSA-N	446.533	1.588	50	20	IDGD	
CN(C)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCN(Cc3ccccc3)CC2)c1	746012567	GJFHUIRYTKRHIP-UHFFFAOYSA-N	445.545	1.109	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN(C(=O)NC2CCCC2)C1)c1cc(Br)c[nH]1	746103595	QEEUAKUHASRLFM-LLVKDONJSA-N	426.315	1.902	50	20	IDGD	
CC(C)[C@H](NS(=O)(=O)c1ccc2ccccc2c1)C(=O)NNC(=O)Cc1ccncc1	747429783	TXNSOGLDRYKDBW-NRFANRHFSA-N	440.525	1.928	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)[C@H](C)N2C(=O)c3ccc(C)cc3C2=O)o1	747715688	KAVHIIROQIZRMJ-AWEZNQCLSA-N	426.473	1.876	50	20	IDGD	
CN(C)C(=O)CCCNC(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1	747984039	MOWIMXBTAZEKGU-OAQYLSRUSA-N	437.544	1.812	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cccc3nc(O)oc23)c1	751538760	NGJFIOQVXYMLJG-UHFFFAOYSA-N	432.458	1.639	50	20	IDGD	
CC1(CNC(=O)NNC(=O)C(=O)Nc2ccccn2)CCN(C(=O)OC(C)(C)C)CC1	753355454	KLHZYFPLRQNLKL-UHFFFAOYSA-N	434.497	1.388	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNS(=O)(=O)c1ccc(C(=O)O)c(C(F)(F)F)c1	754741015	NSQSXVKAQXBILF-UHFFFAOYSA-N	442.375	1.983	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@@H](CC(C)C)N1CCCCC1=O	755050434	ZDKKHEGTNKBUMY-OAHLLOKOSA-N	437.566	1.476	50	20	IDGD	
Cc1ccc(C)c(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c1	755320509	NOHHYHFQBLYKCR-UHFFFAOYSA-N	432.502	1.791	50	20	IDGD	
C[C@@H]1CN(S(=O)(=O)c2ccc(NC(=O)NNC(=O)c3cccnc3)cc2)C[C@@H](C)O1	755423106	NZVSGHXMOHCRET-ZIAGYGMSSA-N	433.490	1.346	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)Nc1ccccc1C(=O)N1CCOCC1	755622999	MVPVXKPWDRKJSZ-UHFFFAOYSA-N	443.416	1.299	50	20	IDGD	
COc1ccc(C(=O)N2CCOCC2)cc1NC(=O)NNC(=O)c1ccccc1OC	756258636	UFNVUFVUPNPYIL-UHFFFAOYSA-N	428.445	1.643	50	20	IDGD	
CS(=O)(=O)CCOc1cccc(NC(=O)NNC(=O)c2nnc(O)c3ccccc23)c1	756298383	WEEBRVKGJKRDQJ-UHFFFAOYSA-N	445.457	1.225	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)Nc2cccc(C(=O)NCCC(N)=O)c2)c2ccccc2n1	756392133	MANNATXRMGKPNK-UHFFFAOYSA-N	434.456	1.615	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)Nc1cccc(N2CCCNC2=O)c1	756791072	DLXXXSWZIIZVIQ-UHFFFAOYSA-N	435.444	1.964	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)C2(CNC(=O)OC(C)(C)C)CCCC2)C[C@@H](C)O1	757371204	MTIZBGJFPXLREO-HZPDHXFCSA-N	426.558	1.718	50	20	IDGD	
CCOC(=O)c1cnn2c(C(=O)NNC(=O)c3cc(OC)c(OC)c(OC)c3)ccnc12	757988726	BVZAOCJPHMIKDP-UHFFFAOYSA-N	443.416	1.007	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)C3(NC(C)=O)CCCCC3)n[nH]2)cc1OC	763149126	ONZORHRHNSOBHL-UHFFFAOYSA-N	429.477	1.694	50	20	IDGD	
CS(=O)(=O)c1c(F)cc(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3n2)cc1F	763449658	GAFZTOQYICZGKW-UHFFFAOYSA-N	448.407	1.316	50	20	IDGD	
CS(=O)(=O)c1ccccc1NC(=O)C(=O)NNC(=O)c1cc2ccccc2cc1O	763517327	GVLUENFMSQVDEN-UHFFFAOYSA-N	427.438	1.349	50	20	IDGD	
O=C(NNC(=O)c1cc2ccccc2cc1O)C(=O)Nc1ccc(-n2cncn2)c(F)c1	763528549	VHGBXXAIUYFQBK-UHFFFAOYSA-N	434.387	1.665	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)ccc1C(=O)NC(C)C	763570875	GIMWFYHTXKMNKU-GOSISDBHSA-N	440.456	1.059	50	20	IDGD	
COCCn1ccc2ccc(NC(=O)C(=O)NNC(=O)[C@H]3COc4ccccc4O3)cc21	763573593	TWVYTBFHUVBGKU-LJQANCHMSA-N	438.440	1.214	50	20	IDGD	
Cn1nc(C2CCCCC2)cc1NC(=O)C(=O)NNC(=O)[C@@H]1COc2ccccc2O1	763579459	VIRNYPXNBUPBNF-KRWDZBQOSA-N	427.461	1.394	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(-n3cccn3)c(Cl)c2)c1	763623641	DVBRLUXLEUBPKY-UHFFFAOYSA-N	427.848	1.999	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(N(C)C(C)C)c(F)c2)cc1	763662195	VRSSTVWTHYEVBZ-UHFFFAOYSA-N	432.452	1.844	50	20	IDGD	
CN(C)C(=O)c1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)COc1ccc(C#N)cc1	763680049	BTUGZIAPIFLTTB-UHFFFAOYSA-N	443.847	1.078	50	20	IDGD	
CNC(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)c1	763684354	KERNNXZWWAAXHY-UHFFFAOYSA-N	439.255	1.518	50	20	IDGD	
Cn1cc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccco3)nc3ccccc23)ccc1=O	763765196	YRXYVJCEISOTFQ-UHFFFAOYSA-N	431.408	1.593	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2cnc3c(c2)CCCC3)c2ccccc2c1=O	763787308	WYOXOYZQQNWBMM-UHFFFAOYSA-N	434.456	1.090	50	20	IDGD	
CC(C)c1nc2cc(NC(=O)C(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)ccc2o1	763791533	VBJSMTLMOHBCRT-UHFFFAOYSA-N	448.439	1.598	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)C(=O)Nc1cccc(N2CCCCC2)c1	763791589	XCPAXNWRULKLHE-UHFFFAOYSA-N	434.456	1.725	50	20	IDGD	
Cc1ccnc(Oc2ccc(NC(=O)C(=O)NNC(=O)COc3ccc(F)cc3)cc2)n1	763838914	WLMSSKKFFWJKPH-UHFFFAOYSA-N	439.403	1.881	50	20	IDGD	
O=C(Cc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1ccc(NC(=O)[C@H]2CCCO2)cc1	763932863	UBOUQHDYKGOEDE-QGZVFWFLSA-N	444.875	1.786	50	20	IDGD	
NC(=O)CCOc1ccc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCCCC3)cc1	763962512	ROQICDJLCTWBNW-UHFFFAOYSA-N	444.513	1.671	50	20	IDGD	
NC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2ccc(-c3ccc(F)cc3)s2)n1	763975730	MMQFCXUSKZYARW-UHFFFAOYSA-N	427.417	1.448	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1ccccc1OC(F)(F)F	764005539	AABODAQYGWAQAF-UHFFFAOYSA-N	425.319	1.756	50	20	IDGD	
O=C(NNC(=O)c1cccc(Br)c1)C(=O)Nc1ccc(Cn2cncn2)cc1	764063803	YFXVHRMGKYCZDH-UHFFFAOYSA-N	443.261	1.489	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cnn(Cc3ccc(Cl)cc3)c2)c(O)c1	764108628	CASYWPTZDHEALL-UHFFFAOYSA-N	427.848	1.999	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccccc2-n2ccnn2)o1	764139030	MUBATKGZMXKWIL-UHFFFAOYSA-N	425.449	1.102	50	20	IDGD	
O=C(COC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1)NNC(=O)c1cccs1	764173492	SQBXXGUUICSBQQ-HNNXBMFYSA-N	431.470	1.854	50	20	IDGD	
Cc1nn(-c2ccc(C#N)cc2)c(NC(=O)C(=O)NNC(=O)c2ccc(C#N)cc2)c1C	764177880	UBBJTJYWPXEHEM-UHFFFAOYSA-N	427.424	1.632	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)CCc2ccccc2)cccc1S(=O)(=O)NC1CC1	764185660	QMVWWKGDFQYJCE-UHFFFAOYSA-N	444.513	1.154	50	20	IDGD	
COC(=O)CSCc1cccc(NC(=O)C(=O)NNC(=O)c2cccc(C#N)c2)c1	764238493	STGSATMPHOIRQA-UHFFFAOYSA-N	426.454	1.364	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)C(=O)Nc1ccc(Br)cc1Br	764297743	XUUZCIXNMQMKHN-UHFFFAOYSA-N	445.071	1.643	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3sc(C)nc3C)n[nH]2)cc1OC	764378013	GGHWTJPNBWJKGX-UHFFFAOYSA-N	444.473	1.567	50	20	IDGD	
Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	764388094	PPXJEUMGHCHBLL-UHFFFAOYSA-N	426.364	1.832	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2cc(S(=O)(=O)N3CCCCC3)ccc2Cl)n[nH]1	765584060	VYTALJNKFMJAQW-UHFFFAOYSA-N	425.898	1.621	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)c2nn(-c3ccc(F)cc3)ccc2=O)n[nH]1	765595492	LRPTZMNJDYEKNK-UHFFFAOYSA-N	448.414	1.845	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)N1CC[C@@H]2[C@H](CCCN2Cc2ccccc2)C1	765731869	DDUNXDFOYSZQPG-RTBURBONSA-N	439.516	1.737	50	20	IDGD	
COCCOc1cccc(C(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)c1	765753097	AYZBGCPYIQPFFS-UHFFFAOYSA-N	440.544	1.599	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)c1cc(S(C)(=O)=O)ccc1Cl	767237501	UFXKRVQEXCJCKS-UHFFFAOYSA-N	438.889	1.599	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)[C@H]3CC(=O)N(CC(C)C)C3)n[nH]2)cc1OC	768275295	AKZLKUWRFWSKRW-AWEZNQCLSA-N	429.477	1.359	50	20	IDGD	
CCCc1nnc(S)n1CC(=O)NNC(=O)c1cc(-c2ccc(OC)c(OC)c2)[nH]n1	768277983	VANLUVNHQCHQMA-UHFFFAOYSA-N	445.505	1.388	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C[C@H]1CN(C(=O)OC(C)(C)C)CCO1	768635978	MIPZALSPHWGFOY-ZDUSSCGKSA-N	443.522	1.568	50	20	IDGD	
O=C(NNC(=O)c1cc(C(F)(F)F)ccc1Br)N[C@H]1CCS(=O)(=O)C1	770881695	KMNHFJRHSQXKES-QMMMGPOBSA-N	444.229	1.599	50	20	IDGD	
C[C@@H]1CCCC[C@@]12NC(=O)N(CC(=O)NNc1nc(O)c3cnn(C(C)(C)C)c3n1)C2=O	770958074	HMLSLBVHVMKEFX-BIBXISHDSA-N	444.496	1.231	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@@H]2C(=O)O[C@@H](C)C(=O)NNC(=O)CC(C)C)s1	771932908	ZJRYBFLFLJYMDD-UONOGXRCSA-N	445.563	1.335	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)NCCN(C)S(=O)(=O)c2cccs2)c1	772632005	VACBPGFFOAJMGI-UHFFFAOYSA-N	440.547	1.395	50	20	IDGD	
CC(C)(C)NS(=O)(=O)Cc1cccc(NC(=O)C(=O)NNc2ccccc2[N+](=O)[O-])c1	773650138	DCSFOMQBWLSWHB-UHFFFAOYSA-N	449.489	1.895	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ncc(Cl)cc2Cl)cc1-n1nnnc1C	773678561	WKERWLIDADLHEJ-UHFFFAOYSA-N	437.247	1.763	50	20	IDGD	
C[C@@H](NCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)c1cccc(N2CCCC2=O)c1	775279867	VFFHORMHTFBQRL-CQSZACIVSA-N	425.445	1.833	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1N1CCOCC1	776293667	YCWNKMPDYMWYNH-UHFFFAOYSA-N	444.444	1.670	50	20	IDGD	
CCc1ccccc1S(=O)(=O)NNC(=O)CN1CCN(Cc2ccc(C)cc2)CC1	777640317	TUYFGXLGCLGIGY-UHFFFAOYSA-N	430.574	1.685	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)N2CCC[C@@H]2C(=O)NNc2cc(Cl)ccn2)o1	778450948	CZZHJXDFCQDQLQ-GFCCVEGCSA-N	442.881	1.801	50	20	IDGD	
N#Cc1ccc(N2CCC[C@H](NC(=O)NNC(=O)c3cc(Br)c[nH]3)C2=O)cc1	779968121	ONEVCJFNNYPONJ-AWEZNQCLSA-N	445.277	1.788	50	20	IDGD	
COc1ccc(NNC(=O)NCc2ccccc2OCC(=O)NC[C@@H]2CCCO2)nc1	780974566	RUZJZYDVBSIBQV-KRWDZBQOSA-N	429.477	1.591	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)cc1)C(=O)Nc1ccc(OCC(F)(F)C(F)F)nc1	782832061	JZZMORBHHDUOQF-UHFFFAOYSA-N	430.314	1.466	50	20	IDGD	
CN(C)C(=O)COc1cccc(NC(=O)C(=O)NNc2ccc(Cl)cc2[N+](=O)[O-])c1	783289700	RZXWFCBIQUUXFQ-UHFFFAOYSA-N	435.824	1.797	50	20	IDGD	
O=C(NNc1ccc(F)cc1F)C(=O)Nc1ccc(F)c(S(=O)(=O)NC2CC2)c1	783346853	AJJHBJDAOCWPBN-UHFFFAOYSA-N	428.392	1.626	50	20	IDGD	
Cc1c(Br)cccc1NC(=O)C(=O)NNC(=O)Cc1cn2ccccc2n1	785066455	AVSCYXQGHOTJAY-UHFFFAOYSA-N	430.262	1.734	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)C(=O)Nc1cc(Br)c(F)cc1F	786415141	YAEIDOAFSLMQRZ-UHFFFAOYSA-N	442.172	1.856	50	20	IDGD	
COC(=O)CCc1cccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(C)cc3)[nH]n2)c1	786417132	LWSLGDDDUFKYGO-UHFFFAOYSA-N	449.467	1.890	50	20	IDGD	
CCC1(CC)Oc2ccc(NC(=O)C(=O)NNC(=O)CNC(=O)c3ccco3)cc2O1	787899975	XFSFSFUBSAHMKW-UHFFFAOYSA-N	430.417	1.083	50	20	IDGD	
Cc1ccnc(-n2nccc2NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c1	788301341	YORSSFGZYDQOSD-UHFFFAOYSA-N	448.531	1.941	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCN(c3ccccc3F)C[C@H]2C)cc1OC	789497132	PEEPSPSFWVZWTN-OAHLLOKOSA-N	430.480	1.815	50	20	IDGD	
Cc1noc(-c2ccc(C(F)(F)F)cc2NC(=O)C(=O)NNC(=O)c2ccccn2)n1	789730523	UJCJPIOVFUXPER-UHFFFAOYSA-N	434.334	1.859	50	20	IDGD	
CCCCn1c(N)c(N(C)C(=O)/C(C#N)=C\c2cc(C)n(CCOC)c2C)c(O)nc1=O	790044964	SQBIZUFLFSEORL-ATVHPVEESA-N	442.520	1.966	50	20	IDGD	
Cc1ccc(C(=O)NNc2cccc(F)c2[N+](=O)[O-])cc1S(=O)(=O)N1CCOCC1	790590525	CUZZJIJRKRGUFL-UHFFFAOYSA-N	438.437	1.820	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NC[C@H]2N(C)CCCC2(C)C)nc1	790896481	OVYIXHWVFUSVMI-MRXNPFEDSA-N	426.587	1.859	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1cc([C@@H]2CCCOC2)nn1C	790952816	WAVGRRSVDUJSJA-CHWSQXEVSA-N	433.440	1.007	50	20	IDGD	
CC(C)(C)OC(=O)Nc1ccc(CC(=O)NNC(=O)CNC(=O)c2cccs2)nc1	791557009	QZKTYHMIDIZHKO-UHFFFAOYSA-N	433.490	1.610	50	20	IDGD	
CCc1c(NC(=O)C(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)cnn1C(CC)CC	792285013	CWBDKHXZFPIRGK-UHFFFAOYSA-N	432.437	1.820	50	20	IDGD	
CC(C)(C)OC(=O)CCc1cccc(NC(=O)C(=O)NN[C@]2(C)CCS(=O)(=O)C2)c1	792353815	QBNOZQZDKNLSDE-HXUWFJFHSA-N	439.534	1.097	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(N3C(=O)CCCC3=O)c2)c1	792355307	SBFMSVDBVWZJEQ-UHFFFAOYSA-N	438.440	1.203	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@@H](C)c2ccc3c(c2)OCO3)cc1	794183144	QYWSRCMIOLNMNZ-AWEZNQCLSA-N	433.486	1.295	50	20	IDGD	
Cc1cccc(C(=O)NNS(=O)(=O)c2cc3nc(O)[nH]c3cc2Br)n1	794599068	APYRIOUEGGWPED-UHFFFAOYSA-N	426.252	1.358	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cscc2Br)c1	794763835	LFDOIKNIIPKCHV-UHFFFAOYSA-N	432.321	1.836	50	20	IDGD	
COc1c([N+](=O)[O-])cccc1S(=O)(=O)NNC(=O)CCCNC(=O)OC(C)(C)C	794869132	GYMKLSPDXUHWKB-UHFFFAOYSA-N	432.455	1.218	50	20	IDGD	
CO[C@H]1CCC[C@@H](CC(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)C1	795107818	FSXJIBBDRWRGMX-CVEARBPZSA-N	425.555	1.056	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C[C@@H](c1ccccc1)N1CCOC1=O	795181091	IUGVMMHPQNJEGF-KRWDZBQOSA-N	432.502	1.964	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2ccc(OC(C)C)c(C(N)=O)c2)cc1	797000438	CTIAHMFJEGZZTH-UHFFFAOYSA-N	442.472	1.300	50	20	IDGD	
Cc1ccc(N2CCOCC2)cc1NC(=O)C(=O)NNC(=O)c1cccc(N(C)C)c1	797534966	IMMOJAUPFLGYQV-UHFFFAOYSA-N	425.489	1.297	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNS(=O)(=O)c1ccc(Cl)cc1Br	799122196	TWOGVFVJMPUSJX-UHFFFAOYSA-N	436.671	1.435	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)OCC(=O)N3C)c2ccccc2n1	799256901	AXFKVPZJZFSVQI-UHFFFAOYSA-N	433.424	1.298	50	20	IDGD	
Cc1c(I)cc([N+](=O)[O-])cc1C(=O)NNc1ncnc2[nH]cnc12	801622041	KUTJFBUWQKDMGK-UHFFFAOYSA-N	439.173	1.931	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)N[C@H](C)CCNS(=O)(=O)c1ccccc1	801798380	UQSWSRRXVPSVEV-OAHLLOKOSA-N	434.518	1.325	50	20	IDGD	
CCS(=O)(=O)N[C@H](CCSC)C(=O)NNC(=O)Nc1ccc(OC(F)F)cc1	802046119	ALPCGIAVYINAFS-GFCCVEGCSA-N	440.494	1.502	50	20	IDGD	
CC(C)[C@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	802064797	AXLGDBVWQMHIME-AWEZNQCLSA-N	428.511	1.792	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)CCc2nc(O)c3cnn(C)c3n2)c(OC)cc1Cl	802082992	VNRDDTCCSOYXGU-UHFFFAOYSA-N	449.855	1.525	50	20	IDGD	
O=C(NCc1ccncc1OCc1ccccc1)NNC(=O)c1ccc(-n2cnnn2)cc1	804868317	CPNMHLPZKSZVAC-UHFFFAOYSA-N	444.455	1.781	50	20	IDGD	
CNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)Cc2ccccc2C)c1Br	806979934	GVBRDRVLRIMYJM-UHFFFAOYSA-N	447.289	1.446	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCC[C@@H](C)C2)cc1	807369310	RTTDXTHLEHPEQC-OAHLLOKOSA-N	441.550	1.657	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C2(S(=O)(=O)c3ccccc3)CCOCC2)cc1	809145236	OLPHQKACMPYFRT-UHFFFAOYSA-N	432.498	1.544	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCC(=O)NNc2ccc(Cl)nn2)cc1OCC	810419549	FDDZTWKLWRVBTF-UHFFFAOYSA-N	429.886	1.349	50	20	IDGD	
C[C@@H](C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1)N1CCN(c2ccc(F)cc2)CC1	812727842	YKKDLVDDQDAXLC-INIZCTEOSA-N	449.552	1.730	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)Nc2ccn(CCc3ccncc3)n2)cc1	812947610	RSYFNBKTWAONPI-UHFFFAOYSA-N	429.506	1.920	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)c1c(I)cnn1C	814101509	ZTUCHAYTBCMUJO-UHFFFAOYSA-N	434.621	1.762	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)c2cnc3c(c2)c(O)nc(=O)n3C)c1	818745319	HFMNHTRJZQFJRO-UHFFFAOYSA-N	448.233	1.340	50	20	IDGD	
C[C@@H]1CC(C)(C)C[C@]2(C1)NC(=O)N(CC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)C2=O	912764471	QHCIEWXWVNCWPW-ODXCJYRJSA-N	431.449	1.493	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)Cn2ncc3ccccc3c2=O)c2ccccc2c1=O	912988196	HFAKDGVHXWXARY-UHFFFAOYSA-N	432.440	1.149	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C2CCN(S(=O)(=O)/C=C\c3ccccc3)CC2)n1	913025842	HCOISCGHPCRQQG-RAXLEYEMSA-N	445.545	1.360	50	20	IDGD	
O=C(CCNS(=O)(=O)c1cccc(Br)c1)NNC(=O)NC1CCCCC1	913451051	JPSNUPWJCYXIHT-UHFFFAOYSA-N	447.355	1.781	50	20	IDGD	
CCOC(=O)N[C@@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)C(C)C	915062772	DRGWWKHOMBHDSP-MRXNPFEDSA-N	440.522	1.003	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCc2ccc(CN3CCN(C)CC3)cc2)cc1OC	916387994	PGKQXOFMHFQIMS-UHFFFAOYSA-N	441.532	1.595	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)COc1ccccc1[N+](=O)[O-])N1CCc2sccc2C1	916620018	LIAKBUBKOORWSP-CYBMUJFWSA-N	433.490	1.812	50	20	IDGD	
COc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NNC(=O)Cc2ccc3ccccc3c2)cc1	917195709	WLDAUTQEHRNMNW-HNNXBMFYSA-N	441.509	1.905	50	20	IDGD	
O=C(NNc1ccc(Cl)cc1[N+](=O)[O-])c1ccc(S(=O)(=O)N2CCOCC2)o1	917215944	MASAEHJQNQCAIY-UHFFFAOYSA-N	430.826	1.619	50	20	IDGD	
Cc1cc(O[C@H](C)C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)ccc1Cl	917314104	YYTNTOCWCGNTIK-FZKQIMNGSA-N	448.859	1.946	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2cccc(NC(=O)NC3CC3)c2)c2ccccc2c1=O	917515417	JCIFIOCTISCYPH-UHFFFAOYSA-N	434.456	1.775	50	20	IDGD	
CC(C)[C@@H](CNC(=O)NNC(=O)c1ccc(F)cc1Br)N1CCN(C)CC1	918202099	IXFAJQCPIPNRPD-MRXNPFEDSA-N	444.349	1.804	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)[C@H]2CCCN(S(=O)(=O)c3ccccc3)C2)cc1	919834302	VYBOXECJVJPMDI-SFHVURJKSA-N	445.541	1.876	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNS(=O)(=O)c2c[nH]c3ncccc23)cc1	919954644	PDHGAENNKAAPPO-UHFFFAOYSA-N	443.514	1.607	50	20	IDGD	
CS(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)c2ccc3ccccc3c2)c(F)c1	919958766	JBLZWESZQFOWIO-UHFFFAOYSA-N	437.474	1.974	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)c2ccc3c(c2)CCC3)c1	920400810	SMHCNHAONBBJGF-UHFFFAOYSA-N	443.525	1.850	50	20	IDGD	
Cc1ccc([C@]2(C)NC(=O)N(CC(=O)NNC(=O)Cc3nc4ccccc4n3C)C2=O)cc1	920455556	IDRRHDYXPWZFMJ-QHCPKHFHSA-N	448.483	1.039	50	20	IDGD	
CC(=NNC(=O)CCN1CCC(C)CC1)c1ccc(S(=O)(=O)N2CCNCC2)cc1	1115832744	JFDPMTBGIIVQMQ-UHFFFAOYSA-N	435.594	1.243	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)C2=NN(c3ccccc3)C(=O)CC2)CC1	1116084212	DZUQVYFJDPTHNB-UHFFFAOYSA-N	443.504	1.964	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCCC(=O)N2CCC[C@@H](C)C2)nc1	1123723456	RRFDIIOVQQQOJL-CQSZACIVSA-N	426.543	1.043	50	20	IDGD	
Nc1cnnc(NNC(=O)CCc2ccc(S(=O)(=O)N3CCCCC3)cc2)c1Cl	1319302075	BNDMPJCOSAAUFP-UHFFFAOYSA-N	438.941	1.963	50	20	IDGD	
COc1cc(Cl)c(Br)cc1C(=O)NNC(=O)CNC(=O)c1cccnc1	1320747408	JOFGKFTYZVNHNE-UHFFFAOYSA-N	441.669	1.697	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2cc(C(=O)NNc3ccn(C)n3)ccc2Cl)C[C@H](C)O1	1321105205	MMMQVODHYJLMQS-RYUDHWBXSA-N	427.914	1.628	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)Cn2nc3n(c2=O)CCCCC3)cc1Cl	1321307008	NYEMAWHLBMZQAT-UHFFFAOYSA-N	438.872	1.295	50	20	IDGD	
Cc1cc(C=NNC(=O)c2cc(S(=O)(=O)NCc3ccccc3)ccc2O)ncn1	1326191954	CUAWQNKRNUNIHE-UHFFFAOYSA-N	425.470	1.733	50	20	IDGD	
O=C(c1c[nH]c2cc(Cl)ccc12)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1777787643	SPOYRKNPYRBGBJ-APWZRJJASA-N	426.300	1.865	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Cl)C2	1778090953	IVTRKARLUQEXTC-BYZSLHIBSA-N	441.891	1.169	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4c(c3)CC(=O)N4)C2)C1	1778391852	DDHQYCXPHYKTIC-HXPMCKFVSA-N	436.306	1.408	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4c(c3)CC(=O)N4)C2)C1	1778394117	YALSXXGHNQQYBU-PMACEKPBSA-N	440.327	1.861	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2)c1ccc2c(c1)CCCC2=O	1778646036	IMISWRVJZNQRBG-MIZPHKNDSA-N	448.947	1.933	50	20	IDGD	
Cc1nc[nH]c1CSCC(=O)N1CC[C@@]2(CN(C(=O)CCBr)CCO2)C1	1778908903	JOTZITYPXVSCSD-KRWDZBQOSA-N	445.383	1.566	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(=O)Nc1cccnc1)C2	1779545723	XOPGUJVPSKKLHS-DYESRHJHSA-N	448.596	1.386	50	20	IDGD	
CN(C)c1ccc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)cn1	1779762864	CBWYMYOSVXFAFM-MOPGFXCFSA-N	429.348	1.827	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(Cl)Cl)C2)c1nn[nH]c1C(F)(F)F	1780200002	CRQBZAGZNUVRCY-XLKFXECMSA-N	444.241	1.755	50	20	IDGD	
CN1CCC[C@@H](C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)CO[Si](C)(C)C)C3)C1	1780574013	NSBBFLYFEAAKIR-DBXWQHBBSA-N	425.646	1.694	50	20	IDGD	
Cc1nc2ncccn2c1C(=O)N1CCO[C@]2(CCN(C(=O)[C@@](C)(Cl)CCl)C2)C1	1781229302	FYILOIQNWJEMQP-RBUKOAKNSA-N	440.331	1.718	50	20	IDGD	
O=C([C@H](F)Br)N1CC[C@@]2(C1)CN(C(=O)[C@H]1CNc3ccccc31)CCO2	1781331058	KHGZSAWWRRAQQF-DHSIGJKJSA-N	426.286	1.716	50	20	IDGD	
O=C(c1cccn2nccc12)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781332003	CQNXQEBCULFUNN-RHSMWYFYSA-N	425.258	1.468	50	20	IDGD	
O=C(c1ccn2cncc2c1)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781332192	VMVMCPROELDVAJ-YOEHRIQHSA-N	425.258	1.468	50	20	IDGD	
CCOC(=O)C1(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](C)Br)C2)CC1	1782002033	LAOIOERXZUALEC-PMUMKWKESA-N	445.354	1.627	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@]2(C1)CN(C(=O)c1ncon1)CCO2	1782867948	WCJTZOXVFQKIBW-FZXOMJPYSA-N	429.383	1.398	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cccc(OC)n3)CCO2)C1	1783344809	UIEZVCFLPWIDJL-FZKQIMNGSA-N	426.311	1.707	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](C)Br)C3)C2)nn1C(F)F	1783539223	ZIYRELXQRPCQLA-BDJLRTHQSA-N	435.269	1.814	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cnc4c(Cl)cccn34)CCO2)C1	1783876328	UUARZZKXYBBHKN-IFXJQAMLSA-N	441.315	1.685	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cccc(-c4cnccn4)c3)CCO2)C1	1783883673	XTYRVQSYCNSYRM-AVRDEDQJSA-N	444.919	1.841	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4nccn4c3)C[C@@H]21	1783966689	JVCXLIYXMIKWNO-HJWJTTGWSA-N	449.349	1.959	50	20	IDGD	
O=C(CSc1ccc(F)cc1F)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21	1784414795	ZVFCYOMBFSYNOT-MZGVZZPPSA-N	448.919	1.636	50	20	IDGD	
C#CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@@]2(CN(C(=O)C(Cl)Cl)CCO2)C1	1785575769	CMRJNKNYKZDGBR-YJYMSZOUSA-N	448.347	1.537	50	20	IDGD	
Cc1onc(-c2ccccc2)c1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21	1785894278	OIURCEQNJOIXAE-FJIDUMEYSA-N	447.919	1.843	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(F)cn3)[C@H]2C1	1786211683	IVMIYOFNEOKLLN-DUPGQFARSA-N	428.302	1.845	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3nc(OC)ccc3[N+](=O)[O-])[C@H]2C1	1787752673	PSDBELNZSQFNSB-XPCVCDNBSA-N	440.884	1.609	50	20	IDGD	
Cc1cc(C)n(CC(=O)NC2(c3ccc(NC(=O)c4cccc(B(O)O)c4)cc3)CCC2)n1	1788144897	ADXLPNVXAPOHCT-UHFFFAOYSA-N	446.316	1.628	50	20	IDGD	
CC(C)[C@H](O)C(=O)NC1(c2ccc(NC(=O)c3cnccc3C(=O)NN)cc2)CCC1	1789519781	KMPYUANVQXQUKO-SFHVURJKSA-N	425.489	1.450	50	20	IDGD	
CC(C)NCCC(=O)NC1(c2ccc(NC(=O)c3cnccc3C(=O)NN)cc2)CCC1	1789522646	LRBDTLBAHFELAF-UHFFFAOYSA-N	438.532	1.821	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(NC(C)=O)c(O)c3)C[C@@H]21	1789864922	DVAVOFPOIYASQF-FPXQBCRKSA-N	437.924	1.961	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccnc3S)C[C@@H]21)[C@H](F)Br	1789920927	ICNZLHSXDPOEIL-BQUFFADESA-N	432.315	1.654	50	20	IDGD	
Cc1nc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]3C2)c(C)s1	1789922397	MBZVLBHRUGLYJC-LMRQPLJMSA-N	448.358	1.973	50	20	IDGD	
NC(=O)c1ccccc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21	1790127858	YJSKOSMCXSSREN-RCBQFDQVSA-N	438.322	1.164	50	20	IDGD	
CCOC(=O)C1(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)CBr)C[C@@H]32)CC1	1790719380	NMAADYZOKJJFCJ-AJNGGQMLSA-N	445.354	1.340	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C[C@H](N)c3cccnc3)C[C@@H]21	1791057466	DEGZDFQNHXZGDK-VFTHGPRRSA-N	439.354	1.235	50	20	IDGD	
Cn1cc(CC(=O)Nc2ccc(C3(NC(=O)c4cccc(B(O)O)c4)CCC3)cc2)cn1	1791905117	RJOVORIJYQELAW-UHFFFAOYSA-N	432.289	1.090	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CC[C@H]1CNc3ccccc3C1)C2)[C@H](O)CCl	1792977111	QNDYGMSYOWASHT-OWQBGRFZSA-N	435.952	1.240	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H]2C[C@H]2C[C@@H]1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCl	1793117664	XDXDPANEWCGADG-FVSVBAFRSA-N	441.956	1.622	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnoc1C1CC1	1795007741	JRXUFUHRWCLAFT-NEBZKDRISA-N	426.311	1.929	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CCc3ccoc3C1)C2	1795113336	YQMBUPASOVWCAF-ZXFNITATSA-N	425.323	1.759	50	20	IDGD	
COc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCBr)c(OC)c1	1795114869	HBOWQSNUVIWVNB-IVWMJMPLSA-N	441.322	1.692	50	20	IDGD	
CN(CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccon1)NC(=O)NCc1ccccc1	1795303004	FAFXLTLDMKUIMW-BCDXTJNWSA-N	440.504	1.273	50	20	IDGD	
COc1ccc([C@@H](C)C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)cc1	1796189694	PIPAQSSWFYMMIV-HUJKARHJSA-N	436.317	1.431	50	20	IDGD	
Cc1ncc(/C=C/C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)s1	1796190502	GHVNVPFMXQKRNN-VOHBNYOCSA-N	425.319	1.097	50	20	IDGD	
COc1c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)ccc(F)c1F	1796192919	BWZMVYNMQPGSHH-MUJYYYPQSA-N	444.243	1.219	50	20	IDGD	
O=C1CSc2cc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)C(Cl)Cl)C4)ccc2N1	1796293840	LNDZCMMAICNCHL-QHBPRCKVSA-N	444.340	1.738	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cn1ccnn1	1796329573	SPEIXYDCDJPPAF-XGUBFFRZSA-N	440.932	1.048	50	20	IDGD	
Cn1cnc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)C(Cl)Cl)C3)c1C(F)(F)F	1796606350	OJTIYFCRXWFBCB-AYMMMOKOSA-N	429.226	1.446	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@]2(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)[C@H](F)Cl)C[C@H]1CO2	1796808670	RTBSKHGFOWYFME-HKQPUQOZSA-N	445.919	1.937	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1Cc2ccccc2O1	1797226725	HFMXMQPTDCQTOS-BXNDMCELSA-N	427.328	1.816	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C#CC1(O)CCCCC1	1797781275	SPURFOPVGZYRBQ-CUSZFKRNSA-N	441.366	1.306	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CC1Cc3ccccc3C1)C2	1798442781	VDNKMAACUWCSLC-ACDBMABISA-N	447.539	1.742	50	20	IDGD	
COc1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)ccc1F	1798443541	GRSZKLJHDJYNAM-QDMKHBRRSA-N	441.463	1.398	50	20	IDGD	
C[C@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CO[Si](C)(C)C)[C@@H]1SC(=N)NC1=O	1798625924	RSRRKROTGXHWGN-AIUMHDJVSA-N	426.615	1.279	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1CCN(c2ccccn2)CC1	1799089147	KDHKRBGBNJHVMB-AJYBTWMASA-N	434.968	1.905	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(=O)nc2cccnn12)[C@H](F)Br	1799189164	HWHRNCIEQSBQOO-DDIVZENXSA-N	438.257	1.032	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3cn[nH]c3cn1)C2	1799276747	PPLYFKFMGCBWNI-TYYYEBLRSA-N	426.304	1.397	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)c1cc(Cl)c(F)c(Cl)c1	1799760039	GEVMFVUYQYFYDY-FJHTZYQYSA-N	439.698	1.935	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(F)nc1C)C2	1800641873	LCQYDUCPOQNTOC-FAXLKDOZSA-N	428.302	1.906	50	20	IDGD	
CC[C@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](C)NS(=O)(=O)CC)C2	1801798409	HLIOWXCXBRXOLS-HPCHECBXSA-N	438.388	1.126	50	20	IDGD	
CC[C@H](NC(C)=O)C(=O)N1CC[C@H](CNC(=O)CCBr)[C@H]1c1cccnc1	1806337431	HUVITGLUMAZQNB-SOLBZPMBSA-N	439.354	1.787	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2nccnc2C(N)=O)[C@@H]1c1cccnc1	1808263764	POUFPSWDWGGQLX-GRDNDAEWSA-N	430.896	1.308	50	20	IDGD	
O=C(COC(=O)C(F)(F)F)NC[C@@H]1CCN(C(=O)C(Cl)Cl)[C@H]1c1cccnc1	1810190891	ZNDZONVIPGIODV-JQWIXIFHSA-N	442.221	1.997	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@H]1CCN(C(=O)CCS(C)(=O)=O)[C@H]1c1cccnc1	1810548109	NMTJTLNCZHOHJQ-APWZRJJASA-N	441.626	1.374	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@@H](CNC(=O)c2cnc(O)[nH]2)[C@H]1c1cccnc1	1810942133	BDTPGUKPRYAHBG-OSAQELSMSA-N	436.310	1.861	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2cc3cccnn3n2)[C@@H]1c1cccnc1	1811269538	GLRIPCDGBHBIBO-AYBZRNKSSA-N	442.907	1.698	50	20	IDGD	
CCCNC(=O)CCC(=O)N1CC[C@H](CNC(=O)[C@@H](Cl)COC)[C@@H]1c1cccnc1	1813028702	UGSNOOPZGPGJTD-UWVAXJGDSA-N	438.956	1.648	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)Cc2c(C)nn(C)c2C)[C@@H]1c1cccnc1	1813421931	SVCBFMYZTITXIE-LMNJBCLMSA-N	447.967	1.934	50	20	IDGD	
O=C(CCC(F)(F)F)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(B(O)O)cc1)CC2	1814431817	CBWWNOIBLTXLIW-LBPRGKRZSA-N	441.240	1.391	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)C(F)(F)C(F)(F)C(=O)O)[nH]n1)[C@@H](O)CCl	1814867551	NICBXWXUZLWKGF-BDAKNGLRSA-N	444.769	1.357	50	20	IDGD	
CCS(=O)(=O)CC(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](C)CBr)[nH]n1	1815171713	QWUIQSSBTILMPX-AAEUAGOBSA-N	449.371	1.868	50	20	IDGD	
CN[C@H](CC(=O)Nc1cc([C@@H]2CCCCN2C(=O)CO[Si](C)(C)C)[nH]n1)C(=O)O	1817366945	DDZLZQVKNKLINR-KGLIPLIRSA-N	425.562	1.316	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)C2CC(F)(F)C2)[nH]n1)c1ccc(B(O)O)cc1	1817470436	RAECKJBXAHYUJG-INIZCTEOSA-N	432.236	1.441	50	20	IDGD	
C[Si](C)(C)OCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)C(=O)Nc1cccnc1)CC2	1820165573	KCUFDVDKUCMXSB-LBPRGKRZSA-N	447.593	1.940	50	20	IDGD	
C[C@H](C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1ccccn1	1822899362	SZFIJQOXUNNHIY-MGPUTAFESA-N	447.304	1.594	50	20	IDGD	
CC(=O)N/C(C)=C/C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1	1823008826	HROUCFWFAARHNT-RGQOULRXSA-N	433.303	1.786	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](O)CCl)CC2)c1ccccc1-n1nccn1	1823546202	FLTWBBIYAAMHRR-NHYWBVRUSA-N	446.920	1.549	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CNCP(=O)(O)O)CC1	1824010693	FWGQWFUUNNVADP-HNNXBMFYSA-N	437.905	1.596	50	20	IDGD	
CC(=O)NCCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](C)CBr)CC2	1825232368	NUNLNJUZSRKTKR-MWLCHTKSSA-N	431.356	1.612	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)COc1cccnn1)CC2	1826009069	LLHWCODVUPABTP-QWRGUYRKSA-N	425.898	1.178	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)CSc3nc[nH]n3)sc2C1	1826674350	BYQMQBACGFSBKW-SFYZADRCSA-N	445.368	1.749	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC([C@@H]2CCCCN2C(=O)CN2CCOCC2)CC1	1826716866	YBUKTXLDYVCPAN-IBGZPJMESA-N	425.646	1.790	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)COc3cccnn3)sc2C1	1826765060	HXJCZIAOAWMASX-NXEZZACHSA-N	440.323	1.708	50	20	IDGD	
O=C(c1cccc(F)n1)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827052450	ZUODCPLPLOCCPA-HXUWFJFHSA-N	439.296	1.448	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H]3CCOC3)sc2C1	1827168672	DTNZWRUOYBFDIU-PTFKFJSFSA-N	444.517	1.226	50	20	IDGD	
CN1CCN(CC(=O)N2CCCC[C@@H]2C2CCN(C(=O)CO[Si](C)(C)C)CC2)CC1	1828442820	FHMLKIRTQNNNHM-HXUWFJFHSA-N	438.689	1.705	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1CCCCN1C)CCO2	1830775303	LPHKCQCUCYBQNY-TXPKVOOTSA-N	446.386	1.101	50	20	IDGD	
C=CCOCCCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1831412077	CBTSSZXPTFHBOM-NVXWUHKLSA-N	437.306	1.116	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1Cc3ccccc3CN1C)CCO2	1832472838	SZAZNPDPCXMFFJ-MIZPHKNDSA-N	449.979	1.517	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)C(C)(C)C)CC2)CC1	1833282762	HJRXLXAKIHQKAA-PBHICJAKSA-N	446.430	1.996	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3ccc(F)cc3F)CC2)CC1)[C@@H](O)CCl	1833313991	YKCBUSCQDBXRJV-SFHVURJKSA-N	429.895	1.750	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)CSc3ncccn3)CC2)CC1)[C@H](F)Cl	1835080625	ZYNWKOWEFWBPEG-INIZCTEOSA-N	429.949	1.675	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)C3(C)CC3)CC2)CC1	1835118145	ATHZJYJHPGNALA-WGOQTCKBSA-N	442.564	1.492	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cnn4ccccc34)CC2)CC1	1835309363	HEMHDCVWQVSUBP-LJQANCHMSA-N	447.967	1.773	50	20	IDGD	
CC1=C(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](C)CBr)C3)C2)CCO1	1836268279	OKAXVIUUBZVFOE-UGSOOPFHSA-N	431.327	1.168	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cnccc1F)CCO2	1836316181	QOYUPXRANGDVMZ-IBGZPJMESA-N	425.533	1.142	50	20	IDGD	
Cc1nc2ncccn2c1C(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836716989	CIQCDRJUVIKIPB-QGZVFWFLSA-N	449.939	1.250	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)COc3cccnc3)CC2)CC1	1837114481	UZDCUPPDZXMFKA-LJQANCHMSA-N	439.940	1.713	50	20	IDGD	
C[Si](C)(C)C#CCCCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1	1837426997	ISXNTUIYACRJQV-PXNSSMCTSA-N	445.032	1.094	50	20	IDGD	
C[C@H](Nc1cnccn1)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](F)Cl)CC2)CC1	1838082065	DDFVJLFAINDDCE-SUMWQHHRSA-N	427.908	1.810	50	20	IDGD	
O=C(Cc1ccc(F)cc1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839198718	APEDKLWMZBKZRS-AEFFLSMTSA-N	447.276	1.515	50	20	IDGD	
O=C(c1ccoc1Cl)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839201652	FBXIKBRJGOCQGQ-NHYWBVRUSA-N	439.665	1.694	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(O)c([N+](=O)[O-])c3)CCO2)C1	1839274598	HKILQNFAIYULOG-AUUYWEPGSA-N	441.868	1.388	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3c(C)cccc3Cl)CCO2)C1	1839341652	GEULRFMZZURZAN-UZLBHIALSA-N	445.343	1.972	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccncc3O)C2)C1	1839964837	GBONKRWUUPTZIO-KBXCAEBGSA-N	442.310	1.031	50	20	IDGD	
CCc1ccnc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)c1	1840031731	APFHRIKLGOPVGS-KUHUBIRLSA-N	440.338	1.497	50	20	IDGD	
CCc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)no1	1840033836	SDIQXFPDYJKZLG-SJCJKPOMSA-N	430.299	1.090	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H](C)CC(C)=O)CCO2)C1	1840133019	RWWKPZRILQZVAT-YEWWUXTCSA-N	433.343	1.232	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCCC(F)(F)F)C2)C1	1840151181	XCFSDSKTHXDOAJ-BBRMVZONSA-N	430.851	1.429	50	20	IDGD	
Cc1cccc(/C=C/C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)n1	1840187042	IPTKAULYJJYYKZ-UEKDZROGSA-N	428.316	1.663	50	20	IDGD	
C[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1)n1cccc1	1840353649	PCVIFUJFBBXMQG-MNEFBYGVSA-N	432.348	1.742	50	20	IDGD	
C=C[C@H](O)C(C)(C)C(=O)N1CC2(CCCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C1	1841924718	UVZMZXAUUKSRAC-GJZGRUSLSA-N	443.972	1.895	50	20	IDGD	
Cc1ccc(S/C=C/C(=O)N2CC3(CCCN3C(=O)c3ccc(B(O)O)cc3)C2)cc1	1843011469	HGVLUIGCAARSNW-SDNWHVSQSA-N	436.342	1.798	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)c1cc(C)nn1-c1cccc(=O)n1C)C2	1845164564	NODKMKUWFRFFGX-HNNXBMFYSA-N	431.924	1.714	50	20	IDGD	
O=C(CCS(=O)(=O)c1ccccc1)N1CC2(CCCN2C(=O)[C@H](F)Br)C1	1845216667	DGKOGKSZLCAJOG-HNNXBMFYSA-N	447.326	1.744	50	20	IDGD	
O=C([C@@H](O)CCl)N1CC2(CCCN2C(=O)c2cnc3cc(C(F)(F)F)ccn23)C1	1845716849	QXOMALCRBXEXHF-ZDUSSCGKSA-N	430.814	1.770	50	20	IDGD	
COCCOCCOCCC(=O)N1CCCC12CN(C(=O)[C@@](C)(Cl)CCl)C2	1846249175	IFPSKHYBMPPGLK-KRWDZBQOSA-N	425.353	1.496	50	20	IDGD	
CCc1c(Br)c(C(=O)N2CC3(CCCN3C(=O)[C@@H](Cl)COC)C2)nn1C	1846361575	BMUYQOSBZVBVAP-NSHDSACASA-N	447.761	1.816	50	20	IDGD	
CCOC(=O)N1CCC(C(=O)N2CCCC23CN(C(=O)[C@H](F)Br)C3)CC1	1846978815	XIEGCRQALICQLG-ZDUSSCGKSA-N	434.306	1.749	50	20	IDGD	
Cn1cc(NC(=O)OC(C)(C)C)cc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl	1847556295	HXMGEGHMGTUSHV-DZKIICNBSA-N	440.928	1.787	50	20	IDGD	
O=C(c1cccc(Br)c1[N+](=O)[O-])N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl	1847562566	YRODOYZJGXJNGD-AVGNSLFASA-N	446.685	1.772	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H]1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](F)Br	1847959274	XBQZZVAAVCSUAL-CYDGBPFRSA-N	434.306	1.888	50	20	IDGD	
C[C@H](SCC(=O)Nc1ccc(F)cc1)C(=O)NNC(=O)[C@@H]1COc2ccccc2O1	23712880	CVURKEQKTNKYST-SJCJKPOMSA-N	433.461	1.873	50	20	IDGD	
O=C(CCC(=O)N1CC(=O)Nc2ccccc21)NNC(=O)c1cc(Br)c[nH]1	24123402	HBJBARXMSZLBNY-UHFFFAOYSA-N	434.250	1.304	50	20	IDGD	
Nn1c(SCC(=O)NNC(=O)c2ccc(F)cc2)nnc1SCc1ccccc1	26221946	CYBHAMBEWIHCQK-UHFFFAOYSA-N	432.506	1.977	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2ccc3c(c2)C[C@@H](C)N3C(C)=O)cc1OC	28686690	DZMHNDPEQJZNRM-GFCCVEGCSA-N	433.486	1.625	50	20	IDGD	
CSCC[C@H](NC(=O)c1ccco1)C(=O)NNC(=O)c1cc(Br)c[nH]1	28717758	PNBSFSCURQDMLB-JTQLQIEISA-N	429.296	1.683	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)c2ccc3c(=O)n(CC)c(=O)[nH]c3c2)cc1	108045658	SACVOQVUOVYFLU-ZDUSSCGKSA-N	440.456	1.337	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)N1CCN(c2cccc(C(F)(F)F)c2)CC1	725872682	QHHJTTMVMNLXOI-UHFFFAOYSA-N	439.394	1.591	50	20	IDGD	
COc1ccc(CN2C[C@@H](C(=O)NNC(=O)[C@@H]3COc4ccccc4O3)CC2=O)cc1	726496695	GRBBKOJSWSFIJC-KXBFYZLASA-N	425.441	1.031	50	20	IDGD	
COCCC(=O)NNC(=O)CN(Cc1ccccc1)S(=O)(=O)c1ccc(Cl)cc1	727099010	MQCHSBXJHHQCAT-UHFFFAOYSA-N	439.921	1.715	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCC[C@@H](CN(C)C(=O)OC(C)(C)C)C2)n1	727137615	FARKHKDRNRLUDY-HNNXBMFYSA-N	439.582	1.720	50	20	IDGD	
COc1ccccc1/C(C)=C\C(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1	727364094	LULTZUCFNBPJHZ-SSZFMOIBSA-N	431.514	1.875	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)[C@H](c2ccccc2)N2CCCCC2=O)c2ccccc2c1=O	728150814	JQYBQXLOAYZCRD-FQEVSTJZSA-N	433.468	1.448	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)C[C@@](O)(c2nc(C)cs2)C(F)(F)F)c1	728206547	UQGIHMQWSFOMSK-MRXNPFEDSA-N	432.424	1.860	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)c2ccc(S(=O)(=O)CCCC#N)cc2)c1	728207654	CBCSJCXHMPMSFA-UHFFFAOYSA-N	430.486	1.646	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2ccccn2)c(Br)cc1F	728501056	DOQKXEAIVXPQDD-UHFFFAOYSA-N	432.227	1.393	50	20	IDGD	
CCc1nc(CN2CCN(C(=O)NNC(=O)c3cc(Br)c[nH]3)CC2)cs1	728942617	YXYUNOWYZAVFJV-UHFFFAOYSA-N	441.355	1.968	50	20	IDGD	
O=C(CNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)Nc1ccc(Cl)cc1	728962055	WMGQAWNKJYBBMS-UHFFFAOYSA-N	431.884	1.316	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)NC[C@H]1CN2CCC[C@@H]2CO1	729507772	VTUUIZWZZSWAHS-HIFRSBDPSA-N	427.299	1.022	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(C)cc(OC)c2O)c1	730272455	OGUUCPVSMBBQCB-UHFFFAOYSA-N	435.502	1.815	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)CCCc2ccc3nc(O)[nH]c3c2)n1	730374738	UKCKPXBGGWAFJU-UHFFFAOYSA-N	431.474	1.289	50	20	IDGD	
COc1ccccc1C(=O)NNS(=O)(=O)c1ccc(Br)cc1[N+](=O)[O-]	731494481	XQBHBIHNCZSNCG-UHFFFAOYSA-N	430.236	1.989	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2ccc(CS(C)(=O)=O)o2)cc1Br	732036147	YIQUDNAHRDDAOB-UHFFFAOYSA-N	431.264	1.670	50	20	IDGD	
CC(C)[C@H](NS(=O)(=O)c1ccc2c(c1)OCCCO2)C(=O)NNC(=O)C1CCC1	732140762	JMWRSDFDKWLSAT-KRWDZBQOSA-N	425.507	1.098	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CSCC(=O)N2CCCCC2)cc1Br	732173812	HLHWOKVYFDUANK-UHFFFAOYSA-N	444.351	1.964	50	20	IDGD	
CS(=O)(=O)N1CCc2cc(C(=O)NNC(=O)c3cnn(-c4ccccc4)c3)ccc21	733106944	QZBYWSXEMXVHNQ-UHFFFAOYSA-N	425.470	1.269	50	20	IDGD	
CN1C(=O)CC[C@@H](C(=O)NNC(=O)N2CCOCC2)[C@@H]1c1ccc(C(F)(F)F)cc1	734429315	MBPLVMYOJQOUHM-ZBFHGGJFSA-N	428.411	1.688	50	20	IDGD	
Cc1cc(C)n2nc(SCc3ccccc3C(=O)NNC(=O)c3cnn(C)c3)nc2n1	735444154	FDPSPLQGAJLFEB-UHFFFAOYSA-N	436.501	1.842	50	20	IDGD	
C[C@@H]1OC(C)(C)N(C(=O)OC(C)(C)C)[C@H]1C(=O)NNC(=O)c1ccc2c(c1)OCCO2	735839693	FGQMTOPKOAYHOG-BLLLJJGKSA-N	435.477	1.979	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)c2ccc(S(N)(=O)=O)c(C)c2)cc1C	736821532	SAWJFJQELINSRR-UHFFFAOYSA-N	439.515	1.193	50	20	IDGD	
CCn1cnc2c1c(=O)n(CC(=O)NN=C(COC)C(C)C)c(=O)n2Cc1ccccc1	741457121	RWFRMEGLLCGJSX-UHFFFAOYSA-N	440.504	1.203	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)c2ccc(N3CCCS3(=O)=O)cc2C)c1	741659975	JLQDEQKJNBWALF-UHFFFAOYSA-N	431.514	1.992	50	20	IDGD	
Cc1nn(C)c2sc(C(=O)N[C@@H](C)C(=O)NNC(=O)Cn3ccc4ccccc43)cc12	742069275	PBEJDSNIGKLBJF-ZDUSSCGKSA-N	438.513	1.864	50	20	IDGD	
C[C@H](C(=O)NNC(=O)COc1ccc(Br)cc1)n1nnc(-c2ccccc2)n1	742471992	WFMWFFJWPLFGTI-GFCCVEGCSA-N	445.277	1.890	50	20	IDGD	
C[C@@H](CC(=O)NNC(=O)c1cccc2ncccc12)/N=C1/NS(=O)(=O)c2ccccc21	742646887	VCXHHLSWIQIOGY-ZDUSSCGKSA-N	437.481	1.513	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(/C#N)C(=O)OCc2nc(CS(C)(=O)=O)no2)c1C	744459959	HFSDFFVAFCBHIX-BWADBZPLSA-N	436.490	1.890	50	20	IDGD	
Cc1nc2c(c(C)nn2C)c(C)c1CC(=O)OCC(=O)NNC(=O)c1ccc(C#N)cc1	744786039	FZFOVORYLQNFJL-UHFFFAOYSA-N	434.456	1.312	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)N[C@@H]2[C@@H]3CCCO[C@@H]3C2(C)C)nc1	745859915	HEIXCEMFKKZZHX-UAGQMJEPSA-N	425.555	1.942	50	20	IDGD	
C[C@@H]1C[C@H](NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)C(=O)N1c1ccccc1	745883401	TUNRXOSUPVEKBL-DYVFJYSZSA-N	430.486	1.228	50	20	IDGD	
CSCC[C@@H](C(=O)NNC(=O)COc1ccc(C)cc1)N1C(=O)[C@H]2CCCC[C@H]2C1=O	746129373	HXLMXKUEOSNUBE-KSZLIROESA-N	447.557	1.818	50	20	IDGD	
COc1ccc(-c2nnc(SCC(=O)NNC(=O)Cc3cn4ccccc4n3)o2)cc1	746555812	ICRQYSXKSKHTFR-UHFFFAOYSA-N	438.469	1.875	50	20	IDGD	
CCO[C@H](CCNC(=O)NNC(=O)c1csc(N2CCOCC2)n1)C1CCCC1	747490723	BPISWOFZHPAUJE-MRXNPFEDSA-N	425.555	1.909	50	20	IDGD	
O=C(CCn1cc([N+](=O)[O-])cn1)NNc1ccc(S(=O)(=O)Nc2nccs2)cc1	747944195	RCFIQOLGXHHISC-UHFFFAOYSA-N	437.463	1.582	50	20	IDGD	
CCCC(=O)N1CCC[C@H]1C(=O)OCC(=O)NNC(=O)c1cc(Cl)ccc1OC	748376936	LAGDLPFFIPGGLG-AWEZNQCLSA-N	425.869	1.444	50	20	IDGD	
COc1ccccc1N1CC[C@@H](CNC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])C1	750330918	MWYPIQXYNUCLGF-HNNXBMFYSA-N	443.460	1.839	50	20	IDGD	
CCC(CC)[C@@H](C(=O)OCC(=O)NNC(=O)c1cccc(Cl)c1)N1CCOCC1	750514978	UQXSXAMCTBXHFH-SFHVURJKSA-N	425.913	1.781	50	20	IDGD	
CCOC(=O)c1sc(CNC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)nc1C	750674809	YXBGVIYGJJRSHJ-UHFFFAOYSA-N	440.503	1.176	50	20	IDGD	
COc1cc(Br)c(S(=O)(=O)NNC(=O)N2CCOCC2)cc1Cl	751212031	FCOFOEYBVQWIRG-UHFFFAOYSA-N	428.692	1.346	50	20	IDGD	
O=C(Cn1cnc2ccccc21)NNC(=O)c1cn(-c2ccc(C(F)(F)F)cn2)nn1	751291043	PDUOBCKIJAAFKM-UHFFFAOYSA-N	430.350	1.492	50	20	IDGD	
CC[C@H](C)C(=O)N1CCC[C@@H](C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)C1	751295512	ZMWODMDVKVOYCM-DZGCQCFKSA-N	437.566	1.334	50	20	IDGD	
COC(=O)c1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)ccn1	751298527	YNAZIWPFHXFOSV-UHFFFAOYSA-N	446.485	1.118	50	20	IDGD	
CCOC(=O)[C@H]1Cc2cc(S(=O)(=O)NNC(=O)c3ccc(Cl)cc3F)ccc2O1	751548718	KSFWZLAVDPVYBS-MRXNPFEDSA-N	442.852	1.969	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)C2CN(C(=O)OC(C)(C)C)C2)cc1C	752240086	MFFCRNZPRGZKLR-UHFFFAOYSA-N	425.507	1.790	50	20	IDGD	
O=C(CNC(=O)c1c[nH]c2ccccc2c1=O)NNC(=S)NCCc1cccs1	753077325	JINROQVOAADRID-UHFFFAOYSA-N	429.527	1.057	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)c1c[nH]nc1-c1ccc2c(c1)OCO2	753391251	VMVHWUARSYIQEX-UHFFFAOYSA-N	432.396	1.772	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)c2cc(S(=O)(=O)N(C)C)c(C)o2)cc1	753565906	MYEAKNSHABAXII-CYBMUJFWSA-N	439.490	1.466	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)N[C@@H]1[C@H]2CCO[C@H]2C12CCC2	754677886	ZBWYTPDRYZXTMT-KZNAEPCWSA-N	448.545	1.373	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2nnc(Cc3ccccc3)s2)c1	755409727	WWHUFJBNQWPDKZ-UHFFFAOYSA-N	431.499	1.999	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)Nc2cccc(S(=O)(=O)NC3CC3)c2)cc1	755584489	BYJZYXFWLDOIKX-UHFFFAOYSA-N	432.502	1.921	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)Nc1nnc(C(F)F)s1	756219065	DZRCEFYMKUTABR-UHFFFAOYSA-N	425.465	1.841	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)Nc2ccccc2CN2C(=O)CCC2=O)c2ccccc2c1=O	756221819	RENQICZSNHMCSB-UHFFFAOYSA-N	448.439	1.049	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CN2CCN(CC(=O)Nc3ccccc3F)CC2)cc1	756642534	MGQORUVTRYBYFX-UHFFFAOYSA-N	427.480	1.151	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)Nc1cc(S(=O)(=O)N(C)C)ccc1F	756686485	VJLFBMXGCRMXBE-LLVKDONJSA-N	442.444	1.835	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Nc2ccn(CCS(C)(=O)=O)n2)ccc1OC(C)C	756763098	YQBMGWSJVZVARG-UHFFFAOYSA-N	439.494	1.190	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)C(F)(F)c3nccs3)cc2)CC1	756874438	DNDNTCZNAMWRQC-UHFFFAOYSA-N	431.490	1.314	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)Nc1ccc(C(=O)NC2CCOCC2)cc1	757621063	MJKSLNVNBYSZNV-UHFFFAOYSA-N	426.473	1.999	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1cc(-c2ccccc2)nc2cc(F)ccc12	758035692	NLCINMCCMBNEOF-LBPRGKRZSA-N	430.461	1.740	50	20	IDGD	
CN(NC(=O)CNC(=O)NC1CCCCC1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758782817	ZCIZTCJHLBYXOV-UHFFFAOYSA-N	440.545	1.254	50	20	IDGD	
CCO[C@@H]1C[C@H](NC(=O)NNC(=O)COc2ccc(Br)cc2)[C@]12CCCO2	759325452	YZHAAAGBABFVDJ-HDMKZQKVSA-N	442.310	1.885	50	20	IDGD	
CN(C)C1CCN(CCNC(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)CC1	759581174	ZONWOVYSSAQDLA-UHFFFAOYSA-N	437.488	1.632	50	20	IDGD	
Cc1nnc([C@@H](C)NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)s1	760140550	BWVVTTUXYXJKBA-LLVKDONJSA-N	438.535	1.336	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNS(=O)(=O)c1cccc(S(=O)(=O)CC)c1	760335564	SJWNGXZISQKOLC-UHFFFAOYSA-N	442.515	1.267	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)c1noc(-c2ccccc2)n1	761802140	WUSGQXQUHUDGSV-AWEZNQCLSA-N	436.476	1.835	50	20	IDGD	
Cc1ccc2c(c1)C(=O)N([C@@H](C)C(=O)NNC(=O)c1cc(-c3ccc(F)cc3)[nH]n1)C2=O	763174029	UOCQGLFPPNAIJE-LBPRGKRZSA-N	435.415	1.970	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(-n3nccn3)nc2)cc1	763770306	WAVNBIWZCJARJA-UHFFFAOYSA-N	437.460	1.487	50	20	IDGD	
CN1CCN(Cc2cccc(NC(=O)C(=O)NNC(=O)c3cc4c(s3)CCC4)c2)CC1	763784594	ZXWWREPGGSTBJY-UHFFFAOYSA-N	441.557	1.384	50	20	IDGD	
Cc1nnc(-c2cccc(NC(=O)C(=O)NNC(=O)COc3ccc(F)cc3)c2)n1C	763840274	PFNRWZPMMFZNMW-UHFFFAOYSA-N	426.408	1.095	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)C(=O)Nc1cnn(-c2ccncc2)c1	763849858	LHYZSPXMFVZCBJ-OAHLLOKOSA-N	444.451	1.974	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cccc(NC(C)=O)c2C)cc1	763859825	GCJMXWIOZGZIBK-CQSZACIVSA-N	442.472	1.906	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1cccc(OC[C@H]2CCCO2)c1	763863764	BVIBNOBRVRTUOV-RHSMWYFYSA-N	445.447	1.937	50	20	IDGD	
CC(C)C(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)cc1	763866959	RUQIUBCVAGOAQN-ZDUSSCGKSA-N	430.436	1.974	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cnn(-c3ccccc3)c2C)cc1	763871034	CUPITRFCJMMTSI-MRXNPFEDSA-N	449.467	1.937	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1cccc(N2CCCC2=O)c1	763871518	HFJGRYNGJJVWFT-ZDUSSCGKSA-N	428.420	1.506	50	20	IDGD	
COC(=O)c1cccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(C(C)=O)cc2)c1	763878346	PARCXGAJXGQXJO-CYBMUJFWSA-N	427.413	1.229	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2cc(NC(=O)c3ccccc3)ccc2C)n1	763886355	VIGFIJUIOIONNS-UHFFFAOYSA-N	448.483	1.847	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)CSc2ccc(C)cc2)c(OC)c1OC	763891929	SOKSOOVUOZTKBJ-UHFFFAOYSA-N	433.486	1.899	50	20	IDGD	
Cc1nc(-c2cccc(NC(=O)C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)c2)oc1C	763921268	LETCLGGKMBMQPD-UHFFFAOYSA-N	446.427	1.334	50	20	IDGD	
CCOC(=O)c1ccsc1NC(=O)C(=O)NNC(=O)c1cc(Br)c[nH]1	763995760	LGTCKRWCSQNNDW-UHFFFAOYSA-N	429.252	1.415	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1cc(F)ccc1OC(F)F	764005665	FFHMGHJBWLNUDJ-UHFFFAOYSA-N	425.319	1.598	50	20	IDGD	
Cn1cc(Br)cc(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3c2)c1=O	764061601	JQFZEOOVJCRSHG-UHFFFAOYSA-N	443.257	1.701	50	20	IDGD	
O=C(CC1CCCC1)NNC(=O)C(=O)N1C[C@@H](C(=O)N2CCCCC2)Oc2ccccc21	764184233	PCOWUSYDXAZHEF-IBGZPJMESA-N	442.516	1.521	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2cccc(C#N)c2)cc(OC)c1Br	764242376	PEYNFFQISDARQC-UHFFFAOYSA-N	447.245	1.738	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)C(=O)N1CCc2ccc(Br)cc21	764277356	CJEPPBFBKVPTCT-UHFFFAOYSA-N	432.274	1.824	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)C(=O)Nc1ccc(C(=O)NCc2ccccc2)cc1	764355834	JYLUCKIIGVQQDH-UHFFFAOYSA-N	431.452	1.340	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)C(=O)Nc1ccccc1OC[C@@H]1CCCCO1	764363604	SSSCQUKAROKMFX-SFHVURJKSA-N	441.484	1.937	50	20	IDGD	
COC(=O)c1sccc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	764387297	IZGOYXZPRJQGGY-UHFFFAOYSA-N	431.405	1.464	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccccc2C)cc1OC	764406195	PQJATXDDFNTUIT-UHFFFAOYSA-N	448.501	1.094	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)CCCOc1ccc2c(c1)OCO2	764559056	OTFCIJXPMSAAQL-UHFFFAOYSA-N	448.501	1.637	50	20	IDGD	
COC(=O)c1c(CC(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)[nH]c(C(C)=O)c1C	765619634	KDYNDVYYVIFXMO-UHFFFAOYSA-N	441.419	1.845	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNc2nccnc2OC)sc2c1CCSC2	766260246	BWUCFXQMFFNLBT-UHFFFAOYSA-N	437.503	1.595	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1ccc(C)c(NC(=O)CN2CCCCC2)c1	766264348	JBBUEXZIQUGVIY-UHFFFAOYSA-N	441.492	1.300	50	20	IDGD	
COC(=O)c1ccsc1N1CC[C@H](NC(=O)NNc2ncnc3ccsc23)C1=O	767067840	WFCYTQFDPPNXSD-NSHDSACASA-N	432.487	1.971	50	20	IDGD	
Cc1nn(CC(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)cc1-c1ccccc1	768178756	FTIRQPLRBOICIU-UHFFFAOYSA-N	425.876	1.976	50	20	IDGD	
COc1ccc(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)nc1Cl	768206098	GPNPKUHEPFKDIW-UHFFFAOYSA-N	426.882	1.521	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(OC)cc2)c2ncccc12	768230595	GCEMZMHZLHMQDS-UHFFFAOYSA-N	438.440	1.807	50	20	IDGD	
O=C(CC(F)(F)F)NNC(=O)C(=O)Nc1ccccc1OCC(=O)Nc1cccnc1	768238481	ALEPQWVLYSJXOX-UHFFFAOYSA-N	439.350	1.137	50	20	IDGD	
COc1cc(O)c(C=NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)cc1OC	768368115	WOEYBNKAWDACMI-UHFFFAOYSA-N	426.517	1.986	50	20	IDGD	
CC(C)(C)[C@H](Br)C(=O)NC1CN(S(=O)(=O)c2ccc3c(c2)OCCO3)C1	768389014	WLFFJGNDCSOKKE-OAHLLOKOSA-N	447.351	1.757	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)c1cc(S(=O)(=O)N(C)C)oc1C	768629791	MQOATGZBDSGHMJ-UHFFFAOYSA-N	431.492	1.007	50	20	IDGD	
CSCCNC(=S)NNC(=O)[C@H]1CCCN1C(=O)c1ccc(Br)cc1	770245385	NMBCURZLBBHOMH-CYBMUJFWSA-N	445.408	1.912	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)NC[C@H]3CCN(CC(F)(F)F)C3)nc21	770344063	GRQYCYQQURPWRJ-SNVBAGLBSA-N	430.435	1.797	50	20	IDGD	
CC(=O)NCc1ccc(S(=O)(=O)NCC(=O)OC[C@@H](C)CBr)s1	770382645	HPCVRSLOHVFSNY-VIFPVBQESA-N	427.342	1.237	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)c3cc(I)c[nH]3)nc21	770958198	JPMQZXJNJZVQHN-UHFFFAOYSA-N	441.233	1.977	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1ccc2c(c1)S(=O)(=O)c1ccccc1C2=O	771888719	DSVITPUMPJICSH-NSHDSACASA-N	430.438	1.167	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCCNC(=O)NNC(=O)c2cccc(OC(F)F)c2)s1	771981149	SVLSPNRDWZJENV-UHFFFAOYSA-N	448.473	1.580	50	20	IDGD	
CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O[C@H](C)C(=O)NNC(=O)CC(C)C	772166856	HBGZOQJQTGXNTE-XIKOKIGWSA-N	434.468	1.479	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)CSc1nc2ccccc2nc1N1CCCC1	772192721	WUPDCBTYAPWKAA-ZDUSSCGKSA-N	431.518	1.811	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)c1cc(N2C[C@H](C)O[C@@H](C)C2)ccn1	772561075	OBQCGDDXQQBBJI-KBPBESRZSA-N	434.518	1.864	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCC2CCN(c3ccncc3)CC2)nc1	772611362	FCHALQHKGDGXAQ-UHFFFAOYSA-N	447.565	1.706	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)C(=O)Nc2ccc(I)cn2)c1	773487806	GIWDGTAZIDTYIS-UHFFFAOYSA-N	440.197	1.555	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)ncc1Br	773520576	PGNSHQAPFGIBDG-CYBMUJFWSA-N	435.234	1.078	50	20	IDGD	
Cc1nc(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)ccc1Br	773527215	IHAOZWYZLWDPDN-UHFFFAOYSA-N	445.071	1.643	50	20	IDGD	
COc1ccc(F)cc1CC(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	773856375	GZNBJPGUDZMTNH-UHFFFAOYSA-N	448.926	1.995	50	20	IDGD	
O=C(NNc1cnc2ccccc2n1)[C@H]1CCCN1S(=O)(=O)c1cccc([N+](=O)[O-])c1	774769231	JLYIWUALQAMQOQ-QGZVFWFLSA-N	442.457	1.834	50	20	IDGD	
O=C(NNS(=O)(=O)c1cnn(CC(F)(F)F)c1)c1cc(F)ccc1Br	775278229	AOMATZPPWQCCGI-UHFFFAOYSA-N	445.192	1.970	50	20	IDGD	
Cc1ccc(S(=O)(=O)C[C@@H](C)NC(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1	776191382	CJAVJPXDCWPSIB-CQSZACIVSA-N	433.486	1.573	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1C[C@H](SC)[C@@H](N2CCCC2)C1	776487138	VYUHDLOMBIJFCS-RDJZCZTQSA-N	426.970	1.621	50	20	IDGD	
CN(C)CCS(=O)(=O)c1ccccc1C(=O)NNc1cccc(S(C)(=O)=O)c1	776715044	OKHSLRZLXTWIKG-UHFFFAOYSA-N	425.532	1.182	50	20	IDGD	
O=C(CO)NNC(=O)Cc1ccc(NS(=O)(=O)c2ccc(Cl)c(Cl)c2)cc1	777781941	IWAKVKHAGHRBMD-UHFFFAOYSA-N	432.285	1.476	50	20	IDGD	
COC[C@@H](C)C(C)=NNC(=O)C[C@@H]1c2cc(OC)c(OC)cc2CCN1S(C)(=O)=O	777876668	BAJPSYYLZZNSAO-CXAGYDPISA-N	441.550	1.727	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)N2CCN(CCO)C(C)(C)C2)N(C)c2ccccc21	781680942	XWBVIHHZSWXWMZ-UHFFFAOYSA-N	425.533	1.572	50	20	IDGD	
O=C(COC(=O)C1(Cc2ccc(F)cc2)CC1)NNC(=O)[C@H]1COc2ccccc2O1	782472799	IXGXVLNAYMYXDN-GOSISDBHSA-N	428.416	1.679	50	20	IDGD	
Cc1cccc(C)c1NC(=O)C(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	783704256	MYLCSSRNCFQBIU-UHFFFAOYSA-N	433.509	1.878	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1ccc(-c2nccs2)cc1	784003136	AHRSEUMXBXDPTJ-UHFFFAOYSA-N	429.483	1.388	50	20	IDGD	
CC(C)CCn1nccc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	784218093	ZKWXCSUUHRDIML-UHFFFAOYSA-N	434.522	1.452	50	20	IDGD	
O=C(COc1ccccc1NC(=O)C(=O)NNc1nccnc1Cl)Nc1cccnc1	784776721	SJRIBYQNEVFLDL-UHFFFAOYSA-N	441.835	1.624	50	20	IDGD	
CSc1nnnn1-c1cccc(NC(=O)C(=O)NNc2ccnc(Br)c2)c1	784837526	WLDYMPVYZWCLKQ-UHFFFAOYSA-N	449.294	1.624	50	20	IDGD	
COC(=O)c1cc(Br)c(F)cc1NC(=O)C(=O)NNc1ccnc(F)c1	784848021	FAUAUGCTCBLUNL-UHFFFAOYSA-N	429.177	1.991	50	20	IDGD	
C[C@@H]1[C@H](C(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)CCN1C(=O)OC(C)(C)C	786249893	LQZDKZDLKBAOBG-IUODEOHRSA-N	438.912	1.749	50	20	IDGD	
Cc1ccc(N2CCNC2=O)cc1NC(=O)C(=O)NNC(=O)COc1ccc(Cl)cc1	787540722	DNWYVGWNTQTECL-UHFFFAOYSA-N	445.863	1.343	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ccnc(Br)c2)cc1N1CCNC1=O	787562698	ULXYXADCSMUKSE-UHFFFAOYSA-N	433.266	1.764	50	20	IDGD	
COC[C@H](C)Oc1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)c1ccc2c(c1)OCO2	787894209	NHEAOIJEXNLXGV-NSHDSACASA-N	449.847	1.882	50	20	IDGD	
CS(=O)(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)ccc1Cl	788334558	XNSMGLCLMBRPCE-UHFFFAOYSA-N	446.268	1.502	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)c1cnnn1-c1c(Cl)cccc1Cl	795065817	CXRKKOKVGKVVQV-UHFFFAOYSA-N	439.284	1.827	50	20	IDGD	
COc1cccc(C2(C(=O)NNc3ccccc3S(=O)(=O)N3CCOCC3)CC2)c1	796838016	UKZTYQWEWDVIDD-UHFFFAOYSA-N	431.514	1.891	50	20	IDGD	
COC(=O)c1cc(F)cc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)c1F	797357446	KLRNKCKMKBOPCP-GUYCJALGSA-N	447.394	1.410	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNC(=O)C(=O)Nc1cnc(-c2ccccc2)nc1	797368571	DOHYHUDAMNIOBO-UHFFFAOYSA-N	448.439	1.156	50	20	IDGD	
O=C(CCCNS(=O)(=O)c1ccc2c(c1)CCCC2)NNC(=O)N=c1cc[nH]cc1	802028987	HYNFABZMWXDOBM-UHFFFAOYSA-N	431.518	1.294	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2nc(Cc3ccccc3)cs2)cc1	806973484	CZJKCLCWWWTKAW-UHFFFAOYSA-N	435.465	1.770	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2cccc(F)c2Cl)c2ccccc2c1=O	806974943	ZJGIFMWGLNBHLG-UHFFFAOYSA-N	431.811	1.609	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2cc(C(F)(F)F)cc(Br)n2)n1	806984010	KNJRNWVALLOHCZ-UHFFFAOYSA-N	435.160	1.743	50	20	IDGD	
CCN(CC)CC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2cccc(C)n2)c1	807070366	TVIROQKZGDAUCA-UHFFFAOYSA-N	426.477	1.070	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)c1nnn(-c2ccc(OC(F)F)cc2)c1C	807370148	WBKZVRCYFGQMJN-UHFFFAOYSA-N	427.408	1.727	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)N[C@@H]1CCCN(C(=O)N2CCCC2)C1	807457455	DQZCGCGWWDXEBI-OAHLLOKOSA-N	435.550	1.798	50	20	IDGD	
CCCCOc1ccc(C(=O)NNS(=O)(=O)c2cnc(NC(C)=O)s2)cc1OC	808069966	NPGRUOHQOKMAOD-UHFFFAOYSA-N	442.519	1.912	50	20	IDGD	
CCCNS(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)c2cccc3cccnc23)cc1	808084895	FTPLIADIFHVTGL-UHFFFAOYSA-N	448.526	1.546	50	20	IDGD	
CCS(=O)(=O)N1CCC([C@@H](C)N(C)C(=O)NNC(=O)CCOc2ccccc2)CC1	808254704	DZEUZICTBDBDSE-MRXNPFEDSA-N	440.566	1.578	50	20	IDGD	
COc1ccc(-c2ocnc2C(=O)OCC(=O)NNC(=O)Cc2nc(C)cs2)cc1	808645087	WBDAFZOZPHJXJB-UHFFFAOYSA-N	430.442	1.662	50	20	IDGD	
COC(=O)c1c(F)ccc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)c1F	810405814	PHUVWLNCUCKPFO-SJCJKPOMSA-N	447.394	1.410	50	20	IDGD	
CC(C)CC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)NNc1c(F)cc(C(=O)NC2CC2)cc1F	810563689	QDTGFOMJRYMEKM-KRWDZBQOSA-N	448.474	1.797	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)CNS(=O)(=O)c2cccc(Br)c2)nc1	810755580	WMBFZCXVVLBFCK-UHFFFAOYSA-N	443.279	1.052	50	20	IDGD	
COc1ccc(C[C@@](C)(O)CNC(=O)NNC(=O)Cn2ccc3ccccc32)cc1OC	811875297	BGNHZAKKMXKUFK-HSZRJFAPSA-N	440.500	1.983	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cc3ccccc3cc2O)cc1	811968285	OJWRBYDFBRAHBB-UHFFFAOYSA-N	443.481	1.545	50	20	IDGD	
Cc1nc(CC(C)C)c(NC(=O)C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)s1	813033793	LOVUOXHHYMQWGY-UHFFFAOYSA-N	439.563	1.982	50	20	IDGD	
O=C(COc1ccccc1O)NN=C1C(=O)Nc2c(I)cccc21	814952203	PDASGLFIEPVWSZ-UHFFFAOYSA-N	437.193	1.848	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C)c(C)c(NC(=O)C(=O)NNc2ncncc2F)c1	815764647	OWXVMKFDHVZXMJ-UHFFFAOYSA-N	438.485	1.345	50	20	IDGD	
CCn1c(=O)n(CC(=O)NNC(=O)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)c2ccccc21	816509832	DBBRANIMISKYRN-OAHLLOKOSA-N	445.520	1.617	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc2c(c1)nc(CCC(=O)NNc1ncncc1F)n2C	817080060	SKMAQKMPKKGJDE-UHFFFAOYSA-N	449.512	1.609	50	20	IDGD	
COc1cccc([C@]2(C)NC(=O)N(NC(=O)/C(C#N)=C/c3cc(C#N)n(C)c3C)C2=O)c1	863708971	VXEUXTZKYSNQOR-BODNZJIQSA-N	432.440	1.619	50	20	IDGD	
CC(=O)N1CCN(S(=O)(=O)c2cccc(C(=O)NNc3cccc(Cl)c3)c2)CC1	912718234	YPERKMMHWDAEEZ-UHFFFAOYSA-N	436.921	1.950	50	20	IDGD	
Cn1c(=NNC(=O)c2ccccc2S(=O)(=O)N2CCOCC2)sc2ccccc21	914774966	YZNYAJPYOFJIRB-UHFFFAOYSA-N	432.527	1.506	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)[C@H]2CC[C@H](C(F)(F)F)NC2=O)c2ccccc2c1=O	915190997	ZFNUKXDPDRZZBU-QWHCGFSZSA-N	439.394	1.025	50	20	IDGD	
CN(C)N(C(=O)c1ccc(F)cc1I)[C@H]1CCS(=O)(=O)C1	915277606	YHSAHSNJWPORQA-JTQLQIEISA-N	426.251	1.536	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)N[C@@H](C)c3cccc(S(N)(=O)=O)c3)n[nH]2)cc1	916197507	VQTAZVCIDTUTML-ZDUSSCGKSA-N	442.501	1.738	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2cccc(C#N)c2)c1	916406649	JXRNNEHXILDYRO-UHFFFAOYSA-N	429.502	1.733	50	20	IDGD	
CCc1c(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)[nH]c(C)c1C(C)=O	916726180	HDCPJOMMCRDTOV-UHFFFAOYSA-N	446.529	1.947	50	20	IDGD	
CN(CC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)C(=O)c1ccc(Br)o1	917390547	SYTDEDACEMTAPE-UHFFFAOYSA-N	425.195	1.484	50	20	IDGD	
CCNS(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)c1	917918749	CZGCWYLYAASNKO-NSHDSACASA-N	427.429	1.492	50	20	IDGD	
C[C@H](COc1ccccc1)NC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	918088814	QRPKNQXXKGLIDC-LJQANCHMSA-N	425.533	1.997	50	20	IDGD	
O=C(CCN1C(=O)[C@H]2CCCC[C@H]2C1=O)NNC(=O)c1ccc(F)cc1Br	918340337	KXKMAQYITQMGIH-TXEJJXNPSA-N	440.269	1.915	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1cc(C)nc2cc(C)nn12	919530791	HOCSXPPNSSZKNY-UHFFFAOYSA-N	431.836	1.626	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)C2(S(=O)(=O)c3ccc(Cl)cc3)CC2)cc1	919689147	ZXVZQDSBLFZJDH-UHFFFAOYSA-N	433.873	1.744	50	20	IDGD	
O=C(NCCOc1cccc(Cl)c1Cl)NNC(=O)c1ccc(-n2cnnn2)cc1	919922750	KBULLVCMUOXVHY-UHFFFAOYSA-N	436.259	1.992	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)CCn2cnc3c(C)cccc3c2=O)o1	920248364	CKWDRDKPHHSMSG-UHFFFAOYSA-N	425.489	1.991	50	20	IDGD	
O=C(NNC(=O)c1cncn1-c1ccccc1)N[C@@H]1CCN(c2c(F)cccc2F)C1=O	1116248862	FJJSKZSBZBQZEU-MRXNPFEDSA-N	440.410	1.900	50	20	IDGD	
COCCNC(=O)C1CCN(C(=O)NNC(=O)c2ccc(Br)s2)CC1	1317797923	SVUBHKRKAAQFCR-UHFFFAOYSA-N	433.328	1.340	50	20	IDGD	
COCCOC(=O)c1c(C)[nH]c(C(=O)NNC(=O)c2cncn2-c2ccccc2)c1C	1317864768	WRRUYXGLURHPFR-UHFFFAOYSA-N	425.445	1.695	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](C(=O)NNC(=O)c1ccc(Br)cc1)C(C)(C)O	1326048894	VBSJAYPSKBUGBH-GFCCVEGCSA-N	430.299	1.874	50	20	IDGD	
Cc1c([C@H](C)NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cnn1C	1337489742	LWYFZKFAYZSSHJ-ZDUSSCGKSA-N	434.522	1.218	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(CCN(C(=O)C[C@H]3CNc4ccccc4O3)C2)C1	1778931712	QDHUFILAPCNVTL-HTAPYJJXSA-N	447.608	1.931	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@]2(C1)CN(C(=O)c1ccnc3ncccc13)CCO2	1779298724	IJHFNDDEJCUWIS-NRFANRHFSA-N	428.565	1.925	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc([N+](=O)[O-])[nH]3)C2)C1	1780414867	VBCABVXYCIGGOK-ZBEGNZNMSA-N	429.271	1.397	50	20	IDGD	
COc1ccc(CC(=O)N2CC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)c([N+](=O)[O-])c1	1781415332	YZRYMVKBLIQAQW-GOSISDBHSA-N	446.287	1.780	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3n[nH]c4ccc(C#N)cc34)C2)C1	1782197804	DHWJDLJMHWLKQU-FOIQADDNSA-N	431.880	1.132	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H]1CCc3nc[nH]c3C1)C2)C(Cl)Cl	1782220106	XJYPPDWODAYOOA-IOHHAYIISA-N	429.348	1.832	50	20	IDGD	
COc1cnc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](C)Br)C3)C2)c(F)c1	1783532664	QTSSXLJZQXGEHV-DIFFPNOSSA-N	430.274	1.456	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1783854203	JTTMXBGMYIYKRD-MOROJQBDSA-N	447.301	1.262	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(C)cc3-n3nccn3)CCO2)C1	1783880919	GUCAAFKXHRYNCP-UWJYYQICSA-N	447.923	1.273	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(OC)cc3OC)CCO2)C1	1783883214	WQGFEKZDBSALMO-UZLBHIALSA-N	426.897	1.401	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)CCc3cccc(O)c3)C2)C1	1784127167	OBXASTDWFKBESW-AUUYWEPGSA-N	425.323	1.938	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)Cc3cnc(C)s3)C2)C1	1784440865	UHVWLRWPDNECEG-WMLDXEAASA-N	430.368	1.997	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3n[nH]c(C4CC4)c3F)[C@H]2C1	1785767643	XQNFGQBSHUBPMX-KKUMJFAQSA-N	438.576	1.871	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(C)n(C)n3)[C@H]2C1	1786007953	BQMITWRLVNVQEJ-YXWQFLTLSA-N	427.343	1.495	50	20	IDGD	
O=C1CCc2ccc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)C(Cl)Cl)C[C@@H]43)nc2N1	1787267997	SAQJZQHOUBZORJ-OBJOEFQTSA-N	441.315	1.363	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)c1cc2cccn2cn1	1788075919	XHZJRHIOZROHTL-QRTARXTBSA-N	435.322	1.713	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)c1cc2n(n1)CCCO2	1788349574	GAYMFIKMEKPWOK-YDHLFZDLSA-N	441.326	1.044	50	20	IDGD	
COC(=O)[C@H]1CC[C@H](C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]3C2)C1	1788761925	HDXNITNYLPFGDL-ATIWLJMLSA-N	440.613	1.407	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(Cl)ncn3)[C@H]2C1	1789058647	OFSRRQWKEDROSO-BTIUKSQHSA-N	435.739	1.960	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(C)nn3C(F)F)[C@H]2C1	1789335014	YLYIQUZITBMAQR-ABHRYQDASA-N	434.871	1.434	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnn4ccncc34)C[C@@H]21	1789867914	JESRADICXPZRJZ-HAHWVIBASA-N	440.331	1.559	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]2C1	1789923397	KZXBQQQXSDNEET-VITBEWHZSA-N	434.133	1.893	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(NC(C)=O)cc3)C[C@@H]21	1791256335	MDNWZTQMUROPDE-WNHJNPCNSA-N	437.924	1.492	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)Sc3ccccn3)C[C@@H]21	1791256676	UKSHKXIXZAFFEX-HMDCTGQHSA-N	441.981	1.796	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4c(c3)OCCO4)C[C@@H]21)C(Cl)Cl	1791294885	WHDNJCMJCXNZDQ-XEZPLFJOSA-N	429.300	1.855	50	20	IDGD	
C[C@H](Br)C(=O)Nc1ccc(C2(NC(=O)CN3C(=O)C=CC3=O)CCC2)cc1	1791436655	VWZBXMQJNVHBJJ-LBPRGKRZSA-N	434.290	1.829	50	20	IDGD	
C[C@@H](Br)C(=O)NC1(c2ccc(NC(=O)CN3C(=O)C=CC3=O)cc2)CCC1	1791694931	XVRMYSKWFJFXBQ-GFCCVEGCSA-N	434.290	1.829	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCCn1cccc1)C2	1792873318	SGMYUJDROAWQBZ-XLMAVXFVSA-N	426.355	1.889	50	20	IDGD	
CC(C)[C@@H](O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)C2	1793077448	YEOLAVQGPDMFGN-NPCRTEPVSA-N	433.455	1.478	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CC(=O)N(C2CCCC2)C1	1794030885	FKQHQKZOTUWAFJ-YGTYDBBMSA-N	425.957	1.670	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1Cc2ccccc2CN1	1796373569	MZFNISHQFIMZPQ-KSZKVXGTSA-N	440.371	1.527	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc2c1OCCO2	1796963221	WVJGATMDDNYNRW-CCWDJLKJSA-N	434.565	1.513	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccnn1-c1ccccc1)c1cccc(B(O)O)c1	1797235057	JTXADPPPNRPFBL-NUZGMZIFSA-N	444.300	1.118	50	20	IDGD	
COc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)Br)C3)cc(Cl)n1	1798291365	CCSAZNKPSMJFKB-BTABJRDXSA-N	446.729	1.730	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1(c2ccc(F)c(F)c2)CC1	1799067934	KHBUESUVDVCTDH-ZFHGCVPZSA-N	442.890	1.840	50	20	IDGD	
Cn1c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](O)CCl)C3)cc2c[nH]c3nccc-3c21	1799170742	FBXUVGAXSBVZHC-LOUJCGABSA-N	429.908	1.858	50	20	IDGD	
C[C@@H](NNc1ccccc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@](C)(Cl)CCl	1799273706	OMKAJOJDZDKLSK-ITNJMCAHSA-N	443.375	1.818	50	20	IDGD	
COc1cc(C)cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)Br)C3)c1	1799451443	HGVNSDXXERMICL-FAYQHZLMSA-N	425.323	1.990	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc([N+](=O)[O-])cc1F	1799492994	IPFUAQVWKJENMS-ZVXAKGHKSA-N	444.257	1.721	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1C[C@@]12C(=O)Nc1ccccc12	1800766747	OVRRTZUHHHJUIG-PJHOBBQFSA-N	431.920	1.503	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnn2c1OCCC2	1800937595	IZIZAFHARYFAAL-FQUUOJAGSA-N	425.327	1.948	50	20	IDGD	
Cc1cc(F)cc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Br)C3)c1	1801082855	GFBPKWCHSSZDPO-DLTLXFJOSA-N	431.277	1.957	50	20	IDGD	
COc1cc(Cl)cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CCC(=O)NN(C)C)c1	1802343371	BOUDUCMCWPNFPI-BJWYYQGGSA-N	436.940	1.973	50	20	IDGD	
Cc1ncc(/C=C/C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)s1	1803187631	SORAURXWTVQANA-VOHBNYOCSA-N	425.319	1.097	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)[C@H](C)CC(N)=O)[C@@H]1c1cccnc1	1803672724	UYWLWSJOQHSDQL-FIRUKDTASA-N	425.327	1.382	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CC1Cc2ccccc2C1)c1cccc(B(O)O)c1	1804501523	YKZXGEODYIOXJM-NUNAXRQHSA-N	432.329	1.423	50	20	IDGD	
CN1Cc2ccccc2C[C@@H]1C(=O)N1CCC2(CCCN(C(=O)[C@@H](O)CCl)C2)CC1	1805518189	PTCPMUFKPPECDD-UXHICEINSA-N	433.980	1.874	50	20	IDGD	
Cc1ccc(CC(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)o1	1807368492	UINYVENRWMDMLH-WMZHIEFXSA-N	447.300	1.225	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)[C@@H]2CCC(=O)N2C)[C@@H]1c1cccnc1	1808777004	AKBAMUHTQNIESK-GUSZCTEKSA-N	437.338	1.492	50	20	IDGD	
O=C(CSC1CCCC1)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1	1809968996	KRFNPWDOXMWDHW-UHFFFAOYSA-N	444.406	1.887	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)c3ccncc3Cl)CC2)C1	1809971404	VRCJXPWHBLWKBY-UHFFFAOYSA-N	441.724	1.573	50	20	IDGD	
CC(C)OCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1814550727	JXSRAYKSBBSSSZ-INIZCTEOSA-N	429.481	1.139	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CS(C)(=O)=O)n[nH]1	1817059480	JVFPWMQGMKKRCO-CMPLNLGQSA-N	435.344	1.620	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCN2CCOCC2)n[nH]1	1817180585	AIUJWZXAPBDSLB-ZFWWWQNUSA-N	442.358	1.908	50	20	IDGD	
Cc1cc(/C=C/C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)no1	1817472030	DCDMQYNMTLKUSU-JBVUFVISSA-N	449.276	1.405	50	20	IDGD	
Cc1ccc(O)c(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)c1	1817476327	BNPDIAVMHRIUIK-IBGZPJMESA-N	448.288	1.723	50	20	IDGD	
CC(=O)C[C@H](C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819404219	DTKUNNWPVUTIOG-YVEFUNNKSA-N	441.492	1.329	50	20	IDGD	
C[C@H](Br)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN2CCN(C)CC2)[nH]n1	1822186783	JEQGJFGTXOGDBZ-ZFWWWQNUSA-N	441.374	1.433	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2nc(C)c(C)[nH]c2=O)[nH]n1	1822367256	JWUCKDZFUVOFAW-OCCSQVGLSA-N	436.900	1.670	50	20	IDGD	
C=C(CC(=O)OCC)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1	1822415960	VFRDWPSITGVLHN-MRXNPFEDSA-N	448.524	1.284	50	20	IDGD	
COc1ccc(C(=O)N[C@H]2CCc3nc(NC(=O)[C@@H](F)Br)sc3C2)nn1	1823006488	GIJVZJSXINWBAD-JVXZTZIISA-N	444.286	1.858	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H]2CNC(=O)O2)CC1	1824574752	FPDKFAONOUBAOU-ZNMIVQPWSA-N	430.343	1.888	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H]3CCCO3)sc2C1	1825580190	JZIKXFQAMRIGID-AAVYNUALSA-N	444.517	1.368	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ncn(C(C)C)n1)CC2	1825997846	CYGUFSZFPWMONG-QWRGUYRKSA-N	426.930	1.795	50	20	IDGD	
CC(C)/C=C/C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnccc1C(=O)NN)CC2	1827437523	OVXWFDHRHSDJFP-MJRJWQSSSA-N	428.518	1.580	50	20	IDGD	
C[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1)C1(O)CCC1	1829743456	JVFUFIPZRDQLGQ-FHLIZLRMSA-N	437.364	1.230	50	20	IDGD	
O=C([C@@H](F)Br)N1CCC([C@@H]2CCCCN2C(=O)Cn2ccncc2=O)CC1	1831109755	BIMQANDBWUIVLD-WMLDXEAASA-N	443.317	1.554	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CCN2CCOCC2)CC1	1831830272	OGGIAWZZVCDOFU-OALUTQOASA-N	429.989	1.582	50	20	IDGD	
CCc1cc(C(=O)N2CCC([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)n[nH]1	1831871184	MQOFLWBGPKUTBF-LJQANCHMSA-N	432.569	1.578	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3c(C)noc3C)CCO2)C1	1832553048	IOOBRPFJSBVDCP-FXAWDEMLSA-N	427.929	1.698	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(Cl)nc3F)CCO2)C1	1833267218	LBEDZSVEGDBLNY-FZKQIMNGSA-N	434.295	1.962	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](F)Cl)CC2)CC1)[C@@H]1COc2ccccc2O1	1833715390	GATLJMOFIUWRET-RBUKOAKNSA-N	439.915	1.932	50	20	IDGD	
O=C(CCc1cn[nH]c1)NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1	1833812458	HZHJMILHVTXACW-UHFFFAOYSA-N	440.386	1.699	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(C)no3)CCO2)C1	1834227461	GHUGTTIPURZMGI-DYVFJYSZSA-N	430.299	1.227	50	20	IDGD	
CC(C)c1cc(C(=O)N2CCOC[C@]3(CN(C(=O)CCBr)CCO3)C2)on1	1834823656	AZUAODYJAFVSAO-SFHVURJKSA-N	444.326	1.653	50	20	IDGD	
O=C(CCC(F)(F)F)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1835325028	BLRQXTXFLGQNCM-YPMHNXCESA-N	435.212	1.476	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)C(Cl)Cl)CC2)CC1)c1ccc2ncnn2c1	1835633108	NVOSGSJDHFOGPC-UHFFFAOYSA-N	439.347	1.718	50	20	IDGD	
O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)CCc1ccc[nH]1)CCO2	1836011946	PUKYUWFDXNSAAM-GOSISDBHSA-N	428.327	1.189	50	20	IDGD	
C[C@@H](C(=O)N1CCC(N2CCC(NC(=O)[C@H](F)Br)CC2)CC1)n1cncn1	1836414257	BGHPCYKVMDHYHH-WFASDCNBSA-N	445.337	1.101	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836670319	MJJWZJCCPDEXJX-IUODEOHRSA-N	439.778	1.616	50	20	IDGD	
C[C@H](CC(N)=O)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1836911150	UHKJBXFJZGREKD-IAQYHMDHSA-N	436.322	1.187	50	20	IDGD	
Cn1cncc1C(=O)N1CCC(OC2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1837512901	PNTWPIJEOZUYCC-OAHLLOKOSA-N	431.306	1.723	50	20	IDGD	
O=C1C[C@@H](C(=O)N2CCC(OC3CCN(C(=O)CCBr)CC3)CC2)CCN1	1837654598	FXIBUYRPGNRLOO-AWEZNQCLSA-N	444.370	1.296	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(O)cc3F)C2)C1	1839154065	AAGLVEQGABIUKZ-RTBURBONSA-N	449.306	1.838	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnc4cc(C)ccn34)CCO2)C1	1839602050	IBMFKPCIUIFPPN-KKSFZXQISA-N	434.924	1.730	50	20	IDGD	
O=C(c1cnn2cccc(F)c12)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1839620722	RHOUAYJUYHBEOU-GOSISDBHSA-N	445.278	1.347	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(C#N)c3)C2)C1	1840034869	ZMIYGUIZIQRPNK-AUUYWEPGSA-N	436.306	1.412	50	20	IDGD	
O=C(CCc1ccoc1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1840516449	RGTCXYCONRSEAA-DOTOQJQBSA-N	433.274	1.359	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)COCCOCCOCCOC)C2	1841670583	IIESNMOWRLLNRD-QGZVFWFLSA-N	434.961	1.294	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC2(CCCN2C(=O)c2ccc(CS(C)(=O)=O)nc2)C1	1843215244	XHSMTZGOVGLWIC-UHFFFAOYSA-N	427.954	1.708	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCCC12CN(C(=O)CSCC(=O)O)C2	1845871892	BCBDPKISNNLVOA-MKMNVTDBSA-N	435.452	1.893	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@H](CC(=O)OC)NC(=O)OC(C)(C)C)C1	1846213099	OYSLUFITJIMWSI-KBPBESRZSA-N	445.944	1.664	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)c1cc3c(F)cc(F)cc3[nH]1)C2	1846384788	IRJRYABANGFLAB-UHFFFAOYSA-N	433.459	1.636	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@H]2C[C@H](F)CN2C(=O)OC(C)(C)C)C1	1847136775	MELLLJVYTIRBMX-ZNMIVQPWSA-N	447.935	1.791	50	20	IDGD	
O=C(c1cnc2ccc(C(F)(F)F)cn12)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl	1847563596	MQIQEUVMVTXDHK-OBJOEFQTSA-N	430.814	1.768	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1848099148	CTWXSSIXFWNEOW-QPSCCSFWSA-N	442.944	1.011	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@@H](C(=O)NNC(=O)C(=O)NC3CC3)C2)c2ccccc12	10215156	DMEUCHJACSLNSY-CQSZACIVSA-N	438.484	1.127	50	20	IDGD	
Cn1cnnc1SCC(=O)Nc1cccc(C(=O)NNC(=O)c2ccccc2F)c1	14290694	NHBPBRYFETZBEP-UHFFFAOYSA-N	428.449	1.760	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Cn2c(S)nnc2-c2cccs2)cc(OC)c1OC	26956533	AMCGKHRNGIKAOQ-UHFFFAOYSA-N	449.514	1.782	50	20	IDGD	
COc1ccc(COCCCNC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1	727606553	OBFCVNAUEJRJJF-UHFFFAOYSA-N	439.472	1.493	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)NCC(=O)Nc2ccc(-n3cncn3)cc2)c1C	727712853	NQOPQVSNYZBVMD-ODLFYWEKSA-N	447.499	1.994	50	20	IDGD	
O=C(CN1C(=O)c2cccc([N+](=O)[O-])c2C1=O)NNC(=O)c1c(Cl)cccc1Cl	727794573	OFDHWYDGQKYOAH-UHFFFAOYSA-N	437.195	1.959	50	20	IDGD	
CCn1c(SCC(=O)N([C@H]2CCS(=O)(=O)C2)N(C)C)nnc1-c1cccs1	728180740	XDGGRKNAGWFECU-LBPRGKRZSA-N	429.593	1.611	50	20	IDGD	
CN(C)C(=O)c1ccc(C(=O)NNC(=O)c2ccc(CSc3nncn3C)cc2)cc1	728187926	WJUFKYAPKNIYLZ-UHFFFAOYSA-N	438.513	1.884	50	20	IDGD	
COc1ccc(CCCC(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1	728338619	FMIKSUGSHRYUQI-IBGZPJMESA-N	428.441	1.549	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)c1ccc2c(c1)C(=O)NC2=O	729282189	LXLVIRUEIAKLPM-VIFPVBQESA-N	432.230	1.561	50	20	IDGD	
CCN(CC)[C@@H](C(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1)c1ccccc1	729511822	VZFVQQYVXQDHHU-OAQYLSRUSA-N	446.573	1.846	50	20	IDGD	
CC[C@@H](NC(=O)NNC(=O)Cc1nc2ccccc2n1C)c1cccc(S(N)(=O)=O)c1	729613104	NPYMARIFOUSSTB-OAHLLOKOSA-N	444.517	1.245	50	20	IDGD	
O=C(CN1C(=O)N[C@@]2(CCc3ccccc32)C1=O)NNC(=O)c1cccc2ncccc12	730227669	KHADHKGCXRXZJV-HSZRJFAPSA-N	429.436	1.389	50	20	IDGD	
CC(C)C[C@@H](/N=C1/NS(=O)(=O)c2ccccc21)C(=O)NNC(=O)Cc1ccccc1F	731344750	GVTNUAAPUCCUDC-QGZVFWFLSA-N	446.504	1.669	50	20	IDGD	
O=C(NNC(=O)[C@@H](O)c1cccnc1)c1ccccc1NS(=O)(=O)c1cccs1	731865885	WBNLXKLZXTUHPN-INIZCTEOSA-N	432.483	1.439	50	20	IDGD	
COc1ccc(C(=O)N2CCC(C(=O)NNC(=O)C(=O)NC(C)C)CC2)c2ccccc12	732643465	FCETZZMELSLMEV-UHFFFAOYSA-N	440.500	1.373	50	20	IDGD	
CCn1c(=O)c2ccccc2n(CC(=O)Oc2ccc([N+](=O)[O-])c(C(=O)OC)c2)c1=O	732653064	DFKIILCFEIYRKJ-UHFFFAOYSA-N	427.369	1.484	50	20	IDGD	
COc1ccc([C@H]2[C@@H](C(=O)OCC(=O)NNC(=O)c3cccs3)CCC(=O)N2C)cc1	734617640	KONCKMRVVUXXAX-KXBFYZLASA-N	445.497	1.671	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)Sc1nnc(COc2c(Cl)cccc2Cl)n1N	735414679	QXDGJDWSIWHBPT-MRVPVSSYSA-N	433.321	1.916	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)c1	735462195	SZLZNERSOVSELQ-UHFFFAOYSA-N	440.865	1.502	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN(C(=O)COc2ccccc2)C1)c1nnc(O)c2ccccc12	741206702	CVBDXDIRMQNWNI-OAHLLOKOSA-N	449.467	1.414	50	20	IDGD	
O=C(COC(=O)[C@@H]1CCCN(Cc2ccccc2)C1)NNC(=O)c1cccc([N+](=O)[O-])c1	741323292	YTYJTCQDVFAWNL-GOSISDBHSA-N	440.456	1.811	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2cc(N3CCOC3=O)ccc2F)c2ccccc2c1=O	741659580	CAXNKPRBUNRHIB-UHFFFAOYSA-N	439.403	1.587	50	20	IDGD	
Cc1nn(C)c2sc(C(=O)N[C@H](C)C(=O)NNC(=O)[C@@H](C)Oc3ccc(F)cc3)cc12	742036131	FNZUVSADRXBEAT-VXGBXAGGSA-N	447.492	1.816	50	20	IDGD	
CC(=O)N1c2ccc(S(=O)(=O)NNC(=O)c3cc([N+](=O)[O-])ccc3O)cc2C[C@H]1C	743268488	UVOWWDUIXIAWEM-SNVBAGLBSA-N	434.430	1.221	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)NCc2ccccc2S(=O)(=O)N(C)C)cc1	743521560	ROLIGFKTDMRHRM-UHFFFAOYSA-N	434.522	1.539	50	20	IDGD	
CN(C)c1ccc(N2CCC(NC(=O)NNC(=O)CNC(=O)c3cccs3)CC2)cc1	743578970	NCLNARQKWRGCFG-UHFFFAOYSA-N	444.561	1.543	50	20	IDGD	
CNS(=O)(=O)c1ccc(C)c(C(=O)NNC(=O)c2cc(Br)ccc2O)c1	743729652	BVMXWABFWMJEHN-UHFFFAOYSA-N	442.291	1.446	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1)NC1CCCC1	744054033	NQEZINVSZJGGSU-INIZCTEOSA-N	439.494	1.411	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1ccc(-n2cccn2)cc1	744621291	OAURSNDYLMDZDI-UHFFFAOYSA-N	427.486	1.650	50	20	IDGD	
COc1cc(NC(=O)c2ccccc2)c(C(=O)NNC(=O)N2CCOCC2)cc1OC	745991924	LHQIOGOSVARLCN-UHFFFAOYSA-N	428.445	1.643	50	20	IDGD	
COC(=O)c1ccsc1N1CC[C@@H](NC(=O)/C(C#N)=C/c2cc(C#N)n(C)c2C)C1=O	746642286	XUVSOEUTNGHCCD-LEHPZIBWSA-N	437.481	1.882	50	20	IDGD	
O=C(CCOc1ccccc1)NNC(=O)[C@@H]1CS[C@H](Cc2ccccc2F)C(=O)N1	747179223	AWGVQACQHVGCPF-ZWKOTPCHSA-N	431.489	1.585	50	20	IDGD	
Cn1c(=O)nc(O)c2c(C(=O)NNC(=O)c3cccc4cccnc34)cc(C3CC3)nc21	747425876	UYEWVVXRZNQKQK-UHFFFAOYSA-N	430.424	1.535	50	20	IDGD	
Cc1cc(OCc2ccc(C(=O)NNC(=O)CN3C(=O)CN(C)C3=O)cc2)ccc1Cl	747458254	BERBHNAKEYJOKW-UHFFFAOYSA-N	444.875	1.882	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC(NC(=O)NNC(=O)Cc3ccncc3)CC2)cc1	747579890	DFQQXEIJETWLTH-UHFFFAOYSA-N	431.518	1.116	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)CNC(=O)NCc1ccc([N+](=O)[O-])cc1	748213114	VKNYOLTYVBUJBP-UHFFFAOYSA-N	435.824	1.517	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)Nc2ccc(F)cc2)c1)C(=O)N1CCCC1	748246654	NIVVAXJEFVWBEU-UHFFFAOYSA-N	434.449	1.010	50	20	IDGD	
CC[C@@H](Nc1c([N+](=O)[O-])c(C)nn1C)C(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	749521150	NMZHIIKWODQYBS-CYBMUJFWSA-N	442.436	1.180	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNS(=O)(=O)c3cccc(C)c3C#N)CC2)cc1	749772239	UNMQZDFQCDAJOL-UHFFFAOYSA-N	441.557	1.302	50	20	IDGD	
O=C(NCc1nccn1CCc1ccccc1)NNC(=O)c1ccc(-n2cnnn2)cc1	751607188	PWCLVQZUWYWDSG-UHFFFAOYSA-N	431.460	1.246	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCCC(=O)NNc2nc3ccccc3c(=O)n2C)cc1C	752902020	HXDSKYHBMDNDCO-UHFFFAOYSA-N	429.502	1.362	50	20	IDGD	
C[C@]12CCC(=O)N1c1ccccc1C(=O)N2CC(=O)NNc1ccc(C(F)(F)F)nn1	755183519	NXRXOJZDNURVLR-GOSISDBHSA-N	434.378	1.938	50	20	IDGD	
CCOCCCNC(=O)c1cccc(NC(=O)NNC(=O)c2cncc(NC(C)=O)c2)c1	755956368	MRYFVQGWBRTQFS-UHFFFAOYSA-N	442.476	1.663	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2c(C)nc3ccccn23)c(Cl)cc1F	755957318	MSQXMPDPDWSAOJ-UHFFFAOYSA-N	440.840	1.845	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)Nc2ccn(CC(=O)N(C)C)n2)c1	756310630	GBABDHUXNQYFTC-UHFFFAOYSA-N	439.270	1.209	50	20	IDGD	
CC(C)S(=O)(=O)c1ccccc1NC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	756528545	NJWKIJAQSGLESV-UHFFFAOYSA-N	439.515	1.739	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN2CCN(c3nccnc3C#N)C[C@H]2C)cc1C	756909287	NCSUASUTEZSQEB-CQSZACIVSA-N	427.534	1.252	50	20	IDGD	
CN(NC(=O)c1cnn(C)c1-n1cccc1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758786994	QYFHWZYILSEHQC-UHFFFAOYSA-N	431.497	1.460	50	20	IDGD	
COCCS(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1	759258154	HYJDYKYTMVDOQJ-UHFFFAOYSA-N	449.485	1.022	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)c1cnn(CCO[C@H]2CCCCO2)c1C	760122671	BJKLFTHIKBNYKW-FQEVSTJZSA-N	431.493	1.616	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)CCn1c(=O)oc2cc(Cl)ccc21	760438269	SVWZUDSXPYFGPJ-UHFFFAOYSA-N	426.857	1.700	50	20	IDGD	
O=C(NNc1nccc(N2CCOCC2)n1)[C@@H]1CCCN(C(=O)COc2ccccc2)C1	762860753	IOEXTERGEPAYHO-QGZVFWFLSA-N	440.504	1.074	50	20	IDGD	
CC(C)Oc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)C(=O)NNC(=O)c1ccccc1	763425906	MAXBLBUNAJDWJZ-UHFFFAOYSA-N	448.501	1.124	50	20	IDGD	
CC(=O)NNC(=O)C(=O)Nc1ccc(I)cc1Br	763514958	BTLCOMLSVSSXFT-UHFFFAOYSA-N	426.008	1.160	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cccc(OC(F)F)c2)cc(OC)c1OC	763539121	ISYXFNHEAIKFNY-UHFFFAOYSA-N	439.371	1.714	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cnn(-c3ccccc3F)c2C)cc1OC	763550700	QCCVSKBJULOFTP-UHFFFAOYSA-N	441.419	1.737	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)C(=O)Nc1cc(CC2CC2)nn1-c1ccccc1	763560002	YKUDJORCRRWVOD-UHFFFAOYSA-N	447.451	1.953	50	20	IDGD	
CC(C)(C)c1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(S(C)(=O)=O)c2)cc1	763601253	WMUSRWSBWAPVEX-UHFFFAOYSA-N	447.513	1.553	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(OCCC(N)=O)cc2)c2ccccc2n1	763613607	ARLCNLSLIBWWCT-UHFFFAOYSA-N	435.440	1.197	50	20	IDGD	
CC[C@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2OC)cc1	763656921	KBVHJHBYVTXPPF-AWEZNQCLSA-N	442.472	1.388	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(Cl)c2)cc1S(=O)(=O)N(C)C	763747221	CFJVEJKEVNWVFH-UHFFFAOYSA-N	438.893	1.298	50	20	IDGD	
Cc1cc(C)n(-c2cccc(NC(=O)C(=O)NNC(=O)COc3ccc(F)cc3)c2)n1	763839994	OKDGZFPMCUNMFR-UHFFFAOYSA-N	425.420	1.793	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cc(C(=O)NC)ccc2C)cc1	763862238	WLZICZJKDOOVEG-AWEZNQCLSA-N	442.472	1.307	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@@H](C)C(=O)NNC(=O)C(=O)Nc1cc(C)n(CCC#N)n1	763882312	IPEDNYKJZPFPCL-AWEZNQCLSA-N	446.895	1.929	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(C(=O)NC3CC3)c2)cc1OC	763902879	RLNFCPCAUBYCQJ-UHFFFAOYSA-N	440.456	1.386	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C)c(C(=O)OC)c2)cc1OC	763912382	YSNYZSKMIKGFCC-UHFFFAOYSA-N	443.456	1.979	50	20	IDGD	
COc1c(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CC[C@H](C)C3)cccc1C(N)=O	763940357	GQBPHRVFKCCGQL-JTQLQIEISA-N	430.486	1.380	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CC[C@H](C)C3)cccc1-n1cnnn1	763943909	VRTYPAPXJYGFNR-NSHDSACASA-N	439.501	1.557	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc(NC(=O)NC[C@@H]2CCCO2)cc1	763956427	NTMHUKLOIBBVRY-KRWDZBQOSA-N	439.472	1.695	50	20	IDGD	
Cn1c(=O)oc2cc(NC(=O)C(=O)NNC(=O)c3cc4c(s3)CCCCC4)ccc21	763960917	AUOOTWFFIPSSFN-UHFFFAOYSA-N	428.470	1.862	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)Nc1ccnn1C1CCCCC1	764002982	WFZCGZIGJBCVEB-UHFFFAOYSA-N	437.298	1.889	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)Nc1ccnn1-c1ccccc1	764004668	KZDRRYOYLJTDDE-UHFFFAOYSA-N	431.250	1.373	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1cccc(N2CCOC2=O)c1	764013002	VWBBHNALQUFNPW-UHFFFAOYSA-N	432.820	1.705	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1ccc(C(N)=O)c(Cl)c1	764020474	ZDPWJZSIIHNWAE-UHFFFAOYSA-N	425.228	1.501	50	20	IDGD	
O=C(NNC(=O)c1cnccn1)C(=O)Nc1ccc(OCc2cccc(F)c2)c(F)c1	764032276	PZBIRCYPVRINOB-UHFFFAOYSA-N	427.367	1.734	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CC(F)(F)F)cc1NC(=O)CN1CCCCC1	764117851	XBWRADXJGTTYKK-UHFFFAOYSA-N	443.426	1.458	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2O1)C(=O)Nc1ccccc1OC[C@H]1CCCCO1	764151243	IEGOAYYUYPQEMQ-OXQOHEQNSA-N	439.468	1.724	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2O1)C(=O)Nc1ccc(OCC2CCOCC2)cc1	764166971	GMEQHVAMRJDUCM-FQEVSTJZSA-N	439.468	1.582	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2O1)C(=O)Nc1cccc(CN2CCCCC2=O)c1	764168191	ODXSQPHUBHRQFD-LJQANCHMSA-N	436.468	1.289	50	20	IDGD	
O=C(CCc1ccccc1)NNC(=O)C(=O)Nc1cccc(OCC(=O)N2CCCC2)c1	764193328	UNRAWDBYOQIMDC-UHFFFAOYSA-N	438.484	1.407	50	20	IDGD	
CN(C)CC(=O)NNC(=O)C(=O)Nc1ccc(CN2C(=O)Cc3ccc(Cl)cc32)cc1	764203791	DZHPGOLNOMPMTD-UHFFFAOYSA-N	443.891	1.077	50	20	IDGD	
Cc1ncsc1C(=O)NNC(=O)C(=O)Nc1ccccc1I	764247285	PTOYAGNOOAZDHS-UHFFFAOYSA-N	430.227	1.456	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1cccc(N2CCCCCC2)c1	764278356	WTJAPIGRTJCKLY-UHFFFAOYSA-N	426.473	1.938	50	20	IDGD	
CC1CCC(NS(=O)(=O)CC(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)CC1	764336063	XCJPXLUQCQIAPR-UHFFFAOYSA-N	444.504	1.798	50	20	IDGD	
CN(C)C(=O)COc1cccc(NC(=O)C(=O)NNC(=O)CCCc2cccs2)c1	764340088	SAZBUJMAJKBRPG-UHFFFAOYSA-N	432.502	1.324	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)C(=O)Nc2cccc(COc3ccc(CC#N)cc3)c2)cn1	764359312	OZQHVODJQMGKFG-UHFFFAOYSA-N	432.440	1.465	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cc(C(C)C)on3)n[nH]2)cc1OC	764379450	XZUMDVGLVAXZHX-UHFFFAOYSA-N	442.432	1.605	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)C(=O)Nc1ccc(OCCN2CCCCC2)cc1	764385811	KSOALASWRIUBON-UHFFFAOYSA-N	425.489	1.654	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=S)NCCc3cccs3)CC2)cc1	764519154	MXTKJCGYIPUNEC-UHFFFAOYSA-N	431.631	1.912	50	20	IDGD	
CC(C)(C)OC(=O)NNC(=O)Nc1ccc(Cl)c(S(=O)(=O)N2CCOCC2)c1	765109924	FGOIUOKTXGXVDL-UHFFFAOYSA-N	434.902	1.922	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)Cc3nnc(O)c4ccccc34)n[nH]2)cc1OC	765597469	GFHVEWLSHGHEMZ-UHFFFAOYSA-N	448.439	1.746	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1ccc(Br)cn1	765733084	MQATVMJDWYBQPY-UHFFFAOYSA-N	446.305	1.063	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1cc(-c2ccccc2)on1	765735332	JZFMNISLXXJMSB-UHFFFAOYSA-N	433.468	1.561	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)[C@H]1COc2ccccc21	765756015	JWLFEMKHFIKCIN-SFHVURJKSA-N	428.920	1.781	50	20	IDGD	
CC(C)[C@H](NC(=O)C(F)(F)F)C(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12	765974444	ROXRFEXBHGBLKA-ZDUSSCGKSA-N	441.410	1.442	50	20	IDGD	
CC(=O)NC1(C(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)CCCCC1	766647362	DSIPBDXKSQAUAA-UHFFFAOYSA-N	429.565	1.099	50	20	IDGD	
Cc1cc(C)c(C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)c(O)n1	766664788	UCCKRYULZDTLQY-UHFFFAOYSA-N	431.924	1.636	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Cc2ccccc2NC(C)=O)c1	767404181	XNZXIFMTABBLBW-UHFFFAOYSA-N	446.529	1.679	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1cccc(C#N)c1)C(=O)NNC(=O)Cc1ccc2ccccc2c1	767879487	CYQOGOOEXADBSR-OAHLLOKOSA-N	436.493	1.768	50	20	IDGD	
Cc1cc(C(=O)N2CCOCC2)ccc1NC(=O)NNC(=O)COc1ccccc1O	768002231	VZAKYUAHEYFPPE-UHFFFAOYSA-N	428.445	1.405	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)[C@@H](C)NC(=O)OC(C)(C)C)n[nH]2)cc1OC	768276246	JCNKKOTXQDFPLV-LLVKDONJSA-N	433.465	1.768	50	20	IDGD	
CCCC(=O)N1CSC[C@@H]1C(=O)NNC(=O)c1cc(-c2ccc(OC)c(OC)c2)[nH]n1	768280282	XWNBCUIMZYCKDJ-OAHLLOKOSA-N	447.517	1.557	50	20	IDGD	
CCS(=O)(=O)Nc1ccccc1C(=O)NNc1c(OC)cccc1S(C)(=O)=O	768629480	JNMPWALVPOPENY-UHFFFAOYSA-N	427.504	1.617	50	20	IDGD	
CC[C@@H](NC(=O)NNc1nc(O)c2cnn(C)c2n1)[C@@H]1CN(Cc2ccccc2)CCO1	770410087	GYZIILTUYYEDIQ-SJORKVTESA-N	440.508	1.375	50	20	IDGD	
CC(C)S(=O)(=O)c1cccc(C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)c1	770434657	ZDRQJZNISSVSCI-UHFFFAOYSA-N	429.454	1.358	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)c3cccc(S(=O)(=O)N4CCCCCC4)c3)nc21	770979798	KNFNXHLYRSLVCZ-UHFFFAOYSA-N	445.505	1.391	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)c1ccn(-c2ccc(Cl)cc2Cl)n1	772179742	MCNCSWSULPWPNX-UHFFFAOYSA-N	433.255	1.765	50	20	IDGD	
CCOC(=O)c1cnc(C(=O)NNC(=O)c2nn(CC)c(=O)c3ccccc23)c(Cl)c1	772705417	GPGJPEKEWWZRLM-UHFFFAOYSA-N	443.847	1.716	50	20	IDGD	
O=C(NNC(=O)c1cccc(Br)c1)Nc1ccnn1[C@@H]1CCS(=O)(=O)C1	776056553	LNDCAPJVXUSGRD-GFCCVEGCSA-N	442.295	1.472	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)Nc2ccnn2[C@@H]2CCS(=O)(=O)C2)cc1OC	776059557	PQFDDXPYAMZJOU-CYBMUJFWSA-N	437.478	1.117	50	20	IDGD	
COc1ccc(Cn2ccc(NC(=O)C(=O)NNC(=O)COc3cccc(C)c3)n2)cc1	778707077	KLVQGYCOQNWUPY-UHFFFAOYSA-N	437.456	1.413	50	20	IDGD	
CC(C)c1ccc(-n2c(NNC(=O)Cn3ncn(C)c3=O)nc3ccccc3c2=O)cc1	778741788	DGILWUDQNVVUAK-UHFFFAOYSA-N	433.472	1.548	50	20	IDGD	
NS(=O)(=O)c1ccc(CC(=O)NNc2ccc([N+](=O)[O-])cc2Br)cc1	779148397	RWTGVBVOIGXAIG-UHFFFAOYSA-N	429.252	1.691	50	20	IDGD	
COc1ccc(-c2noc(CN3CCN(S(=O)(=O)CBr)CC3)n2)cc1	779204452	DVFBIUZCBJCTGG-UHFFFAOYSA-N	431.312	1.545	50	20	IDGD	
O=C(/C=C/c1ccc(O)c(O)c1)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	779531576	CIELBFVUCFLAGV-SOFGYWHQSA-N	444.919	1.730	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)NCc2ccccc2N2CCN(C(C)=O)CC2)c1	780827402	AXAOZQFQDIIENZ-UHFFFAOYSA-N	425.489	1.968	50	20	IDGD	
Cc1oc(C(=O)NNC(=O)CCNC(=O)OC(C)(C)C)cc1S(=O)(=O)N1CCCC1	780970491	CUTIZZLUPPBHJY-UHFFFAOYSA-N	444.510	1.048	50	20	IDGD	
CN(C)CC1CCN(c2ccc(NC(=O)C(=O)NNC(=O)c3ccc(O)cc3)cc2)CC1	782837244	GWYXVFGLSAUIDG-UHFFFAOYSA-N	439.516	1.570	50	20	IDGD	
Cc1ccc(Cl)cc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)NC(C)C)cn1	783264446	PYCXXQXNKWTIGD-UHFFFAOYSA-N	425.898	1.812	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2cccc(Cl)c2F)nc1	783265731	WSEJXFXXWARMFM-UHFFFAOYSA-N	429.861	1.643	50	20	IDGD	
Cc1cc(S(N)(=O)=O)cc(NC(=O)C(=O)NN=c2sc3ccccc3n2C)c1C	783349979	SQJOKKCHSWEPMM-UHFFFAOYSA-N	433.515	1.075	50	20	IDGD	
Cc1ccc(NNC(=O)C(=O)Nc2cc(NC(=O)CN3CCCC[C@@H]3C)ccc2F)nn1	783950069	JVQMWLCPGKBDOZ-AWEZNQCLSA-N	443.483	1.819	50	20	IDGD	
COc1ccc(Sc2ccc(NC(=O)C(=O)NNC(=O)C(=O)N3CCCC3)cc2)cc1	783996717	KRWRFOAOUHBOGL-UHFFFAOYSA-N	442.497	1.555	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ccc(F)c(F)c2F)cc1S(=O)(=O)NC1CC1	784815134	OXNYNHYBXGTIOL-UHFFFAOYSA-N	442.419	1.935	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2ccc(C(=O)NC(C)C)c(C)c2)n1	785226367	TVACOIGHIGFDMO-UHFFFAOYSA-N	427.509	1.851	50	20	IDGD	
Cc1ccc(N2CCNC2=O)cc1NC(=O)NNC(=O)CCCNC(=O)OC(C)(C)C	786243766	WMWKMTRHKVGBJX-UHFFFAOYSA-N	434.497	1.982	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1)c1ncnn1C	788884857	CYWOHWCDYDVYOE-OXQOHEQNSA-N	433.516	1.834	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Cc2cc(OC)c(O)c(OC)c2)c2ccccc2c1=O	789868994	PLKGWHRDGZBSEM-UHFFFAOYSA-N	426.429	1.143	50	20	IDGD	
COc1cc(OC2CC2)ccc1C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	791615741	QDHGEQRLNFYWET-IBGZPJMESA-N	442.424	1.381	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)NCCCCn1cc(Br)cn1	792221182	MQNQHVMPACIHGF-UHFFFAOYSA-N	440.298	1.844	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)NNC(=O)C(=O)Nc1cccc(N2C(=O)CCCC2=O)c1	792355305	SADPNFVKKDDXOT-UHFFFAOYSA-N	447.451	1.540	50	20	IDGD	
O=C(NNC(=O)c1cccc(NN2C(=O)[C@@H]3CC=CC[C@H]3C2=O)c1)c1ccc([N+](=O)[O-])cc1	792762181	NZOBPQXGAXPQJC-QZTJIDSGSA-N	449.423	1.948	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)c1cnn(CCO)c1-c1ccccc1	792813650	ULQKGJWXHKNFMN-UHFFFAOYSA-N	432.484	1.916	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNc2cccc(S(C)(=O)=O)c2)c(F)cc1C	793018262	QBRGXSWNBUEXTD-UHFFFAOYSA-N	437.449	1.796	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)N1CCC[C@H](C=NNC(=O)COc2ccccc2C#N)C1	794476936	ULWNSODUHYFQEI-MRXNPFEDSA-N	443.504	1.802	50	20	IDGD	
COCC[C@@H]1CCCC1=NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	799867619	MCNJJWWZVRLJAW-SFHVURJKSA-N	437.562	1.949	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)NCc2cccc(CS(N)(=O)=O)c2)c2ccccc2n1	800717627	NRKPSKPJJAVAAZ-UHFFFAOYSA-N	427.486	1.476	50	20	IDGD	
CCc1[nH]nc(C(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)c1Br	802064014	VGCYYFWYFYUORQ-UHFFFAOYSA-N	430.284	1.605	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)[C@@](C)(O)Cn2cc(C(F)(F)F)ccc2=O)cc1	802123369	ODMJSAQUSLDJEQ-SFHVURJKSA-N	441.410	1.537	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)c1sc(-c2c(C)c(C)nn(C)c2=O)nc1C	807370873	VYHYOLVCFGEGTO-UHFFFAOYSA-N	437.522	1.379	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)C(=O)Nc1cccnc1OCc1ccccc1	807429131	MEHRSYINZCVJIJ-UHFFFAOYSA-N	430.428	1.718	50	20	IDGD	
CC(C)CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)NNC(=O)c1ccc(Br)s1	809981320	HARPQLQLHSWXPO-LLVKDONJSA-N	442.339	1.768	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)C(=O)Nc3cccc4c3OCC(=O)N4)n[nH]2)c1	810398779	HYLWXGDDBACMKD-UHFFFAOYSA-N	448.439	1.424	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)CNS(=O)(=O)c2ccccc2C(F)(F)F)nc1	810755171	NGMUSHCEWLUKRQ-UHFFFAOYSA-N	432.380	1.309	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)Nc1cccc(N2C(=O)N[C@@](C)(C3CC3)C2=O)c1	812985939	KSINGFRBOLKUFP-ODXCJYRJSA-N	433.465	1.116	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2cccc(S(=O)(=O)C3CCCCC3)c2)n1	815630820	YKAIITNEUWLGCN-UHFFFAOYSA-N	444.513	1.896	50	20	IDGD	
COc1ccc(NNC(=O)CCc2nc3c(O)nc(=O)n(C)c3[nH]2)c(C(F)(F)F)c1	816703589	KXZVOVDSLBKWHP-UHFFFAOYSA-N	426.355	1.466	50	20	IDGD	
Cc1ncc(S(N)(=O)=O)cc1C(=O)NNC(=O)c1ccc(COc2ccccc2)o1	816829321	LCBHIXIAGLGALR-UHFFFAOYSA-N	430.442	1.284	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)[C@H]1CCCN1c1ncnc2ccccc12	817054196	YHTFFLGCZTVCOX-GOSISDBHSA-N	440.529	1.992	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)c1nccnc1C(=O)NCc1ccc(F)cc1	819727807	KTQDJYIRHIQHHI-UHFFFAOYSA-N	433.440	1.096	50	20	IDGD	
Cc1ccc(N2C[C@@H](C(=O)NNC(=O)c3nn(-c4ccccc4)cc3O)CC2=O)cc1F	844265467	ZANVDMZZROEWEJ-AWEZNQCLSA-N	437.431	1.840	50	20	IDGD	
O=C(Cn1nnc(-c2ccccc2)n1)NN=C1C(=O)Nc2cc(OC(F)(F)F)ccc21	915049470	WDVRCQSZIXATDR-UHFFFAOYSA-N	431.334	1.711	50	20	IDGD	
NS(=O)(=O)c1ccc(CC(=O)NNC(=O)c2ccc(COc3ccccc3)o2)s1	915189150	KLQRBPMNIQCAIX-UHFFFAOYSA-N	435.483	1.571	50	20	IDGD	
O=C(Cc1nc(-c2ccccc2)cs1)NNC(=O)[C@H]1CC(=O)N(Cc2ccccn2)C1	915259616	DZYLIELWXWBSES-INIZCTEOSA-N	435.509	1.944	50	20	IDGD	
CCc1c(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)cnn1Cc1ccccc1	915287328	GJQXSBPEILMEGK-UHFFFAOYSA-N	440.529	1.862	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCC(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)cc1C	915788130	VIKVBYWCIOPLQQ-QGZVFWFLSA-N	433.530	1.813	50	20	IDGD	
CC(=O)N1CCC(NC(=O)NNC(=O)[C@H](C)Oc2cccc(Br)c2)CC1	915931199	JZGNOQDOZPDQEA-NSHDSACASA-N	427.299	1.558	50	20	IDGD	
CC(=NNC(=O)c1csc(N2CCOCC2)n1)c1ccc(OCC(=O)N(C)C)cc1	916338691	YKUVVPIQDVLIMQ-UHFFFAOYSA-N	431.518	1.601	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCc2ccc(N3CCCC3)nc2)c2ccccc2c1=O	916389326	XJUBCXILXJJWGG-UHFFFAOYSA-N	435.488	1.556	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H]2CCN3CCC[C@H]3C2)c1	916573270	JTOOQHRIPJXYIZ-SJORKVTESA-N	437.566	1.288	50	20	IDGD	
O=C(CN1CCN(C(=O)COc2ccc(Cl)cc2)CC1)NNC(=O)c1ccccc1	917163058	ALBKXYYZAHXCEB-UHFFFAOYSA-N	430.892	1.324	50	20	IDGD	
O=C(NNC(=O)N1CCC(N2CCNC2=O)CC1)c1ccc(COc2ccccc2)o1	918002688	SNHHCFNYYZFHBD-UHFFFAOYSA-N	427.461	1.703	50	20	IDGD	
C[C@@H](Cc1cccc(O)c1)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	919784421	QDBKKQWAGRCQGW-HNNXBMFYSA-N	446.529	1.752	50	20	IDGD	
CCOC(=O)c1ccc(CNC(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)cc1	919919787	ZFZCPQCWOADCJU-UHFFFAOYSA-N	435.506	1.771	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)Nc2cccc(CN3CCC[C@H]3C(N)=O)c2)cc1	920930933	WAAIDEDPSLOSAY-IBGZPJMESA-N	436.472	1.240	50	20	IDGD	
NC(=O)[C@@H]1CCCN1Cc1cccc(NC(=O)NNC(=O)c2cc(Br)c[nH]2)c1	920933348	UTNLXXCIOUCEHX-HNNXBMFYSA-N	449.309	1.693	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)NC[C@@H](c1cccc(F)c1)N1CCOCC1	921200959	IHNKTGMVLFHXMX-SFHVURJKSA-N	440.479	1.799	50	20	IDGD	
Cc1nc(CSCC(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cs1	1317737636	ODAUBOQZFDTVOH-UHFFFAOYSA-N	434.952	1.447	50	20	IDGD	
CN(C)[C@@H]1CCCC[C@H]1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	1318405522	BSKQDLKTKZXDRC-QZTJIDSGSA-N	437.566	1.288	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCC[C@H](c3n[nH]cc3NC(C)=O)C2)cc1OC	1320768765	UHHPURWZNHPECJ-HNNXBMFYSA-N	444.492	1.026	50	20	IDGD	
Nc1cnnc(NNC(=O)CCNS(=O)(=O)c2ccc(Br)cc2)c1Cl	1322679239	GNWMWIRYHLLQIX-UHFFFAOYSA-N	449.718	1.286	50	20	IDGD	
C[C@@H](NC(=O)CCc1ccccc1)C(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1	1327033340	RIKSSFNJRYHWJA-MRXNPFEDSA-N	446.548	1.918	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@H](C(=O)NNc2cncc(Br)c2)[C@@H](C)O)cc1	1341980605	SFJXEERWIWUNDR-ABAIWWIYSA-N	443.323	1.324	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H]3CCC[C@H]3C)C2)C1	1778337299	FMEZPRHIWQHCLV-DSZWDOIBSA-N	429.521	1.387	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(CCN(C(=O)c3cn4cc(F)ccc4n3)C2)C1	1778541393	CJTQVYXECXOESH-GOSISDBHSA-N	439.285	1.702	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(Cl)c4nncn4c3)C2)C1	1778948328	UKHXJYXOPPTCJN-KSSFIOAISA-N	442.303	1.080	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)C(C)(C)n3nc(C)ccc3=O)C2)C1	1779232064	BDTZMDXGSCTKFE-IIBYNOLFSA-N	438.956	1.524	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCBr)C2)c1n[nH]cc1[N+](=O)[O-]	1779602786	CTPNAPGXCXMOAF-MLGOLLRUSA-N	444.286	1.230	50	20	IDGD	
CCn1nc(C(C)C)cc1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](Cl)COC)CCO2	1780403847	FJLDJHQJJZEHLW-FOIQADDNSA-N	426.945	1.724	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](COC)NC(=O)OC(C)(C)C)CCO2	1781217094	FFTSEKQPBZAUFL-MDOVXXIYSA-N	447.960	1.373	50	20	IDGD	
O=C(c1ccc([N+](=O)[O-])cc1F)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781334073	UURUFOPPYCOKDE-CJNGLKHVSA-N	448.220	1.868	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(C)(C)NC(C)=O)C2	1781897708	OKBBDNBOPAEBOT-SPYBWZPUSA-N	446.386	1.589	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)C2)C1	1781938281	AEXUHFDVEWPUAO-GTNSWQLSSA-N	442.266	1.527	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](C)NNc1ccccc1)CCO2	1783528084	JJFAJQHYMSWXJO-KHYOSLBOSA-N	439.354	1.605	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3nn[nH]c3C(F)(F)F)CCO2)C1	1783537103	LLRLNQRASQCTNY-SDBXPKJASA-N	440.220	1.050	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)CCc3cncc(OC)c3)CCO2)C1	1783873824	VGVFZETUVXAMCA-XLIONFOSSA-N	425.913	1.107	50	20	IDGD	
CCOc1ncc(Cl)cc1C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](Cl)COC)C2)C1	1783877644	MNMSQYMUTIDIME-BEFAXECRSA-N	446.331	1.831	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)c3ccco3)C[C@@H]21	1783964767	ZWSBBRRWOPBYER-VRUQUDLLSA-N	429.311	1.324	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(-n4cccn4)cc3)C[C@@H]21)[C@H](O)CCl	1784092714	UODFVIWPUWAODN-KANFNMMFSA-N	432.908	1.065	50	20	IDGD	
CCOC(CC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](Br)CC)CCO2)OCC	1784166500	HIJGUSSMGYKUBN-KSSFIOAISA-N	435.359	1.779	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(OC)c(C)c(OC)c3)C2)C1	1785177971	GSTFXYFSGMLRJK-HRAATJIYSA-N	440.924	1.710	50	20	IDGD	
COc1cccnc1CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21	1785248036	TUDZMRNZFKRTLN-XEZPLFJOSA-N	430.332	1.806	50	20	IDGD	
COc1cc(F)ccc1CC(=O)N1CC[C@]2(CN(C(=O)CCBr)CCO2)C1	1785656348	UYDWDYBCSVJOMN-LJQANCHMSA-N	443.313	1.992	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(C(F)F)no3)[C@H]2C1	1787142878	ZDWIYCFQKKFROZ-YVNDNENWSA-N	436.253	1.989	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC1(c2ccc(NC(=O)c3cc(=O)cco3)cc2)CCC1	1787593879	QXZUKSUCROWGCW-UHFFFAOYSA-N	426.473	1.761	50	20	IDGD	
Cn1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)C(Cl)Cl)C[C@@H]32)c(C(F)F)n1	1787736128	QBDZMACMODQQIF-QXEWZRGKSA-N	425.263	1.755	50	20	IDGD	
CSCC[C@@H](O)C(=O)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1	1788143698	RMLYYRFSRYPPRB-LJQANCHMSA-N	442.346	1.228	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)c3cncc(F)c3)CCC2)cc1)c1cccc(B(O)O)c1	1788146073	ZSPZKTSPXXNREB-UHFFFAOYSA-N	433.248	1.962	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)c3cccc(F)n3)CCC2)cc1)c1cccc(B(O)O)c1	1788147784	FNBIRJDZRYYLGE-UHFFFAOYSA-N	433.248	1.962	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)Cn3cncn3)[C@H]2C1	1788728017	XJGVMFADNLIMDI-YXMSTPNBSA-N	442.358	1.067	50	20	IDGD	
CSc1cccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](O)CCl)C[C@@H]32)c1O	1789245860	SRZZNCBZKSLOBD-MXAVVETBSA-N	428.938	1.307	50	20	IDGD	
CCC1(C(=O)NC2(c3ccc(NC(=O)c4cnccc4C(=O)NN)cc3)CCC2)COC1	1789522040	ZTCFRHKIRSBGAI-UHFFFAOYSA-N	437.500	1.859	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC1(c2ccc(NC(=O)[C@@H]3CCC(=O)N3C)cc2)CCC1	1790558641	MXJHGZZBAKSVIR-KRWDZBQOSA-N	429.521	1.114	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3cncnc3)C[C@@H]21	1791058489	ZODTVZUSPPIUOT-TUUVXOQKSA-N	425.327	1.172	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc(OC)c(F)c3)C[C@@H]21	1791252614	QAZQVVGNXRJXOG-ZIEJDFEHSA-N	429.876	1.076	50	20	IDGD	
Cc1cc(C)n(CCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Br)C[C@@H]32)n1	1791509084	YKGUJSGHUBNJGV-JKQORVJESA-N	445.333	1.560	50	20	IDGD	
NC(=O)c1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Br)C[C@@H]32)cc1	1791897308	LETJHKBNIZARHR-ZQDZILKHSA-N	442.285	1.069	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc[nH]c3nccc1-3)C2	1792867357	ADFOEMYKYPYSCU-NFFDBFGFSA-N	435.322	1.749	50	20	IDGD	
C[C@H](N[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](O)CCl)C1CC1)c1ccccc1	1792983499	KQQODVDDCJSBNQ-UYOAKOKDSA-N	449.979	1.305	50	20	IDGD	
Cn1ncc2c(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)CCBr)cccc21	1795114476	NOLKMXZIDKCDFT-IVWMJMPLSA-N	435.322	1.562	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1c[nH]c2nccc-2c1	1796197497	OTEBHRDESFRZDS-YGTYGHESSA-N	425.316	1.954	50	20	IDGD	
Cc1ccn2ncc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@H](C)Br)C4)c2c1	1796272080	BBVXJPFBSBQDHN-ZJOBFFGXSA-N	435.322	1.629	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc2ccccc12)c1cccc(B(O)O)c1	1797426300	DTLHBYZUNQDNFH-BCDXTJNWSA-N	445.284	1.186	50	20	IDGD	
Cc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)CBr)C3)c(C)n1C	1798390186	ZHAPBABQNMCWGW-RMIITELYSA-N	426.355	1.876	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ncccc1F	1798991136	NNNBFLIOUGQNCK-SSJPOKSSSA-N	426.452	1.607	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc3ccc(F)cn13)C2)[C@@H](F)Br	1799347606	SPQVPTSBVHFGJL-ANGCBRKESA-N	443.248	1.367	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1cc(F)ccn1)C2	1800640239	MLOZQLLSABXPHN-ZDFLXESQSA-N	442.329	1.916	50	20	IDGD	
CCc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](Br)CC)n(C)n1	1800642032	SJHGCLXENDLHCF-FAXLKDOZSA-N	427.343	1.359	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)Br	1800763202	STGOABNDRPUEGO-BKQXGZDCSA-N	443.338	1.115	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nc(C)oc1C(F)(F)F)C2	1800975208	LLRLPPWTHKANJA-WRWGMCAJSA-N	439.818	1.459	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3sc(C)cc3[nH]1)C2	1800979750	YTVKPDFCSHQSLZ-IPJQOSJUSA-N	425.938	1.995	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@](C)(O)C[C@H]1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](F)Cl)C2	1802054674	XYVWMKSWQDGJLH-HKQPUQOZSA-N	447.935	1.919	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)[C@@H]2CCCCO2)[C@H]1c1cccnc1	1802586565	AQYIEELNVUNYPR-LVCYWYKZSA-N	431.537	1.030	50	20	IDGD	
COCCOCC(=O)N1CC[C@H](CNC(=O)[C@@H](C)CBr)[C@H]1c1cccnc1	1803007380	CAKBGUXDTWAACZ-YXJHDRRASA-N	442.354	1.781	50	20	IDGD	
COc1cccnc1CCC(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]1c1cccnc1	1803142033	VHZDIQPVMLHODU-HGHGUNKESA-N	446.935	1.724	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cccn3ccnc23)[C@H]1c1cccnc1)[C@H](O)CCl	1803142542	FBGQQRQPYXXZLP-JQHSSLGASA-N	427.892	1.649	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]1c1cccnc1	1803147818	MDLJRQBTZIXSPN-CBBWQLFWSA-N	432.746	1.861	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NC[C@@H]1CCN(C(=O)[C@H](F)Cl)[C@@H]1c1cccnc1	1804369205	PBNLFDDGENOZTH-QGTPRVQTSA-N	433.871	1.447	50	20	IDGD	
O=C(CCc1ccco1)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1804585028	RYDDEFTZHXUUOA-CVDCTZTESA-N	447.300	1.307	50	20	IDGD	
CCOC(=O)N[C@@H](O)C(=O)N1CCC2(CCCN(C(=O)[C@H](C)CBr)C2)CC1	1805385458	ZJXCKYLWAFPRAR-KGLIPLIRSA-N	448.358	1.313	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H](CNC(=O)CSC(=N)N)[C@@H]1c1cccnc1	1807005990	NIEKYHXHPSLRRN-IFIJOSMWSA-N	432.377	1.950	50	20	IDGD	
C=CC[C@H](C(=C)C)C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1807376234	TVBPIYAMXLBKJN-MZYLBHOOSA-N	447.344	1.849	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1808260797	XKNWHWCJYFEJMT-WDSOQIARSA-N	429.713	1.098	50	20	IDGD	
Cc1ccnc(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)c1	1808534270	ZQHOZCSDCCMRRL-SIKLNZKXSA-N	444.300	1.098	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)n2)[C@@H]1c1cccnc1	1810542441	RMUZZXDEODYGKH-KBXCAEBGSA-N	445.552	1.454	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)c1ccc(O)c([N+](=O)[O-])c1	1810690290	DZIKJDATVGKTCX-BMGDILEWSA-N	448.863	1.615	50	20	IDGD	
CC1(C)CC(C(=O)N[C@@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)C1	1815348108	DLPRLSQTLPMZAQ-OAHLLOKOSA-N	427.335	1.485	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(F)s1)CC2)c1cccc(B(O)O)c1	1815354668	ADWQFMNFXINUMQ-GFCCVEGCSA-N	445.306	1.563	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1ccccc1F)CC2)c1cccc(B(O)O)c1	1815360866	PTPZKXKSPVRWLJ-AWEZNQCLSA-N	439.277	1.502	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)cc(O)n1	1817475537	SDRSEVCAHBSDLU-SFHVURJKSA-N	449.276	1.118	50	20	IDGD	
Cc1c[nH]cc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819403025	SSTPOQVVYFHVGZ-QGZVFWFLSA-N	436.476	1.664	50	20	IDGD	
Cc1nc(C)c(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)o1	1819799408	FOMHZIKMWDZVAQ-KRWDZBQOSA-N	437.265	1.314	50	20	IDGD	
Cc1ccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)c(C)n1	1820046846	XAFOUNSDHNPLRK-FQEVSTJZSA-N	447.304	1.721	50	20	IDGD	
CN1CCN(CCC(=O)N2CCCC[C@@H]2c2cc(NC(=O)C(Cl)Cl)n[nH]2)CC1	1822418120	LAOIBLVBXADOHK-CQSZACIVSA-N	431.368	1.843	50	20	IDGD	
O=C(N[C@@H]1CCc2nc(NC(=O)[C@@H]3CC[C@H]4CCC(=O)N4C3)sc2C1)[C@@H](O)CCl	1822621401	FHFDPIOVCSRKMO-NMKXLXIOSA-N	440.953	1.056	50	20	IDGD	
C[C@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1)n1ccnc1	1824316775	FMUKJPVAIGKCTC-IEBWSBKVSA-N	432.569	1.437	50	20	IDGD	
CN[C@H](CC(=O)N1CCCC[C@@H]1C1CCN(C(=O)CO[Si](C)(C)C)CC1)C(=O)O	1826947053	SBBBDFFUPMWFBG-IAGOWNOFSA-N	427.618	1.520	50	20	IDGD	
N#Cc1cccc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)c1	1827052585	PVPFKMUDWWBVJI-QHCPKHFHSA-N	445.328	1.785	50	20	IDGD	
C[C@@H]1CC[C@H](C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)O1	1828402033	BBNCMJHCFHPWCY-MAODMQOUSA-N	428.338	1.167	50	20	IDGD	
C[C@@H](C(=O)NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1)C1(O)CCC1	1833070668	GXRBMOIQRLTWMY-XJKSGUPXSA-N	448.377	1.800	50	20	IDGD	
Cc1nn(C)cc1C(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)Br)CC2)CC1	1833583835	KYJDSFHLQSWTIO-CYBMUJFWSA-N	440.386	1.697	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccn(C(C)(C)C)n3)CCO2)C1	1833588755	NYQJVIHZHUPTHF-QRWLVFNGSA-N	426.945	1.726	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)CCc3cnc[nH]3)CC2)CC1	1833789383	FGEGZULBDBZZHI-CQSZACIVSA-N	440.386	1.697	50	20	IDGD	
O=C(c1scnc1C(F)(F)F)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1834571640	XDHTXWBFAZMAOQ-FZMZJTMJSA-N	445.822	1.766	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC(N2CCC(NC(=O)[C@@H](N)c3ccccn3)CC2)CC1	1834725492	VHUCRWGJIAYYIU-NRFANRHFSA-N	447.656	1.505	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](CN)c1ccccc1)CCO2	1835813919	WKUFDVGOPRVULG-XQBPLPMBSA-N	437.968	1.593	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3ccc[nH]3)CCO2)C1	1836016063	VGLJSIWKZADCGV-OALUTQOASA-N	432.348	1.640	50	20	IDGD	
COCc1c[nH]c(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](Cl)COC)CC3)CC2)c1	1836105366	AAFBOXWELKLIDO-SFHVURJKSA-N	440.972	1.600	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3[nH]nc4ncccc34)CCO2)C1	1836451101	PIBGAECYEXRDJS-FQEVSTJZSA-N	435.912	1.293	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)Cc3cc(C)no3)CC2)CC1	1837093981	VPDQPIXHUUVUKV-GOSISDBHSA-N	427.929	1.778	50	20	IDGD	
N=C(N)SCCC(=O)N1CCC(OC2CCN(C(=O)CCBr)CC2)CC1	1837652022	XLAHVGTXMISMAI-UHFFFAOYSA-N	449.415	1.787	50	20	IDGD	
C[C@H](Cc1ccccn1)C(=O)N1CCOC[C@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1837717803	ONJKGZAGYWFMCS-GCJKJVERSA-N	449.624	1.568	50	20	IDGD	
C#CC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](Br)Cc3ccccc3)C2)C1	1839810226	LYWOCYRUWGKLQM-YLJYHZDGSA-N	435.318	1.082	50	20	IDGD	
COc1ccsc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2	1840034321	HWBKJDFMMZLGOY-SJKOYZFVSA-N	447.351	1.610	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccc(C)c(C)c3)C2)C1	1840150959	URGZLFHZQVDFMY-DENIHFKCSA-N	438.952	1.556	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)c3cccs3)C2)C1	1840156532	USCVGRJKGOPNEU-DOXZYTNZSA-N	430.954	1.562	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1CCc3ccccc31)CCO2	1840260649	WCXZBUXBMIETQR-DXIQSLLYSA-N	436.936	1.427	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@H](O)CC(=O)N1CCCC12CN(C(=O)CCBr)C2	1845229853	XIZACVFRCVUHDS-CYBMUJFWSA-N	448.358	1.251	50	20	IDGD	
CN1CCCn2nc(C(=O)N3CCCC34CN(C(=O)[C@@H](F)Br)C4)cc2C1	1845727316	LQLKUYPWHOZSRW-CQSZACIVSA-N	428.306	1.226	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1[C@H](C(=O)N1CCCC13CN(C(=O)[C@H](O)CCl)C3)C2	1847093017	LYPZXMPBUVPAOW-XUWVNRHRSA-N	441.956	1.578	50	20	IDGD	
O=C(c1cc(Br)c(O)cc1F)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl	1847566117	KSWYQJJBJAGRGL-OBJOEFQTSA-N	435.677	1.709	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CCc1ccc(C)cn1	1848205369	WJLURUYATREWID-FMEPYYHXSA-N	436.516	1.658	50	20	IDGD	
COC(=O)c1ccc(C)c(S(=O)(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)c1	23055703	XWERWZPZHWZRNL-UHFFFAOYSA-N	438.458	1.431	50	20	IDGD	
Cc1cccc(C)c1OCc1nnc(SCC(=O)NNC(=O)c2ccccc2)n1N	24216316	YCXXORUFGWFRCP-UHFFFAOYSA-N	426.502	1.741	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)c2ccccc2OCC(=O)N(C)C)cc1	27741282	FZNGZBSHHJJAEH-OAHLLOKOSA-N	429.473	1.781	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)NCC(=O)N2CCc3ccccc32)c2ccccc2c1=O	726281307	LJBVMMDXKIAHDI-UHFFFAOYSA-N	448.483	1.511	50	20	IDGD	
C#Cc1cccc(NC(=S)NNC(=O)[C@H](CSC)N2C(=O)[C@H]3CCCC[C@H]3C2=O)c1	727501245	PICJBXBPOLFNTN-BBWFWOEESA-N	444.582	1.892	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)COCC(=O)NCc1cccnc1	727753346	ZJWPAIHKRFXFNX-UHFFFAOYSA-N	439.497	1.608	50	20	IDGD	
COc1ccc(C(=O)NCCCC(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)cc1	728209920	MXSMHGMNLXKZFQ-UHFFFAOYSA-N	446.529	1.789	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@@H]2CCN(CCc3ccccc3)C2)c1	728603901	SXQGWPHCAUAWQC-SFHVURJKSA-N	444.557	1.599	50	20	IDGD	
Cc1nn2c(=O)c3ccccc3[nH]c2c1C=NNC(=O)C1CCN(c2ncccn2)CC1	728782609	OAZBDVIOKKTRQJ-UHFFFAOYSA-N	430.472	1.641	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)N(C)CCCC(=O)NNC(=O)Cc2cccnc2)cc1	728852758	URLKWTJNDFEHNC-UHFFFAOYSA-N	432.502	1.075	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)N1CCN(S(=O)(=O)c2ccc(Cl)cc2)CC1	728958429	KTRSPFBYMQDBQO-UHFFFAOYSA-N	437.909	1.025	50	20	IDGD	
O=C(Nc1sccc1C(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1ccccc1Cl	730207246	LOYLORGUHVHVTB-SNVBAGLBSA-N	441.918	1.850	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H]1CNC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	730831516	LXQSDMYYSFXZAN-AWEZNQCLSA-N	440.522	1.434	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NC[C@@H]1CCOc2ccccc21	731218809	IMIPQPCCTMTTHO-AWEZNQCLSA-N	431.518	1.798	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)C1CCN(S(=O)(=O)c2cn(C)c(C)n2)CC1)c1ccccc1	731998101	XRKCZTVEENJZAJ-GOSISDBHSA-N	447.561	1.470	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cnn(-c3ccc(O)nn3)c2C)cc1Br	732175613	MHTIDBUEYOIWBW-UHFFFAOYSA-N	447.249	1.522	50	20	IDGD	
CCN1CCCC[C@H]1CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	732471215	MCORTTJZGIHXMQ-KRWDZBQOSA-N	437.566	1.290	50	20	IDGD	
Cc1ccc(CCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cn1	732473465	QTHWDLVLYCIKRM-UHFFFAOYSA-N	431.518	1.361	50	20	IDGD	
CCCS(=O)(=O)N1CCC(NC(=O)NNC(=O)NCc2ccc(Cl)cc2)CC1	732992867	ZSFBMTPLBMEBKS-UHFFFAOYSA-N	431.946	1.558	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1	733110084	QWIBNJHNPRMVID-UHFFFAOYSA-N	427.486	1.634	50	20	IDGD	
CCn1c(=O)c2ccccc2n(CC(=O)NNc2nc(-c3ccccn3)nc(C)c2C)c1=O	734256552	YMWUBLJUGJATRC-UHFFFAOYSA-N	445.483	1.795	50	20	IDGD	
COc1ccccc1[C@H](CNC(=O)NNC(=O)c1cnn(C)c1)NC(=O)OC(C)(C)C	735582880	SSGWGOOCMOYEGO-HNNXBMFYSA-N	432.481	1.639	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)c1ccccc1F)C(=O)NNc1cc(C)nc(C)n1	736717271	YWDKNWHIKLGDSH-AWEZNQCLSA-N	427.527	1.776	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)C(=O)N1CCCC[C@H]1C	737047086	HGIFNNJGBZHZMG-MOPGFXCFSA-N	444.580	1.319	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@H]2CCC[C@@H]2NC(=O)OC(C)(C)C)c2ccccc2c1=O	739679124	PHVYPAIQIGENEP-HOTGVXAUSA-N	443.504	1.871	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2ccc(C#N)cc2[N+](=O)[O-])ccc1OC(C)C	741205304	XERXFUDBOVEPLB-UHFFFAOYSA-N	434.430	1.886	50	20	IDGD	
COCCNS(=O)(=O)c1cccc(C(=O)NNC(=O)c2cccc3ccccc23)c1	741696154	OFLPLZBAUDNXIB-UHFFFAOYSA-N	427.482	1.839	50	20	IDGD	
NC(=O)CS(=O)(=O)c1ccc(C(=O)NNc2c(F)cc(F)cc2Br)cc1	742708054	GDMMVTMTMUYFFH-UHFFFAOYSA-N	448.245	1.743	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)/C=C\c1ccccc1)C(=O)NNc1ncnc2[nH]cnc12	743471268	XRBCDYISMOBDBQ-GDAGCXPBSA-N	447.546	1.508	50	20	IDGD	
CCc1ccccc1NC(=O)CN1CCN(CC(=O)NNC(=O)c2cccc(C#N)c2)CC1	744385880	YEOWDBDQOJTIGK-UHFFFAOYSA-N	448.527	1.138	50	20	IDGD	
Cc1nc(-c2cccnc2)nc(O)c1CCC(=O)NNC(=O)c1ccc2c(c1)OCCO2	745375884	YOAYKHCWBPEBDG-UHFFFAOYSA-N	435.440	1.718	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCc2ccccc2)cc1C(=O)NNC(=O)N1CCOCC1	745995821	DEMDWNVPPLFLQG-UHFFFAOYSA-N	432.502	1.160	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNc1ccc(S(=O)(=O)Nc2nccs2)cc1	747943934	OAIMNXFFZCAUHS-UHFFFAOYSA-N	437.528	1.879	50	20	IDGD	
O=C(CNC(=O)NCc1ccc([N+](=O)[O-])cc1)NNC(=O)c1cc(-c2ccccc2)on1	748213256	ZOEYBSKAMADTPU-UHFFFAOYSA-N	438.400	1.510	50	20	IDGD	
C=CCN1C(=O)C(=O)N(CC(=O)NNC(=O)c2cc3c(s2)CC[C@H](C(C)(C)C)C3)C1=O	748555524	ROYHNQASMPMZRL-ZDUSSCGKSA-N	446.529	1.637	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)NCc1cccc(NC(=O)c2cccc(F)c2)c1	748616647	FCQNLRQRDGWQTF-AWEZNQCLSA-N	432.452	1.960	50	20	IDGD	
O=C1CN(S(=O)(=O)c2ccc(C(=O)NNc3ccc(OC(F)F)cc3)cc2)CCN1	748643958	IDNCFZPGIFJOMW-UHFFFAOYSA-N	440.428	1.165	50	20	IDGD	
O=C(Cn1cc(Br)c(O)nc1=O)NNc1ccc(OCC(F)(F)F)cc1	748704322	YZSMMQUHHGJMJC-UHFFFAOYSA-N	437.172	1.796	50	20	IDGD	
CNS(=O)(=O)C[C@@H]1CCCN1C(=O)/C(C#N)=C\c1cc(C)n(C[C@H]2CCCO2)c1C	749510092	KKNWYRIVLZUHSH-OHBNSYPMSA-N	434.562	1.731	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)NCc2ccccc2CN2CCC(O)CC2)c1	749592507	WRIYJRAFIHRUIO-UHFFFAOYSA-N	442.516	1.805	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN1C(=O)c1ccc2c(c1)OCO2)c1ccc(Cl)cc1O	749734586	NJDIFIXAOKXHOR-CQSZACIVSA-N	431.832	1.840	50	20	IDGD	
COCC(C)=NNC(=O)c1ccc(S(=O)(=O)N2CCN(Cc3ccccc3)CC2)cc1	750934340	DIXPPAGMJXSGHU-UHFFFAOYSA-N	444.557	1.945	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNS(=O)(=O)c2cc(C(=O)OC)c(C)o2)cc1	751143275	YIYIGQFYGDQITC-LBPRGKRZSA-N	426.447	1.550	50	20	IDGD	
COC(=O)c1cc(NC(=O)NNC(=O)COc2ccc(OC)cc2)c(C)c([N+](=O)[O-])c1	753140222	ZUKWZFBFFYYPJK-UHFFFAOYSA-N	432.389	1.930	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)c2ccc(CNS(C)(=O)=O)o2)c1	753607868	HKVOHMOIJLPUFB-UHFFFAOYSA-N	446.279	1.175	50	20	IDGD	
CCS(=O)(=O)N1CCC(CNC(=O)NNC(=O)c2cccc(OC(F)F)c2)CC1	754189224	ZJGYTRRQVVFTIR-UHFFFAOYSA-N	434.465	1.294	50	20	IDGD	
COCC(C)(C)C=NNC(=O)C[C@H]1c2cc(OC)c(OC)cc2CCN1S(C)(=O)=O	754918180	RACNJIYOHWCTPX-INIZCTEOSA-N	441.550	1.727	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNS(=O)(=O)c2csnc2C(=O)OC)cc1	755956098	JVOWTYNHNLNEOK-SNVBAGLBSA-N	429.476	1.105	50	20	IDGD	
Cc1c(NC(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)cccc1C(=O)Nc1ccccc1	756280392	OUVSLRVWEAFFMM-CQSZACIVSA-N	430.486	1.835	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CN(CCO)Cc2cc(Br)ccc2F)c1	756510644	WSLPJSMZMMPXKF-UHFFFAOYSA-N	449.280	1.715	50	20	IDGD	
O=C(Cn1cc(NC(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)cn1)NC1CC1	756797381	ZVAJKKAGDJVVPU-UHFFFAOYSA-N	426.412	1.157	50	20	IDGD	
CC(C)Cn1cc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cn1	756802449	JGBIECJXSHVLQV-UHFFFAOYSA-N	434.522	1.790	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCc2ccccc2)cc1C(=O)NNc1ccc(C(N)=O)nn1	757391932	HWKSYVFJOVGTKX-UHFFFAOYSA-N	440.485	1.119	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)c2ccc(C(=O)NNc3ccc(C(N)=O)nn3)cc2)cc1	757399627	OBGQHWLLPCKKFN-UHFFFAOYSA-N	440.485	1.466	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)Nc3cc(C)n(CCC#N)n3)n[nH]2)cc1OC	757830928	MJSPWQPHZZLKHX-UHFFFAOYSA-N	438.448	1.979	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(F)(F)[C@@H](C(=O)NNC(=O)CNC(=O)c2ccco2)C1	757909561	PXCRPIUCRCYPPO-LLVKDONJSA-N	430.408	1.049	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)c2ccc(Br)cc2n1	758058089	XNCVJQJFICXGNL-VIFPVBQESA-N	429.296	1.004	50	20	IDGD	
C[C@@H](CC(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1)NC(=O)C1CCCC1	758781410	BVDZSJWTZWZKLW-HNNXBMFYSA-N	439.557	1.707	50	20	IDGD	
COC(=O)c1cn([C@H]2CCN(C(=O)NNC(=O)c3cccc(Br)c3)C2)nn1	760682529	VTNPWPKCDBAJAC-LBPRGKRZSA-N	437.254	1.129	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(C)nn1[C@H]1C[C@H]2CC[C@H]1C2	763656511	CEHQUOPYXCKLKV-JYJNAYRXSA-N	441.488	1.726	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)C(=O)Nc1cc(F)cc(F)c1	763695849	YOWZNADOJBFLAD-UHFFFAOYSA-N	428.189	1.892	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cc(OC)cc(OC)c2)ccc1Cl	763773357	VVSQOWDXPHAUKL-UHFFFAOYSA-N	449.847	1.934	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)C(=O)Nc1ccc2c(c1)CCCC(=O)N2	763802828	HTCAAXRYSGWRLA-UHFFFAOYSA-N	441.400	1.035	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccnn1CCc1ccccc1	763812091	CEVPTDGFWGKWJI-UHFFFAOYSA-N	432.440	1.162	50	20	IDGD	
CCc1nnc(-c2cccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc3ccccc3F)c2)o1	763856280	GOQXLMOEPWVEIL-GFCCVEGCSA-N	441.419	1.992	50	20	IDGD	
N#Cc1ccc(Cn2cnc(NC(=O)C(=O)NNC(=O)Cc3c[nH]c4ccccc34)n2)cc1	763860536	GFPFISGIODPXGH-UHFFFAOYSA-N	442.439	1.008	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cnn(CC(F)(F)F)c2)ccc1OC(C)C	763916251	KHBHFENWZPOCAB-UHFFFAOYSA-N	443.382	1.641	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)C(=O)N1CC2(CCC2)c2c(F)cccc21	763945424	XNPLCNBWGHIDEJ-UHFFFAOYSA-N	449.442	1.947	50	20	IDGD	
CN(C1CCCCC1)S(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc[nH]2)cc1	763980149	VMVXZYDGUNOPKV-UHFFFAOYSA-N	447.517	1.368	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)N(C)C(=O)CO2	764010824	DSTKPYHZCMRMJO-UHFFFAOYSA-N	432.820	1.104	50	20	IDGD	
Cc1cc(N2CCSCC2)ccc1NC(=O)C(=O)NNC(=O)c1ccc(Cl)nc1	764091382	DBBTYHPWQLOHIU-UHFFFAOYSA-N	433.921	1.996	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1O)C(=O)Nc1cccc(CN2CCCC2=O)c1	764127280	UIBHPIVYBQYYJF-UHFFFAOYSA-N	430.848	1.568	50	20	IDGD	
O=C(NNC(=O)c1ccoc1)C(=O)Nc1ccc(CC(=O)N2CCc3ccccc32)cc1	764159027	PKWCQNUXUKZRNR-UHFFFAOYSA-N	432.436	1.811	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)ncn3C)c1	764232006	LXKZDOBNHYRZIZ-UHFFFAOYSA-N	446.261	1.744	50	20	IDGD	
COC(=O)CCSCc1cccc(NC(=O)C(=O)NNC(=O)c2scnc2C)c1	764247228	OZDFEMFWINOZKA-UHFFFAOYSA-N	436.515	1.648	50	20	IDGD	
COC(=O)c1ccc(OC(C)C)c(NC(=O)C(=O)NNC(=O)Cc2ccccc2F)c1	764320368	ZKBCECLLISNOFM-UHFFFAOYSA-N	431.420	1.728	50	20	IDGD	
COCCOc1ccc(F)cc1NC(=O)C(=O)NNC(=O)c1cnn(-c2ccccc2)c1	764343933	VUZNXVCFUQRKGA-UHFFFAOYSA-N	441.419	1.436	50	20	IDGD	
NC(=O)c1ccc(Oc2ccc(C(=O)NNC(=O)CNC(=O)c3cccnc3)cc2)cc1	764345813	XEPDOYFVOYWSAF-UHFFFAOYSA-N	433.424	1.164	50	20	IDGD	
COC(=O)c1c(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)sc(C)c1C	764350237	BURQYGZYWXOQMN-UHFFFAOYSA-N	441.469	1.737	50	20	IDGD	
Cc1cc(Br)ncc1NC(=O)C(=O)NNC(=O)CSc1ccccc1O	764403804	BWMWKPPEWZYFQS-UHFFFAOYSA-N	439.291	1.736	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COCCO1)C(=O)Nc1ccc(Sc2ccc(Cl)cc2)cc1	764430465	WQKCQAMWHSZISL-INIZCTEOSA-N	435.889	1.993	50	20	IDGD	
COCCOc1c(Cl)cccc1NC(=O)C(=O)NNC(=O)c1cncc(NC(C)=O)c1	764433100	JTXOIPSEQJTKGI-UHFFFAOYSA-N	449.851	1.118	50	20	IDGD	
CCN1CCC[C@H]1CNC(=S)NNC(=O)CN1CCN(Cc2ccc(C)cc2)CC1	764518748	HZEABWZAZCIACH-FQEVSTJZSA-N	432.638	1.092	50	20	IDGD	
CCOc1cccc(NC(=S)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)c1	764519280	PANFLHFVRNEWSX-UHFFFAOYSA-N	441.557	1.861	50	20	IDGD	
CC(C)(Oc1ccc(F)cc1)C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	766635626	BGDJLPFHUFJCEO-UHFFFAOYSA-N	442.491	1.589	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1)N1CCCC1=O	766669690	RCDOFSVXKJEOCP-GOSISDBHSA-N	435.956	1.006	50	20	IDGD	
CNS(=O)(=O)c1cccc(NC(=O)[C@H](C)NC(=O)[C@@H](Br)C(C)(C)C)c1	767977656	BXKLKTUKOYGJBO-GXFFZTMASA-N	434.356	1.848	50	20	IDGD	
COc1ccc2c(c1)OC[C@@H](NC(=O)NNC(=O)c1sc(N3CCOCC3)nc1C)C2	768105624	NZOOLCFZVGVFDT-AWEZNQCLSA-N	447.517	1.244	50	20	IDGD	
COCc1c(C(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)cnn1-c1ccccc1	768386679	PFMWZEKXRHUAFL-UHFFFAOYSA-N	441.875	1.750	50	20	IDGD	
COC(=O)c1[nH]c(C)c(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1C	769038474	SRFOQWFEBBIKLQ-UHFFFAOYSA-N	448.501	1.277	50	20	IDGD	
COc1ccccc1COC1CCN(C(=O)NNC(=O)CNC(=O)c2ccco2)CC1	769715508	RNYMKZAZJRUMLX-UHFFFAOYSA-N	430.461	1.440	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)N[C@@H]1CCN(c2ccccc2C(N)=O)C1	770514657	PYYJINSWOUXNFW-UKRRQHHQSA-N	445.907	1.816	50	20	IDGD	
CS(=O)(=O)c1cc(S(=O)(=O)NNC(=O)c2ccc(Cl)nc2)c(Cl)s1	770633133	OHHSMPSLEMWFKI-UHFFFAOYSA-N	430.316	1.477	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)N1CCO[C@@H](C(=O)OC(C)(C)C)C1	770659435	SDIDCNZKUYIOGZ-SWLSCSKDSA-N	427.885	1.891	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)c1ccc(C[C@@H]2CC(=O)NC2=O)cc1	772971376	ZCOLACIDZAXYNU-SWLSCSKDSA-N	429.860	1.774	50	20	IDGD	
O=C(NNC(=O)N1CC[C@H]2[C@H](CCCN2C2CC2)C1)C1CCN(c2ncccn2)CC1	773006475	UHJCOAVUNLFYPD-MJGOQNOKSA-N	427.553	1.383	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccc(OC(F)F)c3cccnc23)n1	773500717	WJJRPAFDBBHFFO-UHFFFAOYSA-N	432.387	1.436	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1ccc(C(F)(F)F)cn1	773548157	ZXLHJLDQWKKNLE-UHFFFAOYSA-N	428.392	1.987	50	20	IDGD	
COC(=O)c1c(F)cccc1NNC(=O)CN1C(=O)N[C@]2(CCc3ccccc32)C1=O	773637165	AYMIEGXIRYUXKW-NRFANRHFSA-N	426.404	1.449	50	20	IDGD	
CNS(=O)(=O)c1ccc2c(c1)N(C(=O)C(=O)NNc1c(Cl)cccc1Cl)CC2	773692216	ZPOVSUYKZLAJGI-UHFFFAOYSA-N	443.312	1.934	50	20	IDGD	
CCCNS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2cnc3ccccc3n2)cc1	773718194	JMYRTUAHCNONQD-UHFFFAOYSA-N	428.474	1.400	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)[C@H]3C[C@@]3(C)C(C)C)CC2)cc1	773857776	NZDKREKQXUSLQI-NQIIRXRSSA-N	436.578	1.131	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)NC(=O)CC2	774009579	RGGUNZBDEVKRJZ-LLVKDONJSA-N	430.848	1.778	50	20	IDGD	
Cc1cc(CNC(=O)NNC(=O)c2cccc(Br)c2)ccc1S(N)(=O)=O	775227709	HKURPZUDJAFORB-UHFFFAOYSA-N	441.307	1.549	50	20	IDGD	
CC(C)C[C@@H](C(=O)NNc1cccc(S(C)(=O)=O)c1)N1C(=O)[C@H]2CC=CC[C@H]2C1=O	776540884	DCNSOYSCAGQEBQ-KSZLIROESA-N	433.530	1.899	50	20	IDGD	
Cc1cc(C(=O)N2CCN(S(=O)(=O)CBr)CC2)c(C)n1-c1ccccn1	777779391	LNDMXASYMZKURZ-UHFFFAOYSA-N	441.351	1.929	50	20	IDGD	
O=C(NN=Cc1ccc([N+](=O)[O-])cc1F)c1cccc(S(=O)(=O)N2CCOCC2)c1	777878102	DBOJQVBVKWZLQC-UHFFFAOYSA-N	436.421	1.519	50	20	IDGD	
Cc1cc(C)nc(-n2nc(C)c(CC(=O)NNC(=O)CNC(=O)OC(C)(C)C)c2C)n1	778438452	STFKOBMCTLBUPD-UHFFFAOYSA-N	431.497	1.111	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)CSc1nncn1-c1cccc(Cl)c1	778444858	AFIOWJRXVZICJN-UHFFFAOYSA-N	440.913	1.685	50	20	IDGD	
CN(C)C(=O)COc1ccccc1C(F)(F)C(=O)NNc1ccccc1S(C)(=O)=O	778902471	LFVFVPWMYAZFNR-UHFFFAOYSA-N	441.456	1.792	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N2CCCN(C(=O)C3CC3)CC2)cc1Br	780991285	YYVPITMTDKJSPI-UHFFFAOYSA-N	439.310	1.756	50	20	IDGD	
COC(=O)c1ccccc1S(=O)(=O)N1CCC(C(=O)NNc2ccnc(F)c2)CC1	781357499	KQSOPQYZVJBNCT-UHFFFAOYSA-N	436.465	1.551	50	20	IDGD	
COCCN(CCOC)S(=O)(=O)c1ccc(C(=O)NNc2ncncc2Cl)cc1	781830880	YUVOOGVJAWUHLS-UHFFFAOYSA-N	443.913	1.170	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)c2cnc3ncc(Br)cc3c2)C[C@@H](C)O1	781886842	USMGRYLHWPBGNM-VXGBXAGGSA-N	436.310	1.653	50	20	IDGD	
CN(C)C(=O)COC(=O)/C(C#N)=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	782180969	MWFJKPVJLJOHQI-ZROIWOOFSA-N	429.864	1.617	50	20	IDGD	
COCCn1cc(C(=O)NNc2ccc(S(=O)(=O)Nc3nccs3)cc2)c(C)n1	782851005	HAILXQHXCIHNPS-UHFFFAOYSA-N	436.519	1.852	50	20	IDGD	
CC[C@H](C)NS(=O)(=O)c1cccc(NC(=O)C(=O)NNC(=O)Nc2ccccc2C)c1	783417184	MZPWXXPIRYEKBQ-AWEZNQCLSA-N	447.517	1.863	50	20	IDGD	
CCOCCCn1c(NNC(=O)CCn2c(C)cc(O)cc2=O)nc2ccccc2c1=O	783635601	XYNKAULRDLPYBM-UHFFFAOYSA-N	441.488	1.532	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NN=C(C)[C@@H]1CCCO1)N(S(C)(=O)=O)CC2	783809356	CBSYQIGJWQBLGS-IRXDYDNUSA-N	439.534	1.624	50	20	IDGD	
COCCOc1ccc(C#N)cc1NC(=O)C(=O)NNc1ccc(Br)cn1	784340604	ZXEPHSSIDFQSSR-UHFFFAOYSA-N	434.250	1.823	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2cccc(S(C)(=O)=O)c2)n(-c2ccccc2F)n1	784838957	BLUBMTCDHMETGS-UHFFFAOYSA-N	431.449	1.805	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ccc(Cl)nc2)cc1-n1nnnc1C1CC1	784869798	MFKDDPOVTJBUIK-UHFFFAOYSA-N	428.840	1.679	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)n(-c2ccc(F)cc2)n1	785023888	OXDRJVJGWVNRLX-UHFFFAOYSA-N	442.363	1.333	50	20	IDGD	
COc1cc(F)cc(NNC(=O)C(=O)Nc2ccccc2CN2CCN(C(C)=O)CC2)c1	785237238	MHXVHYUOJILLTI-UHFFFAOYSA-N	443.479	1.580	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1ccc2c(c1)OC(F)(F)O2	785337540	HADRCNQNXRHVCO-UHFFFAOYSA-N	443.384	1.502	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)Nc2ccc(-c3cnn(C)c3)nn2)cc1	788786431	NBUHAELOSSXFNU-CYBMUJFWSA-N	425.449	1.896	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1c2c(nn1-c1ccc(Cl)cc1)CCC2	792265804	JICDGNVOZXGMRS-GFCCVEGCSA-N	449.895	1.152	50	20	IDGD	
CC[C@@H](C)[C@@H](OC)C(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	792789078	HUPHPOPHINZNHI-DNVCBOLYSA-N	433.530	1.987	50	20	IDGD	
CN(C)N(C(=O)[C@H]1CCN(c2cc(Cl)ccc2Cl)C1=O)[C@@H]1CCS(=O)(=O)C1	792851929	YTNHDFUBJCRDDX-OLZOCXBDSA-N	434.345	1.839	50	20	IDGD	
CCn1c(NNC(=O)Cc2ccc(S(=O)(=O)N(C)C)cc2)nc2ccccc2c1=O	792942166	LGXHXTNKYDTHPH-UHFFFAOYSA-N	429.502	1.353	50	20	IDGD	
O=C(NNC(=O)[C@H]1OCC[C@H]1c1ccccc1)C(=O)Nc1cccc(Br)n1	793067643	KTMACDIYIMKJKF-WFASDCNBSA-N	433.262	1.503	50	20	IDGD	
CS(=O)(=O)C1(CNC(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)CCC1	793282211	XFCQIOVMUJDCML-UHFFFAOYSA-N	429.442	1.574	50	20	IDGD	
CNS(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)c2cc3c(s2)CCC3)cc1C	794577349	UXWLRHCCJGHSLA-UHFFFAOYSA-N	429.545	1.077	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C[C@H]2COCCN2C(=O)OC(C)(C)C)o1	795557205	HYSQANWRAQBSCI-HNNXBMFYSA-N	438.525	1.908	50	20	IDGD	
CNC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccc3ccccc3c2)c(C)c1	797001183	GKXIRBXFKJAVNH-UHFFFAOYSA-N	448.479	1.602	50	20	IDGD	
Nc1c(C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)ccnc1-c1ccccc1	797484655	CVLRRZDSDGTQHU-UHFFFAOYSA-N	435.396	1.857	50	20	IDGD	
O=C(NNc1cncc(Cl)n1)C(=O)Nc1ccc(Cl)c(CN2CCOCC2)c1	797537634	WMYACVAYBRQOEJ-UHFFFAOYSA-N	425.276	1.697	50	20	IDGD	
Cc1cc(OCC(=O)N2CCN(S(=O)(=O)CBr)CC2)ccc1[N+](=O)[O-]	797749860	BESPINCSDKGRGG-UHFFFAOYSA-N	436.284	1.108	50	20	IDGD	
CN(NS(=O)(=O)c1ccc(C#N)s1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	797835133	KVTMASDSOIQUJO-UHFFFAOYSA-N	429.524	1.418	50	20	IDGD	
CNC(=O)CNC(=O)c1cccc(NC(=O)C(=O)NNc2nc3ccccc3cc2C)c1	800631530	RHERRPVVBOVRCJ-UHFFFAOYSA-N	434.456	1.101	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)N[C@@H](Cn1ccccc1=O)c1ccccc1	800762090	AMHSETDXXMJKTJ-IBGZPJMESA-N	431.452	1.871	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)CN2C(=O)[C@@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2=O)cc1Cl	802077625	WVFAJHWNOKZRAC-DIRVTVSLSA-N	448.863	1.317	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)c2sc(S(N)(=O)=O)cc2C)c(OC)cc1Cl	802084174	PTLWUCGDJNXGRS-UHFFFAOYSA-N	448.910	1.841	50	20	IDGD	
N#CCCCS(=O)(=O)c1ccc(C(=O)NNC(=O)Nc2ccc3c(c2)OCO3)cc1	802100218	KUWAZESEEMXXSP-UHFFFAOYSA-N	430.442	1.959	50	20	IDGD	
Cn1cccc1C(=O)C(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	806342733	QYLLFHVGBZGZRM-UHFFFAOYSA-N	440.481	1.148	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)Nc1cc2ccccn2n1	806651076	JZYULFGALRSMBV-UHFFFAOYSA-N	442.501	1.975	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(NC(=O)C(=O)NNc2cccc([N+](=O)[O-])c2)ccc1F	806968913	SVQSCFYTBMWIQP-UHFFFAOYSA-N	425.398	1.066	50	20	IDGD	
O=C1COC[C@@H](C[C@@H]2CN(C(=O)C(=O)NNc3cccc(Cl)c3)c3ccccc32)N1	806984017	KPQZLNFWUIRYNP-CZUORRHYSA-N	428.876	1.819	50	20	IDGD	
NS(=O)(=O)c1ccccc1CNC(=O)NNC(=O)c1cc(F)ccc1Br	807604464	GOZWHFUHTKCOFO-UHFFFAOYSA-N	445.270	1.380	50	20	IDGD	
C#CC[C@]1(C(=O)NNC(=O)CCN2C[C@H](C)O[C@@H](C)C2)CCCN1C(=O)OC(C)(C)C	809556920	PERPMDAESFHYNJ-PNLZDCPESA-N	436.553	1.426	50	20	IDGD	
O=C1CC(C(=O)NNC(=O)CNC(=O)c2ccco2)(c2cccc(Br)c2)C1	810308473	ZJADWHYQQCDQPR-UHFFFAOYSA-N	434.246	1.220	50	20	IDGD	
Cn1c(=NNC(=O)C(=O)Nc2ccc(C(N)=O)cc2OCC(F)F)sc2ccccc21	810393542	TXFUBFHNGFDWCT-UHFFFAOYSA-N	449.439	1.553	50	20	IDGD	
CC[C@@H](Nc1c([N+](=O)[O-])c(C)nn1C)C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	812727462	RJIJTOIEEYIZRL-CQSZACIVSA-N	439.498	1.221	50	20	IDGD	
CNS(=O)(=O)c1cc(NC(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)ccc1C	812916490	WEYTUSYICTZOOI-UHFFFAOYSA-N	441.535	1.302	50	20	IDGD	
CNC(=O)NCCC(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccc(C)cc2C)c1	814194514	WHARUACVMCFQQJ-UHFFFAOYSA-N	447.517	1.184	50	20	IDGD	
COC(=O)c1ccc(C(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)[nH]1	814211952	WQHUGBPQHCIOBV-UHFFFAOYSA-N	445.435	1.634	50	20	IDGD	
CN(Cc1ccccc1S(N)(=O)=O)C(=O)NNC(=O)c1ccc(Br)s1	814272026	YUJWVMWZSBSYOP-UHFFFAOYSA-N	447.336	1.644	50	20	IDGD	
Cc1nc(NC(=O)C(=O)NNc2c(Br)cccc2Br)nn1C	815637686	CZDIJHHDAARXKP-UHFFFAOYSA-N	432.076	1.730	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1cnc(-c2ccccc2)nc1	815752187	HOPMHFRQILIIAF-UHFFFAOYSA-N	440.485	1.476	50	20	IDGD	
COC(=O)c1cc(NNC(=O)CCNS(=O)(=O)c2ccc(F)c(F)c2)ccc1C	816689259	ACQHXEIERQGRJW-UHFFFAOYSA-N	427.429	1.872	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1nc(-c2cccs2)n(-c2cccc(F)c2)n1	818854153	XCVCTQHFYXXGKY-LLVKDONJSA-N	449.489	1.331	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)c1cc([N+](=O)[O-])ccc1Sc1nc[nH]n1	821955610	YWMLWGXCVNXVRC-AWEZNQCLSA-N	442.413	1.465	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1ccc(C(F)(F)F)nc1O	822197024	HMYOLOMYZFCRNS-UHFFFAOYSA-N	431.396	1.482	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NNC(=O)c2c(C)nc3ccccn23)ccc1OC(C)C	838613282	OSHXMSFOFNBCNC-UHFFFAOYSA-N	440.460	1.728	50	20	IDGD	
CCN1CCC[C@H]1CNC(=S)NNC(=O)c1cccc(S(=O)(=O)N(CC)CC)c1	884004364	VROIOFXGBCBPKI-INIZCTEOSA-N	441.623	1.310	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@@H]1CC(c2cccc(F)c2)=NO1	916134370	KYEXMUAKNCVWAB-HNNXBMFYSA-N	433.465	1.381	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)NC[C@H](c1ccc(C)o1)N1CCOCC1	916228375	AIRWWIQTZMABTL-QGZVFWFLSA-N	446.504	1.769	50	20	IDGD	
CC(C)(C)C(=O)N1CCC(NC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)CC1	916375027	BZZNJFAASCPLDW-UHFFFAOYSA-N	428.493	1.559	50	20	IDGD	
Cn1cc(CCNC(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)cn1	916595250	WCROMYVMTDFFOP-UHFFFAOYSA-N	445.483	1.365	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)CN2C(=O)c3cccc([N+](=O)[O-])c3C2=O)c2ccccc2n1	917365449	SZHXDFTUHKJULU-UHFFFAOYSA-N	433.380	1.509	50	20	IDGD	
Cc1ccc(C(=O)NNS(=O)(=O)c2ccc(C(=O)NCC(F)(F)F)cc2)c(O)c1	917753995	VOSLMCJQKHJONQ-UHFFFAOYSA-N	431.392	1.616	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@H](C)CN2CCCC2)c1	918221600	ZHNGQIBFCFFMKL-INIZCTEOSA-N	439.582	1.393	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccccc1Cl)NNC(=O)c1ccc(Cl)cc1O	918358241	MBCDOTAJPIMEKP-UHFFFAOYSA-N	432.285	1.829	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)[C@@H]2CCCN(S(=O)(=O)CC)C2)cc1	918548623	HLJXDDXWUQSAAA-LSDHHAIUSA-N	427.523	1.062	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)c2ccc3c(c2)S(=O)(=O)N(C[C@H]2CCCO2)C3=O)n1	918557304	VPWFHTNIGITRMP-CQSZACIVSA-N	431.474	1.174	50	20	IDGD	
O=C(NNC(=O)N1CCN(C(=O)CCC2CCCC2)CC1)c1ccc(-n2cnnn2)cc1	918779333	MWCTXALARJBOIA-UHFFFAOYSA-N	440.508	1.131	50	20	IDGD	
O=C(NC[C@@H]1CCCCO1)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	920343926	HHPRFOLXUYGBCL-SFHVURJKSA-N	446.529	1.678	50	20	IDGD	
O=C(COC(=O)[C@H]1CCN(c2ccc(F)cc2)C1=O)NNC(=O)c1cccc(Cl)c1	920569546	OEPJLGFIWBLWOE-INIZCTEOSA-N	433.823	1.836	50	20	IDGD	
CC(=O)NCCNC(=O)/C(C#N)=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	920848977	KHTPKVGVUICLHG-GDNBJRDFSA-N	428.880	1.238	50	20	IDGD	
O=C(NC[C@@H](c1cccc(F)c1)N1CCOCC1)NNC(=O)[C@H]1COc2ccccc2O1	921199038	GOVWLMHEMMSNRA-FXAWDEMLSA-N	444.463	1.369	50	20	IDGD	
CNC(=O)c1cccc(CCNC(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)c1	1252063758	VNHRFAMPXAZHMF-UHFFFAOYSA-N	447.536	1.566	50	20	IDGD	
O=C(CCS(=O)(=O)c1ccc2c(c1)OCCO2)NNc1cncc(Br)c1	1319529580	QPAZIWODWVLXNI-UHFFFAOYSA-N	442.291	1.922	50	20	IDGD	
O=C(NNC(=O)[C@@]1(F)CCN(C(=O)OCc2ccccc2)C1)c1n[nH]c2c1CCCC2	1320096046	ZAKRSHKRQLGZLC-OAQYLSRUSA-N	429.452	1.800	50	20	IDGD	
O=C(NNC(=O)c1sccc1S(=O)(=O)N1CCC(O)CC1)c1ccccc1Cl	1329382404	WUXGIFMXFNVUBL-UHFFFAOYSA-N	443.934	1.622	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(CCN(C(=O)c3cccc4c3OCCO4)C2)C1	1777834129	ARQJMRPBNPDJGK-LJQANCHMSA-N	439.306	1.686	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(Cl)Cl)C2)c1nccc2nc[nH]c12	1777927365	WBPUUACNXCHPCE-KZULUSFZSA-N	426.304	1.889	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)/C=N/O[C@@H]3CCCCO3)C2)C1	1779106315	OAGYJWONUPQRRW-NYBIFMDASA-N	432.315	1.129	50	20	IDGD	
COc1nc(C)ccc1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](C)Br)CCO2	1779743597	OSDZONDZEHDYEA-SCLBCKFNSA-N	426.311	1.626	50	20	IDGD	
CN(C)c1ccc(C(=O)N2CC[C@@]3(CN(C(=O)CCBr)CCO3)C2)cn1	1779760431	HXYXWKXBZVTGOT-GOSISDBHSA-N	425.327	1.376	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(COC)c[nH]3)C2)C1	1780079154	NACQAIUIEVCELT-KDOFPFPSSA-N	428.327	1.778	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(CN(C(=O)c3ccon3)CCO2)C1	1780097398	YTCUHRSTVSNEKS-HXUWFJFHSA-N	444.400	1.265	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(CCN(C(=O)Cc3ccc(F)c(C#N)c3)C2)C1	1781301203	RKFWANCKKFTGKO-NRFANRHFSA-N	433.556	1.921	50	20	IDGD	
O=C(CNc1ccc(F)cc1)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781331822	XWIFIWUBLREBDU-WBVHZDCISA-N	432.265	1.758	50	20	IDGD	
O=C(CCc1cccc(O)c1)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781333059	BFPUUAUKQJUPBU-AEFFLSMTSA-N	429.286	1.845	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccnc4c(O)cccc34)C2)C1	1782510884	DKTTXJIAMKPYBZ-IERDGZPVSA-N	433.892	1.638	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cnc4ccccn34)CCO2)C1	1783348091	UZVMRXNRWBERFY-AUUYWEPGSA-N	435.322	1.951	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3noc4c3CCCC4)CCO2)C1	1783534537	LDJUYCNRAJMYQL-KPZWWZAWSA-N	426.311	1.780	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cccc(NC(=O)OC)c3)CCO2)C1	1783880773	LNUZDRCUYMPEGE-JXFKEZNVSA-N	439.896	1.562	50	20	IDGD	
C[C@@H](NC(=O)c1ccccc1)C(=O)N1CCO[C@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783952650	UTMIFAMJOSFYEF-YJYMSZOUSA-N	428.316	1.439	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@](C)(O)C(F)(F)F)C[C@@H]21	1783969893	QUHVCTPRXWPNCR-JLPNCARGSA-N	445.276	1.310	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/c3ccccc3[N+](=O)[O-])C[C@@H]21)[C@H](O)CCl	1784096226	BBNNSUZIBQXGAI-HZJWCDLWSA-N	437.880	1.187	50	20	IDGD	
COc1cc(F)ccc1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1784917200	MWZNWCIKMZPTAM-YOEHRIQHSA-N	433.249	1.968	50	20	IDGD	
Cc1ccc(C(=O)NCC(=O)N2CC[C@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)cc1	1785561431	SAFOHWORHXSIAA-QFIPXVFZSA-N	435.952	1.820	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC1(c2ccc(NC(=O)Cc3cnccn3)cc2)CCC1	1786226656	PRKODDYYISQRQT-UHFFFAOYSA-N	445.483	1.466	50	20	IDGD	
CC[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCBr)[C@H]2C1)N(CC)CC	1786404791	QHQFVOZOPRNHND-NXOAAHMSSA-N	432.403	1.872	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)COc3ccccc3F)C[C@@H]21	1786407318	PUKWVHZHJMOVDZ-ZQIUZPCESA-N	443.313	1.969	50	20	IDGD	
Cc1cnn([C@@H](C)C(=O)NC2(c3ccc(NC(=O)c4ccc(B(O)O)cc4)cc3)CCC2)c1	1788143572	ONEUVKIJBQEPME-KRWDZBQOSA-N	446.316	1.880	50	20	IDGD	
C[Si](C)(C)OCC(=O)Nc1ccc(C2(NC(=O)C[C@@H]3NC(=O)NC3=O)CCC2)cc1	1789647828	YYWGUMJIDMYBFC-HNNXBMFYSA-N	432.553	1.570	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnn4ccncc34)C[C@@H]21	1789867911	JESRADICXPZRJZ-BCRCDCHUSA-N	440.331	1.559	50	20	IDGD	
CC(C)=NO[C@@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)CBr)C[C@@H]21	1789952757	RASZFFDTPVGXIH-QXKUPLGCSA-N	432.359	1.798	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3cnccn3)C[C@@H]21	1790963365	GPANNVKHIKWBLX-HJWJTTGWSA-N	439.354	1.562	50	20	IDGD	
Cc1nnc(CCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](C)Br)[C@H]3C2)s1	1791057332	SRGOFNAGJUDVAT-PYJNHQTQSA-N	445.383	1.542	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3CCc4ccccc4O3)[C@H]2C1	1791231217	ZOZWXAFDFMKNPT-CAVMOMJPSA-N	436.936	1.614	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccn(C(F)F)c3=O)C[C@@H]21	1791255442	RPSAZTQHZZDOHF-MXAVVETBSA-N	447.866	1.091	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cccc(OC)c3C)C[C@@H]21	1791257800	UCQHDIKMYXPNFS-JPLJXNOCSA-N	438.952	1.780	50	20	IDGD	
CCN(CC)[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](O)CCl)c1ccccc1	1792984411	ZVELZWCGDVILQG-WPVAHCMFSA-N	437.968	1.259	50	20	IDGD	
O=C(CSc1ccc(F)cc1F)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2	1793291151	XUDXUUKKYPSQQA-UOHMRFDXSA-N	434.892	1.246	50	20	IDGD	
CO/C=C(\C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1793880140	RDGVWWWKFIFEIF-DLRZWJSXSA-N	445.944	1.258	50	20	IDGD	
COc1ncc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)CBr)C3)cc1F	1794361542	NADSBIDVFWOQQN-DNVSUFBTSA-N	444.301	1.464	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(Cl)nc1F	1794538091	JRWMCUMRSXAEKW-ZSBIGDGJSA-N	446.870	1.438	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(N2CCCNC(=O)C2)n1	1794840138	CXDCQKFXDCYFHZ-YYIAUSFCSA-N	447.967	1.677	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)n1cccc1C=O	1795746762	QWMCBJKOMBOFEM-LBKYZSNHSA-N	440.338	1.482	50	20	IDGD	
C[C@@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@](C)(Cl)CCl)C2)n1cccc1C=O	1795750261	JISGUJBOGXUQSL-WXZWTWHISA-N	430.332	1.688	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C[C@@H](C)NC(=O)OC(C)(C)C	1796389835	SUXHPLIVPZLXMA-OWVAZHOYSA-N	431.961	1.897	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2occc2c1	1797038808	VBEJLRPMEBZNTJ-UPHUGPLXSA-N	428.489	1.009	50	20	IDGD	
CC(=O)N1CCN(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@](C)(Cl)CCl)C3)CC1	1797933087	PJHURZMONYNXIB-YYAJDYIMSA-N	433.380	1.025	50	20	IDGD	
COC(=O)c1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CO[Si](C)(C)C)c(C)c1	1797959291	LOCFKDWDVBWTDN-XEMDLRDOSA-N	448.592	1.836	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2n(n1)CCCO2	1798096710	MQZRRIDHTYQAGY-FQUUOJAGSA-N	425.327	1.948	50	20	IDGD	
CC(C)Cc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Br)n(C)n1	1799346112	CNHQDLZZTGZDMX-NOXHYTERSA-N	445.333	1.512	50	20	IDGD	
COc1ccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Br)cc1	1799346802	AIXOGJSXPZFJQD-RMHZUWNSSA-N	429.286	1.518	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2)c1cc2cccnc2nc1O	1799922088	JCYUGEQCBPPIQV-YWVIFJGQSA-N	449.305	1.324	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CC[C@@H](C(=O)OC)C1)C2	1800637633	FLYYTCVFPNAVGX-FGZZBPHYSA-N	445.354	1.339	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN1CCC(C)CC1)C2	1800638196	RLHSZSWQTMWJRV-KYHPRHEASA-N	430.387	1.481	50	20	IDGD	
O=C([C@@H](O)CCl)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CC[C@H](C(F)(F)F)CC1	1801993126	KQGINKDFVKYPQM-LOVFCKMRSA-N	426.863	1.544	50	20	IDGD	
CC(C)(CCl)C(=O)NC[C@@H]1CCN(C(=O)CN2C(=O)C=CC2=O)[C@H]1c1cccnc1	1802902503	OVVPLAVBJXUTKJ-KXBFYZLASA-N	432.908	1.277	50	20	IDGD	
CC(=O)O[C@H](C(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]1c1cccnc1)C(C)C	1803143074	STCZHUMDEYEIAG-TVFCKZIOSA-N	425.913	1.275	50	20	IDGD	
C[C@H](NC(=O)c1ccccc1)C(=O)N1CCC2(CCCN(C(=O)[C@@H](O)CCl)C2)CC1	1805529066	IJKVBKVCBWMBIS-WMZOPIPTSA-N	435.952	1.636	50	20	IDGD	
Cc1nscc1C(=O)N1CCCC2(CCN(C(=O)c3ccc(B(O)O)cc3)CC2)C1	1807849132	PHAXHXLASSKPAQ-UHFFFAOYSA-N	427.335	1.290	50	20	IDGD	
Cc1cc(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)cn1C	1808723159	CJERJZIPRBXUHF-UGKGYDQZSA-N	446.316	1.042	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@H]1CCN(C(=O)Cc2ncccn2)[C@@H]1c1cccnc1	1810540422	NJYSGSTWPBRQGY-DYESRHJHSA-N	427.581	1.972	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC2(CCCN(C(=O)Cc3cnc[nH]3)C2)CC1	1810836957	LQDSSBVHUMOUII-WGOQTCKBSA-N	439.520	1.317	50	20	IDGD	
C#CC(=O)N1CC[C@@H](CNC(=O)c2cc([N+](=O)[O-])ccc2OC(C)=O)[C@H]1c1cccnc1	1811358836	KUHQBBOOTWQMEW-HRAATJIYSA-N	436.424	1.868	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)c1ccnc2ncccc12	1812156686	MKSCYUGCKXZPQC-KFKAGJAMSA-N	439.903	1.944	50	20	IDGD	
Cc1ncc(C(=O)N2CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)s1	1813070221	HFWBZESMRJWAKS-OXQOHEQNSA-N	444.561	1.539	50	20	IDGD	
C[C@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)Cc3ccn(C)n3)sc2C1	1815553523	QPRCZQXARAOWOX-UWVGGRQHSA-N	426.340	1.815	50	20	IDGD	
Cc1cc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)cnc1C	1816069834	GVQHCVZTLOFKPG-HXUWFJFHSA-N	447.304	1.721	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CN(C)C)n[nH]1	1816853309	IODDRXISJXGVCH-DXRSZSRVSA-N	428.497	1.097	50	20	IDGD	
O=C(CS(=O)(=O)N1CCCC1)N[C@H]1CCc2nc(NC(=O)[C@H](F)Cl)sc2C1	1817121260	DHBXELKMEZLSGG-ZANVPECISA-N	438.934	1.015	50	20	IDGD	
O=C(CN1CCOCC1)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](F)Br)[nH]n1	1817149070	DXERFVUATNZCNO-SWLSCSKDSA-N	432.294	1.425	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3nc[nH]c3[N+](=O)[O-])sc2C1	1817205948	WFPWKXMLAKCGDQ-SFYZADRCSA-N	428.858	1.254	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)COC(C)C)CC2	1817276208	PKLHKJHSUAXRBR-CJCQAYSXSA-N	446.533	1.614	50	20	IDGD	
Cc1cc(C(=O)NCC(=O)N2CCCC[C@H]2c2cc(NC(=O)[C@@H](F)Cl)n[nH]2)no1	1818039410	BDWYVMWYLQHFJW-SWLSCSKDSA-N	426.836	1.663	50	20	IDGD	
Cc1ncoc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819402015	IUDBUXZIGVZSRE-HNNXBMFYSA-N	438.448	1.324	50	20	IDGD	
CNC(=S)NCCC(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](Cl)COC)[nH]n1	1819408542	AHUSFEAOCKPPDC-DGCLKSJQSA-N	430.962	1.140	50	20	IDGD	
C[Si](C)(C)OCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CN1CCOC1=O)CC2	1820160308	JKUJYEKSFCPZBK-NSHDSACASA-N	426.571	1.359	50	20	IDGD	
C[C@H](Br)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1	1822192111	OYWAPURLHGKTQO-WCQYABFASA-N	443.346	1.558	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](C)N2CCN(C)CC2)[nH]n1	1822374634	YLGZGVCMSNDDGA-INMHGKMJSA-N	440.976	1.292	50	20	IDGD	
CS(=O)(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1	1823014419	WFWFWFVBZIMPNJ-CPCISQLKSA-N	442.332	1.180	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC[C@H]1C1CCN(C(=O)C2=NNC(=O)C2)CC1	1824092004	LWSDMYOYRMKZIY-DOMZBBRYSA-N	427.343	1.513	50	20	IDGD	
CC(C)(C)[C@@H](O)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1	1824135392	ZUFJSXOKTYORIR-PMACEKPBSA-N	430.354	1.007	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1n[nH]cc1[N+](=O)[O-])CC2	1825642105	NZLQIONNMIINTN-RNFRBKRXSA-N	443.283	1.784	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](C)n1ccnn1)CC2	1825647694	VEUVCEMTHHATAX-IVZWLZJFSA-N	427.328	1.691	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)c2cccs2)CC1	1825777376	TUVRVXHWDJNCLU-IBGZPJMESA-N	426.347	1.975	50	20	IDGD	
Cc1ccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)nc1	1826071062	RXRGKEWMZNJCBC-JOCHJYFZSA-N	435.333	1.617	50	20	IDGD	
O=C(c1ccns1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827050381	QEJZJODAFOUTAP-SFHVURJKSA-N	427.335	1.370	50	20	IDGD	
Cc1cccnc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827050390	QUUPCFLCULQACT-NRFANRHFSA-N	435.333	1.617	50	20	IDGD	
CN1CCCC[C@@H]1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827056441	ZRESNRXZXQJSHN-FGZHOGPDSA-N	441.381	1.084	50	20	IDGD	
C[C@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1)n1cccc1	1827060452	JDVFCELMFQNGCW-GCJKJVERSA-N	437.349	1.662	50	20	IDGD	
O=C(CS(=O)(=O)N1CCCC1)N1CCC([C@H]2CCCCN2C(=O)[C@@H](F)Cl)CC1	1827613956	WLJOBICATMKXKG-NVXWUHKLSA-N	437.965	1.566	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H]2C[C@@H]2C2CC2)CC1	1828923672	RZMQCZFUIFCGQJ-SFHLNBCPSA-N	439.560	1.965	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H]2C[C@@H]2C2CC2)CC1	1828923673	RZMQCZFUIFCGQJ-SVFBPWRDSA-N	439.560	1.965	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H]2CNC(=O)C2)CC1	1831408589	BYXRXNDELWCYTE-BMFZPTHFSA-N	428.371	1.773	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)OC(=O)OCC)C2)C1	1831658610	XZLLVKHOXYKSQP-ZRGWGRIASA-N	434.917	1.412	50	20	IDGD	
C[C@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)CC(C)(C)O)CC2)CC1	1833262182	IVORSDMLCUTQTD-CQSZACIVSA-N	432.403	1.750	50	20	IDGD	
CC(C)(C)n1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)cn1	1833457591	RZJBWQMCBQZNDS-GOSISDBHSA-N	433.336	1.512	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)CCNC(=S)NC)CC2)CC1	1833533739	OGFDTOZELHAUHA-QGZVFWFLSA-N	446.061	1.450	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnc(OCF)cn3)CCO2)C1	1833566708	SCENVLOIUVVOAH-LJQANCHMSA-N	444.891	1.117	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3cnsn3)CC2)CC1	1833979978	JEEVJYRIDXKXDK-AWEZNQCLSA-N	444.399	1.897	50	20	IDGD	
O=C(CCc1ccoc1)N1CCOC[C@]2(C1)CN(C(=O)CCBr)CCO2	1834826707	UCGYXSSPOPARBW-SFHVURJKSA-N	429.311	1.454	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccccc3)CCO2)C1	1835000593	XXMINOMFGDDLLQ-FXAWDEMLSA-N	439.350	1.859	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CC(F)(F)F)CCO2)C1	1835336213	BLUFUVAYZYAATF-BXUZGUMPSA-N	431.249	1.569	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1)c1ccncc1O	1835874917	VPRHPZVBFYRFJE-UHFFFAOYSA-N	439.354	1.757	50	20	IDGD	
CC(C)N[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)Br)C2)C1)C(C)C	1835900935	LTQDSHSOFGMODT-TXPKVOOTSA-N	448.402	1.249	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(C=O)s3)CCO2)C1	1835946753	UAWUMSQSOBLGME-QZTJIDSGSA-N	449.356	1.867	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)N1CCC(OC2CCN(C(=O)C(C)(C)CCl)CC2)CC1	1836623771	PKQPXIHZGQILQO-OAHLLOKOSA-N	445.004	1.958	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ncccc3F)C2)C1	1837715513	UVAJDRNOMLUTBL-IBGZPJMESA-N	425.533	1.142	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CNc3ccc(F)cc3)C2)C1	1839143927	MBPKUSFOXHDFGT-YLJYHZDGSA-N	427.904	1.711	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)COc3ccccc3)C2)C1	1839151112	ILNSJNWDKRPFCY-PMACEKPBSA-N	445.343	1.758	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cccnc3)C2)C1	1839152255	SGARUOAPYAITCX-RTBURBONSA-N	430.332	1.317	50	20	IDGD	
COc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)cc1	1840034615	REDFVGSHDDGPNQ-AUUYWEPGSA-N	441.322	1.549	50	20	IDGD	
CC(C)(C(=O)N1CCO[C@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1)c1ccccn1	1840329354	SVYJJMKUOBWDDN-QFIPXVFZSA-N	449.624	1.667	50	20	IDGD	
Cc1cc(O)c(C(=O)N2CC3(CCCN3C(=O)[C@@H](O)CCl)C2)cc1Br	1841353084	BSIDUCWBSULDEA-AWEZNQCLSA-N	431.714	1.880	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@](C)(C(=O)N2CC3(CCCN3C(=O)[C@H](F)Cl)C2)[C@H](O)C1	1843363895	FGMFTDDSMSLONH-TYILLQQXSA-N	447.935	1.732	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1cccn3ccnc13)C2	1843416253	OXDRAZKZOVSFEA-MFKUBSTISA-N	433.472	1.285	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)c2cc3cc(F)c(F)cc3[nH]2)C1	1844010963	IFXZLCYUHVJMNG-UHFFFAOYSA-N	439.227	1.257	50	20	IDGD	
CN(CC(=O)N1CCCC12CN(C(=O)[C@@H]1CCCS1)C2)NC(=O)NCc1ccccc1	1845039293	BLMZVLZWUGRYFO-SFHVURJKSA-N	445.589	1.432	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1O)C2	1845164931	LKASHXPSZLJUTO-PMPSAXMXSA-N	443.972	1.825	50	20	IDGD	
C=CC(=O)N[C@@H](C)C(=O)N1CC2(CCCN2C(=O)[C@H](Br)Cc2ccccc2)C1	1845941492	BRECIASYLKOURW-DOTOQJQBSA-N	448.361	1.887	50	20	IDGD	
CC(=O)NCCC(=O)N1CC2(CCCN2C(=O)[C@@H](Br)Cc2ccccc2)C1	1845942606	QKYXNAKQFURAFH-KRWDZBQOSA-N	436.350	1.722	50	20	IDGD	
CC[C@@H](C)[C@H](N)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1848099170	HIZAMBVBRRYDBL-YXMSTPNBSA-N	430.977	1.694	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cn(C)c3ccccc23)cc1	26074131	CNVABKKCZFAMFO-UHFFFAOYSA-N	430.486	1.178	50	20	IDGD	
CCn1c(=O)c2ccccc2n(CC(=O)NNC(=S)Nc2cc(C)ccc2C)c1=O	28349932	YBBVQUCAWITYKB-UHFFFAOYSA-N	425.514	1.818	50	20	IDGD	
Cc1noc(C)c1COc1ccccc1C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	105618453	MBMMDBDLTFFHSA-UHFFFAOYSA-N	433.428	1.921	50	20	IDGD	
CCOC(=O)C1=NN(c2ccccc2)[C@@H](C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)C1	110673692	FVJBHVGDODNWLT-APWZRJJASA-N	438.440	1.172	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)CCN(Cc2ccccc2)C(C)=O)c2ccccc2c1=O	726155989	BAPPCCDBVCQRGP-UHFFFAOYSA-N	435.484	1.616	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H](c2ccccc2)[C@@H]2CCCO2)c1	726711370	DHOUKWYLZTTWHQ-OALUTQOASA-N	446.529	1.801	50	20	IDGD	
O=C(NNC(=S)NCC1CCC1)c1ccc(F)c(S(=O)(=O)N2CCCCC2)c1	727866982	JQLFGIBFORQYBS-UHFFFAOYSA-N	428.555	1.909	50	20	IDGD	
CC(C)Oc1cccc(CC(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1	728334698	ZZBWORXXYSOGTI-LJQANCHMSA-N	428.441	1.547	50	20	IDGD	
COc1ccc(N(C(C)=O)c2nc(C=NNC(=O)[C@@H](C)NS(C)(=O)=O)cs2)cc1	728436471	PCKZXLGWYMNOGT-LLVKDONJSA-N	439.519	1.224	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)NC[C@@H]2CN(CC(C)C)CCO2)c1	728741647	SSBGLADDEZAXCI-CQSZACIVSA-N	443.342	1.759	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)[C@@H]1CCCN(C(=O)c2ccccc2OC(F)F)C1	728851566	KTHHQOGRNXUXMS-OAHLLOKOSA-N	432.427	1.925	50	20	IDGD	
COc1ccc(CNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c(OC)c1OC	728945768	ITCVHNLZYRIMHK-UHFFFAOYSA-N	444.492	1.249	50	20	IDGD	
CC(=O)Nc1cccc2c1CCN(C(=O)NNC(=O)C1CCN(c3ncccn3)CC1)C2	728958658	DNIGZBSDSLCXMJ-UHFFFAOYSA-N	437.504	1.451	50	20	IDGD	
O=C(CNc1ccccc1)NNC(=O)c1ccc(S(=O)(=O)N=c2cc[nH]cc2)cc1	729514047	ISCRXSOYFSLVQY-UHFFFAOYSA-N	425.470	1.177	50	20	IDGD	
O=C(CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)NNC(=O)CCc1ccccc1O	730034053	PBPZPRBLBOUMQC-UHFFFAOYSA-N	428.401	1.769	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)NCc1cccc(NC(=O)c2ccncc2)c1	730823845	YRKVFVJMWJUHTB-UHFFFAOYSA-N	435.440	1.949	50	20	IDGD	
O=C(NC[C@@H]1CCCN1CC1CCCCC1)NNC(=O)c1ccc(-n2cnnn2)cc1	731497021	RRAZMHQRULONAW-IBGZPJMESA-N	426.525	1.651	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@@H]2CC[C@@H](C(F)(F)F)NC2=O)cc1Br	732175248	IFMSKRAHBIGAHK-KCJUWKMLSA-N	438.200	1.676	50	20	IDGD	
CS(=O)(=O)N1CCC[C@@H]1C(=O)NNC(=O)COc1ccccc1Cc1ccccc1	732960409	IOADEABDQPJRLY-GOSISDBHSA-N	431.514	1.228	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)cn1	734418604	SELKYTMBXPTHEL-UHFFFAOYSA-N	435.465	1.507	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)c2cc(Br)c[nH]2)cc1C(=O)N(C)C	734419332	PBJLVPSQWJLXNC-UHFFFAOYSA-N	445.295	1.111	50	20	IDGD	
O=C(NN=C1C(=O)Nc2c(Br)cc(Cl)cc21)N[C@@H]1CCS(=O)(=O)C1	735613591	CLHKKSWSYKWCQR-SSDOTTSWSA-N	435.687	1.245	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2Br)C[C@@H](C)O1	740075404	HDJVTILVABFEKA-PHIMTYICSA-N	429.271	1.618	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@@H](C)n2nnc(-c3ccccc3)n2)c2ccccc2c1=O	742473946	LNMCOJDZFOYXKF-CYBMUJFWSA-N	432.444	1.092	50	20	IDGD	
C[C@@H](C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1)n1nnc(-c2ccccc2)n1	742618482	JAJNVEWWRGTXKK-ZDUSSCGKSA-N	427.490	1.485	50	20	IDGD	
CC(=O)N[C@@H](CC(=O)NNC(=O)c1nn(-c2ccccc2)cc1O)c1ccc(F)cc1F	743293368	XGJHCVZETDOTBT-KRWDZBQOSA-N	443.410	1.885	50	20	IDGD	
CN(C)CC(=O)NNC(=O)c1occc1CS(=O)(=O)c1ccc(Br)cc1	743332399	BOZURSCZGQBZSS-UHFFFAOYSA-N	444.307	1.339	50	20	IDGD	
CS(=O)(=O)c1ccc(OCCCC(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1	743622054	MSRGMQPSEYJPSU-UHFFFAOYSA-N	434.470	1.482	50	20	IDGD	
CC(=O)Nc1cc(NC(C)=O)cc(C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)c1	744613902	VIMOAHMUNHDUBD-UHFFFAOYSA-N	437.412	1.093	50	20	IDGD	
C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)OCC(=O)NNC(=O)c1ccc(C#N)cc1	744869122	GQOJVXAALHJNPS-NSHDSACASA-N	446.803	1.892	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)N[C@@H]1CC(=O)N(CCOc2ccccc2)C1	745846348	GQDNNVLWSMLTSB-MRXNPFEDSA-N	430.436	1.215	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)N[C@H]3CCc4c(O)cccc43)nc2)CC1	745865373	OPXFRPFHMMQHIY-KRWDZBQOSA-N	446.533	1.037	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNC(=O)N[C@H]2C[C@@H](C)N(c3cnn(C)c3)C2=O)cc1	745916132	AYVCMDDUSYYQEB-BEFAXECRSA-N	442.520	1.983	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N(C)C)cc1S(=O)(=O)N1CCCc2ccccc21	746008327	NBZVIJVGPITWAN-UHFFFAOYSA-N	432.502	1.753	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2ccc(Cl)cc2Cl)cc(S(N)(=O)=O)cc1[N+](=O)[O-]	746099997	DKUBVPBALFMESB-UHFFFAOYSA-N	447.256	1.932	50	20	IDGD	
CCN(CC)S(=O)(=O)CC(=O)NNC(=O)c1ccc(Br)cc1Cl	746218712	YXFODBBPVNJJBI-UHFFFAOYSA-N	426.720	1.535	50	20	IDGD	
CC(C)(C(=O)NNC(=O)c1ccc(F)c(S(=O)(=O)Cc2ncon2)c1)c1ccccc1	746239412	JZUGWRSHWXIQOA-UHFFFAOYSA-N	446.460	1.921	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)[C@H]2COc3cc(OC)ccc3C2)c2ccccc2c1=O	747370556	OWVGNQDIYSTHQB-OAHLLOKOSA-N	436.468	1.827	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)NC2CCC(C(N)=O)CC2)cc(OCC)c1OCC	747582222	BKTFTIMTTXSHKW-UHFFFAOYSA-N	436.509	1.871	50	20	IDGD	
N#Cc1cccc(NNC(=O)CCCNS(=O)(=O)c2ccc3c(c2)OCCCO3)c1	748049667	CCBOWNSCCFRVJP-UHFFFAOYSA-N	430.486	1.921	50	20	IDGD	
Cn1c(NNC(=O)c2cc(S(=O)(=O)N3CCC3)ccc2Cl)nc2ccccc2c1=O	748712030	QAUMZIVCAFFRDF-UHFFFAOYSA-N	447.904	1.738	50	20	IDGD	
Cc1cc(C)c(C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)o1	749309248	WYFPKFARTDWZDC-UHFFFAOYSA-N	435.502	1.311	50	20	IDGD	
O=C(NNC(=O)c1c(F)cccc1Br)c1csc(N2CCOCC2)n1	749333162	JQIAHTVTIKMCKY-UHFFFAOYSA-N	429.271	1.956	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)CNC(=O)OC(C)(C)C	750439013	GXJYFLOPZAOJCM-LBPRGKRZSA-N	432.481	1.038	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)NCCc2nc(C)no2)cc1	751387550	BJZOMKFSTBWLTL-LFIBNONCSA-N	449.471	1.391	50	20	IDGD	
C[C@H](C(=O)OCC(=O)NNC(=O)c1cccc(C#N)c1)c1ccc(S(C)(=O)=O)cc1	753480870	AKIJBIZVHOKWTC-ZDUSSCGKSA-N	429.454	1.070	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)c3cccc(S(N)(=O)=O)c3C)n[nH]2)c1	754474765	JMMPACZPLYTRLL-UHFFFAOYSA-N	427.486	1.724	50	20	IDGD	
CC(=O)N1CC[C@H](CN(C)C(=O)NNC(=O)[C@@H](C)Oc2cccc(Br)c2)C1	754837855	GWYMUBSOWMWJII-TZMCWYRMSA-N	441.326	1.757	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)Nc2ccc(N3CCCS3(=O)=O)cc2)c1	755591456	CMJGTMPNKXSUMG-UHFFFAOYSA-N	434.474	1.710	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2ccc3c(c2)CCC(=O)N3)cc1	755627739	BUQDWYGSXGUDHL-UHFFFAOYSA-N	445.501	1.353	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CN2C[C@H](CCN3CCCC3=O)c3ccccc32)c1	756598102	BTERWMKQLBTIHF-IBGZPJMESA-N	431.496	1.936	50	20	IDGD	
COC(=O)Cn1ccc(NC(=O)NNC(=O)COc2ccccc2Cc2ccccc2)n1	756648306	VRRUCTRZRHJVRL-UHFFFAOYSA-N	437.456	1.879	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2ccc(Cl)nc2)cc1S(=O)(=O)NC1CC1	756681051	FBHUFDRQONNBMY-UHFFFAOYSA-N	439.881	1.651	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cncc(I)c2)cc1OC	756854419	DJOHWZCPWLYASQ-UHFFFAOYSA-N	427.198	1.778	50	20	IDGD	
COc1ccccc1N1CC[C@@H](NC(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)C1=O	757291905	KSXMNHCVFZBOFS-XJKSGUPXSA-N	430.436	1.738	50	20	IDGD	
NC(=O)c1ccc(NNC(=O)CCCCCn2c(S)nc3ccccc3c2=O)nn1	757403070	UDNIRFJXDVEULN-UHFFFAOYSA-N	427.490	1.278	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2ccc(F)cc2CS(C)(=O)=O)cc1OC	757678239	LUMQLWDKHVDFNU-UHFFFAOYSA-N	425.438	1.854	50	20	IDGD	
O=C(COc1ccc(F)c(Cl)c1)N1CCN(S(=O)(=O)CBr)CC1	758512501	MWPBTEVYXQWXEL-UHFFFAOYSA-N	429.695	1.684	50	20	IDGD	
COc1cccc(CNC(=O)NNC(=O)C(=O)Nc2ccccn2)c1OC1CCCC1	758773789	GNRPHARQKYVKSQ-UHFFFAOYSA-N	427.461	1.881	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1F	760265979	XILJUICUDRZOBF-UHFFFAOYSA-N	449.504	1.549	50	20	IDGD	
CCS(=O)(=O)Nc1cc(OC)ccc1S(=O)(=O)NNC(=O)c1ccccc1OC	761271364	LTHHPKPWOFCPMG-UHFFFAOYSA-N	443.503	1.089	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)NCc1ccnc(N2CCN(C)CC2)c1	761658993	DZZPNEVLZGAPEM-UHFFFAOYSA-N	444.561	1.465	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)NCc1ccc(CS(C)(=O)=O)cc1	761671086	YOLCRMGGVMCVGH-UHFFFAOYSA-N	437.543	1.863	50	20	IDGD	
O=C(COC(=O)c1cc([N+](=O)[O-])c2nsnc2c1)NNC(=O)c1ccc(Cl)cc1	762965328	BJUZAIZFKPKHAL-UHFFFAOYSA-N	435.805	1.871	50	20	IDGD	
CC(=NNC(=O)CNC(=O)c1cccnc1)c1ccc(S(=O)(=O)N2CCCCC2)cc1	763197253	YOHBFYWIPAMVOO-UHFFFAOYSA-N	443.529	1.526	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)cn2)C[C@@H](C)O1	763468489	LHEDHANXQRNETB-BETUJISGSA-N	442.432	1.003	50	20	IDGD	
O=C(NNC(=O)c1cccnc1)C(=O)Nc1ccc(C(=O)NCc2ccc(F)cc2)cc1	763491533	MHEGILPXYDCNNE-UHFFFAOYSA-N	435.415	1.550	50	20	IDGD	
CN(c1ccccc1NC(=O)C(=O)NNC(=O)[C@@H]1COc2ccccc2O1)C1CCCC1	763572278	QHGMDZPEPNMQDT-FQEVSTJZSA-N	438.484	1.991	50	20	IDGD	
CON(C)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)cc1	763614573	SWZBAFOJNSCDIA-UHFFFAOYSA-N	436.428	1.110	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cc3c(cc2F)CCC(=O)N3)c2ccccc2n1	763617358	YPAXQLXKSWEPRW-UHFFFAOYSA-N	435.415	1.967	50	20	IDGD	
Cc1cc(C)n(-c2ccc(NC(=O)C(=O)NNC(=O)c3c(C)nc4ccccn34)cc2F)n1	763629861	PIWUSXZFCYDTNW-UHFFFAOYSA-N	449.446	1.984	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2ccc(OCCN(C)C)cc2)c1	763650856	RFDCDIRZZAUCTR-UHFFFAOYSA-N	428.489	1.409	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2ccc(-c3cc[nH]n3)cc2)c2ccccc2c1=O	763785561	HWURVPGKJOGRIF-UHFFFAOYSA-N	445.439	1.206	50	20	IDGD	
C=CCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)cc1	763849402	LJQMEUISUBZLRI-INIZCTEOSA-N	438.484	1.773	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cnn(CC(F)F)c2)cc1	763861086	MIKCHDOUOSFQHE-LLVKDONJSA-N	425.392	1.100	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccccc2-n2cncn2)cc1	763862646	YUYFMIDMBNZZHL-CQSZACIVSA-N	438.444	1.219	50	20	IDGD	
CCC(C)(C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)Cn2nc(C)cc2C)cc1	763886806	ZASLICYVTGIICU-UHFFFAOYSA-N	428.493	1.204	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(OC(C)C)c(OC)c2)cc1	763916859	WQBBMLRIWPQIHR-UHFFFAOYSA-N	429.429	1.669	50	20	IDGD	
CNC(=O)CCOc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccc(Cl)cc2)cc1	763936628	MJNJMPMXEDQURE-UHFFFAOYSA-N	432.864	1.184	50	20	IDGD	
NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Br)s2)cc1Cl	763938363	DMMVHWONNHMPTQ-UHFFFAOYSA-N	445.682	1.663	50	20	IDGD	
O=C(NNC(=O)c1cc(Cl)ccc1O)C(=O)Nc1ccc(CN2CCOC2=O)cc1	763976913	IHGPOSOLRQOJLH-UHFFFAOYSA-N	432.820	1.398	50	20	IDGD	
CC(C)(C)OC(=O)N1CCc2ncc(NC(=O)C(=O)NNC(=O)c3ccc[nH]3)cc2C1	763979237	KTYSIYSEUNACOE-UHFFFAOYSA-N	428.449	1.103	50	20	IDGD	
O=C(NNC(=O)c1ccc[nH]1)C(=O)Nc1cccc(Oc2ncc(Br)cn2)c1	763980270	XCMRKOLGCSKTCE-UHFFFAOYSA-N	445.233	1.759	50	20	IDGD	
CCCOC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)cc1	763996163	CPRVKMDZNLXDDS-UHFFFAOYSA-N	437.250	1.744	50	20	IDGD	
C=CCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)cc1	763996231	XNCMPQVBHIYOIM-UHFFFAOYSA-N	434.250	1.093	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(Br)cc2Br)n[nH]1	764098391	MOVGHWNVXAIMJY-UHFFFAOYSA-N	445.071	1.643	50	20	IDGD	
CCS(=O)(=O)c1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)c1ccc(Cl)nc1	764099665	BXBQJRARYFAPQA-UHFFFAOYSA-N	445.284	1.582	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccc(-c2n[nH]c(C3CC3)n2)cc1	764138642	GPQQRIFNXPQIJI-UHFFFAOYSA-N	434.456	1.686	50	20	IDGD	
Cc1nc(Br)ccc1NC(=O)C(=O)NNC(=O)C(F)(F)Oc1ccccc1	764379743	IWSABDNHRVMXOA-UHFFFAOYSA-N	443.204	1.910	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)[C@@H](C)NS(=O)(=O)c2cccc(C#N)c2)c1C	764553117	RFFJNOYYIMDNFF-HZPDHXFCSA-N	444.513	1.457	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C[C@@H]1CN(C(=O)OC(C)(C)C)CCO1	764565218	ZQMNSZGXFWGTCI-CZUORRHYSA-N	425.457	1.766	50	20	IDGD	
CCCc1ccc(S(=O)(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cc1	765117221	DBDDBBGKEMQWAZ-UHFFFAOYSA-N	444.557	1.407	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)Cn3c(=O)nc(O)c4ccccc43)n[nH]2)cc1C	765568692	ZARZZWSBXLHSCM-UHFFFAOYSA-N	432.440	1.570	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)N[C@@H]1CC(=O)N(CCOc2ccccc2)C1	765802666	DRNNPYGLVFNHSP-OAHLLOKOSA-N	432.502	1.396	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3ccncc3Br)CC2)cc1	766650297	SUTIQQPHTCDVHF-UHFFFAOYSA-N	446.349	1.731	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NC2CCN([C@H]3CCC[C@H]3O)CC2)cc(OC)c1OC	767927288	JYVXJEWQUYISCF-JKSUJKDBSA-N	436.509	1.034	50	20	IDGD	
O=C(NCc1nc(COc2ccccc2)n[nH]1)NNC(=O)c1cnn(-c2ccccc2)c1	771376996	LEYTUWKOURXOAM-UHFFFAOYSA-N	432.444	1.714	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)c1cnc(S)n1-c1ccccc1	772896693	BNFOFCNXCXPJOR-UHFFFAOYSA-N	429.889	1.892	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccc(-n2cccn2)nc1	774007542	BLYZDVVFWQRJOE-LBPRGKRZSA-N	428.836	1.474	50	20	IDGD	
Nc1ccc(Br)cc1C(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	775091759	VSSVCSWNLQPGHW-UHFFFAOYSA-N	437.206	1.558	50	20	IDGD	
CC(C)CS(=O)(=O)N1CCC(NC(=O)NNc2ccccc2S(C)(=O)=O)CC1	777765595	VLCFDDDDTIOPAY-UHFFFAOYSA-N	432.568	1.166	50	20	IDGD	
O=C(c1ccc(Br)cn1)N1CCN(S(=O)(=O)CBr)CC1	777831525	BSEBTDADYBCYLI-UHFFFAOYSA-N	427.118	1.284	50	20	IDGD	
Cc1ccc2cccnc2c1S(=O)(=O)NNC(=O)c1sc(N2CCOCC2)nc1C	777910908	GMZUCSQUMDWJQU-UHFFFAOYSA-N	447.542	1.768	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)[C@@H]1CC(=O)N(c2ccc(Cl)c(F)c2)C1	778437302	YJLDLSDSVCJMRZ-SNVBAGLBSA-N	428.848	1.504	50	20	IDGD	
O=C(NNc1ccc([N+](=O)[O-])cc1Br)C(=O)Nc1ccc(-n2cnnn2)cc1	778752049	MIGJXNIOCUTOOJ-UHFFFAOYSA-N	447.209	1.415	50	20	IDGD	
COc1cccc2[nH]cc(CC(=O)OCC(=O)NNC(=O)[C@@H]3COc4ccccc4O3)c12	778868534	LRBUZQFVLUHKDG-SFHVURJKSA-N	439.424	1.250	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2ccc3c(c2)CCC(=O)N3CC(F)(F)F)n1	782122971	FSOQUMPYVPEDQR-UHFFFAOYSA-N	438.366	1.409	50	20	IDGD	
CCNC(=O)N(C)NS(=O)(=O)c1ccc(S(=O)(=O)N2C[C@H](C)C[C@@H](C)C2)cc1	782478145	IBGJQBULYBTWKI-ZIAGYGMSSA-N	432.568	1.208	50	20	IDGD	
Cc1cc(C(=O)N2CCC[C@H](C)C2)ccc1NC(=O)C(=O)NNC(=O)c1ccc(O)cc1	782830053	CYZNPGWAAZZHNR-AWEZNQCLSA-N	438.484	1.972	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCc2ccc(N3CCOC3=O)cc2)cc(OC)c1OC	782998367	XVAHAAXDKSPEDI-UHFFFAOYSA-N	444.444	1.813	50	20	IDGD	
O=C(NNc1ncccc1C(F)(F)F)C(=O)Nc1ccccc1C(=O)N1CCOCC1	783120087	OARFBLZNBRTKCF-UHFFFAOYSA-N	437.378	1.655	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNC(=O)CNC(=O)c2cccs2)c2ncccc12	784003776	OQFYPQVZTDQDRJ-UHFFFAOYSA-N	441.469	1.211	50	20	IDGD	
O=C(NNc1ccc(OC(F)F)cc1)C(=O)Nc1cccc(N2CCCS2(=O)=O)c1	784309180	XTDQOMHULWPXFW-UHFFFAOYSA-N	440.428	1.910	50	20	IDGD	
O=C(NNc1ccnc(Br)c1)C(=O)Nc1ccn(CCc2ccncc2)n1	784837522	WIKILWOMAFOEAM-UHFFFAOYSA-N	430.266	1.760	50	20	IDGD	
COc1cccc(NNC(=O)C(=O)Nc2cc(S(=O)(=O)N(C)C(C)C)ccc2C)n1	784845894	GSXKQOQROGOUOF-UHFFFAOYSA-N	435.506	1.509	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)Nc1cccnc1N1CCCCC1	785023581	NSMXDYWLJINCKN-UHFFFAOYSA-N	428.405	1.085	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2ccc([C@H](C)N3CCOCC3)cc2)n1	785238705	ZJECWCAORQELQP-INIZCTEOSA-N	441.536	1.798	50	20	IDGD	
CCOC(=O)c1ccsc1NC(=O)C(=O)NNc1c(OC)cccc1S(C)(=O)=O	785337602	ICQFIOMCMHQPJA-UHFFFAOYSA-N	441.487	1.419	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc3ccccc3cc2O)cc1N1CCNC1=O	787540875	GHNAFZDFVMEDMZ-UHFFFAOYSA-N	447.451	1.783	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cc(N3CCNC3=O)ccc2C)cc1C	787541124	MHLYDZNLPVUVSN-UHFFFAOYSA-N	439.472	1.306	50	20	IDGD	
COC[C@H](C)Oc1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)[C@H]1Cc2ccccc2O1	787889969	UJRGHFQJNVZAQY-KPZWWZAWSA-N	447.875	1.843	50	20	IDGD	
COc1nc(Br)ccc1NC(=O)C(=O)NNC(=O)c1cccc(Cl)c1	789587573	ZVOIGCPBHSKGGU-UHFFFAOYSA-N	427.642	1.906	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1cc([C@H]2CCCOC2)nn1C	790965199	HWYYKTKOPZKKJF-STQMWFEESA-N	449.895	1.521	50	20	IDGD	
Cc1c(C(=O)NNc2nccc(N3CCOCC3)n2)nnn1Cc1ccc(F)cc1F	792392208	VCVAXMMWDJHCCI-UHFFFAOYSA-N	430.419	1.297	50	20	IDGD	
C[C@@](O)(Cn1cc(C(F)(F)F)ccc1=O)C(=O)NNC(=O)c1cc(Cl)ccc1O	792629551	RXDHRABVBFPOQB-MRXNPFEDSA-N	433.770	1.438	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)OCC(=O)N2C	799262787	CMJDDXFROHEEQU-NSHDSACASA-N	446.847	1.249	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)COCc3nnc(C)s3)n[nH]2)cc1OC	802937561	YLSNVMKIOVFTHG-UHFFFAOYSA-N	432.462	1.232	50	20	IDGD	
O=C(COCc1ccccn1)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	806346864	BGGCAJJUZILZRF-UHFFFAOYSA-N	443.467	1.761	50	20	IDGD	
CN(C)C(=O)COc1c(Cl)cc(S(=O)(=O)NNC(=O)C2CCCC2)cc1Cl	808075807	BPXYTPMUJBXUQH-UHFFFAOYSA-N	438.333	1.960	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2cccc(C3OCCO3)c2)cc1	808859052	AMBKUCIYDIAKDZ-UHFFFAOYSA-N	448.501	1.514	50	20	IDGD	
Cc1cc(C(F)(F)F)ncc1NC(=O)C(=O)NNC(=O)c1cc(Br)c[nH]1	810384941	SAYBMIIZAZZIIP-UHFFFAOYSA-N	434.172	1.899	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)nn1C1CCCCC1	810390638	JHJPPXQZRMLJPH-UHFFFAOYSA-N	437.504	1.912	50	20	IDGD	
CC(C)CC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)NNC(=O)[C@@H](C)Oc1cccc(Cl)c1	811461419	ARAHKJMOVWAORF-DYVFJYSZSA-N	435.912	1.751	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)c1ccc(N2CCNC2=O)cc1	812506164	WVOJDEODZPVKKS-UHFFFAOYSA-N	433.262	1.819	50	20	IDGD	
CCOC(=O)c1ccc(NNC(=O)c2cnc3c(c2C)c(=O)n(C)c(=O)n3C)cc1C	812720891	FUKZMKDDOCSQAC-UHFFFAOYSA-N	425.445	1.183	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)N[C@@H]1CC(=O)N(c2ccccc2F)C1	812930324	LCOANZAZVANQKZ-CYBMUJFWSA-N	437.472	1.566	50	20	IDGD	
COC(=O)c1cn(-c2cccc(NC(=O)NNC(=O)COc3ccccc3C#N)c2)nn1	812981632	FGLUTQUECNWARW-UHFFFAOYSA-N	435.400	1.157	50	20	IDGD	
CCCCCn1nc(C)cc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	813033018	AKNYXVUUTMFGBU-UHFFFAOYSA-N	436.538	1.714	50	20	IDGD	
COC(=O)[C@]1(c2ccccc2)CCN(C(=O)NNC(=O)c2cc(Br)c[nH]2)C1	814272221	YZIRMDXHRAVYAP-GOSISDBHSA-N	435.278	1.948	50	20	IDGD	
Cn1cnnc1COCC(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1	815157730	VQGNZPQHUDVMGK-HXUWFJFHSA-N	434.500	1.106	50	20	IDGD	
N#Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)ccc1Br	815564349	GLERPZSOYPMQSC-UHFFFAOYSA-N	431.202	1.449	50	20	IDGD	
COCc1cc(NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)cc(C(=O)OC)c1	815568960	AEKFGMZHZBDHPH-UHFFFAOYSA-N	438.440	1.360	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@H]2CCc3nncn3C2)ccc1Oc1ccncc1	815693129	MSTWARXHPUUCGZ-AWEZNQCLSA-N	435.444	1.122	50	20	IDGD	
CNC(=O)c1cc(Oc2ccc(NC(=O)C(=O)NNc3ncncc3F)cc2F)ccn1	815763910	HHHUMCZHHWOYDJ-UHFFFAOYSA-N	443.370	1.384	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCCC(=O)NNc2ccc(C)c(C(=O)OC)c2)cc1	816687853	RPTHXVKXMGMPMW-UHFFFAOYSA-N	435.502	1.992	50	20	IDGD	
COc1ccc([N+](=O)[O-])cc1NS(=O)(=O)c1cccc(C(=O)NNc2ncccn2)c1	913040175	JLLPUZHVFJUDEX-UHFFFAOYSA-N	444.429	1.951	50	20	IDGD	
COc1ccccc1NC(=S)NNC(=O)CNS(=O)(=O)c1c(F)cccc1F	913440935	KDKUIIOAOOVNPY-UHFFFAOYSA-N	430.458	1.270	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccccc1	914781382	BUJUODGZHQXKQH-UHFFFAOYSA-N	429.502	1.067	50	20	IDGD	
CN(C)N(C(=O)Cc1csc(NC(=O)Cc2cccs2)n1)[C@@H]1CCS(=O)(=O)C1	915140512	ANPGYHRYFUNNSS-CYBMUJFWSA-N	442.588	1.421	50	20	IDGD	
CC1CCN(C(=S)SCC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)CC1	915165019	WMHPGCMZLHIBLJ-UHFFFAOYSA-N	429.589	1.601	50	20	IDGD	
COc1ccc(CCNC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc1	915883465	MIMBEQSASXQOKL-UHFFFAOYSA-N	446.529	1.666	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)NC[C@H](c1ccc(F)cc1)N1CCOCC1	915898024	OOGDEIBNSUOCET-LJQANCHMSA-N	434.443	1.748	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)c2cccc(C(=O)OC)n2)c2ccccc2c1=O	916129466	LGALZKJAJDFIGM-UHFFFAOYSA-N	437.456	1.843	50	20	IDGD	
CC(C)[C@@H](CNC(=O)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1)N1CCOCC1	916254591	ZLAUUOCAZBNJKN-OAHLLOKOSA-N	438.472	1.963	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNC(=O)NCc2cccc(S(N)(=O)=O)c2)cc1	916625014	BDEFFTDVHDQSTN-UHFFFAOYSA-N	434.518	1.903	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C3=NN(c4ccccc4)[C@@H](C(N)=O)C3)n[nH]2)cc1	917178896	XSTNDPWMJRLLJX-LJQANCHMSA-N	431.456	1.266	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)c2ccc(Br)cc2n1	917624962	INOXHKQHUXGMTG-JTQLQIEISA-N	426.292	1.501	50	20	IDGD	
Cn1nnnc1SCCC(=O)NNC(=O)c1ccccc1OCc1ccc(F)cc1	917907281	XAULRHGITKQMNM-UHFFFAOYSA-N	430.465	1.872	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2ccc(N3CCOCC3)cc2)c1	919791210	YMYPWNWEVCLQST-UHFFFAOYSA-N	432.502	1.071	50	20	IDGD	
CCCCNC(=O)NNC(=O)[C@@H](CCS(C)(=O)=O)NC(=O)c1ccccc1Cl	920764881	QLONELPWHWHZOS-CQSZACIVSA-N	432.930	1.004	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)c2ccccc2c1=O	921300911	HJRDLPWJTQITKP-UHFFFAOYSA-N	433.384	1.102	50	20	IDGD	
CCN1CCN(S(=O)(=O)c2ccc(Cl)c(C(=O)NNC(=S)NC(C)C)c2)CC1	1115812564	VCFZJNDUMDFARJ-UHFFFAOYSA-N	448.014	1.184	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](COC(C)=O)OC(C)=O)C2	1780704951	YUNZKQKZGHSYHT-AXVVYFOYSA-N	446.928	1.013	50	20	IDGD	
COc1ccc(CC(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](F)Cl)CCO3)c([N+](=O)[O-])c1	1781412807	ODQCMRGLUXJGOV-AEFFLSMTSA-N	429.832	1.510	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(S(C)(=O)=O)ccc3F)C2)C1	1782151672	SXPPNOKQIPRZAZ-HNAYVOBHSA-N	446.928	1.690	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccn(C(F)F)n1)C2	1782176257	ZFVJIWPHULLJFA-RVZJWNSFSA-N	434.871	1.660	50	20	IDGD	
O=C(c1nc2ccccc2o1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1782235165	ACKBDZVGABJFKA-CXAGYDPISA-N	426.242	1.962	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(OC)ccn3)CCO2)C1	1783349897	VMQBRGANOZAWMG-KDOFPFPSSA-N	426.311	1.707	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)CCc3ccc(F)nc3)CCO2)C1	1783530469	YWIWWZZMNCMFSG-FZKQIMNGSA-N	428.302	1.767	50	20	IDGD	
CCSc1ncccc1C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](Cl)COC)C2)C1	1783869073	NKYHBMYLGBPLMS-KXBFYZLASA-N	427.954	1.891	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1C[C@H]1c1ccc(OC)cc1)CCO2	1783870518	CSUCJDUWOFLXRF-WEMPKCCASA-N	436.936	1.882	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CSc3ccncc3)[C@H]2C1	1785162687	XILRZYJCMLMQPN-SDADXPQNSA-N	442.379	1.937	50	20	IDGD	
CCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1	1785578497	MUCPBPOQQJKGBU-BXTJHSDWSA-N	447.960	1.109	50	20	IDGD	
Cc1cc(CC(=O)Nc2ccc(C3(NC(=O)c4ccc(B(O)O)cc4)CCC3)cc2)nn1C	1786220193	FCHLAKIEGDERKK-UHFFFAOYSA-N	446.316	1.399	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCS(=O)(=O)c3ccccc3)C[C@@H]21)[C@@H](F)Cl	1787445926	UGVJVKYWRGGQNA-OWIUFQIYSA-N	446.928	1.365	50	20	IDGD	
COCCn1nccc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]2C1	1789865867	HNNRJIFDSNFGPW-PWDMQXDWSA-N	447.363	1.359	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3n[nH]cc3[N+](=O)[O-])C[C@@H]21	1790960488	LQCUTZWWZULGPD-KQXIARHKSA-N	444.286	1.085	50	20	IDGD	
CCc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](Br)CC)[C@H]3C2)n[nH]1	1790962203	XQEHIMMYDMRWEQ-ZIEJDFEHSA-N	427.343	1.739	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc4ncccn34)C[C@@H]21	1791056141	OXCOAHDFMHCZMF-OSFYFWSMSA-N	436.310	1.106	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(-n4cccn4)nc3)C[C@@H]21	1791255698	YOEDHTMMPAFOTI-XSLAGTTESA-N	447.923	1.114	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1ccc(C2(NC(=O)c3n[nH]cc3[N+](=O)[O-])CCC2)cc1	1791600971	BESSAMZYODBPHP-UHFFFAOYSA-N	443.464	1.439	50	20	IDGD	
COc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](O)CCl)C[C@@H]32)cc1Cl	1792009789	LPFKKQGVLKGZMT-HPZZRFSDSA-N	431.316	1.542	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCNC(=O)c1ccc[nH]1	1794309069	ZURXYOBNRMRIBH-YIYPIFLZSA-N	425.327	1.556	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)c1cccc2cnccc12	1796189075	SSBBBGOFKNDRMV-ACDBMABISA-N	429.285	1.480	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)c1cccnc1OCC1CC1	1796190809	NSQZCBSOCUAWIX-ACDBMABISA-N	449.316	1.116	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1nccc2[nH]ccc12	1796209146	NIQNLYLUEPBSBH-LMWOUKEDSA-N	435.322	1.940	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnc2ccoc2c1	1796673142	BUQRDLOMNHMXQW-QDMKHBRRSA-N	434.456	1.392	50	20	IDGD	
Cn1ccc2c(O)ncc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)C(Cl)Cl)C4)c21	1798432526	SKULWEAYCBGDQZ-DDFAGTSDSA-N	427.288	1.286	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CSC1CCCC1)C2	1798439631	PRGZZJYRITWCQI-QDMKHBRRSA-N	431.562	1.613	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1c(F)cncc1F	1798930750	XQZCMXCZKNNGFA-BTSNSQKGSA-N	444.442	1.746	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H]1CCCO1)C2	1799217948	NNKWWHMMTUZHRZ-NXEZDXNNSA-N	431.445	1.951	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(N3CCN(C)CC3)cc1)C2	1799264348	FHDLUGWGQMZQLH-YHELAOLJSA-N	448.995	1.659	50	20	IDGD	
COc1ccccc1OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@](C)(Cl)CCl	1799273543	KWUFRPKIONUVHJ-ZZXMYQEDSA-N	445.343	1.900	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1(Br)CC1	1799358330	KQFSJXMOSQQPJB-WRWGMCAJSA-N	438.160	1.677	50	20	IDGD	
O=C(CCNC(=O)c1ccc[nH]1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](F)Br	1800157811	ZGTKWJKUOMAIHP-OXIQGZBJSA-N	429.290	1.463	50	20	IDGD	
C/C=C(/C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2	1800471139	COHIMRQRFGXZRL-SRQBAGKHSA-N	431.445	1.690	50	20	IDGD	
COC(=O)c1ccc(OCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C(Cl)Cl)cc1	1801019170	BDCZJIFNWVDUKE-YWVIFJGQSA-N	445.299	1.245	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cn1cncn1)C2	1801436552	QHWDDESWWBVABZ-MFCNVNSWSA-N	426.427	1.802	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(C(F)(F)F)[nH]1)C2	1802337777	RNZGNLKJWLFGRN-CLLJXQQHSA-N	429.443	1.658	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCc1ccc(N(C)C)cc1)C2	1802339859	RQPLKHWSORMWJF-NUZGMZIFSA-N	443.592	1.696	50	20	IDGD	
N#Cc1ccc(CC(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]2c2cccnc2)cc1	1803137459	PXZYDCIBKASCSY-SFHLNBCPSA-N	426.904	1.801	50	20	IDGD	
CC(C)(C)OC(=O)CC(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1	1803896759	RVSZJUATMQJJSZ-DAYGRLMNSA-N	425.913	1.419	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)c1cnc(OCF)cn1	1805024733	AYYKKGOXLAWGFG-YSVLISHTSA-N	437.859	1.097	50	20	IDGD	
CN(C)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1	1805104798	XZFXYWUDMKKNNN-KFKAGJAMSA-N	431.924	1.462	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC2(CCN(C(=O)[C@H]3CCCS3(=O)=O)CC2)C1	1805388909	IRAGCUMFPLSYDD-HUUCEWRRSA-N	449.411	1.826	50	20	IDGD	
Cc1cncc(CCC(=O)N2CCCC3(CCN(C(=O)c4ccc(B(O)O)cc4)CC3)C2)c1	1807035599	BXXVJTIPXOBYKV-UHFFFAOYSA-N	449.360	1.547	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)C#CC2CC2)[C@@H]1c1cccnc1	1808408432	IPEOUTCMGZIXFJ-AKTXGKLESA-N	446.511	1.635	50	20	IDGD	
COC1(CC(=O)N2CCC3(CCCN(C(=O)c4ccc(B(O)O)cc4)C3)CC2)CCC1	1809972716	OBJUXUFGQOXNHH-UHFFFAOYSA-N	428.338	1.170	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)Cn2cc(Cl)cn2)[C@@H]1c1cccnc1	1813030857	MXEFDHIWTQNSQO-QILLFSRXSA-N	440.331	1.891	50	20	IDGD	
Cc1c[nH]cc1C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1813070539	JZWFJLWSZSGIQB-DYESRHJHSA-N	426.521	1.411	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H](CNC(=O)CN2C(=O)C=CC2=O)[C@H]1c1cccnc1	1813175994	NUMYNKVUQURPAA-DNVCBOLYSA-N	432.908	1.277	50	20	IDGD	
C#CCCCCC(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1	1813227817	XXOHFRDPLOGNDZ-PGRDOPGGSA-N	448.527	1.593	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)CNCP(=O)(O)O)sc2C1	1814763709	ZYNUHZPKSDPCRH-NXEZZACHSA-N	438.874	1.187	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cccn3c(O)nnc23)[nH]n1)[C@H](O)CCl	1814870096	IMLHXOQFYBGRPI-CHWSQXEVSA-N	433.856	1.064	50	20	IDGD	
Cc1nc2ncccn2c1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](O)CCl)n[nH]1	1814871293	LXVVQYFPBVKABW-ZIAGYGMSSA-N	431.884	1.666	50	20	IDGD	
O=C(CCBr)Nc1cc([C@H]2CCCCN2C(=O)CCN2CCOCC2)[nH]n1	1816782503	RCBBOLYXRKHTBP-OAHLLOKOSA-N	442.358	1.909	50	20	IDGD	
CC(C)(C)NCC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1817283146	YSMYRJVSHXLYLR-MRXNPFEDSA-N	442.524	1.102	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)C#Cc2ccccc2)[nH]n1)c1ccc(B(O)O)cc1	1817471488	PJVOXZPFCATJEO-OAQYLSRUSA-N	442.284	1.447	50	20	IDGD	
CC(C)O[C@@H](C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819403601	WMEXKIXUILGAGR-SUMWQHHRSA-N	443.508	1.528	50	20	IDGD	
COC[C@H](NC(C)=O)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)C(C)(C)CCl)CC2	1820183805	GQORNAXQRTURAT-YPMHNXCESA-N	430.958	1.471	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2nc3ncccn3n2)[nH]n1	1822187460	VIPQLGFTSKIPFC-ZYHUDNBSSA-N	447.297	1.937	50	20	IDGD	
CCOC(=O)C1(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)CC1	1822416333	ARQCGVFBGZMMOE-OAHLLOKOSA-N	448.524	1.118	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)[C@H]1CCCSC1	1823453302	SFKQZKXTONIMKR-MAUKXSAKSA-N	442.350	1.539	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCSC(=N)N)CC2	1825642976	XMCLNIDPCSJQRI-JGVFFNPUSA-N	434.385	1.855	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnoc1C1CC1)CC2	1826080323	AYZUDRHBDGFMLG-LBPRGKRZSA-N	446.533	1.607	50	20	IDGD	
Cc1nc(C(=O)N[C@@H]2CCc3nc(NC(=O)C(Cl)Cl)sc3C2)c(=O)[nH]c1C	1826093394	MILLBXXTEFGYRN-MRVPVSSYSA-N	430.317	1.873	50	20	IDGD	
CC(C)(C)[C@@H](O)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1	1828923272	BCXJRCXWDSVJBU-OALUTQOASA-N	445.564	1.325	50	20	IDGD	
O=C(c1ccc(Cl)c(F)c1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1830732984	CSUVWHNVROBUCE-MAUKXSAKSA-N	435.279	1.149	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccn4ccnc34)C2)C1	1831651195	NTJMOVAEFLNJSF-UWJYYQICSA-N	434.924	1.812	50	20	IDGD	
O=C([C@@H](F)Cl)N1CCOC[C@@]2(C1)CN(C(=O)C13CC(C(F)(F)F)(C1)C3)CCO2	1831701240	CTUAUYQPLPQMKA-JGVXXWTJSA-N	428.810	1.710	50	20	IDGD	
C[C@@H](Nc1ccccn1)C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)CCl)CC2)CC1	1833312185	JLXSRFKALUJBCX-CRAIPNDOSA-N	437.972	1.053	50	20	IDGD	
CN(C)c1cccc(C(=O)N2CCC(N3CCC(NC(=O)[C@H](O)CCl)CC3)CC2)c1	1833313221	ADTPBQRPOQDPIY-HXUWFJFHSA-N	436.984	1.538	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cncn3-c3ccncc3)CCO2)C1	1833654271	FDXLRBZVJPQGBL-DYESRHJHSA-N	447.923	1.355	50	20	IDGD	
COCc1oncc1C(=O)NC1CCN(C2CCN(C(=O)C(Cl)Cl)CC2)CC1	1835236822	RZCPNTSJOIAQTA-UHFFFAOYSA-N	433.336	1.810	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)c1ccc2c(c1)COC2	1835378608	MDZRLYGJBPSSDQ-HXUWFJFHSA-N	435.952	1.502	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnc(N)s3)CCO2)C1	1835846205	BAJIBYNHNLFOEN-HOTGVXAUSA-N	437.349	1.032	50	20	IDGD	
Cc1c(F)ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)c1N	1835875065	MYIPRTUQNHGBOS-GOSISDBHSA-N	434.295	1.590	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cc(OC)ccn3)CC2)CC1	1835924421	ZTQBDMYMDWUZMJ-GOSISDBHSA-N	438.956	1.529	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3cccs3)CCO2)C1	1836091975	JZAOYCGWBKYJDT-SUMWQHHRSA-N	431.352	1.530	50	20	IDGD	
CCc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@](C)(Cl)CCl)C3)C2)n[nH]1	1836280896	LKSJZMLDLNERAT-MSOLQXFVSA-N	433.336	1.278	50	20	IDGD	
O=C(CCc1cccc(O)c1)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836720644	ZBFWEZAODQIDCJ-FQEVSTJZSA-N	438.952	1.923	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(Cl)cn3)CCO2)C1	1837899825	VOCPRGUBDHQTBC-SJCJKPOMSA-N	446.729	1.588	50	20	IDGD	
O=C(c1cccc(C(F)(F)F)n1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1837931967	AQUKGTSANNKFBB-BBRMVZONSA-N	439.793	1.705	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)c3ccc(OC)cc3)C2)C1	1839141646	OMMGMBREZHNQBL-BBTUJRGHSA-N	440.924	1.202	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccsc3)C2)C1	1839151889	HQQPDGPEATYPJA-QZTJIDSGSA-N	435.373	1.983	50	20	IDGD	
Cc1ccncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839200261	FCLXOLTUXBHPHJ-YOEHRIQHSA-N	430.274	1.151	50	20	IDGD	
O=C(c1ccc(O)c(F)c1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1839305351	IWGCDNQQXQBMNU-YOEHRIQHSA-N	449.248	1.292	50	20	IDGD	
Cc1cccnc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)Br)CCO2	1840030527	OMVMSUFEGPCGGB-KSSFIOAISA-N	426.311	1.243	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3cc(C)cs3)C2)C1	1840150388	KKBWRAZKFGZDOT-FXAWDEMLSA-N	444.981	1.699	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc([C@H](C)C#N)c3)C2)C1	1840156960	YWKHGLDKRORKJR-WVBUVRCRSA-N	449.935	1.637	50	20	IDGD	
Cc1cnn([C@@H](C)C(=O)N2CCO[C@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)c1	1840400724	DOMDLYARZCHFPG-OXJNMPFZSA-N	426.945	1.474	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@H]2CC(=O)N(Cc3cccs3)C2)C1	1841980548	XUVRNJOKBLXTAQ-GDBMZVCRSA-N	439.965	1.554	50	20	IDGD	
CC(=O)N(C)[C@@H](C)C(=O)N1CCCC12CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1843424394	NOXZUALEFNPZDX-ZFWWWQNUSA-N	444.960	1.189	50	20	IDGD	
Cc1ccc2[nH]c(C(=O)N3CCCC34CN(C(=O)c3cnccc3C(=O)NN)C4)cc2c1	1843683579	HWHUWTYRCSVCCE-UHFFFAOYSA-N	432.484	1.606	50	20	IDGD	
Cc1ccc2cc(C(=O)N3CC4(CCCN4C(=O)c4cnccc4C(=O)NN)C3)ccc2n1	1844264461	VIMDGOTWGCXYFJ-UHFFFAOYSA-N	444.495	1.673	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)c1cncnc1)C2	1844692089	FDFIAFLSVNBQBF-UHFFFAOYSA-N	425.401	1.441	50	20	IDGD	
COc1ccc(C(=O)N2CCCC23CN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C3)c(C)c1	1844985229	IOTNALNVIQWKHQ-PCLIKHOPSA-N	437.500	1.955	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC12CN(C(=O)C1=NN(c3ccccc3)C(=O)C1)C2	1846177122	YKNUDIICZQXDCX-ZDUSSCGKSA-N	433.306	1.766	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)C13CCC(C(=O)OC)(CC1)CC3)C2	1846362450	FUKYNNFDNBCEJN-VMEOHVCESA-N	426.941	1.957	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1c(-n2cccc2)sc2c1CCSC2	16146012	RRLAJXCAGYZRDJ-LLVKDONJSA-N	425.557	1.524	50	20	IDGD	
CS(=O)(=O)NCCc1ccc(C(=O)NNC(=S)NCCc2cccs2)s1	21126053	GKMJLZLUJOKQSV-UHFFFAOYSA-N	432.618	1.253	50	20	IDGD	
COCCCNC(=S)N(C)NC(=O)c1ccc(S(=O)(=O)N2CCC[C@@H](C)C2)cc1	726077304	VOBLCWPWAKFAKR-OAHLLOKOSA-N	442.607	1.595	50	20	IDGD	
C[C@@]1(c2ccc(CNC(=O)NNC(=O)c3cccc4cccnc34)cc2)NC(=O)NC1=O	726281815	DUDVRYVLGIYWNI-QFIPXVFZSA-N	432.440	1.434	50	20	IDGD	
CS(=O)(=O)Cc1c(C(=O)OCC(=O)NNC(=O)c2ccccc2)oc2ccccc12	726658559	FZTOSSCHKMKLDD-UHFFFAOYSA-N	430.438	1.595	50	20	IDGD	
CCOC(=O)C1=NN(c2ccccc2)[C@@H](C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)C1	727766181	JBUFTSNFKLMTBL-KBXCAEBGSA-N	442.447	1.938	50	20	IDGD	
C[C@H]1C[C@H](C)CN(S(=O)(=O)c2ccc(S(=O)(=O)NNC(=O)c3ccc[nH]3)cc2)C1	728260582	JLSWAMHTELMHGD-KBPBESRZSA-N	440.547	1.305	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)c1	728526424	VMMKWAWXMGKRDM-UHFFFAOYSA-N	426.227	1.759	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)ccc1OCC(=O)OC	728613677	FIDOULQMABHCHP-UHFFFAOYSA-N	443.456	1.654	50	20	IDGD	
Cc1cc(C)cc(N2CC[C@@H](C(=O)OCC(=O)NNC(=O)Cc3nc(C)cs3)C2=O)c1	728728788	AYVYIYTZRDWOSG-MRXNPFEDSA-N	444.513	1.355	50	20	IDGD	
O=C(NCCN1CCc2sccc2C1)NNC(=O)C1CCN(c2ncccn2)CC1	728950147	YMQOWIXBTVKXFH-UHFFFAOYSA-N	429.550	1.143	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)N2CCN(CC(=O)Nc3ccccc3Cl)CC2)c1	728954431	FCGBBJZGZGZTLA-UHFFFAOYSA-N	440.891	1.822	50	20	IDGD	
N#Cc1cccc(OC2CCN(C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)CC2)c1	729229786	OTGZHRUELALYJE-UHFFFAOYSA-N	449.515	1.849	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@@H]2CC(=O)N(c3ccc(F)cc3)C2)cc(OC)c1OC	730160298	HWUGOKBPIMONNM-CYBMUJFWSA-N	431.420	1.666	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)c1cnn(-c2ncccc2Cl)c1C(F)F	730743354	MWJPCHSCSWQTOX-QMMMGPOBSA-N	433.824	1.054	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)N1CCN(S(=O)(=O)c2c(C)c(C)c(C)c(C)c2C)CC1	731848513	GDIYVDBXMARSFW-SFHVURJKSA-N	438.594	1.481	50	20	IDGD	
CCCC(=O)N1CSC[C@H]1C(=O)NNC(=O)c1ccc(OC)c(Br)c1	732036139	XXTYCASJOKFWSK-LBPRGKRZSA-N	430.324	1.920	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2occc2CS(=O)(=O)c2ccccc2)C[C@H](C)O1	732259462	DYNKTSBEXLMONN-HOTGVXAUSA-N	449.529	1.514	50	20	IDGD	
CCOc1ccccc1[C@H](CC(=O)NNC(=O)CCN1C[C@@H](C)O[C@H](C)C1)NC(C)=O	732259611	IHEZXHMAGZBYFE-MDZRGWNJSA-N	434.537	1.299	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)C2CCN(C(=O)CCc3ccccc3)CC2)C[C@H](C)O1	732263854	PITSYZZCBRUZNE-OALUTQOASA-N	444.576	1.505	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)N[C@@H]2CCN(c3ccccc3Cl)C2=O)cc1	732469991	QBIUXRAGRNLMCZ-MRXNPFEDSA-N	427.848	1.726	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NCCCCN1C(=O)c2ccccc2C1=O	732472791	WHMGVYWRSMVEGF-AWEZNQCLSA-N	442.447	2.000	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@@H](NC(=O)NN[C@@]1(C)CCS(=O)(=O)C1)C1CCCCC1	732474366	BWTQTUINVDJZET-BEFAXECRSA-N	432.587	1.841	50	20	IDGD	
Cc1ccc([C@@]2(C)NC(=O)N(CC(=O)NNC(=O)NCc3ccc(Cl)cc3)C2=O)cc1	733004918	YGKKCXUIJYPVDT-OAQYLSRUSA-N	443.891	1.946	50	20	IDGD	
COc1ccc(CN2CC[C@H](NC(=O)NNC(=O)COc3ccccc3C#N)C2=O)cc1	734682453	AHZGLAXZLPVRBP-SFHVURJKSA-N	437.456	1.077	50	20	IDGD	
C[C@H]1OC(C)(C)N(C(=O)OC(C)(C)C)[C@@H]1C(=O)NNC(=O)c1ccc2c(c1)OCCO2	735839696	FGQMTOPKOAYHOG-WBMJQRKESA-N	435.477	1.979	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)N[C@H]1CC=CCC1	737063185	DQIJNDWKMZPOTH-KRWDZBQOSA-N	436.534	1.079	50	20	IDGD	
C[C@@H]1CC(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)C[C@@H](C)C1	740490205	OHLAAXRMCMNTDG-GJZGRUSLSA-N	438.550	1.476	50	20	IDGD	
O=C(NNC(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1csc(N2CCOCC2)n1	742478451	OZWUJKCOKKMVDP-UHFFFAOYSA-N	445.379	1.982	50	20	IDGD	
COC(=O)CN(C(=O)CCC(=O)C(C#N)=C1N(C)c2ccccc2N1C)C1CCOCC1	742957043	YQIYMEIQQFTCTI-UHFFFAOYSA-N	440.500	1.838	50	20	IDGD	
Cn1c(N)c(C(=O)/C(C#N)=C\c2cc(Cl)ccc2OC[C@H]2CCCO2)c(=O)n(C)c1=O	743248502	VTNJVDNFZVMTSJ-JEMSNHSXSA-N	444.875	1.667	50	20	IDGD	
COC(=O)c1ccc(S(=O)(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)c(Cl)c1	743269176	ZRJYVRCRLMHJBG-UHFFFAOYSA-N	429.794	1.364	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)N[C@@H]2CC(=O)N(c3ccccc3)C2)cc1	743571094	VZXGCWMFLIYBBG-CQSZACIVSA-N	431.474	1.231	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)CSc2ccc3c(c2)OCCO3)cc1	743829415	PHYVDUOYKGCNCQ-UHFFFAOYSA-N	437.499	1.806	50	20	IDGD	
CCN(C(=O)[C@H](C)OC(=O)/C(C#N)=C\c1cc(C#N)n(C)c1C)[C@H]1CCS(=O)(=O)C1	744633058	SYOQHVSSDAASMC-ASIHQCGVSA-N	432.502	1.079	50	20	IDGD	
C[C@@]1(NNC(=O)NC[C@@H](c2ccc(Cl)cc2)N2CCOCC2)CCS(=O)(=O)C1	744866708	WUFIXPCGBHIHKW-FUHWJXTLSA-N	430.958	1.094	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)[C@@H](c2ccccc2)N2CCCCC2=O)c1	744989721	GYYQQMKJJYGZPO-OAQYLSRUSA-N	434.452	1.616	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)C[C@@H]2CN(Cc3ccccc3)CCO2)cc1	745102327	QHULOVULYWIOBY-HXUWFJFHSA-N	436.468	1.154	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)[C@@H](C)Cc1c(C)nn(C)c1C	745273097	OEWRFTJGFKCGQM-NSHDSACASA-N	436.896	1.882	50	20	IDGD	
COC(=O)[C@H]1CCC[C@H](C(=O)NNC(=O)c2ccc(CSc3nncn3C)cc2)C1	746093368	PEBQYELRWOYBQN-HOTGVXAUSA-N	431.518	1.848	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)NC2CCN(C)CC2)cc1	746581958	ISFJLCHOXXBBHL-GHRIWEEISA-N	436.516	1.551	50	20	IDGD	
COc1cc(C)nc(NNC(=O)c2ccc(Cl)c(S(=O)(=O)N3CCCC3)c2)n1	746629945	BOZOKFUJAITHKX-UHFFFAOYSA-N	425.898	1.988	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)[C@@H]2CCCN(S(=O)(=O)c3ccc(F)cc3)C2)cc1	747174328	JAYGKAKXKZZAAR-MRXNPFEDSA-N	430.461	1.559	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCc2ccco2)cc1C(=O)NNC(=O)Cc1ccncc1	747428525	QAUSEQZBBFWIOC-UHFFFAOYSA-N	428.470	1.465	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)N1CC[C@@]2(CCCN(Cc3ccccc3)C2)C1	747501980	HKSUJXWKVVDDOH-HSZRJFAPSA-N	439.516	1.738	50	20	IDGD	
Cc1nc(S(=O)(=O)N2CCC(C(=O)NNC(=O)c3cccc(Cl)c3)CC2)cn1C	747625967	XOPBULSEOWBBPN-UHFFFAOYSA-N	439.925	1.244	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)F)cc1)[C@@]1(O)CCN(Cc2ccccc2)C1	748609969	GTXLHMQFTYEYRP-LJQANCHMSA-N	425.457	1.763	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)N[C@@H](C)c1cc(F)ccc1N1CCC(O)CC1	748634491	XJAGTDDGCLYXIK-KBPBESRZSA-N	426.489	1.230	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)N[C@@H]2CCN(c3cc(OC)cc(OC)c3)C2)cc1	748662784	VVIYWWYJJVIRFF-OAHLLOKOSA-N	444.488	1.701	50	20	IDGD	
COC(=O)c1ccc(C(=O)OC)c(S(=O)(=O)NNC(=O)c2cc3ccccc3o2)c1	749866475	ACMUJNJXGZBQPV-UHFFFAOYSA-N	432.410	1.629	50	20	IDGD	
CCOc1ccc(-c2noc(CCC(=O)NNC(=O)CNC(=O)c3cccs3)n2)cc1	751209286	OCOAQBJYQFFCJI-UHFFFAOYSA-N	443.485	1.707	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCc1cnc(N(C)C)n1C	751807111	MYOPVRIZTYPZPX-NSHDSACASA-N	439.314	1.547	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)c2csc(Cc3ccc(N)cc3)n2)c1	751930012	FRNREHXLBUMIJC-UHFFFAOYSA-N	435.465	1.806	50	20	IDGD	
Nc1nc(Cl)cc(NNC(=O)C2CCN(C3=NS(=O)(=O)c4ccccc43)CC2)n1	753455011	MYARCZWKKDNDNA-UHFFFAOYSA-N	435.897	1.016	50	20	IDGD	
Cc1nccc(NCc2cccc(C(=O)OCC(=O)NNC(=O)c3cccc(C#N)c3)c2)n1	754956585	OQZHGDDZFKLYNO-UHFFFAOYSA-N	444.451	1.887	50	20	IDGD	
Cc1ccc(-n2nc(Br)cc2C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)cc1	755062073	GDMRAKUAICPWEP-LLVKDONJSA-N	441.307	1.139	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCCCC2)cc1NC(=O)NNC(=O)Cc1cccnc1	755393898	WJXBOIYBWZBHDV-UHFFFAOYSA-N	431.518	1.960	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2cc(S(C)(=O)=O)ccc2F)c2ccccc2c1=O	755403744	COPAYLJKGKBHHR-UHFFFAOYSA-N	432.433	1.034	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1ncc(Cc2cc(F)cc(F)c2)s1	755474293	CDSWNGRNMZFPQH-MRVPVSSYSA-N	433.462	1.103	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CNC(=O)c2ccccc2C(F)(F)F)cc1C	755623357	RSQQPNFULWFEDV-UHFFFAOYSA-N	436.390	1.838	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2cccc(-n3nnnc3SC)c2)cc1OC	755729232	GQWWRGOVWVWXGL-UHFFFAOYSA-N	429.462	1.868	50	20	IDGD	
CCC(=O)Nc1ccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1	755913949	KEFWVNTUZUCUNK-UHFFFAOYSA-N	433.490	1.752	50	20	IDGD	
COC(=O)c1n[nH]c2ccc(NC(=O)NNC(=O)C3CCN(c4ncccn4)CC3)cc12	756575603	WHHIIZNFEWAFJN-UHFFFAOYSA-N	438.448	1.209	50	20	IDGD	
COC(=O)NCc1ccc(NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1	756612169	UNEMFASNSZBEJJ-UHFFFAOYSA-N	427.465	1.402	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)on1)Nc1ccn(CCN2CCOCC2)n1	756646718	OFKPMZOQUYZUEU-UHFFFAOYSA-N	425.449	1.337	50	20	IDGD	
CCn1ncc(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)c1-c1ccccc1	756796352	IDPVMXODXUJBBE-UHFFFAOYSA-N	426.502	1.938	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2cnn(-c3ccccc3F)c2)c1	757657360	LUOSXPXVZWWCPY-UHFFFAOYSA-N	446.464	1.728	50	20	IDGD	
Cc1nn([C@@H]2CCS(=O)(=O)C2)c(C)c1NC(=O)NNC(=O)Cn1ccc2ccccc21	757871263	HUMOJNJSBGCRDS-MRXNPFEDSA-N	444.517	1.667	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)NCCNS(=O)(=O)NC(C)C)c(C)n1C[C@@H]1CCCO1	760641238	NTRVYTCNEQWQPH-LOHYDARVSA-N	437.566	1.140	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCCC(=O)NNc1nc(-c2ccncc2)no1	760872447	WYJHNFGLSIEBOQ-CQSZACIVSA-N	445.480	1.481	50	20	IDGD	
O=C(NNc1ncc(F)cn1)C1CCN(c2ccc3nnc(C(F)(F)F)n3n2)CC1	760906161	OICXXKSQHCZODE-UHFFFAOYSA-N	425.350	1.432	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c(Br)c1	763441700	HRUGYYBUECJVEO-UHFFFAOYSA-N	437.206	1.766	50	20	IDGD	
CCOc1cc2c(cc1NC(=O)C(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)O[C@H](C)C2	763444102	RLRVSZBAIMTWJZ-LLVKDONJSA-N	428.401	1.717	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(-c3ccnc(C)n3)c2)cc1OC	763550730	KQDZIPWYQNKIIJ-UHFFFAOYSA-N	435.440	1.869	50	20	IDGD	
CCN(CC)C(=O)c1ccccc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccccc2)[nH]n1	763602255	YCUVFVSZKXJSGD-UHFFFAOYSA-N	448.483	1.958	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(Cl)ccc1C(=O)N(C)C	763663260	POFYITCEGFJPPT-UHFFFAOYSA-N	448.863	1.215	50	20	IDGD	
CNC(=O)c1cc(NC(=O)C(=O)NNC(=O)COc2cc(C)ccc2C)ccc1Cl	763667478	AEIHAVRAFKUTGV-UHFFFAOYSA-N	432.864	1.481	50	20	IDGD	
CCOC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2F)cc1C#N	763678738	INCIIWOCXNORFR-UHFFFAOYSA-N	443.391	1.431	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccc(N(C)C(C)=O)c1	763681367	KIMTWGRUAOYPJU-UHFFFAOYSA-N	428.445	1.233	50	20	IDGD	
CCN(CC)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(OC)cc(OC)c2)cc1	763771497	BFPFPTRVLTUZFH-UHFFFAOYSA-N	442.472	1.586	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2cccc(C(=O)NCc3ccccc3)c2)n1	763880594	INKSZNFFMMXWOO-UHFFFAOYSA-N	448.483	1.216	50	20	IDGD	
COC(=O)c1c(F)cccc1NC(=O)C(=O)NNC(=O)c1ccc(Br)s1	763940239	FUGSLNUMADDTMP-UHFFFAOYSA-N	444.238	1.836	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc(C(=O)N2CCOCC2)c(Cl)c1	763962970	WDDBEWNXMLVTIH-UHFFFAOYSA-N	444.875	1.521	50	20	IDGD	
CC(C)Cn1ncc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)c1C(C)C	764005381	WWURQBRIJFXSRB-UHFFFAOYSA-N	429.477	1.833	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)CNC(=O)c2ccc(F)cc2)CC1	764139399	SMUCUICCXWXSDO-UHFFFAOYSA-N	437.472	1.285	50	20	IDGD	
C[C@H]1CN(C(=O)c2ccc(NC(=O)C(=O)NNC(=O)CC3CCCC3)cc2)C[C@@H](C)O1	764184134	NIBSDWKCDGQLRP-GASCZTMLSA-N	430.505	1.602	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)CNC(=O)c2cccnc2)c2cnn(Cc3cccs3)c2n1	764342271	FQZISGAXMCICGD-UHFFFAOYSA-N	449.496	1.436	50	20	IDGD	
COC(=O)c1c(C2CC2)csc1NC(=O)C(=O)NNC(=O)COCc1ccccc1	764363609	STJZHNVPDRMJPU-UHFFFAOYSA-N	431.470	1.715	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)C(=O)Nc1cccc(OC[C@H]2CCCO2)c1	764365778	AYTARRKZGNWSSB-LJQANCHMSA-N	427.457	1.547	50	20	IDGD	
CNC(=O)c1ccc(C)c(NC(=O)C(=O)NNC(=O)CSc2ccccc2OC)c1	764396758	BRLKKGBKGLIHFI-UHFFFAOYSA-N	430.486	1.241	50	20	IDGD	
Cc1c(C(=O)NNC(=O)CSc2ccccc2O)sc2nc3n(c(=O)c12)CCC3	765250482	UTXOWGKVQADCIB-UHFFFAOYSA-N	430.511	1.972	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCc4ccccc43)c2)n[nH]1	765587657	PLXAOJRLGLIDCC-UHFFFAOYSA-N	439.497	1.934	50	20	IDGD	
CN(C)c1ccc(C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)cn1	765757997	ZKQWOKFSGBJGAQ-UHFFFAOYSA-N	430.940	1.380	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NN=C[C@@H](C)CCC#N)N(S(C)(=O)=O)CC2	766000959	BSWWEVZYDJSMMT-YOEHRIQHSA-N	436.534	1.995	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1	767272406	KSECDYPNADILMA-UHFFFAOYSA-N	438.400	1.031	50	20	IDGD	
CCOc1cc(/C=C\C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)ccc1O	768623981	KMEVQRXKMMEZGG-IBHIWXBSSA-N	442.424	1.335	50	20	IDGD	
CCn1c(O)nc2cc(C(=O)NNc3c(OC)cccc3S(C)(=O)=O)ccc2c1=O	768645930	USERNQWRAJJHSE-UHFFFAOYSA-N	432.458	1.291	50	20	IDGD	
CCNC(=O)COc1ccc(NC(=O)NNc2c(OC)cccc2S(C)(=O)=O)cc1	769221035	FEGXUEZRBSUMDW-UHFFFAOYSA-N	436.490	1.762	50	20	IDGD	
CSCCNC(=S)NNC(=O)[C@H]1CC(=O)N(c2cccc(Br)c2)C1	769764469	CYKVLZLEGROJIV-JTQLQIEISA-N	431.381	1.660	50	20	IDGD	
COCCOc1ccc(C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c(Cl)c1	769848589	FYIDMROYVHZRFP-UHFFFAOYSA-N	426.878	1.844	50	20	IDGD	
CNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2sc(-c3ccccc3)nc2C)cn1	770221319	VXLWLDQWSZDMCF-UHFFFAOYSA-N	431.499	1.496	50	20	IDGD	
COCCOc1ccc(C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)c(Cl)c1	770416340	BFABMBKIRZYADU-UHFFFAOYSA-N	431.832	1.855	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c2ncccc12	771282630	SYAWEAYMBODPEI-UHFFFAOYSA-N	443.485	1.960	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1ccc([N+](=O)[O-])cc1I	772069403	PNEHHHQMGODUNE-SSDOTTSWSA-N	435.174	1.302	50	20	IDGD	
COc1ccc(C(=O)CCC(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)cc1OC	772188428	OWZVGFWQAVGWDE-UHFFFAOYSA-N	447.875	1.784	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCN(Cc2nc(C)c(C)o2)CC1	772747242	KSFHSEZSWBNKOQ-UHFFFAOYSA-N	435.912	1.532	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)CN1C(=O)COc2ccc([N+](=O)[O-])cc21	772998231	WZNOLOGXJNTEGF-LLVKDONJSA-N	448.819	1.589	50	20	IDGD	
C=Cn1cc(C=NNC(=O)C[C@@H]2c3cc(OC)c(OC)cc3CCN2S(C)(=O)=O)cn1	773023182	AXTRJLDJBYFJQQ-QGZVFWFLSA-N	447.517	1.400	50	20	IDGD	
CNS(=O)(=O)c1cccc(S(=O)(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)c1	773263233	FMUZNYJUCCLEOQ-LLVKDONJSA-N	447.922	1.025	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)[C@@H]2CCN(C(=O)OCc3ccccc3)C2)c1	773582402	QTMDTLJVIBSKJT-LJQANCHMSA-N	439.468	1.958	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2ccc(I)cc2Cl)n1	773726618	OFHKPBYVJZENRI-UHFFFAOYSA-N	447.620	1.825	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)NCc1cnn(-c2ccc(Br)cc2)c1	775205316	GEZVDFYPPLXBEW-GFCCVEGCSA-N	440.298	1.517	50	20	IDGD	
COc1ccnc(NNC(=O)Nc2cc(S(=O)(=O)N3CCCCC3)ccc2OC)n1	775444628	IGPXJESOZBPFMG-UHFFFAOYSA-N	436.494	1.817	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@@H]2CCC[C@@H]2OC)c1	775461235	UXEJKXVFRVEXEG-RDJZCZTQSA-N	426.539	1.476	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)[C@H]2CCCN2C(=O)C(F)(F)F)c2ccccc2c1=O	776598628	SUWQMMGVUAOUPY-CYBMUJFWSA-N	439.394	1.121	50	20	IDGD	
CC(C)Oc1ccc(NS(=O)(=O)CC(=O)NNc2cccc(S(C)(=O)=O)c2)cc1	776721126	MPRIRVBISZTPSX-UHFFFAOYSA-N	441.531	1.762	50	20	IDGD	
COc1ccc(Cn2ccc(NC(=O)C(=O)NNC(=O)c3cccc(Cl)c3)n2)cc1	778707998	YWVUAOBMKITBOS-UHFFFAOYSA-N	427.848	1.993	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)Nc1ccnn1Cc1ccc(Cl)c(F)c1	779479281	HLPLNRXOXMTGRB-LLVKDONJSA-N	429.861	1.311	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@]2(C[C@H]2C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)C1	780347885	PPFQXNSANUJHBW-MGPUTAFESA-N	437.518	1.498	50	20	IDGD	
COc1ccc(NNC(=O)C2CCN(S(=O)(=O)c3ccc4c(c3)OCCO4)CC2)nc1	781536063	PJUAENRTLULJLF-UHFFFAOYSA-N	448.501	1.405	50	20	IDGD	
O=C(NNc1nc2ccccc2s1)C(=O)Nc1cccc(N2CCCS2(=O)=O)c1	782816244	TVQZAXRJOCXQGQ-UHFFFAOYSA-N	431.499	1.918	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2cccc(C(=O)OCc3ccccc3)c2)CCS(=O)(=O)C1	783427277	NYHKKKBQPYVGDM-OAQYLSRUSA-N	445.497	1.180	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2cnn(-c3ccc(C(F)(F)F)cc3)c2)CCS(=O)(=O)C1	783427358	RQCHSJWWJOEWKF-INIZCTEOSA-N	445.423	1.028	50	20	IDGD	
N#Cc1ccc(NNC(=O)C(=O)Nc2ccc(N3CCNC(=O)C3)cc2)cc1C(F)(F)F	784240158	ODBNBZMNIVZKMX-UHFFFAOYSA-N	446.389	1.595	50	20	IDGD	
O=C(NC1CC1)c1cc(F)c(NNC(=O)[C@H]2CC=CC[C@@H]2C(=O)N2CCOCC2)c(F)c1	784448089	FMBABBSXOVWXPZ-HOTGVXAUSA-N	448.470	1.741	50	20	IDGD	
O=C(NNc1nccnc1Cl)C(=O)Nc1cc(Br)cnc1-n1cccn1	784776889	WUVDUNIHESNMNR-UHFFFAOYSA-N	437.645	1.555	50	20	IDGD	
O=C(NNc1ccc(F)c(F)c1F)C(=O)Nc1ccc(CC(=O)N2CCOCC2)cc1	784811363	SRSAHZMNJXRRCS-UHFFFAOYSA-N	436.390	1.587	50	20	IDGD	
CC[C@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)cc1	785061145	UCDANLOIYBFCCV-AWEZNQCLSA-N	436.472	1.191	50	20	IDGD	
CC(C)Cn1ncc(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)c1C(F)F	785067158	HSOMWHLLMHGVGN-UHFFFAOYSA-N	433.419	1.453	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)c1C	785612308	FZWHMIPVQDBPIX-UHFFFAOYSA-N	437.500	1.172	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)ccc1F	789809700	DWIPNYSXLDYHJT-YOEHRIQHSA-N	429.404	1.271	50	20	IDGD	
COC(=O)Nc1cc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)ccc1F	789811238	XVOZSEOMTDWAMW-YOEHRIQHSA-N	444.419	1.663	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@](C)(O)Cn2ccc(C)cc2=O)cc1Br	790703738	JIBOUIVPZGNZTP-GOSISDBHSA-N	438.278	1.140	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)Cc2cccc(Br)c2C)n1	791514980	TYLXEWOPRIKUQN-UHFFFAOYSA-N	440.319	1.998	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NN=C(c1ccc(Cl)c(S(N)(=O)=O)c1)C1CC1	794525815	AHSNVNLJHUAFPR-UHFFFAOYSA-N	430.914	1.742	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)c1nn(-c2ccc(F)cc2)ccc1=O	795176573	DHHQTYSGWIWTJA-UHFFFAOYSA-N	431.449	1.379	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	798339833	JLSFDPHWKSHFOR-UHFFFAOYSA-N	433.895	1.156	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N1CC[C@@H]2NC(=O)OC[C@H]2C1	798510786	YCOPACDCNOOGPZ-WDMOLILDSA-N	441.282	1.388	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)N[C@H]2CC(=O)N(Cc3ccccc3)[C@@H]2C)cc1C	798529943	AFRNFWIQVNYDRW-APWZRJJASA-N	437.500	1.762	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc(C)c1Cl	799835187	NANLOHGWZBZRRJ-UHFFFAOYSA-N	437.909	1.650	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CNC(=O)c2ccc(Br)s2)cc1	801109665	XPUJVTZWSOCCNE-UHFFFAOYSA-N	439.291	1.335	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@]2(NC(=O)OCc3ccccc3)CCOC2)cc1	801111212	NGQOQARFEDEXTE-JOCHJYFZSA-N	440.456	1.166	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)OCc2ncnn2C)cc1	801209494	KCKWXKQQZRCRKS-OQLLNIDSSA-N	435.444	1.213	50	20	IDGD	
CN(C)C(=O)Cn1cc(C(=O)NNC(=O)Nc2ccc(Br)cc2Cl)nn1	802039107	XFGCLSLRQPFIBM-UHFFFAOYSA-N	444.677	1.249	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2ccc(OC)c(S(=O)(=O)NC3CC3)c2)cc1	802052253	MESWNFGNOPOAEU-UHFFFAOYSA-N	434.474	1.611	50	20	IDGD	
COc1ccc(C(=O)CNC(=O)CCC(=O)NNC(=O)Nc2ccc(N(C)C)cc2)cc1	802118629	HDQNCCWUWUDEBO-UHFFFAOYSA-N	441.488	1.693	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)c1cn2ccc(Br)cc2n1	803942281	FQWHGCRRAQYUNX-UHFFFAOYSA-N	445.273	1.952	50	20	IDGD	
COc1cc(N)c(C(=O)OCC(=O)NNC(=O)c2cccs2)cc1Br	803951865	QPFCZUIQUFGWKI-UHFFFAOYSA-N	428.264	1.719	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(NC(=O)NNC(=O)COc2ccccc2O)ccc1F	806542961	DTVWTTZRHNZRKB-UHFFFAOYSA-N	426.426	1.013	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccc(F)cc1OC1CCOCC1	806977623	RILHGMCEGOVLQS-UHFFFAOYSA-N	445.447	1.721	50	20	IDGD	
NS(=O)(=O)c1ccc(C=NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1Br	807939694	CDGMTTPKFYLFML-UHFFFAOYSA-N	427.236	1.769	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2nccnc2Cl)c(C(=O)NCC(F)(F)F)cc1F	810396281	JEEIJWXDYGESHF-UHFFFAOYSA-N	448.764	1.951	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1)NNc1ncc(F)cn1	810776812	JESBPDBPDGKWOG-UHFFFAOYSA-N	427.767	1.710	50	20	IDGD	
CC[C@H]1[C@H](C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)CCN1C(=O)OC(C)(C)C	811299000	FMJLVCQBLLSXCQ-SJORKVTESA-N	444.488	1.898	50	20	IDGD	
Cc1cnn(C)c1S(=O)(=O)NC(=O)/C(C#N)=C/c1cc(C)n(C[C@@H]2CCCO2)c1C	813992118	UFQZPUKCXQADCD-GONKEYIRSA-N	431.518	1.738	50	20	IDGD	
O=C(NN=Cc1ccccc1-n1cncn1)c1cccc(S(=O)(=O)N2CCOCC2)c1	814689243	XNFJYKOYQSKXOE-UHFFFAOYSA-N	440.485	1.052	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN2CCCNC(=O)[C@H]2Cc2ccccc2)cc1C	815142287	QDOJPPYSWMUYCF-QGZVFWFLSA-N	428.558	1.813	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)CNC(=O)c2cccs2)cccc1-c1ncco1	815593386	KTXBNUJSZXVGRY-UHFFFAOYSA-N	427.442	1.227	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)c3ccc4c(c3)NC(=O)CNC4=O)n[nH]2)cc1	815887821	VFSGTKZTMIFYGZ-UHFFFAOYSA-N	432.440	1.396	50	20	IDGD	
Cc1nnnn1/C(=C/c1ccc(F)cc1)C(=O)NNc1ccccc1S(=O)(=O)N(C)C	817054448	KEOMOCSSWBQBAP-SFQUDFHCSA-N	445.480	1.512	50	20	IDGD	
O=C(c1ccc(Cl)c(S(=O)(=O)Nc2ccc(F)cc2)c1)N1CC[C@H](B(O)O)C1	864234845	XAVMXFKKHRZCEG-LBPRGKRZSA-N	426.662	1.969	50	20	IDGD	
COc1cc(C(=O)NNC(=O)COc2cccc(NC(=O)C3CC3)c2)cc(OC)c1OC	914747655	BYHBWASUTQAJIU-UHFFFAOYSA-N	443.456	1.901	50	20	IDGD	
COCCS(=O)(=O)CC(=O)NNC(=O)c1ccc(COc2ccc(Cl)cc2)cc1	915635015	UDKIXDZOISXEHW-UHFFFAOYSA-N	440.905	1.741	50	20	IDGD	
Cc1cc(C)n(CCCNC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)n1	915889774	MZXREPIDGXBFDK-UHFFFAOYSA-N	427.553	1.433	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NN=C2CCN(Cc3ccccn3)CC2)cc1	915943826	DYMNNWZRDHGQOC-UHFFFAOYSA-N	429.546	1.779	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)NCc3ccnc(N4CCOCC4)c3)n[nH]2)cc1	916388706	FWUJPRZAUVKMOP-UHFFFAOYSA-N	435.488	1.761	50	20	IDGD	
CCN(CC)C(=O)c1ccc(CNC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1	916389192	HPDBEKRFGHBJBP-IBGZPJMESA-N	426.473	1.839	50	20	IDGD	
CCCCOc1ccc(CNC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1OC	916391272	CMMAYVUWDHLFHK-UHFFFAOYSA-N	439.476	1.994	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCCCN2CCc3ccccc32)c2ccccc2c1=O	916458085	UCJCZTRCXSVODK-UHFFFAOYSA-N	434.500	1.813	50	20	IDGD	
O=C(Cc1ccc2ccccc2c1)NNC(=O)NCCNS(=O)(=O)Cc1ccccc1	916516263	IEPTVLVQURDHMU-UHFFFAOYSA-N	440.525	1.832	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CCNS(=O)(=O)c2ccc(C)c(C)c2)cc1C	916561786	FUZIPDLQPDGQIV-UHFFFAOYSA-N	446.529	1.375	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)c2ccc3c(c2)S(=O)(=O)N(CCOC)C3=O)cc1	916744770	MJHNSNCKALUENN-UHFFFAOYSA-N	431.470	1.115	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(C)[nH]n2)c1	917391880	LIICSZINXXYWPD-UHFFFAOYSA-N	429.458	1.602	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)cc1	918217836	MANKEMAVIHPYBX-CQSZACIVSA-N	449.489	1.615	50	20	IDGD	
C[C@H]1CN(Cc2cccc(CNC(=O)NNC(=O)[C@H]3COc4ccccc4O3)c2)CCO1	920236717	GBSZIBWEIQJQKW-HRAATJIYSA-N	440.500	1.578	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)NCC3CC3)c2)o1	920248344	BGFUEYRVVDJECD-UHFFFAOYSA-N	448.545	1.885	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)Nc1ccc(CN2C(=O)CNC2=O)cc1	920931638	ZJBSEUJBOMWIHQ-UHFFFAOYSA-N	425.445	1.533	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3ncoc3[C@@H]3CCCO3)cc2)CC1	1116073558	CDOKOTIXVLRWKY-INIZCTEOSA-N	435.506	1.219	50	20	IDGD	
CC(=O)N1CCC[C@H](CNC(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)C1	1116879704	KVHVUSUGDCYSKC-OAHLLOKOSA-N	425.530	1.222	50	20	IDGD	
COC[C@@H](C)n1c(C)cc(/C=C(/C#N)C(=O)N2CCN(C(=O)N3CCOCC3)CC2)c1C	1317982398	UAMLIFWSZCAMIN-MKYLKIGJSA-N	443.548	1.816	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)N[C@@H]2CCCN(C(=O)c3ccccc3)C2)cc1	1318175761	OBSKIDWUSAXVDU-QGZVFWFLSA-N	426.473	1.709	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4nonc4c3)C2)C1	1777714369	OTRQJUICCFDKOF-XIKOKIGWSA-N	437.294	1.697	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cn4ccc(Cl)cc4n3)C2)C1	1778063125	XFDPFBDJWTUXBQ-IFXJQAMLSA-N	441.315	1.685	50	20	IDGD	
COc1cccnc1CCC(=O)N1CCO[C@@]2(CCN(C(=O)CO[Si](C)(C)C)C2)C1	1779294312	NBABGYGAGDXHBO-OAQYLSRUSA-N	435.597	1.704	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(Cl)nn3)C2)C1	1779428919	STJCZNBDXFTFOP-MEDUHNTESA-N	431.718	1.605	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(N(C)C)nc3)C2)C1	1779759511	CBVSLNFXTNWSTD-KUHUBIRLSA-N	439.354	1.622	50	20	IDGD	
C=C1CC(C(=O)N2CCO[C@]3(CCN(C(=O)c4cc([N+](=O)[O-])ccc4OC(C)=O)C3)C2)C1	1780095646	VPVALBBPKOQLAK-QFIPXVFZSA-N	443.456	1.930	50	20	IDGD	
COC(=O)c1ccc(CC(=O)N2CC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)s1	1780898425	FDBLNXVURSBPGF-KRWDZBQOSA-N	435.329	1.711	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)Cc3ccc([N+](=O)[O-])c(OC)c3)C2)C1	1781192864	QWTMXXZTALGOAN-YWZLYKJASA-N	439.896	1.993	50	20	IDGD	
C=C(Oc1ccccc1O)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781331534	RHQSLWNMNNLVEV-CRAIPNDOSA-N	443.269	1.805	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3c(F)ccc([N+](=O)[O-])c3C)C2)C1	1781987943	YXCODNKFTPLZOK-DJJJIMSYSA-N	443.859	1.740	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C1CCSCC1)C2	1782214194	NORUJLUXDVSLPG-DYESRHJHSA-N	440.610	1.017	50	20	IDGD	
CC[C@H](O)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](Br)Cc3ccccc3)C2)C1	1783018812	QHFMOIDDIQRCJH-FUHIMQAGSA-N	439.350	1.593	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)CCC(=O)N3CCCC3)CCO2)C1	1783342440	IUMLAIFHIZUXEB-KXBFYZLASA-N	444.370	1.392	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cn(C(C)(C)C)nn3)CCO2)C1	1783537231	MYXDUDCXPXAQNS-SJCJKPOMSA-N	428.331	1.260	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3c(-c4ccncn4)noc3C)CCO2)C1	1783883845	ZUKPZJVNQDLTLE-JLTOFOAXSA-N	449.895	1.137	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cccc3ncccc13)CCO2	1783935612	WLSHONPRGGDHDX-QHCPKHFHSA-N	439.516	1.051	50	20	IDGD	
O=C(C(Cl)Cl)N1CC[C@@]2(C1)CN(C(=O)[C@H]1CC(=O)N(C3CCCC3)C1)CCO2	1783942959	QKXFUSUGNNBEOU-ORAYPTAESA-N	432.348	1.411	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]2C1	1783973846	DLXOCFJYDGBGFL-AICCOOGYSA-N	449.342	1.559	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4cc(O)ccc4n3)C[C@@H]21)[C@@H](O)CCl	1784090358	AZTAYTZNRDVSMH-BMIPRAEKSA-N	433.892	1.133	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(OCC4CC4)cc3)C[C@@H]21)[C@@H](O)CCl	1784095453	IIIKGVHALQPWQU-LEAZDLGRSA-N	436.936	1.668	50	20	IDGD	
C[C@H](Cc1ccccc1)C(=O)N1CC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1	1784209723	LCOJLRNFZFQNTR-JPYJTQIMSA-N	430.549	1.068	50	20	IDGD	
O=C(/C=C/c1ccc(O)c(O)c1O)N1CC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1785510594	RXDXQGRPPZXNBO-BWDYHRDRSA-N	431.272	1.450	50	20	IDGD	
C[C@@H](Nc1cnccn1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCBr)[C@H]2C1	1786406039	FDICRUUOECXNIQ-QPSCCSFWSA-N	440.342	1.042	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCCn3ccnc3)C[C@@H]21)[C@H](F)Br	1789927262	RZOWYUFZUFCKQD-YXWQFLTLSA-N	431.306	1.334	50	20	IDGD	
Cc1nccn1CC(=O)Nc1ccc(C2(NC(=O)CCC(=O)NN(C)C)CCC2)cc1	1791112130	ILYLRFYTGZVYJO-UHFFFAOYSA-N	426.521	1.699	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)n3ccnc3C)[C@H]2C1	1791707326	DQUXSMURHZYHNC-GWFJUFKTSA-N	441.370	1.906	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN3C(=O)CSC3=S)[C@H]2C1	1792237531	MNRUWCYGMAMTQK-FQUUOJAGSA-N	448.010	1.234	50	20	IDGD	
C[C@H](NNc1ccccc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Br)C2	1792511989	YSXOBTLAJABAKJ-LBKYZSNHSA-N	439.354	1.365	50	20	IDGD	
COc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](O)CCl)c(Cl)c1OC	1792975538	UPAGWMIOGHVDPQ-DDFXLWFNSA-N	447.315	1.160	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCn1c(=O)oc3ccccc31)C2	1793445486	JZLZNRMVKTYFGB-QOIOWGMHSA-N	449.935	1.982	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CNC(=O)c1ccc(C)cc1)C2	1793456071	WQZOJHNZQXKDJQ-AJYBTWMASA-N	435.952	1.722	50	20	IDGD	
CCc1[nH]nc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Br)C3)c1Cl	1795904878	BHKMSYMWZUICHM-LVNATWPUSA-N	437.697	1.519	50	20	IDGD	
Cc1cccc2[nH]c(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3ccc(B(O)O)cc3)cc12	1796189015	MRVYCHLQFAOHRC-REPLKXPHSA-N	431.301	1.722	50	20	IDGD	
CCCCC[C@H](C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1	1796443841	NDRYICNSRLMKHY-PWIWSCCXSA-N	445.564	1.926	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2c(c1)OCCO2	1796790798	RGIGTCKIOVEQMN-MBMVNNNZSA-N	439.306	1.444	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1nc3ccccn3n1)C2	1796892036	CGVSNGVXBHKJEY-MVRRYPJTSA-N	448.487	1.115	50	20	IDGD	
Cc1ccn2c(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)CO[Si](C)(C)C)cnc2c1	1797957275	JVOCFJLZWPOUOH-CWPLJXCYSA-N	430.581	1.697	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1CC(=O)C1)C2	1799220427	MSRSFONXANMLDL-QDMKHBRRSA-N	429.429	1.751	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1noc3ccccc13)C2)[C@@H](F)Br	1799346632	UCVMEOMUSNRQDW-ZWUPXRALSA-N	440.269	1.650	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3nc[nH]c3c1)C2)[C@@H](F)Br	1799348991	FNJCMPANQDHUCR-BAESOJJISA-N	425.258	1.457	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc([N+](=O)[O-])cc1F)C2)[C@@H](F)Br	1799349470	WZGYCUVNFMPKQS-HZZFPTLFSA-N	448.220	1.628	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccccc1-n1nccn1	1799670831	NVRSHKGHORKZOU-LORHWOILSA-N	431.924	1.878	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1C[C@@H](O)C1)C2	1800333291	CNNRITYUAWGBPF-OOQXEWCUSA-N	431.439	1.232	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(C(C)C)[nH]n1)C2	1800642616	SFUKUCJOLSFXRM-OQMKEHIESA-N	427.343	1.910	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)Cc1ccccc1)C2	1800644480	VTEIWGWCXDOCEY-RZFLPCETSA-N	439.350	1.353	50	20	IDGD	
COC(=O)[C@H]1CCC[C@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)C(C)(C)CCl)C3)C1	1800962602	RVWBHYVGBNJGPJ-VIQHNZTISA-N	428.957	1.820	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3c(F)cc(F)cc3[nH]1)C2	1800978648	YJJWLRITCJMRQE-MSNRECKUSA-N	441.862	1.903	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C)=C/c1ccc(OC)cc1)C2	1800979701	VJEIKLLBJYVFTH-UXNJRRTJSA-N	436.936	1.942	50	20	IDGD	
COc1cc(C)ccc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Br)C2	1801707558	NBQBFALRRHVMAJ-VWPFQQQWSA-N	425.323	1.990	50	20	IDGD	
Cc1cccc(C)c1NC(=O)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCC(=O)NN(C)C	1802338835	UBJDBKWLWWZTSG-BCDXTJNWSA-N	443.548	1.253	50	20	IDGD	
CC(C)(C)n1cc(C(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)nn1	1803141363	NKDKFIJHCGIOKO-OIISXLGYSA-N	434.928	1.347	50	20	IDGD	
Cn1ncc2c(C(=O)N3CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]3c3cccnc3)cccc21	1803142793	JINLZUVRFVNDIL-UIAACRFSSA-N	441.919	1.888	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H](CNC(=O)c2cc(O)ncn2)[C@@H]1c1cccnc1	1803744503	PJPSULHCAWAZMN-BEFAXECRSA-N	429.553	1.748	50	20	IDGD	
Cc1onc(C(=O)NC[C@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)c1C	1803891608	LLHAADINRDQAHN-DYESRHJHSA-N	442.520	1.379	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H](CNC(=O)c2ccc(O)nn2)[C@@H]1c1cccnc1	1805263882	ALWDTHPPCUCNBP-MRRJBJDNSA-N	448.321	1.928	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC2(CCCN(C(=O)CS(=O)(=O)CC)C2)CC1	1805967672	ITALYWXWUJMUQJ-AWEZNQCLSA-N	437.400	1.826	50	20	IDGD	
C[C@H](Cn1cncn1)C(=O)N1CC[C@@H](CNC(=O)CCBr)[C@@H]1c1cccnc1	1806342789	LIITYMLUVIVSDD-HFTRVMKXSA-N	449.353	1.800	50	20	IDGD	
CN[C@H](CC(=O)N1CC[C@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]1c1cccnc1)C(=O)O	1808294922	CWQCWVSYANPHJD-NPNMTCQASA-N	445.347	1.386	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)c1c[nH]c2ncccc12	1809120819	XYXNIYCJUPGEGA-WBAXXEDZSA-N	427.892	1.877	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)n2ccnn2)[C@@H]1c1cccnc1	1812868802	MRMVZUVQLYMKTF-LQKXBSAESA-N	435.326	1.724	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](O)CCl)n[nH]1	1814877751	KHDHNQCIJGKYIN-LQKXBSAESA-N	438.912	1.757	50	20	IDGD	
COC(=O)c1ccc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@@H](O)CCl)CC3)cn1	1817535555	KENYRASBFDJRTL-GWCFXTLKSA-N	438.893	1.150	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1	1818110674	NMBAHKREFIUBIC-OVKBOSNOSA-N	449.899	1.136	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1)c1ccc2c(c1)CNC2=O	1819201783	JIRQFHXAHXVQKF-HZPDHXFCSA-N	431.880	1.559	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)CCl)CC2)c1cc(-c2ccccn2)[nH]n1	1820639316	HJNZIXYWFGEVDI-BMIGLBTASA-N	446.920	1.754	50	20	IDGD	
CC[C@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc3n(n2)CCNC3=O)[nH]n1	1820854260	PPTDCQPTCHFTHS-FZMZJTMJSA-N	433.900	1.673	50	20	IDGD	
C=CCNC(=O)/C=C\C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](F)Br)n[nH]1	1820933750	CRRPVRPYMAUQOO-VLZSXYJSSA-N	442.289	1.951	50	20	IDGD	
Cc1cnn(CC(=O)N[C@@H]2CCc3nc(NC(=O)[C@H](F)Br)sc3C2)c1	1823005183	XRDCANLIDKKMCO-RNCFNFMXSA-N	430.303	1.951	50	20	IDGD	
C[C@@]1(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)CC1(F)F	1823394196	QANXNJOFTDLGFD-KXBFYZLASA-N	432.236	1.441	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](C)n3ccnn3)sc2C1	1824692157	BIGXMBWKQIDNBX-LPEHRKFASA-N	427.328	1.691	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc[n+]([O-])c1)CC2	1825637000	PITRPIINAJTKTM-GXSJLCMTSA-N	425.308	1.786	50	20	IDGD	
CCc1cc(C(=O)N[C@@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)n[nH]1	1826085319	MSFJXUOCZWORHN-GFCCVEGCSA-N	433.538	1.027	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)CN2CCCCC2)CC1	1826700769	DEPJFWRSPAEMPO-QFIPXVFZSA-N	441.381	1.086	50	20	IDGD	
O=C(c1nccs1)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827056030	OHRQKKCKKLETLN-GOSISDBHSA-N	427.335	1.370	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)Cc2cscn2)CC1	1827130586	VUPFZBVYMVXHJL-SFHVURJKSA-N	435.594	1.678	50	20	IDGD	
O=C(c1cc(-c2ccccc2)on1)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1	1829589622	VFECQIQVPDQXFB-LAUBAEHRSA-N	449.891	1.011	50	20	IDGD	
O=C(c1cc(Cl)ccc1F)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1	1830183387	OHYRJQNTDOICIK-CRAIPNDOSA-N	435.279	1.149	50	20	IDGD	
Cc1ccc(OCCC(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)cc1	1830206144	VTFQTNDBPSZMNQ-AZUAARDMSA-N	428.888	1.755	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)CSc3ccncc3)C2)C1	1830359306	ZDMBCSVKACPSLE-FQEVSTJZSA-N	441.981	1.895	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2	1830535244	KENVCYPCZKXIKZ-GRDNDAEWSA-N	439.778	1.881	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc(Cl)nc3)C2)C1	1831638848	HSDDUOAENJCMAV-KSSFIOAISA-N	431.320	1.608	50	20	IDGD	
Cc1csc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)c1	1831778715	GBHVKFJHEVYIER-BBRMVZONSA-N	435.315	1.817	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2nc[nH]c2[N+](=O)[O-])CC1	1831832376	GQGWHVIFUGGNRB-ZIAGYGMSSA-N	427.889	1.805	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)c1ccccc1)CCO2	1832232274	OQZQWLJKNMZLRC-QOKNQOGYSA-N	443.313	1.937	50	20	IDGD	
COc1cccnc1CCC(=O)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1832869687	DCCVEKWZVLEUDL-IBGZPJMESA-N	446.331	1.283	50	20	IDGD	
Cc1ncccc1CCC(=O)NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1833747653	NODPYYKJJNSGAT-HXUWFJFHSA-N	436.984	1.494	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)c3ncnn3C)CC2)CC1	1834073278	QTXZOLVWZVCBBQ-ZDUSSCGKSA-N	441.374	1.031	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1)c1cc(=O)cco1	1834344763	BXCQPXVPYWDERY-INIZCTEOSA-N	444.301	1.516	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)[C@@H]1CNc2ccccc21	1834726079	DEYAYYCMNNYEPY-UYAOXDASSA-N	434.968	1.367	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)c1noc2c1CCCC2	1834994759	ITFBSNWTTOTAJY-KRWDZBQOSA-N	438.956	1.338	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccccc3F)CCO2)C1	1835007996	KFNMGNNQTVNDOE-OXQOHEQNSA-N	428.888	1.078	50	20	IDGD	
Cc1ccoc1C(=O)NC1CCN(C2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1	1835143469	SKROEAFFAVSJGG-UHFFFAOYSA-N	433.553	1.146	50	20	IDGD	
CC(C)CNC(=O)C(=O)N1CCC(N2CCC(NC(=O)CO[Si](C)(C)C)CC2)CC1	1835837228	CAMWFKYSKQSQLF-UHFFFAOYSA-N	440.661	1.182	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](F)Cl)CC2)CC1)c1ccnc2c1OCO2	1836092528	ASBRWONWOZYASN-MRXNPFEDSA-N	426.876	1.530	50	20	IDGD	
O=C(c1ncc(Cl)cn1)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836715121	JUBIRKDIJWLNFN-OAHLLOKOSA-N	431.320	1.342	50	20	IDGD	
Cc1cc(/C=C/C(=O)N2CCC(OC3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)no1	1836717208	NDDSKRHZADTIDX-DCKQQPRJSA-N	425.913	1.595	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cn(C)nc3C)CC2)CC1	1836967641	CCKQSUWIAGRNFE-SFHVURJKSA-N	426.945	1.595	50	20	IDGD	
C=CC[C@H](C(=C)C)C(=O)N1CCO[C@]2(COCCN(C(=O)CCBr)C2)C1	1837305817	KFLCKIFAJIFDPC-APWZRJJASA-N	429.355	1.996	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3ncc(Cl)cn3)CC2)CC1	1837359084	SJOHQXLDJOJLII-INIZCTEOSA-N	445.347	1.996	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3ccccc3)C2)C1	1837711945	AXFOCBCYVVGQNX-JOCHJYFZSA-N	434.609	1.927	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccnc3SC)CCO2)C1	1838287308	GTJACWXJAVWKDX-HNAYVOBHSA-N	443.953	1.127	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3ccnnc3O)CC2)CC1	1838515766	FWAGIIYJBAEXQG-INIZCTEOSA-N	426.901	1.048	50	20	IDGD	
CC(C)n1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)n1	1838790198	POIQTSXJJMYYGV-RDTXWAMCSA-N	443.342	1.317	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3c(F)ccc(O)c3F)C2)C1	1839146904	ABCOTTLFWNFVTK-BLVKFPJESA-N	432.851	1.758	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc(C)cn3)C2)C1	1839963432	KAAIXLXGCIMSLV-KDOFPFPSSA-N	441.326	1.029	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CC[C@@H]3CCOC3)C2)C1	1840035938	AFUHKRZZYLCWFG-DAYGRLMNSA-N	433.343	1.043	50	20	IDGD	
CC[C@H]1CC[C@H](C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](Cl)COC)C3)C2)CC1	1840059200	XHQIHZKPRYIBDK-NEYJZJCJSA-N	430.973	1.913	50	20	IDGD	
O=C(c1ccc2ncoc2c1)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840188338	DPJWFCFRIUGWMM-SFHVURJKSA-N	428.272	1.702	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)n1ccnc1C)CCO2	1840489560	YNRMRJMRSCBKSW-SYNHAJSKSA-N	426.945	1.616	50	20	IDGD	
Cc1cc(C(=O)N2CCCC23CN(C(=O)c2ccc(B(O)O)cc2)C3)c(C(F)(F)F)o1	1842458018	NMOHRGZEDMLOTN-UHFFFAOYSA-N	436.195	1.417	50	20	IDGD	
CC(=O)N[C@H](C(=O)N1CC2(CCCN2C(=O)CCBr)C1)c1ccc(F)cc1	1842638971	QTYHRUDFCAVSTL-KRWDZBQOSA-N	440.313	1.991	50	20	IDGD	
COc1nccc(C(=O)N2CC3(CCCN3C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)c1F	1843415685	AOHGSMFMINVEMZ-DHRITJCHSA-N	442.451	1.180	50	20	IDGD	
Cn1c(=O)c(C(=O)N2CCCC23CN(C(=O)[C@@](C)(Cl)CCl)C3)nc2ccccc21	1843744397	XGOGHVBGGLDLFE-IBGZPJMESA-N	437.327	1.987	50	20	IDGD	
O=C1CCCc2cc(C(=O)N3CCCC34CN(C(=O)c3ccc(B(O)O)cc3)C4)ccc21	1843759241	MMGQKEUHSVUQHH-UHFFFAOYSA-N	432.285	1.016	50	20	IDGD	
Cc1ocnc1C(=O)N1CC2(CCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)C1	1845039277	YRYSZBZVCMCWBZ-UHFFFAOYSA-N	440.504	1.146	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@H]1COCCN1C(=O)OC(C)(C)C)C2	1845163152	IOMVLVJHUUACAK-HUUCEWRRSA-N	429.945	1.843	50	20	IDGD	
C[C@H]1Oc2ccc(C(=O)N3CC4(CCCN4C(=O)[C@H](F)Br)C3)cc2NC1=O	1845218570	NHTGDQVUDUSGJU-YGRLFVJLSA-N	440.269	1.914	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](CC1CC1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl	1847564007	OPOAOZLCBWNECI-FXUDXRNXSA-N	429.945	1.481	50	20	IDGD	
COc1ccc(Cn2nnnc2SCC(=O)NNC(=O)c2ccccc2Cl)cc1	15047312	RVOMLBZUTILUPU-UHFFFAOYSA-N	432.893	1.937	50	20	IDGD	
C[C@@H]1CN(S(=O)(=O)c2ccc(C(=O)NNC(=O)c3ccccc3F)cc2)C[C@@H](C)O1	15991476	DLCCCJVVVZOURS-ZIAGYGMSSA-N	435.477	1.698	50	20	IDGD	
Cc1nn(-c2ccccc2)c(C)c1C(=O)C(=O)NNC(=O)Cc1nc2ccccc2n1C	17411520	SQDLYIKWYOXNQA-UHFFFAOYSA-N	430.468	1.949	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=S)NC(C)(C)C)CC2)cc1	28716724	SCCCTRCZOWBGAU-UHFFFAOYSA-N	442.607	1.780	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)N3CCC(N(C)S(C)(=O)=O)CC3)cc2C1	725859989	JHIFDELMWFZOIT-LBPRGKRZSA-N	428.580	1.583	50	20	IDGD	
O=C(NNC(=O)C1CCOCC1)c1ccc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1	725907838	QSEYIYQHVVTZJC-UHFFFAOYSA-N	448.457	1.583	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)NCCCN1CCC[C@H]1C(=O)N(C)C	726278362	WHEMVAMBZABKLX-HNNXBMFYSA-N	425.917	1.235	50	20	IDGD	
O=C(CNC(=O)c1ccc(O)cc1)NNC(=O)COc1ccccc1Cc1ccccc1	727481420	DLKINMYPIFVHJH-UHFFFAOYSA-N	433.464	1.939	50	20	IDGD	
COc1cccc(N2CC[C@H](NC(=O)NNC(=O)c3nn(-c4ccccc4)cc3O)C2)c1	728220167	CUXQEBDVAWPTSJ-HNNXBMFYSA-N	436.472	1.809	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)[C@@H]2CCCCN2C(=O)c2ccccc2)c2ccccc2c1=O	729299361	BBJOAKZDMYXCNH-SFHVURJKSA-N	433.468	1.389	50	20	IDGD	
CCOc1ccc(NS(=O)(=O)c2ccc(C)c(C(=O)NNC(=O)c3cnn[nH]3)c2)cc1	729455553	LFJQVTLADSUDMD-UHFFFAOYSA-N	444.473	1.387	50	20	IDGD	
CCC(=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O)c1ccc2cc(OC)ccc2c1	730568760	ADNDYBBUBMHABJ-UHFFFAOYSA-N	441.513	1.663	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)NC[C@@H](c1cccc(F)c1)N1CCOCC1	730825747	WJDDHGLFBZMNHC-KRWDZBQOSA-N	432.452	1.314	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)C1(S(=O)(=O)c2ccccc2)CC1	731343665	DKPQRCWNFJXGNI-UHFFFAOYSA-N	435.527	1.577	50	20	IDGD	
CS(=O)(=O)CCN1CCC(NC(=O)NNc2ccc(F)cc2Br)CC1	731761599	UAHBVIGTNJMMHH-UHFFFAOYSA-N	437.335	1.723	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2csc(S(N)(=O)=O)c2)cc1Br	732176155	UBGMNCPLEFXPIV-UHFFFAOYSA-N	434.293	1.241	50	20	IDGD	
Cc1nn(-c2ccc(F)cc2)c(C)c1CC(=O)NNC(=O)CCN1C[C@@H](C)O[C@H](C)C1	732263113	JWJATGJYNDNDSX-HUUCEWRRSA-N	431.512	1.817	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccccc2NC(=O)C(C)(C)C)c1	733123731	CNGUMMITKZAXBF-UHFFFAOYSA-N	446.529	1.996	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)N[C@@H]1CCCN(c2ccccc2)C1=O	734072125	QGQBZVVGLLRXIJ-OAHLLOKOSA-N	427.417	1.500	50	20	IDGD	
O=C(CCNS(=O)(=O)c1cccc(Br)c1)NNc1nccnc1Cl	734261130	VEXFEFRJQNBJKL-UHFFFAOYSA-N	434.703	1.704	50	20	IDGD	
C[C@H](CN1CCN(c2ccccn2)CC1)NC(=O)NNC(=O)Cn1ccc2ccccc21	735517364	CTTXNQJBXCLSQY-GOSISDBHSA-N	435.532	1.577	50	20	IDGD	
O=C(COC(=O)c1ccccc1OC1CCC1)NNC(=O)[C@@H]1COc2ccccc2O1	735740746	QRYLDOLPCKODHO-IBGZPJMESA-N	426.425	1.762	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N1CC[S@](=O)[C@H](C)[C@@H]1C	736649433	FFRWSGCSLSAETG-IZNQUEAISA-N	432.340	1.799	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2ccc(O)c(F)c2)c1	739058869	JZUJSHREGRLGOU-UHFFFAOYSA-N	438.481	1.706	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1ccnc(N2CCCCC2)n1	739681434	YRPNWVPSAJSLKI-UHFFFAOYSA-N	431.522	1.143	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N1CCS(=O)(=O)C[C@H]1C	740026487	YJCRDSFVFTXDFO-MNOVXSKESA-N	434.312	1.076	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)COc1ccccc1F)[C@H]1CN(Cc2ccccc2)CCO1	741266139	JDXAQVNQPCYFTQ-OXJNMPFZSA-N	430.480	1.824	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)c2ccc3c(c2)C[C@@H](C)N3S(C)(=O)=O)c1	744617612	CIPKDMTUOQRQTQ-CQSZACIVSA-N	445.497	1.324	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)[C@H]1CCCN1Cc1ccccc1	744620248	HOJANKCTGIGWPR-HXUWFJFHSA-N	444.557	1.815	50	20	IDGD	
COc1ccc(N2C[C@@H](C(=O)OCC(=O)NNC(=O)c3cccc(C)c3)CC2=O)cc1	744665149	AXSOEKDXWKPOQC-INIZCTEOSA-N	425.441	1.361	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)[C@H](O)[C@@H](C)c2ccc(C)cc2)cc1OC	745756332	MNGZAEMVORCJRM-VBKZILBWSA-N	430.457	1.481	50	20	IDGD	
C[C@@H]1C[C@@H](NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)C(=O)N1c1ccccc1	745883400	TUNRXOSUPVEKBL-CXAGYDPISA-N	430.486	1.228	50	20	IDGD	
Cc1cc(N2CC[C@@H](NC(=O)NNC(=O)[C@H](C)Oc3cccc(C)c3C)C2=O)n(C)n1	745906872	VYBWNPGHTHAGHF-JKSUJKDBSA-N	428.493	1.249	50	20	IDGD	
O=C(CSc1ccc(Cl)cc1)NNC(=O)NCCNS(=O)(=O)c1cccnc1	746326737	UGJLKEFJOJJMHD-UHFFFAOYSA-N	443.938	1.136	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)CN1C(=O)c2cc(Cl)c(Cl)cc2C1=O	746553720	QDGOGLPWKIURKZ-UHFFFAOYSA-N	446.250	1.627	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)CCOc2ccc(S(C)(=O)=O)cc2)cc1	746645805	PFJWLHMWGSDWSO-UHFFFAOYSA-N	434.470	1.172	50	20	IDGD	
NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NNC(=O)CCOc3ccccc3)cc2)C1	747107868	BOFNLRLVMSYHDS-GOSISDBHSA-N	439.516	1.688	50	20	IDGD	
O=C(CSCC(=O)N1CCCCC1)NNc1nc(Br)cn2ccnc12	750242905	CBNODILVCNFNCA-UHFFFAOYSA-N	427.328	1.681	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)CNC(=O)c2cccs2)cc1Br	751280903	WGOQFUBVRUDGOD-UHFFFAOYSA-N	448.320	1.259	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NN=C1CN(C)C[C@H]1C)N(S(C)(=O)=O)CC2	752163331	VGKIQOKNGQPFPJ-CXAGYDPISA-N	438.550	1.006	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)NNC(=O)c2ccc(COc3ccccc3)o2)ccc1F	752397181	PFUXEJCBURNCSF-UHFFFAOYSA-N	447.444	1.981	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)CNC(=O)c1cccs1)c1nc(Cc2ccccc2)no1	753038465	OOBGQTBMQOZXJX-GFCCVEGCSA-N	428.474	1.543	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)C(=O)Nc1cc2c(cc1C(=O)OC)OCO2)c1ccccc1	753839987	FTURLYKQWVBPHT-CYBMUJFWSA-N	427.413	1.482	50	20	IDGD	
CN(CC(=O)NNc1ccc(C(F)(F)F)nn1)S(=O)(=O)c1cccc([N+](=O)[O-])c1	755194040	LNDNKICNYNKARQ-UHFFFAOYSA-N	434.356	1.167	50	20	IDGD	
Cc1cccc(NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c1C(=O)N1CCCC1	755803418	OZLMZHGDPJRQOT-UHFFFAOYSA-N	448.483	1.944	50	20	IDGD	
CN(C)N(C(=O)c1cn(-c2ccc(Br)cc2)cn1)[C@H]1CCS(=O)(=O)C1	756502700	GZLOYXYOOGDBFB-AWEZNQCLSA-N	427.324	1.741	50	20	IDGD	
CCOC(=O)C1CCN(C(=O)c2ccc(NC(=O)NNC(=O)c3cc(C)[nH]n3)cc2)CC1	756684691	ZJAXJPCMDXJKRX-UHFFFAOYSA-N	442.476	1.600	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)Nc1cnn(C[C@H]2CCCO2)c1	756739838	QLFSORUDKWSBDY-HXUWFJFHSA-N	441.536	1.427	50	20	IDGD	
O=C(COC(=O)c1ccc(C(=O)NC2CC2)cc1)NNC(=O)c1ccc([N+](=O)[O-])cc1	757848782	KZMNBGFTSFJMHA-UHFFFAOYSA-N	426.385	1.105	50	20	IDGD	
C[C@@H](CC(=O)NNc1nc(O)c2ccccc2n1)/N=C1/NS(=O)(=O)c2ccccc21	758308789	CSGORVRVSUMJMC-NSHDSACASA-N	426.458	1.296	50	20	IDGD	
Cc1nc(-c2ccccc2)ncc1C(=O)N1CCN(S(=O)(=O)CBr)CC1	758521976	BVSWRBPLHGICGQ-UHFFFAOYSA-N	439.335	1.892	50	20	IDGD	
CCS(=O)(=O)N1CCC(CNC(=O)NNC(=O)NCc2ccc(Cl)cc2)CC1	758733470	AFZGJCZINBHQQU-UHFFFAOYSA-N	431.946	1.415	50	20	IDGD	
O=C(NC[C@H]1CN(Cc2ccccc2)CCCO1)NNC(=O)c1ccc2c(c1)OCCO2	759219818	PPEFILHGHPWEAG-IBGZPJMESA-N	440.500	1.693	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)C2CCN(S(=O)(=O)c3ccc(C#N)cc3)CC2)nc1	759738420	OOHPCTXUSURUDJ-UHFFFAOYSA-N	443.485	1.284	50	20	IDGD	
COc1cc(Br)cc(S(=O)(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1	760509233	GTKONKMCYHNOBQ-OAHLLOKOSA-N	443.275	1.607	50	20	IDGD	
C[C@@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(NC(=O)C(=O)NNC(=O)C(C)(C)C)cc2)C1	761073660	VQGIDKLAXRPTQV-ZIAGYGMSSA-N	438.550	1.485	50	20	IDGD	
C=C(C)COCCNC(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	762377984	ZPELDQXWPWRBAC-UHFFFAOYSA-N	435.484	1.982	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H]2CC[C@H]3SCCS[C@@H]23)c1	763061438	GCZIKLKWQQFHNC-KFWWJZLASA-N	444.604	1.261	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)c2sccc2S(=O)(=O)N(C)C)n[nH]1	763156203	XUVUDWWEWYYLSG-UHFFFAOYSA-N	449.514	1.472	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(-c3csnn3)cc2)cc1OC	763552224	XMHTYNKCVXUJGH-UHFFFAOYSA-N	427.442	1.622	50	20	IDGD	
Cc1ccc(-n2nc(NC(=O)C(=O)NNC(=O)COc3ccc(C#N)cc3)cc2C)cc1	763679284	LQZAFXBQUIOOBQ-UHFFFAOYSA-N	432.440	1.526	50	20	IDGD	
Cc1cc(C(=O)N2CCOCC2)ccc1NC(=O)C(=O)NNC(=O)c1cccc(Cl)c1	763748157	NRONGMFJMXGFLA-UHFFFAOYSA-N	444.875	1.521	50	20	IDGD	
O=C(NNC(=O)c1cc2c(s1)CCC2)C(=O)Nc1cccc(CN2CCOC2=O)c1	763784809	IGOWTQRAQOTSCC-UHFFFAOYSA-N	428.470	1.589	50	20	IDGD	
CC[C@H](C)Oc1cccc(NC(=O)C(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])c1	763804672	PDWIOXAMOJCHDO-ZDUSSCGKSA-N	430.417	1.937	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)c1cccc(NC(=O)c2ccc(F)cc2)c1	763825538	RDRFSWFDZLFOFW-UHFFFAOYSA-N	435.415	1.664	50	20	IDGD	
Cc1cc(N2CCOCC2)ccc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccccc1F	763850642	PFJCEWUPXVRKCE-OAHLLOKOSA-N	444.463	1.524	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)ccc1N1CCOCC1	763872152	KVVLNQLWBJNDAG-OAHLLOKOSA-N	444.463	1.524	50	20	IDGD	
COC(=O)[C@H](C)Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)cc1	763872273	MANDZUYYIDTCHB-KGLIPLIRSA-N	445.447	1.731	50	20	IDGD	
COc1ccc(Cn2nccc2NC(=O)C(=O)NNC(=O)CC(C)C)c(OC)c1OC	763886101	QJLMXRUFEFMWBQ-UHFFFAOYSA-N	433.465	1.089	50	20	IDGD	
CCCN1C(=O)CCc2cc(NC(=O)C(=O)NNC(=O)Cc3ccc(F)cc3)ccc21	763918423	CKVBUEJKCVYCOC-UHFFFAOYSA-N	426.448	1.844	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3ccn(-c4ncccc4F)n3)cc2C1	763947941	GHQVZKOAUUWIMS-NSHDSACASA-N	442.476	1.992	50	20	IDGD	
COC(=O)c1ccc(-n2cc(C)cn2)c(NC(=O)C(=O)NNC(=O)c2ccccc2C)c1	763957910	MPGXROZCWMRGTO-UHFFFAOYSA-N	435.440	1.675	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1	764040423	HPMFHNWMWQDULT-OKILXGFUSA-N	444.463	1.848	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(Cl)cc2I)n[nH]1	764106853	VRINQSVRCPKVBQ-UHFFFAOYSA-N	447.620	1.376	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cccc(OC(F)F)c2)c(F)cc1F	764251267	TZIWFUBAITWUKM-UHFFFAOYSA-N	443.309	1.753	50	20	IDGD	
CC(C)(C(=O)NNC(=O)C(=O)Nc1cccn(Cc2ccccc2)c1=O)c1ccccc1	764321170	SAVMYIUQJGZDIH-UHFFFAOYSA-N	432.480	1.960	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2cccnc2OC(C)C)n[nH]1	764378407	ZILGDRKUDYVZJD-UHFFFAOYSA-N	438.444	1.667	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cccc(CC(=O)OC)c3)n[nH]2)cc1	764385286	VRIKKNJUGGYJCD-UHFFFAOYSA-N	449.467	1.754	50	20	IDGD	
CSc1nc2ccc(NC(=O)C(=O)NNC(=O)c3cncc(NC(C)=O)c3)cc2s1	764434303	UJSIEMOVGAZHBU-UHFFFAOYSA-N	444.498	1.771	50	20	IDGD	
O=C(NNC(=O)[C@@H](O)CCc1ccccc1)c1cccc(S(=O)(=O)N2CCCC2)c1	764583846	BTEOYTCJIHXSME-IBGZPJMESA-N	431.514	1.226	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)Cc1cccc(NS(C)(=O)=O)c1	765317583	PTYASSWGBWBODN-UHFFFAOYSA-N	428.511	1.053	50	20	IDGD	
COC(=O)NNC(=O)C(=O)Nc1cc(OC)c(OC)cc1C(=O)N1[C@@H](C)CCC[C@H]1C	765377624	YCWAOJRVCZBSCG-TXEJJXNPSA-N	436.465	1.433	50	20	IDGD	
CC(C)CN1N=C(C(=O)NNC(=O)COc2ccc(Br)cc2)CCC1=O	766339041	MTFZBJGHTCUKGN-UHFFFAOYSA-N	425.283	1.610	50	20	IDGD	
CC[S@](=O)c1ccccc1C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	766644702	BICUTMVSNJMPAR-HKBQPEDESA-N	442.541	1.033	50	20	IDGD	
CN(C)Cc1ccc(C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)cc1	766663252	JWNXNZXVRNHYPJ-UHFFFAOYSA-N	443.979	1.980	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)CO[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)nc2ccccc21	767823400	DNGSMYJOSRLLJM-OAHLLOKOSA-N	445.520	1.679	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccccc2Br)n(-c2ncccn2)n1	768234026	QOUBRTSOPNUARJ-UHFFFAOYSA-N	444.249	1.133	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1ccc(Cc2nnc3n2CCCCC3)cc1	768248990	YRXSHZAPUXZFFE-UHFFFAOYSA-N	436.476	1.476	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)[C@@H](C)N1C(=O)c2ccc(C)cc2C1=O	768641636	UNYNUBLFSMDOFG-GFCCVEGCSA-N	431.470	1.535	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)N[C@@H]2CCO[C@@]3(CCSC3)C2)nc1	769235045	CULFKFISEZUYDO-KDOFPFPSSA-N	443.595	1.793	50	20	IDGD	
O=C(NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)c1ccc(-c2nc[nH]n2)cc1	770209152	RDLWSGZAYLUFHQ-UHFFFAOYSA-N	440.485	1.331	50	20	IDGD	
C[C@@H](C(=O)NNc1ccc(Br)c(F)c1)N1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O	771691154	PVUXXVJIPSSEHL-AJVHJNHVSA-N	426.242	1.582	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)C1CCN(C(=O)CCc2ccccc2)CC1	771990223	CGVXFULGBJXHET-KRWDZBQOSA-N	431.533	1.983	50	20	IDGD	
C[C@H]1Sc2ccc(C(=O)NNC(=O)C(=O)NCc3ccc(Cl)cc3)cc2NC1=O	772195440	MHRGCWFLINIWIY-SNVBAGLBSA-N	432.889	1.850	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCC2(Cc3ccccc3)CC2)cc1	772631984	UFBVTWDVHNAQNX-UHFFFAOYSA-N	444.557	1.969	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)[C@H]2CC(=O)N(Cc3ccccc3)C2)C1	773422683	XNNNVLNHGKLEKN-ROUUACIJSA-N	444.532	1.830	50	20	IDGD	
CC(=O)N1CCc2c(NC(=O)C(=O)NNC(=O)[C@H](C)Oc3cccc(Cl)c3)cccc21	774003228	VONDEGPCDJXRMJ-LBPRGKRZSA-N	444.875	1.802	50	20	IDGD	
CS(=O)(=O)Cc1ccc(Cl)cc1S(=O)(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	774607644	GUIMQYZOQRUALI-UHFFFAOYSA-N	447.878	1.416	50	20	IDGD	
Cc1nn(C(F)F)c(C)c1CC(=O)N1CCN(S(=O)(=O)CBr)CC1	777778949	AXBRWPCOBHXDAR-UHFFFAOYSA-N	429.287	1.264	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNS(=O)(=O)c1ccc(F)cc1Br	777940333	ZKUAYSIZBZKGFC-UHFFFAOYSA-N	426.264	1.422	50	20	IDGD	
CCN1CCc2nc3ccccc3c(C(=O)NNC(=O)CNC(=O)OC(C)(C)C)c2C1	778446001	YWPYUWKZWGADIJ-UHFFFAOYSA-N	427.505	1.899	50	20	IDGD	
COc1cccc(NNC(=O)C(=O)Nc2cc(Br)c(OC)cc2OC)n1	778698082	YCQIGWPCWFRCPM-UHFFFAOYSA-N	425.239	1.952	50	20	IDGD	
COC(=O)c1cn(C2CN(C(=O)/C(C#N)=C/c3cc(C)n(C[C@@H]4CCCO4)c3C)C2)nn1	779550264	UQNXBWVKCHIFII-QTQQGTETSA-N	438.488	1.653	50	20	IDGD	
COc1cccc(NNC(=O)CNC(=O)c2ccccc2I)n1	780770830	WOXKTGHJLFIPIC-UHFFFAOYSA-N	426.214	1.568	50	20	IDGD	
C[C@@H]1C(=O)CC[C@@H](C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)C1(C)C	780926470	LJQLISLCIWQIFS-AEFFLSMTSA-N	428.533	1.233	50	20	IDGD	
COc1ccc(NNC(=O)[C@H](CCS(C)(=O)=O)NC(=O)c2ccc(Cl)cc2)nc1	781515569	FJZGCUALYZWJKH-HNNXBMFYSA-N	440.909	1.420	50	20	IDGD	
C[C@H]1C[C@@H](C)CN(C(=O)CN2CCN(CC(=O)NNC(=O)c3cccc(Cl)c3)CC2)C1	782100606	HAXMSFSJBQIDSR-CALCHBBNSA-N	449.983	1.223	50	20	IDGD	
CN(C)CCc1ccccc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	782702543	OXGKACFEEKLPCM-UHFFFAOYSA-N	438.463	1.720	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C(=O)Nc2ccc3c(cnn3C(F)F)c2)nc2ccccc21	782894608	QKCKTZSHJZOVME-UHFFFAOYSA-N	441.398	1.647	50	20	IDGD	
NC(=O)COc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2Cl)c1	782926579	XGTTVVVXIPTELZ-UHFFFAOYSA-N	425.228	1.257	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2cccc(-n3cccc3)c2)nc1	783265905	ZSLVFKDEXOYRNM-UHFFFAOYSA-N	442.501	1.641	50	20	IDGD	
CCC(C)(C)OCc1cccc(NC(=O)C(=O)NN[C@]2(C)CCS(=O)(=O)C2)c1C	783426735	JXNLDNYKFLJUMQ-HXUWFJFHSA-N	425.551	1.837	50	20	IDGD	
Cc1nc(-c2cccc(NC(=O)C(=O)NNC(=O)CNC(=O)c3cccs3)c2)oc1C	784004590	YNQOSHJPKDIZKQ-UHFFFAOYSA-N	441.469	1.536	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)[C@H]3CC=CC[C@@H]3C(=O)N3CCOCC3)nc21	784400647	ZKHRYSOGCURYNP-KBPBESRZSA-N	443.508	1.171	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)NC[C@H]2CCCCS2(=O)=O)cc1OC	784437858	HLBWPUSKRKAXQI-OAHLLOKOSA-N	427.523	1.785	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)C(=O)Nc2cccn(Cc3ccccc3)c2=O)c1	784841186	MYPVYGUGCGSJJP-UHFFFAOYSA-N	440.481	1.382	50	20	IDGD	
COCC(=O)N1CCc2cc(NC(=O)C(=O)NNc3ccc(OC)c(Cl)c3)ccc21	785120307	QFXVMUVXAGLEBU-UHFFFAOYSA-N	432.864	1.966	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1ccccc1O[C@@H]1CCOC1	785330085	DKLMZNKKGMQZTJ-CYBMUJFWSA-N	449.485	1.348	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNc2c(OC)cccc2S(C)(=O)=O)cc1OC	785330852	NESJPXOEBUKMAX-UHFFFAOYSA-N	437.474	1.588	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)c1	785676655	GYIDIOLXAYPHAS-UHFFFAOYSA-N	434.368	1.270	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H](c2cc(C(=O)NNC(=O)COc3ccccc3O)n[nH]2)C1	787335967	WWOOVILNIGKBGC-CYBMUJFWSA-N	445.476	1.680	50	20	IDGD	
CCCOc1cc(OC)ccc1C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	789213674	UJGCENOUJGVALY-LJQANCHMSA-N	444.440	1.628	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)N2CCC[C@H](N3CCCS3(=O)=O)C2)c1C	790222349	PMZJUPQRDMODRX-DTBYZMGXSA-N	434.562	1.685	50	20	IDGD	
Cc1ccn(C[C@](C)(O)C(=O)NNC(=O)c2ccc(F)cc2Br)c(=O)c1	790559485	KPRBKXXQRMFYAN-KRWDZBQOSA-N	426.242	1.271	50	20	IDGD	
Cc1cc2n[nH]cc2cc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)NC(C)C)cn1	792280006	DTWVJHHJUZFNSR-UHFFFAOYSA-N	431.478	1.035	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)[C@](C)(O)Cn2cc(C(F)(F)F)ccc2=O)n1	792648807	MFUFMKHWYDNUAZ-QGZVFWFLSA-N	428.415	1.398	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1	793022372	WHSNMNZRCGSPAB-UHFFFAOYSA-N	439.197	1.825	50	20	IDGD	
Cc1cc(Br)ccc1NNC(=O)[C@](C)(O)CN1C(=O)NC2(CCCC2)C1=O	793711015	UOQVNILNZPPXEM-QGZVFWFLSA-N	439.310	1.816	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(F)cc2-c2cnn(C)c2)c1	796992148	NWSABAJBJTZDLE-UHFFFAOYSA-N	425.420	1.700	50	20	IDGD	
O=C(Cc1cc[nH]n1)NNC(=O)C(=O)Nc1ccc(-c2csc(C(F)(F)F)n2)cc1	797009583	UXZOUPXBZPHXOI-UHFFFAOYSA-N	438.391	1.881	50	20	IDGD	
CCNC(=O)N(C)c1cccc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)c1	797012759	TZOYKNMIRPJFAE-UHFFFAOYSA-N	445.501	1.436	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2CC(c3ccccc3[N+](=O)[O-])=NO2)cc1C	798310372	WOVJDVCFIIRJEA-KRWDZBQOSA-N	425.401	1.491	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)NCc1ccncc1OCC(F)(F)F	798521007	HZAAOJRQMMCIJP-UHFFFAOYSA-N	443.338	1.840	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)C2(c3cccc(Cl)c3)CC(=O)C2)cc1	798685053	AJNGJLQEXJLKAB-UHFFFAOYSA-N	425.828	1.817	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(S(=O)(=O)NNC(=O)CSc2ccccc2O)CC1	799796210	UZPANIWOWIOXFS-UHFFFAOYSA-N	445.563	1.834	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccnc(OCc3ccccc3)c2)c1O	800623131	HECJCBBJEMZEPN-UHFFFAOYSA-N	436.424	1.775	50	20	IDGD	
NS(=O)(=O)Cc1cccc(CNC(=O)NNC(=O)CCSc2ccc(F)cc2)c1	800719764	ZBCAAQDHHAIJRQ-UHFFFAOYSA-N	440.522	1.627	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)N[C@@H]3CCC[C@H]3CNS(C)(=O)=O)n[nH]2)cc1	800749096	RZDXYHBINFVXNR-LSDHHAIUSA-N	434.522	1.047	50	20	IDGD	
Cc1ccc(C2=NO[C@H](CNC(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)C2)cc1	800754205	QEYRVXFOJZKTSK-INIZCTEOSA-N	430.486	1.536	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)N[C@@H]1CCN(C(=O)Nc2ccccc2)C1	800983856	WRMHUHCHBCXLSO-MRXNPFEDSA-N	427.461	1.711	50	20	IDGD	
COc1ccc(S(=O)(=O)C[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(C)cc2)cc1	801110441	AXIACAQNMJGBGF-AWEZNQCLSA-N	433.486	1.200	50	20	IDGD	
O=C(NNc1ncnc2ccsc12)c1ccc(F)c(S(=O)(=O)N2CCOCC2)c1	801172339	SESCOCJUKLKYTD-UHFFFAOYSA-N	437.478	1.608	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)NNC(=O)Nc2ccc(Br)cc2)c(C)o1	801996727	HDMIJTNPUSDUTH-UHFFFAOYSA-N	431.268	1.725	50	20	IDGD	
C[C@H](C(=O)NNC(=O)Nc1ccc(Br)cc1)S(=O)(=O)C1CCOCC1	801998407	XPFXZKJVCXXHTI-SNVBAGLBSA-N	434.312	1.584	50	20	IDGD	
Cc1ccc([C@]2(C)NC(=O)N(CC(=O)NNC(=O)Nc3cc(F)cc(F)c3)C2=O)cc1	802002779	BQEDGXUNQARPSN-FQEVSTJZSA-N	431.399	1.893	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)cc1	802067012	HSSBOOMXXKLUIE-UHFFFAOYSA-N	428.373	1.943	50	20	IDGD	
CN1CCN(CCCNC(=O)NNc2ccc(-n3ccnc3)nn2)[C@H](c2ccccc2)C1	804952278	MEFOLNPXRSPVDE-IBGZPJMESA-N	435.536	1.667	50	20	IDGD	
CCc1nnc(NC(=O)[C@@H](C)[C@H](C)NC(=O)NNc2ccccc2S(C)(=O)=O)s1	805878493	NAORPHDOGMRXJV-QWRGUYRKSA-N	440.551	1.793	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)NC[C@@H]2c3ccccc3CCN2C(=O)OC(C)(C)C)cn1	807436042	AYWXWOHZOIAPCR-QGZVFWFLSA-N	428.493	1.899	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)NCC2(S(C)(=O)=O)CCCC2)cc1	807537349	IOZQTLLVDFEGRC-CQSZACIVSA-N	427.523	1.540	50	20	IDGD	
COc1cc(Cl)c(NC(=O)C(=O)NNC(=O)CNC(=O)OCc2ccccc2)cc1C	808943148	VEGUDXVKRHQXFX-UHFFFAOYSA-N	448.863	1.669	50	20	IDGD	
CCOC(=O)c1ccn(-c2ccccc2NC(=O)NNC(=O)[C@@H]2CCc3nncn3C2)n1	814635386	ZBBXALWQMJHEEH-CYBMUJFWSA-N	438.448	1.056	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(Br)c(C#N)c2)cc1OC	815563515	FTPCOOXAKARVJU-UHFFFAOYSA-N	447.245	1.738	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc([C@H]3CCOC3)cc2)cc1OC	815567429	XYGQSAJOZARLJU-INIZCTEOSA-N	427.457	1.998	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2CCc3nncn3C2)c(C(F)(F)F)c1	815691868	DCZGVAGCEGLHCX-JTQLQIEISA-N	440.382	1.044	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCO1)C(=O)Nc1ccc(Br)cc1OC(F)(F)F	815778581	YGRKJRXFVDYDQG-SECBINFHSA-N	440.172	1.613	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)c2ccc(S(N)(=O)=O)s2)c1	818763207	LOQMYBZLPOHJGR-UHFFFAOYSA-N	434.293	1.702	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NNC(=O)c1csc(N2CCOCC2)n1	892846280	IFOBNUBMSAAFIO-ZDUSSCGKSA-N	425.511	1.140	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)c(C)[nH]1	914750020	ITEWKTNWHVCTFP-UHFFFAOYSA-N	434.518	1.046	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)ccc1-n1cnnn1	914750515	JFKYQZFFGZQGCU-UHFFFAOYSA-N	432.444	1.336	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(S(=O)(=O)NC(C)(C)C)o2)cc1C	915268611	NLKQKOCIHHYMLV-UHFFFAOYSA-N	436.490	1.373	50	20	IDGD	
CC(=NNC(=O)c1c(C)nc2ccccn12)c1ccc(S(=O)(=O)N2CCNCC2)cc1	915931004	BHJDVEFDEUCJQV-UHFFFAOYSA-N	440.529	1.391	50	20	IDGD	
O=C(NCCNS(=O)(=O)c1cccc(Cl)c1)NNC(=O)c1ccc(Cl)cc1	916295135	JTLUGLLBEJIBKV-UHFFFAOYSA-N	431.301	1.916	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc(S(=O)(=O)N(C)C)ccc2F)cc1C	916562964	WTGXNOOSMUAIDB-UHFFFAOYSA-N	436.465	1.093	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2ccc3ccccc3n2)cc1	916646656	GCIWTGYQTNMTOG-UHFFFAOYSA-N	427.486	1.629	50	20	IDGD	
O=C(CCCCC/N=C1/NS(=O)(=O)c2ccccc21)NNC(=O)c1ccc(Cl)nc1	917250749	HNUHFGOWXQBKAE-UHFFFAOYSA-N	449.920	1.795	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2ccc3c4c(cccc24)C(=O)N3)c1	917737811	QLGOVJWGDXJTKR-UHFFFAOYSA-N	445.478	1.432	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NC[C@@H](c2ccc(C)cc2)N2CCOCC2)cc1	918099558	UCPKUSNXQRWJMS-NRFANRHFSA-N	442.516	1.786	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)NCc1ccc(N2CCOCC2)c(F)c1	918218347	WSOHXOXZPAWKLQ-UHFFFAOYSA-N	446.479	1.970	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2ccc(Cl)cc2O)cc1C	918358953	FMQSTKZNIYJFCT-UHFFFAOYSA-N	425.894	1.744	50	20	IDGD	
Cc1ccc(O[C@@H](C)C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)c(Br)c1	919885062	JPVULVWFYPZUOQ-WDEREUQCSA-N	434.312	1.042	50	20	IDGD	
Cc1ccc(Oc2ccc(OCC(=O)NNC(=O)N[C@H]3CCS(=O)(=O)C3)cc2)cc1	919889849	VNFHKJNVTZFTCX-HNNXBMFYSA-N	433.486	1.684	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NN=Cc1cc2c(cc1[N+](=O)[O-])OCCO2	920364414	RJEZSMGLVNSEGU-UHFFFAOYSA-N	433.446	1.731	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)c2sccc2NC(=O)c2ccncc2)c2ccccc2c1=O	920418456	VHYNNQQTBZCGDP-UHFFFAOYSA-N	448.464	1.717	50	20	IDGD	
CCNC(=O)NNC(=O)c1ccc(NC(=O)C[C@@H]2SC(N3CCCC3)=NC2=O)cc1	920858185	JEKUOFPOMNEIPN-AWEZNQCLSA-N	432.506	1.073	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2ccc(OC)cc2)ccc1Br	1317912461	WWRGYYWZWGTYJS-UHFFFAOYSA-N	443.275	1.868	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1	1318569985	GVXOMIVCVHRTBX-UHFFFAOYSA-N	435.481	1.318	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)CCN2C(=O)COc3ccccc32)CC1	1318615776	YKAAODUBQXGWSY-UHFFFAOYSA-N	446.504	1.597	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1ccccc1N1CCCC1=O	1318940550	BRCQLRSCZFROJF-UHFFFAOYSA-N	444.513	1.591	50	20	IDGD	
O=C(NNC(=O)c1ccn(-c2ccccc2C(F)(F)F)n1)N[C@@H]1CCS(=O)(=O)C1	1320392578	UKJRLFFIDFHCKJ-SNVBAGLBSA-N	431.396	1.022	50	20	IDGD	
CN(C(=O)OC(C)(C)C)[C@@H](C(=O)NNC(=O)COc1ccc(F)cc1)c1cnn(C)c1	1321299735	ZOPUNPHSQOFLNT-QGZVFWFLSA-N	435.456	1.694	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnn4ccncc34)C2)C1	1777976577	DCPWMOJMLPUYIF-UGSOOPFHSA-N	436.310	1.204	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)o1	1779027346	OBDLXIDMDHXGQO-QZTJIDSGSA-N	432.304	1.918	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(Cl)nn3)C2)C1	1779428914	STJCZNBDXFTFOP-BDJLRTHQSA-N	431.718	1.605	50	20	IDGD	
CN1CCCC[C@@H]1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCBr)C2	1780588492	AKFFQDYIWIUIKY-GPMSIDNRSA-N	430.387	1.770	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ncn(-c4cccc(F)c4)n3)CCO2)C1	1781213465	JFNYTYNUUITJHQ-UZLBHIALSA-N	435.887	1.867	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)c3cccc4c3NC(=O)C4)CCO2)C1	1781232221	HVTJPPXSGOXMJS-WOJBJXKFSA-N	440.327	1.861	50	20	IDGD	
Cc1cccc(/C=C/C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)n1	1781325052	IIJRYTXVSPTXFS-BHMLKFMNSA-N	426.286	1.924	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCNC(C)=O)C2	1781904712	AIHKBFKYUYTCKC-IIDMSEBBSA-N	432.359	1.200	50	20	IDGD	
COc1nccnc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)Br)C1	1781996120	BAXKWIZPAPAYGC-SNUQEOBHSA-N	441.326	1.396	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)Cn1cccn1)C2	1781996943	ZNMSGFCPTAMHPM-YIOZNXECSA-N	441.370	1.817	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(O)ccc3O)C2)C1	1782042583	LAQDFOJPOJWVAF-SGTLLEGYSA-N	427.295	1.572	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnc4c(c3)NC(=O)CS4)C2)C1	1782422435	JUVDMKQXYNMZBM-DJJJIMSYSA-N	438.937	1.587	50	20	IDGD	
C/C(=C/C(=O)N1CCO[C@@]2(CCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1)C(=O)O	1782867533	JTEZVAUZYKIQOL-VRSIDFBBSA-N	445.422	1.733	50	20	IDGD	
O=C(/C=C/c1cccc(O)c1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1783272947	FRKANNPTPMUYTI-FPZRGXOSSA-N	427.270	1.926	50	20	IDGD	
COCCOCCOCCC(=O)N1CC[C@@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1783663562	MXUBFWAHVPJLLO-HXUWFJFHSA-N	434.961	1.151	50	20	IDGD	
C[C@H](NC(=O)OC(C)(C)C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21	1783821710	FYLAVEYNUNDGLC-CYDGBPFRSA-N	438.352	1.683	50	20	IDGD	
CC(C)c1ccc(CC(=O)N2CCO[C@@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc1	1783937107	PHELLRULOSNDLC-XMMPIXPASA-N	444.576	1.555	50	20	IDGD	
C#CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCO[C@@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783952073	MLGJEDXCZRIASI-BFUOFWGJSA-N	448.347	1.537	50	20	IDGD	
COc1ccc2cc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]4C3)[nH]c2c1	1784090928	RDCLRYHYZQBHOT-JOQQVMPUSA-N	435.908	1.370	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3c(O)cc(O)cc3O)C[C@@H]21	1784620103	KKBWHOGGCGQPGP-DPYKFYPSSA-N	426.897	1.804	50	20	IDGD	
N#Cc1ccccc1OCC(=O)N1CC[C@@]2(CN(C(=O)CCBr)CCO2)C1	1785375497	BPSYUKAUTVQSBQ-IBGZPJMESA-N	436.306	1.552	50	20	IDGD	
CCOC(=O)C(C)(C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCBr)[C@H]2C1	1786408354	NIZIGMCSOCWITP-IHRRRGAJSA-N	433.343	1.340	50	20	IDGD	
C=CCSCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)[C@H]2C1	1787506498	AMMIGZSWJMUWRO-VYOPWZLOSA-N	447.561	1.019	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](S)C(C)C)C[C@@H]21	1787506777	MOYUMFXQLLDTIP-UKZVOZDVSA-N	449.577	1.055	50	20	IDGD	
CCOC(=O)N[C@H](O)C(=O)NC1(c2ccc(NC(=O)CCBr)cc2)CCC1	1787673292	SUCCYWZVGSAVKN-OAHLLOKOSA-N	442.310	1.970	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnoc3COC)[C@H]2C1	1787723126	DBYZGZGTNQFKIU-MHEUCROKSA-N	444.326	1.588	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1(c2ccc(NC(=O)Cn3cncn3)cc2)CCC1	1788257491	LQCPRPYJMMPFFS-RWPZCVJISA-N	448.487	1.546	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccnc4c3OCO4)[C@H]2C1	1789181003	OYFJBXZIFYYUGL-LDBIXWDDSA-N	444.315	1.640	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CSCc3[nH]cnc3C)C[C@@H]21	1789863016	AZKNSTXMHUTUEI-JKQORVJESA-N	428.986	1.948	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/c3cnccn3)C[C@@H]21	1789873022	PAJQBOLJAKWGIH-OIUMSMNJSA-N	427.332	1.706	50	20	IDGD	
CCOC(=O)O[C@@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](Br)CC)[C@H]2C1	1790964753	YSESTTZSEGTQBK-LXFSFDBISA-N	449.342	1.701	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CSc3ccccc3)C[C@@H]21	1791289076	IFQUBUNKJUVMEP-WDSOQIARSA-N	448.589	1.131	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)c1cc(F)c(F)c(Cl)c1	1792042719	ZJNLCIKRVHTXJZ-YIVQXAGMSA-N	437.270	1.811	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccccc1O)C2	1792872277	VWNJWKJDVYYWGF-LJGDNWOOSA-N	425.323	1.555	50	20	IDGD	
COc1ccc([C@H](C)C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CCC(=O)NN(C)C)C3)cc1	1792935823	YUMFJRIQNOJBKW-KANFNMMFSA-N	430.549	1.810	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3cc(F)ccc3s1)C2)[C@H](O)CCl	1792981238	HLYITCQQMWOJRO-DMVWFOPNSA-N	426.897	1.843	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCn1c(=O)oc2ccccc21	1793983941	JFSCCGJNMILIRN-YGTYGHESSA-N	435.908	1.592	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(F)nc1F)C2	1796889758	QBCDJDAGTXEQPT-BTSNSQKGSA-N	444.442	1.746	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnc3c(c1)CCNCC3)C2	1798628999	VYIQLZVKRRSSNZ-REPLKXPHSA-N	430.625	1.873	50	20	IDGD	
COc1ccnc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@](C)(Cl)CCl)C3)c1OC	1798771297	VNJIVISITIMJRU-MAAUKKLOSA-N	446.331	1.538	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc2c(c1)NC(=O)[C@@H](C)O2	1799293754	LRSRGIDTVFFRKH-YMILTQATSA-N	435.908	1.912	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1ccc([N+](=O)[O-])cc1F	1799491848	WTCPJUZOBIZENN-WAYYCVMKSA-N	448.220	1.628	50	20	IDGD	
CC[C@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccnc1CS(C)(=O)=O)C2	1800069318	DCYSVUDIJZADEI-FQLMCAECSA-N	427.954	1.895	50	20	IDGD	
Cc1c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)Br)nc2ccccn12	1800757225	JTJZBORJZXUSHI-MBMVNNNZSA-N	435.322	1.629	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1COc3ccccc3O1)C2	1800757974	YWDDWZUWTWGXET-ZWNONLRRSA-N	439.306	1.199	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1ccc(F)cc1F	1801821603	PUQABDLVJYVFQD-MUJYYYPQSA-N	443.454	1.458	50	20	IDGD	
C[C@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc3c(c1)n(C)c(=O)n3C)C2	1801962410	IOXHDHZHTGONEW-MHEUCROKSA-N	449.349	1.912	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(-c3ccncc3)[nH]n1)C2	1802337212	KKENAGGAIDWEFS-BJWYYQGGSA-N	439.520	1.097	50	20	IDGD	
CC(C)(CCl)C(=O)NC[C@H]1CCN(C(=O)CNCP(=O)(O)O)[C@@H]1c1cccnc1	1802900321	VDBPCMLWWRRQLS-GDBMZVCRSA-N	446.872	1.077	50	20	IDGD	
O=C(c1cnn(-c2cccnc2)c1)N1CCC2(CCCN(C(=O)[C@H](O)CCl)C2)CC1	1805517343	CCCRIYKUQOBOHH-GOSISDBHSA-N	431.924	1.712	50	20	IDGD	
Cc1ccn2c(=O)c(C(=O)N3CCC4(CCCN(C(=O)[C@@H](O)CCl)C4)CC3)cnc2c1	1805523916	GAPFWXCCGKNQQE-KRWDZBQOSA-N	446.935	1.447	50	20	IDGD	
N#Cc1ccc2[nH]nc(C(=O)N3CCC4(CCCN(C(=O)[C@@H](O)CCl)C4)CC3)c2c1	1805526253	IFBMHSCPLGXJGC-KRWDZBQOSA-N	429.908	1.879	50	20	IDGD	
Cc1ccsc1C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1807369910	YVDZLHMLMBYDPV-AZUAARDMSA-N	449.341	1.765	50	20	IDGD	
Cc1ccoc1C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1807375840	QFUUNYPINXQDOJ-QUCCMNQESA-N	433.273	1.296	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC2(CCCN(C(=O)CNC(C)(C)C)C2)CC1	1809730457	RGAAQJBYEQPSAV-YZSQISJMSA-N	444.580	1.740	50	20	IDGD	
C/C=C/C=C\C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1	1812578945	VOUJBGPIQBDFGX-VHDLWDKBSA-N	434.500	1.532	50	20	IDGD	
CN(CC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](O)CCl)CC2)C(=O)OC(C)(C)C	1814231310	DLUPFGGKJSWKAR-CMPLNLGQSA-N	446.957	1.522	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1CCc2nc(NC(=O)CN3CCOCC3)sc2C1	1814568716	DZAQACIBQLUHRL-DIFFPNOSSA-N	435.377	1.624	50	20	IDGD	
C[C@@H](CBr)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CN2CCOCC2)[nH]n1	1814780799	TUPCNWMVYSPCQQ-DZGCQCFKSA-N	442.358	1.765	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)C[C@H]2NC(=O)NC2=O)n[nH]1	1815771491	SIKFIVZXTPRNPN-RLFDGXBXSA-N	445.307	1.236	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)CCl)CC2)[C@@H]1Cc2ccccc2CN1	1817030343	IJGAYUNCBOMFBI-KBMXLJTQSA-N	434.949	1.369	50	20	IDGD	
C[C@H](C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](F)Cl)CC2)[C@@H]1SC(=N)NC1=O	1817251435	VTWAQENMKZLNKN-FTEGDLIOSA-N	433.918	1.392	50	20	IDGD	
Cc1ccc(CC(=O)N2CCCC[C@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)o1	1817474908	ITNAOEURHWDTFK-IBGZPJMESA-N	436.277	1.540	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)ccc1O	1817477130	MSJLVFSWPWGMTL-LJQANCHMSA-N	448.288	1.723	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1)c1ccc2c(n1)OCCO2	1817960377	OSTDOYPNGYBPDR-UONOGXRCSA-N	435.868	1.482	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(O)nc(O)n2)n[nH]1	1818031031	JIJCKVWYMUQVOE-CYBMUJFWSA-N	434.529	1.768	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](COC)NC(C)=O)n[nH]1	1819606178	SEWABLFTTPWJMW-NUEKZKHPSA-N	427.933	1.960	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1CCc2nc(NC(=O)c3n[nH]cc3[N+](=O)[O-])sc2C1	1820299024	JVZHNFYHWBHJPL-SECBINFHSA-N	438.542	1.852	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)CN2CCOCC2)[nH]n1)[C@H](F)Br	1820931909	ATZPDDIOLQJBRA-WFASDCNBSA-N	432.294	1.425	50	20	IDGD	
CC(=O)N[C@H](C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](C)CBr)[nH]n1	1821967883	ZWBXRHJJGAECFJ-GYSYKLTISA-N	428.331	1.957	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN2CCOCC2)[nH]n1	1822088482	WRCDNTLFJMUUFF-ZFWWWQNUSA-N	442.358	1.908	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2c[nH]c(=O)cn2)[nH]n1	1822089586	DLSDWYJHAFPMTN-GWCFXTLKSA-N	437.298	1.972	50	20	IDGD	
C[C@H](Cn1ccnc1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1	1822416419	CWNPLACZTJBCFU-WBVHZDCISA-N	444.540	1.308	50	20	IDGD	
Cc1cc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@@H](O)CCl)CC3)nc2nccn12	1824111380	RCTHSMNAHYKLEF-MFKMUULPSA-N	434.909	1.320	50	20	IDGD	
O=C(c1cnc(OCF)cn1)N1CCC([C@@H]2CCCCN2C(=O)[C@H](O)CCl)CC1	1824180404	HJNBSAXELAKNPV-JKSUJKDBSA-N	428.892	1.615	50	20	IDGD	
CS(=O)(=O)CC(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H](F)Br)CC1	1826628909	KGJIKQXEFVNYIE-OCCSQVGLSA-N	427.336	1.341	50	20	IDGD	
Cn1ccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)CC2)c1	1828925017	BFFQLDUDJPXXAP-HXUWFJFHSA-N	438.532	1.571	50	20	IDGD	
COc1ccccc1CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830366316	QGFACMSLFGMZHR-JOCHJYFZSA-N	438.952	1.959	50	20	IDGD	
O=C(Cc1ccc2ccccc2c1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1830724882	JEAOIBQTDMGFDE-NFBKMPQASA-N	446.931	1.438	50	20	IDGD	
O=C(C[C@@H]1COc2ccccc2O1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1831236129	WSRQAPGUDSGHEB-LXGCGDOSSA-N	442.871	1.207	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccn4ccnc4c3)C2)C1	1831652323	YSWCUCVIRODRIP-UTKZUKDTSA-N	434.924	1.812	50	20	IDGD	
Cc1cccc(CC(=O)N2CCC([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)n1	1831871965	YCPOIOSMNRCOIZ-NRFANRHFSA-N	443.592	1.925	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)CCN2CCCC2)CC1	1832966025	MJNPBFLJHPUBQG-JOCHJYFZSA-N	441.381	1.086	50	20	IDGD	
Cc1nnc(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)s1	1833016930	MFVNIMVVAAIGHT-IBGZPJMESA-N	444.985	1.501	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cn3nc(C)cc3C)CCO2)C1	1833035355	BWCDHIRVZCVUPT-PXNSSMCTSA-N	426.945	1.364	50	20	IDGD	
CSc1ncccc1C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)CCl)CC2)CC1	1833312349	MDZLAVHGUYVGPZ-QGZVFWFLSA-N	440.997	1.588	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)Cc3cc(F)ccc3F)CC2)CC1)[C@H](O)CCl	1833313418	FCCIQEXWAOKVGP-LJQANCHMSA-N	443.922	1.679	50	20	IDGD	
Cc1nscc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1	1833746875	GHXXRAAGGXKEAF-IAGOWNOFSA-N	436.361	1.758	50	20	IDGD	
CC[C@H](C)[C@@H](N)C(=O)N1CCC(N2CCC(NC(=O)CCBr)CC2)CC1	1834421890	RQGRTERKAIKTIV-KBXCAEBGSA-N	431.419	1.716	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cn4ncccc4n3)CC2)CC1	1835395480	YFMJNGQLYOKUET-KRWDZBQOSA-N	432.956	1.932	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC(OC2CCN(C(=O)c3ncon3)CC2)CC1	1836673145	JKZGXKXBDGFQMI-GFCCVEGCSA-N	429.315	1.713	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(C4CC4)on3)C2)C1	1837708859	QNLIGELKCNLXJF-HXUWFJFHSA-N	437.569	1.474	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)N1CCC(OC2CCN(C(=O)[C@H](C)Br)CC2)CC1	1838428627	QWXBILCPBCCJLM-UONOGXRCSA-N	444.370	1.459	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cn(C(C)(C)C)nn3)CCO2)C1	1838756223	ZHKNWCVZTGMQRD-MGPUTAFESA-N	441.960	1.511	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](C)n3cccn3)CC2)CC1	1838786821	QWRCDRZKFYSZQT-QAPCUYQASA-N	426.945	1.697	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4nccnc4c3)C2)C1	1839144712	JEEGSEGMNSWXLH-HRAATJIYSA-N	432.908	1.717	50	20	IDGD	
Cc1cnc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)s1	1839151528	VEWOPFVKPPIWNL-DLBZAZTESA-N	436.361	1.758	50	20	IDGD	
C=CCO[C@H](C)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](Br)CC)CCO2)C1	1839962470	GHZISLSWTDWBSN-RKVPGOIHSA-N	433.343	1.207	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(C)n3)C2)C1	1839963572	OJVCHVBUIRMVPP-DNVCBOLYSA-N	440.338	1.634	50	20	IDGD	
CC(C)[C@H]1CC[C@H](C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)CC1	1839974493	OLJVCIPNEFVNKJ-IKVWTGGYSA-N	430.973	1.505	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3CCc4ccccc43)C2)C1	1840155599	FMFCVWKTRLINJE-IPJJNNNSSA-N	436.936	1.427	50	20	IDGD	
O=C([C@@H](F)Cl)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)c1ccccc1Cl)CCO2	1840317215	OLAZHBFVOLASPP-RKVPGOIHSA-N	435.279	1.364	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)Cc2cncnc2)C1	1842096312	JNMGOEQDQARGMM-UHFFFAOYSA-N	439.428	1.370	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)[C@@H](C)C1(O)CCC1)C2	1844691798	AXDBTLNSHANPQV-CQSZACIVSA-N	445.472	1.888	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@]2(C(=O)N3CCCC34CN(C(=O)[C@@H](F)Cl)C4)C[C@H]1CO2	1845078168	FKURXEDAGOHKEF-QUJCMNEKSA-N	431.892	1.503	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2cccc3nccn23)C1	1845644347	KWVQXHCTUCVURH-MFKUBSTISA-N	433.472	1.285	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)[C@H]2CC[C@H](O)CC2)C1	1846467179	CVGABXCKDDUNJW-JCNLHEQBSA-N	445.472	1.888	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1nc2c(=O)[nH]c3ccccc3n2n1	1847437992	DZSRVSNDPBYAIP-GJZGRUSLSA-N	442.907	1.651	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)CCNc2ccccc2[N+](=O)[O-])c1	11593919	PWGYIRXKFJMNEH-UHFFFAOYSA-N	435.462	1.108	50	20	IDGD	
COc1ccc(S(N)(=O)=O)cc1C(=O)NNC(=O)c1ccc(COc2ccccc2)o1	24464326	FEECUOJEZLTPIW-UHFFFAOYSA-N	445.453	1.589	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1	26974916	JHQADXULCVJLSS-LPHOPBHVSA-N	445.497	1.136	50	20	IDGD	
CN(Cc1cc(Br)ccc1F)C(=O)NNC(=O)CNC(=O)c1ccco1	725871540	MYOHHKXOGFJEKR-UHFFFAOYSA-N	427.230	1.784	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2ccc(F)c(Cl)c2)c1	726275964	BBXAVPDUBLNNRT-UHFFFAOYSA-N	428.873	1.874	50	20	IDGD	
O=C(CNC(=O)NCc1ccc(Cl)cc1)NNC(=O)c1cc(-c2ccccc2)[nH]n1	727493318	LSIFNMYLSDRVAH-UHFFFAOYSA-N	426.864	1.991	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1ccc(I)cc1Cl	727984972	BOHJQVBTKYFPFY-SSDOTTSWSA-N	442.662	1.140	50	20	IDGD	
O=C(CNC(=O)NCc1ccc([N+](=O)[O-])cc1)NNC(=O)c1cccc(OC(F)F)c1	728543700	CZCZTVIFXLDCBY-UHFFFAOYSA-N	437.359	1.457	50	20	IDGD	
O=C(NC[C@@H](c1cccs1)N1CCCC1)NNC(=O)C1CCN(c2ncccn2)CC1	729045219	RTHWQMHJMAITAF-KRWDZBQOSA-N	443.577	1.922	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCN(C)C2CCCC2)c1	729622474	HHBVQJJMKHYGTQ-UHFFFAOYSA-N	439.582	1.536	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])o1	731874870	SHBCJZWOTRIRKZ-YPMHNXCESA-N	434.380	1.546	50	20	IDGD	
Cc1cccn2cc(CC(=O)NNC(=O)NC3CCN(C(=O)OC(C)(C)C)CC3)nc12	734821467	KPQYKMHFLULURU-UHFFFAOYSA-N	430.509	1.915	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)N[C@@H]1CCCN(c2cccc(F)c2)C1	734855669	QYZBHIZNUDJPIR-OAHLLOKOSA-N	448.524	1.732	50	20	IDGD	
CC(C)COc1ccccc1C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	735118314	RNWPZGJDEGWZFT-UHFFFAOYSA-N	447.561	1.809	50	20	IDGD	
CCSc1ccccc1C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	735118567	WZSNBTANXUVSQU-UHFFFAOYSA-N	435.575	1.887	50	20	IDGD	
C[C@@H]1CN(S(=O)(=O)c2cccc(C(=O)NNc3ccc(Cl)nn3)c2)C[C@@H](C)O1	735688796	VPSADJZAFMLOAH-VXGBXAGGSA-N	425.898	1.685	50	20	IDGD	
Cc1nc(-c2cccnc2)nc(NNC(=O)C2=NN(c3ccc(F)cc3)[C@@H](C(N)=O)C2)c1C	736696719	MHKHIWIZFUFPDE-GOSISDBHSA-N	448.462	1.858	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(CC(=O)NNC(=O)NCc2ccc(Cl)cc2)C(=O)C1	741305858	SMMURKAKJFUIDQ-UHFFFAOYSA-N	439.900	1.250	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1ccc(OC2CCOCC2)cc1	741922355	BBFZBUMIGBDAGT-UHFFFAOYSA-N	425.489	1.712	50	20	IDGD	
Cc1nn(C)c2sc(C(=O)N[C@H](C)C(=O)NNC(=O)NCCc3cccs3)cc12	742053116	DJARDFKWUPAEGJ-LLVKDONJSA-N	434.547	1.696	50	20	IDGD	
CCn1c(O)nc2cc(C(=O)NNC(=O)c3cccc(Br)c3)ccc2c1=O	742769106	KLIAOVAZDTXPFZ-UHFFFAOYSA-N	431.246	1.959	50	20	IDGD	
CCOc1ccc(NC(=S)NNC(=O)c2ccc(C[C@@H]3CC(=O)NC3=O)cc2)cc1	743300971	NSBVHPMZUFIQOD-OAHLLOKOSA-N	426.498	1.922	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NC[C@H](C)Oc1cccc(F)c1	743509699	JHONPDFVOAXORK-LBPRGKRZSA-N	437.497	1.839	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)N[C@H]1CCCN(c2ccccc2Cl)C1	743512194	SGTJJJBNGGSQQS-HNNXBMFYSA-N	440.895	1.929	50	20	IDGD	
COc1ccc2c(c1)OCC[C@@H]2NC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	743650250	SFQHMEOVAYYUHC-INIZCTEOSA-N	434.474	1.958	50	20	IDGD	
CS(=O)(=O)Cc1cccc(C(=O)NNC(=O)c2cc(Br)ccc2O)c1	743733566	MDDMDIGTFBPKLM-UHFFFAOYSA-N	427.276	1.774	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCOCC3)cc2)cc1	743827976	VVFFZPTVNKZDSF-UHFFFAOYSA-N	447.517	1.240	50	20	IDGD	
COc1ccc(-n2ccc(CNC(=O)NNC(=O)c3cc([N+](=O)[O-])ccc3O)n2)cc1	745763526	RGCUQOJUVMTTEM-UHFFFAOYSA-N	426.389	1.639	50	20	IDGD	
CN(C)CCCOc1ccc(CNC(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)cc1	745800613	IJZUYKROLUKUBD-UHFFFAOYSA-N	431.449	1.775	50	20	IDGD	
COc1cc(C(=O)NNC(=O)N[C@H]2CCN(c3cc(C)nn3C)C2=O)ccc1OC(C)C	745905917	OJXMPEBXFACSRP-HNNXBMFYSA-N	444.492	1.274	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)N[C@@H]3CCCN(CC(F)(F)F)C3=O)nc21	746339796	QYCYFWPYXQDUOB-SNVBAGLBSA-N	444.418	1.466	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=O)Cc2cn3ccccc3n2)ccc1C	746546165	BTQCGMAYTAYBKV-UHFFFAOYSA-N	443.529	1.677	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)c1sc(N2CCCC2)nc1Cl	746601689	FUYZPTCPFBBDKN-UHFFFAOYSA-N	432.934	1.865	50	20	IDGD	
COc1ccc(/C=C(\C#N)C(=O)OCC(=O)Nc2ccc(C)c(S(N)(=O)=O)c2)cc1	747873184	BEHCORTWZSFAHP-OQLLNIDSSA-N	429.454	1.740	50	20	IDGD	
CCN(Cc1ccccc1)c1ccc(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)cc1	748718125	SFOBTHSFXSOHQI-GOSISDBHSA-N	430.530	1.844	50	20	IDGD	
N#Cc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)CCc3ccccc3)CC2)cc1	749802677	OYXNNMVSOLUJAM-UHFFFAOYSA-N	440.525	1.739	50	20	IDGD	
C[C@H](NC(=O)CC1CCCCC1)C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	749837683	FXVHZTNESRAQJM-AWEZNQCLSA-N	438.550	1.173	50	20	IDGD	
CCC(CC)[C@@H](C(=O)OCC(=O)NNC(=O)c1ccc(Cl)cc1)N1CCOCC1	750510996	CHXRKDWQLOLHRF-SFHVURJKSA-N	425.913	1.781	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)[C@@H]1CSCN1C(=O)OC(C)(C)C	751291697	YCHJPQZJPFVPPR-ZDUSSCGKSA-N	425.507	1.922	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)c2cc(Br)ccc2n1	751363949	YVKNAMQRHNQTCK-LLVKDONJSA-N	441.307	1.437	50	20	IDGD	
CCC(=O)NCc1cc(S(=O)(=O)NNC(=O)c2ccc(Cl)nc2)ccc1OC	751541440	YBIKSOCYOHSHOM-UHFFFAOYSA-N	426.882	1.393	50	20	IDGD	
COC(=O)c1cc2c(cc1NC(=O)C(=O)NNC(=O)c1cccc3ncccc13)OCO2	753840348	JBICGVVWUAPTAH-UHFFFAOYSA-N	436.380	1.150	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc2ccccc2o1)c1cccc(S(=O)(=O)N2CCCC2)c1	753977695	HYDGYWYIEZVTAC-UHFFFAOYSA-N	449.510	1.841	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(N2CCOCC2)c(C(=O)NNc2cccnc2Cl)c1	754484924	AIQWFVSCMBSTOH-UHFFFAOYSA-N	439.925	1.579	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)[C@@H](NC2CCOCC2)C(C)C)cc1C	754512270	MVIYQBHUOGMTOO-SFHVURJKSA-N	425.551	1.716	50	20	IDGD	
C[C@H]1Cc2cc(S(N)(=O)=O)ccc2N1C(=O)COC(=O)/C(C#N)=C/c1ccc(O)cc1	754538100	CFSLISBMJITONO-WFSQQTBHSA-N	441.465	1.468	50	20	IDGD	
O=C(NNC(=O)c1ccc[nH]1)Nc1ccc(Cl)c(S(=O)(=O)N2CCOCC2)c1	755359960	BJSHSGLZARCMHC-UHFFFAOYSA-N	427.870	1.156	50	20	IDGD	
CN(Cc1ccccc1)S(=O)(=O)c1ccc(NC(=O)NNC(=O)c2cnn(C)c2)cc1	755446854	RICFBZQGXVGHDB-UHFFFAOYSA-N	442.501	1.707	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)COc2ccc(Br)cc2)ccc1-n1cnnn1	755682643	ZZYMQYPHLIGWMY-UHFFFAOYSA-N	446.265	1.965	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)N1CCC[C@@H]1Cn1cnc2ccccc21	756063201	NSEDXLIVLPPDDA-CQSZACIVSA-N	426.502	1.733	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)Nc2cccnc2N2CCOCC2)cc1	756183397	LAWIXPCSDXGXCT-OAHLLOKOSA-N	427.461	1.741	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)C(=O)Nc1ccc(N2C[C@H]3CC[C@H]2C3)cc1	756200274	YZXIBRBXICHWLW-KXBFYZLASA-N	432.484	1.652	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@H]2C)ccc1NC(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O	756246157	SWLXHSCUXRSLCP-ZIAGYGMSSA-N	439.538	1.100	50	20	IDGD	
CS(=O)(=O)CCOc1cccc(NC(=O)NNC(=O)COc2ccccc2C#N)c1	756297589	MGOZGQMVCHKFBB-UHFFFAOYSA-N	432.458	1.213	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)Nc1ccc(C(=O)NC2CCOCC2)cc1	757618926	HRRLKNCOOXGEBC-UHFFFAOYSA-N	442.472	1.836	50	20	IDGD	
Cc1ccccc1-n1nc(C)c2cc(C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)sc21	758045864	QBKXPQZSJADUSI-LBPRGKRZSA-N	435.531	1.403	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1ccc(Oc2ccc(Cl)cc2)c(F)c1	758046498	SUPUDHSDCAVTIQ-JTQLQIEISA-N	429.857	1.970	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)NCc1ccc2c(c1)C(=O)NCC2	758684858	RBLWRPHWIHIUNN-UHFFFAOYSA-N	447.289	1.644	50	20	IDGD	
CN(NC(=O)c1ccc(N2CCOC2=O)cc1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758782041	LMEBURCMZPDBSF-UHFFFAOYSA-N	447.492	1.893	50	20	IDGD	
COc1cc2c(cc1C=NNC(=O)c1cccc(S(=O)(=O)N3CCCC3)c1)OCO2	758868885	KYNYKJPXPDYXSN-UHFFFAOYSA-N	431.470	1.972	50	20	IDGD	
COC(=O)[C@H](C)Cc1ccc(NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1	760088057	RSXDGMVFXNBGIH-OAHLLOKOSA-N	440.504	1.898	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)c3ccc(=O)n(-c4cnn(C)c4)c3)n[nH]2)c1	760825246	RCSCYRQZKOKXHO-UHFFFAOYSA-N	431.456	1.653	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCCC(=O)NNc1cnnc2ccccc12	761079604	YVPHRTVHFQXNCM-QGZVFWFLSA-N	428.493	1.979	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)N[C@H]1CCN(c2ccccc2OC)C1=O	761734084	CLOWTGIMFFIOIU-AWEZNQCLSA-N	444.513	1.932	50	20	IDGD	
CSCC[C@@H](NC(=O)Cc1ccccc1)C(=O)NNc1nccc(N2CCOCC2)n1	762856984	PNYZGUJILGRJJL-QGZVFWFLSA-N	444.561	1.237	50	20	IDGD	
CN1C(=O)C[C@H](C(=O)NNc2nccc(N3CCOCC3)n2)[C@@H]1c1cccc(Cl)c1	762860693	HGJNRJDUQWFZBK-YJBOKZPZSA-N	430.896	1.629	50	20	IDGD	
Cc1cc(C)nc(-n2nc(C)c(CC(=O)NNc3nccc(N4CCOCC4)n3)c2C)n1	762866564	OYRCWEIIYWFRAM-UHFFFAOYSA-N	437.508	1.208	50	20	IDGD	
CCS(=O)(=O)c1cccc(C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c1	762908434	SOKYETFMUKGUEV-UHFFFAOYSA-N	435.414	1.006	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(Cl)c(N)c(Cl)c2)c1	763258135	GAHXRUJEMOYACF-UHFFFAOYSA-N	431.301	1.901	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)NC[C@H](c1ccccc1)N1CCOCC1	763461131	ZFEAJEQKDWJATL-QGZVFWFLSA-N	430.530	1.888	50	20	IDGD	
O=C(NNC(=O)c1ccccn1)C(=O)Nc1ccnn1Cc1cccc(Br)c1	763464623	PMQNHBKUXOXVPF-UHFFFAOYSA-N	443.261	1.489	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)NNC(=O)c1cnn(-c2ccccc2)c1	763507752	VIBXBTCBIWVLLC-UHFFFAOYSA-N	445.480	1.152	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)COc2ccccc2Br)c1	763548331	JVWKUEGBWYJMCE-UHFFFAOYSA-N	427.276	1.693	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccccc2N2CCN(C)CC2)c2ccccc2n1	763615723	PORQSCRQNAFNLX-UHFFFAOYSA-N	446.511	1.695	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2ncn(Cc3ccc(Cl)cc3)n2)c1	763625859	ZGQBJGGZVUIDHC-UHFFFAOYSA-N	442.863	1.453	50	20	IDGD	
COc1cc(OC)c(OC)cc1NC(=O)C(=O)NNC(=O)c1c(C)nc2ccccn12	763630153	WVUQKGRRGZIUNN-UHFFFAOYSA-N	427.417	1.068	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(-c2ccccc2C)nn1C	763664548	XQSKJTDOOAIOLL-UHFFFAOYSA-N	437.456	1.569	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(CN3CCOC3=O)c2)cc1C	763667957	WUHXIACUEKHNDJ-UHFFFAOYSA-N	440.456	1.421	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)c(C)c1	763745974	MBLZYTDODWYTEM-UHFFFAOYSA-N	440.500	1.559	50	20	IDGD	
Cc1noc(COc2ccc(NC(=O)C(=O)NNC(=O)c3cc4c(s3)CCC4)cc2)n1	763781544	LBBMRZOELRVLNM-UHFFFAOYSA-N	441.469	1.907	50	20	IDGD	
CO[C@@H](C)C(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCC3)c1	763782774	VEMLEXXHTDOZPW-NSHDSACASA-N	430.486	1.610	50	20	IDGD	
CC(C)(C)c1ccc(C(=O)NNC(=O)C(=O)Nc2cnn(-c3ncccc3C#N)c2)cc1	763795505	OPZQMGUNNJYMNZ-UHFFFAOYSA-N	431.456	1.836	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccc(Cl)c(C(=O)NC2CC2)c1	763840258	OTMPGOKCNKOKHX-UHFFFAOYSA-N	448.838	1.536	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)N(C)CCO3)c1C	763849816	NIDCRKMDONWNPT-HNNXBMFYSA-N	426.473	1.685	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)c(OCCN(C)C)c1	763855753	BABLFIHDQNQDQN-HNNXBMFYSA-N	446.479	1.628	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(F)cc2OCC#N)cc1OC	763912386	YXPIDNBORWLXLL-UHFFFAOYSA-N	444.419	1.925	50	20	IDGD	
Cc1c(Cl)cc(NC(=O)C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1Cl	763917542	WTCLSVOJMIABFP-UHFFFAOYSA-N	434.243	1.677	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Br)s2)cc1	763940547	JGAIYDFQUDVBEX-UHFFFAOYSA-N	442.291	1.936	50	20	IDGD	
CN1CCCN(c2ccc(NC(=O)C(=O)NNC(=O)c3cc(Cl)ccc3O)cc2)CC1	763976924	IXUVKAGVZAYGOV-UHFFFAOYSA-N	445.907	1.587	50	20	IDGD	
CCOC(=O)c1cnn(-c2cccc(NC(=O)C(=O)NNC(=O)c3cccn3C)c2)c1C	763995362	HDDJEKVNBRAAGP-UHFFFAOYSA-N	438.444	1.096	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccsc2)c2ccccc12	764032910	GHRRFBOKCFCJPF-UHFFFAOYSA-N	441.465	1.782	50	20	IDGD	
O=C(NNC(=O)c1cccc(Br)c1)C(=O)Nc1cnn(-c2ccccc2)n1	764062947	HEIGIEXMMINYPN-UHFFFAOYSA-N	429.234	1.430	50	20	IDGD	
O=C(NNC(=O)c1cccc(Br)c1)C(=O)Nc1ncn(Cc2ccccc2)n1	764063574	SHLRBEKJIXMDDC-UHFFFAOYSA-N	443.261	1.489	50	20	IDGD	
O=C(Cc1ccc2ccccc2c1)NNC(=O)C(=O)Nc1ccn(Cc2ccncc2)n1	764085142	PMMGNNMZHTYMSW-UHFFFAOYSA-N	428.452	1.808	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2ccc(CCS(C)(=O)=O)cc2)cc1	764131054	FVYDRQUZUJYUMY-UHFFFAOYSA-N	447.513	1.001	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2O1)C(=O)Nc1ccn(-c2ccccc2Cl)n1	764164731	SPJIYXUQANRSOB-INIZCTEOSA-N	425.832	1.615	50	20	IDGD	
Cc1cc(C(=O)N2CCC[C@@H](C)C2)ccc1NC(=O)C(=O)NNC(=O)Cc1ccccn1	764267253	FXCOATZBCVAFPV-OAHLLOKOSA-N	437.500	1.591	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)C(=O)Nc1ccc(C(F)(F)F)cc1Br	764294775	BHMSAYZQXRSEGY-UHFFFAOYSA-N	434.172	1.899	50	20	IDGD	
CSc1nnnn1-c1cccc(NC(=O)C(=O)NNC(=O)c2cc3ccccc3o2)c1	764330354	AQTDRDYUSIXQAA-UHFFFAOYSA-N	437.441	1.530	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)N[C@H]3CCCC[C@@H]3N3CCOCC3)n[nH]2)cc1	764374941	MMXCSYUOCIQVBL-PXNSSMCTSA-N	426.521	1.973	50	20	IDGD	
CC[C@@H](C)NS(=O)(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)c2ncccc2C)c1	764385881	OJOQWHVZBAQNFP-CQSZACIVSA-N	447.517	1.008	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1)C(=O)Nc1cccc2c1OCCC2=O	764386572	AYCBLTHJAYAMID-UHFFFAOYSA-N	437.387	1.581	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)C(=O)Nc1ccccc1O[C@H]1CCOC1	764401175	NHUGWKIOAPEOJK-ZDUSSCGKSA-N	431.470	1.438	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)Cn3c(=O)nc(O)c4ccccc43)n[nH]2)cc1	765574754	DWYIAXPPJIEKMD-UHFFFAOYSA-N	432.440	1.516	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)c1ccc(N2C(=O)CCC2=O)c([N+](=O)[O-])c1	766711905	VFVHKRKTDKVSGV-UHFFFAOYSA-N	426.385	1.226	50	20	IDGD	
Cn1nc(SCC(=O)NN=C2CCSc3ccc(Cl)cc32)c(=O)n(C)c1=O	767300357	IJRPSJYATPNZNF-UHFFFAOYSA-N	425.923	1.241	50	20	IDGD	
CC(C)(C)[C@H](Br)C(=O)N(CCCN1CCOCC1)[C@@H]1CCS(=O)(=O)C1	768032464	BCOGPKZLKODBHG-HUUCEWRRSA-N	439.416	1.534	50	20	IDGD	
CC(C)c1cc(NC(=O)C(=O)NNC(=O)CCOc2ccccc2)n(-c2ncccn2)n1	768238564	CYXLXILKWSGHNO-UHFFFAOYSA-N	437.460	1.341	50	20	IDGD	
NS(=O)(=O)c1cccc2c(C(=O)NNC(=O)C34CC5CC(CC(C5)C3)C4)nccc12	768463801	XEJAQROFQYDGLF-UHFFFAOYSA-N	428.514	1.860	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)CN2C(=O)N[C@]3(CCCC(C)(C)C3)C2=O)c1	768571051	LOBQAEQZCFCPDD-QFIPXVFZSA-N	430.505	1.720	50	20	IDGD	
COc1ccc(C(=O)NNC(=S)NCCSC)cc1S(=O)(=O)NC1CCCC1	769776869	HXUORNFLNZYPTK-UHFFFAOYSA-N	446.620	1.388	50	20	IDGD	
CCc1c(C(=O)NNc2nc(O)c3cnn(C)c3n2)nnn1-c1ccc(OC(C)C)cc1	770991516	SIWQRHXIKMMUBV-UHFFFAOYSA-N	437.464	1.756	50	20	IDGD	
CS(=O)(=O)CCN1CCC(NC(=O)NNc2ccc(Br)c(F)c2)CC1	771320421	DOTJSAHSYVAWCR-UHFFFAOYSA-N	437.335	1.723	50	20	IDGD	
C[C@@H](CO)NC(=O)/C(C#N)=C\c1cn(CCC(N)=O)nc1-c1cccc(Br)c1	771779431	YEDMXSYAZIIBPW-OBTCNRAFSA-N	446.305	1.592	50	20	IDGD	
CN(C)c1cc(C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c2ccccc2n1	772310430	UMMWNARAZYBZDX-UHFFFAOYSA-N	437.412	1.827	50	20	IDGD	
CCNS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)c1	772951275	CEKSXNLLHYDAFX-LBPRGKRZSA-N	425.894	1.867	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)C(=O)Nc2ccc(F)cc2I)n1	773482169	LYJURSKBKIBKNB-UHFFFAOYSA-N	429.193	1.919	50	20	IDGD	
CC(C)c1nccnc1NNC(=O)C(=O)Nc1ccc(S(=O)(=O)N(C)C2CC2)cc1	773997774	MEYKGTATAMEMPD-UHFFFAOYSA-N	432.506	1.465	50	20	IDGD	
Cn1cc(S(=O)(=O)NNC(=O)CCCc2ccccc2)cc1C(=O)NCC(F)(F)F	775671587	IHYLTQCYAHCFGT-UHFFFAOYSA-N	446.451	1.650	50	20	IDGD	
CC(C)N(C)S(=O)(=O)c1cccc(C(=O)NNc2cccc(S(C)(=O)=O)c2)c1	776534548	SDZGUAJCBJUOCF-UHFFFAOYSA-N	425.532	1.876	50	20	IDGD	
Cn1cc(Br)cc1C(=O)N1CCN(S(=O)(=O)CBr)CC1	777832631	PTYNZHUFSJJOHL-UHFFFAOYSA-N	429.134	1.228	50	20	IDGD	
CN(C)C(=O)COc1ccccc1C(F)(F)C(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	778517277	KKBWDQIWPNXALB-UHFFFAOYSA-N	436.371	1.615	50	20	IDGD	
COCCCn1ccc(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2Br)n1	778751953	LCRCCKRIUFVODX-UHFFFAOYSA-N	441.242	1.672	50	20	IDGD	
CC(C)N1CC[C@@H](NC(=O)NNC(=O)C(=O)Nc2ccccn2)[C@H]1c1ccc(F)c(F)c1	779416948	JEBFSAJMNWJTSN-SJLPKXTDSA-N	446.458	1.853	50	20	IDGD	
O=C(c1nn(-c2ccc(F)cc2)cc1O)N1CCN(S(=O)(=O)CBr)CC1	779544736	NMRHUDVQLSTWDW-UHFFFAOYSA-N	447.286	1.157	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNS(=O)(=O)c2cnc(-c3ccccc3)nc2)cc1C	780366552	LXPGYRCUEZHVQK-UHFFFAOYSA-N	425.470	1.709	50	20	IDGD	
COc1cccc(NNC(=O)C2CCN(c3ccc4nnc(C(F)(F)F)n4n3)CC2)n1	780771857	FBZZZCITVOLIJK-UHFFFAOYSA-N	436.398	1.906	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)c2c(N)ccc(Br)c2F)cc1	781223865	MBUJCVVDZDYUAD-UHFFFAOYSA-N	435.209	1.660	50	20	IDGD	
CNC(=O)c1cc(Oc2ccccc2NC(=O)C(=O)NNc2cncc(Cl)n2)ccn1	783265668	JQOOYOOEEFKUDC-UHFFFAOYSA-N	441.835	1.759	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2ccc(S(=O)(=O)N(C)C3CCCCC3)cc2)ncn1	783945941	UIVMPMIEDXNEPV-UHFFFAOYSA-N	446.533	1.820	50	20	IDGD	
CCCCOc1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)cn1	784216834	QFMJDFISZLZSGJ-UHFFFAOYSA-N	447.517	1.783	50	20	IDGD	
COC(=O)CCOc1ccc(NC(=O)C(=O)NNc2ccc(Br)nc2)cc1	784806833	RQAGMCLBLCWHOS-UHFFFAOYSA-N	437.250	1.868	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)cc1OC(C)C	785067169	HVEMAEVSYMOLON-UHFFFAOYSA-N	425.445	1.459	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)cc1OC	785100149	RUWKXZPNFKWLIZ-UHFFFAOYSA-N	434.399	1.956	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2cccc(N3CCOC3=O)c2C)n1	785226006	BXQRGMJFKRYOJD-UHFFFAOYSA-N	427.465	1.670	50	20	IDGD	
CNC(=O)c1cccc(NC(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)c1	785835780	WYASEPIUJLJNFC-UHFFFAOYSA-N	434.497	1.687	50	20	IDGD	
Cc1ccc(-n2cc(NC(=O)C(=O)NNC(=O)c3nnc(O)c4ccccc34)cn2)c(C)c1	786414355	MIWGRZMTTVWZNN-UHFFFAOYSA-N	445.439	1.538	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)N[C@@H]1CCN(c2ccc(Cl)cc2Cl)C1	788906243	NFFKBERGMLYZDC-GFCCVEGCSA-N	440.287	1.926	50	20	IDGD	
Cn1c(N)c(C(=O)/C(C#N)=C\c2cc(Br)c(Cl)s2)c(=O)n(C)c1=O	790099696	LMUYFWVNBICUNR-UTCJRWHESA-N	429.683	1.933	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)c(F)c1	790388852	IUSYKFXQDAVWBO-UHFFFAOYSA-N	446.501	1.726	50	20	IDGD	
O=C(NNC(=O)[C@H]1[C@H]2[C@@H]3C[C@@H]4[C@@H]5C[C@@H]([C@@H]2[C@@H]53)[C@@H]41)c1ccc(S(=O)(=O)N2CCCC2)cc1	792805099	BQKWNQWZBGBPBX-NNZJSVBASA-N	441.553	1.626	50	20	IDGD	
Cn1ccc2ccc(NC(=O)C(=O)NNC(=O)c3cccc(C(F)(F)F)c3)cc2c1=O	793026849	UCBVNAYPNPDZEB-UHFFFAOYSA-N	432.358	1.957	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)cc1OC	796992580	STAZGTKUQJWAEX-UHFFFAOYSA-N	435.820	1.300	50	20	IDGD	
Cc1ccc(N2CCOCC2)cc1NC(=O)C(=O)NNC(=O)c1cc(Cl)ccc1O	797535248	JHZPBLKEXDFVBJ-UHFFFAOYSA-N	432.864	1.590	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN2C(=O)c3ccc(Cl)cc3S2(=O)=O)cc1C	800840538	QCLSYXYAFYIHCB-UHFFFAOYSA-N	441.918	1.878	50	20	IDGD	
O=C(COC(=O)c1cscc1Br)NNC(=O)[C@@H]1COc2ccccc2O1	803772251	DYDNFKMAKAQBJJ-ZDUSSCGKSA-N	441.259	1.655	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@](C)(O)C2CC2)c1	804146352	PZSSBURBXPZMKB-FQEVSTJZSA-N	433.486	1.418	50	20	IDGD	
Cc1cc(C(=O)NNc2ccc(-n3ccnc3)nn2)ccc1NS(=O)(=O)C(F)(F)F	804958688	IOVFLEIRGANGLS-UHFFFAOYSA-N	441.395	1.989	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(F)c2Cn2cccc(C)c2=O)o1	806978827	HTIYKUCHTMREGZ-UHFFFAOYSA-N	426.404	1.645	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)C(=O)Nc1cc(Cl)ccc1C(F)(F)F	807003883	BTNPRUYQDSHSFH-UHFFFAOYSA-N	432.742	1.468	50	20	IDGD	
CCN(CC)CC(=O)Nc1cccc(NC(=O)C(=O)NNc2nccnc2C(C)C)c1	807065020	AQZMASYKMTVWPT-UHFFFAOYSA-N	427.509	1.962	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNc2ncccc2F)c(C(=O)N2CCCCC2)cc1OC	807300303	ISGSFTQIIGLIRG-UHFFFAOYSA-N	445.451	1.946	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)C(=O)Nc1ccc([S@](=O)C(F)(F)F)cc1	807429570	VHTZMYLPKIYQGM-PMERELPUSA-N	439.379	1.372	50	20	IDGD	
CC(=O)c1cc(Br)ccc1OCC(=O)N([C@@H]1CCS(=O)(=O)C1)N(C)C	808025012	ZFVYQXQOJDJUER-CYBMUJFWSA-N	433.324	1.523	50	20	IDGD	
CCCS(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1	808066175	RFMXBGPVTPMFIP-UHFFFAOYSA-N	427.460	1.402	50	20	IDGD	
CCCS(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)COc2ccccc2CC)cc1	808069059	MRNNTKCMMRZJRC-UHFFFAOYSA-N	440.543	1.821	50	20	IDGD	
Cc1nc(-c2cccnc2)nc(NNC(=O)CNS(=O)(=O)c2c(C)noc2C)c1C	810421773	PKDIZOIQQZWJMT-UHFFFAOYSA-N	431.478	1.182	50	20	IDGD	
Cc1cnc(Br)c(NC(=O)C(=O)NNc2cccc(S(C)(=O)=O)c2)c1	812978621	WNKFEIHHWBJOGL-UHFFFAOYSA-N	427.280	1.638	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2cc(F)cc(F)c2F)c2ccccc2c1=O	815566144	JWYCWOOXGXNGLN-UHFFFAOYSA-N	433.346	1.233	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCc2nncn2C1)C(=O)Nc1ccc(Sc2ccncc2)cc1	815691223	JAUGGIBGGZFDRX-ZDUSSCGKSA-N	437.485	1.173	50	20	IDGD	
CCn1ncc2ccc(NC(=O)C(=O)NNc3ccccc3S(=O)(=O)N(C)C)cc21	815750652	GVPNLCWUWYYDBN-UHFFFAOYSA-N	430.490	1.388	50	20	IDGD	
C[C@@H]1CN(S(=O)(=O)c2cc(C(=O)NNc3ncncc3F)ccc2Cl)C[C@@H](C)O1	817067742	POYCPMVATMOBLN-GHMZBOCLSA-N	443.888	1.824	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)CCOc2ccc(C(N)=O)cc2)C1	819657277	BCRPDJHNYRGCQQ-HNNXBMFYSA-N	434.493	1.349	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(C)c(C(=O)NNC(=O)CNc2ccc(C)cc2)c1	825600735	QLTVDKHGNBCFSF-UHFFFAOYSA-N	434.518	1.101	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)[C@H](O)[C@H](O)c2nc3ccccc3s2)cc1	831306885	MKHAXLHXOSIOMD-PJSAGSTRSA-N	445.497	1.704	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)cc(Cl)c1OCC(N)=O	837298455	NQCXEXGDMPCTEY-UHFFFAOYSA-N	448.863	1.229	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)c2cn(-c3ccccc3C(F)(F)F)nn2)cc1	915188344	DXBRFBHQTPIPEY-UHFFFAOYSA-N	430.346	1.998	50	20	IDGD	
C[C@@H]1NC(C(=O)NNC(=O)c2cc3c(s2)CC[C@@H](C)C3)=NN(c2ccccc2)C1=O	915188929	ISOCSSXSEADEAU-OLZOCXBDSA-N	425.514	1.972	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1cnc2cc(C)ccn2c1=O	915547745	DIPITSPIRDVWTE-UHFFFAOYSA-N	444.831	1.283	50	20	IDGD	
COc1cc(C#N)ccc1OCCCC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	916124794	OAHMZAMYTDQWIH-UHFFFAOYSA-N	435.440	1.434	50	20	IDGD	
O=C(CNC(=O)c1c[nH]c2ccccc2c1=O)NNC(=O)c1cc(-c2ccccc2)[nH]n1	916145225	JBUACNYCRCCVDX-UHFFFAOYSA-N	430.424	1.109	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)NC1CCN(Cc2ccccn2)CC1	916382394	OAAYTZVFNILYEI-UHFFFAOYSA-N	435.488	1.582	50	20	IDGD	
O=C(COc1ccccc1Cc1ccccc1)NNC(=O)NCCNC(=O)c1cccnc1	916443846	VXGWZFZCRHHOFU-UHFFFAOYSA-N	447.495	1.812	50	20	IDGD	
O=C(NCC1(N2CCSCC2)CCCC1)NNC(=O)c1nnc(O)c2ccccc12	916616219	GEZDIKGDPVHQGE-UHFFFAOYSA-N	430.534	1.641	50	20	IDGD	
NC(=O)c1cn(CC(=O)NNC(=O)COc2ccc(Br)cc2)c2ccccc12	917388222	NUYHTKIOEKXNEB-UHFFFAOYSA-N	445.273	1.729	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)CCCS(=O)(=O)N2CCCC2)cc1OC	917392196	SPVUORBRRSCSBS-UHFFFAOYSA-N	427.523	1.451	50	20	IDGD	
COC(=O)[C@H](C)Sc1ccccc1C(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	917915289	JQAFUNOLPHCJEI-LBPRGKRZSA-N	440.481	1.662	50	20	IDGD	
O=C(NNC(=O)c1nc2ncc(Br)cn2n1)c1cc(-c2ccccc2)on1	919843442	SWIXTGPURHJFOF-UHFFFAOYSA-N	428.206	1.617	50	20	IDGD	
CC[C@H](C)c1ccccc1N1C[C@@H](C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)CC1=O	919883936	FGFCORDLTZEBRN-SOUVJXGZSA-N	436.534	1.071	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)c1cc(-c2ccccc2)nn1-c1ccccc1	920298063	IOJHYRBLYJUSPF-CQSZACIVSA-N	427.486	1.238	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)[C@H]1COc2ccccc2O1)c1ccc(N2CCOC2=O)cc1	920972476	WHIZYFPTECGLMY-SCLBCKFNSA-N	426.429	1.875	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)c1ccc2c(c1)CCCN2S(C)(=O)=O	921234508	GCBXYUUQRAUKIH-UHFFFAOYSA-N	447.513	1.638	50	20	IDGD	
Cn1cc(-c2cncc(C(=O)NNC(=O)C3CCN(C(=O)OC(C)(C)C)CC3)c2)cn1	1318566097	HSIAYJLULBUVJG-UHFFFAOYSA-N	428.493	1.890	50	20	IDGD	
C[S@@](=O)c1ccc(CNC(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1	1319077412	HOYBETVNPLUXJJ-SSEXGKCCSA-N	438.550	1.902	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Br)C2)c1cc(O)nc(O)c1	1777852168	GQSQTZKTQWVFKG-JDSLSITLSA-N	446.273	1.311	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3nn(C)c(C)c3Br)C2)C1	1780368307	IOARMIISXGUNPQ-YVEFUNNKSA-N	447.761	1.952	50	20	IDGD	
Cc1ccn(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](F)Br)C2)n1	1780770882	HYCYRVSGZRGOCP-UKPHBRMFSA-N	431.306	1.396	50	20	IDGD	
O=C(Cn1cnc2ccccc21)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781332767	FACXMTMGTVRRIN-FUHWJXTLSA-N	439.285	1.557	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CNC(=S)NCC)C1	1781470492	FBEOAZKTJOMAAR-SPYBWZPUSA-N	433.018	1.392	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cc4ccccn4n3)CCO2)C1	1783348043	SRLCIGKVZOOGGE-BEFAXECRSA-N	435.322	1.951	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccccc3C(N)=O)CCO2)C1	1783351559	BVNOIWFIGPAMMF-KXBFYZLASA-N	438.322	1.403	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(C)n(CC)n3)CCO2)C1	1783352762	SMLSKRCNHVYRKC-KDOFPFPSSA-N	427.343	1.828	50	20	IDGD	
Cc1nc(CC(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](C)Br)C3)C2)c(C)s1	1783532184	JUOSBULNACWRHU-GTNSWQLSSA-N	430.368	1.916	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)CC34CCCN3CCC4)CCO2)C1	1783538392	VEFNZXQKWYOLSJ-HNAYVOBHSA-N	428.371	1.618	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](CC)NC(C)=O)[C@H]2C1	1783582764	XZHPZSPLFJNTMN-RBZJEDDUSA-N	432.359	1.054	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)/C=C/c3cc(F)cc(OC)c3)C2)C1	1783695148	SJSBSHVWTMWPLE-CLJOXJKXSA-N	440.899	1.931	50	20	IDGD	
O=C(Cc1c(F)cccc1Cl)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21	1783810098	DKYFFZFUBPAPSC-BHADISHBSA-N	433.307	1.601	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cn4ccc(Cl)cc4n3)CCO2)C1	1783874061	CDZUMOANGBEXFE-IFXJQAMLSA-N	441.315	1.685	50	20	IDGD	
Cc1ccc(CCC(=O)N2CCO[C@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc1F	1783933693	VRXIUQFRYQOXOZ-QHCPKHFHSA-N	448.539	1.270	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@]1(F)CCCCC1(F)F)CCO2	1783934363	FPLDERKSGJWNPG-RBUKOAKNSA-N	448.486	1.107	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)N1CCO[C@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783951951	MCAZGYWLFRBDPE-GOSISDBHSA-N	438.352	1.925	50	20	IDGD	
COc1c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]3C2)ccc(F)c1F	1784092594	QNORQWNSXQUNSX-FATJJJSSSA-N	432.851	1.166	50	20	IDGD	
COc1cccc(CCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]3C2)n1	1788764868	BSRIQISEMSNTCZ-WDSOQIARSA-N	449.624	1.854	50	20	IDGD	
Cc1nc(CC(=O)NC2(c3ccc(NC(=O)c4cnccc4C(=O)NN)cc3)CCC2)no1	1789521356	ZNMLFXGVBWAAHN-UHFFFAOYSA-N	449.471	1.367	50	20	IDGD	
CCCc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]32)cc1	1789662559	LWZFBUDPWMMRHK-ACRUOGEOSA-N	444.576	1.605	50	20	IDGD	
O=C([C@H](F)Br)N1CC[C@H]2CO[C@@H](CNC(=O)C3(Br)CC3)[C@H]2C1	1789931149	ZCFRXZFQLOFELS-NAKRPEOUSA-N	442.123	1.584	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3n[nH]c(C)c3F)C[C@@H]21	1790961920	XTEWVQLZGRNMOQ-CYDGBPFRSA-N	431.306	1.624	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnn4cccnc34)C[C@@H]21	1791055611	AAIFAXYDCHVTKR-JURCDPSOSA-N	436.310	1.106	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3ccccc3OC)C[C@@H]21	1791249842	RTQNMWFJTNMHHS-GNBUJSLZSA-N	438.952	1.861	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/C3CCCCC3)C[C@@H]21	1791290965	UHEKVNIEDLJJKO-KOQZAGCLSA-N	434.581	1.476	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)CBr	1792872296	XGWOHZWHAVHETR-MJDLHHQISA-N	426.149	1.390	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCOCCOCCOC)C2	1793453145	SDGVESCHJAZARU-ZMMAXQRCSA-N	434.961	1.053	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnc[nH]1)C2	1794141386	XCMQIXKSMKRDAB-CRWXNKLISA-N	425.917	1.794	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)Cn1cccn1	1794210029	DJPGNZNUCNFINK-IBEHDNSVSA-N	427.343	1.282	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)[C@@H]1CNc2ccccc21	1795621198	VKAYATCLHUYPAI-VUBORPHZSA-N	426.286	1.476	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc2c[nH]nc12	1796181477	VCFLQVHWLKFFQW-XRGAULLZSA-N	435.322	1.940	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)c1ccc(-n2cccn2)cc1	1796189356	BXMYKRIJLDKWPA-QQFNCUIESA-N	444.300	1.118	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@]1(F)CCCCC1(F)F)C2	1796191469	PIVMRWCUAYQXAN-CLWJZODNSA-N	438.255	1.536	50	20	IDGD	
Cc1ncc(Br)cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Cl	1796362033	WYTANPNIJFAULK-DJBIQUGXSA-N	434.693	1.890	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1(F)CCCCC1)C2	1796441856	AQKBSTWDFIAQCG-MRRJVURZSA-N	447.511	1.382	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2nccnc2c1	1797055574	QTINGZPMNXUBSG-CWPLJXCYSA-N	428.565	1.685	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2)c1ccn(-c2ccccc2)n1	1798698010	YGMPCJFMFHIQGG-CCWDJLKJSA-N	447.333	1.861	50	20	IDGD	
CCc1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C3)no1	1798904919	ZNKZMYWKZBJSQJ-NGYDUSEUSA-N	426.477	1.623	50	20	IDGD	
C[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@](C)(Cl)CCl)n1ccccc1=O	1799277507	WKJOQAVTWVMXTG-MABMQTIPSA-N	430.332	1.235	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cc(F)cc(F)c1)C2)[C@@H](F)Br	1799346466	RFVTXAIPBXQKIJ-OXUXUCFPSA-N	435.240	1.787	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1c(C)n[nH]c1C	1800253723	HMDBAASSXQJEOS-CKFWPPNZSA-N	439.520	1.341	50	20	IDGD	
CCOc1ncccc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](Br)CC	1800637694	GCKWFABDBGUNSR-XRGAULLZSA-N	440.338	1.857	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1nnc(C)s1)C2	1800640340	SIFYJTBFYPCNQQ-OQMKEHIESA-N	445.383	1.542	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nc(Cl)ccc1F)C2	1800757396	FBZNLUPIDIAMJO-XHSYRHOGSA-N	434.693	1.861	50	20	IDGD	
Cc1c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](C)Br)cn2[nH]cnc(=O)c12	1801963792	QBJFMSBIJQIIBF-RVMXOQNASA-N	436.310	1.366	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2c[nH]c3nccc-3c2)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803138423	AGWKWRCLYOJCDX-RYQLBKOJSA-N	427.892	1.829	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)ncc1[N+](=O)[O-]	1803138882	HCIBOIGYDFOXGT-JLSDUUJJSA-N	447.879	1.613	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC2(CCN(C(=O)CCC(=O)NN(C)C)CC2)C1	1805389326	MHMNWNPDAMTIMF-HNNXBMFYSA-N	445.402	1.622	50	20	IDGD	
CC1(C)CC(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)C1	1807375779	VMPXZRJWNKWDQB-RXVVDRJESA-N	435.333	1.517	50	20	IDGD	
O=C(Cc1ccsc1)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1807559768	PNFSQNLNCZUSJF-DENIHFKCSA-N	449.341	1.385	50	20	IDGD	
O=C(Cn1nccn1)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@H]1c1cccnc1	1808959313	BYDXXMSYUKRSEZ-QEJZJMRPSA-N	425.262	1.070	50	20	IDGD	
Cc1noc(C)c1C(=O)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1	1809974876	DXGLXQKPKMPGJF-UHFFFAOYSA-N	425.294	1.130	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H](CNC(=O)C2=NNC(=O)C2)[C@@H]1c1cccnc1	1810221052	FUBCJLCVXSEZQV-MRAWALMUSA-N	426.304	1.200	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H](CNC(=O)c2c[nH]c(=O)cn2)[C@@H]1c1cccnc1	1811458032	FJTPXWTXYCRCJH-KEYYUXOJSA-N	448.321	1.658	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2cc(OC)n(C)n2)[C@H]1c1cccnc1	1811636772	ZSKULOXGCBQARC-RVKKMQEKSA-N	435.912	1.397	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)CCN2CCOC2=O)[C@H]1c1cccnc1	1813029952	CDRRTIDSBDANDD-BQFCYCMXSA-N	438.912	1.184	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2cnn3c2OCCC3)[C@@H]1c1cccnc1	1813034173	CWMYTHMVRTXQTB-BPQIPLTHSA-N	447.923	1.634	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2ccc(F)cc2)[C@H]1c1cccnc1	1813072137	BVEVATKJCKYXAM-GCJKJVERSA-N	441.507	1.913	50	20	IDGD	
C[C@H](C(=O)NC[C@@H]1CCN(C(=O)[C@@](C)(Cl)CCl)[C@@H]1c1cccnc1)n1cnnn1	1813473724	OGVKYSRLILKHIN-PXMRGAAZSA-N	440.335	1.571	50	20	IDGD	
Cc1ccc(CC(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)o1	1813509469	KOXTVCZACMMGRU-XXBNENTESA-N	447.300	1.225	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1cccs1)CC2)c1ccc(B(O)O)cc1	1815337490	UAFZIYMNZZAEFM-CYBMUJFWSA-N	427.316	1.424	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)[C@H](O)c1ccccc1	1817078814	KHHXCMJERBCSAQ-PZJWPPBQSA-N	448.288	1.129	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCN(C)C)n[nH]1	1817142269	IBKVVZNTFZGXBH-PTZPRWATSA-N	442.524	1.488	50	20	IDGD	
COc1cc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)CO[Si](C)(C)C)CC3)nn1C	1821770690	CJQCPZPKZRYHIQ-LLVKDONJSA-N	437.598	1.963	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CNC(=O)N(C)C)[nH]n1	1822185759	PTGOGCXHERDCMV-ZYHUDNBSSA-N	429.319	1.456	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CSc2nc[nH]n2)[nH]n1	1822374528	MQDFKLKVTQGKBR-ZYHUDNBSSA-N	427.918	1.566	50	20	IDGD	
C[C@@H]1C[C@]1(C)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnccc1C(=O)NN)CC2	1822650435	NINIETOQYVBRPF-HZNYWTHISA-N	428.518	1.414	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(O)cc3F)sc2C1	1823347156	IOGOLFBEPULBBE-LLVKDONJSA-N	449.508	1.587	50	20	IDGD	
Cc1cccc(CC(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)n1	1824282474	JMGXXZQGYMBLAA-HSZRJFAPSA-N	449.360	1.546	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)C#Cc2ccccc2)CC1	1826523162	KOGPAWVLUZPQFW-XMMPIXPASA-N	444.340	1.651	50	20	IDGD	
Nc1n[nH]c(CCC(=O)N2CCCC[C@@H]2C2CCN(C(=O)[C@H](F)Br)CC2)n1	1828805279	SKAKSAMPPYNZGL-DOMZBBRYSA-N	445.337	1.630	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2CCC=CO2)CC1	1828892138	FZSBFWCHZBIIGF-SFTDATJTSA-N	426.322	1.292	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccn4ccnc34)C2)C1	1830362337	REQZPQULUUGKBH-OAQYLSRUSA-N	434.924	1.669	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3c(C)nc4ncccn34)C2)C1	1831647058	OUYMBASNCZJBNH-HRAATJIYSA-N	449.939	1.515	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4c(c3)CNC4=O)C2)C1	1831649724	AXLZKQAAVOSNIO-AVRDEDQJSA-N	449.935	1.408	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)C(=O)OCC)C2)C1	1831659287	QGUODYRJIRLFGS-FOIQADDNSA-N	432.945	1.440	50	20	IDGD	
CC(F)(F)C(C)(C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1831683065	PRYAWTSSBLSYPQ-BZNIZROVSA-N	445.276	1.815	50	20	IDGD	
Cc1nn(C)c(C)c1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1	1831815400	JVFUQYXKZXIZSX-OALUTQOASA-N	447.363	1.343	50	20	IDGD	
O=C1C[C@@H](C(=O)N2CCCC[C@@H]2C2CCN(C(=O)CCBr)CC2)CCN1	1831936094	WBIFPHONGBXNHX-JKSUJKDBSA-N	428.371	1.917	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@H]2CCCOC2)CC1	1832870034	OWZQEGYKJNPDRJ-FXAWDEMLSA-N	443.548	1.345	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)c3ccco3)CC2)CC1	1833089765	JPZFGTQLUBDFGL-SJLPKXTDSA-N	427.929	1.138	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)C3CCC(F)(F)CC3)CC2)CC1)[C@@H](O)CCl	1833306496	UFZAEYHFIPUTKJ-KRWDZBQOSA-N	435.943	1.983	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)CCc3ccsc3)CC2)CC1)[C@H](O)CCl	1833310716	QGVZTJIBPJKQKT-GOSISDBHSA-N	427.998	1.852	50	20	IDGD	
CC(=O)NC(C)(C)C(=O)NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1	1833486701	WNNRGFDHYPSHHP-HNNXBMFYSA-N	449.365	1.163	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnc(N(C)C)o3)CCO2)C1	1833896169	QJSPWNQFGUCLPK-LIRRHRJNSA-N	428.917	1.218	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)Cc1cccc(F)c1)CCO2	1835023952	WDTDNVFYPPEJRA-OAQYLSRUSA-N	438.572	1.676	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)Cc3cnc[nH]3)CC2)CC1	1835064005	GWVXFIFQBOIMHW-CYBMUJFWSA-N	426.359	1.307	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)c1cnc2ccccc2n1	1835275117	NYVOYRILOHONHN-FQEVSTJZSA-N	445.951	1.415	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)C[C@H](N)c3cccnc3)CCO2)C1	1835824972	NDIWZALBMZUULT-LAUBAEHRSA-N	438.956	1.193	50	20	IDGD	
CCc1cc(C(=O)NC2CCN(C3CCN(C(=O)[C@H](Cl)COC)CC3)CC2)no1	1835984038	HSURQXCFKUOUJE-QGZVFWFLSA-N	426.945	1.676	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)Cc3ccc4ncnn4c3)CC2)CC1	1836341334	YQNXQMADIYUFAV-LJQANCHMSA-N	446.983	1.861	50	20	IDGD	
CN1CCC[C@H](C(=O)NC2CCN(C3CCN(C(=O)CO[Si](C)(C)C)CC3)CC2)C1	1836350201	BHOGLHMEWAHNHD-SFHVURJKSA-N	438.689	1.751	50	20	IDGD	
CC(C)=CCCC(=O)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1	1836378996	BJCJGOFIBVZLSF-UHFFFAOYSA-N	441.381	1.298	50	20	IDGD	
CC[C@H](Br)C(=O)NC1CCN(C2CCN(C(=O)[C@H]3C[C@@H](O)C3)CC2)CC1	1836541772	DLYTYTWHOMGCSR-XKQJLSEDSA-N	430.387	1.502	50	20	IDGD	
COC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)[C@@H](C)CBr)CC2)CC1	1836670156	BBTNBBDJDCAQKN-AWEZNQCLSA-N	447.370	1.969	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4n[nH]cc4c3)C2)C1	1837711333	DSCYEMIRLXOTLI-NRFANRHFSA-N	446.580	1.484	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)CO[Si](C)(C)C)CCO2	1837715505	UPOGSKNHJOYOFV-GOSISDBHSA-N	432.666	1.146	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3nc4ccccc4o3)C2)C1	1837715753	IHOKDIJRXLZVKV-NRFANRHFSA-N	447.564	1.749	50	20	IDGD	
CC/C=C(\C)C(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1	1838395490	XBOJMNIZUJHMPK-AYSLTRBKSA-N	443.548	1.654	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)cc1N(C)C	1839116002	QMVBMHKAXLBKEM-YLJYHZDGSA-N	443.903	1.366	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CC(c4ccccc4)=NO3)C2)C1	1839141790	SISNNWOEKHNREK-LQBOVUBWSA-N	449.935	1.653	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)/C=C/c3cnc[nH]3)C2)C1	1839154976	FBRUXLLKAQGDHW-QLVMYSCWSA-N	431.320	1.116	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(C)cc3F)CCO2)C1	1839260931	LKKKGQPMLGFTET-OXQOHEQNSA-N	428.888	1.458	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(C)c(O)c3)CCO2)C1	1839269174	GMKCRNTYWNHWOA-OXQOHEQNSA-N	426.897	1.024	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(F)ccc3Cl)CCO2)C1	1839327606	UBKFHGKSAQIKPK-APWZRJJASA-N	449.306	1.803	50	20	IDGD	
O=C(c1n[nH]c2cccc(F)c12)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1839599850	LUIIWZIVEXMFFB-SFHVURJKSA-N	445.278	1.576	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3csnc3C)C2)C1	1839962805	RGMXUVZBKGWUTM-PBHICJAKSA-N	446.367	1.695	50	20	IDGD	
CCc1oncc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](Br)CC)CCO2	1839963614	QFUBUSYVBCVIHL-RDTXWAMCSA-N	444.326	1.481	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccc(F)cc3F)CCO2)C1	1839980117	ZIRQWDHILLOUSS-OXQOHEQNSA-N	446.878	1.218	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C(C)C)on3)C2)C1	1840150417	KPPSMOCUUGAPEV-KUHUBIRLSA-N	429.901	1.122	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccc(Cl)cc3)C2)C1	1840151563	FWSMWWCXYXEIDT-XLIONFOSSA-N	445.343	1.593	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc4ccoc4c3)C2)C1	1840152329	FPJLTXDQLZGWCZ-QRWLVFNGSA-N	437.880	1.152	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4occc4c3)C2)C1	1840152565	MIUZFYVHEOMDSQ-UTKZUKDTSA-N	436.892	1.757	50	20	IDGD	
COc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)c(F)c1	1840189153	ADSBDVMCIMPXDE-GOSISDBHSA-N	435.279	1.708	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H]3C[C@@]3(F)Cl)CCO2)C1	1840246530	FSXVYSZZDLZQHD-DDWPSWQVSA-N	431.719	1.604	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)Cc1ccccc1)CCO2	1840301118	DDCKOMOEJLHVKQ-ZWCUEREDSA-N	438.952	1.575	50	20	IDGD	
COc1ccc(Cl)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)c1	1840653555	GHNLUYBWHJSHIS-YJBOKZPZSA-N	435.279	1.953	50	20	IDGD	
C[C@@]1(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)CC1(F)F	1840827978	JIWXESGZNATSLE-JYJNAYRXSA-N	429.291	1.724	50	20	IDGD	
Cc1c(C(=O)N2CC3(CCCN3C(=O)[C@H](C)CBr)C2)cn2[nH]cnc(=O)c12	1841288060	XDJDRHFJUKZGQL-LLVKDONJSA-N	436.310	1.179	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)N1CC2(CCCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C1	1841924893	MSOKABLQNJUNNV-HIFRSBDPSA-N	444.960	1.189	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2ccnc(Cl)c2)C1	1842446861	KKQQJCGLGRWMRC-ZMOGYAJESA-N	428.880	1.686	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)CCCn1ccnc1)C2	1843417149	BXTWCSYLUFITHX-LFVJCYFKSA-N	425.493	1.001	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2cnc(Cl)s2)C1	1844535860	RKTYXDTYHGPEAV-SSDVNMTOSA-N	434.909	1.748	50	20	IDGD	
CN(CC(=O)N1CCCC12CN(C(=O)CC(C)(C)C)C2)NC(=O)NCc1ccccc1	1845038596	WZQWFYGNMGJAJL-UHFFFAOYSA-N	429.565	1.972	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)[C@H](C)Cc2ccco2)C1	1846640270	RIWXSKCZPFTYIN-DSDXLYQOSA-N	425.489	1.796	50	20	IDGD	
N#C/C(=C\c1ccc(Br)cc1)C(=O)N1CC2(CCCN2C(=O)CNC(N)=O)C1	1847107881	WHFMEQYNVRVJPX-RIYZIHGNSA-N	446.305	1.228	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)n[nH]1)c1ccc(S(=O)(=O)N2CCCC2)cc1	3559974	HVXGCVGNJQROOU-UHFFFAOYSA-N	439.497	1.936	50	20	IDGD	
O=C(COC(=O)CCC(=O)N1CCC(c2ccccc2)=N1)NNC(=O)c1cccs1	10015959	NDIYOGWGBBDRTK-UHFFFAOYSA-N	428.470	1.469	50	20	IDGD	
O=C(Cn1c(-c2cccs2)n[nH]c1=S)NNC(=O)c1n[nH]c(=O)c2ccccc12	17195622	CXTFFBFWQVZOSR-UHFFFAOYSA-N	427.471	1.367	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2ccc3c(c2)oc(=O)n3C)ccc1OC(C)C	23015576	SPKLPBFBKQPZRQ-UHFFFAOYSA-N	435.458	1.551	50	20	IDGD	
CC(C)N(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(Br)c[nH]2)c1	24122829	JFGXHDUUPCIIMD-UHFFFAOYSA-N	443.323	1.881	50	20	IDGD	
C#CCNS(=O)(=O)c1ccc(C(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)cc1	26531666	VKJXNPCKSYADQK-INIZCTEOSA-N	429.498	1.443	50	20	IDGD	
O=C(NNC(=O)[C@H]1CC(=O)N(c2ccc3c(c2)OCCO3)C1)c1ccc2c(c1)OCO2	26962853	NDHUISVHJLCLOQ-ZDUSSCGKSA-N	425.397	1.001	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)CN2C(=O)c3ccccc3C2=O)cc1OC	28078446	RAFVUAKGZKCXHC-UHFFFAOYSA-N	425.441	1.931	50	20	IDGD	
O=C(Cc1cccc2ccccc12)NNC(=O)CN1C(=O)N[C@@]2(CCc3ccccc32)C1=O	29612415	CLHGIDMTKMELRQ-RUZDIDTESA-N	442.475	1.923	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)CN2C(=O)N[C@@]3(C[C@@H](C)CC(C)(C)C3)C2=O)c1	104669872	QCHMNGCZXGKSCP-OYHNWAKOSA-N	430.505	1.658	50	20	IDGD	
O=C(CCCCC/N=C1/NS(=O)(=O)c2ccccc21)NNC(=O)Cc1ccc(F)cc1	726242509	QAHSRDZEQUOVIV-UHFFFAOYSA-N	446.504	1.815	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1nn(-c2ccccc2)cc1O)c1ccc2c(c1)CC(=O)N2C	728311264	VASKKUYHRPHWOE-CYBMUJFWSA-N	434.456	1.802	50	20	IDGD	
CCc1c(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cnn1C(C)(C)C	728329213	KUIILNNCUGPWTL-QGZVFWFLSA-N	430.461	1.345	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)NC[C@H]2CN(CC(C)C)CCO2)c1	728741646	SSBGLADDEZAXCI-AWEZNQCLSA-N	443.342	1.759	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)C1CCN(S(=O)(=O)c2cc(F)ccc2F)CC1	728852739	SHILTQIXRXUERJ-UHFFFAOYSA-N	438.456	1.151	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1ccc(Cl)c(NC(=O)c2cccs2)c1	729275996	UVJHFGYWNBZCCW-VIFPVBQESA-N	444.922	1.353	50	20	IDGD	
COc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NNC(=O)Cn2ccc3ccccc32)cc1	729448067	AEDJJNKBLJPPDN-AWEZNQCLSA-N	430.486	1.164	50	20	IDGD	
COCCN(Cc1ccc(F)cc1Cl)C(=O)NNC(=O)CNC(=O)c1ccco1	730580599	NBOFUFINBQIUCH-UHFFFAOYSA-N	426.832	1.691	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)[C@H]1CCN(c2ccc3c(c2)OCCO3)C1=O	730591007	BQSVXUUMCMQJEA-MRXNPFEDSA-N	425.441	1.297	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)c1ccc(F)c(S(=O)(=O)N2CCCC2)c1	730778414	OAFQIKHMFVKHJP-UHFFFAOYSA-N	437.449	1.156	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2C[C@H](C)O[C@H](C)C2)c1	731491211	FKQYGPJZVVQNES-GASCZTMLSA-N	447.513	1.568	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)N1CCN(C(=O)c2ccc(Br)cc2)CC1	732198818	GGUPQJWPDAWXHN-CQSZACIVSA-N	439.354	1.789	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)c2cnc(-c3ccc4c(c3)OCO4)s2)C[C@@H](C)O1	732264914	YADWWCITMATHIX-CHWSQXEVSA-N	432.502	1.799	50	20	IDGD	
COc1ccc(-n2c(C)cc(/C=C(\C#N)C(=O)N3CC[C@H](S(N)(=O)=O)C3)c2C)cc1	732664236	LLQNTAJHJRWCHW-KDMTZKAISA-N	428.514	1.899	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCC[C@H](CNC(=O)C(C)(C)C)C2)cc1OC	732989711	UFWIWUATVRCFBW-OAHLLOKOSA-N	434.537	1.339	50	20	IDGD	
CCc1cc(NNC(=O)C2=NN(c3ccc(F)cc3)[C@@H](C(N)=O)C2)nc(-c2ccccn2)n1	734356754	JQHXCOSRLDXRAY-GOSISDBHSA-N	448.462	1.803	50	20	IDGD	
COc1ccc(CN2CC[C@@H](NC(=O)NNC(=O)c3cc4c(s3)CCC4)C2=O)cc1	734545282	WFYCOFJJIUCUIP-MRXNPFEDSA-N	428.514	1.991	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)NCc2cc(S(N)(=O)=O)ccc2F)c1C	734551407	WKDWIPHOEQSVCC-SXGWCWSVSA-N	434.493	1.761	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)N[C@@H](CCN(C)C)C(C)(C)C	734854818	MEFGOKVLMQLEIW-AWEZNQCLSA-N	426.587	1.599	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NC[C@H](O)C1CCOCC1	736650547	WLBXEANXTWNTNX-ABAIWWIYSA-N	430.299	1.334	50	20	IDGD	
C[C@H](CCC(C)(C)C)NC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	737062021	YASTVYAQGBKACP-OAHLLOKOSA-N	426.587	1.859	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@@H](C)Cc2ccc(C)s2)cc1	739045409	LWSXQLOLWSFQCV-AWEZNQCLSA-N	438.575	1.947	50	20	IDGD	
CN1CCN(C(=O)/C(C#N)=C\c2cn(CCC(N)=O)nc2-c2ccc(Cl)cc2)CC1=O	740836255	CUNNCLWIGNGPPK-GDNBJRDFSA-N	440.891	1.286	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)CSc1nnc(-c2cccs2)n1C1CC1	740850907	FIHOJXBMRQVFEC-UHFFFAOYSA-N	436.563	1.886	50	20	IDGD	
Cc1ccc(C=NNC(=O)C[C@@H](C(=O)NN=Cc2ccc(C)cc2)N2CCOCC2)cc1	741766902	QAEOMQFJNIERHS-QFIPXVFZSA-N	435.528	1.995	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)N[C@H](C)COCC(F)(F)F)c2ccccc2c1=O	743342031	ZOKMXRJXNWRTGD-LLVKDONJSA-N	429.399	1.889	50	20	IDGD	
CCS(=O)(=O)N1CCC(C(=O)NNc2ncnc3[nH]cnc23)(c2ccccc2)CC1	743469812	VTODDUUNXDJXJM-UHFFFAOYSA-N	429.506	1.180	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)ccc1O)c1ccc(CN2C(=O)CCC2=O)cc1	743732480	XIXSXTJXXLYVAM-UHFFFAOYSA-N	446.257	1.879	50	20	IDGD	
COc1ccccc1N1C[C@H](C(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)CC1=O	743830034	KZCJFMALCNMBCQ-CYBMUJFWSA-N	446.485	1.305	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)Cc2ccc(-n3cnnn3)cc2)cc1Cl	743834380	CLAUNRWRSCQQER-UHFFFAOYSA-N	431.840	1.728	50	20	IDGD	
Cc1nn(-c2ccccc2)c(C)c1CC(=O)OCC(=O)NNC(=O)c1cccc(C#N)c1	744588769	GLBHMYJEXJGTCM-UHFFFAOYSA-N	431.452	1.908	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)Cc2cc(Cl)c3c(c2)OCCO3)c1	744610971	KFZVYORKKGFNOA-UHFFFAOYSA-N	429.816	1.530	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)N[C@@H]2CCN(Cc3ccccc3)C2=O)cc1	744878513	ZCHMUIRNKMLRLB-OXJNMPFZSA-N	440.500	1.984	50	20	IDGD	
C[C@H](CCc1cccn1C)NC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	745874848	FXYVISAXCKNUCC-MRXNPFEDSA-N	447.561	1.775	50	20	IDGD	
Cc1cccc(O[C@@H](C)CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1	745875759	IWHKNHPGTLUOJV-HNNXBMFYSA-N	434.518	1.657	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNC(=O)N[C@@H]2C[C@@H](C)N(c3cnn(C)c3)C2=O)cc1	745916133	AYVCMDDUSYYQEB-DNVCBOLYSA-N	442.520	1.983	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)CCC(=O)N2CC(=O)Nc3ccccc32)o1	746397311	NZQIRFAOCQPPRP-UHFFFAOYSA-N	441.488	1.648	50	20	IDGD	
CCC(C)(C)C1CCC2(CC1)NC(=O)N(CC(=O)NNC(=O)Cc1ccncc1)C2=O	747320624	YCNKWCXYGQENGR-UHFFFAOYSA-N	429.521	1.689	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCC(C)(C)S(C)(=O)=O	748967485	OKLMPYWGNQOLDQ-SNVBAGLBSA-N	436.328	1.370	50	20	IDGD	
Cc1c(/C=C(\C#N)C(=O)NCC(=O)N2CCN(Cc3ccccc3)CC2)cc(C#N)n1C	749617659	REHYWSSZLYIJAH-CIAFOILYSA-N	430.512	1.573	50	20	IDGD	
O=C(CNC(=O)c1cc(-c2ccccc2)on1)NNC(=O)c1cc(-c2ccccc2)[nH]n1	749718762	GXANKWBSJRVVJS-UHFFFAOYSA-N	430.424	1.923	50	20	IDGD	
C[C@H](CN1CCOCC1)C(=O)NN=C1C(=O)Nc2c(I)cccc21	750935373	RADJDCBAIXFVKW-SNVBAGLBSA-N	442.257	1.032	50	20	IDGD	
COc1ccc(N2CCN(CC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)CC2)cc1F	753861116	MKUARBVBZBWFRY-UHFFFAOYSA-N	431.424	1.326	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCN(C/C=C\c3ccccc3)CC2)cc1OC	755025458	XQRYBXXVVAZXTR-TWGQIWQCSA-N	438.528	1.796	50	20	IDGD	
COc1ccccc1[C@@]1(C)NC(=O)N(CC(=O)NNc2ccc(C(F)(F)F)nn2)C1=O	755187881	SVBDJSNMESRGGF-QGZVFWFLSA-N	438.366	1.414	50	20	IDGD	
COc1ccc(S(=O)(=O)NC2CC2)cc1NC(=O)NNC(=O)CCc1ccccc1	755614779	SKITYVMROUCRGC-UHFFFAOYSA-N	432.502	1.921	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)Nc1cccc(C(=O)N2CCOCC2)c1	755928156	ZTIYUFHEFKWTKY-UHFFFAOYSA-N	443.416	1.299	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)N[C@@H]1CN(C)Cc2ccccc21	757004407	VJXOGNBZHFRXGY-MRXNPFEDSA-N	430.534	1.419	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)Nc1cc(Br)c(F)cc1Cl	757595159	ASVLVRFWKFSAGM-ZCFIWIBFSA-N	428.667	1.829	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)CC1(C)CC1)N(S(C)(=O)=O)CC2	757782105	VXSRBEQWJYYTLF-HNNXBMFYSA-N	439.534	1.290	50	20	IDGD	
CN(NC(=O)[C@@H]1Cc2ccccc2C(=O)O1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758781377	AAAULEPAIZNQFE-INIZCTEOSA-N	432.477	1.404	50	20	IDGD	
Cc1sc(=O)n(CCC(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)c1C	758786024	IQUQBPDONNTBTD-UHFFFAOYSA-N	441.554	1.552	50	20	IDGD	
COCCS(=O)(=O)c1ccc(CNC(=O)NNC(=O)COc2ccc(C)c(C)c2)cc1	759396234	IJQRSVQACLBABX-UHFFFAOYSA-N	449.529	1.633	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)NC[C@@]1(Cc2ccc(F)cc2)CCC[C@@H]1O	759672035	NFGPVCBOFPPZJY-UWJYYQICSA-N	432.452	1.253	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCC(OC[C@@H]2CCOC2)CC1	761114984	ZBSMVVHZGLPZHZ-CQSZACIVSA-N	425.913	1.627	50	20	IDGD	
C[C@H](C(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1)c1cccc(C(=O)c2ccccc2)c1	761431877	VHSPDDJTZLDMGJ-KBXCAEBGSA-N	429.498	1.539	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1cccc([C@@H]2CCOC2)c1	761815068	VYEQMEAVIGALKO-GOSISDBHSA-N	431.514	1.968	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccncc2)cc1NC(=O)CN1CCCCC1	763461762	CNHFAXHBPPJJLQ-UHFFFAOYSA-N	438.488	1.214	50	20	IDGD	
Cc1cccc(NC(=O)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c1C(=O)N1CCCC1	763471869	OHCUREDVZHHRRD-UHFFFAOYSA-N	439.428	1.539	50	20	IDGD	
O=C1CCc2cc(NC(=O)C(=O)NNC(=O)c3ccccc3Br)ccc2N1	763483615	SQSOFGYFDGFDJR-UHFFFAOYSA-N	431.246	1.734	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)NNC(=O)c1cccc(OC(F)F)c1	763499481	SEEUFCHSYMPKJC-UHFFFAOYSA-N	426.401	1.761	50	20	IDGD	
COc1cc(F)c(NC(=O)C(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)cc1F	763538316	ACBYWGUHPOIUKO-UHFFFAOYSA-N	439.371	1.399	50	20	IDGD	
CCOCCOCc1cccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)c1C	763550701	FUATXUWFBVQNNZ-UHFFFAOYSA-N	443.456	1.677	50	20	IDGD	
COCCCS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2F)cc1	763555235	BTBRQYSBPXBTIX-UHFFFAOYSA-N	437.449	1.036	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)Nc1ccc(OC[C@H]2CCCO2)cc1	763569827	CHPJNQFIRUBICG-APWZRJJASA-N	441.440	1.170	50	20	IDGD	
Cc1ccc(-n2nc(NC(=O)C(=O)NNC(=O)[C@@H]3COc4ccccc4O3)cc2C)cc1	763576450	AQACYCASFLFPAC-SFHVURJKSA-N	435.440	1.415	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)C(=O)Nc2ccc(C(N)=O)c(C)c2)c1	763597539	OXSLQZGAXBMINM-UHFFFAOYSA-N	426.473	1.691	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(C(=O)NC)ccc1Cl	763680948	IKWGTEQAYWOEEM-UHFFFAOYSA-N	448.863	1.263	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccn(CC(F)(F)F)n1	763682739	VMOXODOSUCTDNL-UHFFFAOYSA-N	429.355	1.009	50	20	IDGD	
COCCn1ncc2ccc(NC(=O)C(=O)NNC(=O)COc3ccc(Cl)cc3)cc21	763687013	YNMDMCGNFUHLPK-UHFFFAOYSA-N	445.863	1.501	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)C(=O)Nc1cccc2c1OCO2	763695368	SMPQXFWFLORLEE-UHFFFAOYSA-N	436.218	1.343	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(S(=O)(=O)CC)cc1	763713132	VESVUQSOKIUGLS-UHFFFAOYSA-N	433.486	1.208	50	20	IDGD	
O=C(CC12CC3CC(CC(C3)C1)C2)NNC(=O)C(=O)Nc1cccnc1N1CCOCC1	763736984	VRRFDTWQGXZQCB-UHFFFAOYSA-N	441.532	1.611	50	20	IDGD	
CS(=O)(=O)c1c(F)cc(NC(=O)C(=O)NNC(=O)c2cccc(Cl)c2)cc1F	763748074	WCDYKSRJJPUZND-UHFFFAOYSA-N	431.804	1.421	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(CCN(C)C)cc2)c1C	763851465	CVWSRPRDWPIJQG-KRWDZBQOSA-N	426.517	1.961	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNC(=O)CC(C)C)cc1S(=O)(=O)N1CCCC1	763881608	HVRPHJWMGWOKKR-UHFFFAOYSA-N	440.522	1.002	50	20	IDGD	
O=C(CCSc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccc(Cn2cncn2)cc1	763895358	OJIFPGNFQISLQC-UHFFFAOYSA-N	442.476	1.734	50	20	IDGD	
CO[C@@H](C)C(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)Cc2ccc(Cl)cc2)c1	763931241	DVOYPPQJJQBQEH-LBPRGKRZSA-N	432.864	1.642	50	20	IDGD	
CN(Cc1cccc(NC(=O)C(=O)NNC(=O)c2cccn2C)c1)Cc1cscn1	763996300	OSIKHIUNFJUMLH-UHFFFAOYSA-N	426.502	1.513	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1ccc(-n2cccn2)c(Cl)c1	764003159	AKJATLAFXJLOHR-UHFFFAOYSA-N	441.831	1.697	50	20	IDGD	
Cc1cn(C2CCCCC2)nc1NC(=O)C(=O)NNC(=O)c1ccc2c(c1)OCCO2	764003685	HDWJKYXXZPSFBW-UHFFFAOYSA-N	427.461	1.868	50	20	IDGD	
COc1cccc(C[C@H](C(=O)NNC(=O)CSc2ccccc2O)n2nnnc2C)c1	764045953	VKMQARXOQWZFCR-MRXNPFEDSA-N	442.501	1.419	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc(C)c(C(=O)N(C)C)c3)n[nH]2)cc1	764111891	SDJJHYOPPZXCQL-UHFFFAOYSA-N	448.483	1.795	50	20	IDGD	
CCn1nnnc1-c1cccc(NC(=O)C(=O)NNC(=O)c2cccc3cccnc23)c1	764147573	DLPKPQRNXHPPCF-UHFFFAOYSA-N	430.428	1.308	50	20	IDGD	
O=C(NNC(=O)c1ccoc1)C(=O)Nc1ccc(I)cc1Cl	764160303	SIHBSSDGVZMNIM-UHFFFAOYSA-N	433.589	1.937	50	20	IDGD	
C[C@H]1CN(C(=O)c2ccc(NC(=O)C(=O)NNC(=O)c3ccc(C#N)cc3)cc2)C[C@@H](C)O1	764177516	QGMZYKYTCZKOOQ-GASCZTMLSA-N	449.467	1.207	50	20	IDGD	
O=C(CCc1ccccc1)NNC(=O)C(=O)Nc1cccn(Cc2ccc(F)cc2)c1=O	764193916	WSFQFWFVAZWVKU-UHFFFAOYSA-N	436.443	1.754	50	20	IDGD	
COC(=O)c1cc(F)c(F)cc1NC(=O)C(=O)NNC(=O)Cn1ccc2ccccc21	764243318	SMWQAXOXKOEKCD-UHFFFAOYSA-N	430.367	1.492	50	20	IDGD	
CN(C1CCCCC1)S(=O)(=O)c1ccccc1NC(=O)C(=O)NNC(=O)C1CCC1	764338822	LYOINQNFVRQNEQ-UHFFFAOYSA-N	436.534	1.526	50	20	IDGD	
CC(=O)Nc1ccc(C)c(NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)c1	764381807	AAWOMFYNWAMMEY-UHFFFAOYSA-N	426.458	1.805	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccccc3C(=O)N(C)C)n[nH]2)cc1	764385337	YDHPGOMDWJUGNJ-UHFFFAOYSA-N	448.483	1.741	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)C(=O)Nc1cccc(CN2C[C@H](C)O[C@@H](C)C2)c1	764389740	WPMPMSKKYDLLMO-HOTGVXAUSA-N	425.489	1.399	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1c(F)cccc1-n1cccn1	764397671	LSQKGOMDXYOUAU-UHFFFAOYSA-N	443.460	1.898	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)C(=O)Nc1ccc2c(c1)NC(=O)CS2	764404842	ONUSEXVOWAGMQC-UHFFFAOYSA-N	432.483	1.315	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3ccc4c(c3)OCCCO4)CC2)cc1	765749706	QVAMZMHHLAOJOF-UHFFFAOYSA-N	438.528	1.735	50	20	IDGD	
Cc1ccc(-c2n[nH]c(SCC(=O)OCC(=O)NNC(=O)c3ccccc3)n2)cc1	767421985	HDYGSAJTQGWMOZ-UHFFFAOYSA-N	425.470	1.877	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1cccc(-c2nc[nH]n2)c1	767640121	ADQPWOMLJZARBI-UHFFFAOYSA-N	428.474	1.250	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1cccc(C#N)c1)C(=O)NNC(=O)c1cc(-c2cccs2)[nH]n1	768260355	KRVRZCVWZUCLOZ-LLVKDONJSA-N	444.498	1.138	50	20	IDGD	
O=C(COC(=O)c1csc(-c2ncccc2F)n1)NNC(=O)c1cccc([N+](=O)[O-])c1	768663779	NYFAGVCZLZGPRO-UHFFFAOYSA-N	445.388	1.870	50	20	IDGD	
Cn1cnc(CNC(=O)/C(C#N)=C/c2cn(CCC(N)=O)nc2-c2ccc(Cl)cc2)n1	769122915	UFNGYWBXWXGROV-RIYZIHGNSA-N	438.879	1.431	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cccc(OC)c2[N+](=O)[O-])cc1OC	769600651	FUSZARQAYUAQLW-UHFFFAOYSA-N	433.373	1.239	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)[C@H]2CC(=O)N(c3c(F)cccc3F)C2)nc2ccccc21	770579353	RVOQXMHWTXZPQD-LBPRGKRZSA-N	427.411	1.595	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)CS(=O)(=O)Cc3ccc(C#N)cc3)nc21	770964720	DVOMIFAMTFASKT-UHFFFAOYSA-N	443.489	1.217	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1cccs1)C(=O)NNc1c(F)cc(C(=O)NC2CC2)cc1F	771047760	OSGACLOQGKFARQ-SECBINFHSA-N	444.485	1.729	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)CNC(=O)c1cccc(Br)c1	771941730	ATHGQVGLVIBVFE-LLVKDONJSA-N	428.283	1.304	50	20	IDGD	
COc1ccc([C@@H](OC)[C@@H](C)NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1	771966279	WVRYPFYAOPGECS-BEFAXECRSA-N	442.520	1.808	50	20	IDGD	
CCc1nc(C(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)nn1-c1ccccc1	772188682	RERXFWHFUKHPQY-UHFFFAOYSA-N	426.864	1.561	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNc2cccc(C#N)c2)ccc1S(=O)(=O)N1CCCC1	773689041	MCIAIYRYQNITQO-UHFFFAOYSA-N	443.485	1.433	50	20	IDGD	
CN(CCCc1cc(-c2ccc(F)cc2)n[nH]1)C(=O)NNC(=O)CNC(=O)c1ccco1	774705841	YSPRYQDHUWDLHF-UHFFFAOYSA-N	442.451	1.844	50	20	IDGD	
COc1ccc(C(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)nc1Cl	776202091	QGXJHRYCJQPING-UHFFFAOYSA-N	427.889	1.993	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)COC2CCN(C(=O)OC(C)(C)C)CC2)cc1	777101497	WDECBGYVEZDTNO-UHFFFAOYSA-N	436.509	1.671	50	20	IDGD	
COc1cc(CCC(=O)N2CCN(S(=O)(=O)CBr)CC2)cc(OC)c1	777776994	BMBRUJCWNLXCOU-UHFFFAOYSA-N	435.340	1.463	50	20	IDGD	
Cc1cc(C)cc(C(=O)N2CCC[C@H](C(=O)NNC(=O)CNC(=O)OC(C)(C)C)C2)c1	778436468	KZHOLCNKBJTPIG-INIZCTEOSA-N	432.521	1.828	50	20	IDGD	
COc1ccc(Cn2nccc2NC(=O)NNC(=O)c2cccn2C)c(OC)c1OC	779462864	YDFCATHNXUVRSN-UHFFFAOYSA-N	428.449	1.762	50	20	IDGD	
COC[C@@H](CNC(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12)OC	781387795	NZPRHXQXGKBTDV-MRXNPFEDSA-N	439.472	1.050	50	20	IDGD	
Cc1noc(C2(C)CCN(C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)CC2)n1	781419768	REVACSXTMOWCAO-UHFFFAOYSA-N	428.497	1.179	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Cc2cccc(N3CCCC3=O)c2)cc(OC)c1OC	781841934	LBLPMKPYMQUSDE-UHFFFAOYSA-N	427.457	1.843	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)[C@H]1C[C@]12CCN(C(=O)OC(C)(C)C)C2	781969187	CZELMDGEKZNLIX-XCLFUZPHSA-N	426.514	1.696	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)c1cccc(NS(=O)(=O)C(F)(F)F)c1	782851960	ZCJYSWDRTSYOEN-UHFFFAOYSA-N	446.407	1.830	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2Cl)cn1	782926252	FMOPXJWLNCSIRW-UHFFFAOYSA-N	427.244	1.813	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2cnn(-c3ccccc3S(C)(=O)=O)c2)cc1	783039010	BEUDHVIHAXCWQR-UHFFFAOYSA-N	429.458	1.366	50	20	IDGD	
CNC(=O)[C@H]1CN(C(=O)C(=O)NNc2ccc(Cl)cc2[N+](=O)[O-])c2ccccc2O1	783291168	LIMHFGWYEVZCRY-OAHLLOKOSA-N	433.808	1.232	50	20	IDGD	
CCc1cccc(Oc2ccc(NC(=O)C(=O)NN[C@]3(C)CCS(=O)(=O)C3)cn2)c1	783425413	HWPKSJHYLKRENO-HXUWFJFHSA-N	432.502	1.573	50	20	IDGD	
Cc1ccc(C(=O)NCC(F)(F)F)cc1NC(=O)C(=O)NNc1nccnc1Cl	784776242	HDTMRFXRGWKXJX-UHFFFAOYSA-N	430.774	1.812	50	20	IDGD	
CNC(=O)c1cccc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)NC(C)(C)C)c1	784833914	SJTMHFCPABLXNR-UHFFFAOYSA-N	447.517	1.205	50	20	IDGD	
COC(=O)c1cc(Cl)ccc1NC(=O)C(=O)NNc1cccc(S(C)(=O)=O)c1	784839717	OYAOGOLWQQHBKG-UHFFFAOYSA-N	425.850	1.612	50	20	IDGD	
COCCOc1ccc(C#N)cc1NC(=O)C(=O)NNc1cccc(S(C)(=O)=O)c1	784843648	BKEQNWJMKHCKHP-UHFFFAOYSA-N	432.458	1.069	50	20	IDGD	
CCNC(=O)N(C)NC(=O)C(=O)Nc1ccc(N2CCC(OC)CC2)c(C(F)(F)F)c1	784917041	GQAVWUTYEGTGLJ-UHFFFAOYSA-N	445.442	1.952	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)Nc1ccc(Cl)cc1OC(F)F	785022922	BLIKHMIFJPUJLJ-UHFFFAOYSA-N	444.734	1.955	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)C(=O)Nc1c2c(nn1-c1ccccc1)CCC2	785068202	VZKCQCQYYICTTG-UHFFFAOYSA-N	443.467	1.337	50	20	IDGD	
CCc1noc(-c2ccc(C)c(NC(=O)C(=O)NNC(=O)Cc3cn4ccccc4n3)c2)n1	785068652	ZCHJXHDFUXVFAT-UHFFFAOYSA-N	447.455	1.584	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NC[C@@H](c2ccnn2C)C(C)C)nc1	788321310	VMUYSZXYWUPNIE-MRXNPFEDSA-N	437.570	1.912	50	20	IDGD	
COc1ccc(F)c(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)c1OC	788512806	SXGZPRNLLATYQN-UHFFFAOYSA-N	439.465	1.621	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)c(OC(F)F)c1	789735343	NNYWBJRAUCLJBY-UHFFFAOYSA-N	442.444	1.973	50	20	IDGD	
Cc1ccc(C)c(N2C(=O)c3ccc(C(=O)NNC(=O)CN4CCCC4=O)cc3C2=O)c1	789857432	SHZAACBFKNTZIM-UHFFFAOYSA-N	434.452	1.487	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)[C@@H](CCS(C)(=O)=O)c1ccccc1	789868937	MLSQWWVDSSJSGD-KRWDZBQOSA-N	442.541	1.965	50	20	IDGD	
CN(C)N(C(=O)CCNS(=O)(=O)c1ccc2ccccc2c1)[C@H]1CCS(=O)(=O)C1	792855085	OGMBBXKGKCIUJQ-KRWDZBQOSA-N	439.559	1.001	50	20	IDGD	
CCCNC(=O)[C@@H]1CN(C(=O)C(=O)NNc2ccc3c(=O)[nH]ccc3c2)c2ccccc2O1	793069829	JZSFFBQYRBVGQN-IBGZPJMESA-N	449.467	1.292	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)/C=C/c1ccccc1)C(=O)NNC(=O)c1cccc(C)n1	794081026	YTJAUZZDDWSPAA-QIXNEVBVSA-N	448.570	1.863	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)CNS(=O)(=O)c1c(F)cccc1F	794706968	QVHSRAIAMUGYML-UHFFFAOYSA-N	433.820	1.366	50	20	IDGD	
COc1cccc(C2(C(=O)NNC(=O)CN(C)S(=O)(=O)c3ccc(C)cc3)CC2)c1	794767559	QMGXFQRZQFPFQV-UHFFFAOYSA-N	431.514	1.503	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CCc2c(C)nc3c4cccnc4nn3c2C)cc1	794806472	MCOZGTDRBSOXPH-UHFFFAOYSA-N	445.483	1.921	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN[C@@H]2[C@@H](C)CCN(C(=O)OC(C)(C)C)[C@@H]2C)n1	796649851	IQBLEQMDFYDCKF-WPKBUWHJSA-N	439.582	1.765	50	20	IDGD	
CCNc1ccc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1[N+](=O)[O-]	797668494	CIRGIJMVORLULH-KRWDZBQOSA-N	444.400	1.171	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)Nc2ccc(OCC(=O)NC)cc2C)cc1OC	797679318	KVOXGAODMXAHBK-UHFFFAOYSA-N	430.461	1.994	50	20	IDGD	
CCCn1c(C)cc(/C=C(/C#N)C(=O)N(CCN2CCN(C)CC2)CC(=O)OC)c1C	798552727	LRGZSMJQZYZXQH-QNGOZBTKSA-N	429.565	1.671	50	20	IDGD	
CCn1ncc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)c1C(F)(F)F	799258667	FNWPUYGOMSRADL-UHFFFAOYSA-N	431.396	1.506	50	20	IDGD	
Cc1c(NNC(=O)NCCNS(=O)(=O)c2ccc(F)cc2F)cccc1[N+](=O)[O-]	799675182	GTFKKTUUNIDHPR-UHFFFAOYSA-N	429.405	1.786	50	20	IDGD	
Cc1c(C(=O)NNC(=O)Cn2cnc3ccccc32)nnn1CCOc1ccc(F)cc1	800316202	VQCVJVHOVIEQHE-UHFFFAOYSA-N	437.435	1.616	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NC[C@H]2CC(c3ccc(C)cc3)=NO2)c2ccccc2c1=O	800751251	VCVDXMSFQIIYOW-MRXNPFEDSA-N	448.483	1.862	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1c(C)nn(C)c1Br	801104151	DZDGEIAFJQXBSD-UHFFFAOYSA-N	443.327	1.167	50	20	IDGD	
CN(C)C(=O)COc1ccccc1C(F)(F)C(=O)NNc1ccc(-n2ccnc2)nn1	804957300	SHHVBHOOCCVAJI-UHFFFAOYSA-N	431.403	1.364	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)[C@H]1CCN(c2ccc(C#N)cc2F)C1	805588606	SRFNZIAZWNWPDJ-SFHVURJKSA-N	438.459	1.765	50	20	IDGD	
CC(C)Cn1ncc(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1C1CC1	806972493	BGGXCCKLRIYROH-KRWDZBQOSA-N	427.461	1.342	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)Nc1nc(-c2ccc(F)cc2)cs1	806973192	DAJPRKOTGZQGIJ-INIZCTEOSA-N	442.428	1.875	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)C(=O)Nc1cccc2c1CNC2=O	806975055	LXMLIRCMFCVQBA-CYBMUJFWSA-N	432.436	1.637	50	20	IDGD	
CCOC(=O)C(C)(C)c1csc(NC(=O)C(=O)NNC(=O)c2ccc(C)c(F)c2)n1	806987093	POSCZGOBFQAZRE-UHFFFAOYSA-N	436.465	1.831	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)[C@@H](NC(=O)c2ccccc2)c2ccccc2)c1	807116286	KEPBOANMNVCIGM-FQEVSTJZSA-N	431.452	1.972	50	20	IDGD	
COCCS(=O)(=O)c1ccc(CNC(=O)NNc2ccc3c(=O)[nH]ccc3c2)cc1	807177860	FXLBSXRQCIEOQE-UHFFFAOYSA-N	430.486	1.775	50	20	IDGD	
Cc1ccc(Br)c(S(=O)(=O)NCCNC(=O)NNC(=O)CC(C)C)c1	807563423	JJSOUUUCWIYQEG-UHFFFAOYSA-N	435.344	1.412	50	20	IDGD	
CC(C)CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)NNc1nc(O)c2cnn(C(C)(C)C)c2n1	810382567	QJFJYJCXZHVOEN-CQSZACIVSA-N	443.512	1.227	50	20	IDGD	
C/C(=C/c1ccc(C)cc1)C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	810414387	RWKLNTLTKPLSKZ-ICFOKQHNSA-N	429.546	1.873	50	20	IDGD	
CC(C)c1nccnc1NNC(=O)CNS(=O)(=O)c1ccc(Br)cc1	811462497	QRJLCLATTVBBHU-UHFFFAOYSA-N	428.312	1.784	50	20	IDGD	
O=C(NNS(=O)(=O)CCCN1C(=O)c2ccccc2C1=O)c1cc2c(s1)CCC2	811678108	RSQJVJDYAFYFHA-UHFFFAOYSA-N	433.511	1.487	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)[C@]1(C(F)(F)F)CCN(C(=O)OC(C)(C)C)C1	813461922	OGDXXLDEHJEAHS-KRWDZBQOSA-N	438.447	1.628	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCc2nncn2C1)C(=O)Nc1ccc(Cl)cc1C(F)(F)F	815692078	ISLKXQHNNGFKGA-MRVPVSSYSA-N	430.774	1.299	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)c1ccn(-c2ccc(Br)cc2)n1	815983068	PEPNMDYUDZIRSZ-UHFFFAOYSA-N	438.282	1.921	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)C(C)(C)O)c([C@H]2CCCN(C(=O)OCc3ccccc3)C2)n1	816360487	VUYVPOCZFYJIJH-INIZCTEOSA-N	443.504	1.468	50	20	IDGD	
Cn1c(NNC(=O)c2cccc(S(=O)(=O)NC[C@H]3CCCO3)c2)nc2ccccc21	816580107	SDSHAWQSRPPPJD-OAHLLOKOSA-N	429.502	1.788	50	20	IDGD	
CS(=O)(=O)N1CCN(CC(=O)NNc2cc(C(F)(F)F)cc(C(F)(F)F)c2)CC1	817014735	WMLWWKIIJPNMNA-UHFFFAOYSA-N	448.389	1.745	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)/C=C\c1ccccc1)C(=O)NNc1ncncc1F	817071057	NHUZJDYEAMZBNC-WWRUEGTHSA-N	425.511	1.771	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)N2CC[C@H](B(O)O)C2)c(Br)cc1Cl	864232044	VRAZTBIGDJYBAF-ZETCQYMHSA-N	426.481	1.127	50	20	IDGD	
CSC[C@@H](C(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)N1C(=O)[C@H]2CCCC[C@H]2C1=O	866751507	YREJYEYVYHOOOM-ZNMIVQPWSA-N	434.474	1.263	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1)NNC(=O)c1ccccn1	912770494	MWOCVIVUKBGUAD-UHFFFAOYSA-N	436.799	1.493	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NN=Cc2ccc(C(=O)NC3CC3)cc2)cc1	912788482	FTJAEYNAQYJIKS-UHFFFAOYSA-N	428.514	1.658	50	20	IDGD	
C[C@@H]1CN(S(=O)(=O)c2cc(C(=O)NNc3ncccn3)ccc2Cl)C[C@@H](C)O1	913044317	MIRPOJQELIFKAB-VXGBXAGGSA-N	425.898	1.685	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)NC2CC2)cc1)NNC(=O)COc1ccccc1F	913464945	FSXBOTOAORZVGO-UHFFFAOYSA-N	435.477	1.425	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)N2CCC[C@H](NS(C)(=O)=O)C2)c(C)n1C[C@@H]1CCCO1	915203860	VXNPYZIUIUSHMV-CKMYNJMQSA-N	434.562	1.731	50	20	IDGD	
COc1c(F)cc(CC(=O)NNC(=O)c2ccc3ccccc3n2)cc1S(N)(=O)=O	915594852	FBLAVQUVCDHZQW-UHFFFAOYSA-N	432.433	1.034	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)NCCN2CCN(Cc3ccccc3)CC2)nc2ccccc21	915900978	ASMKELLJAJVWTO-UHFFFAOYSA-N	449.559	1.264	50	20	IDGD	
Cc1cc(C)cc(C(=O)N2CCC[C@H](C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)C2)c1	916144676	ILSXVVGOHGSTMF-SFHVURJKSA-N	447.499	1.593	50	20	IDGD	
CN1CCN(Cc2ccc(CNC(=O)NNC(=O)Cc3nc4ccccc4n3C)cc2)CC1	916387925	MIXLGNKBFNZZSF-UHFFFAOYSA-N	449.559	1.394	50	20	IDGD	
COc1cc(C)c([C@@H](C)NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1OC	916485035	XORCPUQABZTANL-CYBMUJFWSA-N	439.472	1.964	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)c1ccc(NC(=O)NC2CC2)cc1	916645612	BEVVQDIFHWVUGX-CYBMUJFWSA-N	449.475	1.651	50	20	IDGD	
Cc1ccc(N2C(=O)C[C@@H](C(=O)NNC(=O)CN3CCCC3=O)[C@@H]2c2cccs2)cc1	916758500	BISXQHWJSVYUHI-IIBYNOLFSA-N	440.525	1.921	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H](c2ccc3c(c2)OCCO3)C2CC2)c1	918139179	AVKADEXJFRHFHI-IBGZPJMESA-N	445.497	1.957	50	20	IDGD	
O=C(NCCN1CCc2sccc2C1)NNC(=O)c1csc(N2CCOCC2)n1	919785159	WDWYWTBYHBPGBI-UHFFFAOYSA-N	436.563	1.044	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)CN1C(=O)N[C@@]2(C[C@H](C)CC(C)(C)C2)C1=O	919822202	GIWRWCMATKPAAK-JLCFBVMHSA-N	430.505	1.522	50	20	IDGD	
O=C(NNC(=O)[C@H]1CC(c2ccc(Cl)cc2Cl)=NO1)N[C@@H]1CCS(=O)(=O)C1	919883653	BVOSPUYNAJZYNY-NOZJJQNGSA-N	435.289	1.004	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)NC(C)C)c2)o1	920249516	GQDGULZGQVZTCS-UHFFFAOYSA-N	436.534	1.883	50	20	IDGD	
CCN1CCN(CCCNC(=O)CCC(=O)C(C#N)=C2N(C)c3ccccc3N2C)CC1	920461582	ZTCPRUIYLBGXPV-UHFFFAOYSA-N	438.576	1.801	50	20	IDGD	
CN(C)CCOc1ccc(CCNC(=O)NNC(=O)c2cncn2-c2ccccc2)cc1	1115996035	KQMNYPPJNSXOQU-UHFFFAOYSA-N	436.516	1.999	50	20	IDGD	
O=C(NCCS(=O)(=O)c1ccc(Cl)cc1)NNC(=O)c1cncn1-c1ccccc1	1251220658	NWPADSPEGJDSCN-UHFFFAOYSA-N	447.904	1.944	50	20	IDGD	
O=C(Cn1cc(C2CC2)nn1)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	1252944010	GBQAPKANMBMFHL-UHFFFAOYSA-N	443.467	1.375	50	20	IDGD	
CC1(C)CCC[C@@]2(C1)NC(=O)N(CC(=O)NNC(=O)c1cncn1-c1ccccc1)C2=O	1253190073	IKJPEYSYAJYWLF-QFIPXVFZSA-N	438.488	1.524	50	20	IDGD	
CS(=O)(=O)c1ccc(C(=O)NNC(=O)c2n[nH]c3c2CCCC3)cc1Br	1320506928	LUDBHXJCQIDMBW-UHFFFAOYSA-N	441.307	1.529	50	20	IDGD	
COc1ccc2[nH]c(C)c(C(=O)NNC(=O)CN(C)S(=O)(=O)c3ccc(C)cc3)c2c1	1322852878	BXKIRSMLPCMOIB-UHFFFAOYSA-N	444.513	1.875	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)N[C@H]2CC(=O)N(c3ccccc3)C2)CC1	1326250068	VSNNIUSAGFNSJQ-INIZCTEOSA-N	445.520	1.769	50	20	IDGD	
CCC1CCC2(CC1)NC(=O)N(CC(=O)NNC(=O)c1cncn1-c1ccccc1)C2=O	1337203654	HFYWSJPHSRIMMI-UHFFFAOYSA-N	438.488	1.524	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cn4cccnc4n3)C2)C1	1778478290	IGFKPRKLDLILMI-MSOLQXFVSA-N	426.304	1.409	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(CCN(C(=O)C[C@@H]3CNc4ccccc4O3)C2)C1	1778931725	QDHUFILAPCNVTL-VGOFRKELSA-N	447.608	1.931	50	20	IDGD	
COc1cccc(OC)c1C(=O)N1CCO[C@@]2(CCN(C(=O)CO[Si](C)(C)C)C2)C1	1779300268	NVMNPSVHYLVXLF-OAQYLSRUSA-N	436.581	1.999	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccnc4c3OCO4)C2)C1	1780030136	SOBIWHWSIBIRAZ-APPDUMDISA-N	426.267	1.037	50	20	IDGD	
O=C(c1cccnc1-c1ccc(F)cc1)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1780348824	ZQQILAWFPXFCRL-XMSQKQJNSA-N	447.894	1.931	50	20	IDGD	
CCOc1ccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)nn1	1780425232	HXOQDEMPLMGRBN-SCLBCKFNSA-N	441.326	1.350	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1cncnc1)C2)[C@@H](F)Br	1780770857	GVWQGIHMJZIWQY-FRFSOERESA-N	429.290	1.224	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(CCN(C(=O)[C@@H]3CC[C@@H]4CCC(=O)N4C3)C2)C1	1781053123	NMFIGLQTIKOLFQ-SPYBWZPUSA-N	442.354	1.002	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)n1	1781225486	YUPZIRKSMCPAMW-RBUKOAKNSA-N	443.331	1.720	50	20	IDGD	
Cc1nc2ncccn2c1C(=O)N1CCO[C@]2(CCN(C(=O)[C@](C)(Cl)CCl)C2)C1	1781229305	FYILOIQNWJEMQP-RTBURBONSA-N	440.331	1.718	50	20	IDGD	
Cc1nn(C)c(C)c1CC(=O)N1CCO[C@]2(CCN(C(=O)[C@](C)(Cl)CCl)C2)C1	1781231964	BZVUFOQJVNPTBY-RTBURBONSA-N	431.364	1.646	50	20	IDGD	
O=C([C@@H]1CCc2ccccc2O1)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781332797	FNMHPOALSHCWGP-BXWFABGCSA-N	441.297	1.901	50	20	IDGD	
COc1ccc(F)cc1CC(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781335415	YDRGGBYBJRDFSK-AEFFLSMTSA-N	447.276	1.897	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(Cl)c(O)cc3O)C2)C1	1781472363	FSBKNAUTIVOFLW-UGSOOPFHSA-N	433.288	1.449	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccccc3C(N)=O)C2)C1	1781754864	ATQDHFOUTRRZPP-YJYMSZOUSA-N	438.322	1.260	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(CO)c(F)c3)CCO2)C1	1783352775	IFLKSPRQXRIZBU-HNAYVOBHSA-N	443.313	1.935	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(Cl)cnc3O)CCO2)C1	1783528422	NRUPLHCTLRJVON-QFYYESIMSA-N	432.702	1.668	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3c4c(nn3C)CCC4)CCO2)C1	1783538034	VMOHBGCIDYAOEJ-KPZWWZAWSA-N	425.327	1.136	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H]1CC[C@H]3CCC(=O)N3C1)CCO2	1783538068	SPMDRLBUHUTJTM-XLPNERPQSA-N	442.354	1.001	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cccc(C#N)c3Cl)CCO2)C1	1783882911	UOBUACAUBNJNRN-HNAYVOBHSA-N	426.300	1.909	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cn3cc(Cl)cn3)C[C@@H]21	1783965190	ABEAOJZDGNSCMC-JURCDPSOSA-N	447.761	1.547	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cn4c(Cl)cccc4n3)C[C@@H]21)[C@H](O)CCl	1784091306	ZQWSJDAWDMGHQD-VIRABCJISA-N	441.315	1.181	50	20	IDGD	
C[C@H](Oc1cccnc1)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1784549157	YTEBPGGOCZLKLD-JDFRZJQESA-N	430.274	1.369	50	20	IDGD	
COc1ccc(CCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CO[Si](C)(C)C)C[C@@H]32)cn1	1785094443	SZTPUIPGTLMALV-FHWLQOOXSA-N	449.624	1.854	50	20	IDGD	
O=C(CCc1ccccn1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21	1785433648	JJCFEYJFXFHFIW-NZUILWFCSA-N	428.302	1.684	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H](C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](F)Cl)CCO3)C[C@H]2C[C@H]21	1785593885	GFSKOOVBZPFDGC-ACEYWOQSSA-N	445.919	1.749	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)c3ccccc3)C[C@@H]21	1789866907	ZPHPCOCXPAYXNY-ZTTBQOKTSA-N	429.344	1.936	50	20	IDGD	
CC(C)c1nc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]3C2)no1	1789922798	TZPDKPXOICMYTQ-ASHKBJFXSA-N	447.305	1.406	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)ON=C(C)C)[C@H]2C1	1789957390	PZZUUMRTWKNJSF-QXKUPLGCSA-N	432.359	1.941	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCC(N)=O)[C@H]2C1	1790853563	HORVFPBXEORFNW-DKQAGWEXSA-N	446.454	1.117	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3Cc4ccccc4O3)C[C@@H]21	1791055943	KXVFEVLFTXTPSN-AHMROAQXSA-N	437.334	1.753	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)Nc3ccccn3)C[C@@H]21	1791056142	OYYPLKJTKFCLOB-OWYFMNJBSA-N	439.354	1.645	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3ccc(F)cc3)[C@H]2C1	1791099590	IEHNCRXNMNTGLI-KANFNMMFSA-N	426.916	1.992	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(Cl)s3)C[C@@H]21	1791288716	OZEGNGFGYWZCOA-IHRRRGAJSA-N	442.969	1.368	50	20	IDGD	
C[C@H](Cc1ccccn1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21	1791492301	OWQDYNHDPCOBHO-NOYHWAJDSA-N	442.329	1.930	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3c(F)cc(F)cc3[nH]1)C2)[C@H](O)CCl	1792978550	ZYYXEYDFFOJADC-OBSGGCNASA-N	427.835	1.249	50	20	IDGD	
Cn1c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](O)CCl)cc2c1-c1ncccc1OC2	1793109854	HFPRIOPUXNCTEN-IVSAIRAKSA-N	444.919	1.831	50	20	IDGD	
COc1cccc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@](C)(Cl)CCl)C3)n1	1794015130	JXZNIOWUXZIZIZ-ZZXMYQEDSA-N	444.359	1.849	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1scnc1C(F)(F)F	1794982946	XUKINWBCBWPHII-LMLFDSFASA-N	441.859	1.619	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc3c(c1)OCO3)C2	1795112967	ZOELYJFPPYMVFS-HBCWATKFSA-N	439.306	1.332	50	20	IDGD	
C[C@@H](Sc1ccccn1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1	1796192067	FRYIGWNZLACRPA-DQEVTTJGSA-N	439.346	1.194	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(Cl)o1	1796752772	SFXNHCYIXGEXOJ-CNKKGNCFSA-N	447.879	1.270	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(F)cn1)C2	1796889699	AXCJPNKLTYZHPM-TWXBYECESA-N	426.452	1.607	50	20	IDGD	
O=C(CCBr)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1nc(O)n2c1CCCC2	1798657411	HFVBHBNBPOWMOI-CLLJXQQHSA-N	425.327	1.962	50	20	IDGD	
C[C@H](Oc1cccnc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@](C)(Cl)CCl	1799278438	GUKJJGBTPPZBOL-WXZWTWHISA-N	430.332	1.675	50	20	IDGD	
COc1nccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)Br)c1F	1800756191	GYKOMEUYOKDLKW-DYNIEEOBSA-N	430.274	1.216	50	20	IDGD	
Cc1ccc(CSCCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](O)CCl)C3)cc1	1800865536	HNLCXPLWNQHGIS-DMUMMCEESA-N	440.993	1.808	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H]1CNC(=O)C1)C2	1801438457	OFEXMFGNSPKIEU-MIRJSDFSSA-N	428.439	1.646	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1CCN(C(=O)[C@H](C)CC(N)=O)[C@H]1c1cccnc1	1803011096	NEFYQZZOPRGVPE-LGWLGOQQSA-N	439.354	1.630	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2c[nH]c3cnccc23)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803142680	GXTGCHQILAGSRN-ZOCIIQOWSA-N	427.892	1.877	50	20	IDGD	
Cc1nc(O)c(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)nc1C	1804870559	NYEVMMLUOSLTFQ-YQQAZPJKSA-N	433.896	1.113	50	20	IDGD	
Cn1cnc(C(=O)NC[C@@H]2CCN(C(=O)[C@@](C)(Cl)CCl)[C@@H]2c2cccnc2)n1	1805327633	XUYGNWXLWOIDHN-IYOUNJFTSA-N	425.320	1.766	50	20	IDGD	
Cn1ncc(Br)c1C(=O)N1CCC2(CCCN(C(=O)[C@@H](O)CCl)C2)CC1	1805522909	FOUYHLAKOVRONN-ZDUSSCGKSA-N	447.761	1.627	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)c2ccccc2F)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1	1807376214	UEWVJIQBDFAQKT-XMSQKQJNSA-N	447.275	1.534	50	20	IDGD	
C[C@@H]1CCC[C@@H]1C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1807377099	XOQUVLSYLWSIHZ-XEHJXZTKSA-N	435.333	1.517	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)C2(N3CCN(C)CC3)CC2)[C@H]1c1cccnc1	1807950291	GBYWIJXKKWJYRO-SLFFLAALSA-N	448.011	1.885	50	20	IDGD	
Cc1c[nH]cc1C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1808580546	NJXFTBFJJXSYJJ-GHTZIAJQSA-N	432.289	1.031	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)c2cn[nH]c2)[C@@H]1c1cccnc1	1808608534	XPUMXZKVDVYISK-ULJMSJBCSA-N	448.487	1.258	50	20	IDGD	
CC(=O)OC[C@H](OC(C)=O)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Cl)[C@H]1c1cccnc1	1810339214	WKYOEBKXKJPPJJ-LUKYLMHMSA-N	443.859	1.117	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1ccc(O)cc1	1811932696	MVHKELGBZKPWBG-SIKLNZKXSA-N	445.284	1.100	50	20	IDGD	
C#CC(=O)NC[C@H]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2OC(C)=O)[C@@H]1c1cccnc1	1812530404	AXXPRWHMUODRBV-IIBYNOLFSA-N	436.424	1.868	50	20	IDGD	
COC(=O)C1(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](F)Br)[C@@H]2c2cccnc2)CC1	1812691159	DVSGRNQDJZFJBW-BFHYXJOUSA-N	442.285	1.731	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H](CNC(=O)CSCC(=O)O)[C@@H]1c1cccnc1	1813086094	GPDJTOIYOPCVOS-BEFAXECRSA-N	439.610	1.757	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)Cc2ccc3ncnn3c2)[nH]n1)[C@H](O)CCl	1814871618	APETXZYORPZNCW-LSDHHAIUSA-N	431.884	1.287	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1)c1ccc(-n2cnnc2)cc1	1817204030	PHKJKKHIXANGMS-IAGOWNOFSA-N	443.895	1.896	50	20	IDGD	
CC(C)CNC(=O)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](F)Br)CC2	1817332449	MEIQKPLESLONQM-GZMMTYOYSA-N	435.319	1.518	50	20	IDGD	
CC(C)=NO[C@H](C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1	1817477161	NPFNOHWCYPSAQD-RDTXWAMCSA-N	441.297	1.196	50	20	IDGD	
Cc1ccc(CC(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)o1	1817479441	MVFGZSOWGBWCEN-LJQANCHMSA-N	436.277	1.540	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc4cn[nH]c4cn3)sc2C1	1819453830	LJXPDMIQIYYUIC-GHMZBOCLSA-N	434.909	1.894	50	20	IDGD	
CC[S@](=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](F)Br)CC2	1819517782	XCUDULBLUPDUKT-RSOXTKTDSA-N	440.360	1.904	50	20	IDGD	
C[C@@H](Cn1cncn1)C(=O)N[C@@H]1CCc2nc(NC(=O)CO[Si](C)(C)C)sc2C1	1820165382	FHGVIMUNXOJVKR-QWHCGFSZSA-N	436.614	1.834	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(F)cc3)sc2C1	1822191052	MUBRZPVIIWTFPL-AWEZNQCLSA-N	433.509	1.881	50	20	IDGD	
CCNC(=S)NCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](Cl)COC)n[nH]1	1822377512	XFWFJEJDRHICMU-WCQYABFASA-N	430.962	1.140	50	20	IDGD	
COC(=O)NCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](C)CBr)[nH]n1	1822620456	WHRBUERJJBXFGG-JQWIXIFHSA-N	430.303	1.789	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)C(F)(F)C(F)F)CC1	1824848229	ZAHZWEMCAIYWFM-AWEZNQCLSA-N	438.466	1.880	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H]1CCC(=O)N1C)CC2	1825646061	OHYDUNBMYMRADW-QXEWZRGKSA-N	429.340	1.459	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)CCn3cncn3)sc2C1	1826611222	QMUMHNQRFJPHJX-VHSXEESVSA-N	427.328	1.520	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)CCCn3ccnc3)sc2C1	1826690856	PXXVJUZCNYVQDZ-CQSZACIVSA-N	447.565	1.105	50	20	IDGD	
C[C@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)CCn3ccnn3)sc2C1	1826879339	MZOGPDNYWDICAM-UWVGGRQHSA-N	427.328	1.520	50	20	IDGD	
C=CCO[C@@H](C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827049190	PKYHIXYSDVTSMS-UWJYYQICSA-N	428.338	1.191	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1830363688	JCZKGRPMMZPRPO-IAQYHMDHSA-N	429.714	1.398	50	20	IDGD	
CN1CCN(CC(=O)N2CCC([C@@H]3CCCCN3C(=O)[C@@H](F)Br)CC2)CC1	1830378435	NMYQDOVSIHKUDI-FUHWJXTLSA-N	447.393	1.544	50	20	IDGD	
Cc1[nH]ccc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)CBr)CCO2	1830538359	DAUMJWANWNJZOL-ACJLOTCBSA-N	428.327	1.424	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](S)C(C)C)CCO2	1831499266	TUBNVVKBHZKFAC-GRDNDAEWSA-N	437.400	1.571	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3nccc4nc[nH]c34)C2)C1	1831645264	ANPHHUUAPQKMPM-VBKZILBWSA-N	435.912	1.435	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](CCC)NC(C)=O)C2)C1	1831659481	SLLDOLFJPRKESY-SQGPQFPESA-N	431.961	1.155	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)/C=C/c3ccoc3)CCO2)C1	1832652345	FUVXRNUTYRHZQA-AMVWBUNWSA-N	427.295	1.533	50	20	IDGD	
CC(C)(CCl)C(=O)NC1CCN(C2CCN(C(=O)[C@@H]3CCC(=O)NC3)CC2)CC1	1833213881	GRVCLPUTWLXUSM-OAHLLOKOSA-N	426.989	1.349	50	20	IDGD	
C[C@@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)c3cnco3)CC2)CC1	1833265091	QBWQSTOGMGDDFJ-ZDUSSCGKSA-N	427.343	1.891	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3ccc4nccnc4c3)CC2)CC1)[C@@H](O)CCl	1833310339	QVJLMSWYUZBSDD-FQEVSTJZSA-N	445.951	1.415	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3ccnnc3)CC2)CC1	1834142526	AGCCTUDSYMKSOK-KRWDZBQOSA-N	438.370	1.835	50	20	IDGD	
CCn1ccc(C(=O)NC2CCN(C3CCN(C(=O)CCBr)CC3)CC2)n1	1834273227	WTUPDCBGHMMXLX-UHFFFAOYSA-N	440.386	1.873	50	20	IDGD	
O=C(c1ccc(C(F)(F)F)nc1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1834274346	BORJNSYRBUZMCL-BBRMVZONSA-N	439.793	1.705	50	20	IDGD	
Cn1cnc(C(=O)NC2CCN(C3CCN(C(=O)[C@](C)(Cl)CCl)CC3)CC2)c1	1834286447	KXYHAHFHMICERB-LJQANCHMSA-N	430.380	1.842	50	20	IDGD	
Nc1ncc(C(=O)N2CCC(N3CCC(NC(=O)CCBr)CC3)CC2)s1	1834421909	SSGVRWKQENVWDZ-UHFFFAOYSA-N	444.399	1.696	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)c3ccc(F)s3)C2)C1	1834819704	YSNTYIWXNUOHCV-INIZCTEOSA-N	435.315	1.742	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)Cc3ccccn3)CC2)CC1	1834891409	DGCVBHFEFCPZHO-HNNXBMFYSA-N	437.382	1.979	50	20	IDGD	
O=C(Cc1ccccc1F)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1835005769	QEOVFPCZLKHXDF-SJLPKXTDSA-N	447.276	1.515	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H]3CC(c4ccccc4)=NN3)CC2)CC1)[C@H](F)Cl	1835081712	ZWGCSPRHJKPCGH-UXHICEINSA-N	449.958	1.859	50	20	IDGD	
CC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)c3nc4ncccn4n3)CC2)CC1	1836394250	PCJKTEOUKSQQBR-INIZCTEOSA-N	433.944	1.327	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)N1CCC(N2CCC(NC(=O)[C@@](C)(Cl)CCl)CC2)CC1	1836399559	DQDVBBSLKUGXBE-VLIAUNLRSA-N	447.407	1.485	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1Cc3ccccc3O1)CCO2	1836649769	AMJHWAAOMJTVGJ-UGKGYDQZSA-N	448.592	1.298	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnnc(Cl)c3)C2)C1	1837710212	NZNJMMYPPPRMAD-SFHVURJKSA-N	442.976	1.052	50	20	IDGD	
C=CCOCCCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)CO[Si](C)(C)C)CCO2	1837710270	RQWBEGVEMVPLPW-HXUWFJFHSA-N	428.602	1.277	50	20	IDGD	
CC(C)c1cc(C(=O)N2CCOC[C@@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)on1	1837714396	CEAZTGBRRFGOAC-HXUWFJFHSA-N	439.585	1.720	50	20	IDGD	
Cc1cnn(CC(=O)N2CCC(OC3CCN(C(=O)[C@@H](F)Br)CC3)CC2)c1	1837980192	UITXMYHDXHXOFQ-QGZVFWFLSA-N	445.333	1.881	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(F)cnc3Cl)C2)C1	1839145439	HROLRQMCZZGCMK-KDOFPFPSSA-N	434.295	1.962	50	20	IDGD	
CCn1nccc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2	1839151357	PCXURXMMYRGJAN-QZTJIDSGSA-N	433.336	1.209	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(O)cc1F)CCO2	1839316845	VQTMXBBACNCPLK-HXUWFJFHSA-N	440.544	1.453	50	20	IDGD	
COc1ccc(Cl)cc1CC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1839790148	JSFFATJMGNKZMH-IEBWSBKVSA-N	449.306	1.882	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4ccccc4n3C)C2)C1	1840152746	RVIIRPWNNAJSIU-JTSKRJEESA-N	449.935	1.502	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CCc3nc[nH]c3C1)CCO2	1840361260	URXLBSNHHPKZBC-VWKPWSFCSA-N	438.956	1.379	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)Cc2cnccn2)C1	1841462448	QEKWZBJIZDUADA-UHFFFAOYSA-N	439.428	1.370	50	20	IDGD	
O=C(CCBr)N1CC2(CCCN2C(=O)[C@H]2CC(=O)N(C3CCCC3)C2)C1	1841857699	OUNHIDWDWORCML-AWEZNQCLSA-N	426.355	1.766	50	20	IDGD	
C#CCO[C@H](C)C(=O)N1CC2(CCCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C1	1841924072	SDUIHLQHONGDKM-CABCVRRESA-N	427.929	1.360	50	20	IDGD	
COC(=O)C1(C(=O)N2CC3(CCCN3C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)CC1	1841925369	OSPWKFSLHQIWJL-ZDUSSCGKSA-N	443.928	1.275	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)[C@@H]1[C@H]3Sc4ccccc4[C@@H]31)C2	1844264485	XSXFLEIFSGAOBJ-QYZOEREBSA-N	449.536	1.390	50	20	IDGD	
Cc1c(C(=O)N2CCCC23CN(C(=O)[C@@H](C)CBr)C3)cn2[nH]cnc(=O)c12	1844655271	LTHRQQNUUDIFIV-NSHDSACASA-N	436.310	1.179	50	20	IDGD	
Cc1cn2c(=O)c(C(=O)N3CC4(CCCN4C(=O)[C@@H](F)Br)C3)cnc2s1	1845217665	ODCHCTVWZIDVIB-LLVKDONJSA-N	443.298	1.572	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2cc3cccnn3c2)C1	1845653228	RHCZGTULTUZCSJ-MFKUBSTISA-N	433.472	1.285	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2ccc(NS(C)(=O)=O)cc2)c2ccccc2c1=O	11659868	PQXXSEJHLYAATM-UHFFFAOYSA-N	443.485	1.253	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)CCc2nc3ccccc3c(=O)[nH]2)c2ccccc2c1=O	17196120	CSEPEFNKIKSYLN-UHFFFAOYSA-N	446.467	1.608	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CC(=O)N(C2CCCC2)C1)c1ccc(S(=O)(=O)N2CCCC2)cc1	17514304	UFJDJAOFXRNOOB-MRXNPFEDSA-N	448.545	1.023	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)cc1	23566901	NMOPEGQDKUCCSA-YJBOKZPZSA-N	449.504	1.902	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)[C@H]1CC(=O)N(c2ccc3c(c2)OCCO3)C1	24626546	VFHDSOKPJIXVFP-LBPRGKRZSA-N	445.859	1.934	50	20	IDGD	
CCn1c(O)nc2cc(C(=O)NNc3ccc(S(=O)(=O)NC4CC4)cc3)ccc2c1=O	726867559	NHYHWYTUENUUHR-UHFFFAOYSA-N	443.485	1.320	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)CN(C)S(=O)(=O)c2ccc(Cl)cc2)cn1	726895361	HPFFUQCDXCUATH-UHFFFAOYSA-N	443.938	1.382	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2CCCN2C(=O)OCC(F)(F)F)c1	727788510	OMEYZLWZDJDUTP-LBPRGKRZSA-N	437.396	1.014	50	20	IDGD	
CN(C)N(C(=O)CSc1nnc(-c2ccc(Cl)cc2)o1)[C@H]1CCS(=O)(=O)C1	728180062	NBVHRYGJQJTOIO-ZDUSSCGKSA-N	430.939	1.974	50	20	IDGD	
C[C@@H](CCC(=O)NNC(=O)c1ccc(C#N)cc1)CC(=O)NNC(=O)c1ccc(C#N)cc1	729842957	SMSDJPHTOYBDGS-HNNXBMFYSA-N	446.467	1.459	50	20	IDGD	
C[C@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)NNC(=O)CCc2ccccc2O)C1=O	730033553	DQJQRGAPUIFGTP-OAQYLSRUSA-N	428.420	1.079	50	20	IDGD	
CN(C)C(=O)CCN1CCC(NC(=O)NNC(=O)CC23CC4CC(CC(C4)C2)C3)CC1	731502554	LPLYIKUKPAMJOO-UHFFFAOYSA-N	433.597	1.866	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)c2occc2COc2cccc(C#N)c2)C[C@@H](C)O1	732260377	DIRZXDXWHWHYSE-HZPDHXFCSA-N	426.473	1.991	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1S(=O)(=O)N(C)C	733110643	YXLWWJKYEHJYPW-UHFFFAOYSA-N	443.485	1.206	50	20	IDGD	
O=C(CCCOc1ccc(Cl)cc1Cl)NNC(=O)NCCN1C(=O)CNC1=O	733657797	NGXWZHHIZKKENZ-UHFFFAOYSA-N	432.264	1.035	50	20	IDGD	
O=C(NNc1cnccn1)c1ccc(NS(=O)(=O)c2ccc3c(c2)OCCO3)cc1	734243841	ASIWAIGDDVUXSB-UHFFFAOYSA-N	427.442	1.806	50	20	IDGD	
O=C(COC(=O)Cc1c[nH]c2ccc(F)cc12)NNC(=O)[C@H]1COc2ccccc2O1	734597291	HQRWQYNNOGZDLF-GOSISDBHSA-N	427.388	1.380	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)C[C@@H]2OCCc3ccccc32)cc1OC	734604821	IENJLNGDILGVDX-SFHVURJKSA-N	428.441	1.712	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)[C@@H]2CS[C@@]3(C)CCC(=O)N23)CC1	734826105	XDYRAQJYMBWPBD-DJJJIMSYSA-N	441.554	1.170	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2cc(Cl)nc(Cl)c2)CC1	735117985	LPYTXZRKAXZMBZ-UHFFFAOYSA-N	445.332	1.476	50	20	IDGD	
COc1ccc(C(=O)Nc2nc(CC(C)=NNC(=O)c3cnn(C)c3)ns2)cc1OC	735410861	AJGWKJJVOVYDPY-UHFFFAOYSA-N	443.489	1.890	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)N[C@@H](C)CN1CCN(c2ccccn2)CC1	735517330	CEGWUSXSJINCDT-HNNXBMFYSA-N	446.939	1.898	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)N2CCC(C(=O)NNc3ccc(Cl)nn3)CC2)cc1	735689016	IHQMRZIYZXJOHG-UHFFFAOYSA-N	437.909	1.877	50	20	IDGD	
O=C(COC(=O)CCN1C(=O)CCc2ccccc21)NNC(=O)c1ccc([N+](=O)[O-])cc1	738876349	ZLMUWSNTUQPPGV-UHFFFAOYSA-N	440.412	1.269	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)[C@H]1CS[C@@]2(c3ccc(F)cc3)CCC(=O)N12	740852375	XYLXHHSPAQMDLT-FOIQADDNSA-N	436.509	1.169	50	20	IDGD	
CC(=NNC(=O)Nc1ccc(N(C)C)cc1)c1ccc(S(=O)(=O)NCC(=O)O)cc1	741767318	RKRZOVAQMOMSFJ-UHFFFAOYSA-N	433.490	1.661	50	20	IDGD	
CC(C)c1nc(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)nn1-c1ccccc1F	742035283	FREQNHNAQIZEKA-UHFFFAOYSA-N	435.423	1.580	50	20	IDGD	
Cc1ccc(CN2C(=O)CC[C@H]2C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1	742473768	IKHLPWUAFZBHAC-SFHVURJKSA-N	433.468	1.194	50	20	IDGD	
Cn1ccnc1[C@@](O)(CC(=O)NNC(=O)c1cccc(Br)c1)C(F)(F)F	742773513	WNKPNKCHJYJYLV-AWEZNQCLSA-N	435.200	1.784	50	20	IDGD	
CC(C)(C)OC(=O)N1CCCC[C@H]1C(=O)OCC(=O)NNC(=O)c1ccc(C#N)cc1	744884678	UTGRYFABSNCJLH-INIZCTEOSA-N	430.461	1.652	50	20	IDGD	
O=C(COC(=O)CNC(=O)c1cc2ccccc2[nH]1)NNC(=O)c1ccc(Cl)cc1	745640366	GFHCFQPNUJXEOO-UHFFFAOYSA-N	428.832	1.556	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=O)Cc2cn3ccccc3n2)ccc1F	746549123	VAALVQFJKXJOGQ-UHFFFAOYSA-N	447.492	1.508	50	20	IDGD	
Cc1nn(Cc2ccc(Cl)cc2)c(C)c1C(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1	748702177	FOARPEUMIOJPBZ-OAHLLOKOSA-N	439.925	1.333	50	20	IDGD	
CC[C@@H](Oc1cccc(C)c1)C(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1	749329822	GSZNIDCFCBOGLK-LJQANCHMSA-N	433.530	1.929	50	20	IDGD	
Cc1ccc2c(CCNC(=O)NNC(=O)c3csc(N4CCOCC4)n3)c[nH]c2c1	749422823	CMCHCQPHUGSYLU-UHFFFAOYSA-N	428.518	1.956	50	20	IDGD	
COc1ccc(C(=O)CNC(=O)CCC(=O)NNC(=O)c2cccc3cccnc23)cc1	751396018	INCPRBYEZAAVCD-UHFFFAOYSA-N	434.452	1.784	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc1OC	755374767	XJPIKVIHHXZVCE-UHFFFAOYSA-N	448.501	1.955	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2cccc(OCC#N)c2)cc1	755933993	SLVKWYXHVKFTHT-UHFFFAOYSA-N	431.474	1.371	50	20	IDGD	
CN1CCC/C1=N\S(=O)(=O)c1cccc(NC(=O)NNC(=O)c2ccccc2O)c1	756027926	ABKQPPGKHAMEPB-HAVVHWLPSA-N	431.474	1.672	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)[C@H]1CC(Br)=NN1c1ccc(C)cc1	756098031	DUKFAQOGOFNCBH-CQSZACIVSA-N	438.326	1.734	50	20	IDGD	
COc1ccc2cc(NC(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)ccc2n1	756329522	BTYQIHZHVYMHKA-UHFFFAOYSA-N	443.485	1.960	50	20	IDGD	
O=C(COc1ccccc1O)NNS(=O)(=O)c1cc(F)c(Br)cc1F	756964451	IFQCTOUIXGVDON-UHFFFAOYSA-N	437.218	1.821	50	20	IDGD	
CCOC(=O)Cc1nnc(NC(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)s1	757756129	PYIGLGCIRLUXPG-UHFFFAOYSA-N	439.450	1.136	50	20	IDGD	
COc1cccc2c1OCC(C(=O)N1CCN(S(=O)(=O)CBr)CC1)=C2	758518900	SIAVVGKISNUOBV-UHFFFAOYSA-N	431.308	1.297	50	20	IDGD	
O=C(CCc1nc(O)c2ccccc2n1)N1CCN(S(=O)(=O)CBr)CC1	758534194	DFERHSVOLTUKGR-UHFFFAOYSA-N	443.323	1.094	50	20	IDGD	
CCc1ccccc1-n1cnnc1SCC(=O)NNC(=O)C(=O)Nc1ccccn1	758830557	AOQWGRADAATFTR-UHFFFAOYSA-N	425.474	1.103	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)[C@H]1CC(=O)N(c2ccc3c(c2)CCC3)C1	760440076	QMDJPMCQFSPCCM-INIZCTEOSA-N	430.505	1.590	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCCOc2ccc(Cl)cn2)c2ccccc2c1=O	761780061	DLQGSRPPSQNMKZ-UHFFFAOYSA-N	430.852	1.488	50	20	IDGD	
CCc1noc2ncc(S(=O)(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)cc12	762450216	XYONLLNBLYGABH-UHFFFAOYSA-N	427.483	1.400	50	20	IDGD	
Cn1nccc1CCNC(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1	762572434	SLKJUBAHASCTKQ-JOCHJYFZSA-N	432.528	1.920	50	20	IDGD	
C[C@@H](CN1CCN(c2ccccn2)CC1)NC(=O)NNC(=O)CSc1ccccc1O	763511674	DDJZKIPDHPEDNQ-INIZCTEOSA-N	444.561	1.420	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)C(=O)Nc1cccc(OC[C@@H]2CCCO2)c1	763549253	VSZVBKQBKUGORL-INIZCTEOSA-N	427.413	1.373	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2F)c(OC(F)F)c1	763560520	CCLUPWZPXQQATF-UHFFFAOYSA-N	425.319	1.613	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(C2CCCCC2)nn1C	763663624	LPDCPWKQSLNAEJ-UHFFFAOYSA-N	429.477	1.641	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1	763818289	FNFXZUCAQWJSOT-UHFFFAOYSA-N	426.414	1.304	50	20	IDGD	
COCCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2C)cc1Cl	763956361	MDQRYOLDMKDXJF-UHFFFAOYSA-N	432.864	1.424	50	20	IDGD	
Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)C(=O)NNC(=O)c1cccn1C	763994436	XSRBDYUANIAWQC-GOSISDBHSA-N	449.515	1.377	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)Nc1ccc(Br)cc1	764002820	STBARTHUHSJTEM-UHFFFAOYSA-N	444.083	1.950	50	20	IDGD	
CC(C)(C)OC(=O)N1CCc2c(cccc2NC(=O)C(=O)NNC(=O)c2cnccn2)C1	764024031	HNCLTGSUTJEVEP-UHFFFAOYSA-N	440.460	1.170	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccccc1N1C[C@H](C)O[C@@H](C)C1	764041610	YFELIGKZRUZPFJ-GJZGRUSLSA-N	426.473	1.709	50	20	IDGD	
O=C(CCc1ccccc1)NNC(=O)C(=O)Nc1cccc(C(=O)N2CCSCC2)c1	764192973	PEBAXASDLIFOKB-UHFFFAOYSA-N	440.525	1.594	50	20	IDGD	
Cc1cc(C)cc(Oc2ccc(NC(=O)C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)cc2)c1	764226138	GERJCRINLPZDRR-AWEZNQCLSA-N	448.501	1.119	50	20	IDGD	
CCOCC(=O)NNC(=O)C(=O)Nc1ccc(CC(=O)N2CCCc3ccccc32)cc1	764325375	MEDSQNPCFCMHIP-UHFFFAOYSA-N	438.484	1.331	50	20	IDGD	
COC(=O)CCc1ccc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1	764346042	RSOUKMYWBREIIH-UHFFFAOYSA-N	435.440	1.378	50	20	IDGD	
CCCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)COCc2ccccc2)cc1Cl	764363419	OVNDMCFZPTZBQB-UHFFFAOYSA-N	446.891	1.783	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(Br)ccc2-n2cccn2)o1	764372279	SIRLRCJDRZCGPI-UHFFFAOYSA-N	432.234	1.936	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc(C(N)=O)cc3F)n[nH]2)cc1	764384969	PEVMHQOYQRPCBF-UHFFFAOYSA-N	438.419	1.277	50	20	IDGD	
CC(=NNC(=O)COc1ccccc1[N+](=O)[O-])c1ccc(Cl)c(S(N)(=O)=O)c1	764659330	JSVCLIOQASAKJW-UHFFFAOYSA-N	426.838	1.815	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNS(=O)(=O)c1cccc(F)c1	765118882	HTVLPXQQYCKICP-UHFFFAOYSA-N	440.928	1.606	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)N[C@@H]2CCC[C@@H]2C(=O)NC)cc(OCC)c1OCC	765778873	QLACJYLWWWFZMF-LSDHHAIUSA-N	436.509	1.741	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1ccc(-c2nnc3n2CCCCCC3)cc1	766271640	NSIDZSRKIGCFCE-UHFFFAOYSA-N	436.476	1.942	50	20	IDGD	
CCC(=O)N1CCCC[C@@H]1C(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	766670246	VFZGSEGEYPSWRP-LJQANCHMSA-N	449.983	1.396	50	20	IDGD	
Cc1c(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cnn1CC(C)C	767089541	RVOXPRWBENXPCN-UHFFFAOYSA-N	426.521	1.067	50	20	IDGD	
CC(C)[C@H](NC(=O)OC(C)(C)C)C(=O)NCC(=O)NNc1nc(-c2ccncc2)no1	768389662	YJYOCVZQDVQDMI-AWEZNQCLSA-N	433.469	1.240	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)[C@@H](F)c1ccccc1	768964087	BLJNXFUCHOTPFT-FQEVSTJZSA-N	449.504	1.498	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)Nc1cccc(N2C(=O)CN(C)C2=O)c1	769227424	FNNILOVMACCGPA-UHFFFAOYSA-N	447.473	1.646	50	20	IDGD	
CCOC(=O)NNC(=O)Nc1ccc(S(=O)(=O)N2CCC[C@H](C(=O)OC)C2)cc1	769942422	NDLIBDZETHCWER-LBPRGKRZSA-N	428.467	1.043	50	20	IDGD	
CN(C)C(=O)Cn1ccc(NC(=O)NNc2ccccc2S(=O)(=O)NC(C)(C)C)n1	769994983	ZGJSTEFRGXSLAP-UHFFFAOYSA-N	437.526	1.197	50	20	IDGD	
C[C@H](NS(=O)(=O)c1cccc(C(F)(F)F)c1)C(=O)NNC(=O)Cc1ccc(F)cc1	770952124	YWEMLLNMZYPOFP-NSHDSACASA-N	447.410	1.901	50	20	IDGD	
CC(C)(C)CC(=O)NNC(=O)CN1C(=O)N[C@](C)(c2ccc(Br)cc2)C1=O	771256279	MKQJCWGVBHNVMI-GOSISDBHSA-N	439.310	1.800	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)/C(=C/c1cccs1)n1nnnc1-c1ccccc1	771914467	RZIIKQGPNCXKCO-WIOAZZGGSA-N	440.485	1.889	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccccc2)C1	771988160	JBLFQHDTYYPOKY-JKSUJKDBSA-N	439.534	1.213	50	20	IDGD	
COc1ccc([C@@H]2[C@H](C(=O)O[C@H](C)C(=O)NNC(=O)CC(C)C)CCC(=O)N2C)cc1	772136632	MWEBIDRJCGMRLJ-WIBUTAKZSA-N	433.505	1.730	50	20	IDGD	
Cc1oncc1C(=O)Nc1ccc(C(=O)O[C@H](C)C(=O)NNC(=O)CC(C)C)c(O)c1	772144521	ULFLPOGNACDQAV-GFCCVEGCSA-N	432.433	1.680	50	20	IDGD	
Cc1cc(C[C@H](C)NC(=O)NNC(=O)CNC(=O)c2cccs2)n(-c2ccccc2)n1	773004910	JKLYPHFEJVELLP-AWEZNQCLSA-N	440.529	1.934	50	20	IDGD	
CCS(=O)(=O)c1cccc(S(=O)(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)c1	773252633	VTPCORNVJFDMRN-GFCCVEGCSA-N	446.934	1.911	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(-c3cncnc3)cc2F)c1	773741453	ZLCBFXMNQJJNPN-UHFFFAOYSA-N	443.460	1.608	50	20	IDGD	
COCCOc1ccccc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1cccc(Cl)c1	774011481	ZTQZRVXHWPJDLY-CYBMUJFWSA-N	435.864	1.919	50	20	IDGD	
C#C[C@H](NC(=O)NNC(=O)c1nn(CCCCC)c(=O)c2ccccc12)[C@H]1CCCO1	776226217	DWYNFOIKBONMLT-ZWKOTPCHSA-N	425.489	1.712	50	20	IDGD	
O=C(CN1CCNC(=O)[C@@H]1c1ccccc1Br)NNC(=O)c1cccs1	777717599	VLLRBVRYPVMGIV-HNNXBMFYSA-N	437.319	1.445	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NC[C@@H]2COC3(CCCCCC3)O2)nc1	777763576	GFSCDSCASGCGTR-OAHLLOKOSA-N	441.554	1.860	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)N1CCC(CCCN2CCOCC2)CC1	779965912	MPZICGQZYQDGHO-UHFFFAOYSA-N	428.537	1.822	50	20	IDGD	
N#Cc1ccc(NNC(=O)[C@@H]2C[C@@H](O)CN2S(=O)(=O)c2ccc(F)cc2)cc1Cl	781016661	OIZILPTZKRIVBF-PBHICJAKSA-N	438.868	1.618	50	20	IDGD	
O=C(NNc1cncc(Cl)n1)C(=O)Nc1ccc2c(ccn2CCN2CCOCC2)c1	783260198	YCHCBGBMGUWBHD-UHFFFAOYSA-N	443.895	1.499	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2ccc(-n3nccc3C(F)(F)F)cc2)CCS(=O)(=O)C1	783426534	MQIZPJKKAZJHOC-MRXNPFEDSA-N	445.423	1.028	50	20	IDGD	
O=C(NNC(=O)C(=O)N1CCCC1)C(=O)Nc1ncc(Cc2ccccc2Cl)s1	784003245	RSGNHSAHYKIBEO-UHFFFAOYSA-N	435.893	1.096	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)c(C)c1	784231348	XKUZTXNUEKAFSM-UHFFFAOYSA-N	445.545	1.321	50	20	IDGD	
O=C(NNc1nc(-c2ccccn2)nc2c1CCC2)[C@H]1CC=CC[C@@H]1C(=O)N1CCOCC1	784784004	LQVJBTABOGSOHA-IRXDYDNUSA-N	448.527	1.912	50	20	IDGD	
O=C(NNc1cccnc1Cl)C(=O)Nc1ccc(F)c(S(=O)(=O)NC2CC2)c1	784843775	RYJIBRMJRQSONN-UHFFFAOYSA-N	427.845	1.397	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCCCCC2)cc1NC(=O)C(=O)NNc1cccnn1	784863557	YLJNZNVROUWSHL-UHFFFAOYSA-N	448.505	1.132	50	20	IDGD	
CON(C)S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2nc3ccccc3cc2C)cc1	785154894	SOCHUQXKTNRVMS-UHFFFAOYSA-N	443.485	1.807	50	20	IDGD	
O=C(COC(=O)Cc1cccc(N2CCCC2=O)c1)NNC(=O)c1cccc([N+](=O)[O-])c1	785216119	FXFXPYWFIJIAOB-UHFFFAOYSA-N	440.412	1.269	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1ccc(C(=O)NC(C)C)cc1	785337928	IOOIAFYJTMVJSS-UHFFFAOYSA-N	448.501	1.319	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@H]2CCc3cc(C#N)ccc32)cc1	787420402	JMVMRHUGWYLDAW-IBGZPJMESA-N	441.513	1.505	50	20	IDGD	
O=C(COC(=O)CCCc1ccc(O)c(F)c1)NNC(=O)[C@@H]1COc2ccccc2O1	787847512	GTFFKANGJOOFOV-SFHVURJKSA-N	432.404	1.385	50	20	IDGD	
Cc1ccc(-n2cccn2)cc1NC(=O)C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C	789584124	DNHUQGNOTCTITC-UHFFFAOYSA-N	444.492	1.572	50	20	IDGD	
CN1C(=O)Cc2cc(NC(=O)C(=O)NNc3ccc(S(=O)(=O)C(F)F)cc3)ccc21	789728161	XUFQCMBZKAHJJS-UHFFFAOYSA-N	438.412	1.284	50	20	IDGD	
CCC[C@H](CCCS(C)(=O)=O)C(=O)NNc1nc(O)c2cnn(C(C)(C)C)c2n1	789942297	OAGBNUADTRPGLZ-GFCCVEGCSA-N	426.543	1.971	50	20	IDGD	
CC(C)(C)OC(=O)Nc1ccc(CC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)nc1	791446651	GDABUYHMXNZSTP-KRWDZBQOSA-N	428.445	1.959	50	20	IDGD	
COc1ccc(OC)c(C2=NO[C@@H](C(=O)NNC(=O)[C@@H](C)Oc3ccccc3F)C2)c1	791461385	ZMHFQJKUMRAVDA-CWTRNNRKSA-N	431.420	1.951	50	20	IDGD	
Cc1cccc(=O)n1C[C@](C)(O)C(=O)NNC(=O)COc1ccccc1-c1ccccc1	792014506	JCXUYVUIGGVVLR-DEOSSOPVSA-N	435.480	1.801	50	20	IDGD	
COc1cc(OC)c(NC(=O)C(=O)NNc2nc3ccccn3n2)cc1Br	792396190	YGLRLFXHKAMLNA-UHFFFAOYSA-N	435.238	1.591	50	20	IDGD	
CC(C)(C)OC(=O)N1CC=C(CCNC(=O)NNC(=O)CNC(=O)c2ccco2)CC1	792881010	CVWPTUIPHFQAFF-UHFFFAOYSA-N	435.481	1.297	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNC(=O)c1cc([N+](=O)[O-])cc2c1OCCO2	794065895	QYIMKWNLYCJSRV-UHFFFAOYSA-N	430.373	1.053	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3C[C@H](C)O[C@@H](C)C3)c2)n1	794074616	CPVXIGOTJQIYIL-GJZGRUSLSA-N	432.502	1.263	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)CNC(=O)c2ccc(C(F)(F)F)cc2)cc1	794718350	DZJBUPZLLPBDPO-UHFFFAOYSA-N	444.435	1.829	50	20	IDGD	
Cc1ccc(Br)c(S(=O)(=O)NCCNS(=O)(=O)CCCCCl)c1	796248566	RTGGKTDNAPVUOO-UHFFFAOYSA-N	447.804	1.974	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)CN[C@@H](CO)c1ccccc1OC(F)(F)F	796526873	ZELYGZADMSNDOH-INIZCTEOSA-N	425.407	1.907	50	20	IDGD	
O=C(NNc1ccc(F)c(F)c1F)C(=O)Nc1cc(S(=O)(=O)N2CCCC2)ccn1	796989473	OMZGMMGMTCVWMK-UHFFFAOYSA-N	443.407	1.365	50	20	IDGD	
O=C(NNS(=O)(=O)c1cccc(Br)c1F)c1ccc2c(c1)OCCO2	799120410	QMGZLHFMUBJRQK-UHFFFAOYSA-N	431.239	1.983	50	20	IDGD	
CN1C(=O)COc2cc(NC(=O)C(=O)NNC(=O)CSc3ccc(Cl)cc3)ccc21	799258002	XVXBVXKBKXDPPO-UHFFFAOYSA-N	448.888	1.573	50	20	IDGD	
Cc1cc(O[C@H]2CCN(C)C2=O)ccc1NC(=O)C(=O)NNC(=O)Cc1ccccc1F	799259072	MYYAYGQCMWJIML-SFHVURJKSA-N	442.447	1.072	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)C2(OCC)CCOCC2)c2ccccc2c1=O	803649937	UXJYHNATWZMIIA-UHFFFAOYSA-N	430.505	1.933	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)c1cc(S(=O)(=O)Nc2ccccc2F)c[nH]1	804958588	DLEUTAKDHYMIJH-UHFFFAOYSA-N	442.436	1.687	50	20	IDGD	
Cc1cccn(Cc2c(F)cccc2NC(=O)C(=O)NNC(=O)Cc2ccsc2)c1=O	806976987	QHDRVVDZNFTTOQ-UHFFFAOYSA-N	442.472	1.734	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2ccc(-n3ccnc3)nn2)c(F)cc1Br	807429077	OSLGMSPBUVPIDL-UHFFFAOYSA-N	434.229	1.954	50	20	IDGD	
Cc1cc([N+](=O)[O-])ccc1NNC(=O)C(=O)Nc1cnn(CC(=O)NC2CCCC2)c1	807455222	HXMLPPMGDOBEPE-UHFFFAOYSA-N	429.437	1.240	50	20	IDGD	
C[C@@H]1[C@@H](NC(=O)NNC(=O)c2csc(N3CCOCC3)n2)CCN1Cc1ccccc1	807619972	CWDFWZGMUPNUTD-WBVHZDCISA-N	444.561	1.587	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)CNS(=O)(=O)c2ccc(Cl)c(C(F)(F)F)c2)n[nH]1	810583514	BFRFQLLYMOVXAN-UHFFFAOYSA-N	439.803	1.130	50	20	IDGD	
CS(=O)(=O)C1(C(=O)NNC(=O)c2ccc(Br)cc2Cl)CCOCC1	815399342	RTKCOYMKBIZSRI-UHFFFAOYSA-N	439.715	1.457	50	20	IDGD	
O=C1CC[C@@](C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)(c2ccccc2)CN1	816915435	ABUNJUOVQYTKBB-NRFANRHFSA-N	428.514	1.418	50	20	IDGD	
O=C(NN=Cc1c(Sc2nnnn2-c2ccccc2)nc2ccccn2c1=O)C1CC1	818212362	OCUXOSSOTCOPLD-UHFFFAOYSA-N	432.469	1.682	50	20	IDGD	
CNS(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)c2ccc(C(C)(C)C)cc2)cc1	906379709	KEOYBSHYGDLJBK-UHFFFAOYSA-N	425.532	1.516	50	20	IDGD	
CSC[C@@H](C(=O)NNC(=O)COc1ccc(F)cc1)N1C(=O)[C@H]2CCCC[C@H]2C1=O	910865621	WYNGJOISGFUNCR-XHSDSOJGSA-N	437.493	1.259	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2cc(S(N)(=O)=O)ccc2F)c(C)n1-c1ccccc1	913419457	GXTSVAXPDSRPKK-UHFFFAOYSA-N	430.461	1.955	50	20	IDGD	
Cc1cccc([C@@H](CC(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)NC(N)=O)c1	914642183	FOBGPBMFICFPBB-MRXNPFEDSA-N	432.864	1.752	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN(C(=O)c2ccc(Cl)c(Cl)c2)C1)C(=O)NC1CC1	914838967	UFNLYGFPHQHKDH-NSHDSACASA-N	427.288	1.272	50	20	IDGD	
CC(=NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12)c1cccc(S(N)(=O)=O)c1	915946388	IPSVUAHEQWLOMI-UHFFFAOYSA-N	427.486	1.779	50	20	IDGD	
O=C(O)c1ccc(Br)c(S(=O)(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c1	916104613	MSRBPKWJADTBHW-UHFFFAOYSA-N	444.219	1.679	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)N[C@H](CN1CCOCC1)c1ccccc1	916213614	FINAOSFJURSTKR-OXQOHEQNSA-N	430.480	1.997	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NCC[C@](O)(c2nccn2C)C(F)(F)F)cc1	916378214	JRUPVRKMSCBJHH-KRWDZBQOSA-N	429.399	1.278	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCc2cnn(Cc3ccccc3)c2)nc1	916580143	VWKCORLBUFFIEF-UHFFFAOYSA-N	443.533	1.839	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NC[C@H](C)N2CCc3ccccc32)c2ccccc2c1=O	916623022	XVEBLHVYRYSPQM-HNNXBMFYSA-N	434.500	1.812	50	20	IDGD	
COCCNC(=O)CSc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc(C)cc1	916830523	DNYQGHRVSOAYED-UHFFFAOYSA-N	444.513	1.249	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCc2ccc([C@H]3C[C@H]3C)o2)cc1	918078529	UTLQTEIESKNGAC-PBHICJAKSA-N	434.518	1.863	50	20	IDGD	
C[C@@]1(C2CC2)NC(=O)N(CC(=O)NNC(=O)c2ccc(F)cc2Br)C1=O	918340397	NXWBYTPXZGZZKR-INIZCTEOSA-N	427.230	1.070	50	20	IDGD	
N#CC1(C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)CCCCC1	920019454	NASIMXIDEUJEHB-UHFFFAOYSA-N	448.545	1.262	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)CN2C(=O)N[C@@]3(CCCC[C@@H]3C)C2=O)o1	920272333	MYXANJUHPCMQTH-LHSJRXKWSA-N	433.509	1.383	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)NCc2cccc(C(=O)N3CCOCC3)c2)cc1	920419620	GSDSUSWWPPQESD-UHFFFAOYSA-N	440.500	1.631	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)[C@H]2CS[C@@]3(C)CCC(=O)N23)CC1	1116088803	ZQRURQQCSUDYAN-YJYMSZOUSA-N	426.539	1.235	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(C(=O)N2CCCC2)c(F)c1)c1n[nH]c2c1CCCC2	1253812724	YKPPYDIIASCHHB-UHFFFAOYSA-N	435.481	1.287	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)[C@H]2CC(=O)N(c3ccccc3F)C2)CC1	1318611348	FZFGYISUHZIUFH-HNNXBMFYSA-N	448.495	1.973	50	20	IDGD	
COc1ccc(CN2CC[C@@H](NC(=O)NNC(=O)c3cncn3-c3ccccc3)C2=O)cc1	1318880270	NQONIZGCZNODIS-LJQANCHMSA-N	448.483	1.626	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)cn1	1319764070	WRHSPLMFXTZVBR-UHFFFAOYSA-N	431.924	1.713	50	20	IDGD	
Cn1cc([C@@H](NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c2ccccc2)cn1	1320079429	UDPONABIQCBRFS-SFHVURJKSA-N	431.456	1.401	50	20	IDGD	
O=C(NCc1cccc(OCC(F)(F)F)n1)NNC(=O)c1ccc(-n2cnnn2)cc1	1321360173	MPDSPHCIJGIVQO-UHFFFAOYSA-N	436.354	1.143	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)CC(=O)NNC(=O)c2cncn2-c2ccccc2)cc1F	1321880953	VCHHNMRMCSPPSO-UHFFFAOYSA-N	444.444	1.449	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2n[nH]c3c2CCCC3)cc1I	1322604300	MHZGVWXYZLYDIE-UHFFFAOYSA-N	440.241	1.977	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4c(c3)CCCC4=O)C2)C1	1777927325	GHAKLYASFXXVCG-XMSQKQJNSA-N	434.920	1.903	50	20	IDGD	
CC(=O)Nc1cc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](F)Cl)C2)ccn1	1778025596	DDOMQYPAGOBESS-IDHHARJASA-N	426.876	1.702	50	20	IDGD	
CCO/C=C/C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C1	1778094599	KDTIMTQDWJLZHH-LCWKFOBHSA-N	445.520	1.185	50	20	IDGD	
O=C([C@H](F)Cl)N1CCO[C@]2(CCN(C(=O)[C@H]3CN(Cc4ccccc4)CCO3)C2)C1	1778277395	YVUYNUZBMVHCGO-LQWHRVPQSA-N	439.915	1.252	50	20	IDGD	
C[C@H]1CCC[C@H]1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1	1779372208	BQZLQAGCEQQZAO-PMKZCDPUSA-N	443.548	1.249	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(C1)CN(C(=O)C1(F)CC1)CCO2	1780098732	SVCHIRXRWZOELE-IBGZPJMESA-N	435.408	1.466	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc(O)c(OC)c2)C1	1780444979	AIGSAZKGOYSPBN-RRMPHLOHSA-N	440.924	1.782	50	20	IDGD	
COc1nn(C)cc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Br)C1	1780771245	XXFUOSQONFDJFP-PBFPGSCMSA-N	447.305	1.247	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccccc3C(=O)OCCO)CCO2)C1	1781218439	PBLIEXCQQZEZTG-LAUBAEHRSA-N	438.908	1.297	50	20	IDGD	
Cn1cc2cc(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)[C@@H](O)CCl)C4)ccc2n1	1781236255	RSYIFFCIZHMNJF-WAOWUJCRSA-N	434.924	1.301	50	20	IDGD	
O=C([C@@H]1Cc2ccccc2O1)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781329991	PHBFGWIIZOJZRA-RLFYNMQTSA-N	427.270	1.511	50	20	IDGD	
C[C@H](Nc1cccnc1)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781330688	CYQJBNOQLIHDFW-RVSPLBMKSA-N	429.290	1.402	50	20	IDGD	
CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Cl)CCO2	1782049625	MRXNXHVVKAYESY-QAPCUYQASA-N	428.848	1.639	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)CCc3ccc(O)nn3)C2)C1	1782641796	XLPLVCUGKBCQKO-KDOFPFPSSA-N	441.326	1.118	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccn4cncc4c3)CCO2)C1	1783349968	XKRYBARUVUIMQF-LPHOPBHVSA-N	435.322	1.951	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN3CCSCC3)[C@H]2C1	1783499075	JLQHBMNQVNIXPV-VGWMRTNUSA-N	448.427	1.188	50	20	IDGD	
Cc1ccn2c(C(=O)N3CCO[C@@]4(CCN(C(=O)[C@H](C)Br)C4)C3)cnc2c1	1783538003	VIBYPPGMOMMOJG-IFXJQAMLSA-N	435.322	1.870	50	20	IDGD	
CCOC(=O)[C@@H]1CCC[C@H](C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](Cl)COC)C3)C2)C1	1783870412	BLOJWGSNQHEECV-GRXQJBFDSA-N	444.956	1.440	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)CCc3ncccc3OC)CCO2)C1	1783872755	GVKKEGHFIPPPJU-QRWLVFNGSA-N	425.913	1.107	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C/N=C/c3ccco3)C[C@@H]21	1783966465	FROLDSQBAOMNIY-PAZXJDCASA-N	440.338	1.709	50	20	IDGD	
COc1ccc(Cl)c(CC(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)c1F	1784052845	HHVIJHZFZRQFBD-KUHUBIRLSA-N	449.306	1.460	50	20	IDGD	
COc1cccc2[nH]cc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]4C3)c12	1784091908	CICGUTVVSPTYKF-ZKNMIIFVSA-N	435.908	1.370	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CC[C@H]4CCC(=O)N4C3)C[C@@H]21	1784620672	GIONWGYYPLZDRL-UGCZWRCOSA-N	439.984	1.775	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H]3[C@H]4COC[C@H]43)C2)C1	1784852422	QQBBXZHUTKVAGX-KAJAFPOMSA-N	443.450	1.594	50	20	IDGD	
CC(C)(C)OC(=O)N1CC=C(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](F)Cl)CCO3)CC1	1785319333	UKPXZQIBCSRQSQ-YWZLYKJASA-N	445.919	1.918	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc[nH]c4nccc3-4)[C@H]2C1	1787329945	MXTMTOUIWMLLIU-APYUEPQZSA-N	435.322	1.891	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3[nH]nc4ncccc34)[C@H]2C1	1787345827	IZABFMKJNNRRLS-XWUBHJNHSA-N	436.310	1.335	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4c(c3)n(C)c(=O)n4C)[C@H]2C1	1787962544	WPTYJCZWJFYMBM-FPXQBCRKSA-N	448.951	1.488	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC1(c2ccc(NC(=O)c3ccc4ncnn4c3)cc2)CCC1	1789388394	FPIDGAOCTCRANB-UHFFFAOYSA-N	449.515	1.850	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(CO)c(F)c3)C[C@@H]21)[C@@H](F)Br	1789926966	MHTLYFDQPVQZOU-DARAHFNDSA-N	447.276	1.602	50	20	IDGD	
CCOC(=O)C1(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]32)CC1	1790722128	BIBWLKXDRNNSNY-NUXNZHGMSA-N	435.348	1.546	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CSc3ncccn3)C[C@@H]21	1791058313	WEEBJJIHLUTASL-XUXIUFHCSA-N	443.367	1.332	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3snnc3C3CC3)C[C@@H]21	1791255001	YMVUSCBPKNMGBV-XUXIUFHCSA-N	428.942	1.263	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1ccc(C2(NC(=O)COc3ccc(O)nn3)CCC2)cc1	1791571655	XUKDLBZFQXUBBT-HNNXBMFYSA-N	434.880	1.949	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/c1ccc(O)cc1Cl)C2)[C@@H](O)CCl	1792982497	FLULOLQTPCXIDU-PBWHVCGRSA-N	429.300	1.248	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](NC(C)=O)C(C)(C)C	1793197895	WXPYNXCBHKEMLR-YIDVYQOGSA-N	446.386	1.300	50	20	IDGD	
Cc1ccc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCC(=O)NN(C)C)C3)cc1F	1793311163	MFRBESFMGUQLKF-FEJSZKPUSA-N	448.539	1.029	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN(C)C(=O)c1ccccc1)C2	1793447856	NTDLMBRLKDYPGJ-AJYBTWMASA-N	435.952	1.756	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnc(OC)c(F)c1	1794365116	KDCGRHNDQYZMAC-QVHKTLOISA-N	444.301	1.606	50	20	IDGD	
CC(C)c1nn2ccccc2c1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2	1796080422	UTZKTRMNUAGRDE-QHHYFVSCSA-N	434.924	1.261	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CCC[C@H]1C)C2	1796441948	JHFGKINVNLKMCZ-VOCBBQRYSA-N	429.521	1.146	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1cn2ccccc2n1	1796830863	BXFNBPRJKYPBSC-BAESOJJISA-N	425.258	1.228	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnoc1C1CC1)C2	1796889817	JZYIOSIBMLUEBE-TWXBYECESA-N	438.488	1.938	50	20	IDGD	
Cn1c(=O)c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)C(C)(C)CCl)C3)nc2ccccc21	1796995030	BCKDSXJMQPLNEH-XOIINTDNSA-N	446.935	1.402	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccnn1-c1ccccc1	1797239031	NIPXPUJPLUXPQW-GGPHIMKMSA-N	438.532	1.497	50	20	IDGD	
Cc1ccccc1OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)Br	1800756973	SDHXTZUHHUNEQV-ZXFNITATSA-N	425.323	1.747	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc2ccncc12	1800910986	QAAFXFZGYKLDNF-BJWYYQGGSA-N	444.495	1.799	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C[C@@H]1CNc3ccccc3O1)C2	1800976686	BZLPWKPPNDKCGK-YTMVRGIBSA-N	437.924	1.093	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(F)cc([N+](=O)[O-])c1)C2	1802338786	RYOPGIUQHQHMOS-MUJYYYPQSA-N	435.456	1.359	50	20	IDGD	
CSc1ccc(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CCC(=O)NN(C)C)cc1	1802339965	VEPQOCBBCVOKRY-BCDXTJNWSA-N	432.590	1.962	50	20	IDGD	
CC1(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)CCCC1	1802618640	GULLEYUICJXCJD-CTNGQTDRSA-N	435.333	1.661	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1CCN(C(=O)COCCO)[C@@H]1c1cccnc1	1803014621	JMHGFASUWZYVFM-UKPHBRMFSA-N	428.327	1.127	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2nccc3nc[nH]c23)[C@H]1c1cccnc1	1808138627	LBWNFORODWZYPU-ZRGWGRIASA-N	442.907	1.926	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)[C@H]1Cc2ccccc2CN1	1808321796	WNNNOFOEODNIGE-JSXRDJHFSA-N	442.947	1.402	50	20	IDGD	
CC1(C(=O)N2CC[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)CCC1	1810293747	GTEXMVRMINLXHP-QFBILLFUSA-N	436.516	1.590	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)NC[C@@H]1CCN(C(=O)CN)[C@@H]1c1cccnc1	1812442464	XEOAVEHFLIBISS-ODCFXIRZSA-N	425.439	1.931	50	20	IDGD	
COC(=O)NCC(=O)NC[C@@H]1CCN(C(=O)[C@H](C)CBr)[C@H]1c1cccnc1	1813262103	CBXDNRXSQWARMZ-INWMFGNUSA-N	441.326	1.474	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)[C@H]2CCc3nc[nH]c3C2)[C@@H]1c1cccnc1	1813327440	VQOLZAYPIWCPRX-FORWCCJISA-N	445.951	1.869	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CNCP(=O)(O)O)n[nH]1	1817232152	NIOSFMNEEUKEBB-AAEUAGOBSA-N	435.849	1.534	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@H](F)Br)[nH]n1)c1cnc(O)nc1O	1818021537	YUPXPJFBTLLTJF-ONGXEEELSA-N	443.233	1.607	50	20	IDGD	
C[C@@H]1CCC[C@@H]1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2	1818876560	OYORUQBMXVAIIC-WQVCFCJDSA-N	427.335	1.485	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)C2=COCC2)[nH]n1	1819404189	CWBQYVWWMIBLIC-INIZCTEOSA-N	425.449	1.018	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)C3=NNC(=O)C3)sc2C1	1819672984	FOXSNXSFEAYPLA-HTQZYQBOSA-N	428.312	1.105	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](N)CN)[nH]n1	1821777794	PCBLOKOHKIDRSA-HJXFBKQLSA-N	443.458	1.573	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CN1CCNC1=N)CC2	1822863975	WFOCPFUMTWEZOU-FVMDXXJSSA-N	433.365	1.131	50	20	IDGD	
O=C(CN1C(=O)CSC1=S)N1CCC([C@H]2CCCCN2C(=O)[C@H](O)CCl)CC1	1824186713	AVVQSZUHUFIUFJ-ZIAGYGMSSA-N	448.010	1.066	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)Cc1nnc(C)s1)CC2	1825998729	JBDWEXUPJOXZOE-ZJUUUORDSA-N	429.955	1.712	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)COc1ccccc1)CC2	1826085462	VFZFILYMRCUAMI-CQSZACIVSA-N	445.545	1.507	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(O)cc3F)C2)C1	1830363581	DEHISKDASOBEPA-FQEVSTJZSA-N	428.888	1.866	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CCc4nc[nH]c4C3)C2)C1	1830370091	HVAAHSWHYCBLOS-YCRPNKLZSA-N	438.956	1.236	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)CC(F)(F)F)C2)C1	1830537355	DXKLKBOBRKBDOF-FZMZJTMJSA-N	431.249	1.426	50	20	IDGD	
O=C([C@H](O)CCl)N1CCC([C@@H]2CCCCN2C(=O)c2nc3ccc(F)cn3n2)CC1	1831045559	IWYZJFNNJRQBDW-JKSUJKDBSA-N	437.903	1.701	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CSC3CCCC3)CCO2)C1	1831365116	ZXBFUCXDTUHFDJ-QFBILLFUSA-N	434.986	1.372	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C=N/N3CCCCC3)C2)C1	1831652241	XGGDBTRHJAINIV-ALQCXSEESA-N	428.961	1.322	50	20	IDGD	
CC(C)(CCl)C(=O)NC1CCN(C2CCN(C(=O)CCSC(=N)N)CC2)CC1	1833214152	GQIWMIQLKZTWEJ-UHFFFAOYSA-N	432.034	1.840	50	20	IDGD	
CC(=O)NCCC(=O)N1CCC(N2CCC(NC(=O)[C@H](C)CBr)CC2)CC1	1833264334	DDNXSELGQKFDGS-CQSZACIVSA-N	445.402	1.115	50	20	IDGD	
C[C@H]1CCc2c(C(=O)N3CCC(N4CCC(NC(=O)[C@H](O)CCl)CC4)CC3)n[nH]c21	1833310294	PDDFLIWDGVPOMU-SUMWQHHRSA-N	437.972	1.244	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3n[nH]c(C)c3F)CCO2)C1	1833674141	QIMTWFRDGIPWMK-PXAZEXFGSA-N	447.305	1.101	50	20	IDGD	
Cc1cccc(CCC(=O)NC2CCN(C3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)n1	1833743760	TUXZFVHTTBAPGV-FQEVSTJZSA-N	436.984	1.494	50	20	IDGD	
CCc1oncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1	1834519374	KWFMOQMDYXWHCX-LJQANCHMSA-N	425.558	1.159	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)Nc1cccnc1)CCO2	1835684055	CDTMDMDXPDTGPJ-MDKPJZGXSA-N	438.956	1.746	50	20	IDGD	
Cc1cc(CCC(=O)N2CCC(OC3CCN(C(=O)[C@H](O)CCl)CC3)CC2)ccn1	1836715716	WSWCNJKPDRKSAH-HXUWFJFHSA-N	437.968	1.921	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@H](CC)NC(N)=O)CC2)CC1	1836920182	YVEUPXLZEHVPMN-SJORKVTESA-N	430.977	1.839	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)CN3CCCC3=O)CC2)CC1	1837810099	VCOLQWORJRIJOT-CQSZACIVSA-N	444.370	1.391	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(F)ccc1F)CCO2	1838859892	XGYUAGWQVJJDRA-HXUWFJFHSA-N	442.535	1.886	50	20	IDGD	
Cc1ccc(O)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)c1	1838894448	TYGQIGPFZFFZLX-IFXJQAMLSA-N	441.322	1.554	50	20	IDGD	
CCOc1ncccc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](Cl)CC)CCO2	1839141304	DPHZQPUYUDTQQX-JXFKEZNVSA-N	425.913	1.568	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnn4c3CCC4)C2)C1	1839154714	VJRBBYGBSCSAPB-MOPGFXCFSA-N	445.347	1.136	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)C34CC(F)(C3)C4)C2)C1	1839962483	HFZDZEWFSXCAQV-HELAGCTPSA-N	433.318	1.509	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@]3(C)CC=CCC3)C2)C1	1840036961	UKPWTTWNZZFBCD-IPELMVKDSA-N	429.355	1.973	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccnc(C(F)F)c3)C2)C1	1840150819	QXWVHZWCOMFUDM-AUUYWEPGSA-N	447.866	1.343	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)C34CCC(CC3)CC4)C2)C1	1840156377	NIRPQKYRCOHMJH-HPAHXVRCSA-N	428.957	1.667	50	20	IDGD	
O=C(c1n[nH]c2ccc(F)cc12)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840188415	IILZSRJFSRGHEQ-GOSISDBHSA-N	445.278	1.576	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(NC(C)=O)cc3)CCO2)C1	1840727404	FDJKYLFWHTVHET-WIYYLYMNSA-N	437.924	1.732	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@H](NC(=O)OC(C)(C)C)C2CC2)C1	1843360633	FRIWRLJLKPALEY-GJZGRUSLSA-N	429.945	1.747	50	20	IDGD	
C[C@@H](Sc1cccs1)C(=O)N1CCCC12CN(C(=O)c1ccc(B(O)O)cc1)C2	1844167789	LYJUZHQZFQYRJV-CQSZACIVSA-N	430.360	1.426	50	20	IDGD	
CC(C)C[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl	1847569043	XIXZVRNYPIYTJW-YHUYYLMFSA-N	431.961	1.727	50	20	IDGD	
COc1ccc(-c2nn(-c3ccccc3)cc2C(=O)NNC(=O)C(=O)NC2CC2)cc1OC	10213697	KZGYHFUKVUGMBS-UHFFFAOYSA-N	449.467	1.596	50	20	IDGD	
COc1ccc(S(N)(=O)=O)cc1C(=O)NNC(=O)Cc1nc(-c2ccccc2)cs1	10600638	NWEDIWUGLSHLSK-UHFFFAOYSA-N	446.510	1.470	50	20	IDGD	
CCn1c(NNC(=O)CN2C(=O)N[C@]3(CCCC[C@@H]3C)C2=O)nc2ccccc2c1=O	10681420	OBOBGUGMVNKDRU-ZSEKCTLFSA-N	426.477	1.360	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(Br)cc2)C1)C1CC1	14290547	RIDZYNQUPFWQIF-GFCCVEGCSA-N	430.324	1.407	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)C1CCN(S(C)(=O)=O)CC1	14326263	CKNZCRMMKXWEFP-NSHDSACASA-N	448.339	1.035	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C2=CN3CCS(=O)(=O)N=C3C=C2)c(C)n1-c1ccccc1	15664364	RHKWPFWCNRLGIC-UHFFFAOYSA-N	439.497	1.353	50	20	IDGD	
CS(=O)(=O)c1cc(C(=O)NNC(=O)c2ccc(Br)s2)cc([N+](=O)[O-])c1	109039900	DFUWZBASSXZRLG-UHFFFAOYSA-N	448.276	1.897	50	20	IDGD	
O=C(Cc1csc(-c2cccc(Br)c2)n1)NNC(=O)C(=O)N1CCCC1	216354475	YSDFJSKSZOTHHH-UHFFFAOYSA-N	437.319	1.885	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)c2ccc(CN3C(=O)CNC3=O)cc2)cc1F	727499299	KENDHNXHUKVNLW-UHFFFAOYSA-N	431.449	1.518	50	20	IDGD	
CCC[C@@](C)(NC(=O)OC(C)(C)C)C(=O)NNC(=O)c1csc(N2CCOCC2)n1	727724345	XZBRYIYRZDJOFJ-LJQANCHMSA-N	441.554	1.824	50	20	IDGD	
COc1ccc(CCNC(=O)NNC(=O)CNC(=O)c2cccs2)c(OC)c1OC	727844478	UMOPLPGDVJKBFR-UHFFFAOYSA-N	436.490	1.077	50	20	IDGD	
Cc1nc(S(=O)(=O)N2CCN(C(=O)/C(C#N)=C\c3cc(C#N)n(C)c3C)CC2)cs1	728556885	YJWXEKHEQOMYRI-PXNMLYILSA-N	444.542	1.410	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2cccn(Cc3ccccc3)c2=O)n1	728730682	FTXXANUMKHYFHS-UHFFFAOYSA-N	440.481	1.208	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2cccc(C(=O)NNC(=O)c3cccc(C#N)c3)c2)C[C@@H](C)O1	728828550	ZKDPNQGTYOIRHH-GASCZTMLSA-N	442.497	1.431	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN1C(=O)Cc1ccccc1)C1CCN(c2ncccn2)CC1	728846963	XZJTWUWEOZTDGR-IBGZPJMESA-N	436.516	1.074	50	20	IDGD	
O=C(Cc1csc(N2CCCC2=O)n1)NNc1ccc(S(=O)(=O)C(F)F)cc1	728974596	WAHAEFZRJXABCS-UHFFFAOYSA-N	430.458	1.952	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)NC[C@H]3CCCO3)c2)c1	728977707	XXJZQBWDZGLIME-QGZVFWFLSA-N	428.470	1.090	50	20	IDGD	
CC[C@H](NC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1)c1nc(C)cs1	729623081	CYWRTKXMRZDZEG-HNNXBMFYSA-N	439.563	1.862	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)CCCc2ccc3c(c2)CC(=O)N3)n1	729760951	XTUDWGFMZVMQHD-UHFFFAOYSA-N	430.486	1.202	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC(=O)NNC(=O)COc1ccccc1[N+](=O)[O-]	730908910	ISPWWAIVMIBLAJ-CYBMUJFWSA-N	437.453	1.704	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)/C=C/c1ccccc1)C(=O)NNC(=O)c1c[nH]nc1C	732084205	QUFWASFNHJWAGW-SOGBHIHOSA-N	437.547	1.191	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)c1O	732276842	SZZIDOSVBZZFLP-NSHDSACASA-N	434.430	1.436	50	20	IDGD	
COCCOc1ccc(S(=O)(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1C	733122877	FURMAABWBORJQV-UHFFFAOYSA-N	430.486	1.829	50	20	IDGD	
Cc1ccc(-n2c(NNC(=O)[C@H]3CCS(=O)(=O)C3)nc3ccccc3c2=O)c(C)c1	733265205	LWEJUQRAIFOGKG-HNNXBMFYSA-N	426.498	1.880	50	20	IDGD	
CC(C)Oc1ccc([C@@H](O)CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1	734853949	FMVPRZLEIFANEM-KRWDZBQOSA-N	449.533	1.445	50	20	IDGD	
O=C(NCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNc1c(F)cccc1F	735754105	AEPKMABESZGCAL-UHFFFAOYSA-N	426.445	1.812	50	20	IDGD	
CN(CC(=O)NNC(=O)COCc1ccccc1)C(=O)c1ccc(Br)s1	737636603	SEVWDFKXGOERAP-UHFFFAOYSA-N	440.319	1.947	50	20	IDGD	
COc1ccc(S(=O)(=O)CCC(=O)NNC(=O)c2cccc(Cl)c2)cc1OC	740775341	RKUIBMVODXROEU-UHFFFAOYSA-N	426.878	1.982	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)Nc1ccc(F)c(-n2nnnc2C2CC2)c1	743213652	XGPURRDZSNSVSP-UHFFFAOYSA-N	427.396	1.616	50	20	IDGD	
Cc1cc(Br)ccc1C(=O)N1CCC[C@H](C(=O)NNc2nnc(C)c(O)n2)C1	743295235	IFVYBKFFGVMYOI-LBPRGKRZSA-N	449.309	1.952	50	20	IDGD	
CC(=O)N[C@@H](Cc1c[nH]c2ccc(Br)cc12)C(=O)NNc1nnc(C)c(O)n1	743295652	QCIHMICQIHGAQL-AWEZNQCLSA-N	448.281	1.320	50	20	IDGD	
C[C@@H]1CN(C(=O)NNC(=O)Cc2cccnc2)CCN1C(=O)Cc1cccc(Cl)c1	743589317	RPRUMPZIZGHSTP-OAHLLOKOSA-N	429.908	1.794	50	20	IDGD	
Cc1oc(-c2ccco2)nc1CC(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	744620929	IPIPJJQXXIZEGZ-UHFFFAOYSA-N	446.485	1.950	50	20	IDGD	
CC[C@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1ccncc1	745836205	NJYZGIJYHVCFJI-SFHVURJKSA-N	447.517	1.198	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)c1cc(=O)c2cc(Br)ccc2[nH]1	746640740	IMWNMYCXYYMWNP-UHFFFAOYSA-N	440.257	1.942	50	20	IDGD	
COc1cc(C(C)=NNC(=O)[C@@H](C)CN2CCOCC2)ccc1S(=O)(=O)C(F)F	747041186	HKFLVCSYWMHPDG-LBPRGKRZSA-N	433.477	1.500	50	20	IDGD	
O=C(CSCc1cscn1)NNc1ccccc1S(=O)(=O)N1CCOCC1	747421008	TWACWIKCZYMCKX-UHFFFAOYSA-N	428.561	1.541	50	20	IDGD	
Cc1ccc2ncccc2c1S(=O)(=O)NNC(=O)c1csc(N2CCOCC2)n1	748640355	MMLFTKMVHVYLDU-UHFFFAOYSA-N	433.515	1.460	50	20	IDGD	
COc1cc(OC)cc(N2CC[C@@H](NC(=O)NNC(=O)c3cc([N+](=O)[O-])ccc3O)C2)c1	748661813	NNMYQMRYLZVCDU-GFCCVEGCSA-N	445.432	1.541	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)c1cc(S(=O)(=O)N2CCC2)ccc1Cl	748849637	RXSNSORYWSYFHJ-UHFFFAOYSA-N	437.905	1.834	50	20	IDGD	
COc1ccc(-c2nnc(S)n2CC(=O)NNc2nc3ccccc3c(=O)n2C)cc1	752903619	KPRKYIBVGOWBFJ-UHFFFAOYSA-N	437.485	1.633	50	20	IDGD	
C[C@@H]1CCC[C@@H](C)C1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	754925824	FDSRSNGYNIQVEH-HUUCEWRRSA-N	438.550	1.476	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)Nc2ccc(S(=O)(=O)N(C)C(C)C)cc2)c1O	755454270	XKXMVQPXFAJXMQ-UHFFFAOYSA-N	436.490	1.896	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2cnc3c(c2)c(C)nn3C)cc1	755847073	JQWYBCJHLANIJA-UHFFFAOYSA-N	445.505	1.059	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)Nc1nnc(SCc2ccc(C#N)cc2)s1	756025074	GFLKEYNHEACSHX-LLVKDONJSA-N	436.519	1.906	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)Nc2ccc(OC)c(-n3nnnc3C)c2)cc1	756317844	CVXAERNYLIXENB-UHFFFAOYSA-N	427.421	1.220	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)Nc2ccc(S(=O)(=O)NC3CC3)cc2)cc1	756775917	MZRXYUYOMQOENZ-UHFFFAOYSA-N	429.458	1.231	50	20	IDGD	
Cc1nn([C@@H]2CCS(=O)(=O)C2)c(C)c1NC(=O)NNC(=O)c1cccc(Cl)c1	757872483	ZDYMUVFXZGIHEO-CQSZACIVSA-N	425.898	1.979	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)Nc1ccc(F)c(S(=O)(=O)NC2CC2)c1	757873124	HLFWDPKKQSZOLB-UHFFFAOYSA-N	440.428	1.637	50	20	IDGD	
O=C(NNC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-])C(=O)Nc1ccccn1	758835074	UILVJRWVALJSLM-UHFFFAOYSA-N	427.295	1.331	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NC2CCN(c3cccnn3)CC2)nc1	759604485	JWGUTWZPWKNDFT-UHFFFAOYSA-N	448.553	1.197	50	20	IDGD	
NC(=O)CC[C@@H](NC(=O)OCc1ccccc1)C(=O)NNC(=O)c1ccc(Cl)nc1	760138902	MBEMXZGYMWHANB-CQSZACIVSA-N	433.852	1.057	50	20	IDGD	
Cc1cc(C)nc(-n2nccc2NC(=O)C(=O)NNC(=O)Cc2c[nH]c3ccccc23)n1	760276259	BKLPTEBJDIYBRX-UHFFFAOYSA-N	432.444	1.089	50	20	IDGD	
CC(=O)N(CCc1ccccc1)CC(=O)NNC(=O)c1sc(N2CCOCC2)nc1C	761204425	ARLLJONGEMZMHD-UHFFFAOYSA-N	445.545	1.140	50	20	IDGD	
CCc1csc(-n2cc(C(=O)NNC(=O)c3csc(N4CCOCC4)n3)cn2)n1	762743255	QSXOJCMFUQBPDG-UHFFFAOYSA-N	433.519	1.259	50	20	IDGD	
CCOc1ccc(C(=O)N2CCCCC2)cc1NC(=O)C(=O)NNC(=O)c1ccccn1	763467563	QOFLALBBYYQKJN-UHFFFAOYSA-N	439.472	1.506	50	20	IDGD	
CC(=O)NCc1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2Br)cc1	763482819	KRSSJBYVEXAYMG-UHFFFAOYSA-N	433.262	1.485	50	20	IDGD	
Cc1cnn(-c2ccc(C(N)=O)cc2NC(=O)C(=O)NNC(=O)c2c[nH]c3ccccc23)c1	763541292	SJHJZKLRLRNOGD-UHFFFAOYSA-N	445.439	1.161	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc2c(c1)NC(=O)CS2	763679647	BORRCOMBTKZOBF-UHFFFAOYSA-N	444.469	1.294	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cnc(Br)cc2C)cc1C	763679792	LKQMFPJYIKZVKK-UHFFFAOYSA-N	435.278	1.934	50	20	IDGD	
C[C@H]1Oc2ccc(NC(=O)C(=O)NNC(=O)C34CC5CC(CC(C5)C3)C4)cc2NC1=O	763728294	QXNDIRBSYOTXNW-IURGJNOSSA-N	426.473	1.708	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2cc(OC)c(OC)c(OC)c2)c1	763774458	CNPDUEHZIOWQQF-UHFFFAOYSA-N	433.417	1.129	50	20	IDGD	
CCOc1ccc(OC)cc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccc(C(C)=O)cc1	763878909	UCYCMHJWBUHAJH-CQSZACIVSA-N	443.456	1.850	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)CSc2ccc(C)cc2)cc1NC(C)=O	763891666	RECHSNZBMYOYCF-UHFFFAOYSA-N	430.486	1.840	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccc3nc(-c4ccccn4)oc3c2)n1	763892333	YUAFBGNETBQYJX-UHFFFAOYSA-N	433.428	1.489	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc([S@](C)=O)c(F)c2)cc1OC	763900136	AZEJEHYGRULATE-PMERELPUSA-N	437.449	1.370	50	20	IDGD	
C=CCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2OC)cc1	764012153	MAXGEKXINMNUHW-UHFFFAOYSA-N	430.848	1.664	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cccc(Br)c2)cn1C	764063275	MLWVSWPGEIMTJI-UHFFFAOYSA-N	437.250	1.364	50	20	IDGD	
Cc1cc(C(=O)N2CCC[C@H](C)C2)ccc1NC(=O)C(=O)NNC(=O)CC(F)(F)F	764112597	MFRWFBUFQGOKAR-NSHDSACASA-N	428.411	1.905	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)CCc2ccc(OC)cc2)ccc1Cl	764132345	SUQRFBYTTYHNCK-UHFFFAOYSA-N	433.848	1.854	50	20	IDGD	
C[S@@](=O)Cc1cc(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)ccc1Cl	764163477	JKSNRDIGLCOJSX-GUNSETOZSA-N	435.889	1.308	50	20	IDGD	
C=CCN(CC=C)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)cc1	764164865	UOVUWAZTIJZSIE-FQEVSTJZSA-N	448.479	1.590	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)n(-c2ccc(Cl)cc2)n1	764169049	SLRJODJYVBNMBE-QGZVFWFLSA-N	439.859	1.924	50	20	IDGD	
O=C(CCc1ccco1)NNC(=O)C(=O)Nc1ccnn1Cc1cnn(-c2ccccc2)c1	764171375	JZLALBCLDCSDNA-UHFFFAOYSA-N	447.455	1.429	50	20	IDGD	
CN(C)CC(=O)NNC(=O)C(=O)Nc1ccc(NC(=O)c2ccoc2)cc1C(F)(F)F	764203667	JGOLUGRDFVOBHA-UHFFFAOYSA-N	441.366	1.198	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)CCCc3ccccc3)cn2)C[C@@H](C)O1	764225111	YJBXMNNOZSLMRZ-CALCHBBNSA-N	439.516	1.804	50	20	IDGD	
Cc1ccc(N2CCOC2=O)cc1NC(=O)C(=O)NNC(=O)CSc1ccccc1O	764403749	AHVGHMQYLDFEDO-UHFFFAOYSA-N	444.469	1.535	50	20	IDGD	
Cc1cccc(COc2ccc(NC(=O)C(=O)NNC(=O)[C@H]3COCCO3)c(C)c2)c1	764430648	YEAVYJDOAJHEHO-LJQANCHMSA-N	427.457	1.384	50	20	IDGD	
COc1nccnc1NNC(=O)CCNS(=O)(=O)c1ccc(Br)cc1	764469663	GEUGCMGPLJJKCL-UHFFFAOYSA-N	430.284	1.059	50	20	IDGD	
CSCCCNC(=S)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	764518670	HJXUWOJLGGJBPY-UHFFFAOYSA-N	430.043	1.706	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNc2ccc(OC)cn2)cc(Br)c1F	764673045	KXAFZKPERBKQKY-UHFFFAOYSA-N	441.213	1.860	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)/C=C\c3ccccc3)CC2)cc1	765730919	YCUJLQJRKHWMCH-XFXZXTDPSA-N	442.541	1.162	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)c1ccc([N+](=O)[O-])cc1F	765758837	QYPJQPCFEOIBGD-UHFFFAOYSA-N	449.870	1.966	50	20	IDGD	
C[C@@H](NC(=O)OC(C)(C)C)[C@H]1COCCC1=NNC(=O)c1ccc(-n2cnnn2)cc1	766015495	MIZSWYZXPNZRGK-CZUORRHYSA-N	429.481	1.698	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)C1(C(=O)NC2CC2)CCC1	766662976	ICRKGQMZTSSSTF-UHFFFAOYSA-N	447.967	1.054	50	20	IDGD	
CS(=O)(=O)Nc1ccc(N2CCN(C(=O)NNC(=O)c3cccc(C#N)c3)CC2)cc1	767209679	KTQIBZFGUYRQFL-UHFFFAOYSA-N	442.501	1.106	50	20	IDGD	
NS(=O)(=O)c1ccc2c(c1)oc(=O)n2CC(=O)NNc1c(Cl)cc(F)cc1Cl	767405246	MSOBULRYPJBXRU-UHFFFAOYSA-N	449.247	1.831	50	20	IDGD	
CC(C)NC(=O)c1ccc(C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1	767797661	IQBUPYSWVIDRGH-UHFFFAOYSA-N	428.401	1.351	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)c1ccc(S(C)(=O)=O)c(Br)c1	769742226	GKMFIZZNDZOPSB-UHFFFAOYSA-N	427.276	1.936	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@H](C)C(=O)NNC(=O)[C@H](NS(C)(=O)=O)C(C)(C)C	770750795	ZEYXEWBMQCJSRF-DOMZBBRYSA-N	433.958	1.835	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)C1(S(=O)(=O)c2ccc(Cl)cc2)CC1	771970350	XZMBTUBCOHKNRH-LBPRGKRZSA-N	430.910	1.772	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NN=Cc3ncc(C4OCCO4)s3)CC2)cc1	773068996	RNSQNORFOSBAGO-UHFFFAOYSA-N	429.546	1.765	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2Cc2ccccc2)nn1C	773494373	QWVVRGBXGLZIEN-UHFFFAOYSA-N	437.456	1.184	50	20	IDGD	
CC[C@H](C)NS(=O)(=O)Cc1cccc(NC(=O)C(=O)NNc2ccccc2[N+](=O)[O-])c1	773653564	AQZWLZRDFKJXQJ-ZDUSSCGKSA-N	449.489	1.895	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)c2cnc(O)c([N+](=O)[O-])c2)cc(OCC)c1OCC	776317684	KIAANCDOKJIKRI-UHFFFAOYSA-N	434.405	1.966	50	20	IDGD	
O=C([C@@H]1COc2ccc(Cl)cc2C1)N1CCN(S(=O)(=O)CBr)CC1	777780128	WAQMTOQXOBNPKM-LBPRGKRZSA-N	437.743	1.718	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2cc(OCC(F)F)ccn2)c2ccccc2c1=O	777883380	ZQLFLCBSSCXNMS-UHFFFAOYSA-N	431.399	1.920	50	20	IDGD	
Cc1cnn(-c2c(C(=O)OCC(=O)NNC(=O)c3cccc(Cl)c3)c(C)nn2C)c1	778550462	GITPVVALXCDJFO-UHFFFAOYSA-N	430.852	1.494	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cnn([C@@H](C)C3CC3)c2)cc1	778707854	QIKRBGQSSBIUDK-GXTWGEPZSA-N	427.461	1.610	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@H](C(=O)NNC(=O)c2ccc(Cl)cc2F)[C@@H](C)O)cc1	779532890	XCFBDCWCNMWEPI-BZNIZROVSA-N	443.884	1.276	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNS(=O)(=O)c1ccccc1S(=O)(=O)N(C)C	780369436	IYWLGSGLNWERHN-UHFFFAOYSA-N	447.922	1.222	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)C1(c2cc(C(F)(F)F)ccc2Cl)CC1	781919367	DWJKJSCDELYUFA-MRVPVSSYSA-N	427.832	1.476	50	20	IDGD	
O=C(COc1ccccc1NC(=O)C(=O)NNc1ncncc1Cl)Nc1cccnc1	782165505	GIXWVPJAVWNIMK-UHFFFAOYSA-N	441.835	1.624	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C(=O)Nc2cccc(CCN3CCCC3)c2)nc2ccccc21	782894961	SOVZNSMNUMHJFO-UHFFFAOYSA-N	448.527	1.540	50	20	IDGD	
Cc1cc(N(C)C)ccc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)NC(C)C)cn1	783265719	WRLZHAJALWMNGE-UHFFFAOYSA-N	434.522	1.225	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2cnc(Br)c(Br)c2)ncn1	783945910	SJHBBHZKNMIBCQ-UHFFFAOYSA-N	430.060	1.787	50	20	IDGD	
CCCCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNc2nccnc2Cl)cc1	784776780	UIANYXBOHLIFGO-UHFFFAOYSA-N	426.886	1.754	50	20	IDGD	
O=C(NNc1ccnc(Br)c1)C(=O)Nc1ccccc1CN1CCOCC1	784837626	ZPRUVSAMGBTIPM-UHFFFAOYSA-N	434.294	1.758	50	20	IDGD	
O=C(NNc1ccc(Cl)nc1)C(=O)Nc1ccccc1OCC(=O)N1CCOCC1	784874278	GULSFBLYYPDQQV-UHFFFAOYSA-N	433.852	1.054	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(F)c(NC(=O)C(=O)NNc2cc(F)c(F)c(F)c2)c1	785086947	LDIYQGYUIZRMOW-UHFFFAOYSA-N	434.371	1.575	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1ccc(F)cc1OC(F)F	785330787	MDXABGTWMLELLB-UHFFFAOYSA-N	447.391	1.921	50	20	IDGD	
O=C(NNC(=O)[C@@]1(O)CCc2ccccc2C1)c1cccc(S(=O)(=O)N2CCCC2)c1	785671216	ZQISTNDKFMRHIB-JOCHJYFZSA-N	443.525	1.152	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)[C@H]2CC(c3c(F)cccc3F)=NO2)c2ccccc2c1=O	785688490	COJPVSXDYMGTSR-OAHLLOKOSA-N	427.367	1.166	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)CC2(N3CCOCC3)CCCC2)cc1C	786098110	VPTQVDDWAALIOW-UHFFFAOYSA-N	437.562	1.958	50	20	IDGD	
CCNC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)c1C	789732383	NSRFFHVQXRLKHY-UHFFFAOYSA-N	438.444	1.173	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccccc1F)NNC(=O)c1cc(-c2ccccc2)on1	789905623	NZBQTUJATUXGQS-UHFFFAOYSA-N	432.433	1.610	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@@H](C(=O)NNc2cccc(F)c2[N+](=O)[O-])[C@H](C)O)cc1	791148253	UWUGHUXUHCRLPI-XHDPSFHLSA-N	426.426	1.213	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(F)ccc2-n2cccn2)c1	792807992	VAWRGBLYTTWLOH-UHFFFAOYSA-N	431.449	1.337	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cccc(N(C)C)c2)c(F)cc1C	793021823	LEWOOINJSCQYLB-UHFFFAOYSA-N	430.436	1.777	50	20	IDGD	
Cc1nn(C(C)C)c(C)c1CC(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	794180649	MWWJDPRUTDUUFO-UHFFFAOYSA-N	427.914	1.385	50	20	IDGD	
Cc1cccc(C(=O)NNS(=O)(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)n1	794599527	IPHUJZZJIBPKKW-UHFFFAOYSA-N	438.531	1.188	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)c(C)cc1C	797046599	NKHDDKSDQASBPY-UHFFFAOYSA-N	435.506	1.476	50	20	IDGD	
Cn1cc(-c2cc(F)ccc2NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)cn1	797092897	LBFUDOOHZFZWCY-UHFFFAOYSA-N	435.419	1.203	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNC(=O)C(=O)Nc1ccc(C(F)(F)F)cn1	797368518	CBVIAIPKUQAYDL-UHFFFAOYSA-N	439.350	1.113	50	20	IDGD	
CCOc1ccccc1CN1CCN(CC(=O)NNC(=O)c2cccc(C#N)c2)[C@@H](C)C1	799345247	WIKDETYKJMDGAK-SFHVURJKSA-N	435.528	1.924	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)N[C@H]1CCN(C(=O)Nc2ccccc2)C1	801077892	OQZFQKMMGXEMIP-YJBOKZPZSA-N	425.445	1.463	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)c2nn(-c3cc(C)ccc3F)cc2O)c1	801414093	GDQYNWIIVNYPSB-UHFFFAOYSA-N	426.404	1.952	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cc([N+](=O)[O-])c(F)cc3N)CC2)cc1	801927414	PRJCHRQQDCPGAZ-UHFFFAOYSA-N	444.467	1.203	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)Nc1ccc(Br)cc1)S(=O)(=O)C1CCOCC1	801998406	XPFXZKJVCXXHTI-JTQLQIEISA-N	434.312	1.584	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)N2CCC(C(=O)NNc3ncccc3F)CC2)o1	804212666	AZVHHFKEDXSEDL-UHFFFAOYSA-N	440.453	1.534	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(NC(=O)NNC(=O)c2cc(Cl)ccc2O)ccc1F	806543846	KSJBLIDRRGNTII-UHFFFAOYSA-N	430.845	1.902	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)NC[C@@H](c2cccs2)N2CCOCC2)nc2ccccc21	806994413	VURIOQQQLMKBBS-KRWDZBQOSA-N	442.545	1.581	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2cccc3cc(Br)cnc23)CCS(=O)(=O)C1	807001126	QRMJEPVFTQOUNI-MRXNPFEDSA-N	441.307	1.134	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)N1CCN(S(=O)(=O)c2c(F)cccc2F)CC1	807141936	XOYDBPCALZUXCG-UHFFFAOYSA-N	438.456	1.634	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)NCCn3cc(Br)cn3)nc21	807527896	BFHNDWGOXAFDGG-UHFFFAOYSA-N	438.290	1.572	50	20	IDGD	
CCc1nnc(NC(=O)[C@@H](C)[C@@H](C)NC(=O)NNC(=O)COc2ccc(C)cc2)s1	807565568	NHQSZMFYPHJXFN-QWHCGFSZSA-N	434.522	1.781	50	20	IDGD	
CC(C)(C)OC(=O)N1CCCc2c(CNC(=O)NNC(=O)C(=O)N3CCCC3)cccc21	807600354	FQBWHHJRQJKFSH-UHFFFAOYSA-N	445.520	1.827	50	20	IDGD	
Cn1nc(SCC(=O)NN=Cc2c[nH]c3ccc(C(C)(C)C)cc23)c(=O)n(C)c1=O	811637495	ZKTXDISBNMGFIX-UHFFFAOYSA-N	428.518	1.500	50	20	IDGD	
Cc1c(NC(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)c(=O)n(-c2ccccc2)n1C	812911973	INANOMMVDHEMNI-UHFFFAOYSA-N	444.517	1.883	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N2CCC[C@H](CS(C)(=O)=O)C2)cc1Br	814300037	IIFMTICIMASDST-NSHDSACASA-N	448.339	1.569	50	20	IDGD	
O=C(COC(=O)[C@@H]1CCCCN1C1CCCC1)NNC(=O)[C@@H]1COc2ccccc2O1	815444970	PEAHCBZVRXJVSO-LPHOPBHVSA-N	431.489	1.314	50	20	IDGD	
NC(=O)CCn1c(SCC(=O)NNC(=O)c2cccs2)nnc1-c1cccs1	817851171	LVDKTWPFIUBHTH-UHFFFAOYSA-N	436.544	1.497	50	20	IDGD	
NC(=O)N[C@@H](CC(=O)NNC(=O)COc1ccc(Br)cc1)c1cccs1	821904357	MVRIDLNSICLKOK-LBPRGKRZSA-N	441.307	1.837	50	20	IDGD	
CCOc1ccc(N2C[C@H](C(=O)NNC(=O)CNc3cccc(OC)c3)CC2=O)cc1	825810595	OXIOWCVWDSBUKP-OAHLLOKOSA-N	426.473	1.706	50	20	IDGD	
CC(=O)c1cccc(S(=O)(=O)NCC(=O)NNC(=O)COc2cc(C)ccc2C)c1	913449169	GJHAWHGYGWWCKS-UHFFFAOYSA-N	433.486	1.011	50	20	IDGD	
CCn1c(=O)nc(O)c2c(C(=O)NNC(=O)c3cccc(N(C)C)c3)cc(C3CC3)nc21	914437462	NGEOFZSIOMTMPB-UHFFFAOYSA-N	436.472	1.535	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)c1cccc(S(=O)(=O)NCC2CC2)c1	914595652	CGVOUCJTWIWFDA-UHFFFAOYSA-N	431.514	1.777	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cc(-c3c(C)nn(C)c3C)[nH]n2)cc(OC)c1OC	915685164	YZHIVPGHBKRTBH-UHFFFAOYSA-N	428.449	1.528	50	20	IDGD	
COc1ccccc1CCNC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	915903812	GRJZHDNKKJRELG-UHFFFAOYSA-N	446.529	1.666	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)NCCCN2C(=O)NC3(CCCC3)C2=O)c1	915906216	SGOPQFHPTBYSGN-UHFFFAOYSA-N	431.493	1.267	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=S)Nc2cccc(S(=O)(=O)N(C)C)c2)cc1	916112731	DLFSQAFWQWTMIF-UHFFFAOYSA-N	437.547	1.375	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NCCCN2C(=O)NC3(CCCCC3)C2=O)cc1	916268704	HEYIIEHBRIQHQY-UHFFFAOYSA-N	447.492	1.049	50	20	IDGD	
Cc1ccc(C(=O)NCCNC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])cc1F	916272381	PTDVLKLRRSZSBY-UHFFFAOYSA-N	433.396	1.182	50	20	IDGD	
CCn1cnc2c1c(=O)n(CC(=O)NN=Cc1c(C)noc1C)c(=O)n2Cc1ccccc1	916332259	SUOMFWMQJIZLKG-UHFFFAOYSA-N	449.471	1.183	50	20	IDGD	
O=C(NCc1cccc(N2CCCC2=O)c1)NNC(=O)c1csc(N2CCOCC2)n1	916516142	KDSYNHVSBFUASP-UHFFFAOYSA-N	444.517	1.251	50	20	IDGD	
Cc1cc(S(=O)(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)c2ncccc2c1	917724460	XDQCTWAWSGSQDH-UHFFFAOYSA-N	447.542	1.768	50	20	IDGD	
CCc1ccccc1OCC(=O)NNS(=O)(=O)c1ccc([C@@H](C)NC(C)=O)s1	918399917	TVPONJJAYDYRGJ-GFCCVEGCSA-N	425.532	1.896	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(N2CCCCC2)c(C(=O)NNC(=O)c2ccncc2)c1	919148060	VYAXTPGDJZUTRM-UHFFFAOYSA-N	431.518	1.397	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)c2cc(S(=O)(=O)N3CCCCC3)cn2C)cc1	919833858	HKFAUJIQEYTBON-UHFFFAOYSA-N	448.545	1.602	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNS(=O)(=O)c1ccc(F)c(S(C)(=O)=O)c1	920309047	PNHYAIOIYBHOQC-UHFFFAOYSA-N	446.478	1.016	50	20	IDGD	
COc1ccccc1CC(=O)NN=C(C)c1ccc(S(=O)(=O)N2CCOCC2)cc1	920375963	KBDKOKRSKPOZSJ-UHFFFAOYSA-N	431.514	1.799	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)c1nc(C2CC2)n(-c2ccccc2)n1	1116074231	DKCLYEJAVRKGPU-UHFFFAOYSA-N	429.481	1.613	50	20	IDGD	
C[C@H](CN1CCN(c2ccccn2)CC1)NC(=O)NNC(=O)c1cncn1-c1ccccc1	1251922808	CZBFQENXVWEKRF-GOSISDBHSA-N	448.531	1.422	50	20	IDGD	
C[C@H](O)CNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2ccc(Cl)cc2F)cc1	1262610015	GAZWHTFMPHNGNU-JTQLQIEISA-N	429.857	1.213	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)c1cc(Br)c(C=O)n1C	1324007225	NOXULFWZHJKBKR-UHFFFAOYSA-N	430.280	1.769	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H](C(=O)N2CC[C@@]3(CN(C(=O)[C@@H](F)Cl)CCO3)C2)C1	1778233983	LIRUTLGZCCKLBH-LPMFXHHGSA-N	433.908	1.608	50	20	IDGD	
Cn1cc(C(=O)N2CC[C@@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)c2cccnc21	1778770601	ONHCAQAAGNPFFV-OAQYLSRUSA-N	430.581	1.868	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C2(F)CCCCC2)C1	1778815081	MRHZUNDAAGCKAQ-DENIHFKCSA-N	446.328	1.166	50	20	IDGD	
O=C(/C=C/C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Cl)C2)NCc1ccco1	1779492283	XLHJKJKSCZTHQL-DGLVXXGDSA-N	441.887	1.500	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc4cccnn4n3)C2)C1	1779961171	NJQCEJRYEDHJIQ-MSOLQXFVSA-N	426.304	1.409	50	20	IDGD	
CCOC(=O)C1(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](F)Br)C3)CC1	1781626165	RYHXTGHAPVDTJJ-PBFPGSCMSA-N	449.317	1.534	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)N(C)C(C)=O)C2	1781899919	DGEPLDULCCYHRC-GKDNMFGBSA-N	446.386	1.541	50	20	IDGD	
C=CC(=O)N[C@@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](Br)CC)C1	1781901325	KUXIHDQDDDNLSS-NRTGNBEESA-N	444.370	1.365	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCOCCOCCOC)C1	1782061153	GURXYZIHYPIYJI-WAOWUJCRSA-N	448.988	1.587	50	20	IDGD	
COc1cc(C)c(C)cc1C(=O)N1CC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1	1782097684	BTVOGFQKRXWSEV-QHCPKHFHSA-N	446.548	1.129	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cn(C)c3ncccc13)C2	1782175387	KZBQLOTZFILADT-JBYIUTFZSA-N	448.951	1.955	50	20	IDGD	
CCN1CCC(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](Cl)COC)C2)CC1	1782177803	CPBDGSZBTMSWRM-DBXWQHBBSA-N	429.989	1.486	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)CCc3cccnc3OC)CCO2)C1	1783872618	DLYKFRISPLZPES-UZLBHIALSA-N	425.913	1.107	50	20	IDGD	
Cc1c(Cl)cccc1C(=O)N1CCO[C@@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1	1783933219	SAVYCKKFNKNXSM-OAQYLSRUSA-N	436.940	1.465	50	20	IDGD	
Cc1ccc2[nH]cc(CC(=O)N3CC[C@H]4CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]4C3)c2c1	1784086189	WOBOGFYRKIUZSN-HSCHXYMDSA-N	433.936	1.598	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H](CC(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](F)Cl)CCO3)C1	1784152512	NXATUEUOHJUAEU-DKICVRJWSA-N	447.935	1.998	50	20	IDGD	
CN(C)C(=O)c1cccc(C(=O)N2CC[C@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)c1	1785283348	JRSALNBPYDDKJB-QFIPXVFZSA-N	447.608	1.683	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc(N)s3)[C@H]2C1	1786935578	GJPTYZXJNYEJRA-YFKTTZPYSA-N	431.356	1.492	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc4ccoc34)C[C@@H]21)c1cccc(B(O)O)c1	1786985271	XTRBTSXYGIDHHS-YYWHXJBOSA-N	448.284	1.020	50	20	IDGD	
CC(C)(O)CC(=O)Nc1ccc(C2(NC(=O)c3cnccc3C(=O)NN)CCC2)cc1	1787843257	NXVCQSKPWYINBE-UHFFFAOYSA-N	425.489	1.594	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCCCn3cccc3)[C@H]2C1	1788712397	QMDZGSVRCIXQCP-UFYCRDLUSA-N	447.580	1.011	50	20	IDGD	
COc1ccccc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]2C1	1789924588	NNFBVCGIMGWMPM-DLKVLKDVSA-N	429.286	1.979	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=N/N3CCCCC3)C[C@@H]21	1791056455	ZXKRALIZVNIYGR-LRBDOGNESA-N	429.359	1.221	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)COc3cccnn3)[C@H]2C1	1791604063	MXTYUFGSMSTPIE-XQLPTFJDSA-N	441.326	1.009	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](C)C1(O)CCC1	1792550092	DQZAKIVVXOLTMF-NJSXQYKGSA-N	429.521	1.310	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)COc1ccc(Cl)c(F)c1	1793294633	FHCDBYTVWXDKJO-ABXQLRGKSA-N	449.306	1.701	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1c(F)ccnc1Cl	1794528589	OUVIFYZTXRHNPS-ZSBIGDGJSA-N	446.870	1.438	50	20	IDGD	
N[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCBr)c1cccc(Cl)c1	1795112500	HJSRPTBJXNUAQS-DLTLXFJOSA-N	444.757	1.714	50	20	IDGD	
O=C(Cc1cc(F)cc(F)c1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2	1795842624	SAQMEHHDAKEMMR-OJXGSEEGSA-N	435.240	1.787	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)c1cc(F)c(F)c(Cl)c1	1796192349	CCWVQCDSOFJTLN-MUJYYYPQSA-N	448.662	1.864	50	20	IDGD	
C[C@@H](NC(=O)c1ccc(F)cc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Cl	1796367694	PKBFAFAWWXJCPH-BCEUIYSSSA-N	429.851	1.068	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](F)Cl)c1nc2c(=O)[nH]c3ccccc3n2n1	1796808658	FZIJQOODXKPILN-FBKDDSFISA-N	432.843	1.357	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2cccnc2n1	1797359761	PQXVKSJYCSESTJ-OEYIWLLWSA-N	433.306	1.616	50	20	IDGD	
CC(C)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C=C/C(=O)NCc1ccco1	1797889917	GTSQDCZXXPQTDU-RKLKBWSTSA-N	437.924	1.307	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C=C/c1ccccc1N)C2	1798439077	AJDISJWJMJASDV-ORIYUZMUSA-N	434.500	1.233	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc3c(s1)CCC3)C2	1798439401	YBJIKUNTLBYDQQ-QDMKHBRRSA-N	439.541	1.801	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)N(C)C(=O)OC(C)(C)C	1799140215	QOZCYYFLDIIAOQ-IBEHDNSVSA-N	447.960	1.085	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cccc([N+](=O)[O-])c1)C2	1799274043	YGTPAVVRKVJWEH-QOIYZWAUSA-N	444.315	1.963	50	20	IDGD	
COc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Br)cc1F	1799343137	OKLQHVGOZCIKGN-BAESOJJISA-N	433.249	1.728	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)c1ccc(-c2cccnc2)cc1	1799430024	IBQHFDCCVMYVPJ-IYWMVGAKSA-N	429.904	1.552	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cccc(F)c1F	1800667220	ULIXBJLDVHOMQH-MMPOEDRJSA-N	431.277	1.880	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccc(SC)cc1	1801180405	MYOAGSKYPXYNLW-HIRMHNASSA-N	426.966	1.794	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cn1ccc3c(F)cccc31)C2	1802335182	YTDDFOBOASJBBY-BJWYYQGGSA-N	443.523	1.792	50	20	IDGD	
COc1cc(C)c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CCC(=O)NN(C)C)c(C)c1	1802338881	YUEKMPOLJALBPC-BCDXTJNWSA-N	430.549	1.937	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C(Cl)Cl)c1cccc(N2CCOCC2)n1	1802341152	XMZVGVQHKPPYPP-BTTYYORXSA-N	427.332	1.974	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](C)n1cc(C)cn1	1802925283	XISGBTWHSMUBJZ-INYIEUDKSA-N	439.520	1.525	50	20	IDGD	
COC(=O)NCC(=O)N1CC[C@H](CNC(=O)[C@H](C)CBr)[C@@H]1c1cccnc1	1803018197	YLMPZGNXORJWSH-XPKDYRNWSA-N	441.326	1.474	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2[nH]nc3ccncc23)[C@H]1c1cccnc1)[C@@H](O)CCl	1803139302	NZSQWCJOFHSJTR-OWQGQXMQSA-N	428.880	1.272	50	20	IDGD	
Cn1cc(C(=O)N2CCC3(CCCN(C(=O)[C@H](O)CCl)C3)CC2)c(C(F)(F)F)n1	1805522403	IMBINIXLTZYELQ-CYBMUJFWSA-N	436.862	1.883	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)[C@@H]2C[C@@H]2F)[C@@H]1c1cccnc1	1808408087	GPBFKUXVZXGEPR-YSNZMSLPSA-N	440.479	1.579	50	20	IDGD	
Cc1ccoc1C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1	1808498179	RGHWNFDQWUPOCD-QFBILLFUSA-N	448.483	1.615	50	20	IDGD	
COC[C@@H](NC(C)=O)C(=O)N1CCC2(CCCN(C(=O)CCBr)C2)CC1	1809067385	XVANNAOLNOESCG-OAHLLOKOSA-N	432.359	1.154	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)CN2CCN(C)CC2)[C@@H]1c1cccnc1	1809598329	JNPYOIYNCZUUCJ-ZJOUEHCJSA-N	436.000	1.742	50	20	IDGD	
C[C@H](Cc1ccco1)C(=O)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1	1809980186	KMKAYYBVZWGPKJ-GOSISDBHSA-N	438.333	1.683	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H](CNC(=O)[C@@H]2CNC(=O)C2)[C@H]1c1cccnc1	1812643996	UHUWWHAYXHXHIM-DZASIIFFSA-N	427.332	1.460	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)C2CCSCC2)[C@H]1c1cccnc1	1813074516	SOMBKJAMFGPYGO-RXVVDRJESA-N	447.605	1.604	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)C2(C#N)CCC2)[C@@H]1c1cccnc1	1813074793	VWOLAANRHWDBFN-FXAWDEMLSA-N	426.521	1.154	50	20	IDGD	
COC(=O)NCC(=O)NC[C@@H]1CCN(C(=O)[C@H](C)Br)[C@H]1c1cccnc1	1813268933	MALJLCBRRIVUFN-WHOFXGATSA-N	427.299	1.227	50	20	IDGD	
O=C(CN1C(=O)CSC1=S)NC[C@@H]1CCN(C(=O)[C@@H](F)Cl)[C@@H]1c1cccnc1	1814189146	MMSHBTNOEKMCHT-NILFDRSVSA-N	444.941	1.482	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@H]1CCc2nc(NC(=O)c3cnoc3)sc2C1	1817449573	UZXIDFFDUNVVQI-LUKCILAXSA-N	441.473	1.491	50	20	IDGD	
Cc1ccncc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1818335779	WPSDHRPFKOSTJC-IBGZPJMESA-N	433.277	1.413	50	20	IDGD	
Cc1cc[nH]c1C(=O)N[C@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1	1819793742	SFAUOKWAKCQBSJ-NSHDSACASA-N	439.501	1.318	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc(O)cc2)n[nH]1	1820577763	PLDQKEBEWCOWKY-SFHVURJKSA-N	449.471	1.734	50	20	IDGD	
C[C@H](Br)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CN2CCOCC2)[nH]n1	1822184820	WRUAYNVPUYQNSV-GXTWGEPZSA-N	428.331	1.517	50	20	IDGD	
O=C(CN1CCOC1=O)N[C@@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1	1822999635	VRSFCMFSBZYMOD-HQJQHLMTSA-N	435.275	1.198	50	20	IDGD	
CCN1CCC(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)CC1	1823553096	REBOLFOTGCKQQM-SFHVURJKSA-N	447.584	1.507	50	20	IDGD	
CC(C)c1nc(CC(=O)N2CCC([C@@H]3CCCCN3C(=O)[C@H](O)CCl)CC2)no1	1824178184	DXXMBTXBNQKGHL-JKSUJKDBSA-N	426.945	1.955	50	20	IDGD	
CC(C)(C)n1cc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)[C@H](O)CCl)CC2)nn1	1824184723	DGAGNBAZEOUSRI-DLBZAZTESA-N	425.961	1.866	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H]1CCC(=O)N1C)CC2	1825452022	UXPRDBXVXKPILI-NHCYSSNCSA-N	443.367	1.849	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(F)c[nH]3)sc2C1	1825736353	CEGUSHJCNTXWOX-SNVBAGLBSA-N	443.464	1.148	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1sc(N)nc1C)CC2	1825998779	JULQGSPFKHORIZ-RKDXNWHRSA-N	429.955	1.970	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)C1CC(F)(F)C1)CC2	1826081027	MKCSNMNGXLIKJC-NSHDSACASA-N	429.493	1.473	50	20	IDGD	
C[C@@H](Cc1ccco1)C(=O)N[C@@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1	1826091772	BTOBWVZCJOGSSQ-UONOGXRCSA-N	447.561	1.900	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H]1CCCS1(=O)=O)CC2)C(Cl)Cl	1826103748	ZVFGYEITLSPDTQ-XCBNKYQSSA-N	426.347	1.436	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H]3CCCS3)sc2C1	1827290440	XLXGLOJCAVTERO-QMTHXVAHSA-N	446.558	1.263	50	20	IDGD	
COC1(CC(=O)Nc2nc3c(s2)C[C@H](NC(=O)CCC(=O)NN(C)C)CC3)CCC1	1827410655	AFKNTUHLAPRDCX-CYBMUJFWSA-N	437.566	1.387	50	20	IDGD	
Cn1cc(CCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)cn1	1830357737	JCMLPUZMJYQTNS-HXUWFJFHSA-N	426.945	1.074	50	20	IDGD	
Cc1ccncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2	1830538473	GISVTJWRCAZTNH-HNAYVOBHSA-N	440.338	1.491	50	20	IDGD	
CCOC(=O)[C@@H]1CCC[C@H](C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)C1	1830701801	BCVRBQFNGMSERV-KSVNGYGVSA-N	448.919	1.347	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3nsnc3NC)C2)C1	1831638195	BWQCHEXQUGSUBU-PXAZEXFGSA-N	431.946	1.057	50	20	IDGD	
C[C@@H](Cn1cccn1)C(=O)N1CCC([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1	1831872046	MEJJGLDXTOCDNW-AZUAARDMSA-N	446.596	1.512	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)[C@H]2C[C@@]2(F)Cl)CC1	1831959273	SFINUHIXZROCAE-LQWHRVPQSA-N	436.720	1.524	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3ccc([N+](=O)[O-])o3)CC2)CC1	1833006215	NFGACXZYROYEEU-HNNXBMFYSA-N	442.900	1.627	50	20	IDGD	
O=C(/C=C/c1cccnc1)N1CCO[C@]2(COCCN(C(=O)CCBr)C2)C1	1833099653	FPRNUJHRDVDTJM-RTLBZRNLSA-N	438.322	1.336	50	20	IDGD	
C[C@@H]1CCc2c(C(=O)N3CCC(N4CCC(NC(=O)[C@@H](O)CCl)CC4)CC3)n[nH]c21	1833310292	PDDFLIWDGVPOMU-DYVFJYSZSA-N	437.972	1.244	50	20	IDGD	
O=C(CCBr)NC1CCN(C2CCN(C(=O)c3ccc(O)cn3)CC2)CC1	1834421217	RVGCLVVHOXSZFB-UHFFFAOYSA-N	439.354	1.757	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)C3(C(F)(F)F)CC3)C2)C1	1834821682	UCOFMTUNYOUCQB-AWEZNQCLSA-N	443.260	1.570	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](CN)c1ccccc1)CCO2	1835818767	QLGHGLNOTXRFKN-DENIHFKCSA-N	449.624	1.037	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC1CCN(C2CCN(C(=O)CCc3cnc[nH]3)CC2)CC1	1835834902	GXFDNIYNDNPXDY-UHFFFAOYSA-N	435.645	1.765	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)c1cc(Cl)ccn1	1835888827	SXAINWBPSAIFFJ-QGZVFWFLSA-N	429.348	1.520	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)n1cccc1C=O)CCO2	1835950875	XXOZOPBUQMTRDZ-MMOPVJDHSA-N	439.940	1.726	50	20	IDGD	
O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)C1(F)CCCCC1)CCO2	1836613662	JDMBZIFBLCVIRH-KRWDZBQOSA-N	435.334	1.900	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)C/N=C/c3ccco3)CCO2)C1	1837566741	JNWUEFIORDGASU-NJIURKFCSA-N	446.331	1.391	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3sccc3F)C2)C1	1837710322	VDQCBPBUALADGB-SFHVURJKSA-N	430.574	1.809	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3nccc4nc[nH]c34)CC2)CC1	1838053939	QKYLWDFBMWBXCD-MRXNPFEDSA-N	449.939	1.824	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)c(C)n1	1838364236	KQWFXNVGLCWHKJ-KUHUBIRLSA-N	440.338	1.552	50	20	IDGD	
CCn1nc(C(C)C)cc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1838812676	PORQEKXUQHLJEQ-VQIMIIECSA-N	430.908	1.631	50	20	IDGD	
O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(F)cc1)CCO2	1838954640	QTPPIFWPIJKFKT-GOSISDBHSA-N	429.286	1.681	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnn(C(C)(C)C)c3)C2)C1	1839143250	PYACOZZQBYMUGA-JXFKEZNVSA-N	426.945	1.726	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)Oc3cccnc3)C2)C1	1839148444	ADXCZNQEDADCBK-KNBMTAEXSA-N	425.913	1.323	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)c3ccccc3Cl)C2)C1	1839148458	AFAVNHFKRRCIDW-MDYRTPRTSA-N	445.343	1.847	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(C)on3)C2)C1	1839963725	UCOAHWXYFLULGF-CXAGYDPISA-N	430.299	1.227	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C13CC(C(=O)OC)(C1)C3)CCO2	1840004820	QWXQHFFHLKJWSM-DTBAYKQASA-N	442.940	1.194	50	20	IDGD	
O=C(C(Cl)Cl)N1CCO[C@@]2(COCCN(C(=O)C3(c4ccc(O)cc4)CC3)C2)C1	1840186271	DZZNCCVXPGFNOM-IBGZPJMESA-N	443.327	1.684	50	20	IDGD	
CCOc1cccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)c1O	1840189499	VKGLCUDWGNDRDH-IBGZPJMESA-N	447.315	1.665	50	20	IDGD	
CSc1ccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)cc1	1840302730	IHLVYHZAQXPWQW-HKUYNNGSSA-N	430.929	1.942	50	20	IDGD	
O=C([C@H](F)Cl)N1CCOC[C@]2(C1)CN(C(=O)C1(c3ccccc3F)CC1)CCO2	1840858662	LEWKCYQJCDXGDD-LPHOPBHVSA-N	428.863	1.848	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)N2CC3(CCCN3C(=O)[C@@H](O)CCl)C2)C1	1841353940	ZBKSAVRYLUDWAE-CABCVRRESA-N	429.945	1.437	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)c2nc3ccc(C(F)(F)F)cn3n2)C1	1843156016	RSZJEAFKOVMQGJ-LBPRGKRZSA-N	445.829	1.819	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1cccc3nccn13)C2	1843416748	VVCVYFBHQOEUBH-MFKUBSTISA-N	433.472	1.285	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC2(CCCN2C(=O)c2ccc3nc(CO)[nH]c3c2)C1	1843669451	VUVLTBWOSZLRRZ-GFCCVEGCSA-N	435.322	1.903	50	20	IDGD	
COC(=O)C12CCC(C(=O)N3CCCC34CN(C(=O)CCC(=O)NN(C)C)C4)(CC1)CC2	1843943284	VSBGMUIFULQGHN-UHFFFAOYSA-N	448.564	1.076	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@](C)(C(=O)N2CCCC23CN(C(=O)[C@H](F)Cl)C3)[C@@H](O)C1	1843982867	XEYVQPJRMDLXRG-NJSLBKSFSA-N	447.935	1.732	50	20	IDGD	
O=C([C@H](F)Br)N1CC2(CCCN2C(=O)c2ccc(OCCCO)cc2)C1	1844705827	RDJYVCOAGGFTDI-HNNXBMFYSA-N	429.286	1.955	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCCC12CN(C(=O)c1ccc(S(C)(=O)=O)cn1)C2	1845169324	COMSGMWXKGILPB-MRXNPFEDSA-N	434.345	1.538	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@H]1CCN(C(=O)OC(C)(C)C)C1)C2	1846362750	UFROZGXTLKSNDY-LSDHHAIUSA-N	429.945	1.701	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)Cc1c(F)ccc(F)c1F)C2	1846384195	PJXHLUJBYZXBGV-UHFFFAOYSA-N	426.439	1.223	50	20	IDGD	
C#CCCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl	1847565405	PHRAPTOTELSANQ-QAETUUGQSA-N	441.956	1.485	50	20	IDGD	
O=C(COC(=O)Cc1cc(Cl)c2c(c1)OCCO2)NNC(=O)c1ccc([N+](=O)[O-])cc1	12961485	MLIWHAVEIOYTIB-UHFFFAOYSA-N	449.803	1.566	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(F)ccc2Br)c1	16594198	OSQMCLIKBFGZFW-UHFFFAOYSA-N	444.282	1.913	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)n(C)c1	23567505	FVSGDPNKGGJWEY-CYBMUJFWSA-N	440.497	1.423	50	20	IDGD	
CCS(=O)(=O)N1CCC(C(=O)NNC(=O)c2ccc(OC(C)C)c(OC)c2)CC1	23787317	BBXSSJDALSXYMA-UHFFFAOYSA-N	427.523	1.305	50	20	IDGD	
CC[C@@H](C)NS(=O)(=O)c1ccc(C(=O)OCC(=O)NNC(=O)c2cccs2)cc1	24656092	ZEJFNMHEPZGPRV-GFCCVEGCSA-N	439.515	1.443	50	20	IDGD	
O=C(CNC(=O)c1ccco1)N/N=C1/C(=O)Nc2c(Br)cc(Cl)cc21	111943407	LGRLGQKJPCSVTL-UHFFFAOYSA-N	425.626	1.898	50	20	IDGD	
COCCCNC(=S)N(C)NC(=O)CSc1nnc(C)n1-c1cccc(OC)c1	726077280	UVDNFQUFCORMNT-UHFFFAOYSA-N	438.579	1.550	50	20	IDGD	
Cc1cc(C)c(NCC(=O)NNC(=S)NCc2ccc(S(N)(=O)=O)cc2)c(C)c1	726441786	ZTIDQRGKFQFAHT-UHFFFAOYSA-N	435.575	1.367	50	20	IDGD	
O=C(NNC(=O)N1CCO[C@@H](c2cccc(F)c2)C1)c1csc(N2CCOCC2)n1	727473324	IAXZZQGGCRAULJ-MRXNPFEDSA-N	435.481	1.547	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)[C@@H]1CC(=O)N(Cc2ccccc2)C1	728209523	DRFYTUSSUYNTJI-MRXNPFEDSA-N	428.514	1.619	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)c2ccc(N3CCOCC3)nc2)c1	728529734	MMKRRNYPNJWWCP-UHFFFAOYSA-N	435.278	1.764	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)[C@@H]2CCCN(C(=O)Cc3ccccc3)C2)cn1	729692649	YEELCXDPXHHYEE-MRXNPFEDSA-N	427.530	1.889	50	20	IDGD	
CC(C)(C)C(=O)N1CSC[C@@H]1C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	730074487	ZBIWGAZCVIWHNJ-GOSISDBHSA-N	447.605	1.294	50	20	IDGD	
CCCNC(=O)NNC(=O)CCC(=O)N[C@H](C)C(=O)c1ccc(Br)cc1	732063470	WYXMBWIUBHQVLK-LLVKDONJSA-N	427.299	1.657	50	20	IDGD	
CSCC[C@H](NC(=O)Cc1ccccc1)C(=O)NNC(=O)[C@@H]1COc2ccccc2O1	732749657	CXFXNMZZKKGIAJ-LPHOPBHVSA-N	443.525	1.454	50	20	IDGD	
CON(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1	733110327	IUCUQVUGEOZGHJ-UHFFFAOYSA-N	429.458	1.129	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)N[C@H]2CCCN(C(=O)OC(C)(C)C)C2)nc2ccccc21	734218422	JNNRODQPVURHEJ-AWEZNQCLSA-N	430.509	1.846	50	20	IDGD	
Cn1c(O)nc2cc(C(=O)NNC(=O)NC3CCN(C(=O)OC(C)(C)C)CC3)ccc21	734824902	MHIXGKCLYYVCCX-UHFFFAOYSA-N	432.481	1.622	50	20	IDGD	
C[C@H]1OC(C)(C)N(C(=O)OC(C)(C)C)[C@H]1C(=O)NNC(=O)c1ccc2c(c1)OCCO2	735839695	FGQMTOPKOAYHOG-MLGOLLRUSA-N	435.477	1.979	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N(C)Cc2ccon2)cc1	739800021	KGXSRXPNEAMPRL-LFIBNONCSA-N	434.456	1.988	50	20	IDGD	
O=C(COC(=O)c1cc(O)nc2cc(F)ccc12)NNC(=O)[C@@H]1COc2ccccc2O1	740258812	OIRNSHSFTZIZMQ-KRWDZBQOSA-N	441.371	1.224	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NCC[S@](=O)C(C)(C)C)c2ccccc2c1=O	741412064	KSDXMWJPQQYMOV-PMERELPUSA-N	435.550	1.688	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(Br)c(F)c1)c1cc([N+](=O)[O-])ccc1O	743268134	DQEZTHDFIJUTFK-UHFFFAOYSA-N	434.199	1.825	50	20	IDGD	
COc1ccc(OCC(=O)NN[C@@H](C(N)=O)c2ccc(Br)cc2F)cc1	743465200	WPWBJEFYFIHWIS-MRXNPFEDSA-N	426.242	1.823	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)[C@H](C(C)C)N2C(=O)c3ccccc3C2=O)c1	744450899	KIMKPOMAEWBDGW-IBGZPJMESA-N	437.452	1.620	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)C[C@@H]2CN(Cc3ccccc3)CCO2)c1	745101163	HFCHYNANYDINNU-HXUWFJFHSA-N	425.485	1.590	50	20	IDGD	
Cc1ccc(CN2C(=O)CC[C@H]2C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)cc1	745593489	SBJQFNAZCDAJMJ-IBGZPJMESA-N	434.452	1.362	50	20	IDGD	
CC(=O)Nc1ccccc1CNC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	745859471	ZDJSELLZEODXJK-UHFFFAOYSA-N	438.532	1.688	50	20	IDGD	
CC(=NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1)c1ccc(NS(C)(=O)=O)cc1	747042296	OEVUTRSQDZTTER-UHFFFAOYSA-N	444.922	1.513	50	20	IDGD	
O=C(NNC(=O)[C@H]1CC(=O)N(c2ccc3c(c2)OCCO3)C1)c1cccc2cccnc12	747427727	VUKXWATWCJDZAI-HNNXBMFYSA-N	432.436	1.820	50	20	IDGD	
CCNC(=O)NNS(=O)(=O)c1c(Br)cc(C(=O)O)cc1Br	747609611	VXIKMYIROLQQCD-UHFFFAOYSA-N	445.089	1.422	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1ccc(C)c(C(=O)NNc2nccn(C)c2=O)c1	747946143	UPBCWFPSKYMWNU-UHFFFAOYSA-N	443.485	1.655	50	20	IDGD	
O=C(NNc1ccccc1F)c1cc(O)nc2ccc(S(=O)(=O)N3CCOCC3)cc12	748056504	BWBXRIUMRZRYLN-UHFFFAOYSA-N	446.460	1.857	50	20	IDGD	
O=C(CCNS(=O)(=O)c1cccnc1)NNc1nc(-c2ccccn2)nc2c1CCC2	748337308	FCDVCGPIMJQZAW-UHFFFAOYSA-N	439.501	1.234	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)NCC2CCN(S(C)(=O)=O)CC2)cc1OC	748827004	BHCDKMOKJSBVDQ-UHFFFAOYSA-N	442.538	1.100	50	20	IDGD	
O=C(COc1ccc(OCc2ccccc2)cc1)NNC(=O)N[C@H]1CC(=O)N(C2CC2)C1	750656247	WECXAAWXNALEKC-KRWDZBQOSA-N	438.484	1.738	50	20	IDGD	
CC[S@](=O)[C@H]1CCC[C@@H](NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)C1	750669834	DSSAMXYPFZMJRV-URWSEJSBSA-N	449.621	1.609	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C2=NN(c3ccccc3)[C@H](C(C)=O)C2)cc(OC)c1OC	750845872	RJPOEUOXCCXYER-KRWDZBQOSA-N	440.456	1.697	50	20	IDGD	
CCOc1ccc(S(=O)(=O)Nc2ccc(C(=O)NN=Cc3cnnn3C)cc2)cc1	751130601	DTUNNKVJKAFICT-UHFFFAOYSA-N	428.474	1.779	50	20	IDGD	
CCOc1ccc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)N[C@@H]3CCOC3)cc2)cc1	752699602	WKXCSFGGYQDHHQ-MRXNPFEDSA-N	448.501	1.619	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)c2cc(S(=O)(=O)N(C)C)oc2C)cc1F	753429985	WHRWKOONHOIVBK-UHFFFAOYSA-N	430.483	1.617	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)[C@H](C)CS(=O)(=O)c1ccc(F)cc1	755046771	HAOLFJCDWNHMBG-CQSZACIVSA-N	446.504	1.995	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2cc3c(cc2Cl)OCO3)c1	755572115	IDYADQKZHOTKFH-UHFFFAOYSA-N	440.865	1.786	50	20	IDGD	
C[C@@H](c1ccc(NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1)N1CCOCC1	756508387	JHJNDFHYFTYAJJ-HNNXBMFYSA-N	446.529	1.950	50	20	IDGD	
CCCS(=O)(=O)Nc1ccc(NC(=O)NNC(=O)COc2ccc(C#N)cc2)cc1	756569918	ACDHZFKFNHUIPM-UHFFFAOYSA-N	431.474	1.942	50	20	IDGD	
CCOC(=O)Cc1nnc(NC(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)s1	757755044	GSHCWNQYKYVTCI-UHFFFAOYSA-N	433.425	1.639	50	20	IDGD	
O=C1CCSc2ccc(C(=O)N3CCN(S(=O)(=O)CBr)CC3)cc2N1	758534825	JTZPWWSVGOOSPQ-UHFFFAOYSA-N	448.364	1.561	50	20	IDGD	
Cc1c(C(=O)OCC(=O)NNC(=O)c2ccccc2)cnn1CCO[C@H]1CCCCO1	758618626	JTSUTDPGAKXPPE-IBGZPJMESA-N	430.461	1.353	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)c1ccc(Br)cc1-n1cncn1	760122862	DNJAMZHDJSCCQS-UHFFFAOYSA-N	445.277	1.912	50	20	IDGD	
COC(=O)CS(=O)(=O)Cc1ccc(CNC(=O)NNc2c(F)cccc2F)cc1	760198880	HNVAVUYQRIGTSI-UHFFFAOYSA-N	427.429	1.879	50	20	IDGD	
CC1(C)C(=O)N(C[C@@](C)(O)C(=O)NNC(=O)Cc2cn3ccccc3n2)c2ccccc21	760393953	ANEJOWAHSCEFDG-HSZRJFAPSA-N	435.484	1.100	50	20	IDGD	
N#CCOc1cccc(CC(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)c1	760649165	QZDHSEVMYSWMAM-UHFFFAOYSA-N	430.486	1.296	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cccc1N1CCOC1=O	763446747	WTZHFRXXRWSTGQ-UHFFFAOYSA-N	427.373	1.260	50	20	IDGD	
O=C1CCc2cc(F)c(NC(=O)C(=O)NNC(=O)c3cc4ccccc4cc3O)cc2N1	763528562	VKGNAEILRJJXCC-UHFFFAOYSA-N	436.399	1.969	50	20	IDGD	
O=C(NNC(=O)c1ccccc1O)C(=O)Nc1cnn(-c2ccccc2Br)c1	763529804	NKHOMCRNVRZRSN-UHFFFAOYSA-N	444.245	1.740	50	20	IDGD	
CCN(CC)CCOc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)cc1	763552064	WBEJBNQOZMDJTB-UHFFFAOYSA-N	442.472	1.536	50	20	IDGD	
CC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1Cl	763574474	BRFYWNMWHHPVJX-MRXNPFEDSA-N	432.820	1.224	50	20	IDGD	
CCOC(=O)N(C)c1ccc(NC(=O)C(=O)NNC(=O)c2c(C)nc3ccccn23)cc1	763627928	FUGXHSLKASZTCG-UHFFFAOYSA-N	438.444	1.635	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(-n3cncn3)c(Cl)c2)c1	763629789	IBHSUTDQJFDHRF-UHFFFAOYSA-N	428.836	1.394	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2cc3c(cc2F)CCC(=O)N3)c1	763646109	BOOSVEIISYTPLL-UHFFFAOYSA-N	428.420	1.492	50	20	IDGD	
Cc1ncc(NC(=O)C(=O)NNC(=O)COc2ccc(OCc3ccccc3)cc2)cn1	763678798	CTKLGMGEEMQJJO-UHFFFAOYSA-N	435.440	1.529	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(C)c(NC(C)=O)c1C	763714570	YQNDYTBXANTNMY-UHFFFAOYSA-N	426.473	1.989	50	20	IDGD	
CCOC(=O)/C=C\c1ccc(NC(=O)C(=O)NNC(=O)c2cc(OC)cc(OC)c2)cc1	763775448	RCHRWBAGHMAIQA-YFHOEESVSA-N	441.440	1.680	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)C(=O)Nc2ccccc2OCC2CC2)c2ccccc2c1=O	763785657	KTCBCCAGUPQQME-UHFFFAOYSA-N	435.440	1.122	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2cc(F)c(F)c(F)c2)c2ccccc2c1=O	763785710	LHCWLADJAICJGX-UHFFFAOYSA-N	433.346	1.233	50	20	IDGD	
CCCNC(=O)[C@@H]1CN(C(=O)C(=O)NNC(=O)c2ccc(CC)cc2)c2ccccc2O1	763831646	QRJLTMRMQZMACO-IBGZPJMESA-N	438.484	1.330	50	20	IDGD	
CNC(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)c1	763864664	FCCAVQQRBZOXEN-JTQLQIEISA-N	436.827	1.392	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1cnn(Cc2ccccn2)c1	763870709	BSFAGEJNGUYKJP-ZDUSSCGKSA-N	426.408	1.019	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)n1	763886327	SYNMPZYIJYEYRK-UHFFFAOYSA-N	432.440	1.950	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)C(=O)Nc2ccc(OCC(=O)N(C)C)cc2)cc1	763890870	HJGYBKDGOFLTHD-UHFFFAOYSA-N	444.513	1.340	50	20	IDGD	
O=C(NNC(=O)c1ccc[nH]1)C(=O)Nc1ccc(CN2CCN(c3ccccn3)CC2)cc1	763980056	BRMCXSLFQVTXGL-UHFFFAOYSA-N	447.499	1.132	50	20	IDGD	
COC(=O)Nc1cc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)ccc1F	764006546	QHCHKQPXRSHSJK-UHFFFAOYSA-N	432.364	1.175	50	20	IDGD	
CC(=O)Nc1cc(NC(=O)C(=O)NNC(=O)c2cccc(Br)c2)ccc1F	764059426	UYXRHSKIZMMJJZ-UHFFFAOYSA-N	437.225	1.946	50	20	IDGD	
O=C(NNC(=O)c1ccc(F)cc1Br)C(=O)Nc1cccc(-n2ccnn2)c1	764085790	OPBJERGPAFELSH-UHFFFAOYSA-N	447.224	1.569	50	20	IDGD	
N#Cc1cc(Cl)ccc1-n1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)nc2)n1	764100214	JCVPMNGYSIDUFQ-UHFFFAOYSA-N	444.238	1.845	50	20	IDGD	
O=C(NNC(=O)c1ccoc1)C(=O)Nc1cccc(CS(=O)(=O)Cc2ccccc2)c1	764159597	YZFOCHGNJYFZDN-UHFFFAOYSA-N	441.465	1.794	50	20	IDGD	
C=C(C)COc1cccc(NC(=O)C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1	764260866	SIBRQVGNIKRIAA-UHFFFAOYSA-N	438.488	1.434	50	20	IDGD	
CC(C)(C)NC(=O)c1ccccc1NC(=O)C(=O)NNC(=O)CCc1ccccc1O	764280682	FMWVZLRWNNDNEV-UHFFFAOYSA-N	426.473	1.639	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(Oc3cnccn3)c2)c(OC)c1	764287247	YFYXDCGHULGXOO-UHFFFAOYSA-N	437.412	1.686	50	20	IDGD	
O=C(Cc1cc[nH]n1)NNC(=O)C(=O)Nc1ccc(OCc2ccccc2Cl)cc1	764292565	FFISTRGTTTUWFA-UHFFFAOYSA-N	427.848	1.971	50	20	IDGD	
CS(=O)(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc3ccccc3o2)cc1F	764331400	CPSGEMFICZITDZ-UHFFFAOYSA-N	433.417	1.516	50	20	IDGD	
CS(=O)(=O)c1c(Cl)cccc1NC(=O)C(=O)NNC(=O)c1ccc(O)c(Cl)c1	764349430	OGNWSTNQIYZLLK-UHFFFAOYSA-N	446.268	1.502	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)C(=O)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1	764385776	IXHUNPOXHPIAEX-SFHVURJKSA-N	447.499	1.433	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)C(=O)N1C[C@@H]2CCCN2c2ccccc21	764401733	RIIDQDVKJDMEQX-AWEZNQCLSA-N	426.498	1.647	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	765759053	SUBGMOSNSSKIPP-UHFFFAOYSA-N	449.964	1.097	50	20	IDGD	
Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C(=O)NNC(=O)c1cc(Br)cn1C	766258620	IHWHAVFDPLDUEQ-UHFFFAOYSA-N	438.238	1.712	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1cccc(CN(C)C(=O)OC(C)(C)C)c1	766271262	MOTGUCVUCMUFTL-UHFFFAOYSA-N	430.465	1.934	50	20	IDGD	
O=C(CSc1cccc(Br)c1)NNC(=O)c1ccc(-n2cnnn2)cc1	766757713	OUBKHDPTVNSTBR-UHFFFAOYSA-N	433.291	1.978	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1)S(=O)(=O)c1ccc(F)cc1	768288697	AEHLTWOUROXFBM-NSHDSACASA-N	434.424	1.978	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)/C=C/C(=O)Nc1ccc2n[nH]cc2c1	768635129	VYFCFZLMVDDCSM-CMDGGOBGSA-N	429.458	1.613	50	20	IDGD	
O=C(COC(=O)CSCc1ccc(F)cc1)NNC(=O)[C@@H]1COc2ccccc2O1	769673712	JATJXQMHFGHZKC-KRWDZBQOSA-N	434.445	1.590	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)[C@H]2CC(=O)N(c3c(F)cccc3F)C2)cc1	771154231	SDIQAOSWUNJEQY-AWEZNQCLSA-N	431.395	1.631	50	20	IDGD	
Cc1cc2c(cc1C)[C@H](C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1)CO2	771735434	QCILLYMEEFCCEP-QGZVFWFLSA-N	445.545	1.254	50	20	IDGD	
CN1CCC/C1=N/S(=O)(=O)c1cccc(NC(=O)C(=O)NNc2cccc(C#N)c2)c1	773680590	CJJCNMTXYCBAOQ-BWAHOGKJSA-N	440.485	1.453	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccc(C(=O)N(C)C)cc1	774010710	YUFUUYHHBUAROB-GFCCVEGCSA-N	432.864	1.595	50	20	IDGD	
CC[C@H](NC(=O)NNc1cccc(S(C)(=O)=O)c1)c1cccc(S(N)(=O)=O)c1	776620206	LBXVPYCEGOZMDO-INIZCTEOSA-N	426.520	1.515	50	20	IDGD	
O=C(NNC(=O)c1cn(-c2cccc(Cl)c2F)nn1)c1ccc(-n2cnnn2)cc1	776702643	KIKORQHMPIKOQR-UHFFFAOYSA-N	427.787	1.110	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)c1nn(-c2ccc(F)c(F)c2)c2c1CCC2	778435926	AHMMHFIZZCDFHV-UHFFFAOYSA-N	435.431	1.925	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@@H](C(=O)NNC(=O)c2ccc3ccccc3c2)[C@H](C)O)cc1	779500091	LEIULDDZNIBAJP-MGPUTAFESA-N	441.509	1.637	50	20	IDGD	
CC(=O)Nc1ccc(C)c(C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)c1	780170959	FXVGEWKYKPVZBD-UHFFFAOYSA-N	432.502	1.344	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1S(=O)(=O)NNC(=O)c1cccc2ncccc12	780386116	CWCCFVSSJSEFLO-UHFFFAOYSA-N	434.499	1.108	50	20	IDGD	
COC(=O)CC(C)(C)CC(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	780645500	BZUUJABBKYHLOY-UHFFFAOYSA-N	438.956	1.584	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)CNC(=O)c3ccc([N+](=O)[O-])c(C)c3)n[nH]2)cc1	782570808	PYVGKVYNTRKTEG-UHFFFAOYSA-N	436.428	1.793	50	20	IDGD	
CSc1cccc(NC(=O)C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)c1C	782896353	GPJZVEDFNILULQ-UHFFFAOYSA-N	449.558	1.718	50	20	IDGD	
Cn1cnn(-c2ccc(NC(=O)C(=O)NNC(=O)c3ccc(Cl)cc3Cl)cc2)c1=O	782926352	NOEKBGFWNVSNOG-UHFFFAOYSA-N	449.254	1.278	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2cc(Cl)ccc2N2CCCCC2)CCS(=O)(=O)C1	783425979	KURDUEVIEXNPFD-SFHVURJKSA-N	428.942	1.467	50	20	IDGD	
CON(C)S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2cccc3c2CCCC3)cc1	783451132	HCQODVVJAIFRNN-UHFFFAOYSA-N	432.502	1.829	50	20	IDGD	
O=C(NNC(=O)c1ccccc1-n1ccnn1)c1cccc(S(=O)(=O)N2CCCC2)c1	783698576	KHWRSJVNHGOXQF-UHFFFAOYSA-N	440.485	1.127	50	20	IDGD	
CC(C)(C)OC(=O)N[C@]1(C(=O)NNc2ncnc3[nH]cnc23)[C@@H]2CCCO[C@H]2C1(C)C	783899528	IYEDSWOLQBLBAS-YZRASEIHSA-N	431.497	1.895	50	20	IDGD	
CCC(=O)c1cccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)c1	784215922	HGQASMPELBOFMD-UHFFFAOYSA-N	430.486	1.802	50	20	IDGD	
CCOC(=O)[C@@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNc2cc(Cl)ccn2)cc1	784860322	ACGFXJHMXSWMHO-LLVKDONJSA-N	433.852	1.498	50	20	IDGD	
O=C(NNc1ccc(Cl)nc1)C(=O)Nc1ccc(C(=O)N2CCOCC2)c(Cl)c1	784874839	NASLFLBICQGMQY-UHFFFAOYSA-N	438.271	1.943	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2ccc(S(=O)(=O)NC(C)C)cc2)n1	785225104	CVAHLMRYKZFVLL-UHFFFAOYSA-N	449.537	1.091	50	20	IDGD	
CC[C@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNc2nccc(N(CC)CC)n2)cc1	785226152	QUBRQPFLXHEXFP-AWEZNQCLSA-N	427.509	1.933	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(C#N)cc2)cc1C(=O)N1CCCCC1	787542838	RXBAAIVQJSSERS-UHFFFAOYSA-N	433.468	1.893	50	20	IDGD	
CC(C)(C(=O)NNC(=O)C(=O)Nc1ccc(Cl)c(S(C)(=O)=O)c1)c1ccccc1	788332812	HAGUAVDZVALMKL-UHFFFAOYSA-N	437.905	1.807	50	20	IDGD	
Cc1ccc(C)c(-n2cnc3cc(C(=O)NNC(=O)N[C@H]4CCS(=O)(=O)C4)ccc32)c1	788500706	AFSLHTIKEFKNQL-INIZCTEOSA-N	441.513	1.773	50	20	IDGD	
Cc1ccnn1-c1ccccc1NC(=O)C(=O)NNC(=O)[C@H]1OCC[C@H]1c1ccccc1	789812286	KBXOYIQDKJWKHO-PXNSSMCTSA-N	433.468	1.839	50	20	IDGD	
Cn1nc([C@@H]2CCCOC2)cc1NC(=O)C(=O)NNC(=O)CCSc1ccc(F)cc1	790952513	RGWMXEUPHAZWFB-CYBMUJFWSA-N	449.508	1.722	50	20	IDGD	
COc1cc(N2C[C@H](C(=O)NNc3nc4ccccn4n3)CC2=O)cc(OC)c1OC	791260644	QIRXNXSLCRMXPR-GFCCVEGCSA-N	426.433	1.251	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cccc1NC(=O)N(C)C	792350418	JQEZRWCDFAIQRC-KRWDZBQOSA-N	441.444	1.014	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N2C[C@H](C)O[C@]3(CCOC3)C2)cc1Br	792932108	LWDACGFSGMOADH-APPDUMDISA-N	428.283	1.692	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(C)(C)[C@@H]1C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	793032969	RRZGMKMOVDETBE-AWEZNQCLSA-N	425.507	1.497	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNc2ccc3c(=O)[nH]ccc3c2)c(C)c([N+](=O)[O-])c1	793069874	KGRORYQHRQJHJU-UHFFFAOYSA-N	439.384	1.613	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C2CCN(c3oc(C)nc3C#N)CC2)o1	793185673	LIZTWEKOMPKWEF-UHFFFAOYSA-N	428.493	1.967	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(C)(C)[C@@H]1C(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	793770298	BATLRTMGDHAYPI-AWEZNQCLSA-N	438.912	1.749	50	20	IDGD	
CCc1cc(C)cc(CC)c1NC(=O)C(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	796989564	HLIMSOHBIMFFIM-UHFFFAOYSA-N	435.484	1.766	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)[C@H](C)NS(=O)(=O)c2ccc(C#N)cc2)c2ccccc2n1	799010126	RXFZVKRLZFYNBY-AWEZNQCLSA-N	437.481	1.543	50	20	IDGD	
CCc1c(Br)cc(C(=O)NNC(=O)C(=O)NC2CC2)cc1Br	800324066	KPBQWIJVJHOIDK-UHFFFAOYSA-N	433.100	1.814	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@]1(C)CCN(CC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)C1	801572961	JWIYWCWTIVVFRW-FQEVSTJZSA-N	435.481	1.593	50	20	IDGD	
CN(C(=O)OC(C)(C)C)[C@@H](C(=O)NNC(=O)CSc1ccccc1O)c1cnn(C)c1	802942013	MLUKNCXXHXYYQK-QGZVFWFLSA-N	449.533	1.973	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2ccc3ccccc3n2)cc1	811240308	BDAIFUIEUJWWRR-UHFFFAOYSA-N	428.470	1.234	50	20	IDGD	
O=C(NC[C@@H]1CCCCN(Cc2ccccc2)C1)NNC(=O)c1ccc(-n2cnnn2)cc1	811851716	OPPMOXWIUQYLLO-IBGZPJMESA-N	448.531	1.909	50	20	IDGD	
Cc1ccc(CN2C(=O)CC[C@H]2C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)cc1	812729043	CTRWANBVJBZEEY-IBGZPJMESA-N	430.530	1.880	50	20	IDGD	
COC(=O)c1cn(-c2cccc(NC(=O)NNC(=O)COc3ccccc3OC)c2)nn1	812977745	QEQKHJCWONPTGS-UHFFFAOYSA-N	440.416	1.294	50	20	IDGD	
CCN(C)C(=O)c1cccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)c1	813033572	ZWQUEAKBGIYAPO-UHFFFAOYSA-N	447.517	1.111	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2nc(C(C)(C)C)ns2)cc1	813033685	GNUHBPXVQRPWHX-UHFFFAOYSA-N	426.524	1.168	50	20	IDGD	
CC(=O)c1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)cc1Cl	813033791	LKILPCCJGZVEIS-UHFFFAOYSA-N	438.893	1.875	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)c1cnn(C)c1I	814737205	YLRWCAATJAMXPX-QMMMGPOBSA-N	432.193	1.392	50	20	IDGD	
NS(=O)(=O)c1ccc(NC(=O)NN=C2C(=O)Nc3cc(OC(F)(F)F)ccc32)cc1	814968272	WTRBAYUHJKFOPC-UHFFFAOYSA-N	443.363	1.711	50	20	IDGD	
O=C(COC(=O)[C@@H]1CCCN1C(=O)c1ccccc1)NNC(=O)c1cccc([N+](=O)[O-])c1	912681420	FTLRMLNEHYKHFZ-KRWDZBQOSA-N	440.412	1.204	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C1=NN(c2ccc(F)cc2)[C@H](C(N)=O)C1	913082949	CHQQGUXZAJCMLW-HNNXBMFYSA-N	433.827	1.369	50	20	IDGD	
Cc1nc(C(F)(F)F)ccc1C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	914587379	IDVHWXNYHPEXOQ-AWEZNQCLSA-N	439.346	1.553	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNS(=O)(=O)c2cc(C(=O)O)c(O)cc2C)cc1	914688979	SQBHAEXNMULLLQ-GFCCVEGCSA-N	438.458	1.575	50	20	IDGD	
O=C(NNC(=O)c1cn(-c2ccccc2)nn1)c1cccc(S(=O)(=O)N2CCCC2)c1	914710195	KNIWGZPGEDLXTB-UHFFFAOYSA-N	440.485	1.127	50	20	IDGD	
CCCS(=O)(=O)NC1CCN(C(=O)/C(C#N)=C\c2cc(C)n(CCOC)c2C)CC1	915160586	OUHZRUIHUGLONT-RGEXLXHISA-N	436.578	1.979	50	20	IDGD	
CN(C)N(C(=O)[C@@H]1CC(=O)N(Cc2cccc(C(F)(F)F)c2)C1)[C@H]1CCS(=O)(=O)C1	915830353	XWYCLPYRRGAFLD-ZBFHGGJFSA-N	447.479	1.546	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCC2(N(C)C)CCCCC2)cc1	915891182	VGRDVEIEXVXLPO-UHFFFAOYSA-N	439.582	1.210	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)NCCNS(=O)(=O)c2ccccc2)c1C	916295102	IWCQXICDWHXPEB-INIZCTEOSA-N	434.518	1.380	50	20	IDGD	
CC(C)Cn1cnc2c1c(=O)n(CC(=O)NN=Cc1ccc[nH]1)c(=O)n2Cc1ccccc1	916331846	LSJJLUQVMIYDHW-UHFFFAOYSA-N	447.499	1.542	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)[C@@H]2CC(=O)N(c3cccc(Br)c3)C2)c1O	919755968	MEQKJMFWYOCNOR-LLVKDONJSA-N	448.273	1.977	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)c2ccc3c(c2)CCN3S(C)(=O)=O)o1	920248654	NAWMNPQCOCVUNS-UHFFFAOYSA-N	434.518	1.518	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)o1	920272288	JVSHQYDWNDLWOH-UHFFFAOYSA-N	448.545	1.981	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2ccc(C(=O)NNC(=O)CN3CCCC3=O)cc2)cc1C	920827040	QXIKCRFMRKVIKO-UHFFFAOYSA-N	444.513	1.488	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)c1cccc(N2CCCC2=O)c1	920979271	DRVPYQYAQHFVLG-AWEZNQCLSA-N	448.483	1.766	50	20	IDGD	
C[C@H]1CC[C@@H](C)N1[C@@H](C)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	1320622455	IWGOFLGBICORIM-BBWFWOEESA-N	436.578	1.884	50	20	IDGD	
CCNC(=O)c1ccc(CNC(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1	1322970751	XGQWUSQNANYHOQ-UHFFFAOYSA-N	447.536	1.914	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)N[C@H]1COc2c(F)cc(F)cc2C1	1356382888	SGISHKWRDFMXSH-GFCCVEGCSA-N	439.444	1.206	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc3c(n1)OCCO3)C2)[C@@H](F)Cl	1778025557	CCRPALZDNOOOCT-SPYBWZPUSA-N	427.860	1.515	50	20	IDGD	
Cc1cc(C)cc(C(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1	1779032456	KOBPIFHFAHNRDJ-HSZRJFAPSA-N	437.500	1.059	50	20	IDGD	
CN1Cc2ccccc2C[C@@H]1C(=O)N1CCO[C@@]2(CCN(C(=O)CO[Si](C)(C)C)C2)C1	1779294325	NYWVTBQVLAQZLV-NFBKMPQASA-N	445.636	1.725	50	20	IDGD	
CCc1[nH]nc(C(=O)N2CCO[C@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)c1Cl	1779296113	JYNIYZUCOLVPIK-SFHVURJKSA-N	428.993	1.921	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](C)Nc3ccccn3)C2)C1	1779323674	QAPPMKXHFVVFLO-CLCXKQKWSA-N	439.354	1.743	50	20	IDGD	
COc1cccc(CC(=O)N2CCO[C@@]3(CCN(C(=O)[C@](C)(Cl)CCl)C3)C2)n1	1781224095	HLSCDEGWCORTTR-MOPGFXCFSA-N	430.332	1.699	50	20	IDGD	
CC(=O)N/C(C)=C/C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@](C)(Cl)CCl)C2	1781463707	LDPSGQFRXMHNCG-IZECBSCFSA-N	434.364	1.777	50	20	IDGD	
CC(=O)N/C(C)=C/C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)Br)C2	1781465339	VWMKIVIDWBUWCC-OWZNBKATSA-N	430.343	1.324	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ncccn1)C2	1781899703	DDINXQGSLRHBDA-HBUWYVDXSA-N	425.327	1.778	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1c[nH]c(=O)cn1)C2	1781902501	ACPWYVCDOHNXCD-WPKBUWHJSA-N	441.326	1.071	50	20	IDGD	
O=C(Cc1ccc2c(c1)CCO2)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2	1781947693	VTNCMEIFXABNBC-LRXVAGHRSA-N	436.936	1.278	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(CCN(C(=O)c3ccnc4ncccc34)C2)C1	1782339058	NFTJJDAYDXJZMD-NRFANRHFSA-N	428.565	1.925	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cc4cccnc4nc3O)CCO2)C1	1783538504	XSKIIOOXAFQPSJ-BLVKFPJESA-N	449.305	1.562	50	20	IDGD	
O=C(c1ccc(OCCCO)cc1)N1CCO[C@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783948508	RFYAEZLYSBJHQA-IBGZPJMESA-N	431.316	1.695	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnn4c3CCC4)C[C@@H]21	1783973235	VMSODMLVGGOETL-HPZZRFSDSA-N	439.354	1.454	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C\c3c[nH]c4ccccc34)C[C@@H]21)[C@H](O)CCl	1784086158	VRCHLLIEPLQFEJ-OLCHUJGPSA-N	431.920	1.761	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(Cl)cc(Cl)n3)C[C@@H]21)[C@H](O)CCl	1784090964	FUZPAALJNIFJIW-VMXABPDPSA-N	436.723	1.581	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](C)Oc3cccnc3)C2)C1	1784539707	NOZAVRKMHCQGDO-CLCXKQKWSA-N	440.338	1.710	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)c1	1785112411	HPZFCGWCCNJXRU-ORAYPTAESA-N	438.322	1.872	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H]2C[C@H]2C[C@@H]1C(=O)N1CC[C@]2(CN(C(=O)[C@@H](F)Cl)CCO2)C1	1785591411	GFSKOOVBZPFDGC-AHGCTEEOSA-N	445.919	1.749	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(C)nn3C)[C@H]2C1	1786029112	GEBHRYXQMWRNTL-AYDFFVQHSA-N	427.343	1.495	50	20	IDGD	
C[C@@](O)(C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCBr)[C@H]2C1)C(F)(F)F	1786400873	CFFFXMBKTGXGBW-AYGWYOGXSA-N	431.249	1.064	50	20	IDGD	
Cc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](O)CCl)C[C@@H]32)n(-c2ccccc2)n1	1787532297	VPFQLAAYTRNIFC-UHMOLFJZSA-N	446.935	1.374	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]2C1	1789871493	CSOADBYOAYZJOP-IAGXKZSMSA-N	430.170	1.986	50	20	IDGD	
COc1ccc(F)c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Cl)C[C@@H]32)c1OC	1790160227	PRGNJZOGCYVMGE-PMOCNGQXSA-N	432.851	1.971	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnn4c3CCC4)[C@H]2C1	1790390629	HBGZVUNBBWHLPJ-DUPGQFARSA-N	425.327	1.206	50	20	IDGD	
CCC(=O)N[C@@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](Br)CC)[C@H]2C1	1790958215	MMHLBOUPZRWANZ-LXFSFDBISA-N	432.359	1.054	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](C)Br)[C@H]3C2)cc(O)n1	1791057070	APQNXIPTBDFZRT-JURCDPSOSA-N	426.311	1.472	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CC34CCCN3CCC4)C[C@@H]21	1791060885	LFUBQBTZXKMSDB-QZWWFDLISA-N	442.398	1.768	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3Cc4ccccc4CN3)C[C@@H]21)C(Cl)Cl	1791295596	PPDYXHSQALSKBA-NXOAAHMSSA-N	426.344	1.484	50	20	IDGD	
CSCC[C@H](O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]21	1791308224	WUJIPAACCANXMK-GGOFEBJYSA-N	427.394	1.316	50	20	IDGD	
CC(C)(C)OC(=O)NCC1(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](O)CCl)CC1	1793107203	VKCYAZRQPUMOOG-LXTVHRRPSA-N	429.945	1.529	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1C[C@H]1F)C2	1793879039	BMQHAPCACZHSHD-DEPYFDJDSA-N	433.908	1.066	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1=C2c3ccccc3C(=O)N2CC1	1798451027	DPCGEJCXEAWIPL-GTYSZEQSSA-N	443.931	1.864	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)c1ccc(N2CCCC2)c(F)c1	1798557792	CUFDFAZBMRWRTL-QXGSTGNESA-N	439.915	1.229	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@]1(C)C[C@H]1C	1799165592	WPYCTHJDBHBBMP-QCRSQXJJSA-N	445.472	1.769	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccnc2ncccc12	1799977174	BPGFFMQGVAMSOH-CCWDJLKJSA-N	428.565	1.685	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](O)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CO[Si](C)(C)C)C2	1800599620	JEGLSAFGXASKBB-HLPPOEQASA-N	429.590	1.319	50	20	IDGD	
N#Cc1ccc(F)c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)c1	1800685200	QAFLFNLVZSUHOD-QDMKHBRRSA-N	436.447	1.261	50	20	IDGD	
CC(C)(C)OC(=O)NC12CC(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@H](F)Cl)C4)(C1)C2	1800701234	XPTUBUFZXXBMPZ-BALXUMTASA-N	445.919	1.558	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C=C/c1cc(F)c(F)c(F)c1	1800873068	XTTHOXKGFVMBDZ-WBXNVRACSA-N	446.853	1.961	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)COc1ccccc1F	1801809228	ZFZMRWKFHXFKBO-QDMKHBRRSA-N	441.463	1.155	50	20	IDGD	
C=CCNC(=O)/C=C\C(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)Br)[C@@H]1c1cccnc1	1802491242	XKRAUDMQUUHFQT-ADGJCKPVSA-N	449.349	1.729	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)[C@@H]2CC=CCC2)[C@@H]1c1cccnc1	1803029714	ZBZSHTYDUZRINX-MMOPVJDHSA-N	448.527	1.756	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cc3ncccc3[nH]2)[C@H]1c1cccnc1)[C@@H](O)CCl	1803146396	ASCJMHWHHALYMT-JVPBZIDWSA-N	427.892	1.877	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cccc3nccn23)[C@@H]1c1cccnc1)[C@H](O)CCl	1803146547	BPPBXSMRHAWCBI-KVSKMBFKSA-N	427.892	1.649	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)C2=CCCS2)[C@@H]1c1cccnc1	1803639723	IQDVOCLSSOVCBU-JXFKEZNVSA-N	431.562	1.481	50	20	IDGD	
Cc1cccnc1C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1803806998	UGZDIOHJOMBJJY-PGRDOPGGSA-N	438.532	1.478	50	20	IDGD	
Cn1cccc(C(=O)NC[C@H]2CCN(C(=O)CCBr)[C@H]2c2cccnc2)c1=O	1803829050	DPSJTLKSVDTURC-QAPCUYQASA-N	447.333	1.885	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C(/C)C(=O)O	1804172149	NPPUVVVATXVXNH-FUUYKEDTSA-N	445.428	1.803	50	20	IDGD	
O=C(c1cc(-c2ccccn2)[nH]n1)N1CCC2(CCCN(C(=O)[C@H](O)CCl)C2)CC1	1805522348	GZERREOJOICKRL-GOSISDBHSA-N	431.924	1.916	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)c2ccc(F)cc2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1	1807373434	BCDSSKIHGKTIST-KNQAVFIVSA-N	447.275	1.534	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)c1cccc2c1OCCO2	1809232367	DKZWXZGLJVYNPM-WDYCEAGBSA-N	445.903	1.772	50	20	IDGD	
Cc1onc(C(=O)N2CCC3(CCCN(C(=O)c4ccc(B(O)O)cc4)C3)CC2)c1C	1809969415	VODJUJRFCYCHRU-UHFFFAOYSA-N	425.294	1.130	50	20	IDGD	
Cc1nc(C(=O)N2CCC3(CCCN(C(=O)c4cccc(B(O)O)c4)C3)CC2)sc1C	1809978053	RVMCIOHOGZHYBJ-UHFFFAOYSA-N	441.362	1.598	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)no1	1810297827	FFJYFQDGIFJHJW-DNVCBOLYSA-N	449.471	1.010	50	20	IDGD	
CC(=O)N/C(C)=C/C(=O)NC[C@H]1CCN(C(=O)CO[Si](C)(C)C)[C@@H]1c1cccnc1	1812320065	WCTMEXMSKOEDBV-PTUDVVCWSA-N	432.597	1.979	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)CCn2ccnn2)[C@@H]1c1cccnc1	1813435232	GPHYIDLYPYLMOW-LXZKKBNFSA-N	435.326	1.553	50	20	IDGD	
CNc1nsnc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](Cl)COC)[nH]n1	1814434634	JLLKWCBLRDUVGT-ONGXEEELSA-N	427.918	1.863	50	20	IDGD	
C[C@H](CBr)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2CNC(=O)C2)[nH]n1	1814782840	BGKPTXPVRFXVCI-MDZLAQPJSA-N	426.315	1.569	50	20	IDGD	
CC[C@H](C)[C@H](N)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1817266484	WTJQUOYRYWHDJL-XZOAIXRZSA-N	442.524	1.088	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2[nH]cc3c2CCC3)[nH]n1)c1cccc(B(O)O)c1	1817476743	PGGYMFMYXOBHQD-LJQANCHMSA-N	447.304	1.526	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)Cc2cscn2)n[nH]1	1817549875	QUYBZEZRLHSRJF-OAHLLOKOSA-N	433.538	1.474	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ncon2)n[nH]1	1820017034	OREFGIJESMUFKP-YTRQYYDFSA-N	439.436	1.233	50	20	IDGD	
C[Si](C)(C)OCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CN1CCSCC1)CC2	1820158172	HGYTWUIGTJCTRH-ZDUSSCGKSA-N	442.683	1.955	50	20	IDGD	
CC(=O)N(C)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](F)Br)n[nH]1	1820930900	KEEOMEDDTSOVAW-WFASDCNBSA-N	432.294	1.961	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1)[C@@H]1CC(c2ccccc2)=NN1	1821611736	XUSYDHSZJLJDCD-OKZBNKHCSA-N	444.923	1.768	50	20	IDGD	
CC(=O)NCCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](C)CBr)[nH]n1	1821978408	QGWDQRBEBUGQQE-FZMZJTMJSA-N	428.331	1.959	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2C[C@@]2(F)Cl)[nH]n1	1822416969	UFZIYBAHUKMMFO-FNFWKMNBSA-N	428.896	1.699	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)/C=N/N1CCCCC1)CC2	1826000082	KLNZJVJRRLHHMQ-CAVOBDPNSA-N	427.958	1.781	50	20	IDGD	
Cc1cnc(C(=O)N[C@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)s1	1826080309	ANRRQQSSNJVUAG-NSHDSACASA-N	436.563	1.507	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)CN)CC1	1826814134	HENQERLROAAGKP-SFHVURJKSA-N	432.477	1.712	50	20	IDGD	
O=C(c1ccnc(F)c1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827050382	QHMCLDPBOSDDME-FQEVSTJZSA-N	439.296	1.448	50	20	IDGD	
O=C(c1ncc(Cl)cc1Cl)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1829606797	MVEVDXPIIYDJCA-CZUORRHYSA-N	440.686	1.993	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cn4ccccc4n3)C2)C1	1830362290	QBLSWZHDUWBOFD-OAQYLSRUSA-N	434.924	1.669	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CC=CCC3)C2)C1	1830543325	PYLONSZEOWEGFX-BXWFABGCSA-N	429.355	1.830	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3[nH]nc4ncccc34)C2)C1	1831646981	PFWFKOAANCVVOY-YWZLYKJASA-N	435.912	1.435	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(OC)ccn3)C2)C1	1831650754	KYRGMIKBMQAVFJ-JXFKEZNVSA-N	425.913	1.568	50	20	IDGD	
Cc1onc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCBr)C3)C2)c1C	1831975978	WVGUTJKSFAGPIT-QGZVFWFLSA-N	430.299	1.146	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3cc(C)no3)CCO2)C1	1832573760	PRUPFTVTKIITMK-MAUKXSAKSA-N	444.326	1.155	50	20	IDGD	
Cc1nc(CC(=O)NC2CCN(C3CCN(C(=O)[C@H](F)Br)CC3)CC2)no1	1833810293	AFPJPYVUVHJAGQ-INIZCTEOSA-N	446.321	1.183	50	20	IDGD	
C[C@H](C(=O)NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)n1cccc1C=O	1834805602	QIPXUXNEYWJBMV-BEFAXECRSA-N	438.956	1.033	50	20	IDGD	
C[C@H](C(=O)N1CCOC[C@@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1)c1ccccn1	1837717954	SQFPMMXNTKHDEC-LAUBAEHRSA-N	435.597	1.493	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)C(C)(C)NCCC#N)CC2)CC1	1837869611	WSXCLYPEKCZGNK-GOSISDBHSA-N	442.988	1.521	50	20	IDGD	
CC(=O)N[C@@H](C)C(=O)N1CCC(OC2CCN(C(=O)CO[Si](C)(C)C)CC2)CC1	1838431900	BCWRWDJEPSQXAN-HNNXBMFYSA-N	427.618	1.361	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cncc4cnccc34)CCO2)C1	1838465389	VJBLINRLCIAXPW-WIYYLYMNSA-N	432.908	1.717	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)[C@H](C)n3cnnn3)CC2)CC1	1838773352	BZERLZOHXLSHEV-STQMWFEESA-N	443.346	1.016	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](C)n3cncn3)CC2)CC1	1838773549	NQUIDVCNXJRLAM-ZIAGYGMSSA-N	442.358	1.621	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccn(C(F)F)c3=O)C2)C1	1839145532	LCCWFVKWPWWROL-KUHUBIRLSA-N	447.866	1.331	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCNC(=O)OC(C)(C)C)C2)C1	1839149519	JMSNJLLEJGDHAA-QRWLVFNGSA-N	447.960	1.375	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)cn1C	1839200114	BYDUMWZMRYONIM-WMLDXEAASA-N	432.290	1.094	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(C)ccc3F)CCO2)C1	1839314083	QBIBBQQVXBRUQS-OXJNMPFZSA-N	428.888	1.458	50	20	IDGD	
O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(O)cc1F)CCO2	1839315596	ZGYVNWYACODXHK-GOSISDBHSA-N	445.285	1.386	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)Oc1ccccc1)CCO2	1839952275	XIGSHMMXYYPVKI-DJPFJPOOSA-N	440.924	1.164	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CCCCO3)C2)C1	1839962048	RTEAGBIFZPEIJX-RLFYNMQTSA-N	433.343	1.185	50	20	IDGD	
O=C(c1cccc2c1OCCO2)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840188511	NUSKNBFIUQVZCO-IBGZPJMESA-N	445.299	1.332	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1cccc3c1NC(=O)C3)C2	1843416666	KVYAHIDFGMWTKD-VULFUBBASA-N	448.483	1.132	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)C[C@@H]1OCCc3ccccc31)C2	1844263533	NXKXCBHACWBXIM-FQEVSTJZSA-N	449.511	1.206	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)C1	1845038325	PTUFRPDNBSAQPS-GOSISDBHSA-N	449.983	1.944	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H](C(=O)N2CCCC23CN(C(=O)C(C)(C)CCl)C3)[C@@H](O)C1	1845103948	PDLMSYZOPIBQFL-GJZGRUSLSA-N	443.972	1.683	50	20	IDGD	
O=C([C@@H](O)CCl)N1CC2(CCCN2C(=O)c2cccc([N+](=O)[O-])c2Br)C1	1845330285	BTXOBHBTJVGFLF-LBPRGKRZSA-N	446.685	1.774	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@](C)(O)C[C@H]1C(=O)N1CCCC12CN(C(=O)[C@@H](F)Cl)C2	1846230597	WKVQZDLEHUUDGN-JCGVRSQUSA-N	433.908	1.485	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)CN(Cc2ccccc2)C(=O)OC)C1	1846260684	UIRITTBXGQUIJV-KRWDZBQOSA-N	437.924	1.712	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N1CCCC12CN(C(=O)[C@@H](F)Cl)C2	1846534977	YJOYRMUFTVLPDT-UONOGXRCSA-N	443.907	1.583	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H]1CCC(=O)NC1	1847325993	VVDYBXDMLWLBIB-WOJZUGSCSA-N	428.439	1.600	50	20	IDGD	
Cn1cc(Br)cc1C(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	16164818	GZQWZMCEJXRPOJ-UHFFFAOYSA-N	425.195	1.314	50	20	IDGD	
CNS(=O)(=O)c1ccc(CCC(=O)NNC(=S)NCCc2cccs2)cc1	21125741	LTZYPHONOQMBRA-UHFFFAOYSA-N	426.589	1.327	50	20	IDGD	
O=C(CCn1ccnc1)Nc1cccc(C(=O)NNC(=O)c2ccc3c(c2)OCCO3)c1	108939647	HKATVSZFUSUKNT-UHFFFAOYSA-N	435.440	1.758	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3c(Cl)nc4ccccn34)cc2)CC1	728215931	LUZKSIUWSIGWHI-UHFFFAOYSA-N	448.936	1.681	50	20	IDGD	
NC(=O)C1CCN(c2ncccc2CNC(=O)NNC(=O)c2ccc3ccccc3n2)CC1	729229957	GYYPVLRVMLYICU-UHFFFAOYSA-N	447.499	1.476	50	20	IDGD	
CCN(CC)C(=O)c1ccc(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1	729300373	MLZWFFIGFJZMMF-UHFFFAOYSA-N	431.518	1.537	50	20	IDGD	
Cc1ccc(C)c(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)Cc3cc[nH]n3)cc2)c1	730102994	UKYHULJCNLPBTO-UHFFFAOYSA-N	427.486	1.831	50	20	IDGD	
NC(=O)C1(C(=O)NNC(=O)c2cccc(S(=O)(=O)Nc3ccccc3Cl)c2)CC1	731595321	AXQKNMXCEJDXFG-UHFFFAOYSA-N	436.877	1.167	50	20	IDGD	
O=C(CCN1CCN(C(=O)[C@H]2CCCO2)CC1)NNc1ccc(Cl)cc1[N+](=O)[O-]	732057544	IKVAOMQVXNWYJO-MRXNPFEDSA-N	425.873	1.405	50	20	IDGD	
Cc1nn(-c2ccccc2)c2nc(C(=O)NNC(=O)CCN3C[C@@H](C)O[C@H](C)C3)ccc12	732261165	BBZLHEAFYLUMLN-HZPDHXFCSA-N	436.516	1.989	50	20	IDGD	
N#Cc1ccc(N2C(=O)N[C@@H](CCC(=O)NNC(=O)Cc3c[nH]c4ccccc34)C2=O)cc1	733774245	KOQXWIPAVUHDOQ-IBGZPJMESA-N	444.451	1.635	50	20	IDGD	
N#Cc1ccc(N2C(=O)N[C@@H](CCC(=O)NNC(=O)c3cc(Cl)ccc3O)C2=O)cc1	733804737	KXVOMVNHOABRFF-HNNXBMFYSA-N	441.831	1.583	50	20	IDGD	
Cc1ccc(S(=O)(=O)Nc2ccccc2C(=O)NNC(=O)C(=O)N2CCCC2)cc1	733952461	HYBOIOKVUNWWSR-UHFFFAOYSA-N	430.486	1.179	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)[C@H]1CC(=O)N(Cc2ccccn2)C1	734252420	SFKWQUHRGDWNCS-HNNXBMFYSA-N	445.545	1.650	50	20	IDGD	
COCCOc1ccc(-n2nc(C)c(C(=O)NNc3ccccc3S(C)(=O)=O)n2)cc1	735116151	BDNGNXDOERSVDG-UHFFFAOYSA-N	445.501	1.761	50	20	IDGD	
CSc1ccsc1C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	735116870	JBEOVJVJRYTXJH-UHFFFAOYSA-N	427.577	1.558	50	20	IDGD	
CC(=NNC(=O)c1cnn(C)c1)c1ccc(S(=O)(=O)N2CCCC[C@@H]2C(=O)O)cc1	735413145	GPSSRNNJTTYEIR-QGZVFWFLSA-N	433.490	1.202	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)CCN2C(=O)[C@H]3CCCC[C@H]3C2=O)cc1C	736735618	VLPNRXXQGINWGL-OKILXGFUSA-N	449.529	1.488	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2ccccc2OCC2CC2)c1	740486627	UAXNISDBZJSSEX-UHFFFAOYSA-N	446.529	1.870	50	20	IDGD	
O=C(Cc1ccc(S(=O)(=O)C(F)F)cc1)NNC(=O)[C@@H]1COc2ccccc2O1	740633342	BEIMHBCJCYLSOE-HNNXBMFYSA-N	426.397	1.213	50	20	IDGD	
COc1ccc(SCCC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1OC	740814208	LYKMSNYOHICFOU-UHFFFAOYSA-N	428.474	1.623	50	20	IDGD	
C[C@H]1C[C@H](NC(=O)NNC(=O)c2cc3c(s2)CC[C@@H](C)C3)C(=O)N1c1cnn(C)c1	743510748	CZZHBBWFJXUABV-XUJVJEKNSA-N	430.534	1.744	50	20	IDGD	
O=C(NC[C@@H](O)COc1cccc(F)c1)NNC(=O)c1cccc(Br)c1	743687823	QLFNSJSBDIITOZ-CQSZACIVSA-N	426.242	1.972	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CN(Cc2ccccc2)CCO1)c1cc(Br)ccc1O	743731265	NHUUEIZOEISLDC-KRWDZBQOSA-N	434.290	1.817	50	20	IDGD	
Cc1cccc(N2C[C@H](C(=O)NNC(=O)Nc3ccc(S(C)(=O)=O)cc3)CC2=O)c1C	743829979	IXKHJNCROFFJJU-OAHLLOKOSA-N	444.513	1.913	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CN2CCN(c3c(C#N)cnc4ccccc34)CC2)c1	744393390	NSWHSQHWIXMKIE-UHFFFAOYSA-N	428.496	1.998	50	20	IDGD	
COc1ccc(-n2nnc(C(=O)OCC(=O)NNC(=O)c3ccc(C#N)cc3)c2C)cc1	744717483	RSEMJRBMUROWEX-UHFFFAOYSA-N	434.412	1.074	50	20	IDGD	
Cc1ccc(CN2C(=O)CC[C@@H]2C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)cc1	745593490	SBJQFNAZCDAJMJ-LJQANCHMSA-N	434.452	1.362	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCCc2cccc(C(=O)N(C)C)c2)nc1	745846998	KDCFKQDBUSGYNR-UHFFFAOYSA-N	448.549	1.339	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H](C)CC(C)(C)OC)c1	745865638	YOPDPWMSIQGOOV-AWEZNQCLSA-N	428.555	1.865	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)N[C@@H]1CC(=O)N([C@@H]2C[C@H]2c2ccccc2)C1	745915385	YULSNEGICVWNFX-FHLIZLRMSA-N	446.467	1.436	50	20	IDGD	
C[C@@H](CC(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1)C(=O)c1cccc(F)c1	746084150	BVXPIZFURFVHAZ-SCLBCKFNSA-N	444.415	1.565	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)c1ccc(C[C@H]2CC(=O)NC2=O)cc1	746096438	UUKHNRMTPLXRMU-INIZCTEOSA-N	433.468	1.265	50	20	IDGD	
O=C(CCc1ccccc1)NNC(=O)[C@@H]1CN(Cc2nc(O)c3ccccc3n2)CCO1	746194645	WDDHRWZLSPHQQT-IBGZPJMESA-N	435.484	1.316	50	20	IDGD	
CSC[C@H](C(=O)NNC(=O)c1cccc2cccnc12)N1C(=O)[C@@H]2CCCC[C@H]2C1=O	747427144	CJFVNHCFVULMOM-BFYDXBDKSA-N	440.525	1.903	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)NCc3ccon3)c2)cc1	747593307	AQSPZQBVWBXZSQ-UHFFFAOYSA-N	445.457	1.628	50	20	IDGD	
O=C(CCc1ccccc1O)NNS(=O)(=O)c1ccc(C(=O)O)cc1Br	747613406	HFZZYFBBTAHDEY-UHFFFAOYSA-N	443.275	1.795	50	20	IDGD	
Cn1ccnc(NNC(=O)c2ccc(OS(=O)(=O)c3cccc([N+](=O)[O-])c3)cc2)c1=O	747946305	YGKXFUAGHMSTCD-UHFFFAOYSA-N	445.413	1.213	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NCCCCCCCN2CCCC2)c2ccccc2c1=O	747952695	CFAFEQBXDFSGPJ-UHFFFAOYSA-N	428.537	1.924	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)CNC(=O)NCc1ccc([N+](=O)[O-])cc1	748212665	SLXXCZLXFMALND-LBPRGKRZSA-N	433.396	1.148	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)c1cc(S(=O)(=O)N2CCC2)ccc1Cl	748708976	LYMGWNSCPXBQRK-UHFFFAOYSA-N	439.877	1.280	50	20	IDGD	
CC(=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O)[C@@H](C)c1nc2ccccc2s1	748780617	MSHNSBDMUKPDMD-SNVBAGLBSA-N	432.531	1.477	50	20	IDGD	
Cc1ccc(-c2noc(CCC(=O)NNC(=O)CNC(=O)c3cccs3)n2)cc1F	751206935	WUOXQMGRPNHQIH-UHFFFAOYSA-N	431.449	1.756	50	20	IDGD	
COc1ccc(CCN2C[C@@H](C(=O)NNC(=S)N[C@H](C)C3CC3)CC2=O)cc1OC	751616813	JZNAHZOXDRPOFC-CJNGLKHVSA-N	434.562	1.389	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)[C@@H]2CCCN(S(=O)(=O)c3ccc([N+](=O)[O-])cc3)C2)o1	752523434	UJAUTNBANFBLRR-CYBMUJFWSA-N	436.446	1.358	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)NCCNS(=O)(=O)c1ccc(Cl)s1	752688221	FLFZGEHCPJPJAX-UHFFFAOYSA-N	434.902	1.392	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCc2csc([C@@H](C)OC)n2)c2ccccc2c1=O	753057145	PGSVLBIIZQZVHT-LLVKDONJSA-N	430.490	1.725	50	20	IDGD	
CCOc1ccc(NC(=O)NNC(=O)c2cccn2C)cc1S(=O)(=O)N(CC)CC	755451261	RKUMRXUNPZDAJC-UHFFFAOYSA-N	437.522	1.921	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)COc2ccc(Cl)cc2)cc1-n1nnnc1C	756317849	CYBOJRCRNPIERQ-UHFFFAOYSA-N	431.840	1.864	50	20	IDGD	
O=C(CN1CCN(CC(=O)Nc2ccc(Cl)cc2)CC1)NNC(=O)c1ccccc1	756650067	JWHXPVAQUSACAT-UHFFFAOYSA-N	429.908	1.357	50	20	IDGD	
Cn1cccc(NC(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)c1=O	756687241	YAHRKNKJXRWKIE-UHFFFAOYSA-N	444.455	1.554	50	20	IDGD	
O=C(Cc1cc[nH]n1)NNC(=O)Nc1ccc(S(=O)(=O)NCc2ccccc2)cc1	756863606	IIQPNMXDUJAHPR-UHFFFAOYSA-N	428.474	1.284	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)Nc2ccc(S(=O)(=O)NCc3ccccc3)cc2)cn1	756865984	WKCNAQXOPLMCNP-UHFFFAOYSA-N	428.474	1.365	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)Nc2cc(Br)cn(C)c2=O)c1	757596217	QXLIBKSBPJIWHZ-UHFFFAOYSA-N	425.239	1.632	50	20	IDGD	
O=C(CCc1nnc(C2CCCC2)o1)N1CCN(S(=O)(=O)CBr)CC1	758516725	FVYPHFUJKJYHDS-UHFFFAOYSA-N	435.344	1.486	50	20	IDGD	
COc1ccccc1[C@H](CNC(=O)NNC(=O)C(=O)Nc1ccccn1)N1CCCCC1	758710094	MLPDEGIVOBWYIT-KRWDZBQOSA-N	440.504	1.586	50	20	IDGD	
CN(NC(=O)C(C)(C)NC(=O)OC(C)(C)C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758786585	NTINJRRWZDXPKM-UHFFFAOYSA-N	443.545	1.925	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)C(=O)Nc1cnccc1-c1ccccc1	760277774	REPYZRMXJHBMHQ-UHFFFAOYSA-N	428.412	1.124	50	20	IDGD	
CC(C)NC(=O)N1CCC[C@H]1C(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12	760278386	DWAKSEDASLHUMH-INIZCTEOSA-N	428.493	1.321	50	20	IDGD	
Cn1cc(-n2cc(C(=O)NNC(=O)c3ccc(F)cc3Br)ccc2=O)cn1	760801472	YBGUZYRVDKWDMM-UHFFFAOYSA-N	434.225	1.547	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)CN(CCc2ccccc2)C(C)=O)c2ccccc2c1=O	761199871	HNOLFQAIXFJEKY-UHFFFAOYSA-N	435.484	1.269	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H]1[C@H]1COCCC1=NNC(=O)N[C@H]1CCS(=O)(=O)C1	762418676	RNWOSPZFFWTNBW-OFQRWUPVSA-N	444.554	1.265	50	20	IDGD	
Cc1c(C(=O)O)cccc1S(=O)(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12	763278159	JRSQCUFTCQTWKA-UHFFFAOYSA-N	444.469	1.607	50	20	IDGD	
COc1ccc(Cn2nccc2NC(=O)C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1	763441450	FGVOJJAJHWORIH-UHFFFAOYSA-N	438.400	1.248	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)ccc1N1CCSCC1	763441733	IRTQHMJMIIYAEC-UHFFFAOYSA-N	443.485	1.856	50	20	IDGD	
CC(C)(C)OC(=O)N1CCc2c(cccc2NC(=O)C(=O)NNC(=O)c2ccccn2)C1	763464910	YEWMRQWHCGSWOZ-UHFFFAOYSA-N	439.472	1.775	50	20	IDGD	
CC(=O)N1CCc2cc(NC(=O)C(=O)NNC(=O)c3cc4ccccc4cc3O)ccc21	763523533	SURHNTQQJAZMLO-UHFFFAOYSA-N	432.436	1.854	50	20	IDGD	
CC(C)(C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1	763570575	GGGHXYJOPVLRFL-KRWDZBQOSA-N	440.456	1.141	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCOC[C@H]1C[C@H](O)c1ccccc1	763636767	SWFCPTJVZSIGDR-MJGOQNOKSA-N	447.919	1.934	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)N[C@@H]1CCCC[C@@H]1N1CCOCC1	763661422	WFLSJLBPSWUVLA-SJORKVTESA-N	428.493	1.165	50	20	IDGD	
COC(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)c2cc(OC)cc(OC)c2)c1	763773593	ZFMMCDXWDRPKKE-UHFFFAOYSA-N	435.820	1.544	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc2c(c1)OC1(CCCC1)O2	763808347	LSFRIFAACTWZGP-UHFFFAOYSA-N	436.424	1.765	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccc(C(=O)c2ccccc2)c1	763808806	QVKTYBXAFXZVDU-UHFFFAOYSA-N	442.431	1.954	50	20	IDGD	
CCOC(=O)N(C)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)cc1	763809252	UCDDMGZSPZBOHG-UHFFFAOYSA-N	439.428	1.316	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(F)cc2C(=O)OC)cc1	763860664	JWIZCLFBXZLVJD-GFCCVEGCSA-N	447.419	1.564	50	20	IDGD	
CCCNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)c1	763866032	NEKIISKMRCRYTC-CYBMUJFWSA-N	430.436	1.519	50	20	IDGD	
O=C(Cc1ccsc1)NNC(=O)C(=O)Nc1cccc(F)c1I	764033021	DILXRKRNXNCLND-UHFFFAOYSA-N	447.229	1.820	50	20	IDGD	
COC(=O)CCSc1cccc(NC(=O)C(=O)NNC(=O)c2ccccc2OC)c1	764040408	GZVFXBWSVPGBCZ-UHFFFAOYSA-N	431.470	1.750	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(F)c(C(F)(F)F)c2)c1	764077059	GYWUHOTXVPQQDI-UHFFFAOYSA-N	447.366	1.648	50	20	IDGD	
COc1ccc(Br)c(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)c1	764154826	VHXDRWGMWNHJKT-HNNXBMFYSA-N	434.246	1.547	50	20	IDGD	
O=C1C[C@@H](Cc2ccc(C(=O)NNc3c(F)cc(C(=O)NC4CC4)cc3F)cc2)C(=O)N1	764329289	HSCIYUHKJKYBRK-CYBMUJFWSA-N	442.422	1.819	50	20	IDGD	
O=C(CCc1nnc(-c2ccc(Cl)cc2)o1)NNC(=O)CNC(=O)c1cccnc1	764343241	NACPJNULDUVKFJ-UHFFFAOYSA-N	428.836	1.295	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)C(=O)Nc1ccc(N2CCOC2=O)cc1	764343515	RWDUYTLLOHJAPY-UHFFFAOYSA-N	434.412	1.229	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(OCCNC(=O)OC(C)(C)C)cc2)o1	764370459	CJKYTGXVMKNIAI-UHFFFAOYSA-N	446.460	1.891	50	20	IDGD	
CCc1c(NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)cnn1CC(C)C	764382374	IQYZDRYGXOSTJJ-UHFFFAOYSA-N	429.506	1.953	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COCCO1)C(=O)Nc1cnccc1-c1ccc(C(F)(F)F)cc1	764432004	HYTVTMJLVVEEHA-HNNXBMFYSA-N	438.362	1.269	50	20	IDGD	
Cc1ccc(S(=O)(=O)NNC(=O)OC(C)(C)C)cc1S(=O)(=O)N1CCCCC1	764932068	OANIFGNIFPNIJJ-UHFFFAOYSA-N	433.552	1.888	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1)Nc1nc(CN2CCOCC2)cs1	765311624	QPOYELASNTYXFJ-UHFFFAOYSA-N	445.480	1.971	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)c3cccc(C)c3F)CC2)cc1	765728560	LJHOYMHJJYYRJO-UHFFFAOYSA-N	448.520	1.210	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3ccc(N4CCCC4)nc3)CC2)cc1	765747170	DJEFVLFOQCVDTJ-UHFFFAOYSA-N	436.560	1.569	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2nnn(Cc3ccc(F)cc3)c2C)cc(OC)c1OC	766325803	YRUSBPQCRZJGDF-UHFFFAOYSA-N	443.435	1.875	50	20	IDGD	
CCCC[C@@H](CC)C(=O)NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1	766635518	AGBCZWTZPKZPLI-GOSISDBHSA-N	438.594	1.665	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cncc(OC(C)C)c3)CC2)cc1	766642397	HHRUVYIKPLWAAT-UHFFFAOYSA-N	425.533	1.756	50	20	IDGD	
CC(C)c1ncncc1C(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	766669580	QAIYUNILFKCESM-UHFFFAOYSA-N	430.940	1.832	50	20	IDGD	
C[C@@H](CC(=O)NNc1ncnc2ccsc12)NS(=O)(=O)c1cccnc1Cl	766671023	YOMJIZQTRKOQMW-VIFPVBQESA-N	426.911	1.940	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)c(C)nn1	767164085	XMNSAHYCGFUVIP-UHFFFAOYSA-N	439.497	1.647	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)Cc1c(C)nc2c(c(O)nn2C)c1C	767337219	QEPDISIRTRLMJM-UHFFFAOYSA-N	439.472	1.075	50	20	IDGD	
COc1cc(OC)cc(C(=O)Nc2ccc(O)c(C(=O)NNC(=O)N3CCOCC3)c2)c1	769742707	UAGDMKBDVOTEKB-UHFFFAOYSA-N	444.444	1.348	50	20	IDGD	
COc1ccccc1[C@@H](CNC(=O)NNC(=O)CNC(=O)c1cccs1)OC(C)C	770374359	OONACTMIXMLQJP-MRXNPFEDSA-N	434.518	1.983	50	20	IDGD	
O=C(NNc1ccc(Br)c(F)c1)Nc1ccn(CC(=O)N2CCOCC2)n1	771154290	QSCBHRYOPGJFRB-UHFFFAOYSA-N	441.261	1.792	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)NCC(C)(C)CO)cc1	771788912	KKFTVTMNQJCSPP-MHWRWJLKSA-N	425.489	1.476	50	20	IDGD	
Cn1ncc(C(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)c1Br	773034886	OIRUVQZRXLWSLF-UHFFFAOYSA-N	445.318	1.526	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@H]2CCC[C@H]2OC)c1	775461234	UXEJKXVFRVEXEG-NVXWUHKLSA-N	426.539	1.476	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@H]2COc3ccccc3O2)nc1	776063762	WUKVYYCFUSZIEL-OAHLLOKOSA-N	449.489	1.151	50	20	IDGD	
COc1ccccc1C(=O)NNS(=O)(=O)c1ccc(N2CCOC2=O)c([N+](=O)[O-])c1	777631137	FSYDIEJKCHNZRZ-UHFFFAOYSA-N	436.402	1.183	50	20	IDGD	
CC(C)N1CC[C@@H](NC(=O)NNC(=O)C(=O)N2CCCC2)[C@H]1c1ccc(Cl)c(F)c1	777750905	XSBMYPDUIQIKJN-IAGOWNOFSA-N	439.919	1.956	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@H](C(=O)NNc2ccc([N+](=O)[O-])cc2Cl)[C@@H](C)O)cc1	779533362	FANCMSXQALNZMS-BZNIZROVSA-N	442.881	1.728	50	20	IDGD	
CCOC(=O)N1CCC([C@H](C)NC(=O)NNC(=O)c2nnc(O)c3ccccc23)CC1	779673344	KWNNSVUZFZBCSV-LBPRGKRZSA-N	430.465	1.536	50	20	IDGD	
O=C(COc1ccccc1Cc1ccccc1)NNC(=O)NCCNC(=O)c1cc[nH]n1	780872390	LMPQEEGNUVNNQB-UHFFFAOYSA-N	436.472	1.140	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)c1ccc(C)cc1)C(=O)NNc1ncncc1Cl	781820219	OXCGNSBKZQXDEM-CQSZACIVSA-N	429.955	1.982	50	20	IDGD	
Cc1ccc(F)cc1C(=O)C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	781929310	GJXIZSPMEOXLME-UHFFFAOYSA-N	433.461	1.563	50	20	IDGD	
CN(NC(=O)c1cn(C)nc1-c1cnn(C)c1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	781983114	FJOLSECHGLVPDX-UHFFFAOYSA-N	446.512	1.070	50	20	IDGD	
CCOCc1cccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)c1	783262482	DPVQADOZXBWONH-UHFFFAOYSA-N	435.506	1.387	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2cnn(-c3ccccc3)c2C(F)(F)F)CCS(=O)(=O)C1	783425852	FCEOFRRUCBXBEI-INIZCTEOSA-N	445.423	1.028	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@@H]2CC=CC[C@H]2C(=O)N2CCOCC2)ccc1OC(C)C	784295298	FKLPUEXORCQFCX-QZTJIDSGSA-N	445.516	1.685	50	20	IDGD	
COCC(=O)N1CCc2cc(NC(=O)C(=O)NNc3ccc([N+](=O)[O-])cc3Cl)ccc21	784382641	ISRAKCOMTSQPCP-UHFFFAOYSA-N	447.835	1.866	50	20	IDGD	
COc1ccc(Cn2ccc(NC(=O)C(=O)NNc3ccc(C(F)(F)F)nn3)n2)cc1	784885812	CEFYJBXAELWNSJ-UHFFFAOYSA-N	435.366	1.831	50	20	IDGD	
CN(C)c1nccc(NNC(=O)C(=O)Nc2cnn(-c3ccccc3Br)c2)n1	784969813	QMEXIIVIVQHJBZ-UHFFFAOYSA-N	445.281	1.573	50	20	IDGD	
COC(=O)[C@@](C)(CNC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)c1ccccc1	787306310	MIUQDJBVFGMDLC-FQEVSTJZSA-N	448.501	1.557	50	20	IDGD	
C[C@@H](c1cccc(N2CCOC2=O)c1)N(C)C(=O)NNC(=O)CNC(=O)c1ccco1	789839758	NDTBOAGEKUDOMN-ZDUSSCGKSA-N	429.433	1.400	50	20	IDGD	
C[C@@](O)(Cn1cc(C(F)(F)F)ccc1=O)C(=O)NNC(=O)Cn1ccc2ccccc21	792144451	WHVZKSYSDKKVBU-LJQANCHMSA-N	436.390	1.420	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccccc2O)n(-c2nc3ccccc3s2)n1	793022871	DJTQUROPSZTQGZ-UHFFFAOYSA-N	436.453	1.896	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2ccc(COc3ccccc3)o2)cnc1C	793353772	RFNGLYILDVKXEQ-UHFFFAOYSA-N	445.453	1.972	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)c2cccc(NN3C(=O)[C@@H]4CC=CC[C@H]4C3=O)c2)nc1	793735688	PCBFNYKDWFUWCM-IAGOWNOFSA-N	435.440	1.903	50	20	IDGD	
Cc1nc(C#N)c(N2CCC(C(=O)NNC(=O)C(=O)NCc3ccc(Cl)cc3)CC2)o1	793773962	SSHVSZVTQSGIIG-UHFFFAOYSA-N	444.879	1.188	50	20	IDGD	
O=C(CN1CC[C@@]2(CCN(Cc3ccccc3)C2)C1)NNC(=O)c1cccc([N+](=O)[O-])c1	796438390	YQFWEEZAWATSTO-HSZRJFAPSA-N	437.500	1.954	50	20	IDGD	
CN(C)c1ncn(-c2cccc(NC(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)c2)n1	799415600	RPIGXPOJRGQCGU-UHFFFAOYSA-N	446.512	1.791	50	20	IDGD	
Cc1nc2nc(N)nn2c(C)c1CC(=O)NNc1cc([N+](=O)[O-])ccc1Br	800697097	KKTDUJMCYXRKJK-UHFFFAOYSA-N	435.242	1.680	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)c2nn(-c3ccc(Cl)cc3)cc2O)cc1	801373835	QCIQAGRSSBPZTD-UHFFFAOYSA-N	439.815	1.721	50	20	IDGD	
CN(C)C(=O)CS(=O)(=O)c1ccc(C(=O)NNC(=O)Nc2ccc(Cl)cc2)cc1	802023130	IJMCFTIDXDPWFA-UHFFFAOYSA-N	438.893	1.668	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2ccc(S(=O)(=O)CC(=O)N(C)C)cc2)cc1	802062838	NWQVZXWQTGLVIC-UHFFFAOYSA-N	434.474	1.024	50	20	IDGD	
Cc1ccc(NNC(=O)NC[C@@H](N2CCN(C(=O)OC(C)(C)C)CC2)C(F)(F)F)nn1	802466033	WZCHWTPKDOOLOF-CYBMUJFWSA-N	447.462	1.895	50	20	IDGD	
COC(=O)c1c(F)cc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)cc1F	802565873	OSXYJCAIZJJZMM-UHFFFAOYSA-N	443.366	1.541	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)c1ccc(S(=O)(=O)Nc2nccs2)cc1	804954814	REHDSKNFJWINOA-UHFFFAOYSA-N	442.486	1.677	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCC2(S(C)(=O)=O)CCCC2)cc1Br	805104673	YGIFGYPQJSBFSQ-UHFFFAOYSA-N	448.339	1.759	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N2CCOCC2)cc1NC(=O)NNc1ncccc1F	806144683	ZAOQPPPNLFZBET-UHFFFAOYSA-N	439.469	1.789	50	20	IDGD	
COCCOc1ccc(S(C)(=O)=O)cc1NC(=O)NNC(=O)c1ccc(C#N)cc1	806736762	ONQIDTMGAAUVPE-UHFFFAOYSA-N	432.458	1.453	50	20	IDGD	
COC(=O)c1cc(Br)c(OC)cc1NC(=O)C(=O)NNC(=O)c1ccoc1	806977312	DJLVPOQSPXJAAL-UHFFFAOYSA-N	440.206	1.237	50	20	IDGD	
COCCNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2F)c1	806980396	ONSCXLQFBPNTRL-UHFFFAOYSA-N	436.827	1.255	50	20	IDGD	
COC(=O)c1cc(OC)c(OC)cc1NC(=O)C(=O)NNc1ccc([N+](=O)[O-])cc1C	807456156	YRMIULWJGFVNEA-UHFFFAOYSA-N	432.389	1.789	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NC[C@H]2CCCS(=O)(=O)C2)ccc1OCCC(C)C	807581476	DOMZWAHUXLCGRH-OAHLLOKOSA-N	441.550	1.889	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)[C@H]2CC(=O)N(c3ccccc3F)C2)C1	808011056	OISCNRAIZKAGIO-GJZGRUSLSA-N	448.495	1.973	50	20	IDGD	
C#CC[C@]1(C(=O)NNC(=O)CCN2C[C@@H](C)O[C@H](C)C2)CCCN1C(=O)OC(C)(C)C	809556913	PERPMDAESFHYNJ-DRSNIGMVSA-N	436.553	1.426	50	20	IDGD	
CNC(=O)c1cc(Oc2ccc(NC(=O)C(=O)NNC(=O)CC(C)C)cc2F)ccn1	810386073	LHHUEZBWOZXZGB-UHFFFAOYSA-N	431.424	1.505	50	20	IDGD	
Cc1nc2ccc(NC(=O)C(=O)NNc3c(F)cc(C(=O)NC4CC4)cc3F)cn2n1	810399604	WVDDADNJSFMFHG-UHFFFAOYSA-N	429.387	1.290	50	20	IDGD	
C#CCNS(=O)(=O)c1ccc(C(=O)NNC(=O)CCSc2ccc(F)cc2)cc1	811284834	IQQGXHPUNOIHAW-UHFFFAOYSA-N	435.502	1.681	50	20	IDGD	
CNS(=O)(=O)c1ccc(C)c(C(=O)NNC(=O)CCSc2ccc(F)cc2)c1	811889195	RWVJOYCUXRWOHC-UHFFFAOYSA-N	425.507	1.986	50	20	IDGD	
C[C@H]1CCCN(c2cc(C(=O)NNC(=O)c3csc(N4CCOCC4)n3)ccn2)C1	812452040	PKNTVTVMTHKMLU-AWEZNQCLSA-N	430.534	1.686	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)CCC(=O)N2CCc3sccc3C2)cc1	812729428	OWTWWPZFFZQZSF-UHFFFAOYSA-N	436.559	1.807	50	20	IDGD	
COC(=O)c1c(F)cccc1NNC(=O)[C@H](NS(=O)(=O)c1ccc(C)cc1)[C@@H](C)O	819710281	DREOXNFNFLXQPN-SJKOYZFVSA-N	439.465	1.092	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)c2sccc2S(=O)(=O)N2CCCCC2)cc1	821882200	SRZRTMWBDPLCBU-UHFFFAOYSA-N	448.526	1.634	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)Cn1nnc(-c2ccc(Cl)cc2)n1	836618160	GPUAYKUZGNYNIM-UHFFFAOYSA-N	438.879	1.753	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)[C@@H](CCS(C)(=O)=O)NC(=O)c2ccc(Cl)cc2)n1	837302383	OTGWYPGLPIOBNK-OAHLLOKOSA-N	439.925	1.423	50	20	IDGD	
CCOc1ccc(NC(=S)NNC(=O)CN2C(=O)c3ccccc3S2(=O)=O)cc1	891388016	MWCZDPJKRBCWEM-UHFFFAOYSA-N	434.499	1.248	50	20	IDGD	
CCc1ccccc1OCC(=O)NNS(=O)(=O)c1ccc(C(=O)OC)cc1[N+](=O)[O-]	912979290	CJQLJKPMBSRKDO-UHFFFAOYSA-N	437.430	1.332	50	20	IDGD	
COCCNS(=O)(=O)c1cccc(C(=O)NNC(=S)Nc2ccc(C)cc2C)c1	913901229	TWLAGZACCPUWQR-UHFFFAOYSA-N	436.559	1.860	50	20	IDGD	
COc1cccc(C[C@@H](C(=O)NNC(=O)c2cc(-c3ccccc3)on2)n2nnnc2C)c1	915686216	YLHMDAWRXHGJEA-IBGZPJMESA-N	447.455	1.890	50	20	IDGD	
CN(C)[C@H](CNC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)c1cccc(F)c1	915901078	MXZHGVSDQPZVLN-QGZVFWFLSA-N	426.452	1.320	50	20	IDGD	
CC(=NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1ccc(N(C)C)cc1	916258781	LARDHUQTPQNAQK-UHFFFAOYSA-N	430.530	1.928	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@@H]2CCN(c3ccccc3)C2)c1	916580285	YNPIAPGMIZKGFJ-INIZCTEOSA-N	445.545	1.407	50	20	IDGD	
CC[C@H](C)C(=O)Nc1cccc(CNC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c1	916648150	CAAJYZWYYBVDDL-AWEZNQCLSA-N	436.476	1.791	50	20	IDGD	
COc1ccc(S(N)(=O)=O)cc1C(=O)NNC(=O)c1cc(-c2ccc(C)cc2)[nH]n1	917178056	HGDCEJFQDIWHSW-UHFFFAOYSA-N	429.458	1.116	50	20	IDGD	
COc1cc(C=NNC(=O)c2ccc(C)cc2O)ccc1OCC(=O)N1CCOCC1	917555866	IDHOHBANJJBZOE-UHFFFAOYSA-N	427.457	1.711	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNS(=O)(=O)c2ccc(CCNC(C)=O)cc2)cc1	917724982	DRQUSUNCXUURMA-OAHLLOKOSA-N	449.529	1.541	50	20	IDGD	
COC(=O)CCOc1ccc(S(=O)(=O)NNC(=O)c2ccc(Cl)cc2O)cc1	917758201	VOYCBNAKYVBJAD-UHFFFAOYSA-N	428.850	1.611	50	20	IDGD	
O=C(NCc1cc(F)ccc1Br)NNC(=O)c1ccc(-n2cnnn2)cc1	918103307	FUUUKJISHFIVKA-UHFFFAOYSA-N	434.229	1.708	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NCCS(=O)(=O)c2ccc(Cl)cc2)cc1	919785803	KHAALKYYZGLTIM-UHFFFAOYSA-N	425.894	1.832	50	20	IDGD	
CC(C)Oc1cc(Br)ccc1C(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1	919994983	NQILACUCYZKJES-NSHDSACASA-N	434.312	1.367	50	20	IDGD	
CC(=NNC(=O)N[C@@H]1CCS(=O)(=O)C1)c1ccc(OCC(=O)N2CCCCC2)cc1	920383513	FPBMUQPDIXKTCL-QGZVFWFLSA-N	436.534	1.288	50	20	IDGD	
CCCCN1C(=O)CC[C@@H](C(=O)NNC(=O)CN2CCCC2=O)[C@@H]1c1ccc(OC)cc1	920436227	ZDZZGTBQBGXAGR-GCJKJVERSA-N	444.532	1.545	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)Nc2cccc(CN3CCC[C@H]3C(N)=O)c2)cc1	920930965	XWXGFVFPZOAKRD-IBGZPJMESA-N	441.488	1.377	50	20	IDGD	
COc1ccc(S(=O)(=O)CCC(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)cc1	1115813521	XQIVHYPQFPCQAD-UHFFFAOYSA-N	428.470	1.710	50	20	IDGD	
CNS(=O)(=O)c1ccc(Br)c(C(=O)NNC(=O)CNc2ccccc2)c1	1248521432	HHJFLGZBZPBBQG-UHFFFAOYSA-N	441.307	1.230	50	20	IDGD	
CN1CCC(=O)Nc2cc(C(=O)NNC(=O)C3CCN(C(=O)OC(C)(C)C)CC3)ccc21	1318857392	FGXIJQCPGRGQDQ-UHFFFAOYSA-N	445.520	1.873	50	20	IDGD	
O=C(CSc1nc2ccccc2[nH]1)N1CCN(S(=O)(=O)CBr)CC1	1325377615	NZRVLEAJTWNLMK-UHFFFAOYSA-N	433.353	1.481	50	20	IDGD	
Cc1cccc(N2N=C(C(=O)NNc3ccccc3S(=O)(=O)N(C)C)CCC2=O)c1	1327888179	RAXJDYBEUDFLIK-UHFFFAOYSA-N	429.502	1.871	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)Cn3c(=O)n(C)c4ccccc43)C2)C1	1778164161	BSPIXJXIZAXFRC-VFNWGFHPSA-N	434.924	1.187	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](C)N3C[C@H]4C[C@H]4C3)C2)C1	1778853228	HQHHRCHTNNLQBC-RMWBKXBUSA-N	428.371	1.188	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)C#CC3(O)CCCCC3)C2)C1	1779062338	LTKKWRGNNLSLPQ-OXQOHEQNSA-N	441.366	1.546	50	20	IDGD	
CC(C)N1CCC(C(=O)N2CCO[C@@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)CC1	1779294755	YASTYDRZCSEDNT-OAQYLSRUSA-N	425.646	1.788	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3csc(C(F)(F)F)n3)C2)C1	1779758654	MRUFPHHRPGRLBG-MEBBXXQBSA-N	441.859	1.859	50	20	IDGD	
COc1ccnc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](F)Cl)C3)c1OC	1780252710	PKJIOXYDHBJPGN-ACWOFJMJSA-N	429.876	1.761	50	20	IDGD	
O=C(Cc1ccc(Br)nc1)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Cl)CCO2	1780875054	VMOSOEKKVCWEOG-HOCLYGCPSA-N	434.693	1.751	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCN1CCCC1)C2	1782004240	JGVMEZLWDIDNPY-FRQCXROJSA-N	430.387	1.770	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(CCN(C(=O)c3cccc(-n4cncn4)c3)C2)C1	1782014343	FKAJVSYTDQVCBJ-IBGZPJMESA-N	448.321	1.496	50	20	IDGD	
CCOc1ccc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](Cl)COC)C2)nn1	1782173460	CDWYTDZQWUYCCW-YYFZDKIDSA-N	440.928	1.257	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccnc4ncccc34)C2)C1	1782342221	SXECHTCIIGYDRJ-YJYMSZOUSA-N	433.306	1.857	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C23CCC(CC2)CC3)C1	1782705229	MCIPUOPJAZMDTK-BLWHJXEHSA-N	448.608	1.844	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H]3CCCO3)C2)C1	1783480938	DPNOTOXSFWUAKF-RXVVDRJESA-N	447.444	1.143	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCOc3ccc(F)cc3)[C@H]2C1	1783792876	KYEFVYLFJFVGDY-QZHFEQFPSA-N	442.915	1.828	50	20	IDGD	
Cn1c(=O)n(C)c2cc(C(=O)N3CCO[C@]4(CCN(C(=O)C(Cl)Cl)C4)C3)ccc21	1783947963	OWBJEIMIESNSCS-IBGZPJMESA-N	441.315	1.124	50	20	IDGD	
O=C(c1cc([N+](=O)[O-])cc2c1OCC2)N1CCO[C@@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783948594	WUQPQUQJFMBWRS-GOSISDBHSA-N	444.271	1.777	50	20	IDGD	
COC(=O)[C@@H]1CC[C@H](C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCBr)C[C@@H]32)C1	1784081958	OSGGLQIMPYEXBY-QRJUGERDSA-N	445.354	1.340	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](N)Cc3cscn3)C[C@@H]21	1784617962	GIGXMQWAPJUNRT-RKOFLFEYSA-N	428.986	1.400	50	20	IDGD	
O=C(Cc1cnccn1)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1	1786225109	GJBTYIZHSOIWQP-UHFFFAOYSA-N	430.273	1.147	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc4n(n3)CCC4)[C@H]2C1	1788415547	GFECGJXXSLPQDF-DSPQJCBJSA-N	425.327	1.206	50	20	IDGD	
C[C@@H](NNc1ccccc1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]2C1	1788761821	DVIXQZRHEAPQPV-UMGGQSCQSA-N	448.640	1.823	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc4cc(C)ccn4c3=O)C[C@@H]21	1789859462	CXVPMXKHBIINOG-OWLYRPNTSA-N	446.935	1.614	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3[nH]cc4c3CCC4)C[C@@H]21)[C@H](F)Br	1789924797	WWSKCZBRKJJIEX-PCBIJLKTSA-N	428.302	1.787	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3c(O)cc(O)cc3O)[C@H]2C1	1790158312	MORGIVVQCCNNCE-OUCVZQCGSA-N	443.294	1.180	50	20	IDGD	
CC(=O)N/C(=C\c1ccco1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Cl)C[C@@H]21	1790178137	JSJDROVKSPSVKB-ABBAMVGSSA-N	427.860	1.271	50	20	IDGD	
CN[C@@H](CC(=O)NC1(c2ccc(NC(=O)[C@H](C)Br)cc2)CCC1)C(=O)O	1791434810	ZVMUXHSTEZTKLL-FZMZJTMJSA-N	426.311	1.967	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1noc3c1CCCC3)C2	1792868062	OIWXRZXZIUNOEJ-JFILPPLUSA-N	440.338	1.788	50	20	IDGD	
COCCn1nccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](C)CBr	1792988314	VBABQZUEBAQEKL-APIJFGDWSA-N	427.343	1.812	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CC(=O)N(Cc2ccccc2)C1	1793404537	ZQSYIKAOERQYHZ-OUUBHVDSSA-N	447.963	1.927	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCOc1ccccc1)C2	1795112918	XOAQMVXSTLUGNT-CCWDJLKJSA-N	425.323	1.830	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1(c3ccccc3)CCC1)C2	1796190458	ZNXHIOZZNDYFNR-KOUNCHBCSA-N	432.329	1.740	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1nc2ccccc2[nH]1	1796823741	KUZVEJIWJODKQT-RDBQEKCUSA-N	425.258	1.457	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1ON=C(c2ccccc2)O1	1797639509	CRRVVKQAMAOEDD-JXVINKLPSA-N	435.908	1.718	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C=N/O[C@@H]1CCCCO1	1797817108	YJAQLWQBPHZPSJ-RDYRMYCPSA-N	446.342	1.279	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CC(C)C)C2	1798522732	RWOMODTXAVFFNM-YVWYUNDQSA-N	433.461	1.769	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COc1ccccc1F)C2)[C@H](F)Br	1799347664	ULIYKFMGUURSNX-OJXGSEEGSA-N	433.249	1.485	50	20	IDGD	
CC[C@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCOCCOCCOCCOC)C2	1800074848	HJUPNAQFVGHTFR-RDGPPVDQSA-N	448.988	1.728	50	20	IDGD	
CN(C)[C@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)c1ccccc1Cl	1800308816	BCPLPGFJEGYKCZ-IYYQDKMGSA-N	444.359	1.132	50	20	IDGD	
Cc1nn[nH]c1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C#N)=C/c1ccc(F)cc1F	1800332931	DAWCLGSOOGANFC-BJUDCHGJSA-N	442.426	1.202	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](O)Cc1ccccc1	1800637880	VEFWHKPJYKNCHH-RZFLPCETSA-N	439.350	1.353	50	20	IDGD	
COc1c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)Br)ccc(F)c1F	1800759854	MANPEIVEXDXHKI-ZVXAKGHKSA-N	447.276	1.960	50	20	IDGD	
C[C@@H](Oc1cccnc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2	1801398736	HPURBNFNRSYIBA-VWPFQQQWSA-N	426.311	1.224	50	20	IDGD	
CSc1ccc(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)cc1	1802648022	JGNRELLEHBIJJX-ACDBMABISA-N	438.358	1.583	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@H]1CCN(C(=O)Cn2ccnn2)[C@H]1c1cccnc1	1803008634	MKCRXYUQYDZIRO-UNEWFSDZSA-N	435.326	1.410	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cc3ccccn3n2)[C@H]1c1cccnc1)[C@@H](O)CCl	1803140122	YHKCJEOKFIHHMY-SNRMKQJTSA-N	427.892	1.649	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)C23CC(F)(C2)C3)[C@H]1c1cccnc1	1803661483	RMRSASKBGVQABP-VYRUVADXSA-N	431.512	1.353	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(C(=O)N(C)C)c1	1803977490	NJKUKYMTURITFU-REPLKXPHSA-N	443.548	1.013	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2cnc(OC)cn2)[C@@H]1c1cccnc1	1806044901	COBBBZWJIOQDRG-VKJFTORMSA-N	433.896	1.454	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H](CNC(=O)[C@@H]2CCC(=O)N2)[C@@H]1c1cccnc1	1806639878	FQRVGPKBTWEIPF-DFHZNHDVSA-N	427.332	1.602	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)Cc2ccsc2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1	1807370372	CBOGJXCINCGFCB-UGKGYDQZSA-N	449.341	1.385	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)c1cn2cccnc2n1	1809776521	ZBXNODCRLWLEQW-XIRDDKMYSA-N	428.880	1.044	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@@H](CNC(=O)c2cnc(O)[nH]2)[C@@H]1c1cccnc1	1810942135	BDTPGUKPRYAHBG-ZLDLUXBVSA-N	436.310	1.861	50	20	IDGD	
CCS(=O)(=O)CC(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](C)CBr)n[nH]1	1814778395	GOSHXJSBPAQXFU-YPMHNXCESA-N	449.371	1.868	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CN2CCS(=O)(=O)CC2)n[nH]1	1815672975	NKMCQORXVQGRCC-DZGCQCFKSA-N	445.973	1.150	50	20	IDGD	
CCNC(=O)N[C@@H](C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCBr)n[nH]1	1816782465	QNBOWYXEVDVAEU-AAEUAGOBSA-N	443.346	1.894	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@H](F)Br)CC2)c1cnc(O)nc1O	1817087674	VOVASPFVCXUKIM-ANLVUFKYSA-N	446.258	1.261	50	20	IDGD	
O=C(CCN1CCOC1=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](F)Br)[nH]n1	1818848438	FPJBTSRTQOIFMN-BXUZGUMPSA-N	446.277	1.935	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1)[C@@H]1ON=C(c2ccccc2)O1	1819296597	VISWEHQETHBJAF-MDOVXXIYSA-N	447.879	1.736	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCc2ccc(O)nn2)[nH]n1	1822377548	XTGATSRRUAIDQT-UKRRQHHQSA-N	436.900	1.784	50	20	IDGD	
Cc1ccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)nc1	1822412696	FEFZLOOPIFRXKL-QGZVFWFLSA-N	427.509	1.792	50	20	IDGD	
O=C(CC[C@H]1CCOC1)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1823028500	NAXJPBYMEBRWMV-KXBFYZLASA-N	440.309	1.212	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCC(=O)NN(C)C)CC2	1825647878	VYCYABDHFFYSDD-VHSXEESVSA-N	446.371	1.212	50	20	IDGD	
Cc1nscc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1	1825657445	OOCICANCLGTPSA-FQEVSTJZSA-N	441.362	1.678	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@H]1CCCS1(=O)=O)CC2)C(Cl)Cl	1826103747	ZVFGYEITLSPDTQ-OIBJUYFYSA-N	426.347	1.436	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1CCc2nc(NC(=O)C3=COCC3)sc2C1	1827236995	JLSUINOTQPGNBU-OBPDLJBASA-N	442.501	1.493	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1CCCCO1)CCO2	1829908313	DTZMDBPYQYAFHR-RVKKMQEKSA-N	433.343	1.043	50	20	IDGD	
C[C@@H](C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2)n1cccc1C=O	1830357856	MUAHINOLCAPUOR-HRAATJIYSA-N	439.940	1.583	50	20	IDGD	
Cc1nc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)co1	1830537887	RUTRPEYTYLRBMK-PXAZEXFGSA-N	430.299	1.084	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)c(Cl)c1	1830736920	BWUYIWWJXQAVON-LPHOPBHVSA-N	431.316	1.318	50	20	IDGD	
O=C([C@@H](O)CCl)N1CCO[C@]2(COCCN(C(=O)C34CC(c5ccccc5)(C3)C4)C2)C1	1830737284	CVVVGOICBGVPBF-DVVHHAQGSA-N	448.947	1.164	50	20	IDGD	
C=CCOCCCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)CBr)C2)C1	1831404399	MRPRUPRMCHKTKH-QFBILLFUSA-N	447.370	1.457	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CC3CCN(C)CC3)C2)C1	1831638748	GFFALGDHHIHWSX-NQIIRXRSSA-N	429.989	1.582	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCBr)C2)C1	1831644173	QGNRGTOFIKIFCN-BBRMVZONSA-N	425.751	1.635	50	20	IDGD	
O=C(/C=C/c1ccoc1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1832651892	ZQDLPUIIMTWSKP-PHQDNCEWSA-N	431.258	1.440	50	20	IDGD	
Cc1nn(C)c(C(=O)N2CCO[C@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)c1F	1833702255	PGVOZYHEPXTUBM-LJQANCHMSA-N	430.908	1.203	50	20	IDGD	
Cc1cc(C(=O)NC2CCN(C3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)c(C)o1	1834166611	LCHXDFPLJHLRQG-UHFFFAOYSA-N	447.580	1.455	50	20	IDGD	
C[C@H](C(=O)N1CCC(N2CCC(NC(=O)CCBr)CC2)CC1)n1cccn1	1834423383	IWGBBDXYUIMDSU-OAHLLOKOSA-N	440.386	1.801	50	20	IDGD	
CC[C@H](C)[C@@H](N)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)CBr)CC2)CC1	1834681740	GKPKHBYIWLHDIR-RLFYNMQTSA-N	445.446	1.962	50	20	IDGD	
CC[C@H](C)[C@@H](N)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)Br)CC2)CC1	1834689373	IHEIDKULMTUAPB-JJRVBVJISA-N	431.419	1.715	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cc(F)cn3C)CC2)CC1	1835249600	YDXIRSCRVUFYJF-QGZVFWFLSA-N	428.936	1.603	50	20	IDGD	
CCCC(=O)N[C@H](C)C(=O)NC1CCN(C2CCN(C(=O)[C@H](Cl)CC)CC2)CC1	1835820785	QEJCOEWCOWIJOV-CRAIPNDOSA-N	429.005	1.880	50	20	IDGD	
COc1cscc1C(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836718163	TYXDZXAQONGKAM-MRXNPFEDSA-N	430.954	1.969	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccccc3)C2)C1	1839150913	CCGDOOOQKNTSHR-UXHICEINSA-N	429.344	1.922	50	20	IDGD	
CN(C)c1ncc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)o1	1839151605	XTPHOYQBFGJCQR-QZTJIDSGSA-N	449.335	1.047	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc(N)s3)C2)C1	1839152138	OWDDZCKPXPLFEM-HZPDHXFCSA-N	437.349	1.032	50	20	IDGD	
CCc1nc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](Br)CC)CCO3)co1	1839965623	FNQLEDMHWVVCAM-SCLBCKFNSA-N	444.326	1.481	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C=C/c3ccoc3)C2)C1	1840031126	GILRIOLRQHJXJR-HEFFKOALSA-N	427.295	1.533	50	20	IDGD	
Cc1cccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)c1	1840034127	AXXCPBACWHYEOC-BEFAXECRSA-N	425.323	1.848	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(CC#N)cc3)C2)C1	1840154877	IMVUIPXRAMIVHE-RXVVDRJESA-N	435.908	1.076	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(O)c(C)c3)C2)C1	1840154983	MAAVFHUFSWYYJG-JXFKEZNVSA-N	426.897	1.024	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)[C@@H](C)n2ccnc2)C1	1841467286	ZSXLRFNHEWVDKL-CQSZACIVSA-N	441.444	1.795	50	20	IDGD	
C[C@@H](Sc1ccccn1)C(=O)N1CC2(CCCN2C(=O)c2cnccc2C(=O)NN)C1	1844265292	OIRDIMHYBWPLBQ-CQSZACIVSA-N	440.529	1.078	50	20	IDGD	
CC(C)(C)OC(=O)NCC[C@H](O)C(=O)N1CCCC12CN(C(=O)C(C)(C)CCl)C2	1845220571	AAMITTYUDYAOEI-AWEZNQCLSA-N	431.961	1.731	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)c2cc(OC)c(OC)c([N+](=O)[O-])c2)C1	1845552403	MJKCTENJNAOULR-ZDUSSCGKSA-N	441.868	1.683	50	20	IDGD	
Cc1nn2cc(CC(=O)N3CC[C@H]4[C@@H]3CCN4C(=O)[C@@H](C)CBr)nc2s1	1847493877	JUNLTVKVXCMBLE-BPNCWPANSA-N	440.367	1.875	50	20	IDGD	
O=C(CCNC(=O)c1ccc(Br)cc1)NNC(=O)c1ccc2c(c1)OCO2	26690269	JFHLNWZJVXLUQQ-UHFFFAOYSA-N	434.246	1.759	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@H]2CC(=O)N(Cc3ccc(C)cc3)C2)cc(OC)c1OC	28700518	KRINMLNRHFOONG-KRWDZBQOSA-N	441.484	1.831	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CC[C@H](C(F)(F)F)NC1=O)c1ccc(F)cc1Br	195571188	ZZYOGDRJNYIGCI-PSASIEDQSA-N	426.164	1.806	50	20	IDGD	
O=C(CNC(=O)NCc1ccc(Cl)cc1)NNC(=O)c1nnc(O)c2ccccc12	727365812	YWDAXVQTFLDPDD-UHFFFAOYSA-N	428.836	1.249	50	20	IDGD	
O=C(NNc1nc(-c2cccnc2)no1)c1cccc(S(=O)(=O)NC[C@@H]2CCCO2)c1	728078380	CVXQVGRZQXGDEY-HNNXBMFYSA-N	444.473	1.346	50	20	IDGD	
COc1ccccc1[C@@H](C)CC(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	728511858	DQJJFHDVXOPSGP-NSHDSACASA-N	425.894	1.951	50	20	IDGD	
CC(=O)Nc1cc(F)c(S(=O)(=O)NNC(=O)CNC(=O)c2cccs2)cc1Cl	729666704	ZTWTXPFFQQZOEQ-UHFFFAOYSA-N	448.885	1.239	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)CNC(=O)c1ccc(Br)s1	730033105	SZNTVIYVKNPUDQ-UHFFFAOYSA-N	426.292	1.726	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)[C@H]1CCN(c2ccc3c(c2)OCCO3)C1=O	730514874	NSHVXLKZJTVKMY-SUMWQHHRSA-N	443.431	1.565	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)NCc1ccccc1CS(=O)(=O)NC(C)C	731497020	RPIXCSZTBGJARL-UHFFFAOYSA-N	434.518	1.667	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)[C@H]1CCN(c2ccc3c(c2)OCCO3)C1=O	732303733	MZABPZAIBZDHLP-CQSZACIVSA-N	431.470	1.358	50	20	IDGD	
CN(CCCC(=O)NNc1ccccc1S(C)(=O)=O)S(=O)(=O)c1ccc(F)cc1	732305477	KRQOLHUCKRVZNS-UHFFFAOYSA-N	443.522	1.773	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)N[C@H](Cc1ccccc1)CN1CCOCC1	732476335	FORYQXQHCLMZRB-HXUWFJFHSA-N	426.517	1.512	50	20	IDGD	
CCOc1ncc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1Cl	732750466	QHWNJJIRTYEXFK-UHFFFAOYSA-N	426.882	1.459	50	20	IDGD	
Cc1nc(S(=O)(=O)NCCC(=O)NNc2nc(-c3ccc(Cl)cc3)no2)cn1C	732975175	CQLAIVHKPDOPJT-UHFFFAOYSA-N	439.885	1.244	50	20	IDGD	
O=C(CN1CCN(S(=O)(=O)c2ccc(C3CCCCC3)cc2)CC1)NNC(=O)C1CC1	733193190	IJNYHOXNZZYDOS-UHFFFAOYSA-N	448.589	1.598	50	20	IDGD	
Cc1cc(C(=O)NNc2ccccc2S(=O)(=O)NC(C)(C)C)ccc1-n1cnnn1	734249547	FVFFTJHAXQRALO-UHFFFAOYSA-N	429.506	1.804	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNS(=O)(=O)c2ccc3c(c2)N(C(C)=O)CC3)cc1	734420180	ZCHWLQMFCPZYRI-AWEZNQCLSA-N	447.513	1.771	50	20	IDGD	
Cc1ccccc1OCCCC(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	735118317	RQYUUMOOEGXSBX-UHFFFAOYSA-N	447.561	1.628	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)CC2(N3CCOCC3)CCCC2)c2ccccc2c1=O	735834041	XKDGAPSWADMECE-UHFFFAOYSA-N	441.532	1.774	50	20	IDGD	
CC[C@@H](Nc1c([N+](=O)[O-])c(C)nn1C)C(=O)NNC(=O)c1cc(-c2ccccc2)[nH]n1	735840832	OMBCHBLMEXODSX-CYBMUJFWSA-N	426.437	1.679	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)CCN2C(=O)CCc3ccccc32)c2ccccc2c1=O	737469374	MPDIWXJRINRESS-UHFFFAOYSA-N	447.495	1.937	50	20	IDGD	
CCc1cc(NNC(=O)C/N=C2/NS(=O)(=O)c3ccccc32)nc(-c2ccccn2)n1	738531102	AUQGIFFJVSOWTH-UHFFFAOYSA-N	437.485	1.283	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCc2c[nH]nc2C1)c1cccc(S(=O)(=O)N2CCCCC2)c1	742468239	QOYAYJPPUIEFDI-HNNXBMFYSA-N	431.518	1.150	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNC(=O)[C@H](C)N2C(=O)[C@H]3[C@H]4CC[C@@H](O4)[C@@H]3C2=O)cc1	744352682	NTXFFODPQQFSIG-LRMKFPBYSA-N	443.500	1.423	50	20	IDGD	
O=C(CCc1nc2ccccc2o1)NNc1ccccc1S(=O)(=O)N1CCOCC1	744619456	PFSCLZIIYADLCO-UHFFFAOYSA-N	430.486	1.925	50	20	IDGD	
COc1cc([N+](=O)[O-])c(C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)cc1SC	744953232	UGFOHHVOOLPZDB-UHFFFAOYSA-N	444.425	1.815	50	20	IDGD	
CC(=O)N[C@@H](CC(=O)OCC(=O)NNC(=O)c1cccs1)c1ccc(F)cc1F	745144140	YCBCXYHNQWKRRO-AWEZNQCLSA-N	425.413	1.598	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)N[C@H]3CCCN(c4ccn(C)n4)C3=O)n[nH]2)cc1	745884297	UIUAWDBQULNCIO-HNNXBMFYSA-N	436.476	1.258	50	20	IDGD	
C#CCCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2OC)c1	745899629	GRPCUROHWDITGT-UHFFFAOYSA-N	430.486	1.853	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)Cc2cn3ccccc3n2)ccc1OCC(=O)OC	746553541	MWDLLRUAVGDISD-UHFFFAOYSA-N	426.429	1.289	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)c2ccc([C@]3(C)NC(=O)NC3=O)cc2)o1	748090085	FPRAHMYYQOOSOQ-NRFANRHFSA-N	427.461	1.251	50	20	IDGD	
CCCCCCOc1ccc(C(=O)NNC(=O)C2=S=CC(S(=O)(=O)NC)=C2)cc1	748695053	ROQAGOADZMXQKV-UHFFFAOYSA-N	439.559	1.561	50	20	IDGD	
CC(=O)N1CCN(c2ccc(C(=O)NNC(=S)N[C@H](C)C3CC3)cc2[N+](=O)[O-])CC1	751617502	BGDKBMJFWJFQDD-GFCCVEGCSA-N	434.522	1.171	50	20	IDGD	
COc1cc(OC)cc(N2C[C@H](C(=O)NNC(=O)c3ccc4c(c3)OCCO4)CC2=O)c1	752283831	GDUHZMOUJKKYDM-CQSZACIVSA-N	441.440	1.289	50	20	IDGD	
C[C@H]1C[C@H](CCNC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)CN1Cc1ccccc1	752996887	HVTKUWADHPRIIV-HKUYNNGSSA-N	448.531	1.907	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)NC[C@@H]2CCCCS2(=O)=O)c1	753268525	CIBYVMLCDSVWLS-NSHDSACASA-N	434.312	1.369	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)N[C@@H]1CCN(Cc2ccc(C#N)cc2)C1=O	753733463	QNJOFHADIDOXQQ-KBXCAEBGSA-N	439.447	1.596	50	20	IDGD	
COCCOCC(=O)NC1CCC(C(=O)NNc2ccc(-c3ccccc3)nn2)CC1	754469876	IFZIOHQJMGEYAN-UHFFFAOYSA-N	427.505	1.925	50	20	IDGD	
N#C/C(=C\c1ccc(O)cc1)C(=O)OCC(=O)N(C[C@@H]1CCCO1)[C@@H]1CCS(=O)(=O)C1	754536543	KLYWZULWJBZRGX-DWENRMJNSA-N	448.497	1.037	50	20	IDGD	
Cc1c(NC(=O)NNC(=O)COc2ccccc2F)cccc1C(=O)N1CCOCC1	756185039	XJFIISUBUHYYLK-UHFFFAOYSA-N	430.436	1.838	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)CNC(=O)c1cc(C)cc(C)c1	756399913	RTUNNAHRBLPGNL-UHFFFAOYSA-N	447.875	1.700	50	20	IDGD	
CCC(CC)NC(=O)[C@@H]1CN(CC(=O)NNC(=O)c2cccc(C#N)c2)c2ccccc2O1	756590878	RFUXXMUGFDEIFX-NRFANRHFSA-N	449.511	1.892	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2cc(S(=O)(=O)N(C)C)ccc2F)cc1OC	756686672	WFXXZPUOXZIBKD-UHFFFAOYSA-N	440.453	1.560	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2cc3c(s2)CCC3)cc1	756782513	BXJVDFLHVBDYPD-UHFFFAOYSA-N	438.531	1.628	50	20	IDGD	
O=C(CCc1ccccc1)NNC(=O)Nc1cc(C2CC2)nn1[C@H]1CCS(=O)(=O)C1	756854122	CGRUBQWOMNIPCK-INIZCTEOSA-N	431.518	1.906	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)Nc1cc(C2CC2)nn1[C@@H]1CCS(=O)(=O)C1	756857217	TVODYNYWEXTXMQ-MRXNPFEDSA-N	447.517	1.490	50	20	IDGD	
COc1ccccc1N1CC[C@@H](NC(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)C1=O	757287894	UTOQQWYNDFNDNC-CYBMUJFWSA-N	429.389	1.059	50	20	IDGD	
CCN1CCN(C(=O)Cc2ccc(NC(=O)NNC(=O)c3ccccc3OC)cc2)CC1	757583705	UFVXPRIQKDKUQZ-UHFFFAOYSA-N	439.516	1.868	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)NNC(=O)c2cccc(N(C)C)c2)cc(S(C)(=O)=O)c1	757609531	XFXHGNCEWUDMEY-UHFFFAOYSA-N	448.501	1.799	50	20	IDGD	
CS(=O)(=O)N1CCc2c(NC(=O)NNC(=O)c3cnn(-c4ccccc4)c3)cccc21	758297869	ANUWSGJVKXDMDN-UHFFFAOYSA-N	440.485	1.661	50	20	IDGD	
COc1ccc2c(c1)OC[C@H]2CC(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	760613562	PCDCXJQZEVEVIV-CYBMUJFWSA-N	429.385	1.474	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)C1=Cc2cc(F)ccc2OC1	761816366	ZZSOVVSYKAFRPX-UHFFFAOYSA-N	433.461	1.766	50	20	IDGD	
COC(=O)c1cn([C@@H]2CCCN(C(=O)NNC(=O)c3cc4c(s3)CC[C@H](C)C4)C2)nn1	762556756	QPOICIWKTXEQSM-GXTWGEPZSA-N	446.533	1.943	50	20	IDGD	
CCNS(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)c1	763172891	DLVYFAUSGYLSCU-UHFFFAOYSA-N	449.439	1.728	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)NC1CCN(C[C@@H]2CCOC2)CC1	763513930	UINMSIQGFQSRMM-HNNXBMFYSA-N	427.546	1.123	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)c(OCCN(C)C)c1	763559993	YGQCWKKTIBSQCM-UHFFFAOYSA-N	428.445	1.064	50	20	IDGD	
Cc1cc(Br)ncc1NC(=O)C(=O)NNC(=O)[C@H]1COc2ccccc2O1	763573305	YLGVXJMQRNARDA-CYBMUJFWSA-N	435.234	1.078	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(C)c(S(=O)(=O)NC3CC3)c2C)c(C)o1	763581748	DKLWUMLLDKAYMA-UHFFFAOYSA-N	448.501	1.354	50	20	IDGD	
Cc1cccc(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)c1C(=O)N1CCCC1	763674164	MJUJSUMKJDLUPQ-UHFFFAOYSA-N	449.467	1.268	50	20	IDGD	
CCN1CCC(n2nccc2NC(=O)C(=O)NNC(=O)c2cccc(N(C)C)c2)CC1	763760438	PALPCCWXADBBPF-UHFFFAOYSA-N	427.509	1.006	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1OC(F)F	763789841	FTJZNEDGULODFC-UHFFFAOYSA-N	445.382	1.243	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccc(C(=O)N2CCCC2)cc1	763849108	HNOADLIMLAWYHF-CQSZACIVSA-N	442.447	1.615	50	20	IDGD	
CC(C)CC(=O)NNC(=O)C(=O)Nc1cccc(S(=O)(=O)N(C)C2CCCCC2)c1	763883149	UJCNXIPHISRVLQ-UHFFFAOYSA-N	438.550	1.772	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)CCC(=O)N3)cc1OC	763901279	MVWRKYBGOJKMMY-UHFFFAOYSA-N	426.429	1.378	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2cc(Br)cn2C)cc(OC)c1	764001720	CYJVAOOKJQUILX-UHFFFAOYSA-N	425.239	1.205	50	20	IDGD	
CC(=O)N(C)c1cccc(NC(=O)C(=O)NNC(=O)c2cccc(Br)c2)c1	764063476	PMMLIWKQMZZZBJ-UHFFFAOYSA-N	433.262	1.832	50	20	IDGD	
COC(=O)c1csc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(C)cc3)[nH]n2)c1	764112066	VGXYCCJOKXQCDH-UHFFFAOYSA-N	427.442	1.633	50	20	IDGD	
CNC(=O)c1cc(Oc2ccccc2NC(=O)C(=O)NNC(=O)CC(F)(F)F)ccn1	764115078	MPIFQYPOXNGNRM-UHFFFAOYSA-N	439.350	1.272	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(OCC(F)(F)F)nc2)c1O	764131493	KDEKCAAVPDRZNQ-UHFFFAOYSA-N	428.323	1.137	50	20	IDGD	
Cc1ncsc1C(=O)NNC(=O)C(=O)Nc1cc(C(=O)N(C)C(C)C)ccc1Cl	764244339	FRXDTGAUIIWPQG-UHFFFAOYSA-N	437.909	1.985	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1ccc([S@](=O)C(F)(F)F)cc1	764276073	YQIBSJYUGBYOMU-PMERELPUSA-N	445.375	1.185	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2O)n(-c2ccc(F)cc2)n1	764277298	BBBXEIZZBHTLOG-UHFFFAOYSA-N	427.392	1.190	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)ccc1O)C(=O)N1CCc2cc(F)c(F)cc21	764279734	DOPKLKOTOZFTBO-UHFFFAOYSA-N	440.200	1.783	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cnc(Br)c(Br)c2)o1	764367701	KZSNFZXLIRKDFS-UHFFFAOYSA-N	446.055	1.908	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1cc(OC)c(OC)c(OC)c1	764392252	DALKXJMQLWPKLH-UHFFFAOYSA-N	449.485	1.599	50	20	IDGD	
COCCNc1ccc(S(N)(=O)=O)cc1NS(=O)(=O)c1ccc(CCCl)cc1	765141740	NDGKONANSGPENA-UHFFFAOYSA-N	447.966	1.974	50	20	IDGD	
O=C(Cn1nc(-c2ccccc2)ccc1=O)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	765618333	YULZBKNBKYFCIX-UHFFFAOYSA-N	432.415	1.901	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNc2nccnc2OC)c2ccccc12	766261359	VRKLSWJDJGQHPY-UHFFFAOYSA-N	425.401	1.272	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)NCCS(=O)(=O)CC2CC2)N(C)c2ccccc21	766621234	GKEOMYPZDNSSSQ-UHFFFAOYSA-N	430.530	1.598	50	20	IDGD	
C[C@H](c1ccccc1)[C@](C)(O)C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	766636570	QJTJCQTXSNFGMQ-KOSHJBKYSA-N	438.528	1.147	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)c1cc(F)ccc1[N+](=O)[O-]	766664293	OZCSGGIZXYKXAK-UHFFFAOYSA-N	449.870	1.966	50	20	IDGD	
Cc1noc(C2CC2)c1NC(=O)C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	768233284	MSYCQRJNZQNFFZ-UHFFFAOYSA-N	440.504	1.159	50	20	IDGD	
O=C(NNC(=O)c1c[nH]n2c1nc(=O)c1ccccc12)c1cc(-c2ccc(F)cc2)[nH]n1	768275668	FGXKTQPBKLLSAU-UHFFFAOYSA-N	431.387	1.780	50	20	IDGD	
COCCS(=O)(=O)c1ccc(C(=O)NNc2c(OC)cccc2S(C)(=O)=O)cc1	768629693	SKKIBNMTGWLRMK-UHFFFAOYSA-N	442.515	1.276	50	20	IDGD	
O=C(NNC(=O)c1nccn2c(Br)cnc12)c1cc(Br)c[nH]1	769627743	XYEKEGZJRXKMME-UHFFFAOYSA-N	428.044	1.657	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)NCc1ccnc(N2CCN(C)CC2)c1	770147933	WXEBICNVKLYBHV-HNNXBMFYSA-N	446.939	1.785	50	20	IDGD	
CSCCNC(=S)NNC(=O)CCCCC/N=C1/NS(=O)(=O)c2ccccc21	770247440	MECLNNRAGYEWEY-UHFFFAOYSA-N	443.620	1.144	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)c3cnn(-c4ccc(Br)cc4)c3)nc21	770974592	MXSCMSMFFBSKGV-UHFFFAOYSA-N	429.238	1.774	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(Br)cn2)cc1	773531525	ZLOWQBNTBOBSFI-NSHDSACASA-N	449.261	1.600	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)C(=O)Nc1cc(C(F)(F)F)ccn1	773661137	JPXBIFHMCCSPOR-UHFFFAOYSA-N	443.407	1.623	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C)c(N3CCCS3(=O)=O)c2)cc1F	773888401	GPSOXYSAFLLMPC-UHFFFAOYSA-N	448.476	1.382	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)NCc1ccc(OC(F)F)cn1	775219728	JSPQZLYFQFOIHV-UHFFFAOYSA-N	448.474	1.726	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)Nc1ccc(C[C@@H]2NC(=O)NC2=O)cc1	775706882	JJMRYMPAONUXNI-HNNXBMFYSA-N	441.444	1.068	50	20	IDGD	
CN(NC(=O)c1ccc(-n2cccn2)nc1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776206339	SKFAXHQFDHOINT-UHFFFAOYSA-N	429.481	1.517	50	20	IDGD	
Cn1nc(Br)c2c(=O)n(CC(=O)NNc3ccc4ccccc4n3)cnc21	777466805	MTUKWZUAILFBTQ-UHFFFAOYSA-N	428.250	1.584	50	20	IDGD	
Cc1cc(N2C[C@H](C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)CC2=O)ccc1F	780683417	IFKKHVJTHPQHGI-CQSZACIVSA-N	436.484	1.939	50	20	IDGD	
COc1cccc(NNC(=O)C2CCN(S(=O)(=O)c3cc([N+](=O)[O-])ccc3C)CC2)n1	780768637	BVQNVXOHNBBROB-UHFFFAOYSA-N	449.489	1.851	50	20	IDGD	
CCCn1nc(C(=O)NNS(=O)(=O)c2ccc(OCC)nc2)c2ccccc2c1=O	781659185	VXTFZCWCSITCJL-UHFFFAOYSA-N	431.474	1.224	50	20	IDGD	
O=C(NNc1ncncc1Cl)C(=O)Nc1cc(Br)cnc1-n1cccn1	782158424	DJIJLFXMVCGGEA-UHFFFAOYSA-N	437.645	1.555	50	20	IDGD	
CC(=NNC(=O)[C@@H](C)CN1CCOCC1)[C@H]1CN(C(=O)OCc2ccccc2)CCO1	783809188	ZVHRKTBSFAFZRY-FXAWDEMLSA-N	432.521	1.484	50	20	IDGD	
CS(=O)(=O)c1cc(Br)ccc1NC(=O)C(=O)NNc1cc(Cl)ccn1	784861148	RIUZIWZJNDILRL-UHFFFAOYSA-N	447.698	1.983	50	20	IDGD	
CN(C)c1nccc(NNC(=O)C(=O)Nc2cnn(-c3ccc(C(F)(F)F)cc3)c2)n1	784968786	DXXAEJGUSMMYRW-UHFFFAOYSA-N	434.382	1.829	50	20	IDGD	
CNC(=O)c1ccc(C)c(NC(=O)C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)c1	785099823	LGIASUYVHRZMCS-UHFFFAOYSA-N	445.426	1.607	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)c2cn(Cc3noc(C)n3)nn2)cc1Cl	785130220	NBXJDTMRBYOVCX-UHFFFAOYSA-N	436.816	1.155	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1ccc(Br)cc1	785329903	AIJRWRULWHYALG-UHFFFAOYSA-N	442.291	1.943	50	20	IDGD	
O=C(COC(=O)[C@H](Cc1ccccc1)NC(=O)c1cccnc1)NNC(=O)c1ccccc1	785764737	GERNEVQDVGEJAM-FQEVSTJZSA-N	446.463	1.427	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)Nc1cccc2c1OC(C)(C)C2	789585155	ZOKFCEYBFHIKKR-UHFFFAOYSA-N	435.278	1.901	50	20	IDGD	
O=C(NNC(=S)Nc1ccsc1)c1cccc(S(=O)(=O)N2CCOCC2)c1	790303763	WOEVIVGLHAVKGG-UHFFFAOYSA-N	426.545	1.400	50	20	IDGD	
COCCCn1c(S)nc2cc(C(=O)NNc3nc4ccccn4n3)ccc2c1=O	791257233	BBRWEGLFYYTINJ-UHFFFAOYSA-N	425.474	1.521	50	20	IDGD	
CSSCCNC(=O)C(=O)Nc1cccc(S(=O)(=O)/N=C2\CCCN2C)c1	793078054	ATESGOXWFJLHCR-XMHGGMMESA-N	430.577	1.565	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)N2CCC[C@@H](CN3CCN(c4ccccn4)CC3)C2)n1	793232518	XAZKWZFXMMEBRC-IBGZPJMESA-N	437.548	1.674	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NN=C[C@@H]1CCCSC1	794859969	KTVJWDCKCBBVBU-KRWDZBQOSA-N	425.576	1.885	50	20	IDGD	
C=C(CBr)COC(=O)CNC(=O)c1cccc(S(=O)(=O)N(CC)CC)c1	795364082	LLAPJIFLJQSVHM-UHFFFAOYSA-N	447.351	1.941	50	20	IDGD	
CN(c1ccccc1NC(=O)NNC(=O)CNC(=O)OCc1ccccc1)S(C)(=O)=O	797634439	LTLMUOVYJCYHNM-UHFFFAOYSA-N	449.489	1.162	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)Nc1ccc(F)c(N2CCOC2=O)c1	797661743	ORYYRAJWMQRIPM-UHFFFAOYSA-N	426.364	1.898	50	20	IDGD	
Cn1ncc2c(O)nc(NNS(=O)(=O)c3ccc(OCCBr)cc3)nc21	799530627	LLAXVCNHBCCEJC-UHFFFAOYSA-N	443.283	1.148	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)Nc2cc3c(cc2N2CCCCC2)n(C)c(=O)n3C)cn1	800592805	LXLKTMMCFNJSCL-UHFFFAOYSA-N	426.481	1.067	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)N[C@H]1CCCN(C(=O)Cc2ccccc2)C1	800983325	GNHULDGLMDSDRS-SFHVURJKSA-N	440.500	1.638	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1)Nc1ccccc1	801991070	CMDNESYREJBLGK-CQSZACIVSA-N	447.473	1.848	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)Nc2ccc(OC(F)F)cc2)nc2c1c(=O)n(C)c(=O)n2C	802045563	PHFKJALIIIVGMD-UHFFFAOYSA-N	448.386	1.009	50	20	IDGD	
CCC[C@@H](CCCS(C)(=O)=O)C(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	802068045	XTIJJFMHQONTAM-ZDUSSCGKSA-N	433.552	1.484	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(F)(F)F)nc2C)c(OC)c1	802567341	SPMZEAGJMGJCGV-UHFFFAOYSA-N	426.351	1.826	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNc3ccc(-n4ccnc4)nn3)cc2)C[C@@H](C)O1	807429860	ZIXIWSDMFNKPPN-GASCZTMLSA-N	436.476	1.358	50	20	IDGD	
Cc1cc([N+](=O)[O-])ccc1NNC(=O)C(=O)Nc1cccc2c1CCN2S(C)(=O)=O	807455880	YHGGCCORZYNBTA-UHFFFAOYSA-N	433.446	1.307	50	20	IDGD	
O=C(NNc1nccnc1C1CCC1)C(=O)Nc1ccc(CC(=O)N2CCOCC2)cc1	807461685	OYOIDAHZZPYHAW-UHFFFAOYSA-N	438.488	1.227	50	20	IDGD	
NS(=O)(=O)c1cc(C=NNC(=O)CCN2CCN(c3ccccc3)CC2)ccc1F	807944762	OKRQMTADXUCBLB-UHFFFAOYSA-N	433.509	1.136	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)CNS(=O)(=O)c1cccc(C(F)(F)F)c1	810356831	YDWFNDXQSVVRCB-UHFFFAOYSA-N	445.419	1.470	50	20	IDGD	
C[C@H]1CCCN(c2cc(C(=O)OCC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)ccn2)C1	812654079	SEHHLGCRQCYXTM-AWEZNQCLSA-N	441.444	1.844	50	20	IDGD	
O=C1CN(Cc2cccc(NC(=O)C(=O)NNc3ncccc3C(F)(F)F)c2)CCN1	812983536	VRRGLZJQNYGVOB-UHFFFAOYSA-N	436.394	1.114	50	20	IDGD	
COC(=O)[C@]1(c2ccccc2)CCN(C(=O)NNC(=O)CNC(=O)c2cccs2)C1	814294204	HQZDDYHNKTVXAN-HXUWFJFHSA-N	430.486	1.035	50	20	IDGD	
O=C(NN=C1CCS(=O)(=O)CC1)c1cccc(S(=O)(=O)NCc2ccccc2)c1	814709382	AAALNKPRAYPGLI-UHFFFAOYSA-N	435.527	1.460	50	20	IDGD	
Cc1c(C=NNC(=O)Cc2cc[nH]n2)c2ccccn2c1C=NNC(=O)Cc1cc[nH]n1	814955527	LAJOFKIRTPEEIQ-UHFFFAOYSA-N	431.460	1.080	50	20	IDGD	
COCCOc1ccc(C(C)=NNC(=O)Nc2ccc(S(N)(=O)=O)cc2)cc1OC	814965342	MHVKFTKTHNDTNU-UHFFFAOYSA-N	436.490	1.914	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)CCc2ccccc2O)cc1)[C@@H]1C[C@H]1C	815569184	KAHKRTKZQFULTK-AUUYWEPGSA-N	438.484	1.872	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2nnn(Cc3ccccc3F)c2C)cc1F	815575118	JXDMOVWQHIXHAY-UHFFFAOYSA-N	428.399	1.621	50	20	IDGD	
CN(C)S(=O)(=O)NCC(=O)NNC(=O)c1ccc(COc2ccc(Cl)cc2)cc1	816812263	JUQLNBZXJMTQEP-UHFFFAOYSA-N	440.909	1.076	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@@H]2CSC(c3ccccc3O)=N2)cc(OC)c1OC	816813964	DCMBDBZBHPQABF-ZDUSSCGKSA-N	431.470	1.741	50	20	IDGD	
O=C(COC(=O)c1ccc2c(c1)NC(=O)CCS2)NNC(=O)c1cccc([N+](=O)[O-])c1	843337032	IWMJQEIYDIZBRU-UHFFFAOYSA-N	444.425	1.647	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc2ccccc2c1)NNC(=O)[C@@H]1COc2ccccc2O1	913416812	VEMHLKXEHSEBJZ-IBGZPJMESA-N	441.465	1.106	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2ccc(F)cc2)n1	914749144	DWUCGZSVLLPADC-UHFFFAOYSA-N	445.476	1.901	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@H]2C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c(OC)c1	915059187	GCWUKNCKJDCUNO-KRWDZBQOSA-N	442.428	1.678	50	20	IDGD	
CC(C)(C)c1noc(CCCC(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)n1	915188862	ZJSUEGXESKLPNC-UHFFFAOYSA-N	443.913	1.452	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)NCCc2ccc(S(N)(=O)=O)cc2)c1C	915883755	HQLIESHCGVUCOP-HNNXBMFYSA-N	434.518	1.291	50	20	IDGD	
CCOc1ccc(OCc2ccc(C(=O)NNC(=O)[C@@H](C)N3C(=O)CCC3=O)cc2)cc1	916034364	FLFVUJGKJZDDKF-OAHLLOKOSA-N	439.468	1.963	50	20	IDGD	
O=C(NCCCOc1ccccc1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	916219482	TWNIZXBYLGSCIK-UHFFFAOYSA-N	446.529	1.884	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NC[C@H]2CCN(c3ccccc3)C2)nc1	916579884	QQQNSTYHLMZEKL-MRXNPFEDSA-N	432.550	1.921	50	20	IDGD	
C[C@@H](SCc1ccccc1)C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	917284096	DIUDZIQCODLZKT-KDOFPFPSSA-N	430.482	1.839	50	20	IDGD	
Cc1ccc(Cl)c(O[C@H](C)C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1	917308304	ODSPZNQZSVIXDS-FZKQIMNGSA-N	448.859	1.946	50	20	IDGD	
COC(=O)CCOc1ccc(S(=O)(=O)NNC(=O)c2cc(Br)c[nH]2)cc1	917732948	QEOMFSVTHVLJNF-UHFFFAOYSA-N	446.279	1.342	50	20	IDGD	
COC(=O)COc1ccc(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1	918399687	SFSHMCSUKUSPJP-UHFFFAOYSA-N	440.500	1.212	50	20	IDGD	
Cn1cc(CNC(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)cn1	919792828	JTTLCFVAEOMOFH-UHFFFAOYSA-N	431.460	1.266	50	20	IDGD	
CCN(Cc1ccccc1)C(=O)CNC(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	920050561	ASUUFTVZMHMMMX-UHFFFAOYSA-N	436.472	1.571	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)N[C@H]2CCCN(S(C)(=O)=O)C2)c1	920238571	HKENNEXVJXGCTP-HNNXBMFYSA-N	426.539	1.252	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)c2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1	1115884980	IQDCRHWPLRJWOA-HNNXBMFYSA-N	426.473	1.480	50	20	IDGD	
C[C@@H](O)CNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2c(Cl)cccc2Cl)cc1	1120571428	DVJFKSSTKPSQKB-SNVBAGLBSA-N	446.312	1.727	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)c2ccnc(N3CCCCC3)n2)CC1	1252039855	SXLQTXZXOJEDMO-UHFFFAOYSA-N	432.525	1.875	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN1C(=O)c1ccc2c(c1)OCO2)c1n[nH]c2c1CCCC2	1318245643	LTCVMVZRMXDUIY-OAHLLOKOSA-N	425.445	1.083	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)Cc1nc2ccccc2n1C)CN(C)C(=O)OC(C)(C)C	1318427320	RIJXADASVKJXBQ-AWEZNQCLSA-N	432.525	1.949	50	20	IDGD	
CN(Cc1ccc([S@@](C)=O)cc1)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	1319016689	SMNGZMLKEFZFAC-SSEXGKCCSA-N	430.534	1.303	50	20	IDGD	
O=C(COC(=O)c1ccc(-n2cccn2)c(F)c1)NNC(=O)[C@@H]1COc2ccccc2O1	1321596855	SDHQKTPKYTYFGH-SFHVURJKSA-N	440.387	1.156	50	20	IDGD	
O=C(c1cc2cccn2cn1)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1778051151	NRCGAWFRHTVLLD-PBHICJAKSA-N	425.258	1.468	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@]2(C1)CN(C(=O)c1ccc3c(c1)OCCO3)CCO2	1779295328	IKVZLYGIKQKSAZ-NRFANRHFSA-N	434.565	1.753	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cccn(C(F)F)c3=O)C2)C1	1779363732	YBQIIXIAXJPSAX-GTNSWQLSSA-N	448.264	1.470	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccn(C(F)F)n3)C2)C1	1779615448	CMBOIDLGOKBTIK-HZPDHXFCSA-N	425.263	1.958	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H]1CC(=O)N(C3CCCC3)C1)CCO2	1781214966	GPMRVXLGUQVCHK-LDBYXDLTSA-N	425.957	1.625	50	20	IDGD	
C[C@H](Oc1ccccn1)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781335058	ROVHFLJFTKGFEL-QEORTHHSSA-N	430.274	1.369	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)C3(Br)CC3)C2)C1	1781345869	MBTRFKFOGVILCQ-KGLIPLIRSA-N	428.154	1.980	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H]1CCCN(C)C1)C2	1782003946	ZCUYCIBBPXXEAQ-YKTARERQSA-N	430.387	1.626	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1[nH]nc3ncccc13)C2	1782172908	QHIMNPIGMPHMHS-BXTJHSDWSA-N	435.912	1.339	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCC1CCCC1)C2	1782210751	GWYRNESZLUPCRM-AUSIDOKSSA-N	436.597	1.844	50	20	IDGD	
C[C@@]1(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cccc(B(O)O)c2)C3)CC=CCC1	1782722115	WQBJRHDSBXIPFO-AGILITTLSA-N	440.349	1.240	50	20	IDGD	
COc1ncccc1CCC(=O)N1CCO[C@]2(CCN(C(=O)[C@H](C)Br)C2)C1	1783532583	PWCIFMNOHVDSLJ-IFXJQAMLSA-N	440.338	1.636	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccc(C(C)(C)C)nc1)CCO2	1783933422	YOTZWXWJQCXFCW-HSZRJFAPSA-N	445.564	1.196	50	20	IDGD	
C[C@H](NC(=O)c1ccccc1)C(=O)N1CCO[C@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783952640	UTMIFAMJOSFYEF-DJJJIMSYSA-N	428.316	1.439	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc([N+](=O)[O-])o3)C[C@@H]21	1783964004	GSDWFDNZVCUJPW-MNXVOIDGSA-N	444.282	1.812	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ncc[nH]3)[C@H]2C1	1785784922	ANJUPZQJNVHQCF-DKQAGWEXSA-N	441.438	1.888	50	20	IDGD	
CC(C)N[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CO[Si](C)(C)C)C[C@@H]21)C(C)C	1786963668	OZRULIFVSAFEOY-JPLJXNOCSA-N	427.662	1.840	50	20	IDGD	
CCOC(=O)c1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]3C2)cc1	1787449622	JIGXJGIRSOREHG-QAETUUGQSA-N	426.872	1.991	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)Nc3nccs3)[C@H]2C1	1787490071	YXIBSRHQCHJCNJ-DGTMBMJNSA-N	445.383	1.707	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3=CCCS3)C[C@@H]21	1787506855	QUYXXSWHELGXQZ-GLYSVQQSSA-N	445.545	1.121	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3nnsc3C3CC3)[C@H]2C1	1787680286	VNWIHDYNDBPFAI-IXOXFDKPSA-N	443.367	1.792	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3snnc3C3CC3)C[C@@H]21	1788762724	QAMJJMYJXYTKLA-KKUMJFAQSA-N	438.626	1.860	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)c1ccc(-c2ccccc2)nc1	1789098635	CSGSOMLOPJLTNT-MMKMLUHNSA-N	443.931	1.942	50	20	IDGD	
Cc1ccn(C)c1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)CBr)C[C@@H]21	1789384405	XRYMWJORMJMMFD-VGWMRTNUSA-N	426.355	1.958	50	20	IDGD	
CCn1ccc(C(=O)NC2(c3ccc(NC(=O)c4cnccc4C(=O)NN)cc3)CCC2)n1	1789521252	QBMWWRIAOWIDGR-UHFFFAOYSA-N	447.499	1.963	50	20	IDGD	
O=C(C/N=C/c1ccco1)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1	1789577149	BFEBEPCNCDJYTQ-CVKSISIWSA-N	445.284	1.826	50	20	IDGD	
COc1cccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]3C2)n1	1789922914	XYKMHYJXEQWVNZ-UHXUCMFUSA-N	430.274	1.374	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3nnc(C)s3)C[C@@H]21	1790960845	ASZOLGPRBIJINV-XUXIUFHCSA-N	445.383	1.542	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(C)nn3CC)C[C@@H]21	1790961027	FBWPICYZRIAQNX-MPTYRVRUSA-N	441.370	1.978	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCOCCOCCOC)[C@H]2C1	1791134495	PYADQKCRQFZVEZ-FJIDUMEYSA-N	434.961	1.053	50	20	IDGD	
CC(C)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(N3CCOCC3)c1)C2	1792784420	CNKPWUNBOSDDLS-OPVJXMOQSA-N	449.979	1.991	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnn(C(C)(C)C)c1Cl	1794430688	BTQJLYXVGWJALK-NEBZKDRISA-N	447.363	1.749	50	20	IDGD	
Cc1noc(-c2ccccc2)c1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2	1796476170	MKACYZATXUQPCF-KYHPRHEASA-N	433.892	1.453	50	20	IDGD	
CC[C@@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnccc1C(=O)NN)N(CC)CC	1798439546	HZGKFMWFJIXLGY-RCJHGTSTSA-N	430.553	1.057	50	20	IDGD	
C[C@H]1CCc2c(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@@](C)(Cl)CCl)n[nH]c21	1799275333	PQYGRVKMBRACRU-PCMWVUJGSA-N	429.348	1.899	50	20	IDGD	
Cc1noc(C)c1CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Br	1799344595	NZADDDCMWNMRJK-VZAMPYOESA-N	432.290	1.504	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2)c1cc(O)cc([N+](=O)[O-])c1	1799730504	NIGCGYXUDNFFBM-DRXBFXEBSA-N	442.266	1.289	50	20	IDGD	
COC(=O)CCCCCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)Br)C2	1801074987	MPGUMKRYVMGICE-ZJOBFFGXSA-N	433.343	1.483	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1CN(C(=O)OCc2ccccc2)C1)[C@@H](O)CCl	1801579799	LELTWLSENDWUGB-RDGPPVDQSA-N	449.935	1.493	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1ccc2c(c1)CCO2	1801852569	QWRHHBRBGKXCBL-BCDXTJNWSA-N	449.511	1.115	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)CNC(=O)N(C)C)[C@@H]1c1cccnc1	1802681432	AJVRZXKMAFOZSU-BJJXKVORSA-N	440.342	1.142	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cn3cc(F)ccc3n2)[C@H]1c1cccnc1)[C@@H](O)CCl	1803143256	XXBCSTIQQOSUGS-FNHZYXHNSA-N	445.882	1.788	50	20	IDGD	
CCOc1cnc(C(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)cn1	1804912507	NZNUUMOQGQNDFB-YXJHDRRASA-N	433.896	1.190	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC2(CCCN(C(=O)CCc3cncnc3)C2)CC1	1810081894	LWZBBPHLWVIHQR-UHFFFAOYSA-N	430.553	1.013	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)CNC(=S)NCC)[C@H]1c1cccnc1	1812328683	JFPQISDQGHTEMV-XYJFISCASA-N	440.013	1.979	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)[C@@H]2CCC(=O)N2)[C@H]1c1cccnc1	1812774692	CWWLAUBMLLZFIH-AESZEHBQSA-N	437.338	1.540	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)N1CC[C@H](CNC(=O)[C@H](C)Br)[C@H]1c1cccnc1	1812864463	PLJDGHZIQGBZHE-NSNWQYSKSA-N	439.354	1.738	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)Cn2cc([N+](=O)[O-])cn2)[C@@H]1c1cccnc1)C(Cl)Cl	1813078143	PRVVBZPSJWFARA-IUODEOHRSA-N	441.275	1.696	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2nc3ncccn3n2)[C@@H]1c1cccnc1)C(Cl)Cl	1813078792	AFSCRPRQHQCNNB-QWHCGFSZSA-N	434.287	1.643	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)c2cc(O)nc(O)n2)[C@H]1c1cccnc1)C(Cl)Cl	1813080256	NZDMKULDCAUAMT-MFKMUULPSA-N	426.260	1.406	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)CCn2cncn2)[C@@H]1c1cccnc1	1813321002	HXBBMKCLONRQNN-QRTARXTBSA-N	435.326	1.553	50	20	IDGD	
C[C@H](C(=O)NC[C@@H]1CCN(C(=O)CO[Si](C)(C)C)[C@@H]1c1cccnc1)n1cnnn1	1813471433	YFYXLIFILZCGOS-UWWQBHOKSA-N	431.573	1.187	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc([N+](=O)[O-])o2)n[nH]1	1814311206	AMBHVFRWKIUNDO-CYBMUJFWSA-N	447.452	1.590	50	20	IDGD	
CN1CCN(CC(=O)Nc2cc([C@H]3CCCCN3C(=O)[C@H](F)Br)[nH]n2)CC1	1818913887	SZTHEPOBUJKXJH-CJNGLKHVSA-N	445.337	1.340	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1	1819801085	YLQFDAOJKVODCU-SKDRFNHKSA-N	436.925	1.385	50	20	IDGD	
COc1cc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@@H](C)Br)CC3)nn1C	1821777177	ACMFACAZBKJZPG-RKDXNWHRSA-N	442.339	1.894	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](C)n2cnnn2)n[nH]1	1822853246	YWFZUBUABBGELT-WZRBSPASSA-N	439.318	1.681	50	20	IDGD	
CC(=O)N/C(C)=C/C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](C)Br)CC2	1824477308	BFXNRKIEVZQVDF-HBUNZAKRSA-N	429.340	1.878	50	20	IDGD	
COC(=O)C1(C(=O)N[C@H]2CCc3nc(NC(=O)[C@H](C)Br)sc3C2)CC1	1825647061	MOOVYODIBYPRBK-IUCAKERBSA-N	430.324	1.792	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@](C)(O)C(F)(F)F)CC2	1825993936	FVZZMSSNNVZMNM-FZVNPBSJSA-N	429.848	1.622	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H]2CCC(=O)N2)CC1	1826657454	JVHWTKPPYGRNNX-BMFZPTHFSA-N	428.371	1.916	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](N)Cc2cccnc2)CC1	1827642959	DSEXCOSGRURYCY-AABGKKOBSA-N	436.984	1.825	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)C2=CCCS2)CC1	1828923626	PTUKQVJTZJNWDP-GOSISDBHSA-N	443.573	1.939	50	20	IDGD	
C[C@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@H](F)Br)CC1)n1cnnn1	1830381039	DZEIOTBDJODGGQ-BNOWGMLFSA-N	431.310	1.544	50	20	IDGD	
Cc1cccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)CCBr)C3)C2)n1	1830917227	JWMGSUGZIZYNTL-LJQANCHMSA-N	440.338	1.174	50	20	IDGD	
C=CCOCCCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](Br)CC)C2)C1	1831413323	VHKKIOMAPLXIOG-VQIMIIECSA-N	447.370	1.599	50	20	IDGD	
COc1cccc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)n1	1831872433	WPUGQSMKMMASQS-IBGZPJMESA-N	445.564	1.697	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H]2C[C@@]2(F)Cl)CC1	1831875579	ZHOJRYJQPKNLKR-YRNRMSPPSA-N	430.952	1.904	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)C(F)(F)Cl)CC1	1832016806	DNQJQODDQYUNGD-INIZCTEOSA-N	428.672	1.431	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)c1ccccc1)CCO2	1832231990	LQOFGGHTOSVHEF-QKLQHJQFSA-N	428.888	1.407	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)[C@@H]2CCCS2)CC1	1832435197	YROXQWCAHDWTNB-UXHICEINSA-N	430.379	1.495	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)s1	1833425752	NLIOJYHREYGFQA-SJKOYZFVSA-N	447.351	1.610	50	20	IDGD	
Cc1nc(C(=O)N2CCC(N3CCC(NC(=O)CCBr)CC3)CC2)co1	1834421062	BVZPTCLTXABHCG-UHFFFAOYSA-N	427.343	1.953	50	20	IDGD	
N=C(N)SCCC(=O)NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1	1834707553	GLDXKHZOYVYTHI-UHFFFAOYSA-N	448.431	1.360	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)c3cccc(F)c3)C2)C1	1834823990	PUCVRBWYJVIYCG-GOSISDBHSA-N	429.286	1.681	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3[nH]nc4ncccc34)CC2)CC1	1835022585	QWMVUMDULBDOEM-QGZVFWFLSA-N	448.955	1.397	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](F)Cl)CC2)CC1)c1cc2n(n1)CCCC2	1835571612	NPCDMHVLOFXDHB-GOSISDBHSA-N	425.936	1.939	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836352962	JCEBPJKJBJYUCN-OAQYLSRUSA-N	446.979	1.882	50	20	IDGD	
CC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)CSCC(=O)OC)CC2)CC1	1836394821	GWPCXAXIAYORCM-INIZCTEOSA-N	434.002	1.482	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC1CCN(C2CCN(C(=O)Cn3cccn3)CC2)CC1	1836398863	ZGZDKKMEKNKUAA-IBGZPJMESA-N	430.380	1.691	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(Cl)o3)C2)C1	1837713156	KBVDJQJHPMGYEH-GOSISDBHSA-N	430.961	1.855	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)Cc3nc(C)no3)CC2)CC1	1837951237	KWKLNQMULMCCFG-MRXNPFEDSA-N	428.917	1.173	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3[nH]cnc3-c3cccnc3)CCO2)C1	1838498410	MKOQDADVMCSQRM-KKSFZXQISA-N	447.923	1.559	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3ccc(OC)nn3)CC2)CC1	1838512468	FAVQMARFQGVVNC-MRXNPFEDSA-N	440.928	1.351	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)nn1C(F)F	1838703868	LQJFDQMGDJUYGP-IBGZPJMESA-N	448.898	1.922	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3ccc(C#N)cc3)C2)C1	1839141772	SCGNGPALXISKGJ-SIKLNZKXSA-N	433.936	1.965	50	20	IDGD	
Cc1nc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)cs1	1839151052	HCHOJUMBGHIKKG-DLBZAZTESA-N	436.361	1.758	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)nc1	1839151080	HOHOMHGWAVXEMF-MOPGFXCFSA-N	430.332	1.696	50	20	IDGD	
CCc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)no1	1839153254	DKXCSVJBFCCMGD-MSOLQXFVSA-N	434.320	1.543	50	20	IDGD	
Cc1cc(/C=C/C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)no1	1840033610	LDJWCQSUGLSFEF-UIOCAAJDSA-N	442.310	1.236	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3cc(C)cs3)C2)C1	1840150402	KKBWRAZKFGZDOT-YLJYHZDGSA-N	444.981	1.699	50	20	IDGD	
CN(C)c1ccncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840186114	BHIUHADAHCCXIU-SFHVURJKSA-N	431.320	1.021	50	20	IDGD	
C[C@H](Cc1ccco1)C(=O)N1CCO[C@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1	1840470964	IRWGCWCUJIPRCI-UTKZUKDTSA-N	438.597	1.766	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CC3(OC)CCC3)CCO2)C1	1840617395	AZKAITPSENSDIG-DNVCBOLYSA-N	447.370	1.576	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H]1C(=O)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1	1841348425	QVTAATZJKUPEOU-ZNMIVQPWSA-N	429.945	1.483	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC2(CCCN2C(=O)c2cncc(S(C)(=O)=O)c2)C1	1842189437	FIFCQLMGYFDCMN-MRXNPFEDSA-N	434.345	1.538	50	20	IDGD	
O=C(c1nc2c(Br)cc(F)cn2n1)N1CC2(CCCN2C(=O)[C@@H](F)Cl)C1	1843365819	LWNSLEDGYNSOAP-SNVBAGLBSA-N	448.655	1.982	50	20	IDGD	
CCCc1onc(C)c1C(=O)N1CC2(CCCN2C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C1	1843415949	GXISOXDODUQMJD-BUVRLJJBSA-N	440.504	1.887	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@](C)(C(=O)N2CCCC23CN(C(=O)[C@@H](O)CCl)C3)C1	1843867225	HZLRFWBXSQWJJQ-LIRRHRJNSA-N	429.945	1.437	50	20	IDGD	
Cc1cc(C(=O)N2CCCC23CN(C(=O)c2ccc(B(O)O)cc2)C3)c2cc(O)ccc2n1	1844020799	UDEIOSBXCSUXHD-UHFFFAOYSA-N	445.284	1.059	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1cc3c(s1)CCCC3)C2	1844264477	WRDHNHWSVLHCIP-UHFFFAOYSA-N	439.541	1.756	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@H](C)NC(=O)c2ccc(F)cc2)C1	1845004553	RKZUSIMKIOARKI-XJKSGUPXSA-N	425.888	1.401	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC12CN(C(=O)C1CN(C(=O)OC(C)(C)C)C1)C2	1846177520	UNPBXQZIYOTPOX-LBPRGKRZSA-N	430.343	1.840	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)C(C)(C)CNC(=O)OC(C)(C)C)C2	1846365720	QVGBGNOXQJZQIH-AWEZNQCLSA-N	431.961	1.995	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)/C=C/c1ccc(O)cc1Cl)C2	1846386266	UHUDBJLRVFSHJR-VMPITWQZSA-N	434.924	1.635	50	20	IDGD	
C[C@H](C(=O)N1CCCC12CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)n1cccn1	1846616793	LKLRVAHAAZDZKQ-CABCVRRESA-N	439.944	1.780	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)C2(F)CN(C(=O)OC(C)(C)C)C2)C1	1847131646	AXRBAAZFUCOIMX-CYBMUJFWSA-N	433.908	1.403	50	20	IDGD	
C=CC[C@@H](CC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl)NC(=O)OC(C)(C)C	1847568008	JSNLWEPYPXQDPD-YHUYYLMFSA-N	429.945	1.647	50	20	IDGD	
CC(C)[C@H](NC(=O)c1cccs1)C(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	10159536	ALNNAVMZHFSHBR-INIZCTEOSA-N	427.486	1.855	50	20	IDGD	
O=C(CC[C@H]1Cc2ccccc2NC1=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	23684126	LTNHHAGFKTWEIX-FQEVSTJZSA-N	449.555	1.937	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c([N+](=O)[O-])cc1OC(F)F	25956420	RUFGSIBGVYVQJH-UHFFFAOYSA-N	449.330	1.255	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(/C#N)C(=O)N2CCN(CC(=O)NC3CC3)CC2)c1C	105283699	AMHUTLUZBJKTHO-BRLDDBHUSA-N	427.549	1.642	50	20	IDGD	
Cc1cc(C)cc(C(=O)N2CCC[C@H](C(=O)NNC(=O)c3n[nH]c(=O)c4ccccc34)C2)c1	107908233	WKQXAENLMCYUOI-INIZCTEOSA-N	447.495	1.853	50	20	IDGD	
CC(C)C[C@H](/N=C1/NS(=O)(=O)c2ccccc21)C(=O)NNC(=S)NC(C)(C)C	726138978	CODNFUSWMJKOIE-ZDUSSCGKSA-N	425.580	1.434	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(N2CCCC2)c(C(=O)NNC(=O)c2cccn2C)c1	726538166	FOGNFFJFRVJNPO-UHFFFAOYSA-N	447.561	1.731	50	20	IDGD	
O=C(CN1CCN(C(=O)c2c(F)cccc2F)CC1)NNC(=O)c1ccccc1Cl	727831508	GHEBNIDXOBBBBX-UHFFFAOYSA-N	436.846	1.837	50	20	IDGD	
O=C(CN1C(=O)COc2cc(Br)ccc21)NNc1nc(-c2cccnc2)no1	728076922	MHVCVTHDHUEOJT-UHFFFAOYSA-N	445.233	1.763	50	20	IDGD	
O=C(NNc1nc(-c2ccccc2)no1)c1cccc(CN2CCS(=O)(=O)CC2)c1	728079832	HLDCEHZODSSTLO-UHFFFAOYSA-N	427.486	1.724	50	20	IDGD	
CC(=O)c1cccc(S(=O)(=O)NCCC(=O)NNc2nc(-c3ccccc3)no2)c1	728080898	PUDHABFIDKWDSW-UHFFFAOYSA-N	429.458	1.751	50	20	IDGD	
COc1ccc(N2C[C@@H](C(=O)NNc3ccc(S(=O)(=O)NC4CC4)cc3)CC2=O)cc1	728210139	UWQAJDFNRXEWHC-AWEZNQCLSA-N	444.513	1.632	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)NCCN2CCOCC2(C)C)c2ccccc2c1=O	728400519	OCTGAPLVDACWTH-UHFFFAOYSA-N	430.509	1.032	50	20	IDGD	
CC(C)C(=O)Nc1ccc(CNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1	728939019	WFAJSRPIJAZLCF-UHFFFAOYSA-N	439.520	1.818	50	20	IDGD	
O=C(NNS(=O)(=O)c1csc(-c2ccc(Cl)cc2)n1)[C@H]1CCS(=O)(=O)C1	730511910	CHJJDFJGIQBCGR-JTQLQIEISA-N	435.936	1.208	50	20	IDGD	
CCOCC(=O)NN=C1C(=O)N(CCN(CC)CC)c2ccc(Br)cc21	731152520	KILNYKHQJQJELG-UHFFFAOYSA-N	425.327	1.994	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NNC(=O)C(C)(C)c2ccccc2)cc(OC)c1OC	731219062	RJJMKHITSBDSPO-UHFFFAOYSA-N	430.461	1.665	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)[C@@H]2CCCN(C(=O)c3ccccc3)C2)n1	731273522	GDTQPKLRPTVAIK-MRXNPFEDSA-N	444.513	1.237	50	20	IDGD	
COc1ccccc1C(=O)NNS(=O)(=O)c1cccc(C(=O)NCC(F)(F)F)c1	731494527	ZDQWUQXAFNVVGA-UHFFFAOYSA-N	431.392	1.611	50	20	IDGD	
Cc1c(C(=O)NNC(=O)CCN2C[C@H](C)O[C@@H](C)C2)nnn1-c1ccc(OC(C)C)cc1	732259263	BNUZBBTXGZEQBC-HOTGVXAUSA-N	444.536	1.623	50	20	IDGD	
COc1cccc(/C=C(\C(=O)NNc2nc3ccccc3c(=O)n2C)n2nnnc2C)c1	733264129	XRIDVBOEBGEEAR-LDADJPATSA-N	432.444	1.378	50	20	IDGD	
Cc1ccc(-n2c(NNC(=O)CN3CCC(=O)NC3=O)nc3ccccc3c2=O)c(C)c1	733365478	LPJIEDPUPOIDLK-UHFFFAOYSA-N	434.456	1.388	50	20	IDGD	
N#Cc1ccc(N2C(=O)N[C@H](CCC(=O)NNC(=O)Cc3ccc(Cl)cc3)C2=O)cc1	733777124	NYQZEMQHKCEMEU-QGZVFWFLSA-N	439.859	1.807	50	20	IDGD	
Cn1nc(Br)c2c(=O)n(CC(=O)NNc3nccc4sccc34)cnc21	734250548	XPDVULJYEBDGPS-UHFFFAOYSA-N	434.279	1.646	50	20	IDGD	
O=C(CCOc1ccc(Cl)cc1[N+](=O)[O-])NNC(=O)c1ccc(-n2cnnn2)cc1	735030281	LDDJXBBWJHPYKF-UHFFFAOYSA-N	431.796	1.454	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)[C@H]2CCCN2Cc2ccccn2)c2ccccc2c1=O	741139510	XHXKTHPRVAEPBP-LJQANCHMSA-N	434.500	1.627	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCc2c[nH]nc2C1)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	742511161	NXOFAIYNVDKZLB-SFHVURJKSA-N	442.483	1.678	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNS(=O)(=O)c2cnn(-c3ccccc3OC)c2)c1	743249426	BKEFHSUHFXMIQC-UHFFFAOYSA-N	432.458	1.521	50	20	IDGD	
CC(C)[C@@H](NC1CCOCC1)C(=O)NNC(=O)COc1ccc(Br)cc1	743282767	RHENNNXUFLLTKI-QGZVFWFLSA-N	428.327	1.769	50	20	IDGD	
CN(C)CC(=O)NNC(=O)[C@H]1CCCN(C(=O)c2ccc(Br)c(F)c2)C1	743333603	UQJSZNBBWKTBRB-LBPRGKRZSA-N	429.290	1.149	50	20	IDGD	
O=C(CCn1c(=O)nc(O)c2ccccc21)NNC(=O)Nc1ccc(OC(F)F)cc1	743831600	BJBSJAIHOZGKAD-UHFFFAOYSA-N	433.371	1.947	50	20	IDGD	
Cc1nn(C(F)F)c(C)c1CC(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	744619899	CGLZFUGLXSVJLW-UHFFFAOYSA-N	443.476	1.602	50	20	IDGD	
CCC(CC)N1C[C@H](C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)CC1=O	744620705	KNUNKEUUDLXGOA-OAHLLOKOSA-N	438.550	1.188	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)[C@@H](c2ccccc2F)N2CCOCC2)cc1	745494937	DANSHKXQMUEGKQ-HXUWFJFHSA-N	440.431	1.075	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cc(S(=O)(=O)N3CCCC3)ccc2O)cc1OC	745991058	OKCITACQJRSFBR-UHFFFAOYSA-N	449.485	1.269	50	20	IDGD	
CCOc1ccc(N2C(=O)c3ccc(C(=O)NNC(=O)N4CCOCC4)cc3C2=O)cc1	745991928	LUHRHAZFZVSQDG-UHFFFAOYSA-N	438.440	1.573	50	20	IDGD	
NS(=O)(=O)c1cccc(N2C[C@@H](C(=O)NNc3ccccc3C(F)(F)F)CC2=O)c1	746113677	VOVMTDHJEYMLKJ-NSHDSACASA-N	442.419	1.849	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)c2ccc(F)c(S(=O)(=O)Cc3ncon3)c2)c1	746217641	MLSHRUWOYCOYHY-UHFFFAOYSA-N	429.389	1.129	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)NCc1cccc(NC(=O)[C@H]2CCCO2)c1	746755619	GXJDOGQADKYQTG-GOSISDBHSA-N	436.472	1.525	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN1Cc1ccc(F)cc1)C1CCN(c2ncccn2)CC1	747379342	DVRVCHFJATXCGM-IBGZPJMESA-N	426.496	1.644	50	20	IDGD	
CC(=O)Nc1ccc(NS(C)(=O)=O)c(C(=O)NNc2ccc(S(C)(=O)=O)cc2)c1	748138058	GNBIMZOENRVHCW-UHFFFAOYSA-N	440.503	1.177	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)NCc1cc(Br)ccc1OC(F)F	748628400	VLYQRCWKIYMPRM-VIFPVBQESA-N	440.241	1.932	50	20	IDGD	
N#Cc1ccc(NNC(=O)CCN2CCN(C(=O)[C@H]3CCCO3)CC2)cc1C(F)(F)F	748628572	DSCKLFCEICFCKE-QGZVFWFLSA-N	439.438	1.733	50	20	IDGD	
CN(CC(=O)NNC(=O)c1cc2ccccc2o1)S(=O)(=O)c1cccc([N+](=O)[O-])c1	749477359	JIOOOVOOZCYLKK-UHFFFAOYSA-N	432.414	1.423	50	20	IDGD	
CC[C@@H](NC(=O)NNC(=O)COc1ccccc1[N+](=O)[O-])c1nnc2n1CCCCC2	749583711	ZMPZWNHJBSPXMH-CYBMUJFWSA-N	431.453	1.773	50	20	IDGD	
COc1ccccc1N1C[C@@H](C(=O)NNc2nc(Br)cn3ccnc23)CC1=O	750246974	KGGPZEPPKCVPJB-NSHDSACASA-N	445.277	1.997	50	20	IDGD	
CN1CC[C@@H](C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c2ccccc21	750715162	QCAZWPJRMFJICO-LJQANCHMSA-N	442.541	1.856	50	20	IDGD	
CC[C@H](C)c1ccccc1N1C[C@@H](C(=O)NNC(=O)CNC(=O)c2ccco2)CC1=O	751206799	NONXJXNKMZSDNQ-GJZGRUSLSA-N	426.473	1.723	50	20	IDGD	
C[C@@H](CC(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1)c1ccc(F)cc1F	751859329	OZXXFRMSUYVQFV-KPZWWZAWSA-N	434.395	1.989	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)[C@H]2CC(=O)N(CCOc3ccccc3Cl)C2)c1O	752286982	RYNVCMFTXVXJNG-ZDUSSCGKSA-N	447.875	1.743	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN[C@@H](C)c2nc(Cc3ccccc3)no2)cc1OC	755101578	KLQIWXREVAXRNN-AWEZNQCLSA-N	439.472	1.789	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCC(=O)NNc1nc(-c2cccnc2)no1	755308363	OPUGNBXTIJJNPE-ZDUSSCGKSA-N	431.453	1.090	50	20	IDGD	
CN(Cc1ccccc1)S(=O)(=O)c1ccc(NC(=O)NNC(=O)c2cnccn2)cc1	755447368	WBTZLDUMZHQMLP-UHFFFAOYSA-N	440.485	1.764	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)c2ccc(Cl)cc2O)n([C@@H]2CCS(=O)(=O)C2)n1	755537426	VDZYMJIVNXCWFY-LLVKDONJSA-N	427.870	1.377	50	20	IDGD	
CN(C)C(=O)COc1cccc(NC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])c1	755960253	INATWQYURCESBZ-UHFFFAOYSA-N	431.405	1.294	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)Nc2cccc(N3C(=O)CNC3=O)c2)cc1	755995007	OGOVGXXCNCFIIU-ZDUSSCGKSA-N	439.428	1.566	50	20	IDGD	
CCOC(=O)C1CCN(C(=O)c2ccc(NC(=O)NNC(=O)c3cnn(C)c3)cc2)CC1	756682196	NOYARJIOKQVNEY-UHFFFAOYSA-N	442.476	1.302	50	20	IDGD	
CCCNS(=O)(=O)c1ccc(NC(=O)NNC(=O)COc2ccc(C#N)cc2)cc1	756775437	HMTSSUUQDRYRAY-UHFFFAOYSA-N	431.474	1.478	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)Cc3c[nH]c4ncccc34)cc2)CC1	757381311	FIWQEMNDIKMEAJ-UHFFFAOYSA-N	428.518	1.185	50	20	IDGD	
O=C(CCCn1cnc2ccccc21)N1CCN(S(=O)(=O)CBr)CC1	758534903	LJXGJASOQHFIOO-UHFFFAOYSA-N	429.340	1.643	50	20	IDGD	
O=C(NNC(=O)C(=O)Nc1ccccn1)N[C@H]1CCCN(Cc2ccc(F)cc2Cl)C1	758756499	VVSZKHBZBMCSEQ-HNNXBMFYSA-N	448.886	1.808	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCC[C@H]([C@@H](C)NC(=O)OC(C)(C)C)C2)n1	758780770	UITVVFWLVMIBAW-CABCVRRESA-N	439.582	1.767	50	20	IDGD	
CN1C(=O)C[C@@H](C(=O)NNC(=O)COc2ccccc2O)[C@@H]1c1ccc(Cl)c(F)c1	759009908	CZLUPKPOXWVJOU-BLVKFPJESA-N	435.839	1.931	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)[C@H]1CC(=O)N(c2c(F)cccc2F)C1	760439006	DGLYKSXYCONIDJ-NSHDSACASA-N	426.420	1.380	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)Cn1cnc(-c2ccccc2)n1	761197710	KZIGKFCRMJLMCD-UHFFFAOYSA-N	430.262	1.934	50	20	IDGD	
CCOC(=O)c1cnn(-c2cccc(NC(=O)C(=O)NNC(=O)CC)c2)c1C(F)(F)F	763441150	HILROUJSXVFZPU-UHFFFAOYSA-N	441.366	1.564	50	20	IDGD	
Cc1cc(C)n(-c2ccc(NC(=O)C(=O)NNC(=O)c3ccc4ccccc4n3)cn2)n1	763450739	TWALPTOLHWRSCQ-UHFFFAOYSA-N	429.440	1.832	50	20	IDGD	
CCc1cccc2c1N(C(=O)C(=O)NNC(=O)c1cc(OC)c(OC)c(OC)c1)CC2	763540664	YLDGFQPWBCQXBX-UHFFFAOYSA-N	427.457	1.625	50	20	IDGD	
O=C(COc1ccccc1Br)NNC(=O)CN1C(=O)COc2ccccc21	763543462	JRTAYYVYBDWWOH-UHFFFAOYSA-N	434.246	1.401	50	20	IDGD	
CCCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)cc1Cl	763549229	UYRSEKFGCLIVJO-UHFFFAOYSA-N	446.847	1.608	50	20	IDGD	
CCOC(=O)N(C)c1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1	763569731	ATJNKRWXVPSVJL-KRWDZBQOSA-N	442.428	1.205	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)Nc1ccnn1-c1ccc(Cl)cc1	763573857	VITKXZIRSMHVTB-INIZCTEOSA-N	441.831	1.452	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cccc(C(=O)NCc3ccccn3)c2)c(C)o1	763576140	GNZCFTQXPXNIKG-UHFFFAOYSA-N	435.440	1.621	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)NCC(F)(F)F)cc2)c(C)o1	763586544	NUUADFFYNAKPIT-UHFFFAOYSA-N	426.351	1.588	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(N3CCCCC3)c2)cc1	763658836	DPZIQZHUONVGGX-UHFFFAOYSA-N	426.473	1.850	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)C(=O)Nc1cccn(Cc2ccccc2)c1=O	763683217	XTNXDVHUSVDGEE-UHFFFAOYSA-N	438.415	1.201	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(Cl)c(OC(F)F)c1	763812572	GYNFNGWRKVUEDM-UHFFFAOYSA-N	438.774	1.978	50	20	IDGD	
CCn1cnnc1-c1ccccc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccccc1F	763866316	VLWVBCMLXBDXDK-ZDUSSCGKSA-N	440.435	1.658	50	20	IDGD	
CNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)CCSc2ccc(F)cc2)c1C	763896691	RSUUNJSACPWXBS-UHFFFAOYSA-N	432.477	1.762	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)C(=O)Nc2cnn(-c3ncccc3C#N)c2)cc1	763898216	NOFLAJKQQXKWOD-UHFFFAOYSA-N	435.469	1.326	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3ccc(CS(C)(=O)=O)cc3)cc2C1	763940363	GWQQBRBXSVYUGP-GFCCVEGCSA-N	449.554	1.817	50	20	IDGD	
O=C(NNC(=O)c1cc(Cl)ccc1O)C(=O)Nc1ccccc1C(=O)N1CCCC1	763974163	MAYBFFOGOQHKLZ-UHFFFAOYSA-N	430.848	1.681	50	20	IDGD	
Cc1nc(C)n(-c2ccccc2NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)on2)n1	764004438	WBPYWDQVMKWXMO-UHFFFAOYSA-N	445.439	1.939	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cc(C(=O)N3CCCCC3)ccc2Cl)n[nH]1	764107087	YGSQMSNTOZENSG-UHFFFAOYSA-N	432.868	1.397	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2ccc(C(=O)NC(C)C)cc2C)cc1	764125148	SIFBVAHUWFJUCQ-UHFFFAOYSA-N	440.500	1.861	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccnn2Cc2ccc(C)s2)c1O	764131165	NTMOSAQHDVHFKX-UHFFFAOYSA-N	429.458	1.415	50	20	IDGD	
COC(=O)c1ccc(-n2cc(C)cn2)c(NC(=O)C(=O)NNC(=O)CC2CCCC2)c1	764184240	PITCZMWPGJRKPR-UHFFFAOYSA-N	427.461	1.634	50	20	IDGD	
CCCS(=O)(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)CCc2ccccc2)c1	764185349	LZMMKXVCOYEYQZ-UHFFFAOYSA-N	432.502	1.557	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3nc(N4CCOCC4)sc3c2)o1	764370607	GCRXYOVPOBTWFA-UHFFFAOYSA-N	429.458	1.434	50	20	IDGD	
COC(=O)c1cc(Cl)cc(NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)c1	764383084	VSYWWTGBQMTFCJ-UHFFFAOYSA-N	447.860	1.978	50	20	IDGD	
COC(=O)c1ccc(N2CCCC2)c(NC(=O)C(=O)NNC(=O)c2ncccc2C)c1	764385568	BZNQVSCXWYXJGA-UHFFFAOYSA-N	425.445	1.177	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)C(=O)Nc1ccc(C(=O)NCc2ccccc2F)cc1	764388201	DDMHKTIVCJZJEL-UHFFFAOYSA-N	449.442	1.859	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCCCN2CCCO[C@H](C)C2)cc1Br	764587270	PLZWPXIZURROTJ-CYBMUJFWSA-N	443.342	1.903	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNS(=O)(=O)CCc3ccccc3)CC2)cc1	765126139	IUZZTKPKNIPDFE-UHFFFAOYSA-N	430.574	1.306	50	20	IDGD	
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1	765243494	KYZBQBCETZPWTP-XLIONFOSSA-N	437.548	1.544	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)c3ccc4c(c3)[nH]c(=O)c(=O)n4CC)n[nH]2)cc1	765570578	BCDZNHNKJIIBEG-UHFFFAOYSA-N	446.467	1.737	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cc(C)[nH]n2)cc1	765588924	TYWIPSBJTJUTIC-UHFFFAOYSA-N	429.458	1.602	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)CCn2c(=O)nc(O)c3ccccc32)n[nH]1	765595654	OUFATGUPSKOMOC-UHFFFAOYSA-N	448.439	1.352	50	20	IDGD	
N#Cc1ccc(C2=CCN(C(=O)NNC(=O)c3csc(N4CCOCC4)n3)CC2)cc1	767187744	VWKXCPOBDANDIS-UHFFFAOYSA-N	438.513	1.995	50	20	IDGD	
CC(C)(O)C(=O)NNC(=O)[C@@H]1CCCN(C(=O)c2ccc(Br)c(F)c2)C1	768245350	RPPBPOVEZDWXOH-LLVKDONJSA-N	430.274	1.359	50	20	IDGD	
COCCCNC(=S)N(C)NC(=O)Cn1cnc2sc(-c3ccccc3)cc2c1=O	768732206	BDZQLXPVMRYFQC-UHFFFAOYSA-N	445.570	1.999	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)CN1C(=O)N[C@]2(CCCC(C)(C)C2)C1=O	768927857	LQBCSUJIAWHYAB-NRFANRHFSA-N	431.493	1.145	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)c3cccc([C@]4(C)NC(=O)NC4=O)c3)n[nH]2)cc1	768958073	WBVCCPTUCLGBPY-QFIPXVFZSA-N	432.440	1.515	50	20	IDGD	
CC(C)(C)OC(=O)C1CCC(NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)CC1	769729732	ZWAGVIXSFDNDGT-UHFFFAOYSA-N	439.534	1.935	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)NC3CCN(c4nc5ccccc5s4)CC3)nc21	770366443	RVHNWGBFMWBPRH-UHFFFAOYSA-N	439.505	1.974	50	20	IDGD	
Cc1cc(N2CC[C@@H](NC(=O)NNC(=O)[C@@H](C)Oc3cccc(Cl)c3)C2=O)n(C)n1	770648362	GDKMTQDPCWSKJQ-IUODEOHRSA-N	434.884	1.285	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)C3CCN(c4ccc(C(F)(F)F)cn4)CC3)nc21	770971395	IUUUNWXCLKOQDK-UHFFFAOYSA-N	436.398	1.842	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)CCNS(=O)(=O)c1cccc(Cl)c1	771856408	TXXIRHCZCSXSMP-GFCCVEGCSA-N	433.914	1.134	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)[C@H](C)NS(=O)(=O)c1ccc(Cl)cc1	771931589	JBFVTQYPNDKFQN-RYUDHWBXSA-N	433.914	1.132	50	20	IDGD	
Cc1cc(NC(=O)CSCC(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)no1	772952817	GCVNWGYFJMPROM-NSHDSACASA-N	426.882	1.923	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)CN1C(=O)N[C@@]2(CCCC[C@@H]2C)C1=O	772967060	LXJFKHPDTQPXQO-KQHSUYLTSA-N	436.896	1.755	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NNC(=O)c2ccccc2N2CCOCC2)C1	773410969	GXYQLPHOCXOHMV-MRXNPFEDSA-N	432.521	1.931	50	20	IDGD	
CN1CCC(=O)Nc2cc(C(=O)NNC(=O)[C@H]3CCCN(C(=O)OC(C)(C)C)C3)ccc21	773421672	SOGOBKPSNSPRMW-HNNXBMFYSA-N	445.520	1.873	50	20	IDGD	
O=C(NC[C@H]1CCCO1)Nc1ccc(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2)cc1	773645168	WWNAPTHFLWAELD-QGZVFWFLSA-N	442.432	1.977	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(C(=O)NNC(=O)c2ccc(F)cc2Br)n(C)c1	778631292	VCLXBDJENMRCHQ-UHFFFAOYSA-N	447.286	1.252	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)N[C@H]1CCCC[C@@H]1CNC(=O)OC(C)(C)C	778679566	BDRGHWIKYTXEDG-KGLIPLIRSA-N	443.545	1.925	50	20	IDGD	
COc1ccc(NNC(=O)c2ccc3c(c2)S(=O)(=O)N(C[C@H]2CCCO2)C3=O)nc1	781525387	LJYMFQMWRSVZKC-CQSZACIVSA-N	432.458	1.171	50	20	IDGD	
CC(C)CCNS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ncncc2Cl)cc1	782159875	XXMMHRUFNAVZLD-UHFFFAOYSA-N	440.913	1.536	50	20	IDGD	
CS(=O)(=O)CCOc1ccc(Cl)cc1NC(=O)C(=O)NNc1ccccc1F	782706965	GXBLEIBENOHWHK-UHFFFAOYSA-N	429.857	1.984	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C(=O)Nc2cccc(NC(=O)C3CC3)c2)nc2ccccc21	782893871	NPETWXCFTWANAX-UHFFFAOYSA-N	434.456	1.250	50	20	IDGD	
NC(=O)CCOc1ccccc1NC(=O)C(=O)NNc1ccc(Br)cc1F	783086686	RORUPIYRBQILPV-UHFFFAOYSA-N	439.241	1.924	50	20	IDGD	
CC(C)(C)OC(=O)N1CCc2ncc(NC(=O)C(=O)NNc3cncc(Cl)n3)cc2C1	783266747	ZUOYKAKIBYJALG-UHFFFAOYSA-N	447.883	1.900	50	20	IDGD	
Cc1ccc(NNC(=O)C(=O)Nc2c(C)cnn2[C@H]2CCN(Cc3ccccc3)C2)nn1	783952699	OPXCBOZKYQNZAR-SFHVURJKSA-N	434.504	1.819	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1cccc(Cl)c1-n1cccn1	784003430	FFJUTPODZWHKQH-UHFFFAOYSA-N	446.876	1.103	50	20	IDGD	
O=C(CCSc1ccc(F)cc1)NNC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CCOCC1	784297220	VJTLXBBDOKDNJF-MSOLQXFVSA-N	435.521	1.897	50	20	IDGD	
COc1cc(OC)c(OC)cc1NC(=O)C(=O)NNc1ccc(Br)cn1	784340385	XZIFYHLEULNDBV-UHFFFAOYSA-N	425.239	1.952	50	20	IDGD	
O=C(NNc1ccc(OC(F)(F)F)cc1)C(=O)Nc1ccc2c(c1)S(=O)(=O)CC2	784801725	WMOOZMGRUCMGKQ-UHFFFAOYSA-N	429.376	1.997	50	20	IDGD	
CC(C)(C)c1ccc(NNC(=O)C(=O)Nc2cccn(CCS(C)(=O)=O)c2=O)cc1	784804348	IJVCQKLTOPCFAR-UHFFFAOYSA-N	434.518	1.272	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)Cc2cccc(N3CCCC3=O)c2)cc1	785127048	AHOXCDLNIFRMOR-UHFFFAOYSA-N	430.486	1.612	50	20	IDGD	
COc1cc(F)cc(NNC(=O)C(=O)Nc2cc(C(=O)N3CCOCC3)ccc2OC)c1	785242266	VAYJIMFEFFCGLT-UHFFFAOYSA-N	446.435	1.397	50	20	IDGD	
C[C@@H]1CCC[C@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)CC1	785945414	BRXBZJARONKOEQ-WBVHZDCISA-N	438.550	1.620	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1N1CCNC1=O	786344897	MUAINPJMFSVONY-UHFFFAOYSA-N	431.474	1.395	50	20	IDGD	
CCc1[nH]nc(C(=O)OCC(=O)NNC(=O)Cc2nc(C)cs2)c1Br	789145032	QFXMFQUIJCUTEI-UHFFFAOYSA-N	430.284	1.046	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)cc1F	789810033	KKNNVVUVWRAFBU-LPHOPBHVSA-N	445.447	1.510	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N1CC(=O)N(CC2CC2)C1	789829397	LFGTYGPUDAELFK-LLVKDONJSA-N	425.283	1.469	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)N3CCC[C@H](N4CCCS4(=O)=O)C3)cc2C1	789829461	OYOGLOIEADNWLV-ZFWWWQNUSA-N	440.591	1.727	50	20	IDGD	
COC(=O)c1ccc(S(=O)(=O)NNC(=O)c2cccc(C#N)c2)cc1C(F)(F)F	790052744	IRWJGENKFYOYOI-UHFFFAOYSA-N	427.360	1.987	50	20	IDGD	
COc1cccc(NNC(=O)C(=O)Nc2cc(F)ccc2N2CCCN(C(C)=O)CC2)n1	790943984	BJNFGMLMOQNMHZ-UHFFFAOYSA-N	444.467	1.370	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)[C@H](C#N)Cc2ccc(C#N)cc2)c2ccccc2c1=O	791457968	JDSLAVFBZACXRG-KRWDZBQOSA-N	428.452	1.822	50	20	IDGD	
O=C(CCc1cnccn1)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	792930012	UJXZVDRYEPUERI-UHFFFAOYSA-N	428.456	1.572	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2O1)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1	793026272	PNMKNRWFCXYHCR-AWEZNQCLSA-N	449.217	1.447	50	20	IDGD	
CC(=O)N1CCC[C@@H](CNC(=O)NNC(=O)COc2ccc(Br)cc2)C1	793202651	NRWLHUXTQVCQRD-ZDUSSCGKSA-N	427.299	1.417	50	20	IDGD	
O=C(CCn1cnccc1=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1	794260380	CUJQVEQQESHZKU-OAQYLSRUSA-N	431.496	1.408	50	20	IDGD	
CN(CCC(=O)NNC(=O)c1nn(-c2ccccc2)cc1O)C(=O)OCc1ccccc1	794897095	UBCJTSLXBZWJKZ-UHFFFAOYSA-N	437.456	1.998	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2ccc(F)cc2-c2cnn(C)c2)cc1	797002237	OTTXAUHUVVBMOD-UHFFFAOYSA-N	439.447	1.954	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)C(=O)Nc1ccc(F)c(N2CCOC2=O)c1	797004265	IGBOAGPOJNPEDU-UHFFFAOYSA-N	439.403	1.523	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNC(=O)C(=O)N1CCCc2ccc(F)cc21	797369366	TYXJPZQSCJUVKQ-UHFFFAOYSA-N	428.420	1.179	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=O)N=c2cc[nH]cc2)c1	802022711	FXJOMZHUVKILGS-UHFFFAOYSA-N	425.898	1.700	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2ncccc2OCC(F)(F)F)cc1	802065519	DDOWXLWRAFRQHI-UHFFFAOYSA-N	432.380	1.893	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)CN2C(=O)[C@@H]3[C@@H](C2=O)[C@H]2C=C[C@H]3C2)c(OC)cc1Cl	802086534	XHGSZJDTSMWJLP-QEWLZKHVSA-N	448.863	1.317	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1N1CCOCC1)Nc1ccc2c(c1)OCO2	802099448	RTMZZFCTGIAOJX-UHFFFAOYSA-N	429.389	1.627	50	20	IDGD	
CC(C)[C@@H](NS(=O)(=O)c1ccc2c(c1)OCCCO2)C(=O)NNc1ncccc1F	804216473	GAIGTRZWQMFFFS-QGZVFWFLSA-N	438.481	1.828	50	20	IDGD	
O=C(NC[C@@H](N1CCOCC1)C(F)(F)F)NNC(=O)c1cccc(Br)c1	805160451	YQUMSGJESJSQRC-GFCCVEGCSA-N	439.232	1.656	50	20	IDGD	
COc1ccc(CS(C)(=O)=O)cc1NC(=O)NNC(=O)[C@H](C)Oc1ccccc1F	806638622	FEBGAEUUDNTMHF-LBPRGKRZSA-N	439.465	1.999	50	20	IDGD	
O=C(NCCCn1cnc2ccccc21)NNC(=O)c1csc(N2CCOCC2)n1	807015528	DBZHOCGVGYPYKE-UHFFFAOYSA-N	429.506	1.364	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)c2cc([N+](=O)[O-])c(F)cc2N)C1	808011629	ZMQBBDHMSZZAOF-JTQLQIEISA-N	425.417	1.724	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](C(=O)NNC(=O)c1nnc(O)c2ccccc12)C(F)(F)F	809933226	WLOJXQDGYAPSDV-LLVKDONJSA-N	429.355	1.552	50	20	IDGD	
O=C(CNS(=O)(=O)c1cccnc1)NNC(=O)COc1ccccc1-c1ccccc1	809933471	ICHYLPGEUGPBCE-UHFFFAOYSA-N	440.481	1.253	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)N[C@H]1CCN(c2ccccc2F)C1	813856314	ZTCQWSUVKINIOF-INIZCTEOSA-N	427.484	1.441	50	20	IDGD	
CC1(C)C(=O)Nc2cc(C(=O)NNC(=O)c3ccc(Cl)c(S(N)(=O)=O)c3)ccc21	814735899	GTKAOSADFINUAN-UHFFFAOYSA-N	436.877	1.292	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCc2nncn2C1)C(=O)Nc1cccc(Br)c1Cl	815692012	HOOVXGADPMWCHX-MRVPVSSYSA-N	441.673	1.043	50	20	IDGD	
CCOc1cc(N2CCN(C)CC2)ccc1NC(=O)C(=O)NNc1cccc(Cl)n1	815728518	HAJWYQQWBHTWIC-UHFFFAOYSA-N	432.912	1.967	50	20	IDGD	
CC(C)CNS(=O)(=O)c1ccc(Br)c(C(=O)NNC(=O)CC2CC2)c1	819140999	UQOKQGNRNPGARN-UHFFFAOYSA-N	432.340	1.945	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)CCNC(=O)c1ccc(Br)cc1	825615342	SJLOMSDLYFFVAB-UHFFFAOYSA-N	449.305	1.837	50	20	IDGD	
CCOc1ccccc1N1C[C@@H](C(=O)NNC(=O)CNc2ccccc2OC)CC1=O	825615460	XVVLVRYSSPPQCA-HNNXBMFYSA-N	426.473	1.706	50	20	IDGD	
O=C(/C=C\c1ccccc1)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	863949951	BEAWLGMPTWNLFW-WQLSENKSSA-N	443.525	1.501	50	20	IDGD	
O=C(c1cc(S(=O)(=O)N2CCCCC2)ccc1N1CCCC1)N1CC[C@H](B(O)O)C1	864234671	ZJSVLYPQTLDGIE-INIZCTEOSA-N	435.355	1.150	50	20	IDGD	
CN1CC[C@H](C(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)CC1=O	907727877	VRIMUQIZZRJBSL-SFHVURJKSA-N	433.472	1.018	50	20	IDGD	
O=C(CNS(=O)(=O)c1c(Cl)cccc1Cl)NNC(=O)c1ccc([N+](=O)[O-])cc1	912764511	ZYOIIERRYFRWHM-UHFFFAOYSA-N	447.256	1.641	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)c2cc(S(=O)(=O)N(C)C)ccc2F)cc1OC	913068071	JHSREPCRQHUNII-UHFFFAOYSA-N	439.465	1.558	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)NC2CC2)cc1)NNC(=O)c1cccc([N+](=O)[O-])c1	913465550	MYYQSKDMTGIRNM-UHFFFAOYSA-N	432.458	1.429	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCc1ccc(-n2ccnc2)nc1	914535270	XUBBGTYJSWBVJH-UHFFFAOYSA-N	442.505	1.013	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)Cc1ccc(-n2cnnn2)cc1	914838386	BPTWDYXNVIRFST-UHFFFAOYSA-N	431.250	1.194	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CCS(=O)(=O)c2ccc3c(c2)CCC3)cc1OC	915273717	DGOUCXHTZRNZTD-UHFFFAOYSA-N	432.498	1.818	50	20	IDGD	
CC(=NNC(=O)COc1ccccc1C#N)c1ccc(S(=O)(=O)NCCC(=O)O)cc1	916324008	OQWVLUUYIIACDH-UHFFFAOYSA-N	444.469	1.230	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)NC1CCN(C(=O)c2ccccc2F)CC1	916379731	MCUKBVDZKDKREE-UHFFFAOYSA-N	432.427	1.979	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)NC[C@H](c1ccccc1)N1CCOCC1	916509032	JDFPXUBYWBVCLA-GOSISDBHSA-N	428.489	1.478	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)NC[C@@H](c1ccccc1)N1CCOCC1	916509408	NYWQWJQLQXTCDS-IBGZPJMESA-N	442.516	1.868	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)N1CCc2sccc2C1	916620234	UNTITUZJIXWARS-CYBMUJFWSA-N	440.529	1.386	50	20	IDGD	
O=C(NCc1cc(Br)cs1)NNC(=O)c1csc(N2CCOCC2)n1	916626652	JNLUANFCUDJEDM-UHFFFAOYSA-N	446.352	1.948	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CNS(=O)(=O)c2c(C)c(C)cc(C)c2C)cc1	916830809	YLDJYRQTBWBUNQ-UHFFFAOYSA-N	446.529	1.293	50	20	IDGD	
CC(C)S(=O)(=O)CC(=O)NNC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1	917684148	HVYWUGQJDILUEU-UHFFFAOYSA-N	427.486	1.519	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNS(=O)(=O)c1ccc(CCNC(C)=O)cc1	917731900	PMRNIOILQVQGCO-UHFFFAOYSA-N	425.894	1.651	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NCc2cccc(Cn3cccn3)c2)c2ccccc2c1=O	918132475	UYFDEQJFAGCFIT-UHFFFAOYSA-N	431.456	1.323	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)NCCCC(=O)N(C)C)c2ccccc2c1=O	919923932	QXMNEVRLBINSFX-UHFFFAOYSA-N	430.509	1.399	50	20	IDGD	
CC(C)(CNC(=O)/C(C#N)=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(N)=O	920852261	SXYHRHNLAJVOOC-ZROIWOOFSA-N	442.907	1.614	50	20	IDGD	
Cc1cc(COc2ccc(C(=O)NNC(=O)C(=O)NC3CC3)cc2Br)no1	921304364	OIVRFISIABOTIW-UHFFFAOYSA-N	437.250	1.364	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2ccccc2Cl)cc1	1115855263	GBCYOAMQEOYTCR-UHFFFAOYSA-N	440.909	1.409	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@H]2CCCCN2Cc2ccncc2)c2ccccc2c1=O	1116024314	QCQDFSHGLKEAKL-LJQANCHMSA-N	434.500	1.627	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@@H]2CCCN2C(=O)Nc2ccc3c(c2)OCCO3)cc1	1116179151	FBELIJFLUPXLCV-KRWDZBQOSA-N	440.456	1.924	50	20	IDGD	
Nc1cnnc(NNC(=O)CNS(=O)(=O)c2ccc(Cl)c(Cl)c2)c1Cl	1324187728	WFVKNVDJRMPJPV-UHFFFAOYSA-N	425.685	1.441	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@]2(C1)CN(C(=O)c1ccc3c(c1)NC(=O)CC3)CCO2	1779299398	SBBMBQSQCYBGRX-QFIPXVFZSA-N	445.592	1.866	50	20	IDGD	
COC(=O)CCCCCC(=O)N1CCO[C@@]2(CCN(C(=O)CO[Si](C)(C)C)C2)C1	1779301872	XDXBZNHHNZWLKS-HXUWFJFHSA-N	428.602	1.791	50	20	IDGD	
COc1ccc(C2(C(=O)N3CC[C@]4(CN(C(=O)[C@@H](O)CCl)CCO4)C3)CCC2)cc1	1781204194	HBKWJUAAHLISFQ-RXVVDRJESA-N	436.936	1.547	50	20	IDGD	
Cc1c(F)ccc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](F)Br)C3)C2)c1N	1781330806	GOEJCQDGRTXWDF-YOEHRIQHSA-N	432.265	1.850	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ncc(OC)cc3F)CCO2)C1	1783344558	RGIUBECHDNHGLL-SCLBCKFNSA-N	444.301	1.846	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccn4ccnc4c3)CCO2)C1	1783349207	JPULTJFIQAHXGE-KXBFYZLASA-N	435.322	1.951	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3noc4c3CCCC4)CCO2)C1	1783534539	LDJUYCNRAJMYQL-KZULUSFZSA-N	426.311	1.780	50	20	IDGD	
C[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1783704919	KEKHFRKATMXJCG-VLIAUNLRSA-N	431.961	1.995	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)c3ccco3)C[C@@H]21	1783964765	ZWSBBRRWOPBYER-IICXDKKESA-N	429.311	1.324	50	20	IDGD	
CSc1ccc(CC(=O)N2CC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)cc1	1784217647	DBAIUGYFZGPFIH-JOCHJYFZSA-N	448.589	1.154	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)Cn3cccn3)[C@H]2C1	1785445239	YOHMSHLRTRBYPX-HMDCTGQHSA-N	441.370	1.672	50	20	IDGD	
Cc1onc(-c2ccccc2)c1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21	1785894281	OIURCEQNJOIXAE-XSLAGTTESA-N	447.919	1.843	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(C(=O)OC)nc3)[C@H]2C1	1787604080	UGHCJGHWBXJLEG-CUSZFKRNSA-N	437.924	1.869	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc4ncccn34)[C@H]2C1	1788005400	IGJWJQMNLJKNSB-NGOJXBLDSA-N	440.331	1.559	50	20	IDGD	
O=C(CCBr)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1	1788140729	OQSUBPRPWBKBSM-UHFFFAOYSA-N	445.122	1.899	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)c1csc2c1CCCC2	1788312997	JJFSLKRXCCRQBJ-CSFVBSKPSA-N	426.966	1.820	50	20	IDGD	
C[C@@H](Nc1cnccn1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]2C1	1788764737	TYMAQPNANUCMSX-QZWWFDLISA-N	435.601	1.108	50	20	IDGD	
CC(C)(C)OC(=O)CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]2C1	1789868879	QHXRWVXZLPJHQD-WFTHSTBKSA-N	437.364	1.934	50	20	IDGD	
N#C/C(=C\c1ccc(Br)cc1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN)C[C@@H]21	1790696334	SXOTVFVVOYVBQI-DCHBYBGLSA-N	447.333	1.294	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1ccc(C2(NC(=O)[C@H](O)N3CCOCC3)CCC2)cc1	1791568868	LCXBIVJGZBTGNZ-LPHOPBHVSA-N	425.913	1.025	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnoc1C1CC1)C2	1792870168	JYNYKPZYECTFPA-DNVSUFBTSA-N	426.311	1.786	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1c(F)ccnc1Cl	1794238718	PSYDNZYKFUZPHP-DRXBFXEBSA-N	429.952	1.929	50	20	IDGD	
COc1ccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCBr)cc1F	1795117057	KMRDGGXEAFHKSJ-HBCWATKFSA-N	443.313	1.751	50	20	IDGD	
CC[C@H](C)[C@H](N)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)C2	1795558111	XGUBCHGKGNUKKG-SUADVCAXSA-N	446.498	1.835	50	20	IDGD	
CCOc1c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Cl)cnc2c1cnn2C	1796363351	PBTWHQLVIPUKQM-VAECKANCSA-N	439.875	1.105	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnccc1F)C2	1796892351	XEQWSQMNEYDLME-SSJPOKSSSA-N	426.452	1.607	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1c[nH]c2cnccc12	1797564003	CIWKFEQHJCWKRG-OWLDWWDNSA-N	425.258	1.457	50	20	IDGD	
O=C(CS[C@H]1CCCCO1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2	1797793770	ZQVIUSOXBOPKED-RMHZUWNSSA-N	435.384	1.621	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(F)c(F)c1)C2	1798442165	ZJMZBFYYGBAXMJ-BTTYYORXSA-N	429.427	1.529	50	20	IDGD	
CCOc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@](C)(Cl)CCl)C3)nn1	1798754043	FESXTNUUKWCHFS-ABXQLRGKSA-N	431.320	1.315	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3ncccc3[nH]1)C2)[C@H](F)Br	1799348869	QIRJYPLSOQAJNH-OWLDWWDNSA-N	425.258	1.457	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2c(c1)NC(=O)CC2	1800102876	BTCCAAHOWVMWAL-UPHUGPLXSA-N	445.592	1.626	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1nnc(C)s1)C2	1800639840	OWIIBDUPLYOXHY-NWJSVONSSA-N	431.356	1.152	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1n[nH]c3c1CC[C@H]3C)C2	1800757061	HJMIEXGYQOBUNY-XRHZXQNYSA-N	425.327	1.446	50	20	IDGD	
Cc1cc(C)n2ccc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@@H](C)Br)c2n1	1800762130	OIFCLSOWEHEORC-PNBKFKSVSA-N	449.349	1.938	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1(c3ccc(F)c(F)c3)CC1)C2	1800977378	NRQFTJDSUHSDGA-HRJSJKBJSA-N	442.890	1.840	50	20	IDGD	
CC[C@H](NC(C)=O)C(=O)NC[C@@H]1CCN(C(=O)[C@H](C)Br)[C@H]1c1cccnc1	1802548844	UNELEOQSWABRPI-STECZYCISA-N	439.354	1.786	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1CCN(C(=O)CS(C)(=O)=O)[C@@H]1c1cccnc1	1803009269	SGDPYJPDMKHYML-IVMMDQJWSA-N	446.367	1.163	50	20	IDGD	
COc1ccc(CC(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)cc1	1803138273	INFYUGGZJPGVJC-QFUCXCTJSA-N	431.920	1.938	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc3cnccc3n2)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803139796	WACOAVHTACJSRV-FFZOFVMBSA-N	439.903	1.944	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccn3ccnc3c2)[C@H]1c1cccnc1)[C@H](O)CCl	1803142942	OWJHTCGRVJFGRH-SCTDSRPQSA-N	427.892	1.649	50	20	IDGD	
O=C(CCNC(=O)c1ccc[nH]1)NC[C@@H]1CCN(C(=O)[C@H](F)Cl)[C@@H]1c1cccnc1	1804460352	FZYMAOQJWGLJMR-QGTPRVQTSA-N	435.887	1.770	50	20	IDGD	
O=C(Cn1cc(Cl)cn1)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1	1807404120	SBFOVUURIQKHKV-JLJPHGGASA-N	426.304	1.237	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)c1cn2ccccc2n1	1809048461	PRRHGCDSMCMRPL-WDYCEAGBSA-N	427.892	1.649	50	20	IDGD	
Cc1nocc1C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1	1810297425	CBDDMJDZIVLWCE-KXBFYZLASA-N	449.471	1.010	50	20	IDGD	
C[C@@H]1C[C@]1(C)C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1	1810305323	KBSHRZREMXGMRM-RNRVAENMSA-N	436.516	1.446	50	20	IDGD	
Cc1nc(C)c(C(=O)NC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)o1	1810876391	HJXYGWJCTDGBTR-PXNSSMCTSA-N	442.520	1.379	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)[C@H]2CC[C@H](O)CC2)[C@H]1c1cccnc1	1813075036	WXQVZHQUXOOEAW-FUOQNJDISA-N	445.564	1.012	50	20	IDGD	
COc1cc(C(=O)N2CC[C@@H](CNC(=O)C(Cl)Cl)[C@H]2c2cccnc2)n(C)n1	1813077058	GFEFJBRKIWRSEH-SWLSCSKDSA-N	426.304	1.947	50	20	IDGD	
COc1ccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)cn1	1815440896	KGNVKYQCUSFNLW-SFHVURJKSA-N	449.276	1.113	50	20	IDGD	
Cc1cccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)n1	1816397887	ZMOFJPMUYHYVLV-QGZVFWFLSA-N	427.509	1.792	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(=O)nc3cccnn23)[nH]n1)[C@@H](F)Cl	1818041881	XKAMOSBWDVRETL-MEDUHNTESA-N	433.831	1.653	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2nc[nH]c2[N+](=O)[O-])n[nH]1	1818078946	RQVMHDZMCKQTNI-ONGXEEELSA-N	425.833	1.601	50	20	IDGD	
CCc1nc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)CCC(=O)NN(C)C)CC3)co1	1820755136	HOCSNSNTQXHZJQ-LLVKDONJSA-N	434.522	1.292	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)ncn2)[nH]n1)[C@H](F)Br	1820931700	SJEGMVXWQZFINW-GWCFXTLKSA-N	427.234	1.902	50	20	IDGD	
COc1ccc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@@H](F)Br)CC3)nn1	1821069387	PJZBGQZGPCRSOK-JMCQJSRRSA-N	444.286	1.858	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCN2CCOC2=O)[nH]n1	1822370324	MLARHOSKDBYPCR-TZMCWYRMSA-N	427.889	1.498	50	20	IDGD	
O=C(N[C@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1)c1c[nH]c(=O)cn1	1823006837	IWSSAPDGXIBVEP-UPONEAKYSA-N	430.259	1.143	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCC([C@H]2CCCCN2C(=O)C(O)O)CC1	1824025191	VYQDOFHCFBBDFX-QGZVFWFLSA-N	449.460	1.064	50	20	IDGD	
Cc1nn(C)cc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1	1824713270	USJPQYYVFLRPMS-LJQANCHMSA-N	432.569	1.335	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(=O)n1O)CC2	1825994607	WONFNQAPIPYRHB-ZJUUUORDSA-N	426.882	1.022	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1[nH]cc3c1CCC3)CC2	1826088378	XBPBLTOVBJXUOF-ZDUSSCGKSA-N	444.561	1.559	50	20	IDGD	
CCNC(=S)NCC(=O)N1CCC([C@H]2CCCCN2C(=O)CCBr)CC1	1826360042	WSEQGQWTVFXFFU-OAHLLOKOSA-N	447.443	1.875	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccc(C#N)cc3)CCO2)C1	1829898941	OQGFYHUUUWAVBX-DENIHFKCSA-N	433.936	1.965	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)C3CC(F)(F)C3)CCO2)C1	1829993342	ZXZPRDFZRFUHNN-CZUORRHYSA-N	439.297	1.662	50	20	IDGD	
COc1ccc([C@@H]2C[C@@H]2C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)cc1	1831302634	VRYWLCLUORKJCO-LXGFNABISA-N	440.899	1.790	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3(Br)CC3)C2)C1	1831654055	PSTJSIWHIHQPFR-CJNGLKHVSA-N	437.762	1.778	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1)c1ccncn1	1835146429	KLWQEOGRCKAJJB-HNNXBMFYSA-N	428.306	1.352	50	20	IDGD	
O=C(CCc1ccc2c(c1)OCO2)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1835180503	JDKFEXIRIYNQGB-QUCCMNQESA-N	442.871	1.339	50	20	IDGD	
C[C@@H](Nc1cccnc1)C(=O)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1835695363	FGZIEWBMPDCCEV-FZKQIMNGSA-N	431.320	1.142	50	20	IDGD	
CC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)CCN3CCOCC3)CC2)CC1	1836395774	MFKSGZWLMRYRPP-IBGZPJMESA-N	429.005	1.298	50	20	IDGD	
O=C(/C=N/O[C@H]1CCCCO1)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836716967	BAGSSQJWPWTHRO-KPQBVPQESA-N	445.944	1.114	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccn4ccnc34)CCO2)C1	1836995025	GLQDRPGTOMQUAM-DYESRHJHSA-N	434.924	1.812	50	20	IDGD	
C[Si](C)(C)c1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)co1	1837424359	VGFPSBADPZINKH-CRAIPNDOSA-N	432.952	1.429	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC(OC2CCN(C(=O)CCSC(=N)N)CC2)CC1	1837863890	URKHUMAXZXIKPE-UHFFFAOYSA-N	444.674	1.853	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3oc(C)nc3C)CCO2)C1	1838007521	GRGSFIAPJXHLEM-KBXCAEBGSA-N	444.326	1.535	50	20	IDGD	
N[C@@H](Cc1cccnc1)C(=O)N1CCC(OC2CCN(C(=O)[C@H](F)Cl)CC2)CC1	1838083252	IBDHGROJHTYKOY-ROUUACIJSA-N	426.920	1.484	50	20	IDGD	
CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)CCO2	1838528260	MZKBMCQFYRIODC-FQEVSTJZSA-N	435.433	1.000	50	20	IDGD	
CCOC(=O)C1(C(=O)N2CCC(OC3CCN(C(=O)[C@H](Cl)COC)CC3)CC2)CC1	1838737695	KHOXCCQTZMLBFR-QGZVFWFLSA-N	444.956	1.582	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)cc1F	1838915996	MYQRIIUBYUMVEW-CRAIPNDOSA-N	447.276	1.895	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3c(F)cccc3F)CCO2)C1	1838996603	VUDHESUZYPCTEE-QRWLVFNGSA-N	446.878	1.218	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3nnsc3C3CC3)C2)C1	1839144901	ODATUERNLNIULT-FZKQIMNGSA-N	428.942	1.503	50	20	IDGD	
O=C(c1coc(Cl)n1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839198063	RNGLOGFAWHMFQC-YGRLFVJLSA-N	440.653	1.089	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(O)cc1F)CCO2	1839316844	VQTMXBBACNCPLK-FQEVSTJZSA-N	440.544	1.453	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc4ccncc34)CCO2)C1	1839509089	KGBCGFPIANNPHX-SIKLNZKXSA-N	447.919	1.559	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)C[C@@H]3CCCCO3)C2)C1	1839962564	KLUANUNPUOKXCV-TXPKVOOTSA-N	447.370	1.576	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccccc3)C2)C1	1839963552	OELNBSHQPCFYEC-PXNSSMCTSA-N	439.350	1.859	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(F)ccc3OC)C2)C1	1840156949	YPRRNOGBWTYRIS-UZLBHIALSA-N	444.887	1.158	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@](C)(C(=O)N2CC3(CCCN3C(=O)[C@@H](O)CCl)C2)C1	1841354507	FELDAEKBOJAJFP-MGPUTAFESA-N	443.972	1.827	50	20	IDGD	
Cc1cc(C(=O)N2CC3(CCCN3C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)no1	1841924241	NPOASVGCJJLJCJ-AWEZNQCLSA-N	426.901	1.932	50	20	IDGD	
COC(=O)CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)[C@H](F)Cl)C1	1843365452	RBHMIEUHXDBAOB-OCCSQVGLSA-N	449.907	1.571	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)c2c[nH]c3cccc(Cl)c23)C1	1844144951	GKIJJHGIXAJKJA-UHFFFAOYSA-N	437.692	1.632	50	20	IDGD	
C[C@H]1Oc2ccc(C(=O)N3CCCC34CN(C(=O)[C@H](F)Br)C4)cc2NC1=O	1844730163	BMYFCHVQMKFKRH-YGRLFVJLSA-N	440.269	1.914	50	20	IDGD	
CCn1nc(C(C)C)cc1C(=O)N1CCCC12CN(C(=O)c1cnccc1C(=O)NN)C2	1844823158	DSFILBIOYOMHHW-UHFFFAOYSA-N	439.520	1.156	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)Cc2ccc([N+](=O)[O-])c(OC)c2)C1	1845148841	VTXKMBOUEJYMKS-CQSZACIVSA-N	425.869	1.603	50	20	IDGD	
O=C1CSc2ncc(C(=O)N3CCCC34CN(C(=O)[C@@H](F)Br)C4)cc2N1	1845670049	SRQAHGSGEUJHSD-GFCCVEGCSA-N	443.298	1.633	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC12CN(C(=O)Cn1cccc([N+](=O)[O-])c1=O)C2	1846072021	BNDGACWHNLQCLM-LBPRGKRZSA-N	441.282	1.133	50	20	IDGD	
C=CCO[C@@H](C)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O	1847811777	SJLZKZYKKGGBCM-KKXDTOCCSA-N	431.445	1.927	50	20	IDGD	
NS(=O)(=O)c1ccc(CCC(=O)NNC(=O)Cc2nc(-c3ccccc3)cs2)cc1	10600326	QLACBDREXRBLSR-UHFFFAOYSA-N	444.538	1.780	50	20	IDGD	
CC(C)[C@H](NC(=O)COc1ccccc1)C(=O)NNC(=O)[C@@H](C)Oc1ccccc1F	26534306	JNKPBZDYEVYFMI-QRWLVFNGSA-N	431.464	1.960	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)c2ccc(CCNS(C)(=O)=O)s2)cc1	28029845	FINDYZWCZOAZHO-UHFFFAOYSA-N	427.573	1.702	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)CCc1nc2c(cnn2C)c(=O)[nH]1	29513702	QQJVUBXTVGJFRU-ZDUSSCGKSA-N	434.456	1.357	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)CC12C[C@H]3C[C@@H](CC(O)(C3)C1)C2	103255862	XHBWBUZULGTBSS-VKFLQFAXSA-N	434.562	1.771	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C2CCN(C(=O)OCC(C)C)CC2)cc(OC)c1OC	726134989	VBEBTILIDCOISU-UHFFFAOYSA-N	437.493	1.978	50	20	IDGD	
Cn1cc(CCCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)cn1	726851429	OHJXIWCVAATRCF-UHFFFAOYSA-N	448.549	1.172	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)N[C@H]2CCc3nc(C)nn3C2)cc(OCC)c1OCC	727229330	QGOGTPXWCGEQFN-HNNXBMFYSA-N	446.508	1.742	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccn(C)n2)c1	727364784	UTECAAXJNAPSIG-UHFFFAOYSA-N	429.458	1.304	50	20	IDGD	
CCOc1ccc(OCC)c(NC(=S)NNC(=O)c2ccc(S(N)(=O)=O)o2)c1	727492758	YIKUQCIXFZEFMF-UHFFFAOYSA-N	428.492	1.356	50	20	IDGD	
O=C(COC(=O)c1cnc(-c2ccccn2)s1)NNC(=O)c1ccc([N+](=O)[O-])cc1	727891833	YZYCLOHMVWSGNA-UHFFFAOYSA-N	427.398	1.731	50	20	IDGD	
CC(C)(C)CC(=O)N1CSC[C@@H]1C(=O)NNC(=O)c1csc(N2CCOCC2)n1	728151532	JZQHBZRCBUFRRM-CYBMUJFWSA-N	441.579	1.078	50	20	IDGD	
Cc1nn(C)c2[nH]c(=O)c(CCC(=O)NNC(=O)c3cccc(OC(F)F)c3)c(C)c12	728484781	JLSAQYCDFPQUCW-UHFFFAOYSA-N	433.415	1.874	50	20	IDGD	
CC(=NNC(=O)Cc1csc(N2CCOCC2)n1)c1cccc(NS(C)(=O)=O)c1	729816470	MPKZRJLXLCTPRY-UHFFFAOYSA-N	437.547	1.434	50	20	IDGD	
COC(=O)C1CCC(NC(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)CC1	730130006	FYSJYICCJHTSGX-UHFFFAOYSA-N	429.477	1.653	50	20	IDGD	
O=C(COC(=O)[C@H](c1ccccc1)N1CCC(O)CC1)NNC(=O)c1ccc(Cl)cc1	731249800	WQBBGFQWOOKHKB-FQEVSTJZSA-N	445.903	1.842	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1cc2c(nc1O)CCCC2	731740440	SXVWWLHEPPFVCL-UHFFFAOYSA-N	433.848	1.946	50	20	IDGD	
C=CCn1c(S)nc2cc(C(=O)NNC(=O)CCN3C[C@H](C)O[C@@H](C)C3)ccc2c1=O	732261125	KLXXQCIBHYXKPP-KBPBESRZSA-N	445.545	1.132	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)c2ccc(I)c(F)c2)C[C@@H](C)O1	732262069	IKHZYADNXGAIAT-GHMZBOCLSA-N	449.264	1.691	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)NCc1ccc(OCCN2CCCC2)cc1	732473689	WWQLSJUIPRYPFW-UHFFFAOYSA-N	437.500	1.942	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)[C@@H](C)CS(=O)(=O)c2ccc(OC)cc2)cc1	735004399	AALZIHGGCPWBQG-HNNXBMFYSA-N	434.514	1.894	50	20	IDGD	
COc1ccc(S(=O)(=O)C[C@H](C)C(=O)OCC(=O)NNC(=O)c2ccc(C)cc2)cc1	735158814	SLKWXRFANJADED-HNNXBMFYSA-N	448.497	1.418	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1ccc(C(=O)NNc2ncnc3[nH]cnc23)cc1	740746673	CIPRCDQHQSLBKP-UHFFFAOYSA-N	439.457	1.919	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)c1nnn(-c2ccc(F)cc2)c1C(F)(F)F	740851765	UWYTWVZMVBBGHP-UHFFFAOYSA-N	430.362	1.491	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(CC(=O)NNC(=O)Cc2cccc3ccccc23)C(=O)C1	741175952	YOEAFZGLEXKDDB-UHFFFAOYSA-N	440.500	1.609	50	20	IDGD	
COCc1cc(C(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)no1	742510648	HEMROTXGNQJGBV-UHFFFAOYSA-N	433.428	1.598	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)c1ccc(Cl)c(N2CCNC2=O)c1	742675963	GEVDWTATULHRNY-UHFFFAOYSA-N	440.888	1.338	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1cc(O)nc2cc(F)ccc12	744620544	KEGFOXGHSMJKBO-UHFFFAOYSA-N	446.460	1.857	50	20	IDGD	
C[C@@H](C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1)N1CCc2ccccc2C1	744621261	MZRYBHKNXGJFLZ-KRWDZBQOSA-N	444.557	1.597	50	20	IDGD	
C[C@H]1CN(c2ccc(C(=O)OCC(=O)NNC(=O)c3ccc(C#N)cc3)cn2)C[C@H](C)O1	744716077	ZPMONBBGVHKMNY-GJZGRUSLSA-N	437.456	1.185	50	20	IDGD	
C[C@@H](CC(=O)c1ccccc1F)C(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	745489275	YJCRRXCIJMSIRG-LBPRGKRZSA-N	431.376	1.947	50	20	IDGD	
O=Cc1ccc(OCC(=O)OCC(=O)NNC(=O)c2cccs2)c(Br)c1	745589876	RFXUGQHLKBAAPH-UHFFFAOYSA-N	441.259	1.706	50	20	IDGD	
O=C(CNC(=O)[C@@H]1c2ccccc2C(=O)N1Cc1ccccc1)NNC(=O)c1ccncc1	745835299	BSEPXHOZGCGOSV-NRFANRHFSA-N	443.463	1.356	50	20	IDGD	
Cc1nn(CCCl)c(C)c1C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	746331781	JCRJELJJUAWQDD-UHFFFAOYSA-N	441.941	1.517	50	20	IDGD	
NC(=O)c1ccc(OCC(=O)NNc2ccc(S(=O)(=O)Nc3nccs3)cc2)cc1	747942605	BKSKWFFLLNMHOI-UHFFFAOYSA-N	447.498	1.565	50	20	IDGD	
COc1ccc(-n2c(C)cc(/C=C(\C#N)C(=O)N3CCN4C(=O)NC(=O)[C@@H]4C3)c2C)cc1	749253150	OIQIYCZVWUJFNA-KDMTZKAISA-N	433.468	1.772	50	20	IDGD	
CN1CC[C@H](C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)c2ccccc21	750788219	LSCWNEOGJBKUGU-FQEVSTJZSA-N	435.528	1.216	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N[C@H](C)C[S@@](C)=O)cc1	753149697	BXHBFYGABPRFMJ-YEJLFTSZSA-N	443.529	1.224	50	20	IDGD	
N#C/C(=C\c1ccc(O)cc1)C(=O)OCC(=O)N1CCc2cc(S(N)(=O)=O)ccc21	754548054	BJSVPOUXCOFNDJ-OQLLNIDSSA-N	427.438	1.079	50	20	IDGD	
COC(=O)CNC(=O)c1ccc(NC(=O)NNC(=O)c2cccc(OC(F)F)c2)cc1	755543574	CGDMRSDPSZDLHY-UHFFFAOYSA-N	436.371	1.657	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)Nc1ccccc1C(=O)N1CCN(C)CC1	755621784	CRDFBBNOFNKSLG-OAHLLOKOSA-N	443.479	1.834	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)Nc2cc(N3CCCS3(=O)=O)ccc2F)c1O	756155592	RVYSBQARUWVNHL-UHFFFAOYSA-N	438.437	1.546	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c(OC)n1	756247820	JJLWVIIZBGGQQK-UHFFFAOYSA-N	428.493	1.464	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)Nc2ccc(F)c(-n3nnnc3C)c2)cc1	756335673	KOPWYTHSZSZJHD-LBPRGKRZSA-N	441.423	1.933	50	20	IDGD	
COc1ccccc1N1CC[C@H](NC(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)C1	757290484	FPGBFXNRRPARRK-KRWDZBQOSA-N	425.489	1.860	50	20	IDGD	
COc1ncc(NC(=O)NNC(=O)COc2cccc(C(F)(F)F)c2)cc1C(N)=O	757693216	SZMDQCMCWVBSDV-UHFFFAOYSA-N	427.339	1.440	50	20	IDGD	
Cc1ccc(-n2nc(Br)cc2C(=O)NNC(=O)C(=O)Nc2ccccn2)cc1	758840697	WVHXLPMGNMPMAZ-UHFFFAOYSA-N	443.261	1.738	50	20	IDGD	
C[C@H](O)C[C@@H](CNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)c1ccccc1	759610390	KZHPCUBHWLJHCT-LPHOPBHVSA-N	426.521	1.578	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NC[C@]1(Cc2ccc(F)cc2)CCC[C@H]1O	759691218	BAODJMQRCQUVNO-DYESRHJHSA-N	448.520	1.721	50	20	IDGD	
Cc1cc(C)nc(-n2nccc2NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2F)n1	760291301	NTXBRSQDYCLFSR-UHFFFAOYSA-N	431.815	1.471	50	20	IDGD	
Cc1cc(C)nc(-n2nccc2NC(=O)C(=O)NNc2ccc(Br)cn2)n1	760301555	JPJIBSDYKZOYEJ-UHFFFAOYSA-N	431.254	1.518	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)CS[C@H](C)C(=O)Nc1cc(C)on1	761618471	FGDTZLKDAGGGHM-GFCCVEGCSA-N	438.531	1.992	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)N[C@@H]2CCCN(c3ccccc3F)C2)c2ccccc2c1=O	763079384	OTNIGJVZGNCALH-CQSZACIVSA-N	438.463	1.686	50	20	IDGD	
CCN1CCN(c2ccc(Cl)cc2NC(=O)C(=O)NNC(=O)c2ccncc2)CC1	763463501	ZPLBYICCSQAWPA-UHFFFAOYSA-N	430.896	1.277	50	20	IDGD	
CCOC(=O)c1cnn2c(C(=O)NNC(=S)Nc3ccc(OCC)cc3)ccnc12	763545966	KFIZKRQHJSQSHK-UHFFFAOYSA-N	428.474	1.936	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)nn1-c1cccc(F)c1	763550933	JEQDYDQBLBPQFT-UHFFFAOYSA-N	425.376	1.448	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)Nc1ccc(OC2CCCC2)cc1	763575608	ZBBGMTIMDPCMBV-IBGZPJMESA-N	425.441	1.934	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1ccc(OC[C@@H]2CCCO2)cc1	763623149	CQBWAMVKMQFBBB-KRWDZBQOSA-N	437.456	1.600	50	20	IDGD	
C[C@@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3cccc(N(C)C)c3)cc2)CCO1	763758149	OZUHIRRJANXTLE-OAHLLOKOSA-N	425.489	1.377	50	20	IDGD	
CC(C)C(=O)NNC(=O)C(=O)Nc1ccc(S(=O)(=O)N(C)Cc2ccccc2)cc1	763817033	WUEMZIOXCDKZEJ-UHFFFAOYSA-N	432.502	1.249	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(OC)c(OCC)c2)cc1OC	763901304	NEENWHVPIVIZTF-UHFFFAOYSA-N	431.445	1.901	50	20	IDGD	
C#CCOc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(OCCC)c(OC)c2)cc1	763912093	NOXAOOCTBDEMKQ-UHFFFAOYSA-N	425.441	1.896	50	20	IDGD	
O=C(NNC(=O)c1ccc(F)cc1Br)C(=O)Nc1ccccc1-n1cncn1	764084723	GZBVXBCCLAMALI-UHFFFAOYSA-N	447.224	1.569	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccccc3-n3cccn3)n[nH]2)cc1	764110897	MLLUGMJFLOCAIS-UHFFFAOYSA-N	429.440	1.971	50	20	IDGD	
O=C(CC(F)(F)F)NNC(=O)C(=O)Nc1cc2c(cc1Br)OCCO2	764112665	NPAABMHCJFWDCE-UHFFFAOYSA-N	426.145	1.259	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2ccc(N3CCOCC3)c(F)c2)cc1	764132744	WYMBLVVWEYKEJM-UHFFFAOYSA-N	444.463	1.390	50	20	IDGD	
O=C(CC1CC1)NNC(=O)C(=O)Nc1ccc(Cl)c(S(=O)(=O)N2CCCCC2)c1	764142527	PXLUOWREVYTMDC-UHFFFAOYSA-N	442.925	1.401	50	20	IDGD	
N#Cc1cccnc1Oc1ccccc1NC(=O)C(=O)NNC(=O)[C@@H]1Cc2ccccc2O1	764153081	IJUHQIZPLOQJFI-IBGZPJMESA-N	443.419	1.835	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2O1)C(=O)Nc1cc(N2CCCC2=O)ccc1F	764153107	IROOOFFYUOWQJU-KRWDZBQOSA-N	426.404	1.042	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccccn2)cc1OCC1CCOCC1	764270894	VLQQKTDAEXFQRP-UHFFFAOYSA-N	426.473	1.524	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)C(=O)Nc1cccc(-c2cn(Cc3ccccc3)nn2)c1	764298541	WAWYCDQTJHGZPM-UHFFFAOYSA-N	444.455	1.425	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)C(=O)Nc1cc(Br)c(F)cc1Cl	764354595	ULTDTFHQVLRSTN-UHFFFAOYSA-N	429.633	1.965	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(N3CCC(CN(C)C)CC3)cc2)o1	764367498	ILVPUXZIVXMTKJ-UHFFFAOYSA-N	427.505	1.766	50	20	IDGD	
Cc1nccn1-c1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)cn1	764382477	LRNNAGDMWXKKJI-UHFFFAOYSA-N	436.457	1.427	50	20	IDGD	
CNC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2F)ccc1Cl	764410598	ULGZHWWKRWJEAG-UHFFFAOYSA-N	427.219	1.892	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)CN2C(=O)[C@H](C)Oc3ccccc32)n[nH]1	765595572	MSKUBPXFYVBBGQ-ZDUSSCGKSA-N	435.440	1.660	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCN(C(C)=O)C2(CCCCC2)C1	766245975	JKEBANJWNCPLRA-UHFFFAOYSA-N	436.940	1.977	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)[C@H](NC(=O)c1ccco1)c1ccccc1	767267635	OMLYZIHAMLVSQI-JOCHJYFZSA-N	449.463	1.992	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)c1ccc(N2C(=O)CCC2=O)c([N+](=O)[O-])c1	767470682	YCMLKHPHSQZYSX-UHFFFAOYSA-N	436.384	1.279	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ncn(-c3ccccc3)n2)c1	768273065	FKIBXGSUTBUHFP-UHFFFAOYSA-N	442.501	1.373	50	20	IDGD	
COc1cc(C(=O)NNC(=O)N[C@H]2CCO[C@]3(CCSC3)C2)cc(OC)c1OC	768516292	KILOLHZHMVPPIF-ORAYPTAESA-N	425.507	1.711	50	20	IDGD	
N#Cc1cc(Cl)nc(NNC(=O)COCC(=O)NNc2cc(C#N)cc(Cl)n2)c1	769056762	PGLXOYRGDGDASZ-UHFFFAOYSA-N	435.231	1.130	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2cccc3c2CCN3C(C)=O)c1	769264260	CUFDVAAFUARYPZ-UHFFFAOYSA-N	426.429	1.013	50	20	IDGD	
CCc1c(C(=O)NNC(=O)CCN2C[C@@H](C)O[C@H](C)C2)cnn1-c1ccccc1OC	769648830	SQDKLHGJWXROKI-HZPDHXFCSA-N	429.521	1.704	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)[C@H](C)NS(=O)(=O)c1cccc(C(F)(F)F)c1	770955161	MBIQPOZICPXOOE-NSHDSACASA-N	445.419	1.842	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)CN2C(=O)N[C@@](C)(c3ccccc3OC)C2=O)n1	771652719	GBFNEECPXNAQLS-NRFANRHFSA-N	441.492	1.242	50	20	IDGD	
CN(CCNC(=O)NNC(=O)c1ccc2ccccc2n1)S(=O)(=O)c1cccs1	772014595	ABRDIATVELIPJT-UHFFFAOYSA-N	433.515	1.561	50	20	IDGD	
O=C(CCCC(=O)c1ccc(Br)cc1)NNC(=O)CNC(=O)c1ccco1	772175266	HWXVOZMYTRYRHN-UHFFFAOYSA-N	436.262	1.973	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)CCCC[C@@H]1SC[C@H]2NC(=O)N[C@@H]21	772969221	KQGLFKGHSBNNQV-UTNFCUCBSA-N	440.953	1.981	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)c1cnn(CC(=O)NC2CCCC2)c1	772998478	PNZDJFGPRRPYCE-CYBMUJFWSA-N	433.896	1.824	50	20	IDGD	
CCOc1ccc(-c2noc(CCC(=O)NNC(=O)c3cncc(NC(C)=O)c3)n2)cc1	773082426	VVCJAJZVFXRALG-UHFFFAOYSA-N	438.444	1.883	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)c1cc(S(N)(=O)=O)ccc1Cl	773177729	XKNOOBSKJWQAEC-VIFPVBQESA-N	432.285	1.869	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)C(=O)Nc2cccc(S(=O)(=O)N3CCCCC3)c2)n1	773478316	BPGNIYRKGSRWRL-UHFFFAOYSA-N	432.506	1.350	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)N[C@H](C)[C@@H](OC)c1ccc(Br)cc1	774343149	HLBMWDFGNRHWQZ-LALPHHSUSA-N	432.315	1.907	50	20	IDGD	
COCc1ccc(S(=O)(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)cc1	774618729	MSMDOXDBQOFPFB-UHFFFAOYSA-N	442.538	1.725	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)c2cccc(Cc3cnc(N)s3)c2)c1	775898953	FCRKNDYPKDLGHE-UHFFFAOYSA-N	435.465	1.806	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)N2CCN(c3nnc(C(F)(F)F)s3)CC2)cc1	776867010	SEZJEERIOVZXFF-UHFFFAOYSA-N	425.396	1.605	50	20	IDGD	
COc1c(F)cc(S(=O)(=O)NNC(=O)c2nnc(-c3ccccc3)o2)cc1[N+](=O)[O-]	777613641	CGBGPKGBAPJPPD-UHFFFAOYSA-N	437.365	1.416	50	20	IDGD	
Cc1cc(F)c([N+](=O)[O-])cc1S(=O)(=O)NNC(=O)C1CCN(c2ncccn2)CC1	777933441	PIZVVQSZYINJFX-UHFFFAOYSA-N	438.441	1.058	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1cc2c(cc1F)NC(=O)CC2	778706686	BNNVCIQTTQCKFA-SNVBAGLBSA-N	432.383	1.403	50	20	IDGD	
Cc1nn(-c2ccccc2)c(C)c1C(=O)C(=O)NNC(=O)CCNC(=O)OC(C)(C)C	780973868	IQSNCUZMOYMTEO-UHFFFAOYSA-N	429.477	1.734	50	20	IDGD	
O=C(NNc1ccc([N+](=O)[O-])cc1)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(Cl)cc1	782016413	DEEDORDJBSZNRW-ZBFHGGJFSA-N	440.865	1.515	50	20	IDGD	
CC[C@H](C)NS(=O)(=O)Cc1cccc(NC(=O)C(=O)NNc2ccc(OC)cn2)c1	782141124	LVBLCHSBHZBIMH-ZDUSSCGKSA-N	435.506	1.390	50	20	IDGD	
COc1cc(OC)c(NC(=O)C(=O)NNC(=O)c2ccc(O)cc2)cc1Br	782834006	OQTIPOBDIYVFSS-UHFFFAOYSA-N	438.234	1.572	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2cc(Br)c(F)cc2Cl)CCS(=O)(=O)C1	783423831	ATTNCBWBKVAGND-ZDUSSCGKSA-N	442.694	1.378	50	20	IDGD	
CN(NC(=O)[C@@H]1CCCN1Cc1ccccn1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	783703943	JBQGVYDJIDQDBQ-SFHVURJKSA-N	446.552	1.682	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2cccc(C(=O)NCC(N)=O)c2)ccc1Br	783921252	PGNCSARUIQDAOT-UHFFFAOYSA-N	448.277	1.054	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2cccc([N+](=O)[O-])c2C)cc1NS(C)(=O)=O	784357604	FCQPZJZSWJOMMF-UHFFFAOYSA-N	437.434	1.365	50	20	IDGD	
CC[C@H](C)NS(=O)(=O)c1cccc(NC(=O)C(=O)NNc2nccnc2Cl)c1	784777955	NWBWKQCBJRBBEL-JTQLQIEISA-N	426.886	1.289	50	20	IDGD	
CCN1CCN(c2ccc(Cl)cc2NC(=O)C(=O)NNc2cccc(OC)n2)CC1	784846416	SVNDNXVUFWODIQ-UHFFFAOYSA-N	432.912	1.967	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ccnc(N(C)C)n2)cc1NC(=O)OC(C)(C)C	784970778	MTRYXXFPGDRISX-UHFFFAOYSA-N	445.480	1.980	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)ccc1OCC(F)(F)F	785061104	SHJQQBATHZHNPQ-UHFFFAOYSA-N	449.389	1.912	50	20	IDGD	
COc1cc(F)cc(NNC(=O)C(=O)Nc2cc(N3CCCS3(=O)=O)ccc2F)c1	785242286	VNMFGZYGUCKPHT-UHFFFAOYSA-N	440.428	1.595	50	20	IDGD	
NC(=O)[C@H]1CCC[C@H](C(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)C1	786688871	XLRLWHPOODVTHH-IRXDYDNUSA-N	447.495	1.498	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)C(=O)Nc2cc(-c3ccc(F)cc3F)nn2C)c1	789732396	OOFNJIFNJUUFNU-UHFFFAOYSA-N	442.426	1.831	50	20	IDGD	
COc1cc(Cl)c(S(=O)(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1OC	790340135	WGDBGFKNJPHOPE-UHFFFAOYSA-N	448.906	1.384	50	20	IDGD	
CC(=O)N1CCCN(c2ccc(F)cc2NC(=O)C(=O)NNC(=O)CC(C)(C)C)CC1	790953209	YDQWYCXYCNSFLE-UHFFFAOYSA-N	435.500	1.406	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc3c2OCC[C@@H]3OC)cc1OC	790956476	JFJRJGRGHIRYDR-HNNXBMFYSA-N	429.429	1.574	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)CCN2CCN(C(=O)OC(C)(C)C)CC2)cc1	792633224	RAGYAKGTRNTTIV-UHFFFAOYSA-N	434.537	1.718	50	20	IDGD	
CO[C@@H]1CCC[C@H](CC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)C1	792773421	RHFRCRXJYHBOIL-DOTOQJQBSA-N	439.534	1.064	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NC[C@@H]2CCCN(C(C)=O)C2)c2ccccc2c1=O	793310242	YKNRDZXRRJYDRM-INIZCTEOSA-N	442.520	1.399	50	20	IDGD	
C[C@@H](CNC(=O)OC(C)(C)C)C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	794752439	PGGVRGKENBFXTC-KRWDZBQOSA-N	433.553	1.507	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1n[nH]c(C(C)C)c1[N+](=O)[O-]	796258046	ADQQOQHCWJQZSQ-UHFFFAOYSA-N	439.812	1.721	50	20	IDGD	
COC(=O)c1cc(F)c(Br)cc1NC(=O)C(=O)NNc1ccc(Cl)nn1	796989089	NPJCQTRITZHZHE-UHFFFAOYSA-N	446.620	1.900	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)C(=O)Nc1ccc(OCC(F)(F)F)c(F)c1	800621845	AQCWXKJDIXJPAI-UHFFFAOYSA-N	443.309	1.895	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)NCCS(=O)(=O)CCc2ccccc2)c1	800756263	CNEWXJOKVQIRSZ-UHFFFAOYSA-N	433.530	1.670	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)CSc2nnnn2C2CC2)cc1Cl	802077104	IFGKIVOJRBRCHQ-UHFFFAOYSA-N	427.874	1.624	50	20	IDGD	
CCN1CCN(Cc2ccc(CNC(=O)NNc3ccc(-n4ccnc4)nn3)cc2)CC1	804948812	ANLTUKZSXVUSER-UHFFFAOYSA-N	435.536	1.626	50	20	IDGD	
CN(C)C(=O)Cn1cnc(NC(=O)NNc2ccc(-c3cccc(C(F)(F)F)c3)nn2)n1	806308033	KNRFLPDWVNICJN-UHFFFAOYSA-N	449.397	1.991	50	20	IDGD	
O=C(NNC(=O)c1cnn(CCF)c1)c1cccc(S(=O)(=O)NCc2ccccc2)c1	806342739	RGGXTXKBLGUIRB-UHFFFAOYSA-N	445.476	1.406	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)Nc1ccc(F)c(N2C(=O)CCC2=O)c1	806744282	VTUIUQNYPROFQF-MRXNPFEDSA-N	428.376	1.472	50	20	IDGD	
COCCOc1ccc(S(C)(=O)=O)cc1NC(=O)C(=O)NNc1ccccc1F	806981086	JDESDLCGUHSMTQ-UHFFFAOYSA-N	425.438	1.336	50	20	IDGD	
C[C@@]1(C2CC2)NC(=O)N(c2ccc(CNC(=O)NNC(=O)CC(F)(F)F)cc2)C1=O	807239669	IHFWBBOWCGPEHL-KRWDZBQOSA-N	427.383	1.694	50	20	IDGD	
CC(=O)c1cccc(S(=O)(=O)NCC(=O)NNc2ccc(-c3ccccc3)nn2)c1	810493808	IULNGYIXIROREO-UHFFFAOYSA-N	425.470	1.768	50	20	IDGD	
COc1cc(C(=O)NN=C2CCCc3ccc(S(N)(=O)=O)cc32)cc(OC)c1OC	811630297	XRKSVUCPAKFFRH-UHFFFAOYSA-N	433.486	1.830	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)C(C)(C)c1ccc2c(c1)OCO2	814224598	ITGKRAXPIHSIOZ-UHFFFAOYSA-N	432.502	1.756	50	20	IDGD	
O=C(NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)NNC(=O)[C@@H]1CCc2nncn2C1	814325747	YJSDSUYCPDJXAJ-SNVBAGLBSA-N	427.343	1.298	50	20	IDGD	
CCCN1C(=O)c2ccccc2N2C(=O)CC[C@]12C(=O)NNC(=O)NCc1ccco1	814625419	CUMSQFGAFYTLOJ-NRFANRHFSA-N	425.445	1.499	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NN=Cc3ccc4oncc4c3)CC2)cc1	814876896	DXIWWGLPBPECBX-UHFFFAOYSA-N	441.513	1.593	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCCNC(=O)[C@H]1Cc1ccccc1	815142450	TTYNMYLSAPJPNC-GOSISDBHSA-N	444.919	1.543	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)C1(N2C(=O)c3ccccc3C2=O)CCCC1	815440083	SNUSOWOGHZMQNR-CQSZACIVSA-N	429.473	1.721	50	20	IDGD	
CNC(=O)Oc1cccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)c1	815565943	FJOZWSWQWWRCFB-CQSZACIVSA-N	428.445	1.575	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)Cc2ccc(F)cc2)cc1)[C@H]1C[C@@H]1C	815567344	VEYZBLZOACWADB-DJJJIMSYSA-N	426.448	1.916	50	20	IDGD	
CCCNC(=O)c1ccc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)N(C)C)cc1	815751044	QAZYWLJZEYXURC-UHFFFAOYSA-N	447.517	1.159	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1ccc2c(c1)CCCC2=O	815826778	AJSQNFUUUWWZFS-UHFFFAOYSA-N	434.496	1.425	50	20	IDGD	
COc1cccc(/C=C(\C(=O)NNC(=O)c2cc(Br)c[nH]2)n2nnnc2C)c1	818071187	MKUDAGZXYYITEE-VIZOYTHASA-N	446.265	1.540	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccccc1C(F)(F)F)NNC(=O)c1ccc2c(c1)OCO2	913415642	CFEKEZZETJKMGZ-UHFFFAOYSA-N	445.375	1.174	50	20	IDGD	
CCCc1ccc(N2C[C@@H](C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)CC2=O)cc1	914406042	JTBFRJIOPPEBKJ-KRWDZBQOSA-N	433.472	1.429	50	20	IDGD	
COc1ccc(/C=C(\C#N)C(=O)OCC(=O)N2CCN(c3oc(C)nc3C#N)CC2)cc1	915369771	CTFAOHCIGJDNSH-GZTJUZNOSA-N	435.440	1.662	50	20	IDGD	
COCC(=O)NC1CCN(C(=O)/C(C#N)=C\c2cc(C)n(C[C@@H]3CCCO3)c2C)CC1	915705781	TXBVLWXJIJYMHS-JCAJYURWSA-N	428.533	1.945	50	20	IDGD	
CC(C)CCNC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	915880005	DMPVPPRZRFECGV-UHFFFAOYSA-N	426.539	1.017	50	20	IDGD	
CC(=NNC(=O)Cc1nc(O)c2c(C)c(C)sc2n1)c1ccc(S(N)(=O)=O)cc1	916322689	IDMQNRGSUAFCEY-UHFFFAOYSA-N	433.515	1.744	50	20	IDGD	
COc1cc(C=NNC(=O)c2csc(N3CCOCC3)n2)cc(OC)c1OC(C)=O	916338145	IIKICOXUVMOCJR-UHFFFAOYSA-N	434.474	1.686	50	20	IDGD	
COCCCn1c(S)nc2cc(C(=O)NNC(=O)c3ccc(Cl)nc3)ccc2c1=O	917251102	RMCKBNQGXLTPSQ-UHFFFAOYSA-N	447.904	1.845	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)nnn1-c1cccc(Cl)c1	917529298	BPTWGCDPFZEGIK-UHFFFAOYSA-N	437.847	1.551	50	20	IDGD	
NC(=O)c1cn(CC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c2ccccc12	917904795	ZFRMVIDNTXQHCQ-UHFFFAOYSA-N	448.527	1.100	50	20	IDGD	
COc1cccc(/C=C(\C(=O)NNC(=O)NCCc2cccs2)n2nnnc2C)c1	920859364	IQJYMSPGTJYYKZ-SFQUDFHCSA-N	427.490	1.623	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H](C)c2cnn(C)c2C)c1	1115853446	CFABMOPUIBLDNC-ZDUSSCGKSA-N	436.538	1.464	50	20	IDGD	
COc1cc(C(=O)NNC(=S)Nc2ccccn2)cc(NS(C)(=O)=O)c1OC	1119110228	AOPPYVQHSAAISJ-UHFFFAOYSA-N	425.492	1.102	50	20	IDGD	
CS(=O)(=O)Nc1ccccc1CNC(=O)NNC(=O)NCc1ccc(Cl)cc1	1318449000	SGUMGBBTHHJDSW-UHFFFAOYSA-N	425.898	1.925	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN(c2ncnc3sccc23)C1)c1n[nH]c2c1CCCC2	1319112934	MHKKYAIPVOINRZ-GFCCVEGCSA-N	425.518	1.971	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(F)(F)[C@H](C(=O)NNC(=O)c2n[nH]c3c2CCCC3)C1	1321919356	WYMVFNQSSSNYED-LBPRGKRZSA-N	427.452	1.942	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)Nc1ccc(N2CCN(C)CC2)c(C)c1	1337767359	SWTGYJZIWQIJIV-UHFFFAOYSA-N	427.505	1.987	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cccc4c3NC(=O)C4=O)C2)C1	1778709040	WSGSANUIPVBAMA-VFNWGFHPSA-N	433.892	1.672	50	20	IDGD	
Cc1cc(/C=C/C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)no1	1779125786	OVCUBXXMWSIAOW-JSAGRGGKSA-N	426.311	1.857	50	20	IDGD	
CN1CCc2cc(C(=O)N3CCO[C@]4(CCN(C(=O)CO[Si](C)(C)C)C4)C3)ccc21	1779296741	BYGQLCYLNHFKOS-QFIPXVFZSA-N	431.609	1.974	50	20	IDGD	
Cn1c(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)cc2c[nH]c3nccc-3c21	1780035163	IXBBXMKGQXPNEB-HRAATJIYSA-N	445.907	1.049	50	20	IDGD	
COc1cc(C#N)cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](O)CCl)C3)c1	1780086068	BWEQOMQNTAGMRB-DBXWQHBBSA-N	435.908	1.294	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(=O)ccn3C)C2)C1	1780107043	XNBCXLJYTGPUHU-RDTXWAMCSA-N	426.311	1.002	50	20	IDGD	
CCC(=O)N[C@@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Br)C1	1780770201	HTLALQYLJWSFQD-HSTIPLNKSA-N	436.322	1.106	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cccc(S(C)(=O)=O)c3)CCO2)C1	1781211452	UWDQHIPVTDDCET-QFBILLFUSA-N	428.938	1.551	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)CCn3c(=O)oc4ccccc43)CCO2)C1	1781215586	RXYOZVWHJVNSGK-QVKFZJNVSA-N	435.908	1.832	50	20	IDGD	
COc1nccc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)c1F	1781330924	IWHCLSFRFZYJPO-MLGOLLRUSA-N	434.237	1.363	50	20	IDGD	
O=C(c1[nH]nc2ccncc12)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781332076	ZDLFKHOTSQIARF-CZUORRHYSA-N	426.246	1.092	50	20	IDGD	
O=C1CSc2ncc(C(=O)N3CC[C@@]4(C3)CN(C(=O)C(Cl)Cl)CCO4)cc2N1	1782423517	DJIKAHSBSFBRGA-QGZVFWFLSA-N	445.328	1.373	50	20	IDGD	
COCCC(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](Br)Cc3ccccc3)C2)C1	1783022622	KULQVEPFJSZYFA-PXNSSMCTSA-N	439.350	1.859	50	20	IDGD	
C[C@@H](C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)C2)c1ccccc1	1783244676	LRYYORDZFJWYPZ-DRMXPCRNSA-N	444.576	1.677	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)CN3CCC(C)CC3)CCO2)C1	1783344915	WRASGIOTVDYNRB-APWZRJJASA-N	430.387	1.722	50	20	IDGD	
CCOc1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](Br)CC)C3)C2)nn1	1783353703	ZGAKVGHGUZYFAD-SCLBCKFNSA-N	441.326	1.492	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)COc3ccc(O)cc3)CCO2)C1	1783527517	CJMYVUDFXIYPFU-FZKQIMNGSA-N	427.295	1.384	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(F)nc3)C[C@@H]21	1783970252	PKLWHIAAKDVXHV-UNQGMJICSA-N	428.302	1.845	50	20	IDGD	
CC(C)(C)OC(=O)CCCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]2C1	1784084144	MAUMTGBGWKKVSW-VGWMRTNUSA-N	432.945	1.078	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cn3cc([N+](=O)[O-])cn3)[C@H]2C1	1785217805	JCWKKAJOXUPZDS-MJFSBKNWSA-N	448.307	1.007	50	20	IDGD	
CCC(=O)N[C@@H](C)C(=O)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1	1786293292	BXJVXULHWOYOJA-HNNXBMFYSA-N	437.305	1.029	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)Cc3ccccc3)C[C@@H]21	1788763457	FBKVNBIUTXQEDZ-HAGHYFMRSA-N	434.609	1.421	50	20	IDGD	
O=C(Cc1cc2cccnc2cc1F)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21	1789844638	UQHSCBMMYJGSLV-QHERXFFYSA-N	449.910	1.496	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccnc4c3OCO4)C[C@@H]21	1789870604	QBIPZMQNCZBBTH-MDWPOOTQSA-N	444.315	1.640	50	20	IDGD	
CC[C@@H](Cl)C(=O)Nc1ccc(C2(NC(=O)c3cc(=O)n4[nH]nnc4n3)CCC2)cc1	1790485621	BIPHNYFTNOTPFN-CYBMUJFWSA-N	429.868	1.578	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](N)c3ccccn3)C[C@@H]21	1790961884	SJAZQQDUFLCTBE-JBJRXJHCSA-N	439.354	1.235	50	20	IDGD	
CCc1nn(C)c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](Cl)COC)[C@H]3C2)c1Cl	1791252836	RPRAVISTMZPDOX-XPCVCDNBSA-N	447.363	1.483	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cn4cc(F)ccc4n3)C[C@@H]21	1791253547	DQDUKOXBBKXJPL-QEWYBTABSA-N	438.887	1.321	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(-c4ccncc4)[nH]n3)C[C@@H]21	1791255612	XDUFXCSAMICKNZ-FPXQBCRKSA-N	447.923	1.319	50	20	IDGD	
CSCC[C@H](O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]21	1791308223	WUJIPAACCANXMK-DEEHTKSCSA-N	427.394	1.316	50	20	IDGD	
C[C@H](Nc1cccnc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)CBr	1792867923	NVPGVNDHSKQCPA-JGFGOLAASA-N	439.354	1.503	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(S(C)(=O)=O)c1)C2	1793444968	NCMNMIZJQCQCCX-MVJTYMMSSA-N	442.965	1.701	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CC(c2ccccc2)=NO1	1793499389	QGPIGEGVSBEDGW-DMUMMCEESA-N	441.532	1.191	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccnc1C(=O)OC(C)C	1794314523	ALWDVRYWXOPTEG-YALNPMBYSA-N	437.924	1.867	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2)c1ccc(OC(F)F)cn1	1794455816	ZXKSLCVRDJFKGX-QHBPRCKVSA-N	448.264	1.671	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CC[C@H]1CNc2ccccc2C1	1795651077	DSPAWZAAOIYLMB-DRASZATQSA-N	449.979	1.894	50	20	IDGD	
Cc1c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)C(Cl)Cl)C3)ccc2c1OCCO2	1796251834	SVUUSSHEJUQTMQ-JJLQDPRZSA-N	429.300	1.773	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1nc2ccccc2n(C)c1=O	1797524305	WOJQOMBBOCPLFQ-XGUBFFRZSA-N	432.908	1.439	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)Nc1cnccn1	1797778765	CXGOZXGBWWZXSX-USRAEIGSSA-N	440.342	1.040	50	20	IDGD	
C[C@H](Oc1ccccc1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnccc1C(=O)NN	1798442847	KHBASSKNRIDSPK-NXOAAHMSSA-N	437.500	1.404	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(Cl)nc1F)C2)[C@@H](F)Br	1799344949	ZQYXBYLIJZDCCS-IWXIMVSXSA-N	438.656	1.768	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc3c1OCC3)C2)[C@@H](F)Br	1799347590	QQRFFNSSXSNXKX-FAXLKDOZSA-N	427.270	1.515	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Nc1cnccn1)C2	1800641965	OCCZGZZCJUECBC-XYFZXANASA-N	440.342	1.040	50	20	IDGD	
COc1ccc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)Br)cn1	1800757056	MKDYRQSHOGSJCL-LJGDNWOOSA-N	440.338	1.396	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cc(F)ccc1[N+](=O)[O-]	1802095210	VVDCJDBSHSKAAM-HRJSJKBJSA-N	443.859	1.120	50	20	IDGD	
N#Cc1ccc(CC(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)cc1	1802573255	JYUJQEOZJJWGOG-IRFCIJBXSA-N	426.904	1.801	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1	1803012113	WCAHDGDZPOXFOP-UQOMUDLDSA-N	432.746	1.718	50	20	IDGD	
C[C@H](Nc1nccs1)C(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1	1803139075	KDFQOYPSFVAIPH-UKMLZYKCSA-N	437.953	1.644	50	20	IDGD	
O=C(Cc1ncccn1)NC[C@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1	1804689353	ODVIILFCAWFKSI-DNVCBOLYSA-N	432.322	1.905	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2cccc(=O)n2C)[C@H]1c1cccnc1	1805314671	BXVNGFANAOLYNK-JTDSTZFVSA-N	432.908	1.354	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)N1CCC2(CCCN(C(=O)[C@H](C)CBr)C2)CC1	1805385154	SWCGNYXYEBEMTA-HUUCEWRRSA-N	428.371	1.939	50	20	IDGD	
O=C(COc1ccc(F)cc1)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1	1806475390	UFJJUJWQJTUQAW-CVAIRZPRSA-N	435.883	1.905	50	20	IDGD	
O=C(CNc1ccc(F)cc1)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1	1807060954	FFNHYLAQJJPBOS-QSFXBCCZSA-N	434.899	1.938	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)N1CC[C@H](CNC(=O)[C@H](F)Br)[C@H]1c1cccnc1	1808662503	MDOCTAWSISMERI-MPESAESLSA-N	443.317	1.645	50	20	IDGD	
C[C@@H]1CCC[C@@H]1C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1809656107	HXGKUWTZKQPILH-JJJJLYANSA-N	435.333	1.517	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC2(CCCN(C(=O)c3cc(C(F)F)no3)C2)CC1	1810235496	PNUHEYZYJPAUIK-UHFFFAOYSA-N	447.247	1.451	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)[C@H](COC)NC(C)=O)[C@@H]1c1cccnc1	1810560322	YTRMALSQGIPCDT-XWSJACJDSA-N	438.956	1.646	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2ncccc2F)[C@H]1c1cccnc1	1811118762	XKGDKDNSTKZPOB-IIBYNOLFSA-N	442.495	1.308	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2cnn3cccnc23)[C@@H]1c1cccnc1	1813029942	BGAUPBBIIBNYAJ-RYQLBKOJSA-N	442.907	1.698	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2cnn3cccnc23)[C@H]1c1cccnc1	1813029943	BGAUPBBIIBNYAJ-SZMVWBNQSA-N	442.907	1.698	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)[C@H]2CCc3nc[nH]c3C2)[C@@H]1c1cccnc1	1813034047	ZPNZZMWQTKVLAK-JWWIWJDOSA-N	445.951	1.869	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1	1814060892	YUPBWKZIXCQSPK-BBTUJRGHSA-N	442.903	1.638	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)CS(C)(=O)=O)sc2C1	1814327498	FOKVHALWTAOFIU-DTWKUNHWSA-N	438.369	1.273	50	20	IDGD	
C[C@H](NC(=O)c1ccccc1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](O)CCl)n[nH]1	1814875565	DASVESDJOVIZCX-RRQGHBQHSA-N	447.923	1.820	50	20	IDGD	
C=CC[C@H](C(=C)C)C(=O)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1	1815356526	IWXIZZJPCIOZPG-DLBZAZTESA-N	439.346	1.817	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H]2CCC(=O)N2)n[nH]1	1817084677	IMMDGECXUCUOAS-WZRBSPASSA-N	426.315	1.711	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](O)C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](F)Cl)sc2C1	1817128481	LXKAVIIRHSXUTQ-JVQVWZCXSA-N	436.893	1.433	50	20	IDGD	
CC1=CC[C@H](C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2ccc(B(O)O)cc2)CC3)CC1	1818623118	YCSYAFKUMJVIKO-YOEHRIQHSA-N	439.346	1.795	50	20	IDGD	
Cc1cnc2c(C(=O)Nc3nc4c(s3)C[C@@H](NC(=O)[C@H](O)CCl)CC4)cnn2c1	1819086120	ROIOMAZHNZHQBF-GXFFZTMASA-N	434.909	1.320	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)C2CC(F)(F)C2)[nH]n1	1819400624	OYXYTPFPAGIUGF-HNNXBMFYSA-N	447.446	1.759	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCc2ccc(O)nn2)n[nH]1	1821640899	ZFCOGALIIWUCIR-ZFWWWQNUSA-N	436.900	1.784	50	20	IDGD	
C=CC[C@@H](C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1821920937	AEKJBFHPAUQHFB-DYVFJYSZSA-N	425.493	1.926	50	20	IDGD	
Cc1nc(N)sc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1	1822414260	PIMRFHQMKGHGEQ-CYBMUJFWSA-N	448.553	1.436	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnc(O)nc1O)CC2	1822863560	OBUYICLSZBAPBL-QZTNRIJFSA-N	446.316	1.806	50	20	IDGD	
Cc1nnc(CC(=O)N[C@@H]2CCc3nc(NC(=O)[C@H](F)Br)sc3C2)o1	1823002179	AOLBKWHUBFIFNU-KRTXAFLBSA-N	432.275	1.680	50	20	IDGD	
O=C(/C=C\C(=O)N[C@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1)NC1CC1	1823008983	YGRDQDSTGQBTHJ-FAYRYBEVSA-N	445.314	1.580	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H]3CCC(=O)N3C)sc2C1	1823054516	KGQKTMAFXZXENG-SCVCMEIPSA-N	443.367	1.849	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CNCP(=O)(O)O)CC1	1824614047	DPWGRTKBBMTXCF-HZPDHXFCSA-N	437.905	1.738	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccnc2C(N)=O)CC1	1825400755	DXUOOKBYLABEIK-IAGOWNOFSA-N	436.940	1.668	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](C)Br)sc2C1	1825641358	NVLBLHWDZAWTGW-IQJOONFLSA-N	431.356	1.705	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)Cc1cc(C)n(C)n1)CC2	1825995169	UIGZFZPJLONJLN-DGCLKSJQSA-N	425.942	1.594	50	20	IDGD	
CCc1cc(C(=O)N[C@H]2CCc3nc(NC(=O)[C@H](Cl)COC)sc3C2)n(C)n1	1826003936	VFIHYKUQGSYVRW-NWDGAFQWSA-N	425.942	1.919	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)c2cncc(F)c2)CC1	1826056761	DHNMWZZUFMEBHQ-OAQYLSRUSA-N	439.296	1.448	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccoc1Cl)CC2	1826088661	IJYKQJUTQBQSNF-JTQLQIEISA-N	439.925	1.988	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H]3CCNC(=O)C3)sc2C1	1826228458	LVZXTMMIPIDIQS-LPEHRKFASA-N	429.340	1.365	50	20	IDGD	
COc1ccnc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)c1	1829262757	POMLFCMUSPEKKA-HXUWFJFHSA-N	445.564	1.697	50	20	IDGD	
Cc1cccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)n1	1830537455	IQJBTHUOROESIY-IFXJQAMLSA-N	440.338	1.491	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3CC[C@H](O)CC3)C2)C1	1830544036	LQNIMXJGTQNXNA-IUVQAAGXSA-N	447.370	1.025	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccncc2O)CC1	1831873797	YGXZHADGZYKPLH-GOSISDBHSA-N	431.537	1.394	50	20	IDGD	
Cc1cccc(CCC(=O)N2CCC(N3CCC(NC(=O)[C@H](O)CCl)CC3)CC2)n1	1833308482	TWQNNGMVPLNDDV-HXUWFJFHSA-N	436.984	1.494	50	20	IDGD	
Cc1cc(C(=O)N2CCC(N3CCC(NC(=O)[C@H](O)CCl)CC3)CC2)cc2c[nH]nc12	1833311904	GUWNWDFHVSWQTK-LJQANCHMSA-N	447.967	1.656	50	20	IDGD	
CC(C)n1ccc(C(=O)N2CCC(N3CCC(NC(=O)[C@H](O)CCl)CC3)CC2)n1	1833312219	JXLDTPPZJAVNJZ-GOSISDBHSA-N	425.961	1.249	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)C3Cc4ccccc4C3)CC2)CC1)[C@H](O)CCl	1833313852	WHIINZDZQGCOEP-OAQYLSRUSA-N	433.980	1.573	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ocnc3C)CCO2)C1	1834369333	HPHWXOQFUFOOQU-CXAGYDPISA-N	430.299	1.227	50	20	IDGD	
CC1=CC[C@H](C(=O)N2CCOC[C@@]3(CN(C(=O)CCBr)CCO3)C2)CC1	1834821270	DSTWLCXIYQXAHL-QFBILLFUSA-N	429.355	1.974	50	20	IDGD	
CCCC(=O)N[C@H](C)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](Cl)CC)CC2)CC1	1835820788	QEJCOEWCOWIJOV-QAPCUYQASA-N	429.005	1.880	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)N1CCC(N2CCC(NC(=O)CO[Si](C)(C)C)CC2)CC1	1835837793	VPSROVUUCGPXFI-MRXNPFEDSA-N	440.661	1.276	50	20	IDGD	
COc1ncccc1C(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836714942	DZFFSTBNRZQLIQ-QGZVFWFLSA-N	425.913	1.302	50	20	IDGD	
C#CCO[C@@H](C)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1836860747	DDLFVXLCVWOARO-XJKSGUPXSA-N	433.318	1.714	50	20	IDGD	
CC(C)O[C@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1	1837601913	HGVJPNKMOMZGMI-ZTFGCOKTSA-N	425.353	1.493	50	20	IDGD	
COCCOCC(=O)N1CCC(OC2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1837768226	KBCKLDAFRNTFAT-MRXNPFEDSA-N	439.322	1.339	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(C(C)(C)C)n[nH]3)CCO2)C1	1837991426	KSAJFGMBIQICLJ-VLIAUNLRSA-N	426.945	1.795	50	20	IDGD	
Cc1nc(C)c(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)o1	1838006055	IFRMAPHMKAMFJW-ZWKOTPCHSA-N	434.320	1.598	50	20	IDGD	
O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)c1c(F)cncc1F)CCO2	1838164789	QMXGWYICJFCZTR-QGZVFWFLSA-N	448.264	1.215	50	20	IDGD	
CC(=O)N[C@H](C)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1838647993	DSCMSYNAYAHMLE-IAQYHMDHSA-N	436.322	1.200	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3ccoc3)C2)C1	1839156624	WCDCKPRKHNLWBZ-RTBURBONSA-N	433.332	1.905	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cccc3ccnn13)CCO2	1839498881	VXXBOFYMAVWXSV-NRFANRHFSA-N	446.580	1.256	50	20	IDGD	
C[C@@H](Cc1ccncc1)C(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1839656675	YKQVNCADAZEJJB-HTAPYJJXSA-N	437.968	1.982	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CC=CCC3)C2)C1	1839961906	MSRUEOPKDRAXFL-MDZRGWNJSA-N	429.355	1.973	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(Cl)ccn3)C2)C1	1840033964	VTFCBDMURNTCFE-SJCJKPOMSA-N	446.729	1.588	50	20	IDGD	
Cc1ccc(O)c(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)c1	1840034278	GRDZEDNVYMBJMG-LIRRHRJNSA-N	441.322	1.554	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(N(C)C)c3)C2)C1	1840154411	WPKGMKYNOPXQQL-RXVVDRJESA-N	439.940	1.076	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(F)cc3OC)CCO2)C1	1840641453	GWLWHTGCVGCDQU-JXFKEZNVSA-N	444.887	1.158	50	20	IDGD	
O=C(C(Cl)Cl)N1CCOC[C@@]2(C1)CN(C(=O)[C@]1(F)CCCC=C1F)CCO2	1840951390	LJSHLRQCKIKJFM-SJORKVTESA-N	427.275	1.992	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)CCc2cnc3ccccc3c2)C1	1841252379	XPDKJJOUPUVCAD-UHFFFAOYSA-N	443.312	1.364	50	20	IDGD	
CCc1noc(C)c1C(=O)N1CC2(CCCN2C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C1	1843416163	HMPUIVROCLKBFT-YDZHTSKRSA-N	426.477	1.496	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC2(CCCN2C(=O)CCN2CCOC2=O)C1	1843858369	PGUZXUWXXSPHRH-MHWRWJLKSA-N	444.438	1.917	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)c2cc3cc(F)c(F)cc3[nH]2)C1	1844012884	WMYYZHZQLMFYNY-UHFFFAOYSA-N	433.459	1.636	50	20	IDGD	
CSc1ncccc1C(=O)N1CCCC12CN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2	1844581277	DLZSYXFMMSLOAS-ZVHZXABRSA-N	440.529	1.755	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)c1cc[n+]([O-])cc1)C2	1844692775	JNFOLKHJQZBQHA-UHFFFAOYSA-N	440.412	1.284	50	20	IDGD	
CN(CC(=O)N1CCCC12CN(C(=O)c1ccccc1)C2)NC(=O)NCc1ccccc1	1845039233	UXRDBLIIWATDTO-UHFFFAOYSA-N	435.528	1.850	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)N2CC3(CCCN3C(=O)[C@@H](F)Br)C2)c1	1845215847	HXGPJWIPXMKUMG-CYBMUJFWSA-N	433.299	1.598	50	20	IDGD	
COC(OC)C(=O)N1CC2(CCCN2C(=O)[C@H](Br)Cc2ccccc2)C1	1845940423	OXXCWQKQIRUOES-OAHLLOKOSA-N	425.323	1.815	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@](C)(O)C[C@H]1C(=O)N1CCCC12CN(C(=O)[C@H](F)Cl)C2	1846230600	WKVQZDLEHUUDGN-ZJNRKIDTSA-N	433.908	1.485	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2	1846362861	AUUVXUOZAAQTTK-HNNXBMFYSA-N	439.852	1.591	50	20	IDGD	
O=C1CN(c2cccc(C(=O)N3CC4(CCCN4C(=O)C(Cl)Cl)C3)n2)CCCN1	1846387184	QUGWCKSUHHFEQM-UHFFFAOYSA-N	440.331	1.029	50	20	IDGD	
COc1cc(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](O)CCl)ccc1Br	1847561838	IFUZGBILPNHVEI-MELADBBJSA-N	431.714	1.873	50	20	IDGD	
COc1ccc(Cc2nnc(SCC(=O)NNC(=O)c3ccc(Cl)cc3)n2N)cc1	10921195	WTIBJRZPTIMBTH-UHFFFAOYSA-N	446.920	1.798	50	20	IDGD	
O=C(COC(=O)COc1ccc2ccc(=O)oc2c1)NNC(=O)c1ccc([N+](=O)[O-])cc1	10988455	MDNGBLNTNDFDIP-UHFFFAOYSA-N	441.352	1.084	50	20	IDGD	
O=C(NNC(=S)NCCc1cccs1)[C@@H]1CC(=O)N(c2ccc3c(c2)OCCO3)C1	11513752	FLMULBGGZOMJJA-CYBMUJFWSA-N	446.554	1.610	50	20	IDGD	
CC(C)Cn1nc(C(=O)NNC(=O)CCN2C[C@H](C)O[C@H](C)C2)c2ccccc2c1=O	38686875	FHAACJAHFKZZBW-IYBDPMFKSA-N	429.521	1.313	50	20	IDGD	
COc1ccc2nc(C)c(C(=O)OCC(=O)NNC(=O)Cc3nc(C)cs3)cc2c1	115392360	JCOYTMGQRVEHNA-UHFFFAOYSA-N	428.470	1.864	50	20	IDGD	
O=C(CN1CCCN(C(=O)Oc2ccccc2)CC1)NNC(=O)c1cccc([N+](=O)[O-])c1	725816249	LXGSXDXCHKKTSX-UHFFFAOYSA-N	441.444	1.563	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)/C=C\c1ccccc1)C(=O)NNC(=O)c1cccn1C	726538125	BIYOUSNWRIOYBC-SYCZXOQXSA-N	436.559	1.498	50	20	IDGD	
COC(=O)N1CCC[C@H](NC(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)C1	726716999	JNJLPEKXTGMMGC-ZDUSSCGKSA-N	430.465	1.152	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)c1cc([N+](=O)[O-])cc2c1OCCO2	727483093	GHONOEYYCLEXIS-UHFFFAOYSA-N	425.357	1.332	50	20	IDGD	
CSCC[C@@H](NC(=O)c1ccccc1Br)C(=O)NNC(=O)CN(C)C	727761417	BPYGNPRFSWNOIZ-CYBMUJFWSA-N	431.356	1.010	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@H]2CCCN2C(=O)OCC(F)(F)F)cc(OC)c1OC	727785414	VTUIENCRIUWCRC-LLVKDONJSA-N	449.382	1.637	50	20	IDGD	
Cc1nc(N2CCOCC2)nc(O)c1CCC(=O)NNc1nc(-c2ccccc2)no1	728080158	IKZPIUGIXWMFGF-UHFFFAOYSA-N	425.449	1.453	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3ccc4ncsc4c3)cc2)CC1	728213970	SUIGVJCECSMSJB-UHFFFAOYSA-N	431.543	1.989	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NN=Cc1csc(-c2cccc(Br)c2)n1	728436678	ICTXPHVHRWFBIH-SECBINFHSA-N	431.337	1.960	50	20	IDGD	
CC(=O)NCC(=O)N1CCC[C@@H]1C(=O)NNC(=O)c1sc(-c2ccccc2)nc1C	728513019	OTTJDOFMYYWTCV-OAHLLOKOSA-N	429.502	1.007	50	20	IDGD	
O=C(NNC(=O)C1(c2cccc(F)c2)CCOCC1)C1CCN(c2ncccn2)CC1	728846933	WUNNKLFRTGXUNE-UHFFFAOYSA-N	427.480	1.728	50	20	IDGD	
O=C(NCCCN1C(=O)CCC1=O)NNC(=O)c1ccc(Br)cc1Cl	730025790	PXFKEQXQKQZYCO-UHFFFAOYSA-N	431.674	1.586	50	20	IDGD	
CC(C)(C)OC(=O)N1CSC[C@H]1C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	730077396	WKUDQYASLZSBRG-HNNXBMFYSA-N	442.563	1.880	50	20	IDGD	
O=C(CC[C@@H]1NC(=O)N(c2ccc(Cl)cc2)C1=O)NNC(=O)COc1ccccc1O	730778606	JAWWYJWKAGKPFG-AWEZNQCLSA-N	446.847	1.477	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2nc(C)n(-c3ccccc3)n2)c2ccccc2c1=O	731572180	JDQZCHIDHCAWHI-UHFFFAOYSA-N	431.456	1.770	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Cn2cnc3c(C)cccc3c2=O)cc1Br	732032506	ANANPLONJXOHBF-UHFFFAOYSA-N	445.273	1.937	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)N1CCN(S(=O)(=O)c2ccc(F)c(Cl)c2)CC1	732196753	FMFGNDDQOZRVPT-ZDUSSCGKSA-N	448.948	1.367	50	20	IDGD	
CCOc1ccc(C(=O)NCC(=O)NNc2ccccc2S(C)(=O)=O)cc1OCC	732304324	KLKQPCSCDGZYCJ-UHFFFAOYSA-N	435.502	1.761	50	20	IDGD	
C[C@@H]1CN(CC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)C[C@@H](C)N1C(=O)OC(C)(C)C	733200305	LIZUFRACMSHKBZ-ZIAGYGMSSA-N	435.481	1.686	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(/C#N)C(=O)NS(=O)(=O)CCCC(=O)OC)c1C	734087824	CLIQCFXVCXWNLR-XGHPXPSOSA-N	425.507	1.619	50	20	IDGD	
O=P(CCN[C@H]1CS(=O)(=O)C[C@@H]1N1CCOCC1)(c1ccccc1)c1ccccc1	734837402	IAYRBGNQVWXUFM-VXKWHMMOSA-N	448.525	1.088	50	20	IDGD	
CCOC(=O)C(=O)N1CCN(C(=O)/C(C#N)=C\c2cc(C)n(C[C@@H]3CCCO3)c2C)CC1	736132092	RYKYGKQDYCDRMM-DTBYZMGXSA-N	442.516	1.425	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)[C@H](C)N2C(=O)[C@@H]3CCCC[C@H]3C2=O)cc1C	736758020	RWOZWZCIVWFMCJ-BFHYXJOUSA-N	449.529	1.487	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)[C@@H]1CC(=O)N(c2ccccc2Br)C1	740850039	RHUPNEAENYXSJJ-LLVKDONJSA-N	439.310	1.254	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)[C@@H]1CS[C@@]2(c3ccc(F)cc3)CCC(=O)N12	740852376	XYLXHHSPAQMDLT-MGPUTAFESA-N	436.509	1.169	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)[C@H]1CCCN(c2ncccc2C(F)(F)F)C1	740853087	SVPATXRZDBMMNA-LBPRGKRZSA-N	429.443	1.769	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)N[C@H](C)[C@H]1CN(Cc2ccccc2)CCO1	741284686	YEGFYWSLCAKMHQ-DYESRHJHSA-N	426.517	1.858	50	20	IDGD	
CC(C)CC(=O)Nc1ccc(Cl)c(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)c1	741671573	IUUNZKKBHMABOC-GFCCVEGCSA-N	430.914	1.456	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cc3c(s2)CCC3)cc(NS(C)(=O)=O)c1OC	742474537	RQXVXBISMCZXHD-UHFFFAOYSA-N	439.515	1.700	50	20	IDGD	
O=C(Nc1ccc(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1)OCC(F)(F)F	742479643	AQSWMLNYWFQHGB-UHFFFAOYSA-N	449.349	1.848	50	20	IDGD	
C[C@@H]1CCCC[C@@]12NC(=O)N(CC(=O)NNC(=O)c1cccc(Br)c1)C2=O	742768795	AGJONRXHFBMQFG-ADLMAVQZSA-N	437.294	1.711	50	20	IDGD	
CC(=NNC(=O)Cc1cc(O)nc(O)n1)c1ccc(OCC(=O)Nc2ccccc2)cc1	743448126	ZNHZVAXFNWNPNI-UHFFFAOYSA-N	435.440	1.988	50	20	IDGD	
CCN(C[C@@H]1CCN(Cc2ccccc2)C1)C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	743511433	LEBSMHPRPDSBQT-LJQANCHMSA-N	448.531	1.861	50	20	IDGD	
C[C@H]1C[C@H](NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)C(=O)N1c1ccccc1	743589404	UEWVWIDNGWWCOI-YJBOKZPZSA-N	437.504	1.217	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)N[C@@H]1CC(=O)N(CCOc2ccccc2)C1	743636262	GSJAOSZGFDMBKR-OAHLLOKOSA-N	446.891	1.973	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2ccc(Cl)c(S(C)(=O)=O)c2)cc1	743831251	UGNGJFWWZQKOHO-UHFFFAOYSA-N	445.906	1.614	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CN2CCN(C(=O)COc3ccc(F)cc3)CC2)c1	744387514	BIYVZYRGXMUZNN-UHFFFAOYSA-N	428.464	1.118	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)CCCNC(=O)c2ccc(Cl)cc2)cc1	744481233	CACFMQNTPYOWGZ-UHFFFAOYSA-N	442.859	1.726	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1cnn(-c2ccccc2)c1	744619754	XFCAQRSEEMAWHW-UHFFFAOYSA-N	427.486	1.650	50	20	IDGD	
CC/C=C(\C)C(=O)N1CSC[C@@H]1C(=O)OCC(=O)NNC(=O)c1ccc(C#N)cc1	744972270	LFZNRAUEZNNBER-JILDMTJUSA-N	430.486	1.120	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CN2CCC(C(=O)NCCc3cccs3)CC2)cc1	745170656	GAFJHIAPXXRAMY-UHFFFAOYSA-N	428.558	1.888	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)COc2ccc([N+](=O)[O-])c(F)c2)c2ccccc2c1=O	745835598	QPCRMWCSTDWKMY-UHFFFAOYSA-N	443.391	1.865	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccc(C(=O)NNC(=O)Cc2cn3ccccc3n2)cc1	746551000	ZRWCCJKYKSEGTH-UHFFFAOYSA-N	429.502	1.415	50	20	IDGD	
Cc1cccn2cc(CCNC(=O)NNC(=O)c3csc(N4CCOCC4)n3)nc12	746776199	QWVHGUBRBDBXDV-UHFFFAOYSA-N	429.506	1.123	50	20	IDGD	
O=C(NNc1c(F)cc(C(=O)NC2CC2)cc1F)c1cccc(CN2C(=O)CNC2=O)c1	748829730	UMMUHWZVDBBRTR-UHFFFAOYSA-N	443.410	1.666	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NC2CCN(C3CCCC3)CC2)c1	748981803	BNZNENKHSWHAJT-UHFFFAOYSA-N	437.566	1.288	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(C(=O)NCC(=O)NNc2cccc([N+](=O)[O-])c2)cc1	749257699	FRKBLXDNIWUDCM-UHFFFAOYSA-N	449.489	1.498	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc3nnc(C)n3c2)c1	749715099	FRQQXUZGCCZQJR-UHFFFAOYSA-N	430.490	1.143	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1ccc2c(c1)NC(=O)[C@@H](C)N2C	749866383	METZYKRPJRXUKR-GFCCVEGCSA-N	444.517	1.140	50	20	IDGD	
NC(=O)c1ccc(CNC(=O)NNC(=O)[C@H]2Cc3ccccc3CN2Cc2ccccc2)o1	752009172	FFULEGBBBOKSJV-HXUWFJFHSA-N	447.495	1.836	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2C[C@@H](CNC(=O)OC(C)(C)C)C[C@H]2C)n1	752069513	PHTBOACFSQSSGJ-ZIAGYGMSSA-N	425.555	1.377	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)Nc1ccc(Br)c(C(=O)OC)c1C	753234748	NDBKBMAXKCAOCB-JTQLQIEISA-N	432.271	1.748	50	20	IDGD	
Nc1nc(Cl)cc(NNC(=O)[C@@H]2CCN(c3ccccc3Br)C2=O)n1	753458229	XRTWSFOXUUMEMW-QMMMGPOBSA-N	425.674	1.971	50	20	IDGD	
O=C(CC[C@H]1NC(=O)N(c2ccc(Cl)c(Cl)c2)C1=O)NNC(=O)Cc1cc[nH]n1	755285402	BIVIKFJGWUAKDK-CYBMUJFWSA-N	439.259	1.312	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)N[C@H]2CCN(c3ncccc3F)C2)cc1	755302632	NCHZLFOAOUSNGI-ZDUSSCGKSA-N	436.469	1.239	50	20	IDGD	
CCOc1ccc(S(=O)(=O)Nc2ccc(C(=O)NN=Cc3cn(C)nn3)cc2)cc1	755482080	VAZDMOFHGFIPMT-UHFFFAOYSA-N	428.474	1.779	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)c2cccc3ncccc23)n([C@H]2CCS(=O)(=O)C2)n1	755528956	AHXICOCLBYLTAU-ZDUSSCGKSA-N	428.474	1.566	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)Nc1ccc(OCC(=O)N(C)C)cc1	755646083	JVXBCWIKDBVSBW-UHFFFAOYSA-N	430.461	1.784	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2cccc(Cn3cccn3)c2)c1	755683531	KZVZNSWLPAYYIE-UHFFFAOYSA-N	442.501	1.648	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)Nc2ccc(CC(=O)N3CCOCC3)cc2)c1	755861894	JJAHAHKGJWQILP-UHFFFAOYSA-N	440.500	1.936	50	20	IDGD	
O=C(c1ccnc(OCC(F)(F)F)c1)N1CCN(S(=O)(=O)CBr)CC1	758512171	ISRDZPSNZWLHEV-UHFFFAOYSA-N	446.245	1.463	50	20	IDGD	
CCOC(=O)N1CCC[C@@H](C(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)C1	758781763	GSFZGIWNRARXLA-OAHLLOKOSA-N	441.529	1.491	50	20	IDGD	
O=C(NNC(=O)c1ccnc(O)c1)c1cccc(S(=O)(=O)NCc2ccccc2)c1	760263063	FBJSPPRJUNMEDL-UHFFFAOYSA-N	426.454	1.341	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)N[C@H]2CCN(C(=O)C3CCCC3)C2)cc1	762377933	GZIFQWLVQDACJE-WBVHZDCISA-N	432.521	1.974	50	20	IDGD	
Cc1ccc(S(=O)(=O)NC(C)(C)C)cc1C(=O)NNc1nccc(N2CCOCC2)n1	762854702	DYLKWYLQKKADMG-UHFFFAOYSA-N	448.549	1.455	50	20	IDGD	
CC(C)(C)OC1CC(CCNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)C1	763130836	GLXZMZBXMMAHRM-UHFFFAOYSA-N	425.555	1.908	50	20	IDGD	
O=C(NNC(=O)c1ccccn1)C(=O)Nc1ccc(I)cc1Cl	763467638	RWRSTQTXYYTGSE-UHFFFAOYSA-N	444.616	1.739	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)ccc1F	763511486	FTXOMKCCEHALBB-UHFFFAOYSA-N	448.476	1.318	50	20	IDGD	
CS(=O)(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2cc3ccccc3cc2O)c1	763523578	VMVWKPSJSQGTJZ-UHFFFAOYSA-N	427.438	1.349	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)Nc1ccc(F)c(C(F)(F)F)c1	763569460	ABIBNJIARGRHIK-AWEZNQCLSA-N	427.310	1.770	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(N2CCSCC2)cc1	763646457	HDZWBEJUMRYUBC-UHFFFAOYSA-N	444.513	1.413	50	20	IDGD	
COC(=O)c1cc(C(C)C)ccc1NC(=O)C(=O)NNC(=O)COc1ccc(C#N)cc1	763682141	RPMJAJRNNBXCMW-UHFFFAOYSA-N	438.440	1.633	50	20	IDGD	
CCn1cc(NC(=O)C(=O)NNC(=O)c2nn(CCC(C)C)c(=O)c3ccccc23)cn1	763844137	VFGSGCYUNQFMSO-UHFFFAOYSA-N	439.476	1.059	50	20	IDGD	
COc1cc(C(=O)N(C)C)ccc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccccc1F	763863849	DIXVFRNOBFKAME-LBPRGKRZSA-N	446.435	1.090	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(C(C)=O)cc2)cc1F	763877998	NQMPDBAJCXNAQD-LBPRGKRZSA-N	445.403	1.368	50	20	IDGD	
CC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(C(C)=O)cc2)cc1C	763879591	ZELVAQDZPNSHTL-AWEZNQCLSA-N	440.456	1.709	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)NC(=O)[C@H](C)O3)cc1OC	763901143	GEQGWSGPSPFTFL-NSHDSACASA-N	442.428	1.213	50	20	IDGD	
CC(C)S(=O)(=O)c1ccccc1NC(=O)C(=O)NNC(=O)Cc1ccc(Cl)cc1	763932841	SWRNAKFPKZQOBP-UHFFFAOYSA-N	437.905	1.851	50	20	IDGD	
CS(=O)(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)c1	763976899	HWERACBHKWEGMI-UHFFFAOYSA-N	446.268	1.502	50	20	IDGD	
O=C(Cc1ccsc1)NNC(=O)C(=O)Nc1ccc(OCc2noc(C3CC3)n2)cc1	764035256	QLNKMMHXWMMVLC-UHFFFAOYSA-N	441.469	1.916	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2OC)cc1C	764040358	GFAZPICHGPUKOX-UHFFFAOYSA-N	434.474	1.165	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(Cl)c(C(=O)NC3CC3)c2)c(O)c1	764110742	SXUKANJNESVRDI-UHFFFAOYSA-N	430.848	1.646	50	20	IDGD	
C=CCN(CC=C)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(C)cc2O)cc1	764111831	RGYDNDHPOUMWFW-UHFFFAOYSA-N	436.468	1.915	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccccc3S(C)(=O)=O)n[nH]2)cc1	764112529	ZHVSXKCAIKBKTC-UHFFFAOYSA-N	441.469	1.188	50	20	IDGD	
CCOC(=O)/C=C/c1ccc(NC(=O)C(=O)NNC(=O)Cc2ccccc2OC)cc1	764135490	HJUYPBNAXFPMRJ-JLHYYAGUSA-N	425.441	1.600	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)Cc2ccccc2OC)sc2c1CCC2	764138394	DACPHGQBQQSVDY-UHFFFAOYSA-N	445.497	1.751	50	20	IDGD	
Cc1cc(C)n(-c2ccc(NC(=O)C(=O)NNC(=O)[C@@H]3Cc4ccccc4O3)cc2F)n1	764164698	SGMRORMLKFJJKY-IBGZPJMESA-N	437.431	1.718	50	20	IDGD	
COc1ccc(I)c(NC(=O)C(=O)NNC(=O)CC(C)(C)C)c1	764202742	YUCCGFQOOWXBBF-UHFFFAOYSA-N	433.246	1.822	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)C(=O)Nc1ccc(OC[C@H]2CCCO2)cc1	764242028	AEDLYQLMBQHXRC-LJQANCHMSA-N	436.468	1.985	50	20	IDGD	
O=C(NNC(=O)c1cccc2ncccc12)C(=O)Nc1ccnc(OCC(F)(F)F)c1	764257920	QDTRBHOLZWFLEM-UHFFFAOYSA-N	433.346	1.971	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)C(=O)Nc1cc(-c2nnc3n2CCCCC3)ccc1F	764297540	BBCNGXFHUBOGAY-UHFFFAOYSA-N	440.439	1.242	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)NC[C@@H]1CN(Cc2ccccc2)CCO1	764327640	ZDSFTSLRJRKBEU-QGZVFWFLSA-N	430.530	1.716	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)ccc1N1CCCC1=O	764349406	NCKWUZZEKCSLAD-UHFFFAOYSA-N	446.847	1.581	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)C(=O)Nc1cccc(N2CCCCC2=O)c1	764351991	VMBLSSGFCKONKM-UHFFFAOYSA-N	446.467	1.789	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)C(=O)N1CCc2ccc(Br)cc21	764363956	XNOBBOFTMHNFLQ-UHFFFAOYSA-N	432.274	1.702	50	20	IDGD	
O=C(NNC(=O)[C@H]1COCCO1)C(=O)Nc1ccc(Sc2ccccc2Cl)cc1	764427583	AGHNXTZXOPICTE-OAHLLOKOSA-N	435.889	1.993	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3nc(C)n(-c4ccccc4)n3)CC2)cc1	765748366	MSGHVSXWTCIILO-UHFFFAOYSA-N	447.543	1.463	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)[C@H]1CCCN(C(=O)c2ccc(F)cc2)C1	766000248	JDBANQXTDXIGBY-HNAYVOBHSA-N	427.432	1.665	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)C(=O)Nc3c(C)cccc3C)CC2)cc1	766649121	ZSXNZYPNOHAZJO-UHFFFAOYSA-N	437.544	1.516	50	20	IDGD	
CCC1(CC)[C@@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)C[C@@H]1OC	767162676	YHPKFUKOKNVUNI-HOTGVXAUSA-N	426.539	1.475	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)N[C@@H]1CC(=O)N(Cc2ccccc2C(F)(F)F)C1	767327093	JDDXHSHXSBULTK-OAHLLOKOSA-N	435.406	1.774	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)[C@H](C)NS(=O)(=O)c2cccc(C#N)c2)c(C)c1	767852056	BKBANUIXZDPIDS-HNNXBMFYSA-N	429.502	1.101	50	20	IDGD	
COc1ccc(C(=O)NNC(=S)Nc2ccccn2)cc1S(=O)(=O)NC1CCCC1	768578005	IZOFGRCHYUFRPF-UHFFFAOYSA-N	449.558	1.943	50	20	IDGD	
CC(C)C[C@H](C(=O)NNC(=O)c1ccc2c(c1)OCCO2)N1C(=O)[C@H]2CC=CC[C@@H]2C1=O	770417956	NTUREXYTBCLDMS-YESZJQIVSA-N	441.484	1.585	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)N1CCN(C(=O)c2cccn2C)CC1	770659765	VJOANVHHRBGSOG-AWEZNQCLSA-N	433.896	1.645	50	20	IDGD	
Cc1cc2c(N3CCC[C@@H]3C(=O)NNC(=O)CCN3C[C@H](C)O[C@H](C)C3)ncnc2s1	770949217	CCXJDGAHOFATAL-JKIFEVAISA-N	446.577	1.615	50	20	IDGD	
CC(C)[C@@H](NC(=O)c1ccccn1)C(=O)NNc1nc(O)c2cnn(C(C)(C)C)c2n1	770968572	LOQNGQSLEOTNPZ-CQSZACIVSA-N	426.481	1.580	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)Cc3csc(NC(=O)c4cccs4)n3)nc21	770985049	WGCPBSMBBFRAQG-UHFFFAOYSA-N	430.475	1.525	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N[C@@H]2CCO[C@@]3(CCOC3)C2)cc1Br	771444768	POLKEEOUGJGQMY-PXAZEXFGSA-N	428.283	1.740	50	20	IDGD	
C#CCOc1ccccc1NC(=O)C(=O)NNC(=O)COc1cccc(C(F)(F)F)c1	773493479	BPHKNUVDUDODQF-UHFFFAOYSA-N	435.358	1.882	50	20	IDGD	
O=C1C[C@@H](Cc2ccc(NC(=O)C(=O)NNc3ncc(Cl)cc3Cl)cc2)C(=O)N1	773678584	WTWTYQIQEXVECL-SNVBAGLBSA-N	436.255	1.675	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)NCc2cn(C)nc2C)cc1	773888918	XMJMNWHQRPSAAI-YVLHZVERSA-N	447.499	1.699	50	20	IDGD	
CC(=O)N1CCN(Cc2ccccc2NC(=O)C(=O)NNc2nccnc2C(C)C)CC1	773990807	CYSIORLXSCOKOF-UHFFFAOYSA-N	439.520	1.346	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)N[C@H](c1ccc(C(C)(C)C)cc1)C(F)(F)F	775953849	BBWZTOOTPNXDTE-ZWNOBZJWSA-N	438.472	1.856	50	20	IDGD	
COc1ccc(SC)c(OC)c1C(=O)OCC(=O)NNC(=O)c1cccc(C#N)c1	775965292	ZLXISXOIFXQAJY-UHFFFAOYSA-N	429.454	1.915	50	20	IDGD	
Cc1c(NC(=O)NNc2cccc(S(C)(=O)=O)c2)cccc1S(=O)(=O)NC1CC1	776472407	JTTJTQKAFQSREV-UHFFFAOYSA-N	438.531	1.988	50	20	IDGD	
COc1ccc(N2CCN(CCNC(=O)NNc3cccc(S(C)(=O)=O)c3)CC2)cc1	776618950	LHCVLPVMKWRPPY-UHFFFAOYSA-N	447.561	1.547	50	20	IDGD	
O=C(OCc1ccccc1)N1CC[C@](F)(C(=O)NNc2nccc(N3CCOCC3)n2)C1	777522685	BKWBZZWMCLSWKT-OAQYLSRUSA-N	444.467	1.507	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)N[C@@H]1CCN(c2ccc(F)c(Cl)c2)C1	778589769	UUSVPSOIKRBXKF-CYBMUJFWSA-N	444.858	1.678	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)Nc1ccc(F)c(S(=O)(=O)NC2CC2)c1	779090614	KDZOZQIWXPXRLZ-UHFFFAOYSA-N	438.437	1.204	50	20	IDGD	
COc1ccc(Cn2nccc2NC(=O)NNC(=O)c2ccccn2)c(OC)c1OC	779461271	HRZXFSJZCPKCPC-UHFFFAOYSA-N	426.433	1.819	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)NCc2nnc(C)s2)c2ccccc2c1=O	780903930	VXRVTVLHPYZCSN-UHFFFAOYSA-N	429.506	1.891	50	20	IDGD	
O=C(NNc1nc2ccccc2s1)C(=O)Nc1ccc(S(=O)(=O)NC2CC2)cc1	782813156	ZJHSZKDBAVWAHW-UHFFFAOYSA-N	431.499	1.819	50	20	IDGD	
Cc1cc(C)c(NC(=O)C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)c(C)c1	782898049	XXHLKMLZDQMUDU-UHFFFAOYSA-N	431.518	1.613	50	20	IDGD	
NC(=O)c1n[nH]c2ccc(NC(=O)C(=O)NNc3ccc(Br)cc3F)cc12	783085645	KJZVFQDTCCKTAA-UHFFFAOYSA-N	435.213	1.645	50	20	IDGD	
CCOc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NNC(=O)Nc1ccccc1C	783415976	MZZLBWUKSLNUDS-UHFFFAOYSA-N	427.461	1.887	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2cccc(-c3ccc4c(c3)CCO4)c2)CCS(=O)(=O)C1	783425010	HFYHWVQLFVQOKX-NRFANRHFSA-N	429.498	1.425	50	20	IDGD	
COc1cc(C)ccc1Oc1ccc(NC(=O)C(=O)NN[C@]2(C)CCS(=O)(=O)C2)cn1	783426040	LJTAGBABRXNMKL-HXUWFJFHSA-N	448.501	1.327	50	20	IDGD	
CC1CCN(Cc2ccc(NC(=O)C(=O)NNc3ccc(-n4cccn4)nn3)cc2)CC1	783436666	MDLKWQHTPNURKE-UHFFFAOYSA-N	434.504	1.976	50	20	IDGD	
O=C(NNC(=O)C(=O)N1CCCC1)C(=O)Nc1ccc(N2CCc3sccc3C2)cc1	783996111	CKENLWCXTMPCKP-UHFFFAOYSA-N	441.513	1.019	50	20	IDGD	
COCC(=O)N1CCc2cc(NC(=O)C(=O)NNc3ccc(OC(F)F)cc3)ccc21	784309948	UJZGYQYBHUIEQN-UHFFFAOYSA-N	434.399	1.905	50	20	IDGD	
CSc1nnnn1-c1cccc(NC(=O)C(=O)NNc2ccc(Br)nc2)c1	784808892	HBUROGJPJAGKGQ-UHFFFAOYSA-N	449.294	1.624	50	20	IDGD	
O=C1CCc2cc(NC(=O)C(=O)NNc3c(F)cc(C(=O)NC4CC4)cc3F)ccc2N1	785099306	DOHCXZNBWMUPDH-UHFFFAOYSA-N	443.410	1.824	50	20	IDGD	
CNS(=O)(=O)CCNC(=O)C(=O)Nc1ccccc1S[C@@H](Cl)C(F)(F)F	786002653	JLHRITOYJJNNHP-GFCCVEGCSA-N	433.861	1.510	50	20	IDGD	
Cn1cc(-c2ncccc2NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cn1	786210099	RFZMFOXKKFQNPZ-UHFFFAOYSA-N	448.531	1.847	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)cc1N1CCNC1=O	787544078	OGUZTJVFONJWSV-ZDUSSCGKSA-N	443.435	1.217	50	20	IDGD	
O=C(CN1CCC(c2ncc3n2CCCC3)CC1)NNC(=O)c1cccc([N+](=O)[O-])c1	789356142	GKHXFFGYZKSXAL-UHFFFAOYSA-N	426.477	1.768	50	20	IDGD	
C[C@H]1CCC2=S=C(C(=O)NNC(=O)C(=O)Nc3cc([C@H]4CCCO4)nn3C)C=C2C1	789731422	HEXDWIGUHVQBTE-SMDDNHRTSA-N	431.518	1.196	50	20	IDGD	
COC(=O)c1cc(Cl)cc(S(=O)(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c1OC	790050381	PVBAJEOMPLGAAB-UHFFFAOYSA-N	443.821	1.667	50	20	IDGD	
COc1ccc(NNC(=O)NCC(=O)Nc2ccc(I)cc2)nc1	790889627	JVWYCCMETCSPBN-UHFFFAOYSA-N	441.229	1.960	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)C2CC2)c(Br)cc1Br	792266977	CIQBOMSFNFRLCQ-UHFFFAOYSA-N	435.072	1.716	50	20	IDGD	
CN(C)N(C(=O)C1CCN(c2ccc3cccc(O)c3n2)CC1)[C@@H]1CCS(=O)(=O)C1	792853213	CLOOVPFENMTDTF-QGZVFWFLSA-N	432.546	1.649	50	20	IDGD	
CCNC(=O)N1CCc2ccc(NC(=O)C(=O)NNc3ccc4c(=O)[nH]ccc4c3)cc21	793065435	MVPUVCJXRMVMNY-UHFFFAOYSA-N	434.456	1.702	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)[C@H]3COCCN3C3CCCC3)n[nH]2)cc1OC	793749384	KPJBJDJAIMFRPG-GOSISDBHSA-N	443.504	1.498	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc2ccccc2c1)NNC(=O)c1ccc2c(c1)OCCO2	794415473	UZKIEFRSVRQYLK-UHFFFAOYSA-N	441.465	1.351	50	20	IDGD	
C[C@@H](Oc1ccc(C=O)cc1)C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	796835894	DXMGMOOGGSBHIN-OAHLLOKOSA-N	433.486	1.431	50	20	IDGD	
O=C(NNC(=O)C(=O)NC1CC1)C(=O)Nc1ccc(-c2csc(C(F)(F)F)n2)cc1	797036056	OYXGXVSBLJJZTH-UHFFFAOYSA-N	441.391	1.193	50	20	IDGD	
Cc1ccc([C@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)cc1	797703444	WPCIEKUMBMEEHR-GJZGRUSLSA-N	425.507	1.143	50	20	IDGD	
COC(=O)CN(CCN1CCN(C)CC1)C(=O)/C(C#N)=C\c1cc(C)n(CC(C)C)c1C	798555867	TXWJOFZZJNVNSV-HMAPJEAMSA-N	443.592	1.917	50	20	IDGD	
O=C(CCCCC(=O)NN=C1CC(=O)N2CCCC[C@@H]12)NN=C1CC(=O)N2CCCC[C@@H]12	799467260	IZVCVYKXRTWCIT-ROUUACIJSA-N	444.536	1.061	50	20	IDGD	
COc1cccc(NC(=O)COc2ccc(C(=O)NNC(=O)N=c3cc[nH]cc3)cc2)c1	802034546	RFAPJAZQPAVCOY-UHFFFAOYSA-N	435.440	1.996	50	20	IDGD	
O=C1C[C@H](Cc2ccc(C(=O)NNC(=O)Nc3ccc(OC(F)F)cc3)cc2)C(=O)N1	802044931	GZHMCDJLIUFADT-ZDUSSCGKSA-N	432.383	1.960	50	20	IDGD	
CN(C[C@H]1CCCN(C(=O)NNC(=O)c2c(Cl)cccc2Cl)C1)S(C)(=O)=O	805061501	JTVLUEXPBCOEEI-LLVKDONJSA-N	437.349	1.951	50	20	IDGD	
Cn1cnc2c(C(=O)NNC(=O)CN3CCN(Cc4ccc(Cl)cc4)CC3)ccnc21	805191547	JRBMATJSXMHBIH-UHFFFAOYSA-N	441.923	1.201	50	20	IDGD	
CCc1nnc(NC(=O)[C@@H](C)[C@H](C)NC(=O)NNC(=O)Cc2ccccc2OC)s1	805881117	VKPVOEAFTVRNSM-RYUDHWBXSA-N	434.522	1.645	50	20	IDGD	
COC(=O)c1c(C)csc1NC(=O)C(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	806975832	QEHBEIRQEIAFNN-UHFFFAOYSA-N	443.441	1.134	50	20	IDGD	
COc1ccc2cc(NC(=O)C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)ccc2c1	806975947	WDMLMNAOCNUEDV-UHFFFAOYSA-N	431.412	1.224	50	20	IDGD	
CCN(C)C(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2OC)c1	806976352	BCFGHVZSSMAIBV-UHFFFAOYSA-N	432.864	1.840	50	20	IDGD	
N#Cc1ccc(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)cc1Br	807019861	MQLJIJWXBKCDRW-UHFFFAOYSA-N	441.245	1.297	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNS(=O)(=O)c2cnc(NC(C)=O)s2)cc1	808070214	QXFSTQDDGSNFLB-SNVBAGLBSA-N	428.492	1.277	50	20	IDGD	
C#CC[C@@]1(C(=O)NNC(=O)Cc2cn3ccccc3n2)CCCN1C(=O)OC(C)(C)C	809705332	SOAZYBYPLOGNNB-QFIPXVFZSA-N	425.489	1.817	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)C(=O)Nc1ccc(C(N)=O)cc1OCC(F)F)c1ccccc1	810387328	QKKMRIHRJKAHKY-CQSZACIVSA-N	448.426	1.709	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)CNC(=O)c2ccccc2C(F)(F)F)cc1	812728578	PVRIYMLVSVTZNS-UHFFFAOYSA-N	444.435	1.829	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccc3c(c2)CC(C)(C)O3)cc1	813033390	QYTINBBELAASQT-UHFFFAOYSA-N	432.502	1.732	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCc2nncn2C1)C(=O)Nc1ccc(Cl)cc1C(F)(F)F	815692079	ISLKXQHNNGFKGA-QMMMGPOBSA-N	430.774	1.299	50	20	IDGD	
CC(=O)N1CCN(c2ccc(C(=O)NNc3nc4ccccc4n3C)cc2[N+](=O)[O-])CC1	816577228	BXGNMHBSJBBJIE-UHFFFAOYSA-N	437.460	1.907	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)C2(S(C)(=O)=O)CCOCC2)c(OC)cc1Cl	816597007	AACPZZXQKNLWAA-UHFFFAOYSA-N	435.886	1.104	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)CNC(=O)CC23CC4CC(CC(C4)C2)C3)c1	825805738	OMTXUSHSRXCEOV-UHFFFAOYSA-N	428.533	1.977	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(Br)c(C(=O)N2CC[C@@H](B(O)O)C2)c1	864233525	IMEHDVVYBNTXCV-LLVKDONJSA-N	433.133	1.169	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)CN1C(=O)N[C@@]2(CCCC[C@@H]2C)C1=O	915775824	PHMJQUQLOLXUIW-RCDICMHDSA-N	440.504	1.247	50	20	IDGD	
Cc1ccc2nc(SCC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)n(C)c(=O)c2c1	915795244	FCTIEOVOXFLIFQ-UHFFFAOYSA-N	427.442	1.703	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)CCS(=O)(=O)C1CCCC1	915804968	TVDADXWPTCWCEV-UHFFFAOYSA-N	436.578	1.094	50	20	IDGD	
CN1CCN([C@@H](CNC(=O)NNC(=O)c2ccc3c(c2)OCCO3)c2cccs2)CC1	915901690	KWKGNAKWIDSHNW-INIZCTEOSA-N	445.545	1.452	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCCCN(C)c2ccccc2)cc1	915902022	QMTHRAUKOIHMPP-UHFFFAOYSA-N	447.561	1.472	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)NCc2ccccc2S(=O)(=O)N2CCCCC2)n1	916241241	ORBCQEARTOPCSB-UHFFFAOYSA-N	448.549	1.205	50	20	IDGD	
CC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)C(=O)Nc1ccc(C)c(C)c1	916561621	AFMVANVSYWOPCU-HXUWFJFHSA-N	435.484	1.618	50	20	IDGD	
CC[C@H](NC(=O)NNc1ccc(-n2cccn2)nn1)c1ccccc1OCC(=O)N(C)C	918222127	ADHVSNGQPUWNRV-INIZCTEOSA-N	438.492	1.907	50	20	IDGD	
Cc1ccc(N2CCC(C(=O)NNC(=O)c3sc(N4CCOCC4)nc3C)CC2)nc1	919809730	CEOCXSNPRLOTKT-UHFFFAOYSA-N	444.561	1.669	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)CNS(=O)(=O)c2ccccc2C(F)(F)F)c1	920240147	ZCMPTOVXJWHHIB-UHFFFAOYSA-N	444.435	1.511	50	20	IDGD	
Cc1cccnc1NC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	920273438	HLKOUDCFLNLQTA-UHFFFAOYSA-N	447.517	1.196	50	20	IDGD	
CC(=O)N/C(=C\c1ccccc1)C(=O)NNC(=O)[C@H]1CCCN(C(=O)OC(C)(C)C)C1	920435492	HOBLSSDOQUQGQZ-XIDKLXSXSA-N	430.505	1.958	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)c1ccc(N2CCOCC2)cc1	920921833	VCZABVLDMVZYEV-OAHLLOKOSA-N	436.476	1.204	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)Nc1cccc(CN2C(=O)CNC2=O)c1	920933561	WMAQRRHWCBHHOQ-GFCCVEGCSA-N	429.408	1.498	50	20	IDGD	
N#C/C(=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)NCCN1CCC1	1116362692	WTUWQDBHVJPDTO-FOWTUZBSSA-N	426.908	1.808	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)NCC(=O)NNc2cncc(Br)c2)cc1	1116397543	RNPNBFYNRWJNGH-UHFFFAOYSA-N	427.280	1.468	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(OC[C@@H]2CCOC2)c(F)c1)c1n[nH]c2c1CCCC2	1116610592	XFMJWKJLFHZPDL-GFCCVEGCSA-N	438.481	1.466	50	20	IDGD	
Cc1ccc2c(c1)S[C@@H](C(=O)OCC(=O)NNC(=O)[C@H]1COc3ccccc3O1)C2	1317766415	SPXHTNIYVFQBOM-SJLPKXTDSA-N	428.466	1.542	50	20	IDGD	
O=C(c1cn2cc(F)ccc2n1)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1778545479	PNZWPINODIOWAR-YOEHRIQHSA-N	443.248	1.607	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)C[C@H]3CNc4ccccc4O3)C2)C1	1778934885	XGCHUWIFTYRKGP-QYWGDWMGSA-N	437.924	1.333	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)COC(=O)C(F)(F)F)C1	1779274833	GBUHLPMQHOSVLN-SJKOYZFVSA-N	442.862	1.871	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H]1ON=C(c3ccccc3)O1)CCO2	1779296851	IFILVRZJDJRJLF-NHCUHLMSSA-N	447.564	1.403	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(Cl)Cl)C2)[C@H]1CC[C@@H]2CCC(=O)N2C1	1780613029	UBKIZFUJSSSKQK-LYKCQVCGSA-N	446.375	1.705	50	20	IDGD	
CC[C@@H](NC(C)=O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@](C)(Cl)CCl)C1	1780706234	UEELFENGFWUFMF-VVWQDTPRSA-N	436.380	1.651	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(=O)n1O)C2	1780710295	NBMSOYKKFWRBPP-NIKGAXFTSA-N	446.331	1.449	50	20	IDGD	
CN1CCCC[C@H]1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Br)C1	1780770421	NCRYGZDCGHCRES-LUXYFRNMSA-N	434.350	1.675	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(=O)oc1)C2)[C@H](F)Br	1780771983	YDCQMHDKNMAHQX-HACGYAERSA-N	431.258	1.458	50	20	IDGD	
Cc1nnsc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Br)C1	1780773907	ZEQMVHQGLHBHFN-IFUGULHKSA-N	435.319	1.665	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)C1(NC(=O)OC(C)(C)C)CC1)CCO2	1781225713	OOGHMKWBVOJGFF-LIRRHRJNSA-N	429.945	1.891	50	20	IDGD	
CN(C)c1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](F)Br)C3)C2)cn1	1781331664	OMJOKPZRHBGGFX-WMLDXEAASA-N	429.290	1.282	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@H]1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Cl)C2	1782160684	QMEIZWMXXITDJU-PEJGYKSESA-N	430.904	1.790	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)n2cc(C)cn2)C1	1782515097	DNJLFXIEZFKKMP-AXVVYFOYSA-N	426.945	1.520	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3n[nH]c4c3CCCC4)CCO2)C1	1783347781	OSXDGQKVJKMAJH-IFXJQAMLSA-N	439.354	1.906	50	20	IDGD	
COc1ccc([C@H](O)C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](C)Br)C3)C2)cc1	1783527802	GMQXISQTCSBRAW-AXHNFQJDSA-N	441.322	1.342	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cnn(C)c3C(F)(F)F)CCO2)C1	1783873310	NTUSDEJSDDBSEG-BLLLJJGKSA-N	438.834	1.136	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc4c(c3)CCCC4=O)CCO2)C1	1783874071	CHOYFZQGHQYVJV-XMSQKQJNSA-N	434.920	1.903	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3csc(C(F)(F)F)n3)CCO2)C1	1783877938	SEAFCSPUMPQQEG-BMIGLBTASA-N	441.859	1.859	50	20	IDGD	
C[C@H](C(=O)N1CCO[C@@]2(CCN(C(=O)C(Cl)Cl)C2)C1)N1CSCSC1	1783945663	AVBCZRPRONBMQP-IAQYHMDHSA-N	428.407	1.663	50	20	IDGD	
O=C(COc1ccccc1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21	1786484834	ALRUNOXSORRHBT-QEWYBTABSA-N	429.286	1.736	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)[C@H]1Cc2ccccc2O1	1788184484	AQQCKSLYVKOGCD-HNWLLIRGSA-N	441.297	1.660	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4cccnc4n3)[C@H]2C1	1788287289	RJPXWMBLWSRZFV-OVWQWFNUSA-N	432.908	1.477	50	20	IDGD	
COc1nc(C)ccc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21	1789018297	PRFRENHVTPBPMS-MXAVVETBSA-N	444.301	1.682	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(OC)cc3O)[C@H]2C1	1789483409	ZPLJXBKVSHENAK-RPZXMPESSA-N	426.897	1.248	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)ON=C(C)C)C[C@@H]21	1790963309	RHLUKPBDVYXXDS-YXMSTPNBSA-N	432.359	1.941	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3CCN(CC)CC3)[C@H]2C1	1792297256	QSUGZFBDVGBHNB-XSLAGTTESA-N	444.414	1.872	50	20	IDGD	
CC(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)C2	1792613748	QAUUFIAWVNMRSB-IBMUYAKESA-N	433.455	1.886	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)CBr	1792872080	LMKCRVBLOUTSLK-WJTVCTBASA-N	440.176	1.781	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccnc3c1OCO3)C2	1792872691	WQRRPDPVNLFZGQ-FMSGJZPZSA-N	440.294	1.045	50	20	IDGD	
O=C(Cc1ccc2c(c1)OCO2)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2	1795310328	CUJAILYYYHXBRU-HBCWATKFSA-N	439.306	1.332	50	20	IDGD	
C[C@@H](Nc1nccs1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2	1796414728	DTXSFBIZWVPQAW-ZIQFBCGOSA-N	435.319	1.224	50	20	IDGD	
C[C@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCBr)C2)[C@H]1SC(=N)NC1=O	1796873453	IDRISUISCIAANX-XPORZQOISA-N	431.356	1.212	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1c(F)cccc1Cl	1798808699	HUPIRWBBCUBZOQ-DBWKPXFBSA-N	440.903	1.055	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2)c1cc(Br)ccc1O	1798837416	FEOUXFZAYBYBLU-HZZFPTLFSA-N	435.677	1.892	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccccc1C(N)=O)C2	1799277147	UMSIDWCRIBFXPP-RHQBZFHZSA-N	428.316	1.225	50	20	IDGD	
N#Cc1cc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Br)C3)ccc1F	1799326019	FPBSSWGGQNECBD-RMHZUWNSSA-N	442.260	1.520	50	20	IDGD	
Cc1cc(NC(=O)CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](F)Br)no1	1800159000	KHXRLLHNVQESCQ-JNIYBQFBSA-N	431.262	1.640	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(Cl)c3nncn3c1)C2	1802279947	DBBHTIXFTLLGIZ-QVHKTLOISA-N	426.304	1.888	50	20	IDGD	
Cc1cccc2c(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)CCC(=O)NN(C)C)n[nH]c12	1802338657	XKBKYHXBWZGYPK-MUJYYYPQSA-N	426.521	1.496	50	20	IDGD	
C[C@@H](Sc1ccccn1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(B(O)O)cc1)C2	1802889748	NFCUJAQWVFHLQM-DQEVTTJGSA-N	439.346	1.194	50	20	IDGD	
COc1ccc(OCC(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)cc1	1803136267	AUPINSOAZROFIK-LKUPVBHCSA-N	447.919	1.775	50	20	IDGD	
N#Cc1ccccc1OCC(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]1c1cccnc1	1803147264	FGWGQIYCEYYXRS-DBXWQHBBSA-N	442.903	1.638	50	20	IDGD	
COc1ccccc1CC(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]1c1cccnc1	1803148228	PJUDCZLOMKFQKS-LVCYWYKZSA-N	431.920	1.938	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)C(OC)OC)[C@@H]1c1cccnc1	1803357710	XGPVIYQDMQUYMV-KKUMJFAQSA-N	428.327	1.880	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@@H](CNC(=O)c2cc(O)ncn2)[C@H]1c1cccnc1	1803736758	JZFTVPBTKWGRBT-HACGYAERSA-N	448.321	1.928	50	20	IDGD	
N[C@H](C(=O)N1CC[C@H](CNC(=O)CCBr)[C@@H]1c1cccnc1)c1ccccn1	1806341167	ZIZUVDQUKGEYKQ-MNEFBYGVSA-N	446.349	1.967	50	20	IDGD	
N=C(N)SCCC(=O)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@H]1c1cccnc1	1807128786	GWDBHNDOLAFKRE-UBHSHLNASA-N	446.346	1.795	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)c[nH]1	1807360811	CUBZSBJNNVMJEJ-RXVVDRJESA-N	432.289	1.031	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)c1cccc2c1OCCO2	1809232365	DKZWXZGLJVYNPM-VDZJLULYSA-N	445.903	1.772	50	20	IDGD	
O=C(O)c1cnncc1C(=O)NC[C@@H]1CCN(C(=O)C(Cl)Cl)[C@H]1c1cccnc1	1810804778	UZMKOMRUECFQDE-FZMZJTMJSA-N	438.271	1.693	50	20	IDGD	
CC(=O)NCCC(=O)NC[C@@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1	1812656595	QJDFYIUAJKTXKJ-YJBOKZPZSA-N	425.327	1.399	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)CN2CCSCC2)[C@H]1c1cccnc1	1813027885	HTCNDFCMKJKJCM-LNLFQRSKSA-N	440.997	1.390	50	20	IDGD	
Cc1ccc(CC(=O)N2CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)o1	1813072462	CEPHFLBTPCJXRO-FDDCHVKYSA-N	441.532	1.605	50	20	IDGD	
Cc1cccc(CC(=O)Nc2cc([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)n1	1814974668	QYZMDWZOAKPKDX-GOSISDBHSA-N	441.536	1.721	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@H]1CC=CCC1)CC2)c1ccc(B(O)O)cc1	1815343706	KFEUQAFXKYTXJO-BBRMVZONSA-N	425.319	1.405	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)C2CCOCC2)n[nH]1	1817013314	NNWZMPYYJWWDLN-KRWDZBQOSA-N	441.492	1.141	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3nc[nH]c3[N+](=O)[O-])sc2C1	1817205945	WFPWKXMLAKCGDQ-JGVFFNPUSA-N	428.858	1.254	50	20	IDGD	
CCc1ncccc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1	1817473375	PUIQYMKMGUKMTJ-HXUWFJFHSA-N	447.304	1.667	50	20	IDGD	
Cc1cc(C)n2ncc(C(=O)Nc3nc4c(s3)C[C@@H](NC(=O)[C@H](O)CCl)CC4)c2n1	1818237281	WKRICVKYDHRVQF-SMDDNHRTSA-N	448.936	1.628	50	20	IDGD	
CC[C@@H](Br)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](N)CCC(N)=O)[nH]n1	1822087663	MVNLYUKEJRXSMR-NTZNESFSSA-N	443.346	1.168	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CN2C(=O)C=CC2=O)n[nH]1	1822530735	ZCQLXZQLEOOPLU-XIKOKIGWSA-N	442.303	1.563	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](O)c2ccco2)CC1	1823772868	AUQPBHSALYWJDI-UWJYYQICSA-N	434.537	1.306	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)on1	1825966381	PBUICKLMJIAUTA-SFHVURJKSA-N	440.504	1.529	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CN1CCSCC1)CC2	1825991449	KSFFRRZCQLUNIS-NWDGAFQWSA-N	432.999	1.358	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1nc3ccccn3n1)CC2	1825998858	NJOKJPSINKGZMC-QWRGUYRKSA-N	434.909	1.665	50	20	IDGD	
Cc1nc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)cs1	1826123222	SKOPXHQJSGTZJS-HXUWFJFHSA-N	441.362	1.678	50	20	IDGD	
Cc1cc(CC(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)on1	1827055766	DZSUCKNTNBQSPG-NRFANRHFSA-N	439.321	1.139	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1	1829102331	PBHGHLJHCHFGPA-FQEVSTJZSA-N	446.429	1.451	50	20	IDGD	
Cc1cnoc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1	1829550208	CCMNWRYVYOCCRO-GOSISDBHSA-N	440.504	1.529	50	20	IDGD	
CCOc1cnc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)cn1	1830358929	SBHUBVFTBWZIGG-HXUWFJFHSA-N	440.928	1.210	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnn4ccccc34)C2)C1	1830362248	OXEPTGWNVZNUEE-OAQYLSRUSA-N	434.924	1.669	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccn(CCOC)n3)C2)C1	1831647875	ZTYFFZQZOVRQSW-OXJNMPFZSA-N	442.944	1.007	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)C[C@H]2CCCCO2)CC1	1831871663	WAOMKGBDJDENHV-UXHICEINSA-N	436.597	1.938	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@H]2CCOC2)CC1	1832376552	KHACKFHMCXMAEO-BAGDKLQBSA-N	443.548	1.777	50	20	IDGD	
COc1ccc([C@@H](O)C(=O)NC2CCN(C3CCN(C(=O)[C@H](F)Cl)CC3)CC2)cc1	1833184413	QEHLVACVAIPSPD-MOPGFXCFSA-N	441.931	1.835	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cc[nH]c4nccc3-4)CC2)CC1)[C@@H](O)CCl	1833310168	APWZXNFDVOBTLR-SFHVURJKSA-N	433.940	1.299	50	20	IDGD	
CCC(=O)N[C@H](C)C(=O)NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1	1833422094	VEOLPZNEYLGWGH-CQSZACIVSA-N	445.402	1.258	50	20	IDGD	
COc1ncc(C(=O)N2CCO[C@@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)cc1F	1833487290	GBTCRFXAFOIXSH-KRWDZBQOSA-N	436.267	1.103	50	20	IDGD	
O=C(c1ccc(OC(F)F)cn1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1833638896	HUUJFTYULGBTQX-SUMWQHHRSA-N	437.802	1.287	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccnc(Cl)c3)CCO2)C1	1834185608	KEZXCAUYKAKRKM-SJKOYZFVSA-N	446.729	1.588	50	20	IDGD	
CCn1nccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)CBr)C2)C1	1834411170	HQHBIXSAEXONBK-KBXCAEBGSA-N	443.342	1.004	50	20	IDGD	
O=C(CCBr)NC1CCN(C2CCN(C(=O)c3cc(O)n[nH]3)CC2)CC1	1834421878	RETCCDSGFYHZEJ-UHFFFAOYSA-N	428.331	1.086	50	20	IDGD	
C[C@H](C(=O)N1CCOC[C@@]2(CN(C(=O)CCBr)CCO2)C1)n1cccc1	1834826833	YDGIGTZXASTIFK-CRAIPNDOSA-N	428.327	1.291	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CSc3ccccc3)CCO2)C1	1835094263	OLAKENPGJFTWOK-PXNSSMCTSA-N	442.965	1.489	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)C(Cl)Cl)CC2)CC1)c1cnc2[nH]ncc2c1	1835526480	IAOUYCQXQFTCRR-UHFFFAOYSA-N	439.347	1.947	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](F)Cl)CC2)CC1)c1cc2n(n1)CCCO2	1835569454	RENFOTNIRUZTLT-KRWDZBQOSA-N	427.908	1.385	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCC(N2CCC(NC(=O)c3cc(O)no3)CC2)CC1	1835976342	VXIVNGWDLDBCLJ-GOSISDBHSA-N	433.336	1.802	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnccc3F)CCO2)C1	1836319797	ZPKVWYKIGVXURC-KDOFPFPSSA-N	444.301	1.464	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)C[C@@](C)(O)CC(=O)O)CC2)CC1	1836397317	DIRFOQOVGBAKFD-OXQOHEQNSA-N	431.961	1.191	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC1CCN(C2CCN(C(=O)[C@@H]3CCC(=O)N3)CC2)CC1	1836398454	KOGVDBOEAKDMLW-KXBFYZLASA-N	433.380	1.073	50	20	IDGD	
O=C(c1csc2c1CCCC2)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1	1836896341	ZXUNXHNQERUGSS-OXJNMPFZSA-N	442.965	1.297	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1c[nH]c3cnccc13)CCO2	1837176616	UWSHEQGUPHIPFJ-OAQYLSRUSA-N	446.580	1.484	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](C)N(C)C(C)=O)CC2)CC1	1838106567	AFGBEGDKSVVGOT-RDTXWAMCSA-N	431.961	1.106	50	20	IDGD	
O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(O)cc1)CCO2	1838969495	KKRFBMZUILKEMS-SFHVURJKSA-N	427.295	1.247	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(OC)cc3C)CCO2)C1	1839026380	WETZQVQBBWKXCA-RXVVDRJESA-N	440.924	1.327	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnn(-c4cccnc4)c3)C2)C1	1839143097	LEVNMALOTCXUPX-WIYYLYMNSA-N	447.923	1.355	50	20	IDGD	
C/C=C/C(=O)N1CCO[C@@]2(COCCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1	1839816360	YJYDBOZWVCALKX-JZUVUIKZSA-N	431.439	1.904	50	20	IDGD	
Cc1ncsc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)Br)CCO2	1840030995	BXSYUUOWFVWKHJ-MEDUHNTESA-N	432.340	1.305	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C)cc(Cl)c3)C2)C1	1840155875	FRJNPQNFIRIGCO-FXAWDEMLSA-N	445.343	1.972	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)COc3ccccc3C#N)CCO2)C1	1840820363	LXGHKIQPLDXUNS-DYESRHJHSA-N	435.908	1.411	50	20	IDGD	
Cn1c(C(=O)N2CCCC23CN(C(=O)[C@@H](O)CCl)C3)cc2c1-c1ncccc1OC2	1843134183	JBZCEFDHPZYCJA-HNNXBMFYSA-N	430.892	1.396	50	20	IDGD	
C=C[C@H](O)C(C)(C)C(=O)N1CCCC12CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1844235402	ACUNBSWTYJHDMG-GJZGRUSLSA-N	443.972	1.895	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)c1ccc(O)nn1)C2	1844692183	QYDFKAQUKFTNPK-UHFFFAOYSA-N	441.400	1.147	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC12CN(C(=O)[C@@H](O)CNC(=O)OC(C)(C)C)C2	1846068679	HPDSAUKVRRNJAQ-STQMWFEESA-N	448.358	1.249	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC2(CCCN2C(=O)[C@H]2C[C@@]23C(=O)Nc2ccccc23)C1	1846153296	LXQQKEJNEROOJN-ZHRRBRCNSA-N	427.577	1.951	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)C[C@@H](NC(=O)OC(C)(C)C)C(=O)OC)C1	1846304801	BMRPYUCXABZODY-ZIAGYGMSSA-N	445.944	1.664	50	20	IDGD	
C[C@@H](C(=O)N1CCCC12CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)n1cccn1	1846616794	LKLRVAHAAZDZKQ-GJZGRUSLSA-N	439.944	1.780	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)(C)O)C1	1847091813	XNHDOLSXNYGDAW-ZIAGYGMSSA-N	431.961	1.871	50	20	IDGD	
COc1ccccc1-n1cnnc1SCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	20891427	ZLXGOLLOQZVQEI-UHFFFAOYSA-N	428.430	1.737	50	20	IDGD	
COc1ccc(N2C[C@H](C(=O)NNC(=O)Cc3c[nH]c4ccccc34)CC2=O)c(OC)c1	26536504	DIUTWVWMJKQILU-OAHLLOKOSA-N	436.468	1.928	50	20	IDGD	
O=C(NNC(=O)c1c[nH]c2ccccc2c1=O)c1cccc(S(=O)(=O)N2CCCC2)c1	32605231	DGPAXWVNZBNNMF-UHFFFAOYSA-N	440.481	1.387	50	20	IDGD	
CN1C(=C(C#N)C(=O)COC(=O)CNS(=O)(=O)c2cccs2)N(C)c2ccccc21	36753592	LOJMDMMHADXHPC-UHFFFAOYSA-N	446.510	1.460	50	20	IDGD	
Cc1ccc(S(=O)(=O)NNC(=O)c2ccc(Cl)cc2O)c(C)c1OCC(=O)O	726155217	IWYMNTNUZMKZPK-UHFFFAOYSA-N	428.850	1.749	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NC2CCC(NC(C)=O)CC2)c2ccccc2c1=O	726276788	ZUKWYOMTMPZDHW-UHFFFAOYSA-N	442.520	1.588	50	20	IDGD	
CCn1c(NNC(=O)[C@H]2CC(=O)N(Cc3ccc(OC)cc3)C2)nc2ccccc2c1=O	726524512	JQPUFMFRSHZFAQ-INIZCTEOSA-N	435.484	1.917	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)NCCCN2CCC[C@@H]2C(=O)N(C)C)c1C	728072885	LCSGISNGKJHYGI-WOHXKIKESA-N	429.565	1.717	50	20	IDGD	
CN(C)C(=O)c1ccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc1	728187414	IDEDVOQLUJZCQN-UHFFFAOYSA-N	444.513	1.248	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3ccc4c(c3)OCCCO4)cc2)CC1	728213040	BZOBKALQFHPLQT-UHFFFAOYSA-N	446.529	1.541	50	20	IDGD	
C[C@@H]1CCCN(S(=O)(=O)c2ccc(CNC(=O)NNC(=O)Cc3cccnc3)cc2)C1	728946047	WTWCABABTVWQBG-MRXNPFEDSA-N	445.545	1.575	50	20	IDGD	
C[C@H]1CN(C(=O)c2ccc(CNC(=O)NNC(=O)Cc3cccnc3)cc2)C[C@H](C)O1	728958254	YXLSTMMNESXEDC-HOTGVXAUSA-N	425.489	1.404	50	20	IDGD	
Cc1ncsc1C(=O)NNC(=O)CC[C@H](C)CC(=O)NNC(=O)c1scnc1C	729662576	VUPJVAGZGIRTIR-VIFPVBQESA-N	438.535	1.245	50	20	IDGD	
CS(=O)(=O)N(c1cccc(C(=O)/C=C\c2cnn(CCCl)c2)c1)S(C)(=O)=O	729824124	XNAGDYITVGJMGJ-SREVYHEPSA-N	431.923	1.744	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2ccc(C)c(OCC(=O)O)c2C)c(OC)c1	729964145	WPVQPBAAESPKKN-UHFFFAOYSA-N	438.458	1.407	50	20	IDGD	
CC(=O)N1Cc2ccccc2C[C@H]1C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	730076959	FJXCAHOVHKMKPK-FQEVSTJZSA-N	428.514	1.544	50	20	IDGD	
CC(=O)N1CCc2ccc(S(=O)(=O)NNC(=O)c3nnc(-c4ccccc4)o3)cc21	734415931	FWSIQHLPSGOKCW-UHFFFAOYSA-N	427.442	1.269	50	20	IDGD	
C[C@@H]1Cc2cc(S(=O)(=O)NNC(=O)CNC(=O)c3cccs3)cc(Cl)c2O1	736062748	IGIUCWGDOMOYFI-SECBINFHSA-N	429.907	1.464	50	20	IDGD	
C[C@H]1[C@@H](C)N(C(=O)CCC(=O)C(C#N)=C2N(C)c3ccccc3N2C)CCS1(=O)=O	736269789	GSMRTVBKZONAFN-CABCVRRESA-N	430.530	1.691	50	20	IDGD	
O=C(COC(=O)c1cc(O)nc2ccc(F)cc12)NNC(=O)[C@@H]1COc2ccccc2O1	738822019	MMDIBLXTOPMMFZ-KRWDZBQOSA-N	441.371	1.224	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCCCCN2CCCCC2)c1	739040358	ZUUPPIAFBNJXTE-UHFFFAOYSA-N	439.582	1.537	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)N[C@H](Cn1cccn1)c1ccccc1	741280490	YXHQMONQJFGFIZ-LJQANCHMSA-N	434.504	1.661	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)CCN2C(=O)[C@@H]3[C@H]4CC[C@@H](O4)[C@@H]3C2=O)c1	742470966	YPPMQCYKWMNLBV-NBJYBMASSA-N	443.500	1.197	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)C(C)(C)NC(=O)OC(C)(C)C	743252796	RFIHVOQXRPLTAH-UHFFFAOYSA-N	443.884	1.956	50	20	IDGD	
COc1cccc(O[C@H](C)CNC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)c1	743674353	VOHQHVFELQEUEJ-CYBMUJFWSA-N	436.490	1.902	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)CCC(=O)c2ccc3c(c2)OCCO3)cc1	743830483	GACVUUGKSGGJSG-UHFFFAOYSA-N	447.469	1.677	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)OCC(=O)NNC(=O)c2cccc(C)c2)c1C	744457596	RBVZRJUXZDSTPU-UDWIEESQSA-N	438.484	1.971	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)CNC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c1	744564399	LBCCEAXQUMQYSN-UHFFFAOYSA-N	448.819	1.291	50	20	IDGD	
O=C(CSCC(=O)c1ccccc1)NNc1ccccc1S(=O)(=O)N1CCOCC1	744620170	GLAVUXHHGFAGTM-UHFFFAOYSA-N	449.554	1.767	50	20	IDGD	
O=C(NNC(=O)[C@H](O)c1ccccc1)c1cccc(S(=O)(=O)NCc2ccccc2)c1	746093090	KJDZIMUVZPVFCQ-HXUWFJFHSA-N	439.493	1.660	50	20	IDGD	
O=C(CC[S@](=O)c1ccc2c(c1)OCCO2)NNC(=O)Cc1c[nH]c2ccccc12	746097245	DKVVWBXSPRSZFZ-PMERELPUSA-N	427.482	1.827	50	20	IDGD	
Cc1csc([C@@](O)(CC(=O)NNC(=O)Cc2cn3ccccc3n2)C(F)(F)F)n1	746642450	YFHKHURLGLTKES-INIZCTEOSA-N	427.408	1.629	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)c1cc([N+](=O)[O-])ccc1I	747324855	MSTDEWZEXBQAGC-UHFFFAOYSA-N	426.170	1.598	50	20	IDGD	
O=C(CN1CCN(C(=O)OCc2ccccc2)CC1)NNC(=O)c1cccc([N+](=O)[O-])c1	747348003	AJKSGVFNSBELCH-UHFFFAOYSA-N	441.444	1.310	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1)[C@@H]1CCS(=O)(=O)C1	747787796	VXHYUZHBGNXDPZ-WOJBJXKFSA-N	427.526	1.196	50	20	IDGD	
Cc1ccc(S(=O)(=O)Nc2cccc(C(=O)NNc3nccn(C)c3=O)c2)cc1F	747941587	IXDCHUGDJWCFDZ-UHFFFAOYSA-N	431.449	1.786	50	20	IDGD	
Cc1cc(C(=O)NNc2ccccc2S(=O)(=O)NC(C)(C)C)c2c(O)nn(C)c2n1	748594952	ZWQCNGZDQKMXBI-UHFFFAOYSA-N	432.506	1.816	50	20	IDGD	
Cc1nn(C)c(C)c1S(=O)(=O)N[C@H](C)C(=O)NNc1ccc([N+](=O)[O-])cc1Cl	748716468	GUDUQXARNNJJNP-SECBINFHSA-N	430.874	1.409	50	20	IDGD	
NS(=O)(=O)c1cccc(N2C[C@@H](C(=O)NNc3cc(F)c(F)cc3F)CC2=O)c1	748797523	SMLGEFJWWGTUTQ-VIFPVBQESA-N	428.392	1.248	50	20	IDGD	
N#Cc1ccc(C(=O)NCC(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)cc1	749284107	NHPVCHXXNVNPCG-UHFFFAOYSA-N	426.376	1.725	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNS(=O)(=O)c2cnn(C3CCOCC3)c2)cc1	749753873	ANUAPQOSHASMOD-AWEZNQCLSA-N	438.506	1.410	50	20	IDGD	
CCOCCCn1c(NNC(=O)CNC(=O)c2ccc(F)cc2)nc2ccccc2c1=O	752037911	QBGOLZQTPNGXDB-UHFFFAOYSA-N	441.463	1.835	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)c2ccc(C)o2)cc1NC(=O)c1ccccn1	753086502	WNPSOFCFIXWRFQ-UHFFFAOYSA-N	430.442	1.867	50	20	IDGD	
CCn1cc([C@H]2C[S@@](=O)CCN2C(=O)NNC(=O)Cn2ccc3ccccc32)cn1	753125833	OLQLOCMPAWWBNB-JJCDCTGGSA-N	428.518	1.404	50	20	IDGD	
CCCOc1ccc(C(=O)NNS(=O)(=O)c2csnc2C(=O)OC)cc1OC	755956898	LHIHWXWAPBUOEE-UHFFFAOYSA-N	429.476	1.350	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2ccc(C(=O)NC)c(Cl)c2)c2ccccc2c1=O	756140733	WIMOTQLHCHNCPU-UHFFFAOYSA-N	442.863	1.896	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)Nc1nnc2ccccn12	756431749	DKPZFYJEYYEZDX-UHFFFAOYSA-N	443.489	1.370	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)Nc2cccc(S(N)(=O)=O)c2)c1	756510224	PHTNWDYSIMUNLR-UHFFFAOYSA-N	443.279	1.572	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NCCc1ccccc1OC(F)(F)F	756932022	UQDJHBUDXKGQII-UHFFFAOYSA-N	430.408	1.950	50	20	IDGD	
O=C(NC[C@@H]1CCCS1)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	757254459	KWPXRYAJMLERGH-HNNXBMFYSA-N	426.564	1.701	50	20	IDGD	
COCCOc1c(Cl)cc(NC(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)cc1Cl	757890733	UDOKYCQXCSVDJN-MRVPVSSYSA-N	443.309	1.109	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(Br)o1)C1CCN(c2ncccn2)CC1	758943807	CBNDOMQXQYGBTH-UHFFFAOYSA-N	430.284	1.058	50	20	IDGD	
Cc1noc(C[C@@H](NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c2ccccc2)n1	759866614	GYZHKHUSLQCCHG-QGZVFWFLSA-N	447.455	1.553	50	20	IDGD	
C=CCNC(=O)NC(=O)COC(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccccc1	761396477	DXQHUYRLZBITPA-SFQUDFHCSA-N	432.440	1.926	50	20	IDGD	
CCOc1ccc(OCC)c(NC(=S)NNC(=O)c2ccc(S(N)(=O)=O)nc2)c1	762742554	LYXJNZKZVHJVSG-UHFFFAOYSA-N	439.519	1.158	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(N2CCSCC2)cc1	763444591	VHKMHMFTYRBWJT-UHFFFAOYSA-N	429.458	1.548	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccccc1O[C@H]1CCOC1	763658604	YWYZKYMGYTYGIO-AWEZNQCLSA-N	429.429	1.028	50	20	IDGD	
CS(=O)(=O)c1c(Cl)cccc1NC(=O)C(=O)NNC(=O)c1cccc(Cl)c1	763750644	QEWSQZNIISOYPM-UHFFFAOYSA-N	430.269	1.797	50	20	IDGD	
C[C@@H]1CN(c2ccccc2NC(=O)C(=O)NNC(=O)c2cccc(N(C)C)c2)C[C@@H](C)O1	763758636	SPDASOSVYIUFHX-HZPDHXFCSA-N	439.516	1.766	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2ccnn2Cc2ccc(C)o2)c1	763771575	IPTWEQQLNKCDPY-UHFFFAOYSA-N	427.417	1.250	50	20	IDGD	
COc1cccc(CC(=O)N2CCc3ccc(NC(=O)C(=O)NNC(=O)C(C)C)cc32)c1	763822226	ZXGPLTLZJYVFOG-UHFFFAOYSA-N	438.484	1.569	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2cc(F)ccc2OCC(F)(F)F)n1	763885808	OATMFYCDKYLIAV-UHFFFAOYSA-N	431.346	1.366	50	20	IDGD	
COC(=O)CCNC(=O)c1ccc(NC(=O)NNC(=O)CSc2ccccc2O)cc1	763915885	XKRQCHDDRNLWJH-UHFFFAOYSA-N	446.485	1.630	50	20	IDGD	
CS(=O)(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2ccc(Br)s2)c1	763940611	KZKRJDOSRCEKLZ-UHFFFAOYSA-N	446.304	1.314	50	20	IDGD	
O=C(NNC(=O)c1ccc[nH]1)C(=O)Nc1ccc(N2CCOCC2)cc1C(F)(F)F	763978784	FPOTVCIVATWWLP-UHFFFAOYSA-N	425.367	1.270	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)nc2)ccc1-n1nnnc1C(C)C	764092610	LTMHOLGDFABLEY-UHFFFAOYSA-N	442.867	1.542	50	20	IDGD	
C[C@H]1CN(Cc2ccccc2NC(=O)C(=O)NNC(=O)c2ccc(Cl)nc2)C[C@@H](C)O1	764099925	DUOCPZWDKMKBBZ-OKILXGFUSA-N	445.907	1.744	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)cc1NS(C)(=O)=O	764125927	BLBYSEPLNASWHK-UHFFFAOYSA-N	440.865	1.125	50	20	IDGD	
Cc1noc(COc2ccc(NC(=O)C(=O)NNC(=O)Cn3ccc4ccccc43)cc2)n1	764242271	CMFYLLZHUFHYJU-UHFFFAOYSA-N	448.439	1.698	50	20	IDGD	
O=C(NNC(=O)c1cccc2ncccc12)C(=O)Nc1ccc(C(=O)N2CCCC2)cc1	764253290	OPKKNQIAOOCJCK-UHFFFAOYSA-N	431.452	1.871	50	20	IDGD	
COCCOc1cc(NC(=O)C(=O)NNC(=O)c2cccc3ncccc23)ccc1OC	764257299	BPYQJDOABWIZOU-UHFFFAOYSA-N	438.440	1.668	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)Cc2cccnc2)c2ccccc12	764263395	HBPMPVRNDSDWIA-UHFFFAOYSA-N	436.424	1.115	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)ccc1O)C(=O)Nc1ccccc1-n1cccn1	764280244	LJGHNQZXKNQCJX-UHFFFAOYSA-N	444.245	1.740	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)ccc1C	764378014	VBHBFMUDBSOUCJ-UHFFFAOYSA-N	427.442	1.633	50	20	IDGD	
CCCc1[nH]nc(C(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)c1[N+](=O)[O-]	766649529	QNCXXQMYJGPCOC-UHFFFAOYSA-N	443.508	1.158	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)c1ccnc(C2CC2)n1	766659668	FAKYCBLUHZXQFI-UHFFFAOYSA-N	428.924	1.586	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)Sc1nnc(-c2cc(-c3ccc(Cl)cc3)[nH]n2)n1N	768439182	DLUGQPCTWCFDQU-VIFPVBQESA-N	434.913	1.740	50	20	IDGD	
O=C(NNS(=O)(=O)c1sc(C(=O)O)cc1Br)c1ccc2c(c1)OCO2	769622395	YXWHKROALVJGKG-UHFFFAOYSA-N	449.260	1.561	50	20	IDGD	
CSCCNC(=S)NNC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(C)s2)C1	769768607	FBRZGPGRAUKYJM-GFCCVEGCSA-N	436.650	1.316	50	20	IDGD	
COc1ccccc1C(=O)N[C@H](CCS(C)(=O)=O)C(=O)NNc1c(C)cccc1F	771701465	PLTVVXQVXLJICW-MRXNPFEDSA-N	437.493	1.819	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccccc1C[S@](C)=O	774003570	XRHLJNFJNDGCLP-AOAWJKDVSA-N	437.905	1.772	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccc(-n2ccnc2)nc1	774009492	OXBASYVYSPRHFS-LBPRGKRZSA-N	428.836	1.474	50	20	IDGD	
COc1ccc(-c2nnc(S)n2CC(=O)NNc2cccc(S(C)(=O)=O)c2)cc1	776534741	SCSCGZOHEAYTDY-UHFFFAOYSA-N	433.515	1.789	50	20	IDGD	
COc1ccc(NC(=O)/C(C#N)=C\c2ccc(O)cc2)cc1S(=O)(=O)N1CCOCC1	776595555	GXNIUQCJYLKUDS-VBKFSLOCSA-N	443.481	1.967	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(CCNC(=O)NNc2cccc(S(C)(=O)=O)c2)CC1	776618726	HNNSUYXGJABZMJ-UHFFFAOYSA-N	441.554	1.269	50	20	IDGD	
C[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	777412756	YSKQIDWSZWNPGX-CZUORRHYSA-N	444.496	1.252	50	20	IDGD	
COCC(=O)N1CCc2cc(NC(=O)C(=O)NNC(=O)c3cccc4ncccc34)ccc21	778709852	IVXIAGSZMMEICO-UHFFFAOYSA-N	447.451	1.170	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)N[C@H]1CCCN(c2ccc(C#N)cc2)C1=O	779963623	BFSWQWYKEOULNF-KRWDZBQOSA-N	437.456	1.472	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)CCS(=O)(=O)c2ccc3c(c2)OCCCO3)c1	781036938	BKFXCCXLLCTFPK-UHFFFAOYSA-N	434.470	1.942	50	20	IDGD	
CC(C)(C)OC(=O)NCc1cc(C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)co1	781383094	YDPSTPXERKOMBV-UHFFFAOYSA-N	442.428	1.794	50	20	IDGD	
CC(C)[C@H]1C[C@@H](CC(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)CCO1	781708534	DSYLVHASKVTESJ-AZUAARDMSA-N	430.549	1.433	50	20	IDGD	
CSc1nnc(CNC(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)s1	783061327	WXGZLOKDPRTGNB-UHFFFAOYSA-N	433.519	1.695	50	20	IDGD	
COc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NN=c1sc2ccccc2n1C	783349670	NBPQKFKOCGUPQN-UHFFFAOYSA-N	427.486	1.521	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)Nc2ccccc2C)c(OC)c(OC)c1	783415479	DIPUPPZEPBYTHI-UHFFFAOYSA-N	430.417	1.590	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)C(=O)Nc1ccc(Br)c(Cl)c1	784004417	MWAXSYUIXZIYKU-UHFFFAOYSA-N	443.641	1.211	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H]2CO[C@@H](C)C2)c1	784147024	WSRQOAAMUIRUHX-DZGCQCFKSA-N	433.486	1.682	50	20	IDGD	
O=C(NNc1ncc(F)cn1)C(=O)Nc1ccc(-c2csc(N3CCOCC3)n2)cc1	784949969	SDUYYOZEDRELOT-UHFFFAOYSA-N	443.464	1.658	50	20	IDGD	
CCOC(=O)Nc1ccc(NC(=O)C(=O)NNc2nccc(N(CC)CC)n2)cc1C#N	785227006	MRTYYZOHTGLEBI-UHFFFAOYSA-N	440.464	1.845	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2ccc(CN3C(=O)CCC3=O)cc2)n1	785233274	LZYQJYQEYLUGHY-UHFFFAOYSA-N	439.476	1.054	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc(Br)c1OC	785701562	KPSMPOGLQOQFEV-UHFFFAOYSA-N	447.249	1.517	50	20	IDGD	
CCNC(=O)N(C)NC(=O)Nc1cc(S(=O)(=O)N2CCCCC2)ccc1OCC	785835551	MBGFXRCIDAFEBO-UHFFFAOYSA-N	427.527	1.958	50	20	IDGD	
COc1ccc(NC(=O)COC(=O)/C(C#N)=C/C2CC2)cc1S(=O)(=O)N1CCOCC1	786679086	JUABKEOJVZEABN-XNTDXEJSSA-N	449.485	1.058	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)[C@H]1CCc2nccn2C1	787127888	WFLGFWQUVUXBFJ-KRWDZBQOSA-N	430.940	1.064	50	20	IDGD	
CN(NS(=O)(=O)Cc1c(F)cccc1F)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	788917815	VRHCUVNJZRWFRM-UHFFFAOYSA-N	448.492	1.904	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)N[C@@H](COC)[C@H]2CCCO2)c2ccccc2c1=O	789333619	BWGUBWPINDTBHV-ZWKOTPCHSA-N	445.520	1.725	50	20	IDGD	
CC(C)Oc1cc(NC(=O)C(=O)NNC(=O)c2cn(C)c3ccccc23)ccc1C(N)=O	789732551	WCOYFXHLHOWKOW-UHFFFAOYSA-N	437.456	1.464	50	20	IDGD	
CC(=O)N1CCCN(c2ccc(F)cc2NC(=O)C(=O)NNC(=O)C2CCCC2)CC1	790952114	OOAYHAHOTMJUDL-UHFFFAOYSA-N	433.484	1.160	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCC(C(=O)NNc3nc4ccccn4n3)CC2)cc1	791243235	ZKVGCWKRKLPRHT-UHFFFAOYSA-N	430.490	1.282	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(N2CCCCC2)c(C(=O)NNc2nc3ccccn3n2)c1	791244186	IIFCFNAZQOQTOK-UHFFFAOYSA-N	443.533	1.727	50	20	IDGD	
Cc1cccc(=O)n1C[C@@](C)(O)C(=O)NNc1ccc([N+](=O)[O-])cc1Br	792336036	AVXHYNAPQQKZHG-MRXNPFEDSA-N	425.239	1.722	50	20	IDGD	
Cc1nnnn1/C(=C/c1ccccc1)C(=O)NNC(=O)CNC(=O)OCc1ccccc1	794071379	IGJODMGXUZEQDO-LDADJPATSA-N	435.444	1.053	50	20	IDGD	
O=C(CN1CC[C@]2(CCN(Cc3ccccc3)C2)C1)NNC(=O)c1ccc([N+](=O)[O-])cc1	796441380	CIIVITVTHRMXKE-QHCPKHFHSA-N	437.500	1.954	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(F)cc(C(=O)OC)c1F	796989966	NTZGFQPRJGQVDH-UHFFFAOYSA-N	435.383	1.479	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)c(OC)c(C)c1OC	797001690	JOAYXTXGHGVTOK-MRXNPFEDSA-N	429.429	1.110	50	20	IDGD	
Cc1ccc(N2CCOCC2)cc1NC(=O)C(=O)NNC(=O)COCc1ccccc1	797534614	BLTMOJMYROTKNX-UHFFFAOYSA-N	426.473	1.134	50	20	IDGD	
COC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(OC)c(OC)c2)c1C	798042332	QIYJUCXHLJNDDJ-UHFFFAOYSA-N	430.417	1.590	50	20	IDGD	
Cn1c(Cl)cnc1C=NNC(=O)CCCCC(=O)NN=Cc1ncc(Cl)n1C	799467859	YILFDDFEAGGCCL-UHFFFAOYSA-N	427.296	1.621	50	20	IDGD	
C[C@@H](NC(=O)CCc1ccccc1)C(=O)OCC(=O)NNC(=O)c1ccc(Cl)cc1	799545601	BHJPBEQETRDNMU-CQSZACIVSA-N	431.876	1.782	50	20	IDGD	
Cc1c(C(=O)NNc2nccc(N3CCOCC3)n2)nnn1CCOc1ccc(F)cc1	800693323	JXYPQOGQQQPCMW-UHFFFAOYSA-N	442.455	1.188	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)CSCC(=O)N2CCOCC2)c(OC)cc1Cl	802082482	HNAAXTKJFDRRPE-UHFFFAOYSA-N	446.913	1.102	50	20	IDGD	
COc1ccc(C2=NO[C@@H](CNC(=O)NNC(=O)COc3ccccc3F)C2)cc1F	802346233	CJUSIUXRZGATKT-CYBMUJFWSA-N	434.399	1.876	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)N[C@H]2CCCN(C(=O)Cc3ccccc3)C2)cc1	802475110	ADIPJRSZKZMRCL-IBGZPJMESA-N	435.484	1.501	50	20	IDGD	
CCc1nnc(NC(=O)[C@@H](C)[C@@H](C)NC(=O)NNC(=O)c2c(C)nc3ccccn23)s1	804867893	NTEITFYIJFXZDI-WDEREUQCSA-N	444.521	1.664	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](c2cc(C(=O)NNc3ccc(-n4ccnc4)nn3)n[nH]2)C1	804955644	UEIWXZJEOXSIKE-ZDUSSCGKSA-N	439.480	1.867	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)c1csc(N2CCOCC2)n1)C1CN(C(=O)OC(C)(C)C)C1	806338566	QTEIBMDMCMQGFS-GFCCVEGCSA-N	439.538	1.244	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)Nc2ccc(F)c(S(=O)(=O)N(C)C)c2)c1O	806544182	WVFWPTQWLKIUSU-UHFFFAOYSA-N	426.426	1.257	50	20	IDGD	
COCCNC(=O)c1cccc(NC(=O)NNc2c(OC)cccc2S(C)(=O)=O)c1	806626636	CDCUQCUOSQOYTD-UHFFFAOYSA-N	436.490	1.624	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCCC2)cc1	807370577	NIBQGVVDBLEPIH-UHFFFAOYSA-N	427.523	1.411	50	20	IDGD	
Cc1cc([N+](=O)[O-])ccc1NNC(=O)C(=O)Nc1ccc2c(c1)C(=O)N(CC1CC1)C2=O	807456441	MJTGUUPWUGYPKQ-UHFFFAOYSA-N	437.412	1.991	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NCc1ccncc1OC[C@@H]1CCOC1	807614843	ADDDEONDZPJZFT-HUUCEWRRSA-N	432.452	1.934	50	20	IDGD	
Cn1nnc2c1C[C@H](C(=O)NNc1ccc(S(=O)(=O)Nc3ccccc3)cc1)CC2	810341641	OGWDZLDWQCWBNF-CQSZACIVSA-N	426.502	1.864	50	20	IDGD	
COC[C@]1(C(=O)NNC(=O)COc2ccc(F)cc2)CCN(C(=O)OC(C)(C)C)C1	811871446	FPAKRNQITFIZOM-FQEVSTJZSA-N	425.457	1.626	50	20	IDGD	
COCCOc1ccccc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	813033411	RPOBQUGDVYHEIP-UHFFFAOYSA-N	436.490	1.044	50	20	IDGD	
Cn1ncc(I)c1C(=O)NNC(=O)c1cc(-c2ccccc2)on1	814101108	JFIZDLKERCTFJI-UHFFFAOYSA-N	437.197	1.755	50	20	IDGD	
C[C@@H]1CN(c2ccc(Cl)c(F)c2)CCN1C(=O)NNC(=O)CNC(=O)c1ccco1	814295486	VMXMAKBUZPXIPM-GFCCVEGCSA-N	437.859	1.753	50	20	IDGD	
COc1ccc2c(c1OC)OCC2=NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1	814730112	KOBUMZACTWQXIL-UHFFFAOYSA-N	433.486	1.546	50	20	IDGD	
CCc1ccc(C(=O)NNc2nc3ccccc3n2C)cc1S(=O)(=O)N1CCOCC1	816579319	MADZSPXTIJGVOO-UHFFFAOYSA-N	443.529	1.914	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)[C@]23CCC(=O)N2CCS3)cc(OCC)c1OCC	844263683	BSUWDVQGFKXODC-HXUWFJFHSA-N	437.518	1.709	50	20	IDGD	
CC(=O)Nc1c(C)cccc1C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	878456661	QVQZMHXXHIRGBQ-KRWDZBQOSA-N	427.413	1.098	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)CNS(=O)(=O)c2ccc(Cl)cc2)cc1OC	913068403	YHDRRFKHKTYCBI-UHFFFAOYSA-N	441.893	1.487	50	20	IDGD	
COc1cc(N2C[C@H](C(=O)NNC(=O)NC3CCCCC3)CC2=O)cc(OC)c1OC	913901017	KKUNUYCTVHMTAL-CYBMUJFWSA-N	434.493	1.728	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2CC(=O)N(C(C)(C)C)C2)c1	914748522	LAFRVOLZYJGXMX-OAHLLOKOSA-N	438.550	1.125	50	20	IDGD	
CN(CC(=O)NNC(=O)CCSc1ccc(F)cc1)S(=O)(=O)c1ccccc1	914781930	WYHSLZZIGWMIDW-UHFFFAOYSA-N	425.507	1.776	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(S(=O)(=O)NC(C)(C)C)o2)cc1	915417962	VCLRCLYTMNKUDS-UHFFFAOYSA-N	437.474	1.283	50	20	IDGD	
CC(C)COCCCNC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	916208773	UCSGXKCNGDKJJL-UHFFFAOYSA-N	426.539	1.478	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCc2ccccc2Cn2ccnc2)nc1	916230455	AQYUUTMWEVTCKL-UHFFFAOYSA-N	443.533	1.839	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)NCCC(=O)N1CCN(C)CC1	916433487	XIFWXFHDAKZKSA-UHFFFAOYSA-N	430.534	1.227	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)COc1ccc(F)cc1)N1CCN(c2ccccc2)CC1	916514864	QQQXLGAQKHCBHK-KRWDZBQOSA-N	429.496	1.746	50	20	IDGD	
O=C(NCCN1CCN(c2ccc(F)cc2)CC1)NNC(=O)c1ccc2c(c1)OCCO2	916515045	YTEWLBUWJMQPPU-UHFFFAOYSA-N	443.479	1.363	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CNC(=O)c2cccc(Br)c2)cc1C	916561714	FOWJZVWPVYUBPJ-UHFFFAOYSA-N	447.289	1.582	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H]2CCCc3c2cnn3C)c1	916604702	MVCUXWSUNCEQEE-QGZVFWFLSA-N	448.549	1.472	50	20	IDGD	
O=C(COc1ccccc1CNC(=O)NNC(=O)c1ccccc1F)NC[C@@H]1CCCO1	918217534	JISIUYKWJRJKJC-INIZCTEOSA-N	444.463	1.644	50	20	IDGD	
CCCS(=O)(=O)N1CCC(NC(=O)/C(C#N)=C/c2cc(C)n(CCOC)c2C)CC1	918573802	OPAXZQBQNFBERK-XMHGGMMESA-N	436.578	1.979	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@H](C)Cc2cccc(O)c2)cc1	919782881	BCQFROPTXZBBSE-OAHLLOKOSA-N	434.518	1.283	50	20	IDGD	
O=C(COc1ccc(-c2ccccc2)cc1Cl)NNC(=O)N[C@@H]1CCS(=O)(=O)C1	919886121	UUSKFIKWCWXYPG-OAHLLOKOSA-N	437.905	1.903	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2cccc(N3CCNC3=O)c2)c2ccccc2c1=O	919896900	NFEVRAUUNZDZOL-UHFFFAOYSA-N	435.444	1.413	50	20	IDGD	
CCOC(=O)CCc1c(C)c(C=NNC(=O)N[C@@H]2CCS(=O)(=O)C2)c2ccccn12	920378741	BCDIYRNUZHJNHD-OAHLLOKOSA-N	434.518	1.564	50	20	IDGD	
Cc1ccc(C)n1-c1c(C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cnn1C	920626289	BWIKKPBCWXZEAT-UHFFFAOYSA-N	440.416	1.354	50	20	IDGD	
COC(=O)c1cccc(S(=O)(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)c1	1116084976	LQNUMMTZWAVFKA-UHFFFAOYSA-N	441.506	1.430	50	20	IDGD	
O=C(NNC(=O)c1n[nH]c2c1CCCC2)c1cc(Cn2cc(Br)cn2)on1	1319628765	KPWIZUGDDAXFJR-UHFFFAOYSA-N	434.254	1.359	50	20	IDGD	
COc1cc(OC)cc(N2C[C@H](C(=O)NNC(=O)c3cncn3-c3ccccc3)CC2=O)c1	1323632489	YWMVHEPLVPSJKU-OAHLLOKOSA-N	449.467	1.704	50	20	IDGD	
O=C(c1cc(Cl)nc2ccccc12)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1777803901	CEDZMNVIYQBXAP-UZLBHIALSA-N	438.311	1.931	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cnc3c(c1)CCNCC3)CCO2	1779298892	LGSYYXPBHQBZLF-JOCHJYFZSA-N	446.624	1.065	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)nn1C(F)F	1779299343	XYDYLWDREFSYNL-SFHVURJKSA-N	430.528	1.882	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@]2(C1)CN(C(=O)C1CCC3(CC1)OCCO3)CCO2	1779299515	WCRGRSDLGNBIPH-HXUWFJFHSA-N	440.613	1.601	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2)c1cc(C(F)(F)F)ccn1	1779790345	MVERWBXQPJWSIR-HDMKZQKVSA-N	449.857	1.828	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(CCN(C(=O)c3ccnc4c3OCO4)C2)C1	1780031811	PSGWMWDLKNXKNN-QGZVFWFLSA-N	426.267	1.039	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H]3CCN3C(=O)OC(C)(C)C)C2)C1	1781014947	FBUFLCARGBZTQN-MDOVXXIYSA-N	445.944	1.080	50	20	IDGD	
O=C1Cc2cc(C(=O)N3CCO[C@]4(CCN(C(=O)[C@@H](F)Br)C4)C3)ccc2N1	1781329506	GRHREKBAWGVNOY-QAPCUYQASA-N	440.269	1.315	50	20	IDGD	
C[C@H](Cc1ccncc1)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781335094	VSCIPYBPAQTREG-QIIPPGSGSA-N	428.302	1.781	50	20	IDGD	
Cc1n[nH]c(C)c1CC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2	1781424950	AKRVQXAJLRFAOA-SGTLLEGYSA-N	427.343	1.430	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(Cl)Cl)C2	1781937494	IIGLZLIFFKJWSH-KZULUSFZSA-N	438.352	1.829	50	20	IDGD	
CSCC[C@H](O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)Br)C1	1782001713	JVBQPQHSHILZQU-SZOQZIPDSA-N	437.400	1.398	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc4cccnc4nc3O)C2)C1	1782267338	HNAUMHVSQBAOMK-CWTRNNRKSA-N	449.305	1.562	50	20	IDGD	
O=C(c1cnc2ccc(Cl)cc2c1)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1782271690	NVIDSBHZROXWDH-PXNSSMCTSA-N	438.311	1.931	50	20	IDGD	
CC(=O)Nc1ccccc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2	1782981127	JICBHUUDQBWMSM-DBXWQHBBSA-N	437.924	1.372	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(C)c(NC(C)=O)c3)CCO2)C1	1783879753	ANXOSUCIIKROEO-LAUBAEHRSA-N	437.924	1.651	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3cnn(C)c3)C[C@@H]21	1783965340	JEMPNCADPKSWRH-HJWJTTGWSA-N	441.370	1.363	50	20	IDGD	
COc1ncccc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)CBr)C[C@@H]21	1786009326	SOCBLYHFWXGDOZ-SDADXPQNSA-N	440.338	1.715	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC1(c2ccc(NC(=O)c3cc(O)ncn3)cc2)CCC1	1786473984	QPETXSULKSRZSS-UHFFFAOYSA-N	426.477	1.303	50	20	IDGD	
O=C(Cc1cncnc1)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1	1786934388	DBZRELZNSXMBOZ-UHFFFAOYSA-N	430.273	1.147	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc(Br)cn3)C[C@@H]21)[C@H](F)Cl	1787444326	UAGZDQMOACYWJG-CFMVVWHZSA-N	448.720	1.901	50	20	IDGD	
CCN(CC)C[C@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]2C1	1788763396	BRYHRZKGHGKWNE-VJANTYMQSA-N	427.662	1.796	50	20	IDGD	
CCc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)CBr)C[C@@H]32)no1	1788984503	XTHRNZSDYFUPOQ-DSPQJCBJSA-N	428.327	1.861	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4cccnc4[nH]3)C[C@@H]21)[C@H](F)Br	1789925508	FYIRTYWHNFXSJK-JURCDPSOSA-N	439.285	1.847	50	20	IDGD	
Cc1ccc(-n2ccnn2)c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Cl)C[C@@H]32)c1	1790316471	QXXQWZIKCXMFQS-QXRTWZOPSA-N	435.887	1.703	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C=C(\C)NC(C)=O)[C@H]2C1	1790560994	MDNYTJYHOYGBFF-HXBQTNNPSA-N	430.343	1.180	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(CO)c(F)c3)C[C@@H]21	1791065524	ZUGPNPNHHSOFSY-ZUFFMMDNSA-N	443.313	1.695	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)Oc3cccnc3)[C@H]2C1	1791654670	XANPENNCFOLAIK-IAVJCBSLSA-N	425.913	1.082	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccnc1Cl	1792359506	UTJKMHCWMNUOHJ-NRWUCQMLSA-N	430.730	1.969	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c[nH]c(-c3ccc(F)cc3)c1)C2)[C@H](O)CCl	1792976413	TYICCRKDPPUTRZ-WTLGNFPFSA-N	435.883	1.624	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c(n1)NC(=O)CC3)C2	1793446685	ITFVKRROOSMTIE-KRXQYRFLSA-N	434.924	1.577	50	20	IDGD	
Cc1nnc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)CBr)C3)s1	1794104140	ONBZGAPPKNLXEG-VFFTVRQLSA-N	445.383	1.400	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)[C@H]1C[C@@H]1c1ccc(F)cc1	1796189571	DMXFZZKAFICUPS-YHINDDMVSA-N	436.292	1.561	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1nnsc1C1CC1	1796644647	RZNZOKHWCMDUCN-IXLVHKGHSA-N	429.340	1.402	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CCC[C@@H]1C	1797292337	CNVLIGOFBOJARH-WZHFHBLDSA-N	429.521	1.146	50	20	IDGD	
N#Cc1ccc(F)c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Br)c1	1799348685	MVWOQTGLQJPRLP-BAESOJJISA-N	428.233	1.591	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1n[nH]c3c1CCCC3)C2	1800639636	KXNRKVVYCDYSDH-LMWOUKEDSA-N	439.354	1.665	50	20	IDGD	
C[C@@H](NC(=O)c1ccc(F)cc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(Cl)Cl	1801016380	GOKBUUTZPZFURW-IKVITTDRSA-N	446.306	1.337	50	20	IDGD	
COC(=O)c1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)C(Cl)Cl)C3)c(C)c1	1801911686	GUOIQXASSAWFTB-AGGWBTHJSA-N	429.300	1.789	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cnn3ncccc23)[C@@H]1c1cccnc1)[C@H](O)CCl	1803139530	QMFQBQLFJWMTGJ-BMGDILEWSA-N	428.880	1.044	50	20	IDGD	
Cn1nc2c(c1C(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)CCC2	1803146636	CBGZCBOVUAITDH-JLSDUUJJSA-N	431.924	1.223	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1803689951	HNJMATASMWDLID-YSIASYRMSA-N	443.740	1.489	50	20	IDGD	
C[C@H](CNC(=O)OC(C)(C)C)C(=O)N1CCCC2(CCN(C(=O)[C@@H](O)CCl)CC2)C1	1805532080	DJXLLROWKICBNJ-CVEARBPZSA-N	445.988	1.978	50	20	IDGD	
CCc1oncc1C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1806033306	QZFQRUSLVBRWPS-KKSFZXQISA-N	442.520	1.325	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)/C=C/c2ccco2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807365463	XUJWXXXFUHFEJU-GJOLYLAISA-N	445.284	1.387	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)[C@@H]2CCCS2(=O)=O)[C@H]1c1cccnc1	1812497459	KTUANUFPBAUYGQ-LTIDMASMSA-N	427.954	1.682	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)c2ncnn2C)[C@@H]1c1cccnc1	1812775066	PQZAAJLWXQNQLH-QLFBSQMISA-N	435.326	1.703	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)CCn2cncn2)[C@@H]1c1cccnc1	1812778769	LNDPVOICOGEKQA-SOLBZPMBSA-N	449.353	1.943	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2cn(C)nc2OC)[C@@H]1c1cccnc1	1813029423	LRCRGBHKIRIULC-BHYGNILZSA-N	435.912	1.397	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2cc(OC)nn2C)[C@@H]1c1cccnc1	1813029564	PSIUDOJOGNXYRB-RLFYNMQTSA-N	435.912	1.397	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](C)CBr)n[nH]1	1814780043	FFLQERLTOJZKRG-GMXVVIOVSA-N	443.346	1.880	50	20	IDGD	
O=C(/C=C/C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](O)CCl)n[nH]1)NCc1ccco1	1814874200	YVBYFEWAUPPWCA-YCZSJOHXSA-N	449.895	1.467	50	20	IDGD	
O=C(/C=C/c1ccco1)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1	1815337709	WFFAVJNNBQZAIH-HQPKTYMTSA-N	437.286	1.355	50	20	IDGD	
N#CC1(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cnccc3C(=O)NN)n[nH]2)CCC1	1819404713	VJQJYBPUBISAJK-INIZCTEOSA-N	436.476	1.408	50	20	IDGD	
CC(C)[C@H](S)C(=O)N[C@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1	1819793148	LKBALAQXKBFEGS-BONVTDFDSA-N	448.574	1.322	50	20	IDGD	
CC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](COC(C)=O)OC(C)=O)CC2	1822850539	STIWEQNIEXLQMR-DYEKYZERSA-N	445.925	1.567	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](C)n2cnnn2)n[nH]1	1822863289	MGICEGVQIFZKRX-NHCYSSNCSA-N	425.291	1.433	50	20	IDGD	
CCOC(=O)/C=C/C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1	1823003718	NVIVWSBPXYKJDE-ASHLVDIESA-N	434.287	1.865	50	20	IDGD	
CC(C)(C)[C@@H](O)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1	1824135393	ZUFJSXOKTYORIR-UXHICEINSA-N	430.354	1.007	50	20	IDGD	
CCS(=O)(=O)N[C@H](C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H](F)Cl)CC1	1824459973	JTDHGSPIDVYHTK-VHDGCEQUSA-N	425.954	1.468	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)C34CC(C(=O)OC)(C3)C4)sc2C1	1825559148	UXIVPWOAPYUSPT-VYKCNYFWSA-N	441.937	1.652	50	20	IDGD	
Cc1ncoc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1	1826063822	RBGWLYPEIRQERO-IBGZPJMESA-N	425.294	1.210	50	20	IDGD	
C=C[C@H](O)C(C)(C)C(=O)N[C@@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1	1826087504	FXYAGJITTNTOSH-DOMZBBRYSA-N	437.566	1.001	50	20	IDGD	
CC(C)n1ccc(C(=O)N[C@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)n1	1826088766	NXPWYELIWOIZQU-ZDUSSCGKSA-N	447.565	1.519	50	20	IDGD	
C[C@@H](C(=O)N[C@H]1CCc2nc(NC(=O)C(Cl)Cl)sc2C1)N1CCN(C)CC1	1826104312	KNZSFTUNDNMBRB-QWRGUYRKSA-N	434.393	1.495	50	20	IDGD	
Cc1ncc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)cn1	1827055778	FPBZEKWVOYPLAC-NRFANRHFSA-N	436.321	1.012	50	20	IDGD	
Cn1cc(F)cc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827059373	NXSMWXXLWKANNG-FQEVSTJZSA-N	441.312	1.391	50	20	IDGD	
Cc1ncncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1	1829361808	BNMKUUNYRMKQBT-IBGZPJMESA-N	430.553	1.391	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(Cl)cnc3O)CCO2)C1	1829564272	MTODDLAVBRCGFT-KDOFPFPSSA-N	432.304	1.528	50	20	IDGD	
Cc1c(Cl)cccc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1	1830130917	PBVZYWWHFFHWJR-QFBILLFUSA-N	431.316	1.318	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(Cl)ccc3F)CCO2)C1	1830192021	MMRJWJFLSCJDDI-BEFAXECRSA-N	449.306	1.803	50	20	IDGD	
CCOC(=O)C(C)(C)C(=O)N1CCOC[C@@]2(CN(C(=O)C(C)(C)CCl)CCO2)C1	1830371376	ZGWKCDYLIZACBR-HXUWFJFHSA-N	432.945	1.297	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)C34CC(F)(C3)C4)C2)C1	1830535603	QSJAKNVKQDOFMR-CRZVIPCUSA-N	433.318	1.366	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](CC)N(CC)CC)CCO2	1831662171	NMNWFNFXOWNSKG-WAOWUJCRSA-N	432.005	1.971	50	20	IDGD	
Cc1csc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)c1	1831778720	GBHVKFJHEVYIER-CZUORRHYSA-N	435.315	1.817	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3noc(C(C)C)n3)CCO2)C1	1832783558	LUICNJITNBNBRH-YWZLYKJASA-N	442.944	1.599	50	20	IDGD	
C[C@@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)[C@@H]3[C@H]4COC[C@H]43)CC2)CC1	1833266219	WKIRANDJAWCIMW-VIBAHUMZSA-N	442.398	1.481	50	20	IDGD	
Cn1ncc2c(C(=O)N3CCC(N4CCC(NC(=O)[C@H](O)CCl)CC4)CC3)cccc21	1833310628	VUELHDPXCSHDPI-HXUWFJFHSA-N	447.967	1.358	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)c3cc(O)n(C)n3)CC2)CC1	1833531539	SIFLFOWWVRDTJN-MRXNPFEDSA-N	425.961	1.718	50	20	IDGD	
CCc1[nH]nc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)c1F	1833737811	KQGUCRJXFYBBAG-LJQANCHMSA-N	442.564	1.033	50	20	IDGD	
Cc1nscc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1833747023	IEJWJDCTKSLNKL-DOMZBBRYSA-N	436.303	1.212	50	20	IDGD	
Cc1cnc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)s1	1833804444	VWHQTDXKGDYLBL-ABAIWWIYSA-N	436.303	1.212	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccnn3CC)CCO2)C1	1834417677	OJNOQWDZBCKPLV-KBXCAEBGSA-N	443.342	1.147	50	20	IDGD	
Cc1ncc(C(=O)N2CCC(N3CCC(NC(=O)CCBr)CC3)CC2)cn1	1834421234	VEDALKNFJBVDNG-UHFFFAOYSA-N	438.370	1.755	50	20	IDGD	
O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)COc1ccccc1)CCO2	1834949522	PSGYWJHDPWDWLX-IBGZPJMESA-N	441.322	1.307	50	20	IDGD	
CNc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](Cl)COC)C3)C2)cc1	1835610081	IOFFILIXTZTKFX-FXAWDEMLSA-N	425.913	1.052	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnn4ncccc34)CCO2)C1	1836467039	SEBPIVYDGSLYHJ-HXUWFJFHSA-N	435.912	1.064	50	20	IDGD	
CCc1noc(C)c1C(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836718167	IJJZGDZMOQVGIB-QGZVFWFLSA-N	427.929	1.757	50	20	IDGD	
COC(=O)CCCCCC(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836720158	LBGOXIAAMFXXDV-SFHVURJKSA-N	446.972	1.708	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc4cnccc4[nH]3)CCO2)C1	1837097480	FFYFGEWFEJCGLX-NRFANRHFSA-N	434.924	1.898	50	20	IDGD	
O=C(CCCCn1cccc1)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1837624010	XECIMJSTBCCHIJ-LJQANCHMSA-N	432.348	1.919	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccncc3Cl)CCO2)C1	1837890658	CSLSLQVOABLCRR-SJKOYZFVSA-N	446.729	1.588	50	20	IDGD	
Cc1nnc(CC(=O)N2CCC(OC3CCN(C(=O)[C@H](C)Br)CC3)CC2)o1	1837940252	BPDHPCWFXYJMDM-LBPRGKRZSA-N	443.342	1.703	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC(OC2CCN(C(=O)CCn3ccnn3)CC2)CC1	1838432153	ADDPCMXYAJRMME-UHFFFAOYSA-N	437.617	1.518	50	20	IDGD	
CC(=O)NCCC(=O)N1CCC(OC2CCN(C(=O)[C@H](F)Br)CC2)CC1	1838648597	ZZSRWEGFYVCOIX-INIZCTEOSA-N	436.322	1.202	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3nc(O)n4c3CCCC4)C2)C1	1839145414	HBJLAHJIAIKYRW-JLTOFOAXSA-N	440.928	1.012	50	20	IDGD	
O=C(c1ccccc1O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839197638	CQYPRRCHVLCUAB-WMLDXEAASA-N	431.258	1.153	50	20	IDGD	
O=C(c1cc(O)c(O)c(Cl)c1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1839434020	JFHXWXMUTHLHLJ-PBHICJAKSA-N	437.251	1.356	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3CCOCC3)C2)C1	1839963254	FYGWHIVBJLHCMC-MAUKXSAKSA-N	433.343	1.043	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(F)c(C)c3)C2)C1	1840155058	OHWSJJDWGRVBKG-UZLBHIALSA-N	428.888	1.458	50	20	IDGD	
COc1ccc(OCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)cc1	1840186537	AIEZHRRJJOTTRO-LJQANCHMSA-N	447.315	1.334	50	20	IDGD	
O=C(c1cc(F)cc(F)c1F)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1840719238	BNWUJUFUNLWLCA-QGZVFWFLSA-N	441.233	1.978	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC12CN(C(=O)c1cccc(S(C)(=O)=O)c1)C2	1841285109	DFGBDDPQAAJNSK-ZDUSSCGKSA-N	443.363	1.938	50	20	IDGD	
CC(C)(C)OC(=O)N1CC2(C[C@@H]2C(=O)N2CC3(CCCN3C(=O)[C@H](O)CCl)C2)C1	1841353907	XEGUANGZTDWWDG-ZIAGYGMSSA-N	427.929	1.047	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2ncc(F)cc2F)C1	1841735230	OKEHHVOXJJTVRW-BRJLIKDPSA-N	430.415	1.311	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)[C@@H](C)Oc1ccccn1)C2	1843417334	XQIBLGVEIUIBBR-FYHAJLKWSA-N	438.488	1.186	50	20	IDGD	
C[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1C(=O)N1CCCC12CN(C(=O)[C@@H](O)CCl)C2	1843970872	BOUDOYAFGCCVKA-KKUMJFAQSA-N	429.945	1.293	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC2(CCCN2C(=O)c2cc3n(n2)CCCNC3=O)C1	1843999554	YIJIAFJQRMUGEI-LBPRGKRZSA-N	438.326	1.007	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1ccc(-c3cc[nH]n3)cc1)C2	1844264953	CEUVWEQPQDJVRO-UHFFFAOYSA-N	445.483	1.206	50	20	IDGD	
CC(=O)N[C@H](C(=O)N1CCCC12CN(C(=O)CCBr)C2)c1ccc(F)cc1	1845005715	HEQWHMOGADVPPD-KRWDZBQOSA-N	440.313	1.991	50	20	IDGD	
C[C@@H]1Oc2ccc(C(=O)N3CC4(CCCN4C(=O)[C@@H](F)Br)C3)cc2NC1=O	1845218568	NHTGDQVUDUSGJU-IINYFYTJSA-N	440.269	1.914	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cc(Cl)c(OCC(N)=O)c(OC)c2)cc1OC	14289561	BUTGUUIGKBXNJI-UHFFFAOYSA-N	437.836	1.305	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc2c1O[C@H](C)C2	26535073	ICZWFMREXZINCM-SECBINFHSA-N	439.877	1.394	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)c1ccc(S(=O)(=O)N(C)OC)cc1	26792933	BJEXXOURLSSOBM-UHFFFAOYSA-N	445.501	1.242	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1I)c1ccccc1O	33225979	IXRADZQHZRBQHX-UHFFFAOYSA-N	427.154	1.980	50	20	IDGD	
Cc1ccc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)C(=O)NC(C)C)cc2)cc1C	46772895	VOFCKHHZBNZNMV-UHFFFAOYSA-N	432.502	1.390	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1cc(=O)n(C)c2ccccc12	107917621	RQRLRGZXFVVDPG-UHFFFAOYSA-N	427.486	1.215	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)C2=NN(c3ccc(F)cc3)[C@H](C(N)=O)C2)c(C)c1	110888251	ZGJSYKVSHPXNPR-SFHVURJKSA-N	426.452	1.122	50	20	IDGD	
Cc1noc(C)c1S(=O)(=O)N1CCC[C@H](C(=O)NNc2nc(-c3ccccc3)no2)C1	728081344	SFBLQLWHRZFCFU-HNNXBMFYSA-N	446.489	1.885	50	20	IDGD	
COc1ccc(S(=O)(=O)Nc2ccccc2C(=O)NNC(=O)Cc2cccnc2)cc1	728891925	LCZCTTCKUGLINW-UHFFFAOYSA-N	440.481	1.895	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)[C@@H](Cc1cccc(F)c1)n1nnnc1C	729297446	KYTLHZHSJPZYJP-MRXNPFEDSA-N	428.424	1.139	50	20	IDGD	
CN(C)c1ccc(NC(=S)NNC(=O)c2nc3ncc(Br)cn3n2)cc1	729689953	LATKQCGRDJQCPS-UHFFFAOYSA-N	435.311	1.584	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)NCCCN1CCN(c2ccccc2)CC1	730822019	COFNGJGGNJYWNA-UHFFFAOYSA-N	427.505	1.314	50	20	IDGD	
O=Cc1ccc(OC(F)(F)C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1	730871574	FZXGFRIWSVMDIP-UHFFFAOYSA-N	437.311	1.383	50	20	IDGD	
Cc1nc2cc(O)nn2c(C)c1CC(=O)OCC(=O)NNC(=O)c1cccc(Cl)c1	731447232	SBUQKZWFTHFRLX-UHFFFAOYSA-N	431.836	1.252	50	20	IDGD	
COc1ccccc1NC(=S)NNC(=O)c1nnn(-c2ccc3c(c2)OCCO3)c1C	731501566	WZJAZVGTNGIGIA-UHFFFAOYSA-N	440.485	1.987	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2c3ccccc3C[C@H]2C)c1	732082677	JVYDJFANFVGUJZ-CYBMUJFWSA-N	439.497	1.933	50	20	IDGD	
CS(=O)(=O)c1cc(C(=O)NNC(=O)NCc2ccc(Cl)cc2)cc([N+](=O)[O-])c1	733004234	AAEPQMASRDFOFQ-UHFFFAOYSA-N	426.838	1.796	50	20	IDGD	
CCS(=O)(=O)CC(C)=NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	733745896	FDFOGQLHJOALDD-UHFFFAOYSA-N	426.498	1.985	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)C(=O)NCCCc1ccccc1	734252761	GQYUSQNKYUSENF-UHFFFAOYSA-N	432.546	1.956	50	20	IDGD	
Cc1nc(-c2ccccn2)nc(NNC(=O)C2=NN(c3ccccc3)[C@@H](C(N)=O)C2)c1C	734256158	MLWZSSKUAYFTBD-GOSISDBHSA-N	430.472	1.719	50	20	IDGD	
CN1CCC(N2CC[C@@H](NC(=O)NNC(=O)c3ccc(F)cc3Br)C2)CC1	734281397	IUHYNDQXWDYURL-CYBMUJFWSA-N	442.333	1.701	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NC2CCN(C[C@@H]3CCCO3)CC2)c2ccccc2c1=O	734281782	KEWPNQMPAMXPBA-INIZCTEOSA-N	442.520	1.004	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)c1cc(I)c[nH]1	734429954	GUQIYERUYGGAAP-UHFFFAOYSA-N	446.270	1.817	50	20	IDGD	
CC(=O)NCC(=O)N1CCc2cc(C(=O)NNC(=O)c3cc(-c4ccccc4)on3)ccc21	735649379	FFRIISAVSWAJHM-UHFFFAOYSA-N	447.451	1.442	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)cc1	736066692	QHMPYHYALOKWCM-UHFFFAOYSA-N	440.865	1.638	50	20	IDGD	
Cc1noc(C)c1C[C@H](C)NC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	739050740	YCBHMYAGSKTXGK-ZDUSSCGKSA-N	449.533	1.651	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)c1ccc2c(c1)S(=O)(=O)c1ccccc1C2=O	740851271	XFQKCJDFQAFACV-UHFFFAOYSA-N	443.481	1.130	50	20	IDGD	
CCCCCn1nc(C(=O)NNS(=O)(=O)c2cnn(C(C)C)c2)c2ccccc2c1=O	741648199	XIAQHJYQRRAUEW-UHFFFAOYSA-N	446.533	1.987	50	20	IDGD	
O=C(NNC(=O)N1CCOCC1)c1nn(-c2cccc(Br)c2)c2c1CCC2	741681510	PXHSIWIAWJDGAP-UHFFFAOYSA-N	434.294	1.810	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)CCN1C[C@@H](C)O[C@H](C)C1	743290690	IXBCBSNFFLAMFO-MCIONIFRSA-N	428.327	1.863	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)N[C@@H](C)COCC(F)(F)F)c2ccccc2c1=O	743342032	ZOKMXRJXNWRTGD-NSHDSACASA-N	429.399	1.889	50	20	IDGD	
O=C(CCN1C(=O)c2ccccc2C1=O)NNC(=O)c1cc(Br)ccc1O	743733918	UBAOXQBFTLOIID-UHFFFAOYSA-N	432.230	1.602	50	20	IDGD	
COCCNS(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccc(N(C)C)cc2)c1	743828584	UGANKJOEZFWIJR-UHFFFAOYSA-N	435.506	1.144	50	20	IDGD	
CC(C)NC(=O)C(=O)NNC(=O)C[C@H](NC(=O)c1ccccc1Cl)c1ccccc1	744446494	ARPVDBADVRLBAQ-KRWDZBQOSA-N	430.892	1.873	50	20	IDGD	
CCN(C)[C@H](C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1)c1ccccc1	745102658	YLENJXCGQIGTIW-QUCCMNQESA-N	427.457	1.210	50	20	IDGD	
C[C@@H](CN1CCN(c2ccccc2)CC1)NC(=O)NNC(=O)c1nnc(O)c2ccccc12	745840781	YIXPWVNZLRNRBN-INIZCTEOSA-N	449.515	1.490	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)c1ccc(-c2ccccn2)nc1O	746819918	KEMNJFISWCUIDD-UHFFFAOYSA-N	446.511	1.823	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N1CCC[C@H](CC(N)=O)C1	747491190	QJBNQPIRSBVPBG-VXGBXAGGSA-N	427.299	1.545	50	20	IDGD	
COc1cc(S(=O)(=O)NNC(=O)COCc2ccccc2)ccc1Br	747618977	SLMYTMXUCZVNJZ-UHFFFAOYSA-N	429.292	1.984	50	20	IDGD	
CCc1cc(N2CCC(NC(=O)NNC(=O)COc3ccc(OC)cc3)CC2)ncn1	748659554	BGCRZBXZDBGPLI-UHFFFAOYSA-N	428.493	1.426	50	20	IDGD	
CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)NNC(=O)COc1ccc(F)cc1	749333700	RXFWFJWYOBMDDL-IBGZPJMESA-N	430.411	1.720	50	20	IDGD	
C[C@@H](Sc1ccnc2cc(Cl)ccc12)C(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1	749874240	MODAEBPTNCUQIP-MNOVXSKESA-N	427.935	1.951	50	20	IDGD	
CO[C@H](C)c1nc(CNC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)cs1	752356216	LBOKDHUXPHMOFP-LLVKDONJSA-N	440.551	1.596	50	20	IDGD	
COc1ccc([C@H](CNC(=O)NNC(=O)c2ccc(C)o2)N2CCOCC2)cc1OC	752365202	RPLTZGHRFPHISJ-INIZCTEOSA-N	432.477	1.623	50	20	IDGD	
CCN1C(=O)[C@@H]2CN(C(=O)/C(C#N)=C/c3cc(C)n([C@H](C)COC)c3C)CCN2C1=O	752507892	KFIFNTAISVMYBQ-NUJRJDIVSA-N	427.505	1.714	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@H]2C(=O)NNC(=O)c2ccc(C)o2)cc1	752779148	DJJBGZXQHFBYMI-KRWDZBQOSA-N	433.486	1.795	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2cnc(C)s2)c1	754741049	OCASZRBPUSJPIN-UHFFFAOYSA-N	432.549	1.105	50	20	IDGD	
CN1CCN(C(=O)c2ccccc2NC(=O)NNC(=O)COc2ccc(F)cc2)CC1	755623324	NODBLCFFDFVESV-UHFFFAOYSA-N	429.452	1.445	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)Nc2ccc(NC(=O)NC[C@H]3CCCO3)cc2)n1	756510580	KLGPLRMCYPMDJB-QGZVFWFLSA-N	429.481	1.653	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CN2CCN(CC(=O)Nc3ccc(Cl)cc3)CC2)c1	756649207	FGOBVMPKUIMGQF-UHFFFAOYSA-N	443.935	1.666	50	20	IDGD	
C[C@H]1C[C@@H](C)C[C@]2(C1)NC(=O)N(CC(=O)NNC(=O)NCc1ccc(Cl)cc1)C2=O	757648349	QPYXOYARCQDYKJ-NXCRSVRDSA-N	435.912	1.917	50	20	IDGD	
Cc1cc(CNC(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)ncn1	757664436	SGRKCZMGFGMDCK-UHFFFAOYSA-N	446.514	1.792	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1Cl	757738214	MEQBYMFEGFDHPZ-UHFFFAOYSA-N	445.823	1.334	50	20	IDGD	
Cc1ccc2nc(-c3ccccc3)cc(C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)c2c1	758029689	MXQGTGHABCXJNU-AWEZNQCLSA-N	426.498	1.909	50	20	IDGD	
COCCOc1ccccc1C(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758787065	ROMIQKHMLKRIPL-UHFFFAOYSA-N	436.509	1.961	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Cc2cccc(OCC#N)c2)c1	760246295	HSJOIQLJTGDVMK-UHFFFAOYSA-N	444.513	1.623	50	20	IDGD	
Cn1c(NNC(=O)[C@@](C)(O)CN2C(=O)C(C)(C)c3ccccc32)nc2ccccc2c1=O	760328839	IRVBERCJZMMPIH-QHCPKHFHSA-N	435.484	1.452	50	20	IDGD	
O=C(COC(=O)c1cccc([C@@H]2CCOC2)c1)NNC(=O)[C@H]1COc2ccccc2O1	761546914	IKLWKXLMNCCLRM-VQIMIIECSA-N	426.425	1.335	50	20	IDGD	
CCS(=O)(=O)N[C@H](CCSC)C(=O)NNC(=O)c1cc(-c2ccc(C)cc2)[nH]n1	762956171	QBULJIGKDVZYFP-CQSZACIVSA-N	439.563	1.207	50	20	IDGD	
COC(=O)CCOc1ccc(S(=O)(=O)NNC(=O)CSc2ccccc2O)cc1	763409573	ITSJVPCTYZOPLY-UHFFFAOYSA-N	440.499	1.436	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)C(=O)Nc1cc(F)ccc1OC[C@H]1CCCO1	763441808	KARFNZDECUBEQE-OAHLLOKOSA-N	446.391	1.691	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)C(=O)Nc1cccc(Cl)c1N1CCOCC1	763550930	JDHLWWLTLZORKE-UHFFFAOYSA-N	446.847	1.305	50	20	IDGD	
CC(C)N(C)c1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1F	763578785	QBXKNRBAOKKPIQ-SFHVURJKSA-N	430.436	1.596	50	20	IDGD	
CC(C)(C)c1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc3c(c2)OCC(=O)N3)cc1	763600665	SCFILVYIZKXPDZ-UHFFFAOYSA-N	440.456	1.480	50	20	IDGD	
COC(=O)Nc1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2OC)ccc1F	763662203	GCRQUGLZSOASMG-UHFFFAOYSA-N	434.380	1.178	50	20	IDGD	
CC(C)CNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)cc1	763682804	ZVXSKMHGGBENML-UHFFFAOYSA-N	437.456	1.109	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(OC)c(OC)cc1OC	763712204	OJUSFERXIZSGHI-UHFFFAOYSA-N	431.445	1.440	50	20	IDGD	
COCCCn1ccc(NC(=O)C(=O)NNC(=O)CSc2ccc(Cl)cc2)n1	763733730	HUIJBSACCOMZAG-UHFFFAOYSA-N	425.898	1.451	50	20	IDGD	
O=C(CN1CCCc2ccccc21)NNC(=O)C(=O)Nc1cccc(Cn2cccn2)c1	763736421	TWDDLFGLWUDSET-UHFFFAOYSA-N	432.484	1.470	50	20	IDGD	
O=C(NNC(=O)c1cccc(Cl)c1)C(=O)Nc1ccc(S(=O)(=O)C(F)F)cc1	763749780	DTSAVZOTXDWAHW-UHFFFAOYSA-N	431.804	1.736	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(N(C)C)c2)cc1C(=O)NC(C)C	763760741	QHHSQUBZNRJLCT-UHFFFAOYSA-N	425.489	1.599	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(C(C)=O)cc2)c(Cl)n1	763870512	AERMNMHFANUOOU-LLVKDONJSA-N	434.836	1.500	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc([S@@](C)=O)c(F)c2)cc1	763873012	REXHVEFPKMIKID-MDQXEJNYSA-N	449.460	1.319	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@@H](C)C(=O)NNC(=O)C(=O)Nc1cncnc1N(C)C	763882788	LWXZMPMJRAYIAU-LBPRGKRZSA-N	434.884	1.366	50	20	IDGD	
Cn1c(C2CC2)nc2cc(NC(=O)C(=O)NNC(=O)c3cc(Br)c[nH]3)ccc21	763996015	TWPIMEXDUYTILJ-UHFFFAOYSA-N	445.277	1.941	50	20	IDGD	
CC(C)(C)OC(=O)N1CCCc2cc(NC(=O)C(=O)NNC(=O)c3cnccn3)ccc21	764024559	NDDJDAHXUGHJEP-UHFFFAOYSA-N	440.460	1.564	50	20	IDGD	
Cn1cnc2cc(NC(=O)C(=O)NNC(=O)c3ccc(F)cc3Br)ccc21	764085774	OGDGDBOAEWGAHS-UHFFFAOYSA-N	434.225	1.875	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)c2ccc(C)cc2O)sc2c1CCC2	764112310	VOPHTHCZVYLPMM-UHFFFAOYSA-N	431.470	1.827	50	20	IDGD	
O=C(CC1CCCC1)NNC(=O)C(=O)Nc1ccccc1S(=O)(=O)N1CCCCC1	764179737	WARPGURCHPNHEL-UHFFFAOYSA-N	436.534	1.527	50	20	IDGD	
CCn1cnnc1-c1ccccc1NC(=O)C(=O)NNC(=O)c1cccc(OC(F)F)c1	764251630	WLTYGVJSKVIKFU-UHFFFAOYSA-N	444.398	1.966	50	20	IDGD	
CN(C(=O)c1ccccc1NC(=O)C(=O)NNC(=O)Cc1ccccn1)C1CCCCC1	764267221	DIFQRQVNAYMEFZ-UHFFFAOYSA-N	437.500	1.815	50	20	IDGD	
CCCN(C(=O)c1ccccc1NC(=O)C(=O)NNC(=O)Cc1cccnc1)C(C)C	764268687	OWSRYLWPDWUMQM-UHFFFAOYSA-N	425.489	1.671	50	20	IDGD	
CN(C)S(=O)(=O)c1c[nH]c(C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)c1	764335693	UITLOFPDOJLTHH-UHFFFAOYSA-N	427.433	1.192	50	20	IDGD	
C[C@@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(NC(=O)C(=O)NNC(=O)C3CCC3)cc2)C1	764340998	BYEIEKBTVBZHPY-ZIAGYGMSSA-N	436.534	1.239	50	20	IDGD	
COc1cc(F)c(NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)cc1OC	764379373	CUADSETXPLUXKC-UHFFFAOYSA-N	427.335	1.601	50	20	IDGD	
O=C(NNC(=O)C(F)(F)Oc1ccccc1)C(=O)Nc1ccnn1CCc1ccccc1	764379871	MXKWJAMXMKKNGL-UHFFFAOYSA-N	443.410	1.884	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1ccc([S@@](C)=O)c(F)c1	764392655	KALUFJJXYWSULT-GDLZYMKVSA-N	439.490	1.450	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1ccc2nc(-c3ccc(F)cc3)oc2c1	764398061	CLTJZBPACHDUPH-GFCCVEGCSA-N	444.419	1.771	50	20	IDGD	
COC(=O)NCc1ccc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)cc1	764405306	ROCPHZZNTKWGHE-UHFFFAOYSA-N	432.458	1.126	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)N[C@@H]1CCN(c2ccc(Cl)c(F)c2)C1=O	764505809	BGONVNLLBQXBQI-MRXNPFEDSA-N	445.838	1.865	50	20	IDGD	
CS(=O)(=O)c1ccc(OCCC(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)cc1	765566269	SZQHOJSTJOPONY-UHFFFAOYSA-N	434.499	1.772	50	20	IDGD	
C/C(=C/C(=O)NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1)C(C)(C)C	766637141	YJOGTCLYFHNVSB-VKAVYKQESA-N	436.578	1.441	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(C(=O)NNc2ccccc2S(C)(=O)=O)ccc1Cl	766667479	AJJMRYOASJWNES-UHFFFAOYSA-N	431.923	1.751	50	20	IDGD	
CCN1CCC[C@H]1CN1C[C@@H](C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)CC1=O	768261847	XIHAGUQLKYWAOH-KBPBESRZSA-N	430.534	1.232	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)NC2CCN([C@@H]3CCCC[C@@H]3O)CC2)cc1	769165515	ZFOALRIJSIDDQF-HBGVWJBISA-N	448.564	1.951	50	20	IDGD	
CSCCNC(=S)NNC(=O)c1ccc(S(=O)(=O)N2C[C@H](C)C[C@@H](C)C2)cc1	769768923	HQTVKVYFIJVMCK-ZIAGYGMSSA-N	444.648	1.825	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cc(C)oc2C(F)(F)F)cc1	770211278	BKHMAFGGFPLLLH-UHFFFAOYSA-N	433.408	1.997	50	20	IDGD	
CCN1CCN(c2cccc(NC(=O)C(=O)NNC(=O)Cc3ccc(F)cc3)c2)CC1	770771639	LIWFJCIPZMRPLN-UHFFFAOYSA-N	427.480	1.296	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1ncccc1C(F)(F)F	770787466	IUCWKUTXHBAHIX-UHFFFAOYSA-N	435.406	1.319	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)c2cc(I)c(F)cc2F)n1	772047852	QWRNCQYSDOJJEK-UHFFFAOYSA-N	434.184	1.844	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)CN1C(=O)N[C@]2(CCCC[C@H]2C)C1=O	772967064	LXJFKHPDTQPXQO-UVARLRKDSA-N	436.896	1.755	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)C(=O)Nc2ccc(Cl)c(S(=O)(=O)N(C)C)c2)n1	773478873	NFJGVZGKODKYTK-UHFFFAOYSA-N	426.886	1.079	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(F)c(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2)c1	773640001	RPQIZJAAIQPXOD-UHFFFAOYSA-N	425.398	1.066	50	20	IDGD	
CC[C@H](NCC(=O)NNC(=O)c1ccccc1Cl)c1ccccc1OCC(=O)NC	775128047	FTBFKRMWUMEWOH-KRWDZBQOSA-N	432.908	1.967	50	20	IDGD	
C[C@H](NCC(=O)NNC(=O)c1cccc(Cl)c1)c1cccc(S(=O)(=O)N(C)C)c1	775337490	HVLXKZVMBDEBSV-ZDUSSCGKSA-N	438.937	1.702	50	20	IDGD	
CNC(=O)NNS(=O)(=O)c1cc(C(=O)O)c(Br)cc1Br	775673253	PKZBQGIDLBNEAO-UHFFFAOYSA-N	431.062	1.032	50	20	IDGD	
CCOc1cccc([C@H]2C[C@H]2NC(=O)NNC(=O)c2csc(N3CCOCC3)n2)c1	775715218	UNVQUAIJMOBVMZ-HZPDHXFCSA-N	431.518	1.879	50	20	IDGD	
Cc1cc(Br)cc(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)c1	777141740	PSKRPCGDZKPJBZ-UHFFFAOYSA-N	431.246	1.794	50	20	IDGD	
CCNS(=O)(=O)c1ccccc1S(=O)(=O)NNC(=O)c1cc2c(s1)CCC2	777597667	WHFJKTZPPMYIRZ-UHFFFAOYSA-N	429.545	1.158	50	20	IDGD	
CC(C)(C(=O)NNS(=O)(=O)c1ccc(N2CCOC2=O)c([N+](=O)[O-])c1)c1ccccc1	777633234	WNBHOZCSGPBWLQ-UHFFFAOYSA-N	448.457	1.839	50	20	IDGD	
C[C@H]1CCN(C(=O)OC(C)(C)C)[C@H](C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)C1	778413182	POGNAEOLQVLOGB-YOEHRIQHSA-N	444.488	1.898	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)[C@@H](O)Cc1cccc(C(F)(F)F)c1	778834781	CNTKREZJVSZIRS-ZDUSSCGKSA-N	434.415	1.464	50	20	IDGD	
C[C@@H](C(=O)NNc1ccc([N+](=O)[O-])cc1Br)S(=O)(=O)C1CCOCC1	779144919	BGIAITMOEYIFBS-VIFPVBQESA-N	436.284	1.783	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)F)cc1)[C@H](O)[C@@H](O)c1nc2ccccc2s1	779535998	GOENUZZAZWXKDM-ZIAGYGMSSA-N	443.453	1.830	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H]2CCC[C@H]2CCO)c1	779710298	CATAUVXMQBUZCF-WMLDXEAASA-N	426.539	1.212	50	20	IDGD	
O=C(COC(=O)c1ncsc1-c1ccccc1)NNC(=O)[C@H]1COc2ccccc2O1	782383468	BZVCZIGLFWCEJU-MRXNPFEDSA-N	439.449	1.954	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2cccc(CS(=O)(=O)NC(C)(C)C)c2)cc1	783035405	ULXKGTSSFSVSPM-UHFFFAOYSA-N	434.518	1.995	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2ccc(S(=O)(=O)N3C[C@@H](C)C[C@@H](C)C3)cc2)ncn1	783947505	BBAYPTICVPRINB-OKILXGFUSA-N	446.533	1.533	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)cc(OC)c1	784835525	QPPAFQFOYHWVRT-UHFFFAOYSA-N	429.401	1.782	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)cnn1-c1ccccc1F	785023893	PAXZNARLGLQUSW-UHFFFAOYSA-N	442.363	1.333	50	20	IDGD	
Cn1ccnc(NNC(=O)C(=O)Nc2ccc(Br)cc2C(F)(F)F)c1=O	785090151	OJXPWCFPMBJGGN-UHFFFAOYSA-N	434.172	1.643	50	20	IDGD	
CN(C)CCc1ccc(CNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1	786116544	CISITVNPDIPDFH-UHFFFAOYSA-N	425.537	1.328	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)cc1N1CCNC1=O	787541849	XIUIRQAXJHEOHG-UHFFFAOYSA-N	439.516	1.827	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)on2)cccc1N1CCNC1=O	787544558	UOPHDXJYOHSYPS-UHFFFAOYSA-N	448.439	1.579	50	20	IDGD	
CS(=O)(=O)[C@@H]1CCCC(=NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)C1	788418817	BFKQKZLXQRUOGY-QGZVFWFLSA-N	427.548	1.544	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)on1)c1ccc(N2CCCS2(=O)=O)cc1	789906201	OIYPNBVYVQCQNL-UHFFFAOYSA-N	426.454	1.956	50	20	IDGD	
O=C(NNc1cccc(F)c1[N+](=O)[O-])c1sccc1S(=O)(=O)N1CCOCC1	791069267	JLPQOKZHYUQJSN-UHFFFAOYSA-N	430.439	1.573	50	20	IDGD	
N#Cc1ccc(C[C@H](C#N)C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)cc1	792209257	MKIVKWLNFMYXEG-GOSISDBHSA-N	439.497	1.405	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(N2CCCCC2)c2ncccc12	792356111	MEZFLXRZVGYJDO-OAHLLOKOSA-N	443.504	1.363	50	20	IDGD	
C[C@H](NC(=O)c1ccc(Br)s1)C(=O)N([C@H]1CCS(=O)(=O)C1)N(C)C	792854063	INMNNKWNSTVLSO-UWVGGRQHSA-N	438.369	1.121	50	20	IDGD	
CCOC(=O)c1nn(C)cc1/C=C(/C#N)C(=O)Nc1cc2c(cc1[N+](=O)[O-])OCCO2	792865171	BKGLJKDJDZCZSV-WDZFZDKYSA-N	427.373	1.822	50	20	IDGD	
CN(C)S(=O)(=O)CCNC(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccccc1	794233615	ZVLBBZDCOTWOFN-GHRIWEEISA-N	426.502	1.378	50	20	IDGD	
CN(C)c1cc(C(=O)NN=C[C@@H]2CCCN(C(=O)CNC(=O)OC(C)(C)C)C2)ccn1	794510262	LTNLIVNDBGAPBL-HNNXBMFYSA-N	432.525	1.627	50	20	IDGD	
CCOC(=O)c1ccc(Br)c(S(=O)(=O)NNC(=O)c2cccc(C)n2)c1	794599846	QVKQCYJREKGQKQ-UHFFFAOYSA-N	442.291	1.953	50	20	IDGD	
CC(C)(C)c1csc(NC(=O)C(=O)NNC(=O)CNC(=O)OCc2ccccc2)n1	797369435	WWPBFJWMQABFLZ-UHFFFAOYSA-N	433.490	1.453	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2cccc(N3C(=O)c4ccccc4C3=O)c2)n1	797370075	FWHUEAUQFYDFMO-UHFFFAOYSA-N	443.419	1.590	50	20	IDGD	
Cc1n[nH]cc1-c1nnc(NC(=O)NNC(=O)CNC(=O)OCc2ccccc2)s1	797648922	KKTQCASDDHDFFK-UHFFFAOYSA-N	430.450	1.316	50	20	IDGD	
Cc1ccc(-n2cnnc2)c(C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)c1	797791347	FZWOXXWDTGHUEB-UHFFFAOYSA-N	427.490	1.252	50	20	IDGD	
Cn1c(=NNC(=O)CCC/N=C2/NS(=O)(=O)c3ccccc32)sc2ccccc21	798304224	ZBZHFUNWBJYWTB-UHFFFAOYSA-N	429.527	1.691	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNS(=O)(=O)c2cnc3ccccc3c2)ccc1Cl	800830824	JTDHKFSGHFOIBU-UHFFFAOYSA-N	440.890	1.159	50	20	IDGD	
O=C(CN1CCN(c2cncc3ccccc23)CC1)NNC(=O)c1cccc([N+](=O)[O-])c1	801950293	WUUOKBZOFSRCFN-UHFFFAOYSA-N	434.456	1.726	50	20	IDGD	
CC(C)CNC(=O)N1CCC[C@@H](C(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)C1	802068196	DUUMCGKXPJPCRC-CQSZACIVSA-N	439.538	1.320	50	20	IDGD	
CC[C@@H]1CN(C(=O)NNC(=O)c2ccc(OC)c(Br)c2)C[C@H](C)S1(=O)=O	805103829	FGRZSHRKWVZPNM-CMPLNLGQSA-N	448.339	1.710	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1cnn(C)c1-c1ccccc1	806974645	DYSXQRNSBMEMAD-ZDUSSCGKSA-N	425.420	1.780	50	20	IDGD	
O=C1COC[C@H](C[C@@H]2CN(C(=O)C(=O)NNc3ccc(Cl)cc3)c3ccccc32)N1	806997377	MEADSNYJRUQNFR-CJNGLKHVSA-N	428.876	1.819	50	20	IDGD	
O=C(NCc1cnc2n1CCCC2)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	807264381	JWFUBFFJNLDDTB-UHFFFAOYSA-N	446.533	1.148	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)c1ccc(Sc2nncn2C)c([N+](=O)[O-])c1	808045242	GGPNJLRQXJWCQP-UHFFFAOYSA-N	438.466	1.425	50	20	IDGD	
COc1ccccc1N(CCC(N)=O)C(=O)COC(=O)/C(C#N)=C\c1cc(C#N)n(C)c1C	809302239	CKSTUZBXSANYLB-YVLHZVERSA-N	449.467	1.573	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NN=C3C(=O)NC(=O)NC3=O)c3ccccc3n2)cc1OC	814215149	KZOLPJASCHCKMC-UHFFFAOYSA-N	447.407	1.371	50	20	IDGD	
CNS(=O)(=O)c1cc(NC(=O)NNc2ccccc2S(=O)(=O)N(C)C)ccc1C	814516467	NNQPSWSSMWVIFH-UHFFFAOYSA-N	441.535	1.302	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)[C@H](CC(C)C)N2C(=O)[C@H]3CC=CC[C@H]3C2=O)c1	825791649	ROKRNGPEHSPRQF-OTWHNJEPSA-N	442.516	1.620	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)c1ccc(F)c(S(=O)(=O)NC(C)C)c1	914880729	SVTPKHWXEPRJJH-UHFFFAOYSA-N	439.465	1.361	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)NCCOc1ccccc1F	915889471	AUMRWQBUDUGTIQ-UHFFFAOYSA-N	429.496	1.747	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1S(C)(=O)=O	916031007	CLLNRIHPCIDODV-UHFFFAOYSA-N	444.557	1.372	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)NCc2cn3ccsc3n2)c2ccccc2c1=O	916217820	CCQCHOHFHGTUIT-UHFFFAOYSA-N	425.474	1.831	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)NCc1nnc2ccc(C(F)(F)F)cn12	916222508	FXNBCHQFDAPQIG-UHFFFAOYSA-N	438.366	1.666	50	20	IDGD	
CCN(CC)c1ccc(CNC(=O)NNC(=O)c2nn(CC)c(=O)c3ccccc23)cn1	916389895	IHXFYFTXAOFWBU-UHFFFAOYSA-N	437.504	1.802	50	20	IDGD	
CN(C)[C@@H](CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)C1CCCCC1	916447852	GPDOGPINDZGCCO-SFHVURJKSA-N	439.582	1.391	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)NCCCN1CCN(c2ccccc2)CC1	916489598	OYHNWXYRIMHJIC-UHFFFAOYSA-N	429.496	1.747	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)c1ccccc1)C(=O)NNC(=O)c1ccc(Cl)nc1	917248961	IJMYDDQFUKJRBC-AWEZNQCLSA-N	442.950	1.596	50	20	IDGD	
Cc1ccc(Cl)c(O[C@H](C)C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1	917308303	ODSPZNQZSVIXDS-ACJLOTCBSA-N	448.859	1.946	50	20	IDGD	
C[C@]1(NNC(=O)NCc2cccc(NC(=O)c3ccc(F)cc3)c2)CCS(=O)(=O)C1	918102825	HYGXGSXSJWIJNZ-FQEVSTJZSA-N	434.493	1.959	50	20	IDGD	
Cc1ccc(CC(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)cn1	918199263	RWYAKLMNQOHRDA-UHFFFAOYSA-N	438.509	1.872	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1	918218982	AGHOOVQZPNASGW-UHFFFAOYSA-N	446.479	1.705	50	20	IDGD	
O=C(NC[C@@H]1Cc2ccccc21)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	919657922	CRLSBYZPPNSXFR-KRWDZBQOSA-N	428.514	1.755	50	20	IDGD	
CCOC(=O)c1ccc(CNC(=O)NNC(=O)c2nn(CC)c(=O)c3ccccc23)cc1	919919143	JDPZEHUKUKFPKN-UHFFFAOYSA-N	437.456	1.737	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccco2)c1	920212607	CLIZKDJAAAVCBZ-UHFFFAOYSA-N	443.481	1.770	50	20	IDGD	
CC(=O)N1CCN(c2ccc(C(=O)NNC(=O)NC3CCCCC3)cc2[N+](=O)[O-])CC1	920221927	PUCBNADFRSMKOC-UHFFFAOYSA-N	432.481	1.540	50	20	IDGD	
CS(=O)(=O)c1cc(C(=O)NNC(=O)c2cc(-c3ccccc3)on2)cc([N+](=O)[O-])c1	920285535	OFAKHWSXJPRQET-UHFFFAOYSA-N	430.398	1.728	50	20	IDGD	
Cc1nn(C(F)F)c(C)c1CC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	920879154	JJAVKAGMRNHALZ-UHFFFAOYSA-N	434.491	1.797	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)Nc1ccc(CN2C(=O)CNC2=O)cc1	920928472	GBDOQPMBVLDUJN-UHFFFAOYSA-N	449.427	1.096	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)Nc1cccc(CN2CCC[C@H]2C(N)=O)c1	920933373	NOXIWTRYKLLSFE-KDOFPFPSSA-N	443.479	1.896	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)NCc1cccnc1N1CCN(C)CC1	921247305	CZEXBAWYIWDPGO-UHFFFAOYSA-N	426.521	1.305	50	20	IDGD	
C[C@@H]1CN(CCCNC(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)C[C@@H](C)O1	1318620639	HTKCEQRSERJWFR-HZPDHXFCSA-N	441.573	1.463	50	20	IDGD	
CCNS(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2cncn2-c2ccccc2)cc1	1319270396	XCJLSPZOLMCBEK-UHFFFAOYSA-N	442.501	1.315	50	20	IDGD	
COc1ccc(Cl)cc1CCNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1	1321761579	NKNPVEFVBSPPII-UHFFFAOYSA-N	432.912	1.928	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ncoc2[C@@H]2CCCO2)c1	1339125903	MVVWCQSHYLLXGH-HNNXBMFYSA-N	436.490	1.631	50	20	IDGD	
C[C@H]1CCC[C@@H]1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1	1779372207	BQZLQAGCEQQZAO-NBZRVGKJSA-N	443.548	1.249	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](C)S)CCO2	1780098492	MWISULIDCHOEHN-BUXKBTBVSA-N	437.474	1.282	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)NC(=O)OC(C)(C)C)C2	1780707095	HCVLKCISUNITCJ-XGNBGGDFSA-N	447.960	1.361	50	20	IDGD	
CCCc1ccc(C(=O)N2CC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)cc1	1780848328	XIDYYDZKTJWHGF-QHCPKHFHSA-N	430.549	1.456	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2)c1ccc(-c2cc[nH]n2)cc1	1781064434	IGQWZCAWKOPLDP-WOIUINJBSA-N	446.935	1.804	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](CCO)NC(=O)OC(C)(C)C)CCO2	1781211506	VYXGHQJOIXLFKZ-AUSJPIAWSA-N	447.960	1.109	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H]1CCN1C(=O)OC(C)(C)C)CCO2	1781217266	HDVCJDVMEWXZOW-SXGZJXTBSA-N	429.945	1.843	50	20	IDGD	
O=C(Cn1cnc2ccccc21)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781332764	FACXMTMGTVRRIN-AEFFLSMTSA-N	439.285	1.557	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc([N+](=O)[O-])cc3F)C2)C1	1781555382	ZHNDPYDRQZGICC-RDTXWAMCSA-N	429.832	1.431	50	20	IDGD	
Cc1noc(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](C)Br)C2)n1	1781998508	ZQFHXVCYLPCVGM-CJBNDPTMSA-N	429.315	1.218	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(O)c(OC)c1)C2	1782173923	TZSUAIUNFZPTCW-FQELHTAISA-N	440.924	1.782	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1c(C)nn(C)c1C)C2	1782178612	PPBPXCYJAAWVLU-WAOWUJCRSA-N	440.972	1.347	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccccc3-n3nccn3)CCO2)C1	1783537787	RLKAPYHHWQHWOI-AUUYWEPGSA-N	448.321	1.494	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3n[nH]c4cccc(F)c34)CCO2)C1	1783538488	XRRLZPODKLZCSI-BBATYDOGSA-N	439.285	1.929	50	20	IDGD	
CCSc1ncccc1C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](Cl)COC)C2)C1	1783869068	NKYHBMYLGBPLMS-DNVCBOLYSA-N	427.954	1.891	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CCc4cccc(Cl)c43)C[C@@H]21)[C@@H](O)CCl	1784094762	RBJVKSTYLCLTEI-CRCOGDFISA-N	441.355	1.949	50	20	IDGD	
O=C1CSc2ncc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]4C3)cc2N1	1787449201	CYKXGWAHTCXQNC-YARBFKLUSA-N	442.900	1.254	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4occc4c3)[C@H]2C1	1788013800	WSJZAOOQZSHABB-BJLQDIEVSA-N	442.516	1.399	50	20	IDGD	
O=C(CC1CCOCC1)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1	1788140617	BCEHWDFEDGFJMM-UHFFFAOYSA-N	436.317	1.931	50	20	IDGD	
C[C@@H](Br)C(=O)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1	1788149476	XCELMVUZKCPNTK-CYBMUJFWSA-N	445.122	1.898	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc4ncccn4n3)[C@H]2C1	1788304018	JLLGXPPHSSMHPO-ZOBUZTSGSA-N	431.569	1.174	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccnc(Cl)n3)[C@H]2C1	1788877585	CMWXIEXFGBUCQU-MNXVOIDGSA-N	445.745	1.897	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc(F)cn3)C[C@@H]21	1789866040	LICRSUJILYXNRL-BMYCAMMWSA-N	432.323	1.979	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]3C2)o1	1789925733	IIGRYPCLWMEKRW-UHXUCMFUSA-N	446.273	1.522	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc4ccccn34)C[C@@H]21)[C@@H](F)Br	1789925753	ISUCXTFCBGHYLI-LMRQPLJMSA-N	439.285	1.618	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)Nc1ccc(C2(NC(=O)CN3C(=O)CNC3=O)CCC2)cc1	1790489479	TZOBVSXAJSNEFL-SFHVURJKSA-N	441.315	1.909	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3c(F)c(C)nn3C)C[C@@H]21	1790960665	AGYZRVLFOQDPPK-FQUUOJAGSA-N	445.333	1.634	50	20	IDGD	
CC[C@H]1CC[C@H](C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)CC1	1791103736	VZLRZCIUAYDVQH-XWCXQPFMSA-N	442.365	1.176	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC1(c2ccc(NC(=O)CCc3cnccn3)cc2)CCC1	1791899065	ZJYCBQLCSMZWJD-UHFFFAOYSA-N	438.532	1.916	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(S(C)(=O)=O)c1	1792772292	LYGIBVIBLNFLAF-JYYAWHABSA-N	428.938	1.596	50	20	IDGD	
Cc1nnc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCBr)C3)s1	1794106391	NDVKTFMFULZUDY-DRXBFXEBSA-N	431.356	1.154	50	20	IDGD	
O=C(CNc1ccc(F)cc1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2	1795542070	OQVNECSKZVHFQW-OJXGSEEGSA-N	432.265	1.518	50	20	IDGD	
COc1ccc2cc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3ccc(B(O)O)cc3)[nH]c2c1	1796189119	YEGCAPAHYZTVDA-REPLKXPHSA-N	447.300	1.422	50	20	IDGD	
COc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Cl)cc(C(F)(F)F)n1	1796366475	WXKXXZJTQCUBGV-DJBIQUGXSA-N	439.793	1.847	50	20	IDGD	
COc1ccc(-c2cc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@H](O)CCl)C4)no2)cc1	1796498714	MSCSXZXTHIIKBB-QOIYZWAUSA-N	449.891	1.153	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CC1CCOCC1)C2	1796892356	XGMHYCLPXSICSZ-XMYAHUOOSA-N	429.521	1.575	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](C)n1ccnc1C)C2	1796893007	GPKLFLHNWWNMLX-ILMZPKKMSA-N	439.520	1.525	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2ccc(OC)cc2[nH]1	1796918832	YDUZZSGDSOTUIG-QHHYFVSCSA-N	435.908	1.634	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1n[nH]c2ccccc12	1797414079	HXOXPVMWRDTJPK-FJHTZYQYSA-N	425.258	1.457	50	20	IDGD	
COc1cccnc1CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Br	1799344412	LQOGVYZPEIRXJW-CZAMWMTLSA-N	444.301	1.303	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)[C@@H]1CCc2cccc(Cl)c21	1800325465	CDBYIWFAPYPTBU-WVYJYSKYSA-N	427.328	1.559	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cocn1)C2	1800332515	LOHJGNGDLJKANU-PSKFDLRZSA-N	428.395	1.763	50	20	IDGD	
CCCNC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](Br)CC	1800638306	XYLUNFFIAKKEGP-UMPJEAMMSA-N	432.359	1.056	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1cncnc1)C2	1800639001	FYAIOPAHDYUPPQ-JYYAWHABSA-N	425.327	1.172	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1[nH]nc3ncccc13)C2	1800639951	QZJZPFKZAZJNKR-ZMJPVWNMSA-N	436.310	1.335	50	20	IDGD	
Cn1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C(Cl)Cl)c(C(F)(F)F)n1	1801017102	NFIMLHKOHJOKTF-DIYOJNKTSA-N	429.226	1.446	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(N3CCCC3)ccn1)C2	1802336051	FMTNUGHHVULJOA-GGPHIMKMSA-N	442.564	1.307	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc3nonc3c2)[C@H]1c1cccnc1)[C@H](O)CCl	1803139719	UGMMSCITPVXBRK-QGTPRVQTSA-N	429.864	1.537	50	20	IDGD	
COc1ncc(C(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)cc1C	1803140335	CJVOCTNMZKJNDV-NXHRZFHOSA-N	432.908	1.713	50	20	IDGD	
COc1cccnc1CCC(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1	1804453369	ICXIFBREYAXUQR-YRISNDGFSA-N	446.935	1.724	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@H]1c1cccnc1)c1ccc(O)nn1	1805274756	GTXATFRUDLMRNY-CQDKDKBSSA-N	438.257	1.587	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCC2(CCCN(C(=O)C[C@H]3NC(=O)NC3=O)C2)CC1	1806849905	YZQAZKNNPJXKRJ-SJKOYZFVSA-N	433.336	1.052	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)c2ccc(O)cc2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807368106	YLNDGWFIHPCIBG-DENIHFKCSA-N	445.284	1.100	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)c2ccc[nH]2)[C@H]1c1cccnc1	1808417933	UABQGGNHVAPAQV-RYUIIRDCSA-N	447.499	1.863	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2cnc3[nH]ncc3c2)[C@H]1c1cccnc1	1809712207	CDCHWOUMYCSVAM-JCGIZDLHSA-N	442.907	1.926	50	20	IDGD	
CC(C)n1nccc1C(=O)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1	1809971004	HTNXPYQWAOSHHE-UHFFFAOYSA-N	438.337	1.302	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)c3ncc(F)cc3F)CC2)C1	1809977991	QIQAXKDIYYSYLP-UHFFFAOYSA-N	443.259	1.198	50	20	IDGD	
CC(=O)NCCC(=O)NC[C@@H]1CCN(C(=O)[C@@](C)(Cl)CCl)[C@@H]1c1cccnc1	1812661425	KBWXUHATCQEWIN-WDYCEAGBSA-N	429.348	1.850	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cncnc2)n[nH]1	1816508014	GHUKOCRUKHIOTA-ROCQKPIASA-N	449.475	1.640	50	20	IDGD	
O=C(CCBr)Nc1cc([C@@H]2CCCCN2C(=O)CN2CCCC2=O)[nH]n1	1816782241	LPUAMNOHIXXXRT-ZDUSSCGKSA-N	426.315	1.809	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@H]2C[C@]2(F)Cl)[nH]n1)c1cccc(B(O)O)c1	1817479342	LCLVIDHWAWFTQV-FRIZHTMISA-N	434.664	1.320	50	20	IDGD	
C[C@H](NC(=O)c1cnccn1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](F)Cl)n[nH]1	1818039847	JQOUPHOKXYTEEX-ZBINZKHDSA-N	437.863	1.545	50	20	IDGD	
Nc1n[nH]c(CCC(=O)Nc2cc([C@@H]3CCCCN3C(=O)CCBr)[nH]n2)n1	1819282693	KBCHQAHIIZQCCC-NSHDSACASA-N	439.318	1.520	50	20	IDGD	
O=C(/C=C1\C(=O)Nc2ccccc21)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](O)CCl)CC2	1819617517	FVHHVVDBLJBOCE-SDYJPDCYSA-N	446.916	1.691	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)c3ccoc3Cl)sc2C1	1821815865	PPMSHAIYSDKVEH-JTQLQIEISA-N	439.925	1.988	50	20	IDGD	
CCNC(=S)NCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](C)Br)CC2	1824509381	MDOONBDDRBQYOB-DTWKUNHWSA-N	448.412	1.323	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCn1cncn1)CC2	1825647561	QAQQVGDUNZQOSB-UWVGGRQHSA-N	427.328	1.520	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cn3cccnc3n1)CC2	1825999646	BHXNEAGPKNACPP-GHMZBOCLSA-N	434.909	1.665	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCBr)CC1	1827560643	WLHBZNYEGWVUEI-LSDHHAIUSA-N	431.375	1.838	50	20	IDGD	
CCS(=O)(=O)N[C@H](C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H](F)Cl)CC1	1827608265	NWIWVRZNLNRBSC-SNPRPXQTSA-N	425.954	1.468	50	20	IDGD	
C[C@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H](F)Cl)CC1)[C@@H]1SC(=N)NC1=O	1827666591	BWRBPEQAANTPLY-AHLTXXRQSA-N	432.949	1.943	50	20	IDGD	
Cc1ccc(F)cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)Br)C2)C1	1830079603	NLXBFOXOEIRJGY-IFXJQAMLSA-N	443.313	1.988	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccnc(Cl)n3)C2)C1	1830365543	YMRQOLXMHVQHIN-SFHVURJKSA-N	431.320	1.465	50	20	IDGD	
CC(C)(C)c1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)cn1	1830720119	TUTOCOQSEGRLTN-IERDGZPVSA-N	439.940	1.049	50	20	IDGD	
O=C(C(Cl)Cl)N1CCC([C@H]2CCCCN2C(=O)COc2ccc(O)nn2)CC1	1831116923	SVIZUZZAYOZPPY-CYBMUJFWSA-N	431.320	1.984	50	20	IDGD	
C=CCOCCCC(=O)N1CCO[C@@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1	1831410907	HEVIVQQMPUUWKJ-FQEVSTJZSA-N	428.602	1.277	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)C(F)(F)Cl)CC1	1832017923	XKQDYUUUNXLOCM-INIZCTEOSA-N	428.672	1.431	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](C)C3(O)CCC3)CC2)CC1	1833071583	HYCZUJSBYXIVGE-CRAIPNDOSA-N	429.989	1.363	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCC(N2CCC(NC(=O)c3cccnc3C(N)=O)CC2)CC1	1833918509	WAPZGKGIJRNLBF-UHFFFAOYSA-N	449.983	1.631	50	20	IDGD	
CN(C)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)[C@@H](F)Cl)CC2)CC1	1834015762	NYRSNWNJLJERTR-GOSISDBHSA-N	425.936	1.867	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1)c1ncccn1	1834233172	BAVZSIMPJIYSEY-CQSZACIVSA-N	428.306	1.352	50	20	IDGD	
CCc1oncc1C(=O)NC1CCN(C2CCN(C(=O)[C@@H](Cl)COC)CC2)CC1	1834313580	LPRHSGGWDLMYSO-KRWDZBQOSA-N	426.945	1.676	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CCC(N2CCC(NC(=O)[C@H](F)Cl)CC2)CC1	1835083927	ZUTGQDLZADUQBR-KSZLIROESA-N	443.947	1.848	50	20	IDGD	
CCNC(=O)N[C@@H](C)C(=O)NC1CCN(C2CCN(C(=O)C(C)(C)CCl)CC2)CC1	1835706021	HDRPPGGXMBEHBG-HNNXBMFYSA-N	444.020	1.531	50	20	IDGD	
Cc1n[nH]cc1C(=O)NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1836155464	WUGITYGQGTWPGY-OAHLLOKOSA-N	430.322	1.594	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3[nH]nc4ccncc34)CCO2)C1	1836446056	VBCGNUUNCWGBSF-HXUWFJFHSA-N	435.912	1.293	50	20	IDGD	
C[C@H](C(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1)n1cccc1C=O	1836716547	BELFDURXMPKCLY-DNVCBOLYSA-N	439.940	1.460	50	20	IDGD	
C[C@H]1CCc2c(C(=O)N3CCC(OC4CCN(C(=O)[C@@H](O)CCl)CC4)CC3)n[nH]c21	1836717070	GPYJLNQFMIFKFE-GUYCJALGSA-N	438.956	1.671	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)c3cnsn3)CC2)CC1	1837298329	AYOBCJCETKTLDV-NSHDSACASA-N	431.356	1.934	50	20	IDGD	
COc1ccnc(C(=O)N2CCOC[C@@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)c1	1837715440	QERUEOHQMJKYIG-HXUWFJFHSA-N	437.569	1.012	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(F)nc3)CCO2)C1	1837846888	SXGRBUUYNTYTRF-MSOLQXFVSA-N	434.295	1.527	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CC34CCCN3CCC4)CCO2)C1	1839118817	QWBOQIJPHAMHQU-UWJYYQICSA-N	427.973	1.479	50	20	IDGD	
Cc1nc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)ccc1F	1839151386	PNLMPVZRXKCHRG-RBUKOAKNSA-N	448.322	1.835	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)cc(O)n1	1839152230	RKGCCNHINKAQGS-RBUKOAKNSA-N	446.331	1.402	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3nccs3)C2)C1	1839963319	HRORBUZBKUJOKV-MLGOLLRUSA-N	432.340	1.387	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3ccco3)C2)C1	1840031360	NKSAKQJTZUFKFS-RDTXWAMCSA-N	429.311	1.452	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)/C=C/c3ccsc3)C2)C1	1840150263	IJOSKJYNFRCXKJ-AKWDPIGTSA-N	428.938	1.472	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3nc4ccccc4o3)C2)C1	1840154599	ADGXRVXLSAKDLM-JLTOFOAXSA-N	437.880	1.152	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3c(C)cccc3Cl)C2)C1	1840155001	MLCNYLRJZMUULA-OXQOHEQNSA-N	445.343	1.972	50	20	IDGD	
O=C(c1cn2c(F)cccc2n1)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840190025	ZGSGORLMWPTZGO-GOSISDBHSA-N	445.278	1.347	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)Oc1cccnc1)CCO2	1840449789	KMHPGUGXHFUJRA-DJPFJPOOSA-N	439.940	1.713	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1cc(C)cnc1Cl)C2	1843415426	GUCDKGLUNJTQKF-AFUMVMLFSA-N	442.907	1.994	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)c2cc(-c3cccs3)on2)C1	1844473397	DOFBPTZFKDFBMJ-UHFFFAOYSA-N	437.286	1.214	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)c2ccc(OC(F)F)cc2F)C1	1844713106	PYPLLGZKZYLBND-UHFFFAOYSA-N	442.438	1.617	50	20	IDGD	
CO[C@H](C)[C@@H](C(=O)N1CCCC12CN(C(=O)[C@@H](F)Cl)C2)N(C)C(=O)OC(C)(C)C	1845092353	PRNYGPKKJIUWQU-HZSPNIEDSA-N	435.924	1.995	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@H]1[C@H]3CN(C(=O)OC(C)(C)C)C[C@H]31)C2	1846364836	MLRWUQXAZWMHGE-FZKCQIBNSA-N	441.956	1.557	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)on1	1848095581	ATTNVFJLOCUNNT-IHRRRGAJSA-N	426.901	1.931	50	20	IDGD	
O=C(CCCNS(=O)(=O)c1ccc(F)cc1)NNC(=O)COc1ccc(F)cc1	16069301	NAKAAJFPTPJRNN-UHFFFAOYSA-N	427.429	1.250	50	20	IDGD	
C[C@@H]1CC(C)(C)C[C@]2(C1)NC(=O)N(CC(=O)NNC(=O)c1cc(Cl)ccc1O)C2=O	105349504	OIXGZDFXFFVWPL-GIPWTMENSA-N	436.896	1.943	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)CN2C(=O)N[C@@]3(CCCC[C@H]3C)C2=O)cc1	195489474	MEIJXMHLNGHORJ-DOQJBMMISA-N	446.504	1.501	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)N1CCC(C(=O)c2ccc(O)cc2)CC1	725872115	AVPGCBNOZCJZFL-UHFFFAOYSA-N	430.486	1.519	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NNc2nc(-c3ccncc3)no2)ccc1OC	726370938	VXEASVQJHTYOFE-UHFFFAOYSA-N	446.489	1.928	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)COc1ccc(Br)cc1)C(=O)N1CCCC[C@H]1C	726615477	AUIDXSAARCRZFJ-OLZOCXBDSA-N	441.326	1.948	50	20	IDGD	
CN(C)N(C(=O)c1cc(S(=O)(=O)N2CCCC2)ccc1Cl)[C@H]1CCS(=O)(=O)C1	728180529	WDDZFPSGEOYNSL-ZDUSSCGKSA-N	449.982	1.230	50	20	IDGD	
CC(C)[C@H](C(=O)NNC(=O)c1nnc(O)c2ccccc12)S(=O)(=O)C1CCCCC1	728512643	VWLZMZQAOIBAOJ-QGZVFWFLSA-N	434.518	1.869	50	20	IDGD	
CC1=C(C(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)C(=O)OC1(C)C	729298386	DSLSPZFFGDJWER-UHFFFAOYSA-N	446.463	1.858	50	20	IDGD	
CCC[C@H](NC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)c1ccccn1	729613823	VUBJPEBYCQFDQJ-SFHVURJKSA-N	447.565	1.580	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)c2ccc(Cl)c(S(=O)(=O)N(C)C)c2)cn1	729691914	FONCJYVCRKMYKB-UHFFFAOYSA-N	443.938	1.625	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)C(C)(C)c2ccccc2)cc1	731175018	LTIOVZRKABAQSG-UHFFFAOYSA-N	446.529	1.391	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)N1CCN(S(=O)(=O)c2ccc3ccccc3c2)CC1	731848990	QCYPGHRIYOZXBP-QGZVFWFLSA-N	446.573	1.728	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C2CCN(C(=O)N(C)C)CC2)cc1Br	732034085	XXGIYLDMXCNMMP-UHFFFAOYSA-N	427.299	1.612	50	20	IDGD	
O=C(CSc1nccn1-c1ccc(C(F)(F)F)cc1)NNC(=O)C(=O)N1CCCC1	732066600	SRABOCVZTIVPPX-UHFFFAOYSA-N	441.435	1.753	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)N[C@@H](Cc1ccccc1)CN1CCOCC1	732476279	CPFVLONUOVFZQU-NRFANRHFSA-N	440.544	1.902	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)N[C@@H]2CCN(C3CCN(C)CC3)C2)cc1	734284064	PVFSAWHJZUKAOT-DLBZAZTESA-N	433.553	1.352	50	20	IDGD	
CCCOc1cccc(C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)c1	735117655	FCVCASVFQDNEFH-UHFFFAOYSA-N	433.534	1.563	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@@H]2CCC[C@H]2NC(=O)OC(C)(C)C)c2ccccc2c1=O	739679125	PHVYPAIQIGENEP-HZPDHXFCSA-N	443.504	1.871	50	20	IDGD	
CCOc1cc(C#N)cc(Br)c1OCC(=O)NNc1ncnc2[nH]cnc12	740746403	AAXAQXSGUHPOIO-UHFFFAOYSA-N	432.238	1.908	50	20	IDGD	
CC(C)[C@H](C(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)N1C[C@@H](C)O[C@H](C)C1	741024993	BNYDSUWBCREBQP-HBUWYVDXSA-N	436.465	1.033	50	20	IDGD	
CS(=O)(=O)CC[C@H](Cc1cccc(Br)c1)C(=O)NNC(=O)NCC1CC1	741212080	MPIYWWDTTPIFPU-CQSZACIVSA-N	446.367	1.783	50	20	IDGD	
O=C(NNC(=O)c1ccccc1F)c1ccnc(C(=O)NNC(=O)c2ccccc2F)c1	741447014	JIBFVKNVIYKCFQ-UHFFFAOYSA-N	439.378	1.509	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=S)N[C@@H]2CCOc3ccccc32)ccc1Cl	741478378	YQKVRSUBAYHHOF-CYBMUJFWSA-N	440.934	1.620	50	20	IDGD	
CS(=O)(=O)c1ccc(Cl)c(C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)c1	741825716	KPXYTFPJOYDNFS-UHFFFAOYSA-N	435.845	1.233	50	20	IDGD	
CNC(=O)c1cccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)c1	742032402	GWEDSTJDHJQTBD-UHFFFAOYSA-N	444.513	1.296	50	20	IDGD	
NC(=O)[C@H]1CC(C(=O)NNC(=O)c2cc(Br)ccc2O)=NN1c1ccccc1	743731950	FAVMJAJUIGLSPF-CQSZACIVSA-N	446.261	1.036	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1ccc(Br)cn1	744620687	MUTHNOVLLAFAMA-UHFFFAOYSA-N	441.307	1.622	50	20	IDGD	
C[C@H]1CN(c2ccc(CNC(=O)NNC(=O)c3cc([N+](=O)[O-])ccc3O)cn2)CCO1	745466911	FQLGWPBZJOONQO-LBPRGKRZSA-N	430.421	1.065	50	20	IDGD	
COc1cc(C)nc(NNC(=O)[C@H]2CCC[C@@H](C(=O)NNc3nc(C)cc(OC)n3)C2)n1	746632898	LCCSBJOVUXNDLS-OKILXGFUSA-N	444.496	1.293	50	20	IDGD	
COC1(CNC(=O)NNC(=O)[C@H](C)Oc2cccc(Br)c2)CCOCC1	746703459	HYCBFZCJJJMGPQ-LBPRGKRZSA-N	430.299	1.742	50	20	IDGD	
COCCCn1c(S)nc2cc(C(=O)NNC(=O)Cc3ccncc3)ccc2c1=O	747429749	RHRFHPLBFDBAMT-UHFFFAOYSA-N	427.486	1.120	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NC2CCN(C3CCN(C)CC3)CC2)ccc1OC(C)C	747990206	FKPRVHRBRQSQOI-UHFFFAOYSA-N	447.580	1.985	50	20	IDGD	
Cc1nn(C)c(C)c1S(=O)(=O)N[C@@H](C)C(=O)NNc1ccccc1Br	748058838	YVBPJIIQPZEBQR-JTQLQIEISA-N	430.328	1.610	50	20	IDGD	
COc1ccccc1-c1nn(-c2ccccc2)cc1C(=O)NNC(=O)C(=O)N1CCCC1	748247829	XZFGGDWBMPWWPR-UHFFFAOYSA-N	433.468	1.931	50	20	IDGD	
O=C1C[C@@H](Cc2ccc(C(=O)NNc3nc(-c4ccccn4)nc4c3CCC4)cc2)C(=O)N1	748341077	NNVLWCXSTIUKFL-MRXNPFEDSA-N	442.479	1.989	50	20	IDGD	
O=C(O)Cc1ccc(S(=O)(=O)NNC(=O)c2cc(F)ccc2Br)cc1	748643254	QDMHYGZUNFMUDF-UHFFFAOYSA-N	431.239	1.839	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)N1CCCN(C(=O)Cc2cccc(F)c2)CC1	749112580	ZIQXZSDTRPOLOE-UHFFFAOYSA-N	442.491	1.860	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)N[C@@H]1CCN(c2cccc(Cl)c2)C1	751101373	DXNYWNJSVBAGBD-OAHLLOKOSA-N	426.868	1.539	50	20	IDGD	
CO[C@@H](C)c1nc(CN2CCCN(C(=O)NNC(=O)Cc3cccnc3)CC2)cs1	752369951	LYXBNTATQKZKHZ-HNNXBMFYSA-N	432.550	1.737	50	20	IDGD	
O=C(COCCNC(=O)c1ccccc1)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1	752631192	BPEPPAMGPDMXCH-UHFFFAOYSA-N	445.419	1.870	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN[C@H](C)[C@H]2CCCN(C(=O)OC(C)(C)C)C2)n1	754319495	QRAOIRGOIIRWRE-CABCVRRESA-N	439.582	1.767	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)C(C)(C)CN(C)C	754378644	OVSMZTDNNWMZJF-OAHLLOKOSA-N	439.582	1.391	50	20	IDGD	
O=C(NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)N[C@@H]1[C@H]2CCO[C@@H]2C12CCC2	754675444	OBJHVMVXPFAJCA-KURKYZTESA-N	448.545	1.373	50	20	IDGD	
CCOCC(=O)NNC(=O)Nc1cc(S(=O)(=O)N2CCCCC2)ccc1N(C)C	755435231	NCKZYQLFKZNHDG-UHFFFAOYSA-N	427.527	1.116	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NC1CCN(S(=O)(=O)C(C)(C)C)CC1	755896692	VCLRMRLWZXGYJO-ZDUSSCGKSA-N	444.529	1.516	50	20	IDGD	
C=CCN(C)S(=O)(=O)c1ccc(NC(=O)NNC(=O)COc2ccccc2OC)cc1	755932205	LBOXXVUGBXWJEW-UHFFFAOYSA-N	448.501	1.733	50	20	IDGD	
Cc1csc(Sc2ccc(NC(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)cc2)n1	756172429	AGFVJYHUCFBRJK-JTQLQIEISA-N	429.549	1.693	50	20	IDGD	
COc1ccccc1Oc1ccc(NC(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)cc1F	756211422	JHKIZQWWIMMHCU-NSHDSACASA-N	440.453	1.717	50	20	IDGD	
CC(=O)N1CC[C@@H](NC(=O)NNC(=O)c2csc(N3CCOCC3)n2)c2ccccc21	757003508	PCGMROKYYCWIJR-OAHLLOKOSA-N	444.517	1.422	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)Nc1ccc(C(=O)NC2CCOCC2)cc1	757618888	GIZQLHXFJDXOCP-UHFFFAOYSA-N	437.456	1.699	50	20	IDGD	
Cn1cc(NC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])cc(Br)c1=O	757689616	MDDCVTORIFJOAG-UHFFFAOYSA-N	440.210	1.288	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)cn1	757732476	GOFHFKGNHVJDCE-UHFFFAOYSA-N	447.517	1.196	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)Nc2cnc3c(c2)C[C@@H](NC(=O)OC(C)(C)C)CC3)n[nH]1	757927840	MBRUKRARUPJLIE-ZDUSSCGKSA-N	429.481	1.962	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)C2(NC(=O)OC(C)(C)C)CC2)c2ccccc2c1=O	760279109	HOLSUKGXTBRRHN-UHFFFAOYSA-N	429.477	1.796	50	20	IDGD	
C[C@@H](CC(=O)NNC(=O)Cn1ccc2ccccc21)NS(=O)(=O)c1cccnc1Cl	760539851	GUFOANNODBCMQR-ZDUSSCGKSA-N	449.920	1.594	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2ccc(OCC(F)F)nc2)c2ccccc2c1=O	761201977	YGIZNNOVFOUDAU-UHFFFAOYSA-N	431.399	1.920	50	20	IDGD	
O=C(NNC(=O)c1ccn(C2CCCC2)n1)c1cccc(S(=O)(=O)N2CCCC2)c1	763109295	RDWWPTGQFRHWQK-UHFFFAOYSA-N	431.518	1.858	50	20	IDGD	
CC(C)(C)OC(=O)N1CCc2c(NC(=O)C(=O)NNC(=O)c3ccncc3)cccc21	763462361	NVOHKYNICOESLV-UHFFFAOYSA-N	425.445	1.779	50	20	IDGD	
CN(Cc1cccc(NC(=O)C(=O)NNC(=O)c2cccnc2)c1)C(=O)OC(C)(C)C	763488937	ROLCZCJYRPWUTA-UHFFFAOYSA-N	427.461	1.848	50	20	IDGD	
NC(=O)c1ccccc1N1CC[C@@H](NC(=O)NNC(=O)CSc2ccccc2O)C1	763506484	GCJMCYTUTQCBLR-CYBMUJFWSA-N	429.502	1.193	50	20	IDGD	
O=C(NNC(=O)c1c[nH]c2ccccc12)C(=O)Nc1cccc(S(=O)(=O)NC2CC2)c1	763535420	CAWAUQNANZUNDT-UHFFFAOYSA-N	441.469	1.008	50	20	IDGD	
C#CCOc1ccc(NC(=O)C(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)cc1	763538944	HBRRQYFIBKDZNK-UHFFFAOYSA-N	427.413	1.124	50	20	IDGD	
O=C1CN(S(=O)(=O)c2cccc(C(=O)NNc3c(Cl)cccc3Cl)c2)CCN1	763609189	OJOWKBAZCACCJJ-UHFFFAOYSA-N	443.312	1.871	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N2CCC[C@@H](S(C)(=O)=O)C2)cc1Br	763662324	XIAVLRVLRXLBBP-LLVKDONJSA-N	434.312	1.321	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2ccccc2SCCC(N)=O)c1	763668579	NTUGKNONZVVBEU-UHFFFAOYSA-N	444.513	1.436	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2cccc(Cl)c2C)c2ccccc2c1=O	763787345	XTVIXGQADRSTJS-UHFFFAOYSA-N	427.848	1.778	50	20	IDGD	
CN(Cc1ccccc1)Cc1cccc(C(=O)NNC(=O)CNC(=O)c2cccnc2)c1	763819917	HYXRNCHYVWLKHE-UHFFFAOYSA-N	431.496	1.905	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccc(-n2cnc3ccccc32)nc1	763840351	UBAUUUPYCGMOPZ-UHFFFAOYSA-N	448.414	1.725	50	20	IDGD	
C[C@H]1COCCN1c1ccc(NC(=O)C(=O)NNC(=O)Cc2ccc(Cl)cc2)cc1	763930449	ANPUJQMFPBVLLG-AWEZNQCLSA-N	430.892	1.894	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)CSc2ccccc2O)cc1NS(C)(=O)=O	763966616	HTSPFRCWUMQDPZ-UHFFFAOYSA-N	440.503	1.717	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1cccc(OC(F)(F)F)c1	764003174	BIAXMDBKJGQSFP-UHFFFAOYSA-N	425.319	1.756	50	20	IDGD	
COC(=O)c1cc2cc(NC(=O)C(=O)NNC(=O)c3ccc4c(c3)OCCO4)ccc2o1	764003913	JYFOFTRXKOLSAU-UHFFFAOYSA-N	439.380	1.390	50	20	IDGD	
CC[C@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(OC)c(S(=O)(=O)N2CCCCC2)c1	764082419	NTAREPSTVXXAQM-ZDUSSCGKSA-N	440.522	1.002	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc4c(c3)C(=O)NCC4)n[nH]2)cc1	764112264	ZJKBADVZRLWHLN-UHFFFAOYSA-N	432.440	1.071	50	20	IDGD	
COC(=O)c1c(NC(=O)C(=O)NNC(=O)CCc2ccc(OC)cc2)sc(C)c1C	764126222	HREVYFOTJLPXBP-UHFFFAOYSA-N	433.486	1.879	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(N3CCCC3=O)c(F)c2)c1O	764132155	LHVGPLGHYAKOIW-UHFFFAOYSA-N	430.392	1.066	50	20	IDGD	
CC[C@@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)Cc2ccccc2OC)cc1	764132464	OKRGSBYPFATNHN-CQSZACIVSA-N	426.473	1.552	50	20	IDGD	
O=C(CCCc1ccccc1)NNC(=O)C(=O)Nc1ccc(C[C@H]2CC(=O)NC2=O)cc1	764223899	MWRUDBXRHBNESM-KRWDZBQOSA-N	436.468	1.001	50	20	IDGD	
NC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cc(F)ccc2Br)ccc1F	764270198	HPSZAGJLCALRPA-UHFFFAOYSA-N	441.188	1.226	50	20	IDGD	
Cc1ccc(C)c(-n2ncc(NC(=O)C(=O)NNC(=O)COc3ccccc3O)c2C)c1	764275591	OFJJMYUACMHKMY-UHFFFAOYSA-N	437.456	1.668	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1ccc(Cl)c(C(=O)NC2CC2)c1	764278337	WHIWGBSAJPGUCT-UHFFFAOYSA-N	446.847	1.103	50	20	IDGD	
CC(=O)N(C)c1cccc(NC(=O)C(=O)NNC(=O)c2cc(Br)ccc2O)c1	764281114	YPVXNOWOHDBWQR-UHFFFAOYSA-N	449.261	1.537	50	20	IDGD	
CC(=O)Nc1c(C)ccc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c1C	764343540	SCCNQVXAQIOOPX-UHFFFAOYSA-N	434.456	1.847	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)Cc2ccncc2)sc2c1CC[C@@H](C)C2	764356231	QZWASNSUGZQXRC-GFCCVEGCSA-N	444.513	1.773	50	20	IDGD	
CC(C)Cc1noc(-c2cc(Cl)ccc2NC(=O)C(=O)NNC(=O)c2cnn(C)c2)n1	764362243	BXXCALRLICNUTH-UHFFFAOYSA-N	445.867	1.722	50	20	IDGD	
CN(C)C(=O)c1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)COCc1ccccc1	764367420	WOFQADRZDHFROL-UHFFFAOYSA-N	432.864	1.345	50	20	IDGD	
CC[C@@H](C)NS(=O)(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(C)o2)c1	764370317	QDDGDNVQTUHVOJ-GFCCVEGCSA-N	436.490	1.206	50	20	IDGD	
COC(=O)c1ccc(C)c(NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)c1	764382325	GUKIJFOXMUXMFK-UHFFFAOYSA-N	427.442	1.633	50	20	IDGD	
COC(=O)c1ccc(C)c(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)c1	764386952	FTVOZLCTDBDJFK-UHFFFAOYSA-N	439.403	1.711	50	20	IDGD	
Cc1nc(C)n(-c2ccccc2NC(=O)C(=O)NNC(=O)CSc2ccccc2O)n1	764401958	UPKSUADOJLANMZ-UHFFFAOYSA-N	440.485	1.468	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)CCC(=O)N2CCN(c3ccccc3)CC2)c1	764525324	OXEJGRYARZKZIZ-UHFFFAOYSA-N	438.528	1.959	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)[C@@H](O)CCc3ccccc3)cc2)CC1	765198227	KVYPLPNHFODNKG-FQEVSTJZSA-N	432.546	1.060	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cncc(Br)c3)CC2)cc1	765754854	OGIJNNOESBYVMV-UHFFFAOYSA-N	446.349	1.731	50	20	IDGD	
CCc1ccc(C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)cc1S(C)(=O)=O	766158384	RGEMQDHVQQQNSY-UHFFFAOYSA-N	429.454	1.142	50	20	IDGD	
COC(=O)c1cccc(C#Cc2cccc(NC(=O)C(=O)NNc3nccnc3OC)c2)c1	766271285	MVLYEIXYXUJRHY-UHFFFAOYSA-N	445.435	1.753	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNS(=O)(=O)CCc2ccccc2[N+](=O)[O-])cc1	766313037	UOQUGINZSDZIAB-AWEZNQCLSA-N	437.474	1.954	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1cnc(Cl)c(Br)c1	768238822	FYNLMZNJJFUPLJ-UHFFFAOYSA-N	427.642	1.906	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)c2cn(CC(=O)C(C)(C)C)nn2)n[nH]1	768282141	ZYGWBQDLXNBNHH-UHFFFAOYSA-N	425.449	1.367	50	20	IDGD	
COc1cccc(OC)c1C(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	768290509	IJNDPYUOLVZLIP-UHFFFAOYSA-N	446.935	1.936	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)N1CCS(=O)(=O)[C@@H]2CCCC[C@H]21	770649189	MZTYOSNGRLZDNJ-APHBMKBZSA-N	429.926	1.890	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2cccs2)[nH]n1)C(=O)Nc1ccnn1-c1cccc(F)c1	770781440	MWDZBXAXUZXWKA-UHFFFAOYSA-N	439.432	1.863	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)CCCN1C(=O)c2cccc3cccc(c23)C1=O	771848407	ANGHEMGGTBFRAF-CYBMUJFWSA-N	425.441	1.705	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)C[C@@H]1CSCCN1C(=O)OC(C)(C)C	772384839	AJNTWNABTUQRGI-CQSZACIVSA-N	438.550	1.997	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)C(=O)N2C[C@@H](C(=O)N3CCCCC3)Oc3ccccc32)n1	773481619	UWTDIYPWBQZSGX-SFHVURJKSA-N	438.488	1.343	50	20	IDGD	
C[C@H](NC(=O)NNc1cccc(S(C)(=O)=O)c1)c1ccc(S(=O)(=O)N(C)C)cc1	776613044	MYDCFOMBSUKSKP-ZDUSSCGKSA-N	440.547	1.728	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(N2CCOCC2)c(C(=O)NNc2ccccn2)c1	777474885	BQDPWOTUJBIPRU-UHFFFAOYSA-N	433.534	1.706	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(=O)n(CC(=O)NNc2nc3ccccc3cc2C)c1	777477941	LIJSZWNKVJWBDP-UHFFFAOYSA-N	443.529	1.879	50	20	IDGD	
COCCCNC(=O)NNS(=O)(=O)c1cc(Br)ccc1OCCOC	778563583	NZAIFCNHUNGKRM-UHFFFAOYSA-N	440.316	1.003	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)N[C@@H]1CCN(C(=O)CCc2ccccc2)C1	778701040	KRUWTKHOUATJLH-MRXNPFEDSA-N	433.509	1.075	50	20	IDGD	
Cc1nc2nc(C(F)(F)F)nn2c(C)c1CCC(=O)NNc1cc(Cl)nc(N)n1	779373687	VZPBIESAJDSQCV-UHFFFAOYSA-N	429.794	1.861	50	20	IDGD	
CN1C(=O)C[C@@H](C(=O)NNC(=O)CCNC(=O)OC(C)(C)C)[C@@H]1c1cccc(Cl)c1	780974470	XZNUGIATPLTZPX-PBHICJAKSA-N	438.912	1.922	50	20	IDGD	
COC[C@@H](C)NS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccc(F)cc2F)cc1	783347764	YBFLUAIQMPKGAM-LLVKDONJSA-N	442.444	1.360	50	20	IDGD	
CCN1CCN(C(=O)c2ccc(NC(=O)C(=O)NNc3ccc(F)cc3C)cc2)CC1	783446148	IAMHWAFQDDEWLQ-UHFFFAOYSA-N	427.480	1.994	50	20	IDGD	
CC[C@@H](C)NS(=O)(=O)Cc1cccc(NC(=O)C(=O)NNc2cccc(OC)n2)c1	784845925	HQDXKBJXUJRFHM-CYBMUJFWSA-N	435.506	1.390	50	20	IDGD	
CNC(=O)c1cc(Oc2ccccc2NC(=O)C(=O)NNc2cccc(OC)n2)ccn1	784849303	VKQKEFRJAIGNRI-UHFFFAOYSA-N	436.428	1.719	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)C(=O)Nc1cnccc1-c1cccc(F)c1	785059797	AMRCTUDPSFVDKV-UHFFFAOYSA-N	432.415	1.864	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)C(=O)Nc3cccc([S@@](C)=O)c3)n[nH]2)c1	785125159	BINGVDAWXLQKKK-WJOKGBTCSA-N	439.497	1.831	50	20	IDGD	
COc1ccc([C@]2(C)NC(=O)N(NC(=O)COC(=O)/C(C#N)=C/c3ccccc3)C2=O)cc1	785365825	MOQUTKZCLLCUKF-DTPJYZGHSA-N	448.435	1.644	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)cc1N1CCNC1=O	787542541	NCTOCMCFJLTXAC-UHFFFAOYSA-N	434.456	1.265	50	20	IDGD	
CO[C@H](C)CS(=O)(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	788139510	NHQZRLSROABXHJ-LLVKDONJSA-N	433.533	1.148	50	20	IDGD	
CS(=O)(=O)c1cc(NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)ccc1Cl	788334526	WHVVCLPRADKJCC-UHFFFAOYSA-N	448.888	1.484	50	20	IDGD	
CN(NS(=O)(=O)c1ccc(F)c(F)c1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	788915312	JNJZGTHLCHVTGB-UHFFFAOYSA-N	434.465	1.763	50	20	IDGD	
CC(C)Oc1cc(NC(=O)C(=O)NNC(=O)CCCc2ccccc2)ccc1C(N)=O	789735120	KINWCZOHBZFLPT-UHFFFAOYSA-N	426.473	1.682	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)C2CCC(NC(=O)C(C)(C)C)CC2)c2ccccc2c1=O	789868171	AKKUJFAAMDQFFQ-UHFFFAOYSA-N	427.505	1.416	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)NCCC(=O)NNc2cccc(F)c2[N+](=O)[O-])cc1	790595005	SPUZYEXIOFDMBE-UHFFFAOYSA-N	439.425	1.504	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NC[C@H](C)NC(=O)OC(C)(C)C)nc1	792261236	DTWOBEUUEDIALL-LBPRGKRZSA-N	430.531	1.308	50	20	IDGD	
C[C@@H]1CN(C(=O)NNC(=O)[C@@H](C)Oc2cccc(Br)c2)C[C@]2(CCOC2)O1	792782092	YXWRIPXZEBIHPI-VFVRVIDISA-N	442.310	1.837	50	20	IDGD	
C[C@@](O)(CN1C(=O)NC2(CCCC2)C1=O)C(=O)NNC(=O)c1c(Cl)cccc1Cl	793386105	ZVPYPTZFPPPXRP-QGZVFWFLSA-N	443.287	1.370	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)C(C)(C)c2cc(F)cc(C#N)c2)cc1	794766433	HYLBQEKWHHSWPM-UHFFFAOYSA-N	446.504	1.752	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@@](C)(O)CSc2cccc(F)c2)c2ccccc2c1=O	794774930	JWRHWEKGVPBPRY-NRFANRHFSA-N	444.488	1.860	50	20	IDGD	
C[C@H](C(=O)NNc1ccccc1S(=O)(=O)N(C)C)c1ccc(S(C)(=O)=O)cc1	795182425	VGBHNHKQRAWEBF-ZDUSSCGKSA-N	425.532	1.587	50	20	IDGD	
C[C@H](C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1)[C@@H]1OCCc2sccc21	796495640	RCYCKHVVVTVUOH-UVIMBBFXSA-N	446.481	1.529	50	20	IDGD	
O=C(NNC(=O)C1CCN(CC(F)F)CC1)c1ccc(S(=O)(=O)N2CCCC2)cc1	798153925	MKDOZFUFYPTZHY-UHFFFAOYSA-N	444.504	1.209	50	20	IDGD	
COc1cc(C=O)c([N+](=O)[O-])cc1OCC(=O)NNC(=O)C(=O)Nc1ccc(C)c(C)c1	798307161	JHTMDNKCWCOULN-UHFFFAOYSA-N	444.400	1.198	50	20	IDGD	
COC(=O)c1ccc(S(=O)(=O)NNC(=O)c2ccc(Cl)cc2OC)cc1OC	799120962	ZSVPVKYBGUXXQA-UHFFFAOYSA-N	428.850	1.767	50	20	IDGD	
CCn1ncc2cc(C(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)c(C)nc21	799408181	OBVWIFJXRABOII-UHFFFAOYSA-N	430.490	1.085	50	20	IDGD	
CSC[C@H](C)C(=O)N1CCC(C(=O)OCC(=O)NNC(=O)c2cccs2)CC1	799540852	QMAQCCTZOQBURI-LBPRGKRZSA-N	427.548	1.290	50	20	IDGD	
COCCN(CCOC)C1CCN(C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)CC1	805109477	FDZADNRYVFEOTB-UHFFFAOYSA-N	444.536	1.286	50	20	IDGD	
COC(=O)c1c(C)csc1NC(=O)C(=O)NNC(=O)Cc1nc2ccccc2n1C	806993353	VXHDKVWHXPZDKY-UHFFFAOYSA-N	429.458	1.058	50	20	IDGD	
COc1ccc(CC(=O)N(C)CC(Cl)Cl)cc1S(=O)(=O)N1CCOCC1	808245427	DIZFMURNWQLCQX-UHFFFAOYSA-N	425.334	1.521	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)Nc2ccc(C(N)=O)cc2OCC(F)F)c1	810302417	QCCYDSZETJHDAK-UHFFFAOYSA-N	438.387	1.913	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(Br)cc1)NNc1cccc(F)c1[N+](=O)[O-]	811476270	QZSLDIVMGMPJDG-UHFFFAOYSA-N	447.242	1.918	50	20	IDGD	
CC(C)(O)CN1CCC(=NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)CC1	814224606	IUBXYXXPOVLDOW-UHFFFAOYSA-N	436.000	1.797	50	20	IDGD	
CO[C@@H]1Cc2ccc(NC(=O)C(=O)NNc3ccccc3S(=O)(=O)N(C)C)cc2C1	815750618	GCSCUGPMFZPEGV-MRXNPFEDSA-N	432.502	1.132	50	20	IDGD	
CC(C)Oc1ccc(C#N)cc1NC(=O)C(=O)NNc1ccccc1S(=O)(=O)N(C)C	815752472	UEDXYEBMINODDA-UHFFFAOYSA-N	445.501	1.678	50	20	IDGD	
Cc1ccc([C@](O)(CC(=O)NNC(=O)c2csc(N3CCOCC3)n2)C(F)(F)F)o1	818653218	UCJJWBZTLBRBRF-MRXNPFEDSA-N	448.423	1.482	50	20	IDGD	
CNS(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=O)CNc2cccc(OC)c2)c1	825811021	WMKRGIRSGAEDEW-UHFFFAOYSA-N	426.882	1.130	50	20	IDGD	
COC(=O)c1cccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1	861709875	RKMGJNRUDSIQIO-UHFFFAOYSA-N	446.485	1.724	50	20	IDGD	
NS(=O)(=O)N1CCC(C(=O)OCC(=O)NN=C(c2ccccc2)c2ccccc2)CC1	914898277	LQBFQEMRITVTIR-UHFFFAOYSA-N	444.513	1.014	50	20	IDGD	
CN(C)c1cc(C(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)ccn1	915057898	KIAWXFFQRIIUNC-UHFFFAOYSA-N	442.483	1.924	50	20	IDGD	
CCC(CC)N1C[C@@H](C(=O)OCC(=O)NNC(=O)c2cc(Cl)ccc2OC)CC1=O	915580579	QGHQINJAULXIJK-LBPRGKRZSA-N	439.896	1.690	50	20	IDGD	
COc1ccccc1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	915879554	UXFLDVDDFZJVCA-UHFFFAOYSA-N	434.474	1.183	50	20	IDGD	
CC(C)CC[C@@H](C)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	915885839	LZXOIFYJXIXMMC-OAHLLOKOSA-N	426.539	1.476	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)NC[C@@H](c1cccs1)N1CCN(C)CC1	915901475	ILEXXYUGMFUDNL-INIZCTEOSA-N	441.561	1.637	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)NC1CCN(Cc2ccccn2)CC1	916382678	UOACSWIMTCEYKL-UHFFFAOYSA-N	428.449	1.364	50	20	IDGD	
Cc1cccc(N2CCN(CCCNC(=O)NNc3ccc(-n4cccn4)nn3)CC2)c1	916513766	RCDXJYPAQWHUJC-UHFFFAOYSA-N	435.536	1.809	50	20	IDGD	
COc1ccc(C=NNC(=O)CN2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)cc1O	916663619	CGAQMEJTZBICQU-UHFFFAOYSA-N	446.529	1.166	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)c2ccc3c(c2)S(=O)(=O)N(C(C)C)C3=O)cc1	916987135	SJOLMZDXCPUESP-UHFFFAOYSA-N	446.485	1.121	50	20	IDGD	
O=C(NNC(=O)N1CCN(c2cccc([N+](=O)[O-])c2)CC1)c1cc(Br)c[nH]1	918002668	RNBJGCLWPZRPNF-UHFFFAOYSA-N	437.254	1.862	50	20	IDGD	
CCC(=O)N1CCCC[C@@H]1C(=O)NNC(=O)c1cccc(S(=O)(=O)N(CC)CC)c1	918688685	AMWLJGFVCPVUSV-QGZVFWFLSA-N	438.550	1.269	50	20	IDGD	
CCCN1CC[C@H](CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)C1	919792928	XOOAXEGCEDOYEK-MRXNPFEDSA-N	437.566	1.147	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)[C@H]1CCCCN1S(=O)(=O)c1cccs1	919822430	UEJDYDZWMXLCKT-OAHLLOKOSA-N	437.543	1.690	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)c2cc(Cl)c(-n3cnnn3)cc2OC)cc1	919833809	CUVVUEGZGJUNOI-UHFFFAOYSA-N	430.852	1.727	50	20	IDGD	
Cc1ccc(O[C@H](C)C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)c(Br)c1	919885056	JPVULVWFYPZUOQ-GHMZBOCLSA-N	434.312	1.042	50	20	IDGD	
COc1cccc(C[C@H](O)C(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)c1	1255540394	XKMFDFBXTYTKHZ-KRWDZBQOSA-N	436.509	1.329	50	20	IDGD	
CC(C)NC(=S)NNC(=O)CN1C(=O)N[C@@](C)(c2ccc(Br)cc2)C1=O	1319298168	HPMIVEUHOCTXJS-INIZCTEOSA-N	442.339	1.120	50	20	IDGD	
CCS(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1	1320928977	SQFAUQZZFUWORM-UHFFFAOYSA-N	439.515	1.028	50	20	IDGD	
NC(=O)[C@@H]1CCCN(c2ccc(C(=O)NNC(=O)Nc3ccc4c(c3)OCO4)cc2)C1	1321789199	OZGGZJZEEULUGK-CQSZACIVSA-N	425.445	1.584	50	20	IDGD	
O=C(CNS(=O)(=O)c1c(F)cccc1F)NNC(=O)c1ccc(Br)cc1	1324157064	IDDZCMIKYSZVFU-UHFFFAOYSA-N	448.245	1.467	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)c1cccc(N2CCNC2=O)c1	1337614703	VHZQFBMTMWULLB-UHFFFAOYSA-N	436.516	1.190	50	20	IDGD	
Cn1c(NNC(=O)CC2(CC(=O)N3CCOCC3)CCCC2)nc2ccccc2c1=O	1339019688	GFWZZMFFFFSQAU-UHFFFAOYSA-N	427.505	1.576	50	20	IDGD	
CCc1cc(C(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)nn1C	1342092330	DWGSLPDAHGMRIN-UHFFFAOYSA-N	430.472	1.759	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2nc3ncccn3n2)C1	1778586297	AKCDBOVWVHZWOZ-STXHMFSFSA-N	434.928	1.659	50	20	IDGD	
CN1CCc2cc(C(=O)N3CCO[C@@]4(CCN(C(=O)CO[Si](C)(C)C)C4)C3)ccc21	1779296740	BYGQLCYLNHFKOS-JOCHJYFZSA-N	431.609	1.974	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)N2CCO[C@@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)c1	1779299883	HSPUTDCPWAZXIW-OAQYLSRUSA-N	433.581	1.940	50	20	IDGD	
C[C@H](C(=O)N1CC[C@@]2(CN(C(=O)C(Cl)Cl)CCO2)C1)N(C)C(=O)OC(C)(C)C	1781041980	YYKCZBYIQUFCDT-XIKOKIGWSA-N	438.352	1.875	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)CCO2)C1	1781233634	CKVRAUMONOOWRY-MSOLQXFVSA-N	446.287	1.980	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccccc3C(N)=O)C2)C1	1781761168	YZAKYCMTSYEBBR-MOPGFXCFSA-N	428.316	1.465	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CSc1ccncc1)C2	1782172689	ZYIDDNNFYKMKME-SQGPQFPESA-N	441.981	1.941	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCCn1ccnc1C)C2	1782179141	SXENVKWDSDTFPG-DBXWQHBBSA-N	440.972	1.739	50	20	IDGD	
C#CC(=O)N1CCO[C@]2(CCN(C(=O)/C(C#N)=C/c3ccc(Br)cc3)C2)C1	1782869906	LIXGITAFTVOIMW-MBNYPGIVSA-N	428.286	1.819	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3nccc(Cl)c3OC)CCO2)C1	1783881251	JYUJEDLKIMUEJN-FZKQIMNGSA-N	432.304	1.441	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc4cc(Cl)ccn34)C[C@@H]21)[C@H](O)CCl	1784089935	MIRCHHSGHBAIJK-YUDUHTQSSA-N	441.315	1.181	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccnc3C(N)=O)[C@H]2C1	1785519190	BDNIQSSKWYJZIE-LDBIXWDDSA-N	443.331	1.010	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ncc(Cl)cn3)[C@H]2C1	1785821026	LBACJKCZILOQJJ-HTWFXAOOSA-N	435.739	1.960	50	20	IDGD	
C[C@@H](C(=O)Nc1ccc(C2(NC(=O)CCC(=O)NN(C)C)CCC2)cc1)n1ccnc1	1786234575	AEYIPLLZESMKGL-INIZCTEOSA-N	426.521	1.951	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN3CCCCC3)[C@H]2C1	1786715460	UUVJDOTVCIRJHN-QAETUUGQSA-N	430.387	1.626	50	20	IDGD	
O=C(Cc1ncccn1)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1	1786952357	IVJLSTOGYPFJHG-UHFFFAOYSA-N	430.273	1.147	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3noc4c3CCCC4)[C@H]2C1	1787307356	WCTISMYUMCWTJG-ZVZYQTTQSA-N	435.597	1.998	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CCN3C(=O)OC(C)(C)C)C[C@@H]21	1789857902	KQJLJKLJUFNFFZ-WOYTXXSLSA-N	443.972	1.993	50	20	IDGD	
Cn1cccc1C(=O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]2C1	1789872527	IIXHHRZRBBIYTP-VODUFIJXSA-N	430.332	1.424	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CNc4ccccc43)C[C@@H]21)[C@H](F)Br	1789922261	HGXHWOZVOXWHFJ-LLLJDESDSA-N	440.313	1.866	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc4cc(C)ccn34)[C@H]2C1	1790490406	GVUBUPIALDEEJX-CUSZFKRNSA-N	434.924	1.490	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccn4cncc34)C[C@@H]21	1791055826	IZSPBAXVTOZYBJ-HPZZRFSDSA-N	435.322	1.711	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc4ccccn34)C[C@@H]21	1791057870	ROZVGPKCVDIGNI-HOSILWTGSA-N	435.322	1.711	50	20	IDGD	
COc1cnc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)CBr)c(F)c1	1792870478	PJGXRLFSIZEPPT-OHTBPHCPSA-N	444.301	1.464	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H]1C=C[C@@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Cl)C3)C1	1793875574	GLPZTXZBEUPTRB-XMEMRUQMSA-N	445.919	1.580	50	20	IDGD	
C[C@@H](Cc1ccc(F)cc1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1	1796193201	UEZRMDOPJKNQIK-RWXMBLCBSA-N	438.308	1.636	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Cl)C1CC1	1796362884	KHMRFECOVZMEKT-AICCOOGYSA-N	433.908	1.414	50	20	IDGD	
Cc1c(Br)c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Cl)nn1C	1796366523	ZKFXLRJYDCJTGT-INTNWOOBSA-N	437.697	1.229	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2)c1ccc(N2CCOCC2)cc1	1796490382	GRAYUSRJNUIBLF-MVJTYMMSSA-N	425.888	1.261	50	20	IDGD	
N#C/C(=C\c1ccc(Br)cc1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](N)CN	1796782579	JCRTZXIHYCJJMW-DBDMEFSLSA-N	446.349	1.280	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cccc(Cl)n1)C2	1797952885	OLBKEJAKDVHUSH-HBCWATKFSA-N	425.989	1.719	50	20	IDGD	
CC(C)c1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)on1	1798439766	CXHCFKYGKADZKZ-BTTYYORXSA-N	426.477	1.362	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccnc1Cl)C2	1798440134	MJSUXIZNBOBROF-CLLJXQQHSA-N	428.880	1.299	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc3c[nH]nc13)C2)[C@@H](F)Br	1799346134	DHKYIWMUOJLIJX-NDPMZMCLSA-N	425.258	1.457	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1cc2ccoc2cn1	1799881333	BTLJIJWMTWBEAN-JLUCKKNBSA-N	426.242	1.722	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)c1cnc2ccc(Cl)cc2c1	1799923786	CRKPOSRCMIOIHE-LTCOOKNTSA-N	438.311	1.691	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)Cc1ccc(F)cc1	1800373029	YWRVCDCIUDVCGX-GJSASXELSA-N	426.916	1.848	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cncc3cnccc13)C2	1800760272	LVFIEYMKEZFCRZ-MBMVNNNZSA-N	433.306	1.616	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(OC)cc1OC)C2	1800979192	WHMATWXHMIUNJV-VLWCASSMSA-N	426.897	1.161	50	20	IDGD	
C[C@@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cn1c(=O)n(C)c3ccccc31)C2	1801963024	VDVIBGYIJOHTEC-APIJFGDWSA-N	449.349	1.762	50	20	IDGD	
CCOc1cnc(C(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)cn1	1803139979	AICZUQFOGULKKT-HFTRVMKXSA-N	433.896	1.190	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)C[C@@H]2NC(=O)NC2=O)[C@@H]1c1cccnc1	1803686588	QKIZQMKYTHXWPW-QBYUYEEZSA-N	435.912	1.093	50	20	IDGD	
CC[C@H](NC(C)=O)C(=O)N1CC[C@H](CNC(=O)CCBr)[C@@H]1c1cccnc1	1806337430	HUVITGLUMAZQNB-RYRKJORJSA-N	439.354	1.787	50	20	IDGD	
CC1=CC[C@H](C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)CC1	1807376756	WFKIYPBTKRIJBI-HARLFGEKSA-N	447.344	1.827	50	20	IDGD	
C[C@@H](Cc1ccccn1)C(=O)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1	1809979984	JLQGRHHRZPDVRD-IBGZPJMESA-N	449.360	1.485	50	20	IDGD	
CC/C=C(\C)C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1	1810307038	CMUKITZURNTKMT-AEJBLPPUSA-N	436.516	1.756	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)N1CC[C@H](CNC(=O)CO[Si](C)(C)C)[C@H]1c1cccnc1	1810542716	WZSHOFZFLHZTOW-XFQXTVEOSA-N	434.613	1.806	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1	1812864726	RGRGUNWALGRWCU-BNLOLNQZSA-N	449.305	1.991	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2nccnc2OC)[C@H]1c1cccnc1	1813029850	ZKCTYGBZXNLOGJ-ZOBUZTSGSA-N	433.896	1.454	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)C(Cl)Cl)[C@@H]1c1cccnc1	1813073962	MOWPDNHTKDOSRF-XJKSGUPXSA-N	430.336	1.264	50	20	IDGD	
Cc1nn[nH]c1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](C)CBr)CC2	1815931653	JQJYJXYTDDBRSE-VXNVDRBHSA-N	427.328	1.826	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cscn2)n[nH]1	1816487997	DRYPBZXLCCNIRX-HNNXBMFYSA-N	440.489	1.484	50	20	IDGD	
O=C(CCC(F)(F)F)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1817095404	ZORXHZOBMGXWHA-HNNXBMFYSA-N	438.215	1.738	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)CCc2ccccn2)[nH]n1)c1cccc(B(O)O)c1	1817474181	ORTNCTPCKZNCJK-HXUWFJFHSA-N	447.304	1.423	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1)c1cccn2c(O)nnc12	1817964400	ANMZOPLKAOJKBY-STQMWFEESA-N	433.856	1.064	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2nc[nH]c2[N+](=O)[O-])n[nH]1	1818078945	RQVMHDZMCKQTNI-MWLCHTKSSA-N	425.833	1.601	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)C(=O)Nc3cccnc3)sc2C1	1820052616	UKYLSCDVPLHZAC-CMPLNLGQSA-N	437.909	1.343	50	20	IDGD	
Cc1cc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)[C@@H](O)CCl)[nH]n2)nc2nccn12	1821478068	QQCUDVFNVUYULC-GJZGRUSLSA-N	431.884	1.666	50	20	IDGD	
Cc1ccnc(C(=O)N[C@@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)c1	1826086432	VGQDBPMDUUOMQP-CYBMUJFWSA-N	430.534	1.445	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc[nH]n2)CC1	1827677099	HSIJTGDBHSJTRZ-QVWJKXSPSA-N	439.520	1.777	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(F)c[nH]2)CC1	1828925617	NDFSKQCPMUHENU-IBGZPJMESA-N	442.495	1.699	50	20	IDGD	
CC(=O)OC[C@H](OC(C)=O)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H](F)Cl)CC1	1828954398	XUAZLJZOAAFBBP-IKGGRYGDSA-N	434.892	1.635	50	20	IDGD	
O=C(COc1ccc(O)cc1)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1830350014	QYIWMYKDDPUNHL-GOSISDBHSA-N	433.288	1.031	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4cnccc4[nH]3)C2)C1	1830361768	CEPBHTASAWDQNX-NRFANRHFSA-N	434.924	1.898	50	20	IDGD	
CN[C@H](CC(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H](F)Br)CC1)C(=O)O	1830375913	WSFJOMMHEWPNGR-UMVBOHGHSA-N	436.322	1.359	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccn4ccnc34)C2)C1	1831651192	NTJMOVAEFLNJSF-UTKZUKDTSA-N	434.924	1.812	50	20	IDGD	
CC[C@@H](C(=O)N1CCO[C@]2(COCCN(C(=O)CCBr)C2)C1)N(CC)CC	1831663853	NCLKNSXHWFXCQD-LPHOPBHVSA-N	448.402	1.348	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CCc2nc(N)n[nH]2)CC1	1831830975	KYFCLSDJDFNHNK-GJZGRUSLSA-N	426.949	1.193	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)COC(=O)C(F)(F)F)CC1	1831831459	ZEYWOHBNURACRG-KBPBESRZSA-N	442.862	1.965	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccn3c(O)nnc23)CC1	1831832713	HHTNUKYWHCAULD-IAGOWNOFSA-N	449.939	1.922	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H]2CCCS2(=O)=O)CC1	1831835100	OEFQYSDKPCGQLC-BBWFWOEESA-N	434.986	1.437	50	20	IDGD	
C[C@H](C(=O)NC1CCN(C2CCN(C(=O)CO[Si](C)(C)C)CC2)CC1)C1(O)CCC1	1833068597	UTVGVPDFLHPGAK-QGZVFWFLSA-N	439.673	1.961	50	20	IDGD	
Cc1cc(F)ccc1C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)CCl)CC2)CC1	1833313465	HMZGETQZUINYES-LJQANCHMSA-N	425.932	1.919	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](Cl)CCC)CC2)CC1	1833533884	UCTDBHGUJRXUEX-QAPCUYQASA-N	426.989	1.656	50	20	IDGD	
CC(=O)N(C)CCC(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)Br)CC2)CC1	1833671031	DTTKYPUYFZZIPK-CQSZACIVSA-N	445.402	1.210	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)c1cccc2c[nH]nc12	1835006839	XBTDJOWWBLXMTG-GOSISDBHSA-N	433.940	1.348	50	20	IDGD	
COc1ccc([C@H](O)C(=O)N2CCC(N3CCC(NC(=O)[C@H](F)Cl)CC3)CC2)cc1	1835078162	TYAGTNDFUZLGAL-OALUTQOASA-N	441.931	1.835	50	20	IDGD	
Cc1cnn([C@H](C)C(=O)N2CCOC[C@@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)c1	1837718078	XDYGJIKJWRGIQC-YLJYHZDGSA-N	438.601	1.060	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)COCCOC)CC2)CC1	1837769124	CWTNNTHAXLHLOQ-KRWDZBQOSA-N	449.386	1.822	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ncccc3F)CCO2)C1	1838250805	UZJINYJENTWSBP-ZWKOTPCHSA-N	434.295	1.527	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)CCN3CCOC3=O)CC2)CC1	1838273074	OHYCHKWHZJGAAT-QGZVFWFLSA-N	429.945	1.845	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnn4ccc(C)cc34)C2)C1	1839144133	RCYQLQFWNQKYTF-LAUBAEHRSA-N	434.924	1.730	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(F)c(OC)c3)C2)C1	1839148649	FKGFAWTUEZBNEF-FOIQADDNSA-N	428.888	1.922	50	20	IDGD	
O=C(Cc1cccs1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839198729	ARANCFITJWXVAS-GOEBONIOSA-N	435.315	1.438	50	20	IDGD	
Cc1csc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)c1	1839198768	NOZQGAJIDXBSMR-XJKSGUPXSA-N	435.315	1.817	50	20	IDGD	
O=Cc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)s1	1839199501	OZLWYDYPCUFAPT-CJNGLKHVSA-N	449.298	1.321	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(C)on3)C2)C1	1839963728	UCOAHWXYFLULGF-SUMWQHHRSA-N	430.299	1.227	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccnc3S)C2)C1	1840029974	XARQSWOWFXVEOJ-SJCJKPOMSA-N	444.351	1.224	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1C[C@@]1(F)Cl)CCO2	1840247740	HTHINSIBLYCKSV-RKLWJJNISA-N	441.725	1.541	50	20	IDGD	
Cc1cnn([C@H](C)C(=O)N2CCO[C@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)c1	1840404725	BORPLDSDVCDFDW-XLIONFOSSA-N	438.601	1.060	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CCCS1)CCO2	1840574064	FKYGHFSWFOXTEJ-CKEIUWERSA-N	435.384	1.369	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3cc(F)ccc3F)CCO2)C1	1840810874	IGRBJFRCPMGXOW-JXFKEZNVSA-N	430.879	1.981	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H]1C=C[C@@H](C(=O)N2CC3(CCCN3C(=O)[C@@H](O)CCl)C2)C1	1841350157	KTGZWPSSQMULAG-ILXRZTDVSA-N	427.929	1.259	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@@]2(C(=O)N2CC3(CCCN3C(=O)[C@@H](O)CCl)C2)C1	1841353488	ADGUHHCXJGMTTG-VFCRVFHLSA-N	441.956	1.437	50	20	IDGD	
CN(CC(=O)N1CC2(CCCN2C(=O)[C@@H]2CCC=CO2)C1)NC(=O)NCc1ccccc1	1844246755	NSYSBRBJMPPFKX-IBGZPJMESA-N	441.532	1.229	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@]2(C(=O)N3CCCC34CN(C(=O)C(Cl)Cl)C4)C[C@H]1CO2	1845078660	HRZRLBHSJYBXSD-BUXKBTBVSA-N	448.347	1.772	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC12CN(C(=O)c1cncc(S(C)(=O)=O)c1)C2	1846175617	JMSBJUQJCOTBRV-LLVKDONJSA-N	430.324	1.086	50	20	IDGD	
CC(C)COc1cc(C(=O)N2CC3(CCCN3C(=O)CCC(=O)NN(C)C)C2)ccn1	1846384858	RUQCNWKPVAVWHL-UHFFFAOYSA-N	431.537	1.306	50	20	IDGD	
O=C([C@H](Br)Cc1ccccc1)N1CC2(CCCN2C(=O)CCn2cncn2)C1	1846547367	WBWDYCDCQPOBQQ-QGZVFWFLSA-N	446.349	1.878	50	20	IDGD	
COc1ccc(CC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](O)CCl)c(Br)c1	1847559541	SMUFXTTZXCPPAF-JYJNAYRXSA-N	445.741	1.802	50	20	IDGD	
CCOC(=O)c1c(CCC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](O)CCl)c[nH]c1C	1847559967	VRVCMARYPGMDMR-HRCADAONSA-N	425.913	1.234	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)Cc2n[nH]c(=O)c3ccccc23)c2ccccc2c1=O	17162069	VMZCJVSYDHVYGJ-UHFFFAOYSA-N	432.440	1.047	50	20	IDGD	
Cc1ccc(S(N)(=O)=O)cc1C(=O)NNC(=O)c1ccc(COc2ccccc2)o1	21970136	YZJYRECCMQSIHL-UHFFFAOYSA-N	429.454	1.889	50	20	IDGD	
O=C(NNS(=O)(=O)c1cccc(S(=O)(=O)NC2CC2)c1)c1cccc(Cl)c1	26221392	VWNUMKGFWZPRRU-UHFFFAOYSA-N	429.907	1.404	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CNC(=O)NCc2ccc(F)cc2)ccc1OC(C)C	45818947	NNTBGUGTTKJUGT-UHFFFAOYSA-N	432.452	1.882	50	20	IDGD	
CC(C)[C@H](NS(=O)(=O)c1ccc2ccccc2c1)C(=O)NNC(=O)c1ccncc1	725870019	YJHWCSMQAMAGTM-IBGZPJMESA-N	426.498	1.999	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NCCOc1cccc(Br)c1	725873063	JUFWRVAOHNYWFO-UHFFFAOYSA-N	441.307	1.650	50	20	IDGD	
COc1ccc(Br)cc1CNC(=O)NNC(=O)CNC(=O)c1ccco1	726249751	KMZSPRVFRBSAML-UHFFFAOYSA-N	425.239	1.311	50	20	IDGD	
COC(=O)C[C@H]1c2cc(OC)c(OC)cc2CCN1CC(=O)NNC(=O)c1cccs1	727238162	GEYIDXRKAOBLHV-HNNXBMFYSA-N	447.513	1.689	50	20	IDGD	
O=C(CCCc1ccccc1)NNC(=O)c1ccc(S(=O)(=O)NC[C@H]2CCCO2)cc1	727741257	LKVBBRTXDULRMN-LJQANCHMSA-N	445.541	1.928	50	20	IDGD	
CSCC[C@H](NC(=O)c1ccccc1Br)C(=O)NNC(=O)CN(C)C	727761418	BPYGNPRFSWNOIZ-ZDUSSCGKSA-N	431.356	1.010	50	20	IDGD	
CC(C)NC(=O)C(=O)N1CCN(C(=O)NNC(=O)c2c(Cl)cccc2Cl)CC1	727847353	YBKHAOIYFQYUBE-UHFFFAOYSA-N	430.292	1.017	50	20	IDGD	
CC(=O)NCC(=O)N1CCC[C@@H]1C(=O)NNC(=O)c1cc(-c2ccco2)nc2ccccc12	728511589	VGQKHYFCKMMLNH-LJQANCHMSA-N	449.467	1.383	50	20	IDGD	
Cc1cccc(-n2nnc(C(=O)OCC(=O)NNC(=O)Cc3nc(C)cs3)c2C)c1	728731431	AIGDNHGFOHYKNU-UHFFFAOYSA-N	428.474	1.196	50	20	IDGD	
CCN(CCNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)c1cccc(C)c1	728942491	WCNDJSURUKTKES-UHFFFAOYSA-N	425.537	1.858	50	20	IDGD	
COc1cc(CCNC(=O)NNC(=O)COc2ccccc2O)c([N+](=O)[O-])cc1OC	730902730	HJYCZWJJCJUEMI-UHFFFAOYSA-N	434.405	1.270	50	20	IDGD	
CCN(C1CCN(C(=O)/C(C#N)=C\c2cc(C)n(CCOC)c2C)CC1)S(C)(=O)=O	731347934	ZDWFTDZPYUBMQS-RGEXLXHISA-N	436.578	1.931	50	20	IDGD	
COC(=O)c1sc2ccccc2c1S(=O)(=O)NNC(=O)CNC(=O)c1ccco1	731596645	VBLYAFOWXPOYDK-UHFFFAOYSA-N	437.455	1.020	50	20	IDGD	
COCCOc1cc([N+](=O)[O-])c(C(=O)NNc2nc(-c3cccnc3)no2)cc1OC	732110738	MBKZFBGHEBERQV-UHFFFAOYSA-N	430.377	1.831	50	20	IDGD	
CC(C)n1cc([C@H](C)NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cn1	732892314	AULPBKSPKQLDLN-HNNXBMFYSA-N	448.549	1.954	50	20	IDGD	
CCc1cc(N2CCC[C@H](NC(=O)NNC(=O)COc3ccccc3[N+](=O)[O-])C2)ncn1	732914318	NVCSVWSGOLADFC-HNNXBMFYSA-N	443.464	1.325	50	20	IDGD	
O=C(NNC(=O)C1CCS(=O)(=O)CC1)c1nc(-c2ccccc2)n(-c2ccccc2)n1	732949524	KIQYSKIVQWNPLR-UHFFFAOYSA-N	439.497	1.520	50	20	IDGD	
CC(=O)N1CCc2ccc(S(=O)(=O)NNC(=O)C(=O)Nc3ccc(C)c(C)c3)cc21	734419138	LYAXUPRSHRVTIO-UHFFFAOYSA-N	430.486	1.161	50	20	IDGD	
Cc1cccc2c(=O)c(C(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)c[nH]c12	741741779	AKZBYXIDOJMWJP-UHFFFAOYSA-N	428.470	1.162	50	20	IDGD	
NS(=O)(=O)c1ccc(NC(=O)NNC(=S)Nc2ccc3c(c2)OC(F)(F)O3)cc1	741870712	ZOTIZRQTHJEJGN-UHFFFAOYSA-N	445.429	1.679	50	20	IDGD	
O=C(CCN1C(=O)[C@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O)NNC(=O)c1c(Cl)cccc1Cl	742626878	ALYSDQQNRGOLHC-FIXIBIHLSA-N	426.256	1.307	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)CN2CCN(c3ccccn3)CC2)c1	743336084	BZFSZGCRAGAWNF-UHFFFAOYSA-N	448.321	1.436	50	20	IDGD	
C[C@H]1CCN(CC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)CCN1Cc1ccccc1	744425750	BANHIMYIERTSQO-KRWDZBQOSA-N	425.489	1.952	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)[C@@H]2CCN(c3ccc(Cl)cc3)C2=O)cc1	744842746	QVWKUIFKHCGPIE-QGZVFWFLSA-N	440.843	1.569	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)c2ccc(CSc3nncn3C)cc2)c(-c2ccncc2)n1	745835467	JZIYXFKTXJUDHP-UHFFFAOYSA-N	448.512	1.978	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)c1cnn(C)c1	745840827	ZXSDOYDLPFBUNZ-CQSZACIVSA-N	434.522	1.300	50	20	IDGD	
C[C@@]1(NNC(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2=O)CCS(=O)(=O)C1	745875098	KXNIMDKDFJXMHF-RDTXWAMCSA-N	446.476	1.164	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)[C@H]1COc2ccccc2O1)n1nnc(-c2ccc(Cl)cc2)n1	746080721	ZNUCAWSTEIOTDV-WMLDXEAASA-N	442.863	1.932	50	20	IDGD	
O=C(CCOc1ccccc1)NNC(=O)[C@H]1CS[C@H](Cc2ccccc2F)C(=O)N1	747179221	AWGVQACQHVGCPF-QZTJIDSGSA-N	431.489	1.585	50	20	IDGD	
Cc1nn(Cc2ccc(F)cc2)c2sc(C(=O)NNC(=O)C(=O)N3CCCC3)cc12	748246496	BHHHLNUSZBIGAK-UHFFFAOYSA-N	429.477	1.977	50	20	IDGD	
C[C@H](C(=O)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1)N1C(=O)[C@@H]2CCCC[C@H]2C1=O	748519937	FTSXDIBBDUPHKA-LERXQTSPSA-N	447.435	1.987	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(C(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)o1	748520453	QKWHEISBFYWAGX-UHFFFAOYSA-N	441.409	1.580	50	20	IDGD	
O=C(Cn1cc([N+](=O)[O-])ccc1=O)NNC(=O)c1ccccc1OCc1ccc(F)cc1	748604166	CMOJKTGMGRVLEZ-UHFFFAOYSA-N	440.387	1.936	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)Cn2nc(Br)nc2Br)cc1	748631504	NDGYLMCBINGRIF-UHFFFAOYSA-N	428.044	1.136	50	20	IDGD	
CCc1ccccc1OCC(=O)NNS(=O)(=O)c1sc(C(=O)OC)cc1OC	748791747	ZZQFZHPXGALVSI-UHFFFAOYSA-N	428.488	1.494	50	20	IDGD	
CN(C)N(C(=O)c1ccc2ncc(I)n2c1)[C@H]1CCS(=O)(=O)C1	749317923	LRORXRUYFZSBLA-NSHDSACASA-N	448.286	1.045	50	20	IDGD	
CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)NNC(=O)NCCc1cccs1	749356915	LUXWOXTXWYHUCD-SFHVURJKSA-N	431.493	1.989	50	20	IDGD	
NS(=O)(=O)c1cnn(CCC(=O)NNC(=O)c2ccc(-c3ccc(F)cc3)s2)c1	749402994	DIURKWYYBOXOGV-UHFFFAOYSA-N	437.478	1.249	50	20	IDGD	
CO[C@@H](C)c1noc(CN2CCCN(C(=O)NNC(=O)c3cccc(C#N)c3)CC2)n1	750274431	ASYMJMROMBPXCK-AWEZNQCLSA-N	427.465	1.211	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)CCOc2cccc(C(N)=O)c2)c1	751377498	XFPMAWQLEPAKIH-UHFFFAOYSA-N	436.262	1.787	50	20	IDGD	
O=C(NNC(=O)c1cccc2cccnc12)c1cccc(CN2CCS(=O)(=O)CC2)c1	751397693	TYLVSTMGVXJOFP-UHFFFAOYSA-N	438.509	1.540	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NC[C@@H](c2cccnc2)C(C)C)cc1	751813020	DKGNYPRPUJDAEC-LJQANCHMSA-N	447.561	1.781	50	20	IDGD	
CCn1cc([C@@H]2C[S@](=O)CCN2C(=O)NNC(=O)Cn2ccc3ccccc32)cn1	753125841	OLQLOCMPAWWBNB-YVGXBJCXSA-N	428.518	1.404	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)Nc1ccc(NC(=O)CN2CCOCC2)cc1	755600670	UWALTNFSLMRNSC-UHFFFAOYSA-N	445.451	1.328	50	20	IDGD	
COC(=O)CCNC(=O)c1ccc(NC(=O)NNC(=O)COc2cccc(C)c2)cc1	755604476	RGCYYADDKIKMOE-UHFFFAOYSA-N	428.445	1.520	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2ccccc2C(=O)N2CCN(C)CC2)cc1OC	755622478	IHPRRIZAIIROJY-UHFFFAOYSA-N	441.488	1.558	50	20	IDGD	
CN1CCN(C(=O)c2ccccc2NC(=O)NNC(=O)Cc2c[nH]c3ccccc23)CC1	755623150	OBESRVSZAXPTFV-UHFFFAOYSA-N	434.500	1.951	50	20	IDGD	
Cc1c(NC(=O)NNC(=O)CCc2ccccc2O)cccc1C(=O)N1CCOCC1	756184646	IVBZHCZQTGLUNY-UHFFFAOYSA-N	426.473	1.959	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)Nc1c(C(=O)N2CCOCC2)oc2ccccc12	756287734	VZLDNGZRYCTVOC-CYBMUJFWSA-N	434.449	1.109	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)Nc1ccc(CN2C(=O)CSC2=O)cc1	756300689	MJGXTUUBQDGIDU-INIZCTEOSA-N	442.453	1.875	50	20	IDGD	
CC(C)CCn1nc(C(=O)NNC(=O)Nc2nnc3ccccn23)c2ccccc2c1=O	756433932	RJSQUIADOJFDOD-UHFFFAOYSA-N	434.460	1.952	50	20	IDGD	
Cc1cc(S(N)(=O)=O)cc(NC(=O)NNC(=O)c2cc(Br)c[nH]2)c1C	756632931	FEQJGHGVOQRBRR-UHFFFAOYSA-N	430.284	1.508	50	20	IDGD	
CCOC(=O)[C@@H](C)NC(=O)c1ccc(NC(=O)NNC(=O)c2ccccc2OC)cc1F	756818242	MZUZSDMXYREPIA-GFCCVEGCSA-N	446.435	1.982	50	20	IDGD	
C[C@H]1C[C@@H](C)C[C@]2(C1)NC(=O)N(CC(=O)NNc1nc3ccccc3c(=O)n1C)C2=O	756996319	PYZDSSLICYUPNF-NGVSDPCNSA-N	426.477	1.123	50	20	IDGD	
O=C(NCc1cc2c(cc1OC(F)F)OCO2)NNC(=O)c1cc([N+](=O)[O-])ccc1O	757251855	QIYBGXCPUCWYRB-UHFFFAOYSA-N	440.315	1.775	50	20	IDGD	
CN(C)c1nccc(NNC(=O)[C@H]2CCC(=O)N2Cc2ccc(Br)cc2)n1	757662455	RNWHGJAPOHCVHE-CQSZACIVSA-N	433.310	1.939	50	20	IDGD	
Cn1nc(Br)cc1C(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	757946491	VKLSFQXFZGSQNE-UHFFFAOYSA-N	445.318	1.526	50	20	IDGD	
C[C@H](CC(=O)N1CCN(S(=O)(=O)CBr)CC1)NC(=O)c1ccccc1	758522793	KCSRQFCNYCTUDK-CYBMUJFWSA-N	432.340	1.021	50	20	IDGD	
CCS(=O)(=O)CCN(C)C(=O)NNC(=O)c1ccc(Br)cc1Cl	758761774	LNPNKEMNGOGFBE-UHFFFAOYSA-N	426.720	1.823	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)N[C@@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1C#N	758774008	SZXVBIJDEWKIPD-LSDHHAIUSA-N	447.492	1.554	50	20	IDGD	
COc1ccc(-c2nc(CC(=O)NNC(=O)C(=O)Nc3ccccn3)cs2)cc1OC	758832175	UACOLMDHOBUXLV-UHFFFAOYSA-N	441.469	1.551	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)NC[C@@H]2CN(Cc3ccccc3)CCCO2)c1	759234376	YBNPZTWAQUBQHU-OAQYLSRUSA-N	442.516	1.939	50	20	IDGD	
O=S(=O)(c1cccc2nsnc12)N1CCN(CCI)CC1	759321808	IBCSSPMFKHHLBP-UHFFFAOYSA-N	438.316	1.433	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2cc([N+](=O)[O-])cc(C)c2F)cc(OC)c1OC	760334009	DAFGYAVIPOQYDQ-UHFFFAOYSA-N	443.409	1.691	50	20	IDGD	
O=C(NCCC[C@H]1CCCCO1)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	761036490	NZQJBSHSJMBLBW-QGZVFWFLSA-N	438.550	1.764	50	20	IDGD	
CN(C1CCCCC1)S(=O)(=O)c1cccc(NC(=O)C(=O)NNC(=O)C(C)(C)C)c1	761073834	ZGGQOTIRMKEGKE-UHFFFAOYSA-N	438.550	1.772	50	20	IDGD	
COc1cc(NC(=O)C2CC2)ccc1S(=O)(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	761267074	NRPSNSARERKIJG-UHFFFAOYSA-N	434.430	1.575	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)N[C@@H]1C[C@@H](C)N(c2cnn(C)c2)C1=O	761722615	ZEVRJZCNGYERQH-TZMCWYRMSA-N	432.506	1.045	50	20	IDGD	
CCC(=O)NNC(=O)C(=O)Nc1cc(S(=O)(=O)N(CC)c2ccccc2)ccc1OC	763431002	PVLBQQWVASKGBR-UHFFFAOYSA-N	448.501	1.406	50	20	IDGD	
Cc1ccccc1NC(=O)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	763512256	OMBRMEXEJHGRBZ-UHFFFAOYSA-N	444.513	1.569	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(N(C)C3CCN(C)CC3)cc2)c(C)o1	763585842	HFEPWMVTSVVRCM-UHFFFAOYSA-N	427.505	1.827	50	20	IDGD	
NC(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2-c2ccccc2)cc1	763642265	UGUNJYNDSUYRPQ-UHFFFAOYSA-N	446.463	1.546	50	20	IDGD	
CNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2cc(C)cc(C)c2)cc1Cl	763649441	IRKCETKJUMSCIV-UHFFFAOYSA-N	432.864	1.481	50	20	IDGD	
O=C(CSc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1ccc2c(c1)C(=O)NCC2	763735377	OJCXCLNREBZNEC-UHFFFAOYSA-N	432.889	1.504	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2cccc(OCCCC#N)c2)c1	763775215	OUGVKBWBMLTVBY-UHFFFAOYSA-N	426.429	1.786	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)C(=O)Nc1cc2c(cc1Cl)OCCO2	763789701	AMRQEHVIKFILSR-UHFFFAOYSA-N	443.803	1.160	50	20	IDGD	
COC(=O)N(C)Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)cc1	763873090	QRJLRDVCUJVWSM-CYBMUJFWSA-N	446.435	1.577	50	20	IDGD	
CC(C)CC(=O)NNC(=O)C(=O)Nc1cc(NC(=O)CN2CCCC[C@H]2C)ccc1F	763881627	IEQVDRWDKMJANG-CQSZACIVSA-N	435.500	1.771	50	20	IDGD	
C[C@@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)Cc3ccc(F)cc3)cn2)C[C@@H](C)O1	763919632	WIOWLOZWEYLVGV-ZIAGYGMSSA-N	429.452	1.163	50	20	IDGD	
CS(=O)(=O)c1cccc(Oc2ccc(NC(=O)C(=O)NNC(=O)c3ccc[nH]3)cc2)c1	763980476	ISCXJOSMKKVDIW-UHFFFAOYSA-N	442.453	1.610	50	20	IDGD	
COC(=O)c1ccc(F)c(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)on2)c1	764016181	IOBOCVGFKPPCHR-UHFFFAOYSA-N	426.360	1.667	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc([S@@](=O)C(F)(F)F)cc1	764049443	ZKLMMJVLJAQHNL-GDLZYMKVSA-N	429.376	1.722	50	20	IDGD	
COCCOc1ccc(C(F)(F)F)cc1NC(=O)C(=O)NNC(=O)CC(F)(F)F	764115793	WBWIOXVBGJWEGG-UHFFFAOYSA-N	431.289	1.769	50	20	IDGD	
N#Cc1c(F)cccc1-n1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)n1	764117969	WLGUGMFJMNSORM-UHFFFAOYSA-N	442.794	1.642	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2ccc(N3CCOCC3)c(C)c2)cc1	764131789	OEFMIGNLKOZIFP-UHFFFAOYSA-N	440.500	1.559	50	20	IDGD	
COCCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)CCc2ccccc2)cc1Cl	764191758	FEXRACQKJRROGQ-UHFFFAOYSA-N	446.891	1.435	50	20	IDGD	
N#Cc1ccc(Cn2cnc(NC(=O)C(=O)NNC(=O)CCCc3ccccc3)n2)cc1	764224573	QYVOGGNAZYZIQK-UHFFFAOYSA-N	431.456	1.307	50	20	IDGD	
Cc1cccc(C(=O)N2CCCC2)c1NC(=O)C(=O)NNC(=O)Cn1ccc2ccccc21	764243022	KUSBRPMYTXQYSE-UHFFFAOYSA-N	447.495	1.972	50	20	IDGD	
CNC(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)c2cccc3ncccc23)c1	764252083	AWRHATMCAAYKAM-UHFFFAOYSA-N	425.832	1.648	50	20	IDGD	
CC(C)(C)OC(=O)Cc1ccccc1NC(=O)C(=O)NNC(=O)COc1ccccc1O	764277605	FQZFEHMALVDJBV-UHFFFAOYSA-N	443.456	1.441	50	20	IDGD	
CCN(Cc1ccccc1NC(=O)C(=O)NNC(=O)Cc1cc[nH]n1)C(=O)OC(C)(C)C	764292998	JWCLTKWUJOEVMC-UHFFFAOYSA-N	444.492	1.495	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2cccs2)[nH]n1)C(=O)Nc1cccnc1N1CCCCC1	764382843	RNKPGMLVVQKQGG-UHFFFAOYSA-N	439.501	1.923	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1ccn(Cc2ccccn2)n1	764396716	ATFYMJAWQPXTSM-UHFFFAOYSA-N	440.485	1.213	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1	764397564	AELQEIIOIYHNME-CQSZACIVSA-N	443.460	1.468	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=S)Nc3ccc(C(N)=O)cc3)CC2)cc1	764519655	URLFUIKWDQXNLD-UHFFFAOYSA-N	440.573	1.229	50	20	IDGD	
Cc1cc(C(C)(C)C)ccc1OCCCC(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1	765070570	LDPJKEMFQUQTPN-MRXNPFEDSA-N	425.551	1.969	50	20	IDGD	
O=C(C[C@H]1CCc2ccccc2C1)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765735358	KXISQODEUGADLP-IBGZPJMESA-N	434.540	1.787	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NCc2ccc(O)c(Br)c2)c2ccccc2c1=O	767230322	DZOBVMOBNWJABX-UHFFFAOYSA-N	446.261	1.546	50	20	IDGD	
COCc1c(C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)cnn1-c1ccccc1	767739907	TXVMTCUWHXECDR-UHFFFAOYSA-N	433.424	1.508	50	20	IDGD	
COc1cc2c(cc1NC(=O)C(=O)NNC(=O)c1ccc(Cl)cc1O)NC(=O)CC2	768239895	QPLMVFQTIWLMTA-UHFFFAOYSA-N	432.820	1.339	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@H](NCC(=O)NNC(=O)c1cccc(C#N)c1)C1CCCC1	769920524	JBTGZIRKUZBFTN-SFHVURJKSA-N	429.521	1.992	50	20	IDGD	
CN(C)Cc1ccc(C(N)=O)cc1NC(=O)NNc1ccc(S(=O)(=O)C(F)F)cc1	770052208	KIYVUNZXDKHKKE-UHFFFAOYSA-N	441.460	1.992	50	20	IDGD	
Cc1nc2c(c(O)nn2C)c(C)c1CC(=O)NNc1nc(O)c2cnn(C(C)(C)C)c2n1	770956481	UIXWELHLHBLJBN-UHFFFAOYSA-N	439.480	1.577	50	20	IDGD	
COc1cc(C)c(S(=O)(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)c(C)c1	771609226	XFHFPXSNDJRROF-UHFFFAOYSA-N	425.894	1.591	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)[C@@H]1CC(=O)N(CCOc2ccccc2Cl)C1	772215755	IXBCMHZTPHPEMC-CHWSQXEVSA-N	425.869	1.056	50	20	IDGD	
CCCS(=O)(=O)N1CCCC[C@@H]1C(=O)NNC(=O)[C@H](C)Oc1cccc(Cl)c1	772969651	OGWIMGXZADAPBZ-XJKSGUPXSA-N	431.942	1.849	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N2CCCCC2)cc1NC(=O)C(=O)NNc1ncccn1	773720390	XOTDWPOOGKBNSL-UHFFFAOYSA-N	448.505	1.132	50	20	IDGD	
COc1ncc(/C=C\C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)cn1	773860013	TYUQYYOONZXWGF-SREVYHEPSA-N	444.923	1.117	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)cc1C	774003443	WCBSNFNPEKLBOA-LBPRGKRZSA-N	433.848	1.988	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccc(Cl)c(C(N)=O)c1	774010599	YIUSMHWLLVVWNX-SECBINFHSA-N	439.255	1.646	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(C(=O)NNC(=O)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)C1	774246164	OOKJDZUYYNSWEH-CYBMUJFWSA-N	426.514	1.648	50	20	IDGD	
O=C(CCSc1ccc(F)cc1)NNC(=O)Nc1ccnn1[C@@H]1CCS(=O)(=O)C1	776054393	FVJDUPNGVTWUHW-CYBMUJFWSA-N	441.510	1.717	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2N2CCOCC2)nc2ccccc21	776703714	ZZCUMWYBZCQRFH-UHFFFAOYSA-N	438.444	1.322	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CN(C)[C@H](C)c2cccc(N3CCCS3(=O)=O)c2)cc1	778227804	XIRDEQMUVPDNCZ-QGZVFWFLSA-N	444.557	1.989	50	20	IDGD	
C[C@H]1CCN(C(=O)OC(C)(C)C)[C@H](C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)C1	778835676	KEQHWWGZOVZLFV-KBPBESRZSA-N	443.545	1.877	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)c1cccc(NS(=O)(=O)C(F)(F)F)c1	782536495	GTYCNHZTMIYJBP-UHFFFAOYSA-N	435.355	1.927	50	20	IDGD	
CCCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNc2ncnc3ccsc23)cc1	783261346	FPKHEQLAEQFMQE-UHFFFAOYSA-N	434.503	1.925	50	20	IDGD	
CC(=O)N1CCN(c2cccc(NC(=O)C(=O)NNc3ncnc4ccsc34)c2)CC1	783263869	MGZRKEVDCRTIOF-UHFFFAOYSA-N	439.501	1.442	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2cccnc2OC(C)C)nc1	783265750	WXRTVLACGRXIIL-UHFFFAOYSA-N	436.494	1.032	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)C(=O)Nc1ccc(-c2cc[nH]n2)cc1	784210056	AAWGMMWNXWXSKA-UHFFFAOYSA-N	440.485	1.599	50	20	IDGD	
O=C(NCCCc1nc(-c2ccc(F)cc2)no1)NNC(=O)[C@@H]1COc2ccccc2O1	784450902	BBNIAQWGRYLZMB-KRWDZBQOSA-N	441.419	1.979	50	20	IDGD	
COc1ccc(OC)c(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)c1	784836427	XACDUVFAUJJVSU-UHFFFAOYSA-N	429.401	1.782	50	20	IDGD	
CN(C)c1nccc(NNC(=O)C(=O)Nc2ccc(F)cc2-c2nc(C3CC3)no2)n1	784969860	ATGUYMOEVBOPOR-UHFFFAOYSA-N	426.412	1.691	50	20	IDGD	
CCN(CC)CCn1ccc2cc(NC(=O)C(=O)NNc3nccn(C)c3=O)ccc21	785090382	QSZSXVZYFRPMPT-UHFFFAOYSA-N	425.493	1.159	50	20	IDGD	
CC(C)(C)OC(=O)NCc1cccc(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c1	786692587	JBZBVCHVPKSXIW-UHFFFAOYSA-N	437.460	1.762	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(C)c(C(=O)N3CCOCC3)c2)c(C)o1	787541020	IKXGNFRWJDJJRG-UHFFFAOYSA-N	428.445	1.077	50	20	IDGD	
CCCn1nc(C(=O)NNS(=O)(=O)Cc2cc(C(C)(C)C)on2)c2ccccc2c1=O	788139231	KYYOVZGJDDDYPC-UHFFFAOYSA-N	447.517	1.856	50	20	IDGD	
COc1ccc(/C=C\C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1OC	788959202	SEBOZYBBXZHLRQ-CLFYSBASSA-N	429.385	1.630	50	20	IDGD	
CCn1c(=O)c(C(=O)/C(C#N)=C/c2cn(C(C)(C)C)nn2)c(N)n(Cc2ccccc2)c1=O	790216718	TYOHZPGEEYDZJK-LFIBNONCSA-N	447.499	1.797	50	20	IDGD	
CCc1nn(C)c(CC)c1CC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	790803723	LQXTWHJFGMDLOL-UHFFFAOYSA-N	448.593	1.167	50	20	IDGD	
COc1ccc(C(=O)NNc2nc3ccccn3n2)cc1S(=O)(=O)NC1CCCC1	791239175	FOZUXARMVSRDAP-UHFFFAOYSA-N	430.490	1.716	50	20	IDGD	
Cc1ccc(C)c(OCCC(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1	791405384	YOVPDLTVGPKDPF-LJQANCHMSA-N	428.441	1.603	50	20	IDGD	
COc1cc(C(F)(F)F)ncc1NC(=O)C(=O)NNC(=O)CSc1ccccc1O	792266111	NLDQCHMOOGCYAO-UHFFFAOYSA-N	444.391	1.693	50	20	IDGD	
Cc1ccc(-c2noc(CN3CCN(C(=O)NNC(=O)c4cccc(C)n4)CC3)n2)cc1	793228719	PRFMTSAOQNFLNW-UHFFFAOYSA-N	435.488	1.921	50	20	IDGD	
C[C@](O)(CSc1cccc(F)c1)C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	795194361	BJNOPIQIEFIIGR-SFHVURJKSA-N	426.491	1.534	50	20	IDGD	
O=C(COC(=O)c1cc(F)ccc1-n1cccn1)NNC(=O)[C@H]1COc2ccccc2O1	796086507	SXQAJVJSEIVMPW-GOSISDBHSA-N	440.387	1.156	50	20	IDGD	
CN(C(=O)OC(C)(C)C)[C@H](C(=O)NNc1nc2ccccc2c(=O)n1C)c1cnn(C)c1	796442199	SWYJONLJWRVWHV-INIZCTEOSA-N	441.492	1.718	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)Nc2cc(S(=O)(=O)N3CCCC3)ccn2)c1O	797675237	GUBQFXGGYHHHBF-UHFFFAOYSA-N	435.462	1.047	50	20	IDGD	
CNC(=O)CNC(=O)c1cccc(NC(=O)NNC(=O)Cc2ccc3ccccc3c2)c1	800595788	GTPDRQSYJGWYSG-UHFFFAOYSA-N	433.468	1.711	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N=c2cc[nH]cc2)cc1S(=O)(=O)NC1CCCC1	802026582	HTVWMDOMNDCQQY-UHFFFAOYSA-N	433.490	1.200	50	20	IDGD	
COCCn1nc(C(=O)NNC(=O)Nc2cc(OC)c(Cl)cc2OC)ccc1=O	802081037	YVJMKRSPRHOEPH-UHFFFAOYSA-N	425.829	1.027	50	20	IDGD	
Cn1cccc1C(=O)C(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	806347012	CUXMRHZOIGVLTE-UHFFFAOYSA-N	429.440	1.371	50	20	IDGD	
COC(=O)c1cc(C)c(NC(=O)C(=O)NNC(=O)CCOc2ccccc2)c(Cl)c1	806977697	VKUZTQBGPCLSEM-UHFFFAOYSA-N	433.848	1.990	50	20	IDGD	
O=C1COc2c(cc(Cl)cc2NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2F)N1	806979975	HRTFKWADCMTQTO-UHFFFAOYSA-N	441.202	1.863	50	20	IDGD	
CCCCN1C(=O)C[C@H](C(=O)NNC(=O)N2CCN(C)CC2)[C@H]1c1ccc(OC)cc1	807379310	WZUNQXMTTFRULD-AZUAARDMSA-N	431.537	1.373	50	20	IDGD	
O=C(NCC1=CCCOC1)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	807594570	XZMLGUNELBEABZ-UHFFFAOYSA-N	433.472	1.679	50	20	IDGD	
COc1cc(NC(C)=O)c(Cl)cc1S(=O)(=O)NNC(=O)COc1ccccc1O	808289393	GJDPMTDIVSNMIN-UHFFFAOYSA-N	443.865	1.401	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)C(=O)Nc2ccc(Oc3cccnc3)cc2)c1	808935169	LKBAXJZUYDFPBC-UHFFFAOYSA-N	434.412	1.627	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)NCC(=O)NNc2ncc(Cl)cc2Cl)cc1	811164604	VDQZGXQCGRFTBV-UHFFFAOYSA-N	432.289	1.768	50	20	IDGD	
CCOC(=O)c1cc(S(=O)(=O)NNC(=O)c2cnn(C)c2)cc(Br)c1C	811684364	FXRJYCXNMGHWNH-UHFFFAOYSA-N	445.295	1.291	50	20	IDGD	
COCCCNC(=O)NNC(=O)Cc1nc(-c2ccc(S(C)(=O)=O)cc2)cs1	815114129	DXTGRANMULOGAC-UHFFFAOYSA-N	426.520	1.123	50	20	IDGD	
O=C(COC(=O)COc1ccc(Cl)c(F)c1)NNC(=O)[C@H]1COc2ccccc2O1	815299706	MZCJYZNAUVMFLJ-MRXNPFEDSA-N	438.795	1.389	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)c2cnn(-c3ccccn3)c2N)c1	815377292	PFTJTRZZUVHRLK-UHFFFAOYSA-N	431.250	1.695	50	20	IDGD	
Cc1ccccc1COc1cccc(NC(=O)C(=O)NNC(=O)[C@H]2CCc3nncn3C2)c1	815691073	DWJMTBLJQJOPFJ-INIZCTEOSA-N	448.483	1.514	50	20	IDGD	
CCOc1ccc(NNC(=O)C(=O)Nc2cccc(S(=O)(=O)N3CCOCC3)c2)cc1	815816116	ILGDPHBCGHNEMB-UHFFFAOYSA-N	448.501	1.188	50	20	IDGD	
Cc1nc(CSc2ccccc2C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)cs1	841751466	ZBWGCDZNTAEJNV-LBPRGKRZSA-N	425.557	1.940	50	20	IDGD	
O=C(/C=C\c1ccc([N+](=O)[O-])cc1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	912642911	IHSWZQLAFBFQKD-FLIBITNWSA-N	444.469	1.854	50	20	IDGD	
NC(=O)c1ncn2c(C(=O)NNC(=O)c3c[nH]c4ccccc34)cc(-c3ccco3)nc12	913081601	CBPFDVCQXYNDND-UHFFFAOYSA-N	429.396	1.644	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)NCC(=O)NNC(=O)COc2cc(C)ccc2C)cc1	913449264	PXKHIDOJIZHAFK-UHFFFAOYSA-N	433.486	1.011	50	20	IDGD	
COc1cccc(C(=O)NCC(=O)NNC(=O)COc2ccc(Br)cc2)c1	913457973	ZZBRRNVXMBCDNY-UHFFFAOYSA-N	436.262	1.414	50	20	IDGD	
O=C(NNC(=O)N1CC=C(c2c[nH]c3ncccc23)CC1)c1ccc(-n2cnnn2)cc1	913627845	CABWHEGXTGYKPF-UHFFFAOYSA-N	429.444	1.682	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@@H](c2ccco2)N2CCCC2)c1	915896955	YGIUGZYTUJOUIC-KRWDZBQOSA-N	449.533	1.311	50	20	IDGD	
COC(=O)c1ccc(CCNC(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)cc1	916249112	PATSJRWJXHMUBB-UHFFFAOYSA-N	435.506	1.424	50	20	IDGD	
C[C@@]1(NNC(=O)NCc2ccc(N3CCc4ccccc4C3)nc2)CCS(=O)(=O)C1	916431017	BGODZOPUZXUKSG-OAQYLSRUSA-N	429.546	1.525	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCCCC(=O)NC1CC1	916577503	GDIZHZLQDJQOLY-LLVKDONJSA-N	427.299	1.606	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)NCCS(=O)(=O)NCc2ccccc2)c2ccccc2n1	916645112	DDCOTIITXQAGEU-UHFFFAOYSA-N	441.513	1.607	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2c(C)nn3c(C)cc(C)nc23)c2ccccc2c1=O	916728301	OXENODDLPRYLEB-UHFFFAOYSA-N	433.472	1.849	50	20	IDGD	
Cn1cc(S(=O)(=O)NC(=O)/C(C#N)=C\c2cn(CCC#N)nc2-c2ccccc2)cn1	916821678	OSWJSEZATKDSRE-YBEGLDIGSA-N	435.469	1.609	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1	918001883	JAQJMKFWGZQXLM-SFHVURJKSA-N	439.516	1.606	50	20	IDGD	
Cc1ccc([C@@H](C)NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1	918233287	BHACODOQCQBRRP-MRXNPFEDSA-N	446.529	1.721	50	20	IDGD	
C=CCOc1c(Br)cc(C=NNC(=O)N[C@H]2CCS(=O)(=O)C2)cc1OC	920383542	FQMQZGDUDDHEKM-LBPRGKRZSA-N	446.323	1.843	50	20	IDGD	
CCOc1ccc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)CN(CC)CC)cc2)cc1	920431522	AQKYLGJANWBRDJ-UHFFFAOYSA-N	448.545	1.989	50	20	IDGD	
CCNC(=O)NNC(=O)c1ccc(NC(=O)C[C@H]2SC(N3CCCC3)=NC2=O)cc1	920858186	JEKUOFPOMNEIPN-CQSZACIVSA-N	432.506	1.073	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)N[C@@H]1CCCN(C(=O)c2ccccc2)C1	1115952210	GEHAZGNLJBIXIC-OAHLLOKOSA-N	434.456	1.584	50	20	IDGD	
CS(=O)(=O)Nc1cccc(F)c1CNC(=O)NNC(=O)c1cc(Br)c[nH]1	1319535536	ARVCHNRLQXIAQL-UHFFFAOYSA-N	448.274	1.432	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2ccccc2Cl)cc(NS(C)(=O)=O)c1OC	1323203536	FIZOSGZNRDESOV-UHFFFAOYSA-N	427.866	1.804	50	20	IDGD	
CC(=O)N(c1ccc(F)cc1)c1nc(C=NNC(=O)N[C@@H]2CCS(=O)(=O)C2)cs1	1337811657	JUGDSBQWROYWKK-CYBMUJFWSA-N	439.494	1.787	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)NCCc1nc(Cc2ccccc2)no1	1346271420	GSMSDBLQRQNRQV-UHFFFAOYSA-N	425.445	1.621	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3n[nH]c4c3CC[C@@H]4C)C2)C1	1777854019	HIJVTQBUISEGIY-PZROIBLQSA-N	425.327	1.686	50	20	IDGD	
CCCCC[C@@H](C)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1	1779033823	FGECGMVKWVPJDP-ZHRRBRCNSA-N	431.537	1.345	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cnc3snnc3c1)CCO2	1779299259	VOZVEQLNESKFLX-SFHVURJKSA-N	435.582	1.381	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cc4n(n3)CCCC4)CCO2)C1	1783349688	RFOFZEVTVPZKKQ-BEFAXECRSA-N	439.354	1.836	50	20	IDGD	
COc1ncc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](C)Br)C3)C2)cc1C	1783531959	GJSFRGTZOTUTCU-ACJLOTCBSA-N	426.311	1.626	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1CC(c3ccccc3)=NN1)CCO2	1783535337	BJSYEBHSUIFAOW-VHFSOBRXSA-N	449.349	1.366	50	20	IDGD	
COc1ccc(OCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)C(Cl)Cl)C[C@@H]32)cc1	1783780184	VUSQAHUXFFSMEQ-RCBQFDQVSA-N	431.316	1.857	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(-n4cccn4)cc3)CCO2)C1	1783882507	ZWIWHQBZRCDZTC-WIYYLYMNSA-N	432.908	1.570	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccnc(F)c3)C[C@@H]21	1783970158	SEDNPCPVINZIPT-MXAVVETBSA-N	428.302	1.845	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccccc3O)C[C@@H]21	1783974502	OVZKQVCYUASUGS-MBGYTDRXSA-N	439.350	1.945	50	20	IDGD	
O=C(Cc1cnc2ccccn12)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21	1784046170	KVTAWLBRMRQTIX-XIRDDKMYSA-N	449.349	1.642	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(OC)n3)[C@H]2C1	1785812055	AVPTXVKULSQUOY-YXWQFLTLSA-N	440.338	1.857	50	20	IDGD	
Cc1nnc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)Br)C[C@@H]32)s1	1787058369	HBPBRIIOLQHYRA-IXOXFDKPSA-N	431.356	1.152	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3c[nH]cc3C)[C@H]2C1	1787599012	BYBCMOVKUVBSEN-IIYRHJEWSA-N	440.504	1.050	50	20	IDGD	
Cn1c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](O)CCl)C[C@@H]32)ccc1C(F)(F)F	1787740806	JJNNFZZAENBBOP-IMIFBBOLSA-N	437.846	1.237	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)c1cccc(C(F)(F)F)c1	1789549898	ZTKLTNFHWWNDIA-HNKHHVNMSA-N	434.842	1.898	50	20	IDGD	
CC(C)(C)OC(=O)CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]2C1	1789868878	QHXRWVXZLPJHQD-MNUAXYBXSA-N	437.364	1.934	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/c3cnccn3)C[C@@H]21	1789873021	PAJQBOLJAKWGIH-FHYOHNPVSA-N	427.332	1.706	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/c3cccnc3)C[C@@H]21)[C@H](F)Br	1789922487	NMZBYTGYHUSRGS-IBCWIVPQSA-N	426.286	1.765	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CC34CCCN3CCC4)C[C@@H]21)[C@H](F)Br	1789923286	DEFNUFMYWXGTOX-JKQORVJESA-N	446.361	1.675	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc4ccccn34)C[C@@H]21)[C@H](F)Br	1789925752	ISUCXTFCBGHYLI-DUPGQFARSA-N	439.285	1.618	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1(c2ccc(NC(=O)c3ncon3)cc2)CCC1	1789944009	ISWDDBLXWJPQRK-LGJNPRDNSA-N	435.444	1.951	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(C4CC4)cc3)[C@H]2C1	1790253091	NOSCQALHHRQMKM-ACRUOGEOSA-N	442.560	1.530	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3(C(=O)OC)CC3)[C@H]2C1	1790889152	INLXYLFMSPPNDO-XUXIUFHCSA-N	431.327	1.093	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cn(C)nc3OC)C[C@@H]21	1790961543	PFRZQTZCLXQEFL-VIRABCJISA-N	443.342	1.196	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nsnc3NC)C[C@@H]21	1790962361	VZDQICYYERHBTM-YFKTTZPYSA-N	446.371	1.347	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21	1790963196	OAQRZLNMTGLGJJ-UHFZAUJKSA-N	444.139	1.830	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnn4c(C)cc(C)nc34)C[C@@H]21	1791254930	XFXIZEJUCOXOHV-DKIMLUQUSA-N	449.939	1.193	50	20	IDGD	
CC(=O)N[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)CBr)C(C)(C)C	1792868518	CBRDWJSBKPWWHI-YMILTQATSA-N	446.386	1.158	50	20	IDGD	
COc1ncccc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)CBr	1792870459	PBBOUIWMEJHJDT-XPCVCDNBSA-N	426.311	1.324	50	20	IDGD	
CCc1c(Br)c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](O)CCl)nn1C	1793109839	GVGWNQZXNJIZAZ-LSCVPOLPSA-N	447.761	1.597	50	20	IDGD	
C[C@H](Sc1ccccc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCC(=O)NN(C)C)C2	1793239038	KGHCJUCIYJPNBN-OPOADAIRSA-N	448.589	1.130	50	20	IDGD	
COc1cc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCBr)C3)ccn1	1793901181	YXXHRFQLOVWRLS-CCWDJLKJSA-N	440.338	1.397	50	20	IDGD	
Cc1noc(C)c1CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnccc1C(=O)NN)C2	1794414777	MAVCAYZSHWSTMA-MUJYYYPQSA-N	440.504	1.175	50	20	IDGD	
CCn1nc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](Cl)COC)C3)c2ccccc21	1796023553	SNJJJFGDIWNROV-KPEUIFRASA-N	434.924	1.513	50	20	IDGD	
CSc1ccc(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)cc1	1796192320	ZTSJAZSNCYLULN-ACDBMABISA-N	438.358	1.583	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1Cc2ccccc2CN1	1796374312	XXPPOOMQSMQIPN-IHXXTUNLSA-N	436.350	1.074	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/c1ccccc1)C2	1796440927	FAKTVVCDXUGOQA-ZISJOHAUSA-N	449.511	1.423	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc2scnc2c1)c1ccc(B(O)O)cc1	1798155180	XDGZHCNNEXZOFQ-BCDXTJNWSA-N	435.314	1.542	50	20	IDGD	
Cc1ccc(=O)n(C(C)(C)C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CCBr)C3)n1	1798587783	FFLSOPCLURSXOB-QDMKHBRRSA-N	439.354	1.710	50	20	IDGD	
C[C@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2)N(C)C(=O)OC(C)(C)C	1799139795	DKGOEPHUWFVOMS-FVCCEPFGSA-N	438.352	1.635	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](O)CCl)C2	1799219535	PHRMNRAUWXFIRH-ZWUHOBOKSA-N	439.852	1.372	50	20	IDGD	
CN(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](F)Cl)C2)NC(=O)NCc1ccccc1	1799871690	VUUORKCXEPCEMB-DFGXFYAUSA-N	439.919	1.505	50	20	IDGD	
Cc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)Br)C3)nc2nccn12	1799991937	UPQFPHJKDHSSCR-GUIRCDHDSA-N	436.310	1.024	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cccc(F)c1F	1800667217	ULIXBJLDVHOMQH-AKENFEQQSA-N	431.277	1.880	50	20	IDGD	
Cc1nccn1CCCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)Br	1800762866	IIXPLIVGHLVUFK-JJAZEVLHSA-N	427.343	1.345	50	20	IDGD	
Cc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Br)C3)cc(C)c1O	1801703132	IACSWILHAIWBSB-HLPPOEQASA-N	429.286	1.903	50	20	IDGD	
C=C(Oc1ccccc1O)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCC(=O)NN(C)C	1802332355	ARPYVISJZOLFNU-BJWYYQGGSA-N	430.505	1.296	50	20	IDGD	
COc1ccc([C@H](O)C(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)cc1	1802800271	WMBSCPXCOPFICQ-NBYUQASBSA-N	447.919	1.429	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)N2CCCC3(CCN(C(=O)[C@H](O)CCl)CC3)C2)c1	1805130247	VMLXMQQYOMEGFI-QGZVFWFLSA-N	442.965	1.535	50	20	IDGD	
Cc1cccc(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)n1	1805508389	VCIVTIOIYONZPZ-SIKLNZKXSA-N	444.300	1.098	50	20	IDGD	
Cc1occc1C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1805614871	IMIHHZAETVKDRI-GHTZIAJQSA-N	433.273	1.296	50	20	IDGD	
O=C(CCBr)NC[C@@H]1CCN(C(=O)c2ccnnc2O)[C@H]1c1cccnc1	1806342530	KJBMNEYYXOUEFX-BBRMVZONSA-N	434.294	1.682	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@H](CNC(=O)CSC(=N)N)[C@@H]1c1cccnc1	1807005991	NIEKYHXHPSLRRN-JDFRZJQESA-N	432.377	1.950	50	20	IDGD	
O=C(CCc1ccc[nH]1)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1807458615	BMFSJFKQDQVGTP-XXBNENTESA-N	446.316	1.042	50	20	IDGD	
CN(C)C(=O)NCC(=O)N1CC[C@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]1c1cccnc1	1808290190	QLPPHZDJTSVLCW-IDHHARJASA-N	444.363	1.595	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CCn2cncn2)[C@@H]1c1cccnc1)[C@H](F)Br	1808681828	VYKBGEHRLGLUAT-IMJJTQAJSA-N	439.289	1.460	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)c3nc4ccccc4o3)CC2)C1	1809974174	RUZIHKVWAMEQQZ-UHFFFAOYSA-N	447.300	1.666	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)c3ccc(Cl)cn3)CC2)C1	1809978022	NYYWEZPWHRAFOS-UHFFFAOYSA-N	441.724	1.573	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC2(CCCN(C(=O)Cn3cccn3)C2)CC1	1810169479	AXMFYVYCUWTHOZ-KOEQRZSOSA-N	439.520	1.248	50	20	IDGD	
O=C(c1n[nH]c2c1CS(=O)(=O)C2)N1CCCC2(CCN(C(=O)[C@H](F)Cl)CC2)C1	1810260485	FBVHTCNUQAYXIO-AWEZNQCLSA-N	432.905	1.217	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)Br)[C@@H]1c1cccnc1	1810533381	OOOGBMVMIPJRKR-LNCBFAARSA-N	437.338	1.562	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1CCN(C(=O)[C@@H]2CCNC(=O)C2)[C@@H]1c1cccnc1	1810548118	OMYFIAZGIDHXSG-OXFYSEKESA-N	432.597	1.465	50	20	IDGD	
C[C@H](C(=O)NC[C@H]1CCN(C(=O)CO[Si](C)(C)C)[C@@H]1c1cccnc1)n1ccnn1	1812398365	CYDATXPHCBVLOL-SZVBFZGTSA-N	430.585	1.792	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)CC(=O)NC)[C@@H]1c1cccnc1	1812773556	HCINBMCFWIXQAB-JKIFEVAISA-N	425.327	1.397	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)CNC(C)=O)[C@@H]1c1cccnc1	1812779300	SCCXURWGJNJBAU-HLLBOEOZSA-N	425.327	1.397	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)C(C)(C)NCCC#N)[C@@H]1c1cccnc1	1813031844	SWDZJUFPXXYYCG-FGTMMUONSA-N	435.956	1.623	50	20	IDGD	
CCc1nc(C(=O)N2CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)co1	1813074606	UOVVYOJQHUBHGJ-IERDGZPVSA-N	442.520	1.325	50	20	IDGD	
C[C@H](Oc1cccnc1)C(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1	1813437032	YWGLLACHOCJKRS-WQCNXYOZSA-N	432.908	1.550	50	20	IDGD	
O=C(CN1CCOCC1)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](F)Br)CC2	1814569244	XJLMYBFJBHYTEQ-TVQRCGJNSA-N	435.319	1.078	50	20	IDGD	
N#Cc1ccc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)cc1	1815343749	MXWCKBJIKKGLIX-QGZVFWFLSA-N	446.297	1.234	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ncccn2)n[nH]1	1816503062	PHZGCFWMRGBDNQ-PASSITCSSA-N	449.475	1.640	50	20	IDGD	
O=C(CCBr)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1816781700	FOUREUJYNKITIN-OAHLLOKOSA-N	449.114	1.180	50	20	IDGD	
C[C@H](C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1)n1cccc1	1817480035	ZSWSRWZAIYOXMJ-BEFAXECRSA-N	435.293	1.458	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1)c1ccc2c(n1)OCCO2	1817960375	OSTDOYPNGYBPDR-KBPBESRZSA-N	435.868	1.482	50	20	IDGD	
C[C@H](NC(=O)c1cnccn1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](F)Cl)n[nH]1	1818039845	JQOUPHOKXYTEEX-VZJVUDMVSA-N	437.863	1.545	50	20	IDGD	
COC(=O)C1(C(=O)N[C@H]2CCc3nc(NC(=O)CO[Si](C)(C)C)sc3C2)CC1	1820168968	NTSYTODNQIRHHS-NSHDSACASA-N	425.583	1.860	50	20	IDGD	
CC(C)NC(=O)OC(C)(C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1	1820739358	FXNDMHGOMAEBNV-ZIAGYGMSSA-N	443.932	1.915	50	20	IDGD	
CN[C@H](CC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](F)Br)n[nH]1)C(=O)O	1820932860	RUPJJPZQNGOBEH-GIPNMCIBSA-N	434.266	1.155	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN2CCNC2=N)[nH]n1	1822182874	DWMNLHSXMOUHLE-PWSUYJOCSA-N	426.319	1.025	50	20	IDGD	
CN[C@H](CC(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](C)Br)n[nH]1)C(=O)O	1822183859	NRVVNNZGDGZTLL-JLLWLGSASA-N	430.303	1.248	50	20	IDGD	
CCC[C@H](NC(C)=O)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](Cl)COC)n[nH]1	1822376270	FPYZDRPTUWCOAK-YCPHGPKFSA-N	427.933	1.960	50	20	IDGD	
Cc1cccn2ncc(C(=O)Nc3nc4c(s3)C[C@@H](NC(=O)[C@H](O)CCl)CC4)c12	1824335149	QFBWMJDVGUFEHN-SMDDNHRTSA-N	433.921	1.925	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H](C)NS(=O)(=O)CC)CC1	1824462717	APVUABBILRPXSM-HYVNUMGLSA-N	436.018	1.951	50	20	IDGD	
Cc1nn(C)cc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1	1824713266	USJPQYYVFLRPMS-IBGZPJMESA-N	432.569	1.335	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4n(n3)CCCO4)C2)C1	1830362287	PWNNBMPLZFXCHW-FQEVSTJZSA-N	440.928	1.001	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C=C/c3cc(C)on3)C2)C1	1831651333	ORBWSBVCWRMDKS-HOQHSMRBSA-N	425.913	1.860	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnc(C)c(C)c3)CCO2)C1	1833300650	IBKICPUVXIVRFP-PXNSSMCTSA-N	425.913	1.022	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)C(Cl)(Cl)Cl)CC2)CC1)[C@H](O)CCl	1833312580	YLYBUHCRDRUNMQ-GFCCVEGCSA-N	435.179	1.528	50	20	IDGD	
Cc1nn(C)cc1C(=O)NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1	1833581023	FQXKAUKZHBQAKB-UHFFFAOYSA-N	440.386	1.699	50	20	IDGD	
Cc1cnc(C(=O)NC2CCN(C3CCN(C(=O)CCBr)CC3)CC2)cn1	1834160500	UBPIYCKBGUOKFR-UHFFFAOYSA-N	438.370	1.755	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(O)cn3)CCO2)C1	1834588037	FAFLFYNGORSDEL-ZWKOTPCHSA-N	432.304	1.094	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H]3CC[C@@H]4CCC(=O)N4C3)CC2)CC1)[C@H](F)Cl	1835082201	VQZHAHSIWULVFH-BJZITVGISA-N	442.963	1.493	50	20	IDGD	
CC(=O)Nc1cc(C(=O)NC2CCN(C3CCN(C(=O)[C@H](F)Cl)CC3)CC2)ccn1	1835262396	SHCQYOJTYFPQOS-SFHVURJKSA-N	439.919	1.760	50	20	IDGD	
O=C(c1cc(O)nc(O)c1)N1CCC(OC2CCN(C(=O)C(Cl)Cl)CC2)CC1	1838031708	GGTOJSODZDOEMA-UHFFFAOYSA-N	432.304	1.909	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccnc3SC)CCO2)C1	1838287309	GTJACWXJAVWKDX-KXBFYZLASA-N	443.953	1.127	50	20	IDGD	
C[C@H](C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2)C1(O)CCC1	1839149920	WGSSVPBPMPGLEG-FHLIZLRMSA-N	437.364	1.230	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(O)cc3)C2)C1	1839154276	IVQPSUFFSWEPEW-RBUKOAKNSA-N	431.316	1.699	50	20	IDGD	
O=C(C1CC(F)(F)C1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839197485	XWXAEUAYQHZVMV-SMDDNHRTSA-N	429.233	1.179	50	20	IDGD	
CC[C@@H](O)C(=O)N1CCOC[C@@]2(CN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)CCO2)C1	1839741801	BNYBLHWVBYOCMK-UNHHPSKZSA-N	449.454	1.099	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3c(C)n[nH]c3C)C2)C1	1839965225	QZNZXFSPNDQEIQ-KBXCAEBGSA-N	443.342	1.270	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccccc3)C2)C1	1839966041	SMOZUSIYVZFSRL-APWZRJJASA-N	425.323	1.930	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3ccoc3)C2)C1	1839967114	AVWPELXCVRCVDF-VQIMIIECSA-N	443.338	1.842	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)n3cccn3)C2)C1	1839967503	OGIBYOLOSRKPCR-RVKKMQEKSA-N	443.342	1.074	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](OC)c3ccccc3)C2)C1	1840151709	MCTFFALBTVNDFJ-BBTUJRGHSA-N	440.924	1.084	50	20	IDGD	
O=C(COc1ccc(F)cc1)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840188136	QDLZFLACUSZUFV-SFHVURJKSA-N	435.279	1.465	50	20	IDGD	
N#CCc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)cc1	1840189249	GHARPIJTFJZSOB-IBGZPJMESA-N	426.300	1.626	50	20	IDGD	
CO[C@H](C)[C@@H](C(=O)N1CC2(CCCN2C(=O)[C@@H](F)Cl)C1)N(C)C(=O)OC(C)(C)C	1843365462	RXYPDGRWUUVFIZ-HZSPNIEDSA-N	435.924	1.995	50	20	IDGD	
O=C1c2ccccc2CN1CCC(=O)N1CCCC12CN(C(=O)[C@H](F)Br)C2	1843871597	MVGTULWLBCVIIJ-INIZCTEOSA-N	438.297	1.926	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@]2(NC(=O)OC(C)(C)C)CCOC2)C1	1845208649	RAIHCVWIVNYXKC-JLTOFOAXSA-N	429.945	1.891	50	20	IDGD	
O=C1CC[C@H](C(=O)N2CC3(CCCN3C(=O)[C@H](Br)Cc3ccccc3)C2)N1	1845940686	DTZRGIAIKSGJHJ-HZPDHXFCSA-N	434.334	1.475	50	20	IDGD	
CCOc1ccsc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cnccc1C(=O)NN	1847188685	QKYIOOMYSKJOOU-GJZGRUSLSA-N	429.502	1.275	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2ccc3c(c2)NC(=O)CS3)cc1OC	9074419	YDVLZNQUOHXQBU-UHFFFAOYSA-N	445.453	1.366	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)cc1	18103867	DPMUOEHDHJTRJO-DLBZAZTESA-N	433.530	1.894	50	20	IDGD	
Cc1nc(-c2c(C)c(C)nn(C)c2=O)sc1C(=O)NNC(=O)Cc1ccccc1F	303382022	WEANKAWWJLSQEM-UHFFFAOYSA-N	429.477	1.972	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)CC23C[C@H]4C[C@@H](CC(O)(C4)C2)C3)ccc1Cl	726150975	CYMPVSRWEGVFSB-TYGXQLQZSA-N	441.937	1.470	50	20	IDGD	
C#Cc1cccc(NC(=S)NNC(=O)CN(C)S(=O)(=O)c2ccc(Cl)cc2)c1	726437735	JXYQHJGYQMTTIF-UHFFFAOYSA-N	436.946	1.960	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)[C@H]2CCCN2C(=O)/C=C/c2ccc(C(N)=O)cc2)cc1	728204289	CGTGWNSVMQOEPO-ZTVSIKPCSA-N	449.511	1.358	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2ccccn2)c(Br)cc1Cl	728261481	SDLVWPSHYGVLEW-UHFFFAOYSA-N	448.682	1.907	50	20	IDGD	
CC(C)CN1CCO[C@H](CNC(=O)NNC(=O)c2cc(F)ccc2Br)C1	728741626	RXQIOXWRBYODKY-CYBMUJFWSA-N	431.306	1.889	50	20	IDGD	
CCC(C)(C)C1CCC2(CC1)NC(=O)N(CC(=O)NNC(=O)Cc1cccnc1)C2=O	728856482	QZMGIKMSYFZLTF-UHFFFAOYSA-N	429.521	1.689	50	20	IDGD	
CN(C)c1ccc(NC(=S)NNC(=O)CCNC(=O)c2ccc([N+](=O)[O-])cc2)cc1	729691066	YPBBQJJQYJDADC-UHFFFAOYSA-N	430.490	1.799	50	20	IDGD	
CN(C)c1ccc(NC(=S)NNC(=O)CCn2c(=O)nc(O)c3ccccc32)cc1	729691081	ZWGYUXIIQKLEJP-UHFFFAOYSA-N	426.502	1.576	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(CNC(=O)NNC(=O)C(C)(C)c2ccccc2)cc1	731219927	NLTVAZHNSLUUAH-UHFFFAOYSA-N	448.545	1.420	50	20	IDGD	
O=C(NNc1nccnc1Cl)C1CCN(S(=O)(=O)c2cc(F)ccc2F)CC1	734260617	YZNZAKJIUIIQDA-UHFFFAOYSA-N	431.852	1.952	50	20	IDGD	
O=C(NCCc1ccc(Br)cc1)NNC(=O)c1ccc(-n2cnnn2)cc1	735330269	XIFWQCKPEKIJIR-UHFFFAOYSA-N	430.266	1.612	50	20	IDGD	
O=C(NNc1cccnn1)[C@H]1CCCN(S(=O)(=O)c2ccc(Br)cc2)C1	736702057	VYXPSGOGRVWGFM-LBPRGKRZSA-N	440.323	1.783	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)Cn2nc(-c3ccccc3)oc2=O)cc1C	736744001	IFLFCKONTJFFHW-UHFFFAOYSA-N	444.469	1.440	50	20	IDGD	
CCN1CCN(Cc2ccc(CNC(=O)NNC(=O)COCc3ccccc3)cc2)CC1	738457099	QAWCRUYYDJNSRY-UHFFFAOYSA-N	439.560	1.871	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2ccc(C(=O)NNc3ccnc(N(C)C)n3)cc2)C[C@@H](C)O1	740114172	RRBPHTMLHXVVNR-OKILXGFUSA-N	434.522	1.097	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2ccccc2-n2cccn2)c1	743358347	IPHVUQWJCPQRAO-UHFFFAOYSA-N	442.501	1.267	50	20	IDGD	
C[C@@H]1C[C@@H](NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)C(=O)N1c1ccccc1	743589401	UEWVWIDNGWWCOI-CRAIPNDOSA-N	437.504	1.217	50	20	IDGD	
CCCOc1ccc(C(=O)NNS(=O)(=O)c2cc(C)cc(C(=O)O)c2O)cc1OC	743837233	ZMYJCRZNXMDJOY-UHFFFAOYSA-N	438.458	1.820	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN(C[C@@H]2CCCO2)[C@@H]2CCS(=O)(=O)C2)cc1C	744401268	CIPKPMJKPIOBMG-CABCVRRESA-N	443.591	1.048	50	20	IDGD	
CCCCN1C(=O)CC[C@@H](C(=O)NNC(=O)C(=O)NC2CC2)[C@H]1c1ccc(OC)cc1	744463435	DIWIJXZUFZVWJY-IEBWSBKVSA-N	430.505	1.201	50	20	IDGD	
COc1cc(C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)cc(OC)c1OC(F)F	745604369	JQQVWCVTHOSKIZ-UHFFFAOYSA-N	449.366	1.795	50	20	IDGD	
C[C@]1(NNC(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CCS(=O)(=O)C1	745904127	MASFUUJOBHVWMA-UGSOOPFHSA-N	432.493	1.638	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)CCC(=O)Nc1nnc(C2CC2)o1	747345494	NJGIDCMVHANMCY-UHFFFAOYSA-N	425.449	1.425	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)[C@@H]2CCCCN2Cc2ccc(F)cc2)c2ccccc2c1=O	747345622	RTBRJBMBGBUBNW-IBGZPJMESA-N	437.475	1.888	50	20	IDGD	
O=C(CCN1CCN(C(=O)[C@H]2CCCO2)CC1)NNc1cccc(Br)c1	748019339	AFFQEJZZDZKHBH-MRXNPFEDSA-N	425.327	1.606	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)c2ccc([C@@]3(C)NC(=O)NC3=O)cc2)o1	748090086	FPRAHMYYQOOSOQ-OAQYLSRUSA-N	427.461	1.251	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@H]2CCCN2C(=O)CC(C)(C)C)c2ccccc2c1=O	748213632	CHVNPVNVWIQMBK-MRXNPFEDSA-N	427.505	1.605	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)[C@H]1CC(=O)N(c2cn[nH]c2)C1	748527234	KTBOJDBOHBTHCD-MNOVXSKESA-N	436.266	1.140	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)CCOc2ccc(C(N)=O)cc2)c1	748707973	IDJOSNLHBNRPTN-UHFFFAOYSA-N	436.262	1.787	50	20	IDGD	
CC[C@@H](CNC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)Oc1ccccc1F	748977556	RDXPEVWDCADVQT-ZDUSSCGKSA-N	427.436	1.874	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NCC(=O)N2CCN(c3ccccc3)CC2)cc1C	749220879	MAGGNVVGUCMWBJ-UHFFFAOYSA-N	439.516	1.361	50	20	IDGD	
O=C(NNC(=O)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1)[C@H]1CCS(=O)(=O)C1	751062876	NSKYJKXIUHHSPF-YOEHRIQHSA-N	433.452	1.023	50	20	IDGD	
Cc1cc(CSc2ncccc2C(=O)NNC(=O)CNC(=O)c2cccs2)no1	751208351	CEPYYWJRZPEONB-UHFFFAOYSA-N	431.499	1.923	50	20	IDGD	
CN(C)c1ncc(CNC(=O)NNC(=O)COc2ccc(Br)cc2)n1C	751806815	JTBXRABEIILLSC-UHFFFAOYSA-N	425.287	1.158	50	20	IDGD	
C[C@@H]1C[C@@H](CNC(=O)OC(C)(C)C)CN1CC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	752085232	NGTSHYBXTYENNS-KGLIPLIRSA-N	435.481	1.591	50	20	IDGD	
Cc1ccc([C@@H](C)NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1[N+](=O)[O-]	753042918	ZNNMOWTXBAKUCA-CYBMUJFWSA-N	449.489	1.859	50	20	IDGD	
COc1cc(OC)cc(OCCCNC(=O)NNC(=O)c2nnc(O)c3ccccc23)c1	753946796	LNNCQXLOTNDSNN-UHFFFAOYSA-N	441.444	1.766	50	20	IDGD	
C[C@@H](CNC(=O)OC(C)(C)C)NC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	755303405	STJQDOQEIMGLTA-NSHDSACASA-N	429.499	1.339	50	20	IDGD	
CCOc1ccc(NC(=O)NNC(=O)c2ccccn2)cc1S(=O)(=O)N1CCCC1	755468731	BEECCXXMLJPUJV-UHFFFAOYSA-N	433.490	1.731	50	20	IDGD	
COC(=O)CNC(=O)c1ccc(NC(=O)NNC(=O)c2cc3ccccc3cc2O)cc1	755547499	OXCTVYXEYPBBQK-UHFFFAOYSA-N	436.424	1.915	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2cccc(N3CCCS3(=O)=O)c2)cc1OC	755884067	FKCDFSSOADXPOL-UHFFFAOYSA-N	434.474	1.710	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccc(CN3CCCC3=O)cc2)c1	755939891	LVRPQBKBBZNROV-UHFFFAOYSA-N	430.486	1.679	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2sccc2CN(C)C)c1	756078973	FBQWZMIOSMMREC-UHFFFAOYSA-N	438.575	1.915	50	20	IDGD	
CCN(CC(=O)NNC(=O)c1ccc(OC)c(OC)c1)Cc1ccc(C(=O)N(C)C)cc1	756507914	GKAAUJNDKWLPPV-UHFFFAOYSA-N	442.516	1.689	50	20	IDGD	
O=C(COC(=O)c1c[nH]nc1-c1ccccc1F)NNC(=O)[C@@H]1COc2ccccc2O1	756607671	PHJYCVOOPFMSKD-KRWDZBQOSA-N	440.387	1.360	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc2c(c1)OCCCO2)NN=c1cc[nH]cc1Cl	757421707	BVHLQCOVPFFLBR-UHFFFAOYSA-N	426.882	1.130	50	20	IDGD	
C[C@H](Oc1ccc(Cl)cc1)C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	758703787	JJQCCURUDGIVKG-YVEFUNNKSA-N	434.832	1.638	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H](C#N)[C@H](NC(=O)NNC(=O)c2nnc(O)c3ccccc23)C1	758761472	QZZYJNZPKAXUMQ-SMDDNHRTSA-N	441.448	1.038	50	20	IDGD	
Cc1ccc(CNC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])c(O[C@@H]2CCOC2)c1	758899885	KEIADWFPIKBSHW-MRXNPFEDSA-N	444.444	1.980	50	20	IDGD	
CO[C@](C)(C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1)c1ccccc1F	760449534	QFKIZRDOFJSMQT-QHCPKHFHSA-N	442.491	1.293	50	20	IDGD	
CC(CC(=O)NNc1ncc(F)cn1)(CC(=O)NNc1ncc(F)cn1)c1ccccc1	760929948	WWDXKLULIKDSSV-UHFFFAOYSA-N	442.430	1.869	50	20	IDGD	
CCS(=O)(=O)Nc1cc(OC)ccc1S(=O)(=O)NNC(=O)NC1CCCCC1	761267254	PPXOSBFAPPWUIP-UHFFFAOYSA-N	434.540	1.282	50	20	IDGD	
CCCN1Cc2cccc(NC(=O)C(=O)NNC(=O)c3ccc(OC)c(OC)c3)c2C1	763550130	GVEUZGSBHOBSBR-UHFFFAOYSA-N	426.473	1.829	50	20	IDGD	
Cc1nn(-c2ccccc2)cc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccccc2)[nH]n1	763613185	JVZZSWZIZRDWKN-UHFFFAOYSA-N	429.440	1.971	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2cccc(OCCN(C)C)c2)c1	763665570	KGAQQNLHQLHVDS-UHFFFAOYSA-N	428.489	1.409	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(N3CCOCC3)c(F)c2)cc1C	763681502	YQIOHDJAGNNLKZ-UHFFFAOYSA-N	444.463	1.444	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc2c(c1)C[C@H](OC)C2	763681584	LXMKGVILWOPYBE-QGZVFWFLSA-N	427.457	1.364	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cc(C(=O)NC(C)C)ccc2Cl)cc1	763821340	OHLNPUWZZMLPLA-UHFFFAOYSA-N	446.891	1.952	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)OC(F)(F)O2	763866646	QOHKNESBKFDASX-SECBINFHSA-N	425.319	1.701	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ncn(Cc2ccccc2)n1	763873104	QXOPCWMYIRNGCD-CYBMUJFWSA-N	426.408	1.019	50	20	IDGD	
CS(=O)(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)Cc2ccc(F)cc2)c1	763933423	XULMEMAPJLLWBY-UHFFFAOYSA-N	427.841	1.211	50	20	IDGD	
COC(=O)c1sccc1NC(=O)C(=O)NNC(=O)c1ccc(Br)s1	763940615	LBIRLKPCMHAFQT-UHFFFAOYSA-N	432.277	1.758	50	20	IDGD	
CNC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)ccc1Cl	763974411	OBTHJGGEKFXHCS-UHFFFAOYSA-N	425.228	1.458	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)c(C(F)(F)F)c1	764003648	LAUYSWAVYQVRNF-UHFFFAOYSA-N	439.346	1.885	50	20	IDGD	
CCOC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)nc2)cc1C#N	764101056	NXQZDDBAJMIAKB-UHFFFAOYSA-N	430.808	1.575	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc(F)cc3OCC#N)n[nH]2)cc1	764112111	WAHFVYRLHUJEIG-UHFFFAOYSA-N	436.403	1.826	50	20	IDGD	
CCOC(=O)c1ccn(-c2ccccc2NC(=O)C(=O)NNC(=O)CC(F)(F)F)n1	764115076	MNQNHWYNKMNQAV-UHFFFAOYSA-N	427.339	1.087	50	20	IDGD	
CN(C)CCCOc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)cc1	764125922	AYMCACMMHLOTNT-UHFFFAOYSA-N	434.880	1.776	50	20	IDGD	
CCn1nccc1NC(=O)C(=O)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1	764179583	UYYRUBBAOFJJQJ-FQEVSTJZSA-N	446.511	1.616	50	20	IDGD	
COC(=O)c1c(NC(=O)C(=O)NNC(=O)c2cccc(C#N)c2)sc2c1CCCC2	764242450	RAUZIOHMCOEDOF-UHFFFAOYSA-N	426.454	1.685	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)Cc2cc[nH]n2)cc1NC(=O)C1CCCCC1	764286249	QRCGZJUEPCUZFC-UHFFFAOYSA-N	442.476	1.266	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)C(=O)Nc1cc(Br)ccc1N1CCCC1	764297198	MTPWGTHCDWQLCJ-UHFFFAOYSA-N	435.282	1.481	50	20	IDGD	
CC(C)(C(=O)NNC(=O)C(=O)Nc1ccc(S(=O)(=O)NC2CC2)cc1)c1ccccc1	764309607	RKZLQGIMEDYMRW-UHFFFAOYSA-N	444.513	1.191	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F	764312901	CBSDVSPMNVJLJN-UHFFFAOYSA-N	426.307	1.664	50	20	IDGD	
CCCN1C(=O)CCc2cc(NC(=O)C(=O)NNC(=O)Cc3ccccc3F)ccc21	764318885	KQVWRDKRRZQUMU-UHFFFAOYSA-N	426.448	1.844	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccnn2C(C)(C)C)cc1Br	764326849	PKWNEZOWKOIHHJ-UHFFFAOYSA-N	438.282	1.809	50	20	IDGD	
COCCn1ncc2ccc(NC(=O)C(=O)NNC(=O)c3ccc(O)c(Cl)c3)cc21	764349263	HLKVPFXHMPJGFF-UHFFFAOYSA-N	431.836	1.441	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(C(=O)Nc2ccccc2)cc1	764399116	ZHODBXSBAKMUBZ-AWEZNQCLSA-N	428.445	1.076	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1F)C(=O)Nc1cccc(N2CCCNC2=O)c1	764409970	DERVUMMMCOAHRM-UHFFFAOYSA-N	433.827	1.799	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)OC(C)(C)C)cc(Br)c1F	764662210	IBPTTXFSSLWNDC-UHFFFAOYSA-N	434.218	1.869	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)CN(C)C(=O)OC(C)(C)C)CC2)cc1	766643467	WTZBOEBIIXOGRD-UHFFFAOYSA-N	433.553	1.127	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)[C@@H]1CCCN(C(=O)NCC(C)C)C1	767344338	MSXIOADJAXXKPM-GOSISDBHSA-N	432.521	1.306	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)c1sc(-c2cnn(C)c2)nc1C	767355582	SWSNENGQOXBYGA-UHFFFAOYSA-N	427.486	1.707	50	20	IDGD	
CCCS(=O)(=O)N1CCCC[C@H]1C(=O)NNc1c(OC)cccc1S(C)(=O)=O	768636544	SXFSLTRRZZANAT-ZDUSSCGKSA-N	433.552	1.136	50	20	IDGD	
O=C(NNC(=O)c1cc(O)cc([N+](=O)[O-])c1)c1ccc(S(=O)(=O)N2CCCC2)cc1	769470360	CKILPEVSNBQMBD-UHFFFAOYSA-N	434.430	1.160	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(F)(F)c2ccc(OCC(=O)N(C)C)cc2)c1O	769651033	MFDFAXRQEWBUNT-UHFFFAOYSA-N	437.399	1.421	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCc1cccc2c1OCCCO2	769952149	HLFJPKZGLILTOJ-UHFFFAOYSA-N	447.517	1.594	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)c1ccc2nc(C(F)(F)F)cn2c1	770242450	QXNPUKVSFXAJFS-UHFFFAOYSA-N	430.387	1.822	50	20	IDGD	
CCn1c(S)nc2cc(C(=O)NNC(=O)c3ccc4c(c3)OCCO4)ccc2c1=O	770423738	CGGXWSSLVSDEPY-UHFFFAOYSA-N	426.454	1.551	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)c3ccc([C@]4(C)NC(=O)NC4=O)cc3)nc21	770967135	ZDUXXRBWXDEAHD-FQEVSTJZSA-N	438.448	1.098	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)c1cc(S(N)(=O)=O)cc(Cl)c1Cl	772135401	GCLBCINJGDRNIZ-QMMMGPOBSA-N	440.305	1.380	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCCCCC(=O)OC(C)(C)C	773447457	HEKYEECOQBCDLB-UHFFFAOYSA-N	441.554	1.744	50	20	IDGD	
CC(=O)N1CCc2cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc3cccc(Cl)c3)ccc21	774009416	PKAZYNBTMQFGEE-GFCCVEGCSA-N	444.875	1.802	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCN(C(=O)/C(C#N)=C/c3ccc(O)cc3)CC2)cc1	776595741	FPGPPEAUYREDME-SAPNQHFASA-N	427.482	1.841	50	20	IDGD	
O=C(NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12)N[C@H]1CCCOCC1	776636058	RGBFCJPVRWOVKF-KRWDZBQOSA-N	435.484	1.958	50	20	IDGD	
CCOC(=O)N1CCC[C@@H]([C@@H](C)NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)C1	777266148	NWODYCHQJZMUDP-ZIAGYGMSSA-N	444.492	1.135	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)c2ccc(S(=O)(=O)N3CCCCC3)cc2)nc1C	778427253	WUFDODDASWLQLL-UHFFFAOYSA-N	447.517	1.893	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2cc3c(cc2F)NC(=O)CC3)cc1	778714541	VGYRMRQQIBSOMA-UHFFFAOYSA-N	428.420	1.438	50	20	IDGD	
CC(C)(C)NS(=O)(=O)Cc1cccc(NC(=O)C(=O)NNc2ncncc2Cl)c1	782158673	HBASTQZRMMAXFM-UHFFFAOYSA-N	440.913	1.430	50	20	IDGD	
CN1CCN(CC(=O)N(C)c2ccc(NC(=O)C(=O)NNc3ccccc3F)cc2)CC1	782703633	WPAVUFJTCHHCGX-UHFFFAOYSA-N	442.495	1.118	50	20	IDGD	
CCc1ccc(CC)c(NC(=O)C(=O)NNC(=O)c2csc(N3CCOCC3)n2)c1	782896564	KHEPWUHYXIQPNT-UHFFFAOYSA-N	431.518	1.504	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNC(=O)c2csc(N3CCOCC3)n2)c(C)c1	782897347	MYGPFIDCMJGCDQ-UHFFFAOYSA-N	433.490	1.087	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)C(=O)Nc1cc(F)ccc1Cl	782897703	SHRRNXWZCDTDMV-UHFFFAOYSA-N	441.872	1.480	50	20	IDGD	
CN1CC(=O)N(c2cccc(NC(=O)C(=O)NNc3ccc(Br)cc3)c2)C1=O	783009759	WVVSDYQFOJJCBV-UHFFFAOYSA-N	446.261	1.929	50	20	IDGD	
CC(=NNC(=O)C(=O)Nc1ccccn1)[C@H]1CN(C(=O)OCc2ccccc2)CCO1	783853883	GVJCYWRJOFNGIS-QGZVFWFLSA-N	425.445	1.550	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1nc(-c2cccs2)cs1	784004794	KJEIDWPFGSBRAV-UHFFFAOYSA-N	435.512	1.449	50	20	IDGD	
CCNS(=O)(=O)c1cccc(C(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)c1	787937779	MDDAUWPYJFBZQV-UHFFFAOYSA-N	439.877	1.256	50	20	IDGD	
O=C(CCOCC(F)F)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	790113631	MAPOCNCYTMIXFS-UHFFFAOYSA-N	430.411	1.878	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(CC(F)(F)F)cc1)C1CCN(c2ncccn2)CC1	790387953	CEQGOCJSAKVDRV-UHFFFAOYSA-N	443.451	1.808	50	20	IDGD	
CC(C)(C)OC(=O)Nc1ccccc1CCC(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1	790545812	GAYPIVWWTLUDCP-CQSZACIVSA-N	440.522	1.484	50	20	IDGD	
CC(=O)N1CCCN(c2ccc(F)cc2NC(=O)C(=O)NNC(=O)CC2CCCC2)CC1	790952534	NXXPWUPQMPEVJS-UHFFFAOYSA-N	447.511	1.551	50	20	IDGD	
CC1=C(C(=O)OCC(=O)C(C#N)=C2N(C)c3ccccc3N2C)[C@H](C)n2ncnc2N1C	791463652	ASMYWZHKDPASPU-AWEZNQCLSA-N	433.472	1.997	50	20	IDGD	
COc1cc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc([N+](=O)[O-])c1C	791689899	PZTDFBSFEWBHAL-KRWDZBQOSA-N	445.384	1.056	50	20	IDGD	
CCc1c(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)cnn1C(CC)CC	792286662	QFDYWMYGZCMDHH-UHFFFAOYSA-N	425.493	1.783	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNc2ncccc2C)cc1S(=O)(=O)N(CC)CC	792375061	DAPMIRNVMHVFCF-UHFFFAOYSA-N	449.533	1.901	50	20	IDGD	
CC(C)OCCCn1c(NNC(=O)C2(S(C)(=O)=O)CCC2)nc2ccccc2c1=O	793498847	PGMXONYMGJXWSK-UHFFFAOYSA-N	436.534	1.622	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CN2C(=O)N[C@](C)(c3ccc(F)c(Cl)c3)C2=O)n1	794072924	TYKUXESGNWRIFE-LJQANCHMSA-N	433.827	1.411	50	20	IDGD	
Cc1c(I)cc([N+](=O)[O-])cc1C(=O)NNC(=O)Cc1ccncc1	800907096	PRUKJKVRRXVZFJ-UHFFFAOYSA-N	440.197	1.907	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)C2CCN(C(=O)CCc3ccccc3)CC2)cc1	801105377	DJYJNYXZDATHPH-UHFFFAOYSA-N	436.512	1.952	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCCC(=O)NNC(=O)Nc2cc(F)cc(F)c2)cc1	802000903	STDKQNCOYJYHKZ-UHFFFAOYSA-N	442.444	1.885	50	20	IDGD	
Cn1cc(S(=O)(=O)N2CCOCC2)cc1C(=O)NNC(=O)Nc1ccc(Cl)cc1	802018263	LEEYOAARTYMIEN-UHFFFAOYSA-N	441.897	1.166	50	20	IDGD	
CCS(=O)(=O)c1ccccc1C(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	802063568	KTRWFJHLPPNFEX-UHFFFAOYSA-N	425.488	1.350	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CC(=O)N(CCN2CCOCC2)C1)Nc1ccc(Cl)cc1Cl	802095340	ZUJXVSUFZFEWSF-GFCCVEGCSA-N	444.319	1.327	50	20	IDGD	
CCCN(NC(=O)CN(C)S(=O)(=O)c1ccc(NC(C)=O)cc1)C(=O)OC(C)(C)C	804594711	NVOSLBCFKOBRCG-UHFFFAOYSA-N	442.538	1.944	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)[C@@H](c1ccccc1)N(C)C	807399029	GYUIVHVULQCFMP-APWZRJJASA-N	425.537	1.715	50	20	IDGD	
O=C(CSc1ccc(Cl)cc1)NNC(=O)NC1CCC2(CC1)NC(=O)NC2=O	807545849	FDIQUCAYFJUNAA-UHFFFAOYSA-N	425.898	1.283	50	20	IDGD	
CNC(=O)c1cc(O[C@@H]2CCCN(C(=O)/C(C#N)=C\c3cc(C#N)n(C)c3C)C2)ccn1	808234738	OLARKBMHSIBXDZ-JFQUDDBISA-N	432.484	1.937	50	20	IDGD	
Cn1nnc2c1C[C@@H](C(=O)NNC(=O)COc1ccc(OCc3ccccc3)cc1)CC2	809933766	UCIARRKTKFXGRT-KRWDZBQOSA-N	435.484	1.725	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CNS(=O)(=O)c2ccc(Cl)cc2)c(OC)c1	810356129	ODQMQMPFFQCFGC-UHFFFAOYSA-N	427.866	1.097	50	20	IDGD	
CC(C)c1cc(NC(=O)C(=O)NNC(=O)CNC(=O)c2ccco2)n(-c2ccccc2)n1	810395913	PXLUUVOWCZRKHI-UHFFFAOYSA-N	438.444	1.105	50	20	IDGD	
CC(C)CC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)NNc1nc(Br)cn2ccnc12	810485150	WLIKXHYNGPJOSV-LBPRGKRZSA-N	449.313	1.432	50	20	IDGD	
COC[C@@]1(C(=O)NNC(=O)c2cncc(NC(C)=O)c2)CCN(C(=O)OC(C)(C)C)C1	810662535	DTFWXXVOTAJRGR-HXUWFJFHSA-N	435.481	1.075	50	20	IDGD	
COc1ccc(C[C@@](C)(O)CNC(=O)NNC(=O)c2c(C)nc3ccccn23)cc1OC	811851503	GNLZNJXWNUZWTQ-JOCHJYFZSA-N	441.488	1.598	50	20	IDGD	
CC(=O)N1CCN(C(=O)CCNC(=O)NNc2ccc(Br)cc2Cl)CC1	812050962	FASVHKLXOSHSIX-UHFFFAOYSA-N	446.733	1.809	50	20	IDGD	
CN1CCN([C@@H](C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)c2ccccc2)CC1	812727743	UZSNIXCQQQTOKA-HXUWFJFHSA-N	431.562	1.369	50	20	IDGD	
Cc1ccc(NC(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)c(OCC(=O)N(C)C)c1	812927365	LCEBDHFOANCQLJ-UHFFFAOYSA-N	449.533	1.861	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N2CCC(CS(C)(=O)=O)CC2)cc1Br	814300050	ILNKFLTWZCCZRD-UHFFFAOYSA-N	448.339	1.569	50	20	IDGD	
CC(=NNC(=O)N=c1cc[nH]cc1)c1ccc(S(=O)(=O)N2CCCC[C@H]2C(=O)O)cc1	815002219	QMAFJYJKQCIJAR-SFHVURJKSA-N	445.501	1.677	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C)c(C)c2)cc1)C1CC1	815565330	KLMTUNJEXSEOCR-UHFFFAOYSA-N	438.484	1.984	50	20	IDGD	
O=C(NNc1ncncc1F)C(=O)Nc1ccnn1Cc1ccc(OC(F)(F)F)cc1	815765153	HNJYTMBPCMDEDB-UHFFFAOYSA-N	439.329	1.841	50	20	IDGD	
Cn1ncc(C(=O)NNC(=O)[C@H]2CCCN(C(=O)OC(C)(C)C)C2)c1Br	816509042	CDQZCECLACAPML-JTQLQIEISA-N	430.303	1.591	50	20	IDGD	
CN(C)c1ncc(Br)cc1C(=O)NNc1ccccc1S(=O)(=O)N(C)C	817053462	SKUPOKFKUYRVMU-UHFFFAOYSA-N	442.339	1.917	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCC(C(=O)NNc3ncncc3F)CC2)cc1OC	817081417	ACWPTKHMXZIHPT-UHFFFAOYSA-N	439.469	1.177	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(CCC(=O)NNC(=S)NCCc2cccs2)CC1	819427107	HOTNWXXYYJJFTL-UHFFFAOYSA-N	441.623	1.729	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)NC2CCN([C@H]3CCN(C)C3=O)CC2)c1C	819805335	XSCCNUPSKBDRTG-CURYZJDOSA-N	427.549	1.470	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)CN1C(=O)N[C@]2(C[C@@H](C)CC(C)(C)C2)C1=O	825615290	PXNFNJHHNMZNIH-FPTDNZKUSA-N	445.520	1.391	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C(C)C)c1	825625021	VVCAIDUGEDJCCN-UHFFFAOYSA-N	434.518	1.597	50	20	IDGD	
COc1ccc([C@]2(C)NC(=O)N(CC(=O)NN=c3sc4ccccc4n3C)C2=O)cc1	855569662	NEGMHOSIMDCDER-NRFANRHFSA-N	439.497	1.648	50	20	IDGD	
CC(C)NC(=O)C(=O)NNC(=O)c1cnn(-c2cccc(C(F)(F)F)c2)c1-n1cccc1	914442308	ACSZEJNNXLVOCO-UHFFFAOYSA-N	448.405	1.967	50	20	IDGD	
O=C(NCc1ccc(Br)s1)NNC(=O)c1csc(N2CCOCC2)n1	914531094	MAFWSBZCCBVHDR-UHFFFAOYSA-N	446.352	1.948	50	20	IDGD	
Cn1cc(S(=O)(=O)N2CCCCC2)cc1C(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	914846040	OXXZHXABVVSBBJ-UHFFFAOYSA-N	435.462	1.183	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)NCc3cccc(NS(C)(=O)=O)c3)n[nH]2)cc1	916246481	IIUAQWZXPZSHTR-UHFFFAOYSA-N	442.501	1.901	50	20	IDGD	
CC(=NNC(=O)[C@H](C)CN1CCOCC1)c1ccc(S(=O)(=O)NCc2ccco2)cc1	916363780	YNSCXMVRLLZOGR-MRXNPFEDSA-N	448.545	1.567	50	20	IDGD	
CCN1CCN(Cc2ccc(CNC(=O)NNc3ccc(-n4cccn4)nn3)cc2)CC1	916419070	WGLPCHUHWMYZRB-UHFFFAOYSA-N	435.536	1.626	50	20	IDGD	
CCCC(=O)Nc1ccc(CNC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1	916514095	VSUOGNJHCSALPI-UHFFFAOYSA-N	436.472	1.816	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)Cn2cc(Br)cn2)c2ccccc2c1=O	916728295	OLRHNYFRZUCXGY-UHFFFAOYSA-N	433.266	1.227	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](CC(C)C)N2C(=O)[C@H]3CC=CC[C@H]3C2=O)cc1	916830418	WRMOHPOWPTWAKV-FGTMMUONSA-N	440.500	1.447	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)NCCC(=O)N[C@@H]2CCS(=O)(=O)C2)c(C)n1CCC(C)C	918570820	XYLJYKRQMWYMKR-QDDTUJKSSA-N	448.589	1.868	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)c1ccc(F)c(S(=O)(=O)N2CCCC2)c1	920007117	BOKKLORNVKRLNG-UHFFFAOYSA-N	435.477	1.623	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)NCCNC(=O)c1ccccc1C(F)(F)F	1116011243	OHICGLZHNVWBAB-UHFFFAOYSA-N	440.378	1.550	50	20	IDGD	
C[C@@H](C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1)c1ccc(F)cc1F	1182815268	BGKWPFPIAQYCNX-CYBMUJFWSA-N	439.488	1.543	50	20	IDGD	
Cc1cc(Cl)ccc1OCCCC(=O)NNC(=O)CNS(=O)(=O)c1ccccc1	1323923007	IMZUZUJBAQVCKK-UHFFFAOYSA-N	439.921	1.933	50	20	IDGD	
O=C(Cc1cccc2ccccc12)NNC(=O)Cn1cc(Br)c(O)nc1=O	1337155236	IDHKFSKYXWHSIV-UHFFFAOYSA-N	431.246	1.255	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(C1)CN(C(=O)C1(C#N)CC1)CCO2	1780096824	HKKPBONUHQLDHN-OAQYLSRUSA-N	442.428	1.267	50	20	IDGD	
C[C@H](NC(=O)c1ccc(F)cc1)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Cl)CCO2	1780901615	LYRMYRBPCFMWTA-ODYMNIRHSA-N	429.851	1.308	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3nc4ccccc4n(C)c3=O)CCO2)C1	1781219385	OWIHQEDWFQQYSE-LHSJRXKWSA-N	432.908	1.394	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)c3cnn4ncccc34)CCO2)C1	1781227339	JKGYRXGHQSHZLU-ROUUACIJSA-N	426.304	1.409	50	20	IDGD	
CC(C)c1nc(CC(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)no1	1781325576	FUDGKZLGJIRRKC-CJNGLKHVSA-N	433.278	1.256	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCc1ccoc1)C2	1782214037	JVAJJZUJQXLGHG-XMSQKQJNSA-N	434.537	1.099	50	20	IDGD	
O=C(/C=C/c1ccc(O)c(O)c1O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Cl)C2	1783222004	DYRWGYQWYSKNOH-SNCOMPKDSA-N	442.871	1.865	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)COc3ccc(OC)cc3)CCO2)C1	1783869648	QKXRXDXNAPNSGA-XLIONFOSSA-N	426.897	1.158	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(OC)c(C)c(OC)c3)CCO2)C1	1783884109	PSSFGYCUZLQCHX-KKSFZXQISA-N	440.924	1.710	50	20	IDGD	
COc1ccc(CC(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)cc1F	1784706135	PWBNVNFGWSZJMY-WMZOPIPTSA-N	447.276	1.897	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)COc3ccccc3C#N)C2)C1	1785383672	WFJGTPYOXKHBLG-KUHUBIRLSA-N	436.306	1.550	50	20	IDGD	
Cc1noc(C)c1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)CBr)C[C@@H]21	1785974493	VOGSZQIJFBGOEE-HJPIBITLSA-N	428.327	1.916	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3snnc3C3CC3)[C@H]2C1	1787741449	YUAUQFHTZHEJFA-FQUUOJAGSA-N	428.942	1.263	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)c1cc(-c2ccccc2)[nH]n1	1789318526	SEQSFKZQKBJZIN-SAKMYQHLSA-N	432.908	1.270	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1ccc(C2(NC(=O)c3ccc(O)nn3)CCC2)cc1	1789521236	OQRBISXARXEATD-UHFFFAOYSA-N	447.455	1.242	50	20	IDGD	
CC(C)(C)c1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]3C2)[nH]n1	1789924471	FTVFMPOWGRNZST-UHXUCMFUSA-N	445.333	1.991	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)Nc1ccc(C2(NC(=O)CC[C@@H](N)C(N)=O)CCC2)cc1	1790492569	JLIBPOQBLQHISX-RDTXWAMCSA-N	429.348	1.950	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc4cc(C)ccn34)C[C@@H]21	1791257305	XYNJZZWODSLMNK-OVWQWFNUSA-N	434.924	1.490	50	20	IDGD	
CC(C)N1CCC[C@H]1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)CBr)C[C@@H]21	1791807095	XWOYZNFJFBEBHH-ATIWLJMLSA-N	444.414	1.870	50	20	IDGD	
C=CCCC(C)(C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2	1792492352	BREZHEUTRBFOGJ-BRTCSPBQSA-N	443.548	1.702	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(C)(C)C#N	1792629425	VQHOOQILZDKVJB-XGUBFFRZSA-N	442.944	1.258	50	20	IDGD	
Cc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)CBr)c(C)n1C	1792872336	AIZFCRKCSJMRIB-RMIITELYSA-N	426.355	1.876	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN1CCC(C)CC1	1793202560	TWZSFPAKQOONIO-KYHPRHEASA-N	430.387	1.481	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Br)C3)c1	1793814369	FKUUVVUUYONHPT-DACLVMHWSA-N	443.313	1.962	50	20	IDGD	
CCOc1ncccc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCBr	1795113863	OSNGEHPRRKXEEB-YWVIFJGQSA-N	426.311	1.469	50	20	IDGD	
C[C@@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCBr)[C@H]1SC(=N)NC1=O	1795492347	KAEXAINRECIMKV-BZNQNGANSA-N	431.356	1.212	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CSc1ncccn1	1795836052	GCURJIIJFIDVSE-XPCVCDNBSA-N	443.367	1.189	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CC(=O)Nc1cc(C)on1	1796417677	BPGDPZXSEUDKRC-AHXJXLJNSA-N	426.901	1.309	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CCC[C@@H]1C)C2	1796441950	JHFGKINVNLKMCZ-WZHFHBLDSA-N	429.521	1.146	50	20	IDGD	
Cc1cc2nc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)CCC(=O)NN(C)C)C4)[nH]c2cc1C	1798363021	GJDVNVUXHOZCHB-BJWYYQGGSA-N	440.548	1.805	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCN1Cc3ccccc3C1=O)C2	1799267548	BEAWKNVTNDZKIR-YNVMFWSZSA-N	433.936	1.640	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc3c(c1)CCO3)C2)[C@@H](F)Br	1799346533	BHAHCOQIFYCGPX-LTCOOKNTSA-N	441.297	1.444	50	20	IDGD	
CCOC(=O)c1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](Cl)COC)C3)cc1	1799789666	VPGNVCJYWPTYJA-MHORFTMASA-N	438.908	1.320	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cccc(OC)n1)C2	1800640043	IHKCUTCXTRPTDY-HRJSJKBJSA-N	440.338	1.396	50	20	IDGD	
Cc1ccc(OCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)Br)cc1	1800756195	HCZNGGYOXCPCIN-AFIMGQEJSA-N	425.323	1.747	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1csc(Br)n1)C2)C(Cl)Cl	1801014888	RANQDJLJZOSCCH-SRSLHRDFSA-N	443.150	1.913	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1ccc2c(c1)CCCO2	1801673246	ICQYHNIHZQYJPF-YALNPMBYSA-N	441.297	1.905	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H]2Cc3ccccc3O2)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803143282	YWQIOUKMBOCQCD-QGZVKYPTSA-N	429.904	1.691	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)CN2CCOC2=O)[C@@H]1c1cccnc1	1803338292	BMCOJCXGANOYFY-NOLJZWGESA-N	439.310	1.323	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)CCS(C)(=O)=O)[C@@H]1c1cccnc1	1803693865	AFHUFMLTYWIPNL-XYJFISCASA-N	429.970	1.930	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)c2ccc(O)nn2)[C@H]1c1cccnc1	1805271165	VBDWTHRQNRLORH-NORZTCDRSA-N	434.294	1.680	50	20	IDGD	
O=C(/C=C/C(=O)N1CCC2(CCCN(C(=O)[C@H](O)CCl)C2)CC1)NCc1ccccc1	1805515524	RQLOJDYEZWQZSB-IHHMQQGQSA-N	447.963	1.690	50	20	IDGD	
CCS(=O)(=O)CC(=O)N1CCCC2(CCN(C(=O)[C@@H](C)CBr)CC2)C1	1805964226	MWUNVSJZLSWJTQ-AWEZNQCLSA-N	437.400	1.683	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)C(C)(C)F)[C@H]1c1cccnc1	1806980578	JLCNNVFJMOCFFG-AENKRZKSSA-N	442.495	1.970	50	20	IDGD	
CN1C(=O)CC[C@H]1C(=O)N1CC[C@H](CNC(=O)[C@](C)(Cl)CCl)[C@@H]1c1cccnc1	1808306121	ZBCMFELKYCWCJA-TXDAXLQXSA-N	441.359	1.945	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1CCN(C(=O)[C@@H]2CCNC(=O)C2)[C@H]1c1cccnc1	1808317979	PNLGHUPQKBLPKW-JJUQKUTHSA-N	441.359	1.850	50	20	IDGD	
Cc1cc(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)c[nH]1	1808774195	BQTHDJVKYBZMKB-WIYYLYMNSA-N	432.289	1.031	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC2(CCCN(C(=O)CC3CCOCC3)C2)CC1	1809565946	ZZUNGVUXFLHDAI-UHFFFAOYSA-N	443.548	1.347	50	20	IDGD	
CN1CCN(CC(=O)NC[C@H]2CCN(C(=O)C(C)(C)CCl)[C@H]2c2cccnc2)CC1	1809599298	MZZUHQGNTCMRNU-QUCCMNQESA-N	436.000	1.600	50	20	IDGD	
C[C@@H](C(=O)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1)c1ccccn1	1809972864	SYAKYTIHUWKPRS-GOSISDBHSA-N	435.333	1.410	50	20	IDGD	
O=C(O)c1cnncc1C(=O)N1CC[C@@H](CNC(=O)C(Cl)Cl)[C@H]1c1cccnc1	1813078257	GTMJOPGRDMJHDD-SMDDNHRTSA-N	438.271	1.693	50	20	IDGD	
CCC[C@@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CN(CCO)CCO)[nH]n1	1815323073	YSALMPHUNDAILI-GDBMZVCRSA-N	429.949	1.096	50	20	IDGD	
Cc1cc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)c(C)o1	1815339822	QLVVTYJWZXGDHX-OAHLLOKOSA-N	439.302	1.572	50	20	IDGD	
CCO/C=C/C(=O)N[C@@H]1CCc2nc(NC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)sc2C1	1817283217	XOTXFXNKNUHEJU-WFYFWWQASA-N	444.517	1.739	50	20	IDGD	
Cc1cccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)n1	1817473248	NLAFVWYKWHFNIO-LJQANCHMSA-N	433.277	1.413	50	20	IDGD	
C[C@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)CN3CCN(C)CC3)sc2C1	1818804755	BMCYBJNPEWRQBC-RYUDHWBXSA-N	444.399	1.086	50	20	IDGD	
CC[C@H](C)[C@@H](O)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819401513	FRNLYQMONYNZCD-BJOOFOGMSA-N	443.508	1.121	50	20	IDGD	
CN1CCN(C2(C(=O)Nc3nc4c(s3)C[C@@H](NC(=O)C(Cl)Cl)CC4)CC2)CC1	1822721726	QRGFWLJZTDBISX-NSHDSACASA-N	446.404	1.639	50	20	IDGD	
O=C(CN1CCOCC1)N[C@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1	1823002251	BZFYGLMEDILFFK-TVQRCGJNSA-N	435.319	1.078	50	20	IDGD	
CC(C)c1nc(CC(=O)N2CCC([C@H]3CCCCN3C(=O)[C@@H](O)CCl)CC2)no1	1824178181	DXXMBTXBNQKGHL-CVEARBPZSA-N	426.945	1.955	50	20	IDGD	
CC(=O)N[C@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H](O)CCl)CC1)C(C)(C)C	1824179549	TYVYXFNVUHKUPR-FGTMMUONSA-N	429.989	1.757	50	20	IDGD	
O=C1COc2ccc(C(=O)N3CCC([C@H]4CCCCN4C(=O)[C@@H](O)CCl)CC3)cc2N1	1824184861	AGOILMNNGVRZPQ-MSOLQXFVSA-N	449.935	1.851	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnc3[nH]ncc3c1)CC2	1825999774	CLSWFMHFOSCPKX-RYUDHWBXSA-N	434.909	1.894	50	20	IDGD	
O=C(NCC(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H](O)CCl)CC1)c1ccco1	1827181846	JQIYXNGQOZVOLG-HOTGVXAUSA-N	425.913	1.229	50	20	IDGD	
Cc1nccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)n1	1827884399	CGBMTCFBNGFOPC-NRFANRHFSA-N	436.321	1.012	50	20	IDGD	
CC[S@@](=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1	1828786613	UMKCIHHPOYIGPN-YVGXBJCXSA-N	442.626	1.138	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc([N+](=O)[O-])o3)CCO2)C1	1829481108	HZBULAHOGMJBFQ-SCLBCKFNSA-N	429.857	1.665	50	20	IDGD	
Cc1ccc(F)cc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)Br)C2)C1	1830079607	NLXBFOXOEIRJGY-LIRRHRJNSA-N	443.313	1.988	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)C[C@@H]2NC(=O)NC2=O)CC1	1830314244	UTLGARPPMCBUMM-KSMMKXTCSA-N	447.363	1.441	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CCCCN1C)CCO2	1830762905	LPHKCQCUCYBQNY-FRQCXROJSA-N	446.386	1.101	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)C3CCN(C(C)C)CC3)CCO2)C1	1832415008	GUZKJFQTHIPRQK-GHTZIAJQSA-N	429.989	1.581	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)c1cc(Cl)cnc1O	1833022778	OHMOBJOGKRRIOE-MRXNPFEDSA-N	445.347	1.226	50	20	IDGD	
C[C@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)[C@H](O)C(C)(C)C)CC2)CC1	1833264495	DCTHNMXBRMQTJP-PBHICJAKSA-N	446.430	1.996	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)[C@@H]1CCc2ccoc2C1	1833362390	MVRCTZYMNQWUQP-VQIMIIECSA-N	437.968	1.556	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCC(N2CCC(NC(=O)Cc3cnc[nH]3)CC2)CC1	1835063913	YWDZQMKDDFSRHE-IBGZPJMESA-N	430.380	1.760	50	20	IDGD	
Cc1ccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)cc1	1835082724	JPEBUEYMMJTQPM-QFIPXVFZSA-N	434.609	1.845	50	20	IDGD	
CCC(=O)N[C@@H](C)C(=O)N1CCC(N2CCC(NC(=O)[C@H](F)Br)CC2)CC1	1836413561	JGEQDFGJLVAOQN-LRDDRELGSA-N	449.365	1.163	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836670318	MJJWZJCCPDEXJX-DOMZBBRYSA-N	439.778	1.616	50	20	IDGD	
Cc1cc(C(=O)N2CCC(OC3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)c(C)o1	1837446304	KRZXCBAPKXWZSH-UHFFFAOYSA-N	448.564	1.882	50	20	IDGD	
CC(C)n1nccc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1838025014	ANOVRIPIVMLXSW-WMLDXEAASA-N	447.305	1.225	50	20	IDGD	
COCc1oncc1C(=O)N1CCC(OC2CCN(C(=O)[C@H](Cl)COC)CC2)CC1	1838166372	DPRVBGBGWHKWQR-QGZVFWFLSA-N	443.928	1.687	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3cccc(OC)n3)C2)C1	1839142420	NVIZJYBDTUGPIW-UTKZUKDTSA-N	439.940	1.497	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc4ccccc4n3)C2)C1	1839144736	JUCKJRFSTMKKTH-BTYIYWSLSA-N	432.908	1.717	50	20	IDGD	
CCc1oncc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2	1839151519	VCJQMDBLRFLETA-ZWKOTPCHSA-N	434.320	1.543	50	20	IDGD	
O=C(c1ccc(F)cc1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839201534	AKDRLSVBBOEAJE-PBHICJAKSA-N	433.249	1.586	50	20	IDGD	
COc1cc(F)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)c(F)c1	1839333264	YGINKWBMLZGXHU-YJBOKZPZSA-N	436.814	1.578	50	20	IDGD	
Cc1cccc(Cl)c1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1	1839338870	ROONTSDFPFBHDU-HNAYVOBHSA-N	431.316	1.318	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)ccc1O	1840035562	VUZWCMVAVDMLOJ-LIRRHRJNSA-N	441.322	1.554	50	20	IDGD	
O=C(C(Cl)Cl)N1CCO[C@@]2(COCCN(C(=O)[C@H]3COc4ccccc4O3)C2)C1	1840186230	BVUFJGRTFIPHJY-DNVCBOLYSA-N	445.299	1.087	50	20	IDGD	
O=C(c1cc(Cl)cnc1O)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840187006	HVVKSCNMFLOKNA-INIZCTEOSA-N	438.695	1.314	50	20	IDGD	
O=C([C@@H]1C[C@]1(F)Cl)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1840247414	YRZYXOMUWCWOQF-DUBDDPSESA-N	431.661	1.058	50	20	IDGD	
Cc1cc2nnc(C(=O)N3CC4(CCCN4C(=O)[C@@H](C)CBr)C3)c(C)n2n1	1841287397	KSDHRRVSRJHLMN-NSHDSACASA-N	435.326	1.589	50	20	IDGD	
C[C@H](CC(N)=O)C(=O)N1CCCC12CN(C(=O)[C@@H](Br)Cc1ccccc1)C2	1841658977	RPUILFSUNOIZPY-ZBFHGGJFSA-N	436.350	1.708	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCCC12CN(C(=O)/C=C/c1cnc[nH]1)C2	1841925376	PSODYYHUVGCURL-NFAHFFEMSA-N	437.928	1.758	50	20	IDGD	
CC[C@@H](C)[C@H](N)C(=O)N1CCCC12CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2	1842894241	LGCXIHPBKVXXFS-ACJLOTCBSA-N	432.477	1.711	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)[C@@H](C)Cc1ccccn1)C2	1843417084	ULOOYQGAUJLNIG-MQISTKKBSA-N	436.516	1.598	50	20	IDGD	
Cn1ncnc1C(=O)N1CC2(CCCN2C(=O)[C@@H](Br)Cc2ccccc2)C1	1845940662	CRXDPHKNWKPYRZ-HNNXBMFYSA-N	432.322	1.638	50	20	IDGD	
CC(=O)N[C@H](C)C(=O)N1CCCC12CN(C(=O)[C@H](Br)Cc1ccccc1)C2	1846006260	LKRRZCMEKFENJW-RHSMWYFYSA-N	436.350	1.721	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(SC)c([N+](=O)[O-])c2)cc1OC	9620949	PVTPAFUELHYDLF-UHFFFAOYSA-N	449.441	1.952	50	20	IDGD	
COc1cc(C(=O)NCC(=O)NNC(=O)c2cc(Cl)ccc2O)ccc1OC(F)F	10626058	RCEVFCIFEPRTJO-UHFFFAOYSA-N	443.790	1.847	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Cc2ccc(OC)c(OC)c2)c1	21894568	MTBGKMFUVGVAKK-UHFFFAOYSA-N	449.529	1.738	50	20	IDGD	
C#CCNS(=O)(=O)c1cccc(C(=O)NNC(=O)COc2cc(C)ccc2C(C)C)c1	32204195	VNGGAZXGPMMELP-UHFFFAOYSA-N	443.525	1.870	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)NNC(=O)CN1C(=O)N[C@]2(CCc3ccccc32)C1=O	58582686	UORQUQFZNJGDKW-QHCPKHFHSA-N	431.452	1.251	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(C)c(C(=O)NNC(=O)COc2cccc(C)c2)c1	104747798	GKRMOFQHDJXPCE-UHFFFAOYSA-N	435.502	1.068	50	20	IDGD	
C[C@H]1CC(C)(C)C[C@]2(C1)NC(=O)N(CC(=O)NNC(=O)c1ccc3c(c1)OCCO3)C2=O	105279423	AHCZKRUTKLSMJK-XMHCIUCPSA-N	444.488	1.356	50	20	IDGD	
O=C(Cn1cc([N+](=O)[O-])cn1)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1	215844556	XYKLZFQMTIOFFU-HXUWFJFHSA-N	434.456	1.566	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NCC1CCN(Cc2ccccc2)CC1	726242595	UEZLDSOVXPRZCO-UHFFFAOYSA-N	429.546	1.721	50	20	IDGD	
O=C(NNC(=O)c1cnccn1)C(=O)Nc1ccc(Br)cc1C(F)(F)F	727801532	YNAWEYHDSMAPNR-UHFFFAOYSA-N	432.156	1.658	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2ccc(C(=O)NNC(=O)c3cccc(C#N)c3)cc2)C[C@@H](C)O1	728827851	AYNKQIZBPJDTCL-GASCZTMLSA-N	442.497	1.431	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)N[C@H](C)[C@H](C)N2CCOCC2)c1	729624747	ZALBMBKIMZCKGU-NEPJUHHUSA-N	429.315	1.511	50	20	IDGD	
CN(C)C(=O)NNC(=O)[C@H](Cc1cn(Cc2ccccc2)cn1)NC(=O)OC(C)(C)C	730532174	DECBHAGUYNKQNA-KRWDZBQOSA-N	430.509	1.670	50	20	IDGD	
CN(C)C(=O)Cn1cc(C(=O)NNc2ccc(Br)cc2C(F)(F)F)nn1	731479242	QVFXKBKUHVTRNE-UHFFFAOYSA-N	435.204	1.905	50	20	IDGD	
CCCn1c(=O)nc(O)c2c(C(=O)NNC(=O)c3ccccc3OC)cc(C3CC3)nc21	731491160	DCAVEENUQYMPMH-UHFFFAOYSA-N	437.456	1.868	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)c1ccc(Cl)c(S(=O)(=O)N2CCC[C@H](C)C2)c1	731851861	UOZFNJRDEKRRPF-NSHDSACASA-N	439.925	1.867	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N2CCN(c3ncccn3)CC2)cc1Br	732256245	ZXHDDGGKOLTPOR-UHFFFAOYSA-N	435.282	1.424	50	20	IDGD	
CCOCCCn1c(NNC(=O)[C@@H]2CCCN(C(=O)CC)C2)nc2ccccc2c1=O	733266037	DCHFPRCMGOJOIP-MRXNPFEDSA-N	429.521	1.915	50	20	IDGD	
NS(=O)(=O)c1ccc(F)c(CNC(=O)NNC(=O)Cc2ccc3ccccc3c2)c1	734675543	INOINAVLQXIQQB-UHFFFAOYSA-N	430.461	1.699	50	20	IDGD	
COCCOc1ccc(-n2nc(C)c(C(=O)NNC(=O)COc3ccccc3F)n2)cc1	735029516	XYEFKDPVJKUKOJ-UHFFFAOYSA-N	443.435	1.580	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)NC2CCN(S(=O)(=O)Cc3ccccc3)CC2)cc1	735513265	QOPNVOJYIIHWNN-UHFFFAOYSA-N	441.513	1.497	50	20	IDGD	
COc1ccc(CN2CC[C@H](NC(=O)NNC(=O)COCc3ccccc3)C2=O)cc1	738481676	GAAHIAJTRMYPGW-IBGZPJMESA-N	426.473	1.343	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)CCS(=O)(=O)c2ccc3c(c2)OCCCO3)cc1	741210067	SGPBGQPNQBXNFT-UHFFFAOYSA-N	429.454	1.345	50	20	IDGD	
CCCc1c(C(=O)NNC(=O)C(=O)NC2CC2)nnn1Cc1cccc(Br)c1	741662572	QKCZSRVDWBIMNS-UHFFFAOYSA-N	449.309	1.081	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)c1cnc(O)c(Br)c1	742062277	OOYQBNKOGVTZTL-UHFFFAOYSA-N	427.280	1.747	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)c2ccc(S(=O)(=O)CC(=O)N(C)C)cc2)c(C)c1	743293575	CGUKXTUJGOOXNC-UHFFFAOYSA-N	446.529	1.038	50	20	IDGD	
Cc1cc(N2CCCS2(=O)=O)ccc1C(=O)NNC(=S)NCCc1cccs1	743823252	ZSYSKFQGOGXGOA-UHFFFAOYSA-N	438.600	1.948	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)cc1	745094734	SLSBBWYWIFGOTI-LJQANCHMSA-N	438.459	1.914	50	20	IDGD	
O=C(Cc1cc(O)nc(S)n1)NN=C1CCC[C@@H](N2C(=O)c3ccccc3C2=O)C1	745199478	IDXVKOLDNUIYJI-CYBMUJFWSA-N	425.470	1.724	50	20	IDGD	
C[C@H](C(=O)OCC(=O)NNC(=O)c1ccc(Cl)cc1)n1nnc(-c2ccccc2)n1	745680835	GZLMWYDDGUIYSZ-GFCCVEGCSA-N	428.836	1.559	50	20	IDGD	
O=C(NNC(=O)c1csc(C2CC2)n1)c1cccc(S(=O)(=O)N2CCOCC2)c1	747367980	ZULKZXMRHSCHEV-UHFFFAOYSA-N	436.515	1.116	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)NCC(=O)NNc2ccc(F)c(F)c2F)cc1	748215510	KTNFIUJTQYRUHJ-UHFFFAOYSA-N	431.392	1.702	50	20	IDGD	
COc1cc(CCNC(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)c([N+](=O)[O-])cc1OC	748342110	PVXLUOSZNLCFPI-SFHVURJKSA-N	430.417	1.489	50	20	IDGD	
CCc1nc(C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)nn1-c1c(Cl)cccc1Cl	748613256	JKKZCQGXQZQELN-SECBINFHSA-N	446.316	1.332	50	20	IDGD	
O=C(C/N=C1/NS(=O)(=O)c2ccccc21)NNc1ccc(OCC(F)(F)F)cc1	748702038	IJBIRQFTUOTHPI-UHFFFAOYSA-N	428.392	1.810	50	20	IDGD	
C[C@@H](C(=O)NNc1nc(Br)cn2ccnc12)N1C(=O)NC2(CCCC2)C1=O	750250472	SZLUKQXVRFJRLT-VIFPVBQESA-N	436.270	1.188	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)[C@H]1CCCN(C(=O)c2ccc3n[nH]cc3c2)C1	751291510	VQPHJGXNDJRGFT-MGPUTAFESA-N	449.467	1.403	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)c2cccc(CN3CCS(=O)(=O)CC3)c2)cc1	751292216	DWJWPEKNLJFCPP-UHFFFAOYSA-N	447.582	1.779	50	20	IDGD	
O=C(NNS(=O)(=O)c1cnn([C@H]2CCOC2)c1)c1ccc(F)cc1Br	751540375	AEMLNKLCAXTTRV-JTQLQIEISA-N	433.259	1.369	50	20	IDGD	
CCOC(=O)[C@@H]1Cc2cc(S(=O)(=O)NNC(=O)c3cc4ccccc4o3)ccc2O1	751548285	JUWKBISTQYQFPP-SFHVURJKSA-N	430.438	1.923	50	20	IDGD	
Cc1nc2nc(C(F)(F)F)nn2c(C)c1CCC(=O)NNC(=S)N[C@@H](C)C1CC1	751618254	QHVMKZBXGQFNGJ-QMMMGPOBSA-N	429.472	1.986	50	20	IDGD	
COc1cc(OC)cc(N2C[C@H](C(=O)NNC(=O)c3cccc(OC)c3O)CC2=O)c1	752520793	WKTDSHLNCIKFHO-GFCCVEGCSA-N	429.429	1.232	50	20	IDGD	
CC(C)c1cccc(-n2cc(O)c(C(=O)NNC(=O)CCN3C[C@H](C)O[C@@H](C)C3)n2)c1	752788294	DSFXLHOBCPXWQJ-HOTGVXAUSA-N	429.521	1.962	50	20	IDGD	
C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	755021195	OSWJSRSMAMOEAR-HGZMWJMZSA-N	441.396	1.529	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Cc2ccc(F)c(F)c2)c1	755037301	QMNDJQIQRQMUCR-UHFFFAOYSA-N	425.457	1.999	50	20	IDGD	
CNC(=O)c1ccc(NC(=O)NNC(=O)c2cc(-c3ccc(OC)c(OC)c3)[nH]n2)cc1	755510749	ORNPCIVQHHPJQL-UHFFFAOYSA-N	438.444	1.920	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)[nH]n1)Nc1cccc(S(=O)(=O)NC2CC2)c1	755586696	YOPKFXNGHLADFV-UHFFFAOYSA-N	440.485	1.984	50	20	IDGD	
CN(CC(=O)O)c1ccc(C(F)(F)F)cc1C=NNC(=O)Cc1cc(O)nc(O)n1	755753557	KUQTXWPLKDAMCQ-UHFFFAOYSA-N	427.339	1.120	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2cc(C(=O)N(C)C)ccc2C)c2ccccc2c1=O	755887431	CLJPNSVLHYSGAI-UHFFFAOYSA-N	436.472	1.893	50	20	IDGD	
NC(=O)c1ccc(F)c(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1	756065278	HSKGXAXTMGABAM-UHFFFAOYSA-N	449.464	1.176	50	20	IDGD	
CCOCC(=O)NNC(=O)Nc1ccc(S(=O)(=O)/N=C2\CCCCCN2C)cc1	756115601	UHTGVUHFTHLKNR-CJLVFECKSA-N	425.511	1.469	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)Nc1cccc(C(=O)N2CCOCC2)c1C	756184924	SBVUWWHXJFYXHO-UHFFFAOYSA-N	436.472	1.890	50	20	IDGD	
Cc1nc(-c2cccc(C(F)(F)F)c2)[nH]c1C(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1	756870543	LSSNUDADXPELMG-LLVKDONJSA-N	430.408	1.600	50	20	IDGD	
Cc1onc(-c2cccc(Br)c2)c1C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O	758033916	AYHJZQCJRJQPRX-QMMMGPOBSA-N	445.295	1.111	50	20	IDGD	
CC(C)[C@@H](C(=O)NNc1nc(-c2ccccn2)nc2c1CCC2)N1CCCS1(=O)=O	758286506	VETRHWSEFUWHED-KRWDZBQOSA-N	430.534	1.531	50	20	IDGD	
Cn1ncc(C(=O)N2CCN(S(=O)(=O)CBr)CC2)c1-c1ccccc1	758524107	URFRYGOOIMITDY-UHFFFAOYSA-N	427.324	1.527	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)c1cn(-c2ccccc2)nn1	760916395	PNYVEXXSBDMGPL-ZDUSSCGKSA-N	443.489	1.768	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)c1ccc(S(=O)(=O)Nc2nccs2)cc1	763045633	WDLCVMVRKQUMLD-UHFFFAOYSA-N	448.482	1.490	50	20	IDGD	
CC(=O)N1CCc2cc(S(=O)(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)ccc21	763439414	OIKNBYFCCDMOSP-UHFFFAOYSA-N	440.522	1.210	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1F	763529562	CSZAPMGEIHIFND-UHFFFAOYSA-N	443.479	1.133	50	20	IDGD	
CC(C)c1cc(NC(=O)C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)no1	763530246	GLPNTPYIEJNICM-UHFFFAOYSA-N	428.493	1.096	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)ccc1N1CCSCC1	763552049	VYUCRWMALJRMQP-UHFFFAOYSA-N	442.497	1.677	50	20	IDGD	
CCOC(=O)/C=C\c1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1	763572458	RKJSNSJNYHYQCP-DVESRUBUSA-N	439.424	1.189	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)c2c(C)nc3ccccn23)c(C)c1	763627812	DUJYOVBSZUCPEJ-UHFFFAOYSA-N	425.445	1.376	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccccc2-c2noc(C)n2)cc1	763662065	SVAZDWGVAIWSEW-UHFFFAOYSA-N	425.401	1.219	50	20	IDGD	
O=C(COc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1ccc(O[C@@H]2CCOC2)cc1	763686708	QDVIPWCTSKEUTG-QGZVFWFLSA-N	433.848	1.673	50	20	IDGD	
CN(C)C(=O)c1cc(NC(=O)C(=O)NNC(=O)CSc2ccc(Cl)cc2)ccn1	763736786	UVTBAINWSUVIQI-UHFFFAOYSA-N	435.893	1.315	50	20	IDGD	
O=C(NNC(=O)c1cc2c(s1)CCC2)C(=O)Nc1ccc(CCN2CCOCC2)cc1	763781830	NIVDRYNEXNKZOE-UHFFFAOYSA-N	442.541	1.511	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)cc1F	763790426	JEXJYLICZJAMLW-UHFFFAOYSA-N	425.420	1.825	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)C(=O)Nc2cccnc2C)c2ccccc2c1=O	763820623	LSXSYDKPCOQAMD-UHFFFAOYSA-N	436.472	1.690	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(CC(=O)N(C)C)cc2)c1C	763850153	OGLJZMYPLOKHDM-INIZCTEOSA-N	440.500	1.488	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)Cc2c[nH]c3ccccc23)cc1N1CCOC1=O	763864423	AAZLXGCOYQGGJR-UHFFFAOYSA-N	435.440	1.762	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccnc(OCC(F)(F)F)c1	763871617	HWFSOAYOPMZAKB-SNVBAGLBSA-N	444.341	1.715	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)C(=O)Nc2cc(C(=O)N(C)C)ccc2C)cc1	763896340	LNOSZMJQTPNSBF-UHFFFAOYSA-N	428.514	1.883	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)C(=O)Nc1c(F)cc(Cl)cc1F	763948261	ISBZACGXNSIDKW-UHFFFAOYSA-N	435.774	1.909	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc(COc3ccccc3)o2)ccc1C(N)=O	763955800	RKJADKYHSKEUMH-UHFFFAOYSA-N	436.424	1.666	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc(CC(=O)N2CCSCC2)cc1	763961569	HTICGJVCDLCDIO-UHFFFAOYSA-N	440.525	1.513	50	20	IDGD	
CN1C(=O)COc2ccc(NC(=O)C(=O)NNC(=O)c3cc4c(s3)CCCCC4)cc21	763961630	IPGDSXSVKCEXPG-UHFFFAOYSA-N	442.497	1.772	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)c2cccn2C)sc2c1CCSC2	763996270	NTNVIDBYMUDABD-UHFFFAOYSA-N	436.515	1.452	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(Br)cn2C)cc1F	764004864	PJQUCJFMHQWOJE-UHFFFAOYSA-N	441.213	1.113	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)on1)C(=O)Nc1ccn(Cc2ccccc2)n1	764015990	BZQIONLBHSNZHP-UHFFFAOYSA-N	430.424	1.986	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc(S(=O)(=O)C(F)F)cc1	764047648	JTWWHTQWWLRXGR-UHFFFAOYSA-N	427.385	1.091	50	20	IDGD	
C=CCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cccc(Br)c2)cc1	764062723	BRZUABPRURRJFD-UHFFFAOYSA-N	445.273	1.765	50	20	IDGD	
CN1C(=O)COc2ccc(NC(=O)C(=O)NNC(=O)Cc3ccc4ccccc4c3)cc21	764081433	JAEJBUMKCYTVPD-UHFFFAOYSA-N	432.436	1.524	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(F)cc2Br)c(N(C)C)n1	764084016	CYIFZAIBNODAIV-UHFFFAOYSA-N	438.257	1.757	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2O1)C(=O)Nc1cc(F)ccc1OC[C@@H]1CCCO1	764166623	FDAAWFQJJCAALS-HNAYVOBHSA-N	443.431	1.473	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(OCCN3CCCCC3)cc2)cc1	764183342	WZHZXBFJIYSPAK-UHFFFAOYSA-N	435.484	1.823	50	20	IDGD	
CC(C)n1cnnc1-c1ccccc1NC(=O)C(=O)NNC(=O)COc1ccccc1O	764280784	UCVFIAWRAYGGHA-UHFFFAOYSA-N	438.444	1.397	50	20	IDGD	
COCCc1ccc(Oc2ccc(NC(=O)C(=O)NNC(=O)Cc3cc[nH]n3)cc2)cc1	764292855	HOZXZLXEVQFXCL-UHFFFAOYSA-N	437.456	1.720	50	20	IDGD	
CN(C)CCC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccccc2F)cc1	764320078	DRXPYCBCDCMHSI-UHFFFAOYSA-N	429.452	1.045	50	20	IDGD	
COC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)c1C	764378017	VIEUWUOZKCVMBP-UHFFFAOYSA-N	427.442	1.633	50	20	IDGD	
Cc1cccc(C)c1NC(=O)C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	764545310	VNSOGOBDXLAWLI-UHFFFAOYSA-N	444.513	1.488	50	20	IDGD	
CCOC(=O)NNC(=O)C(=O)Nc1ccc(S(=O)(=O)N(CC)c2ccccc2)cc1	765408892	JAMIJPSRSKCUKI-UHFFFAOYSA-N	434.474	1.618	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)COc2ccc([N+](=O)[O-])c(OC)c2)n[nH]1	765604568	YMNHHHJIMKMNRN-UHFFFAOYSA-N	441.400	1.842	50	20	IDGD	
COc1cc(C#N)ccc1NC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1	766240528	CVTSSLBCHCERSE-UHFFFAOYSA-N	431.474	1.349	50	20	IDGD	
Cc1cc(N(C)C)cc(C)c1NC(=O)C(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	766259245	VXXUJBIGYBNNTM-UHFFFAOYSA-N	436.472	1.016	50	20	IDGD	
C[C@H](OC[C@@H]1CCCO1)C(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	766663370	KGUSZCLQIAQVRT-LPHOPBHVSA-N	438.956	1.189	50	20	IDGD	
COc1nc(N(C)C)sc1C=NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1	767034233	SUWUUYHGCOOUGL-UHFFFAOYSA-N	425.536	1.297	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2cc(C3CC3)nn2-c2ncccn2)c1	768232126	KJZTZLKNAKZWMK-UHFFFAOYSA-N	449.471	1.321	50	20	IDGD	
N#Cc1cc(Cl)nc(NNC(=O)[C@@H](CCC(N)=O)NC(=O)OCc2ccccc2)c1	768696355	XBWBJKJFRNVRKP-CQSZACIVSA-N	430.852	1.610	50	20	IDGD	
Cc1nn(CC(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1-c1ccccc1	769357264	UMEDHAMJNPYKMA-UHFFFAOYSA-N	437.412	1.771	50	20	IDGD	
CC(=O)N[C@@H](CC(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)c1ccccc1	770283312	YAEWRVFWPUMKSA-KRWDZBQOSA-N	428.401	1.167	50	20	IDGD	
C[C@@H]1CN(C(C)(C)CNC(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)C[C@@H](C)O1	770341239	MBLSIUCOVHQJGT-CHWSQXEVSA-N	434.545	1.801	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NN=C1CCCOCC1)N(S(C)(=O)=O)CC2	770592538	UIBDHVBKKVFDJP-KRWDZBQOSA-N	439.534	1.625	50	20	IDGD	
COCCNC(=O)C1CCN(C(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)CC1	770659823	VRYNRTWREWWPTR-ZDUSSCGKSA-N	426.901	1.323	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1ccnn1-c1cccc(F)c1	770779915	GDXQBVMGRWRXMZ-UHFFFAOYSA-N	443.460	1.898	50	20	IDGD	
C[C@H](NS(=O)(=O)c1ccc(C(N)=O)cc1)C(=O)NNc1nc(C(F)(F)F)cs1	771037047	YHDGHPPQFNGWFQ-ZETCQYMHSA-N	437.425	1.071	50	20	IDGD	
Cc1cccc([C@H](CC(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)NC(N)=O)c1	772191163	CIQDQMRXBNGVGE-INIZCTEOSA-N	431.880	1.212	50	20	IDGD	
CC[C@H](C)[C@@H](NC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1)C(F)(F)F	772530657	IGFGPWLDIAPHGX-SWLSCSKDSA-N	438.472	1.923	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)ncc1Br	773519740	JGCPTGSNATZDLC-UHFFFAOYSA-N	443.261	1.942	50	20	IDGD	
CN1CCN(CCOc2ccc(NC(=O)C(=O)NNc3ccc([N+](=O)[O-])cc3)cc2)CC1	773655634	DNAQQDPFRWOBOP-UHFFFAOYSA-N	442.476	1.303	50	20	IDGD	
CON(C)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)cc1	774007364	GYOVBDCCLHAXFX-GFCCVEGCSA-N	448.863	1.527	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)N[C@@H](c1cccc2ccccc12)C(F)(F)F	776009684	MYSFYAHPDDTOIE-YGRLFVJLSA-N	432.424	1.711	50	20	IDGD	
COC(=O)Cn1cccc1C=NNC(=O)Cc1nn2c(C3CCCCC3)nnc2s1	776179095	KZGKXDAMOZTYEL-UHFFFAOYSA-N	429.506	1.901	50	20	IDGD	
CCCOC[C@@H](Cc1cccc(Br)c1)NC(=O)NNC(=O)C(=O)NC1CC1	776185726	UWBRISIWJGRVJV-OAHLLOKOSA-N	441.326	1.396	50	20	IDGD	
CCO[C@@H]1C[C@@H](NC(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)[C@@H]1Oc1ccccc1	776530926	JEIGKVHUAINGJS-NXHRZFHOSA-N	430.417	1.869	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)[C@]1(F)CCN(C(=O)OCc2ccccc2)C1	776973001	HETXOKJIHGJUMC-QFIPXVFZSA-N	439.447	1.775	50	20	IDGD	
Cc1cc(C(=O)N2CCN(S(=O)(=O)CBr)CC2)c2cnn(C(C)C)c2n1	777778165	ZLOAYLCDWJDTNY-UHFFFAOYSA-N	444.355	1.761	50	20	IDGD	
N#Cc1c(F)cccc1C(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	777813739	UIHFINNNTJHLNR-UHFFFAOYSA-N	429.883	1.930	50	20	IDGD	
C=CCNS(=O)(=O)c1cc(C(=O)NNc2ncc(C(=O)OCC)c(C)n2)ccc1F	778426117	KMDJVHUHGZNQPY-UHFFFAOYSA-N	437.453	1.322	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)[C@H](CC(C)C)N2C(=O)[C@H]3CC=CC[C@@H]3C2=O)nc1C	778428567	NMEKOWQEVDIBBD-ZOBUZTSGSA-N	443.504	1.771	50	20	IDGD	
COc1ccc(Cn2ccc(NC(=O)C(=O)NNC(=O)c3cc4c(s3)CCC4)n2)cc1	778707907	RQIIQTOXFZUIIU-UHFFFAOYSA-N	439.497	1.890	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)Nc1ccccc1S(=O)(=O)N1CCCCC1	779357363	NPKFWLOSNIPVHM-AWEZNQCLSA-N	428.511	1.065	50	20	IDGD	
C=CCn1c(=O)c2ccccc2n2c(SCC(=O)NNc3ccc(OC)cn3)nnc12	781533837	OPVSOJVCCLZQMX-UHFFFAOYSA-N	437.485	1.869	50	20	IDGD	
CCS(=O)(=O)c1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)c1ccc(O)cc1	782834140	RVRKRKNJXXCWBC-UHFFFAOYSA-N	425.850	1.239	50	20	IDGD	
Cc1cc(Cl)ccc1NC(=O)C(=O)NNC(=O)c1sc(N2CCOCC2)nc1C	782896246	CWVNWNQZRGGZRL-UHFFFAOYSA-N	437.909	1.650	50	20	IDGD	
O=C(NNC(=O)C(=O)NC1CC1)C(=O)Nc1ccc(OC(F)F)c(Cc2ccccc2)c1	782965082	FMBMPAVYZYWSST-UHFFFAOYSA-N	446.410	1.243	50	20	IDGD	
CN1CCCCC/C1=N\S(=O)(=O)c1cccc(NC(=O)C(=O)NN=c2cc[nH]cc2)c1	783370160	MCLXPGCQSBPMBO-XIEYBQDHSA-N	444.517	1.178	50	20	IDGD	
CN(Cc1ccccc1)c1ccc(NC(=O)C(=O)NN[C@@]2(C)CCS(=O)(=O)C2)cc1	783424949	GVPSMLSLEFQAPS-NRFANRHFSA-N	430.530	1.460	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2ccc(-n3cccn3)nn2)ccc1N1CCSCC1	783433708	ZORSFDPNSUQMTB-UHFFFAOYSA-N	438.517	1.606	50	20	IDGD	
CCN(CC)CCNC(=O)c1cccc(NC(=O)C(=O)NNc2ccc(Cl)nn2)c1	784788947	ACVJOJVCEODPBB-UHFFFAOYSA-N	433.900	1.283	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2nc(-c3ccc(Cl)cc3)no2)ccc1-n1cnnn1	784796088	ZXUHULQVYXVRIM-UHFFFAOYSA-N	439.823	1.756	50	20	IDGD	
CC(C)n1ncc2cc(NC(=O)C(=O)NNC(=O)c3cc([N+](=O)[O-])ccc3O)ccc21	785022951	CVLAKVAKEBOFRY-UHFFFAOYSA-N	426.389	1.631	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)nn1-c1cccc(F)c1	785024493	ZZIILIQHYBWPNV-UHFFFAOYSA-N	442.363	1.333	50	20	IDGD	
Cc1ccc(Cn2nccc2NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)s1	785060721	KICIGNGINFRWIC-UHFFFAOYSA-N	437.485	1.278	50	20	IDGD	
N#Cc1cccc(-c2csc(NC(=O)C(=O)NNC(=O)Cc3cn4ccccc4n3)n2)c1	785067304	JZTMEGWPGYGJTE-UHFFFAOYSA-N	445.464	1.658	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2ccc3ccn(CC(=O)NC)c3c2)n1	785226731	VAIDOBAECSNTIN-UHFFFAOYSA-N	438.492	1.105	50	20	IDGD	
N#C/C(=C/c1ccc(F)cc1)C(=O)NCCS(=O)(=O)N1CCN(c2ccccn2)CC1	785249595	IYERNJUKHPIZOL-SDXDJHTJSA-N	443.504	1.396	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(CN3CCC(CO)CC3)cc2)cc1	785710954	HLPPAJXRXLRDTD-UHFFFAOYSA-N	439.512	1.817	50	20	IDGD	
CCOC(=O)c1csc(CCNC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)n1	786845667	RPXDFJMMSPKSBP-UHFFFAOYSA-N	444.473	1.398	50	20	IDGD	
CC(C)(O)C(=O)NNC(=O)c1ccc(Cl)c(NS(=O)(=O)c2ccc(F)cc2)c1	787947494	RCCIMRHLSOIYMA-UHFFFAOYSA-N	429.857	1.812	50	20	IDGD	
COc1cc(C(=O)NNc2ccc(-n3ccnc3)nn2)ccc1OCC(=O)NC(C)C	788177916	NWZVOJRWUFRBBM-UHFFFAOYSA-N	425.449	1.331	50	20	IDGD	
NS(=O)(=O)c1ccccc1NNC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccccc1	788230553	PTSFVKQMKYEJLY-MRXNPFEDSA-N	438.531	1.021	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2ccc(Cl)cc2-n2cccn2)c1	788330989	ODHMDTRMTFUGKL-UHFFFAOYSA-N	443.847	1.943	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)N[C@H](C)c2ncnn2C)c2ccccc2c1=O	788887212	RRVWULYSRHODFK-CYBMUJFWSA-N	426.481	1.420	50	20	IDGD	
Cc1cc(C)c(N2CC[C@H](NC(=O)NNC(=O)c3cc([N+](=O)[O-])ccc3O)C2=O)c(C)c1	788946232	ZXBGZKGEQJAPTQ-INIZCTEOSA-N	441.444	1.975	50	20	IDGD	
O=C(CC(F)(F)F)NNC(=O)NC[C@@H](Cc1cccc(F)c1)C(=O)N1CCOCC1	789313830	QGNXRLSPCPSHTF-CYBMUJFWSA-N	434.390	1.126	50	20	IDGD	
CC[C@@H]1CCc2nc(NC(=O)C(=O)NNC(=O)c3ccc4c(c3)OCCO4)sc2C1	789732010	NUCYQCQMFMTKMY-LLVKDONJSA-N	430.486	1.829	50	20	IDGD	
CCNC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)c1C	789772209	WOCJRXHVTLKAFS-UHFFFAOYSA-N	437.460	1.113	50	20	IDGD	
C[C@H]1CCc2c(sc3nc(CCC(=O)NNC(=O)CN4CCCC4=O)nc(O)c23)C1	789857729	JNZODUBPYDJBLK-NSHDSACASA-N	431.518	1.224	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)[C@H]2CCN(CC(F)(F)F)C2)c2ccccc2c1=O	792016666	RZTFZRCIIYVSGA-LBPRGKRZSA-N	425.411	1.623	50	20	IDGD	
C[C@](O)(Cn1cc(C(F)(F)F)ccc1=O)C(=O)NNC(=O)Cc1c[nH]c2ccccc12	792023804	WGGJSAXOBIZCKJ-IBGZPJMESA-N	436.390	1.490	50	20	IDGD	
O=C(NNc1nc2ccccn2n1)Nc1ccc(S(=O)(=O)NCC(F)(F)F)cc1	792314383	SHZRBAJNFGHDIB-UHFFFAOYSA-N	429.384	1.719	50	20	IDGD	
CNC(=O)c1cc2cc(NC(=O)C(=O)NNC(=O)C34CC5CC(CC(C5)C3)C4)ccc2[nH]1	792352700	GSLLCKUCOSNZAF-UHFFFAOYSA-N	437.500	1.830	50	20	IDGD	
COCc1cc(C(=O)OC)cc(S(=O)(=O)NNC(=O)c2ccc(OC)c(OC)c2)c1	793350433	NWRHDFXGRHZBBL-UHFFFAOYSA-N	438.458	1.260	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)[C@@H](O)[C@@H](O)c2nc3ccccc3s2)cc1	794717603	QPEJRUWHVKRDAI-JKSUJKDBSA-N	436.515	1.084	50	20	IDGD	
CCCn1nc(C(=O)NNS(=O)(=O)c2cc3c(cc2C)OCO3)c2ccccc2c1=O	794867620	YTHSOACRIAYVNY-UHFFFAOYSA-N	444.469	1.467	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2cccc(C)n2)cc1S(=O)(=O)N1CCCC1	797651026	KOHCJBNYOBCLAR-UHFFFAOYSA-N	433.490	1.650	50	20	IDGD	
O=C(NNC(=O)C1(c2cncc(Br)c2)CC1)c1nnc(O)c2ccccc12	798830935	XRFMXEBZKXOGJW-UHFFFAOYSA-N	428.246	1.986	50	20	IDGD	
CCCCNS(=O)(=O)c1ccc(C)c(NC(=O)C(=O)NNC(=O)c2cccc(C)n2)c1	799836455	LZPMPJAMUPDUGI-UHFFFAOYSA-N	447.517	1.177	50	20	IDGD	
CCc1cc(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)c2c(CC(C)(C)C)noc2n1	800328947	XGVNDOUHFDDBAY-GFCCVEGCSA-N	437.522	1.505	50	20	IDGD	
CCn1cnc2c1c(=O)n(CC(=O)NN=C1CCC[C@H]3C[C@@H]13)c(=O)n2Cc1ccccc1	800807757	FOLSSVMVZBHFQK-DLBZAZTESA-N	434.500	1.720	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2cnc(C(=O)OC(C)(C)C)cn2)c2ccccc2c1=O	801798636	YQMCRNUCIOTLII-UHFFFAOYSA-N	438.444	1.237	50	20	IDGD	
O=C(NNC(=O)c1ccc(S(=O)(=O)N2CCOCC2)cc1)Nc1cc(F)cc(F)c1	802001604	MUZRHEWTPSZREP-UHFFFAOYSA-N	440.428	1.452	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1ccc(OC(F)F)cc1F	802566125	AKUDVYLCZHWTBL-UHFFFAOYSA-N	425.319	1.598	50	20	IDGD	
CC1(C(=O)NNC(=O)CNC(=O)c2ccco2)CCN(c2ccc(Cl)cc2C#N)CC1	804338022	GHPXMBZTCUFRRX-UHFFFAOYSA-N	443.891	1.989	50	20	IDGD	
CC(C)N(C)S(=O)(=O)c1ccc(CNC(=O)NNc2ccc(-n3ccnc3)nn2)cc1	804985489	UIFFVOTZZJLURC-UHFFFAOYSA-N	444.521	1.518	50	20	IDGD	
O=C(CC(O)CC(=O)NNc1nccnc1C1CCC1)NNc1nccnc1C1CCC1	805473316	KYWJWHOFUBKSDX-UHFFFAOYSA-N	440.508	1.529	50	20	IDGD	
CCc1nnc(NC(=O)[C@@H](C)[C@H](C)NC(=O)NNc2ccc(-n3ccnc3)nn2)s1	805881174	XNJOCIDSXATJFQ-QWRGUYRKSA-N	430.498	1.366	50	20	IDGD	
CN(C)S(=O)(=O)C[C@H](NC(=O)NNC(=O)Cc1cccc2ccccc12)C(F)(F)F	806569028	IBDAJGGOYQLFOH-HNNXBMFYSA-N	446.451	1.535	50	20	IDGD	
COCCOc1ccc(S(C)(=O)=O)cc1NC(=O)C(=O)NNc1cccc(Cl)c1	806983851	IIEXPVHAFPWYNM-UHFFFAOYSA-N	441.893	1.851	50	20	IDGD	
COC(=O)c1cn(CCNC(=O)NNC(=O)[C@@H](C)Oc2ccc3ccccc3c2)nn1	807251105	PVUNPUDCQIIMEF-CYBMUJFWSA-N	426.433	1.016	50	20	IDGD	
Cc1ccccc1[C@H]([C@H](C)NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)N(C)C	807406510	RWFAGJYZDOAUGX-YWZLYKJASA-N	436.516	1.877	50	20	IDGD	
C[C@@H]1CCCN(Cc2ccc(NC(=O)C(=O)NNc3ccc(-n4ccnc4)nn3)cc2)C1	807428343	BBSCMTOSVRZCJZ-MRXNPFEDSA-N	434.504	1.976	50	20	IDGD	
Cc1ccc(CNC(=O)NCC(=O)NNC(=O)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1	808011343	TZRCTQYJCMDNET-QGZVFWFLSA-N	447.536	1.589	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)CNS(=O)(=O)c2ccc3ccccc3c2)c1	810006715	OIMDVZCQHHPHLF-UHFFFAOYSA-N	442.497	1.386	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)C(=O)Nc1c2c(cc3c1CCC3)CCC2	810387242	MFWNOSLEYSXXCC-UHFFFAOYSA-N	448.527	1.457	50	20	IDGD	
CC(=O)N1C[C@@H]2[C@@H](CCC[C@H]2NC(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)C1	812434769	UCVZCSWMBBZDKL-NWANDNLSSA-N	430.513	1.560	50	20	IDGD	
CCOC(=O)c1ccc(NNC(=O)c2cc(C)c3c(=O)n(C)c(=O)n(C)c3n2)cc1C	812715902	DEGVNVHWHULWOX-UHFFFAOYSA-N	425.445	1.183	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)c2cncc(I)c2)cc1	812731906	ZTJTUBSLXRZHHF-UHFFFAOYSA-N	446.270	1.693	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2cccc(C3CCC3)c2)c1	812979711	DXKKKGVZINDLAM-UHFFFAOYSA-N	444.513	1.604	50	20	IDGD	
CC(C)Cn1ncc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)N(C)C)c1C1CC1	815752454	SUAOPFMDBFUFHF-UHFFFAOYSA-N	448.549	1.749	50	20	IDGD	
O=C(O)c1cc(C(=O)O)cc(S(=O)(=O)NNC(=O)c2ccccc2Br)c1	831810015	GQZWDJFWCNMLDB-UHFFFAOYSA-N	443.231	1.469	50	20	IDGD	
O=C(Cc1ccccc1O[C@@H]1CCOC1)NNC(=O)C(=O)NCc1ccc(Cl)cc1	857479898	SNGUDZCPBNLOOD-QGZVFWFLSA-N	431.876	1.514	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)c2cc(S(=O)(=O)N(C)C)ccc2F)c1C	911584323	TXYTWVQUVTXTHG-AWEZNQCLSA-N	437.493	1.921	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)NC[C@H](c2ccc(F)cc2)N2CCOCC2)c1	915897390	FCBJVDUKJGYGRM-HXUWFJFHSA-N	429.496	1.909	50	20	IDGD	
COc1ccc(NCC(=O)NN=C(C)c2ccc(OCC(=O)N3CCOCC3)cc2)cc1	915916477	GIHHLIOFDAAJJQ-UHFFFAOYSA-N	440.500	1.885	50	20	IDGD	
Cc1cc(C)c(CNC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c(O)n1	916216510	LYTOUQJSZXWFIE-UHFFFAOYSA-N	447.517	1.333	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)NCCCN2C[C@@H](C)O[C@H](C)C2)c2ccccc2c1=O	916250035	UDYLXQDQMSEMMM-HZPDHXFCSA-N	444.536	1.421	50	20	IDGD	
CC(=NNC(=O)[C@@H](C)CN1CCCCCC1)c1ccc(S(=O)(=O)N2CCNCC2)cc1	916367284	XYJCZPQBQKATGU-SFHVURJKSA-N	449.621	1.633	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)n1	918220205	IDEQZQALWFJKHV-HOTGVXAUSA-N	432.500	1.783	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)OCC(=O)N2CCC(C(=O)N3CCCC3)CC2)cc(C#N)n1C	919044305	MFCQWZVARMIHQQ-ODLFYWEKSA-N	437.500	1.516	50	20	IDGD	
Cc1cc(C)c(C)c(S(=O)(=O)NCC(=O)NNC(=O)c2cccc(N(C)C)c2)c1C	920239572	HUXRMFSPVTWHDK-UHFFFAOYSA-N	432.546	1.726	50	20	IDGD	
COc1nc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc2ccccc12	920767662	AAAIIHSSICTAEY-UHFFFAOYSA-N	428.470	1.569	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)Nc1cccc(CN2C(=O)CNC2=O)c1	920933428	XXOILZNQGKSWPA-UHFFFAOYSA-N	435.238	1.296	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2ccc(-n3cccn3)c(F)c2)ccc1Cl	1115992494	ZZTKCOCQPVTWIR-UHFFFAOYSA-N	437.840	1.387	50	20	IDGD	
Cc1ncc(Br)c(C(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)n1	1116772999	JQRKGOAMJGWVRJ-UHFFFAOYSA-N	427.642	1.819	50	20	IDGD	
COc1cccc(N2CCC(NC(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)CC2)c1	1251334263	OWDFYTLIGNOGAK-UHFFFAOYSA-N	446.529	1.712	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)NCc2ccccc2N2CCN(C)CC2)cc1	1318272204	OWIVCFATEPFBFM-UHFFFAOYSA-N	425.533	1.910	50	20	IDGD	
CCCCS(=O)(=O)N1CCC[C@H]1C(=O)NNC(=O)c1ccc(Br)cc1	1337446247	LGBHNDLAEDLMDY-AWEZNQCLSA-N	432.340	1.804	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)c2ccc(N3CCC[C@H](C(N)=O)C3)cc2)nc2ccccc21	1337740909	IMFOEJMTCFZIFF-INIZCTEOSA-N	434.500	1.279	50	20	IDGD	
CO/C=C(\C)C(=O)N1CC[C@@]2(C1)CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)CCO2	1778841287	UTLBFJRYVJGBIF-QGFLDLQWSA-N	447.444	1.514	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)/C=N/N3CCCCC3)C2)C1	1779020279	MBHDRFPRYVNSNS-RLTHDXANSA-N	429.359	1.462	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cc(N3CCCC3)ccn1)CCO2	1779295468	NXUNHOYNVWTLOR-JOCHJYFZSA-N	446.624	1.977	50	20	IDGD	
COc1ccc2[nH]cc(C(=O)N3CCO[C@@]4(CCN(C(=O)CO[Si](C)(C)C)C4)C3)c2n1	1779297901	BTVNNFFQGCNIAN-OAQYLSRUSA-N	446.580	1.867	50	20	IDGD	
O=C(c1ccn(C(F)F)n1)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1779617035	OUJKTRJFDZAJCC-HZMBPMFUSA-N	425.205	1.412	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(OC)nn3)C2)C1	1779902434	QZFNRRZPIGLRLT-SJCJKPOMSA-N	427.299	1.102	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccn(C(C)C)n2)C1	1780210516	XWOWNBPYACYQQC-XAUMDUMWSA-N	426.945	1.845	50	20	IDGD	
CN(C)[C@H](C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2)c1ccc(Cl)cc1	1782820621	MQYYQSFFUDNDKH-ABSDTBQOSA-N	444.359	1.372	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H]2CCCSC2)C1	1783205662	QGZJJJWHXKYBQU-CBGDNZLLSA-N	440.610	1.017	50	20	IDGD	
CCCCC[C@@H](C)C(=O)N1CC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1	1783223266	CKWYORJDNDHKMZ-OPAMFIHVSA-N	431.537	1.345	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc(Cl)nc3)[C@H]2C1	1783380629	MALFZVLQOHFHDP-UKJIMTQDSA-N	431.718	1.507	50	20	IDGD	
C[C@H](O)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](Br)Cc1ccccc1)CCO2	1783525792	OAIUTVFVMQLQST-URLQWDBASA-N	425.323	1.203	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cnc4c(Cl)cccn34)CCO2)C1	1783876333	UUARZZKXYBBHKN-LIRRHRJNSA-N	441.315	1.685	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cc(Cl)ccc1F)CCO2	1783933281	UIBQMSOLKBBHLM-FQEVSTJZSA-N	440.903	1.296	50	20	IDGD	
Nc1c(C(=O)N2CCO[C@]3(CCN(C(=O)C(Cl)Cl)C3)C2)sc2nccnc12	1783947460	UPTAQLMBHVOOPS-INIZCTEOSA-N	430.317	1.521	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3CCCCN3C)[C@H]2C1	1784115528	UGJSHMDHKDCDQL-WOYTXXSLSA-N	430.387	1.481	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCC(=O)N3CCCC3)[C@H]2C1	1784995773	QYQQUTUOGRHHGN-ULQDDVLXSA-N	427.973	1.634	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(C(=O)OC)cc3C)C2)C1	1785279204	OWCKQRJLSGCMPH-UTKZUKDTSA-N	438.908	1.479	50	20	IDGD	
C[C@@H](CBr)C(=O)Nc1ccc(C2(NC(=O)CC[C@H](N)C(N)=O)CCC2)cc1	1786069147	MAVXEAKPPRXOMG-WFASDCNBSA-N	439.354	1.744	50	20	IDGD	
C[C@H](Cn1ccnc1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCBr)[C@H]2C1	1786407833	XLBWAQICFXAIGC-UGUYLWEFSA-N	427.343	1.284	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3nnsc3C3CC3)[C@H]2C1	1787679847	LPNKRWLCVVKGNX-XUXIUFHCSA-N	428.942	1.263	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)c1cc(-c2ccccc2)[nH]n1	1789318525	SEQSFKZQKBJZIN-LNMJFAINSA-N	432.908	1.270	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1ccc(C2(NC(=O)Cn3cccn3)CCC2)cc1	1789522833	QLILFSFHALIZAC-UHFFFAOYSA-N	433.472	1.330	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccn(C(F)F)c3=O)C[C@@H]21	1789863262	HVQBXVMWTUZIGV-MXAVVETBSA-N	431.867	1.854	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4cccnc4nc3O)C[C@@H]21	1789865268	OPOURSQAWYHWGI-LLLHUVSDSA-N	432.908	1.946	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnn4cccnc34)C[C@@H]21	1789867793	GJIFGALZBJGJCL-XPVILTJLSA-N	440.331	1.559	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3c(O)cc(O)cc3O)C[C@@H]21)[C@@H](F)Br	1789923583	VQMCIPIRMFUGKV-LGRMDKJXSA-N	447.257	1.087	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc4cc(C)ccn34)[C@H]2C1	1790490407	GVUBUPIALDEEJX-OVWQWFNUSA-N	434.924	1.490	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)ccc3O)C[C@@H]21	1790963494	CYSQXMZOVBOZEZ-SIUGBPQLSA-N	441.322	1.865	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3(Br)CC3)C[C@@H]21	1791060917	MLBUAEYTXVWJPT-RHYQMDGZSA-N	438.160	1.677	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4[nH]ccc4s3)C[C@@H]21	1791290989	HMLQHVUJKOWQDD-DZKIICNBSA-N	447.561	1.196	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3ccc(C)nc3C)[C@H]2C1	1791498855	YXWUXCLUXUEVFN-HAGHYFMRSA-N	437.968	1.865	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COc1ccccc1)C2	1792867786	KWKYKRHWKCAWAW-AFIMGQEJSA-N	425.323	1.686	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cn1cnc3ccccc31)C2	1792872195	QSGIFESGATWPDA-ZTENYAIWSA-N	449.349	1.657	50	20	IDGD	
N#Cc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](O)CCl)cc(C(F)(F)F)c1	1792980888	WFIZFVPSTMSJDD-OCVGTWLNSA-N	445.825	1.380	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc3c(F)c(F)ccc3c1)C2)[C@H](O)CCl	1792983218	DEGYRDATUWPFLF-IARIHHJXSA-N	439.846	1.316	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CNC(=O)c1cccs1	1794115171	HQXONRRTCAOIQE-LOUJCGABSA-N	427.954	1.475	50	20	IDGD	
COc1cncc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCBr)c1	1795111391	HRVZZNPNAZJBED-CCWDJLKJSA-N	440.338	1.397	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1nc(OC)ccc1[N+](=O)[O-]	1797214124	DXYAJRPCTHGFJB-YVECIDJPSA-N	426.857	1.504	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)NC(=O)c1ccc(F)cc1)C2	1799268928	OFKTVCNTKIYNLT-QMQAMEMWSA-N	439.915	1.551	50	20	IDGD	
Cc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@](C)(Cl)CCl)C3)nc2nccn12	1799990102	IOHAVVZOHLNDMV-FCIKYMEBSA-N	440.331	1.477	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](F)Br)[C@@H]1CC[C@@H]2CCC(=O)N2C1	1800161674	CGRSFTZOVOVSLO-VHYSLAALSA-N	430.318	1.716	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCN1CCCCC1)C2	1800639199	KITFAPDYONWLJR-KYHPRHEASA-N	430.387	1.626	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(OC)c(Cl)c1)C2	1800983202	QVTWJSMKNWRVLZ-YXPYIKCWSA-N	431.316	1.806	50	20	IDGD	
CN(CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1(F)CC1)NC(=O)NCc1ccccc1	1801478781	DDZMMNLJRIBDOU-BCDXTJNWSA-N	431.512	1.473	50	20	IDGD	
Cc1cc(C(=O)NCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](C)Br)no1	1801963960	VCSVRAQALHLXPH-FVCCEPFGSA-N	427.299	1.134	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CCc2ccccc2O1)c1ccc(B(O)O)cc1	1802234594	QCNFBXZRVHSLKE-IIZPIQPGSA-N	434.301	1.012	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)Cn2cc(Cl)cn2)[C@@H]1c1cccnc1)[C@H](O)CCl	1803137728	DFLNRJSENRRTCC-YSVLISHTSA-N	426.304	1.237	50	20	IDGD	
COc1cc(C#N)cc(C(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)c1	1803141577	QDBJHXXAYGAYPP-AHRSYUTCSA-N	442.903	1.881	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2c(O)cc(O)cc2O)[C@@H]1c1cccnc1)[C@H](O)CCl	1803141902	VLLHCHHCVBDJOL-BJOOFOGMSA-N	435.864	1.118	50	20	IDGD	
CCOC(=O)C(C)(C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2	1804303852	QDWJSZMTNQLZFX-BDHJUDLHSA-N	445.520	1.348	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H]2C[C@@H]2C2CC2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807361282	WNPBXWHZADEXJZ-PDGJWGCVSA-N	433.317	1.127	50	20	IDGD	
C[C@]1(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)CC1(F)F	1807375612	UGFOQZARIAAKLX-PLMTUMEDSA-N	443.259	1.126	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC2(CCCN(C(=O)CN3CCOCC3)C2)CC1	1809546377	VBJUBHMKUBYXRD-INIZCTEOSA-N	430.387	1.723	50	20	IDGD	
O=C(c1ccc(O)c(F)c1)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1	1809969327	CWPJBMQSASXGOL-UHFFFAOYSA-N	440.280	1.370	50	20	IDGD	
Cc1cc(C(=O)N2CCC3(CCCN(C(=O)c4cccc(B(O)O)c4)C3)CC2)ccc1F	1809979888	CKRWIRCLYZYGEU-UHFFFAOYSA-N	438.308	1.973	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@H](CNC(=O)/C=C\C(=O)NC2CC2)[C@H]1c1cccnc1	1810129121	CDKOUQSOGUBZRT-XCWBYQPUSA-N	444.608	1.774	50	20	IDGD	
Cn1cccc(C(=O)N2CC[C@H](CNC(=O)CO[Si](C)(C)C)[C@H]2c2cccnc2)c1=O	1810541968	WZTDPXZETFHQEO-YLJYHZDGSA-N	442.592	1.951	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@H]1CCN(C(=O)c2cc(CO)on2)[C@H]1c1cccnc1	1810543497	CVDGTULWSHKNEA-BEFAXECRSA-N	432.553	1.733	50	20	IDGD	
C[C@H](Cc1ccncc1)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1	1812334167	NDMSPINHAMFBBW-XFWGSAIBSA-N	430.936	1.961	50	20	IDGD	
O=C(CCn1ccnn1)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@@H]1c1cccnc1	1813432532	NCDWDVFTDQZLJJ-NUEKZKHPSA-N	439.289	1.460	50	20	IDGD	
C=CCO[C@H](C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1815214480	VWTSONDUSNXJFR-CXAGYDPISA-N	441.492	1.305	50	20	IDGD	
O=C(CCC1CCC1)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1	1815335632	IJBOXSWVFYMICM-MRXNPFEDSA-N	427.335	1.629	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)CCl)CC2)c1cnc(C(F)(F)F)cn1	1816084421	KQVGBWNMKANGMS-XCBNKYQSSA-N	449.842	1.777	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)Cc2ccccc2)[nH]n1)c1ccc(B(O)O)cc1	1817470993	BVOQLZFPOSTRJO-HXUWFJFHSA-N	432.289	1.638	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCN2CCOC2=O)n[nH]1	1818850383	TWOVKHQDQRIDAL-OCCSQVGLSA-N	427.889	1.498	50	20	IDGD	
CC(=O)OC[C@H](OC(C)=O)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](F)Cl)CC2	1819855386	JKUZHRRJHIRHCO-XHVZSJERSA-N	435.861	1.084	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)Cc2ccc(O)cn2)n[nH]1	1822893541	YKWQOBHGJKUWNM-QGZVFWFLSA-N	443.508	1.118	50	20	IDGD	
CSCC[C@H](O)C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](C)Br)sc2C1	1825646656	BDAOTZOKHWQKBS-YWVKMMECSA-N	436.397	1.953	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CC(C)(C)O)CC1	1826634148	XYJCHFYAMRDQMN-PTFSYIGCSA-N	445.564	1.901	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1CCc2nc(NC(=O)CCS(C)(=O)=O)sc2C1	1827212038	SMIPRFWVIYELQQ-RFAUZJTJSA-N	442.390	1.726	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1CCc2nc(NC(=O)C3CC(=O)C3)sc2C1	1828062406	RYJDHSBOTSZAMA-LPUHGPTISA-N	442.501	1.168	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)ccn1	1829245025	KYVZKTGLBZBLNU-QFIPXVFZSA-N	435.333	1.617	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)Cn2cc(C)c(O)nc2=O)CC1	1830314153	BYJVPEHCJHCMSI-IAGOWNOFSA-N	438.956	1.894	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnnc(Cl)c3)C2)C1	1830357779	GLHJNICWYYPTOJ-SFHVURJKSA-N	431.320	1.465	50	20	IDGD	
C=CCC(CC=C)C(=O)N1CCO[C@]2(COCCN(C(=O)CCBr)C2)C1	1830639060	KMAVCEPIGNYOAX-IBGZPJMESA-N	429.355	1.996	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3cnc4ccccn34)CCO2)C1	1830663856	NQVFXCSIHKVAKZ-LAUBAEHRSA-N	434.924	1.351	50	20	IDGD	
CCNC(=S)NCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H](Cl)COC)CC1	1831093344	LLTJEFGJHMUAIT-HZPDHXFCSA-N	433.018	1.344	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)N3C[C@H]4C[C@@H]4C3)C2)C1	1831650877	LPJIOCLLHHBTGA-MVVOQFOESA-N	427.973	1.191	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3c(C)nn(C)c3C)CCO2)C1	1831803283	BAWISBWLCCSMHQ-JXFKEZNVSA-N	426.945	1.514	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1	1831875205	VJNRWIMOCLPPMT-SJORKVTESA-N	430.977	1.233	50	20	IDGD	
Cc1nn(C)cc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1	1831877068	SCSFVNOSTRVUNY-QZTJIDSGSA-N	433.336	1.035	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ncc(F)cc1F)CCO2	1831966161	WRDNZJSKYSRGNM-LJQANCHMSA-N	443.523	1.281	50	20	IDGD	
COc1cccnc1CCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1832864235	KEPXHZFKJKSDCS-MJGOQNOKSA-N	429.876	1.014	50	20	IDGD	
CC[C@H](NC)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](C)CBr)CC2)CC1	1833263169	FGBWPQBIMGCOIK-YOEHRIQHSA-N	431.419	1.587	50	20	IDGD	
CC[C@H](C)[C@@H](O)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](C)CBr)CC2)CC1	1833264727	JDEGDBRHMWIUGQ-RLFYNMQTSA-N	446.430	1.996	50	20	IDGD	
Nc1ccccc1/C=C/C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)CCl)CC2)CC1	1833309413	UCMULZMVCZNQAB-RRFGBZISSA-N	434.968	1.453	50	20	IDGD	
Cn1ncc2cc(C(=O)N3CCC(N4CCC(NC(=O)[C@@H](O)CCl)CC4)CC3)ccc21	1833310325	QEMJNLYNFBHZRW-FQEVSTJZSA-N	447.967	1.358	50	20	IDGD	
COc1cc(C)cc(C(=O)N2CCC(N3CCC(NC(=O)[C@@H](O)CCl)CC3)CC2)c1	1833313302	FTEDOMBHFZWPJH-FQEVSTJZSA-N	437.968	1.789	50	20	IDGD	
C#CCO[C@@H](C)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](Br)CC)CC2)CC1	1833469327	QOVUJZHRVNBGCW-YJBOKZPZSA-N	442.398	1.770	50	20	IDGD	
Cc1ncc(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](F)Br)CC3)CC2)cn1	1834064556	QADKGVPDRJOMSK-MRXNPFEDSA-N	442.333	1.661	50	20	IDGD	
O=C(Cc1ccc(F)c(F)c1)NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1834530489	PEJPDKXZNVMZPW-IBGZPJMESA-N	443.922	1.679	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)[C@@H]3C[C@]3(F)Cl)C2)C1	1834826189	FPQAJXAWCZXQJR-NILFDRSVSA-N	427.698	1.152	50	20	IDGD	
Cc1cc(CC(=O)NC2CCN(C3CCN(C(=O)CO[Si](C)(C)C)CC3)CC2)n[nH]1	1835786813	GGKYTQKRUBCLTI-UHFFFAOYSA-N	435.645	1.684	50	20	IDGD	
O=C(c1cn2cc(F)ccc2n1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1836960479	QACQAIUVFTVGAS-YJBOKZPZSA-N	428.823	1.078	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccn4cncc4c3)CCO2)C1	1837074128	UPTPUNNICOIKTO-WIYYLYMNSA-N	434.924	1.812	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)c3ncnn3C)CC2)CC1	1837371808	JMJJMVGPCDSPIG-HNNXBMFYSA-N	442.358	1.601	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccnn3C(C)C)CCO2)C1	1838019039	VRCRCBGZZQDBAK-JXFKEZNVSA-N	426.945	1.942	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(C#N)cc(OC)c3)CCO2)C1	1838584796	HCHJGOODLQZXQC-GHTZIAJQSA-N	435.908	1.654	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)C3=COCCC3)CC2)CC1	1838789253	MTTKUUFAKRFCEG-UHFFFAOYSA-N	436.553	1.052	50	20	IDGD	
O=C(c1ccoc1Cl)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1838844812	MEXULBUUOPOXOI-IAQYHMDHSA-N	439.665	1.694	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3nnc(C)s3)C2)C1	1839142424	OIHZKADPFKPBPT-KSSFIOAISA-N	430.958	1.253	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(-n4cccn4)nc3)C2)C1	1839146860	YQRKAOYEZKKTSY-DYESRHJHSA-N	447.923	1.355	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)C(F)(F)C(F)F)C2)C1	1839150104	BTDRZESTXXCTNJ-ZIAGYGMSSA-N	439.233	1.580	50	20	IDGD	
Cc1nccnc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2	1839153687	OLCSVPWRYPQKOH-QZTJIDSGSA-N	431.320	1.091	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)nc1	1839198059	RLNDSIWHYOXMPJ-YOEHRIQHSA-N	430.274	1.151	50	20	IDGD	
O=C(c1ccoc1Cl)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839201653	FBXIKBRJGOCQGQ-XHDPSFHLSA-N	439.665	1.694	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(O)c(F)c3)CCO2)C1	1839305930	NEMNVVOLAKYAPE-KZULUSFZSA-N	445.285	1.385	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(CN(C(=O)CCC(C)C)CCO2)C1	1839848708	JTYGQDKNAYDFES-ZRZWOPFXSA-N	447.536	1.013	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)C(C)=O)C2)C1	1839961657	DUJSBYWSBINXPY-KSSFIOAISA-N	433.343	1.232	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)Oc1cccnc1)CCO2	1840453389	OWRQEECIINBNPH-KNBMTAEXSA-N	425.913	1.323	50	20	IDGD	
COc1c(Cl)cccc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1840739587	OABSBVUAPMWTLL-CRAIPNDOSA-N	435.279	1.953	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)c2c(Cl)cncc2Cl)C1	1840996081	OQVRKKCFNQRXFI-UHFFFAOYSA-N	434.088	1.199	50	20	IDGD	
Cc1cnn(CC(=O)N2CC3(CCCN3C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)c1	1841924363	CIUGZSLGOMKGOW-HNNXBMFYSA-N	439.944	1.527	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@H]2COCCN2C(=O)OC(C)(C)C)C1	1843347363	OJLLWVZRVXCGAJ-CABCVRRESA-N	429.945	1.843	50	20	IDGD	
Cc1[nH]ccc1C(=O)N1CCCC12CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2	1843547853	SMZVWSOVMBJBRZ-UHFFFAOYSA-N	438.532	1.486	50	20	IDGD	
CC(=O)Nc1cc(C(=O)N2CCCC23CN(C(=O)CCC(=O)NN(C)C)C3)ccc1C	1845463517	WBKDGJCDDUUZAO-UHFFFAOYSA-N	429.521	1.143	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@](C)(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](O)CCl)C1	1847568501	XSFAVAMSTGVZDJ-OSAWLIQMSA-N	443.972	1.825	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H]1CC(=O)N(Cc2cccs2)C1	1848148511	DEVZKJMYWGQFBS-SIXLDLHFSA-N	439.965	1.552	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=O)c2cc(Cl)ccc2O)n(C)c1	10626920	RJBZERPUHSMHMK-UHFFFAOYSA-N	428.898	1.489	50	20	IDGD	
CCCn1c(CCC(=O)NNc2nc(C)cc(C)n2)nc2cc(S(N)(=O)=O)ccc21	11261630	VGBPWVVZEZPYCT-UHFFFAOYSA-N	431.522	1.576	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2ccc3c(c2)NC(=O)CS3)c2ccccc2c1=O	17161765	JWMPOAFZHAICRS-UHFFFAOYSA-N	437.481	1.926	50	20	IDGD	
COc1ccccc1-c1nnc(SCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)n1C	23553609	MWYHXVYUKCBSDK-UHFFFAOYSA-N	442.457	1.952	50	20	IDGD	
CCS(=O)(=O)N1CCC(NC(=O)NNC(=O)c2ccc(OC(C)C)c(OC)c2)CC1	26310479	XKCCZJQQSRBNIN-UHFFFAOYSA-N	442.538	1.241	50	20	IDGD	
CC(=O)N/C(=C/c1ccccc1)C(=O)NNC(=O)c1sc(N2CCOCC2)nc1C	27193211	LVGNNWVTVJKUPT-FOWTUZBSSA-N	429.502	1.226	50	20	IDGD	
C[C@H](C(=O)NNC(=O)c1ccc(Br)s1)N1C(=O)NC2(CCCC2)C1=O	110367543	RIFLPBSZCOZMBM-MRVPVSSYSA-N	429.296	1.525	50	20	IDGD	
COc1ccc(CN2C[C@H](C(=O)NNC(=O)c3cc(Br)c[nH]3)CC2=O)cc1	726523965	JAOTXTPNOUCGIM-GFCCVEGCSA-N	435.278	1.596	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)Cc2c(C)nn(-c3nc(C)cc(C)n3)c2C)c1	728206117	VRXYCFIZNBYRBA-UHFFFAOYSA-N	437.504	1.707	50	20	IDGD	
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC[C@@H](C(=O)NNC(=O)CCCc2ccccc2)C1	728217574	KWQPGTVZNIWFQA-GOSISDBHSA-N	447.561	1.598	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)c1ccc(C)cc1)C(=O)NNC(=O)c1cccc(C#N)c1	728873554	ZPDBMHDXKADDSK-GOSISDBHSA-N	446.554	1.728	50	20	IDGD	
CCN(CCNC(=O)NNC(=O)c1nn(CC)c(=O)c2ccccc12)C(=O)OC(C)(C)C	729616919	FXALTOOHEFLGMC-UHFFFAOYSA-N	446.508	1.617	50	20	IDGD	
O=C(NNC(=O)N1CCCO[C@@H](c2ccccc2)C1)c1csc(N2CCOCC2)n1	729856827	IPFSUAKOGCBDQT-QGZVFWFLSA-N	431.518	1.798	50	20	IDGD	
CS(=O)(=O)c1ccc(OCCNC(=O)NNC(=O)Cn2ccc3ccccc32)cc1	730066997	RHBMWXGKZLEUTL-UHFFFAOYSA-N	430.486	1.454	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2csc(C(=O)O)c2)cc1Br	732048333	FHAUDMUQYPTYDF-UHFFFAOYSA-N	435.277	1.841	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)C1CCN(S(=O)(=O)c2cccnc2)CC1	732304834	WUNOBFKWLGUWRQ-UHFFFAOYSA-N	438.531	1.029	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)NCCN/C(O)=C1/N=CC=CC1=O	732467897	YNDJANGPWBQSAJ-MPHHAOFMSA-N	437.456	1.464	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)C(=O)c1cnn(-c2ccccc2)c1	733776617	OEZWQLHCGMTUEV-UHFFFAOYSA-N	425.470	1.639	50	20	IDGD	
CC(C)(C)CC(=O)N1CSC[C@@H]1C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C	734241317	MRRBIURYMWUQDX-GFCCVEGCSA-N	431.559	1.179	50	20	IDGD	
CC(C)(C)C1CCC2(CC1)NC(=O)N(CC(=O)NNC(=O)COCc1ccccc1)C2=O	737926955	QNWOOFHAKWMDSP-UHFFFAOYSA-N	444.532	1.878	50	20	IDGD	
Cc1ccc([C@@H](CN2CCOCC2)NC(=O)NNC(=O)COCc2ccccc2)cc1	738497147	LCOXISHICFJABV-OAQYLSRUSA-N	426.517	1.916	50	20	IDGD	
O=C(O)c1cc(S(=O)(=O)NNC(=O)C(F)(F)Oc2ccccc2)cc2c1OCCO2	741655384	YGAKCHOHZQLMTN-UHFFFAOYSA-N	444.368	1.137	50	20	IDGD	
Cc1cc(Br)ccc1C(=O)N1CCC[C@@H](C(=O)NNC(=O)c2cnn(C)c2)C1	742688044	RKSZPMYWTHGHLN-CYBMUJFWSA-N	448.321	1.804	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N[C@@H]2CC(=O)N([C@H]3C[C@@H]3c3ccccc3)C2)cc1OC	743521333	PRAXUQVHOCWDSA-KURKYZTESA-N	438.484	1.805	50	20	IDGD	
COc1ccccc1OCCC(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	744620168	GHSWLJKGXYWCNG-UHFFFAOYSA-N	435.502	1.628	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)[C@H]2CC(=O)N(c3ccc(F)cc3F)C2)c1	744708084	RWUDEFSTPSIPQZ-AWEZNQCLSA-N	431.395	1.631	50	20	IDGD	
CC1(C)[C@H](NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)[C@@H]2CCCO[C@H]21	745859861	FTWPJGFXNFLJNS-CEWLAPEOSA-N	429.565	1.733	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)N[C@@H]2CCCN(c3ccn(C)n3)C2=O)cc1	745884499	YJUXGZFCUYHVHU-RHSMWYFYSA-N	444.492	1.112	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NC[C@@H](C)Oc2ccc(OC)cc2)c2ccccc2c1=O	745900410	WUMOISJNMIYMLI-CQSZACIVSA-N	439.472	1.837	50	20	IDGD	
Cc1cc(N2CC[C@H](NC(=O)NNC(=O)c3ccc(-n4c(C)ccc4C)cc3)C2=O)n(C)n1	745906413	OPKSGUZYZAPACW-IBGZPJMESA-N	449.515	1.886	50	20	IDGD	
C[C@@H]1OC(C)(C)N(C(=O)OC(C)(C)C)[C@H]1C(=O)NNC(=O)COc1ccc(C#N)cc1	746095053	WZNJGLNZEYZAMC-SUMWQHHRSA-N	432.477	1.845	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)[C@@H]1CSCN1C(=O)c1ccc(Cl)cc1	746544943	AZMUFQCMCRIYKZ-INIZCTEOSA-N	443.916	1.893	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)c1occc1CS(=O)(=O)c1ccccc1	746545443	MZWZAGNHPNSXEY-UHFFFAOYSA-N	438.465	1.905	50	20	IDGD	
CC(=O)Nc1ccc(NS(C)(=O)=O)c(C(=O)NNC(=O)c2ccc(Cl)cc2F)c1	747429557	RBXAPVASASVUJB-UHFFFAOYSA-N	442.856	1.884	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NCCCN1CCN(c2ccncc2)CC1	748464479	DGLDRMYMASOJFJ-KRWDZBQOSA-N	444.511	1.531	50	20	IDGD	
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC[C@H](C(=O)NNc2cccc([N+](=O)[O-])c2C)C1	748670761	ZCMAKRITRMJCAR-AWEZNQCLSA-N	436.494	1.787	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@@H]2CCCN2S(=O)(=O)c2cccs2)cc1OC	749114614	SUQSNWNQSNIUOB-ZDUSSCGKSA-N	439.515	1.380	50	20	IDGD	
COc1ccccc1C1(CNC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)CC1	749419912	GNSAUTNMXTUXMK-UHFFFAOYSA-N	445.545	1.973	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1)c1cnn(C)c1	749865132	XKLJOJJTSYHBQE-OAHLLOKOSA-N	441.513	1.463	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NNC(=O)c2cc3ccccc3o2)cc(OC)c1OC	750265213	ADLXIDOEXIDIAF-UHFFFAOYSA-N	428.401	1.748	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)c1cc(Br)c2c(c1)OCO2	751206434	MJVUUUDTOQEZDR-UHFFFAOYSA-N	426.248	1.430	50	20	IDGD	
CC[C@H](NC(=O)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1)C(=O)N1CCOCC1	753055791	FDVOLDDSLQLBMZ-ZDUSSCGKSA-N	438.428	1.244	50	20	IDGD	
O=C(NNc1cccnn1)c1ccc(Br)c(S(=O)(=O)N2CCOCC2)c1	753099897	OREDXVKFINXMBH-UHFFFAOYSA-N	442.295	1.017	50	20	IDGD	
COC(=O)c1c(Br)ccc(NC(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)c1C	753211197	KPDQZIHHKFXMMJ-VIFPVBQESA-N	448.295	1.132	50	20	IDGD	
C[C@H](C[S@](C)=O)NC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	753356142	BPCXDQLVLCFSRQ-LUGWNYHVSA-N	444.560	1.260	50	20	IDGD	
COc1ccc2c(c1)c(CC(=O)NNC(=O)CO)c(C)n2C(=O)c1ccc(Cl)cc1	753442563	IEUDDWPGIGESAH-UHFFFAOYSA-N	429.860	1.982	50	20	IDGD	
Cc1ccccc1-n1c(C)cc(/C=C(/C#N)C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)c1C	754753607	GJEJGTZBYNCCTK-HPKGMJOESA-N	440.525	1.892	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H]2[C@@H]3CCO[C@@H]3C23CCCC3)c1	755088492	MQBXVJITVIBFBM-BBWFWOEESA-N	436.534	1.229	50	20	IDGD	
O=C(NCCN1C(=O)[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)NNC(=O)c1cccc(OC(F)F)c1	755151561	YOHYVXKMPDCJNO-LWWSYDQCSA-N	434.399	1.039	50	20	IDGD	
CCN1CCN(c2ccc(NC(=O)NNC(=O)c3nnc(O)c4ccccc34)cc2)CC1	755472933	LIUWNIGFVCAFIK-UHFFFAOYSA-N	435.488	1.944	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)c1cn(-c2ccc(Br)cc2)cn1	755832976	FLYGSOHZGNMPRD-UHFFFAOYSA-N	432.234	1.419	50	20	IDGD	
Cc1cc(C)nc(-n2nccc2NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2Cl)n1	760306586	FJVMYENRIMFTPR-UHFFFAOYSA-N	448.270	1.986	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)c1ccc(I)c(O)c1	760872345	VTLYSYVPSALKHW-UHFFFAOYSA-N	445.238	1.249	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)C(C)(C)C)c(C(=O)N2CCCCC2)cc1OC	761072068	JLXWMHXHPHAOBA-UHFFFAOYSA-N	434.493	1.462	50	20	IDGD	
Cn1ccnc(NNC(=O)c2cccc(Br)c2I)c1=O	761571406	JJEWJVMFLONMGN-UHFFFAOYSA-N	449.046	1.904	50	20	IDGD	
CCC(=O)N1CC[C@H](NC(=O)NNC(=O)COc2ccc(OCc3ccccc3)cc2)C1	762380113	VPZYOEGRPYJRJO-SFHVURJKSA-N	440.500	1.986	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cccc(C3OCCO3)c2)cc1	763462791	MEEOMKSYLPXMIG-UHFFFAOYSA-N	433.486	1.122	50	20	IDGD	
CC(C)(C)[C@H]1CCC2=S=C(C(=O)NNC(=O)c3ccnc4c(C(N)=O)cnn34)C=C2C1	763467439	VSRKKGSZJVMDRO-LBPRGKRZSA-N	440.529	1.453	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)n([C@H]2C[C@H]3CC[C@H]2C3)n1	763472592	ZMTUJZZUJLAIAB-XEZPLFJOSA-N	426.433	1.861	50	20	IDGD	
CC(=O)N(C)c1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2Br)cc1	763484514	ZSMCVWACWPGAJA-UHFFFAOYSA-N	433.262	1.832	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)CCN3C(=O)c2cccnc2)c(C)o1	763586750	QPQQZFDXGUDJPO-UHFFFAOYSA-N	447.451	1.894	50	20	IDGD	
COC(=O)[C@@H](C)Cc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)cc1	763682185	SCOVNWHKFFUBHI-AWEZNQCLSA-N	438.440	1.075	50	20	IDGD	
O=C(CN1CCCc2ccccc21)NNC(=O)C(=O)Nc1ccc(-c2csnn2)cc1	763734963	OFMADCMZYCYBLK-UHFFFAOYSA-N	436.497	1.744	50	20	IDGD	
CCS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)cc1	763865243	NZIDCTPDKRVDND-LBPRGKRZSA-N	437.449	1.173	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccn(CC(F)F)n2)cc1	763865603	LVGIUYCQYIYIJW-LLVKDONJSA-N	425.392	1.100	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2ccc(OCCC(C)C)c(OC)c2)ncn1	763913996	IVXYLQSQNNNYJS-UHFFFAOYSA-N	431.449	1.318	50	20	IDGD	
Cc1cc(C(=O)N2CCC[C@H](C)C2)ccc1NC(=O)C(=O)NNC(=O)c1cccn1C	763999462	SNXFEAPNAZTZKS-AWEZNQCLSA-N	425.489	1.605	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1ccc(NC(=O)CN(C)C)cc1	764012622	UBDKRKLVPKUIHZ-UHFFFAOYSA-N	447.879	1.248	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)Cc3ccsc3)cc2F)C[C@H](C)O1	764034656	SUWMCOSBRKOZTM-STQMWFEESA-N	434.493	1.829	50	20	IDGD	
CCNC(=O)COc1cccc(NC(=O)C(=O)NNC(=O)Cc2cccc3ccccc23)c1	764037507	YFFKYFDCGJVTDV-UHFFFAOYSA-N	448.479	1.683	50	20	IDGD	
CC[C@H](C)C(=O)NNC(=O)C(=O)Nc1cc(F)c(F)cc1I	764085166	ZVYLMUDUTXBNHP-LURJTMIESA-N	425.173	1.701	50	20	IDGD	
Cc1cc(C(=O)NC(C)C)ccc1NC(=O)C(=O)NNC(=O)c1ccc(Cl)cc1O	764116143	AYKHSANUTJAWQW-UHFFFAOYSA-N	432.864	1.892	50	20	IDGD	
O=C(CCc1ccco1)NNC(=O)C(=O)Nc1ccc(I)cc1	764169176	MTYIETMIUQUHJY-UHFFFAOYSA-N	427.198	1.603	50	20	IDGD	
COC(=O)[C@@H]1CCCCN1C(=O)c1cccc(NC(=O)C(=O)NNC(=O)CCC(C)C)c1	764202369	BPNLYUHNJOLEIK-KRWDZBQOSA-N	446.504	1.376	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)C(=O)Nc1cccc(OCC(=O)Nc2ccccc2)c1	764268239	NEOXEYKRRHXCKW-UHFFFAOYSA-N	447.451	1.428	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2O)ccc1Br	764277269	ABOCKVCVXCDKRQ-UHFFFAOYSA-N	438.234	1.328	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2O)ccc1OCC(F)(F)F	764277826	IFCZEHZJSKHAKF-UHFFFAOYSA-N	441.362	1.807	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)c(OC)c1OC	764394986	XYBAPLGWQIGQSB-UHFFFAOYSA-N	435.458	1.296	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)N[C@H]1CCN(c2ccc(Cl)c(F)c2)C1=O	764505804	BGONVNLLBQXBQI-INIZCTEOSA-N	445.838	1.865	50	20	IDGD	
C[C@H]1CCCN(S(=O)(=O)c2ccc(NC(=O)C(=O)NNC(=O)OC(C)(C)C)cc2)C1	765386785	OKSQUVHKHRORAZ-ZDUSSCGKSA-N	440.522	1.602	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)CNC(=O)c3cccc([N+](=O)[O-])c3)n[nH]2)cc1C	765565108	CZPRHFCKHOMXGI-UHFFFAOYSA-N	436.428	1.793	50	20	IDGD	
CCC(=O)Nc1cccc(C(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)c1	765754814	NSWFDNTZBBEUJN-UHFFFAOYSA-N	437.544	1.922	50	20	IDGD	
C[C@@H]1Cc2ccc(Br)cc2CN1C(=O)NNC(=O)CNC(=O)c1ccco1	766530175	NVEYMHUWKNYLOK-LLVKDONJSA-N	435.278	1.960	50	20	IDGD	
CCCC(=O)N1CCC[C@@H]1C(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	766664765	SIMALLPOVWCVAR-LJQANCHMSA-N	449.983	1.396	50	20	IDGD	
O=C(NNc1ccc([N+](=O)[O-])cc1)[C@H]1CCCN1S(=O)(=O)c1cccc([N+](=O)[O-])c1	768247886	ZFUNBBAXQBXIJY-MRXNPFEDSA-N	435.418	1.799	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2sccc2S(=O)(=O)NCc2cccs2)n[nH]1	768279145	ZNZNINNUOCMOCZ-UHFFFAOYSA-N	425.517	1.394	50	20	IDGD	
CSCCNC(=S)NNC(=O)c1ccc2c(c1)C(=O)N(Cc1ccccc1)C2=O	769769585	VTOUOSRJQUAGES-UHFFFAOYSA-N	428.539	1.955	50	20	IDGD	
O=C(CCc1cnn(-c2ccccc2)c1)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772188342	LRLQQGVZQLMQBL-UHFFFAOYSA-N	425.876	1.922	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1cc(F)c(F)cc1I	772188659	TUNUWUNWTRQADN-LURJTMIESA-N	426.157	1.672	50	20	IDGD	
CCOc1ccc(NC(=S)NNC(=O)c2cnn(CC(=O)NC3CCCC3)c2)cc1	772400168	FURSGMFJDJJFGG-UHFFFAOYSA-N	430.534	1.972	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cn(C)nc3-c3ccccc3)CC2)cc1	772811142	LGYUOAMUUQJABE-UHFFFAOYSA-N	446.555	1.974	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1cccc(Cn2cncn2)c1	774010633	YLIFWSNERVBPOO-ZDUSSCGKSA-N	442.863	1.533	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1N1CCOCC1)c1cnn(-c2ccccc2)c1	776319413	CWEXUMWFKJHYSC-UHFFFAOYSA-N	436.428	1.692	50	20	IDGD	
O=C(CCOc1ccc(Cl)cc1)N1CCN(S(=O)(=O)CBr)CC1	777838123	QTQWVWJDZWQKBQ-UHFFFAOYSA-N	425.732	1.935	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(OCC(F)(F)F)nc1)c1cc(Br)c[nH]1	777914159	AERHAJUSZIMZAR-UHFFFAOYSA-N	443.201	1.737	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)/C(=C/c1ccco1)NC(=O)c1ccccc1	778432830	ASHYWHFLURNMSJ-VBKFSLOCSA-N	428.445	1.723	50	20	IDGD	
Cc1cc2ccc(Cl)cc2nc1NNC(=O)CNS(=O)(=O)c1c[nH]c(C(N)=O)c1	779043200	SLJRFLGLHDNRSU-UHFFFAOYSA-N	436.881	1.045	50	20	IDGD	
N#C[C@H](c1ccc(F)cc1)N1CCN(CC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)CC1	780311581	HPCKLNKZCJNALO-LJQANCHMSA-N	440.435	1.377	50	20	IDGD	
COc1ccc(I)c(NC(=O)C(=O)NNc2ncncc2Cl)c1	782160441	SKTFIMJTDOOJNI-UHFFFAOYSA-N	447.620	1.825	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C(=O)Nc2cccc(Br)c2)nc2ccccc21	782895028	WEDPCWUPZQZHCG-UHFFFAOYSA-N	430.262	1.664	50	20	IDGD	
Cn1ncc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)c1C(F)F	783407906	HDULREHBFUPDDT-UHFFFAOYSA-N	441.338	1.733	50	20	IDGD	
C[C@@H](C#N)Oc1ccccc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	784210215	IMTUGXZLBRPQIV-ZDUSSCGKSA-N	443.485	1.500	50	20	IDGD	
C#CCOc1cc(F)ccc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	784215475	JCYYLNZTKBXRPM-UHFFFAOYSA-N	446.460	1.360	50	20	IDGD	
Cc1nc(Cn2nnc(C(=O)NNC(=O)c3ccc(COc4ccccc4)o3)c2C)no1	784687371	XOFVSPZYGPUGJC-UHFFFAOYSA-N	437.416	1.573	50	20	IDGD	
NS(=O)(=O)[C@@H]1CCN(C(=O)C(=O)Nc2ccccc2S[C@H](Cl)C(F)(F)F)C1	784793756	QQCFTBNBJQMSFK-OQPBUACISA-N	445.872	1.734	50	20	IDGD	
CNC(=O)CCOc1ccc(NC(=O)C(=O)NNc2cccc(C(F)(F)F)n2)cc1	784951920	CDRNKNFDVDXHJS-UHFFFAOYSA-N	425.367	1.697	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)[C@H]1CN(C)C(=O)c2ccccc21	787094117	OCIHFYNYHGUUNY-INIZCTEOSA-N	445.859	1.522	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ccc(F)cc2)cc1S(=O)(=O)N1CCCC1	787542378	ZWUVUKGKVFSCNA-UHFFFAOYSA-N	436.465	1.701	50	20	IDGD	
Cc1ccc(NNC(=O)C(=O)Nc2ccc(N3CCN(C)CC3)c(Br)c2)nn1	787897888	DSIUTENZDJKKOP-UHFFFAOYSA-N	448.325	1.381	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(Cl)cc1-n1cccn1	788330384	GNFCNRPVRLNXMH-UHFFFAOYSA-N	428.792	1.834	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)N[C@@H]2CCN(Cc3ccc(F)cc3)C2=O)cc1C	790673039	OOAVLAWOEYKLTB-GOSISDBHSA-N	441.463	1.513	50	20	IDGD	
O=C(NN=c1cc[nH]cc1)C(=O)Nc1cc(Br)cc(C(=O)N2CCCC2)c1	790957771	OAVURNPRXCMFAR-UHFFFAOYSA-N	432.278	1.584	50	20	IDGD	
CO[C@@H]1CCOc2c(NC(=O)C(=O)NNC(=O)Cc3nc4ccccc4n3C)cccc21	790959106	GZSYLQFWWHGDMZ-QGZVFWFLSA-N	437.456	1.372	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)[C@H]2[C@H](C)CC(=O)C[C@H]2C(=O)NNc2nc(C)cc(C)n2)n1	791122569	AQFBOBIVOUDLMS-LWNYNHHKSA-N	440.508	1.318	50	20	IDGD	
O=C(CCc1cnc2ccccc2c1)N1CCN(S(=O)(=O)CBr)CC1	792300020	HMFPNIINHYQCTH-UHFFFAOYSA-N	426.336	1.994	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)[C@@](C)(O)Cn2cc(C(F)(F)F)ccc2=O)nc1C	792302272	WMJNNJNPDLVMJC-KRWDZBQOSA-N	443.382	1.037	50	20	IDGD	
O=C(CNS(=O)(=O)c1c[nH]c2ncccc12)NNC(=O)c1ccc(Cl)cc1Cl	794793011	DLFFEOOUTZKJEZ-UHFFFAOYSA-N	442.284	1.609	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccccc2C(=O)N2C[C@@H](C)C[C@H](C)C2)n1	797369597	AKXWYXONVRGBMH-GJZGRUSLSA-N	437.500	1.908	50	20	IDGD	
CCOc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NNC(=O)c1cccc(OC(F)F)c1	799259451	XUJDRCMTEIBRLF-UHFFFAOYSA-N	438.343	1.995	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccccc2I)cc1	801108880	UIISVEPFZBFTAH-UHFFFAOYSA-N	437.237	1.928	50	20	IDGD	
O=C(N=c1cc[nH]cc1)NNC(=O)c1c[nH]c2ccc(I)cc2c1=O	802025284	ZGNPMOMEDVETPG-UHFFFAOYSA-N	449.208	1.416	50	20	IDGD	
CCN1CCC[C@@H]1CN1C[C@H](C(=O)NNC(=O)Nc2ccc(OC(F)F)cc2)CC1=O	802043593	IDZQZYWOLNDUGF-UKRRQHHQSA-N	439.463	1.774	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)cc1	802067970	TVAKYYWSVRSITK-UHFFFAOYSA-N	444.429	1.651	50	20	IDGD	
COc1ccc(-n2cnnc2SCC(=O)NNC(=O)Nc2ccc3c(c2)OCO3)cc1	802099935	FIAIVOSSSWCHPD-UHFFFAOYSA-N	442.457	1.950	50	20	IDGD	
COc1ccc(Cl)c(NC(=O)NNC(=O)c2cnn3c2C[C@@H](CNC(C)=O)CC3)c1	802116995	VZYPDUZNXSFZEL-LBPRGKRZSA-N	434.884	1.710	50	20	IDGD	
COc1ccc([C@@H](C)NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c(C)c1OC	807600121	YOVQZEUZUCEHNA-CYBMUJFWSA-N	425.449	1.693	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)cc2[nH]ccc12	808935504	ZSOWEWWZFXQMBV-UHFFFAOYSA-N	446.366	1.712	50	20	IDGD	
COC(=O)c1c(F)ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)c1F	810386183	PGFBVMOGUJDSEH-VIFPVBQESA-N	439.346	1.444	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NN=Cc3ccc4[nH]ccc4c3)CC2)cc1	811645380	KFPFZZGRXDVKAC-UHFFFAOYSA-N	439.541	1.933	50	20	IDGD	
COc1cc(C(=O)NNC(=O)N[C@@H]2CC(=O)N(c3ccccc3F)C2)cc(OC)c1OC	812868127	SBFXBCVHLOAFNT-CYBMUJFWSA-N	446.435	1.601	50	20	IDGD	
O=C(Cc1ccc2ccccc2c1)NNC(=O)C(=O)Nc1cn(Cc2ccccc2)nn1	815567541	CFAUQIYBWCFYGI-UHFFFAOYSA-N	428.452	1.808	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2cc(F)cc(F)c2F)nc1	815586779	QWBUBGJXPQOVCQ-UHFFFAOYSA-N	431.396	1.267	50	20	IDGD	
CCn1cc(NC(=O)C(=O)NNc2cc(C(=O)OC)ccc2Br)ccc1=O	815865836	GZPATHOBPVSNIE-UHFFFAOYSA-N	437.250	1.499	50	20	IDGD	
CC(=O)N1Cc2ccccc2C[C@@H]1C(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12	823777167	QPZCAKJULVZGJN-HXUWFJFHSA-N	447.495	1.712	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Cc2ccc([N+](=O)[O-])cc2)c1	912643000	BTWNLRJXMUWLKN-UHFFFAOYSA-N	434.474	1.629	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)N2CCN(c3ncnc4c3cnn4C)CC2)c1C	914755060	SOIAEKDPMGAFQP-UNOMPAQXSA-N	448.531	1.684	50	20	IDGD	
Cc1ccc(C)c2c1NC(=O)C2=NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	914771902	BHWMDPCZNQXUNW-UHFFFAOYSA-N	442.497	1.411	50	20	IDGD	
O=C(CCNS(=O)(=O)c1cccnc1)NNc1ccc(C(F)(F)F)cc1[N+](=O)[O-]	914833420	FTHZLYGDTDWGSG-UHFFFAOYSA-N	433.368	1.820	50	20	IDGD	
COC[C@H](C)NC(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccc(OC)cc2)c1	915888010	KRNCJDFRJZJAIP-ZDUSSCGKSA-N	436.490	1.475	50	20	IDGD	
Cc1nn([C@H]2CCS(=O)(=O)C2)c(Cl)c1C=NNC(=O)[C@@H]1COc2ccccc2O1	916292274	VBXWHWGGKBKARC-LRDDRELGSA-N	438.893	1.495	50	20	IDGD	
CCOc1ncccc1CNC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	916400605	OBINLQIXVUWDFN-UHFFFAOYSA-N	426.521	1.523	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCc2ccc(OC(C)C)nc2)cc1	916511939	IGTCAANKGLYMGR-UHFFFAOYSA-N	449.533	1.328	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(\C#N)C(=O)NS(=O)(=O)c2cc(C(N)=O)n(C)c2)c1C	916789274	RKOQHNFHRALDGY-HFVKVNHUSA-N	447.517	1.162	50	20	IDGD	
CC(=O)N[C@H](C)c1ccc(S(=O)(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)s1	918399943	UZKHCWILKHRJKF-GFCCVEGCSA-N	438.531	1.510	50	20	IDGD	
COc1ccnc(NNC(=O)c2ccc(OC)c(S(=O)(=O)Cc3cc(C)no3)c2)n1	919813768	NHKJCKCQRRXERI-UHFFFAOYSA-N	433.446	1.521	50	20	IDGD	
O=C(NCc1ccc(F)c(F)c1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	920343702	BTQSIWLDKBRNRG-UHFFFAOYSA-N	438.456	1.894	50	20	IDGD	
Cn1c(=O)nc(O)c2c(C(=O)NNC(=O)NCCc3cccs3)cc(C3CC3)nc21	920859334	FAVSQXAADSHDFJ-UHFFFAOYSA-N	428.474	1.160	50	20	IDGD	
COC(=O)N1CCC(NC(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)CC1	1256110715	JWGTYMTWDOYTSW-UHFFFAOYSA-N	427.502	1.195	50	20	IDGD	
O=C1Nc2c(I)cccc2C1=NNC(=O)c1n[nH]c2c1CCCC2	1318110910	RHCOHVBSXQVRDJ-UHFFFAOYSA-N	435.225	1.979	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)NCC(C)(C)N2CCOCC2)CC1	1318579176	PEJFSVQLYDHLOK-UHFFFAOYSA-N	427.546	1.075	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)[C@@H]1CC(=O)N(c2ccc(C#N)cc2)C1	1324021018	GCQBECHBRHZATI-GOSISDBHSA-N	434.452	1.153	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CS[C@]2(c3ccc(F)cc3)CCC(=O)N12)c1n[nH]c2c1CCCC2	1337156154	QZRFZTFTJIOJLX-KKSFZXQISA-N	443.504	1.779	50	20	IDGD	
O=C(NNC(=O)c1ccnc(OC2CCC2)c1)c1ccc(S(=O)(=O)N2CCCC2)cc1	1341343641	WLTVNWIKDOYKAY-UHFFFAOYSA-N	444.513	1.872	50	20	IDGD	
Cc1cn2c(=O)c(C(=O)N3CC[C@@]4(C3)CN(C(=O)[C@@H](F)Cl)CCO4)cnc2s1	1777991618	WMDJGWHZFQVYPS-SJKOYZFVSA-N	428.873	1.042	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@]2(C)CCCN2)C1	1780674554	QHWMKIABUVAUOR-OHDICMOHSA-N	430.387	1.816	50	20	IDGD	
CCc1ccc(C(=O)N2CC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)cc1	1780789666	VDBQPJNOVQTDMB-QHCPKHFHSA-N	437.500	1.005	50	20	IDGD	
CCCc1ccc(C(=O)N2CC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)cc1	1780844804	QJEPUEOVPRKZMB-XMMPIXPASA-N	436.317	1.076	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cccc(N4CCOCC4)c3)CCO2)C1	1781217396	WEBUMFDNMQHWTN-DENIHFKCSA-N	435.952	1.984	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(CS(C)(=O)=O)nc3)CCO2)C1	1781219636	WHRWJGZLYHZLOH-APWZRJJASA-N	443.953	1.087	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnn3c2OCCC3)C1	1781265242	KJSQBQJKBOXXOM-RZQQEMMASA-N	440.928	1.047	50	20	IDGD	
O=C(c1ccc(N2CCCCC2)cc1)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1781711930	WFDZJBRCTDHSGA-DENIHFKCSA-N	435.952	1.720	50	20	IDGD	
O=C1NCc2cc(C(=O)N3CC[C@H]4OCCC[C@@]4(CNC(=O)C(Cl)Cl)C3)ccc21	1782218094	RYJDXBQCXCTXOO-FOIQADDNSA-N	440.327	1.861	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(CCN(C(=O)c3n[nH]c4cccc(F)c34)C2)C1	1782482397	LJHRYBDJWZQGBJ-FQEVSTJZSA-N	434.544	1.997	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)n2cncn2)C1	1782526016	LPARNAGFURCRDA-ATNYBXOESA-N	442.358	1.384	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)C1CC2(CCC2)C1	1782793659	DJOMMDSAFPFWJI-HYBUGGRVSA-N	440.349	1.074	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cccn(C)c3=O)CCO2)C1	1783344360	STXUSJBFTFSPSS-RDTXWAMCSA-N	426.311	1.002	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)CCO2)C1	1783880141	GHZLRTHZHUKSCF-MAUKXSAKSA-N	429.832	1.431	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CCCN(C)C3)C[C@@H]21	1783971681	DYKISZGMIUOVQE-WOYTXXSLSA-N	430.387	1.339	50	20	IDGD	
Cc1nn2cc(CC(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)[C@@H](F)Cl)C[C@@H]43)nc2s1	1784849536	HTRJGAZUWRJUDS-GZCFXPHUSA-N	429.905	1.156	50	20	IDGD	
O=C(c1ccc(N2C(=O)C=CC2=O)cc1)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Cl)CCO2	1785221714	MRYSBLPFGKZZDY-FXAWDEMLSA-N	435.839	1.094	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccnc3OC)[C@H]2C1	1786013042	HNRXGUWMAFFUMH-HNKHHVNMSA-N	440.338	1.857	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3cncnc3)[C@H]2C1	1787043761	QYVZFYCFGNRRSL-FPXQBCRKSA-N	429.348	1.625	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)c1cc2cccn2cn1	1788076461	HNMQEGNPWQAORR-MZGVZZPPSA-N	439.285	1.618	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cn3cc(Cl)cn3)C[C@@H]21	1788764813	NPVSRRQNYUWVEE-BPUTZDHNSA-N	428.993	1.368	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1ccc(C2(NC(=O)c3ccc(=O)oc3)CCC2)cc1	1789522530	JGLBSDAVGJHZBQ-UHFFFAOYSA-N	447.451	1.700	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(OC)c(OC)c3)[C@H]2C1	1789544949	JVSAZRWWRLCKJD-GGXPGOJBSA-N	440.924	1.551	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)c1cc(O)ccc1F	1790053538	UABJSSJPIWTLBQ-PJODQICGSA-N	429.286	1.910	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccccc3-n3nccn3)[C@H]2C1	1790166549	XJBUHFGHGDWHRW-RMRDIRSESA-N	431.924	1.878	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(C=O)s3)C[C@@H]21	1791058459	YVXFVTXJIDIOFG-IMIFBBOLSA-N	429.336	1.937	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3(c4ccc(O)cc4)CC3)C[C@@H]21	1791248946	CNHXSTQMAAMSGL-FZDIXFNVSA-N	436.936	1.657	50	20	IDGD	
COC(=O)[C@H]1CCC[C@@H](C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]3C2)C1	1791298535	ZAITYCQAFOHJFW-QTVXIADOSA-N	435.348	1.749	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCNC(=O)OC(C)(C)C)[C@H]2C1	1792124591	OANHQBOAJMMXAW-JONQDZQNSA-N	431.961	1.898	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COc1ccccc1F)C2	1792871982	GZGWUZPGEHAHKH-FLTUCWPJSA-N	443.313	1.825	50	20	IDGD	
CC(C)(C)n1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCBr)cn1	1795111352	DSPVYWZMCLYHQC-MIFYACCESA-N	427.343	1.626	50	20	IDGD	
C[C@@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCBr	1795116587	VXLLDQPETUFZDI-GUIRCDHDSA-N	448.358	1.274	50	20	IDGD	
Cc1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)nc2ccccc12	1796191352	CBMGCIGGXSSOLT-ACDBMABISA-N	443.312	1.789	50	20	IDGD	
CC(C)(C)c1cnc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)cn1	1797263655	JPCKTLHPEZWKPW-BCDXTJNWSA-N	436.321	1.020	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(Cl)c2nncn2c1	1797688392	MKFXEDSQXYMJJT-HLPPOEQASA-N	440.331	1.993	50	20	IDGD	
COC(=O)[C@H]1CC[C@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CO[Si](C)(C)C)C1	1797953672	CCVGMNNKYBIUNY-FDPKGLCPSA-N	426.586	1.017	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc([N+](=O)[O-])c2c1OCO2	1798628183	VDAFWHBSGNSVAR-NDPMZMCLSA-N	439.852	1.544	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](NC(C)=O)c1ccc(F)cc1	1799057615	QBSVEDBPIRJJEX-CSFFLVESSA-N	439.915	1.610	50	20	IDGD	
CCOC(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Br)OCC	1799351979	HAMASQKZMDSSNO-JLUCKKNBSA-N	425.295	1.056	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1c(F)ccc(O)c1F	1799727258	DMCOMPLWCOJUNE-KSPBDQMDSA-N	428.508	1.725	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccn3nccc3c1)C2	1800641624	GBDLDDQKCRWCPM-YALNPMBYSA-N	435.322	1.711	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCCn1ccnc1C)C2	1800644016	DHAIYHIAZRTCEX-DFGXFYAUSA-N	441.370	1.735	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CCc3ccccc3[C@H]1O)C2	1800970383	DCHGQZFIOVFKQD-ZLKCZHQWSA-N	436.936	1.126	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)Sc1ccccn1)C2	1800980927	HMUZDXUSYDFIPR-JBXGNFEISA-N	427.954	1.406	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(Cl)cc(OC)c1)C2	1800982244	AHGJSHLHZDLYSH-RMHZUWNSSA-N	431.316	1.806	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc2ccoc2c1	1800988440	QOGJZCLPKMWSQW-BJWYYQGGSA-N	433.468	1.997	50	20	IDGD	
O=C(CCc1ccco1)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1804584249	ILJXBZBXTYWJJF-AUSIDOKSSA-N	447.300	1.307	50	20	IDGD	
CC1CCN(CC(=O)N2CCCC3(CCN(C(=O)CCC(=O)NN(C)C)CC3)C2)CC1	1805816115	UIIQSWZEZXFHTP-UHFFFAOYSA-N	435.613	1.323	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)CCc2ccc[nH]2)[C@H]1c1cccnc1	1807464131	TWUKRICDFAVBND-WZONZLPQSA-N	440.548	1.421	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1CCN(C(=O)Cn2cnnn2)[C@@H]1c1cccnc1	1808294742	CEDYKVBHKZZTJJ-LXZKKBNFSA-N	426.308	1.010	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc[n+]([O-])c2)[C@H]1c1cccnc1)[C@@H](F)Br	1808650673	BZOQRVOBQWOJBZ-CWRNSKLLSA-N	437.269	1.725	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC2(CCCN(C(=O)CCN3CCOCC3)C2)CC1	1809585594	WRTZFBFXSPEBMX-UHFFFAOYSA-N	425.646	1.791	50	20	IDGD	
Cc1cscc1C(=O)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1	1809966563	FKKYAKBUMSTSJT-UHFFFAOYSA-N	426.347	1.895	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)c3cccc4c[nH]nc34)CC2)C1	1809966704	KFBIAZUGLRIIIC-UHFFFAOYSA-N	446.316	1.401	50	20	IDGD	
O=C(c1cnc2ccoc2c1)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1	1809977768	GHSVPBRCPHWXEO-UHFFFAOYSA-N	447.300	1.666	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)/C=N/N2CCCCC2)[C@@H]1c1cccnc1	1810289071	OKBYGIAQRQJQRQ-QAOSEWDCSA-N	435.956	1.813	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)/C=C/C2CC2)[C@H]1c1cccnc1	1810296045	ZQGITIJHSIXBHF-RAIXIZIVSA-N	434.500	1.366	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2ccc(C#N)cc2)[C@H]1c1cccnc1	1811893495	IFAJBUKGMIIQKN-NFBKMPQASA-N	448.527	1.646	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)c2c[nH]c(=O)cn2)[C@H]1c1cccnc1	1812777231	NVLQQOKZALPLEP-KEYYUXOJSA-N	448.321	1.658	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2cnn3c2CCC3)[C@@H]1c1cccnc1	1813034220	DYUAJEHXSMHAKR-VDZJLULYSA-N	431.924	1.798	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)C23CC(F)(C2)C3)[C@@H]1c1cccnc1	1813068140	IVKHYUXAFJWIGJ-UCPPSSTDSA-N	431.512	1.353	50	20	IDGD	
COCCOCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](C)CBr)CC2	1814299771	IWVABRSCUWXZGR-QWRGUYRKSA-N	434.356	1.749	50	20	IDGD	
Cc1csc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)c1	1815350268	NGQVRDWNDHFXLV-CQSZACIVSA-N	441.343	1.732	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3cnn4ncccc34)sc2C1	1816950232	PHQWEQYVJGHGNA-CMPLNLGQSA-N	434.909	1.665	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](F)Br)CC2)c1cnc(O)nc1O	1817087677	VOVASPFVCXUKIM-SSDLBLMSSA-N	446.258	1.261	50	20	IDGD	
C[C@H](Nc1nccs1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)CCl)CC2	1817216996	VKYUIRQYAOZESU-NGZCFLSTSA-N	429.955	1.612	50	20	IDGD	
Cc1ccc(CC(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)cn1	1817470426	BCFOBKVLUZMOBG-HXUWFJFHSA-N	447.304	1.342	50	20	IDGD	
CC(C)=NO[C@H](C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1	1817472518	NJBQCZPIJBNVSW-KDOFPFPSSA-N	441.297	1.196	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cncc(F)c2)[nH]n1)c1cccc(B(O)O)c1	1817473155	IZBSRBUPJYUDGX-SFHVURJKSA-N	437.240	1.243	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)C2CCSCC2)[nH]n1)c1cccc(B(O)O)c1	1817478577	GPZILIJQGDZDQZ-SFHVURJKSA-N	442.350	1.539	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](O)N2CCOCC2)n[nH]1	1819442204	XAQVFYROBDYWIU-RFUYNDQBSA-N	427.933	1.460	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)/C=N/O[C@H]3CCCCO3)sc2C1	1819907858	UCECTEYCUPROCO-IFISONFRSA-N	444.941	1.838	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN)[nH]n1	1820167051	VVQAFCFRLKRCIX-HNNXBMFYSA-N	430.421	1.508	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)CCl)CC2)c1cc(-c2cccnc2)[nH]n1	1820607199	BLXGSHDVOSYHLC-ABAIWWIYSA-N	446.920	1.754	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCc2nc(N)n[nH]2)[nH]n1	1820866916	QBXRPBJPQOFTMI-APPDUMDISA-N	443.339	1.971	50	20	IDGD	
CCc1cc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)nn1C	1822414867	MFYFSIICPWRMAF-QGZVFWFLSA-N	444.540	1.385	50	20	IDGD	
Cc1ccc(CC(=O)N[C@@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)cc1	1826085370	OMUCYOMYNABWGM-MRXNPFEDSA-N	443.573	1.979	50	20	IDGD	
CCc1oncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1	1826172493	BDHMSOZSWQXQKI-SFHVURJKSA-N	433.553	1.843	50	20	IDGD	
COc1cnc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)cn1	1826178616	BZHUMAMQMGHKAX-SFHVURJKSA-N	446.552	1.092	50	20	IDGD	
C#CCCCCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnccc1C(=O)NN)CC2	1826426824	IFELDWJPBJZSHW-CYBMUJFWSA-N	440.529	1.561	50	20	IDGD	
Cc1nscc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827050238	JZKYONHPCXNEIJ-FQEVSTJZSA-N	441.362	1.678	50	20	IDGD	
Cc1ccncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1	1827899645	ORQQHHBTJLWJJT-JOCHJYFZSA-N	435.333	1.617	50	20	IDGD	
O=C(N[C@H]1CCc2nc(NC(=O)C3CCSCC3)sc2C1)c1ccc(B(O)O)cc1	1828335934	ITHSJDAEODFLJF-HNNXBMFYSA-N	445.375	1.192	50	20	IDGD	
C/C=C/C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCN2C(=O)OCc1ccccc1	1828551314	MOAASXBKTIZFLO-NXZIYRRWSA-N	449.935	1.614	50	20	IDGD	
COc1ccc(OCC(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)cc1	1830234964	AEWOHPYNPFACBK-PKOBYXMFSA-N	430.860	1.065	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4n(n3)CCCC4)C2)C1	1830361766	CDGGLPXECLBMNG-NRFANRHFSA-N	438.956	1.554	50	20	IDGD	
O=C(c1cccc(-c2cnco2)c1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1830733748	SIXPDOXOHPVZPR-UTKZUKDTSA-N	449.891	1.011	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2[C@H]3C=CS[C@H]32)CC1	1831159171	HQGGPUQKGGUSFC-HRQSHJORSA-N	434.606	1.854	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cn4ccccc4n3)C2)C1	1831647478	VTIAAMRBWAMKRM-IIBYNOLFSA-N	434.924	1.812	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2CCCOC2)CC1	1832870040	OWZQEGYKJNPDRJ-XLIONFOSSA-N	443.548	1.345	50	20	IDGD	
Cc1csc(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)c1	1832976400	PPIXWAJWFIDOAD-APWZRJJASA-N	430.954	1.045	50	20	IDGD	
CC[C@@H](NC(N)=O)C(=O)N1CCC(N2CCC(NC(=O)C(C)(C)CCl)CC2)CC1	1833215129	AGDQUXQERMQOOZ-MRXNPFEDSA-N	429.993	1.270	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)CNC(=O)N(C)C)CC2)CC1	1833530462	QLPWJDVPWRAIJO-KRWDZBQOSA-N	429.993	1.237	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)c3cccnc3C(N)=O)CC2)CC1	1833531223	LBRAQLLVOWEODC-SFHVURJKSA-N	449.983	1.773	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3csnn3)CC2)CC1	1833559213	UMLPUNGZOAXXEX-NSHDSACASA-N	430.372	1.507	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3n[nH]c(C4CC4)c3F)CCO2)C1	1833677118	AXQAFSWPAZGBBO-FQEVSTJZSA-N	442.919	1.761	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCC(N2CCC(NC(=O)c3ccc[n+]([O-])c3)CC2)CC1	1833910105	PRXAOVQCTCIDJI-FQEVSTJZSA-N	443.375	1.742	50	20	IDGD	
CCc1oncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)CCBr)C2)C1	1834515916	HYPRCNCXBRFFIO-QGZVFWFLSA-N	430.299	1.092	50	20	IDGD	
O=C(C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1)c1ccccc1	1834706376	IBMOSRPEWOATDV-MAUKXSAKSA-N	443.269	1.016	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)[C@@H]3[C@H]4C=CS[C@@H]43)C2)C1	1834825479	YIMXLIOHNAQMTE-JJAZEVLHSA-N	431.352	1.103	50	20	IDGD	
C[C@@H](C(=O)N1CCC(N2CCC(NC(=O)[C@@H](F)Cl)CC2)CC1)n1ccccc1=O	1835083977	DIWYQLLGFVQPKB-KBXCAEBGSA-N	426.920	1.515	50	20	IDGD	
Cc1cnc2c(C(=O)NC3CCN(C4CCN(C(=O)[C@H](F)Cl)CC4)CC3)cnn2c1	1835563026	YORPGLOBDXIAIO-KRWDZBQOSA-N	436.919	1.757	50	20	IDGD	
CN(C)c1ccc(C(=O)NC2CCN(C3CCN(C(=O)[C@H](F)Cl)CC3)CC2)cn1	1836005161	CTEJLMXKXVFWKY-SFHVURJKSA-N	425.936	1.867	50	20	IDGD	
Cc1noc(N)c1C(=O)N1CCC(N2CCC(NC(=O)[C@@](C)(Cl)CCl)CC2)CC1	1836398662	QTKLGDOMYZSYTD-IBGZPJMESA-N	446.379	1.987	50	20	IDGD	
Nc1ccccc1/C=C/C(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836716899	WWVASHHEFDWKBB-XJDXJNMNSA-N	435.952	1.880	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@](C)(Cl)CCl)C3)C2)c(O)n1	1838672162	KDNSIJOYCIMLAX-MOPGFXCFSA-N	446.331	1.402	50	20	IDGD	
Cc1ccn(C)c1C(=O)N1CCO[C@@]2(COCCN(C(=O)CCBr)C2)C1	1838815884	BUATYELOZMIFHX-GOSISDBHSA-N	428.327	1.189	50	20	IDGD	
C[C@H](Cn1cccn1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2	1839150572	QFSMRQHXCZYFPB-ATZDWAIDSA-N	447.363	1.212	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)n(C)n1	1839151229	LJTQIQVHQKRWNM-QZTJIDSGSA-N	433.336	1.035	50	20	IDGD	
O=C(/C=C/c1ccoc1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839199658	ZIKPFFXVAFKHTC-CYJXPKQYSA-N	431.258	1.440	50	20	IDGD	
CC(C)[C@H](S)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H](F)Br)CCO2)C1	1839199682	ZKAGUINLIBAFFW-ZOWXZIJZSA-N	427.336	1.088	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3c(C)ccn3C)C2)C1	1839965759	JTTCGWAVEDBUGQ-HNAYVOBHSA-N	442.354	1.577	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)Oc3ccccc3)C2)C1	1840155627	FVFMTFWVLURMQY-DJPFJPOOSA-N	440.924	1.164	50	20	IDGD	
COc1cccc(C(=O)N2CCO[C@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)c1C	1840645153	GPAVAGKPYJTVCB-LJQANCHMSA-N	431.316	1.877	50	20	IDGD	
CCc1ncsc1C(=O)N1CC2(CCCN2C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C1	1843416490	QLJRHUUAWDPTAK-YDZHTSKRSA-N	428.518	1.657	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1ccc3nn(C)cc3c1)C2	1843416703	QQVUXKVYLBEBDB-MFKUBSTISA-N	447.499	1.524	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)[C@H]2[C@H]3c4ccccc4S[C@H]32)C1	1844271242	VUGKYTNPQYLNDL-HSALFYBXSA-N	434.326	1.071	50	20	IDGD	
O=C([C@@H](O)CCl)N1CC2(CCCN2C(=O)c2cc(Br)cnc2Cl)C1	1844409217	VFVMTXYTHNZNPP-NSHDSACASA-N	437.121	1.914	50	20	IDGD	
CN(CCOc1ccc(Cl)cc1)C(=O)NNC(=O)c1csc(N2CCOCC2)n1	9789955	JXRMFRHNAXVTKN-UHFFFAOYSA-N	439.925	1.998	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)CCN2C(=O)COc3ccccc32)c2ccccc2c1=O	17197357	IFLKJMBXEGYWKK-UHFFFAOYSA-N	449.467	1.554	50	20	IDGD	
O=C(CCc1ncc(-c2ccc(F)cc2F)o1)NNC(=O)c1ccc(-n2cnnn2)cc1	22193109	WLNHFKFNHZTDTE-UHFFFAOYSA-N	439.382	1.989	50	20	IDGD	
CCOc1ccc(N[C@H](C)C(=O)NNC(=O)c2cccc(C)c2)cc1S(=O)(=O)N(C)C	25215237	GXBVHNOHWQLOBB-OAHLLOKOSA-N	448.545	1.906	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCc2cccc(O)c2)c1	727239437	GKQUMVIHWQRKNX-UHFFFAOYSA-N	434.518	1.609	50	20	IDGD	
Cn1ncc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1C(F)F	727364854	GBOUNAIWVOQWLW-UHFFFAOYSA-N	427.433	1.217	50	20	IDGD	
CCOc1ccc(OCC)c(NC(=S)NNC(=O)Cn2nnc3ccccc3c2=O)c1	727494286	GKHAYTKTKOKDKL-UHFFFAOYSA-N	442.501	1.607	50	20	IDGD	
O=C(CN1C(=O)c2ccc(Br)cc2C1=O)NNc1nc(-c2cccnc2)no1	728075428	BDEHVNZVPHYJAX-UHFFFAOYSA-N	443.217	1.633	50	20	IDGD	
CN(C)N(C(=O)CNC(=O)c1sc2ccccc2c1Cl)[C@H]1CCS(=O)(=O)C1	728175160	KPWXJIYOQPSWOY-NSHDSACASA-N	429.951	1.777	50	20	IDGD	
COc1cc(OC)cc(C(=O)N2CCC(C(=O)NNC(=O)Cc3cccnc3)CC2)c1	728851567	KWGPDTCNQJKCHS-UHFFFAOYSA-N	426.473	1.341	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N1CCN(C(=O)N(C)C)CC1	728943118	HGUWFUVXWXWDAH-LBPRGKRZSA-N	442.314	1.256	50	20	IDGD	
Cc1cc(C)c(S(=O)(=O)Nc2cc(C(=O)NNC(=O)c3cnn[nH]3)ccc2C)c(C)c1	729455648	PZNBMIAXSOJSKD-UHFFFAOYSA-N	442.501	1.914	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CCc2c(C)nc3[nH]n(C)c(=O)c3c2C)cc1OC	729511425	PJMCEYCIKHIWMU-UHFFFAOYSA-N	427.461	1.289	50	20	IDGD	
C[C@]12CCC(=O)N1c1ccccc1C(=O)N2CC(=O)NNC(=O)c1cccc2ncccc12	730286543	ONZMCXYBGBLXFY-XMMPIXPASA-N	443.463	1.995	50	20	IDGD	
CC[C@@H](NC(=O)NNC(=O)COc1ccccc1O)c1ccccc1OCC(=O)NC	730902295	HBYFKYKUVNHCNE-OAHLLOKOSA-N	430.461	1.378	50	20	IDGD	
Cc1c(C(=O)NNC(=O)COc2ccc(C#N)cc2)nnn1-c1ccc(OC(F)F)cc1	731186975	YDKAGJPPCAYHOB-UHFFFAOYSA-N	442.382	1.889	50	20	IDGD	
CC(=NNC(=O)c1ccnc(N(C)C)c1)c1ccc(S(=O)(=O)NCCCC(=O)O)cc1	731561366	BLLWDILNNYEFDK-UHFFFAOYSA-N	447.517	1.445	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C1CCN(S(=O)(=O)c2cn(C)c(C)n2)CC1)c1ccccc1	731998103	XRKCZTVEENJZAJ-SFHVURJKSA-N	447.561	1.470	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)c1cn(-c2ccc(C(F)(F)F)cn2)nn1	732302226	SWKUBJSZHLAQPL-UHFFFAOYSA-N	426.380	1.842	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N[C@@H](C)[C@@H](C)N2CCOCC2)cc1Br	732464841	JVRNGCHXHXDNAB-NWDGAFQWSA-N	429.315	1.511	50	20	IDGD	
CSCC[C@@H](NC(=O)Cc1ccccc1)C(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	732750643	XUVGTNJGJARMIT-QGZVFWFLSA-N	430.486	1.836	50	20	IDGD	
N#Cc1ccc(N2C(=O)N[C@H](CCC(=O)NNC(=O)c3cccc4cccnc34)C2=O)cc1	733776566	LWIUMVOCXQPGDH-GOSISDBHSA-N	442.435	1.773	50	20	IDGD	
COc1ccc([C@@H]2[C@@H](C(=O)NNC(=O)c3ccc4c(c3)OCCO4)CCC(=O)N2C)cc1	734316159	KSGBIFXBJFTEPQ-LAUBAEHRSA-N	439.468	1.837	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)c2cc(Cl)ccc2-n2cnnn2)cc1C	736776783	DWGAIUORDHSYDG-UHFFFAOYSA-N	448.892	1.866	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)Cc2c(C)nc3cc(O)nn3c2C)cc1C	736813820	QPNRCPONAPREKS-UHFFFAOYSA-N	445.501	1.531	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1cc2c(nc1O)CCCCC2	737766244	NJNKFRXCNGHJOH-UHFFFAOYSA-N	431.518	1.732	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC[C@@H]2C)c1	740851681	QRCSCFRTSQJCSB-AWEZNQCLSA-N	438.550	1.316	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)N[C@@H]2CCC[C@@H](S(C)(=O)=O)C2)c2ccccc2c1=O	741092353	CLTYKFJESNWRNP-ZIAGYGMSSA-N	449.533	1.277	50	20	IDGD	
CCN1CCC(=NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)[C@H](C)C1	741453252	NSIQGAJSJWSANE-QGZVFWFLSA-N	436.578	1.474	50	20	IDGD	
CC(=O)N[C@H](CC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)c1ccc(F)cc1F	741535331	MPZXIALDJLMDSP-QGZVFWFLSA-N	439.440	1.397	50	20	IDGD	
CCC(CC)[C@@H](C(=O)NNC(=O)c1nn(CC)c(=O)c2ccccc12)N1CCOCC1	742034027	IZLZZBVKCFHGCI-IBGZPJMESA-N	429.521	1.314	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)[C@@]2(C)CCCN(C(=O)c3ccccc3)C2)c2ccccc2c1=O	742034884	YLZCDQDZAWDRQI-DEOSSOPVSA-N	447.495	1.637	50	20	IDGD	
Cc1nn(C)c2sc(C(=O)N[C@H](C)C(=O)NNC(=O)[C@@H](C)Oc3ccccc3F)cc12	742037261	VMYMEJBWKHMCFQ-VXGBXAGGSA-N	447.492	1.816	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)[C@H]1CCCN(c2ncnc3sccc23)C1	742612323	JHKWTKNPFZMJAI-LBPRGKRZSA-N	444.542	1.547	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)N[C@H]1CCCN(c2ccccc2Cl)C1=O	743580127	ULWUDRDAOMYNIQ-ZDUSSCGKSA-N	449.920	1.657	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)N[C@@H]1CC(=O)N(CCOc2ccccc2)C1	743639639	XLCNNGGWGGNBCN-QGZVFWFLSA-N	426.473	1.248	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)c2cc(S(N)(=O)=O)cc([N+](=O)[O-])c2C)cc1	746096972	KCDJZIBWKJXNLY-UHFFFAOYSA-N	438.487	1.412	50	20	IDGD	
C[C@@H](CN(C)C(=O)OC(C)(C)C)C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	746815850	GFYAMVOEBHJMRM-SFHVURJKSA-N	447.580	1.849	50	20	IDGD	
N#CCCn1cc(/C=C(/C#N)C(=O)NCCN2CCCS2(=O)=O)c(-c2ccccc2)n1	747202199	ISHYGQODYQKFFR-JXAWBTAJSA-N	438.513	1.522	50	20	IDGD	
Cc1cc(Br)ccc1NNC(=O)CCNS(=O)(=O)c1cn(C)c(C)n1	748732722	YOFRQOLZTXNDOZ-UHFFFAOYSA-N	430.328	1.611	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCC(C)(C)S(C)(=O)=O	748967470	OKLMPYWGNQOLDQ-JTQLQIEISA-N	436.328	1.370	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CSCCS1)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	750983041	DLOYYFCUCXFCLG-KRWDZBQOSA-N	440.554	1.998	50	20	IDGD	
COCCCOc1ccc(C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)cn1	751292772	APWFBGCVWWSPQM-UHFFFAOYSA-N	439.472	1.863	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)N(C)C[C@H](O)CN2CCOCC2)c(C)n1C[C@H]1CCCO1	751430411	KPJJRNPDOAUJBC-CQBKICRYSA-N	430.549	1.342	50	20	IDGD	
CN(C[C@H](O)CN1CCOCC1)C(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccccc1	751431847	RZZJWJCQNSAIBO-PZHBDVNGSA-N	448.527	1.522	50	20	IDGD	
C[C@H](NC(=S)NNC(=O)C1CCN(S(=O)(=O)c2cccnc2Cl)CC1)C1CC1	751617579	JKEPGJFSUPAZON-NSHDSACASA-N	445.998	1.430	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)Nc2ccc3c(ccn3CC(=O)N3CCOCC3)c2)c1	756295045	XJDGMPYOBKNIIT-UHFFFAOYSA-N	446.467	1.838	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)CN2C(=O)NC3(C[C@H](C)C[C@@H](C)C3)C2=O)cc1	756868522	WTAIOTDJEDCAOV-HUUCEWRRSA-N	432.546	1.981	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)CN1C(=O)N[C@]2(C[C@@H](C)C[C@@H](C)C2)C1=O	756901242	LZWSYZRCLXHWHE-OYHTYJOISA-N	436.896	1.856	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)c1ccc(-c2ccc(Br)cc2)n1C	758048742	VEKVGYDHEYURNM-SNVBAGLBSA-N	443.323	1.153	50	20	IDGD	
O=C(NNC(=O)c1cccc(NS(=O)(=O)c2ccccc2)c1)C(=O)Nc1ccccn1	758840528	JHAVXMDEBTVYJN-UHFFFAOYSA-N	439.453	1.282	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)C2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)nc1	759730879	OIFIKWCFUYCESW-UHFFFAOYSA-N	432.502	1.721	50	20	IDGD	
Cc1ccnc(-n2nccc2NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)c1	760279340	MQSSZMJBVLGIAJ-UHFFFAOYSA-N	428.836	1.394	50	20	IDGD	
CC[C@@H](NC(=O)NNC(=O)CNC(=O)c1ccco1)[C@H]1CN(Cc2ccccc2)CCO1	760751407	NASAPIYQDHAYKV-IEBWSBKVSA-N	443.504	1.019	50	20	IDGD	
COc1ccc(-c2noc(CCCC(=O)NNc3nccc(N4CCOCC4)n3)n2)cc1	762860071	CSUOFLLNRQDTPG-UHFFFAOYSA-N	439.476	1.838	50	20	IDGD	
CCCC(=O)N1CCC[C@@H]1C(=O)NNC(=O)c1cc(-c2ccc(OC)c(OC)c2)[nH]n1	763153409	ZLIJAGFMQXWBMC-MRXNPFEDSA-N	429.477	1.646	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)C(=O)Nc1ccnn1-c1cccc(Cl)c1	763547539	DGALYZQGAIEIPV-UHFFFAOYSA-N	427.804	1.654	50	20	IDGD	
Cc1ccnc(Oc2ccc(NC(=O)C(=O)NNC(=O)[C@H]3COc4ccccc4O3)cc2)n1	763569987	CUDGKHPSKDECOM-GOSISDBHSA-N	449.423	1.503	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccccc2S(=O)(=O)N2CCCCC2)c(C)o1	763583377	PFGWCQCGKPPIFZ-UHFFFAOYSA-N	448.501	1.471	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccc(C(C)(C)C)cc2)ccc1C(N)=O	763599587	JGEORWRWIHKCGR-UHFFFAOYSA-N	426.473	1.556	50	20	IDGD	
CC(C)(C)c1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccnc2-n2cccn2)cc1	763600680	SFFOKFQVTZDXMO-UHFFFAOYSA-N	436.472	1.730	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1cccc(C(=O)N2CCCC2)c1C	763629849	UOEOTXWZUZSXJD-UHFFFAOYSA-N	448.483	1.587	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(-n2cncn2)c(F)c1	763713349	YGFVUTPFCISCAJ-UHFFFAOYSA-N	426.408	1.134	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)N(C)C)c(Cl)c2)c1	763775201	NULLKSFVFWDHIZ-UHFFFAOYSA-N	448.863	1.459	50	20	IDGD	
COC(=O)N(C)c1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)cc1	763865845	ROOPVZGGIOFECL-GFCCVEGCSA-N	432.408	1.582	50	20	IDGD	
O=C(CCSc1ccc(F)cc1)NNC(=O)C(=O)Nc1cccc(-n2cnnn2)c1	763894383	BKRBAPMWAXIWEP-UHFFFAOYSA-N	429.437	1.070	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CC[C@H](C)C3)cn1	763939217	BCZHTVYQBCCMQW-LBPRGKRZSA-N	432.502	1.693	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3cnn(C[C@H]4CCCO4)c3)cc2C1	763939639	NOTXYCCJRWLBPD-IUODEOHRSA-N	431.518	1.648	50	20	IDGD	
O=C1COc2cc(NC(=O)C(=O)NNC(=O)c3ccc(Br)s3)ccc2N1	763940397	QMAMZHOTUWBFRX-UHFFFAOYSA-N	439.247	1.241	50	20	IDGD	
COC(=O)COc1cccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)on2)c1	764004227	UWBMLDWSIYIZRF-UHFFFAOYSA-N	438.396	1.293	50	20	IDGD	
O=C(NNC(=O)c1cccc(Br)c1)C(=O)Nc1ccn(Cc2ccncc2)n1	764063817	YLUPHKHKTCWHRI-UHFFFAOYSA-N	443.261	1.489	50	20	IDGD	
O=C(NNC(=O)C1CCCC1)C(=O)Nc1cc(Br)ccc1N1CCOCC1	764075975	ABKBSXVGOHJHOC-UHFFFAOYSA-N	439.310	1.562	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(NC(=O)[C@H]3CCCO3)cc2)c(O)c1	764110061	WJQHVKGFPXAXKO-QGZVFWFLSA-N	426.429	1.218	50	20	IDGD	
O=C(NNC(=O)c1ccoc1)C(=O)Nc1ccc(Cl)c(S(=O)(=O)N2CCCC2)c1	764160002	KTZRKCFEIGOPFG-UHFFFAOYSA-N	440.865	1.117	50	20	IDGD	
COc1ccc(C(=O)N2CCCC2)cc1NC(=O)C(=O)NNC(=O)CCc1ccco1	764172076	OZWWPYZDUXDIEI-UHFFFAOYSA-N	428.445	1.243	50	20	IDGD	
CC(C)CCC(=O)NNC(=O)C(=O)Nc1ccc(S(=O)(=O)N2CCC[C@@H](C)C2)cc1	764203809	XBVRCLFQEZIVJX-OAHLLOKOSA-N	438.550	1.629	50	20	IDGD	
COC(=O)c1c(NC(=O)C(=O)NNC(=O)Cc2ccccn2)sc2c1CCCCC2	764267093	NGDPAEWAZMLAIR-UHFFFAOYSA-N	430.486	1.527	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1ccc(Cl)cc1OC(F)F	764278078	QMVFQMRRVBXMTH-UHFFFAOYSA-N	429.763	1.812	50	20	IDGD	
O=C(Cc1cc[nH]n1)NNC(=O)C(=O)Nc1ccc(Br)c(C(F)(F)F)c1	764285862	CEZNIWUCDDAVJE-UHFFFAOYSA-N	434.172	1.520	50	20	IDGD	
CCN(C(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)c2cnn(C)c2)cc1)c1ccccc1	764358980	LMOLXRFFYDYANW-UHFFFAOYSA-N	448.483	1.415	50	20	IDGD	
CN(c1ccccc1NC(=O)C(=O)NNC(=O)c1ccc(Cl)cc1F)S(C)(=O)=O	764413991	ZBDCYVQCDPZBAH-UHFFFAOYSA-N	442.856	1.275	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](CNC(=O)NNC(=O)c1nnc(O)c2ccccc12)C1CC1	764543435	GBEMITAWUKQBTJ-CQSZACIVSA-N	430.465	1.583	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)c1cc(S(C)(=O)=O)ccc1Cl	765311418	BXBXMOMJRWFNFB-UHFFFAOYSA-N	433.914	1.809	50	20	IDGD	
Cc1nc2c(C#N)cnn2c(C)c1CCC(=O)NNC(=O)CCCNC(=O)OC(C)(C)C	765324473	WXPPQEYSEHHKNR-UHFFFAOYSA-N	443.508	1.603	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NN=Cc3n[nH]c4cc(C(=O)O)ccc34)CC2)cc1	765582941	GYFSPEPTGCGVIU-UHFFFAOYSA-N	434.500	1.837	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1cncc(-c2ccccc2)c1	765739287	SCCOBEDNTFJUQL-UHFFFAOYSA-N	443.507	1.968	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cn(-c4ccccc4)nn3)CC2)cc1	765749665	PBRSKNHWMREPEO-UHFFFAOYSA-N	433.516	1.155	50	20	IDGD	
O=C(NNc1ncnc2ccsc12)C1CCN(C2=NS(=O)(=O)c3ccccc32)CC1	766674874	BAUNVFGUVQNSOV-UHFFFAOYSA-N	442.526	1.996	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)CCCN2C(=O)c3ccc(Br)cc3C2=O)n[nH]1	768278085	ZHTHECIZMZUXJB-UHFFFAOYSA-N	434.250	1.318	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)c1ccc(S(=O)(=O)NC(C)(C)C)o1	768635157	WUZPFOOWKYOOEX-UHFFFAOYSA-N	445.519	1.525	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)Nc1ccccc1N(C)S(C)(=O)=O	769243940	YMZMHEJNEHUFAX-UHFFFAOYSA-N	442.519	1.643	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)N[C@H]3CCN(c4ncccc4F)C3)nc21	770413360	QFYMLQVMMMDWLL-NSHDSACASA-N	429.460	1.726	50	20	IDGD	
CC[C@H](C)NS(=O)(=O)c1ccc(C(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1	770426859	JUXBNIFSKYSSDH-ZDUSSCGKSA-N	433.486	1.609	50	20	IDGD	
CCN1CCN(C(=O)Cc2ccc(NC(=O)C(=O)NNc3c(C)cccc3F)cc2)CC1	770823682	MFJFASBWVXLQEV-UHFFFAOYSA-N	441.507	1.923	50	20	IDGD	
C[C@H]1CCCN(S(=O)(=O)c2ccc(C(=O)NNc3nc(O)c4cnn(C)c4n3)cc2)C1	770971460	JNLUHIIFNMKYLH-LBPRGKRZSA-N	445.505	1.246	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)[C@H]1CSCN1C(=O)C1CCCC1	772883815	FONDQFSJMRIMBT-OAHLLOKOSA-N	438.937	1.195	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)c2ccc(CS(=O)(=O)c3ccccc3)o2)c1	773069729	IQGHKFOTFADDDV-UHFFFAOYSA-N	442.453	1.682	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNc2ccc(C(F)(F)F)cn2)cc1	773667382	XOUBAMNXJRUPPT-UHFFFAOYSA-N	431.396	1.944	50	20	IDGD	
O=C(NNC(=O)N1CCO[C@@H](Cc2ccccc2)C1)c1csc(N2CCOCC2)n1	776315927	DFBQAQGDGGAXMH-INIZCTEOSA-N	431.518	1.278	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)[C@@H]2CCN(c3ccc4c(c3)OCCO4)C2=O)c1	776534805	WXHPNOHTNSLUPS-INIZCTEOSA-N	431.470	1.358	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(OCC(=O)NNC(=O)Cn2cnc3ccccc32)CC1	777096176	GIRJBJJFRJDVHZ-UHFFFAOYSA-N	431.493	1.600	50	20	IDGD	
CS(=O)(=O)CCn1cccc(NC(=O)NNc2ccccc2OC(F)(F)F)c1=O	779446277	YZYXPSXGKNIYOI-UHFFFAOYSA-N	434.396	1.940	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNS(=O)(=O)c1cnc(-c2ccccc2)nc1	780398007	SMVQFQLMTXIRBL-UHFFFAOYSA-N	445.888	1.423	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)C1=CCN(C)CC1	781397069	WNPGEMBPWDYHPR-INIZCTEOSA-N	449.577	1.456	50	20	IDGD	
CC(C)C(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)cc1	782894136	MIMSMICHOUIQTN-UHFFFAOYSA-N	436.472	1.496	50	20	IDGD	
COC[C@@H](C)NS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2cc(C)ccc2C)cc1	783366320	BDDMGGKATJFNCC-OAHLLOKOSA-N	434.518	1.698	50	20	IDGD	
CC(C)c1ccc(Cn2nccc2NC(=O)C(=O)NN[C@]2(C)CCS(=O)(=O)C2)cc1	783426398	LRQLSKGWRRGONG-HXUWFJFHSA-N	433.534	1.191	50	20	IDGD	
O=C1CCC(=NNC(=O)C(=O)NN=C2CCC(=O)Nc3ccccc32)c2ccccc2N1	783785529	ZHESTFCFBFDBRX-UHFFFAOYSA-N	432.440	1.492	50	20	IDGD	
O=C(NNc1ccc(F)cc1Br)C(=O)Nc1cccnc1N1CCOCC1	784802560	LHRIFZQIZSOWSJ-UHFFFAOYSA-N	438.257	1.902	50	20	IDGD	
COC(=O)c1csc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)c1	784835875	YJVZUPWNXNPOJZ-UHFFFAOYSA-N	433.414	1.613	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)on2)cc1N1CCNC1=O	787544918	ZDGNISNDDWRDHC-UHFFFAOYSA-N	448.439	1.579	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1OC(C)C	787556274	FGOMICGYGXPZTB-UHFFFAOYSA-N	447.517	1.475	50	20	IDGD	
CCS(=O)(=O)CCn1cc(C)c(NC(=O)C(=O)NNc2cccc(C(F)(F)F)c2)n1	787560966	XXKMTLJJAMKHPP-UHFFFAOYSA-N	447.439	1.727	50	20	IDGD	
CCN(CC)Cc1ccc(NC(=O)C(=O)NNC(=O)c2nnc(O)c3ccccc23)cc1	787888651	DQFPFXMEONZDPF-UHFFFAOYSA-N	436.472	1.577	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)NC[C@H](Cc2cccc(F)c2)C(=O)N2CCOCC2)n1	789308191	AGHLERQDTXELTE-KRWDZBQOSA-N	430.484	1.576	50	20	IDGD	
COCC(=O)N1CCc2cc(NC(=O)C(=O)NNc3ccc(Cl)c(OC)c3)ccc21	789804943	SEJWYBSIXZRYAA-UHFFFAOYSA-N	432.864	1.966	50	20	IDGD	
O=C(NC[C@@H]1CCSC1)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	790877429	MXIXXPGEFFDPNL-INIZCTEOSA-N	448.570	1.862	50	20	IDGD	
COCC1(C(=O)NNC(=O)c2ccc3c(c2)OCCO3)CCN(C(=O)OC(C)(C)C)CC1	792892954	IOKFYFUGLBQOTC-UHFFFAOYSA-N	449.504	1.883	50	20	IDGD	
CC1(C)C(=O)Nc2ccc(S(=O)(=O)NNC(=O)CNC(=O)OCc3ccccc3)cc21	794596605	JOCSYAAVLWZBOP-UHFFFAOYSA-N	446.485	1.152	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2c(C)nn(Cc3ccccc3)c2N)c2ccccc2c1=O	794774020	BEXBGUUHLIPLGQ-UHFFFAOYSA-N	445.483	1.627	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@H]2C(=O)NNc2ccccc2S(=O)(=O)N(C)C)cc1	795152575	TVKQYFKJBDRQAW-SFHVURJKSA-N	446.529	1.693	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(Cl)cc1Cl)c1csc(N2CCOCC2)n1	797428852	IBBUBIRRIRAHRU-UHFFFAOYSA-N	437.330	1.910	50	20	IDGD	
CC(C)(C(=O)NNC(=O)NCCNS(=O)(=O)c1ccc(F)cc1F)c1ccccc1	799370461	MVXJCCARJLYGHN-UHFFFAOYSA-N	440.472	1.551	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNS(=O)(=O)c3cccc([N+](=O)[O-])c3)CC2)cc1	799537632	RXOPMAZWYLNOIM-UHFFFAOYSA-N	447.517	1.031	50	20	IDGD	
O=C(CN1C(=O)[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)NNc1cc([N+](=O)[O-])ccc1Br	800621300	QGUQZNPBPWUHOM-WDQYXFPCSA-N	435.234	1.608	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)c2nn(-c3cccc(Cl)c3)cc2O)c1	801358707	AYNUARGTKKSGPA-UHFFFAOYSA-N	439.815	1.721	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)[C@H]2CC[C@@H](C(F)(F)F)NC2=O)c(OC)cc1Cl	802081471	PUDLRJUVZUCDEJ-MADCSZMMSA-N	438.790	1.967	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)Nc1ccc(OC(F)F)nc1	802566168	CCTIWCOTGFPYQB-UHFFFAOYSA-N	432.181	1.184	50	20	IDGD	
CN(C)S(=O)(=O)C[C@@H](NC(=O)NNC(=O)c1cc2ccccc2cc1O)C(F)(F)F	806565343	LAHALQVAHXYGHY-CQSZACIVSA-N	448.423	1.312	50	20	IDGD	
COC(=O)c1scc(-c2ccc(C)cc2)c1NC(=O)C(=O)NNC(=O)c1cc(C)[nH]n1	806976554	RWJZVXVVTLTUHT-UHFFFAOYSA-N	441.469	1.941	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)CSc1nnc(C)n1-c1ccccc1OC	807369335	VWQNWHKKZQZJDM-UHFFFAOYSA-N	437.522	1.613	50	20	IDGD	
CN1CCN(C(=O)NNC(=O)c2nn(-c3ccc(F)cc3)cc2Br)CC1	807380298	SYXIUELFJUCRAM-UHFFFAOYSA-N	425.262	1.376	50	20	IDGD	
C#CC[C@]1(C(=O)OCC(=O)NNC(=O)c2ccccc2)CCCN1C(=O)OC(C)(C)C	808594247	FZPLSWSVQFGWSI-JOCHJYFZSA-N	429.473	1.784	50	20	IDGD	
COC[C@@]1(C(=O)NNC(=O)c2ccc3c(c2)OCCO3)CCN(C(=O)OC(C)(C)C)C1	809986505	HBLDKUOENVOLOR-OAQYLSRUSA-N	435.477	1.492	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2ccc(F)c(C(=O)OC)c2F)c2ccccc2c1=O	810337538	DBKQDEYGXBQLFF-UHFFFAOYSA-N	445.382	1.948	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)CNS(=O)(=O)c1ccc(C#N)cc1	811462021	JZFAXKZFPLRNMA-LBPRGKRZSA-N	436.877	1.105	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccc3c(c2)OC(C)(C)O3)cc1	813033403	RMAPTJPKXVORNI-UHFFFAOYSA-N	434.474	1.526	50	20	IDGD	
COC(=O)CN1CCN(c2ccc(NC(=O)C(=O)NNc3cccc(Cl)n3)cc2)CC1	815727239	NOSOLOFHTKWEJQ-UHFFFAOYSA-N	446.895	1.112	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)NCc2ccc(S(N)(=O)=O)s2)c1	915906203	RFPLDFHAQZAUPJ-UHFFFAOYSA-N	440.547	1.737	50	20	IDGD	
Cn1ccnc1[C@@](O)(CCNC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)C(F)(F)F	916381294	FVYFBSQMIMPWKG-HNNXBMFYSA-N	430.343	1.113	50	20	IDGD	
CCN1CCN(Cc2ccccc2CNC(=O)NNC(=O)c2c(C)nc3ccccn23)CC1	916419908	LOIGTKMUEVTUJP-UHFFFAOYSA-N	449.559	1.924	50	20	IDGD	
COCCCCNC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	916501861	BVCIQENLODUPDY-UHFFFAOYSA-N	426.520	1.920	50	20	IDGD	
COc1cc(CNC(=O)NNC(=O)COc2ccc(C)cc2)ccc1OCC(=O)N(C)C	916641393	BZGBGYSYAGUMIZ-UHFFFAOYSA-N	444.488	1.380	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)[C@@H](CC(C)C)N1C(=O)[C@H]2CC=CC[C@H]2C1=O	917360337	GISVQLHLVNJLPP-IXDOHACOSA-N	437.500	1.770	50	20	IDGD	
Cc1ccc(C(=O)N2CCN(CC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)CC2)s1	917837721	ZCWUFFAQRFGYHD-UHFFFAOYSA-N	431.474	1.184	50	20	IDGD	
C[C@]12CCC(=O)N1c1ccccc1C(=O)N2CC(=O)NNC(=O)c1ccc(Cl)cc1O	918359201	POYRMGKJQXUHEU-OAQYLSRUSA-N	442.859	1.806	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccccc2)C1)c1ccc(Cl)cc1O	918359391	ZHYDOKCRVQHCER-CYBMUJFWSA-N	437.905	1.908	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CC=CC[C@H]1c1nc2ccccc2s1)N[C@@H]1CCS(=O)(=O)C1	919889265	KHYREDAWZCGXHO-MGPQQGTHSA-N	434.543	1.864	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)Nc1ccccc1CN1C(=O)CNC1=O	920932938	GBQGHLJJZYBVJA-LBPRGKRZSA-N	429.408	1.498	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)NC2CCN(c3cccnn3)CC2)CC1	1255807724	VPEIJRKZFXNMIG-UHFFFAOYSA-N	447.540	1.423	50	20	IDGD	
CN1CCN(Cc2cccc(CNC(=O)NNC(=O)c3cc(Br)c[nH]3)c2)CC1	1318249786	IPVPAGPUWXVWBX-UHFFFAOYSA-N	449.353	1.669	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)[C@H]2CCCCCN2C(=O)OC(C)(C)C)c2ccccc2c1=O	1321484657	WJFUXQXCOCRRAO-MRXNPFEDSA-N	443.504	1.874	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)[C@@H]1COc2ccc(F)cc2C1	1323092459	LODUVALRYRFYFR-SFHVURJKSA-N	426.492	1.737	50	20	IDGD	
CS(=O)(=O)c1ccc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](F)Cl)C2)nc1	1778023867	GVMZRIIIUGIDEA-RVKKMQEKSA-N	447.916	1.147	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnc4[nH]ncc4c3)C2)C1	1778413324	OYNTWBSSUHWBDW-XIKOKIGWSA-N	436.310	1.432	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)CCC3CCCC3)CCO2)C1	1779031526	SVQVCKLSAYAMEC-QFIPXVFZSA-N	429.521	1.099	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccnc4c3OCO4)C2)C1	1780029222	WHGQTPRIEHWDND-MSOLQXFVSA-N	430.288	1.490	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(=O)nc3cccnn13)C2	1780705666	FGVVHJBVDMSCAS-CMPZQBNXSA-N	447.923	1.234	50	20	IDGD	
C=CCNC(=O)/C=C\C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Br)C1	1780770456	OGRFJMKHKUKREY-MDWWKSDDSA-N	446.317	1.049	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1cscn1)C2)[C@@H](F)Br	1780771257	HQPVHUBRSTUTLM-XNRPHZJLSA-N	434.331	1.890	50	20	IDGD	
O=C(CCOc1ccccc1)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781328738	XWACQOJZHROOHL-WMZOPIPTSA-N	429.286	1.976	50	20	IDGD	
O=C(C#CC1(O)CCCCC1)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781331580	NHQGCXUQLAHWAA-CRAIPNDOSA-N	431.302	1.205	50	20	IDGD	
O=C(CSc1ncccn1)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781332118	ZVNDWRVUJRISRH-WFASDCNBSA-N	433.303	1.089	50	20	IDGD	
Cn1cc2cc(C(=O)N3CC[C@@]4(C3)CN(C(=O)[C@H](F)Br)CCO4)ccc2n1	1782244642	GGKRMTKOODWBQE-MAUKXSAKSA-N	439.285	1.707	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)n2cncn2)C1	1782534311	XYFAADIOXKWUAM-SZOQZIPDSA-N	428.331	1.136	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cnc(N(C)C)o3)CCO2)C1	1783342470	ADXSCEDBAUSCBV-YVEFUNNKSA-N	429.315	1.358	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)Cc3cccnc3Cl)CCO2)C1	1783530520	ZZWDVGAPKWTOBU-PXAZEXFGSA-N	430.730	1.891	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(N(C)C)cn3)CCO2)C1	1783532299	LROHLLPWDAXCQM-FZKQIMNGSA-N	425.327	1.375	50	20	IDGD	
CCc1nn(C)c(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](C)Br)C3)C2)c1Cl	1783532989	VTQJCDGUFWVPGE-APPDUMDISA-N	447.761	1.863	50	20	IDGD	
O=C(Cc1ccc(Cl)c(F)c1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21	1783814499	SABRJUIBDCPJKN-CLROSIBMSA-N	433.307	1.601	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)COc3ccc(OC)cc3)CCO2)C1	1783869651	QKXRXDXNAPNSGA-YLJYHZDGSA-N	426.897	1.158	50	20	IDGD	
COc1ccc([C@H](C)C(=O)N2CCO[C@@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc1	1783933002	OGJCRXHZQQYMOM-GAJHUEQPSA-N	446.548	1.002	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc(OCF)cn3)[C@H]2C1	1785685876	JXBNXKWBOIUSJH-YDHLFZDLSA-N	428.892	1.641	50	20	IDGD	
CCOC(=O)/C=C/C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)CBr)C[C@@H]21	1786372280	PPNRHLRNIUCHKG-KHEBKASOSA-N	431.327	1.116	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3cncnc3)[C@H]2C1	1787043762	QYVZFYCFGNRRSL-IUVQAAGXSA-N	429.348	1.625	50	20	IDGD	
Cc1cc(C(=O)Nc2ccc(C3(NC(=O)c4cccc(B(O)O)c4)CCC3)cc2)nn1C	1787357071	RMAJAIOIZHXXNT-UHFFFAOYSA-N	432.289	1.470	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cc(F)ccc3[N+](=O)[O-])C[C@@H]21)[C@H](F)Cl	1787451307	GUKBVTISSYNSHU-MSMFTSAESA-N	431.823	1.791	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)c1csc(C(F)(F)F)n1	1789022227	YVJBVEBGNJJYNK-XPXLGCRWSA-N	441.859	1.355	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(Cl)ncn3)C[C@@H]21	1789870471	IMBCOTKBAAQMHH-BTIUKSQHSA-N	435.739	1.960	50	20	IDGD	
Cc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](O)CCl)C[C@@H]32)cc(C)c1C(=O)O	1790317532	PIMFOEWQAJEAKQ-HJWJTTGWSA-N	438.908	1.195	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnn4c3OCCC4)C[C@@H]21	1791061625	ZRRQCMFFTMUUJB-JURCDPSOSA-N	441.326	1.042	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc4ccccc4n3)C[C@@H]21	1791254945	XIFRFXMRSOPSPX-XLPNERPQSA-N	432.908	1.477	50	20	IDGD	
CSCC[C@@H](O)C(=O)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1	1791615672	AFDJHFYMRNCYAI-LJQANCHMSA-N	442.346	1.228	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(F)nc1F	1792418459	FTDCYGSUAKKLKW-BTSNSQKGSA-N	444.442	1.746	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1CCN(C)CC1	1792632023	NDHGBNRSFLGSKK-XMYAHUOOSA-N	428.537	1.100	50	20	IDGD	
CN(C)c1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](O)CCl)c2ccccc12	1792978544	ZUSNZXDZTHXMNA-YQMDMEMYSA-N	445.947	1.709	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCl)[C@@H]1CC(=O)N(Cc2cccs2)C1	1793110556	KVKHLNOCVHEFSX-OWVAZHOYSA-N	439.965	1.335	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c(c1)NC(=O)CO3)C2	1793449313	TUUUSJRNCYBCAK-NXEZDXNNSA-N	435.908	1.628	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CCC[C@H](C(=O)OC)C1)C2	1793453434	ZPUWINAAODZQJE-WJWMFLMHSA-N	428.957	1.963	50	20	IDGD	
CN1Cc2ccccc2C[C@@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(C)(C)CCl)C2	1793824095	BCAKLDPZSOLLSO-IYWMVGAKSA-N	433.980	1.898	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2c[nH]nc2c1	1796165377	AFSKFMUFGCXDJS-FIUQPQMISA-N	435.322	1.797	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1n[nH]c3cc(Cl)ccc13)C2)[C@H](F)Cl	1796367403	HVOHKBMPJOLPGX-HPQBHAKGSA-N	429.279	1.883	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](COC)NC(=O)OC(C)(C)C	1796394081	FXOZJIXBADZSEF-DGADGQDISA-N	447.960	1.133	50	20	IDGD	
COc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Br)c(F)c1	1799348180	BKYAWEQXLYEUGR-OWLDWWDNSA-N	433.249	1.728	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnn2c1OCCC2	1799937635	LJRJAMNRRKWGMD-NEBZKDRISA-N	441.326	1.042	50	20	IDGD	
CN(C)CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](Br)Cc1ccccc1	1800435493	ISDOOKOJCCRBNP-ZMMAXQRCSA-N	438.366	1.144	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1cnccn1)C2	1800644398	RWTDPQFZTDVKHA-YXPYIKCWSA-N	425.327	1.172	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](O)c1ccccc1Cl	1801200458	UERAKZDMSDKNSV-RWNPNPFLSA-N	445.741	1.746	50	20	IDGD	
COc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)C(Cl)Cl)C3)ccc1[N+](=O)[O-]	1801838993	LYCRHOHFKJKHIK-GNXNZQSNSA-N	432.260	1.610	50	20	IDGD	
CCOc1ncccc1C(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1	1802314114	PZUMVGNVOIYIRO-JQHSSLGASA-N	432.908	1.795	50	20	IDGD	
CC1(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)CCCC1	1802620642	RPFSFYRZCCXGML-PZJWPPBQSA-N	435.333	1.661	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)Cn2cnc3ccccc32)[C@H]1c1cccnc1)[C@@H](O)CCl	1803146768	PZYHQAJJHOHIPG-LRQRDZAKSA-N	441.919	1.737	50	20	IDGD	
Cc1ccc(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)o1	1803778537	BYAFDVOMCUWVDA-NQIIRXRSSA-N	433.273	1.296	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)COC(C)(C)C)[C@@H]1c1cccnc1	1804085325	SRQKPHHSCLTFMV-UTKZUKDTSA-N	433.553	1.276	50	20	IDGD	
CCS(=O)(=O)CC(=O)N1CCC2(CCCN(C(=O)[C@@H](C)CBr)C2)CC1	1805384234	UVQWTXXNKQGNIK-AWEZNQCLSA-N	437.400	1.683	50	20	IDGD	
COc1cnc(C(=O)N2CC[C@@H](CNC(=O)CCBr)[C@@H]2c2cccnc2)cn1	1806339689	QKGFJSDKDQDGAS-KSSFIOAISA-N	448.321	1.985	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)[C@@H]2CCC(=O)N2)[C@@H]1c1cccnc1	1806638621	BLOMHALAVBYELF-JKQORVJESA-N	437.338	1.540	50	20	IDGD	
O=C1CC[C@@H](C(=O)NC[C@@H]2CCN(C(=O)[C@@H](F)Br)[C@@H]2c2cccnc2)N1	1806641571	OYMTZNFPSNQDBB-DDHJSBNISA-N	427.274	1.057	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC2(CCCN(C(=O)C(=O)c3ccco3)C2)CC1	1806830806	SMNQFJWDMATWNF-UHFFFAOYSA-N	439.472	1.006	50	20	IDGD	
O=C(CN1CCOCC1)NC[C@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1	1806903619	GBGYIGBQRFITNM-APWZRJJASA-N	439.354	1.205	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@H](CNC(=O)CN2CCCC2=O)[C@H]1c1cccnc1	1806924095	PWYJQHUJODYDIP-LAUBAEHRSA-N	432.597	1.561	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@H]1CCN(C(=O)c2ccnnc2O)[C@H]1c1cccnc1	1810543626	DADAUVDRKSEVAQ-QAPCUYQASA-N	429.553	1.748	50	20	IDGD	
Cc1noc(CC(=O)N2CC[C@H](CNC(=O)[C@H](C)Br)[C@H]2c2cccnc2)n1	1812865369	XCRVNKDMRCCIFC-FABXCBLPSA-N	436.310	1.805	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)CC(F)(F)C(=O)O)[C@@H]1c1cccnc1	1813031099	OAQKRKSPNQDLAW-VNHYZAJKSA-N	433.839	1.451	50	20	IDGD	
CCc1cc(C(=O)N2CC[C@H](CNC(=O)[C@@H](Cl)COC)[C@H]2c2cccnc2)n(C)n1	1813033017	YWYDPQKYJJNBDC-HHXXYDBFSA-N	433.940	1.951	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)c2n[nH]cc2[N+](=O)[O-])[C@H]1c1cccnc1)C(Cl)Cl	1813079242	WPIUCLMMNZOUNW-MFKMUULPSA-N	427.248	1.836	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)[C@@H]2C[C@@]2(F)Cl)[C@@H]1c1cccnc1	1813159612	NPKNGEAEPJEQPE-QIJLZVCCSA-N	439.919	1.385	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H](CNC(=O)CSc2nc[nH]n2)[C@@H]1c1cccnc1	1813346237	CKVVGIGWYXWATK-QAPCUYQASA-N	448.625	1.849	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cncs2)n[nH]1	1816583105	SSEHKLCIXUSNOO-CQSZACIVSA-N	440.489	1.484	50	20	IDGD	
Cc1ccnc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)c1	1817471600	JXYPSWNMEZLEQM-IBGZPJMESA-N	433.277	1.413	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](F)Br)[nH]n1	1818124952	WQJWAZHLHGDGCC-GAJTVXKRSA-N	432.294	1.959	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)CN2CCOC2=O)[nH]n1)[C@@H](F)Br	1820932204	YWRMDMYUTCIKEC-ZWNOBZJWSA-N	432.250	1.545	50	20	IDGD	
C[C@H](C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](F)Br)n[nH]1)n1ccnn1	1820936398	BQWFWSWKCIEROY-CDMKHQONSA-N	428.266	1.945	50	20	IDGD	
CCNC(=S)NCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](F)Br)[nH]n1	1821644518	OMZRUSWGZPCDDP-GWCFXTLKSA-N	449.350	1.576	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(C(=O)O)ncn2)[nH]n1	1822367837	SUDPLWOHACJHTC-YGRLFVJLSA-N	436.856	1.458	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CSc2nc[nH]n2)[nH]n1	1822374526	MQDFKLKVTQGKBR-PWSUYJOCSA-N	427.918	1.566	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)C2=CCCS2)CC1	1824567388	UQSBKHXMVRTSRL-SFHVURJKSA-N	443.573	1.939	50	20	IDGD	
CC(C)(C)OCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1	1824893598	IAJNWMMJRKEBQK-HXUWFJFHSA-N	430.354	1.415	50	20	IDGD	
COc1cnc(C(=O)N[C@H]2CCc3nc(NC(=O)[C@@H](C)Br)sc3C2)cn1	1825636992	PFAVINJFDVZHJB-BDAKNGLRSA-N	440.323	1.951	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1nccnc1OC)CC2	1825994147	QQPFUPZNOKFAMF-NXEZZACHSA-N	425.898	1.421	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc3c(c1)CNC3=O)CC2	1826000229	OTZKQEKAFQFOHR-TZMCWYRMSA-N	448.932	1.866	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)N1CCC([C@H]2CCCCN2C(=O)CCBr)CC1	1826357345	WWPOFVLJJAMDNM-LSDHHAIUSA-N	431.375	1.838	50	20	IDGD	
CC(C)O[C@H](C)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827052266	RREDLNMFKDYGSF-DYESRHJHSA-N	430.354	1.413	50	20	IDGD	
Cc1nnsc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1	1827816737	QZQCGLMFXCJMQV-SFHVURJKSA-N	442.350	1.073	50	20	IDGD	
O=C(N[C@@H]1CCc2nc(NC(=O)[C@@H]3CCCSC3)sc2C1)c1ccc(B(O)O)cc1	1828153887	ZZZYRDYEHDXSME-UKRRQHHQSA-N	445.375	1.192	50	20	IDGD	
Cc1cc(CC(=O)N2CCC([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)nn1C	1831870387	BDAFRUPGEXBBBB-HXUWFJFHSA-N	446.596	1.264	50	20	IDGD	
O=C([C@H](F)Br)N1CCC([C@@H]2CCCCN2C(=O)CCn2cncn2)CC1	1832119362	ICDLITPEMGUFAZ-HOCLYGCPSA-N	430.322	1.978	50	20	IDGD	
C[C@@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1)n1cccn1	1832235881	JOOIYUUVWIDBKM-UWJYYQICSA-N	438.337	1.057	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3c(F)ccnc3Cl)CCO2)C1	1833252911	AOSMUJKGMBTUOC-KZULUSFZSA-N	434.295	1.962	50	20	IDGD	
C[C@@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1833264866	MLNAYERZVFLNOD-WFASDCNBSA-N	438.794	1.189	50	20	IDGD	
CC(C)c1nc(C(=O)N2CCC(N3CCC(NC(=O)[C@H](O)CCl)CC3)CC2)co1	1833308621	XWVOVUMTCPWUSX-QGZVFWFLSA-N	426.945	1.583	50	20	IDGD	
CC[C@H](C)[C@H](O)C(=O)NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1	1833496458	BOQXIGSCADZIRF-KSSFIOAISA-N	432.403	1.750	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cnc(N(C)C)o3)CC2)CC1	1834096443	UKRCMIBXCYOENS-MRXNPFEDSA-N	425.961	1.943	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3nccn3C)CC2)CC1	1834271020	OVPNFLQMQUJHNC-ZDUSSCGKSA-N	426.359	1.389	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(C(C)C)on3)CCO2)C1	1834500210	GJTQXVJXQHXPCF-LIRRHRJNSA-N	429.901	1.122	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3ccc(OC)cn3)CC2)CC1	1835255828	OMPGSXQLEOFRLZ-SFHVURJKSA-N	438.956	1.529	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4ccoc4cn3)C2)C1	1837715982	UTUNGTUJSLUSMM-OAQYLSRUSA-N	447.564	1.749	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)CCc3cnn(C)c3)CC2)CC1	1837933386	SLQVPCSBYFXQLX-IBGZPJMESA-N	440.972	1.605	50	20	IDGD	
O=C(c1nc[nH]c1[N+](=O)[O-])N1CCC(OC2CCN(C(=O)C(Cl)Cl)CC2)CC1	1838093571	ZKOSCRCQZFTBBW-UHFFFAOYSA-N	434.280	1.734	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cc4n(n3)CCC4)CC2)CC1	1838341806	IOKLCGGAANEIPL-GOSISDBHSA-N	438.956	1.695	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@](C)(Cl)CCl)C3)C2)c(C)n1C	1838385728	ZHPIYPVNWFIFLD-WOJBJXKFSA-N	446.375	1.948	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cc(Cl)ncn3)CC2)CC1	1838500505	IQJCPLOGIHCRTI-OAHLLOKOSA-N	445.347	1.996	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(C)nc3OC)C2)C1	1839145854	GDGODHLJGOUKKN-JXFKEZNVSA-N	425.913	1.486	50	20	IDGD	
CC[C@H](C)[C@H](O)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2	1839150393	LDMHCOYIMDFHNY-LBTBCDHLSA-N	425.353	1.086	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc4c(c3)C(=O)CC4)CCO2)C1	1839528804	NCRDPQNMKSYKEO-XMSQKQJNSA-N	434.920	1.903	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(F)cc3F)C2)C1	1840034812	XUYXNCIWAKQFOJ-XIKOKIGWSA-N	447.276	1.818	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3ccsc3)C2)C1	1840151420	AVSKNOSYXLBVQR-VQIMIIECSA-N	430.954	1.391	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1C[C@H]1c1ccccc1)CCO2	1840288980	DZYZOLCAYYFHTP-JZJXAQOMSA-N	436.936	1.500	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)cc1	1840726586	BOQHWDNNOFPYBZ-APWZRJJASA-N	427.860	1.249	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC12CN(C(=O)c1nc(O)n3c1CCCC3)C2	1841287868	LWFNSRJNITWYDG-GFCCVEGCSA-N	425.327	1.773	50	20	IDGD	
CC[C@H](C)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1	1841352940	VSZXRIUBOZKWIW-RRFJBIMHSA-N	431.961	1.729	50	20	IDGD	
O=C([C@@H](F)Br)N1CC2(CCCN2C(=O)CCn2c(=O)oc3ccccc32)C1	1841988179	FHCZMZNLEVWWNO-OAHLLOKOSA-N	440.269	1.879	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC2(CCCN2C(=O)CN2CCOCC2)C1	1842826661	OYUUDSMBGMTFGJ-LICLKQGHSA-N	430.455	1.407	50	20	IDGD	
CC[C@H](C)[C@H](N)C(=O)N1CCCC12CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2	1842894244	LGCXIHPBKVXXFS-UGSOOPFHSA-N	432.477	1.711	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@](C)(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](O)CCl)C1	1847568505	XSFAVAMSTGVZDJ-VCAMNPENSA-N	443.972	1.825	50	20	IDGD	
Cc1nc(COc2ccc(Cl)cc2)sc1C(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1	10213903	YSTIJBWMQROTQS-NSHDSACASA-N	443.934	1.880	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(C(=O)OCC(=O)NNC(=O)c2ccccc2)ccc1Cl	11109054	AQSUYTZXHGJNRR-UHFFFAOYSA-N	439.877	1.208	50	20	IDGD	
CCN1C(=O)C(=CNNC(=O)CSc2nc3ccccc3s2)C(=O)N(CC)C1=S	13015687	KJTKZFQOFKBMLA-UHFFFAOYSA-N	449.583	1.889	50	20	IDGD	
C#CCNS(=O)(=O)c1ccc(C(=O)NNC(=O)CSc2ccc(Cl)cc2)cc1	26772553	NAYYMYAGOBQZRZ-UHFFFAOYSA-N	437.930	1.805	50	20	IDGD	
O=C(N[C@@H](C(=O)NNC(=O)c1n[nH]c(=O)c2ccccc12)c1ccccc1)c1ccccc1	27077623	LUEOJCQBMMIFPS-LJQANCHMSA-N	441.447	1.855	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)NCc1cc(Br)c2c(c1)OCO2	725870708	OXKDBKXINRHKLG-UHFFFAOYSA-N	439.222	1.031	50	20	IDGD	
C[C@H](C(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1)N1C(=O)CCC1=O	727733110	XJBVVJQEGMGKQS-OXQOHEQNSA-N	434.496	1.298	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)Cc1c(C)nc2[nH]n(C)c(=O)c2c1C	730103968	LMQLFIQKFZQGQR-UHFFFAOYSA-N	427.461	1.046	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc(F)c(F)c1)NNC(=O)c1cccc2ncccc12	730225152	PVNLFVVBIBERCY-UHFFFAOYSA-N	434.424	1.643	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)CNC(=O)c1c(Cl)cccc1[N+](=O)[O-]	731050055	CHBUYPUAHWSNOM-UHFFFAOYSA-N	435.824	1.246	50	20	IDGD	
C[C@H]1CCC[C@@H](NC(=O)CN2CCN(C(=O)NNC(=O)c3ccc(C#N)cc3)CC2)C1	731223408	ZIVZQAZXXZRHSO-QFBILLFUSA-N	426.521	1.225	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)c2nnn(-c3ccc4c(c3)OCCO4)c2C)c1O	731457283	NKMKQLZZOCDUSH-UHFFFAOYSA-N	425.401	1.136	50	20	IDGD	
O=C(O)COc1ccc(C=NNC(=O)Cc2csc(N3CCOCC3)n2)cc1[N+](=O)[O-]	731559331	XTAFJHKIDPAUNW-UHFFFAOYSA-N	449.445	1.044	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Cn2cnc3sccc3c2=O)cc1Br	732036056	SSBPUYMEQFVBKD-UHFFFAOYSA-N	437.275	1.690	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Br)cc2F)CC1)NNC(=O)C1CCC1	732293284	ZWVWOUYQGGYADX-UHFFFAOYSA-N	427.318	1.653	50	20	IDGD	
C#CCOc1ccc(C(C)=NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1	733201010	NNNAHYZCOQUJOF-UHFFFAOYSA-N	441.509	1.874	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)[C@H]1CC(=O)N(c2ccc(F)cc2F)C1	734240511	PCQOUTWMFPBFMD-NSHDSACASA-N	441.435	1.173	50	20	IDGD	
Cc1nc(-c2cnn(C)c2)sc1C(=O)NNC(=O)c1sc(N2CCOCC2)nc1C	734418666	FQGOWHUYBWAXGM-UHFFFAOYSA-N	447.546	1.528	50	20	IDGD	
CCCn1c(CCC(=O)NNc2ccc(Cl)nn2)nc2cc(S(N)(=O)=O)ccc21	735686897	KOQKQZSGTIXKTC-UHFFFAOYSA-N	437.913	1.613	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccccc2CNC(=O)NNc2c(F)cccc2F)CC1	735756802	CCVLXSDSOIHZHK-UHFFFAOYSA-N	439.488	1.727	50	20	IDGD	
CN(CC1CC1)S(=O)(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	737755478	AXLBRURHALLXAV-UHFFFAOYSA-N	444.560	1.370	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC(C(=O)NNc3ccnc(N(C)C)n3)CC2)c(C)c1	740107918	QEUZCHFRBBXPSS-UHFFFAOYSA-N	432.550	1.703	50	20	IDGD	
Cc1cc(N2CCCS2(=O)=O)ccc1C(=O)NNC(=O)c1c(C)nc2ccccn12	741661176	AVVUAMHZZAODPC-UHFFFAOYSA-N	427.486	1.566	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@H]2CCCN(C(=O)c3ccncc3)C2)cc(OC)c1OC	741882540	SQFUXTPOHPJAML-HNNXBMFYSA-N	442.472	1.421	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)[C@H]1CCCN(c2ncnc3sccc23)C1	742470109	OLZHIBUHWNCENW-GUYCJALGSA-N	439.497	1.895	50	20	IDGD	
C[C@H]1Cc2ccccc2N1CCNC(=O)NNC(=O)c1csc(N2CCOCC2)n1	744277703	FMNSXUWEXRCQFE-AWEZNQCLSA-N	430.534	1.375	50	20	IDGD	
C[C@H](C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1)N1CCc2ccccc21	744620895	QKGKBFHYRMADIU-MRXNPFEDSA-N	430.530	1.602	50	20	IDGD	
CO[C@]1(C)C[C@@H](NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)C1(C)C	745930372	DCZWODBUVGLPJY-OXQOHEQNSA-N	438.550	1.619	50	20	IDGD	
CCCCN1C(=O)CC[C@@H](C(=O)NNC(=O)N2CCOCC2)[C@@H]1c1ccc(OC)cc1	745988316	XMWRSMOMEVOXEF-QUCCMNQESA-N	432.521	1.848	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N1CCC2(CC1)OCCO2	746512095	IZYFKDAXPOLIQY-LBPRGKRZSA-N	428.283	1.796	50	20	IDGD	
CCn1c(NNC(=O)c2cnn(CC(=O)NC3CCCCC3)c2)nc2ccccc2c1=O	746583628	LDBGTFPVFWSJCS-UHFFFAOYSA-N	437.504	1.819	50	20	IDGD	
Cc1ccc(-c2nnc(S)n2CCC(=O)NNC(=O)Cc2cn3ccccc3n2)cc1	746640713	IHPXAVINCFTVDW-UHFFFAOYSA-N	435.513	1.970	50	20	IDGD	
CS(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)c2ccc(Cl)cc2F)c(F)c1	747617276	BQTOADIAVSBWHZ-UHFFFAOYSA-N	439.849	1.613	50	20	IDGD	
CN1C(=O)C(=CNNC(=O)[C@H]2Cc3ccccc3CN2Cc2ccccc2)C(=O)N(C)C1=O	747900588	PICSSLCWNYYURX-HXUWFJFHSA-N	447.495	1.169	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)Cc2coc3cc(F)ccc23)ccc1Cl	748287913	VDNUDXRKGCNTTM-UHFFFAOYSA-N	425.825	1.876	50	20	IDGD	
O=C(CN1C(=O)[C@@H]2[C@@H](C1=O)[C@H]1C=C[C@H]2C1)NNc1nc(-c2ccccn2)nc2c1CCC2	748338760	HOIGDDIYUZTMDN-OYUDYFSCSA-N	430.468	1.278	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@H]2CC(=O)N(c3cn[nH]c3)C2)ccc1OCCC(C)C	748527553	VZQXIQNQXPIDDK-HNNXBMFYSA-N	429.477	1.657	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)[C@@H]1CCCN(C(=O)c2ccc(Cl)cc2)C1	751211128	MNUCWWAIAWMSSL-CQSZACIVSA-N	448.932	1.831	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2c(C)nn(Cc3ccccc3)c2C)n1	752858738	KWWODCVUDNYWKP-UHFFFAOYSA-N	441.513	1.860	50	20	IDGD	
O=C(O)c1ccc(S(=O)(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1C(F)(F)F	754740922	MXPKIDSXWBZUCA-AWEZNQCLSA-N	446.359	1.553	50	20	IDGD	
O=C(Cc1ccccn1)NNC(=O)Nc1ccc(S(=O)(=O)NC2=NCCCCC2)cc1	755498892	GNSRYHGUVINDCX-UHFFFAOYSA-N	444.517	1.728	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)Nc1ccc(C(=O)NCC(F)(F)F)cc1	755690170	FCKPHFULVHLPNX-HNNXBMFYSA-N	438.362	1.971	50	20	IDGD	
Cc1ccc(NC(=O)c2ccccc2)cc1NC(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1	755912595	GCUAPHDOOPQSCX-HNNXBMFYSA-N	430.486	1.835	50	20	IDGD	
O=C(NNC(=O)N1CCC[C@@H]1Cn1cnc2ccccc21)c1ccc(-n2cnnn2)cc1	756051171	SCAXEXMFNBAHAH-QGZVFWFLSA-N	431.460	1.531	50	20	IDGD	
COc1ccc(C(=O)N2CCOCC2)cc1NC(=O)NNC(=O)c1ccc(C)cc1O	756257226	NGHXXFBORWTBQA-UHFFFAOYSA-N	428.445	1.648	50	20	IDGD	
O=C(NNC(=O)C(F)(F)c1nccs1)c1cccc(S(=O)(=O)N2CCCC2)c1	756446274	OQVZSULASPTUID-UHFFFAOYSA-N	430.458	1.481	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)Nc1cc(S(=O)(=O)N(C)C)ccc1F	756683248	KZZDYGWPPXBDCV-LLVKDONJSA-N	442.444	1.835	50	20	IDGD	
CCc1ccccc1NC(=O)CN(C)CC(=O)NNC(=O)c1ccc(OC)c(OC)c1	756764264	DRRNERMWNOJEGY-UHFFFAOYSA-N	428.489	1.598	50	20	IDGD	
CCOc1cc(C(=O)N(C)C)ccc1NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	756869160	PLUAIOXJZYYMJR-UHFFFAOYSA-N	438.448	1.229	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)c1ccc(Oc2ccc(C(F)(F)F)cn2)cc1	758035332	KYUSTUJMLOVZBO-SNVBAGLBSA-N	446.407	1.591	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccccn2)cc1S(=O)(=O)NC1CCCC1	758846410	NRFAZXPNHCJGMV-UHFFFAOYSA-N	445.501	1.011	50	20	IDGD	
CCS(=O)(=O)c1cc(F)ccc1NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	760013951	KATHHMKEZXNPDD-UHFFFAOYSA-N	433.425	1.062	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)c1nc(-c2ccccc2)no1	760330802	DALSNFQUBXNNQK-ZDUSSCGKSA-N	443.485	1.888	50	20	IDGD	
CCC(=O)NNC(=O)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C)[C@@H]2C[C@H]3CC[C@H]2C3)cc1	763441564	XJXSLPBLWZTQGG-FHIRATQRSA-N	436.534	1.286	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)NCc1ccc(N2CCOCC2)cc1	763478740	YCCQONSDTVGODS-UHFFFAOYSA-N	435.525	1.659	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)N[C@H]1CCCC[C@@H]1N1CCOCC1	763526765	PAWXOACMVIENKR-HOTGVXAUSA-N	427.546	1.265	50	20	IDGD	
CC(C)(C)[S@](=O)Cc1cccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)c1	763557350	AMQNQEBUQMZMIB-WJOKGBTCSA-N	445.497	1.862	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)N1CCc2c1cccc2C(F)(F)F	763570604	GVYIXOUGGIFFIL-INIZCTEOSA-N	435.358	1.582	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(CCC(=O)N3CCCC3)cc2)c(C)o1	763585961	JNDZYFCWBVUSBJ-UHFFFAOYSA-N	426.473	1.851	50	20	IDGD	
Cc1ccc(Cn2nccc2NC(=O)C(=O)NNC(=O)c2c(C)nc3ccccn23)s1	763630328	YINVVZJYKVCNQU-UHFFFAOYSA-N	437.485	1.657	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(N3CCOCC3)c(F)c2)c1	763760390	LWCYIIYVQNOEIT-UHFFFAOYSA-N	429.452	1.128	50	20	IDGD	
COCCn1ncc2ccc(NC(=O)C(=O)NNC(=O)c3cc4c(s3)CCC4)cc21	763782812	VZROWRUCDAWXJM-UHFFFAOYSA-N	427.486	1.633	50	20	IDGD	
Cc1cc(Br)ncc1NC(=O)C(=O)NNC(=O)COc1ccccc1C#N	763813285	JUFYHPBIGUTOSX-UHFFFAOYSA-N	432.234	1.189	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(Oc2ccncc2)cc1	763813360	LNIFKOCJWINEST-UHFFFAOYSA-N	431.408	1.910	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccccc2OCCC(N)=O)c1C	763850844	BAXDEYSSDNLQQP-HNNXBMFYSA-N	442.472	1.111	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)cc1	763859482	CGSRZTAYYNIIFM-GFCCVEGCSA-N	446.416	1.556	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)n(-c2ccccc2)n1	763870572	ARGDZMQJRVHERC-AWEZNQCLSA-N	425.420	1.873	50	20	IDGD	
COC(=O)[C@H](C)Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)cc1	763872277	MANDZUYYIDTCHB-ZIAGYGMSSA-N	445.447	1.731	50	20	IDGD	
NC(=O)c1cc(NC(=O)C(=O)NNC(=O)CCSc2ccc(F)cc2)ccc1Cl	763894954	ICZJPKBRKGEITL-UHFFFAOYSA-N	438.868	1.846	50	20	IDGD	
O=C(Cc1ccsc1)NNC(=O)C(=O)Nc1ccc(S(=O)(=O)C2CCCC2)cc1	764032768	ABTXZZCIWROGLU-UHFFFAOYSA-N	435.527	1.793	50	20	IDGD	
COC(=O)NCc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(C(F)(F)F)c2)cc1	764037516	MSSNMFRPFMVBII-UHFFFAOYSA-N	438.362	1.961	50	20	IDGD	
CC(=O)Nc1cc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(C)cc3)[nH]n2)ccc1F	764111911	SRVWLGHOZPZFHX-UHFFFAOYSA-N	438.419	1.882	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccc(N2CCOCC2)cc1C	764131502	HZGOFQKKQICNEG-UHFFFAOYSA-N	426.473	1.169	50	20	IDGD	
C[C@H](C(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)CCc2ccccc2)cc1)n1cncn1	764187132	CWDZSZWTVLYMEP-OAHLLOKOSA-N	449.471	1.197	50	20	IDGD	
CC(=O)Nc1cc(NC(=O)C(=O)NNC(=O)c2cccc(OC(F)F)c2)c(F)cc1F	764259142	DCROOIJYUIOZQB-UHFFFAOYSA-N	442.325	1.924	50	20	IDGD	
CCOCC(=O)NNC(=O)C(=O)Nc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(C(F)(F)F)c1	764325306	IRSFFMJPEQGECC-RYUDHWBXSA-N	446.426	1.441	50	20	IDGD	
CN(C)CCOc1cccc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c1	764342710	ISLKXBXKTMBEHW-UHFFFAOYSA-N	436.472	1.212	50	20	IDGD	
CCOc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NNC(=O)CCCc1cccs1	764343061	MYDSDYXWLSRQJD-UHFFFAOYSA-N	446.529	1.957	50	20	IDGD	
Cc1cnn([C@@H]2CCCc3ccccc32)c1NC(=O)C(=O)NNC(=O)Cc1ccncc1	764352744	CRVQTDWKEPUDRM-LJQANCHMSA-N	432.484	1.841	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2cccs2)[nH]n1)C(=O)Nc1ccc(O[C@H]2CCOC2)cc1	764382385	JBEPWHHYYSNCFQ-AWEZNQCLSA-N	441.469	1.706	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)C(=O)Nc1cnn(-c2cccc(C(F)(F)F)c2)c1	764388243	FNNQQDVDJQDOKK-UHFFFAOYSA-N	432.362	1.994	50	20	IDGD	
COCCn1nc(C)c(NC(=O)C(=O)NNC(=O)CSc2ccccc2OC)c1C	764394581	RZRKAKGAOPKBHC-UHFFFAOYSA-N	435.506	1.033	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1cccc(NC(=O)C2CCCCC2)c1	764398969	IYGNLXZMYXMMCK-CQSZACIVSA-N	434.493	1.343	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@H](C)C(=O)NNC(=O)[C@H](C)S(=O)(=O)C1CCOCC1	764561866	ACTOUBOUXUAHED-KGLIPLIRSA-N	446.953	1.854	50	20	IDGD	
C[C@@H]1CN(CCCNC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)CCCO1	764587709	SBJCSWOOPARJKM-HXUWFJFHSA-N	446.596	1.030	50	20	IDGD	
CCn1c(SCC(=O)NN=Cc2c(N)ncnc2OC)nnc1-c1ccc(OC)cc1	764742656	HXDHBDKRNOGITP-UHFFFAOYSA-N	442.505	1.597	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCC1(N2CCOCC2)CC1	764756857	IMCWXTYXCZNBMZ-CYBMUJFWSA-N	441.326	1.412	50	20	IDGD	
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	765316495	SUGGWACXMMLBQH-DNVCBOLYSA-N	445.545	1.946	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)OC(C)(C)C)cc1NC(=O)CN1CCCCC1	765392625	YOOWYEMAVDZCNS-UHFFFAOYSA-N	433.509	1.914	50	20	IDGD	
CC(C)CCNS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)OC(C)(C)C)cc1	765394112	XOFYEBQKRSVOGD-UHFFFAOYSA-N	428.511	1.505	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cc(-c3ccccc3OC)[nH]n2)ccc1OCC(N)=O	765592567	OTZHGMQWILHQDU-UHFFFAOYSA-N	439.428	1.033	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1cc(-c2ccccc2)no1	766640959	CLFSIQGDNFCSQD-UHFFFAOYSA-N	433.468	1.561	50	20	IDGD	
COCCOc1ccccc1C(=O)NNC(=O)CN1CCN(Cc2ccc(C)cc2)CC1	766641662	KLZSYORNONUUCC-UHFFFAOYSA-N	440.544	1.599	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@@H]2CCO[C@@]3(CCSC3)C2)c2ccccc2c1=O	769235879	RLMAUMPGADJGND-XCLFUZPHSA-N	431.518	1.415	50	20	IDGD	
CNS(=O)(=O)c1ccc(C(=O)NNC(=O)NCc2cccc(C(F)(F)F)c2)cn1	770221298	AKBDVAWCKGYVLM-UHFFFAOYSA-N	431.396	1.153	50	20	IDGD	
Cc1cccc([C@@H](CNC(=O)NNc2nc(O)c3cnn(C)c3n2)N2CCOCC2)c1	770342686	VLWAYADGXLXIMV-MRXNPFEDSA-N	426.481	1.077	50	20	IDGD	
C[C@@H]1CN(C(=O)NNC(=O)c2ccc3ccccc3c2)CCN1c1nccn2cnnc12	771201571	KVAMGUIEWYXBNI-OAHLLOKOSA-N	430.472	1.843	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)c1c[nH]c2ccc(I)cc2c1=O	771605495	CHKQROJESJLKCY-UHFFFAOYSA-N	436.209	1.546	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)CCc1nc(-c2cc(Br)cs2)no1	772044115	SLYSVGSCCKQDKH-QMMMGPOBSA-N	445.295	1.982	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(Br)c(C)n1	773526116	VEUUMEKVMVMQOV-UHFFFAOYSA-N	437.250	1.326	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)NC[C@H]1COC2(CCCC2)O1	773733401	JEKJWVJETWXHKM-AWEZNQCLSA-N	428.283	1.844	50	20	IDGD	
O=C1C[C@@H](Cc2ccc(NC(=O)C(=O)NNc3cccc(C(F)(F)F)c3)cc2)C(=O)N1	773763366	UPYCWJJOEGKJCS-GFCCVEGCSA-N	434.374	1.992	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)Cc2sc(N)nc2-c2ccccc2)cc1	775881495	PGQQJAMAVLZCJE-UHFFFAOYSA-N	435.465	1.811	50	20	IDGD	
Nc1nc(-c2ccc(C(=O)OCC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)cc2)cs1	775884937	XLQSBICTMRSSOS-UHFFFAOYSA-N	441.425	1.919	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cc(O)nc(CC(C)C)c2)cc1OC	777142198	JUJXBLKTINEIMH-UHFFFAOYSA-N	431.445	1.621	50	20	IDGD	
COCc1ccccc1S(=O)(=O)NNC(=O)c1ccc(CSc2nncn2C)cc1	778557202	UYNSXQVMQBOJNN-UHFFFAOYSA-N	447.542	1.877	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccnc(OC(C)C)c2)cc1	778707175	HQQOLAPYUOETCV-CQSZACIVSA-N	428.445	1.625	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)N[C@@H]2CCCN(c3ccc(C#N)cc3)C2=O)c1	780894640	RDYBEJSZXSLIBH-LJQANCHMSA-N	437.456	1.715	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)c2ccc(OC)c(-n3cnnn3)c2)cc1C	781771287	CVUZBGXDIIUVOR-UHFFFAOYSA-N	444.473	1.221	50	20	IDGD	
CC(C)C[C@H](CN(C)S(=O)(=O)CBr)NS(=O)(=O)CBr	782475471	HKBSEBBAROYMOC-SECBINFHSA-N	444.211	1.287	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ccc(-n3cccn3)nn2)c(Br)c1	783432896	HJYLGCLLKCQZEM-UHFFFAOYSA-N	432.238	1.515	50	20	IDGD	
CCOC(=O)[C@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNc2ccc(F)cc2C)cc1	783450174	ZSIQKXRWILQGPW-ZDUSSCGKSA-N	430.436	1.897	50	20	IDGD	
Cc1ccc(NNC(=O)C(=O)Nc2ccnn2Cc2ccc(Br)cc2)nn1	783949704	MTTSZHVYTNJRMZ-UHFFFAOYSA-N	430.266	1.874	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)c(F)c1	784833907	SFHLYEMIODJYFX-UHFFFAOYSA-N	445.375	1.690	50	20	IDGD	
O=C(NNc1cccnc1Cl)C(=O)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1	784839468	WNCHYQPOWRMGNR-UHFFFAOYSA-N	437.909	1.991	50	20	IDGD	
C[C@H]1CN(Cc2cccc(NC(=O)C(=O)NNc3ccnc(N(C)C)n3)c2)C[C@@H](C)O1	784969504	NCLWLWPEYOTGCK-GASCZTMLSA-N	427.509	1.234	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1cc(F)cc(Br)c1F	787542538	MRTHWKFFJQXSDZ-UHFFFAOYSA-N	444.188	1.598	50	20	IDGD	
CC(C)C[C@H](C(=O)NNc1ccccc1S(N)(=O)=O)N1C(=O)[C@@H]2CC=CC[C@H]2C1=O	788223412	JEEOBVRVIRODPN-IIAWOOMASA-N	434.518	1.143	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2nc3c(s2)CCCCCC3)cc1	789731183	BDCOLDGTVLORLD-UHFFFAOYSA-N	432.502	1.976	50	20	IDGD	
O=C(NNC(=O)c1ccn(CC(F)F)n1)c1ccc(S(=O)(=O)N2CCCC2)cc1	789869002	PRLCLJOTHZWCFS-UHFFFAOYSA-N	427.433	1.008	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1ccc(N2CCCCC2)c2ncccc12	791947133	RBLURBZKDHNSPA-CYBMUJFWSA-N	434.522	1.316	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N(CC)CC)cc1NC(=O)C(=O)NNc1ncccc1C	792378348	NXFMLOMLPCAPGT-UHFFFAOYSA-N	449.533	1.901	50	20	IDGD	
CC(=O)NC[C@H]1CCn2ncc(C(=O)NNC(=O)[C@H](C)Oc3ccc4ccccc4c3)c2C1	792736022	DYIRIIDRHGOYME-RDJZCZTQSA-N	449.511	1.963	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)NCCc3cccc(OCC(F)(F)F)c3)nc21	793480584	XSZUGXHRYNCLDC-UHFFFAOYSA-N	425.371	1.879	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1cc(C2CC2)cnc1Cl	793683155	REZQRSVMHDJDGO-UHFFFAOYSA-N	441.919	1.831	50	20	IDGD	
CC(C)c1occc1C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	794863721	WCPYNRJCNUZLBR-UHFFFAOYSA-N	449.529	1.818	50	20	IDGD	
Cn1cc(-c2cc(F)ccc2NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)cn1	796989263	CPXACQZNGIWASW-UHFFFAOYSA-N	436.403	1.263	50	20	IDGD	
COC(=O)c1cc(F)c(Br)cc1NC(=O)C(=O)NNc1ccnc(F)c1	797088369	XONZVSHACYXQSZ-UHFFFAOYSA-N	429.177	1.991	50	20	IDGD	
CCOc1cc(C)ccc1NC(=O)C(=O)NNC(=O)CNC(=O)OCc1ccccc1	797368993	LGSUCLISMZXNKM-UHFFFAOYSA-N	428.445	1.406	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)Nc1ccc(S(=O)(=O)N(C)C)cn1	797654115	SXQDDZUZGRXHII-NSHDSACASA-N	425.442	1.091	50	20	IDGD	
Cc1nn(C(C)C)cc1C=NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	799104390	PQOAIUUSILSXEY-UHFFFAOYSA-N	447.561	1.876	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)Nc1cnc(N2CCOCC2)c(Br)c1	799249093	LNFSBIZGEFSILC-UHFFFAOYSA-N	435.282	1.471	50	20	IDGD	
Cc1cc(O[C@@H]2CCN(C)C2=O)ccc1NC(=O)C(=O)NNc1cccc([N+](=O)[O-])c1C	799261829	DGBYENCMXKXMGM-GOSISDBHSA-N	441.444	1.903	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)N1CCOc2ccc(Br)cc2C1	801749252	UIJJAJFMHAIBTD-UHFFFAOYSA-N	437.250	1.407	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@@H]2CC(c3ccccc3[N+](=O)[O-])=NO2)cc1	802068131	BFRFTAWZVPOUAN-INIZCTEOSA-N	447.429	1.344	50	20	IDGD	
COC(=O)c1c(F)cc(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)cc1F	802566613	XXDAPFRMROTROF-UHFFFAOYSA-N	425.319	1.055	50	20	IDGD	
O=C(Cc1ccccn1)NNC(=O)C(=O)Nc1ccc(Br)c2cccnc12	802567584	ZREGXHOXTPNAGE-UHFFFAOYSA-N	428.246	1.721	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)[C@@H]1CCS(=O)(=O)c2ccccc21	802945807	MILMLTDALAPUCL-CQSZACIVSA-N	425.507	1.400	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)Nc2nncn2C2CC2)cc1	803514446	AVUQFPKFZMNSCZ-XNTDXEJSSA-N	446.471	1.906	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)c2cn3ccc(Br)cc3n2)cc1	803943065	QEWYRQQJHYNWAX-UHFFFAOYSA-N	442.229	1.586	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN2CCC[C@@H](CNC(=O)C(F)(F)F)C2)cc1C	810073048	ZGGZRSWXQNCCHP-LBPRGKRZSA-N	434.484	1.770	50	20	IDGD	
Cn1nnc2c1C[C@H](C(=O)NNC(=O)[C@H]1Cc3ccccc3CN1Cc1ccccc1)CC2	810273104	IMLSALPYZDSSMU-AUSIDOKSSA-N	444.539	1.695	50	20	IDGD	
N#Cc1ncn(-c2ccccc2NC(=O)C(=O)NNC(=O)c2ccc3ccccc3c2)n1	810385273	ZGOUJQWIJJHOEM-UHFFFAOYSA-N	425.408	1.692	50	20	IDGD	
CN(C)c1cc(C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)nc2ccccc12	811324281	ZAWMMJSOJCQJLZ-UHFFFAOYSA-N	437.412	1.827	50	20	IDGD	
Cc1cc(Cl)cnc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)NC(C)C)cn1	812983499	UBTTVEHFBQFHTQ-UHFFFAOYSA-N	426.886	1.207	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)[C@@H](O)c1ccc(Cl)cc1F	813488310	SPLPRAYDLFANAO-IBGZPJMESA-N	448.882	1.118	50	20	IDGD	
CCCc1nc(C)c(CNC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)o1	813858190	BNAWIKQMEREZMP-UHFFFAOYSA-N	428.537	1.978	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1cccc(OC(F)(F)F)c1	815752033	ZCGMQZRDJNTWMT-UHFFFAOYSA-N	446.407	1.917	50	20	IDGD	
Nc1c(C(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)cnn1-c1ccccn1	815854248	UPUHWZAJWOMUOG-UHFFFAOYSA-N	426.380	1.900	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)CCCCCS(N)(=O)=O	816828684	MEPULQIZFRZJDX-NSHDSACASA-N	436.328	1.213	50	20	IDGD	
COC(=O)NNC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(Br)s2)C1	822760725	REFVMLCPFDYCIU-QMMMGPOBSA-N	426.314	1.299	50	20	IDGD	
Cc1ccc2cc(C(=O)NNC(=O)c3cccc(S(=O)(=O)N4CCOCC4)c3)[nH]c2c1	906478359	TVWVHZPOULECNK-UHFFFAOYSA-N	442.497	1.572	50	20	IDGD	
COC(=O)NNC(=O)[C@H](CCSC)NS(=O)(=O)c1ccc(Cl)c(Cl)c1	913176842	AJZYQJDNPRWIPO-NSHDSACASA-N	430.335	1.781	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NN=C2CCN(S(=O)(=O)c3c(C)n[nH]c3C)CC2)c1	914554815	UULOUFMLDMKXBQ-UHFFFAOYSA-N	433.534	1.979	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)[C@H]1CC(=O)N(CC(F)(F)F)C1	914710841	MFRNZIKAHGCTPB-VIFPVBQESA-N	438.200	1.386	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)[C@@H]2CCCN(S(=O)(=O)c3ccccc3)C2)cc1	915060811	ZFTIDFHDTJGZDD-QGZVFWFLSA-N	431.514	1.622	50	20	IDGD	
CC(C)Oc1ccc(CCNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1	915259168	IXFFTTNYBYJRFN-UHFFFAOYSA-N	433.534	1.954	50	20	IDGD	
COc1cccc(C[C@H](C(=O)NNC(=O)COc2cc(C)ccc2C)n2nnnc2C)c1	915695545	PLUSCTYFHAOXCZ-LJQANCHMSA-N	438.488	1.617	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCC2(N3CCOCC3)CCCCC2)c1	915896596	HIDWEQBJKPEWBS-UHFFFAOYSA-N	438.550	1.069	50	20	IDGD	
O=C(NCCc1ccco1)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	915906919	IGZXBFIPKSAARI-UHFFFAOYSA-N	442.497	1.945	50	20	IDGD	
CC(=O)N1CCC(NC(=O)NNC(=O)[C@@H](C)Oc2cccc(Br)c2)CC1	915931198	JZGNOQDOZPDQEA-LLVKDONJSA-N	427.299	1.558	50	20	IDGD	
O=C(NN=C1CCS(=O)(=O)c2ccccc21)c1cccc(S(=O)(=O)N2CCCC2)c1	916260860	LARVVNYYTZYOMK-UHFFFAOYSA-N	447.538	1.783	50	20	IDGD	
CCOc1cc(C=NNC(=O)[C@H](C)CN2CCOCC2)ccc1O[C@H](C)C(=O)N(C)C	916362069	ILNMAVKQCXWYKF-IAGOWNOFSA-N	434.537	1.359	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NCC[C@@](O)(c2nccn2C)C(F)(F)F)cc1C	916378645	RMNPEYFZPCBJSP-GOSISDBHSA-N	443.426	1.586	50	20	IDGD	
Cn1ccnc1[C@](O)(CCNC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)C(F)(F)F	916381296	FVYFBSQMIMPWKG-OAHLLOKOSA-N	430.343	1.113	50	20	IDGD	
CC(=O)NNC(=O)C1(c2ccccc2)CCN(S(=O)(=O)c2cccc(C(C)=O)c2)CC1	916556414	XNMDWWOOWPBRPW-UHFFFAOYSA-N	443.525	1.779	50	20	IDGD	
COc1cccc(OCC(=O)NNC(=O)c2ccc(CSc3nncn3C)cc2)c1	917021253	HOEWWSGSVTUQTP-UHFFFAOYSA-N	427.486	1.956	50	20	IDGD	
O=C(CSc1nnc(O)nc1O)NN=Cc1cc(Br)c2c(c1)OCCO2	917544579	JDSJSWPGKVDPSG-UHFFFAOYSA-N	442.251	1.059	50	20	IDGD	
Cc1cc(S(=O)(=O)NNC(=O)c2csc(N3CCOCC3)n2)ccc1OC(C)C	917723731	KQDGZQSLOAVGNF-UHFFFAOYSA-N	440.547	1.699	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNS(=O)(=O)c2ccc(O)c(C(=O)OC)c2)cc1	917724838	APBFPENWGKIFLW-LBPRGKRZSA-N	438.458	1.355	50	20	IDGD	
O=C(CCC/N=C1/NS(=O)(=O)c2ccccc21)NNC(=O)c1ccc(Cl)cc1O	918358221	LHMOIFPIJKTDCD-UHFFFAOYSA-N	436.877	1.326	50	20	IDGD	
O=C(CN1CCC(CC(=O)NC2CCCC2)CC1)NNC(=O)c1ccc([N+](=O)[O-])cc1	920089073	SZLAMAHLGXRHPI-UHFFFAOYSA-N	431.493	1.517	50	20	IDGD	
CC(C)(C)NC(=S)NNC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1	920208140	BJVAEFZRMNMVKP-LBPRGKRZSA-N	443.551	1.289	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)c2ccc(N3NC(=O)CCC3=O)cc2)cc1	920288035	LXTFWNONIUVALD-CQSZACIVSA-N	440.456	1.472	50	20	IDGD	
Cc1cc(SCC(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)c(C)cc1Br	920298908	VNXHRANHOGXUNG-SNVBAGLBSA-N	438.369	1.243	50	20	IDGD	
O=C(NCCc1cc(Br)ccc1F)NNC(=O)c1ccc(-n2cnnn2)cc1	920920796	KTIDYPIQFSIRCG-UHFFFAOYSA-N	448.256	1.751	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@H]2CCCCN2Cc2ccncc2)cc1	1116937086	USHWJLJBSMBZEJ-GOSISDBHSA-N	431.518	1.693	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)c1ccc([S@@](C)=O)cc1	1253663493	VFKYXVSRNZACRC-PSBQPLHCSA-N	438.531	1.924	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2cc(Cl)ccc2O)cc1	1317742607	UWZPMYKOHMRNAA-UHFFFAOYSA-N	427.866	1.184	50	20	IDGD	
CS(=O)(=O)c1ccc(Br)c(C(=O)NNC(=O)c2n[nH]c3c2CCCC3)c1	1318280904	BCWRVTYBVHSTBV-UHFFFAOYSA-N	441.307	1.529	50	20	IDGD	
COc1ccc(CNC(C)=O)cc1S(=O)(=O)NNC(=O)c1cncn1-c1ccccc1	1319188180	QEYPUJGJYALQRF-UHFFFAOYSA-N	443.485	1.140	50	20	IDGD	
Nc1cnnc(NNC(=O)[C@H]2CCN(c3cccc(Br)c3)C2=O)c1Cl	1319425650	VCIDTPDQNJPKMD-SNVBAGLBSA-N	425.674	1.971	50	20	IDGD	
O=C(NNC(=O)c1cccc(Br)c1)N[C@@H]1CCO[C@@]2(CCS(=O)(=O)C2)C1	1319833403	WFUUHPFYFFUKDZ-CJNGLKHVSA-N	446.323	1.129	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CCC(=O)N2CCc3cc(OC)c(OC)cc3C2)cc1	1322617975	UIJLUPDXWTZQOI-UHFFFAOYSA-N	441.484	1.839	50	20	IDGD	
C[C@H](O)CNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cccc3ccccc23)cc1	1353587431	RPIRUHWVVKPZPO-AWEZNQCLSA-N	427.482	1.574	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(O)nc(O)n2)C1	1778018595	VNOQRZUPCNCXOK-OCBCSQNSSA-N	447.319	1.252	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2)c1cccc2c1OCCO2	1778589575	MJOQCZXRNWBARJ-LUQKVYGDSA-N	438.908	1.185	50	20	IDGD	
COC(=O)[C@H]1CC[C@H](C(=O)N2CCO[C@@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)CC1	1779294609	VDWHTSHLRGEBGN-CBGDNZLLSA-N	440.613	1.647	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CCO[C@]2(CCN(C(=O)CO[Si](C)(C)C)C2)C1	1779301100	KNZASLCRFZBWRV-FVJLSDCUSA-N	438.597	1.423	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(N(C)C)nc3)C2)C1	1779764584	JWAOTESRDGOYOM-HNAYVOBHSA-N	439.354	1.765	50	20	IDGD	
O=C(c1ccncc1-c1ccccc1)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1779852947	KYUIOOLVWLFSAD-DENIHFKCSA-N	429.904	1.792	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)Cc2c(C)n[nH]c2C)C1	1780828614	NIEWWPSFLYHOCN-SQGPQFPESA-N	426.945	1.337	50	20	IDGD	
C[C@H](Nc1nccs1)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781332108	ZUYPGTSOVGWJDD-PGUXBMHVSA-N	435.319	1.464	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C=C(\C)NC(C)=O)C1	1781465062	ACFHTXPJMSMLAA-IISUWSKNSA-N	444.370	1.714	50	20	IDGD	
COc1cc(C)c(C)cc1C(=O)N1CC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1	1782097682	BTVOGFQKRXWSEV-HSZRJFAPSA-N	446.548	1.129	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CN2C(=O)CSC2=S)C1	1783245897	LEIURCPRUUZFJM-VEVIJQCQSA-N	448.010	1.378	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](C)Cn1cccn1)CCO2	1783342617	CLBRZAFODYDQOR-RVKKMQEKSA-N	427.343	1.523	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)COc3ccccc3F)CCO2)C1	1783538199	AIYKRBYINMEPFA-ACJLOTCBSA-N	429.286	1.818	50	20	IDGD	
COc1cc(F)cc(/C=C/C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)c1	1783692770	MFNVUGFVYIVMTR-YBNRNPCLSA-N	426.872	1.277	50	20	IDGD	
CCSc1cccnc1C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](Cl)COC)C2)C1	1783880408	BNQHTSILTMKKPQ-KUHUBIRLSA-N	427.954	1.891	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccnc4c(O)cccc34)CCO2)C1	1783881854	NDUGDNOGMGTWIC-IIBYNOLFSA-N	433.892	1.638	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CC[C@H]3CCOC3)C[C@@H]21	1783975037	DTGZIZRXFYGENU-WOYTXXSLSA-N	431.371	1.814	50	20	IDGD	
Cc1ccc(CCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](O)CCl)C[C@@H]32)cc1F	1784433996	VEXUYYXEVKMPOM-CAMMJAKZSA-N	426.916	1.646	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C[C@@H]3CCCCO3)[C@H]2C1	1784957195	KBFYGNPVUVDLKC-WOYTXXSLSA-N	431.371	1.956	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CNC(=O)c3cccnc3)[C@H]2C1	1785169358	MMTDAPFMNYVLPK-FJIDUMEYSA-N	436.940	1.199	50	20	IDGD	
C[C@H](CBr)C(=O)Nc1ccc(C2(NC(=O)[C@@H](N)CCC(N)=O)CCC2)cc1	1786068934	GFUUJJKKUUJVAV-DOMZBBRYSA-N	439.354	1.744	50	20	IDGD	
O=C(COc1ccc(F)cc1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21	1786489663	GQNXMRMKAUROPL-JIRONKKISA-N	447.276	1.875	50	20	IDGD	
CCc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)CBr)C[C@@H]32)n[nH]1	1787165838	CVYCYLNQDJCUGX-DUPGQFARSA-N	427.343	1.596	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)c1ccnn1-c1ccccc1	1787767912	SXNXETQUGMIHOT-CBVHJVASSA-N	432.908	1.065	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4c(c3)OCCO4)[C@H]2C1	1787813664	ORQUTLCYSOSTEQ-GGXPGOJBSA-N	438.908	1.305	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cn(C(C)(C)C)nn3)[C@H]2C1	1789356667	IUFSIOOQXWUQIS-OSFYFWSMSA-N	442.358	1.410	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CCC[C@H](C(=O)OC)C3)C[C@@H]21	1789864422	BTUWBMOUGOWDAW-QQCJEOGWSA-N	428.957	1.963	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CSc3nc[nH]n3)C[C@@H]21	1789873324	VKPCOABHKNRWOO-YWDSYVAPSA-N	436.365	1.113	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3ccccc3O)[C@H]2C1	1790900031	ISSWVHCERZJDOP-QEWYBTABSA-N	425.323	1.698	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3=NO[C@H](c4ccccc4)C3)C[C@@H]21	1791253505	BYKBIFNKEHBYRT-GCLMUHHRSA-N	449.935	1.738	50	20	IDGD	
C=C(Oc1ccccc1O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](Cl)COC)[C@H]2C1	1791254370	LIGMAHMPENQGFL-GGXPGOJBSA-N	438.908	1.518	50	20	IDGD	
Cc1ccc(C(=O)NCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]3C2)cc1	1791297867	JHJBWVDBZFWQQV-JYJNAYRXSA-N	442.343	1.508	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C#CC1(O)CCCCC1)C2	1792871451	ZFANFKYQTLXAOA-XLMAVXFVSA-N	441.366	1.306	50	20	IDGD	
C[C@@H](CBr)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](O)NC(=O)OC(C)(C)C)C2	1792990636	BSQIYQCEBFTNDS-AIUMHDJVSA-N	448.358	1.499	50	20	IDGD	
CCN1CCN(c2ccc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)[C@H](O)CCl)cc2)CC1	1793117815	GLVFVXRJRVOAEZ-GFOJFJKKSA-N	448.995	1.680	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)[C@@H]1[C@@H]2Sc3ccccc3[C@H]21	1796191454	OASZBUWTRLLVPY-WXBORZKFSA-N	448.353	1.506	50	20	IDGD	
Cc1nc2ncccn2c1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CO[Si](C)(C)C)C2	1797006064	YIMDVRMNSFHTGS-SCAQPMJSSA-N	431.569	1.092	50	20	IDGD	
Cc1cc(C(N)=O)cc(C)c1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CO[Si](C)(C)C	1797957004	WLBMYTJKLSZOGA-XEMDLRDOSA-N	447.608	1.457	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnccc1Cl	1797994267	WDLUTSOWEPZUJC-OHTBPHCPSA-N	430.730	1.969	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1c[nH]c3cnccc13)C2	1798440722	WKYJKZZXVRHPJR-BTTYYORXSA-N	433.472	1.127	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CCN1C(=O)OC(C)(C)C)C2	1799263305	JTNIDJZVCZJZMW-DGADGQDISA-N	429.945	1.603	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CNC(=O)OC(C)(C)C	1800675371	OXEKISMIZKERLR-QVHKTLOISA-N	448.358	1.274	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2	1800959266	KHMNNPUOJLIVSO-ZLCQRPCESA-N	447.301	1.022	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCBr)C3)C1	1800961921	DVGGJRHIASEMGB-WVCIDPQESA-N	445.354	1.340	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(OC)cc1Cl)C2	1800983332	YQXCNCLLHOUVCP-LZDSYCOUSA-N	431.316	1.806	50	20	IDGD	
CC[C@@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCN1C(=O)C=CC1=O)C2	1801799122	PDLCMDGSCIFNMW-XJFOESAGSA-N	426.311	1.113	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CCC(=O)N2CCCC2)[C@@H]1c1cccnc1)[C@H](O)CCl	1803136323	PAKCBNGHXLUGIN-SQGPQFPESA-N	436.940	1.090	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@H](CNC(=O)CN2CCOC2=O)[C@@H]1c1cccnc1	1803337169	NCBAPFLAKOHCQU-QOKNQOGYSA-N	443.331	1.776	50	20	IDGD	
COc1cccc(CCC(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@H]2c2cccnc2)n1	1804430122	NFSJCAFTSJOCEP-CDXJDZJCSA-N	446.935	1.724	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2cccc(=O)n2C)[C@@H]1c1cccnc1	1805314668	BXVNGFANAOLYNK-GJYPPUQNSA-N	432.908	1.354	50	20	IDGD	
COC(=O)CSCC(=O)N1CCCC2(CCN(C(=O)[C@@H](C)Br)CC2)C1	1806038232	SPWKIWRPWQGUDF-CYBMUJFWSA-N	435.384	1.907	50	20	IDGD	
C[C@@H](CN)C(=O)N1CCC2(CCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)CC1	1806756928	QBLJJCLQOPNZHX-HOTGVXAUSA-N	445.004	1.945	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H](CNC(=O)[C@H]2CCC(=O)N2)[C@H]1c1cccnc1	1806816806	BLOMHALAVBYELF-JYYAWHABSA-N	437.338	1.540	50	20	IDGD	
O=C(CCN1CCOCC1)NC[C@@H]1CCN(C(=O)C(Cl)Cl)[C@H]1c1cccnc1	1806957201	RJRYLNCBUFAKAA-RDJZCZTQSA-N	429.348	1.613	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1807359002	CFYJIGBDXUUTHT-MJGOQNOKSA-N	443.740	1.346	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)/C=C/c2ccco2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1	1807369442	JXMDWMZLFKUNPE-BVVUSLJFSA-N	445.284	1.387	50	20	IDGD	
Cc1ccncc1C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1807375567	QBEJIUFSDXWYNH-KNQAVFIVSA-N	444.300	1.098	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC2(CCCN(C(=O)c3cnccn3)C2)CC1	1808111979	SUZPFOVMDBFQSZ-WGOQTCKBSA-N	437.504	1.455	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1808259638	LPHMXHRGXNRRCW-NEWSRXKRSA-N	429.713	1.098	50	20	IDGD	
COC(=O)C1(C(=O)N2CC[C@H](CNC(=O)[C@H](F)Br)[C@@H]2c2cccnc2)CC1	1808677827	DFTMDLLCBIVUJL-RDBSUJKOSA-N	442.285	1.731	50	20	IDGD	
CCC(=O)N[C@H](C)C(=O)N1CC[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]1c1cccnc1	1810537393	FFOQZWKKDWAUKV-OXFYSEKESA-N	434.613	1.854	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H](CNC(=O)CCn2ccnn2)[C@H]1c1cccnc1	1813428359	YPYNUVREWZXMCA-QGPMSJSTSA-N	449.353	1.800	50	20	IDGD	
C[C@]1(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)CC1(F)F	1814073363	BWWHZRKHGSNZTH-DJPFJPOOSA-N	443.259	1.126	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc3c(n2)OCCO3)[nH]n1)[C@H](O)CCl	1814870546	WBPVCBZORGPWHP-UONOGXRCSA-N	435.868	1.482	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1ccns1	1816273329	LIGKHYXJUFPWJP-OAHLLOKOSA-N	425.279	1.166	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnoc2)[nH]n1	1818111918	PHQOUXGUNVZDTJ-UPVZUOOXSA-N	438.448	1.838	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](C)Br)CC2	1819694332	CUNDZNABQJBDIE-IVZWLZJFSA-N	446.371	1.546	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnn3c2CCC3)n[nH]1	1821455951	ZJTOLQCCLYZWCO-QGZVFWFLSA-N	442.524	1.231	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)Cc3ccncc3)sc2C1	1822539854	NLUUEJBLBMNFBN-AWEZNQCLSA-N	430.534	1.066	50	20	IDGD	
CC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)Cn1cc(C)c(O)nc1=O)CC2	1822858097	WHDPHIUWMVPDQS-WDEREUQCSA-N	439.925	1.343	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CC2(O)CCC2)n[nH]1	1823039690	XGJUVVRWAITXFG-MRXNPFEDSA-N	441.492	1.019	50	20	IDGD	
CN1CCCC[C@@H]1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1	1824199497	WQMGEYQGOYKNAV-FGZHOGPDSA-N	441.381	1.084	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](C)n1cnnn1)CC2	1825453156	PXMLFUSSJKFYFI-UTLUCORTSA-N	442.343	1.476	50	20	IDGD	
O=C(c1cnc(O)nc1O)N1CCC([C@@H]2CCCCN2C(=O)CCBr)CC1	1826357255	SRSLQPFMBBYNTB-AWEZNQCLSA-N	441.326	1.906	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC([C@@H]2CCCCN2C(=O)Cn2cnnn2)CC1	1827198592	DQIBYGAOWDPHNC-CABCVRRESA-N	427.347	1.466	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CCc2nc(N)n[nH]2)CC1	1828806955	UAVLCNBEISXCBY-JSGCOSHPSA-N	441.374	1.723	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CCCCO3)C2)C1	1830534238	YPUFTNNIMBAVHB-RKVPGOIHSA-N	433.343	1.043	50	20	IDGD	
CC(C)[C@H](S)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1831492897	OKGINIFPCPYJTI-SLEUVZQESA-N	427.336	1.088	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)C2=NNC(=O)C2)CC1	1831552603	DTJMIYOQPAITLZ-DZGCQCFKSA-N	427.343	1.656	50	20	IDGD	
C[C@@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)c3cccnn3)CC2)CC1	1833263292	OTWCEKJLWZRPJQ-AWEZNQCLSA-N	438.370	1.693	50	20	IDGD	
CC(=O)N(C)CCC(=O)NC1CCN(C2CCN(C(=O)[C@](C)(Cl)CCl)CC2)CC1	1833669744	ADPGVXFQBYHSLG-HXUWFJFHSA-N	449.423	1.663	50	20	IDGD	
Cn1cnc(C(=O)NC2CCN(C3CCN(C(=O)[C@@](C)(Cl)CCl)CC3)CC2)n1	1834088648	GEINWXTVXYXEAK-SFHVURJKSA-N	431.368	1.237	50	20	IDGD	
Cc1noc(N)c1C(=O)N1CCC(N2CCC(NC(=O)CCBr)CC2)CC1	1834421885	RLUHYQNVARGGBF-UHFFFAOYSA-N	442.358	1.535	50	20	IDGD	
CC(C)n1ccc(C(=O)N2CCOC[C@]3(CN(C(=O)CCBr)CCO3)C2)n1	1834823672	BQGQQLHPKDZCDS-SFHVURJKSA-N	443.342	1.319	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](C)N3CCN(C)CC3)CC2)CC1	1836375389	XNKLRIPWQLISNY-XLIONFOSSA-N	442.048	1.211	50	20	IDGD	
CC(C)(C)[C@@H](O)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](F)Br)CC2)CC1	1836413710	MLUQLHNWTOTHEY-LSDHHAIUSA-N	436.366	1.656	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3n[nH]c4c(F)cccc34)CCO2)C1	1837058907	PIQUXIHNHFAPDQ-VBKZILBWSA-N	438.887	1.789	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4[nH]ccc4n3)C2)C1	1837713182	MGOWUKPQIDUMME-NRFANRHFSA-N	446.580	1.484	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(F)cc3F)C2)C1	1837714703	MKIQBTNQLLZNON-FQEVSTJZSA-N	442.535	1.886	50	20	IDGD	
CCc1ncsc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](Cl)COC)C2)C1	1838838934	HTIYLMYLNNZELZ-UGSOOPFHSA-N	431.942	1.029	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)cc1	1838984321	QGGDERKFCCCELL-YJBOKZPZSA-N	429.286	1.756	50	20	IDGD	
CC(C)c1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)n[nH]1	1839199954	ASYVQVLPBDCZLY-PBHICJAKSA-N	447.305	1.294	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3ccnc(C)c3)C2)C1	1840149901	AQLXEFYUFKUUFG-RXVVDRJESA-N	439.940	1.033	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC12CN(C(=O)C13CC(c4ccccc4)(C1)C3)C2	1843015772	YRJIXGCYENZQIU-UHFFFAOYSA-N	430.313	1.305	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@](F)(C(=O)N2CCCC23CN(C(=O)[C@@H](O)CCl)C3)C1	1843953454	ZWVDTDZUHNLJPL-ORAYPTAESA-N	433.908	1.139	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCCC12CN(C(=O)[C@H]1CCc3nc(O)nc(O)c3C1)C2	1845169383	FXZPIMBKXLMPFI-VOJFVSQTSA-N	443.331	1.432	50	20	IDGD	
C=CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)[C@@H](Cl)COC)C1	1846360549	SNPPXWAUIDEQSN-GJZGRUSLSA-N	429.945	1.913	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)c1cc(S(C)(=O)=O)ccc1Cl)C2	1846365429	SZJONWGUWJPRQN-OAHLLOKOSA-N	449.356	1.814	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)CCc1ccc(N(C)C)cc1)C2	1846386117	DGUBFOYWTSSHNH-UHFFFAOYSA-N	429.565	1.262	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@H](CC(N)=O)NC(=O)OC(C)(C)C)C1	1847090052	JEFGPVTZGDKFQW-KBPBESRZSA-N	444.960	1.366	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(S(=O)(=O)NC(C)C)cc2)cc1	10602193	UDPZJMMYGPVMNG-UHFFFAOYSA-N	433.486	1.300	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)N(C)CCCC(=O)NNC(=S)NC(C)(C)C)cc1	28716741	SSXHZTBMVGDJOU-UHFFFAOYSA-N	428.580	1.584	50	20	IDGD	
COC(=O)c1ccc(N2CCN(CC(=O)NNC(=O)Cc3nc(C)cs3)[C@@H](C)C2)cc1	109958616	WNIVIJZYFMBBGZ-HNNXBMFYSA-N	445.545	1.139	50	20	IDGD	
COc1ccc(C(=O)NNc2nc(-c3ccncc3)no2)cc1S(=O)(=O)NC1CC1	110377409	CKDAHRNKKVCENI-UHFFFAOYSA-N	430.446	1.338	50	20	IDGD	
C[C@H]1CN(Cc2ccc(CNC(=O)NNC(=O)CNC(=O)c3ccco3)cc2)C[C@@H](C)O1	725870580	KWEZQHRBPHLLHO-IYBDPMFKSA-N	443.504	1.149	50	20	IDGD	
Cc1ccccc1CN1CCC(NC(=O)NNC(=O)CNC(=O)c2cccs2)CC1	725873616	OYORXANENAQMSD-UHFFFAOYSA-N	429.546	1.781	50	20	IDGD	
O=C(CC12CC3CC(CC(C3)C1)C2)NCC(=O)NNC(=O)CNC(=O)c1cccs1	725902837	VDYUHKXHZIVPDH-UHFFFAOYSA-N	432.546	1.348	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)[C@@H]1Cc2ccccc2N1C(C)=O	726661055	GBLDCTGJNOEDAX-KRWDZBQOSA-N	445.859	1.631	50	20	IDGD	
COc1ccc(CCNC(=O)NNC(=O)COc2ccc(C#N)cc2)c(OC)c1OC	727944517	DUPXZCJDLFBKBW-UHFFFAOYSA-N	428.445	1.536	50	20	IDGD	
CCN(CC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1)c1ccccc1	728215608	HUAOXFZFTONYNY-UHFFFAOYSA-N	431.562	1.592	50	20	IDGD	
O=C(C[C@H](c1ccccc1)N1CCOC1=O)NNC(=O)c1nn(-c2ccccc2)cc1O	728308141	YRRNNWAFGPDGSH-QGZVFWFLSA-N	435.440	1.923	50	20	IDGD	
O=C(COC(=O)c1ccc(-n2cccc2)cc1O)NNC(=O)[C@H]1COc2ccccc2O1	728362402	NGTIDTNXCNFTQY-LJQANCHMSA-N	437.408	1.327	50	20	IDGD	
CC(=O)NC1(c2noc(CCC(=O)NNC(=O)Cc3cccnc3)n2)CCCCCC1	728850323	MQIAFQMCCBUEQE-UHFFFAOYSA-N	428.493	1.473	50	20	IDGD	
O=C(NCCC(=O)N1CCOCC1)NNC(=O)c1ccc(Br)cc1Cl	728946766	BSNTZOGNKJKATK-UHFFFAOYSA-N	433.690	1.295	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)C(=O)NCCCc2ccccc2)c2ccccc2c1=O	729258242	KHQWZCPIXHRKEE-UHFFFAOYSA-N	435.484	1.317	50	20	IDGD	
CCN1CCC[C@@H]1CN1C[C@@H](C(=O)NNC(=O)c2ccc(OC(C)C)c(OC)c2)CC1=O	729627189	PNQZPEBSBVQAOB-ZWKOTPCHSA-N	446.548	1.576	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)CCNS(=O)(=O)c2ccc(C)c(C)c2)cn1	729692917	YNBOJYOBCLPROR-UHFFFAOYSA-N	437.547	1.393	50	20	IDGD	
O=C(NCc1ccccc1CN1C(=O)NC2(CCCCC2)C1=O)NNC(=O)c1ccc[nH]1	730129466	XZGUNPQRVBOIAX-UHFFFAOYSA-N	438.488	1.914	50	20	IDGD	
COC(=O)c1ccc(C(=O)OC)c(S(=O)(=O)NNC(=O)c2cccc3ncccc23)c1	730204004	ODQUUXSCKSRDHF-UHFFFAOYSA-N	443.437	1.431	50	20	IDGD	
O=C(CCCS(=O)(=O)c1ccc(Br)cc1)NNC(=O)c1ccncc1	730996909	ADRBBWJAOACHMU-UHFFFAOYSA-N	426.292	1.859	50	20	IDGD	
COc1ccccc1C(=O)NNS(=O)(=O)c1c(C)cc(C)c(NS(C)(=O)=O)c1C	731494319	UVCQAZKCHBAJCY-UHFFFAOYSA-N	441.531	1.615	50	20	IDGD	
CC[C@H](C)[C@H](NC(=O)N1CCCC1)C(=O)NNC(=O)c1cc(OC)c(OC)c(OC)c1	731891675	BJRPIWBLYVZUHL-GUYCJALGSA-N	436.509	1.694	50	20	IDGD	
CN(C)[C@H](C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1)c1cccc(Cl)c1	732260645	XCHUSTFWUSKUEU-HNNXBMFYSA-N	445.328	1.705	50	20	IDGD	
CCOCCCn1c(NNC(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)nc2ccccc2c1=O	733268597	PYNKSIAIKAEWLC-UHFFFAOYSA-N	443.464	1.806	50	20	IDGD	
CS(=O)(=O)Cc1cccc(CNC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c1	733344699	KCLPGRWPJROANM-UHFFFAOYSA-N	427.486	1.561	50	20	IDGD	
COc1ccc(CN2CC[C@H](NC(=O)NNC(=O)COc3cc(C)cc(C)c3)C2=O)cc1	734685103	QSDPSROVUKPJCT-FQEVSTJZSA-N	440.500	1.822	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)Cc1ccc(S(=O)(=O)CC(F)(F)F)cc1	736557234	GOJAOVGXCKUABA-UHFFFAOYSA-N	446.403	1.497	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)[C@H]1CCCN1C(=O)c1ccc2c(c1)OCO2	737629475	ROUGUMRGBKGZGG-QGZVFWFLSA-N	425.441	1.384	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)c2cn([C@H]3CCS(=O)(=O)C3)nc2C(C)C)cc1C	742472932	YKTFCJGTMBOCCK-INIZCTEOSA-N	448.545	1.823	50	20	IDGD	
O=C(CNC(=O)N1CCc2ccccc2C1)NNC(=O)c1cccc(Br)c1	742769206	HJMUANIGWUZHST-UHFFFAOYSA-N	431.290	1.978	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)c1cc(N2CCOC2=O)ccc1F	743292989	PRSYYKDBGUQVJU-UHFFFAOYSA-N	425.376	1.748	50	20	IDGD	
O=C(NC[C@@]1(N2CCOCC2)CCSC1)NNC(=O)c1cccc(Br)c1	743558018	UZQSPXVRUFMTMQ-KRWDZBQOSA-N	443.367	1.601	50	20	IDGD	
C[C@H]1C[C@@H](NC(=O)NNC(=O)c2c(Cl)cccc2Cl)C(=O)N1c1cnn(C)c1	743586055	TWZFCZLNMVMIDZ-TVQRCGJNSA-N	425.276	1.865	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)NC[C@](C)(O)C(C)C)cc1	743773880	MPMJIRWOKIDYBX-LYQKSFCXSA-N	439.516	1.864	50	20	IDGD	
CCC(CC)(CNC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1)SC	745908189	BQJUZCYMAXMHBR-UHFFFAOYSA-N	430.596	1.868	50	20	IDGD	
C[C@H](CN1CCN(c2ccccc2)CC1)NC(=O)NNC(=O)Cc1cn2ccccc2n1	746768411	WGYPULLHZPYYJL-GOSISDBHSA-N	435.532	1.418	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC(NC(=O)NNC(=O)c3ccc(C#N)cc3)CC2)cc1	747298549	FMRNVTUBRMSLRA-UHFFFAOYSA-N	441.513	1.664	50	20	IDGD	
Cc1cc(N2C[C@H](C(=O)NNC(=O)Cc3ccncc3)CC2=O)ccc1Br	747323208	NFSYIDVJOBEJMM-CQSZACIVSA-N	431.290	1.896	50	20	IDGD	
Cn1ccnc(NNC(=O)c2ccc(Br)cc2I)c1=O	747938914	ZSONQDAWLZYFHH-UHFFFAOYSA-N	449.046	1.904	50	20	IDGD	
CC(=O)N1CCN(S(=O)(=O)c2ccc(C(=O)NNc3ccc(C#N)cc3)cc2)CC1	748101789	DOJMRCZMBWMXMK-UHFFFAOYSA-N	427.486	1.168	50	20	IDGD	
CN(C(=O)CSc1ccccc1C(=O)NNC(=O)C(=O)N1CCCC1)C1CCCCC1	748245993	BYDIFCIXIYUQQL-UHFFFAOYSA-N	446.573	1.953	50	20	IDGD	
Cc1cc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)C(=O)N3CCCC3)cc2)ccc1F	748246047	DUTLXIUBDVJJNX-UHFFFAOYSA-N	448.476	1.318	50	20	IDGD	
COc1cc(S(=O)(=O)NNC(=O)NCCc2cccs2)c(Cl)cc1C(=O)O	749141494	HDSROFPHEYKYFX-UHFFFAOYSA-N	433.895	1.844	50	20	IDGD	
CS(=O)(=O)Cc1ccccc1CNC(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	749586244	LJKGZJIQSSDDFQ-UHFFFAOYSA-N	443.485	1.267	50	20	IDGD	
CN(C)[C@@H]1CCC[C@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)C1	749592857	WXYRKPFPKJMBFF-DLBZAZTESA-N	437.566	1.288	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)N[C@@H]2CC(=O)N(C(C)C)C2)cc(OCC)c1OCC	750643215	GKIJVCRNHJNMGO-OAHLLOKOSA-N	436.509	1.836	50	20	IDGD	
CC[C@@H](CS(=O)(=O)c1ccccc1)NC(=O)NNC(=O)c1ccc(OC)c(OC)c1	752130801	VSHIJMYQGJZROX-HNNXBMFYSA-N	435.502	1.900	50	20	IDGD	
COc1cccc(/C=C(\C#N)C(=O)OCC(=O)N2CCc3cc(S(N)(=O)=O)ccc32)c1	752868313	VRVFXUGFTOHKAU-CXUHLZMHSA-N	441.465	1.382	50	20	IDGD	
CS[C@H](CNC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1)C(C)(C)C	753290998	MFMKSMHKUOCBML-OAHLLOKOSA-N	430.596	1.724	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(C(=O)O)c(C(F)(F)F)c1)c1ccc2c(c1)OCCO2	754746447	YQIPAYXDJGDKDL-UHFFFAOYSA-N	446.359	1.798	50	20	IDGD	
COc1c(F)ccc(F)c1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	755037332	QTWCCZOEKKBASF-UHFFFAOYSA-N	439.440	1.833	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)Nc1ccc(N2CCCS2(=O)=O)cc1	755595444	SRDJBEQEAXULME-UHFFFAOYSA-N	429.458	1.330	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)Nc2ccc(NC(=O)CN3CCOCC3)cc2)c1	755599741	PCUPVJQTDPLATC-UHFFFAOYSA-N	441.488	1.497	50	20	IDGD	
CCNC(=O)N1CCc2ccc(NC(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)cc21	756736343	DYCXREYYXKWCBK-UHFFFAOYSA-N	445.501	1.649	50	20	IDGD	
CCOc1ccc(C(=O)N(C)C)cc1NC(=O)NNC(=O)c1nnc(O)c2ccccc12	756878650	DAZDKLQZKKGDFB-UHFFFAOYSA-N	438.444	1.902	50	20	IDGD	
CCOC(=O)c1sc([C@@H](C)NC(=O)NNC(=O)COc2ccccc2C#N)nc1C	757269672	AXFJMRAALDWGIY-GFCCVEGCSA-N	431.474	1.970	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2cc(C(=O)NNc3ccc(C(N)=O)nn3)ccc2C)cc1	757402439	MUURJDDODAYMQK-UHFFFAOYSA-N	440.485	1.750	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2cccc(C(=O)NNc3ccc(C(N)=O)nn3)c2)cc1	757404486	QJGFYBBTFYIUEC-UHFFFAOYSA-N	426.458	1.442	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)N2CCC[C@@H]2C(=O)NN=c2cc[nH]cc2Cl)o1	757406283	UUJODNQQGHIDEI-CYBMUJFWSA-N	442.881	1.223	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1ccc2nc(Cc3ccccc3)oc2c1	757673380	FQNHLCIDUIIYAV-GFCCVEGCSA-N	431.474	1.509	50	20	IDGD	
Cn1cnn(-c2ccc(NC(=O)NNC(=O)c3cc(Br)ccc3O)cc2)c1=O	757863665	SKXJIIRFVSDPAD-UHFFFAOYSA-N	447.249	1.506	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)C(=O)Nc1ccccn1)Oc1ccc(Br)cc1	758814748	GUYDIEXFFNKPRQ-NSHDSACASA-N	436.266	1.581	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@]2(C)CCCS2)c1	758861123	KJQDVQPQORFSMQ-SFHVURJKSA-N	428.580	1.947	50	20	IDGD	
C[C@H]1CC[C@@H](CC(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)C1	759111573	BPPYVHBYOJKUPM-FUHWJXTLSA-N	437.562	1.614	50	20	IDGD	
O=[N+]([O-])c1cccc(S(=O)(=O)N2CCN(CCI)CC2)c1	759320657	CQZCSIRFXHIPTM-UHFFFAOYSA-N	425.248	1.336	50	20	IDGD	
COc1cc(OC)c2cc(C(=O)NNC(=O)CCNC(=O)OC(C)(C)C)[nH]c2c1OC	760438120	RHDUGYYAXGIZBP-UHFFFAOYSA-N	436.465	1.870	50	20	IDGD	
COC(=O)[C@@H](C)NC(=O)/C(C#N)=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	761108961	HCLZEYNOYAYJQZ-OJLMPMFISA-N	429.864	1.664	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)c1cn(-c2cccc([N+](=O)[O-])c2)nn1	761621144	JJMJZDVQHNHNBP-UHFFFAOYSA-N	428.430	1.737	50	20	IDGD	
CCc1csc(-n2cc(C(=O)NNC(=O)c3cc(OC)c(OC)c(OC)c3)cn2)n1	762435292	CQVXFQLTZCIXOW-UHFFFAOYSA-N	431.474	1.992	50	20	IDGD	
CC(C)(C)c1ccc(C(=O)NCCC(=O)NNc2nccc(N3CCOCC3)n2)cc1	762860685	GZLZCQSGOVYVQN-UHFFFAOYSA-N	426.521	1.874	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(CNC(=O)NNC(=O)CSc2ccccc2O)cc1	763464061	TZVLHJFTMYQSLF-UHFFFAOYSA-N	438.531	1.265	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)NCc1cc(F)ccc1N1CCOCC1	763507969	JITTVGHKZDJGNX-UHFFFAOYSA-N	434.493	1.991	50	20	IDGD	
CCOC(=O)/C=C/c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(OC)c(OC)c2)cc1	763552350	ZAJVJXQFKUCGPW-KPKJPENVSA-N	441.440	1.680	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2ccc(N3CCOCC3)cc2C)c1	763645851	ZQLDPSRWAATKPJ-UHFFFAOYSA-N	440.500	1.613	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2cc(C#N)ccc2OC(F)F)c1	763667914	FAIWJKWTOKYAKG-UHFFFAOYSA-N	432.383	1.941	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)C2=S=C3CCCC3=C2)n([C@@H]2C[C@H]3CC[C@H]2C3)n1	763780629	CDDPBWGPVUXJRJ-KCQAQPDRSA-N	427.530	1.840	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cc(C3CC3)n(CC)n2)cc1	763861932	UCNDGDXVPFITLY-ZDUSSCGKSA-N	429.477	1.733	50	20	IDGD	
CC(C)CC(=O)NNC(=O)C(=O)Nc1ccccc1S(=O)(=O)N(C)C1CCCCC1	763881561	HMNDEPYSRWBVOZ-UHFFFAOYSA-N	438.550	1.772	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccc(Oc3ccc(F)cc3)nc2)n1	763892850	LXBOSCRDQNLURH-UHFFFAOYSA-N	426.408	1.612	50	20	IDGD	
COc1ccc(OC)c(NC(=O)C(=O)NNC(=O)c2ccc(OC(C)C)c(OC)c2)c1	763915699	FGBFOIHLWPBJIM-UHFFFAOYSA-N	431.445	1.899	50	20	IDGD	
COC(=O)c1cc(F)c(F)cc1NC(=O)C(=O)NNC(=O)c1cc(Cl)ccc1O	763979617	ZYWYTOBEHSDPPU-UHFFFAOYSA-N	427.747	1.510	50	20	IDGD	
Cc1nc2ccc(NC(=O)C(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)cc2s1	764076649	DLKKVLFPGRTTII-UHFFFAOYSA-N	432.483	1.408	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc(O[C@@H]4CCOC4)cc3)n[nH]2)cc1	764109744	AZCMVGJPAGQRII-GOSISDBHSA-N	449.467	1.953	50	20	IDGD	
COc1ccc(Oc2ccc(NC(=O)C(=O)NNC(=O)[C@H]3Cc4ccccc4O3)cn2)cc1	764167390	JKKPYUFTGJVTPK-LJQANCHMSA-N	448.435	1.972	50	20	IDGD	
CN(Cc1cccc(NC(=O)C(=O)NNC(=O)c2cccc(C#N)c2)c1)C(=O)C(F)(F)F	764235127	QPBKDRRTOIKOLT-UHFFFAOYSA-N	447.373	1.479	50	20	IDGD	
Cc1cccc(C(=O)N2CCCC2)c1NC(=O)C(=O)NNC(=O)CCc1ccccc1O	764278199	MFUWZXHPTXJHJT-UHFFFAOYSA-N	438.484	1.655	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)C(=O)Nc1ccc2nc3n(c(=O)c2c1)CCC3)c1ccccc1	764328152	BKXVREWKNBFJHF-MRXNPFEDSA-N	433.468	1.622	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2c[nH]nc2-c2ccccn2)n[nH]1	764377407	PDCSNKPERQPMEF-UHFFFAOYSA-N	446.427	1.270	50	20	IDGD	
COc1nccnc1NNC(=O)CNC(=O)[C@H]1c2ccccc2C(=O)N1Cc1ccccc1	764469630	KXDQVPFVLLAIAG-LJQANCHMSA-N	446.467	1.442	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@@H]2CN(C(=O)OC(C)(C)C)CCO2)cc(OC)c1OC	764514667	SLECRQDFKIIWFF-HNNXBMFYSA-N	439.465	1.109	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)c2ccc(F)c(NS(C)(=O)=O)c2)n[nH]1	765597471	GOYJCLOFMVCESQ-UHFFFAOYSA-N	447.448	1.671	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NN=C[C@@H](C)CCC#N)N(S(C)(=O)=O)CC2	766000958	BSWWEVZYDJSMMT-WMLDXEAASA-N	436.534	1.995	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)CCCC(=O)c2ccc3c(c2)OCCO3)c1	766633433	VDUJYPKQSLFBMP-UHFFFAOYSA-N	446.481	1.676	50	20	IDGD	
O=C(CCCC(=O)c1ccc2c(c1)OCCO2)NNC(=O)CNC(=O)c1cccs1	766642611	YHFMFTZUNHYTCB-UHFFFAOYSA-N	431.470	1.450	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)c1cncc(I)c1	768639761	VTZUQNVELDPXGC-UHFFFAOYSA-N	447.254	1.855	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)[C@H]2CCN(C(=O)OCc3ccccc3)C2)cc1	770133338	FAHNYPZHTSAEFL-KRWDZBQOSA-N	426.473	1.913	50	20	IDGD	
C[C@H]1Oc2ccccc2N(CCC(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)C1=O	770957805	FRTTUALELRBNMG-GFCCVEGCSA-N	439.476	1.934	50	20	IDGD	
CCC[C@H](NC(=O)NCc1ccc(F)cc1)C(=O)NNc1nc(O)c2cnn(C)c2n1	770972854	JUWULZKYRJLUKW-AWEZNQCLSA-N	430.444	1.319	50	20	IDGD	
CC/C=C(/C)C(=O)N1CSC[C@H]1C(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772897716	LGXUZSOPLHZEPH-VPRWNFCTSA-N	438.937	1.361	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NC[C@@H]1CCCN(CC(C)C)C1	772973834	ZROOBJPCZAJRAF-INIZCTEOSA-N	438.598	1.600	50	20	IDGD	
CC[C@@H](C)NS(=O)(=O)c1cccc(NC(=O)C(=O)NNc2ccccc2[N+](=O)[O-])c1	773654461	WLNNKWOJFOMOMD-GFCCVEGCSA-N	435.462	1.753	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNc2cnc3ccccc3n2)cc1OC	773723138	YJVCLBVVPRKCCG-UHFFFAOYSA-N	444.473	1.482	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCc1ccnc(N(C)C)n1	775715611	HPBPOFQERJSDKI-LLVKDONJSA-N	437.298	1.603	50	20	IDGD	
CN(C)C(=O)c1ccc(C(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)cc1	776201160	GGKPBPFPNJSSGE-UHFFFAOYSA-N	433.509	1.638	50	20	IDGD	
COC(=O)C1(c2ccc(S(=O)(=O)NNC(=O)c3ccc(OC)c(OC)c3)cc2)CC1	776271869	KOUVOKOGOKHRJQ-UHFFFAOYSA-N	434.470	1.532	50	20	IDGD	
CCOC(=O)N1CCC[C@H]([C@@H](C)NC(=O)NNC(=O)c2nnc(O)c3ccccc23)C1	777266523	AABGBADUVGKJRA-OLZOCXBDSA-N	430.465	1.536	50	20	IDGD	
CC(C)Cc1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc(O)n1	777269754	DXMCJZQSZPFDGR-UHFFFAOYSA-N	446.529	1.845	50	20	IDGD	
CCNS(=O)(=O)c1ccccc1S(=O)(=O)NNC(=O)C(C)(C)c1ccccc1	777630572	AVLBXRLKTRDCHA-UHFFFAOYSA-N	425.532	1.272	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)NC[C@@H]1COC2(CCOCC2)O1	777761588	VPBHVCNYAYSTMT-HNAYVOBHSA-N	429.473	1.860	50	20	IDGD	
O=C([C@H]1CCCN(CC(F)(F)F)C1)N1CCN(S(=O)(=O)CBr)CC1	777776964	ASMUCUOWBVIGBT-NSHDSACASA-N	436.294	1.087	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccc(Oc3ccccc3)c(C#N)c2)n1	778708288	WZMHJJJIACYIMK-UHFFFAOYSA-N	432.440	1.950	50	20	IDGD	
COc1ccc(C(=O)NNc2cc(Cl)nc(N)n2)cc1S(=O)(=O)N1CCCC1	779373335	GZUJZRRMTLHKMT-UHFFFAOYSA-N	426.886	1.262	50	20	IDGD	
CC(C)(C)OC(=O)N=c1cc[nH]cc1C(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	780990226	LMQPVFQGMFRYGD-UHFFFAOYSA-N	447.879	1.581	50	20	IDGD	
CC(C)CC(=O)N1CCN(C(=O)CCCCCNS(=O)(=O)CBr)CC1	782435480	ROIIFFNWXKRIQC-UHFFFAOYSA-N	440.404	1.536	50	20	IDGD	
Cc1cc(C)c(NC(=O)C(=O)NNC(=O)c2csc(N3CCOCC3)n2)c(Cl)c1	782896398	HROWNPHPJVSJKT-UHFFFAOYSA-N	437.909	1.650	50	20	IDGD	
N#Cc1cccnc1-n1cc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2Cl)cn1	782926768	YOTPQKIOVMLGPA-UHFFFAOYSA-N	444.238	1.845	50	20	IDGD	
CN1CCN(C(=O)c2ccccc2NC(=O)C(=O)NNc2ncnc3ccsc23)CC1	783253045	FTVLYAKGZSUCPH-UHFFFAOYSA-N	439.501	1.161	50	20	IDGD	
CN1CC(=O)N(c2cccc(NC(=O)C(=O)NNc3ccc(Cl)cc3[N+](=O)[O-])c2)C1=O	783289316	KINBCKAKEUGUJG-UHFFFAOYSA-N	446.807	1.728	50	20	IDGD	
Cc1cccc(COc2ccc(NC(=O)C(=O)NNC(=O)C(=O)N3CCCC3)c(C)c2)c1	783997656	VHZLEYKDGZZNNW-UHFFFAOYSA-N	438.484	1.591	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc2c(c1)CCN2C(=O)C(=O)NNc1ccc(F)c(F)c1F	784811169	OQCVQFFITKPFIO-UHFFFAOYSA-N	442.419	1.387	50	20	IDGD	
COc1cccc(NNC(=O)C(=O)Nc2ncn(Cc3cccc(Br)c3)n2)n1	784842069	GOJUMWGHJPCKGY-UHFFFAOYSA-N	446.265	1.574	50	20	IDGD	
COc1cccc(NNC(=O)C(=O)Nc2cc(Br)cnc2-n2cccn2)n1	784843749	PMGLEVJLKPVUDJ-UHFFFAOYSA-N	432.238	1.515	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)cc(OC)c1OC	789811076	UHPDYMYUGWAASI-YJBOKZPZSA-N	443.456	1.371	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCC(C)CC2)cc1	790063879	QVNYLBVYSZLKGX-UHFFFAOYSA-N	441.550	1.657	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@H](C(=O)NNC(=O)c2cccc(Cl)c2)[C@@H](C)O)cc1	792120473	RTZLAVSLWJZCQN-WBMJQRKESA-N	425.894	1.137	50	20	IDGD	
CN(CC(N)=O)C(=O)c1cccc(NC(=O)C(=O)NNc2ccc(C(C)(C)C)cc2)c1	793017880	JVOYNEXUHBEPQI-UHFFFAOYSA-N	425.489	1.623	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccc2ccn(C)c(=O)c2c1	793021644	HVVDOMGUNDHSLQ-GFCCVEGCSA-N	426.404	1.231	50	20	IDGD	
Cc1cccc(C(=O)NNS(=O)(=O)c2cc(Br)cc(C(=O)O)c2F)n1	794599105	CJDDBQWWIWJSPD-UHFFFAOYSA-N	432.227	1.613	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(OC(C)C)c(C(N)=O)c2)cc1C	796992966	YLNPDZKBAFYRQL-UHFFFAOYSA-N	442.472	1.354	50	20	IDGD	
COC(=O)NCc1ccc(NC(=O)NNC(=O)CNC(=O)OCc2ccccc2)cc1	797627757	OPBFGYVLSJBWEO-UHFFFAOYSA-N	429.433	1.622	50	20	IDGD	
CCc1ccc(C(=O)NNS(=O)(=O)c2cccc(S(=O)(=O)N(CC)CC)c2)cc1	800830998	OTVMWHAMZWFMIL-UHFFFAOYSA-N	439.559	1.903	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@]2(NC(=O)OCc3ccccc3)CCOC2)cc1	801111213	NGQOQARFEDEXTE-QFIPXVFZSA-N	440.456	1.166	50	20	IDGD	
COc1cc(OC)cc(C(=O)N2CCC(C(=O)NNC(=O)N=c3cc[nH]cc3)CC2)c1	802029831	VVBJJDCAANGUCL-UHFFFAOYSA-N	427.461	1.226	50	20	IDGD	
O=C(NNC(=O)c1ccc(F)cc1Br)C(=O)Nc1ccc(OC(F)F)nc1	802567574	ZFVRVAAFEMWLAN-UHFFFAOYSA-N	447.167	1.984	50	20	IDGD	
O=C(COC(=O)[C@@H](O)c1ccc(Cl)cc1F)NNC(=O)c1ccc([N+](=O)[O-])cc1	811369418	FKNSGKJPVYDIRJ-HNNXBMFYSA-N	425.756	1.425	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(CN3CCCC3)on2)c1	812449892	RYBGBCUUALVYCO-UHFFFAOYSA-N	449.533	1.376	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)c(C2CC2)n1	813487758	LPXFBMOFKMQPLL-UHFFFAOYSA-N	430.940	1.530	50	20	IDGD	
O=C(CCc1ccc2ccccc2n1)N1CCN(S(=O)(=O)CBr)CC1	813510414	XXZDUNAEAHAHMO-UHFFFAOYSA-N	426.336	1.994	50	20	IDGD	
CN(CCOc1ccc(S(N)(=O)=O)cc1)C(=O)NNC(=O)C(C)(C)c1ccccc1	814299134	LUDCTEFQYMDOGY-UHFFFAOYSA-N	434.518	1.363	50	20	IDGD	
CCc1nn(C)c(OC)c1C=NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	814691279	UNBZWZUEAAYFSJ-UHFFFAOYSA-N	433.534	1.930	50	20	IDGD	
CC(C)C(=O)Nc1cc(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)ccn1	814708310	IINADRWKGHJQBK-UHFFFAOYSA-N	438.532	1.649	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)CCc2ccccc2O)cc1)[C@H]1C[C@H]1C	815569186	KAHKRTKZQFULTK-KUHUBIRLSA-N	438.484	1.872	50	20	IDGD	
CN1CCN(CCOc2ccc(NC(=O)C(=O)NNc3cccc(Cl)n3)cc2)CC1	815727495	AKFWYJPMBJVUFA-UHFFFAOYSA-N	432.912	1.443	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1c(F)cc(Cl)cc1F	815751922	UPYLZJDXVOENEI-UHFFFAOYSA-N	432.836	1.950	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)[C@@H]1CSC(c2ccccc2O)=N1	816916193	YPQXYRIBMYYIGQ-INIZCTEOSA-N	432.527	1.838	50	20	IDGD	
C[C@@H](C(=O)NNc1ccccc1S(=O)(=O)N(C)C)S(=O)(=O)c1ccc(F)cc1	817054600	PQMGWKCPJPWMIT-LBPRGKRZSA-N	429.495	1.382	50	20	IDGD	
CCn1c(NNC(=O)CNS(=O)(=O)c2ccc(Cl)cc2)nc2ccccc2c1=O	823887514	IJFCZCRZWGVYBS-UHFFFAOYSA-N	435.893	1.491	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	825624245	IKNPACQXLPEARB-UHFFFAOYSA-N	446.529	1.743	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)[C@H]2CC(=O)N(c3ccc4c(c3)OCCO4)C2)c1	825777352	VMIVPTSYBAUSTM-AWEZNQCLSA-N	440.456	1.079	50	20	IDGD	
O=C(COC(=O)c1ccc(=O)n(Cc2ccccc2)n1)NNC(=O)c1cccc(Cl)c1	847191351	CVCKTJIGFNROOL-UHFFFAOYSA-N	440.843	1.563	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)CSc1nnnn1C1CC1	849201902	COJFVYDYAFCLSZ-VIFPVBQESA-N	441.311	1.478	50	20	IDGD	
O=C(CN1C(=O)[C@@H]2[C@@H](C1=O)[C@H]1C=C[C@H]2C1)NNC(=O)c1cc2c(s1)CCCCCC2	913094963	JHHQUNBPTUBZCC-LSOMNZGLSA-N	427.526	1.975	50	20	IDGD	
CCc1ccccc1OCC(=O)NN=C1CCN(S(=O)(=O)c2c(C)n[nH]c2C)CC1	914559249	FPAPTIHLIUNDQZ-UHFFFAOYSA-N	433.534	1.925	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)NC1CCN(CC(=O)Nc2ccccc2)CC1	914598773	QRFCWCQHJHZJHE-UHFFFAOYSA-N	443.479	1.638	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)CSCc2cccnc2)c1	915685794	LMTSSTMTTURXDX-UHFFFAOYSA-N	436.559	1.807	50	20	IDGD	
CC(=NNC(=O)c1ccc([N+](=O)[O-])cc1)c1ccc(S(=O)(=O)NCCCC(=O)O)cc1	916243849	SZUJAGHMYAGTQT-UHFFFAOYSA-N	448.457	1.892	50	20	IDGD	
COc1cc(Cl)ccc1NC(=O)COc1ccc(C=NNC(=O)C(N)=O)cc1OC	916272288	KBHLNUKGQYLPKZ-UHFFFAOYSA-N	434.836	1.310	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)NC1CCN(C(=O)c2ccccc2F)CC1	916380666	JAZRKTXSCSKLQH-UHFFFAOYSA-N	442.447	1.846	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NC[C@H](C)N2CCN(c3ccccc3)CC2)cc1	916514868	QSWRTAPZOOHIBI-SFHVURJKSA-N	441.532	1.615	50	20	IDGD	
CCOc1ccc(N2C[C@H](C(=O)NNC(=O)C(=O)Nc3ccc(C)c(C)c3)CC2=O)cc1	916562730	XNYKYZLLTXIINM-MRXNPFEDSA-N	438.484	1.841	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)CNC(=O)c2ccc(Br)s2)c1	916725770	WQRBDFMBOPJVJU-UHFFFAOYSA-N	442.291	1.719	50	20	IDGD	
O=C(NC1CC1)C(=O)N1CCN(CCP(=O)(c2ccccc2)c2ccccc2)CC1	917125003	ZFNHPQBMNQEBOX-UHFFFAOYSA-N	425.469	1.423	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)CCc3c(C)nc4nc(N)nn4c3C)n[nH]2)cc1	917178271	PYJXXGDLIWROQH-UHFFFAOYSA-N	433.476	1.416	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N[C@@H](CCSC)C(=O)NNC(=O)C(C)(C)C)cc1	917181633	XYIROFQKVYSLGF-HNNXBMFYSA-N	431.580	1.679	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)NCCS(=O)(=O)c2ccccc2)cc1	918229565	IYDYUERWBLVXEQ-HNNXBMFYSA-N	435.502	1.657	50	20	IDGD	
O=C(Cn1c(=O)nc(O)c2ccccc21)NNC(=O)c1ccc(F)cc1Br	918341678	VZGWXAQGYVKRDZ-UHFFFAOYSA-N	435.209	1.465	50	20	IDGD	
CN(C)C(=O)C[C@H](NC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)c1ccccc1	920046784	NURBBIPCERSJMJ-KRWDZBQOSA-N	432.502	1.254	50	20	IDGD	
CCS(=O)(=O)c1cccc(NC(=O)NNc2ccccc2S(=O)(=O)N(C)C)c1	1117702170	OMOVTGDBQWBMDT-UHFFFAOYSA-N	426.520	1.879	50	20	IDGD	
C[C@@H]1Oc2ccccc2N(CC(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)C1=O	1318657221	YTODSHIQRBKGJH-AWEZNQCLSA-N	446.504	1.595	50	20	IDGD	
C=C[C@H](COC)NC(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2OC)c1	1320606372	VRMPWYYOZUSXBN-OAHLLOKOSA-N	448.501	1.641	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)Nc2cnccn2)C1	1779393926	FMRMWZRPDZSWKX-AXHMDWHKSA-N	439.944	1.045	50	20	IDGD	
CN(C)c1ccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)cn1	1779762874	CBWYMYOSVXFAFM-RBUKOAKNSA-N	429.348	1.827	50	20	IDGD	
O=C([C@@H]1CCCCN1Cc1ccccc1)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1780881398	DPIFZZNUVKODBK-JTAQYXEDSA-N	449.979	1.471	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)c3cc4n(n3)CCCO4)CCO2)C1	1781230173	OLWYLXZEWCVUMH-QZTJIDSGSA-N	431.320	1.345	50	20	IDGD	
CC(=O)Nc1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](F)Br)C3)C2)ccn1	1781329736	JEYFHDXCMJPDFK-WMLDXEAASA-N	443.273	1.174	50	20	IDGD	
O=C(CCCc1cccnc1)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781335568	VWXHAAZQARVFNL-FUHWJXTLSA-N	428.302	1.925	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2)[C@@H]1CCc2ccccc2C1	1781937178	XZZKACHILXZIKS-GLHSZLCASA-N	434.964	1.905	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc3c(cnn3C)c1)C2	1782175749	QNMMIXXZADZJAI-LRXVAGHRSA-N	448.951	1.955	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CSc2nc[nH]n2)C1	1782481015	BGNXVRSOTPOMCQ-RDTXWAMCSA-N	441.630	1.262	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)C3(F)CC3)C2)C1	1782904693	PVJOGKJOACCFIH-UGSOOPFHSA-N	433.908	1.451	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccnc(OC)c3F)CCO2)C1	1783342778	OKRIZGCCAHXQFK-UGSOOPFHSA-N	444.301	1.846	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)C3CCN(c4ccccc4)CC3)CCO2)C1	1783870895	JFSLOZWISKQZSB-NZQKXSOJSA-N	449.979	1.987	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cnn(C)c3C(F)(F)F)CCO2)C1	1783873316	NTUSDEJSDDBSEG-MLGOLLRUSA-N	438.834	1.136	50	20	IDGD	
C[C@@H](C#N)c1cccc(C(=O)N2CCO[C@@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)c1	1783937829	PBLZAMUGIXEAHL-GAJHUEQPSA-N	441.532	1.130	50	20	IDGD	
Cc1cccc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Br)C[C@@H]32)n1	1784222622	VSEYWTSYYSPSJX-QEWYBTABSA-N	428.302	1.603	50	20	IDGD	
Cc1noc(C)c1CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)Br)C[C@@H]21	1785087076	TXMQHKZKEABGPH-NZBMOFRJSA-N	428.327	1.597	50	20	IDGD	
COc1cnc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Br)C[C@@H]32)c(F)c1	1785740995	NVODJMYRAQNWQF-PBLBJHRBSA-N	448.264	1.513	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3noc4c3CCCC4)C[C@@H]21	1786406120	SLSPLVDCPMXMHH-NOLJZWGESA-N	440.338	1.932	50	20	IDGD	
COC(=O)N[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]2C1)c1ccccc1	1787443805	TYTKJRVSISOYBK-VIQHNZTISA-N	441.887	1.598	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc4ccccc4n3)[C@H]2C1	1787802814	RUSANBKDPTWHMK-ZTENYAIWSA-N	432.908	1.477	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc4ccc(F)cn34)C[C@@H]21	1788763815	VKOFHSIDKMGIEX-ZVZYQTTQSA-N	448.571	1.918	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(Cl)nn3)C[C@@H]21)[C@@H](F)Br	1789924430	CZSWXHVUMXOCRQ-LKAMGYQZSA-N	435.681	1.414	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4nncn4c3)C[C@@H]21)[C@H](F)Br	1789926157	PCVQADMSVBOLIR-ABHRYQDASA-N	440.273	1.013	50	20	IDGD	
Cc1cc(CC(=O)NC2(c3ccc(NC(=O)CCC(=O)NN(C)C)cc3)CCC2)nn1C	1791599508	KRIFTHKNOSKMLT-UHFFFAOYSA-N	440.548	1.778	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3cc(F)ccc3F)[C@H]2C1	1792136486	ITSKGMONTJOHED-PTOXDTDZSA-N	430.879	1.741	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)NNc1ccccc1	1792511996	YSXOBTLAJABAKJ-WVCIDPQESA-N	439.354	1.365	50	20	IDGD	
CC(C)[C@@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCl)N1Cc2ccccc2C1=O	1793106423	GMCPYJUCHPUEDT-VYMYIBDJSA-N	447.963	1.905	50	20	IDGD	
CCOC(=O)N(CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCl)Cc1ccco1	1793116766	SVHAFMAQYYWATR-IVSAIRAKSA-N	441.912	1.476	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)COCCOCCOCCOC)C2	1793684553	HNJWFHHORHZYLZ-RDGPPVDQSA-N	448.988	1.728	50	20	IDGD	
COc1ncccc1CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2	1794091991	DRZRIQQOYSJYSF-JLVBRIDZSA-N	440.338	1.397	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnnc(Cl)c1	1794209425	PNLPAKFJICNSFN-ZKCLLBTKSA-N	431.718	1.364	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2)c1nc(Cl)ccc1F	1794232299	AFFSGTKXHQJSLZ-WDAIWFPHSA-N	434.693	1.862	50	20	IDGD	
Cc1nc(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)c(C)s1	1794467787	SYYQMUMABYGTFD-QDMKHBRRSA-N	442.545	1.253	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c(c1)C(=O)CC3)C2	1795115090	HPOBJFDTEOWGJL-CCWDJLKJSA-N	435.318	1.804	50	20	IDGD	
CC(=O)N[C@@](C)(C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Cl)c1ccccc1F	1796367276	DGTMFEPOHAACQH-UZSUOLLMSA-N	443.878	1.301	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1cnnc2ccccc12	1796890085	VUKBZJLDNPEIKU-OJXGSEEGSA-N	437.269	1.524	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1=NO[C@H](c2ccccc2)C1	1797179202	NWFPQBFDAGVKOQ-MGGVOPSTSA-N	435.908	1.347	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccn2ccnc2c1	1797448475	BCUQLWOSKLSECJ-JYYAWHABSA-N	435.322	1.711	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1c[nH]c2cnccc12	1797562039	HIFBRLGJTHBDSD-KOFHJDLBSA-N	435.322	1.797	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H](F)C[C@H]1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](O)CCl)C2	1797676966	ALMCLAASMFHBFU-VJQRDGCPSA-N	447.935	1.572	50	20	IDGD	
O=C(COc1cc(Cl)ccn1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2	1797904352	JSCSCZUBGLQRDZ-DPIQGUFMSA-N	446.729	1.488	50	20	IDGD	
CC[C@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnccc1C(=O)NN)N(CC)CC	1798439547	HZGKFMWFJIXLGY-YYAJDYIMSA-N	430.553	1.057	50	20	IDGD	
Cc1ncccc1CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Br	1799344333	IFQWIMMMHOPPIZ-YALNPMBYSA-N	428.302	1.603	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Br	1799347833	XFSXWVDGZUDXAZ-QGKZMRNZSA-N	430.112	1.440	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CC13CCCN1CCC3)C2)[C@@H](F)Br	1799348577	LHXKREYCCPOQGB-OCVGTWLNSA-N	432.334	1.285	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cn1nccn1	1800248482	JIPJJLLZDDHQCN-FZBFXSHXSA-N	426.427	1.802	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CSc1ncccn1)C2	1800639586	JNRGCZFFGUIQDC-XFMPKHEZSA-N	443.367	1.332	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnn3ncccc13)C2	1800639831	OIHDJLNAQNAMEM-LMWOUKEDSA-N	436.310	1.106	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1n[nH]c3c1CC[C@H]3C)C2	1800641227	SIVCNDNJUHSUAT-JNZVMSIHSA-N	439.354	1.836	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)CN(CC)CC)C2	1800643622	YISZRQHLRFUSTD-SIRPWMCASA-N	432.403	1.727	50	20	IDGD	
CCc1nn(C)c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)Br)c1Cl	1800758314	SOZKOXRDRLLKBX-NJBDSQKTSA-N	447.761	1.623	50	20	IDGD	
O=C(CCc1cnc2[nH]ccc2c1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2	1800846379	DJPSZKLXGHCFJN-MIFYACCESA-N	425.316	1.889	50	20	IDGD	
C[C@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](CO)NC(=O)OC(C)(C)C)C2	1801961003	DAETYBFCNRRCRI-HPCHECBXSA-N	448.358	1.294	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc3ccn(C)c13)C2	1802336765	XRZNHRBXUQXWDK-BCDXTJNWSA-N	425.533	1.803	50	20	IDGD	
CC1(C(=O)NC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)CCC1	1802422908	MEVZKMPTJLXGIC-QFBILLFUSA-N	436.516	1.590	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H]2Cc3ccccc3CN2)[C@H]1c1cccnc1)[C@H](O)CCl	1803138578	CRPRJQVFHHXKCZ-BQJUDKOJSA-N	442.947	1.402	50	20	IDGD	
C=C(Oc1ccccc1O)C(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]1c1cccnc1	1803139680	SWGMZNZZUTXBCG-YVWKXTFCSA-N	445.903	1.985	50	20	IDGD	
COc1ncc(C(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)cc1C	1803140333	CJVOCTNMZKJNDV-NJAFHUGGSA-N	432.908	1.713	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cn3ccsc3n2)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803142873	LOCXVPMJOMDRJB-CWRNSKLLSA-N	433.921	1.710	50	20	IDGD	
CC(=O)Nc1ccccc1C(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]1c1cccnc1	1803145557	FCRZISDYNKARFZ-NSISKUIASA-N	444.919	1.959	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)/C=C/C2CC2)[C@@H]1c1cccnc1	1803189650	AXKWJMGPZYGAGO-HAYFENEFSA-N	434.500	1.366	50	20	IDGD	
Cc1cc(Cl)cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)c1	1803631314	CTMFZUHNALLJNG-ACDBMABISA-N	426.709	1.894	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)CN2C(=O)CNC2=O)[C@H]1c1cccnc1	1803686500	OEMQNEBZCGQPLI-VKJFTORMSA-N	435.912	1.047	50	20	IDGD	
Cn1ncnc1C(=O)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@H]1c1cccnc1	1805280410	ZEGYDTYAXAHBKK-AVGNSLFASA-N	425.262	1.220	50	20	IDGD	
Cc1nocc1C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1	1805823313	CONNYGSRYDQZOD-HNAYVOBHSA-N	449.471	1.010	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1807367064	PTYUMZMFKSJZMQ-YTQUADARSA-N	429.713	1.098	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1CCN(C(=O)[C@@H]2CCC(=O)N2)[C@@H]1c1cccnc1	1808296566	SCGWNIVGEBFRFR-BFIPOCKSSA-N	427.332	1.602	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)Cc2cncnc2)[C@@H]1c1cccnc1)[C@H](F)Br	1808651396	KVVFBRLXHQPNNS-UAGQMJEPSA-N	436.285	1.811	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)N1CC[C@H](CNC(=O)[C@@H](F)Br)[C@H]1c1cccnc1	1808662504	MDOCTAWSISMERI-RAEVTNRLSA-N	443.317	1.645	50	20	IDGD	
CN(C)CC(=O)N1CCCC2(CCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CC2)C1	1809161316	SJHCXHHESHZSMU-INIZCTEOSA-N	445.004	1.911	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)c3cccn4nccc34)CC2)C1	1809974541	VTDBZSGITJZRQQ-UHFFFAOYSA-N	446.316	1.173	50	20	IDGD	
O=C(COC(=O)C(F)(F)F)NC[C@@H]1CCN(C(=O)[C@H](F)Cl)[C@H]1c1cccnc1	1810183301	PQSZTAVKXVFBKN-DRZSPHRISA-N	425.766	1.727	50	20	IDGD	
C/C=C/C=C\C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1	1810305959	RKNBXDMIHQWVMO-RIBBNGDISA-N	434.500	1.532	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)C2(F)CC2)[C@@H]1c1cccnc1	1812457019	ORJSXEIJJOKBLS-RMEHUUNGSA-N	440.479	1.724	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)Cc2cc(C)n(C)n2)[C@@H]1c1cccnc1	1813028598	PUZOWMBAZFTZDT-XKGZKEIXSA-N	433.940	1.626	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1	1813030532	IZMGQTIBTBBFSR-DHSIGJKJSA-N	434.880	1.461	50	20	IDGD	
COc1nccc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@H](O)CCl)CC3)c1F	1815813294	SWWALTMNEXNNPF-GZMMTYOYSA-N	428.873	1.511	50	20	IDGD	
Cn1nc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)CCBr)[nH]n2)cc1O	1816121450	FXIRNYMGMOWKLG-GFCCVEGCSA-N	425.287	1.940	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)C(Cl)Cl)CC2)c1cccn2c(O)nnc12	1816968479	MOUUUEZGZXIAHC-SSDOTTSWSA-N	441.300	1.921	50	20	IDGD	
CCn1nc(C)cc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1	1817841410	HRTIDCZOMFMIOR-MRXNPFEDSA-N	444.540	1.613	50	20	IDGD	
CCOCCC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819404149	BBFZSGVAWGJFGB-INIZCTEOSA-N	429.481	1.141	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3cc(=O)nc4cccnn34)sc2C1	1821268428	PRKPRXJXRIVLHV-WDEREUQCSA-N	446.920	1.789	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CN2CCCCC2=O)n[nH]1	1822303385	HCTSSKWRZOTOSZ-HIFRSBDPSA-N	425.917	1.668	50	20	IDGD	
CC[C@H](C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1)N(CC)CC	1822410678	ONQUKGWUWIAWLP-MSOLQXFVSA-N	449.600	1.895	50	20	IDGD	
O=C(N[C@@H]1CCc2nc(NC(=O)[C@@H]3CC[C@H]4CCC(=O)N4C3)sc2C1)[C@@H](F)Cl	1822624197	XWKYQSFXRGXJDE-YYHMBLRTSA-N	428.917	1.991	50	20	IDGD	
O=C(N[C@@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1)c1cc[n+]([O-])cc1	1823007705	RZLCWTVKVQOFIE-BXKDBHETSA-N	429.271	1.693	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3ccccc3C(N)=O)sc2C1	1823451156	QJWKFJNXVORTRQ-GWCFXTLKSA-N	436.921	1.722	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC[C@@H]1C1CCN(C(=O)C(F)(F)Cl)CC1	1827060674	WTRYWVKXAFPFRX-MRXNPFEDSA-N	428.672	1.431	50	20	IDGD	
COc1ccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)nc1	1827961791	LJQGOAVPVPJWGN-HXUWFJFHSA-N	445.564	1.697	50	20	IDGD	
CC(C)N[C@@H](C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2)C(C)C	1830357990	OCCRRYFNHBEXLK-DYESRHJHSA-N	432.005	1.730	50	20	IDGD	
COc1cccc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)n1	1830358629	PVZMVTIMTXSDMA-NRFANRHFSA-N	439.940	1.354	50	20	IDGD	
CC(C)=NO[C@H](C)C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](C)CBr)CCO2)C1	1830543276	OMRPUVYXNKZVPI-RKVPGOIHSA-N	448.358	1.275	50	20	IDGD	
O=C([C@@H]1CC(c2ccccc2)=NO1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1831254134	FWDCHXHCYCDFFJ-ZWOKBUDYSA-N	439.871	1.170	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccc(O)cn3)C2)C1	1831658955	KFGXSZUGZXXDII-XLIONFOSSA-N	425.913	1.194	50	20	IDGD	
O=C(CCCc1ccncc1)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1833060043	QFUAVEVCSDUJAE-IBGZPJMESA-N	430.332	1.664	50	20	IDGD	
C[C@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)[C@@H]3CCOC3)CC2)CC1	1833266257	XCFPMNFBJWYFTN-HUUCEWRRSA-N	430.387	1.626	50	20	IDGD	
CC[C@@H](C(=O)NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)N(CC)CC	1833535918	SOZNHNGYVOILOG-OALUTQOASA-N	431.021	1.278	50	20	IDGD	
CCc1[nH]nc(C(=O)N2CCO[C@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)c1F	1833732880	NRQOLBUABBSLHG-LJQANCHMSA-N	430.908	1.446	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)c3ccnnc3)CC2)CC1	1834140491	MXYVHLBRIWSMAF-AWEZNQCLSA-N	438.370	1.693	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cccnc3OC)CC2)CC1	1834178296	MLLHLSDDGYWAPM-SFHVURJKSA-N	438.956	1.529	50	20	IDGD	
C[C@H](C(=O)N1CCOC[C@]2(CN(C(=O)CCBr)CCO2)C1)c1ccccn1	1834826461	QLWOSIJKNYNPST-KXBFYZLASA-N	440.338	1.427	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3ccccc3)CCO2)C1	1834842101	QYJVMWLLAAPSCU-OXJNMPFZSA-N	439.350	1.859	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)C3CC3)CC2)CC1	1835118060	NCPJITARFRUJOA-MFKUBSTISA-N	428.537	1.102	50	20	IDGD	
CCc1[nH]nc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](Cl)CC)C3)C2)c1Cl	1836230780	DXXYTRMVUTXVMR-XIKOKIGWSA-N	433.336	1.713	50	20	IDGD	
CCOc1cnc(C(=O)N2CCC(OC3CCN(C(=O)[C@H](O)CCl)CC3)CC2)cn1	1836714958	GBOCZDVDHPJXBF-QGZVFWFLSA-N	440.928	1.087	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc4cn[nH]c4cn3)CCO2)C1	1837193564	SOOWMFCVGSCNRL-QRWLVFNGSA-N	435.912	1.435	50	20	IDGD	
C=C[C@H](O)C(C)(C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)CBr)C2)C1	1837391336	LDRXRBBFJINYOJ-YZVOILCLSA-N	447.370	1.047	50	20	IDGD	
Cn1ccc(C(=O)N2CCC(OC3CCN(C(=O)CCBr)CC3)CC2)n1	1837489011	HFTWPZCCQLTENN-UHFFFAOYSA-N	427.343	1.817	50	20	IDGD	
O=C(CC1CCCC1)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1	1837609020	ILODLEXSWUUXGN-UHFFFAOYSA-N	442.365	1.559	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCC(OC2CCN(C(=O)CN)CC2)CC1	1837838675	YIVANHKUHHBCHQ-LFIBNONCSA-N	432.471	1.829	50	20	IDGD	
O=C([C@H](F)Cl)N1CCC(OC2CCN(C(=O)[C@@H]3CC[C@H]4CCC(=O)N4C3)CC2)CC1	1838083872	CQFPGAFCVQCCFA-VCBZYWHSSA-N	443.947	1.920	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ncoc3C)CCO2)C1	1838208345	DGFOFYDXBLMQQT-DYVFJYSZSA-N	430.299	1.227	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(F)c3)CCO2)C1	1838909214	RVDYGEZECQJQIW-AUUYWEPGSA-N	443.313	1.927	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccc4c(c3)CCO4)C2)C1	1839147713	AGNUYGIQISYZJR-XMSQKQJNSA-N	436.936	1.638	50	20	IDGD	
O=C([C@H](F)Br)N1CCO[C@@]2(COCCN(C(=O)C3(C(F)(F)F)CC3)C2)C1	1839200591	KUKLNSJVKCJIFK-GWCFXTLKSA-N	447.223	1.476	50	20	IDGD	
CC(C)C1(C(=O)N2CCOC[C@]3(CN(C(=O)[C@H](F)Br)CCO3)C2)CCC1	1839203662	RKKFWVZBKYJSEH-YOEHRIQHSA-N	435.334	1.960	50	20	IDGD	
CC(C)C(=O)N1CCOC[C@]2(CN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)CCO2)C1	1839743302	IYDSEFWFBYRTSB-CQTHNFAISA-N	433.455	1.984	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)C(Cl)Cl)CCO2)C1	1840189863	QANOULNYBWITPI-HZMBPMFUSA-N	432.142	1.420	50	20	IDGD	
COc1ccc(F)cc1CC(=O)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1840252584	YRTLTVHVJHQGNR-IBGZPJMESA-N	449.306	1.637	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC12CN(C(=O)c1nc3ccccc3n(C)c1=O)C2	1841287513	RRASZEDQLXZNTQ-ZDUSSCGKSA-N	447.333	1.782	50	20	IDGD	
CCC(=O)N[C@H](C)C(=O)N1CCCC12CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1841532289	OQUZHUAKVKWJQZ-KGLIPLIRSA-N	444.960	1.237	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)c2c(C)noc2N)C1	1842906490	DFCJVLJDVAZONI-UHFFFAOYSA-N	443.416	1.530	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2snnc2C2CC2)C1	1843578561	XIRVLIPUPOFHGW-WSDLNYQXSA-N	441.517	1.367	50	20	IDGD	
CC#CC[C@@H](C(=O)N1CC2(CCCN2C(=O)c2cnccc2C(=O)NN)C1)c1ccccc1	1844264682	WQJGNQNADZENBQ-LJQANCHMSA-N	445.523	1.699	50	20	IDGD	
CC(C)(C)OC(=O)NCC[C@H](O)C(=O)N1CCCC12CN(C(=O)CCBr)C2	1845221642	KVYFJPKCAMPXDT-ZDUSSCGKSA-N	448.358	1.251	50	20	IDGD	
C[C@H](C(=O)N1CCCC12CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)n1cncn1	1846598151	SNMYMXRAUVTIFF-KGLIPLIRSA-N	440.932	1.175	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CN1C(=O)CSC1=S	1847501458	CGBLJEDDCPECJT-DCAQKATOSA-N	434.381	1.080	50	20	IDGD	
CC[C@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl	1847568670	HQZFCXLFCXVLJI-QXKUPLGCSA-N	431.961	1.727	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)N3CC[C@H]4[C@@H]3CCN4C(=O)c3ccc(B(O)O)cc3)c[nH]2)cc1	1848310174	OOXYZAOUEYFALS-GOTSBHOMSA-N	443.312	1.799	50	20	IDGD	
CCOC(=O)c1cc(C(=O)OCC(=O)NNC(=O)c2ccc(C)cc2)cc([N+](=O)[O-])c1	10855957	SFXPGCWLZCYCIV-UHFFFAOYSA-N	429.385	1.698	50	20	IDGD	
COc1ccc(-c2n[nH]cc2C(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1	11260664	DAWBMJSZBKZJAK-UHFFFAOYSA-N	428.474	1.453	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)COCc1nc2ccccc2s1	12702172	TYAWYOWZISHORH-UHFFFAOYSA-N	447.542	1.876	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)CN2C(=O)[C@@H](C)Oc3ccccc32)cc1	115402100	QDXSDONXXLVKLU-LSDHHAIUSA-N	427.457	1.814	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)N[C@@H](C)c2nc(C)no2)c2ccccc2c1=O	726277544	CQSHFAYQXJRDOG-LBPRGKRZSA-N	427.465	1.983	50	20	IDGD	
O=C(CCCc1ccccc1)NNC(=O)c1ccccc1S(=O)(=O)N1CCOCC1	727717442	SJDGAHODDDUXQY-UHFFFAOYSA-N	431.514	1.491	50	20	IDGD	
N#Cc1cccc(C(=O)NNS(=O)(=O)c2cc(Br)cc(C(=O)O)c2F)c1	728853456	MSQRIZWBNWMQGJ-UHFFFAOYSA-N	442.222	1.781	50	20	IDGD	
Cc1cccc(C)c1NC(=O)CNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1	728959665	ORKJTCBLEDMCSV-UHFFFAOYSA-N	425.493	1.279	50	20	IDGD	
NC(=O)c1ccc(Oc2ccc(C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)cc2)cc1	729299820	WAKUWLWEOFBFFU-UHFFFAOYSA-N	443.423	1.628	50	20	IDGD	
COc1cc(OC)cc(C(=O)N2CCC(C(=O)NNC(=O)CNc3ccccc3)CC2)c1	729513687	INTFXLLJWAFUOR-UHFFFAOYSA-N	440.500	1.816	50	20	IDGD	
CCn1c(=O)c2ccccc2n(CC(=O)NNC(=S)Nc2ccc(N(C)C)cc2)c1=O	729689698	QLYGUHWYEIEYSI-UHFFFAOYSA-N	440.529	1.267	50	20	IDGD	
COC(=O)c1ccc(S(=O)(=O)NNC(=O)c2ccc(OC)cc2OC)c([N+](=O)[O-])c1	729963474	GBAXNRWVOHVLIM-UHFFFAOYSA-N	439.402	1.022	50	20	IDGD	
O=C(CN1C(=O)N[C@]2(CCc3ccccc32)C1=O)NNC(=O)c1cccc2ncccc12	730227672	KHADHKGCXRXZJV-QHCPKHFHSA-N	429.436	1.389	50	20	IDGD	
O=C(CNC(=O)c1c(F)cccc1Cl)NNC(=O)C1CCN(c2ncccn2)CC1	730591036	DYHIZUDAVBJDKP-UHFFFAOYSA-N	434.859	1.063	50	20	IDGD	
CC(C)(C(=O)NNC(=O)c1ccc(F)c(S(=O)(=O)N2CCOCC2)c1)c1ccccc1	731174514	JIIFHKBAPGKTHH-UHFFFAOYSA-N	449.504	1.585	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNS(=O)(=O)c1ccc(Oc2cccc(Cl)c2)cc1	731177035	BCRUDAXKWYGRLJ-NSHDSACASA-N	447.922	1.380	50	20	IDGD	
CC(C)(C(=O)NNC(=O)CCC/N=C1/NS(=O)(=O)c2ccccc21)c1ccccc1	731201267	LHYUGDGATKJWQA-UHFFFAOYSA-N	428.514	1.631	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)c2ccccc2OC)cc1	731494001	GEOWCDPBCRADJR-UHFFFAOYSA-N	441.531	1.349	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CCn2c(=O)n(C)c3ccccc32)cc1Br	732035846	NCZMPHLLGNUVSQ-UHFFFAOYSA-N	447.289	1.962	50	20	IDGD	
CCOc1cc(CNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)ccc1OC	734009765	CXOQRWSTKPTCCP-UHFFFAOYSA-N	428.493	1.631	50	20	IDGD	
Cc1ccc2c(=O)c(C(=O)OCC(=O)NNC(=O)c3cccc(Cl)c3)cn(C)c2n1	734038764	RXPQDVQOWJJDNN-UHFFFAOYSA-N	428.832	1.513	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)N[C@H]1CCCN(c2ccccc2)C1	734516293	FXJOLVCNZMHMCO-HNNXBMFYSA-N	430.534	1.593	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)[C@@H]2CC(=O)N(C)[C@@H]2c2cccc(Cl)c2)C[C@@H](C)O1	734543611	QJIGMONQYVUAJE-HXFPYSNGSA-N	436.940	1.506	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)NCCNS(=O)(=O)c1ccccc1[N+](=O)[O-])c1ccccc1	735190830	QFSWDJRBKMFDAN-HNNXBMFYSA-N	449.489	1.397	50	20	IDGD	
COC(=O)[C@H](NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1)c1cccc(Cl)c1	735507000	GIVIACRBHAASHL-GOSISDBHSA-N	439.921	1.804	50	20	IDGD	
CCC(COC)=NNC(=O)C[C@@H]1c2cc(OC)c(OC)cc2CCN1S(C)(=O)=O	735972868	WMXDRADUTZBQEH-MRXNPFEDSA-N	427.523	1.481	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN2CCN(CCN3[C@@H](C)CC[C@H]3C)CC2)cc1C	738308186	FCQYYBSAWNKTQB-HDICACEKSA-N	435.638	1.870	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCc2n[nH]cc2Br)cc(OC)c1OC	738447962	QRHLDMOSFJJEQE-UHFFFAOYSA-N	428.243	1.342	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)[C@@H](NC(=O)Cc1ccc2ccccc2c1)C(C)C	740850877	CRNPOTJNIUGVBL-NRFANRHFSA-N	440.544	1.975	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)[C@H]1Cc2ccccc2CN1C(=O)OC(C)(C)C	740851064	NXQBGENGDQDHNZ-QGZVFWFLSA-N	432.521	1.801	50	20	IDGD	
CC(C)CNC(=O)N1CCC[C@H](CC(=O)NNC(=O)c2nnc(O)c3ccccc23)C1	741207791	RAXWUUDMRPZEIZ-CQSZACIVSA-N	428.493	1.564	50	20	IDGD	
CC(C)(C)CC(=O)Nc1ccc(Cl)c(C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)c1	741894379	HQLQMOZMACWZIP-LLVKDONJSA-N	429.926	1.910	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNS(=O)(=O)c2cccc(-c3nnnn3C)c2)cc1	742026216	OXMJUQDKZNOJDP-ZDUSSCGKSA-N	446.489	1.053	50	20	IDGD	
Cc1nn(C)c(C)c1C[C@@H](C)C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	742035086	YCXRGHLRAFUAKO-CQSZACIVSA-N	447.561	1.461	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)[C@@H]1CCCN(c2ncnc3sccc23)C1	742470107	OLZHIBUHWNCENW-CXAGYDPISA-N	439.497	1.895	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=S)N[C@H]2CCc3ccccc3C2)ccc1Cl	742978101	OVGZVKINMZICOL-AWEZNQCLSA-N	438.962	1.654	50	20	IDGD	
Cc1nn(C)c(C)c1S(=O)(=O)N[C@@H](C)C(=O)NNC(=O)c1cc2ccccc2cc1O	743291325	JVIABQCGQHIEBY-LBPRGKRZSA-N	445.501	1.024	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)NCC3CC3)c2)cc1	743826647	LITYRSMSRPZOEX-UHFFFAOYSA-N	431.518	1.907	50	20	IDGD	
Cc1ccc(-c2noc([C@H](C)N3CCN(CC(=O)NNC(=O)C(C)(C)C)CC3)n2)cc1	744386645	CTUVMFNEAZNIBG-INIZCTEOSA-N	428.537	1.917	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(\C#N)C(=O)OCCNS(=O)(=O)c2cnn(C)c2)c1C	744459968	HISGBUOHGDKFOI-UPAIAECRSA-N	449.533	1.475	50	20	IDGD	
C[C@H](NC(=O)c1cccs1)C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	744621551	SNXABGNQJXRJBL-ZDUSSCGKSA-N	438.531	1.031	50	20	IDGD	
COc1cccc(O[C@H](C)CNC(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)c1	745882471	ODZOFZQYAYXMRO-CQSZACIVSA-N	437.522	1.871	50	20	IDGD	
COC(=O)c1ccsc1N1CC[C@H](NC(=O)NNC(=O)Cc2ccccc2OC)C1=O	746779564	JKYSMDNRJPKKRF-AWEZNQCLSA-N	446.485	1.222	50	20	IDGD	
CS(=O)(=O)Nc1cc(C(=O)NNC(=O)[C@H]2COc3ccccc3O2)ccc1Cl	747144444	FFWQEPFIWYVQIC-OAHLLOKOSA-N	425.850	1.313	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)[C@@H]2CCCN2C(=O)/C=C\c2ccc(C(N)=O)cc2)cc1	747173228	ZIZBITIFYLJWNO-DIBVOSKASA-N	431.452	1.123	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCCC[C@@H]2C)cc1C(=O)NNC(=O)Cc1ccncc1	747324008	WKALWFSBXWRFLK-INIZCTEOSA-N	430.530	1.957	50	20	IDGD	
Cc1cc(C)nc(SCc2ccc(C(=O)NNC(=O)C[C@H]3CCS(=O)(=O)C3)cc2)n1	747458072	DZLQQPVUUJABPV-MRXNPFEDSA-N	448.570	1.972	50	20	IDGD	
CNS(=O)(=O)c1csc(C(=O)NNc2ccccc2S(=O)(=O)NC(C)(C)C)c1	748850209	OPJVZTIEZLGFJG-UHFFFAOYSA-N	446.576	1.490	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NNC(=O)COc2ccc(F)cc2)cc1	750706761	WYPWBHWVJQYCCQ-SFHVURJKSA-N	435.477	1.514	50	20	IDGD	
Cc1cc(C(=O)NNS(=O)(=O)c2cc(C(=O)O)cc([N+](=O)[O-])c2)c2ccccc2n1	751141415	GJJUDGBAYYQPSQ-UHFFFAOYSA-N	430.398	1.773	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccccc1OC(F)F)c1csc(N2CCOCC2)n1	751264159	UPGHWURGKRUTSP-UHFFFAOYSA-N	434.446	1.204	50	20	IDGD	
Cn1c(C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)ccc1-c1ccc(Br)cc1	751302915	NZDQXTZGPYVSAU-GFCCVEGCSA-N	440.319	1.650	50	20	IDGD	
Cn1c(NNC(=O)c2cc(Cn3cc(Br)cn3)on2)nc2ccccc2c1=O	751966119	RHWZNJZSLZPDDJ-UHFFFAOYSA-N	444.249	1.686	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)NCCNS(=O)(=O)c1ccc(Cl)s1	752689010	MRTPUADVSNRQNF-UHFFFAOYSA-N	434.902	1.392	50	20	IDGD	
COc1cc(C(=O)NNC(=O)/C=C\C(=O)Nc2ccc3n[nH]cc3c2)cc(OC)c1OC	752898288	FYPIMXFMFJUTOR-SREVYHEPSA-N	439.428	1.545	50	20	IDGD	
COC(=O)c1cccc([C@@H](NNC(=O)C2CCN(c3ncccn3)CC2)C(=O)OC)c1	754003870	RAJWHOZETZMVEC-QGZVFWFLSA-N	427.461	1.015	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)CNC(=O)c2ccccc2C(F)(F)F)c1	755045492	IFTNDLFBNWEMIW-UHFFFAOYSA-N	425.363	1.914	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N(CC)CC)cc1NC(=O)NNC(=O)Cc1cc[nH]n1	755443235	XDZLLCCICVPMEU-UHFFFAOYSA-N	438.510	1.234	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)Nc1ccc(-c2nnc3n2CCCCCC3)cc1	755585138	ZVRQFCHIBMUBKW-OAHLLOKOSA-N	446.533	1.649	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)Nc2ccc(F)c(N3CCCS3(=O)=O)c2)cc1	756493856	AFYVJCSPFLBTNE-UHFFFAOYSA-N	447.448	1.469	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2coc(S(N)(=O)=O)c2)ccc1OCCC(C)C	757630636	SSYDIESUHNQTGV-UHFFFAOYSA-N	425.463	1.435	50	20	IDGD	
O=C(NCc1ccc2c(c1)CCS2(=O)=O)NNC(=O)c1nn(-c2ccccc2)cc1O	757752050	VVYWOARBHUFRIU-UHFFFAOYSA-N	441.469	1.052	50	20	IDGD	
COCc1nc2n(n1)C[C@H](NC(=O)NNC(=O)Nc1ccc(OC(F)F)cc1)CC2	757774786	IBMIHWHCJILKJR-LLVKDONJSA-N	425.396	1.377	50	20	IDGD	
N#CCn1c(C(=O)N2CCN(S(=O)(=O)CBr)CC2)cc2ccccc21	758516357	ATQLWKSQYKZAGC-UHFFFAOYSA-N	425.308	1.605	50	20	IDGD	
C[C@@H](NC(=O)c1cccs1)C(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758786846	PAOBTCPMQBGRAK-CYBMUJFWSA-N	439.538	1.502	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN(C(=O)c2ccc(Cl)cc2)C1)C(=O)Nc1ccccn1	758829657	FIVLASVEMMLJKW-CQSZACIVSA-N	429.864	1.373	50	20	IDGD	
COC(=O)[C@H](c1cc(F)c(F)c(F)c1)N(C)CC(=O)NNC(=O)Cc1nc(C)cs1	759767368	KWGKNPYGJXGRPF-KRWDZBQOSA-N	444.435	1.405	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cnc(-c3cccnc3)s2)cc1OC	761604275	BVURFDKDMVJHBT-UHFFFAOYSA-N	442.453	1.840	50	20	IDGD	
C[S@](=O)Cc1ccccc1NC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	762929815	RNRQZISIJGVJGA-HKBQPEDESA-N	443.573	1.930	50	20	IDGD	
Cc1cc(C(=O)N2CCSCC2)ccc1NC(=O)C(=O)NNC(=O)c1ccccc1	763423956	ZLMIPUSLEUOYMZ-UHFFFAOYSA-N	426.498	1.584	50	20	IDGD	
Cc1cccc(F)c1NC(=O)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	763509975	XMLOOFCPAOKKIU-UHFFFAOYSA-N	448.476	1.318	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(C(=O)NC(C)(C)C)cc2)cc1	763660452	DJDNZNRAZVHJDK-UHFFFAOYSA-N	442.472	1.388	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(-c3csnn3)cc2)cc1C	763681470	XXKVVAKZBJAKGD-UHFFFAOYSA-N	425.470	1.987	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)C(=O)N(CC2CC2)C3=O)c1	763754137	MLMUXLHMTJBRDK-UHFFFAOYSA-N	449.467	1.158	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)NC(C)C)cc2)c1	763772155	OHQMXZYNQUGTHU-UHFFFAOYSA-N	428.445	1.242	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(C(=O)c3nccn3C)cc2)cc1	763809295	MVKJNFLTBGFKLE-UHFFFAOYSA-N	435.440	1.124	50	20	IDGD	
CC(C)COc1cn(-c2ccccc2)nc1C(=O)NNC(=O)CNC(=O)c1cccnc1	763819842	HIMINFKOSGAFPD-UHFFFAOYSA-N	436.472	1.493	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccccc1N1CCOC1=O	763848252	BBHVNCWYHZLJAF-GFCCVEGCSA-N	430.392	1.336	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cnc3c(c2)COCC3)cc1	763859676	DWAVDZUAHGJUTM-ZDUSSCGKSA-N	428.445	1.106	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2cccc(OCc3cscn3)c2)n1	763890479	AITLKRYFZPOKAQ-UHFFFAOYSA-N	428.474	1.322	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)C(=O)Nc1cnc2c(c1)COCC2	763899978	FMOYETGOSJCEDJ-UHFFFAOYSA-N	437.481	1.986	50	20	IDGD	
CN(C)C(=O)c1cc(=NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCCCCC3)cc[nH]1	763915043	VWEZAXLZQZLVMJ-UHFFFAOYSA-N	443.529	1.326	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)C(=O)N1CC2(CCCC2)c2c(F)cccc21	763917589	YSURGBFWTNSIPM-UHFFFAOYSA-N	449.446	1.421	50	20	IDGD	
COC(=O)c1ccccc1NC(=O)C(=O)NNC(=O)c1ccc(Br)s1	763941686	RRSDTVNVHIPPDA-UHFFFAOYSA-N	426.248	1.697	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)Nc1cccc(NC(=O)C2CC2)c1	764001604	BKQIPJCKGFJTMZ-UHFFFAOYSA-N	448.277	1.536	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1ccc(CCN2CCCC2)cc1	764003251	AKYRXUARXPHPLL-UHFFFAOYSA-N	438.484	1.496	50	20	IDGD	
Cc1nnnn1[C@@H](Cc1cccc(F)c1)C(=O)NNC(=O)CSc1ccccc1O	764043857	YRPNDILLPLRKEW-HNNXBMFYSA-N	430.465	1.550	50	20	IDGD	
COC(=O)c1ccc(OC)cc1NC(=O)C(=O)NNC(=O)Cc1ccc2ccccc2c1	764090660	FNOZDRDDRHFPLU-UHFFFAOYSA-N	435.436	1.964	50	20	IDGD	
CC(=O)NCc1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(C)cc3)[nH]n2)cc1	764109948	DULLIMHMMGNZAK-UHFFFAOYSA-N	434.456	1.421	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2O1)C(=O)N1CCc2cc(Br)cc(F)c21	764153189	JSKGRAMPGVAMBT-OAHLLOKOSA-N	448.248	1.628	50	20	IDGD	
C[C@H](C(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(C#N)cc2)c1)n1cccn1	764178144	YYQWTXDRIKXJLD-CQSZACIVSA-N	445.439	1.354	50	20	IDGD	
COc1ccc(I)c(NC(=O)C(=O)NNC(=O)CC2CCCC2)c1	764178689	GDAVYRKGWSDUMO-UHFFFAOYSA-N	445.257	1.966	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)C(=O)Nc1ccc2c(c1)CCCC(=O)N2	764204682	RQUZOMXRELHSEB-UHFFFAOYSA-N	447.492	1.352	50	20	IDGD	
Cc1nc2ncnn2c(C)c1CCC(=O)NNc1c(F)cc(C(=O)NC2CC2)cc1F	764328842	BAVLJQTYNLLJRY-UHFFFAOYSA-N	429.431	1.987	50	20	IDGD	
CO[C@@H](C)C(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)CCCc2cccs2)c1	764340418	BVLYUQRJUCRPMC-ZDUSSCGKSA-N	432.502	1.830	50	20	IDGD	
CC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1Cl	764343578	SRCKTXRWNMNSAE-UHFFFAOYSA-N	440.847	1.884	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)C(=O)Nc2cc(-c3ccccc3C)nn2C)c1	764430194	GVDSGCKLYKJWAW-UHFFFAOYSA-N	435.444	1.149	50	20	IDGD	
O=C(CSc1nnc(-c2ccco2)n1-c1ccc(Cl)cc1)NNC(=O)c1cnn[nH]1	765426898	IKUPPUMWQSDJAM-UHFFFAOYSA-N	444.864	1.852	50	20	IDGD	
CC(C)(C)OC(=O)NCc1cc(C(=O)NNC(=O)[C@H]2COc3ccccc3O2)ccn1	766136664	WRUBROGAHZTMNF-QGZVFWFLSA-N	428.445	1.707	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)[C@H]1Cc2cc(F)ccc2O1	766663216	JTYKDZGYYVXLCB-HXUWFJFHSA-N	446.910	1.748	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)CN1CCN([C@H](CO)c2ccc(Cl)cc2)CC1	766892082	IIXCRQQNXUOXNT-OAQYLSRUSA-N	444.963	1.690	50	20	IDGD	
COc1cc(C=NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c([N+](=O)[O-])cc1O	767159228	NULCVGVSNQFVOT-UHFFFAOYSA-N	448.457	1.857	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)CCNS(=O)(=O)c3cccnc3)n[nH]2)cc1	768268381	OFWSQJPENZHWRZ-UHFFFAOYSA-N	442.501	1.164	50	20	IDGD	
CC1CCC(NS(=O)(=O)CC(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)CC1	768275690	BVVUHBGXBTWVAZ-UHFFFAOYSA-N	437.497	1.475	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1O)c1cccc(S(=O)(=O)N2CCCC2)c1	768918377	KGPWSQJOUWROOS-UHFFFAOYSA-N	434.430	1.160	50	20	IDGD	
CCN1CCN(C[C@@H](C)CNC(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)CC1	770399744	HVNLQRLPPUTKJX-AWEZNQCLSA-N	433.561	1.187	50	20	IDGD	
CON(C)S(=O)(=O)c1ccc(C(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)cc1	770965890	HAIJKXJEZKXLQM-UHFFFAOYSA-N	449.493	1.226	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)CNC(=O)c1c(Cl)cccc1[N+](=O)[O-]	772106289	PBNCGGHCIVTFJU-SNVBAGLBSA-N	428.829	1.103	50	20	IDGD	
CC(C)c1nccnc1NNC(=O)CCNS(=O)(=O)c1ccc2c(c1)OCCCO2	772817495	WUBVMXATHJVJNE-UHFFFAOYSA-N	435.506	1.573	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)cnn1C1CCCC1	773542518	PIPQJHDPSKGEEW-UHFFFAOYSA-N	436.513	1.697	50	20	IDGD	
Nc1nc(Cl)cc(NNC(=O)[C@@]23CCC(=O)N2c2ccccc2C(=O)N3C2CC2)n1	773863246	UIXRCUXCEDINKK-LJQANCHMSA-N	427.852	1.297	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccccc1C(=O)N(C)C	774007382	HODMEFNMCZDINN-LBPRGKRZSA-N	432.864	1.595	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2c[nH]c3c(F)cc(F)cc3c2=O)cc(OC)c1OC	776317393	FBVBXDVRYSVWOY-UHFFFAOYSA-N	433.367	1.907	50	20	IDGD	
Cn1nc(SCC(=O)NN=CCCOc2ccc(Cl)c(Cl)c2)c(=O)n(C)c1=O	777429738	KBCIRSTYBQSRDV-UHFFFAOYSA-N	446.316	1.449	50	20	IDGD	
Nc1nc(Cl)cc(NNC(=O)[C@H]2CC(=O)N(c3cccc(Br)c3)C2)n1	779374797	GDSTVIONZOKUTI-QMMMGPOBSA-N	425.674	1.971	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)NCCNS(=O)(=O)c2cc(C)sc2C)c1	780844912	VFLGXAKKCOCEMJ-UHFFFAOYSA-N	426.520	1.756	50	20	IDGD	
CC[C@H](C)NS(=O)(=O)Cc1cccc(NC(=O)C(=O)NNc2ncncc2Cl)c1	782160352	QMPPASNELQTYAQ-NSHDSACASA-N	440.913	1.430	50	20	IDGD	
COC(=O)[C@@H](c1cccc(Cl)c1)N1CCN(S(=O)(=O)CBr)CC1	782473138	UXJAVKJSPULJJI-CYBMUJFWSA-N	425.732	1.854	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNc2cncc(Cl)n2)cccc1C(=O)N1CCSCC1	783260045	UQEIXJHHXSDCDW-UHFFFAOYSA-N	434.909	1.709	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2ccnn2Cc2cccc3ccccc23)CCS(=O)(=O)C1	783426474	HMNATRFRNKNZKT-NRFANRHFSA-N	441.513	1.221	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N[C@H](C)C[C@H](C)O)cc1	783628427	JDVIOJLABWXJPS-HJHPPFKDSA-N	425.489	1.617	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)C(=O)Nc1cccc(COc2ccccc2)c1	784001872	FQHAWDQBNFLQHO-UHFFFAOYSA-N	436.424	1.375	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1cc(F)ccc1N1CCCCC1	784003741	NIRDSPRMKKFDFK-UHFFFAOYSA-N	447.492	1.393	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)N[C@H]1CCCN(Cc2ccccn2)C1=O	784317686	JZTICIIJNDWXDI-IBGZPJMESA-N	433.472	1.403	50	20	IDGD	
O=C1CN(c2ccc(NC(=O)C(=O)NNc3cccc([N+](=O)[O-])c3)cc2Cl)CCN1	784829402	YRMAKEQIPGKTQW-UHFFFAOYSA-N	432.824	1.266	50	20	IDGD	
C=CCN(C)S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2cc(F)c(F)cc2F)cc1	784892818	AFNXTKYJBJFTES-UHFFFAOYSA-N	442.419	1.992	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCCCC2)cc1NC(=O)C(=O)NNc1ncc(F)cn1	784949438	LAVPXIXVFKOFMQ-UHFFFAOYSA-N	436.469	1.181	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2cccc(C(F)(F)F)n2)c(OCC(=O)N(C)C)c1	784952035	ZVNCRROSKJDZPG-UHFFFAOYSA-N	439.394	1.958	50	20	IDGD	
COC(=O)Nc1cccc(NC(=O)C(=O)NNc2c(OC)cccc2S(C)(=O)=O)c1	785331293	SKTTULDUGAVUGH-UHFFFAOYSA-N	436.446	1.359	50	20	IDGD	
CC1=C(C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)[C@@H](C)n2ncnc2N1C	788263402	ZJGZPRRVLSOJOR-CYBMUJFWSA-N	436.476	1.315	50	20	IDGD	
CCN1CCN(C(=O)Cc2ccc(NC(=O)NNc3cc(Cl)nc(N)n3)cc2)CC1	789137864	ZPSIOFCZHLPZBB-UHFFFAOYSA-N	432.916	1.567	50	20	IDGD	
COc1c(C)cnc(Cn2cnc(NC(=O)C(=O)NNc3ccc(F)cc3F)n2)c1C	789748355	RRYIBRCRLXWSBS-UHFFFAOYSA-N	431.403	1.707	50	20	IDGD	
O=C(NNc1cccc(F)c1[N+](=O)[O-])C(=O)Nc1cnn(-c2cnc3ccccc3n2)c1	791000277	LRPYDWXAVRDBNU-UHFFFAOYSA-N	436.363	1.945	50	20	IDGD	
Cn1ccc2ccc(NC(=O)C(=O)NNC(=O)c3cc(-c4ccccc4)[nH]n3)cc2c1=O	793023819	WPMGGTQUBYCLCT-UHFFFAOYSA-N	430.424	1.328	50	20	IDGD	
CSSCCNC(=O)C(=O)Nc1cc(Cl)ccc1OCCS(C)(=O)=O	793079921	WTFRLEGXJOJNHQ-UHFFFAOYSA-N	426.969	1.829	50	20	IDGD	
CC(C)(C)OCCCC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	794741392	MOVPJINBDNQPPR-UHFFFAOYSA-N	427.523	1.064	50	20	IDGD	
Cc1nc2c3cccnc3nn2c(C)c1CCC(=O)NNC(=O)COc1ccc(C#N)cc1	794759257	JWIXNSYHDLPUPH-UHFFFAOYSA-N	443.467	1.925	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)COCc2ncc(C)o2)c2ccccc2c1=O	794772708	DAVMJLBKLSPEMY-UHFFFAOYSA-N	427.461	1.861	50	20	IDGD	
CCOC(=O)c1ccc(OC)c(S(=O)(=O)NNC(=O)c2c(C)nc3ccccn23)c1	795280830	NKUMGANQSXDMDB-UHFFFAOYSA-N	432.458	1.451	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(S(=O)(=O)C3CCCC3)cc2)n1	797370393	BHFNJZVUMBPXDU-UHFFFAOYSA-N	430.486	1.506	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2CCCN2C(=O)Cc2cccs2)cc1C	798309354	LGEIPZQIIYALAK-QGZVFWFLSA-N	428.514	1.685	50	20	IDGD	
O=C(NNc1cc([N+](=O)[O-])ccc1Br)C1=CC=CN2CCS(=O)(=O)N=C12	800619235	KNUCVUSPNPYDGI-UHFFFAOYSA-N	442.251	1.298	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)NCCCNC(=O)/C=C/c2ccccc2)nc2ccccc21	800761037	HKURFAVHEFBZLE-OUKQBFOZSA-N	434.500	1.666	50	20	IDGD	
CN(C)S(=O)(=O)CCC(=O)NNc1c(Br)cccc1Br	801502520	MVOUGLAIHRIODQ-UHFFFAOYSA-N	429.134	1.936	50	20	IDGD	
CC(C)NC(=O)NC1(C(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)CCCCC1	802063961	UNNFDIUFFWGAHP-UHFFFAOYSA-N	439.538	1.653	50	20	IDGD	
CC(=O)c1cc(Br)ccc1OCC(=O)NNC(=O)CNC(=O)OC(C)(C)C	803054213	MQDXXSWAWXWXGA-UHFFFAOYSA-N	444.282	1.703	50	20	IDGD	
CCN=c1nc(NCC)n2c(SCC(=O)NNc3ccc([N+](=O)[O-])cc3C)n[nH]c2n1	805374358	LHGZQBFKFZNLSL-UHFFFAOYSA-N	446.497	1.257	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)NC[C@H]2CCCS(=O)(=O)C2)cc1OC	806041984	NNGPEADKAKYNQK-CQSZACIVSA-N	427.523	1.643	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)c1c(F)cncc1F	807557202	VSMLMIDMMRUEDO-SNVBAGLBSA-N	427.433	1.315	50	20	IDGD	
O=C(NNc1ccc(-n2cccn2)nn1)N[C@@H]1CCCN(C(=O)CCC(F)(F)F)C1	807574201	NHIRULXNMYFOJG-GFCCVEGCSA-N	426.403	1.622	50	20	IDGD	
O=C(COc1cc(F)cc(F)c1)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	809983950	XUMPTPDTKXJEJX-UHFFFAOYSA-N	439.440	1.589	50	20	IDGD	
CCOc1cc(Br)c(F)cc1NC(=O)C(=O)NNC(=O)c1cccn1C	810385063	VWGRCECOTUFSDZ-UHFFFAOYSA-N	427.230	1.725	50	20	IDGD	
Cc1cc(C(F)(F)F)ncc1NC(=O)C(=O)NNC(=O)CSc1ccccc1O	810387174	JDMJCVHGKGXNDB-UHFFFAOYSA-N	428.392	1.993	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1c2c(cc3c1CCC3)CCC2	810396264	USWMOIYXHOUZKD-UHFFFAOYSA-N	426.498	1.241	50	20	IDGD	
Cc1noc(C)c1S(=O)(=O)NCC(=O)NNc1nc(-c2ccc(Cl)cc2)no1	810397530	RAZFGPSVARIZMI-UHFFFAOYSA-N	426.842	1.416	50	20	IDGD	
COc1cc(C(C)=NNC(=O)Cc2cc(O)nc(S)n2)ccc1OCCCC(=O)O	814783576	NTMOUKHBPCZWFK-UHFFFAOYSA-N	434.474	1.806	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)/C=C/CN(C)CC(F)(F)F)CC2)cc1	815827313	UGVZVFNRROLRIY-ONEGZZNKSA-N	441.498	1.310	50	20	IDGD	
Cc1[nH]c(-c2ccncc2)nc(=O)c1CC(=O)NNc1ccccc1S(=O)(=O)N(C)C	817053854	IXAKEQUHIIYTJB-UHFFFAOYSA-N	442.501	1.076	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)c1ccc(C(F)(F)F)nc1O	821892839	UNWMXEDGINDHII-UHFFFAOYSA-N	437.422	1.779	50	20	IDGD	
O=C(NNC(=O)c1cc2c(F)cccc2[nH]1)c1cccc(S(=O)(=O)N2CCOCC2)c1	822714395	FRIHFYSEGIBVOD-UHFFFAOYSA-N	446.460	1.403	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(I)cc1)c1ccc2c(c1)OCO2	906369589	PWAGSEWJNXNKLD-UHFFFAOYSA-N	446.222	1.643	50	20	IDGD	
NC(=O)c1ncn2c(C(=O)NNC(=O)Cc3ccc(Cl)cc3)cc(-c3ccco3)nc12	913081846	IULFWXDFLDBXIJ-UHFFFAOYSA-N	438.831	1.745	50	20	IDGD	
COc1ccc(CCN2C[C@@H](C(=O)NNC(=O)NC3CCCCC3)CC2=O)cc1OC	913450812	ANWCNYIJYANFLI-INIZCTEOSA-N	432.521	1.758	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@H](C)CCc2ccc(O)cc2)cc1	916235317	LIASPYCBEJUWDY-MRXNPFEDSA-N	448.545	1.673	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NN=C2CCS(=O)(=O)c3ccc(F)cc32)c1	916305929	BXOQDIQYYIEOQZ-UHFFFAOYSA-N	439.490	1.388	50	20	IDGD	
O=C(NCCNS(=O)(=O)Cc1ccccc1)NNC(=O)C12CC3CC(CC(C3)C1)C2	916516549	CUGVLCQZXMCROD-UHFFFAOYSA-N	434.562	1.653	50	20	IDGD	
COC(=O)c1ccc(Br)c(S(=O)(=O)NNC(=O)c2ccccc2O)c1	917717279	IYZXEHTYAMCEDS-UHFFFAOYSA-N	429.248	1.565	50	20	IDGD	
O=C(NCCCCn1ccnc1)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	918139775	YFFLLKBJLYBETG-UHFFFAOYSA-N	448.549	1.482	50	20	IDGD	
CC(=O)N[C@@H](C)c1ccc(S(=O)(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)s1	918399944	UZKHCWILKHRJKF-LBPRGKRZSA-N	438.531	1.510	50	20	IDGD	
C[C@H](c1ccccc1)N1CC[C@H](NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)C1	919786592	XIBXYZYVQHUFBX-QAPCUYQASA-N	430.530	1.870	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)NCCN2C(=O)c3ccccc3C2=O)cc1	919788662	SMPZFOPVEPHIFF-CQSZACIVSA-N	440.456	1.479	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)[C@H](Cc2cccc(OC)c2)n2nnnc2C)cc1	920012277	LIABYVYEVOZMGY-FQEVSTJZSA-N	438.488	1.563	50	20	IDGD	
CCNC(=O)NNC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(Br)s2)C1	920858665	WDUPSWMYBDXECS-SECBINFHSA-N	439.357	1.262	50	20	IDGD	
CCCNC(=O)NNC(=O)c1cc(S(=O)(=O)NCC(C)C)ccc1Br	921042981	YODWLYBTVYRBNZ-UHFFFAOYSA-N	435.344	1.737	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNS(=O)(=O)c2ccc3c(c2)COC3)CC1	1116087397	JGQGWCKWHDVSCO-UHFFFAOYSA-N	425.507	1.673	50	20	IDGD	
CCN1C(=O)C(=CNNC(=O)c2ccc(Br)cc2)C(=O)N(CC)C1=S	1317726195	MABCBEPVBHHWAZ-UHFFFAOYSA-N	425.308	1.563	50	20	IDGD	
O=C(NCCN1CCN(c2ccccc2)CC1)NNC(=O)c1cncn1-c1ccccc1	1317868481	SOYAAXQUGAWCFW-UHFFFAOYSA-N	433.516	1.639	50	20	IDGD	
O=C(NNC(=O)c1nc(-c2ccc(F)cc2)n2c1CCCCC2)N[C@@H]1CCS(=O)(=O)C1	1317977187	BIYZDDBEDIQNGW-OAHLLOKOSA-N	449.508	1.547	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCC2CCOCC2)c1	1318614905	AVKAORBQKKFGDD-UHFFFAOYSA-N	426.539	1.478	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)C(=O)Nc3cccnc3)C2)C1	1779204130	AXTHMAIVDNAKQB-MSOLQXFVSA-N	429.304	1.086	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)N2CCO[C@@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)n1	1779296424	PUOIBZQUHIXLBX-HXUWFJFHSA-N	434.569	1.335	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cc(O)cc([N+](=O)[O-])c1)CCO2	1779299463	UXNBFLMFFRTQRL-LJQANCHMSA-N	437.525	1.595	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCBr)C2)[C@@H](F)Br	1780771911	SOKUOPGHQDNYGG-MPKXVKKWSA-N	444.139	1.976	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CCO[C@]2(CCN(C(=O)[C@@](C)(Cl)CCl)C2)C1	1781231900	GQFJDYYPAUOBEJ-IDENBPMYSA-N	447.359	1.808	50	20	IDGD	
C[C@H](Oc1cccnc1)C(=O)N1CCO[C@]2(CCN(C(=O)[C@](C)(Cl)CCl)C2)C1	1781233214	KDJZIZCAELSIKI-GDIGMMSISA-N	430.332	1.915	50	20	IDGD	
Cn1cc2cc(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)[C@H](O)CCl)C4)ccc2n1	1781236254	RSYIFFCIZHMNJF-DBXWQHBBSA-N	434.924	1.301	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)c3c(O)cc(O)cc3O)C2)C1	1781814842	UXZITHZUUGGDEP-MSOLQXFVSA-N	433.288	1.483	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCN1CCCCC1)C2	1782170216	BGLXJOMIZPQVAI-WAOWUJCRSA-N	429.989	1.630	50	20	IDGD	
O=C(c1cc2cccnn2c1)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1782385689	GXAOPGCBPSGCAS-YOEHRIQHSA-N	425.258	1.468	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CC2(O)CCC2)C1	1782779102	OHGHJLUIZCFWMA-HDMKZQKVSA-N	431.371	1.836	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)NNc3ccccc3)[C@H]2C1	1783553316	BQUWHQJSUCBQGS-JAQSECSASA-N	438.956	1.225	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)COc3ccc(OC)cc3)CCO2)C1	1783869646	QKXRXDXNAPNSGA-PXNSSMCTSA-N	426.897	1.158	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cccc(C(F)(F)F)n3)CCO2)C1	1783878379	XPGJIEMXKKELMC-PXAZEXFGSA-N	435.830	1.798	50	20	IDGD	
CC#C[C@@H](CC(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](Cl)COC)C2)C1)c1ccc(O)cc1	1783879154	PDCQPJHKXULPFL-LEDOBFOHSA-N	448.947	1.973	50	20	IDGD	
O=C(C(Cl)Cl)N1CC[C@@]2(C1)CN(C(=O)[C@@H]1CC(c3ccccc3)=NN1)CCO2	1783949276	IMCBFUIKPZDLHD-HNAYVOBHSA-N	425.316	1.386	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4n(n3)CCC4)C[C@@H]21	1783966971	NNHKLTWJXJAOON-RMRKRWHISA-N	439.354	1.454	50	20	IDGD	
CCc1oncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]2C1	1783967158	CKQDZVZMUGXZJG-DUPGQFARSA-N	428.327	1.861	50	20	IDGD	
O=C(/C=C\c1c[nH]c2ccccc12)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21	1785174228	URZFTPDWQDOTEK-OLCHUJGPSA-N	431.920	1.761	50	20	IDGD	
O=C([C@H](O)CCl)N1CCO[C@]2(CCN(C(=O)[C@H]3CC[C@H](C(F)(F)F)CC3)C2)C1	1785380577	IYTPLHRZRIJIHO-WBOJAVRRSA-N	426.863	1.785	50	20	IDGD	
C=C[C@@H]1C[C@]1(NC(=O)OC(C)(C)C)C(=O)N1CC[C@@]2(CN(C(=O)[C@H](F)Cl)CCO2)C1	1785596491	XCKUTXPSBQCVEB-RYMBOPBQSA-N	445.919	1.820	50	20	IDGD	
CCOC(=O)O[C@@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]2C1	1788763455	DZYDRNBKQYQFQS-VGWMRTNUSA-N	430.574	1.379	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(CO)c(F)c3)C[C@@H]21	1788766145	QUAPMOQTLAOITA-LNLFQRSKSA-N	438.572	1.763	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3C[C@H]3F)C[C@@H]21	1789221813	HDZIIIRXUFOOTO-RRPUIJGBSA-N	449.435	1.471	50	20	IDGD	
CCOC(=O)N[C@H](O)C(=O)Nc1ccc(C2(NC(=O)[C@@H](Cl)COC)CCC2)cc1	1789408502	HYEXHLINERQWFC-WMLDXEAASA-N	427.885	1.439	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC1(c2ccc(NC(=O)[C@H](O)N3CCOCC3)cc2)CCC1	1789555465	MCGDQTVMZKYTCR-FQEVSTJZSA-N	435.597	1.623	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C34CC(C(=O)OC)(C3)C4)[C@H]2C1	1791013263	KZVRDDDBVRYKKP-AIGROLTGSA-N	426.941	1.717	50	20	IDGD	
COc1cccc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]3C2)n1	1791057767	XFQLKOMSAJFNMF-VRKREXBASA-N	440.338	1.396	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3c(F)cncc3F)C[C@@H]21	1791058841	IPWAZMBHYWERTO-ZHPDPMBESA-N	432.265	1.737	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccn(C(F)F)n3)C[C@@H]21	1791059075	NIBCJMUXWHQJBD-ZPFDUUQYSA-N	435.269	1.655	50	20	IDGD	
Cc1c(F)cccc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2C1	1791286749	JNTASWDPELBRME-IEZWGBDMSA-N	434.512	1.100	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3C[C@]3(F)Cl)[C@H]2C1	1791367679	RLWGVWVJVSHMRE-WUMBASQESA-N	425.726	1.922	50	20	IDGD	
COc1cccnc1CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@](C)(Cl)CCl)C2	1794031361	DOWSXDMPANYNJY-ZZXMYQEDSA-N	444.359	1.849	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2)c1n[nH]c2c1CCCC2	1796160894	CAFDQIOLPMUFLN-DRXBFXEBSA-N	425.327	1.277	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CC(=O)N(Cc3ccccc3)C1)C2)[C@H](F)Cl	1796364743	LLQSIEDJHYHMME-VYDRJQSISA-N	437.899	1.159	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)c1cccc(Br)c1)C2)[C@H](F)Cl	1796367709	QUGKSUKYTQDGLA-BJBXXJATSA-N	449.704	1.607	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1c(Cl)ccc2c1OCO2	1796939240	IBDZJLILSZIAEZ-DDFXLWFNSA-N	445.299	1.526	50	20	IDGD	
Cc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)CBr)C3)n(C(F)F)n1	1798678237	VDZQFTUVROBIMG-SGESHTKJSA-N	449.296	1.821	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2nn(C)cc2c1	1799911681	ULVUYBOLFSREHT-FIUQPQMISA-N	435.322	1.560	50	20	IDGD	
COc1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CCC(=O)NN(C)C)C3)cc1N(C)C	1799995744	QANDDEARGPPVBT-BCDXTJNWSA-N	445.564	1.386	50	20	IDGD	
CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@](C)(Cl)CCl	1800084848	YKYCZWHKIGWREH-NHMNCCLUSA-N	444.363	1.331	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1CCC3(CC1)OCCO3)C2	1800762656	WRBRQFCCRZMFIQ-DMRZNYOFSA-N	445.354	1.293	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)nc3ccccc13)C2	1800978755	ZYWUYLPIAXKAIX-AODNKKSCSA-N	433.892	1.397	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCN1Cc3ccccc3C1=O)C2)C(Cl)Cl	1801014985	WNZZXAQYEGSUQL-XOIINTDNSA-N	440.327	1.426	50	20	IDGD	
CC[C@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(C(=O)O)ncn1)C2	1801798341	CRBQSAWUAABAPT-USZNOCQGSA-N	425.283	1.600	50	20	IDGD	
C[C@@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cn1cccc([N+](=O)[O-])c1=O)C2	1801966534	LNICMBGTNBRDEE-FVCCEPFGSA-N	441.282	1.178	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C(=O)c1ccc(C)cc1	1802149871	BTJWMTBFQIXYFJ-INZAXJFKSA-N	449.511	1.950	50	20	IDGD	
COC(=O)CCCCCC(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]1c1cccnc1	1803145669	GPKRGWUVJPUDET-FUHIMQAGSA-N	439.940	1.811	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2cccn2C)[C@@H]1c1cccnc1	1805358966	SBHNGDHPYIITLY-UWJYYQICSA-N	426.521	1.113	50	20	IDGD	
C[C@@H](CNC(=O)OC(C)(C)C)C(=O)N1CCCC2(CCN(C(=O)[C@H](O)CCl)CC2)C1	1805528983	DJXLLROWKICBNJ-JKSUJKDBSA-N	445.988	1.978	50	20	IDGD	
Cc1occc1C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1805615386	LCARKUCXAHWFAH-WIYYLYMNSA-N	433.273	1.296	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1	1809971279	QIPMWCJACYZIGW-UHFFFAOYSA-N	432.402	1.063	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)[C@@H]2CC=CCC2)[C@H]1c1cccnc1	1810294425	KNUMLXOKZKGGIZ-MMOPVJDHSA-N	448.527	1.756	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2cc3cn[nH]c3cn2)[C@@H]1c1cccnc1	1813031384	MBEVCHKJVPGCAC-SIXWZSSISA-N	442.907	1.926	50	20	IDGD	
Cc1cc(NC(=O)CC(=O)N2CCCC[C@H]2c2cc(NC(=O)[C@@H](O)CCl)n[nH]2)no1	1814871411	OKEANOIXAISLAN-STQMWFEESA-N	438.872	1.327	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](O)CCl)n[nH]1	1814874778	DUHNYVHXYMHXPX-OLZOCXBDSA-N	429.905	1.526	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccno1)CC2	1817277093	IPHIGCDNFVGTOI-IVWJEFBKSA-N	441.473	1.491	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](C)Br)[nH]n1	1819585784	KRBFOWPGMHHKGG-LOWVWBTDSA-N	426.315	1.876	50	20	IDGD	
C=CC[C@H](C(=C)C)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2	1819597803	MHZULFROAKOFRS-DLBZAZTESA-N	439.346	1.817	50	20	IDGD	
COc1ccc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@@H](O)CCl)CC3)c(O)c1	1821962599	CAZQZLFAPDLKBV-XPTSAGLGSA-N	425.894	1.683	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2C[C@]2(F)Cl)[nH]n1	1822416970	UFZIYBAHUKMMFO-RRUGBERISA-N	428.896	1.699	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](C)N3CCN(C)CC3)sc2C1	1822709726	PFGPQKANRKAVEF-MGPQQGTHSA-N	428.002	1.708	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@H](O)CCl)CC2)c1cn2c(F)cccc2n1	1824134922	VWRZPRDHGHIUBG-BXKDBHETSA-N	437.884	1.755	50	20	IDGD	
Cc1cnc(C(=O)N[C@@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)s1	1826080308	ANRRQQSSNJVUAG-LLVKDONJSA-N	436.563	1.507	50	20	IDGD	
CCNC(=S)NCC(=O)N1CCC([C@@H]2CCCCN2C(=O)CCBr)CC1	1826360040	WSEQGQWTVFXFFU-HNNXBMFYSA-N	447.443	1.875	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@H]1CCc2nc(NC(=O)CCS(C)(=O)=O)sc2C1	1827212040	SMIPRFWVIYELQQ-VFZGTOFNSA-N	442.390	1.726	50	20	IDGD	
C=C[C@H](O)C(C)(C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1	1828882955	TTYWFHHAUXATKS-RTWAWAEBSA-N	442.365	1.173	50	20	IDGD	
Cc1cnoc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1	1829548766	BANMOFOCFBQOQN-IBGZPJMESA-N	425.294	1.210	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ncccc3F)C2)C1	1830542677	BIVJBEZCASPIDL-ACJLOTCBSA-N	444.301	1.322	50	20	IDGD	
O=C([C@@H](F)Cl)N1CCOC[C@]2(C1)CN(C(=O)C1(c3ccc(O)cc3)CC1)CCO2	1830811721	YPDCALPTUYATKY-APWZRJJASA-N	426.872	1.415	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3c(C)nn(C)c3C)C2)C1	1831639825	DXRRJGRGAYKHCB-JXFKEZNVSA-N	426.945	1.514	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)C#CC3(O)CCCCC3)C2)C1	1831650904	MDWXEVJZWWNEAI-GCJKJVERSA-N	440.968	1.549	50	20	IDGD	
COc1ccc(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)cn1	1832585844	OYERLOLBEQOKAK-IBGZPJMESA-N	446.331	1.283	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cncc(N(C)C)c3)CCO2)C1	1833358781	UXTFNJAVEWKXAW-GHTZIAJQSA-N	438.956	1.625	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3cn(C)cn3)CC2)CC1	1834287773	UDCIJZDMWDHXMK-MRXNPFEDSA-N	440.386	1.779	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc4c(s3)CCC4)CCO2)C1	1834547566	BXDVQJGFRFGEEZ-MGPUTAFESA-N	442.965	1.561	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CCBr)CCO2)C1	1834824625	CRGUCBKMGGEMPJ-BXUZGUMPSA-N	442.148	1.011	50	20	IDGD	
COc1ncc(C(=O)N2CCC(N3CCC(NC(=O)[C@@H](F)Cl)CC3)CC2)cc1F	1835078719	UDBWZMGEHGOHLO-MRXNPFEDSA-N	430.883	1.949	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)c1ccccc1)CCO2	1835298379	BUEAOULLQNZQQT-TZIWHRDSSA-N	436.581	1.028	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)[C@H]3C[C@@H](O)C3)CC2)CC1	1835441876	UZRNBIUUCSPRIA-GRDNDAEWSA-N	430.387	1.360	50	20	IDGD	
CC[C@H](C)[C@@H](O)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](F)Br)CC2)CC1	1836414166	XECFJGGAILHZEQ-APHBMKBZSA-N	436.366	1.656	50	20	IDGD	
O=C(c1ccc(CO)c(F)c1)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836720253	NHMUEINEICZNEE-IBGZPJMESA-N	442.915	1.530	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccnc4c3OCO4)CCO2)C1	1838474690	OZGJITBAFOCHPR-YWZLYKJASA-N	439.896	1.288	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(O)nc3)CCO2)C1	1838651571	XLJNNXDMPVDOBL-QZTJIDSGSA-N	432.304	1.094	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3c(F)cccc3F)C2)C1	1839146606	QIUISSPELISPSO-FOIQADDNSA-N	430.879	1.981	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnn4cccc(F)c34)C2)C1	1839148079	LOYVMMSOBRVYPK-YWZLYKJASA-N	438.887	1.561	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(CO)o3)C2)C1	1839153630	MEOWAXQJSDHRMQ-MSOLQXFVSA-N	435.304	1.078	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3conc3C)C2)C1	1839963665	RGKIVBIHTSZYMQ-WMLDXEAASA-N	430.299	1.227	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cccc(F)c3)C2)C1	1840151704	LRSOHWGVILLWNY-YLJYHZDGSA-N	428.888	1.078	50	20	IDGD	
Cn1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)c(C(F)F)n1	1840187553	JAKVTPJWGAKVPB-INIZCTEOSA-N	441.262	1.231	50	20	IDGD	
O=C(c1cccn2ccnc12)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840188699	XOXPEPUGWAMFCG-GOSISDBHSA-N	427.288	1.208	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)n1cccc1)CCO2	1840355042	RHLNPNFPLFEFOB-MPGHIAIKSA-N	428.327	1.289	50	20	IDGD	
O=C(c1cc2cc[nH]c2cc1Cl)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843013972	JNRPHTCIAAXDCT-UHFFFAOYSA-N	437.692	1.632	50	20	IDGD	
O=C(c1cc(Cl)c2nncn2c1)N1CC2(CCCN2C(=O)[C@H](F)Br)C1	1845218356	ZGCREBDYKJMIGD-NSHDSACASA-N	430.665	1.890	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC12CN(C(=O)c1ccccc1C(=O)OCCO)C2	1846177840	OPTRQTSATFMYKQ-ZDUSSCGKSA-N	439.306	1.436	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)C#Cc1ccc(Cl)cc1	1847476623	VJYBQOABCVJJCQ-OALUTQOASA-N	437.887	1.206	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](CCN)NC(=O)OC(C)(C)C	1847867200	QVGBNGGAOQTSNM-FZKCQIBNSA-N	430.977	1.838	50	20	IDGD	
COc1cc(OC)c(C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1OC	11407858	JYLIQIVGRKKIDF-UHFFFAOYSA-N	433.373	1.239	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)[C@H]2COc3ccc(Cl)cc3C2)cc1OC	16796791	YFXDDAATXMESJU-CQSZACIVSA-N	448.859	1.913	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)[C@H]1CS[C@@]2(C)CCC(=O)N12	21957785	OQCNQOWNBLABKX-XIKOKIGWSA-N	441.893	1.107	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2ccc(COc3ccccc3)o2)ccc1OCC(N)=O	24154721	KQLKDGXKQILXRK-UHFFFAOYSA-N	439.424	1.806	50	20	IDGD	
Cc1cc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)c3ccc4c(c3)OCO4)c2)no1	26966304	YLXAFQDBQMCVDX-UHFFFAOYSA-N	444.425	1.587	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)NCc1cccnc1Oc1cccc(F)c1	725871525	COWNYLCJDKFVQZ-UHFFFAOYSA-N	427.392	1.866	50	20	IDGD	
CN(C)C(=O)[C@@H]1CCCN1CCCNC(=O)NNC(=O)c1ccc(Cl)cc1Cl	726278000	UJKFBDJIGDREGO-HNNXBMFYSA-N	430.336	1.880	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)NCCc2cccc(C(N)=O)c2)c2ccccc2c1=O	726718272	LAPSAGVBZIDYDR-UHFFFAOYSA-N	436.472	1.263	50	20	IDGD	
CC(=O)N(c1ccc(Cl)cc1)c1nc(C=NNC(=O)[C@H](C)NS(C)(=O)=O)cs1	728434971	RSSXKZHJZOAKJC-JTQLQIEISA-N	443.938	1.869	50	20	IDGD	
COC(=O)c1ccc(COc2ccccc2C=NNC(=O)[C@H](C)NS(C)(=O)=O)cc1	728436275	FCYNYTSKCJRACN-AWEZNQCLSA-N	433.486	1.440	50	20	IDGD	
Cc1nnnn1[C@@H](Cc1ccc(F)cc1)C(=O)NNC(=O)c1cccc(OC(F)F)c1	728484802	JSLMWEAUMYLPBT-INIZCTEOSA-N	434.378	1.967	50	20	IDGD	
CCCCCNC(=O)C1CCN(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)CC1	728959774	PIKILCMMBUQTQT-UHFFFAOYSA-N	445.568	1.452	50	20	IDGD	
C[C@H](C(=O)NNc1ccc(S(=O)(=O)C(F)F)cc1)N1C(=O)[C@@H]2CCCC[C@H]2C1=O	728974730	ZQVKJDFDTVGMKG-LERXQTSPSA-N	429.445	1.690	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc2nc(O)cc(C(=O)NNC(=O)c3c[nH]nc3C)c2c1	731851654	KLMUCAOWEQQMFI-UHFFFAOYSA-N	446.489	1.077	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)NNC(=O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])o1	731874182	CXKXSKATTMMOLK-HNNXBMFYSA-N	425.401	1.664	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@@H](C(=O)NNC(=O)N3CCOCC3)C2)c2ccccc12	732063963	QFGSNCUECLOLAH-MRXNPFEDSA-N	440.500	1.774	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)N[C@@H]1CCN(c2ccccc2Cl)C1=O	732469165	AVXUURQZPXCEPV-CQSZACIVSA-N	440.847	1.738	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)/C(=C/c1cccnc1)NC(=O)c1ccccc1	733143412	GFJROUKSBPSTFW-ATVHPVEESA-N	433.424	1.023	50	20	IDGD	
Cn1c(NNC(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)nc2ccccc2c1=O	733261159	MAWIAEADIVHWLJ-UHFFFAOYSA-N	438.400	1.673	50	20	IDGD	
CCOCCCn1c(NNC(=O)c2ccc(C(=O)OC)cn2)nc2ccccc2c1=O	733266329	HBQOIOPIONTQMZ-UHFFFAOYSA-N	425.445	1.762	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCCc2ccc3c(c2)CCO3)nc1	734069570	QPVVQJLVZQQDPG-UHFFFAOYSA-N	433.534	1.916	50	20	IDGD	
COc1ccc(Cn2cc(C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)cn2)cc1	734238960	CGUQIZNLORVJBI-UHFFFAOYSA-N	432.481	1.409	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)COc1cccc(Br)c1	734240549	UBSUWQLPIKCMFW-UHFFFAOYSA-N	431.287	1.683	50	20	IDGD	
COc1ccc(CN2CC[C@@H](NC(=O)NNC(=O)c3ccc4ccccc4n3)C2=O)cc1	734541358	HJXYKCOSOYQCMR-HXUWFJFHSA-N	433.468	1.989	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2cc3ccccc3s2)CC1	735117016	LBKZVGCWZKCWJF-UHFFFAOYSA-N	431.543	1.989	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)[C@@H](CC)Nc2c([N+](=O)[O-])c(C)nn2C)cc1OC	735837370	SNVPVBUPVUQOPD-CYBMUJFWSA-N	434.453	1.696	50	20	IDGD	
CCN(CC)S(=O)(=O)CC(=O)NNC(=O)[C@@H](C)Oc1cccc(Br)c1	735840515	JFYWDLCAQUFFQW-LLVKDONJSA-N	436.328	1.035	50	20	IDGD	
O=C(NNC(=O)c1ccc(N2CCCS2(=O)=O)cc1Cl)c1cccc([N+](=O)[O-])c1	735990281	VCEPGAAHGTYXHZ-UHFFFAOYSA-N	438.849	1.863	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)c1ccc(S(=O)(=O)NC[C@@H]2CCCO2)cc1	737923444	MZCWOYFRKXJVMA-SFHVURJKSA-N	447.513	1.122	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1ccccc1Cn1cncn1	742477411	HUPQEGHTKDGZBW-UHFFFAOYSA-N	427.490	1.003	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN(C[C@H]2CCCO2)[C@H]2CCS(=O)(=O)C2)cc1C	744401273	CIPKPMJKPIOBMG-LSDHHAIUSA-N	443.591	1.048	50	20	IDGD	
CCCc1c(C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)[nH]c(C)c1C(=O)OC	744826551	WJEMLJMVTCXPLO-UHFFFAOYSA-N	426.429	1.552	50	20	IDGD	
CC(=O)N[C@H](CC(=O)OCC(=O)NNC(=O)c1cccc(C)c1)c1ccc(F)cc1F	745141418	MSXXRHZYJUMADZ-GOSISDBHSA-N	433.411	1.845	50	20	IDGD	
CCN1CCO[C@H](C(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)C1	746103570	PNAWXZLXOWIWFH-HNNXBMFYSA-N	438.531	1.031	50	20	IDGD	
NS(=O)(=O)Cc1ccc(C(=O)NNC(=O)COc2ccccc2-c2ccccc2)cc1	746347460	KXMVYKPAQLIHBK-UHFFFAOYSA-N	439.493	1.982	50	20	IDGD	
CC(=NNC(=O)C(=O)NN=C(C)c1ccc([S@](C)=O)cc1)c1ccc([S@@](C)=O)cc1	746365700	AWBBRAJYYTXZQN-RNPORBBMSA-N	446.554	1.542	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(C)c(C(=O)NNC(=O)c2ccc(Cl)cc2F)c1	747429573	RKTJQLZNVXPNAS-UHFFFAOYSA-N	443.884	1.787	50	20	IDGD	
C[C@H]1CN(C(=O)c2ccc(CNC(=O)NNC(=O)Cc3ccncc3)cc2)C[C@@H](C)O1	747581916	RHSVZSUWFHXRFO-IYBDPMFKSA-N	425.489	1.404	50	20	IDGD	
Cc1cc(F)ccc1S(=O)(=O)Nc1ccc(C(=O)NNC(=O)C(=O)N2CCCC2)cc1	748246830	QANUKKJDMZSHMA-UHFFFAOYSA-N	448.476	1.318	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CCc2ccccc2)cc1S(=O)(=O)N1CCOCC1	749804329	UPTRFMNCWBJTCE-UHFFFAOYSA-N	431.514	1.410	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)N[C@@H]1CCN(CCCc2ccccc2)C1=O	750266318	HSCLJKXFQUYSBB-GOSISDBHSA-N	428.464	1.769	50	20	IDGD	
CC[C@@H](C)C(=O)N1CCC[C@H](C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)C1	751043850	RGHBPKGJZDTVAW-UXHICEINSA-N	443.592	1.631	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)[C@@H]2CSCN2C(=O)OC(C)(C)C)c2ccccc2c1=O	751294652	QKRRTHPRUOMDGL-ZDUSSCGKSA-N	433.490	1.005	50	20	IDGD	
COc1ccc(C(=O)NNC(=S)N[C@H](C)C2CC2)cc1S(=O)(=O)N1CCCC1	751621652	ZVVAUMJVXNQPMH-GFCCVEGCSA-N	426.564	1.387	50	20	IDGD	
O=C(C[C@@H]1CCCCO1)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	755036641	ZMOCYHBVYKNEEN-SFHVURJKSA-N	431.514	1.885	50	20	IDGD	
COC(=O)CNC(=O)c1ccc(NC(=O)NNC(=O)c2cc(C)nc3ccccc23)cc1	755551177	XAMLHUUDZIVSDK-UHFFFAOYSA-N	435.440	1.913	50	20	IDGD	
Cn1c(=O)c2cc(NC(=O)NNC(=O)c3cc4c(s3)CCCCC4)cnc2n(C)c1=O	755848086	JSJDSZOTYZUXPU-UHFFFAOYSA-N	442.501	1.429	50	20	IDGD	
N#Cc1cc(NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)ccc1F	756357312	MYIXZEGZUGHHBV-UHFFFAOYSA-N	431.449	1.948	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)OCC(=O)NN=C(c2ccccc2)c2ccccc2)co1	756400395	IDCNKMJNZDBTCG-UHFFFAOYSA-N	441.465	1.913	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2cnn(CC(=O)N(C)C)c2)cc1Br	756795566	GFCUXCBPJNZTQA-UHFFFAOYSA-N	439.270	1.209	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)Nc1ccccc1CN1CCNC1=O	757924220	NEIIHDWCNQRBIQ-UHFFFAOYSA-N	435.444	1.570	50	20	IDGD	
C=C[C@H](CC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1ccccc1	758044595	XPOZMLAKPVBFIJ-QGZVFWFLSA-N	443.525	1.828	50	20	IDGD	
CCn1cc(Br)cc1C(=O)N1CCN(S(=O)(=O)CBr)CC1	758518835	RRHFUXPVUQGTQB-UHFFFAOYSA-N	443.161	1.711	50	20	IDGD	
COc1cc(C(=O)NNC(=O)N[C@@H]2CCCS(=O)(=O)C2)ccc1OCCC(C)C	758649315	MRAPSNZGLKAXRN-OAHLLOKOSA-N	427.523	1.641	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)C(=O)Nc1ccccn1)Oc1ccccc1Br	758833164	KDARLRSSHSHYDN-LLVKDONJSA-N	436.266	1.581	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1cnc([C@H]2CCCO2)s1	760650558	ZZRLQMZCLNFSQR-CQSZACIVSA-N	438.531	1.772	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)COC1CN(C(=O)OC(C)(C)C)C1	762370871	QCKVSQJVJJEPPN-UHFFFAOYSA-N	425.507	1.571	50	20	IDGD	
NS(=O)(=O)c1ccc(C(=O)NNC(=O)CCCOc2ccc(Cl)cc2Cl)cn1	762735695	CDTFMSJJASACRY-UHFFFAOYSA-N	447.300	1.656	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)[C@H]2CC(=O)N(c3cc(OC)cc(OC)c3)C2)n1	762900321	CDZXIUNSGOKGOI-AWEZNQCLSA-N	428.493	1.836	50	20	IDGD	
CN(C)C(=O)C[C@H]1CN(C(=O)C(=O)NNC(=O)c2ccccn2)c2ccc(Cl)cc21	763467482	OZAWSNYRARJWKN-LBPRGKRZSA-N	429.864	1.105	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)ccc1Cl	763574342	ZATPUVVDBPVRDF-INIZCTEOSA-N	447.831	1.443	50	20	IDGD	
C[C@@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3cc(-c4ccccc4)[nH]n3)cc2)CCO1	763605527	UXSWPVAIPMLQGH-OAHLLOKOSA-N	448.483	1.702	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(N3CCOC3=O)c2C)c1	763619336	SXMNWKPJWPQSGP-UHFFFAOYSA-N	426.429	1.425	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2cccc(Cn3cccnc3=O)c2)c1	763669680	YJIYSRDCRLWYMZ-UHFFFAOYSA-N	449.467	1.073	50	20	IDGD	
Cc1cc(Oc2ncccn2)ccc1NC(=O)C(=O)NNC(=O)COc1ccccc1F	763679932	FKPAOHYKWOLCKN-UHFFFAOYSA-N	439.403	1.881	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)C(=O)Nc1ccc(-n2ccnc2)nc1	763849873	LPELXIVRDIXPBB-HNNXBMFYSA-N	444.451	1.974	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)C(=O)Nc1cc(C(N)=O)ccc1F	763851601	DVDSYHYCBFFOQX-GFCCVEGCSA-N	438.415	1.631	50	20	IDGD	
COc1cc(C(=O)N(C)C)ccc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccc(F)cc1	763871989	JHZRGQJQMKFEDJ-GFCCVEGCSA-N	446.435	1.090	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)C(=O)Nc2ccc3c(c2)n(C)c(=O)n3C)cc1	763896192	KSEVESPJMUCGPG-UHFFFAOYSA-N	427.486	1.064	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cccc(-n3ccnn3)c2)ccc1OC(C)C	763916127	IQQSPMMPBJQHDT-UHFFFAOYSA-N	438.444	1.463	50	20	IDGD	
O=C(Cc1cc[nH]n1)NNC(=O)C(=O)Nc1ccc(C(F)(F)F)cc1Br	764293941	RFLWJTGNMGJWPJ-UHFFFAOYSA-N	434.172	1.520	50	20	IDGD	
Cc1nc(N2CCOCC2)ccc1NC(=O)C(=O)NNC(=O)C(C)(C)c1ccccc1	764308968	KEOPQEPSMNMLDB-UHFFFAOYSA-N	425.489	1.290	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)C(=O)Nc1ccc2c(c1)C(=O)N(CC1CC1)C2=O	764320748	KMJZBHGFFSZUBC-UHFFFAOYSA-N	438.415	1.160	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C(=O)Nc1ccc(CN2C(=O)CNC2=O)cc1)c1ccccc1	764330281	TXMRSCPRILBGPJ-KRWDZBQOSA-N	437.456	1.018	50	20	IDGD	
CN(C1CCCCC1)S(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)C2CCC2)cc1	764335969	WOPJVXLEALLOAF-UHFFFAOYSA-N	436.534	1.526	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)C(=O)Nc1cccc(C[S@](=O)C2CCCCC2)c1	764354083	OVCZUUVGSKFOJY-HKBQPEDESA-N	442.541	1.992	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)C(=O)Nc1cccc(OC[C@@H]2CCCO2)c1	764365777	AYTARRKZGNWSSB-IBGZPJMESA-N	427.457	1.547	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=S)Nc1ccc(F)cc1F	764512527	DDGNOEBYECGQIY-UHFFFAOYSA-N	433.484	1.740	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)C[C@H]1CN(C(=O)OC(C)(C)C)CCO1	764547316	KZAYRGMMKPIKCH-HNNXBMFYSA-N	445.520	1.772	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2cccc(CCOC(C)=O)c2)c2ccccc2c1=O	764717285	BLGYZKCEZFRBBO-UHFFFAOYSA-N	437.456	1.989	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)[C@@H](c1ccccc1F)N1CCOCC1	765318754	PCVGAACNVCTJAL-GOSISDBHSA-N	438.500	1.651	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)c2cccc(Cl)c2)cc1F	765639228	AXACCGZQUPCBAO-UHFFFAOYSA-N	435.886	1.864	50	20	IDGD	
C[C@@H](NC(=O)OC(C)(C)C)[C@@H]1COCCC1=NNC(=O)c1nn(C)c(=O)c2ccccc12	766007129	JYJZCIJEAIPZTN-CJNGLKHVSA-N	443.504	1.969	50	20	IDGD	
CCOc1ccc(C(=O)NNS(=O)(=O)c2cnc3c(Cl)c(C)nn3c2)cc1OC	766313053	VGMGBRJGTORHON-UHFFFAOYSA-N	439.881	1.722	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@@H](C(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)[C@H](C)O)cc1	767302054	RMNZAMCRJFOAJG-ZWCZNYOASA-N	449.573	1.387	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)c1cnnn1-c1ccccc1Cl	767305831	SGDGDLGYMYGIKB-UHFFFAOYSA-N	427.848	1.776	50	20	IDGD	
CC(C)(C)S(=O)(=O)CC(=O)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1	767353541	VTIDZMYLECZZQJ-FQEVSTJZSA-N	443.569	1.974	50	20	IDGD	
O=C(CCC(=O)N1CCN(c2ncccn2)CC1)NNc1ccc(-c2ccccc2)nn1	768230864	RSVGRBJQTVKIGV-UHFFFAOYSA-N	432.488	1.506	50	20	IDGD	
C[C@@]1(c2cccc(C(=O)NNc3nc(-c4ccccn4)nc4c3CCC4)c2)NC(=O)NC1=O	769143608	OFSRGFXZPNOCLA-QHCPKHFHSA-N	443.467	1.839	50	20	IDGD	
O=C(NNC(=O)c1nccn2c(Br)cnc12)c1cc(-c2ccccc2)[nH]n1	769601419	FXHDKCJEYJJQRT-UHFFFAOYSA-N	426.234	1.957	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)CCc3cccc4c3OCO4)CC2)cc1	770245923	NSYHMKQIRNUHQV-UHFFFAOYSA-N	438.528	1.622	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)[C@@H](CNC(=O)OC(C)(C)C)c3ccccc3)nc21	770979833	LMKQWCOBFHGERZ-ZDUSSCGKSA-N	427.465	1.821	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNS(=O)(=O)c1cc(Cl)ccc1[N+](=O)[O-]	771604311	IZJMKYDRTAAUTB-UHFFFAOYSA-N	447.256	1.528	50	20	IDGD	
CCOc1nc(C(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)co1	771866634	HOXBNFKENQMFEF-UHFFFAOYSA-N	433.424	1.906	50	20	IDGD	
Cc1oc(C(=O)O[C@@H](C)C(=O)NNC(=O)CC(C)C)cc1S(=O)(=O)N1CCCC1	772019915	JATWARHXNRNJEW-ZDUSSCGKSA-N	429.495	1.111	50	20	IDGD	
Cc1cc(S(=O)(=O)NCCNC(=O)NNC(=O)Cc2c[nH]c3ccccc23)c(C)s1	772626073	PZHYLNMOACFUPC-UHFFFAOYSA-N	449.558	1.698	50	20	IDGD	
CC(C)S(=O)(=O)c1ccccc1C(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772884356	JKRWPNMRSLEENO-UHFFFAOYSA-N	437.905	1.600	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)[C@@H]1CC=CC[C@H]1C(=O)N1CCOCC1	772971222	YFTAMPVHRFHPQC-BMGDILEWSA-N	435.908	1.696	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)C(=O)Nc2cc(C(=O)N3CCSCC3)ccc2C)n1	773482394	NCVBVHAHTFSFQO-UHFFFAOYSA-N	428.518	1.673	50	20	IDGD	
O=C(NNc1cnc2ccccc2n1)c1ccc(S(=O)(=O)NC[C@@H]2CCCO2)cc1	774784532	UPPSQHFAMKWCIE-HNNXBMFYSA-N	427.486	1.844	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)N[C@H](C)CS(=O)(=O)c2ccc(C)cc2)cc1	776194382	LSAUGJSTBVTKPT-OAHLLOKOSA-N	435.502	1.575	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@@H](C(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)C1	776204869	HCELMJVPEBGHAG-HUUCEWRRSA-N	426.514	1.602	50	20	IDGD	
CCc1ccccc1OCC(=O)NNS(=O)(=O)c1cc(F)c(OC)c([N+](=O)[O-])c1	777595830	KAPHWAUXLZXYNI-UHFFFAOYSA-N	427.410	1.693	50	20	IDGD	
COC(=O)c1ccccc1NNC(=O)c1ccc(OC)c(S(=O)(=O)N2CCOCC2)c1	777772754	LPAFCKXURMJWCY-UHFFFAOYSA-N	449.485	1.260	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)[C@H]1CCCN(C(=O)CCOc2ccccc2)C1	778437245	WFYMQXBUZZBORN-INIZCTEOSA-N	448.520	1.366	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)C[C@@H](O)c1ccc(OCc2ccccc2)cc1	780921174	JCZXIPHLPAZZLI-LJQANCHMSA-N	437.452	1.860	50	20	IDGD	
COCCO[C@@H]1CCN(C(=O)NNC(=O)[C@@H](C)Oc2cccc(Br)c2)C1	780951965	MHJQQVZUOUSJIX-IUODEOHRSA-N	430.299	1.695	50	20	IDGD	
COC(=O)c1cc(C(=O)NNC(=O)COc2ccc(OCc3ccccc3)cc2)on1	781415946	QOEOIMCBCQQGTQ-UHFFFAOYSA-N	425.397	1.880	50	20	IDGD	
O=C(CN1CCNC(=O)[C@@H]1c1ccccc1C(F)(F)F)NNC(=O)c1cccs1	782102342	SMIDEDHUIKQINU-HNNXBMFYSA-N	426.420	1.701	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2ncn(Cc3cccc(Br)c3)n2)nc1	782145603	WDRCRSFJMDYLET-UHFFFAOYSA-N	446.265	1.574	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)C(C)C)cc1NC(=O)C(=O)NNc1ncncc1Cl	782158771	BTGRDJRXPPFIQX-UHFFFAOYSA-N	440.913	1.549	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)O[C@H](C(=O)N[C@@]2(C)CCS(=O)(=O)C2)C(C)C)cc(C#N)n1C	782628189	VUNIRPPFVOMRCZ-FYLMCMIZSA-N	446.529	1.373	50	20	IDGD	
Cc1cc(I)ccc1NC(=O)C(=O)NNC(=O)c1ccc(O)cc1	782833882	MSRHVTYRTWDXJB-UHFFFAOYSA-N	439.209	1.705	50	20	IDGD	
O=C(CCCOc1ccc2c(c1)NC(=O)CC2)NNC(=O)CNC(=O)c1cccs1	783111517	NEQHYVJYAOAHCN-UHFFFAOYSA-N	430.486	1.369	50	20	IDGD	
CN(c1ccccc1NC(=O)C(=O)NNc1ncccc1C(F)(F)F)S(C)(=O)=O	783120084	IKEWKZYAWVTMBP-UHFFFAOYSA-N	431.396	1.578	50	20	IDGD	
CCCNS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ncnc3ccsc23)cc1	783253116	HNSJDPPYXZMYNZ-UHFFFAOYSA-N	434.503	1.461	50	20	IDGD	
CS(=O)(=O)CCc1ccc(NC(=O)C(=O)NNc2ccc(Br)nc2)cc1	784806779	QPMPAFVLQNNCJE-UHFFFAOYSA-N	441.307	1.513	50	20	IDGD	
COc1ncc(C)cc1NC(=O)C(=O)NNc1ccccc1S(=O)(=O)NC(C)(C)C	784832890	FWRBGQAXFDXGCM-UHFFFAOYSA-N	435.506	1.557	50	20	IDGD	
CCN1CCN(C(=O)Cc2ccc(NC(=O)C(=O)NNc3ccc(Cl)nc3)cc2)CC1	784869638	CNCCPWHZIZXKDZ-UHFFFAOYSA-N	444.923	1.523	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNc2cccc(C(F)(F)F)n2)cc1	784959538	ZIDNLEFIZOTBER-UHFFFAOYSA-N	431.396	1.944	50	20	IDGD	
CN1CCc2ccc(NC(=O)C(=O)NNc3c(F)cc(C(=O)NC4CC4)cc3F)cc21	785100302	VZCWQIHFYGBFBO-UHFFFAOYSA-N	429.427	1.931	50	20	IDGD	
CCCCOc1ccc(NC(=O)C(=O)NNc2c(OC)cccc2S(C)(=O)=O)cn1	785331417	UPGQMTWJTLXQCI-UHFFFAOYSA-N	436.490	1.754	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCc2ncnn2-c2ccccc2)cc(OC)c1OC	787347218	YCKFEFIMHAPPAL-UHFFFAOYSA-N	426.433	1.437	50	20	IDGD	
CCNC(=O)Nc1ccc(C)c(NC(=O)C(=O)NNC(=O)CCc2ccc(OC)cc2)c1	787541625	AYSOXDRXIIREJA-UHFFFAOYSA-N	441.488	1.864	50	20	IDGD	
N#Cc1ccc(S(=O)(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1Br	788476323	FLVKWDDHCGKNOM-OAHLLOKOSA-N	438.259	1.470	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN(C)[C@@H]1CCN(Cc2ccccc2)C1=O	789527717	DWRFRKVBZYLGIM-GOSISDBHSA-N	444.919	1.843	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)nn1[C@@H](C)C1CC1	789817850	KOEIRQXUAJZXAS-FNHZYXHNSA-N	425.489	1.821	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)c2nc(Br)ccc2Br)n1	790121225	RBKBYGSDNKCTNP-UHFFFAOYSA-N	431.088	1.881	50	20	IDGD	
CS(=O)(=O)C1(CNC(=O)NNC(=O)COc2ccc(OCc3ccccc3)cc2)CC1	793265077	FKAIKOTZMHSKOD-UHFFFAOYSA-N	447.513	1.552	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)CNC(=O)c1c(F)cccc1Cl	795160609	FUHJRLFKMXKIJJ-UHFFFAOYSA-N	428.873	1.603	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@@H]2C(=O)NNC(=O)Cc2nc3ccccc3n2C)cc1	798828636	WCUJOVQKYDZLOF-LJQANCHMSA-N	435.484	1.577	50	20	IDGD	
Cc1cc(O[C@@H]2CCN(C)C2=O)ccc1NC(=O)NNC(=O)[C@H]1COc2ccccc2O1	799241554	UQSVOCBEUJZKIU-RTBURBONSA-N	440.456	1.597	50	20	IDGD	
CCc1cccc(C)c1NNC(=O)C(=O)Nc1cc(S(=O)(=O)N(C)C)ccc1N(C)C	799843813	DPUNBHKFEFZQLT-UHFFFAOYSA-N	447.561	1.956	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(S(=O)(=O)NNC(=O)c2ccccc2F)c1	800830748	HBSAHORLYJSVEY-UHFFFAOYSA-N	429.495	1.480	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)N[C@H]1CCCN(C(=O)Cc2ccccc2)C1	800983473	KESWOBIXHGSMTQ-KRWDZBQOSA-N	428.464	1.769	50	20	IDGD	
O=C(C/N=C1/NS(=O)(=O)c2ccccc21)NNC(=O)Nc1ccc(Cl)cc1Cl	802093966	MDDLSTNOKHZZQS-UHFFFAOYSA-N	442.284	1.885	50	20	IDGD	
CC1(C)CC(=O)c2cc(NC(=O)C(=O)NNC(=O)COc3ccccc3F)ccc2O1	806974016	PPCRRNYWUKOMMK-UHFFFAOYSA-N	429.404	1.734	50	20	IDGD	
O=C(NNc1nccnc1C1CCC1)C(=O)Nc1ccc(N2CCCS2(=O)=O)cc1	807462868	VPDQTPLIIFBOLW-UHFFFAOYSA-N	430.490	1.366	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(Cl)c(Cl)c1)NNC(=O)COc1ccccc1O	810364765	HOCMOLDDBQOTFD-UHFFFAOYSA-N	448.284	1.204	50	20	IDGD	
Cc1cccc2c(=O)n(CCC(=O)NNc3ccc(S(=O)(=O)N(C)C)cc3)cnc12	812730014	YAHKEJXOJUYTGU-UHFFFAOYSA-N	429.502	1.489	50	20	IDGD	
COC(=O)c1cn(-c2cccc(NC(=O)NNC(=O)c3ccc(OC)cc3OC)c2)nn1	812981037	JKOQHGMPMHEHSJ-UHFFFAOYSA-N	440.416	1.538	50	20	IDGD	
COC(=O)CCc1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)cc1	813033379	QOJYBVAUBDVASF-UHFFFAOYSA-N	448.501	1.124	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)ccc1C	813033414	RRZFVZNEAGDWEA-UHFFFAOYSA-N	434.474	1.114	50	20	IDGD	
O=C(NNC(=O)C1(Cc2cccc(F)c2)CCOCC1)c1csc(N2CCOCC2)n1	814365933	YRSYOTLKWHELES-UHFFFAOYSA-N	448.520	1.919	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)[C@](C)(O)c2ccc(Cl)cc2)cc1OC	815500417	XIFXCFMEUFBPEV-HXUWFJFHSA-N	436.848	1.569	50	20	IDGD	
O=C(COC(=O)c1ccccc1NC(=O)C1CC1)NNC(=O)c1ccc([N+](=O)[O-])cc1	815518104	ADKNPIUTKDNOHG-UHFFFAOYSA-N	426.385	1.561	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCO1)C(=O)Nc1nc(-c2ccccc2OC(F)F)cs1	815778360	NUONDHVFXMGZTQ-GFCCVEGCSA-N	426.401	1.676	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NNC(=O)Cn2cccc(C(F)(F)F)c2=O)C1	816510425	VZCZMPRYMGEBOR-GFCCVEGCSA-N	446.426	1.662	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C[C@](O)(c2nccn2C)C(F)(F)F)cc1	818649175	LPWFCRQSQQRTPU-SGTLLEGYSA-N	444.410	1.574	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)c2ccc3c(c2)C[C@@H](C)N3S(C)(=O)=O)cc1	825542398	MSPKWUIXXSXDTJ-CYBMUJFWSA-N	432.502	1.279	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)CCNS(=O)(=O)/C=C\c2ccccc2)cc1	913455033	CSKMCYLTLXTQTI-QBFSEMIESA-N	428.470	1.065	50	20	IDGD	
CN(C)N(C(=O)c1cccc(S(=O)(=O)NC2CCCC2)c1)[C@@H]1CCS(=O)(=O)C1	914436857	DDGRRWRNLWEQQH-MRXNPFEDSA-N	429.564	1.013	50	20	IDGD	
Cc1ccc(OCCC(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c(C)c1	914586388	ZJBKGEVKAWONTM-LJQANCHMSA-N	428.441	1.603	50	20	IDGD	
CN(CC(=O)NNC(=O)c1ccc(CSc2nc3ccccc3[nH]2)cc1)S(C)(=O)=O	914747872	SAZDVOUYMPIXPP-UHFFFAOYSA-N	447.542	1.508	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NC2CCN(Cc3ccccc3)CC2)c1	915054145	LEBOYWJTHUOWBE-UHFFFAOYSA-N	430.530	1.699	50	20	IDGD	
COc1ccc([C@@H](CNC(=O)NNc2nc(C)cc(C)n2)N2CCOCC2)cc1OC	915895523	OLSFEVDLFOSQTP-QGZVFWFLSA-N	430.509	1.810	50	20	IDGD	
O=C(NC[C@H]1CC1(Cl)Cl)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	915907934	KBFSYKOZYOFUFZ-GFCCVEGCSA-N	435.333	1.609	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCCNC(=O)c2ccc(Cl)cc2)c1	916262494	NJIZQAKBWRMBGX-UHFFFAOYSA-N	438.893	1.118	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NC[C@@H]2CCN(CC(F)(F)F)C2)cc(OC)c1OC	916578071	SMACHXLZNNAZEO-NSHDSACASA-N	434.415	1.541	50	20	IDGD	
CCS(=O)(=O)N(C)CCCNC(=O)NNC(=O)c1ccc(-n2c(C)ccc2C)cc1	916580154	GJSCDXGKCRJLBR-UHFFFAOYSA-N	435.550	1.710	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccc([N+](=O)[O-])s2)CC1)NNC(=O)c1ccc(F)cc1	917107594	FOGLPHBIHKAYHX-UHFFFAOYSA-N	435.437	1.014	50	20	IDGD	
CCCOc1ccc(C(=O)NNS(=O)(=O)c2cccc(C(=O)NC3CC3)c2)cc1OC	917727827	QYZVJBIIWIVVDN-UHFFFAOYSA-N	447.513	2.000	50	20	IDGD	
COc1ccc(C(=O)NCCNC(=O)NNC(=O)c2ccc(OC(C)C)c(OC)c2)cc1	918221786	ODYBHYWBOIKQAW-UHFFFAOYSA-N	444.488	1.865	50	20	IDGD	
CC1CCC(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)CC1	919915984	LSAGNIVNGJXDIO-UHFFFAOYSA-N	438.550	1.478	50	20	IDGD	
CCn1c(NNC(=O)c2cc([N+](=O)[O-])cc(S(C)(=O)=O)c2)nc2ccccc2c1=O	920284464	LPXZKERBKCENEA-UHFFFAOYSA-N	431.430	1.485	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1O	920426889	FLEWACVQWVXDKW-UHFFFAOYSA-N	447.513	1.115	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)NCc1cccc(C(=O)N2CCOCC2)c1	920811689	MFDHNIVSPUHZTL-UHFFFAOYSA-N	430.436	1.208	50	20	IDGD	
CCCNC(=O)NNC(=O)c1cc(S(=O)(=O)N(CC)CC)ccc1Br	921041768	LVBNTUZUKFUDDP-UHFFFAOYSA-N	435.344	1.834	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)NCc2cccc(CN3CCN(C)CC3)c2)c1	1318459319	UNBIXSSBIQOEEU-UHFFFAOYSA-N	439.560	1.960	50	20	IDGD	
Cc1nn(C)c2sc(C(=O)N[C@@H](C)C(=O)NNC(=O)c3n[nH]c4c3CCCC4)cc12	1322124708	XEZMETXYTGNZMW-JTQLQIEISA-N	429.506	1.125	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccccc1)NNC(=O)c1ccc(Br)cc1Cl	1324586842	LLLGYCHELGNJCE-UHFFFAOYSA-N	446.710	1.842	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(CCN(C(=O)c3ccc4cnccc4n3)C2)C1	1777732391	WFVAEYNRDVOZAI-IBGZPJMESA-N	433.306	1.858	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H](C(=O)N2CC[C@]3(CN(C(=O)[C@@H](F)Cl)CCO3)C2)C1	1778233986	LIRUTLGZCCKLBH-PJIJBLCYSA-N	433.908	1.608	50	20	IDGD	
CCCC(=O)N[C@@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)Br)C2	1779520508	SDWQGEOSKRVKGM-NXEZDXNNSA-N	446.386	1.589	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc(N(C)C)nc2)C1	1779860845	COPZSHFTXLCIFZ-CBGDNZLLSA-N	438.956	1.529	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc(O)nc2)C1	1780130855	KRNWNMAIYYGJIS-RVZJWNSFSA-N	426.311	1.698	50	20	IDGD	
CC(C)=NO[C@@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Br)C2	1780808727	IGBTZJUNMCHVDQ-ZOMKSWQUSA-N	436.322	1.992	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@@]2(C1)CN(C(=O)C1(NC(=O)OC(C)(C)C)CC1)CCO2	1781225706	OOGHMKWBVOJGFF-AUUYWEPGSA-N	429.945	1.891	50	20	IDGD	
COC(=O)c1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)cn1	1781329343	DWWJKMVUIBMASS-CXAGYDPISA-N	444.257	1.002	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCBr)C2	1781511563	VFWMNEGSJHPBKL-HBUWYVDXSA-N	449.342	1.847	50	20	IDGD	
COCCC(=O)N1CCO[C@]2(CCN(C(=O)[C@H](Br)Cc3ccccc3)C2)C1	1783022633	KULQVEPFJSZYFA-YLJYHZDGSA-N	439.350	1.859	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(CO)c(F)c3)CCO2)C1	1783536871	HTBKUNAYJPFGGH-KZULUSFZSA-N	429.286	1.545	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)C(C)(C)Oc1ccc(C)cn1)CCO2	1783883734	YFOXDJAFPXZPRT-IERDGZPVSA-N	439.940	1.631	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]2C1	1783974561	QAZBRSYOZSFPFJ-VLJOUNFMSA-N	440.176	1.781	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cn4cc(Cl)ccc4n3)C[C@@H]21)[C@H](O)CCl	1784090420	FSQYDVWHCNXDPR-YUDUHTQSSA-N	441.315	1.181	50	20	IDGD	
COc1cc(F)c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]3C2)c(F)c1	1784092805	VZHMLZILHOSEEW-SPGJAERMSA-N	432.851	1.166	50	20	IDGD	
COc1cc(F)ccc1CC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2	1785659925	AIUWYHWTQLQBDY-YJYMSZOUSA-N	443.313	1.990	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC1(c2ccc(NC(=O)[C@@H](O)c3ccco3)cc2)CCC1	1785859881	KXEMIJXDJBAEEP-FQEVSTJZSA-N	428.489	1.820	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3Cc4ccccc4O3)[C@H]2C1	1788186037	BIKMBZBYQHZFRK-AHMROAQXSA-N	437.334	1.753	50	20	IDGD	
O=C(Cc1ccccc1O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21	1790898839	UNGFHDAVQSUEII-HPZZRFSDSA-N	429.286	1.605	50	20	IDGD	
COC(=O)CCCCCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)Br)[C@H]2C1	1791063732	RALBLGFCUCEJSP-VGWMRTNUSA-N	447.370	1.873	50	20	IDGD	
CCn1nc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](Cl)COC)[C@H]3C2)c2ccccc21	1791254021	INQUZEKNUXYVBT-RMRDIRSESA-N	448.951	1.903	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC1(c2ccc(NC(=O)C[C@@](C)(O)CC(=O)O)cc2)CCC1	1791596330	NVTJQESSQSDBPN-OAQYLSRUSA-N	448.520	1.109	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(C)(C)CCl	1792782545	WIYBHPXSNGTLCQ-QKPAOTATSA-N	443.972	1.850	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1Cc3ccccc3O1)C2	1792870254	AQSCNMTYHPNETM-CNGORYIKSA-N	437.334	1.611	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(OC(F)(F)F)cc1)C2)[C@@H](O)CCl	1792980976	XQQNNRXZVIVEGN-NEBZKDRISA-N	436.814	1.388	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1cncc(C(F)(F)F)c1)C2)[C@H](O)CCl	1792982410	CRUBXSJXXOHMGM-IARIHHJXSA-N	449.857	1.222	50	20	IDGD	
O=C(COc1ccc(Cl)c(F)c1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2	1793292652	WRNWZYYRRCMKCC-RERORNDZSA-N	435.279	1.047	50	20	IDGD	
O=C(CC1Cc2ccccc2C1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1	1796189638	KIACTTVZOLKXPV-NUNAXRQHSA-N	432.329	1.423	50	20	IDGD	
COc1ccc2[nH]cc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3cccc(B(O)O)c3)c2c1	1796191561	XVTCEFPDCJLGAK-BCDXTJNWSA-N	447.300	1.422	50	20	IDGD	
CC(C)[C@H](CNC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Cl	1796368169	FEYGEEHQIMQBOT-XFIYOXNOSA-N	449.951	1.907	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(Cl)nc1Cl	1798029286	MQVAUYUZNXCGAN-QPPBUOOMSA-N	436.723	1.845	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(O)c(F)c1	1799546962	NXQUDSBIHVCQPG-VFFTVRQLSA-N	429.286	1.766	50	20	IDGD	
CN(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CC(C)(C)O)C2)NC(=O)NCc1ccccc1	1799864974	VVXGWPRCVJPPDJ-REPLKXPHSA-N	445.564	1.132	50	20	IDGD	
CN(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H]1C[C@H]1F)C2)NC(=O)NCc1ccccc1	1799869872	UBYWQWMGOSWOPI-XCDZQEORSA-N	431.512	1.329	50	20	IDGD	
COc1cccc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)Br)n1	1800757927	WPHRLALABXKPAN-ZUMXRPEOSA-N	440.338	1.396	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCC(N)=O	1801665946	PPWGILVJRLJZQU-BTTYYORXSA-N	432.433	1.037	50	20	IDGD	
C#CC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](Cl)COC	1802283176	PUPCNMDVEHTGLX-JJTUDDRGSA-N	441.956	1.795	50	20	IDGD	
COc1cc(F)c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CCC(=O)NN(C)C)c(F)c1	1802337947	INXIETWUYTZXAH-BTTYYORXSA-N	438.475	1.598	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2nc(O)n3c2CCCC3)[C@H]1c1cccnc1)[C@H](O)CCl	1803143036	RLNBMZGWAXIMOO-LESCRADOSA-N	447.923	1.239	50	20	IDGD	
COc1cncc(CCC(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)c1	1804482115	QGUYXHRGQUMMFD-CUWPLCDZSA-N	446.935	1.724	50	20	IDGD	
O=C(Cc1ncccn1)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@H]1c1cccnc1	1804694174	HBSWOLSBEAMYKM-RRQGHBQHSA-N	436.285	1.811	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)C2CCCC2)[C@@H]1c1cccnc1	1806180579	KAXODGXHGNOQNN-PXNSSMCTSA-N	436.516	1.590	50	20	IDGD	
O=C(CCC(F)(F)F)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1806825183	HFLXCMNENQXYTB-QFBILLFUSA-N	449.238	1.424	50	20	IDGD	
O=C(C[C@H]1CCCCO1)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1	1809975157	VKIOYYYHVDOXTF-HXUWFJFHSA-N	428.338	1.170	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)[C@H]3Cc4ccccc4O3)CC2)C1	1809978728	LYIPOYKWJVFGSL-JOCHJYFZSA-N	448.328	1.215	50	20	IDGD	
C=CC[C@H](C(=C)C)C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1810173453	VMWCPSYRIRPZBB-MZYLBHOOSA-N	447.344	1.849	50	20	IDGD	
CNC(=S)NCCC(=O)NC[C@H]1CCN(C(=O)C(Cl)Cl)[C@H]1c1cccnc1	1810309657	CDWFKLWPRFTOAY-OCCSQVGLSA-N	432.377	1.375	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1CCN(C(=O)Cn2ccccc2=O)[C@@H]1c1cccnc1	1810541499	KMLMRJYFVPANOI-PGRDOPGGSA-N	442.592	1.801	50	20	IDGD	
CN(C)c1ccc(C(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)cn1	1811060040	KOXVYQJRGVKMNG-KVSKMBFKSA-N	431.924	1.462	50	20	IDGD	
C=CCNC(=O)/C=C\C(=O)N1CC[C@H](CNC(=O)[C@@H](C)Br)[C@H]1c1cccnc1	1812864506	UNPOZIRDGSUEQV-PAEIFRNCSA-N	449.349	1.729	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2cc(=O)ccn2C)[C@@H]1c1cccnc1	1813032253	VZKZONJZPSOUIG-VDZJLULYSA-N	432.908	1.354	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)[C@]2(C)CC2(F)F)[C@@H]1c1cccnc1	1814079214	QECNSPHHHBQWJS-BPAFIMBUSA-N	437.491	1.506	50	20	IDGD	
O=C1CC[C@H](C(=O)Nc2cc([C@H]3CCCCN3C(=O)CCBr)[nH]n2)CN1	1814522794	IIBHLASRQVGZNM-WCQYABFASA-N	426.315	1.713	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1ccoc1Cl)CC2)c1cccc(B(O)O)c1	1815360835	OPDUBFRNTGSGMA-GFCCVEGCSA-N	445.693	1.609	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CS(=O)(=O)N2CCCC2)n[nH]1	1818108977	HVUPDICOEYUPJS-UKRRQHHQSA-N	445.973	1.845	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)C2=COCC2)[nH]n1	1818114276	QPSCBZBBIGWXMN-PDERCVKFSA-N	439.476	1.840	50	20	IDGD	
Cc1cc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)cn1C	1818298694	OSPLOZVJYXNOCD-IBGZPJMESA-N	435.293	1.356	50	20	IDGD	
CCOC(=O)N[C@@H](O)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)C(C)(C)CCl)[nH]n1	1819238014	OXUIRWWFBAFVAE-WFASDCNBSA-N	429.905	1.731	50	20	IDGD	
C[Si](C)(C)OCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H]1CCCS1(=O)=O)CC2	1820169667	REYLJYZJBBWCEN-BXUZGUMPSA-N	445.639	1.484	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)CCl)CC2)c1nc(O)n2c1CCCC2	1820232802	KARVATUHRDDALA-SKDRFNHKSA-N	439.925	1.207	50	20	IDGD	
C[C@@H]1C[C@]1(C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1820770698	VEUVEKHRDZKEFM-PKQAIAMASA-N	425.493	1.760	50	20	IDGD	
CNC(=S)NCCC(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](F)Br)n[nH]1	1820934978	DWSUFBASWNUKBK-GWCFXTLKSA-N	449.350	1.576	50	20	IDGD	
Cc1ncsc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1	1822412690	FBGFLGKFLHGYEX-CQSZACIVSA-N	433.538	1.854	50	20	IDGD	
C[C@@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCBr)[nH]n1)n1cnnn1	1822857109	WBXPXERAUIPRMX-JQWIXIFHSA-N	425.291	1.435	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)C2=NN(C)C(=O)CC2)CC1	1824928434	UCTFEMFFEHWUGT-DOTOQJQBSA-N	426.945	1.468	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCc1cccnc1)CC2	1826085233	KOZRBPXCAHYMEJ-OAHLLOKOSA-N	444.561	1.456	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)CCn3ccnn3)sc2C1	1826879341	MZOGPDNYWDICAM-ZJUUUORDSA-N	427.328	1.520	50	20	IDGD	
COCC1(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)CC2)CC1	1828923872	YNFRIFMKAQINQT-IBGZPJMESA-N	443.548	1.345	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)c2ccncc2O)CC1	1829175240	SZKPIGQURWWBSZ-HXUWFJFHSA-N	437.305	1.014	50	20	IDGD	
Cc1nccn1CCCC(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830370542	TUNNPPAHSFBWMC-NRFANRHFSA-N	440.972	1.693	50	20	IDGD	
O=C(c1c[nH]c(=O)cn1)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](F)Br)CC1	1830380519	PPYWKUANAKPMPV-DZGCQCFKSA-N	429.290	1.694	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccs3)C2)C1	1830537858	QRIPQLNFLXDKPD-SUMWQHHRSA-N	431.352	1.849	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)CSC1CCCC1)CCO2	1831362211	ZDIOTJPUFQOWFS-HXUWFJFHSA-N	444.670	1.970	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)C(C)(F)F)CCO2	1831684171	GTEIMBXXLUOZDJ-SJKOYZFVSA-N	441.313	1.908	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)CS[C@H]3CCCCO3)CC2)CC1)[C@H](O)CCl	1833311794	DZSSNOSQERTVDX-MJGOQNOKSA-N	448.029	1.418	50	20	IDGD	
CCc1oncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](Br)CC)C2)C1	1834522363	RIEUFTQZLUAVKG-KSSFIOAISA-N	444.326	1.481	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3[nH]nnc3C)CC2)CC1	1834935711	VISKTJLYQAHVNG-HNNXBMFYSA-N	441.374	1.472	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)COc3ccccc3C)CCO2)C1	1835155412	PUQQGFHFDQYUME-DYESRHJHSA-N	440.924	1.084	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC1CCN(C2CCN(C(=O)[C@H]3CCC(=O)N3)CC2)CC1	1836398450	KOGVDBOEAKDMLW-DNVCBOLYSA-N	433.380	1.073	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3csnn3)CC2)CC1)[C@H](F)Br	1836414217	YXKHYAGUYXRQMV-ZDUSSCGKSA-N	434.335	1.414	50	20	IDGD	
CN(C)c1ccc(C(=O)N2CCC(OC3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)nc1	1836714885	AIHNIBXYCXDVHN-IBGZPJMESA-N	438.956	1.360	50	20	IDGD	
COc1ccc(C(=O)N2CCOC[C@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)s1	1837710033	DCILJPPQJXPKGN-IBGZPJMESA-N	442.610	1.678	50	20	IDGD	
COc1ccc2[nH]cc(C(=O)N3CCO[C@@]4(COCCN(C(=O)[C@@H](F)Cl)C4)C3)c2n1	1838487665	CSYNAOKDXCNMLR-APWZRJJASA-N	440.859	1.176	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc4ccc(F)cn34)C2)C1	1839147888	FZDFZQVPIHFWBZ-FOIQADDNSA-N	438.887	1.561	50	20	IDGD	
Cc1cccnc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2	1839150436	MPDCSGZFJLEWCE-MOPGFXCFSA-N	430.332	1.696	50	20	IDGD	
CCn1nc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)cc1C	1839153826	SWDIKGNKCYHXLX-MOPGFXCFSA-N	447.363	1.518	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnn4c3CCC4)CCO2)C1	1839532950	KDYHYHPOAWVFLO-MOPGFXCFSA-N	445.347	1.136	50	20	IDGD	
CCn1nc(C)cc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)Br)CCO2	1840032511	ASYYSUBHCPRYHT-KBXCAEBGSA-N	443.342	1.065	50	20	IDGD	
CC(C)c1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)on1	1840034329	HZSMLXBBCUUSKZ-SCLBCKFNSA-N	444.326	1.651	50	20	IDGD	
O=C(C(Cl)Cl)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CCc4ccoc4C3)C2)C1	1840186742	OBLBCUZGBYOSID-IFXJQAMLSA-N	431.316	1.645	50	20	IDGD	
Cc1cncc(CCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)c1	1840186814	VKDXDAYRJCSHBT-LJQANCHMSA-N	430.332	1.583	50	20	IDGD	
O=C(CCCc1cccnc1)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1840513873	VWOVELRCHOFWBG-LJQANCHMSA-N	430.332	1.664	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC12CN(C(=O)Cn1c(=O)n(C)c3ccccc31)C2	1841287499	RBZLYXGJQQSENM-CQSZACIVSA-N	449.349	1.574	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@H](C(=O)N2CC3(CCCN3C(=O)[C@H](O)CCl)C2)C[C@@H](F)C1	1841351620	WEKZVZUULZHQGX-RRFJBIMHSA-N	447.935	1.385	50	20	IDGD	
O=C(Cc1ccccc1C(F)(F)F)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843010798	DWIFFUSADOBVEJ-UHFFFAOYSA-N	446.234	1.445	50	20	IDGD	
C[C@H](C(=O)N1CCCC12CN(C(=O)[C@@H](F)Br)C2)N1CSCSC1	1844318698	DNBJSFZFAKGVOT-GHMZBOCLSA-N	426.377	1.923	50	20	IDGD	
Cc1ccc(S(=O)(=O)CC(=O)N2CC3(CCCN3C(=O)[C@H](F)Br)C2)cc1	1845216795	LERAJKCIOGQGKF-HNNXBMFYSA-N	447.326	1.663	50	20	IDGD	
CN1CCCn2nc(C(=O)N3CC4(CCCN4C(=O)[C@@H](F)Br)C3)cc2C1	1845219334	JFQLLURDYGMWGE-CQSZACIVSA-N	428.306	1.226	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC2(CCCN2C(=O)[C@@H]2CC(c3ccccc3)=NN2)C1	1845741153	ZMCXLUKCFYIABY-PBHICJAKSA-N	433.350	1.987	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCN(C(=O)NNC(=O)c3ccccc3C)CC2)cc1	9796630	HUCQVSJDLMMFJE-UHFFFAOYSA-N	432.502	1.365	50	20	IDGD	
O=C(CCCNS(=O)(=O)c1ccc2c(c1)OCCCO2)NNC(=O)c1ccccc1	15435377	YZOFNCMFSGOGFN-UHFFFAOYSA-N	433.486	1.368	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc(Cl)sc1Cl)c1csc(N2CCOCC2)n1	20629079	QROHQVXQOGXNTI-UHFFFAOYSA-N	443.359	1.971	50	20	IDGD	
COc1ccc([C@]2(C)NC(=O)N(CC(=O)NNC(=O)c3ccc4ccccc4n3)C2=O)cc1	21007873	UTRKESXXOJCHTQ-QHCPKHFHSA-N	447.451	1.472	50	20	IDGD	
CN(CC(=O)NNC(=O)c1cc(Br)c[nH]1)S(=O)(=O)c1ccc(Cl)cc1	23914146	IBNFTIJBCUVPSA-UHFFFAOYSA-N	449.714	1.512	50	20	IDGD	
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)NNC(=O)c1ccc2ccccc2n1	27682506	BXUCTNGGLJXUEC-IBGZPJMESA-N	449.467	1.556	50	20	IDGD	
COc1ccc(Cl)cc1NCC(=O)NNC(=O)c1sc(N2CCOCC2)nc1C	727099541	YKLVUQXTVWYWMP-UHFFFAOYSA-N	439.925	1.823	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2cccc(C(=O)NNC(=O)c3cccc(C#N)c3)c2)C[C@H](C)O1	728828554	ZKDPNQGTYOIRHH-GJZGRUSLSA-N	442.497	1.431	50	20	IDGD	
O=C(NCc1ccccc1Cn1ccnc1)NNC(=O)C1CCN(c2ncccn2)CC1	728944304	UCGMAAZQAQEKIX-UHFFFAOYSA-N	434.504	1.468	50	20	IDGD	
COCCOc1cn(-c2ccccc2)nc1C(=O)NNC(=O)CNC(=O)c1cccs1	729358554	FMMAZNUMLZCSBE-UHFFFAOYSA-N	443.485	1.150	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)CC(F)(F)F)cc1Br	729523974	KIIOAYRSBFZMSD-UHFFFAOYSA-N	432.218	1.413	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2cc3c(cc2[N+](=O)[O-])OCCO3)c(OC)c1	729963150	BVTMIJRXXDEVNW-UHFFFAOYSA-N	439.402	1.007	50	20	IDGD	
Cc1oc(C(=O)NNC(=O)c2cccc3ncccc23)cc1S(=O)(=O)N1CCCC1	730224853	CTPMBAWUQWIFIH-UHFFFAOYSA-N	428.470	1.996	50	20	IDGD	
Cn1nc(SCC(=O)NN=Cc2c(-c3ccccc3)[nH]c3ccccc23)c(=O)n(C)c1=O	730569394	YERBSRLTWMVEKO-UHFFFAOYSA-N	448.508	1.870	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1cc(F)ccc1N1CCOCC1	730777428	ZUVLIIMRRFSLJU-UHFFFAOYSA-N	428.468	1.130	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccccc1	730779568	GMLGABURDZSKCU-INIZCTEOSA-N	433.486	1.162	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCC(C)(C)N2CCC(OC)CC2)c2ccccc2c1=O	730907537	FFNRKIXEUOSCBR-UHFFFAOYSA-N	444.536	1.250	50	20	IDGD	
CN(CCN1CCN(CC(=O)NNC(=O)c2cccc(Cl)c2)CC1)Cc1ccccc1	731213136	JXOSOSGETHHCNL-UHFFFAOYSA-N	443.979	1.851	50	20	IDGD	
C[C@H]1CCC[C@H](NC(=O)CN2CCN(CC(=O)NNC(=O)c3cccc(Cl)c3)CC2)C1	731214309	CLNWYFDEGAWYEE-LPHOPBHVSA-N	449.983	1.414	50	20	IDGD	
COc1cc(C=O)c([N+](=O)[O-])cc1OCC(=O)NNC(=O)c1cc(Br)c[nH]1	731599298	NWBACBXICFCWTI-UHFFFAOYSA-N	441.194	1.347	50	20	IDGD	
CS(=O)(=O)CCN1CCC(NC(=O)NNC(=O)Cc2ccc3ccccc3c2)CC1	731686584	DIESGAPXQDPVPF-UHFFFAOYSA-N	432.546	1.222	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)C2CCC2)c(Br)cc1Cl	732048039	RAHRCUUQBXXFSG-UHFFFAOYSA-N	425.688	1.999	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)C[C@@H](C)O1	732261363	CGPDOEOARMOTLP-CHWSQXEVSA-N	433.490	1.979	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)NCC2(O)CCCC2)cc1	733977692	IRFWNDUOUWATSB-ATVHPVEESA-N	437.500	1.762	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)COc2cc(OC)ccc2C=O)c2ccccc2c1=O	734417807	UUUCDDFDIXPEGN-UHFFFAOYSA-N	438.440	1.468	50	20	IDGD	
CN1C(=O)CC[C@@H](C(=O)NNC(=O)N2CCOCC2)[C@H]1c1ccc(C(F)(F)F)cc1	734429312	MBPLVMYOJQOUHM-GDBMZVCRSA-N	428.411	1.688	50	20	IDGD	
COc1ccc(-c2nn(CCC#N)cc2/C=C(\C#N)C(=O)NCC[S@](C)=O)cc1OC	735044726	BUJCNRXBYMLELT-IFQLAXCMSA-N	441.513	1.883	50	20	IDGD	
COc1ccc(-c2nn(CCC#N)cc2/C=C(\C#N)C(=O)NCC[S@@](C)=O)cc1OC	735044731	BUJCNRXBYMLELT-RCKGABTRSA-N	441.513	1.883	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](C(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1cccc(Cl)c1	740815048	IABQZOWRJLTBQH-TZMCWYRMSA-N	445.925	1.488	50	20	IDGD	
C#CCOc1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(CC)CC)c2)cc1	741658958	IUZUAQPWMISYDL-UHFFFAOYSA-N	429.498	1.804	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)CCN3C(=O)[C@H]4[C@H]5CC[C@@H](O5)[C@@H]4C3=O)cc2C1	742480453	PLQHYAMOCCEVRY-IQWYXEQVSA-N	431.514	1.186	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)c1cc(NS(C)(=O)=O)c(OC)c(OC)c1	743320230	WSTFMIBQWPIOGW-UHFFFAOYSA-N	437.474	1.088	50	20	IDGD	
C[C@]1(c2ccc3ccccc3c2)NC(=O)N(CC(=O)NNc2ncnc3[nH]cnc23)C1=O	743472995	IFCWELHUEMABDZ-OAQYLSRUSA-N	430.428	1.416	50	20	IDGD	
CS(=O)(=O)c1ccc(OCCCC(=O)NNC(=O)COc2ccc(C#N)cc2)cc1	743737833	DEQNMXQNRCJJPB-UHFFFAOYSA-N	431.470	1.347	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)c2ccc(S(=O)(=O)N(C)C(C)C)cc2)c1	744634799	ITUGEHBUAFMKAS-UHFFFAOYSA-N	447.513	1.642	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)N[C@H](C)CN2CCN(C)CC2)cc1Cl	745807270	BNJRJUULKRUURG-GFCCVEGCSA-N	428.921	1.329	50	20	IDGD	
CN(C)C(=O)NNC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(Br)s1	746014258	ABVRKIBCQAPUQS-VIFPVBQESA-N	439.357	1.356	50	20	IDGD	
CC(C)(C)OC(=O)NC1(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)CCCCC1	746821518	IPGNECZJMYLLBO-UHFFFAOYSA-N	429.481	1.651	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)ccc1F	747595901	JXXJETZTTVJTLU-UHFFFAOYSA-N	442.421	1.261	50	20	IDGD	
COc1ccccc1C(=O)NNS(=O)(=O)c1ccc(C(=O)O)cc1Br	747616037	MREJEBREPQOGGW-UHFFFAOYSA-N	429.248	1.779	50	20	IDGD	
Cc1sc2nc(CS[C@H](C)C(=O)NNC(=O)C(=O)N3CCCC3)nc(O)c2c1C	748247855	WFGQNQWOWZASIV-LLVKDONJSA-N	437.547	1.405	50	20	IDGD	
Cc1c(Br)cc(S(=O)(=O)NNC(=O)c2ccc(C#N)cc2)cc1C(=O)O	748641273	HVIXJDADWVHDMK-UHFFFAOYSA-N	438.259	1.951	50	20	IDGD	
N#Cc1ccc(CC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)cc1	749838873	XQZUCJSMSAGKDM-UHFFFAOYSA-N	426.498	1.737	50	20	IDGD	
CC(=NNC(=O)CNC(=O)c1ccco1)c1ccc(OCC(=O)N2CCCCC2)cc1	750938850	RAKIUJVYLIGGIO-UHFFFAOYSA-N	426.473	1.941	50	20	IDGD	
CCc1cccc(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N(CC)CC)c2)c1	751201899	HARCSLFSMGHFHY-UHFFFAOYSA-N	439.559	1.903	50	20	IDGD	
COC(=O)c1ccc(Cl)cc1S(=O)(=O)NNC(=O)c1ccc(OC)c(OC)c1	751267353	QQVMNENPVXRTOF-UHFFFAOYSA-N	428.850	1.767	50	20	IDGD	
CC[C@H](C)C(=O)N1Cc2ccccc2C[C@@H]1C(=O)NNC(=O)[C@H]1COc2ccccc2O1	751291897	YQWREXFRINGNDE-RRMPHLOHSA-N	437.496	1.973	50	20	IDGD	
Cn1cnc2cc(C(=O)NNC(=O)c3cccc(S(=O)(=O)N4CCCCC4)c3)ccc21	753378604	DRBPOADOVDRTJS-UHFFFAOYSA-N	441.513	1.823	50	20	IDGD	
O=C(NNc1ccc(C(F)(F)F)nn1)c1cccc(S(=O)(=O)NC[C@H]2CCCO2)c1	755295345	ZIUPTZCCSFCCDN-GFCCVEGCSA-N	445.423	1.710	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)C[C@@](C)(O)C3CC3)c2)cc1	755381350	LBRKKBPUKYYWOL-OAQYLSRUSA-N	447.513	1.808	50	20	IDGD	
COc1ccc(OC)c(NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)c1	755388733	DGOWSFMWBRGXQR-UHFFFAOYSA-N	436.490	1.486	50	20	IDGD	
C[C@H]1CCCN(S(=O)(=O)c2ccc(NC(=O)NNC(=O)Cc3cccnc3)cc2)C1	755447169	JSOFQVACBSKCII-HNNXBMFYSA-N	431.518	1.898	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)Nc1ccc(CC(=O)N2CCOCC2)cc1	755861528	GBXLJZDOCNFHKK-UHFFFAOYSA-N	427.417	1.463	50	20	IDGD	
CCc1cnc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(OC)c(OC)c3)[nH]n2)s1	756169671	NXQRDTOWAIOXOI-UHFFFAOYSA-N	444.473	1.513	50	20	IDGD	
CS(=O)(=O)Cc1ccccc1NC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	756269355	PKXIYUTXCUTXAY-UHFFFAOYSA-N	425.488	1.101	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)Nc1cnn(C[C@@H]2CCCO2)c1	756739836	QLFSORUDKWSBDY-FQEVSTJZSA-N	441.536	1.427	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1cc(Br)c(F)cc1Cl	757595026	ADRBUTGBWNHYCP-YFKPBYRVSA-N	431.671	1.332	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2ccc([N+](=O)[O-])cc2F)cc1	758337108	WFJHFGWXTKZPHW-UHFFFAOYSA-N	439.425	1.516	50	20	IDGD	
CC[C@H]1CN(CC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)CCN1Cc1ccccc1	759892138	VLXPZMFENGJHEC-IBGZPJMESA-N	425.489	1.952	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)c1noc(-c2ccccc2)n1	761790999	LAOMPKJYRXWTSA-GFCCVEGCSA-N	429.458	1.845	50	20	IDGD	
O=C(Cc1csc(NC(=O)c2ccccc2)n1)NNc1nccc(N2CCOCC2)n1	762854751	HBFIGVQZZKWWHN-UHFFFAOYSA-N	439.501	1.708	50	20	IDGD	
O=C(CCCC[C@@H]1SC[C@H]2NC(=O)N[C@H]21)NNC(=O)c1cc(-c2cccs2)[nH]n1	763157864	MAIGBIGHCMJRFQ-IVMMDQJWSA-N	434.547	1.625	50	20	IDGD	
CCN1CCN(c2ccc(NC(=O)C(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)cc2)CC1	763441181	AAZNLQDTPLOXRH-UHFFFAOYSA-N	440.460	1.136	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)n(-c2ccccc2F)n1	763444937	CVKHXHWBPYODRZ-UHFFFAOYSA-N	426.364	1.628	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(OC)c(OC)c2)cc1OCC	763550081	DPHSYUCEIXUICL-UHFFFAOYSA-N	431.445	1.901	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)Nc1ccccc1OC1CCCC1	763573701	UNCHIWIVUZPNMZ-IBGZPJMESA-N	425.441	1.934	50	20	IDGD	
CNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)COc2cccc(C(F)(F)F)c2)c1	763639250	KDHVXVWPIJDXOR-UHFFFAOYSA-N	438.362	1.230	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(Cc2ccncc2)cc1	763645793	CBKZESXDWZLXCP-UHFFFAOYSA-N	434.452	1.846	50	20	IDGD	
CSc1cc2c(cc1NC(=O)C(=O)NNC(=O)COc1cc(C)ccc1C)OCCO2	763666012	UJLSQGLJDDKFHV-UHFFFAOYSA-N	445.497	1.961	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(-c2ncon2)cc1	763682303	QPZMMPZVBYURLT-UHFFFAOYSA-N	425.401	1.300	50	20	IDGD	
O=C(CN1CCCc2ccccc21)NNC(=O)C(=O)Nc1ccnn1Cc1ccccc1	763745770	KBDDSTGHMMOXNK-UHFFFAOYSA-N	432.484	1.470	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2cccc(Cl)c2)cccc1C(=O)N1CCOCC1	763747410	KJVVFPGLVUPIPK-UHFFFAOYSA-N	444.875	1.521	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)C(=O)N1C[C@@H]2CCCN2c2ccccc21	763790633	MARWITYWXQJONC-ZDUSSCGKSA-N	432.440	1.112	50	20	IDGD	
N#Cc1c(F)cccc1-n1ccc(NC(=O)C(=O)NNC(=O)Cc2c[nH]c3ccccc23)n1	763856244	GEJBFFLLJBLYRZ-UHFFFAOYSA-N	445.414	1.693	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)NNC(=O)C(=O)Nc1ccccc1CN1CCOCC1	763857808	OVGZSBSJRPCWQQ-UHFFFAOYSA-N	435.484	1.329	50	20	IDGD	
COc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccc(F)cc1	763872878	PSIKUMQSTUALPC-GFCCVEGCSA-N	446.435	1.090	50	20	IDGD	
CCOCc1cccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(C(C)=O)cc2)c1	763877168	ICFGDQIMVYFYPF-OAHLLOKOSA-N	427.457	1.979	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)C(=O)Nc2cc(C)nn2C2CCOCC2)cc1	763897201	YBKCGSKQTJKCFW-UHFFFAOYSA-N	431.518	1.730	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc(OCCN2CCN(C)CC2)cc1	763961042	XVTWHLWBLZZMKM-UHFFFAOYSA-N	439.516	1.021	50	20	IDGD	
CCOC(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)on2)c1	764004079	QLMWEFZJVYPIHW-UHFFFAOYSA-N	436.424	1.847	50	20	IDGD	
COc1cc2nc(C)sc2cc1NC(=O)C(=O)NNC(=O)c1ccc2c(c1)OCCO2	764005545	ADBSJMBAJAOPMX-UHFFFAOYSA-N	442.453	1.784	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(OCC(F)(F)C(F)F)nc2)c(O)c1	764111275	OIVMGLSVIJGXNN-UHFFFAOYSA-N	444.341	1.775	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccc(OCc2nc(C)no2)cc1	764136010	LKIKCGIEKPNLLU-UHFFFAOYSA-N	439.428	1.294	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)C(=O)Nc2cccc(CN(C)C)c2)c1	764233313	WWODOBITGXCGOP-UHFFFAOYSA-N	449.305	1.919	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(C#N)c2)cc1OCC(F)(F)F	764241863	MQARAHZEOZVARN-UHFFFAOYSA-N	436.346	1.908	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)Cc2cccnc2)cc1OCC(F)(F)F	764267254	GCIHIUZZHKJLDE-UHFFFAOYSA-N	426.351	1.360	50	20	IDGD	
CC(=O)N(Cc1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2O)cc1)C1CC1	764275788	VFEWXWZMCSQVOH-UHFFFAOYSA-N	440.456	1.068	50	20	IDGD	
CCOC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)CCc2ccccc2O)cc1C#N	764281212	MSJNZLTYZGBUTA-UHFFFAOYSA-N	439.428	1.551	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)Cc2cc[nH]n2)nn1-c1ccc(Cl)cc1Cl	764286624	YRGRAIVMDKCLOE-UHFFFAOYSA-N	436.259	1.539	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)c(Cl)c1)C(=O)Nc1ccc(NC(=O)[C@@H]2CCCO2)cc1	764346027	RMKPCRQULKQXLT-INIZCTEOSA-N	446.847	1.563	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cccc([S@](C)=O)c3)n[nH]2)cc1	764384944	NWAYIHVZTXYWOJ-HKBQPEDESA-N	439.497	1.776	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)c(OC)n1	764386515	AEPYMRRDZNDDSD-UHFFFAOYSA-N	428.380	1.028	50	20	IDGD	
CCOC(=O)c1ccccc1NC(=O)C(=O)NNC(=O)CSc1ccccc1OC	764394548	QYTQPQJFHRINIX-UHFFFAOYSA-N	431.470	1.750	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3ccc(Cl)cc3F)cn2)C[C@H](C)O1	764411356	VXLKXGLEMNCYGW-RYUDHWBXSA-N	449.870	1.887	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCCCN2CCCO[C@H](C)C2)nc1	764572339	CXJLEMLNYPWGAC-MRXNPFEDSA-N	442.586	1.239	50	20	IDGD	
O=C(CCNS(=O)(=O)/C=C/c1ccccc1)NNC(=O)CSc1ccccc1O	765249045	NPSSSYMKDUSMEJ-ACCUITESSA-N	435.527	1.612	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)c3cccc(CS(N)(=O)=O)c3)n[nH]2)c1	765575454	IVIQSMPOEOADPP-UHFFFAOYSA-N	427.486	1.557	50	20	IDGD	
COc1ccc(S(=O)(=O)NCCC(=O)NNc2cnc3ccccc3n2)cc1OC	765995871	JWBBEMCKSNISSF-UHFFFAOYSA-N	431.474	1.459	50	20	IDGD	
NC(=O)COc1ccc(Cl)cc1S(=O)(=O)NNC(=O)c1cccc2ncccc12	766317320	JYCMBEYTWXLWFA-UHFFFAOYSA-N	434.861	1.376	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNS(=O)(=O)c2ccc(C#N)cc2OC)c1	766361683	VMKNKIDPJZYDMF-UHFFFAOYSA-N	440.275	1.961	50	20	IDGD	
CCCC(=O)N1CCC[C@@H](C(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)C1	766650615	XIYHBYYWJRJXCW-OAQYLSRUSA-N	443.592	1.299	50	20	IDGD	
O=CNc1ccc(C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)cc1	766662667	AHIJTGZKPWIHEM-UHFFFAOYSA-N	429.908	1.487	50	20	IDGD	
CCOC(Cn1cc(C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)nn1)OCC	768289141	OHJGDXOLNYHVNH-UHFFFAOYSA-N	431.428	1.281	50	20	IDGD	
COc1ccc(NNC(=O)Cc2cc(F)c(OC)c(S(N)(=O)=O)c2)c([N+](=O)[O-])c1	768332866	ZAICCCBHKLBGJT-UHFFFAOYSA-N	428.398	1.084	50	20	IDGD	
COCCN1CCN(C(=O)/C(C#N)=C/c2cn(CCC#N)nc2-c2ccccc2)CC1=O	769146877	NHZCJPOABGZURH-XMHGGMMESA-N	432.484	1.688	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)c2ccc(S(N)(=O)=O)cc2F)cc1Cl	769749093	YJSDIXWKXVKUFC-UHFFFAOYSA-N	446.844	1.610	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)[C@H](C)NS(=O)(=O)c2cccs2)n[nH]1	771043845	BVDJWTQOJWEDCC-NSHDSACASA-N	449.514	1.275	50	20	IDGD	
O=C(NNC(=O)N1CCS(=O)(=O)c2ccccc2C1)c1cc(Br)c[nH]1	773136746	UVZYJFLLMYLNBX-UHFFFAOYSA-N	427.280	1.421	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNS(=O)(=O)c1cccc(C(=O)N(C)C)c1	773266921	UGPXHLAABXKCIH-GFCCVEGCSA-N	425.894	1.819	50	20	IDGD	
CCC(CC)NC(=O)[C@@H]1CN(C(=O)C(=O)NNc2nc(C)cc(C)n2)c2ccccc2O1	773479293	GNAFJRDQJSSCAR-SFHVURJKSA-N	440.504	1.636	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNc2nccc(OC)n2)sc2c1CC[C@H](C)C2	773726139	JECYUXKZVRXUQM-JTQLQIEISA-N	433.490	1.930	50	20	IDGD	
O=C(NNc1cccc(Cl)c1)C(=O)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1	773729687	SNXWCYALKJRDMM-UHFFFAOYSA-N	438.893	1.443	50	20	IDGD	
Cc1nc(-c2ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc3cccc(Cl)c3)cc2)n[nH]1	774002169	NMDWCXYFARMTNH-LLVKDONJSA-N	442.863	1.987	50	20	IDGD	
CCOC1CC(CNC(=O)NNC(=O)c2cc(C)nc3ccccc23)(N2CCOCC2)C1	775158066	NEHUABNIRWEBKH-UHFFFAOYSA-N	441.532	1.757	50	20	IDGD	
O=C(NNS(=O)(=O)c1cnn(CC(F)(F)F)c1)c1ccc(F)cc1Br	775271624	NHPPDGYPDZJVHS-UHFFFAOYSA-N	445.192	1.970	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)Nc2ccnn2[C@H]2CCS(=O)(=O)C2)cc1OC	776059558	PQFDDXPYAMZJOU-ZDUSSCGKSA-N	437.478	1.117	50	20	IDGD	
O=C(NNC(=O)c1ccc(Br)s1)N[C@@H](CO)C[C@H](O)c1ccccc1	778590605	MYECFDYUAUKEIW-NEPJUHHUSA-N	428.308	1.939	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N[C@H]2CCCC[C@@H]2O)cc1	779333825	DXJPDAJFSBJKFD-LVVKNKJBSA-N	437.500	1.761	50	20	IDGD	
O=C(COc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(O)cc2)c1)Nc1ccccc1	782834573	YRZGEEHIUHWFOJ-UHFFFAOYSA-N	448.435	1.809	50	20	IDGD	
Cc1cn(C2CCCCC2)nc1NC(=O)C(=O)NNC(=O)Cc1nc2ccccc2n1C	782888251	VZOLNJRMGPUYGS-UHFFFAOYSA-N	437.504	1.912	50	20	IDGD	
CCc1cccc(C)c1NC(=O)C(=O)NNC(=O)c1sc(N2CCOCC2)nc1C	782897999	VMUZVVWVNPOIEV-UHFFFAOYSA-N	431.518	1.559	50	20	IDGD	
CO[C@H](C)C(=O)Nc1cccc(NC(=O)C(=O)NN=c2sc3ccccc3n2C)c1	783352575	ZJSJUHKMLSHLHT-GFCCVEGCSA-N	427.486	1.784	50	20	IDGD	
C[C@H]1CCC[C@H](OCc2cccc(NC(=O)C(=O)NNC(=O)C(=O)N3CCCC3)c2)C1	784003263	SJPXKHICYCKCCX-YJBOKZPZSA-N	430.505	1.490	50	20	IDGD	
CCn1c(NNC(=O)c2cc3c(=O)n4ccccc4nc3n2C)nc2ccccc2c1=O	784338412	YPIYVNLRVLMEPJ-UHFFFAOYSA-N	429.440	1.673	50	20	IDGD	
CC(=O)NCc1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)cc1	784835665	RQQNELCLORNKBD-UHFFFAOYSA-N	440.428	1.401	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNc2cc(F)c(F)cc2F)cc1OC	784886659	RLFWNQRRFQSENF-UHFFFAOYSA-N	446.407	1.956	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)cc(OC)c1C(C)C	785023391	HCTBDWGNIJKWSB-UHFFFAOYSA-N	446.416	1.841	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)[C@H]3CN(C)C(=O)c4ccccc43)n[nH]2)cc1OC	785183489	XYNZNDUJPAKFQR-INIZCTEOSA-N	449.467	1.724	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NN[C@@H](C(=O)OC)c2ccsc2)c1	788406398	PULSGEPLGWIEHV-MRXNPFEDSA-N	425.532	1.927	50	20	IDGD	
COC(=O)COc1ccc(C=NNC(=O)C2CCN(c3ncccn3)CC2)cc1[N+](=O)[O-]	788714297	UZFNZVMZMSNMNA-UHFFFAOYSA-N	442.432	1.303	50	20	IDGD	
CC(C)c1cc(NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)n(-c2ncccn2)n1	789258126	NFGFBGFSGAMTRX-UHFFFAOYSA-N	447.459	1.499	50	20	IDGD	
CC(=O)Nc1ccc(CNC(=O)NNC(=O)COc2ccc(Br)cc2)cn1	789300055	VDLYVBXEGPPYKH-UHFFFAOYSA-N	436.266	1.712	50	20	IDGD	
CN1C(=O)Cc2cc(NC(=O)C(=O)NNC(=O)c3cc(Br)ccc3O)ccc21	789734587	KQCIDZVFULLCHL-UHFFFAOYSA-N	447.245	1.073	50	20	IDGD	
COc1ccc(Cn2ccc(NC(=O)C(=O)NNc3ccc4c(=O)[nH]ccc4c3)n2)cc1	793070496	SYJWIQQRSQGYAB-UHFFFAOYSA-N	432.440	1.863	50	20	IDGD	
Cc1nc2ccc(Br)cn2c1C(=O)NNC(=O)CNC(=O)OC(C)(C)C	793783079	JUKLYBAQVDEMKD-UHFFFAOYSA-N	426.271	1.691	50	20	IDGD	
COc1ccc(Cl)c(NC(=O)C(=O)NNC(=O)CNC(=O)OCc2ccccc2)c1	797369310	SGGNYPDFFPSGHO-UHFFFAOYSA-N	434.836	1.361	50	20	IDGD	
CC(=O)N[C@](C)(C(=O)NNc1oc(C(C)C)nc1C#N)c1ccc(S(C)(=O)=O)cc1	797716173	MOIDPUXRMHVQLU-IBGZPJMESA-N	433.490	1.568	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@@H]1CC(C(=O)NNC(=O)c2cc(-c3ccccc3)on2)=NO1	798857348	UEWGRTPRTUPLSY-ZDUSSCGKSA-N	429.433	1.772	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NN=C3CCCc4cccnc43)CC2)cc1	799110798	FDVSRGZDDUAXSM-UHFFFAOYSA-N	441.557	1.553	50	20	IDGD	
CN1C(=O)COc2cc(NC(=O)C(=O)NNC(=O)c3ccccc3Br)ccc21	799257757	RMIHJXYEVIRDQQ-UHFFFAOYSA-N	447.245	1.204	50	20	IDGD	
Cn1cccc1C(=O)NNS(=O)(=O)c1c(Cl)nc2ccc(Br)cn12	799916057	FQNVANOWJRNCDG-UHFFFAOYSA-N	432.687	1.712	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)Nc2nc(C3CCOCC3)cs2)c2ccccc2c1=O	806725758	HORIAWNRQUXVBS-UHFFFAOYSA-N	428.474	1.751	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)Nc1nc2c(Br)cccc2s1	806741046	PJLMJTMQKGGEDG-ZETCQYMHSA-N	433.309	1.646	50	20	IDGD	
COC(=O)CC[C@@H](NC(=O)OC(C)(C)C)C(=O)NNc1nc2ccccc2c(=O)n1C	806853133	RCMMBMRTSQTPKX-CQSZACIVSA-N	433.465	1.223	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1cccc2c1CNC2=O	806968582	LTHDPTHRKBBCMO-UHFFFAOYSA-N	445.501	1.089	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)Nc1nc(-c2ccc(F)cc2)cs1	806973193	DAJPRKOTGZQGIJ-MRXNPFEDSA-N	442.428	1.875	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cnn(C)c1-c1ccccc1	806974054	ROFISZYULWFXHZ-UHFFFAOYSA-N	437.456	1.651	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNc2nccnc2OC)c(C)cc1Br	806980979	FZNBDGIMCFQIMC-UHFFFAOYSA-N	438.238	1.425	50	20	IDGD	
CCCNC(=O)[C@H]1CN(C(=O)C(=O)NNc2nccnc2C2CCC2)c2ccccc2O1	807460164	LGIXYDQVIBHJHI-QGZVFWFLSA-N	438.488	1.508	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2ccnc(C(F)(F)F)c2)cc1	808375037	KEQNARQFAGDSEI-UHFFFAOYSA-N	430.408	1.491	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)[C@@H]1C[C@H](c2ccccc2)OC1=O	809539105	YRIRUDLNWBGNPR-LEWJYISDSA-N	436.512	1.651	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)OCc2cnnn2C)cc1	811048905	HBZOYEXOKBYJSL-DHDCSXOGSA-N	435.444	1.213	50	20	IDGD	
CC(=NNC(=O)N=c1cc[nH]cc1)c1ccc(S(=O)(=O)N2CCC(C(=O)O)CC2)cc1	815000156	GOVMOMVXBUFUNN-UHFFFAOYSA-N	445.501	1.535	50	20	IDGD	
COc1ccccc1N(C)S(=O)(=O)c1ccc(C)c(C(=O)N2CC[C@@H](B(O)O)C2)c1	864234662	ZEQKKSNCJGBJKT-OAHLLOKOSA-N	432.307	1.518	50	20	IDGD	
COc1cccc(C[C@H](C(=O)NNC(=O)c2ccc(Cl)cc2OC)n2nnnc2C)c1	915687576	FZQHVQFNUXRQBH-QGZVFWFLSA-N	444.879	1.897	50	20	IDGD	
Cc1ccccc1CCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	915909802	JCLYNWJWLCLPTP-UHFFFAOYSA-N	446.529	1.203	50	20	IDGD	
CC[C@@H](CNC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)N1CCc2ccccc2C1	916447629	BBNQKDRZPODVDC-SFHVURJKSA-N	448.527	1.714	50	20	IDGD	
Cc1ccc(C(=O)NNS(=O)(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c(O)c1	917753689	MXVHPJPNKDIFCY-UHFFFAOYSA-N	439.515	1.108	50	20	IDGD	
O=C(NCCCOCCc1ccccc1)NNC(=O)c1csc(N2CCOCC2)n1	918019465	VKAODQXFAFRSAR-UHFFFAOYSA-N	433.534	1.573	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)c2ccc(C)cc2O)cc1S(=O)(=O)N1CCOCC1	918339115	IBOQMVJNIMPSEE-UHFFFAOYSA-N	447.513	1.359	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)c2cc(NS(C)(=O)=O)ccc2O)cc1	919806610	KJYTZHUOULJTDG-LBPRGKRZSA-N	437.474	1.391	50	20	IDGD	
CNC(=O)NNC(=O)c1cccc(NC(=O)C[C@H]2SC(N3CCCCC3)=NC2=O)c1	919877882	GBUYZUADRFNRCV-CQSZACIVSA-N	432.506	1.073	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)c2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)cc1	920550289	HQBVVCOYQSJKJP-UHFFFAOYSA-N	437.412	1.922	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N[C@@H](C)Cn2ccnc2)cc1	920850657	CIXFYOHNSJJISP-GYXHFJGISA-N	447.499	1.742	50	20	IDGD	
O=C(NCCc1cccs1)NNC(=O)C1CCN(S(=O)(=O)c2cccnc2)CC1	920859303	BAGSTOAQSSOHTR-UHFFFAOYSA-N	437.547	1.117	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)C2(Sc3ccccc3)CC2)CC1	1116364873	ZJQTZNFIGVTAQD-UHFFFAOYSA-N	447.586	1.786	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CNS(=O)(=O)c2c(Cl)cccc2Cl)cc1	1317704783	UPSKHSXEXKBZQM-UHFFFAOYSA-N	432.285	1.742	50	20	IDGD	
CNS(=O)(=O)c1ccc(Br)c(C(=O)NNC(=O)NCc2ccco2)c1	1318090079	ORVZCPFTLRKVQP-UHFFFAOYSA-N	431.268	1.094	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1nc(C2CC2)n(-c2ccccc2)n1	1318264998	MXRJBPKQJAJXMQ-UHFFFAOYSA-N	432.488	1.612	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cc(S(N)(=O)=O)c(Br)s2)cc1	1318490341	KKWYTVBMLUECTM-UHFFFAOYSA-N	434.293	1.241	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1ccc(OCC2CC2)nc1	1319793995	JQFIGDKULSWAPR-UHFFFAOYSA-N	437.500	1.089	50	20	IDGD	
CN1CCN(Cc2cccc(CNC(=O)NNc3cccc(S(C)(=O)=O)c3)c2)CC1	1319852607	XPTPWHCKRAVRDO-UHFFFAOYSA-N	431.562	1.664	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3ccn(-c4ccncc4)n3)n[nH]2)cc1OC	1321203436	BENNXBGYIQDGLU-UHFFFAOYSA-N	433.428	1.749	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc(Br)c(F)cc1F)c1n[nH]c2c1CCCC2	1321539239	RWSOIMYFEVJYMP-UHFFFAOYSA-N	435.250	1.953	50	20	IDGD	
NC(=O)c1ccccc1N1CC[C@H](NC(=O)NNC(=O)c2cncn2-c2ccccc2)C1	1321757652	YPMFGCMTEUREHX-HNNXBMFYSA-N	433.472	1.194	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NC2CCN(Cc3ccccn3)CC2)cc1	1329991713	QGEGGJVEKOUZID-UHFFFAOYSA-N	446.533	1.485	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cccn4ccnc34)C2)C1	1778588453	UOICTKLTTCAQTB-BEFAXECRSA-N	435.322	1.951	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccc3nccnc3c1)CCO2	1779297228	XHSPJYBOHKKAMM-OAQYLSRUSA-N	428.565	1.925	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnn(C)c3Cl)C2)C1	1779863866	WPBFVTFMGYNSPQ-WBMJQRKESA-N	433.734	1.691	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)c3cc4ncccn4n3)CCO2)C1	1781229761	JDWHZOVUSNYAIQ-QZTJIDSGSA-N	426.304	1.409	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781332782	FMBFKBGRMYDXBW-OPQQBVKSSA-N	430.112	1.680	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)n(C(F)F)n1	1781333127	DCSDLCCAATVXQU-ABAIWWIYSA-N	439.232	1.721	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781335492	ZXNAUAWCQHEMTL-BLLLJJGKSA-N	438.294	1.032	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnccn1)C2	1781901706	UAQMLLYLACBRGU-JCKWVBRZSA-N	425.327	1.778	50	20	IDGD	
CC(=O)N[C@H](C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](C)Br)C2)C1)C(C)(C)C	1783530507	ZVHMJDCQMCWSDQ-WRSAYESZSA-N	432.359	1.151	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H]3CC=CC[C@@H]3C(=O)OC)C2)C1	1783847535	BVPLIMIZMYNEHO-JJDSTIRJSA-N	426.941	1.979	50	20	IDGD	
O=C(COc1cccnc1)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21	1785143134	REHTVEZKIPHFGP-BPUTZDHNSA-N	426.311	1.225	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21	1786404197	JWQAPJHLTYXJRY-SRVKXCTJSA-N	426.149	1.536	50	20	IDGD	
Cc1nccn1[C@@H](C)C(=O)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1	1788149370	MEDSMSXYTNBIDY-INIZCTEOSA-N	446.316	1.880	50	20	IDGD	
Cc1cc(/C=C/C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)Br)C[C@@H]32)no1	1788674413	SRBNHGVFQZOJTA-HFLCEVLVSA-N	426.311	1.759	50	20	IDGD	
CCOC(=O)c1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](Cl)CC)[C@H]3C2)ccn1	1789862049	WVECTUPZJLLOHH-OVWQWFNUSA-N	437.924	1.869	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc4[nH]ncc34)C[C@@H]21)[C@@H](F)Br	1789922721	LSGGOUMGDMLTDN-NHJBHEPMSA-N	439.285	1.847	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(F)c3[N+](=O)[O-])[C@H]2C1	1790136910	SBZRNRZYRAAIFI-ZIEJDFEHSA-N	443.859	1.581	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(C)nc3O)C[C@@H]21	1790963238	PHIWKZYHMPYWPP-HNKHHVNMSA-N	440.338	1.862	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)[C@H]1CCc2nc[nH]c2C1	1791530194	HPKPLEAMJIKWTM-IKUJJKIKSA-N	443.317	1.185	50	20	IDGD	
COC(C)(C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1792570369	HZDMKHIVXBYYLK-XGUBFFRZSA-N	447.960	1.133	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(C(F)F)no1)C2	1792867554	FLMOXMUVEDBDIA-ORXSELOVSA-N	436.253	1.846	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COc1cccc3ccccc13)C2)[C@@H](O)CCl	1792975795	XQBIXDBTLZIGDU-HPNQWNLUSA-N	432.904	1.408	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CCCCN1C	1793140030	MYAWQTOVNASERX-WZAKMNGYSA-N	428.537	1.243	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cccc(F)c1	1795233092	UZGRQUNYAMTQIH-FRQROOTJSA-N	427.314	1.989	50	20	IDGD	
CC(C)Cc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Br)C3)n(C)n1	1796017134	UQGLTDSGWWFUNW-NOXHYTERSA-N	445.333	1.512	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1[nH]cnc1-c1cccnc1)C2	1797957264	CVNCQVMYZKCTOF-ALXJQNPVSA-N	443.580	1.526	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/C(=O)NCc1ccccc1)C2	1799264890	RUQWUKSDVGOLNT-JBJYQZIFSA-N	433.936	1.466	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COCCNC(=O)OC(C)(C)C)C2	1799268514	XWVCHIFELWLPFM-JYYAWHABSA-N	447.960	1.135	50	20	IDGD	
Cc1nc2ncccn2c1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@](C)(Cl)CCl	1799275585	YYIOGCHAWSEEKD-ZYKCCNLVSA-N	440.331	1.477	50	20	IDGD	
Cc1n[nH]c(C)c1CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)CBr)C2	1799413609	MQZGWQABGBRZBJ-MJRMRKOOSA-N	427.343	1.190	50	20	IDGD	
C[C@H](CN)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](Br)Cc1ccccc1	1800436293	URXAXTYAEZVPPX-SOVHRIKKSA-N	438.366	1.177	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(-n3ccnc3)ccn1)C2	1800760658	YVELODLHUWZHDX-VWPFQQQWSA-N	448.321	1.254	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCNC(=O)OC(C)(C)C)C2	1800763957	PXBIZSPWQKFOEG-XPCVCDNBSA-N	448.358	1.274	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H]2C[C@]21C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](O)CCl)C2	1802103381	YTUQJYYTBSJLSC-LQJCKMKWSA-N	441.956	1.624	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1CCN(C(=O)[C@@H]2CNC(=O)O2)[C@@H]1c1cccnc1	1803011617	QVPNTLCLUYRKPF-UQOMUDLDSA-N	439.310	1.227	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)c(O)c1	1803141372	NMQPGCUEODXQTD-MDASCCDHSA-N	433.892	1.715	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H](CNC(=O)c2ncn(C)n2)[C@@H]1c1cccnc1	1805328567	JSWFTKGZNMYCIC-ILXRZTDVSA-N	435.326	1.703	50	20	IDGD	
O=C1Nc2c(cccc2C(=O)N2CCC3(CCCN(C(=O)[C@@H](O)CCl)C3)CC2)C1=O	1805524144	JPRQLHGQQJVWMH-HNNXBMFYSA-N	433.892	1.266	50	20	IDGD	
Cc1ccncc1C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1807361939	JYLXLFXPJUNCON-DENIHFKCSA-N	444.300	1.098	50	20	IDGD	
Cc1nn[nH]c1C(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)CBr)[C@@H]1c1cccnc1	1807797533	LSCFWGLNDWTIHH-HZUKXOBISA-N	435.326	1.859	50	20	IDGD	
Cc1cc(NC(=O)CC(=O)NC[C@@H]2CCN(C(=O)[C@H](F)Cl)[C@@H]2c2cccnc2)no1	1808394898	RVCIJXVAOZZEKS-VHSSKADRSA-N	437.859	1.947	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)C#CC2CC2)[C@@H]1c1cccnc1	1808408442	IPEOUTCMGZIXFJ-RBCAPNDLSA-N	446.511	1.635	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H](CNC(=O)COCCO)[C@H]1c1cccnc1	1808626978	APVLVHOAEMRUPW-HLLBOEOZSA-N	428.327	1.270	50	20	IDGD	
Cc1nccn1CC(=O)N1CC[C@H](CNC(=O)[C@H](F)Br)[C@@H]1c1cccnc1	1808679386	XCVQZAOFHKZFGP-PVAVHDDUSA-N	438.301	1.983	50	20	IDGD	
Cc1[nH]ccc1C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1808750326	OAPOTCWBILLWDH-RXVVDRJESA-N	432.289	1.031	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)N1CCCC2(CCN(C(=O)[C@H](Br)CC)CC2)C1	1810822692	AGRNGXSURGANGC-KGLIPLIRSA-N	431.375	1.838	50	20	IDGD	
CN(C)c1ccc(C(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@H]2c2cccnc2)cn1	1811060044	KOXVYQJRGVKMNG-WDYCEAGBSA-N	431.924	1.462	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)c2c[nH]c(=O)cn2)[C@@H]1c1cccnc1	1811458209	LQICQWTXFCKOCW-GHJWDPDVSA-N	434.294	1.268	50	20	IDGD	
COC(=O)C1(C(=O)NC[C@@H]2CCN(C(=O)CCBr)[C@H]2c2cccnc2)CC1	1812685641	YNWYWKYTPYQHNK-HOCLYGCPSA-N	438.322	1.826	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2cc(F)c[nH]2)[C@@H]1c1cccnc1	1813072304	AHWZYVZVQIUTJY-MGPUTAFESA-N	430.484	1.241	50	20	IDGD	
Cc1n[nH]c(C)c1C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1813073316	KZJRLLBEEMTLES-UTKZUKDTSA-N	441.536	1.114	50	20	IDGD	
C[C@H](CBr)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CS(C)(=O)=O)[nH]n1	1814780306	LJOXVFISBQFHAX-ZYHUDNBSSA-N	435.344	1.477	50	20	IDGD	
Cn1cc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)[C@H](O)CCl)n[nH]2)c(C(F)F)n1	1814871021	HZBMMDQUPHPJIY-NWDGAFQWSA-N	430.843	1.986	50	20	IDGD	
Cn1ccc2c(O)ncc(C(=O)N3CCCC[C@H]3c3cc(NC(=O)[C@H](O)CCl)n[nH]3)c21	1814873912	SQCANWBXPNSZBZ-LSDHHAIUSA-N	446.895	1.908	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)C1CCSCC1)CC2)c1cccc(B(O)O)c1	1815364107	LDSKIBHBMIYVOQ-OAHLLOKOSA-N	445.375	1.192	50	20	IDGD	
O=C1CCc2ccc(C(=O)Nc3nc4c(s3)C[C@@H](NC(=O)[C@H](O)CCl)CC4)nc2N1	1816659482	OAGBSRWUGRLWRF-GXFFZTMASA-N	449.920	1.248	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CN2CCNC2=N)n[nH]1	1817292321	SFDZMAWSTQRYCG-YPMHNXCESA-N	440.346	1.273	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CC[C@@H](N)C(N)=O)n[nH]1	1817359976	SNAKHXZXEXVWGD-HSOHIQCKSA-N	433.340	1.231	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1	1817470419	QRQDQXQQHWDCNQ-INIZCTEOSA-N	432.717	1.660	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnccn2)[nH]n1	1818111316	CICSDTGHARYCJU-ROCQKPIASA-N	449.475	1.640	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1)c1ncn(-c2ccccc2)n1	1818197993	UKQRKCXGVNOBNT-JKSUJKDBSA-N	443.895	1.896	50	20	IDGD	
C[C@@H]1C[C@]1(C)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1	1819798051	SFYJZUJOPXSHIX-HZNYWTHISA-N	428.518	1.414	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)[C@@H](O)CCl)[nH]n2)cc1O	1821355979	PUYXNQYENZFFFM-RDJZCZTQSA-N	449.895	1.979	50	20	IDGD	
CCCC(=O)N[C@H](C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](Cl)COC)n[nH]1	1822372204	DYBWQZJKJDLMJT-NFAWXSAZSA-N	427.933	1.960	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)CO[Si](C)(C)C)[nH]n1	1822414632	JGWNEKGAMDFHFN-OAHLLOKOSA-N	438.605	1.626	50	20	IDGD	
CC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](O)NC(=O)OC(C)(C)C)CC2	1822856051	SIADDAGGXUNYSG-YHAQOWFVSA-N	446.957	1.916	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CC2CCC2)n[nH]1	1823430527	XDZMEVFQLDHUMO-QGZVFWFLSA-N	425.493	1.904	50	20	IDGD	
CN(C)C(=O)NCC(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@H](F)Br)CC1	1823882386	SBSWNIARNUSCLR-ZFWWWQNUSA-N	435.338	1.568	50	20	IDGD	
CC[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CNC(=O)N(C)C)CC2	1825440279	NWBGWEFBCCVKPG-VHSXEESVSA-N	446.371	1.500	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CN2CCOCC2)CC1	1826714276	NTDQMFUHZXLGKV-AEFFLSMTSA-N	444.414	1.969	50	20	IDGD	
O=C(/C=C/c1cnc[nH]1)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827060604	RYZJUICNRHCNAI-QQUYBBDPSA-N	436.321	1.036	50	20	IDGD	
C[C@H](NC(=O)c1cnccn1)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H](F)Cl)CC1	1829026158	KPTXNWIPXWYBTQ-IAOVAPTHSA-N	439.919	1.749	50	20	IDGD	
Cc1nc2ncccn2c1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830362363	SCRXPKUTVKJULO-OAQYLSRUSA-N	449.939	1.373	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)c[nH]1	1830538776	POVGTHRYDUZAKU-FZKQIMNGSA-N	428.327	1.424	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(OC)nc3)CCO2)C1	1831945819	QYNRELQHRLQFNU-OXJNMPFZSA-N	425.913	1.568	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3ccc(O)cc3F)CC2)CC1)[C@H](O)CCl	1833313521	JCUVWZCZUDYFFY-GOSISDBHSA-N	427.904	1.316	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)CCc3cn[nH]c3)CC2)CC1	1833813620	BWEKGIIAIKBGIT-CQSZACIVSA-N	440.386	1.697	50	20	IDGD	
COC(=O)CCC(=O)NC1CCN(C2CCN(C(=O)[C@H](C)Br)CC2)CC1	1834436199	KTIRAUDPYPWGJI-ZDUSSCGKSA-N	432.359	1.295	50	20	IDGD	
CCCC(=O)N[C@@H](C)C(=O)N1CCC(N2CCC(NC(=O)[C@H](Cl)CC)CC2)CC1	1836396857	NOJGTRHKKBAZMN-MAUKXSAKSA-N	429.005	1.880	50	20	IDGD	
COC(=O)C1(C(=O)N2CCC(N3CCC(NC(=O)[C@@H](F)Br)CC3)CC2)CC1	1836413443	CIXGAESEPRQGIV-CQSZACIVSA-N	448.333	1.202	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccn3cncc3c1)CCO2	1837078474	DUFIQDMABUVSDQ-NRFANRHFSA-N	446.580	1.256	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)c3cccs3)CC2)CC1	1837399403	VEUZVHUZTXVFFV-UHFFFAOYSA-N	436.578	1.733	50	20	IDGD	
C[Si](C)(C)c1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)co1	1837424361	VGFPSBADPZINKH-QAPCUYQASA-N	432.952	1.429	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccn4nccc34)C2)C1	1837715833	LWHKENMNFZNMKW-NRFANRHFSA-N	446.580	1.256	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC(OC2CCN(C(=O)CSC(=N)N)CC2)CC1	1837828313	DLXAKFFLUGQZQK-UHFFFAOYSA-N	430.647	1.463	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)c3[nH]nnc3C)CC2)CC1	1838002340	WPNCRZXOGCKIOH-OAHLLOKOSA-N	442.358	1.899	50	20	IDGD	
CCc1ncsc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)Br)C2)C1	1838839118	PUXUKWKQHLPXNP-SJKOYZFVSA-N	446.367	1.559	50	20	IDGD	
COc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)cn1	1839150257	GYZQGJFGCQJRDQ-OALUTQOASA-N	446.331	1.397	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4n(n3)CCC4)C2)C1	1839152497	AZBBWWRXXXYCHW-RTBURBONSA-N	445.347	1.136	50	20	IDGD	
Cc1nccnc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2	1839153686	OLCSVPWRYPQKOH-MSOLQXFVSA-N	431.320	1.091	50	20	IDGD	
C[C@H](Cn1ccnc1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2	1839155030	GWHZAPQNQXPVDX-ATZDWAIDSA-N	447.363	1.212	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(O)c(F)c3)CCO2)C1	1839302881	REAVHAQSHFLLOT-HXUWFJFHSA-N	428.888	1.866	50	20	IDGD	
O=C(c1cccc(-c2cnco2)c1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1839365302	CVFHPUZRGPXJBR-YLJYHZDGSA-N	437.855	1.946	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccncc3Cl)C2)C1	1840033645	MFSKRNHGEUYZKL-SJKOYZFVSA-N	446.729	1.588	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(Cl)ccn3)C2)C1	1840033963	VTFCBDMURNTCFE-PXAZEXFGSA-N	446.729	1.588	50	20	IDGD	
O=C(c1cnnc2ccccc12)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840187760	VDEPRQLFBXPDKX-LJQANCHMSA-N	439.299	1.504	50	20	IDGD	
O=C(c1ccn2nccc2c1)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840188605	SRJURVZFHFQIRX-GOSISDBHSA-N	427.288	1.208	50	20	IDGD	
C[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1)n1cccc1	1840353486	KEFYJEPOWQEFSM-CKEIUWERSA-N	432.290	1.196	50	20	IDGD	
Cc1ncc(CC(=O)N2CCO[C@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)s1	1840397519	FZAMHAMMVLWXKP-LJQANCHMSA-N	429.970	1.715	50	20	IDGD	
CO/C=C(\C)C(=O)N1CCCC12CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2	1844180896	BIYNSHQFAAOZBC-SAPNQHFASA-N	429.521	1.086	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)N1CCCC12CN(C(=O)[C@H](Br)Cc1ccccc1)C2	1844372628	UDEHPRAHPNTGGS-NVXWUHKLSA-N	448.361	1.887	50	20	IDGD	
CCCCCc1ncc(C(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)s1	1845792165	XXQDAFAVPNTLPR-UHFFFAOYSA-N	441.362	1.686	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCCC12CN(C(=O)c1cnc3cc(C)ccn3c1=O)C2	1846070395	GVXJNXHFWYRKEK-OAHLLOKOSA-N	447.333	1.993	50	20	IDGD	
C#CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)[C@@H](F)Br)C2	1847071985	SBNJACREHGIGEF-QWHCGFSZSA-N	446.317	1.797	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cc(Cl)ccc2O)cc1S(=O)(=O)NC1CC1	10627796	SIGKZFGGJVPPMH-UHFFFAOYSA-N	439.877	1.570	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=O)COc2ccc(C#N)cc2)ccc1C	15888644	PCENYQUDVUIJCH-UHFFFAOYSA-N	444.513	1.737	50	20	IDGD	
O=C(COC(=O)CSc1ccc(F)c(F)c1)NNC(=O)c1ccc([N+](=O)[O-])cc1	17834728	YAULJFMPERJYKO-UHFFFAOYSA-N	425.369	1.970	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C[C@](O)(c1nccn1C)C(F)(F)F	105568612	QHJYPVNPCIZOLL-KRWDZBQOSA-N	430.383	1.185	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)N[C@H](c2nnc3ccccn23)C(C)C)nc1	726282319	LWEDUMMSXRUBHZ-KRWDZBQOSA-N	446.537	1.834	50	20	IDGD	
CCn1nc(C)c(CNC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c1C	727604779	IYFKXHNQVDEEGX-UHFFFAOYSA-N	427.553	1.563	50	20	IDGD	
CC(C)(C)c1ccc(C(=O)N2CSC[C@@H]2C(=O)NNC(=O)C(=O)N2CCCC2)cc1	728025517	JFIALUZDJFMAQX-MRXNPFEDSA-N	432.546	1.269	50	20	IDGD	
CCOc1cn(-c2ccccc2)nc1C(=O)NNC(=O)c1csc(N2CCOCC2)n1	728512344	QFGHLEWPRPBWBW-UHFFFAOYSA-N	442.501	1.639	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)NCc2nccn2C)cc1	728544504	GPFRRRLXZQPGKT-WJDWOHSUSA-N	433.472	1.391	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1CNC(=O)NNC(=O)c1cccc2ncccc12	730114103	FSOAODFRAIRFLD-UHFFFAOYSA-N	427.486	1.629	50	20	IDGD	
CC(C)(C)C(=O)N1CSC[C@H]1C(=O)OCC(=O)NNC(=O)c1ccc(Cl)cc1	730322331	AGOBBQVMKPMJFS-ZDUSSCGKSA-N	427.910	1.592	50	20	IDGD	
CCC[C@@H](NC(=O)NCc1ccc(F)cc1)C(=O)NNC(=O)COc1ccccc1O	730781519	PTEHESWGYPPXGZ-MRXNPFEDSA-N	432.452	1.726	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)[C@H]1CSCN1C(=O)c1ccc(Cl)cc1	730782414	MVOPXCOMJPBQJP-CQSZACIVSA-N	435.889	1.787	50	20	IDGD	
CCN1CCN(C(=O)CC2CCN(C(=O)/C(C#N)=C/c3cc(C#N)n(C)c3C)CC2)CC1	731200996	MAKVHPHUBVLQES-KGENOOAVSA-N	436.560	1.905	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCCCCC2)cc1C(=O)NNC(=O)c1c[nH]nc1C	731851582	FCHBOFXQJBFFGQ-UHFFFAOYSA-N	435.506	1.366	50	20	IDGD	
Cc1c(Cl)cccc1-n1ccnc1SCC(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1	732307813	NJBVFYXZACRKSL-LBPRGKRZSA-N	442.950	1.508	50	20	IDGD	
N#Cc1ccc(N2C(=O)N[C@@H](CCC(=O)NNC(=O)Cn3ccc4ccccc43)C2=O)cc1	733760468	ASVPMELXODKWJO-SFHVURJKSA-N	444.451	1.566	50	20	IDGD	
Cn1cc(-c2cncc(C(=O)NNC(=O)NC3CCN(C(=O)OC(C)(C)C)CC3)c2)cn1	734826169	ZSLDGQDNBIPLCC-UHFFFAOYSA-N	443.508	1.826	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCc1cccc(-n2cncn2)c1	735513593	XKGQADDCUNVWMI-UHFFFAOYSA-N	442.505	1.013	50	20	IDGD	
O=C(CCNS(=O)(=O)c1cccc(Br)c1)NNc1ccc(Cl)nn1	735688299	LZLAVISXZXVMCQ-UHFFFAOYSA-N	434.703	1.704	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)c1cc(I)ccc1O	738545752	NYDPHQAZIWREMN-UHFFFAOYSA-N	426.210	1.975	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)[C@@H]2CN(Cc3ccccc3)CCO2)c2ccccc2c1=O	741207113	IWYLTWRATRBBDM-FQEVSTJZSA-N	449.511	1.639	50	20	IDGD	
CCO[C@@H]1C[C@H](O)C12CCN(CC(=O)NNC(=O)c1cc(Cl)ccc1OC)CC2	741255355	JGNAOGGNSWUFAK-DLBZAZTESA-N	425.913	1.362	50	20	IDGD	
CN(CC1CCN(CC(=O)NNC(=O)c2ccc(C#N)cc2)CC1)C(=O)OC(C)(C)C	744398498	JIVUOBXSNXFJEB-UHFFFAOYSA-N	429.521	1.898	50	20	IDGD	
C[C@@H](CC(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1)NC(=O)c1ccccc1	744621950	KAQYTRWITBVSCN-INIZCTEOSA-N	446.529	1.359	50	20	IDGD	
O=C(COC(=O)c1ccc(C[C@@H]2CC(=O)NC2=O)cc1)NNC(=O)c1cccc(Cl)c1	745107292	IKCLOEQZDNZDRW-OAHLLOKOSA-N	443.843	1.163	50	20	IDGD	
CC(C)C(=O)N(C)Cc1ccc(C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)cc1	745173737	CWFZORWUZWXGCT-UHFFFAOYSA-N	436.468	1.791	50	20	IDGD	
CC(C)CO[C@@H](C)c1noc(CN(C)C(=O)NNC(=O)CNC(=O)c2cccs2)n1	745998010	FDPVWSFTZOCZNE-LBPRGKRZSA-N	438.510	1.467	50	20	IDGD	
COC(=O)c1ccsc1N1CC[C@H](NC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)C1=O	746778375	APGOOYGKVGKMBL-ZDUSSCGKSA-N	447.429	1.192	50	20	IDGD	
O=C(CSCc1cscn1)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	746820832	FXXXQYPGYOTZTN-UHFFFAOYSA-N	440.572	1.622	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2cccc(C(=O)NNC(=O)c3ccc(C#N)cc3)c2)C[C@H](C)O1	747176791	QYIOBQDMZDRLKU-GJZGRUSLSA-N	442.497	1.431	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)CSc2nnc(S)s2)c2ccccc2c1=O	747199735	VGQDVCAKFDEWCS-UHFFFAOYSA-N	436.544	1.500	50	20	IDGD	
C[C@H]1C[C@H](C)CN(S(=O)(=O)c2ccc(C(=O)NNC(=O)Cc3ccncc3)cc2)C1	747323061	ZAGLJQFIODZYEL-HOTGVXAUSA-N	430.530	1.752	50	20	IDGD	
Cc1cccc(NS(=O)(=O)c2ccc(C)c(C(=O)NNC(=O)C(=O)N3CCCC3)c2)c1	748246638	NBNUEAZFMQVXNX-UHFFFAOYSA-N	444.513	1.488	50	20	IDGD	
Cc1nc2nc(N)nn2c(C)c1CCC(=O)NNc1nc(-c2ccccn2)nc2c1CCC2	748340938	LYGVPMMGGHNGBO-UHFFFAOYSA-N	444.503	1.740	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)c1ccccc1S(C)(=O)=O	748603098	RXDKQFONZLJVIL-UHFFFAOYSA-N	425.532	1.924	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCCc2nnc(-c3ccccc3)o2)nc1	749205145	YKDCZBKZSJJITJ-UHFFFAOYSA-N	445.505	1.687	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)c2ccccc2c1=O	749344399	KEKIBUKUINGNJP-UHFFFAOYSA-N	446.508	1.665	50	20	IDGD	
Cc1nc(N2CCOCC2)nc(O)c1CCC(=O)NNC(=O)c1cc2ccccc2o1	749474260	QUVZKIHFCARBAM-UHFFFAOYSA-N	425.445	1.467	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(C(=O)NNc2nc(Br)cn3ccnc23)cc1	750243949	RBRZIJLJRKZKOL-UHFFFAOYSA-N	439.295	1.499	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)N[C@H]2CC(=O)N(C(C)C)C2)cc(OCC)c1OCC	750643213	GKIJVCRNHJNMGO-HNNXBMFYSA-N	436.509	1.836	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)NNC(=O)c2cc(-c3ccc(C)cc3)[nH]n2)ccc1F	752519941	GNLIJMYEOLNWGH-UHFFFAOYSA-N	431.449	1.507	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN2CCC(C)(CN3CCN(C)CC3)CC2)cc1C	755240883	ILLUNATXCCRBDP-UHFFFAOYSA-N	435.638	1.729	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)Nc2cccc(S(=O)(=O)NC3CC3)c2)c1	755585842	OPMHUGJZNQOJMX-UHFFFAOYSA-N	432.502	1.976	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)Nc1cccc(N2CCCS2(=O)=O)c1	755886233	TUUNLWSAKOOYIY-KRWDZBQOSA-N	432.458	1.219	50	20	IDGD	
CC(=O)Nc1cc(NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)ccc1C	755913439	OKNYXESEBVPIBN-UHFFFAOYSA-N	447.517	1.735	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2nnc(-c3ccco3)s2)c1	756028713	IMVCBKGOFWPPDX-UHFFFAOYSA-N	436.475	1.515	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)NCCN3C(=O)[C@@H]4[C@H]5C=C[C@@H](C5)[C@H]4C3=O)n[nH]2)cc1	756104092	XNRGEOGGWFRRIL-ILRDRHFLSA-N	448.483	1.136	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)Nc2cccnc2N2CCOCC2)cc1	756183395	LAWIXPCSDXGXCT-HNNXBMFYSA-N	427.461	1.741	50	20	IDGD	
Cc1cccc(COc2ccc(NC(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)c(C)c2)c1	756447615	XBWCTDAAYYDYRH-HNNXBMFYSA-N	434.518	1.973	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c(OCCN(C)C)c1	756674508	WUFBOKIQEOOWNA-UHFFFAOYSA-N	438.488	1.649	50	20	IDGD	
CCOC(=O)[C@H](C)NC(=O)c1ccc(NC(=O)NNC(=O)Cc2ccccc2F)cc1	756792223	ZXYRBWCAHJNEDI-ZDUSSCGKSA-N	430.436	1.903	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)Nc1ccc(C[C@@H]2CC(=O)NC2=O)cc1	756815162	IUNUIJYGPAYEHN-OAHLLOKOSA-N	440.456	1.522	50	20	IDGD	
CCN1CCN(C(=O)Cc2ccc(NC(=O)NNC(=O)c3ccc(C)cc3O)cc2)CC1	757579002	FELYGKVBAWCVDP-UHFFFAOYSA-N	439.516	1.874	50	20	IDGD	
C[C@H](NC(=O)OC(C)(C)C)[C@@H](C)C(=O)N1CCN(S(=O)(=O)CBr)CC1	757592519	JZNNVNVQKQNNJE-NEPJUHHUSA-N	442.376	1.362	50	20	IDGD	
COC(=O)c1cc(NC(=O)NNC(=O)c2cc3c(s2)CCC3)cc(S(C)(=O)=O)c1	757673255	AWANSQKSXHQWAX-UHFFFAOYSA-N	437.499	1.893	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)c2cccnc2I)c1	757691541	XMZPUGNGVICEHF-UHFFFAOYSA-N	427.198	1.778	50	20	IDGD	
CCc1cccc2c3c([nH]c12)[C@@](CC)(CC(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1)OCC3	758145275	YQSROEFLOREUFI-IVZQSRNASA-N	447.557	1.881	50	20	IDGD	
Cc1ccc(-c2nc(C(=O)OCC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)cs2)n1C	758572980	OFYXVYCZQDWUSZ-UHFFFAOYSA-N	443.441	1.983	50	20	IDGD	
NC(=O)CC[C@@H](NC(=O)OCc1ccccc1)C(=O)NNc1nc(O)c2ccccc2n1	760165415	ZDSGXCFSZQFMFY-MRXNPFEDSA-N	438.444	1.339	50	20	IDGD	
C[C@@H](O)c1cn(CC(=O)NNC(=O)c2nc(-c3ccccc3)n(-c3ccccc3)n2)nn1	762964848	RZWPQQXUGVPJFS-CQSZACIVSA-N	432.444	1.040	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NN=C(C)[C@@H](C)OC)N(S(C)(=O)=O)CC2	763143059	YZUGYHSJEZEZRQ-CZUORRHYSA-N	427.523	1.480	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)c1	763163788	GHHVEWVJRPBXMO-UHFFFAOYSA-N	437.478	1.602	50	20	IDGD	
CNC(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)c2cc3ccccc3cc2O)c1	763518016	LEXWNOCGXYMIOD-UHFFFAOYSA-N	440.843	1.958	50	20	IDGD	
O=C(NNC(=O)c1ccccc1F)C(=O)Nc1cccc(S(=O)(=O)N2CCCC2)c1	763560898	DDQNVIVBBQTBKZ-UHFFFAOYSA-N	434.449	1.010	50	20	IDGD	
CC[C@H](C)n1ncc(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1C1CC1	763570227	DFXWLPZILQLMAL-YVEFUNNKSA-N	427.461	1.657	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(F)c(-n3nnnc3C3CC3)c2)c(C)o1	763575960	BHSZGNJHFIWHSB-UHFFFAOYSA-N	427.396	1.288	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccc(-n2nc(C)cc2C)c1	763658356	VFLFQHCKKPAZOE-UHFFFAOYSA-N	437.456	1.663	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccnn2-c2ccc(Cl)cc2)cc1	763673534	GGGVNZBZOSQKQH-UHFFFAOYSA-N	438.831	1.562	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(Cl)c2-n2cccn2)cc1	763680211	DHPDVYGZXDRZNQ-UHFFFAOYSA-N	438.831	1.562	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(N2CCCC2=O)c(F)c1	763712192	NRAYWJRQLQMBQK-UHFFFAOYSA-N	442.447	1.680	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(N2CCOCC2)c(F)c1	763716812	MXLSDZLZNWTNFS-UHFFFAOYSA-N	444.463	1.390	50	20	IDGD	
CCc1ccc(NC(=O)C(=O)NNC(=O)c2nn(CC)c(=O)c3ccccc23)cc1CC	763787123	WGCYEPLDPKMYPD-UHFFFAOYSA-N	435.484	1.941	50	20	IDGD	
CC(C)COc1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])cn1	763803256	KKFGEYCPBMKIFV-UHFFFAOYSA-N	431.405	1.190	50	20	IDGD	
CCOC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)cc1C#N	763839232	GXYUZTUTBSHRHK-UHFFFAOYSA-N	443.391	1.431	50	20	IDGD	
CCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)cc1	763847502	CIHSSMZETHQKFM-OAHLLOKOSA-N	426.473	1.607	50	20	IDGD	
C=CCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)cc1	763849405	LJQMEUISUBZLRI-MRXNPFEDSA-N	438.484	1.773	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccc(Cn2cncn2)cc1	763872254	LSJCRUUUBYHCMF-ZDUSSCGKSA-N	426.408	1.019	50	20	IDGD	
COc1ccncc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1cccc(Br)c1	763882251	HXXZJMKZUPJDAY-SNVBAGLBSA-N	437.250	1.406	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)C(=O)Nc2cccc(CN3CCCC3=O)c2)cc1	763895439	DUEQSKCTZODEMV-UHFFFAOYSA-N	440.525	1.996	50	20	IDGD	
CCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(OCC)c(OC)c2)cc1	763900203	BQAQULGEYAQXCD-UHFFFAOYSA-N	428.445	1.243	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)C(=O)Nc1ccc2nc(C3CC3)oc2c1	763922424	XBSFPEBZHZDIEX-UHFFFAOYSA-N	432.400	1.081	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3cnn(Cc4ccncc4)c3)cc2C1	763942875	PFRZAFPUCPKEFB-ZDUSSCGKSA-N	438.513	1.912	50	20	IDGD	
CN(C)CCn1ccc(NC(=O)C(=O)NNC(=O)c2ccc(COc3ccccc3)o2)n1	763951236	RSZUZRVPRPKCEV-UHFFFAOYSA-N	440.460	1.016	50	20	IDGD	
Cc1ccc(Oc2ccccc2NC(=O)C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)cc1	763998854	UEZZARJQKMQXLC-AWEZNQCLSA-N	431.470	1.308	50	20	IDGD	
O=C(Cc1ccsc1)NNC(=O)C(=O)Nc1ccc2c(c1)CCN2C(=O)c1cccnc1	764032766	ABGYCRVCCHXMKD-UHFFFAOYSA-N	449.492	1.675	50	20	IDGD	
NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cccc(Br)c2)cc1Cl	764063734	XGKDLMSEOFNZJT-UHFFFAOYSA-N	439.653	1.601	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(Br)c(C(F)(F)F)c2)n[nH]1	764098475	OEOGEKBPNFQIRQ-UHFFFAOYSA-N	434.172	1.899	50	20	IDGD	
COC(=O)[C@@H](C)Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)cc1	764169098	UFJIGPKPDPFZFP-SCLBCKFNSA-N	425.441	1.128	50	20	IDGD	
Cn1c(=O)n(C)c2cc(NC(=O)C(=O)NNC(=O)c3c(Cl)cccc3Cl)ccc21	764220948	HVBSFVNOXVIZHO-UHFFFAOYSA-N	436.255	1.584	50	20	IDGD	
COC(=O)Nc1cc(NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)ccc1F	764239735	RECMWZAIPUTUHW-UHFFFAOYSA-N	427.392	1.745	50	20	IDGD	
CN(C)CC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2cccc3ncccc23)cc1	764257716	MCQUELHZAWGIBI-UHFFFAOYSA-N	434.456	1.135	50	20	IDGD	
O=C(Cc1ccccn1)NNC(=O)C(=O)Nc1ccn(-c2ccc(Cl)cc2Cl)n1	764264632	QSRYYQQCLWLEBW-UHFFFAOYSA-N	433.255	1.903	50	20	IDGD	
CSCc1ccc(NC(=O)C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1	764265569	BBLHOJKLJYGIEK-UHFFFAOYSA-N	428.518	1.342	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1cccc(C(=O)N(C)C)c1	764394081	VVAICVUXZIIEAW-UHFFFAOYSA-N	430.486	1.275	50	20	IDGD	
COc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NNC(=O)c1ccc(Cl)cc1F	764409922	AVARHCFOCAOCPV-UHFFFAOYSA-N	436.827	1.589	50	20	IDGD	
CC(C)COc1ccc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cc1	765736017	NTOXBHQWWZWAGZ-UHFFFAOYSA-N	438.528	1.940	50	20	IDGD	
O=C(Cc1ccc2c(c1)OCO2)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	765754106	IXXVHPAQZMCODI-UHFFFAOYSA-N	444.919	1.576	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)c1n[nH]c2c1CCCC2	766661476	WHINZGXIUDBXHJ-UHFFFAOYSA-N	430.940	1.521	50	20	IDGD	
CC(=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O)c1ccc(Br)cc1F	767766006	UGZMFTMROCKXHL-UHFFFAOYSA-N	444.286	1.013	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)C(=O)Nc1cnc(Cl)c(Br)c1	768230340	CZZISZGNARZYQN-UHFFFAOYSA-N	442.613	1.805	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ncccc2C)n(-c2ccc(C(F)(F)F)cn2)n1	768244138	YROPHNWEDFWZRP-UHFFFAOYSA-N	447.377	1.698	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)Cc3cc(F)c(F)cc3F)CC2)cc1	768290443	HBCOEOPKROPZPR-UHFFFAOYSA-N	434.462	1.920	50	20	IDGD	
O=C(COC(=O)c1ccc(OCC(F)(F)F)cn1)NNC(=O)c1cccc([N+](=O)[O-])c1	768922803	ACNJVDKJADWLMI-UHFFFAOYSA-N	442.306	1.549	50	20	IDGD	
COC(=O)c1ccc(S(=O)(=O)NNC(=O)c2ccc(COc3ccccc3)o2)cn1	769627711	XGAHWCORHOIWPS-UHFFFAOYSA-N	431.426	1.664	50	20	IDGD	
CS(=O)(=O)N1CCN(c2ccc(NC(=O)NNc3ncccc3Cl)cn2)CC1	770027765	VEYZBRFTAQPERW-UHFFFAOYSA-N	425.902	1.360	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)N[C@@H]2CCO[C@@]3(CCOC3)C2)c2ccccc2c1=O	771432517	ASHZXGWNWQBCRO-QRQCRPRQSA-N	443.504	1.479	50	20	IDGD	
O=C(CCc1nc(-c2cccs2)no1)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772192202	KZSGHFWOZWAQSI-UHFFFAOYSA-N	433.877	1.848	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)ncc1Br	773551482	BLFYBWBBZAEYHL-UHFFFAOYSA-N	439.291	1.736	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2)cccc1C(=O)N1CCOCC1	773644146	JLENNEYEJDAQCW-UHFFFAOYSA-N	427.417	1.457	50	20	IDGD	
O=C(c1ccc(Br)cc1O)N1CCN(S(=O)(=O)CBr)CC1	777779054	COUQUDJRBRQBCW-UHFFFAOYSA-N	442.129	1.595	50	20	IDGD	
CCOc1cnc(C(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)cn1	778374724	NFYLWBWYVCWBJX-UHFFFAOYSA-N	444.455	1.652	50	20	IDGD	
CCOC(=O)c1cc(F)cc(S(=O)(=O)NNC(=O)c2cc(OC)cc(OC)c2)c1	778555687	BGUGNEQWJZCXLG-UHFFFAOYSA-N	426.422	1.643	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)CCN2C(=O)COC)c1ccccc1	778715373	VOSIYBIWASUBLK-GOSISDBHSA-N	438.484	1.502	50	20	IDGD	
CNC(=O)COc1ccc(NC(=O)C(=O)NNc2ccccc2OC(F)(F)F)cc1	778797720	JPHYHQBMLNGIJR-UHFFFAOYSA-N	426.351	1.792	50	20	IDGD	
O=C(NN=c1cc[nH]cc1)c1ccccc1NS(=O)(=O)c1ccc2c(c1)OCCO2	780761420	SPWJNNLPYQCNSA-UHFFFAOYSA-N	426.454	1.832	50	20	IDGD	
CO[C@@]1(C(F)(F)F)CCCN(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)C1	780989310	OLVICCHQMJUQNN-KRWDZBQOSA-N	430.431	1.477	50	20	IDGD	
CC1C[C@H](C(=O)NNc2ncncc2Cl)[C@@H](C(=O)NNc2ncncc2Cl)C1	781835927	BWPOSBFLHIMZRS-UWVGGRQHSA-N	425.280	1.822	50	20	IDGD	
CC(=O)N1CCN(c2cccc(NC(=O)C(=O)NNc3ccc4ccccc4n3)c2)CC1	782123572	GBZLFKLWJMPFSB-UHFFFAOYSA-N	432.484	1.985	50	20	IDGD	
O=C(NNC(=O)C(=O)NC1CC1)C(=O)Nc1cccc(OCc2ccc(Cl)cc2)c1	782968113	XWHJPGBLIAMJEU-UHFFFAOYSA-N	430.848	1.284	50	20	IDGD	
CCN(CC)CCn1ccc2cc(NC(=O)C(=O)NN[C@@]3(C)CCS(=O)(=O)C3)ccc21	783425173	BSSKLUCLVPQYEU-NRFANRHFSA-N	449.577	1.120	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1cc(-c2ccccc2)ns1	784005005	OBBYYBCATGGPAF-UHFFFAOYSA-N	429.483	1.388	50	20	IDGD	
C#CCOc1ccccc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	784218580	WEBWKQPDTTYAIM-UHFFFAOYSA-N	428.470	1.221	50	20	IDGD	
CCC(CC)NC(=O)[C@H]1CN(C(=O)C(=O)NNc2ccc(Cl)nn2)c2ccccc2O1	784792314	OAJBRTUSMCJDEV-OAHLLOKOSA-N	446.895	1.672	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(/C#N)C(=O)N2CCN(c3cnc(O)nc3N)CC2)c1C	788156009	WWZXFGNZDWZYFK-PACYTGELSA-N	439.520	1.646	50	20	IDGD	
CCO[C@H]1C[C@@](NC(=O)OC(C)(C)C)(C(=O)NNC(=O)N2CCN(C)CC2)C1(C)C	788165593	CXAWCDOZNGSJQP-VBKZILBWSA-N	427.546	1.073	50	20	IDGD	
CSCC[C@H](O)C(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	788626358	XJASAFYHUNCUHH-ZDUSSCGKSA-N	429.545	1.424	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2n[nH]c3c2CCCCC3)c1	788694133	NXGHOVFCLZNNJU-UHFFFAOYSA-N	433.534	1.784	50	20	IDGD	
COc1cc2ncn(CCCC(=O)NNC(=O)NC3CCCCC3)c(=O)c2cc1OC	792961291	SXSZBUULIFDVGP-UHFFFAOYSA-N	431.493	1.857	50	20	IDGD	
COC(=O)c1cc(F)cc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)c1F	796991787	JHVNUFSLNFPZLZ-UHFFFAOYSA-N	443.366	1.541	50	20	IDGD	
CC(=O)N[C@](C)(C(=O)NNC(=O)CCCc1ccccc1)c1ccc(S(C)(=O)=O)cc1	797445411	YECFACLSTOCIDL-QFIPXVFZSA-N	445.541	1.612	50	20	IDGD	
Cc1ccc(-c2ccnn2C)cc1NC(=O)C(=O)NNC(=O)c1c(C)nc2ccccn12	799257877	UQTHGJUBUZDGNB-UHFFFAOYSA-N	431.456	1.751	50	20	IDGD	
CN1CCN(CCNC(=O)NNC(=O)c2cc(F)ccc2Br)CC1(C)C	799680115	IMFMUESVTLJPMO-UHFFFAOYSA-N	430.322	1.558	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccnc(OCc2ccccc2)c1	800623093	GAHRHBAUAZBJIF-UHFFFAOYSA-N	434.452	1.998	50	20	IDGD	
Cc1ccc(C2=NO[C@@H](CNC(=O)NNC(=O)C3CCN(c4ncccn4)CC3)C2)cc1	800751321	VQWYDNJSPUNFJW-GOSISDBHSA-N	437.504	1.525	50	20	IDGD	
CCS(=O)(=O)c1ccc(Br)c(C(=O)NNC(=O)N=c2cc[nH]cc2)c1	802027946	CVFCZOMNFFBYHJ-UHFFFAOYSA-N	427.280	1.526	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)Cn2c(=O)n(C)c3ccccc32)c(OC)cc1Cl	802081192	FSZBFZGTNPHAFU-UHFFFAOYSA-N	433.852	1.864	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)Nc1ccc(S(=O)(=O)NCC2CC2)cc1	806309505	TXORCRUYQDSJLE-UHFFFAOYSA-N	428.478	1.499	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)NCc2ccccc2CN2CCOCC2)nc2ccccc21	807118291	DNTRQQIOPCEVHC-UHFFFAOYSA-N	436.516	1.479	50	20	IDGD	
O=C(NNc1nccnc1C1CCC1)C(=O)Nc1cnn(-c2cnc3ccccc3n2)c1	807462033	GZSXVDLGFLNXND-UHFFFAOYSA-N	429.444	1.955	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)NCCCN1C(=O)c2ccccc2C1=O	807494143	UMQKKRYQISAKPV-UHFFFAOYSA-N	442.497	1.804	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(S(=O)(=O)N(C)C(C)C)cc2)cc1	811304022	CAPZRAICPSSRGG-UHFFFAOYSA-N	432.502	1.424	50	20	IDGD	
O=C(NNC(=O)c1ccc(F)cc1Br)C(=O)N1CCN(c2ccccc2)CC1	812476716	MBJCEGZLWRJKRE-UHFFFAOYSA-N	449.280	1.698	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)[C@H](c2ccccc2)N2CCC(O)CC2)cc1	812729411	LPEFKFWUGVCREL-FQEVSTJZSA-N	432.546	1.578	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)NC[C@@H]2CCCS(=O)(=O)C2)N(C)c2ccccc21	813629655	ZCXFPMUKRZOJQH-HNNXBMFYSA-N	430.530	1.598	50	20	IDGD	
Cc1cc(C)nc(SCc2ccc(C(=O)NNC(=O)COCc3nncn3C)cc2)n1	814884826	ZYQIAEYYXNIASG-UHFFFAOYSA-N	441.517	1.492	50	20	IDGD	
O=C(NNC(=O)c1cnc(OC2CCCCC2)c(Cl)c1)N[C@H]1CCS(=O)(=O)C1	815103207	WNAOVZNTIJNCHD-LBPRGKRZSA-N	430.914	1.578	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)c2cnn(-c3ccccn3)c2N)c(OC)cc1Cl	816597466	SMVDKDTUXFEWMP-UHFFFAOYSA-N	431.840	1.987	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)CN2C(=O)N[C@]3(C[C@@H](C)CC(C)(C)C3)C2=O)c1	864001597	QAIAUHVRZKUQGA-WNSKOXEYSA-N	444.532	1.966	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1)N1CC[C@H](B(O)O)C1	864233221	GOMZCYPPPIBSLD-VIFPVBQESA-N	428.625	1.103	50	20	IDGD	
CCCCCC(=O)NNC(=O)C[C@H]1c2cc(OC)c(OC)cc2CCN1S(C)(=O)=O	886212271	PDWULASODAXDCY-INIZCTEOSA-N	441.550	1.680	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2ccc(Cl)cc2)cc1	913108772	MSDCBTGTLQSWIF-UHFFFAOYSA-N	439.877	1.256	50	20	IDGD	
O=C(NNc1ncccn1)c1ccccc1NS(=O)(=O)c1ccc2c(c1)OCCO2	913498003	MCQPITXMSTXUBM-UHFFFAOYSA-N	427.442	1.806	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)COc2ccc(Br)cc2)o1	914838794	JOOFIDPBECHHEL-UHFFFAOYSA-N	446.279	1.132	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)[C@@H](Cc2ccc(F)cc2)n2nnnc2C)cc1OC	915690456	QPLRLEZMRLQVSX-QGZVFWFLSA-N	442.451	1.773	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)N[C@@H](CN1CCCC1=O)c1ccccc1	916462793	QGDBNIHTVUFWCC-KRWDZBQOSA-N	426.473	1.768	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)c1ccc(OCC(=O)NC2CC2)cc1	916489328	JDLOUGRHRLCKBW-ZDUSSCGKSA-N	441.444	1.957	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)CCc2c(C)nc3ccnn3c2C)c2ccccc2c1=O	916728433	RECXGGVCVCRLMR-UHFFFAOYSA-N	447.499	1.860	50	20	IDGD	
Cc1ccc(CNC(=O)C2CCN(CC(=O)NNC(=O)c3cccs3)CC2)cc1F	917116539	SOOHBFPHGQUDGU-UHFFFAOYSA-N	432.521	1.985	50	20	IDGD	
O=C(COC(=O)c1cc2cc([N+](=O)[O-])ccc2o1)NNC(=O)[C@@H]1COc2ccccc2O1	917263874	UUJVWHKKZGANSL-KRWDZBQOSA-N	441.352	1.485	50	20	IDGD	
CC(C)[C@@H](CNC(=O)NNC(=O)c1ccc(F)cc1Br)N1CCOCC1	918202149	QZWNLXFOWWMJMX-OAHLLOKOSA-N	431.306	1.889	50	20	IDGD	
C[C@@H]1CN(Cc2cccc(CNC(=O)NNC(=O)COc3ccccc3F)c2)CCO1	920236763	GGACSXBCQWCVOM-MRXNPFEDSA-N	430.480	1.956	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc3c(c2)nc(O)n3C)c1	920287232	IWGMVYCDFQJURN-UHFFFAOYSA-N	445.501	1.384	50	20	IDGD	
COc1ccc(C(C)=NNC(=O)N[C@@H]2CCS(=O)(=O)C2)cc1CSc1ncccn1	920382055	VVVDMGOFPUAMKO-MRXNPFEDSA-N	449.558	1.988	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Cc2cccc(OC(C)C)c2)cc1	921020270	TTYDPFFPWWTEKM-UHFFFAOYSA-N	433.530	1.793	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)c2cccc(N3C(=O)CCC3=O)c2)CC1	1318667839	NALLYYKOKLDPKC-UHFFFAOYSA-N	444.488	1.748	50	20	IDGD	
COC(=O)C(=O)NNC(=O)N[C@H](c1ccc(Cl)cc1)c1cccc(S(C)(=O)=O)c1	1318941281	IFCYOIXIOZRKMA-OAHLLOKOSA-N	439.877	1.336	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cnn(-c3cccnc3)c1)CCO2	1779296398	PHSQDECJRTWMSQ-OAQYLSRUSA-N	443.580	1.562	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnc(O)[nH]2)C1	1779776406	BZNYTJUQZWUTKR-CJBNDPTMSA-N	429.315	1.274	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)nc(O)c1)C2	1780713511	WAENJDFPQQKWDD-ZNZDAUKMSA-N	446.331	1.857	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)c3nc(O)n4c3CCCC4)CCO2)C1	1781230506	TXFFINDZXUDTMR-OALUTQOASA-N	445.347	1.605	50	20	IDGD	
Cc1ccncc1CCC(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781327264	ZMTXQKZLHKTCOJ-WMZOPIPTSA-N	428.302	1.843	50	20	IDGD	
Cc1ncc(/C=C/C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)s1	1781334276	JUXYOICTZHWKRR-XHCBAJNBSA-N	432.315	1.985	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(C#N)cc3Cl)C2)C1	1781972631	IWIFHFLUEMNLKK-VQIMIIECSA-N	426.300	1.909	50	20	IDGD	
CSCC[C@@H](O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)Br)C2	1782232167	ZPKMIKGRWDTJLF-ZOMKSWQUSA-N	437.400	1.398	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)Cc3ccc(F)cn3)CCO2)C1	1783343239	RKZFZSYILYEJMQ-CRAIPNDOSA-N	428.302	1.767	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)COc3cccnc3)CCO2)C1	1783343775	PUUYQUHPQICMAQ-YJBOKZPZSA-N	426.311	1.464	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(NC(C)=O)o3)CCO2)C1	1783349664	QSMRKHDTLXOASU-ACJLOTCBSA-N	442.310	1.855	50	20	IDGD	
CC(=O)Nc1ccccc1C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](C)Br)C2)C1	1783535971	CEOZXDXUBIMCBU-ORAYPTAESA-N	438.322	1.872	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)Cc3ccc(C(=O)OC)s3)CCO2)C1	1783881114	JAFHUVMQJQFPPW-KUHUBIRLSA-N	444.937	1.161	50	20	IDGD	
CC(C)c1nc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]32)no1	1785211546	ZKXOGCQMKHMAHS-WFTHSTBKSA-N	447.363	1.952	50	20	IDGD	
COc1ccc(F)c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]3C2)c1OC	1787449242	DQCMVWKMAQTPDF-BQNZHIODSA-N	432.851	1.971	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3nc4ccccc4[nH]3)[C@H]2C1	1787836793	UYEXIVYCODXSOK-DVZHBHJUSA-N	435.322	1.940	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4nc(CO)[nH]c4c3)[C@H]2C1	1787870782	DKKOZMNKIXOVFQ-MPGHIAIKSA-N	448.951	1.914	50	20	IDGD	
CCCC(=O)N[C@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]2C1	1788764612	OPUZOTAPCHUOSY-QZWWFDLISA-N	427.618	1.122	50	20	IDGD	
COc1ccnc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)C(C)(C)CCl)C[C@@H]32)c1OC	1789409372	NMFIISHSBKGBAA-DZKIICNBSA-N	439.940	1.957	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC1(c2ccc(NC(=O)c3cccnn3)cc2)CCC1	1789725930	QGGHCDGKLBTUMZ-UHFFFAOYSA-N	431.456	1.537	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3c(C)noc3C)C[C@@H]21	1790958572	VIHXDGKOQUFJNI-LLLHUVSDSA-N	442.354	1.987	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCC(=O)N3CCCC3)C[C@@H]21	1791055159	MALIUTYATQQJQZ-UGUYLWEFSA-N	444.370	1.152	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccnc4c3OCO4)C[C@@H]21	1791059227	RTZVAFCWXPSDOC-XWUBHJNHSA-N	440.294	1.187	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1ccc(C2(NC(=O)COc3cccnn3)CCC2)cc1	1791603405	XCNAWLOBPRLXRS-UHFFFAOYSA-N	440.504	1.363	50	20	IDGD	
COc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)CBr)ccc1O	1792872401	FDNUKVSNLADRPA-DPYKFYPSSA-N	441.322	1.635	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1cncc(C(F)(F)F)c1)C2)[C@@H](O)CCl	1792982412	CRUBXSJXXOHMGM-YXPYIKCWSA-N	449.857	1.222	50	20	IDGD	
CCC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCl	1793117451	MCUONQPNMMWDSO-QRJUGERDSA-N	431.961	1.918	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CC[C@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Cl)C3)C1	1793155452	RUISROSLPVKJHD-UGYDUONOSA-N	447.935	1.804	50	20	IDGD	
C[C@H](Sc1ccccc1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(B(O)O)cc1)C2	1793437034	QTCOJVIHXAZOTL-QLIIJSOBSA-N	438.358	1.799	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccccc1-n1nccn1)C2	1793452285	WBZGCJZCSDHCMX-HIRMHNASSA-N	431.924	1.878	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(Cl)nc1F	1794246757	AIHGJBUXAUOYTI-DRXBFXEBSA-N	429.952	1.929	50	20	IDGD	
Cn1ccnc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1795245989	ZHLIIWJRKNZITI-XGUBFFRZSA-N	439.944	1.804	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cn1ccc3sccc3c1=O)C2)[C@H](F)Cl	1796362069	YRRWVQXTWFWEPB-OJXGSEEGSA-N	427.885	1.187	50	20	IDGD	
CC(C)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1=NN(c2ccccc2)C(=O)C1	1796479076	BBKXBFBAHGXFLA-CCWDJLKJSA-N	446.935	1.634	50	20	IDGD	
C=C(C)CC(C)(C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2	1797913552	XZLOCBUUZFXGKH-BRTCSPBQSA-N	443.548	1.702	50	20	IDGD	
C[C@]1(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)/C(C#N)=C/c2ccc(F)cc2F)C3)CCCN1	1799219141	JRBDITGQGNZRKS-AOAJYTEHSA-N	444.482	1.603	50	20	IDGD	
COC(OC)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O	1799219572	SYXDKGDXKJBEOZ-BTTYYORXSA-N	435.433	1.391	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](NC(=O)OC(C)(C)C)C1CC1)C2	1799269191	DJBPNOPHBDSYBB-QEOTZNIISA-N	443.972	1.897	50	20	IDGD	
COc1cc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Br)ccn1	1799344802	VXHQZJHTEYYWAN-RMHZUWNSSA-N	444.301	1.303	50	20	IDGD	
N#Cc1cc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Br)ccc1F	1799348973	RPOXZBYQDAOUCA-DLTLXFJOSA-N	442.260	1.520	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2	1800333136	OXHHOSKZTIHTPL-FJFWCWKTSA-N	427.810	1.996	50	20	IDGD	
COc1ccccc1CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)Br	1800762070	MMNYCQSVFNOQAA-LJGDNWOOSA-N	425.323	1.611	50	20	IDGD	
Cc1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)cc2c[nH]nc12	1800918493	QTQXFHJLDWMWJN-ACDBMABISA-N	432.289	1.117	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1CCN(c3ccccc3)CC1)C2	1800970867	LVOBOYSPZKXOJO-KOUHRCEDSA-N	449.979	1.746	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Cl)C3)C1	1801139367	JVYUNGBRBARAIE-WDTWZTHCSA-N	447.935	1.758	50	20	IDGD	
Cn1ncc2c(C(=O)N3CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]3c3cccnc3)cccc21	1803142795	JINLZUVRFVNDIL-YSGRDPCXSA-N	441.919	1.888	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cnn3cccc(F)c23)[C@@H]1c1cccnc1)[C@H](O)CCl	1803146872	CWFYMLCEXMDGBR-BMGDILEWSA-N	445.882	1.788	50	20	IDGD	
CC[C@@H](C)[C@H](O)C(=O)N1CCCC2(CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CC2)C1	1806074280	OXFAJJLGBNKSSC-JQIBSRIMSA-N	445.564	1.759	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)Cc2ccsc2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807362774	JGRHCVQVXIULGR-DENIHFKCSA-N	449.341	1.385	50	20	IDGD	
C=C(C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)C(F)(F)F	1807374052	WWKDTXWILDMVKI-FUHWJXTLSA-N	447.222	1.200	50	20	IDGD	
O=C(O)c1cc(C(=O)N2CCCC3(CCN(C(=O)[C@H](F)Br)CC3)C2)ncn1	1807579174	VUITZAGZIWQVSZ-ZDUSSCGKSA-N	443.273	1.710	50	20	IDGD	
CCc1[nH]nc(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)c1Cl	1807700962	UGCLFYVGNFXRTF-RVSPLBMKSA-N	440.331	1.940	50	20	IDGD	
CN1CCc2cc(C(=O)NC[C@@H]3CCN(C(=O)[C@@H](O)CCl)[C@H]3c3cccnc3)ccc21	1809317872	ZJENGHJOFUPCLV-JBACZVJFSA-N	442.947	1.993	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](CCN)C(=O)N1CCCC2(CCN(C(=O)[C@@H](F)Cl)CC2)C1	1809750728	XYHBCJQIUQKBBY-HUUCEWRRSA-N	448.967	1.994	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@@H](CNC(=O)COc2ccc(O)nn2)[C@H]1c1cccnc1	1812349073	AJKXIVCQEBAVIV-HNAYVOBHSA-N	447.923	1.927	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)C(OC)OC)[C@H]1c1cccnc1	1812773523	GEFXNPRTSKAAKG-ILXRZTDVSA-N	428.327	1.880	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)Cn2ccnn2)[C@H]1c1cccnc1	1812777944	ZNLDFRVWROOQFD-VYDXJSESSA-N	435.326	1.553	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)CN2CCCC2=O)[C@H]1c1cccnc1	1812864910	QSLFVIWIPUVLKE-YEWWUXTCSA-N	437.338	1.493	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)Cc2ncccn2)[C@H]1c1cccnc1	1812865858	YMRLJHBIAIGCRE-JOQOYGCGSA-N	432.322	1.904	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H]3CCC(=O)N3)sc2C1	1814414574	BINAQLJPWUNRPC-IQJOONFLSA-N	429.340	1.365	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)c3cc(O)nc(O)n3)sc2C1	1817109060	UYGKYFLPYNFNAZ-RQJHMYQMSA-N	442.295	1.354	50	20	IDGD	
CC(C)N[C@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1)C(C)C	1817456591	UUTAHGVGDNAJIO-UWJYYQICSA-N	449.600	1.797	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)CCc2cncnc2)n[nH]1	1817556003	ONDDVOOQJKSBFZ-KRWDZBQOSA-N	442.524	1.198	50	20	IDGD	
CS(=O)(=O)CC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](F)Br)n[nH]1	1820932957	WHTYQOSMYDTWLI-SKDRFNHKSA-N	425.280	1.137	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](C)Br)n[nH]1	1822189616	WOHWDTOLQOMSFJ-WZRBSPASSA-N	426.315	1.876	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1	1822417009	VONNHZRVNAMKLJ-JSGCOSHPSA-N	428.921	1.029	50	20	IDGD	
O=C(O)CSCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](F)Br)[nH]n1	1822428103	YXVMRBPIDGHCGN-TVQRCGJNSA-N	437.291	1.910	50	20	IDGD	
CC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](C)NS(=O)(=O)CC)CC2	1822840333	YUABUCNCZKOGLC-AXFHLTTASA-N	436.987	1.400	50	20	IDGD	
O=C(COc1cccnn1)N[C@@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1	1823013989	MECDJZZWELFKFH-OQPBUACISA-N	444.286	1.615	50	20	IDGD	
CC[C@@H](O)C(=O)N1CCCC[C@H]1C1CCN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)CC1	1824080708	SWRABHCNXYXMCL-PJHRTMSESA-N	431.537	1.511	50	20	IDGD	
COCC1(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1	1824480509	JSRFYZGSPJHYQU-FQEVSTJZSA-N	428.338	1.026	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](F)Br)CC1	1830378047	HPSVENLOCJBORM-MELADBBJSA-N	435.338	1.744	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](NC(C)=O)C(C)(C)C)CCO2	1831082180	DPGGOEADMXBFQB-XGHQBKJUSA-N	445.988	1.401	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)C3=CCCS3)CCO2)C1	1831544009	GGPSHRNZMQTWDE-DYVFJYSZSA-N	433.368	1.495	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCCC[C@H]1C1CCN(C(=O)C2=NNC(=O)C2)CC1	1831552607	DTJMIYOQPAITLZ-HIFRSBDPSA-N	427.343	1.656	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc(OC)c(C)c3)C2)C1	1831643962	MHZCDSPHXXABOP-LAUBAEHRSA-N	439.940	1.876	50	20	IDGD	
CCOc1ncccc1C(=O)NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1833018895	MCJFTHCGBSDABS-GOSISDBHSA-N	438.956	1.265	50	20	IDGD	
Cc1ccc(F)cc1C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)CCl)CC2)CC1	1833306486	UCAKXRMFNQLIED-LJQANCHMSA-N	425.932	1.919	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)[C@@H]3CCCN3C)CC2)CC1	1833620163	UQUJRUXMVUHZRU-QAPCUYQASA-N	443.430	1.683	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)CCC(=O)N3CCCC3)CC2)CC1	1833699454	NFTXIXOWECGDAY-IBGZPJMESA-N	441.016	1.978	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1)c1ccnnc1	1834141802	MXRPJGTUTDSHND-OAHLLOKOSA-N	428.306	1.352	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(C(F)F)no1)CCO2	1836246050	HRILLJPJBCJTJO-GOSISDBHSA-N	447.511	1.534	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC(OC2CCN(C(=O)c3cc(O)n[nH]3)CC2)CC1	1836670244	CMIHFCZZXLFBTK-LBPRGKRZSA-N	443.342	1.759	50	20	IDGD	
O=C(CCCn1ccnc1)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836720298	OESJIZRXCPEPTF-SFHVURJKSA-N	426.945	1.262	50	20	IDGD	
CC1=C(C(=O)N2CCC(OC3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)CCO1	1837995856	NYNZHDAYLNEUFH-UHFFFAOYSA-N	436.553	1.052	50	20	IDGD	
Cc1nc(C)c(C(=O)N2CCO[C@]3(COCCN(C(=O)CCBr)C3)C2)o1	1838002137	YYELNTUVBICOEJ-KRWDZBQOSA-N	430.299	1.146	50	20	IDGD	
O=C(c1ncccc1C(F)(F)F)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1838142177	GEULTHFYICNHSW-XJKSGUPXSA-N	439.793	1.705	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@H](F)Br)CC2)CC1	1838648564	ZDGBSBCUOJPABL-KGLIPLIRSA-N	443.741	1.929	50	20	IDGD	
CCOc1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)c1O	1839426473	XIPNSEUUKQQUFW-APWZRJJASA-N	430.860	1.395	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnn4c3OCCC4)CCO2)C1	1839516159	CVWKMEPDOTUEHS-UZLBHIALSA-N	440.928	1.143	50	20	IDGD	
Cc1cc(C)n2ccc(C(=O)N3CCO[C@@]4(COCCN(C(=O)[C@@H](F)Cl)C4)C3)c2n1	1839626786	UTLGXTBOAHEJHQ-UZLBHIALSA-N	438.887	1.556	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cncc(C)c3)C2)C1	1839963780	VPJKZBOKVDKPBI-VQIMIIECSA-N	440.338	1.634	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3CCSCC3)C2)C1	1840035931	KYCORZLUWROFCP-DYVFJYSZSA-N	435.384	1.369	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)C(C)(F)F)C2)C1	1840150067	FBMNUVQMQRTGRP-UGSOOPFHSA-N	426.888	1.378	50	20	IDGD	
O=C(c1ccn2cncc2c1)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840188529	ODIKWDUCMFFWDT-GOSISDBHSA-N	427.288	1.208	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)CCCc2ccccc2F)C1	1841335044	GIXVWHNRDNVKIE-UHFFFAOYSA-N	439.491	1.664	50	20	IDGD	
COCCOCC(=O)N1CCCC12CN(C(=O)[C@H](Br)Cc1ccccc1)C2	1842777130	KZBWEWMUEAYGIL-QGZVFWFLSA-N	439.350	1.859	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)CN1CCC(C)CC1)C2	1843415253	DMMSRWKYVABOBE-JJIBRWJFSA-N	428.537	1.056	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@H](O)C(=O)N1CC2(CCCN2C(=O)[C@@](C)(Cl)CCl)C1	1845168914	HVWBYNWRWPOPER-SJCJKPOMSA-N	438.352	1.312	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)c1scnc1C(F)(F)F)C2	1846384462	WERSFXQEUJARSA-UHFFFAOYSA-N	433.456	1.352	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](F)Cl)[C@H](O)C1	1847233418	AKBRWJPGYSTRBV-BTFPBAQTSA-N	433.908	1.341	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)[C@@H]1CC(=O)N(c2ccc3c(c2)OCCO3)C1	15879300	KJZSDUIBLJHOSH-CQSZACIVSA-N	441.440	1.046	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=O)c2c(C)nc3ccccn23)n(C)c1	17582899	ZIBZFSGUCSVICZ-UHFFFAOYSA-N	432.506	1.087	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2cccc(C[S@@](C)=O)c2)c2ccccc2c1=O	25954692	PDVRNCQDANDPLS-PMERELPUSA-N	426.498	1.760	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)NCc1cccc(NC(=O)c2ccccc2)c1	726088860	KCOVLQCKGQJOEV-UHFFFAOYSA-N	435.440	1.792	50	20	IDGD	
COc1ccc(COCCCNC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1	727479706	NIDXOAPBBBXDHE-UHFFFAOYSA-N	435.502	1.650	50	20	IDGD	
Cc1nn(Cc2ccccc2Cl)c(Cl)c1C(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1	728374315	LWUJOUUKHFOYDZ-LBPRGKRZSA-N	445.328	1.742	50	20	IDGD	
CCN(Cc1ccc(OC)c(OC)c1)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	728960196	WIBHXQGRUONGPT-UHFFFAOYSA-N	442.520	1.973	50	20	IDGD	
C[C@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)NNC(=O)Cn2ccc3ccccc32)C1=O	729451300	RMYZPUOVCOKMNI-JOCHJYFZSA-N	437.431	1.395	50	20	IDGD	
COc1ccc(C(=O)NCC(=O)NNC(=S)Nc2ccc(N(C)C)cc2)cc1OC	729690847	MHVCMGMSCDIDNY-UHFFFAOYSA-N	431.518	1.517	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)CN1C(=O)COc2cc(Br)ccc21	730033859	XZWBRZNOKPTKJW-UHFFFAOYSA-N	448.273	1.660	50	20	IDGD	
Cc1cccc2cc(C=NNC(=O)CSc3nn(C)c(=O)n(C)c3=O)c(Cl)nc12	730568789	BMMMLJZTYLZIRV-UHFFFAOYSA-N	432.893	1.231	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)Nc1ccccc1S(=O)(=O)N1CCCCC1	730903362	NHDYWGGKDNXUPA-UHFFFAOYSA-N	448.501	1.799	50	20	IDGD	
C[C@H](C(=O)NNC(=O)c1cc(Br)c[nH]1)N1CCN(c2ccc(F)cc2)CC1	731866758	ZCHSPDAKFAZLON-GFCCVEGCSA-N	438.301	1.888	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CCN2C[C@@H](C)O[C@H](C)C2)c1I	732264214	REOLVSUUJRIWDL-CHWSQXEVSA-N	445.301	1.860	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCCCC(=O)N2CCc3ccccc32)c1	732475621	JDJKDIYGFSWGPK-UHFFFAOYSA-N	444.513	1.404	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCCn2cnc3ccccc32)nc1	732595327	NCEBUBLNZOXBLK-UHFFFAOYSA-N	431.522	1.788	50	20	IDGD	
O=C(NCCCN1CCN(c2ccncc2)CC1)NNC(=O)NCc1ccc(Cl)cc1	732994825	IYSVJNRQCKKSPM-UHFFFAOYSA-N	445.955	1.961	50	20	IDGD	
Cn1c(NNC(=O)CCS(=O)(=O)c2ccc3c(c2)CCC3)nc2ccccc2c1=O	733262199	RLWSCKAUGDJRAY-UHFFFAOYSA-N	426.498	1.729	50	20	IDGD	
C[C@@H](CS(C)(=O)=O)NC(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1	733662566	NHNCZSFYLJFDSZ-OXJNMPFZSA-N	444.557	1.377	50	20	IDGD	
N#Cc1ccc(N2C(=O)N[C@@H](CCC(=O)NNC(=O)COc3ccc(F)cc3)C2=O)cc1	733774096	HGZKTRBKQBVYIX-KRWDZBQOSA-N	439.403	1.129	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCc2coc3ccccc23)cc1	734071921	KXKPKVMGXYJWJL-UHFFFAOYSA-N	430.486	1.892	50	20	IDGD	
CCOc1cc(Br)c(CC(=O)NNC(=O)c2cnn(C)c2)cc1OCC	735444089	OBJLWBBBVPRHOU-UHFFFAOYSA-N	425.283	1.984	50	20	IDGD	
O=C(NNc1cccnn1)c1cc(S(=O)(=O)N2CCCC2)ccc1Br	736704385	VLWAZZRZSJFXHJ-UHFFFAOYSA-N	426.296	1.781	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)[C@@H]2CCC[C@H]2NC(=O)OC(C)(C)C)c2ccccc2c1=O	739678921	NHOJWBDRJXFKKZ-HUUCEWRRSA-N	429.477	1.388	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1ccc2c(c1)OCCO2)[C@@H]1CN(Cc2ccccc2)CCO1	741285228	ZMMDBOWFVKJYKJ-IERDGZPVSA-N	440.500	1.691	50	20	IDGD	
CC(C)c1nn([C@@H]2CCS(=O)(=O)C2)cc1C(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	742463302	LEXBUMFGBJZDJA-CQSZACIVSA-N	435.462	1.349	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)N[C@H](C)CN2CCN(c3ccccc3)CC2)c1	743509065	XMULYPIOSOLMED-LJQANCHMSA-N	425.533	1.915	50	20	IDGD	
Cc1cccc2c(CCC(=O)OCC(=O)NNC(=O)[C@@H]3COc4ccccc4O3)c[nH]c12	745135590	OTLSCGIRVWFYPY-IBGZPJMESA-N	437.452	1.940	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H]2CC[C@@H](SC)C2)c1	745893773	GMOJFOWABGHLIO-LSDHHAIUSA-N	428.580	1.945	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)N[C@@H]1CC(=O)N([C@H]2C[C@@H]2c2ccccc2)C1	745915376	YOFYESKUEPPBGQ-QRVBRYPASA-N	433.468	1.424	50	20	IDGD	
O=C(NNC(=O)c1cccc2ncccc12)c1cc(S(=O)(=O)N2CCCC2)ccc1O	745994300	TZJKOFAXIVOWSP-UHFFFAOYSA-N	440.481	1.800	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)[C@@H]1C[C@@H](O)CN1C(=O)OCc1ccccc1	746098534	TZLRHGWDEQVMDX-AEFFLSMTSA-N	431.420	1.124	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNS(=O)(=O)c1cc(C(=O)OC)ccc1OC	747595785	GCNRIBYWHVRPHC-UHFFFAOYSA-N	438.458	1.269	50	20	IDGD	
COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)NNC(=O)C(=O)N2CCCC2)cc1	748240836	KYDCVBGUMDNWBU-UHFFFAOYSA-N	428.401	1.779	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN1C(=O)c1cc(Cl)cc(Cl)c1)C(=O)N1CCCC1	748240978	NABNGNJENIYUIT-AWEZNQCLSA-N	427.288	1.368	50	20	IDGD	
Cc1nc(Cl)cc(NNC(=O)[C@@H]2CCCN2S(=O)(=O)c2cccc([N+](=O)[O-])c2)n1	748336586	XPJXUHCZVYRPRT-ZDUSSCGKSA-N	440.869	1.643	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)/C=C/c3ccccc3C#N)cc2)CC1	748619517	JEAYQLBFONAOPV-IZZDOVSWSA-N	425.514	1.651	50	20	IDGD	
CCc1cc(N2CCC(NC(=O)NNC(=O)c3cc(Br)c[nH]3)CC2)ncn1	748662675	BTZNBICVZMLMHJ-UHFFFAOYSA-N	436.314	1.743	50	20	IDGD	
CCOc1ccc(C(=O)NCC(=O)NNc2nc(Br)cn3ccnc23)cc1	750243474	JFCKVYRQLUCZMW-UHFFFAOYSA-N	433.266	1.764	50	20	IDGD	
Cc1nn(-c2cncc3nnnn23)c(C)c1CC(=O)NNc1ccc([N+](=O)[O-])cc1Cl	750428774	RQCGCGFHUHUWRJ-UHFFFAOYSA-N	442.827	1.569	50	20	IDGD	
COCCCNC(=O)NNC(=O)c1sccc1S(=O)(=O)NCc1cccs1	751373037	XOCCBORJWSJZTA-UHFFFAOYSA-N	432.549	1.269	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NCc2c(F)cccc2OC(F)F)c2ccccc2c1=O	753000213	QOCLRCZDVDRXAH-UHFFFAOYSA-N	435.362	1.818	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)N[C@H]3CCCN(c4cccnc4)C3=O)nc21	753358901	SWFMOOMUZONDLN-AWEZNQCLSA-N	439.480	1.504	50	20	IDGD	
N#C/C(=C\c1ccc(O)cc1)C(=O)OCC(=O)NCC1(N2CCOCC2)CCCCC1	754545825	LFKHIPVSWAOJOQ-XMHGGMMESA-N	427.501	1.994	50	20	IDGD	
Cc1c(C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)c(=O)oc2ccc(Br)cc12	755065629	UCUFJIYLBBVEAA-SECBINFHSA-N	443.275	1.060	50	20	IDGD	
N#C/C(=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)NC[C@]1(O)CCOC1	755219245	QAAXHOQDCVUFOD-ZVYZCIRASA-N	443.891	1.253	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)Nc2ccc(S(=O)(=O)N3C[C@H](C)O[C@@H](C)C3)cc2)o1	755423850	RDMWDEPYGYWPHF-KBPBESRZSA-N	436.490	1.852	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)Nc2ccc(CCn3nnc(-c4ccccc4)n3)cc2)cn1	756294067	DLEGECQHGHAKQO-UHFFFAOYSA-N	431.460	1.783	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)Nc3ccc(CNS(C)(=O)=O)cc3)n[nH]2)cc1	756630507	WLEWHJSISJSGLI-UHFFFAOYSA-N	442.501	1.901	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Nc2ccn(Cc3ccncc3)n2)cc(OC)c1OC	756650223	MVBVSLCBHBKVED-UHFFFAOYSA-N	426.433	1.819	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)Nc2ccn(CCN(C)C)n2)c1	756766791	ZDCLUFLPLOYGER-UHFFFAOYSA-N	425.287	1.682	50	20	IDGD	
CC[C@H]1CN(CC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)CC[C@H]1NC(=O)OC(C)(C)C	757103933	FZSOUCSWEVAJEY-WMLDXEAASA-N	449.508	1.981	50	20	IDGD	
COc1ncncc1NC(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	757690159	KCBHGIDCOHMCBZ-UHFFFAOYSA-N	445.443	1.654	50	20	IDGD	
COCCCS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2cccc(OC)c2O)cc1	757822283	HOQQDECUWHTKGC-UHFFFAOYSA-N	437.474	1.678	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(F)(F)[C@@H](C(=O)NNC(=O)CNC(=O)c2cccs2)C1	757909565	QDAPQIPLLKWVRB-LLVKDONJSA-N	446.476	1.518	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2ccnc(OCC(F)F)c2)cc1	758069075	RFRZZRAXYDBYLW-UHFFFAOYSA-N	442.444	1.116	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)N=c2cc[nH]cc2I)cc1	760035313	TVMPROSPPYGNFO-UHFFFAOYSA-N	442.213	1.348	50	20	IDGD	
COC(=O)c1cc(Cl)cc(S(=O)(=O)NNC(=O)CSc2ccccc2O)c1	763411621	VDFWMHNKCZESQD-UHFFFAOYSA-N	430.891	1.934	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNS(=O)(=O)c1ccc(C(=O)O)c(Cl)c1	763439324	KUWMCILKKDSUAT-UHFFFAOYSA-N	435.886	1.653	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)Nc1ccc(CCN2CCCC2)cc1	763575565	XLCOVBNDLWTAGK-FQEVSTJZSA-N	438.484	1.251	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C)c(C)c2)c(Br)n1	763664345	AKOFIBVRPZDSFX-UHFFFAOYSA-N	435.278	1.934	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(N3CCOC[C@@H]3C)cc2)cc1C	763665255	QGYBVOMSGOGQBJ-KRWDZBQOSA-N	440.500	1.693	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cc(S(C)(=O)=O)ccc2F)cc1C	763665584	YSYQWIVCAYVKAF-UHFFFAOYSA-N	437.449	1.011	50	20	IDGD	
O=C(COc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1cccc(N2CCCNC2=O)c1	763686035	JBWVWIHPYBVIOF-UHFFFAOYSA-N	445.863	1.425	50	20	IDGD	
C[C@H]1CN(c2ccccc2NC(=O)C(=O)NNC(=O)c2cccc(N(C)C)c2)C[C@H](C)O1	763758629	SPDASOSVYIUFHX-HOTGVXAUSA-N	439.516	1.766	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2nn(CCC(C)C)c(=O)c3ccccc23)no1	763842600	FKMVQHBCANIGAJ-UHFFFAOYSA-N	426.433	1.139	50	20	IDGD	
Cc1noc(C)c1NC(=O)C(=O)NNC(=O)c1nn(CCC(C)C)c(=O)c2ccccc12	763843095	NZOKMWCMHVSNIW-UHFFFAOYSA-N	440.460	1.447	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(OC)c(OC)c2)cc1	763861371	OPJANTVSOYIYDS-ZDUSSCGKSA-N	431.445	1.656	50	20	IDGD	
Cc1cc(Oc2ncccn2)ccc1NC(=O)C(=O)NNC(=O)c1ccc2c(c1)OCCO2	764007088	ZMNFUBQZJNYOFX-UHFFFAOYSA-N	449.423	1.748	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc(OCc2nc(C)no2)cc1	764040682	JBFGOHQVLSGXNK-UHFFFAOYSA-N	425.401	1.365	50	20	IDGD	
O=C(NNC(=O)c1cccc(Br)c1)C(=O)Nc1ccn(CC(F)(F)F)n1	764062748	CNDLHTTWEGIFNR-UHFFFAOYSA-N	434.172	1.608	50	20	IDGD	
CCc1cc(O)nc(-c2cccc(NC(=O)C(=O)NNC(=O)c3ccc(C)cc3O)c2)n1	764105251	PBXBYUGMMLJCPQ-UHFFFAOYSA-N	435.440	1.825	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C)c(C(=O)OC)c2)o1	764138594	FPUGHSCNEJSWDY-UHFFFAOYSA-N	430.461	1.616	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)cccc1C(=O)N1CCCC1	764168482	PNQLPGKDCRXZDU-LJQANCHMSA-N	436.468	1.321	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(C#N)c2)cc1C	764233524	AGHDBBBNRPQCPM-UHFFFAOYSA-N	429.458	1.028	50	20	IDGD	
O=C(NNC(=O)c1cccc(OC(F)F)c1)C(=O)Nc1ccn(Cc2ccccn2)n1	764260455	ZEWBZEKUVIHTEN-UHFFFAOYSA-N	430.371	1.328	50	20	IDGD	
Cc1cc(C)n(-c2ccc(NC(=O)C(=O)NNC(=O)COc3ccccc3O)cc2F)n1	764278222	NILVKTHKNKAKKH-UHFFFAOYSA-N	441.419	1.499	50	20	IDGD	
CCS(=O)(=O)c1cc(F)ccc1NC(=O)C(=O)NNC(=O)c1cc2ccccc2o1	764332674	WPHUIVNYNSHALF-UHFFFAOYSA-N	433.417	1.765	50	20	IDGD	
N#Cc1c(F)cccc1-n1ccc(NC(=O)C(=O)NNC(=O)COCc2ccccc2)n1	764363872	VVCOZYPHSUVEBX-UHFFFAOYSA-N	436.403	1.186	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)NCCNc1nccc(C(F)(F)F)n1	764415358	XRRAZTWPYUQSTF-UHFFFAOYSA-N	430.412	1.736	50	20	IDGD	
Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1NC(=O)C(=O)NNC(=O)CO	764421390	NMIBDQZZYBSWOW-UHFFFAOYSA-N	438.362	1.344	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)C(=O)Nc2c3c(nn2-c2ccccc2)CCC3)c1	764430148	CGSZWRBMRRSZRG-UHFFFAOYSA-N	447.455	1.114	50	20	IDGD	
COc1nccnc1NNC(=O)C1CCN(S(=O)(=O)c2ccc3c(c2)CCCC3)CC1	764481918	OCKCJRHZOJKRCG-UHFFFAOYSA-N	445.545	1.908	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2cc(-c3cccc(OC)c3)[nH]n2)c2ccccc2c1=O	764544368	IHAAJWTUQKIPCI-UHFFFAOYSA-N	432.440	1.890	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)[C@H](C)NS(=O)(=O)c2ccc(C#N)cc2)c1C	764553994	UOMFJCAXJGRQOU-JKSUJKDBSA-N	444.513	1.457	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1ccc(OCC(F)(F)F)cn1	765185815	OKAJZPUGAKOFLK-UHFFFAOYSA-N	445.423	1.699	50	20	IDGD	
C=C(C)Cn1c(SCC(=O)NNC(=O)C(=O)Nc2ccccn2)nnc1-c1ccco1	765506773	RAEVSYGBZOZPEC-UHFFFAOYSA-N	441.473	1.387	50	20	IDGD	
CNS(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)c1	765568110	LHYNSGIHROACJJ-UHFFFAOYSA-N	439.906	1.775	50	20	IDGD	
O=C(/C=C/c1nc2ccccc2s1)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765734614	AHDHRCQWGAZOKU-ZHACJKMWSA-N	449.536	1.915	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)CN1CCN([C@@H]2CCN(c3ccccc3)C2=O)CC1	766890152	XXVJMXOQGOOJLZ-JOCHJYFZSA-N	449.555	1.108	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)c1sccc1S(=O)(=O)C(F)F	767340663	WMLHMTCESXSXMU-UHFFFAOYSA-N	446.453	1.600	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cc1C1CC1	768072392	OQTRLBMKKSQJEJ-UHFFFAOYSA-N	436.512	1.792	50	20	IDGD	
COc1ccc(NNC(=O)[C@H](CSC)N2C(=O)[C@H]3CCCC[C@@H]3C2=O)c([N+](=O)[O-])c1	768332283	RXTDOZRDJLZZCE-XEZPLFJOSA-N	436.490	1.953	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)c1cc(Br)cc([N+](=O)[O-])c1	770172039	MOGRDCXMCZSTRR-UHFFFAOYSA-N	427.236	1.610	50	20	IDGD	
Cc1ccc(S(=O)(=O)NC(C)(C)C)cc1C(=O)NNC(=O)c1ccc2c(c1)OCCO2	770390113	ALTHVFPPDMMFMY-UHFFFAOYSA-N	447.513	1.918	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)[C@@H](C)NS(=O)(=O)c2cccs2)n[nH]1	771043844	BVDJWTQOJWEDCC-LLVKDONJSA-N	449.514	1.275	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1cc(Br)ccc1Br	771940707	QCZRKIOWJHCSHC-SSDOTTSWSA-N	440.113	1.407	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)NCCN(C)S(=O)(=O)c2cccs2)cc1	772626400	RSTFXBFQKPKMKC-UHFFFAOYSA-N	442.588	1.800	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)Nc1cnn(Cc2nnc3n2CCCC3)c1	772639320	DYJDOGDFZIPXNG-CYBMUJFWSA-N	442.455	1.619	50	20	IDGD	
Cc1cc(C)c2[nH]cc(C(=O)N3CCN(S(=O)(=O)CBr)CC3)c(=O)c2c1	776188392	DZCABFVZUYEGRR-UHFFFAOYSA-N	442.335	1.585	50	20	IDGD	
CN(NC(=O)C[C@H]1C(=O)Nc2ccccc21)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776201683	KWDUWCIVFXCNSY-OAHLLOKOSA-N	431.493	1.748	50	20	IDGD	
O=C(COC(=O)C1(c2ccc(F)cc2F)CCC1)NNC(=O)[C@@H]1COc2ccccc2O1	777213197	OMRWKXCFDDMVMV-SFHVURJKSA-N	446.406	1.917	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)[C@H](C)NC(=O)c2cc3c(C)nn(C)c3s2)nc1C	778425609	UXCABOIEXPWUNV-NSHDSACASA-N	445.505	1.480	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)NCC1CCN(Cc2cccs2)CC1	778641177	TWQBJZUFUGJDHE-UHFFFAOYSA-N	425.555	1.815	50	20	IDGD	
CC(C)(C(=O)NNS(=O)(=O)c1ccccc1S(=O)(=O)NC1CC1)c1ccccc1	780388362	YUAQMWUBLJWUMZ-UHFFFAOYSA-N	437.543	1.415	50	20	IDGD	
COc1ccc(C[C@H](C)C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)cc1OC	781237470	YNADDFQQSUBPCW-ZDUSSCGKSA-N	448.545	1.945	50	20	IDGD	
COc1ccc(CN(CC(=O)NNC(=O)c2ccccc2)[C@H]2CCS(=O)(=O)C2)cc1	781348658	MISHOIQUMBWBPI-SFHVURJKSA-N	431.514	1.146	50	20	IDGD	
CNC(=O)[C@@H]1CN(C(=O)C(=O)Nc2ccccc2S[C@@H](Cl)C(F)(F)F)CCO1	782005841	YADYUTQKEKNZPE-ZUZCIYMTSA-N	439.843	1.818	50	20	IDGD	
O=C(CN1CCC[C@H](S(=O)(=O)NC2CCCC2)C1)NNC(=O)c1ccccc1Cl	782056360	SJBXBALJMMIZNG-HNNXBMFYSA-N	442.969	1.427	50	20	IDGD	
CC(=O)N1CCN(c2cccc(NC(=O)NNC(=O)COc3ccccc3O)c2)CC1	782081794	MEBWSQMGUDAKMS-UHFFFAOYSA-N	427.461	1.292	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)cc1)C(=O)Nc1ccc(CCN2CCSCC2)cc1	782833834	LZNRCLVQSYWZSF-UHFFFAOYSA-N	428.514	1.383	50	20	IDGD	
C[C@H]1CN(C(=O)c2ccc(NC(=O)C(=O)NNc3cncc(Cl)n3)cc2)C[C@@H](C)O1	783259432	FEPOAJXIHGTDFM-TXEJJXNPSA-N	432.868	1.461	50	20	IDGD	
Cc1cc(Br)cc(Cl)c1NC(=O)C(=O)NN[C@]1(C)CCS(=O)(=O)C1	783424448	DTYCYRGGHNVQRE-CQSZACIVSA-N	438.731	1.547	50	20	IDGD	
Cc1ccc(NNC(=O)C(=O)Nc2ccc(S(=O)(=O)c3ccc(F)cc3)cc2)nn1	783951376	AUSWAOYVJONEPX-UHFFFAOYSA-N	429.433	1.839	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ccc(Br)nc2)c(OC)c1OC	784806714	OVJSPVLFXAFVFV-UHFFFAOYSA-N	425.239	1.952	50	20	IDGD	
O=C(NNc1ccnc(F)c1)C(=O)Nc1c(C(=O)N2CCOCC2)oc2ccccc12	784852100	UDXVTEYRDIGRPG-UHFFFAOYSA-N	427.392	1.521	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)Nc1ccc(F)c(Br)c1	785024016	QHOVDRMSGWCZNZ-UHFFFAOYSA-N	441.169	1.602	50	20	IDGD	
CCN(Cc1ccccc1NC(=O)C(=O)NNC(=O)Cc1cn2ccccc2n1)C(C)=O	785067116	HELFYNZBKDJHSA-UHFFFAOYSA-N	436.472	1.031	50	20	IDGD	
O=C(NC[C@H](Cc1cccc(F)c1)C(=O)N1CCOCC1)NNc1ccc(Cl)nn1	789310517	ONBQBHBGFMVNIH-AWEZNQCLSA-N	436.875	1.613	50	20	IDGD	
COc1cc(NNC(=O)C(=O)Nc2ccc(S(=O)(=O)NC3CC3)cc2)ccc1Cl	789796544	ZMXMGOGRKUCHOP-UHFFFAOYSA-N	438.893	1.871	50	20	IDGD	
C[C@@H]1Oc2ccc(NC(=O)C(=O)NNC(=O)[C@H]3OCC[C@H]3c3ccccc3)cc2NC1=O	789811429	ZZPDZBMRRASWGW-QITLCBANSA-N	438.440	1.065	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cccc1NC(=O)N(C)C	792355356	GOEQTDALHRPRRG-UHFFFAOYSA-N	449.471	1.674	50	20	IDGD	
CN(C)N(C(=O)c1nc(Br)ccc1Br)[C@H]1CCS(=O)(=O)C1	792524537	GYXUQKBLRLVTJS-QMMMGPOBSA-N	441.145	1.713	50	20	IDGD	
O=C(Cc1ccc2n[nH]cc2c1)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	792774096	NVMILEMXKDFGDN-UHFFFAOYSA-N	441.513	1.741	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)CNC(=O)c1cccs1)c1ccc(Br)cn1	792882425	LVLZKEFGWKMAQF-VIFPVBQESA-N	426.296	1.727	50	20	IDGD	
CSC[C@@H](C)C(=O)N1CCC(C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)CC1	799539188	DFDLDUSBLYYLMD-CQSZACIVSA-N	446.529	1.100	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3ccc(NCC4CC4)nc3)cc2)CC1	800690888	SGJKQPOZBPNCTE-UHFFFAOYSA-N	444.561	1.597	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)NC(=O)c2cc3c(C)nn(C)c3s2)cc1	801109931	IZBVWWRYOOKNFQ-LBPRGKRZSA-N	442.501	1.156	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCCC1C[C@@H](C)O[C@H](C)C1	801737973	LWUNVDIHUTTWQR-CHWSQXEVSA-N	425.555	1.826	50	20	IDGD	
O=C(N=c1cc[nH]cc1)NNC(=O)C1CCN(C(=O)c2ccc(Br)cc2)CC1	802029280	LAIJSKDBBPOXCE-UHFFFAOYSA-N	446.305	1.971	50	20	IDGD	
C[C@H]1CN(c2ccnc(C(=O)NNC(=O)Nc3ccc(S(C)(=O)=O)cc3)c2)C[C@@H](C)O1	802068230	FXCLPASKCRAJDM-OKILXGFUSA-N	447.517	1.565	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)N[C@H]1CCCN(C(=O)N2CCCC2)C1	805110444	UWANYBKKHGGNHI-KRWDZBQOSA-N	425.493	1.497	50	20	IDGD	
O=C(NCCNS(=O)(=O)c1cccc(Cl)c1)NNc1ccc2c(=O)[nH]ccc2c1	806364087	OGKOGRVFVGFFQI-UHFFFAOYSA-N	435.893	1.786	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)C(=O)Nc1cccc(C(=O)c2ccccc2)c1	807429587	VUXZIUAIZDHFTG-UHFFFAOYSA-N	427.424	1.975	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(F)c(NC(=O)C(=O)NNc2nccnc2C2CCC2)c1	807459901	IGNWZVVBSSEJAD-UHFFFAOYSA-N	436.469	1.215	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)C(=O)OC3)cc1	808934488	HRTGMZTYBIBWRT-GFCCVEGCSA-N	425.397	1.113	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cncnc2-c2ccccc2)c1	809939946	AMFHIGXVEJLJOO-UHFFFAOYSA-N	425.470	1.469	50	20	IDGD	
O=C(COc1ccccc1O)NNS(=O)(=O)c1cnc2onc(-c3ccccc3)c2c1	810047696	ZTQAWSPCUVTLIG-UHFFFAOYSA-N	440.437	1.984	50	20	IDGD	
O=C(NNc1nc(-c2ccncc2)no1)C1(S(=O)(=O)c2ccccc2)CCOCC1	813433702	AAVNPDIONNHWJY-UHFFFAOYSA-N	429.458	1.598	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@](C)(O)c2ccc(Cl)cc2)c1	814722094	JRRUSTFXWMBTAV-GOSISDBHSA-N	425.894	1.259	50	20	IDGD	
CCn1cnc2c1c(=O)n(CC(=O)NN=C1CCC[C@H](C#N)C1)c(=O)n2Cc1ccccc1	814745931	KRVWQYOSOKHTAE-KRWDZBQOSA-N	447.499	1.614	50	20	IDGD	
O=C(NNC(=O)c1cc2ccccc2cc1O)C(=O)Nc1cn(Cc2ccccc2)nn1	815563461	CMMVIAYEFYHIOJ-UHFFFAOYSA-N	430.424	1.585	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1)C1CC1	815564037	VIMHGGOJRYEUMM-UHFFFAOYSA-N	425.401	1.510	50	20	IDGD	
CN(Cc1ccccc1)c1ccc(NC(=O)C(=O)NNC(=O)[C@H]2CCc3nncn3C2)cc1	815691917	FMXARJLDPAOLGN-KRWDZBQOSA-N	447.499	1.263	50	20	IDGD	
CC(C)Sc1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)[C@H]1CCc2nncn2C1	815692275	NLPDHIGBRADCPA-NSHDSACASA-N	436.925	1.781	50	20	IDGD	
O=C(CCC(=O)Nc1nnc(C2CCCCC2)s1)NNC(=O)[C@@H]1CCc2nncn2C1	816879720	UUWBGGBNECFZAC-CYBMUJFWSA-N	446.537	1.306	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(F)c(C(=O)NNc2ccccc2S(=O)(=O)N(C)C)c1	817055226	RXGGUFOHWCIFBA-UHFFFAOYSA-N	444.510	1.083	50	20	IDGD	
C[C@H](Sc1nnnn1C1CC1)C(=O)NNC(=O)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	819658842	PTBGBTOKHBYWNK-NWDGAFQWSA-N	439.542	1.283	50	20	IDGD	
O=C(NCc1ccc(Cn2cncn2)cc1)NNC(=O)c1nn(-c2ccccc2)cc1O	838657236	PNDGPQXAHLPGEL-UHFFFAOYSA-N	432.444	1.362	50	20	IDGD	
Cc1ccc([C@@]2(C)NC(=O)N(CC(=O)NNC(=O)COc3ccc(F)cc3)C2=O)cc1	910814765	BRAKNGXMDBTLNO-OAQYLSRUSA-N	428.420	1.128	50	20	IDGD	
CN(C)N(C(=O)c1cn(-c2ccccc2Br)nn1)[C@H]1CCS(=O)(=O)C1	914717417	JHJZGHCHBALBEY-NSHDSACASA-N	428.312	1.136	50	20	IDGD	
COc1ccc(/C=C\C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1OC	915789154	SORBDDPTGQSFME-YWEYNIOJSA-N	439.877	1.479	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCCc2c[nH]c3ccccc23)cc1	915885185	VSNBLRIPAZLRLV-UHFFFAOYSA-N	443.529	1.670	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)[C@H]3CCC(=O)NC3)c2)c(C)c1	916097483	GIHFUURWMZLEAX-INIZCTEOSA-N	444.513	1.391	50	20	IDGD	
Cc1ccc([C@@H](CNC(=O)NNC(=O)[C@H](C)Oc2ccccc2F)N2CCOCC2)o1	916227563	CLJUJUPLTRBSHL-DOTOQJQBSA-N	434.468	1.898	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)NCc2ccnc(N3CCOCC3)c2)cc1C	916389456	ZXZMNSLFPPFSOX-UHFFFAOYSA-N	426.477	1.004	50	20	IDGD	
O=C(NCc1ccc(-n2cccn2)cc1)NNC(=O)c1csc(N2CCOCC2)n1	916519147	AWGPQHHPSPJKNK-UHFFFAOYSA-N	427.490	1.310	50	20	IDGD	
CCCCN(C(=O)COC(=O)/C(C#N)=C/c1ccc(OC)cc1)[C@H]1CCS(=O)(=O)C1	916613225	UISJDKRWTXMHJE-WQJNHMDYSA-N	434.514	1.961	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NCCS(=O)(=O)NCc2ccccc2)cc1C	916645483	YHGSKGLHJNBMHR-UHFFFAOYSA-N	434.518	1.132	50	20	IDGD	
COc1ccc(Cl)cc1CNC(=O)NNC(=O)c1csc(N2CCOCC2)n1	916647181	QBSWQJFOFGHPJT-UHFFFAOYSA-N	425.898	1.786	50	20	IDGD	
Cc1cc(C)c(S(=O)(=O)NNC(=O)c2ccccc2O)c(C)c1NS(C)(=O)=O	917717833	QSZAPLAIMPKFMV-UHFFFAOYSA-N	427.504	1.312	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c(OC)c1OC	917926410	XROBETMLSTZOHI-UHFFFAOYSA-N	426.433	1.082	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCc2ccc(OC)cc2OC)nc1	918234801	GUVSBXPXVOMKOX-UHFFFAOYSA-N	437.522	1.956	50	20	IDGD	
CNS(=O)(=O)c1ccc([C@H](C)NC(=O)NNC(=O)COc2ccccc2OC)cc1	919778350	ACGNAFWLKNESNG-ZDUSSCGKSA-N	436.490	1.074	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)Nc1ccc(S(N)(=O)=O)cc1	919896652	HBODMKXKTPSMTO-UHFFFAOYSA-N	441.535	1.559	50	20	IDGD	
Cn1c(=NNC(=O)[C@H]2CCCN2C(=O)/C=C\c2ccc(C(N)=O)cc2)sc2ccccc21	920017867	GFSOSSAZULUZGV-ZLTBNNCUSA-N	449.536	1.975	50	20	IDGD	
O=C(CCNS(=O)(=O)c1cccc([N+](=O)[O-])c1)NNC(=O)c1ccc(Cl)cc1	920339064	BHHUMHWDQUGJRB-UHFFFAOYSA-N	426.838	1.378	50	20	IDGD	
Cc1ccc(S(=O)(=O)Cc2ccc(C(=O)NNC(=O)CN3CCCC3=O)cc2)cc1	920433173	QWVDRSAFIKRDQN-UHFFFAOYSA-N	429.498	1.352	50	20	IDGD	
Cc1nc(-c2cccnc2)nc(O)c1CC(=O)NNC(=O)c1cncn1-c1ccccc1	1115870950	LHOPYXGOFMHFAR-UHFFFAOYSA-N	429.440	1.742	50	20	IDGD	
Cc1ccc2c(c1)S[C@@H](C(=O)NNC(=O)CN1CCN(C(=O)c3ccccc3)CC1)C2	1319201573	SLKPLZZWJMMPGF-HXUWFJFHSA-N	438.553	1.617	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])ccc1N1CCN(C)CC1	1325338680	JZEGQUXIVASWMM-UHFFFAOYSA-N	442.476	1.887	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](C(=O)NNC(=O)c1ccc(Br)s1)C(C)(C)O	1330104309	OBIJHLHEANZBHW-SNVBAGLBSA-N	436.328	1.936	50	20	IDGD	
Cc1ccc(C(=O)NCC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](F)Cl)C2)cc1	1778028328	WEUOMNOLQRNQND-HGHGUNKESA-N	439.915	1.773	50	20	IDGD	
CCOCCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C1	1778094347	GKVJDAVXWFEYJY-UPRBLEQPSA-N	447.536	1.061	50	20	IDGD	
CN1CCCC[C@@H]1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CO[Si](C)(C)C)C1	1779538753	GZDVLQUZXRWYQQ-DBXWQHBBSA-N	425.646	1.836	50	20	IDGD	
Cc1n[nH]c(C)c1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCBr)C2	1779606614	SEKZTQVNUGEUFK-RDTXWAMCSA-N	427.343	1.939	50	20	IDGD	
CCn1nc(C(C)C)cc1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](Cl)COC)CCO2	1780403852	FJLDJHQJJZEHLW-YWZLYKJASA-N	426.945	1.724	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCc1nc(N)n[nH]1)C2	1780712934	ZKRHWQWHTPPDDJ-NXOUGTEYSA-N	447.367	1.070	50	20	IDGD	
Cc1[nH]nc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](F)Br)C2)c1F	1780770804	CFYOOAVIOMWGBZ-CKUKBARFSA-N	435.269	1.675	50	20	IDGD	
C[C@@H](Cn1cncn1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Br)C1	1780774476	BFYATOPDQYZIJO-QDEZUTFSSA-N	446.321	1.119	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)c3cnc4ncccn34)CCO2)C1	1781229117	CCPUNPQWRMSGNV-ROUUACIJSA-N	426.304	1.409	50	20	IDGD	
O=C(c1ccc2nc[nH]c2c1)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781330894	AQDGADOCXKBNNF-PBHICJAKSA-N	425.258	1.697	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2)c1n[nH]c2cccc(F)c12	1781391514	UTIXICIKOLMTOG-BXTJHSDWSA-N	438.887	1.429	50	20	IDGD	
C#CC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2	1781695877	RUHPXNDJPGJEME-WIYYLYMNSA-N	429.429	1.281	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(CCN(C(=O)c3ccc(C4CC4)cc3)C2)C1	1782020263	CUQWVSFZABBWTM-XMMPIXPASA-N	434.301	1.001	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1cccc(OC)n1)C2	1782172451	UWHOJRQMXDRTEZ-CSODHUTKSA-N	439.940	1.400	50	20	IDGD	
Cc1cscc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCC(=O)NN(C)C)C1	1782211978	LJWDONRYOFVEIA-DYESRHJHSA-N	436.578	1.557	50	20	IDGD	
COc1cc2c(O)cccc2cc1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1782388027	XYRWSLCBYZSQQI-AVRDEDQJSA-N	448.903	1.597	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C=C/c2cnccn2)C1	1782620753	KSDVOQPKGVSZMP-SOCMVBSASA-N	437.338	1.787	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)Cc3cccc(OC)n3)CCO2)C1	1783342093	GQIUHDLMTNHTPO-KXBFYZLASA-N	440.338	1.636	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)CCBr)CCO2)C1	1783342147	JHPKMKVSVRDKHG-BXUZGUMPSA-N	426.149	1.775	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)CCc3ccc(F)nc3)CCO2)C1	1783530471	YWIWWZZMNCMFSG-UGSOOPFHSA-N	428.302	1.767	50	20	IDGD	
Cc1nn(C)c(C)c1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)Br)C[C@@H]21	1784703230	JOYJOXVXCZWZCV-KJEVXHAQSA-N	427.343	1.414	50	20	IDGD	
Cc1ccc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]32)cc1C	1784992343	XTPWKWHMRFJFRU-ACRUOGEOSA-N	444.576	1.199	50	20	IDGD	
COc1ccc(F)cc1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1785025121	RVLPWFOGYSFXHJ-PBHICJAKSA-N	433.249	1.968	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3CCC(CO)CC3)[C@H]2C1	1785058184	LLAHAUSQTZGIBG-GNEWDUKKSA-N	445.398	1.938	50	20	IDGD	
Cc1nc(N)sc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)Br)C[C@@H]21	1786919158	MEYICEMBLXSCEA-VGDYDELISA-N	431.356	1.410	50	20	IDGD	
Nc1c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Cl)C[C@@H]32)sc2nccnc12	1786951486	FZJINWDEDBUAKQ-RUMNANIHSA-N	427.889	1.401	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4c(c3)CC(=O)N4)[C@H]2C1	1788261815	ZGDZJPDHDONPAE-IEZWGBDMSA-N	445.592	1.626	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC1(c2ccc(NC(=O)c3cc(=O)n4[nH]nnc4n3)cc2)CCC1	1788407375	HWZJODWNTWVVLL-AWEZNQCLSA-N	443.895	1.968	50	20	IDGD	
C[C@@H](Cc1ccncc1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]2C1	1789925058	MEVKICMDYUGNQT-JVNPIMRCSA-N	442.329	1.930	50	20	IDGD	
CCc1cnc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]3C2)s1	1789926409	WVEJTJXNAODHJI-BQUFFADESA-N	434.331	1.989	50	20	IDGD	
O=C(CCc1c[nH]c2ncccc12)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21	1792205708	YAGILLMJRILIOV-OWLYRPNTSA-N	434.924	1.075	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCc1ccc(C#N)cc1	1792424332	PXJOBFJBSFSWCD-HATOLVCRSA-N	429.593	1.932	50	20	IDGD	
Cc1ccn2c(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@H](C)CBr)cnc2c1	1792874350	MXDZDBAYMXWBIL-ZXFNITATSA-N	449.349	1.877	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CCc2ccccc2[C@H]1O	1793182800	HYKLXJXNKATQSX-PSBIQLRGSA-N	442.560	1.294	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(=C/c1ccco1)NC(C)=O)C2	1793451581	CYEKPZBMYPUWIW-JJQBXIMZSA-N	437.924	1.754	50	20	IDGD	
Cn1ncc2cc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)CCBr)ccc21	1795114522	RQWARRFJYJEPEB-JLVBRIDZSA-N	435.322	1.562	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1CN(C(=O)OC(C)(C)C)C1	1797143261	OAFSZWGLECAQSI-YVSFHVDLSA-N	443.972	1.850	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2cccnc2n1	1797355861	RRTGNLAFHZFQMH-JJAZEVLHSA-N	447.333	1.864	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)Nc1ccccn1	1797976108	JATBGUBHMNZAFZ-IPVBOJNNSA-N	425.327	1.255	50	20	IDGD	
C[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@](C)(Cl)CCl)n1ccccc1=O	1799277506	WKJOQAVTWVMXTG-HUYPOWGKSA-N	430.332	1.235	50	20	IDGD	
COc1ccc(C)c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)Br)C3)c1	1799638700	KMGBXYAUYFZMCE-VWPFQQQWSA-N	425.323	1.990	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2nn(C)cc2c1	1799910673	QPIMRHNWGXCUSS-PTOXDTDZSA-N	449.349	1.808	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1CCN(C(C)C)CC1)C2	1800640253	NORSJKLFEAEYQI-XMTFNYHQSA-N	444.414	1.870	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CCC[C@@H](C(=O)OC)C1	1800964485	OOAFFUUKIATICE-BLONOQDTSA-N	428.957	1.963	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@H]1CCN(C(=O)c2cnc(O)[nH]2)[C@H]1c1cccnc1	1803013206	BDSYFSFNIKEPGY-KYOSRNDESA-N	436.310	1.861	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)Cn2cc(Cl)cn2)[C@H]1c1cccnc1)[C@H](O)CCl	1803137724	DFLNRJSENRRTCC-LXZKKBNFSA-N	426.304	1.237	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2[nH]nc3ccncc23)[C@@H]1c1cccnc1)[C@H](O)CCl	1803139301	NZSQWCJOFHSJTR-FDQGKXFDSA-N	428.880	1.272	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H](CNC(=O)CC(=O)NC)[C@@H]1c1cccnc1	1803483248	ULQYJLSSSLGAJR-KEYYUXOJSA-N	425.327	1.397	50	20	IDGD	
C[C@H](C#N)c1cccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)c1	1803678456	BMBHVVHHZALYLZ-ZHHJKBAOSA-N	431.301	1.559	50	20	IDGD	
Cc1cnc(C(=O)NC[C@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)s1	1805245105	RNWDGJZNQHMSAL-APWZRJJASA-N	444.561	1.539	50	20	IDGD	
CC(C)(C)CC(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1	1806306395	JFLUJGGWXHSLMY-UZLBHIALSA-N	438.532	1.836	50	20	IDGD	
Cc1ccc(CC(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)o1	1807368489	UINYVENRWMDMLH-CVDCTZTESA-N	447.300	1.225	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2ccc3nncn3c2)[C@H]1c1cccnc1	1809910286	GZULGIMGMVTEBK-HHXXYDBFSA-N	442.907	1.698	50	20	IDGD	
Cc1noc(C)c1CC(=O)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1	1809969410	VLCCTTCHRNBWOU-UHFFFAOYSA-N	439.321	1.059	50	20	IDGD	
Cc1ccc(C(=O)N2CCC3(CCCN(C(=O)c4cccc(B(O)O)c4)C3)CC2)cc1F	1809978062	SQKBNGBTIRMFOC-UHFFFAOYSA-N	438.308	1.973	50	20	IDGD	
Cc1cc(C(=O)N2CCC3(CCCN(C(=O)c4cccc(B(O)O)c4)C3)CC2)ccc1O	1809980160	LUPLNXDMSBJTTM-UHFFFAOYSA-N	436.317	1.539	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H](CNC(=O)c2c[nH]c(=O)cn2)[C@H]1c1cccnc1	1811446579	GBDOPOVZRRUPLQ-SUYBPPKGSA-N	448.321	1.516	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)NC[C@@H]1CCN(C(=O)CN)[C@H]1c1cccnc1	1812442461	XEOAVEHFLIBISS-DFOJPQRFSA-N	425.439	1.931	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)C23CC(C(=O)OC)(C2)C3)[C@H]1c1cccnc1	1812837920	NHNJVEXMYULUOL-XYOLMSGHSA-N	449.935	1.685	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2cnccc2F)[C@H]1c1cccnc1	1813070867	LRKUNOHLCFEUDD-IERDGZPVSA-N	442.495	1.308	50	20	IDGD	
NC(=O)c1nccnc1C(=O)N1CC[C@H](CNC(=O)C(Cl)Cl)[C@@H]1c1cccnc1	1813078201	GLNQECKPYAEVJM-RISCZKNCSA-N	437.287	1.094	50	20	IDGD	
COC(=O)NCC(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)CBr)[C@@H]1c1cccnc1	1813262102	CBXDNRXSQWARMZ-DUVNUKRYSA-N	441.326	1.474	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@H](CNC(=O)CCn2cncn2)[C@H]1c1cccnc1	1813318739	MWPHGFBEXSWGPJ-FXAWDEMLSA-N	430.585	1.621	50	20	IDGD	
CCC[C@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CN(C)C(=O)C(=O)O)[nH]n1	1815322000	GHTSVTILUKRPPP-WCQYABFASA-N	427.889	1.352	50	20	IDGD	
O=C(Cc1cccs1)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1	1815339950	WOAZEVBNOCWAOB-CQSZACIVSA-N	441.343	1.353	50	20	IDGD	
N[C@@H](Cc1cscn1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1	1817976136	MDCDTGSGRRMAGU-IACUBPJLSA-N	426.930	1.028	50	20	IDGD	
CCC(C)(C)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1	1819800105	LYFIUDHHSBZVRY-LLVKDONJSA-N	430.534	1.804	50	20	IDGD	
C[Si](C)(C)OCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)C(=O)Nc1cccnc1)CC2	1820165572	KCUFDVDKUCMXSB-GFCCVEGCSA-N	447.593	1.940	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)Cn2ccncc2=O)[nH]n1	1822188722	NBBLWUDEKYUUCX-YPMHNXCESA-N	437.298	1.442	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@](C)(O)C(F)(F)F)[nH]n1	1822410958	UBGIIMDEUYXQLK-YVEFUNNKSA-N	448.446	1.088	50	20	IDGD	
O=C(Cn1cccc([N+](=O)[O-])c1=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](F)Cl)CC2	1824720949	GIFNBOXTLULIPV-SDBXPKJASA-N	443.844	1.360	50	20	IDGD	
Cc1c(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)cnn1C	1826108081	ZOUUCFGYHUANFL-LJQANCHMSA-N	432.569	1.335	50	20	IDGD	
C[C@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H](F)Cl)CC1)[C@@H]1SC(=N)NC1=O	1827666595	BWRBPEQAANTPLY-GHYVTOPFSA-N	432.949	1.943	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)/C=C\C(=O)NC2CC2)CC1	1828794041	AEEPSPGQEZBQSU-OPDSQHBBSA-N	425.957	1.695	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)CNCP(=O)(O)O)CC1	1829102496	UBVSTFMJSGLXQD-MRXNPFEDSA-N	449.561	1.182	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc([N+](=O)[O-])o3)CCO2)C1	1829490439	VMQWYWCVVUTPES-BDJLRTHQSA-N	446.254	1.041	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CN2CCS(=O)(=O)CC2)CC1	1830303543	OEDPLNFAMPRVQA-ZWKOTPCHSA-N	448.029	1.354	50	20	IDGD	
CCn1nc(C)cc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830357847	MJWLMAFIEHVDIH-HXUWFJFHSA-N	426.945	1.546	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4nn[nH]c4c3)C2)C1	1830366680	TZKFIBYBACOQLC-HXUWFJFHSA-N	435.912	1.293	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)COc3ccc(O)cc3)C2)C1	1831639121	MHWJEATVGJNZSY-RXVVDRJESA-N	440.924	1.635	50	20	IDGD	
CC[C@H](NC(C)=O)C(=O)NC1CCN(C2CCN(C(=O)CO[Si](C)(C)C)CC2)CC1	1833098730	YFSWJKFSSYMWBH-IBGZPJMESA-N	440.661	1.324	50	20	IDGD	
CCOC(=O)/C=C/C(=O)N1CCC(N2CCC(NC(=O)C(C)(C)CCl)CC2)CC1	1833214219	NCAVOKJBZFDPCE-AATRIKPKSA-N	427.973	1.942	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cc4cccnn4c3)CC2)CC1)[C@@H](O)CCl	1833312433	VDZRGFJIJGOWHJ-IBGZPJMESA-N	433.940	1.119	50	20	IDGD	
Cc1ncc(C(=O)NC2CCN(C3CCN(C(=O)CCBr)CC3)CC2)cn1	1834064084	MJXYIRQESKARES-UHFFFAOYSA-N	438.370	1.755	50	20	IDGD	
CCn1nc(C)cc1C(=O)N1CCOC[C@@]2(CN(C(=O)CCBr)CCO2)C1	1834822605	XQMPXYPKXVYZBP-GOSISDBHSA-N	443.342	1.066	50	20	IDGD	
O=C([C@H](O)CCl)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CCC[C@@H]3CCCC[C@@H]31)CCO2	1836697299	KSGNXZQFCSETDC-FEEZOJJESA-N	442.984	1.649	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccn4cncc4c3)CCO2)C1	1837074673	YMPYSKYBCZKJOA-OAQYLSRUSA-N	434.924	1.669	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(F)cc(F)c3)C2)C1	1837714788	NOXHNHVKSCTMJS-HXUWFJFHSA-N	442.535	1.886	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(OC2CCN(C(=O)CCC#N)CC2)CC1	1837794003	XGSURXFYAQSTRW-PCLIKHOPSA-N	442.520	1.423	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCBr)C3)C2)c(C)n1C	1838382278	SKOWPRFUDCTUQL-LJQANCHMSA-N	442.354	1.497	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc([N+](=O)[O-])[nH]3)CCO2)C1	1838827505	RFBBHICPZSTAQW-DLBZAZTESA-N	449.291	1.229	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccnn3CC)C2)C1	1839963153	BICOKHCIYOZDQG-KBXCAEBGSA-N	443.342	1.147	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccccc3)C2)C1	1839966043	SMOZUSIYVZFSRL-QFBILLFUSA-N	425.323	1.930	50	20	IDGD	
CCOc1ccccc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840188923	LFRJSZVTZJKOPI-IBGZPJMESA-N	431.316	1.959	50	20	IDGD	
O=Cc1ccccc1-c1cncc(C(=O)N2CC3(CCCN3C(=O)[C@@H](O)CCl)C2)c1	1841353164	IDORMPMGNLEEIT-IBGZPJMESA-N	427.888	1.978	50	20	IDGD	
O=C([C@H](F)Br)N1CC2(CCCN2C(=O)[C@H]2CC(=O)N(C3CCCC3)C2)C1	1841859656	XWUVYJCISCHAFD-WFASDCNBSA-N	430.318	1.671	50	20	IDGD	
C[C@@H](C(=O)N1CC2(CCCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C1)n1ccnc1	1841924049	QEWXJPUFCBSPLW-GJZGRUSLSA-N	439.944	1.780	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)c2ccc(Cl)nc2Cl)C1	1844421992	RZLDRLJQONMZOZ-UHFFFAOYSA-N	434.088	1.199	50	20	IDGD	
CC(C)O[C@H](C)C(=O)N1CC2(CCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)C1	1845039012	UMGGRCDHQVSBCI-GOSISDBHSA-N	445.564	1.350	50	20	IDGD	
C[C@@H](NC(=O)c1ccccc1)C(=O)N1CC2(CCCN2C(=O)[C@H](F)Br)C1	1845220695	IQJKYYLOIVVZHV-OCCSQVGLSA-N	426.286	1.699	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC12CN(C(=O)C1=NN(c3ccccc3)C(=O)C1)C2	1846177121	YKNUDIICZQXDCX-CYBMUJFWSA-N	433.306	1.766	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1coc(C(C)C)n1	1848309302	XGYIMSNQGSUYMG-SWORYUBOSA-N	426.477	1.747	50	20	IDGD	
CCOC(=O)c1c(C)[nH]c(C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c1C	9158499	QPZDSJLVDHAKAI-UHFFFAOYSA-N	432.389	1.334	50	20	IDGD	
CCn1c(=O)c2ccccc2n(CC(=O)NNC(=O)CSc2ccc(Cl)cc2)c1=O	17185613	HBDIPNZRVJYJPZ-UHFFFAOYSA-N	446.916	1.776	50	20	IDGD	
Cc1cccc(-c2n[nH]c(=S)n2CC(=O)NNC(=O)c2n[nH]c(=O)c3ccccc23)c1	17195620	DRDZGENYKMTQDK-UHFFFAOYSA-N	435.469	1.614	50	20	IDGD	
COCCn1nc(C(=O)NNC(=O)COc2ccccc2Cc2ccccc2)ccc1=O	25416446	VBOFEBOLHNYVKG-UHFFFAOYSA-N	436.468	1.321	50	20	IDGD	
Cc1cc(Cl)ccc1O[C@@H](C)C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	104497432	BACIVKZLXHDQOZ-SCLBCKFNSA-N	448.859	1.946	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=S)NCC(=O)NC(C)C)c2ccccc2c1=O	727271665	ZRZQRKBHGOKYKY-UHFFFAOYSA-N	432.550	1.220	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)[C@H](c1ccccc1)N1CCN(C)CC1	727765414	ZULIOJSUGAQZRH-QFIPXVFZSA-N	426.517	1.600	50	20	IDGD	
Cc1cc(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)n2nc(C)cc2n1	728215578	GXUMCZUBYIBZIT-UHFFFAOYSA-N	443.533	1.039	50	20	IDGD	
CC1CCC(NC(=O)CN2CCN(CC(=O)NNC(=O)c3cccc(Cl)c3)CC2)CC1	728293982	SXKDXNDRVGPILC-UHFFFAOYSA-N	449.983	1.414	50	20	IDGD	
C#CCNC(=O)CN1CCN(C(=O)/C(C#N)=C\c2cc(C)n([C@H](C)COC)c2C)CC1	728533515	LUVIXAWMLKTGFY-LZAZYHHXSA-N	425.533	1.113	50	20	IDGD	
CCOC(=O)C1=NN(c2ccccc2)[C@H](C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)C1	728712703	BJQTUGJZEOYCFN-KRWDZBQOSA-N	425.401	1.554	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CCNS(=O)(=O)c2ccc3c(c2)CCCC3)c1	728873180	UZVYYXZAICCVBZ-UHFFFAOYSA-N	426.498	1.567	50	20	IDGD	
O=C(CCCS(=O)(=O)N1CCCC1)NNc1ccc(S(=O)(=O)C(F)F)cc1	728972845	TVMLBYNGAYSJSR-UHFFFAOYSA-N	425.479	1.332	50	20	IDGD	
Cc1nc2[nH]n(C)c(=O)c2c(C)c1CCC(=O)NNC(=O)[C@@H](C)Oc1ccccc1F	729282822	JYQNCFQMIMIWLR-CYBMUJFWSA-N	429.452	1.565	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)CC1(CC(=O)NNC(=O)c2cccn2C)CCCCC1	729838082	PMIKNXQRHZEVKU-UHFFFAOYSA-N	442.520	1.317	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=O)CCc2ccccc2O)ccc1OC	730034044	OJRSZDUMDJDCNB-UHFFFAOYSA-N	449.529	1.825	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@@H]2C(=O)NNC(=O)COc2ccccc2O)c(OC)c1	730777817	DRSXHPKHZLYFJS-MRXNPFEDSA-N	443.456	1.240	50	20	IDGD	
O=C(CN1CCCN(C(=O)CC2CCCC2)CC1)NNC(=O)c1cccc([N+](=O)[O-])c1	730808208	DCYSRZJDRTUYJI-UHFFFAOYSA-N	431.493	1.470	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)N1CCN(Cc2nc(O)c3c4c(sc3n2)CCCC4)CC1	732197005	JKZCUKGCNQFMHE-ZDUSSCGKSA-N	446.577	1.339	50	20	IDGD	
CCc1nc(C(=O)NNC(=O)CCN2C[C@H](C)O[C@@H](C)C2)nn1-c1ccccc1Cl	732263441	MPUKIBHKRQWWKH-KBPBESRZSA-N	434.928	1.743	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CN2CCN([C@H]3CCN(c4ccccc4)C3=O)CC2)cc1	732985245	MRUXUHVGRABHRP-NRFANRHFSA-N	435.528	1.179	50	20	IDGD	
CCOCCCn1c(NNC(=O)[C@H]2CCCN(C(=O)C3CC3)C2)nc2ccccc2c1=O	733268046	HYQSDOYXINZWLE-KRWDZBQOSA-N	441.532	1.915	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2c(C)nn(C(C)C)c2C)cc(OC)c1OC	734414123	ASCWKRUVNOIFLQ-UHFFFAOYSA-N	426.495	1.730	50	20	IDGD	
COCCOc1ncccc1C(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	734824486	ADDDJDACGBFLTF-UHFFFAOYSA-N	437.497	1.450	50	20	IDGD	
COc1ccc2c(c1)C[C@@H](C(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1)CO2	734825335	YWLBZKOGUJZRLK-OAHLLOKOSA-N	448.520	1.976	50	20	IDGD	
Cn1cc(C(=O)NNS(=O)(=O)c2csc(-c3cccc(Br)c3)n2)cn1	735462840	XIBCPSNEDKWSGF-UHFFFAOYSA-N	442.320	1.929	50	20	IDGD	
CCCn1c(C)cc(/C=C(/C#N)C(=O)N[C@H]2CC(=O)N(CCN3CCOCC3)C2)c1C	735822632	FYRGBHULZNRNFI-MSTPFNHUSA-N	427.549	1.471	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)c2sccc2NS(C)(=O)=O)cc1C	736791039	VFKPEEAKPYBUBB-UHFFFAOYSA-N	445.544	1.670	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)[C@H]1CCN(c2ccc3c(c2)OCCO3)C1=O	737927409	VXFPMGCUNVDVJE-QGZVFWFLSA-N	425.441	1.175	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)N[C@@H](C)c2cn(C)nc2C)c2ccccc2c1=O	739035907	YQPFXXHZWNQMOJ-ZDUSSCGKSA-N	425.493	1.944	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1NC(=O)NC(C)(C)C	740814149	KCHXSGBKPDPGTM-UHFFFAOYSA-N	436.476	1.966	50	20	IDGD	
CCOc1c(Br)cc(C(=O)NNC(=O)C(=O)NC(CC)CC)cc1OC	740851292	XVWMIFBDWOMVTH-UHFFFAOYSA-N	430.299	1.922	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CNC(=O)NNC(=O)CNC(=O)c1ccco1)c1ccccc1	743578626	YATVTSXRIHSAFP-HNNXBMFYSA-N	445.476	1.606	50	20	IDGD	
CCc1nsc(N2CCN(C(=O)NNC(=O)c3cnn(-c4ccccc4)c3)CC2)n1	743609078	MLSIEWLEUGVPFK-UHFFFAOYSA-N	426.506	1.463	50	20	IDGD	
O=C(NNC(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2)c1cc(Br)ccc1O	743730057	MIYFGPVLXMEXOE-UHFFFAOYSA-N	438.190	1.909	50	20	IDGD	
O=C(CSC[C@@H]1CCCCO1)NNc1ccccc1S(=O)(=O)N1CCOCC1	744620015	DSNBGPLYKHTIRV-HNNXBMFYSA-N	429.564	1.453	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)O[C@@H](C)C(=O)N2CCN(c3ncccn3)CC2)cc(C#N)n1C	744632863	QGGCZIOIXGWPND-GYXHFJGISA-N	433.472	1.183	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)c2ccc(S(=O)(=O)NC(C)(C)C)o2)c1	744719002	PLUKBHNZKIIULP-UHFFFAOYSA-N	437.474	1.283	50	20	IDGD	
CCn1c(=O)c2ccccc2n(CC(=O)NNC(=S)Nc2cc(C)ccc2F)c1=O	745195794	QMRIBRYSTPKERI-UHFFFAOYSA-N	429.477	1.648	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2ccc(Cl)cc2F)cc(OC)c1OCC(N)=O	747329781	QYGSBDJVGXLBMY-UHFFFAOYSA-N	425.800	1.435	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2ccc(C(=O)NNC(=O)Cc3ccncc3)cc2)cc1	747428060	BJHLCFPVRBOPIJ-UHFFFAOYSA-N	440.481	1.895	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)NCc2cccc(CS(C)(=O)=O)c2)cc1	749192586	RGBMICIEBGMYLL-OAHLLOKOSA-N	449.529	1.928	50	20	IDGD	
CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)NNC(=O)Cc1cn2ccccc2n1	749417372	WSBFZACGRBDHTF-IBGZPJMESA-N	436.447	1.392	50	20	IDGD	
NC(=O)[C@@H]1CC(C(=O)NNc2nc(Br)cn3ccnc23)=NN1c1ccccc1	750247829	UXXQRUJWWISKNL-LBPRGKRZSA-N	443.265	1.055	50	20	IDGD	
NS(=O)(=O)c1cc(Cl)c(F)c(C(=O)NNC(=O)NCc2ccc(Cl)cc2)c1	752298421	CWVGXODGIYTOHT-UHFFFAOYSA-N	435.264	1.924	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)NC[C@@H]2CCC[C@@]23NC(=O)N(C)C3=O)c1C	752726580	WFECILJKZYOGMC-QZOUUAOOSA-N	427.505	1.495	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N[C@H](C)C[S@](C)=O)cc1	753149696	BXHBFYGABPRFMJ-WDQHICRSSA-N	443.529	1.224	50	20	IDGD	
COC(=O)c1cc2c(cc1NC(=O)C(=O)NNC(=O)c1ccc(Cl)cc1F)OCO2	753842233	ZZRZMQJTZWSFQI-UHFFFAOYSA-N	437.767	1.394	50	20	IDGD	
COc1c(C)c2c(c(O)c1C/C=C(\C)CCC(=O)NNC(=O)Cc1cc[nH]n1)C(=O)OC2	755260989	HNTZJMFRLLOVJD-UUILKARUSA-N	442.472	1.762	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)c1coc(S(=O)(=O)N(C)C)c1	755408886	BEJDKEKNMWVBJZ-ZDUSSCGKSA-N	431.470	1.912	50	20	IDGD	
CCC(=O)NNC(=O)Nc1cc(S(=O)(=O)N(CC)CC)ccc1N1CCN(C)CC1	755440907	PXIHRPLRJUVESJ-UHFFFAOYSA-N	440.570	1.032	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccccc2N2CCCC2=O)c1	755552495	ZKZULNAGJFRDEG-UHFFFAOYSA-N	445.501	1.530	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)[C@@H]1CCC(=O)N1Cc1ccc(Br)cc1	755719186	DANOZRQMYXOFIY-FZMZJTMJSA-N	440.294	1.429	50	20	IDGD	
COC(=O)CNC(=O)Cc1ccc(NC(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)cc1	755863515	MTDAWSJAXZGQEJ-CYBMUJFWSA-N	446.435	1.278	50	20	IDGD	
Cc1nc(CC(C)C)c(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)s1	756548933	YNFPHUOAJOWKJE-MRXNPFEDSA-N	433.486	1.794	50	20	IDGD	
CNC(=O)Cn1ccc2ccc(NC(=O)NNC(=O)c3nnc(O)c4ccccc34)cc21	756762868	SGAHFYTYSMZBQG-UHFFFAOYSA-N	433.428	1.503	50	20	IDGD	
CCOC(=O)Cn1cccc(NC(=O)NNC(=O)COc2ccc(C(C)(C)C)cc2)c1=O	757764018	OOPNIAHYBLKCOD-UHFFFAOYSA-N	444.488	1.941	50	20	IDGD	
COC(=O)C[C@H](C)C(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	758363283	WSZPVCCVGSZSJO-AWEZNQCLSA-N	433.486	1.125	50	20	IDGD	
C[C@@H]1CC[C@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)C[C@H]1C	758717666	GRFCKRQKXOWOII-INMHGKMJSA-N	438.550	1.476	50	20	IDGD	
CCOC(=O)N1CCC[C@H](C(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)C1	758781756	GSFZGIWNRARXLA-HNNXBMFYSA-N	441.529	1.491	50	20	IDGD	
Cc1cccc(-n2cc(C(=O)NN(C)C(=O)N3CCN(C(=O)OC(C)(C)C)CC3)nn2)c1	758787587	SUXIONQWSFUOIT-UHFFFAOYSA-N	443.508	1.825	50	20	IDGD	
O=C(NNC(=O)/C(=C/c1cccnc1)NC(=O)c1ccccc1)C(=O)Nc1ccccn1	758839299	CEHFGJMVYPWMCA-LGMDPLHJSA-N	430.424	1.034	50	20	IDGD	
CCCc1nc(C(=O)NNC(=O)C(=O)Nc2ccccn2)nn1-c1ccccc1Cl	758839648	PKJNMDWGTOQANF-UHFFFAOYSA-N	427.852	1.668	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)c1ccccc1F)C(=O)NNc1ncccc1[N+](=O)[O-]	759290810	NJDARCYZLSUQBR-LBPRGKRZSA-N	443.482	1.672	50	20	IDGD	
CC1(Cn2cc(C(=O)NNC(=O)COc3ccc(-c4ccc(C#N)cc4)cc3)nn2)COC1	759373444	COSVLYRFFYJTCD-UHFFFAOYSA-N	446.467	1.693	50	20	IDGD	
CCc1cc(C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)c(C)nn1	759392750	QFNOYBAOSOVCFG-UHFFFAOYSA-N	430.940	1.580	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2cc(Br)ccc2F)n1	761175462	MQGAZTPVLDQBHN-UHFFFAOYSA-N	430.255	1.900	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)c1ccncc1Br	763113460	ILZLAARSGJALCB-UHFFFAOYSA-N	432.322	1.817	50	20	IDGD	
CC(=NNC(=O)c1nn(-c2ccccc2)cc1O)c1c(C)nn(CCS(C)(=O)=O)c1C	763138892	KXOWAIMQECCGSB-UHFFFAOYSA-N	444.517	1.590	50	20	IDGD	
Cc1ccc(C(=O)N2CCSCC2)cc1NC(=O)C(=O)NNC(=O)c1ccccc1O	763525505	CHJJHTQWAOSRSN-UHFFFAOYSA-N	442.497	1.289	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccnn2-c2ccc(Cl)cc2)cc1OC	763544459	YBFMTJPYWZNILF-UHFFFAOYSA-N	443.847	1.943	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c(OC)cc1Cl	763570349	DQAAZTZZSLGRQQ-INIZCTEOSA-N	435.820	1.283	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cccc(N3CCOC3=O)c2)c2ccccc2n1	763617003	QYPUQSJWCVHJLX-UHFFFAOYSA-N	433.424	1.900	50	20	IDGD	
COc1cc2nc(C)sc2cc1NC(=O)C(=O)NNC(=O)c1c(C)nc2ccccn12	763630123	WRRXUFQQAFEANW-UHFFFAOYSA-N	438.469	1.969	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)N[C@H]2CCCC[C@H]2N2CCOCC2)cc1	763656590	OQHQOIQGNFCRQL-DLBZAZTESA-N	439.538	1.069	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(F)c(N2CCCC2)c(F)c1	763663633	MDJPOHISAPINHW-UHFFFAOYSA-N	448.426	1.739	50	20	IDGD	
COC(=O)[C@@H](C)Cc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C)c(C)c2)cc1	763679177	HUDHNCVTRIUJIQ-INIZCTEOSA-N	441.484	1.820	50	20	IDGD	
Cc1ccc(-c2nnco2)cc1NC(=O)C(=O)NNC(=O)COc1ccc(Cl)cc1	763686044	JOAJLYTWKUZJPS-UHFFFAOYSA-N	429.820	1.863	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc2c(cc1F)CCC(=O)N2	763716161	AFKCJOFAODVLHE-UHFFFAOYSA-N	428.420	1.438	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccn(CCC(C)C)n2)cc1	763872577	OQCKRZSSOIAKJF-HNNXBMFYSA-N	429.477	1.685	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)Cc3ccc(F)cc3)cc2F)C[C@H](C)O1	763918379	GCRSQRCQGYIQFM-KBPBESRZSA-N	446.454	1.907	50	20	IDGD	
Cc1cc(Br)ncc1NC(=O)C(=O)NNC(=O)c1cc(Br)c[nH]1	763999939	XXIIHACWGIJJJG-UHFFFAOYSA-N	445.071	1.643	50	20	IDGD	
COC(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)CCc2ccc(OC)cc2)c1	764124681	NTWUBVVBNALIMI-UHFFFAOYSA-N	433.848	1.854	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2nn(-c3ccc(C#N)cn3)cc2C)cc1	764132772	XMHMBMZMAJMHJG-UHFFFAOYSA-N	447.455	1.175	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(OCCN3CCCCC3)cc2)c1	764234782	IYSPVHVVFVLFAQ-UHFFFAOYSA-N	435.484	1.823	50	20	IDGD	
CCOC(=O)c1cc(-c2ccccc2)ccc1NC(=O)C(=O)NNC(=O)Cc1cc[nH]n1	764297304	NSNSPDPWKCATLE-UHFFFAOYSA-N	435.440	1.582	50	20	IDGD	
CS(=O)(=O)c1cccc(Oc2ccc(NC(=O)C(=O)NNC(=O)C3CCC3)cc2)c1	764339778	YPDDBFKGQWGGCJ-UHFFFAOYSA-N	431.470	1.768	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)c(Cl)c1)C(=O)Nc1cc(N2CCCC2=O)ccc1F	764349558	OODXIKOWJAFYKL-UHFFFAOYSA-N	434.811	1.711	50	20	IDGD	
O=C(CO)NNC(=O)C(=O)Nc1ccccc1OCc1ncc(-c2cccc(Cl)c2)o1	764421617	PJHUBKMYIUTVAN-UHFFFAOYSA-N	444.831	1.652	50	20	IDGD	
COc1nccnc1NNC(=O)C1CCN(S(=O)(=O)c2cc(F)ccc2F)CC1	764483543	DDGXDNATORMWJE-UHFFFAOYSA-N	427.433	1.307	50	20	IDGD	
CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	765369220	OTIAVOAQQZUDJJ-HNNXBMFYSA-N	448.501	1.875	50	20	IDGD	
CCc1noc(CC)c1CC(=O)NNC(=O)CN1CCN(Cc2ccc(C)cc2)CC1	765753284	DFJQLAYFQRLYGV-UHFFFAOYSA-N	427.549	1.616	50	20	IDGD	
COC(=O)c1nccc2c(S(=O)(=O)NNC(=O)[C@H]3COc4ccccc4O3)cccc12	766308951	TYKPJIWJTZGSAZ-MRXNPFEDSA-N	443.437	1.171	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)[C@@H]2C[C@H]2c2cc(F)c(F)c(F)c2)n1	766781346	OKNBRRPQDHGXEJ-WDEREUQCSA-N	427.404	1.906	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)CCC(=O)N2CCN(c3ccccn3)CC2)n1	768244149	OUWFXWOXGWWKLF-UHFFFAOYSA-N	426.525	1.290	50	20	IDGD	
CC(C)[C@H](NC(=O)OC(C)(C)C)C(=O)NCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	768268019	GUCMARQJGRBVMI-HNNXBMFYSA-N	437.453	1.021	50	20	IDGD	
Cc1cccc(-c2nnc(SCC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)n2N)c1	768440425	ZYGOTGGEWAFCFR-UHFFFAOYSA-N	427.446	1.429	50	20	IDGD	
CSCC[C@@H](NC(=O)c1ccc([N+](=O)[O-])o1)C(=O)NNC(=S)Nc1ccccn1	768580057	DHCOCWNCEIEGPN-SNVBAGLBSA-N	438.491	1.452	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1cc(C(F)(F)F)ccc1Br	770258122	RZEDKECAUSSUIK-SSDOTTSWSA-N	429.214	1.664	50	20	IDGD	
Cn1cnn(-c2ccc(NC(=O)C(=O)NNc3ccc(Br)c(F)c3)cc2)c1=O	770815303	FQCMAPGXTTWVGW-UHFFFAOYSA-N	449.240	1.554	50	20	IDGD	
CC(C)CNC(=O)N1CCC[C@H](C(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)C1	770965741	LUYZGIGRQQYFIJ-ZDUSSCGKSA-N	432.529	1.808	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NNC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc23)C1	773411028	HUKIPHOQXXHDQC-LLVKDONJSA-N	432.437	1.879	50	20	IDGD	
N#Cc1ccc(NNC(=O)C(=O)Nc2ccc3c(ccn3CC(=O)N3CCOCC3)c2)cc1	773702179	PNGYVBOPIZNRSN-UHFFFAOYSA-N	446.467	1.454	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)NCCc2cncn2C)cc1	773823007	HKQVMKSWQXMWGL-BOPFTXTBSA-N	447.499	1.433	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)Cn1c(S)nc2ccccc2c1=O	774905734	RFFDYJXUPNMDIH-LLVKDONJSA-N	432.889	1.954	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccccc1S(=O)(=O)N1CCCC1)c1ccccc1F	775251373	PKZYGURYFFFWOV-UHFFFAOYSA-N	427.479	1.234	50	20	IDGD	
COC(=O)[C@H]1CCC[C@@H](C(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)C1	776204855	HCELMJVPEBGHAG-CABCVRRESA-N	426.514	1.602	50	20	IDGD	
COc1cccc(C[C@H](C(=O)NNc2cccc(S(C)(=O)=O)c2)n2nnnc2C)c1	776720566	DCYPHRMPDLQBPW-GOSISDBHSA-N	430.490	1.321	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)[C@]1(F)CCN(C(=O)OCc2ccccc2)C1	776873048	LVJZLHSQKGFCQU-FQEVSTJZSA-N	448.476	1.376	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)NCc1cccc(NC(=O)[C@H]2CCCO2)c1	778628415	YQYYHTGZIKQYOB-OAHLLOKOSA-N	435.481	1.159	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)N1CCN([C@@H]2CCCN(Cc3ccccc3)C2=O)CC1	780314664	KDMYWWPOKWAMAW-PZJWPPBQSA-N	443.592	1.377	50	20	IDGD	
Cn1cc(CCNC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c2ccc(Cl)cc21	780716515	VZYMAJCVKLWZBJ-UHFFFAOYSA-N	438.879	1.994	50	20	IDGD	
COC(=O)c1ccccc1NNC(=O)c1cc(S(=O)(=O)N2CCC[C@H](C)C2)cn1C	780739762	QXCJYQVLIJOBMW-AWEZNQCLSA-N	434.518	1.989	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@@H]3CCC(=O)[C@@H](C)C3(C)C)CC2)cc1	780927066	QNDWPZSHWAKLAZ-QUCCMNQESA-N	428.577	1.901	50	20	IDGD	
Cc1ccc(S(=O)(=O)NC[C@H]2CCCN(S(=O)(=O)CBr)C2)cc1	782432763	MRSVXYBGKITUHD-CYBMUJFWSA-N	425.370	1.668	50	20	IDGD	
CC(C)Sc1ccccc1NC(=O)C(=O)NNC(=O)c1csc(N2CCOCC2)n1	782897006	LFGOUJYHUDXGRH-UHFFFAOYSA-N	449.558	1.880	50	20	IDGD	
CS(=O)(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2Cl)c1	782924338	BGXWSKGPGRVOQX-UHFFFAOYSA-N	444.296	1.938	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)c2cc(Br)c(F)cc2N)c1	783213325	BSUXBIDJBFPSFU-UHFFFAOYSA-N	435.209	1.660	50	20	IDGD	
CC[C@@H](C)NS(=O)(=O)c1cccc(NC(=O)C(=O)NNc2cncc(Cl)n2)c1	783260047	UQFHVJSXCVVQFM-SNVBAGLBSA-N	426.886	1.289	50	20	IDGD	
O=C(NNc1ccc(-n2cccn2)nn1)C(=O)Nc1cc(F)ccc1OC[C@H]1CCCO1	783432824	FGCMYILSCMYUAE-CQSZACIVSA-N	441.423	1.441	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)nn1[C@@H](C)C1CC1	784214471	YCOQYGQPRFWWHP-ZDUSSCGKSA-N	446.533	1.685	50	20	IDGD	
CCc1ccc(NC(=O)C(=O)NNc2ccc(OC(F)F)cc2)cc1S(N)(=O)=O	784310188	YMFSOEDYPADMCC-UHFFFAOYSA-N	428.417	1.580	50	20	IDGD	
COC(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)c1	785067167	HUCJXJWSTKGFEA-UHFFFAOYSA-N	429.820	1.103	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)C(=O)Nc1ccnn1Cc1ccccc1F	785068224	WIJYUSYLRYQDRS-UHFFFAOYSA-N	435.419	1.047	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNc2nccn(C)c2=O)sc2c1CC[C@@H](CC)C2	785090725	XSFYVVBTSROLET-LLVKDONJSA-N	447.517	1.615	50	20	IDGD	
COc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)C(=O)NNc1ccc(Cl)c(F)c1	785180497	YPNSETBTWFFAOU-UHFFFAOYSA-N	444.872	1.820	50	20	IDGD	
Cc1cc([C@H](CC(=O)NNC(=O)C(=O)NC(C)C)NC(=O)OC(C)(C)C)cc(Cl)n1	788495900	RKSLTPBIQZSZII-ZDUSSCGKSA-N	441.916	1.671	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)c1ccc2c(=O)n(CC)c(S)nc2c1	788812976	USRRMCNWQYVMHZ-UHFFFAOYSA-N	442.497	1.944	50	20	IDGD	
CS(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)c1	789852825	UTGPOXQGYDKXEJ-UHFFFAOYSA-N	434.861	1.710	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)ccc1C(F)(F)F	790956281	FGXCGNASEWDRBW-OAHLLOKOSA-N	439.346	1.640	50	20	IDGD	
CC[C@H](C)CC[C@@H](O)CC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	793710419	LVQVFTFGMABFNQ-FUHWJXTLSA-N	426.583	1.643	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)c1ccc(F)c(NS(C)(=O)=O)c1	795152859	WMMGZEUTHFXZIJ-UHFFFAOYSA-N	430.483	1.204	50	20	IDGD	
O=C(CNC(=O)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1)NCC(F)F	796535629	LICCOHJOXGUDML-SFHVURJKSA-N	445.470	1.325	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)N1CC[C@H](N2CCN(C(=O)OC(C)(C)C)CC2)C1	796616147	UFGUCRCCJCLUQS-IRXDYDNUSA-N	425.574	1.195	50	20	IDGD	
COC(=O)c1cc(F)cc(NC(=O)C(=O)NNc2ccc(Br)nc2)c1F	797077566	ORNVAQFNTXPWCZ-UHFFFAOYSA-N	429.177	1.991	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2cc(Cl)ccc2OC[C@@H]2CCOC2)n1	797370229	WVJDEGPMNMSAJL-CYBMUJFWSA-N	432.864	1.858	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2cccc(CNC(=O)OC(C)(C)C)c2)n1	797370282	JGHSBBFKHGDPSE-UHFFFAOYSA-N	427.461	1.814	50	20	IDGD	
Cc1noc(C)c1C(C)(C)C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	797742406	GZXZQFYKBAGUMJ-UHFFFAOYSA-N	427.505	1.174	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@H]2C(=O)NNC(=O)c2cc(OC)cc(OC)c2)cc1	798351889	GKXZOSJPUMVLRL-IBGZPJMESA-N	427.457	1.778	50	20	IDGD	
CN(NC(=O)c1ccc(I)c(I)c1)C(N)=O	798987494	XKJYRZBSSLMIQG-UHFFFAOYSA-N	444.998	1.551	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2ccccc2Oc2cnn(C)c2)n1	801465920	YDKUBOOGCMBHRQ-UHFFFAOYSA-N	429.458	1.524	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)CCC(=O)N2CCN(c3ccccn3)CC2)cc1	802056259	GZVYPKUMJLODIM-UHFFFAOYSA-N	426.477	1.372	50	20	IDGD	
CC1CCC(N2C[C@@H](C(=O)NNC(=O)Nc3ccc(S(C)(=O)=O)cc3)CC2=O)CC1	802067977	UDTYBISMCSNPKS-BBBYJDLNSA-N	436.534	1.670	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)N[C@H]2CCCN(C(=O)Cc3ccccc3)C2)c1	802476782	GBMUNGGZACRVNE-SFHVURJKSA-N	440.500	1.882	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)N[C@H](C)CCNS(=O)(=O)c1ccccc1	802527510	GOCVFNHBCOCWTM-MRXNPFEDSA-N	448.545	1.715	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)/C(=C/c1cccnc1)NC(=O)c1ccccc1	804958953	TYFJCFSFPPMBKD-AQTBWJFISA-N	426.440	1.972	50	20	IDGD	
COCc1csc(NC(=O)C(=O)NNC(=O)c2ccc(COc3ccccc3)o2)n1	806975927	VDIUEVYWJHDWSD-UHFFFAOYSA-N	430.442	1.861	50	20	IDGD	
CCOC(=O)c1c(C2CC2)csc1NC(=O)C(=O)NNc1ccc(-n2ccnc2)nn1	807429797	XPJYQDMDPWGKEC-UHFFFAOYSA-N	441.473	1.860	50	20	IDGD	
CCCN1CCC[C@H]1CNC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	807549393	XVOUNYAHLPUHIO-KRWDZBQOSA-N	437.566	1.290	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2ccc(Cl)nn2)c(C(=O)NCC(F)(F)F)cc1F	810382395	CTEXBTNNFKSRQB-UHFFFAOYSA-N	448.764	1.951	50	20	IDGD	
COC(=O)c1c(F)ccc(NC(=O)C(=O)NNC(=O)c2ccc(OC)cc2OC)c1F	810387243	MJOYLKSDRXNGCG-UHFFFAOYSA-N	437.355	1.168	50	20	IDGD	
Cc1cc(C)c(C)c(S(=O)(=O)NCC(=O)NNC(=O)COCc2ccccc2)c1C	810423396	AKCWUWZTCNSHBA-UHFFFAOYSA-N	433.530	1.563	50	20	IDGD	
COCc1nc(CNC(=O)NNC(=O)COc2ccc(Br)cc2)cs1	811949072	OLYHUBGQPGZKNV-UHFFFAOYSA-N	429.296	1.961	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NC[C@@H]2COc3ccccc32)cc1	812443961	TXDYTBVCZKLAPB-OAHLLOKOSA-N	432.502	1.122	50	20	IDGD	
COCCOCc1ccc(C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1	812452342	GAJQWVIGDMWFLB-UHFFFAOYSA-N	449.529	1.240	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2cn(C)nn2)c1	813010514	RVDKZTMPGAAWTH-UHFFFAOYSA-N	445.461	1.091	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NC[C@@H]2CCN(c3ccccc3F)C2)c2ccccc2c1=O	813207212	GKAFWSXGWQSBFU-AWEZNQCLSA-N	438.463	1.543	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)Nc1ccc(CCN2CCOCC2)cc1	814618932	ITKCFFPYPDUFJZ-UHFFFAOYSA-N	447.561	1.960	50	20	IDGD	
O=C(COC(=O)[C@H]1CCCCN1C1CCCC1)NNC(=O)[C@@H]1COc2ccccc2O1	815444969	PEAHCBZVRXJVSO-APWZRJJASA-N	431.489	1.314	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(C#N)cn2)ccc1OCCC(C)C	815567359	VSAJDDAMNFAPCU-UHFFFAOYSA-N	425.445	1.786	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCc2nn[nH]c21)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	816831394	QORNBYYWYZZQGI-KRWDZBQOSA-N	443.471	1.388	50	20	IDGD	
CC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)OCC(=O)NNC(=O)c1cccs1	848952209	SWXYYUBVZIBSSI-MRXNPFEDSA-N	428.470	1.281	50	20	IDGD	
CC(C)c1ccccc1OCC(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	849188694	QDPXMOGYEWZJQX-IBGZPJMESA-N	428.441	1.719	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)c1cc(F)cc(N2CCOCC2)c1	857479383	KLOURYGYZRTLTF-UHFFFAOYSA-N	434.855	1.393	50	20	IDGD	
O=C(CSc1nnc(-c2ccccc2)n1-c1ccccc1)NNC(=O)[C@@H]1CCC(=O)N1	864013360	QTUOJBLHOIGOKO-INIZCTEOSA-N	436.497	1.452	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)COc2ccc(F)c(Cl)c2)c1	906374277	GNSPYKIVKFZVSY-UHFFFAOYSA-N	429.857	1.569	50	20	IDGD	
COc1ccc([C@]2(C)NC(=O)N(NC(=O)/C(C#N)=C/c3cc(C#N)n(C)c3C)C2=O)cc1	906491631	JYXXNNBLSOLJLE-OZOJFGJPSA-N	432.440	1.619	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccccc1	910836541	ICVBJXWNFMOQHQ-SFHVURJKSA-N	435.477	1.595	50	20	IDGD	
O=C(NNc1ncccn1)c1cccc(NS(=O)(=O)c2ccc3c(c2)OCCO3)c1	913044365	RSXCWJIJCMRXJG-UHFFFAOYSA-N	427.442	1.806	50	20	IDGD	
O=C(CN1CCCN(C(=O)c2ccc(F)cc2)CC1)NNC(=O)c1cccc([N+](=O)[O-])c1	913146700	KVNAKDQKDPSDEL-UHFFFAOYSA-N	443.435	1.343	50	20	IDGD	
Cn1c(=NNC(=O)C2CCN(S(=O)(=O)c3cccnc3)CC2)sc2ccccc21	914829830	YRWYXXGDUQTSAU-UHFFFAOYSA-N	431.543	1.668	50	20	IDGD	
COc1ccccc1NC(=S)NNC(=O)[C@@H]1CS[C@@H](Cc2ccccc2F)C(=O)N1	915599083	QKWDRPUPTJUXBX-RDJZCZTQSA-N	448.545	1.995	50	20	IDGD	
Cc1nn([C@@H]2CCS(=O)(=O)C2)c(C)c1C=NNC(=O)[C@H](C)CN1C[C@@H](C)O[C@H](C)C1	917028278	DHOZTIUIMMIZKM-ATNYBXOESA-N	439.582	1.055	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)c2ccnc(-n3cncn3)c2)cc(OCC)c1OCC	917500924	AQLGKEQBQDLGBC-UHFFFAOYSA-N	440.460	1.933	50	20	IDGD	
O=C(CCSc1ccc(F)cc1)NNC(=O)CNC(=O)c1c[nH]c2ccccc2c1=O	917923147	OLLOJCBHJARWHI-UHFFFAOYSA-N	442.472	1.727	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)NC1CCN(Cc2ccncc2)CC1	918226750	OWGZWBWOWHKBEP-UHFFFAOYSA-N	427.505	1.854	50	20	IDGD	
CC(C)Oc1ccc(NS(=O)(=O)CC(=O)NNC(=O)COc2ccc(C#N)cc2)cc1	918399192	KQXBLFLBBVLTDP-UHFFFAOYSA-N	446.485	1.314	50	20	IDGD	
Cc1nn(C)c(C)c1-c1cc(C(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)n[nH]1	919323298	QIINBQJCNOQGAO-UHFFFAOYSA-N	430.852	1.698	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1	919912080	XXDKPYBZGBYNDC-GOSISDBHSA-N	439.516	1.470	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)N[C@@H](C)CN2C[C@@H](C)C[C@@H](C)C2)nc1	919923917	BKLKGUHUNGXAFU-XHSDSOJGSA-N	426.587	1.761	50	20	IDGD	
O=C(NCCc1cccs1)NNC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccccc1	920861740	IRVFZIAJNJJSOF-QGZVFWFLSA-N	436.559	1.864	50	20	IDGD	
COC(=O)c1cc(NC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc(C(=O)OC)c1	920932613	SNYZUDFBWDMRQQ-INIZCTEOSA-N	429.385	1.253	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN(C(=O)COc2ccccc2)C1)c1cncn1-c1ccccc1	1116125823	METXIBLJSQILMQ-SFHVURJKSA-N	447.495	1.951	50	20	IDGD	
CCc1ccc([C@@H](NC(=O)NNC(=O)C(=O)OC)c2cccc(S(C)(=O)=O)c2)cc1	1116186817	GVNDMPRDXCRSRP-QGZVFWFLSA-N	433.486	1.245	50	20	IDGD	
C[C@H]1CCc2nc(NC(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)sc2C1	1116587186	JMUUMSJJMVJXIQ-NSHDSACASA-N	437.547	1.985	50	20	IDGD	
CC(=O)N1C[C@H]2[C@@H](NC(=O)NNC(=O)Nc3ccc(S(C)(=O)=O)cc3)CCC[C@H]2C1	1117497572	UQTSMIKDQWALFV-XKQJLSEDSA-N	437.522	1.073	50	20	IDGD	
CC[C@]1(C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)CCN(C(=O)OC(C)(C)C)C1	1319982146	PZZWHJAIKHTOPX-FQEVSTJZSA-N	439.534	1.888	50	20	IDGD	
CN(C)Cc1cc(C(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)no1	1342081307	AFUBIPJKZSZGFC-UHFFFAOYSA-N	446.471	1.513	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4nccn4c3)C2)C1	1778011834	PVUJEFRKYQQFID-KUHUBIRLSA-N	435.322	1.809	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc4cnccc4nc3C)C2)C1	1778441488	RRSQDNRQTMPWJF-UTKZUKDTSA-N	432.908	1.636	50	20	IDGD	
C[C@H](Cn1ccnc1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CO[Si](C)(C)C)C1	1779545901	QBYGLACFUSVHKU-DBXWQHBBSA-N	436.629	1.885	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)C(=O)Nc3cccnc3)CCO2)C1	1781229780	JLFLZCMGYXCVDM-MSOLQXFVSA-N	429.304	1.086	50	20	IDGD	
CC(C)(C)OC(=O)N[C@]1(C(=O)N2CC[C@@]3(CN(C(=O)[C@H](F)Cl)CCO3)C2)CCOC1	1781308795	IRANNCQFXDRBJX-MJXNMMHHSA-N	449.907	1.035	50	20	IDGD	
CC(C)(C)n1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](F)Br)C3)C2)cn1	1781326747	SFHYAQZULZDYQV-SUMWQHHRSA-N	431.306	1.772	50	20	IDGD	
O=C(c1ccc(OCC2CC2)cc1F)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1781435517	VIBUJMWNAIAUGV-RXVVDRJESA-N	440.899	1.658	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(Cl)c(O)cc3O)C2)C1	1781473416	ZHGZQZHXZPLGLT-DYZYQPBXSA-N	447.713	1.978	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc([N+](=O)[O-])cc3F)C2)C1	1781554784	HAFBCPNPXMCVQT-GTNSWQLSSA-N	444.257	1.961	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(OC)c(OC)c3O)C2)C1	1781828850	AEHAMMWCRBHSPU-VLIAUNLRSA-N	442.896	1.107	50	20	IDGD	
CCOC(=O)/C=C/C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](Br)CC)C1	1781899625	ASMFCTXXWQWECO-YUKCVPCESA-N	445.354	1.793	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc3c(c1)CC(=O)N3)C2	1782175985	TXIVTIUOUGCKLC-AQOAWAETSA-N	449.935	1.563	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H]1Cc3ccccc3O1)C2	1782176155	WXZRAMXJTZPQJD-FAGZOMQFSA-N	436.936	1.758	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H]1CC[C@H](C(=O)OC)C1)CCO2	1783343692	OQUQYJWSZUEGSJ-XLPNERPQSA-N	445.354	1.579	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cnc(OCF)cn3)CCO2)C1	1783343900	KVBZPYUGEPAKMD-SJKOYZFVSA-N	445.289	1.399	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cc4n(n3)CCCC4)CCO2)C1	1783534705	YDXIPHBROLAHBE-ACJLOTCBSA-N	425.327	1.446	50	20	IDGD	
C[C@H](NC(=O)c1ccccc1)C(=O)N1CC[C@]2(CN(C(=O)C(Cl)Cl)CCO2)C1	1785561424	KUINSQNEAKCOEQ-ORAYPTAESA-N	428.316	1.439	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC1(c2ccc(NC(=O)c3cccc(O)n3)cc2)CCC1	1787388372	UCFLDKGSLPSOJS-UHFFFAOYSA-N	446.467	1.847	50	20	IDGD	
C[C@H](Cn1ccnc1)C(=O)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1	1788149354	LHTSQLLDSXIGED-QGZVFWFLSA-N	446.316	1.647	50	20	IDGD	
COc1ccnc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Br)C[C@@H]32)c1	1788892223	NSLWPGWQYJYAQW-LVGORTOPSA-N	430.274	1.374	50	20	IDGD	
O=C(C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]2C1)c1ccccc1	1789922178	FVFVVEBWOMOQSN-RZLSGREXSA-N	427.270	1.540	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccn4nccc34)C[C@@H]21)[C@@H](F)Br	1789925548	RDJNRLNVGHSHCE-DLKVLKDVSA-N	439.285	1.618	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)Cc3ccccc3)[C@H]2C1	1790957573	SNKKKVSYXBVSEO-XNJHUCFUSA-N	439.350	1.353	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnn(C)c3Cl)C[C@@H]21	1790960623	OKJFZQKXIVYSMF-PYJNHQTQSA-N	447.761	1.840	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4nonc4c3)C[C@@H]21	1791057979	SVROBXJPZKOIBU-SDPXSBNPSA-N	437.294	1.600	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(F)c(OC)c3)C[C@@H]21	1791255970	ABVUVWHIWGNNMU-AFIMGQEJSA-N	428.888	1.681	50	20	IDGD	
CCOC(=O)N[C@@H](O)C(=O)NC1(c2ccc(NC(=O)[C@@H](C)Br)cc2)CCC1	1791434050	DAJUXSLQJULLFC-ABAIWWIYSA-N	442.310	1.968	50	20	IDGD	
CCCC(=O)N[C@@H](C)C(=O)NC1(c2ccc(NC(=O)CCC(=O)NN(C)C)cc2)CCC1	1791601004	DHKXMRRGPBCGPX-INIZCTEOSA-N	445.564	1.798	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1cccc([N+](=O)[O-])c1	1792477415	NSUXWGJDVIKCJK-BJWYYQGGSA-N	431.493	1.149	50	20	IDGD	
O=C(CCc1ccc(C(F)(F)F)cn1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2	1794097072	XXMBSKKTMRMZAO-RBNVPPIJSA-N	449.857	1.222	50	20	IDGD	
CC#CC[C@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)c1ccccc1	1796188720	LSDSYUKVUCDRSB-KIHHCIJBSA-N	444.340	1.815	50	20	IDGD	
CC(C)(C)OC(=O)N1C(=O)CC[C@@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Cl	1796368101	CJRXVDUDYLUSJX-BUONHZGMSA-N	447.891	1.037	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cccs1)C2	1796440460	MSLWLRCCWSGFIH-BHTPPFENSA-N	443.529	1.014	50	20	IDGD	
Cc1noc(-c2ccccc2)c1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2	1796476045	MKACYZATXUQPCF-DFGXFYAUSA-N	433.892	1.453	50	20	IDGD	
COc1cnc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CO[Si](C)(C)C)c(F)c1	1797954459	OFEIRRQYIUNDAR-FVCICTRLSA-N	425.533	1.284	50	20	IDGD	
Cc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CO[Si](C)(C)C)C3)n(C(F)F)n1	1798679254	RZFMRWMIASZBOE-YWVIFJGQSA-N	430.528	1.641	50	20	IDGD	
C[C@@H](Nc1cccnc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@](C)(Cl)CCl	1799275041	LUUDWXCRSMEUJA-HUYPOWGKSA-N	429.348	1.708	50	20	IDGD	
CCOc1cccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Br)c1O	1799348237	DWYTWHMYQZJPKR-YHYOWMERSA-N	445.285	1.685	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(F)cc([N+](=O)[O-])c1	1799629080	WTDMGXIVQGXLMK-NOXHYTERSA-N	429.832	1.191	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@@H](O)CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C(Cl)Cl)C2	1800183024	YIZYMXOGJBJJFG-RNJOBUHISA-N	438.352	1.704	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](N)c1cccc(Cl)c1)C2	1800975952	YSVLZUOIKMPGOB-PEHHYFEISA-N	430.332	1.183	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(F)cc([N+](=O)[O-])c1)C2	1800976976	FEMXCCJVSSVBDY-NOXHYTERSA-N	429.832	1.191	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc([N+](=O)[O-])cc1F)C2	1800979761	ZDTGELCVLYFTKI-ZFHGCVPZSA-N	443.859	1.120	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)S	1800985604	FXNSDLRNEYLMLT-AKENFEQQSA-N	437.474	1.042	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CCC[C@@H]3CCCC[C@H]31)C2	1801011456	MAVGCRMVFCLXKB-ZEBPIIIJSA-N	448.608	1.556	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)c1ccccc1Cl)c1cccc(B(O)O)c1	1802690499	YAOPBISRTMPYSS-AXVVYFOYSA-N	442.708	1.005	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)c2cc[nH]n2)[C@@H]1c1cccnc1	1803760850	JVHIHFPIESLBPT-YRJCQSRDSA-N	448.487	1.258	50	20	IDGD	
CCOC(=O)[C@H](NC(=O)OC(C)(C)C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](F)Cl)C2	1804300957	RTFRUTLNYMNXIY-XVIXHAIJSA-N	449.907	1.615	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)CNC(=O)c2cccnc2)[C@@H]1c1cccnc1	1804368863	HOLKBLVWDUTSBA-QRFRQXIXSA-N	443.935	1.930	50	20	IDGD	
C[C@H](CNC(=O)OC(C)(C)C)C(=O)N1CCC2(CCCN(C(=O)[C@H](O)CCl)C2)CC1	1805514921	GTIBCQXWANCZEN-HZPDHXFCSA-N	445.988	1.978	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H]1C(=O)N1CCC2(CCCN(C(=O)[C@@H](O)CCl)C2)CC1	1805518004	NJAJUYDZYIXSRI-HOTGVXAUSA-N	443.972	1.827	50	20	IDGD	
Cc1occc1C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1	1805613599	HNGYMMDXEYOFLB-OXQOHEQNSA-N	448.483	1.615	50	20	IDGD	
Cc1ncoc1C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1	1805857865	LEKXACIGEQSLFS-YJBOKZPZSA-N	449.471	1.010	50	20	IDGD	
COC(=O)CCC(=O)NC[C@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1	1806372053	MPABMGYUAGOVCV-KDOFPFPSSA-N	426.311	1.826	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)CCSC(=N)N)[C@@H]1c1cccnc1	1807127028	MQJVSSIHRXYVBJ-YCPHGPKFSA-N	427.958	1.358	50	20	IDGD	
CC1(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)CCCC1	1807360169	OSDVEUMMVMBSLX-TZIWHRDSSA-N	435.333	1.661	50	20	IDGD	
CC(C)=CCCC(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1807971933	BXNMPMRSSJZWPG-REWPJTCUSA-N	435.333	1.827	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@@H](CNC(=O)Cn2nccn2)[C@@H]1c1cccnc1	1808920948	YRSGEIKHAMKVPG-KMFMINBZSA-N	435.326	1.410	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)c3cc[nH]c4nccc3-4)CC2)C1	1809967070	PZWALBGEZKEWHJ-UHFFFAOYSA-N	446.316	1.353	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@H](CNC(=O)c2c[nH]c(=O)cn2)[C@@H]1c1cccnc1	1811450283	SHKFFRMDCDMRMF-KXBFYZLASA-N	429.553	1.336	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)Cc2ccc3ncnn3c2)[nH]n1)[C@H](O)CCl	1814871616	APETXZYORPZNCW-HUUCEWRRSA-N	431.884	1.287	50	20	IDGD	
O=C([C@@H](O)CCl)N1CCCC[C@@H]1c1cc(NC(=O)C(F)(F)C(F)(F)C(=O)O)n[nH]1	1815563304	KJKCYSFNCWNCOJ-BDAKNGLRSA-N	444.769	1.357	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)C(=O)C1CC1)CC2	1817276200	OUATXOPFPIVHEP-LUKCILAXSA-N	442.501	1.168	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](C)Br)[nH]n1	1817996420	PVTAMFKVFCFTIB-JFGNBEQYSA-N	429.319	1.632	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccns2)[nH]n1	1819402293	ZMRPEGLWFJMTDN-AWEZNQCLSA-N	440.489	1.484	50	20	IDGD	
Cc1nccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)n1	1822413927	HRJHGZDMCFSQIE-MRXNPFEDSA-N	428.497	1.187	50	20	IDGD	
CN1C(=O)CC[C@H]1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCBr)CC2	1823046816	LYJAOEAPCWMCQI-ONGXEEELSA-N	429.340	1.461	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)Cn2cc([N+](=O)[O-])cn2)CC1	1825128191	DBVUSRKGTCIYJD-IRXDYDNUSA-N	441.916	1.665	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](C)n1cncn1)CC2	1825648062	XEDPAIAXVHAYLY-LPEHRKFASA-N	427.328	1.691	50	20	IDGD	
CC(C)O[C@H](C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827052268	RREDLNMFKDYGSF-UTKZUKDTSA-N	430.354	1.413	50	20	IDGD	
Cc1cc(CC(=O)N2CCC([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)on1	1827055767	DZSUCKNTNBQSPG-OAQYLSRUSA-N	439.321	1.139	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830366503	RFYUUUXGLZOTHM-CXAGYDPISA-N	439.778	1.881	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CN2CCNC2=N)CC1	1831549172	MLKAVLCJLQUASM-HOTGVXAUSA-N	442.402	1.620	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CN3CCC(C)CC3)C2)C1	1831639486	ACHVNPQBPBAOFV-NQIIRXRSSA-N	429.989	1.582	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H](N)Cc2cscn2)CC1	1831833112	LEDPZWBEDSBNNR-OKZBNKHCSA-N	443.013	1.886	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)CN3CCSCC3)CC2)CC1	1833061575	WLSRDYGKIRKQHN-SFHVURJKSA-N	431.046	1.624	50	20	IDGD	
C=CCOCCCC(=O)NC1CCN(C2CCN(C(=O)[C@@H](Cl)COC)CC2)CC1	1833470915	XODATFPNSVBMBV-IBGZPJMESA-N	429.989	1.795	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)CSc3nc[nH]n3)CC2)CC1	1833535031	OSBMBWXVFGATOK-INIZCTEOSA-N	443.017	1.876	50	20	IDGD	
Cc1cc(C(=O)NC2CCN(C3CCN(C(=O)CCBr)CC3)CC2)no1	1834250831	TWVWPEWQXCYXBR-UHFFFAOYSA-N	427.343	1.953	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)c3cccc(F)n3)C2)C1	1834822989	CHVKKWONVGPWSG-KRWDZBQOSA-N	430.274	1.076	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3nc4ccccn4n3)CCO2)C1	1836393603	WCYYJYDIYOGKIC-FOIQADDNSA-N	435.912	1.207	50	20	IDGD	
CC(C)(C)c1cc(C(=O)N2CCC(OC3CCN(C(=O)[C@H](O)CCl)CC3)CC2)[nH]n1	1836718658	YEJSCYCQZLQHCJ-QGZVFWFLSA-N	440.972	1.919	50	20	IDGD	
O=C(c1ccc([N+](=O)[O-])cc1F)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1839278029	YOPGXFUDOLVJOZ-PBHICJAKSA-N	433.795	1.338	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(F)c3Cl)CCO2)C1	1839324604	PVKNJDXLISFPSO-IFXJQAMLSA-N	449.306	1.803	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc4ccsc4[nH]3)CCO2)C1	1839521636	AORIAPVADAVBDA-LIRRHRJNSA-N	441.937	1.553	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnc4ccc(F)cn34)CCO2)C1	1839592547	MHIBAJHAYPGYFB-YWZLYKJASA-N	438.887	1.561	50	20	IDGD	
Cc1cccc2c(C(=O)N3CCO[C@]4(COCCN(C(=O)C(Cl)Cl)C4)C3)n[nH]c12	1839597173	MQKBZOCKRUIKNM-LJQANCHMSA-N	441.315	1.745	50	20	IDGD	
COc1cc(F)cc(/C=C/C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)c1	1840084795	HDERDVJLVUXGQN-RNRGVFSRSA-N	444.862	1.838	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C)cc(OC)c3)C2)C1	1840155138	QTYDFFJZLPDKTM-WIYYLYMNSA-N	440.924	1.327	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(C)cc3O)CCO2)C1	1840669772	OQVZSZYOYTVEBZ-OXQOHEQNSA-N	426.897	1.024	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(C)cc3OC)CCO2)C1	1840680223	PUBVMIPSAZOMNM-LAUBAEHRSA-N	440.924	1.327	50	20	IDGD	
O=C([C@H](F)Cl)N1CC2(CCCN2C(=O)c2ccc3nc(Br)nn3c2)C1	1843127774	HEMRBHQLZSNHDR-NSHDSACASA-N	430.665	1.843	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1ccc(F)nc1F)C2	1843415191	WTGHHVUVDVPFCJ-BRJLIKDPSA-N	430.415	1.311	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)CCc1nnc(C)s1)C2	1843415311	KWCIJWGYLKGRHY-LPYMAVHISA-N	443.533	1.117	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC2(CCCN2C(=O)c2ccnnc2O)C1	1844611794	BHBQIHRFPIQGSE-RIYZIHGNSA-N	425.395	1.885	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@H](NC(C)=O)c2ccc(F)cc2)C1	1845006876	MYGXTEYJUTXUDZ-IRXDYDNUSA-N	425.888	1.460	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)c2cc(OC)c(OC)c([N+](=O)[O-])c2)C1	1845552402	MJKCTENJNAOULR-CYBMUJFWSA-N	441.868	1.683	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H]2OC[C@H](C(=O)N3CCCC34CN(C(=O)[C@H](F)Cl)C4)[C@H]2C1	1846141740	IMUACXWGEPQVHN-BARDWOONSA-N	445.919	1.606	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC2(CCCN2C(=O)CCOCCOCCOC)C1	1846249405	JSKJLUKQIYLLLV-OAHLLOKOSA-N	435.359	1.433	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)c2cc(F)c(F)c(Cl)c2)C1	1846869407	HSJHCNLQDITNSF-UHFFFAOYSA-N	428.867	1.808	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](CCN)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)C(C)(C)CCl	1847435731	RDZTWSNSCURHPO-ILXRZTDVSA-N	430.977	1.695	50	20	IDGD	
CC(C)(C)OC(=O)NCC[C@H](O)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)C(C)(C)CCl	1847438319	MEZFYDBQCMRQHM-KKUMJFAQSA-N	431.961	1.729	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(Cl)cc2)c1	15886261	VWADBJGCWJRQNA-UHFFFAOYSA-N	439.921	1.804	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccn(-c3ccccc3)n2)c1	32651120	PUGHWUWNGQNZCE-UHFFFAOYSA-N	441.513	1.978	50	20	IDGD	
O=C(NNC(=O)c1cn(-c2ccccc2)nn1)c1ccc(S(=O)(=O)N2CCCC2)cc1	36830666	KVBVGEWREXXWMW-UHFFFAOYSA-N	440.485	1.127	50	20	IDGD	
O=C(COc1cccnc1)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	116704479	GTNDLRASHCPEEQ-UHFFFAOYSA-N	440.481	1.400	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCCc2ccn(-c3ccccc3)n2)c1	725865404	FGLPNEDKQYTZOR-UHFFFAOYSA-N	427.486	1.463	50	20	IDGD	
CN(Cc1ccc(C(=O)NC2CC2)cc1)C(=O)NNC(=O)CNC(=O)c1cccs1	725873059	JKLAPYGNFDHNPG-UHFFFAOYSA-N	429.502	1.243	50	20	IDGD	
O=C(COC(=O)c1cn(-c2ccc(C(F)(F)F)cn2)nn1)NNC(=O)c1cccs1	726060902	WUGZDLCIUGEVRU-UHFFFAOYSA-N	440.363	1.361	50	20	IDGD	
CS(=O)(=O)Cc1c(C(=O)NNC(=O)[C@H]2COc3ccccc3O2)oc2ccccc12	726496590	AAFZYJUQNKWCPR-QGZVFWFLSA-N	430.438	1.578	50	20	IDGD	
COc1ccc(CN2C[C@H](C(=O)OCC(=O)NNC(=O)c3ccc(C)cc3)CC2=O)cc1	726684184	ZOWFBENAVVVRKS-GOSISDBHSA-N	439.468	1.357	50	20	IDGD	
C#Cc1cccc(NC(=S)NNC(=O)c2ccc(S(=O)(=O)NCCOC)cc2)c1	727497630	CQJTZCFXHRAGOC-UHFFFAOYSA-N	432.527	1.224	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)NCCN(C(=O)OC(C)(C)C)C2CC2)nc2ccccc21	727606369	XDXLBFBXASNINZ-UHFFFAOYSA-N	430.509	1.846	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)c2cccc(S(=O)(=O)NC3CCCC3)c2)c1	728205899	KREWMDSNGSEVQR-UHFFFAOYSA-N	446.529	1.789	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)c2cccn2C)cc1NC(=O)c1ccccn1	728503484	QXCTUNONMUFXPV-UHFFFAOYSA-N	429.458	1.304	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)N1CCC[C@H](CN2CCN(c3ccccn3)CC2)C1	728958146	UDINFECUFNANFZ-HXUWFJFHSA-N	437.548	1.294	50	20	IDGD	
CC[C@H](N=c1nn[nH]n1-c1ccccc1)C(=O)NNC(=O)[C@H](C)Oc1ccccc1F	729283507	UARGZZKPSSWQNB-BBRMVZONSA-N	427.440	1.029	50	20	IDGD	
C=CCNS(=O)(=O)c1ccc(C(=O)NNC(=S)Nc2ccc(N(C)C)cc2)cc1	729690752	ITTPCMMGBRZDFA-UHFFFAOYSA-N	433.559	1.848	50	20	IDGD	
O=C(NNC(=O)c1c[nH]nc1-c1cccnc1)c1ccc(S(=O)(=O)N2CCCC2)cc1	730420562	LPVYBTGRPOKOGS-UHFFFAOYSA-N	440.485	1.331	50	20	IDGD	
COc1cc(CNC(=O)NNC(=O)C(C)(C)c2ccccc2)ccc1OCC(=O)N(C)C	731219650	BTSMRPHGWGDRCV-UHFFFAOYSA-N	442.516	1.970	50	20	IDGD	
O=C(NC[C@]1(O)CCCc2ccccc21)NNC(=O)c1csc(N2CCOCC2)n1	731358126	FJORGZMCSLLWCA-HXUWFJFHSA-N	431.518	1.148	50	20	IDGD	
CCS(=O)(=O)N(C)C1CCN(C(=O)NNC(=O)c2cc3c(s2)CC[C@@H](C)C3)CC1	731358148	FYDQAVMLOSVEHQ-CYBMUJFWSA-N	442.607	1.973	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)c1cc(S(=O)(=O)N2CCC[C@H](C)C2)cn1C	731491872	ZJZRJCUUCRBONY-AWEZNQCLSA-N	434.518	1.529	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)CCNS(=O)(=O)c1cccc([N+](=O)[O-])c1)c1ccccc1	732133187	SARRKLXAYFFHQT-QGZVFWFLSA-N	434.474	1.604	50	20	IDGD	
CCc1cc(N2CCC[C@H](NC(=O)NNC(=O)COc3ccccc3OC)C2)ncn1	732913856	DDQRCVVNIIMGJG-INIZCTEOSA-N	428.493	1.426	50	20	IDGD	
O=C(NCCCS(=O)(=O)c1ccccc1)NNC(=O)c1cnn(-c2ccccc2)c1	733344982	IDAUCKFCFSQHQH-UHFFFAOYSA-N	427.486	1.680	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)CN1C(=O)[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O	734251883	RHMKLOQNIRSQLC-RPLLJCPNSA-N	446.529	1.014	50	20	IDGD	
CCOCCCN1CC[C@H](NC(=O)NNC(=O)c2cc(Br)c[nH]2)[C@@H](C)C1	734683307	GVFVAZMEAUMATP-JSGCOSHPSA-N	430.347	1.858	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)c2ccc3c(c2)OCC(=O)N3)CC1	734821014	DXDMNBUQKIOJMS-UHFFFAOYSA-N	433.465	1.361	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)c1ccc(F)c(S(=O)(=O)N2CCCC2)c1	737637378	WYDWEFLWFMTGAR-UHFFFAOYSA-N	435.477	1.588	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2cc(F)ccc2O1)c1cccc(S(=O)(=O)N2CCCCC2)c1	740812414	HVXRSXIYQKJAJE-LJQANCHMSA-N	447.488	1.765	50	20	IDGD	
COCC(=NNC(=O)C[C@@H]1c2cc(OC)c(OC)cc2CCN1S(C)(=O)=O)C(C)C	741455667	NHXWIXQUZCUZOD-QGZVFWFLSA-N	441.550	1.727	50	20	IDGD	
C[C@H](CC(=O)c1cccc(Br)c1)C(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1	741662942	UKXOGHMJKOSXHI-ZYHUDNBSSA-N	431.308	1.240	50	20	IDGD	
Cc1cc(=O)oc2cc(OCC(=O)OCC(=O)NNC(=O)c3cccc(C#N)c3)ccc12	741827745	BCAFYVOTUIKHTE-UHFFFAOYSA-N	435.392	1.356	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CCCN(C)C2=NS(=O)(=O)c3ccccc32)c(O)c1	743312329	FYZQELOYFMUFFR-UHFFFAOYSA-N	430.486	1.323	50	20	IDGD	
CN(C)c1cc(CNC(=O)NNC(=O)CNC(=O)c2cccs2)c2ccccc2n1	743577609	DRMPJFJLGJUHAY-UHFFFAOYSA-N	426.502	1.623	50	20	IDGD	
CC(C)(C)C(=O)NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C(C)(C)C)cc2)CC1	744382758	ADDBGXLQPOXTTM-UHFFFAOYSA-N	438.594	1.484	50	20	IDGD	
COc1ccc(-c2noc(CCC(=O)OCC(=O)NNC(=O)c3cccc(C)c3)n2)cc1	744541261	BVUZMYJXKYTZLX-UHFFFAOYSA-N	438.440	1.991	50	20	IDGD	
Cn1ncc(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)c1C(F)(F)F	744619829	AEUOCRZEGMVKKL-UHFFFAOYSA-N	433.412	1.217	50	20	IDGD	
CCC[C@@H](CC)NC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	744887742	UWLQLBUBIIJQRP-QGZVFWFLSA-N	440.566	1.549	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)[C@H]2CCCN2c2ncccn2)CC1	747397278	JLSIIYVJCFHHRC-OAHLLOKOSA-N	433.513	1.175	50	20	IDGD	
COCCCN1C(=O)C(=NNC(=O)[C@H](C)OCCOC)c2cc(Br)ccc21	748259973	ZZGFWQKGGYAIKZ-LBPRGKRZSA-N	442.310	1.704	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCC(=O)N(C)C2CCCCC2)c2ccccc2c1=O	748666767	OLYCAZJALVHUHY-UHFFFAOYSA-N	428.493	1.152	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)[C@H](Cc1c[nH]c2cc(F)ccc12)NC(C)=O	749330806	WDGUMYDLRCKZLI-SFHVURJKSA-N	442.447	1.589	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)Nc1cc([N+](=O)[O-])ccc1OC(F)F	756066078	RAPQSJYARDIWJD-UHFFFAOYSA-N	434.319	1.638	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2ccc(Cl)cc2O)cc1NS(C)(=O)=O	756781483	FLLQBOJQIPVBCZ-UHFFFAOYSA-N	428.854	1.892	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2cc(Cl)ccc2O)cc1NS(C)(=O)=O	756782156	OOUHEPOMZUBZIX-UHFFFAOYSA-N	428.854	1.892	50	20	IDGD	
O=C(Cc1cc[nH]n1)NNC(=O)c1cc(-c2cccnc2)nc2c1cnn2Cc1ccco1	758081299	QRQXDBWUDOJLKL-UHFFFAOYSA-N	442.439	1.861	50	20	IDGD	
CCN(CC)C(=O)c1ccc(C(=O)N2CCN(S(=O)(=O)CBr)CC2)cc1	758514104	ZNSGYJNUKKDOAC-UHFFFAOYSA-N	446.367	1.609	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)N[C@@H]2CN(C(=O)OC(C)(C)C)C[C@H]2C#N)cc1	758756317	XXFJGBGINPROLO-CZUORRHYSA-N	431.497	1.847	50	20	IDGD	
C[C@@H](Cc1ccccc1Br)NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	759717786	FVZHCZXTGJURON-LBPRGKRZSA-N	444.293	2.000	50	20	IDGD	
NC(=O)[C@@H]1CC[C@H](CNC(=O)NNC(=O)CCCOc2ccc(Cl)cc2Cl)O1	760204892	VUPYNTIMPWRAPV-RISCZKNCSA-N	433.292	1.516	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCCC(=O)NNc1nc(O)c2ccccc2n1	761097861	BFSVNVJCTJPECA-OAHLLOKOSA-N	444.492	1.684	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2ccc3nc(C)sc3c2)cc1	761399696	IMQIAHIKGFOHAA-UHFFFAOYSA-N	432.527	1.995	50	20	IDGD	
COc1cc(S(=O)(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)ccc1[N+](=O)[O-]	763438543	BAMXBPVIDXBVBS-UHFFFAOYSA-N	432.455	1.218	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cccc(-c3ncco3)c2)cc(OC)c1OC	763539512	MQHYGLRWYHWXCJ-UHFFFAOYSA-N	440.412	1.767	50	20	IDGD	
CCCCN(C)c1ccc(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1	763573066	XAQDIANHLZDDAJ-LJQANCHMSA-N	426.473	1.849	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCc2ccc(N3CCCS3(=O)=O)cc2)cc1OC	763642421	ROEBMPGKAJSGQZ-UHFFFAOYSA-N	448.501	1.388	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)C(=O)Nc1cnn(CC2CC2)c1	763693973	GNDLDFPHYNEOBJ-UHFFFAOYSA-N	436.266	1.221	50	20	IDGD	
Cc1cc(N2CCCC2)ccc1NC(=O)C(=O)NNC(=O)c1nnc(O)c2ccccc12	763790804	PBFZERJAPMUQHQ-UHFFFAOYSA-N	434.456	1.644	50	20	IDGD	
Cc1ccc(-n2nc(NC(=O)C(=O)NNC(=O)c3nnc(O)c4ccccc34)cc2C)cc1	763791901	YNQZRUAJGFIUCB-UHFFFAOYSA-N	445.439	1.538	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(F)cc2OCC#N)cc1	763861904	TUJRUBSEHDTWLL-ZDUSSCGKSA-N	444.419	1.680	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccn(CC(F)(F)F)n2)cc1	763876452	DCUPFNFUZDBCKZ-NSHDSACASA-N	441.366	1.201	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)C(=O)Nc2nc(-c3nccn3C)cs2)cc1	763895162	AFBQMJWNNAWDIT-UHFFFAOYSA-N	430.515	1.730	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccc(OCC2CCOCC2)cc1	763919232	MSOYVSTZGZJCQO-UHFFFAOYSA-N	429.448	1.960	50	20	IDGD	
CCOc1cc(NC(=O)C(=O)NNC(=O)Cc2ccc(F)cc2)c([N+](=O)[O-])cc1OCC	763919339	NVYWAFNCSPKWCS-UHFFFAOYSA-N	448.407	1.860	50	20	IDGD	
CC(=O)Nc1cc(NC(=O)C(=O)NNC(=O)c2cc(Br)cn2C)ccc1F	764002749	RLGBDEQSRSTGLM-UHFFFAOYSA-N	440.229	1.285	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)Nc1cccc(N2CCCC2=O)c1	764004310	CKMFCESCIAQDAC-UHFFFAOYSA-N	448.277	1.314	50	20	IDGD	
CN1CCOc2ccc(NC(=O)C(=O)NNC(=O)c3cc(Br)cn3C)cc21	764004981	QMPJPVWUTCZHHI-UHFFFAOYSA-N	436.266	1.016	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc(OC)c(N2CCOC2=O)c1	764049309	XQWNVCJFPNMDFU-UHFFFAOYSA-N	428.401	1.060	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cnn(C[C@@H]4CCCO4)c3)n[nH]2)cc1	764109709	AVZOJAYAVQRJQD-INIZCTEOSA-N	437.460	1.160	50	20	IDGD	
COCCOc1c(Cl)cccc1NC(=O)C(=O)NNC(=O)Cc1ccccc1OC	764136919	WBZRPXRZBCLHJN-UHFFFAOYSA-N	435.864	1.702	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)c(C)c1	764246137	WUFAMFSPWBDFHK-UHFFFAOYSA-N	438.440	1.288	50	20	IDGD	
CCNC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)C(C)(C)c2ccccc2)cc1	764308549	DKDLCXFTERTQPH-UHFFFAOYSA-N	426.473	1.265	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)C(C)(C)c2ccccc2)cc1C	764313148	KIXJIQYZEBHFOK-UHFFFAOYSA-N	446.529	1.820	50	20	IDGD	
COC(=O)CCOc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)cc1	764349269	HPMNDLGPEGGYPC-UHFFFAOYSA-N	435.820	1.387	50	20	IDGD	
CCOC(=O)N(C)c1ccc(NC(=O)C(=O)NNC(=O)COCc2ccccc2)cc1	764366144	KHDOPIZWFOOUGH-UHFFFAOYSA-N	428.445	1.582	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cc(C)cc(F)c3)n[nH]2)cc1OC	764377315	BWJGTVWLHVKUKZ-UHFFFAOYSA-N	441.419	1.941	50	20	IDGD	
O=C(NNC(=O)[C@H]1COCCO1)C(=O)Nc1ccccc1OCc1cccc(Cl)c1	764427567	AFBPZYAIYORASS-QGZVFWFLSA-N	433.848	1.420	50	20	IDGD	
Cc1cc(C=NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)ccc1-n1cncn1	764818385	KOLBUMNYZZVZGP-UHFFFAOYSA-N	431.500	1.484	50	20	IDGD	
COc1ccccc1S(=O)(=O)NNC(=O)CN1CCN(Cc2ccc(C)cc2)CC1	765124597	BYBLUPRDILAALV-UHFFFAOYSA-N	432.546	1.131	50	20	IDGD	
Cc1ccc(N2C[C@@H](C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)CC2=O)cc1F	765310397	FVSLSLSDQMVSOF-AWEZNQCLSA-N	436.484	1.939	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNS(=O)(=O)c2cc(C)ccc2Cl)cc1	765642828	OQYPCRSPFMBTKF-UHFFFAOYSA-N	445.950	1.587	50	20	IDGD	
CC(=O)N1CCN(C(=O)NNC(=O)c2cc(Br)c[nH]2)CC12CCCCC2	765645546	WCMDMBFKNHZBFM-UHFFFAOYSA-N	426.315	1.999	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)c1cccc(S(=O)(=O)NC(C)C)c1	767235566	JAMSEMIXNYPAAX-UHFFFAOYSA-N	447.513	1.229	50	20	IDGD	
COC(=O)c1cn(CC(=O)OCC(=O)NNC(=O)Cc2ccccc2C)c2ccccc12	767273431	WGWSHVGSZLYJID-UHFFFAOYSA-N	437.452	1.670	50	20	IDGD	
COc1cc(OC)cc(S(=O)(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)c1	767736202	PNIDDDBUQBFFDG-UHFFFAOYSA-N	426.447	1.353	50	20	IDGD	
O=C(NNC(=O)c1ccc(F)cc1Br)NC1CCN([C@@H]2CCC[C@H]2O)CC1	769155937	PSXWNFNKZCDJOF-HZPDHXFCSA-N	443.317	1.910	50	20	IDGD	
C[C@]1(c2ccc(F)c(Cl)c2)NC(=O)N(CC(=O)NNC(=O)Cc2cccnc2)C1=O	769925065	XHXGSPQGPQOBBP-LJQANCHMSA-N	433.827	1.031	50	20	IDGD	
Cc1ccc(C(=O)NCCNC(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)cc1F	770341144	LEWZHQJJIUYPHN-UHFFFAOYSA-N	444.471	1.791	50	20	IDGD	
CCc1nn(C)cc1C(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	770602779	RQEHAXWYQUVXLB-UHFFFAOYSA-N	433.515	1.920	50	20	IDGD	
CN(CCNC(=O)NNC(=O)C12CC3CC(CC(C3)C1)C2)S(=O)(=O)c1cccs1	772015337	HXWPDOUFVZMJGU-UHFFFAOYSA-N	440.591	1.915	50	20	IDGD	
Cc1cccc([C@@H](CC(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)NC(N)=O)c1	772191166	CIQDQMRXBNGVGE-MRXNPFEDSA-N	431.880	1.212	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)COC1CN(C(=O)OC(C)(C)C)C1	772995879	PBQNWKNDCAUOHE-LBPRGKRZSA-N	427.885	1.891	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNS(=O)(=O)c1cc(C(=O)O)cc(C(=O)O)c1	773252557	VDGNJQABHYMMFX-VIFPVBQESA-N	442.833	1.513	50	20	IDGD	
CCOC(=O)[C@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2)cc1	773640413	YSJHOQUFOIXCCS-LBPRGKRZSA-N	443.416	1.358	50	20	IDGD	
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC[C@H](C(=O)NNc2ccc(C(F)(F)F)cn2)C1	775265064	SFMDNQLYCJTKJK-LBPRGKRZSA-N	446.455	1.984	50	20	IDGD	
COc1ccnc(NNC(=O)Nc2cc(S(=O)(=O)N3CCCCC3)ccc2N(C)C)n1	775448362	PCMCZEHUJJWADF-UHFFFAOYSA-N	449.537	1.874	50	20	IDGD	
C#C[C@H](NC(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12)[C@@H]1CCCO1	776230228	KFIVPSWFYKXZLG-PMACEKPBSA-N	445.479	1.570	50	20	IDGD	
O=C(CSc1n[nH]c(O)n1)NNC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1	776323332	MCESJBLTPZWETP-UHFFFAOYSA-N	436.457	1.311	50	20	IDGD	
CSc1cccc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1[N+](=O)[O-]	777077155	CXELUGSCJUEQQW-CQSZACIVSA-N	447.425	1.461	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)c3ccncn3)c2)cc1	778283907	PXHTWFMJFGJQOG-UHFFFAOYSA-N	427.442	1.361	50	20	IDGD	
COC(=O)[C@@H](O)CNC(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccc(Cl)cc1	778946298	DZFKZHGMZOEDDD-DZXKJOIRSA-N	427.848	1.674	50	20	IDGD	
CCNC(=O)N(C)NC(=O)CC12C[C@@H]3C[C@H](C1)CC(C(=O)NN(C)C(=O)NCC)(C3)C2	780708224	CTUAPXISDDJUSD-XFKLWTPLSA-N	436.557	1.348	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)[C@H]1CCCN(S(=O)(=O)CCCCCl)C1	780754207	DXUHCJZMAFDNLG-AWEZNQCLSA-N	425.979	1.688	50	20	IDGD	
O=C(NNC(=O)c1cccc(Br)c1)C(=O)Nc1ccc(OC2COC2)cc1	782117375	MHGVXPPOKXNODM-UHFFFAOYSA-N	434.246	1.626	50	20	IDGD	
COc1cc(C(C)=NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)ccn1	782127177	KDXWKBATDLIREH-UHFFFAOYSA-N	446.529	1.584	50	20	IDGD	
Cc1cc(N(C)C)cc(C)c1NC(=O)C(=O)NNc1ccc(S(=O)(=O)NC(C)C)cn1	783263763	KZQWSARHQZGINE-UHFFFAOYSA-N	448.549	1.533	50	20	IDGD	
Cc1ccnc(NNC(=O)C(=O)Nc2ccc(S(=O)(=O)N3CCC[C@@H](C)C3)cc2)c1	783930646	KMQLPGXJGZHHIO-OAHLLOKOSA-N	431.518	1.892	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)COc2cccc(I)c2)n1	784733459	ROWKFYOWNLDSCL-UHFFFAOYSA-N	428.230	1.331	50	20	IDGD	
COc1ccc(F)cc1NC(=O)C(=O)NNc1ccccc1S(=O)(=O)NC(C)(C)C	784833938	UUIADOURVMALNP-UHFFFAOYSA-N	438.481	1.993	50	20	IDGD	
CC1CCN(S(=O)(=O)c2ccc(NC(=O)C(=O)NNc3ncc(F)cn3)cc2)CC1	784949423	CTPQWYIAKZOVOC-UHFFFAOYSA-N	436.469	1.118	50	20	IDGD	
CN(Cc1cccc(NC(=O)C(=O)NNc2nccn(C)c2=O)c1)C(=O)OC(C)(C)C	785090052	LQWKOFQMDIVXPJ-UHFFFAOYSA-N	430.465	1.229	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1cc(F)cc(F)c1OC	785330018	BVZRTACRHLJTGC-UHFFFAOYSA-N	429.401	1.467	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)c1C	785612211	JEULCEYETKFSGE-UHFFFAOYSA-N	445.545	1.646	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(-c3ccsc3)nn2C)cc1OC	787541503	TXZBRYJHPDKPQU-UHFFFAOYSA-N	429.458	1.566	50	20	IDGD	
COC(=O)c1cc(F)c(F)cc1NC(=O)C(=O)NNC(=O)[C@H]1OCC[C@H]1c1ccccc1	789810419	NCOIIVZNLIUDKX-SJCJKPOMSA-N	447.394	1.410	50	20	IDGD	
Cc1cc(C)nc(SCc2ccc(C(=O)NNC(=O)C3(S(C)(=O)=O)CC3)cc2)n1	791444480	FWNBBQBGVDVADQ-UHFFFAOYSA-N	434.543	1.724	50	20	IDGD	
COc1cccc(C2=NO[C@@H](C(=O)NNc3nc(O)c4cnn(C(C)(C)C)c4n3)C2)c1	792164136	GBDQZUYJKZNRTN-OAHLLOKOSA-N	425.449	1.932	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)nc2)cc(Cl)c1F	792269375	RBZQKQJEHBZDAN-UHFFFAOYSA-N	429.191	1.714	50	20	IDGD	
O=C(NNc1nc2ccccn2n1)C(=O)Nc1ccc(CN2C(=O)CSC2=O)cc1	792391543	FMDGQVHDZAQFJQ-UHFFFAOYSA-N	425.430	1.007	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)c2nnn(Cc3cc(C)no3)c2C)n[nH]1	794394529	YWUIZJNPQOSECA-UHFFFAOYSA-N	436.432	1.405	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)c1ccc(S(=O)(=O)NC(C)(C)C)o1	795177743	RKXUAOKFDPDWLZ-UHFFFAOYSA-N	444.535	1.364	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2cccc(CN(C)C(=O)C(F)(F)F)c2)n1	797369801	KJIKCAXFKRCKFS-UHFFFAOYSA-N	437.378	1.310	50	20	IDGD	
CC(=O)N[C@](C)(C(=O)NN=c1sc2ccccc2n1C)c1ccc(S(C)(=O)=O)cc1	797404233	INTDDRWEOKPLKJ-FQEVSTJZSA-N	446.554	1.627	50	20	IDGD	
CSC[C@H](C)C(=O)N1CCC(C(=O)NNC(=O)CCNC(=O)OC(C)(C)C)CC1	799844018	NAUYRLDUDFPPEJ-ZDUSSCGKSA-N	430.571	1.286	50	20	IDGD	
CNC(=O)CNC(=O)c1cccc(NC(=O)C(=O)NNc2cc(Cl)ccc2Cl)c1	800627406	JVQMCMUGMSBDFJ-UHFFFAOYSA-N	438.271	1.551	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)c2nn(-c3ccc(F)cc3F)cc2O)c1	801414513	GRIIWRJGFGWVLX-UHFFFAOYSA-N	430.367	1.783	50	20	IDGD	
Cc1ccc2c(c1)nc(CNC(=O)NNC(=O)c1csc(N3CCOCC3)n1)n2C	802321799	PZFRIWDNGNBQQQ-UHFFFAOYSA-N	429.506	1.319	50	20	IDGD	
COc1ccc(C2=NO[C@@H](CNC(=O)NNc3ccc(-n4cccn4)nn3)C2)cc1F	802342705	MRVFUQCAUKBGOT-CYBMUJFWSA-N	426.412	1.629	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN([C@@H]2CCN(C(=O)NNC(=O)c3cccc(C#N)c3)C2)CC1	805067250	MWKZIPFCOSYCQB-GOSISDBHSA-N	442.520	1.540	50	20	IDGD	
CCCNS(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)c2ccc(Cl)nc2)cc1	808077941	OOXCEDVHDIVXKA-UHFFFAOYSA-N	432.911	1.047	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)Nc2ccc3c(c2)C(=O)N(CC2CC2)C3=O)c1	808832462	NSBSCLQFSJZSHB-UHFFFAOYSA-N	436.428	1.513	50	20	IDGD	
Cc1c(/C=C(\C#N)C(=O)OCC(=O)Nc2ccccc2SCC(N)=O)cc(C#N)n1C	809303547	PGCVZDWMAPHZCI-VIZOYTHASA-N	437.481	1.871	50	20	IDGD	
COC[C@]1(C(=O)OCC(=O)NNC(=O)c2cccc(C)c2)CCN(C(=O)OC(C)(C)C)C1	811399200	HTZODHOORDHOJO-QFIPXVFZSA-N	449.504	1.573	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CCN2C[C@H](C)O[C@H](C)C2)c([N+](=O)[O-])cc1OC(F)F	813281480	CRZHEJOTRMUOEP-PHIMTYICSA-N	446.407	1.465	50	20	IDGD	
COC(=O)C12CCC(C(=O)OCC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)(CC1)CC2	814590286	FSBNLUWAFMSFST-UHFFFAOYSA-N	433.417	1.413	50	20	IDGD	
CCn1nc(C)c(C(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)n1	814796592	HENPUEGWDFDVJZ-UHFFFAOYSA-N	434.503	1.544	50	20	IDGD	
CNC(=O)c1cc(Oc2cccc(NC(=O)C(=O)NNC(=O)CC3CCCC3)c2)ccn1	815568491	KBERXUCIOMDTCU-UHFFFAOYSA-N	439.472	1.900	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCc2nncn2C1)C(=O)Nc1cccc(CCCc2ccccc2)c1	815691883	DPNIFGSSGAREBK-LJQANCHMSA-N	446.511	1.802	50	20	IDGD	
CC(C)(C)c1nc2cc(NC(=O)C(=O)NNC(=O)[C@H]3CCc4nncn4C3)ccc2o1	815692369	POAYLDYDCKLCCI-NSHDSACASA-N	425.449	1.065	50	20	IDGD	
Cc1ccc(-c2csc(NC(=O)C(=O)NNC(=O)[C@H]3CCc4nncn4C3)n2)cc1C	815692916	FRCSGMPYKKFQCJ-AWEZNQCLSA-N	439.501	1.367	50	20	IDGD	
Cn1ncc(I)c1C(=O)NNC(=O)c1cccc(Br)c1	815713164	KXXVDGZZESZSLF-UHFFFAOYSA-N	449.046	1.862	50	20	IDGD	
Cc1c(C(F)(F)F)nn(C)c1NC(=O)C(=O)NNc1ccccc1S(=O)(=O)N(C)C	815751538	DBBSIWOGMNLGFN-UHFFFAOYSA-N	448.427	1.079	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)N(C)C)ccc1Cl	815751993	XKYGJSXIDUZWDV-UHFFFAOYSA-N	426.882	1.681	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)CCn1cnc2sc(C)c(C)c2c1=O	818023914	WUESJSFXEVMABD-UHFFFAOYSA-N	430.486	1.700	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NNC(=O)c2csc(S(C)(=O)=O)c2)C1	819658058	HQYAYUMYYAHISE-LLVKDONJSA-N	431.536	1.560	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)[C@H](C)NS(=O)(=O)c2ccc(Cl)cc2)cc1	825542400	MVGOJPVMLXVJQR-LBPRGKRZSA-N	440.909	1.275	50	20	IDGD	
O=C(COC(=O)/C=C/c1nc2ccccc2s1)NNC(=O)[C@H]1COc2ccccc2O1	849190091	YVPJNEBVTHJHQA-ZNFPLGDCSA-N	439.449	1.840	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NN=Cc1c(Cl)nc(N)nc1N1CCOCC1	874103564	LCAWSGVFRGUELJ-UHFFFAOYSA-N	425.276	1.975	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@H](C)C(=O)NNC(=O)CN1C(=O)[C@@H]2[C@@H](C1=O)[C@H]1C=C[C@H]2C1	912868668	JKNGSQRBDMHHCN-AVKRCAIGSA-N	445.903	1.679	50	20	IDGD	
COc1cc(C=NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c([N+](=O)[O-])cc1OC	916306011	GYYSFJFLJGTYNO-UHFFFAOYSA-N	436.446	1.626	50	20	IDGD	
Cn1ccnc1[C@@](O)(CCNC(=O)NNC(=O)c1cn(C)c2ccccc12)C(F)(F)F	916381845	WLQXHTJQIAJNMZ-SFHVURJKSA-N	438.410	1.696	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NCc1ccnc(N2CCN(C)CC2)c1	916390457	RHCDJNPDHFRYLL-HNNXBMFYSA-N	430.484	1.270	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)NCCNS(=O)(=O)Cc2ccccc2)c1C	916516546	FQEDBRVVCMXRGJ-KRWDZBQOSA-N	448.545	1.521	50	20	IDGD	
Cc1nc(SCC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c(C#N)c(C)c1C	916561146	UFBRCIVYEDNEGF-UHFFFAOYSA-N	436.497	1.679	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)NCc2cccc(OCC(=O)N(C)C)c2)cc1	919908175	SQLRTWLOJYKQGM-UHFFFAOYSA-N	428.489	1.625	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)N[C@@H]1CCCN(S(C)(=O)=O)C1	920239913	IGKVMGCNDANUKN-WMLDXEAASA-N	434.518	1.362	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)CCNS(C)(=O)=O)c3ccccc3n2)cc1	920406686	XOSXUXKIRRWYGE-UHFFFAOYSA-N	426.498	1.911	50	20	IDGD	
O=C(CN1CCCCC1=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	920434198	SPOGXUSILJDHES-UHFFFAOYSA-N	433.472	1.162	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)Nc1ccc(CN2C(=O)CNC2=O)cc1	920933476	QMCOWHRUGIWVEM-LBPRGKRZSA-N	429.408	1.498	50	20	IDGD	
Cc1nn(-c2ccccc2)c2sc(C(=O)NNC(=O)N[C@H](C)c3nnnn3C)cc12	1123738501	VORMXWIEYBZEBT-LLVKDONJSA-N	425.478	1.624	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCC(=O)NNC(=O)Cc2ccc(Cl)cc2)cc1	1317745864	ZKWGIGQECNSZAJ-UHFFFAOYSA-N	425.894	1.407	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H]2CCCN(C(=O)c3ccccc3)C2)c1	1318203773	WVHQIENJOIACKJ-KRWDZBQOSA-N	444.513	1.339	50	20	IDGD	
Cc1c(NC(=O)NNC(=O)c2n[nH]c3c2CCCC3)nnn1CCOc1ccc(F)cc1	1321766069	NEVKBHFOIYWNKI-UHFFFAOYSA-N	442.455	1.873	50	20	IDGD	
CC(C)c1ccc(-c2noc(CCC(=O)NNC(=O)CNC(=O)c3cccnc3)n2)cc1	1323959369	VIMURNSITIJKFB-UHFFFAOYSA-N	436.472	1.765	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3cccn4cncc34)C2)C1	1778680646	JENAACOLDXXAIN-KUHUBIRLSA-N	435.322	1.809	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(Cl)nn3)C2)C1	1779428920	STJCZNBDXFTFOP-ZBEGNZNMSA-N	431.718	1.605	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cccnn3)C2)C1	1779464309	GKYQGTCZWZWDRE-JLOHOZFJSA-N	439.422	1.805	50	20	IDGD	
C[C@@](O)(C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CO[Si](C)(C)C)C1)C(F)(F)F	1779539652	IZWXKZHTDNWVFJ-KBRIMQKVSA-N	440.535	1.665	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Cl)C2)c1nn[nH]c1C(F)(F)F	1780194215	QBJCRRFZABLMNO-FDLBOYPASA-N	427.786	1.485	50	20	IDGD	
COc1cc(CC(=O)N2CC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)ccc1[N+](=O)[O-]	1781191203	BMQRMDWJSVSVSX-SFHVURJKSA-N	446.287	1.780	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccccc3C(N)=O)C2)C1	1781754856	ATQDHFOUTRRZPP-BFUOFWGJSA-N	438.322	1.260	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)n1ccnc1)C2	1781997145	GGIFTCSFWVNNRH-OIPACUDHSA-N	427.343	1.741	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc([N+](=O)[O-])[nH]1)C2	1782003596	OCCRKNXLWDPZFX-CJBNDPTMSA-N	443.298	1.834	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCBr)C2	1782170289	HFGVSERBPDOWTK-WOSRLPQWSA-N	425.751	1.539	50	20	IDGD	
N#C/C(=C\c1ccc(Br)cc1)C(=O)N1CC[C@]2(CN(C(=O)CN)CCO2)C1	1782870105	MHNLAUURMBRQDS-POUQMFDLSA-N	433.306	1.145	50	20	IDGD	
COc1cc(C)c(C)cc1C(=O)N1CCO[C@@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1	1783935685	XFWKABITHSQGBF-HSZRJFAPSA-N	446.548	1.129	50	20	IDGD	
O=C(/C=C/c1ccc(F)cc1F)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21	1784861163	AXVLTTZUQYJJFF-WVSAELBTSA-N	428.863	1.557	50	20	IDGD	
CC(C)Oc1ccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)cc1C#N	1785192645	JPZWLVFHIVSWHK-LAUBAEHRSA-N	435.908	1.389	50	20	IDGD	
O=C(c1ccc(F)cc1C(F)(F)F)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1785203235	LMOXMUBWEYYSET-RHSMWYFYSA-N	438.805	1.888	50	20	IDGD	
O=C(NC1(c2ccc(NC(=O)[C@H](O)CCl)cc2)CCC1)c1cccn2c(O)nnc12	1786132681	XWJGIEUEHAXDGG-OAHLLOKOSA-N	429.864	1.782	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccnc(OC)c3F)[C@H]2C1	1787139735	UCUFTYXPKJZIMV-MXAVVETBSA-N	429.876	1.076	50	20	IDGD	
CS(=O)(=O)c1ccc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]3C2)cc1	1787445995	YSJUFQQUYVFCNI-OWIUFQIYSA-N	446.928	1.147	50	20	IDGD	
C[C@@H](C(=O)NC1(c2ccc(NC(=O)c3cnccc3C(=O)NN)cc2)CCC1)n1ccnc1	1789519755	IVKQRQFACPGINR-HNNXBMFYSA-N	447.499	1.891	50	20	IDGD	
COc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]3C2)ccn1	1789924386	AYVKCUMSZQZBHL-ABHRYQDASA-N	430.274	1.374	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)Cc3ccccc3)C[C@@H]21)[C@H](F)Br	1789924684	AJFBUGALQOKWEW-KSWRQPAISA-N	443.313	1.260	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)c3ccco3)C[C@@H]21	1790960541	BVTLOZDZWVTRJD-YOPIWALVSA-N	429.311	1.466	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccn(C)n3)C[C@@H]21	1790961978	SXTJZVXZDOTYKO-HNKHHVNMSA-N	427.343	1.116	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4c(c3)OCCO4)C[C@@H]21	1791253854	HOBLERNEJVWVQT-GGXPGOJBSA-N	438.908	1.305	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3CCC(F)(F)CC3)C[C@@H]21	1791287977	JHTJKUVGOJMHGH-ULQDDVLXSA-N	444.523	1.165	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CC[C@@H](C(=O)OC)C1	1792970391	BRMUKQHTBMAXHS-FGZZBPHYSA-N	445.354	1.339	50	20	IDGD	
COc1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](O)CCl)cc(C(F)(F)F)n1	1793113162	DARDNOPVLNMSMY-YVECIDJPSA-N	435.830	1.961	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](O)CCl)C1	1793115709	TYWMDLFGHMWLJN-ZOFXXKQRSA-N	443.972	1.871	50	20	IDGD	
O=C(CCc1ccc(F)nc1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2	1794021280	ZOAVBQBUHQAFLS-VZAMPYOESA-N	432.265	1.433	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCBr)c1	1795117037	JJEORNASLHWPIV-JLVBRIDZSA-N	438.322	1.633	50	20	IDGD	
Cc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)Br)C3)ncc1[N+](=O)[O-]	1796603059	CPXSUMVDCUPQQE-MCYUEQNJSA-N	441.282	1.285	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cc1cc(C)no1)C2	1796891030	YOJFWFJOFHPRSE-YDOXXCSQSA-N	426.477	1.298	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H]1CNc3ccccc31)C2	1796892244	RMXMZNIORFOSJD-MPTSOXDCSA-N	448.527	1.968	50	20	IDGD	
Cc1cc2cccc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)CCC(=O)NN(C)C)C4)c2[nH]1	1796987230	PKRWPJYMEXYIRQ-UPHUGPLXSA-N	441.532	1.053	50	20	IDGD	
COC(=O)C12CCC(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)C(Cl)Cl)C4)(CC1)CC2	1797268540	IAEBOCAIWIXQFH-XUWXVTPTSA-N	447.359	1.893	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnccc1C(=O)NN)C2	1797355052	DOIRRXCGMUVBOA-MUJYYYPQSA-N	447.499	1.207	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CS[C@H]1CCCCO1	1797800184	ODLXZXJDIKNNKP-XYTFPVCRSA-N	435.384	1.619	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2)c1nnc(-c2ccccc2)o1	1797821899	VPCVSMQITPVJLG-CLLJXQQHSA-N	425.272	1.744	50	20	IDGD	
CC(C)(C)c1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCBr)C3)[nH]n1	1798132762	XSFGSQHSMNUBCD-DRXBFXEBSA-N	427.343	1.695	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Cl)C3)C1	1799232663	MPZQVCIIMGVUNR-ARKGTOAJSA-N	447.935	1.758	50	20	IDGD	
C[C@@H](Oc1cccnc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@](C)(Cl)CCl	1799278435	GUKJJGBTPPZBOL-HUYPOWGKSA-N	430.332	1.675	50	20	IDGD	
CCCCCc1ncc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](O)CCl)C3)s1	1800233931	GPXUEFHBUGXQQJ-UMPJEAMMSA-N	429.970	1.679	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccnc1OC)C2	1800639286	MRFVARZAYSNCDH-AYRXBEOTSA-N	426.311	1.467	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CCc3ccccc3[C@H]1O)C2)C(Cl)Cl	1801015810	VQSQCJDBILTJIN-QMPXSYISSA-N	427.328	1.676	50	20	IDGD	
CCS(=O)(=O)CC(=O)NC[C@@H]1CCN(C(=O)C(C)(C)CCl)[C@H]1c1cccnc1	1803509257	JISQGRKNKFKOMZ-RDJZCZTQSA-N	429.970	1.787	50	20	IDGD	
Cc1cn(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@](C)(Cl)CCl)C3)c(=O)nc1O	1804097600	OMPHCBIWJWIWDE-SJBDTSRBSA-N	431.320	1.132	50	20	IDGD	
Nc1ccccc1/C=C/C(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1	1807209728	AKIFRPIYTSYFCJ-VFNXBMPVSA-N	428.920	1.983	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)CNC(=O)c2ccco2)[C@@H]1c1cccnc1	1807595969	NJGPNCPVCOVJRQ-BXWFABGCSA-N	448.907	1.364	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H](CNC(=O)Cn2cncn2)[C@H]1c1cccnc1	1807597432	VXTOHPCGWDOMTP-FRFSOERESA-N	435.326	1.410	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)c1cnn2ncccc12	1808167153	NDJHDAYPLIUIIF-WBAXXEDZSA-N	428.880	1.044	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](F)Cl)[C@H]1c1cccnc1)c1cc2n(n1)CCCNC2=O	1809678900	KMXHKTFKWMBJIN-JQFCIGGWSA-N	448.886	1.266	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)c1c(F)ccc(O)c1F	1811655706	GSAHWEUQBWHPQS-PNPHSEOMSA-N	439.846	1.985	50	20	IDGD	
Cc1ccccc1C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1811776914	QBGYZYWRSUCTBQ-NZQKXSOJSA-N	443.312	1.703	50	20	IDGD	
CCC(=O)N[C@H](C)C(=O)N1CC[C@H](CNC(=O)[C@H](C)Br)[C@@H]1c1cccnc1	1812863805	CYCOOOIWEHZZGW-SHFYGJNESA-N	439.354	1.786	50	20	IDGD	
CCC[C@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(=O)n3[nH]cnc3n2)[nH]n1	1815317843	KDIXYWQOWWXQAQ-FZMZJTMJSA-N	446.899	1.854	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1sccc1F)CC2)c1cccc(B(O)O)c1	1815350320	QGMNYACZJHBSRU-LBPRGKRZSA-N	445.306	1.563	50	20	IDGD	
N[C@@H](Cc1cscn1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1	1817976138	MDCDTGSGRRMAGU-YUTCNCBUSA-N	426.930	1.028	50	20	IDGD	
CCOCCC(=O)N1CCCC[C@H]1c1cc(NC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)n[nH]1	1818114253	PQZVDKRLCPQPME-ZZQPOVDQSA-N	443.508	1.962	50	20	IDGD	
C[C@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1)N1C[C@H]2C[C@@H]2C1	1819294816	ATQZLTZFXGGNLT-KONPQCLYSA-N	445.568	1.115	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3cc4cn[nH]c4cn3)sc2C1	1819453832	LJXPDMIQIYYUIC-QWRGUYRKSA-N	434.909	1.894	50	20	IDGD	
CCCC(=O)N[C@H](C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](Cl)COC)[nH]n1	1819565008	HODGCLDIUZRQCN-IPYPFGDCSA-N	427.933	1.960	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H]1CC=CCC1)CC2	1819800811	RPAXKNGHADCQJF-STQMWFEESA-N	440.529	1.724	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1)c1cc(-n2ccnc2)ccn1	1820341244	CRISWOBMHXEFGX-IRXDYDNUSA-N	443.895	1.896	50	20	IDGD	
Cc1ccn(C)c1C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1	1820361100	CJCYCHYSWMUQKY-MRXNPFEDSA-N	429.525	1.736	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)CN2CCOCC2)[nH]n1)[C@@H](F)Br	1820931906	ATZPDDIOLQJBRA-SWLSCSKDSA-N	432.294	1.425	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC([C@H]2CCCCN2C(=O)CNC(=O)N(C)C)CC1	1823877658	OPDNZELGYXCNKL-GOEBONIOSA-N	445.402	1.908	50	20	IDGD	
COC(=O)[C@@H]1CC[C@H](C(=O)N2CCC([C@@H]3CCCCN3C(=O)[C@@H](O)CCl)CC2)C1	1824176523	OXWWIOCBADWBEJ-MHORFTMASA-N	428.957	1.795	50	20	IDGD	
CC(C)c1nc(CC(=O)N2CCC([C@@H]3CCCCN3C(=O)[C@@H](O)CCl)CC2)no1	1824178182	DXXMBTXBNQKGHL-HOTGVXAUSA-N	426.945	1.955	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)c2cncc(F)c2)CC1	1826057037	MSLDRLFVFKWSEX-OAQYLSRUSA-N	439.296	1.448	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@H]2CCC=CO2)CC1	1828924018	GOKAZGGSHFKZGM-VQTJNVASSA-N	441.532	1.611	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccnc3OCC)CCO2)C1	1829535786	BAHZYWWGUHVWEQ-UWJYYQICSA-N	439.940	1.958	50	20	IDGD	
C=CCSCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)CBr)CCO2	1830535890	VXXOJRKBYVYGKN-RHSMWYFYSA-N	435.384	1.393	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccccn3)C2)C1	1830537479	JPSYDVXIMVZSMU-KDOFPFPSSA-N	426.311	1.183	50	20	IDGD	
CC(C)(C)c1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)ccn1	1830725668	QUOIVWYMMSJLAX-IIBYNOLFSA-N	439.940	1.049	50	20	IDGD	
O=C([C@H](O)CCl)N1CCC([C@H]2CCCCN2C(=O)c2cnc3c(c2)CCNCC3)CC1	1831148262	UWLBHNLECSDCFP-NHCUHLMSSA-N	448.995	1.603	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CN2CCNC2=N)CC1	1831549174	MLKAVLCJLQUASM-HZPDHXFCSA-N	442.402	1.620	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3nn(C)c4c3CCC4)C2)C1	1831646625	LVCWMMKHNAUJEY-KKSFZXQISA-N	438.956	1.386	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4nccn4c3)C2)C1	1831647525	XCUSONUBDASFCJ-UWJYYQICSA-N	434.924	1.812	50	20	IDGD	
COc1ccnc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)c1	1831873443	LGSOCVRBBCWCOA-FQEVSTJZSA-N	445.564	1.697	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)Cn3ccncc3=O)CC2)CC1	1833534610	IIWMMYBPYWKTCF-GOSISDBHSA-N	437.972	1.222	50	20	IDGD	
CCn1nccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1	1834418088	CNPTXSIMFUNQDR-MSOLQXFVSA-N	433.336	1.209	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3ccsc3)CCO2)C1	1836007357	INABPRWUHQTCHA-KDOFPFPSSA-N	445.379	1.921	50	20	IDGD	
Cc1nc(C(=O)NC2CCN(C3CCN(C(=O)[C@H](O)CCl)CC3)CC2)sc1C	1836072606	GFAPKOMUIYUNDT-MRXNPFEDSA-N	428.986	1.545	50	20	IDGD	
CC[C@H](Br)C(=O)NC1CCN(C2CCN(C(=O)[C@@H]3C=CCN3)CC2)CC1	1836541992	RAZBCPRTTRSTQR-IRXDYDNUSA-N	427.387	1.260	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)[C@@H]3C[C@H]3C3CC3)CC2)CC1	1836662360	ZANNMUXYBBFPOB-VQTJNVASSA-N	434.581	1.404	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccoc3Cl)CCO2)C1	1838845326	NBHYGYLVQSJPPN-ZBEGNZNMSA-N	435.702	1.786	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3cncc(OC)c3)C2)C1	1839142415	NVHVHPZJFPTDCA-NQIIRXRSSA-N	439.940	1.497	50	20	IDGD	
O=C(/C=C/c1cccs1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839198761	ATRDKQAMUDJZBZ-JUPLKNRCSA-N	447.326	1.908	50	20	IDGD	
O=C(c1cnc2ccc(F)cn12)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1839592670	UKJCXNVKZXHNNO-GOSISDBHSA-N	445.278	1.347	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3(c4ccccc4)CC3)C2)C1	1840149413	ONHPVWNTCJQAIF-RXVVDRJESA-N	436.936	1.428	50	20	IDGD	
CCC[C@@H](NC(C)=O)C(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1840851900	WMBQDUWZTMOAES-OXQOHEQNSA-N	431.961	1.013	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1cc(Cl)ccn1)C2	1843416280	RLEVTPWIKZHFSM-ZMOGYAJESA-N	428.880	1.686	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)C#Cc1ccc(Cl)cc1)C2	1844263308	PBCTVCDZSFUQPC-UHFFFAOYSA-N	437.887	1.207	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)[C@@H]2[C@@H]3Sc4ccccc4[C@H]32)C1	1844271299	XPYATFXAONBBKJ-SLFFLAALSA-N	434.326	1.071	50	20	IDGD	
CN(CC(=O)N1CCCC12CN(C(=O)C1(F)CCC1)C2)NC(=O)NCc1ccccc1	1845039500	VTSZPJLDMVQUBY-UHFFFAOYSA-N	431.512	1.428	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@]13C[C@@H]1CCN3C(=O)OC(C)(C)C)C2	1846364810	KQACJYZDYRZPED-VFCRVFHLSA-N	441.956	1.843	50	20	IDGD	
CCOc1ccc(CC(=O)N2CC3(CCCN3C(=O)CCC(=O)NN(C)C)C2)cc1OC	1846386230	OXRDPDSGWFQQAY-UHFFFAOYSA-N	446.548	1.213	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)[C@H](C)n2ccnc2C)C1	1846657042	VXEMHCAZUXQFJF-BGHCKBSUSA-N	425.493	1.090	50	20	IDGD	
CC(C)(C)OC(=O)NC1CCC(C(=O)N2CCCC23CN(C(=O)[C@@H](O)CCl)C3)CC1	1846954398	GBLBEPCIULHUAK-GPANFISMSA-N	443.972	1.873	50	20	IDGD	
O=C(CCSCc1nc2sc3c(c2c(=O)[nH]1)CCC3)NNC(=O)c1ccncc1	15628400	XOCJOFXMJAKZLP-UHFFFAOYSA-N	429.527	1.953	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)CCc2c(C)nc3nc(N)nn3c2C)cc1	18071560	XGUPCEWMZQGKSI-CQSZACIVSA-N	441.492	1.270	50	20	IDGD	
COc1ccc(OC)c(CN2CCN(CC(=O)NNC(=O)c3ccccc3Cl)CC2)c1	23295224	RZGIJLNSEHMARQ-UHFFFAOYSA-N	446.935	1.936	50	20	IDGD	
Cc1ccc(S(=O)(=O)NC2CC2)cc1C(=O)NNC(=O)Cc1c[nH]c2ccccc12	26536596	YUDXDCFCEUXQMD-UHFFFAOYSA-N	426.498	1.921	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2cccs2)n[nH]1)c1ccc(S(=O)(=O)N2CCCC2)cc1	107920750	HQXLTYPXHDBAQM-UHFFFAOYSA-N	445.526	1.998	50	20	IDGD	
Cc1noc([C@H](C)NC(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)n1	726279056	MQEQOVLKYCCYPC-ZDUSSCGKSA-N	447.459	1.785	50	20	IDGD	
Cc1noc(C)c1S(=O)(=O)N1CCC[C@@H](C(=O)NNc2nc(-c3ccncc3)no2)C1	726369650	DCLKOMPZPBBAAN-CQSZACIVSA-N	447.477	1.280	50	20	IDGD	
CCOc1ccc(S(=O)(=O)Nc2cccc(C(=O)NNC(=O)C(=O)NC(C)C)c2)cc1	726615115	YHLLRPHBLHVAEC-UHFFFAOYSA-N	448.501	1.172	50	20	IDGD	
Nc1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)cc(Cl)n1	726765436	OWADZTZGJZWHSO-UHFFFAOYSA-N	437.909	1.567	50	20	IDGD	
COc1ccc(C[C@@H](NC(=O)NNC(=O)C(=O)NC2CC2)c2ccccc2)cc1OC	727605343	XZAOZNHJAWDKBV-QGZVFWFLSA-N	426.473	1.597	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)[C@@H](c2ccccc2)N2CCN(C)CC2)cc1	727766273	OONODDYEHICFFG-PGRDOPGGSA-N	440.544	1.989	50	20	IDGD	
NC(=O)[C@H]1CC(C(=O)NNC(=O)c2cccc(OC(F)F)c2)=NN1c1ccc(F)cc1	728485276	VHKNLJAWZKWHEG-OAHLLOKOSA-N	435.362	1.308	50	20	IDGD	
C[C@H]1Cc2ccccc2N1Cc1ccoc1C(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1	728518489	UTKZEMYVABFOIZ-BBRMVZONSA-N	432.502	1.362	50	20	IDGD	
CCCS(=O)(=O)N1CCC(NC(=O)NNC(=O)c2cccc(OC(F)F)c2)CC1	728595350	AUPTVYQLFYLVGE-UHFFFAOYSA-N	434.465	1.436	50	20	IDGD	
CCOC(=O)C1=NN(c2ccccc2)[C@@H](C(=O)NNC(=O)Cc2nc3ccccc3n2C)C1	728712764	DFIZNSWGKQDKNV-LJQANCHMSA-N	448.483	1.461	50	20	IDGD	
COc1ccc(OCCCNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1	728948515	FWZZTOCYQJBBLQ-UHFFFAOYSA-N	428.493	1.501	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2cc(F)ccc2Br)ccc1S(N)(=O)=O	730842627	LJQZHRROPHVGQW-UHFFFAOYSA-N	430.255	1.619	50	20	IDGD	
Cc1ccccc1-n1nc(C(=O)NNC(=O)CCN2C[C@@H](C)O[C@H](C)C2)c2c1CCC2	732263080	ZVGLRVUYSQYNAC-IAGOWNOFSA-N	425.533	1.930	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)c1ccccc1NS(=O)(=O)C(F)(F)F	732766966	PAPRDWSCBUCNKD-UHFFFAOYSA-N	433.364	1.494	50	20	IDGD	
Cc1nc(-c2cccnc2)nc(O)c1CCC(=O)NNc1nc2ccccc2c(=O)n1C	733263246	QIPKNBFRDYMXTK-UHFFFAOYSA-N	431.456	1.875	50	20	IDGD	
Cc1cc(C)c(C)c(OCCC(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1	733552649	VPBRFCLOZIPXIN-HXUWFJFHSA-N	442.468	1.911	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)c1ccccc1F)C(=O)NNc1nccnc1Cl	734260544	UZPMZYZCJCDOOP-LLVKDONJSA-N	433.918	1.812	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)[C@@H]1CCCN1C(=O)c1ccccc1OC(F)F	740853050	SOFKUJYAZVVFID-AWEZNQCLSA-N	440.447	1.345	50	20	IDGD	
O=C(NNC(=O)c1cnc2ccsc2c1)c1cccc(S(=O)(=O)N2CCOCC2)c1	741878696	HIBWYGLOWWGZFM-UHFFFAOYSA-N	446.510	1.392	50	20	IDGD	
CC(C)c1nc(C(=O)NNC(=O)CCN2C[C@@H](C)O[C@H](C)C2)nn1-c1ccccc1F	743289364	SCIXBLXKXMWSIQ-HUUCEWRRSA-N	432.500	1.790	50	20	IDGD	
CCS(=O)(=O)NCc1ccc(C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc1	743292213	BMWXLWQTIFTJIA-UHFFFAOYSA-N	443.485	1.092	50	20	IDGD	
CCNS(=O)(=O)CCNC(=O)NNC(=O)Nc1ccc(Br)cc1Cl	743601903	BASZZBVLRSRURY-UHFFFAOYSA-N	442.723	1.378	50	20	IDGD	
COC(=O)Nc1cccc(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)c1	744621921	TVWIZDIDSBCSOC-UHFFFAOYSA-N	434.474	1.643	50	20	IDGD	
CC(=O)N[C@H](CC(=O)OCC(=O)NNC(=O)c1cccs1)c1ccc(F)cc1F	745144141	YCBCXYHNQWKRRO-CQSZACIVSA-N	425.413	1.598	50	20	IDGD	
COc1ccnc(NNC(=O)NCCc2ccc(S(=O)(=O)N3CCCCC3)s2)n1	745889091	COUFUGIWZXTYJG-UHFFFAOYSA-N	440.551	1.590	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)c1cc(S(=O)(=O)N2CCCC2)ccc1O	745993392	BRZYWCPSLZRLQU-UHFFFAOYSA-N	433.486	1.276	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccn2)no1)c1cccc(S(=O)(=O)N2CCCC2)c1	746092882	FHLLJHALQJPQIO-UHFFFAOYSA-N	441.469	1.596	50	20	IDGD	
CC(C)(NC(=O)Nc1ccccc1)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	746219843	ZKRDVUFQJRMNSU-UHFFFAOYSA-N	425.493	1.441	50	20	IDGD	
O=C(NNc1nc(-c2cccnc2)no1)[C@H]1CN(Cc2nc(O)c3ccccc3n2)CCO1	746240951	DKIPTUVLKRZODN-MRXNPFEDSA-N	448.443	1.125	50	20	IDGD	
CCS(=O)(=O)N1CCC(C(=O)NNC(=O)Cc2ccncc2)(c2ccccc2)CC1	747323689	IHOGWWROVGEKAN-UHFFFAOYSA-N	430.530	1.155	50	20	IDGD	
O=C(CCC/N=C1/NS(=O)(=O)c2ccccc21)NNC(=O)c1ccc(Cl)cc1F	747429375	LLCNMBKEELOGEE-UHFFFAOYSA-N	438.868	1.759	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)NNC(=O)c1ccc(COc2ccccc2)o1	747490244	HCWLOVZMEQPPAJ-UHFFFAOYSA-N	448.439	1.724	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(S(=O)(=O)CCCC#N)cc2)cc1C	748359639	FAAXMWPRIIQXRI-UHFFFAOYSA-N	442.497	1.781	50	20	IDGD	
CN(CCNC(=O)NNC(=O)c1nn(-c2ccccc2)cc1O)Cc1ccc(F)cc1	748976088	FSYSTOPKDFYKKI-UHFFFAOYSA-N	426.452	1.793	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)CNC(=O)c1cc(-c2ccccc2)on1	749400320	BOEXUUXYWJEQKX-ZDUSSCGKSA-N	426.404	1.825	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1C[C@H](NC(C)=O)Cc2ccccc21	749549127	ATRZFCNHCRNWGS-MRXNPFEDSA-N	430.892	1.677	50	20	IDGD	
O=C(NNC(=S)NC[C@@H]1CCOC1)c1cccc(S(=O)(=O)N2CCCCC2)c1	749643479	BQXDWZNAEOJZHD-AWEZNQCLSA-N	426.564	1.007	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)N[C@@H]1CCN(CCCc2ccccc2)C1=O	750662557	XCXWUHAPKPFEBX-LJQANCHMSA-N	435.484	1.501	50	20	IDGD	
CCS[C@H]1CCCC[C@@H]1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	750675204	IMNASTWCTSLRKL-HOTGVXAUSA-N	428.580	1.945	50	20	IDGD	
COC(=O)c1ccc(Cl)cc1S(=O)(=O)NNC(=O)[C@@H]1COc2ccccc2O1	751267803	ZKRNQSPDUXZTMM-AWEZNQCLSA-N	426.834	1.276	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)/C(C#N)=C\c3ccc(F)cc3)cc2)CC1	752635040	WDCCNGCZXVZTNO-VKAVYKQESA-N	443.504	1.812	50	20	IDGD	
COCCCOc1cccc(CNC(=O)NNC(=O)c2nnc(O)c3ccccc23)c1	752683807	DFEBAGHKHIBFFO-UHFFFAOYSA-N	425.445	1.895	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccc(Cl)cc2C(F)(F)F)cc1O)C(=O)N1CCCC1	752795566	SLLYEQWQDPBALC-UHFFFAOYSA-N	445.785	1.634	50	20	IDGD	
CS(=O)(=O)c1ccc(F)c(C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)c1	755841556	NGURQEYPIUTDAL-UHFFFAOYSA-N	427.479	1.427	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)Nc1cccc(C(=O)N2CCOCC2)c1	755934901	XOIKWJWWKMNMBI-UHFFFAOYSA-N	434.456	1.811	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1ccccc1CN1CCc2ccccc21	756137088	RZKYGSSJDCGXCI-AWEZNQCLSA-N	431.518	1.340	50	20	IDGD	
CCc1cnc(NC(=O)C(=O)NNC(=O)COc2ccc(Br)cc2)s1	756164940	RIRNGMAZYDWZOH-UHFFFAOYSA-N	427.280	1.633	50	20	IDGD	
Cc1cc(S(N)(=O)=O)cc(NC(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)c1C	756634106	LVLWWZCCLWCOLD-UHFFFAOYSA-N	428.474	1.807	50	20	IDGD	
C[C@H]1C[C@H](C)CC2(C1)NC(=O)N(CC(=O)NNC(=O)Cn1ccc3ccccc31)C2=O	756974034	IPJJFCAGCMYAAO-GJZGRUSLSA-N	425.489	1.535	50	20	IDGD	
CCn1cc(C(=O)NNC(=O)CCN2C[C@H](C)O[C@H](C)C2)c(=O)c2cc(Cl)ccc21	757715680	PQUWGIGNBJCGTD-OKILXGFUSA-N	434.924	1.935	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2cc(COC)ncn2)c1	757721493	UHVAXRFOIKUABB-UHFFFAOYSA-N	436.494	1.120	50	20	IDGD	
CN(NC(=O)C1CCN(c2cnccn2)CC1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758781688	FZNVCPJIXXJZMM-UHFFFAOYSA-N	447.540	1.329	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2cnc(OCc3ccccc3)cn2)n1	759060064	XFFHMUQMTPZCHA-UHFFFAOYSA-N	441.469	1.367	50	20	IDGD	
CN(C)C1CCN(CCNC(=O)NNC(=O)c2cc(F)ccc2Br)CC1	759606900	BQQGKVGXBFUPSD-UHFFFAOYSA-N	430.322	1.558	50	20	IDGD	
CCNS(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)c1	763159529	CLSZNHLZTDTCOF-UHFFFAOYSA-N	437.478	1.650	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CNC(=O)c2ccco2)cc1I	763323176	QYRVHGYQIYADEW-UHFFFAOYSA-N	443.197	1.084	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(Cl)c(S(=O)(=O)N(C)C)c2)c(C)o1	763584256	XMNNEXVDJDBXDF-UHFFFAOYSA-N	442.881	1.200	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(C(N)=O)c(Cl)c2)c2ccccc2n1	763619047	MWQINQRYOOFEAW-UHFFFAOYSA-N	425.832	1.695	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2c(C)nc3ccccn23)c(OC)cc1Cl	763628677	DSIASJSLNNLJSS-UHFFFAOYSA-N	431.836	1.713	50	20	IDGD	
CCOC(=O)c1cc(F)c(F)cc1NC(=O)C(=O)NNC(=O)COc1cccc(C)c1	763631583	ZFHOUDZHPMAOBZ-UHFFFAOYSA-N	435.383	1.615	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccc3ccccc3c2)c1	763718384	KMVIIDLZXUAJBH-UHFFFAOYSA-N	440.481	1.490	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(-n3cnnn3)cc2)cc1	763767432	IXQIIKXJRKSXHU-UHFFFAOYSA-N	437.460	1.487	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2cc(N3CCCC3=O)ccc2F)c1	763773021	SXOKRAVSWCXZNU-UHFFFAOYSA-N	444.419	1.369	50	20	IDGD	
O=C(NNC(=O)c1cc2c(s1)CCC2)C(=O)Nc1ccc(N2CCOCC2)c(F)c1	763782527	FJJLNJJOUIMLGV-UHFFFAOYSA-N	432.477	1.612	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(NS(=O)(=O)CC)c(OC)c2)cc1	763832648	ZZJWMNALRMBUIJ-UHFFFAOYSA-N	448.501	1.419	50	20	IDGD	
CSc1cc2c(cc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccccc1F)OCCO2	763866156	UJXSPHSTQNMENA-NSHDSACASA-N	449.460	1.872	50	20	IDGD	
CNC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)CCSc2ccc(F)cc2)cc1	763895258	MYALWUOSSYTWDA-UHFFFAOYSA-N	448.476	1.219	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(C3CCCC3)nn2C)cc1OC	763899906	DQNAZPKNDSXGFA-UHFFFAOYSA-N	429.477	1.885	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)C(=O)Nc1ccccc1Oc1cccc(F)c1	764002238	KQNKAOGRAWLKKO-GFCCVEGCSA-N	435.433	1.139	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)on2)cccc1-n1cnnn1	764003702	LHMOJDBJXBIVFW-UHFFFAOYSA-N	432.400	1.025	50	20	IDGD	
COC(=O)NCc1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)on2)cc1	764016638	KZDQDNHRLPDZCH-UHFFFAOYSA-N	437.412	1.597	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)Cc2cccc3ccccc23)cccc1-n1cnnn1	764019543	PBPCAUSROIVHQU-UHFFFAOYSA-N	429.440	1.453	50	20	IDGD	
C[C@H](c1cc(Cl)ccc1Cl)n1nccc1NC(=O)C(=O)NNC(=O)c1cnccn1	764033930	ZSLIMUBOATZOGW-SNVBAGLBSA-N	448.270	1.989	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc(N(C)C2CCN(C)CC2)cc1	764049334	XYJZGZWMXQLYQP-UHFFFAOYSA-N	439.516	1.625	50	20	IDGD	
Cc1ccn(C)c(=O)c1NC(=O)C(=O)NNC(=O)c1ccc(Br)cc1Cl	764057516	FUPBOCMPGAVISL-UHFFFAOYSA-N	441.669	1.509	50	20	IDGD	
O=C(CCc1ccco1)NNC(=O)C(=O)Nc1ccc(CCN2CCSCC2)cc1	764171013	DPDOCPARDFPCCC-UHFFFAOYSA-N	430.530	1.590	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)C(=O)Nc1cccc(COCC(F)(F)C(F)F)c1	764267846	KJZGQECVGBQUKD-UHFFFAOYSA-N	442.369	1.827	50	20	IDGD	
CC(=O)Nc1ccc(Cl)c(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c1	764343114	ODUOGPCKVHDZNT-UHFFFAOYSA-N	440.847	1.884	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)C(=O)Nc1cc(N2CCNC2=O)ccc1Cl	764366741	FIDQYRKEVHIMGV-UHFFFAOYSA-N	445.863	1.172	50	20	IDGD	
CCn1c(=O)n(CC)c2nc(NC(=O)CCC(=O)NNc3cc(Cl)nc(C)n3)ccc21	764374596	YVOAHCVSEPYUND-UHFFFAOYSA-N	446.899	1.852	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1ccc(F)c(C(=O)N(C)C)c1	764397411	ISODIGSICSKREA-UHFFFAOYSA-N	448.476	1.414	50	20	IDGD	
CNS(=O)(=O)c1cccc([C@@H](C)NC(=O)NNC(=O)CSc2ccccc2O)c1	764398071	UERWXTABFLPCAX-GFCCVEGCSA-N	438.531	1.484	50	20	IDGD	
CN(C)N(C(=O)c1cnn(-c2ccccc2)c1Br)[C@@H]1CCS(=O)(=O)C1	764976593	FVDNJSCWGPOCFT-CYBMUJFWSA-N	427.324	1.741	50	20	IDGD	
CCC(CC)NC(=O)[C@H]1CN(C(=O)C(=O)NNC(=O)OC(C)(C)C)c2ccccc2O1	765392711	JZQPTCVEJQUXGI-MRXNPFEDSA-N	434.493	1.641	50	20	IDGD	
Cn1cc(CC(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)c2ccccc21	766643424	LMRAJJAVSMYEFE-UHFFFAOYSA-N	433.512	1.326	50	20	IDGD	
CCNS(=O)(=O)c1ccc(C)c(C(=O)OCC(=O)NNC(=O)Cc2ccccc2C)c1	767244387	RQKVVELXSLLDLG-UHFFFAOYSA-N	447.513	1.149	50	20	IDGD	
O=C(CCc1ccccc1O)NNS(=O)(=O)c1ccc(OC[C@H]2CCOC2)c(F)c1	767461689	LQNPCHCTTTYRRD-AWEZNQCLSA-N	438.477	1.889	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)cc1N1CCNC1=O	768267654	AGJDMBLDGKDQQC-UHFFFAOYSA-N	426.458	1.751	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)NC1CCN([C@H]2CCCC[C@@H]2O)CC1	769160516	JGGUGHFWYHKFJN-RDJZCZTQSA-N	435.481	1.072	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)Cc2ccc(C(=O)NNC(=O)[C@@](C)(O)C(C)C)cc2)cc1	770209656	QIFANVULKFCXAB-QFIPXVFZSA-N	447.557	1.984	50	20	IDGD	
O=C(CN1C(=O)[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)NNC(=S)Nc1cccc(Br)c1	770994323	SPPKOHMLSVYLSW-NBLIUIFLSA-N	449.330	1.574	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1cc(OC)c(OC)cc1NC(=O)c1ccco1	771875934	XDSHUXMANFPVIG-NSHDSACASA-N	433.417	1.652	50	20	IDGD	
COc1cc(C#N)ccc1OCCCC(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772194687	BXRQNWABLOTTDC-UHFFFAOYSA-N	444.875	1.843	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ccc(C(F)(F)F)cn2)cc1NS(C)(=O)=O	773662172	QOGTXXFOOPFFJA-UHFFFAOYSA-N	431.396	1.862	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NC[C@H]2COC3(CCCC3)O2)nc1	774313038	XHKOAZGIECYANT-AWEZNQCLSA-N	427.527	1.424	50	20	IDGD	
CC[C@H]1Oc2cc([C@H](C)NCC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)ccc2NC1=O	775462639	BDWORYVPBYMAHX-YVEFUNNKSA-N	441.444	1.816	50	20	IDGD	
C[C@@H]1OC(C)(C)N(C(=O)OC(C)(C)C)[C@@H]1C(=O)OCC(=O)NNC(=O)c1cccs1	776481123	VKKFPPQQYJQJFC-FZMZJTMJSA-N	441.506	1.813	50	20	IDGD	
CC[C@H](C)Oc1cc(C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)ccn1	777273986	GLQRWIJHGDEOSV-HNNXBMFYSA-N	434.518	1.649	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)C(=O)Nc1cc(Cl)ccc1OC[C@@H]1CCOC1	778715397	WIWNGYHKPDRMKN-CYBMUJFWSA-N	432.864	1.858	50	20	IDGD	
O=C(C[C@@H]1SC(N2CCCC2)=NC1=O)Nc1ccc(C(=O)NN=c2cc[nH]cc2)cc1	780755320	VLRFKLJCHOEBDF-KRWDZBQOSA-N	438.513	1.683	50	20	IDGD	
C[C@H]1CN(Cc2cccc(NC(=O)C(=O)NNC(=O)c3ccc(O)cc3)c2)C[C@H](C)O1	782838002	WDESIVAZONIUCQ-GJZGRUSLSA-N	426.473	1.401	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C(=O)Nc2ccccc2OCC(F)(F)F)nc2ccccc21	782888561	UVVIHWWOQILWIJ-UHFFFAOYSA-N	449.389	1.843	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNc2ncccc2C(F)(F)F)cc1C(=O)OC	783121467	MTCQJRWVNUPEKO-UHFFFAOYSA-N	440.334	1.755	50	20	IDGD	
CCc1cccc(Oc2ccc(NC(=O)C(=O)NN[C@@]3(C)CCS(=O)(=O)C3)cn2)c1	783425408	HWPKSJHYLKRENO-FQEVSTJZSA-N	432.502	1.573	50	20	IDGD	
CC(C)c1nnc(NC(=O)CCC(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)s1	784190039	WNVCPZLUXZVRKV-UHFFFAOYSA-N	444.473	1.256	50	20	IDGD	
CC(=O)N1CCN(Cc2ccccc2NC(=O)C(=O)NNc2cccnc2Cl)CC1	784842113	JZLWLDYBAGZPGY-UHFFFAOYSA-N	430.896	1.481	50	20	IDGD	
CC(C)Cn1ncc(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)c1C(C)C	785067322	KJPMNRDGXLTWDY-UHFFFAOYSA-N	425.493	1.639	50	20	IDGD	
CC1CCN(c2cccc(NC(=O)C(=O)NNC(=O)Cc3cn4ccccc4n3)c2)CC1	785067746	LNTRYIBAICGURR-UHFFFAOYSA-N	434.500	1.899	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)[C@@H]2CN(C)C(=O)c3ccccc32)cc1C	787098280	YYCAFUXIQJSWDM-OAHLLOKOSA-N	429.498	1.793	50	20	IDGD	
CO[C@@H](C)CS(=O)(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	788139511	NHQZRLSROABXHJ-NSHDSACASA-N	433.533	1.148	50	20	IDGD	
CN1CCN(C(=O)NNC(=O)[C@H]2CCCN2C(=O)c2ccc(Cl)c(Cl)c2)CC1	788170071	YWCNWAHRPIYZQT-OAHLLOKOSA-N	428.320	1.586	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)c(OC(F)F)c1	789734498	FACBLCZIEMXZIK-UHFFFAOYSA-N	428.417	1.665	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)cc1[N+](=O)[O-]	789811192	WSFLYSGMDMLFCJ-YOEHRIQHSA-N	428.401	1.262	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cc(-c3ccccc3)on2)cc1S(=O)(=O)N(C)C	789899743	PRXZYYMIJFKJPP-UHFFFAOYSA-N	444.469	1.675	50	20	IDGD	
Cn1nc([C@@H]2CCCOC2)cc1NC(=O)C(=O)NNC(=O)C(F)(F)Oc1ccccc1	790952219	LKOQSXNBXJWDAJ-GFCCVEGCSA-N	437.403	1.072	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@H](C)C(=O)NNC(=O)[C@@](C)(O)Cn1c(C)cccc1=O	792023782	VZJPWUYMMDQJEY-VFNWGFHPSA-N	435.908	1.793	50	20	IDGD	
CN(C)N(C(=O)C[C@@H](NC(=O)c1ccc(O)cc1)c1ccccc1)[C@H]1CCS(=O)(=O)C1	792853627	FZQKYRBQWLLASS-AZUAARDMSA-N	445.541	1.746	50	20	IDGD	
COC(=O)c1ccc(S(=O)(=O)NNC(=O)c2cccc(Br)c2)c(F)c1	794588939	CLRCOXYMSHPLJH-UHFFFAOYSA-N	431.239	1.998	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(C(=O)OC)c(OC)c1	796992368	OVKUCHKEFFODOU-UHFFFAOYSA-N	429.429	1.209	50	20	IDGD	
CNC(=O)COc1ccc(NC(=O)C(=O)NNc2cccc(C(F)(F)F)n2)c(C)c1	797097725	CXGKFSHXDIDWHW-UHFFFAOYSA-N	425.367	1.615	50	20	IDGD	
CC(=O)N[C@@](C)(C(=O)NNC(=O)c1c[nH]c2ccccc12)c1ccc(S(C)(=O)=O)cc1	797610590	SFPBKPANZTUEPO-OAQYLSRUSA-N	442.497	1.384	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H](CC(F)F)NC(=O)OC(C)(C)C)cc1C	798309514	GYQRSWYBHBMCJX-ZDUSSCGKSA-N	428.436	1.938	50	20	IDGD	
O=C(NCC(F)(F)F)NNC(=O)c1ccc(NC2=NS(=O)(=O)c3ccccc32)cc1	798316795	VPTPLRVFKLJOHH-UHFFFAOYSA-N	441.391	1.754	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)[C@H]2COCCN2CC(F)(F)F)cc1C	801342305	JXFABKBCJLIIAK-LLVKDONJSA-N	437.440	1.186	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1nn(-c2cc(Cl)ccc2[N+](=O)[O-])cc1O	801386710	LXZWJLRJBMLBGI-QMMMGPOBSA-N	425.785	1.242	50	20	IDGD	
O=C(COCc1ccccn1)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	805152404	VSBYHMJBBNOCSV-UHFFFAOYSA-N	443.463	1.818	50	20	IDGD	
O=C(NCc1cc(F)c(F)cc1Br)NNC(=O)C(=O)Nc1ccccn1	807526901	DEBFHIUSZBZSBZ-UHFFFAOYSA-N	428.193	1.591	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)c1snnc1C1CC1	810593945	NXQICOQHTYKYNO-UHFFFAOYSA-N	434.953	1.648	50	20	IDGD	
CCCN(NC(=O)CNS(=O)(=O)c1ccc(OC)c(OC)c1)C(=O)OC(C)(C)C	811523558	PECLELCEPQIBLF-UHFFFAOYSA-N	431.511	1.660	50	20	IDGD	
CCOC(=O)c1ccc(NNC(=O)C2=NN(c3ccc(F)cc3)[C@@H](C(N)=O)C2)cc1C	812717372	ZQOGCBZEMCHIAE-GOSISDBHSA-N	427.436	1.874	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)[C@H]2CCCN(C(=O)c3ccccc3)C2)cc1	812730601	OMSKLIQFTWCBOF-KRWDZBQOSA-N	430.530	1.932	50	20	IDGD	
O=C(NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)Nc1ccc2c(c1)OCCO2	813467211	BEINPPNNNLNJOP-UHFFFAOYSA-N	446.485	1.709	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NN=C1CN(C(=O)OC(C)(C)C)CC[C@H]1c1ccccc1	814835653	XMQMDWUADSYBJR-HOCLYGCPSA-N	438.550	1.821	50	20	IDGD	
O=C(CC(F)(F)F)NNC(=O)C(=O)Nc1cc(Cl)ccc1I	815568285	BYBJOMWMFCMKQX-UHFFFAOYSA-N	449.554	1.983	50	20	IDGD	
COCc1cc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2F)cc(C(=O)OC)c1	815570541	GCRQGWAXFQFPRB-UHFFFAOYSA-N	437.811	1.812	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCc2cncn2C1)c1ccccc1NS(=O)(=O)c1cccs1	816830924	ZFGQMVLBTPZOJR-CYBMUJFWSA-N	445.526	1.769	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)[C@@H](CCS(C)(=O)=O)c1ccccc1	817053882	KEPOTAOELQRCND-INIZCTEOSA-N	439.559	1.599	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)N2CCC[C@@H](n3cc(CO)nn3)C2)N(C)c2ccccc21	818155565	JLGFWZVODJHBQZ-QGZVFWFLSA-N	449.515	1.605	50	20	IDGD	
O=C(C1CCN(S(=O)(=O)c2ccccc2C(F)(F)F)CC1)N1CC[C@@H](B(O)O)C1	864234339	QGHLYFACOUIVEL-CYBMUJFWSA-N	434.245	1.181	50	20	IDGD	
COc1ccc(OCC(=O)NN=Cc2c(N3CCOCC3)nc3ccccn3c2=O)cc1	864237313	UDCCOHXZAIXIFW-UHFFFAOYSA-N	437.456	1.069	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc2ccccc2c1)NNC(=O)COc1ccccc1F	913455285	ZQSXCIVPQHOLEQ-UHFFFAOYSA-N	431.445	1.484	50	20	IDGD	
COc1c(F)cc(CC(=O)NNC(=O)Cc2cccc3ccccc23)cc1S(N)(=O)=O	915596558	DUHQUZCYHZBPFN-UHFFFAOYSA-N	445.472	1.568	50	20	IDGD	
O=C1Nc2cc(N3CCOCC3)ccc2C1=NNC(=O)c1nn(-c2ccccc2)cc1O	915952926	ZELSMHFSUYTBBU-UHFFFAOYSA-N	432.440	1.501	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NCC(C)(C)N2CCc3ccccc3C2)c2ccccc2c1=O	916591749	IBAIGZVCBSBIJM-UHFFFAOYSA-N	448.527	1.714	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)NCc1ccc(S(=O)(=O)N(C)C)cc1	916646638	FCZZTFLMUQGSAB-UHFFFAOYSA-N	440.909	1.743	50	20	IDGD	
CCN(CCO)c1ccc(C=NNC(=O)Cc2csc(N3CCOCC3)n2)c(C)c1	917566668	VUDCVRGLGCQAON-UHFFFAOYSA-N	431.562	1.800	50	20	IDGD	
CCc1nc(CC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)cs1	919807412	HVKOXTBKNUTCJE-UHFFFAOYSA-N	436.559	1.884	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)c2ccc3c(c2)CCCN3S(C)(=O)=O)cc1	919835375	FGZIJWLYIQBYMN-UHFFFAOYSA-N	431.514	1.801	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)N[C@@H]2CCCN(S(C)(=O)=O)C2)c1	920238573	HKENNEXVJXGCTP-OAHLLOKOSA-N	426.539	1.252	50	20	IDGD	
C[C@@H](Cc1ccc(F)cc1)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	920999129	GKYMPSMUKOZTKJ-HNNXBMFYSA-N	449.504	1.486	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)Cc2ccc(S(=O)(=O)NC)cc2)cc1OC	1116596930	YVSWLUDDKSJRIN-UHFFFAOYSA-N	449.529	1.786	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)CNC(=O)c2cc(Cl)ccn2)c1	1251606299	YZNBHSUKTDNALA-UHFFFAOYSA-N	441.669	1.697	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)[C@@H]1CC12CCS(=O)(=O)CC2	1323637858	XQQNRRWVVYMPGC-ZDUSSCGKSA-N	429.564	1.421	50	20	IDGD	
O=C(NNC(=O)c1n[nH]c2c1CCCC2)c1ccc(I)c(O)c1	1337873908	LFUPSPGWHBSMNJ-UHFFFAOYSA-N	426.214	1.674	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3n[nH]c4c3CC[C@H]4C)C2)C1	1777854020	HIJVTQBUISEGIY-SOZUMNATSA-N	425.327	1.686	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(C)nc4ccc(O)cc34)C2)C1	1778429205	HPKQWSZAPBKUIG-GCJKJVERSA-N	447.919	1.946	50	20	IDGD	
Cn1cc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)c2cccnc21	1778768338	FNVHPSBCZBXNKD-KBXCAEBGSA-N	439.285	1.707	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)c(OC)c1	1779299565	BSBVHZIMMKYIAR-NRFANRHFSA-N	436.581	1.999	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnc(O)[nH]2)C1	1779780846	HHRQRPJWPFJOST-CJBNDPTMSA-N	429.315	1.416	50	20	IDGD	
COc1cc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)cc(Cl)n1	1779796560	POEHTFLSVYCLNX-APPDUMDISA-N	446.729	1.971	50	20	IDGD	
CCOC(=O)c1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](F)Cl)C3)ccn1	1780170998	NZEFHJKEIRCCJP-GQIGUUNPSA-N	441.887	1.920	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(C)nc3O)C2)C1	1780276498	XOUSTKFDQOFOBT-KSSFIOAISA-N	426.311	1.713	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2)c1cccc(F)c1[N+](=O)[O-]	1780997831	GNYCXHQBCJCCPG-QMTMVMCOSA-N	443.859	1.461	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H]1CC(=O)N(Cc3ccccc3)C1)CCO2	1781210958	FEUVPLLJHFLGAM-DNVFCKCGSA-N	447.963	1.882	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(O)c([N+](=O)[O-])c3)CCO2)C1	1781235343	YBWVBDNUOMEADF-QZTJIDSGSA-N	446.287	1.980	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)C3(Br)CC3)C2)C1	1781345871	MBTRFKFOGVILCQ-UONOGXRCSA-N	428.154	1.980	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(O)c(OC)c1)C2	1782173925	TZSUAIUNFZPTCW-RRMPHLOHSA-N	440.924	1.782	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnn3cccnc13)C2)C(Cl)Cl	1782218041	MZRYANANTHNXJN-FZKQIMNGSA-N	426.304	1.661	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](C)CN(CC)CC)C2)C1	1782701721	HIXYBLUMEYIKIG-JTDSTZFVSA-N	432.403	1.968	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccn4cncc4c3)CCO2)C1	1783349969	XKRYBARUVUIMQF-QFBILLFUSA-N	435.322	1.951	50	20	IDGD	
COc1cc(C#N)cc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](C)Br)C3)C2)c1	1783538398	UOUPUWQWLCRPQI-YJYMSZOUSA-N	436.306	1.794	50	20	IDGD	
COC(=O)CCCCCC(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](C)Br)C2)C1	1783539443	JAFDNCROLXVYLL-RDTXWAMCSA-N	433.343	1.723	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/c3ccccc3[N+](=O)[O-])C[C@@H]21)[C@@H](O)CCl	1784096229	BBNNSUZIBQXGAI-OLNGHUQWSA-N	437.880	1.187	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)Cc3cnc(C)s3)C2)C1	1784440864	UHVWLRWPDNECEG-RHSMWYFYSA-N	430.368	1.997	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](C)n3cc(C)cn3)C2)C1	1784451826	NRNYQZAGOIVRQJ-RVKKMQEKSA-N	427.343	1.756	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCC(=O)N3CCCC3)[C@H]2C1	1785002457	YPLJWCBYHGXWCU-VGWMRTNUSA-N	444.370	1.152	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H]1C[C@H](C(=O)N2CC[C@@]3(CN(C(=O)[C@H](F)Cl)CCO3)C2)C1	1785512660	ASMOGDICSFSKNW-MNUAXYBXSA-N	433.908	1.654	50	20	IDGD	
Cc1nc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCBr)[C@H]3C2)cs1	1786401351	YMMFSOXCZZQZKD-QEJZJMRPSA-N	430.368	1.759	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)c1cccc2[nH]ncc12	1787309476	IFVGTYLEUKFNDH-NHJBHEPMSA-N	439.285	1.847	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccn4c(O)nnc34)[C@H]2C1	1787383784	FNIAUSLVGVIOAA-QEJZJMRPSA-N	435.912	1.293	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc4cccn4cn3)[C@H]2C1	1788078993	KHKIOBBFKUZIKD-RMRKRWHISA-N	435.322	1.711	50	20	IDGD	
O=C(NC1(c2ccc(NC(=O)[C@@H](O)N3CCOCC3)cc2)CCC1)[C@@H](F)Br	1789554697	HAAVHAGEDVGGFS-RHSMWYFYSA-N	444.301	1.462	50	20	IDGD	
C=C(CC(=O)OCC)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21	1789890141	ADPSBALULFOYNQ-KKUMJFAQSA-N	431.327	1.261	50	20	IDGD	
Cc1noc(C)c1CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)CBr	1792868620	GRQKIVTVPQKVSB-JAMKOXHTSA-N	428.327	1.455	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(C(C)(C)C)n[nH]1)C2	1792870726	JHVHJDUZTZTTCB-JFILPPLUSA-N	441.370	1.941	50	20	IDGD	
Cc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)CBr)cc1O	1792874102	KWERYXJRZQROHY-FAYQHZLMSA-N	425.323	1.935	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)COC1CCCCC1	1792889527	CBNSKQXBMVKYAU-MUJYYYPQSA-N	429.521	1.286	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](CCO)NC(=O)OC(C)(C)C	1793250841	HYSBJRXNSQOBKJ-JKJDWNRSSA-N	431.961	1.918	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1CCCCC1(F)F	1793716047	IXEXMQBZBMJZBV-UMPJEAMMSA-N	435.475	1.762	50	20	IDGD	
CCn1nc(C)cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)CBr)C2	1796130666	CRPDZQIFNFYPCP-ZIEJDFEHSA-N	427.343	1.446	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2n(n1)CCCC2	1797443043	GIBKFINISJFVHB-IARIHHJXSA-N	439.354	1.596	50	20	IDGD	
CC(C)(C)c1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Br)C3)[nH]n1	1798133757	WNDHATQYGLBVKW-DJBIQUGXSA-N	431.306	1.601	50	20	IDGD	
COc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@](C)(Cl)CCl)C3)c(O)c1	1798836011	MIHMTKMINBAHGP-FIXGWNCBSA-N	431.316	1.840	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(C)cc1-n1nccn1)C2	1799268726	HSDDOLLVWLZJCZ-HIRMHNASSA-N	431.924	1.796	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1ccc(F)nc1)C2	1799274353	ZHLBFPSYXGFTSZ-CSHUHZATSA-N	432.323	1.979	50	20	IDGD	
CN(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H]1C[C@@H]1F)C2)NC(=O)NCc1ccccc1	1799865967	UBYWQWMGOSWOPI-ZRSRNVLSSA-N	431.512	1.329	50	20	IDGD	
CCOC(=O)O[C@@H](C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@](C)(Cl)CCl)C2	1800230988	GVSWVYXHSWSKAW-QHRNJGFCSA-N	425.309	1.374	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccnc3ncccc13)C2	1800762674	XEHULZWJLCVEFI-NFFDBFGFSA-N	433.306	1.616	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2	1800950295	HSJHKMAMMSXTHY-SVZOTFJBSA-N	443.338	1.116	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2	1800959264	KHMNNPUOJLIVSO-FVUFVHQMSA-N	447.301	1.022	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(OC(C)C)c(C#N)c1)C2	1800983127	PLGFDLYKYZOLNO-DMUMMCEESA-N	449.935	1.802	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1=NO[C@@H](c3ccccc3)C1)C2)C(Cl)Cl	1801014992	XCVZQLPUQQUAET-OCVGTWLNSA-N	426.300	1.897	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)COc2ccc(F)cc2)[C@@H]1c1cccnc1)[C@H](O)CCl	1803139322	WUEWIDAWCUNQSB-QKYXUNIQSA-N	435.883	1.905	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccn3nccc3c2)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803142657	GMPFOOTVRGOCTH-YTQUADARSA-N	427.892	1.649	50	20	IDGD	
N#Cc1ccccc1OCC(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1	1803147279	FGWGQIYCEYYXRS-LQWHRVPQSA-N	442.903	1.638	50	20	IDGD	
O=C(Cn1cc([N+](=O)[O-])cn1)NC[C@H]1CCN(C(=O)C(Cl)Cl)[C@@H]1c1cccnc1	1804421299	PAYOUDMFZVJDHB-IUODEOHRSA-N	441.275	1.696	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC2(CCCN(C(=O)C3CCC(CO)CC3)C2)CC1	1806729075	PCJRYFIVAZBMPZ-UHFFFAOYSA-N	436.597	1.389	50	20	IDGD	
Cc1[nH]ccc1C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1807375447	PFMCBYPYWRSUOS-GHTZIAJQSA-N	432.289	1.031	50	20	IDGD	
CC1(C)CC(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)C1	1807375777	VMPXZRJWNKWDQB-NQIIRXRSSA-N	435.333	1.517	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)CCN2C(=O)C=CC2=O)[C@@H]1c1cccnc1	1808249825	DMSUJZNTTNUEBG-TWOQFEAHSA-N	432.908	1.420	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)CCN2CCOC2=O)[C@H]1c1cccnc1	1809531012	BBVNQLQWERRCTR-SOLBZPMBSA-N	438.912	1.184	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2cc3n(n2)CCCO3)[C@@H]1c1cccnc1	1809868729	XHCHYBLXJYNWJN-BXWFABGCSA-N	447.923	1.634	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC2(CCCN(C(=O)c3noc4c3CCCC4)C2)CC1	1810582578	LIQSHEBNQPVABD-UHFFFAOYSA-N	445.564	1.771	50	20	IDGD	
N[C@@H](Cc1cccnc1)C(=O)N1CC[C@@H](CNC(=O)C(Cl)Cl)[C@@H]1c1cccnc1	1813080875	ZSDIBAHIUYXVMG-ULQDDVLXSA-N	436.343	1.856	50	20	IDGD	
COCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)CC2	1813753378	PCRCEYWMADPLOX-NSHDSACASA-N	448.457	1.849	50	20	IDGD	
Cc1nscc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1	1817470778	GUYRSDLYZTZVJD-QGZVFWFLSA-N	439.306	1.474	50	20	IDGD	
Cc1ccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)c(O)n1	1817472285	PWTNNJSEHZWQFC-GOSISDBHSA-N	449.276	1.118	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@H]2CCCSC2)[nH]n1)c1ccc(B(O)O)cc1	1817475063	KHMCWJDSBCQUSI-YJBOKZPZSA-N	442.350	1.539	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)C2CN(C)C2)[nH]n1	1818114051	DZZVZEUCJVOSGG-ZRWQFTNJSA-N	440.508	1.097	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](C)CBr)CC2	1820134007	CQFJSVYMUOUXAU-GMTAPVOTSA-N	443.367	1.777	50	20	IDGD	
C[Si](C)(C)OCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H]1CCCS1(=O)=O)CC2	1820169672	REYLJYZJBBWCEN-SMDDNHRTSA-N	445.639	1.484	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1cc(F)c[nH]1	1822236056	BEWAENKXRQAPCU-QGZVFWFLSA-N	425.229	1.176	50	20	IDGD	
Cc1nn(C)c(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)c1F	1822412644	AMXZUCHXFAWPSG-CQSZACIVSA-N	448.503	1.270	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2[C@H]3C=CS[C@H]32)[nH]n1	1822416361	BQTFFCONSKBMGX-NTSITTNCSA-N	432.550	1.650	50	20	IDGD	
CC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)COc1ccc(O)nn1)CC2	1822855733	PBYCFNUQKYQXTP-NXEZZACHSA-N	425.898	1.647	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCS(C)(=O)=O)CC2	1822870089	RUFIDSARVSXKAH-VFZGTOFNSA-N	442.390	1.726	50	20	IDGD	
Cc1cn(CC(=O)Nc2cc([C@@H]3CCCCN3C(=O)[C@@H](F)Cl)[nH]n2)c(=O)nc1O	1823366825	DIENOWYPMMDAKV-SMDDNHRTSA-N	426.836	1.207	50	20	IDGD	
C[C@@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1)n1ccnc1	1824312923	NURFUAREZGAEGL-LAUBAEHRSA-N	438.337	1.057	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H]3CCNC(=O)C3)sc2C1	1826222412	XESLVYLDMJEELF-YHTYYEMMSA-N	433.361	1.818	50	20	IDGD	
CCOc1ncccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](Cl)CC)C2)C1	1829542479	ZKRMPHUBFODQBL-UZLBHIALSA-N	425.913	1.568	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(F)cc3)C2)C1	1830543436	RYRAWJTURKTMHY-LIRRHRJNSA-N	443.313	1.927	50	20	IDGD	
CC[C@H](C)CC(=O)N1CCO[C@@]2(COCCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)C1	1831050759	CCJFJSWPHGLKON-ZUHXEFHUSA-N	447.536	1.013	50	20	IDGD	
COCc1c[nH]c(C(=O)N2CCC([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)c1	1831873608	PUQHTNOHMKOGNC-FQEVSTJZSA-N	447.580	1.767	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H]2[C@@H]3C=CS[C@@H]23)CC1	1831874581	KIBKVHSDCKIKPO-XWDORNJCSA-N	434.606	1.854	50	20	IDGD	
CC(=O)N1CCN(CC(=O)N2CCC([C@@H]3CCCCN3C(=O)C(Cl)Cl)CC2)CC1	1831877798	LYMBKJCTVRAAEU-KRWDZBQOSA-N	447.407	1.574	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)CSc2nc[nH]n2)CC1	1832151736	FSILZNZKFBNFQV-LSDHHAIUSA-N	429.974	1.770	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)COC(C)(C)C)CCO2)C1	1832306921	KEYHUSOFDGFYGN-KBXCAEBGSA-N	435.359	1.289	50	20	IDGD	
COc1ccc(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)cn1	1832580959	RPUZYJYBBRHCDR-HKUYNNGSSA-N	429.876	1.014	50	20	IDGD	
Cc1nc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)ccc1F	1833465510	DHJYMSHNDMPOJW-WMLDXEAASA-N	448.264	1.290	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)C(=O)NCC(C)C)CC2)CC1	1833532890	PRYICKHZTXJCLI-SFHVURJKSA-N	429.005	1.738	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3ccc(O)cn3)CC2)CC1	1834337838	LIMUOJHHOQOYBV-CYBMUJFWSA-N	439.354	1.756	50	20	IDGD	
O=C(CCc1ccccc1)N1CCOC[C@@]2(C1)CN(C(=O)CCBr)CCO2	1834822250	DXGYBVTTXOPFEK-HXUWFJFHSA-N	439.350	1.861	50	20	IDGD	
O=C(CCc1ccccc1Cl)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1	1835173074	OSVFOCGMJCKEMP-FXAWDEMLSA-N	445.343	1.329	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cnn4ccccc34)CC2)CC1	1835309362	HEMHDCVWQVSUBP-IBGZPJMESA-N	447.967	1.773	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccsc3)CCO2)C1	1836095007	NQWZUORPIYOQLJ-KSSFIOAISA-N	445.379	1.778	50	20	IDGD	
CCOC(=O)/C=C/C(=O)N1CCC(N2CCC(NC(=O)[C@](C)(Cl)CCl)CC2)CC1	1836398775	UKJFPHJOROPILL-DPZZJQGRSA-N	448.391	1.914	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)c3cc(O)n[nH]3)CC2)CC1	1837904033	MUKHTSUTEVGQRJ-CQSZACIVSA-N	443.342	1.901	50	20	IDGD	
CC(C)n1nccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1838025012	ANOVRIPIVMLXSW-PBHICJAKSA-N	447.305	1.225	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cnn4ccncc34)CC2)CC1	1838249821	NCIUMOPVDKNGTR-GOSISDBHSA-N	449.939	1.595	50	20	IDGD	
O=C(c1ccn(-c2ccccc2)n1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1838745083	HALAAOPXAOAUFS-YLJYHZDGSA-N	436.871	1.477	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccnc(OC)c3F)C2)C1	1839144373	WOHLTTSJQGBMEW-IFXJQAMLSA-N	429.876	1.317	50	20	IDGD	
Cc1csc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)c1	1839198763	NOZQGAJIDXBSMR-BBRMVZONSA-N	435.315	1.817	50	20	IDGD	
CC(C)=NO[C@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1	1839226339	LTGCUUZVVOKZOH-ZTFGCOKTSA-N	438.352	1.480	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C=C/c3ccco3)C2)C1	1839962832	RZAWHCKWZUYEHA-RIOIIYTLSA-N	441.322	1.923	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccc(F)cc3F)CCO2)C1	1839980115	ZIRQWDHILLOUSS-JXFKEZNVSA-N	446.878	1.218	50	20	IDGD	
Cc1cccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)c1F	1840030753	VSYTVGGIZLSYKZ-AUUYWEPGSA-N	443.313	1.988	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CC3CCOCC3)C2)C1	1840032122	OEBFYLOEAYEMCH-KDOFPFPSSA-N	433.343	1.043	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)C(=O)OCC)CCO2	1840882484	ONWKGRNURZGHPV-MGPUTAFESA-N	432.945	1.440	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC2(CCCN2C(=O)CNC(=O)c2cccs2)C1	1842063250	MEHYJHPOOWXVPR-LBPRGKRZSA-N	428.352	1.712	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)Cn1cc(C)cn1)C2	1844692443	XWVHDECJWUJMBI-UHFFFAOYSA-N	441.444	1.542	50	20	IDGD	
COc1ccc(CNC(=O)CCC(=O)N2CCCC23CN(C(=O)[C@@H](F)Cl)C3)cc1	1845822855	SFBNAHPSRNKWFC-GOSISDBHSA-N	425.888	1.829	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1nc2ccccc2n(C)c1=O	1847501918	ZUAHDQYZBGPRHQ-KCXAZCMYSA-N	447.333	1.780	50	20	IDGD	
O=C(c1cnc2cc(C(F)(F)F)ccn12)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl	1847562295	AUBMLBHGVURZJQ-SGMGOOAPSA-N	430.814	1.768	50	20	IDGD	
CC(C)(C)OC(=O)N1CC2(C[C@@H]2C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](O)CCl)C1	1847563992	SXHSYGISHOQRHA-QPSCCSFWSA-N	427.929	1.045	50	20	IDGD	
O=C(COC(=O)c1ccc(Cl)cc1[N+](=O)[O-])NNC(=O)[C@@H]1COc2ccccc2O1	10748408	PDYSFASCRSMDMW-HNNXBMFYSA-N	435.776	1.392	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)c2ccc(CCNS(C)(=O)=O)cc2)cc1	18071841	HKVABVDUENFHOH-HNNXBMFYSA-N	449.529	1.406	50	20	IDGD	
O=C(C[C@@H]1CCS(=O)(=O)C1)NNC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1	46775084	YKMSZBYVLDFRHU-HNNXBMFYSA-N	439.497	1.520	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)C[C@H]2C(=O)Nc3ccccc32)c1	116343638	BRHBXZOVILOHCB-QGZVFWFLSA-N	444.513	1.604	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)Cn2nc(-c3ccccc3)oc2=O)c2ccccc2c1=O	726086730	NPUCWOJHVYPCCM-UHFFFAOYSA-N	448.439	1.255	50	20	IDGD	
CC(=O)N1CCN(c2ccccc2CNC(=O)NNC(=O)Cc2c[nH]c3ccccc23)CC1	726274541	QZKQBACIQDYJII-UHFFFAOYSA-N	448.527	1.910	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)CNC(=O)c1cc(-c2ccccc2)on1	726522501	NFRQWGQMCKTLKO-UHFFFAOYSA-N	446.467	1.831	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN(C)CC(=O)Nc2cc(F)cc(F)c2)cc1OC	727435699	XXLOISSGKFEDRK-UHFFFAOYSA-N	436.415	1.314	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)c2ccc(S(=O)(=O)N(C)OC)cc2)cc1F	727500144	UDHURLDWPUKMOR-UHFFFAOYSA-N	442.494	1.648	50	20	IDGD	
C#Cc1cccc(NC(=S)NNC(=O)c2ccc(S(=O)(=O)NCCC#N)cc2)c1	727501210	NKLQYRYEMVIUMN-UHFFFAOYSA-N	427.511	1.491	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)N[C@@H](C)c1cccc(S(=O)(=O)N(C)C)c1	727610877	VXBJZXDWYYOMQX-ZDUSSCGKSA-N	444.517	1.598	50	20	IDGD	
O=C(NNC(=S)NC1CCOCC1)c1nn(Cc2ccccc2)c(=O)c2ccccc12	727780494	MZUTUPODFVQQED-UHFFFAOYSA-N	437.525	1.733	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)[C@H]2CSCN2C(=O)CC(C)(C)C)c2ccccc2c1=O	728150860	MLZRZNAEDGGVMU-CQSZACIVSA-N	431.518	1.032	50	20	IDGD	
Cc1ccc(-n2nnc(C(=O)OCC(=O)NNC(=O)Cc3nc(C)cs3)c2C)cc1	728732653	LTRKHGFRFKFHQO-UHFFFAOYSA-N	428.474	1.196	50	20	IDGD	
CC(C)[C@H](NC(=O)c1cccs1)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	728845370	INTINACTUOJFNX-INIZCTEOSA-N	430.534	1.357	50	20	IDGD	
O=C(NCc1ccc(-n2ccnc2)c(F)c1)NNC(=O)C1CCN(c2ncccn2)CC1	728950235	HFRRCKYSNFXVSX-UHFFFAOYSA-N	438.467	1.548	50	20	IDGD	
O=C(CN1C(=O)CCOc2ccccc21)NNc1ccc(S(=O)(=O)C(F)F)cc1	728974481	PWPGVSOGUFTPJY-UHFFFAOYSA-N	425.413	1.942	50	20	IDGD	
Cc1cc(S(C)(=O)=O)c(C)c(S(=O)(=O)NNC(=O)c2cccc(OC(F)F)c2)c1	730203197	IXNDHLUJSRHAMX-UHFFFAOYSA-N	448.469	1.932	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)CCCc1ccc2nc(O)[nH]c2c1	730205262	KKRGUCKPYDZADZ-UHFFFAOYSA-N	444.517	1.654	50	20	IDGD	
O=C(CCC/N=C1/NS(=O)(=O)c2ccccc21)NNC(=O)c1cccc2ncccc12	730228058	YQHLMNSOSPEALL-UHFFFAOYSA-N	437.481	1.515	50	20	IDGD	
O=C(NCCS(=O)(=O)N1CCSCC1)NNC(=O)c1c(Cl)cccc1Cl	730581716	QGFRMVNCELCHLV-UHFFFAOYSA-N	441.362	1.316	50	20	IDGD	
CCc1ccc(-n2nc(C(=O)NNC(=O)N[C@H]3CCS(=O)(=O)C3)c3c2CCC3)cc1	730774253	TZUOESIIFOCXRX-AWEZNQCLSA-N	431.518	1.055	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@H]2CCOc3ccccc32)c1	731284561	AEWPDPUHDZQQFC-OAHLLOKOSA-N	432.502	1.447	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)c2nn(-c3ccc(F)cc3)ccc2=O)o1	731618622	ROFIDJBPZLHUSU-UHFFFAOYSA-N	427.436	1.881	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1)c1ccc([N+](=O)[O-])cc1	732049393	UFLALBKSHZUJLM-GFCCVEGCSA-N	433.402	1.630	50	20	IDGD	
NS(=O)(=O)c1ccc(OCCSCC(=O)NNc2nc(-c3ccccc3)no2)cc1	732113572	YFCPKMRDRZDSMI-UHFFFAOYSA-N	449.514	1.639	50	20	IDGD	
CCN(Cc1nc(O)c2cc(OC)c(OC)cc2n1)[C@H](C)C(=O)NNC(=O)CC(C)C	732194894	DHLYKUVDEVYIKX-CYBMUJFWSA-N	433.509	1.757	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCCC(=O)NNc2ccccc2S(C)(=O)=O)cc1C	732305771	RGUBDJHRTIGLEQ-UHFFFAOYSA-N	425.532	1.519	50	20	IDGD	
Cc1ccc(C)n1-c1c(C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cnn1C	732331432	ZFQUWHFJDSAGCS-UHFFFAOYSA-N	440.416	1.354	50	20	IDGD	
COc1cc(C(=O)NNc2ccc(Br)nc2)cc(OC)c1OCC(N)=O	732838742	YMACDLGXFWXNMD-UHFFFAOYSA-N	425.239	1.482	50	20	IDGD	
CCOCCCn1c(NNC(=O)c2cnc3sccn3c2=O)nc2ccccc2c1=O	733269007	XDYSGAOGEXGCGQ-UHFFFAOYSA-N	440.485	1.649	50	20	IDGD	
COCCOc1ccc(-n2nc(C)c(C(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)n2)cc1	735027795	BJDGJJKYKFGZDY-UHFFFAOYSA-N	440.416	1.584	50	20	IDGD	
CC(=NNC(=O)c1c[nH]nc1C)c1ccc(S(=O)(=O)N2CCC(C(=O)O)CC2)cc1	735411583	KAYORRMXSRCFCB-UHFFFAOYSA-N	433.490	1.357	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)N[C@@H]2CCN(c3cnn(C)c3)C2=O)c(C)n1C[C@H]1CCCO1	735447904	GWHXHLXQKKXKSP-NGVKPMOPSA-N	436.516	1.846	50	20	IDGD	
CCc1ccc([C@H]2COCCN2C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)o1	736387637	UCCZFWGXWYAPCD-QGZVFWFLSA-N	428.493	1.663	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)[C@H]2CC(=O)N(CC(F)(F)F)C2)cc1C	736779211	YCMXDQSJCMOESY-JTQLQIEISA-N	435.424	1.334	50	20	IDGD	
CC(C)(CCC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)NC(=O)OC(C)(C)C	737501356	AMGONGWOCCSYEX-UHFFFAOYSA-N	427.523	1.935	50	20	IDGD	
Cc1c(C)c(C)c(S(=O)(=O)NCCC(=O)NNc2ccnc(N(C)C)n2)c(C)c1C	740107951	RLGLCELJVDISRE-UHFFFAOYSA-N	434.566	1.896	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)CCc1nc(O)c2c3c(sc2n1)C[C@H](C)CC3	740853317	NWYGUGPXQCFSCI-LLVKDONJSA-N	447.561	1.907	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)N[C@@H]2CCC[C@H](S(C)(=O)=O)C2)cc1	741094007	VPSPGYNVGWTNPD-CPUCHLNUSA-N	427.523	1.539	50	20	IDGD	
COc1ccc(-c2n[nH]c(CNC(=O)NNC(=O)c3ccc(OC)c(OC)c3)n2)cc1	741418610	OZHFKHZIYTXFSX-UHFFFAOYSA-N	426.433	1.642	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN(C)Cc2cc3c(cc2OC(F)F)OCO3)n1	741793228	IAPPISGPKOLJHD-UHFFFAOYSA-N	442.444	1.604	50	20	IDGD	
C[C@H](CC(=O)NNC(=O)CCCc1ccccc1)/N=C1/NS(=O)(=O)c2ccccc21	742627880	LHLINEJPNNEQSE-OAHLLOKOSA-N	428.514	1.674	50	20	IDGD	
O=C(C[C@@H]1CN(Cc2ccccc2)CCO1)NNC(=O)c1nn(-c2ccccc2)cc1O	743293424	ZACSVWRDEVALCC-LJQANCHMSA-N	435.484	1.630	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])cc2c1OCCO2)c1cc(Br)ccc1O	743732385	SUONFYLXTPLHSZ-UHFFFAOYSA-N	438.190	1.909	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)CCCc2nc(O)c3ccccc3n2)cc1	744610789	HPFDLAWORDZGEG-UHFFFAOYSA-N	433.424	1.534	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)COc2ccc(C=O)cc2Br)c1	745587798	DRCLSWSWTWDBKN-UHFFFAOYSA-N	449.257	1.953	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Cc2cn3ccccc3n2)cc1S(=O)(=O)NC(C)C	746556077	MDPQARZXZPRDTP-UHFFFAOYSA-N	445.501	1.033	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(CNC(=O)NNc2cc(F)c(F)c(F)c2)cc1	746760706	ZNRYQYZICXQVOK-UHFFFAOYSA-N	432.424	1.855	50	20	IDGD	
COc1cc(OC)cc(N2CC[C@H](NC(=O)NNC(=O)c3ccccc3OC)C2=O)c1	747954790	MBJATGPXAKYQBE-KRWDZBQOSA-N	428.445	1.462	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2C[C@@H](CCN3CCCC3=O)c3ccccc32)n1	751485732	PMGXXJDMKXWMAS-MRXNPFEDSA-N	441.557	1.758	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCC2(CN3CCOCC3)CCCCC2)cc1OC	751606835	MSCOAYRIDCUWRC-UHFFFAOYSA-N	434.537	1.931	50	20	IDGD	
C[C@H](NC(=S)NNC(=O)C1CCN(S(=O)(=O)c2cc(F)ccc2F)CC1)C1CC1	751618124	CSOLYQDMVRRREM-NSHDSACASA-N	446.545	1.659	50	20	IDGD	
COc1cc2c(cc1OC)CN(C(=O)CCCNC(=O)NNC(=O)c1ccc(C)o1)CC2	752372852	SHLVHVDILZVHNC-UHFFFAOYSA-N	444.488	1.914	50	20	IDGD	
CC[C@@H](CS(=O)(=O)c1ccccc1)NC(=O)NNC(=O)c1cc(OC)cc(OC)c1	752702775	FFBNNDDKYPAWLV-HNNXBMFYSA-N	435.502	1.900	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)NCC2(CS(C)(=O)=O)CC2)N(C)c2ccccc21	752729138	OSVMBADJCBVJJQ-UHFFFAOYSA-N	430.530	1.598	50	20	IDGD	
Nc1nc(Cl)cc(NNC(=O)C2CCN(S(=O)(=O)/C=C/c3ccccc3)CC2)n1	753454553	IEKOLKQGEWKGQU-DHZHZOJOSA-N	436.925	1.868	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)Cc1ccc([N+](=O)[O-])cc1Br	755266731	HBHNNZULOMDBPD-UHFFFAOYSA-N	425.195	1.070	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)Nc1ccc(C(=O)NC2CCCC2)cc1	756019864	VXKCFPFAQFCNGP-UHFFFAOYSA-N	434.460	1.801	50	20	IDGD	
COCCOc1ccc(F)cc1NC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	756331135	UZLPPCYQYJXGFU-UHFFFAOYSA-N	425.438	1.721	50	20	IDGD	
COCc1nc2n(n1)C[C@@H](NC(=O)NNC(=O)Nc1ccc(OC(F)F)cc1)CC2	757774790	IBMIHWHCJILKJR-NSHDSACASA-N	425.396	1.377	50	20	IDGD	
O=C(c1scnc1Br)N1CCN(S(=O)(=O)CBr)CC1	758521933	ARNQHUDEECXZFU-UHFFFAOYSA-N	433.147	1.346	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(C(=O)NNc2ncccc2[N+](=O)[O-])cc1Br	759290348	DYBASHHNCVCXJR-UHFFFAOYSA-N	444.267	1.760	50	20	IDGD	
C[C@H](NC(=O)OC(C)(C)C)[C@H]1CN(CC(=O)NNC(=O)c2cccc(Cl)c2)CCO1	760975437	QVZOLVXVYJEFOV-XJKSGUPXSA-N	440.928	1.715	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)CN2C(=O)N[C@@](C)(c3ccc(C)cc3)C2=O)n1	762901434	LBVIOSNRFPVGOZ-NRFANRHFSA-N	425.493	1.542	50	20	IDGD	
O=C(NNC(=O)c1cc2ccccc2cc1O)C(=O)Nc1ccn(CCc2ccncc2)n1	763527767	PFWZZIWWDJGUQM-UHFFFAOYSA-N	444.451	1.779	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)C(=O)Nc1ccc(F)cc1Cl	763532336	VSQRPQNYZKXOKM-UHFFFAOYSA-N	447.898	1.777	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(N2CCOC2=O)cc1	763682941	RTUOCHVMOAAEBN-UHFFFAOYSA-N	442.428	1.207	50	20	IDGD	
CCN(CC)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)cc1	763808686	PDEWZDYRXFOHIZ-UHFFFAOYSA-N	437.456	1.205	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cc(C)nn2-c2ccccc2F)cc1	763810088	ZQHHUWMUIHCPJX-UHFFFAOYSA-N	425.420	1.793	50	20	IDGD	
COC(=O)c1ccc(OC)cc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1cccc(C)c1C	763851066	QGRRRGOSVGGRTG-AWEZNQCLSA-N	443.456	1.652	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cccc(C(=O)NC)c2C)cc1	763859803	FXHWRIWIMCAYHS-AWEZNQCLSA-N	442.472	1.307	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccnn2C2CCCC2)cc1	763862537	XXWXOGNLBRSMDW-AWEZNQCLSA-N	429.477	1.950	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)OC)c(F)c2)cc1	763862594	YKJSZVJJRXCMKI-GFCCVEGCSA-N	447.419	1.564	50	20	IDGD	
C[C@H]1CN(Cc2ccccc2NC(=O)C(=O)NNC(=O)Cc2ccc(F)cc2)C[C@H](C)O1	763918966	NNCVRBRQQMQWEN-HOTGVXAUSA-N	442.491	1.764	50	20	IDGD	
O=C(NNC(=O)c1ccc[nH]1)C(=O)Nc1cc(Br)ccc1N1CCOCC1	763979629	PCFYORZNWNYRIL-UHFFFAOYSA-N	436.266	1.014	50	20	IDGD	
CN(C)CCOc1cccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)on2)c1	764003356	GLEYJUBMYKSLKP-UHFFFAOYSA-N	437.456	1.682	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)N3CCC(C)CC3)cc2)c(O)c1	764108534	JOCGDVDHUDSNBI-UHFFFAOYSA-N	438.484	1.972	50	20	IDGD	
CCN(CC)C(=O)COc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(C)cc2O)c1	764111861	RSOXXNLUYWTRJO-UHFFFAOYSA-N	442.472	1.348	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(OC[C@H]3CCCO3)cc2)c1O	764133942	ZFYVYDDGXUCYCU-OAHLLOKOSA-N	429.429	1.358	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2O1)C(=O)Nc1cc(N2CCCC2=O)ccc1F	764153109	IROOOFFYUOWQJU-QGZVFWFLSA-N	426.404	1.042	50	20	IDGD	
O=C(CCC1CCCCC1)NNC(=O)C(=O)Nc1cccc(CN2C(=O)CNC2=O)c1	764215534	XSQHITVYLXSLJY-UHFFFAOYSA-N	429.477	1.185	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2cccs2)[nH]n1)C(=O)Nc1cc2c(cc1Cl)OCO2	764376348	BRTRLXIRLYMMNO-UHFFFAOYSA-N	433.833	1.920	50	20	IDGD	
COC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)cc1	764382414	JSUHBDRUFFIHNW-UHFFFAOYSA-N	428.430	1.716	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(Oc2ccc(C)c(C)c2)nc1	764398339	FRGBKPXDNDMJLX-OAHLLOKOSA-N	430.461	1.628	50	20	IDGD	
C[C@H](NS(=O)(=O)c1ccc(C#N)cc1)C(=O)NNC(=O)Cc1cccc2ccccc12	764639115	DETNILHQKZNPPM-HNNXBMFYSA-N	436.493	1.768	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1cccc(C#N)c1)C(=O)NNC(=O)Cc1cccc2ccccc12	764643569	ZIJRYKWHORSASV-OAHLLOKOSA-N	436.493	1.768	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@]2(CCN(CC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)C2)C1	765028601	CYFWYMCCQRALJD-NRFANRHFSA-N	447.492	1.689	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)NCc1cccc(N2CCCS2(=O)=O)c1	765304313	IWFNNGZIQIKKDH-UHFFFAOYSA-N	432.502	1.308	50	20	IDGD	
CC(C)(C)OC(=O)NNC(=O)C(=O)Nc1cccc(NC(=O)CN2CCCCCC2)c1	765399025	RVGJHRPSRFWQRZ-UHFFFAOYSA-N	433.509	1.996	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(CCC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)CC1	765543568	UURGEVCXEXGFDS-UHFFFAOYSA-N	443.508	1.851	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)c3ccc(F)c(S(N)(=O)=O)c3)n[nH]2)cc1	765575933	OAKTXRJDZZAEQE-UHFFFAOYSA-N	431.449	1.500	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)c3ccc(CNS(C)(=O)=O)o3)n[nH]2)c1	765577977	ZKNHSHDHECKGIN-UHFFFAOYSA-N	431.474	1.411	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1)c1ccc(CN2C(=O)CCC2=O)cc1	765608099	UDCNMNQPOTVMOY-UHFFFAOYSA-N	435.415	1.940	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1cc(Cl)c2c(c1)OCO2	765736900	CCCOFLVMLDPQJT-UHFFFAOYSA-N	444.875	1.288	50	20	IDGD	
O=C(NNc1cnccn1)C(=O)Nc1ccc(CN2CCN(Cc3ccccc3)CC2)cc1	766259897	GWCNRPBFPBDXCQ-UHFFFAOYSA-N	445.527	1.876	50	20	IDGD	
COc1ccc(N2C[C@H](C(=O)NNc3ccccc3S(C)(=O)=O)CC2=O)c(OC)c1	766662205	KHNBWAZQWRRPHX-CYBMUJFWSA-N	433.486	1.604	50	20	IDGD	
O=S(=O)(CBr)N1CCN(S(=O)(=O)c2cccc3cccnc23)CC1	767849566	GPHJMWCKMDZIGM-UHFFFAOYSA-N	434.337	1.223	50	20	IDGD	
CC(C)c1cc(NC(=O)C(=O)NNC(=O)Cc2ccc(Cl)cc2)n(-c2ncccn2)n1	768236951	HGJWHTGHOSWWNV-UHFFFAOYSA-N	441.879	1.768	50	20	IDGD	
CN(C)C(=O)c1cc(F)ccc1NC(=O)C(=O)NNC(=O)CN1CCCc2ccccc21	768237411	JZZHVLAOKHCIOR-UHFFFAOYSA-N	441.463	1.066	50	20	IDGD	
Cc1nn(-c2ccc(S(N)(=O)=O)cc2)c(C)c1CCC(=O)NNc1ccnc(F)c1	768417465	QIWRWZAKTVBGNK-UHFFFAOYSA-N	432.481	1.747	50	20	IDGD	
O=C(NCc1cc2cc(Br)ccc2[nH]1)NNC(=O)C(=O)Nc1ccccn1	768519366	NKOWFWKKLHXUED-UHFFFAOYSA-N	431.250	1.795	50	20	IDGD	
CC1(CNC(=O)/C(C#N)=C/c2cn(CCC(N)=O)nc2-c2ccc(Cl)cc2)OCCO1	769021853	CVXRTWXXQRGZDV-XNTDXEJSSA-N	443.891	1.865	50	20	IDGD	
COc1ccc(NC(=O)NNc2c(OC)cccc2S(C)(=O)=O)cc1-n1cnnn1	769241876	QUANAWJAQJABDH-UHFFFAOYSA-N	433.450	1.232	50	20	IDGD	
Cc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c1Br	769268097	VKOXOGQZLGPIOJ-UHFFFAOYSA-N	444.249	1.133	50	20	IDGD	
COc1ccc(Cl)cc1N1C[C@@H](C(=O)NNC(=O)C(=O)Nc2ccc(C)cc2)CC1=O	769686043	WGSPHDSNHAYDET-ZDUSSCGKSA-N	444.875	1.796	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)c2cc(Br)ncc2[N+](=O)[O-])c1	769841437	ZEUXZDIEBAJSQM-UHFFFAOYSA-N	448.189	1.242	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)N1CCS(=O)(=O)[C@H]2CCCC[C@H]21	770649190	MZTYOSNGRLZDNJ-MAZHCROVSA-N	429.926	1.890	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)Nc2cc(C(=O)OC)ccn2)c2ccccc2c1=O	770684359	ZBPKLGAAYPWBBX-UHFFFAOYSA-N	438.444	1.845	50	20	IDGD	
CCc1nn(C)c(OC)c1CNC(=O)NNC(=O)c1ccc(OC)c(Br)c1	771981874	VRDYQMMRUAHGQU-UHFFFAOYSA-N	440.298	1.906	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)[C@H](c1ccc(Cl)cc1Cl)N1CCOCC1	772160324	CEHKKIGSTRDWMX-ZBEGNZNMSA-N	432.304	1.856	50	20	IDGD	
O=C(COc1ccc(Cl)cc1)NNC(=O)Nc1cnn(Cc2nnc3n2CCCC3)c1	772635656	FQAOZQRGZWAEEL-UHFFFAOYSA-N	444.883	1.744	50	20	IDGD	
COc1ccc(/C=C\C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cc1O	773389051	DRRDLFLGEKHJTC-NTMALXAHSA-N	438.484	1.019	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)C(=O)Nc2ccccc2OCC(=O)Nc2cccnc2)n1	773478561	JCMCVLQPEVHHRN-UHFFFAOYSA-N	435.444	1.588	50	20	IDGD	
CCN(CC)C(=O)Cn1ccc2cc(NC(=O)C(=O)NNc3nc(C)cc(C)n3)ccc21	773481112	PSCZNEOKAQIFOA-UHFFFAOYSA-N	437.504	1.998	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1cccc2c1oc(=O)n2C	774006158	BJMIVAMVINEHBF-SNVBAGLBSA-N	432.820	1.338	50	20	IDGD	
O=C(NNC(=O)c1cc2ccccc2cc1O)Nc1ccnn1[C@@H]1CCS(=O)(=O)C1	776055914	JMBPNBZEZDPHPK-CQSZACIVSA-N	429.458	1.568	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2ccc(Cl)cc2O)nc1	776061876	QFANYBQMKSFJCG-UHFFFAOYSA-N	441.897	1.984	50	20	IDGD	
CSCC[C@@H](C(=O)NNc1cccc(S(C)(=O)=O)c1)N1C(=O)c2ccccc2C1=O	776541217	LELUFIMUPJOKGQ-KRWDZBQOSA-N	447.538	1.951	50	20	IDGD	
O=C(NNC(=O)N1CC[C@H](n2cncn2)C1)[C@H]1Cc2ccccc2CN1Cc1ccccc1	776868313	ZGHDKCRTHUTMEB-FCHUYYIVSA-N	445.527	1.893	50	20	IDGD	
Cc1c(Cl)cccc1OCC(=O)N1CCN(S(=O)(=O)CBr)CC1	777838201	UEWUIGKILBQKNX-UHFFFAOYSA-N	425.732	1.854	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1cnc(C(F)(F)F)nc1	778445666	NTLURBYKLPLIKE-UHFFFAOYSA-N	432.742	1.775	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)N[C@H](CO)c1ccc(C(F)(F)F)cc1	778588535	IKNNDOJNPNWOAI-OAHLLOKOSA-N	435.366	1.359	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1ccc(-c2ccccc2OC(F)(F)F)o1	781919331	CEMHAYFSEOTAKZ-VIFPVBQESA-N	435.380	1.544	50	20	IDGD	
COC(=O)c1scc(C)c1NC(=O)C(=O)NNC(=O)c1cc(-c2ccccc2)[nH]n1	782121668	RMOTVXGEGJHUMH-UHFFFAOYSA-N	427.442	1.633	50	20	IDGD	
CS(=O)(=O)c1c(Cl)cccc1NC(=O)C(=O)NNc1ncnc2ccsc12	783253092	GRPUSVGFQUGFBX-UHFFFAOYSA-N	425.879	1.830	50	20	IDGD	
O=C(NNc1ncnc2ccsc12)C(=O)Nc1ccc(NC(=O)[C@@H]2CCCO2)cc1	783262811	QICXSDVKTSEWBZ-AWEZNQCLSA-N	426.458	1.891	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2ccc(Oc3ccc(Cl)cc3)nc2)CCS(=O)(=O)C1	783427907	UFBNBWHMENMTDB-GOSISDBHSA-N	438.893	1.664	50	20	IDGD	
C[C@H]1CCC[C@@H](OCc2cccc(NC(=O)C(=O)NNC(=O)C(=O)N3CCCC3)c2)C1	784003259	SJPXKHICYCKCCX-MAUKXSAKSA-N	430.505	1.490	50	20	IDGD	
CNC(=O)c1ccc(NC(=O)C(=O)NNc2ccc(Br)cn2)cc1Cl	784338905	GYXRQARCPNXAOX-UHFFFAOYSA-N	426.658	1.939	50	20	IDGD	
CN(C)CCc1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)cc1	784832657	CMDSSRKAMVCOJI-UHFFFAOYSA-N	440.472	1.869	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)cc1Br	785024434	UZGJEEFFBBNNTF-UHFFFAOYSA-N	437.206	1.771	50	20	IDGD	
CCN(CC)C(=O)c1ccc(NC(=O)C(=O)NNc2nccc(N(CC)CC)n2)cc1	785226999	MMFLIPFFHPTDJU-UHFFFAOYSA-N	427.509	1.887	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccc(C)c(C(=O)N(C)C(C)C)c1	787543621	ZMIWDMFYIHKNLT-UHFFFAOYSA-N	440.500	1.813	50	20	IDGD	
C[C@@H]1[C@H](C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)CCN1C(=O)OC(C)(C)C	787993212	OKJBLBNWGDMTKH-UKRRQHHQSA-N	429.477	1.984	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)n(Cc2ccccc2)n1	789810885	SKDWFUHHENAADR-FPOVZHCZSA-N	447.495	1.898	50	20	IDGD	
COC(=O)c1cc(Cl)cc(S(=O)(=O)NNC(=O)c2ccc3c(c2)OCO3)c1OC	790048883	AOJMPHBUOQNUNY-UHFFFAOYSA-N	442.833	1.487	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)c1cc(S(=O)(=O)N(CC)CC)ccc1Cl	790064206	WMZZXCPCTMFSFB-UHFFFAOYSA-N	449.957	1.921	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNc2ncccc2C)cc1S(=O)(=O)N1CCCC1	792375732	MBKGWPJLAHPFLM-UHFFFAOYSA-N	447.517	1.655	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(F)cc1-c1cnn(C)c1	796990764	XEFQBCIFBKKGFX-UHFFFAOYSA-N	439.447	1.954	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)C(=O)Nc1cccc2c1CCO2	796999945	PSXWYZQFEWJEGK-LLVKDONJSA-N	448.273	1.937	50	20	IDGD	
CO[C@@H](C)C(=O)Nc1cccc(NC(=O)NNC(=O)CNC(=O)OCc2ccccc2)c1	797619724	TUFCXGBFKHACCX-AWEZNQCLSA-N	443.460	1.739	50	20	IDGD	
CSc1c(F)cccc1C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	797938965	AAFDTMHXAVEQJS-UHFFFAOYSA-N	430.505	1.767	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)C(C)(C)Cc2nc3ccccc3[nH]2)c1	798826854	CVTKPGPVBASXLD-UHFFFAOYSA-N	443.529	1.843	50	20	IDGD	
CC(=O)NCCN(Cc1ccsc1)C(=O)NNC(=O)c1cnn(-c2ccccc2)c1	801017409	CRYHZFJAPPHKMV-UHFFFAOYSA-N	426.502	1.927	50	20	IDGD	
Cc1oc(C(=O)NNC(=O)Nc2ccc3c(c2)OCO3)cc1S(=O)(=O)N1CCCC1	802093116	PPMAEFNNJGKWHT-UHFFFAOYSA-N	436.446	1.568	50	20	IDGD	
COc1cccc(-n2c(C)nnc2SCC(=O)NNc2ccc(-n3ccnc3)nn2)c1	804958065	ZYBGKWGMHHNLRX-UHFFFAOYSA-N	437.489	1.795	50	20	IDGD	
Cc1ccnc2ccc(C(=O)NNc3ncccc3S(=O)(=O)N3CCN(C)CC3)cc12	806872160	FKBPZSVPHBRKQA-UHFFFAOYSA-N	440.529	1.631	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(F)c(N3C(=O)CCC3=O)c2)cc1F	806987949	VSJFPSXCNXEOGP-UHFFFAOYSA-N	430.367	1.326	50	20	IDGD	
Cc1cc([N+](=O)[O-])ccc1NNC(=O)C(=O)Nc1ccc(N2C[C@@H](C)O[C@H](C)C2)nc1	807455132	FWAVHGWXCJXUFG-ZIAGYGMSSA-N	428.449	1.994	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)N[C@H]1CCN(S(=O)(=O)c2ccccc2)C1	807610316	ZSVHCMYNQYVYHX-AWEZNQCLSA-N	433.446	1.002	50	20	IDGD	
O=C(NNC(=O)c1c(F)ccc(O)c1F)c1cccc(S(=O)(=O)N2CCCC2)c1	809544842	CIUJMWDXULLPMC-UHFFFAOYSA-N	425.413	1.530	50	20	IDGD	
CC(C)(C)c1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccc3c2OCC(=O)N3)cc1	810384332	CRXSHFONXWUFSP-UHFFFAOYSA-N	440.456	1.480	50	20	IDGD	
Cc1cc(Cl)ccc1OCCCC(=O)NNC(=O)c1nnn(-c2ccn(C)n2)c1C	814361089	RFUCPRNHZSTWRC-UHFFFAOYSA-N	431.884	1.891	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)C2(C(C)=O)CC2)c1	814697767	BKBXAPQTDPDUMF-UHFFFAOYSA-N	431.470	1.626	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccc([C@H]3CCOC3)cc2)nc1	815586379	HOPMOMGZSDLADG-HNNXBMFYSA-N	447.517	1.354	50	20	IDGD	
O=C(COC(=O)c1ccc(OC[C@H]2CCCO2)cc1)NNC(=O)c1cccc([N+](=O)[O-])c1	844160141	KZQCFUQDDOYGJI-GOSISDBHSA-N	443.412	1.771	50	20	IDGD	
CN(c1ccc(F)cc1)S(=O)(=O)c1ccc(Cl)c(C(=O)N2CC[C@H](B(O)O)C2)c1	864233464	JYYUYOFETJJMKX-LBPRGKRZSA-N	440.689	1.993	50	20	IDGD	
C[C@@H](NC(=O)C(C)(C)C)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	871045118	GAGCSUKBPYQJNY-CQSZACIVSA-N	438.550	1.173	50	20	IDGD	
CCN1CCC[C@H]1CNC(=S)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	884004210	MFOOECQCXNMVOM-INIZCTEOSA-N	439.607	1.064	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNC(=O)CN2C(=O)[C@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2=O)cc1	909364715	AWOVSVGMMSDETF-CPLUKWAASA-N	425.485	1.680	50	20	IDGD	
C[C@@H]1CCC[C@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)[C@@H]1C	915890578	WUPAHFFWSCGKDK-RKVPGOIHSA-N	438.550	1.476	50	20	IDGD	
COc1cc(Br)c(C=NNC(=O)Cn2nnc(-c3ccccc3)n2)cc1O	915907542	WOHXIPQLWRULES-UHFFFAOYSA-N	431.250	1.967	50	20	IDGD	
CSCC[C@@H](NC(=O)NNC(=O)c1ccc2c(c1)OCCO2)c1nnc2ccccn12	916223983	RRUBHMOYSCFYIU-CQSZACIVSA-N	442.501	1.939	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)NCCN1CCN(c2ccccc2)CC1	916514448	FMXHKPLROVDONA-UHFFFAOYSA-N	442.476	1.126	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)CN2C(=O)COc3ccccc32)CC1	916519894	NCCRHEYTNMIKSN-UHFFFAOYSA-N	447.492	1.142	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)NCCCS(=O)(=O)Cc2ccccc2)c1	916576986	IFAIYCJNXRXZQB-UHFFFAOYSA-N	435.502	1.653	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H]2COc3ccccc3C2)c1	916636021	MSAIRWIUXCLXHB-QGZVFWFLSA-N	446.529	1.665	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)NC[C@]3(N4CCOCC4)CCSC3)n[nH]2)cc1	916636930	PVSBPTPYBLEZPD-OAQYLSRUSA-N	444.561	1.537	50	20	IDGD	
COc1ccc(C(=O)NCCNC(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)cc1	918001212	GFNNVVUEQKRPTR-UHFFFAOYSA-N	446.460	1.095	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2ccc(Cl)nc2)ccc1Br	918160606	LFHADEVAHJTKGJ-UHFFFAOYSA-N	448.682	1.907	50	20	IDGD	
CC[C@H](C)c1ccccc1N1C[C@H](C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)CC1=O	919883939	FGFCORDLTZEBRN-ZNMIVQPWSA-N	436.534	1.071	50	20	IDGD	
CCCCOc1c(Cl)cc(C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)cc1OC	919885821	RWIWULXRCVYZLB-LBPRGKRZSA-N	433.914	1.659	50	20	IDGD	
CC1CCN(S(=O)(=O)c2ccc(C(=O)NNc3nncc(N)c3Cl)s2)CC1	1116300315	WMNLBPLAJIOSGX-UHFFFAOYSA-N	430.943	1.951	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)Cc1ccccc1NS(C)(=O)=O	1116803855	IOMHWNJSSMNLRK-LBPRGKRZSA-N	425.894	1.869	50	20	IDGD	
C[C@@H](CCNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)N(C)C(=O)OC(C)(C)C	1251795108	ALVDBAQYQVALOM-HNNXBMFYSA-N	449.556	1.669	50	20	IDGD	
O=C(CCC(=O)N1CCN(c2ncccn2)CC1)NNc1cncc(Br)c1	1319526887	GGAPJAZRWVLECJ-UHFFFAOYSA-N	434.298	1.206	50	20	IDGD	
COc1cc(F)cc(F)c1S(=O)(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1	1323023013	FGRIZKKGDQSXIR-UHFFFAOYSA-N	449.476	1.930	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc4n(n3)CCCC4)C2)C1	1778562315	ZTRDZCFBISJQSE-MOPGFXCFSA-N	429.348	1.899	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cnc(OCF)cn1)CCO2	1779295841	CWJZAKAJLUOHPP-GOSISDBHSA-N	426.521	1.077	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@]2(CN(C(=O)CCNC(=O)c3ccccc3)CCO2)C1	1779300541	VBZYBWYXILFKSI-JOCHJYFZSA-N	447.608	1.488	50	20	IDGD	
CC[S@](=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Br)C1	1780774728	JUHOIMFMAHOLCA-ILMDJTRDSA-N	441.363	1.350	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1ccc(O)cn1)C2)[C@H](F)Br	1780776893	HTQKPAXKBCKVRO-UWWQBHOKSA-N	444.301	1.534	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)[C@@H]3[C@@H](O)CCN3Cc3ccccc3)CCO2)C1	1781219392	MSGBYKDULMMIHV-NVJIOZQYSA-N	449.979	1.469	50	20	IDGD	
COc1ccc(CC(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)cc1	1781328689	WJJZYVWUGNLHLN-SJLPKXTDSA-N	429.286	1.758	50	20	IDGD	
O=C(c1cccn2ccnc12)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781331810	QGUZQZZDMLZVOV-GUYCJALGSA-N	425.258	1.468	50	20	IDGD	
O=C(c1cnc2ccc(F)cn12)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1782462547	NQWZOTQPYDWNKB-YOEHRIQHSA-N	443.248	1.607	50	20	IDGD	
C[C@@H](CC(N)=O)C(=O)N1CCO[C@@]2(CCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1	1782860859	DSATXIAKHBNHGW-BATBXUBVSA-N	446.454	1.213	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)c1cc(-c2ccccc2)on1	1783420941	MMBDAJBHFBEWLP-BVYOLEPJSA-N	433.892	1.535	50	20	IDGD	
Cc1ccn2ncc(C(=O)N3CCO[C@]4(CCN(C(=O)[C@@H](C)Br)C4)C3)c2c1	1783534746	OCBDQEJHWNIAFB-KUHUBIRLSA-N	435.322	1.870	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H]2C[C@@]21C(=O)N1CC[C@@]2(CN(C(=O)[C@@H](F)Cl)CCO2)C1	1783553827	FPQQELRLWBKRHZ-FQZPYLGXSA-N	445.919	1.750	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cnn4c(C)cc(C)nc34)CCO2)C1	1783874298	GNQFYJVFXRVSBR-JXFKEZNVSA-N	435.912	1.043	50	20	IDGD	
CC(C)OC(=O)c1ncccc1C(=O)N1CCO[C@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783944376	YEAGRZZISDJIDY-IBGZPJMESA-N	444.315	1.894	50	20	IDGD	
CC#CC[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]2C1)c1ccccc1	1784091498	VXTKQAXIXBAZFZ-SXYSDOLCSA-N	432.948	1.763	50	20	IDGD	
Cc1oc2cc(O)ccc2c1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]2C1	1784092152	IARSDZNSURZTTB-PTOXDTDZSA-N	436.892	1.640	50	20	IDGD	
O=C(C[C@H]1OCCc2ccccc21)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21	1784395625	XMDMLRSOWUESQT-FLNBYBTLSA-N	436.936	1.270	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3c(C)noc3C)[C@H]2C1	1785087092	UKUQRXTUIHZEQC-LLLHUVSDSA-N	442.354	1.987	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(OC)c(C)c(OC)c3)C2)C1	1785177980	GSTFXYFSGMLRJK-KKSFZXQISA-N	440.924	1.710	50	20	IDGD	
CCOC(=O)C(C)(C)C(=O)N1CC[C@]2(CN(C(=O)[C@H](C)CBr)CCO2)C1	1785517306	HTQFNBBHWZOTKC-ACJLOTCBSA-N	433.343	1.437	50	20	IDGD	
CCCCC[C@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2C1	1786983073	HUQRRWLFFIJBFU-GIUOSPMZSA-N	430.354	1.176	50	20	IDGD	
COc1ccc(C(=O)NC2(c3ccc(NC(=O)c4ccc(B(O)O)cc4)cc3)CCC2)nn1	1788142133	DFRYKHKHKNNPBE-UHFFFAOYSA-N	446.272	1.227	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)c1cc(Cl)cc(Cl)n1	1789047418	TXIBGVWASJDQDK-VMXABPDPSA-N	436.723	1.581	50	20	IDGD	
Cn1c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]3C2)cccc1=O	1789865719	ADEVFGSZQOYJFP-VODUFIJXSA-N	430.332	1.215	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]3C2)cn1	1789921615	RVTGVRGDRRDPAV-ABHRYQDASA-N	430.274	1.374	50	20	IDGD	
COc1ncc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]3C2)cc1F	1789922368	LQCSLUWXVYSBEU-RETIQXCHSA-N	448.264	1.513	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nccc(Cl)c3OC)C[C@@H]21	1791253369	ANDPGMKYLXBHQP-JURCDPSOSA-N	446.331	1.591	50	20	IDGD	
COc1ccc(CCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]3C2)cn1	1791294131	KDXXVZXRICEIRX-KKUMJFAQSA-N	430.332	1.806	50	20	IDGD	
Cn1ncc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]3C2)c1C(F)(F)F	1791294291	UVRLIAGLIBVDKA-LSJOCFKGSA-N	443.253	1.836	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](Br)Cc1ccccc1)C2)C(=O)C1CC1	1792901720	KBVHRVGTYCNRNL-MHORFTMASA-N	449.345	1.561	50	20	IDGD	
CCN1CCN(c2ccc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)[C@@H](O)CCl)cc2)CC1	1793117816	GLVFVXRJRVOAEZ-NRDMVMEKSA-N	448.995	1.680	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cc([N+](=O)[O-])ccc1F	1793811988	XXKDIRFBTLZKSH-ZFHGCVPZSA-N	443.859	1.120	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1ccc(Cl)s1)c1ccc(B(O)O)cc1	1794167713	BKZORWQOIZWNKB-MUJYYYPQSA-N	432.738	1.576	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ncn(-c2ccccc2)n1	1796540713	JGPWGGCLGRFVMD-HGKCTWBKSA-N	443.580	1.322	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cn2ccccc2n1	1796823943	MIKKVIHZYJEQQH-VWPFQQQWSA-N	435.322	1.569	50	20	IDGD	
C[C@@H](NNc1ccccc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CO[Si](C)(C)C	1797953779	GURWHSWBIKHJCT-PDOICOKGSA-N	434.613	1.433	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1[C@H]2c3ccccc3S[C@H]21	1798458385	ZXPJBFFSZVXLEK-NEKOTWGDSA-N	442.585	1.886	50	20	IDGD	
COc1ccccc1CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Br	1799343421	WLZXPNAZAJOJBE-DACLVMHWSA-N	443.313	1.908	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/c1cccc(O)c1)C2)[C@@H](F)Br	1799346739	FSJHRLGQYZVKIN-HHJHSXPOSA-N	427.270	1.686	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCCn1ccnc1C)C2	1800644017	DHAIYHIAZRTCEX-KYHPRHEASA-N	441.370	1.735	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)COc1ccccc1F	1800645449	WEAUIUVCPPEZDE-FLTUCWPJSA-N	443.313	1.825	50	20	IDGD	
CC(C)(C)OC(=O)NC12CC(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@@H](F)Cl)C4)(C1)C2	1800701236	XPTUBUFZXXBMPZ-HOXVMPQISA-N	445.919	1.558	50	20	IDGD	
COc1cccnc1CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)Br	1800756748	HRVMODYDNYKEKY-FLTUCWPJSA-N	440.338	1.396	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(=O)c3ccccc3o1)C2	1800970776	JDADYTAXBGEALQ-FCIKYMEBSA-N	434.876	1.250	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc2c(c1)C(=O)CC2	1800974706	NBJMEQWTCOAQME-BCDXTJNWSA-N	426.517	1.440	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc(-c3ccccn3)nc1)C2)C(Cl)Cl	1801016057	ZFPAPSWGTYTMMT-AGGWBTHJSA-N	436.299	1.546	50	20	IDGD	
CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(Cl)Cl	1801021358	KVFPVMGCTKQTSB-YVECIDJPSA-N	438.352	1.683	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@H]1CCN(C(=O)CCn2cncn2)[C@H]1c1cccnc1	1803018175	XOBGTFAXCGIKFE-KYJSFNMBSA-N	449.353	1.800	50	20	IDGD	
CC(C)c1nc(CC(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)no1	1803135789	HNAHTBDQOYHZIM-RVKKMQEKSA-N	435.912	1.436	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)c(O)c1	1803141380	NMQPGCUEODXQTD-ZMYBRWDISA-N	433.892	1.715	50	20	IDGD	
CC(C)Cc1cc(C(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@H]2c2cccnc2)n(C)n1	1807841433	DRDSCBVNDVSJJC-DBVUQKKJSA-N	447.967	1.933	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)[C@H]2CC[C@H](O)CC2)[C@@H]1c1cccnc1	1813075049	WXQVZHQUXOOEAW-WGQQHEPDSA-N	445.564	1.012	50	20	IDGD	
CN1N=C(C(=O)N2CC[C@H](CNC(=O)C(Cl)Cl)[C@@H]2c2cccnc2)CCC1=O	1813076674	YSOCSNPKDJJTGT-DOMZBBRYSA-N	426.304	1.499	50	20	IDGD	
C[C@H](C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)n1cccc1	1813309525	NLMDEKLYPHASGL-ZNLUXHQJSA-N	446.316	1.144	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)[C@@H](C)n2cnnn2)[C@H]1c1cccnc1	1813473607	WVYRRIDPKZCLGO-CTHBEMJXSA-N	436.314	1.119	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnc(O)nc3O)sc2C1	1817078901	LHPQLIJRQFPTAO-PSASIEDQSA-N	425.898	1.978	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)CCc2ccc[nH]2)n[nH]1	1817532296	GFADIEVYHYABQN-KRWDZBQOSA-N	429.525	1.736	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1cnccc1F	1817732869	LQKVFMWBDWQMBT-SFHVURJKSA-N	437.240	1.243	50	20	IDGD	
COC(=O)c1ccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)[C@H](O)CCl)[nH]n2)cn1	1818222084	NHRRIMRUJYITLD-HUUCEWRRSA-N	435.868	1.497	50	20	IDGD	
C[Si](C)(C)OCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)Cn2ccncc2=O)[nH]n1	1819596403	IYGVHMRQRSJOQK-HNNXBMFYSA-N	432.557	1.510	50	20	IDGD	
O=C(CN1C(=O)CSC1=S)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](F)Cl)[nH]n1	1823497135	ADMIIFRNHSTIJL-TVQRCGJNSA-N	433.918	1.797	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H]3CCNC(=O)C3)sc2C1	1826210178	NQEQJLBKSWXOMK-OUAUKWLOSA-N	443.367	1.612	50	20	IDGD	
Cc1cccc(CC(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)n1	1827055901	NSQRVMIRBWQFNV-QHCPKHFHSA-N	449.360	1.546	50	20	IDGD	
O=C(C1=COCCC1)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827060564	QHPZFVUEZWWGKS-OAQYLSRUSA-N	426.322	1.294	50	20	IDGD	
O=C([C@H](O)CCl)N1CCC([C@@H]2CCCCN2C(=O)[C@H]2Cc3ccccc3CN2)CC1	1827614454	XXVSFINHSJJCOD-QHAWAJNXSA-N	433.980	1.920	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H](O)N2CCOCC2)CC1	1828974386	RUMRQXXUPHBRTA-YXJHDRRASA-N	446.386	1.040	50	20	IDGD	
N#Cc1c[nH]c(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)c1	1829775887	APLOXSBEJFUNJQ-FQEVSTJZSA-N	449.515	1.432	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cncs3)C2)C1	1830537558	KFDRJGJMKBIDLN-MLGOLLRUSA-N	432.340	1.244	50	20	IDGD	
CCCOc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)cc1	1830733847	VSSQJNDHPOYQFJ-NQIIRXRSSA-N	440.924	1.145	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc(OC)c(C)c3)C2)C1	1831643964	MHZCDSPHXXABOP-UTKZUKDTSA-N	439.940	1.876	50	20	IDGD	
CO[C@H](C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)CCl)CC2)CC1)c1ccccc1	1833309009	IVMHEALCWNWYAA-UXHICEINSA-N	437.968	1.545	50	20	IDGD	
CCN(CC)C[C@H](C)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)CCl)CC2)CC1	1833311650	BOKWUCBNUYBAPZ-LPHOPBHVSA-N	431.021	1.136	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1)C(=O)c1ccco1	1833755829	BLGVALNJYQKUDI-INIZCTEOSA-N	444.301	1.724	50	20	IDGD	
Cc1ncoc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)CBr)C2)C1	1834363329	ZMXUKCICTCIFMK-SJCJKPOMSA-N	430.299	1.084	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cnc(N)s3)CC2)CC1	1834768482	XCOIKLCWYOMZKT-CQSZACIVSA-N	429.974	1.164	50	20	IDGD	
O=C(/C=C/c1cccnc1)N1CCOC[C@@]2(C1)CN(C(=O)CCBr)CCO2	1834819623	WVIASYYJMKNAAV-GNAXCBTBSA-N	438.322	1.336	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)Cn3ccccc3=O)CC2)CC1	1834820607	CFAZMRHNIYQYSQ-IBGZPJMESA-N	436.984	1.827	50	20	IDGD	
CC(C)N[C@H](C(=O)N1CCOC[C@]2(CN(C(=O)CCBr)CCO2)C1)C(C)C	1834822571	WEWKOWKKPLWKMX-HKUYNNGSSA-N	448.402	1.250	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3cc[n+]([O-])cc3)CC2)CC1	1836054367	MMAACFSSFRHIOD-CQSZACIVSA-N	439.354	1.289	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc4nccn4c3)CCO2)C1	1836574323	QYXJTWQZXAYWJO-UTKZUKDTSA-N	434.924	1.812	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC(OC2CCN(C(=O)[C@H]3C[C@@H](O)C3)CC2)CC1	1836673674	SYBGCKGHHALHPL-SOUVJXGZSA-N	431.371	1.787	50	20	IDGD	
Cc1ccncc1CCC(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836715069	IJBHROCEVXVNKH-HXUWFJFHSA-N	437.968	1.921	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc4n(n3)CCCC4)CCO2)C1	1836974216	QRHOCQOPFSXXTA-LAUBAEHRSA-N	438.956	1.697	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cn4ccsc4n3)CCO2)C1	1837045074	PXBRGQVGVSWGQA-LJQANCHMSA-N	440.953	1.731	50	20	IDGD	
O=C(c1cccc2ncsc12)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1837070667	MWTDZZZSQCNMLB-QAPCUYQASA-N	427.885	1.901	50	20	IDGD	
Cc1cc(/C=C/C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)no1	1837558595	RISKQGXWLXQFHY-DIMNXIJWSA-N	442.310	1.236	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cc(O)nc(O)n3)CC2)CC1	1838081601	MHRXAUWNPMWCLT-AWEZNQCLSA-N	426.901	1.517	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)c(C)n1	1838364234	KQWFXNVGLCWHKJ-AUUYWEPGSA-N	440.338	1.552	50	20	IDGD	
Cc1nccn1CC(=O)N1CCC(OC2CCN(C(=O)[C@H](C)Br)CC2)CC1	1838731007	VEKDJZXCCFHXQX-AWEZNQCLSA-N	441.370	1.974	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)cc1F	1838916371	PEYXZZKHEGPKRB-AUUYWEPGSA-N	443.313	1.988	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(O)nc(Cl)c3)C2)C1	1839143425	WBCLFTCJGMTICI-UGSOOPFHSA-N	432.304	1.528	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(C)c([N+](=O)[O-])cn3)C2)C1	1839144564	FFIWOGHMHAIBQY-AUUYWEPGSA-N	440.884	1.386	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)Nc3nccs3)C2)C1	1839144846	MFRGGULKXZOHSP-QWQRMKEZSA-N	430.958	1.417	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccncc3O)C2)C1	1839153599	LSKIYURIMIKCLA-QZTJIDSGSA-N	432.304	1.094	50	20	IDGD	
Cc1ccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)cc1[N+](=O)[O-]	1839189295	VDJWKYCFLMGOBR-HKUYNNGSSA-N	443.859	1.437	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)n3cccc3)C2)C1	1839967367	KEKOEPRWEFZKMN-BXWFABGCSA-N	442.354	1.679	50	20	IDGD	
Cc1noc(C)c1CC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2	1840030336	IVXVZOLGLVZPSF-XIKOKIGWSA-N	444.326	1.074	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)cn1	1840031533	SWGIFYRKKKSZEC-KBXCAEBGSA-N	426.311	1.243	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@]3(C)CC3(F)F)C2)C1	1840035804	GNLGNOKPBWPKEL-GLQYFDAESA-N	425.270	1.272	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(C)ccc3O)C2)C1	1840154293	RITSLCYELFYYFS-JXFKEZNVSA-N	426.897	1.024	50	20	IDGD	
O=C(c1cn2c(F)cccc2n1)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840190026	ZGSGORLMWPTZGO-SFHVURJKSA-N	445.278	1.347	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3c[nH]c4ncccc34)CCO2)C1	1840870522	NHFAILKWAWQNHX-XMSQKQJNSA-N	448.951	1.969	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC2(CCCN2C(=O)[C@@H]2CCCCO2)C1	1841101643	HIXRKIFSYGANSL-GJZGRUSLSA-N	429.945	1.891	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)C2(c3ccccc3)CCCC2)C1	1841215318	XGVNGGMGCBVZFG-UHFFFAOYSA-N	432.329	1.695	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1cc(C(F)F)no1)C2	1843415735	GMFHWENCHURDNL-FOKLQQMPSA-N	434.403	1.563	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1ccc3c(c1)C(=O)CC3)C2	1843416618	GYFVTSFUGNPNLL-CVKSISIWSA-N	447.495	1.767	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)c2cc3cccc(F)c3s2)C1	1843701963	VZHMUJQEFYQRLN-UHFFFAOYSA-N	438.289	1.851	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC2(CCCN2C(=O)c2cc(Cl)c3nncn3c2)C1	1844226997	WPKUHBCLIFWOLG-SNVBAGLBSA-N	426.702	1.983	50	20	IDGD	
Cc1ccc(=O)n(C(C)(C)C(=O)N2CCCC23CN(C(=O)[C@H](F)Br)C3)n1	1844354383	BIYNNDGUHCKGAD-ZDUSSCGKSA-N	429.290	1.181	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2ccc(Cl)nc2Cl)C1	1844422283	BNNQVCQNZTVLFF-UHFFFAOYSA-N	449.298	1.518	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](C)[C@@H]1SC(=N)NC1=O	1847498897	UCKFEALJXPEQTD-GCHJQGSQSA-N	431.356	1.022	50	20	IDGD	
COc1ccc2c(CC(=O)N3CC[C@H]4[C@@H]3CCN4C(=O)CCC(=O)NN(C)C)c[nH]c2c1	1847595194	IJXROMYFJSWBFU-PMACEKPBSA-N	441.532	1.294	50	20	IDGD	
C=C1c2ccccc2C(=O)N1CC(=O)OCC(=O)NNC(=O)c1cc(Cl)ccc1OC	11578077	NEIFPYQLLMZMAC-UHFFFAOYSA-N	443.843	1.780	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2ccc(F)c(C(=O)O)c2)ccc1OC(C)C	13262163	FWTZRQRXTOYVIL-UHFFFAOYSA-N	426.422	1.943	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCCC3)cc2)n1	15758379	IPXJEJICCSTAOD-UHFFFAOYSA-N	433.534	1.065	50	20	IDGD	
COc1ccc(C)cc1N1C[C@@H](C(=O)NNC(=O)Cc2nc3ccccc3n2C)CC1=O	16179055	IYNPUKYDPVEQQU-HNNXBMFYSA-N	435.484	1.633	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)CCN2C(=O)COc3ccccc32)c2ccccc2c1=O	17163270	UYLHSSNUSFDJPR-UHFFFAOYSA-N	449.467	1.383	50	20	IDGD	
CCOc1ccc(N2C[C@@H](C(=O)OCC(=O)NNC(=O)c3ccc(C)cc3)CC2=O)cc1	21166461	AOHPKNWYFKVYFP-KRWDZBQOSA-N	439.468	1.751	50	20	IDGD	
Cc1nnc(NNC(=O)c2cc(S(=O)(=O)N3CCCCC3)ccc2Cl)nc1O	22383398	GYNASRNSMBSKJD-UHFFFAOYSA-N	426.886	1.471	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cncn2-c2ccccc2)c1	22662930	IZXWTESNCPAXOE-UHFFFAOYSA-N	441.513	1.978	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)CNC(=O)c1ccc(C#N)cc1	726979116	BQZZDKGOJRALIS-GFCCVEGCSA-N	445.273	1.665	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)[C@@H]1CC(=O)N(Cc2ccccn2)C1	728209609	ISYIYRGSFDLUPD-CQSZACIVSA-N	429.502	1.014	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)OCC(=O)NNC(=O)[C@@H]3COc4ccccc4O3)n[nH]2)o1	728329665	SFUNERUZYFQSHS-KRWDZBQOSA-N	426.385	1.122	50	20	IDGD	
CC(=O)[C@@H]1CC(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)=NN1c1ccccc1	728846501	OFUAGERADJIPNW-IBGZPJMESA-N	435.488	1.064	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)N2CCC[C@@H](CN3CCN(c4ccccn4)CC3)C2)c1	728954532	ZZSLFTCHLWIYOO-FQEVSTJZSA-N	447.543	1.842	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)F)cc1)c1ccc(S(=O)(=O)NC2CC2)cc1	728974372	MIHAKPAFSGPGSY-UHFFFAOYSA-N	445.469	1.881	50	20	IDGD	
Cc1cccc(-c2nnc(-c3ccc(C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)cc3)o2)c1	729275959	TZOBEZRVGUELFI-CYBMUJFWSA-N	443.485	1.411	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)NCCC(=O)N1CCN(c2ccccc2)CC1	729605210	GTMUGFWLNPIHDF-UHFFFAOYSA-N	448.527	1.711	50	20	IDGD	
O=C(NCc1cccc(CO)c1)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	729621255	FTTPOOVGMWLHFD-UHFFFAOYSA-N	432.502	1.108	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)c1cnn(-c2cccc(Br)c2)c1	730179558	WZWUDZMUENWHBD-UHFFFAOYSA-N	432.234	1.419	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)nnn1-c1ccc2c(c1)OCCO2	731453767	MMUYLJSGYARYDA-UHFFFAOYSA-N	445.439	1.812	50	20	IDGD	
C#Cc1cccc(NC(=S)NNC(=O)c2nnn(-c3ccc4c(c3)OCCO4)c2C)c1	731500622	GVGIGBUVRJHDEO-UHFFFAOYSA-N	434.481	1.960	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2C(=O)[C@H]3CCCC[C@H]3C2=O)cc1Br	732037120	HKVSXLFBHKGTEO-TXEJJXNPSA-N	438.278	1.394	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N(C)[C@H](C)CS(C)(=O)=O	732677041	RFABYPFZEPANFT-GHMZBOCLSA-N	436.328	1.322	50	20	IDGD	
CC(C)n1cc([C@@H](C)NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cn1	732894030	SNNATTPUKROLSC-OAHLLOKOSA-N	448.549	1.954	50	20	IDGD	
Cn1c(NNC(=O)c2ccc(F)c(S(=O)(=O)NC3CC3)c2)nc2ccccc2c1=O	733260943	SRARRODSORZKLE-UHFFFAOYSA-N	431.449	1.270	50	20	IDGD	
CC(C)c1ccc(-n2c(NNC(=O)[C@@H](C)NS(C)(=O)=O)nc3ccccc3c2=O)cc1	733365735	PZSLDJVECOFMMW-CQSZACIVSA-N	443.529	1.890	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)CC[C@H]2NC(=O)N(c3ccc(C#N)cc3)C2=O)c(C)c1	733805394	STMUPSKQEXQLKH-LJQANCHMSA-N	448.483	1.640	50	20	IDGD	
COc1cc(F)c([C@@H](C)NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1OC	734009699	AZNBWBIUVCYVFK-CYBMUJFWSA-N	446.483	1.941	50	20	IDGD	
CCOCCCN1CC[C@@H](NC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)[C@H](C)C1	734545026	VERVMBKSGFJBDM-YLJYHZDGSA-N	428.537	1.953	50	20	IDGD	
CN1C(=O)C[C@@H](C(=O)OCC(=O)NNC(=O)c2cccs2)[C@H]1c1cccc(Cl)c1	734636049	LOTRGXVMVAATSB-CXAGYDPISA-N	435.889	1.925	50	20	IDGD	
COc1ccc(S(=O)(=O)C[C@@H](C)C(=O)NNC(=O)Cn2ccc3ccccc32)cc1	735010611	WAAXHQLUWVRYAY-OAHLLOKOSA-N	429.498	1.907	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)N[C@@H]2CC(=O)N(CCN3CCOCC3)C2)c(C)n1CC(C)C	736153578	RFYXDEPRUCABDF-UHSICZIDSA-N	441.576	1.717	50	20	IDGD	
O=C(CN1CCN(c2ccccn2)CC1)NNC(=O)c1ccc(COc2ccccc2)o1	740749745	NKYOCSNIBYVUMQ-UHFFFAOYSA-N	435.484	1.837	50	20	IDGD	
C[C@@H]1CN(C(=O)NNC(=O)CNC(=O)c2cccs2)CC[C@@H]1NC(=O)OC(C)(C)C	740912933	JKUGERVFBVTAGO-OLZOCXBDSA-N	439.538	1.454	50	20	IDGD	
CCS(=O)(=O)N(C)C1CCN(C(=O)NNC(=O)c2cccc(Br)c2)CC1	743688172	YCIALRVENGPSID-UHFFFAOYSA-N	447.355	1.549	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ccc3nnc(C(F)(F)F)n3n2)CC1)NC1CCCC1	744054147	REPUENCNBHFTJD-UHFFFAOYSA-N	440.430	1.633	50	20	IDGD	
COc1cccc2c1OCC(C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1)=C2	744621077	NQROXKRYLAWMDQ-UHFFFAOYSA-N	445.497	1.635	50	20	IDGD	
Cc1cc(=O)c(C(=O)OCC(=O)NNC(=O)c2cccs2)nn1-c1cccc(Cl)c1	745224145	DTBUSSCVPDFFHS-UHFFFAOYSA-N	446.872	1.874	50	20	IDGD	
C[C@H](CCc1cccc(F)c1)C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	745585711	SYTLABQACFDGDF-AUUYWEPGSA-N	430.432	1.925	50	20	IDGD	
Cc1n[nH]c(C)c1S(=O)(=O)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1	747696739	IHSJCTXEQJGCAL-FQEVSTJZSA-N	439.541	1.963	50	20	IDGD	
N#Cc1ccccc1Sc1ccc(C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)cc1	748530725	ZSCBPXSDTOQXNO-HNNXBMFYSA-N	430.511	1.841	50	20	IDGD	
O=C(NCCc1cccs1)NNC(=O)c1cc(S(=O)(=O)N2CCC2)ccc1Cl	748704077	UQMLAPKIMJYFNV-UHFFFAOYSA-N	442.950	1.983	50	20	IDGD	
O=C(COC(=O)CC12C[C@H]3C[C@@H](CC(O)(C3)C1)C2)NNC(=O)[C@@H]1COc2ccccc2O1	750512612	FMESITFYRNNTKU-MDNXRPTBSA-N	444.484	1.238	50	20	IDGD	
O=C(O)c1ccc(O)c(S(=O)(=O)NNC(=O)c2ccc(F)cc2Br)c1	751210939	JNXYSMBKNILNPG-UHFFFAOYSA-N	433.211	1.615	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)NCCNS(=O)(=O)c2ccc(Cl)s2)cc(C#N)n1C	752257592	UDXIVVVMEIAMES-QPEQYQDCSA-N	437.934	1.922	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)NNC(=S)Nc2ccc(OC)c(F)c2)ccc1F	752521016	HRLMRXYLGKXOTI-UHFFFAOYSA-N	430.458	1.513	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)N[C@@H]1CCCN(Cc2ccccn2)C1=O	753289328	LFLBGQZZLZXTHE-GOSISDBHSA-N	425.489	1.544	50	20	IDGD	
COc1cc(Cl)c(C=NNC(=O)CSc2nn(C)c(=O)n(C)c2=O)cc1Cl	753923846	MAOXYPHOELWKPH-UHFFFAOYSA-N	432.289	1.037	50	20	IDGD	
CCCC[C@@H](NC(=O)[C@H](C)NC(=O)C(C)(C)C)C(=O)NNC(=O)c1ccc(C#N)cc1	755252573	BYKSBVBRPCSKPZ-WMLDXEAASA-N	429.521	1.545	50	20	IDGD	
CCCc1nnc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(CC)CC)c2)s1	755473795	UUGGUVVEWHJDLF-UHFFFAOYSA-N	440.551	1.988	50	20	IDGD	
CCN(CC)C(=O)COc1cccc(NC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1	755658497	YUVXLFBGACIGRL-LJQANCHMSA-N	442.472	1.927	50	20	IDGD	
COc1ccc(C(=O)N2CCOCC2)cc1NC(=O)NNC(=O)COc1ccc(C)cc1	756259658	YTNMFCGBBKWBKE-UHFFFAOYSA-N	442.472	1.708	50	20	IDGD	
CCc1nc(NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)sc1C	756804520	LXDVACRHVYUQFM-UHFFFAOYSA-N	425.536	1.796	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1	758024082	BGLJPFOREHCUSD-LLVKDONJSA-N	436.877	1.703	50	20	IDGD	
CC(C)Cn1ncc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1C(F)F	758054270	KMDWXFLIHBMQJX-UHFFFAOYSA-N	443.476	1.802	50	20	IDGD	
O=C(NNC(=O)c1ccccc1OCc1cn2ccccc2n1)C(=O)Nc1ccccn1	758828734	VLIVXOMCJDESRP-UHFFFAOYSA-N	430.424	1.708	50	20	IDGD	
Cc1ccnc(-n2nccc2NC(=O)C(=O)NNC(=O)CCSc2ccc(F)cc2)c1	760277458	LQKVCXRUNZIQPI-UHFFFAOYSA-N	442.476	1.983	50	20	IDGD	
O=C(COC(=O)C1=Cc2cc(F)ccc2OC1)NNC(=O)[C@H]1COc2ccccc2O1	761640885	IPKJRWAFVXZDNP-GOSISDBHSA-N	428.372	1.132	50	20	IDGD	
COc1cc(C(=O)NNC(=O)N[C@H]2CCN(C(=O)C3CCCC3)C2)cc(OC)c1OC	762085959	GDYPNXIZESTSBB-HNNXBMFYSA-N	434.493	1.448	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccccc2F)c1	763508508	NCDPGYMQLPDOOK-UHFFFAOYSA-N	436.465	1.256	50	20	IDGD	
CC(C)(C)c1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(C(N)=O)c(F)c2)cc1	763599544	ITKKPEOCXYYJIX-UHFFFAOYSA-N	430.436	1.387	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(CCN3CCCC3)cc2)cc1	763659876	SVJOXWWCMMUYDZ-UHFFFAOYSA-N	440.500	1.498	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2c(F)c(F)c(F)c(F)c2F)cc1	763660902	KJXFDYOGKFJFHY-UHFFFAOYSA-N	433.289	1.556	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(C)c(C(=O)N(C)C)c2)cc1C	763664837	JGGSDXQGTZPMDG-UHFFFAOYSA-N	426.473	1.479	50	20	IDGD	
C[C@@H]1COCCN1c1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2F)cc1	763678235	BAFITIMTTFNMJI-CQSZACIVSA-N	430.436	1.216	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)cc(OC)c1OC	763693634	BDSYOQCWAMEIFG-UHFFFAOYSA-N	437.836	1.531	50	20	IDGD	
N#Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccc(Br)cc2)ccc1F	763695326	QTUNMYPBIZTCTQ-UHFFFAOYSA-N	435.209	1.625	50	20	IDGD	
CN(C)C(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)cc1	763732316	AWSFWQOSQSLUDU-UHFFFAOYSA-N	426.517	1.620	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)CC23CC4CC(CC(C4)C2)C3)cn1	763737124	XAKPWZZPKDWUCZ-UHFFFAOYSA-N	430.505	1.799	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)c1ccc(CNC(=O)c2cccs2)cc1	763818355	IRMYCZKPEWUWME-UHFFFAOYSA-N	437.481	1.264	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(OCC(=O)N3CCCC3)c2)cc1	763831727	RQHHEHQJCVYHSW-UHFFFAOYSA-N	438.484	1.650	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cccc(CS(C)(=O)=O)c2)c1C	763840230	JOBAMGDHEFSPMI-OAHLLOKOSA-N	447.513	1.401	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1cccc(Cn2cncn2)c1	763858732	WUVZYUFUDMKEAC-ZDUSSCGKSA-N	426.408	1.019	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1cnn(Cc2ccncc2)c1	763863525	ACUUFVICMOEOOW-CYBMUJFWSA-N	426.408	1.019	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cc(C)nn2C(C)(C)C)cc1	763872989	QLSCFCMUGLIEFP-AWEZNQCLSA-N	429.477	1.703	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccc(-c3noc(C(F)F)n3)cc2)n1	763892862	MBXWURKYDMFQPR-UHFFFAOYSA-N	433.375	1.274	50	20	IDGD	
O=C(NNC(=O)c1cc(Cl)ccc1O)C(=O)Nc1cccn(Cc2ccccc2)c1=O	763977342	OGHWPMOJRQYOOB-UHFFFAOYSA-N	440.843	1.655	50	20	IDGD	
O=C(NNC(=O)c1ccc[nH]1)C(=O)Nc1cnc(Br)c(Br)c1	763981104	UNVLXRRONDTBHR-UHFFFAOYSA-N	431.044	1.334	50	20	IDGD	
Cc1cc(C)cc(Oc2ccc(NC(=O)C(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)cc2)c1	763997323	JOBKQFLKSAKVEM-OAHLLOKOSA-N	445.497	1.616	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(F)cc2OC(F)F)c1	764085701	NPURQYOLOTXGGS-UHFFFAOYSA-N	445.375	1.230	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cnn(-c3ccccc3Br)c2)n[nH]1	764107093	YSYRTZILJWEPRA-UHFFFAOYSA-N	432.238	1.066	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(C#N)c2)cc1N1CCCCC1=O	764241560	AGNVOHHCWKNIRZ-UHFFFAOYSA-N	435.440	1.483	50	20	IDGD	
Cc1ncsc1C(=O)NNC(=O)C(=O)Nc1cccc(C(=O)N2CCSCC2)c1C	764246338	NTAWUMGBINETEH-UHFFFAOYSA-N	447.542	1.349	50	20	IDGD	
CN(C)C(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2cc(Br)ccc2O)c1	764276404	DEXAPNHPXSVTHD-UHFFFAOYSA-N	449.261	1.256	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1c2c(nn1-c1ccccc1)CCC2	764278235	NZKXXUUOYIZFKF-UHFFFAOYSA-N	435.440	1.232	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1ccc(Br)cc1Cl	764281118	YTDBLAFEWUYVKV-UHFFFAOYSA-N	442.653	1.973	50	20	IDGD	
Cc1nnc(-c2cccc(NC(=O)C(=O)NNC(=O)c3ccc(O)c(Cl)c3)c2)n1C	764350068	VNELLRDPDXTZLU-UHFFFAOYSA-N	428.836	1.549	50	20	IDGD	
COc1c(Br)cc(Cl)cc1NC(=O)C(=O)NNC(=O)Cc1ccncc1	764354149	MGIBRPJEEIDOTC-UHFFFAOYSA-N	441.669	1.835	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccnn2Cc2ccc(Br)cc2)o1	764372316	XCGZMBPVWTXYHL-UHFFFAOYSA-N	446.261	1.995	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)CSc2ccccc2OC)ccc1NC(C)=O	764397214	GZCRYOUUQDCXML-UHFFFAOYSA-N	446.485	1.540	50	20	IDGD	
O=C(Cc1csc2nccn12)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	764463492	LBGGKBGKPVZTIS-UHFFFAOYSA-N	433.515	1.184	50	20	IDGD	
O=C(CCC(=O)N1CCN(c2ccccc2)CC1)NNC(=O)c1nnc(O)c2ccccc12	764545390	ZKDIUZJFEUVBMD-UHFFFAOYSA-N	448.483	1.225	50	20	IDGD	
CCCCS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1	764766900	KWEIMNJBZNCRFW-UHFFFAOYSA-N	438.527	1.739	50	20	IDGD	
O=C(NCc1cccc(N2CCCS2(=O)=O)c1)NNC(=O)c1cccc2ncccc12	765307224	WBNCQJRBTFLQMA-UHFFFAOYSA-N	439.497	1.919	50	20	IDGD	
C[C@H]1CCCC[C@@]12NC(=O)N(CC(=O)NNC(=O)c1cc(-c3ccc(F)cc3)[nH]n1)C2=O	765617308	GCBYCNFYJOLSEB-LAJNKCICSA-N	442.451	1.478	50	20	IDGD	
Cc1c(Br)cc(C(=O)NNC(=O)CCNC(=O)OC(C)(C)C)c(=O)n1C	765904944	KNFSZBWZJJRSMA-UHFFFAOYSA-N	431.287	1.132	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc2c(c1)OCCCO2)NNc1cnc2ccccc2n1	765990089	LUONYRLTABYDGH-UHFFFAOYSA-N	443.485	1.603	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)[C@@H]1CCCN(C(=O)c2ccc(F)cc2)C1	766000240	JDBANQXTDXIGBY-DNVCBOLYSA-N	427.432	1.665	50	20	IDGD	
NC(=O)COc1ccc(Cl)cc1S(=O)(=O)NNC(=O)NCCc1cccs1	766319292	MFUBADNLCUABSY-UHFFFAOYSA-N	432.911	1.001	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)[C@H](C)NC(=O)c1ccc(Cl)cc1	767250752	KOPLIOMLPBFKKG-AWEZNQCLSA-N	431.876	1.700	50	20	IDGD	
Cc1cc(Cl)ccc1S(=O)(=O)N1CCN(S(=O)(=O)CBr)CC1	767850452	KKKSVQFEANZKHA-UHFFFAOYSA-N	431.761	1.637	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N1CCOC2(CCOCC2)C1	767937165	GKUUXWVAEHVJND-CYBMUJFWSA-N	442.310	1.839	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2c(Cl)cccc2Cl)n(-c2ncccn2)n1	768238525	BHHBSLODRWMFHF-UHFFFAOYSA-N	434.243	1.677	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)c1ccc(S(=O)(=O)N(C)C)nc1	770218927	DOGYEFPSSJPPLI-UHFFFAOYSA-N	445.526	1.839	50	20	IDGD	
CSC[C@H](C(=O)NNC(=O)c1ccc2c(c1)OCCO2)N1C(=O)[C@H]2CCCC[C@@H]2C1=O	770416904	DMFUDQXBLNUIAZ-SOUVJXGZSA-N	447.513	1.126	50	20	IDGD	
CC1CCN(S(=O)(=O)c2ccc(C(=O)NNc3nc(O)c4cnn(C)c4n3)cc2)CC1	770973211	YYGWEWBDMBHUPU-UHFFFAOYSA-N	445.505	1.246	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(C)c(C(=O)O[C@H](C)C(=O)NNC(=O)CC(C)C)c1	771934936	XNFIXDUAUXGRKU-OAHLLOKOSA-N	441.550	1.764	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)[C@H]1CC(=O)N(c2cccc(Br)c2)C1	771984176	FKCIXUUJAWUSOV-QWRGUYRKSA-N	426.267	1.291	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNS(=O)(=O)c1c[nH]c(C(=O)N2CCCC2)c1	773267857	XSDPBFVFMBGFQH-LBPRGKRZSA-N	440.909	1.681	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)OCc2ccnn2C)cc1	773473773	ORXPLUDIRLVXRB-WJDWOHSUSA-N	434.456	1.818	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1ccnn1-c1ccc(C)nn1	773499518	LXRTZUGDYCNCHG-UHFFFAOYSA-N	429.824	1.032	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)C(C)C)cc1NC(=O)C(=O)NNc1ccc(C#N)cc1	773692966	PASKATWXXRHJMA-UHFFFAOYSA-N	429.502	1.977	50	20	IDGD	
O=C(NNc1ncccn1)C(=O)Nc1ccc(-c2csc(N3CCOCC3)n2)cc1	773718958	JGWZXHWFVYJPHB-UHFFFAOYSA-N	425.474	1.519	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccc(-c2ncon2)cc1	774003595	YEWUXMPVQMPWNY-LLVKDONJSA-N	429.820	1.943	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)c2nccnc2C(=O)NCc2ccc(F)cc2)c1	776714995	NODFURFDOXZSFD-UHFFFAOYSA-N	443.460	1.706	50	20	IDGD	
Cn1c(=O)nc(O)c2c(C(=O)NNc3ccccn3)cc(-c3ccc4c(c3)OCO4)nc21	777468379	ZCQVZDVTMHWLQS-UHFFFAOYSA-N	432.396	1.582	50	20	IDGD	
CSc1ccc([N+](=O)[O-])c(C(=O)N2CCN(S(=O)(=O)CBr)CC2)c1	777777896	RQUFZMJZSZYCGM-UHFFFAOYSA-N	438.325	1.757	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cc3c(cc2F)NC(=O)CC3)c1C	778708053	TWHGZDQIYUMUBU-ZDUSSCGKSA-N	442.447	1.881	50	20	IDGD	
Cc1nn(C)c(-n2cccn2)c1C(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	778859105	KEYIDNCUKOVLHY-UHFFFAOYSA-N	446.512	1.258	50	20	IDGD	
COCC[C@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)c1ccc(C)o1	779397117	VLXLOLSPADSYSE-INIZCTEOSA-N	438.506	1.560	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H]2CCC[C@H]2CCO)c1	779710299	CATAUVXMQBUZCF-YOEHRIQHSA-N	426.539	1.212	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN([C@@H]2CCCN(S(=O)(=O)CCCCCl)C2)C(=O)C1	780856778	XOUGWENIYOOCRX-OAHLLOKOSA-N	437.990	1.879	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)c(O)c1O	780982350	GJFASPXFHSLTFX-UHFFFAOYSA-N	432.908	1.638	50	20	IDGD	
C[C@H]1CN(CC(C)(C)O)CCN1C(=O)CCC(=O)C(C#N)=C1N(C)c2ccccc2N1C	781222533	LWBXKRIWVPLXSQ-KRWDZBQOSA-N	439.560	1.961	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)C1=CCN(C)CC1	781394901	LYFDERJBOTVIMR-HNNXBMFYSA-N	435.550	1.066	50	20	IDGD	
CCC(CC)NC(=O)[C@H]1CN(C(=O)C(=O)NNc2ncncc2Cl)c2ccccc2O1	782159419	RACYGHWGXMLIRE-MRXNPFEDSA-N	446.895	1.672	50	20	IDGD	
Cc1ccc(NNC(=O)C(=O)Nc2cc(S(=O)(=O)N3CCOCC3)ccc2C)cc1	783348714	WIULEFVCTFNAOB-UHFFFAOYSA-N	432.502	1.406	50	20	IDGD	
Cn1c(C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)cc2c(=O)n3ccccc3nc21	784459434	OUQJXHAVIOXAMV-UHFFFAOYSA-N	442.476	1.252	50	20	IDGD	
CN(C)Cc1cccc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)NC(C)(C)C)c1	784833557	NZISUAZPNSKTAR-UHFFFAOYSA-N	447.561	1.907	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)Nc1nc(-c2ccccc2F)cs1	785024010	QCUJQUXPHGYHCN-UHFFFAOYSA-N	445.388	1.963	50	20	IDGD	
Cn1nc(C2CCCCC2)cc1NC(=O)C(=O)NNC(=O)c1cc([N+](=O)[O-])ccc1O	785024017	QIGAPKBZTSSYSK-UHFFFAOYSA-N	430.421	1.481	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1cc(C(=O)NCC2CC2)ccc1C	785990445	HDRLKJRQGYKDEZ-UHFFFAOYSA-N	438.484	1.472	50	20	IDGD	
CCOC(=O)c1cnn(C)c1NC(=O)C(=O)NNC(=O)c1ccc(Cl)cc1Cl	786422075	AGAUCEMYKJHOBL-UHFFFAOYSA-N	428.232	1.303	50	20	IDGD	
CCc1c(C(=O)OCC(=O)NNC(=O)c2cccc(C)c2)nnn1Cc1ccc(F)cc1	787164941	WVPPBOPQVGGJPY-UHFFFAOYSA-N	439.447	1.954	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1	787342023	QTHZMSSOJYWGPV-UHFFFAOYSA-N	429.311	1.467	50	20	IDGD	
CN1CCN(C(=O)NNC(=O)c2cccc(S(=O)(=O)Nc3ccc(F)cc3)c2)CC1	788168747	BDPIWAVVYNOHNR-UHFFFAOYSA-N	435.481	1.228	50	20	IDGD	
N#Cc1ccc(S(=O)(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1Br	788480895	NHIWKORXOWQKED-UHFFFAOYSA-N	438.259	1.715	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)[C@H]1CC(c2cccnc2)=NO1	790120286	CZEVHCUQRIWRIP-BDJLRTHQSA-N	433.262	1.952	50	20	IDGD	
O=C(NNc1cccc(F)c1[N+](=O)[O-])c1ccc(S(=O)(=O)NC[C@@H]2CCCO2)cc1	790585133	BXBOJROJFFPTIJ-ZDUSSCGKSA-N	438.437	1.948	50	20	IDGD	
CC(C)(CNC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)CN1CCCC1	790701224	IYLSCTOAMRSUTR-UHFFFAOYSA-N	430.597	1.651	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)NCc2ccc(N3C(=O)N[C@@](C)(C4CC4)C3=O)cc2)n1	790846897	OUJFQDMMPGHGDV-QFIPXVFZSA-N	436.472	1.759	50	20	IDGD	
CCc1nn(C)c(CC)c1CC(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	790885642	BSMKDNCNSRULQM-UHFFFAOYSA-N	436.557	1.723	50	20	IDGD	
COc1ccc(NNC(=O)[C@H]2[C@H](C)CC(=O)C[C@H]2C(=O)NNc2ccc(OC)cn2)nc1	791147438	ZMPUCJFHPNXZMW-FXHACXQTSA-N	442.476	1.312	50	20	IDGD	
CC(C)C[C@H](/N=C1/NS(=O)(=O)c2ccccc21)C(=O)NNc1nc2ccccn2n1	791241708	IXJKJHZMQPWUMI-AWEZNQCLSA-N	427.490	1.326	50	20	IDGD	
Cc1c(NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cccc1NC(=O)N(C)C	791908566	ALKVONRHWNHHIA-UHFFFAOYSA-N	433.490	1.959	50	20	IDGD	
CN(C)N(C(=O)c1c[nH]c2c(OC(F)(F)F)cccc2c1=O)[C@@H]1CCS(=O)(=O)C1	792853576	DYYJMCVXHQDQRR-SNVBAGLBSA-N	433.408	1.533	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNC(=O)C(=O)Nc1ccc2c3c(cccc13)CC2	797368507	BWCPSLLCKWOBMF-UHFFFAOYSA-N	446.463	1.951	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(NC(=O)NCc3ccco3)cc2)n1	797369991	DDKAJYUYPFUOAV-UHFFFAOYSA-N	436.428	1.704	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)N3CCC[C@H](C)C3)cc2C)n1	797370387	BBMRITCVEWDAEX-AWEZNQCLSA-N	437.500	1.970	50	20	IDGD	
COCCOc1cc([N+](=O)[O-])c(C(=O)NNC(=O)C(=O)Nc2ccc(C)cc2)cc1OC	798149486	RPYYFMKNELKHEX-UHFFFAOYSA-N	446.416	1.337	50	20	IDGD	
CCOc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NNC(=O)COc1ccc(OC)cc1	799257697	PVZSBJDGFBUCSA-UHFFFAOYSA-N	432.389	1.167	50	20	IDGD	
Cc1c(I)cc([N+](=O)[O-])cc1C(=O)NNc1nccn(C)c1=O	801629483	ZODWMWJBEFTQHE-UHFFFAOYSA-N	429.174	1.358	50	20	IDGD	
C[C@H](CCNS(=O)(=O)c1ccccc1)NC(=O)NNc1ccccc1S(C)(=O)=O	801797544	JJIJYVVZRMEGHK-CQSZACIVSA-N	440.547	1.473	50	20	IDGD	
O=C(N=c1cc[nH]cc1)NNC(=O)C1CCN(S(=O)(=O)/C=C/c2ccccc2)CC1	802030752	QOLFOYDDHCMQMA-XNTDXEJSSA-N	429.502	1.369	50	20	IDGD	
COc1ccc(Cn2ncc3cc(C(=O)NNC(=O)N=c4cc[nH]cc4)cnc32)c(OC)c1	802034652	VICRJYBRQHOFKR-UHFFFAOYSA-N	447.455	1.780	50	20	IDGD	
COc1ccc(N2CCN(C(=O)/C=C\C(=O)NNc3ccc4c(=O)[nH]ccc4c3)CC2)cc1	803428035	OCWZMPMXAVRMKN-HJWRWDBZSA-N	447.495	1.885	50	20	IDGD	
Cc1cc(F)cc2c1S(=O)(=O)N(CC(=O)NNC(=O)c1cccc(Cl)c1)C2=O	804917307	LPKFDCBXIPFQQA-UHFFFAOYSA-N	425.825	1.393	50	20	IDGD	
COC(=O)c1ccsc1N1CC[C@H](NC(=O)NNc2ccc3c(=O)[nH]ccc3c2)C1=O	806900250	UHHMEVZPOJDVMR-HNNXBMFYSA-N	441.469	1.808	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)COc1ccc(Br)cc1C(C)=O	807369159	REVJVGRDCBIQRG-UHFFFAOYSA-N	431.283	1.967	50	20	IDGD	
CN1CCN(C(=O)NNC(=O)c2cnn(-c3ncccc3Cl)c2C(F)(F)Cl)CC1	807381711	FQWBTFJDNBCSQU-UHFFFAOYSA-N	448.261	1.811	50	20	IDGD	
Cc1cc([N+](=O)[O-])ccc1NNC(=O)C(=O)Nc1ccc(C(=O)NC2CCOCC2)cc1	807456066	VPWIKWCKKFZCAD-UHFFFAOYSA-N	441.444	1.894	50	20	IDGD	
NC(=O)CC[C@@H](NC(=O)OCc1ccccc1)C(=O)NNc1ccc2c(=O)[nH]ccc2c1	807507509	PQYGSWKIELUDMH-GOSISDBHSA-N	437.456	1.532	50	20	IDGD	
CN(C)C(=O)CN1[C@H]2CC[C@H]1CC(NC(=O)NNC(=O)C13CC4CC(CC(C4)C1)C3)C2	807514053	IBDWHFBPPRSUSX-XAZDHKSNSA-N	431.581	1.617	50	20	IDGD	
CCCS(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1	808092384	RMJIGIIFURHKGH-UHFFFAOYSA-N	448.526	1.679	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN(C)C1CN(C(=O)OC(C)(C)C)C1	810074666	RXTUSHNGFPVLFB-UHFFFAOYSA-N	426.901	1.661	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)C(=O)Nc2cc(C)n(C3CCCCC3)n2)c1	810389375	DUBKODZDKHYULE-UHFFFAOYSA-N	427.465	1.450	50	20	IDGD	
COc1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2cc3ccccc3o2)cc1OC	810482607	HFZGNTDUZAIMGQ-UHFFFAOYSA-N	433.442	1.190	50	20	IDGD	
Cn1cncc1CNC(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	812489004	LGMYNSJBNLFXRZ-UHFFFAOYSA-N	431.460	1.266	50	20	IDGD	
Cn1nncc1CNC(=O)/C(C#N)=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	813793682	XLXQMFFZQVKMMD-RIYZIHGNSA-N	438.879	1.431	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)N[C@@H]2CCN(c3ccccc3F)C2)nc1	813854370	ZZVSMKACXZXLRY-CQSZACIVSA-N	436.513	1.812	50	20	IDGD	
O=C(Cc1nc(-c2ccccc2)cs1)NNC(=O)c1ccc2c(c1)NC(=O)CNC2=O	814268790	HYPULLVCHXFLPA-UHFFFAOYSA-N	435.465	1.496	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)NCc1cccc(N2CCOCC2)c1	814465388	OQSKTZUSJBDTQP-UHFFFAOYSA-N	435.525	1.659	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNc2ccc(Cl)nn2)nnn1CCOc1ccc(F)cc1	815557922	KIJLQEOYZKGJRF-UHFFFAOYSA-N	434.819	1.330	50	20	IDGD	
O=C(NNc1nc2ccccn2n1)C(=O)Nc1cccc(S(=O)(=O)C2CCCCC2)c1	815619731	WKVVSCBMEOCTDM-UHFFFAOYSA-N	442.501	1.918	50	20	IDGD	
Cc1nc(-c2cccc(NC(=O)C(=O)NNC(=O)[C@H]3CCc4nncn4C3)c2)cs1	815692724	ZJQKFQQHBJQPQT-ZDUSSCGKSA-N	425.474	1.059	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)c2ccc3oc(O)nc3n2)c2ccccc2c1=O	816828496	HICBAYMGDBPFSU-UHFFFAOYSA-N	436.428	1.903	50	20	IDGD	
CCC1CCC2(CC1)NC(=O)N(CC(=O)NNC(=S)Nc1ccccc1OC)C2=O	876220499	YMZHRDRHGZTTNA-UHFFFAOYSA-N	433.534	1.904	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)CCC(=O)c2ccc3c(c2)OCCCO3)C[C@@H](C)O1	912919427	NSYGFVHFSXYKSX-HZPDHXFCSA-N	433.505	1.458	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)CNC(=O)c1ccc(Br)cc1	913459250	BVMLSHDNVRYSSA-UHFFFAOYSA-N	434.290	1.968	50	20	IDGD	
Cn1c(=O)ccn(CC(=O)NNC(=O)c2cc(-c3ccccc3)nc3ccccc23)c1=O	915061819	SOTYLWINQVRJLT-UHFFFAOYSA-N	429.436	1.223	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NCCCOc3ccccc3)nc2)CC1	916219034	IQCOKAIBHVKVSD-UHFFFAOYSA-N	448.549	1.113	50	20	IDGD	
CNS(=O)(=O)c1cccc(CNC(=O)NNC(=O)CCSc2ccc(F)cc2)c1	916486046	URSISRROYUDEJV-UHFFFAOYSA-N	440.522	1.747	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)NC[C@@H](C)N2CCN(c3ccccc3)CC2)c1	916515070	ZVLKXUCVQDPLRH-LJQANCHMSA-N	425.533	1.915	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NC[C@H]2CCN(CC(F)(F)F)C2)cc(OC)c1OC	916578070	SMACHXLZNNAZEO-LLVKDONJSA-N	434.415	1.541	50	20	IDGD	
Cc1cc(C)n2nc(C)c(C(=O)NNC(=O)c3sc(N4CCOCC4)nc3C)c2n1	916734434	GKYCIAYMODXIBB-UHFFFAOYSA-N	429.506	1.331	50	20	IDGD	
O=C(COC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1)NNC(=O)[C@H]1COc2ccccc2O1	917331180	NBZSXTIKRFWLSD-MRXNPFEDSA-N	440.368	1.220	50	20	IDGD	
O=C(NN=Cc1cccc2c1OCCCO2)c1cccc(S(=O)(=O)N2CCOCC2)c1	917532441	KLHWJPDFJLKJJB-UHFFFAOYSA-N	445.497	1.633	50	20	IDGD	
COC(=O)c1ccc(S(=O)(=O)NNC(=O)c2ccc(OC(C)C)c(OC)c2)s1	917727495	HXSQHTAUOZTKBA-UHFFFAOYSA-N	428.488	1.954	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)NCCc2ccc(OCC(=O)NC3CC3)cc2)c1	918105933	NJAYJYPXKKJQQS-UHFFFAOYSA-N	439.516	1.597	50	20	IDGD	
CCCC[C@@H](/N=C1/NS(=O)(=O)c2ccccc21)C(=O)NNC(=O)c1ccc(C)cc1O	918337742	UAPCPTWAOAZZJB-MRXNPFEDSA-N	444.513	1.759	50	20	IDGD	
CCCS(=O)(=O)N1CCCC[C@@H]1C(=O)NNC(=O)[C@@H](C)Oc1ccc(OCC)cc1	918549399	KBSWFPLQQNKYQC-CRAIPNDOSA-N	441.550	1.594	50	20	IDGD	
O=C(CCNS(=O)(=O)c1cccc([N+](=O)[O-])c1)NNC(=O)c1cccc(Cl)c1	920338218	NANWMJIWBYOJCO-UHFFFAOYSA-N	426.838	1.378	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N2CCc3nc[nH]c3C2)cc1	929081107	PHRLKONOVJAAMD-YBEGLDIGSA-N	445.483	1.649	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2c[nH]c(Br)c2)cc1	1318499457	UZFJJSXUSAICRW-UHFFFAOYSA-N	429.296	1.167	50	20	IDGD	
CS(=O)(=O)Nc1cccc(F)c1CNC(=O)NNC(=O)c1ccc2ccccc2n1	1319050653	HHJMWJFPURMIFT-UHFFFAOYSA-N	431.449	1.890	50	20	IDGD	
CC[C@H](N=c1nn[nH]n1-c1ccccc1)C(=O)NNC(=O)c1cc(C)nc2ccccc12	1322585787	OJNSLVVZKVBGGF-SFHVURJKSA-N	430.472	1.593	50	20	IDGD	
NC(=O)c1cnc(C(=O)NNC(=O)COc2ccc(Br)cc2)c(Cl)c1	1324320195	WFMBCQYLOMRTMN-UHFFFAOYSA-N	427.642	1.436	50	20	IDGD	
CCN1CCOC[C@H]1C(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	1335336305	JZGPNPGWABDJGS-HNNXBMFYSA-N	438.531	1.031	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(N2C[C@@H](C(=O)O)CC2=O)cc1)c1ccccc1Cl	1337309749	KDCWOOLFQWPEIN-NSHDSACASA-N	437.861	1.401	50	20	IDGD	
COC(=O)c1cc(C(=O)NNc2c(OC)cccc2S(C)(=O)=O)n(-c2ccccc2)n1	1338094841	FWERVDXMBCHWQC-UHFFFAOYSA-N	444.469	1.828	50	20	IDGD	
COC[C@H](C)Oc1ccc(Cl)cc1S(=O)(=O)NNC(=O)c1n[nH]c2c1CCCC2	1338749464	GTMCDARFYUSEID-NSHDSACASA-N	442.925	1.979	50	20	IDGD	
Nc1cnnc(NNC(=O)NCCCNC(=O)c2ccc(Br)cc2)c1Cl	1340572943	KPUFGZWFSGGPOH-UHFFFAOYSA-N	442.705	1.921	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4c(c3)NC(=O)CO4)C2)C1	1778574180	OLRKEUZMMNUMNA-NRFANRHFSA-N	435.908	1.726	50	20	IDGD	
Cc1nc[nH]c1CSCC(=O)N1CC[C@]2(CN(C(=O)CCBr)CCO2)C1	1778908905	JOTZITYPXVSCSD-QGZVFWFLSA-N	445.383	1.566	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(NC(C)=O)o3)C2)C1	1779030327	OBIKWIADDBEWOX-UGSOOPFHSA-N	442.310	1.855	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(CCN(C(=O)c3nnc(-c4ccccc4)o3)C2)C1	1779110948	WCNWRTNTUDFXTQ-IBGZPJMESA-N	449.305	1.965	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](C)n3ccccc3=O)C2)C1	1779272522	WNLKVBYVZYPVEC-YZVOILCLSA-N	440.338	1.413	50	20	IDGD	
O=C(c1ccn(C(F)F)n1)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1779617039	OUJKTRJFDZAJCC-IINYFYTJSA-N	425.205	1.412	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnn(C)c3Cl)C2)C1	1779857216	ZGHXRMORZSGXIT-BZNIZROVSA-N	433.734	1.548	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)c3c(F)cccc3Cl)C2)C1	1780512610	VCMVQYVZNYXUKY-FQEVSTJZSA-N	440.903	1.296	50	20	IDGD	
CCOc1c(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](Cl)CC)C3)C2)cnc2c1cnn2C	1781217439	IPBGAYNGXJYOIH-HRAATJIYSA-N	449.939	1.828	50	20	IDGD	
Cc1cccnc1CCC(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781326337	NNFYIVYXGYQWJR-AEFFLSMTSA-N	428.302	1.843	50	20	IDGD	
COc1cnc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)c(F)c1	1781328139	JCXDQOJWGMSHEI-CJNGLKHVSA-N	434.237	1.363	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(=O)ccn1C)C2	1781998384	ZMADTURXCOFKNT-VVFCZOMOSA-N	440.338	1.296	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccc4ncnn4c3)CCO2)C1	1783349062	GURABKQLZOIDQO-RDTXWAMCSA-N	436.310	1.346	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@H]1C(=O)N1CC[C@@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1783848871	ASWAAHPMTFMNGH-CBGDNZLLSA-N	438.597	1.423	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](C)N(C)C(=O)OC(C)(C)C)CCO2	1783880013	DPHXZSAETHWKQK-SIFCLUCFSA-N	447.960	1.326	50	20	IDGD	
CN(C)c1ccc([N+](=O)[O-])c(C(=O)N2CCO[C@]3(CCN(C(=O)C(Cl)Cl)C3)C2)c1	1783948501	PWSRPKQBBRFVSL-SFHVURJKSA-N	445.303	1.908	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccnc(F)c3)[C@H]2C1	1784734658	KUSYEGVDOJSQTG-UNQGMJICSA-N	428.302	1.845	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CSc3ccncc3)[C@H]2C1	1785162386	QCEWURWHDJDBBQ-HJWJTTGWSA-N	427.954	1.407	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)c1cn2cccnc2n1	1788311345	ZXSNAJCYFIUYHD-IMIFBBOLSA-N	440.273	1.013	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)[C@@H](O)CCl)CCC2)cc1)c1cccn2c(O)nnc12	1788518699	LQYBZBSEXGTZGG-HNNXBMFYSA-N	429.864	1.782	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3c(O)cc(O)cc3O)C[C@@H]21	1788763930	ZLOXRDPIAKPNTN-JDFRZJQESA-N	438.553	1.248	50	20	IDGD	
COc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]32)nn1	1789103699	FNDCWHKKTQVTQA-MMNXLFCMSA-N	431.320	1.315	50	20	IDGD	
CCOc1cnc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]3C2)cn1	1789868339	CRRJZZAPHNHVSF-NGOJXBLDSA-N	445.347	1.705	50	20	IDGD	
CCc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]3C2)cc1	1791291025	XKXAESYXXVSLBA-UFYCRDLUSA-N	430.549	1.215	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]3C2)cc1O	1791296850	RSINJGPUQDPODA-XEZPLFJOSA-N	444.315	1.748	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)CCSC)[C@H]2C1	1791308792	NQKOHGUIUVHHHM-RMEBNNNOSA-N	437.400	1.254	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC1(c2ccc(NC(=O)CC3(O)CCC3)cc2)CCC1	1792030440	MVXKLQFATCCYAR-UHFFFAOYSA-N	437.500	1.738	50	20	IDGD	
COc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)CBr)s1	1792870428	OOFLIIUZKHDPHD-MCYUEQNJSA-N	431.352	1.991	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@](C)(Cl)CCl)C2	1792874545	QZLFVFWEKBNMBY-OVKLUEDNSA-N	430.170	1.843	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1(c2ccc(O)cc2)CC1	1793027264	QABWMBPDMNZHOS-VWPFQQQWSA-N	437.334	1.797	50	20	IDGD	
CN1Cc2ccccc2C[C@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CO[Si](C)(C)C)C2	1793829414	QQHKZYSYTRFJMR-IIZPIQPGSA-N	445.636	1.484	50	20	IDGD	
CCc1nn(C)c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)Br)C3)c1Cl	1794424875	DADDBHUFVWFMGU-DYNIEEOBSA-N	447.761	1.623	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccc(F)cn1	1795794692	YYCUUCKUQAKMTA-JRATXPSKSA-N	428.302	1.384	50	20	IDGD	
Cc1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)cc1Cl	1796185797	QDOGWEIQSRUCAX-REPLKXPHSA-N	426.709	1.894	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](C)Br)C2	1796893502	CFMDBZHNASHQMR-VYZKQCBTSA-N	438.326	1.542	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cn2cc(F)ccc2n1	1797430182	GLGUYBREAXFALS-LSSIXWDNSA-N	439.285	1.460	50	20	IDGD	
CCc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)CBr)C3)n(C)n1	1798165218	QWPPWYGOVGMKGT-NFFDBFGFSA-N	427.343	1.217	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(F)cc(F)c1)C2	1798441948	PKQGJYFDVJPNEI-MUJYYYPQSA-N	429.427	1.529	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)c(O)c(Cl)c1	1799768316	RLPKRUBQBBAFQT-GCDPNZCJSA-N	447.713	1.738	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CC[C@H]2CCC(=O)N2C1)[C@@H](F)Br	1799930541	AUIFXNSWDPXXCJ-SOBZTRSMSA-N	430.318	1.716	50	20	IDGD	
O=C(CNC(=O)c1cccs1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](F)Br	1800157738	VKXYRYDXBIUNGS-FBKDDSFISA-N	432.315	1.807	50	20	IDGD	
C/C=C(\C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2	1800466319	COHIMRQRFGXZRL-QDLNHOJZSA-N	431.445	1.690	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(-c3ccncc3)[nH]n1)C2	1800760654	YMRRCBGHBFMJEE-DPYKFYPSSA-N	448.321	1.458	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc3cc(Cl)ccn13)C2)C(Cl)Cl	1801016241	OWKCBQWNZHJFLD-WDAIWFPHSA-N	431.707	1.995	50	20	IDGD	
COC(=O)C12CC(C(=O)N3CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]3c3cccnc3)(C1)C2	1803147001	FPWOIOOBNUYPQB-TVZLTPBZSA-N	435.908	1.030	50	20	IDGD	
Cc1cnc(C(=O)N2CCCC3(CCN(C(=O)c4ccc(B(O)O)cc4)CC3)C2)s1	1807914153	VCKOCCKVUHRUNY-UHFFFAOYSA-N	427.335	1.290	50	20	IDGD	
CCc1ncccc1C(=O)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1	1809969354	RSKSHJVSAHGOSX-UHFFFAOYSA-N	435.333	1.482	50	20	IDGD	
O=C(C#Cc1ccccc1)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1	1809976581	IBPSREMXXILIAH-UHFFFAOYSA-N	430.313	1.263	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)[C@H](OC(C)=O)C(C)C)[C@H]1c1cccnc1	1810108991	QLDYWFQXVUNYJX-FCGDIQPGSA-N	439.940	1.929	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1CCN(C(=O)CCn2cncn2)[C@H]1c1cccnc1	1810547381	FQHXXLTXRLSXED-PXNSSMCTSA-N	430.585	1.621	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)Nc2cnccn2)[C@@H]1c1cccnc1	1813033131	ZYXVZQODHAYGQU-QSOKESPWSA-N	446.939	1.632	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)/C=C/c2ccoc2)[C@H]1c1cccnc1	1813071731	WHTUAWSPEDRCMU-VTQAWEMUSA-N	439.516	1.767	50	20	IDGD	
COC(=O)NCC(=O)NC[C@@H]1CCN(C(=O)[C@H](C)CBr)[C@@H]1c1cccnc1	1813262104	CBXDNRXSQWARMZ-IVMMDQJWSA-N	441.326	1.474	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)cc([N+](=O)[O-])c2)[nH]n1)[C@H](O)CCl	1814873007	QFYJHFOSGOUKDG-LSDHHAIUSA-N	437.840	1.929	50	20	IDGD	
O=C(CCBr)Nc1cc([C@H]2CCCCN2C(=O)c2cnc(O)nc2O)[nH]n1	1816780619	AGVMVSWHHAKPAS-LLVKDONJSA-N	439.270	1.702	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](N)Cc2cscn2)n[nH]1	1817980466	MEBYQAPEDAJCJC-IPYPFGDCSA-N	440.957	1.682	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(O)nc(O)n2)n[nH]1	1818032142	SYBKSAIGNNWOGN-GZMMTYOYSA-N	439.270	1.700	50	20	IDGD	
CC(C)=NO[C@@H](C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1820970349	ZPANVQKNMDMQMG-KBXCAEBGSA-N	441.297	1.196	50	20	IDGD	
O=C(Cn1ccncc1=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](F)Br)CC2	1824536687	QGPQVPYJJSTQQO-OQPBUACISA-N	444.286	1.003	50	20	IDGD	
COCCOCCOCCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](F)Cl)CC2	1825773100	MCEWOIUHEHJTIB-XHDPSFHLSA-N	437.921	1.659	50	20	IDGD	
CCOC(=O)C(C)(C)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](Cl)COC)sc2C1	1826009342	RZVHPAVVMVSCJQ-GHMZBOCLSA-N	431.942	1.898	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccnc1S)CC2	1826081023	MAJNQGYQGHNIPR-NSHDSACASA-N	448.574	1.426	50	20	IDGD	
Cc1ccnc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)c1	1827052928	OYIQBECWMKOJDP-JOCHJYFZSA-N	435.333	1.617	50	20	IDGD	
Cc1cc2nnc(C(=O)N3CCCC[C@@H]3C3CCN(C(=O)[C@H](O)CCl)CC3)c(C)n2n1	1828144802	OEWYXYCYDGDQLY-IAGOWNOFSA-N	448.955	1.574	50	20	IDGD	
CC(C)N(C)CC(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1	1828925395	JKKNTUKDSMZRFO-HXUWFJFHSA-N	444.580	1.259	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cnoc2)CC1	1828926453	IBRIWZYCWKKUBG-GOSISDBHSA-N	426.477	1.220	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(O)nc2)CC1	1829723619	RUPZUTJXUBYPCJ-FQEVSTJZSA-N	437.305	1.014	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4c[nH]nc4c3)C2)C1	1830358663	YWOMPDRJJFFDQH-NRFANRHFSA-N	434.924	1.898	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4c(c3)CC(=O)N4)C2)C1	1830362194	NSBSSTQLFGRGIS-QFIPXVFZSA-N	449.935	1.516	50	20	IDGD	
Cc1ncc(C(=O)N2CCC([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)cn1	1831872414	VKOKEQVIZKYHFI-LJQANCHMSA-N	430.553	1.391	50	20	IDGD	
CCS(=O)(=O)N[C@H](C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)C(Cl)Cl)CC1	1831875188	UXJAONXUFIAIED-OCCSQVGLSA-N	442.409	1.738	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)CC[C@@H]2CCOC2)CC1	1831876934	NCEGAILXHOJYKK-QUCCMNQESA-N	436.597	1.796	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2CCNC(=O)C2)CC1	1831942382	VRPPPPSGQKGWJH-IMJJTQAJSA-N	428.371	1.916	50	20	IDGD	
CS(=O)(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@H](F)Br)CC1	1832402169	VBPFUFSIVUQPCE-ZFWWWQNUSA-N	441.363	1.731	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cncc4cnccc34)CC2)CC1)[C@@H](O)CCl	1833312530	QKVKDTCRNHOABK-FQEVSTJZSA-N	445.951	1.415	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccccc3O)CCO2)C1	1833758149	OOHVDXFXCGFRCR-RBUKOAKNSA-N	431.316	1.699	50	20	IDGD	
CCc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)cn1	1833892838	UWUJXXXAWCHHKU-VQTJNVASSA-N	444.359	1.950	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3ncc(C)s3)CC2)CC1	1834061319	JZOISYPVZMPECK-MRXNPFEDSA-N	428.986	1.891	50	20	IDGD	
Cc1ncc(C(=O)NC2CCN(C3CCN(C(=O)CO[Si](C)(C)C)CC3)CC2)cn1	1834063855	IYYZNIOTGBVQLC-UHFFFAOYSA-N	433.629	1.822	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1)c1ccc(O)nn1	1834070499	WUWVRVCIIJBCFE-UHFFFAOYSA-N	440.342	1.152	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCC(N2CCC(NC(=O)c3cncnc3)CC2)CC1	1834237184	RTWJCCSIRNRWSO-IBGZPJMESA-N	428.364	1.898	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3cc(=O)cco3)CC2)CC1	1834345185	NZUPVSMLSQQXKY-ZDUSSCGKSA-N	440.338	1.608	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)Cc3cccc(F)c3)C2)C1	1834822402	LEXCEVDBRRBZKR-LJQANCHMSA-N	443.313	1.610	50	20	IDGD	
Cc1cccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)c1	1835042380	OMOCWKBLOMNMHQ-PKOBYXMFSA-N	443.313	1.684	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccc(F)c(F)c3)CCO2)C1	1835140423	GUJLZQWDLYKDDC-YWZLYKJASA-N	430.879	1.981	50	20	IDGD	
CCOc1ccccc1C(=O)NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836242261	LLDRIEAUFYUYRP-IBGZPJMESA-N	437.968	1.870	50	20	IDGD	
CC[C@@H](NC(N)=O)C(=O)N1CCC(OC2CCN(C(=O)C(C)(C)CCl)CC2)CC1	1836623619	XOOGCMIIWJMIHR-MRXNPFEDSA-N	430.977	1.697	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)CCc3ccccn3)C2)C1	1837710293	TTZVQXPOSCSQLO-NRFANRHFSA-N	435.597	1.322	50	20	IDGD	
O=C(c1cc(O)c(O)c(Cl)c1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1839434021	JFHXWXMUTHLHLJ-RHSMWYFYSA-N	437.251	1.356	50	20	IDGD	
C=C(C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)Br)C2)C1)C(F)(F)F	1839894575	GKMOVCAIFLGGFS-BXUZGUMPSA-N	429.233	1.345	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C)C2)C1	1839964458	RVKQRHLSGZBUGG-LPHOPBHVSA-N	440.338	1.634	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc([N+](=O)[O-])o3)C2)C1	1840029376	BYRLXFSIDNUOFT-ZBEGNZNMSA-N	446.254	1.041	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3Cl)C2)C1	1840153582	UPMPTOYQOPKCNL-MAUKXSAKSA-N	432.304	1.059	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2ccc3cnccc3c2)C1	1843731930	YGNSXACOHQBIJA-UHFFFAOYSA-N	430.468	1.364	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1ccccc1OC(F)F)C2	1844265540	MZPSIMKHIQQBNI-UHFFFAOYSA-N	445.426	1.417	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)c1ccc(-c3ccc(O)nn3)cc1)C2	1846363787	DTXBGGWPXUUURH-INIZCTEOSA-N	430.892	1.920	50	20	IDGD	
C=CC[C@@H](CC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl)NC(=O)OC(C)(C)C	1847568007	JSNLWEPYPXQDPD-VGWMRTNUSA-N	429.945	1.647	50	20	IDGD	
COc1ccc(N(C)S(=O)(=O)c2cccc(C(=O)NNc3nnc(C)c(=O)[nH]3)c2)cc1	11548079	UQKYIKQHDSMAPJ-UHFFFAOYSA-N	444.473	1.064	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)ccc1Cl	15795107	OCSJFTQLLIDOAP-HNNXBMFYSA-N	439.877	1.191	50	20	IDGD	
CSc1nc2nc(C)c(CC(=O)OCC(=O)NNC(=O)c3ccc(C)cc3)c(C)n2n1	19614532	DPGGOSYRUOYIAB-UHFFFAOYSA-N	442.501	1.318	50	20	IDGD	
Cc1ccc([C@@]2(C)NC(=O)N(CC(=O)NNC(=O)Cc3c[nH]c4ccccc34)C2=O)cc1	24453616	NZRWEEIDJOMYCZ-HSZRJFAPSA-N	433.468	1.633	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CSc2nnc(-c3cccnc3)n2C)cc1OC	28628760	VNTTXZROZFCKGM-UHFFFAOYSA-N	428.474	1.448	50	20	IDGD	
COc1ccc(C[C@H](NC(=O)NNC(=O)C(=O)N2CCCC2)c2ccccc2)cc1OC	727605129	SMIJGBQTRODUHH-SFHVURJKSA-N	440.500	1.940	50	20	IDGD	
O=C(CSc1nncn1CCc1ccccn1)NNC(=O)c1ccc([N+](=O)[O-])cc1	727744795	HUJDESLYGDNAKW-UHFFFAOYSA-N	427.446	1.377	50	20	IDGD	
CCOC(=O)c1ccc(Br)c(S(=O)(=O)NNC(=O)c2cccn2C)c1	728503261	LHKVVRDDIALURP-UHFFFAOYSA-N	430.280	1.588	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)[C@@H]2CCCN2c2ncnc3sccc23)c2ccccc2c1=O	728512296	OCCHCFANAKMCEO-HNNXBMFYSA-N	449.496	1.368	50	20	IDGD	
CCOC(=O)C1=NN(c2ccccc2)[C@@H](C(=O)NNC(=O)COc2ccccc2OC)C1	728713340	RCQOPYNIFOZHNR-QGZVFWFLSA-N	440.456	1.419	50	20	IDGD	
CC(=O)Nc1ccc(S[C@@H](C)C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1	728845529	LGRGPQOTICRZQW-AWEZNQCLSA-N	442.545	1.980	50	20	IDGD	
O=C(Cc1ccc(NS(=O)(=O)c2cccs2)cc1)NNC(=O)Cc1cccnc1	728891882	IJCHIWVMQKONHM-UHFFFAOYSA-N	430.511	1.877	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CN2CCC[C@H](NS(=O)(=O)c3cccc(F)c3)C2)cc1	729482088	KJVYIUAKYXYKLW-SFHVURJKSA-N	448.520	1.338	50	20	IDGD	
CCN1CCC[C@H]1CN1C[C@@H](C(=O)NNC(=O)c2ccc(OC(C)C)c(OC)c2)CC1=O	729627180	PNQZPEBSBVQAOB-ROUUACIJSA-N	446.548	1.576	50	20	IDGD	
CN(C)c1ccc(NC(=S)NNC(=O)c2ccc(CCNS(C)(=O)=O)cc2)cc1	729690064	ZTCSBUXMUVGYJM-UHFFFAOYSA-N	435.575	1.476	50	20	IDGD	
CCOC(=O)/C(C#N)=C\NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2OC)c1	730941468	WBXQOJTYAQNXHF-SQFISAMPSA-N	444.469	1.701	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)N1CCC([C@@H](O)c2ccc(F)cc2)CC1	731043616	IGVZBMJLUFCRAL-SFHVURJKSA-N	434.493	1.803	50	20	IDGD	
Cc1c(C(=O)OCC(=O)NNC(=O)c2ccccc2)nnn1-c1cccc2cccnc12	731524024	YHNSZTFSTIWQLW-UHFFFAOYSA-N	430.424	1.742	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)CCC/N=C1/NS(=O)(=O)c2ccccc21)c1ccccc1	732133102	PWZWFYBAEWJMOL-INIZCTEOSA-N	428.514	1.847	50	20	IDGD	
Cc1ccc(S(=O)(=O)n2ccc(C(=O)NNC(=O)Cn3cnc4ccccc43)c2)cc1	732259454	DWGBTJYATHTAMY-UHFFFAOYSA-N	437.481	1.844	50	20	IDGD	
COc1ccc2c(C)c(CCC(=O)NNC(=O)CCN3C[C@H](C)O[C@H](C)C3)c(=O)oc2c1	732259537	GRZKBUBYRJXKGI-GASCZTMLSA-N	445.516	1.689	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)N[C@@H](Cc1ccccc1)CN1CCOCC1	732476355	GICOMFAMJBAXFG-HKUYNNGSSA-N	444.507	1.867	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2ccc(C(=O)NNc3nccnc3Cl)cc2)C[C@H](C)O1	734260755	LPXJBSVEGVEFHS-RYUDHWBXSA-N	425.898	1.685	50	20	IDGD	
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC[C@@H](C(=O)NNc2cc(F)c(F)cc2F)C1	734553472	NUPGCEGYQHWYSL-LLVKDONJSA-N	431.440	1.988	50	20	IDGD	
Cc1nn(C)c2sc(C(=O)N[C@H](C)C(=O)NNC(=O)c3cc(Cl)ccc3O)cc12	743295035	DWXPJXXIJAJNQY-SECBINFHSA-N	435.893	1.882	50	20	IDGD	
COc1ccccc1OCC(=O)NN[C@H](C(N)=O)c1ccc(Br)cc1F	743464859	ONEDTDVRMOHTKT-INIZCTEOSA-N	426.242	1.823	50	20	IDGD	
CSCC[C@H](NC(=O)c1ccc2ccccc2n1)C(=O)NNc1ncnc2[nH]cnc12	743473044	JZHHLYMOTZYFCX-HNNXBMFYSA-N	436.501	1.896	50	20	IDGD	
COc1ccccc1O[C@@H](C)CNC(=O)NNC(=O)c1sc(N2CCOCC2)nc1C	743510182	RBMNVOLTLNYNQV-ZDUSSCGKSA-N	449.533	1.708	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NC[C@H](O)c1cnn(C)c1	743521295	RCYXDBJYDLPXBN-HZMBPMFUSA-N	426.271	1.014	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CC(=O)N(Cc2ccccc2)C1)c1cc(Br)ccc1O	743733713	PYDRXJACBGPCJH-CYBMUJFWSA-N	432.274	1.964	50	20	IDGD	
C[C@H](NC(=O)c1n[nH]c2ccccc12)C(=O)NNC(=O)c1cc(Br)ccc1O	743733935	UYPIAUAYYJYKMI-VIFPVBQESA-N	446.261	1.611	50	20	IDGD	
NC(=O)c1cc(C(=O)NNC(=O)c2cc(Br)ccc2O)nn1-c1ccccc1	743734024	ZEQOZMDFRRTJGF-UHFFFAOYSA-N	444.245	1.514	50	20	IDGD	
COc1ccc2cc(C(=O)NNc3ccccc3S(=O)(=O)N3CCOCC3)[nH]c2c1	744621421	RVPZBMKWWXTGRV-UHFFFAOYSA-N	430.486	1.954	50	20	IDGD	
Cc1nccn1CCCCNC(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12	745843095	ZNMFPAFSFIADKK-UHFFFAOYSA-N	425.493	1.907	50	20	IDGD	
CN(C)[C@@H](C(=O)NNC(=O)C1CCN(c2ncccn2)CC1)c1c(F)cccc1Cl	746218078	BGIVSPMMXZSFOQ-QGZVFWFLSA-N	434.903	1.936	50	20	IDGD	
Cc1cccc(N2CCN(CCC(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)CC2)c1	746270277	SVFRNAYIDBMOKI-UHFFFAOYSA-N	448.568	1.362	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)c2cc(S(=O)(=O)NC)ccc2Cl)o1	746391897	IANVFXANGVZUHL-UHFFFAOYSA-N	442.925	1.758	50	20	IDGD	
COc1cc(N2C[C@H](C(=O)NNc3cc(Cl)nc(C)n3)CC2=O)cc(OC)c1OC	747982133	RJVQJFXIURUQJW-LLVKDONJSA-N	435.868	1.960	50	20	IDGD	
CC(C)(C)CC(=O)N1CCC[C@H]1C(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	748391898	ZUPXIAXMTVJFLO-HNNXBMFYSA-N	434.449	1.326	50	20	IDGD	
COc1ccc(CC(=O)NNc2ccc(F)cc2C)cc1S(=O)(=O)N1CCOCC1	748551625	MDVZCCFEPDSMFV-UHFFFAOYSA-N	437.493	1.849	50	20	IDGD	
Cc1c(NNC(=O)[C@H]2CN(Cc3nc(O)c4ccccc4n3)CCO2)cccc1[N+](=O)[O-]	748693387	LXAQAEJUGQTFGJ-GOSISDBHSA-N	438.444	1.896	50	20	IDGD	
CS(=O)(=O)Cc1cccc(CNC(=O)NNC(=O)c2cc(Br)c[nH]2)c1	749192594	RNZGCZJTISOGPP-UHFFFAOYSA-N	429.296	1.466	50	20	IDGD	
CCC1(C(=O)NNC(=O)C[C@H]2c3cc(OC)c(OC)cc3CCN2S(C)(=O)=O)CC1	749524038	MEHHJNNPLLNZNF-HNNXBMFYSA-N	439.534	1.290	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)N[C@@H]1CCN(CCCc2ccccc2)C1=O	750659394	GCNLHGRYLRHGLQ-LJQANCHMSA-N	428.464	1.769	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)c1cc(Cn2cc(Br)cn2)on1	751540048	CJJLTUXPHGPNQY-HNNXBMFYSA-N	448.233	1.283	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1cc(F)c(F)c(O)c1F	755435882	WERXDCTZBIQBQF-UHFFFAOYSA-N	431.392	1.587	50	20	IDGD	
COc1ccc(NNC(=O)CNC(=O)[C@H]2CCCN2C(=O)OC(C)(C)C)c([N+](=O)[O-])c1	755514211	DQZNEIWNIJPUFF-CQSZACIVSA-N	437.453	1.562	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)Nc2cccc(S(=O)(=O)/N=C3\CCCN3C)c2)n1	756033332	XWNSNPIAVYCFLI-JJIBRWJFSA-N	447.521	1.166	50	20	IDGD	
CC[C@@H]1CN(CC(=O)NNC(=O)c2ccc(C#N)cc2)CC[C@H]1NC(=O)OC(C)(C)C	757101266	HFJHUCSATXGXEB-SJLPKXTDSA-N	429.521	1.944	50	20	IDGD	
Cc1nn(Cc2ccc(C(=O)NNC(=O)C(=O)Nc3ccccn3)cc2)c(C)c1[N+](=O)[O-]	758834419	OJEXBXRKRZDVTJ-UHFFFAOYSA-N	437.416	1.251	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)N[C@H]1CCN(C(=O)C2CCCC2)C1	762092391	SRXGHRZINSFGTP-HNNXBMFYSA-N	426.477	1.313	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)CN1C(=O)c2cccc([N+](=O)[O-])c2C1=O	762409485	PWLPNPHCMPORKM-UHFFFAOYSA-N	444.425	1.139	50	20	IDGD	
O=C(NNC(=O)c1ccc(S(=O)(=O)Nc2nccs2)cc1)C1=S=C2CCCC2=C1	763013465	PGAUKLOJGAAXAG-UHFFFAOYSA-N	448.551	1.907	50	20	IDGD	
CN1CC[C@@H](CNC(=O)NNC(=O)C(=O)Nc2ccccn2)[C@@H]1c1ccc(Cl)c(F)c1	763093309	VIYRHBVIQNSAGT-GUYCJALGSA-N	448.886	1.836	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNS(=O)(=O)c1cc(C(=O)O)ccc1Cl	763438557	BPTFSIQCFNPJAK-UHFFFAOYSA-N	435.886	1.653	50	20	IDGD	
CCN(CC)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)cn1	763538541	CZRICIDCCACRLO-UHFFFAOYSA-N	445.476	1.353	50	20	IDGD	
CCOc1ncccc1NC(=O)C(=O)NNC(=O)COc1cccc(C(F)(F)F)c1	763638962	FVFKOFKNKDZRBW-UHFFFAOYSA-N	426.351	1.664	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(C(=O)NC(C)(C)C)c2)cc1	763661943	QSQAYFGKYXNCRG-UHFFFAOYSA-N	442.472	1.388	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cc(F)ccc2Br)cc1	763678975	KOUJQAXKPIINSJ-UHFFFAOYSA-N	435.209	1.625	50	20	IDGD	
Cc1cc(C(=O)NCC(C)C)ccc1NC(=O)C(=O)NNC(=O)COc1ccccc1F	763682151	YAZZRBSWADUSPO-UHFFFAOYSA-N	444.463	1.685	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cnn(Cc2ccccc2)c1	763683218	XTVVYYCKFAHYGV-UHFFFAOYSA-N	437.456	1.495	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(C)c(NS(C)(=O)=O)c1	763712390	PSYDDTAAQDNARB-UHFFFAOYSA-N	448.501	1.094	50	20	IDGD	
CC(C)CNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cccc(N(C)C)c2)cc1	763757139	DPPKMIFOGDHOGZ-UHFFFAOYSA-N	425.489	1.538	50	20	IDGD	
CC(C)N(C)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])cc1F	763804293	RODWWXXYSLSRGP-UHFFFAOYSA-N	447.423	1.743	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(N3CCCC3=O)cc2)c1C	763850650	OUXZYWTWYYUVOJ-INIZCTEOSA-N	438.484	1.984	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cccc(NC(C)=O)c2)cc1	763861373	OQMFVXPRIPEQCA-ZDUSSCGKSA-N	428.445	1.597	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cnn(CC#N)c2)ccc1OCCC(C)C	763914499	NZTGIJTWPPVGLF-UHFFFAOYSA-N	428.449	1.240	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3ccccc3Cn3cncn3)cc2C1	763943059	QEZGMYUFMWDXBH-ZDUSSCGKSA-N	438.513	1.912	50	20	IDGD	
COCCc1noc(-c2cc(Cl)ccc2NC(=O)C(=O)NNC(=O)c2cccn2C)n1	763996176	MBYJBKHWDJWYAT-UHFFFAOYSA-N	446.851	1.317	50	20	IDGD	
COc1ccc(Cl)c(NC(=O)C(=O)NNC(=O)c2cc(Br)cn2C)c1	764004796	MVFJEZIABLMMDF-UHFFFAOYSA-N	429.658	1.849	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2ccc(N3CCOC3=O)cc2)cc1	764125496	YGJZHRAXQGEQPK-UHFFFAOYSA-N	426.429	1.371	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2cc(C)n(-c3cc(C)cc(C)c3)n2)c1O	764132910	SRZRLOXCFAOTAI-UHFFFAOYSA-N	437.456	1.911	50	20	IDGD	
C[C@H]1CN(C(=O)c2ccc(NC(=O)C(=O)NNC(=O)c3ccc(C#N)cc3)cc2)C[C@H](C)O1	764177517	QGMZYKYTCZKOOQ-GJZGRUSLSA-N	449.467	1.207	50	20	IDGD	
Cc1ccc(Cn2cccc(NC(=O)C(=O)NNC(=O)c3ccc(C#N)cc3)c2=O)cc1	764181745	GIMWCPSBBOEQEA-UHFFFAOYSA-N	429.436	1.476	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)NCC(F)(F)F)cc2)c1	764242594	VLWVVMSTCKCYEF-UHFFFAOYSA-N	433.346	1.250	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3nccnc3c2)cc1Br	764326083	FATWGIAASQGUQO-UHFFFAOYSA-N	444.245	1.801	50	20	IDGD	
CCNS(=O)(=O)c1cccc(C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)c1	764329600	YQGIBIHWNSLPBC-UHFFFAOYSA-N	438.456	1.912	50	20	IDGD	
CON(C)S(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc3ccccc3o2)cc1	764330632	DIDXUBYVCWWXDB-UHFFFAOYSA-N	446.441	1.014	50	20	IDGD	
C[C@@H]1CN(Cc2ccccc2NC(=O)C(=O)NNC(=O)Cc2ccncc2)C[C@@H](C)O1	764354572	SZIWHCHHPHBIAJ-HZPDHXFCSA-N	425.489	1.019	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)C(=O)Nc1cccc(C[S@](=O)c2ccccc2)c1	764355026	YDAHITJGZYYZOJ-HKBQPEDESA-N	436.493	1.718	50	20	IDGD	
CC(C)(C)c1ccc(OCC(=O)NNC(=O)Nc2nc(CS(C)(=O)=O)no2)cc1	765244533	AWVJESUHIBQNIZ-UHFFFAOYSA-N	425.467	1.143	50	20	IDGD	
Cc1c(Br)cc(C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)c(=O)n1C	765475114	CNXWGVCPFLKYOF-UHFFFAOYSA-N	436.291	1.983	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)Cc3ccc(OCC#N)cc3)n[nH]2)cc1OC	765597273	QWZMHBAUMVOVLN-UHFFFAOYSA-N	435.440	2.000	50	20	IDGD	
CN1CCO[C@H]([C@H](NC(=O)NNC(=O)COc2ccccc2O)c2ccc(Cl)cc2)C1	766319662	NUHGCXFEZWZJEV-AZUAARDMSA-N	448.907	1.827	50	20	IDGD	
C[C@H]1CN(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)[C@H](C)CN1Cc1ccccc1	766517495	GVUHHLBIIRKWDD-DLBZAZTESA-N	434.504	1.612	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)CN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1	766900552	ZYSZNPZBAZSQMF-UHFFFAOYSA-N	439.472	1.051	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNS(=O)(=O)c1cc(C)c(F)c([N+](=O)[O-])c1	768268853	JHHNRJMIAXUAAP-UHFFFAOYSA-N	427.410	1.830	50	20	IDGD	
CCOC(=O)c1cc(C(=O)NNc2c(OC)cccc2S(C)(=O)=O)cc([N+](=O)[O-])c1	768631042	ZGUZXJHLOJPPFB-UHFFFAOYSA-N	437.430	1.941	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)[C@@H](Cc1cccc(F)c1)n1nnnc1C	768631144	ZSURIOXYWPAPPH-OAHLLOKOSA-N	448.480	1.460	50	20	IDGD	
O=C(NCc1ccc2c(c1)COC2)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	770415144	QYABYEQNMSDFDK-UHFFFAOYSA-N	444.513	1.646	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)C3CCN(C(=O)CCOc4ccccc4)CC3)nc21	770971084	GEWLZMPNBWCKLL-UHFFFAOYSA-N	439.476	1.220	50	20	IDGD	
C[C@H]1CCCCN1S(=O)(=O)c1cccc(C(=O)NNc2nc(O)c3cnn(C)c3n2)c1	770973760	HKFFGQGKUWFFFE-LBPRGKRZSA-N	445.505	1.389	50	20	IDGD	
COc1ccc(C)cc1[C@@]1(C)NC(=O)N(CC(=O)NNc2oc(C(C)C)nc2C#N)C1=O	771383211	SWQTUFTVFPKHSZ-OAQYLSRUSA-N	440.460	1.897	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cc([N+](=O)[O-])c3nsnc3c2)cc(OC)c1OC	771499658	FXDRGMBHLXLRGV-UHFFFAOYSA-N	433.402	1.700	50	20	IDGD	
CC[C@H](C)[C@@H](C(=O)O[C@@H](C)C(=O)NNC(=O)CC(C)C)N1C(=O)c2ccccc2C1=O	771875327	RLHYVZJYTGFFJJ-DEYYWGMASA-N	431.489	1.823	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1ccc(S(=O)(=O)N2CCC[C@@H](C)C2)cc1	771942283	WJIZCPUMAPEYMI-ZIAGYGMSSA-N	425.507	1.210	50	20	IDGD	
CC(C)(C)OC(=O)Nc1cccc(CC(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)c1	772158173	OGGDRPUJMNPWJW-CQSZACIVSA-N	426.495	1.094	50	20	IDGD	
CN(C)c1cc(C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c2ccccc2n1	772304987	NVYQEQMGACXGOU-UHFFFAOYSA-N	437.412	1.827	50	20	IDGD	
C[C@H]1CN(c2ccnc(C(=O)NNC(=O)C(=O)NCc3ccc(Cl)cc3)c2)C[C@H](C)O1	772517514	KJBTVDDGUVUCHZ-KBPBESRZSA-N	445.907	1.426	50	20	IDGD	
C=Cn1cc(C=NNC(=O)C[C@H]2c3cc(OC)c(OC)cc3CCN2S(C)(=O)=O)cn1	773023179	AXTRJLDJBYFJQQ-KRWDZBQOSA-N	447.517	1.400	50	20	IDGD	
COC(=O)c1cc(Br)c(F)cc1NC(=O)C(=O)NNc1nc(C)cc(C)n1	773479897	MBXRCBBIBGQMQR-UHFFFAOYSA-N	440.229	1.863	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)[C@H]2CCCN2C(=O)C(F)(F)F)c2ccccc2c1=O	776314276	JDAGMYHZQUDUJG-CYBMUJFWSA-N	439.394	1.292	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)NC[C@@H]2COC3(CCOCC3)O2)cc1Cl	776946486	SGOJORJKCMMZIZ-LLVKDONJSA-N	444.872	1.615	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)N1CCN([C@H]2CCCN(Cc3ccccc3)C2=O)CC1	780314663	KDMYWWPOKWAMAW-FPOVZHCZSA-N	443.592	1.377	50	20	IDGD	
C[C@H]1CC[C@H](NC(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)C1	780788130	UGMJRXDWHIPXHQ-RDJZCZTQSA-N	438.550	1.159	50	20	IDGD	
COc1ccc(C[C@@H](C)C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)cc1OC	781315434	HUCFCTLUPLWIFL-CQSZACIVSA-N	425.441	1.758	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1csc(N2CCOCC2)n1)[C@@H]1CCCN(C2CCC2)C1	781399811	HSGRREQWNCGQBX-LSDHHAIUSA-N	436.582	1.577	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cnn(C)c2C(F)(F)F)cc1	782121072	RBUCLPWDKZOXLP-SNVBAGLBSA-N	443.382	1.391	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2ccc3c(ccn3CCN3CCOCC3)c2)nc1	782148528	YNGGTQPVMJAUIU-UHFFFAOYSA-N	438.488	1.459	50	20	IDGD	
Cc1nnnn1-c1cc(NC(=O)C(=O)NNc2ccccc2Br)ccc1F	782986558	CSFZJSZTHOBCQX-UHFFFAOYSA-N	434.229	1.954	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N[C@H](C)C[C@@H](C)O)cc1	783628425	JDVIOJLABWXJPS-DSWHRGLISA-N	425.489	1.617	50	20	IDGD	
Cc1ccnc(NNC(=O)C(=O)Nc2ccc(S(=O)(=O)N3CCC(C)CC3)cc2)c1	783929068	MONXVLOCTSAQPB-UHFFFAOYSA-N	431.518	1.892	50	20	IDGD	
CCCCn1ncc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)c1C	784210130	DPGGNHMHPVBIBH-UHFFFAOYSA-N	434.522	1.514	50	20	IDGD	
CN1CCN(Cc2cccc(NC(=O)C(=O)NNc3ccc(Br)cn3)c2)CC1	784339911	PCEMFASVJRVGJV-UHFFFAOYSA-N	447.337	1.673	50	20	IDGD	
CNC(=O)c1cc(Oc2ccccc2NC(=O)C(=O)NNc2ccc(Cl)nn2)ccn1	784789749	OSAOVVTXKVPDTB-UHFFFAOYSA-N	441.835	1.759	50	20	IDGD	
COC(=O)[C@H]1CCCCN1C(=O)c1cccc(NC(=O)C(=O)NNc2ccccn2)c1	784792997	OVVIBOHKZAQZHH-MRXNPFEDSA-N	425.445	1.331	50	20	IDGD	
O=C(NNc1ccccc1C(F)(F)F)C(=O)Nc1ccc(CN2C(=O)CNC2=O)cc1	784831174	KVUKQZGDSLHXGU-UHFFFAOYSA-N	435.362	1.839	50	20	IDGD	
CC(C)n1cnnc1-c1ccccc1NC(=O)C(=O)NNC(=O)Cc1cn2ccccc2n1	785067791	NZISRKXMRLNUCO-UHFFFAOYSA-N	446.471	1.502	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ccc(C#N)c(Cl)c2)cc1NS(C)(=O)=O	785093414	QTIQUZYUEOHTMI-UHFFFAOYSA-N	437.865	1.674	50	20	IDGD	
Cc1cc2ccccc2nc1NNC(=O)C(=O)Nc1cccc2c1CCN2S(C)(=O)=O	785165123	QBGTWTNMWRNELU-UHFFFAOYSA-N	439.497	1.947	50	20	IDGD	
O=C(CCC(=O)Nc1nnc(C2CCCCC2)s1)NNC(=O)CNC(=O)c1ccco1	787289978	LDGTVZOQXUETGY-UHFFFAOYSA-N	448.505	1.475	50	20	IDGD	
CN(C)NC(=O)Nc1cccc(NC(=O)c2ccc(S(=O)(=O)CC(=O)N(C)C)cc2)c1	788256302	ZZGGDNOUCUZLLI-UHFFFAOYSA-N	447.517	1.399	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@H](C(=O)NNC(=O)Cc2ccc(Cl)cc2)[C@H](C)O)cc1	789165881	BJAGDGOLHJPTDQ-UGSOOPFHSA-N	439.921	1.066	50	20	IDGD	
CN(C)[C@H]1CCOc2c(NC(=O)C(=O)NNC(=O)c3ccc4c(c3)OCO4)cccc21	789729845	JXFJLIKYXHUUAV-HNNXBMFYSA-N	426.429	1.200	50	20	IDGD	
Cn1nc([C@H]2CCCO2)cc1NC(=O)C(=O)NNC(=O)c1cccc(C(F)(F)F)c1	789731106	CIVIBKRHMYDXAD-CYBMUJFWSA-N	425.367	1.690	50	20	IDGD	
Cn1nc([C@@H]2CCCO2)cc1NC(=O)C(=O)NNC(=O)C1=S=C2CCCCCCC2=C1	789740282	FENMEKASXXHJOM-HNNXBMFYSA-N	445.545	1.730	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)c1nc(Br)ccc1F	792294763	ONRLKUZQTCJXMQ-UHFFFAOYSA-N	429.633	1.714	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)[C@H]1CC(c2cc(OC)ccc2OC)=NO1	792629115	KDSJPUDFXQGWLH-HXUWFJFHSA-N	427.457	1.986	50	20	IDGD	
COc1ccc(OC)c(C2=NO[C@@H](C(=O)NNC(=O)c3cncc(NC(C)=O)c3)C2)c1	792651501	ATNRQGXUMFBOOP-GOSISDBHSA-N	427.417	1.011	50	20	IDGD	
COCc1cc(C(=O)OC)cc(S(=O)(=O)NNC(=O)c2cc(Br)c[nH]2)c1	793354703	YPTIDHDEUBDJCM-UHFFFAOYSA-N	446.279	1.334	50	20	IDGD	
COC(=O)C[C@@H]1CCC(=NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)[C@@H]1C	794452727	BKIBUGDDWFAPCA-CABCVRRESA-N	437.518	1.403	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)Nc2ccc(N3CCOCC3)cc2N2CCOCC2)n1	797608832	MKUHHFLSZUKGKN-UHFFFAOYSA-N	440.504	1.530	50	20	IDGD	
CC(=O)N[C@](C)(C(=O)NNc1nc(-c2cccnc2)no1)c1ccc(S(C)(=O)=O)cc1	797723782	BCJZDGRAQQRSJT-IBGZPJMESA-N	444.473	1.030	50	20	IDGD	
CN(CCNC(=O)NNC(=O)Cn1ccc2ccccc21)S(=O)(=O)c1ccc(F)cc1	798062136	MAMMIDBFMCVPTA-UHFFFAOYSA-N	447.492	1.432	50	20	IDGD	
Cn1c(=O)n(C)c2cc(N3CCCCC3)c(NC(=O)C(=O)NNc3ccnc(F)c3)cc21	800630182	XEQOTRCJZINTIW-UHFFFAOYSA-N	441.467	1.483	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCC2(COC)CCC2)c1	800731101	ZYSZJXWCBYITPP-UHFFFAOYSA-N	426.539	1.478	50	20	IDGD	
O=C(CN1C(=O)c2ccc(Cl)cc2S1(=O)=O)NNC(=O)c1ccccc1Cl	800840510	OSKSHOUJHXPBGD-UHFFFAOYSA-N	428.253	1.599	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)CCNS(=O)(=O)c2cn(C)c(C)n2)c(Cl)c1	802051143	SAWJWCVTFOONQZ-UHFFFAOYSA-N	428.902	1.212	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c(Cl)cc1F	806976505	RBDBFDLKLZJGIQ-UHFFFAOYSA-N	427.841	1.591	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(F)c(N3CCOCC3)cc2F)cc1	806978075	LHIHSXIVOBNQEQ-UHFFFAOYSA-N	429.383	1.073	50	20	IDGD	
O=C1COC[C@H](C[C@@H]2CN(C(=O)C(=O)NNc3cc(F)c(F)cc3F)c3ccccc32)N1	807014041	PCPKXHWVNADGMG-NEPJUHHUSA-N	448.401	1.583	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(NC(=O)C(=O)NNc2cccc(F)n2)ccc1Cl	807391485	UZZYHDCKWHIWOM-UHFFFAOYSA-N	443.888	1.986	50	20	IDGD	
CC[C@@H]1[C@H](C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)CCN1C(=O)OC(C)(C)C	809932949	KRMDGPOQVNMROV-HZPDHXFCSA-N	443.504	1.730	50	20	IDGD	
COC(=O)[C@@]1(c2ccccc2)CCN(C(=O)NNC(=O)c2cc(Br)c[nH]2)C1	814272222	YZIRMDXHRAVYAP-SFHVURJKSA-N	435.278	1.948	50	20	IDGD	
O=C(NNc1ccc(F)cc1F)C(=O)Nc1cccc(S(=O)(=O)C2CCOCC2)c1	815588008	AMCBVLYHGFUYDX-UHFFFAOYSA-N	439.440	1.999	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCO1)C(=O)Nc1ccc(-c2nnc3n2CCCCCC3)cc1	815778461	SBAPWIQVRJIFFZ-MRXNPFEDSA-N	426.477	1.327	50	20	IDGD	
COc1ccc(CCC(=O)OCC(=O)NNC(=O)Cc2nc(C)cs2)cc1Cl	818177964	IUPSVJLBCRJYGU-UHFFFAOYSA-N	425.894	1.979	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N2CC3(CCOC3)C2)cc1	819384758	LLFMKWGSKOMAHS-YVLHZVERSA-N	435.484	1.590	50	20	IDGD	
O=C(Cc1ccccc1)NCCC(=O)NNC(=O)COc1ccc(Br)cc1	821736045	WPZDJHMLLBOMHP-UHFFFAOYSA-N	434.290	1.724	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)CN2C(=O)c3ccc(Br)cc3C2=O)cc1	825596140	WUOIOZLVEBZAAF-UHFFFAOYSA-N	445.273	1.613	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2cccn2Cc2ccccc2)ccc1Cl	892686201	HVJZYLKCVCELNH-UHFFFAOYSA-N	432.889	1.912	50	20	IDGD	
Cn1cc(S(=O)(=O)N2CCCCC2)cc1C(=O)NNC(=O)c1ccc2c(c1)OCO2	914837888	ZGPYCSIFZZVJNR-UHFFFAOYSA-N	434.474	1.003	50	20	IDGD	
O=C(COC(=O)c1ccn(-c2ccccc2F)n1)NNC(=O)c1ccc([N+](=O)[O-])cc1	915460105	CJKYYYIQKVFGEW-UHFFFAOYSA-N	427.348	1.538	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)CNS(=O)(=O)c1ccc2ccccc2c1	915787869	KYNSAXNHECBPTD-AWEZNQCLSA-N	445.472	1.872	50	20	IDGD	
NC(=O)c1ccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1	915880016	FGUOQCLAQYBLNV-UHFFFAOYSA-N	431.474	1.037	50	20	IDGD	
O=C(COc1ccc(OCc2ccccc2)cc1)NNC(=O)N[C@H]1CCS(=O)(=O)C1	915880407	LTNQXFHTXCXDGF-INIZCTEOSA-N	433.486	1.162	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)N[C@H](C)c2ccc(-n3cncn3)cc2)nc1	915923352	MXEZNNXBKOTVSL-CQSZACIVSA-N	444.521	1.736	50	20	IDGD	
Cc1nn([C@H]2CCS(=O)(=O)C2)c(Cl)c1C=NNC(=O)c1c(C)nc2ccccn12	915931469	LUDBWAQWDRQMMN-ZDUSSCGKSA-N	434.909	1.925	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NN=Cc1c(C)n[nH]c1C)N(S(C)(=O)=O)CC2	915952444	WHURFOCDMHBKBZ-KRWDZBQOSA-N	449.533	1.443	50	20	IDGD	
CC(=O)Nc1cccc(C(C)=NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c1	916258665	HWVDYZCBBDDNKY-UHFFFAOYSA-N	444.513	1.820	50	20	IDGD	
O=C(NCc1ccc(N2CCCC2)cc1)NNC(=O)c1csc(N2CCOCC2)n1	916588321	RITOHZKQHGVIAL-UHFFFAOYSA-N	430.534	1.724	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)NCc2cccc(S(N)(=O)=O)c2)cc1	916624168	XJZWNJWIXVWOEU-CYBMUJFWSA-N	436.490	1.031	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)NC[C@@]2(N3CCOCC3)CCSC2)c1C	916636689	JQDQCFOVVJVUNT-UTKZUKDTSA-N	436.578	1.609	50	20	IDGD	
CCCC(=O)N1CCC[C@@H](C(=O)NNC(=O)c2ccc(CSc3nncn3C)cc2)C1	917524373	IFSIHVHQFFDVFJ-QGZVFWFLSA-N	444.561	1.907	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccc(C)s3)CC2)cc1OC	917837458	TXWACASWWCDHQR-UHFFFAOYSA-N	446.529	1.293	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1nn(-c2ccccc2)cc1O	917944600	ACMIZYGOWLFEHE-UHFFFAOYSA-N	444.831	1.858	50	20	IDGD	
CN(CC(=O)NNC(=O)CC(F)(F)F)S(=O)(=O)c1ccc(Br)cc1	918367229	NQOIFVSETWYCGU-UHFFFAOYSA-N	432.218	1.169	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)CCNS(=O)(=O)c1ccc2ccccc2c1	919819992	FIQCIMMBGZDAGS-UHFFFAOYSA-N	441.509	1.907	50	20	IDGD	
COc1ccc(OCCCNC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc1	919922598	WUEIDNDZRAYBHR-UHFFFAOYSA-N	425.445	2.000	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)[C@@H]1CS[C@H](Cc2ccccc2F)C(=O)N1	920212943	HORTXOVNFZQFSA-FUHWJXTLSA-N	431.489	1.367	50	20	IDGD	
O=C(COC(=O)c1csc(-c2ncccn2)n1)NNC(=O)c1ccc([N+](=O)[O-])cc1	920530013	FDQIYHOEPROJBA-UHFFFAOYSA-N	428.386	1.126	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2nc(CC(=O)OC)cs2)c2ccccc2c1=O	920928526	MTHGHXVNDMXSQL-UHFFFAOYSA-N	430.446	1.055	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNC(=O)[C@H]2Nc3ccccc3S(=O)(=O)N2)cc1	1319089634	QOSMFGHASPPOMQ-SFHVURJKSA-N	432.502	1.603	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2cc(OCC(F)F)ccn2)c1	1319911359	IOEUATDWABYVDY-UHFFFAOYSA-N	428.417	1.273	50	20	IDGD	
Cc1ccccc1C(F)(F)C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	1320358567	CDGGVSKVLITUKA-UHFFFAOYSA-N	439.488	1.561	50	20	IDGD	
CCCc1n[nH]cc1C(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	1320366284	CYDOBUFEVIPIDS-UHFFFAOYSA-N	441.513	1.916	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(CCN(C(=O)CS[C@H]3CCCCO3)C2)C1	1779078213	NTYXEVJYTHTANE-IRXDYDNUSA-N	435.384	1.861	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3nnc(-c4ccccc4)o3)C2)C1	1779113694	AXHIHSRBZRUKRJ-QRWLVFNGSA-N	434.880	1.434	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)NC(=O)NCC)C1	1779315918	XBYCAQWZTXRLHV-ZFCANOHDSA-N	430.977	1.615	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H]1CCCSC1)C2	1782213892	CCLUDYCQJSMCGD-CSODHUTKSA-N	440.610	1.017	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(CCN(C(=O)c3cc4cccnc4nc3O)C2)C1	1782265597	IMGVHPRGDHXUOJ-NRFANRHFSA-N	444.564	1.630	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccc4nccn4c3)CCO2)C1	1783347133	ACFQCORSYXBCMV-DNVCBOLYSA-N	435.322	1.951	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cc(C)nc(O)c3)CCO2)C1	1783347874	QEUIYUOVKBANFM-KBXCAEBGSA-N	426.311	1.713	50	20	IDGD	
COc1cc(C#N)cc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](C)Br)C3)C2)c1	1783538388	UOUPUWQWLCRPQI-DJJJIMSYSA-N	436.306	1.794	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc4cc(OC)ccc4n3)CCO2)C1	1783875364	QCNIJYDONJGHBY-VGOFRKELSA-N	447.919	1.941	50	20	IDGD	
Cc1cccc2[nH]c(C(=O)N3CCO[C@@]4(CCN(C(=O)CCC(=O)NN(C)C)C4)C3)cc12	1783934468	GWVNLTJZVUQCLF-HSZRJFAPSA-N	441.532	1.293	50	20	IDGD	
O=C(c1ccc(C(F)(F)F)cc1F)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1785198746	HMSWFWBZTKGRHI-WMLDXEAASA-N	438.805	1.888	50	20	IDGD	
Cc1cc(C(=O)NCC(=O)NC2(c3ccc(NC(=O)[C@@H](O)CCl)cc3)CCC2)no1	1786134908	SXJWCWJISHPQHC-INIZCTEOSA-N	434.880	1.447	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)c3ccccc3)[C@H]2C1	1786671644	OMHQXNAZVKZQFU-KFGODFMUSA-N	439.350	1.873	50	20	IDGD	
O=C(COc1cccnc1)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1	1788140290	RJIJTVHIYYFGSP-UHFFFAOYSA-N	445.284	1.588	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1ccc(C2(NC(=O)C3CCOCC3)CCC2)cc1	1789522415	FJZRIRJSWFHLSR-UHFFFAOYSA-N	437.500	1.859	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnn(-c4cccnc4)c3)C[C@@H]21	1789858804	QDUAJKIDXHRZQJ-QZHFEQFPSA-N	431.924	1.878	50	20	IDGD	
C[C@H](NC(=O)c1ccccn1)C(=O)Nc1ccc(C2(NC(=O)[C@@H](O)CCl)CCC2)cc1	1791046728	UMLWXSBCAHHIKS-KSSFIOAISA-N	444.919	1.934	50	20	IDGD	
CCCc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]3C2)cc1	1791290623	CWDCUHOTMZMPLL-ACRUOGEOSA-N	444.576	1.605	50	20	IDGD	
COc1cnc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@](C)(Cl)CCl)C3)c(F)c1	1794452160	CAJHCGANNVDAHX-MSNRECKUSA-N	434.295	1.669	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CSc1ccccc1	1795684737	HVSRHDSVQKLBMU-MUJYYYPQSA-N	439.541	1.729	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1noc2ccccc12	1795766251	XKXHFSLCSDDZAN-ZIVKBKJYSA-N	436.306	1.743	50	20	IDGD	
Cc1cccc(-c2cnccc2C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](O)CCl)C3)c1	1795997400	CMSYTJCAKWPGRX-HRQSHJORSA-N	443.931	1.860	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1(c3cccc(F)c3)CC1)C2	1796189970	OOGLPSNNPJNMFO-WKCHPHFGSA-N	436.292	1.489	50	20	IDGD	
N#Cc1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)c(Cl)c1	1796192971	FXNBEMCHZPLCGH-BCDXTJNWSA-N	437.692	1.457	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1c[nH]c2nccc-2c1	1796197458	MBAIOWDEFWMLCQ-CRWXNKLISA-N	425.258	1.408	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)COCc1ccc(C)c(C)c1	1796471807	KJFVPUZUUSRMBL-JTJHWIPRSA-N	438.952	1.663	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2n(n1)CCCC2	1797439920	GSCMZCQDCYBROJ-ZJOBFFGXSA-N	439.354	1.454	50	20	IDGD	
Cc1cccc2[nH]c(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)c3cccc(B(O)O)c3)C4)cc12	1798057940	LTNDYTPPTNNKIJ-REPLKXPHSA-N	431.301	1.722	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1n[nH]c2ccccc12	1798072863	UJFWXZIXIMPYQX-BTTYYORXSA-N	433.472	1.127	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(Cl)cc(Cl)n1	1798298457	KXROQTRQPGBFSS-KVQFHVITSA-N	436.723	1.845	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCC(=O)N1CCCC1)C2	1799273766	HAACIIKBLIQRBQ-CSHUHZATSA-N	434.364	1.215	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CCc3nc[nH]c3C1)C2	1799278328	ATBSVVZMMHQJOJ-NUFHUAHKSA-N	429.348	1.341	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1n[nH]c3c1CCCC3)C2)[C@H](F)Br	1799346144	FOQLQAFLUVQAFW-FJHTZYQYSA-N	429.290	1.182	50	20	IDGD	
CC(C)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(N2CCOCC2)c1	1799611138	KRLGPWDELPLWAF-OPVJXMOQSA-N	449.979	1.991	50	20	IDGD	
CN1CCN(C2(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)[C@@](C)(Cl)CCl)CC2)CC1	1800082593	WCQRUJVNTYWYSH-RCJHGTSTSA-N	431.408	1.641	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cn3ccccc3n1)C2	1800641324	YPBUKACSBKXHMN-LOUJCGABSA-N	435.322	1.711	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/C(=O)c1cccs1)C2	1800975179	KZBVETKJZGOLLZ-CBHLTWEASA-N	426.922	1.330	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@H]1CCN(C(=O)c2cc(O)ncn2)[C@@H]1c1cccnc1	1803010688	JHAAEPVZMOVZAU-SUYBPPKGSA-N	448.321	1.928	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CSc2ncccn2)[C@@H]1c1cccnc1)[C@H](O)CCl	1803137930	FDFRLMYRIUKZEF-ZMSDIMECSA-N	435.937	1.269	50	20	IDGD	
Cn1ccc(=O)cc1C(=O)N1CC[C@@H](CNC(=O)CCBr)[C@H]1c1cccnc1	1806343245	OKLXZXXKZACUEL-HNAYVOBHSA-N	447.333	1.885	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)CCC#N)[C@H]1c1cccnc1	1806863953	UPJYOULTRXQZFF-BLCOGNGMSA-N	435.488	1.525	50	20	IDGD	
O=C(CN1CCCC1=O)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@H]1c1cccnc1	1806926309	YRYMTKVCUNKEIH-JQFCIGGWSA-N	441.301	1.400	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)Cc2ccsc2)[C@H]1c1cccnc1	1807565322	ZITRBSQACYVQGT-PGRDOPGGSA-N	443.573	1.765	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H](CNC(=O)c2cnc(O)nc2O)[C@@H]1c1cccnc1	1808276128	RLMFBWRSBBLSPR-HIFRSBDPSA-N	433.896	1.867	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cccn3c(O)nnc23)[C@H]1c1cccnc1)[C@@H](F)Cl	1808308174	BOFZFTYNYRSMDY-AEGPPILISA-N	432.843	1.684	50	20	IDGD	
Cc1nc(CC(=O)N2CC[C@H](CNC(=O)CO[Si](C)(C)C)[C@@H]2c2cccnc2)no1	1810540405	MYJYYFACSGLDLU-UZLBHIALSA-N	431.569	1.873	50	20	IDGD	
COc1cc(C#N)cc(C(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@H]2c2cccnc2)c1	1811407528	WOJQXVFPBYJMPL-DBVUQKKJSA-N	442.903	1.881	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2cc(C(=O)O)ncn2)[C@H]1c1cccnc1	1813029830	YXQVUDXALMDDKS-ZQIUZPCESA-N	447.879	1.143	50	20	IDGD	
COc1ccnc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)[C@@H](O)CCl)n[nH]2)c1OC	1814872833	GQJPDXWYDYYUGM-OLZOCXBDSA-N	437.884	1.728	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)C2=CCCS2)n[nH]1	1815269181	IASKWVACUNEMIW-OAHLLOKOSA-N	441.517	1.735	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@H](F)Br)[nH]n1)c1cc(O)ncn1	1815359172	PWODHSNZENKBMQ-GWCFXTLKSA-N	427.234	1.902	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H]2CC2(F)F)n[nH]1	1818839068	WJECDCHCVOMIRN-GXTWGEPZSA-N	433.419	1.369	50	20	IDGD	
Cc1nccnc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1	1822415428	ZPOBHEAAHSFUPH-HNNXBMFYSA-N	428.497	1.187	50	20	IDGD	
CN1CCN(C2(C(=O)N3CCCC[C@@H]3c3cc(NC(=O)C(Cl)Cl)n[nH]3)CC2)CC1	1822420978	GXSJUXWYIAFMPF-CQSZACIVSA-N	443.379	1.986	50	20	IDGD	
CN[C@H](CC(=O)N[C@H]1CCc2nc(NC(=O)[C@](C)(Cl)CCl)sc2C1)C(=O)O	1822863642	QFSPTZADENKTPW-GXEAXYKVSA-N	437.349	1.354	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H]1CCNC(=O)C1)CC2	1825453148	PVYQXGLTUXPBHU-VWYCJHECSA-N	443.367	1.755	50	20	IDGD	
C[C@]1(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)CC1(F)F	1827055319	UOAIIYGVOFBSIY-WIYYLYMNSA-N	434.292	1.645	50	20	IDGD	
CC(=O)OC[C@H](OC(C)=O)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H](F)Cl)CC1	1828954402	XUAZLJZOAAFBBP-YESZJQIVSA-N	434.892	1.635	50	20	IDGD	
Cc1cc2cc(C(=O)N3CCOC[C@]4(C3)CN(C(=O)[C@H](O)CCl)CCO4)ccc2[nH]1	1830735339	HHVMPQGFNDVFFY-NQIIRXRSSA-N	435.908	1.146	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@H](C)C3(O)CCC3)CC2)CC1	1833071584	HYCZUJSBYXIVGE-MAUKXSAKSA-N	429.989	1.363	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cc4cccnn4c3)CC2)CC1)[C@H](O)CCl	1833312434	VDZRGFJIJGOWHJ-LJQANCHMSA-N	433.940	1.119	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)C(=O)c3ccccc3)CC2)CC1	1834381280	NOMCFZWQTAFXJV-IBGZPJMESA-N	435.952	1.695	50	20	IDGD	
O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)Cc1ccc(F)cc1)CCO2	1835048859	RBEQTFFVTLKHCB-LJQANCHMSA-N	443.313	1.610	50	20	IDGD	
COc1ccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)cc1	1835063609	FQHFTASTICZPQL-QFIPXVFZSA-N	438.952	1.959	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cc(O)nc(O)n3)CC2)CC1	1835076084	SQVGIATYHMSBFI-HNNXBMFYSA-N	439.944	1.481	50	20	IDGD	
CC[S@](=O)CCC(=O)N1CCC(N2CCC(NC(=O)CO[Si](C)(C)C)CC2)CC1	1835837021	MEBNOLBTENBAHJ-NDEPHWFRSA-N	445.702	1.568	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3ccc(OC)nc3)CC2)CC1	1836983498	XWNKMGPTKLZZEY-GOSISDBHSA-N	439.940	1.956	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3Cc4ccccc4O3)C2)C1	1837713343	XZMAYZNJAKMHKG-UGKGYDQZSA-N	448.592	1.298	50	20	IDGD	
CCc1nc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](Br)CC)C3)C2)co1	1838138363	UKJIUWBFULNCTA-SCLBCKFNSA-N	444.326	1.481	50	20	IDGD	
CC(=O)N[C@@H](C)C(=O)N1CCC(OC2CCN(C(=O)[C@@](C)(Cl)CCl)CC2)CC1	1838638856	NWBFIDKIQDYCIQ-DJJJIMSYSA-N	436.380	1.746	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(F)cc(F)c3)CCO2)C1	1839003603	PZXVCYKZTWEQGP-KZULUSFZSA-N	447.276	1.818	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccc(F)cn3)C2)C1	1839152432	ZACIDTBXKVJXIQ-RBUKOAKNSA-N	448.322	1.456	50	20	IDGD	
Cc1ncsc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839198223	XFVHYUIMPYASKN-DOMZBBRYSA-N	436.303	1.212	50	20	IDGD	
C/C=C/C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1	1839814723	FXHIMYDQDSIKQG-SHTLVRLNSA-N	447.444	1.166	50	20	IDGD	
COc1ccccc1CC(=O)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1839955852	WVRHKOJBYBSWDK-IBGZPJMESA-N	431.316	1.498	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cncc(C)c3)C2)C1	1839963778	VPJKZBOKVDKPBI-LPHOPBHVSA-N	440.338	1.634	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(C#N)cc3)C2)C1	1840034396	JSOHAEUOJFOEBS-IFXJQAMLSA-N	436.306	1.412	50	20	IDGD	
Cc1cccn2ncc(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)C(Cl)Cl)CCO4)c12	1840189614	CGBAQPQMNTXDQO-LJQANCHMSA-N	441.315	1.516	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C13CCC(CC1)CC3)CCO2	1840543905	GAVJFSTUCNLIJN-BLVDZXQRSA-N	428.957	1.667	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCO)C(=O)N1CC2(CCCN2C(=O)C(C)(C)CCl)C1	1841224983	IMLUPKSTGDLLQO-AWEZNQCLSA-N	431.961	1.731	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H]1CCC(=O)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1	1841351240	JTOLEULMMUSMDJ-JKSUJKDBSA-N	443.972	1.969	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](CC1CC1)C(=O)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1	1841354153	KJPQMPWIHZJAOJ-HUUCEWRRSA-N	429.945	1.483	50	20	IDGD	
O=C(/C=C/c1cc2ccccc2o1)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843013915	CFUBPOCQSQROMZ-MDZDMXLPSA-N	430.269	1.643	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)CCc1cnccc1C)C2	1843415288	ISJGWDGQECBFLP-YZSQISJMSA-N	436.516	1.660	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)Cc1c(F)cccc1F)C2	1844264842	NREFSSMBTNJERP-UHFFFAOYSA-N	429.427	1.023	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)c2ccc(-n3c(O)nnc3O)cc2)C1	1844738730	CAIDYOKECGMSEM-OAHLLOKOSA-N	433.896	1.903	50	20	IDGD	
O=C(c1ccc2nc(CO)[nH]c2c1)N1CC2(CCCN2C(=O)[C@H](F)Br)C1	1845217785	VRKLWLPIFIIEBS-AWEZNQCLSA-N	425.258	1.563	50	20	IDGD	
O=C([C@@H](O)CCl)N1CC2(CCCN2C(=O)c2cn3cccc(Br)c3n2)C1	1845650965	OBOUIPRUQWECFL-ZDUSSCGKSA-N	441.713	1.514	50	20	IDGD	
Cn1cnc(C(=O)N2CC3(CCCN3C(=O)[C@H](Br)Cc3ccccc3)C2)n1	1845940719	GBLREAKUGKYRIU-OAHLLOKOSA-N	432.322	1.638	50	20	IDGD	
O=C(CCn1ccnn1)N1CC2(CCCN2C(=O)[C@H](Br)Cc2ccccc2)C1	1845943158	WGSJIDVVKPKOPL-QGZVFWFLSA-N	446.349	1.878	50	20	IDGD	
COc1ccc(Cl)c(C(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)c1	1846775560	DIPVSOYAQAUFNG-UHFFFAOYSA-N	428.681	1.159	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)c2ccccc2OC(F)F)C1	1846856680	YLRWBOFNTNDJCY-UHFFFAOYSA-N	430.216	1.099	50	20	IDGD	
CS(=O)(=O)N1CCCc2cc(C(=O)OCC(=O)NNC(=O)c3ccccc3)ccc21	17149078	YXKBLAYNWKTSPE-UHFFFAOYSA-N	431.470	1.017	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)[C@H](C)NC(=O)c2ccco2)c2ccccc2c1=O	21899724	ZUZOTQNDXCARMQ-AWEZNQCLSA-N	439.472	1.759	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)CN2C(=O)N[C@@]3(C[C@@H](C)CC(C)(C)C3)C2=O)c1	23154005	TYYANNWSMQGJLH-QMHKHESXSA-N	444.532	1.966	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2ccccc2SCC(N)=O)c2ccccc2c1=O	24400688	VNWQZEAYHRBFBU-UHFFFAOYSA-N	439.497	1.459	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2cc(C)nc3c2c(C)nn3C)c2ccccc2c1=O	25436516	OOMZGWWRJSFDNL-UHFFFAOYSA-N	433.472	1.780	50	20	IDGD	
O=C(NNC(=O)c1ccccn1)c1cccc(S(=O)(=O)N2CCc3sccc3C2)c1	105816561	FLJYRSPBNMMJNP-UHFFFAOYSA-N	442.522	1.965	50	20	IDGD	
COc1cc(-n2cnnn2)c(Cl)cc1C(=O)NNC(=O)COc1cc(C)ccc1C	107908700	GYOKCAWVXLFKSX-UHFFFAOYSA-N	430.852	1.781	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)NC[C@@H](c1ccccc1Cl)N1CCOCC1	725872549	YUNSNQUMEFLFRD-INIZCTEOSA-N	449.895	1.067	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)CNC(=O)c1cccs1)c1ccc(N2CCOC2=O)cc1	726244179	LCFHZDIHGJGIOV-GFCCVEGCSA-N	431.474	1.526	50	20	IDGD	
CC(C)NC(=O)C(=O)NNC(=O)c1ccc(NS(=O)(=O)/C=C\c2ccccc2)cc1	726614795	TXRYESIKKWBEFZ-SEYXRHQNSA-N	430.486	1.385	50	20	IDGD	
CSCC[C@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)Cc1nc2ccccc2n1C	727114048	NEUUESNODVULQS-AWEZNQCLSA-N	435.550	1.910	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)CNC(=O)c1ccc(O)cc1	727483033	CPCSUBLCARAJDI-NSHDSACASA-N	436.262	1.499	50	20	IDGD	
CC(=O)c1cccc(O[C@@H](C)C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1	728338167	GOCPRWURVWHAII-LIRRHRJNSA-N	442.424	1.187	50	20	IDGD	
COc1ccc(C2(C(=O)OCC(=O)NNC(=O)[C@@H]3COc4ccccc4O3)CCC2)cc1	728344920	SOVCAZDGKCMEAP-IBGZPJMESA-N	440.452	1.648	50	20	IDGD	
O=C(NNS(=O)(=O)c1cccc2c1OCCO2)c1cc(F)ccc1Br	728509294	BKTMCWCWZAHANT-UHFFFAOYSA-N	431.239	1.983	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2cccc(Nc3ncccn3)c2)n1	728722114	CAKQUZKGUKHROG-UHFFFAOYSA-N	426.458	1.532	50	20	IDGD	
CCC(CC)[C@@H](CNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)N1CCOCC1	728944200	OMESOXZJRRGRIC-LJQANCHMSA-N	447.584	1.160	50	20	IDGD	
CCC(CC)N1C[C@@H](C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)CC1=O	729299340	AKNUDRRCJGVJTM-AWEZNQCLSA-N	427.505	1.776	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)C(=O)NCCCc2ccccc2)c1	729533329	FLWQPEUEWHATIB-UHFFFAOYSA-N	434.290	1.968	50	20	IDGD	
C[C@H](CN1CCN(C)CC1)NC(=O)NNC(=O)COc1ccccc1-c1ccccc1	730129749	COFVCOQTTVCVKE-GOSISDBHSA-N	425.533	1.699	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)c1ccn(-c2cccc(Br)c2)n1	730178229	BGLHKUVEYOLWQA-UHFFFAOYSA-N	432.234	1.419	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)CC[C@@H]2NC(=O)N(c3ccc(Cl)cc3)C2=O)n1	730768583	IVPHGILJIFWKFF-HNNXBMFYSA-N	432.868	1.206	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN(C(=O)c2ccccc2)C1)C1CCN(c2ncccn2)CC1	731169644	RXRLVFFWYWUXSH-LJQANCHMSA-N	436.516	1.393	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)N1CCN(Cc2csc(-c3ccc(OC)cc3)n2)CC1	732197237	XTRKWEJYJRJXRJ-OAHLLOKOSA-N	431.562	1.882	50	20	IDGD	
CCCn1c(=O)n(CCC(=O)NNC(=O)CCN2C[C@H](C)O[C@@H](C)C2)c2ccccc21	732259558	HHSYPPPUUYUERE-IRXDYDNUSA-N	431.537	1.250	50	20	IDGD	
O=C(COC(=O)c1ccc(-c2ccccc2)nc1O)NNC(=O)c1cccc([N+](=O)[O-])c1	732324968	GWQHXCSTCITSHG-UHFFFAOYSA-N	436.380	1.980	50	20	IDGD	
COc1ccc(-c2nn(Cc3ccccc3)cc2C(=O)NNC(=O)CN(C)C)cc1OC	733359346	DNWVYZOARNNNJY-UHFFFAOYSA-N	437.500	1.938	50	20	IDGD	
O=C(NNc1cnnc2ccccc12)c1cccc(S(=O)(=O)NC[C@H]2CCCO2)c1	733810511	NLTYWYBSUUFMDS-OAHLLOKOSA-N	427.486	1.844	50	20	IDGD	
CCc1ccccc1O[C@@H](C)C(=O)N1CCN([C@@H](C)C(=O)NNC(=O)CC(C)C)CC1	736622805	CMOWULRMBVYUTG-ROUUACIJSA-N	432.565	1.743	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)Cc2nnc(O)c3ccccc23)cc1C	736755240	NMKUWRZLWHEDGX-UHFFFAOYSA-N	428.470	1.815	50	20	IDGD	
CCc1cc(NNC(=O)CCNS(=O)(=O)c2cccnc2)nc(-c2ccccn2)n1	738531068	TVYIZKUKTXLTSI-UHFFFAOYSA-N	427.490	1.308	50	20	IDGD	
CC(=NNC(=O)[C@@H](C)CN1CCOCC1)c1ccc(S(=O)(=O)CC(F)(F)F)cc1	741757288	PSSWZCXSLYRNRT-ZDUSSCGKSA-N	435.468	1.831	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CSc2ccc(S(=O)(=O)N3CCCC3)cn2)c1	741851443	NNGUDTXGSXTYSZ-UHFFFAOYSA-N	445.526	1.291	50	20	IDGD	
CCNC(=O)NNC(=O)c1occc1CS(=O)(=O)c1ccc(Br)cc1	742054180	XVLBZQCQJCTXRA-UHFFFAOYSA-N	430.280	1.980	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)CSc2ccc(S(=O)(=O)N3CCCC3)cn2)cc1	742450201	ZELVLCAQALOGIY-UHFFFAOYSA-N	445.526	1.291	50	20	IDGD	
Cc1cccc2c(=O)n(CC(=O)NNC(=O)c3cc(Br)ccc3O)cnc12	743732338	QRCKLNUPASHTMM-UHFFFAOYSA-N	431.246	1.634	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2ccc(OCC(F)(F)F)nc2)cc1	743829672	AGWWJWHWMKXQRB-UHFFFAOYSA-N	432.380	1.893	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)CN2CCN(C(=O)Cc3ccc(Cl)cc3)CC2)cc1	744387724	WXHMBTNLVDRQED-UHFFFAOYSA-N	439.903	1.360	50	20	IDGD	
C[C@@H]1C[C@@H](NC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)C(=O)N1c1ccccc1	745881703	LDMVUSPFLMXTFI-RHSMWYFYSA-N	434.456	1.716	50	20	IDGD	
O=C(NNC(=O)N1CCOCC1)C1CCN(C(=O)c2ccc(Br)cc2)CC1	745992926	NKNCTLHQIASRGX-UHFFFAOYSA-N	439.310	1.374	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCO[C@H](C(=O)OC(C)(C)C)C1	746678511	JUZYVGCKFQXGKE-HNNXBMFYSA-N	427.885	1.152	50	20	IDGD	
COc1ccc([C@@H](C)NC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)cc1	746962661	KFDRDHLRMDMLJL-OAHLLOKOSA-N	448.549	1.414	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2cc(C(=O)O)cc(Cl)c2C)cc1OC	747595896	JQXBKROKYGOGGG-UHFFFAOYSA-N	428.850	1.987	50	20	IDGD	
Cn1ccnc(NNC(=O)c2ccc3c(=O)n(CCc4ccccc4)c(S)nc3c2)c1=O	747938067	OUZMHEWECRGSRR-UHFFFAOYSA-N	448.508	1.779	50	20	IDGD	
Cc1cc(C)c(S(=O)(=O)N2CCC(C(=O)NNc3nccn(C)c3=O)CC2)c(C)c1	747945550	MLMVUWROSHYVIB-UHFFFAOYSA-N	433.534	1.250	50	20	IDGD	
C=CCCCC(=O)NNC(=O)C[C@@H]1c2cc(OC)c(OC)cc2CCN1S(C)(=O)=O	748285962	MNLBXOSWXYXJJG-MRXNPFEDSA-N	439.534	1.456	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)c2cc(S(=O)(=O)NC)cs2)cc1OC	748696317	YPJZYDMPCNYJLY-UHFFFAOYSA-N	441.531	1.919	50	20	IDGD	
C[C@@H]1CCCCN1C(=O)CN1CCN(C(=O)NNC(=O)c2cc3ccccc3o2)CC1	750289287	QYPXRTXQUFKJTG-MRXNPFEDSA-N	427.505	1.806	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)NCC2CCN(CC(=O)NC(C)(C)C)CC2)c1	751112165	UHQZNKOBDDAVEJ-UHFFFAOYSA-N	432.569	1.323	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCC2CCN(CC(=O)NC(C)(C)C)CC2)cc1OC	751112223	VBZWNZIHNNICMY-UHFFFAOYSA-N	449.552	1.275	50	20	IDGD	
C[C@@H]1CN(Cc2ccc(C(=O)NNC(=O)CNC(=O)c3cccs3)cc2)C[C@@H](C)O1	751208847	IFZMSQMTHHHAJC-HUUCEWRRSA-N	430.530	1.548	50	20	IDGD	
C[C@@H](C[S@](C)=O)NC(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	753357760	HVUVBRQDWXJXNA-PSKUBERUSA-N	441.517	1.099	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@](C)(CNC(=O)NNC(=O)C(=O)Nc2ccccn2)C1	753372897	OZCWFQQPSDGOBA-HXUWFJFHSA-N	434.497	1.388	50	20	IDGD	
CCOc1ccccc1C(F)(F)C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	753388910	OYXLDUIIKNQJSV-UHFFFAOYSA-N	441.456	1.889	50	20	IDGD	
CS(=O)(=O)N1CCC[C@@H]1CNC(=O)NNc1c(F)cc(F)cc1Br	753693444	SVUBXIOIMGOIQR-SECBINFHSA-N	427.271	1.777	50	20	IDGD	
NS(=O)(=O)c1cc(Br)c(Cl)c(C(=O)NNC(=O)c2ccccn2)c1	753760627	AJJSWDOYIUZYTA-UHFFFAOYSA-N	433.671	1.220	50	20	IDGD	
CN1C(=O)c2cccc3c(S(=O)(=O)NNC(=O)COCc4ccccc4)ccc1c23	753779394	JUJAZTPMNGDMHS-UHFFFAOYSA-N	425.466	1.956	50	20	IDGD	
COC(=O)c1c(Br)ccc(NC(=O)C(=O)NNC(=O)Cc2ccncc2)c1C	753841963	WFRKYNXGNZICAI-UHFFFAOYSA-N	449.261	1.268	50	20	IDGD	
O=C(NNc1ccc(C(F)(F)F)nn1)c1cccc(S(=O)(=O)NC[C@@H]2CCCO2)c1	755295347	ZIUPTZCCSFCCDN-LBPRGKRZSA-N	445.423	1.710	50	20	IDGD	
Cc1cccc(-n2nc(C(C)(C)C)cc2NC(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)c1	755748110	PSNDRNFTNCGARV-ZDUSSCGKSA-N	436.538	1.569	50	20	IDGD	
COc1cc([N+](=O)[O-])ccc1C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	756840237	ZCDNJIHKPOJXRS-UHFFFAOYSA-N	436.446	1.381	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)N[C@H]1CCN(C(=O)CCc2ccccc2)C1	756981825	BTIPNNHMPKDBJJ-PXNSSMCTSA-N	438.484	1.391	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2ccc(C#N)cc2Cl)cc1	757727999	ZAMWRTSQGZXWCA-UHFFFAOYSA-N	435.893	1.994	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)cc(OC)c1Br	757904833	MCPZJXKZCKGKMB-MRVPVSSYSA-N	436.284	1.054	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)CS(=O)(=O)Nc2ccc(N3CCCCC3)cc2)nc1	759740005	QWWHJZLQKZKYQQ-UHFFFAOYSA-N	447.517	1.744	50	20	IDGD	
O=C(N=c1cc[nH]cc1F)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	760018776	IWHIWHJDFHIIEG-UHFFFAOYSA-N	432.419	1.811	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)[C@H]1CC(=O)N(c2ccc(F)cc2F)C1	760439384	DXDSKGRACSYYHT-NSHDSACASA-N	426.420	1.380	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)CN2C(=O)N[C@@](C)(c3ccc4ccccc4c3)C2=O)nc1	760789653	NTBPXQJYXBBKSH-QHCPKHFHSA-N	447.451	1.932	50	20	IDGD	
CNS(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=O)CSc2ccccc2OC)c1	761637376	RAZBAGHLOHUMKL-UHFFFAOYSA-N	443.934	1.810	50	20	IDGD	
CCOc1cccc(C=NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)n1	763119708	BNBNSYGZHDFMFF-UHFFFAOYSA-N	446.529	1.584	50	20	IDGD	
CCN(CC)C(=O)c1ccc(S(=O)(=O)NNC(=O)CSc2ccccc2O)cc1	763408930	HKQJBKWZMRQAGX-UHFFFAOYSA-N	437.543	1.976	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(N2CCSCC2)cc1	763467829	TVMOIIWULKANEK-UHFFFAOYSA-N	429.458	1.548	50	20	IDGD	
CCn1c(=O)n(CC)c2nc(NC(=O)CCC(=O)NNC(=O)c3ccccc3O)ccc21	763474464	YPKQWQMLJPTXQC-UHFFFAOYSA-N	440.460	1.123	50	20	IDGD	
COCCOc1cc(C)ccc1NC(=O)C(=O)NNC(=O)COc1ccc(C#N)cc1	763677970	AHXGDOWACIERSH-UHFFFAOYSA-N	426.429	1.057	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2F)ccc1Cl	763678647	GLCUEAKUOYGSRG-UHFFFAOYSA-N	437.811	1.821	50	20	IDGD	
CCOC(=O)/C=C/c1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2F)cc1	763682069	WKXYKVPPIDEBDQ-FMIVXFBMSA-N	429.404	1.567	50	20	IDGD	
COCCOc1cc(NC(=O)C(=O)NNC(=O)c2cccc(N(C)C)c2)ccc1OC	763760250	JBTQVZWPXHKEEU-UHFFFAOYSA-N	430.461	1.186	50	20	IDGD	
Cc1ccc(-c2ncco2)cc1NC(=O)C(=O)NNC(=O)COc1ccccc1[N+](=O)[O-]	763803788	NRVQXYRFJXTRPD-UHFFFAOYSA-N	439.384	1.723	50	20	IDGD	
CNC(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc3ccccc3c2)cc1	763852426	IPWNADYINLTFQK-OAHLLOKOSA-N	448.479	1.682	50	20	IDGD	
CCCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)cc1	763864633	DRMSVSBSBRDJNK-CYBMUJFWSA-N	430.436	1.519	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(NC(C)=O)c(C)c2)cc1OC	763900344	DGRCWBANNNFUFX-UHFFFAOYSA-N	428.445	1.760	50	20	IDGD	
Cc1ccc(C(N)=O)cc1NC(=O)C(=O)NNC(=O)c1sc(-c2ccccc2)nc1C	763900924	DWNLCQKIASRMSE-UHFFFAOYSA-N	437.481	1.926	50	20	IDGD	
O=C(NNC(=O)c1cc2c(s1)CCCCC2)C(=O)Nc1ccc(-n2cncn2)nc1	763963002	WPUPCNBGTNHHEC-UHFFFAOYSA-N	425.474	1.392	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1ccc(OC)c(OC)c1OC	764013123	VDFHBGDRKCYQHY-UHFFFAOYSA-N	437.836	1.774	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc(-c2nnc3n2CCCC3)cc1	764049412	YWSVMTGINLMNDE-UHFFFAOYSA-N	434.456	1.690	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(SC(F)F)cc2)c1	764077196	IYOOUIBDCBQYBW-UHFFFAOYSA-N	443.453	1.805	50	20	IDGD	
CC[C@H](C)C(=O)NNC(=O)C(=O)Nc1cccc(S(=O)(=O)N(C)C2CCCCC2)c1	764086078	SOWGMHZYHMKVFT-AWEZNQCLSA-N	438.550	1.772	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(N3CCCC3=O)ccc2Cl)c(O)c1	764110095	YAWBSANNCFGGHH-UHFFFAOYSA-N	430.848	1.881	50	20	IDGD	
CCOC(=O)c1cc(F)c(F)cc1NC(=O)C(=O)NNC(=O)CCc1ccc(OC)cc1	764131249	JCXFOXMUZYAJEX-UHFFFAOYSA-N	449.410	1.869	50	20	IDGD	
COc1ccc(Cn2nccc2NC(=O)C(=O)NNC(=O)Cc2ccccc2OC)cc1	764139638	XABYLIMMWQSFHT-UHFFFAOYSA-N	437.456	1.277	50	20	IDGD	
CC(C)(C)OC(=O)Cc1ccccc1NC(=O)C(=O)NNC(=O)[C@H]1Cc2ccccc2O1	764162313	CBSWXUFCUCGERE-GOSISDBHSA-N	439.468	1.660	50	20	IDGD	
O=C(CCCc1ccccc1)NNC(=O)C(=O)Nc1cc2c(cc1[N+](=O)[O-])OCCCO2	764223538	HLCPJBBJMWQKBA-UHFFFAOYSA-N	442.428	1.865	50	20	IDGD	
Cc1ccc(C(=O)NCC(F)(F)F)cc1NC(=O)C(=O)NNC(=O)c1cccc(C#N)c1	764238931	ZZBGRVLZYDWXTE-UHFFFAOYSA-N	447.373	1.559	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)Cc3cccnc3)cc2F)C[C@H](C)O1	764263855	MMRUQTWQBGJLPV-KBPBESRZSA-N	429.452	1.163	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C(=O)Nc1cccc(N2C(=O)CN(C)C2=O)c1)c1ccccc1	764329856	PCFCZXVNZKBOCR-KRWDZBQOSA-N	437.456	1.365	50	20	IDGD	
O=C(NNC(=O)C1CCC1)C(=O)Nc1ccc(CN2CCN(Cc3ccccc3)CC2)cc1	764335032	JYOYNISANYSCQV-UHFFFAOYSA-N	449.555	1.890	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)Cc2ccncc2)n(-c2ccccc2C(F)(F)F)n1	764353341	ISDLZDSQYBLZQL-UHFFFAOYSA-N	446.389	1.923	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)Cc2csc3nccn23)cc1	764519611	SGAUUGOHEYBPAN-UHFFFAOYSA-N	427.515	1.820	50	20	IDGD	
CC(=O)OCCCc1cccc(NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c1	765398229	TXBXQXYSLWDBLA-UHFFFAOYSA-N	437.456	1.896	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)[C@]3(O)CCSC3)c2)c(C)c1	765507331	JEUMUEMJIVWERP-FQEVSTJZSA-N	449.554	1.733	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNS(=O)(=O)c2cnc3c(Cl)c(C)nn3c2)cc1C	766313573	YQWSNJYRKWMKAF-UHFFFAOYSA-N	436.881	1.256	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	766662698	BQLQLGPMDPNBBZ-UHFFFAOYSA-N	445.951	1.726	50	20	IDGD	
COc1ccc(C(C)(C)C(=O)OCC(=O)NNC(=O)c2ccc(OC)c(OC)c2)cc1	767630584	GCWYLZGUZHKICZ-UHFFFAOYSA-N	430.457	1.994	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)OCc2nnnn2CC2CCOCC2)c1C	768356746	NUBCQKFTOXMJSO-YBFXNURJSA-N	428.493	1.815	50	20	IDGD	
CC(C)(C)OC(=O)N1CCc2ccccc2[C@H]1C(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1	769077648	LHTMGORCLOWPQU-HOCLYGCPSA-N	437.518	1.103	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2ccc3nnc(C(C)(C)C)n3c2)n1	769206971	UPRDVMBBTRHDCL-UHFFFAOYSA-N	430.490	1.339	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNS(=O)(=O)c1cccc(Br)c1	771603438	AKBKGXOYIUTCHD-UHFFFAOYSA-N	446.710	1.728	50	20	IDGD	
Cc1cc(F)c(S(=O)(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)cc1C(=O)O	771605895	DIBZVQUMJGAJDV-UHFFFAOYSA-N	443.840	1.112	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)[C@@H]1CC(=O)N(c2ccc(Br)c(C)c2)C1	771995314	QWLHFKSLZJWKHP-VXGBXAGGSA-N	440.294	1.600	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NNC(=O)CCNC(=O)OCC(F)(F)F)C1	773420013	WJFIPARWYJHREM-LLVKDONJSA-N	440.419	1.460	50	20	IDGD	
COc1ccc(Cn2nccc2NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2)c(OC)c1	773644124	ILFRBJXLTRPRTR-UHFFFAOYSA-N	440.416	1.939	50	20	IDGD	
COC(=O)c1ccsc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1cccc(Cl)c1	774007992	DHHKSPGQROZVKV-VIFPVBQESA-N	425.850	1.742	50	20	IDGD	
Cc1nnnn1-c1cccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)c1	774008837	MGHKZJNAMMVXDD-NSHDSACASA-N	443.851	1.178	50	20	IDGD	
COc1ccc(NS(=O)(=O)CCCCCl)cc1S(=O)(=O)N1CCOCC1	776431158	IESVXSRSKKHQPO-UHFFFAOYSA-N	426.944	1.477	50	20	IDGD	
CCSc1cc(CNC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)ccn1	777411913	JYSPESSEPMSNBJ-UHFFFAOYSA-N	436.563	1.939	50	20	IDGD	
C[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	777412755	YSKQIDWSZWNPGX-CJNGLKHVSA-N	444.496	1.252	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(N2CCOC2=O)c([N+](=O)[O-])c1)c1c[nH]c2ccccc12	777595277	DGZFHHGTPALCRZ-UHFFFAOYSA-N	445.413	1.656	50	20	IDGD	
CN(C)C(=O)COc1ccccc1C(F)(F)C(=O)NNc1nc(-c2ccncc2)no1	778691162	VGUWZBHJGXUUAD-UHFFFAOYSA-N	432.387	1.834	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1ccc(OC2COC2)cc1	782124760	SVROQLGGFZAREK-UHFFFAOYSA-N	431.470	1.351	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2ccc(CC(=O)N3CCSCC3)cc2)cc1	783035877	GSTSWWJJHGOENF-UHFFFAOYSA-N	428.514	1.895	50	20	IDGD	
COCC[S@](=O)Cc1cccc(NC(=O)C(=O)NNC(=O)Nc2ccccc2C)c1	783415990	NMIREBGYOUPKJY-PMERELPUSA-N	432.502	1.682	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NN[C@@]2(C)CCS(=O)(=O)C2)c(OCc2ccccc2)c1	783426821	ONGODHXRRMJZMV-NRFANRHFSA-N	431.514	1.711	50	20	IDGD	
CN(NC(=O)C(=O)N1CCc2cc(S(=O)(=O)N3CCCCC3)ccc21)c1ccccc1	783431562	GFYUYSJSLGKXRV-UHFFFAOYSA-N	442.541	1.918	50	20	IDGD	
Cn1ccc2c(NC(=O)C(=O)NNc3ccc(S(=O)(=O)NC4CC4)cc3)cccc21	784217631	VVUWFKHZWWNOAI-UHFFFAOYSA-N	427.486	1.701	50	20	IDGD	
O=C(CN1CCCCCCC1)Nc1ccc(NC(=O)C(=O)NNc2ncc(F)cn2)cc1	784949084	DMSYRQVVFRUGDZ-UHFFFAOYSA-N	443.483	1.902	50	20	IDGD	
COc1c(NC(=O)C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)cccc1C(N)=O	785099727	KAHMYDWXJMTAPF-UHFFFAOYSA-N	447.398	1.046	50	20	IDGD	
COC(=O)Nc1ccc(NC(=O)C(=O)NNc2c(OC)cccc2S(C)(=O)=O)cc1	785330078	CVBMQNXEWLKAKI-UHFFFAOYSA-N	436.446	1.359	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)[C@@]2(O)CCc3ccccc3C2)CC1	786187549	XXVJSXQXEYOJFS-JOCHJYFZSA-N	432.521	1.636	50	20	IDGD	
C[C@@H]1[C@@H](C(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)CCN1C(=O)OC(C)(C)C	786250208	OHDAORQBMFELHR-DOMZBBRYSA-N	440.522	1.888	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)c1ccc2c(c1)C(=O)N(C[C@H]1CCCO1)C2=O	788180666	DGJXGTTVWQNEDW-CQSZACIVSA-N	433.428	1.194	50	20	IDGD	
Cc1nc2nc(N)nn2c(C)c1CCC(=O)NNC(=O)c1cc2c(s1)CC[C@@H](C)C2	789297986	GKXOAJPHRQCPBS-SNVBAGLBSA-N	427.534	1.903	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1nc2c(s1)C[C@H](C(C)(C)C)CC2	789739489	OWKJCXKDRAVUBE-NWDGAFQWSA-N	426.539	1.432	50	20	IDGD	
Cc1ccn(-c2ccccc2NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)n1	789814083	ZUXDEYCPZPXKDE-PXNSSMCTSA-N	433.468	1.839	50	20	IDGD	
COc1ccc(OC)c(C2=NO[C@@H](C(=O)NNC(=O)Cc3nc4ccccc4n3C)C2)c1	792016982	DUVIEDLNSRVGJU-LJQANCHMSA-N	437.456	1.474	50	20	IDGD	
CSCCNC(=S)NNC(=O)c1cc(NS(C)(=O)=O)cc(C(F)(F)F)c1	792290712	YJIARPPDPLFVDA-UHFFFAOYSA-N	430.499	1.549	50	20	IDGD	
C[C@@](O)(Cn1cc(C(F)(F)F)ccc1=O)C(=O)NNC(=O)c1cc2ccccc2cc1O	792630282	USGUTRAIILJZON-HXUWFJFHSA-N	449.385	1.938	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)c1ccnc(NC(=O)C2CC2)c1	794750967	JHHYJDXNAJCBRE-UHFFFAOYSA-N	436.516	1.403	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@@H](O)c1cccc(C(F)(F)F)c1	794779991	IPSSBEFSHCBFDV-ZDUSSCGKSA-N	444.435	1.802	50	20	IDGD	
CC(=O)N[C@](C)(C(=O)NNC(=O)c1cc2ccccc2o1)c1ccc(S(C)(=O)=O)cc1	797461654	AYWOTTUBFUHMIS-NRFANRHFSA-N	443.481	1.649	50	20	IDGD	
Cc1cc(C)nc(-n2nccc2NC(=O)NNC(=O)CNC(=O)OCc2ccccc2)n1	797649624	JSESRZKYVGWUBT-UHFFFAOYSA-N	438.448	1.358	50	20	IDGD	
CCc1cc(C(=O)NNC(=O)CNC(=O)c2cccnc2)c2c(CC(C)(C)C)noc2n1	800334261	IBTKLZXTHOTZDE-UHFFFAOYSA-N	438.488	1.960	50	20	IDGD	
C[C@H](CCNS(=O)(=O)c1ccccc1)NC(=O)NNC(=O)Nc1ccc(N(C)C)cc1	801797132	WSOWQGGUXZLGSX-OAHLLOKOSA-N	448.549	1.845	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(Cl)s1)NNC(=O)Nc1ccc2c(c1)OCO2	802103910	LXWYUSBBVXPGLB-UHFFFAOYSA-N	432.867	1.261	50	20	IDGD	
COc1ccc(Cl)c(NC(=O)NNC(=O)[C@@](C)(O)CN2Cc3ccccc3C2=O)c1	802113561	WAIUCTUQBBGRKT-FQEVSTJZSA-N	432.864	1.908	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C[C@H]1COCCN1C(=O)OC(C)(C)C	803112889	JZTRVYXXSRQFPN-ZDUSSCGKSA-N	443.522	1.568	50	20	IDGD	
CC[C@@H](NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)c1ccc(OC)c(OC)c1	804868164	YJSNLZDJVWSOCS-MRXNPFEDSA-N	425.449	1.775	50	20	IDGD	
CN(Cc1nc(-c2cccs2)no1)C(=O)NNC(=O)c1csc(N2CCOCC2)n1	804868198	ZQELMZQUSMIMOQ-UHFFFAOYSA-N	449.518	1.578	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)c1nn(-c2cc(Cl)ccc2[N+](=O)[O-])cc1O	804957093	OFIWULGFSQLEKE-UHFFFAOYSA-N	441.795	1.872	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)NNc1ccc(-n2ccnc2)nn1	806290117	HXMVZBVBLAZSKM-UHFFFAOYSA-N	446.493	1.460	50	20	IDGD	
N#Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1Br	806972727	IZKRTPUCQAFMRM-OAHLLOKOSA-N	445.229	1.247	50	20	IDGD	
CN1CCN(C(=O)NNC(=O)[C@H]2CCC(=O)N(C)[C@@H]2c2ccc(C(F)(F)F)cc2)CC1	807380621	KWDSNOBXZXLQPR-DOTOQJQBSA-N	441.454	1.603	50	20	IDGD	
CN(C)CCOc1ccc(NC(=O)C(=O)NNc2ccc(-n3ccnc3)nn2)cc1Cl	807429839	YSRYJDYLYXPMFN-UHFFFAOYSA-N	444.883	1.338	50	20	IDGD	
CCCNS(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)c2ccccc2OC)cc1	808090453	FBVDBWGAWWLDPA-UHFFFAOYSA-N	427.504	1.007	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)N1CCN([C@H]2CCN(C(=O)OC(C)(C)C)C2)CC1	808187826	MCHHOKKUOIRMSJ-KRWDZBQOSA-N	431.537	1.976	50	20	IDGD	
CN(C)c1cc(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)nc2ccccc12	809982416	FWOYTSVXUQRVRJ-UHFFFAOYSA-N	447.904	1.676	50	20	IDGD	
CC/C=C(/C)C(=O)NNC(=O)C[C@H]1c2cc(OC)c(OC)cc2CCN1S(C)(=O)=O	809999532	OFVRMGAZJFPQEN-DJXGBFBFSA-N	439.534	1.456	50	20	IDGD	
CCn1ncc2ccc(NC(=O)C(=O)NNc3ccc(S(=O)(=O)N(C)C)cc3)cc21	813033971	TWKPNKQUYZFJKF-UHFFFAOYSA-N	430.490	1.388	50	20	IDGD	
CO[C@@H]1C[C@@H](c2ccccc2)CCC1=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O	814785232	OCFKFPKSZJOTAO-GOEBONIOSA-N	431.518	1.026	50	20	IDGD	
NS(=O)(=O)c1ccc(NC(=O)NN=Cc2cc3c(cc2Br)OCO3)cc1	814968338	YYMGYKLVCGFTGS-UHFFFAOYSA-N	441.263	1.981	50	20	IDGD	
CNC(=O)c1cc(Oc2cccc(NC(=O)C(=O)NNc3cccc(OC)n3)c2)ccn1	815558969	SWBSLOUEJUFGNE-UHFFFAOYSA-N	436.428	1.719	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1nc(CC(F)(F)F)cs1	815565871	BZUQCFYLOWFRHT-QMMMGPOBSA-N	434.371	1.940	50	20	IDGD	
CSCC[C@@H](NC(=O)c1ccccc1Br)C(=O)NNc1cnnn1C	816770499	ZXRNDSLNCPRDPI-GFCCVEGCSA-N	427.328	1.572	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C[C@H](c2nccn2C)C(F)(F)F)cc(OC)c1OC	816814441	QSULWVOLLVPAEC-LLVKDONJSA-N	430.383	1.943	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)c1ccccc1S(=O)(=O)N1CCCCC1	863999002	IYJMFZWKKQOVBU-UHFFFAOYSA-N	447.513	1.710	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)COc2ccc(Oc3ccccn3)cc2)c2ccccc2c1=O	891624578	CEWCAJAMRCQFND-UHFFFAOYSA-N	445.435	1.961	50	20	IDGD	
CCCn1c(CCC(=O)NNC(=O)OC)nc2cc(S(=O)(=O)N3CCCC3)ccc21	913176929	OPXLTMQPOSBCGD-UHFFFAOYSA-N	437.522	1.551	50	20	IDGD	
CC(C)NS(=O)(=O)c1cccc(CNC(=O)NNC(=O)c2c[nH]c3ccccc23)c1	913640939	ZVGMZLYPAISFBI-UHFFFAOYSA-N	429.502	1.999	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)c2ccccc2OCc2ccncc2)c2ccccc2c1=O	914280262	KZBTVSRQQLRNIN-UHFFFAOYSA-N	429.436	1.982	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNS(=O)(=O)c2ccc(OCC(=O)O)cc2)cc1	915185018	QZJRCJDOXYWYTF-ZDUSSCGKSA-N	438.458	1.326	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)C[C@H]3CCCO3)c2)cc1	915636769	UAZQNODERPOGLP-QGZVFWFLSA-N	433.486	1.826	50	20	IDGD	
COc1cccc(COCC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1	915638463	VFDCMHFHDDBGHW-UHFFFAOYSA-N	447.513	1.458	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2ccc3c(c2)NC(=O)CS3)ccc1Cl	915789086	HLPSWEAISTVCSP-UHFFFAOYSA-N	440.890	1.106	50	20	IDGD	
Cc1nn([C@@H]2CCS(=O)(=O)C2)c(Cl)c1C=NNC(=O)[C@H](C)CN1CCCCC1	916364549	PDHCSPLWUSIKNW-UKRRQHHQSA-N	429.974	1.777	50	20	IDGD	
COCCOc1ncccc1CNC(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	916510170	BKOOWZGOTTUOFD-UHFFFAOYSA-N	426.433	1.142	50	20	IDGD	
O=C(NC[C@@H]1Cc2ccccc2O1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	916516153	KSOGBZMZEXLDKX-KRWDZBQOSA-N	444.513	1.419	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)NCc1cc(Cl)c2c(c1)OCCO2	916628727	ZNSVNVXGRFIQFM-UHFFFAOYSA-N	436.808	1.929	50	20	IDGD	
COc1ccc(S(=O)(=O)NCCC(=O)NNC(=O)NC2CCCCC2)cc1OC	916655587	WCGVDDURZFUIPQ-UHFFFAOYSA-N	428.511	1.035	50	20	IDGD	
COc1cc(C)c(S(=O)(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1C	917723455	FVEIPGFAQKTVSM-UHFFFAOYSA-N	426.520	1.228	50	20	IDGD	
C[C@@H]1C[C@H]1c1ccc(CNC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)o1	918078021	LTUADDRMDPARSL-RHSMWYFYSA-N	448.549	1.560	50	20	IDGD	
CCS(=O)(=O)NCCNC(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccccc1	918561672	FAIVSCRPJTYLEH-GHRIWEEISA-N	426.502	1.426	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)c2ccc(CN3CCN(C)CC3)cc2)cc1OC	919744752	IXLYGHDXXGOARH-UHFFFAOYSA-N	426.517	1.916	50	20	IDGD	
Cc1ccc(Sc2ncccc2C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)c(C)c1	919889209	KDRCNRIADVAEJD-CQSZACIVSA-N	434.543	1.981	50	20	IDGD	
CCCNC(=O)NNC(=O)c1ccc(NC(=O)C[C@H]2SC(N3CCCC3)=NC2=O)cc1	921042129	BHYCLUFYCAGZRQ-OAHLLOKOSA-N	446.533	1.463	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)Nc1ccnn1C[C@H]1CCOC1	1325804625	ZQOJDWDYNDVFHW-GFCCVEGCSA-N	438.282	1.914	50	20	IDGD	
C[C@H]1C(=O)Nc2cc(C(=O)NNC(=O)C3CCN(C(=O)OC(C)(C)C)CC3)ccc2N1C	1331185603	TZQOFKQDAPPHSL-ZDUSSCGKSA-N	445.520	1.872	50	20	IDGD	
CC1(C)NC(=O)N(CCCNC(=O)NNC(=O)CCSc2ccc(F)cc2)C1=O	1519715403	LNTJWKBJDRCBBH-UHFFFAOYSA-N	425.486	1.359	50	20	IDGD	
O=C(c1n[nH]c2c(F)cccc12)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1778638210	FZQNXASDYSSHEZ-WMLDXEAASA-N	443.248	1.836	50	20	IDGD	
Cc1ccc(=O)n(C(C)(C)C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](F)Cl)C3)n1	1779506922	MUWYFBSKSHUJLF-PTSWNOGYSA-N	442.919	1.335	50	20	IDGD	
COc1ccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@](C)(Cl)CCl)C3)nn1	1779952538	MSALGNQDWPXSLO-MDASCCDHSA-N	445.347	1.849	50	20	IDGD	
COc1ccc(CC(=O)N2CC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)c([N+](=O)[O-])c1	1781415333	YZRYMVKBLIQAQW-SFHVURJKSA-N	446.287	1.780	50	20	IDGD	
Cc1ncncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)Br)C1	1781998103	SONFJSVKYVQGMB-WBHUJUFNSA-N	425.327	1.696	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H]2CCc3nc[nH]c3C2)C1	1782459849	IYTYRIREPPPZSD-QKSJRXBFSA-N	438.956	1.282	50	20	IDGD	
O=C(C1CCN(c2ccc(F)cn2)CC1)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Cl)CCO2	1782797922	SEOGUCAUKUCSDO-FXAWDEMLSA-N	442.894	1.801	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)CC(=O)OC(C)(C)C)CCO2)C1	1783342380	IPIHZCRHBJCTOZ-UGSOOPFHSA-N	433.343	1.722	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1CCC[C@@H]3CCCC[C@H]31)CCO2	1783934532	IQFWXNKTAGSYSZ-SMOZNVCYSA-N	448.608	1.796	50	20	IDGD	
O=C(c1ccc(N2CCOCC2)cn1)N1CCO[C@@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783943894	PIQZLFXLBPAILV-LJQANCHMSA-N	443.331	1.165	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc4nccn34)C[C@@H]21	1783973221	VDEOLIDAORGDJG-JKQORVJESA-N	449.349	1.959	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccncc3-c3ccccc3)C[C@@H]21)[C@@H](O)CCl	1784090876	DTINSVBSDSEATF-FIRPJDEBSA-N	443.931	1.942	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3nc(Cl)ccc3F)[C@H]2C1	1785477103	QZMCJDUJEUBEPJ-MNXVOIDGSA-N	434.295	1.721	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)CNC(=O)c3ccc(C)cc3)C2)C1	1785560963	MVRKFOPJJRMAGJ-GCJKJVERSA-N	435.952	1.962	50	20	IDGD	
COc1cccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)Br)C[C@@H]32)n1	1785812335	MBURJELZZJVAIP-OSFYFWSMSA-N	426.311	1.467	50	20	IDGD	
O=C1CC(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]3C2)=Cc2ccccc2N1	1787448208	YDKSBTAYBPXYFJ-YMFLFHJQSA-N	435.883	1.926	50	20	IDGD	
C[C@H]1CCc2c(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)CCBr)C[C@@H]43)n[nH]c21	1787950373	HWFCFRFCIWDKSX-JURCDPSOSA-N	439.354	1.838	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Cl)C[C@@H]21)c1n[nH]c2c1CCc1ncccc1-2	1789185473	UFAXQFLWCFOUMU-WNZPGNDNSA-N	447.898	1.698	50	20	IDGD	
COC(=O)c1ccc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Cl)C[C@@H]32)s1	1789689788	UBOABTMTAXKMTM-SDPXSBNPSA-N	432.901	1.591	50	20	IDGD	
Cn1nc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]3C2)c2c1CCC2	1789926363	VCHMXFKTDKESST-ZAJUMQRFSA-N	443.317	1.193	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)c1ccc(O)cc1F	1790084433	SJWKIIVKXPESRZ-HLHNXRDNSA-N	433.249	1.815	50	20	IDGD	
CC(C)=NO[C@H](C)C(=O)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1	1790564558	GRTUXWMAYATXIG-MRXNPFEDSA-N	437.305	1.915	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4[nH]ccc4n3)C[C@@H]21	1791056344	UXAUGRAJWFMJLY-MRHIQRDNSA-N	435.322	1.940	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(C)nn3C(F)F)C[C@@H]21	1791253377	APHGOPYQZYBERP-XPCVCDNBSA-N	434.871	1.434	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3cnccn3)[C@H]2C1	1791656203	GXYBIUNMXAQZFF-OHFALNGGSA-N	439.354	1.420	50	20	IDGD	
CC(C)(C)c1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)cn1	1792441619	GCSPZJRTKKHRIJ-ACDBMABISA-N	435.333	1.625	50	20	IDGD	
CCOC(=O)O[C@@H](C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)CBr	1792872126	NDMPUIGXWIPRLG-XHJNMGKDSA-N	435.315	1.169	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(-c3ccccc3)nc1)C2)[C@H](O)CCl	1792980957	OJOBINQYSWJSIJ-PIKOESSRSA-N	429.904	1.552	50	20	IDGD	
O=C(COc1ccc(F)cc1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2	1795198370	XJCVJULQVQHIAV-OXUXUCFPSA-N	433.249	1.485	50	20	IDGD	
N#CCCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](Br)Cc1ccccc1)C2	1795420538	GCKYBRJNJQLBCW-ZMMAXQRCSA-N	434.334	1.886	50	20	IDGD	
CC(C)Cc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)Br)C3)n(C)n1	1796018391	XPTUNXHYMKBUAP-VWPFQQQWSA-N	441.370	1.605	50	20	IDGD	
C[C@H](CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)Oc1ccccc1	1796189898	CATUBIZMPWIIMH-RZXSNQJFSA-N	436.317	1.476	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C13CC(C(F)(F)F)(C1)C3)C2	1796190030	RWKRYUZBPPHUPZ-CVMQENGJSA-N	436.239	1.351	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2c(c1)CCCC2=O	1797024556	LGRMOMWNYUGXNT-WQDJSCAQSA-N	434.920	1.663	50	20	IDGD	
CN(CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cn[nH]c1)NC(=O)NCc1ccccc1	1797041723	HRONPWNVWJKEMH-REPLKXPHSA-N	439.520	1.008	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1=Cc2ccccc2NC(=O)C1	1798437094	HBWGEOXLSCLKGX-CLWJZODNSA-N	447.919	1.256	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1[C@@H]2Sc3ccccc3[C@H]21	1798458382	ZXPJBFFSZVXLEK-CHDRMWHRSA-N	442.585	1.886	50	20	IDGD	
COc1ccccc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)CBr)C2	1798815329	QBNGGUYKLJTQKX-ZJOBFFGXSA-N	425.323	1.929	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@](C)(Cl)CCl	1799279447	OQGYOQZLNAWALG-GUFWIUQMSA-N	425.309	1.374	50	20	IDGD	
CCOc1ncccc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Br	1799343130	OGPLGZGSYWJFRI-XCCSTKFXSA-N	430.274	1.374	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2cccnc2nc1O	1799919471	MHFKFZDEGVTTJY-FSDCSDTHSA-N	432.908	1.946	50	20	IDGD	
C[C@@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2	1800744223	HAGGQOQOSDBYHA-USACIQFYSA-N	441.887	1.425	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/c1ccc([N+](=O)[O-])o1)C2	1800754647	SVURYLPTQPSWCF-OTISQIKCSA-N	442.266	1.574	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c(c1)NC(=O)CC3)C2	1800979622	RVGOCQUAUHFKBW-RCJHGTSTSA-N	435.908	1.028	50	20	IDGD	
N#Cc1ccc(CC(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)cc1	1802573264	JYUJQEOZJJWGOG-ZJOUEHCJSA-N	426.904	1.801	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H](CNC(=O)[C@@H]2CCC(=O)NC2)[C@H]1c1cccnc1	1802607967	FCWBRYBGHFGBCA-MBOZVWFJSA-N	432.597	1.465	50	20	IDGD	
O=C(CN1CCOC1=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@H]1c1cccnc1	1803337813	ROPVXWOUEBJSPO-AEGPPILISA-N	443.273	1.230	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)/C=C/c2ccco2)[C@H]1c1cccnc1	1804613024	GDOCUVULDZLHMO-UMQOZUHOSA-N	439.516	1.767	50	20	IDGD	
Cc1ncoc1C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1	1805857856	LEKXACIGEQSLFS-MAUKXSAKSA-N	449.471	1.010	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)Cc2cccs2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807362197	FNSOCICLWSJFOA-PGRDOPGGSA-N	449.341	1.385	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC2(CCCN(C(=O)c3cnoc3C)C2)CC1	1808520712	OPGYJRZBUTZPGX-MFKUBSTISA-N	440.504	1.962	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)c2cnoc2)[C@H]1c1cccnc1	1808521664	MTCCXVLHLQULSN-RUVVGEKZSA-N	449.471	1.523	50	20	IDGD	
CN1C(=O)CC[C@H]1C(=O)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@@H]1c1cccnc1	1808774550	SCYHHZFNPNSGFN-UGQVUOCMSA-N	441.301	1.399	50	20	IDGD	
O=C(Cc1cccc(F)c1)N1CCCC2(CCN(C(=O)c3cccc(B(O)O)c3)CC2)C1	1809233226	FZWCDLCLGGWZPE-UHFFFAOYSA-N	438.308	1.593	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)C[C@@](C)(O)CC(=O)O)[C@@H]1c1cccnc1	1813067407	GWZRNWXCBOXFIP-HCCHORAYSA-N	425.913	1.721	50	20	IDGD	
CCc1nc(C(=O)N2CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)co1	1813074610	UOVVYOJQHUBHGJ-KKSFZXQISA-N	442.520	1.325	50	20	IDGD	
CC1(C)CC(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)C1	1813125544	BDUVOQHNGYVDEJ-RXVVDRJESA-N	435.333	1.517	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)C[C@@H](NC)C(=O)O)sc2C1	1815087491	YXTRWHXUCRCSQK-ATZCPNFKSA-N	447.355	1.291	50	20	IDGD	
CCC[C@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](COC)NC(C)=O)[nH]n1	1815321268	RPNJKHSKUWDUQE-BPUTZDHNSA-N	427.933	1.960	50	20	IDGD	
Cc1nc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)cs1	1817473147	INNYPBYBURBWQC-QGZVFWFLSA-N	439.306	1.474	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2nc3ncccn3n2)n[nH]1	1818621208	UKDLCXLFDSXSMH-WCQYABFASA-N	432.872	1.407	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](C)Nc2cnccn2)[nH]n1	1822370143	LFCMNIQZGSWPKN-IPYPFGDCSA-N	435.916	1.946	50	20	IDGD	
CCc1nc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)co1	1822414396	DPRCXUZSCWSVQR-HNNXBMFYSA-N	431.497	1.639	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)[C@@H]1CCCSC1	1823453303	SFKQZKXTONIMKR-QAPCUYQASA-N	442.350	1.539	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1[nH]nnc1C)CC2	1825446998	NMRKBYONMKGIAX-BDAKNGLRSA-N	427.328	1.969	50	20	IDGD	
O=C(COc1cccnn1)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](F)Br)CC2	1826762995	VMKMPIBDPCHONB-ISVAXAHUSA-N	444.286	1.615	50	20	IDGD	
CC[C@H](C)[C@H](O)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827050748	XKXKHXLHAZOWHX-NDXORKPFSA-N	430.354	1.007	50	20	IDGD	
CC(C)=NO[C@H](C)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827056851	YXMKSBHDQNUWRI-DYESRHJHSA-N	443.353	1.401	50	20	IDGD	
O=C(c1ccc(F)nc1)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827058601	YDMAZUPRICORLH-HXUWFJFHSA-N	439.296	1.448	50	20	IDGD	
N[C@@H](Cc1cscn1)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@H](O)CCl)CC1	1827546023	WSCPCGHGSXKTJD-YESZJQIVSA-N	428.986	1.232	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CN2CCN(C)CC2)CC1	1828444720	LULMWVPBMAXPCV-OALUTQOASA-N	429.005	1.107	50	20	IDGD	
COc1ccc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)cc1	1830359505	QFTZQDMZHYRDLE-JOCHJYFZSA-N	438.952	1.959	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc4nccn34)C2)C1	1830365929	JNIWCFWTBLHXOH-OAQYLSRUSA-N	434.924	1.669	50	20	IDGD	
Cc1cncc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)c1	1830537437	IHACDEBWDZBWTA-KXBFYZLASA-N	440.338	1.491	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cn(C)nc2OC)CC1	1831828743	TYQREBJRUZDYJZ-IRXDYDNUSA-N	426.945	1.916	50	20	IDGD	
CNc1nsnc1C(=O)NC1CCN(C2CCN(C(=O)[C@@H](Cl)COC)CC2)CC1	1833072992	DQIHSWSPALRGCG-AWEZNQCLSA-N	444.989	1.019	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)C3CCN(C)CC3)CC2)CC1	1833105545	HCVCZASGPXLJED-HNNXBMFYSA-N	443.430	1.683	50	20	IDGD	
C[C@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)C3(C#N)CC3)CC2)CC1	1833262302	MXVWJDFFNFFNGB-CQSZACIVSA-N	425.371	1.893	50	20	IDGD	
C[C@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)c3cnnn3C)CC2)CC1	1833265447	WOLLIYKYGUCXGS-CYBMUJFWSA-N	441.374	1.031	50	20	IDGD	
O=C(c1ccc(Cl)nc1F)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1833269633	VIWZDWJTNBWGOG-INIZCTEOSA-N	440.686	1.748	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)cnc1C	1833301394	DLEBVFBCXCGIPQ-KUHUBIRLSA-N	440.338	1.552	50	20	IDGD	
CCn1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](C)CBr)C3)C2)n1	1834401520	JREMBVVZDFCARS-KBXCAEBGSA-N	443.342	1.004	50	20	IDGD	
COCC1(C(=O)N2CCC(N3CCC(NC(=O)CCBr)CC3)CC2)CC1	1834422588	VZPJTXKYBXVECS-UHFFFAOYSA-N	430.387	1.770	50	20	IDGD	
Cc1ccc(OCC(=O)N2CCO[C@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)cc1	1835166986	VSPTUNOOFMVOQS-LJQANCHMSA-N	431.316	1.634	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H](O)c3ccccc3)CCO2)C1	1835291062	BMNVOAKSRGCUHN-VDGAXYAQSA-N	445.343	1.413	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)NCCC#N)CCO2	1835674702	FCRPIMXXLVIOJL-UZLBHIALSA-N	428.961	1.132	50	20	IDGD	
CC[C@@H](NC(C)=O)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](Cl)COC)CC2)CC1	1836618940	KYXPYIIVBLBESY-ZWKOTPCHSA-N	431.961	1.154	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCC(OC2CCN(C(=O)C[C@@](C)(O)CC(=O)O)CC2)CC1	1836624539	MWSJGIXXPJZVHS-OAQYLSRUSA-N	446.972	1.866	50	20	IDGD	
O=C(Cc1ccccc1F)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836716657	HNXXCUDVNNBQBO-LJQANCHMSA-N	426.916	1.967	50	20	IDGD	
O=C(c1n[nH]c2ccc(F)cc12)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1837041238	ADZWVTIGHDSPIS-QAPCUYQASA-N	428.823	1.306	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(NC(C)=O)o3)CCO2)C1	1837453042	AVXWSDOEMRHLGW-LIRRHRJNSA-N	427.885	1.325	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3nc(C)c(C)s3)CCO2)C1	1838411955	RXFCVYLAFYIKEF-KBXCAEBGSA-N	431.942	1.084	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)[C@H]3C[C@]3(F)Cl)CC2)CC1	1838789697	UATVDJSIOHNAFX-OXQOHEQNSA-N	446.951	1.283	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccccc3O)C2)C1	1840035446	RNWIELOXMFUZOT-LIRRHRJNSA-N	441.322	1.175	50	20	IDGD	
CC[C@H](C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H](Cl)COC)CCO2)C1)c1ccccc1	1840151264	ZEEQSADZWBUSMW-CNNODRBYSA-N	438.952	1.890	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC2(CCCN2C(=O)Cc2ncccn2)C1	1842109856	DHRIVEKSXJZKOC-AWEZNQCLSA-N	437.928	1.355	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2ccc3ncoc3c2)C1	1843791598	GINXIISASZNTJR-AFUMVMLFSA-N	434.456	1.779	50	20	IDGD	
C=C[C@@H]1C[C@]1(NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)[C@@H](Cl)COC)C1	1846365870	ZZOCDCSZPSQTST-LRAJWGHMSA-N	441.956	1.913	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)C(F)(F)C(F)(F)C(=O)O	1848012833	FPNSIQNXEHJIIS-VGMNWLOBSA-N	433.196	1.717	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)NCc2cccc(NS(C)(=O)=O)c2)nc2ccccc21	10356149	VYRZHFZSFALREK-UHFFFAOYSA-N	430.490	1.018	50	20	IDGD	
COc1ccc(-c2noc(CCC(=O)NNC(=O)COc3ccccc3OC)n2)cc1	14317498	PWYDGBLLCJDZSL-UHFFFAOYSA-N	426.429	1.913	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COc2cc(C)ccc2C)cc1S(=O)(=O)N(C)C	15886199	BBVNEGCLVSFOPF-UHFFFAOYSA-N	435.502	1.402	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)c1cccc(N2CCCC2=O)c1	18079775	ILXGOTXQEDPTQN-UHFFFAOYSA-N	435.528	1.787	50	20	IDGD	
CC(C)N(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1	26068752	GQHYGICSLUYKIM-SFHVURJKSA-N	433.486	1.317	50	20	IDGD	
O=C(NNC(=O)C1CCN(S(=O)(=O)c2ccccc2)CC1)c1ccc2c(c1)OCO2	26963210	YSDJQRYGTCLOTJ-UHFFFAOYSA-N	431.470	1.277	50	20	IDGD	
COC(=O)c1cccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1	46903916	HLBYNIHQATWZJF-UHFFFAOYSA-N	431.470	1.333	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NCc1ccnc(OCC(F)(F)F)c1	725874392	ZRSWPPAHVVCFII-UHFFFAOYSA-N	431.396	1.345	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)c1cccc(S(=O)(=O)N(C)C)c1	727609724	NNRZXNSHOHRKGB-LBPRGKRZSA-N	435.462	1.550	50	20	IDGD	
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC[C@H](C(=O)NNC(=O)CCc2ccccc2)C1	728209927	JDIOHLRXNBEEDA-KRWDZBQOSA-N	433.534	1.207	50	20	IDGD	
O=C(NNC(=O)c1cccc(OC(F)F)c1)c1ccc(N2CCCS2(=O)=O)cc1	728487103	SRRPUKZOTIGPCQ-UHFFFAOYSA-N	425.413	1.903	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NCCOc2ccc(S(C)(=O)=O)cc2)cc1C	730066700	NYZQOKAQSPBGSJ-UHFFFAOYSA-N	435.502	1.495	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)c1ccc(I)c(F)c1	730779861	KXIHJJYCZDDAFP-UHFFFAOYSA-N	430.173	1.976	50	20	IDGD	
COc1cc2c(cc1OC)CN(C(=O)CCCNC(=O)NNC(=O)CC(F)(F)F)CC2	731118880	IRZZOJAERZOJHQ-UHFFFAOYSA-N	446.426	1.652	50	20	IDGD	
O=C(Cc1ccc2ccccc2c1)NNC(=O)NCCS(=O)(=O)NC[C@@H]1CCCCO1	732473800	BNMOCRQACXVWDP-IBGZPJMESA-N	448.545	1.201	50	20	IDGD	
CN1CCN(C)[C@H](CNC(=O)NNC(=O)COc2ccccc2Cc2ccccc2)C1	732474318	ACOKIIKTGMGHER-HXUWFJFHSA-N	425.533	1.232	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)N[C@@H]1CCN(c2ccccc2C(N)=O)C1	732595555	RUTCZYNIFYEDCM-DZGCQCFKSA-N	429.452	1.301	50	20	IDGD	
Cn1nnnc1SCCC(=O)NNc1cc(C(F)(F)F)nc(-c2ccccn2)n1	734259533	RWKHXKUXSCWGDM-UHFFFAOYSA-N	425.400	1.706	50	20	IDGD	
COc1ccc(S(=O)(=O)C[C@@H](C)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1	734990408	IXSGVYAECKMNDV-FZKQIMNGSA-N	434.470	1.092	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)CN2C(=O)c3ccccc3C2=O)cc1C	736743976	UBLAEGHARHAAQT-UHFFFAOYSA-N	429.454	1.219	50	20	IDGD	
COc1cc(C=NNC(=O)COCc2ccccc2)ccc1OCC(=O)N1CCOCC1	737438845	LLFVHQOOYMYLQU-UHFFFAOYSA-N	441.484	1.600	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)NC[C@@H](c1cccc(F)c1)N1CCOCC1	738458550	AWFFSCZODBFKJI-FQEVSTJZSA-N	430.480	1.746	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NCCNc2nccc(C(F)(F)F)n2)cc1C	739045894	PSNYADGKWQLNRG-UHFFFAOYSA-N	426.399	1.934	50	20	IDGD	
COc1cc(CCNC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)ccc1C	741265152	BNVLUIOABKCTGG-UHFFFAOYSA-N	433.534	1.792	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNS(=O)(=O)c2cc(F)c(F)c(F)c2)ccc1Cl	741646964	LQSNPGZFJFWRQA-UHFFFAOYSA-N	443.812	1.028	50	20	IDGD	
CC(C)c1nc(C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)nn1-c1ccccc1F	742077583	YASBTJLBYATONX-UHFFFAOYSA-N	449.487	1.999	50	20	IDGD	
Cc1cc(S(=O)(=O)NNC(=O)c2cccc(Br)c2)ccc1OCC(=O)O	743264225	RWOBTVRHQWCGJZ-UHFFFAOYSA-N	443.275	1.844	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)c1ccc(-n2cncn2)cc1	743506059	JWDJZPOBJJXAIM-ZDUSSCGKSA-N	443.489	1.768	50	20	IDGD	
CN(CCN1CCN(CC(=O)NNC(=O)c2cccc(C#N)c2)CC1)Cc1ccccc1	744399162	YIOXRKALJCFAHA-UHFFFAOYSA-N	434.544	1.069	50	20	IDGD	
COc1cc(NC(C)=O)c(C(=O)OCC(=O)NNC(=O)c2cccc(C)c2)cc1OC	744460093	PNRQNIRTUWVAEL-UHFFFAOYSA-N	429.429	1.589	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)C[C@@H](C)S(=O)(=O)c2ccc(F)cc2)c1	744957647	MREQNOVNMPTGLE-CQSZACIVSA-N	436.461	1.691	50	20	IDGD	
CC[C@@H](NC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)c1ccncc1	745837073	WWDNAMRLCQPDJM-GOSISDBHSA-N	431.518	1.961	50	20	IDGD	
Cc1ccc(N2CC[C@@H](NC(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)C2=O)cc1	745857774	JPBHHUHHQQFEDY-QGZVFWFLSA-N	430.486	1.148	50	20	IDGD	
C[C@@H]1OC(C)(C)N(C(=O)OC(C)(C)C)[C@H]1C(=O)NNC(=O)Cc1cn2ccccc2n1	746637367	MJDHDTGHOCNIEF-SUMWQHHRSA-N	431.493	1.785	50	20	IDGD	
COc1cc(C)nc(NNC(=O)NCc2ccc(C(=O)N3C[C@H](C)O[C@H](C)C3)cc2)n1	746757300	OALWPLMHQDZKKG-GASCZTMLSA-N	428.493	1.869	50	20	IDGD	
N#Cc1ccc(NNC(=O)[C@@H]2CC(=O)N(CCN3CCOCC3)C2)cc1C(F)(F)F	746895018	ASFQXYBHZXJPDN-CQSZACIVSA-N	425.411	1.201	50	20	IDGD	
COc1ccc(Br)c(S(=O)(=O)NNC(=O)c2ccc3c(c2)OCO3)c1	747596985	UVZCBHTWECQBSP-UHFFFAOYSA-N	429.248	1.810	50	20	IDGD	
Cc1ccc(C)c(N2C(=O)c3ccc(C(=O)NNC(=O)C(=O)N4CCCC4)cc3C2=O)c1	748246637	FIMDCJLCODUYMU-UHFFFAOYSA-N	434.452	1.487	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)c1cc(S(=O)(=O)N2CCC2)ccc1Cl	748721080	JTEUOXRVKLXNRT-UHFFFAOYSA-N	447.904	1.386	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCC(C)(C)S(C)(=O)=O)ccc1OCCC(C)C	748972140	ZJKXVCNUIHWYAK-UHFFFAOYSA-N	429.539	1.887	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CC[C@H](N(C)C(=O)OC(C)(C)C)C2)cc1OC	749853949	VUBKSOPVOFTCQT-HNNXBMFYSA-N	436.509	1.406	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2ccc3c(c2)NC(=O)[C@H](C)N3C)c2ccccc2c1=O	749865331	IZTDZKCPYOHMKP-LBPRGKRZSA-N	434.456	1.268	50	20	IDGD	
O=C(COC(=O)[C@@H]1CCCN1Cc1ccc(F)cc1)NNC(=O)c1ccc([N+](=O)[O-])cc1	750501017	FBYFCNXAVJDZBZ-SFHVURJKSA-N	444.419	1.703	50	20	IDGD	
Cc1c(C(=O)NNC(=O)CO)nnn1-c1cccc2c1CCN(Cc1ccccc1F)C2	753440536	UBMHAAKLNCBVLY-UHFFFAOYSA-N	438.463	1.026	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCc2ccc(C(N)=O)nc2)ccc1OCCC(C)C	753953374	KAIYVVLKIHFYEY-UHFFFAOYSA-N	429.477	1.758	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)CCc2cccc([N+](=O)[O-])c2)cc1	755041290	PUUWJYLELDOXPW-UHFFFAOYSA-N	434.474	1.304	50	20	IDGD	
CCOc1ccc(NC(=O)NNC(=O)c2cnccn2)cc1S(=O)(=O)N(CC)CC	755449175	BQXQHSSRNCGNPJ-UHFFFAOYSA-N	436.494	1.372	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(C(=O)NNc2ccccc2S(=O)(=O)NC(C)(C)C)co1	756013031	SEUTXWYYGPKIKZ-UHFFFAOYSA-N	444.535	1.364	50	20	IDGD	
COCCOc1ccc(NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1F	756204691	YUSDOBASENSQMU-UHFFFAOYSA-N	432.456	1.710	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)Nc1ccc(C(=O)NCc2ccccc2)cc1	756206650	ZVQWTANHHWRMBY-MRXNPFEDSA-N	430.486	1.204	50	20	IDGD	
COCCn1ncc2ccc(NC(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)cc21	756270192	NRGUEATVXBFQAV-UHFFFAOYSA-N	431.474	1.553	50	20	IDGD	
O=C(NCc1ccco1)Nc1ccc(NC(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)cc1	756611425	VRENSQBPCPIOAW-LBPRGKRZSA-N	435.462	1.189	50	20	IDGD	
CS(=O)(=O)CCn1ccc(NC(=O)NNC(=O)c2cc3c(s2)CCCCC3)n1	756763335	ZELBWRIJMUKBNP-UHFFFAOYSA-N	425.536	1.725	50	20	IDGD	
CCOC(=O)c1cnc(C)c(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1	757810232	JGQJPLLKVADWCO-UHFFFAOYSA-N	449.489	1.284	50	20	IDGD	
Cc1nnc([C@H](C)NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)s1	760140552	BWVVTTUXYXJKBA-NSHDSACASA-N	438.535	1.336	50	20	IDGD	
CCS(=O)(=O)c1cccc(S(=O)(=O)NNC(=O)c2cc(C)nc3ccccc23)c1	760334544	INFJQWRCGVPIHL-UHFFFAOYSA-N	433.511	1.960	50	20	IDGD	
O=C(NNc1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(CN2C(=O)CCCC2=O)cc1	761071039	IYICHEJRSQNYMN-UHFFFAOYSA-N	425.401	1.716	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)c1ccc(C[C@H]2CC(=O)NC2=O)cc1	762370267	IWKFTSXEWYUMAB-HNNXBMFYSA-N	427.482	1.454	50	20	IDGD	
CCS(=O)(=O)c1ccccc1C(=O)NNC(=O)c1cc(-c2ccccc2OC)[nH]n1	763156255	YRZHMMMEXIMYEH-UHFFFAOYSA-N	428.470	1.954	50	20	IDGD	
C#Cc1cccc(NC(=O)C(=O)NNC(=O)c2cccc(S(=O)(=O)N(CC)CC)c2)c1	763509366	TVEFZIZSRHKFNQ-UHFFFAOYSA-N	442.497	1.098	50	20	IDGD	
C[C@H]1Oc2ccc(NC(=O)C(=O)NNC(=O)c3cc4ccccc4cc3O)cc2NC1=O	763521047	AYLDPTJMKVNSOK-LLVKDONJSA-N	434.408	1.665	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)[nH]n1)C(=O)Nc1cccc(C(=O)NC2CC2)c1	763614692	VWLVFNBIGALPRE-UHFFFAOYSA-N	432.440	1.369	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)C(=O)N(C)C3=O)c2ccccc2n1	763617364	YVYBUKMTNGWYPN-UHFFFAOYSA-N	431.408	1.169	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccccc1O[C@H]1CCOC1	763712199	OFMLTDNFFQDEOL-INIZCTEOSA-N	427.457	1.582	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)C(=O)Nc1ccc(OC2CCC2)c(F)c1	763803258	FYJRQXVQQPCYGC-UHFFFAOYSA-N	446.391	1.830	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cc(Cl)ccc2C(=O)N(C)C)cc1	763820881	LKEXIGHTYRYMFX-UHFFFAOYSA-N	432.864	1.515	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1cccc(Cn2cccn2)c1	763855693	AMXHNFQHEXBQSB-CQSZACIVSA-N	425.420	1.624	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(OC)ccc2OC)cc1OC	763911951	UMDIJAOIGWPJLS-UHFFFAOYSA-N	431.445	1.901	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)Cc2ccc(Cl)cc2)ccc1N1CCCC1=O	763937147	XPESOSNJEMTRQY-UHFFFAOYSA-N	444.875	1.804	50	20	IDGD	
CC(C)OCc1ccc(NC(=O)C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc1	763947903	DXWBVGKDHKLSBY-UHFFFAOYSA-N	437.456	1.903	50	20	IDGD	
COC(=O)c1cc(N2CCOCC2)ccc1NC(=O)C(=O)NNC(=O)c1ccccc1C	763962201	NIUBRKDRZVQWPO-UHFFFAOYSA-N	440.456	1.018	50	20	IDGD	
COc1cccc(Cn2ccc3ccc(NC(=O)C(=O)NNC(=O)c4cnccn4)cc32)c1	764025470	VXXAMXLTZNGQBJ-UHFFFAOYSA-N	444.451	1.888	50	20	IDGD	
O=C(CC(F)(F)F)NNC(=O)C(=O)Nc1cccc(OCC(=O)Nc2ccccc2)c1	764115130	NXYYMKPRSROGMV-UHFFFAOYSA-N	438.362	1.742	50	20	IDGD	
C[C@H]1COCCN1c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)cc1	764116825	HYQNPHDENXEHCA-LBPRGKRZSA-N	432.864	1.670	50	20	IDGD	
CCn1c(=O)c(=O)[nH]c2cc(C(=O)NNc3c(F)cc(C(=O)NC4CC4)cc3F)ccc21	764334371	RHCABATWYUACAH-UHFFFAOYSA-N	443.410	1.637	50	20	IDGD	
Cc1nc(-c2ccc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc3ccccc3)cc2)n[nH]1	764380086	OGKJTYAJZBKZSV-UHFFFAOYSA-N	430.371	1.538	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)CCc3c(C)nc(C)nc3O)n[nH]2)cc1OC	765596847	NIRKLWHQWSSJNG-UHFFFAOYSA-N	440.460	1.600	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)C3CCN(C(=O)C(C)C)CC3)n[nH]2)cc1OC	765598936	MSBBPENUFWXJMF-UHFFFAOYSA-N	443.504	1.750	50	20	IDGD	
CCO[C@H](C)c1ncc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)s1	765736171	PIGYOMFQMKLIBU-OAHLLOKOSA-N	445.545	1.460	50	20	IDGD	
CCOC(=O)c1cnn(-c2cccc(NC(=O)C(=O)NNc3nccnc3OC)c2)c1C	766260213	BMHWUHIVXCJUCQ-UHFFFAOYSA-N	439.432	1.238	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CC(=O)N(c2ccc(Cl)c(F)c2)C1)c1ccc(-n2cnnn2)cc1	766757104	GGADEZZNQMOXSA-GFCCVEGCSA-N	443.826	1.269	50	20	IDGD	
Cc1oc2ccccc2c1CC(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	767246673	FRPSGNFSBKPOOU-UHFFFAOYSA-N	434.496	1.889	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)[C@H]2CCCN(C(=O)NCC(C)C)C2)n[nH]1	768280786	CXUBWRKPPQWTAK-HNNXBMFYSA-N	442.520	1.924	50	20	IDGD	
COC[C@@H](C)n1c(C)cc(/C=C(\C#N)C(=O)N2CCC(C(=O)NCCCO)CC2)c1C	769332461	AWYIFSMORFHAPQ-VYVDHXHBSA-N	430.549	1.957	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCC(O)(Cc3cccc(F)c3)CC2)cc1OC	770702773	UOOSENSWVMKWPB-UHFFFAOYSA-N	445.491	1.674	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)[C@@H]3CCCN(C(=O)N4CCCC4)C3)nc21	770969089	ROOORERAYJDSMM-CYBMUJFWSA-N	430.513	1.658	50	20	IDGD	
O=C(CN1C(=O)[C@H]2CCCC[C@@H]2C1=O)NNC(=S)Nc1cccc(Br)c1	770993531	QEWIIQSCSAXDCB-STQMWFEESA-N	439.335	1.942	50	20	IDGD	
C[C@@]1(c2ccc(F)c(Cl)c2)NC(=O)N(CC(=O)NNc2ccc(Cl)nn2)C1=O	771734674	HCJMFMRSTILQQC-INIZCTEOSA-N	427.223	1.833	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)[C@]1(F)CCN(C(=O)OCc2ccccc2)C1	772241647	RMGLBNQWLDCLKP-BTYIYWSLSA-N	437.468	1.862	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)CN1C(=O)c2ccccc2S1(=O)=O	772973120	ZTEFSIPUZQDHIB-NSHDSACASA-N	437.861	1.099	50	20	IDGD	
Cn1cnc(-c2ccc(C(=O)NNC(=O)[C@@H]3CCCN(C(=O)OC(C)(C)C)C3)cc2)n1	773410586	DPDJFXLJBYVUAX-MRXNPFEDSA-N	428.493	1.890	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc(Br)cn3)n[nH]2)cc1	773540019	FCVPASUAERBTDI-UHFFFAOYSA-N	443.261	1.942	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)c2cnc(C3OCCO3)s2)c2ccccc2c1=O	774322749	OBBCWFQDXXQUOL-UHFFFAOYSA-N	429.458	1.554	50	20	IDGD	
C#C[C@@H](NC(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12)[C@@H]1CCCO1	776230229	KFIVPSWFYKXZLG-UXHICEINSA-N	445.479	1.570	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)Nc2ccc(NC(=O)CN3CCOCC3)cc2)c1	776466886	YTUJFHWHJFLWBN-UHFFFAOYSA-N	447.517	1.509	50	20	IDGD	
COc1ccc(NNC(=O)NCc2cccc(NC(=O)CCN3CCOCC3)c2)nc1	780963956	MNQQWEFXJRTMQZ-UHFFFAOYSA-N	428.493	1.577	50	20	IDGD	
Cc1ccc(-n2nc(C(C)(C)C)cc2NC(=O)C(=O)NNC(=O)C(=O)NC2CC2)c(C)c1	782965719	IAYOPBVGVNDUIN-UHFFFAOYSA-N	440.504	1.151	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCOCC2)cc1NC(=O)C(=O)NNc1cccc(F)c1	783037237	LESPZKUQLRXVSH-UHFFFAOYSA-N	436.465	1.237	50	20	IDGD	
CN(C)C1CCN(c2ccc(NC(=O)C(=O)NNc3ccc(Cl)nn3)cc2F)CC1	784792154	FQZSESOFOFYLTF-UHFFFAOYSA-N	435.891	1.881	50	20	IDGD	
CC(C)(C)n1cc(C#N)c(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)n1	784834929	CGXGCIYMHISFST-UHFFFAOYSA-N	440.432	1.588	50	20	IDGD	
CCN1CCN(c2ccc(NC(=O)C(=O)NNc3cccc(S(C)(=O)=O)c3)cc2)CC1	784841374	GNBNCEOZHVZRMC-UHFFFAOYSA-N	445.545	1.314	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2cc(Cl)ccn2)cc1-n1nnnc1C1CC1	784856617	OTWHJJYEXFKSMP-UHFFFAOYSA-N	428.840	1.679	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)n1	785235832	SJNCXIBKVUNJND-UHFFFAOYSA-N	439.379	1.914	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)N[C@@H]2CCCN(C3CCCCC3)C2=O)nc2ccccc21	785920255	BBWHKIIFKMKMFT-QGZVFWFLSA-N	426.521	1.770	50	20	IDGD	
COCCOc1ccc(F)cc1S(=O)(=O)NNC(=O)c1cc(OC)cc(OC)c1	786724142	LLYDSATZDITXMB-UHFFFAOYSA-N	428.438	1.491	50	20	IDGD	
Cc1cn(-c2c(F)cccc2F)nc1C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	786762702	ORGHOVFEWPPHNY-UHFFFAOYSA-N	434.424	1.937	50	20	IDGD	
CCc1c(C(=O)OCC(=O)NNC(=O)c2cccs2)nnn1Cc1ccc(F)cc1	787166113	MRHNLRPSTYQCRT-UHFFFAOYSA-N	431.449	1.707	50	20	IDGD	
Cn1nc(-c2ccc(Cl)s2)cc1NC(=O)C(=O)NNc1ccc(-n2cccn2)nn1	787561149	VTSUKOKXYVESMM-UHFFFAOYSA-N	443.880	1.860	50	20	IDGD	
CN1CCN(C(=O)NNC(=O)C2CCN(c3ncc(C(F)(F)F)cc3Cl)CC2)CC1	788164502	BJMAGFFVYFDNQT-UHFFFAOYSA-N	448.877	1.958	50	20	IDGD	
COc1nc(Br)ccc1NC(=O)C(=O)NNC(=O)Cc1ccc(F)cc1	789584876	STKGQBYKRJGEQW-UHFFFAOYSA-N	425.214	1.320	50	20	IDGD	
C[C@@]12CCN(C(=O)NNC(=O)c3csc(N4CCOCC4)n3)C[C@H]1C2(Cl)Cl	790655275	HGAFEQCXMFOXOB-IAQYHMDHSA-N	434.349	1.850	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNc2cccc(F)c2[N+](=O)[O-])cc1C	790998437	MSZMYYWWCMPNEU-UHFFFAOYSA-N	439.425	1.886	50	20	IDGD	
O=C(NNc1cccc(F)c1[N+](=O)[O-])[C@@H]1CCCC[C@H]1C(=O)N[C@@H]1CCS(=O)(=O)C1	791150288	LLVKJQGTMXDIFZ-JHJVBQTASA-N	442.469	1.287	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(Cl)cc(C(N)=O)c1OC	793023716	UPSUMJPYGDBNEC-UHFFFAOYSA-N	448.863	1.175	50	20	IDGD	
Cc1cc(C(=O)O)cc(S(=O)(=O)NNC(=O)CNC(=O)OCc2ccccc2)c1F	794596570	IXVYNKQKSFEIOE-UHFFFAOYSA-N	439.421	1.068	50	20	IDGD	
COC(=O)c1cc(F)cc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c1F	797007818	SMCZOMARLLCPKB-UHFFFAOYSA-N	443.366	1.337	50	20	IDGD	
CCN(CC)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cccc(C)n2)cc1Cl	797370478	MZJOVSLOJKIZMJ-UHFFFAOYSA-N	431.880	1.925	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)N3CCSCC3)cc2C)n1	797370834	VPTMAJMBLJGEBK-UHFFFAOYSA-N	441.513	1.287	50	20	IDGD	
COC(=O)c1ccc(NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1OC	797672264	DISRHLVKBKRYSG-UHFFFAOYSA-N	425.401	1.195	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CSCc2cc(=O)n3ccsc3n2)cc1C	798310858	XHPBQSCGXYZGNZ-UHFFFAOYSA-N	445.526	1.392	50	20	IDGD	
NS(=O)(=O)c1ccc(F)c(C(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)c1	798334303	ADSKCIWTUHVQNL-UHFFFAOYSA-N	441.384	1.524	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)[C@H](OC)c2cnn(C)c2)c2ccccc2c1=O	798830396	QWSKLQSBBQXHEQ-GOSISDBHSA-N	426.477	1.469	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCOCC3)cc2)cc1	802054763	QBWRMDPDIMZRPU-UHFFFAOYSA-N	434.474	1.183	50	20	IDGD	
CC(C)[C@@H](C(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)N1C[C@H](C)O[C@H](C)C1	802067757	ZFHUGSLQAXCNGU-VBQJREDUSA-N	426.539	1.377	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)NC[C@@H]2CC(c3ccc(OC)c(F)c3)=NO2)c1	802349349	ISBZZPZRGOXNHX-INIZCTEOSA-N	446.435	1.989	50	20	IDGD	
COc1cc(C(=O)NNc2ccc3c(=O)[nH]ccc3c2)cc(NS(C)(=O)=O)c1OC	803437829	ZUVOXWVESKQZGA-UHFFFAOYSA-N	432.458	1.674	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)Nc2cccc(C(=O)N(C)CC(N)=O)c2)c1C	803705752	NIVUPDFJCFSTAP-YBFXNURJSA-N	437.500	1.854	50	20	IDGD	
O=C(NNc1ncccc1F)c1cc(I)ccc1-n1cnnn1	804211761	VBWQZCAZHPBWBX-UHFFFAOYSA-N	425.165	1.558	50	20	IDGD	
C[S@](=O)Cc1ccc(CNC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc1	805867966	VQKLKOZPEOMWIW-PMERELPUSA-N	427.486	1.601	50	20	IDGD	
O=C1COC[C@@H](C[C@@H]2CN(C(=O)C(=O)NNc3ccc(Cl)cc3)c3ccccc32)N1	806997378	MEADSNYJRUQNFR-CZUORRHYSA-N	428.876	1.819	50	20	IDGD	
Cc1nn(C)cc1S(=O)(=O)NC(=O)/C(C#N)=C/c1cc(C)n(C[C@H]2CCCO2)c1C	809034156	RPTNUUXTPKKJEE-JIARHERNSA-N	431.518	1.738	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2ccc3c(C)nn(C)c3c2)n[nH]1	812980704	WNJTXOSBVRKMQY-UHFFFAOYSA-N	447.455	1.680	50	20	IDGD	
CS(=O)(=O)c1ccc(NNC(=O)C2(S(=O)(=O)c3ccccc3)CCOCC2)cc1	813494221	CFUSXKVYWPYDOM-UHFFFAOYSA-N	438.527	1.556	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)CN3C(=O)C(F)(F)Oc4ccccc43)nc21	815555330	WJVSNNVAMSLLDC-UHFFFAOYSA-N	447.402	1.748	50	20	IDGD	
O=C(NNc1cccc(F)c1F)C(=O)Nc1cccc(S(=O)(=O)C2CCOCC2)c1	815606357	UZAQGYMMYCCDON-UHFFFAOYSA-N	439.440	1.999	50	20	IDGD	
Cc1cc(-c2ncccc2NC(=O)C(=O)NNC(=O)[C@H]2CCc3nncn3C2)cs1	815691955	GKVBHTISDKPPTG-LBPRGKRZSA-N	425.474	1.059	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2cccc(Cl)n2)cc1OCC(=O)NC1CC1	815725847	CZVWZAIJJZIIJU-UHFFFAOYSA-N	433.852	1.483	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2cc(C(=O)NNc3ncncc3F)ccc2Cl)C[C@@H](C)O1	817067743	POYCPMVATMOBLN-PHIMTYICSA-N	443.888	1.824	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)[C@H](O)[C@H](O)c2nc3ccccc3[nH]2)c1	818751013	VGXCCVOIJXHAKI-LSDHHAIUSA-N	449.261	1.650	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)CN2C(=O)N[C@]3(C[C@@H](C)CC(C)(C)C3)C2=O)cc1	913429553	HZVANAOOGPMZQD-FPTDNZKUSA-N	445.520	1.391	50	20	IDGD	
COc1ccc(-c2nn(CCC#N)cc2/C=C(\C#N)C(=O)NCC(=O)N(C)C)cc1OC	914464844	YHIDWONXSXVVDL-MHWRWJLKSA-N	436.472	1.592	50	20	IDGD	
CS(=O)(=O)c1ccc(Cl)c(S(=O)(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c1	914562846	JOWHKOJOTNIHDC-UHFFFAOYSA-N	433.851	1.275	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)CCc1c(C)c2c(C)nn(C)c2[nH]c1=O	914688289	VACHNPDNKUEBPE-UHFFFAOYSA-N	441.488	1.436	50	20	IDGD	
O=C(NC[C@@H](c1cccs1)N1CCOCC1)NNC(=O)c1ccc2c(c1)OCCO2	915893104	CIUYWVWXZYJHGZ-HNNXBMFYSA-N	432.502	1.537	50	20	IDGD	
CCN(CC)[C@H](CNC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)c1ccccc1	915901184	AAUSJSJINOHVML-LJQANCHMSA-N	436.516	1.961	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)NC[C@H](c1cccs1)N1CCN(C)CC1	915902137	QDRZQQFNTMLXCG-DOTOQJQBSA-N	449.552	1.974	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)NCCCN2CCCCCC2=O)c2ccccc2c1=O	915905688	UCUMSEBXMXSRDU-UHFFFAOYSA-N	442.520	1.714	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)N[C@H](c3ccccc3)C3CC3)nc2)CC1	916231137	GXIULVDXGZWOGL-HXUWFJFHSA-N	444.561	1.795	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)NCC2(NS(C)(=O)=O)CCCCC2)c1	916253937	TZTWBUBIGYJWJW-UHFFFAOYSA-N	426.539	1.265	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCCCN2C[C@@H](C)C[C@@H](C)C2)nc1	916460617	OEJHLJIGIJSDAW-IYBDPMFKSA-N	426.587	1.762	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)CCNC(=O)c2cccs2)cc1	916703060	OXHIHQKUGUJAGI-UHFFFAOYSA-N	444.542	1.750	50	20	IDGD	
O=C(NNC(=O)c1ccc(F)cc1Br)c1ccc(CN2C(=O)CNC2=O)cc1	918340649	XKTWGGBQLHKFTM-UHFFFAOYSA-N	449.236	1.715	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)[C@@H]1CCCCN1S(=O)(=O)c1cccs1	919822427	UEJDYDZWMXLCKT-HNNXBMFYSA-N	437.543	1.690	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N[C@@H](C)Cn2ccnc2)cc1	920850654	CIXFYOHNSJJISP-GYKGCMEESA-N	447.499	1.742	50	20	IDGD	
O=C(CCNS(=O)(=O)c1cccc(Cl)c1)NNC(=O)NCCc1cccs1	920889293	RNYKGBWUIWGTOM-UHFFFAOYSA-N	430.939	1.643	50	20	IDGD	
O=C(NN=Cc1cc(Br)c2c(c1)OCCCO2)N[C@@H]1CCS(=O)(=O)C1	921260297	WOIJIBKKZYBEGE-LLVKDONJSA-N	432.296	1.431	50	20	IDGD	
N#CCCn1cc(/C=C(\C#N)C(=O)NS(=O)(=O)C2CCOCC2)c(-c2ccccc2)n1	1115912306	QPXVZMQZYZGKHV-GHRIWEEISA-N	439.497	1.996	50	20	IDGD	
CS(=O)(=O)C[C@H](NC(=O)NNC(=O)c1cncn1-c1ccccc1)c1ccccc1	1254128808	BSSKBYRVXWAQJV-KRWDZBQOSA-N	427.486	1.602	50	20	IDGD	
O=C(/C=C\c1ccc(I)o1)NNC(=O)c1n[nH]c2c1CCCC2	1261893485	SCGLFGGUDHHOKO-VURMDHGXSA-N	426.214	1.961	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN1C(=O)OCC(F)(F)F)c1cncn1-c1ccccc1	1318213318	ALKAOEZVWFCHLC-CYBMUJFWSA-N	425.367	1.797	50	20	IDGD	
Cc1ncc2c(n1)CC[C@@H](NC(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1)C2	1318917157	AQJWMGILUCCWIC-MRXNPFEDSA-N	432.525	1.620	50	20	IDGD	
Cc1c([C@@H](C)NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)cnn1C	1323297873	RGJWSPZTQVXUFU-CQSZACIVSA-N	448.549	1.608	50	20	IDGD	
O=C(NCc1ccncc1OC[C@@H]1CCOC1)NNC(=O)c1cncn1-c1ccccc1	1323460222	FIJVCMGSLIOGGG-MRXNPFEDSA-N	436.472	1.827	50	20	IDGD	
COc1ccc(S(=O)(=O)NCC(=O)NNc2cncc(Br)c2)cc1OC	1324192103	HSIVHHIOHREHOW-UHFFFAOYSA-N	445.295	1.283	50	20	IDGD	
CCCCS(=O)(=O)N1CCC(C(=O)NNC(=O)c2cncn2-c2ccccc2)CC1	1337476681	YJAFUSGVTZGZHT-UHFFFAOYSA-N	433.534	1.475	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4c(cnn4C)c3)C2)C1	1778025393	ZGBXZDPRDJORDT-DJJJIMSYSA-N	435.322	1.800	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)/C=N/O[C@H]3CCCCO3)C2)C1	1779098281	FXGHOPSSEHMAAZ-HMUFYHRRSA-N	446.342	1.376	50	20	IDGD	
CN1Cc2ccccc2C[C@H]1C(=O)N1CCO[C@]2(CCN(C(=O)CO[Si](C)(C)C)C2)C1	1779294328	NYWVTBQVLAQZLV-REWPJTCUSA-N	445.636	1.725	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc[n+]([O-])cc2)C1	1779945724	KJYDUEPFGVFWFE-JCKWVBRZSA-N	426.311	1.231	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(=O)ccn2C)C1	1780059775	QMKCZBRLJCZOAW-URKNILKWSA-N	440.338	1.296	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc3ncccc3[nH]2)C1	1781211915	AVHKNBDARABXNQ-FIKMYACPSA-N	434.924	1.944	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)ncc1[N+](=O)[O-]	1781329900	NFYKCPPUXBURRT-CZUORRHYSA-N	445.245	1.432	50	20	IDGD	
O=C(CC12CCCN1CCC2)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781333014	CUHZAJAYSJNPLZ-QAPCUYQASA-N	432.334	1.525	50	20	IDGD	
Cc1nccn1CC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)Br)C2	1781559773	YGWCPXQUMRMUGZ-DDUZABMNSA-N	427.343	1.489	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)n1ccnc1)C2	1781997142	GGIFTCSFWVNNRH-ATNYBXOESA-N	427.343	1.741	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCCn1ccnc1C)C2	1782179145	SXENVKWDSDTFPG-WAOWUJCRSA-N	440.972	1.739	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)nc2nccn12	1782352728	HCDBXGYLXVYOKP-FQEVSTJZSA-N	431.569	1.333	50	20	IDGD	
COC[C@@H](C)C(=O)N1CCO[C@]2(CCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1	1782862115	PBUOARQMYOGNME-SEVXFQSKSA-N	433.455	1.984	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cccn4cncc34)CCO2)C1	1783349440	LVHQROCNBJEHQI-DNVCBOLYSA-N	435.322	1.951	50	20	IDGD	
CCOc1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](C)Br)C3)C2)nn1	1783535669	BKGAGPLPTFLQNK-SJKOYZFVSA-N	427.299	1.102	50	20	IDGD	
CC(C)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3Cc4ccccc4CN3)C[C@@H]21	1783850120	BVLUEJQJTWJICN-HAGHYFMRSA-N	433.980	1.946	50	20	IDGD	
O=C(c1ccc2nc(CO)[nH]c2c1)N1CCO[C@@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783947888	LAHFZUADJAXFOX-GOSISDBHSA-N	427.288	1.302	50	20	IDGD	
O=C(CCC(=O)N1CCCC1)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21	1784998540	IUGYXKZLGMIXJE-JYJNAYRXSA-N	444.370	1.154	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(F)(F)F)[C@H]2C1	1786005244	WPXNWXBFKWKAFH-MZGVZZPPSA-N	449.857	1.948	50	20	IDGD	
O=C(Cc1cncnc1)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1	1786934768	SAMBJQKWMZWHMF-UHFFFAOYSA-N	430.273	1.147	50	20	IDGD	
COc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)Br)C[C@@H]32)nc1	1787760988	HFWOXZUSRWSZQW-DUPGQFARSA-N	426.311	1.467	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccnc(Cl)n3)[C@H]2C1	1788876099	NGEUYJWUGUUWDJ-BTIUKSQHSA-N	435.739	1.960	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)n3ccnc3)C[C@@H]21	1790958165	KTMUWCFNZYKPMH-QXKUPLGCSA-N	427.343	1.597	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)n3cccc3C=O)C[C@@H]21	1791058446	YUFPPRHUEGPTLQ-JBJRXJHCSA-N	440.338	1.625	50	20	IDGD	
CC(C)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1n[nH]c3ccc(C#N)cc13)C2	1792784556	MDGXKMWSQFSAAJ-XOIINTDNSA-N	429.908	1.903	50	20	IDGD	
Cc1ccncc1CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)CBr	1792870798	VCUPBQJZMMZVEF-RMRDIRSESA-N	438.366	1.943	50	20	IDGD	
CCc1[nH]nc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](Br)CC)C3)c1F	1794514936	YPNXAZJNGIBENQ-FBKDDSFISA-N	431.306	1.488	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cocn1	1794933680	SXZORXOYDMRBRI-XFMPKHEZSA-N	442.900	1.010	50	20	IDGD	
CN(C)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCBr	1795112897	XIAWPSMEVAGCQA-FVCICTRLSA-N	425.327	1.136	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(CO)c(F)c1)C2	1795117270	XIRVAZJOCUYLIS-XOIINTDNSA-N	429.286	1.306	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc2nonc2c1	1797399570	HRSMWYDWTVDNRQ-XMOXNHLCSA-N	449.471	1.609	50	20	IDGD	
COc1ccc2cc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)CCC(=O)NN(C)C)C4)[nH]c2c1	1797432422	XJVIXBKFVLDJQF-BJWYYQGGSA-N	441.532	1.801	50	20	IDGD	
CCc1cnc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)CBr)C3)s1	1797958800	ZCGVICXYJOKXFR-FMSGJZPZSA-N	430.368	1.940	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1ccn(C(F)F)n1	1798163558	JEWPWVCQGWXXRA-OEIWMXHLSA-N	425.205	1.172	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1CCC1)C2	1798522594	BIDJOLFKTNIKNC-CCWDJLKJSA-N	431.445	1.523	50	20	IDGD	
O=C1Cc2cccc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)CCBr)C4)c2N1	1800029102	FGSGVRZYSDOVCI-FVCICTRLSA-N	436.306	1.169	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Cl)C3)CC1	1802225586	FVRFGKMKVVDZKT-FZKCQIBNSA-N	447.935	1.758	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CSc2ccncc2)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803136814	VVOKXKSHYXBVBF-VDZJLULYSA-N	434.949	1.874	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cnc3ccc(F)cn23)[C@H]1c1cccnc1)[C@@H](O)CCl	1803147441	HTHRTTKAEBZTJH-FNHZYXHNSA-N	445.882	1.788	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(N2C(=O)C=CC2=O)cc1	1803883653	GLWQSFOSDLOCSZ-BZZMCLGOSA-N	445.903	1.622	50	20	IDGD	
O=C(CCN1CCOCC1)NC[C@H]1CCN(C(=O)C(Cl)Cl)[C@@H]1c1cccnc1	1806957198	RJRYLNCBUFAKAA-NVXWUHKLSA-N	429.348	1.613	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)CNC(=O)C(F)(F)F)[C@H]1c1cccnc1	1808277307	BMRWJOMWIUEEMV-IPYPFGDCSA-N	434.846	1.783	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@H]1CCN(C(=O)c2c[nH]c(=O)cn2)[C@H]1c1cccnc1	1808304576	INSWGCNTFGQLIN-AZOIQLNYSA-N	438.315	1.721	50	20	IDGD	
Cc1nc(CC(=O)N2CC[C@H](CNC(=O)[C@H](F)Br)[C@H]2c2cccnc2)no1	1808650660	BUWVZPITLILNNS-WQVCFCJDSA-N	440.273	1.712	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)c3cccc(F)n3)CC2)C1	1809971240	MMYLTNZTNWLQGY-UHFFFAOYSA-N	425.269	1.059	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)c3cc4ncccc4[nH]3)CC2)C1	1809980178	OHJROWLYQMFRBD-UHFFFAOYSA-N	446.316	1.401	50	20	IDGD	
O=C(/C=C\C(=O)NC1CC1)NC[C@H]1CCN(C(=O)C(Cl)Cl)[C@H]1c1cccnc1	1810133689	KKAUFWXMLOTXTN-FULAONPOSA-N	425.316	1.726	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H](CNC(=O)CCn2cncn2)[C@H]1c1cccnc1	1813316865	YDCUVXRHAVFPGN-QGPMSJSTSA-N	449.353	1.800	50	20	IDGD	
Cc1cc(C(=O)N[C@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)c(C)o1	1815339821	QLVVTYJWZXGDHX-HNNXBMFYSA-N	439.302	1.572	50	20	IDGD	
CCc1[nH]nc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@@H](O)CCl)CC3)c1Cl	1815804660	JJKKVHUAZFJPQO-XVKPBYJWSA-N	432.333	1.908	50	20	IDGD	
Cc1cc(C)nc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)CCC(=O)NN(C)C)CC3)c1	1815958019	FUBYDWPBNUAYNP-CQSZACIVSA-N	444.561	1.754	50	20	IDGD	
CCc1ncccc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1816162072	BWSRCKVXBCULHY-FQEVSTJZSA-N	447.304	1.667	50	20	IDGD	
COc1cccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)n1	1816268523	CUWNAPPLOVJCCM-SFHVURJKSA-N	449.276	1.113	50	20	IDGD	
CCn1nc(C)cc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCC(=O)NN(C)C)CC2	1816717230	DJSZLAUXTFEQGV-ZDUSSCGKSA-N	447.565	1.267	50	20	IDGD	
CCNC(=S)NCC(=O)N1CCCC[C@H]1c1cc(NC(=O)CCBr)n[nH]1	1816784560	KZCBNVGEJZBCDO-LBPRGKRZSA-N	445.387	1.671	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCBr)[nH]n1	1819350198	KFDFUECZPIHIRT-YPMHNXCESA-N	443.346	1.894	50	20	IDGD	
C=C(CC(=O)OCC)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](Cl)COC)CC2	1822930334	LBUFKXXOZXEVCT-NWDGAFQWSA-N	429.926	1.818	50	20	IDGD	
CCC(=O)N[C@H](C)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1	1822999029	NKEXQFMDGAOXIT-DNSOKLHBSA-N	435.319	1.660	50	20	IDGD	
CCS(=O)(=O)N[C@H](C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@H](F)Cl)CC1	1824459972	JTDHGSPIDVYHTK-SNPRPXQTSA-N	425.954	1.468	50	20	IDGD	
C[C@H](C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](F)Br)CC2)n1ccnn1	1824690755	JLVHIJJYJUYIEM-VHSKPIJISA-N	431.291	1.598	50	20	IDGD	
CC[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CN1CCOCC1)CC2	1825445403	WAOQNYZEJHBAIO-NWDGAFQWSA-N	445.383	1.561	50	20	IDGD	
O=C([C@@H](O)N1CCOCC1)N1CCC([C@@H]2CCCCN2C(=O)CCBr)CC1	1826358246	BNNLNKPXFJDPGE-QFBILLFUSA-N	446.386	1.042	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)C2CCOCC2)CC1	1826578405	DXHGHWSUCWJJNX-NRFANRHFSA-N	428.338	1.026	50	20	IDGD	
O=C([C@@H](F)Br)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)n2)CC1	1827601734	OLMROZXDJRCGNQ-TZMCWYRMSA-N	445.289	1.812	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)COc3ccccc3OC)CCO2)C1	1830229619	XZUNYFUGIUWLFK-IERDGZPVSA-N	440.924	1.548	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnn4ccccc34)C2)C1	1830362246	OXEPTGWNVZNUEE-NRFANRHFSA-N	434.924	1.669	50	20	IDGD	
C[C@H](Cc1ccc(F)cc1)C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1	1830735504	HVCZTVLLBVBYPJ-FQELHTAISA-N	442.915	1.060	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1CCc3ccoc3C1)CCO2	1830940374	KWSHOYXZEQHASY-WWMYMODYSA-N	440.924	1.095	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccn4nccc34)C2)C1	1831653529	HJKXPFDSIBUOHK-DYESRHJHSA-N	434.924	1.812	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)COC(C)(C)C)CCO2)C1	1832317247	JQEREDKTWHIGLM-KSSFIOAISA-N	435.359	1.431	50	20	IDGD	
O=C(CSc1ccncc1)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1832712620	HRLVNXLRVNITKS-QGZVFWFLSA-N	434.345	1.434	50	20	IDGD	
Cc1ccc(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)s1	1832882289	LNKFWBVAZLJABF-LPHOPBHVSA-N	430.954	1.045	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC(N2CCC(NC(=O)[C@H](O)c3ccco3)CC2)CC1	1833088343	MHAOSIFLBQWXFJ-HXUWFJFHSA-N	437.613	1.736	50	20	IDGD	
C[C@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)c3cnoc3)CC2)CC1	1833263124	BEVGZYOTDVMRBM-CYBMUJFWSA-N	427.343	1.891	50	20	IDGD	
CC(C)(C)c1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)ccn1	1833367808	GTJPYHDDWQGECG-KKSFZXQISA-N	439.940	1.049	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(O)nc(Cl)c3)CCO2)C1	1833581386	RQHZKTOLPXXEHW-FZKQIMNGSA-N	432.304	1.528	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cnnc(Cl)c3)CC2)CC1	1833892028	BSDPFFRHDVHCPV-INIZCTEOSA-N	444.363	1.569	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)Cn3ccccc3=O)CC2)CC1	1834820608	CFAZMRHNIYQYSQ-LJQANCHMSA-N	436.984	1.827	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)[C@H]3C[C@]3(F)Cl)C2)C1	1834826187	FPQAJXAWCZXQJR-KCPJHIHWSA-N	427.698	1.152	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)[C@@H]3C=CCN3)CC2)CC1	1835054480	NTPGJHKTFBDWKL-SJORKVTESA-N	427.387	1.260	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CC[C@@H](C)O1)CCO2	1836609375	OCBAZVYJJCDPOF-BASYENTBSA-N	433.343	1.184	50	20	IDGD	
O=C([C@H](O)CCl)N1CCC(OC2CCN(C(=O)[C@@H]3Cc4ccccc4O3)CC2)CC1	1836717411	WIXOMQXGZCPKRC-QUCCMNQESA-N	436.936	1.588	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3nccc(Cl)c3OC)CCO2)C1	1838727565	KDXPRSURXFCDNT-YJYMSZOUSA-N	446.331	1.831	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccc(F)c(C#N)c3)C2)C1	1839147073	GEYUMMYYBAFOOK-LAUBAEHRSA-N	437.899	1.714	50	20	IDGD	
C[C@@H](Oc1ccccc1)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1839219470	IEPLCTNFSHKPJX-KUHUBIRLSA-N	431.316	1.714	50	20	IDGD	
CCN(CC)C[C@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)CCBr)C2)C1	1839675415	CJZHKIWMTWCGIS-LPHOPBHVSA-N	448.402	1.206	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)[C@H]3[C@H]4SC=C[C@H]43)CCO2)C1	1839699816	VSHVVGBHCLSEIB-UKCJKJFHSA-N	435.373	1.554	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)C3CCC4(CC3)OCCO4)CCO2)C1	1839773787	MXRMJHRJNWCVPT-PXNSSMCTSA-N	444.956	1.394	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C=C/c3cccc(C)n3)C2)C1	1840149719	YWIDHBXYFCDGMX-DYWSFYFFSA-N	437.924	1.113	50	20	IDGD	
O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)CC[C@@H]1CCOC1)CCO2	1840587823	IHCIWXILONLJAR-QAPCUYQASA-N	433.343	1.045	50	20	IDGD	
O=C(Cc1cc(F)ccc1[N+](=O)[O-])N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1840887230	BJKHEFUJHJRXTG-WMZOPIPTSA-N	447.822	1.267	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)c2ccccc2OC(F)(F)F)C1	1841154807	ALZGFGDANHYAMU-UHFFFAOYSA-N	448.206	1.396	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1cncc3cnccc13)C2	1843416515	SOJWHRFTLVNCNZ-JFLMPSFJSA-N	445.483	1.581	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC12CN(C(=O)CCOCCOCCOC)C2	1846072609	HQUOLCBMBXFKNK-HNNXBMFYSA-N	435.359	1.433	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)C[C@H](NC(C)=O)c2cccs2)c2ccccc2c1=O	11148174	FZINDRDZICPNFE-INIZCTEOSA-N	441.513	1.897	50	20	IDGD	
CCOc1ccc(OC(C)(C)C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1	24932747	OYHCMXNKLMIERB-UHFFFAOYSA-N	449.529	1.954	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)c2cn(Cc3ccccc3)nn2)c2ccccc2c1=O	26228956	OGYFPILXSOHADZ-UHFFFAOYSA-N	431.456	1.692	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)[C@H]1CCCN1S(=O)(=O)c1cccs1	109905543	OZHAEYWCLKGEFS-SWLSCSKDSA-N	441.506	1.655	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2cc(-c3ccccc3)on2)c1	726852307	MKHBECPOXSMSFC-UHFFFAOYSA-N	443.485	1.736	50	20	IDGD	
CCOc1ccc(OCC)c(NC(=S)NNC(=O)CNC(=O)NCc2ccco2)c1	727492762	YMOPQXPCPMZEOZ-UHFFFAOYSA-N	435.506	1.894	50	20	IDGD	
COc1ccc([C@@]2(C)NC(=O)N(CC(=O)NNc3nc(-c4cccnc4)no3)C2=O)cc1	728075934	SIACXDMQFQKUGE-HXUWFJFHSA-N	437.416	1.051	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NN=C1C(=O)N(Cc2ccccc2Cl)c2ccccc21	728435546	DXZVDRJWTNLESG-GFCCVEGCSA-N	434.905	1.645	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)C2(c3cccc(F)c3)CCOCC2)n1	728729078	GYBKOVVJCWCHIW-UHFFFAOYSA-N	435.477	1.572	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1	728846203	UMGMPMVBONJZCV-UHFFFAOYSA-N	436.432	1.248	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)NCC2CCN(S(=O)(=O)c3ccccc3)CC2)c1	728951834	HENOYSYSOMLMPE-UHFFFAOYSA-N	441.513	1.603	50	20	IDGD	
O=C(CCN1C(=O)NC2(CCCC2)C1=O)NNc1ccc(S(=O)(=O)C(F)F)cc1	728974214	HQNMGXUGKAYGOK-UHFFFAOYSA-N	430.433	1.381	50	20	IDGD	
CC[C@H](NC(=O)NNC(=O)c1cc(Br)c[nH]1)c1cccc(S(N)(=O)=O)c1	729221524	RWXWFJONWXTFTJ-LBPRGKRZSA-N	444.311	1.520	50	20	IDGD	
O=C(NCCCCN1CCN(c2ncccn2)CC1)NNC(=O)c1ccc2ccccc2n1	729233785	VRNSVOMHXZZLDX-UHFFFAOYSA-N	448.531	1.571	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)Cc2csc(-c3nc[nH]n3)n2)c1	729862640	FCHGIVQJWHMCIZ-UHFFFAOYSA-N	437.279	1.703	50	20	IDGD	
O=C(Cc1cccc2ccccc12)NNC(=O)NCCS(=O)(=O)N1CCSCC1	730673428	VKVKAYKOBUTRLP-UHFFFAOYSA-N	436.559	1.091	50	20	IDGD	
Cc1c(C(=O)OCC(=O)NNC(=O)c2ccccc2)nnn1-c1ccc2ncccc2c1	731396016	WAQNBQWXVGJNFX-UHFFFAOYSA-N	430.424	1.742	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)c1ccc(S(=O)(=O)N2C[C@H](C)O[C@@H](C)C2)cc1	731491076	JZKADXLMKRVLKL-GJZGRUSLSA-N	447.513	1.568	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)CCNS(=O)(=O)c1ccc(F)c(F)c1)c1ccccc1	732132954	LPHQDEKFQZTOMZ-HNNXBMFYSA-N	425.457	1.974	50	20	IDGD	
CC(C)C[C@H](C(=O)NNc1ccccc1S(C)(=O)=O)N1C(=O)[C@@H]2CC=CC[C@H]2C1=O	732305269	GHKCKKCVYVMXQM-BFYDXBDKSA-N	433.530	1.899	50	20	IDGD	
CSCC[C@H](NC(=O)Cc1ccccc1)C(=O)NNC(=O)c1ccc2c(c1)OCO2	732749600	CFAPUQHIKWWLEL-INIZCTEOSA-N	429.498	1.657	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](NC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)C1	734173519	LYQLYBCQLFXRJM-AWEZNQCLSA-N	444.492	1.921	50	20	IDGD	
O=C(NNC(=O)N1CCC(C(F)(F)F)(C(F)(F)F)C1)c1ccc(-n2cnnn2)cc1	735328096	LPGIXVDGLTTYEH-UHFFFAOYSA-N	437.304	1.833	50	20	IDGD	
C[C@H]1[C@H](C)S(=O)(=O)CCN1C(=O)CCC(=O)C(C#N)=C1N(C)c2ccccc2N1C	736269793	GSMRTVBKZONAFN-GJZGRUSLSA-N	430.530	1.691	50	20	IDGD	
Cc1cc(NNC(=O)c2ccc(Cl)c(S(=O)(=O)NC[C@@H]3CCCO3)c2)nc(C)n1	736718419	IHPUQGMAJRQVKF-AWEZNQCLSA-N	439.925	1.961	50	20	IDGD	
N#Cc1ccc(N2C(=O)N[C@@H](CCC(=O)NNC(=O)COCc3ccccc3)C2=O)cc1	737636819	GHSXMPGXJCOMLS-SFHVURJKSA-N	435.440	1.127	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)COc1ccc(Br)cc1)CN1CCOCC1	739050249	VIQXORAWQSWNIP-CYBMUJFWSA-N	429.315	1.127	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1ccccc1CN1CCOCC1	740749355	WALQNUBPMYSMGL-UHFFFAOYSA-N	445.545	1.195	50	20	IDGD	
CC(C)NS(=O)(=O)c1c[nH]c(C(=O)NNC(=O)c2ccc(COc3ccccc3)o2)c1	741144195	KCHVRFRJNPDDFY-UHFFFAOYSA-N	446.485	1.948	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)N[C@H](C)[C@H]2CN(Cc3ccccc3)CCO2)cc1	741425198	KSJNCFSEZFXXDS-DYESRHJHSA-N	442.516	1.694	50	20	IDGD	
COc1ccc(Cc2nnc(SCC(=O)NNC(=O)c3cccc(C#N)c3)n2N)cc1	741846890	ZAMYURUPPJUYGU-UHFFFAOYSA-N	437.485	1.016	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)c1ccccc1Cn1cncn1	742471619	SLDJLDOGXWFJOI-UHFFFAOYSA-N	430.262	1.929	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)COc2cccc(Br)c2)c1	744475541	ZUSDHJXQJGGPGH-UHFFFAOYSA-N	432.230	1.704	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)CNC(=O)c2c(F)cccc2Cl)c1	744988894	UMPBHEOMNJDLSQ-UHFFFAOYSA-N	432.795	1.085	50	20	IDGD	
Cc1nc(CNC(=O)NNc2ccc(S(=O)(=O)NC3CCCCCCC3)cn2)no1	745854805	NMBPTMBYRVBXLO-UHFFFAOYSA-N	437.526	1.991	50	20	IDGD	
O=C(NNc1nc(-c2ccccc2)no1)c1ccc(F)c(S(=O)(=O)Cc2ncon2)c1	746241271	HNWKKMZHZJPQLE-UHFFFAOYSA-N	444.404	1.990	50	20	IDGD	
COc1cc(C)nc(NNC(=O)CCCN(C)S(=O)(=O)c2ccc(C(C)=O)cc2)n1	746632535	FLGRCEIIIUVVKI-UHFFFAOYSA-N	435.506	1.540	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)NCCNS(=O)(=O)c2cccs2)c1C	747437660	MWXTVKGDQNPSTR-AWEZNQCLSA-N	440.547	1.441	50	20	IDGD	
Cc1nc(Cl)cc(NNC(=O)C2CCN(S(=O)(=O)c3cn(C)c(C)n3)CC2)n1	747988221	OPAZQDRCZMKGHT-UHFFFAOYSA-N	427.918	1.024	50	20	IDGD	
Cc1nc(Cl)cc(NNC(=O)c2sccc2S(=O)(=O)Nc2cnn(C)c2)n1	748335587	QAANHZXDUDKXRY-UHFFFAOYSA-N	427.899	1.791	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NN=Cc1ccc(Cl)nc1	748782532	UFMWYKZFHGMJLJ-UHFFFAOYSA-N	436.921	1.839	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)c1cn(-c2ccc(C(F)(F)F)cn2)nn1	751046415	DOGGYDNPFMRAPM-CQSZACIVSA-N	434.334	1.282	50	20	IDGD	
Cc1cc(S(N)(=O)=O)cc(C(=O)NNC(=O)c2cc(F)ccc2Br)c1C	751882528	OORBXEZHLUCCCM-UHFFFAOYSA-N	444.282	1.927	50	20	IDGD	
O=C(NNc1nc(-c2cccnc2)no1)c1cc(Cn2cc(Br)cn2)on1	751946837	MEBVNJDNKXAMGL-UHFFFAOYSA-N	431.210	1.884	50	20	IDGD	
Cc1cc(C(=O)O)cc(S(=O)(=O)NNC(=O)CNC(=O)c2cccs2)c1Cl	753778387	OSAIIRBGHRBYDK-UHFFFAOYSA-N	431.879	1.148	50	20	IDGD	
C[C@@H](NCC(=O)NNC(=O)c1cccc(C#N)c1)[C@H]1CCCN(C(=O)OC(C)(C)C)C1	754322118	XHIPDPVDTKBVOF-QAPCUYQASA-N	429.521	1.944	50	20	IDGD	
COc1cc(CN2CC[C@H](NC(=O)NNC(=O)COc3ccccc3F)C2)cc(OC)c1	755083451	CJCBYHSVCVPBBA-INIZCTEOSA-N	446.479	1.827	50	20	IDGD	
COC(=O)COc1cccc(NC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)c1	755909633	OUHNBHOVABVWAE-UHFFFAOYSA-N	425.401	1.596	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)Nc1cccc(S(=O)(=O)/N=C2/CCCN2C)c1	756028959	IRRCXFNCXOAJRU-MOHJPFBDSA-N	445.501	1.975	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)Nc1ccc(-c2noc(C(F)(F)F)n2)cc1	756316535	ZUWOIRBUUPOJGB-SECBINFHSA-N	433.368	1.343	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1ccc(OCc2cccc(F)c2)c(F)c1	756379556	PCKRFWHWZKGABB-LLVKDONJSA-N	442.444	1.634	50	20	IDGD	
COC(=O)CCCc1nnc(NC(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)s1	756684035	JQPQCXKOWWQNEG-JTQLQIEISA-N	425.442	1.793	50	20	IDGD	
O=C(NCc1cc2c(cc1OC(F)F)OCO2)NNC(=O)[C@@H]1COc2ccccc2O1	756960020	UILXIZNCBPBMAU-INIZCTEOSA-N	437.355	1.687	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1)c1cn[nH]c1	757727183	SBPCPOCPTLSWNK-LLVKDONJSA-N	434.503	1.977	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)N[C@@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1C#N	758772108	PLKBUTVGCPMQBC-UONOGXRCSA-N	433.465	1.163	50	20	IDGD	
Cc1cc(Br)cn2cc(CNC(=O)NN[C@]3(C)CCS(=O)(=O)C3)nc12	760150119	YMRFQYLDFPVNDD-OAHLLOKOSA-N	430.328	1.286	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2ccc3sccc3c2)CC1	761567906	GVEDFVWAMONPKV-UHFFFAOYSA-N	431.543	1.989	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2O)cc1NC(=O)c1ccncc1	763530459	VSRATYRORKEGBO-UHFFFAOYSA-N	433.424	1.748	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)C(=O)Nc1cccc(F)c1F	763531805	RIYSEYHYYSOJLE-UHFFFAOYSA-N	431.443	1.263	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2F)cc1	763568479	LPLBMPKVWKJRAL-UHFFFAOYSA-N	436.465	1.256	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)C(=O)Nc2ccc(-n3cnnn3)cc2)c1	763598491	ZUXUQNBFAVTOEJ-UHFFFAOYSA-N	437.460	1.259	50	20	IDGD	
CSc1nnnn1-c1cccc(NC(=O)C(=O)NNC(=O)c2cccc(Cl)c2)c1	763748204	ONGGUAYGSKANLL-UHFFFAOYSA-N	431.865	1.437	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3cccc(-n4cnnn4)c3)cc2C1	763943905	VPSYCQZSMJIJNS-NSHDSACASA-N	425.474	1.248	50	20	IDGD	
CC(C)(C)NC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)c1	763973644	DBWOMQICBXMXDI-UHFFFAOYSA-N	432.864	1.974	50	20	IDGD	
CN(C1CCCCC1)S(=O)(=O)c1ccccc1NC(=O)C(=O)NNC(=O)c1ccc[nH]1	763980013	BCDLRZRXNMOFSV-UHFFFAOYSA-N	447.517	1.368	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)C(=O)Nc1ccc(CC(=O)N2CCc3ccccc32)cc1	763998011	CMJYZRUBGVWIMO-UHFFFAOYSA-N	445.479	1.557	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)C(=O)Nc1cc(Br)ccc1N1CCCC1	763998074	FYCBUNCZUMNQCZ-UHFFFAOYSA-N	434.294	1.788	50	20	IDGD	
CO[C@@H]1Cc2ccc(NC(=O)C(=O)NNC(=O)c3cc(Br)cn3C)cc2C1	764002500	NHVCOXKZAHSADA-CQSZACIVSA-N	435.278	1.301	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cc(Br)cn2C)nn1[C@@H](C)C1CC1	764005126	VEOWLZMMZSOAMP-JTQLQIEISA-N	437.298	1.663	50	20	IDGD	
CNC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(C(F)(F)F)c2)cc1	764036837	BKBGNZOGHKRKTC-UHFFFAOYSA-N	438.362	1.230	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3ccc(Cl)nc3)cn2)C[C@@H](C)O1	764100246	KIFLLWDDAHGMHM-TXEJJXNPSA-N	432.868	1.143	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(N3C[C@H](C)O[C@H](C)C3)cc2)c1O	764131023	DNNFXZVEJGAZDP-OKILXGFUSA-N	442.472	1.414	50	20	IDGD	
COC(=O)C(C)(C)c1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)cc1	764155383	ZTSUZBKPOOWMJM-KRWDZBQOSA-N	425.441	1.227	50	20	IDGD	
C[C@@H]1CN(Cc2ccccc2NC(=O)C(=O)NNC(=O)Cc2ccccn2)C[C@@H](C)O1	764267314	SNFQRRPRNUGPHL-HZPDHXFCSA-N	425.489	1.019	50	20	IDGD	
CN(C)C(=O)c1ccccc1NC(=O)C(=O)NNC(=O)c1cc(Br)ccc1O	764276269	BJCXTNWFVOXJDV-UHFFFAOYSA-N	449.261	1.256	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)COc2ccccc2O)sc2c1CCC2	764278480	QEIQKRBYQUPYPF-UHFFFAOYSA-N	447.469	1.284	50	20	IDGD	
CS(=O)(=O)c1c(Cl)cccc1NC(=O)C(=O)NNC(=O)CCc1ccccc1O	764289469	UULGRUCPLFFJAF-UHFFFAOYSA-N	439.877	1.168	50	20	IDGD	
C[C@@H]1CCCCN1C(=O)c1ccc(NC(=O)C(=O)NNC(=O)Cc2cc[nH]n2)cc1Cl	764296608	BRSZTWIZFDRKTH-GFCCVEGCSA-N	446.895	1.406	50	20	IDGD	
COCCNS(=O)(=O)c1c[nH]c(C(=O)NNC(=S)Nc2cccc(C)c2C)c1	764321165	QUUZLTKEPNLANX-UHFFFAOYSA-N	425.536	1.188	50	20	IDGD	
Cn1cc(NC(=O)C(=O)NNC(=O)CCCc2cccs2)cc(Br)c1=O	764340874	JWZLGWTXDGCCFR-UHFFFAOYSA-N	441.307	1.318	50	20	IDGD	
COC(=O)c1csc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)c1C	764379754	JCZYIIWGXAIJKR-UHFFFAOYSA-N	427.385	1.601	50	20	IDGD	
COC(=O)c1ccc(F)c(NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)c1	764382848	RPVHBRBGPHOMOQ-UHFFFAOYSA-N	431.405	1.464	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1cc(C(C)(C)C)nn1-c1ccc(F)cc1	764398388	GQSBNFVKBSJKAC-CYBMUJFWSA-N	449.483	1.446	50	20	IDGD	
CCn1c2ccccc2c2cc(NC(=O)C(=O)NNC(=O)[C@H](C)OCCOC)ccc21	764399114	ZFPXJBPPWHBLAV-AWEZNQCLSA-N	426.473	1.952	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@H](C)S(=O)(=O)C2CCOCC2)ccc1OC(C)C	764569929	DEJTZWQJQZPHRQ-ZDUSSCGKSA-N	428.507	1.226	50	20	IDGD	
O=C(NN=Cc1c(N2CCOCC2)nc2ccccn2c1=O)c1cc(-c2cccs2)[nH]n1	764785325	DMWZIAISQGWZQJ-UHFFFAOYSA-N	449.496	1.747	50	20	IDGD	
C[C@H]1Oc2ccccc2N(CCC(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)C1=O	765323476	QSKIFUKMHXZIDI-CQSZACIVSA-N	434.493	1.643	50	20	IDGD	
Cc1oc(C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)cc1S(=O)(=O)N1CCCC1	765571990	SZANWSHXXOIYIO-UHFFFAOYSA-N	449.514	1.899	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)CCNS(=O)(=O)c2ccccc2)n[nH]1	765601703	SHQYHBVIHONYGY-UHFFFAOYSA-N	443.485	1.215	50	20	IDGD	
CCNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)cc1	765615532	HWJHZQAZCGCPBU-UHFFFAOYSA-N	431.449	1.589	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)CCCC(C)(C)C)CC2)cc1	765726361	BDLYMFHXQZFUFM-UHFFFAOYSA-N	438.594	1.665	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)C[C@@H](C)CC(C)C)CC2)cc1	765729331	ONQAOCOFCHQPOA-SFHVURJKSA-N	438.594	1.521	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1ccn(-c2ccccc2)n1	765733997	UCZYCQZVZVRCIE-UHFFFAOYSA-N	432.484	1.091	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1ccc(-c2ccccc2)[nH]1	766641528	HAXYDMNUQYFQDC-UHFFFAOYSA-N	431.496	1.901	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)[C@@H]2CC(=O)N(c3ccc(Cl)c(F)c3)C2)C[C@@H](C)O1	767148476	VBJOECOMKZONBY-HZSPNIEDSA-N	440.903	1.479	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccccc2)n(-c2ccc(C(F)(F)F)cn2)n1	768227459	OKSCLHZORTUDCN-UHFFFAOYSA-N	432.362	1.994	50	20	IDGD	
CC(C)(C)OC(=O)NCc1cc(C(=O)NNc2nccc(N3CCOCC3)n2)ccn1	768720445	BAHFFPGCALJMAM-UHFFFAOYSA-N	429.481	1.490	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)[C@H]1c2ccccc2CCN1C(=O)OC(C)(C)C	769231004	UVHMEXMVARWQSC-QGZVFWFLSA-N	432.521	1.973	50	20	IDGD	
CSCCNC(=S)NNC(=O)[C@H]1CCCN(C(=O)c2ccccc2OC(F)F)C1	769770352	VBXVMEKOQRHAOM-LBPRGKRZSA-N	446.545	1.999	50	20	IDGD	
CCOC(=O)c1nn(C)cc1C=NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	769776475	IHJPVUFCJPTYSL-UHFFFAOYSA-N	433.490	1.145	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)Nc1ccc(-n2nccn2)nc1	769966672	TYHJFFVBBQSLKW-UHFFFAOYSA-N	430.494	1.888	50	20	IDGD	
CO[C@@H](CNC(=O)OC(C)(C)C)CC(=O)NNC(=O)c1cc(Br)ccc1O	770000975	JSTLSUZZAJVIDV-LLVKDONJSA-N	446.298	1.846	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)NC3CCN([C@@H]4CCC[C@@H]4O)CC3)nc21	770413664	USTIMTUBKMKNTP-CABCVRRESA-N	432.529	1.291	50	20	IDGD	
COc1ccccc1C(=O)N[C@@H](CCS(C)(=O)=O)C(=O)NNc1c(C)cccc1F	771701451	PLTVVXQVXLJICW-INIZCTEOSA-N	437.493	1.819	50	20	IDGD	
O=C(COc1ccccc1Br)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772187738	CYNPNMTUKZTISK-UHFFFAOYSA-N	440.681	1.945	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C[C@H]2CSCCN2C(=O)OC(C)(C)C)c1O	772221174	LSZCAFHSHRCJTM-LBPRGKRZSA-N	425.507	1.904	50	20	IDGD	
CC1CCC(NS(=O)(=O)CC(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)CC1	772968685	SIGCZGWRRTXLFF-JVWICGRDSA-N	431.942	1.753	50	20	IDGD	
CC(C)OCCCn1c(NNC(=O)[C@@H]2CCCCS2(=O)=O)nc2ccccc2c1=O	772991276	LDVCDDZHZAJGIH-KRWDZBQOSA-N	436.534	1.622	50	20	IDGD	
COCc1ccc(NC(=O)C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)cc1	773526159	VXNDZTWTXOJCGF-UHFFFAOYSA-N	437.456	1.524	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ccccc2[N+](=O)[O-])cc1N1CCCS1(=O)=O	773651346	TWZIHRUCOAWXHN-UHFFFAOYSA-N	433.446	1.525	50	20	IDGD	
COc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)C(=O)NNc1cccc(Cl)c1C	773766158	IQYQNUHZHYYBFR-UHFFFAOYSA-N	440.909	1.989	50	20	IDGD	
O=C(c1ccc(-c2cncnc2)cc1F)N1CCN(S(=O)(=O)CBr)CC1	775890865	FUYOQZMUZNBBPR-UHFFFAOYSA-N	443.298	1.723	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2cccc(Cc3cnc(N)s3)c2)n1	775900590	QLADOGZIWYMPPS-UHFFFAOYSA-N	445.526	1.628	50	20	IDGD	
COc1ccccc1[C@](N)(C(=O)NNc1nccc(N2CCOCC2)n1)C(F)(F)F	776173539	XXZHFLZQAIIRRQ-KRWDZBQOSA-N	426.399	1.181	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)NC[C@@H](c1ccc(F)cc1)N1CCOCC1	778580068	FDIBPGVGNKVLEB-INIZCTEOSA-N	439.488	1.054	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cc3c(cc2F)NC(=O)CC3)cc1OC	778711751	YUBYCZLNAFDNQS-UHFFFAOYSA-N	444.419	1.517	50	20	IDGD	
CCS(=O)(=O)N1CCC(C(=O)NNc2ccc([N+](=O)[O-])cc2Br)CC1	779145216	SWCAXWRCOYJTFK-UHFFFAOYSA-N	435.300	1.862	50	20	IDGD	
COc1cc(OC)c(Cn2nccc2NC(=O)NNC(=O)Cc2ccncc2)c(OC)c1	779481805	AXCREJBAEPAMCU-UHFFFAOYSA-N	440.460	1.748	50	20	IDGD	
CCCS(=O)(=O)Nc1cccc(NC(=O)C(=O)NNc2ncncc2Cl)c1C	782159895	LJMDUDOPIIVBBH-UHFFFAOYSA-N	426.886	1.672	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C(=O)Nc2ccc(OCC(F)F)cc2)nc2ccccc21	782887417	OTVYQVHSLRPWAK-UHFFFAOYSA-N	431.399	1.546	50	20	IDGD	
Cn1c(=NNC(=O)C(=O)Nc2ccc(CCN3CCOCC3)cc2)sc2ccccc21	783349814	QUFKDPZIFVKPKY-UHFFFAOYSA-N	439.541	1.685	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2cc(C(F)(F)F)cc(C(F)(F)F)c2)CCS(=O)(=O)C1	783426832	OQRSATTYWSTFPE-CYBMUJFWSA-N	447.357	1.861	50	20	IDGD	
Cc1c(NNC(=O)C(=O)Nc2cccc(S(=O)(=O)NC3CC3)c2)cccc1[N+](=O)[O-]	784353868	WLRYERSSZPYZBX-UHFFFAOYSA-N	433.446	1.426	50	20	IDGD	
COCC[S@](=O)Cc1cccc(NC(=O)C(=O)NNc2cccc([N+](=O)[O-])c2C)c1	784358764	YVILZCBGMDFTTH-PMERELPUSA-N	434.474	1.880	50	20	IDGD	
O=C(NNc1ccc([N+](=O)[O-])cc1Cl)C(=O)Nc1ccc(CN2C(=O)CCC2=O)cc1	784391312	GUBIFDFBHDEONW-UHFFFAOYSA-N	445.819	1.979	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C)c(C)c(NC(=O)C(=O)NNc2cccc(OC)n2)c1	784842628	RJKFYLIKYFGEGX-UHFFFAOYSA-N	449.533	1.819	50	20	IDGD	
COc1cccc(NNC(=O)C(=O)Nc2ccc(NC(=O)c3cccnc3)c(OC)c2)n1	784845907	KOZLCKORBVIBOC-UHFFFAOYSA-N	436.428	1.828	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)cc1C(=O)NC(C)C	785067171	HWDNDXDDBINKGX-UHFFFAOYSA-N	436.472	1.110	50	20	IDGD	
Cc1ccc(-c2nc3cc(F)ccc3n2C)cc1NC(=O)C(=O)NNc1nccn(C)c1=O	785087216	YJVHAZNGFZFKLY-UHFFFAOYSA-N	449.446	1.863	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@H]3CCCN3c3ccccc3)CC2)cc1	787439269	IQSPUSVHQSJHDM-HSZRJFAPSA-N	435.572	1.929	50	20	IDGD	
COc1cc(NNC(=O)NCCNS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1Cl	788912333	CPZSHLAQZMFTSF-UHFFFAOYSA-N	443.869	1.861	50	20	IDGD	
COC(=O)c1ccc(COc2ccc(C=NNC(=O)N3CCN(C)CC3)cc2OC)o1	790172974	BDDVCLIFFICMMK-UHFFFAOYSA-N	430.461	1.945	50	20	IDGD	
C[C@H](CC(=O)NNc1cccc(F)c1[N+](=O)[O-])NS(=O)(=O)c1cccnc1Cl	791150391	MOABGMGPLOCSDP-SECBINFHSA-N	431.833	1.983	50	20	IDGD	
O=C(NNc1nc2ccccn2n1)C(=O)Nc1cccc(-c2nnc3n2CCCCC3)c1	792393820	HXTOCGUJBDCRCV-UHFFFAOYSA-N	431.460	1.796	50	20	IDGD	
CC(=O)NC[C@@H]1CCn2ncc(C(=O)NNC(=O)[C@H](C)Oc3cccc(C)c3C)c2C1	792736671	OLGNGJOLRCJOHJ-DOTOQJQBSA-N	427.505	1.427	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N[C@H](C)[C@H](C)OC)cc1	794004223	IFHKAKFSQOWHEX-HJHPPFKDSA-N	425.489	1.881	50	20	IDGD	
O=C(NNC(=O)c1cn(-c2ccc(Cl)c(Cl)c2)cn1)N[C@H]1CCS(=O)(=O)C1	797711852	PXDXDXVKBXJMLL-VIFPVBQESA-N	432.289	1.310	50	20	IDGD	
CC(=O)N[C@@](C)(C(=O)NNc1nc(-c2cccnc2)no1)c1ccc(S(C)(=O)=O)cc1	797723784	BCJZDGRAQQRSJT-LJQANCHMSA-N	444.473	1.030	50	20	IDGD	
CCS(=O)(=O)N1CCC[C@@H](C(=O)NNc2cc([N+](=O)[O-])ccc2Br)C1	800620254	HYEKXFOELJDRFH-SNVBAGLBSA-N	435.300	1.862	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccnc(OCc3ccccc3)c2)cc1	800622431	LDBAROUDUZZUJK-UHFFFAOYSA-N	445.435	1.697	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2nn(-c3cccc(Cl)c3)cc2O)n1	801359411	IGYKWPRBOKWBFR-UHFFFAOYSA-N	449.876	1.543	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cccc3nc(C)[nH]c23)c1	801797877	OHHUEKOLWSPGOF-UHFFFAOYSA-N	429.502	1.977	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)N=c3cc[nH]cc3)CC2)cc1	802024937	NINCPMXBQTZVOM-UHFFFAOYSA-N	447.517	1.156	50	20	IDGD	
Cc1ccc(F)c(NNC(=O)C(=O)N2C[C@@H](C[C@@H]3COCC(=O)N3)c3ccccc32)c1	807014016	NYYJLZYSJGBCLW-HUUCEWRRSA-N	426.448	1.613	50	20	IDGD	
CN(CCC(F)(F)F)[C@H](CNC(=O)NNC(=O)C(=O)NC1CC1)c1ccc(Cl)cc1	807227277	XAWMTSAWBALSFU-CQSZACIVSA-N	449.861	1.874	50	20	IDGD	
O=C(NNc1nccnc1C1CCC1)C(=O)Nc1ccc(S(=O)(=O)C(F)F)cc1	807462089	JAWYHYJEBQLPKX-UHFFFAOYSA-N	425.417	1.822	50	20	IDGD	
CC(C)NC(=O)NNS(=O)(=O)c1cc(Cl)c(OCC(=O)N(C)C)c(Cl)c1	808085806	SYQRYWSQYZTNDF-UHFFFAOYSA-N	427.310	1.361	50	20	IDGD	
Cc1ccn(-c2ccc(NC(=O)C(=O)NNc3ccc(S(=O)(=O)N(C)C)cc3)cc2)n1	813033010	ADTPHGVUQUNSOX-UHFFFAOYSA-N	442.501	1.513	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccccc2CNC(=O)NNc2cccc(Cl)n2)CC1	814303969	FBWAVCUPWOKUGP-UHFFFAOYSA-N	438.941	1.497	50	20	IDGD	
Cc1nc(Cn2nnc(NC(=O)C(=O)NNc3cc(C(F)(F)F)ccc3F)c2C)no1	815609264	CCRBTSYXDICZNY-UHFFFAOYSA-N	442.333	1.566	50	20	IDGD	
CC(C)(C)Oc1c(F)cc(NC(=O)C(=O)NNC(=O)[C@@H]2CCc3nncn3C2)cc1F	815691353	NGUMOAXWUNQYLD-SNVBAGLBSA-N	436.419	1.082	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)[C@@H](C)S(=O)(=O)C2CCOCC2)c1	816717820	RSXQDCBQYGZRDG-SNVBAGLBSA-N	449.323	1.661	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)[C@H](C(C)C)N1C(=O)c2ccccc2C1=O	863998655	MCRJRKICHVPWLH-IBGZPJMESA-N	425.441	1.542	50	20	IDGD	
Cc1nn2c(nc(N3CCCC3)c3ccccc32)c1C=NNC(=O)[C@H]1CCS(=O)(=O)C1	912808704	PBBNFISAPWDFQB-HNNXBMFYSA-N	440.529	1.676	50	20	IDGD	
Cc1ccccc1C(=O)N[C@@H](CC(C)C)C(=O)NNC(=O)CCN1C[C@H](C)O[C@H](C)C1	912921638	QETHACLLXYPIQM-NSHGMRRFSA-N	432.565	1.786	50	20	IDGD	
N#Cc1cccc(S(=O)(=O)NCC(=O)NNC(=O)CC23CC4CC(CC(C4)C2)C3)c1	913500092	NVKQDMDPAAFQRQ-UHFFFAOYSA-N	430.530	1.590	50	20	IDGD	
O=C(NCCc1cnn(-c2ccccc2)c1)NNC(=O)c1nn(-c2ccccc2)cc1O	914543306	QGOPTLUUOZRPGI-UHFFFAOYSA-N	431.456	1.950	50	20	IDGD	
NS(=O)(=O)c1ccc(CC(=O)NNC(=O)COc2ccccc2-c2ccccc2)s1	914689286	DYYPPOSPWXORAW-UHFFFAOYSA-N	445.522	1.831	50	20	IDGD	
COc1ccc(Cn2ncc3cc(C(=O)NNC(=O)c4cccn4C)cnc32)c(OC)c1	914847213	YYCAQPIJFCFEEV-UHFFFAOYSA-N	434.456	1.910	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCc2ccc(OC)cc2)c1	915883906	RJYHYPPTYASWGE-UHFFFAOYSA-N	448.545	1.912	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)NC[C@@H](c1cccs1)N1CCN(C)CC1	915902139	QDRZQQFNTMLXCG-RDJZCZTQSA-N	449.552	1.974	50	20	IDGD	
CNS(=O)(=O)c1ccc(C(C)=NNC(=O)c2sc(N3CCOCC3)nc2C)cc1	916339452	LVWOANLGPFHORP-UHFFFAOYSA-N	437.547	1.350	50	20	IDGD	
COc1cccc(NCC(=O)NN=C(C)c2ccc(S(=O)(=O)N3CCNCC3)cc2)c1	916359407	AFNMUVBBAGNKLI-UHFFFAOYSA-N	445.545	1.241	50	20	IDGD	
CC(C)NS(=O)(=O)c1cccc(CNC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1	916486467	UFTGXJPZHIODOA-GOSISDBHSA-N	448.501	1.044	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCCc2cn3c(n2)CCCC3)nc1	916578248	AKGWFKRGPXCYPR-UHFFFAOYSA-N	435.554	1.514	50	20	IDGD	
COc1ccc(CNC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1F	916594764	SMQGTZATEWWSGE-UHFFFAOYSA-N	438.481	1.294	50	20	IDGD	
CC(C)NC(=O)C(=O)N1CCN(CCP(=O)(c2ccccc2)c2ccccc2)CC1	917075061	PAWDQOCPWLHPQQ-UHFFFAOYSA-N	427.485	1.669	50	20	IDGD	
CS(=O)(=O)N1CCN(C(=O)/C(C#N)=C\c2cn(CCC#N)nc2-c2ccccc2)CC1	918218802	RQHKOFAMLONGON-JXAWBTAJSA-N	438.513	1.475	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCC(C)(C)N1CCC[C@H](C)C1	919796632	HWHPFBMHTKXYMD-AWEZNQCLSA-N	438.598	1.743	50	20	IDGD	
O=C(NN=Cc1cccc(OCc2cccc(C(=O)O)c2)c1)N[C@@H]1CCS(=O)(=O)C1	1318373422	PONPVCOCACHMIT-QGZVFWFLSA-N	431.470	1.784	50	20	IDGD	
CC(C)CN1CC[C@H](CNC(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)C1	1319071733	JGKCMCVJXYVEQW-MRXNPFEDSA-N	425.574	1.942	50	20	IDGD	
O=C(NNS(=O)(=O)c1c(F)cccc1Br)c1ccc(-n2cnnn2)cc1	1319280174	KDIAPMOOMIOALL-UHFFFAOYSA-N	441.242	1.187	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)c2cc(Br)c(C=O)n2C)cc1	1343790778	UAQKMXMUBWARFW-UHFFFAOYSA-N	429.296	1.607	50	20	IDGD	
COCc1oncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)Br)C2	1778345098	WOSDFBCTIXOQRS-CDHAZOANSA-N	444.326	1.732	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4cccnc4n3)C2)C1	1778433719	JRNKVRPIPIHAFY-BFUOFWGJSA-N	433.306	1.857	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc4n(n3)CCCO4)C2)C1	1778555520	CXVZOQNXYCPUPS-QZTJIDSGSA-N	431.320	1.345	50	20	IDGD	
CCCC(=O)N[C@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CO[Si](C)(C)C)C2	1779518184	WLAGFXRDOIRXGF-CBGDNZLLSA-N	441.645	1.657	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Br)C2)c1cc(Cl)ncn1	1779900108	GRNZEYPKKOJBQT-PVXIVEMSSA-N	449.708	1.948	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc(OC)cc2O)C1	1780323570	UAYUNNFCTKEEGM-HGHGUNKESA-N	440.924	1.782	50	20	IDGD	
COc1ccccc1OCC(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781324938	FVENLHHBYQIWQI-WMZOPIPTSA-N	445.285	1.594	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ncc(F)cc1F)C2	1782172003	JXUWHXBAYYNQAL-ZBQZNYHESA-N	431.867	1.741	50	20	IDGD	
CC1(C)CC(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cnccc2C(=O)NN)C3)C1	1782263578	MTLFDUNGBKMXGV-WZONZLPQSA-N	443.548	1.249	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCCn2cccc2)C1	1782583860	IWQVUHLJVQGNCA-AUSIDOKSSA-N	447.580	1.155	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@]2(C1)CN(C(=O)C1CC(=O)C1)CCO2	1782868095	TXTFPOICEGHHAK-RWHUQTJRSA-N	429.423	1.681	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1CCc3ccccc3O1)CCO2	1783539242	GYVZSZIPBAMJQA-VHFSOBRXSA-N	437.334	1.994	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cc(C(F)(F)F)ccn3)CCO2)C1	1783877766	PMKKBTUWLWIWRB-CXAGYDPISA-N	435.830	1.798	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cccc3ncsc13)CCO2	1783935098	NUQYNCYUTQKHPW-NRFANRHFSA-N	445.545	1.113	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc4c(c3)CCCO4)C[C@@H]21)[C@H](O)CCl	1784093043	PFKXVUAVRMTZCK-GNBUJSLZSA-N	436.936	1.134	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)C3(c4ccccc4F)CC3)C2)C1	1785463481	WTMSUXZCCNHFCZ-JOCHJYFZSA-N	446.523	1.060	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc(OC)c(F)c3)[C@H]2C1	1785640571	AVHPMBAYUTUQPO-PCBIJLKTSA-N	429.876	1.076	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cn4ccsc4n3)C[C@@H]21	1786407281	VXLASEPJCKYFHG-OBJOEFQTSA-N	441.351	1.774	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3CCCCC3)C[C@@H]21	1787508908	RJHSMUFDQQUFLL-QXDWZXEQSA-N	443.548	1.680	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc4c3OCCO4)[C@H]2C1	1787945773	LYLWAKXFZPCOBI-MBGYTDRXSA-N	438.908	1.305	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)c3cnccc3F)CCC2)cc1)c1cccc(B(O)O)c1	1788143575	FEELTRVKKCEPNV-UHFFFAOYSA-N	433.248	1.962	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)c1ncccc1C(F)(F)F	1788993695	PLDZISPLXCNGDE-IMIFBBOLSA-N	435.830	1.293	50	20	IDGD	
COCc1c[nH]c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]3C2)c1	1789870316	DVBXPQXANVIVEV-IWKLRQMXSA-N	432.348	1.991	50	20	IDGD	
Cc1cccc(C)c1NC(=O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Cl)C[C@@H]21	1789874854	CYRLNNJOBXHWTL-QBYUYEEZSA-N	425.888	1.756	50	20	IDGD	
Cc1n[nH]cc1C(=O)Nc1ccc(C2(NC(=O)c3cnccc3C(=O)NN)CCC2)cc1	1790121861	KNQCHCHWZCISAR-UHFFFAOYSA-N	433.472	1.778	50	20	IDGD	
CCCC(=O)N[C@@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](Br)CC)[C@H]2C1	1790961118	WZRNCNNFAXXFLK-GVRJEKJASA-N	446.386	1.444	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3cnn(C)c3)C[C@@H]21	1791058081	ORNLFMLOEQBEDZ-TUUVXOQKSA-N	427.343	1.116	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)CCSC)[C@H]2C1	1791308790	NQKOHGUIUVHHHM-LXFSFDBISA-N	437.400	1.254	50	20	IDGD	
C[C@@H](C(=O)NC1(c2ccc(NC(=O)CCC(=O)NN(C)C)cc2)CCC1)N1C[C@H]2C[C@H]2C1	1791601101	LXWYEAHNHWNXQJ-OKZBNKHCSA-N	441.576	1.834	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)Cc1ccccc1)C2	1792871978	GPBOCIJCABIOKU-MWTISTBLSA-N	439.350	1.211	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(C(F)(F)F)c(F)c1)C2)[C@H](O)CCl	1792979771	GPOXFSYEPJYVPR-BAESOJJISA-N	438.805	1.647	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1c[nH]c3ccc(F)cc13)C2)[C@@H](O)CCl	1792982777	NHHLBEZSHNKIAH-ZZXMYQEDSA-N	437.899	1.429	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cc(C)n(C)n1	1793131792	PKYOEDZNPMFNRF-YXPYIKCWSA-N	427.343	1.034	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ncn(C)n1	1794935751	DGADHNNYJZDQBD-BTTYYORXSA-N	442.432	1.214	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(C)cc1)C2	1796441734	WMAUCWUVIRZYSO-WCARGJHZSA-N	437.500	1.332	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(-n2ccnc2)ccn1	1798729132	KLKFDYNKBLBELD-CWPLJXCYSA-N	443.580	1.322	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1CCN(Cc3ccccn3)CC1)C2	1799264284	GZPOFLJVPKNGBX-KOUHRCEDSA-N	448.995	1.901	50	20	IDGD	
COC(=O)c1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@](C)(Cl)CCl)cn1	1799275320	PMVUASUBFCVCBG-QPWUGHHJSA-N	444.315	1.308	50	20	IDGD	
CC(C)c1nc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Br)no1	1799344240	DCAOKBMATBMVFJ-DJBIQUGXSA-N	433.278	1.016	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc3nccn13)C2)[C@@H](F)Br	1799346565	CUECCBOLTQSLDF-BAESOJJISA-N	425.258	1.228	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1Cc3ccccc3O1)C2)[C@@H](F)Br	1799348826	BOGMTESWINDEAT-UDUPFKKZSA-N	427.270	1.270	50	20	IDGD	
CSc1ncccc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Br	1799348916	SAIDMWSSPHHMJK-LYIQGSDWSA-N	432.315	1.697	50	20	IDGD	
C[C@H](Nc1ccccn1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Br	1799350161	SUUQLXITLPFLMC-ZZVJUGKHSA-N	429.290	1.162	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1(Br)CC1	1799360669	UUVIJRCPNCUQBC-MIJXAVMKSA-N	428.154	1.740	50	20	IDGD	
Cc1cc(C(=O)NCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@](C)(Cl)CCl)no1	1800080541	IHTZOJKNPQCDLU-YFQWEKLQSA-N	431.320	1.587	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(COC)c[nH]1)C2	1800642599	RGMQPSAQJCVATC-HLPPOEQASA-N	428.327	1.538	50	20	IDGD	
C[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)Br)n1cccc1C=O	1800756505	NJLBYBAFHYEAKB-YMSVYLFOSA-N	426.311	1.235	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3ccc(OC)cc3[nH]1)C2	1800978010	JHNAQXDFIZTVTG-QHHYFVSCSA-N	435.908	1.634	50	20	IDGD	
C=CCNC(=O)/C=C\C(=O)NC[C@H]1CCN(C(=O)CO[Si](C)(C)C)[C@H]1c1cccnc1	1802480694	DLISUNSGSSRZKW-LKWHPCHFSA-N	444.608	1.797	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)o1	1803143081	SURZAMBRSOTLBT-RKVPGOIHSA-N	434.880	1.552	50	20	IDGD	
Cc1nc(C(=O)NC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)cs1	1805966053	BGWUAQXQZJITIF-OXJNMPFZSA-N	444.561	1.539	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC2(CCCN(C(=O)COc3cccnc3)C2)CC1	1806839447	CEAUFSDKEQMALN-UHFFFAOYSA-N	431.537	1.065	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cnsn2)[C@H]1c1cccnc1)[C@@H](F)Br	1808652206	WEYLAMVAKZQHKI-WCFLWFBJSA-N	428.287	1.943	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1CCN(C(=O)Cc2cnccn2)[C@@H]1c1cccnc1	1810537745	NIUAHGXRWLKBMV-LAUBAEHRSA-N	427.581	1.972	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@H]1CCN(C(=O)CSCC(=O)O)[C@H]1c1cccnc1	1810549241	ZGZGSINMGXOVPJ-BEFAXECRSA-N	439.610	1.757	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@H](CNC(=O)[C@H](C)Br)[C@@H]2c2cccnc2)nn1	1812866866	MJMJQEYUEGUBTK-QEORTHHSSA-N	448.321	1.983	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2nc3ncccn3n2)[C@@H]1c1cccnc1	1813030394	IVMGAIUUWXXDRQ-OWCLPIDISA-N	443.895	1.093	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)Cn2cc([N+](=O)[O-])cn2)[C@H]1c1cccnc1)C(Cl)Cl	1813078150	PRVVBZPSJWFARA-WFASDCNBSA-N	441.275	1.696	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)C1CC2(CCC2)C1	1813650698	ZMCQHAMKNNKQMQ-SIKLNZKXSA-N	447.344	1.661	50	20	IDGD	
C[C@H]1CC[C@H](C(=O)N[C@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)CC1	1815347687	KOSPNWDXPNIQCF-ZQIUZPCESA-N	441.362	1.875	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCc2ccccn2)n[nH]1	1816011451	UYFGSSBSWQCRHA-GOSISDBHSA-N	441.536	1.803	50	20	IDGD	
O=C1CC[C@H](C(=O)N[C@@H]2CCc3nc(NC(=O)[C@@H](F)Br)sc3C2)CN1	1822999379	PVWQIGFDHPHHFH-JOAULVNJSA-N	433.303	1.272	50	20	IDGD	
O=C1CC[C@@H](C(=O)N2CCCC[C@@H]2C2CCN(C(=O)CCBr)CC2)CN1	1823834651	NHQJSBAFBJMCME-HZPDHXFCSA-N	428.371	1.917	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(=O)n3[nH]nnc3n2)CC1	1824012423	ARLHQYXKLOQECB-HNNXBMFYSA-N	449.943	1.311	50	20	IDGD	
COCC1(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1	1824480969	VDRLKANJXIUXOP-HXUWFJFHSA-N	428.338	1.026	50	20	IDGD	
C[C@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)Cn3ccncc3=O)sc2C1	1824542214	KZBPXXHKBRONLX-UWVGGRQHSA-N	440.323	1.095	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)CNC(=O)OC(C)(C)C)sc2C1	1825509618	NFPQBGKFAMAUGL-WDEREUQCSA-N	446.957	1.834	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H]2C=CCN2)CC1	1827552322	QNQSJPPGJMKKEZ-VEWSIASQSA-N	440.548	1.268	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1	1828923848	CPJOFMAJAJKZBW-MSOLQXFVSA-N	435.956	1.936	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)NNc1ccccc1)CCO2	1829809458	WCANCMSNEXFJEN-DJPFJPOOSA-N	438.956	1.465	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)c(C)o1	1830537841	QCOSFZWKRNJNKO-ORAYPTAESA-N	443.338	1.997	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CN3CCC(C)CC3)CCO2)C1	1831097764	BQXBWSWIVVDPPB-GHTZIAJQSA-N	429.989	1.582	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4nn[nH]c4c3)C2)C1	1831654783	XTWVKNBMKABZED-MGPUTAFESA-N	435.912	1.435	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnc(C)c(C)c3)CCO2)C1	1833300654	IBKICPUVXIVRFP-YLJYHZDGSA-N	425.913	1.022	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)CCc3cccs3)CC2)CC1)[C@H](O)CCl	1833307899	CXJKCXLOYBHNQD-GOSISDBHSA-N	427.998	1.852	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccsc3)CCO2)C1	1833959258	DJQCPHNDUIEINX-CXAGYDPISA-N	431.352	1.849	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@H](CC)NC(N)=O)CC2)CC1	1835054661	XDYWPBSWCDVXJX-SJORKVTESA-N	429.993	1.412	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836719492	UEXCIXXTXOBAAE-CZUORRHYSA-N	434.917	1.146	50	20	IDGD	
C[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1)N1C[C@H]2C[C@H]2C1	1837287267	PPXWQTSHBLFIRH-AOHSKODXSA-N	448.391	1.019	50	20	IDGD	
Cn1cnc(C(=O)N2CCC(OC3CCN(C(=O)CCBr)CC3)CC2)c1	1837548064	KHVRJLGHCFUPTH-UHFFFAOYSA-N	427.343	1.817	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)C3CCCC3)CC2)CC1	1837605802	RDCUDDFAGWNLCT-UHFFFAOYSA-N	443.548	1.488	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)COc3cc(Cl)ccn3)CCO2)C1	1837654021	IFMYIWVPWMIFNY-DNVCBOLYSA-N	446.331	1.588	50	20	IDGD	
Cc1nc(F)ccc1C(=O)N1CCOC[C@@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1837715496	UATQKQJMEQCTRR-HXUWFJFHSA-N	439.560	1.451	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)C(C)(C)NCCC#N)CC2)CC1	1837869612	WSXCLYPEKCZGNK-SFHVURJKSA-N	442.988	1.521	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3snnc3C)CC2)CC1	1838139629	QGDFYDGXCLYQRL-OAHLLOKOSA-N	430.958	1.713	50	20	IDGD	
Cc1nc(F)ccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1	1838266924	KBRVUNZGQGAKPH-HXUWFJFHSA-N	439.560	1.451	50	20	IDGD	
CCCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)CCO2	1838528258	MYMMGIDTAFSCRA-NRFANRHFSA-N	449.460	1.390	50	20	IDGD	
CC(C)c1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)n[nH]1	1838693672	FUXKQWAPGGFENW-FQEVSTJZSA-N	426.945	1.868	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3c(C)ccn3C)CCO2)C1	1838822461	KVIDEZJFHUTGBP-HNAYVOBHSA-N	442.354	1.577	50	20	IDGD	
O=C(c1n[nH]c2cccc(F)c12)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1839598364	FZELCICECXXUOK-CRAIPNDOSA-N	428.823	1.306	50	20	IDGD	
CC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](Br)Cc1ccccc1)CCO2	1839801794	CYGTUPFFYSNVGC-MJGOQNOKSA-N	425.323	1.469	50	20	IDGD	
O=C(C[C@@H]1C[C@@H]2CC[C@H]1C2)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1839915226	JKCIWHHWBRRCNJ-BTWZCHHXSA-N	447.345	1.960	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)C(C)(C)C)C2)C1	1839962176	WPAJXZOWJABBEC-SUNYJGFJSA-N	435.359	1.023	50	20	IDGD	
Cc1cccc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)c1	1840032058	MQOCWUQTQWRNOU-OXJNMPFZSA-N	439.350	1.777	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cccc(F)c3F)C2)C1	1840156157	OOMJFWAAZYJJEU-FOIQADDNSA-N	446.878	1.218	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccccc3NC(C)=O)CCO2)C1	1840724944	SHOHLYCEDSKZIQ-LAUBAEHRSA-N	437.924	1.732	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@H]2CC(=O)N(c3cccc(OC)c3)C2)C1	1841009800	LVROYFZIFUAYBA-CRAIPNDOSA-N	449.935	1.505	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(O)(C(=O)N2CC3(CCCN3C(=O)[C@H](F)Cl)C2)CC1	1843362469	WKVPZIRMWSDYBX-ZDUSSCGKSA-N	433.908	1.486	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCCC12CN(C(=O)[C@@H](O)CNC(=O)OC(C)(C)C)C2	1846068677	HPDSAUKVRRNJAQ-OLZOCXBDSA-N	448.358	1.249	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@@]2(C(=O)N2CCCC23CN(C(=O)[C@H](O)CCl)C3)C1	1846127748	CDGSQJQIQXOYAM-PDSXEYIOSA-N	441.956	1.437	50	20	IDGD	
CC(C)(C)OC(=O)N1CC2(CC(C(=O)N3CCCC34CN(C(=O)[C@@H](O)CCl)C4)C2)C1	1846136595	WEVKSNBHXRUWOZ-HNNXBMFYSA-N	441.956	1.437	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)Cc1ccc(C(F)(F)F)cc1)C2	1846384352	HGUOZIZQKXPJKT-UHFFFAOYSA-N	440.466	1.824	50	20	IDGD	
COc1cc(F)cc(/C=C/C(=O)N2CC3(CCCN3C(=O)CCC(=O)NN(C)C)C2)c1	1846385921	KULYPLBYSHHNEB-FNORWQNLSA-N	432.496	1.424	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)CC[C@H]2Cc3ccccc3NC2=O)c1	14260575	XXEJODFTBDGCBK-INIZCTEOSA-N	444.513	1.289	50	20	IDGD	
CC(C)Nc1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2ccccc2)cc1[N+](=O)[O-]	17170900	DMBBUTYCJHHFFS-UHFFFAOYSA-N	435.462	1.155	50	20	IDGD	
CCOC(=O)/C(C#N)=C/Nc1cc(S(=O)(=O)N2CCOCC2)ccc1N(CC)CC	18988890	DOKPBWSDQJOLSN-FOCLMDBBSA-N	436.534	1.936	50	20	IDGD	
Nn1c(SCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)nnc1-c1ccccc1F	28799365	VJBVXOLQNPWDFO-UHFFFAOYSA-N	431.409	1.260	50	20	IDGD	
CCCc1c(C(=O)NNC(=O)c2nn(CC)c(=O)c3ccccc23)[nH]c(C)c1C(=O)OC	108113200	HRNTZNRELVWMJC-UHFFFAOYSA-N	439.472	1.867	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(C)nc3[nH]nc(C)c23)c1	725877888	ABQMVUMDECELDO-UHFFFAOYSA-N	444.517	1.680	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)c2ccc(-n3ccnc3)nn2)cc1	725881393	KAGGEGGVNAXORK-UHFFFAOYSA-N	435.473	1.158	50	20	IDGD	
O=C(NCc1cccc(S(=O)(=O)N2CCCCC2)c1)NNC(=O)c1ccccc1O	726272842	SRNGKZHYKDVQEQ-UHFFFAOYSA-N	432.502	1.711	50	20	IDGD	
O=C(COc1ccc2ccc(=O)oc2c1)NNc1ccc(S(=O)(=O)NC2CC2)cc1	726867629	QITMYKSXPZZZRR-UHFFFAOYSA-N	429.454	1.756	50	20	IDGD	
C#Cc1cccc(NC(=S)NNC(=O)[C@H](CSC)N2C(=O)[C@H]3CCCC[C@@H]3C2=O)c1	727501247	PICJBXBPOLFNTN-ULQDDVLXSA-N	444.582	1.892	50	20	IDGD	
O=C(CN1C(=O)c2cccc([N+](=O)[O-])c2C1=O)NNC(=O)c1cccc(OC(F)F)c1	728487956	GXKCXUSYKDJEMQ-UHFFFAOYSA-N	434.311	1.253	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2cnn(Cc3ccccc3)c2C)n1	728726209	VOLFCMNXQOYFLQ-UHFFFAOYSA-N	427.486	1.552	50	20	IDGD	
CC(C)n1ncc2c(C(=O)NNC(=O)c3cnn[nH]3)cc(-c3ccc4c(c3)OCCO4)nc21	729456655	ZCUDTDSQWVZATJ-UHFFFAOYSA-N	448.443	1.643	50	20	IDGD	
COc1cccc(CC(=O)N2CCN(C(=O)NNC(=O)Cn3ccc4ccccc43)CC2)c1	729510613	HDCYDCQIKNCKJV-UHFFFAOYSA-N	449.511	1.778	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)[C@H]1CCCCN1C(=O)c1ccco1	730077243	PPPNNGCFGMSSKS-QGZVFWFLSA-N	432.502	1.858	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)[C@H]1CCN(c2ccc3c(c2)OCCO3)C1=O	730514871	NSHVXLKZJTVKMY-CXAGYDPISA-N	443.431	1.565	50	20	IDGD	
C[C@H]1CC(C)(C)C[C@]2(C1)NC(=O)N(CC(=O)NNC(=O)COc1ccccc1O)C2=O	730782177	JDHVHCSOECSFMG-ZSEKCTLFSA-N	432.477	1.055	50	20	IDGD	
COc1cc(OC)c(CCNC(=O)NNC(=O)c2cc(Br)c[nH]2)c(OC)c1	731044738	UAAKMZYRUGZTRG-UHFFFAOYSA-N	441.282	1.990	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1	732053516	FFOAKLTXDDSHJU-ZDUSSCGKSA-N	436.421	1.626	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)c1sccc1S(=O)(=O)NC1CCCCCC1	732082789	LJXSWZRBUWCVAX-UHFFFAOYSA-N	425.536	1.856	50	20	IDGD	
COC(=O)c1cc(OC(=O)CN2C(=O)N[C@@]3(CCc4ccccc43)C2=O)ccc1[N+](=O)[O-]	732651236	ATAZEHCWVDGTIE-OAQYLSRUSA-N	439.380	1.680	50	20	IDGD	
CCCCNC(=O)NNS(=O)(=O)c1cc(C(=O)OC)c(Br)cc1F	734415813	BAMHRNGVQVGXPB-UHFFFAOYSA-N	426.264	1.667	50	20	IDGD	
O=C(NCCCCc1ccc([N+](=O)[O-])cc1)NNC(=O)C1CCN(c2ncccn2)CC1	740482893	HVAMMWHQQWGTAJ-UHFFFAOYSA-N	441.492	1.955	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)[C@H](C)N2CCN(c3ccc(F)cc3)CC2)cc1	740982517	MDILLMCNORPZLO-KRWDZBQOSA-N	442.491	1.649	50	20	IDGD	
CS(=O)(=O)[C@@H]1CCC[C@H](NC(=O)NNC(=O)COc2ccc(Br)cc2)C1	741092219	AIQPNDUBBWWQLD-GXTWGEPZSA-N	448.339	1.514	50	20	IDGD	
COc1ccc(Oc2ccc(S(=O)(=O)NNC(=O)CNC(=O)c3ccco3)cc2)cc1	741204191	KVRJKLJICJFIEF-UHFFFAOYSA-N	445.453	1.820	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)Nc2ncn(CC(=O)N(C)C)n2)c(C)n1C[C@@H]1CCCO1	741971886	XDKQDCASEMIKKQ-GONKEYIRSA-N	425.493	1.509	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CSc2nnnn2-c2ccc3c(c2)OCCO3)c1	742453255	CYOOVYBWZIXPHY-UHFFFAOYSA-N	426.458	1.295	50	20	IDGD	
COc1ccc([C@@H](CC(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)NC(C)=O)cc1	744511762	JOOCLCPUWMTROQ-LJQANCHMSA-N	438.440	1.139	50	20	IDGD	
O=C(COC(=O)c1cnnn1-c1ccccc1Cl)NNC(=O)c1ccc([N+](=O)[O-])cc1	744719820	CMDZERUJVFFJFL-UHFFFAOYSA-N	444.791	1.447	50	20	IDGD	
CC(=O)N[C@H](CC(=O)OCC(=O)NNC(=O)c1cccc(C#N)c1)c1ccc(F)cc1F	745141716	PIWMEUFJJDHNBM-GOSISDBHSA-N	444.394	1.408	50	20	IDGD	
Cc1ccc([C@@H](CNC(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)N2CCOCC2)o1	745398549	GFZCYAFJAQRUDE-OAHLLOKOSA-N	433.421	1.219	50	20	IDGD	
Cc1cc(N2CC[C@H](NC(=O)NNC(=O)c3ccc(Cl)cc3Cl)C2=O)n(C)n1	745905396	IUDZMEFQUSJIBC-ZDUSSCGKSA-N	425.276	1.785	50	20	IDGD	
CC[C@@H]1Oc2cc([C@@H](C)NC(=O)NNC(=O)CNC(=O)c3cccs3)ccc2NC1=O	745929305	BXFHJTFODZEHIW-RISCZKNCSA-N	445.501	1.679	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(Cl)c(C(=O)NNc2nc(C)cc(OC)n2)c1	746623799	QNXJCKKMVLMENU-UHFFFAOYSA-N	429.886	1.129	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C[C@](O)(c1nc(C)cs1)C(F)(F)F	746854237	KUXQZEVJQNSRCN-INIZCTEOSA-N	433.408	1.827	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)NCC1CCN(S(=O)(=O)c2ccccc2)CC1	747498430	GLSAWGZXEDAMKK-UHFFFAOYSA-N	431.518	1.055	50	20	IDGD	
CS(=O)(=O)c1ccc(NNC(=O)CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])cc1	748147182	DFJWJUMWGOZLLO-UHFFFAOYSA-N	426.838	1.525	50	20	IDGD	
COCCO[C@H](C)C(=O)NN=Cc1cc(I)c(OC)c(OC)c1	748258840	CYGHPRZLRWGCNY-SNVBAGLBSA-N	436.246	1.810	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)N2CCC([C@@]3(C)NC(=O)NC3=O)CC2)c1C	748376043	RKFPLRFOMPXZFD-TWMGVTGTSA-N	427.505	1.495	50	20	IDGD	
COC(=O)/C=C1\SCC(=O)N1CCCOC(=O)/C(C#N)=C/c1cc(C#N)n(C)c1C	748862097	AAGRCGFGWQVTPM-ZHIGFMDJSA-N	428.470	1.635	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c(C)c1	749150612	BIJVEDIGUYLWDX-UHFFFAOYSA-N	441.531	1.267	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCc2ccnc(-n3ccnc3)c2)nc1	749200005	FLYSPGKSSSQXGN-UHFFFAOYSA-N	430.494	1.175	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)[C@@H]1CCCN1C(=O)c1ccc2c(c1)OCO2	749504777	JUUVJCXEWFIFJV-INIZCTEOSA-N	425.441	1.419	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)c1ccc(=O)n(Cc2ccccc2Cl)c1	751204138	DOKJTQFJXKTUKG-UHFFFAOYSA-N	428.832	1.334	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cccc(CN3CCS(=O)(=O)CC3)c2)cc1OC	751290709	PDRNLLRYNQSTND-UHFFFAOYSA-N	447.513	1.009	50	20	IDGD	
CCOC(=O)C1(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)CCC1	751539149	RJALIWSRPQMKPH-UHFFFAOYSA-N	437.518	1.356	50	20	IDGD	
C[C@@H](C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1)c1ccc([N+](=O)[O-])cc1F	755068744	SNGPHSZOHVYLKA-PIGZYNQJSA-N	447.375	1.368	50	20	IDGD	
COc1cc([N+](=O)[O-])ccc1C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	755312708	HFDSYWJSROIVIM-UHFFFAOYSA-N	427.461	1.577	50	20	IDGD	
CCN(Cc1ccccc1NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)C(C)=O	755757290	CUILCMLJOJZCQB-UHFFFAOYSA-N	436.472	1.768	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)Nc1ccc(S(=O)(=O)NC2CC2)cc1	756774349	BZSAAXGWCNCGRO-LBPRGKRZSA-N	436.465	1.887	50	20	IDGD	
CC[C@H](C)NS(=O)(=O)c1cccc(NC(=O)NNC(=O)c2ccc3c(c2)OCO3)c1	757710986	NUDHDDVJKONTCN-LBPRGKRZSA-N	434.474	1.959	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)Nc1cccc(S(=O)(=O)NC)c1C	757721499	MVAVNVWVAYIUQK-UHFFFAOYSA-N	436.490	1.534	50	20	IDGD	
CN1C(=O)C[C@H](C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)[C@H]1c1ccc(Cl)c(F)c1	758055889	UCHMMEIPARHPRB-OYYNGEPBSA-N	447.850	1.986	50	20	IDGD	
O=C(CCc1nc(O)c2c3c(sc2n1)CCCC3)NNC(=O)C(=O)Nc1ccccn1	758819497	CLVKPHNUOJTWOO-UHFFFAOYSA-N	440.485	1.389	50	20	IDGD	
Cc1ccc(CNC(=O)NNC(=O)c2nnc(O)c3ccccc23)c(O[C@H]2CCOC2)c1	758902194	SGWTULKHBSJRIT-HNNXBMFYSA-N	437.456	1.956	50	20	IDGD	
CC[C@@H]1CN(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)CCN1Cc1ccccc1	759211074	FPEJZHLFDFTLJQ-LJQANCHMSA-N	434.504	1.613	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(/C#N)C(=O)N2CCC3(CC2)NC(=O)N(C)C3=O)c1C	759621358	HNVOZCPBPVKPGP-GZQZNAIASA-N	427.505	1.762	50	20	IDGD	
Cc1cc(C)nc(-n2nccc2NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)n1	760279246	KNLKAOQCPDYWTB-UHFFFAOYSA-N	445.443	1.069	50	20	IDGD	
O=C(COC(=O)c1cnc([C@H]2CCCO2)s1)NNC(=O)[C@@H]1COc2ccccc2O1	760673181	QDBLUASWLYFKIG-KGLIPLIRSA-N	433.442	1.139	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)CN1C(=O)NC2(C[C@H](C)C[C@@H](C)C2)C1=O	761626293	VKJJCAGWVGFYQE-ZIAGYGMSSA-N	448.545	1.681	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1)[C@@H]1COc2ccccc2O1	763100481	IXVAJGBURJKEKY-LPHOPBHVSA-N	425.441	1.775	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccn(C)c2)c1	763109979	UKLBMLVTEXIAJG-UHFFFAOYSA-N	428.470	1.909	50	20	IDGD	
COC(=O)c1ccc(Cl)c(S(=O)(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)c1	763439764	RDVCIIVNGRRMRI-UHFFFAOYSA-N	449.913	1.741	50	20	IDGD	
C[C@H]1CN(C(=O)c2ccc(NC(=O)C(=O)NNC(=O)c3ccccc3O)cc2)C[C@@H](C)O1	763527251	OGOGUSVWOYQSIH-OKILXGFUSA-N	440.456	1.041	50	20	IDGD	
Cc1nn(-c2ccccc2)c2sc(C(=O)NNC(=O)C(=O)Nc3cc(C)n(C)n3)cc12	763537476	DVFZNPXDBIVHKB-UHFFFAOYSA-N	437.485	1.837	50	20	IDGD	
O=C(NNC(=O)c1ccccc1F)C(=O)Nc1ccc(CCN2CCSCC2)cc1	763557351	ZBESDNIYXJWXDE-UHFFFAOYSA-N	430.505	1.817	50	20	IDGD	
COC(=O)c1c(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)sc(C)c1C	763604815	LWTVHARNAAVQPK-UHFFFAOYSA-N	441.469	1.941	50	20	IDGD	
COc1ccc(CN(C)C)cc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccccc2)[nH]n1	763606128	VWNIEKAULKETKZ-UHFFFAOYSA-N	436.472	1.547	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2ccc(-n3cccn3)c(F)c2)c1	763666186	WXOQJFRZISOPNP-UHFFFAOYSA-N	425.420	1.793	50	20	IDGD	
CC(C)CNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2F)cc1	763682189	YYOVMTUBJWSUOA-UHFFFAOYSA-N	430.436	1.376	50	20	IDGD	
C[S@](=O)c1cccc(NC(=O)C(=O)NNC(=O)CSc2ccc(Cl)cc2)c1	763736460	UVSIBWJATAJDEH-MHZLTWQESA-N	425.919	1.956	50	20	IDGD	
CCOC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C)cc2)cc1C#N	763811678	KLHFAXYRVGOHFK-UHFFFAOYSA-N	439.428	1.600	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)c1cccc(-n2ccc(C(F)(F)F)n2)c1	763823472	HJENFXFHLAJYED-UHFFFAOYSA-N	432.362	1.477	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cnc3c(c2)CCCC3)cc1	763861175	MOHXMBSPSZSZQJ-CQSZACIVSA-N	426.473	1.913	50	20	IDGD	
Cc1ccc2cccc(NC(=O)C(=O)NNC(=O)c3nn(-c4ccccc4)cc3O)c2n1	763948777	LBVBMDNSTKIKAJ-UHFFFAOYSA-N	430.424	1.834	50	20	IDGD	
CC(C)n1ncc2cc(NC(=O)C(=O)NNC(=O)c3cc(Br)cn3C)cnc21	764003025	WTMRFPRUQDJRAK-UHFFFAOYSA-N	448.281	1.513	50	20	IDGD	
Cc1ccc(C(=O)NC2CC2)cc1NC(=O)C(=O)NNC(=O)c1ccc2c(c1)OCCO2	764006056	JMDOZOVEDZEIDX-UHFFFAOYSA-N	438.440	1.058	50	20	IDGD	
O=C(NNC(=O)c1cccc(Br)c1)C(=O)Nc1ccn(-c2ccncc2)n1	764063257	METDEXVWJDARQX-UHFFFAOYSA-N	429.234	1.430	50	20	IDGD	
Cc1ncsc1C(=O)NNC(=O)C(=O)Nc1ccc(C(=O)N2CCCC[C@H]2C)cc1	764245332	DIOCMQHXENENNZ-GFCCVEGCSA-N	429.502	1.866	50	20	IDGD	
Cc1cc(CSc2ccccc2C(=O)NNC(=O)CNC(=O)c2cccnc2)on1	764344765	JFZNDTCQECEZAQ-UHFFFAOYSA-N	425.470	1.861	50	20	IDGD	
Cc1ccnn1-c1ccccc1NC(=O)C(=O)NNC(=O)CSc1ccccc1O	764394871	WCHFGMIHZPYQNO-UHFFFAOYSA-N	425.470	1.765	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNc2cccc(OC)n2)cc(Br)c1F	764664157	RBTSYUMWSZSKNM-UHFFFAOYSA-N	441.213	1.860	50	20	IDGD	
Cc1ccc(C)c(S(=O)(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)c1	765118069	IHMKYLDKOVEZSK-UHFFFAOYSA-N	430.530	1.071	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2ccccn2)c(I)c1	765696800	BDGYCRZTJWOUPI-UHFFFAOYSA-N	440.197	1.095	50	20	IDGD	
CC(C)(C)CC(=O)NCC(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	765756801	QJRHGTNYKMIVEG-UHFFFAOYSA-N	437.972	1.157	50	20	IDGD	
CC[C@H](Nc1c([N+](=O)[O-])c(C)nn1C)C(=O)NNC(=O)c1cc(-c2cccs2)[nH]n1	768263550	UJTKIZHPMQUFAS-JTQLQIEISA-N	432.466	1.740	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)[C@H](C)NC(=O)C3CCCC3)n[nH]2)cc1OC	768279460	PCLDZZJXZWFEKE-LBPRGKRZSA-N	429.477	1.550	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1ccc(Br)c(C(F)(F)F)c1	768898689	ANIBFYBIKGTFPV-MRVPVSSYSA-N	429.214	1.664	50	20	IDGD	
Cc1cnn(Cc2ccccc2F)c1NC(=O)C(=O)NNc1cccc(S(C)(=O)=O)c1	769256602	URIRQDINSLQHAF-UHFFFAOYSA-N	445.476	1.864	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)c1csc(NC2CC2)n1	769301931	LCXLYUUHZKHVOF-UHFFFAOYSA-N	448.980	1.950	50	20	IDGD	
CSCCNC(=S)NNC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(F)cc2)C1	769768492	BJCYGCIESKDJPV-GFCCVEGCSA-N	434.584	1.085	50	20	IDGD	
Cc1ccc(S(=O)(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)c(C)c1C(=O)O	771608529	UQLQDMPJQJRPFU-UHFFFAOYSA-N	439.877	1.281	50	20	IDGD	
CC(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)c1	771716520	HBYGJOXGKCHDJS-UHFFFAOYSA-N	428.470	1.835	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)NCCNS(=O)(=O)c1ccc(C)s1	772632068	VWYDSDSUHZPNBD-UHFFFAOYSA-N	440.547	1.307	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2cccc3c2CCN3C(=O)OC(C)(C)C)n1	773729972	CPAMLWKGCUYHLG-UHFFFAOYSA-N	428.449	1.865	50	20	IDGD	
O=C(NNC(=O)c1ccc(Br)s1)N[C@H](CO)C[C@@H](O)c1ccccc1	778590607	MYECFDYUAUKEIW-NWDGAFQWSA-N	428.308	1.939	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNS(=O)(=O)c1cnc(-c2ccccc2)nc1	780397735	PUAYVHFUNQIWEW-UHFFFAOYSA-N	435.506	1.758	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](NC(=O)NNC(=O)Cc2cn3ccccc3n2)CC1	780683234	XWZRHXXDGDMLRS-HNNXBMFYSA-N	430.509	1.997	50	20	IDGD	
Cn1cc(CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)c(-c2ccccc2)n1	782493545	QAIDCWRGVXXZLQ-UHFFFAOYSA-N	441.517	1.524	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ccc(Br)cc2)cc1OCC(N)=O	783009416	NADJUKXCMLTSSH-UHFFFAOYSA-N	437.250	1.404	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2ccc(C(=O)N3CCSCC3)cc2C)nc(C)n1	783327066	XARBMNVTISBFLV-UHFFFAOYSA-N	428.518	1.673	50	20	IDGD	
CC(C)c1nnc(NC(=O)CCC(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)s1	784201789	NMNDVWXZZOMPML-UHFFFAOYSA-N	444.473	1.256	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Cc2cccc(N3CCCC3=O)c2)c2ccccc2c1=O	784684782	LXEIJKTUHNYGCG-UHFFFAOYSA-N	433.468	1.547	50	20	IDGD	
Cc1nc(Cn2cc(C(=O)NNC(=O)COc3ccccc3Cc3ccccc3)nn2)no1	784694484	BTUMUDHQDHGJJZ-UHFFFAOYSA-N	447.455	1.449	50	20	IDGD	
Cn1cc(NC(=O)C(=O)NNc2nc(C(F)(F)F)cs2)cc(Br)c1=O	785145574	HLYDMLABJDBHGA-UHFFFAOYSA-N	440.201	1.705	50	20	IDGD	
CCCCN1C(=O)CC[C@H](C(=O)NNC(=O)N2CCN(C)CC2)[C@H]1c1ccc(OC)cc1	788168835	FNGNWVJOUFKEQD-PZJWPPBQSA-N	445.564	1.763	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2ccc(C(F)(F)F)nn2)cc1	788297914	UJNDAUFLOJHYPN-UHFFFAOYSA-N	446.411	1.277	50	20	IDGD	
CS(=O)(=O)c1cc(NC(=O)C(=O)NNC(=O)Cc2c[nH]c3ccccc23)ccc1Cl	788330085	CMJYHZXQUOHLIP-UHFFFAOYSA-N	448.888	1.553	50	20	IDGD	
CC[C@H]1CCc2nc(NC(=O)C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)sc2C1	789741011	MSXSSBZMKJNEGP-NSHDSACASA-N	440.489	1.033	50	20	IDGD	
CN1C(=O)Cc2cc(NC(=O)C(=O)NNc3c(F)cc(C(=O)NC4CC4)cc3F)ccc21	789772784	CSYRFGCYFXMAKS-UHFFFAOYSA-N	443.410	1.458	50	20	IDGD	
O=C(NNC(=O)N1CCC(c2ncc3n2CCCC3)CC1)c1ccc(-n2cnnn2)cc1	789829789	VKPZEGBKYZDGKA-UHFFFAOYSA-N	435.492	1.429	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)c1ccc(N2CCCS2(=O)=O)cc1	789852628	MQBKTQPUVFDNMZ-UHFFFAOYSA-N	441.469	1.193	50	20	IDGD	
C[C@@H]1CCCN(S(=O)(=O)c2ccc(CNC(=O)NNc3nc4ccccn4n3)cc2)C1	790228051	KQQDJZBFLLZBPM-OAHLLOKOSA-N	443.533	1.976	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(C(F)(F)F)c(F)c1)c1ccc(-n2cnnn2)cc1	790342179	RPYDFOFXXBJDQM-UHFFFAOYSA-N	430.343	1.444	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)Nc2cc(Br)cc(C(=O)N3CCCC3)c2)cn1	790598313	LFERQYKIKNJSGI-UHFFFAOYSA-N	435.282	1.885	50	20	IDGD	
O=C(NNc1nc2ccccn2n1)C(=O)Nc1ccc(C(=O)NCc2ccccc2F)cc1	792393771	GDOHSYNLDGNBGZ-UHFFFAOYSA-N	447.430	1.880	50	20	IDGD	
O=C(NNc1nc2ccccn2n1)C(=O)Nc1cccc(C(=O)NCc2ccccc2)c1	792395439	ZEODXMOJVQWEGR-UHFFFAOYSA-N	429.440	1.741	50	20	IDGD	
CCCn1nc(C(=O)NNS(=O)(=O)c2ccccc2CC#N)c2ccccc2c1=O	794577152	RLOUUNKQDPPQIK-UHFFFAOYSA-N	425.470	1.496	50	20	IDGD	
C[C@H](CNC(=O)OC(C)(C)C)C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	794752441	PGGVRGKENBFXTC-QGZVFWFLSA-N	433.553	1.507	50	20	IDGD	
N#C/C(=C/c1ccc(OCCn2cc(C(=O)O)nn2)c(Cl)c1)S(=O)(=O)NC1CC1	794944257	SOLHIRUMQYSTLF-QPEQYQDCSA-N	437.865	1.655	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccc(C(F)(F)F)cc2)c1)N[C@H]1CCS(=O)(=O)C1	795526637	BKEOBAQQULFIQC-LBPRGKRZSA-N	431.396	1.022	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2cccc(OCC(=O)Nc3ccccc3)c2)n1	797371045	XVAADMKYUWOUOZ-UHFFFAOYSA-N	447.451	1.807	50	20	IDGD	
O=C(NN=Cc1cc(C(F)(F)F)n[nH]1)c1cccc(S(=O)(=O)N2CCOCC2)c1	799464976	UPAWZPUIHXENRE-UHFFFAOYSA-N	431.396	1.213	50	20	IDGD	
NC(=O)c1cc(Br)cc(S(=O)(=O)NNC(=O)COCc2ccccc2)c1	799532262	PRVHFMRYOLUCHX-UHFFFAOYSA-N	442.291	1.074	50	20	IDGD	
COc1ccc(C(=O)CNC(=O)CCC(=O)NNC(=O)Nc2cc(F)cc(F)c2)cc1	802001218	HUZIATDGHGUGPP-UHFFFAOYSA-N	434.399	1.905	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)[C@](C)(O)Cn2ccc(C)cc2=O)cc1Cl	802075459	AZRHFXDBAMSWQW-LJQANCHMSA-N	438.868	1.431	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=O)Nc2ccc3c(c2)OCO3)n(C)c1	802100612	VVVOIDXTACFIDF-UHFFFAOYSA-N	437.478	1.251	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccc(OC(F)F)nc1	802575388	NQDNDIAVHLACKG-VIFPVBQESA-N	428.779	1.890	50	20	IDGD	
C[C@H](Cn1ccc2ccccc21)C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	802762572	IWSRZCTYSRNCNJ-LJQANCHMSA-N	447.539	1.883	50	20	IDGD	
N#Cc1ccc(N2CC[C@@H](C(=O)NNC(=O)c3nn(-c4ccccc4)cc3O)C2)c(F)c1	806346612	ODZZUHHETMLOOH-OAHLLOKOSA-N	434.431	1.876	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2ccc(F)c(N3C(=O)CCC3=O)c2)cc1OC	806744196	TUXRXDJJKGFHOV-UHFFFAOYSA-N	430.392	1.963	50	20	IDGD	
CCOC(=O)N1CCC(NC(=O)NNC(=O)COc2ccc(Br)cc2)CC1	807007805	PDIPZYPHVVUSQS-UHFFFAOYSA-N	443.298	1.779	50	20	IDGD	
Cc1cc(CNC(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)n(C)n1	807223421	YLLIJXGJVJXFOP-UHFFFAOYSA-N	445.483	1.631	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)c1ccc(Br)cc1-n1cncn1	807369604	AYCXTZPMYAPAAE-UHFFFAOYSA-N	426.271	1.580	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(C3CC3)n(C)n2)cc1Br	810386996	ARLGUCISALAWNQ-UHFFFAOYSA-N	436.266	1.468	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C(=O)Nc1ccc(C(N)=O)cc1OCC(F)F)c1ccccc1	810387327	QKKMRIHRJKAHKY-AWEZNQCLSA-N	448.426	1.709	50	20	IDGD	
O=C(NNC(=O)N1CC[C@]2(CCc3ccccc3O2)C1)C1CCN(c2ncccn2)CC1	811874211	JTCSQHOZLBZGLB-HSZRJFAPSA-N	436.516	1.904	50	20	IDGD	
CC(C)(C)OC(=O)NC/C=C/CNC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	812473467	KEDGOVHTNDNMCK-AATRIKPKSA-N	426.495	1.115	50	20	IDGD	
COc1ccc(C)cc1N1C[C@@H](C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)CC1=O	812727173	OVORZOSKLBZLKO-HNNXBMFYSA-N	446.529	1.750	50	20	IDGD	
CCOc1ccc([C@@H](O)C2CCN(C(=O)NNC(=O)CNC(=O)c3ccco3)CC2)cc1	812882938	WPEFLIIMMNOYIL-HXUWFJFHSA-N	444.488	1.595	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)c2c(I)cnn2C)cc1	814101011	FHWSGPGZCRDDLK-UHFFFAOYSA-N	430.271	1.886	50	20	IDGD	
Cc1ccc(S(C)(=O)=O)cc1NC(=O)NNc1ccccc1S(=O)(=O)N(C)C	814521901	NEIPVSBRUSHNBH-UHFFFAOYSA-N	426.520	1.797	50	20	IDGD	
CC[C@H](C)Sc1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2CCc3nncn3C2)c(C)c1	815692589	VNHAXCLKMOPHOT-UONOGXRCSA-N	430.534	1.826	50	20	IDGD	
CCOc1ccc(NNC(=O)C(=O)Nc2cc(S(=O)(=O)NC3CC3)ccc2OC)cc1	815816388	UGDJRQWOKLPORI-UHFFFAOYSA-N	448.501	1.616	50	20	IDGD	
CCCCn1c(CCC(=O)NNc2cnnn2C)nc2cc(S(=O)(=O)N(C)C)ccc21	816770317	SCSBYKHZAMJMOG-UHFFFAOYSA-N	448.553	1.291	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)CCn2cnc3ccc(Br)cc3c2=O)n1	818028957	AWPFNMBPONLTMX-UHFFFAOYSA-N	447.293	1.210	50	20	IDGD	
COc1ccc([N+](=O)[O-])cc1NS(=O)(=O)c1ccc(C(=O)N2CC[C@@H](B(O)O)C2)cc1	864234343	QGQRBLOUZKELFZ-CYBMUJFWSA-N	449.250	1.093	50	20	IDGD	
CCOc1ccccc1N1C[C@H](C(=O)NNC(=O)CCN2C[C@@H](C)O[C@H](C)C2)CC1=O	912919860	RSOGCVHDKCPHEC-BRWVUGGUSA-N	432.521	1.085	50	20	IDGD	
C[C@H]1CN(c2ccc(C(=O)OCC(=O)NNC(=O)c3ccc(Cl)cc3)cn2)C[C@@H](C)O1	915038221	SNKHINRJNXJUEH-OKILXGFUSA-N	446.891	1.967	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)[C@@H]2CC(=O)N(Cc3ccccn3)C2)c2ccccc2c1=O	915259859	FYUSMMQHYMLHGC-OAHLLOKOSA-N	448.483	1.182	50	20	IDGD	
O=C(CCNS(=O)(=O)/C=C\c1ccccc1)NNC(=O)Cc1c[nH]c2ccccc12	915788466	OXODYPGMFNSZAV-QBFSEMIESA-N	426.498	1.838	50	20	IDGD	
COc1cc(CNC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc(OC)c1OC	915932306	VRLLLPXMPQLBGW-UHFFFAOYSA-N	437.474	1.260	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)NCCNC(=O)c2ccc(C)c(F)c2)cc1C	916272221	FMLRCPPQTQHGQG-UHFFFAOYSA-N	429.452	1.450	50	20	IDGD	
CNC(=O)CN1CCC(NC(=O)NNC(=O)[C@H](C)Oc2ccc3ccccc3c2)CC1	916516777	KJJBSFMPCMEAJC-HNNXBMFYSA-N	427.505	1.148	50	20	IDGD	
O=C(COC(=O)c1nn(-c2ccccc2)cc1O)NNC(=O)c1ccc([N+](=O)[O-])cc1	917945901	ZYZWSOLMFCRGNX-UHFFFAOYSA-N	425.357	1.104	50	20	IDGD	
C[C@@H](COc1ccccc1)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	918090083	ZRAVXUNIGGTPGJ-INIZCTEOSA-N	446.529	1.883	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)N[C@H](C)c2ccc(S(=O)(=O)N(C)C)cc2)c1	918103165	ARYNGWCQUIKJIH-OAHLLOKOSA-N	434.518	1.716	50	20	IDGD	
O=C(CCc1ncc(-c2ccc(Cl)cc2)o1)NNC(=O)N[C@H]1CCS(=O)(=O)C1	919889776	TYDSMEVFZJMXJV-ZDUSSCGKSA-N	426.882	1.445	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)N=c3cc[nH]cc3)c2)cc1	919896989	RTMACBLLGMHFTM-UHFFFAOYSA-N	441.469	1.779	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)NCc1cccc(NC(=O)[C@@H]2CCCO2)c1	920236333	BCYYQEHUGUZPNT-KRWDZBQOSA-N	436.472	1.904	50	20	IDGD	
CN1C(=O)C(=CNNC(=O)c2ccccc2OCc2ccc(F)cc2)C(=O)N(C)C1=O	920978021	QFYLBGREDZTDHP-UHFFFAOYSA-N	426.404	1.573	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)c1ccc(N2NC(=O)CCC2=O)cc1	1116614071	PBVYHCYYPVGIRT-UHFFFAOYSA-N	432.458	1.014	50	20	IDGD	
CN(Cc1ccc([S@](C)=O)cc1)C(=O)NNC(=O)c1csc(N2CCOCC2)n1	1252628459	JYQXUTLLJCITDJ-LJAQVGFWSA-N	437.547	1.204	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)c(C(F)(F)F)c1	1320433811	FDFOFYPVBAYBTP-UHFFFAOYSA-N	437.422	1.263	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)c2cc(O)ccc2n1	1778423068	IXCFJVBFMPZGOM-WIYYLYMNSA-N	433.892	1.292	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(-c4ccncc4)[nH]n3)C2)C1	1779593432	PAGLCRNEISHUBM-YJYMSZOUSA-N	448.321	1.699	50	20	IDGD	
CN(C)c1ccc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)cn1	1779762866	CBWYMYOSVXFAFM-OALUTQOASA-N	429.348	1.827	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H]1CC[C@@H]3CCC(=O)N3C1)C2	1780707223	FFLWUSKOIUPURD-GKICUZSHSA-N	439.984	1.919	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc[n+]([O-])c1)C2)[C@H](F)Br	1780771046	RIBCKGMYJQVMEW-JKIFEVAISA-N	430.274	1.138	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Br)C2)[C@H](F)Br	1780773821	NHMFHXNPEKCDLM-KEPMVKOISA-N	448.102	1.881	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(=O)c1cccn1C)C2	1782001721	JYOJAOSUUFMMGR-ZBQZNYHESA-N	440.338	1.505	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](C)[S@](=O)c1ccccc1)CCO2	1783881024	JGNDRUXVKXGXER-DRACSYEFSA-N	442.965	1.266	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(C(=O)OC)cc3C)CCO2)C1	1783885373	ZOZUCEZUFAVQQD-LAUBAEHRSA-N	438.908	1.479	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)Cc1ccc(Cl)cc1)CCO2	1783934051	VIKDJSNRLMJSFW-NRFANRHFSA-N	436.940	1.085	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)Cc1ccc(Cl)cc1)CCO2	1783934052	VIKDJSNRLMJSFW-OAQYLSRUSA-N	436.940	1.085	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3cn4nc(C)sc4n3)[C@H]2C1	1784851396	JOMWPGXJALLXPS-TUUVXOQKSA-N	439.969	1.639	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(CCN(C(=O)c3ccccc3C3CC3)C2)C1	1784949606	YTZMMTPKYWQJMM-DEOSSOPVSA-N	434.301	1.001	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3cnc[nH]3)[C@H]2C1	1785220227	MJOVHSLRGSVMTQ-VRKREXBASA-N	427.343	1.353	50	20	IDGD	
CCOc1cnc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]32)cn1	1785609536	ZPLVQLKFJXFJOT-NGOJXBLDSA-N	445.347	1.705	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)[C@H](O)c1ccccc1	1786672221	WREPDYZSBSYXOT-GVRJEKJASA-N	429.286	1.390	50	20	IDGD	
N[C@@H](CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)c1cccnc1	1786928428	IPPYOFIRTJSYLW-WNZSCWOMSA-N	443.317	1.142	50	20	IDGD	
CC(C)=CCCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)[C@H]2C1	1787507578	FZZDUDCRHPYBIV-RWRPXTCXSA-N	443.548	1.847	50	20	IDGD	
COc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CO[Si](C)(C)C)C[C@@H]32)ccc1O	1789599800	FEWITHJHONDTQY-BXWFABGCSA-N	436.581	1.846	50	20	IDGD	
O=C(NC1(c2ccc(NC(=O)c3cccc(F)n3)cc2)CCC1)c1ccc(B(O)O)cc1	1789736716	MKHZNQNCGLRTQK-UHFFFAOYSA-N	433.248	1.962	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1ccc(C2(NC(=O)C[C@@](C)(O)CC(=O)O)CCC2)cc1	1791573022	XAHXIHOJOOMGQL-DNVCBOLYSA-N	426.897	1.990	50	20	IDGD	
N#Cc1ccc(CCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)cc1	1792481681	OPTTZFMVOVXZSX-REPLKXPHSA-N	446.511	1.441	50	20	IDGD	
CC(C)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(-n3cnnc3)cc1)C2	1792782951	GAYLKUDWOILMPK-ALXJQNPVSA-N	431.924	1.736	50	20	IDGD	
CCOc1cnc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)CBr)cn1	1792870114	GGVJPAYBRXCCFV-JFILPPLUSA-N	441.326	1.110	50	20	IDGD	
COC(=O)c1ccccc1CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2	1793093499	SDZHPCSLJWQCQQ-LTCOOKNTSA-N	426.872	1.530	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1Cc2ccccc2CN1C	1794082010	YWKOTJFRRDQBIV-PLACYPQZSA-N	441.576	1.054	50	20	IDGD	
CC(C)(C)c1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)ccn1	1794599465	USWWOJSODZFRTH-ACDBMABISA-N	435.333	1.625	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1c[nH]c3ncccc13)C2	1795117345	RGSGOBNKPNXLFT-CCWDJLKJSA-N	449.349	1.870	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)c1ccnc2ccccc12	1796190934	FFORWPZKIBMSGF-REPLKXPHSA-N	429.285	1.480	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(CS(C)(=O)=O)nc1	1796541763	ZFRSQWKHDAIOAW-YYIAUSFCSA-N	443.953	1.132	50	20	IDGD	
CCc1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)n[nH]1	1796892133	KEQFLEZGROBOOU-VFMVUTOHSA-N	425.493	1.358	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2cn[nH]c2cn1	1797581796	PTOJIDVZXYITER-ZWUHOBOKSA-N	436.310	1.335	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@](C)(Cl)CCl)n1	1799277469	SEMCLZUQBAGJMP-AODNKKSCSA-N	443.331	1.480	50	20	IDGD	
COc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)C(Cl)Cl)C3)c(O)c1OC	1799665680	YQNHGRQCTKRJIU-DDFAGTSDSA-N	433.288	1.416	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN1CCCC1)C2	1800330932	YXZNTHQCSQHDMW-BDCURPAKSA-N	444.482	1.557	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1noc3c1CCCC3)C2	1800639875	PSUOEKGYYXWOMV-FAXLKDOZSA-N	440.338	1.930	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)nc3ccccc13)C2	1800757605	MTXWDLIWBIWONP-JWXAPSBJSA-N	448.317	1.927	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccn(-c3ccccc3)n1)C2	1800760380	MQNFROZCQQKEMV-AFIMGQEJSA-N	447.333	1.859	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccnc3ncccc13)C2	1800762671	XEHULZWJLCVEFI-JFILPPLUSA-N	433.306	1.616	50	20	IDGD	
COc1cc(F)ccc1CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Br)C2	1802181338	CGEBAGNECVMGFU-GNTLTTKYSA-N	443.313	1.750	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@H]1CCN(C(=O)C(=O)N(C)C)[C@@H]1c1cccnc1	1803009511	WNKIYZUQRSWYRL-BPLDGKMQSA-N	425.327	1.207	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cc(C(F)F)no2)[C@H]1c1cccnc1)[C@@H](O)CCl	1803138314	JIUIMLDCJDNTJN-WHOFXGATSA-N	428.823	1.927	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H]2CCc3nc[nH]c3C2)[C@H]1c1cccnc1)[C@H](O)CCl	1803147123	TUIZXYHFWVTUGC-MWLKLMTCSA-N	431.924	1.215	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(-c2ncc[nH]2)cc1	1803787163	OXBITHAJRJRTSZ-REPLKXPHSA-N	438.532	1.702	50	20	IDGD	
Cc1cccnc1C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1807364657	TUFMTMSFFWTHGD-DENIHFKCSA-N	444.300	1.098	50	20	IDGD	
O=C(CCc1ccc[nH]1)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1807458613	BMFSJFKQDQVGTP-WMZHIEFXSA-N	446.316	1.042	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)[C@@H](C)N2CCN(C)CC2)[C@@H]1c1cccnc1	1807873845	BSBCQNVUVLHRGH-LMCOJAPRSA-N	436.000	1.741	50	20	IDGD	
Cc1ncsc1C(=O)N1CCCC2(CCN(C(=O)c3cnccc3C(=O)NN)CC2)C1	1808461853	YULHPFHBYIMEBN-UHFFFAOYSA-N	442.545	1.609	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)c1cccn2ccnc12	1809888174	WLQMIOANSICWJS-RYQLBKOJSA-N	427.892	1.649	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1CCN(C(=O)[C@@H]2CCNC(=O)C2)[C@H]1c1cccnc1	1810548121	OMYFIAZGIDHXSG-SYNHAJSKSA-N	432.597	1.465	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)c2ccc[nH]2)[C@@H]1c1cccnc1	1810624922	YWJNKOWPGAWFPO-BEFAXECRSA-N	433.472	1.042	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@@H]1c1cccnc1)c1cc[n+]([O-])cc1	1811197221	BHHXKKKMTNVCEA-XHSDSOJGSA-N	437.269	1.725	50	20	IDGD	
Cc1cc(C(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)n(C(F)F)n1	1811520984	NZEJHGRWSJETEL-NUEKZKHPSA-N	441.866	1.901	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@H](F)Cl)CC2)c1n[nH]c2c1CS(=O)(=O)C2	1815851686	UWIQMZXMPCQUGF-INWYIAFRSA-N	447.901	1.055	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](F)Br)[nH]n1)c1ccc(O)nn1	1816297867	JZGUQVQIQFULHZ-GXFFZTMASA-N	427.234	1.902	50	20	IDGD	
Cc1ccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)nc1	1816542993	HCLSECIMLSPQSP-KRWDZBQOSA-N	427.509	1.792	50	20	IDGD	
Cc1nc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)cs1	1816578565	WMMGCWLINGFDNQ-QGZVFWFLSA-N	439.306	1.474	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccon1)CC2	1817277249	NKAFGXOWGBRSJQ-QPDIMOPTSA-N	441.473	1.491	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cnoc2C2CC2)[nH]n1)c1ccc(B(O)O)cc1	1817471506	QIEGMVAAOIULNZ-GOSISDBHSA-N	449.276	1.575	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)C1=CCCC1)CC2	1819795803	SAGRBLAHIDXSAI-LBPRGKRZSA-N	426.502	1.478	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)C(C)=O)CC2	1821303172	WHIXXUDTBBOCOV-LLVKDONJSA-N	446.441	1.791	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)CCBr)[nH]n1	1822412727	GZFXFFRGWFRDTN-CYBMUJFWSA-N	443.346	1.560	50	20	IDGD	
Cc1ncc(CC(=O)N2CCCC[C@@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)s1	1822416722	LWLFWUMWLVLTCN-MRXNPFEDSA-N	447.565	1.782	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CN2CCNC2=N)CC1	1824092895	IFGBVGYKJHXXFJ-HOCLYGCPSA-N	442.402	1.477	50	20	IDGD	
CN1CCCC[C@H]1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1	1824204003	WQMGEYQGOYKNAV-VXKWHMMOSA-N	441.381	1.084	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1n[nH]cc1[N+](=O)[O-])CC2	1825642101	NZLQIONNMIINTN-NKWVEPMBSA-N	443.283	1.784	50	20	IDGD	
C[C@@H](NC(=O)OC(C)(C)C)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)CCl)CC2	1825810365	QAFXXFZWXGGBBG-FOGDFJRCSA-N	446.957	1.568	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)C[C@@H](N)c1cccnc1)CC2	1825998670	HPCPLRLUFKLPDE-MELADBBJSA-N	437.953	1.794	50	20	IDGD	
O=C(c1ccsc1)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827056076	OQVLAGUJRRATRA-HXUWFJFHSA-N	426.347	1.975	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)CN2CCN(C)CC2)CC1	1828444722	LULMWVPBMAXPCV-RBUKOAKNSA-N	429.005	1.107	50	20	IDGD	
C[C@H](O)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Cl)CCN2C(=O)OCc1ccccc1	1829057592	ZHCARNAQHJCYKS-YYFZDKIDSA-N	441.887	1.354	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccncc2O)CC1	1829177672	JFMYEAXKQQMCOU-SFHVURJKSA-N	431.537	1.394	50	20	IDGD	
O=C(c1cc(Cl)ccc1F)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1830719403	CSQRLHVURHKXTP-CRAIPNDOSA-N	435.279	1.149	50	20	IDGD	
Cc1c(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)oc2ccccc12	1830728289	RKMIUYYZVFPXIP-HRAATJIYSA-N	436.892	1.411	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)Nc3cnccn3)C2)C1	1831651056	NFRVHCNQUNEOJX-FTRWYGJKSA-N	439.944	1.141	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccn(C(C)C)n3)C2)C1	1831653857	FXBCNLCQFKRXFI-OXJNMPFZSA-N	426.945	1.942	50	20	IDGD	
Cc1cc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)CBr)C3)C2)on1	1832563776	LAIMFRORITVBLX-ACJLOTCBSA-N	444.326	1.013	50	20	IDGD	
C[C@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)c3cnccn3)CC2)CC1	1833262176	ISVLAZDTMZUKIA-CQSZACIVSA-N	438.370	1.693	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3n[nH]c(C4CC4)c3F)CC2)CC1)[C@H](O)CCl	1833308255	MJSYVOKXORCZGH-OAHLLOKOSA-N	441.935	1.211	50	20	IDGD	
Cc1nc(C(=O)N2CCO[C@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)ccc1F	1833459343	STKMCPHERLPRDS-HXUWFJFHSA-N	427.904	1.864	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccccc3O)CCO2)C1	1833759057	WFNYBVGSFMVNLT-UGSOOPFHSA-N	427.295	1.246	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3conc3C)CCO2)C1	1834340167	JJMNEADSEVDZOL-PBHICJAKSA-N	430.299	1.227	50	20	IDGD	
Cc1nc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](C)CBr)C3)C2)cs1	1834450314	ANQVKTOOIJAAPK-PXAZEXFGSA-N	446.367	1.553	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)CC3CCOCC3)C2)C1	1834822543	ULSCRYJKOGNMMB-GOSISDBHSA-N	433.343	1.045	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(F)F)CCO2	1834917624	ISTDDCUOLZIHIU-FZXOMJPYSA-N	441.381	1.593	50	20	IDGD	
CNc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)cc1	1835609626	BOFQTPXGQDEVLD-AUUYWEPGSA-N	440.338	1.582	50	20	IDGD	
Cc1ccn(CC(=O)N2CCC(N3CCC(NC(=O)CO[Si](C)(C)C)CC3)CC2)n1	1835834844	BYHZKKMREXIXGN-UHFFFAOYSA-N	435.645	1.615	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC1CCN(C2CCN(C(=O)CCn3ccnn3)CC2)CC1	1835837572	KHSMPFZMUMQOBO-UHFFFAOYSA-N	436.633	1.091	50	20	IDGD	
CC1=C(C(=O)N2CCC(N3CCC(NC(=O)[C@@H](F)Br)CC3)CC2)CCO1	1836412257	AWTCIXLURXVHCL-MRXNPFEDSA-N	432.334	1.943	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC(OC2CCN(C(=O)[C@@H]3[C@H]4COC[C@H]43)CC2)CC1	1836674676	XABIMNQZLZKJHR-VIBAHUMZSA-N	443.382	1.908	50	20	IDGD	
CC(=O)N[C@@H](C)C(=O)N1CCC(OC2CCN(C(=O)[C@](C)(Cl)CCl)CC2)CC1	1838638857	NWBFIDKIQDYCIQ-ORAYPTAESA-N	436.380	1.746	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3c[nH]c4ccccc34)CCO2)C1	1839071847	NTPAXQYJMAAOBK-AVRDEDQJSA-N	449.935	1.421	50	20	IDGD	
C=C(Oc1ccccc1O)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](Cl)CC)CCO2	1839144511	CORCTUXISIOLJE-KKSFZXQISA-N	438.908	1.759	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc4cc(C)ccn34)C2)C1	1839148388	XITIWDBTOKYLHR-IIBYNOLFSA-N	434.924	1.730	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3CCC(O)CC3)C2)C1	1839155302	QIAUABPQNDLKRG-QIRNKGDASA-N	437.364	1.230	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3n[nH]c4cccc(F)c34)CCO2)C1	1839599640	VXDBZLPBAHDSHJ-RBZFPXEDSA-N	438.887	1.789	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccncc3F)C2)C1	1840032755	JNKOCJMFUSZYOX-PXAZEXFGSA-N	430.274	1.074	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1ccc(O)c(F)c1)C2	1843416608	FNFWUULHJZLGJC-ZMOGYAJESA-N	427.436	1.482	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)[C@@H]1CCCOC1)C2	1844693592	WRPPGWQMPKDLMY-OAHLLOKOSA-N	431.445	1.764	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)c2cc(Cl)c(F)cc2F)C1	1845300776	NTLQVJLDPHVLFD-UHFFFAOYSA-N	428.867	1.808	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](CCO)NC(=O)OC(C)(C)C	1847639141	NQQHTDMVJOPNRV-WCVJEAGWSA-N	431.961	1.871	50	20	IDGD	
COc1ccc([C@@H]2C[C@@H]2C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)CCC(=O)NN(C)C)cc1	1847775255	KMZYGCMHZWGLQN-MUGJNUQGSA-N	428.533	1.374	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)[C@H]2CCCCN2C(=O)c2cccs2)c2ccccc2c1=O	25599343	XUULSGNHFNPLLG-OAHLLOKOSA-N	439.497	1.451	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)[C@H]2CC(=O)N(c3ccc(C)c(F)c3)C2)cc1	26448502	LAZZGTGRLUQJEQ-INIZCTEOSA-N	427.432	1.800	50	20	IDGD	
O=C(CSCc1ccccn1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	108467203	ORXWWOYJOZSGJQ-UHFFFAOYSA-N	434.543	1.561	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)NNC(=O)[C@H]1CCCN1C(=O)c1ccc2c(c1)OCO2	116430465	GMQJWFYWADFJPE-GOSISDBHSA-N	434.452	1.891	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NCCNc1ccc(C(F)(F)F)cn1	725872773	HCAZHPFNYQUSRJ-UHFFFAOYSA-N	430.412	1.334	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NNc1ncc(C(F)(F)F)cc1Cl	725872825	HHYURRKIGNBIMH-UHFFFAOYSA-N	436.803	1.903	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2csc(-c3ccc(O)cc3)n2)c1	726379039	DUYAIHGLEPWSLT-UHFFFAOYSA-N	446.510	1.841	50	20	IDGD	
COCCN(C)CCNC(=O)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1	727032787	HDIUTXFXXMASDX-QFIPXVFZSA-N	439.560	1.522	50	20	IDGD	
CC(C)c1ccccc1NC(=S)NNC(=O)Cn1cc(Br)c(O)nc1=O	727173901	DNDFBZWMMDEKQR-UHFFFAOYSA-N	440.323	1.853	50	20	IDGD	
Cc1occc1C(=O)Nc1cc(Cl)ccc1C(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1	728169833	ASDRTKPVYOPKHG-NSHDSACASA-N	439.877	1.689	50	20	IDGD	
O=C(CNC(=O)c1cccc(Br)c1)NNC(=O)Cn1ccc2ccccc21	729540932	RUCYVEURDVLXFZ-UHFFFAOYSA-N	429.274	1.981	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)N[C@@H]1CCN(c2ccc(F)cc2F)C1	730142896	ZFXZCYPFIJONOZ-MRXNPFEDSA-N	445.474	1.581	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)[C@@H]2CCN(c3ccc4c(c3)OCCO4)C2=O)cc1C	730513028	ULOOYHAGORSBNN-SFHVURJKSA-N	439.468	1.654	50	20	IDGD	
COc1cc(Br)c(C=NNC(=O)CSc2nnc(O)nc2O)cc1OC	730558267	GOYSLKFYMJDTDN-UHFFFAOYSA-N	444.267	1.305	50	20	IDGD	
O=C(NN=Cc1cc(Br)c(O)c(Br)c1)[C@H]1CCS(=O)(=O)C1	730576533	RQCZTIGOJDCUHY-QMMMGPOBSA-N	440.113	1.802	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=O)Cc2ccccc2F)ccc1F	731330086	NBDFYOOJVZOJEQ-UHFFFAOYSA-N	425.457	1.999	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)Cn2ccc3ccccc32)cc1C(=O)N(C)C	734416495	SNBAGUPYGUBSCK-UHFFFAOYSA-N	430.486	1.361	50	20	IDGD	
CC(=O)NCC(=O)N1CCc2cc(C(=O)NNC(=O)c3cccc4ncccc34)ccc21	735658099	XALWQOLHYLWTKQ-UHFFFAOYSA-N	431.452	1.335	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2cccc(Oc3cnccn3)c2)ccc1Cl	736542943	DIEBLKGANLHMFX-UHFFFAOYSA-N	447.860	1.645	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)CN2C(=O)NC(CC)(CC)C2=O)cc1C	736735890	WMESDNQSPQBVBE-UHFFFAOYSA-N	438.506	1.034	50	20	IDGD	
COCC(=O)N[C@H](C(=O)NNC(=O)COc1ccc(-c2ccc(C#N)cc2)cc1)C(C)C	741206581	GDHGAPMRMCNPDY-QFIPXVFZSA-N	438.484	1.539	50	20	IDGD	
Cc1nn(C)c(C)c1C[C@@H](C)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	741878327	FKHHNFBWSGURQB-CQSZACIVSA-N	447.561	1.461	50	20	IDGD	
COc1cc(NC(=O)OC(C)(C)C)c(Cl)cc1C(=O)NNC(=O)C(=O)NC(C)C	742489711	UQDLZPJNOVCDTH-UHFFFAOYSA-N	428.873	1.981	50	20	IDGD	
NC(=O)c1ccc(N2CCN(C(=O)NNC(=O)c3cccc(Br)c3)CC2)nc1	743686775	HOTVPPSMBRAREY-UHFFFAOYSA-N	447.293	1.120	50	20	IDGD	
Cc1nc2c(c(O)nn2C)c(C)c1CC(=O)NNC(=O)c1cc(Br)ccc1O	743732368	RVKJWSAVEDBYLF-UHFFFAOYSA-N	448.277	1.763	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@@H]2CC(=O)N(Cc3ccccc3)C2)cc1	743830212	QGJKVZOYENKAIJ-OAHLLOKOSA-N	430.486	1.292	50	20	IDGD	
Cc1cc(C(=O)O)c(O)c(S(=O)(=O)NNC(=O)c2ccc(Br)s2)c1	743835711	DXPXFFXUJOCVBY-UHFFFAOYSA-N	435.277	1.846	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CN2CCC(C(=O)Nc3ccc4c(c3)OCO4)CC2)c1	744384780	HSRBVZSPFFQOBW-UHFFFAOYSA-N	438.484	1.835	50	20	IDGD	
CCn1cc(C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)c(=O)c2ccc(C)nc21	744471545	QMIOPYHDHTWCKR-UHFFFAOYSA-N	433.424	1.215	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)c2nc(N3CCCC3)ncc2Cl)c1	744791505	VUEJAVFCCIOHAR-UHFFFAOYSA-N	428.836	1.220	50	20	IDGD	
Cn1ncnc1COc1ccc(S(=O)(=O)NNC(=O)c2ccc(Cl)cc2F)cc1	746598562	HZPARLYLERWSAV-UHFFFAOYSA-N	439.856	1.810	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)c2cc(S(=O)(=O)Nc3ccccc3F)c[nH]2)cc1	747171919	VKFWXRBUJRMXLS-UHFFFAOYSA-N	427.417	1.901	50	20	IDGD	
CC(C)(CO)[C@@H](CNC(=O)NNC(=O)c1csc(N2CCOCC2)n1)c1ccccc1	747462838	KKWXDUOOFTXCAI-INIZCTEOSA-N	447.561	1.726	50	20	IDGD	
C[C@H](C(=O)NNc1ccc(Br)cc1F)N1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O	748200939	IAIMFCPTZADGOA-FVJKAEFOSA-N	426.242	1.582	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCN(C2=NC[C@@H](C)S2)CC1	750840606	SNYXZFOPEWJFDC-GFCCVEGCSA-N	425.942	1.219	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)COc1ccc(Br)cc1Cl	751206318	DMRVGESBGZHYSQ-UHFFFAOYSA-N	430.642	1.652	50	20	IDGD	
Cc1ccc(C(=O)NNS(=O)(=O)c2ccc(C)c(S(=O)(=O)N3CCCCC3)c2)o1	753086057	PRRJBXQQOFHCMJ-UHFFFAOYSA-N	441.531	1.694	50	20	IDGD	
CCOC(=O)c1ccc(N2CC(NC(=O)NNC(=O)C(C)(C)c3ccccc3)C2)nc1	753281598	YPHWGRUPFKZEIJ-UHFFFAOYSA-N	425.489	1.755	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(NC(=O)COC(=O)/C(C#N)=C/c2ccc(O)cc2)c1	754539374	YCIUMRQXUYOECX-XNTDXEJSSA-N	429.454	1.731	50	20	IDGD	
COc1ccccc1NC(=O)c1ccc(NC(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)cc1	755493380	BUCJUONNXPELJC-GFCCVEGCSA-N	449.489	1.038	50	20	IDGD	
Cc1nn(C)c(N2CCOCC2)c1C=NNC(=O)CSc1nc2ccccc2n1C	755773836	BJUXNSHQDIBPEM-UHFFFAOYSA-N	427.534	1.694	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)N[C@H]2CCN(c3c(F)cccc3F)C2=O)cc1C	756212460	QUZRERYYCHWRMF-INIZCTEOSA-N	445.426	1.656	50	20	IDGD	
CS(=O)(=O)Cc1ccccc1NC(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	756269960	VLTYMFKXYAXDFE-UHFFFAOYSA-N	429.458	1.589	50	20	IDGD	
COCCn1ccc(NC(=O)NNC(=O)c2nn(CCC(C)C)c(=O)c3ccccc23)n1	756311277	NDENSSRKRFNEAG-UHFFFAOYSA-N	441.492	1.752	50	20	IDGD	
CN(C)C(=O)Cn1cnc(NC(=O)NNC(=O)c2ccc(COc3ccccc3)o2)n1	756768940	BJFAHFGPDWANKI-UHFFFAOYSA-N	427.421	1.005	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)[C@](C)(O)CN2Cc3ccccc3C2=O)cc1	756797857	SXGDHXDCYQWAKS-IQMFZBJNSA-N	441.484	1.407	50	20	IDGD	
CNC(=O)Cn1nc(NC(=O)NNC(=O)c2sc(-c3ccccc3)nc2C)cc1C	757823836	SZNCYBYRWUUDIF-UHFFFAOYSA-N	427.490	1.836	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2cccc(OCc3noc(C)n3)c2)c2ccccc2c1=O	758071511	KLPUYMPFFACMDT-UHFFFAOYSA-N	448.439	1.762	50	20	IDGD	
CCc1ccc(S(C)(=O)=O)cc1C(=O)NNC(=O)c1nn(CC)c(=O)c2ccccc12	758071570	LKSRWEVUXPSYSU-UHFFFAOYSA-N	442.497	1.457	50	20	IDGD	
N#CCCn1ncc(C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)c1-c1ccccc1	759054082	HQIMQTLFXUCZAE-UHFFFAOYSA-N	442.435	1.953	50	20	IDGD	
Cc1ccnc(-n2nccc2NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)on2)c1	760277627	NYTGSIGQDBJMLK-UHFFFAOYSA-N	431.412	1.630	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CN(CCc2ccccc2)C(C)=O)cc(OC)c1OC	761195861	YFPYXSGSYJEGPX-UHFFFAOYSA-N	429.473	1.565	50	20	IDGD	
COCCC1(CNC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)CCCC1	761768874	QJBQMQFHCYPMRM-UHFFFAOYSA-N	440.566	1.543	50	20	IDGD	
CC[C@H](NC(=O)NNC(=O)Cn1nc(C)cc1C)[C@H]1CN(Cc2ccccc2)CCO1	761796507	YBTVOVITMASKJF-VQTJNVASSA-N	428.537	1.510	50	20	IDGD	
CC(=O)c1ccc(Cl)c(S(=O)(=O)NNC(=O)c2csc(N3CCOCC3)n2)c1	761885156	BJWBGDRAPYXDRH-UHFFFAOYSA-N	444.922	1.459	50	20	IDGD	
C[C@H](CCS(C)(=O)=O)NC(=O)NNC(=O)[C@@H](C)Oc1cccc(Br)c1	761995506	ZEKRMUUJAHXCIL-GHMZBOCLSA-N	436.328	1.370	50	20	IDGD	
CCCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2cccc(C)c2)cc1Cl	763618614	DIUYRITVGQSMTE-UHFFFAOYSA-N	446.891	1.953	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(NC(=O)[C@H]3CCCO3)cc2)c1	763619462	XADMPUGRPJXAKH-GOSISDBHSA-N	440.456	1.277	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)COc2cccc(C)c2)cc1C	763623453	MIDBXQGEAUQLSR-UHFFFAOYSA-N	448.501	1.230	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2c(C)nc3ccccn23)c(Br)n1	763624286	LZTZNZYFRBNQLJ-UHFFFAOYSA-N	431.250	1.508	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccc(C)c(C)c2)n(C2CCOCC2)n1	763679213	IYIQHIJNLMUIJO-UHFFFAOYSA-N	429.477	1.325	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(C(F)(F)F)cnc1O	763680904	ICVOPYLUPZGZAR-UHFFFAOYSA-N	442.350	1.370	50	20	IDGD	
CC(=O)N(Cc1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2F)cc1)C(C)C	763683361	ZXQGFBLWQOANOK-UHFFFAOYSA-N	444.463	1.748	50	20	IDGD	
CCc1ccc(NC(=O)C(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)cc1S(N)(=O)=O	763722720	HIGZHRQICVVHPF-UHFFFAOYSA-N	448.545	1.199	50	20	IDGD	
O=C(CN1CCCc2ccccc21)NNC(=O)C(=O)Nc1cccc(CCN2CCCC2)c1	763737115	XQNFTUDQISNILZ-UHFFFAOYSA-N	449.555	1.864	50	20	IDGD	
Cc1nc(-c2cccc(NC(=O)C(=O)NNC(=O)CN3CCCc4ccccc43)c2)no1	763745436	FWJFXZQZNRXULQ-UHFFFAOYSA-N	434.456	1.584	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cnn(-c3ncccn3)c2)cc1	763769013	ZTIYZKGFBJSLES-UHFFFAOYSA-N	437.460	1.487	50	20	IDGD	
C[C@H](CC(=O)NNC(=O)CNC(=O)c1cccnc1)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	763824389	OMRYLRBKRPDCTE-NVXWUHKLSA-N	447.536	1.632	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(OC)c(N3CCOC3=O)c2)cc1	763834428	OGIMZCQKIFEBFG-UHFFFAOYSA-N	426.429	1.614	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1cccnc1OCC(F)F	763849398	JAEQGLQGQJPFKV-SNVBAGLBSA-N	426.351	1.418	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(C(N)=O)c(C)c2)cc1	763859634	DEGPADYULYNFDU-CYBMUJFWSA-N	428.445	1.046	50	20	IDGD	
C[S@@](=O)c1cccc(NC(=O)C(=O)NNC(=O)c2ccc(COc3ccccc3)o2)c1	763950354	UCXXEGATKPNNBA-WJOKGBTCSA-N	441.465	1.996	50	20	IDGD	
CC(C)(C)c1nc2ccc(NC(=O)C(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)cc2s1	764001967	IBLPNMLOUYKMFW-JTQLQIEISA-N	438.531	1.114	50	20	IDGD	
COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccccc2)on1	764016074	DTNTZPWEBWGZNJ-UHFFFAOYSA-N	425.357	1.658	50	20	IDGD	
COCCOC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(C)cc2O)c1	764109300	JVPBIWGCGNPXCW-UHFFFAOYSA-N	430.417	1.295	50	20	IDGD	
CS(=O)(=O)c1cc(Br)ccc1NC(=O)C(=O)NNC(=O)CC1CCCC1	764183303	FOEDYFMHJJLMQY-UHFFFAOYSA-N	446.323	1.519	50	20	IDGD	
COc1ccc(Sc2ccc(NC(=O)C(=O)NNC(=O)Cc3cc[nH]n3)cc2)cc1	764294385	YAIZDXQPVJVROR-UHFFFAOYSA-N	425.470	1.898	50	20	IDGD	
COCC(=O)NNC(=O)C(=O)Nc1ccc(NC(=O)c2ccoc2)cc1C(F)(F)F	764300569	SXFRWYKVDMWTMN-UHFFFAOYSA-N	428.323	1.283	50	20	IDGD	
CC(C)(C(=O)NNC(=O)C(=O)Nc1ccc(N2CCCS2(=O)=O)cc1)c1ccccc1	764301415	DATYIELGLDABAS-UHFFFAOYSA-N	444.513	1.290	50	20	IDGD	
C[C@H](c1ccc(NC(=O)C(=O)NNC(=O)Cc2ccccc2F)cc1)N1CCOCC1	764314489	YCGBXAQLAZSRFW-OAHLLOKOSA-N	428.464	1.548	50	20	IDGD	
CCOCC(=O)NNC(=O)C(=O)Nc1ccc(CN2C(=O)Cc3ccc(Cl)cc32)cc1	764320099	VYGPGTDBBDIHJW-UHFFFAOYSA-N	444.875	1.552	50	20	IDGD	
O=C(CCCc1cccs1)NNC(=O)C(=O)Nc1ccc(C[C@H]2CC(=O)NC2=O)cc1	764340425	CAVVJMYRTFITLA-AWEZNQCLSA-N	442.497	1.062	50	20	IDGD	
Cc1cccc(Cn2nccc2NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c1	764345510	GQBKAUWXLRZYDF-UHFFFAOYSA-N	443.467	1.825	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)NC(=O)CC3)n[nH]1	764377928	SWBFIQPDIOALQE-UHFFFAOYSA-N	448.439	1.370	50	20	IDGD	
CCC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)cc1	764382329	HACKCKATESTVMP-UHFFFAOYSA-N	426.458	1.886	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1ccc(C(=O)NC(C)C)cc1	764396887	DDFFMLYNMSSBAB-UHFFFAOYSA-N	444.513	1.712	50	20	IDGD	
O=C(NNC(=O)[C@H]1COCCO1)C(=O)Nc1ccccc1S[C@@H](Cl)C(F)(F)F	764424996	LYBVPSOZUIPQOX-YMTOWFKASA-N	441.815	1.407	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)C(=O)Nc2ccc(OCc3ccccc3)nc2)c1	764433685	QEWZRTJOAICXMP-UHFFFAOYSA-N	448.439	1.414	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cn(-c4ccc(C)cc4)nn3)CC2)cc1	765749961	WTXRRNZDQFGDTK-UHFFFAOYSA-N	447.543	1.463	50	20	IDGD	
Cn1nc2c(c1C(=O)NNC(=O)CN1CCN(Cc3ccc(Cl)cc3)CC1)CCCC2	766664795	UMUOBEPUUDZOFS-UHFFFAOYSA-N	444.967	1.531	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)CCC(=O)NC1CCCC1	767769936	WUUBGCOBGULVCF-UHFFFAOYSA-N	425.869	1.492	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)N[C@H]3CCCN(c4ccc(OC(F)F)cc4)C3)nc21	770399889	MTOXDTCJVJNTML-NSHDSACASA-N	448.434	1.965	50	20	IDGD	
CCOC(=O)Cn1cccc(NC(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)c1=O	770624864	LWXDOEZFCDSJIE-GFCCVEGCSA-N	436.852	1.685	50	20	IDGD	
C[C@@H]1C[C@H](NC(=O)OC(C)(C)C)CCN1C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	771945392	ALWPJUDSPDAWCS-UKRRQHHQSA-N	444.496	1.394	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)C(C)(C)S(=O)(=O)c1ccc(Br)cc1	772067551	DYAVLXNVRFMRGR-JTQLQIEISA-N	449.323	1.491	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)[C@H]1CCCN(C(=O)N2CCc3sccc3C2)C1	772159331	PJVHBLZULSUEFB-HIFRSBDPSA-N	436.534	1.427	50	20	IDGD	
CCOC(=O)CON=C(C(=O)NNC(=O)c1c(Cl)cccc1Cl)c1cc[nH]n1	772207716	XLSMVUOQLLQQMU-UHFFFAOYSA-N	428.232	1.462	50	20	IDGD	
CNC(=O)COc1ccc(C(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)cc1OC	772993286	ACKVETILCNYOPZ-GFCCVEGCSA-N	435.864	1.702	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)C(=O)Nc2cccc(F)c2I)n1	773479609	AXQVTEWISXIRRO-UHFFFAOYSA-N	429.193	1.919	50	20	IDGD	
CN(C)c1nccc(NNC(=O)C(=O)Nc2cccc3cncc(Br)c23)n1	773674737	PRWPPKPMSOKLJN-UHFFFAOYSA-N	430.266	1.935	50	20	IDGD	
Cc1ccc(C(=O)N2CCOCC2)cc1NC(=O)C(=O)NNc1cnc2ccccc2n1	773716726	OIMQVQRIQFYTDR-UHFFFAOYSA-N	434.456	1.492	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1cn(C)nc1C(F)(F)F	774007489	AFSGIUGNVVFSDX-MRVPVSSYSA-N	433.774	1.646	50	20	IDGD	
O=C(COC(=O)c1ccc(N2C(=O)CCC2=O)cc1)NNC(=O)c1cccc(Cl)c1	774820412	XVEALLNZNQSZDH-UHFFFAOYSA-N	429.816	1.611	50	20	IDGD	
COc1ccc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)nc1	775090706	XSBAOYZMWIZERN-UHFFFAOYSA-N	447.517	1.409	50	20	IDGD	
C[C@H](NCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)c1ccc(N2CCOCC2)cc1	775259907	LOLYDFXPTNCSQG-HNNXBMFYSA-N	427.461	1.543	50	20	IDGD	
O=C(NNC(=O)c1ccc(Br)s1)Nc1ccnn1[C@@H]1CCS(=O)(=O)C1	776059741	RFABNLRAMWOZDW-MRVPVSSYSA-N	448.324	1.533	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCCc2nn(C)c3ccccc23)nc1	776177851	BIOTYJOODCBTDD-UHFFFAOYSA-N	431.522	1.524	50	20	IDGD	
O=C(NNC(=O)[C@@]1(F)CCN(C(=O)OCc2ccccc2)C1)c1ccc2c(c1)OCCO2	776757834	ADMMJWALQJEOAC-JOCHJYFZSA-N	443.431	1.970	50	20	IDGD	
CC1CCC2(CC1)OC[C@@H](CNC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)O2	776949427	MRZLBMXIGHIJGL-SHBDPFAUSA-N	440.522	1.748	50	20	IDGD	
CC(C)Oc1ccc(NC(=S)NNC(=O)c2cc(S(=O)(=O)N(C)C)cn2C)cc1	778673525	FRWUTTDPOOCANN-UHFFFAOYSA-N	439.563	1.694	50	20	IDGD	
COc1ccc(Cn2ccc(NC(=O)C(=O)NNC(=O)c3ccc(O)c(Cl)c3)n2)cc1	778711139	CKSZBUQFMJKCHO-UHFFFAOYSA-N	443.847	1.699	50	20	IDGD	
C[C@]1(NNC(=O)N[C@H]2CCN(c3ccc(Cl)c(Cl)c3)C2=O)CCS(=O)(=O)C1	779380411	RPBFHKZBIAJSEP-BBRMVZONSA-N	435.333	1.480	50	20	IDGD	
COC(=O)CNC(=O)NNS(=O)(=O)c1cc(Br)cc(C(F)(F)F)c1	779846726	OLTLWGQCYWPTQQ-UHFFFAOYSA-N	434.190	1.133	50	20	IDGD	
C[C@@H]1CN(CC(C)(C)O)CCN1C(=O)CCC(=O)C(C#N)=C1N(C)c2ccccc2N1C	781222536	LWBXKRIWVPLXSQ-QGZVFWFLSA-N	439.560	1.961	50	20	IDGD	
CC(C)S(=O)(=O)c1ccc(CC(=O)NNC(=O)c2nnc(O)c3ccccc23)cc1	781235667	HSJNYWYAMVAVNB-UHFFFAOYSA-N	428.470	1.521	50	20	IDGD	
CCCn1c(CCC(=O)NNc2ncncc2Cl)nc2cc(S(N)(=O)=O)ccc21	781820166	RUHDPBTYLCJJBO-UHFFFAOYSA-N	437.913	1.613	50	20	IDGD	
O=C1C[C@H](Cc2ccc(NC(=O)C(=O)NNc3ccc(Cl)cc3[N+](=O)[O-])cc2)C(=O)N1	783291258	KORJGEUKMFVHIZ-NSHDSACASA-N	445.819	1.535	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2ccc(Oc3ccccc3C#N)c(F)c2)CCS(=O)(=O)C1	783424241	CQMJYDAKTFAEQY-FQEVSTJZSA-N	446.460	1.626	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NN[C@@]2(C)CCS(=O)(=O)C2)cc1OC1CCCC1	783427364	RTUGBBUNOOXPOX-IBGZPJMESA-N	425.507	1.153	50	20	IDGD	
O=C(NNc1ccc(-n2cccn2)nn1)C(=O)Nc1ccccc1OC[C@@H]1CCCCO1	783433214	OPYVGIKUDDBQSP-HNNXBMFYSA-N	437.460	1.692	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ccc(-n3cccn3)nn2)c(OCC(F)(F)F)c1	783435947	DHEORNSCQGPMMS-UHFFFAOYSA-N	435.366	1.994	50	20	IDGD	
COC(=O)C1(CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)CCCCC1	784171304	JGHJXLWEOMOUIU-UHFFFAOYSA-N	425.511	1.047	50	20	IDGD	
C[C@H](C#N)Oc1ccccc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	784210214	IMTUGXZLBRPQIV-CYBMUJFWSA-N	443.485	1.500	50	20	IDGD	
NC(=O)[C@H]1CCC[C@H](C(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)C1	786723424	OXJURGROJMDDHI-OALUTQOASA-N	447.499	1.441	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)[C@@H]3CCCc4c(O)cccc43)cc2)CC1	789819064	WSCVYNOXFHDAAL-HXUWFJFHSA-N	444.557	1.892	50	20	IDGD	
COc1cccc(NNC(=O)NC[C@@H](Cc2cccc(F)c2)C(=O)N2CCOCC2)n1	789841604	FTVXJTUUPHWBMX-MRXNPFEDSA-N	431.468	1.573	50	20	IDGD	
CO[C@@H]1CCOc2c(NC(=O)C(=O)NNC(=O)COc3cc(C)ccc3C)cccc21	790952135	OOTFEMVUJFKTSX-QGZVFWFLSA-N	427.457	1.938	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2cccc(C(=O)NNc3nc4ccccn4n3)c2)C[C@H](C)O1	791242543	REMUADBGFKOFKX-KBPBESRZSA-N	430.490	1.284	50	20	IDGD	
O=C(CN1CCNC(=O)[C@H]1c1ccc(OC(F)(F)F)cc1)NNC(=O)c1cccs1	792359401	IKRXMNZMOUFQBK-OAHLLOKOSA-N	442.419	1.581	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1cc(F)ccc1-n1cccn1	792810316	RESRJKRXFUCZKH-UHFFFAOYSA-N	430.465	1.688	50	20	IDGD	
Cc1ccc(N2N=C(Br)C[C@@H]2C(=O)N([C@@H]2CCS(=O)(=O)C2)N(C)C)cc1	792855787	SYWPPRAGYSFPHH-HUUCEWRRSA-N	443.367	1.774	50	20	IDGD	
C[C@@]1(C(N)=O)CCN(C(=O)NNC(=O)[C@H]2Cc3ccccc3CN2Cc2ccccc2)C1	792879437	KJYZIGKASRPBGI-HYBUGGRVSA-N	435.528	1.552	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CN2CCN(c3cccc(Br)c3)CC2)c1	792934616	ZBYGQTBTVSXLLY-UHFFFAOYSA-N	442.317	1.904	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2cc(Br)c(O)nc2C)c2ccccc2c1=O	794774010	BEFYPAKEAMAKNG-UHFFFAOYSA-N	446.261	1.663	50	20	IDGD	
O=C(COC(=O)c1nc(Br)ccc1F)NNC(=O)c1cccc([N+](=O)[O-])c1	795855252	HXEDQNXJCVSVHK-UHFFFAOYSA-N	441.169	1.509	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2cccc(CN(C)Cc3cscn3)c2)n1	797370194	VRQBSXNZJYVNBU-UHFFFAOYSA-N	438.513	1.878	50	20	IDGD	
O=C(NCc1c(F)cc(F)c(F)c1F)NNC(=O)c1csc(N2CCOCC2)n1	797521066	PDEARAUNDUQYQX-UHFFFAOYSA-N	433.387	1.680	50	20	IDGD	
O=C(NCc1cc(Cl)ccc1N1CCOCC1)NNC(=O)c1cc([N+](=O)[O-])ccc1O	798488927	GKPHIGMVBWVACX-UHFFFAOYSA-N	449.851	1.935	50	20	IDGD	
CCCCNS(=O)(=O)c1ccc(C)c(NC(=O)C(=O)NNC(=O)c2ccccc2C)c1	799835595	UXIUJVSSPRQWDS-UHFFFAOYSA-N	446.529	1.782	50	20	IDGD	
COc1ccc(CCN2C[C@@H](C(=O)NNC(=O)Nc3ccccc3)CC2=O)cc1OC	801992082	XVZRLCKGPBKYEA-INIZCTEOSA-N	426.473	1.948	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)CCC/N=C2/NS(=O)(=O)c3ccccc32)cc1	802056473	PMLCBFTYZSSEEH-UHFFFAOYSA-N	431.474	1.367	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@@H](c2ccccc2)N2CCC(O)CC2)cc1	802068192	DOCYJBHKRWKBID-LJQANCHMSA-N	446.529	1.441	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)[C@H](c2cnn(C)c2)N(C)C(=O)OC(C)(C)C)c1O	806550436	FIVQXBBPZVAMAZ-HNNXBMFYSA-N	433.465	1.504	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)Nc1cc(C(F)(F)F)cc(Br)n1	806801223	SLADSUALJMUZJT-ZCFIWIBFSA-N	445.217	1.450	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)CNS(=O)(=O)c2c(Cl)cccc2Cl)cc1	810267645	BZKFGHFWHYRCRU-UHFFFAOYSA-N	427.269	1.605	50	20	IDGD	
CC1(C)CCCc2sc(NC(=O)C(=O)NNC(=O)c3nnc(O)c4ccccc34)nc21	810385812	ACJNYYLAUAJGEB-UHFFFAOYSA-N	440.485	1.806	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NC[Si](C)(C)c2ccccc2)c1	812213764	JTOKYUWMNLCCQG-UHFFFAOYSA-N	434.594	1.036	50	20	IDGD	
CC(C)S(=O)(=O)CCNC(=O)NNC(=O)COc1ccccc1Cc1ccccc1	812439659	PFZQSYNEIUJFKZ-UHFFFAOYSA-N	433.530	1.810	50	20	IDGD	
COc1ccnc(NNC(=O)NCc2cccc(N3C(=O)NC4(CCCC4)C3=O)c2)n1	812560532	IRNRGMIWERXDRR-UHFFFAOYSA-N	425.449	1.681	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NN=Cc1n[nH]cc1C)N(S(C)(=O)=O)CC2	814759225	VWIMKFNZVPRBIQ-INIZCTEOSA-N	435.506	1.135	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)cc1)C1CC1	815570947	PTZUZUQYQFNYSZ-UHFFFAOYSA-N	442.497	1.786	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCc2nncn2C1)C(=O)Nc1ccccc1COCc1ccccc1	815692574	VGPAHHYCBCQRCY-KRWDZBQOSA-N	448.483	1.343	50	20	IDGD	
C[C@](O)(C(=O)N1CCN(S(=O)(=O)CBr)CC1)c1ccc(Cl)cc1	815965023	ZZOAKBGQBRKBAC-CQSZACIVSA-N	425.732	1.374	50	20	IDGD	
COc1ccc(NC(=O)COc2ccc(C(=O)NNc3cnnn3C)cc2OC)cc1	816769648	QIRYMYADIZZHNP-UHFFFAOYSA-N	426.433	1.607	50	20	IDGD	
O=C(Cc1cncc(O)c1)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	816831298	NXEBTVUWWAQDCX-UHFFFAOYSA-N	429.440	1.493	50	20	IDGD	
O=C(CC1CC1)NNC(=O)c1ccc(NS(=O)(=O)c2ccc3nc(O)[nH]c3c2)cc1	819140826	PRMWGMARWJKAJL-UHFFFAOYSA-N	429.458	1.630	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)Cn2c(S)nnc2-c2ccc(C)cc2)cc1	825548618	CVDAVLFMQNSMQM-UHFFFAOYSA-N	426.502	1.810	50	20	IDGD	
O=C(COC(=O)CCc1nnc(-c2ccsc2)o1)NNC(=O)c1ccc([N+](=O)[O-])cc1	904227670	NLJDVNXBXVRCCQ-UHFFFAOYSA-N	445.413	1.643	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)NCC(=O)NNC(=S)Nc2ccc(C)c(C)c2)cc1	913434320	HKSFPOYGCLCPOI-UHFFFAOYSA-N	449.558	1.558	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)CNS(=O)(=O)c1ccc2ccccc2c1	913446125	QICYGILWXZCQTI-UHFFFAOYSA-N	443.481	1.353	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCC(C)(C)N2C[C@H](C)O[C@H](C)C2)nc1	916234442	GCMUFDKFCJSQHY-GASCZTMLSA-N	442.586	1.282	50	20	IDGD	
CC1CCN(c2ccc(CNC(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)cn2)CC1	916389321	WZXWAUSXAIOSMH-UHFFFAOYSA-N	445.545	1.866	50	20	IDGD	
O=C(NCc1ccc(OCC(F)(F)F)nc1)NNC(=O)[C@H]1COc2ccccc2O1	916397586	FDNDTYWUAGVFOD-CQSZACIVSA-N	426.351	1.693	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCN2CCC[C@H](C)C2)c1	916452282	GXXUXLOIGDYBPL-INIZCTEOSA-N	439.582	1.393	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)N[C@H]2CCCN(Cc3ccccc3)C2)c2ccccc2c1=O	916607876	ZLLOQKKOYBJBKW-KRWDZBQOSA-N	434.500	1.542	50	20	IDGD	
Cc1cnn(-c2ccc(C(=O)OCC(=O)NNC(=O)[C@H]3COc4ccccc4O3)cc2)c1	917286919	YLFSCZRRXZJVPV-LJQANCHMSA-N	436.424	1.325	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)CCNC(=O)c2ccc3ccccc3c2)c2ccccc2c1=O	917387328	OTLDKIDRTCNHOE-UHFFFAOYSA-N	443.463	1.668	50	20	IDGD	
CCCn1nc(C(=O)NNS(=O)(=O)c2cc(C(=O)O)ccc2F)c2ccccc2c1=O	918062414	SAVQJCOPTXQKOH-UHFFFAOYSA-N	448.432	1.267	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)CN1CCCCC1	918104554	RFDHBSUOMNEIQB-FQEVSTJZSA-N	430.597	1.651	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)c1ccc(S(=O)(=O)N(C)C)cc1	918106662	ZASHBJXDGVYLEM-LBPRGKRZSA-N	435.462	1.550	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2CCCN2Cc2ccccc2)c1	918758320	MRZDWBKNOPRYCP-IBGZPJMESA-N	430.530	1.363	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)N3CCC[C@H](CNS(C)(=O)=O)C3)cc2C1	918779518	YAXJLGWAXRIYNV-QWHCGFSZSA-N	428.580	1.489	50	20	IDGD	
COc1ccc(/C=C(\C#N)C(=O)OCc2nnnn2-c2ccc(S(C)(=O)=O)cc2)cc1	918864243	OANATOFSPKEAKW-RVDMUPIBSA-N	439.453	1.725	50	20	IDGD	
CS(=O)(=O)CC(=O)NNC(=O)CSc1nnc(-c2ccccc2)n1-c1ccccc1	919679850	KPVAAFIFFRLAMN-UHFFFAOYSA-N	445.526	1.218	50	20	IDGD	
O=C(NCC1(c2ccc(F)cc2)CCOCC1)NNC(=O)c1ccc(-n2cnnn2)cc1	919917762	CQXPDMPRLDFXOW-UHFFFAOYSA-N	439.451	1.494	50	20	IDGD	
CC(C)C(=O)NNC(=O)/C(C#N)=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	920849992	NZUGQGKWPYVKLZ-ZROIWOOFSA-N	428.880	1.789	50	20	IDGD	
C[S@@](=O)CCCNC(=O)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1	1121903528	SGTGQBAJHVYRKX-WENCNXQZSA-N	428.558	1.713	50	20	IDGD	
CNS(=O)(=O)c1ccc(Br)c(C(=O)NNC(=O)c2ccccc2C)c1	1317704139	JWKJWQNZJANUDZ-UHFFFAOYSA-N	426.292	1.740	50	20	IDGD	
Cn1c(=O)n(C)c2cc(S(=O)(=O)NNC(=O)c3ccc(Br)cc3)ccc21	1318113056	FJCRIBUOIBTDFO-UHFFFAOYSA-N	439.291	1.263	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@H](C(=O)NNC(=O)c2ccccc2Cl)[C@@H](C)O)cc1	1319920865	WBGQKJDJMRJHTI-WBMJQRKESA-N	425.894	1.137	50	20	IDGD	
CC(C)CN(CC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)C(=O)OC(C)(C)C	1322546228	DXZZUXUVLMRWQC-UHFFFAOYSA-N	431.493	1.588	50	20	IDGD	
C[C@@H](CC(=O)NNc1cncc(Br)c1)/N=C1/NS(=O)(=O)c2ccccc21	1323072615	VXZFFRCZHBIDQC-JTQLQIEISA-N	438.307	1.805	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCC(C(=O)NNc3nncc(N)c3Cl)CC2)cc1	1324047148	FWDOUBVXGVNPGI-UHFFFAOYSA-N	440.913	1.265	50	20	IDGD	
COC(=O)c1ccc(F)c(S(=O)(=O)NNC(=O)c2ccc(Br)cc2)c1	1324230940	OOTUHSKXLUOBAW-UHFFFAOYSA-N	431.239	1.998	50	20	IDGD	
CC(C)c1nn([C@@H]2CCS(=O)(=O)C2)cc1C(=O)NNC(=O)Cc1cn2ccccc2n1	1330403342	DEBKOJPQOJQBAM-OAHLLOKOSA-N	444.517	1.018	50	20	IDGD	
O=C(c1n[nH]c2ccccc12)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1778520747	XPPNBZGKICTISJ-WMLDXEAASA-N	425.258	1.697	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cn4ccsc4n3)C2)C1	1778623559	IVXJDZYHCUSABC-SJKOYZFVSA-N	441.351	1.870	50	20	IDGD	
Cn1c(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)cc2c[nH]c3nccc-3c21	1780035164	IXBBXMKGQXPNEB-IERDGZPVSA-N	445.907	1.049	50	20	IDGD	
O=C(c1n[nH]c2c1CCc1ncccc1-2)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Cl)CCO2	1780037136	FXFCWDTXXWIJBT-XLIONFOSSA-N	433.871	1.548	50	20	IDGD	
CCSc1cccnc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2	1780260521	WYGOIUDVFNUDPM-YYFZDKIDSA-N	441.981	1.921	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3nc4cc([N+](=O)[O-])ccc4[nH]3)CCO2)C1	1781220343	YRLLRZBOUFTMEO-BFUOFWGJSA-N	435.868	1.932	50	20	IDGD	
Cc1nn(C)c(C)c1CC(=O)N1CCO[C@@]2(CCN(C(=O)[C@](C)(Cl)CCl)C2)C1	1781231956	BZVUFOQJVNPTBY-MOPGFXCFSA-N	431.364	1.646	50	20	IDGD	
N[C@H](C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1)c1cccc(Cl)c1	1781331397	QATRHFKRLFUJGL-VBQJREDUSA-N	448.720	1.860	50	20	IDGD	
O=C(c1n[nH]c2c(F)cccc12)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781332178	VHZUWPYAYIVQSN-PBHICJAKSA-N	443.248	1.836	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](F)Br)C3)C2)c1	1781334949	QIJOTEMRWTYSMS-YJBOKZPZSA-N	442.285	1.779	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)COc2ccc(O)nn2)C1	1781493854	RQNIADUCDYKATF-PJIJBLCYSA-N	426.901	1.092	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(C#N)cc3Cl)C2)C1	1781972407	BDMPBRGYDGFCGN-NRFANRHFSA-N	447.923	1.028	50	20	IDGD	
Cc1cc(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](C)Br)C2)n[nH]1	1781998204	VKVUFBZMYGFJEA-JCKWVBRZSA-N	427.343	1.558	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cc4cccnn4c3)CCO2)C1	1783354152	UYRXKKJHUCECSA-QFBILLFUSA-N	435.322	1.951	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)Cc3cc4ccccc4n3C)CCO2)C1	1783867843	BWILDVKOJATSCU-GCJKJVERSA-N	433.936	1.805	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(C)(C)NCCC#N)C[C@@H]21	1783967161	CTECBTHUMIQDGX-UGUYLWEFSA-N	443.386	1.279	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)Cc3cc(F)ccc3[N+](=O)[O-])C2)C1	1785533638	XTNACJLXUDYMFP-KXBFYZLASA-N	443.859	1.360	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(=O)c3ccccc3)[C@H]2C1	1786338039	DFHGQKBTUUADCF-HJWJTTGWSA-N	437.334	1.880	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC1(c2ccc(NC(=O)Cn3ccnc3)cc2)CCC1	1787485425	VOUAOWGMNCQACY-UHFFFAOYSA-N	433.472	1.330	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)c1cnn2ccccc12	1787854251	ZNVXKWFRFJGILC-DLKVLKDVSA-N	439.285	1.618	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cn4ncccc4n3)[C@H]2C1	1788017702	OILALBZYEQLHOL-NGOJXBLDSA-N	440.331	1.559	50	20	IDGD	
Cc1nnc(CC(=O)Nc2ccc(C3(NC(=O)c4cnccc4C(=O)NN)CCC3)cc2)o1	1788195107	FPWMHPAZWNHFOY-UHFFFAOYSA-N	449.471	1.367	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nc[nH]c3[N+](=O)[O-])C[C@@H]21	1789866739	YPIXCZGNDUTZGA-ZGNZKYAMSA-N	434.280	1.148	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cn3cc(Cl)cn3)C[C@@H]21	1791058303	VXKOKFOWCOQJTM-IMIFBBOLSA-N	433.734	1.300	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(F)c(C)c3N)C[C@@H]21	1791251748	UPTKWQRWLJGDQX-FAYQHZLMSA-N	427.904	1.563	50	20	IDGD	
CSCC[C@@H](O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)CBr)C[C@@H]21	1791303993	RDHQRJJKLNMJKM-LXFSFDBISA-N	437.400	1.111	50	20	IDGD	
C[C@H]1Oc2ccc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)C(C)(C)CCl)cc2NC1=O	1792784032	JHTBFWPHHWKNNW-LJGDNWOOSA-N	449.935	1.874	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1nc(Cl)ccc1F	1794234884	AHYMDVBPINODMT-LVNATWPUSA-N	438.656	1.768	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnc[nH]1	1795065967	RKJVDTJHBLNIOL-CRWXNKLISA-N	425.917	1.794	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc2c(n1)OCCO2)[C@H](F)Br	1796720774	HIHKQFYOETUEDL-MIJXAVMKSA-N	428.258	1.795	50	20	IDGD	
C[C@@H]1CCc2c(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@](C)(Cl)CCl)C4)n[nH]c21	1796972412	SHPBDTGQHCYHMT-FOHZDRRLSA-N	429.348	1.899	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccn(C(F)F)n1	1798163238	OUMMHFABZGLLAU-NOHGZBONSA-N	435.269	1.655	50	20	IDGD	
CN(C)c1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Br)C3)cn1	1798262406	OJLJFXFVSWTLKT-NEBZKDRISA-N	429.290	1.041	50	20	IDGD	
CC(C)(C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Br)c1ccccn1	1799351817	BNHAIHJSZAUCFU-NEBZKDRISA-N	428.302	1.639	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(C)ccc1-n1ccnn1	1799864977	HCLZXDPRRVNTPG-HIRMHNASSA-N	447.923	1.033	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@](C)(Cl)CCl)C2	1800230984	GVSWVYXHSWSKAW-GUFWIUQMSA-N	425.309	1.374	50	20	IDGD	
COC[C@@H](NC(C)=O)C(=O)N1CCC2(CCCN(C(=O)[C@H](C)CBr)C2)CC1	1805385299	VYZIWHGFJPKQSL-GDBMZVCRSA-N	446.386	1.400	50	20	IDGD	
Cc1occc1C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1807364014	RQCWOYVFSVKKJX-WIYYLYMNSA-N	433.273	1.296	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)Cn2cncn2)[C@@H]1c1cccnc1	1807604836	WYSAOXFWMAQIJU-ZOBUZTSGSA-N	435.326	1.553	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)CNC(=O)C(F)(F)F)[C@H]1c1cccnc1	1808277310	BMRWJOMWIUEEMV-YDHLFZDLSA-N	434.846	1.783	50	20	IDGD	
O=C1C[C@H](C(=O)N2CC[C@H](CNC(=O)[C@@H](F)Br)[C@@H]2c2cccnc2)CCN1	1808678639	MDSUKHKSTQZCSS-XABYNWHXSA-N	441.301	1.304	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1ccccc1	1811662855	BPEBYZMPVGQUDF-IRLDBZIGSA-N	429.285	1.395	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)[C@H]2CC=CCC2)[C@@H]1c1cccnc1	1813073110	MJXGRSSFJUYNMK-LRXVAGHRSA-N	427.549	1.817	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2CC[C@@H]3CCC(=O)N3C2)[nH]n1)[C@@H](O)CCl	1814872416	JTZYOMICPRJACB-VDERGJSUSA-N	437.928	1.403	50	20	IDGD	
Cc1ccc(CC(=O)N[C@@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)cc1	1815355128	NTJPGUIGPQWHNC-GOSISDBHSA-N	449.341	1.600	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@H](F)Br)[nH]n1)c1ccc(O)nn1	1816297868	JZGUQVQIQFULHZ-MFKMUULPSA-N	427.234	1.902	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CN(C)C)n[nH]1	1816853315	IODDRXISJXGVCH-OHHQFBAHSA-N	428.497	1.097	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)C2=CCCS2)[nH]n1)c1ccc(B(O)O)cc1	1817469767	DWYPMDHYCGBWKU-INIZCTEOSA-N	426.307	1.416	50	20	IDGD	
CSCC(C)(C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1	1817474093	LWGCNDSBXUXTNH-KRWDZBQOSA-N	444.366	1.785	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc(F)nc2)[nH]n1)c1cccc(B(O)O)c1	1817476989	VDGUOGDGCKCBIK-QGZVFWFLSA-N	437.240	1.243	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3ncn(C(C)C)n3)sc2C1	1817689830	BTZZDKVRXGCZQQ-MNOVXSKESA-N	426.930	1.795	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)/C=N/N2CCCCC2)n[nH]1	1819396432	SWXXJAPQYQQXEW-HINJULBWSA-N	446.556	1.247	50	20	IDGD	
Cc1ccc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cnccc4C(=O)NN)sc3C2)o1	1819793564	PSTLVIKTCLEAIK-LLVKDONJSA-N	440.485	1.583	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](O)CCl)CC2)c1ccc(-n2cccn2)nc1	1820732566	PVOURVITFSOLQI-JSGCOSHPSA-N	446.920	1.549	50	20	IDGD	
CCN(CC)C[C@H](C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1	1821680134	OEGIXWLFKIPROW-FUHWJXTLSA-N	449.600	1.753	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)Cn2cc([N+](=O)[O-])cn2)[nH]n1	1822367381	MVIXYFFXFYBSTP-TZMCWYRMSA-N	439.860	1.461	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)COc2ccc(O)nn2)[nH]n1	1822376621	NROSBSBYIWBHFG-AAEUAGOBSA-N	438.872	1.230	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)C3(N4CCN(C)CC4)CC3)sc2C1	1822719923	ZNEUVRXPOBKXFJ-KBPBESRZSA-N	440.013	1.853	50	20	IDGD	
CCOC(=O)N[C@@H](O)C(=O)N1CCC([C@H]2CCCCN2C(=O)C(C)(C)CCl)CC1	1824013820	RYAZECRARZNSAT-CVEARBPZSA-N	431.961	1.936	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H]1CCC(=O)NC1)CC2	1825440294	OCQAHBKUQYEJQX-VWYCJHECSA-N	443.367	1.755	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)/C=C\C(=O)NC1CC1)CC2	1826000513	UWMBZSGLXPYYQL-UXFRKABBSA-N	426.926	1.144	50	20	IDGD	
C#CCCCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1)CC2	1826037520	KYMNUIZYSGPXQY-WOLHVBPDSA-N	440.529	1.993	50	20	IDGD	
C[C@H]1CCc2c(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)C(C)(C)CCl)CCO4)n[nH]c21	1830362124	MBHADIIBAPYSBG-LHSJRXKWSA-N	438.956	1.794	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H](F)Br)CC1	1830381585	HVCZKYVWFVRPLV-XNRPHZJLSA-N	432.334	1.987	50	20	IDGD	
CC(=O)C(C)(C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)CBr)C2)C1	1831117200	RLHPJVFAKNMHAT-FZKQIMNGSA-N	433.343	1.089	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(OC)cn3)C2)C1	1831647651	XYXYFOPSDMPCPG-UZLBHIALSA-N	425.913	1.568	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CN2CCOCC2)CC1	1831651252	RPMQJTPPXXMRLV-WBVHZDCISA-N	430.387	1.722	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H](C)Br)CC1	1831652856	KSSBBFORAZFAJO-VHDGCEQUSA-N	431.375	1.836	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)C2=COCCC2)CC1	1831915374	PWBVFWFLOFDNJH-OAQYLSRUSA-N	426.322	1.294	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2cnccn2)CC1	1832299203	FGNIKHWVBRZYQN-HYGBKTPJSA-N	448.332	1.103	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3cccc(C)n3)CCO2)C1	1832618679	NHECSSIWOZYRAC-RXVVDRJESA-N	439.940	1.033	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3ccco3)CCO2)C1	1833052756	WRXAHPXAMIZSQX-VQIMIIECSA-N	443.338	1.842	50	20	IDGD	
CN1CCC(C(=O)NC2CCN(C3CCN(C(=O)CO[Si](C)(C)C)CC3)CC2)CC1	1833104143	NENPYUNGMGLDQE-UHFFFAOYSA-N	438.689	1.751	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)c3cnnn3C)CC2)CC1	1833896407	HBJRVMXGHPOJJD-ZDUSSCGKSA-N	441.374	1.031	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)c1c(F)ccnc1Cl	1833901743	HXOZOMQVEIEVLU-HNNXBMFYSA-N	447.338	1.659	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](C)CBr)C3)C2)c(C)o1	1834090622	OCGCPQJJZNKDDS-ORAYPTAESA-N	443.338	1.997	50	20	IDGD	
CC(C)N(C)CC(=O)N1CCC(N2CCC(NC(=O)CCBr)CC2)CC1	1834423295	DVZQOYURTCSATK-UHFFFAOYSA-N	431.419	1.683	50	20	IDGD	
Cc1cnoc1C(=O)N1CCC(N2CCC(NC(=O)CCBr)CC2)CC1	1834423462	ZCZPQBPIARCXLC-UHFFFAOYSA-N	427.343	1.953	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)c3cccnc3Cl)C2)C1	1834820264	UOQWVVFVVVVORQ-KRWDZBQOSA-N	446.729	1.590	50	20	IDGD	
O=C(CCc1cccnc1)N1CCOC[C@]2(C1)CN(C(=O)CCBr)CCO2	1834822477	PLOVMWFCLWSCPL-IBGZPJMESA-N	440.338	1.256	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCBr)CCO3)C2)ccn1	1834823343	OYSABMKMXVZVON-GOSISDBHSA-N	426.311	1.245	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)c3cccc(F)c3F)C2)C1	1834823839	MKVQZWGRILZDCH-GOSISDBHSA-N	447.276	1.820	50	20	IDGD	
CCN(CC)C[C@H](C)C(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836718721	ATTREBXMPHTOCX-QFBILLFUSA-N	432.005	1.563	50	20	IDGD	
O=C(c1cc2c(s1)CCCC2)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1	1836875510	HHYIWGVJTIELCR-QRWLVFNGSA-N	442.965	1.297	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@H](O)NC(=O)OCC)CC2)CC1	1836923438	XKHNZHFUTJYZCA-IRXDYDNUSA-N	447.960	1.457	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc4cn[nH]c4cn3)CCO2)C1	1837192159	FUEULAGBCNTBAM-HXUWFJFHSA-N	435.912	1.293	50	20	IDGD	
O=C1Nc2ccccc2/C1=C/C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1837322493	CWPHZWSGRDCCHA-BIRGUMQJSA-N	437.855	1.013	50	20	IDGD	
O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(F)n1)CCO2	1837905545	SMVROZMWDGBMDL-KRWDZBQOSA-N	430.274	1.076	50	20	IDGD	
C/C(=C/C(=O)N1CCC(OC2CCN(C(=O)[C@H](F)Br)CC2)CC1)C(=O)O	1838649271	AQKODNZXKSKFNJ-WOLCWHLNSA-N	435.290	1.706	50	20	IDGD	
CC(C)c1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)n[nH]1	1838700241	WIJAMFDAINVDOG-SCLBCKFNSA-N	443.342	1.387	50	20	IDGD	
CC[C@H](C)[C@H](O)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2	1839150395	LDMHCOYIMDFHNY-ZZCKCESHSA-N	425.353	1.086	50	20	IDGD	
CC(C)=NO[C@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCBr)C2)C1	1839224398	RBHWNEITQLSOLV-RHSMWYFYSA-N	434.331	1.029	50	20	IDGD	
O=C(c1ccc(Cl)c(F)c1)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1	1839269672	QSMKIKOIIVVREY-QAPCUYQASA-N	435.279	1.149	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)cc(C)c1C(=O)O	1839480399	GCHJRQCVCIZEDI-JXFKEZNVSA-N	442.871	1.606	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(F)cn3C)C2)C1	1839964617	XKHAIQHQUGWXDT-KBXCAEBGSA-N	446.317	1.408	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3c(C)n[nH]c3C)C2)C1	1839965227	QZNZXFSPNDQEIQ-KSSFIOAISA-N	443.342	1.270	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)nc1C	1840031328	MKUDULJMCUANJQ-LIRRHRJNSA-N	440.338	1.552	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CC3CCOCC3)C2)C1	1840032123	OEBFYLOEAYEMCH-KSSFIOAISA-N	433.343	1.043	50	20	IDGD	
COc1ccccc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2	1840034213	DTVDJGVYHBGPEB-KUHUBIRLSA-N	441.322	1.549	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4occc4c3)C2)C1	1840152564	MIUZFYVHEOMDSQ-LAUBAEHRSA-N	436.892	1.757	50	20	IDGD	
O=C(Cc1cnc2ccccn12)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840187262	QAFWLUVHRRJOAW-LJQANCHMSA-N	441.315	1.137	50	20	IDGD	
O=C(c1cccn2nccc12)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840189755	KMRQYJOTYJPUHR-GOSISDBHSA-N	427.288	1.208	50	20	IDGD	
COC(=O)CCCCCC(=O)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1840236099	CCDJSNGYGBOTQO-SFHVURJKSA-N	439.336	1.370	50	20	IDGD	
COc1ccc(F)cc1CC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1840250408	XZBQAXVJTFLMNN-MJGOQNOKSA-N	432.851	1.368	50	20	IDGD	
C[C@H](Cc1ccccn1)C(=O)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1840335829	XVCJOLCDGDMOSU-AUUYWEPGSA-N	430.332	1.520	50	20	IDGD	
Cc1ccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)o1	1840508671	DLCUVUMYRNIYGY-NVXWUHKLSA-N	433.274	1.277	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)cc1	1840726587	BOQHWDNNOFPYBZ-LPHOPBHVSA-N	427.860	1.249	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@]1(C)CC1(F)F)CCO2	1840827979	JIWXESGZNATSLE-OWCLPIDISA-N	429.291	1.724	50	20	IDGD	
Cc1nn2cc(CC(=O)N3CC4(CCCN4C(=O)[C@H](C)CBr)C3)nc2s1	1841285558	BXOCWNZJMPMIMX-LLVKDONJSA-N	440.367	1.876	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC2(CCCN2C(=O)c2cccc(O)n2)C1	1842449311	UBTZDWFTHDBGCB-AWEZNQCLSA-N	438.912	1.736	50	20	IDGD	
COc1ccc(CNC(=O)CCC(=O)N2CC3(CCCN3C(=O)[C@H](F)Cl)C2)cc1	1843365959	TZXPSJNWWLMKGN-SFHVURJKSA-N	425.888	1.829	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCCC12CN(C(=O)c1cncc(S(C)(=O)=O)c1)C2	1844377438	BNSAOTWWHDUFQO-UHFFFAOYSA-N	425.583	1.154	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)c2n[nH]c3c(Cl)cccc23)C1	1845591107	FAPSHTYWYNNMKG-UHFFFAOYSA-N	438.680	1.027	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2cccn3nccc23)C1	1845630931	ROYWBPPKDCATFN-MFKUBSTISA-N	433.472	1.285	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1ccc(-n2c(O)nnc2O)cc1	1847870876	YRSYGBNWJPCADJ-PMPSAXMXSA-N	433.896	1.901	50	20	IDGD	
Cc1ccc(C)c(S(=O)(=O)N2CCN(C(=O)NNC(=O)c3ccccc3C)CC2)c1	9796655	PCIGGLXUFAHVAP-UHFFFAOYSA-N	430.530	1.973	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)CN1C(=O)c2cccc([N+](=O)[O-])c2C1=O	27265618	ISDZJQDLKRBWPY-UHFFFAOYSA-N	432.776	1.314	50	20	IDGD	
CC(C)n1nc(C(=O)NNS(=O)(=O)c2ccc3[nH]c(=O)oc3c2)c2ccccc2c1=O	36638710	PZHNQTKMQULISZ-UHFFFAOYSA-N	443.441	1.035	50	20	IDGD	
CC(=NNC(=O)c1cccn1C)c1ccc(S(=O)(=O)N2CCC(C(=O)O)CC2)cc1	725847386	JNCOHZQHHZIIIR-UHFFFAOYSA-N	432.502	1.664	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)CCc2nnc(-c3ccccc3)o2)ccc1Cl	726150965	CNXNHMWFKOZJAO-UHFFFAOYSA-N	449.876	1.431	50	20	IDGD	
O=C(NNc1nc(-c2ccncc2)no1)c1cc(S(=O)(=O)N2CCOCC2)ccc1F	726370682	DUCABDFKMOQKEW-UHFFFAOYSA-N	448.436	1.049	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=S)NCCCN(C)c1ccccc1	726442918	DZTQFOFUIPWQBU-UHFFFAOYSA-N	448.618	1.924	50	20	IDGD	
COc1ccc(OC)c(NC(=S)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)c1	726445628	ZOIYACLYPVCRTR-UHFFFAOYSA-N	444.922	1.636	50	20	IDGD	
C[C@@H](CN1C[C@@H](C)O[C@H](C)C1)C(=O)NNC(=S)NCCc1ccc2c(c1)OCCO2	726748576	ZBIRWNZBJJVLOS-ARFHVFGLSA-N	436.578	1.241	50	20	IDGD	
C#Cc1cccc(NC(=S)NNC(=O)[C@@H]2CC(=O)N(c3ccc4c(c3)OCCO4)C2)c1	727501274	QNEZLORBEMHBKI-OAHLLOKOSA-N	436.493	1.810	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)N[C@H](C)c2cccc(S(=O)(=O)N(C)C)c2)cc1	727608605	BFXZQMWQGCZJIK-OAHLLOKOSA-N	434.518	1.716	50	20	IDGD	
CC(=O)Nc1cc(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)ccc1F	728216387	YVJZSLSCOMHTLX-UHFFFAOYSA-N	449.508	1.477	50	20	IDGD	
O=C(CCn1cnc2sccc2c1=O)NNc1ccc(S(=O)(=O)C(F)F)cc1	728975976	XGRCYFIPLCNMKZ-UHFFFAOYSA-N	428.442	1.988	50	20	IDGD	
CC[C@@H](N=c1nn[nH]n1-c1ccccc1)C(=O)NNC(=O)[C@H](C)Oc1cccc(C)c1C	729282719	GSUCSPQJEXCKLW-FUHWJXTLSA-N	437.504	1.506	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H]2CCN(c3ccc(F)cc3F)C2)c1	730136319	GGLFTLDUFHHNRZ-AWEZNQCLSA-N	438.456	1.591	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)[C@@H]2CCN(c3ccc4c(c3)OCCO4)C2=O)c1	730513152	VMBIKFJKIBTDLK-KRWDZBQOSA-N	439.468	1.654	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCN(c2ccc3c(c2)OCCO3)C1=O)c1ccc2c(c1)OCCO2	730520435	HKFVZKVAXHGVIE-OAHLLOKOSA-N	439.424	1.043	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)[C@H]1CCCN1C(=O)c1ccccc1OC(F)F	730781239	ISWHAHDQQVGKCM-CQSZACIVSA-N	449.410	1.825	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)c1cccc(S(=O)(=O)NC[C@@H]2CCCO2)c1	731501580	XETFTUSWQYVRPZ-HNNXBMFYSA-N	433.486	1.227	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)[C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])o2)c1	732050665	ZMUTUMNJHWDPSV-OAHLLOKOSA-N	430.417	1.636	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2csc(I)c2)C[C@H](C)O1	732263242	LIFQPYONQZNLRC-UWVGGRQHSA-N	437.303	1.613	50	20	IDGD	
Cc1cc(NNC(=O)Cn2cc(Br)c(O)nc2=O)ccc1Br	734254997	UYRQWYSDVIHJSQ-UHFFFAOYSA-N	432.072	1.926	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)Cc2ccc3ccccc3c2)nc2c1c(=O)n(C)c(=O)n2C	738508670	DCZNMIRMWBURRP-UHFFFAOYSA-N	431.452	1.098	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2cccc(NC(=O)N(C)C)c2)c2ccccc2c1=O	739679169	QORYARZFMWIXHT-UHFFFAOYSA-N	436.472	1.975	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)c1ccc(OCC(=O)N2[C@@H](C)CCC[C@H]2C)cc1	740850993	JZIHJFXYPGJUCJ-IYBDPMFKSA-N	446.548	1.921	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)c2ccc(N3CCCS3(=O)=O)cc2C)c1	741660937	RVJUVKHWDHRUHT-UHFFFAOYSA-N	431.514	1.992	50	20	IDGD	
C[C@H](CC(=O)NNc1nc(-c2ccccc2)no1)/N=C1/NS(=O)(=O)c2ccccc21	742658462	UBCGMNOHFMTFCB-GFCCVEGCSA-N	426.458	1.697	50	20	IDGD	
Cc1nc2nc(N)nn2c(C)c1CCC(=O)NNC(=O)c1cccc(Br)c1	742769835	UXKDZIWYCQSJJJ-UHFFFAOYSA-N	432.282	1.480	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(Br)c(F)c1)c1ccc(-n2cnnn2)cc1	743251522	SINKTOCMWKWICH-UHFFFAOYSA-N	441.242	1.187	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N2CCc3n[nH]cc3C2)cc1	743901530	NUVOTACENAWYGG-YBEGLDIGSA-N	445.483	1.649	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1ccc(-n2ccnc2)nc1	744621183	ULUIQEIMMUVWLZ-UHFFFAOYSA-N	428.474	1.045	50	20	IDGD	
CCn1nc(C)c(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)c1Cl	744621904	SLEYTBNNZXKSRL-UHFFFAOYSA-N	427.914	1.643	50	20	IDGD	
Cc1ccc2c(CCC(=O)OCC(=O)NNC(=O)[C@H]3COc4ccccc4O3)c[nH]c2c1	745761302	SCQBIMCZSVDVDA-HXUWFJFHSA-N	437.452	1.940	50	20	IDGD	
C[C@H]1C[C@H](NC(=O)NNC(=O)CCSc2ccc(F)cc2)C(=O)N1c1cnn(C)c1	745919956	XSPOPASFLMQYKP-LRDDRELGSA-N	434.497	1.566	50	20	IDGD	
Cc1cc(=O)c(C(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)c[nH]1	746095183	KBCAWEOHTYMDPZ-UHFFFAOYSA-N	429.436	1.516	50	20	IDGD	
CCN=c1nc(NCC)n2c(SCC(=O)NNc3ccc(Cl)c(F)c3)n[nH]c2n1	746695913	UALGWFZOMYYQOE-UHFFFAOYSA-N	439.908	1.833	50	20	IDGD	
C[C@H](CCNC(=O)NNC(=O)c1csc(N2CCOCC2)n1)N(C)Cc1ccccc1	746773743	IECQXABDMKEGSK-MRXNPFEDSA-N	446.577	1.834	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)c1ccc(S(=O)(=O)NCCc2cccs2)cc1	747428124	FRXSXKYWMOLKGQ-UHFFFAOYSA-N	444.538	1.668	50	20	IDGD	
NC(=O)COc1cccc(C(=O)NNc2ccc(S(=O)(=O)Nc3nccs3)cc2)c1	747943422	WJPXNSIYDSDMLM-UHFFFAOYSA-N	447.498	1.565	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@@]2(F)CCN(C(=O)OC(C)(C)C)C2)c2ccccc2c1=O	748285032	GCGBBEMGXVNTEO-OAQYLSRUSA-N	447.467	1.527	50	20	IDGD	
O=C(CCN1CCN(C(=O)[C@@H]2CCCO2)CC1)NNc1ccc(OCC(F)(F)F)cc1	748701558	LISNBPCOJJTPPF-KRWDZBQOSA-N	444.454	1.784	50	20	IDGD	
O=C(CCc1ccccc1)NNC(=O)c1ccc(S(=O)(=O)NC[C@@H]2CCCO2)cc1	749852180	YEUSZGUKLQCUMG-SFHVURJKSA-N	431.514	1.538	50	20	IDGD	
CCc1cccc(S(=O)(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1	751207780	RXLVRISUFIJVGV-UHFFFAOYSA-N	437.543	1.657	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)COc1ccc(F)cc1Br	751210824	JIEFXZNGQQVWSW-UHFFFAOYSA-N	430.255	1.606	50	20	IDGD	
C[C@@H]1CCN(c2cc(C(=O)OCC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)ccn2)C1	752607505	ODYACXCGJNROHM-CYBMUJFWSA-N	427.417	1.454	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)c1ccc(C(=O)NNC(=O)c2ncccc2C)s1	752632014	UDNAAFRYFOZTRP-UHFFFAOYSA-N	438.469	1.305	50	20	IDGD	
CC[C@H](CS(=O)(=O)c1ccccc1)NC(=O)NNC(=O)COc1ccc(OC)cc1	752703769	KBCKDPGDMQAGRZ-OAHLLOKOSA-N	435.502	1.657	50	20	IDGD	
N#Cc1ccc(NNC(=O)Cc2ccc(S(=O)(=O)N3CCOCC3)s2)cc1Cl	753303322	UFTYQGKOTQVGQY-UHFFFAOYSA-N	440.934	1.980	50	20	IDGD	
NS(=O)(=O)c1ccc(Br)c(C(=O)NNc2ccc(C(F)(F)F)nn2)c1	755182896	FMFDJFGWBWRFTJ-UHFFFAOYSA-N	440.201	1.662	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1ccc(C)c(C(=O)NNC(=O)Cc2cc[nH]n2)c1	755287230	VGESDRKXCKEFQV-UHFFFAOYSA-N	443.485	1.531	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2c(C)n(C)n(-c3ccccc3)c2=O)cc1OC	755319024	CUMDTLVRRZSZMN-UHFFFAOYSA-N	425.445	1.968	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1cccc(NC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1	755514420	HFZVILHYVFCQNL-QGZVFWFLSA-N	448.501	1.756	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)Nc1ccc(CC(=O)N2CCOCC2)cc1	755861905	JLPXFMOWNGFJFF-UHFFFAOYSA-N	448.483	1.740	50	20	IDGD	
COC(=O)CNC(=O)Cc1ccc(NC(=O)NNC(=O)c2ccc(OC)c(OC)c2)cc1	755863411	IICNWQHUGRDSOX-UHFFFAOYSA-N	444.444	1.002	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)Nc2cc(Br)cnc2OCC(F)(F)F)cn1	756574425	VRFIGBFVTYBEMB-UHFFFAOYSA-N	437.176	1.985	50	20	IDGD	
CNS(=O)(=O)c1cccc(NC(=O)NNC(=O)COc2ccc(Cl)cc2)c1C	757726101	HMQOEVZXEGPKCC-UHFFFAOYSA-N	426.882	1.788	50	20	IDGD	
O=C(CSc1nnc(CO)n1-c1ccccc1)NNC(=O)c1cccc([N+](=O)[O-])c1	758009595	CNRSZUCTAUCUIL-UHFFFAOYSA-N	428.430	1.221	50	20	IDGD	
O=C(NNc1ncc(F)cn1)c1cc(S(=O)(=O)N2CCCC2)ccc1Br	760912042	LZPUOBCURFXVNP-UHFFFAOYSA-N	444.286	1.920	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)CCNS(=O)(=O)c2ccc(F)c(F)c2)n1	762914599	WHZWSTLBIKTNKC-UHFFFAOYSA-N	428.465	1.413	50	20	IDGD	
COc1ccc(OC)c(NC(=O)C(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)c1	763540107	QUZOGVZVZJOVPC-UHFFFAOYSA-N	433.417	1.129	50	20	IDGD	
COC(=O)c1c(C2CC2)csc1NC(=O)C(=O)NNC(=O)c1ccc(OC)c(OC)c1	763542637	IFCXGPLCWYXEOG-UHFFFAOYSA-N	447.469	1.829	50	20	IDGD	
NC(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)c2sc3ccccc3c2Cl)cc1	763578176	MMSJUVIJAHVSJW-UHFFFAOYSA-N	430.873	1.982	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)Nc1cnn(-c2ccccc2Cl)c1	763579511	WUXHGWKPOPLSLM-KRWDZBQOSA-N	441.831	1.452	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccnn2Cc2cnn(-c3ccccc3)c2)c(C)o1	763583339	MVLKFNRVFZKTBB-UHFFFAOYSA-N	447.455	1.727	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cc(C)n(-c3ccccc3)c2C)ccc1C(N)=O	763601545	GNMCWYICMKHIHE-UHFFFAOYSA-N	433.468	1.901	50	20	IDGD	
N#Cc1ccc(OC(F)F)c(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)c1	763605401	SAMCPVCBNQIUBZ-UHFFFAOYSA-N	440.366	1.949	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2ccc(C)c(C(=O)NC(C)C)c2)c1	763665527	XXFMPQWASDAYAR-UHFFFAOYSA-N	440.500	1.915	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(CN3CCOC3=O)cc2)cc1C	763679981	NBFFNOCUDVMEGC-UHFFFAOYSA-N	440.456	1.421	50	20	IDGD	
O=C(NNC(=O)[C@@H]1C[C@]12CCOC2)c1cccc(S(=O)(=O)NCc2ccccc2)c1	763728749	QYSWHLGYFDJLMC-RXVVDRJESA-N	429.498	1.353	50	20	IDGD	
NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)CSc2ccc(Cl)cc2)cc1Cl	763736035	RCGUXONXESRAQL-UHFFFAOYSA-N	441.296	1.971	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)ccc1Br	763840131	ISZQXDYOQPFLOA-UHFFFAOYSA-N	440.225	1.762	50	20	IDGD	
Cc1nn(C)c(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(Br)c2)c1C	763881316	CEKKCBVEQCDTFS-NSHDSACASA-N	438.282	1.353	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2cc(Br)cn2C)c(OC)c1	764004281	BQDUZITXUGHYOF-UHFFFAOYSA-N	425.239	1.205	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cccc(C(F)(F)F)c2)cn1C	764037661	SEFDAQRBYZJLMG-UHFFFAOYSA-N	426.351	1.620	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(OCc3noc(C)n3)cc2)c(O)c1	764105576	VPOLZOPUFSZVAT-UHFFFAOYSA-N	425.401	1.371	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2c(C)c(C)nn2-c2ccc(C#N)cc2)c(O)c1	764108261	FUWYWIKQXCJABL-UHFFFAOYSA-N	432.440	1.775	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2cccc(OC)c2O)ccc1Br	764130172	CKDXLBWXVHUBAR-UHFFFAOYSA-N	438.234	1.572	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(OC)c2O)cc1Br	764132709	PRCQQNJMGIEAOW-UHFFFAOYSA-N	438.234	1.572	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2nn(C(C)(C)C)cc2C#N)o1	764138123	CCBXMQKRIGTZHH-UHFFFAOYSA-N	429.481	1.344	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(N3CCCC3=O)c2)o1	764139326	QRMDDSGGIQPDEK-UHFFFAOYSA-N	441.488	1.648	50	20	IDGD	
C[C@H]1CN(Cc2cccc(NC(=O)C(=O)NNC(=O)c3ccc(C#N)cc3)c2)C[C@H](C)O1	764176146	AEURZOORBGQIPD-HOTGVXAUSA-N	435.484	1.567	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)C(=O)Nc1ccccc1Br	764204107	IXNCIUXGEVDDDD-UHFFFAOYSA-N	443.298	1.840	50	20	IDGD	
COC(=O)C(C)(C)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2O)cc1	764278320	VWPLROHZJPMWMR-UHFFFAOYSA-N	429.429	1.008	50	20	IDGD	
O=C(NNC(=O)c1cc2ccccc2o1)C(=O)Nc1ccc(S(=O)(=O)NC2CC2)cc1	764331662	ZLDGEOCYQRLZKP-UHFFFAOYSA-N	442.453	1.273	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)C(=O)Nc1ccccc1O[C@@H]1CCOC1	764401174	NHUGWKIOAPEOJK-CYBMUJFWSA-N	431.470	1.438	50	20	IDGD	
CNS(=O)(=O)c1ccc(C)c(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2F)c1	764413136	NAYOHHJAKVZECJ-UHFFFAOYSA-N	442.856	1.095	50	20	IDGD	
O=C(NNC(=O)[C@H]1COCCO1)C(=O)Nc1cc(Cl)ccc1Sc1ccccc1	764434810	RTXVSFGBXZSFHD-OAHLLOKOSA-N	435.889	1.993	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cncc(OC(C)C)c2)c1	764465831	OVTDKTLAQYYAGF-UHFFFAOYSA-N	434.518	1.974	50	20	IDGD	
C[C@](O)(CNC(=O)NNC(=O)c1csc(N2CCOCC2)n1)c1cccc(Cl)c1	765196563	UIOMVJLCWGNRPB-SFHVURJKSA-N	439.925	1.485	50	20	IDGD	
Cn1nccc1S(=O)(=O)NC(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccccc1	765658331	OZSQCHDVALRQDI-VBKFSLOCSA-N	435.469	1.609	50	20	IDGD	
Cc1noc(C)c1CCC(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	765753311	DTQSIALPNFSQQU-UHFFFAOYSA-N	433.940	1.843	50	20	IDGD	
CC(=O)Nc1cc(C(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)ccc1F	765756620	XZXXTZSNSZKYGT-UHFFFAOYSA-N	441.507	1.671	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)N2CCC(C(=O)NCCCO)CC2)c(C)n1C[C@H]1CCCO1	769333672	FHGGCOFJKPTFPC-ZPWPBLDLSA-N	442.560	1.928	50	20	IDGD	
C[C@]1(c2ccc(F)c(Cl)c2)NC(=O)N(CC(=O)NNC(=O)c2cccc(C#N)c2)C1=O	769925700	SZLROOSUCXNRSO-HXUWFJFHSA-N	443.822	1.579	50	20	IDGD	
CSC[C@H](C(=O)NNC(=O)c1ccc2c(c1)OCCO2)N1C(=O)[C@H]2CCCC[C@H]2C1=O	770416900	DMFUDQXBLNUIAZ-QLFBSQMISA-N	447.513	1.126	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)c3ccc(C[C@H]4CC(=O)NC4=O)cc3)nc21	770966670	NLEVMXRSXVPOEP-ZDUSSCGKSA-N	437.460	1.249	50	20	IDGD	
C[C@@H]1CN(C(=O)OC(C)(C)C)[C@H](C)CN1C(=O)NNC(=O)CNC(=O)c1cccs1	771955721	BUWZPKVFEXEFEJ-CHWSQXEVSA-N	439.538	1.548	50	20	IDGD	
C[C@H](C(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1)n1nnc(-c2ccccc2)n1	772195366	KPYJUUGEVFTYAV-GFCCVEGCSA-N	427.852	1.018	50	20	IDGD	
O=C(NNC(=O)[C@@]1(F)CCN(C(=O)OCc2ccccc2)C1)[C@H]1COc2ccccc2O1	776739514	SEJZKZRCNPNFCJ-XMSQKQJNSA-N	443.431	1.725	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)[C@@H](O)[C@H](O)c1nc2ccccc2s1	779540977	VFXBVEDFBISBBA-IRXDYDNUSA-N	433.511	1.639	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)CNC(=O)c1cccc(Br)c1	780970867	GKQQPKOJIHROTM-UHFFFAOYSA-N	443.298	1.241	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)cc1)C(=O)Nc1ccccc1-n1cc(Br)cn1	782832064	KDYPRDVRPXXYKG-UHFFFAOYSA-N	444.245	1.740	50	20	IDGD	
CN(C)C1(CNC(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)CCC1	783009092	DWABXWJZDXPJDP-UHFFFAOYSA-N	448.527	1.873	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)c(=O)n(C)c1	783408544	LPULEMCSSUSMGH-UHFFFAOYSA-N	432.380	1.069	50	20	IDGD	
C[C@@H]1CCCCN1C(=O)c1ccc(NC(=O)C(=O)NNc2ccc(-n3cccn3)nn2)cc1	783436699	NDTQZPUNDHCRKE-OAHLLOKOSA-N	448.487	1.759	50	20	IDGD	
COC(=O)c1cc(F)ccc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)C(F)F)cc1	784835403	NTYNJKSIXQTYBH-UHFFFAOYSA-N	445.375	1.690	50	20	IDGD	
COc1cccc(NNC(=O)C(=O)Nc2ccc(Cl)c(S(=O)(=O)N(C)C)c2)n1	784847314	ANEMZXSRSQZUEK-UHFFFAOYSA-N	427.870	1.076	50	20	IDGD	
CN1CCN(C(=O)Cc2ccc(NC(=O)C(=O)NNc3ccc(Cl)nc3)cc2)CC1	784871487	MBTKQWJUQAZLLM-UHFFFAOYSA-N	430.896	1.133	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)Nc1ccc(Cl)c(OC(F)F)c1	785024711	YQRROSFQTKYDLX-UHFFFAOYSA-N	444.734	1.955	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)C(=O)Nc1nc(-c2cccs2)cs1	785066614	FHTXFJSOCLUXFO-UHFFFAOYSA-N	426.483	1.848	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)[C@H]2[C@H]3CC[C@@H](O3)[C@@H]2C(F)(F)F)c2ccccc2c1=O	785442933	GPVUEYXBZWUFMO-KBXIAJHMSA-N	438.406	1.923	50	20	IDGD	
CCOC(=O)c1cnn(C)c1NC(=O)C(=O)NNc1ccc(OCC(F)(F)F)cc1	786427980	WOCYTYNDQPJYRN-UHFFFAOYSA-N	429.355	1.620	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)COc2ccc([N+](=O)[O-])c3cccnc23)cc1	786786798	WEMMHDXURZKIAG-UHFFFAOYSA-N	438.396	1.835	50	20	IDGD	
CCNS(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)NCc2ccc(Cl)cc2)c1	787430564	CLZJPLHMIOTEJF-UHFFFAOYSA-N	428.873	1.922	50	20	IDGD	
CC(=O)c1cccc(S(=O)(=O)NCCC(=O)NNc2nnc(-c3ccccn3)s2)c1	788563938	WPYMJZGFYKGANL-UHFFFAOYSA-N	446.514	1.614	50	20	IDGD	
C[C@@H]1CN(c2ccccc2F)CCN1C(=O)NNC(=O)c1csc(N2CCOCC2)n1	788987900	AEDBNSXHVMCEAI-CQSZACIVSA-N	448.524	1.684	50	20	IDGD	
CC(C)(C)Cc1csc(NC(=O)C(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])n1	789731827	IIVFBMLGOIXOOT-UHFFFAOYSA-N	435.462	1.805	50	20	IDGD	
Cc1nn(C)c(C=NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)c1Br	790294474	QCDIBAMHFNSIEF-UHFFFAOYSA-N	447.337	1.399	50	20	IDGD	
O=C(CNS(=O)(=O)CBr)Nc1ccc(I)cc1	790353346	JQNXAYZWUXAIRF-UHFFFAOYSA-N	433.065	1.502	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3cnc(OCC4CC4)cn3)n[nH]2)cc1OC	791053913	KBRMOZPOPXANDM-UHFFFAOYSA-N	438.444	1.748	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)CCN1CCN(C(=O)OC(C)(C)C)CC1	792027030	FSCUOMAXAFVCJS-UHFFFAOYSA-N	430.509	1.347	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)C(=O)Nc1cccc(N2C(=O)CCCC2=O)c1	792355561	SSZGCMIFRINWBC-UHFFFAOYSA-N	426.404	1.198	50	20	IDGD	
CS(=O)(=O)c1cc(C(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)ccc1F	792456301	RGZQPAQNKSRULJ-UHFFFAOYSA-N	428.825	1.501	50	20	IDGD	
CS(=O)(=O)NCCc1ccc(C(=O)NNC(=O)c2cc3ccccc3cc2O)s1	792521273	MDKXIXFXIVXQSG-UHFFFAOYSA-N	433.511	1.773	50	20	IDGD	
Cc1ccn(-c2ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc3ccc(F)cc3)cc2)n1	793021243	AIGGFHBITPUSNG-AWEZNQCLSA-N	425.420	1.873	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)NC[C@@H]2CCCN(C(C)=O)C2)c1	793312859	PECFGCSTSFGYLX-LBPRGKRZSA-N	427.299	1.660	50	20	IDGD	
Cc1ncc(S(=O)(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)cc1C#N	793393109	BAQSCGLQWKMQLC-UHFFFAOYSA-N	438.510	1.154	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@H]2C(=O)NNC(=O)c2cccc(C)n2)cc1	794075671	OZIGBFLUMSDFDB-IBGZPJMESA-N	444.513	1.597	50	20	IDGD	
COC(=O)c1ccc(Br)c(S(=O)(=O)NNC(=O)c2cccc(C)n2)c1	794599802	OIDWWCPMHVSPEK-UHFFFAOYSA-N	428.264	1.562	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(OCCN3CCCCC3)cc2)n1	797369822	LRSPXWNDUCSOTB-UHFFFAOYSA-N	425.489	1.654	50	20	IDGD	
O=C(CCc1ccco1)NNC(=O)C(=O)Nc1ccc(Cl)c(CN2CCOCC2)c1	797535581	OOZGTIIXDYXTGK-UHFFFAOYSA-N	434.880	1.484	50	20	IDGD	
CNC(=O)C[C@@H](NC(=O)NNc1nc(O)c2cnn(C(C)(C)C)c2n1)c1ccccc1	797547424	TUIFZDZMWBTGIP-CQSZACIVSA-N	426.481	1.790	50	20	IDGD	
CNC(=O)COc1ccc(NC(=O)NNc2c(OC)cccc2S(C)(=O)=O)c(C)c1	797680156	CIBUGMRUHDFSQE-UHFFFAOYSA-N	436.490	1.681	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)/C=C\c2cc3cnn(C(C)C)c3[nH]c2=O)cc1C	798307667	BKUHZLXSDRGPCP-VURMDHGXSA-N	436.472	1.722	50	20	IDGD	
Cc1cn(-c2ccc(F)cc2)nc1C(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	801447485	DCMONNVEJYCVOS-UHFFFAOYSA-N	441.375	1.846	50	20	IDGD	
Cn1cc(S(=O)(=O)N2CCCCC2)cc1C(=O)NNc1ccc2c(=O)[nH]ccc2c1	803430578	GPJADALPIATAPC-UHFFFAOYSA-N	429.502	1.798	50	20	IDGD	
CCCN(NC(=O)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(F)cc1)C(=O)OC(C)(C)C	804593515	MTEOCRCIZPTMMK-ZBFHGGJFSA-N	445.513	1.628	50	20	IDGD	
CS(=O)(=O)N1CCN(c2ccc(NC(=O)NNc3nccnc3C3CCC3)cn2)CC1	806268424	GIUDGXRVLQLIAQ-UHFFFAOYSA-N	446.537	1.369	50	20	IDGD	
CN1CCC(Oc2ccc(CNC(=O)NNc3nc(O)c4cnn(C)c4n3)cc2)CC1	807254092	RIDIRQYDROBVHT-UHFFFAOYSA-N	426.481	1.368	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)CNS(=O)(=O)c1cccc(F)c1	810792517	QDCNKHUGUVXFST-UHFFFAOYSA-N	427.479	1.052	50	20	IDGD	
CC[C@H](C)C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)CN(C(=O)OC(C)(C)C)CCO2	812979238	LOCOQQYSKQZNOO-ZDUSSCGKSA-N	434.493	1.948	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccn(Cc3ccccc3)n2)cc1	813033751	JVGLTPIBTYAZCZ-UHFFFAOYSA-N	442.501	1.264	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2nnn(Cc3ccc(C(F)(F)F)cc3)c2C)ncn1	815593209	FLLKGKQNVYPYFR-UHFFFAOYSA-N	434.382	1.834	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCc2nncn2C1)C(=O)Nc1ccc2c(c1)OC1(CCCCC1)O2	815692343	OSRCISSGKXJIBC-ZDUSSCGKSA-N	440.460	1.058	50	20	IDGD	
O=C(NNc1ncncc1F)C(=O)Nc1ccnn1Cc1ccccc1Br	815763884	GEIOZKTZZKUHDK-UHFFFAOYSA-N	434.229	1.705	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H]2CCO[C@@H](c3ccccc3)O2)c1	816810231	DXHDVFNWZDFUPO-YLJYHZDGSA-N	433.486	1.202	50	20	IDGD	
NS(=O)(=O)c1cnn(CC(=O)NNc2cc(C(F)(F)F)cc(C(F)(F)F)c2)c1	817015040	JEXMJUMRGGKPNJ-UHFFFAOYSA-N	431.318	1.711	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N[C@H](CCSC)C(=O)NNc2ncncc2F)cc1	817070696	LAFJDYGDJKATMP-OAHLLOKOSA-N	443.526	1.558	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)CNC(=O)c1ccc(Br)cc1	825643585	FIMGATNYAGNVDA-UHFFFAOYSA-N	435.278	1.447	50	20	IDGD	
O=C(c1nnn(-c2cccc(Br)c2)c1C(F)(F)F)N1CC[C@H](B(O)O)C1	864234801	WHHHCCGWRXJCBX-QMMMGPOBSA-N	432.993	1.738	50	20	IDGD	
CCC1(CC)NC(=O)N(CC(=O)NNC(=O)[C@@H](C)Oc2c(C)cc(Cl)cc2C)C1=O	912864553	JNOPULVBCYWJIZ-CYBMUJFWSA-N	438.912	1.982	50	20	IDGD	
O=C(NN=Cc1cnc(N2CCCC2)nc1)c1cccc(S(=O)(=O)N2CCCC2)c1	914772001	GUINMKWTHLUOHT-UHFFFAOYSA-N	428.518	1.625	50	20	IDGD	
CCOc1ccc(OCc2ccc(C(=O)NNC(=O)c3cn(C)c(=O)nc3O)cc2)cc1	915807997	IOJDVNILLSWKIH-UHFFFAOYSA-N	438.440	1.538	50	20	IDGD	
O=C(NC[C@@H]1CN(Cc2ccccc2)CCO1)NNC(=O)c1ccc2c(c1)OCCO2	915894833	QKALHHUYSLBLPC-GOSISDBHSA-N	426.473	1.303	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)NC[C@H](c1cccs1)N1CCN(C)CC1	915902138	QDRZQQFNTMLXCG-NVXWUHKLSA-N	449.552	1.974	50	20	IDGD	
O=C(NNC(=O)c1cccnc1Oc1ccc(F)cc1Br)C(=O)NC1CC1	916111100	ZOVXTAHALBFJJR-UHFFFAOYSA-N	437.225	1.815	50	20	IDGD	
COc1cc(OC)cc([C@@H](NC(=O)NNc2ccc(-n3cccn3)nn2)c2nccn2C)c1	916229802	ZCKCNQWCCIBRFB-LJQANCHMSA-N	449.475	1.829	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)NC1CCN(C(=O)c2ccccc2F)CC1	916379595	KMAWHQKVFKOWDP-UHFFFAOYSA-N	432.427	1.979	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)N[C@@H]2CCCc3c2cnn3C)c2ccccc2c1=O	916604485	HWLYOALTARWJRF-QGZVFWFLSA-N	437.504	1.952	50	20	IDGD	
Cc1cc(S(=O)(=O)NNC(=O)c2csc(N3CCOCC3)n2)c2ncccc2c1	917723955	QJAJWFSPVDLXHN-UHFFFAOYSA-N	433.515	1.460	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)Cc1c(C)[nH]c(-c2ccncc2)nc1=O	917920185	OGYIQVKCFJEUGB-UHFFFAOYSA-N	445.483	1.443	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)NCCS(=O)(=O)c3ccccc3)n[nH]2)cc1	918229638	LODLDBSWINBHSE-UHFFFAOYSA-N	427.486	1.803	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)NCCCCN2CCN(c3ccccc3)CC2)n1	918230964	ANLOTLDKNLKUPK-UHFFFAOYSA-N	427.553	1.433	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NNC(=O)c2ccc(Br)s2)cc1OC	918778493	HGHWIXUWIQCSDH-UHFFFAOYSA-N	443.279	1.817	50	20	IDGD	
CCC[C@H](C)N1C[C@H](C(=O)OCC(=O)NNC(=O)c2cc(Cl)ccc2OC)CC1=O	919586913	ZYBMRSUJLVVUFV-QWHCGFSZSA-N	439.896	1.690	50	20	IDGD	
O=C(CN1C(=O)N[C@@]2(CCc3ccccc32)C1=O)NNC(=O)NCCc1cccs1	920861351	XDIWMYYPQNZJQV-HXUWFJFHSA-N	427.486	1.015	50	20	IDGD	
COc1cc(OC)cc(S(=O)(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)c1	1253155268	GCDNLBOMVVDFAI-UHFFFAOYSA-N	443.522	1.660	50	20	IDGD	
COc1cc(CNC(=O)NNC(=O)c2ccccc2Cl)ccc1OCC(=O)N(C)C	1321733155	XBWXINDZJIRJEI-UHFFFAOYSA-N	434.880	1.960	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(C(=O)NNc2nncc(N)c2Cl)cc1Br	1324051146	UXPVKZIUSJSDHS-UHFFFAOYSA-N	449.718	1.482	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2C(=O)N[C@@](C)(c3ccc(C)cc3)C2=O)cc1OC	1337084135	DETHPGVRMRKLHO-QFIPXVFZSA-N	440.456	1.240	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)Cn3c(=O)n(C)c4ccccc43)C2)C1	1778161573	HXMKKUUJGSJXGM-KSFYIVLOSA-N	448.951	1.577	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4c(c3)CC(=O)N4)C2)C1	1778394122	YALSXXGHNQQYBU-UXHICEINSA-N	440.327	1.861	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cnn3cccc(F)c13)CCO2	1779299579	XLFJJWLZGHODNQ-HXUWFJFHSA-N	434.544	1.768	50	20	IDGD	
O=C(c1ncon1)N1CC[C@@]2(C1)CN(C(=O)[C@H](Br)Cc1ccccc1)CCO2	1779871726	GGGOTPVPQQHUFF-DNVCBOLYSA-N	449.305	1.519	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc3c1NC(=O)C3=O)C2	1780705001	ZQUKLQBMQCUSTE-XCGNWRKASA-N	447.919	1.966	50	20	IDGD	
O=C(CCc1noc(-c2ccccc2)n1)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1780894350	KTQQBRZFXRVYRR-IERDGZPVSA-N	448.907	1.099	50	20	IDGD	
O=C(c1cnc2ccccc2n1)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781329964	OSWWUDLEQNFCCQ-QAPCUYQASA-N	437.269	1.764	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(OC)ccn1)C2	1782175109	FCPXAJXUCWVAIG-XAUMDUMWSA-N	425.913	1.472	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnn4c3OCCC4)C2)C1	1782279438	KZFOUDQPHYMTCN-ROUUACIJSA-N	431.320	1.345	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnc4c(c3)NC(=O)CS4)C2)C1	1782422436	JUVDMKQXYNMZBM-ORAYPTAESA-N	438.937	1.587	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3nc4ccc(F)cn4n3)C2)C1	1782570226	FIKIZFAGXRBCDR-APPDUMDISA-N	440.273	1.095	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Cl)C[C@@H]32)c1	1783747852	FAIWXRSKOGWTFE-TUUVXOQKSA-N	432.901	1.218	50	20	IDGD	
CC(C)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CNC(=O)c3cccs3)C[C@@H]21	1783845894	GWQZMYIEIBTMMZ-KKUMJFAQSA-N	441.981	1.723	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)Cc3ccc4c(c3)CCCO4)CCO2)C1	1783876176	WJPPZNROINXQMI-GCJKJVERSA-N	436.936	1.638	50	20	IDGD	
Cc1cnn([C@@H](C)C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]3C2)c1	1783973550	BVRBLURKTBMZTC-XAJHFOFHSA-N	441.370	1.763	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)CCn3nc(C)cc3C)C2)C1	1784321150	KOVLOAHORNTOPD-QFBILLFUSA-N	441.370	1.893	50	20	IDGD	
Cc1cc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)CBr)C[C@@H]32)on1	1785085992	CJIDKBQOHCBLFP-MZGVZZPPSA-N	428.327	1.536	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(-c4ncc[nH]4)cc3)C2)C1	1785156691	ZNDYHDCIEJRFIR-UWJYYQICSA-N	432.908	1.774	50	20	IDGD	
O=C(/C=C/c1cccnc1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21	1785377846	XIZRPNNVBJYCIU-IBCWIVPQSA-N	426.286	1.765	50	20	IDGD	
COc1ncc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CO[Si](C)(C)C)C[C@@H]32)cc1F	1785638974	LSKICUOLMIQAOV-QRTARXTBSA-N	439.560	1.674	50	20	IDGD	
COCCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C[C@@H]21	1786632076	WOBQLMKZGXSCAO-VGWMRTNUSA-N	447.960	1.135	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)c3cc4n(n3)CCC4)CCC2)cc1)c1cccc(B(O)O)c1	1788145574	CYBVFPXACWFVOE-UHFFFAOYSA-N	444.300	1.571	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cncn3-c3ccncc3)C[C@@H]21	1789858800	PZKMFGQKOABZGF-XPYUAMARSA-N	431.924	1.878	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCC(=O)N3CCCC3)C[C@@H]21)[C@@H](F)Br	1789921605	RQBGSIWIHSUIOY-AYMQEEERSA-N	448.333	1.059	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cnn(C)c3)C[C@@H]21	1790963967	QIWBBVIXVZRQMW-JONQDZQNSA-N	427.343	1.116	50	20	IDGD	
Cc1nccn1[C@@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21	1791704989	QNUNHYHYCSVIHA-PSWFKFNGSA-N	431.306	1.423	50	20	IDGD	
COC(=O)c1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Cl)C[C@@H]32)c(C)c1	1792096933	QMTHOKPJVDOYRS-HJWJTTGWSA-N	426.872	1.909	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3ccnn3c1)C2	1792874697	ZOTABPMFEUHFBZ-JJAZEVLHSA-N	435.322	1.569	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCCC(=O)OC(C)(C)C	1793023865	NDHVZRJNNSMJFI-VWPFQQQWSA-N	447.370	1.871	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H]1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCl	1793107688	UWGTXKQEZFGQNP-RHJCGQNESA-N	443.972	1.918	50	20	IDGD	
O=C(Cc1ccc2c(c1)CCC2)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2	1793847195	SHHANLDRBGSMCB-UKBAYJJMSA-N	439.325	1.998	50	20	IDGD	
COc1cccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)CBr)C3)n1	1794526481	WOFLEMAJVFRGHX-JFILPPLUSA-N	426.311	1.324	50	20	IDGD	
C[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2	1797302506	MPMBQNSPECPJHO-KXKVQDCLSA-N	447.935	1.613	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCC(=O)NN(C)C)C2	1797355663	ZXHTUSHJWZZXKW-BJWYYQGGSA-N	426.521	1.268	50	20	IDGD	
Cc1nc2sccn2c1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)Br)C2	1797546412	YHOSGVKTDIUOBC-SYEHKZFSSA-N	441.351	1.691	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccon1)C2	1798522693	NBEGLYLZNZRNFO-IVWMJMPLSA-N	444.400	1.025	50	20	IDGD	
COCc1c[nH]c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C3)c1	1799200929	PXMSJYDRXSRCLI-FWKYCFCSSA-N	440.504	1.547	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccn3nccc13)C2	1799279859	VJXNMBJNNNJEOX-AODNKKSCSA-N	425.316	1.774	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(Cl)(Cl)Cl	1800582711	RHXVWNPIKQWQJH-DOLQZWNJSA-N	436.561	1.977	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](OC(C)=O)C(C)C)C2	1800642136	YGRHFQXNCBPXOF-QRJUGERDSA-N	433.343	1.337	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COc1ccccc1F)C2	1800644458	URARAPTZUIIEAZ-KYZVSKTDSA-N	443.313	1.968	50	20	IDGD	
O=C(O)C#CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](Br)Cc1ccccc1)C2	1801993361	QXHNISOTLXBVTA-YVSFHVDLSA-N	433.302	1.719	50	20	IDGD	
COc1nc(C)ccc1C(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]1c1cccnc1	1803141987	VXAWXSZKPPZXTG-BPQIPLTHSA-N	432.908	1.713	50	20	IDGD	
COc1nn(C)cc1C(=O)NC[C@H]1CCN(C(=O)C(Cl)Cl)[C@@H]1c1cccnc1	1805308506	QUTGJNFUUCZTTA-TZMCWYRMSA-N	426.304	1.947	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC2(CCCN(C(=O)CN3CCOC3=O)C2)CC1	1805768571	UFYKDUMOQUXBBN-AWEZNQCLSA-N	430.343	1.843	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@H](CNC(=O)Cn2ccccc2=O)[C@H]1c1cccnc1	1807440835	RPJCWLVQBLDIKJ-PGRDOPGGSA-N	442.592	1.801	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2nn(C)c3c2CCC3)[C@@H]1c1cccnc1	1809367712	UOKHTIMWDBBGQW-SYNHAJSKSA-N	445.951	1.877	50	20	IDGD	
O=C(CCC(F)(F)F)N1CCCC2(CCN(C(=O)c3cccc(B(O)O)c3)CC2)C1	1809480801	LPKRTXLMMYIJEF-UHFFFAOYSA-N	426.244	1.554	50	20	IDGD	
CCC1(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)CCC1	1809647525	QMLXNNNNRQSLHX-PZJWPPBQSA-N	435.333	1.661	50	20	IDGD	
C=CC[C@H](C(=C)C)C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1810173461	VMWCPSYRIRPZBB-YMPZKCBVSA-N	447.344	1.849	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1CCN(C(=O)c2n[nH]cc2[N+](=O)[O-])[C@H]1c1cccnc1	1810544951	VLQKHWOQURZUSZ-KSSFIOAISA-N	446.540	1.884	50	20	IDGD	
COC(=O)C1(C(=O)N2CC[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]2c2cccnc2)CC1	1810548993	WQXBVZSHHRDWLU-FUHWJXTLSA-N	433.581	1.892	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)c1cncc2cnccc12	1811295752	TYFARWKHEOCIBP-BEVDRBHNSA-N	439.903	1.944	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2nccc3nc[nH]c23)[C@H]1c1cccnc1	1813032201	UXNJPPIAVYFBLX-VCBZYWHSSA-N	442.907	1.926	50	20	IDGD	
C#CCCCC(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1	1813049282	RWXOAYQORJHEMM-UTKZUKDTSA-N	434.500	1.203	50	20	IDGD	
C[C@](O)(CC(=O)O)CC(=O)NC[C@@H]1CCN(C(=O)C(Cl)Cl)[C@@H]1c1cccnc1	1813066522	BWMOYPDJNLNTMS-WBHUJUFNSA-N	432.304	1.507	50	20	IDGD	
Cc1ccnc(C(=O)N2CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)c1	1813071305	QWSKINJLMBTLGL-XMSQKQJNSA-N	438.532	1.478	50	20	IDGD	
CCc1nc(C(=O)N2CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)co1	1813074604	UOVVYOJQHUBHGJ-HRAATJIYSA-N	442.520	1.325	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@H]1CCc2nc(NC(=O)C(C)(C)F)sc2C1	1814686150	SCKWWAOOEXGAQT-DLDHGHKKSA-N	434.497	1.937	50	20	IDGD	
Cc1ccc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)s1	1815339796	OVUREHGYDNCPAF-CQSZACIVSA-N	441.343	1.732	50	20	IDGD	
CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](F)Cl)sc2C1	1817133948	PLFJRJAVHUENEN-IUPBHXKESA-N	442.904	1.060	50	20	IDGD	
CN(CC(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@](C)(Cl)CCl)[nH]n1)C(=O)C(=O)O	1821716080	XECNVSPSEQWXLW-PIGZYNQJSA-N	448.307	1.181	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCc2ccc(O)nn2)[nH]n1	1822377544	XTGATSRRUAIDQT-HIFRSBDPSA-N	436.900	1.784	50	20	IDGD	
Cc1cc2nnc(C(=O)N3CCC([C@H]4CCCCN4C(=O)[C@@H](O)CCl)CC3)c(C)n2n1	1824187968	WGFNUGXJSVMLMY-SJORKVTESA-N	448.955	1.574	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](F)Cl)CC2)c1cnc2c(c1)CCNCC2	1824640221	QOAFKWZQTMKWGN-MLGOLLRUSA-N	437.928	1.987	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)Cn1cc(Cl)cn1)CC2	1825998337	FLGOWSLJHQYZKB-WDEREUQCSA-N	432.333	1.859	50	20	IDGD	
CCC[C@H](NC(C)=O)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](Cl)COC)sc2C1	1826009577	VAHYTKXZBDDFLJ-BZPMIXESSA-N	430.958	1.614	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CN2CCNC2=N)CC1	1826873593	NCXHQFWLKOHRPA-HOTGVXAUSA-N	442.402	1.620	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@H]1CCc2nc(NC(=O)C34CC(C3)C4)sc2C1	1827354558	SNDWJKPZVUWYFW-MRRLMSGDSA-N	426.502	1.168	50	20	IDGD	
Cc1cc(NC(=O)CC(=O)N2CCCC[C@@H]2C2CCN(C(=O)[C@H](O)CCl)CC2)no1	1827660092	LXWNJSOKHAQYQP-HZPDHXFCSA-N	440.928	1.531	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3cccc([N+](=O)[O-])c3)CCO2)C1	1829625997	ZWIDUAMRRRFNIU-FXAWDEMLSA-N	439.896	1.611	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cn(C(C)(C)C)nn3)C2)C1	1830364666	OGPMAPSSDGCVOT-HXUWFJFHSA-N	441.960	1.368	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)C3CC(F)(F)C3)C2)C1	1830534152	XJADJJXVKKRJIM-MLGOLLRUSA-N	439.297	1.519	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cncs3)C2)C1	1830537556	KFDRJGJMKBIDLN-LRDDRELGSA-N	432.340	1.244	50	20	IDGD	
Cc1oncc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)CBr)CCO2	1830537609	LGBPYRGDKIZZDM-PXAZEXFGSA-N	430.299	1.084	50	20	IDGD	
Cc1oncc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2	1830537611	LGBPYRGDKIZZDM-SJCJKPOMSA-N	430.299	1.084	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CCC=CO3)C2)C1	1830540811	SROOXLBYQXHVQY-RKVPGOIHSA-N	431.327	1.167	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)Br)C2)C1	1831656378	DRFWMONOPQRQDR-XEZPLFJOSA-N	425.751	1.634	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2n[nH]cc2[N+](=O)[O-])CC1	1831830984	KYMURTWCUIBKOV-UONOGXRCSA-N	427.889	1.805	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)C[C@](C)(O)CC(=O)O)CC1	1831835157	OZOKUTHGYZBTFN-YRNRMSPPSA-N	432.945	1.476	50	20	IDGD	
Cc1nn(C)cc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1	1831871280	QWNLWGLKJKNAGM-IBGZPJMESA-N	432.569	1.335	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H]2CCCCN2C)CC1	1831871303	RENIPYWUCOKLQF-WOJBJXKFSA-N	435.613	1.463	50	20	IDGD	
C=CCSCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](Br)CC)C2)C1	1832461525	YKPDYNKHHMPHOM-RHSMWYFYSA-N	435.384	1.536	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3ccc(C)nc3)CCO2)C1	1832912906	LHMCHPASEZOWIA-RXVVDRJESA-N	439.940	1.033	50	20	IDGD	
Cc1nc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)cs1	1832972287	HYAVAHDRVBBQLG-SJCJKPOMSA-N	446.367	1.234	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3cccc(Cl)n3)CCO2)C1	1833176627	OQPNEZVSDKFOQE-BEFAXECRSA-N	430.332	1.751	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)CCl)CC2)CC1	1833313271	CTRNFNPZBJALIJ-YOEHRIQHSA-N	428.788	1.394	50	20	IDGD	
CCc1[nH]nc(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](Cl)COC)CC3)CC2)c1F	1834040173	MZVGAVSYTLSXAN-HNNXBMFYSA-N	443.951	1.550	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccnc(Cl)c1)CCO2	1834182712	YNCQEWQOKPMUTB-LJQANCHMSA-N	441.988	1.657	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC(N2CCC(NC(=O)c3cc(=O)cco3)CC2)CC1	1834344733	YARKLXYYRRJAAD-UHFFFAOYSA-N	435.597	1.677	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccn(C(F)F)n3)C2)C1	1837715582	YLZJMFRIKQHDBI-SFHVURJKSA-N	446.527	1.200	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(Cl)ccn3)CCO2)C1	1837867293	MODPYHALGCVXML-SJKOYZFVSA-N	446.729	1.588	50	20	IDGD	
Cc1nc(F)ccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1838268081	ZGRYEQNEHLFJKK-YOEHRIQHSA-N	448.264	1.290	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@H](C)Cn3cncn3)CC2)CC1	1838421037	MLEUVKRZMNMGPR-CRAIPNDOSA-N	425.961	1.930	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(O)cc3)CCO2)C1	1838968732	SOSPZEIWRACYHU-KUHUBIRLSA-N	441.322	1.493	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)/C=C3\C(=O)Nc4ccccc43)C2)C1	1839145295	CKIGTWXLDXJGBO-LGQHBQANSA-N	447.919	1.496	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(F)c(OC)c3)C2)C1	1839148650	FKGFAWTUEZBNEF-MGPUTAFESA-N	428.888	1.922	50	20	IDGD	
Cc1cc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)no1	1839155115	JNZQOTOJHMDOSJ-QZTJIDSGSA-N	434.320	1.218	50	20	IDGD	
COc1cc(C)c(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)c(C)c1	1839408355	PTHYZEQXPLJJKM-YLJYHZDGSA-N	428.888	1.916	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)C3CCC4(CC3)OCCO4)CCO2)C1	1839773789	MXRMJHRJNWCVPT-YLJYHZDGSA-N	444.956	1.394	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cccs3)C2)C1	1839963963	BFMZVLCDTRMWCY-QAPCUYQASA-N	445.379	1.921	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)/C=C/c3cccnc3)C2)C1	1840030999	BYXUEVUHZWWXEC-LTGPNDRFSA-N	438.322	1.335	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C)cc(F)c3F)C2)C1	1840155363	ZDPQKCIRKAPZBW-FOIQADDNSA-N	446.878	1.597	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(F)cc(Cl)c3)C2)C1	1840156874	XDHQHRBLRVFJIY-APWZRJJASA-N	449.306	1.803	50	20	IDGD	
O=C1Cc2cccc(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)C(Cl)Cl)CCO4)c2N1	1840189938	UKSXCDBVTAELPW-LJQANCHMSA-N	442.299	1.055	50	20	IDGD	
C[C@H](C(=O)N1CCCC12CN(C(=O)c1cccc(B(O)O)c1)C2)c1ccc(Cl)cc1	1841197983	RWPXNEYUAAZUFT-HNNXBMFYSA-N	426.709	1.641	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC2(CCCN2C(=O)/C=C/C(=O)NCc2ccccc2)C1	1841329067	UGHLLDQKLGDNCF-ZHACJKMWSA-N	429.593	1.914	50	20	IDGD	
O=C([C@@H](O)c1cccc(Br)c1)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1	1841352511	SVGVBQYPLJNFRV-KGLIPLIRSA-N	431.714	1.286	50	20	IDGD	
Cc1occc1C(=O)N1CCCC12CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2	1842435525	LFQALZPZNLJORD-UHFFFAOYSA-N	439.516	1.751	50	20	IDGD	
O=C(c1c(Cl)ccc(Cl)c1O)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843014745	XMZIWILADOTTSU-UHFFFAOYSA-N	449.099	1.510	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC2(CCCN2C(=O)[C@H](CO)NC(=O)OC(C)(C)C)C1	1843324755	YOMONMUKQUWULG-STQMWFEESA-N	448.358	1.106	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)/C=C/c2cc3ccccc3o2)C1	1843835214	VGITZTVDRSFQMV-MDZDMXLPSA-N	430.269	1.643	50	20	IDGD	
CN(CC(=O)N1CC2(CCCN2C(=O)[C@H]2CCC=CO2)C1)NC(=O)NCc1ccccc1	1844246756	NSYSBRBJMPPFKX-LJQANCHMSA-N	441.532	1.229	50	20	IDGD	
Cc1c(C(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)ccc(F)c1F	1844265514	LADJRNRRVRCRLJ-UHFFFAOYSA-N	429.427	1.403	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)Cc1cccnc1)C2	1844692433	WYWKSRQJCLZWSI-UHFFFAOYSA-N	438.440	1.975	50	20	IDGD	
C=CCO[C@@H](C)C(=O)N1CC2(CCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)C1	1845038393	XXEFDPJXCNAJQB-SFHVURJKSA-N	443.548	1.127	50	20	IDGD	
COc1ccc(/C=C(\C#N)C(=O)O[C@@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)cc1	10866919	PEYIKIFENZCQCY-JMRXEAOASA-N	429.454	1.820	50	20	IDGD	
COc1ccc(-c2nn(CCC#N)cc2/C=C(\C#N)C(=O)NCCn2cncn2)cc1OC	726537529	NGODCDRIWGUFPV-LICLKQGHSA-N	446.471	1.796	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)cc1S(=O)(=O)NCC#N	726879969	FPLQMUYUKJASQC-UHFFFAOYSA-N	430.530	1.774	50	20	IDGD	
CCOC(=O)C1=NN(c2ccccc2)[C@H](C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)C1	727766183	JBUFTSNFKLMTBL-KDOFPFPSSA-N	442.447	1.938	50	20	IDGD	
CN1CCN(C[C@H](NC(=O)NNC(=O)COc2ccc(C#N)cc2)c2ccccc2)CC1	727945755	LXRSOPGEROCQDT-NRFANRHFSA-N	436.516	1.256	50	20	IDGD	
COc1ccc(N2C[C@H](C(=O)NNc3ccc(S(=O)(=O)NC4CC4)cc3)CC2=O)cc1	728210140	UWQAJDFNRXEWHC-CQSZACIVSA-N	444.513	1.632	50	20	IDGD	
Nn1c(COc2ccccc2)nnc1SCC(=O)NNC(=O)c1ccccc1Cl	729032850	OMLKUEMATURZQC-UHFFFAOYSA-N	432.893	1.778	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)c1oc2ccccc2c1CSc1ncccn1	729276861	MXQLSHBSDZUAIE-LLVKDONJSA-N	449.514	1.214	50	20	IDGD	
Cc1noc(CNC(=O)/C(C#N)=C/c2cn(CCC(N)=O)nc2-c2ccc(Cl)cc2)n1	729329482	MRRPNRWSGMALKX-RIYZIHGNSA-N	439.863	1.994	50	20	IDGD	
Cc1ccc(OCC(=O)N2CCN(C(=O)NNC(=O)Cn3ccc4ccccc43)CC2)cc1	729507500	UYSAGNBOEUQIGM-UHFFFAOYSA-N	449.511	1.914	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)c1ccc2c(c1)C(=O)N(C[C@H]1CCCO1)C2=O	731329397	KLMUGYLUWWGVTP-OAHLLOKOSA-N	425.416	1.604	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)CCc2ccc(C(=O)OC)cc2)c2ccccc2c1=O	731573097	YUMLIZOWHLXNPM-UHFFFAOYSA-N	436.468	1.987	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2ccc3nc(O)oc3c2)cc1Br	732048599	PPMJKFFPGGNNKZ-UHFFFAOYSA-N	442.247	1.928	50	20	IDGD	
CSC[C@H](C(=O)NNc1ccccc1S(C)(=O)=O)N1C(=O)[C@H]2CCCC[C@@H]2C1=O	732304536	ZNQMUKYSBCGMEM-KCQAQPDRSA-N	439.559	1.440	50	20	IDGD	
CCc1cc(N2CCC[C@@H](NC(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)C2)ncn1	732914768	VZHQVTQZFFNBSC-MRXNPFEDSA-N	446.533	1.056	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCCCC2)cc1S(=O)(=O)NNC(=O)c1ccccn1	733250088	ZNRRKOPOESVIGW-UHFFFAOYSA-N	438.531	1.188	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)[C@@H]2CC(=O)N(C)[C@H]2c2cccc(Cl)c2)C[C@@H](C)O1	734543613	QJIGMONQYVUAJE-QRKDATQKSA-N	436.940	1.506	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2ccccc2C(F)(F)F)CC1	735117725	HJCSOCDUBFEGEA-UHFFFAOYSA-N	443.451	1.793	50	20	IDGD	
C[C@H]1CCC[C@@H](OCC(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)C1	735118229	NLFIMCXRQCNUKS-JKSUJKDBSA-N	425.555	1.056	50	20	IDGD	
O=C(CN1CCN(C(=O)CCCC[C@@H]2CCSS2)CC1)N[C@@H]1CCS(=O)(=O)C1	736165220	AEXYGJJQTJGYJV-HZPDHXFCSA-N	449.664	1.148	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)Cn2c(=O)nc(O)c3ccccc32)cc1C	736754921	PPQGIVWTDNLDMS-UHFFFAOYSA-N	444.469	1.039	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@@H](C)C(=O)N2CCCC[C@@H]2C)c2ccccc2c1=O	737054707	SUCXTQWQWCNPSA-KBPBESRZSA-N	428.493	1.150	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)[C@@H]1CCN(c2ccc(Cl)c(Cl)c2)C1=O	740850044	RIOYPHFUKLPKQO-LBPRGKRZSA-N	429.304	1.799	50	20	IDGD	
CCO[C@H](C)c1ncc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)s1	742470258	CDKJVBYQRQORKH-LLVKDONJSA-N	426.520	1.566	50	20	IDGD	
C[C@H](CC(=O)NNC(=O)c1cccc(N(C)C)c1)/N=C1/NS(=O)(=O)c2ccccc21	742487159	LHZRQWXABGFTBH-CYBMUJFWSA-N	429.502	1.031	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)N[C@@H](C)COCC(F)(F)F	742760771	RLWBXIZKSOTDGO-VIFPVBQESA-N	425.433	1.200	50	20	IDGD	
CN(C)S(=O)(=O)c1ccsc1C(=O)NNC(=O)c1cccc(Br)c1	742771351	PCMOJXFTNAXLIE-UHFFFAOYSA-N	432.321	1.836	50	20	IDGD	
Cc1nn(C)c(C)c1S(=O)(=O)N[C@H](C)C(=O)NNC(=O)Cc1ccc2ccccc2c1	743311672	QMTKODOGQLSPIU-CQSZACIVSA-N	443.529	1.247	50	20	IDGD	
O=C(NNc1ncnc2[nH]cnc12)c1cc([N+](=O)[O-])ccc1I	743471511	LQGUCKWFJWEUPE-UHFFFAOYSA-N	425.146	1.623	50	20	IDGD	
O=C(NNC(=O)N1CCN(Cc2cccc(F)c2)C(=O)C1)c1cnn(-c2ccccc2)c1	743609125	NULUHNICRNWVRE-UHFFFAOYSA-N	436.447	1.710	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c1NC(=O)c1ccncc1	743741467	FYCYTCQGMGNRII-UHFFFAOYSA-N	442.439	1.693	50	20	IDGD	
C[C@H](OC[C@@H]1CCCCO1)C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	744619868	BHRNOAILKQAVQN-HOTGVXAUSA-N	427.523	1.125	50	20	IDGD	
O=C(C[C@@H]1C(=O)Nc2ccccc21)NNc1ccccc1S(=O)(=O)N1CCOCC1	744620663	JNNASLIGOMWOTL-HNNXBMFYSA-N	430.486	1.277	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)[C@@H](c2ccccc2F)N2CCOCC2)c1	745499854	QKUBZRIRSYKKAA-HXUWFJFHSA-N	429.448	1.512	50	20	IDGD	
COc1cc(I)c(Cl)cc1C(=O)NNC(=O)N1CCOCC1	745985972	GCRPKQITDHFVOS-UHFFFAOYSA-N	439.637	1.640	50	20	IDGD	
CCCS(=O)(=O)N1CCCC[C@H]1C(=O)NNC(=O)c1ccc(CN(CC)CC)o1	746397176	NOMYKYCJVCZJDD-INIZCTEOSA-N	428.555	1.477	50	20	IDGD	
C=CCOc1cn(-c2ccccc2)nc1C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	746586640	HBGQXTDVCAJHJN-UHFFFAOYSA-N	440.481	1.915	50	20	IDGD	
CN(C)[C@H](CNC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)c1ccc(Cl)cc1	746776362	DEJZNKZPBPZNHX-QGZVFWFLSA-N	442.907	1.834	50	20	IDGD	
CC(C)OCCN1CCC(NC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)CC1	747590656	LYOSXRSJIZHWAG-UHFFFAOYSA-N	430.509	1.411	50	20	IDGD	
CCCCN1C(=O)CC[C@@H](C(=O)NNC(=O)C(=O)N2CCCC2)[C@@H]1c1ccc(OC)cc1	748240260	DFGNYLCEDLJQNZ-QUCCMNQESA-N	444.532	1.545	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)N[C@H]1CCN(c2cccc(OC(F)(F)F)c2)C1	748636848	XYOINJZLGPIAOJ-OLZOCXBDSA-N	434.415	1.546	50	20	IDGD	
CS(=O)(=O)c1cc(Br)cc(C(=O)NNC(=O)c2ccc(C#N)cc2)c1F	748728690	RVZZEZGZCVPRFP-UHFFFAOYSA-N	440.250	1.938	50	20	IDGD	
CC[S@](=O)[C@H]1CCC[C@@H](NC(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)C1	750265268	BJIVBEAUCFJSMR-JFTGJMIGSA-N	427.523	1.736	50	20	IDGD	
O=C(COC(=O)c1cnn(-c2ccc(Cl)cc2)n1)NNC(=O)c1ccc([N+](=O)[O-])cc1	751821490	YVQFWWRMKXVNQR-UHFFFAOYSA-N	444.791	1.447	50	20	IDGD	
CC(C)Oc1ccc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1N	754585844	AJVDEZGKLVCQGB-GOSISDBHSA-N	429.429	1.200	50	20	IDGD	
O=C(CN1CCN(C(=O)OCc2ccccc2)CC1)NNc1ccc(C(F)(F)F)nn1	755191492	GYRNYNRTVODOSC-UHFFFAOYSA-N	438.410	1.893	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)Nc2cccc(OCC(=O)N3CCCC3)c2)c1O	755658062	QMBZQMPGZYDIDE-UHFFFAOYSA-N	428.445	1.869	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)N[C@H]1CCN(c2c(F)cccc2F)C1=O	756210332	CDGCEJCZOAXWTR-ZDUSSCGKSA-N	449.370	1.388	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(C(=O)NNC(=O)c2cc(Br)ccc2O)co1	756780038	OHOOMTBIEMVXJO-UHFFFAOYSA-N	432.252	1.073	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)N[C@@H]1CCN(C(=O)CCc2ccccc2)C1	756981058	YTPSXMDNUQJZDB-GOSISDBHSA-N	434.500	1.441	50	20	IDGD	
CC(C)(C)OC(=O)N1CCc2cccc(C=NNC(=O)CSc3nnc(O)nc3O)c21	757564178	ISVPNIPLROKCCL-UHFFFAOYSA-N	446.489	1.823	50	20	IDGD	
COc1ncc(NC(=O)NNC(=O)c2cc(F)ccc2Br)cc1C(N)=O	757691029	BUOFNTSWAOKONA-UHFFFAOYSA-N	426.202	1.557	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Nc2ccnn2Cc2ccccn2)cc(OC)c1OC	757786403	LAXCOKXFAVLOLN-UHFFFAOYSA-N	426.433	1.819	50	20	IDGD	
O=C(NNc1nccc(N2CCOCC2)n1)c1cncc(I)c1	757912700	NRQLEOXXLNUXMI-UHFFFAOYSA-N	426.218	1.070	50	20	IDGD	
Cc1c(CCC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)cnn1C	758042881	DWCNSDPTZIXPDA-UHFFFAOYSA-N	433.534	1.297	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cccnc2Br)cc1	758152341	SRZHGFXUMWVISE-UHFFFAOYSA-N	441.307	1.234	50	20	IDGD	
O=C(NC[C@@H](c1cccc(Cl)c1)N1CCOCC1)NNC(=O)C(=O)Nc1ccccn1	758748589	WIMUYTUEIDDOLJ-INIZCTEOSA-N	446.895	1.077	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)N[C@@H]2CN(C(=O)OC(C)(C)C)C[C@H]2C#N)cc1	758761958	RZBWLCFLXGRWQI-CZUORRHYSA-N	433.465	1.163	50	20	IDGD	
O=C(NC[C@@H]1CN(Cc2ccccc2)CCCO1)NNC(=O)[C@H]1COc2ccccc2O1	759233499	UUNPRLZITBHTQT-WIYYLYMNSA-N	440.500	1.448	50	20	IDGD	
CCCn1c(C)cc(/C=C(\C#N)C(=O)NS(=O)(=O)c2nnc(NC(C)=O)s2)c1C	759507886	BOCFAEMFWMZDKH-RIYZIHGNSA-N	436.519	1.737	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(Cl)c(C(=O)NNc2ccc(C(=O)OC)cn2)c1	759728715	HSMCBLOADHTFDO-UHFFFAOYSA-N	442.881	1.203	50	20	IDGD	
O=C(c1ccc(-c2nnc(S)o2)cc1)N1CCN(S(=O)(=O)CBr)CC1	760024023	FAWZSQWBEBEDSH-UHFFFAOYSA-N	447.336	1.465	50	20	IDGD	
Cc1nc2ccnn2c(C)c1C(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	761169288	MWPASHFTUINIHQ-UHFFFAOYSA-N	431.497	1.690	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)Cc2cc(F)cc3c2OCOC3)c2ccccc2c1=O	761653317	LMLGCKMTSUMGNR-UHFFFAOYSA-N	440.431	1.987	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H]1[C@H]1COCCC1=NNC(=O)[C@H]1CCS(=O)(=O)C1	762418876	UMZZEJWIYKLXGX-OFQRWUPVSA-N	429.539	1.329	50	20	IDGD	
C[C@H](Sc1ccccn1)C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	762535555	FCWIXUMRUKQXEF-HNNXBMFYSA-N	435.575	1.642	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc(OC)c1O	763292087	HUHXEMBDMIFHBV-UHFFFAOYSA-N	428.489	1.383	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)C(=O)Nc2ccn(-c3ccncc3)n2)c1	763596317	VTLKHSZCVZBDAO-UHFFFAOYSA-N	436.472	1.864	50	20	IDGD	
O=C(CN1CCCc2ccccc21)NNC(=O)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1	763746487	YFGJJBOXWLCCQJ-UHFFFAOYSA-N	431.836	1.787	50	20	IDGD	
CC(=O)N1CCCc2cc(NC(=O)C(=O)NNC(=O)c3cc4c(s3)CCC4)ccc21	763784921	JWZPWGLWCBQYFQ-UHFFFAOYSA-N	426.498	1.936	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)C(=O)Nc2cnn(CCC)c2)c2ccccc2c1=O	763805126	SCVNJIZFCSGLIC-UHFFFAOYSA-N	439.476	1.203	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)cccc1C(=O)N1CCCC1	763837278	DKLLPVHCFGFJCQ-UHFFFAOYSA-N	442.447	1.535	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)C(=O)Nc1cccc(N2CCCCC2=O)c1	763839085	FJPZMLWSLIRPPX-UHFFFAOYSA-N	428.420	1.508	50	20	IDGD	
Cc1c(CS(C)(=O)=O)cccc1NC(=O)C(=O)NNC(=O)Cc1c[nH]c2ccccc12	763861686	TZARPPMFHPKYDH-UHFFFAOYSA-N	442.497	1.350	50	20	IDGD	
Cn1ccnc1-c1csc(NC(=O)C(=O)NNC(=O)CCSc2ccc(F)cc2)n1	763895768	SEMIBLGJYZLQST-UHFFFAOYSA-N	448.505	1.951	50	20	IDGD	
Cn1nc2c(c1NC(=O)C(=O)NNC(=O)C1=S=C3CC[C@H](C(C)(C)C)CC3=C1)CCC2	763942313	UMHKGTMABKZBQV-ZDUSSCGKSA-N	443.573	1.859	50	20	IDGD	
C[C@H]1COCCN1c1ccc(NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)cc1	763979566	YENQYFFXYGLQMF-LBPRGKRZSA-N	432.864	1.670	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1cccn(CC(F)(F)F)c1=O	764010663	BZRPJBRKTZBXSN-UHFFFAOYSA-N	446.769	1.472	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccc(C(=O)N2CCCC2)cc1C	764136372	POKGROJYLWXERP-UHFFFAOYSA-N	438.484	1.568	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)CCOc2ccccc2)cc1	764165987	BSKILPFADSRNBA-UHFFFAOYSA-N	434.474	1.003	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CCCc2ccccc2)c(OCC(=O)N(C)C)c1	764226564	ONXKFEDEYWEUBI-UHFFFAOYSA-N	440.500	1.571	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(Cl)cc2C(=O)N2CCCC2)c1	764235888	SMWOLZVMZCGYBO-UHFFFAOYSA-N	439.859	1.847	50	20	IDGD	
O=C(NNC(=O)c1cccc2ncccc12)C(=O)Nc1ccc(OCC(F)(F)F)nc1	764253701	SGNNCOYKXYQHDB-UHFFFAOYSA-N	433.346	1.971	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1ccccc1OC[C@H]1CCCCO1	764279866	GNJUYRBSPOVJFA-OAHLLOKOSA-N	443.456	1.505	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)cc1S(C)(=O)=O	764349157	GCBCRCFVSFGOMF-UHFFFAOYSA-N	425.850	1.157	50	20	IDGD	
C[C@H]1C[C@@H](C)CN(C(=O)c2ccccc2NC(=O)C(=O)NNC(=O)Cc2ccncc2)C1	764356326	UUAKKQYQTAZURZ-IYBDPMFKSA-N	437.500	1.528	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(N2CCSCC2)c(Cl)c1	764397725	BLITWIMNQJCWFU-GFCCVEGCSA-N	444.941	1.031	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(-n2nccc2C(F)(F)F)cc1	764398904	IKRNLRFUYLFRIW-NSHDSACASA-N	443.382	1.029	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)C(=O)Nc1ccc(-c2csnn2)cc1	764405910	YJGPVKCDVWXKBX-UHFFFAOYSA-N	429.483	1.789	50	20	IDGD	
O=C(CN1C(=O)COc2ccc(Cl)cc21)NNC(=O)c1cc(-c2cccs2)[nH]n1	765563716	DPDUZVLFSQNBPO-UHFFFAOYSA-N	431.861	1.978	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)NC[C@H]2CCCCN2C2CC2)c2ccccc2c1=O	765667572	QFOJAWGMBGKIEP-MRXNPFEDSA-N	426.521	1.938	50	20	IDGD	
CN1CCO[C@@H]([C@@H](NC(=O)NNc2nc(O)c3cnn(C)c3n2)c2ccc(Cl)cc2)C1	766319488	LVPSDXMADYJVMR-CABCVRRESA-N	446.899	1.420	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NN=Cc3ccc(C#N)c(C)c3)CC2)cc1	766454331	XPIXHIUDZFBQRP-UHFFFAOYSA-N	439.541	1.632	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)CN1CCN(C(=O)c2cc3occc3s2)CC1	766900313	XBDMKLVTXRLPKE-UHFFFAOYSA-N	440.525	1.951	50	20	IDGD	
COc1ccc(N2C[C@H](C(=O)OCC(=O)NNC(=O)Cc3ccccc3C)CC2=O)cc1	767279175	OMSNMYNKFJDVBC-QGZVFWFLSA-N	439.468	1.290	50	20	IDGD	
CCNS(=O)(=O)c1ccc(C)c(C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)c1	768288695	ADZTUTHECVLXKC-UHFFFAOYSA-N	445.476	1.897	50	20	IDGD	
COC(=O)c1cccc(CCNC(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)c1	768678480	RAHMJZCZLQUVFA-UHFFFAOYSA-N	431.445	1.686	50	20	IDGD	
CCOCCCn1c(NNC(=O)c2cnc(O)c([N+](=O)[O-])c2)nc2ccccc2c1=O	770485157	QFNNLOGALZZOQZ-UHFFFAOYSA-N	428.405	1.589	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)c2cccnc2I)c2ccccc2c1=O	770551466	XKBPUJXGDGVLGD-UHFFFAOYSA-N	449.208	1.008	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)N1CCC(C(=O)N2CCOCC2)CC1	770648108	FEGFYZZUEXDTRT-AWEZNQCLSA-N	438.912	1.419	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)C(=O)Nc1ccnn1-c1cccc(F)c1	770771771	OSGBDEQVZDPUEE-UHFFFAOYSA-N	448.455	1.402	50	20	IDGD	
COc1ccccc1N1C[C@H](C(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)CC1=O	772193309	ULEIDUDMKXDTHT-CQSZACIVSA-N	444.875	1.165	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)NC3CCOCC3)cc2)cc1F	773886412	VMZMKOOHGSTKGI-UHFFFAOYSA-N	442.447	1.443	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)NCc1nc2ccc([N+](=O)[O-])cc2[nH]1	775174296	ZRJOXRCQSJSYLL-UHFFFAOYSA-N	436.226	1.716	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCc2nc3ccc([N+](=O)[O-])cc3[nH]2)cc(OC)c1OC	775179014	YNPAUCOYKLQAKZ-UHFFFAOYSA-N	444.404	1.641	50	20	IDGD	
O=C(NNc1ccc([N+](=O)[O-])cc1)Nc1ccc(F)c(S(=O)(=O)N2CCOCC2)c1	775532809	YUQZXYLWYJNVBV-UHFFFAOYSA-N	439.425	1.903	50	20	IDGD	
Cn1cc(S(=O)(=O)NNC(=O)NC2CCCCC2)cc1C(=O)NCC(F)(F)F	775669457	JTEBQOCBPMHMMR-UHFFFAOYSA-N	425.433	1.142	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)Nc2ccc(OCCN3C(=O)c4ccccc4C3=O)cc2)cn1	775872380	QBFSSYHMUHPHJO-UHFFFAOYSA-N	448.439	1.562	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)NCCCCN2CCN(c3ncccn3)CC2)c1	776619814	XQXQWPOPKUVRNY-UHFFFAOYSA-N	447.565	1.109	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)c1ccc(N2CCCS2(=O)=O)cc1Cl	778446020	ZUCKSLURDBFXPT-UHFFFAOYSA-N	446.913	1.166	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(C(=O)NNC(=O)CSc2ccc(Cl)cc2)n(C)c1	778531175	WHYINRLXGPTJLL-UHFFFAOYSA-N	430.939	1.482	50	20	IDGD	
CCn1cc(-c2n[nH]cc2C(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)cn1	779413157	DDSKKQPTQYEGSZ-UHFFFAOYSA-N	446.512	1.542	50	20	IDGD	
CC(C)(C)[C@H]1CCc2sc(C(=O)NNC(=O)NCC3CN(S(C)(=O)=O)C3)cc2C1	779696141	CPWWBXOVHMUDKW-AWEZNQCLSA-N	442.607	1.735	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2nnc(C)s2)c1	780897102	MTUOQNSXPHBJAP-UHFFFAOYSA-N	426.524	1.021	50	20	IDGD	
O=C(NCc1ccccc1CN1CC[C@H](O)C1)NNC(=O)c1cnn(-c2ccccc2)c1	781803355	DZWQUNWCTIFCLV-NRFANRHFSA-N	434.500	1.583	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NCc1ccccc1CN1CC[C@H](O)C1	781954848	OGGSDEQQYYZSKY-KXBFYZLASA-N	430.480	1.690	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)c2cc([N+](=O)[O-])cnc2N)cc(OCC)c1OCC	782162548	PMEBYNCQYVYUMC-UHFFFAOYSA-N	433.421	1.843	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1ccccc1SC(F)F	784004647	ZJQXBCICIXQIOS-UHFFFAOYSA-N	428.442	1.579	50	20	IDGD	
C[C@@H]1CN(C(=O)c2ccc(NC(=O)C(=O)NNc3cccc([N+](=O)[O-])c3)cc2)C[C@@H](C)O1	784827351	AYGJCDGUKPQKEY-ZIAGYGMSSA-N	441.444	1.926	50	20	IDGD	
COc1cccc(NNC(=O)C(=O)Nc2c(C(=O)N3CCOCC3)oc3ccccc23)n1	784846345	PZGOBLHBPPZAPD-UHFFFAOYSA-N	439.428	1.391	50	20	IDGD	
O=C(NNc1ccc(Cl)nc1)C(=O)Nc1cc(N2CCCS2(=O)=O)ccc1F	784871642	SFUBKLYAFDSERK-UHFFFAOYSA-N	427.845	1.496	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1	785331105	OUBMMQZHXXHOST-UHFFFAOYSA-N	442.837	1.742	50	20	IDGD	
Cc1ccc(C(N)=O)cc1NC(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	785843185	GVLLSGBRTNXZLL-UHFFFAOYSA-N	434.497	1.735	50	20	IDGD	
CCOC(=O)c1cnn(C)c1NC(=O)C(=O)NNc1nc2ccc(OC)cc2cc1C	786432801	ZGHXEIBNYRANSH-UHFFFAOYSA-N	426.433	1.544	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCCc2ccccc2OC(F)F)c1	788114426	PHDCRTPOZXPDBR-UHFFFAOYSA-N	427.429	1.878	50	20	IDGD	
COc1ccc(F)c(C(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)c1OC	788518817	WBDNSNPJPSGZHZ-UHFFFAOYSA-N	444.507	1.730	50	20	IDGD	
CC(=O)Nc1ccc(CNC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cn1	789294255	IFOATBOAEGNBRG-UHFFFAOYSA-N	439.520	1.083	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1nc2c(s1)CCCCCC2	789731860	NBTXRIXKUKYUMH-UHFFFAOYSA-N	430.486	1.973	50	20	IDGD	
CCNC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)c1C	789741468	VOFPPSCNTSVCFF-UHFFFAOYSA-N	431.424	1.440	50	20	IDGD	
CSc1nc(C2CC2)cc(C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c1C#N	790060937	LZKVFMZBWJYOHN-UHFFFAOYSA-N	434.481	1.874	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)NCC(=O)NNc2ccc(Cl)c(OC)c2)cc1	790188153	XVAGBTVTDDQOFQ-UHFFFAOYSA-N	441.893	1.947	50	20	IDGD	
COc1ccc(C(=O)N2CCC(NC(=O)NNc3nc4ccccn4n3)CC2)cc1OC	790371264	GQUCPURRNKCBNF-UHFFFAOYSA-N	439.476	1.677	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)N2CCN(CC(=O)Nc3ccc(Cl)cc3)CC2)n1	793221030	UXSMTRJXJKPOHQ-UHFFFAOYSA-N	430.896	1.654	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)[C@]1(C)CCN(C(=O)OCc2ccccc2)C1	793784607	XWDSOARBTOJOCI-OAQYLSRUSA-N	434.493	1.707	50	20	IDGD	
COc1cccc(C(=O)CCCC(=O)NNC(=O)c2csc(N3CCOCC3)n2)c1	794217980	KWSUHXIKOPIYRE-UHFFFAOYSA-N	432.502	1.803	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)N1CC[C@H](N2CCN(C(=O)OC(C)(C)C)CC2)C1	796616149	UFGUCRCCJCLUQS-SJORKVTESA-N	425.574	1.195	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)Nc1cc(S(=O)(=O)N2CCCC2)ccn1	797674405	UHQCNOLIGFPSKE-UHFFFAOYSA-N	434.434	1.241	50	20	IDGD	
CC(C)(C)[C@@H](NC(N)=O)C(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1	800328110	HFZRFYBUFYSBQF-UXHICEINSA-N	437.544	1.844	50	20	IDGD	
COc1ccc(C(=O)CCC(=O)NNC(=O)C(=O)Nc2ccc(C)cc2)c(OC)c1OC	801106299	TYQYVUFDNQMCBA-UHFFFAOYSA-N	443.456	1.770	50	20	IDGD	
COc1ccc(C2=NO[C@H](CNC(=O)NNC(=O)Cc3cn4ccccc4n3)C2)cc1C	802356026	KPILHQRGNCZYEC-KRWDZBQOSA-N	436.472	1.717	50	20	IDGD	
CC(C)(C)OC(=O)N1CCOC[C@H]1CC(=O)NNC(=S)NCCc1cccs1	803159943	UKIYKLJNMOGLEC-CYBMUJFWSA-N	428.580	1.812	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1ccc(OC)c(F)c1N	805601046	WMLBUAGBANDYDU-UHFFFAOYSA-N	425.800	1.697	50	20	IDGD	
CC(C)N1CCN(c2cccc(NC(=O)C(=O)NNc3ccc(-n4ccnc4)nn3)c2)CC1	807428575	CMXCIXWCNWCZLC-UHFFFAOYSA-N	449.519	1.275	50	20	IDGD	
O=C(NNC(=O)c1nc2ccccc2cc1Br)N[C@@H]1CCS(=O)(=O)C1	808384941	GOXFYWUTTSAGBM-SNVBAGLBSA-N	427.280	1.128	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)CNS(=O)(=O)c1ccc(NC(C)=O)cc1)c1ccccc1	810379141	QIFCIWUYVBQOOU-SFHVURJKSA-N	432.502	1.265	50	20	IDGD	
C[C@H]1CN(c2ccc(C(=O)NNc3ccc(S(=O)(=O)N(C)C)cc3)cn2)C[C@H](C)O1	812729394	LEEQYDWYGLYNEU-GJZGRUSLSA-N	433.534	1.702	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@H](F)C[C@H]1CNC(=O)NNC(=O)c1nnc(O)c2ccccc12	813814693	VGVCCPLNMHOONX-RYUDHWBXSA-N	448.455	1.627	50	20	IDGD	
CN(C)c1cc(Br)cc(C(=O)NNC(=O)CNC(=O)c2cccs2)c1	814407845	LOXRYIJYZSFSGW-UHFFFAOYSA-N	425.308	1.768	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)CSc2ccccc2O)c(F)cc1C	815029613	PZAKWZHOMVMIHJ-UHFFFAOYSA-N	428.463	1.728	50	20	IDGD	
O=C(CC(F)(F)F)NNC(=O)C(=O)Nc1cccc(S(=O)(=O)C2CCCCC2)c1	815568511	KVCXXMLLLJFZPL-UHFFFAOYSA-N	435.424	1.831	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)Cc3cc(C)no3)c2)cc1	816827797	FTOZDWGOHYMJRT-UHFFFAOYSA-N	444.469	1.796	50	20	IDGD	
CCOc1ccc(NNC(=O)[C@@H](CCC(N)=O)NS(=O)(=O)c2ccc(C)c(C)c2)cc1	817925343	CBGATYBVDKCBKG-LJQANCHMSA-N	448.545	1.758	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2ccc(=O)n(Cc3ccccc3)n2)cc(OC)c1OC	859240993	ANIODKKOTOSKLR-UHFFFAOYSA-N	438.440	1.392	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)[C@@H](C(C)C)N1C(=O)c2ccccc2C1=O	869789340	XPQWHOOQFDFVEN-HXUWFJFHSA-N	439.468	1.932	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)CNS(=O)(=O)c3cccc(C#N)c3)cc2C1	913162551	YXDSOKFHRBHRNQ-GFCCVEGCSA-N	432.527	1.484	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)CNS(=O)(=O)c2ccccc2C(F)(F)F)c1	913445640	DLKMZYXOZWQOLB-UHFFFAOYSA-N	445.419	1.519	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)ccc1OCc1cccnc1	915262008	ONWOGCHQZQGHCW-MRXNPFEDSA-N	433.486	1.255	50	20	IDGD	
O=C(NC[C@H](c1ccccc1)N1CCc2sccc2C1)NNC(=O)C(=O)NC1CC1	916511365	PYDLPAHEYOEHEV-QGZVFWFLSA-N	427.530	1.457	50	20	IDGD	
CCN(CCCNC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)C(=O)OC(C)(C)C	916630253	HLQBZXNXHKZCEC-UHFFFAOYSA-N	432.485	1.253	50	20	IDGD	
O=C(NCc1ccoc1)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	916636045	OKIZEYZODRUHGW-UHFFFAOYSA-N	428.470	1.902	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)NCc1cccc(C(=O)NCc2ccco2)c1	918133593	HOPRMXBKWCPQLK-UHFFFAOYSA-N	447.451	1.991	50	20	IDGD	
CCOc1cc(CNC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)ccc1OC(F)F	918226884	DFYTVHNYQUIRAY-UHFFFAOYSA-N	447.402	1.807	50	20	IDGD	
COc1cc(-n2cnnn2)c(Cl)cc1C(=O)OCC(=O)NNC(=O)c1ccc(C)cc1	919382862	STKIZSZFNFTAJP-UHFFFAOYSA-N	444.835	1.251	50	20	IDGD	
COCCOc1cccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1	919678252	ZNDKYAWYNAYQPB-UHFFFAOYSA-N	447.513	1.571	50	20	IDGD	
O=C(NNC(=O)c1ccccc1C(=O)c1ccc(Cl)cc1)N[C@H]1CCS(=O)(=O)C1	919889927	WYEGLPHHDMGQTI-AWEZNQCLSA-N	435.889	1.702	50	20	IDGD	
NC(=O)c1ccc(/C=C\C(=O)N2CCC[C@H]2C(=O)NNC(=O)NC2CCCCC2)cc1	920029495	DUZRVRCRHVNONN-GFBZKKKVSA-N	427.505	1.453	50	20	IDGD	
COc1cccc(CC(=O)N2CCN(CC(=O)NNC(=O)c3cccc(Cl)c3)CC2)c1	921061325	GWLXUYIRPSOKIK-UHFFFAOYSA-N	444.919	1.497	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)c1ccc(S(=O)(=O)NCCC#N)cc1	921159940	WGWODAVZUHDAHR-UHFFFAOYSA-N	430.486	1.281	50	20	IDGD	
C[C@H]1CN(C[C@@H](C)C(=O)NN=Cc2c(Br)cc(C(=O)O)n2C)C[C@@H](C)O1	1116077158	OMXZYWJZDCYYTQ-UTUOFQBUSA-N	429.315	1.681	50	20	IDGD	
Cc1nc2ncccn2c1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1777901736	QJYNGIHYBSTDOK-GUYCJALGSA-N	440.273	1.172	50	20	IDGD	
O=C(c1ccc2c(c1)COC2)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1777914550	HXUACLIBHOSLEQ-YJBOKZPZSA-N	427.270	1.851	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3nn(C)c4c3CCC4)C2)C1	1777963960	ATOFERRKKFGBTP-KZULUSFZSA-N	425.327	1.136	50	20	IDGD	
O=C(c1ccc2cccnc2n1)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1778434003	UYEGIZUBJYMNAC-KDOFPFPSSA-N	437.269	1.764	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)/C=N/O[C@H]3CCCCO3)C2)C1	1779104606	FIUKYYSPFXZXPY-ACJPLXPYSA-N	436.336	1.582	50	20	IDGD	
C[C@H](CS(C)(=O)=O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CO[Si](C)(C)C)C1	1779539753	KVKSDAZSIAQQSE-GPMSIDNRSA-N	448.658	1.033	50	20	IDGD	
C=C[C@H](O)C(C)(C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CO[Si](C)(C)C)C1	1779545533	VUARAULFWZHROY-CSODHUTKSA-N	426.630	1.925	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc(N(C)C)nc2)C1	1779860848	COPZSHFTXLCIFZ-CSODHUTKSA-N	438.956	1.529	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H]1CCNC(=O)C1)C2	1780714386	BUISMEDNDIFEQE-TUFGIGEDSA-N	434.364	1.263	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)c3cnn4cccnc34)CCO2)C1	1781230276	OYXVKGNDMNMNOT-ZWKOTPCHSA-N	426.304	1.409	50	20	IDGD	
Cc1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](O)CCl)C3)cc2c[nH]nc12	1781245746	KFMHUTRVXDYNTD-CSODHUTKSA-N	434.924	1.599	50	20	IDGD	
O=C(c1cc[nH]c2nccc1-2)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781331759	VPCAITIQORQFCC-DYVFJYSZSA-N	425.258	1.649	50	20	IDGD	
O=C(Cn1cnc2ccccc21)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781332773	FACXMTMGTVRRIN-WMZOPIPTSA-N	439.285	1.557	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H]1C[C@@H](O)C1)CCO2	1782866378	RWYMYJYOPUWBRE-FKRLUAHMSA-N	431.439	1.473	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cc(C)nc(O)c3)CCO2)C1	1783347879	QEUIYUOVKBANFM-RDTXWAMCSA-N	426.311	1.713	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H]1Cc3ccccc3O1)CCO2	1783349651	QESBCKLUOLGXHC-XAUMDUMWSA-N	437.334	1.994	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccc4nn(C)cc4c3)CCO2)C1	1783536273	ILUOHLSNQAIUEE-BFUOFWGJSA-N	435.322	1.800	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)c1cc(C2CC2)on1	1783762479	MXAKDSOLPNIDGM-GVARAGBVSA-N	430.274	1.836	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cc(Cl)cc4nn[nH]c34)CCO2)C1	1783880969	HHFGJAAUBJUNAE-SCLBCKFNSA-N	442.303	1.309	50	20	IDGD	
COC(=O)c1ccc(CC(=O)N2CC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)cc1	1784160345	HZPMQQCSBIESBG-IBGZPJMESA-N	429.300	1.649	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](C)Oc3ccccn3)C2)C1	1784490681	BMGZQLBLBNSCED-VCBZYWHSSA-N	440.338	1.852	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@](C)(O)C(F)(F)F)[C@H]2C1	1784877651	RKFNTXUKDPQAPO-MMROJZCPSA-N	431.249	1.063	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CC#N)C[C@@H]21	1785075275	BTUDRDQVBNXHNG-AJNGGQMLSA-N	428.917	1.012	50	20	IDGD	
CCOCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)[C@H]2C1	1785076465	JSLFXWITEQJVLK-VGWMRTNUSA-N	447.960	1.135	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnnc4ccccc34)[C@H]2C1	1787886076	QNDHZSARYGMBDN-KUZCPNRJSA-N	432.908	1.477	50	20	IDGD	
C[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)n1ccccc1=O	1788749964	RNRWSGIQOCXSJK-BLDNINTCSA-N	444.301	1.080	50	20	IDGD	
COC(=O)[C@@H]1CC[C@@H](C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]3C2)C1	1789867582	GFUCWRLRAGYMAD-IZAUMXAJSA-N	449.375	1.792	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21)c1ccccc1-n1nccn1	1790167879	LREUFJZHTBCOLJ-NOLJZWGESA-N	438.315	1.664	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](CN)c3ccccc3)C[C@@H]21	1791057944	LXKDIUDHHRDDGN-HILJTLORSA-N	438.366	1.492	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnnc(Cl)c1)C2	1792870844	WZCLQUSRCOFNBV-ZKCLLBTKSA-N	431.718	1.364	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccco1)C2	1793878195	CPWDGEWUIUWUHJ-FQLMCAECSA-N	441.912	1.615	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2)[C@@H]1CC(=O)N(Cc2cccs2)C1	1793974547	SUVKGAZDFVDFDF-XIUQWWLSSA-N	443.928	1.221	50	20	IDGD	
COc1cccnc1CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CO[Si](C)(C)C)C2	1794031185	XFUCGQJCJFWTSE-VPTLXERWSA-N	435.597	1.464	50	20	IDGD	
O=C(Cn1ccc2sccc2c1=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2	1794045170	LZGUNEMDUVEFMS-OXUXUCFPSA-N	427.885	1.187	50	20	IDGD	
CN(C)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)C2	1795437273	BYEAWRICXYCUTF-JFABSOQWSA-N	432.471	1.413	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)c1cccc2cccnc12	1796189083	ULGYDMAABFOSJG-ACDBMABISA-N	429.285	1.480	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc3cccnc3[nH]1)C2	1796892632	ZTEVURCCIVAONY-FKDCUARVSA-N	447.499	1.949	50	20	IDGD	
Cc1nc2sccn2c1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CO[Si](C)(C)C)C2	1797545453	QOOHIKSAGNKIAT-MIFYACCESA-N	436.610	1.759	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccn2nccc2c1	1797554786	UHSGQXGWBAZNQV-QHHYFVSCSA-N	425.316	1.774	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(F)cnc1Cl)C2	1797956810	FANQCDXVVZUCHM-DRXBFXEBSA-N	429.952	1.929	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(Cl)c3nncn3c1)C2	1799268828	CPXSAXXPIAWRHJ-XFMPKHEZSA-N	426.304	1.603	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CCCN1C(=O)OC(C)(C)C)C2	1799270212	LAQCHFHOEPWEJA-QEOTZNIISA-N	443.972	1.993	50	20	IDGD	
CC[C@H](C)[C@@H](N)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C#N)=C/c1ccc(F)cc1F	1800332620	TZSZIVPVYBYRFI-HVWFQETQSA-N	446.498	1.835	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1noc(C(C)C)n1)C2	1800639966	DJDORUWSDZSKHZ-OQMKEHIESA-N	443.342	1.499	50	20	IDGD	
Cc1ccc(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)o1	1803778536	BYAFDVOMCUWVDA-GHTZIAJQSA-N	433.273	1.296	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)CCN2C(=O)C=CC2=O)[C@@H]1c1cccnc1	1803912804	KGZICDCFXCNUBL-WWMYMODYSA-N	446.935	1.810	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H](CNC(=O)c2ccc[n+]([O-])c2)[C@@H]1c1cccnc1	1804783548	STIKLFVUIHUAOE-XLIONFOSSA-N	428.565	1.886	50	20	IDGD	
CC(=O)N/C(=C\c1ccco1)C(=O)N1CCC2(CCCN(C(=O)[C@@H](O)CCl)C2)CC1	1805526205	GNQSYVAJAYZJAL-FSEPTYSPSA-N	437.924	1.588	50	20	IDGD	
Cc1ccc(CCC(=O)N2CCCC3(CCN(C(=O)c4ccc(B(O)O)cc4)CC3)C2)cn1	1806995559	LKMCGZKZAUFPGK-UHFFFAOYSA-N	449.360	1.547	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC2(CCCN(C(=O)/C=C/c3cccnc3)C2)CC1	1807162568	QLWWHXFTSCGZCZ-SNAWJCMRSA-N	448.527	1.638	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2cnccc2F)[C@@H]1c1cccnc1	1807829755	ZOZUBLVFMBPYGF-IERDGZPVSA-N	442.495	1.308	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)CC(F)(F)C(=O)O)[C@@H]1c1cccnc1	1808295128	RODQEOLEWPQEJK-JKOKRWQUSA-N	448.264	1.981	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cc(CO)on2)[C@@H]1c1cccnc1)[C@H](F)Br	1808675443	ABHCRNIQCYHDPS-GLQYFDAESA-N	441.257	1.572	50	20	IDGD	
O=C(CC1CCOCC1)N1CCCC2(CCN(C(=O)c3cccc(B(O)O)c3)CC2)C1	1809566375	IGCRQKABKOIARC-UHFFFAOYSA-N	428.338	1.028	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)c1cn2cc(F)ccc2n1	1809848228	QSTJLRKLVSRWCN-POZUXBRTSA-N	445.882	1.788	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)[C@H](C)N2C[C@@H]3C[C@H]3C2)[C@H]1c1cccnc1	1810162864	PXMXMEPETMXLGR-VHFSTGMOSA-N	434.968	1.681	50	20	IDGD	
C#CC(=O)N1CC[C@@H](CNC(=O)c2cc([N+](=O)[O-])ccc2OC(C)=O)[C@@H]1c1cccnc1	1811358842	KUHQBBOOTWQMEW-KKSFZXQISA-N	436.424	1.868	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2cc(=O)ccn2C)[C@@H]1c1cccnc1	1811367004	QURABDPMTTYYTM-IEZWGBDMSA-N	432.908	1.354	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2cc(F)c[nH]2)[C@H]1c1cccnc1	1813072308	AHWZYVZVQIUTJY-YWZLYKJASA-N	430.484	1.241	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2nc[nH]c2[N+](=O)[O-])[C@H]1c1cccnc1)C(Cl)Cl	1813080072	MJQPWNBBGDEGHJ-JQWIXIFHSA-N	427.248	1.836	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H]2CCCS2(=O)=O)[C@@H]1c1cccnc1)C(Cl)Cl	1813081726	ZKPMCLMDUFHMKQ-BFHYXJOUSA-N	434.345	1.468	50	20	IDGD	
CCOC(CC(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)OCC	1813201429	HNJSIPCKQQYOCS-FCEWJHQRSA-N	427.929	1.476	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCN2CCN(C)CC2)n[nH]1	1817156158	MEOULNOYRZQMFP-DOTOQJQBSA-N	440.976	1.293	50	20	IDGD	
CN[C@H](CC(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCBr)[nH]n1)C(=O)O	1817362848	CFPSFXFMONAQPB-NEPJUHHUSA-N	430.303	1.250	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)/C=C\C(=O)NC3CC3)sc2C1	1819532982	YANIYELWJPVLNH-RWTFEVOBSA-N	441.351	1.673	50	20	IDGD	
COC[C@@H](NC(C)=O)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CO[Si](C)(C)C)[nH]n1	1819611084	VAPLWPAWTTWNDU-HZPDHXFCSA-N	439.589	1.404	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1)c1ccc(-n2cccn2)nc1	1819882180	RCFGARVOLLKNHJ-HZPDHXFCSA-N	443.895	1.896	50	20	IDGD	
O=C(COc1cc(Cl)ccn1)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](O)CCl)CC2	1820080519	RTJGAJNKBNRFLE-ZYHUDNBSSA-N	445.328	1.782	50	20	IDGD	
O=C(N[C@@H]1CCc2nc(NC(=O)[C@@H]3CC[C@H]4CCC(=O)N4C3)sc2C1)[C@H](O)CCl	1822621403	FHFDPIOVCSRKMO-NRWUCQMLSA-N	440.953	1.056	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3c(O)cc(O)cc3O)sc2C1	1823529546	JEHPLMVARGIJKD-WPRPVWTQSA-N	441.893	1.740	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2C[C@@H]2C2CC2)CC1	1824070641	RUSRWQMTSOMKHK-SBHAEUEKSA-N	439.560	1.965	50	20	IDGD	
CC(=O)C(C)(C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1	1824373956	WYIJYLVNJWQAEI-FQEVSTJZSA-N	428.338	1.215	50	20	IDGD	
COCCn1nccc1C(=O)N[C@H]1CCc2nc(NC(=O)[C@H](Cl)COC)sc2C1	1825999304	UPNDYEWRCZRVPI-NWDGAFQWSA-N	441.941	1.466	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCc1ccoc1)CC2	1826091777	BYDAFVDCSWDSNT-CQSZACIVSA-N	433.534	1.654	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](O)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H](F)Cl)CC1	1827615004	KCKYTRBPFSJDRS-RBSFLKMASA-N	435.924	1.984	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CNC(=O)C(F)(F)F)CC1	1831900658	TWGPFBWUBFDTAL-KBPBESRZSA-N	441.878	1.538	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ncc(F)cc3F)CCO2)C1	1831956681	HCXGGRQBSZTSCG-LJQANCHMSA-N	431.867	1.695	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3noc(C(C)C)n3)CCO2)C1	1832783553	LUICNJITNBNBRH-MGPUTAFESA-N	442.944	1.599	50	20	IDGD	
C[C@H](Oc1ccccc1)C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)CCl)CC2)CC1	1833312042	JEOQQVAPMWOVJN-OXJNMPFZSA-N	437.968	1.625	50	20	IDGD	
Cn1cccc(C(=O)NC2CCN(C3CCN(C(=O)CO[Si](C)(C)C)CC3)CC2)c1=O	1833585924	IJTKZODQOUTRID-UHFFFAOYSA-N	448.640	1.422	50	20	IDGD	
Cc1nnc(CCC(=O)NC2CCN(C3CCN(C(=O)[C@@H](F)Cl)CC3)CC2)s1	1833832530	RDYAKQHEFKFMQB-QGZVFWFLSA-N	431.965	1.885	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1)c1ccc[n+]([O-])c1	1833911538	UMDQBMQQVXGZAS-UHFFFAOYSA-N	439.354	1.290	50	20	IDGD	
CCn1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](C)CBr)C3)C2)n1	1834401523	JREMBVVZDFCARS-KSSFIOAISA-N	443.342	1.004	50	20	IDGD	
Cc1noc(N)c1C(=O)NC1CCN(C2CCN(C(=O)[C@](C)(Cl)CCl)CC2)CC1	1834701664	PVRCFNVYBHUZMC-LJQANCHMSA-N	446.379	1.987	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)COC3CCCCC3)C2)C1	1834819506	QBNGNOCYNSCOHE-LJQANCHMSA-N	447.370	1.577	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccccc3F)CCO2)C1	1835008004	KONKYFDYNZYQNX-AUUYWEPGSA-N	443.313	1.608	50	20	IDGD	
C[C@H](Nc1nccs1)C(=O)NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1835104939	ROMBVHWHLKOBBU-XJKSGUPXSA-N	444.001	1.115	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cc(C)n(C)n3)CC2)CC1	1837455002	TVDRRZAYZDNRGE-KRWDZBQOSA-N	426.945	1.595	50	20	IDGD	
N=C(N)SCC(=O)N1CCC(OC2CCN(C(=O)CCBr)CC2)CC1	1837651883	QFUQSFGUCMGEHQ-UHFFFAOYSA-N	435.388	1.397	50	20	IDGD	
O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)c1[nH]cc3c1CCC3)CCO2	1838452316	YSKBRENCRXCPGH-IBGZPJMESA-N	440.338	1.358	50	20	IDGD	
CC(C)c1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)n[nH]1	1838700237	WIJAMFDAINVDOG-ACJLOTCBSA-N	443.342	1.387	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)Cc3cnn(C)c3)CC2)CC1	1838773496	JVUJPMZDIFUPEH-CQSZACIVSA-N	441.370	1.745	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(C#N)cc3)CCO2)C1	1838953210	RQULWHCYKYWKBO-KUHUBIRLSA-N	436.306	1.412	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(F)c(C)c3N)C2)C1	1839144303	UQFRARYCLHXLKI-MGPUTAFESA-N	427.904	1.804	50	20	IDGD	
O=C(Cc1ccc([N+](=O)[O-])cc1F)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1839788366	DAKQHNMUVQNIPR-AEFFLSMTSA-N	447.822	1.267	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)C3CC4(CCC4)C3)C2)C1	1840035966	BNHGVBNEORKPSO-IFXJQAMLSA-N	429.355	1.807	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(C)cc(F)c3F)C2)C1	1840155366	ZDPQKCIRKAPZBW-YWZLYKJASA-N	446.878	1.597	50	20	IDGD	
CC(C)(C(=O)N1CCOC[C@@]2(CN(C(=O)C(Cl)Cl)CCO2)C1)c1ccccn1	1840190980	YOOAKXMCCRBRHI-LJQANCHMSA-N	430.332	1.619	50	20	IDGD	
O=C([C@H](O)CCl)N1CC2(CCCN2C(=O)c2csc(-n3ncc4ccccc43)n2)C1	1842261430	GIYCHCMMUWVENW-MRXNPFEDSA-N	445.932	1.899	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)c2cccc(N3CCCNC(=O)C3)n2)C1	1842304522	HZJXTWHVUMPUNS-MRXNPFEDSA-N	447.967	1.632	50	20	IDGD	
O=C([C@H](O)CCl)N1CC2(CCCN2C(=O)c2cc3c[nH]nc3cc2Br)C1	1844685561	YVEOSLDOGPAZOT-CQSZACIVSA-N	441.713	1.742	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@H]1C[C@H](O)CN1C(=O)OC(C)(C)C)C2	1845164739	YAVDDTRRANHLGI-ZNMIVQPWSA-N	429.945	1.578	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)[C@@H]2CCc3cccc(Cl)c32)C1	1845865361	GIMFQGHWUFISNE-GOSISDBHSA-N	438.720	1.567	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1ccc(-n2c(O)nnc2O)cc1	1847439166	IMHPFPGQKFLDKO-GJZGRUSLSA-N	433.896	1.759	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CCc1ncc[nH]1	1848098695	RAJWECXVSYREAU-KKUMJFAQSA-N	439.944	1.676	50	20	IDGD	
COc1ccc(C)cc1NC(=O)CNC(=O)COC(=O)/C(C#N)=C/c1cc(C#N)n(C)c1C	10957801	LTKIRETXAYASKC-CAOOACKPSA-N	449.467	1.727	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)COc3ccccc3F)CC2)cc1	15529297	MSXZJOMIFOONOC-UHFFFAOYSA-N	449.504	1.761	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)CN2c3cccc4cccc(c34)S2(=O)=O)cc1	15706107	TWDXNXFTMNXLJY-UHFFFAOYSA-N	436.449	1.447	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)c1ccc(S(=O)(=O)N2CCCCC2)cc1	17329888	SPZOLYSAFYFMNQ-UHFFFAOYSA-N	432.458	1.844	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)c2n[nH]c(=O)c3ccccc23)c2ccccc2c1=O	17397746	UNELLHYYJRUEDQ-UHFFFAOYSA-N	446.467	1.898	50	20	IDGD	
COc1ccc(N2C[C@@H](C(=O)NNC(=O)c3cc(-c4ccccc4)n[nH]3)CC2=O)c(OC)c1	17519045	JEGKWEKGELJAOF-HNNXBMFYSA-N	449.467	1.908	50	20	IDGD	
C[C@@H]1CC(C)(C)C[C@]2(C1)NC(=O)N(CC(=O)NNC(=O)[C@@H]1COc3ccccc3O1)C2=O	22929460	BUPOMHVJDZLSPD-DHZVRSILSA-N	444.488	1.111	50	20	IDGD	
COc1ccc(CN2C[C@H](C(=O)NNC(=O)[C@H](C)Oc3ccccc3F)CC2=O)cc1	726497528	BWHHBQGCLXTSIP-GOEBONIOSA-N	429.448	1.798	50	20	IDGD	
CC[C@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)c1csc(N2CCOCC2)n1	727722375	FSFJRJDXBZOIQL-JSGCOSHPSA-N	441.554	1.680	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(=O)n(CC(=O)NNc2ccc(F)c(F)c2F)c1	727759646	MIRQTDBIRWLKOZ-UHFFFAOYSA-N	432.424	1.439	50	20	IDGD	
Cc1ccc(CN2C[C@@H](C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)CC2=O)cc1	728847891	CVNFOMQWXNHTLM-IBGZPJMESA-N	436.516	1.198	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)c1ccc(C)cc1)C(=O)NNC(=O)Cc1cccnc1	728892270	SNGVLMQTUWWIOH-KRWDZBQOSA-N	436.559	1.180	50	20	IDGD	
Cn1c(=O)c2ccc(C(=O)NNc3ccc(Br)cc3Cl)nc2n(C)c1=O	729276497	FOKBTRJNPDIWJC-UHFFFAOYSA-N	438.669	1.805	50	20	IDGD	
C[C@@H]1CCCN(S(=O)(=O)c2cc(C(=O)NNC(=O)c3ccc4c(c3)OCO4)n(C)c2)C1	730206669	XPLSTURXYZESLU-CYBMUJFWSA-N	448.501	1.249	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)COc2ccccc2O)c1	730781544	RBBMBTGHHAFDBB-UHFFFAOYSA-N	425.438	1.058	50	20	IDGD	
O=C(COc1ccccc1O)NNS(=O)(=O)c1ccc([N+](=O)[O-])c(Br)c1	730812519	RTQRXYPWSOAXCW-UHFFFAOYSA-N	446.235	1.451	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)COc1ccccc1O)c1ccc(OCC(=O)NC2CC2)cc1	730900970	GWEIYIDESSAJII-AWEZNQCLSA-N	442.472	1.520	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)N1CCC(C(=O)c2ccc3c(c2)NC(=O)[C@@H](C)O3)CC1	732199022	DIPAMEQVMGVDBX-HUUCEWRRSA-N	444.532	1.883	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)c2ccn(S(=O)(=O)c3ccc(C)cc3)c2)cc1	732264719	VPPDMPXPNIEUFX-UHFFFAOYSA-N	442.497	1.915	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)CNC(=O)c1c(Cl)cccc1[N+](=O)[O-]	732304067	QVPXDMOLAFVZKS-UHFFFAOYSA-N	426.838	1.525	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)c2ccc(S(C)(=O)=O)o2)cc(OCC)c1OCC	733124001	NJPUEXXBSMZZDU-UHFFFAOYSA-N	440.474	1.954	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)Cc1ccc(S(=O)(=O)CC(F)(F)F)cc1	736476796	VHOCUAWMDMELSA-UHFFFAOYSA-N	444.431	1.964	50	20	IDGD	
O=C(NNc1cccnn1)c1ccc(NS(=O)(=O)c2ccc3nc(O)[nH]c3c2)cc1	736698884	WWWIWRWYXFZUSO-UHFFFAOYSA-N	425.430	1.616	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N2CCC(C(=O)NNc3ncnc4[nH]cnc34)CC2)cc1	740746264	PMPALPWFHGGSEK-UHFFFAOYSA-N	445.505	1.296	50	20	IDGD	
CN(Cc1ccc(S(C)(=O)=O)cc1)C(=O)NNC(=O)c1cnn(-c2ccccc2)c1	740914892	HNQBMPKVXCPAOB-UHFFFAOYSA-N	427.486	1.762	50	20	IDGD	
CC(C)CNC(=O)N1CCC[C@@H](CC(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)C1	741215987	PYGNAOOGROMSEP-HNNXBMFYSA-N	442.561	1.309	50	20	IDGD	
CCC(=NNC(=O)N[C@@H]1CCS(=O)(=O)C1)c1ccc(I)cc1	741810826	RLWCBXQSZKCQHO-GFCCVEGCSA-N	435.287	1.892	50	20	IDGD	
Cc1ccc(CN2C(=O)CC[C@@H]2C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1	742535146	PAMGISMWTYMUQP-GOSISDBHSA-N	429.498	1.351	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2cccc(N3C(=O)CCC3=O)c2)cc1	743829299	KUGRKYIJVHHFHQ-UHFFFAOYSA-N	430.442	1.210	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)C2(c3cccc(F)c3)CCOCC2)c1	744858393	LVJNUNXBKQZFED-UHFFFAOYSA-N	425.416	1.750	50	20	IDGD	
CC(C)(C)OC(=O)NCc1ccc(C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)o1	745633383	NLICRGNSOHSTGB-UHFFFAOYSA-N	442.428	1.794	50	20	IDGD	
COc1ccc(S(=O)(=O)NCCC(=O)NNc2cc(F)c(F)c(F)c2)cc1OC	746703873	KGMMZTKXFCHSFF-UHFFFAOYSA-N	433.408	1.933	50	20	IDGD	
COCCNS(=O)(=O)c1cccc(CNC(=O)NNc2cc(F)c(F)c(F)c2)c1	746768999	INSNXJTZVLOGTR-UHFFFAOYSA-N	432.424	1.855	50	20	IDGD	
C=CCOc1cn(-c2ccccc2)nc1C(=O)OCC(=O)NNC(=O)c1ccc(C#N)cc1	746929236	XSXYATAYCZLKOJ-UHFFFAOYSA-N	445.435	1.927	50	20	IDGD	
C[C@H](c1ccncc1)N1CCC(NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)CC1	747938331	OUNOYUBRWVHCKV-OAHLLOKOSA-N	435.492	1.227	50	20	IDGD	
Cc1cc(N2CCC(NC(=O)NNC(=O)c3cc(Br)c[nH]3)CC2)nc(C)n1	749616715	ROHYVGSNNAIUJJ-UHFFFAOYSA-N	436.314	1.797	50	20	IDGD	
CC(=O)N1CCN(c2ccc(C(=O)NNC(=O)CCc3ccccc3)cc2[N+](=O)[O-])CC1	749804256	SSPGVTXIODRPFT-UHFFFAOYSA-N	439.472	1.657	50	20	IDGD	
CCOC(=O)[C@@H]1CCCN(C(=O)CN(C)C(=O)NNC(=O)c2cc3ccccc3o2)C1	750285085	VBHJMYIJCGASQK-OAHLLOKOSA-N	430.461	1.521	50	20	IDGD	
O=C(NNC(=O)c1cn(-c2ccc(C(F)(F)F)cn2)nn1)c1ccc2c(c1)OCCO2	751076239	UAOLSPXJGJOZSS-UHFFFAOYSA-N	434.334	1.527	50	20	IDGD	
C[C@H]1CCCCN1S(=O)(=O)c1ccc(C(=O)NNC(=O)CNC(=O)c2ccco2)cc1	751206351	FLPAZDCINFNISA-AWEZNQCLSA-N	448.501	1.034	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNS(=O)(=O)c1ccc(OCC(=O)O)c(F)c1	751260255	BGEAWDQDIQZUIT-UHFFFAOYSA-N	442.421	1.076	50	20	IDGD	
C#CCOCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2OC)c1	753376440	GJCJQZNHDQXBDY-UHFFFAOYSA-N	446.485	1.090	50	20	IDGD	
COc1cc(C#N)ccc1OCC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	755002382	MYHDVLOYPKMTIN-UHFFFAOYSA-N	437.500	1.305	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)Nc2cc(S(=O)(=O)N(C)C)ccc2N(C)C)c(O)c1	755534654	VWLYOGUTAULPFZ-UHFFFAOYSA-N	435.506	1.483	50	20	IDGD	
O=C(CN1CCN(S(=O)(=O)c2ccccc2)CC1)NNC(=O)c1cccc(Cl)c1	755773661	DXPWSCNRJPIZBJ-UHFFFAOYSA-N	436.921	1.108	50	20	IDGD	
C=CCN(C)S(=O)(=O)c1ccc(NC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1	755931484	FCIHACRVSLZSCD-UHFFFAOYSA-N	433.446	1.868	50	20	IDGD	
Cc1ccc(N2N=C(Br)C[C@H]2C(=O)NNC(=O)CNC(=O)c2ccco2)cc1	756101418	YHPCRRHNJVETGN-ZDUSSCGKSA-N	448.277	1.453	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)Nc1cccc(S(=O)(=O)N2CCN(C)CC2)c1	756213120	SPFCGSWXUSBFSC-UHFFFAOYSA-N	447.517	1.098	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)NCC2CCS(=O)(=O)CC2)N(C)c2ccccc21	756365796	HTXUWIRMJQJIBS-UHFFFAOYSA-N	430.530	1.598	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)Nc1ccn(Cc2ccncc2)n1	756650820	PXYLIWIJRJROTN-UHFFFAOYSA-N	448.531	1.691	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)Nc2cnn(CCN3CCOCC3)c2)cc1	756826207	CECRTGWYAHARQG-INIZCTEOSA-N	444.492	1.038	50	20	IDGD	
COc1ccccc1N1CC[C@H](NC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])C1=O	757287251	RRWVMCQUNPCQMD-ZDUSSCGKSA-N	443.416	1.118	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)cc1	757623138	LAKZUPZDXVYSIQ-UHFFFAOYSA-N	449.489	1.993	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)Nc2ccc(C(=O)NCC(=O)N(C)C)c(Cl)c2)c(O)c1	757726186	UOBVTTDCUZXCSH-UHFFFAOYSA-N	447.879	1.639	50	20	IDGD	
COCCn1nc(C)c(NC(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)c1C	757871273	IFYUFQBUJYYTMX-UHFFFAOYSA-N	441.492	1.904	50	20	IDGD	
O=C(c1ccc2nc(C(F)F)[nH]c2c1)N1CCN(S(=O)(=O)CBr)CC1	758527979	NDLFCNOUGMBADY-UHFFFAOYSA-N	437.266	1.941	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)N[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1C#N	758780115	YCTFVPXMLCMENV-HOTGVXAUSA-N	431.493	1.717	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NC[C@@H]1CN(Cc2ccccc2)CCCO1	758958240	SYUOJJMSPXVSEQ-QGZVFWFLSA-N	445.545	1.099	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)cc1C	761793347	FWZSRMHITSXGEP-LJQANCHMSA-N	437.500	1.764	50	20	IDGD	
C[C@@H]1CN(Cc2ccccc2)C[C@@H](C)C1NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	761793711	RNHMDONQFOVZFP-IAGOWNOFSA-N	448.531	1.763	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)OCC(=O)N2CCC(C(=O)OC)CC2)c1C	763284350	OLBZBCZHKOSHLF-UNOMPAQXSA-N	431.489	1.613	50	20	IDGD	
Cc1n[nH]c(C)c1[C@@H](C)CC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	763378938	NCVCHSFNBWMAKN-ZDUSSCGKSA-N	449.533	1.002	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)Nc1cccc(CN2C(=O)CNC2=O)c1	763481243	CGYGGYWGLGQKFS-UHFFFAOYSA-N	448.480	1.196	50	20	IDGD	
O=C(NNC(=O)c1ccccc1O)C(=O)Nc1ccc(S(=O)(=O)C2CCCC2)cc1	763528464	ZKDREDOGTPLPEH-UHFFFAOYSA-N	431.470	1.508	50	20	IDGD	
CNC(=O)c1cc(Oc2ccccc2NC(=O)C(=O)NNC(=O)c2ccccc2O)ccn1	763530189	SGQKOKRZSBBLPJ-UHFFFAOYSA-N	449.423	1.339	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)C2CC2)cccc1C(=O)N1CCc2sccc2C1	763558118	NMCSTDQVVWACOR-UHFFFAOYSA-N	426.498	1.751	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)ccc1Cl	763569472	ACERJKCCQJKFKI-OAHLLOKOSA-N	433.804	1.053	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(C)c(N3CCOC3=O)c2)c1	763624338	MBWQLDHEHXWPIQ-UHFFFAOYSA-N	426.429	1.425	50	20	IDGD	
Cn1c(C2CC2)nc2cc(NC(=O)C(=O)NNC(=O)COc3ccccc3F)ccc21	763679285	LXGRNEJAUAWWBH-UHFFFAOYSA-N	425.420	1.755	50	20	IDGD	
Cc1nc(-c2ccccc2NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)no1	763686898	WYXJCIQDOTTXBT-UHFFFAOYSA-N	429.820	1.863	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(=O)n(Cc2ccccc2)c1	763713877	QGZBRUWIOKOJLO-UHFFFAOYSA-N	448.479	1.624	50	20	IDGD	
O=C(NNC(=O)C12CC3CC(CC(C3)C1)C2)C(=O)Nc1ccc(N2CCOCC2)c(F)c1	763735710	RCGFUQCGBQNSMU-UHFFFAOYSA-N	444.507	1.965	50	20	IDGD	
COC(=O)c1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)c1nnc(O)c2ccccc12	763789918	GQTFCPGIFOYISD-UHFFFAOYSA-N	443.803	1.175	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)C(=O)Nc1ccccc1OC(F)(F)F	763802677	FJFXDAXPBONURG-UHFFFAOYSA-N	442.306	1.658	50	20	IDGD	
Cc1ccc(Oc2ccc(NC(=O)C(=O)NNC(=O)COc3ccccc3C#N)cc2)nn1	763807652	DUZKIDKKXAOQIP-UHFFFAOYSA-N	446.423	1.614	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(S(=O)(=O)C(F)F)cc2)cc1	763834401	NQYYXFFOZZGTKU-UHFFFAOYSA-N	425.413	1.645	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccc(C(=O)N3CCCC[C@H]3C)cc2)n1	763892239	CIBOJZITTPLPTK-OAHLLOKOSA-N	440.504	1.301	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)C(=O)Nc1ccc(OC(F)(F)F)cc1	763945035	SCHGVNLABBTMJJ-UHFFFAOYSA-N	449.345	1.876	50	20	IDGD	
Cc1ccc(C(=O)N2C[C@H](C)C[C@@H](C)C2)cc1NC(=O)C(=O)NNC(=O)c1ccc[nH]1	763978778	FCUGDQMBSWEPIC-ZIAGYGMSSA-N	425.489	1.841	50	20	IDGD	
C#CCOc1cc(F)ccc1NC(=O)C(=O)NNC(=O)c1cc(Br)cn1C	764004576	HSKDAKNIXLTSJZ-UHFFFAOYSA-N	437.225	1.338	50	20	IDGD	
O=C(CC(F)(F)F)NNC(=O)C(=O)Nc1cccc(C(=O)N2CCc3ccccc32)c1	764115950	GRMKKKIESHFGQJ-UHFFFAOYSA-N	434.374	1.928	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cccc3ncccc23)c(OCC(=O)N(C)C)c1	764253291	OSGBRQILWKFJIT-UHFFFAOYSA-N	449.467	1.410	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)C(=O)Nc1cc(Br)ccc1-n1cccn1	764295125	JLBMQCBSLSKMQG-UHFFFAOYSA-N	432.238	1.066	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)n(-c2ccc(F)cc2)n1	764345241	DDSMYINJKNCPMU-UHFFFAOYSA-N	447.430	1.905	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)c(Cl)c1)C(=O)Nc1ccccc1CN1CCOCC1	764346019	RFFXYUHHNMIQGS-UHFFFAOYSA-N	432.864	1.278	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(S(=O)(=O)NC(C)(C)C)c2C)o1	764367032	DYYFSRYYTZWJGB-UHFFFAOYSA-N	436.490	1.373	50	20	IDGD	
CCOC(=O)c1ccn(-c2ccccc2NC(=O)C(=O)NNC(=O)c2ccc(C)o2)n1	764369545	GWSNBMBUGYZMFF-UHFFFAOYSA-N	425.401	1.350	50	20	IDGD	
CCOc1cc2c(cc1NC(=O)C(=O)NNC(=O)c1cncc(NC(C)=O)c1)O[C@H](C)C2	764432566	GFKWDMCYMOUIAE-LLVKDONJSA-N	441.444	1.162	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)c3ccc(OCC(N)=O)c(OC)c3)n[nH]2)cc1	765572332	YBIBJLLWPXKTOA-UHFFFAOYSA-N	437.456	1.587	50	20	IDGD	
Cc1ccc(Cl)c(OCC(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)c1	765735098	HSHLXDRHZMYNSW-UHFFFAOYSA-N	444.919	1.633	50	20	IDGD	
Cc1nc(S(=O)(=O)N2CCC(C(=O)NNc3ncnc4ccsc34)CC2)cn1C	766673120	IWBDGBLVIWIZRU-UHFFFAOYSA-N	435.535	1.277	50	20	IDGD	
C[C@@H](Cc1ccc(F)c(Br)c1)NC(=O)NNC(=O)C(=O)Nc1ccccn1	767127506	SCNLJTCSEHIKHC-JTQLQIEISA-N	438.257	1.883	50	20	IDGD	
O=C(COCc1ccccc1)NNS(=O)(=O)c1ccc(OC[C@H]2CCOC2)c(F)c1	767461334	UOXGFROVEHXMKB-INIZCTEOSA-N	438.477	1.767	50	20	IDGD	
COc1ccc(C(=O)NNC(=S)NCCSC)cc1S(=O)(=O)NC(C)(C)C	769769482	UQEFEVYRGZLTSR-UHFFFAOYSA-N	434.609	1.244	50	20	IDGD	
COc1ccccc1[C@@]1(C)NC(=O)N(CC(=O)NNC(=O)CCCc2ccccc2)C1=O	771255223	FSDGXOSPFGPOFI-HSZRJFAPSA-N	438.484	1.633	50	20	IDGD	
Cc1c(/C=C(\C#N)C(=O)N2CCO[C@H](CN3C(=O)c4ccccc4C3=O)C2)cc(C#N)n1C	771790420	HDBPCALQGIIGOS-OJEAVSNDSA-N	443.463	1.636	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)[C@@H]1C[C@@H]1c1ccc2c(c1)OCCO2	772194770	DJEUTTUVOHMOJU-HZPDHXFCSA-N	429.860	1.679	50	20	IDGD	
CC/C=C(\C)C(=O)N1CSC[C@H]1C(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772897717	LGXUZSOPLHZEPH-XANQCZFBSA-N	438.937	1.361	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNS(=O)(=O)c1cc(C(=O)O)cc([N+](=O)[O-])c1	773252617	VSAYBMVXSAIAQX-VIFPVBQESA-N	443.821	1.723	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cc(OC)n(C)n2)ccc1OCCC(C)C	773498710	CJXOGFAIROCUHZ-UHFFFAOYSA-N	433.465	1.262	50	20	IDGD	
COCCOc1ccc(C(F)(F)F)cc1NC(=O)C(=O)NNc1nccc(OC)n1	773723685	FAGHBMLXWBCOMH-UHFFFAOYSA-N	429.355	1.611	50	20	IDGD	
CC[C@@H]1Oc2cc([C@H](C)NCC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)ccc2NC1=O	775463339	KHRQQOFPLOKEBV-SJCJKPOMSA-N	441.444	1.816	50	20	IDGD	
CN1CC(=O)N(Cc2ccc(C(N)=O)cc2NC(=O)NNc2c(F)cccc2F)C1=O	775665899	BNKAWTHNUGXBOJ-UHFFFAOYSA-N	432.387	1.606	50	20	IDGD	
N#CCc1ccccc1CC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	776731661	YRTKCGAYBDOMBS-UHFFFAOYSA-N	426.498	1.541	50	20	IDGD	
O=C(NNC(=O)N1CCO[C@H](c2ccc(F)cc2F)C1)C1CCN(c2ncccn2)CC1	777508206	LOAZYPPTCOZWHB-SFHVURJKSA-N	446.458	1.786	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)N[C@@H]1CCCN(c2ccc(C#N)cc2)C1=O	779964079	DFUIFMZHOMOOLU-QGZVFWFLSA-N	431.456	1.654	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)NCc2ccc(OCC(=O)N(C)C)c(OC)c2)c1	780821786	UNTMPXPWMOJWGX-UHFFFAOYSA-N	430.461	1.775	50	20	IDGD	
C[C@@H]1CN(CC(C)(C)O)CCN1C(=O)NNC(=O)c1ccc(COc2ccccc2)o1	780946082	CZAZPTZFNHHDAF-MRXNPFEDSA-N	430.505	1.990	50	20	IDGD	
CCCOc1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)cc1	783262183	BPUASVSHLNNARZ-UHFFFAOYSA-N	435.506	1.639	50	20	IDGD	
CC(=O)N[C@@H](CC(C)C)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	783391105	UAAQQGWXHRSTJU-SFHVURJKSA-N	438.550	1.173	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)Nc2ccccc2C)cc1OC	783416844	CMUMEXRQGJAXMI-UHFFFAOYSA-N	449.489	1.557	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NN(C)c2ccccc2)cc(OC)c(OC)c1OC	783434395	LCXSFBAFMSMNKS-UHFFFAOYSA-N	431.445	1.995	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1ccccc1OCC(F)(F)F	784004949	MDSHHZTUECLOMA-UHFFFAOYSA-N	444.391	1.205	50	20	IDGD	
CNC(=O)c1ccc(Cl)c(NC(=O)C(=O)NNc2ccc(Br)nc2)c1	784808767	DWHVPVMUVMUQBT-UHFFFAOYSA-N	426.658	1.939	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1cc(NC(=O)C(=O)NNc2ccnc(F)c2)ccc1F	784852378	XTAZJLOBTYLGRV-UHFFFAOYSA-N	427.433	1.518	50	20	IDGD	
COCCCn1ccc(NC(=O)C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)n1	785100755	YUUUJQGFHAFEAJ-UHFFFAOYSA-N	436.419	1.172	50	20	IDGD	
CCc1ccc(NC(=O)C(=O)NNc2nc3ccccc3cc2C)cc1S(N)(=O)=O	785154921	VCLNCUCWQSRPRO-UHFFFAOYSA-N	427.486	1.835	50	20	IDGD	
Cn1c(=O)c(C(=O)COC(=O)/C(C#N)=C/c2ccccc2)c(N)n(Cc2ccccc2)c1=O	785364506	PDXWQGPBRLYMAP-LDADJPATSA-N	444.447	1.511	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)c2cnn(-c3ccc(F)cc3)n2)cc1C	786141496	ZBRBMDMDLQIHBG-UHFFFAOYSA-N	431.449	1.957	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(c2ncc(NC(=O)C(=O)NNc3ccccc3)cn2)CC1	786407994	YRBPDJXEQBHJIC-UHFFFAOYSA-N	441.492	1.616	50	20	IDGD	
CCC1(CC)Oc2ccc(NC(=O)C(=O)NNC(=O)c3cncc(NC(C)=O)c3)cc2O1	787897296	XZRNWPVPFMTFKZ-UHFFFAOYSA-N	441.444	1.727	50	20	IDGD	
C[C@]1(NNC(=O)N[C@H]2CCCN(c3ccc(Cl)cc3Cl)C2=O)CCS(=O)(=O)C1	788916924	RVVAMMYYPXUCMJ-GUYCJALGSA-N	449.360	1.870	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)Nc1ncc(C(C)(C)C)s1	789732191	RIRIJUGPAKHHAF-UHFFFAOYSA-N	428.312	1.941	50	20	IDGD	
COc1ccc([C@@H](CNC(=O)NNc2nc3ccccn3n2)N2CCOCC2)cc1OC	790110466	FZIBKXYKZKVDRF-MRXNPFEDSA-N	441.492	1.446	50	20	IDGD	
Cn1nc([C@H]2CCCOC2)cc1NC(=O)C(=O)NNC(=O)C12CC3CC(CC(C3)C1)C2	790952578	RTIOJIJWYQRSEQ-IGMNZBQBSA-N	429.521	1.616	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)N2CCC(C(=O)NNc3nc4ccccn4n3)CC2)cc1	791242621	SOVUSGXNCFDXEW-UHFFFAOYSA-N	442.501	1.476	50	20	IDGD	
N#C/C(=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)N1CC(CC(N)=O)C1	794280356	DZDQWFQJCIUZAR-NVNXTCNLSA-N	440.891	1.320	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)c2sc(N3CCOCC3)nc2-c2ccccc2)n1	799521152	ZPXXJCMJSQWAJH-UHFFFAOYSA-N	440.529	1.921	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)c1cc(F)cc2nn[nH]c12	800517079	KKAABGKFAKBNIY-UHFFFAOYSA-N	445.886	1.329	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccc(OCC(F)(F)F)c(Cl)c2)n1	800623318	LXHVLXOKHQLAQW-UHFFFAOYSA-N	447.801	1.881	50	20	IDGD	
CNC(=O)CNC(=O)c1cccc(NC(=O)C(=O)NN(c2ccccc2)c2ccccc2)c1	800626555	FVOIRBICCSWCPH-UHFFFAOYSA-N	445.479	1.970	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)NNC(=O)NCCS(=O)(=O)CCc1ccccc1	800755679	ORMZHTHMQFVKOJ-UHFFFAOYSA-N	428.514	1.698	50	20	IDGD	
Cc1c(C(=O)NNC(=O)Nc2ccccc2)cc(Br)cc1S(N)(=O)=O	801992139	ADPKYEZGHDTLSA-UHFFFAOYSA-N	427.280	1.871	50	20	IDGD	
COc1ccc(C2=NO[C@H](CNC(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)C2)cc1	802368489	UWNWGQCAXZPOKX-INIZCTEOSA-N	446.485	1.236	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)C(=O)Nc2cc(Cc3ccccn3)ccc2C)c1	802567487	PQVIOQBIYFWKFK-UHFFFAOYSA-N	446.467	1.734	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)[C@@H]2CCN(c3ccc(C#N)cc3F)C2)c1	805587843	RBVTWRIZJYXONM-QGZVFWFLSA-N	435.415	1.400	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)N=c2ccnc3n(C)[nH]cc2-3)c2ccccc2c1=O	806483012	XLBGCPODLCSAIH-UHFFFAOYSA-N	434.460	1.318	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNc2ccc(-n3ccnc3)nn2)ccc1Cl	807429812	XKOULGYQPIYRQC-UHFFFAOYSA-N	429.824	1.574	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COCc2ccccc2)nn1-c1ccc(F)cc1F	808935247	OBZCWPIKGMNIBC-UHFFFAOYSA-N	443.410	1.762	50	20	IDGD	
COC(=O)[C@@H](CF)NC(=O)/C(C#N)=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	813690748	NRTUHMFZDASUCN-WDBUWWRISA-N	447.854	1.613	50	20	IDGD	
CCc1nc(C)c(CNC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)o1	813877179	NJYXQXPRVLYQFP-UHFFFAOYSA-N	435.506	1.474	50	20	IDGD	
Cc1cc(C)nc(SCc2ccc(C(=O)NNC(=O)CCn3cnccc3=O)cc2)n1	814267452	ABOQFAJEAJXRIQ-UHFFFAOYSA-N	438.513	1.794	50	20	IDGD	
O=C(NNC(=O)N1CCc2c(nnn2-c2ccccc2)C1)c1cc(Br)c[nH]1	814272251	ZWAIECLBLCGJBZ-UHFFFAOYSA-N	430.266	1.771	50	20	IDGD	
Cc1c(CSC(C)C)cccc1NC(=O)C(=O)NNC(=O)[C@@H]1CCc2nncn2C1	815691908	FJBWAIGYCYEXMT-CQSZACIVSA-N	430.534	1.577	50	20	IDGD	
O=C(Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2CCCO2)cc1)Nc1ccccc1F	815778623	ZRIPMQRRBJODDP-QGZVFWFLSA-N	428.420	1.272	50	20	IDGD	
C[C@H](C(=O)N1CCN(S(=O)(=O)CBr)CC1)[C@@H]1OCCc2sccc21	815964991	ZBTLLKLLFPIXKB-FZMZJTMJSA-N	437.381	1.824	50	20	IDGD	
Cn1nncc1NNC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(Br)cc2)C1	816770998	UVPMNLFALRZJND-LLVKDONJSA-N	443.327	1.122	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)CCC[C@@]2(C)NC(=O)NC2=O)c1	818756678	HJXIDPPNUOVMBK-MRXNPFEDSA-N	427.255	1.447	50	20	IDGD	
CSC[C@@H](C(=O)NNC(=O)COc1ccc(C)c(C)c1)N1C(=O)[C@H]2CCCC[C@H]2C1=O	864002566	LQPPFRXMXFDSJX-KSZLIROESA-N	447.557	1.736	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2N2CCOCC2)cc1C	864002662	KVQJQIISJPFZSA-UHFFFAOYSA-N	428.445	1.888	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)c2cc(S(N)(=O)=O)ccc2F)cc1	912842662	SPNXXCSVKRYWBQ-NSHDSACASA-N	425.438	1.100	50	20	IDGD	
O=C(CN1CCN(c2ncnc3sccc23)CC1)NNC(=O)c1cccc([N+](=O)[O-])c1	913041310	KKLYKZWXCDQVGV-UHFFFAOYSA-N	441.473	1.183	50	20	IDGD	
COc1ccccc1NC(=S)NNC(=O)CNS(=O)(=O)c1ccc(C(C)=O)cc1	913441294	WJZAYEJJDCJCHR-UHFFFAOYSA-N	436.515	1.194	50	20	IDGD	
COCCNS(=O)(=O)c1cccc(C(=O)NNC(=S)NCCc2cccs2)c1	913901059	LPEHDWVWHPKBKC-UHFFFAOYSA-N	442.588	1.024	50	20	IDGD	
Cc1nc(-c2c(C)c(C)nn(C)c2=O)sc1C(=O)NNC(=O)COc1ccccc1F	915188566	YIKUCHRQNOTVNU-UHFFFAOYSA-N	445.476	1.808	50	20	IDGD	
COc1ccnc(NNC(=O)NC[C@H](c2ccc(OC)c(OC)c2)N2CCOCC2)n1	915895383	MSZNNIPRRWXRNS-OAHLLOKOSA-N	432.481	1.202	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2ccccc2Cn2cccn2)c1	916228046	UWWPPDWEBUQBIY-UHFFFAOYSA-N	427.486	1.479	50	20	IDGD	
O=C(NN=Cc1ccccc1OCC(=O)N1CCCC1)c1csc(N2CCOCC2)n1	916338833	WJKKTAPDRRRRTK-UHFFFAOYSA-N	443.529	1.745	50	20	IDGD	
O=C(NCc1ccnc(OCC(F)(F)F)c1)NNC(=O)c1nnc(O)c2ccccc12	916396727	FPPWVQNKLTYOJX-UHFFFAOYSA-N	436.350	1.816	50	20	IDGD	
CCOC(=O)N[C@H](CNC(=O)NNC(=O)c1nn(-c2ccccc2)cc1O)CC(C)C	916632625	YDCLSWXSAJUBON-AWEZNQCLSA-N	432.481	1.683	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCc2cccc(C(=O)NC3CC3)c2)cc(OC)c1OC	916648406	GUPWNDUWKDDCQU-UHFFFAOYSA-N	442.472	1.749	50	20	IDGD	
Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCC(C(=O)NNC(=O)C(C)(C)C)CC1	917180200	ORDPWZQSIHCFAF-UHFFFAOYSA-N	426.495	1.497	50	20	IDGD	
O=C(CC/N=C1/NS(=O)(=O)c2ccccc21)NNC(=O)Cc1ccc2ccccc2c1	917195272	ASQSFUNFIILTBG-UHFFFAOYSA-N	436.493	1.659	50	20	IDGD	
Cc1nc2ccnn2c(C)c1CCC(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	919482746	FJHMIULMNSNEAA-UHFFFAOYSA-N	440.416	1.191	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2sc(N(C)C)nc2C)c1	1319660573	ALRVOLHHBQYZSO-UHFFFAOYSA-N	439.563	1.623	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc2c3c(c1)CC(=O)N3CCC2)c1cncn1-c1ccccc1	1320368951	FHAVAONQXZVJOK-UHFFFAOYSA-N	437.481	1.331	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCc2ccc(Br)o2)nc1	1320551164	KVGGYFOIYVGIGR-UHFFFAOYSA-N	432.300	1.950	50	20	IDGD	
CN(C1CC1)S(=O)(=O)c1ccc(NC(=O)NNC(=O)c2n[nH]c3c2CCCC3)cc1	1321023472	NBQLZYGUVZCFPS-UHFFFAOYSA-N	432.506	1.538	50	20	IDGD	
CNS(=O)(=O)c1ccc(Br)c(C(=O)NNc2nc3ccccn3n2)c1	1326267624	LSDJOMHACMTNPS-UHFFFAOYSA-N	425.268	1.157	50	20	IDGD	
O=C(NNC(=O)c1nc2ncc(Br)cn2n1)c1ccc(Br)cc1	1337754375	PTIQFCIKRXGZIH-UHFFFAOYSA-N	440.055	1.724	50	20	IDGD	
COc1cc(CNC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc(Cl)c1OC	1342685601	LFNIALDGRCKKQW-UHFFFAOYSA-N	431.840	1.477	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)COc1ccc(OCc2ccccc2)cc1)c1nnnn1C	1346640333	OYPYCECLNYCMAS-AWEZNQCLSA-N	425.449	1.260	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](N)Cc2cscn2)C1	1777965917	PMULFGAPSSSYNP-RZQQEMMASA-N	443.013	1.792	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)CSCc3[nH]cnc3C)C2)C1	1778914127	XNRZZZSUKKAGCW-KDOFPFPSSA-N	430.958	1.035	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccnc(Cl)n2)C1	1779681533	FLIMSVVWNARLPK-RVZJWNSFSA-N	431.320	1.511	50	20	IDGD	
COc1nc(C)ccc1C(=O)N1CC[C@@]2(CN(C(=O)CCBr)CCO2)C1	1779738274	PXTYRHACLGAZFD-GOSISDBHSA-N	426.311	1.627	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(N(C)C)nc3)C2)C1	1779759510	CBVSLNFXTNWSTD-IFXJQAMLSA-N	439.354	1.622	50	20	IDGD	
Cn1ccc2c(O)ncc(C(=O)N3CC[C@]4(C3)CN(C(=O)C(C)(C)CCl)CCO4)c21	1779979497	XBXQRDRNHMSPIP-NRFANRHFSA-N	434.924	1.987	50	20	IDGD	
COc1ccnc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)c1OC	1780452701	KNVIQEZKAIHJEI-RBUKOAKNSA-N	446.331	1.779	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CN1C(=O)CSC1=S)C2	1780705508	BBWQNDYHLQCTAQ-VEVIJQCQSA-N	448.010	1.378	50	20	IDGD	
COc1nccnc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@](C)(Cl)CCl)C1	1780710120	IRTMBDZWHAXPRP-UPRAQXHNSA-N	445.347	1.849	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)Cc3ccc(OC)cc3C#N)C2)C1	1781176318	IVDBRHUVUBADDH-NQIIRXRSSA-N	435.908	1.193	50	20	IDGD	
COc1ccc(C2(C(=O)N3CC[C@@]4(CN(C(=O)[C@@H](O)CCl)CCO4)C3)CCC2)cc1	1781204192	HBKWJUAAHLISFQ-GHTZIAJQSA-N	436.936	1.547	50	20	IDGD	
Cc1ccc(CCC(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)nc1	1781325731	IDZQNKYMIFYQEO-AEFFLSMTSA-N	428.302	1.843	50	20	IDGD	
O=C(c1ccc2nccn2c1)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781330172	SANOBCBEJJCIIW-WMLDXEAASA-N	425.258	1.468	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(=O)cco1)C2	1781996486	LWJCBGXUWMMVAG-CDHAZOANSA-N	427.295	1.551	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)n1cc(C)cn1)C2	1782178525	NUHWHQIVEMFHLX-WOCWXWTJSA-N	426.945	1.520	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cccc4ccnn34)C2)C1	1782228833	WYWRVFWLWMCWQJ-HNAYVOBHSA-N	435.322	1.951	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@@]2(CN(C(=O)Cc3cc[nH]n3)CCO2)C1	1782867350	RPQQQWZAVAIABH-KYIYGJGQSA-N	441.438	1.667	50	20	IDGD	
C[C@@H](CC(=O)N1CC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1)Oc1ccccc1	1782879609	FAUFQRCIRAQJEU-FDDCHVKYSA-N	446.548	1.047	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(CCN(C(=O)C3(F)CC3)C2)C1	1782911017	ZRUIOVXMZYNAEQ-IBGZPJMESA-N	435.408	1.466	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)Cc3ccc([N+](=O)[O-])cc3F)C2)C1	1782973856	LCTKQTNBIADWNM-HNAYVOBHSA-N	443.859	1.360	50	20	IDGD	
O=C1CCc2ccc(C(=O)N3CCO[C@@]4(CCN(C(=O)C(Cl)Cl)C4)C3)nc2N1	1783945315	GMDQRJLSPCGLPF-GOSISDBHSA-N	427.288	1.214	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCC(=O)N3CCCC3)C[C@@H]21	1784616455	WFWGTEPGCZSJLN-XSLAGTTESA-N	427.973	1.776	50	20	IDGD	
O=C(Cc1cc(F)ccc1[N+](=O)[O-])N1CC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1785530805	CPQBSYCKUDCSPI-QGZVFWFLSA-N	434.251	1.910	50	20	IDGD	
CCc1[nH]nc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCBr)[C@H]3C2)c1F	1786404567	YWHHOWMSCBYSMF-GVXVVHGQSA-N	431.306	1.490	50	20	IDGD	
NC[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)c1ccccc1	1786920529	XJSUBHZOUNPXEN-MHORFTMASA-N	438.366	1.494	50	20	IDGD	
O=C(CC[C@@H]1CCOC1)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1	1788149416	PEAPXSFWBXLZGK-QGZVFWFLSA-N	436.317	1.931	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C/N=C/c3ccco3)[C@H]2C1	1788680943	AKRLPQCCJCBPKO-RYWIAXKTSA-N	440.338	1.852	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(C(=O)O)ncn3)C[C@@H]21	1789868939	TZUFLDIJAZUHFE-KSSIRIBKSA-N	445.303	1.004	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)Cc3ccccc3)C[C@@H]21	1789871836	KWQHBUWMCGPGIH-HUTLKBDOSA-N	443.371	1.806	50	20	IDGD	
COc1ncccc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]2C1	1789922606	PVTIVDWGTNSQIM-PYJNHQTQSA-N	430.274	1.374	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccnc(C)n3)C[C@@H]21	1790961665	NTNPJGVDBYUYEF-YXWQFLTLSA-N	425.327	1.552	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1Cc3ccccc3O1)C2	1792870259	AQSCNMTYHPNETM-UIVXMWCNSA-N	437.334	1.611	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCl)[C@@H]1CN(Cc2ccccc2)CCO1	1793111297	BOELJCDAHSMPJU-WPVAHCMFSA-N	435.952	1.125	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(S(C)(=O)=O)c1)C2	1793444967	NCMNMIZJQCQCCX-CYGHRXIMSA-N	442.965	1.701	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1cn2nc(C)sc2n1	1793905573	ZOCJHTKKHNGLLL-ATGSNQNLSA-N	425.942	1.534	50	20	IDGD	
COc1ncc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCBr)cc1C	1795112425	HKGAWQHRAOWTTL-MIFYACCESA-N	426.311	1.387	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CNc2ccccc21	1795620406	NFENZTOWMKWTKR-BEHLRCOKSA-N	436.350	1.816	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2sccn2c1	1796115670	OMRITMZWSUPGAJ-IKVITTDRSA-N	426.336	1.987	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2ccoc2s1	1796118938	LPDNKPZBNLZLMS-ZSBFGKGUSA-N	434.518	1.071	50	20	IDGD	
CC(C)(C)c1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)ccn1	1796190752	HQAJQLKBPNSIEY-ACDBMABISA-N	435.333	1.625	50	20	IDGD	
Cc1cc2nnc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)C(C)(C)CCl)C4)c(C)n2n1	1796923460	DVFJFXJASZORSJ-XOIINTDNSA-N	434.928	1.209	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(C)nc2ccc(O)cc12	1797356674	WRFIZXQURAIWFH-ZZXMYQEDSA-N	447.919	1.706	50	20	IDGD	
C[C@@H]1CCc2c(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)c3cnccc3C(=O)NN)C4)n[nH]c21	1797492453	GZPWHPMVVUXHMJ-YIYPIFLZSA-N	437.504	1.024	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)Nc1ccccn1	1797976385	MLPACWIUUKFCON-JBXGNFEISA-N	439.354	1.645	50	20	IDGD	
COc1ccc(F)c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)c1	1798443682	VMLWRXSFLZZBPS-BTTYYORXSA-N	441.463	1.398	50	20	IDGD	
COc1cc(C#N)cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Br)C3)c1	1798578912	MVNFWXUYRTYDNT-OCVGTWLNSA-N	440.269	1.461	50	20	IDGD	
COc1nc(C)ccc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@](C)(Cl)CCl	1799276822	LYOBBKJPOQCBSH-QPWUGHHJSA-N	430.332	1.838	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1COc3ccccc3O1)C2)[C@H](F)Br	1799344787	VROOMSMWYYPBDW-MOEWQIFZSA-N	443.269	1.107	50	20	IDGD	
COc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)C(C)(C)CCl)C3)c(O)c1OC	1799663401	WIMOYXQBBNLBHP-YWVIFJGQSA-N	440.924	1.878	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CCc3nc[nH]c3C1)C2	1800644443	UIUDTNHZBIJLMP-GODIYZJISA-N	439.354	1.278	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)NC(=O)OC(C)(C)C)C2	1800754021	CMNLZTMAYYJMHW-YHQUGGNUSA-N	448.358	1.273	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnccc1N(C)C)C2	1800757754	KBCBGVIUMXFPSE-JFILPPLUSA-N	425.327	1.134	50	20	IDGD	
COc1cc(F)ccc1CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)Br	1800764113	VKXVBXUDFVVOJM-GNTLTTKYSA-N	443.313	1.750	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1cccc([N+](=O)[O-])c1)C2	1800970801	KAYXWCMSFKVVQT-LORHWOILSA-N	439.896	1.371	50	20	IDGD	
C[C@H](NC=O)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](Br)Cc1ccccc1	1801570299	IEECOAQXPLEUAW-XEIOYGOASA-N	436.350	1.765	50	20	IDGD	
COc1cc(C(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]2c2cccnc2)ccc1O	1803142371	YZAZRDCFRRYSPZ-SZVBFZGTSA-N	433.892	1.715	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cnc3[nH]ncc3c2)[C@H]1c1cccnc1)[C@@H](O)CCl	1803143121	UTBVDCOWBLXWBY-JQFCIGGWSA-N	428.880	1.272	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)n1	1804826302	VKPVIDDPWFMUAJ-VDZJLULYSA-N	445.907	1.354	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC2(CCCN(C(=O)c3cccc(=O)n3O)C2)CC1	1807558095	KIVZKUMMWWLRIU-CYBMUJFWSA-N	426.311	1.714	50	20	IDGD	
CC(C)=CCCC(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1807972343	GQCDSIALNRXMRW-OFNKIYASSA-N	435.333	1.827	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H](CNC(=O)[C@H](F)Cl)[C@H]1c1cccnc1)[C@@H]1SC(=N)NC1=O	1808313557	ZWEIQGZARGRXRO-OMRNGCIESA-N	441.916	1.424	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H](CNC(=O)[C@@H](F)Cl)[C@H]1c1cccnc1)N1CCN(C)CC1	1808316247	WWGWHPPDBHXFIH-VDHUWJSZSA-N	425.936	1.258	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)Cn2cncn2)[C@H]1c1cccnc1)[C@@H](F)Br	1808662161	WYPJOWCHNPOPNQ-AEGPPILISA-N	425.262	1.070	50	20	IDGD	
Cc1cccc(F)c1C(=O)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1	1809972761	PUKJGLWFJBONCK-UHFFFAOYSA-N	438.308	1.973	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1CCN(C(=O)c2nc[nH]c2[N+](=O)[O-])[C@H]1c1cccnc1	1810539936	ADSXWTLJSOQRBM-YOEHRIQHSA-N	446.540	1.884	50	20	IDGD	
COC(=O)c1ccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)[C@H](O)CCl)n[nH]2)cn1	1814870891	DTOFZZNHXVTBLK-LSDHHAIUSA-N	435.868	1.497	50	20	IDGD	
CCCNC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1	1815114149	TVTFCFVQFLJIGB-MRXNPFEDSA-N	449.556	1.081	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CC[C@@H](N)C(N)=O)n[nH]1	1817351250	ALWPTLADLFBGJS-NQBHXWOUSA-N	443.346	1.026	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnc(O)nc1O)CC2	1822863559	OBUYICLSZBAPBL-HYORBCNSSA-N	446.316	1.806	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnn4c3OCCC4)sc2C1	1824001936	ZXBXENIODZEEFJ-PWSUYJOCSA-N	439.925	1.602	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)CCc2ccco2)CC1	1825247067	XOXIANLDMWBMDH-QFIPXVFZSA-N	438.333	1.826	50	20	IDGD	
CCn1ccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)n1	1826091520	GFCSGAOOCIUNLG-NRFANRHFSA-N	438.337	1.130	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)CN2CCCCC2)CC1	1826704326	NCUYCELDTPROQQ-HXUWFJFHSA-N	435.613	1.465	50	20	IDGD	
CCc1ccnc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)c1	1827356059	BCPCYHJUWZMPBM-HSZRJFAPSA-N	449.360	1.871	50	20	IDGD	
CC(=O)C(C)(C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1	1828923383	HNIKBHAHCGROIH-IBGZPJMESA-N	443.548	1.534	50	20	IDGD	
COc1c(Cl)cccc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1830738127	MAHBWCBRXMDNOC-KXBFYZLASA-N	447.315	1.018	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3ccc(CO)c(F)c3)CC2)CC1)[C@@H](O)CCl	1833313592	LKFMDIJDMOUDBS-IBGZPJMESA-N	441.931	1.103	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3ccn(C)n3)CC2)CC1	1834218679	HKDYXHQBNKTRMS-CYBMUJFWSA-N	426.359	1.389	50	20	IDGD	
O=C(CCBr)NC1CCN(C2CCN(C(=O)c3ccc(CO)o3)CC2)CC1	1834423421	URVABBHCGUAHLA-UHFFFAOYSA-N	442.354	1.742	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cncs3)CCO2)C1	1834470221	DLEIGODEEIXAOW-WBMJQRKESA-N	432.340	1.387	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnc(N)s3)CCO2)C1	1835846206	BAJIBYNHNLFOEN-HZPDHXFCSA-N	437.349	1.032	50	20	IDGD	
Cc1nn(C)c(C)c1CC(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836720049	HNWJPPQXKBIXPG-IBGZPJMESA-N	440.972	1.178	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cccnc3Cl)C2)C1	1837708863	QOLNBDIVWJTUPJ-LJQANCHMSA-N	441.988	1.657	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc4nccn34)C2)C1	1837715633	BJQYEGZDDBBFPO-NRFANRHFSA-N	446.580	1.256	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)C(=O)NCC(C)C)CC2)CC1	1838108344	MUHFNHCAMUBIGC-QGZVFWFLSA-N	431.961	1.011	50	20	IDGD	
CC(C)c1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)n[nH]1	1838697377	MOXZFRXVFIPMKI-HXUWFJFHSA-N	438.601	1.455	50	20	IDGD	
Cc1nc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)cs1	1839197938	NICBICRHMRSILJ-SWLSCSKDSA-N	436.303	1.212	50	20	IDGD	
COC1(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)CCC1	1839203531	NVXYEGYOZWRXAM-PBHICJAKSA-N	437.306	1.093	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc4nccn34)CCO2)C1	1839549901	VIGQZFNRZNAGGI-IERDGZPVSA-N	434.924	1.812	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4cc[nH]c4c3)C2)C1	1840152382	GWQDOZUVQLJYOF-UWJYYQICSA-N	435.908	1.492	50	20	IDGD	
CCC[C@H](C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](Cl)COC)CCO2)C1)n1cccc1	1840152484	JMXGROVJJWTFMV-OPYAIIAOSA-N	441.956	1.540	50	20	IDGD	
O=C(c1snnc1C1CC1)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840187497	FNROGRPMNHFHOH-INIZCTEOSA-N	435.333	1.289	50	20	IDGD	
CN1CCc2cc(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)C(Cl)Cl)CCO4)ccc21	1840188364	FYYWGUOMNQIQFH-HXUWFJFHSA-N	442.343	1.553	50	20	IDGD	
Cc1cc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@](C)(Cl)CCl)C3)C2)no1	1840369099	BAYUQBOAAPJSQI-MSOLQXFVSA-N	434.320	1.218	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](CCC)NC(C)=O)CCO2	1840851244	KZYSHIVSTAVFLK-SQGPQFPESA-N	431.961	1.155	50	20	IDGD	
COc1ccc(CC(=O)N2CCCC23CN(C(=O)c2ccc(B(O)O)cc2)C3)c(Cl)c1	1841911993	UACFXQCZVVEYSN-UHFFFAOYSA-N	442.708	1.088	50	20	IDGD	
Cc1cc(CC(=O)N2CC3(CCCN3C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)n[nH]1	1841924568	AWLDYPDXQQUJSY-HNNXBMFYSA-N	439.944	1.596	50	20	IDGD	
O=C(CSc1ccc(F)cc1F)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843010320	COUHIMDGGDIKOB-UHFFFAOYSA-N	446.284	1.254	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@H]2C[C@H](O)CN2C(=O)OC(C)(C)C)C1	1843104189	XYLJBJKWUSDLEX-JYJNAYRXSA-N	443.972	1.968	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC2(CCCN2C(=O)c2cccc(N3CCOCC3)n2)C1	1843528132	CONMCABNYQAOLI-IBGZPJMESA-N	441.359	1.972	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@]1(NC(=O)OC(C)(C)C)CCOC1)C2	1845166369	QSFLNPYJMOPSAO-JLTOFOAXSA-N	429.945	1.891	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@H]1CN(C(=O)OC(C)(C)C)CCO1)C2	1845168628	QEQREPJFAJWVTE-HUUCEWRRSA-N	429.945	1.843	50	20	IDGD	
CC(C)(C)OC(=O)N1CC2(C[C@@H]2C(=O)N2CCCC23CN(C(=O)[C@H](O)CCl)C3)C1	1846115877	NSXOOXWLZDOJCW-ZIAGYGMSSA-N	427.929	1.047	50	20	IDGD	
C[C@H](Br)C(=O)N1CC2(CCCN2C(=O)[C@H]2C[C@@]23C(=O)Nc2ccccc23)C1	1846153997	RLRPVMXRGPTDCB-HKMRUAMVSA-N	432.318	1.883	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@H]1CCCN1C(=O)OC(C)(C)C)C2	1846364980	UECXUPGSQYHASX-CABCVRRESA-N	429.945	1.843	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1nc(Cl)ccc1F	1848284143	FWPMYLGSFSRZIT-IBSSICKUSA-N	446.870	1.824	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCCCc1nc2ccccc2[nH]1	9756366	KHHUHVYJCSZLLM-UHFFFAOYSA-N	443.533	1.741	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)cc(Cl)c1OCC(N)=O	10402373	AXFQDDQRQFAGHH-SNVBAGLBSA-N	439.827	1.580	50	20	IDGD	
COc1ccc(-c2noc(CCC(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)n2)cc1	14044473	BRXMAGQWGZNSSC-UHFFFAOYSA-N	448.439	1.386	50	20	IDGD	
Cn1cnnc1SCC(=O)Nc1cccc(C(=O)NNC(=O)Cc2ccc(F)cc2)c1	14393077	PQHMFHKQXDUHAK-UHFFFAOYSA-N	442.476	1.689	50	20	IDGD	
O=C(COC(=O)CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)NNC(=O)c1ccccc1	19430579	DAEWUFGXKHLKNH-UHFFFAOYSA-N	442.384	1.287	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)CCc1nnc(-c2ccccc2)o1	21967365	KRUXQBQKIMWVIL-UHFFFAOYSA-N	442.501	1.732	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=O)c2c(C)nc3ccccn23)ccc1F	28698315	RLFJRNZILXCBEH-UHFFFAOYSA-N	447.492	1.887	50	20	IDGD	
O=C(NNc1nc(-c2ccncc2)no1)[C@H]1CCCN(S(=O)(=O)c2ccc(F)cc2)C1	110375180	PVXRKRKSHKOFKQ-AWEZNQCLSA-N	446.464	1.815	50	20	IDGD	
Cc1ccc(CN2C[C@H](C(=O)NNc3ccc(S(=O)(=O)NC4CC4)cc3)CC2=O)cc1	110884058	ZZUAKIOFHYGHNP-QGZVFWFLSA-N	442.541	1.928	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)N1CCCN(C(=O)c2cccc(Cl)c2)CC1	725870783	RVGKJDKRJHPNHD-UHFFFAOYSA-N	447.879	1.252	50	20	IDGD	
CN(Cc1ccccc1N1CCOCC1)C(=O)NNC(=O)CNC(=O)c1cccs1	725873318	WQBARCMMAQXUFQ-UHFFFAOYSA-N	431.518	1.187	50	20	IDGD	
C[C@H](NC(=O)NN[C@]1(C)CCS(=O)(=O)C1)c1cc(F)ccc1N1CCN(C)CC1	726280898	ZETXOSSJALRBMM-IFXJQAMLSA-N	427.546	1.020	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc2[nH]c(=O)c(=O)[nH]c2c1)c1c(Cl)cccc1Cl	727796074	FELDOUVGVDKPAG-UHFFFAOYSA-N	429.241	1.147	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)NNC(=O)c1c(Cl)cccc1Cl	727843478	LZTJDYYKNFYVCL-UHFFFAOYSA-N	435.231	1.258	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)COc3ccc4c(c3)CCC4)cc2)CC1	728213342	YNCRPPRZXGPQCR-UHFFFAOYSA-N	444.557	1.634	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)[C@H]2CCCN2c2ncnc3sccc23)nc2ccccc21	728511350	KFFZTGQAZFBFMY-MRXNPFEDSA-N	435.513	1.937	50	20	IDGD	
CN(C)c1ccc(NC(=S)NNC(=O)c2ccc(F)c(S(=O)(=O)N(C)C)c2)cc1	729688855	FIXISXJPCFEBFI-UHFFFAOYSA-N	439.538	1.773	50	20	IDGD	
CCS(=O)(=O)N[C@H](CCSC)C(=O)NNC(=O)c1ccc(Cl)cc1Cl	730517839	VKKLHWHYMNWQCV-GFCCVEGCSA-N	428.363	1.815	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)N1CCN(c2oc(-c3ccco3)nc2C#N)CC1	731499806	HWSVKZVMYZNTSW-UHFFFAOYSA-N	436.428	1.991	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)Cc2csc(NC(=O)c3ccco3)n2)cc1	731987792	SECMFAUIHPDJKT-UHFFFAOYSA-N	427.442	1.625	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc2c(c1)nc(CCC(=O)NNC(=O)C1CCC1)n2CC	732141131	ILKLFBBOFONVRO-UHFFFAOYSA-N	449.577	1.967	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CNC(=O)Cc2cccc(F)c2)cc1Br	732175054	GXLFLXVYDWUKBJ-UHFFFAOYSA-N	438.253	1.717	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)[C@H]2CC(=O)N(c3cccc4ccccc34)C2)C[C@@H](C)O1	732259430	DLQROHBCTHQMMX-SCTDSRPQSA-N	438.528	1.839	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)CCCN2CCN(c3ccccc3)CC2)cc1	732264746	WHSFGWGURWMEAM-UHFFFAOYSA-N	425.533	1.857	50	20	IDGD	
Cn1c(=O)c2cc(C(=O)NNc3nc(-c4ccc(Cl)cc4)no3)n(C)c2n(C)c1=O	732976388	QLFBMNXNSTWPHP-UHFFFAOYSA-N	429.824	1.036	50	20	IDGD	
C[C@H](NS(=O)(=O)c1ccc(Cl)cc1)C(=O)NNC(=O)c1cnn(-c2ccccc2)c1	733170206	SNGBIGXNZGRKBM-ZDUSSCGKSA-N	447.904	1.654	50	20	IDGD	
Cc1ccc(C(=O)N[C@@H](C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)C(C)C)cc1	734239874	YHOCPRKWHGWJRQ-MRXNPFEDSA-N	435.525	1.605	50	20	IDGD	
COCCCNC(=O)NNC(=O)[C@H]1CCC(=O)N(C)[C@H]1c1ccc(C(F)(F)F)cc1	734427106	AQXRWAMBSWETDC-HOCLYGCPSA-N	430.427	1.982	50	20	IDGD	
CN(C)[C@H](CNC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)c1c(F)cccc1F	734675210	HSFKOHJRRJMMRO-MRXNPFEDSA-N	430.419	1.187	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)CC(=O)NNC(=O)COc2cc(C)cc(C)c2)cc1F	734808862	HDPBOLQFQFONPS-UHFFFAOYSA-N	436.461	1.645	50	20	IDGD	
Cc1ccc(CCNC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)cc1	734947003	QPEAOUQKVNGJQV-UHFFFAOYSA-N	432.550	1.195	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)N[C@H]3CSc4ccccc43)nc2)CC1	735586488	MARVRWMUOLAGMS-INIZCTEOSA-N	448.574	1.491	50	20	IDGD	
CS(=O)(=O)[C@H]1CCC[C@H](NC(=O)NNC(=O)c2cc(F)ccc2Br)C1	741093367	QDTVDNQNOKNGTR-QWRGUYRKSA-N	436.303	1.888	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)[C@@H]1CCCN(C(=O)N2CCc3sccc3C2)C1	741559088	PEHXSMDEQBEJEM-QGZVFWFLSA-N	427.530	1.723	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)c3nnn(C)c3C)c2)cc1	741658719	DAFCFQZQZQRBCZ-UHFFFAOYSA-N	444.473	1.008	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN2CCN(Cc3cccc(F)c3)C(=O)C2)cc1C	741799690	ORFHXKNNUURFQU-UHFFFAOYSA-N	432.521	1.863	50	20	IDGD	
Cn1nnnc1-c1cccc(S(=O)(=O)NNC(=O)c2c(Cl)cccc2Cl)c1	742029203	FTOWIZTUAOCXGM-UHFFFAOYSA-N	427.273	1.807	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Cc2nc3ccccc3n2C)cc(NC(C)=O)c1OC	742473920	JZQMXWFFBCVJIQ-UHFFFAOYSA-N	425.445	1.553	50	20	IDGD	
COc1ccccc1O[C@@H](C)CNC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	743691484	LILCSVGWOSSKNQ-ZDUSSCGKSA-N	436.490	1.902	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2ccc(OC)c(Br)c2)cn1C	745979174	IMJAGEBCYOUVMX-UHFFFAOYSA-N	446.279	1.206	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1ccc(C(=O)NNC(=O)N2CCOCC2)cc1	745992474	BDEFIJDSSBIPCQ-UHFFFAOYSA-N	434.474	1.183	50	20	IDGD	
CN(C)C(=O)CCCC(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	746094962	IHXBPUMTWVMCNS-UHFFFAOYSA-N	435.484	1.464	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)c2ccc(CN3C(=O)CNC3=O)cc2)o1	746391793	HGDOVVQPUFLRLD-UHFFFAOYSA-N	427.461	1.248	50	20	IDGD	
C[C@H]1OC(C)(C)N(C(=O)OC(C)(C)C)[C@@H]1C(=O)NNC(=O)Cc1cn2ccccc2n1	746637363	MJDHDTGHOCNIEF-DYVFJYSZSA-N	431.493	1.785	50	20	IDGD	
C=CCOc1cn(-c2ccccc2)nc1C(=O)OCC(=O)NNC(=O)c1cccc(C#N)c1	746928000	GAUGRXUDRZXGRE-UHFFFAOYSA-N	445.435	1.927	50	20	IDGD	
CSC[C@@H](C(=O)NNC(=O)c1cccc2cccnc12)N1C(=O)[C@H]2CCCC[C@H]2C1=O	747427146	CJFVNHCFVULMOM-UXLLHSPISA-N	440.525	1.903	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)c2cc(N3CCNC3=O)ccc2Cl)cc1	747718000	UUSZCCKMPMUMAF-UHFFFAOYSA-N	441.831	1.359	50	20	IDGD	
C[C@H](OC[C@H]1CCCO1)C(=O)NNc1ccc(S(=O)(=O)Nc2nccs2)cc1	747943493	ZEPIWVBHKADJAV-GXTWGEPZSA-N	426.520	1.971	50	20	IDGD	
O=C(NN=Cc1ccccc1OCc1cn2ccccc2n1)N[C@@H]1CCS(=O)(=O)C1	748586208	ROISDCZDGZICED-MRXNPFEDSA-N	427.486	1.734	50	20	IDGD	
COc1ccc([C@@]2(C)NC(=O)N(CC(=O)NNc3cccc([N+](=O)[O-])c3C)C2=O)cc1	748686755	WOSRHGPQZYVRHI-HXUWFJFHSA-N	427.417	1.822	50	20	IDGD	
Cc1ccsc1[C@@H]1C[C@@H]1C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	749239464	FKNPMCHDANKMLW-CABCVRRESA-N	435.575	1.634	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)CNC(=O)c2cc(-c3ccccc3)on2)cc1OC	749403793	NLRDIDSTLQJPNX-UHFFFAOYSA-N	438.440	1.940	50	20	IDGD	
Cc1cc(N2CCC(NC(=O)NNC(=O)[C@H](C)Oc3ccccc3F)CC2)nc(C)n1	749617387	KKNATYRJVMBJSJ-AWEZNQCLSA-N	430.484	1.999	50	20	IDGD	
C[C@H]1C(=O)Nc2cc(C(=O)NNC(=O)Nc3ccc(S(C)(=O)=O)cc3)ccc2N1C	750305640	LQUZGUXXYWORSV-NSHDSACASA-N	431.474	1.333	50	20	IDGD	
CC[C@H](Oc1cccc(C)c1)C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	750405443	GBAUKCVURLLYJN-LPHOPBHVSA-N	428.441	1.683	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)c1nc(C2CC2)n(-c2ccccc2Cl)n1	751198360	CCPNZASNXRMVKD-UHFFFAOYSA-N	428.836	1.582	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)c2cccc(CN3CCS(=O)(=O)CC3)c2)c1	751290369	JZFQFWMMNKNJIA-UHFFFAOYSA-N	445.541	1.374	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3ccc(N(C)C)cc3F)CC2)cc1	752128174	XQEIMQPTQLWFHZ-UHFFFAOYSA-N	427.524	1.779	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@H](C)C(=O)NNC(=O)CN1C(=O)N[C@@](C)(C2CC2)C1=O	754822162	BGAGPGBZMJJSOP-ODXCJYRJSA-N	436.896	1.592	50	20	IDGD	
Cn1nnc2cc(C(=O)NNC(=O)COc3ccc(-c4ccc(C#N)cc4)cc3)cnc21	754848278	XSVSNVRJKMOWKI-UHFFFAOYSA-N	427.424	1.742	50	20	IDGD	
C[C@@H](CS(=O)(=O)c1ccc(F)cc1)C(=O)NNC(=O)Cc1nc2ccccc2n1C	755047237	YBKPZHUQKAHEKE-ZDUSSCGKSA-N	432.477	1.512	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNS(=O)(=O)c1cc(F)cc(Cl)c1	755407860	QKGKMDLHKSBJCQ-UHFFFAOYSA-N	434.902	1.704	50	20	IDGD	
Cc1nn(C)c(N2CCOCC2)c1C=NNC(=O)COc1ccc(Br)cc1	755511474	RVZJFAWHUWBENS-UHFFFAOYSA-N	436.310	1.857	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)NCCN2C(=O)[C@@H]3[C@@H](C2=O)[C@H]2C=C[C@H]3C2)cc1	756096089	ONEYHCYAFYVLIQ-USJZOSNVSA-N	428.514	1.225	50	20	IDGD	
NC(=O)CCNC(=O)c1cccc(NC(=O)NNC(=O)CSc2ccc(Cl)cc2)c1	756388939	AARQJFKICZTBOY-UHFFFAOYSA-N	449.920	1.890	50	20	IDGD	
O=C(NNC(=O)c1ccccc1O)Nc1ccc(S(=O)(=O)NCC(F)(F)F)cc1	756640171	KJTRSAYOMWOGDZ-UHFFFAOYSA-N	432.380	1.699	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)Nc2cnn(CC(=O)NC3CC3)c2)cc1	756795474	KHRBWDDXEUHEQH-ZDUSSCGKSA-N	430.465	1.181	50	20	IDGD	
O=C(CNC(=O)c1ccccc1I)NN=c1cc[nH]cc1Cl	757420055	KFDOSVDOUAEMIA-UHFFFAOYSA-N	430.633	1.635	50	20	IDGD	
CCN(CC(=O)NNC(=O)c1ccc(OC)c(OC)c1)C[C@@H]1COc2ccccc2O1	757439059	RAIBKIQFPHFTCE-MRXNPFEDSA-N	429.473	1.627	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)Nc1ccc(C(=O)NC2CCOCC2)cc1	757619295	MTEWODZQCZYMLZ-UHFFFAOYSA-N	426.473	1.965	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H](C(=O)NNC(=O)C(=O)Nc2ccccn2)C[C@@H]2CCCC[C@@H]21	758830393	KHRCBKRLGKWJBQ-KKUMJFAQSA-N	431.493	1.736	50	20	IDGD	
Cc1c(C(=O)NNC(=O)C(=O)Nc2ccccn2)nnn1-c1cccc(Br)c1	758833153	KCZKHOMMMQUNJZ-UHFFFAOYSA-N	444.249	1.133	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NC2CCN(c3cccnn3)CC2)cc(OC)c1OC	758856240	VIWFZJQLJBIUDR-UHFFFAOYSA-N	430.465	1.115	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)CCNS(=O)(=O)c1cccc(Cl)c1	760432632	NBQCMGIOOXXNCN-UHFFFAOYSA-N	448.929	1.071	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)NC[C@H](O)c2ccco2)cc1	762314727	VTHMTKDEPNGDJW-QMDZLVRISA-N	449.467	1.784	50	20	IDGD	
O=C(CCCN1CCN(c2ccccc2)CC1)NNc1nccc(N2CCOCC2)n1	762850888	MZDQWOIWQIRZLD-UHFFFAOYSA-N	425.537	1.359	50	20	IDGD	
CCCS(=O)(=O)N1CCC(NC(=O)NNC(=O)CSc2ccccc2O)CC1	763461562	BYICUUVGPLEOMY-UHFFFAOYSA-N	430.552	1.019	50	20	IDGD	
O=C(NNC(=O)c1cc2ccccc2cc1O)C(=O)Nc1cccc(CN2CCOC2=O)c1	763523593	WEYBXORFLPJLFF-UHFFFAOYSA-N	448.435	1.897	50	20	IDGD	
COc1cc(C(=O)NNC(=O)N[C@H]2CCCC[C@H]2N2CCOCC2)cc(OC)c1OC	763536454	PZPKLAZCJQEWFX-JKSUJKDBSA-N	436.509	1.300	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(Cl)cc2F)cc(OC)c1OC	763540113	QYBLXEFUTXMTBT-UHFFFAOYSA-N	425.800	1.905	50	20	IDGD	
CCc1noc(-c2ccc(C)c(NC(=O)C(=O)NNC(=O)c3ccc4c(c3)OCO4)c2)n1	763557585	CAAJWRQSYMNWPO-UHFFFAOYSA-N	437.412	1.736	50	20	IDGD	
CC(C)(C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1	763570576	GGGHXYJOPVLRFL-QGZVFWFLSA-N	440.456	1.141	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)ccc1C(=O)NC(C)C	763570877	GIMWFYHTXKMNKU-SFHVURJKSA-N	440.456	1.059	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)cc1C(=O)NC(C)C	763611624	BMIFHERVXSYKQB-UHFFFAOYSA-N	448.483	1.923	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1ccnn1-c1cccc(Cl)c1	763629166	PIAMVYYYQAEAGF-UHFFFAOYSA-N	437.847	1.882	50	20	IDGD	
O=C(COc1ccccc1-c1ccccc1)NNC(=O)C(=O)Nc1cnc2c(c1)COCC2	763644711	WYUMGJHAVIOMBP-UHFFFAOYSA-N	446.463	1.986	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2ccc(C(=O)NC(C)(C)C)cc2)c1	763669744	ZPJMKXYRSDZPLY-UHFFFAOYSA-N	440.500	1.997	50	20	IDGD	
C[C@@H](C#N)CSc1ccccc1NC(=O)C(=O)NNC(=O)COc1ccc(C#N)cc1	763678152	DWWLFNCJMJYZCG-AWEZNQCLSA-N	437.481	1.975	50	20	IDGD	
CCc1cc(NC(=O)C(=O)NNC(=O)COc2ccc(OCc3ccccc3)cc2)no1	763678747	BRXNWPDVNXSPEC-UHFFFAOYSA-N	438.440	1.981	50	20	IDGD	
O=C(COc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1cnn(-c2ccccc2F)c1	763684263	ICKJYCCFFRXJCV-UHFFFAOYSA-N	431.811	1.830	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2cccc(Cl)c2F)c1	763718245	JEBWJJZIXCHIKA-UHFFFAOYSA-N	442.856	1.129	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2cccc3ccc(C)nc23)c2ccccc2c1=O	763785625	KFRJRZOTGLKQQA-UHFFFAOYSA-N	444.451	1.673	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1	763819831	HCEWBVQYPJBROZ-UHFFFAOYSA-N	426.414	1.304	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cnn(-c3ccccc3)n2)ccc1OC(C)C	763920655	BHWJELZZPFNJAI-UHFFFAOYSA-N	438.444	1.463	50	20	IDGD	
CC(C)COc1ccc(NC(=O)C(=O)NNC(=O)c2cc(Br)cn2C)cn1	764004783	LXYAEEQYBJKNDO-UHFFFAOYSA-N	438.282	1.617	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1cc(C2CC2)nn1-c1ccccc1	764006648	RWSZFBVJXUDIJX-UHFFFAOYSA-N	447.451	1.921	50	20	IDGD	
COCCc1noc(-c2cc(Cl)ccc2NC(=O)C(=O)NNC(=O)C2CCCC2)n1	764076471	DTXSIFUVYGRPCE-UHFFFAOYSA-N	435.868	1.855	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2O1)C(=O)Nc1ccc(OCc2cccnc2)cc1	764165397	YJNKLLCMAMMSCK-FQEVSTJZSA-N	432.436	1.750	50	20	IDGD	
CC(C)CCC(=O)NNC(=O)C(=O)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1	764204552	YKGZBCRUPFFAPW-GOSISDBHSA-N	426.521	1.852	50	20	IDGD	
COc1cccc(Cn2nccc2NC(=O)C(=O)NNC(=O)c2cccc(C#N)c2)c1OC	764234579	GUQFNKMPSNOILE-UHFFFAOYSA-N	448.439	1.220	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)CCc2ccccc2O)nn1-c1cccc(F)c1	764281196	MDAGEVYDPPNWFR-UHFFFAOYSA-N	425.420	1.744	50	20	IDGD	
Cc1cc(C(=O)NC2CCCCC2)ccc1NC(=O)C(=O)NNC(=O)Cc1cc[nH]n1	764293937	RCAYFUHMQQQRGA-UHFFFAOYSA-N	426.477	1.109	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)C(=O)Nc1ccccc1CN1C(=O)CCC1=O)c1ccccc1	764332795	YXGKKHXZUWFOBB-QGZVFWFLSA-N	436.468	1.615	50	20	IDGD	
COC(=O)c1csc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c1C	764350709	IKRKVSWEJVEVSN-UHFFFAOYSA-N	427.442	1.429	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc(NC(C)=O)cc3)n[nH]2)cc1	764384638	HWAQEDXTZOHWRL-UHFFFAOYSA-N	434.456	1.997	50	20	IDGD	
COc1nccnc1NNC(=O)[C@@H](Cc1c[nH]c2ccc(Br)cc12)NC(C)=O	764469657	GCTHIEKDKMENDP-OAHLLOKOSA-N	447.293	1.920	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)CCCNS(=O)(=O)c2cccc(C(F)(F)F)c2)n[nH]1	765586458	WIPCFQOEHHVYCQ-UHFFFAOYSA-N	433.412	1.257	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)CN3CCN(C(=O)c4ccccc4)CC3)n[nH]2)o1	765734748	DEWAKYUEGYTCSC-UHFFFAOYSA-N	436.472	1.197	50	20	IDGD	
Cc1ccc(CCCC(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)s1	765737383	FCWUFTFLSSCIDU-UHFFFAOYSA-N	428.558	1.985	50	20	IDGD	
C[C@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(NC(=O)C(=O)NNc3cnccn3)cc2)C1	766258154	AYMGEPWOIYIIIM-OKILXGFUSA-N	432.506	1.225	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(C#N)cc2OC)cc1	766259302	XHUYXMLYAOOCJP-ZDUSSCGKSA-N	426.429	1.519	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1ccc(C(=O)NC2CCCCC2)cc1C	766260806	KBMFQFURASVEDI-UHFFFAOYSA-N	426.477	1.938	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c1[N+](=O)[O-]	766322224	ATSRUUREVCTPDP-UHFFFAOYSA-N	427.461	1.577	50	20	IDGD	
O=C(NNC(=O)[C@@H]1C[C@H]1c1cc(F)c(F)c(F)c1)c1csc(N2CCOCC2)n1	766630120	MSYWEOUWVASBDM-WDEREUQCSA-N	426.420	1.962	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)cc1	766659934	JYOLHRQLJVRNNM-UHFFFAOYSA-N	443.935	1.552	50	20	IDGD	
CC/C=C(/C)C(=O)N1CSC[C@@H]1C(=O)OCC(=O)NNC(=O)Cc1ccccc1C	767335035	RHHFMNMCCSFERA-IJZIWBRISA-N	433.530	1.486	50	20	IDGD	
CC(C)c1cc(NC(=O)C(=O)NNC(=O)c2c[nH]c3ccccc23)n(-c2ncccn2)n1	768233989	PXLKQMYBSSEPNS-UHFFFAOYSA-N	432.444	1.667	50	20	IDGD	
COc1ccc(NC(=O)NNc2ncccc2Cl)cc1S(=O)(=O)N1CCOCC1	769924824	FBBGHJHHYCMUKJ-UHFFFAOYSA-N	441.897	1.913	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)[C@@H]3CCN(c4ccc(Cl)c(Cl)c4)C3=O)nc21	770985099	YSAGVYNBOIJDPX-VIFPVBQESA-N	436.259	1.872	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)c1ccc(S(=O)(=O)NC(C)(C)C)cc1	771939786	OGYNPRTUDRRMAU-ZDUSSCGKSA-N	427.523	1.502	50	20	IDGD	
C[C@H]1CN(c2ccnc(C(=O)NNc3ccc(S(=O)(=O)NC4CC4)cc3)c2)C[C@H](C)O1	772174489	CGFNPYMODQIDDP-GJZGRUSLSA-N	445.545	1.893	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)N[C@H](c1ccc(F)c(Cl)c1)C(F)(F)F	772628407	MVKLLSFJCHCYNT-QUBYGPBYSA-N	434.799	1.351	50	20	IDGD	
CCNS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)c1	772951274	CEKSXNLLHYDAFX-GFCCVEGCSA-N	425.894	1.867	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NNC(=O)COc2ccc3ccc(=O)oc3c2)C1	773411808	RQFNRJFNJWMUHJ-OAHLLOKOSA-N	445.472	1.966	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1cnn(Cc2ccccn2)c1	774010732	YWYUDLZUMQRAJI-CYBMUJFWSA-N	442.863	1.533	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)NC[C@H]1CC[C@@H](C(=O)N(C)C)O1	775460340	INSZFVXJOZOCKI-KYNGSXCRSA-N	428.489	1.573	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)nc(C(F)(F)F)n1	777412459	VKPULQFXDUPKIE-UHFFFAOYSA-N	436.438	1.777	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)N[C@@H]1CCN(c2ccc(F)c(Cl)c2)C1=O	777751405	DGXGCTOMVCBAGI-OAHLLOKOSA-N	448.838	2.000	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2scnc2Br)c1	777787860	YYSSYSWJCRYSOV-UHFFFAOYSA-N	433.309	1.231	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)c2cc(S(=O)(=O)N(C)C)ccc2Cl)nc1C	778423891	IIWRDHNUJIDKNH-UHFFFAOYSA-N	441.897	1.622	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)NC1CCN(Cc2ccc(F)c(F)c2)CC1	778613368	LTIYGLMXGOURRB-UHFFFAOYSA-N	441.479	1.784	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)c1ccc2cc[nH]c2n1	779533783	LDHOCCWRRPZONA-UHFFFAOYSA-N	426.908	1.795	50	20	IDGD	
COc1ccc(NNC(=O)CNC(=O)c2ccccc2I)nc1	781536098	PKWWSLGIRSOUIC-UHFFFAOYSA-N	426.214	1.568	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)c2cccc([N+](=O)[O-])c2Br)c1	781674235	DWDVILORLNHBNO-UHFFFAOYSA-N	447.201	1.847	50	20	IDGD	
NC(=O)c1cccc(C(=O)NNC(=O)[C@H]2Cc3ccccc3CN2Cc2ccccc2)n1	781958896	SJGCEDVVWCBLPD-OAQYLSRUSA-N	429.480	1.569	50	20	IDGD	
Cn1cc(-c2ccc(F)c(C(=O)NNC(=O)C(=O)NCc3ccc(Cl)cc3)c2)cn1	782555432	MJVNTTUPYPANRO-UHFFFAOYSA-N	429.839	1.957	50	20	IDGD	
CCOC(=O)c1cn(C)nc1NC(=O)C(=O)NNC(=O)c1ccc(Cl)cc1Cl	782926311	GVJUOBPKBBTETL-UHFFFAOYSA-N	428.232	1.303	50	20	IDGD	
CCCOc1cccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)c1	783264967	UWNVCLCMFZUMBM-UHFFFAOYSA-N	435.506	1.639	50	20	IDGD	
Cc1nc(N2CCOCC2)ccc1NC(=O)C(=O)NNc1ccc(Cl)cc1[N+](=O)[O-]	783291028	KBTUMXJIJLEWOE-UHFFFAOYSA-N	434.840	1.870	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N(CC)CC)cc1NC(=O)C(=O)NN=c1cc[nH]cc1	783378268	BEKBLIIZAVKSNX-UHFFFAOYSA-N	435.506	1.015	50	20	IDGD	
CC(C)OC(=O)c1ccc(Cl)c(NC(=O)C(=O)NN[C@]2(C)CCS(=O)(=O)C2)c1	783427361	RQYFYKLODRIQHH-QGZVFWFLSA-N	431.898	1.042	50	20	IDGD	
O=C(NNc1nccc2sccc12)C(=O)Nc1ccc(F)c(S(=O)(=O)NC2CC2)c1	783437824	JUCZWJLQPYPBQB-UHFFFAOYSA-N	449.489	1.958	50	20	IDGD	
CSc1nc2ccc(NC(=O)C(=O)NNC(=O)CNC(=O)c3cccs3)cc2s1	784004261	DBFDTIOXZJFYSX-UHFFFAOYSA-N	449.539	1.596	50	20	IDGD	
Cc1ccc(Br)c(NC(=O)C(=O)NNC(=O)CNC(=O)c2cccs2)c1	784005394	YSDZDOSIGRQXJN-UHFFFAOYSA-N	439.291	1.335	50	20	IDGD	
CC(C)c1ccoc1C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	785706341	STQXGWHFRNQMEM-UHFFFAOYSA-N	449.529	1.818	50	20	IDGD	
C[C@@]1(NNC(=O)N[C@H]2CCN(c3cccc(Br)c3)C2)CCS(=O)(=O)C1	787372196	YYYCQJCKSDZDPE-XJKSGUPXSA-N	431.356	1.409	50	20	IDGD	
CN1CCC(n2ccc(NC(=O)C(=O)NNC(=O)c3c(Cl)cccc3Cl)n2)CC1	787541791	DTEMIMCKCGGQCV-UHFFFAOYSA-N	439.303	1.856	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cccnc2C(F)(F)F)cc1	788582399	DHDAMPOQGDPYJW-UHFFFAOYSA-N	430.408	1.491	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)N[C@@H](COC)[C@H]2CCCO2)c2ccccc2c1=O	789332453	PELAXRYOOOABFC-DLBZAZTESA-N	431.493	1.335	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccnn2CC(F)F)c1	789867152	MGUDYWZVORCMAP-UHFFFAOYSA-N	429.449	1.254	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCC(C)(C)CN2CCCC2)nc1	790711567	URUYVDBFQBEYIO-UHFFFAOYSA-N	426.587	1.860	50	20	IDGD	
CN(CCC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)C(=O)OC(C)(C)C	794750130	DEZISRXEOVHPND-UHFFFAOYSA-N	433.553	1.603	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)c1cc(F)c(F)cc1C(=O)c1ccccc1	795180693	FCSOUBSDWIQNLR-UHFFFAOYSA-N	438.390	1.782	50	20	IDGD	
CCOC(=O)c1ccc(F)c(S(=O)(=O)NNC(=O)c2ccc(OC)c(OC)c2)c1	795280778	MQXGGHUMDQIPHO-UHFFFAOYSA-N	426.422	1.643	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)c(Cl)c1)C(=O)Nc1ccc(F)c(N2CCOC2=O)c1	797007873	TXTCXXVRKOAFKO-UHFFFAOYSA-N	436.783	1.541	50	20	IDGD	
CC(=O)N[C@@](C)(C(=O)NNc1cccc(F)c1[N+](=O)[O-])c1ccc(S(C)(=O)=O)cc1	797760156	AXZMMXQRTBASHM-GOSISDBHSA-N	438.437	1.632	50	20	IDGD	
Cc1cc(O[C@@H]2CCN(C)C2=O)ccc1NC(=O)NNC(=O)COc1ccccc1F	799241065	QBNDGOZQMJLGDO-GOSISDBHSA-N	430.436	1.975	50	20	IDGD	
CN1C(=O)COc2cc(NC(=O)C(=O)NNC(=O)c3cc4ccccc4cc3O)ccc21	799257195	FYBUAIJDNKPUEM-UHFFFAOYSA-N	434.408	1.300	50	20	IDGD	
CC(=NNC(=O)CNC(=O)c1cccnc1)c1c[nH]c2ccc(Br)cc2c1=O	799880899	JFYAIVWEIXVPFV-UHFFFAOYSA-N	442.273	1.956	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)NCCCNC(=O)/C=C/c2ccccc2)cc1C	800761426	XSIIYJKWAJQAHQ-ZRDIBKRKSA-N	437.500	1.792	50	20	IDGD	
CS(=O)(=O)NCCc1ccc(C(=O)NNC(=O)Nc2ccc3c(c2)OCO3)s1	802101795	VGNBQUKDPQBGEZ-UHFFFAOYSA-N	426.476	1.035	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)NC2CC2)cc1)NNC(=O)Nc1ccc2c(c1)OCO2	802107139	KBCPUDDEYNLXDI-UHFFFAOYSA-N	446.485	1.642	50	20	IDGD	
CCc1nnc(NC(=O)[C@@H](C)[C@@H](C)NC(=O)NNC(=O)c2cccc(N(C)C)c2)s1	805878240	GRRQULOZILVWPQ-NWDGAFQWSA-N	433.538	1.774	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)c1nccn1-c1ccccc1	806059209	WORLYLGYZHAJHI-CQSZACIVSA-N	427.486	1.981	50	20	IDGD	
CCN(C)C(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2ccccc2Br)c1	806972540	XLHUUVZPNLNGBH-UHFFFAOYSA-N	447.289	1.941	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)NC[C@H](c1ccc(F)cc1)N1CCOCC1	806999822	AJSRBFCFSOEUOV-GOSISDBHSA-N	434.443	1.748	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2ccc(Cl)cc2OCC(F)F)CCS(=O)(=O)C1	807000553	DMXGYMCSBNXXSU-OAHLLOKOSA-N	425.841	1.120	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)Nc1nc(-c2ccc(F)cc2)cs1	807017296	HHGSTMRZQTVSKQ-UHFFFAOYSA-N	445.388	1.963	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CNS(=O)(=O)c2ccc(OC(F)(F)F)cc2)c(O)c1	810172172	ASCOPDCTEDYLOB-UHFFFAOYSA-N	447.391	1.339	50	20	IDGD	
CC(C)c1cc(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)n(-c2ccccc2)n1	810385257	PMZAGRWVSGBFBF-LJQANCHMSA-N	449.467	1.922	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccc(Br)c([N+](=O)[O-])c1	810385259	YZTFZBFCJBSYPH-UHFFFAOYSA-N	439.197	1.825	50	20	IDGD	
Cc1cc(NNC(=O)CN(CC(=O)NNc2cc(C)nc(C)n2)c2ccccc2)nc(C)n1	812514594	BOQLQYNNRJGRSI-UHFFFAOYSA-N	449.519	1.593	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2ccc3c(C)nn(C)c3c2)cc1	812990773	YSEUTKMRGMXQSL-UHFFFAOYSA-N	444.517	1.664	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NN=Cc3nc4c(s3)CCC4)CC2)cc1	814876962	GQEYJPRNOVPAPY-UHFFFAOYSA-N	447.586	1.397	50	20	IDGD	
Cc1nc(Br)sc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	816810364	JSCJQKHOEIBNSP-UHFFFAOYSA-N	447.336	1.539	50	20	IDGD	
COc1cccc(/C=C(/C(=O)NNC(=O)COc2ccccc2OC)n2nnnc2C)c1	818023552	MLEWCNSZIKGVRP-ATVHPVEESA-N	438.444	1.223	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)[C@@H](CC(C)C)N2C(=O)[C@H]3CC=CC[C@H]3C2=O)cc1	913431301	CZHUGUPZAPZQAL-CEXWTWQISA-N	426.517	1.920	50	20	IDGD	
CC(C)(CNC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)N1CCCCC1	915899561	KNHGDPOWMWTVET-UHFFFAOYSA-N	430.597	1.794	50	20	IDGD	
CCN(CC)C(=O)c1ccc(CNC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1	916389185	HLRKSJPKESAIJM-UHFFFAOYSA-N	436.476	1.289	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)N1CCCC[C@H]1C	916446738	AVBLBTNZSQFXBD-CABCVRRESA-N	425.555	1.144	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)[C@@H](C)NC(=O)c2ccc(Br)s2)n1	917391671	CSOHEEPHCGQQPC-SNVBAGLBSA-N	428.312	1.290	50	20	IDGD	
CCc1ncncc1C(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	918008429	LUERGZAKHKYGSP-UHFFFAOYSA-N	428.456	1.816	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)N2CCC(NS(C)(=O)=O)CC2)N(C)c2ccccc21	919696645	SKWOJGPVXUDDHI-UHFFFAOYSA-N	445.545	1.197	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)c2nc3ncc(Br)cn3n2)cc1OC	919810105	XUDXMBAUGZIQLN-UHFFFAOYSA-N	449.265	1.759	50	20	IDGD	
CCCS(=O)(=O)CC(=O)NNC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1	919810283	AEJKNWZBUNRGGB-UHFFFAOYSA-N	427.486	1.520	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)CN1C(=O)NC2(CCC(C(C)(C)C)CC2)C1=O	920213286	UJJMREAWTOPZBG-UHFFFAOYSA-N	444.532	1.912	50	20	IDGD	
CC(=O)N/C(=C/c1ccccc1)C(=O)NNC(=O)[C@H]1CCCN(C(=O)OC(C)(C)C)C1	920435489	HOBLSSDOQUQGQZ-NAVNFMRLSA-N	430.505	1.958	50	20	IDGD	
O=C(NNC(=O)c1n[nH]c2c1CCCC2)c1ccccc1S(=O)(=O)N1CCCCC1	1317771724	MKCVGFCTJZMJSY-UHFFFAOYSA-N	431.518	1.538	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NCc2ccccc2N2CCN(C)CC2)cc1	1318509979	VKVCEDQVZYSCMH-UHFFFAOYSA-N	427.505	1.356	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(C(=O)NNc2nncc(N)c2Cl)ccc1Br	1319302458	FCSKZXNBIFLFFO-UHFFFAOYSA-N	449.718	1.482	50	20	IDGD	
CCc1cc(C(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)nn1C	1323647601	ZJHGMTRQVLHZCA-UHFFFAOYSA-N	433.515	1.920	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Nc2ccccc2S(=O)(=O)N1)Nc1ccc(Cl)cc1Cl	1327170628	CYPRSPRKLXYKLH-CYBMUJFWSA-N	430.273	1.876	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3nn(C)c4c3CCC4)C2)C1	1777963932	ALMIGGUQNJHFRT-AUUYWEPGSA-N	439.354	1.526	50	20	IDGD	
CC[S@](=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@](C)(Cl)CCl)C2	1779220413	JKZMMUITQCMWJZ-PENXLVGXSA-N	441.421	1.895	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cc3cccnc3nc1O)CCO2	1779299084	OSVGVQULVXMEJC-NRFANRHFSA-N	444.564	1.630	50	20	IDGD	
CC(C)=NO[C@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Br)C2	1780808724	IGBTZJUNMCHVDQ-VMUDFCTBSA-N	436.322	1.992	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)Cc3ccc([N+](=O)[O-])c(OC)c3)C2)C1	1781192862	QWTMXXZTALGOAN-MGPUTAFESA-N	439.896	1.993	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)C1(F)CN(C(=O)OC(C)(C)C)C1)CCO2	1781224362	VLBKCUHUNYJPIR-LIRRHRJNSA-N	447.935	1.793	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2	1781897701	OGYQALVXBCIGMI-OQMKEHIESA-N	425.751	1.274	50	20	IDGD	
C=C(CC(=O)OCC)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](Cl)COC)C1	1782178120	FTMJDAIOIJDGMG-RZQQEMMASA-N	430.929	1.264	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cccc4ccnn34)C2)C1	1782228836	WYWRVFWLWMCWQJ-KXBFYZLASA-N	435.322	1.951	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@@]3(CN(C(=O)CCBr)CCO3)C2)nc2nccn12	1782351415	UGCVISVRDBACEY-GOSISDBHSA-N	436.310	1.266	50	20	IDGD	
Cc1ncc(/C=C/C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](O)CCl)C3)s1	1782663737	JCNCINWESWMOSJ-ISOMHGOVSA-N	427.954	1.578	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(CCN(C(=O)c3cnc4c(c3)CCNCC4)C2)C1	1782729752	KUCKCVLMZFRION-JOCHJYFZSA-N	446.624	1.065	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@@]2(C1)CN(C(=O)c1csnn1)CCO2	1782861811	KRZTXPOQQBEMOH-CDXDBMBRSA-N	445.451	1.867	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3nn(C)c4c3CCC4)CCO2)C1	1783347795	OWGQWMDTRCFBAQ-AUUYWEPGSA-N	439.354	1.526	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3[nH]cnc3-c3cccnc3)CCO2)C1	1783535610	AOPPZRDFICWNQJ-BFUOFWGJSA-N	448.321	1.699	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cccc3nscc13)CCO2	1783936193	FRJUCQDCJVGYOZ-NRFANRHFSA-N	445.545	1.113	50	20	IDGD	
COc1ccc(CC(=O)N2CCO[C@]3(CCN(C(=O)C(Cl)Cl)C3)C2)c(C#N)c1	1783946957	JYEBPYXUKOQSIA-LJQANCHMSA-N	426.300	1.743	50	20	IDGD	
C=C[C@H](O)C(C)(C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]2C1	1783966255	BSNLNGWRLCFJHT-YXMSTPNBSA-N	431.371	1.570	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C3=NO[C@H](c4ccccc4)C3)C[C@@H]21)[C@H](O)CCl	1784092198	JLYSDFNZEVOMSM-AEIBSFOJSA-N	435.908	1.083	50	20	IDGD	
CCOC(=O)N(CC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Cl)CCO2)Cc1ccco1	1784302905	MHFOKYJVUHEIFC-QFBILLFUSA-N	445.875	1.602	50	20	IDGD	
Cc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]32)cc(O)n1	1787458231	NLUANBKQBKIRKF-XPVILTJLSA-N	430.332	1.925	50	20	IDGD	
C[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(C)(C)CCl)C[C@@H]21)[C@@H]1SC(=N)NC1=O	1787493372	UFJYGGKOWCHCJI-QMVSFRDZSA-N	444.985	1.034	50	20	IDGD	
Cc1occ(C(F)(F)F)c1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21	1787663188	AOLWBXNXVQKEMI-VTPLQMEGSA-N	438.830	1.800	50	20	IDGD	
Nc1ncc(C(=O)NC2(c3ccc(NC(=O)c4ccc(B(O)O)cc4)cc3)CCC2)s1	1788140800	YJJBYDIWYWEVQI-UHFFFAOYSA-N	436.302	1.467	50	20	IDGD	
CCC[C@@H](NC(C)=O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]2C1	1788765896	BYNQTXCUWNUBKV-FJIDUMEYSA-N	427.618	1.122	50	20	IDGD	
Cn1cccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]3C2)c1=O	1789867571	FYCHVLAGWNZFJF-XPVILTJLSA-N	430.332	1.215	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4ncnn4c3)C[C@@H]21	1789868183	QGUDJGADSKFJPI-XLPNERPQSA-N	440.331	1.559	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)COc3ccc(O)cc3)C[C@@H]21)[C@@H](F)Br	1789921220	CBZUUMRMBATNRC-JIRONKKISA-N	445.285	1.441	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnnc(Cl)c3)C[C@@H]21)[C@@H](F)Br	1789922041	CSJQRVGDMDCONF-KYVBTAMFSA-N	435.681	1.414	50	20	IDGD	
COc1ncccc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)Br)[C@H]2C1	1791057048	MQQBZGUIXLAYJD-JURCDPSOSA-N	426.311	1.467	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3ccc(OC)nc3)C[C@@H]21	1791252057	AKAPAAQCJMSFGQ-FJIDUMEYSA-N	439.940	1.256	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(CC(C)C)nn3C)C[C@@H]21	1791254794	RZYOMXVSIGDLMI-XPYUAMARSA-N	440.972	1.466	50	20	IDGD	
CCOC(=O)N[C@@H](O)C(=O)NC1(c2ccc(NC(=O)[C@H](C)Br)cc2)CCC1	1791434055	DAJUXSLQJULLFC-NHYWBVRUSA-N	442.310	1.968	50	20	IDGD	
CC(C)N(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](O)CCl)C2)C(=O)OC(C)(C)C	1792673520	QTIMBTWBJYWONV-FZKCQIBNSA-N	431.961	1.870	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1cccc(O)c1)C2	1792871984	HAOVCHHHWKKPNR-AMVTXUCVSA-N	439.350	1.945	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Cn1ccnc1)C2	1792873320	SIVLDGAIAJXFEQ-DGADGQDISA-N	427.343	1.140	50	20	IDGD	
Cc1nc(N)sc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)CBr)C2	1795665587	NLXRRLHLRLOJEY-KXGXSXBTSA-N	431.356	1.268	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CNc2ccccc21	1796066785	FFSKBHYUCYAKNL-MPTSOXDCSA-N	448.527	1.968	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Cl)C1	1796364464	GBFWSDVHSNTKMF-UXXRCYHCSA-N	433.908	1.367	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2)c1ccc(CCN2CCCC2)nc1	1796503909	ATDNMYSPBIVRIX-NBMJBFSESA-N	438.931	1.458	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnc2ccccc2n1	1796779733	UQPLOHFUJVTODD-JRATXPSKSA-N	433.306	1.616	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cc1nnc(C)s1)C2	1796892258	SMZUDVYEIIIVAP-NHDOHCAUSA-N	443.533	1.161	50	20	IDGD	
Cc1nc2ncccn2c1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Br)C2	1797006275	NRIBXQMFMUNHBA-RUZUBIRVSA-N	436.310	1.024	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)c1ccc2occ(Cl)c2c1	1798610250	LWBVZZWMRYRAHM-DJZPMSPPSA-N	427.284	1.889	50	20	IDGD	
Cn1c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](O)CCl)C3)cc2c[nH]c3nccc-3c21	1799170743	FBXUVGAXSBVZHC-UMPJEAMMSA-N	429.908	1.858	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CNc1ccc(F)cc1)C2)[C@@H](F)Br	1799346095	BFVAVQQZNJFSMC-OXUXUCFPSA-N	432.265	1.518	50	20	IDGD	
CS(=O)(=O)c1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](F)Br)nc1	1800157113	HBABYSTVAUTCSH-MIJXAVMKSA-N	448.314	1.427	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1cccc(F)c1F)c1cccc(B(O)O)c1	1801826415	YGTLADAOGWQMOV-BCDXTJNWSA-N	428.244	1.139	50	20	IDGD	
C=CCNC(=O)/C=C\C(=O)NC[C@@H]1CCN(C(=O)[C@H](C)Br)[C@H]1c1cccnc1	1802491250	XKRAUDMQUUHFQT-VMQDEBPWSA-N	449.349	1.729	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@@H]1c1cccnc1)c1cnsn1	1804995478	IGSXRMYURQHNSJ-CYZMBNFOSA-N	428.287	1.943	50	20	IDGD	
O=C(CCBr)NC[C@H]1CCN(C(=O)CN2CCCC2=O)[C@H]1c1cccnc1	1806341199	ZVHVHBVCSMMUQR-BEFAXECRSA-N	437.338	1.495	50	20	IDGD	
O=C(Cc1cccs1)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1807544168	PZTPRXPBHLFMPP-XMSQKQJNSA-N	449.341	1.385	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)Cc2cccs2)[C@@H]1c1cccnc1	1807552316	SYBUKWRSKUALLB-JTSKRJEESA-N	443.573	1.765	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)c1cnn2ccccc12	1809068461	DFCZJHONMCTHRB-KFKAGJAMSA-N	427.892	1.649	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)[C@H]2CCC=CO2)[C@H]1c1cccnc1	1810264847	VMAAERVVRKADBY-DBXWQHBBSA-N	429.521	1.153	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)COc2ccc(O)nn2)[C@H]1c1cccnc1)C(Cl)Cl	1813081152	JHCVLCDITRBVQB-LRDDRELGSA-N	440.287	1.466	50	20	IDGD	
C[C@H](C(=O)NC[C@@H]1CCN(C(=O)[C@@](C)(Cl)CCl)[C@H]1c1cccnc1)n1cnnn1	1813473707	OGVKYSRLILKHIN-FHIHXZLISA-N	440.335	1.571	50	20	IDGD	
O=C(NCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](O)CCl)n[nH]1)c1cccs1	1814867438	LDFPDOOIZMXJPC-CHWSQXEVSA-N	439.925	1.493	50	20	IDGD	
CC(=O)C(C)(C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1815077573	DIEKABJQPRDBMS-MRXNPFEDSA-N	441.492	1.329	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnccn2)n[nH]1	1816361313	HAAAWFDWACYCBH-ROCQKPIASA-N	449.475	1.640	50	20	IDGD	
Cc1ccc(CC(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)o1	1817479439	MVFGZSOWGBWCEN-IBGZPJMESA-N	436.277	1.540	50	20	IDGD	
O=C(Cc1cccnc1)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1817621141	UBERNNMIHNUXEH-IBGZPJMESA-N	433.277	1.033	50	20	IDGD	
CCOCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)n[nH]1	1818111805	IVAFLMDCMQUWNN-DXRSZSRVSA-N	429.481	1.572	50	20	IDGD	
CC(C)O[C@@H](C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1819504050	MKZULOJIVYVXBH-KBXCAEBGSA-N	428.298	1.209	50	20	IDGD	
Cc1cc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)[nH]n2)ccn1	1819754564	GFPARGRDJZRTNW-SFHVURJKSA-N	448.487	1.731	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)n(C)n2)[nH]n1	1822186102	GJOPNTFNHXTVBT-BXKDBHETSA-N	425.287	1.938	50	20	IDGD	
Cn1cccc(C(=O)N[C@@H]2CCc3nc(NC(=O)[C@H](F)Br)sc3C2)c1=O	1822999480	SERZLPUSXPSNKD-PELKAZGASA-N	443.298	1.758	50	20	IDGD	
O=C([C@@H]1ON=C(c2ccccc2)O1)N1CCC([C@@H]2CCCCN2C(=O)[C@H](O)CCl)CC1	1824185501	FFGSTLNYQLKFBZ-SVMVAKDDSA-N	449.935	1.941	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](Cl)COC)CC2	1824613356	VZDKUWYPYSWVMS-VWYCJHECSA-N	433.914	1.871	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CN(CCO)CCO)CC1	1824619216	UUNFYJWROMAZEI-OALUTQOASA-N	432.005	1.300	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(C)n3ccnc3n1)CC2	1826003845	ADHYPULAUVCDJQ-NEPJUHHUSA-N	448.936	1.974	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCc1ccccn1)CC2	1826080558	QTWQUBHWJKNRTI-HNNXBMFYSA-N	444.561	1.456	50	20	IDGD	
O=C(C1=COCCC1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827054393	CJUBMISLJNSRMX-NRFANRHFSA-N	426.322	1.294	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)Cc2ccc(F)cn2)CC1	1827123791	WQMHCRQRASMALS-HXUWFJFHSA-N	447.555	1.756	50	20	IDGD	
Cc1cc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)CC2)n[nH]1	1828924046	HVOCDIJEWQKSGM-LJQANCHMSA-N	439.520	1.264	50	20	IDGD	
Cn1cccc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1	1828925178	GXRKRQISIIKBDA-IBGZPJMESA-N	438.532	1.571	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)c1ccc(OC)cc1)CCO2	1830216502	DYUHQSXNAQXJJB-BBTUJRGHSA-N	440.924	1.202	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccccc3O)C2)C1	1830535864	VKWSKOZGGJRPOX-LIRRHRJNSA-N	441.322	1.493	50	20	IDGD	
C=C(CC(=O)OCC)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](Cl)CCC)CCO2	1831653534	HNYFQALXOYSYLL-OXJNMPFZSA-N	430.929	1.360	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(O)ccc3O)C2)C1	1831653777	LTOZLOWSXPJGIL-JXFKEZNVSA-N	426.897	1.575	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)C3(C(=O)OCC)CC3)C2)C1	1831656120	AXFOGMRJFKMVQD-HNAYVOBHSA-N	430.929	1.194	50	20	IDGD	
Cc1cc(C(=O)N2CCC([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)nn1C	1831871357	AXXQUQONIODJKA-LJQANCHMSA-N	432.569	1.335	50	20	IDGD	
COC(=O)NCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H](C)CBr)CC1	1832062282	AYXCCTVYNZXHQX-DZGCQCFKSA-N	432.359	1.993	50	20	IDGD	
Cc1ccc(CC(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)o1	1832331796	VTRRQIHNBFWMDK-JOCHJYFZSA-N	438.333	1.744	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)CCc2ccoc2)CC1	1832343657	SJKFAQQYVBPRRT-QFIPXVFZSA-N	438.333	1.826	50	20	IDGD	
Cc1cn(CC(=O)N2CCCC[C@@H]2C2CCN(C(=O)C(Cl)Cl)CC2)c(=O)nc1O	1832775640	DWFVAJLGPOTOOD-CQSZACIVSA-N	445.347	1.681	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3nc4ccccc4[nH]3)CC2)CC1)[C@@H](O)CCl	1833310243	MTJUJPXIWUEWAO-SFHVURJKSA-N	433.940	1.348	50	20	IDGD	
O=C(CCCC(F)(F)F)NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1833661759	AQKQXDQYZJTGKS-HNNXBMFYSA-N	427.895	1.890	50	20	IDGD	
CCc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)CCBr)C3)C2)cn1	1833890233	WWZRUWZNUYXUSH-IBGZPJMESA-N	440.338	1.499	50	20	IDGD	
CCn1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@](C)(Cl)CCl)C3)C2)n1	1834409119	XOJKYRARCMDDMY-QZTJIDSGSA-N	433.336	1.209	50	20	IDGD	
CCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](Br)Cc3ccccc3)C2)C1	1834816125	YHERAIHFWKTBCY-FXAWDEMLSA-N	439.350	1.859	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)Cn3cccn3)CC2)CC1	1834881264	ANHKYVFIDGWPLV-OAHLLOKOSA-N	440.386	1.486	50	20	IDGD	
CCc1cc(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](F)Br)CC3)CC2)n[nH]1	1834924651	WLXXLJBLRJAOLT-MRXNPFEDSA-N	444.349	1.848	50	20	IDGD	
O=C(COc1ccc(F)cc1)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1834967192	SWDRCMTWDQSNLM-SFHVURJKSA-N	435.279	1.465	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H]3COc4ccccc4O3)CC2)CC1)[C@H](F)Cl	1835079088	LLQKGQMYGYLEGR-OALUTQOASA-N	439.915	1.932	50	20	IDGD	
O=C(CCc1ccccc1Cl)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1	1835173077	OSVFOCGMJCKEMP-YLJYHZDGSA-N	445.343	1.329	50	20	IDGD	
C[C@H](Nc1cnccn1)C(=O)NC1CCN(C2CCN(C(=O)[C@H](F)Cl)CC2)CC1	1835749561	VIAJLLMWPJBZOE-GUYCJALGSA-N	426.924	1.383	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1)c1ccnnc1O	1836063359	XOSHPSDAUYPSMN-CQSZACIVSA-N	444.305	1.058	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3csnn3)CC2)CC1)[C@@H](F)Br	1836414216	YXKHYAGUYXRQMV-CYBMUJFWSA-N	434.335	1.414	50	20	IDGD	
CN[C@H](CC(=O)N1CCC(OC2CCN(C(=O)C(C)(C)CCl)CC2)CC1)C(=O)O	1836623574	SYBSHRLRNHWZPY-MRXNPFEDSA-N	431.961	1.313	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc4cccc(C)c4[nH]3)CCO2)C1	1836856559	KPKWTPJLDNTNDH-VGSWGCGISA-N	449.935	1.800	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc4n(n3)CCCC4)CCO2)C1	1836974217	QRHOCQOPFSXXTA-UTKZUKDTSA-N	438.956	1.697	50	20	IDGD	
O=C(c1n[nH]c2ccc(F)cc12)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1837043506	VGQJNGCHIGGFPC-SFHVURJKSA-N	445.278	1.576	50	20	IDGD	
C[C@@H](Nc1ccccc1)C(=O)N1CCOC[C@@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1837715542	WDXGPWSUKMVGDV-XMSQKQJNSA-N	449.624	1.795	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(O)nc3)CCO2)C1	1838655276	WEQMVEMLZVFGGD-KDOFPFPSSA-N	442.310	1.031	50	20	IDGD	
COc1cccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)c1	1838929081	XPVTYNUMCCBGGP-MAUKXSAKSA-N	445.285	1.456	50	20	IDGD	
O=C([C@H](F)Cl)N1CCOC[C@]2(C1)CN(C(=O)C1(c3ccc(F)c(F)c3)CC1)CCO2	1839042473	YMBJRJXHOXWKSM-LPHOPBHVSA-N	446.853	1.987	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3noc4c3CCCC4)C2)C1	1839143574	AUCWQFRXECAFKC-FOIQADDNSA-N	425.913	1.641	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(-n4cncn4)c3)C2)C1	1839147574	VYKUGVBMQDYOJT-GHTZIAJQSA-N	447.923	1.355	50	20	IDGD	
O=C(c1cc2ccoc2cn1)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1839486803	DJTMZFDNBRGGRH-SFHVURJKSA-N	428.272	1.702	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCN3CCCC3)C2)C1	1839967546	PYCPLXKHFIAJDT-VQIMIIECSA-N	446.386	1.102	50	20	IDGD	
CC(C)c1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)on1	1840034330	HZSMLXBBCUUSKZ-UGSOOPFHSA-N	444.326	1.651	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)COC3CCCCC3)C2)C1	1840149573	SWONRQIJRRGPCE-XLIONFOSSA-N	432.945	1.046	50	20	IDGD	
C[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1)c1ccccn1	1840503928	PHSIEEBNJVGJSJ-BEVDRBHNSA-N	444.359	1.878	50	20	IDGD	
CC(C)C1(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)CCC1	1840613394	XMIGFPQWIZMMCS-RHSMWYFYSA-N	435.334	1.960	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(F)c(OC)c3)CCO2)C1	1840682808	HHYKOLJMZCYNKS-QRWLVFNGSA-N	428.888	1.922	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3cc(F)ccc3F)CCO2)C1	1840812002	VAKJLGGXCNSPIV-OXJNMPFZSA-N	446.878	1.218	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)C2CN(C(=O)c3ccccc3OC)C2)C1	1841248786	NGZHTJXESWWHRQ-KRWDZBQOSA-N	433.936	1.988	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC12CN(C(=O)c1cncc(S(C)(=O)=O)c1)C2	1841286350	YEWVCJROBQYPFY-GFCCVEGCSA-N	444.351	1.333	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC12CN(C(=O)c1ccc3c(c1)NC(=O)CO3)C2	1841287423	LUGHNIPEVPLZRE-LBPRGKRZSA-N	436.306	1.866	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCCC12CN(C(=O)c1cnsn1)C2	1841924152	BRLQYAZXLLMGNU-NSHDSACASA-N	429.930	1.487	50	20	IDGD	
CC(C)(C)OC(=O)N1CC2(CC(C(=O)N3CC4(CCCN4C(=O)[C@H](F)Cl)C3)=NO2)C1	1843366837	TXJJYHXTISEZTD-ZDUSSCGKSA-N	444.891	1.490	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC2(CCCN2C(=O)c2nnc3cc(C)nn3c2C)C1	1843698696	SRUCVAGETFFFGD-CYBMUJFWSA-N	435.326	1.732	50	20	IDGD	
CC(C)(C)OC(=O)N(CC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl)C1CCCC1	1847560727	ZLCAJDYZBPSGFV-YESZJQIVSA-N	443.972	1.968	50	20	IDGD	
Cc1ccc(CCC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2cnccc2C(=O)NN)cc1F	1847781295	YFUHMKURGXQDDR-PMACEKPBSA-N	439.491	1.581	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)Cn1ccnc1	1848095602	COYMNBXFDDLDEH-KKUMJFAQSA-N	425.917	1.217	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)Cn1c(=O)[nH]c(=O)c2ccccc21	11236862	HXKWXVBJLNMJBV-CQSZACIVSA-N	432.436	1.458	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cccc(C)c2NC(C)=O)cc1OC	11811982	SSIBNYOAIHRFCN-UHFFFAOYSA-N	429.429	1.589	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	14847384	QSOGGKCTHBQZRB-UHFFFAOYSA-N	440.522	1.147	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)cc1OC	15793295	KTQDDMQXICZNLT-UHFFFAOYSA-N	447.513	1.953	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)c2ccc(S(=O)(=O)NC3CC3)cc2)cc1	18072029	ASICEJSJFBCTII-AWEZNQCLSA-N	447.513	1.755	50	20	IDGD	
C[C@]1(C2CC2)NC(=O)N(CC(=O)NNC(=O)c2ccc(COc3ccccc3)o2)C1=O	21969979	CQBMDLYWJUUWFH-OAQYLSRUSA-N	426.429	1.340	50	20	IDGD	
Cc1cc(C)c(C)c(S(=O)(=O)NCC(=O)NNC(=O)c2c(C)nc3ccccn23)c1C	725909484	JAOFUGNKJQHEFU-UHFFFAOYSA-N	443.529	1.616	50	20	IDGD	
NC(=O)[C@@H](NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)c1ccc(F)cc1	727462687	RCFJTARZZXECSB-SFHVURJKSA-N	434.493	1.461	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N[C@@H](CN2CCN(C)CC2)c2ccccc2)cc1OC	727841042	MTMOXAVKWQDFCZ-IBGZPJMESA-N	441.532	1.637	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(\C#N)C(=O)NCCCN2CCC[C@H](C(N)=O)C2)c1C	728077414	IQABOSSMGNSPHR-VDWDRUAGSA-N	429.565	1.923	50	20	IDGD	
O=C(COC(=O)c1cc(F)c(F)c(F)c1F)NNC(=O)[C@@H]1COc2ccccc2O1	728326602	BWJMXRBSCPQTBU-LBPRGKRZSA-N	428.294	1.387	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=S)NCCCN2CCOCC2)c1	728445147	GFRSBOWFJULTEP-UHFFFAOYSA-N	431.356	1.289	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)C1	728847709	MACHKMKKWHDXAO-MRXNPFEDSA-N	432.525	1.488	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)c1ccc2c(=O)n(Cc3ccco3)c(S)nc2c1	728892187	PVTQPCPZKNRGAY-UHFFFAOYSA-N	435.465	1.725	50	20	IDGD	
CS(=O)(=O)NCCc1ccc(C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)cc1	728974229	IHYVIDYQMNODKQ-UHFFFAOYSA-N	447.485	1.532	50	20	IDGD	
C[C@@H]1CCCC[C@]12NC(=O)N(CC(=O)NNc1ccc(S(=O)(=O)C(F)F)cc1)C2=O	728976149	IJQPOKCPZVXLBP-ZMZPIMSZSA-N	444.460	1.627	50	20	IDGD	
CN1CCN(C[C@@H](NC(=O)NNC(=O)Cn2ccc3ccccc32)c2ccccc2)CC1	729506437	BLUFITVHCPTGDI-OAQYLSRUSA-N	434.544	1.960	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H]1CNC(=O)NNC(=O)c1nnc(O)c2ccccc12	730908400	BHYRFZJTGRJKTJ-LBPRGKRZSA-N	430.465	1.679	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)c2snnc2C)c1	731449978	LZOMTCCUGSOQNG-UHFFFAOYSA-N	447.498	1.731	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2c[nH]nc2C)cc1S(=O)(=O)N1CCCCCC1	731852609	DMAILVBXNOCZDP-UHFFFAOYSA-N	435.506	1.366	50	20	IDGD	
CCS(=O)(=O)N1CCC[C@H](C(=O)NNC(=O)c2ccc(OC)c(Br)c2)C1	732033661	UELBCTKNEPRLEE-LBPRGKRZSA-N	448.339	1.280	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)/C(=C\c2cccnc2)NC(=O)c2ccccc2)cc1	733124074	QNYQFSCMALUNHM-FYJGNVAPSA-N	441.447	1.951	50	20	IDGD	
CC(C)N1CC[C@@H](NC(=O)NNC(=O)[C@@H](C)Oc2cccc(Br)c2)C1=O	734162564	MAASKHWWNLIMTH-BXUZGUMPSA-N	427.299	1.556	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)Cn2nnc(C3(NC(=O)c4ccccc4)CCCC3)n2)cc1	734981577	MVJJWIIUVBKETD-UHFFFAOYSA-N	447.499	1.642	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)cc1OC	736865919	GORDROCJDAUWKY-UHFFFAOYSA-N	437.792	1.883	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCCCCc2ccc([N+](=O)[O-])cc2)c1	740483170	OWSMJWMCPDFUOK-UHFFFAOYSA-N	434.474	1.965	50	20	IDGD	
NS(=O)(=O)c1ccccc1S(=O)(=O)NNC(=O)c1cc2c(s1)CCCCCC2	740705070	GQGUDDAWEBEDLW-UHFFFAOYSA-N	443.572	1.678	50	20	IDGD	
CC(C)CNC(=O)N1CCC[C@@H](C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)C1	741213673	AZDNFYIHUCUENN-OAHLLOKOSA-N	437.566	1.648	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)c2ccc(CNS(=O)(=O)CC)cc2)cc1OC	741659193	KCJDCJFNCIPECE-UHFFFAOYSA-N	435.502	1.608	50	20	IDGD	
Cc1cc(C=NNC(=O)C[C@@H](C(=O)NN=Cc2cc(C)[nH]c2C)N2CCOCC2)c(C)[nH]1	741765708	CAIXEONUSFOFEN-FQEVSTJZSA-N	441.536	1.268	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2cc3oc(=O)[nH]c3cc2Cl)cc1OC	743252300	VPIYOBKVULQPSO-UHFFFAOYSA-N	427.822	1.415	50	20	IDGD	
COCCCNC(=O)NNS(=O)(=O)c1cc(Br)c(C)c([N+](=O)[O-])c1	743257112	QSFYKAALBQUALG-UHFFFAOYSA-N	425.261	1.195	50	20	IDGD	
CS(=O)(=O)Cc1ccc(S(=O)(=O)NNC(=O)c2cccc(Br)c2)cc1	743263598	HJKVUXCXZDUQNB-UHFFFAOYSA-N	447.332	1.617	50	20	IDGD	
CO[C@H](CNC(=O)NNC(=O)c1csc(N2CCOCC2)n1)c1cccc(Cl)c1	743509352	CCBNCFFTQGEMPT-OAHLLOKOSA-N	439.925	1.965	50	20	IDGD	
O=C(NCCCN1CCN(c2ncccn2)CC1)NNC(=O)c1cccc2ccccc12	743524635	YRLRRMOFKJLXNQ-UHFFFAOYSA-N	433.516	1.786	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)c2nn(-c3ccccc3)c3c2CCC3)cc1	744634788	IEPFMGNREPQJCB-UHFFFAOYSA-N	429.436	1.851	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)CCc2c(C)c3c(C)nn(C)c3[nH]c2=O)c1	744697627	IWVJUVNTQPHLSF-UHFFFAOYSA-N	439.472	1.124	50	20	IDGD	
C[C@H]1Cc2ccccc2N1CCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	744886822	HSRROGHJUMDSHJ-HNNXBMFYSA-N	445.545	1.332	50	20	IDGD	
O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)NNC(=O)c1cc([N+](=O)[O-])ccc1O	745647609	MKWOITXVOVYBIZ-UHFFFAOYSA-N	447.423	1.545	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12)c1cnn(C)c1	745835928	JPFAWPASGPLZDN-OAHLLOKOSA-N	445.483	1.884	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)N3CCOCC3)cc2)cc1	745992652	GOWSCZPKWVJBJT-UHFFFAOYSA-N	446.485	1.377	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2csc(-c3ccccn3)n2)cc1	747205974	HQPVHXFHQWOFLP-UHFFFAOYSA-N	445.526	1.595	50	20	IDGD	
Cc1c(C(=O)NNC(=O)CSc2ccc(Cl)cc2)cnc2c1c(=O)n(C)c(=O)n2C	747719862	XLOQRANKNQIQQV-UHFFFAOYSA-N	447.904	1.147	50	20	IDGD	
Cc1ccc(CNC(=O)C2CCN(CC(=O)NNC(=O)c3cccc(C#N)c3)CC2)cc1	747843451	AJWZYCDEPRWZQG-UHFFFAOYSA-N	433.512	1.656	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc(Br)ccc1F)c1ccc(-n2cnnn2)cc1	748690554	XSJQLKXYQQUHJV-UHFFFAOYSA-N	441.242	1.187	50	20	IDGD	
C[C@H]1CC(C)(C)CC[C@H]1NC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	748967241	JHLOVDVRYXPNIX-DOTOQJQBSA-N	438.598	1.859	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)[C@H](C(C)C)N1C(=O)c2ccccc2C1=O	750601734	XPQWHOOQFDFVEN-FQEVSTJZSA-N	439.468	1.932	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)N[C@@H]1CCN(c2cccc(Cl)c2)C1=O	750671326	QNCGROQOGRVZCO-CQSZACIVSA-N	433.808	1.703	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)c2cc(Br)ccc2n1	751062132	KKXOTQNAUSKCFN-JTQLQIEISA-N	426.292	1.501	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)c1ccc(S(=O)(=O)N2CCCCCC2)cc1	751211403	HKAMVNQTWYXOJQ-UHFFFAOYSA-N	448.501	1.035	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)[C@@H]2CCCCN2S(=O)(=O)c2ccc([N+](=O)[O-])cc2)o1	752780721	BKMCQWNNRQRIDL-HNNXBMFYSA-N	436.446	1.501	50	20	IDGD	
O=C(NNc1ccc(C(F)(F)F)nn1)[C@@H]1CS[C@H](Cc2ccccc2F)C(=O)N1	755183554	YJRBGKNXVDMFEL-NWDGAFQWSA-N	429.399	1.921	50	20	IDGD	
C[C@H](NS(=O)(=O)c1cnn(C)c1)C(=O)NNc1c(F)cc(F)cc1Br	755407034	LOSPMBDGENSOJL-ZETCQYMHSA-N	438.254	1.271	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)n([C@H]2CCS(=O)(=O)C2)n1	755530189	FUKZFISQUSBSGV-OCCSQVGLSA-N	439.469	1.310	50	20	IDGD	
COc1ccc(C(=O)N(C)C)cc1NC(=O)NNC(=O)c1cc(OC)c(OC)c(OC)c1	756123033	OMFBGYVVTNSXGC-UHFFFAOYSA-N	446.460	1.889	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)c2ccc3c(c2)OCCO3)c(OCC(=O)N(C)C)c1	756202874	MKKXFQVEGROCBQ-UHFFFAOYSA-N	428.445	1.700	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)c2cc(Br)c[nH]2)cc1NS(C)(=O)=O	756517752	USDDUDUNLMAMSL-UHFFFAOYSA-N	430.284	1.924	50	20	IDGD	
O=C(c1ccc(Cn2ccnc2)cc1)N1CCN(S(=O)(=O)CBr)CC1	758526923	CVPJRKJFRPAHRT-UHFFFAOYSA-N	427.324	1.371	50	20	IDGD	
N#C/C(=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)NC[C@H](O)C1CC1	759644248	QLTHTKGTMIXSCO-YHTSIIMFSA-N	427.892	1.873	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cnn(CCO[C@H]3CCCCO3)c2C)cc1C	759755989	CXNQACQZJJSWTG-IBGZPJMESA-N	443.504	1.751	50	20	IDGD	
CC[C@@H](OC1CCCCC1)C(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1	760264776	MYAZCDJSWATKHD-GOSISDBHSA-N	425.551	1.891	50	20	IDGD	
N#Cc1cccc(C(=O)NNS(=O)(=O)c2ccc(Br)c([N+](=O)[O-])c2)c1	760362993	OOEGBBVAODQDBS-UHFFFAOYSA-N	425.220	1.852	50	20	IDGD	
Cc1cn2ccnc(C(=O)NNC(=O)c3cccc(S(=O)(=O)N4CCCCC4)c3)c2n1	761392385	PWMUQFNNMHVZIA-UHFFFAOYSA-N	442.501	1.287	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(N2CCCC2)c(C(=O)NNC(=O)c2cc(C)[nH]n2)c1	763118119	BHSQLTVINXLLOR-UHFFFAOYSA-N	448.549	1.424	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)CSc2ccccc2O)ccc1OC	763410921	PCRVPQYQFCEVKO-UHFFFAOYSA-N	426.472	1.289	50	20	IDGD	
CC(C)(C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1	763442833	UERYLNMQSWFHDV-UHFFFAOYSA-N	427.417	1.523	50	20	IDGD	
CC(C)S(=O)(=O)c1ccccc1NC(=O)C(=O)NNC(=O)c1ccc2ccccc2n1	763454964	LHCOWCCLZXDAOY-UHFFFAOYSA-N	440.481	1.817	50	20	IDGD	
Cc1cc(Cl)ccc1OCCCC(=O)NNC(=O)C(=O)Nc1c2c(nn1C)CCC2	763499896	HIFIOJJBOCHBEG-UHFFFAOYSA-N	433.896	1.816	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)C(=O)Nc1cc(F)ccc1F	763532328	VJFQBHBXJHRELD-UHFFFAOYSA-N	431.443	1.263	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cccc(-n3cccc3)c2)cc(OC)c1OC	763544378	WYWNWZMJXBXHLK-UHFFFAOYSA-N	438.440	1.903	50	20	IDGD	
N#Cc1cccc(-c2csc(NC(=O)C(=O)NNC(=O)[C@H]3COc4ccccc4O3)n2)c1	763569711	AMAPNKXQMFXBJE-QGZVFWFLSA-N	449.448	1.608	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)Nc1cccc(Cl)c1-n1cccn1	763570580	GJJHWPHYQREGRG-INIZCTEOSA-N	441.831	1.452	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)N(C)C)c(C)c2)c2ccccc2n1	763614599	GTOAEJKUQIGAPW-UHFFFAOYSA-N	433.468	1.953	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(Cc3ccncc3)cc2)cc1	763663473	JFBQZKBRHWTPSB-UHFFFAOYSA-N	434.452	1.846	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C)c(C)c2)c(OC)c1OC	763665257	QHSNDUFXQAQDLG-UHFFFAOYSA-N	431.445	1.494	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(C(=O)OC)c(C)c1	763682961	XBWXSYGGLPOIGI-UHFFFAOYSA-N	429.429	1.345	50	20	IDGD	
COC(=O)NCc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)cc1	763694933	MBWDOBLHNUSONM-UHFFFAOYSA-N	434.836	1.361	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(OC[C@H]2CCCO2)cc1	763713230	MITKSAYGLBDOKN-LJQANCHMSA-N	441.484	1.972	50	20	IDGD	
CN(C)c1ccc(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)cc1Cl	763728022	HTTTUCWETYDKHX-UHFFFAOYSA-N	429.908	1.945	50	20	IDGD	
O=C(NNC(=O)c1cc2c(s1)CCC2)C(=O)Nc1ccccc1C(=O)N1CCOCC1	763783419	NVMBOAMXJAKHJE-UHFFFAOYSA-N	442.497	1.109	50	20	IDGD	
CCN(Cc1ccccc1NC(=O)C(=O)NNC(=O)COc1ccccc1C#N)C(C)=O	763807734	QZRBRIXZCKINFG-UHFFFAOYSA-N	437.456	1.092	50	20	IDGD	
CCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)c(C)c1	763841545	SNYDZCACGQCHDG-INIZCTEOSA-N	440.500	1.915	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cc(C#N)ccc2OC)cc1	763862468	XNXBBVVCZHHDNR-ZDUSSCGKSA-N	426.429	1.519	50	20	IDGD	
COC(=O)c1ccccc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccc(C(C)=O)cc1	763873700	XRKINRQDTHDAPU-ZDUSSCGKSA-N	427.413	1.229	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)C(=O)Nc1cccc(C#N)c1	763881572	GEVJFJDJSYUEGC-LLVKDONJSA-N	431.246	1.874	50	20	IDGD	
COC(=O)c1cc2cc(NC(=O)C(=O)NNC(=O)c3cc(Cl)ccc3O)ccc2o1	763978651	NJVZCNGDACVWLX-UHFFFAOYSA-N	431.788	1.978	50	20	IDGD	
N#Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1C(F)(F)F	764004238	NNAKDDNUTPRCFR-UHFFFAOYSA-N	434.330	1.748	50	20	IDGD	
CCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c(C)c1	764342101	AQRUKJBGOZMZSF-UHFFFAOYSA-N	434.456	1.330	50	20	IDGD	
COC(=O)[C@@H](C)Cc1ccc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1	764350401	FGLAPJDIIHMEND-HNNXBMFYSA-N	449.467	1.624	50	20	IDGD	
CCN(CC)C(=O)c1ccccc1NC(=O)C(=O)NNC(=O)CSc1ccccc1O	764393928	KYNVQHCWYHSTQK-UHFFFAOYSA-N	444.513	1.752	50	20	IDGD	
CCOC(=O)c1cc(CC)sc1NC(=O)C(=O)NNC(=O)c1cncc(NC(C)=O)c1	764433111	KCLIHQPLXBNOEG-UHFFFAOYSA-N	447.473	1.240	50	20	IDGD	
CCOCCCN1CCC(=NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)[C@@H](C)C1	764826886	CCOMDXYRCLGUBE-FQEVSTJZSA-N	443.592	1.685	50	20	IDGD	
C[C@@H](Cc1ccc(F)c(Br)c1)C(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1	765070418	IYJQDWQMKVUAEL-ONGXEEELSA-N	436.303	1.284	50	20	IDGD	
O=C(CCC/N=C1/NS(=O)(=O)c2ccccc21)NNC(=O)CSc1ccccc1O	765247302	BBODFNGQOMDAEA-UHFFFAOYSA-N	448.526	1.151	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)[C@@H]1CCN(c2ccc3c(c2)OCCO3)C1=O	765250683	HNEHMWSPSBIODO-AWEZNQCLSA-N	443.481	1.456	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc([N+](=O)[O-])c3cccnc23)c1	765531793	ZEWWMNVRKRYEPO-UHFFFAOYSA-N	443.441	1.468	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)c2ccc(C(=O)NNC(=O)c3cc(C)[nH]n3)cc2)cc1	765586259	QLLSBKCOYZYEIW-UHFFFAOYSA-N	427.486	1.926	50	20	IDGD	
CCn1c(=O)c(=O)[nH]c2cc(C(=O)NNC(=O)c3cc(-c4ccc(F)cc4)[nH]n3)ccc21	765617109	SDYARKVWXDRXIS-UHFFFAOYSA-N	436.403	1.314	50	20	IDGD	
COc1cc(OC)cc(C(=O)Nc2ccc(C(=O)NNC(=O)c3cc(C)[nH]n3)c(O)c2)c1	768274171	PLDAFEKWYLDYGL-UHFFFAOYSA-N	439.428	1.768	50	20	IDGD	
CO[C@H](c1ccc(F)cc1)[C@@H](C)NC(=O)NNC(=O)c1csc(N2CCOCC2)n1	770754938	YBAUPZXFXKLCDP-WBMJQRKESA-N	437.497	1.839	50	20	IDGD	
CC(=NNC(=O)N[C@H]1CCS(=O)(=O)C1)c1ccc(OC[C@H]2CCCCO2)c(F)c1	771099915	HKSNMCVFOMTRFR-JKSUJKDBSA-N	427.498	1.984	50	20	IDGD	
C#CCOc1ccccc1NC(=O)C(=O)NNC(=O)c1ccc(OC)c(Br)c1	773496788	OETMULDBDYTMGV-UHFFFAOYSA-N	446.257	1.869	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)C(=O)Nc1cc(C(F)(F)F)ccn1	773531397	MDYWEHSQROPWTN-UHFFFAOYSA-N	434.334	1.391	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(I)cn2)cc1F	773581622	ZQKLMELENGCEDL-UHFFFAOYSA-N	442.188	1.533	50	20	IDGD	
Cc1nn(C)c2sc(C(=O)N[C@@H](C)C(=O)NNc3cccc(S(C)(=O)=O)c3)cc12	776528425	UVETZNQPRSAVIY-NSHDSACASA-N	435.531	1.608	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)[C@@]2(F)CCN(C(=O)OCc3ccccc3)C2)c1O	776972182	KVRHPDSMMFNLAI-OAQYLSRUSA-N	431.420	1.913	50	20	IDGD	
O=C(c1ccc(Cl)cc1[N+](=O)[O-])N1CCN(S(=O)(=O)CBr)CC1	777779476	MPQOCLQDLJGENO-UHFFFAOYSA-N	426.676	1.688	50	20	IDGD	
Cc1c(C(=O)NNC(=O)CNC(=O)OC(C)(C)C)nnn1-c1cccc2cnccc12	778441589	MPRGSTQKKVSDDN-UHFFFAOYSA-N	425.449	1.410	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)/C=C/C(=O)Nc2ccc3n[nH]cc3c2)c2ccccc2c1=O	778526860	BVSQZNNLOOHPMY-MDZDMXLPSA-N	445.439	1.249	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)Nc2ccccc2OCC(=O)N2CCOCC2)c1	780584524	NZIDRCNKHZMYBQ-UHFFFAOYSA-N	428.445	1.859	50	20	IDGD	
COc1ccc(C[C@@H](C)C(=O)N2CCN(S(=O)(=O)CBr)CC2)cc1OC	781357120	YKFVXPXISVGVKI-CYBMUJFWSA-N	449.367	1.709	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)cnn1-c1ccccc1	782893904	OOLLWKWQWHRCKC-UHFFFAOYSA-N	431.456	1.396	50	20	IDGD	
CCn1cnnc1-c1cccc(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)c1	782894116	LSSILFLZSSINBA-UHFFFAOYSA-N	446.471	1.180	50	20	IDGD	
CC(C)n1nnnc1-c1ccccc1NC(=O)C(=O)NNc1ccc(S(C)(=O)=O)cc1	783071106	FAUBOYCWQLYWIY-UHFFFAOYSA-N	443.489	1.406	50	20	IDGD	
Cc1ccccc1NC(=O)NNC(=O)C(=O)Nc1ccc(CCN2CCOCC2)cc1	783417452	SREWBNXAJZIOCF-UHFFFAOYSA-N	425.489	1.661	50	20	IDGD	
Cc1cc(F)ccc1NNC(=O)C(=O)Nc1ccc(OCCN2CCN(C)CC2)cc1	783444107	DKQQPXZYEUPORG-UHFFFAOYSA-N	429.496	1.842	50	20	IDGD	
COC(=O)[C@H](Cc1ccc(Cl)cc1)NNC(=O)c1sc(N2CCOCC2)nc1C	783569375	FMBIBBAMCBNWCP-HNNXBMFYSA-N	438.937	1.960	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2ccc(OCC(F)F)cc2)c1	783809907	HILDNHNXNKGHKZ-UHFFFAOYSA-N	434.442	1.357	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1ccc(Cc2ccncc2)cc1	784003969	BBICQLPIAJCRLG-UHFFFAOYSA-N	437.481	1.250	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1ccc(F)cc1OC(F)F	784004632	ZFAKOYSPOTZFCO-UHFFFAOYSA-N	430.364	1.005	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)cc1C	784230608	OOEQEOMZOWCJFJ-UHFFFAOYSA-N	445.545	1.321	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)c(OC)n1	784835249	KAUGBJHSSCJAAL-UHFFFAOYSA-N	430.389	1.177	50	20	IDGD	
CC(C)N(C)S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2cc(Cl)ccn2)cc1	784856057	DQURRFPJIIQHMN-UHFFFAOYSA-N	425.898	1.846	50	20	IDGD	
Cc1cc(C)n2nc(NC(=O)NN(C)C(=O)N3CCN(C(=O)OC(C)(C)C)CC3)nc2n1	785539711	ABLCXEJXMDXBJK-UHFFFAOYSA-N	447.500	1.382	50	20	IDGD	
CN1CCN(C(=O)NNC(=O)[C@H]2CCCN(C(=O)c3ccc(Cl)c(Cl)c3)C2)CC1	788165455	BYMKPYHDNZUDKS-AWEZNQCLSA-N	442.347	1.834	50	20	IDGD	
CS(=O)(=O)c1cc(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)ccc1Cl	788332133	XKXTVFNQNOKXQT-UHFFFAOYSA-N	443.840	1.048	50	20	IDGD	
O=C1COc2ccc(C=NNC(=O)c3cccc(S(=O)(=O)N4CCCCC4)c3)cc2N1	788697801	IRUAMDUFORXMCL-UHFFFAOYSA-N	442.497	1.956	50	20	IDGD	
Cc1nc(C)c(S(=O)(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)s1	788914951	HTWQHHAJYWMTQO-UHFFFAOYSA-N	433.556	1.558	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)NC[C@@H](Cc1cccc(F)c1)C(=O)N1CCOCC1	789309907	INLYVJMUCDHGRA-GOSISDBHSA-N	442.491	1.796	50	20	IDGD	
COc1ccc(CC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)nc1	789866783	CZMRTKLVIJFJDN-UHFFFAOYSA-N	432.502	1.269	50	20	IDGD	
CO[C@H]1CCOc2c(NC(=O)C(=O)NNC(=O)COc3cc(C)ccc3C)cccc21	790952133	OOTFEMVUJFKTSX-KRWDZBQOSA-N	427.457	1.938	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)c2cc3c(C(F)F)nn(C)c3s2)c2ccccc2c1=O	792015513	BQEPUWKIIYSTEB-UHFFFAOYSA-N	432.412	1.894	50	20	IDGD	
Cc1cc(C(=O)N2CCC[C@@H](C)C2)ccc1NC(=O)C(=O)NNc1nc2ccccn2n1	792392124	SKSDLLSTNZHALZ-CQSZACIVSA-N	435.488	1.992	50	20	IDGD	
CN(C)N(C(=O)c1cccc(NS(=O)(=O)c2cccs2)c1)[C@@H]1CCS(=O)(=O)C1	792856252	XJAYFSMIFDUWLA-OAHLLOKOSA-N	443.572	1.655	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2nc3ccccn3n2)n(-c2nc3ccccc3s2)n1	793056769	VMDZVJGZDUQMRV-UHFFFAOYSA-N	433.457	1.915	50	20	IDGD	
CCOC(=O)c1ccc(NNC(=O)[C@](C)(O)CN2C(=O)NC3(CCCC3)C2=O)cc1C	794647462	SWELHLJZGFBGDM-HXUWFJFHSA-N	432.477	1.230	50	20	IDGD	
Cc1nnnn1/C(=C/c1ccccc1)C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	794730227	LEGLFJDOIHRDOG-QGOAFFKASA-N	427.490	1.373	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)c1ccc2c(=O)n3c(nc2c1)CCC3	795168677	BOYLZQVLOHDLQQ-UHFFFAOYSA-N	427.486	1.350	50	20	IDGD	
C=CCNC(=S)NNC(=O)c1ccccc1NS(=O)(=O)c1ccc2c(c1)OCCO2	798307384	RETGRFMNNQPONV-UHFFFAOYSA-N	448.526	1.554	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@H]2CCCN2c2ccc(C#N)cc2)cc1	802066589	ZYDQARZOFVYOCB-GOSISDBHSA-N	427.486	1.783	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)NC[C@@H]2CCCS(=O)(=O)C2)cc1Cl	806040455	ITLKGIVZDBFYEK-JTQLQIEISA-N	434.902	1.518	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)Nc1cccc(S(=O)(=O)N2CCCCC2)c1	806099941	WOZCLIYGOJDHFW-UHFFFAOYSA-N	442.505	1.986	50	20	IDGD	
CN(C)c1cc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)ncn1	810221201	MJYDOFNUFJHGBC-UHFFFAOYSA-N	447.521	1.184	50	20	IDGD	
Cc1nn(-c2ccccc2)c2sc(C(=O)NNC(=O)NCc3nc(N(C)C)no3)cc12	812217763	BGWJSSVEIUJVKR-UHFFFAOYSA-N	440.489	1.989	50	20	IDGD	
CCOC(=O)c1ccc(NNC(=O)CNS(=O)(=O)c2c(F)cccc2F)cc1C	812719222	FYNJTWWXLPDLNR-UHFFFAOYSA-N	427.429	1.872	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)[C@]2(F)CCN(C(=O)OC(C)(C)C)C2)cc1	812729615	QEQQHQQCCFOBLC-SFHVURJKSA-N	430.502	1.729	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccc(O[C@H]3CCOC3)cc2)cc1	813033525	XQGMJJDNGAGHRE-KRWDZBQOSA-N	448.501	1.186	50	20	IDGD	
CCNC(=O)COc1cccc(NC(=O)NNc2ccccc2S(=O)(=O)N(C)C)c1	814554930	OLAYGROQMYFDQG-UHFFFAOYSA-N	435.506	1.600	50	20	IDGD	
CCC(=NNC(=O)N[C@@H]1CCS(=O)(=O)C1)c1ccc(OCCCCC(=O)O)cc1	814814689	VVFRKKHYPKKGLM-OAHLLOKOSA-N	425.507	1.921	50	20	IDGD	
NS(=O)(=O)c1ccc(NC(=O)NN=Cc2ccc(OC(F)(F)C(=O)O)cc2)cc1	814964519	XDWFNUSLFUVNTQ-UHFFFAOYSA-N	428.373	1.546	50	20	IDGD	
COCc1cc(NC(=O)C(=O)NNC(=O)c2ccc(OC)c(OC)c2)cc(C(=O)OC)c1	815563984	UJWMTCQBFBXQSP-UHFFFAOYSA-N	445.428	1.037	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCc2nncn2C1)C(=O)Nc1ccccc1N1CCCCCC1	815693111	MGDKOFSTIHCVRN-OAHLLOKOSA-N	425.493	1.007	50	20	IDGD	
CC(C)(C)c1n[nH]cc1C(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	815827537	DNLGRXLOTYHTJV-UHFFFAOYSA-N	432.956	1.939	50	20	IDGD	
Cc1ncc(S(N)(=O)=O)cc1C(=O)NNC(=O)c1ccc(-c2ccc(F)cc2)s1	816830254	XURRQJSQZUTAFZ-UHFFFAOYSA-N	434.474	1.980	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc2c(c1)OCCCO2)NNc1cccc(Cl)n1	817006842	BSBURDDDXRODSR-UHFFFAOYSA-N	426.882	1.708	50	20	IDGD	
COc1ccc(N2C(=O)/C(=C/NNC(=O)c3cnccn3)c3ccccc3C2=O)cc1OC	818235362	NWEADIHVLILWTL-SFQUDFHCSA-N	445.435	1.956	50	20	IDGD	
COc1ccc(CCC(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1Cl	818375969	WYUHKURZUHZCGK-SFHVURJKSA-N	448.859	1.812	50	20	IDGD	
CC(=O)N[C@H](CC(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)c1cccs1	829359527	JUKWDEZQAGUUDZ-CQSZACIVSA-N	434.430	1.228	50	20	IDGD	
O=C(COC(=O)c1ccc(OC[C@@H]2CCCO2)cc1)NNC(=O)c1cccc([N+](=O)[O-])c1	844160143	KZQCFUQDDOYGJI-SFHVURJKSA-N	443.412	1.771	50	20	IDGD	
O=C(c1ccc(Br)c(F)c1)N1CCC[C@@H](C(=O)N2CC[C@@H](B(O)O)C2)C1	864231073	IRSCBWYUPJKHQM-CHWSQXEVSA-N	427.079	1.516	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)c1cccc(OCC(N)=O)c1	912988913	TZXRCXYFYDIJNF-NSHDSACASA-N	436.262	1.542	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)N1CCCN(C(=O)c2ccc(F)cc2)CC1	913463192	VCHPYKJZZORLCT-UHFFFAOYSA-N	438.463	1.984	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)NNC(=O)c1ccc(F)c(S(=O)(=O)NC2CC2)c1	914595705	KCEFVRCBKWSRES-UHFFFAOYSA-N	430.461	1.751	50	20	IDGD	
CCCn1nc(C(=O)NN=C(C)c2ccc(S(=O)(=O)NC)cc2)c2ccccc2c1=O	916319106	DUUODDNAYKTPNR-UHFFFAOYSA-N	441.513	1.869	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1C	916561771	DKFVOXKIDRTUNS-UHFFFAOYSA-N	444.513	1.488	50	20	IDGD	
CCOC(=O)N[C@@H](CNC(=O)NNC(=O)c1nn(-c2ccccc2)cc1O)CC(C)C	916632626	YDCLSWXSAJUBON-CQSZACIVSA-N	432.481	1.683	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NC[C@]1(N2CCOCC2)CCSC1	916636877	NWAOBLGYMAEWGX-AUUYWEPGSA-N	426.514	1.131	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)CN3C(=O)N[C@]4(CCCC[C@@H]4C)C3=O)n[nH]2)cc1	917175682	HSKQOCRMFOKHQZ-FPTDNZKUSA-N	438.488	1.647	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@@H](C(=O)NNC(=O)c3ccc(Cl)nc3)C2)s1	917253333	DQWKMHGXUCNZCT-CYBMUJFWSA-N	442.950	1.967	50	20	IDGD	
Cc1nn(-c2ccccc2)c2nc(C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)ccc12	918398611	ASBIVJTXQSMVBC-UHFFFAOYSA-N	439.439	1.779	50	20	IDGD	
COc1ccc(Cl)cc1N1C[C@H](C(=O)NNC(=O)c2cccc(OC)c2O)CC1=O	919756681	HQRZWCKDHGYLPL-LLVKDONJSA-N	433.848	1.877	50	20	IDGD	
CN(NC(=S)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1)C(=O)OC(C)(C)C	920075584	FVFVFRSIAZLKFM-UHFFFAOYSA-N	430.552	1.776	50	20	IDGD	
O=C(NN=Cc1cnn(-c2ccc(Br)cc2)c1)N[C@H]1CCS(=O)(=O)C1	920379407	VYMUIBKHZMEPIP-ZDUSSCGKSA-N	426.296	1.455	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCC2CC2)cc1S(=O)(=O)N1C[C@@H](C)C[C@@H](C)C1	920859254	RAXZCNOIEMSTKF-OKILXGFUSA-N	438.550	1.716	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2cc(S(C)(=O)=O)ccc2Cl)c2ccccc2c1=O	933463023	ANUDMQVOILQPFW-UHFFFAOYSA-N	448.888	1.548	50	20	IDGD	
COCCN1CCC(NC(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)CC1	1116090409	PSUKCKMDNCPZPO-UHFFFAOYSA-N	427.546	1.075	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)NCc2c(F)cccc2NS(C)(=O)=O)cc1	1116244712	AWGGAOKBQJGBNA-UHFFFAOYSA-N	438.481	1.669	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(-n3cccn3)c(F)c2)c1	1318281677	OXRLNKGURYOXCT-UHFFFAOYSA-N	431.449	1.337	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2cccc(N3CCNC3=O)c2)c2ccccc2c1=O	1319356130	BKPFWIKHFGDVKM-UHFFFAOYSA-N	434.456	1.411	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)N[C@@H]2CCN(c3ccccn3)C2)CC1	1320119861	GMGVGNOZZYLCIZ-MRXNPFEDSA-N	432.525	1.638	50	20	IDGD	
O=C(NNc1ccc2c(=O)[nH]ccc2c1)NC1CCN(S(=O)(=O)C2CCOCC2)CC1	1322957042	WSQPNIGQFJMRHU-UHFFFAOYSA-N	449.533	1.127	50	20	IDGD	
C[C@@H](O)CNS(=O)(=O)c1ccc(C(=O)NNC(=O)Cc2cccc3ccccc23)cc1	1335672383	DLWMVZOBSAVYBC-OAHLLOKOSA-N	441.509	1.503	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(OC)cc(OC)c3)C2)C1	1780663272	BLBARBBNVBVDDI-YLJYHZDGSA-N	426.897	1.401	50	20	IDGD	
C[C@@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Br)C1)C1(O)CCC1	1780770271	KKGZVVWMVYRQMI-ZOMKSWQUSA-N	435.334	1.742	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc[n+]([O-])cc1)C2)[C@@H](F)Br	1780773641	KFLAXWMGNLHFDA-CKEIUWERSA-N	430.274	1.138	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc4ncnn4c3)CCO2)C1	1781229318	BTMXVUYARLNQBB-ZWKOTPCHSA-N	426.304	1.409	50	20	IDGD	
CC(C)N1CCC(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)CC1	1781325490	DPUXQDHUUDDFBD-CRAIPNDOSA-N	434.350	1.627	50	20	IDGD	
O=C(c1c[nH]c2cnccc12)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781331936	SIBQDIBYDTZXOR-PBHICJAKSA-N	425.258	1.697	50	20	IDGD	
Cc1nn(C)c(C)c1CC(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781333547	FTQXJKZGHWCXCQ-RDJZCZTQSA-N	431.306	1.100	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)cc1	1781333969	IXSTWWBRKGBZSP-QAPCUYQASA-N	442.285	1.779	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@H](C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)C1	1781334171	MPSFIQWCCIRRRM-LWGWVAHUSA-N	449.317	1.486	50	20	IDGD	
Cc1nccc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](C)Br)C2)n1	1781999235	TYVPQFNRAISGPR-CDHAZOANSA-N	425.327	1.696	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc3n(n1)CCCO3)C2	1782176057	WTHGEXOWKUPMHS-AKCHCHLHSA-N	440.928	1.047	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](Cl)COC)C1	1782179259	ITSHFACOWAGDED-VMUDFCTBSA-N	439.778	1.928	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(C#N)c1)C2	1782212141	JSBRASBKETZEIP-AUSIDOKSSA-N	441.532	1.059	50	20	IDGD	
O=C(c1c[nH]c2c(Cl)cccc12)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1782451530	WYEJXPCZWOPUCA-KXBFYZLASA-N	426.300	1.865	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](C)Nc1nccs1)CCO2	1783347771	ONOCVDRWGWLFKX-DCGLDWPTSA-N	445.383	1.947	50	20	IDGD	
COc1nccc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](C)Br)C3)C2)c1F	1783532033	CAWPUDIIKPLZTF-DIFFPNOSSA-N	430.274	1.456	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cc(C(C)(C)C)n[nH]3)CCO2)C1	1783536721	IPJQRYSBKCSJGL-KPZWWZAWSA-N	427.343	1.934	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H]1[C@H]3c4ccccc4S[C@H]31)CCO2	1783877963	SQUOKXPJKWYJCH-OTXHSEFHSA-N	436.961	1.958	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1sccc1Cl)CCO2	1783934527	CMPQRQYUDIGKDG-GOSISDBHSA-N	428.942	1.218	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc[nH]n3)[C@H]2C1	1784683429	SOVLBYARZGAHOH-GOFCJJFNSA-N	441.438	1.888	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ncc(F)cc3F)[C@H]2C1	1784765736	NKGOURJDXHHOGR-MPXAEWJHSA-N	446.292	1.984	50	20	IDGD	
Cc1nc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)Br)C[C@@H]32)ccc1F	1785626814	FAPKFILFOOONER-LESCFKLSSA-N	428.302	1.906	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC1(c2ccc(NC(=O)[C@@H]3CCCCN3C)cc2)CCC1	1786153051	HBZUDKQATUUKHO-IBGZPJMESA-N	429.565	1.978	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(=O)oc3)[C@H]2C1	1786280310	IHAXEKMGVNEWLJ-MXAVVETBSA-N	427.295	1.407	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cn3cc(Cl)cn3)[C@H]2C1	1787003145	CXUKFHPYSIAKNG-PLNCSYRRSA-N	437.755	1.753	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC1(c2ccc(NC(=O)c3ccnnc3)cc2)CCC1	1787314750	YVPFXBWUAPSTHI-UHFFFAOYSA-N	431.456	1.537	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CC(=O)Nc3cc(C)on3)[C@H]2C1	1787489492	KFAKJIJORFYSAU-JONQDZQNSA-N	440.928	1.699	50	20	IDGD	
N[C@H](C(=O)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1)c1ccccn1	1788039987	AMKPOXKPJNPYCY-NRFANRHFSA-N	444.300	1.209	50	20	IDGD	
C[C@]1(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)CC=CCC1	1788610936	FNJNWOYBPVWZCT-RJZVVRIISA-N	441.532	1.025	50	20	IDGD	
COc1nc(C)ccc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)Br)C[C@@H]21	1789015635	BKGJITWFMGLHDY-SDADXPQNSA-N	440.338	1.775	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3c(O)cc(O)cc3O)C[C@@H]21	1789872198	MNZPZFSNWRFOLF-AVGHVZBRSA-N	447.315	1.633	50	20	IDGD	
COc1ccc(F)c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Cl)C[C@@H]32)c1OC	1790160225	PRGNJZOGCYVMGE-BQNZHIODSA-N	432.851	1.971	50	20	IDGD	
N#Cc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](O)CCl)C[C@@H]32)c(Cl)c1	1790228356	SHNIVMFQRAQSMI-SDNTUTLCSA-N	426.300	1.405	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3sccc3Cl)C[C@@H]21	1791291461	VQIAYNKTXSBKIO-YDHLFZDLSA-N	442.969	1.368	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CC(c4ccccc4)=NO3)C[C@@H]21)C(Cl)Cl	1791292448	DORCXIVBGREJNO-OTRWWLKZSA-N	440.327	1.963	50	20	IDGD	
Cc1ccc(C)c(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]3C2)c1	1791293367	ZRQWHSJOOWKLTB-JBACZVJFSA-N	444.576	1.199	50	20	IDGD	
C[C@H](Br)C(=O)Nc1ccc(C2(NC(=O)C[C@@H]3NC(=O)NC3=O)CCC2)cc1	1791432326	VUWUZEPGZJZIGY-GWCFXTLKSA-N	437.294	1.502	50	20	IDGD	
Cc1noc(N)c1C(=O)NC1(c2ccc(NC(=O)CCC(=O)NN(C)C)cc2)CCC1	1791600263	WBCMANBOJFCJOH-UHFFFAOYSA-N	428.493	1.686	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCN3CCCC3)[C@H]2C1	1792314589	XXRNDIOGMHKOQF-NXOAAHMSSA-N	430.387	1.626	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C(C)(C)CCl)C1	1792785652	NSBNEOGNCYVILW-NNXHMXCWSA-N	428.957	1.820	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)COC1CCCCC1	1792786208	AXUYNKKYHOFFFN-AFIMGQEJSA-N	431.371	1.956	50	20	IDGD	
COc1ccccc1C(=O)N1CC(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](O)CCl)C3)C1	1792907364	GPQKXOFVQBLIDC-KYHPRHEASA-N	449.935	1.005	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCc1cc(F)ccn1	1794297633	JTOVQVHBHAUISP-BJWYYQGGSA-N	440.479	1.104	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1c(C(C)C)nn2ccccc12	1796086209	ZQKYDLQHMHSCTI-UIVXKWKOSA-N	448.951	1.915	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)c1nc(Cl)ccc1F	1796188295	MWEQBFAJRRFJQM-QDMKHBRRSA-N	431.660	1.120	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2cnccc2n1	1796892890	DODQLSWXNRNYSI-CWPLJXCYSA-N	428.565	1.685	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnc2cc(C)ccn2c1=O	1797065858	VERUHNQMPHEROC-LORHWOILSA-N	446.935	1.614	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3cccnc3nc1O)C2	1797957679	XPJBTZFOMGDZMZ-JLVBRIDZSA-N	444.564	1.390	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(Cl)cn1	1798063726	PSOQGRCEJJDZJQ-OHTBPHCPSA-N	430.730	1.969	50	20	IDGD	
CC#CC[C@@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(B(O)O)cc1)C2)c1ccccc1	1798553640	QUHVIVZQEFVUBX-UEQSERJNSA-N	444.340	1.815	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2c(c1)NC(=O)[C@H](C)O2	1798582527	GKTWJCYKZYAOLY-HMZURLEKSA-N	435.908	1.627	50	20	IDGD	
Cc1nnc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@](C)(Cl)CCl)s1	1799274012	ORRQMOFLJFBDON-DJZPMSPPSA-N	435.377	1.605	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc3c(c1)CCO3)C2	1799279820	UIJVDJLCHPQGSL-NNNWTRQLSA-N	441.355	1.990	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(C(F)(F)F)cc1)c1ccc(B(O)O)cc1	1799705239	UWOJMCGZLJKBFF-REPLKXPHSA-N	446.234	1.951	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](O)CCl)C3)C1	1800019216	FZCIHMVTAJDBRG-KSWRQPAISA-N	443.972	1.871	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2ccnn2c1	1800026493	RKHGODLTXJIKPZ-MVWRLGRASA-N	425.316	1.774	50	20	IDGD	
COc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](F)Br)n1	1800159253	FYJOUPGTCKGQOX-JIXVBMEVSA-N	445.245	1.941	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(NC(=O)OC)c1)C2	1800977773	YHPWEYPEXCXSLG-FSDCSDTHSA-N	439.896	1.322	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1=NO[C@H](c3ccccc3)C1)C2)C(Cl)Cl	1801014993	XCVZQLPUQQUAET-XRGAULLZSA-N	426.300	1.897	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CCc2nc[nH]c2C1	1801268919	OONWOPIWWCCHDQ-NUFHUAHKSA-N	429.348	1.341	50	20	IDGD	
CCOC(=O)N[C@H](O)C(=O)N1CC[C@H](CNC(=O)C(C)(C)CCl)[C@H]1c1cccnc1	1802900632	CALCATQSINCROU-BZUAXINKSA-N	440.928	1.417	50	20	IDGD	
CN(C)c1ccncc1C(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]1c1cccnc1	1803140534	FDXAXAYRQYOHFS-LZQZEXGQSA-N	431.924	1.462	50	20	IDGD	
C=CCSCC(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1804176778	SLQHJSAQNNMZLY-UTKZUKDTSA-N	433.578	1.380	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1ccsc1	1805419004	BDPDBYITYPTUPJ-FXAWDEMLSA-N	435.314	1.456	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1807366948	WEIFCVKCJSMYDZ-IHPCNDPISA-N	443.740	1.489	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)Cc2cccs2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1	1807370892	MUFIVUBMWXSWOR-GCJKJVERSA-N	449.341	1.385	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)C2CCCCC2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1	1807371755	ZOUNXEKZWVGLMP-IRLDBZIGSA-N	435.333	1.661	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)N2CCN(C)CC2)[C@H]1c1cccnc1	1808273583	DKFBCSYVUCFNNY-GTAWCEEGSA-N	436.000	1.741	50	20	IDGD	
CC(=O)N(C)CCC(=O)N1CC[C@H](CNC(=O)[C@@H](F)Br)[C@H]1c1cccnc1	1808652574	YRQPMXWBLJGCBO-DJIMGWMZSA-N	443.317	1.646	50	20	IDGD	
Cc1nscc1C(=O)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1	1809975111	UEBINFXLZNMTIE-UHFFFAOYSA-N	427.335	1.290	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H](CNC(=O)[C@H](C)n2ccnn2)[C@@H]1c1cccnc1	1812394505	AXAGOMYOMPKIAH-WTTBNOFXSA-N	449.353	1.971	50	20	IDGD	
CC(C)(CCl)C(=O)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1	1815350274	NWCRNFGYQIMPEK-ZDUSSCGKSA-N	435.742	1.314	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)CNC(=O)c3ccco3)sc2C1	1815655973	IZUQHDWVURJYIX-GHMZBOCLSA-N	440.909	1.332	50	20	IDGD	
CC(C)n1cnc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)n1	1818296037	MIEXVHGADOXZFC-HNNXBMFYSA-N	445.528	1.261	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)CCN3CCOC3=O)sc2C1	1818696915	BBRZCRCTKQXQAQ-VHSXEESVSA-N	445.339	1.681	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)C2=NNC(=O)C2)n[nH]1	1819344461	WSXKYELHYAUNRM-JOYOIKCWSA-N	425.287	1.451	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](O)N2CCOCC2)n[nH]1	1819442207	XAQVFYROBDYWIU-ZUEVXXBESA-N	427.933	1.460	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](O)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](F)Cl)[nH]n1	1821218835	JFXKQQKWQQZRDH-SCDSUCTJSA-N	433.868	1.779	50	20	IDGD	
CCOc1ccc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@H](O)CCl)CC3)nn1	1821750195	QEQLUBFYQDTUMF-JOYOIKCWSA-N	425.898	1.157	50	20	IDGD	
CC(=O)C[C@H](C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1822335452	JKFSMCPCXRTOOM-UGSOOPFHSA-N	426.282	1.011	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CNC(=O)C(F)(F)F)[nH]n1	1822375044	RTYYGCGRYSRGNM-KOLCDFICSA-N	439.822	1.334	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCc2cccnc2)[nH]n1	1822414716	YWRZDSKTFAQOIC-SFHVURJKSA-N	441.536	1.803	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(O)nc2)[nH]n1	1822415096	SLGMPMREOKGKNO-OAHLLOKOSA-N	429.481	1.189	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1c[nH]c(=O)cn1)CC2	1822867979	PXAFCOPQUOBNOB-BCTVWOGZSA-N	430.317	1.689	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)/C=C/c2cnccn2)n[nH]1	1822875528	XCPGUYOGCXAQDV-DKRLNXSXSA-N	440.508	1.278	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H]2CCCS2)n[nH]1	1823010725	IFELMYCZRMEKSH-HZPDHXFCSA-N	443.533	1.610	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccnc2)CC1	1825822171	NFMJKTULRZHDTP-HXUWFJFHSA-N	436.516	1.627	50	20	IDGD	
O=C(Cc1ccccc1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827051249	QLMPYYDBNKQWCK-QHCPKHFHSA-N	434.345	1.842	50	20	IDGD	
CC(C)(C)[C@@H](O)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1	1830631563	YVLAQXPZNBSWQB-DOPJRALCSA-N	425.353	1.086	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H](O)c2ccccc2)CC1	1831871116	LWRMKPIEGFOVPZ-NFBKMPQASA-N	444.576	1.713	50	20	IDGD	
Cc1onc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)c1C	1831871529	UIEQSSINAVJKNN-SFHVURJKSA-N	433.553	1.898	50	20	IDGD	
COc1nn(C)cc1C(=O)N1CCC(N2CCC(NC(=O)C(C)(C)CCl)CC2)CC1	1833212209	QKBYOHNDUKHDOB-UHFFFAOYSA-N	439.988	1.879	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](C)CBr)C3)C2)on1	1834218248	SMQNLBRXJIACEQ-YVEFUNNKSA-N	430.299	1.084	50	20	IDGD	
Cc1cccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)c1	1835042379	OMOCWKBLOMNMHQ-MJGOQNOKSA-N	443.313	1.684	50	20	IDGD	
Cc1n[nH]c(C)c1C(=O)NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1	1835870287	TZWJUVUESGQMNJ-UHFFFAOYSA-N	440.386	1.997	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)C(C)(C)NCCC#N)CC2)CC1	1836396223	ZGXDBKRPLHACIM-GOSISDBHSA-N	426.005	1.857	50	20	IDGD	
COC(=O)NCC(=O)N1CCC(OC2CCN(C(=O)[C@@H](C)CBr)CC2)CC1	1836674030	MHFTYCGTQQXGFT-ZDUSSCGKSA-N	448.358	1.372	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)COc3ccccc3)C2)C1	1837712234	KPXKHBMKUZFMHD-NRFANRHFSA-N	436.581	1.373	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc(Cl)s3)C2)C1	1837715266	GBGXZHIHFKLCIN-QGZVFWFLSA-N	448.017	1.718	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccn(C(F)F)c3=O)CCO2)C1	1837772112	LJXADDYIPZHNGZ-AUUYWEPGSA-N	447.866	1.331	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1c(F)cccc1F)CCO2	1838863026	BNHFMRVWNAUXRM-HXUWFJFHSA-N	442.535	1.886	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(C#N)cc3)C2)C1	1839154216	GYMXJQXFTHGEMS-VQTJNVASSA-N	440.327	1.865	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)c1ccc(O)cc1)CCO2	1839171331	SDTWOLAILRBRDI-YWMUFLPLSA-N	440.924	1.206	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3c4c(nn3C)CCC4)CCO2)C1	1839581105	DLWAGBZYGOOKAB-HRAATJIYSA-N	438.956	1.386	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3F)C2)C1	1839964683	YZUOXBPTKSBDEB-KSSFIOAISA-N	444.301	1.464	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3C[C@H]4CC[C@@H]3O4)C2)C1	1839966711	NVMYMEQBFNCHPP-MZZPOWALSA-N	445.354	1.184	50	20	IDGD	
CCc1ncccc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2	1840031555	UETWXCIZSYJTGU-KUHUBIRLSA-N	440.338	1.497	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CCc3ccccc3O1)CCO2	1840137996	FVTGPRWZVJBXQN-LRXVAGHRSA-N	436.936	1.854	50	20	IDGD	
O=C(c1ccc2c(c1)COC2)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840188675	WTIJPIKVSZJOMA-IBGZPJMESA-N	429.300	1.591	50	20	IDGD	
C[C@H](Sc1ccccn1)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1840390670	FKFZOFRXGZRTIE-JOQOYGCGSA-N	431.917	1.553	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)CCc1ccc(C#N)cc1)C2	1843415163	RJJGPEVQJPJWBC-WPWMEQJKSA-N	446.511	1.828	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)c2cc(Cl)nc3ccccc23)C1	1843708058	MSEFKDUMDIEVPS-UHFFFAOYSA-N	449.703	1.699	50	20	IDGD	
COC[C@H](NC(C)=O)C(=O)N1CCCC12CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)C2	1844387065	OMELKOCPKLNYQQ-NXNKFBBFSA-N	446.454	1.226	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC12CN(C(=O)c1cccc(S(C)(=O)=O)c1)C2	1846175401	XEEGCTCPLLXHRL-GFCCVEGCSA-N	429.336	1.691	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CCN1C(=O)c2ccccc2C1=O	1848087133	KJTCUJZYOPCUIV-RCBQFDQVSA-N	448.317	1.658	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)Cn2c(C)cc3ccccc32)cc1OC	10621524	IROUAONXXJHJAH-UHFFFAOYSA-N	425.441	1.971	50	20	IDGD	
C=CCNS(=O)(=O)c1cccc(C(=O)OCC(=O)NNC(=O)c2ccc(C)cc2)c1	10792327	BDQKGJKFFZFGAF-UHFFFAOYSA-N	431.470	1.077	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@H](C)C(=O)NNC(=O)c1cc(S(N)(=O)=O)cn1C	27202910	SDNOMFKIYOYMGV-LLVKDONJSA-N	428.898	1.171	50	20	IDGD	
O=C1CC(=O)Nc2cc(S(=O)(=O)NNC(=O)c3cc4c(s3)CCCCC4)ccc2N1	28680256	NGOOCSJGZSINFF-UHFFFAOYSA-N	448.526	1.921	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@@H](NS(=O)(=O)c2ccc(C)cc2)C(C)C)cc1OC	28777135	HABXOZTWOFWIQG-IBGZPJMESA-N	449.529	1.776	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)CCNS(=O)(=O)c2ccc(F)c(F)c2)c2ccccc2n1	115166633	WDWKSGPBKPDVAH-UHFFFAOYSA-N	448.451	1.951	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NN=Cc1ccc([N+](=O)[O-])o1	254696961	GUAVQOKJVWGKOA-UHFFFAOYSA-N	436.446	1.292	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](CNC(=O)NNC(=O)CNC(=O)c2cccs2)C1	725873889	UGCQAPYSMBRBMU-CYBMUJFWSA-N	439.538	1.455	50	20	IDGD	
CC(=O)c1cccc(S(=O)(=O)N2CCC(C(=O)NNC(=S)NC(C)(C)C)CC2)c1	726140164	SZPUQXVYIJBYAR-UHFFFAOYSA-N	440.591	1.584	50	20	IDGD	
NC(=O)c1ccc(NC(=S)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1	726435591	DZUGGGCHZPPVGY-UHFFFAOYSA-N	426.546	1.315	50	20	IDGD	
CC(C)c1nc(C#N)c(NNC(=O)Cn2cnc3c(c(Br)nn3C)c2=O)o1	727104961	XYDVWUILGFQOJT-UHFFFAOYSA-N	435.242	1.019	50	20	IDGD	
Cn1cc(NS(=O)(=O)c2ccsc2C(=O)NNc2nc(-c3ccncc3)no2)cn1	728071058	RNTBOHSJBGNLCG-UHFFFAOYSA-N	446.474	1.484	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	728212722	AUKPYJASYYVMMC-OAHLLOKOSA-N	436.509	1.672	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3ccccc3-n3cccn3)cc2)CC1	728216145	SLTYKAKKKLFIDZ-UHFFFAOYSA-N	440.529	1.565	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2cnn(C(C)(C)C)c2C(F)(F)F)n1	728727804	LCHQDNYFKXNQKP-UHFFFAOYSA-N	447.439	1.969	50	20	IDGD	
Cn1ccnc1CNC(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	728752599	IRCMCFFLQGOYOJ-UHFFFAOYSA-N	431.456	1.323	50	20	IDGD	
O=C(CCCN1C(=O)c2ccc(Br)cc2C1=O)NNC(=O)Cc1cccnc1	728852620	JNPTXQUWDSPXMG-UHFFFAOYSA-N	445.273	1.610	50	20	IDGD	
CC1(C)CN([C@H](CNC(=O)NNC(=O)C(=O)NC2CC2)c2ccc(Cl)cc2)CCO1	729054745	JVHXWMVCEXFIQI-MRXNPFEDSA-N	437.928	1.101	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N2CCO[C@H](C#N)C2)cc1	729979589	LVUFDEMMDWDOEG-OUQXZNHLSA-N	434.456	1.092	50	20	IDGD	
O=C1CC(=O)Nc2cc(S(=O)(=O)NNC(=O)c3cccc4ncccc34)ccc2N1	730204298	NZMQKYZOJDXICS-UHFFFAOYSA-N	425.426	1.139	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@H]2CCN(c3ccc4c(c3)OCCO4)C2=O)cc1OC	730512293	LCXLDNVLGZWFIT-OAHLLOKOSA-N	441.440	1.289	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)NC2CCN(CC#N)CC2)c2ccccc2c1=O	730674257	IXTPBCAAGVPRJB-UHFFFAOYSA-N	439.520	1.519	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@H](C)Sc2nnnn2C2CC2)cc1Br	732177171	ZPGQTWXTVZBQIG-QMMMGPOBSA-N	441.311	1.721	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CNC(=O)c2ccccc2OC)cc1Br	732306861	AMOZXBVUKKGOJL-UHFFFAOYSA-N	436.262	1.657	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NCC2CCN(Cc3nc(C)c(C)o3)CC2)cc1	732475881	NQDCOTPSVDNWFC-UHFFFAOYSA-N	445.520	1.921	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)N[C@H]2CCN(c3ccccc3C(N)=O)C2)c1	732575709	HCEYIIWTNOJCJE-AWEZNQCLSA-N	427.461	1.026	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)[C@H]2CCCN2S(=O)(=O)c2cccc([N+](=O)[O-])c2)c(O)c1	733001242	XJNKGEFZYBBFLA-MRXNPFEDSA-N	448.457	1.223	50	20	IDGD	
CCOCCCn1c(NNC(=O)Cn2nnc3ccccc3c2=O)nc2ccccc2c1=O	733266105	FJPCDBGUEGJAEZ-UHFFFAOYSA-N	449.471	1.071	50	20	IDGD	
CCS(=O)(=O)CC(C)=NNC(=O)c1cccc(NN=C(C)CS(=O)(=O)CC)c1	733745446	KOZCTBWFXUXXRC-UHFFFAOYSA-N	430.552	1.450	50	20	IDGD	
Cc1c(/C=C(\C#N)C(=O)Nc2ncn(CC(=O)NCc3ccccc3)n2)cc(C#N)n1C	734126193	ZKKKOQOTWQSVNG-QGMBQPNBSA-N	428.456	1.659	50	20	IDGD	
CC(=O)N1CCCc2ccc(S(=O)(=O)NNC(=O)Cn3ccc4ccccc43)cc21	736062372	DVSTWWGULFTGAG-UHFFFAOYSA-N	426.498	1.950	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)CCS(=O)(=O)c1ccc2c(c1)OCCCO2	741182381	NCTCYKSNEONCLI-UHFFFAOYSA-N	448.497	1.410	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1ccc2c(c1)NC(=O)CCN2C	741740978	JOBDZYVXBDUGGH-UHFFFAOYSA-N	444.517	1.141	50	20	IDGD	
Cc1cc(Br)ccc1C(=O)N1CCC[C@H](C(=O)NNC(=O)c2cnn(C)c2)C1	742688045	RKSZPMYWTHGHLN-ZDUSSCGKSA-N	448.321	1.804	50	20	IDGD	
O=C(Cc1csc(N2CCOCC2)n1)NNC(=S)N[C@@H]1CCc2ccccc2C1	742976219	XXTPNFUJUDLCEO-MRXNPFEDSA-N	431.587	1.575	50	20	IDGD	
O=C(CNC(=O)c1ccc(F)c(F)c1)NNC(=O)c1cc(Br)ccc1O	743733885	RZQYNVXKWNXZNF-UHFFFAOYSA-N	428.189	1.624	50	20	IDGD	
O=C(Cc1ccccc1OC(F)F)NNc1ccccc1S(=O)(=O)N1CCOCC1	744620171	FESGGBAAGIAJJW-UHFFFAOYSA-N	441.456	1.995	50	20	IDGD	
CC(C)N1CCN(c2ccc(C(=O)OCC(=O)NNC(=O)c3ccc(C#N)cc3)cc2)CC1	744900447	LENWYYABDSDPJI-UHFFFAOYSA-N	449.511	1.707	50	20	IDGD	
COc1cc(C)nc(NNC(=O)c2cc(Br)cc(S(N)(=O)=O)c2C)n1	747419322	AJZDECHEFUFVNO-UHFFFAOYSA-N	430.284	1.269	50	20	IDGD	
COC(=O)[C@H](O)C1CCN(C(=O)/C(C#N)=C\c2cc(C)n(C[C@H]3CCCO3)c2C)CC1	747517388	JZGCXHUYQBNVCU-UNZKKUHZSA-N	429.517	1.963	50	20	IDGD	
Cn1ccnc(NNC(=O)CSCc2nc(O)c3c4c(sc3n2)CCCC4)c1=O	747942151	MPYYHPPPSLOOES-UHFFFAOYSA-N	432.531	1.746	50	20	IDGD	
O=C(NNc1ccc(Br)cc1F)[C@H]1CC(=O)N(CCN2CCOCC2)C1	748188735	VXNQXBFIMMCQPA-LBPRGKRZSA-N	429.290	1.212	50	20	IDGD	
C[C@H](Nc1ccc(C(=O)NNC(=O)C(=O)N2CCCC2)cc1[N+](=O)[O-])c1ccccn1	748240380	UWBQVIXNTDRBSV-ZDUSSCGKSA-N	426.433	1.546	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)N[C@@H]1CCN(c2ccc(Br)cc2)C1	748629739	DOTGFEQDENDTGV-GXTWGEPZSA-N	429.315	1.410	50	20	IDGD	
O=C(O)CCC(=O)c1ccc(S(=O)(=O)NNC(=O)c2ccc3ccccc3n2)cc1	748673607	DCZANJKWSMQUMP-UHFFFAOYSA-N	427.438	1.906	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)c2cc(Br)c3c(c2)OCCO3)cc1	748696855	WOKUGPYDGSSBJL-UHFFFAOYSA-N	432.230	1.932	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)NCCc1nnc(-c2ccccc2)o1	749201846	CZBPLCMMTBZEEC-UHFFFAOYSA-N	426.389	1.597	50	20	IDGD	
NC(=O)c1ccc(/C=C\C(=O)N2CCC[C@@H]2C(=O)NNC(=O)c2cc3ccccc3o2)cc1	749477340	YSNUTKOQXOXCNH-ZVBPTUHVSA-N	446.463	1.997	50	20	IDGD	
CN(Cc1ccccc1)Cc1cccc(C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)c1	751360400	FCSORTYPYQQVKQ-IBGZPJMESA-N	430.530	1.450	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)[C@H]1CC1(C)C)N(S(C)(=O)=O)CC2	752261628	MSWKJQNTTVXMLB-CABCVRRESA-N	439.534	1.146	50	20	IDGD	
C[C@H](C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)c1ccc(S(C)(=O)=O)cc1	753310570	VLMBYRKNSZKEBF-LBPRGKRZSA-N	428.511	1.049	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)NC3CCN(S(=O)(=O)C4CC4)CC3)cc2C1	753801614	KIGZIGZCFNJMHE-GFCCVEGCSA-N	440.591	1.774	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(OC)c(NC(=O)NNC(=O)Cc2ccncc2)c1	755409887	RBADDJZBVNIKBN-UHFFFAOYSA-N	435.506	1.516	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)Nc1ccc(S(=O)(=O)N(C)OC)cc1	755534431	LHUFPOYZKLSCPY-UHFFFAOYSA-N	438.462	1.109	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)Nc2ccc(CC(=O)N3CCOCC3)cc2)c1O	755862077	MOAJNPQYJWORNM-UHFFFAOYSA-N	428.445	1.269	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)Nc1cccc(N2C(=O)CN(C)C2=O)c1	755992922	PFQDPVMGCBSDLG-UHFFFAOYSA-N	425.445	1.879	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1cccc(C[S@](=O)c2ccccc2)c1	756593451	ZFFSWSZICUUYLI-QYSRSOONSA-N	438.531	1.085	50	20	IDGD	
CCOC(=O)[C@@H](C)NC(=O)c1ccc(NC(=O)NNC(=O)Cc2cccnc2)cc1F	756817403	HGPZPIQHPJHRLH-GFCCVEGCSA-N	431.424	1.298	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNS(=O)(=O)c2cc(C(=O)O)cc(F)c2F)cc1C	756930004	QFZCGHUZVNOQOX-UHFFFAOYSA-N	427.385	1.228	50	20	IDGD	
CC(C)n1cnnc1-c1ccccc1NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	757613207	SZDBAELVPVNBEO-UHFFFAOYSA-N	432.448	1.968	50	20	IDGD	
O=C(NNC(=O)[C@H](c1ccc(Br)cc1)N1CCCC1)[C@@H]1CCS(=O)(=O)C1	758154969	MVCMDAULQBWTHG-HIFRSBDPSA-N	444.351	1.168	50	20	IDGD	
COC(=O)[C@H](C)Oc1ccc(/C=C(\C#N)C(=O)Nc2ccc(S(N)(=O)=O)cc2)cc1	758415510	ISQUVSLLOXNMLG-JMRXEAOASA-N	429.454	1.820	50	20	IDGD	
CCNS(=O)(=O)c1ccc(CC(=O)NNC(=O)[C@H](C)Oc2ccc(OCC)cc2)cc1	759355717	ABSKHFVRYHDYCV-HNNXBMFYSA-N	449.529	1.541	50	20	IDGD	
C[C@@H](CC(=O)NNC(=O)CCCc1ccccc1)NS(=O)(=O)c1cccnc1Cl	760520467	QKRFWQJRNIJIIB-AWEZNQCLSA-N	438.937	1.962	50	20	IDGD	
COCCC1(C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)CCCC1	761567860	FGCLHUNHYYQEAZ-UHFFFAOYSA-N	425.555	1.058	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)N[C@H]2CCN(C(=O)C3CCCC3)C2)cc1	762086094	IEVDIJNSOWGZGO-HNNXBMFYSA-N	437.522	1.217	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@H](C(=O)NNc2nccc(N3CCOCC3)n2)C(C)C)cc1	762855412	JVYBRQWSTNSTRE-SFHVURJKSA-N	448.549	1.068	50	20	IDGD	
CCS(=O)(=O)c1cccc(CC(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)c1	763368627	IAPXBTVTCRALKG-UHFFFAOYSA-N	436.486	1.510	50	20	IDGD	
CC(C)(C)OC(=O)N1CCc2ncc(NC(=O)C(=O)NNC(=O)c3ccccc3)cc2C1	763422260	BFXQGMLJCWJXBX-UHFFFAOYSA-N	439.472	1.775	50	20	IDGD	
CCn1nnnc1-c1cccc(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3n2)c1	763449378	FGJNDQSJOCJICP-UHFFFAOYSA-N	430.428	1.308	50	20	IDGD	
O=C(NNC(=O)c1ccncc1)C(=O)Nc1ccc(Cl)cc1I	763462013	HPHBHNSDYDXIBB-UHFFFAOYSA-N	444.616	1.739	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1ccnn1-c1cccc(Cl)c1	763471808	LIOSAKGAIPFJOC-UHFFFAOYSA-N	428.792	1.834	50	20	IDGD	
CC(C)(C)OC(=O)NCCOc1cccc(NC(=O)C(=O)NNC(=O)c2cccnc2)c1	763492280	SJIRUAAHXFYHEQ-UHFFFAOYSA-N	443.460	1.385	50	20	IDGD	
CN(C(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)c2cccnc2)cc1)c1ccccc1	763494353	AJJNTMRDDYKNLN-UHFFFAOYSA-N	431.452	1.687	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)N(C)C)c(Cl)c2)cc1OC	763552321	YRKAUGRYJJKQPL-UHFFFAOYSA-N	448.863	1.459	50	20	IDGD	
O=C(NNC(=O)c1ccccc1F)C(=O)Nc1ccnn1Cc1cnn(-c2ccccc2)c1	763555476	FNQPKBLYTCXQLL-UHFFFAOYSA-N	447.430	1.656	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)Nc1cc(Br)ccc1F	763572627	SVZHHSILWVMSEW-AWEZNQCLSA-N	438.209	1.514	50	20	IDGD	
COCCn1nc(C)c(NC(=O)C(=O)NNC(=O)COc2ccc(C(C)(C)C)cc2)c1C	763600590	RBXAAAQVMFYNTJ-UHFFFAOYSA-N	445.520	1.609	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2ccc(N3CCO[C@@H](C)C3)cc2)c1	763668105	ISEIXGWZGCPUJI-KRWDZBQOSA-N	440.500	1.693	50	20	IDGD	
C[C@H](c1cccc(NC(=O)C(=O)NNC(=O)COc2ccccc2F)c1)N1CCOCC1	763678316	CMSZTUJNAHHWCQ-OAHLLOKOSA-N	444.463	1.384	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)C(=O)Nc2cccc(CN3CCOC3=O)c2)c1	763754497	SXHYWCJHJBTXIK-UHFFFAOYSA-N	425.445	1.105	50	20	IDGD	
CCN(CC)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)C2=S=C3CCCC3=C2)cc1	763785909	VKELEGXEXMRLSF-UHFFFAOYSA-N	428.514	1.456	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccccc2-c2nnnn2C(C)C)cc1	763820906	MMYFMHPRNVTOEW-UHFFFAOYSA-N	437.460	1.394	50	20	IDGD	
C[C@@H]1COCCN1c1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)cc1	763839866	NCAAIOUFFHINQZ-CQSZACIVSA-N	430.436	1.216	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(NC(=O)CC)cc2)cc1	763859741	FPGJDROFEGCSRY-CQSZACIVSA-N	442.472	1.987	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)C(=O)Nc1ccc(C#N)cc1	763882722	LJRUTQZXTKNPNN-LLVKDONJSA-N	431.246	1.874	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccc(C(=O)NC3CCCCC3)cc2)n1	763886043	PVBJYTHYPDNVDJ-UHFFFAOYSA-N	440.504	1.349	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cccnc2OCC(F)F)cc1OC	763902630	VTHDPHDFYBXAGK-UHFFFAOYSA-N	438.387	1.533	50	20	IDGD	
CCS(=O)(=O)c1cc(F)ccc1NC(=O)C(=O)NNC(=O)Cc1ccc(F)cc1	763920352	HKVIDCIFMFVJII-UHFFFAOYSA-N	425.413	1.087	50	20	IDGD	
O=C1CCc2ccc(NC(=O)C(=O)NNC(=O)c3ccc(Br)s3)cc2N1	763940976	NSKZIXBFAAWLPP-UHFFFAOYSA-N	437.275	1.795	50	20	IDGD	
CCOC(=O)/C=C/c1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1	764006253	NKDJRXZCCYMPOL-BJMVGYQFSA-N	439.424	1.434	50	20	IDGD	
COC(=O)[C@@H](C)Cc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(OC)c2O)cc1	764130206	DAKMSDLKWUDJGH-LBPRGKRZSA-N	429.429	1.152	50	20	IDGD	
Cn1cc(NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3CN2Cc2ccccc2)cn1	764179379	SAEHQQXZAVBYRS-HXUWFJFHSA-N	432.484	1.133	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)C(=O)Nc1cccc2c1OCCC2=O	764204059	ROYOPWOBYIOSIL-UHFFFAOYSA-N	434.449	1.043	50	20	IDGD	
Cc1ccc2c(c1)C(=O)N(CC(=O)NNc1c(F)cc(C(=O)NC3CC3)cc1F)C2=O	764335704	ZCLJVCNJLCRARP-UHFFFAOYSA-N	428.395	1.905	50	20	IDGD	
CCC(C)(C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)Cc2ccncc2)cc1Cl	764355605	FMHKNEBVTWLEEV-UHFFFAOYSA-N	445.907	1.982	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)C(=O)Nc1ccc(OC(F)F)cc1OC(F)F	764388167	BEIPYLVBMQABRP-UHFFFAOYSA-N	430.314	1.993	50	20	IDGD	
CC(=O)Nc1ccc(C)c(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)c1	764388317	QPWBEGXAARCXQL-UHFFFAOYSA-N	438.419	1.882	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1ccc([S@](C)=O)c(F)c1	764392656	KALUFJJXYWSULT-LJAQVGFWSA-N	439.490	1.450	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNS(=O)(=O)c3cccc(Cl)c3)CC2)cc1	765126171	JLUHLCVRKCMORO-UHFFFAOYSA-N	436.965	1.776	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccc(F)cc2)ccc1=O)c1cc(-c2ccc(F)cc2)[nH]n1	765620507	XLSYYDQMBJYHFQ-UHFFFAOYSA-N	436.378	1.976	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)cc1	765754416	KDURQWLXQRGQPF-UHFFFAOYSA-N	426.517	1.348	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@H]2CN(Cc3ccccc3)C[C@H]2C)c2ccccc2c1=O	765890883	HBHYSJSSCDRSAH-UZLBHIALSA-N	448.527	1.881	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)C(C)(C)Oc3ccc(C#N)cc3)CC2)cc1	766649624	RQCXJEKBGNOGDR-UHFFFAOYSA-N	449.555	1.989	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)CN1CCN(C(=O)N(C)Cc2ccccc2)CC1	766854985	YLMSTEXDMXUFST-UHFFFAOYSA-N	437.544	1.555	50	20	IDGD	
Cc1ccc(N2N=C(Br)C[C@H]2C(=O)NNc2nc(O)c3cnn(C)c3n2)cc1	770971441	JDZDOCXGLAVEFN-LBPRGKRZSA-N	445.281	1.808	50	20	IDGD	
O=C(NNc1ccc(Br)c(F)c1)[C@H]1CC(=O)N([C@H]2CCS(=O)(=O)C2)C1	771682147	HXLZGILTQKJGIK-ONGXEEELSA-N	434.287	1.067	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)CCn1cnc2sc3c(c2c1=O)CCCC3	771966359	ALEDXFFQRZNROX-CYBMUJFWSA-N	448.545	1.852	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)c1ccc(OCC(F)(F)F)nc1	772194558	ABBCMGPOQBCJEG-UHFFFAOYSA-N	430.770	1.754	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)C[C@H]1CSCCN1C(=O)OC(C)(C)C	772384833	AJNTWNABTUQRGI-AWEZNQCLSA-N	438.550	1.997	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(C(=O)NCc3ccccn3)c2)cc1F	773889021	PAGVYYVZUSHNNC-UHFFFAOYSA-N	449.442	1.859	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2cnn(CC(F)(F)F)c2)ccc1OC(C)C	775251881	CMJTUBWWDQXFQQ-UHFFFAOYSA-N	436.412	1.865	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCC1([C@H](C)CCO)CCC1	775713173	GYICSHKFPYZBGS-CYBMUJFWSA-N	425.555	1.421	50	20	IDGD	
O=C(c1cc(Cl)c2c(c1)OCO2)N1CCN(S(=O)(=O)CBr)CC1	777777293	HJPMGWTWOCQOHL-UHFFFAOYSA-N	425.688	1.509	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)C[C@H]1CSCCN1C(=O)OC(C)(C)C	778436374	IRDCQKVUGASGGD-LBPRGKRZSA-N	432.543	1.401	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@@H]3CCC(=O)[C@H](C)C3(C)C)CC2)cc1	780927064	QNDWPZSHWAKLAZ-ICSRJNTNSA-N	428.577	1.901	50	20	IDGD	
Cc1nn([C@@H]2CCS(=O)(=O)C2)c2nc(C3CC3)cc(C(=O)NN=c3cc[nH]cc3)c12	781020185	SCJIUVWTFBPEEJ-OAHLLOKOSA-N	426.502	1.551	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)N2CCN(Cc3nc(COC)no3)CC2)c1C	781470733	FDHZEJHUZCDRAQ-UNOMPAQXSA-N	442.520	1.532	50	20	IDGD	
CC[C@@H](C)NS(=O)(=O)Cc1cccc(NC(=O)C(=O)NNc2ncncc2Cl)c1	782160351	QMPPASNELQTYAQ-LLVKDONJSA-N	440.913	1.430	50	20	IDGD	
COc1ccc(Cn2nccc2NC(=O)C(=O)NNC(=O)c2ccc(O)cc2)c(OC)c1	782831284	CLAKSHWTLSVQBZ-UHFFFAOYSA-N	439.428	1.054	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1Cl)C(=O)Nc1cc(-n2cnnn2)ccc1F	782925402	IQFCXWYLFLYCTC-UHFFFAOYSA-N	438.206	1.508	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)C(=O)Nc1ccc2ncccc2c1	784213502	ODAWYXGRJCUJTN-UHFFFAOYSA-N	425.470	1.757	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(C(=O)NNC(=O)COc2ccc(Br)cc2)C1	784601778	PIOGPFGYEJDTDW-UHFFFAOYSA-N	428.283	1.842	50	20	IDGD	
CCCc1c(NC(=O)C(=O)NNc2ccnc(N(C)C)n2)cnn1-c1cccc(F)c1	784970328	UWXGPDURUZSVKZ-UHFFFAOYSA-N	426.456	1.902	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2c(F)cc(F)cc2Br)cn1	785008291	LQXIDXBNKBCOHX-UHFFFAOYSA-N	449.233	1.608	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2ccc(C[C@@H]3CC(=O)NC3=O)cc2)cc1Cl	785117591	LAIBUWNOJFDISD-GFCCVEGCSA-N	430.848	1.636	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2cc(Br)c(F)cc2F)c1O	786416541	FJWQBWYBHSQFIE-UHFFFAOYSA-N	444.188	1.841	50	20	IDGD	
CCS(=O)(=O)CCn1cc(C)c(NC(=O)NNC(=O)COc2ccc(C)c(C)c2)n1	786712868	LRAIQXVMYYSTFK-UHFFFAOYSA-N	437.522	1.475	50	20	IDGD	
C[C@H](C(=O)NNC(=O)Cc1ccc(F)cc1)[C@@H](C)C(=O)NNC(=O)Cc1ccc(F)cc1	790125764	TVGKWDRKFIDJGZ-OKILXGFUSA-N	446.454	1.317	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)[C@](C)(O)Cn1cc(C(F)(F)F)ccc1=O	792024046	YJYFXAPUFKBCCB-BBATYDOGSA-N	445.369	1.372	50	20	IDGD	
O=C(Cc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1cccc(N2C(=O)CCCC2=O)c1	792355078	OPRDPNVGJJZOOA-UHFFFAOYSA-N	442.859	1.712	50	20	IDGD	
CCOC(=O)[C@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNc2ncccc2C)cc1F	792377686	AVWPCSJHIOCFDE-LBPRGKRZSA-N	431.424	1.292	50	20	IDGD	
COc1ccccc1NC(=S)NNC(=O)CN1C(=O)N[C@@](C)(c2ccc(C)cc2)C1=O	792952112	FOGQNWCHPYESEO-NRFANRHFSA-N	441.513	1.788	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)nc1Br	793023524	PPWDWXKDQMMKIE-UHFFFAOYSA-N	441.669	1.971	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CCNS(=O)(=O)c2cccc(Br)c2)n1	794073063	VPLKDQQMPRKOQL-UHFFFAOYSA-N	441.307	1.282	50	20	IDGD	
CN(C)c1cc(C(=O)NN=C[C@H]2CCCN(C(=O)CNC(=O)OC(C)(C)C)C2)ccn1	794510264	LTNLIVNDBGAPBL-OAHLLOKOSA-N	432.525	1.627	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@H]2C(=O)NNC(=O)Cc2nc3ccccc3n2C)cc1	798828635	WCUJOVQKYDZLOF-IBGZPJMESA-N	435.484	1.577	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)NCCS(=O)(=O)CCc2ccccc2)c1	800757196	VVYKQNYSEINGOR-UHFFFAOYSA-N	425.532	1.374	50	20	IDGD	
CC(=O)N1CCN(S(=O)(=O)c2cccc(C(=O)NNC(=O)Nc3ccccc3)c2)CC1	801985565	YXUVWAFACUIGNR-UHFFFAOYSA-N	445.501	1.006	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)[C@@H]2CS[C@@]3(C)CCC(=O)N23)cc1Cl	802077304	QAENEIAVSHNBHC-GTNSWQLSSA-N	428.898	1.964	50	20	IDGD	
CCN(CC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)Cc1ccccc1Cl	806273114	QHONHNZJKGMPMR-UHFFFAOYSA-N	427.892	1.870	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1nc2c(s1)CSCC2	806976904	NZQWRDHZEMRIAT-UHFFFAOYSA-N	426.907	1.994	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2ccc(F)c(C(C)=O)c2)n[nH]1	806979400	SVWYEZRTUROMTG-UHFFFAOYSA-N	439.403	1.827	50	20	IDGD	
O=C(NNc1cccc(F)c1[N+](=O)[O-])C(=O)Nc1ccc(F)c(N2CCCNC2=O)c1	807067926	BWSQVQDWCUSRJP-UHFFFAOYSA-N	434.359	1.875	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)c1cn(-c2ccccc2Br)nn1	807370979	AUEUAHCQZKYXFS-UHFFFAOYSA-N	426.271	1.580	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)c1cc([C@@H]2CCN(C(=O)OC(C)(C)C)C2)[nH]n1	807371141	CJZVYOCMVLXLDL-CYBMUJFWSA-N	439.513	1.684	50	20	IDGD	
CS(=O)(=O)c1cc(Br)ccc1NC(=O)C(=O)NNc1cccc(F)n1	807391651	CQQUCHNQBWHVIH-UHFFFAOYSA-N	431.243	1.469	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)NCc1noc2c1CCCC2	807618283	LDTJZUWGQDZRQT-UHFFFAOYSA-N	426.521	1.596	50	20	IDGD	
Cc1sc2ncn(CC(=O)OCC(=O)NNC(=O)c3cccc(Cl)c3)c(=O)c2c1C	807638865	QBJFHERDTIAUEF-UHFFFAOYSA-N	448.888	1.733	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)cc2[nH]ccc12	808934646	OXZBQJPUDGZDJB-LLVKDONJSA-N	442.403	1.647	50	20	IDGD	
CNC(=O)c1cc(Oc2ccc(NC(=O)NNC(=O)c3cnccn3)cc2F)ccn1	810311956	JNBIHWVMOMQPBZ-UHFFFAOYSA-N	425.380	1.629	50	20	IDGD	
CCOC(=O)Nc1scnc1C(=O)NNC(=O)c1csc(N2CCOCC2)n1	813367352	ZMAZRTYYVMTQIM-UHFFFAOYSA-N	426.480	1.079	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NN=C2CCC(CS(C)(=O)=O)CC2)cc1	814729876	FRUPRZDPXFBZJV-UHFFFAOYSA-N	429.564	1.323	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1ccc(OC2CCCC2)nc1	815752573	XNZPOTUGGMCIMQ-UHFFFAOYSA-N	447.517	1.735	50	20	IDGD	
C[C@@H]1CCCN(S(=O)(=O)c2ccc(NC(=O)C(=O)NNc3ncncc3F)cc2)C1	815764412	GZLABPJEHYGSAN-GFCCVEGCSA-N	436.469	1.118	50	20	IDGD	
CNS(=O)(=O)NC1CCN(C(=O)/C(C#N)=C/c2cc(C)n([C@@H](C)COC)c2C)CC1	816468624	KJQOLPMOKZLJRK-LZNAANCOSA-N	437.566	1.264	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)c1cc(I)c[nH]1	817052437	AZDUBGAMUNZHCJ-UHFFFAOYSA-N	434.259	1.627	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)CN2C(=O)N[C@@]3(CCc4ccccc43)C2=O)cc1C	864001989	ZQYWUZWQGOXDGD-HSZRJFAPSA-N	436.468	1.223	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)c1cc2c(nc1O)CCCC2=O	888913941	PLBODFQVXDOMRX-UHFFFAOYSA-N	434.246	1.909	50	20	IDGD	
O=C(CN1c2cccc3cccc(c23)S1(=O)=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	913400938	INAPTHIKFLTYRI-UHFFFAOYSA-N	426.410	1.718	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)CN2C(=O)c3ccccc3N3C(=O)CC[C@@]23C)cc1	914830512	ZIOVHBXPEKSKKE-QHCPKHFHSA-N	436.468	1.520	50	20	IDGD	
Cc1c(N(C)S(=O)(=O)c2cc(C(=O)NN)ccc2Cl)c(=O)n(-c2ccccc2)n1C	916665679	YRNWWIOTECBRFP-UHFFFAOYSA-N	449.920	1.566	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)CCC(=O)N2CCc3sccc3C2)c1	917665545	OOIAOBRJRIFINL-UHFFFAOYSA-N	435.527	1.278	50	20	IDGD	
Cc1ccc(N2CCC(C(=O)NNC(=O)c3csc(N4CCOCC4)n3)CC2)nc1	919810013	QNRNFNRWQPPLRM-UHFFFAOYSA-N	430.534	1.361	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)NCCN1CCN(Cc2ccccc2)CC1	919903441	QOJPNXHZEQQULD-UHFFFAOYSA-N	425.533	1.386	50	20	IDGD	
O=C(NNC(=O)c1ccccc1NS(=O)(=O)c1cccc([N+](=O)[O-])c1)c1ccncc1	920395673	GUNTVBYDLWQZTP-UHFFFAOYSA-N	441.425	1.865	50	20	IDGD	
O=C(NCc1cccc(C(=O)N2CCOCC2)c1)NNC(=O)c1ccc2c(c1)OCCO2	920419627	HEBJUAJSTMTXPO-UHFFFAOYSA-N	440.456	1.074	50	20	IDGD	
Cc1ncc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c(C2CC2)n1	1256494757	ABLHIZCBMIVVRC-UHFFFAOYSA-N	429.502	1.522	50	20	IDGD	
Cc1nn(CCO)c(C)c1C=NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	1319986719	FDHRONDFABNCFD-UHFFFAOYSA-N	444.499	1.958	50	20	IDGD	
COC(=O)c1ccc(S(=O)(=O)NNC(=O)c2cncn2-c2ccccc2)c(OC)c1	1324393196	KGIYLNNUVHCHRS-UHFFFAOYSA-N	430.442	1.291	50	20	IDGD	
NC(=O)CC[C@@H](C(=O)NNC(=O)c1ccccc1Cl)N1C(=O)c2ccccc2C1=O	1329604912	RPBXTPJRTMCIFA-HNNXBMFYSA-N	428.832	1.031	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)C/N=C/c3ccco3)C2)C1	1779133331	YAGPSWAPGVDQHN-UEXBOALHSA-N	426.311	1.559	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@]2(C1)CN(C(=O)Cc1cccc([N+](=O)[O-])c1)CCO2	1779294963	SOOSBWPHMKKTLV-HXUWFJFHSA-N	435.553	1.819	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ncccc3Br)C2)C1	1779652433	CSXNBQPNKAKFOI-DYVFJYSZSA-N	446.729	1.541	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3c(F)cncc3F)C2)C1	1779725265	JDEBDZYPEULXSA-GTNSWQLSSA-N	432.265	1.834	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cncc(C(F)(F)F)c3)C2)C1	1779751144	SESVXULAOCVNDN-WMLDXEAASA-N	435.830	1.798	50	20	IDGD	
COc1ccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](F)Br)C3)nn1	1779952564	NIBLFRHNQAYSFF-HACGYAERSA-N	445.289	1.303	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3[nH]cnc3-c3cccnc3)C2)C1	1780057076	KVZSUIMRKKUFBR-ORAYPTAESA-N	448.321	1.699	50	20	IDGD	
COc1cccc(CC(=O)N2CCO[C@]3(CCN(C(=O)[C@H](F)Br)C3)C2)n1	1781326371	OCTWCFMQUXFTJF-DOTOQJQBSA-N	430.274	1.153	50	20	IDGD	
O=C(c1ccc(CO)c(F)c1)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781333067	BLUNDPVBTCYERQ-RHSMWYFYSA-N	433.249	1.452	50	20	IDGD	
CC(=O)N/C(=C\c1ccco1)C(=O)N1CC[C@@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1781859982	OACXNAUQQNHRKJ-DGJFXRHUSA-N	437.924	1.852	50	20	IDGD	
O=C(c1nc2ccc(F)cn2n1)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1782569921	VJPQUNYUZVELKJ-BLLLJJGKSA-N	444.236	1.002	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](C)Nc1ccccn1)CCO2	1783349225	KEJWSLFNAZEUKK-VCBZYWHSSA-N	439.354	1.885	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]3C2)c(Cl)c1	1784095565	LLKHGRAKVQGEHO-GQGQLFGLSA-N	431.316	1.542	50	20	IDGD	
CCO/C=C/C(=O)N1CC[C@]2(C1)CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)CCO2	1784236396	ZTTWZXZYGUTSGA-ISPXXFMDSA-N	447.444	1.514	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Cl)C[C@@H]21)c1ccc(N2CCOCC2)cn1	1785722893	KYEBAOAMVKLENT-QXRTWZOPSA-N	440.903	1.046	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4ncnn4c3)C[C@@H]21	1786406798	FPWSOOOBCSTVIT-KKUMJFAQSA-N	436.310	1.108	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3nnc(C)s3)[C@H]2C1	1787058531	ZCDVVGMXGFGMMD-XUXIUFHCSA-N	445.383	1.542	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3[nH]nc4ccncc34)C[C@@H]21)[C@H](F)Br	1789922327	CWWAIFROFLAOCX-PBLBJHRBSA-N	440.273	1.242	50	20	IDGD	
COCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](Br)Cc3ccccc3)[C@H]2C1	1790780849	WGFUNEIAGKXYIO-XSLAGTTESA-N	439.350	1.619	50	20	IDGD	
C=C(CC(=O)OCC)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](Br)CC)[C@H]2C1	1790963275	QJSYGAGSNFFZBC-VGWMRTNUSA-N	445.354	1.649	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3csc4c3CCCO4)C[C@@H]21	1791254088	KZTWMFDLZMJIFR-SDNTUTLCSA-N	442.965	1.920	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1noc3c1CCCC3)C2	1792868064	OIWXRZXZIUNOEJ-NFFDBFGFSA-N	440.338	1.788	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccnc(C(=O)OCC)c1)C2	1793448825	LSPJKUFDAABYLF-KYHPRHEASA-N	437.924	1.869	50	20	IDGD	
CC(C)(C)OC(=O)N1CCOC[C@@H]1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](F)Cl)C2	1793841679	VPJTZKGFYKKJKJ-KHMAMNHCSA-N	433.908	1.795	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2n(n1)CCNC2=O	1795354111	OYHXLKCCIWOAGW-YVECIDJPSA-N	438.326	1.052	50	20	IDGD	
N[C@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1cccc(Cl)c1	1795628574	TYNCGMUMFYMXES-HZZBMVKVSA-N	448.720	1.620	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1nnc(C)s1	1795822749	MIGYPRKCSKVMHR-OXIQGZBJSA-N	431.356	1.152	50	20	IDGD	
COc1ccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Cl)c([N+](=O)[O-])c1	1796367449	IVSGKFXYXSIYMT-LZDSYCOUSA-N	429.832	1.270	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2ccccn2n1	1796834830	OVTODKGHFXNFSI-AODNKKSCSA-N	425.316	1.774	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc3ncnn3c1)C2	1796892431	ANZNKNXJOYFEEP-AUHJYUKYSA-N	448.487	1.115	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C=N/O[C@@H]1CCCCO1	1797810753	WJTRRUIFELXZEA-SYQRYTFTSA-N	446.342	1.136	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1c(F)ccc(O)c1F	1799724948	QCLRXKZJMXKFAP-OJLPPKNESA-N	447.276	1.905	50	20	IDGD	
Cc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)Br)C3)cc2c[nH]nc12	1799919637	XMHFSAHPGADKSW-FIUQPQMISA-N	435.322	1.858	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](NC(C)=O)C(C)(C)C)C2	1800637585	DSBVBAUZSOZFHV-JKJDWNRSSA-N	446.386	1.300	50	20	IDGD	
CCOc1cnc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](Br)CC)cn1	1800639136	ISSPSNJXHSRODK-ZWUHOBOKSA-N	441.326	1.252	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(-c3cccnc3)[nH]n1)C2	1800760576	SVPNNQVUCZKJSQ-DPYKFYPSSA-N	448.321	1.458	50	20	IDGD	
Cc1ccc(C(=O)C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Br)C3)cc1	1800884815	PUNJZWPWBLHOGL-HLPPOEQASA-N	427.270	1.458	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cn1cnc2ccccc21	1800889378	DKYQNMBRLFVMGP-ZZXMYQEDSA-N	439.343	1.862	50	20	IDGD	
C[C@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc3n(n1)CCCN(C)C3)C2	1801966030	CWADBLZRKZGFLN-XQLPTFJDSA-N	438.370	1.754	50	20	IDGD	
CCOC(=O)C(C)(C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](Br)CC)C2	1802091557	PORQXHRZOVNGFF-CRWXNKLISA-N	433.343	1.339	50	20	IDGD	
COc1ccc(CC(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)cc1O	1803136906	GCTMTHXYTYEHJQ-PLMTUMEDSA-N	447.919	1.644	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2n[nH]c3c2CCCC3)[C@H]1c1cccnc1)[C@H](O)CCl	1803138818	FNROWEOPQRDKJI-YJLNNSPDSA-N	431.924	1.603	50	20	IDGD	
C[C@H](CC(N)=O)C(=O)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@@H]1c1cccnc1	1803672638	ZEBZGHOZGALKIX-BQPHKTIFSA-N	429.290	1.289	50	20	IDGD	
O=C(Cn1cc([N+](=O)[O-])cn1)NC[C@H]1CCN(C(=O)C(Cl)Cl)[C@H]1c1cccnc1	1804421293	PAYOUDMFZVJDHB-DOMZBBRYSA-N	441.275	1.696	50	20	IDGD	
Cc1ncsc1C(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1805756914	ZIDKVWTWRHNPME-APWZRJJASA-N	444.561	1.539	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)Cc2cccs2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807362190	FNSOCICLWSJFOA-AVRDEDQJSA-N	449.341	1.385	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H]2C[C@@H]2C2CC2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1	1807365999	RFPGTCXHNVPACL-BDKRGJGYSA-N	433.317	1.127	50	20	IDGD	
C=C[C@H](O)C(C)(C)C(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1810254149	VPALOSHXRMBWFW-LVCYWYKZSA-N	445.564	1.034	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)C2=CCCC2)[C@H]1c1cccnc1	1810299053	NHUDNIBASOTWKQ-XLIONFOSSA-N	434.500	1.510	50	20	IDGD	
Cc1cc(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)nn1C(F)F	1811510148	MWDHPFPLTAVGLW-CWRNSKLLSA-N	441.866	1.901	50	20	IDGD	
C#CC(=O)NC[C@H]1CCN(C(=O)CN(C)NC(=O)NCc2ccccc2)[C@H]1c1cccnc1	1812530670	KBUZXLMTKDLTDZ-OFNKIYASSA-N	448.527	1.067	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)c2cnnn2C)[C@@H]1c1cccnc1	1812773213	AYHQJBBDJFMKJY-OFQRWUPVSA-N	435.326	1.703	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)COc2cccnn2)[C@@H]1c1cccnc1	1812868241	VTGBLSJKUXHNSL-DHSIGJKJSA-N	448.321	1.740	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)Cn2nc(C)cc2C)[C@@H]1c1cccnc1	1813028216	LFIZQJKODHKCRJ-CMKODMSKSA-N	433.940	1.855	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2ccnc(F)c2)[C@H]1c1cccnc1	1813069221	WDZBSUVIDHOZBE-UWJYYQICSA-N	442.495	1.308	50	20	IDGD	
CCS(=O)(=O)CC(=O)Nc1cc([C@@H]2CCCCN2C(=O)CO[Si](C)(C)C)[nH]n1	1815174770	XWTAXDZLVMMEKJ-AWEZNQCLSA-N	430.603	1.688	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1ccoc1Cl)CC2)c1ccc(B(O)O)cc1	1815343954	YUDYNLXMJRYJDW-GFCCVEGCSA-N	445.693	1.609	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H]1CC=CCC1)CC2)c1cccc(B(O)O)c1	1815349989	BTKQZBCXEOGEJM-CJNGLKHVSA-N	425.319	1.405	50	20	IDGD	
Cc1ccncc1C(=O)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1	1815354619	MQBQIFWVSCZFFS-HNNXBMFYSA-N	436.302	1.066	50	20	IDGD	
Cc1[nH]nc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)c1F	1816231513	WVPKCLFEUBPXBY-CYBMUJFWSA-N	434.476	1.259	50	20	IDGD	
O=C(CCBr)Nc1cc([C@H]2CCCCN2C(=O)Cn2ccncc2=O)[nH]n1	1816784984	UGUUKNAOKHQSJQ-CYBMUJFWSA-N	437.298	1.444	50	20	IDGD	
CC(C)(C)[C@H](O)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819401544	GZZBYAHGASHDLJ-NVXWUHKLSA-N	443.508	1.121	50	20	IDGD	
Cc1nc(N)sc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1	1822414261	PIMRFHQMKGHGEQ-ZDUSSCGKSA-N	448.553	1.436	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)[C@H]1C[C@@]1(F)Cl	1822502826	VLUJSGBCGVHMAD-WTANOLMUSA-N	434.664	1.320	50	20	IDGD	
O=C(N[C@@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1)c1cnc(O)nc1O	1823005420	ZWJOOWXHYMVTGX-MLUIRONXSA-N	446.258	1.261	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)CNC(=O)OC(C)(C)C)sc2C1	1825509615	NFPQBGKFAMAUGL-GHMZBOCLSA-N	446.957	1.834	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CCc2nc(NC(=O)[C@H](C)O)sc2C1	1825623968	KCZLSSHEGJHIBH-ONGXEEELSA-N	448.457	1.583	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CN1CCCCC1=O)CC2	1825647046	ICYCRCTYALEERX-WDEREUQCSA-N	443.367	1.851	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc([N+](=O)[O-])[nH]1)CC2	1826004314	ZCBJFXPDLDATLW-IUCAKERBSA-N	427.870	1.859	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)Cc1ccc3ncnn3c1)CC2	1826005944	BQLXTLIIQRMFBD-QWHCGFSZSA-N	448.936	1.594	50	20	IDGD	
Cc1ccc(C(=O)N[C@@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)c(C)n1	1826087984	MQRVNMYIAOUGFT-CQSZACIVSA-N	444.561	1.754	50	20	IDGD	
O=C(CCn1ccnn1)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](F)Br)CC2	1826878131	VDYHHHDACZMZKA-PRHODGIISA-N	431.291	1.427	50	20	IDGD	
Cc1ccc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)cn1	1827056214	QXQCESKWUMLQCI-QFIPXVFZSA-N	435.333	1.617	50	20	IDGD	
Cc1cc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)CC2)c[nH]1	1828927019	XWOVMBDGDLYOFI-HXUWFJFHSA-N	438.532	1.869	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3ccco3)C2)C1	1830535106	JFKIPBUSPYNGEG-BEFAXECRSA-N	443.338	1.700	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCN2C(=O)C=CC2=O)CC1	1831829051	XFBLESCABJXXRJ-DLBZAZTESA-N	439.940	1.175	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3ccc4cnccc4n3)CC2)CC1)[C@H](O)CCl	1833310001	GIWWOBRWHZMGQS-HXUWFJFHSA-N	445.951	1.415	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)n3cnnn3)CC2)CC1	1833535608	ZEMBMOHHQBBBND-RHSMWYFYSA-N	425.965	1.213	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cccnc3C(N)=O)CC2)CC1	1833919852	GQHYIMVBQOLQQT-KRWDZBQOSA-N	435.956	1.383	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](C)CBr)C3)C2)cn1	1833991503	UPVYASMOVYNNAG-LIRRHRJNSA-N	440.338	1.491	50	20	IDGD	
Cc1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](C)CBr)C3)C2)n1	1834047074	VZZCBHWZXGRHEO-IFXJQAMLSA-N	440.338	1.491	50	20	IDGD	
Cc1nc(C)c(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)s1	1834079725	RXRQLRDSTCXPEX-GTNSWQLSSA-N	446.367	1.613	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnoc3C3CC3)CCO2)C1	1834609944	QBDWNADWEAUHLZ-HXUWFJFHSA-N	425.913	1.887	50	20	IDGD	
Nc1nc(C(=O)NC2CCN(C3CCN(C(=O)[C@H](F)Br)CC3)CC2)cs1	1834751541	SQAUSXPGEUGOKJ-ZDUSSCGKSA-N	448.362	1.601	50	20	IDGD	
N[C@@H](CC(=O)N1CCC(N2CCC(NC(=O)[C@H](F)Cl)CC2)CC1)c1cccnc1	1835080342	QDGMKXSVLVBYNF-HKUYNNGSSA-N	425.936	1.578	50	20	IDGD	
CC(C)[C@H](S)C(=O)N1CCC(OC2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1	1836882655	GPGSMQTVRMOIJD-FQEVSTJZSA-N	442.626	1.312	50	20	IDGD	
Cc1ncccc1CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)CO[Si](C)(C)C)CCO2	1837710285	SQDXVFNTCCEWJG-JOCHJYFZSA-N	449.624	1.631	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)c(O)c1	1837717646	LJLMVDJHZFAOIG-OAQYLSRUSA-N	436.581	1.622	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(F)n3)CCO2)C1	1837902400	WXAIKBTWFJYSNF-FZKQIMNGSA-N	444.301	1.322	50	20	IDGD	
Cc1ocnc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)CBr)C2)C1	1838199629	LUQQQQLQTZLNEM-SJCJKPOMSA-N	430.299	1.084	50	20	IDGD	
COCc1c[nH]c(C(=O)N2CCO[C@@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)c1	1838512003	DTIXWCGFYAKDDT-FQEVSTJZSA-N	427.929	1.496	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CC34CCCN3CCC4)CCO2)C1	1839118816	QWBOQIJPHAMHQU-UTKZUKDTSA-N	427.973	1.479	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCn3nc(C)cc3C)C2)C1	1839149081	SSXZAFVUKHJMHE-YLJYHZDGSA-N	426.945	1.364	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3c[nH]c4ncccc34)C2)C1	1839149938	WUCVLUKWHGDHDX-PGRDOPGGSA-N	448.951	1.969	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](F)Br)CCO2)C1	1839198595	KDEUMIMSMFXRGS-XHDPSFHLSA-N	429.714	1.398	50	20	IDGD	
Cc1ccccc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839202133	VPDCIOOGTQHRJI-YJBOKZPZSA-N	429.286	1.756	50	20	IDGD	
O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(O)c(F)c1)CCO2	1839303971	GOWHSULTECVCCN-SFHVURJKSA-N	445.285	1.386	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3c(C)cccc3Cl)CCO2)C1	1839341650	GEULRFMZZURZAN-OXQOHEQNSA-N	445.343	1.972	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1Cc3ccccc3N1)CCO2	1839733679	UUWDUERDRCBCSE-JLMWRMLUSA-N	435.952	1.887	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccn3C)C2)C1	1839963694	SDOQTZKUKNUIKJ-RDTXWAMCSA-N	428.327	1.269	50	20	IDGD	
Cc1ccc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)cn1	1840031302	LQYFBNKRPAJZSZ-DNVCBOLYSA-N	440.338	1.172	50	20	IDGD	
Cc1ccc(C(=O)C(=O)N2CCO[C@@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)cc1	1840099918	JENQAFPRRWTTPH-IBGZPJMESA-N	429.300	1.438	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(C(C)C)no3)C2)C1	1840154114	LWJRJCFQUBDYDM-IFXJQAMLSA-N	429.901	1.122	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(N(C)C)cc3)C2)C1	1840154529	YNTAEULEQLDOCD-GHTZIAJQSA-N	439.940	1.076	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@](F)(C(=O)N2CC3(CCCN3C(=O)[C@@H](O)CCl)C2)C1	1841353613	GVVGUELUBSEJSL-XOBRGWDASA-N	447.935	1.529	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H]2C[C@]21C(=O)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1	1841353952	ZIDRASVRBULKRJ-LRDNONRASA-N	427.929	1.189	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@H]2CN(C(=O)OC(C)(C)C)CCO2)C1	1841428404	BOVBOSGXQMFKQJ-GJZGRUSLSA-N	429.945	1.843	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)CCOCCNC(=O)OC(C)(C)C)C1	1841515978	OQSDGFDPTVAHKA-HNNXBMFYSA-N	447.960	1.375	50	20	IDGD	
CN(CC(=O)N1CCCC12CN(C(=O)/C=C/C1CC1)C2)NC(=O)NCc1ccccc1	1845038343	RMEIKMAOYKPNTQ-ZHACJKMWSA-N	425.533	1.502	50	20	IDGD	
CN(CC(=O)N1CCCC12CN(C(=O)[C@H]1CCCCO1)C2)NC(=O)NCc1ccccc1	1845038397	YIEBXUHSBUFDNM-LJQANCHMSA-N	443.548	1.105	50	20	IDGD	
COCCOCCOCCOCCC(=O)N1CC2(CCCN2C(=O)C(Cl)Cl)C1	1846388567	XQPCNMVZYLPCEB-UHFFFAOYSA-N	441.352	1.080	50	20	IDGD	
CC[C@H](C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)N(CC)CC	1847873288	JQVSMTYOHMKPLQ-VLWPSUAZSA-N	430.553	1.443	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NCc1ccccc1S(=O)(=O)N(C)C	10259534	YHRVRADNKNFWLU-CYBMUJFWSA-N	438.481	1.374	50	20	IDGD	
Cc1cccc(C)c1-n1nnnc1SCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	15520532	BOAOWDFWSRYHSV-UHFFFAOYSA-N	427.446	1.741	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1C	15524760	CHKQVZKWBLQTKP-UHFFFAOYSA-N	447.513	1.164	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2ccc(OC)c(S(=O)(=O)N(C)C)c2)cc1OC	15793181	HZPZNUUHLMIVPP-UHFFFAOYSA-N	437.474	1.038	50	20	IDGD	
Cn1c(=O)c2ccccc2n2c(SCC(=O)NNC(=O)c3ccc(F)cc3)nnc12	16321359	NMNUERWTUMLASB-UHFFFAOYSA-N	426.433	1.274	50	20	IDGD	
O=C(NNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])C1=CN2CCS(=O)(=O)N=C2C=C1	21286122	JAWDFOLWVUOMLE-UHFFFAOYSA-N	431.352	1.554	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)c1ccc2c(c1)C(=O)N(C[C@H]1CCCO1)C2=O	25628864	LXBHGHCTIFPKOX-MRXNPFEDSA-N	425.416	1.604	50	20	IDGD	
Cc1ccc(-n2nc(C(=O)NNC(=O)c3n[nH]c(=O)c4ccccc34)c3c2CCC3)cc1	29066452	XHPKWXLVHLBUKM-UHFFFAOYSA-N	428.452	1.981	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CC[C@@H](CNC(=O)OC(C)(C)C)C1	725810538	QEQBKXFCTWKNRF-ZDUSSCGKSA-N	440.928	1.956	50	20	IDGD	
CN(C)C(=O)[C@H]1CCCN1CCCNC(=O)NNC(=O)CC12CC3CC(CC(C3)C1)C2	726278351	WESZEXAQVZTASB-GYVBGXKYSA-N	433.597	1.866	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc2c(c1)COC2)NNC(=O)CC12CC3CC(CC(C3)C1)C2	726379788	POISXQVDQDKZHC-UHFFFAOYSA-N	447.557	1.749	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2cccc(Cl)c2)c(C(=O)OC)s1	726520085	XLVOCSBIGRVSDO-UHFFFAOYSA-N	432.863	1.598	50	20	IDGD	
COc1cc(S(=O)(=O)N2CCOCC2)cc(C(=O)NN(C)c2ccccc2)c1OC	726543749	JGULUXBTTIEALX-UHFFFAOYSA-N	435.502	1.506	50	20	IDGD	
C[C@H]1CN(c2ccc(C(=O)NNc3ccc(S(=O)(=O)NC4CC4)cc3)cn2)C[C@H](C)O1	726867551	NCQJMYQRHXLHFW-GJZGRUSLSA-N	445.545	1.893	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@@H]2COc3c(cccc3OC)C2)c2ccccc2c1=O	728398865	KNMLRZLLULWZPX-AWEZNQCLSA-N	437.456	1.373	50	20	IDGD	
C#CCNC(=O)CN1CCN(C(=O)/C(C#N)=C\c2cc(C)n([C@@H](C)COC)c2C)CC1	728533516	LUVIXAWMLKTGFY-PKIWBCANSA-N	425.533	1.113	50	20	IDGD	
Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCC(C(=O)NNC(=O)CC(C)(C)C)CC1	728607881	FIBCCSNNRLCNQJ-UHFFFAOYSA-N	440.522	1.888	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2cccc(NC(=O)c3ccco3)c2)n1	728733060	PNXQMOQPOAVRJI-UHFFFAOYSA-N	442.453	1.844	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NC[C@H]2CN3CCC[C@@H]3CO2)c2ccccc2c1=O	729619014	NWXSJKXTQAOZSM-CVEARBPZSA-N	442.520	1.004	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)C1=NN(Cc2ccccc2)C(=O)CC1	730076975	FRHFGOAAYCWHLS-UHFFFAOYSA-N	441.513	1.749	50	20	IDGD	
O=C(NNC(=O)[C@H](Oc1ccc(F)c(F)c1)c1ccccc1)N[C@H]1CCS(=O)(=O)C1	730536846	WGJAHRMFJNDOPF-SUMWQHHRSA-N	439.440	1.602	50	20	IDGD	
O=C(COc1cccc(C(F)(F)F)c1)NN=C1CCN(CCN2CCOCC2)CC1	731557297	JQQCBBJLUHRIAJ-UHFFFAOYSA-N	428.455	1.984	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)N2CCN([C@@H]3CCN(c4ccccc4)C3=O)CC2)c1	732995989	VVLPPDOMRYWUPP-HXUWFJFHSA-N	432.484	1.336	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)N1CCN([C@@H]2CCN(c3ccccc3)C2=O)CC1	732998578	MTGOZKYGHMIDFL-LJQANCHMSA-N	437.500	1.473	50	20	IDGD	
CCOC(=O)C1=NN(c2ccccc2)[C@H](C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)C1	733109106	SLVJLUMXNJBMQC-FQEVSTJZSA-N	446.467	1.831	50	20	IDGD	
CC(=O)NCCc1ccc(S(=O)(=O)NNC(=O)c2cnn(-c3ccccc3)c2)s1	733122813	AURUKZOFUIMWCA-UHFFFAOYSA-N	433.515	1.236	50	20	IDGD	
C[C@@H]1CC(C)(C)C[C@]2(C1)NC(=O)N(CC(=O)NNc1nc3ccccc3c(=O)n1C)C2=O	733262374	SWKACRATDXCVKS-DMZKTXOQSA-N	440.504	1.513	50	20	IDGD	
Cn1nnnc1COC(=O)/C(C#N)=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	733381624	NWWPLTSBHLYQCT-JYRVWZFOSA-N	440.851	1.253	50	20	IDGD	
N#Cc1ccc(N2C(=O)N[C@H](CCC(=O)NNC(=O)CCc3ccccc3O)C2=O)cc1	733806684	JMBJCFHFOBLOIH-QGZVFWFLSA-N	435.440	1.249	50	20	IDGD	
CC1CCC(N2C[C@@H](C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)CC2=O)CC1	734239465	PIQFMOMMUURACP-SLTAFYQDSA-N	425.530	1.269	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)CNC(=O)c1ccc(F)c(F)c1	734251113	ZIVDWSLBJKWBTG-UHFFFAOYSA-N	440.472	1.915	50	20	IDGD	
CC(C)c1nc(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)nn1-c1cccc(F)c1	735461255	CZXHNRYLFSNPGG-UHFFFAOYSA-N	435.423	1.580	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1ccc(C)c(C(=O)NNC(=O)c2cnn(C)c2)c1	735471144	QWJHCROFQKFLAQ-UHFFFAOYSA-N	443.485	1.613	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@@H]2CSc3ccccc32)cc1	735585839	IVPBLZZUYQGJAH-MRXNPFEDSA-N	434.543	1.793	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)CN(Cc2cccnc2)c2ccccc2)C[C@@H](C)O1	735687630	PKJSVAVGZUPYTP-RTBURBONSA-N	425.533	1.735	50	20	IDGD	
C[C@H]1OC(C)(C)N(C(=O)OC(C)(C)C)[C@H]1C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	735876489	SCANSHYJTARBLO-IUODEOHRSA-N	445.480	1.184	50	20	IDGD	
O=C(COCc1ccccc1)NNS(=O)(=O)c1cccc(C(=O)NCC(F)(F)F)c1	737755988	LIBICNHNERWOFI-UHFFFAOYSA-N	445.419	1.505	50	20	IDGD	
Cc1ccc(O[C@@H](C)C(=O)N2CCN([C@H](C)C(=O)NNC(=O)CC(C)C)CC2)c(C)c1	738333431	VUXOZMAAYQZOJL-MOPGFXCFSA-N	432.565	1.797	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)CC[S@](=O)c2ccc3c(c2)OCCO3)c1	740738473	IACJRABPWADZON-PMERELPUSA-N	432.498	1.799	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)c1ccccc1	740853082	SVLQJXAQORBAHT-WDSOQIARSA-N	428.533	1.912	50	20	IDGD	
COc1ccccc1-n1cc(S(=O)(=O)NNC(=O)Cn2ccc3ccccc32)cn1	743258581	HYWSSUUWZMEAOX-UHFFFAOYSA-N	425.470	1.845	50	20	IDGD	
NS(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2cccc(Br)c2)s1	743517098	PZDFTECNZRVFLN-UHFFFAOYSA-N	433.309	1.302	50	20	IDGD	
C[C@H](CN1CCN(c2ccccc2)CC1)NC(=O)NNC(=O)[C@H]1COc2ccccc2O1	743632425	GRGUGXRNNNZEON-DYESRHJHSA-N	439.516	1.368	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CN2CCN([C@@H](CO)c3ccc(Cl)cc3)CC2)c1	744399308	ITSCHXYLSAUDDM-FQEVSTJZSA-N	430.936	1.761	50	20	IDGD	
Cc1nc2c(c(C)nn2C)c(C)c1CCC(=O)OCC(=O)NNC(=O)c1ccc(C#N)cc1	744544553	STIJARDKWFRPQA-UHFFFAOYSA-N	448.483	1.702	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)c2cc(C)c(C)c(S(=O)(=O)N(C)C)c2)c1	744582189	QTDIOGYOWKPRBQ-UHFFFAOYSA-N	447.513	1.480	50	20	IDGD	
C[C@@H]1Oc2c(cccc2C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)NC1=O	744619405	NHUREBHEOJNDMB-ZDUSSCGKSA-N	446.485	1.184	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)C[C@H]2CCCN(C(=O)NCC(C)C)C2)c1	745112921	WJVRFNIQXVZJEZ-QGZVFWFLSA-N	432.521	1.767	50	20	IDGD	
COc1cc(CNC(=O)NNC(=O)C(F)(F)Oc2ccccc2)ccc1OCC(N)=O	745616882	NEYAEHJYROWBFR-UHFFFAOYSA-N	438.387	1.062	50	20	IDGD	
C[C@@H]1C[C@H](NC(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)CCN1C	745855280	USZNYKTWHZFDBO-SJLPKXTDSA-N	448.527	1.872	50	20	IDGD	
Cn1ccc(N2CCC[C@H](NC(=O)NNC(=O)c3cc4c(s3)CCCCC4)C2=O)n1	745884302	UOCGMYFLWZZTPM-AWEZNQCLSA-N	430.534	1.890	50	20	IDGD	
CC[C@H](Nc1c([N+](=O)[O-])c(C)nn1C)C(=O)NNC(=O)C(F)(F)Oc1ccccc1	746297105	UCYBHYHYOLKWFV-LBPRGKRZSA-N	426.380	1.646	50	20	IDGD	
CN(C)CCOc1ccccc1CNC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	746978325	CCTDDQLXWKVGGL-UHFFFAOYSA-N	438.488	1.018	50	20	IDGD	
O=C(NC1CC1)c1cc(F)c(NNC(=O)[C@@]2(O)CCN(Cc3ccccc3)C2)c(F)c1	748829773	VFKKCCXDZNVHIW-JOCHJYFZSA-N	430.455	1.937	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2cc3ccccc3o2)sc1Br	749472865	UYNUNEMAZHOTBT-UHFFFAOYSA-N	444.288	1.979	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@H]3CCN(C)c4ccccc43)CC2)cc1	750786553	CUNJQWXACNRVGN-QFIPXVFZSA-N	435.572	1.884	50	20	IDGD	
CCOc1ccc(N2C[C@@H](C(=O)NNC(=O)CNC(=O)c3cccs3)CC2=O)cc1	751211798	VFJUIVHJYDRANL-ZDUSSCGKSA-N	430.486	1.077	50	20	IDGD	
COC(=O)COc1c(C)cc(C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc1C	752789175	KURWUKXXPLCJCR-UHFFFAOYSA-N	438.440	1.821	50	20	IDGD	
CCN(CCS(C)(=O)=O)C(=O)NNC(=O)c1ccc(Br)cc1Cl	753057007	JVXYAJZYYOPJTN-UHFFFAOYSA-N	426.720	1.823	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)C3(O)CCCCC3)c2)cc1	754979149	XQSFHPCEBIWPFN-UHFFFAOYSA-N	447.513	1.952	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)Cn2ccc3ccccc32)n([C@@H]2CCS(=O)(=O)C2)n1	755529976	CPFKGWRNNTURGA-OAHLLOKOSA-N	430.490	1.359	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)Nc1ccc(N2CCCS2(=O)=O)cc1	755594642	RVZQEYNCARRNKX-QGZVFWFLSA-N	432.458	1.219	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccccc2C(=O)N2CCOCC2)c1	755623352	NSDQNSCJZVSXEA-UHFFFAOYSA-N	446.485	1.029	50	20	IDGD	
CCNC(=O)COc1cccc(NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c1	755654614	FQHKFFIILNMIRQ-UHFFFAOYSA-N	434.474	1.072	50	20	IDGD	
CC(C)Oc1ccc(NC(=S)NNC(=O)c2coc(S(=O)(=O)N(C)C)c2)cc1	756137196	NHMOFZFLPZTHEU-UHFFFAOYSA-N	426.520	1.949	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ncn(Cc3ccccc3)n2)c1	756238305	RGJCPADRXDJYOU-UHFFFAOYSA-N	443.489	1.043	50	20	IDGD	
CN1CCN(CC(=O)N(C)c2ccc(NC(=O)NNC(=O)CC3CCCC3)cc2)CC1	756360371	SECZKQZFQJHFHG-UHFFFAOYSA-N	430.553	1.630	50	20	IDGD	
CCN1CCN(C(=O)Cc2ccc(NC(=O)NNC(=O)Cc3ccc(F)cc3)cc2)CC1	757576377	AIJXRUCQAGARMR-UHFFFAOYSA-N	441.507	1.928	50	20	IDGD	
Cc1nc(N2CCOCC2)ccc1NC(=O)NNC(=O)COc1ccccc1[N+](=O)[O-]	757734154	TTYTULQUBCCMTL-UHFFFAOYSA-N	430.421	1.367	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)Nc1ccc2c(c1)COC2	757853516	LBKWSSIVNGRUBZ-UHFFFAOYSA-N	430.486	1.968	50	20	IDGD	
Cc1cc([N+](=O)[O-])c(C)c(S(=O)(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)c1	758164948	WFEGZHFLXQKSAN-UHFFFAOYSA-N	430.483	1.826	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)NCCN1CCC(N(C)C)CC1	759595469	JPMZDKGFIBDXEJ-QGZVFWFLSA-N	427.549	1.964	50	20	IDGD	
CCCOc1ccc(CNC(=O)NNC(=O)C(=O)Nc2ccccn2)c(OC(F)F)c1	761781922	YKUFOPDQSAECSG-UHFFFAOYSA-N	437.403	1.941	50	20	IDGD	
Cc1ccc(C(=O)NNc2nccc(N3CCOCC3)n2)cc1I	762864854	FCCGAJKBKQGKNX-UHFFFAOYSA-N	439.257	1.983	50	20	IDGD	
NS(=O)(=O)c1scnc1C(=O)OCC(=O)NN=C(c1ccccc1)c1ccccc1	762953766	INBBVQDXGXZSSP-UHFFFAOYSA-N	444.494	1.516	50	20	IDGD	
CCOC(=O)c1[nH]c(C)c(S(=O)(=O)NNC(=O)CSc2ccccc2O)c1C	763411587	IXVVNBSLQOKWBN-UHFFFAOYSA-N	427.504	1.616	50	20	IDGD	
CC(C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2Br)cc1	763483132	NULGSVCTQSISGW-UHFFFAOYSA-N	447.289	1.987	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(N3CCOC[C@H]3C)cc2)cc1OC	763541980	CNHNGIGMCWVINH-CQSZACIVSA-N	442.472	1.329	50	20	IDGD	
Cc1c(Cl)cc(F)c(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1F	763571673	NQWXGLMKCXQOKK-CYBMUJFWSA-N	425.775	1.853	50	20	IDGD	
COCCn1nc(C)c(NC(=O)C(=O)NNC(=O)COc2cc(C)ccc2C(C)C)c1C	763594081	GKNAZNSGCZUHIA-UHFFFAOYSA-N	445.520	1.743	50	20	IDGD	
CCc1nnc(-c2ccc(NC(=O)C(=O)NNC(=O)c3c(C)nc4ccccn34)cc2)o1	763629934	SZMNJTXIYBJXLA-UHFFFAOYSA-N	433.428	1.655	50	20	IDGD	
CCOC(=O)/C=C/c1ccc(NC(=O)C(=O)NNC(=O)COc2cccc(C)c2)cc1	763631525	YNGIRVPTNLNWOJ-FMIVXFBMSA-N	425.441	1.736	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccnc2Oc2ccccc2)cc1	763673624	IDDCFGJXLYTHOI-UHFFFAOYSA-N	431.408	1.910	50	20	IDGD	
CCc1nnc(-c2cccc(NC(=O)C(=O)NNC(=O)COc3ccccc3F)c2)o1	763681626	HDNOGJDJIVKBRK-UHFFFAOYSA-N	427.392	1.603	50	20	IDGD	
COC(=O)c1c(NC(=O)C(=O)NNC(=O)c2cccc(N(C)C)c2)sc2c1CCCC2	763760419	NVCXTQDTBXQPKY-UHFFFAOYSA-N	444.513	1.879	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cccc(S(C)(=O)=O)c2)cc1	763859299	AHSDBYPPIGHNSK-CYBMUJFWSA-N	449.485	1.042	50	20	IDGD	
CCOC(=O)c1c(F)cccc1NC(=O)C(=O)NNC(=O)c1ccc(OCC)c(OC)c1	763900365	DNHWUWFNNUTDDF-UHFFFAOYSA-N	447.419	1.809	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cc(C(N)=O)ccc2F)ccc1OC(C)C	763916361	NRORTANKIJPTBL-UHFFFAOYSA-N	432.408	1.120	50	20	IDGD	
NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Br)s2)c(F)c1	763942332	YBMNQIQOINAPRI-UHFFFAOYSA-N	429.227	1.148	50	20	IDGD	
Cc1cc(C(=O)N2CCC[C@@H](C)C2)ccc1NC(=O)C(=O)NNC(=O)c1cccn1C	763999464	SNXFEAPNAZTZKS-CQSZACIVSA-N	425.489	1.605	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1ccc(C)c(C(=O)N(C)C)c1	764011946	MAMXLARCMBSYON-UHFFFAOYSA-N	432.864	1.759	50	20	IDGD	
O=C(Cc1cccc2ccccc12)NNC(=O)C(=O)Nc1cnn(Cc2ccncc2)c1	764028725	OIFKZWUCJYOJNF-UHFFFAOYSA-N	428.452	1.808	50	20	IDGD	
CCn1nnnc1-c1cccc(NC(=O)C(=O)NNC(=O)c2cccc(C(F)(F)F)c2)c1	764037638	RAEJUMBWEMMXRS-UHFFFAOYSA-N	447.377	1.779	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)nc1)C(=O)Nc1ccc(=O)n(Cc2ccccc2)c1	764092815	NZWGHYUSQRZGKW-UHFFFAOYSA-N	425.832	1.345	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3nc(C(C)(C)C)ns3)n[nH]2)cc1	764110202	GIWUDPYRWMPVDU-UHFFFAOYSA-N	427.490	1.934	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)CC(F)(F)F)c(OCC(F)(F)F)c1	764113328	WPAQYHCLXUFBFO-UHFFFAOYSA-N	445.272	1.453	50	20	IDGD	
C[C@@H]1CN(Cc2ccccc2NC(=O)C(=O)NNC(=O)c2ccc(C#N)cc2)C[C@@H](C)O1	764182700	PKBIJYNCBGRKAJ-HZPDHXFCSA-N	435.484	1.567	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CCc2ccccc2O)cc1C(=O)NC(C)C	764289696	YNARYSWKERPKSB-UHFFFAOYSA-N	426.473	1.558	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)C(=O)Nc1cccc(Cl)c1N1CCOCC1	764314475	XSLODAUUMGJLOJ-UHFFFAOYSA-N	434.855	1.644	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2cccc(Cl)c2F)CC1	764324629	VELCEVQDERBXAI-UHFFFAOYSA-N	427.889	1.567	50	20	IDGD	
CCn1nnnc1-c1cccc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)c1	764379783	KKBGRRBIRWNNHH-UHFFFAOYSA-N	445.386	1.118	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1ccc(C(=O)N(C)OC)cc1	764393543	HQPIRGDIDJAUAI-UHFFFAOYSA-N	446.485	1.207	50	20	IDGD	
C[C@H](NS(=O)(=O)c1cccc(C#N)c1)C(=O)NNC(=O)Cc1c[nH]c2ccccc12	764551086	CBTWWMNFHHYJOP-ZDUSSCGKSA-N	425.470	1.096	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)[C@H]2CN(C(=O)OC(C)(C)C)CCO2)cc1OC	764572229	LVCJUUQXYILNPA-QGZVFWFLSA-N	437.493	1.881	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)CC(C)(C)C)cc(Br)c1F	764662404	JIZBBWPQCQQVBO-UHFFFAOYSA-N	432.246	1.897	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)CCn2cc(Br)cn2)n[nH]1	765592842	SRWDESDUYGMOCD-UHFFFAOYSA-N	433.266	1.896	50	20	IDGD	
CON(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)cc1	765608480	WWFCJXHBFXKOTQ-UHFFFAOYSA-N	447.448	1.473	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	765754532	JUQHNTZVRLNDFO-UHFFFAOYSA-N	446.935	1.693	50	20	IDGD	
CON(C)C(=O)[C@H](CCSC)NC(=O)NNC(=O)CSc1ccc(Cl)cc1	767163645	KPUQZKGKULSNOK-ZDUSSCGKSA-N	434.971	1.904	50	20	IDGD	
CC(=NNC(=O)C[C@@H](C(=O)NN=C(C)c1occc1C)N1CCOCC1)c1occc1C	767786651	XKNTUGSGPAYAAI-SFHVURJKSA-N	443.504	1.961	50	20	IDGD	
COc1ccc(NNC(=O)c2ccc3c(c2)SC2=NS(=O)(=O)CCN23)c([N+](=O)[O-])c1	768331859	KCOGHXVMNOHDJV-UHFFFAOYSA-N	449.470	1.972	50	20	IDGD	
CCS(=O)(=O)c1ccc(F)c(C(=O)NNc2c(OC)cccc2S(C)(=O)=O)c1	768641687	VQZXIJVVMPWXQM-UHFFFAOYSA-N	430.479	1.788	50	20	IDGD	
Cc1cccc(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1Br	769257228	XWWQDKMAPPJSNU-CQSZACIVSA-N	434.246	1.683	50	20	IDGD	
COc1ccc(NNC(=O)Cn2c(CS(C)(=O)=O)nc3ccccc32)c([N+](=O)[O-])c1	769313434	XYKXKCPRXXTIRQ-UHFFFAOYSA-N	433.446	1.641	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)Cn2cnc3c(oc4ccccc43)c2=O)cc1C	769692889	JAFZKZFOIHZKQC-UHFFFAOYSA-N	433.424	1.546	50	20	IDGD	
CC(=O)Nc1cc(NC(C)=O)cc(C(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)c1	769694851	QXAXBZCUOQUUOJ-UHFFFAOYSA-N	425.445	1.620	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@@H](NCC(=O)NNC(=O)c1cccc(C#N)c1)C1CCCC1	769920522	JBTGZIRKUZBFTN-GOSISDBHSA-N	429.521	1.992	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(CC(=O)NNc2ccnc(Br)c2)C(=O)C1	771531923	GZRFLKSKLPZDDO-UHFFFAOYSA-N	428.287	1.367	50	20	IDGD	
CC(C)[C@H](NC(=O)OC(C)(C)C)C(=O)NCC(=O)NNc1ccnc(Br)c1	771537829	QMPHCDGBDWUXCQ-AWEZNQCLSA-N	444.330	1.953	50	20	IDGD	
Cc1cc(C)c(S(=O)(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)cc1C(=O)O	771606650	ILFGQUIFYFPPLW-UHFFFAOYSA-N	439.877	1.281	50	20	IDGD	
COc1ccc(Cl)c(S(=O)(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)c1	771609259	YPUWCMCVHWWEKD-UHFFFAOYSA-N	432.285	1.628	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)c1nn(-c2ccccc2F)cc1O	772884639	NEJZWKQGUCTRGC-UHFFFAOYSA-N	431.811	1.448	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)N[C@@H](c1ccccc1OC(F)F)C(F)(F)F	776001646	QFOCDTLOKNRZNM-KWQFWETISA-N	445.366	1.657	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)Nc1ccnn1[C@@H]1CCS(=O)(=O)C1	776054579	GWSFOAIUAHMOLS-NWDGAFQWSA-N	425.442	1.002	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)N[C@@H]2CCO[C@]3(CCS(=O)(=O)C3)C2)cc1	776075741	DIWCYGJMHUCRQA-RDTXWAMCSA-N	427.548	1.154	50	20	IDGD	
COc1cc(OC)cc(N2CC[C@H](NC(=O)NNc3cccc(S(C)(=O)=O)c3)C2=O)c1	776623269	KPMNCWANWZPBGU-SFHVURJKSA-N	448.501	1.539	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)N[C@@H]1CCN(c2ccc(F)c(Cl)c2)C1	778724228	GKZWGRNEHVDSSU-LLVKDONJSA-N	429.880	1.913	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)c(OC)c1	782121048	QJEGVCJVTBQVFC-CQSZACIVSA-N	443.456	1.652	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CCC[C@H](NC(=O)NNC(=O)CNC(=O)c2cccs2)C1	782562569	ZDSLXLGHZABUCB-QWHCGFSZSA-N	439.538	1.644	50	20	IDGD	
Cc1cccc(NC(=O)C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)c1Cl	782896260	DGTKVGPUXOXXDU-UHFFFAOYSA-N	437.909	1.650	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)C(=O)Nc1ccccc1C(C)C	782897480	PPBQREZMPWMOEW-UHFFFAOYSA-N	431.518	1.811	50	20	IDGD	
CCN(CC)C(=O)Cn1ccc2cc(NC(=O)C(=O)NNc3cc(C)nc(C)n3)ccc21	783326912	POCWYLXXYTUSFA-UHFFFAOYSA-N	437.504	1.998	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2ccc(C(=O)Nc3ccccc3)cc2)CCS(=O)(=O)C1	783425725	DBOPSUPBMBMCRC-FQEVSTJZSA-N	430.486	1.075	50	20	IDGD	
Cn1cnn(-c2ccc(NC(=O)C(=O)NNc3ccc(C#N)c(C(F)(F)F)c3)cc2)c1=O	784239401	ASOPNJQIHGUEIO-UHFFFAOYSA-N	445.361	1.543	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNc2ccc(Br)cn2)c(F)cc1F	784340984	HTJDYFCFRFIHOK-UHFFFAOYSA-N	429.177	1.991	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2Cl)c1	784384493	ICBHQKCVEVPDDI-UHFFFAOYSA-N	441.853	1.580	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CCOCC1)c1cc(-c2cccs2)[nH]n1	784456277	LROUMACTUQDEHM-KGLIPLIRSA-N	429.502	1.340	50	20	IDGD	
O=C(NNc1ncccc1Cl)C(=O)Nc1ccccc1OCC(=O)N1CCOCC1	784814823	NANKAKMHNZHXKX-UHFFFAOYSA-N	433.852	1.054	50	20	IDGD	
CN(NC(=O)Nc1ccn(CC(F)F)n1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	785859252	YTFSLDLAZRVWOQ-UHFFFAOYSA-N	431.444	1.789	50	20	IDGD	
Cc1ccc(N2CCNC2=O)cc1NC(=O)C(=O)NNC(=O)Cc1c[nH]c2ccccc12	787544588	WAXNHKYUMBIMCA-UHFFFAOYSA-N	434.456	1.335	50	20	IDGD	
COc1cc(F)ccc1NNC(=O)C1CCN(S(=O)(=O)c2c(C)noc2C)CC1	788189228	PARYCTISQYCNRO-UHFFFAOYSA-N	426.470	1.983	50	20	IDGD	
COc1cc(Cl)c(S(=O)(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1OC	790342023	RLMSUIFJOPRAMU-UHFFFAOYSA-N	428.850	1.752	50	20	IDGD	
C[C@H]1CN(C(=O)Cn2cc(NC(=O)NNc3cccc(F)c3[N+](=O)[O-])cn2)C[C@@H](C)O1	790512213	MYPPIDRZOXWKNT-TXEJJXNPSA-N	435.416	1.715	50	20	IDGD	
CC(=O)N1CCCN(c2ccc(F)cc2NC(=O)C(=O)NNc2cc(C)ccn2)CC1	790958001	PRQBBFRQSATFIQ-UHFFFAOYSA-N	428.468	1.670	50	20	IDGD	
CS(=O)(=O)c1c(Cl)cccc1NC(=O)C(=O)NNc1cccc(F)c1[N+](=O)[O-]	790998240	DPRUSDWKUQSKQO-UHFFFAOYSA-N	430.801	1.873	50	20	IDGD	
O=C(Cc1ncccc1F)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	792018348	WBLYPGZLPWECFQ-UHFFFAOYSA-N	431.427	1.983	50	20	IDGD	
CCOC(=O)c1cc(Br)ccc1NC(=O)C(=O)NNc1nc2ccccn2n1	792394583	RIBFEIUCPGBDGU-UHFFFAOYSA-N	447.249	1.750	50	20	IDGD	
CCn1nc(C)c(CC(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)c1C	794391496	CHLUUEBCTAIYHO-UHFFFAOYSA-N	426.565	1.336	50	20	IDGD	
COc1cc(Br)c(S(=O)(=O)NNC(=O)c2cccc(C)n2)cc1OC	794599541	JEGNJVBJIDVDHS-UHFFFAOYSA-N	430.280	1.793	50	20	IDGD	
N#C/C(=C\c1ccc(OCCn2cc(C(=O)O)nn2)c(Cl)c1)S(=O)(=O)NC1CC1	794944256	SOLHIRUMQYSTLF-NTUHNPAUSA-N	437.865	1.655	50	20	IDGD	
Cc1c(Br)cc(C(=O)NNc2ccccc2S(=O)(=O)N(C)C)c(=O)n1C	795169747	WBCFKXNIEHWLPO-UHFFFAOYSA-N	443.323	1.463	50	20	IDGD	
CN(CCC(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1)C(=O)OC(C)(C)C	796514744	HGSDAANVJUWRGZ-UHFFFAOYSA-N	443.545	1.973	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN2C(=O)c3cc(F)ccc3S2(=O)=O)cc1C	799913284	IRBRTCNSLWHVFJ-UHFFFAOYSA-N	425.463	1.364	50	20	IDGD	
CC[C@@](O)(C(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)c1cccc(Cl)c1	800320471	BHJIBZKTGFYPJH-IBGZPJMESA-N	435.820	1.850	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)CCC(=O)N2CCC(O)CC2)c(OC)cc1Cl	802077534	AIFUSIWTVCTHEX-UHFFFAOYSA-N	428.873	1.273	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)N[C@H](C)[C@@H](c1ccccc1)N(C)C	807404101	YUIGSAWWMLUUQW-PBHICJAKSA-N	446.577	1.924	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)NCCc1c[nH]c2cccc(Br)c12	812513732	WZYZLMRRFHVGTI-NSHDSACASA-N	427.299	1.855	50	20	IDGD	
CCNC(=O)c1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)c(C)c1	813033974	TYQWVMYSXXWRMJ-UHFFFAOYSA-N	447.517	1.077	50	20	IDGD	
COc1ccc(CN(C)C)cc1NC(=O)C(=O)NNc1ccccc1S(=O)(=O)N(C)C	815750531	CZKOKQPUKDVMQB-UHFFFAOYSA-N	449.533	1.089	50	20	IDGD	
Cc1nn(C(C)C)c(C)c1CC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	815854414	BMHPRGGMITZNOV-UHFFFAOYSA-N	448.593	1.703	50	20	IDGD	
CC(C)[C@H](C(=O)NNc1ccccc1S(=O)(=O)N(C)C)N1C(=O)c2ccccc2C1=O	817053290	LDVXUOXAIVQYJW-GOSISDBHSA-N	444.513	1.701	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)Cn2cccn2)c1	842471397	XPFQBMGCHHJEGS-UHFFFAOYSA-N	429.458	1.154	50	20	IDGD	
O=C(NNc1ccnc2cc(Cl)ccc12)C1=NN([C@H]2CCS(=O)(=O)C2)C(=O)CC1	913188091	GTMPCQAUWXKFQO-LBPRGKRZSA-N	435.893	1.497	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cnn1-c1ccc(F)cc1	913465478	DWHHHAMTVWORGD-UHFFFAOYSA-N	445.476	1.645	50	20	IDGD	
C[C@@]12CCC(=O)N1c1ccccc1C(=O)N2CC(=O)NNC(=O)c1c[nH]c2ccccc12	913557509	CMUIVNQAYFRNJT-QHCPKHFHSA-N	431.452	1.928	50	20	IDGD	
CCN1CCC[C@@H]1Cn1c(C)cc(C=NNC(=O)CSc2nnc(O)nc2O)c1C	914695487	XSEUDRSZHCUJOX-OAHLLOKOSA-N	433.538	1.428	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@H]2C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c(OC)c1	915063908	RCOMWOUGSCDEMZ-KRWDZBQOSA-N	442.428	1.678	50	20	IDGD	
CCOc1cccc(C=NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c1O	916258708	JPPBJVHNZZJGEI-UHFFFAOYSA-N	433.486	1.576	50	20	IDGD	
COc1ccccc1OCC(=O)NN=Cc1c(C)nn([C@@H]2CCS(=O)(=O)C2)c1Cl	916295773	CZMALXPDCCDCLV-CYBMUJFWSA-N	440.909	1.742	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(CNC(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)cc1	916646630	DTFAQDBSICVBAH-UHFFFAOYSA-N	434.562	1.984	50	20	IDGD	
CC(C)(C)C(=O)NNC(=O)C1CCN(S(=O)(=O)c2ccc3c(c2)OCCCO3)CC1	917180221	IYFZRHSHFYOPNF-UHFFFAOYSA-N	439.534	1.442	50	20	IDGD	
CSC[C@H](C(=O)NNC(=O)c1c(C)nc2ccccn12)N1C(=O)[C@H]2CCCC[C@H]2C1=O	917360466	ZHROOIAYHXADMY-QLFBSQMISA-N	443.529	1.311	50	20	IDGD	
Cc1nn(-c2ccc(Cl)cc2)c(C)c1/C=C(\C#N)C(=O)c1c(N)n(C)c(=O)n(C)c1=O	917623550	SEQXRMHVOPAAQB-UKTHLTGXSA-N	438.875	1.912	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NC2CCN(C(C)(C)C)CC2)c1	918094328	HAVMJDZYYQVFCH-UHFFFAOYSA-N	425.555	1.144	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCc2cccc(OC)c2OC)c2ccccc2c1=O	918233737	NQAFTHNNAQJYOL-UHFFFAOYSA-N	425.445	1.578	50	20	IDGD	
NC(=O)c1csc(C(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)c1	919700144	HOFPSYPNUTWGOR-UHFFFAOYSA-N	447.480	1.624	50	20	IDGD	
Cc1cc(Br)ccc1SCC(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1	919885177	KPLHYYKMYUSDNN-NSHDSACASA-N	436.353	1.367	50	20	IDGD	
CS(=O)(=O)c1ccc(OCCCCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1	921274266	WHMRAQITEAUPTN-LJQANCHMSA-N	448.497	1.627	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2nc(C3CC3)n(-c3ccccc3)n2)c2ccccc2c1=O	1115956246	XRXPBYFCIOTEDX-UHFFFAOYSA-N	443.467	1.949	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)N[C@@H]2CCO[C@]3(CCS(=O)(=O)C3)C2)c2ccccc2n1	1319831596	JSFQWAIWDCWEJM-JLTOFOAXSA-N	432.502	1.224	50	20	IDGD	
CCO[C@@H]1C[C@H](NC(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)[C@]12CCCO2	1320453929	CUGSNVXDVBQRCB-GCKMJXCFSA-N	440.541	1.691	50	20	IDGD	
CCS(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)s1	1321478607	JVLBBGMZDLHYBM-UHFFFAOYSA-N	445.544	1.089	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@H]2C(=O)NNC(=O)c2n[nH]c3c2CCCC3)c(OC)c1	1321629242	GAIFYHYMPDAAOJ-KRWDZBQOSA-N	441.488	1.372	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cccc3[nH]ncc23)C1	1777874110	QGONGHLRSQUJJI-YRISNDGFSA-N	434.924	1.944	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cccc3c[nH]nc23)C1	1777891777	MQJHCNOOUHRISZ-CBGDNZLLSA-N	434.924	1.944	50	20	IDGD	
Cc1cscc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)C2	1778227265	ZVYZYDAWWSTVNO-DYESRHJHSA-N	436.578	1.557	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(Cl)Cl)C2)c1cnc2[nH]ncc2c1	1778941751	RODFWPNWQUTEOC-FZKQIMNGSA-N	426.304	1.889	50	20	IDGD	
Cn1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](O)CCl)C3)c2cccnc21	1779185232	DURXXUNOMNOZGC-CBGDNZLLSA-N	434.924	1.301	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(OC)c(O)cc3[N+](=O)[O-])C2)C1	1780198967	WPUPKQGTGXUVGJ-BFUOFWGJSA-N	441.868	1.770	50	20	IDGD	
COc1cccc(OC)c1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2	1780541877	KYVSMZDVRSUPLQ-BFUOFWGJSA-N	441.322	1.931	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)N1CCN(C)CC1)C2	1780708674	YBLKERZPLPTQGK-BMQTXXJKSA-N	429.005	1.154	50	20	IDGD	
Cc1n[nH]c(C)c1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Br)C1	1780774641	FUQDSAZJBAUYGU-HACGYAERSA-N	431.306	1.845	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCNC(C)=O)C2	1781904711	AIHKBFKYUYTCKC-HDMKZQKVSA-N	432.359	1.200	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccnnc1O)C2	1781998377	ZJPBQCWHVDAHLX-CJBNDPTMSA-N	427.299	1.093	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](OC(C)=O)C(C)C)C2	1782175038	AVRANBHUBNHZPY-TVKQPGBESA-N	432.945	1.342	50	20	IDGD	
O=C(c1c[nH]c2c(Cl)cccc12)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1782451527	WYEJXPCZWOPUCA-HNAYVOBHSA-N	426.300	1.865	50	20	IDGD	
CN1CCCn2nc(C(=O)N3CC[C@@]4(C3)CN(C(=O)C(C)(C)CCl)CCO4)cc2C1	1782558437	JJYSWLZQTQBJNP-OAQYLSRUSA-N	437.972	1.427	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)C3CCC4(CC3)OCCO4)C2)C1	1782943922	FAXXWWKTUMLSMQ-RBUKOAKNSA-N	449.375	1.986	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](C)n1cccc1C=O)CCO2	1783341084	BELHVBRHBWBGND-SIXWZSSISA-N	440.338	1.865	50	20	IDGD	
CCc1[nH]nc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](Br)CC)C3)C2)c1F	1783345272	YRNJCRAONJFQMR-GTNSWQLSSA-N	431.306	1.728	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)c1cnc(Cl)nc1	1783379072	RGCGLAQKMOZXAA-VGDYDELISA-N	435.681	1.414	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3nnc(-c4ccccc4)o3)CCO2)C1	1783534155	QOPOPQWRSDRBLM-DJJJIMSYSA-N	449.305	1.964	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)Cc3ccc4c(c3)CCCO4)CCO2)C1	1783876179	WJPPZNROINXQMI-PGRDOPGGSA-N	436.936	1.638	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1CCC[C@H](C(=O)OC)C1)CCO2	1783879208	PRLYVGBLZJKJHF-OLPIVMHESA-N	430.929	1.050	50	20	IDGD	
O=C(C(Cl)Cl)N1CC[C@]2(C1)CN(C(=O)[C@@H]1C[C@@]13C(=O)Nc1ccccc13)CCO2	1783950053	KDOUIXXWGOCUKC-MRFFXTKBSA-N	438.311	1.530	50	20	IDGD	
COc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]3C2)n1	1787447439	WXYIJVLEMAUKGF-OUCVZQCGSA-N	430.820	1.126	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3c[nH]c(C)c3)[C@H]2C1	1787697013	RPWFYSNABNYWBN-IIYRHJEWSA-N	440.504	1.050	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4c(c3)OCO4)[C@H]2C1	1787810087	DNJNRBVNBYBQMH-YSLLHCQFSA-N	439.306	1.792	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)c1cc2ccccn2n1	1787845796	XJOMFQMIKHVRFD-MZGVZZPPSA-N	439.285	1.618	50	20	IDGD	
C[C@H](CBr)C(=O)NC1(c2ccc(NC(=O)CC[C@H](N)C(N)=O)cc2)CCC1	1788054595	JVYJQTOOZAMEME-DOMZBBRYSA-N	439.354	1.744	50	20	IDGD	
CCC(=O)N[C@@H](C)C(=O)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1	1788140358	NYFBSFLBMKOLQH-HNNXBMFYSA-N	437.305	1.029	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CC=CC[C@H]3C(=O)OC)C[C@@H]21	1789864598	GSAFVTIIVYTSBT-IZPLOLCNSA-N	426.941	1.739	50	20	IDGD	
CC(=O)N/C(C)=C/C(=O)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1	1791024076	SNZMWVKQFLGBIY-FYWRMAATSA-N	435.289	1.154	50	20	IDGD	
O=C(/C=C/c1ccc(O)c(O)c1O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21	1792217969	MCNUHILDZDCHCP-VWSXDQIGSA-N	445.299	1.600	50	20	IDGD	
Cc1noc(C)c1CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)CBr	1792869917	DASKDIZJVYILJG-ZKRNXSKHSA-N	442.354	1.845	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc[nH]n1	1793736805	HYNDWSSTUCHYDV-XFMPKHEZSA-N	425.917	1.794	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnc(OC)c(F)c1	1794365120	KDCGRHNDQYZMAC-XFMPKHEZSA-N	444.301	1.606	50	20	IDGD	
CCc1nn(C)c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)Br)C3)c1Cl	1794424876	DADDBHUFVWFMGU-NJBDSQKTSA-N	447.761	1.623	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnoc1C1CC1	1795007739	JRXUFUHRWCLAFT-AYRXBEOTSA-N	426.311	1.929	50	20	IDGD	
O=C(Cc1ccccc1C(F)(F)F)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2	1795231141	VDVHYOMXQNKUGD-YXPYIKCWSA-N	434.842	1.437	50	20	IDGD	
CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2)C(=O)OC(C)(C)C	1795336504	LGWWOMJKRDGMSQ-YWVIFJGQSA-N	448.358	1.228	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](O)c1ccccc1	1795386089	KYMQCHYWLBKTCJ-ZHCJQAHYSA-N	425.323	1.483	50	20	IDGD	
Cn1c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Cl)C3)cc2c1-c1ncccc1OC2	1795936186	LMRGGYLWPDNKOR-UESRRSCYSA-N	448.882	1.717	50	20	IDGD	
N#Cc1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)c(Cl)c1	1796189497	VGBDZNPRENEROO-BCDXTJNWSA-N	437.692	1.457	50	20	IDGD	
C=C[C@@H]1C[C@]1(NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Cl	1796371320	VCSRYHDVGWSAHC-CMVVLZHBSA-N	445.919	1.580	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnnc(Cl)c1)C2	1796890917	PFUFHJRNVUMXPM-WCDSHICPSA-N	443.895	1.516	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnc2sc(C)cn2c1=O	1797063402	JHZLUTHFKWWFSG-NEBZKDRISA-N	438.937	1.285	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cc(F)cc(F)c1)C2)[C@H](F)Br	1799346464	RFVTXAIPBXQKIJ-OJXGSEEGSA-N	435.240	1.787	50	20	IDGD	
Cn1cc2cc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@@H](F)Br)ccc2n1	1799348485	JDMVNHYFBMHCSY-OCVGTWLNSA-N	439.285	1.467	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc2ccnn12	1799903457	QFKBVRZPPGGZNK-ZJOBFFGXSA-N	435.322	1.569	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nc[nH]n1)C2)[C@H](Br)Cc1ccccc1	1800436100	QUINBXPHKBNZCM-QKPAOTATSA-N	448.321	1.014	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](NC(C)=O)C(C)(C)C)C2	1800637589	DSBVBAUZSOZFHV-XFIYOXNOSA-N	446.386	1.300	50	20	IDGD	
CC(C)COc1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CCC(=O)NN(C)C)ccn1	1802332723	GOYVJUACOAGHLV-REPLKXPHSA-N	445.564	1.741	50	20	IDGD	
Cc1ccc(CCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)c(C)n1	1802745917	VVTHCMLTCRYMIQ-KOUNCHBCSA-N	435.333	1.263	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccccc1OC(F)F)c1cccc(B(O)O)c1	1803773166	DSGSHFWWGSOTBZ-BJWYYQGGSA-N	444.243	1.533	50	20	IDGD	
CC(C)(C)n1ccc(C(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)n1	1805042181	YTFFSENWPDVNRC-CGTJXYLNSA-N	433.940	1.952	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2cccn2C)[C@H]1c1cccnc1	1805358962	SBHNGDHPYIITLY-LAUBAEHRSA-N	426.521	1.113	50	20	IDGD	
Cc1ccc(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)s1	1805409019	MRNGKFGODPDHKG-NQIIRXRSSA-N	449.341	1.765	50	20	IDGD	
CCOC(=O)/C=C/C(=O)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@@H]1c1cccnc1	1806297588	MGBKNEKXJGIRPK-NTQUSYDVSA-N	442.285	1.897	50	20	IDGD	
O=C(CCBr)NC[C@H]1CCN(C(=O)Cc2cnccn2)[C@H]1c1cccnc1	1806343036	RNPRHAPMBUAKMJ-BEFAXECRSA-N	432.322	1.905	50	20	IDGD	
C[C@H](C(=O)N1CC[C@@H](CNC(=O)CCBr)[C@@H]1c1cccnc1)n1cnnn1	1806347378	WGCNLAFVPNWIMY-INWMFGNUSA-N	436.314	1.120	50	20	IDGD	
CC(=O)NC[C@@H]1CCN(C(=O)CN(C)NC(=O)NCc2ccccc2)[C@H]1c1cccnc1	1806718596	HNGHDAXCFUNELC-UNMCSNQZSA-N	438.532	1.454	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H](CNC(=O)CN2CCCC2=O)[C@@H]1c1cccnc1	1806924096	PWYJQHUJODYDIP-UTKZUKDTSA-N	432.597	1.561	50	20	IDGD	
O=C(NCCC(=O)N1CC[C@H](CNC(=O)[C@H](F)Cl)[C@@H]1c1cccnc1)c1ccc[nH]1	1808308507	KPHUXTAVDJGYMI-JLSDUUJJSA-N	435.887	1.770	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)/C=N/N2CCCCC2)[C@@H]1c1cccnc1	1810289064	OKBYGIAQRQJQRQ-LVPXVQOHSA-N	435.956	1.813	50	20	IDGD	
Cc1cc[nH]c1C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1	1810298065	GDBSXYAZZOZSJS-UZLBHIALSA-N	447.499	1.350	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC2(CCCN(C(=O)c3cnc(O)nc3O)C2)CC1	1810872170	AMULKVSZZPCBKM-NSHDSACASA-N	427.299	1.516	50	20	IDGD	
CC(=O)N[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)CBr)[C@H]1c1cccnc1	1812645909	NOYGEKNUKJIZOD-RMHZUWNSSA-N	439.354	1.643	50	20	IDGD	
O=C(Cc1ccc2c(c1)CCO2)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1	1812824111	JPAPHUWWTFKKCW-NNMXDRDESA-N	443.931	1.865	50	20	IDGD	
CC(=O)N/C(C)=C/C(=O)N1CC[C@H](CNC(=O)[C@H](C)Br)[C@H]1c1cccnc1	1812869055	QDYNLNLIRHYCAG-NFHBXGPASA-N	437.338	1.911	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2cnc3ncccn23)[C@H]1c1cccnc1	1813030193	HSQNIBLKTUNAMU-RYRKJORJSA-N	442.907	1.698	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)[C@@H]2CCc3nc[nH]c3C2)[C@@H]1c1cccnc1	1813034046	ZPNZZMWQTKVLAK-HSSOGYSNSA-N	445.951	1.869	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2cscn2)[C@@H]1c1cccnc1	1813071227	QRFMLENYKIMJJH-DNVCBOLYSA-N	430.534	1.231	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2ncccc2F)[C@@H]1c1cccnc1	1813074157	QWUQJOPXBOCVDR-IIBYNOLFSA-N	442.495	1.308	50	20	IDGD	
O=C(CCc1ccccc1)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1	1815339579	HXMZUJFKKMCIGX-GOSISDBHSA-N	449.341	1.682	50	20	IDGD	
O=C(COc1ccccc1)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1816859181	RLIZZDYVEGACFJ-HXUWFJFHSA-N	448.288	1.474	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@H]2CCCSC2)[nH]n1)c1ccc(B(O)O)cc1	1817475055	KHMCWJDSBCQUSI-MAUKXSAKSA-N	442.350	1.539	50	20	IDGD	
Cc1ccc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2ccc(B(O)O)cc2)CC3)cc1C	1822143748	RTPZPIRSBZUHLS-SFHVURJKSA-N	449.341	1.979	50	20	IDGD	
C[C@H](Br)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN2C(=O)C=CC2=O)[nH]n1	1822193081	ZYDXXHMTXUFUCR-JQWIXIFHSA-N	438.282	1.110	50	20	IDGD	
CCn1nccc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1	1822413544	ZCTSZZAEXPMQOI-HNNXBMFYSA-N	430.513	1.305	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CN2CC(=O)NC2=O)CC1	1824010866	HUGHFSVEQVIIQT-HNNXBMFYSA-N	426.945	1.423	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC[C@H]1C1CCN(C(=O)Cn2ccnn2)CC1	1824092958	JRXVSHFYMQSOLI-ZBFHGGJFSA-N	426.359	1.929	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)Cn2cncn2)CC1	1824094466	WTRCVKFAVHJXFN-GOEBONIOSA-N	426.359	1.929	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)Cn1cncn1)CC2	1825446269	ASYHEMDJKSCOTD-ZJUUUORDSA-N	427.328	1.520	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)C(=O)c1ccccc1)CC2	1826080733	VPCDBMKJTIOROZ-CQSZACIVSA-N	443.529	1.311	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)CCCn3ccnc3)sc2C1	1826690463	KXXFUHYMOKYQRH-CHWSQXEVSA-N	425.942	1.986	50	20	IDGD	
Cc1nscc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827056578	ZGOYTTVKOZHOBV-FQEVSTJZSA-N	441.362	1.678	50	20	IDGD	
O=C(CN1C(=O)CSC1=S)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](F)Cl)CC2	1828244593	KXYSQHXXGBWUPG-KGFZYKRKSA-N	436.943	1.450	50	20	IDGD	
NCC(=O)N1CC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCN2C(=O)OCc1ccccc1	1829359918	MECPJMMZAWRCHK-LJQANCHMSA-N	443.331	1.201	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4ncsc4[nH]3)C2)C1	1830365263	WAZWIIHRKNRDTJ-LJQANCHMSA-N	440.953	1.959	50	20	IDGD	
O=C(CCc1c[nH]c2ccccc12)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1830722567	DGRGBAPGRBDIPQ-KNQAVFIVSA-N	449.935	1.157	50	20	IDGD	
O=C([C@H](O)CCl)N1CCC([C@@H]2CCCCN2C(=O)[C@H]2CC(c3ccccc3)=NN2)CC1	1831062197	RSJGYRSBKQLFER-QHAWAJNXSA-N	446.979	1.972	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc(Cl)nc3)C2)C1	1831638850	HSDDUOAENJCMAV-RDTXWAMCSA-N	431.320	1.608	50	20	IDGD	
Cc1ccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)nc1	1831872538	ZWEKVTLZFWEXHO-HXUWFJFHSA-N	429.565	1.996	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(O)ccc2O)CC1	1831873872	CICKMWWYVDOFJI-LJQANCHMSA-N	446.548	1.704	50	20	IDGD	
CC(=O)N1CCN(CC(=O)N2CCC([C@H]3CCCCN3C(=O)C(Cl)Cl)CC2)CC1	1831877799	LYMBKJCTVRAAEU-QGZVFWFLSA-N	447.407	1.574	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)CN3CCC(C)CC3)CC2)CC1	1833407444	JMWYHWNTZYFLCD-HXUWFJFHSA-N	443.032	1.544	50	20	IDGD	
CCc1[nH]nc(C(=O)NC2CCN(C3CCN(C(=O)[C@H](Cl)COC)CC3)CC2)c1F	1834040174	MZVGAVSYTLSXAN-OAHLLOKOSA-N	443.951	1.550	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(F)cn3)CCO2)C1	1834481405	OCMNZKDWLFTJRU-ROUUACIJSA-N	434.295	1.527	50	20	IDGD	
CCc1oncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)CBr)C2)C1	1834514381	WTJNSAKMZIJCOL-FZKQIMNGSA-N	444.326	1.338	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](N)c1cccc(Cl)c1)CCO2	1835733290	LQOLPIRQAIOTRF-ZWOKBUDYSA-N	444.359	1.814	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)C3=C(C)OCC3)CCO2)C1	1836274504	FRNJALHEBWXEOR-YJBOKZPZSA-N	431.327	1.311	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)c3cc(O)n(C)n3)CC2)CC1	1837271209	LEXSZTDGEJNGHL-LBPRGKRZSA-N	443.342	1.521	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cccc(OC)n3)CC2)CC1	1837353360	RFCQIIISAIJPDF-KRWDZBQOSA-N	439.940	1.956	50	20	IDGD	
O=C(CCBr)N1CCC(OC2CCN(C(=O)c3cnccn3)CC2)CC1	1837410694	LKMZBXULPFYJLQ-UHFFFAOYSA-N	425.327	1.874	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cc(C)nn3C)CC2)CC1	1837465161	GFEVSNNJUIIZRY-KRWDZBQOSA-N	426.945	1.595	50	20	IDGD	
CC(C)c1cc(C(=O)N2CCOC[C@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)on1	1837714395	CEAZTGBRRFGOAC-FQEVSTJZSA-N	439.585	1.720	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(Cl)ccn3)C2)C1	1837715593	ZOLKYBGJNVALRM-IBGZPJMESA-N	441.988	1.657	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccncc3O)CCO2)C1	1837819529	ORUGXKBOPNPKJF-QZTJIDSGSA-N	432.304	1.094	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(F)nc1)CCO2	1837847178	PMAHKOCHXBJPAU-IBGZPJMESA-N	425.533	1.142	50	20	IDGD	
O=C(CC1(O)CCC1)N1CCC(OC2CCN(C(=O)[C@H](F)Br)CC2)CC1	1838648321	QXIMQHXXCUCZMJ-INIZCTEOSA-N	435.334	1.981	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)c(C)n1C	1839200357	JFZOWGZIMAMEEP-CRAIPNDOSA-N	446.317	1.402	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(C)c4n[nH]cc4c3)CCO2)C1	1839511304	QYQCRVBSGOTPQV-DYESRHJHSA-N	434.924	1.959	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)OC(=O)OCC)CCO2	1839681621	UXXYLCLPZJIVBP-VCBZYWHSSA-N	434.917	1.412	50	20	IDGD	
CCc1nc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](Br)CC)CCO3)co1	1839965621	FNQLEDMHWVVCAM-ACJLOTCBSA-N	444.326	1.481	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)cc1O	1840034234	FOXMGEWBCOIXHN-LIRRHRJNSA-N	441.322	1.554	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CSC3CCCC3)C2)C1	1840150090	FJZQSKXIHLDKHM-QFBILLFUSA-N	434.986	1.372	50	20	IDGD	
CC(C)(C)OC(=O)N1CCCC[C@H]1C(=O)N1CCCC12CN(C(=O)[C@@H](O)CCl)C2	1844256339	ASMJTCNWMLVUCU-GJZGRUSLSA-N	429.945	1.579	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)Cc2cc(F)ccc2F)C1	1846973009	MUIBYEQKCFWVLK-UHFFFAOYSA-N	429.427	1.023	50	20	IDGD	
Cc1nn(-c2ccccc2)c2sc(C(=O)NNC(=O)C[C@H]3CCS(=O)(=O)C3)cc12	10105053	APRIFWRKFYUPLC-CYBMUJFWSA-N	432.527	1.981	50	20	IDGD	
O=C(COC(=O)c1cc(I)ccc1O)NNC(=O)c1ccccc1	10590171	JRCSIKKJWPNJAJ-UHFFFAOYSA-N	440.193	1.615	50	20	IDGD	
Cc1nc(C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)nn1-c1ccc(F)cc1	16398096	QALNJOLBVHQJEF-UHFFFAOYSA-N	442.363	1.241	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCCCC2)cc1)NNC(=O)c1ccccc1O	17574154	SYDOKXBXZZSSAN-UHFFFAOYSA-N	431.514	1.961	50	20	IDGD	
CCOc1ccccc1-n1nnnc1SCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	20818120	RNGGFLWNRMDVFD-UHFFFAOYSA-N	443.445	1.523	50	20	IDGD	
Cc1nnnn1[C@H](Cc1ccc(F)cc1)C(=O)NNC(=O)c1cc(Br)c[nH]1	71913187	PCMPJHSJBVPRCI-CQSZACIVSA-N	436.245	1.456	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)c1ccc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1	115150658	RDBDPWBSBFZEQM-UHFFFAOYSA-N	443.441	1.809	50	20	IDGD	
CCCn1c(=O)n(CCC(=O)NNC(=O)CNc2ccc(OC)cc2)c2ccccc21	140104861	WRKIQTSXDPLGQB-UHFFFAOYSA-N	425.489	1.871	50	20	IDGD	
C#Cc1cccc(NC(=S)NNC(=O)CN2C(=O)N[C@@]3(CCc4ccccc43)C2=O)c1	727497761	LZKJROBTWHJKRH-JOCHJYFZSA-N	433.493	1.379	50	20	IDGD	
O=C(CCN1CCCC1=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	727864763	AWXKPLCGGZOEHI-UHFFFAOYSA-N	433.468	1.218	50	20	IDGD	
COc1ccc(-c2nn(CCC#N)cc2C(=O)NNC(=O)Cc2cccnc2)cc1[N+](=O)[O-]	728893231	MPNBQBJJHWVJDB-UHFFFAOYSA-N	449.427	1.779	50	20	IDGD	
COCCOc1cn(-c2ccccc2)nc1C(=O)NNC(=O)COc1ccccc1F	729298158	VAJLZDAIPZHXQO-UHFFFAOYSA-N	428.420	1.877	50	20	IDGD	
CC(=NNC(=O)Cc1ccc(F)cc1)c1cccc(N(S(C)(=O)=O)S(C)(=O)=O)c1	729816248	FUQKFFILWDUZFD-UHFFFAOYSA-N	441.506	1.634	50	20	IDGD	
Cc1ccc(C)c(S(=O)(=O)NCCC(=O)NNC(=O)c2cccc3ncccc23)c1	730225468	DZTQFAAGOWICQJ-UHFFFAOYSA-N	426.498	1.981	50	20	IDGD	
CCNC(=O)COc1ccc(CNC(=O)NNC(=O)Cc2ccccc2F)cc1OC	731362499	GYQQEVPKWKSGOQ-UHFFFAOYSA-N	432.452	1.422	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(C)s2)C1	731491759	VABZUXVBVDOSRQ-AWEZNQCLSA-N	437.543	1.927	50	20	IDGD	
COc1ccc(-c2nc3c(s2)[C@@H](NC(=O)NNC(=O)C(=O)NC2CC2)CCC3)cc1	731762435	CGYLADMRXWJOHH-HNNXBMFYSA-N	429.502	1.805	50	20	IDGD	
CCOc1ccc(N2C(=O)c3ccc(C(=O)NNC(=O)c4c[nH]nc4C)cc3C2=O)cc1	731853139	RQDOLKFVPANVFK-UHFFFAOYSA-N	433.424	1.992	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)N2CCN(S(N)(=O)=O)CC2)c(C)n1-c1ccc(F)cc1	732069469	XJJTYVMJEOULCG-ATVHPVEESA-N	431.493	1.488	50	20	IDGD	
CSc1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)o1	732727007	UGVDPODUULTDGA-UHFFFAOYSA-N	425.488	1.097	50	20	IDGD	
CCOC(=O)C1=NN(c2ccccc2)[C@H](C(=O)NNc2nc3ccccc3c(=O)n2C)C1	733260333	AGMJXGKOPQVTGQ-SFHVURJKSA-N	434.456	1.575	50	20	IDGD	
CN(C)N(C(=O)c1nn(-c2ccccc2C(F)(F)F)cc1O)[C@H]1CCS(=O)(=O)C1	733371361	WUEHLUZDZSBTAZ-NSHDSACASA-N	432.424	1.703	50	20	IDGD	
CC(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)cc1	734241412	OKFCCQDNOCIDCU-UHFFFAOYSA-N	428.511	1.337	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(N2CCOCC2)c(C(=O)NNc2ncccc2Cl)c1	734247495	ONMKLZCKZDOJQF-UHFFFAOYSA-N	439.925	1.579	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)CS(=O)(=O)c2ccc(C(C)=O)c(F)c2)c1	734810011	QZNNAFHPBNBQOX-UHFFFAOYSA-N	438.433	1.280	50	20	IDGD	
Cc1ccc2[nH]c(C(=O)NNc3ncccc3S(=O)(=O)N3CCN(C)CC3)cc2c1	735116645	AXHBABSRMVXGKS-UHFFFAOYSA-N	428.518	1.564	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1csc(Nc2ccccn2)n1	736065477	HFWOTPPTUQWTPI-UHFFFAOYSA-N	445.530	1.958	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)Cn2ncc3ccc([N+](=O)[O-])cc32)cc1C	736783639	FWGOJZOCPBXHHY-UHFFFAOYSA-N	445.457	1.881	50	20	IDGD	
CC(=NNC(=O)[C@H](C)CN1CCCCC1)c1cccc(S(=O)(=O)N2CCOCC2)c1	739414047	UYLFEBZZFPOUDM-QGZVFWFLSA-N	436.578	1.670	50	20	IDGD	
C[C@@H]1CN(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)CC[C@@H]1NC(=O)OC(C)(C)C	740903237	LHDNVVZIVCVPLP-CJNGLKHVSA-N	444.496	1.252	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NC[C@H](O)c1c(Cl)cccc1Cl	740913191	PXGAZJRVFJOAPG-NSHDSACASA-N	431.301	1.849	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)COCc1ccccc1)[C@H]1CN(Cc2ccccc2)CCO1	741276921	BZGHQYYHPMLVMU-GHTZIAJQSA-N	426.517	1.823	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)c2c[nH]cc2-c2ccc3c(c2)OCCO3)c1	742045965	KTDYEGDVEXFPKY-UHFFFAOYSA-N	441.465	1.931	50	20	IDGD	
COc1cc(C(=O)NNC(=O)N[C@@H]2C[C@H](C)N(c3ccccc3)C2=O)cc(OC)c1OC	743506938	SWRNSMARCDUQGA-XJKSGUPXSA-N	442.472	1.850	50	20	IDGD	
CS(=O)(=O)NC[C@@H]1CCCN(C(=O)NNC(=O)c2cccc(Br)c2)C1	743686790	HWSVBEMIWRFMHH-NSHDSACASA-N	433.328	1.065	50	20	IDGD	
CC(C)S(=O)(=O)c1ccc(F)c(C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)c1	745002312	MPUKBLKIYCAPAI-UHFFFAOYSA-N	447.444	1.497	50	20	IDGD	
O=C(COC(=O)[C@@H]1SCCc2sccc21)NNC(=O)[C@@H]1COc2ccccc2O1	745636814	OCQBVNHYDXZWIJ-WMLDXEAASA-N	434.495	1.609	50	20	IDGD	
O=C(NCCN/C(O)=C1\N=CC=CC1=O)NNc1c(F)cc(F)cc1Br	745813560	OWKGEFBXBFQTAP-BUHFOSPRSA-N	430.209	1.880	50	20	IDGD	
O=C(COC[C@H]1CCCO1)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	746385518	FNQCYMYBGXVEJY-LJQANCHMSA-N	436.472	1.345	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)[C@H](C)S(=O)(=O)c2ccc(F)cc2)o1	746396762	CPFCGVLQVLPGJY-ZDUSSCGKSA-N	425.482	1.884	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)CC[C@H]2Cc3ccccc3NC2=O)n1	746920972	ZQWNRKJEKXBURG-AWEZNQCLSA-N	430.486	1.276	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2ccc(C#N)cc2)s1	747298106	BTVKUMCERAZYTM-UHFFFAOYSA-N	435.531	1.794	50	20	IDGD	
Cn1cc(NS(=O)(=O)c2ccsc2C(=O)NNC(=O)c2ccc(Cl)nc2)cn1	751334486	CDSVBTRAPLFZEI-UHFFFAOYSA-N	440.894	1.406	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=S)NCCc3ccccn3)n[nH]2)cc1OC	751618156	PGCGZRALBGOSSP-UHFFFAOYSA-N	426.502	1.841	50	20	IDGD	
CS[C@@H](C)CNC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	752700018	LTBKKLVIUNTRJC-AWEZNQCLSA-N	436.559	1.861	50	20	IDGD	
O=C(NN=C1CCCC[C@@H](N2C(=O)c3ccccc3C2=O)C1)N[C@H]1CCS(=O)(=O)C1	752728255	YFTYWRXIXJRGIZ-LSDHHAIUSA-N	432.502	1.458	50	20	IDGD	
CNC(=O)CCCN(C)C(=O)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1	753042517	RWMNDUBACOKYFE-NRFANRHFSA-N	437.544	1.812	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)NCc2ccc([S@@](C)=O)cc2)c2ccccc2c1=O	753053172	YYNPKJJBZUPZGQ-WJOKGBTCSA-N	441.513	1.859	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNS(=O)(=O)c1cnc2ccsc2c1	753067147	DRSTWXPWKFWEIC-UHFFFAOYSA-N	439.544	1.521	50	20	IDGD	
COc1cccc(C(=O)NNS(=O)(=O)c2ccc3c4c(cccc24)C(=O)N3C)c1O	753773784	CSEKPAWNMPJPTD-UHFFFAOYSA-N	427.438	1.767	50	20	IDGD	
COc1cc(CN2CC[C@@H](NC(=O)NNC(=O)COc3ccccc3F)C2)cc(OC)c1	755083456	CJCBYHSVCVPBBA-MRXNPFEDSA-N	446.479	1.827	50	20	IDGD	
CCS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc1	755600818	UWCAWMDFJSCQQY-UHFFFAOYSA-N	429.458	1.838	50	20	IDGD	
C=CCN(C)S(=O)(=O)c1ccc(NC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1	755932020	IUTPSCCXCPJXCZ-UHFFFAOYSA-N	433.446	1.868	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)Nc2cccc(CS(=O)(=O)NC(C)(C)C)c2)n1	756206036	NEMPRYIXOCAHHC-UHFFFAOYSA-N	436.538	1.571	50	20	IDGD	
COc1c(Br)cc(Cl)cc1NC(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1	756430809	LFLCQBPEOQCCAX-ZETCQYMHSA-N	440.703	1.699	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)Cc2ccn(-c3ccccc3)n2)cc1OC	757166984	NFLYSSOZGBTCLU-UHFFFAOYSA-N	438.440	1.436	50	20	IDGD	
CCS(=O)(=O)NCC(=O)NNc1nc2ccccc2c(=O)n1-c1ccc(C)cc1C	759104195	SSFPQAVYZGZLGK-UHFFFAOYSA-N	429.502	1.385	50	20	IDGD	
COc1cc(F)cc(NNC(=O)c2cc(S(=O)(=O)N3CCOCC3)ccc2OC)c1	759328468	JLTNBMRHZDCYSQ-UHFFFAOYSA-N	439.465	1.621	50	20	IDGD	
CNS(=O)(=O)c1ccc(CNC(=O)NNC(=O)CSc2ccccc2OC)s1	761653195	FOUCSKDZALDNTG-UHFFFAOYSA-N	444.560	1.288	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)NC[C@H](O)c2ccco2)cc1	762314729	VTHMTKDEPNGDJW-SKTWIKFTSA-N	449.467	1.784	50	20	IDGD	
COC(=O)c1ccc(Cl)c(S(=O)(=O)NNC(=O)CSc2ccccc2O)c1	763413557	ROJCHIBFPIASJU-UHFFFAOYSA-N	430.891	1.934	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)C(=O)Nc1ccc(Cl)c(F)c1	763530178	FFKSPLJMADISDE-UHFFFAOYSA-N	447.898	1.777	50	20	IDGD	
COC(=O)c1cc2cc(NC(=O)C(=O)NNC(=O)c3ccc4c(c3)OCO4)ccc2o1	763548630	ORSTWFDZOYEIPJ-UHFFFAOYSA-N	425.353	1.348	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)Nc1cccc(Oc2ccncc2)c1	763569813	CDEUAVBTZLEKKV-IBGZPJMESA-N	434.408	1.800	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2cccc(CN3CCOC3=O)c2)c1	763645141	QUYPIZAKVCQPGU-UHFFFAOYSA-N	440.456	1.421	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)N2CCc3ccc(Br)cc32)cc1	763659067	IITILXZWNWXURJ-UHFFFAOYSA-N	448.273	1.573	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(CN3CCCC3=O)c2)cc1C	763667891	WKBRSCIXOBBZPW-UHFFFAOYSA-N	438.484	1.591	50	20	IDGD	
COC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)cc1F	763681646	XCOBBXWVNOMLGI-UHFFFAOYSA-N	429.364	1.041	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cnn(-c3ccccn3)c2)cc1	763873010	RCHYANVSURHWFK-CQSZACIVSA-N	436.428	1.023	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2cccc(Cn3ccnc3C(C)C)c2)n1	763892796	KVDUIAGMCVVVJL-UHFFFAOYSA-N	437.504	1.654	50	20	IDGD	
Cn1c(=O)oc2cc(NC(=O)C(=O)NNC(=O)c3cccc(Br)c3)ccc21	764059228	PKRGKSHRKXRRTR-UHFFFAOYSA-N	433.218	1.294	50	20	IDGD	
COC(=O)c1cc(F)ccc1NC(=O)C(=O)NNC(=O)c1cccc(Br)c1	764063307	NOOFASIFZGQEKY-UHFFFAOYSA-N	438.209	1.775	50	20	IDGD	
CS(=O)(=O)Cc1cc(F)ccc1NC(=O)C(=O)NNC(=O)c1ccc2ccccc2c1	764066283	FDBYDPLBIURHIB-UHFFFAOYSA-N	443.456	1.923	50	20	IDGD	
O=C(Cc1ccc2ccccc2c1)NNC(=O)C(=O)Nc1ccccc1CN1CCNC1=O	764092241	PKKOIDIQNPXKCS-UHFFFAOYSA-N	445.479	1.694	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(N3CCNC3=O)ccc2Cl)c(O)c1	764105791	YIIXNYXDXWDWRR-UHFFFAOYSA-N	431.836	1.283	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cc(Br)cc(C(F)(F)F)c2)n[nH]1	764106516	LZHNMEUGCLDPCB-UHFFFAOYSA-N	434.172	1.899	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(NC(=O)c3ccccc3)nc2)cc1	764176963	IPIFYOZSFLDHKW-UHFFFAOYSA-N	428.408	1.605	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(Cl)cc2C(=O)N2CCCC2)cc1	764181894	IIDPDTCGYFOLGS-UHFFFAOYSA-N	439.859	1.847	50	20	IDGD	
CCCc1cc(NC(=O)C(=O)NNC(=O)c2cc(OC)ccc2Br)n(C)n1	764233741	YDNDRDYONVZTTG-UHFFFAOYSA-N	438.282	1.543	50	20	IDGD	
O=C(Cc1ccccn1)NNC(=O)C(=O)Nc1ccc(C(=O)N2CCCCC2)c(Cl)c1	764266651	IDHLMELRHHPUHA-UHFFFAOYSA-N	443.891	1.690	50	20	IDGD	
CC(C)(C)OC(=O)N1CCc2c(NC(=O)C(=O)NNC(=O)Cc3cccnc3)cccc21	764268776	PVVRJZJHMGLDMB-UHFFFAOYSA-N	439.472	1.708	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)ccc1N1CCOCC1	764345937	MSTHZNZTSIHZDR-UHFFFAOYSA-N	448.483	1.417	50	20	IDGD	
CCOC(=O)CCc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)cc1	764348916	CLOVXEGXQCOCKI-UHFFFAOYSA-N	433.848	1.941	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc4c(c3)oc(=O)n4C)n[nH]2)cc1	764384681	IPQORPKUHVQOEK-UHFFFAOYSA-N	448.439	1.484	50	20	IDGD	
Cc1ccc(F)c(OCC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1	764462231	GDFCYJFUTKPLSZ-UHFFFAOYSA-N	435.477	1.759	50	20	IDGD	
CN(C)CCOc1ccc(C=NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cc1	764829536	XJCJUFBDUSHTAI-UHFFFAOYSA-N	437.544	1.535	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)CCc3nc(-c4ncccn4)no3)n[nH]2)cc1	765577887	ZVOSMLPMWROWKL-UHFFFAOYSA-N	432.444	1.873	50	20	IDGD	
Cc1ccc(C(=O)NNc2cnc3ccccc3n2)cc1S(=O)(=O)N1CCOCC1	765996256	VDPPMTQVPSCSFV-UHFFFAOYSA-N	427.486	1.716	50	20	IDGD	
CCOc1ccccc1C(=O)N1CCN(CC(=O)NNC(=O)Cc2ccccc2C)CC1	766853552	LLZODBJOUILXJD-UHFFFAOYSA-N	438.528	1.542	50	20	IDGD	
COc1cccc(OCCN2CCN(CC(=O)NNC(=O)c3ccc(C#N)cc3)CC2)c1	767049061	UKZZBRVKEODODT-UHFFFAOYSA-N	437.500	1.024	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)CN(C)C(=O)c3cccs3)n[nH]2)cc1OC	768275769	FVKKCKWKHFQEBB-UHFFFAOYSA-N	443.485	1.689	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)c3nccn4c(Br)cnc34)nc21	769812802	TXEZVIFKJYWEFC-UHFFFAOYSA-N	446.269	1.849	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)[C@H]1CCN(C(=O)OCc2ccccc2)C1	770348917	FRAJLJQGRQNSRM-HNNXBMFYSA-N	430.486	1.284	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)[C@H]3CS[C@]4(c5ccc(F)cc5)CCC(=O)N34)nc21	770973602	NMHWFPANYLZXAC-YJYMSZOUSA-N	443.464	1.242	50	20	IDGD	
CC(C)NC(=O)Nc1ccccc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	771812279	WVDBXCLZEBUITC-UHFFFAOYSA-N	447.517	1.542	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1ccc(S(=O)(=O)N2CCC[C@H](C)C2)cc1	771942273	WJIZCPUMAPEYMI-KBPBESRZSA-N	425.507	1.210	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)c1cc([N+](=O)[O-])cc2c1OCCO2	772188711	SVVSFFAPZCBCQD-UHFFFAOYSA-N	434.792	1.097	50	20	IDGD	
O=C(CC[C@H]1Cc2ccccc2NC1=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772195671	NMSCPFFRZJBJEA-HNNXBMFYSA-N	428.876	1.695	50	20	IDGD	
COC(=O)Cn1cc(C(C)=NNC(=O)c2nc(-c3ccccc3)n(-c3ccccc3)n2)nn1	772837836	ZEKOHBUUXVCEFZ-UHFFFAOYSA-N	444.455	1.853	50	20	IDGD	
CC[C@H](C)NS(=O)(=O)Cc1cccc(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2)c1	773643904	SISZJOWBFVONJP-ZDUSSCGKSA-N	449.489	1.895	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2cccc3cncc(Br)c23)CCS(=O)(=O)C1	773644401	KGFGKUAZFFBOMI-INIZCTEOSA-N	441.307	1.134	50	20	IDGD	
O=C(NNc1ccccc1[N+](=O)[O-])C(=O)Nc1cccc(S(=O)(=O)N2CCCCC2)c1	773654547	GYBKWGWXXWYQCW-UHFFFAOYSA-N	447.473	1.851	50	20	IDGD	
Cn1c(=O)c2cc(NC(=O)C(=O)NNc3c(Cl)cccc3Cl)cnc2n(C)c1=O	773694209	IIJKOZPIYJMMFN-UHFFFAOYSA-N	437.243	1.021	50	20	IDGD	
CCOCCCNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2ccc(C)c(F)c2)c1	773890981	XQLLDILEORJCPA-UHFFFAOYSA-N	444.463	1.690	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2nccnc2C(C)C)cc1S(=O)(=O)NC1CC1	773992989	WQESGFHNNQTAIQ-UHFFFAOYSA-N	448.505	1.131	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1cccc(N2CCNC2=O)c1	774009998	TXFHOSDGUGQBJO-LBPRGKRZSA-N	445.863	1.423	50	20	IDGD	
COC(=O)c1cncc(C(=O)NNc2ccc(S(=O)(=O)Nc3nccs3)cc2)c1	774315571	WUFYWZVNMUMNEJ-UHFFFAOYSA-N	433.471	1.882	50	20	IDGD	
CCO[C@@H]1C[C@@H](NC(=O)NNC(=O)c2nnc(O)c3ccccc23)[C@H]1Oc1ccccc1	776535722	WZCAMDXAJIQIOV-ZHALLVOQSA-N	437.456	1.904	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)c2cccc(S(=O)(=O)N(C)C(C)C)c2)nc1C	778429280	JSBJMWZNBARISV-UHFFFAOYSA-N	435.506	1.748	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)c2sccc2S(=O)(=O)N2CCCC2)nc1C	778429746	NEISSWUBIGEPTK-UHFFFAOYSA-N	439.519	1.565	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@]2(C[C@@H]2C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)C1	780347873	PPFQXNSANUJHBW-FOIQADDNSA-N	437.518	1.498	50	20	IDGD	
CC(=O)N1CCN(Cc2ccccc2NC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)CC1	782077868	GMXZQGZISWROTN-UHFFFAOYSA-N	440.460	1.725	50	20	IDGD	
N#C/C(=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)OCC(=O)NC1CC1	782180543	HBXNRQNKJBZIBL-ZROIWOOFSA-N	441.875	1.808	50	20	IDGD	
CN1CCCN(c2ccc(NC(=O)C(=O)NNc3ncnc4ccsc34)cc2)CC1	783262236	OJBAYXNYWIYWIN-UHFFFAOYSA-N	425.518	1.915	50	20	IDGD	
Cc1cc(F)ccc1NNC(=O)C(=O)Nc1cnn(CC(=O)N2C[C@H](C)O[C@@H](C)C2)c1	783446640	UPVPFLPVOMCBQT-KBPBESRZSA-N	432.456	1.048	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)C(=O)Nc1cccc(CCC(F)(F)F)c1	784001844	FBPLJVODMTWHCR-UHFFFAOYSA-N	426.351	1.290	50	20	IDGD	
CSc1ccc(NC(=O)C(=O)NNC(=O)CNC(=O)c2cccs2)cc1Cl	784003971	RXEYOVROZGYUMN-UHFFFAOYSA-N	426.907	1.639	50	20	IDGD	
O=C(NNc1ccc([N+](=O)[O-])cc1Cl)C(=O)Nc1cccc(Cn2cccnc2=O)c1	784384618	PLCKRYMIKKZDNZ-UHFFFAOYSA-N	442.819	1.935	50	20	IDGD	
O=C(CCN1CCOCC1)Nc1cc(NC(=O)C(=O)NNc2ccc(F)cc2)ccc1F	784783293	XXMPQVOXISGOGE-UHFFFAOYSA-N	447.442	1.707	50	20	IDGD	
Cc1cc(C(=O)N2CCOCC2)ccc1NC(=O)C(=O)NNc1cccc([N+](=O)[O-])c1	784833163	JYZAKUNTYIIVOJ-UHFFFAOYSA-N	427.417	1.457	50	20	IDGD	
COC(=O)c1c(C2CC2)csc1NC(=O)C(=O)NNC(=O)Cc1cn2ccccc2n1	785060868	QDMAAYGALMORFJ-UHFFFAOYSA-N	441.469	1.388	50	20	IDGD	
COc1cccc(NNC(=O)Cc2c(C(=O)NNc3cccc(OC)n3)c(C)cn2C)n1	787510580	ZTAJAGGMMZVOME-UHFFFAOYSA-N	439.476	1.583	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)c(OC2CCCC2)c1	790489329	AFDLQARBRDQWNR-AWEZNQCLSA-N	439.534	1.928	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)c(OCc2ccccc2)c1	792317223	PIOCWVQABPAPQH-HNNXBMFYSA-N	449.529	1.753	50	20	IDGD	
COCC1(C(=O)NNC(=O)[C@H]2COc3ccccc3O2)CCN(C(=O)OC(C)(C)C)CC1	792789079	GEIARDCHFUVAAW-QGZVFWFLSA-N	449.504	1.638	50	20	IDGD	
O=C(NNC(=O)c1ccccc1F)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1	793023539	QEHKUTMQPTXUJE-UHFFFAOYSA-N	425.170	1.896	50	20	IDGD	
COCc1cc(C(=O)OC)cc(S(=O)(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)c1	793353633	PNROTWVXLCTQRY-UHFFFAOYSA-N	449.485	1.185	50	20	IDGD	
CC(C)Oc1ccc(NC(=O)C(=O)NNc2ccnc(Br)c2)cc1C(N)=O	797088434	ZNEIFWQBFJPQDB-UHFFFAOYSA-N	436.266	1.812	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@@H]2C(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1	798365095	MXBPVQLCFOQWMY-QGZVFWFLSA-N	425.441	1.532	50	20	IDGD	
CCOc1cc(C(=O)NNS(=O)(=O)c2cncc(OC)c2)cc(OCC)c1OCC	799120369	LNKNEWMIPBWZOR-UHFFFAOYSA-N	439.490	1.910	50	20	IDGD	
CC(=O)NCCN(CC(=O)NNC(=O)C(C)(C)C)Cc1ccc(Br)s1	800499601	KNEAESDCANUIEU-UHFFFAOYSA-N	433.372	1.642	50	20	IDGD	
CN(CC(=O)NNC(=O)Nc1cc(F)cc(F)c1)S(=O)(=O)c1cccc([N+](=O)[O-])c1	802005801	XNZFPLAZXDZCNB-UHFFFAOYSA-N	443.388	1.346	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)/C=C\c1ccccc1)C(=O)NNC(=O)N=c1cc[nH]cc1	802030875	VLZQRILILXXBQW-QXSWTLKVSA-N	449.558	1.368	50	20	IDGD	
COc1ccc(NC(=O)NNc2ncccc2F)cc1S(=O)(=O)N1CCOCC1	806133434	NBSRAFFXDMLHHF-UHFFFAOYSA-N	425.442	1.399	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)N[C@H](CS(=O)(=O)N(C)C)C(F)(F)F)c2ccccc2n1	806564689	GAWUNEKGZWKBEV-CQSZACIVSA-N	447.439	1.310	50	20	IDGD	
N#Cc1ccc(NC(=O)C(=O)NNC(=O)CCOc2ccccc2)cc1Br	806977305	CYUHHHHJHIGUAE-UHFFFAOYSA-N	431.246	1.876	50	20	IDGD	
Cn1ncc(NC(=O)C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)c1-c1ccccc1	806978070	LATRHXRWSUIXLU-UHFFFAOYSA-N	444.492	1.478	50	20	IDGD	
COc1ccc(CCNC(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)cc1OC	806986849	MXEXBOBFYPVHGF-UHFFFAOYSA-N	433.461	1.916	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)Nc1ccc2c(c1)C(=O)N(CC1CC1)C2=O	808831487	DAIYZTUZFOJQSP-GOSISDBHSA-N	436.424	1.685	50	20	IDGD	
Cc1c(/C=C(\C#N)C(=O)OCC(=O)c2ccc(N(C)S(C)(=O)=O)cc2)cc(C#N)n1C	809302013	KBSGJLXEDPNMFZ-RQZCQDPDSA-N	440.481	1.934	50	20	IDGD	
CO[C@@H](C)c1nsc(NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)n1	809923975	FZLGWIBGAPPNRN-NSHDSACASA-N	442.523	1.027	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)CNS(=O)(=O)c1cccc(C#N)c1	811461847	IBTQGRPMLPIURT-LBPRGKRZSA-N	436.877	1.105	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)COc2ccc([N+](=O)[O-])cc2)cc1	860440387	BTNWMRUVTQEVHC-UHFFFAOYSA-N	442.457	1.856	50	20	IDGD	
O=C(CN1C(=O)[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)NNC(=O)c1cc2c(s1)CCCCCC2	913094962	JHHQUNBPTUBZCC-KODHJQJWSA-N	427.526	1.975	50	20	IDGD	
COc1cc(C(=O)NCC(=O)NNC(=S)Nc2cccc(C)c2)cc(OC)c1OC	913454586	RTIQXVLIFBSGGF-UHFFFAOYSA-N	432.502	1.768	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCCc2cc(OC)c(OC)cc2[N+](=O)[O-])cc1OC	913632425	JTGKSWOYTXWLHZ-UHFFFAOYSA-N	448.432	1.816	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCc1ccc(N2CCCC2)nc1	914544733	BVRSWUBFENSPOP-UHFFFAOYSA-N	445.549	1.428	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)N2CCC[C@H](CNS(C)(=O)=O)C2)c(C)n1C[C@H]1CCCO1	915747462	UCGZYIYKJSONLB-XXIZSCBISA-N	448.589	1.979	50	20	IDGD	
CC[C@@H](C)NS(=O)(=O)c1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C)cc2)cc1	916830790	XKIGXRZBBTZITR-CQSZACIVSA-N	432.502	1.472	50	20	IDGD	
Cc1cc(O[C@@H](C)C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)ccc1Cl	917314105	YYTNTOCWCGNTIK-SCLBCKFNSA-N	448.859	1.946	50	20	IDGD	
Cc1[nH]nc2ncc(C(=O)NNC(=O)c3cccc(S(=O)(=O)N4CCCC4)c3)cc12	918186508	AMEDAIAGYTWZPB-UHFFFAOYSA-N	428.474	1.126	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1ccn(-c2cccc(F)c2)n1	920288503	UPOKYZHDCIIOAA-UHFFFAOYSA-N	430.465	1.688	50	20	IDGD	
COCCOc1cc2c(cc1/C=C(\C#N)C(=O)Nc1ccc(S(N)(=O)=O)cc1)OCO2	920754709	CDHOIXUAGHWGPW-RIYZIHGNSA-N	445.453	1.634	50	20	IDGD	
COC(=O)c1cc(NC(=O)NNC(=O)COc2ccccc2OC)cc(C(=O)OC)c1	920930988	ZLYJEQNWGCWMDT-UHFFFAOYSA-N	431.401	1.500	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)Nc1ccc(CN2C(=O)CNC2=O)cc1	920933504	SKOMACAQGWVSHO-GFCCVEGCSA-N	429.408	1.498	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)Nc1cccc(CN2CCC[C@H]2C(N)=O)c1	920940691	UWJFECYJNCUGJE-SFHVURJKSA-N	425.489	1.540	50	20	IDGD	
CCCNC(=O)NNC(=O)c1ccc(OC)c(S(=O)(=O)N[C@H]2CCCC[C@H]2C)c1	921041616	FQOYZBPZMVBERG-HIFRSBDPSA-N	426.539	1.906	50	20	IDGD	
CCn1c(NNC(=O)C2=NN(c3ccc(F)cc3)[C@@H](C(N)=O)C2)nc2ccccc2c1=O	935364330	SATLROXOJFUQKS-QGZVFWFLSA-N	437.435	1.119	50	20	IDGD	
CC(C)c1ccc(S(=O)(=O)c2ccc(NNC(=O)CN3C(=O)CNC3=O)cc2)cc1	1115892984	ZMPQBWSDLUERAA-UHFFFAOYSA-N	430.486	1.638	50	20	IDGD	
COc1ccccc1C(=O)NCC(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1	1116659121	GBPQXRVBCGNDIS-UHFFFAOYSA-N	434.493	1.220	50	20	IDGD	
CCN1CCN(Cc2ccc(CNC(=O)NNC(=O)c3ccc(OC)cc3)cc2)CC1	1317914660	QYGKRRZULPBBOX-UHFFFAOYSA-N	425.533	1.977	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)COc1ccc([N+](=O)[O-])c(F)c1	1318160936	STEIEHGPIMFKSV-UHFFFAOYSA-N	439.425	1.175	50	20	IDGD	
Cc1c(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)cnn1C1CCCC1	1320358602	CKLPAKMQICQLRO-UHFFFAOYSA-N	446.577	2.000	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc4cn[nH]c4cn3)C2)C1	1778777160	PAFQBSWXXSKDBR-UGSOOPFHSA-N	436.310	1.575	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(OC)ccn2)C1	1779704246	NYPNYFALVDYKDD-XAUMDUMWSA-N	425.913	1.472	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cncc4cnccc34)C2)C1	1780014864	UHKVOZGYASZAPC-BFUOFWGJSA-N	433.306	1.857	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccnc4c3OCO4)C2)C1	1780022782	JKGNHAJPYXYIIY-XIKOKIGWSA-N	440.294	1.285	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cccc(SC)c3O)C2)C1	1780154641	UCFJHRDVZWPKPA-KUHUBIRLSA-N	428.938	1.811	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccccc3C)C2)C1	1780578180	KSELXYGBINQKTB-VAHWYXDJSA-N	437.500	1.573	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(Cl)nn1)C2)[C@@H](F)Br	1780775047	VTUDPXNJIBKGPD-AXAPSJFSSA-N	449.708	1.948	50	20	IDGD	
O=C(c1onc2ccccc12)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781334757	ZUTLHVKOUGQEKE-PBHICJAKSA-N	426.242	1.962	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H]1CCCN(C)C1)C2	1782003944	ZCUYCIBBPXXEAQ-YIOZNXECSA-N	430.387	1.626	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(F)c(N(C)C)c(F)c3)C2)C1	1782110393	VDPVODCYTYOMNX-JLTOFOAXSA-N	445.894	1.728	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccn(C(F)F)n1)C2	1782176259	ZFVJIWPHULLJFA-WPKBUWHJSA-N	434.871	1.660	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(=O)c1ccc(C)cc1)C2	1782178636	BYBMGRBEXVMSJO-JBYIUTFZSA-N	436.936	1.945	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H]1CCCSC1)C2	1782213891	CCLUDYCQJSMCGD-CBGDNZLLSA-N	440.610	1.017	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H]2CCCOC2)C1	1783211144	XHTQPEPUJDXYRV-YIOZNXECSA-N	431.371	1.958	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(F)nc3F)[C@H]2C1	1783384117	FWUTYVPYAVZUQG-URBCHYCLSA-N	432.265	1.737	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cnnc4ccccc34)CCO2)C1	1783534569	LRKGVHMUFWDCRI-ORAYPTAESA-N	433.306	1.857	50	20	IDGD	
O=C(CCc1ccc2c(c1)OCO2)N1CCO[C@@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783947702	YAUIDNFIOTVHBO-IBGZPJMESA-N	429.300	1.982	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)CCc3ccc(N(C)C)cc3)C2)C1	1784246806	OUWPHDYZRHFGFO-KNQAVFIVSA-N	437.968	1.769	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)CCn3nc(C)cc3C)C2)C1	1784321146	KOVLOAHORNTOPD-LPHOPBHVSA-N	441.370	1.893	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4c(c3)CNC4=O)C[C@@H]21	1784617748	MVHBZCRSBLKTCF-FZDIXFNVSA-N	433.936	1.931	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3c(F)cncc3F)C[C@@H]21	1786406064	GNTUWIHVTCHJCN-MJVIPROJSA-N	432.265	1.738	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3nnsc3C3CC3)[C@H]2C1	1787680281	VNWIHDYNDBPFAI-BQUFFADESA-N	443.367	1.792	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cn4ccccc4n3)[C@H]2C1	1787841591	GRBMFGBPWDAISS-BQFCYCMXSA-N	430.581	1.779	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)c3ccc(F)nc3)CCC2)cc1)c1ccc(B(O)O)cc1	1788142364	TYMLAJNXWSPFEP-UHFFFAOYSA-N	433.248	1.962	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CSc3nc[nH]n3)C[C@@H]21	1789873323	VKPCOABHKNRWOO-CENBSLRLSA-N	436.365	1.113	50	20	IDGD	
Cc1cc(C)nc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]3C2)c1	1789923235	ZXMNKWCXDNXVTM-SDADXPQNSA-N	428.302	1.982	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21)c1cccc(N2CCOCC2)c1	1790119532	VDODNPBJXCIUGN-WNHJNPCNSA-N	439.915	1.651	50	20	IDGD	
COC(=O)CCCCCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]2C1	1791063730	RALBLGFCUCEJSP-UGUYLWEFSA-N	447.370	1.873	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(OC)cc3O)C[C@@H]21	1791253724	HKVBFBOUIXVJSZ-PTOXDTDZSA-N	426.897	1.248	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CC[C@@H]3CCOC3)[C@H]2C1	1791818476	RUEZYRPSIUCKIW-XAJHFOFHSA-N	431.371	1.956	50	20	IDGD	
Cc1c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](O)CCl)cc(Cl)cc1[N+](=O)[O-]	1792979992	IPRKJLOIPVVEMK-OXUXUCFPSA-N	446.287	1.360	50	20	IDGD	
COc1ccc([C@H]2C[C@@H]2C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)cc1	1793521680	XTNNOKJRPOUYJY-PMNYKWLYSA-N	448.328	1.431	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](C)NS(=O)(=O)CC	1793536401	QLJXZMKAUDHRTA-RGDJUOJXSA-N	438.388	1.126	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCBr)o1	1795115804	LJRHKZJTUORWGC-DRXBFXEBSA-N	428.283	1.226	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](COC)NC(=O)OC(C)(C)C	1796392694	FXOZJIXBADZSEF-NPJQDHAYSA-N	447.960	1.133	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1[nH]nc3ncccc13)C2	1796892077	DRDHTPUNSGPSBR-SSJPOKSSSA-N	448.487	1.344	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc2c1NC(=O)C2=O	1797538831	ZUJJDLZGUFXPJV-NOXHYTERSA-N	433.892	1.432	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnn(-c3cccnc3)c1)C2	1797954628	ZOCQCNIGEZLPRY-XEMDLRDOSA-N	443.580	1.322	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1nccc(Cl)c1OC	1798690661	LEUNKALKWMLXMC-ZMJPVWNMSA-N	432.304	1.201	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COCc1ccccc1)C2)[C@H](F)Br	1799346400	QBEVFTPPKWRKFT-FSDCSDTHSA-N	429.286	1.483	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c(c1)OCCO3)C2)[C@@H](F)Br	1799347284	KPNZYMBXTDJHPR-NOXHYTERSA-N	443.269	1.352	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1ccc(C(=O)OC)s1	1799808493	KNHYISGPJCPXJI-QVHKTLOISA-N	428.938	1.969	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](F)Br)n1	1800157717	UHOCAVLDFNMUEN-NWJSVONSSA-N	427.274	1.982	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)Nc1cnccn1)C2	1800641963	OCCZGZZCJUECBC-JAAXMTQOSA-N	440.342	1.040	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(-n3cncn3)c1)C2	1800759845	LDYSZVLYGZIPDT-FAYQHZLMSA-N	448.321	1.254	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C=C/c1ccc(O)cc1Cl	1800906425	MKALLNKJMFOBTE-UYDRDUHSSA-N	443.327	1.902	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c(F)ccc([N+](=O)[O-])c1C)C2	1800976852	AJSSIUUYRFKFPZ-LKQDWFRTSA-N	443.859	1.499	50	20	IDGD	
Cc1cccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCC(=O)NN(C)C)c1Cl	1801012222	OKXRZYFYAWAEEC-YVWYUNDQSA-N	436.940	1.225	50	20	IDGD	
Cc1cnn([C@@H](C)C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)CBr)C3)c1	1801335575	PTZLIPZMLWKCTM-GVRJEKJASA-N	427.343	1.373	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCBr)C3)cc1	1801782643	XUTQGLIMJCBRKA-JLVBRIDZSA-N	438.322	1.633	50	20	IDGD	
COc1cccc(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CCC(=O)NN(C)C)c1C	1802339656	FPYBQRXSAGIIDB-REPLKXPHSA-N	430.549	1.557	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1CCN(C(=O)CCC(N)=O)[C@@H]1c1cccnc1	1803014887	HIYNIJPHFIDHLE-HACGYAERSA-N	425.327	1.384	50	20	IDGD	
CCOC(=O)[C@H](NC(=O)OC(C)(C)C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](F)Cl)C2	1804300950	RTFRUTLNYMNXIY-ITGHMWBKSA-N	449.907	1.615	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)ccn1	1807361453	QAHCTMXKCLHEIN-IRLDBZIGSA-N	444.300	1.098	50	20	IDGD	
Cc1occc1C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1807364004	RQCWOYVFSVKKJX-NQIIRXRSSA-N	433.273	1.296	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NC[C@H]1CCN(C(=O)C(Cl)Cl)[C@H]1c1cccnc1	1807595978	NMBWCZBKHLEXQI-CJNGLKHVSA-N	439.299	1.914	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)c1cc2ncccn2n1	1809761642	WRDWYZVHEHVSAX-ZVZYQTTQSA-N	428.880	1.044	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)[C@@H]3CCCSC3)CC2)C1	1809977595	DYHOSSHZWVENNF-GOSISDBHSA-N	430.379	1.354	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)C(=O)N(C)C)[C@@H]1c1cccnc1	1812775867	CNYSYZIUCVFBDN-QLFBSQMISA-N	425.327	1.349	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2coc(Cl)n2)[C@@H]1c1cccnc1	1813070338	HVQDZKZXMZKDIJ-RDTXWAMCSA-N	448.911	1.416	50	20	IDGD	
CC1=CC[C@H](C(=O)N[C@@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)CC1	1815344216	OJTULCVYHIXIHP-WMLDXEAASA-N	439.346	1.795	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1	1817470199	KXKVLLPPADBXNW-WBVHZDCISA-N	432.717	1.803	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@H](O)c2ccccc2)[nH]n1)c1ccc(B(O)O)cc1	1817471032	COAKBBRUJJUGNE-TZIWHRDSSA-N	448.288	1.129	50	20	IDGD	
Cc1n[nH]c(C)c1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1	1817472320	QDZQDLZNUZYMOI-QGZVFWFLSA-N	436.281	1.049	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)/C=C/c2ccco2)[nH]n1)c1cccc(B(O)O)c1	1817473917	GUDJIGJALOLTPW-YXBWYFRISA-N	434.261	1.702	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](N)Cc2cscn2)n[nH]1	1817980468	MEBYQAPEDAJCJC-VNHYZAJKSA-N	440.957	1.682	50	20	IDGD	
O=C1Nc2c(C(=O)Nc3cc([C@H]4CCCCN4C(=O)[C@@H](O)CCl)[nH]n3)cccc2C1=O	1819193833	UAGMXGOTGLDBLG-KGLIPLIRSA-N	445.863	1.450	50	20	IDGD	
C[C@@H](O)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)[nH]n1	1822172589	KXYYSVPBUQHWCZ-XBFCOCLRSA-N	443.932	1.915	50	20	IDGD	
Cc1ccc(C(=O)NCC(=O)Nc2cc([C@H]3CCCCN3C(=O)[C@H](O)CCl)[nH]n2)cc1	1823510933	TVJHMWORMMYYJY-IAGOWNOFSA-N	447.923	1.740	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2nc(C)c(C)[nH]c2=O)CC1	1825448523	JMAGCAWLWCHDOO-IRXDYDNUSA-N	438.956	1.874	50	20	IDGD	
Cc1cnc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)s1	1825692204	BXCBMIDCTKFLTG-IBGZPJMESA-N	441.362	1.678	50	20	IDGD	
CCCNC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](Cl)COC)sc2C1	1825994682	NETZZNDOAXDRBE-RYUDHWBXSA-N	430.958	1.615	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cn3cccnc3n1)CC2	1825999647	BHXNEAGPKNACPP-MNOVXSKESA-N	434.909	1.665	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc3ncccn3n1)CC2	1826000099	KWEUTJVUBRKYDN-MNOVXSKESA-N	434.909	1.665	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCc1ccc[nH]1)CC2	1826085089	DBADKVMQAYGGFX-AWEZNQCLSA-N	432.550	1.389	50	20	IDGD	
C[C@H](C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@](C)(Cl)CCl)CC2)n1cnnn1	1826990245	XTEKNBMQNYYHBH-OLBFVZFUSA-N	432.337	1.539	50	20	IDGD	
NCC(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1828961161	JXUWHBPCGUIMPK-IBGZPJMESA-N	443.331	1.201	50	20	IDGD	
Cn1ncc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)c1Cl	1830364168	AMQACYIPUSPMOV-SFHVURJKSA-N	433.336	1.409	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3sccc3F)C2)C1	1830535284	LQWOILOEYXOOSV-PXAZEXFGSA-N	449.342	1.988	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc(Cl)nc3)C2)C1	1831638846	HSDDUOAENJCMAV-KDOFPFPSSA-N	431.320	1.608	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccc(O)cn3)C2)C1	1831658951	KFGXSZUGZXXDII-FXAWDEMLSA-N	425.913	1.194	50	20	IDGD	
COc1cccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)n1	1831872434	WPUGQSMKMMASQS-LJQANCHMSA-N	445.564	1.697	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cc4sccn4c3)CC2)CC1)[C@@H](O)CCl	1833310187	BLGZMHKHDXDVOR-KRWDZBQOSA-N	438.981	1.786	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cc4ccoc4cn3)CC2)CC1)[C@@H](O)CCl	1833312208	LEGMFLYZZBRZKS-SFHVURJKSA-N	434.924	1.613	50	20	IDGD	
C[C@@H](Cc1ccco1)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)CCl)CC2)CC1	1833313151	XTSCALFSGZDTJI-KXBFYZLASA-N	425.957	1.630	50	20	IDGD	
Cc1nc(CC(=O)NC2CCN(C3CCN(C(=O)[C@H](O)CCl)CC3)CC2)cs1	1833817420	SQHCUCGXMTZYPA-QGZVFWFLSA-N	428.986	1.165	50	20	IDGD	
Cc1cnn([C@H](C)C(=O)N2CCC(OC3CCN(C(=O)[C@H](O)CCl)CC3)CC2)c1	1836720022	HBXYGFQMAUYVDQ-CRAIPNDOSA-N	426.945	1.351	50	20	IDGD	
C#CCO[C@H](C)C(=O)N1CCC(OC2CCN(C(=O)[C@H](F)Br)CC2)CC1	1836860745	DDLFVXLCVWOARO-CJNGLKHVSA-N	433.318	1.714	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)CCN3CCCCC3)C2)C1	1837712461	SPKIWXOYLSZELB-OAQYLSRUSA-N	441.645	1.170	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCC(OC2CCN(C(=O)[C@H]3CCC(=O)N3)CC2)CC1	1837782666	FDUGUVDKMUYDOZ-BEFAXECRSA-N	434.364	1.500	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3c(F)cccc3F)C2)C1	1839146609	QIUISSPELISPSO-YWZLYKJASA-N	430.879	1.981	50	20	IDGD	
O=C([C@@H](F)Br)N1CCO[C@@]2(COCCN(C(=O)C(F)(F)C(F)F)C2)C1	1839199573	YCHKRQPOPSTVBZ-PELKAZGASA-N	439.175	1.034	50	20	IDGD	
Cc1cccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)c1	1839202030	RNIKEVSPOUNZJK-CRAIPNDOSA-N	429.286	1.756	50	20	IDGD	
C[C@H](C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H](F)Br)CCO2)C1)n1cccc1	1839202800	QBLQVBRTJVFEFO-CPUCHLNUSA-N	432.290	1.196	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CN3CCCCC3)C2)C1	1839963203	DEHBTMKFRDLVGF-QFBILLFUSA-N	446.386	1.102	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3sccc3Cl)C2)C1	1840153823	BGOPJWAJXBPXBS-GUYCJALGSA-N	437.345	1.725	50	20	IDGD	
COc1ccc(F)c(C(=O)N2CCO[C@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)c1	1840686885	KCZQCNDMPBNMPT-GOSISDBHSA-N	435.279	1.708	50	20	IDGD	
Cc1c(C(=O)N2CC3(CCCN3C(=O)[C@@H](C)CBr)C2)cn2[nH]cnc(=O)c12	1841288061	XDJDRHFJUKZGQL-NSHDSACASA-N	436.310	1.179	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@H](O)CCNC(=O)OC(C)(C)C)C2	1841669281	KYWAAEUQIXNCBQ-HUUCEWRRSA-N	431.961	1.873	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)c2ccc3cc(O)ccc3n2)C1	1843667033	WSPXCGUNUXBOOL-UHFFFAOYSA-N	425.489	1.130	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC2(CCCN2C(=O)C2CCN(S(C)(=O)=O)CC2)C1	1843838127	VKOBGXRWGALTKV-INIZCTEOSA-N	440.393	1.098	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)[C@H](C)n2cc(C)cn2)C1	1846588377	IJPFTSCVHSROBZ-WTJYETQFSA-N	425.493	1.090	50	20	IDGD	
CC(C)[C@H](CNC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl	1847563830	MFJYTEHCVRLEAE-YHUYYLMFSA-N	431.961	1.585	50	20	IDGD	
O=C(c1cc2c[nH]nc2cc1Br)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl	1847566112	KENRWHOPGVQNPT-SOUVJXGZSA-N	441.713	1.741	50	20	IDGD	
C=C1c2ccccc2C(=O)N1[C@@H](C)C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	10414578	SNXNQVJQZHFINF-NSHDSACASA-N	448.888	1.264	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)c1ccc(Cn2cncn2)cc1	11642276	PRKMDPKBJHTLQV-UHFFFAOYSA-N	430.262	1.929	50	20	IDGD	
O=C(CCC(=O)c1cccs1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	27228950	PZBSKEPQSRVLKQ-UHFFFAOYSA-N	435.527	1.957	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCC(CCN2CCOCC2)CC1	726602280	VSWZEVBFDNONOC-UHFFFAOYSA-N	438.956	1.544	50	20	IDGD	
CNS(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)c2c(Cl)cccc2Cl)cc1	727796497	RJKUKHHFTNKNGJ-UHFFFAOYSA-N	438.314	1.525	50	20	IDGD	
COc1cc(OCC(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)ccc1[N+](=O)[O-]	728211543	XLGTUHGEWBMYBA-UHFFFAOYSA-N	436.446	1.566	50	20	IDGD	
NC(=O)COc1cccc(NC(=O)NNC(=O)c2cc(F)ccc2Br)c1	728742666	LKTUURGIDPZQHY-UHFFFAOYSA-N	425.214	1.919	50	20	IDGD	
C[C@H]1CCC[C@H]1NC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	729624723	XWSXNMGHAXOKFS-MAUKXSAKSA-N	438.550	1.159	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)[C@H]2CCCN(S(=O)(=O)Cc3ccccc3)C2)c1	730511688	BPZOJEZPLKJIAH-IBGZPJMESA-N	445.541	1.763	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)c1cc(S(N)(=O)=O)ccc1N1CCOCC1)c1ccccc1	732133033	NXHNENOGCUTREU-QGZVFWFLSA-N	446.529	1.125	50	20	IDGD	
O=C(NCc1ccc(OCCN2CCCC2)cc1)NNC(=O)[C@@H]1COc2ccccc2O1	732253083	CWSAROOHPYOKIF-NRFANRHFSA-N	440.500	1.832	50	20	IDGD	
NC(=O)c1cc(C(=O)NNC(=O)c2ccc(F)cc2Br)nn1-c1ccccc1	732273595	DYUGWSVNWGIBHJ-UHFFFAOYSA-N	446.236	1.948	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)NCCn1cnc2ccccc21	732594416	AYCIZHUMKQYMLK-UHFFFAOYSA-N	435.532	1.579	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)NCC2CCN(S(=O)(=O)C(F)(F)F)CC2)cc(C#N)n1C	732661874	FYPXJBAKTAASPP-CHHVJCJISA-N	443.451	1.790	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)Cn1cc(C(N)=O)c2ccccc21	734252022	YZHISAMKZKBFLO-UHFFFAOYSA-N	443.529	1.960	50	20	IDGD	
CN1CCC(N2CC[C@H](NC(=O)NNC(=O)CSc3ccc(Cl)cc3)C2)CC1	734282705	BDXWCKDFFVWWNH-HNNXBMFYSA-N	425.986	1.931	50	20	IDGD	
CN1C(=O)C[C@H](C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)[C@@H]1c1cccc(Cl)c1	734387230	NJKOYXLIGUQXCU-FNHZYXHNSA-N	429.860	1.847	50	20	IDGD	
CC(=O)c1cccc(OCC(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)c1	734825127	VNYCCDSVXVUQFB-UHFFFAOYSA-N	434.493	1.998	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)N[C@@H](C)CN2CCN(c3ccccn3)CC2)cc1	735519624	UQHNICKBBFDYOA-SFHVURJKSA-N	440.548	1.564	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1c(C)nn(CCCl)c1C	735836674	MLUFCGQLUDJYFU-UHFFFAOYSA-N	426.930	1.415	50	20	IDGD	
CC(=NNC(=O)[C@@H](C)CN1CCCCC1)c1cccc(S(=O)(=O)N2CCOCC2)c1	739414045	UYLFEBZZFPOUDM-KRWDZBQOSA-N	436.578	1.670	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)c2cn([C@@H]3CCS(=O)(=O)C3)nc2C(C)C)cc1	744361466	AYMIHJGRUTUEDV-MRXNPFEDSA-N	448.545	1.769	50	20	IDGD	
CCc1cc(N2CCC[C@H](NC(=O)NNC(=O)c3cc([N+](=O)[O-])ccc3O)C2)ncn1	745817309	XRVAZCRBLXZKEI-ZDUSSCGKSA-N	429.437	1.266	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NC[C@@H](C)Cc2cccs2)cc1	745860250	MRVBMBYAAZRRSY-HNNXBMFYSA-N	438.575	1.886	50	20	IDGD	
O=C(NNC(=O)N1CCOCC1)[C@@H]1CCCN(C(=O)c2ccc(Cl)c(Cl)c2)C1	745992297	ZBAYXLMPZGCQDQ-CYBMUJFWSA-N	429.304	1.919	50	20	IDGD	
COC(=O)[C@H]1CCC[C@H](C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)C1	746096974	STHMVAJNLPHOEC-HOTGVXAUSA-N	437.518	1.212	50	20	IDGD	
CC[C@H](NC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1)C1CCOCC1	746426337	PMFABTSLOOWLRS-KRWDZBQOSA-N	426.539	1.151	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)NCc2cc(C)no2)cc1	747712539	JJPLZTXZMFEMCH-YBEGLDIGSA-N	434.456	1.954	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2ccc(C)c(C(=O)NNc3nccn(C)c3=O)c2)cc1	747942100	VPMKWZAFVYCGBQ-UHFFFAOYSA-N	443.485	1.655	50	20	IDGD	
CC(=O)N1CCN(S(=O)(=O)c2cccc(C(=O)NNc3ccc(C#N)cc3)c2)CC1	748116825	JNKKNUDVJSTZFL-UHFFFAOYSA-N	427.486	1.168	50	20	IDGD	
COc1cc(S(=O)(=O)N2CCOCC2)cc(C(=O)NNc2ccc(C#N)cc2)c1OC	748118027	WAKUCRLYOLDCGQ-UHFFFAOYSA-N	446.485	1.353	50	20	IDGD	
CC(C)n1nc(C(=O)NNS(=O)(=O)c2ccc(CC(=O)O)cc2)c2ccccc2c1=O	748639242	FGCMYMNNKYFLAL-UHFFFAOYSA-N	444.469	1.228	50	20	IDGD	
O=C(NNc1ccc(OCC(F)(F)F)cc1)[C@@H]1CC(=O)N([C@@H]2CCS(=O)(=O)C2)C1	748694905	HEYKEGPPJFGQEB-DGCLKSJQSA-N	435.424	1.106	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)CN1CCN(C(=O)OCc2ccccc2)CC1	751062358	DOJKTXUAOOYJBS-UHFFFAOYSA-N	440.500	1.340	50	20	IDGD	
COc1ccc(-c2noc(CCCC(=O)NNC(=O)CNC(=O)c3cccs3)n2)cc1	751206187	GGIHQUVWWRCXBI-UHFFFAOYSA-N	443.485	1.707	50	20	IDGD	
CCOc1ccccc1N1C[C@@H](C(=O)NNC(=O)CNC(=O)c2cccs2)CC1=O	751211678	UIAJFLUSPFSMEV-ZDUSSCGKSA-N	430.486	1.077	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)Nc2ccc(NC(=O)[C@H]3CCCO3)cc2)c1	755642504	ZUEZHISGHSPGOX-QGZVFWFLSA-N	426.433	1.624	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)Nc1ccc(=O)n(Cc2ccccc2)c1	755960257	ISRNKXIBTYVQGF-UHFFFAOYSA-N	430.428	1.339	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)Nc2ccc(OC)c(NS(C)(=O)=O)c2)c1	756782878	USUFDELRBHQHTB-UHFFFAOYSA-N	438.462	1.550	50	20	IDGD	
CCOC(=O)C(C)(C)n1cc(NC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cn1	757720134	KFVYQPCTTKHWAT-UHFFFAOYSA-N	441.448	1.539	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)N[C@@H]2CN(C3CC3)C[C@H]2C)c2ccccc2c1=O	757789638	IUMJWCLYYOQVMY-RDTXWAMCSA-N	426.521	1.623	50	20	IDGD	
CCC(=O)c1cc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)ccc1F	757863070	PQHUYSKSVFLTQH-GOSISDBHSA-N	430.388	1.563	50	20	IDGD	
CN1CCc2ccc(NC(=O)NNC(=O)c3cccc(S(=O)(=O)N4CCCC4)c3)cc21	757917932	UUDBLOFXJPCSJM-UHFFFAOYSA-N	443.529	1.930	50	20	IDGD	
CCC(=NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)c1ccn(C)n1	758072376	ALOCOMPBNQGHNM-UHFFFAOYSA-N	433.534	1.304	50	20	IDGD	
COC(=O)c1cccc(CC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1	758077313	VWDAXMGLFQFQCQ-UHFFFAOYSA-N	445.497	1.261	50	20	IDGD	
COC(=O)[C@H](C)Oc1ccc(C=NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1	758365766	NZVMELYDFNIKLX-NSHDSACASA-N	439.877	1.692	50	20	IDGD	
COc1ccccc1[C@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)C(=O)Nc1ccccn1	758831530	QQEVJNMEIMAHHE-INIZCTEOSA-N	443.460	1.442	50	20	IDGD	
Cc1nc(COc2cccc(C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)c2)no1	759113606	LQGIEVYFQCHQJB-UHFFFAOYSA-N	434.453	1.426	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)c1ccc(-n2ccnn2)cc1	760249588	XRXJSYHRHMEBAK-UHFFFAOYSA-N	440.485	1.127	50	20	IDGD	
CCCc1c(NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cnn1-c1cc(C)ccn1	760983780	VSGFTNIVJCLRJF-UHFFFAOYSA-N	446.475	1.970	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)NC1CCN([C@H]2CCCC[C@@H]2O)CC1	761743588	VRERHYNSBFYCES-IRXDYDNUSA-N	436.578	1.886	50	20	IDGD	
CS(=O)(=O)Nc1cc(C(=O)NNc2nccc(N3CCOCC3)n2)ccc1Cl	762864351	AUBWLLDLIQTOCY-UHFFFAOYSA-N	426.886	1.095	50	20	IDGD	
O=C(NCC1CC1)NNS(=O)(=O)c1c(Br)cc2nc(O)oc2c1Cl	763421907	PTBVRDCGGIKCEG-UHFFFAOYSA-N	439.675	1.852	50	20	IDGD	
Cc1c(C(=O)O)cc(Cl)cc1S(=O)(=O)NNC(=O)CNC(=O)c1cccs1	763431711	DZIWENIMEGZHEW-UHFFFAOYSA-N	431.879	1.148	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)C(=O)Nc2cc(C)n(C)n2)cc(OCC)c1OCC	763541934	CFANDUHDLFVOPM-UHFFFAOYSA-N	433.465	1.324	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccccc2-c2noc(C)n2)cc1OC	763551323	VLSKASIEISPWHE-UHFFFAOYSA-N	425.401	1.462	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)Nc1ccc(OCc2ccccc2)nc1	763570763	HQDHDMIFPBLDKO-LJQANCHMSA-N	448.435	1.587	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)C(=O)Nc2ccccc2C(=O)N(C)C)c1	763601597	MRHODWACSGLVAJ-UHFFFAOYSA-N	440.500	1.985	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)[nH]n1)C(=O)Nc1cccnc1N1CCCCC1	763606213	WZEXWZQNZJQHBL-UHFFFAOYSA-N	433.472	1.862	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cnn(Cc3ccncc3)c2)c2ccccc2n1	763615088	AJQULDYZLYASRO-UHFFFAOYSA-N	429.440	1.583	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccnn2Cc2cccc(C)c2)cc1	763661304	MZIWGKVSGKLLOR-UHFFFAOYSA-N	437.456	1.413	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2ccc(C(=O)c3nccn3C)cc2)c1	763665998	SKHWZKNFEZCZAV-UHFFFAOYSA-N	449.467	1.433	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)C(=O)Nc2cccc(-c3nnnn3C3CC3)c2)c1	763759800	BVXKPRCRMSWRDI-UHFFFAOYSA-N	434.460	1.141	50	20	IDGD	
Cc1ncc(NC(=O)C(=O)NNC(=O)c2nc(-c3ccccc3)n(-c3ccccc3)n2)cn1	763804646	OAPGPEDXWYNYNS-UHFFFAOYSA-N	442.439	1.432	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C)cc2)cc1Cl	763820890	LRWGUVQGTOIEBU-UHFFFAOYSA-N	435.864	1.839	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)NC(=O)CC3)cc1	763871086	DMWSOOKWCFXIBP-CYBMUJFWSA-N	438.440	1.327	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)n(C2CCOCC2)n1	763872177	LBHXPNDJGZJWBN-ZDUSSCGKSA-N	433.440	1.236	50	20	IDGD	
CC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(C(C)=O)cc2)c1	763878926	UNPQINNPZAWKQA-ZDUSSCGKSA-N	426.429	1.401	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)C(=O)Nc1cncc(Br)c1	763996213	WNFVWGNEAPUBEY-UHFFFAOYSA-N	431.044	1.334	50	20	IDGD	
CCCc1c(NC(=O)C(=O)NNC(=O)Cc2ccsc2)cnn1-c1cc(C)ccn1	764032932	BHVZQBXLJNRDSJ-UHFFFAOYSA-N	426.502	1.918	50	20	IDGD	
CS(=O)(=O)Cc1ccccc1NC(=O)C(=O)NNC(=O)c1cccc(C(F)(F)F)c1	764040459	JNAJZDSFERYESD-UHFFFAOYSA-N	443.403	1.650	50	20	IDGD	
CC(=O)N(C)c1ccccc1NC(=O)C(=O)NNC(=O)c1cccc(Br)c1	764062963	HXYDWUJXHGXWOF-UHFFFAOYSA-N	433.262	1.832	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(N3CCCCC3)cc2)c1	764078400	SMIHIALFTOQOST-UHFFFAOYSA-N	444.513	1.480	50	20	IDGD	
O=C(NNC(=O)c1ccc(F)cc1Br)C(=O)Nc1ccc(-n2ccnn2)cc1	764083840	BQYQAMZCFQNZJR-UHFFFAOYSA-N	447.224	1.569	50	20	IDGD	
COCC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccc3ccccc3c2)cc1	764085145	PMVSXAFZGITXKN-UHFFFAOYSA-N	434.452	1.753	50	20	IDGD	
CCCCNS(=O)(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2ccc(C)cc2O)c1	764104634	CGJIUJCNTAHRPK-UHFFFAOYSA-N	448.501	1.179	50	20	IDGD	
O=C(CC(F)(F)F)NNC(=O)C(=O)Nc1ccc(I)cc1Cl	764116098	KFJHKLQTOSTNOY-UHFFFAOYSA-N	449.554	1.983	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(CCN3CCCC3)cc2)c1O	764132683	VVYCEQCXMOLYHE-UHFFFAOYSA-N	426.473	1.439	50	20	IDGD	
C[C@H]1CN(Cc2ccccc2NC(=O)C(=O)NNC(=O)CCc2ccco2)C[C@H](C)O1	764176745	FRCFGFJBCBRKBK-HOTGVXAUSA-N	428.489	1.608	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3CN2Cc2ccccc2)n(C)n1	764178541	DEPFLABIOUUQMW-HXUWFJFHSA-N	446.511	1.442	50	20	IDGD	
CN(C)CC(=O)NNC(=O)C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(Cl)c1	764202750	AJKUBLJMQFNERE-UHFFFAOYSA-N	429.864	1.438	50	20	IDGD	
CCOc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NNC(=O)c1cccc2ncccc12	764259719	IPSWNGMJYMYYHF-UHFFFAOYSA-N	449.467	1.735	50	20	IDGD	
O=C(Cc1cc[nH]n1)NNC(=O)C(=O)Nc1cccc(COCC(F)(F)C(F)F)c1	764294033	SSEZWRNGRGIFCJ-UHFFFAOYSA-N	431.346	1.155	50	20	IDGD	
Cc1cc(C(=O)N2CCC[C@H](C)C2)ccc1NC(=O)C(=O)NNC(=O)c1c[nH]nc1C	764296601	BJRKURRKALCRHW-LBPRGKRZSA-N	426.477	1.298	50	20	IDGD	
CCc1noc(-c2cc(Cl)ccc2NC(=O)C(=O)NNC(=O)[C@@H](C)OCCOC)n1	764398939	IUIAVFVJGAQCBL-SNVBAGLBSA-N	439.856	1.090	50	20	IDGD	
COc1cc(C=NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cc([N+](=O)[O-])c1O	764831756	SLQHKRAKUVQRPC-UHFFFAOYSA-N	441.444	1.217	50	20	IDGD	
CC(C)[C@@H](C(=O)NNC(=O)CSc1ccccc1O)N1C(=O)c2ccccc2C1=O	765250797	IDTKUVDCJFRBHN-SFHVURJKSA-N	427.482	1.953	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NC[C@@H]1CCCS1(=O)=O	765645952	YDYATXYSHDPZSZ-GWCFXTLKSA-N	434.312	1.124	50	20	IDGD	
CNC(=O)[C@@H]1CCC[C@@H]1NC(=O)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1	765667016	VITPHOSDKNBQIZ-FSSWDIPSSA-N	449.555	1.859	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNS(=O)(=O)c1cc([N+](=O)[O-])c(O)cc1C	766310504	JGZVRRIVQHXWSK-UHFFFAOYSA-N	425.419	1.396	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1ccn(-c2ccc(F)cc2F)n1	766633047	SSDITSKIYYMOLO-UHFFFAOYSA-N	448.455	1.827	50	20	IDGD	
COc1ccc(OC)c(CN2CCN(CC(=O)NNC(=O)Cc3ccccc3C)CC2)c1	766829902	PPSARUJQBZGLKK-UHFFFAOYSA-N	440.544	1.520	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)N[C@@H]1CCc2n[nH]cc2C1	767110909	PEKLXQQFTZLXDK-MRXNPFEDSA-N	446.533	1.086	50	20	IDGD	
CC(=O)N[C@H](CC(=O)OCC(=O)NNC(=O)Cc1ccccc1C)c1c(F)cccc1F	767327608	CJVBNKCRVNJNAM-GOSISDBHSA-N	447.438	1.774	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)c3ccc([C@]4(C)NC(=O)NC4=O)cc3)n[nH]2)cc1	768268406	PMXNWGJEKUKGOB-QHCPKHFHSA-N	446.467	1.769	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)c2ccc(=O)n(-c3ccc(F)cc3)n2)n[nH]1	768281486	LWDLCDIHZXCSKT-UHFFFAOYSA-N	448.414	1.845	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)Nc1ccc(N2CCOCC2)nc1C	769243035	XWYHHTNVZMSNPX-UHFFFAOYSA-N	435.506	1.787	50	20	IDGD	
CSCCNC(=S)NNC(=O)CCC(=O)C(C#N)=C1N(C)c2ccccc2N1C	770241482	YTWAUTOQRZJLNK-UHFFFAOYSA-N	432.575	1.515	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)NC[C@H](c3ccc(Cl)cc3)N3CCOCC3)nc21	770364703	NGWWIYOSPZZDBH-OAHLLOKOSA-N	446.899	1.422	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)CNC(=O)c3ccccc3OC(F)F)nc21	771008903	NMBCAARHODSNTJ-UHFFFAOYSA-N	449.418	1.761	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1cccc(C(F)(F)F)c1)C(=O)NNc1ncnc2[nH]cnc12	771022759	NZCFFFMAKXYYEJ-MRVPVSSYSA-N	429.384	1.182	50	20	IDGD	
O=C(NCCNS(=O)(=O)Cc1ccon1)NNc1ccc(Br)c(F)c1	771332503	CNUDQQNYJMCKDX-UHFFFAOYSA-N	436.263	1.322	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1ccc(F)c(S(=O)(=O)N2CCCCC2)c1	771875437	TZZSCQLSYQXNFC-GFCCVEGCSA-N	429.470	1.103	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1cc(S(=O)(=O)N2CCCC[C@@H]2C)ccc1C	771934923	XAAJQVZSNDHFGZ-LSDHHAIUSA-N	439.534	1.661	50	20	IDGD	
CCn1c(=O)nc(O)c2c(C(=O)O[C@@H](C)C(=O)NNC(=O)CC(C)C)cc(C(C)C)nc21	771995271	QPTSOBMJZOXCKN-LBPRGKRZSA-N	447.492	1.379	50	20	IDGD	
Cc1ccc(N2CCC(C(=O)NNC(=O)C(=O)NCc3ccc(Cl)cc3)CC2)nc1	772195986	VPAABFKSMBOKIA-UHFFFAOYSA-N	429.908	1.724	50	20	IDGD	
O=C(CCc1nc(-c2ccncc2)no1)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772196443	ZYVRNIOASXKTRW-UHFFFAOYSA-N	428.836	1.181	50	20	IDGD	
O=C(NNc1cnc2ccccc2n1)C(=O)Nc1cccc(S(=O)(=O)NC2CC2)c1	773719068	UTNYSPLYCIYLPF-UHFFFAOYSA-N	426.458	1.152	50	20	IDGD	
O=C(NNc1ncccn1)C(=O)Nc1ccc(OCCN2C(=O)c3ccccc3C2=O)cc1	773721471	QJWJGWROIKFZSJ-UHFFFAOYSA-N	446.423	1.233	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)CCc2ccc(S(=O)(=O)NC3CC3)cc2)c1	776537221	ONORGSTYZBVDHT-UHFFFAOYSA-N	437.543	1.607	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)NCc2ccccc2CN2CCC(O)CC2)c1	776627484	OHKXFFDGBZILPF-UHFFFAOYSA-N	432.546	1.873	50	20	IDGD	
Cc1ccc(-n2nc(C(=O)OCC(=O)NNC(=O)Cc3nc(C)cs3)cc2C)cc1	777151014	HRCUOXJHGBOAEU-UHFFFAOYSA-N	427.486	1.801	50	20	IDGD	
COc1cc(OC)c(S(=O)(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)c(OC)c1	777597957	HBILVYBQGULBAA-UHFFFAOYSA-N	437.474	1.277	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)[C@H]1CCN(Cc2ccccc2)C1	779413643	UDXXBQIZRFRKHG-AEFFLSMTSA-N	448.527	1.788	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)[C@@H]2C[C@]23CCN(C(=O)OC(C)(C)C)C3)c2ccccc2c1=O	780171341	LATFZZJJBKHYAE-NYHFZMIOSA-N	441.488	1.342	50	20	IDGD	
COc1ccc(NNC(=O)C2CCN(S(=O)(=O)c3ccc(F)c(F)c3)CC2)nc1	781527839	WOUQEDFCISEAQX-UHFFFAOYSA-N	426.445	1.912	50	20	IDGD	
Cc1cc2cc[nH]c2cc1NC(=O)C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	782119887	ASCFLWRYENJBRI-UHFFFAOYSA-N	443.485	1.126	50	20	IDGD	
C[C@@H](CC#N)Sc1ccccc1NC(=O)C(=O)NNC(=O)CNC(=O)c1cccs1	784005165	RSNYOPXXCRTCPN-LBPRGKRZSA-N	445.526	1.658	50	20	IDGD	
O=C(NNC(=O)[C@H]1CC=CC[C@@H]1C(=O)N1CCOCC1)c1cc(-c2ccc(F)cc2)[nH]n1	784456878	PFMSQFOQUYVWKW-IRXDYDNUSA-N	441.463	1.418	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(NC(=O)C(=O)NNc2ccc(Br)nc2)c1	784810253	YDMQYHJFBOJOEJ-UHFFFAOYSA-N	442.295	1.176	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)c(C(F)(F)F)c1	785068130	UODFVDPOSHSHLW-UHFFFAOYSA-N	435.362	1.690	50	20	IDGD	
COC(=O)CNC(=O)Cc1ccc(NC(=O)C(=O)NNc2nc3ccccc3cc2C)cc1	785158039	CXEOLJWTAIZOGO-UHFFFAOYSA-N	449.467	1.457	50	20	IDGD	
COCCc1ccccc1NC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1	786200155	UXTVHPYGDXHWJQ-UHFFFAOYSA-N	434.518	1.657	50	20	IDGD	
O=C1CC[C@H](C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)c2ccccc21	786260836	PGWMUSPQWKYXSA-KRWDZBQOSA-N	429.498	1.911	50	20	IDGD	
CCOC(=O)N1CCC(NC(=O)CCCNC(=O)/C(C#N)=C/c2ccc(O)cc2)CC1	786986277	TUXWEMKWNLOCTN-SAPNQHFASA-N	428.489	1.933	50	20	IDGD	
COc1cc(C(=O)NNc2ccccc2S(N)(=O)=O)c([N+](=O)[O-])cc1OC(F)F	788228422	KCTBERKDGFWXAX-UHFFFAOYSA-N	432.361	1.609	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2cn(-c3cc(C)cc(F)c3)nn2)c2ccccc2c1=O	788719728	KTGMVTCHHFXZFK-UHFFFAOYSA-N	435.419	1.519	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)[C@@H]1CC12CN(C(=O)OC(C)(C)C)C2	789297034	UQFLUMORLPLWAS-INIZCTEOSA-N	431.489	1.485	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1cc(-c2ccc(F)cc2F)nn1C	789733333	JABLTNNCNJIVCJ-UHFFFAOYSA-N	443.410	1.703	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C(=O)Nc2ccccc2N2C[C@H]3CC[C@H]2C3)nc2ccccc21	790961153	ZDTXZTDGOIYYMG-HOTGVXAUSA-N	446.511	1.891	50	20	IDGD	
Cn1c(C(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)cc2ccccc2c1=O	796514638	DWQQSWDKARYOPU-UHFFFAOYSA-N	443.504	1.882	50	20	IDGD	
Nc1cc(Cl)c(Cl)cc1C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	797484297	ZPOUTVLAFUTTKS-OAHLLOKOSA-N	440.239	1.720	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1ccc(OC(F)F)c(C(F)(F)F)c1	797663598	UCOHHFSTGUSWDA-LURJTMIESA-N	434.343	1.397	50	20	IDGD	
CCc1cccc(C)c1NNC(=O)C(=O)Nc1cnn(CC(=O)N2C[C@H](C)O[C@@H](C)C2)c1	799842716	VNTYLQJVRQSASB-HOTGVXAUSA-N	442.520	1.472	50	20	IDGD	
Cn1cc(S(=O)(=O)NCC(=O)NNC(=O)Nc2ccc(-c3ccccc3)cc2)cn1	802036952	LKEORLGXTYGQCM-UHFFFAOYSA-N	428.474	1.218	50	20	IDGD	
COc1ccc(C2=NO[C@H](CNC(=O)NNC(=O)COc3ccccc3OC)C2)cc1F	802340280	HBEGJEMPPIVUBT-AWEZNQCLSA-N	446.435	1.745	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)NC[C@@H]1CC(c2ccc(OC)cc2)=NO1	802369779	MUKMJVQRENMIDL-KRWDZBQOSA-N	442.472	1.996	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)N[C@H](C)CCNS(=O)(=O)c2ccccc2)cc1C	802529054	ORHWUMNEQKFKCE-QGZVFWFLSA-N	448.545	1.770	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NNc2ccc(-n3ccnc3)nn2)cc1Br	805104198	MVILVURYUCCUKI-UHFFFAOYSA-N	447.253	1.405	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ncccc2C)c(C)cc1Br	806979525	YKQFWCUBRSUOCZ-UHFFFAOYSA-N	449.261	1.647	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)NC[C@@H](c1ccc(F)cc1)N1CCOCC1	806999823	AJSRBFCFSOEUOV-SFHVURJKSA-N	434.443	1.748	50	20	IDGD	
CCc1nnc(NC(=O)[C@@H](C)[C@@H](C)NC(=O)NNC(=O)COc2ccc(F)cc2)s1	807565853	QWVOFRURJHBQOB-WDEREUQCSA-N	438.485	1.612	50	20	IDGD	
COc1ccc(-c2nsc(NC(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)n2)cc1	809926743	RDADRPQFIVHZGO-UHFFFAOYSA-N	437.445	1.656	50	20	IDGD	
COC(=O)c1c(F)ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2OC)c1F	810384535	MAVZGCQZVAVDGI-UHFFFAOYSA-N	441.774	1.813	50	20	IDGD	
O=C(CNS(=O)(=O)c1cccc(Br)c1)NNc1ccc([N+](=O)[O-])cc1	810574207	LTRFWAWXGOEVCL-UHFFFAOYSA-N	429.252	1.779	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)[C@@H](c2cccc(F)c2)N2CCOCC2)cc1	812733353	PCYDPOQUCFQRPX-LJQANCHMSA-N	436.509	1.593	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNC(=O)C(=O)Nc1ncc(C(F)(F)F)s1	812992104	YVFYUBHIGVGKCT-UHFFFAOYSA-N	445.379	1.174	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)c2cn3c(Br)cnc3s2)cc1	815369977	RSQBRHIIOWNDMP-UHFFFAOYSA-N	448.258	1.648	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1cccc(S(=O)(=O)C2CCCCC2)c1	815571547	GVCNJJKFFJKTIU-UHFFFAOYSA-N	433.490	1.673	50	20	IDGD	
CCc1cccc(Oc2ccc(NC(=O)C(=O)NNC(=O)[C@H]3CCc4nncn4C3)cn2)c1	815692163	KYBXHIWXXCPPRJ-HNNXBMFYSA-N	449.471	1.376	50	20	IDGD	
Cc1ccc(Oc2ccc(NC(=O)C(=O)NNC(=O)[C@H]3CCc4nncn4C3)cc2)cc1	815692299	OANQXMWXRFKJRU-HNNXBMFYSA-N	434.456	1.727	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)c1cccc([N+](=O)[O-])c1N1CCOCC1	817054825	ZXLGAAZHOUQPQD-UHFFFAOYSA-N	449.489	1.439	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)c2sccc2S(=O)(=O)N2CCCC2)c1	823296697	VSLKLFKSCCHRSK-UHFFFAOYSA-N	438.531	1.414	50	20	IDGD	
O=C(NNC(=O)c1ccc(C(F)(F)F)cn1)c1ccc(S(=O)(=O)N2CCCC2)cc1	844256352	VDNCWPYVPRJVKT-UHFFFAOYSA-N	442.419	1.960	50	20	IDGD	
CC(C)C[C@@H](C(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)N1C(=O)[C@H]2CC=CC[C@H]2C1=O	866751091	UEMREQWLDXESBV-BBWFWOEESA-N	428.445	1.722	50	20	IDGD	
COc1ncccc1C(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	907100785	QFKXHZHAVHOUAZ-UHFFFAOYSA-N	429.436	1.923	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)/C(=C/c2ccccc2)n2nnnc2C)cc1	912608307	ZQVUKDFNJLAHJJ-KWPCUBQOSA-N	436.472	1.993	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)COc2cccc(NC(=O)C3CC3)c2)c2ccccc2c1=O	914750535	KZVBJJZEHGFFHZ-UHFFFAOYSA-N	435.440	1.122	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H]2CCCCN2C(=O)c2cccs2)c1	915165837	PZUXYQYGIVJADC-OAHLLOKOSA-N	435.527	1.608	50	20	IDGD	
O=C(COC(=O)CCOc1cccc(Cl)c1)NNC(=O)[C@H]1COc2ccccc2O1	915250750	YBCFXJZQZPAKKD-QGZVFWFLSA-N	434.832	1.640	50	20	IDGD	
COc1ccc(/C=C(/C#N)C(=O)OCC(=O)N2CCN(c3oc(C)nc3C#N)CC2)cc1	915369770	CTFAOHCIGJDNSH-BOPFTXTBSA-N	435.440	1.662	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)NCc2cccnc2N2CCOCC2)cc1OC	916400135	SGXHZBXDGYXUBW-UHFFFAOYSA-N	443.504	1.860	50	20	IDGD	
CC[C@@H]1CCCC[C@@H]1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	916634850	RKICFJKDQULNGO-QAPCUYQASA-N	438.550	1.620	50	20	IDGD	
O=C(CN1CCC[C@@H](C(=O)Nc2ccccn2)C1)NNC(=O)c1cccc([N+](=O)[O-])c1	917396693	KFMAWRVOHJDETC-OAHLLOKOSA-N	426.433	1.102	50	20	IDGD	
O=C(Cc1cc(O)nc(S)n1)NN=Cc1cc(Br)c2c(c1)OCCO2	917544804	LIVRNFFXJSZVKZ-UHFFFAOYSA-N	425.264	1.697	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNS(=O)(=O)c2cccc(F)c2[N+](=O)[O-])cc1	918399995	WVZHMDXAINYIKR-NSHDSACASA-N	427.410	1.910	50	20	IDGD	
CCNC(=O)NC1(C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)CCCC1	919972920	YJEXBOGHZVIPCC-UHFFFAOYSA-N	428.493	1.370	50	20	IDGD	
CN1/C(=C(/C#N)C(=O)CSc2nnc([C@H]3CCS(=O)(=O)C3)n2C)Nc2ccccc21	1317716941	DBFCIRVJGAZSEU-JYRXDZGKSA-N	444.542	1.675	50	20	IDGD	
Cn1c(=O)oc2cc(S(=O)(=O)NNC(=O)c3ccc(Br)cc3)ccc21	1317764820	CBUJPSWABUFIPP-UHFFFAOYSA-N	426.248	1.517	50	20	IDGD	
CC(C)[C@H](CNC(=O)NNC(=O)c1ccc(Br)cc1)N1CCN(C)CC1	1317888300	AMPAXHXHAAOAJL-INIZCTEOSA-N	426.359	1.665	50	20	IDGD	
CC(C)C[C@H](C(=O)NNC(=O)c1cncn1-c1ccccc1)N1C(=O)[C@H]2CC=CC[C@H]2C1=O	1321490776	ALZWAPZQAVJALS-CEXWTWQISA-N	449.511	1.999	50	20	IDGD	
O=C(NCc1ccccc1CN1CC[C@H](O)C1)NNC(=O)c1nnc(O)c2ccccc12	1325132933	KFCNJYOPIWVNKR-INIZCTEOSA-N	436.472	1.046	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc3c(c2)CC(=O)N3)C1	1778921642	GZJQNRVBXZEPDY-RADWXHQJSA-N	449.935	1.563	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2	1780574913	DHKHFNMHIRMFMU-WOIUINJBSA-N	433.936	1.824	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Br)C1	1780773781	WMJJIQYRGXQLNW-LSCFUAHRSA-N	436.322	1.058	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H]2CCC(=O)N2C)C1	1780792396	DPULVAICCCIWHM-XTDOFWJNSA-N	444.370	1.295	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1CC(=O)N(Cc3ccccc3)C1)CCO2	1781210960	FEUVPLLJHFLGAM-PWHSHALESA-N	447.963	1.882	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc([N+](=O)[O-])c4c3OCO4)CCO2)C1	1781219380	XVCAJXJLOSHVRL-ORAYPTAESA-N	439.852	1.784	50	20	IDGD	
O=C(c1ccc2nc[nH]c2c1)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781330900	AQDGADOCXKBNNF-YOEHRIQHSA-N	425.258	1.697	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1nccn1C)C2	1781900883	XKQASJPDQAJPAT-HBUWYVDXSA-N	427.343	1.721	50	20	IDGD	
CCc1ccc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CCC(=O)NN(C)C)C2)cc1	1782212358	XCCCHOCYBRBHOO-HYBUGGRVSA-N	444.576	1.750	50	20	IDGD	
COC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1	1782864800	SJUNGPKBBZKZDL-JLOHOZFJSA-N	447.438	1.655	50	20	IDGD	
O=C(C1CCC2(CC1)OCCO2)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1782943958	FOIRZRVOEGBQSG-YOEHRIQHSA-N	449.317	1.440	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)[C@@H]3Cc4ccccc4CN3)CCO2)C1	1783533995	CPZPZSOZVLSWHJ-CFLQYTFWSA-N	436.350	1.314	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(C(C)(C)C)n[nH]3)CCO2)C1	1783536733	IPJQRYSBKCSJGL-XIKOKIGWSA-N	427.343	1.934	50	20	IDGD	
Cn1cnc(C(=O)N2CCO[C@@]3(CCN(C(=O)C(Cl)Cl)C3)C2)c1C(F)(F)F	1783945667	QMLFEWZOWWQBHL-CQSZACIVSA-N	429.226	1.686	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccccc3C(F)(F)F)C[C@@H]21)[C@H](O)CCl	1784090099	RANQQMFPTWBAPG-DIECFANBSA-N	448.869	1.827	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)C(=O)c3cccn3C)C2)C1	1784610841	IVFCAUYSHGXKQP-FZKQIMNGSA-N	426.311	1.211	50	20	IDGD	
O=C(Cn1ccc2sccc2c1=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21	1785256979	IQMYNNYOVAHEGR-MJFSBKNWSA-N	441.912	1.577	50	20	IDGD	
CC(=O)N[C@H](Cc1cccc(F)c1)C(=O)N1CC[C@@]2(CN(C(=O)[C@@H](F)Cl)CCO2)C1	1785454265	LTWUCUYUHPCHIR-HLIPFELVSA-N	443.878	1.237	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3n[nH]c(C4CC4)c3F)[C@H]2C1	1785768396	WSFSJGYDVZJCSA-IXOXFDKPSA-N	443.317	1.803	50	20	IDGD	
CN(C)c1ncc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Br)C[C@@H]32)o1	1785888128	DVNDGUNQMXRUSG-MRBYEJRBSA-N	433.278	1.024	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC1(c2ccc(NC(=O)[C@H]3CCC(=O)NC3)cc2)CCC1	1785902851	BSECJKZIJBIKIV-HNNXBMFYSA-N	429.521	1.020	50	20	IDGD	
Cc1cc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCBr)[C@H]3C2)nn1C	1786404855	XEWRWRQJAQWQFT-BPUTZDHNSA-N	427.343	1.036	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3c(C)nc4sccn34)[C@H]2C1	1788441367	JVTJEDKKJHVNON-AJNGGQMLSA-N	440.953	1.551	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]2C1	1789921240	DDRTWWFMHZVIRM-WTPMCQDGSA-N	444.139	1.688	50	20	IDGD	
CC(C)(C)c1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]3C2)[nH]n1	1789924470	FTVFMPOWGRNZST-TZQJONAQSA-N	445.333	1.991	50	20	IDGD	
C=C(CC(=O)OCC)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](Br)CC)[C@H]2C1	1790963273	QJSYGAGSNFFZBC-JONQDZQNSA-N	445.354	1.649	50	20	IDGD	
Cc1nc(F)ccc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]2C1	1791058839	IIOZSSKIFNVFGI-WCUVEOEZSA-N	428.302	1.906	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccn(C(F)F)n3)C[C@@H]21	1791059072	NIBCJMUXWHQJBD-BLFANLJRSA-N	435.269	1.655	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1ccc(C2(NC(=O)c3cnccc3C(=O)NN)CCC2)cc1	1791568772	IHRNTAUALQQCTO-QGZVFWFLSA-N	445.907	1.687	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccccc3C3CC3)[C@H]2C1	1791910798	OYNMQAYMHWEUMS-YYWHXJBOSA-N	442.560	1.530	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(-c2ccccc2)on1)c1ccc(B(O)O)cc1	1792459241	CWOCUCWENGCJSU-ACDBMABISA-N	445.284	1.587	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cccc(C(F)(F)F)c1)C2)[C@@H](O)CCl	1792983851	QVOOQFSVQQAINR-YXPYIKCWSA-N	434.842	1.437	50	20	IDGD	
CC1CCN(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)CBr)C3)CC1	1793199829	PZXCBRXKTJFHDP-CUSZFKRNSA-N	430.387	1.339	50	20	IDGD	
Cc1ncccc1CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2	1793918761	JBBSIKWXCTVZPP-YALNPMBYSA-N	428.302	1.603	50	20	IDGD	
CO[C@@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)CBr)C2)c1ccccc1	1795168612	YNSBUCQUYUQVGI-SOVHRIKKSA-N	439.350	1.995	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccc2c(c1)OCO2	1795313053	PSMOVMNQMVFJMZ-GNTLTTKYSA-N	439.306	1.331	50	20	IDGD	
Cc1ccc2oc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3cccc(B(O)O)c3)cc2n1	1796191124	BAAGZPBAHOSTFE-BCDXTJNWSA-N	433.273	1.382	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](C)n1cc(C)cn1)C2	1796893240	UXNIFZHGXLYEFI-VEVDZHASSA-N	439.520	1.525	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc2c1cnn2C	1797086791	KKYJDIYLSZSVCI-ZUMXRPEOSA-N	449.349	1.808	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@]1(F)CCCCC1(F)F	1797212891	MCJZRMJDJCOBBI-IQNXINDISA-N	426.863	1.747	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2c(c1)CNC2=O	1797549154	JTEVSAYKIIPPMC-IDLUEMFASA-N	440.327	1.370	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1n[nH]c2ccccc12	1798071899	HMRJZAHQCWRIOG-MVRRYPJTSA-N	447.499	1.949	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(=O)nc2sccn12	1798412409	WVDODWRIKIJJPC-ZWUHOBOKSA-N	438.937	1.367	50	20	IDGD	
CN(C)c1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)cc1	1798441923	OXMFXBYEVQDZPG-VBUUOAMHSA-N	436.516	1.317	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN1CCc3sccc3C1)C2	1799263283	JHSCVPUDVWIUKS-RCJHGTSTSA-N	425.982	1.713	50	20	IDGD	
CCCOc1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)cc1	1799760104	BMYFCOIUNYTOJZ-WKCHPHFGSA-N	436.317	1.721	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1n[nH]c2cccc(F)c12	1800079598	LDHHVLGZLGDBOW-YYHMBLRTSA-N	439.285	1.689	50	20	IDGD	
COC(=O)N(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](O)CCl)C2)Cc1ccccc1	1802105588	KRNTUSHRDVMJMQ-XMTFNYHQSA-N	437.924	1.493	50	20	IDGD	
NC(=O)c1ccc(C(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)cc1	1803145604	FFMYVUQEYZJVPB-FGTMMUONSA-N	430.892	1.100	50	20	IDGD	
O=C(CCBr)NC[C@@H]1CCN(C(=O)c2cc(O)ncn2)[C@@H]1c1cccnc1	1806341624	DBVQNWFLNVGPOQ-SUMWQHHRSA-N	434.294	1.682	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H](CNC(=O)[C@@H]2C[C@H](O)CN2)[C@H]1c1cccnc1	1807707856	PDGBBLJZPOIJLW-TVEAVKIZSA-N	429.348	1.047	50	20	IDGD	
Cc1nc(C)c(C(=O)N2CCC3(CCCN(C(=O)c4cccc(B(O)O)c4)C3)CC2)o1	1809977580	HLELQOYOASRGOI-UHFFFAOYSA-N	425.294	1.130	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)C(C)(C)CCl)[C@@H]1c1cccnc1	1813068926	QUZGOSLGONORNB-QFBILLFUSA-N	437.972	1.725	50	20	IDGD	
CN1CCN(CCC(=O)Nc2nc3c(s2)C[C@H](NC(=O)C(Cl)Cl)CC3)CC1	1814586518	SLKLZZRJLNUBOV-LLVKDONJSA-N	434.393	1.496	50	20	IDGD	
C[C@H](CBr)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CN2CCOC2=O)[nH]n1	1814778358	GJFZGMVAQAPMRW-DGCLKSJQSA-N	442.314	1.885	50	20	IDGD	
O=C(C[C@@H]1CCCCO1)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1815603281	NUUSJEPCLQHECC-HKUYNNGSSA-N	440.309	1.355	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](N)Cc3cscn3)sc2C1	1816989422	KRNPAYJPRKNXOX-JLLWLGSASA-N	443.982	1.335	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2CCC=CO2)[nH]n1	1819403446	MFUVVIOSCQTZRA-IRXDYDNUSA-N	439.476	1.407	50	20	IDGD	
CN1N=C(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)CO[Si](C)(C)C)n[nH]2)CCC1=O	1819592140	YNSLYCIIZJGOQE-OAHLLOKOSA-N	434.573	1.862	50	20	IDGD	
CC(C)NC(=O)OC(C)(C)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](O)CCl)CC2	1822574208	FECMDBGTWCIVOV-JQWIXIFHSA-N	446.957	1.568	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)C1CC2(CCC2)C1	1823052980	BBIHGDAKWZJSPF-IBGZPJMESA-N	436.321	1.976	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccoc2)CC1	1825051680	GILTVRNCHFAPGX-LQPWBEKMSA-N	436.317	1.906	50	20	IDGD	
C[C@@H](O)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CC2	1825613121	DMNXWZJHOUHEGD-FOGDFJRCSA-N	446.957	1.568	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)N[C@H]1CCc2nc(NC(=O)[C@H](C)Br)sc2C1	1825640462	AQBWGLBBYOPHIP-AEJSXWLSSA-N	446.371	1.546	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cn3ncccc3n1)CC2	1825999599	AJXUVRAJZRNREY-MNOVXSKESA-N	434.909	1.665	50	20	IDGD	
Cc1nc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)cs1	1826123217	SKOPXHQJSGTZJS-FQEVSTJZSA-N	441.362	1.678	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)CCn3cncn3)sc2C1	1826611216	QMLWUGDISYGIIQ-WDEREUQCSA-N	441.355	1.910	50	20	IDGD	
Cc1ccn(C)c1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827052530	MZTDRIGWMSZCHQ-NRFANRHFSA-N	437.349	1.560	50	20	IDGD	
CC(C)O[C@H](C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1	1829020181	LPPKHKYNIIKRFI-DYESRHJHSA-N	430.354	1.413	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC([C@H]2CCCCN2C(=O)c2nccnc2C(N)=O)CC1	1829510180	GBOVOCPLTXXKQG-MRXNPFEDSA-N	447.612	1.660	50	20	IDGD	
CC(C)c1ccc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)cc1	1830734942	BEJTYRVOOGNDAN-DENIHFKCSA-N	438.952	1.409	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4cncn4c3)C2)C1	1831651496	PXYCLMJJFARTCD-RXVVDRJESA-N	434.924	1.812	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc([N+](=O)[O-])[nH]3)C2)C1	1831653708	CWYVAORDUMWZSM-UGSOOPFHSA-N	428.873	1.400	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H](O)CCl)CC1	1831814247	XYKXOUKLECVLAD-MANSERQUSA-N	440.968	1.961	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnc(O)nc2O)CC1	1831832779	IPPVMIMUYMGCPQ-CABCVRRESA-N	426.901	1.375	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(F)n2)CC1	1831873249	FMDNNGJIRGVGEU-GOSISDBHSA-N	433.528	1.827	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccnc(F)c1)CCO2	1831903525	WLBGZDDVCOOUGY-LJQANCHMSA-N	425.533	1.142	50	20	IDGD	
CC[S@@](=O)CCC(=O)N1CCC(N2CCC(NC(=O)C(C)(C)CCl)CC2)CC1	1833214842	RNUBRNJFDCTULC-MUUNZHRXSA-N	434.046	1.982	50	20	IDGD	
C#CCO[C@@H](C)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)CBr)CC2)CC1	1833464241	SLYOTZWTFRIDBN-HOTGVXAUSA-N	442.398	1.627	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3cc(O)ncn3)CC2)CC1	1833555755	IBYPZRYNAZJRAW-LBPRGKRZSA-N	440.342	1.151	50	20	IDGD	
Cn1nccc1C(=O)NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1	1834212756	KBABWQQTDTYJHL-HNNXBMFYSA-N	430.322	1.296	50	20	IDGD	
Cc1cc(C(=O)NC2CCN(C3CCN(C(=O)[C@H](F)Br)CC3)CC2)no1	1834251152	JAJROCOSOVOFKZ-HNNXBMFYSA-N	431.306	1.859	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)c1cc2cccn2cn1	1835424034	SJXWMGCIRSEHKK-LJQANCHMSA-N	433.940	1.119	50	20	IDGD	
CNc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)CCBr)C3)C2)cc1	1835602362	SISZETHTLYMJQA-IBGZPJMESA-N	440.338	1.583	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1)c1ccnnc1O	1836063476	XLFUVRFZHQMICZ-UHFFFAOYSA-N	440.342	1.152	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc([N+](=O)[O-])o3)C2)C1	1837709074	UUSWSPWWWLKYDF-SFHVURJKSA-N	441.513	1.109	50	20	IDGD	
CC(C)n1ccc(C(=O)N2CCOC[C@@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)n1	1837715150	ZDPQMAXHJVHIHJ-HXUWFJFHSA-N	438.601	1.386	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)c(C)n1C	1837715333	KTJURDKAHVAYCU-NRFANRHFSA-N	437.613	1.563	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(F)nc3)CCO2)C1	1837851016	CMGZCJBGRKOYOC-SJKOYZFVSA-N	430.274	1.074	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3c(F)ccc(O)c3F)CCO2)C1	1839411797	KKQLKKLVGUEWQD-CWTRNNRKSA-N	432.851	1.758	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3CC=CCC3)C2)C1	1839961905	MSRUEOPKDRAXFL-JTDSTZFVSA-N	429.355	1.973	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(Cl)cc3C)C2)C1	1840149521	RPNAQPCZHFOQSY-XLIONFOSSA-N	445.343	1.972	50	20	IDGD	
COC(=O)c1ccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)cc1	1840278392	GVMVYKYPUDXLTO-XLIONFOSSA-N	442.871	1.007	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)c1ccccn1)CCO2	1840330152	NJJJHVNXIDMYBA-IERDGZPVSA-N	439.940	1.069	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(C)cc(Cl)c3)CCO2)C1	1840699600	OYGPAXCZDQYZCT-YLJYHZDGSA-N	445.343	1.972	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)[C@@H]2CCc3cccc(Cl)c32)C1	1845867540	FTCRKGJPXDFHKU-MRXNPFEDSA-N	432.952	1.946	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)Cc1cnccn1	1847670408	PXZHXKLFBJYAEM-ROUUACIJSA-N	439.428	1.368	50	20	IDGD	
Cc1csc(CCC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2cnccc2C(=O)NN)c1	1848203349	VGYYWWNXGYSOBH-ROUUACIJSA-N	427.530	1.503	50	20	IDGD	
CSCC[C@@H](NC(=O)c1ccco1)C(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	10159951	CCZKRIXIWZKFIU-CQSZACIVSA-N	443.485	1.484	50	20	IDGD	
C[C@H](NS(=O)(=O)c1ccc(Cl)cc1)C(=O)NNC(=O)COc1ccc(F)cc1	18101474	SYAJLASOZGQJHQ-NSHDSACASA-N	429.857	1.372	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)CCCNC(=O)NC2CCCCC2)c2ccccc2c1=O	23353810	PBSSHJZMEAJLIE-UHFFFAOYSA-N	442.520	1.590	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)c1cccc(CN2C(=O)CNC2=O)c1	26793410	ITUCPIKPJOLHAH-UHFFFAOYSA-N	434.456	1.112	50	20	IDGD	
O=C(NNC(=S)NCCc1ccc2c(c1)OCCO2)c1nnc(-c2ccccc2)o1	726749391	OAFRYKQHFQYBNW-UHFFFAOYSA-N	425.470	1.859	50	20	IDGD	
C#Cc1cccc(NC(=S)NNC(=O)CSc2ccc(C(N)=O)cc2[N+](=O)[O-])c1	727501402	VAAFQXTXEZRVRV-UHFFFAOYSA-N	429.483	1.785	50	20	IDGD	
COCCN1C(=O)c2ccc(C(=O)NNc3ccc(F)c(F)c3F)cc2S1(=O)=O	728717329	QAYDFLWNVSPOJS-UHFFFAOYSA-N	429.376	1.652	50	20	IDGD	
CS(=O)(=O)NC1(CNC(=O)NNC(=O)c2cccc(OC(F)F)c2)CCCCC1	728742880	SKQHLBCBJWDMGR-UHFFFAOYSA-N	434.465	1.484	50	20	IDGD	
C[C@H](C(=O)NNC(=O)Cc1cccnc1)N1C(=O)c2ccc(Br)cc2C1=O	728852563	GJZGRAGQHMDMOW-SNVBAGLBSA-N	431.246	1.219	50	20	IDGD	
Cc1ccc([C@@H](CNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)N(C)C)cc1	728961407	HIZUUDVVDILQTI-LJQANCHMSA-N	425.537	1.635	50	20	IDGD	
COc1ccc(-c2nn(CCC#N)cc2C(=O)NNC(=O)Cc2ccccn2)cc1[N+](=O)[O-]	729397385	XOTJUYBUCVGIJZ-UHFFFAOYSA-N	449.427	1.779	50	20	IDGD	
CC(C)NS(=O)(=O)c1cccc(CNC(=O)NNC(=O)Cn2ccc3ccccc32)c1	729496166	NOSFMRAYZMTYKD-UHFFFAOYSA-N	443.529	1.859	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)c1ccc(S(=O)(=O)NC[C@H]2CCCO2)cc1	731494050	LZAVUJTVFHSCCD-OAHLLOKOSA-N	433.486	1.227	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Cn2c(=O)cnc3ccccc32)cc1Br	732034060	XBVYSSRXSKEGKC-UHFFFAOYSA-N	431.246	1.629	50	20	IDGD	
CC(C)C(=O)Nc1ccc(C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1	732322398	BJGMFTGNUDOXJF-UHFFFAOYSA-N	428.401	1.807	50	20	IDGD	
CCC1CCC2(CC1)NC(=O)N(CC(=O)NNc1nc3ccccc3c(=O)n1C)C2=O	733261781	MDJZQHVZQWJATB-UHFFFAOYSA-N	426.477	1.267	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)c1ccc(S(=O)(=O)C(F)F)cc1	734240937	WYZFZDAZEZEGSN-UHFFFAOYSA-N	436.437	1.152	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCc3ccccc32)cc1C(=O)NNc1cnccn1	734244331	HBMOMLZMGIBQMI-UHFFFAOYSA-N	425.470	1.994	50	20	IDGD	
CN1C(=O)C[C@H](C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)[C@@H]1c1cccc(Cl)c1	734393613	SXOMQBCGRPWREW-WMZOPIPTSA-N	449.916	1.724	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2ccc([N+](=O)[O-])c(C)c2)cc(OC)c1OC	734414105	ACAFZLRPFUDEMZ-UHFFFAOYSA-N	425.419	1.552	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H]2CCCN(c3ccccc3)C2)c1	734676504	QFTVWQFMJKYDPU-KRWDZBQOSA-N	445.545	1.550	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)CSc2nnc(-c3cccnc3)n2-c2ccccc2)cn1	735444671	ZXXBSNXHAJLHFT-UHFFFAOYSA-N	434.485	1.616	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)CNC(=O)c2ccc(F)cc2F)cc1C	736747137	PXLDYDQXAKYYDJ-UHFFFAOYSA-N	439.440	1.631	50	20	IDGD	
CC[C@H](CNC(=O)NNC(=O)C(=O)N1CCCC1)Cc1cccc(Br)c1	737061896	VNZBTUAFOQPOHN-ZDUSSCGKSA-N	425.327	1.971	50	20	IDGD	
CC[C@H]1CCCCN1CCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	737066964	NOQJESYAWBFPAR-INIZCTEOSA-N	425.555	1.145	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNS(=O)(=O)c1c(Cl)cccc1C(F)(F)F	739668126	IGDBGDSJWCRWAD-UHFFFAOYSA-N	425.772	1.691	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)[C@H](c1ccccc1F)N1CCOCC1	742223355	BSDVHRJOEATKTM-NRFANRHFSA-N	431.464	1.824	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)c2cccc(Br)c2)c1	742770361	XMULYAULRPTZSE-UHFFFAOYSA-N	444.282	1.913	50	20	IDGD	
CN(C[C@H]1CCCN(CC(=O)NNC(=O)c2cccc(C#N)c2)C1)C(=O)OC(C)(C)C	744393951	VVLLAVVGSLAAHS-QGZVFWFLSA-N	429.521	1.898	50	20	IDGD	
O=C(CN1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1)NNC(=O)c1cccc([N+](=O)[O-])c1	744421064	CYTXPFAZEHLIAI-UHFFFAOYSA-N	443.416	1.807	50	20	IDGD	
CCOC(=O)[C@H](NCC(=O)NNC(=O)c1cc(Cl)ccc1OC)c1cccc(O)c1	746494083	HVBFEUOAKHFOTB-GOSISDBHSA-N	435.864	1.709	50	20	IDGD	
COc1cc(C)nc(NNC(=O)CCNC(=O)c2cc(F)ccc2Br)n1	746623299	KPBZLWRMXBEQKJ-UHFFFAOYSA-N	426.246	1.958	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(=O)n(CC(=O)NNc2ccc(Cl)c(F)c2)c1	746695677	JHXJCPRGTCEQKF-UHFFFAOYSA-N	430.889	1.815	50	20	IDGD	
COc1ccc(C(=O)NNc2nccn(C)c2=O)cc1S(=O)(=O)N[C@@H]1CCCC[C@@H]1C	747941465	GMQDDGJJBCHAII-DZGCQCFKSA-N	449.533	1.403	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3cn(C)c4ccccc34)cc2)CC1	748621235	YQAQGDLZRNZGJM-UHFFFAOYSA-N	427.530	1.871	50	20	IDGD	
Cc1cccc(N2CCN(S(=O)(=O)CC(=O)NNC(=O)CCc3ccccc3)CC2)c1	749800012	HQSHTQUPXMIJGF-UHFFFAOYSA-N	444.557	1.227	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)N2CCN(/C(=C\C#N)c3ccc([N+](=O)[O-])cc3)CC2)C[C@@H](C)O1	750035595	GJIHTYAZCFUNSU-KVHAGPBPSA-N	435.506	1.431	50	20	IDGD	
CO[C@@H](C)c1noc(CN2CCCN(CC(=O)NNC(=O)c3cccc(C)c3)CC2)n1	750062117	YDGCCSCMADPYQJ-INIZCTEOSA-N	430.509	1.054	50	20	IDGD	
CO[C@H](C)c1noc(CN2CCCN(C(=O)/C(C#N)=C/c3cc(C#N)n(C)c3C)CC2)n1	750114915	UJRPZNXLYFHBFU-VHWUNXFSSA-N	437.504	1.937	50	20	IDGD	
CC(=O)[C@@H]1CC(C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)=NN1c1ccccc1	750864785	DBNTYPYPGADAHU-SFHVURJKSA-N	432.440	1.563	50	20	IDGD	
CC1CCN(C2CCC(NC(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)CC2)CC1	752706266	FYLFEDAXZYZBFI-UHFFFAOYSA-N	440.548	1.921	50	20	IDGD	
CC(C)[C@@H]1OCCC[C@H]1CNC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	753033673	FNFSTMLWDZPYNQ-UGKGYDQZSA-N	431.581	1.980	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)c1noc(Cc2ccccc2)n1	753048511	CDIOCTMGEYWYQG-ZDUSSCGKSA-N	447.455	1.613	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCC[C@H]2CCO[C@@H](C)C2)cc1	753344553	KXWVPWCMINBXMU-HOTGVXAUSA-N	426.539	1.151	50	20	IDGD	
COC(=O)c1c(Br)ccc(NC(=O)C(=O)NNC(=O)c2cccn2C)c1C	753841160	PSKWJSGAYMFAEH-UHFFFAOYSA-N	437.250	1.282	50	20	IDGD	
O=C(NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12)c1ccc2nc[nH]c2n1	754848192	XACGWGXEEOXMAJ-UHFFFAOYSA-N	439.435	1.791	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)NCCN2C(=O)[C@@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2=O)c(Cl)c1	755245886	CBLSWCOEOGUFIG-YXAMBPQSSA-N	431.880	1.791	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)Nc2ccc(S(=O)(=O)/N=C3\CCCCCN3C)cc2)n[nH]1	756112543	CWQCBUBQNUPSFA-KOEQRZSOSA-N	447.521	1.778	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)Nc1ccc(Cl)cc1OCC(F)(F)F	756573364	AOPXUERSIXQSQN-MRVPVSSYSA-N	429.804	1.869	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Nc2ccn(Cc3ccccn3)n2)cc(OC)c1OC	756646326	LORHHIIMUVJDEN-UHFFFAOYSA-N	426.433	1.819	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)[C@H](O)c2cc(Cl)cc(Cl)c2)n1	756752836	GNVZXPGAYMVTJU-OAHLLOKOSA-N	432.285	1.725	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)Nc1ccc(C(=O)NC2CCOCC2)cc1	757619431	PIKMGZOZYOJOPP-LJQANCHMSA-N	440.456	1.588	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)Nc1ccc2nc(N3CCOCC3)oc2c1	757777504	PXHXMCULKWOFGB-UHFFFAOYSA-N	425.401	1.860	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@H]1CCCC[C@H]1NC(=O)NNC(=O)C(=O)Nc1ccccn1	758814272	YZLBAFPBELSYCM-ZIAGYGMSSA-N	434.497	1.434	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cccc([C@@H]3CCOC3)c2)cc1	761197306	RTMLBQQOGGCJDQ-GOSISDBHSA-N	431.514	1.581	50	20	IDGD	
COc1cc(C#N)ccc1OCC(=O)NNC(=O)c1sc(N2CCOCC2)nc1C	761385625	KNPMGRVQVOKECQ-UHFFFAOYSA-N	431.474	1.008	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)[C@H](C)NC(=O)c2cc3c(C)nn(C)c3s2)n1	762893544	HSMLLDXIIRUZHN-LBPRGKRZSA-N	430.538	1.841	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=S)NCCc1ccc(Cl)cc1Cl	763162442	BYVSPJQTZLYAJC-UHFFFAOYSA-N	426.329	1.856	50	20	IDGD	
O=C(NNC(=O)c1ccccc1)C(=O)Nc1cccc(S(=O)(=O)N2CCCCC2)c1	763420218	OUFSHKJNAKTAKF-UHFFFAOYSA-N	430.486	1.261	50	20	IDGD	
O=C(NNC(=O)c1ccccc1)C(=O)Nc1ccc2c(ccn2CCN2CCOCC2)c1	763426387	WMVYIKDAEAVMNA-UHFFFAOYSA-N	435.484	1.373	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNS(=O)(=O)c1ccc(N2CCOC2=O)cc1	763439820	VFVGZGFSWASYDG-UHFFFAOYSA-N	442.494	1.258	50	20	IDGD	
CC(C)S(=O)(=O)c1ccccc1NC(=O)C(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	763442905	FUDPWBOXXSIPKM-UHFFFAOYSA-N	434.430	1.177	50	20	IDGD	
O=C(Cc1ccccc1)Nc1cc(NC(=O)C(=O)NNC(=O)c2ccccn2)ccc1F	763466051	CYGKOVBAURLTPE-UHFFFAOYSA-N	435.415	1.802	50	20	IDGD	
CCCS(=O)(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2ccccc2O)c1C	763531434	NVNDMUVAFTZXNS-UHFFFAOYSA-N	434.474	1.252	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3c[nH]c4ccccc34)cn2)C[C@@H](C)O1	763539863	ANHKQKPIDZQMPY-OKILXGFUSA-N	436.472	1.576	50	20	IDGD	
Cn1c(C(C)(C)C)nc2cc(NC(=O)C(=O)NNC(=O)COc3ccccc3C#N)ccc21	763809559	WTVXCEPAEBLSID-UHFFFAOYSA-N	448.483	1.907	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)n1	763882608	VKZIARAPOHIZCH-UHFFFAOYSA-N	432.440	1.950	50	20	IDGD	
Cc1csc(-c2ccc(NC(=O)C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)cc2)n1	763920659	BKSKWFBMVMRIHB-UHFFFAOYSA-N	448.468	1.494	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(C(F)(F)F)c2)cn1	764036821	BAJVLQPQYBYEIJ-UHFFFAOYSA-N	426.351	1.525	50	20	IDGD	
CS(=O)(=O)c1ccc(F)c(NC(=O)C(=O)NNC(=O)c2cccc3ccccc23)c1	764049106	SVYXSZFVHXLAMF-UHFFFAOYSA-N	429.429	1.782	50	20	IDGD	
CCNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2cccc(Br)c2)c1	764058170	CSOMCRNICLOQPT-UHFFFAOYSA-N	433.262	1.599	50	20	IDGD	
CC[C@H](C)C(=O)NNC(=O)C(=O)Nc1cc(C)nn1[C@H]1CCN(Cc2ccccc2)C1	764087220	YJUZRVWVTXMIGS-YJBOKZPZSA-N	426.521	1.771	50	20	IDGD	
Cc1ccc(C(=O)NC2CC2)cc1NC(=O)C(=O)NNC(=O)c1ccc(Cl)cc1O	764127705	YPEJHSJISWBIKD-UHFFFAOYSA-N	430.848	1.646	50	20	IDGD	
O=C(NNC(=O)c1ccoc1)C(=O)Nc1cnc(Br)c(Br)c1	764159142	SSUUHJYEKPFADG-UHFFFAOYSA-N	432.028	1.599	50	20	IDGD	
Cn1nc(C2CCCC2)cc1NC(=O)C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C	764204506	WNGNYSAABCCANB-UHFFFAOYSA-N	436.513	1.469	50	20	IDGD	
O=C1C[C@H](c2cccc(NC(=O)C(=O)NNC(=O)c3c(Cl)cccc3Cl)c2)CN1	764221379	OUPRKVJJHVJSOV-NSHDSACASA-N	435.267	1.997	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)C(=O)Nc2cccc(NC(C)=O)c2)c1	764233251	VHVSROTZSITKQS-UHFFFAOYSA-N	449.261	1.816	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)C(=O)Nc1cccc(N2C(=O)c3ccccc3C2=O)c1	764265655	DMXIZYUQWXLALN-UHFFFAOYSA-N	443.419	1.211	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2ccc(C)o2)cc(OC)c1Br	764369733	JAEBYLUXRKKZFX-UHFFFAOYSA-N	426.223	1.767	50	20	IDGD	
CCS(=O)(=O)c1cccc(CC(=O)NNc2nc(Br)cn3ccnc23)c1	764458247	BEZVJWNQAGGZAR-UHFFFAOYSA-N	438.307	1.971	50	20	IDGD	
CC(C)C[C@@H](C(=O)NNC(=O)CSc1ccccc1O)N1C(=O)[C@H]2CC=CC[C@H]2C1=O	765248309	PWNLIDVLVGHIFX-XHSDSOJGSA-N	445.541	1.998	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2csc(S(=O)(=O)N3CCc4ccccc4C3)c2)n[nH]1	765585796	HAXBUHQSNOJEHI-UHFFFAOYSA-N	445.526	1.601	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)CNC(=O)c2ccc(F)cc2F)n[nH]1	765599986	FBUHRNZXCCMECH-UHFFFAOYSA-N	429.383	1.555	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)NC[C@@H]2CCCS2(=O)=O)cc(OCC)c1OCC	765899943	OZPXHTMIXZWXTP-AWEZNQCLSA-N	443.522	1.404	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1ccc(NC(=O)C2CC2)cc1C(F)(F)F	766270512	ITBNWIRNPXSTQQ-UHFFFAOYSA-N	438.366	1.934	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)CN1CCN(C(=O)c2ccc(F)cc2Cl)CC1	766868031	UZGHPWSNNKBLGX-UHFFFAOYSA-N	446.910	1.935	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)CCS(=O)(=O)c1ccc(F)cc1	767234781	FCXJEUKFGAXPHV-UHFFFAOYSA-N	436.461	1.231	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1)c1ccc(-n2cncn2)c([N+](=O)[O-])c1	768277167	SENJAHTXEAJXNZ-UHFFFAOYSA-N	436.363	1.780	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2ccc(C(=O)O)c(F)c2)cc(OC)c1OC	768495012	CDBXQCGNBQAWLB-UHFFFAOYSA-N	428.394	1.173	50	20	IDGD	
O=C(Cc1ccc(S(=O)(=O)N2CCCCC2)cc1)NNC(=S)Nc1ccccn1	768583678	FVHDAZUPJBOUMJ-UHFFFAOYSA-N	433.559	1.817	50	20	IDGD	
CCNC(=O)c1ccc(CNC(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)cc1	770340727	JSFTVZLESUPVIJ-UHFFFAOYSA-N	426.481	1.863	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)[C@@H]3CCCCN3C(=O)OCc3ccccc3)nc21	770973103	YKZANBGBUWTZPJ-HNNXBMFYSA-N	425.449	1.703	50	20	IDGD	
CC(C)(C(=O)NNS(=O)(=O)c1ccc(NS(C)(=O)=O)c(F)c1)c1ccccc1	771145209	WFQSDSWSAHZDCQ-UHFFFAOYSA-N	429.495	1.485	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)CNS(=O)(=O)c1ccc2ccccc2c1	771936512	BNAOLGDBMWGTRX-AWEZNQCLSA-N	435.502	1.243	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1ccccc1NS(=O)(=O)c1ccc(C)cc1	772137391	ZKHULULPZPJHBC-AWEZNQCLSA-N	433.486	1.899	50	20	IDGD	
C#CCOc1ccccc1NC(=O)C(=O)NNC(=O)COc1ccc(Br)cc1	773493448	ATAAJIMXJHTHCW-UHFFFAOYSA-N	446.257	1.626	50	20	IDGD	
Cc1c(Cl)cccc1NNC(=O)C(=O)Nc1ncn(CC(=O)N2CCCCCC2)n1	773771754	XCGGJGZHDJOCJZ-UHFFFAOYSA-N	433.900	1.724	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)NC[C@H]2CC[C@@H](C(=O)N(C)C)O2)c1	775454857	NWJYLSDCDRWSOB-RISCZKNCSA-N	443.298	1.038	50	20	IDGD	
CN(NC(=O)[C@H]1CC(=O)N(C(C)(C)C)C1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776201644	KRCBKWWWOLRMRT-AWEZNQCLSA-N	425.530	1.269	50	20	IDGD	
COC(=O)C1(c2ccc(S(=O)(=O)NNC(=O)CSc3ccccc3O)cc2)CC1	776309714	NRTJUGVBFUYADR-UHFFFAOYSA-N	436.511	1.699	50	20	IDGD	
C[C@H]1OC(C)(C)N(C(=O)OC(C)(C)C)[C@H]1C(=O)OCC(=O)NNC(=O)c1cccs1	776481122	VKKFPPQQYJQJFC-BXUZGUMPSA-N	441.506	1.813	50	20	IDGD	
COc1ccc2nc(NNC(=O)CCN3CCN(C(=O)[C@H]4CCCO4)CC3)c(C)cc2c1	778478328	CRSJSMFWPGTADN-HXUWFJFHSA-N	441.532	1.708	50	20	IDGD	
Cc1ccc(S(=O)(=O)c2ccc(NNC(=O)Cn3nc4ccccn4c3=O)cc2)cc1	779168827	NQBMQZFDZXRHKL-UHFFFAOYSA-N	437.481	1.781	50	20	IDGD	
CCn1cc(-c2nn(C)cc2C(=O)NNC(=O)c2cc(Br)ccc2O)cn1	779381382	TZUSILZKEIULSN-UHFFFAOYSA-N	433.266	1.846	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NCc2nc3cc(Cl)ccc3n2C)c2ccccc2c1=O	779673591	PPIBBJUDNRPZQY-UHFFFAOYSA-N	439.863	1.618	50	20	IDGD	
Cc1nn(-c2ccccc2)cc1NC(=O)C(=O)NNC(=O)Cc1nc2ccccc2n1C	782894652	ROUZAPPNNUHGSO-UHFFFAOYSA-N	431.456	1.396	50	20	IDGD	
Cc1ccccc1-c1cc(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)n(C)n1	782894947	ZNCBKXFDJVDOIO-UHFFFAOYSA-N	445.483	1.611	50	20	IDGD	
Cc1ccccc1NC(=O)NNC(=O)C(=O)Nc1cccc(OCCS(C)(=O)=O)c1	783416073	ORCMIKJVFXQDPP-UHFFFAOYSA-N	434.474	1.210	50	20	IDGD	
CCN(CC)CCSCC(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	783703876	IAXKRSHQHJUIOS-UHFFFAOYSA-N	431.603	1.697	50	20	IDGD	
CC(C)(C)OC(=O)N[C@]1(C(=O)NNc2ncnc3[nH]cnc23)[C@@H]2CCCO[C@@H]2C1(C)C	783899526	IYEDSWOLQBLBAS-RZZGRXHGSA-N	431.497	1.895	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2cnc3c(c2)C[C@@H](NC(=O)OC(C)(C)C)CC3)ncn1	783947618	AZINUTBSCPZNLL-AWEZNQCLSA-N	441.492	1.644	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1cccc2c1OCO2	784833722	LYPTVPSSKBYGBI-UHFFFAOYSA-N	434.474	1.574	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNc2cccc(S(C)(=O)=O)c2)c(F)cc1F	784839283	IETOHPAWNQYKSJ-UHFFFAOYSA-N	427.385	1.237	50	20	IDGD	
COc1cc(F)cc(NNC(=O)C(=O)N2CCc3cc(S(=O)(=O)N(C)C)ccc32)c1	785241956	SZMUBALAEYSLIT-UHFFFAOYSA-N	436.465	1.117	50	20	IDGD	
CNC(=O)c1cccc(NC(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)c1C	785834695	IMIXXFACCXTSMK-UHFFFAOYSA-N	448.524	1.996	50	20	IDGD	
C[C@@H](Cc1ccccc1)NC(=S)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	786059273	ZFFSSUSEAVARCD-NSHDSACASA-N	426.951	1.728	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(c2ncc(NC(=O)NNC(=O)c3cccnc3)cn2)CC1	786177587	CMAGZCNYCLAADL-UHFFFAOYSA-N	442.480	1.395	50	20	IDGD	
CCc1c(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cnn1C1CCCC1	789258894	HWLSOHRDYCKERR-IBGZPJMESA-N	442.472	1.705	50	20	IDGD	
CN(C)[C@H]1CCOc2c(NC(=O)C(=O)NNC(=O)COc3ccc(Cl)cc3)cccc21	789731694	GDGLPJOBVIAZCG-KRWDZBQOSA-N	446.891	1.890	50	20	IDGD	
COc1cc(C(F)(F)F)ncc1NC(=O)C(=O)NNC(=O)c1cccc(N(C)C)c1	792268966	QXSXEJBCGAHWLY-UHFFFAOYSA-N	425.367	1.575	50	20	IDGD	
Cn1c(=NNC(=O)C(=O)Nc2cccc(N3C(=O)CCCC3=O)c2)sc2ccccc21	792352633	FCCIBJADNMJGME-UHFFFAOYSA-N	437.481	1.854	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(CC(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)cc1	793711230	DXNDUFQNDIUPHE-UHFFFAOYSA-N	447.485	1.619	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@@H]2C(=O)NNC(=O)c2cccc(C)n2)cc1	794075674	OZIGBFLUMSDFDB-LJQANCHMSA-N	444.513	1.597	50	20	IDGD	
CC(=NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)c1ccnc(F)c1	794860619	UZUSPZXPFSHKEC-UHFFFAOYSA-N	434.493	1.715	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc([N+](=O)[O-])cc(Cl)c1F)[C@@H]1COc2ccccc2O1	795280161	DEBACDLHOJEOFS-LBPRGKRZSA-N	431.785	1.537	50	20	IDGD	
COC(=O)Cn1ncc(NC(=O)C(=O)NNc2ccc(OCC(F)(F)F)cc2)c1C	797072924	QAEXLSYNGCBHHN-UHFFFAOYSA-N	429.355	1.387	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)NCc3ccccc3)cc2)n1	797370327	KMFFIVCXDLJBPG-UHFFFAOYSA-N	431.452	1.720	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)C(=O)Nc1ccc(Cl)c(CN2CCOCC2)c1	797535735	PWXFQVHKPRJNHV-UHFFFAOYSA-N	431.880	1.275	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)Nc1cc(S(=O)(=O)N2CCCC2)ccn1	797675374	QLDQAQROHOACCP-UHFFFAOYSA-N	442.501	1.674	50	20	IDGD	
Cc1ccc([C@@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)cc1	797711357	JQLLDYZCDDFOMK-LSDHHAIUSA-N	440.522	1.078	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)N[C@@H]2CC(=O)N(Cc3ccccc3)[C@H]2C)cc1C	798529945	AFRNFWIQVNYDRW-QFBILLFUSA-N	437.500	1.762	50	20	IDGD	
CCOc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NNC(=O)Cc1nc2ccccc2n1C	799260176	KUEMCCPWPFUQCP-UHFFFAOYSA-N	440.416	1.209	50	20	IDGD	
CSC[C@@H](C)C(=O)N1CCC(C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)CC1	799407537	VJYDOZHOSDSTTC-ZIAGYGMSSA-N	425.526	1.978	50	20	IDGD	
Cn1cc(-n2cc(C(=O)NNC(=O)Nc3ccc(Br)cc3)ccc2=O)cn1	801998296	NRYIXXQPNWPTQK-UHFFFAOYSA-N	431.250	1.800	50	20	IDGD	
CC1(C)C(=O)N(C[C@@](C)(O)C(=O)NNC(=O)Nc2ccc3c(c2)OCO3)c2ccccc21	802099427	RBTCGLGIIKPYMW-JOCHJYFZSA-N	440.456	1.643	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)CSc1nncn1-c1cccc(Cl)c1	808045144	DEIHTOHSVRPLEJ-UHFFFAOYSA-N	427.914	1.949	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)nn1-c1ccc(F)cc1F	808934532	JREKTERIIPWSFD-UHFFFAOYSA-N	443.366	1.587	50	20	IDGD	
CC/C=C(\C)C(=O)NNC(=O)C[C@H]1c2cc(OC)c(OC)cc2CCN1S(C)(=O)=O	809999534	OFVRMGAZJFPQEN-UDYBNVKDSA-N	439.534	1.456	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CNS(=O)(=O)c2ccccc2C(F)(F)F)c1	810347012	NTOLZCFKLKFLPI-UHFFFAOYSA-N	426.376	1.317	50	20	IDGD	
O=C(NNC(=O)c1ccc(COc2ccccc2)o1)C(=O)N1CCN(c2ccccc2)CC1	812452008	PBOBIJMPOUYTMO-UHFFFAOYSA-N	448.479	1.968	50	20	IDGD	
Cc1nc(C(F)(F)F)ccc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	813033009	ADJNDCQMYQLSCV-UHFFFAOYSA-N	445.423	1.741	50	20	IDGD	
COC(=O)c1cc(NNC(=O)c2ccc(S(=O)(=O)NC[C@H]3CCCO3)cc2)ccc1C	816687766	NSSMGPJJFXDJAG-QGZVFWFLSA-N	447.513	1.996	50	20	IDGD	
CC(C)[C@H](NC(=O)COc1ccccc1)C(=O)NNc1ccccc1S(=O)(=O)N(C)C	817053200	HRORAZIXESMHDK-FQEVSTJZSA-N	448.545	1.600	50	20	IDGD	
Cc1nnc(NNC(=O)c2cc(S(=O)(=O)NCC(C)C)c(Cl)cc2Cl)nc1O	817283999	HBYKAEMTIIOUKV-UHFFFAOYSA-N	449.320	1.884	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc2c(c1)nc(CCC(=O)NNC(=O)CC1CC1)n2CC	819125913	FOQZHSKRIOGQIT-UHFFFAOYSA-N	449.577	1.967	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CCc2nc3ccccc3oc2=O)cc(OC)c1OC	859254779	CVNGKZQCESLDAA-UHFFFAOYSA-N	427.413	1.608	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)c1cc(S(=O)(=O)N(C)C)ccc1Cl	863998205	LDZJSQLCJIDLDJ-UHFFFAOYSA-N	441.893	1.439	50	20	IDGD	
O=C(NNc1ncccn1)[C@H]1CCCN(S(=O)(=O)c2ccc(Br)cc2)C1	913043935	NDEYUMGGXMSLNT-LBPRGKRZSA-N	440.323	1.783	50	20	IDGD	
CSC[C@H](C(=O)NNC(=O)Cc1ccc(Cl)cc1)N1C(=O)[C@H]2CCCC[C@@H]2C1=O	913160100	NWEAXKGTTJAQPP-HRCADAONSA-N	437.949	1.937	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@@H]2CCCN(C(=O)N3CCCC3)C2)c2ccccc2c1=O	915108102	MFUGOWSLEZQMPX-OAHLLOKOSA-N	440.504	1.105	50	20	IDGD	
Cc1nc2c(c(C)nn2C)c(C)c1CC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	915857472	GYYNKBVUZXFQKF-UHFFFAOYSA-N	429.502	1.301	50	20	IDGD	
COc1ccc([C@H](CNC(=O)NNC(=O)C(=O)NC2CC2)c2c[nH]c3ccccc23)cc1	915890700	CYXSVSNRGWYAKC-SFHVURJKSA-N	435.484	1.917	50	20	IDGD	
O=C(NCc1ccc(N2CCCCC2)nc1)NNC(=O)c1csc(N2CCOCC2)n1	916392124	GPDYLZSHCKGOTH-UHFFFAOYSA-N	445.549	1.509	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2cccc(CN3CCCC3)c2)c1	916401652	IMSSZKYUEZKSKH-UHFFFAOYSA-N	430.530	1.830	50	20	IDGD	
CCOc1ccc(/C=C(/C#N)C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1	916599752	ZZEQIVNQKVFMQZ-YBEGLDIGSA-N	438.396	1.905	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCCS(=O)(=O)c2ccccc2)ccc1OC(C)C	918229816	SUSIQMUNGUBFII-UHFFFAOYSA-N	435.502	1.900	50	20	IDGD	
CCS(=O)(=O)N1CCC[C@H](C(=O)NNC(=O)[C@H](C)Oc2ccc3ccccc3c2)C1	918549431	SDFNDORGUZLHGE-YJBOKZPZSA-N	433.530	1.816	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)Nc2cc(-n3cnnn3)ccc2C)nc1	919896945	QGMNQRGIEBKJTL-UHFFFAOYSA-N	445.509	1.545	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)c1NC(=O)c1ccccc1F	920432810	DTAMCJQCEFIXHO-ZDUSSCGKSA-N	433.461	1.582	50	20	IDGD	
COCCCNC(=O)NN=C(C)c1ccc(S(=O)(=O)N2CCCC[C@@H]2C(=O)O)cc1	920830402	VTQNAIZBESJQLV-QGZVFWFLSA-N	440.522	1.374	50	20	IDGD	
CC(C)C[C@H](C(=O)NNC(=O)NCCc1cccs1)N1C(=O)[C@@H]2CC=CC[C@H]2C1=O	920860591	PSBJLCXOQCRUGF-BRWVUGGUSA-N	432.546	1.987	50	20	IDGD	
C[C@@H](OC[C@H]1CCCCO1)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	921146449	ZRVYWOCMGXURFZ-NVXWUHKLSA-N	439.534	1.206	50	20	IDGD	
CC(=O)NCC(=O)NCC(=O)NNC(=O)c1cc(-c2ccc(C)cc2)nc2ccccc12	921165599	PWPKKZXEIBZULO-UHFFFAOYSA-N	433.468	1.224	50	20	IDGD	
CC(C)[C@H](C(=O)NNC(=O)c1nnc(O)c2ccccc12)N1C(=O)c2ccccc2C1=O	934946867	COACEJSWGGRYLA-QGZVFWFLSA-N	433.424	1.417	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cc(S(=O)(=O)N3CCC[C@H](C)C3)cn2C)cc1	1116004749	SADUZXQQKSKWEL-AWEZNQCLSA-N	434.518	1.529	50	20	IDGD	
COCCOc1ccc(-n2nc(C)c(C(=O)NNC(=O)c3ccc(OC)cc3)n2)cc1	1116077127	NIBMWVAXFPGBHL-UHFFFAOYSA-N	425.445	1.684	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(CCCNC(=O)NNc2nncc(N)c2Cl)CC1	1319200752	HSFSXTOQPAIQIF-UHFFFAOYSA-N	428.925	1.281	50	20	IDGD	
COC(=O)c1sccc1S(=O)(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1	1328626235	LPHMPLKVKPZPFS-UHFFFAOYSA-N	447.535	1.491	50	20	IDGD	
Cc1ncc(Br)c(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)n1	1338999525	VESUWDMEDIAHAP-UHFFFAOYSA-N	447.337	1.521	50	20	IDGD	
COC[C@]1(C(=O)NNC(=O)c2cncn2-c2ccccc2)CCN(C(=O)OC(C)(C)C)C1	1347466129	DZSCQSOLCSVFII-QFIPXVFZSA-N	443.504	1.907	50	20	IDGD	
Cc1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](O)CCl)C3)ncc1[N+](=O)[O-]	1778246260	HLXKTZLAOMOYHX-GPMSIDNRSA-N	440.884	1.025	50	20	IDGD	
COc1ccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](F)Br)C3)nc1	1778386409	JAOJWEJMRSHTME-IIDMSEBBSA-N	444.301	1.908	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Cl)C2)c1cccn(C(F)F)c1=O	1779584002	WKXFMZKJFXVIJC-FHSNZYRGSA-N	435.830	1.905	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(Cl)cc4nn[nH]c34)C2)C1	1780224489	NDGLDKRYGKVKDR-UGSOOPFHSA-N	442.303	1.309	50	20	IDGD	
COc1cc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)ccc1O	1780751410	YGVCSCUJHBZPBV-PBHICJAKSA-N	431.258	1.535	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)Cc3ccc([N+](=O)[O-])c(OC)c3)CCO2)C1	1781218450	PDQBWFJXQYHYKY-FOIQADDNSA-N	439.896	1.993	50	20	IDGD	
Nc1ccccc1/C=C/C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781331034	JMOBSDNGIVWEPL-BHMLKFMNSA-N	426.286	1.802	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(C)(C)NC(C)=O)C2	1781897707	OKBBDNBOPAEBOT-QMTMVMCOSA-N	446.386	1.589	50	20	IDGD	
C[C@@H](Cn1cccn1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)Br)C1	1781996941	ZNMSGFCPTAMHPM-WFXMFSGNSA-N	441.370	1.817	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](CN)c1ccccc1)C2	1782170777	XJPRIZHAGDMUDA-PSHVLCQKSA-N	437.968	1.497	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](OC(C)=O)C(C)C)C2	1782175036	AVRANBHUBNHZPY-PFRQMTDMSA-N	432.945	1.342	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnn3cc(C)cnc13)C2	1782175342	HQYAXVWCIBUIFA-CSODHUTKSA-N	449.939	1.419	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H]1CCCN1C(C)C)C2	1782179179	UYTQCIUYTXODRE-LXGFNABISA-N	429.989	1.627	50	20	IDGD	
O=C(c1onc2ccccc12)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1782348754	BNCJQRYZHPEFRJ-PBHICJAKSA-N	426.242	1.962	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(CCN(C(=O)c3cn4c(F)cccc4n3)C2)C1	1782370377	WHFCHYVOYJGFHM-HXUWFJFHSA-N	434.544	1.768	50	20	IDGD	
C[C@@H](C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCBr)C2)n1cncn1	1782529412	DXRMNTXFWGBLDM-JJRVBVJISA-N	428.331	1.138	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cccc(OC)n3)CCO2)C1	1783344812	UIEZVCFLPWIDJL-SCLBCKFNSA-N	426.311	1.707	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(-c4ccccn4)[nH]n3)CCO2)C1	1783877799	PYFOMHPWGDTFPG-VLIAUNLRSA-N	433.896	1.169	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H]3CCOC3)C2)C1	1784721446	TWHDXACTSPJVES-CUDMSMGSSA-N	431.439	1.738	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(C)(C)F)C[C@@H]21	1785076518	OVOCARULWXCQKK-AJNGGQMLSA-N	449.951	1.846	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(C(=O)N(C)C)c3)C[C@@H]21	1789864130	KMNVKIHZKLTGMM-OKYOBFRVSA-N	435.952	1.999	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@](C)(O)C(F)(F)F)C[C@@H]21	1789868309	BAFROPZMLUAQHU-YMYJPDDMSA-N	435.270	1.516	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cn(C)nc3C(F)F)C[C@@H]21	1791057155	FKCJIALWPGPAJX-ZPFDUUQYSA-N	449.296	1.734	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(F)c(F)cc3F)C[C@@H]21	1791256505	AEOADRISIRUZMU-PYERRIOISA-N	434.842	1.951	50	20	IDGD	
CC(C)N1CCC[C@H]1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CO[Si](C)(C)C)C[C@@H]21	1791809754	DRMWHFREOBJDIG-VJANTYMQSA-N	425.646	1.690	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(-c4ncc[nH]4)cc3)[C@H]2C1	1792036371	SAMDSZRZSLIEHC-OKYOBFRVSA-N	446.935	1.924	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1CCC(F)(F)CC1	1793344925	DIHRFHKBADYCPF-QDMKHBRRSA-N	435.475	1.762	50	20	IDGD	
COc1cccc(-c2cc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@@H](O)CCl)C4)c[nH]2)c1	1794301528	AYWIDLJOFKLTEF-JSJNYSNDSA-N	447.919	1.493	50	20	IDGD	
COc1ncc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@](C)(Cl)CCl)C3)cc1C	1794985648	QVLBSTPGPICTOJ-YGTYGHESSA-N	430.332	1.838	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CC(=O)N(Cc3ccccc3)C1)C2	1799263256	IAZPSYUNGRARCM-XLIFZOOWSA-N	447.963	1.642	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1CC[C@H]2CCC(=O)N2C1	1799933301	QBIYQPXXDRJAGB-SBOZNWLOSA-N	426.355	1.809	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cn(C(C)(C)C)nn1)C2	1800642494	LMOUPHZZDIUWHV-QVHKTLOISA-N	442.358	1.410	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CC=CC[C@H]1C(=O)OC	1800951390	CWKWLKAYGBNMOJ-NWCWSAAOSA-N	426.941	1.739	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@](C)(Cl)CCl)C2	1800959110	DMRJOELGLSOABG-MXSVDAKMSA-N	447.359	1.568	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc3occc3c1O)C2	1802338648	VPIPMPYDSLSFJG-QDMKHBRRSA-N	428.489	1.763	50	20	IDGD	
C[C@@H]1CCc2c(C(=O)N3CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]3c3cccnc3)n[nH]c21	1803138432	ARHLHPGZNDSCPL-QNDNMDDASA-N	431.924	1.774	50	20	IDGD	
Cc1cc(C(N)=O)cc(C)c1C(=O)N1CCC2(CCCN(C(=O)[C@@H](O)CCl)C2)CC1	1805523655	YBMKPHFHFVAUES-KRWDZBQOSA-N	435.952	1.847	50	20	IDGD	
O=C(CCc1cccs1)N1CCCC2(CCN(C(=O)c3cccc(B(O)O)c3)CC2)C1	1807229431	QEUYYSCGHVSPSL-UHFFFAOYSA-N	440.374	1.906	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1807367063	PTYUMZMFKSJZMQ-WDSOQIARSA-N	429.713	1.098	50	20	IDGD	
C=CCC(F)(F)C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1807367163	QYMJJHFEASIANM-IEBWSBKVSA-N	443.259	1.292	50	20	IDGD	
Cc1cccc(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)c1	1807375420	OPEVEFDSGWHXCY-GGAORHGYSA-N	443.312	1.703	50	20	IDGD	
COC(=O)c1ccc(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)cn1	1808589328	NQVWVJILCACXJX-JCGIZDLHSA-N	446.891	1.183	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)c3nccc4occc34)CC2)C1	1809966545	BMGDJYXLVDKMFJ-UHFFFAOYSA-N	447.300	1.666	50	20	IDGD	
O=C(Cc1ccc(F)cc1)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1	1809976872	UMFYBHPILYDFTC-UHFFFAOYSA-N	438.308	1.593	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1ccccc1F	1811673404	NGQBHNPMJDZQOS-PGRDOPGGSA-N	447.275	1.534	50	20	IDGD	
Cc1ccc(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)cc1	1811959119	IHQBRDDNXJVKRH-JTHBVZDNSA-N	443.312	1.703	50	20	IDGD	
CC(C)[C@H](S)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1	1817470226	MYWMFPDAPLODTH-AEFFLSMTSA-N	430.339	1.350	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)C23CC(F)(C2)C3)[nH]n1)c1ccc(B(O)O)cc1	1817470494	SJLGCHHCBWCHFI-YMTQGWHGSA-N	426.257	1.288	50	20	IDGD	
C#CCCCCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819404128	AKANLJHVAODUAU-GOSISDBHSA-N	437.504	1.908	50	20	IDGD	
C[Si](C)(C)OCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)COc2ccc(O)nn2)[nH]n1	1819596322	GSKVLXHSSXGLPL-AWEZNQCLSA-N	448.556	1.828	50	20	IDGD	
CC(C)(C)c1cc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@@H](O)CCl)CC3)[nH]n1	1820554770	ZILKOAOKXSUDQT-CABZTGNLSA-N	425.942	1.989	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc3n(n2)CCCO3)[nH]n1	1822369808	IUJIULVSWLWHQL-IUODEOHRSA-N	436.900	1.948	50	20	IDGD	
CC(C)[C@@H](S)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1	1824536948	BBQWSSOJCYDTQO-WOJBJXKFSA-N	432.395	1.554	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)[C@H]3C[C@]3(F)Cl)sc2C1	1826274272	QARBMPSSMUQQLW-VHCOLVSPSA-N	431.921	1.353	50	20	IDGD	
Cc1c(F)cccc1C(=O)N1CCO[C@]2(COCCN(C(=O)CCBr)C2)C1	1830155715	BRSJRQZQHRPJLF-IBGZPJMESA-N	443.313	1.989	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(O)ccc3O)C2)C1	1830366580	SOPHUISOQLWTHE-HXUWFJFHSA-N	426.897	1.433	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccccc3)C2)C1	1830543136	KLQUHZZPQAISFL-DNVCBOLYSA-N	425.323	1.788	50	20	IDGD	
CN1CCCC[C@H]1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1	1830773031	OTYCXUOYVHFNDX-ZYSHUDEJSA-N	436.380	1.163	50	20	IDGD	
COc1ccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)nn1	1831873431	KMHAZJRKMPMMJP-GOSISDBHSA-N	446.552	1.092	50	20	IDGD	
Cc1ccc(CC(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)o1	1832331706	UMVKJZZSVFQKFR-QFIPXVFZSA-N	438.333	1.744	50	20	IDGD	
Cc1noc(C)c1CC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1	1832559238	KQOZDLREUIBZPY-OALUTQOASA-N	448.347	1.527	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)COc3cccnc3)CCO2)C1	1832672060	NJIWRZXLSODEPA-FXAWDEMLSA-N	425.913	1.324	50	20	IDGD	
CC(C)(CCl)C(=O)NC1CCN(C2CCN(C(=O)CSc3nc[nH]n3)CC2)CC1	1833216022	MXSQFNDFCTXQHQ-UHFFFAOYSA-N	443.017	1.733	50	20	IDGD	
Cc1n[nH]cc1C(=O)N1CCC(N2CCC(NC(=O)[C@H](C)CBr)CC2)CC1	1833263746	ZKLQUXHJQPHIOW-CYBMUJFWSA-N	440.386	1.934	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)CCN3CCCCC3)CC2)CC1)[C@H](O)CCl	1833309019	JIMSZCVOQFJMQY-LJQANCHMSA-N	429.005	1.034	50	20	IDGD	
CCC(=O)N[C@H](C)C(=O)NC1CCN(C2CCN(C(=O)[C@](C)(Cl)CCl)CC2)CC1	1833422379	XVPCRPTXRMOLRR-JLTOFOAXSA-N	449.423	1.709	50	20	IDGD	
O=C(CCC(=O)N1CCCC1)NC1CCN(C2CCN(C(=O)[C@H](F)Cl)CC2)CC1	1833698121	GAXDNPTWWHTWNJ-IBGZPJMESA-N	430.952	1.495	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(CN(C(=O)CC(C)(C)C)CCO2)C1	1834781316	HEAVVBVHZNKDFJ-ZHNJOBQTSA-N	447.536	1.013	50	20	IDGD	
O=Cc1ccc(C(=O)N2CCOC[C@]3(CN(C(=O)CCBr)CCO3)C2)s1	1834822381	KKNDBSIJSHNTKL-KRWDZBQOSA-N	445.335	1.416	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)Nc1cccnc1)CCO2	1835684053	CDTMDMDXPDTGPJ-DJPFJPOOSA-N	438.956	1.746	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)C(C)(C)CNC(C)=O)CC2)CC1	1836395221	YUJLRNYABCLTQV-GOSISDBHSA-N	429.005	1.738	50	20	IDGD	
O=C(c1cccc(C(F)(F)F)n1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1837931969	AQUKGTSANNKFBB-CZUORRHYSA-N	439.793	1.705	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccnc(C)c3)CCO2)C1	1837941482	LHTMDONIMDGAMM-APWZRJJASA-N	440.338	1.634	50	20	IDGD	
COCCn1nccc1C(=O)N1CCC(OC2CCN(C(=O)[C@@H](F)Cl)CC2)CC1	1838083643	ZBWPNZGXTHBVCC-QGZVFWFLSA-N	430.908	1.676	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(Cl)nc(OC)c3)CCO2)C1	1838233017	ZQRKHRVSHHJPOR-AUUYWEPGSA-N	446.331	1.831	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3ccc(C)nc3O)CC2)CC1	1838543017	DZACGPFAOKJIRE-SFHVURJKSA-N	439.940	1.962	50	20	IDGD	
Cc1cccc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)n1	1839150790	XQPPGTBALXOPBX-VQTJNVASSA-N	444.359	1.625	50	20	IDGD	
Cc1cccc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)c1	1839199627	RCTPGQLOEPTZJJ-MJGOQNOKSA-N	443.313	1.684	50	20	IDGD	
CC(C)c1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)n[nH]1	1839199955	ASYVQVLPBDCZLY-RHSMWYFYSA-N	447.305	1.294	50	20	IDGD	
C[C@]1(C(=O)N2CCOC[C@]3(CN(C(=O)[C@H](F)Br)CCO3)C2)CC1(F)F	1839203487	MNXRNVQWOFRXIS-GDLCADMTSA-N	429.233	1.179	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(O)ccc3F)CCO2)C1	1839296820	YJPXRHADTQVDQZ-KZULUSFZSA-N	445.285	1.385	50	20	IDGD	
Cc1ncc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)s1	1840032589	CPCUNAQLIUORMC-MEDUHNTESA-N	432.340	1.305	50	20	IDGD	
CC(C)c1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)on1	1840034328	HZSMLXBBCUUSKZ-FZKQIMNGSA-N	444.326	1.651	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(F)ccc3C)C2)C1	1840149347	MHSTXZRLCWVNBO-FXAWDEMLSA-N	428.888	1.458	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3c(C)cccc3F)C2)C1	1840155516	ACOSRAHNPCXHEI-FOIQADDNSA-N	428.888	1.458	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(F)c(OC)c3)C2)C1	1840155771	DFRCOQLIPIQETP-MGPUTAFESA-N	444.887	1.158	50	20	IDGD	
O=C(c1n[nH]c2c1CCCC2)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840187775	WIMSSJIJXKKJGV-GOSISDBHSA-N	431.320	1.162	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(F)ccc3OC)CCO2)C1	1840691069	SQUYHPVGYQYSFS-UZLBHIALSA-N	444.887	1.158	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CCCOC1)CCO2	1840878452	HRACCOGVWWGWQV-RVKKMQEKSA-N	433.343	1.043	50	20	IDGD	
O=C(c1cnc2ccc(Br)cn12)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1	1841351402	OWKZIHQLRZBVQJ-CYBMUJFWSA-N	441.713	1.514	50	20	IDGD	
C[C@@H](NC(=O)c1ccc(F)cc1)C(=O)N1CC2(CCCN2C(=O)CO[Si](C)(C)C)C1	1844378881	UCHTVUMALIBVJQ-OAHLLOKOSA-N	435.572	1.999	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2c(F)cncc2F)C1	1844538281	HGTKJSBPEPBCNP-BRJLIKDPSA-N	430.415	1.311	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)c2ccncc2-c2ccccc2)C1	1844587587	XHHBNJMLNLWOPS-UHFFFAOYSA-N	441.296	1.559	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2cc(-c3ccccc3)[nH]n2)C1	1844777538	QINGQOBJWWKBOH-UHFFFAOYSA-N	445.483	1.206	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)C1(O)CCN(C(=O)OC(C)(C)C)CC1)C2	1845163439	XKGPGOPJWBCMGJ-OAHLLOKOSA-N	443.972	1.969	50	20	IDGD	
Cc1cc(C)n2ccc(C(=O)N3CCCC34CN(C(=O)CCC(=O)NN(C)C)C4)c2n1	1845732294	NYSWYQZOPJIQAX-UHFFFAOYSA-N	426.521	1.141	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)c1ccc(Br)cn1)C2	1846385269	KQLBIFQEKDPAIC-UHFFFAOYSA-N	438.326	1.034	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@]2(O)CCN(C(=O)OC(C)(C)C)C2)C1	1846412027	JVKGFRPEMOKPOR-XOBRGWDASA-N	429.945	1.579	50	20	IDGD	
Cn1cc(CC(=O)N2CCCC23CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C3)cn1	1846635592	STSLCAGJBAGMPC-HNNXBMFYSA-N	439.944	1.298	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2ccc(-c3ncc[nH]3)cc2)C1	1846863005	KAOLYBWYYCQGDI-UHFFFAOYSA-N	445.483	1.206	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNS(=O)(=O)c2ccsc2C(=O)OC)cc1	15519964	HIUZGNFQACYBFJ-LLVKDONJSA-N	428.488	1.710	50	20	IDGD	
O=C(CCC(=O)N1CCC(c2ccccc2)=N1)NNC(=O)c1cc(Br)c[nH]1	24124276	BHIPTNUQVKREBS-UHFFFAOYSA-N	432.278	1.955	50	20	IDGD	
O=C(NNC(=O)c1sccc1S(=O)(=O)N1CCCC1)c1cc(Cl)ccc1O	105559008	JXBJOWPTOFRBEB-UHFFFAOYSA-N	429.907	1.966	50	20	IDGD	
O=C(CNC(=O)NCc1ccc(Cl)cc1)NNC(=S)NCCc1cccs1	727493226	JQZGPHYCOIDNRA-UHFFFAOYSA-N	425.967	1.939	50	20	IDGD	
CC(C)C[C@H](C)CC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	727661861	HQLWILTYHZEYOG-KRWDZBQOSA-N	439.578	1.860	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)CS(=O)(=O)NC2CCC(C)CC2)o1	728071552	TZNLMZJWXFDOAY-UHFFFAOYSA-N	428.555	1.381	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@H]2C(=O)NNC(=O)CNc2ccc(C)cc2)c(OC)c1	728204890	XHUSAWDNGMGTQA-IBGZPJMESA-N	440.500	1.876	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3cccc4cccnc34)cc2)CC1	728214031	VFVIQMFRDJQKQB-UHFFFAOYSA-N	425.514	1.928	50	20	IDGD	
O=C(NCCc1nc2ccccc2s1)NNC(=O)C1CCN(c2ncccn2)CC1	729051612	QBHQIKOFMYYCQW-UHFFFAOYSA-N	425.518	1.876	50	20	IDGD	
CC[C@H](NC(=O)NNC(=O)c1cccc2ncccc12)c1cccc(S(N)(=O)=O)c1	730126062	MCVHIYCJFUHYRJ-KRWDZBQOSA-N	427.486	1.978	50	20	IDGD	
Cc1cccc(N2C(=O)N[C@H](CCC(=O)OCC(=O)NNC(=O)c3ccccc3)C2=O)c1	730869222	OGBNHMPKCSACBX-QGZVFWFLSA-N	438.440	1.204	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CS[C@@H]2CCS(=O)(=O)C2)cc1Br	732173880	KUWHYTZILRMPLQ-SNVBAGLBSA-N	437.337	1.139	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)c2cc(O)nc3ccc([N+](=O)[O-])cc23)c2ccccc2c1=O	732257015	BFBKKMKGBLWDTO-UHFFFAOYSA-N	434.368	1.170	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)[C@@H]1CC(=O)N(c2ccc3c(c2)OCCO3)C1	732304898	YTJVBCYUYODZMM-CYBMUJFWSA-N	431.470	1.358	50	20	IDGD	
CCN1CCCC[C@@H]1CNC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	732471162	KRYLDBTWNBGBRI-QGZVFWFLSA-N	437.566	1.290	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)CC[C@@H]2NC(=O)N(c3ccc(C#N)cc3)C2=O)cc1	733758478	BKFMRNOXDOIPOB-IBGZPJMESA-N	449.467	1.552	50	20	IDGD	
Cc1cc(OC(F)F)c(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)s1	734058808	YUOIKYWESDJXMY-CYBMUJFWSA-N	442.396	1.802	50	20	IDGD	
Cc1c(C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)oc2ccccc12	735116728	DBEAGPVXTVQUCS-UHFFFAOYSA-N	429.502	1.829	50	20	IDGD	
CCc1ccc(CCC(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)cc1	735117302	PTYVPTYAGIMCFY-UHFFFAOYSA-N	431.562	1.656	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)[C@H]2C[C@@H]2c2ccc(F)cc2)CC1	735117333	RFCPBHWZWOVPLZ-SJORKVTESA-N	433.509	1.404	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)CCc2nc(-c3cc(Br)cs3)no2)cn1	735443890	IMWQSYKLZIDYIB-UHFFFAOYSA-N	425.268	1.688	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)CCCS(=O)(=O)N2CCCC2)cc1C	736795330	NEYQJUOYDLGIBZ-UHFFFAOYSA-N	445.563	1.129	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)NNC(=O)COCc2ccccc2)cc1OC	738442547	NMLHXJMKWZWSRY-UHFFFAOYSA-N	436.490	1.826	50	20	IDGD	
CC(C)(C)CCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	740485339	DSMYXEXHDANCGH-UHFFFAOYSA-N	426.539	1.478	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H]2CCCCN2Cc2ccccc2)c1	741144439	SBYMICHRVWRBFU-HXUWFJFHSA-N	444.557	1.753	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)CCN3C(=O)[C@H]4[C@H](C3=O)[C@H]3CC[C@H]4O3)cc2C1	742480454	PLQHYAMOCCEVRY-JCLHXSMMSA-N	431.514	1.186	50	20	IDGD	
CNS(=O)(=O)c1ccc(Sc2ccccc2C(=O)NNC(=O)c2cnn(C)c2)cc1	742687250	JFCRYNSWMCXLLX-UHFFFAOYSA-N	445.526	1.554	50	20	IDGD	
O=C(NNC(=O)c1cccc2ncccc12)N[C@@H]1CC(=O)N(CCOc2ccccc2)C1	743638670	SXQROAPWXGGDEQ-MRXNPFEDSA-N	433.468	1.859	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NCc2nc(Cc3ccccc3)no2)cc1	745781301	MFISFHYVBXPWDJ-UHFFFAOYSA-N	444.473	1.600	50	20	IDGD	
C[C@H]1Cc2ccccc2N1S(=O)(=O)c1cccc(C(=O)NNC(=O)N2CCOCC2)c1	745992489	BPLAHONRCGMVMU-HNNXBMFYSA-N	444.513	1.513	50	20	IDGD	
Cc1noc(C)c1S(=O)(=O)NC1(C(=O)NNC(=O)c2cccc(C#N)c2)CCCC1	746217890	DRXIQWOKWKAPML-UHFFFAOYSA-N	431.474	1.215	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)c1cn(-c2ccc(C(F)(F)F)cn2)nn1	746545895	YYVSUFJHENWYFH-UHFFFAOYSA-N	430.350	1.333	50	20	IDGD	
O=C(NCCNS(=O)(=O)c1cccc([N+](=O)[O-])c1)NNc1ccc(Cl)c(F)c1	746757683	QISPPQIPDZHBKP-UHFFFAOYSA-N	431.833	1.992	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)NCCNS(=O)(=O)c1cccs1	747437618	MCTNZYKVSHVBDA-UHFFFAOYSA-N	432.911	1.333	50	20	IDGD	
O=C(CCCNS(=O)(=O)c1ccc2c(c1)OCCO2)NNc1c(F)cccc1F	748175786	ONZDIROLKMWBFW-UHFFFAOYSA-N	427.429	1.938	50	20	IDGD	
C[C@@H](C(=O)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1)S(=O)(=O)C1CCOCC1	748521411	QLNHOTCSZKJOHJ-JTQLQIEISA-N	444.453	1.406	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)c2cc(S(=O)(=O)NC)oc2C)cc1	751297975	NWMTUWFQDAUOIA-LBPRGKRZSA-N	425.463	1.123	50	20	IDGD	
COCCCNC(=O)NNC(=O)c1sccc1S(=O)(=O)NC1CCCCCC1	751373175	ZMWUQFQNOYUGQB-UHFFFAOYSA-N	432.568	1.730	50	20	IDGD	
CC(C)CC(C)(C)CNC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	753041735	WSCFFRWDYSLVMC-UHFFFAOYSA-N	426.587	1.716	50	20	IDGD	
Cc1c(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c(=O)oc2ccccc12	754613109	GVQGUVKVFOWWTR-QGZVFWFLSA-N	438.392	1.246	50	20	IDGD	
CCOC(=O)c1sc([C@@H](C)NCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)nc1C	755055352	VNGVJGCNRDTBFB-LLVKDONJSA-N	435.462	1.648	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)Nc1cccc(S(=O)(=O)N(C)C)c1	755365927	FZBWBIZIMOZLEY-UHFFFAOYSA-N	436.490	1.567	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)n([C@H]2CCS(=O)(=O)C2)n1	755530186	FUKZFISQUSBSGV-JSGCOSHPSA-N	439.469	1.310	50	20	IDGD	
CN(C)c1ccc(S(=O)(=O)N(C)C)cc1NC(=O)NNC(=O)c1c[nH]c2ccccc12	755535878	ZQYUFDUFSWWSBT-UHFFFAOYSA-N	444.517	1.951	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@@H]2C)ccc1NC(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1	756246235	TWBJTCBGEXPSJK-GOEBONIOSA-N	436.534	1.597	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)Nc1cccnc1-n1cncn1	756292126	RFLZHFZTVZIJHC-UHFFFAOYSA-N	435.492	1.027	50	20	IDGD	
CNC(=O)COc1ccc(NC(=O)NNC(=O)[C@@H](C)Oc2ccc(C(C)=O)cc2)cc1	756441115	IJJGRAXMYZBLKX-CQSZACIVSA-N	428.445	1.634	50	20	IDGD	
O=C1C[C@H](Cc2ccc(NC(=O)NNC(=O)c3cc(Br)c[nH]3)cc2)C(=O)N1	756817631	XZUMKXPYNMAFES-JTQLQIEISA-N	434.250	1.449	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)Nc1cccn(CC(F)(F)F)c1=O	757655257	CVXNWFNLSIGTMM-UHFFFAOYSA-N	435.403	1.868	50	20	IDGD	
COc1cc(F)c(NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1F	757674852	XIZAQKPHDISKSH-UHFFFAOYSA-N	442.444	1.755	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccc(OC)nc2C)c1	757684006	VIOXRJBSHLMRTF-UHFFFAOYSA-N	435.506	1.896	50	20	IDGD	
COCCCS(=O)(=O)c1ccc(NC(=O)NNC(=O)COc2ccccc2C#N)cc1	757822335	IHSMDTRRNDKDDH-UHFFFAOYSA-N	446.485	1.600	50	20	IDGD	
COc1ccc2c(-c3ccccc3)c(C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)oc2c1	758036377	RGRQTJDOVNSIBT-GFCCVEGCSA-N	431.470	1.807	50	20	IDGD	
CCc1nnc(O)c(C(=O)NNC(=O)c2ccc(CSc3nncn3C)cc2)c1CC	758152492	WSXJYWZUAJWOJP-UHFFFAOYSA-N	441.517	1.803	50	20	IDGD	
N#CCCn1ncc(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1-c1ccccc1	758286287	OCJRPFWQEBQBBU-UHFFFAOYSA-N	444.499	1.931	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccccn2)c(I)c1	760750873	IOKNAWKJHQUHAF-UHFFFAOYSA-N	440.197	1.095	50	20	IDGD	
Cc1ccc(Cn2cccc(NC(=O)C(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)c2=O)cc1	763468675	QZBZDBKYEYRNJA-UHFFFAOYSA-N	449.423	1.513	50	20	IDGD	
O=C(NNC(=O)c1ccccc1F)C(=O)Nc1ccccc1S(=O)(=O)N1CCCCC1	763555513	HEYUGHKGHCOPRC-UHFFFAOYSA-N	448.476	1.400	50	20	IDGD	
COC(=O)c1cc(Br)ccc1NC(=O)C(=O)NNC(=O)c1cc(C)oc1C	763586637	PEVQCTABPSOBAM-UHFFFAOYSA-N	438.234	1.845	50	20	IDGD	
Cc1ccc(C(=O)NC2CC2)cc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccccc2)[nH]n1	763605424	SLDBBEHJTOJMNY-UHFFFAOYSA-N	446.467	1.677	50	20	IDGD	
CCOc1cc2c(cc1NC(=O)C(=O)NNC(=O)COc1cccc(C)c1)O[C@@H](C)C2	763619355	UMRXXZRNLGYNQP-AWEZNQCLSA-N	427.457	1.882	50	20	IDGD	
COC(=O)c1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)c1c(C)nc2ccccn12	763628270	IEOCWLMVENFNGD-UHFFFAOYSA-N	429.820	1.482	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2cccc(C(F)(F)F)c2)nn1CCC#N	763639016	IOPMBNZGVMINNO-UHFFFAOYSA-N	438.366	1.289	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cnc(-c2ccccc2)nc1	763684192	GQEXFVPVXLPVGT-UHFFFAOYSA-N	435.440	1.707	50	20	IDGD	
O=C(CSc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1ccn(-c2ccncc2)n1	763737135	OPDJUHAJEMUWFP-UHFFFAOYSA-N	430.877	1.799	50	20	IDGD	
O=C(NNC(=O)c1cc2c(s1)CCC2)C(=O)Nc1ccc(=O)n(Cc2ccccc2)c1	763784756	HPCYLSOYTCMNJH-UHFFFAOYSA-N	436.493	1.847	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2ccn(-c3ccccc3)n2)c2ccccc2c1=O	763785140	GRAVQJUZRJURTL-UHFFFAOYSA-N	445.439	1.002	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)C(=O)Nc1cccnc1N1CCCCC1	763804964	PQGFIECMRYWNSJ-UHFFFAOYSA-N	442.432	1.145	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(F)cc2OCC#N)cc1	763861903	TUJRUBSEHDTWLL-CYBMUJFWSA-N	444.419	1.680	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1cnn(-c2ccccc2F)c1	763866667	QTRCTFSMDDPGAB-GFCCVEGCSA-N	429.383	1.704	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)n(-c2ccccc2)n1	763870575	ARGDZMQJRVHERC-CQSZACIVSA-N	425.420	1.873	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cn(-c3ccccc3)nc2C)cc1OC	763911464	FDASAHWFDYFAEL-UHFFFAOYSA-N	437.456	1.988	50	20	IDGD	
CC[C@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(S(=O)(=O)NC2=NCCCCC2)cc1	764081872	KGUMXXLCBIYLDU-ZDUSSCGKSA-N	437.522	1.069	50	20	IDGD	
COC(=O)c1[nH]c(C)cc1NC(=O)C(=O)NNC(=O)c1ccc(F)cc1Br	764084704	GRPAWWSKXFUSPS-UHFFFAOYSA-N	441.213	1.411	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(OCc3ccccn3)c(Cl)c2)n[nH]1	764098457	NYBOACNWVFLBKD-UHFFFAOYSA-N	428.836	1.745	50	20	IDGD	
CCS(=O)(=O)c1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)c1ccc(C#N)cc1	764176198	BMHLVVGYDDNFLU-UHFFFAOYSA-N	434.861	1.405	50	20	IDGD	
CN(C)c1c(Cl)cccc1NC(=O)C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C	764202493	DDCRWTWFAIJSEJ-UHFFFAOYSA-N	441.916	1.797	50	20	IDGD	
CC(C)[C@H]1CC[C@@H](C)C[C@H]1OC(=O)c1ccccc1NC(=O)C(=O)NNC(=O)CN(C)C	764204221	PDNVZOYZJCXNOJ-GPMSIDNRSA-N	446.548	1.952	50	20	IDGD	
Cc1ncsc1C(=O)NNC(=O)C(=O)Nc1ccccc1C(=O)N1C[C@@H](C)C[C@H](C)C1	764247594	UDYWREQPXHLTLT-STQMWFEESA-N	443.529	1.969	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)C(=O)Nc1cccnc1-c1ccccc1	764260859	SCSPYUKRILQOGT-UHFFFAOYSA-N	445.483	1.541	50	20	IDGD	
CCN1CCN(c2ccc(Cl)cc2NC(=O)C(=O)NNC(=O)c2ccc(C)o2)CC1	764371662	QNKTWXUTFXRRST-UHFFFAOYSA-N	433.896	1.783	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@H]2CCCC[C@H]2N2CCOCC2)c2ccccc2c1=O	764374515	KXLPTTGGNVTSCO-ZWKOTPCHSA-N	442.520	1.004	50	20	IDGD	
Cc1ccc(CN(C)C)cc1NC(=O)C(=O)NNC(=O)c1cc(-c2cccs2)[nH]n1	764382665	ORUJWVYNIMOZOQ-UHFFFAOYSA-N	426.502	1.908	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cccc(NC(C)=O)c3)n[nH]2)cc1	764384860	LJQVPFNHTDTITG-UHFFFAOYSA-N	434.456	1.997	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)cc1F	764401960	UUGVGEAPUQNOJF-UHFFFAOYSA-N	437.449	1.435	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)CCNC(=O)c3ccsc3)n[nH]2)cc1OC	765598633	LWZKLZWMOIDTNU-UHFFFAOYSA-N	443.485	1.737	50	20	IDGD	
NC(=O)COc1ccc(Cl)cc1S(=O)(=O)NNC(=O)C12CC3CC(CC(C3)C1)C2	766312350	RCAHUVYXSWCLDD-UHFFFAOYSA-N	441.937	1.730	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1cnc(-c2ccccc2)[nH]1	766642744	MLRATIHWDXFAAC-UHFFFAOYSA-N	432.484	1.296	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)ccc1OC(C)C	768232064	JRERYIYMCGQDEA-UHFFFAOYSA-N	426.429	1.519	50	20	IDGD	
CC(C)(C)OC(=O)C1CCC(NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)CC1	769714449	GNMNUNSVNYFGMC-UHFFFAOYSA-N	446.552	1.924	50	20	IDGD	
CSCCNC(=S)NNC(=O)c1ccc2c(c1)C(=O)N(CCc1ccccc1)C2=O	769768982	IMRSUHDGDFMJEN-UHFFFAOYSA-N	442.566	1.997	50	20	IDGD	
CCN(CC)[C@H](CNC(=O)NNc1nc(O)c2cnn(C)c2n1)c1cccc(OC)c1	770342359	RKCSRJIZEIHPNM-MRXNPFEDSA-N	428.497	1.787	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)NCCCNc3ccc(C(F)(F)F)cn3)nc21	770343669	CBAICRMLESLCMI-UHFFFAOYSA-N	425.375	1.611	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)N[C@H]1CCCN(CC(F)(F)F)C1=O	770659357	RDODQYSTUBTRBC-GWCFXTLKSA-N	436.818	1.991	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)Cn3cc(Br)ccc3=O)nc21	770966832	UCZFQTXAJGHEKF-UHFFFAOYSA-N	436.270	1.354	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)[C@H]3CCN(c4cc(Cl)ccc4Cl)C3=O)nc21	770972056	PLZNLPUJEJEUOA-SECBINFHSA-N	436.259	1.872	50	20	IDGD	
CC(C)(C)c1sc(C(=O)O)cc1S(=O)(=O)NNC(=O)[C@H]1COc2ccccc2O1	773249783	OXPITJOLBSILQP-GFCCVEGCSA-N	440.499	1.893	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)[C@H]2CC[C@H](C(F)(F)F)NC2=O)C1	773410877	FSZMAKNYRXPTNS-SDDRHHMPSA-N	436.431	1.238	50	20	IDGD	
COc1cc(C)c(NC(=O)C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1C	773546393	LYARYCNEPFBJJZ-UHFFFAOYSA-N	426.477	1.105	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2sc(N3CCCC3)nc2Cl)n1	775886894	MWWHWDFSVFSGGR-UHFFFAOYSA-N	443.938	1.709	50	20	IDGD	
COc1ccc(Cn2cc(C(=O)NNC(=O)[C@@H]3COc4ccccc4O3)cn2)cc1OC	777412798	UEXGUOMIOBYAKS-FQEVSTJZSA-N	438.440	1.550	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)[C@H]2CC(=O)N(c3ccc(OC)cc3OC)C2)nc1C	778420862	AVSUIACDHZKWGL-ZDUSSCGKSA-N	443.460	1.475	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3ccc(C#N)c(Cl)c3)cc2)CC1	779011562	KQRXCIZDVLVQHI-UHFFFAOYSA-N	433.921	1.905	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@@H](C(=O)NNC(=O)c2cccc3ccccc23)[C@H](C)O)cc1	779519955	NIGLIVMJHZELIH-MGPUTAFESA-N	441.509	1.637	50	20	IDGD	
COC(=O)c1ccccc1NNC(=O)[C@H]1CCCN1C(=O)/C=C/c1ccc(C(N)=O)cc1	780730837	DKAHQVXSHOEIIA-YFPIXMDGSA-N	436.468	1.720	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)c1ccc(-c2ccccc2OC(F)(F)F)o1	781919330	CEMHAYFSEOTAKZ-SECBINFHSA-N	435.380	1.544	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)N[C@H]1CCC[C@H](NC(=O)OC(C)(C)C)C1	782647243	CQRJVWDXLJDUKK-STQMWFEESA-N	429.518	1.677	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(CNC(=O)NNC(=O)c2cc(Br)c[nH]2)c1	782769894	RBFHQTCCOINCHE-UHFFFAOYSA-N	444.311	1.172	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccc(-n3cccn3)cc2)nc1	783264936	UGHXYDDDEPMDOT-UHFFFAOYSA-N	443.489	1.036	50	20	IDGD	
COc1ccc(S(=O)(=O)NC(C)(C)C)cc1NC(=O)C(=O)NN(C)c1ccccc1	783434120	DXNMXCJUEBLYSA-UHFFFAOYSA-N	434.518	1.878	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)N[C@@H]1COc2cc(F)cc(F)c21	784575114	NWTGMRFKZFVADE-LLVKDONJSA-N	425.417	1.336	50	20	IDGD	
C[C@@H](c1cccc(NC(=O)C(=O)NNc2cccc(S(C)(=O)=O)c2)c1)N1CCOCC1	784839653	NIKNYSQFXAOESG-HNNXBMFYSA-N	446.529	1.565	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)C(=O)Nc2ccccc2N2CCC(C(N)=O)CC2)c1	784853154	ZOEUVJZDBOSQGV-UHFFFAOYSA-N	439.472	1.257	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)cnc1Br	788491117	AQBRNSMPOJJNQH-UHFFFAOYSA-N	442.295	1.221	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)cnc1Br	789812285	JZFNGSXKHRJLCK-GJZGRUSLSA-N	447.289	1.811	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2OC)cc(-n2cccn2)c1	792352203	DUSHRTKJUOOYHN-UHFFFAOYSA-N	439.428	1.054	50	20	IDGD	
COc1ccc(Cn2cc(NC(=O)C(=O)NNC(=O)COCc3ccccc3)cn2)cc1	793027369	XKOKGKCJNQXENO-UHFFFAOYSA-N	437.456	1.243	50	20	IDGD	
N#Cc1cc(F)cc(C2(C(=O)NNC(=O)c3ccc(Cl)c(S(N)(=O)=O)c3)CC2)c1	794781519	RNCJDFQRXPDHQR-UHFFFAOYSA-N	436.852	1.491	50	20	IDGD	
CSCC[C@H](NC(=O)c1ccco1)C(=O)NNc1ccccc1S(=O)(=O)N(C)C	795168822	FEMINBPNTQGXSS-AWEZNQCLSA-N	440.547	1.525	50	20	IDGD	
CCOc1ccccc1N1C[C@@H](C(=O)NNc2ccccc2S(=O)(=O)N(C)C)CC1=O	795177007	IFOZPOHACPWZOQ-HNNXBMFYSA-N	446.529	1.832	50	20	IDGD	
CC(C)(C)OC(=O)N1CCOC[C@@H]1CC(=O)NNc1nc(O)c2cnn(C(C)(C)C)c2n1	796366342	JDHWOKAVRUAUOQ-LBPRGKRZSA-N	449.512	1.756	50	20	IDGD	
CN(C(=O)OC(C)(C)C)[C@@H](C(=O)NNc1nc2ccccc2c(=O)n1C)c1cnn(C)c1	796442347	SWYJONLJWRVWHV-MRXNPFEDSA-N	441.492	1.718	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)CCc1c(C)nc2c3cccnc3nn2c1C	796602438	ZESKJJUZQCFYJX-UHFFFAOYSA-N	425.493	1.279	50	20	IDGD	
Cc1noc(C)c1C(C)(C)C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	797746158	OPADGGHYZHETRA-UHFFFAOYSA-N	435.550	1.648	50	20	IDGD	
COC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)c1C	798041925	HZHNFOCURAIAQO-UHFFFAOYSA-N	428.401	1.344	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@H]2C(=O)NNC(=O)c2cc(Br)c[nH]2)cc1	798845499	MDDLONFEFAJJDK-HNNXBMFYSA-N	435.278	1.852	50	20	IDGD	
CCOc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NNC(=O)COc1ccc(C)c(C)c1	799257915	VXAYPTYDBUZYHY-UHFFFAOYSA-N	430.417	1.775	50	20	IDGD	
O=C(NCCS(=O)(=O)CCc1ccccc1)NNC(=O)c1ccc2c(c1)OCCO2	800062363	NXHSIWXKJHYTJA-UHFFFAOYSA-N	433.486	1.059	50	20	IDGD	
CCOc1cc(C#N)cc(Br)c1OCC(=O)NNC(=O)N=c1cc[nH]cc1	802027104	RJXABXMSTLPMRX-UHFFFAOYSA-N	434.250	1.768	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C(=O)Nc1ccc(F)c(N2C(=O)CCC2=O)c1)c1ccccc1	806979563	AAXXXBOWWAFUTB-HNNXBMFYSA-N	440.431	1.759	50	20	IDGD	
CC(C)n1ncc2c(C(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)cc(-c3ccco3)nc21	807298360	CFXJYCIVMPCWRM-GFCCVEGCSA-N	431.474	1.468	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2cccc(F)n2)cc1S(=O)(=O)N1CCCC1	807393081	VQVWKQZQIXLFQS-UHFFFAOYSA-N	437.453	1.096	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)cc2[nH]ccc12	808934593	MSWFDHQWJSSUAP-UHFFFAOYSA-N	449.467	1.493	50	20	IDGD	
NC(=O)c1ccc(NC(=O)NNC(=O)c2cc(Br)c[nH]2)c(OCC(F)F)c1	810306639	MPSOLMCVGWZPMC-UHFFFAOYSA-N	446.208	1.987	50	20	IDGD	
CC[C@H]1[C@@H](C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)CCN1C(=O)OC(C)(C)C	811300375	GBDHKAFRJSHGJL-IRXDYDNUSA-N	444.488	1.898	50	20	IDGD	
O=C(COC(=O)[C@H](O)c1ccc(Cl)cc1F)NNC(=O)[C@@H]1COc2ccccc2O1	811369519	JAKIKEMUCXHYHV-DOTOQJQBSA-N	438.795	1.043	50	20	IDGD	
COC[C@]1(CNC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])OCCc2ccccc21	812478632	ZIJUKPBTSLKKPJ-NRFANRHFSA-N	444.444	1.419	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)[C@H]2CC(c3ccccc3[N+](=O)[O-])=NO2)cc1	812726938	ACOGWAJVKPGJBW-QGZVFWFLSA-N	433.446	1.481	50	20	IDGD	
COc1ccc2cc(NC(=O)C(=O)NNc3ccc(S(=O)(=O)N(C)C)cc3)ccc2n1	813033049	BRKWOZMTVNMINB-UHFFFAOYSA-N	443.485	1.576	50	20	IDGD	
CC(C)NC(=O)c1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)cc1	813033068	CUZLKYFBBHJYLP-UHFFFAOYSA-N	447.517	1.157	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)N2C[C@@H]3CCCN3c3ccccc32)cc1	813033453	TZGPCEHQWDVGPM-INIZCTEOSA-N	443.529	1.396	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)N(C)Cc1ccccc1S(N)(=O)=O	814325434	QMFDNDOSSQMWLG-LBPRGKRZSA-N	440.909	1.628	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)c2c(C)nc3ccccn23)cc1)C1CC1	815564477	KGQMZQZAXNDPTL-UHFFFAOYSA-N	434.456	1.558	50	20	IDGD	
COC(=O)C(C)(C)c1csc(NC(=O)C(=O)NNC(=O)COc2cc(C)ccc2C)n1	815565771	ZLXVLAGFFXGRAR-UHFFFAOYSA-N	448.501	1.375	50	20	IDGD	
COCc1cc(NC(=O)C(=O)NNC(=O)c2ccc(OC)cc2OC)cc(C(=O)OC)c1	815569085	HAKAQRUBGWFBQY-UHFFFAOYSA-N	445.428	1.037	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)CCNC(=O)C23CC4CC(CC(C4)C2)C3)c1	825791592	QHOJEHLRQPVBJY-UHFFFAOYSA-N	428.533	1.977	50	20	IDGD	
CCOC(=O)c1ccc(NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1	861730343	SCQWQEZZLYDPTK-UHFFFAOYSA-N	448.501	1.645	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(N3C[C@@H](C)O[C@H](C)C3)nc2)cc1C	914882099	VBNIVPUMPIDVAT-HZPDHXFCSA-N	425.489	1.712	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCCn2ccc3ccccc32)c1	915878906	SVBHZOMXQAOXSP-UHFFFAOYSA-N	443.529	1.926	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@H](C)CCc2ccccc2)cc1	915884285	VQZKCHIQZZEFBY-QGZVFWFLSA-N	432.546	1.967	50	20	IDGD	
COC(=O)CCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	915894843	VLGWCMDXWLYWCJ-UHFFFAOYSA-N	448.501	1.062	50	20	IDGD	
Cn1ccnc1[C@@H](NC(=O)NNC(=O)c1nnc(O)c2ccccc12)c1ccc(F)cc1	916221158	RJRVNHOZODKXHU-INIZCTEOSA-N	435.419	1.942	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)NCCCN2CCN(c3ncccn3)CC2)c2ccccc2n1	916267362	OYUBWFYWXPYZRD-UHFFFAOYSA-N	448.531	1.490	50	20	IDGD	
CC(=NNC(=O)c1cccc(N(C)C)c1)c1ccc(S(=O)(=O)NCCC(=O)O)cc1	916280578	GAVIERJFUDJFSK-UHFFFAOYSA-N	432.502	1.660	50	20	IDGD	
COCCNC(=O)CN1CCN(CCP(=O)(c2ccccc2)c2ccccc2)CC1	917064983	ODGNFVUANMQECD-UHFFFAOYSA-N	429.501	1.381	50	20	IDGD	
CN(Cc1ccccc1)C(=O)N1CCN(CC(=O)NNC(=O)c2ccccc2Cl)CC1	917136841	KLZRQJOUURTHMB-UHFFFAOYSA-N	443.935	1.971	50	20	IDGD	
COc1ccc(C(=O)O)cc1S(=O)(=O)NNC(=O)c1ccc(F)cc1Br	917754810	JDWBSPPHGYSQLR-UHFFFAOYSA-N	447.238	1.918	50	20	IDGD	
N#CCCn1cc(/C=C(/C#N)C(=O)NCC2(C(N)=O)CCOCC2)c(-c2ccccc2)n1	918098863	IZRHURLEPBORLC-AQTBWJFISA-N	432.484	1.769	50	20	IDGD	
NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)cc2)C1	918119307	RYWKWQMPKHAMAH-INIZCTEOSA-N	440.460	1.441	50	20	IDGD	
O=C(NNC(=O)c1cc(F)cc2nc[nH]c12)c1cccc(S(=O)(=O)N2CCCCC2)c1	918278669	FNNVBWJYJCBGNT-UHFFFAOYSA-N	445.476	1.951	50	20	IDGD	
C[C@@H]1CC(C)(C)C[C@]2(C1)NC(=O)N(CC(=O)NNC(=O)c1ccc(Cl)cc1O)C2=O	918358028	UDBKCFSNVUAUKY-GIPWTMENSA-N	436.896	1.943	50	20	IDGD	
Cc1nn(C)c(C(=O)NNC(=O)[C@H](C)Oc2cccc(Br)c2)c1[N+](=O)[O-]	918759352	VNUJDBCDBMLBMZ-VIFPVBQESA-N	426.227	1.628	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)c2cc(S(=O)(=O)N3CCCC3)c(C)o2)cc1	919283229	NMBVQQYCKUDUHQ-UHFFFAOYSA-N	449.485	1.299	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(Cl)cc1C(F)(F)F)N[C@H]1CCS(=O)(=O)C1	919961260	YVIXXHUIGONCHO-QMMMGPOBSA-N	435.833	1.038	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)NNC(=O)c2c(C)nc3ccccn23)cc1OC	920934111	CEYGBNZPMUJXQG-UHFFFAOYSA-N	446.489	1.879	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)NC[C@@H](c1cccc(F)c1)N1CCOCC1	921247547	HDJDFROTRJVNMX-IBGZPJMESA-N	441.463	1.480	50	20	IDGD	
CS(=O)(=O)c1cc(CNC(=O)NNc2nncc(N)c2Cl)cc(C(F)(F)F)c1	1117066458	KETPAYYMSLROMJ-UHFFFAOYSA-N	438.819	1.961	50	20	IDGD	
O=C(NNC(=O)c1n[nH]c2c1CCCC2)Nc1cccc(OCC(=O)N2CCCC2)c1	1254706146	WYGAISKVUHGALS-UHFFFAOYSA-N	426.477	1.756	50	20	IDGD	
O=C(Cn1nc2ccccn2c1=O)NNC(=O)c1ccccc1OCc1ccc(F)cc1	1317807915	OTKNGQOCIQQCEH-UHFFFAOYSA-N	435.415	1.675	50	20	IDGD	
CCc1cc(N2CCC[C@H](NC(=O)NNC(=O)c3cncn3-c3ccccc3)C2)ncn1	1318546025	UQAOFNRAENHMFL-KRWDZBQOSA-N	434.504	1.838	50	20	IDGD	
CC(=NNC(=O)c1n[nH]c2c1CCCC2)c1cccc(S(=O)(=O)N2CCOCC2)c1	1318695873	IMDKIMIOXVPSSI-UHFFFAOYSA-N	431.518	1.463	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(OC)c(C(=O)NNc2nncc(N)c2Cl)c1	1322679994	VWXBKGPJGCJUKX-UHFFFAOYSA-N	428.902	1.508	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](OC(C)=O)C(C)C)C1	1779207367	FENVYVHNSPVAGZ-WOCWXWTJSA-N	432.945	1.342	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@]2(C1)CN(C(=O)c1ccc3c(c1)NC(=O)CO3)CCO2	1779296872	JLSADKIIFSRKFD-NRFANRHFSA-N	447.564	1.313	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccn3c(O)nnc13)C2	1780702532	KEEOLMCXFLHJSJ-BXTJHSDWSA-N	435.912	1.580	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@@]2(CN(C(=O)C(=O)C3CC3)CCO2)C1	1782861067	GIAHNJRDPQPXMR-NAVGAYGYSA-N	429.423	1.681	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](C)Br)C2)C1	1783534719	NQNBGYPKVXALRG-BFUOFWGJSA-N	435.322	1.870	50	20	IDGD	
Cc1cccc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]3C2)n1	1783964137	LBOAQVWDUUBSDS-IKICRFKJSA-N	438.366	1.943	50	20	IDGD	
CC(C)n1nc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Cl)C[C@@H]32)cc1C(=O)O	1785716701	YXVZYYJZCQNDFU-GVARAGBVSA-N	430.864	1.290	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc(OC)cn3)[C@H]2C1	1786243979	YWKRJSGICQDHJJ-ABHRYQDASA-N	441.326	1.252	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(C4CC4)cc3)C[C@@H]21)c1ccc(B(O)O)cc1	1786981792	LUQZSCGJDWIQOF-PMVMPFDFSA-N	448.328	1.151	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CNC(=O)c3cc(C)on3)[C@H]2C1	1788667530	IDCVXGAQGODQRF-MPTYRVRUSA-N	440.928	1.100	50	20	IDGD	
COc1nn(C)cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]2C1	1789865839	GKVFGIZWJMYFJT-XBPIAWKYSA-N	433.336	1.258	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(C)(C)OC(=O)NC(C)C)C[C@@H]21	1789866827	PEXGUNUUGAFSCY-VGWMRTNUSA-N	431.961	1.897	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4cncn4c3)C[C@@H]21)[C@@H](F)Br	1789926401	WPNVNHABFVTUSH-QCEMKRCNSA-N	439.285	1.618	50	20	IDGD	
Cc1c(C(=O)Nc2ccc(C3(NC(=O)[C@@H](O)CCl)CCC3)cc2)cn2[nH]cnc(=O)c12	1790011614	NVAGIBBPLONSHC-INIZCTEOSA-N	443.891	1.678	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CC[C@H]4CCC(=O)N4C3)C[C@@H]21)C(Cl)Cl	1791296768	ZVEGVOLQDINUSE-QTVXIADOSA-N	432.348	1.171	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)Sc3ccccn3)[C@H]2C1	1791580779	QWWVVPUIXANGFK-XAJHFOFHSA-N	441.981	1.796	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(F)c(OC)c3)[C@H]2C1	1791947029	UYCTWTUSFLFSCT-AFIMGQEJSA-N	428.888	1.681	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3cccnn3c1)C2	1792873479	ATIRGWCFBRIHBL-JJAZEVLHSA-N	435.322	1.569	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1=COCC1)C2	1793882344	KKOWPUSHDMJAGM-FZKCQIBNSA-N	443.928	1.012	50	20	IDGD	
COc1cncc(CCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CCC(=O)NN(C)C)C3)c1	1794327852	UGAIBUUFMLUPJR-BCDXTJNWSA-N	431.537	1.034	50	20	IDGD	
COc1ccc([C@@H](O)C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCBr)cc1	1795112852	FDEFUBSIDUPCJD-LTCOOKNTSA-N	441.322	1.103	50	20	IDGD	
CC1(C)Cc2cccc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3ccc(B(O)O)cc3)c2O1	1796189288	UCIGGQKFHKRSGJ-ACDBMABISA-N	448.328	1.646	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Cl)C1CC1	1796361873	WZZUAERSGJJNCQ-SSRUIJIPSA-N	447.935	1.804	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1[C@H]2Sc3ccccc3[C@@H]21	1798458388	ZXPJBFFSZVXLEK-WXEFCSOTSA-N	442.585	1.886	50	20	IDGD	
CSc1ncccc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnccc1C(=O)NN)C2	1799011283	XXRSWGYHNMHJJJ-BTTYYORXSA-N	440.529	1.368	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1C[C@@]12C(=O)Nc1ccccc12	1800735476	OVRRTZUHHHJUIG-CEGHFVKMSA-N	431.920	1.503	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc(F)c(F)c1)C2	1800755963	AZXMCHAZCBETOU-AKENFEQQSA-N	431.277	1.880	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(OC)c(Cl)c1)C2	1800983201	QVTWJSMKNWRVLZ-IARIHHJXSA-N	431.316	1.806	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(F)(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Cl)C3)C1	1802198159	CGKXZSQLKGKLLZ-RNJOBUHISA-N	437.871	1.069	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H]1CCN1C(=O)OC(C)(C)C)C2	1802269149	DYJPBPAKDWGVTB-JKJDWNRSSA-N	429.945	1.888	50	20	IDGD	
Cn1nncc1C(=O)NC[C@@H]1CCN(C(=O)[C@@](C)(Cl)CCl)[C@@H]1c1cccnc1	1804750644	XSJUWDSYQRHJLT-JOQOYGCGSA-N	425.320	1.766	50	20	IDGD	
COC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1	1806372052	MPABMGYUAGOVCV-KBXCAEBGSA-N	426.311	1.826	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)Cc2ccn(C)n2)[C@H]1c1cccnc1	1807516767	GRKAKVBKJGGNHN-DHSIGJKJSA-N	434.338	1.847	50	20	IDGD	
CC(C)n1nc(C(=O)N2CCCC3(CCN(C(=O)[C@@H](O)CCl)CC3)C2)cc1C(=O)O	1807691575	VQNNDBMNBKGNQS-INIZCTEOSA-N	440.928	1.607	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cc(=O)nc3cccnn23)[C@@H]1c1cccnc1)[C@H](F)Cl	1808315102	KDABPDKIQSORJJ-VHSSKADRSA-N	444.854	1.339	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)[C@H](O)N2CCOCC2)[C@H]1c1cccnc1	1810349916	VJWJQVIAXGUXTB-IIMDRIAPSA-N	438.956	1.146	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)c2ncn(C)n2)[C@@H]1c1cccnc1	1812774827	IGNXOUZNIXILTK-SOUVJXGZSA-N	435.326	1.703	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)[C@H](N)c2ccccn2)[C@@H]1c1cccnc1	1812864343	OIFWPJOHOLPCAV-OXXUSNJHSA-N	446.349	1.966	50	20	IDGD	
C#CCCCCC(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1813223757	UNWJBXFLFGMWLK-NFBKMPQASA-N	433.317	1.275	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)C1CC(F)(F)C1	1814537915	UMOJPVUFBVSMGI-MRXNPFEDSA-N	432.236	1.441	50	20	IDGD	
Cc1ccoc1C(=O)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1	1815354422	AMDHPQUVMPIJNP-AWEZNQCLSA-N	425.275	1.264	50	20	IDGD	
Cc1c(C(=O)N[C@H]2CCc3nc(NC(=O)[C@@H](F)Cl)sc3C2)cn2[nH]cnc(=O)c12	1817125326	LCPJVYJMXZWULC-ISVAXAHUSA-N	438.872	1.548	50	20	IDGD	
CC(=O)N1CCN(CC(=O)N2CCCC[C@@H]2c2cc(NC(=O)[C@@H](F)Cl)n[nH]2)CC1	1818039357	RWULLNIWPSUZAP-RHSMWYFYSA-N	428.896	1.100	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)CCN2CCOC2=O)[nH]n1)[C@H](F)Br	1820933104	AEKJAUWGSHMGJV-RISCZKNCSA-N	446.277	1.935	50	20	IDGD	
CC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(=O)nc3cccnn13)CC2	1822850145	PETRMNFXTFVAQK-WDEREUQCSA-N	446.920	1.789	50	20	IDGD	
Cc1onc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)c1C	1824750129	OHKMWOKTLJUQJG-FQEVSTJZSA-N	439.321	1.518	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)C[C@@H]2NC(=O)NC2=O)CC1	1825076521	ORWPULTXRBRPMU-NJSLBKSFSA-N	447.363	1.441	50	20	IDGD	
Cc1nscc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1	1825657178	GLBNBBIJBQNDCC-HXUWFJFHSA-N	441.362	1.678	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CN2CCOCC2)CC1	1826717724	HWNBOCSFNOQSMO-WBVHZDCISA-N	430.387	1.722	50	20	IDGD	
CN1CCN(C2(C(=O)N3CCC([C@@H]4CCCCN4C(=O)[C@@H](F)Cl)CC3)CC2)CC1	1827611194	ODCIHUCGMVDHIT-ZWKOTPCHSA-N	428.980	1.921	50	20	IDGD	
CCc1nc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)co1	1829383608	HVXVKWTZJNCPHP-FQEVSTJZSA-N	439.321	1.464	50	20	IDGD	
O=C(C1CC1)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)[C@@H](O)CCl)C2)C1	1829444804	UMWPZWCOJKVEQU-PGRDOPGGSA-N	449.935	1.448	50	20	IDGD	
Cc1c(F)cccc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)Br)C2)C1	1830164049	UNWDDQLSBDVZEW-LIRRHRJNSA-N	443.313	1.988	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccs3)C2)C1	1830537857	QRIPQLNFLXDKPD-GUYCJALGSA-N	431.352	1.849	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H]2CNC(=O)O2)CC1	1831546071	CJWZXODFGJWKGC-ZNMIVQPWSA-N	430.343	1.888	50	20	IDGD	
O=C(Cc1cncnc1)NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1833862065	BEUVGZBBHKIYNS-QGZVFWFLSA-N	442.333	1.281	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)cn1	1833998379	GSXBIIZKXDWFGP-RDTXWAMCSA-N	426.311	1.243	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3csnc3C)CC2)CC1	1834044408	XUVBHGXLVAXGHZ-QGZVFWFLSA-N	428.986	1.891	50	20	IDGD	
O=C(c1ccc(C(F)(F)F)nc1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1834274348	BORJNSYRBUZMCL-CZUORRHYSA-N	439.793	1.705	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnoc3C)CCO2)C1	1834319273	QCKRIVVMPAZOCM-PBHICJAKSA-N	430.299	1.227	50	20	IDGD	
Cc1noc(N)c1C(=O)NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1834701274	DXDKAQYIUYGCOC-CQSZACIVSA-N	446.321	1.441	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1)[C@H]1CC1(F)F	1835450666	PJIYSEKIETTXKU-OLZOCXBDSA-N	426.277	1.904	50	20	IDGD	
C[C@]1(C(=O)N2CCC(N3CCC(NC(=O)[C@H](F)Br)CC3)CC2)CCCN1	1836414013	UHYKHJQKOSUWKK-MAUKXSAKSA-N	433.366	1.391	50	20	IDGD	
Cc1nnc(CCC(=O)N2CCC(OC3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)s1	1836714939	DXJBSCPMRSFVQX-INIZCTEOSA-N	444.985	1.377	50	20	IDGD	
O=C(c1ccnc2c1OCO2)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836718443	OLXQLYDTIFXDCL-MRXNPFEDSA-N	439.896	1.022	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)C1(C(F)(F)F)CC1)CCO2	1836720922	SKYBJESOVCAVSA-INIZCTEOSA-N	438.519	1.637	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)N1CCC(OC2CCN(C(=O)CCBr)CC2)CC1	1837653561	BULOHNTTZPIDDY-CQSZACIVSA-N	444.370	1.461	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ncc(Cl)cn3)C2)C1	1837712453	SHEJQOQSAZCIFI-SFHVURJKSA-N	442.976	1.052	50	20	IDGD	
CCc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)CCBr)C3)C2)no1	1838123783	CXVHUFNWNDHDHL-KRWDZBQOSA-N	430.299	1.092	50	20	IDGD	
COCc1c[nH]c(C(=O)N2CCO[C@]3(COCCN(C(=O)CCBr)C3)C2)c1	1838516839	STABRVLZKSAHNL-SFHVURJKSA-N	444.326	1.016	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCNC(=O)OC(C)(C)C)C2)C1	1839149520	JMSNJLLEJGDHAA-YWZLYKJASA-N	447.960	1.375	50	20	IDGD	
Cc1noc(C)c1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2	1839151422	QWGPICPTOHBXDV-ROUUACIJSA-N	434.320	1.598	50	20	IDGD	
Cc1cccc(Cl)c1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1	1839338871	ROONTSDFPFBHDU-KXBFYZLASA-N	431.316	1.318	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)C(=O)c3ccco3)C2)C1	1839962350	BPIWFANFVRLGMB-FZKQIMNGSA-N	443.294	1.092	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc(C)nc3)C2)C1	1839963529	NJULPEQPWRHGBO-QAPCUYQASA-N	441.326	1.029	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CC[C@H](O)CC3)C2)C1	1839966806	QKOKKFBTHYUMNM-IUVQAAGXSA-N	447.370	1.167	50	20	IDGD	
O=C(C(Cl)Cl)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CCc3ccccc31)CCO2	1840260318	KQGXXRBLGDTIKW-OXQOHEQNSA-N	427.328	1.977	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)c1ccccc1Cl)CCO2	1840318090	NWCRUFVJFOYZEL-MDYRTPRTSA-N	445.343	1.847	50	20	IDGD	
Cc1cc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](C)CBr)C3)C2)no1	1840366406	JVJHBPQOFJAXRG-UGSOOPFHSA-N	444.326	1.013	50	20	IDGD	
O=C(c1ccc2c(c1)CCCO2)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1840659764	KVVQFNWRDJNKTR-YLJYHZDGSA-N	426.872	1.616	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@](F)(C(=O)N2CC3(CCCN3C(=O)[C@H](O)CCl)C2)C1	1841353612	GVVGUELUBSEJSL-VLIAUNLRSA-N	447.935	1.529	50	20	IDGD	
O=C(Cc1ccc(Br)c(F)c1)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1	1841353740	MOZPMXMEUBJEGG-AWEZNQCLSA-N	433.705	1.934	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCCC12CN(C(=O)c1cc(O)ncn1)C2	1841923882	AMPKZPABDLTEDD-ZDUSSCGKSA-N	439.900	1.131	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)CCOc2ccccc2)C1	1842640676	XYGMFCPQHZGNAO-KOEQRZSOSA-N	437.500	1.793	50	20	IDGD	
O=C(Cc1ccc2ccccc2c1)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843013446	MKCCCWAEENYCQN-UHFFFAOYSA-N	428.297	1.579	50	20	IDGD	
CCOC(=O)c1ncn2c1CC[C@@H](C(=O)N1CC3(CCCN3C(=O)[C@@H](F)Cl)C1)C2	1843365925	SAQHIQILBNKLEC-IUODEOHRSA-N	426.876	1.360	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC2(CCCN2C(=O)[C@@H]2ON=C(c3ccccc3)O2)C1	1844195459	PFUBQLQNIKLTTJ-UGSOOPFHSA-N	436.306	1.956	50	20	IDGD	
O=C([C@H](F)Br)N1CC2(CCCN2C(=O)[C@@H]2C[C@@]23C(=O)Nc2ccccc23)C1	1846183314	BSDHORNTLGQKGS-PJFSTRORSA-N	436.281	1.790	50	20	IDGD	
COc1ccc(CC(=O)N2CC3(CCCN3C(=O)CCC(=O)NN(C)C)C2)c(Cl)c1	1846384219	RUMIWAOAPHKGDV-UHFFFAOYSA-N	436.940	1.468	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@]1(O)CCN(C(=O)OC(C)(C)C)C1	1847867879	LVBPZHZZGMNDNW-FAPUVCABSA-N	443.972	1.968	50	20	IDGD	
O=C(CN1c2cccc3cccc(c23)S1(=O)=O)NNC(=O)[C@H]1COc2ccccc2O1	15663386	FKXODVKPNLOUQT-QGZVFWFLSA-N	439.449	1.336	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2ccc(Cl)cc2Cl)cc(OC)c1OCC(N)=O	15811244	JPUCBQVBHVEWLD-UHFFFAOYSA-N	442.255	1.950	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)cc1	15888963	UZVAASPXFPWPNO-UHFFFAOYSA-N	442.497	1.573	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1[N+](=O)[O-]	17455411	YELMBXBAYMFNMB-UHFFFAOYSA-N	432.458	1.763	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNS(=O)(=O)c2ccc(OC)cc2[N+](=O)[O-])cc1	23393580	KRYPJHWBQMRSKD-GFCCVEGCSA-N	439.446	1.779	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNS(=O)(=O)c2ccc(C)cc2Cl)cc1	25366487	BADVZYKQXCCQBO-UHFFFAOYSA-N	445.950	1.587	50	20	IDGD	
Cc1nc2c(C(N)=O)cnn2c(C)c1CCC(=O)NNC(=O)Cc1c[nH]c2ccccc12	107688338	FHIJVRMKMSWSIO-UHFFFAOYSA-N	433.472	1.249	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)c2ccc3c(=O)n(CC)c(=O)[nH]c3c2)cc1	108045655	SACVOQVUOVYFLU-CYBMUJFWSA-N	440.456	1.337	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=S)Nc2ccc(C(N)=O)cc2)cc1	726436077	SILHOKPVWLLXJH-UHFFFAOYSA-N	441.542	1.838	50	20	IDGD	
COc1ccccc1/C(C)=C/C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	728344607	XLQOAMZAHMIIFW-VUVZNRFTSA-N	426.425	1.629	50	20	IDGD	
CCS(=O)(=O)N1CCC(C(=O)NNC(=O)c2cccc(C#N)c2)(c2ccccc2)CC1	728828347	NLYFYRYNESBCIH-UHFFFAOYSA-N	440.525	1.703	50	20	IDGD	
CN(C[C@@H]1COc2ccccc2O1)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	728958968	HRXFBZIZVJBJAG-MRXNPFEDSA-N	426.477	1.206	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCCN(C)C(=O)OC(C)(C)C)c2ccccc2c1=O	729612731	FYFFUXRFTYJKFS-UHFFFAOYSA-N	432.481	1.227	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(C(C)=NNC(=O)Cn2nnc(-c3ccccc3)n2)cc1	729633320	MQFBTGLDJPRKMA-UHFFFAOYSA-N	427.490	1.642	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2ccc(F)c(C)c2)c1	729836139	GURJNDLQVVGOSB-UHFFFAOYSA-N	443.522	1.788	50	20	IDGD	
CC1CCN(S(=O)(=O)c2ccc(C(=O)N([C@@H]3CCS(=O)(=O)C3)N(C)C)s2)CC1	730161965	NDENCFZKVBOYEH-CQSZACIVSA-N	449.620	1.275	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)[C@@H]1CCCN(S(=O)(=O)Cc2ccccc2)C1	730512178	IPFRMAYZPWPEEH-QGZVFWFLSA-N	449.504	1.594	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NN=C1CCN(CCN2CCOCC2)CC1	731557639	UTMOASLRHVARAJ-UHFFFAOYSA-N	439.354	1.728	50	20	IDGD	
CC1CCC(NS(=O)(=O)CC(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)CC1	731734368	RPFMLFAPZOIQNT-UHFFFAOYSA-N	445.925	1.142	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cc(C(=O)NNC(=O)c2c[nH]nc2C)ccc1C	731851639	IXZQOBIOSDSFFF-UHFFFAOYSA-N	443.485	1.911	50	20	IDGD	
Cn1c(CCC(=O)NNC(=O)C2CCC2)nc2cc(S(=O)(=O)N3CCCCC3)ccc21	732143154	UGWJCCSWAKAYHI-UHFFFAOYSA-N	447.561	1.628	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc([C@@H](C)N[C@@H](C)C(=O)NNC(=O)CC(C)C)cc1	732197199	XDAJSAVIEUCVSS-CVEARBPZSA-N	426.583	1.950	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2ccc(CN3C[C@H](C)O[C@H](C)C3)cc2)C[C@@H](C)O1	732262631	VBAAAIOQYTYJQG-QGFMHUBQSA-N	432.565	1.556	50	20	IDGD	
O=C(NNC(=O)C1CCC1)c1ccc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1O	732292294	LMBBFFJGCRWJSJ-UHFFFAOYSA-N	434.430	1.662	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)CCc1ccc(S(=O)(=O)NC2CC2)cc1	732304147	JPKOMQVQCHKVAP-UHFFFAOYSA-N	437.543	1.607	50	20	IDGD	
CCC[C@@H](NC(=O)Cc1ccccc1)C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	732633579	MXVZLEIICPRWHE-GOSISDBHSA-N	431.514	1.379	50	20	IDGD	
O=C(CCNS(=O)(=O)/C=C/c1ccccc1)NNC(=O)c1cnn(-c2ccccc2)c1	733364777	RJYAGAAJRIENPV-WYMLVPIESA-N	439.497	1.614	50	20	IDGD	
Cc1nc2ccccc2c(=O)n1CC(=O)NNc1ccccc1S(=O)(=O)NC(C)(C)C	734249861	KESNYYGCYBAZKK-UHFFFAOYSA-N	443.529	1.925	50	20	IDGD	
CC(C)[C@H](CNC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)NC(=O)OC(C)(C)C	734689134	JTYYMCKCKCRFLA-HNNXBMFYSA-N	442.538	1.583	50	20	IDGD	
C[C@@H](CN1CCN(c2ccccn2)CC1)NC(=O)NNC(=O)[C@H](C)Oc1ccccc1F	735585267	CTOYGFKNLKUKAJ-IRXDYDNUSA-N	444.511	1.529	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)N1CCCN(C(=O)c2cccc(F)c2)CC1	738497261	PVQMEFYWTPBDBR-UHFFFAOYSA-N	428.464	1.931	50	20	IDGD	
CC[C@H](COC)NC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	739049038	MNVVJSCVANFWEP-QGZVFWFLSA-N	434.518	1.534	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)N[C@@H]1CCN(c2ccc(Cl)cc2)C1=O	740483843	IGPRSGJYVYHQNW-CQSZACIVSA-N	447.835	1.763	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C[C@@H]2CN(Cc3ccccc3)CCO2)cc(OC)c1OC	740738273	CJUGQOSGOCQLPV-GOSISDBHSA-N	443.500	1.765	50	20	IDGD	
CCCn1nc(C(=O)NNS(=O)(=O)c2cc(F)c(F)c(F)c2)c2ccccc2c1=O	741646102	FTVJZXCLGYXPAD-UHFFFAOYSA-N	440.403	1.847	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(C)(C)c2ccccc2)cc(NS(C)(=O)=O)c1OC	742658160	YFLLNOGYXLJIHB-UHFFFAOYSA-N	435.502	1.814	50	20	IDGD	
COc1cc(OC)cc(C(=O)NCC(=O)NNC(=O)Nc2ccc(OC(F)F)cc2)c1	743832290	JPDJDFJYSOEBAS-UHFFFAOYSA-N	438.387	1.888	50	20	IDGD	
Cc1cc(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)ccc1-n1cncn1	744621776	PWHZEJRYSJBLJW-UHFFFAOYSA-N	442.501	1.354	50	20	IDGD	
CN(C)C(=O)c1ccc(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)cc1	744622268	YXUWOUDNJCVWGA-UHFFFAOYSA-N	432.502	1.166	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)c2cc(S(=O)(=O)N3CCCC3)c(C)o2)c1	744784324	AWPYAWPAIPWEBM-UHFFFAOYSA-N	449.485	1.299	50	20	IDGD	
COc1cc2c(cc1CNC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)O[C@H](C)C2	746348348	XCWMVMCCRZIMAM-GFCCVEGCSA-N	448.501	1.958	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)NCCCN1CCN(c2ccccc2Cl)CC1	747502678	XSDSKARUOSJNAU-UHFFFAOYSA-N	430.940	1.820	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@@H]2C(=O)NNC(=O)c2cccn2C)cc1	747599030	KIPCSLWDMJRUMN-GOSISDBHSA-N	432.502	1.232	50	20	IDGD	
COc1cc(OC)c(S(=O)(=O)NNC(=O)c2cccc(C#N)c2)cc1Br	747613199	DPXVKOVWDZFMOA-UHFFFAOYSA-N	440.275	1.961	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1)[C@@H]1CC(=O)N(C2CC2)C1	747779674	VRQPODBWTGONSA-IFMALSPDSA-N	432.524	1.772	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1ccc(C(N)=O)cc1)C(=O)NNc1ccc(Cl)cc1Cl	748017783	SIUKJDNGPVKKDI-SECBINFHSA-N	431.301	1.902	50	20	IDGD	
O=C(Cn1nc(-c2ccccc2)oc1=O)NNc1nc(-c2ccccn2)nc2c1CCC2	748341081	NQYJOBFPOSEWJI-UHFFFAOYSA-N	429.440	1.987	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNS(=O)(=O)c1cccc2c1CCCC2	748640249	KXZRHHIOPLCDPW-UHFFFAOYSA-N	436.559	1.790	50	20	IDGD	
Cc1cccc(CCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c1	749185033	GVLNZLRXSKZUSG-UHFFFAOYSA-N	446.529	1.203	50	20	IDGD	
O=C(Cc1ccc(S(=O)(=O)N2CCOCC2)s1)NNC(=O)c1cc2ccccc2o1	749474836	SPFLYOLVPIZAQD-UHFFFAOYSA-N	449.510	1.519	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NC2CCN(c3cc(C)nc(C)n3)CC2)cc1OC	749616661	QPLVDWSESVPMDO-UHFFFAOYSA-N	428.493	1.724	50	20	IDGD	
CS(=O)(=O)Nc1cccc(C(=O)NNc2nc(Br)cn3ccnc23)c1	750249644	GVLGHKOLEUJNDT-UHFFFAOYSA-N	425.268	1.620	50	20	IDGD	
CC[C@H](Oc1ccccc1C)C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	750460663	BPEFNAXWWYAACY-KXBFYZLASA-N	428.441	1.683	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1)N[C@H]1CC(=O)N(C2CC2)C1	750656280	WWGCHZIKNOGTMY-UNMCSNQZSA-N	447.539	1.707	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCO[C@@H]1c1cnn(Cc2ccccc2)c1)C(=O)Nc1ccccn1	753176257	DYNLCIRWPKWSKM-PKOBYXMFSA-N	434.456	1.190	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)N[C@@H]1[C@@H]2CCO[C@H]2C12CCC2	754677896	ZBWYTPDRYZXTMT-RCCFBDPRSA-N	448.545	1.373	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)[C@]3(C)CCOC3)c2)cc1	754826966	BXBQRGZTXQETOX-HXUWFJFHSA-N	433.486	1.684	50	20	IDGD	
C[C@@](O)(CC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1)C1CC1	755388889	DTHCCGDDBAGSDZ-OAQYLSRUSA-N	431.514	1.477	50	20	IDGD	
CCOc1ccc(NC(=O)NNC(=O)Cc2ccncc2)cc1S(=O)(=O)N1CCCC1	755471821	UQTQZMZRONULFZ-UHFFFAOYSA-N	447.517	1.660	50	20	IDGD	
C[C@@H]1CN(c2ccc(NC(=O)NNC(=O)[C@H]3COc4ccccc4O3)cn2)C[C@@H](C)O1	755866903	ZYYQFPOXRKATDC-HBUWYVDXSA-N	427.461	1.688	50	20	IDGD	
C=CCN(C)S(=O)(=O)c1ccc(NC(=O)NNC(=O)c2cncc(NC(C)=O)c2)cc1	755932211	LGAVGFZLHCPTNU-UHFFFAOYSA-N	446.489	1.313	50	20	IDGD	
C=CCN(C)S(=O)(=O)c1ccc(NC(=O)NNC(=O)c2ccc3c(c2)OCO3)cc1	755933289	SPGCFGQKVWYHLC-UHFFFAOYSA-N	432.458	1.688	50	20	IDGD	
COC(=O)c1nscc1S(=O)(=O)NNC(=O)c1ccc(Br)s1	755959165	VWBBLDJFXRDMKK-UHFFFAOYSA-N	426.295	1.377	50	20	IDGD	
COC(=O)CN1CCN(c2ccc(NC(=O)NNC(=O)c3ccc(C)cc3O)cc2)CC1	756391955	FOTATUVBTKHROI-UHFFFAOYSA-N	441.488	1.462	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)cc1-n1cnnn1	756747525	QBFYAEMDXLPSLW-UHFFFAOYSA-N	443.420	1.163	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)CC[C@H]2CCN(C(=O)OC(C)(C)C)C2)c2ccccc2c1=O	758072764	ZEHBACZBZZSBDI-AWEZNQCLSA-N	443.504	1.732	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NNC(=O)c2ccc(OC)c(Br)c2)cn1	758149925	HJDBMXYENZXIEV-UHFFFAOYSA-N	430.280	1.875	50	20	IDGD	
O=C(CN1CCN(c2nc(F)c(F)cc2F)CC1)NNC(=O)c1ccccc1Cl	759972284	ZXBSIWMLNJZVFZ-UHFFFAOYSA-N	427.814	1.736	50	20	IDGD	
CC1(C)C(=O)N(C[C@](C)(O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)c2ccccc21	760052858	GJMXOJHVSVCHKH-JPYJTQIMSA-N	439.468	1.049	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)NC1CCN([C@@H]2CCCC[C@@H]2O)CC1	761743591	VRERHYNSBFYCES-SJORKVTESA-N	436.578	1.886	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)N[C@@H]2CC[C@H]3SCCS[C@H]23)nc1	763059362	BFIFTMNBTIFUJO-UMVBOHGHSA-N	431.609	1.774	50	20	IDGD	
Cc1cc(C(=O)O)cc(S(=O)(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)c1F	763439260	KDUXUTGNQTXXQO-UHFFFAOYSA-N	433.458	1.447	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)cc1OC	763539498	MIWNFIPYHPUHGO-UHFFFAOYSA-N	447.444	1.519	50	20	IDGD	
C[C@H](CC(=O)NNC(=O)C(=O)Nc1ccccn1)[C@H]1CCCN(C(=O)OC(C)(C)C)C1	763565306	ZJMBBUIBBHVXEI-CABCVRRESA-N	433.509	1.841	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cnc3c(c2)COCC3)c(C)n1-c1ccccc1	763603259	YHUYKFKRXICDPA-UHFFFAOYSA-N	433.468	1.962	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)C(=O)Nc1cnn(-c2cnc3ccccc3n2)c1	763681176	MEKJGPYTQRJGGR-UHFFFAOYSA-N	449.402	1.120	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccnn1Cc1ccc(C)o1	763682972	XVJKLJLTPJKISC-UHFFFAOYSA-N	441.444	1.396	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)NCC(C)C)cc2)c1	763771495	BCWMGECDBTVEDN-UHFFFAOYSA-N	442.472	1.489	50	20	IDGD	
Cc1cc(N2CCOCC2)ccc1NC(=O)C(=O)NNC(=O)c1cc2c(s1)CCC2	763784782	HZYGKAFLGJOCBW-UHFFFAOYSA-N	428.514	1.782	50	20	IDGD	
COC(=O)c1c(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)sc2c1CCCC2	763837243	BOXCTWRXXGLUNM-UHFFFAOYSA-N	449.460	1.718	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)C(=O)Nc1cnn(-c2ccccn2)c1	763850853	BDAKIUVJLKFRGQ-OAHLLOKOSA-N	444.451	1.974	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccccc2C[S@](C)=O)c1C	763851889	GAWHTLFFQAHORA-FOGNVHKLSA-N	431.514	1.735	50	20	IDGD	
COc1ccc(CN(C)C)cc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccc(F)cc1	763865393	KHDZZEKPMKQFGY-ZDUSSCGKSA-N	432.452	1.449	50	20	IDGD	
CCOC(=O)N(C)c1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)cc1	763866981	SCBJPNLJUKBQON-CYBMUJFWSA-N	446.435	1.972	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cnn(-c3ccccc3)c2C)cc1OC	763899688	AEMFQXZLUPWRCT-UHFFFAOYSA-N	437.456	1.988	50	20	IDGD	
Cc1nn(C)c(NC(=O)C(=O)NNC(=O)C2=S=C3CC[C@H](C(C)(C)C)CC3=C2)c1C	763941811	PUMAFKWGWKTCDN-AWEZNQCLSA-N	431.562	1.987	50	20	IDGD	
O=C1COc2cc(NC(=O)C(=O)NNC(=O)c3cc4c(s3)CCCCC4)ccc2N1	763968496	PVDVXFXADWQOEJ-UHFFFAOYSA-N	428.470	1.748	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1c(F)cccc1Br	764003667	GCIVWSYTZNLAGH-UHFFFAOYSA-N	438.209	1.759	50	20	IDGD	
COC(=O)CCCOc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(C)cc2O)cc1	764109325	KLXFKPOSIUPRNT-UHFFFAOYSA-N	429.429	1.432	50	20	IDGD	
CCOc1ccc(C(=O)N2CCCCC2)cc1NC(=O)C(=O)NNC(=O)CC(F)(F)F	764116013	IGBGJSNWORRUDR-UHFFFAOYSA-N	444.410	1.750	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2c(F)cccc2Br)c1O	764130975	CGFLTDSKDSJLJF-UHFFFAOYSA-N	426.198	1.702	50	20	IDGD	
Cc1ccc(Oc2ccc(NC(=O)C(=O)NNC(=O)[C@@H]3Cc4ccccc4O3)cc2)nn1	764151450	IUCDWHAPCDEORF-SFHVURJKSA-N	433.424	1.667	50	20	IDGD	
CCOCCOCc1cccc(NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)c1	764153975	NPXJKIMSBSNMAS-LJQANCHMSA-N	427.457	1.329	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cc(F)ccc2Br)ccc1C(N)=O	764270094	FPLCAGIAQGVUEI-UHFFFAOYSA-N	437.225	1.395	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)c1cccc(-n2nccc2C(F)(F)F)c1	764342662	GTTDTGIHDWLVGL-UHFFFAOYSA-N	432.362	1.477	50	20	IDGD	
Cc1cc(C(=O)N2CCSCC2)ccc1NC(=O)C(=O)NNC(=O)c1ncccc1C	764389685	VDZBVRJRRAYEDY-UHFFFAOYSA-N	441.513	1.287	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(-c2cn3cccc(C)c3n2)cc1	764398319	FBYMWZNJKBAXSR-OAHLLOKOSA-N	439.472	1.447	50	20	IDGD	
Cn1cnnc1-c1cccc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)c1	764400037	FPVVJAJKKWIMSJ-UHFFFAOYSA-N	426.458	1.066	50	20	IDGD	
COc1ccc(OC(F)F)c(NC(=O)C(=O)NNC(=O)c2cncc(NC(C)=O)c2)c1	764432226	DEKWQILHLBATNG-UHFFFAOYSA-N	437.359	1.050	50	20	IDGD	
Cn1nc(SCC(=O)NN=C2CCc3cc(Cl)cc(Cl)c32)c(=O)n(C)c1=O	764677478	YVDYTYLYFFOPOU-UHFFFAOYSA-N	428.301	1.345	50	20	IDGD	
COc1ccc(C=NNC(=O)CN2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)c(O)c1	764819313	QPKBCCZRADZGQM-UHFFFAOYSA-N	446.529	1.166	50	20	IDGD	
CC(C)c1cccc(OCC(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)c1	765735293	JQPJYSFHUSFSSA-UHFFFAOYSA-N	438.528	1.794	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)/C=C3\CC[C@@H](C)C3)CC2)cc1	766636084	JAJIGBIKZDZFEY-SOGDLCAJSA-N	434.562	1.195	50	20	IDGD	
CN(C)Cc1ccsc1C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	766640232	CBFHRTMNYSERDV-UHFFFAOYSA-N	429.546	1.029	50	20	IDGD	
CCC1(CC)[C@@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)C[C@H]1OC	767162678	YHPKFUKOKNVUNI-JKSUJKDBSA-N	426.539	1.475	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)CC(F)(F)F)n(-c2ccc(C(F)(F)F)cn2)n1	768239811	OHAVIGDCPGUEPS-UHFFFAOYSA-N	438.288	1.633	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2C(=O)N[C@]3(CCCC(C)(C)C3)C2=O)cc1OC	768571136	NVIGUHBRUDQEDM-NRFANRHFSA-N	432.477	1.356	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)NC[C@@]1(N2CCOCC2)CCSC1	770298104	IKVGEBXGJAXEMN-LIRRHRJNSA-N	442.969	1.646	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)N[C@@H]3CCN(c4ccccc4OC(F)F)C3)nc21	770402516	XXPIQEPMRMWUCL-SNVBAGLBSA-N	434.407	1.575	50	20	IDGD	
C=C1c2ccccc2C(=O)N1[C@H](C)C(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772883486	AVMIMKZMYRZBQR-CYBMUJFWSA-N	426.860	1.619	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)c1cccc([C@@]2(C)NC(=O)NC2=O)c1	772965346	XFVQIAAHAVEBDP-PRWKNARSSA-N	430.848	1.623	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccncc3)nc3ccccc23)nn1C	773489782	AWMRIXUKWRRFGS-UHFFFAOYSA-N	445.439	1.439	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cc(C(F)(F)F)ccn2)cc(OC)c1OC	773510621	GDWMNDXWJRFKNH-UHFFFAOYSA-N	442.350	1.526	50	20	IDGD	
C[C@H](NCC(=O)NNC(=O)c1ccccc1Cl)c1ccc(S(=O)(=O)N(C)C)cc1	775194501	YMMUYCFFYKKQAW-ZDUSSCGKSA-N	438.937	1.702	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Cc2ccccc2C(=O)OC)c1	775637558	RHVNYSACRYOYQV-UHFFFAOYSA-N	447.513	1.507	50	20	IDGD	
CN(C)C(=O)NNS(=O)(=O)c1cc(C(=O)O)c(Br)cc1Br	775672710	KBIUAHSHVDBSIU-UHFFFAOYSA-N	445.089	1.374	50	20	IDGD	
COCCOc1ncccc1C(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776200824	BLHPGFUVKMUWAA-UHFFFAOYSA-N	437.497	1.356	50	20	IDGD	
COCc1nnc(-c2cccc(C(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)c2)o1	776299758	AEOZJFYUGNJZOG-UHFFFAOYSA-N	430.442	1.361	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)N2CCN(S(C)(=O)=O)[C@@H](C)C2)c(C)n1C[C@H]1CCCO1	776438337	AIXYHOCIMDZLAR-STUSAKQCSA-N	434.562	1.683	50	20	IDGD	
CCO[C@@H]1C[C@H](NC(=O)NNC(=O)[C@H](C)Oc2cccc(Br)c2)[C@H]1OC	776473683	OPQYFTAZSBKOOO-BSLXNSKLSA-N	430.299	1.739	50	20	IDGD	
C[C@H]1CCN(S(=O)(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)C1	777913063	HSWCASUYSUXLQZ-HNNXBMFYSA-N	441.513	1.266	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)NCCc1ccc(Br)cc1F	778660710	FYBOHHUBVGPASJ-UHFFFAOYSA-N	433.278	1.986	50	20	IDGD	
CC(C)[C@@H](C(=O)NNc1ccc([N+](=O)[O-])cc1Br)N1CCCS1(=O)=O	779144067	CGKWKVMRZRIKMQ-ZDUSSCGKSA-N	435.300	1.861	50	20	IDGD	
CCO[C@@H]1C[C@@](NC(=O)OC(C)(C)C)(C(=O)NNc2nc(O)c3cnn(C)c3n2)C1(C)C	780701234	UMKJVIQCGSBARQ-MPBGBICISA-N	449.512	1.611	50	20	IDGD	
COc1cccc(NNC(=O)C2CCN(S(=O)(=O)c3cc(F)ccc3F)CC2)n1	780769328	QUANVWPWXGESTE-UHFFFAOYSA-N	426.445	1.912	50	20	IDGD	
CC1(NC(=O)OC(C)(C)C)CCN(C(=O)NNC(=O)CNC(=O)c2cccs2)CC1	780976853	ASXVFDMEZNHMDD-UHFFFAOYSA-N	439.538	1.598	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)N[C@@H](C)C2=CCN(C)CC2)c2ccccc2c1=O	781396733	QVADCAZRNWFANN-HNNXBMFYSA-N	426.521	1.791	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(OS(=O)(=O)CBr)c([N+](=O)[O-])c1	782398779	MJJDGAPKKBUAAP-UHFFFAOYSA-N	431.286	1.686	50	20	IDGD	
CS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2cccc(-c3nnnn3C3CC3)c2)cc1	783071946	PMLGQMFFLADCNV-UHFFFAOYSA-N	441.473	1.160	50	20	IDGD	
CCCS(=O)(=O)Nc1cccc(NC(=O)C(=O)NN=c2sc3ccccc3n2C)c1	783349401	ILLKCEQFSQBUNG-UHFFFAOYSA-N	447.542	1.962	50	20	IDGD	
Cn1c(C(C)(C)C)nc2cc(NC(=O)C(=O)NNc3ccc(-n4cccn4)nn3)ccc21	783437175	VPWLWTXPRMCOQO-UHFFFAOYSA-N	433.476	1.928	50	20	IDGD	
Cc1cc(O[C@H](C)c2ccccc2)ccc1NC(=O)C(=O)NNC(=O)C(=O)N1CCCC1	784000131	WTMIRABVIPRXIA-MRXNPFEDSA-N	438.484	1.843	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)C(=O)Nc1cnc2ccccc2c1	784216157	OBJMOJVSIKBXKG-UHFFFAOYSA-N	425.470	1.757	50	20	IDGD	
CC(C)C[C@@H](C(=O)OCC(=O)NNC(=O)c1ccccc1)N1C(=O)[C@H]2CC=CC[C@H]2C1=O	784473563	XGPPYANLUWOCMO-KSZLIROESA-N	441.484	1.357	50	20	IDGD	
COc1c(NC(=O)C(=O)NNc2ccc(F)cc2Br)cccc1C(N)=O	784802219	ARUAORKEBDJODK-UHFFFAOYSA-N	425.214	1.778	50	20	IDGD	
O=C(NNc1cccc(C(F)(F)F)n1)C(=O)Nc1cccc(Cn2cccnc2=O)c1	784952758	QHUIPOWRBCGLMF-UHFFFAOYSA-N	432.362	1.787	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)Nc1ccc(OC)c(S(=O)(=O)N2CCCC2)c1	786131763	VUZWYYNKAWCJTH-UHFFFAOYSA-N	448.501	1.955	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)[C@@H]2CCCN2c2ccccc2)CC1	787887320	BHCRNNXNAFJRJA-SFHVURJKSA-N	444.561	1.130	50	20	IDGD	
CS(=O)(=O)c1cc(NC(=O)C(=O)NNC(=O)Cc2ccc(Cl)cc2)ccc1Cl	788330034	BDWPRFQBPQGUTL-UHFFFAOYSA-N	444.296	1.726	50	20	IDGD	
CS(=O)(=O)[C@@H]1CCCC(=NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)C1	788435616	WCCNGLMHLXBOFR-LJQANCHMSA-N	440.997	1.917	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1nc2c(s1)C[C@@H](C(C)(C)C)CC2	789739491	OWKJCXKDRAVUBE-RYUDHWBXSA-N	426.539	1.432	50	20	IDGD	
Cc1sc2ncnc(N3CCC(C(=O)NNC(=O)CN4CCCC4=O)CC3)c2c1C	789858344	VOOCNKJIXABUHA-UHFFFAOYSA-N	430.534	1.294	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(C(F)(F)F)c(F)c1)C1CCN(c2ncccn2)CC1	790337722	AABJWFOTWFHBQO-UHFFFAOYSA-N	447.414	1.861	50	20	IDGD	
CC(C)C(=O)NNC(=O)C(=O)Nc1cc(Br)cc(C(=O)N2CCCC2)c1	790950951	AARXKXWRRJWHBL-UHFFFAOYSA-N	425.283	1.427	50	20	IDGD	
Cc1cccnc1NNC(=O)C(=O)Nc1ccc(S(=O)(=O)/N=C2\CCCN2C)cc1	792379827	NZXICLXVNWOHOO-LFVJCYFKSA-N	430.490	1.285	50	20	IDGD	
COc1ccc(Cn2cc(NC(=O)C(=O)NNC(=O)Cn3ccc4ccccc43)cn2)cc1	793025043	JKUOBNAFCIFHMN-UHFFFAOYSA-N	446.467	1.681	50	20	IDGD	
CCOC(=O)c1cc(COC)cc(S(=O)(=O)NNC(=O)NCCc2cccs2)c1	793379439	BKOBXADAFDRTIC-UHFFFAOYSA-N	441.531	1.806	50	20	IDGD	
CCOCCCn1c(NNC(=O)[C@H]2COCCN2C2CCCC2)nc2ccccc2c1=O	793498872	PPBZISDXXSIEBD-HXUWFJFHSA-N	443.548	1.910	50	20	IDGD	
O=C(NCCc1cccs1)NNS(=O)(=O)c1ccccc1S(=O)(=O)C(F)F	794581460	MFKNPDORWVNTMN-UHFFFAOYSA-N	439.487	1.480	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)COC(F)F)c1	794740919	JRODBMDXSOOOIX-UHFFFAOYSA-N	429.401	1.496	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)CN2CCC[C@@H](NC(=O)CCCc3ccccc3)C2)cc1	796077475	HVNSYWYSKDVUNT-JOCHJYFZSA-N	447.539	1.923	50	20	IDGD	
Cn1cc(-c2cc(F)ccc2NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)cn1	796999802	OMURMABQAGQUJY-UHFFFAOYSA-N	431.811	1.985	50	20	IDGD	
CCN1CCc2ccc(NC(=O)C(=O)NNC(=O)CNC(=O)OCc3ccccc3)cc21	797368469	BEHPRKBIQQSZBN-UHFFFAOYSA-N	439.472	1.081	50	20	IDGD	
C=CCNC(=S)NNC(=O)CC[C@H]1NC(=O)N(c2ccc(Cl)c(Cl)c2)C1=O	798306542	LGZJIJUIWFIFBG-GFCCVEGCSA-N	430.317	1.880	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C1CCN(C(=O)[C@H](C)CSC)CC1	799721348	CGEJMNLUXUFFOO-CYBMUJFWSA-N	443.591	1.780	50	20	IDGD	
COCC[C@H]1CCCC1=NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	799867618	MCNJJWWZVRLJAW-GOSISDBHSA-N	437.562	1.949	50	20	IDGD	
CC(=NNC(=O)[C@H]1CCS(=O)(=O)C1)c1c[nH]c2ccc(Br)cc2c1=O	799874095	WGPFUZASICYAKS-JTQLQIEISA-N	426.292	1.566	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)N[C@@H]1CCCN(C(=O)Cc2ccccc2)C1	800983474	KESWOBIXHGSMTQ-QGZVFWFLSA-N	428.464	1.769	50	20	IDGD	
C[C@@H](Sc1ccccc1C(=O)OCC(=O)NNC(=O)c1cccc(Cl)c1)C(N)=O	801490461	MBRHYCPQCFBNTF-LLVKDONJSA-N	435.889	1.924	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)S(=O)(=O)N(C[C@@H]1CCCO1)C2=O)Nc1ccccc1	801985922	NYKIJEFPOJLJIE-HNNXBMFYSA-N	444.469	1.477	50	20	IDGD	
O=C(CCC(=O)N1CCN(c2ncccn2)CC1)NNC(=O)Nc1ccc(Cl)cc1	802022340	LWXHEIKDNIKTGE-UHFFFAOYSA-N	431.884	1.412	50	20	IDGD	
N#Cc1ccc(N2CC[C@@H](C(=O)NNC(=O)C(=O)NCc3ccc(Cl)cc3)C2)c(F)c1	804534504	RGAVZICTKPFULB-OAHLLOKOSA-N	443.866	1.641	50	20	IDGD	
CNS(=O)(=O)c1cc(NC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)ccc1F	806544759	LFDVURCPANFANV-UHFFFAOYSA-N	448.436	1.092	50	20	IDGD	
O=C(NNC(=O)c1cccc(Cl)c1)C(=O)Nc1ccc(F)c(N2CCCNC2=O)c1	806973444	BLJZBJOUWTZUGO-UHFFFAOYSA-N	433.827	1.799	50	20	IDGD	
NS(=O)(=O)c1ccccc1CNC(=O)NNC(=O)Nc1ccc(OC(F)F)cc1	807605258	KKBVPGGUEPBOIF-UHFFFAOYSA-N	429.405	1.471	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NN=Cc2ccc(F)c(S(N)(=O)=O)c2)cc1	807946233	GXSABDDJXMYOIW-UHFFFAOYSA-N	448.505	1.658	50	20	IDGD	
Cc1cc(C(F)(F)F)ncc1NC(=O)C(=O)NNC(=O)CN1CCCc2ccccc21	810385649	XFHILOBDEXTTJO-UHFFFAOYSA-N	435.406	1.948	50	20	IDGD	
CC/C=C(\C)C(=O)N1CSC[C@H]1C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	812730385	GUUFDZPMKIOLJZ-XNWJVHIKSA-N	426.564	1.638	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@](C(=O)NNC(=O)C(=O)Nc2ccccn2)(C(F)(F)F)C1	813480680	XEJWJLUXFLWZPB-KRWDZBQOSA-N	445.398	1.357	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)Cc2ccc(F)cc2)cc1)[C@@H]1C[C@H]1C	815567343	VEYZBLZOACWADB-BFUOFWGJSA-N	426.448	1.916	50	20	IDGD	
CNC(=O)c1cc(Oc2cccc(NC(=O)C(=O)NNc3cncc(Cl)n3)c2)ccn1	815586281	DPTZKJAINVAPIZ-UHFFFAOYSA-N	441.835	1.759	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NCCOC)c(C(=O)NNc2ncncc2F)c1	817080679	YBVJCBUVVFNWIM-UHFFFAOYSA-N	440.501	1.461	50	20	IDGD	
Cc1ccc(N2C[C@@H](C(=O)OCC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)CC2=O)cc1	849123349	YUGLHBAFMGQQJL-HNNXBMFYSA-N	440.412	1.261	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)CNS(=O)(=O)c1c(C)c(C)cc(C)c1C	913446113	NIPOUTFVKCEWQP-UHFFFAOYSA-N	449.529	1.434	50	20	IDGD	
Cc1cc(C)nc(-n2nc(C)c(CC(=O)NNC(=O)c3ccc4c(c3)OCCO4)c2C)n1	914463328	VHFBYTOPZWUOSZ-UHFFFAOYSA-N	436.472	1.671	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)NCCC(=O)N2CCCCC2)c2ccccc2c1=O	916437984	SWIOCXUFKNODEK-UHFFFAOYSA-N	428.493	1.324	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NC[C@@H](C)N2CCC[C@H](C)C2)cc1	916450560	SNPMUPVOYHQEHQ-DLBZAZTESA-N	439.582	1.066	50	20	IDGD	
O=C(COC(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2)NNC(=O)c1cccc(Cl)c1	917235233	HKWYPSIWOAINTH-UHFFFAOYSA-N	435.776	1.637	50	20	IDGD	
CC(C)Oc1ncc(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1Cl	917391745	FQGHQASDUFIUCM-UHFFFAOYSA-N	425.898	1.890	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)Cc1c(C)[nH]c(-c2ccncc2)nc1=O	917908265	FRQFBSLKAVJTIB-UHFFFAOYSA-N	437.456	1.308	50	20	IDGD	
O=C(NNC(=O)c1ccc(NC(=O)c2cccc(Br)c2)cc1)C(=O)NC1CC1	918280004	RJSMCIGBEXDZOF-UHFFFAOYSA-N	445.273	1.741	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)N2CCC[C@@H](CS(C)(=O)=O)C2)N(C)c2ccccc21	919843894	OMEBQYVVZXFWCD-MRXNPFEDSA-N	444.557	1.940	50	20	IDGD	
Cc1nn(Cc2ccccc2)c(Cl)c1C(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1	919886614	XUIUEEAGZLFCQZ-ZDUSSCGKSA-N	425.898	1.024	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)N[C@@H]2CCCN(S(C)(=O)=O)C2)c(C)n1C[C@H]1CCCO1	920292077	LPSDMOATFQKZJO-XFVDGSDISA-N	434.562	1.731	50	20	IDGD	
O=C(NNC(=O)c1n[nH]c(C2CC2)c1Br)c1csc(N2CCOCC2)n1	920849265	CFLWWHPPVAGEGW-UHFFFAOYSA-N	441.311	1.418	50	20	IDGD	
CSc1ncc(Br)c(C(=O)NNC(=O)[C@H]2COc3ccccc3O2)n1	1118517883	LUTDLMDEKNIMFZ-LLVKDONJSA-N	425.264	1.562	50	20	IDGD	
Cc1nn(CCO)c(C)c1C=NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	1317993102	NKOJWRUSVMPOPD-UHFFFAOYSA-N	433.534	1.431	50	20	IDGD	
Cc1c(NC(=O)NNC(=O)c2n[nH]c3c2CCCC3)cccc1C(=O)N1CCOCC1	1320410514	CWXPDLBGSCTXNL-UHFFFAOYSA-N	426.477	1.536	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N2CC[C@@](O)(C3CC3)C2)cc1	1321375930	NGFHOHGGBQVFQQ-CZKPLACNSA-N	449.511	1.714	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCC(=NNC(=O)c3n[nH]c4c3CCCC4)CC2)cc1	1321993616	WJKANRMGPOLJKK-UHFFFAOYSA-N	431.518	1.868	50	20	IDGD	
O=C(c1ccc2c(c1)COC2)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1777914547	HXUACLIBHOSLEQ-CRAIPNDOSA-N	427.270	1.851	50	20	IDGD	
Nc1c(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](F)Cl)C2)sc2nccnc12	1778023081	PZHQSEXQUZZCDC-MAZCYNQFSA-N	441.916	1.935	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H]3C[C@@H](O)C3)C2)C1	1778134916	ALTQRQQKFIWDDV-GNNUVBFBSA-N	431.439	1.473	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](C)n3ccccc3=O)C2)C1	1779265571	WVXURZIYMLZVJQ-CLCXKQKWSA-N	440.338	1.270	50	20	IDGD	
C=CC[C@H](C(=C)C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)C2	1779275993	OKEJVRHIEWVDTG-DNVFCKCGSA-N	434.581	1.642	50	20	IDGD	
CC(C)NC(=O)OC(C)(C)C(=O)N1CCO[C@]2(CCN(C(=O)CO[Si](C)(C)C)C2)C1	1779300062	MGJMYIKHDNBAHP-FQEVSTJZSA-N	443.617	1.581	50	20	IDGD	
CC(=O)c1cc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CO[Si](C)(C)C)C2)n[nH]1	1779540857	XOVYTRDDONKQNT-YLJYHZDGSA-N	436.585	1.591	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2n[nH]cc2[N+](=O)[O-])C1	1779600155	SWGGZALLLIMYLG-WPKBUWHJSA-N	427.889	1.853	50	20	IDGD	
COc1ccnc(C(=O)N2CC[C@@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)c1OC	1780448060	SEGFLLXVVHWOKX-HXUWFJFHSA-N	425.913	1.807	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)CC(=O)Nc3ccc(F)cc3)C2)C1	1780883988	RKDKRUZMOCHLOH-OXJNMPFZSA-N	441.887	1.238	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H]3CCN3C(=O)OC(C)(C)C)C2)C1	1781016830	IHEBZVPARNZKHI-BXTJHSDWSA-N	429.945	1.843	50	20	IDGD	
C#CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](Cl)CC)C2)C1	1781223284	KSUIHAVLAIXWHF-CKJXQJPGSA-N	441.956	1.750	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3cccc4ccoc34)C2)C1	1782447904	IEXCVRDCVJTLPD-HSZRJFAPSA-N	449.467	1.189	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccccc3C(N)=O)CCO2)C1	1783351553	BVNOIWFIGPAMMF-BEFAXECRSA-N	438.322	1.403	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccc4c(c3)CC(=O)N4)CCO2)C1	1783533753	GZMNMRBMPHVVGU-HXPMCKFVSA-N	436.306	1.408	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cccc(-c4cnccn4)c3)CCO2)C1	1783883677	XTYRVQSYCNSYRM-PGRDOPGGSA-N	444.919	1.841	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(C(=O)OC)cc3C)CCO2)C1	1783885377	ZOZUCEZUFAVQQD-UWJYYQICSA-N	438.908	1.479	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1ccnc(C(C)(C)C)c1)CCO2	1783936359	MFQPNNNIACAUCU-QHCPKHFHSA-N	445.564	1.196	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4cc(F)c(F)cc4[nH]3)C[C@@H]21)[C@H](O)CCl	1784092058	GNEISISOLYMUPN-DWMWJDLSSA-N	441.862	1.639	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3Cc4ccccc4CN3C)[C@H]2C1	1785024391	KEBZKFWQDVZXHQ-WHZJULEDSA-N	449.979	1.277	50	20	IDGD	
CC(C)[C@H](O)C(=O)Nc1ccc(C2(NC(=O)c3cnccc3C(=O)NN)CCC2)cc1	1786191708	MBPGYLZPYQFIFC-SFHVURJKSA-N	425.489	1.450	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(O)cc3F)C[C@@H]21	1786408794	APZORLDQCHVADR-PJODQICGSA-N	429.286	1.910	50	20	IDGD	
CCn1ccc(C(=O)Nc2ccc(C3(NC(=O)c4cccc(B(O)O)c4)CCC3)cc2)n1	1787500250	VJNBQGQVLNHFAK-UHFFFAOYSA-N	432.289	1.644	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4nonc4c3)[C@H]2C1	1787882780	WLADRDSMSSWRCN-LESCFKLSSA-N	437.294	1.600	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)COCc3ccccc3)C[C@@H]21)[C@@H](F)Br	1789922480	KWGBJLGUGGHQLL-NBOOPKSLSA-N	443.313	1.873	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3[nH]nc4ncccc34)C[C@@H]21	1791058030	WMLCMVXBXJEDLC-IMIFBBOLSA-N	436.310	1.335	50	20	IDGD	
CCC1(C(=O)Nc2ccc(C3(NC(=O)c4cnccc4C(=O)NN)CCC3)cc2)COC1	1791172586	OGXCWJVNEXWSCA-UHFFFAOYSA-N	437.500	1.859	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3cc(F)ccn3)C[C@@H]21	1791252393	JLVYSWAHPVBBKC-MGHWNKPDSA-N	427.904	1.387	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3nn[nH]c3c1)C2	1792871844	AGWZDSAYVRHKOU-VFFTVRQLSA-N	436.310	1.192	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1C[C@@H]1c1ccc(F)cc1)c1ccc(B(O)O)cc1	1792910600	YWADVTCRFXBBCC-YHINDDMVSA-N	436.292	1.561	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCCC(=O)OC(C)(C)C	1793023595	JCCAGDSPAZXEEX-BASYENTBSA-N	432.945	1.342	50	20	IDGD	
O=C(Cc1noc2ccccc12)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2	1795765754	MPIBUBCCMXJLSV-ZWUPXRALSA-N	440.269	1.650	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cn2cccnc2n1	1797389714	GDZIVIOZNCZJSR-JPVZDGGYSA-N	426.304	1.169	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnn3cccc(F)c13)C2)[C@@H](F)Br	1799346936	JDYYLVPTQIHULJ-YJKIEOBBSA-N	443.248	1.367	50	20	IDGD	
C[C@H](Nc1nccs1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Br	1799347576	QFSMBMAQIVJKLM-SVNGYHJRSA-N	435.319	1.224	50	20	IDGD	
C/C(=C\c1cccnc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Br	1799351780	AKYNBPLZMKNMLV-FLUJKDTBSA-N	426.286	1.765	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)c1c(F)cc(Cl)cc1Cl	1799666276	GNBCZSWPBZTJRS-YPSFTXJRSA-N	439.698	1.935	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(F)cc1F	1799751492	KUYJPHPBFBDPRO-BTTYYORXSA-N	429.427	1.529	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1[nH]nc2c(Cl)cccc12)[C@H](O)CCl	1799844375	JHGIAKXGIHPFCR-AZKPJATDSA-N	425.316	1.997	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1(N2CCN(C)CC2)CC1	1799977305	BZESIGZTVCNTLQ-YYIAUSFCSA-N	441.414	1.578	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cn(C)nc1C(F)F)C2	1800640610	BJXNSHYSIHPAOI-LFSVMHDDSA-N	449.296	1.734	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1CCN(c2ccc(F)cn2)CC1)[C@H](O)CCl	1801368745	NOOQTGSHVZLRJZ-XMTFNYHQSA-N	438.931	1.675	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)c1ccccc1Cl	1802695894	ZGNWWDJICFMQMH-IGMJJTELSA-N	436.940	1.385	50	20	IDGD	
C[C@H](Sc1ccccn1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(B(O)O)cc1)C2	1802889760	NFCUJAQWVFHLQM-FZDIXFNVSA-N	439.346	1.194	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1CCN(C(=O)c2ncn(C)n2)[C@@H]1c1cccnc1	1803008169	HJWXWEKRWKQDHC-VHDGCEQUSA-N	435.326	1.561	50	20	IDGD	
COc1ncccc1CCC(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]1c1cccnc1	1803141597	PXOKHTADWBJNKR-WSTZPKSXSA-N	446.935	1.724	50	20	IDGD	
COc1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)ccc1F	1803591694	POISEERQBXADLD-BCDXTJNWSA-N	426.253	1.080	50	20	IDGD	
Cc1ccc(C(=O)NC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)o1	1803788782	KXIOESNZFGGRGP-UWJYYQICSA-N	427.505	1.676	50	20	IDGD	
O=C(CCBr)NC[C@H]1CCN(C(=O)CN2CCOC2=O)[C@@H]1c1cccnc1	1806341882	HWJAUYALENAZRG-RHSMWYFYSA-N	439.310	1.325	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@H](CNC(=O)Cn2cncn2)[C@H]1c1cccnc1	1807603958	ZKUQHTFUAPKXGZ-LESCRADOSA-N	425.320	1.615	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)c1ccc2c[nH]nc2c1	1808049993	ZAXCERLPCXHXQW-WDSOQIARSA-N	427.892	1.877	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1CCN(C(=O)[C@@H]2C[C@H](O)CN2)[C@H]1c1cccnc1	1808306143	ZJMGQFQDVJMRMB-GMHRPJKWSA-N	429.348	1.047	50	20	IDGD	
Cc1nc(CC(=O)N2CC[C@H](CNC(=O)[C@@H](F)Br)[C@H]2c2cccnc2)no1	1808650655	BUWVZPITLILNNS-DAXOMENPSA-N	440.273	1.712	50	20	IDGD	
CC(=O)NCCC(=O)N1CC[C@H](CNC(=O)[C@H](F)Br)[C@@H]1c1cccnc1	1808678334	HPFSCFSNLGQJDH-KBMXLJTQSA-N	429.290	1.304	50	20	IDGD	
Cc1[nH]ccc1C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1	1808751081	HBHFOWYMPJIOGI-OXJNMPFZSA-N	447.499	1.350	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)[C@H](O)Cc1ccccc1	1812769411	XXIPGRPBBKJYBO-MTQWCTHYSA-N	431.920	1.291	50	20	IDGD	
C[C@H](CBr)C(=O)Nc1cc([C@H]2CCCCN2C(=O)Cn2cnnn2)[nH]n1	1814780042	FDXFPGZXRQXQKF-ZYHUDNBSSA-N	425.291	1.120	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(=O)n4[nH]cnc4n3)sc2C1	1815330164	MIWDQGZBGPCGQY-BDAKNGLRSA-N	435.897	1.117	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](O)C(C)C)CC2	1817276572	VIFNDWRQZFIFJU-FAUFNCHLSA-N	446.533	1.206	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)C[C@H]2CCCCO2)[nH]n1)c1cccc(B(O)O)c1	1817473803	AQIMRPKTQIVQTN-IEBWSBKVSA-N	440.309	1.355	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)C23CC(F)(C2)C3)[nH]n1)c1cccc(B(O)O)c1	1817474395	QZWYSBOTFIFCFH-ATIQYGATSA-N	426.257	1.288	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)CCc3nc(N)n[nH]3)sc2C1	1819552164	QOWAOISNZUJYDJ-VHSXEESVSA-N	425.946	1.796	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCBr)CC2	1819684615	JDLAICIOKQJAPX-NXEZZACHSA-N	446.371	1.548	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccco1)CC2	1819795190	JQWLGDWQCVPUMH-JTQLQIEISA-N	426.458	1.274	50	20	IDGD	
Cc1cnc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)s1	1825692820	SPFFPQVRSMKMPI-IBGZPJMESA-N	441.362	1.678	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)Cc1c(C)nn(C)c1C)CC2	1826009157	MKGUDLUZUKPFKE-JSGCOSHPSA-N	439.969	1.902	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H]1C[C@@]1(F)Cl)CC2	1826090135	WPQYIODXFCNAKP-KEYDSSBGSA-N	431.921	1.353	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2CCC=CO2)CC1	1828891907	BAWHHVDINJXQAI-SFTDATJTSA-N	426.322	1.292	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)CN)C2)C1	1829221864	YSRVHDUBTHUTFV-DYESRHJHSA-N	436.940	1.415	50	20	IDGD	
Cc1nc(C)c(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)o1	1829295051	RXVQADLIBICZFS-FQEVSTJZSA-N	439.321	1.518	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@H](C)NS(=O)(=O)CC)CC1	1830302878	JXNLGYOGCPKBCC-XIRDDKMYSA-N	436.018	1.951	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3cnc4ccccn34)CCO2)C1	1830663858	NQVFXCSIHKVAKZ-UTKZUKDTSA-N	434.924	1.351	50	20	IDGD	
CC(C)[C@H](S)C(=O)N1CCC([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1	1831871981	YEZCUBJDJNXWOL-XLIONFOSSA-N	426.627	1.934	50	20	IDGD	
Cc1nccnc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1	1831873810	ZBCVSPQFMMLITG-SFHVURJKSA-N	430.553	1.391	50	20	IDGD	
O=C([C@@H](O)CCl)N1CCC([C@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)CC1	1832896423	HVLZEPWUSPLLBK-KGLIPLIRSA-N	448.010	1.066	50	20	IDGD	
CNC(=S)NCCC(=O)N1CCC(N2CCC(NC(=O)C(C)(C)CCl)CC2)CC1	1833214840	RLAZKWFMISWBOT-UHFFFAOYSA-N	446.061	1.307	50	20	IDGD	
CC[C@H](C)[C@@H](N)C(=O)N1CCC(N2CCC(NC(=O)[C@H](C)CBr)CC2)CC1	1833261961	FGXGSSCPNJPHIY-HDMKZQKVSA-N	445.446	1.962	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)Cc3noc4ccccc34)CC2)CC1)[C@H](O)CCl	1833310953	YPVRFELTWFHVRV-LJQANCHMSA-N	448.951	1.542	50	20	IDGD	
C[C@@H](Oc1cccnc1)C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)CCl)CC2)CC1	1833313095	VIKRXDNKOWGWLU-DNVCBOLYSA-N	438.956	1.020	50	20	IDGD	
Cc1cc(C(=O)NC2CCN(C3CCN(C(=O)CCBr)CC3)CC2)on1	1834207753	LANWICZMVUYUNF-UHFFFAOYSA-N	427.343	1.953	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(F)cn1)CCO2	1834477119	FXKVVEMBXMCTEW-IBGZPJMESA-N	425.533	1.142	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnc(OC)c(C)c3)CCO2)C1	1834574414	DEEVVKVILJNSFD-UWJYYQICSA-N	439.940	1.876	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)COC(=O)C(F)(F)F)CC2)CC1)[C@@H](F)Cl	1835080579	PTLMGFXIQFMLKT-CYBMUJFWSA-N	431.814	1.198	50	20	IDGD	
C[C@@H](Oc1cccnc1)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](F)Cl)CC2)CC1	1835082725	DGIWOLZAQDJVDW-RDTXWAMCSA-N	426.920	1.955	50	20	IDGD	
O=C(C(Cl)Cl)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CNc3ccccc31)CCO2	1835723067	QASNWHIUNJPACU-IFXJQAMLSA-N	428.316	1.456	50	20	IDGD	
C[C@@H](Cn1cccn1)C(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836715737	YLZGKDBMOZVPIY-MAUKXSAKSA-N	426.945	1.118	50	20	IDGD	
Cn1nccc1C(=O)N1CCC(OC2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1837488488	XSSXRHDAHVWECC-OAHLLOKOSA-N	431.306	1.723	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(C(C)(C)C)n[nH]3)CCO2)C1	1837991425	KSAJFGMBIQICLJ-VBKZILBWSA-N	426.945	1.795	50	20	IDGD	
O=C(COC(=O)C(F)(F)F)N1CCC(OC2CCN(C(=O)[C@@H](F)Cl)CC2)CC1	1838082331	GFYMEAPRSJKPDK-CYBMUJFWSA-N	432.798	1.625	50	20	IDGD	
Cc1nc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)sc1C	1838412117	VGGVYLFZWXRQFY-APPDUMDISA-N	446.367	1.613	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)c3cc[n+]([O-])cc3)CC2)CC1	1838510896	MGWLVTHWVSYGAT-AWEZNQCLSA-N	440.338	1.716	50	20	IDGD	
O=C(c1ccnnc1O)N1CCC(OC2CCN(C(=O)[C@H](F)Br)CC2)CC1	1838514127	FBUBLQMVZUOXJL-AWEZNQCLSA-N	445.289	1.485	50	20	IDGD	
COC(=O)NCC(=O)N1CCC(OC2CCN(C(=O)[C@](C)(Cl)CCl)CC2)CC1	1838638473	YLTIUOFPECQSJK-GOSISDBHSA-N	438.352	1.577	50	20	IDGD	
C[C@@H](C(=O)N1CCC(OC2CCN(C(=O)[C@@H](C)Br)CC2)CC1)n1cncn1	1838773547	NQUIDVCNXJRLAM-KGLIPLIRSA-N	442.358	1.621	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)cc1	1838967297	VWBDGBCPOYVJPN-YJBOKZPZSA-N	445.285	1.456	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(F)cc3F)CCO2)C1	1839006859	WIXGPQSZCJZBMZ-DNVCBOLYSA-N	432.851	1.289	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CC34CCCN3CCC4)CCO2)C1	1839118815	QWBOQIJPHAMHQU-LAUBAEHRSA-N	427.973	1.479	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)CBr)C2)C1	1839141349	GBFASUPYKPBMBR-HEHGZKQESA-N	425.751	1.491	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3Cc4ccccc4CN3)C2)C1	1839144523	CVGBGZCWBKQZEL-XQBPLPMBSA-N	435.952	1.175	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1	1840034093	AEQMCKGERRIDIX-NILFDRSVSA-N	446.169	1.463	50	20	IDGD	
O=C(Cc1cccc([N+](=O)[O-])c1)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840187200	MEAGDHFLEDTTBB-SFHVURJKSA-N	446.287	1.397	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](O)[C@](C)(C(=O)N2CCCC23CN(C(=O)[C@H](F)Cl)C3)C1	1841030574	KOWJTCOTHZOTPO-CKFHNAJUSA-N	447.935	1.732	50	20	IDGD	
O=C1CC(C(=O)N2CCCC23CN(C(=O)[C@@H](Br)Cc2ccccc2)C3)=NN1	1844224519	BSNOQQSRUPADMJ-AWEZNQCLSA-N	433.306	1.072	50	20	IDGD	
O=C(c1c[nH]c2ncc(C(F)(F)F)cc12)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl	1847564258	WGNVHMURFSJUEP-IHRRRGAJSA-N	430.814	1.997	50	20	IDGD	
Nn1c(SCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)nnc1-c1ccccc1Cl	8647012	KGODRPUEPKIKFD-UHFFFAOYSA-N	447.864	1.774	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@H]2COc3ccccc3O2)c([N+](=O)[O-])cc1OC(F)F	11776667	FHQKXDMCSIGUKY-OAHLLOKOSA-N	439.327	1.806	50	20	IDGD	
CCOc1cc([N+](=O)[O-])c(C(=O)NNC(=O)c2n[nH]c(=O)c3ccccc23)cc1OC	15720051	SUCUIBUTNSPKEB-UHFFFAOYSA-N	427.373	1.313	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(Cl)c([N+](=O)[O-])c1)c1csc(N2CCOCC2)n1	16098532	FCKBNUVBBJCNDE-UHFFFAOYSA-N	447.882	1.165	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)c1ccc(S(=O)(=O)N(C)OC)cc1	27267659	SLMWZTLOFCNNBL-UHFFFAOYSA-N	427.866	1.605	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc3c(O)[nH]c(=S)nc3c2)c1	46659983	GWWXYYRVTMBTPM-UHFFFAOYSA-N	447.498	1.323	50	20	IDGD	
CCn1c(S)nc2cc(C(=O)NNC(=O)[C@@H]3COc4ccccc4O3)ccc2c1=O	103437315	LBMJVOMXGFTGKV-INIZCTEOSA-N	426.454	1.306	50	20	IDGD	
COCCCNC(=S)N(C)NC(=O)CNS(=O)(=O)c1c(Cl)cccc1Cl	726076294	XXXQKVHINMKFFF-UHFFFAOYSA-N	443.378	1.146	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)NCC(=O)N3CCc4ccccc4C3)n[nH]2)cc1	726715591	RRTLTRRRCADJMW-UHFFFAOYSA-N	432.484	1.914	50	20	IDGD	
CC(C)c1ccccc1NC(=S)NNC(=O)[C@H]1CC(=O)N(CCN2CCOCC2)C1	727172482	GKNUWXVQFXBJKP-INIZCTEOSA-N	433.578	1.308	50	20	IDGD	
Cc1cc(C)nc(SCc2ccc(C(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)cc2)n1	727943003	TVJCTSGPOZLTRG-MRXNPFEDSA-N	434.543	1.581	50	20	IDGD	
CC(C)[C@@H](C(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)S(=O)(=O)C1CCCCC1	728512157	MKAZPMNFXAOJII-SFHVURJKSA-N	448.545	1.467	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)Cc3cccnc3)c2)cc1	728893704	QKDKJUDQLZCITL-UHFFFAOYSA-N	440.481	1.895	50	20	IDGD	
COC(=O)c1ccc(CCNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1	728944235	QINMXLQALASJMR-UHFFFAOYSA-N	426.477	1.053	50	20	IDGD	
COCC(=O)NC1CCN(C(=O)NNC(=O)c2ccc(Br)cc2Cl)CC1	728956323	RDJSFJFSGKYARR-UHFFFAOYSA-N	447.717	1.684	50	20	IDGD	
CCCOc1ccc(CNC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cn1	730907610	GMCVSQWBPMVRTC-UHFFFAOYSA-N	440.548	1.913	50	20	IDGD	
C[C@@H]1CCCCN1CCOc1ccccc1C(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1	731186531	OTZCBQHHXVYYCE-CVEARBPZSA-N	438.550	1.071	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)NCC(C)(C)NS(C)(=O)=O)cc1OC	731686682	KQBBESMZHXRGSI-UHFFFAOYSA-N	430.527	1.146	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)c2ccc(F)cc2I)C[C@@H](C)O1	732263466	MXXJPWAZSFFJME-GHMZBOCLSA-N	449.264	1.691	50	20	IDGD	
CC1(C)C[C@H]1CNC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	732892434	BVCAXIJFXMMNON-INIZCTEOSA-N	438.550	1.017	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)/C(=C\c1cccnc1)NC(=O)c1ccccc1	733123986	MZWTWRBRBLNGQC-DILWRCETSA-N	444.447	1.840	50	20	IDGD	
C[C@H](CNC(=O)CCC(=O)C(C#N)=C1N(C)c2ccccc2N1C)CN1CCN(C)CC1	733882182	DMCLWHLUXLMARF-GOSISDBHSA-N	438.576	1.657	50	20	IDGD	
Cc1nn(C)c(C)c1C(=NNC(=O)Cc1csc(N2CCOCC2)n1)C(F)(F)F	733907458	PYFCENNCEXLZBQ-UHFFFAOYSA-N	430.456	1.955	50	20	IDGD	
O=C(C[C@@H]1SC(N2CCCC2)=NC1=O)Nc1ccc(C(=O)NNc2cnccn2)cc1	734242527	JNIVEBWVURJYBB-HNNXBMFYSA-N	439.501	1.656	50	20	IDGD	
CC(=O)N1CCCc2ccc(S(=O)(=O)NNC(=O)c3c(C)nc4ccccn34)cc21	736063551	KUGRFTIQUNYEKF-UHFFFAOYSA-N	427.486	1.565	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N1CCS(=O)(=O)C[C@H]1C	740026486	YJCRDSFVFTXDFO-GHMZBOCLSA-N	434.312	1.076	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)CCC(=O)C(C#N)=C1N(C)c2ccccc2N1C	740851712	RXWWBQUBTYGWOK-UHFFFAOYSA-N	440.504	1.109	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)C[C@H](NC(C)=O)c1ccc(Br)cc1	740852676	HZHQABLMFUOECU-HNNXBMFYSA-N	441.326	1.469	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)COc1ccccc1F)[C@H]1CN(Cc2ccccc2)CCO1	741266313	JDXAQVNQPCYFTQ-OXQOHEQNSA-N	430.480	1.824	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)CCN2C(=O)[C@H]3[C@H]4CC[C@@H](O4)[C@@H]3C2=O)c1	742470968	YPPMQCYKWMNLBV-RFZJPIJTSA-N	443.500	1.197	50	20	IDGD	
O=C1COc2ccc(S(=O)(=O)NNC(=O)c3cccc(Br)c3)cc2N1	743264067	OFOYLHIKWQRLJL-UHFFFAOYSA-N	426.248	1.403	50	20	IDGD	
NC(=O)c1ccc(N2CCN(C(=O)NNC(=O)c3cccc(Br)c3)CC2)cc1	743688381	WQIBVFQKQZUXSY-UHFFFAOYSA-N	446.305	1.725	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)CCn2cnc3ccccc3c2=O)cc1	743830991	OERJTCRQGOIQHW-UHFFFAOYSA-N	429.458	1.043	50	20	IDGD	
CCc1ccc(N2C[C@H](C(=O)NNC(=O)Nc3ccc(S(C)(=O)=O)cc3)CC2=O)cc1	743831255	UGOUCLFHIGERFK-OAHLLOKOSA-N	444.513	1.858	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)c1ccccc1F)C(=O)NNC(=O)NC1CCCC1	744052739	QTEAAXDNDNIAGR-AWEZNQCLSA-N	432.543	1.499	50	20	IDGD	
CC(C)NC(=O)NNC(=O)c1ccc(Cl)c(S(=O)(=O)N2C[C@H](C)O[C@@H](C)C2)c1	745146341	LULZXWKMGMVSNI-RYUDHWBXSA-N	432.930	1.490	50	20	IDGD	
Cn1ccc(N2CCC[C@H](NC(=O)NNC(=O)CCSc3ccc(F)cc3)C2=O)n1	745882854	KCXIBPULGKDFRX-HNNXBMFYSA-N	434.497	1.567	50	20	IDGD	
COC(=O)[C@H]1CCC[C@@H](C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)C1	746093635	RMRLPPCQSFBAOE-ZBFHGGJFSA-N	437.518	1.212	50	20	IDGD	
Cc1c(C(=O)NNC(=O)NC2CCCCC2)cc(Br)cc1S(N)(=O)=O	747345988	SQRXEYRZAKVAEW-UHFFFAOYSA-N	433.328	1.682	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCCCCC2)cc1C(=O)NNc1nccn(C)c1=O	747941402	CUXWWZHWZBCEHM-UHFFFAOYSA-N	435.506	1.111	50	20	IDGD	
C[C@H](NS(=O)(=O)c1ccc(C(N)=O)cc1)C(=O)NNc1cccc(Br)c1	748032521	KONXOMMLVLNIGR-JTQLQIEISA-N	441.307	1.358	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@](F)(C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)C1	748209786	LPGVGHZDWGSUNH-HXUWFJFHSA-N	434.424	1.212	50	20	IDGD	
C[C@@]1(c2ccc(C(=O)NNC(=O)c3ccc(F)cc3Br)cc2)NC(=O)NC1=O	748523420	BFHPZEVKUZLFES-SFHVURJKSA-N	449.236	1.718	50	20	IDGD	
CCS[C@H]1CCC[C@@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)C1	748964759	CSPDNCCZZSJVOK-CABCVRRESA-N	428.580	1.945	50	20	IDGD	
COc1cc(N2C[C@@H](C(=O)NNC(=O)CCc3ccccc3)CC2=O)cc(OC)c1OC	749801192	XFTPKGOVSUIEJQ-INIZCTEOSA-N	441.484	1.846	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(N2CCCS2(=O)=O)cc1)c1cc2ccccc2o1	749867430	WWXNRPIHOJUXOZ-UHFFFAOYSA-N	435.483	1.596	50	20	IDGD	
CCn1c(SCC(=O)NNC(=O)CNC(=O)c2ccco2)nnc1-c1ccccc1C	751207575	ZFDMAYSYLZDIEB-UHFFFAOYSA-N	442.501	1.536	50	20	IDGD	
CCOc1ccc(NC(=S)NNC(=O)c2cc(S(=O)(=O)N(C)C)c(C)o2)cc1	754013262	AHCIFAPPFGKRKU-UHFFFAOYSA-N	426.520	1.868	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2cccc(N(C)C)n2)c1	755097083	DHWBDTFVJKUJPA-UHFFFAOYSA-N	448.549	1.322	50	20	IDGD	
CSC[C@H](C(=O)NNc1ccc(C(F)(F)F)nn1)N1C(=O)[C@@H]2CCCC[C@H]2C1=O	755191544	IQZOAPPJZLBHMK-GMTAPVOTSA-N	431.440	1.845	50	20	IDGD	
CCOC(=O)[C@@H](NCC(=O)NNC(=O)c1cc(Cl)ccc1OC)C1CCOCC1	755194700	YBCISPFITSPSTM-KRWDZBQOSA-N	427.885	1.058	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NN=C(C)c1nccn1C)N(S(C)(=O)=O)CC2	755572632	OKFKVXBIUBFVKD-INIZCTEOSA-N	449.533	1.227	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2ccc(N(C)C)c(C)c2)cc1	755743396	FZPRAXUWXAHNDP-UHFFFAOYSA-N	433.534	1.843	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NC[C@@H]2CSCCS2)c2ccccc2c1=O	756058489	AQNPZQUEJOEIJS-CYBMUJFWSA-N	435.575	1.989	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCC[C@H]2Cn2c(C)nc3ccccc32)n1	756625478	NYQSAYFDSDCPEL-INIZCTEOSA-N	426.546	1.964	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(F)c(NC(=O)NNC(=O)COc2ccc(Cl)cc2)c1	756686234	USDOKGRUDNXLIU-UHFFFAOYSA-N	444.872	1.961	50	20	IDGD	
COC(=O)c1cc(NC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c(OC)c(OC)c1	756743421	UJUQVGZHOHBIJM-INIZCTEOSA-N	431.401	1.483	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)c2ccc(C(=O)NC3CC3)cc2)CC1	757004002	LONLLHDMVGEVDY-UHFFFAOYSA-N	445.520	1.922	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2c(OC)ncnc2N(C)C)cc1Br	757709653	UCXVIIAGOGLPDO-UHFFFAOYSA-N	439.270	1.789	50	20	IDGD	
C[C@H]1C[C@@H](NC(=O)NNC(=O)c2csc(N3CCOCC3)n2)CN1Cc1ccccc1	757722122	JPHADHFSPGWWLD-DOTOQJQBSA-N	444.561	1.587	50	20	IDGD	
Cc1nn([C@H]2CCS(=O)(=O)C2)c(C)c1NC(=O)NNC(=O)Cc1c[nH]c2ccccc12	757872010	RYVWLYKZQAEAHD-HNNXBMFYSA-N	444.517	1.736	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)N[C@@H]2CCCS(=O)(=O)C2)c2ccccc2c1=O	758657050	FIZVIPGPLHVTBW-CQSZACIVSA-N	449.533	1.108	50	20	IDGD	
O=C(NNC(=O)c1ccc(I)c(Cl)c1)C(=O)Nc1ccccn1	758832427	GPOACDUINLHQKP-UHFFFAOYSA-N	444.616	1.739	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NC[C@H]1CC(=O)N(Cc2ccccc2)C1	759684633	VQHHYDJTBFXAAL-DOTOQJQBSA-N	428.464	1.972	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)c2ccc(Br)cc2-n2cncn2)cc1	760123515	NKSGFDOLSOWHLY-UHFFFAOYSA-N	445.277	1.912	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC2(CC1)CC(C(=O)NNC(=O)c1ccc(C#N)cc1)=NO2	760212874	MYHXZZAYHIIASP-UHFFFAOYSA-N	427.461	1.865	50	20	IDGD	
C=CCNc1ncc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)s1	761713593	RZJFWPQEAHPNAG-UHFFFAOYSA-N	435.531	1.600	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)c2ccc(OC)c(I)n2)nc1	762074752	AUOLQXQMFGCEQH-UHFFFAOYSA-N	428.186	1.633	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)c2cc(Cl)ccc2-n2cnnn2)n[nH]1	763156476	YZDLSRFGLWKRQM-UHFFFAOYSA-N	438.835	1.789	50	20	IDGD	
O=C(NNC(=O)c1cccnc1)C(=O)Nc1cccc(C(=O)N2CCc3ccccc32)c1	763492346	XABRTSZDYZODSQ-UHFFFAOYSA-N	429.436	1.684	50	20	IDGD	
CN(Cc1ccccc1NC(=O)C(=O)NNC(=O)c1cccnc1)C(=O)OC(C)(C)C	763494402	CBSUJNQFBJNMOG-UHFFFAOYSA-N	427.461	1.848	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)C(=O)Nc1ccc(F)cc1OCC(F)(F)F	763551222	LELJHKVEHLJKPM-UHFFFAOYSA-N	443.309	1.895	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(C(=O)NC(C)(C)C)cc2)c1	763623431	MBAIQHMJLNAQJL-UHFFFAOYSA-N	426.473	1.688	50	20	IDGD	
COc1cc(C)ccc1NC(=O)C(=O)NNC(=O)COc1ccc(Br)cc1	763693857	BVGICXXHENNPTR-UHFFFAOYSA-N	436.262	1.931	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2ccnn2CCc2ccccc2)c1	763775915	YMZYAOOQWWQIPK-UHFFFAOYSA-N	437.456	1.543	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)C(=O)Nc1cccc(CCN2CCCC2)c1	763789745	AOBWKAYEHKFKNQ-UHFFFAOYSA-N	448.483	1.373	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(-c3n[nH]c(C4CC4)n3)cc2)cc1	763820878	LIZDTWOBTDBMKW-UHFFFAOYSA-N	434.456	1.822	50	20	IDGD	
Cc1cc(Br)ccc1SCC(=O)NNC(=O)CNC(=O)c1cccnc1	763823388	AKXGQICKQDKFCM-UHFFFAOYSA-N	437.319	1.822	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cccnc2OCC(F)F)c1C	763840386	KJCDRRJUCOGZCB-ZDUSSCGKSA-N	436.415	1.896	50	20	IDGD	
CNC(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc3ccccc3c2)cc1	763852423	IPWNADYINLTFQK-HNNXBMFYSA-N	448.479	1.682	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1cccc(C(=O)NC2CC2)c1	763873025	RLZMSEYQPNTOQW-GFCCVEGCSA-N	428.420	1.271	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(C(=O)OC)ccc2Cl)cc1OC	763901010	KHWXFAXMMQCHLT-UHFFFAOYSA-N	449.847	1.934	50	20	IDGD	
O=C(NNC(=O)c1ccc(Br)s1)C(=O)Nc1cnn(CC(F)(F)F)c1	763942156	WIPQEVKTAPQAEE-UHFFFAOYSA-N	440.201	1.669	50	20	IDGD	
CC(C)CCn1nccc1NC(=O)C(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	763945317	WNRQVMQVMCKFQS-UHFFFAOYSA-N	425.449	1.220	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)CCN2C(=O)c1cccnc1	763958436	VGPCAYMJKPHANQ-UHFFFAOYSA-N	443.463	1.993	50	20	IDGD	
O=C1CN(c2ccc(NC(=O)C(=O)NNC(=O)Cc3cccc4ccccc34)cc2)CCN1	764026164	ABMAFXNFCKVKHZ-UHFFFAOYSA-N	445.479	1.105	50	20	IDGD	
CNS(=O)(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3c2)ccc1C	764062337	XHWVSWOJKPWJJD-UHFFFAOYSA-N	440.481	1.456	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3ccc(Cl)nc3)cn2)C[C@H](C)O1	764100244	KIFLLWDDAHGMHM-RYUDHWBXSA-N	432.868	1.143	50	20	IDGD	
O=C(CCc1ccco1)NNC(=O)C(=O)Nc1ccc(-n2nccn2)cc1C(F)(F)F	764169391	OPEDYSNXYUIQPX-UHFFFAOYSA-N	436.350	1.598	50	20	IDGD	
CN1CCC(N(C)c2ccc(NC(=O)C(=O)NNC(=O)c3ccc(C#N)cc3)cc2)CC1	764183269	WFPDLLUOJOJUBY-UHFFFAOYSA-N	434.500	1.488	50	20	IDGD	
CCCCN(C)S(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)CC(C)(C)C)cc1	764202064	KELCECSFNNJXIQ-UHFFFAOYSA-N	426.539	1.629	50	20	IDGD	
O=C(NNC(=O)c1cccc2ncccc12)C(=O)Nc1ccc(=O)n(Cc2ccccc2)c1	764252727	KSICUQSFWHXREY-UHFFFAOYSA-N	441.447	1.845	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)C(=O)Nc1ccc(C(=O)NCc2ccc(F)cc2)cc1	764268925	YHFSLFMLRMYNLI-UHFFFAOYSA-N	449.442	1.479	50	20	IDGD	
Cc1nc(-c2cccc(NC(=O)C(=O)NNC(=O)COc3ccccc3O)c2)cs1	764275524	MWFMKWFHPZZSFN-UHFFFAOYSA-N	426.454	1.989	50	20	IDGD	
Cc1cc(C(=O)N2CCC[C@@H](C)C2)ccc1NC(=O)C(=O)NNC(=O)c1c[nH]nc1C	764296600	BJRKURRKALCRHW-GFCCVEGCSA-N	426.477	1.298	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C(=O)Nc1ccc(N2CCOCC2)c(F)c1)c1ccccc1	764332602	UZPMGHVAGINVGU-KRWDZBQOSA-N	428.464	1.942	50	20	IDGD	
CCOC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)cc1	764348957	FEPKCFZNBQDQFB-UHFFFAOYSA-N	435.820	1.387	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)C(=O)Nc1ccc(OC(F)F)cc1OC(F)F	764356216	QRVHCLIVTRKOOD-UHFFFAOYSA-N	430.314	1.613	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)C(=O)Nc1cncc(Br)c1	764405355	SCKIPCLKFYMIOS-UHFFFAOYSA-N	425.264	1.428	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)C(=O)Nc1csc(-c2ccccn2)n1	764405752	XTVRVJMWVGSWRX-UHFFFAOYSA-N	429.483	1.789	50	20	IDGD	
Cc1noc(C)c1S(=O)(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	765119308	OBYWWCFURNKJMT-UHFFFAOYSA-N	441.941	1.072	50	20	IDGD	
Cc1c(Br)cc(C(=O)NNC(=O)c2nnc(O)c3ccccc23)c(=O)n1C	765184700	JKARLFOZDYJSOM-UHFFFAOYSA-N	432.234	1.180	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)c3ccoc3Cl)CC2)cc1	765422769	DRTPNYRXRBOQIV-UHFFFAOYSA-N	440.909	1.009	50	20	IDGD	
COC(=O)c1cccc(C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)c1	765758617	OYSRVCSXOILWDC-UHFFFAOYSA-N	444.919	1.705	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H]2C[C@@H]2c2cc(F)c(F)c(F)c2)c1	766631484	MJLYEPQYRRVXIV-KGLIPLIRSA-N	441.431	1.919	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)Cc3cnn(-c4ccccc4)n3)CC2)cc1	766649687	SKVFPFZLALIDSI-UHFFFAOYSA-N	447.543	1.083	50	20	IDGD	
CC(C)N(CCCNC(=O)COC(=O)[C@@H](Br)C(C)(C)C)S(C)(=O)=O	766749788	DRYNIBRLVRUKBI-CYBMUJFWSA-N	429.377	1.516	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)N[C@@H]1CC(=O)N(Cc2ccccc2C(F)(F)F)C1	767934405	GKEIRLCMJDLXMS-OAHLLOKOSA-N	435.406	1.774	50	20	IDGD	
CC(=O)Nc1ccccc1CC(=O)NNC(=O)CN1CCN(Cc2ccc(C)cc2)CC1	768071778	NTQHQVYEBYEMFX-UHFFFAOYSA-N	437.544	1.461	50	20	IDGD	
CCCS(=O)(=O)N1CCCC[C@H]1C(=O)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	768280002	VXZMTWFLPDRITG-KRWDZBQOSA-N	437.497	1.571	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)c1nccc2c(S(N)(=O)=O)cccc12	768468150	JYUMBEGVQPLFEZ-UHFFFAOYSA-N	434.861	1.619	50	20	IDGD	
Cc1cc(=O)c(C(=O)NNC(=S)Nc2ccccn2)nn1-c1ccccc1[N+](=O)[O-]	768581539	RVSRNGNWGIMWIO-UHFFFAOYSA-N	425.430	1.476	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)NC2CCN([C@H]3CCCC[C@H]3O)CC2)cc1C	769165506	FARWAWANTRSPGI-RBUKOAKNSA-N	431.537	1.340	50	20	IDGD	
COC(=O)c1cc(F)c(Br)c(S(=O)(=O)NNC(=O)c2ccccn2)c1	769863240	RKIDWTKAXAWLAF-UHFFFAOYSA-N	432.227	1.393	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCC[C@@H]2Cn2cnc3ccccc32)cc1OC	769921769	XDBDVCQKPFMQSV-QGZVFWFLSA-N	437.500	1.979	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)NCc3ccc4c(c3)CCS4(=O)=O)nc21	770414044	YTSGQNWJKMBVBJ-UHFFFAOYSA-N	445.505	1.443	50	20	IDGD	
CNS(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)cc1	770484058	JOEKVGADYZAFLP-NSHDSACASA-N	426.882	1.868	50	20	IDGD	
CCN1CCN(c2cccc(NC(=O)C(=O)NNC(=O)c3ccc(Cl)cc3O)c2)CC1	770771100	HGDADHWBUONXLG-UHFFFAOYSA-N	445.907	1.587	50	20	IDGD	
O=C(NNc1c(F)cccc1Cl)C(=O)Nc1ncn(CC(=O)N2CCCCCC2)n1	770812549	YAKGDJDCVHSULY-UHFFFAOYSA-N	437.863	1.555	50	20	IDGD	
O=C(Cn1cc(NC(=O)C(=O)NNc2ccc(Br)c(F)c2)cn1)NC1CC1	770815151	CDNDPNOFPCQLBQ-UHFFFAOYSA-N	439.245	1.145	50	20	IDGD	
CCC(CC)n1nccc1C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	771014776	DTJQFFPIBMJFSU-UHFFFAOYSA-N	435.554	1.332	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1cccc(S(=O)(=O)N[C@H](C)c2ccccc2)c1	771936820	BRKDWAJWLUVFKN-HUUCEWRRSA-N	447.513	1.829	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2ccc(NC(=O)N(C)C)cc2Cl)C[C@@H](C)O1	772371832	BZSWAOMHIQDRLJ-BETUJISGSA-N	425.917	1.694	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2cnc3ccccc3n2)cc1N1CCCS1(=O)=O	773722235	BNLKQOMDVRYQBU-UHFFFAOYSA-N	440.485	1.560	50	20	IDGD	
COC(=O)c1cc(C)ccc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1cccc(Cl)c1	774001441	GMXAXPKRTXVVHL-GFCCVEGCSA-N	433.848	1.988	50	20	IDGD	
Cc1ccnc(-n2nccc2NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)c1	774003616	YQZBEWFUNRNUGL-ZDUSSCGKSA-N	442.863	1.783	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)Nc1ccc(C[C@@H]2NC(=O)NC2=O)cc1	775705146	YLMFAOLOUCDQRL-AWEZNQCLSA-N	431.836	1.566	50	20	IDGD	
Cn1nccc1NC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	775751254	JQKRUTXOJIHYTH-UHFFFAOYSA-N	428.474	1.365	50	20	IDGD	
Cc1ccc(C(=O)NNS(=O)(=O)c2ccc(N3CCOC3=O)c([N+](=O)[O-])c2)cc1F	777651102	OWWCVBOTJLURQT-UHFFFAOYSA-N	438.393	1.622	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)[C@@H]1CSCN1C(=O)c1ccc(Cl)cc1	778437905	GWTIYLAEUOIJNZ-ZDUSSCGKSA-N	442.925	1.527	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cc(S(=O)(=O)N(C)C)cn2C)ccc1OC(C)C	778539722	HTBACKNTRAJDMV-UHFFFAOYSA-N	438.506	1.146	50	20	IDGD	
COc1ccc(Cn2cc(C(=O)NNC(=O)CCN3C[C@@H](C)O[C@H](C)C3)cn2)cc1OC	779370554	HZNRWBKAEMGXAS-HZPDHXFCSA-N	445.520	1.209	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NN=C1CCN(CCC(F)(F)F)CC1	779776666	JUNYEOFOWFNXAO-UHFFFAOYSA-N	439.482	1.965	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)[C@@]2(NC(=O)OCc3ccccc3)CCOC2)nc1C	781021886	TVBMBLYEPQQTNX-OAQYLSRUSA-N	443.460	1.490	50	20	IDGD	
CC(C)n1nnnc1-c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(O)cc2)cc1F	782832664	RETFHDTYVVJXQF-UHFFFAOYSA-N	427.396	1.165	50	20	IDGD	
Cc1cc(F)ccc1-n1ccc(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)n1	783038112	JUEMAXXZCBAFSH-UHFFFAOYSA-N	430.465	1.688	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)C(=O)N2C[C@H](C)Oc3ccccc32)nc1	783264877	SJYVEZMEEXVDJB-ZDUSSCGKSA-N	433.490	1.026	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)C(=O)Nc2ccc(C)cc2OCC(=O)N(C)C)c1	784855296	WSRKDFXCHVQKCZ-UHFFFAOYSA-N	428.445	1.330	50	20	IDGD	
CC(=O)N1CCN(Cc2ccc(NC(=O)C(=O)NNc3cc(F)c(F)cc3F)cc2)CC1	784886163	AZLOKKFZDNNKAG-UHFFFAOYSA-N	449.433	1.850	50	20	IDGD	
N#Cc1ccc(NNC(=O)C(=O)Nc2ccccc2N2CCC(C(N)=O)CC2)cc1Cl	785095281	RUSHTLQOJUEYCS-UHFFFAOYSA-N	440.891	1.995	50	20	IDGD	
Cc1ccc(N2CCNC2=O)cc1NC(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	786253447	GRYLQHPBDVQGLR-UHFFFAOYSA-N	435.444	1.882	50	20	IDGD	
CCOC(=O)[C@@H](C)NC(=O)[C@@H](C)NC(=O)NNC(=O)Nc1ccc(OC(F)F)cc1	787880193	FJMFZBMMMODITE-NXEZZACHSA-N	431.396	1.080	50	20	IDGD	
O=C(CN1C(=O)Cn2c(cc3ccccc32)C1=O)NNc1nnc(-c2ccccn2)s1	788566945	NLVVBVKVLQIWHC-UHFFFAOYSA-N	433.453	1.681	50	20	IDGD	
O=C(Cc1cc(O)nc(O)n1)NN=Cc1ccc(Cl)c(I)c1O	788716036	JBSSSDAWUHUZSY-UHFFFAOYSA-N	448.604	1.544	50	20	IDGD	
Cc1cc(-n2cccn2)ccc1NC(=O)C(=O)NNC(=O)Cc1nc2ccccc2n1C	789588195	DTMUYYXWAYVIJS-UHFFFAOYSA-N	431.456	1.396	50	20	IDGD	
O=C(NNc1cccc(F)c1[N+](=O)[O-])Nc1cccc(S(=O)(=O)N2CCOCC2)c1	790472951	SAJDPHIHXHKENN-UHFFFAOYSA-N	439.425	1.903	50	20	IDGD	
CC(C)(C)C(=O)NNC(=O)C(=O)Nc1cc(Br)cc(C(=O)N2CCCC2)c1	790946087	KACULGFGGKVFSA-UHFFFAOYSA-N	439.310	1.817	50	20	IDGD	
CO[C@@H]1CCOc2c(NC(=O)C(=O)NNC(=O)C(F)(F)Oc3ccccc3)cccc21	790952107	JIKDYUIKUAWWIQ-OAHLLOKOSA-N	435.383	1.914	50	20	IDGD	
CN(C)c1nnc(-c2ccc(NC(=O)C(=O)NNc3cccc(F)c3[N+](=O)[O-])cc2)o1	790997931	XFURLVIZFZFCBB-UHFFFAOYSA-N	429.368	1.932	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(CCC(=O)NNc2cccc(S(C)(=O)=O)c2)CC1	792301419	QXLYUZZBEQMWDI-UHFFFAOYSA-N	426.539	1.476	50	20	IDGD	
Cc1ccc(I)cc1NC(=O)C(=O)NNc1nc2ccccn2n1	792393510	ICBCNZPTWMXWTF-UHFFFAOYSA-N	436.213	1.724	50	20	IDGD	
CCOC(=O)c1cc(COC)cc(S(=O)(=O)NNC(=O)c2cccc(OC)c2O)c1	793368381	WDHCMIYDQBHNKH-UHFFFAOYSA-N	438.458	1.347	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2cc(OC)c(OC)c(C)c2OC)c1	796989663	JLPRTXRUEQOGGQ-UHFFFAOYSA-N	447.444	1.438	50	20	IDGD	
Cc1ccc(-c2ccc(Cl)cc2NC(=O)C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)o1	796999248	JSXFNPYBPGZJBI-NSHDSACASA-N	439.877	1.429	50	20	IDGD	
CCc1cc(C)cc(CC)c1NC(=O)C(=O)NNC(=O)c1csc(N2CCOCC2)n1	797034519	LHEOKCRJECGFMR-UHFFFAOYSA-N	445.545	1.813	50	20	IDGD	
COc1coc(C(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)cc1=O	798827166	UFCZSTYGZKTVRH-UHFFFAOYSA-N	446.419	1.481	50	20	IDGD	
C[C@@H](CCNS(=O)(=O)c1ccccc1)NC(=O)NNC(=O)Cc1ccc(Cl)cc1	801797507	IRERFJTXZXKLEK-AWEZNQCLSA-N	438.937	1.970	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(C)(C)[C@H]1C(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	802065765	BHAJSMYMFPEFNN-CQSZACIVSA-N	440.522	1.888	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)[C@H]2CCCN2C(=O)c2ccc3c(c2)OCO3)cc1	802118576	GHXJIDCFJFJOLJ-QGZVFWFLSA-N	439.472	1.939	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)[C@H](O)c1cccc(C(F)(F)F)c1	802998548	LTNWNNIJLJEJOS-CQSZACIVSA-N	429.782	1.856	50	20	IDGD	
Cc1onc(-c2cccnc2)c1C(=O)N1CCN(S(=O)(=O)CBr)CC1	803038473	TVFUYVIQKCVIQK-UHFFFAOYSA-N	429.296	1.485	50	20	IDGD	
O=C(NCCN1CCN(C(=O)C2CCCCC2)CC1)NNc1ccc2c(=O)[nH]ccc2c1	806798179	HZQMXZHHBPEWDQ-UHFFFAOYSA-N	440.548	1.879	50	20	IDGD	
O=C(NNc1nccnc1C1CCC1)C(=O)Nc1ccccc1S(=O)(=O)C(F)F	807461723	QSNIJCFRJYQCPY-UHFFFAOYSA-N	425.417	1.822	50	20	IDGD	
O=C(CCSc1ccc(F)cc1)NNC(=O)NC[C@@H](N1CCOCC1)C(F)(F)F	807541536	OELCDVDWULFMLR-CQSZACIVSA-N	438.447	1.901	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@@H](C)C(=O)NN=Cc1c(N(C)C)n(C)c(=O)n(C)c1=O	807954793	DBWOWQRNPLHVAH-ZDUSSCGKSA-N	435.912	1.338	50	20	IDGD	
CC(=O)N1C[C@@H]2[C@@H](CCC[C@H]2NC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)C1	808357714	NDUIYYQZQPBYHS-USXIJHARSA-N	426.477	1.169	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)CNS(=O)(=O)c2ccc(Br)cc2)cc1	810267874	IIWIUABKCDBXMS-UHFFFAOYSA-N	437.275	1.060	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)CNS(=O)(=O)c2cc(C(F)(F)F)ccc2Cl)n[nH]1	810584321	OFJVFYLMCUEQIQ-UHFFFAOYSA-N	439.803	1.130	50	20	IDGD	
C[C@@H](CC(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1)c1ccc(F)c(Br)c1	812535459	WROSACJIRKDZPH-ONGXEEELSA-N	436.303	1.599	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NC[C@@]2(C)OCCc3sccc32)nc1	812550618	JSBHDJRPEBBOBS-GOSISDBHSA-N	439.563	1.944	50	20	IDGD	
CC(C)(C)OC(=O)N1CCOc2ccc(NC(=O)C(=O)NNC(=O)c3ccc[nH]3)cc2C1	812979645	ZKPJKHZYNCIMIR-UHFFFAOYSA-N	443.460	1.544	50	20	IDGD	
COCC1(CNC(=O)NNC(=O)COc2ccc(Br)cc2)CCOCC1	813772571	LCVHRGSDGPRBDQ-UHFFFAOYSA-N	430.299	1.602	50	20	IDGD	
COCC(C)(C)CNC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	813840016	GFLHKJPQKJXNJJ-UHFFFAOYSA-N	448.545	1.782	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)c2ccc3c(c2)NC(=O)CNC3=O)c1	815376969	CJOVTKBCCAAAIN-UHFFFAOYSA-N	447.245	1.214	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])cc2cccnc12	815565979	FXQCFCOLNOQMGP-UHFFFAOYSA-N	439.384	1.317	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)[C@@]2(c3ccccc3)CCC(=O)NC2)c2ccccc2c1=O	816806123	SFNCROGWMUFSCK-DEOSSOPVSA-N	447.495	1.586	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)Cc2cc(C)[nH]n2)c1	823966620	WUZOVAOTOFWKMD-UHFFFAOYSA-N	443.485	1.531	50	20	IDGD	
Cc1nnnn1/C(=C/c1ccccc1)C(=O)OCC(=O)NNC(=O)c1cccc(Cl)c1	849196531	PFFQQYRECSCLEM-LICLKQGHSA-N	440.847	1.637	50	20	IDGD	
Cc1cc(Br)c(S(=O)(=O)N2CC[C@H](B(O)O)C2)cc1Br	864230740	FCGLTASVIUXTJD-QMMMGPOBSA-N	426.923	1.757	50	20	IDGD	
CCOc1ccc(N(C)S(=O)(=O)c2ccc(C)c(C(=O)N3CC[C@H](B(O)O)C3)c2)cc1	864234413	VAPSYOFHIWIXKF-INIZCTEOSA-N	446.334	1.908	50	20	IDGD	
O=C(C[C@@H]1OC(=O)c2ccccc21)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	912642977	XBNUVKORSVJMRU-SFHVURJKSA-N	443.481	1.534	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(F)c(S(=O)(=O)NC3CC3)c2)cc1C	914595081	QECCLELMSFHPJW-UHFFFAOYSA-N	448.476	1.283	50	20	IDGD	
C[C@]12CCC(=O)N1c1ccccc1C(=O)N2CC(=O)NNC(=O)COc1ccccc1F	914829688	LUVIRDSQCQMKBA-JOCHJYFZSA-N	440.431	1.351	50	20	IDGD	
Cc1cc(Br)oc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	916095526	XHJPFEDEODEQGA-UHFFFAOYSA-N	430.280	1.676	50	20	IDGD	
Cc1oc(C(=O)NNC(=O)Cn2cnc3ccccc32)cc1S(=O)(=O)N1CCCC1	916111318	MPJFBEKVWWTKAP-UHFFFAOYSA-N	431.474	1.183	50	20	IDGD	
CCCCS(=O)(=O)N1CCC(C(=O)NNC(=O)Cn2c(CC)nc3ccccc32)CC1	916133209	YJFUVKCZVQITTK-UHFFFAOYSA-N	449.577	1.588	50	20	IDGD	
COc1cc(C=NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc([N+](=O)[O-])c1O	916261119	WBIYZOFYUISJPY-UHFFFAOYSA-N	448.457	1.857	50	20	IDGD	
CCCS(=O)(=O)N1CCC(NC(=O)NNC(=O)c2cc(-c3ccc(C)cc3)[nH]n2)CC1	916379589	KBWQMJOTUJGTSM-UHFFFAOYSA-N	448.549	1.533	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCC2(c3ccccc3)CCOCC2)c1	916623505	VYUZQWLWFUATGT-UHFFFAOYSA-N	431.514	1.783	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)NC[C@@]1(N2CCOCC2)CCSC1	916636818	MFLXJOIWBQVZMW-KUHUBIRLSA-N	426.514	1.131	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H]2CCN3CCCC[C@H]23)c1	916638598	JADUGHLEIHJXOW-QZTJIDSGSA-N	437.566	1.288	50	20	IDGD	
CCc1noc(CCCC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)n1	916736393	NTJUOZFWBZIJHV-UHFFFAOYSA-N	435.506	1.200	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)n2nc(C)cc2n1	916745755	LUBLVBQNFZBBIM-UHFFFAOYSA-N	442.501	1.205	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)SCC(=O)Nc2ccc(F)cc2)cc1	916830734	SFCGVGLGSUVGMA-ZDUSSCGKSA-N	432.477	1.980	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNS(=O)(=O)c1cc(S(C)(=O)=O)ccc1C	917730358	BOWSLOYPLBQLCU-UHFFFAOYSA-N	432.907	1.684	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1	918217835	MANKEMAVIHPYBX-AWEZNQCLSA-N	449.489	1.615	50	20	IDGD	
C[C@H](NS(=O)(=O)c1ccc(Cl)cc1)C(=O)NNC(=O)c1ccc(Cl)cc1O	918358227	LLRUVCNHZDTVKY-VIFPVBQESA-N	432.285	1.827	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NN=Cc1cscn1)N(S(C)(=O)=O)CC2	918711694	WWLUNEAZTIFARK-OAHLLOKOSA-N	438.531	1.560	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)OCC(=O)N[C@H](C)C(=O)N2CCCCC2)c1C	918810328	NWIDHRHBECNJDG-VJOZSWGJSA-N	444.532	1.719	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)Nc2cc(-n3cnnn3)ccc2C)cc1	919896726	CCOXDRUEPGKUTH-AWEZNQCLSA-N	425.449	1.990	50	20	IDGD	
Cc1ccccc1C(=O)NNS(=O)(=O)c1cc(S(C)(=O)=O)ccc1Br	919956413	WCQZUOMUFULNBJ-UHFFFAOYSA-N	447.332	1.784	50	20	IDGD	
COc1cc(S(=O)(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)cnc1Cl	1254982046	URUMNDQVPMRMMK-UHFFFAOYSA-N	448.929	1.700	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(\C#N)C(=O)OCC(=O)N2CCC(C(N)=O)CC2)c1C	1317690039	VELPVUGAELHHIH-RPJLVFAOSA-N	430.505	1.486	50	20	IDGD	
CCOC(=O)[C@@H](C)NC(=O)c1ccc(NC(=O)NNC(=O)c2ccc(OC)cc2)cc1	1323831123	VALKYFFCZGUMBV-CYBMUJFWSA-N	428.445	1.843	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4nccn4c3)C2)C1	1778016934	XVUIOGAURNCPTG-KXBFYZLASA-N	435.322	1.951	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H]1C[C@@]13C(=O)Nc1ccccc13)C2)[C@@H](F)Cl	1778027815	AQCUIZHNAXOHEC-CISTUJAYSA-N	449.910	1.945	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2)c1cnnc2ccccc12	1778526834	CTCPVLBPGHHAKJ-WAOWUJCRSA-N	432.908	1.357	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)c3cc4sccc4[nH]3)C2)C1	1778701974	FJIYKMCIMJYNOJ-FQEVSTJZSA-N	433.534	1.046	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2)c1ccc2ncncc2c1	1779071304	ONXFMEBFZXEMOU-WAOWUJCRSA-N	432.908	1.357	50	20	IDGD	
COc1ccc([C@@H](O)C(=O)N2CCO[C@@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)cc1	1779294863	QLEROKVHFDBUFY-TZIWHRDSSA-N	436.581	1.410	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](C)Nc3ccccn3)C2)C1	1779323681	QAPPMKXHFVVFLO-VCBZYWHSSA-N	439.354	1.743	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C/N=C/c2ccco2)C1	1779446318	CRLHFYBDZMAXGF-ONHDISHQSA-N	425.913	1.466	50	20	IDGD	
C[C@H](Nc1cnccn1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CO[Si](C)(C)C)C1	1779545718	XMQPUPGCYMECQX-CSODHUTKSA-N	449.628	1.642	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(CCN(C(=O)c3cc(-n4ccnc4)ccn3)C2)C1	1780386436	WQHINKUAFDVTSF-LJQANCHMSA-N	448.321	1.496	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H]3CC[C@H]4CCC(=O)N4C3)C2)C1	1781059837	TUZQTZHYVFQEPA-YGTYGHESSA-N	442.354	1.001	50	20	IDGD	
O=C1CCc2ccc(C(=O)N3CCO[C@]4(CCN(C(=O)[C@@H](F)Br)C4)C3)cc21	1781332537	IBQCYBDHYUHSEW-APWZRJJASA-N	439.281	1.950	50	20	IDGD	
O=C([C@@H](F)Br)N1CC[C@@]2(C1)CN(C(=O)C(Cl)(Cl)Cl)CCO2	1781332926	GGWOPLKXVQJUNH-GMSGAONNSA-N	426.497	1.877	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc3nn[nH]c3c2)C1	1781440497	ZBAOVBWSSWKDOW-WIYYLYMNSA-N	445.596	1.937	50	20	IDGD	
O=C(c1ccc(-c2cccnc2)cc1)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1781448048	DRRRBAPJOORXGZ-DENIHFKCSA-N	429.904	1.792	50	20	IDGD	
CC(C)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnccc1C(=O)NN)C2	1781748287	AJKQBFRQPOHFLX-XMSQKQJNSA-N	431.537	1.249	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(C)nc1O)C2	1782173917	SZMOFAFLIGBHGP-JXXFODFXSA-N	425.913	1.477	50	20	IDGD	
CCOc1ncccc1C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](C)Br)C2)C1	1783528542	OSKUQJOFUHIUDD-SCLBCKFNSA-N	426.311	1.707	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(CCN(C(=O)Cn3cnc4ccccc43)C2)C1	1783747911	MRBMCLFHSJHXGF-OAQYLSRUSA-N	430.581	1.718	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](C)[S@@](=O)c1ccccc1)CCO2	1783881029	JGNDRUXVKXGXER-SILXOERBSA-N	442.965	1.266	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)CC1CCC(C)(C)CC1)CCO2	1783934635	JPBKSKPZIXMGRR-QHCPKHFHSA-N	436.597	1.796	50	20	IDGD	
CC(=O)Nc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]3C2)ccc1C	1784091836	ADXZLGRHNAFIKV-DKKFBQAASA-N	437.924	1.146	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)CCc3cccc(O)c3)C2)C1	1784127168	OBXASTDWFKBESW-IFXJQAMLSA-N	425.323	1.938	50	20	IDGD	
Cc1cc(C)c(C(=O)N2CC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)c(C)c1	1784985835	HVZIJSJQYMGKRH-XMMPIXPASA-N	436.317	1.049	50	20	IDGD	
Cc1ncc(C(=O)NC2(c3ccc(NC(=O)c4cccc(B(O)O)c4)cc3)CCC2)cn1	1788146020	TVJZLKNBJNLAPE-UHFFFAOYSA-N	430.273	1.526	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)Br)C[C@@H]32)o1	1788608720	KHCDXPLOPMUWSH-HTUGSXCWSA-N	442.310	1.615	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C3CCC(CO)CC3)C[C@@H]21)[C@@H](F)Br	1789922010	BAWRFSUMIVMVSZ-OYVHKFOJSA-N	435.334	1.455	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3C[C@@H]3c3ccccc3)[C@H]2C1	1791211079	VAMBNHVLSJRNFF-ZPAWYTMASA-N	442.560	1.143	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)[C@@H]1CCc2nc[nH]c2C1	1791530190	HPKPLEAMJIKWTM-BFPXCNAZSA-N	443.317	1.185	50	20	IDGD	
Cc1ccc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)CBr)cn1	1792868727	NDRQYLSRWSFZMV-UEILYKACSA-N	438.366	1.943	50	20	IDGD	
COc1ncc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)CBr)cc1C	1792870522	QZJZOKSHOONUNM-DMRZNYOFSA-N	440.338	1.633	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cnc2ccccn12	1792933478	YXGDREOQDHUJBF-MVWRLGRASA-N	449.349	1.640	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(Br)ccc1F)C2)[C@H](O)CCl	1792974882	GGENDVDDCSFFPT-ANGCBRKESA-N	449.704	1.391	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](O)CCl	1792983749	MYEDHWKPHVLVDT-WAQIMAFDSA-N	439.846	1.061	50	20	IDGD	
C[C@@H](CBr)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnncc1C(=O)O)C2	1792990371	LOLZHVBNMSYIRQ-YFKTTZPYSA-N	425.283	1.458	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cncc(N(C)C)c1	1794296327	DLXDNIAMOOGETM-FSDCSDTHSA-N	439.354	1.524	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(OCC(F)(F)F)n1)[C@H](O)CCl	1794643061	YOWDKIJSFOHAGX-GFQSEFKGSA-N	435.830	1.874	50	20	IDGD	
CC(C)(C)n1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCBr)nn1	1795114915	LLAKQCDRUWZNFL-JJLQDPRZSA-N	428.331	1.021	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2sc(N)nc2c1	1795660349	RYJMANQUOPFSNK-ZWUHOBOKSA-N	438.937	1.336	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)[C@H]1[C@H]2c3ccccc3S[C@H]21	1796188890	YMTNEJYEUKCYPT-AZNOEYCNSA-N	448.353	1.506	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](O)[C@H](C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](F)Cl)C1	1796809433	MPMGDRAORRTJOL-GTDBDLECSA-N	447.935	1.777	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnc2ccccc2n1	1797287405	BBZDIGBHDMXQIE-QDMKHBRRSA-N	445.483	1.194	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1n[nH]c2c(F)cccc12	1797489945	AILQKQQSWGPWEG-GDGVSTKUSA-N	443.248	1.596	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)cc([N+](=O)[O-])c1)C2	1797956410	UANOWACMZATERF-ZSBFGKGUSA-N	437.525	1.355	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnccc1C(=O)NN	1798443031	NLSJQJBGBONRKQ-NWJSVONSSA-N	438.326	1.110	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(S(C)(=O)=O)c1)C2	1799264146	BPCIGHNPHHDWHT-FSDCSDTHSA-N	428.938	1.311	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(Cl)cc3nn[nH]c13)C2	1799268899	NGWDEIULQNFAMW-FJHTZYQYSA-N	426.304	1.832	50	20	IDGD	
CC(C)(C)n1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@](C)(Cl)CCl)nn1	1799277860	SKLAXRGIPILWDK-AZGFTEDZSA-N	432.352	1.473	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccccc1C(F)(F)F)c1cccc(B(O)O)c1	1799585391	BQPLRACJUZBUSZ-BJWYYQGGSA-N	446.234	1.951	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(C)ccc1-n1ccnn1	1799865408	OPTAHMCPKZEWIO-HIRMHNASSA-N	431.924	1.796	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2ccoc2c1	1799971722	URVSSAXVUZYKII-UPHUGPLXSA-N	428.489	1.009	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C[C@@H](O)CNC(=O)OC(C)(C)C	1800180034	OGUYDYDQAWPQQR-YIDVYQOGSA-N	431.961	1.918	50	20	IDGD	
Cc1c(F)ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)Br)c1N	1800756809	RVFADAGHUVYJMD-LSSIXWDNSA-N	428.302	1.703	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/C(=O)c1cccs1)C2	1800975180	KZBVETKJZGOLLZ-KUGIXWJLSA-N	426.922	1.330	50	20	IDGD	
COc1ccc(F)cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)Br)C2	1801725581	NIXINVGCQVMCJF-OVZMXSCWSA-N	429.286	1.821	50	20	IDGD	
CCOC(=O)N[C@H](O)C(=O)N1CC[C@H](CNC(=O)C(C)(C)CCl)[C@@H]1c1cccnc1	1802900635	CALCATQSINCROU-OWCLPIDISA-N	440.928	1.417	50	20	IDGD	
O=C(CCC1CCC1)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1803370462	QNDSHZXJDDKZSE-OFNKIYASSA-N	435.333	1.661	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CCC2CCC2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807359686	KYSZQTYGTLEOAL-REWPJTCUSA-N	435.333	1.661	50	20	IDGD	
Cn1nncc1C(=O)N1CC[C@H](CNC(=O)[C@H](F)Br)[C@H]1c1cccnc1	1808651706	PHQFSDGSIPPNPZ-BNOWGMLFSA-N	425.262	1.220	50	20	IDGD	
Cc1ccccc1NCC(=O)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1	1809966730	KXLADYPKFQWUPX-UHFFFAOYSA-N	449.360	1.632	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1CCN(C(=O)CCn2ccnn2)[C@H]1c1cccnc1	1810549219	YOUVUNDIUMBZHO-PXNSSMCTSA-N	430.585	1.621	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)c1c(O)cc(O)cc1O	1811412208	HUWCFKIZYLWYQB-BJOOFOGMSA-N	435.864	1.118	50	20	IDGD	
COc1cc(C(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)ccc1O	1811940957	VSVNYCAIHKBKOV-KVSKMBFKSA-N	433.892	1.715	50	20	IDGD	
C=C(C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)C(F)(F)F	1812676686	CKIZKTAKNLUQPC-FUHWJXTLSA-N	447.222	1.200	50	20	IDGD	
C#CCCCCC(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1813228218	UCNLCGMBUWTRGS-AUSIDOKSSA-N	427.549	1.654	50	20	IDGD	
O=C1CC[C@H](C(=O)Nc2cc([C@@H]3CCCCN3C(=O)[C@H](F)Br)[nH]n2)CN1	1814524130	BSSJRMIVRFSIAU-CHIMOYNISA-N	430.278	1.619	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1ccnc(F)c1	1815418602	AKYWYQIDQLTKJF-QGZVFWFLSA-N	437.240	1.243	50	20	IDGD	
Cc1cc(C)n2ncc(C(=O)Nc3cc([C@@H]4CCCCN4C(=O)[C@@H](O)CCl)[nH]n3)c2n1	1818584306	SFROKDSNAYHYPU-HOTGVXAUSA-N	445.911	1.975	50	20	IDGD	
CCc1nc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)co1	1819896078	SKYREQPTDACRNY-QGZVFWFLSA-N	437.265	1.260	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN2CCNC2=N)[nH]n1	1820863460	DNTFIDAZYCZKFI-SJCJKPOMSA-N	430.340	1.478	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H]2CCC(=O)N2C)n[nH]1	1820956766	KZEUUNXVTFTVIH-WXHSDQCUSA-N	426.315	1.806	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)C(F)(F)Cl)n[nH]1	1822568397	RPARVZFNJUCPNZ-LBPRGKRZSA-N	441.826	1.546	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](Cc2cnc[nH]2)NC(C)=O)n[nH]1	1822704521	ZGRGSIQRHVXXQK-DJIMGWMZSA-N	449.943	1.890	50	20	IDGD	
O=C1CCc2ccc(C(=O)N3CCC([C@@H]4CCCCN4C(=O)[C@H](O)CCl)CC3)nc2N1	1824182534	FLIXSBBCWIGBIH-ZWKOTPCHSA-N	448.951	1.799	50	20	IDGD	
O=C(Cn1cccc([N+](=O)[O-])c1=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](F)Cl)CC2	1824720948	GIFNBOXTLULIPV-OQPBUACISA-N	443.844	1.360	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)C[C@@H]2CCCCO2)CC1	1824904593	CQRYGLIISVZGDJ-VXKWHMMOSA-N	442.365	1.559	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H]1CCC(=O)NC1)CC2	1825631174	CSGYLWMZKUNOHF-LPEHRKFASA-N	429.340	1.365	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](C)Nc1cnccn1)CC2	1826000342	SHMLTLXCXDBHSV-TUAOUCFPSA-N	438.941	1.600	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CNC(=O)OC(C)(C)C)CC2	1826004920	UYQGFHBGCLIDAP-GHMZBOCLSA-N	446.957	1.834	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(F)cc1)CC2	1826088329	DJSIAQMOZYLPLR-CQSZACIVSA-N	433.509	1.881	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC[C@@H]1C1CCN(C(=O)C23CC(F)(C2)C3)CC1	1827055861	MOIMJOFPCDXLEZ-YUVSOPLDSA-N	428.313	1.492	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H]2CCCO2)CC1	1827243797	LAIKEDZYPHZXGP-UXIDLFCBSA-N	443.548	1.919	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccno2)CC1	1828925352	KBPBBGBCYWWXFI-QGZVFWFLSA-N	426.477	1.220	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)C2CCOCC2)CC1	1828925991	WIEYQQXRZMLJPG-HXUWFJFHSA-N	443.548	1.345	50	20	IDGD	
O=C(CCOc1ccc(F)cc1)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1830255713	KLTSRPCHMMRBRH-LJQANCHMSA-N	449.306	1.855	50	20	IDGD	
COC(=O)[C@@H]1CC[C@@H](C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)C1	1830353612	GOKILIYJHXAYQI-WHSLLNHNSA-N	444.956	1.297	50	20	IDGD	
COc1ncccc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830358414	BOKGYPAAAMOUFP-HXUWFJFHSA-N	425.913	1.425	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)nn1C(F)F	1830364674	OMADGGDAXUDPES-LJQANCHMSA-N	448.898	1.922	50	20	IDGD	
Cc1cccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)n1	1830537456	IQJBTHUOROESIY-KUHUBIRLSA-N	440.338	1.491	50	20	IDGD	
CC(C)O[C@H](C)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](C)CBr)CCO2)C1	1830539437	GRYZZJKABZALIV-IIDMSEBBSA-N	435.359	1.287	50	20	IDGD	
Cc1oc(C(C)(C)C)cc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1830725913	SPYDTIXEZLWTTA-IERDGZPVSA-N	442.940	1.555	50	20	IDGD	
O=C(c1cc2sccc2s1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1830730772	DQIDVFIZXRUBDA-KZULUSFZSA-N	444.962	1.633	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(C)n(CC)n3)C2)C1	1831652375	ZKHILXGULRAVKW-OXJNMPFZSA-N	426.945	1.689	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(COC)c[nH]3)C2)C1	1831653876	FYCGEXPNGFDRHA-UZLBHIALSA-N	427.929	1.639	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4nn[nH]c4c3)C2)C1	1831654786	XTWVKNBMKABZED-QRWLVFNGSA-N	435.912	1.435	50	20	IDGD	
Cc1nn(C)c(C)c1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1	1831815399	JVFUQYXKZXIZSX-MOPGFXCFSA-N	447.363	1.343	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cc(F)cnc3Cl)CC2)CC1)[C@H](O)CCl	1833311789	DXNARLZJCRIVMS-MRXNPFEDSA-N	447.338	1.659	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)CN3CCN(C)CC3)CC2)CC1	1833532637	AKVNPRFWLWHWLK-FQEVSTJZSA-N	442.048	1.213	50	20	IDGD	
Cc1cnc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)CBr)C3)C2)s1	1833796677	LLYRJOXGTBHPJH-SJKOYZFVSA-N	446.367	1.553	50	20	IDGD	
N[C@@H](Cc1cccnc1)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](F)Cl)CC2)CC1	1835097951	JODRKBLJMZIBNW-ZWKOTPCHSA-N	425.936	1.057	50	20	IDGD	
O=C(c1cc2ccccn2n1)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836717442	BNTNFFNMTXLDRO-IBGZPJMESA-N	434.924	1.546	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3oc(C)nc3C)CCO2)C1	1838007523	GRGSFIAPJXHLEM-KSSFIOAISA-N	444.326	1.535	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)C34CC(C3)C4)CC2)CC1	1838395419	OIQOGZCDHBIDQH-UHFFFAOYSA-N	441.532	1.097	50	20	IDGD	
COc1c(Cl)ccnc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1838727984	CNNRIHHYDXMQHG-YOEHRIQHSA-N	436.267	1.348	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)C3CN(C)C3)CC2)CC1	1838766149	XYLUNPTXLICTRM-KRWDZBQOSA-N	430.387	1.720	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CC(c4ccccc4)=NO3)C2)C1	1839141789	SISNNWOEKHNREK-KPLVRAHFSA-N	449.935	1.653	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)/C=C/c3ccco3)C2)C1	1839150398	LMXLIGQEQWVQGC-OJBOGMDESA-N	431.316	1.986	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3ccco3)C2)C1	1839150823	YIIFHKQNWRBIPI-RTBURBONSA-N	433.332	1.905	50	20	IDGD	
O=C(CCCC(F)(F)F)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839198457	DUKXGRWHQCUQLG-JSGCOSHPSA-N	449.239	1.866	50	20	IDGD	
Cc1cc(F)cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)c1	1839202175	WNSJLSIRTUEKKB-MAUKXSAKSA-N	447.276	1.895	50	20	IDGD	
COc1cccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)c1C	1840071105	OPEWUKZRZCKACA-FQEVSTJZSA-N	445.343	1.806	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(F)(C(=O)N2CC3(CCCN3C(=O)[C@H](O)CCl)C2)CC1	1841348044	FIWFRAZTFUHNCK-CQSZACIVSA-N	447.935	1.529	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@]1(C)C(=O)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1	1841350330	VPUHNAIGVKADLA-LIRRHRJNSA-N	429.945	1.579	50	20	IDGD	
C[C@H]1[C@@H](C(=O)N2CC3(CCCN3C(=O)[C@H](O)CCl)C2)CCCN1C(=O)OC(C)(C)C	1841352976	XHODJWNNCQMUOD-HRCADAONSA-N	443.972	1.825	50	20	IDGD	
Cc1nn2cc(CC(=O)N3CCCC34CN(C(=O)[C@@H](C)CBr)C4)nc2s1	1841785692	SJUNSHBQQBGHFG-NSHDSACASA-N	440.367	1.876	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)Cc2ccc3ccccc3c2)C1	1842660457	LKEIKKFSSLQDMG-UHFFFAOYSA-N	443.507	1.898	50	20	IDGD	
Cc1noc(N)c1C(=O)N1CCCC12CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1842905287	UBECBQNYHNHDIX-LBPRGKRZSA-N	441.916	1.514	50	20	IDGD	
O=C(c1ncc(Cl)cc1Cl)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843012755	LICCBGRVRNKOJT-UHFFFAOYSA-N	434.088	1.199	50	20	IDGD	
O=C(CCc1c[nH]c2ccccc12)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843013516	SMPQPKXCJJPRLR-UHFFFAOYSA-N	431.301	1.298	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)C1(Br)CC1)C2	1843416614	GJFUXPJEPKPVQJ-CIAFOILYSA-N	436.310	1.251	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)c1cnn(C)c1C)C2	1844692132	KOVLGNJDEJQCBW-UHFFFAOYSA-N	441.444	1.693	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)c1c(C)n[nH]c1C)C2	1844692819	NUDZQFKILZBVRS-UHFFFAOYSA-N	441.444	1.991	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@H]1COCCN1C(=O)OC(C)(C)C)C2	1846362000	BGUHGRALANBGHW-CABCVRRESA-N	445.944	1.080	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)c1ccc(CCN3CCCC3)nc1)C2	1846362187	PPOHQPXKYBOAQO-LJQANCHMSA-N	434.968	1.791	50	20	IDGD	
CC(C)(C)OC(=O)N1CC2(C[C@H]2C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](O)CCl)C1	1847563987	SXHSYGISHOQRHA-AJNGGQMLSA-N	427.929	1.045	50	20	IDGD	
O=C(CSc1ccc(F)cc1F)N1CC[C@H]2[C@@H]1CCN2C(=O)c1ccc(B(O)O)cc1	1847768800	DZFVOWQGIAKYPD-ROUUACIJSA-N	446.284	1.252	50	20	IDGD	
C[C@@H](C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)n1cncn1	1848098586	KOAHMPXFULZHHG-AJNGGQMLSA-N	440.932	1.173	50	20	IDGD	
CS(=O)(=O)c1ccc(C(=O)NNC(=S)NCCc2cccs2)cc1[N+](=O)[O-]	11511932	LJOJORWNTHKSOS-UHFFFAOYSA-N	428.517	1.411	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=S)NC(C)(C)C)CC2)cc1C	14895069	GMIVVWYEWWOFFH-UHFFFAOYSA-N	426.608	1.998	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2ccc3c(c2)OCO3)cc1S(=O)(=O)N1CCCC1	15793611	DENJXRPSKSOYNC-UHFFFAOYSA-N	447.469	1.283	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2[nH]c(C)c(C(=O)OC)c2C)c2ccccc2c1=O	17162038	UDCQDIBTNGYDBM-UHFFFAOYSA-N	425.445	1.613	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2ccccc2S(C)(=O)=O)c2ccccc2c1=O	23688665	GFCXTSRSJQFSSR-UHFFFAOYSA-N	428.470	1.285	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)CCNS(=O)(=O)c2cc(C)ccc2C)c1	28637073	OIQCPWQDRMBIRI-UHFFFAOYSA-N	433.530	1.815	50	20	IDGD	
C[C@@H](NC(=O)c1ccc(Br)s1)C(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	108110446	GMHIHBPQCSZWFZ-MRVPVSSYSA-N	441.263	1.998	50	20	IDGD	
O=C(NNC(=O)c1cccn(Cc2ccccc2)c1=O)c1nn(-c2ccccc2)cc1O	109107826	GXRICRUOOGWVMB-UHFFFAOYSA-N	429.436	1.863	50	20	IDGD	
O=C(CCOc1cccc(Br)c1)NNC(=O)CNC(=O)c1cccs1	725740218	CBZPNNXNBKYFIR-UHFFFAOYSA-N	426.292	1.857	50	20	IDGD	
COC(=O)c1ccc(O)c(C=NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1	726737294	DDRPUSIBMANEHM-UHFFFAOYSA-N	431.470	1.727	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN1C(=O)OCC(F)(F)F)c1nn(-c2ccccc2)cc1O	727848922	PCVJDQASCBNMAC-LBPRGKRZSA-N	441.366	1.502	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3ccc4c(c3)CCC(=O)N4)cc2)CC1	728213025	BAHAQGWFMJZXKC-UHFFFAOYSA-N	443.529	1.264	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	728214515	QJPHDGJCTRCGRK-OAHLLOKOSA-N	436.509	1.672	50	20	IDGD	
COc1cc(C=NNC(=O)[C@@H](C)NS(C)(=O)=O)ccc1OC(=O)c1cccs1	728433909	GWHZUIJDENBDNW-LLVKDONJSA-N	425.488	1.364	50	20	IDGD	
CC[C@H](N=c1nn[nH]n1-c1ccccc1)C(=O)NNC(=O)[C@@H](C)Oc1ccccc1F	729283508	UARGZZKPSSWQNB-CJNGLKHVSA-N	427.440	1.029	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CS[C@@H](Cc2ccccc2F)C(=O)N1)c1cccc2ncccc12	730226520	OIDHZPMJDZPJMU-OALUTQOASA-N	438.484	1.978	50	20	IDGD	
CSCC[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)NNC(=O)Cc1ccccc1F	731345366	QDEGZJKIYZNJMR-QGZVFWFLSA-N	448.476	1.976	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2c[nH]nc2C)cc1S(=O)(=O)N1C[C@@H](C)C[C@@H](C)C1	731852164	HHSUTXKCKDFVNA-BETUJISGSA-N	449.533	1.468	50	20	IDGD	
COC(=O)Cc1cc(=O)n(-c2ccc(C(=O)NNc3nc(-c4ccncc4)no3)cc2)[nH]1	732067659	HEVRUJLDTLOHTD-UHFFFAOYSA-N	435.400	1.083	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)c2ccc(COc3ccccc3C#N)o2)C[C@@H](C)O1	732263121	KCAMRDBDSHIEEO-HZPDHXFCSA-N	426.473	1.991	50	20	IDGD	
Cc1nc([N+](=O)[O-])cn1CCC(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	734826117	XKFYAJZKOXQONT-UHFFFAOYSA-N	439.473	1.220	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)N[C@@H]2CCN(c3cnn(C)c3)C2=O)c(C)n1C[C@@H]1CCCO1	735447906	GWHXHLXQKKXKSP-XYNSYHPZSA-N	436.516	1.846	50	20	IDGD	
C#Cc1cccc(NC(=S)NNC(=O)c2ccc3c(c2)CCN3C(=O)CNC(C)=O)c1	735702625	CSCGUIGQZHUHMC-UHFFFAOYSA-N	435.509	1.325	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCCOC2CCCCCC2)cc1	735762048	CCQUKFDGFXESKV-UHFFFAOYSA-N	440.566	1.685	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)CN(C)S(=O)(=O)c1cccc([N+](=O)[O-])c1)c1ccccc1	737557654	KIRXXHGDIIXLFC-QGZVFWFLSA-N	434.474	1.557	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2ccccc2)c1	741812693	ATGZUNNUIMLBNC-IBGZPJMESA-N	434.452	1.557	50	20	IDGD	
Cc1noc(-c2ccccc2C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)n1	745259974	WBOXNURLNUFCKA-QGZVFWFLSA-N	438.396	1.189	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)N[C@@H](C)CN2CCN(C)CC2)cc1Cl	745807272	BNJRJUULKRUURG-LBPRGKRZSA-N	428.921	1.329	50	20	IDGD	
CCCC[C@H](/N=C1/NS(=O)(=O)c2ccccc21)C(=O)NNc1nc(C)cc(OC)n1	746630372	IXEUIRICBQKIDK-AWEZNQCLSA-N	432.506	1.534	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)N2CCN(C(=O)COc3ccc(F)cc3)CC2)cc1	747103348	FABKFHWMDVMZPZ-UHFFFAOYSA-N	425.420	1.275	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NC2CCN(CCOC(C)C)CC2)cc(OC)c1OC	747591072	ORNMNIOCEVVPPG-UHFFFAOYSA-N	438.525	1.546	50	20	IDGD	
O=C(NNC(=O)c1c(NC(=O)c2cccnc2)sc2c1CCCC2)C(=O)N1CCCC1	748240363	UEYRJSSOOXCPQS-UHFFFAOYSA-N	441.513	1.658	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CN2CCCN(C(=O)Cc3cccc(F)c3)CC2)c1	748836502	VFEQNXXSWXAAQM-UHFFFAOYSA-N	426.492	1.672	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)OCC(=O)N2CCCC[C@@H]2C(N)=O)c(C)n1C[C@H]1CCCO1	749221607	RQYFJYUJTHKBQD-LDWJFSKOSA-N	442.516	1.601	50	20	IDGD	
Cc1ccsc1[C@H]1C[C@H]1C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	749239811	FKNPMCHDANKMLW-LSDHHAIUSA-N	435.575	1.634	50	20	IDGD	
COC[C@@H](C)n1c(C)cc(/C=C(\C#N)C(=O)N2CCN(CCn3cncn3)CC2)c1C	749397991	XGHCLGRQHDCUAN-AGKWGAAGSA-N	425.537	1.655	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)N[C@H]1CCN(c2cccc(Cl)c2)C1=O	750670496	MBIZELOHBUKDDU-HNNXBMFYSA-N	430.848	1.861	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(CCC(=O)NNC(=S)N[C@@H](C)C2CC2)cc1	751617739	BZAVOBQEIDETAE-AWEZNQCLSA-N	426.608	1.944	50	20	IDGD	
COc1cc(OC)cc(N2C[C@@H](C(=O)NNC(=O)COCc3ccccc3)CC2=O)c1	752314785	BMCIRBFIDLFMRI-INIZCTEOSA-N	427.457	1.421	50	20	IDGD	
COc1ccc([C@@H]2[C@H](C(=O)NNC(=O)CO)CCC(=O)N2c2ccc(OC)cc2)cc1	753442964	QRASEBHCPMXTIX-WIYYLYMNSA-N	427.457	1.328	50	20	IDGD	
COc1cc(CN2CC[C@H](NC(=O)NNc3ccc(-n4cccn4)nn3)C2)cc(OC)c1	756102898	QCKHRIGLDULDEP-INIZCTEOSA-N	438.492	1.580	50	20	IDGD	
CCc1c(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)cnn1CCC(C)C	756165062	SYUCTEIQJJQDIQ-UHFFFAOYSA-N	426.477	1.528	50	20	IDGD	
CS(=O)(=O)NCc1ccc(NC(=O)NNC(=O)c2cc(Br)c[nH]2)cc1	756626350	NXSCRDYONBXVQE-UHFFFAOYSA-N	430.284	1.293	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1cccc(Cl)c1SCC(F)F	756676416	OUSMJCUWQVZGAJ-ZETCQYMHSA-N	430.886	1.788	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)Nc2ccc(NS(C)(=O)=O)cc2)n[nH]1	756707443	PKNJHWBUGQYBKS-UHFFFAOYSA-N	444.473	1.923	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1	756812902	HEXYYRWJCFFWFD-LLVKDONJSA-N	435.437	1.580	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)Nc2cnn(CCN3CCOCC3)c2)cc1	756827697	VQJGCOBVDFWSGE-INIZCTEOSA-N	446.508	1.234	50	20	IDGD	
COc1ccccc1N1CC[C@H](NC(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)C1=O	757284067	BYKPCUKQZXYTSC-HIFRSBDPSA-N	430.436	1.738	50	20	IDGD	
CCOCC(=O)NNC(=O)Nc1sc2c(c1C(=O)N1CCOCC1)CCC(C)(C)C2	757673493	HAQGSYGTVYUYFS-UHFFFAOYSA-N	438.550	1.925	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H]2CN(C3CC3)C[C@@H]2C)c1	757790162	ALRYUYXZLOPLNU-KSSFIOAISA-N	437.566	1.144	50	20	IDGD	
CC(C)Cn1cnc2c1c(=O)n(CC(=O)NN=C[C@@H]1C[C@H]1C)c(=O)n2Cc1ccccc1	758366644	SBHSZHJINJXKSX-AEFFLSMTSA-N	436.516	1.822	50	20	IDGD	
Cc1nc(COc2cccc(C(=O)OCC(=O)NNC(=O)Cc3ccccc3C)c2)no1	758790973	VKDOYGVXWGICST-UHFFFAOYSA-N	438.440	1.812	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)CN1C(=O)N[C@@]2(CCCC(C)(C)C2)C1=O	761625336	HRPTWZYIRXFTRG-OAQYLSRUSA-N	448.545	1.826	50	20	IDGD	
CC1CCN(CC(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)CC1	761711732	JLAKKOFUMKUFCT-UHFFFAOYSA-N	433.516	1.881	50	20	IDGD	
Cc1cc(C(=O)O)cc(S(=O)(=O)NNC(=O)Cc2cccnc2)c1Br	762475547	PIDUTWBXORWUAF-UHFFFAOYSA-N	428.264	1.403	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cnn1-c1ccccc1F	763442071	LBFDVFCVQCXFBW-UHFFFAOYSA-N	426.364	1.628	50	20	IDGD	
CC(C)(C)OC(=O)c1ccccc1NC(=O)C(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	763446458	UBTPFUVJECMNIM-UHFFFAOYSA-N	428.401	1.950	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)N[C@@H]1CC(=O)N([C@H]2C[C@@H]2c2ccccc2)C1	763527172	ZSMLQAGZENZJCG-ZACQAIPSSA-N	440.525	1.972	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(OCC(C)C)nc2)cc(OC)c1OC	763540020	PKYOVMYQCRHOPP-UHFFFAOYSA-N	446.460	1.542	50	20	IDGD	
Cc1ccc(-n2cc(C)cn2)c(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1	763572621	STPCOBAOIRZVET-IBGZPJMESA-N	435.440	1.415	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2cc(C)oc2C)cc1OC	763586115	KGCVNIGMSBTOJL-UHFFFAOYSA-N	438.462	1.066	50	20	IDGD	
COC(=O)c1csc(NC(=O)C(=O)NNC(=O)COc2ccc(C(C)(C)C)cc2)c1	763600244	OFPYGSNKZBPQOY-UHFFFAOYSA-N	433.486	1.997	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccc(NC(=O)[C@@H](C)OC)c1	763710871	CUJUSKUBJUWSNS-CQSZACIVSA-N	442.472	1.387	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(NC(C)=O)c(OC)c1	763711890	BUHBWBXICGADSH-UHFFFAOYSA-N	428.445	1.381	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(Cl)c2)c(OCC(=O)N(C)C)c1	763752520	FZPKUTXSWPEVFI-UHFFFAOYSA-N	432.864	1.515	50	20	IDGD	
O=C(NNC(=O)c1cc2c(s1)CCC2)C(=O)Nc1cccn(CC(F)(F)F)c1=O	763784720	GXZZLYRURFUGBG-UHFFFAOYSA-N	428.392	1.361	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)C(=O)Nc2ccccc2OC)c2ccccc2c1=O	763801376	QLCQQRFEBRSTKB-UHFFFAOYSA-N	437.456	1.605	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(N3CCOCC3)cc2C)cc1	763808906	HQHRPNPCNLLUDB-UHFFFAOYSA-N	426.473	1.305	50	20	IDGD	
Cc1nc(-c2cccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc3cccc(C)c3C)c2)n[nH]1	763839950	HGVAETRUJZRDNN-CQSZACIVSA-N	436.472	1.950	50	20	IDGD	
C[C@H](c1cccc(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)c1)N1CCOCC1	763840314	RBWZTKNLKGBOOZ-OAHLLOKOSA-N	444.463	1.384	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccc(N2C(=O)CCCC2=O)cc1	763842094	BDJVGVZGKIVEDY-UHFFFAOYSA-N	442.403	1.034	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccccc2C(=O)OC)cc1	763860698	KQVXOBWIRZIWDE-ZDUSSCGKSA-N	429.429	1.425	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cc(C)nn2CCC#N)cc1	763862675	YZHRPBNRPGOQOC-CQSZACIVSA-N	428.449	1.057	50	20	IDGD	
CC(C)CC(=O)NNC(=O)C(=O)Nc1cccc(S(=O)(=O)NC2=NCCCCC2)c1	763882169	LCLYENGOSXQHQS-UHFFFAOYSA-N	437.522	1.069	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(C(=O)NC)c2C)cc1OC	763911101	DDJGAHSOZCWQNO-UHFFFAOYSA-N	442.472	1.552	50	20	IDGD	
CS(=O)(=O)CCc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccc(Cl)cc2)cc1	763939599	GRXDLHLFPRFMOM-UHFFFAOYSA-N	437.905	1.256	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2C)cc1OC	763957679	JLFOQFDVWXIOOI-UHFFFAOYSA-N	434.474	1.165	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)c(F)cc1F	763974542	RWTZIIRNKQUVBN-UHFFFAOYSA-N	427.747	1.510	50	20	IDGD	
CC(C)S(=O)(=O)c1ccccc1NC(=O)C(=O)NNC(=O)c1cc(Cl)ccc1O	763979311	SXDRUSNMYHRQBJ-UHFFFAOYSA-N	439.877	1.627	50	20	IDGD	
O=C(NNC(=O)c1ccc[nH]1)C(=O)Nc1ccc(=O)n(Cc2ccc(Cl)c(Cl)c2)c1	763979416	HUMABRJEIIXBDX-UHFFFAOYSA-N	448.266	1.931	50	20	IDGD	
COc1c(Br)cc(Cl)cc1NC(=O)C(=O)NNC(=O)c1cnccn1	764024705	PIOKCYCUGQZVRO-UHFFFAOYSA-N	428.630	1.301	50	20	IDGD	
C[C@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)NNC(=O)CSc2ccccc2O)C1=O	764047290	PGKDZABGMSJQKW-HXUWFJFHSA-N	446.460	1.238	50	20	IDGD	
O=C(NNC(=O)C1CCCC1)C(=O)Nc1cccc(CS(=O)(=O)c2ccccc2)c1	764067135	ZEKBPLDHQVVOMK-UHFFFAOYSA-N	429.498	1.937	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccccc2OCC2CC2)c1	764078026	QGGLXGUSIUTAKH-UHFFFAOYSA-N	431.470	1.279	50	20	IDGD	
Cn1c(=O)n(C)c2cc(NC(=O)C(=O)NNC(=O)Cc3ccc4ccccc4c3)ccc21	764091366	JLNVVRCEIZWOKO-UHFFFAOYSA-N	431.452	1.359	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(I)cc2C)n[nH]1	764098572	PDNVCYIKYWEDMD-UHFFFAOYSA-N	427.202	1.031	50	20	IDGD	
N#Cc1cccc(COc2cccc(NC(=O)C(=O)NNC(=O)Cc3ccncc3)c2)c1	764355830	JUZZZMUQDJCAIX-UHFFFAOYSA-N	429.436	1.861	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)N3C[C@@H](C)O[C@H](C)C3)cc2)o1	764370945	JRHRWWLVLIGMSM-ZIAGYGMSSA-N	428.445	1.237	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@H]2CCCC[C@@H]2N2CCOCC2)c2ccccc2c1=O	764374510	KXLPTTGGNVTSCO-ROUUACIJSA-N	442.520	1.004	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccn(-c4ccncc4)n3)n[nH]2)cc1	764389085	YIKYWCLOHXFRIF-UHFFFAOYSA-N	444.455	1.620	50	20	IDGD	
CCc1c(NC(=O)C(=O)NNC(=O)CSc2ccccc2OC)cnn1CC(C)C	764392919	MTGHJCKWLOMXSZ-UHFFFAOYSA-N	433.534	1.988	50	20	IDGD	
N#CCCSc1ccc(C(F)(F)F)cc1NC(=O)C(=O)NNC(=O)[C@H]1COCCO1	764431985	HLXWLKCRWGEBMF-GFCCVEGCSA-N	446.407	1.212	50	20	IDGD	
Cc1ccccc1-n1nc(C)c2cc(C(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)sc21	764615934	NZQQTWITCIDZNO-ZDUSSCGKSA-N	432.527	1.900	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1ccc(=O)n(Cc2ccccc2Cl)c1	766261012	NKSJMXTVAIAUPP-UHFFFAOYSA-N	428.836	1.430	50	20	IDGD	
COC(=O)[C@@H](NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)c1ccccc1C	767562073	ZTEVAACEDQWOGV-IBGZPJMESA-N	431.514	1.928	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc(Cl)c(F)c(C(=O)O)c1)c1cnn(-c2ccccc2)c1	767736229	HVIUFMWVUMKXAQ-UHFFFAOYSA-N	438.824	1.986	50	20	IDGD	
CCN(Cc1ccccc1)S(=O)(=O)N1CCN(S(=O)(=O)CBr)CC1	767849577	HAWAIMJWHHYWLL-UHFFFAOYSA-N	440.385	1.053	50	20	IDGD	
O=S(=O)(CBr)N1CCN(S(=O)(=O)Cc2ccccc2Cl)CC1	767850828	MUJUDCLEWZXORV-UHFFFAOYSA-N	431.761	1.470	50	20	IDGD	
COCCC(=O)N1CCC(NC(=O)NNC(=O)[C@@H](C)Oc2ccc3ccccc3c2)CC1	769166405	XLPMYKPQKRFUJW-MRXNPFEDSA-N	442.516	1.965	50	20	IDGD	
C[C@H](C(=O)NNc1cc(Cl)nc(N)n1)N1C(=O)c2ccc(Br)cc2C1=O	769652325	YQLQJYWXOOWKSU-ZCFIWIBFSA-N	439.657	1.603	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)N[C@@H]1CCN(c2ccccc2C(N)=O)C1	770514467	PYYJINSWOUXNFW-DZGCQCFKSA-N	445.907	1.816	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)CCn3c(=O)nc(O)c4ccccc43)nc21	770965979	INWGOFDRTPQMII-UHFFFAOYSA-N	438.448	1.236	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)Cc2cc(F)ccc2Br)c2ccccc2c1=O	771228669	NSBLDCPUARIKQQ-UHFFFAOYSA-N	433.237	1.839	50	20	IDGD	
CCN1CCN(c2cccc(NC(=O)NNC(=O)[C@@H]3COc4ccccc4O3)c2)CC1	771272528	LIVZPMLCHDPKMG-FQEVSTJZSA-N	425.489	1.821	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)c2coc(C3CCOCC3)n2)c2ccccc2c1=O	771603988	QYLPYMHGOCYVRB-UHFFFAOYSA-N	425.445	1.934	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNS(=O)(=O)c1ccc(F)c2ncccc12	771609212	WSYCXWZJXHPGBD-UHFFFAOYSA-N	436.852	1.653	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1ccc(S(=O)(=O)N2CCC[C@@H](C)C2)cc1	771942276	WJIZCPUMAPEYMI-KGLIPLIRSA-N	425.507	1.210	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1cc(C(C)C)nc2c1c(O)nc(=O)n2CC(C)C	771992380	GANDGSQYMUKFNK-LBPRGKRZSA-N	447.492	1.379	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2C[C@H](C)N(C(=O)OC(C)(C)C)C[C@@H]2C)n1	772330469	LCWMZZNLLBEDQL-KBPBESRZSA-N	425.555	1.471	50	20	IDGD	
C[C@H]1CN(c2cccc3cnccc23)CCN1C(=O)NNC(=O)CNC(=O)c1ccco1	772352663	CFJZOMMUAVTTRW-HNNXBMFYSA-N	436.472	1.509	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)[C@@H](c1ccccc1)N1CCCCC1=O	772885070	UMEFFWRVLOABDL-LJQANCHMSA-N	442.903	1.857	50	20	IDGD	
COc1cc2c(cc1CNC(=O)NNC(=O)c1csc(N3CCOCC3)n1)O[C@H](C)C2	772973382	KTIRCXRAVKBXAW-GFCCVEGCSA-N	447.517	1.456	50	20	IDGD	
CCCC(=O)N1CSC[C@@H]1C(=O)NNC(=O)[C@H]1CCCN(C(=O)OC(C)(C)C)C1	773420834	PNTPPEWXCPOXKN-UONOGXRCSA-N	428.555	1.483	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)NCc1ccc(S(N)(=O)=O)c(C)c1	775232388	WVZGUUALVFKWHH-UHFFFAOYSA-N	426.882	1.449	50	20	IDGD	
O=C(NNc1ccc(F)cc1Br)N[C@@H]1CCO[C@]2(CCS(=O)(=O)C2)C1	776077449	SOURRTOUYOILPJ-IAQYHMDHSA-N	436.303	1.951	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)COC2CCN(C(=O)OC(C)(C)C)CC2)c1	777128661	YGDZXQMECGOYHR-UHFFFAOYSA-N	449.504	1.715	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)N[C@@H]2CCCN(Cc3cccc(C(F)(F)F)c3)C2=O)cn1	777753328	WNBGDOWHVAZBCR-OAHLLOKOSA-N	438.410	1.574	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)[C@@H]2CCN(c3ccc4c(c3)OCCO4)C2=O)nc1C	778428928	FVBPCARSJNWYGA-AWEZNQCLSA-N	441.444	1.229	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2cc3c(cc2F)NC(=O)CC3)c1	778707140	GRPPSHXIUVCJME-UHFFFAOYSA-N	430.392	1.127	50	20	IDGD	
CC1(C)NC(=O)N(CCCC(=O)NNc2ccc([N+](=O)[O-])cc2Br)C1=O	779145841	ODNFUAXKWBAZQE-UHFFFAOYSA-N	428.243	1.911	50	20	IDGD	
O=C(Cn1nc2ccccn2c1=O)NNc1ccc(S(=O)(=O)Nc2ccccc2)cc1	779193582	GCTCWDQKTNIRIW-UHFFFAOYSA-N	438.469	1.440	50	20	IDGD	
CCO[C@@H]1C[C@](NC(=O)OC(C)(C)C)(C(=O)NNC(=O)C(=O)Nc2ccccn2)C1(C)C	780896604	KVILBQTXFSIJDZ-ASSNKEHSSA-N	449.508	1.266	50	20	IDGD	
COc1cccc(C(=O)NCC(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)c1	782752306	RRBSMHVXTUCOIG-UHFFFAOYSA-N	431.392	1.862	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)C(=O)Nc1ccc(Cl)c(C#N)c1	782896295	FDSYLUYVNLZWOR-UHFFFAOYSA-N	448.892	1.213	50	20	IDGD	
C=CCNC(=O)Nc1ccc(NC(=O)C(=O)NNc2ccc(S(C)(=O)=O)cc2)cc1	783073414	XKUCZAHZEYUNOS-UHFFFAOYSA-N	431.474	1.479	50	20	IDGD	
O=C(NNc1cncc(Cl)n1)C(=O)Nc1cc(N2CCCS2(=O)=O)ccc1Cl	783259817	NQVDLHFNCOXIIG-UHFFFAOYSA-N	445.288	1.405	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NN[C@@]2(C)CCS(=O)(=O)C2)ccc1C(=O)OC(C)(C)C	783424873	GFQPTCPZJWBHSD-IBGZPJMESA-N	425.507	1.087	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1ccc(F)cc1OCC(F)F	784003647	KHUZNIFOBPDPGJ-UHFFFAOYSA-N	444.391	1.047	50	20	IDGD	
CC(=O)Nc1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)cc1	784209192	WNPSPONONDOQNX-UHFFFAOYSA-N	431.474	1.168	50	20	IDGD	
Cc1c(NNC(=O)C(=O)Nc2ccc3nc(N4CCOCC4)oc3c2)cccc1[N+](=O)[O-]	784353111	XGKQSFLIQGPISE-UHFFFAOYSA-N	440.416	1.963	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)COCCNC(=O)c3ccccc3)n[nH]2)c1	784683913	LNZWKDYUUGUYAB-UHFFFAOYSA-N	435.484	1.901	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)COc1cccc(I)c1	785280990	ATVRLRBKHQNYJC-NSHDSACASA-N	448.257	1.795	50	20	IDGD	
CCNC(=O)Nc1ccc(C)c(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)c1	787541953	YOYJQFAEQYPTPY-UHFFFAOYSA-N	438.444	1.173	50	20	IDGD	
C[C@H]1CCC[C@H](C)N1C(=O)COc1ccc(C(=O)NNC(=O)N2CCN(C)CC2)cc1	788165565	CPWJBBJGVHWCMK-IRXDYDNUSA-N	431.537	1.457	50	20	IDGD	
NS(=O)(=O)c1ccccc1NNC(=O)CCn1cnc2sc3c(c2c1=O)CCCC3	788232809	YURIEHFITBAWHW-UHFFFAOYSA-N	447.542	1.518	50	20	IDGD	
CCN1C(=O)c2ccc(C(=O)NNc3nnc(-c4ccccn4)s3)cc2S1(=O)=O	788554896	CXHROSDBPIGYAE-UHFFFAOYSA-N	430.471	1.521	50	20	IDGD	
Cc1c(Br)ccc(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)c1F	789733940	XLMGGTSVLYCWBU-AWEZNQCLSA-N	436.237	1.986	50	20	IDGD	
CCC[C@H](CCCS(C)(=O)=O)C(=O)NNC(=O)c1sc(N2CCOCC2)nc1C	789871286	PBUBVZIRPWLOEL-CQSZACIVSA-N	446.595	1.290	50	20	IDGD	
CS(=O)(=O)CC[C@@H](C(=O)NNC(=O)c1nn(-c2ccccc2)cc1O)c1ccccc1	790488070	YMODNEDLACWGAC-QGZVFWFLSA-N	442.497	1.557	50	20	IDGD	
Cn1nc(Br)c2c(=O)n(CC(=O)NNc3cccc(F)c3[N+](=O)[O-])cnc21	790585840	JEPMPHUYGCLYIB-UHFFFAOYSA-N	440.189	1.083	50	20	IDGD	
CCOC(=O)[C@@H](C)NC(=O)c1ccc(NC(=O)NNc2nc3ccccn3n2)cc1F	792317619	NLMMFZGMKQCGOY-LLVKDONJSA-N	429.412	1.698	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2c(C)nc3ccccn23)cc(-n2cccn2)c1	792356060	YXDVQTTYWRTNBN-UHFFFAOYSA-N	433.428	1.237	50	20	IDGD	
O=C(NNc1nc2ccccn2n1)C(=O)Nc1ccc(Cc2nnc3n2CCCCC3)cc1	792395765	USEFRSVAAAXBTH-UHFFFAOYSA-N	445.487	1.720	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1ncccc1Br	793681718	KBVKEVBUJPCUIE-UHFFFAOYSA-N	446.305	1.063	50	20	IDGD	
C[C@](O)(CN1C(=O)NC2(CCCC2)C1=O)C(=O)NNc1cc(C(F)(F)F)ccc1F	793733644	VHFFEGUKBSHTLO-INIZCTEOSA-N	432.374	1.903	50	20	IDGD	
CCn1c(=O)n(CC)c2nc(NC(=O)CCC(=O)NNC(=O)c3cccc(C)n3)ccc21	794071720	FPTSUSYYVHGHSZ-UHFFFAOYSA-N	439.476	1.121	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Cc2ccc([Si](C)(C)C)cc2)c1	798150669	BVGZOFWTGPNNNR-UHFFFAOYSA-N	433.606	1.486	50	20	IDGD	
COc1cc(I)c(C(=O)NNC(=O)NCC(F)(F)F)cc1OC	798313648	LAIUVIMTUHIRBA-UHFFFAOYSA-N	447.151	1.815	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2ccccc2S[C@H](C)C(N)=O)cc(OC)c1OC	800797876	ZSQRNDYZCMZYTD-LLVKDONJSA-N	433.486	1.753	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(NC(=O)CCn3ccnc3)c2)cc1	801108881	UIUXYFMXYRVXAG-UHFFFAOYSA-N	434.456	1.620	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(C(=O)NNC(=O)Nc2ccc(Br)cc2)co1	801998433	YLCCTMZGWVYAFE-UHFFFAOYSA-N	431.268	1.759	50	20	IDGD	
C[C@H]1C[C@@H](C)CN(S(=O)(=O)c2cccc(C(=O)NNC(=O)N=c3cc[nH]cc3)c2)C1	802030293	YDQLLCZTVKQDDE-GASCZTMLSA-N	431.518	1.637	50	20	IDGD	
CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)NNC(=O)Nc1ccc2c(c1)OCO2	802095856	ROGDNFAXRBXHFG-KRWDZBQOSA-N	441.419	1.936	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)NC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1	802338369	VWKHSWUHWGKEEI-OAHLLOKOSA-N	428.420	1.663	50	20	IDGD	
COC(=O)N(C)NC(=O)/C(C#N)=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	804124087	AEXTVJNTBRKYAH-UKTHLTGXSA-N	430.852	1.715	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@H]2CCOC[C@H]2C)c1	807505410	KOPZJJPEBRXAGA-GDBMZVCRSA-N	426.539	1.334	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)[C@]2(c3ccccc3)CNC(=O)C2)cc1C	811239303	VYYSMTITRYLRQI-NRFANRHFSA-N	429.498	1.381	50	20	IDGD	
COC(=O)C1(CS(=O)(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)CCCC1	811675723	MBKXHGZGRHLZDO-UHFFFAOYSA-N	430.479	1.010	50	20	IDGD	
COc1ccc(C(=O)NCCCC(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)cc1	812733130	ZKDIMVTWZANRPW-UHFFFAOYSA-N	434.518	1.599	50	20	IDGD	
Cc1ccc(Oc2ccccc2)c(NC(=O)C(=O)NNC(=O)[C@H]2CCc3nncn3C2)c1	815691291	LJIPRVXTOVCQEC-HNNXBMFYSA-N	434.456	1.727	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C2CCN(C(=O)c3cccnc3)CC2)cc1	913210949	UBFAVIPVRHYKHD-INIZCTEOSA-N	440.500	1.947	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2ccc(C(=O)NNC(=O)NC3CCCCC3)cc2)C[C@@H](C)O1	913450948	FFGDJEKGDPFJND-GASCZTMLSA-N	438.550	1.761	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)c2cc(S(=O)(=O)NC(C)C)ccc2F)cc1C	914748989	SCYCULQRGDUVKE-UHFFFAOYSA-N	437.493	1.969	50	20	IDGD	
C[C@]12CCC(=O)N1c1ccccc1C(=O)N2CC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	914831956	WZDMFQGUVGQXTF-OAQYLSRUSA-N	437.412	1.355	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)[C@@H]2CCCN2C(=O)C(C)(C)C)c2ccccc2c1=O	914846517	NNQDSRLISFTVKZ-INIZCTEOSA-N	427.505	1.776	50	20	IDGD	
COC(=O)Cc1cc(=O)n(-c2ccc(C(=O)NNC(=O)c3ccc(Cl)cc3)cc2)[nH]1	915188186	ITHCKGGNLSWLRJ-UHFFFAOYSA-N	428.832	1.609	50	20	IDGD	
COc1cc(OC)c2cc(C(=O)OCC(=O)NNC(=O)c3ccccc3)[nH]c2c1OC	915472808	FQLKRPQWVVRSTI-UHFFFAOYSA-N	427.413	1.812	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)N[C@H]2CCc3nc(C)ncc3C2)nc1	916317547	AVBIMSBWOPPNCI-HNNXBMFYSA-N	433.538	1.394	50	20	IDGD	
Cc1ccc(-n2nnc(C(=O)NNC(=O)CCN3CCN(c4ccccc4)CC3)c2C)cc1	917531909	KHCDKOZQTYZVOL-UHFFFAOYSA-N	447.543	1.857	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCC(=O)N(C)Cc2ccccc2)cc(OC)c1OC	918001077	CKUXJNUKHKDRIF-UHFFFAOYSA-N	430.461	1.315	50	20	IDGD	
CCC1(CC)NC(=O)N(CC(=O)NNC(=O)c2ccc(F)cc2Br)C1=O	918341570	OXCZRENAUDVPPL-UHFFFAOYSA-N	429.246	1.460	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)NC2CCN(S(C)(=O)=O)CC2)N(C)c2ccccc21	919702141	RTRVZVWKCVCOGO-UHFFFAOYSA-N	445.545	1.197	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)NC[C@H](c1ccc(C)cc1)N1CCOCC1	919909220	TWXYIDLLBARFBL-HXUWFJFHSA-N	426.517	1.950	50	20	IDGD	
CN(C)C(=O)C[C@H](NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)c1ccccc1	920048233	XWIRRMZMAQEOFW-KRWDZBQOSA-N	436.472	1.097	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)N2CCN([C@H]3CCS(=O)(=O)C3)CC2)c(C)n1CC(C)C	921246067	YIQKTPCHKCJXJH-OCBOALCKSA-N	432.590	1.999	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)COc2ccc(F)cc2Br)c2ccccc2c1=O	933544481	PFKGBAWDROWACH-UHFFFAOYSA-N	449.236	1.675	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)CO[C@@H]3CCOC3)c2)cc1	1116201374	QCNPQPALQCUVME-QGZVFWFLSA-N	449.485	1.063	50	20	IDGD	
CN(NC(=O)c1cccc(N2CCNC2=O)c1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	1338642303	WPKQVLMVCNPCQK-UHFFFAOYSA-N	446.508	1.466	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc4ncccn4n3)C2)C1	1778467559	PTGPMKWBZFSDGI-UGSOOPFHSA-N	436.310	1.346	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)C(=O)Nc3cccnc3)C2)C1	1779205687	BOOXOTADSUAHRP-RDTXWAMCSA-N	439.310	1.024	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@]2(C1)CN(C(=O)Cc1ccc(F)c(C#N)c1)CCO2	1779300224	NLZQLBFTHCOSIH-NRFANRHFSA-N	433.556	1.921	50	20	IDGD	
CCOC(=O)c1cccc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](F)Cl)CCO3)c1F	1780110515	KVVDOWRNPIECBA-KXBFYZLASA-N	430.835	1.980	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)/C(=C/c3ccco3)NC(C)=O)C2)C1	1781858764	ADMCVGZTYRNXQY-UMDQBSQQSA-N	437.924	1.994	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CN1CCOC1=O)C2	1781897591	MMENEBARLDJZMV-PMUMKWKESA-N	446.342	1.126	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ncn(C(C)C)n1)C2	1782172697	KRNGIULFJVRUIV-QMTMVMCOSA-N	427.933	1.240	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)ccc1O)C2	1782178457	JOOYEZUMOATRJI-XAUMDUMWSA-N	426.897	1.479	50	20	IDGD	
CC(C)(C)n1cc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)C(Cl)Cl)C2)nn1	1782218408	YNHBQJYXAAERFG-FZKQIMNGSA-N	432.352	1.964	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnn4c3CCC4)C2)C1	1782313905	FUSZAIFPLXPFSK-SCLBCKFNSA-N	425.327	1.304	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)n2cc(C)cn2)C1	1782515101	DNJLFXIEZFKKMP-TVKQPGBESA-N	426.945	1.520	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@]2(CN(C(=O)CN3CCCC3)CCO2)C1	1782861108	GPOYKZKWEJUANN-KUDIEGTJSA-N	444.482	1.797	50	20	IDGD	
O=C(c1cc[nH]n1)N1CCO[C@]2(CCN(C(=O)[C@H](Br)Cc3ccccc3)C2)C1	1783018204	IYFPZSIFBXHETF-UZLBHIALSA-N	447.333	1.859	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)C3CCC(CO)CC3)CCO2)C1	1783341726	DNHODZPVKFFEAT-GETDIDHLSA-N	431.371	1.789	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cncc(N(C)C)c3)CCO2)C1	1783531895	FIGLMVNRJDRZEU-SCLBCKFNSA-N	425.327	1.375	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(O)c(O)c(Cl)c3)CCO2)C1	1783536566	KDSHPNXHKDNOFN-QGHHPUGFSA-N	447.713	1.978	50	20	IDGD	
COc1c(Cl)cccc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]2C1	1784095877	NCJFXUBFRKNIPW-YUDUHTQSSA-N	431.316	1.542	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C34CC(C(F)(F)F)(C3)C4)[C@H]2C1	1784655803	XJDULFMARMASMO-VJUSUEHQSA-N	438.874	1.953	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccccc3C3CC3)C2)C1	1784952218	LTCDYRXGJSYGSS-XMMPIXPASA-N	449.511	1.320	50	20	IDGD	
C#CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](Cl)CC)CCO2	1785575834	GJVYBGYCPMIEJE-VWKPWSFCSA-N	441.956	1.750	50	20	IDGD	
COc1ncc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)Br)C[C@@H]32)cc1C	1786270876	GYQREXZERPMWGV-SDADXPQNSA-N	440.338	1.775	50	20	IDGD	
Cc1cc(NC(=O)CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)C(Cl)Cl)C[C@@H]32)no1	1787493194	PBYRCPSTFBPACO-SRVKXCTJSA-N	433.292	1.095	50	20	IDGD	
COc1ccnc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)CBr)C[C@@H]32)c1	1788889238	WCMUUGKZAOMVNB-HPZZRFSDSA-N	440.338	1.715	50	20	IDGD	
CCc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](Br)CC)[C@H]3C2)n[nH]1	1790962200	XQEHIMMYDMRWEQ-PCBIJLKTSA-N	427.343	1.739	50	20	IDGD	
Cc1cnn([C@@H](C)C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)CBr)C[C@@H]32)c1	1791592528	GUGICHDPVRTEAR-WOYTXXSLSA-N	441.370	1.763	50	20	IDGD	
O=C(CCc1noc(-c2ccccc2)n1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCl	1793115139	AHEGLSWKPIEUEF-YVSFHVDLSA-N	432.908	1.907	50	20	IDGD	
CCC[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCl	1793117454	MCUONQPNMMWDSO-YIDVYQOGSA-N	431.961	1.918	50	20	IDGD	
Cc1nc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)CBr)C3)cs1	1794079903	MEXKBZPNDPOMHU-VFFTVRQLSA-N	430.368	1.615	50	20	IDGD	
Cc1csc(CCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)c1	1794355822	MPYRKGNHAWAFPZ-REPLKXPHSA-N	426.347	1.621	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1(C#N)CC1	1795407882	FEZYCFKNSYQAEM-XGUBFFRZSA-N	440.928	1.012	50	20	IDGD	
CCc1nn(C)c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](O)CCl)C3)c1Br	1796417956	BHFQAJPLVQTBIL-LSCVPOLPSA-N	447.761	1.597	50	20	IDGD	
C[C@H]1CCc2c(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@H](F)Br)C4)n[nH]c21	1796972543	ZMYCACHWJOHSLJ-SGESHLDCSA-N	429.290	1.353	50	20	IDGD	
Cc1cc(CCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)ccn1	1798440811	UZXRXHZYKOGSEP-BCDXTJNWSA-N	436.516	1.273	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(OC)cc(OC)c1F	1798548088	ZADSZNYUAHENMF-TYYYEBLRSA-N	444.887	1.300	50	20	IDGD	
Cc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)Br)C3)n(C(F)F)n1	1798681950	JXHUSFDGZVPLGA-HNCHTBHHSA-N	435.269	1.573	50	20	IDGD	
CN(C)c1cccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Br)C3)c1	1798886306	ZQURXIZQSXHKGE-XRGAULLZSA-N	428.302	1.646	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cncc(C(F)(F)F)c1)c1ccc(B(O)O)cc1	1798941953	FVUUBORLUOLVAY-BCDXTJNWSA-N	447.222	1.346	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN(C(=O)OC(C)(C)C)C1CC1)C2	1799264396	HKDOOZPDHBEHJG-CXHZTBPHSA-N	443.972	1.993	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCNC(=O)OC(C)(C)C	1800169133	MNPKEXOEIXRLHE-YIDVYQOGSA-N	447.960	1.154	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1cnn(C)c1)C2	1800638995	FVIKWGGMNYYZJC-IVSAIRAKSA-N	427.343	1.116	50	20	IDGD	
CCc1[nH]nc(C(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]2c2cccnc2)c1Cl	1803139360	XMENLVGWMYGGAY-SUYBPPKGSA-N	440.331	1.940	50	20	IDGD	
COc1ccnc(C(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)c1OC	1803140863	IOWMZMDBDUTZDD-RKVPGOIHSA-N	448.907	1.413	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CC[C@@H]1CCOC1	1803346593	SFIAHLDFXVWGMY-UONOVLGTSA-N	429.521	1.575	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)[C@@](C)(O)C(F)(F)F)[C@H]1c1cccnc1	1803998607	QFEAZERUSDXGTR-UMPJEAMMSA-N	437.846	1.655	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)c2ncc[nH]2)[C@H]1c1cccnc1	1805156678	VTGKRQYDCCNMNJ-YCIBLXSWSA-N	448.487	1.258	50	20	IDGD	
O=C([C@H](O)CCl)N1CCCC2(CCN(C(=O)[C@@H]3CC[C@@H]4CCC(=O)N4C3)CC2)C1	1805525373	PXRDDLIDMCUUAJ-BRWVUGGUSA-N	425.957	1.218	50	20	IDGD	
CN(CC(=O)N1CCCC2(CCN(C(=O)[C@@H](O)CCl)CC2)C1)C(=O)c1ccccc1	1805843213	IRPXOWHORPKNJY-SFHVURJKSA-N	435.952	1.590	50	20	IDGD	
O=C(CC(F)(F)F)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1806835358	CSKNTEIHSDXKTN-QAPCUYQASA-N	435.211	1.033	50	20	IDGD	
O=C(c1ccn2ccnc2c1)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1	1809978680	KJGYCWUHJXNMNC-UHFFFAOYSA-N	446.316	1.173	50	20	IDGD	
Cn1ncc(C(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@H]2c2cccnc2)c1Cl	1811165396	RSQLZFDMJADUPT-CFVMTHIKSA-N	426.304	1.388	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1ccc(F)cc1	1811900226	LXLTTZQEJPIBJR-DENIHFKCSA-N	447.275	1.534	50	20	IDGD	
Cc1cccnc1C(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1813068997	RIGLYUYLOWYCSN-AVRDEDQJSA-N	438.532	1.478	50	20	IDGD	
C#CCCCCC(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1813073721	LVJMVTRPFLFBDS-WMZHIEFXSA-N	427.549	1.654	50	20	IDGD	
O=C(CN1CCOCC1)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](F)Br)CC2	1814569246	XJLMYBFJBHYTEQ-ZANVPECISA-N	435.319	1.078	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CN2CCOC2=O)n[nH]1	1815023883	VSIDNZSZVYFABG-WCQYABFASA-N	442.314	1.885	50	20	IDGD	
Cc1noc(CC(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@@H](F)Br)CC3)n1	1815565908	RODONVRLVPSWCC-JMCQJSRRSA-N	432.275	1.680	50	20	IDGD	
C[C@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1	1816728260	CWHNQJKXDNKUHV-CBAPKCEASA-N	441.307	1.959	50	20	IDGD	
C[C@@H](CS(C)(=O)=O)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCBr)n[nH]1	1816781173	FXOQELDWFOMJBZ-AAEUAGOBSA-N	449.371	1.868	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](C)[C@H]3SC(=N)NC3=O)sc2C1	1817249512	DZZLWUXHUMXOKJ-KIKITERTSA-N	443.982	1.875	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)Cc2ccccn2)n[nH]1	1817642886	VAYUQLJSJJSSJT-KRWDZBQOSA-N	427.509	1.413	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cccc(=O)n2O)[nH]n1)[C@H](F)Br	1820931083	FTGHZKHOEIARHK-YGRLFVJLSA-N	442.245	1.805	50	20	IDGD	
O=C(/C=C\C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](F)Br)n[nH]1)NC1CC1	1820935503	NJURNCUNAMWXMY-VLZSXYJSSA-N	442.289	1.927	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)C2CCSCC2)n[nH]1	1823548502	RPWGFQTXAKNTPN-INIZCTEOSA-N	436.582	1.918	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CS(C)(=O)=O)CC1	1824093021	KCFQENFJDCSUAT-HIFRSBDPSA-N	437.400	1.682	50	20	IDGD	
NC(=O)c1ncccc1C(=O)N[C@@H]1CCc2nc(NC(=O)C(Cl)Cl)sc2C1	1826093767	XVRUTQXHDPYHFU-SSDOTTSWSA-N	428.301	1.667	50	20	IDGD	
CN[C@H](CC(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H](C)CBr)CC1)C(=O)O	1826938460	AAOFAWVIOFSYEG-FVQBIDKESA-N	446.386	1.700	50	20	IDGD	
O=C(C#Cc1ccccc1)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827051037	LJUUGDGCVBUJKX-XMMPIXPASA-N	444.340	1.651	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)c2cnccc2F)CC1	1827321321	ZOLOYGMZMYPULP-OAQYLSRUSA-N	439.296	1.448	50	20	IDGD	
COC(=O)c1ccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)[C@H](O)CCl)CC2)cn1	1827789340	WARCVTKBHGGMQL-QZTJIDSGSA-N	437.924	1.701	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CC[C@H](C(=O)OC)C1)CCO2	1830714243	NQRXQANBGOBSLH-ZKNHNOBHSA-N	430.929	1.050	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ncc(Cl)cn3)C2)C1	1831644078	NNMCJZRWKQUPRT-KDOFPFPSSA-N	431.320	1.608	50	20	IDGD	
CNC(=S)NCCC(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](C)Br)CC1	1831654714	GRJWDRWAPFDIFC-HIFRSBDPSA-N	447.443	1.874	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccnc2C(N)=O)CC1	1831827873	LRWAGKUISJSQMZ-IAGOWNOFSA-N	436.940	1.668	50	20	IDGD	
COc1ccc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)nc1	1831873111	JZXLFZBAYJGDPS-FQEVSTJZSA-N	445.564	1.697	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(F)(F)C(F)F)CCO2	1832193637	SQXWBKWBGNJKMY-RNCFNFMXSA-N	435.212	1.127	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)Cn1cccn1)CCO2	1833191691	RSXMRHLCWQXNLM-UWVAXJGDSA-N	426.945	1.383	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)C3CC(O)C3)CC2)CC1	1833274998	UZRNBIUUCSPRIA-TUBUQKNSSA-N	430.387	1.360	50	20	IDGD	
Cc1cnc(Cl)c(C(=O)N2CCC(N3CCC(NC(=O)[C@@H](O)CCl)CC3)CC2)c1	1833308850	AWKPFVFSDVXIOT-KRWDZBQOSA-N	443.375	1.828	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)CN3CCOC3=O)CC2)CC1	1833383985	AEDNMLHFGLDKTJ-QGZVFWFLSA-N	428.961	1.418	50	20	IDGD	
Cc1cccc(C(=O)N2CCOC[C@]3(CN(C(=O)CCBr)CCO3)C2)c1F	1834819028	DHPVWSKPIIQUJU-IBGZPJMESA-N	443.313	1.989	50	20	IDGD	
CCc1cc(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](Cl)COC)CC3)CC2)n(C)n1	1835958062	PNFPZLDQXBYISJ-SFHVURJKSA-N	439.988	1.422	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CSc3ncccn3)CCO2)C1	1836115604	ZKXUWNPJYVHRHP-KBXCAEBGSA-N	428.942	1.043	50	20	IDGD	
O=C(Cc1ncccn1)N1CCC(OC2CCN(C(=O)[C@H](F)Br)CC2)CC1	1837211292	GCPADIDOQVHKMY-KRWDZBQOSA-N	443.317	1.708	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)c3cnnn3C)CC2)CC1	1837232487	ALMBBGJWKXLHRB-LBPRGKRZSA-N	428.331	1.211	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)c(O)c1	1837717645	LJLMVDJHZFAOIG-NRFANRHFSA-N	436.581	1.622	50	20	IDGD	
Cc1nccn1[C@H](C)C(=O)N1CCOC[C@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1837718084	XIWYHGDKUKUMOL-UZLBHIALSA-N	438.601	1.060	50	20	IDGD	
O=C(c1cc(Cl)cc(Cl)n1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1838240004	FXNDEDRCAKEAEB-CZUORRHYSA-N	440.686	1.993	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3n[nH]c(C4CC4)c3F)C2)C1	1839143436	WEXKMLWUGCXCPX-ORAYPTAESA-N	428.892	1.514	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3coc(Cl)n3)C2)C1	1839151549	WAEFDVZONJSBGP-HOTGVXAUSA-N	440.711	1.634	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)Oc1ccccc1)CCO2	1839219827	XIGSHMMXYYPVKI-HGHGUNKESA-N	440.924	1.164	50	20	IDGD	
Cc1n[nH]c(C)c1CC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1	1839241337	KEDHXJGLXWGWBA-MOPGFXCFSA-N	447.363	1.262	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(F)c[nH]3)C2)C1	1839966411	CVDMICZMXYHCGN-GUYCJALGSA-N	432.290	1.397	50	20	IDGD	
Cc1cccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)n1	1840030940	AVHGORJFPNGAKU-RDTXWAMCSA-N	426.311	1.243	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3c(F)cncc3F)C2)C1	1840033642	MCRCVEHBWPFIAI-PIGZYNQJSA-N	448.264	1.213	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4sccc4[nH]3)C2)C1	1840153194	HCBOIOVLASRWLM-DJJJIMSYSA-N	441.937	1.553	50	20	IDGD	
O=C(c1ccc(-c2ncc[nH]2)cc1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1840747615	ZXGSOAZPKMCUGX-OXJNMPFZSA-N	436.871	1.681	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(O)(C(=O)N2CCCC23CN(C(=O)[C@H](F)Cl)C3)CC1	1841788769	VKBOXZNRXGKBJE-ZDUSSCGKSA-N	433.908	1.486	50	20	IDGD	
CC(C)(C)Oc1ccc(C(=O)N2CC3(CCCN3C(=O)c3cccc(B(O)O)c3)C2)cc1	1843014761	YKMHNGYNOVUIBK-UHFFFAOYSA-N	436.317	1.675	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@](O)(C(=O)N2CC3(CCCN3C(=O)C(Cl)Cl)C2)C1	1846389072	ADAVRNYMOXZRJL-GOSISDBHSA-N	436.336	1.365	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)c2ccc(OCC3CC3)cc2)C1	1846861694	QTJUXJLXDDHFMJ-UHFFFAOYSA-N	434.301	1.286	50	20	IDGD	
CC(C)(C)OC(=O)CCCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cnccc1C(=O)NN	1847588780	NWBNKAJFWMFPMR-IRXDYDNUSA-N	445.520	1.013	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cccc(N3CCCC3=O)c2)cc1	14844752	KEGNBKWCXLVYOY-UHFFFAOYSA-N	444.513	1.204	50	20	IDGD	
CCNS(=O)(=O)c1ccc(C(=O)NNC(=O)[C@H](C)Oc2ccc(OCC)cc2)cc1	18071972	MPNYSFISQOAGJC-AWEZNQCLSA-N	435.502	1.612	50	20	IDGD	
N#CCCNS(=O)(=O)c1ccc(C(=O)NNC(=S)NCCc2cccs2)cc1	21125462	FCAACCONMSNLPW-UHFFFAOYSA-N	437.572	1.292	50	20	IDGD	
CC(C)[C@H](NC(=O)COc1ccccc1)C(=O)NNC(=O)[C@H]1COc2ccccc2O1	21190763	OKHRNKQLRIPJPC-QUCCMNQESA-N	427.457	1.194	50	20	IDGD	
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)[C@H](C)Oc1ccc(F)cc1	24296714	LQYJVXGTQBNMFV-RBZFPXEDSA-N	426.448	1.969	50	20	IDGD	
CC(C)C[C@H](C(=O)NNC(=O)c1ccc2c(c1)OCO2)N1C(=O)[C@H]2CC=CC[C@@H]2C1=O	26964368	NTWTXTRQOFWHFO-HRCADAONSA-N	427.457	1.542	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)[C@H]1CCN(c2ccc(Cl)c(Cl)c2)C1=O	725740711	IGSMPQLHBQXJOS-LLVKDONJSA-N	439.255	1.517	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)c2cc([N+](=O)[O-])cc3c2OCCO3)cc1	727295311	FUYBHKWOBDFOLC-LBPRGKRZSA-N	431.401	1.993	50	20	IDGD	
CCS(=O)(=O)CCNC(=O)NNC(=O)CCCOc1ccc(Cl)cc1Cl	727944086	VMPJKWLACYTVBJ-UHFFFAOYSA-N	426.322	1.918	50	20	IDGD	
Cc1nc2ccccc2c(=O)n1-c1ccc(C(=O)N([C@H]2CCS(=O)(=O)C2)N(C)C)cc1	728177995	QVDNHKFYOYZMPU-SFHVURJKSA-N	440.525	1.800	50	20	IDGD	
CCCNC(=O)NNS(=O)(=O)c1ccc(S(=O)(=O)N2C[C@@H](C)C[C@@H](C)C2)cc1	728262593	HBFPXTFNJJREKB-OKILXGFUSA-N	432.568	1.256	50	20	IDGD	
COC(=O)Nc1cccc(C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)c1	728511644	XMDZUSKOHKAMHL-UHFFFAOYSA-N	434.474	1.255	50	20	IDGD	
O=C(CNS(=O)(=O)c1cccc(C(F)(F)F)c1)NNC(=O)c1ccc(Cl)nc1	729320844	KSYPHQKNKMNSOU-UHFFFAOYSA-N	436.799	1.493	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc(Br)cc([N+](=O)[O-])c1)c1ccc([N+](=O)[O-])cc1	731181650	VIKNPVXFWVJALC-UHFFFAOYSA-N	445.207	1.889	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2ccc(C)c(S(N)(=O)=O)c2)cc1Br	732307023	LKTYWXFCDVJWSH-UHFFFAOYSA-N	442.291	1.488	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)N[C@@H]1CCN(c2ccccc2C(N)=O)C1	732589532	CNOSRKPMDUTDSD-UONOGXRCSA-N	429.452	1.301	50	20	IDGD	
O=C(CN1CCN([C@H]2CCN(c3ccccc3)C2=O)CC1)NNC(=O)c1ccc(F)cc1	732984853	HGOLPHJXDHVPDW-FQEVSTJZSA-N	439.491	1.010	50	20	IDGD	
CCS(=O)(=O)C[C@@H](C)N(C)C(=O)NNC(=O)c1ccc(OC)c(Br)c1	733348153	LOIFOEALUGABNH-SNVBAGLBSA-N	436.328	1.567	50	20	IDGD	
CCc1cc(NNC(=O)c2ccc(OC)c(S(=O)(=O)NC)c2)nc(-c2ccccn2)n1	734357177	VKVRESYFRWXGQF-UHFFFAOYSA-N	442.501	1.775	50	20	IDGD	
COc1ccc(S(=O)(=O)C[C@H](C)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1	735012767	HKWJPUVSFODDBP-HNNXBMFYSA-N	442.497	1.752	50	20	IDGD	
CCCCN1C(=O)CC[C@@H](C(=O)NNC(=O)c2cnn(C)c2)[C@@H]1c1ccccc1OC	735445953	KVIBKLDOSAGDIT-XLIONFOSSA-N	427.505	1.970	50	20	IDGD	
CC(=O)NC[C@@H]1CN(C(=O)CCC(=O)C(C#N)=C2N(C)c3ccccc3N2C)CCO1	735477619	DTTVKOPRHJWROY-MRXNPFEDSA-N	425.489	1.021	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)N[C@@H]2CCN(c3cnn(C)c3)C2=O)cc1OC	735583683	AVALANYQSRCXIY-MRXNPFEDSA-N	444.492	1.357	50	20	IDGD	
O=C(Cc1ccc(S(=O)(=O)CC(F)(F)F)cc1)NNC(=O)c1cccc([N+](=O)[O-])c1	736451982	CGZRGRNFCPNXLM-UHFFFAOYSA-N	445.375	1.935	50	20	IDGD	
CC(C)C[C@@H](C(=O)NNC(=O)COCc1ccccc1)N1C(=O)[C@H]2CC=CC[C@H]2C1=O	737634663	LCDRIWXWNXNOMM-OTWHNJEPSA-N	427.501	1.717	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(N2CCOC2=O)cc1)c1cnn(-c2ccccc2)c1	740812023	NHCZATXYPWBKEH-UHFFFAOYSA-N	427.442	1.452	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)NCc2cc(F)ccc2N2CCOCC2)cc1C	741093167	NSGLPOSOVYUHEE-UHFFFAOYSA-N	443.479	1.748	50	20	IDGD	
CN(CC(=O)NNC(=O)c1ccc(F)cc1)C[C@H](O)COc1ccccc1C(F)(F)F	741799704	PCOSFQCVOSLFOX-HNNXBMFYSA-N	443.397	1.977	50	20	IDGD	
O=C(CN1CCS(=O)(=O)CC1)NNc1c(Cl)cc(Br)cc1Cl	742005319	TWPVHLIYVDWELM-UHFFFAOYSA-N	431.139	1.929	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1ccc(-c2noc(-c3ccc(F)cc3)n2)cc1	742491519	XBUIJDJUAHPASI-OAHLLOKOSA-N	444.444	1.738	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)c1ccc(-n2cncn2)cc1	743506058	JWDJZPOBJJXAIM-CYBMUJFWSA-N	443.489	1.768	50	20	IDGD	
COc1ccccc1-c1noc([C@H](C)NC(=O)NNC(=O)CNC(=O)c2cccs2)n1	743577503	PTOWDTLZKDKKSS-NSHDSACASA-N	444.473	1.628	50	20	IDGD	
CN1CCC(N2CC[C@@H](NC(=O)NNC(=O)Nc3ccc(OC(F)F)cc3)C2)CC1	743626823	NUAHLSLTPQQSBM-CQSZACIVSA-N	426.468	1.792	50	20	IDGD	
Cc1cccc([C@H](CC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)NC(N)=O)c1	743830359	CUTMFPSXBJMVPK-INIZCTEOSA-N	433.490	1.351	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)c2cc(N3CCOCC3)ccn2)c2ccccc2c1=O	743908225	GJAMMGMMQQIAKZ-UHFFFAOYSA-N	436.472	1.284	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)[C@H](NC(=O)c2ccco2)c2ccccc2)cc1	744548226	YLLUOUDDJQWEMU-HXUWFJFHSA-N	446.419	1.627	50	20	IDGD	
O=C(COC(=O)c1cnc(-c2ccncc2)s1)NNC(=O)c1cccc([N+](=O)[O-])c1	745169198	JPKBUTYZALZKGR-UHFFFAOYSA-N	427.398	1.731	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)NCCCN1CCC[C@H](C(N)=O)C1	745828905	AWHLMNDKRHQFSZ-APWZRJJASA-N	441.532	1.525	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCc2nc(C)c(C)s2)cc1	745923337	NOKYEWHQAPNSTD-UHFFFAOYSA-N	425.536	1.219	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCOCC2)cc1C(=O)NNc1cc(F)c(F)c(F)c1	746707060	SOZZTZMMOGKGOO-UHFFFAOYSA-N	445.419	1.890	50	20	IDGD	
O=C(CSCc1nc(O)c2c3c(sc2n1)CCC3)NNC(=O)Cc1ccncc1	747429383	LRBLZNVNEMNVGW-UHFFFAOYSA-N	429.527	1.904	50	20	IDGD	
CC1=C(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)C(=O)OC1(C)C	748557572	MZHNBUVBSLRLGA-UHFFFAOYSA-N	435.502	1.274	50	20	IDGD	
Cn1c(N)c(C=NNC(=O)c2sc(-c3ccc(Cl)cc3)cc2N)c(=O)n(C)c1=O	749810372	SKVQWYOSSNIZNS-UHFFFAOYSA-N	432.893	1.394	50	20	IDGD	
COCCN(CC(=O)NNc1nc(Br)cn2ccnc12)C(=O)OC(C)(C)C	750243420	HYTGHFVRKCPBBX-UHFFFAOYSA-N	443.302	1.818	50	20	IDGD	
CCCCN1C(=O)CC[C@@H](C(=O)NNC(=O)C(=O)NC2CC2)[C@H]1c1ccccc1OC	750873365	NXXZUDNAKREQRC-VQIMIIECSA-N	430.505	1.201	50	20	IDGD	
COc1cc(OC)cc(N2C[C@@H](C(=O)NNC(=O)COc3ccc(C)cc3)CC2=O)c1	752400622	SDSQJRDXOIRYTA-HNNXBMFYSA-N	427.457	1.592	50	20	IDGD	
O=C(Cc1cc[nH]n1)NNC(=O)c1nn(-c2cccc(Br)c2)c2c1CCC2	755288023	BYKODEXDELORCO-UHFFFAOYSA-N	429.278	1.850	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C)c(C)c(NC(=O)NNC(=O)[C@H](C)OCCOC)c1	755537230	MKKQIBNGKQJBHQ-HNNXBMFYSA-N	444.554	1.538	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2cccnc2N2CCOCC2)c2ccccc2c1=O	756182065	BSWOCYKHFNCDMY-UHFFFAOYSA-N	437.460	1.115	50	20	IDGD	
COCCOc1ccc(NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1F	756204741	ZASDPCXWYOYPNX-UHFFFAOYSA-N	425.438	1.721	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@@H](C)c2ccc([S@](C)=O)cc2)c2ccccc2c1=O	756736877	JFDXGSZNCTURBE-FYKVGYICSA-N	441.513	1.859	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2ccc(C)c(C(=O)NNc3ccc(C(N)=O)nn3)c2)cc1	757408296	QOCPGOZYRBLUNZ-UHFFFAOYSA-N	440.485	1.750	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(F)(F)[C@@H](C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)C1	757758308	AKBSUPQVGZIBDJ-DOMZBBRYSA-N	441.431	1.866	50	20	IDGD	
Cc1nc(COc2cccc(C(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)c2)no1	758072749	YQPFYTFTYDXUIV-UHFFFAOYSA-N	434.412	1.279	50	20	IDGD	
CN(NC(=O)c1cnc2sccn2c1=O)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758785740	FDVOPTBGGYHAOM-UHFFFAOYSA-N	436.494	1.005	50	20	IDGD	
Cc1c(CNC(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)cnn1C	759608992	OGDYELGAZQUWBR-UHFFFAOYSA-N	448.530	1.735	50	20	IDGD	
N#C/C(=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)NC[C@H](O)C1CC1	759644241	QLTHTKGTMIXSCO-DWCFMXGVSA-N	427.892	1.873	50	20	IDGD	
CN(C(=O)/C(C#N)=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)[C@@H]1CCNC1=O	760118867	MPUGXAHNDZGKNK-IDKBZEPQSA-N	440.891	1.333	50	20	IDGD	
Cc1c(S(=O)(=O)NNC(=O)C2CCN(c3ncccn3)CC2)oc2ccc(F)cc12	760363745	SLXUVLGQZBKNLR-UHFFFAOYSA-N	433.465	1.896	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)c1ccc(S(=O)(=O)N(C)OC)cc1	761636912	KUXGAZRQFYDQER-UHFFFAOYSA-N	439.515	1.430	50	20	IDGD	
CCCS(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)c2cccc(C#N)c2)cc1F	762474464	GXGVPRQIMDIOLT-UHFFFAOYSA-N	440.478	1.472	50	20	IDGD	
CC(=O)NNC(=O)C(=O)Nc1cccc(C(=O)OC[C@H]2CCCN2C(=O)OC(C)(C)C)c1	763516782	NHIPLSXBUDYWDO-MRXNPFEDSA-N	448.476	1.349	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(CN3CCOC3=O)c2)cc1OC	763550740	RCJWPROQODNHJX-UHFFFAOYSA-N	442.428	1.056	50	20	IDGD	
CC[C@H](C)n1ncc(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1C1CC1	763570213	DFXWLPZILQLMAL-SJCJKPOMSA-N	427.461	1.657	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(NC(=O)NC[C@@H]3CCCO3)cc2)c(C)o1	763583334	MHQYSTPPCUHOCO-INIZCTEOSA-N	443.460	1.597	50	20	IDGD	
CO[C@H](C)C(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2cc(C)nc3ccccc23)c1	763616637	OKQJHXTVWBVIOR-CQSZACIVSA-N	449.467	1.916	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1ccn([C@H](C)c2ccccc2)n1	763625422	QVUZJCLRJJSXOX-OAHLLOKOSA-N	431.456	1.848	50	20	IDGD	
C[C@H](c1ccccc1)n1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)n1	763675686	YQQVEHOMWDBRMT-OAHLLOKOSA-N	432.440	1.529	50	20	IDGD	
O=C(CSc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1ccc(-n2cncn2)c(F)c1	763735850	QYONQYLDDDIRAD-UHFFFAOYSA-N	448.867	1.938	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(Cl)c2)cc1N1CCOC1=O	763750515	ONKLHIZYJKNYEO-UHFFFAOYSA-N	432.820	1.705	50	20	IDGD	
Cc1cc(F)cc(NC(=O)C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)c1	763791984	ZMWJTGFDVAVDCN-UHFFFAOYSA-N	425.420	1.825	50	20	IDGD	
CC(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])cc1Cl	763802307	AJPJLDZDDHYJST-UHFFFAOYSA-N	434.792	1.616	50	20	IDGD	
CC(C)(C)Oc1ccccc1NC(=O)C(=O)NNC(=O)COc1ccccc1[N+](=O)[O-]	763803191	IXDSPCZZNFJMIW-UHFFFAOYSA-N	430.417	1.937	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(N3C[C@H](C)O[C@@H](C)C3)cc2)cc1	763809929	VVSHAUQUGLNAMZ-IRXDYDNUSA-N	440.500	1.774	50	20	IDGD	
CCc1nnc(-c2ccc(NC(=O)C(=O)NNC(=O)COc3ccccc3C#N)cc2)o1	763814105	PHGNXTQVCDTWTN-UHFFFAOYSA-N	434.412	1.336	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccccc2CN2CCc3ccccc32)n1	763892200	AWXSCSRHEJTGDU-UHFFFAOYSA-N	446.511	1.849	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F	763919169	SBNSBIKHFJQELT-UHFFFAOYSA-N	426.307	1.664	50	20	IDGD	
CCOC(=O)c1cn(C)nc1NC(=O)C(=O)NNC(=O)c1cc2c(s1)CCCCC2	763962876	UDOAGASYOMQQLZ-UHFFFAOYSA-N	433.490	1.327	50	20	IDGD	
COC(=O)N(C)Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)cc1	763977799	VGLZNHHHHPRQDQ-UHFFFAOYSA-N	434.836	1.644	50	20	IDGD	
CN(C)c1nc2cc(NC(=O)C(=O)NNC(=O)c3cc(-c4ccccc4)on3)ccc2o1	764003640	KSQVYEKPBDVULC-UHFFFAOYSA-N	434.412	1.949	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccccc1CC(=O)OC(C)(C)C	764047226	FKBDQPIIEMMBRH-UHFFFAOYSA-N	427.457	1.979	50	20	IDGD	
CCOC(=O)c1cnn(-c2cccc(NC(=O)C(=O)NNC(=O)C3CCCC3)c2)c1C	764071170	QHBBGUOKLRRAKE-UHFFFAOYSA-N	427.461	1.634	50	20	IDGD	
Cc1ccc(-n2nc(-c3ccco3)cc2NC(=O)C(=O)NNC(=O)c2cc(C)[nH]n2)cc1	764100097	VKKQRNAXORORQH-UHFFFAOYSA-N	433.428	1.872	50	20	IDGD	
CC[C@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)cc1	764127064	SATQHSQUUOYOQC-NSHDSACASA-N	432.864	1.974	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccccc1N1C[C@@H](C)O[C@H](C)C1	764132877	RKWDFBLVJWJUJQ-HZPDHXFCSA-N	440.500	1.637	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2O1)C(=O)Nc1cccc(OCc2cscn2)c1	764164441	PPINXPCRKZYGRJ-GOSISDBHSA-N	438.465	1.812	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2O1)C(=O)Nc1ccc(-c2n[nH]c(C3CC3)n2)cc1	764164888	UTGZIQPEFBLPMU-KRWDZBQOSA-N	432.440	1.439	50	20	IDGD	
CN(C)C1CCN(c2ccc(NC(=O)C(=O)NNC(=O)c3cccc(C#N)c3)cc2)CC1	764237979	NSQXBQODNQLNMP-UHFFFAOYSA-N	434.500	1.488	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)C(=O)Nc1cc(Cl)ccc1C(=O)N1CCCC1	764268848	ROYWDVICBPGECK-UHFFFAOYSA-N	429.864	1.300	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)C(=O)Nc1cc(F)ccc1OC[C@H]1CCCO1	764281509	YJLGVHVSAROWLI-MRXNPFEDSA-N	445.447	1.808	50	20	IDGD	
CCNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(CC)cc3)[nH]n2)c1	764384624	HCLRQDQFZDMBBS-UHFFFAOYSA-N	448.483	1.789	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)nn1-c1ccccc1	764402113	XYNHVFMEKXOHNF-UHFFFAOYSA-N	425.470	1.765	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(N2CCOCC2)c(NC(=O)NNC(=O)OC(C)(C)C)c1	765231877	ZDOVURUCNBIYPJ-UHFFFAOYSA-N	443.526	1.335	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1ccc(NC(=O)CN2CCCCCC2)cc1	766260136	AIRWGXUVTCLPIL-UHFFFAOYSA-N	441.492	1.382	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)[C@H](F)c3ccccc3)CC2)cc1	769003876	LUOXGSVTKPFPFT-HXUWFJFHSA-N	448.520	1.160	50	20	IDGD	
O=C(Cn1cc(NC(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)cn1)NC1CC1	770048430	HMXCGQGHQIIAHY-UHFFFAOYSA-N	428.421	1.307	50	20	IDGD	
Cn1ccnc1[C@H](NC(=O)NNc1nc(O)c2cnn(C)c2n1)c1ccc(Cl)cc1	770342827	JPFMFMLGTNOKFI-CYBMUJFWSA-N	427.856	1.872	50	20	IDGD	
CN(CC(=O)NNc1nc(O)c2cnn(C)c2n1)C(=O)c1ccc(Br)s1	770973605	FKSLBRIQEPERDM-UHFFFAOYSA-N	440.283	1.108	50	20	IDGD	
C[C@]1(c2ccc(Br)cc2)NC(=O)N(CC(=O)NNC(=O)c2ccc[nH]2)C1=O	771236805	VNWVLYHXEHVLJC-QGZVFWFLSA-N	434.250	1.005	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNS(=O)(=O)c1cnn(-c2ccccc2)c1	771604781	MEJUJQJGWJLHOV-UHFFFAOYSA-N	433.877	1.152	50	20	IDGD	
COc1ccccc1[C@@]1(C)NC(=O)N(CC(=O)NNc2nc(O)c3ccccc3n2)C1=O	771621312	KYCUVDLJBZXFCI-OAQYLSRUSA-N	436.428	1.254	50	20	IDGD	
COC(=O)C[C@@H]1CCCN1C(=O)NNC(=O)[C@@H](C)Oc1cccc(Br)c1	771954766	RBWQIYBWDRSJSK-YPMHNXCESA-N	428.283	1.985	50	20	IDGD	
COCCOc1cccc(CC(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)c1	772223721	UJLWFAVMIIBEEJ-UHFFFAOYSA-N	441.893	1.016	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)Cc1ccnc(O)c1Br	772560127	JOHSHIMJYVSOAF-UHFFFAOYSA-N	430.280	1.648	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)CCC[C@]1(C)NC(=O)NC1=O	772710130	ZTGTXNRAORUZQQ-QGHHPUGFSA-N	441.282	1.132	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)c1cc(N2CCNC2=O)ccc1F	772883969	GSWQYKJKGXLQPO-UHFFFAOYSA-N	433.827	1.086	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNS(=O)(=O)c1ccc2c(c1)NC(=O)CO2	773250199	ALJOQYJFMHTIOU-SNVBAGLBSA-N	425.850	1.448	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)ccc1-n1cncn1	773419060	LVUCHSGTNYOQKZ-MRXNPFEDSA-N	428.493	1.984	50	20	IDGD	
CS(=O)(=O)c1ccccc1-n1cc(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2)cn1	773656272	LWPPHOYWROSOAD-UHFFFAOYSA-N	444.429	1.266	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNc2cccc(C#N)c2)c(C(=O)N2CCCC2)cc1OC	773699181	OAGRTPBYZMOUMS-UHFFFAOYSA-N	437.456	1.893	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1cn(C)nc1C(F)(F)F	774007490	AFSGIUGNVVFSDX-QMMMGPOBSA-N	433.774	1.646	50	20	IDGD	
C[C@@H](NCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)c1cccc(N2CCOC2=O)c1	775269918	TURKIAPAFLMDOA-CYBMUJFWSA-N	427.417	1.663	50	20	IDGD	
O=C(CN[C@@H](c1ccc2c(c1)OCCO2)C1CC1)NNC(=O)c1cccc([N+](=O)[O-])c1	776014531	JEGCSHXIOSFOFX-HXUWFJFHSA-N	426.429	1.868	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)Nc2ccc(S(=O)(=O)NC(C)(C)C)cn2)c1O	776062283	VKTCNKOWSVZVEF-UHFFFAOYSA-N	437.478	1.339	50	20	IDGD	
CCCNS(=O)(=O)c1ccc(NC(=O)NNc2cccc(S(C)(=O)=O)c2)cc1	776472965	CPKTYJGSFCZHKB-UHFFFAOYSA-N	426.520	1.927	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2N2CCOCC2)cc1	776556751	BTHBAJRZLFFRDD-UHFFFAOYSA-N	425.401	1.143	50	20	IDGD	
COCCO[C@@H]1COCC[C@H]1NC(=O)NNC(=O)c1cc(F)ccc1Br	777276536	XMXVQKARZSNAPZ-ZIAGYGMSSA-N	434.262	1.353	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cc(O)nc(CC(C)C)c2)cc1	777276713	VVTFUVIISQPXCC-UHFFFAOYSA-N	434.518	1.376	50	20	IDGD	
COc1cccc(-c2noc([C@@H](C)NC(=O)NNC(=O)CNC(=O)OC(C)(C)C)n2)c1	778683188	PBCSJVCMCMHEFI-LLVKDONJSA-N	434.453	1.661	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2c(N)ccc(Br)c2F)n1	781226712	HYZLPEQMCJLIMD-UHFFFAOYSA-N	445.270	1.482	50	20	IDGD	
Cc1cc2cc[nH]c2cc1NC(=O)C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	782120420	CZQCVLOSVVOIBH-UHFFFAOYSA-N	448.527	1.775	50	20	IDGD	
C[C@@H](NC(=O)CNC(=O)COC(=O)/C(C#N)=C/c1ccc(O)cc1)c1ccc(F)cc1	784019391	FSRRVXAVUJQDHR-NGWPFTMJSA-N	425.416	1.975	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NN[C@H](Cc2ccc(C(F)(F)F)cc2)C(N)=O)c1	784065190	JKGPPIHPQFXZSW-OAHLLOKOSA-N	429.420	1.440	50	20	IDGD	
CCc1cccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)c1	784229242	CWOOUZIDULQCSH-UHFFFAOYSA-N	445.545	1.267	50	20	IDGD	
O=C(NNc1nc(-c2ccc(Cl)cc2)no1)C(=O)Nc1cnn(-c2ncccn2)c1	784799582	KZDKRXWJGZRYPG-UHFFFAOYSA-N	425.796	1.448	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)cc1	784835326	LVEGQBAGUOOWLT-UHFFFAOYSA-N	427.385	1.551	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)Nc1ccc(Cl)c2ncccc12	785023475	MZEWWMGNTSHHAZ-UHFFFAOYSA-N	429.776	1.902	50	20	IDGD	
COC(=O)CNC(=O)c1ccc(NC(=O)C(=O)NNc2ccc(C#N)c(Cl)c2)cc1	785095057	OTPWJXKXMPPPHK-UHFFFAOYSA-N	429.820	1.196	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2ccc(C(=O)N3CCOCC3)cc2)cc1Cl	785120541	XBVXEPGLHOBHAR-UHFFFAOYSA-N	432.864	1.903	50	20	IDGD	
COCCn1ccc(NC(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)n1	785844483	DQPLUMBDQYALJY-UHFFFAOYSA-N	425.490	1.171	50	20	IDGD	
CCS(=O)(=O)CCn1cc(C)c(NC(=O)C(=O)NNc2cc(F)c(F)c(F)c2)n1	787570483	KSQGGSIBBOEREG-UHFFFAOYSA-N	433.412	1.125	50	20	IDGD	
CN(C)[C@@H]1CCOc2c(NC(=O)C(=O)NNC(=O)COCc3ccccc3)cccc21	789739728	QCYWYGXOKLPBNM-GOSISDBHSA-N	426.473	1.375	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)CCN2CCN(C(=O)OC(C)(C)C)CC2)nc1C	792302335	YDKSPBBIMWNLJC-UHFFFAOYSA-N	436.513	1.348	50	20	IDGD	
CCOC(=O)c1cc(Cl)cc(S(=O)(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1	793351333	VWRUXLJRCGTMED-INIZCTEOSA-N	440.861	1.666	50	20	IDGD	
CC(C)c1c(Cl)ncnc1NNC(=O)Cn1c(=O)ccn(Cc2ccccc2)c1=O	798141954	FAUBTJVCUWFRAV-UHFFFAOYSA-N	428.880	1.768	50	20	IDGD	
CCCC[C@@H](/N=C1/NS(=O)(=O)c2ccccc21)C(=O)NNC(=O)NCC(F)(F)F	798314859	DKMZQBBTUKMDPM-LLVKDONJSA-N	435.428	1.177	50	20	IDGD	
Cc1nn(C)c(Br)c1C(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12	801103869	SUDIUFXXAGZOFK-UHFFFAOYSA-N	447.293	1.857	50	20	IDGD	
COc1ccc(C2=NO[C@H](CNC(=O)NNC(=O)CNC(=O)c3cccs3)C2)cc1F	802346450	OZVAZHGRYQDCCR-LBPRGKRZSA-N	449.464	1.149	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)NCCNS(=O)(=O)c1ccc(Cl)cc1C	805097734	VYHCFUMQVKIKJD-UHFFFAOYSA-N	440.909	1.580	50	20	IDGD	
O=C1COc2c(cc(Cl)cc2NC(=O)C(=O)NNc2ccc(Br)cn2)N1	807005499	JOBVHOUIVQDOLO-UHFFFAOYSA-N	440.641	1.910	50	20	IDGD	
O=C1COC[C@@H](C[C@@H]2CN(C(=O)C(=O)NNc3ccc(Cl)nc3)c3ccccc32)N1	807014309	UNTSJDXUEGCJAR-TZMCWYRMSA-N	429.864	1.214	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](N2CCN(CC(=O)NNC(=O)c3ccccc3)CC2)C1	808772540	JRQPYANNQPQNTN-SFHVURJKSA-N	431.537	1.075	50	20	IDGD	
O=C(NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)N[C@H](C1CC1)C(F)(F)F	808866361	VXHDQIXZDFAVJF-CQSZACIVSA-N	434.440	1.756	50	20	IDGD	
Cn1nnc(Br)c1C(=O)NNC(=O)COc1ccc(Br)cc1	809940655	LMWXAOGGMPQPAH-UHFFFAOYSA-N	433.060	1.180	50	20	IDGD	
COC[C@@]1(C(=O)NNC(=O)c2ccc(OC)c(OC)c2)CCN(C(=O)OC(C)(C)C)C1	809950533	SDEWNHSVQFFNBN-OAQYLSRUSA-N	437.493	1.738	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)Cn2nc(C(F)(F)F)cc2C)c2ccccc2c1=O	809953319	MODULSUEQAWBHL-UHFFFAOYSA-N	436.394	1.791	50	20	IDGD	
COc1cc2c(cc1OC)CN(CC(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1)CC2	812732399	DPUVKEBCJPOWEJ-UHFFFAOYSA-N	448.545	1.456	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)Cc2ccc(C(=O)NNC(=O)[C@@H](O)C(C)C)cc2)cc1	813364427	REDOOOPIXAPWAG-IBGZPJMESA-N	433.530	1.594	50	20	IDGD	
COC(=O)CC[C@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)Nc1ccc2c(c1)OCO2	813574726	HBSHNOBNPPQJOJ-LBPRGKRZSA-N	438.437	1.415	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)NN[C@]2(C)CCS(=O)(=O)C2)CC12CCC2	813800595	VEFYXZPVHJEFPU-RDTXWAMCSA-N	430.571	1.690	50	20	IDGD	
C[C@H](Cc1cnc2ccccc2n1)C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	814736402	NOKLJOJOGVKLFN-LLVKDONJSA-N	447.904	1.570	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1ccc(O[C@H]2CCOC2)cc1	815751490	BKCMJNAMOMTGEN-INIZCTEOSA-N	448.501	1.186	50	20	IDGD	
CCCCCCOc1ccc(C(=O)NNC(=O)[C@@H]2CCCN(S(N)(=O)=O)C2)cc1	816830889	YDVWHFAPUCGCBU-MRXNPFEDSA-N	426.539	1.322	50	20	IDGD	
CCOc1ccc(NNC(=O)c2cc(S(=O)(=O)N(C)C)ccc2N2CCOCC2)cc1	817889729	LUBCGEXXYYGEFJ-UHFFFAOYSA-N	448.545	1.929	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc2ccccc2c1)NNC(=O)COc1ccc(F)cc1	915785322	AKGJIAPIQJCQDY-UHFFFAOYSA-N	431.445	1.484	50	20	IDGD	
Cc1sc(=O)n(CC(=O)N([C@@H]2CCS(=O)(=O)C2)N(C)C)c1-c1ccc(F)cc1	915830436	ZJLWORMVYFECOY-OAHLLOKOSA-N	427.523	1.517	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N[C@H](C(N)=O)c1ccccc1	916233426	XHTNFNJFSLCEHQ-NHYWBVRUSA-N	435.278	1.773	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCCc2ccc(C(=O)OC)cc2)nc1	916249163	RRWUHAODOLNTRR-UHFFFAOYSA-N	449.533	1.768	50	20	IDGD	
CCN(CCO)c1ccc(C=NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)c(C)c1	916278737	SJNPZCHTGNBCSB-UHFFFAOYSA-N	446.573	1.893	50	20	IDGD	
COC(=O)c1ccc(COc2ccc(C=NNC(=O)CN3CCCC3=O)cc2OC)o1	916357840	NVQLJNOOKJKRBK-UHFFFAOYSA-N	429.429	1.726	50	20	IDGD	
CS(=O)(=O)Nc1ccc(CNC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc1	916380658	ITAAUGYNBBFQDJ-UHFFFAOYSA-N	444.473	1.094	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)sc(C)c1C	916562843	LFXQKBVQICNABC-UHFFFAOYSA-N	433.442	1.670	50	20	IDGD	
CC(C)(C)NS(=O)(=O)CCNC(=O)NNC(=O)c1ccc(COc2ccccc2)o1	916622228	BFDYHHTYNYAYBX-UHFFFAOYSA-N	438.506	1.521	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NC[C@@]1(N2CCOCC2)CCSC1	916636881	NWAOBLGYMAEWGX-LIRRHRJNSA-N	426.514	1.131	50	20	IDGD	
CCOC(=O)N1CCC(NC(=O)CCCNC(=O)NNC(=O)c2ccccc2F)CC1	916639552	LYMQEQRMFABJNM-UHFFFAOYSA-N	437.472	1.287	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c(OC)c1OC	917529354	CMMZFDSONZSTGP-UHFFFAOYSA-N	440.456	1.353	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2c[nH]n3c2nc(=O)c2ccccc23)cc(OC)c1OC	919690931	ZPMWFBKQIKQKGD-UHFFFAOYSA-N	437.412	1.276	50	20	IDGD	
O=C(CCSc1ccccc1Br)NNC(=O)N[C@H]1CCS(=O)(=O)C1	919886824	VJCWVEMMIRORGZ-JTQLQIEISA-N	436.353	1.449	50	20	IDGD	
CC(C)C[C@H](C(=O)NNC(=O)NCCc1cccs1)N1C(=O)[C@H]2CC=CC[C@H]2C1=O	920860592	PSBJLCXOQCRUGF-IXDOHACOSA-N	432.546	1.987	50	20	IDGD	
NC(=O)[C@H]1CCCN1Cc1cccc(NC(=O)NNC(=O)c2cc(Br)c[nH]2)c1	920933349	UTNLXXCIOUCEHX-OAHLLOKOSA-N	449.309	1.693	50	20	IDGD	
CCCNC(=O)NNC(=O)c1cc(S(=O)(=O)N2CCN(CC)CC2)ccc1Cl	921040871	KOVMEYJXFIZLFA-UHFFFAOYSA-N	431.946	1.020	50	20	IDGD	
CCOC(=O)C1CCC(NC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)CC1	921118841	ZLUZIZIMSDHZET-UHFFFAOYSA-N	439.538	1.354	50	20	IDGD	
O=C(CCCC[C@@H]1SC[C@H]2NC(=O)N[C@@H]21)NNC(=O)c1cc(-c2ccccc2)on1	921304521	WQPOKXUKMUNLQH-HFTRVMKXSA-N	429.502	1.828	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)cn1	1116289765	VYHJSUITPULBLE-UHFFFAOYSA-N	431.924	1.713	50	20	IDGD	
C[C@@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)NNc2cncc(Br)c2)C1=O	1116394460	YKJKMEFJWIICLX-KRWDZBQOSA-N	436.241	1.894	50	20	IDGD	
C[C@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)NNc2cncc(Br)c2)C1=O	1116394462	YKJKMEFJWIICLX-QGZVFWFLSA-N	436.241	1.894	50	20	IDGD	
O=C(NNC(=O)C1(O)Cc2ccccc2C1)c1cccc(S(=O)(=O)N2CCCCC2)c1	1318974913	PBSYFHFIJSXPBS-UHFFFAOYSA-N	443.525	1.152	50	20	IDGD	
CNS(=O)(=O)c1ccc(CC(=O)NNC(=O)c2ccc(Br)s2)cc1	1323875232	KQWPWHRIZFPDFS-UHFFFAOYSA-N	432.321	1.422	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNS(=O)(=O)c2ccc3c(c2)OCCO3)CC1	1339204173	HGVBBYQXMTVUOM-UHFFFAOYSA-N	441.506	1.414	50	20	IDGD	
CNS(=O)(=O)c1ccc(Br)c(C(=O)NNC(=O)Nc2ccccc2)c1	1340043591	XIJBNMUPAZWENB-UHFFFAOYSA-N	427.280	1.824	50	20	IDGD	
C[C@H](Nc1nccs1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2	1778066942	IYJNALQSNCEIAW-UYAYXHRUSA-N	430.958	1.057	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(CCN(C(=O)CS[C@H]3CCCCO3)C2)C1	1779084556	QGSCZNXKXQYBGW-OALUTQOASA-N	430.643	1.928	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3c(OC)cccc3OC)C2)C1	1780540672	ADXUEVZQFXKHOR-VBKZILBWSA-N	426.897	1.401	50	20	IDGD	
CC(C)c1ccc(C(=O)N2CC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)cc1	1780767362	UCQBLNZAGIHXRJ-HSZRJFAPSA-N	430.549	1.627	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C=N/O[C@@H]1CCCCO1)C2	1782175295	GFWQPULZZMQBMT-KHEABUANSA-N	445.944	1.283	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H]1Cc3ccccc3N1)C2	1782179655	KTQDYLZOVWIPHU-ITBLURSFSA-N	435.952	1.791	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)c3cccc4ccncc34)C2)C1	1782254006	PMWULMWPLJFWEO-HSZRJFAPSA-N	439.516	1.051	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)Cc3cccc(OC)n3)CCO2)C1	1783342085	GQIUHDLMTNHTPO-DNVCBOLYSA-N	440.338	1.636	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cnccc3N(C)C)CCO2)C1	1783343457	JGICSASMBLHOJT-DNVCBOLYSA-N	439.354	1.765	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CC3CCN(C)CC3)[C@H]2C1	1783650230	FCKPOHGHPOLSCP-UBDQQSCGSA-N	444.414	1.729	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H]1CCC[C@H](C(=O)OC)C1)CCO2	1783879213	PRLYVGBLZJKJHF-ULMVMLMRSA-N	430.929	1.050	50	20	IDGD	
C[Si](C)(C)c1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]3C2)co1	1784093076	POYRIPHEXUWKOZ-TUUVXOQKSA-N	428.989	1.018	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)CCCn3ccnc3)C2)C1	1784402995	IBAXBLZGRLHTMD-YJBOKZPZSA-N	427.343	1.667	50	20	IDGD	
Cc1nn(C)c(C)c1CC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1784512598	KYBTZNOJWQDGFY-NVXWUHKLSA-N	431.306	1.100	50	20	IDGD	
COc1cc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)ccc1F	1785011327	XMPZQNYXFJDWER-WMLDXEAASA-N	433.249	1.968	50	20	IDGD	
COc1cccc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Br)C[C@@H]32)n1	1785199589	NKSIWFXAZACILQ-MJFSBKNWSA-N	444.301	1.303	50	20	IDGD	
Cc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Br)C[C@@H]32)cnc1C	1785514391	MWUDYDJEEZBHSD-QCEMKRCNSA-N	428.302	1.982	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCBr)[C@H]3C2)c(O)n1	1786406011	CKNGUOPWDJXUJA-QEJZJMRPSA-N	426.311	1.474	50	20	IDGD	
Cc1nn(C)cc1C(=O)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1	1786507002	BUDSTQWZCXVJNY-UHFFFAOYSA-N	432.289	1.470	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H]1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]2C1	1787443621	OYSLOMOPGHOECR-RMEBNNNOSA-N	433.908	1.510	50	20	IDGD	
CCOC(=O)/C=C/C(=O)Nc1ccc(C2(NC(=O)CCC(=O)NN(C)C)CCC2)cc1	1787654337	KVNCICSOXCNAIK-OUKQBFOZSA-N	430.505	1.613	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cn(C)c4ncccc34)[C@H]2C1	1788465044	VMABYGWABUNLSK-PLYYQAHHSA-N	434.924	1.420	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Cl)C[C@@H]21)c1ccnc(Br)c1	1788821493	FAZRNOYNUZUDBF-ZJQBRPOHSA-N	434.693	1.972	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)c1cc2ncccc2[nH]1	1790335599	YSEGPUWYHDDRFD-DCGLDWPTSA-N	435.322	1.941	50	20	IDGD	
Cc1cnn([C@H](C)C(=O)Nc2ccc(C3(NC(=O)c4ccc(B(O)O)cc4)CCC3)cc2)c1	1791844318	VMXZQWWQIIBCMI-QGZVFWFLSA-N	446.316	1.880	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3ccccn3n1)C2	1792868095	PMKHLRJASOXJDS-VWPFQQQWSA-N	435.322	1.569	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COc1cccc3ccccc13)C2)[C@H](O)CCl	1792975797	XQBIXDBTLZIGDU-VWFIUDSGSA-N	432.904	1.408	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN1CCC(C)CC1	1793202559	TWZSFPAKQOONIO-DFGXFYAUSA-N	430.387	1.481	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCc1ccc(F)nc1	1794021046	RTPNEOVXIVVKBQ-CSHUHZATSA-N	432.323	1.979	50	20	IDGD	
COc1ncc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCBr)cc1F	1795111550	WFNODWWWTQYOGB-JJLQDPRZSA-N	430.274	1.218	50	20	IDGD	
C[C@@H](Nc1cccnc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCBr	1795112526	LBQSRZPGSICVRL-VWPFQQQWSA-N	425.327	1.257	50	20	IDGD	
CO[C@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)CBr)C2)c1ccccc1	1795372632	YNSBUCQUYUQVGI-JFMONLCZSA-N	439.350	1.995	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](CN)c1ccccc1	1795670478	CPFHWQAEORYDKJ-MWTISTBLSA-N	438.366	1.350	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1Cc2ccccc2CN1	1796327817	MZFNISHQFIMZPQ-UONLAYADSA-N	440.371	1.527	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1CCN(Cc3ccccn3)CC1)C2)[C@H](F)Cl	1796361547	ITOKNCJWDXQQEK-NBMJBFSESA-N	438.931	1.418	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Cl)C1	1796370949	PIWINMUVSVODMD-OCVGTWLNSA-N	433.908	1.367	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)c1cccnc1-c1ccccc1	1796566080	FLMMRIWBOCLLTG-UKBAYJJMSA-N	429.904	1.552	50	20	IDGD	
CCc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Br)C3)cc(C)n1	1796698609	PEPYEQVZWQVZQW-XRGAULLZSA-N	428.302	1.846	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@](O)(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](F)Cl)C1	1796810104	PIDOWZJFCKPEPB-QEAYJNAZSA-N	433.908	1.531	50	20	IDGD	
CC(=O)Nc1ccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CO[Si](C)(C)C)C3)cc1	1797232473	RSAGABREMZZKIM-OPMZPASUSA-N	447.608	1.629	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc2c(c1)COC2	1797540480	GWYJLRMJYYZVGH-BCDXTJNWSA-N	435.484	1.281	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(NC(C)=O)o1	1797749633	RMMHNRQZHWMBSY-ZWUHOBOKSA-N	442.310	1.615	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1nnc(-c2ccccc2)o1	1797820620	XUCHVBCNRUFJJY-ALXJQNPVSA-N	444.564	1.791	50	20	IDGD	
Cc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)CBr)C3)ccc1O	1799551161	JKMKNQJKRVTNGY-FAYQHZLMSA-N	425.323	1.935	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccccc1C(N)=O	1799625339	RVYCAINMLJSQIC-RHQBZFHZSA-N	428.316	1.225	50	20	IDGD	
CC(C)OCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN(C)NC(=O)NCc1ccccc1	1799865624	FDAOVJORPOCKMP-ACDBMABISA-N	445.564	1.396	50	20	IDGD	
C=C1CC(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CN(C)NC(=O)NCc2ccccc2)C1	1799865685	IAGFFFAAHNPKMO-WKCHPHFGSA-N	439.560	1.937	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COc1ccccc1F)C2	1800761641	DEVYUWFJWQPOFY-JRATXPSKSA-N	429.286	1.578	50	20	IDGD	
COc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)Br)ccc1F	1800762871	IORKWMOYPGVRPN-VFFTVRQLSA-N	429.286	1.821	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(C(F)(F)F)n1)C2	1800976706	CRMCSAFSPMLOSY-OXIQGZBJSA-N	435.830	1.557	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)[C@H](O)c1ccccc1Cl	1801199385	BTFONDLSYYDFFF-DTIWESFOSA-N	449.704	1.654	50	20	IDGD	
COc1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CCC(=O)NN(C)C)c(O)c1OC	1802338887	ZHVDQIZYRNMDSC-QDMKHBRRSA-N	448.520	1.034	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2n[nH]c3c2CCCC3)[C@H]1c1cccnc1)[C@@H](O)CCl	1803138810	FNROWEOPQRDKJI-FNHZYXHNSA-N	431.924	1.603	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)c2cc[nH]n2)[C@H]1c1cccnc1	1803760845	JVHIHFPIESLBPT-RUVVGEKZSA-N	448.487	1.258	50	20	IDGD	
O=C(c1ccccc1-n1nccn1)N1CCC2(CCCN(C(=O)[C@@H](O)CCl)C2)CC1	1805527083	RKPAAWDUUOEKMF-SFHVURJKSA-N	431.924	1.712	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC2(CCCN(C(=O)Cn3cc([N+](=O)[O-])cn3)C2)CC1	1806935989	YUZMFCHFBYJIHA-HNNXBMFYSA-N	427.889	1.276	50	20	IDGD	
C[C@@H]1CCC[C@@H]1C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1807361072	GRDJHGISQMMQRR-MWRLGJARSA-N	435.333	1.517	50	20	IDGD	
CC(C)=CCCC(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1807367146	QOVMZVOXDXIPJW-OFNKIYASSA-N	435.333	1.827	50	20	IDGD	
C[C@@H](C(=O)NC[C@@H]1CCN(C(=O)C(Cl)Cl)[C@H]1c1cccnc1)N1CCN(C)CC1	1807902780	IWXWYFXLCULJOC-XIRDDKMYSA-N	442.391	1.527	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)c1[nH]nc2ccncc12	1808095157	LNWNKIRSGMCHRE-XCRHUMRWSA-N	428.880	1.272	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]1c1cccnc1)n1cnnn1	1808317711	ZJYPNPWXURRPOU-SCFUHWHPSA-N	440.335	1.571	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC2(CCCN(C(=O)[C@H](O)c3ccccc3)C2)CC1	1809461589	GZYYBOPMYXIWGZ-OAQYLSRUSA-N	430.549	1.324	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@@H](CNC(=O)CCC(N)=O)[C@H]1c1cccnc1	1812625956	CRMWWVUIRGMRTN-HACGYAERSA-N	425.327	1.384	50	20	IDGD	
C[C@H](NC(=O)c1ccccc1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](O)CCl)n[nH]1	1814875564	DASVESDJOVIZCX-JQFCIGGWSA-N	447.923	1.820	50	20	IDGD	
O=C(CSc1ncccn1)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](O)CCl)CC2	1815624073	YJGAHIULFYMPQY-MWLCHTKSSA-N	427.939	1.237	50	20	IDGD	
O=C(CCBr)N[C@H]1CCc2nc(NC(=O)c3nc[nH]c3[N+](=O)[O-])sc2C1	1817196351	RNOKHNOIZCZVER-ZETCQYMHSA-N	443.283	1.785	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(=O)n3[nH]nnc3n2)n[nH]1	1817813349	VUKBKUXLLWDMSF-LBPRGKRZSA-N	447.887	1.107	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)C2(F)CCC2)[nH]n1	1819404499	NXKSZEUWKFTXGY-HNNXBMFYSA-N	429.456	1.606	50	20	IDGD	
Cc1cc(/C=C/C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)no1	1819471437	CNJMTQOWARFRDG-YXBWYFRISA-N	449.276	1.405	50	20	IDGD	
CN1CCN(CC(=O)N2CCCC[C@@H]2c2cc(NC(=O)[C@@H](F)Br)n[nH]2)CC1	1820933820	NYGCKGNEVSOCEL-CZUORRHYSA-N	445.337	1.340	50	20	IDGD	
CN1CCN(CCC(=O)N2CCCC[C@H]2c2cc(NC(=O)C(Cl)Cl)n[nH]2)CC1	1822418116	LAOIBLVBXADOHK-AWEZNQCLSA-N	431.368	1.843	50	20	IDGD	
O=C(CN1CCCCC1=O)N[C@@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1	1823013740	IHJZGXUEOTVEJT-OTYXRUKQSA-N	447.330	1.758	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H]2CCCOC2)n[nH]1	1823468658	BWJLYPIZALJFGU-DYVFJYSZSA-N	441.492	1.141	50	20	IDGD	
CC(=O)Nc1cc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)[C@@H](O)CCl)CC2)ccn1	1824183305	TVIJGUPWXRETBL-ROUUACIJSA-N	436.940	1.873	50	20	IDGD	
CC(C)CNC(=O)C(=O)N[C@H]1CCc2nc(NC(=O)[C@H](C)Br)sc2C1	1825642298	VKZJRRWRTWBVEN-UWVGGRQHSA-N	431.356	1.611	50	20	IDGD	
COC(=O)C1(C(=O)N[C@@H]2CCc3nc(NC(=O)[C@@H](C)Br)sc3C2)CC1	1825647063	MOOVYODIBYPRBK-RKDXNWHRSA-N	430.324	1.792	50	20	IDGD	
N#Cc1ccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)cc1	1830013078	QGBXFMNCPINJLE-QHCPKHFHSA-N	445.328	1.785	50	20	IDGD	
O=C([C@H](O)CCl)N1CCC([C@@H]2CCCCN2C(=O)Cc2ccc3ncnn3c2)CC1	1830154764	WGGZOXJZMYVGRP-ZWKOTPCHSA-N	433.940	1.491	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4nccnc4c3)C2)C1	1830362531	YPUOIZVLUXFEBB-QFIPXVFZSA-N	446.935	1.965	50	20	IDGD	
CCN(CC)C[C@@H](C)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830366102	KIJSZXGTYSQCSK-DYESRHJHSA-N	432.005	1.686	50	20	IDGD	
O=C([C@@H]1CC(c2ccccc2)=NO1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1831254129	FWDCHXHCYCDFFJ-ABSDTBQOSA-N	439.871	1.170	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3n[nH]c4c3CCCC4)C2)C1	1831646243	JYAILRWPBLSJJA-HRAATJIYSA-N	438.956	1.766	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1	1831655855	AHHHMYWLNCIFOB-ZBFHGGJFSA-N	445.402	1.763	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@H]2CCCS2(=O)=O)CC1	1831657239	UWIABWKUGKJAOH-CWRNSKLLSA-N	449.411	1.967	50	20	IDGD	
CCc1oncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1	1831872073	NBGLSFJTABDMFJ-SFHVURJKSA-N	433.553	1.843	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(O)n2)CC1	1831872399	UIVRHVGIKZQBPO-GOSISDBHSA-N	431.537	1.394	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)/C=C/c3ccsc3)CC2)CC1)[C@H](O)CCl	1833307923	DLCARKPVICUWPK-ZMXQLYDGSA-N	425.982	1.933	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cc4n(n3)CCCC4)CC2)CC1)[C@@H](O)CCl	1833310271	OQYIEOFTBWIYLM-IBGZPJMESA-N	437.972	1.004	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)CSCC(=O)OC)CC2)CC1	1833479551	GGBCFEZHHSTHBK-MRXNPFEDSA-N	434.002	1.482	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccn(C(C)(C)C)n3)CCO2)C1	1833588757	NYQJVIHZHUPTHF-YWZLYKJASA-N	426.945	1.726	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCC(N2CCC(NC(=O)c3ccc[n+]([O-])c3)CC2)CC1	1833910106	PRXAOVQCTCIDJI-HXUWFJFHSA-N	443.375	1.742	50	20	IDGD	
CC(C)c1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)no1	1834498824	KYNLPEXECISUSI-PBHICJAKSA-N	448.289	1.559	50	20	IDGD	
O=C(/C=C/c1cccs1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1835966213	MPGOLCKDGNRPFW-GILVVUIESA-N	447.326	1.908	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cn3cc(Cl)cn3)CCO2)C1	1835969418	IAFXIBPAZYCHSB-CRAIPNDOSA-N	433.336	1.400	50	20	IDGD	
O=C([C@@H]1Cc2ccccc2CN1)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836717503	DJGZCIZVUXTGBF-SFTDATJTSA-N	449.979	1.299	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cn4cccnc4n3)CCO2)C1	1836885309	ROMJVXVLRDKQCM-YWZLYKJASA-N	435.912	1.207	50	20	IDGD	
O=C(c1ccn2cncc2c1)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1837082461	TUSYCVRCYVXYPE-GOSISDBHSA-N	427.288	1.208	50	20	IDGD	
CCc1[nH]nc(C(=O)N2CCC(OC3CCN(C(=O)[C@@H](Cl)COC)CC3)CC2)c1F	1837344826	MYSHRQBSYLGELK-HNNXBMFYSA-N	444.935	1.977	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CNc4ccccc43)C2)C1	1837711470	JDPLYBXGXWQEMZ-XMSQKQJNSA-N	447.608	1.504	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](N)c3ccccn3)CC2)CC1	1837876052	YIXHEVUWEXFMLL-MJGOQNOKSA-N	438.956	1.334	50	20	IDGD	
CCc1noc(C)c1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1838058603	NGGBCNRWHRKJPA-YOEHRIQHSA-N	448.289	1.306	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cc(O)ccc3O)CC2)CC1	1838690301	JLQYIKFEIFIPDG-SFHVURJKSA-N	440.924	1.964	50	20	IDGD	
Cc1ccn(C)c1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1838821357	KQFFGGIAMYGVEZ-YOEHRIQHSA-N	432.290	1.094	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cccc(OC)n3)C2)C1	1839142124	FKEQBUUDRUUPML-JXFKEZNVSA-N	425.913	1.107	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)C3CCC(O)CC3)C2)C1	1839155298	QIAUABPQNDLKRG-FUICEZJUSA-N	437.364	1.230	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H](O)Cc3ccccc3)CCO2)C1	1839956312	MGQDIOOMESJPKO-AVRDEDQJSA-N	438.952	1.311	50	20	IDGD	
COc1ncc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)cc1C	1840188012	JVHBWPVDTCBHSD-SFHVURJKSA-N	432.304	1.272	50	20	IDGD	
O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)CCc1ccoc1)CCO2	1840514393	WCZZPXCRHKRGFO-SFHVURJKSA-N	429.311	1.454	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC2(CCCN2C(=O)c2ccc(N3CCOCC3)cn2)C1	1842266394	FNXHKBBYQBDBHK-CQSZACIVSA-N	437.338	1.519	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC2(CCCN2C(=O)[C@H](CO)NC(=O)OC(C)(C)C)C1	1843326580	WDHMBKZZBOCTTF-STQMWFEESA-N	448.358	1.249	50	20	IDGD	
O=C(CN1C(=O)COc2ccc(Cl)cc21)N1CC2(CCCN2C(=O)[C@@H](F)Cl)C1	1843362153	GANVVYRHXOFVTM-MRXNPFEDSA-N	430.263	1.803	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1cc(O)ccc1O)C2	1843416589	BSVJAJSBSFOYPN-YDZHTSKRSA-N	425.445	1.049	50	20	IDGD	
Cn1ncc(I)c1C(=O)N1CCCC12CN(C(=O)[C@H](F)Cl)C2	1843602969	DCZYBXLJRVDXBQ-JTQLQIEISA-N	440.644	1.376	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@](C)(C(=O)N2CCCC23CN(C(=O)[C@@H](F)Cl)C3)[C@@H](O)C1	1843982862	XEYVQPJRMDLXRG-KSMMKXTCSA-N	447.935	1.732	50	20	IDGD	
O=C([C@H](F)Cl)N1CC2(CCCN2C(=O)c2nc3c(Br)cc(F)cn3n2)C1	1845725210	DWXPNMZDJDDKBX-JTQLQIEISA-N	448.655	1.982	50	20	IDGD	
CCOc1ccc(CC(=O)N2CCCC23CN(C(=O)CCC(=O)NN(C)C)C3)cc1OC	1846266204	DMVSTXHMGMEXHK-UHFFFAOYSA-N	446.548	1.213	50	20	IDGD	
COc1ccc([C@@H](C)C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2cnccc2C(=O)NN)cc1	1847466117	DJAGLRSDAAOLOZ-UAOJZALGSA-N	437.500	1.313	50	20	IDGD	
O=C(c1cn2cc(C(F)(F)F)ccc2n1)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl	1847562687	CIKLVRICDIUYOE-IHRRRGAJSA-N	430.814	1.768	50	20	IDGD	
CCn1c(NNC(=O)CNC(=O)c2ccc(Br)o2)nc2ccccc2c1=O	9857409	FGVKZTOHAFCZFI-UHFFFAOYSA-N	434.250	1.645	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)CN2C(=O)COc3ccc([N+](=O)[O-])cc32)cc1	28029088	GWQAPCWOVWUQNV-UHFFFAOYSA-N	430.442	1.568	50	20	IDGD	
CCOC(=O)NNC(=O)c1cc(=O)[nH]c2ccc(S(=O)(=O)Nc3ccc(F)cc3)cc12	45574460	LNVZGSZJYVVLNV-UHFFFAOYSA-N	448.432	1.859	50	20	IDGD	
CC1CCN(Cc2ccc(CNC(=O)NNC(=O)CNC(=O)c3ccco3)cc2)CC1	725871791	GPIAONWUOIJDEY-UHFFFAOYSA-N	427.505	1.772	50	20	IDGD	
COc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NNC(=S)Nc2ccc(C)cc2C)cc1	725907642	OBGJSIPDVIUNTE-AWEZNQCLSA-N	436.559	1.997	50	20	IDGD	
CS(=O)(=O)Nc1cc(C(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)ccc1F	725996232	RWTLGCHFPMQQFV-UHFFFAOYSA-N	443.840	1.469	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)CCNS(=O)(=O)c2cccs2)cc1F	727499011	MANWFSZZVRWSLQ-UHFFFAOYSA-N	432.524	1.582	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)[C@@H]2CCCN(S(=O)(=O)c3c(C)n[nH]c3C)C2)cc1	728203217	IFXSSKZOISUOEV-QGZVFWFLSA-N	433.534	1.451	50	20	IDGD	
Cc1c(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)oc2c1C(=O)CCC2	728325959	HVERTFPICYNFQF-INIZCTEOSA-N	428.397	1.251	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)c2cccn2C)cc1Br	729303887	CGCCMRSRFNJOKP-UHFFFAOYSA-N	429.296	1.113	50	20	IDGD	
CN(C)CCNC(=O)c1cccc(CNC(=O)NNC(=O)Cn2ccc3ccccc32)c1	729499550	SYDWOOJMMTZUCQ-UHFFFAOYSA-N	436.516	1.463	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2cc(C(=O)O)sc2C)cc(OC)c1OC	729662272	JKPPJJMXHDVFCU-UHFFFAOYSA-N	430.460	1.404	50	20	IDGD	
Cc1ccccc1COc1cccc(CC(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)c1	729969083	UPAVXWNLCPSKQO-GOSISDBHSA-N	431.514	1.634	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2csc(-c3ccccc3)n2)c1	730512655	JGCDBWFDZAKGLB-UHFFFAOYSA-N	437.524	1.837	50	20	IDGD	
Cc1c(C(=O)NNC(=O)CNC(=O)c2cccs2)nnn1-c1ccc2ncccc2c1	731330953	HORRQXCCHRWEHX-UHFFFAOYSA-N	435.469	1.376	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)c2nnn(-c3cccc4c3CCN(C)C4)c2C)c1	731759828	VFGYAEJTZZPTJR-UHFFFAOYSA-N	449.515	1.445	50	20	IDGD	
O=C(NNC(=S)Nc1cc(S(=O)(=O)N2CCOCC2)ccc1Cl)C1CCC1	731945629	XPSDGIUXBMDCRZ-UHFFFAOYSA-N	432.955	1.479	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CCc2nc(-c3nc[nH]n3)no2)cc1Br	732175673	NJYRAKNUKILSBU-UHFFFAOYSA-N	436.226	1.020	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)CCNC(=O)C23CC4CC(CC(C4)C2)C3)C[C@@H](C)O1	732260582	GMISTMYQAODORN-JVRWENHQSA-N	434.581	1.356	50	20	IDGD	
CCS(=O)(=O)N1CCC[C@@H](C(=O)NNc2ccccc2S(=O)(=O)NC(C)(C)C)C1	734252071	BLRCZIVWQQUGCV-CQSZACIVSA-N	446.595	1.268	50	20	IDGD	
C[C@H]1C[C@@H]1c1ccc(CCC(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)o1	735117005	KSAFWSJCOLUROZ-RDJZCZTQSA-N	447.561	1.810	50	20	IDGD	
Cc1ccc(CCC(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)c(C)c1	735118214	NHNBDLRJGSDYPK-UHFFFAOYSA-N	431.562	1.710	50	20	IDGD	
CC(=O)NCC(=O)N1CCc2cc(C(=O)NNC(=O)[C@@H](C)Oc3ccccc3F)ccc21	735631231	RYYSVTWSOBBQSM-CYBMUJFWSA-N	442.447	1.079	50	20	IDGD	
CCn1cc(CNC(=O)/C(C#N)=C/c2cn(CCC(N)=O)nc2-c2ccc(OC)cc2)cn1	735659650	SGNTXKLNSRITJW-VCHYOVAHSA-N	447.499	1.874	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)c2cc(S(N)(=O)=O)ccc2F)cc1C	736754128	BPGIYQAVTWUHQZ-UHFFFAOYSA-N	443.478	1.023	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)c1cc(S(=O)(=O)N2CCCC2)ccc1Cl	740851362	BAGIAOKHBBNZTL-UHFFFAOYSA-N	444.941	1.190	50	20	IDGD	
C[C@@H](COCC(F)(F)F)NC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	743341351	KQYZUBLHHLWSDK-HNNXBMFYSA-N	431.459	1.497	50	20	IDGD	
C=CCOc1c(Br)cc(C=NNC(=O)Cc2cc(O)nc(O)n2)cc1OC	743446305	RUTLBKYKXOPUTK-UHFFFAOYSA-N	437.250	1.917	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(n2cc(C(=O)NNc3ncnc4[nH]cnc34)nn2)CC1	743473469	PWLDKXFMKQRUMT-UHFFFAOYSA-N	428.457	1.273	50	20	IDGD	
CCc1ccc(N2C[C@@H](C(=O)OCC(=O)NNC(=O)c3cccc(C#N)c3)CC2=O)cc1	744499562	XVSHIAQTXLFIJV-SFHVURJKSA-N	434.452	1.478	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1ccnc(-n2cccn2)c1	744622373	USWMDCCWICILHR-UHFFFAOYSA-N	428.474	1.045	50	20	IDGD	
CCO[C@@H]1C[C@H](NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)C12CCC2	745851914	XVZNKLQAHAKDMY-DLBZAZTESA-N	438.550	1.294	50	20	IDGD	
CO[C@@]1(C)C[C@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)C1(C)C	745934873	CWKIUNFOUOAYSB-JXFKEZNVSA-N	438.550	1.619	50	20	IDGD	
Cc1ccc(NC(=O)[C@@H]2CCCN(CC(=O)NNC(=O)Cc3nc(C)cs3)C2)nc1	746456731	FDYJXLDKENANKK-OAHLLOKOSA-N	430.534	1.196	50	20	IDGD	
C[C@@]12CCC(=O)N1c1ccccc1C(=O)N2CC(=O)NNC(=O)COc1ccc(F)cc1	746577488	MSXCVTHREVBGFB-QFIPXVFZSA-N	440.431	1.351	50	20	IDGD	
COc1cc(C)nc(NNC(=O)C2CCN(C3=NS(=O)(=O)c4ccccc43)CC2)n1	746625068	GNOFKHOIZPDRCO-UHFFFAOYSA-N	430.490	1.098	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Cn2ccc(=O)c([N+](=O)[O-])c2)ccc1OCCC(C)C	747724836	JVOWAVFMYHDTLJ-UHFFFAOYSA-N	432.433	1.651	50	20	IDGD	
Cn1cnnc1Sc1ccc(C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)cc1[N+](=O)[O-]	748284372	MCBIYBZDWCGXKE-OAHLLOKOSA-N	440.441	1.639	50	20	IDGD	
Cn1c(=NNC(=O)NCCCN2CCN(c3ccncc3)CC2)sc2ccccc21	748343652	LKJFHLWEXMJAJH-UHFFFAOYSA-N	425.562	1.962	50	20	IDGD	
COc1ccc(-n2c(C)cc(/C=C(\C#N)C(=O)N3CCN4C(=O)NC(=O)[C@H]4C3)c2C)cc1	749253146	OIQIYCZVWUJFNA-FVECTHPASA-N	433.468	1.772	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CC(=O)N(c2ccc3c(c2)OCCO3)C1)c1cc(Br)c[nH]1	750841475	HLXVVZWRUSNHJZ-SNVBAGLBSA-N	449.261	1.363	50	20	IDGD	
CCn1cc([C@H]2C[S@@](=O)CCN2C(=O)NNC(=O)c2cc(Br)c[nH]2)cn1	753035440	ZIZVWRDDKNNFNK-SRGMZFCMSA-N	443.327	1.154	50	20	IDGD	
CC[C@H](NC(=O)NNC(=O)c1ccc(F)cc1Br)C(=O)N1CCOCC1	753061021	XYMAEDWLNPZAKN-ZDUSSCGKSA-N	431.262	1.170	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)N[C@H]1CCCN(Cc2ccccn2)C1=O	753289330	LFLBGQZZLZXTHE-SFHVURJKSA-N	425.489	1.544	50	20	IDGD	
CC(C)C[C@@H](CCO)CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	754376054	SRLXEADEBCAJBQ-MRXNPFEDSA-N	440.566	1.460	50	20	IDGD	
COc1ccc(C(=O)N2CCC(C(=O)NNC(=O)Cc3cc[nH]n3)CC2)c2ccccc12	755288645	JOWQGNHEHROLPR-UHFFFAOYSA-N	435.484	1.814	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)Nc2cc(S(=O)(=O)N3CCCCC3)ccc2C)n1	755392478	KLUSGJDHVVLXKQ-UHFFFAOYSA-N	448.549	1.836	50	20	IDGD	
Cc1ccc(Cc2cnc(NC(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)s2)cc1F	755485361	LRFBWORRCUXNEJ-JTQLQIEISA-N	429.499	1.272	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccc3c(c2)OC(F)(F)O3)c1	755551757	VNQIGRKBUXMOQO-UHFFFAOYSA-N	442.400	1.725	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)c2coc(S(=O)(=O)N(C)C)c2)cc1C	756293131	CDXVEOXPXUKRHX-UHFFFAOYSA-N	443.503	1.080	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)Nc2ccc(F)c(-n3nnnc3C3CC3)c2)cc1	756777609	JJROXLNNXXMXNE-UHFFFAOYSA-N	436.407	1.782	50	20	IDGD	
C[C@@H]1CN(C(=O)Cn2cc(NC(=O)NNC(=O)Cc3ccc(Cl)cc3)cn2)C[C@@H](C)O1	756836391	AAUNXCSUCBEWPU-ZIAGYGMSSA-N	448.911	1.568	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)Nc1cc(C2CC2)nn1[C@@H]1CCS(=O)(=O)C1	756854001	BPLMBHCOSRZURN-CYBMUJFWSA-N	433.490	1.595	50	20	IDGD	
CCC(=O)c1cc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)ccc1F	757095887	LJCXJRKPPDEGMH-UHFFFAOYSA-N	440.475	1.637	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H](CCC(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)C1	758717287	SVLVLRPMRYYQRD-MRXNPFEDSA-N	444.488	1.900	50	20	IDGD	
CCNS(=O)(=O)c1ccc(CC(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)cc1	759352778	VDPWEDKXKYPHNV-MRXNPFEDSA-N	433.530	1.759	50	20	IDGD	
COCCS(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1	759399321	QHKIJXNVGURHRL-UHFFFAOYSA-N	436.446	1.159	50	20	IDGD	
CCO[C@@H]1C[C@@H](NC(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)[C@@]12CCCO2	760144099	UQJBRDGPZYIPLW-YVHKJVDXSA-N	443.504	1.648	50	20	IDGD	
CC[C@H](NC(=O)NNC(=O)COc1ccccc1O)[C@H]1CN(Cc2ccccc2)CCO1	760900085	URFMHOQDFXSJFV-GHTZIAJQSA-N	442.516	1.781	50	20	IDGD	
CN(C)N(C(=O)c1cc(I)ccc1F)[C@H]1CCS(=O)(=O)C1	762270820	VCCSGJFHHYLHCK-JTQLQIEISA-N	426.251	1.536	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)C(C)(C)n3cc([N+](=O)[O-])cn3)n[nH]2)cc1OC	763147981	KRFRYYPFFOXPDG-UHFFFAOYSA-N	443.420	1.395	50	20	IDGD	
CC(=NNC(=O)C1CCN(c2ncccn2)CC1)c1c(C)nn(CCS(C)(=O)=O)c1C	763172059	DOZZDWXFTKGPGA-UHFFFAOYSA-N	447.565	1.091	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2cccc(C)c2)c1	763507707	BEPWDMIYOGBZEA-UHFFFAOYSA-N	432.502	1.425	50	20	IDGD	
CN(Cc1cccc(NC(=O)C(=O)NNC(=O)c2ccccc2O)c1)C(=O)C(F)(F)F	763525711	FRUUWTUODYTZHZ-UHFFFAOYSA-N	438.362	1.313	50	20	IDGD	
CN1CCc2ccc(NC(=O)C(=O)NNC(=O)c3cc4ccccc4cc3O)cc2C1=O	763525811	DODLNEOJXVSPGF-UHFFFAOYSA-N	432.436	1.573	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)Nc1ccc(F)c(C(F)(F)F)c1	763569464	ABIBNJIARGRHIK-CQSZACIVSA-N	427.310	1.770	50	20	IDGD	
CCS(=O)(=O)c1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)c1cc(C)oc1C	763577349	WMOANHFPWSVXDL-UHFFFAOYSA-N	427.866	1.743	50	20	IDGD	
CCOC(=O)c1c(C)csc1NC(=O)C(=O)NNC(=O)[C@@H]1COc2ccccc2O1	763578228	NFWPLGFIRPSCBD-ZDUSSCGKSA-N	433.442	1.159	50	20	IDGD	
CN(C)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C(C)(C)C)cc2)cc1	763596320	VZDOLVRFSDRGCL-UHFFFAOYSA-N	440.500	1.851	50	20	IDGD	
CCn1cnnc1-c1cccc(NC(=O)C(=O)NNC(=O)c2c(C)nc3ccccn23)c1	763629009	NRXOJTJEVQDGQI-UHFFFAOYSA-N	432.444	1.321	50	20	IDGD	
COC(=O)c1c(C2CC2)csc1NC(=O)C(=O)NNC(=O)COc1ccccc1OC	763648914	XXQRFXUTJZWFIM-UHFFFAOYSA-N	447.469	1.586	50	20	IDGD	
Cc1cc(F)ccc1NC(=O)C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	763796426	DJEGZICEZQSZPN-UHFFFAOYSA-N	448.476	1.318	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)N(C)CCO3)c1C	763849818	NIDCRKMDONWNPT-OAHLLOKOSA-N	426.473	1.685	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cc(C(=O)NC)ccc2C)cc1	763862239	WLZICZJKDOOVEG-CQSZACIVSA-N	442.472	1.307	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(C(C)=O)cc2)cc1C	763870510	ACKKXJYYRNYOBQ-CQSZACIVSA-N	441.440	1.538	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2cnn(-c3ccc(C(F)(F)F)cc3)c2)n1	763881998	RWHHLIMGNSWRMW-UHFFFAOYSA-N	449.393	1.491	50	20	IDGD	
CCOC(=O)c1cc(C(C)(C)C)sc1NC(=O)C(=O)NNC(=O)Cn1nc(C)cc1C	763893268	SOLDLXXTZDXLNP-UHFFFAOYSA-N	449.533	1.822	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1cc(C(F)(F)F)cnc1O	764012228	MVGYZZJXXJGSAH-UHFFFAOYSA-N	432.742	1.868	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccc(N2C[C@@H](C)O[C@H](C)C2)nc1	764136844	UTKYDAYWDGCBPM-HUUCEWRRSA-N	441.488	1.032	50	20	IDGD	
Cc1nnnn1-c1cc(NC(=O)C(=O)NNC(=O)c2cccc3cccnc23)ccc1F	764150821	CMDQUPPHGLGING-UHFFFAOYSA-N	434.391	1.058	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)C(=O)N2CCc3c(F)cccc32)c1	764233856	ZGGGGLGUPKMOBX-UHFFFAOYSA-N	436.237	1.947	50	20	IDGD	
Cc1ncsc1C(=O)NNC(=O)C(=O)Nc1ccc(I)cc1	764247508	RLONLYSIHGSINL-UHFFFAOYSA-N	430.227	1.456	50	20	IDGD	
CC(C)(C)OC(=O)N1CCc2cc(NC(=O)C(=O)NNC(=O)Cc3cc[nH]n3)ccc21	764286182	PJQDCOVTLJWRPU-UHFFFAOYSA-N	428.449	1.036	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(F)cc2C#N)cc1Br	764327013	SYLJYMBEJVDOQT-UHFFFAOYSA-N	435.209	1.868	50	20	IDGD	
COCCOc1cccc(NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)c1	764381966	DTRYGBKTSDFLFL-UHFFFAOYSA-N	429.458	1.563	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(OC2CCCC2)c(Cl)c1	764398060	CLHVSFKGHSEGFY-LBPRGKRZSA-N	427.885	1.799	50	20	IDGD	
COc1ccc([N+](=O)[O-])c(C(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)c1	765756449	XCKCOPTZOYWSMU-UHFFFAOYSA-N	441.488	1.491	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)CCc2ccccc2[N+](=O)[O-])cc(OC)c1OC	766306795	HXQSDCJXDAFODH-UHFFFAOYSA-N	439.446	1.428	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3ccccc3Cn3cccn3)CC2)cc1	766648930	LUPYQXHIFRKXJS-UHFFFAOYSA-N	446.555	1.819	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)[C@@H](Br)C(C)(C)C)cc1OC	766749868	FTYLTYFTWWWXIN-CQSZACIVSA-N	431.283	1.818	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)C1CCN(C(=O)N2CCCC2)CC1	767283862	DMXYUWBHTLXMKN-UHFFFAOYSA-N	430.505	1.156	50	20	IDGD	
C[C@H](C(=O)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1)N1C(=O)[C@H]2CCCC[C@@H]2C1=O	768280415	ZXSWNTHWZIRGAO-UGFHNGPFSA-N	427.436	1.541	50	20	IDGD	
CCCOc1ccc(C(=O)NNS(=O)(=O)c2ccc(C(=O)O)c(F)c2)cc1OC	768496569	MBQYNYFAJNIHKV-UHFFFAOYSA-N	426.422	1.945	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)NC3CCN([C@H]4CCC[C@H]4O)CC3)n[nH]2)cc1	769154379	KGVBWJRENVSMFB-VQTJNVASSA-N	426.521	1.707	50	20	IDGD	
Cc1ccc(C)n1-c1c(C(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)cnn1C	772890562	ZALBQIPDIHYHIJ-UHFFFAOYSA-N	428.880	1.558	50	20	IDGD	
N#Cc1ccc(Cl)c(S(=O)(=O)N2CCN(S(=O)(=O)CBr)CC2)c1	772947823	QELGQVGILOYEFI-UHFFFAOYSA-N	442.744	1.200	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)o1	772952673	IXUSZMZGBHADNN-GFCCVEGCSA-N	441.893	1.946	50	20	IDGD	
CCNC(=O)C(C)(C)CNC(=O)NNC(=O)[C@@H](C)Oc1cccc(Br)c1	772973648	BSVHECTYWYOODZ-LLVKDONJSA-N	429.315	1.709	50	20	IDGD	
C[C@@H](NCC(=O)NNC(=O)c1cccc(Cl)c1)c1cccc(S(=O)(=O)N(C)C)c1	775337489	HVLXKZVMBDEBSV-CYBMUJFWSA-N	438.937	1.702	50	20	IDGD	
COc1ccc(SC)c(OC)c1C(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	775639126	OZSYCNZFKUXJAS-UHFFFAOYSA-N	428.470	1.747	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(C)c(C(=O)NNc2cccc(S(C)(=O)=O)c2)c1	776527570	HYVOYOAAHLUTTH-UHFFFAOYSA-N	441.531	1.080	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNc2cccc(S(C)(=O)=O)c2)c1	776540030	PEIDKICQCIRCNX-UHFFFAOYSA-N	425.532	1.878	50	20	IDGD	
O=C(NNC(=O)[C@]1(F)CCN(C(=O)OCc2ccccc2)C1)c1ccc2c(c1)OCCO2	776757837	ADMMJWALQJEOAC-QFIPXVFZSA-N	443.431	1.970	50	20	IDGD	
O=C(NNC(=O)[C@H]1CC[C@H](C(=O)NNC(=O)c2ccccc2F)CC1)c1ccccc1F	777878683	YWTVZVAVWLHNHM-HDJSIYSDSA-N	444.438	1.993	50	20	IDGD	
CCOC(=O)C1=NN(c2ccccc2)[C@H](C(=O)NNc2ncc(C(=O)OCC)c(C)n2)C1	778424479	USQCFUIWXDNCHD-KRWDZBQOSA-N	440.460	1.603	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)N[C@H]1CCN(C(=O)CCc2ccccc2)C1	778701038	KRUWTKHOUATJLH-INIZCTEOSA-N	433.509	1.075	50	20	IDGD	
CCc1cc(NNC(=O)c2cc(S(=O)(=O)N(C)C)cn2C)nc(-c2ccccn2)n1	779198085	FBODWWQAHWCMMV-UHFFFAOYSA-N	429.506	1.447	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)cc1Br	779504761	GSXJDLXZCIDYSB-QMMMGPOBSA-N	436.284	1.054	50	20	IDGD	
CC(C)n1ncc2ccc(NC(=O)C(=O)NNC(=O)Cc3nc4ccccc4n3C)cc21	782892258	AZYQOZLPVZRYRI-UHFFFAOYSA-N	433.472	1.833	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C(=O)Nc2ccccc2O[C@H]2CCOC2)nc2ccccc21	782893628	KEKHVUJJHSQDRR-AWEZNQCLSA-N	437.456	1.070	50	20	IDGD	
COC(=O)COc1ccccc1C(C)=NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	783813475	MKDTXGFEEAXPOZ-UHFFFAOYSA-N	439.877	1.693	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2ccnn2Cc2ccccc2Br)ncn1	783944064	COZKTDKTRKNXEI-UHFFFAOYSA-N	430.266	1.874	50	20	IDGD	
O=C(NNc1cccc(C(F)(F)F)n1)C(=O)Nc1cccc(C(=O)N2CCOCC2)c1	784954447	MIPFXTOLDUIGOV-UHFFFAOYSA-N	437.378	1.655	50	20	IDGD	
CCOc1ccc(OCC)c(NC(=S)NNC(=O)c2cn(Cc3noc(C)n3)nn2)c1	784986531	CDFNRZVHBNJVEF-UHFFFAOYSA-N	446.493	1.447	50	20	IDGD	
CCCC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)c1C	785067853	QETKNRWVDNXLPA-UHFFFAOYSA-N	436.472	1.710	50	20	IDGD	
COc1ccc2nc(NNC(=O)C(=O)Nc3ccc4c(c3)S(=O)(=O)CC4)c(C)cc2c1	785162527	FULDGCJQOJCHDR-UHFFFAOYSA-N	440.481	1.963	50	20	IDGD	
CCCS(=O)(=O)Nc1cccc(NC(=O)C(=O)NNc2nccc(N(CC)CC)n2)c1	785235806	SASQAPXRXMRTIG-UHFFFAOYSA-N	449.537	1.556	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1cc(F)cc(F)c1Br	785991357	QVJLJOFDTZUBKY-UHFFFAOYSA-N	444.188	1.598	50	20	IDGD	
O=C(NNc1nnc(-c2ccccn2)s1)[C@@H]1CCN(c2ccc3c(c2)OCCO3)C1=O	788567700	QFDMKZIJMNXEKU-ZDUSSCGKSA-N	438.469	1.868	50	20	IDGD	
CCN(C)C(=O)[C@H](C)NC(=O)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1	788896903	RSAAVWUGPYKQAE-UWJYYQICSA-N	437.544	1.811	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2nc3c(s2)CCCC3)c2ccccc2c1=O	789731751	GYJNWQJXZNPLJR-UHFFFAOYSA-N	440.485	1.151	50	20	IDGD	
Cc1nc(-c2cccc(NC(=O)C(=O)NNC(=O)[C@H]3OCC[C@H]3c3ccccc3)c2)no1	789822243	USKKRFZLVRKZRC-ROUUACIJSA-N	435.440	1.704	50	20	IDGD	
CNS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2cc(-c3ccc(C)c(C)c3)[nH]n2)nc1	792401816	ZNIHWNHVNPNQDT-UHFFFAOYSA-N	443.489	1.463	50	20	IDGD	
Cc1c(Br)cc(N)cc1C(=O)OCC(=O)NNC(=O)c1cccc(C#N)c1	792404355	NWPXORRFHLZWPQ-UHFFFAOYSA-N	431.246	1.829	50	20	IDGD	
CCOC(=O)NNC(=O)CCc1nc2cc(S(=O)(=O)N(CC)CC)ccc2n1CC	792609434	CZXDXYMMBQNQTH-UHFFFAOYSA-N	439.538	1.797	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(CC(=O)NNC(=O)c2ccc(Br)s2)cc1	792826634	HVRHJAVVWFQLPC-UHFFFAOYSA-N	446.348	1.765	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)[C@H](C)c2ccc3c(c2)OCO3)cc1OC	795912914	WADKMCCJBXWMKI-GFCCVEGCSA-N	430.413	1.540	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)cc1OC	796990207	OUWCNIDBQZYSMZ-LLVKDONJSA-N	433.392	1.174	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)C(=O)Nc1cccc2c1CCO2	796992075	LUOVEUYLLIBHGM-UHFFFAOYSA-N	434.246	1.549	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2cn(C)nc2C(C)C)n[nH]1	797005204	AKUMOBJDWMZEFH-UHFFFAOYSA-N	425.449	1.342	50	20	IDGD	
CNC(=O)COc1ccc(NC(=O)C(=O)NNc2ccc(Cl)cc2[N+](=O)[O-])c(C)c1	797048266	XMQPQCGYWADMIR-UHFFFAOYSA-N	435.824	1.763	50	20	IDGD	
CC(=O)N[C@](C)(C(=O)NNc1nc(-c2ccncc2)no1)c1ccc(S(C)(=O)=O)cc1	797720645	ZMZCJPYYJYHGOR-IBGZPJMESA-N	444.473	1.030	50	20	IDGD	
NC(=O)[C@H]1CC(C(=O)NNC(=O)Nc2ccc(Br)cc2)=NN1c1ccccc1	801996376	IGYJCTLHFXISOD-OAHLLOKOSA-N	445.277	1.722	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)N[C@@H](C)CCNS(=O)(=O)c2ccccc2)c1	802528419	YLZCJXDRBPHJRT-KRWDZBQOSA-N	448.545	1.770	50	20	IDGD	
CC(=O)N1CCN(Cc2ccccc2NC(=O)NNc2ccc(-n3ccnc3)nn2)CC1	806442641	NLFKQOKKHDBICG-UHFFFAOYSA-N	435.492	1.475	50	20	IDGD	
O=C(NNc1ncccc1F)C(=O)Nc1cccc(S(=O)(=O)NC2=NCCCCC2)c1	807301416	BFTONISGYGQPGU-UHFFFAOYSA-N	448.480	1.553	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)[C@H]1CCCN1C(=O)c1ccc(OC)cc1OC	807371980	XPPJMWCYAOFKOY-MRXNPFEDSA-N	437.493	1.245	50	20	IDGD	
Cc1cc([N+](=O)[O-])ccc1NNC(=O)C(=O)Nc1ccccc1CN1C(=O)CCC1=O	807456845	VPKORUHTHPTHFY-UHFFFAOYSA-N	425.401	1.634	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCc2nncn2C1)C(=O)Nc1cccc(-c2cccc(Cl)c2)c1	815691926	FQCIJUBWYQATRO-OAHLLOKOSA-N	438.875	1.947	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)c1ccc(Cl)c(N2CCNC2=O)c1	817055390	ZUCKTWXRGXWZMZ-UHFFFAOYSA-N	437.909	1.877	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)CN2C(=O)N[C@]3(C[C@H](C)CC(C)(C)C3)C2=O)c1	825776109	BPDGPNWRCXRVKE-PEBXRYMYSA-N	445.520	1.391	50	20	IDGD	
COCCn1cnc2c1c(=O)n(CC(=O)NNc1ccccc1)c(=O)n2Cc1ccccc1	868084524	ACFUQYAMABMYTE-UHFFFAOYSA-N	448.483	1.198	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1cccnc1-n1cccn1	878909677	HUEUETSQGKWBJI-UHFFFAOYSA-N	429.820	1.547	50	20	IDGD	
COCCN1C[C@@H](C(=O)NNC(=O)c2ccccc2OCc2ccc(F)cc2)CC1=O	914458411	SAKRKMKJACFORE-INIZCTEOSA-N	429.448	1.661	50	20	IDGD	
C[C@@H](NC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)[C@H]1C[C@H]2CC[C@H]1C2	915883184	CZOBHRWCGDVSJE-MUQADHOPSA-N	436.582	1.469	50	20	IDGD	
COc1cc(C=NNC(=O)CNc2ccccc2F)ccc1OCC(=O)N1CCOCC1	915919267	OTVKXDVVQMAWPK-UHFFFAOYSA-N	444.463	1.634	50	20	IDGD	
Cc1ncc2c(n1)CC[C@H](NC(=O)NNC(=O)COc1ccc(Br)cc1)C2	916318756	XRQRYTFLPFDLLC-AWEZNQCLSA-N	434.294	1.814	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NCCCN2CCN(c3ccccc3)CC2)cc1	916489830	QCFZGUHIQAPGDL-UHFFFAOYSA-N	441.532	1.617	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)c1cc(Br)c[nH]1)N1CCN(c2ccccc2)CC1	916514362	BDFWUSMAQNXEJX-AWEZNQCLSA-N	449.353	1.932	50	20	IDGD	
COC[C@@H](C)n1c(C)cc(/C=C(\C#N)C(=O)NS(=O)(=O)c2cc(C(N)=O)n(C)c2)c1C	916789273	RKOQHNFHRALDGY-DFWYYUMKSA-N	447.517	1.162	50	20	IDGD	
O=C(COC(=O)c1cc(Cl)c2c(c1)OCO2)NNC(=O)[C@H]1COc2ccccc2O1	917241758	CUJOJPNFGRLPFI-OAHLLOKOSA-N	434.788	1.213	50	20	IDGD	
O=C1CN(C(=O)c2ccc(CNS(=O)(=O)c3ccc(CCCl)cc3)cc2)CCN1	917910438	KWCMGLYOMPHDPX-UHFFFAOYSA-N	435.933	1.518	50	20	IDGD	
CCOc1ccc(CNC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)cc1	920342762	GDGKUDKFUCHDOK-UHFFFAOYSA-N	448.549	1.243	50	20	IDGD	
Cc1ccccc1NS(=O)(=O)c1ccc(C(=O)NNC(=O)CN2CCCC2=O)cc1	920827023	QWNWCQDWVYYKGE-UHFFFAOYSA-N	430.486	1.179	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)NNC(=O)c2ccc[nH]2)cc1	920849376	PIXURNNYUAJQHX-PTNGSMBKSA-N	447.455	1.130	50	20	IDGD	
CN(CCO)S(=O)(=O)c1ccc(C(=O)NNc2ccccc2Br)cc1	1321135876	HDWTYPOCELEHSB-UHFFFAOYSA-N	428.308	1.819	50	20	IDGD	
O=C(c1cc2n(n1)CCCC2)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1778561796	OQQCJPRRNICYTK-RHSMWYFYSA-N	429.290	1.353	50	20	IDGD	
CCC1(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cnccc3C(=O)NN)C2)CCC1	1779372648	RVDHZNMGPKFWCJ-WZONZLPQSA-N	443.548	1.393	50	20	IDGD	
Cn1nc(C(F)(F)F)cc1C(=O)N1CC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1779656576	DLGFKPWWTJZPSS-CQSZACIVSA-N	429.226	1.686	50	20	IDGD	
Cc1noc(N)c1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Br)C1	1780771602	MVBUXHYVDJOYGZ-RSAASHCRSA-N	433.278	1.383	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)C(C)(C)Oc3ccc(C)cn3)C2)C1	1780971395	XSCCEVWKUUSXGX-HRAATJIYSA-N	439.940	1.631	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)CCNC(=O)c3ccc[nH]3)CCO2)C1	1781223652	AKZMFHFXDCOBPI-RBUKOAKNSA-N	445.347	1.201	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781334259	NSFSXHYEWJWNJB-HFAKWTLXSA-N	425.251	1.068	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cn1cc(C)cn1)C2	1781899892	CNZGCXUAEPIBLJ-FRQCXROJSA-N	441.370	1.879	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C[C@@H](N)c1cccnc1)C2	1782170714	UTDFQKWNUXDVLN-XKGFGPFHSA-N	438.956	1.239	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc3c[nH]nc13)C2	1782172535	GCOLRIIQPYMPES-CBGDNZLLSA-N	434.924	1.944	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)Oc1cccnc1)C2	1782178220	JHFTYQJAVBBBQS-DZKDUJFISA-N	439.940	1.617	50	20	IDGD	
O=C(NCCC(=O)N1CCO[C@@]2(CCN(C(=O)C(Cl)Cl)C2)C1)c1ccccc1	1783951361	GKZVWNPMCIAHBE-IBGZPJMESA-N	428.316	1.440	50	20	IDGD	
COC(=O)CCCCCC(=O)N1CC[C@@]2(C1)CN(C(=O)CO[Si](C)(C)C)CCO2	1784050567	UQQYOTYGLMROFI-HXUWFJFHSA-N	428.602	1.791	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc(OC)c(F)c3)[C@H]2C1	1785640574	AVHPMBAYUTUQPO-ZIEJDFEHSA-N	429.876	1.076	50	20	IDGD	
CCS(=O)(=O)N[C@H](C)C(=O)Nc1ccc(C2(NC(=O)[C@H](O)CCl)CCC2)cc1	1786335358	BFDDJGQLUGVIBG-IUODEOHRSA-N	431.942	1.048	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccnc(OC)c3F)[C@H]2C1	1787139734	UCUFTYXPKJZIMV-MHEUCROKSA-N	429.876	1.076	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)c1nc2ccccn2n1	1787263046	LOSAFKFLRCBSAQ-IHRRRGAJSA-N	436.310	1.108	50	20	IDGD	
O=C(NC1(c2ccc(NC(=O)c3ccc(O)cn3)cc2)CCC1)c1cccc(B(O)O)c1	1787581579	YJNYGWFHPDQKBF-UHFFFAOYSA-N	431.257	1.529	50	20	IDGD	
COc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]32)nc1	1787760735	SNUHDNLRBFRHGB-BCRCDCHUSA-N	430.332	1.920	50	20	IDGD	
C[C@H](Cn1ccnc1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]2C1	1789873522	YOPHSTSXHOCKTO-XZLOLGPPSA-N	431.364	1.735	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21)[C@H]1CC(c2ccccc2)=NN1	1790546762	IIEIBQLUPWAJII-DIECFANBSA-N	439.343	1.536	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccnc(C(F)(F)F)c3)C[C@@H]21	1791252407	KPKJNUOSCKWELC-AJNGGQMLSA-N	449.857	1.948	50	20	IDGD	
CC#C[C@@H](CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)c1ccc(O)cc1	1791331276	QHYQZYLVZGGAFI-UGKANONSSA-N	448.947	1.469	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1csc(Br)n1)C2)[C@@H](F)Cl	1796364326	CMLURPSPPRNCMF-BKFJMODKSA-N	426.695	1.643	50	20	IDGD	
Cc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)CBr)C3)cc(O)n1	1796373867	UEIYQJDTDLYOAJ-BWPSIRRCSA-N	426.311	1.330	50	20	IDGD	
COc1ncccc1CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CO[Si](C)(C)C	1797952696	GXLUQXISQNLGMX-XEMDLRDOSA-N	435.597	1.464	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc([N+](=O)[O-])[nH]1	1798747482	AGAWQLSTSBSRLC-FBKDDSFISA-N	429.271	1.300	50	20	IDGD	
COc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Br)c(C)c1	1799348339	FNKWNFWZECIKNC-VZAMPYOESA-N	429.286	1.897	50	20	IDGD	
COc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Br)ccc1C	1799349031	UOZCJBDQMRIONG-XRGAULLZSA-N	429.286	1.897	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2)c1ccc(N2CCCOC2=O)cc1	1799815914	CFUFRZRATCMHTK-YALNPMBYSA-N	439.871	1.771	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccnc(OCC(C)C)c1)C2	1800975939	YKDRMPWBOMVDEF-ZMMAXQRCSA-N	439.940	1.573	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc([N+](=O)[O-])cc3c1OCC3)C2)C(Cl)Cl	1801016374	FQQLVPDBHBRNGU-GNXNZQSNSA-N	444.271	1.537	50	20	IDGD	
C#CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2	1802126523	IDWSNEOGFMMMMM-XLWJZTARSA-N	431.892	1.027	50	20	IDGD	
C[C@H](NNc1ccccc1)C(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1	1802508314	AULDKWNGZADJQF-SMMRIJLZSA-N	445.951	1.692	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CCC(=O)N2CCCC2)[C@H]1c1cccnc1)[C@@H](O)CCl	1803136325	PAKCBNGHXLUGIN-ZWOKBUDYSA-N	436.940	1.090	50	20	IDGD	
CCOC(=O)C(C)(C)C(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]1c1cccnc1	1803148922	QZPDUTUBJBIOIF-OWCLPIDISA-N	425.913	1.276	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)C1=CCCS1	1803634861	UHWJMZIXMSEFSW-FXAWDEMLSA-N	437.330	1.102	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2nccnc2C(N)=O)[C@@H]1c1cccnc1	1803692315	SGXLJQXXCOKARA-RLFYNMQTSA-N	444.923	1.698	50	20	IDGD	
Cc1nc(CC(=O)NC[C@@H]2CCN(C(=O)[C@H](C)Br)[C@H]2c2cccnc2)no1	1804496592	QIDJGANLZQWEMC-YLVFBTJISA-N	436.310	1.805	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2cnc(OC)cn2)[C@H]1c1cccnc1	1806044896	COBBBZWJIOQDRG-RLFYNMQTSA-N	433.896	1.454	50	20	IDGD	
CC(C)(C)CC(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1	1806306393	JFLUJGGWXHSLMY-OXJNMPFZSA-N	438.532	1.836	50	20	IDGD	
N=C(N)SCC(=O)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@@H]1c1cccnc1	1807005816	HWUHYFOMIZGVCB-UHTWSYAYSA-N	432.319	1.405	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)c2ccccc2O)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807360343	AGLFXEDXDXTSLF-XMSQKQJNSA-N	445.284	1.100	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)/C=C/c2ccco2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1	1807369444	JXMDWMZLFKUNPE-PFTYNZSZSA-N	445.284	1.387	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)ccn1	1807374798	JJTHAWZNEKOWLD-RBBKRZOGSA-N	444.300	1.098	50	20	IDGD	
CC(=O)N[C@H](C)C(=O)N1CC[C@H](CNC(=O)[C@@](C)(Cl)CCl)[C@@H]1c1cccnc1	1808317993	PUQGJTBUMXWIEQ-RXMXQMHTSA-N	429.348	1.848	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H](CNC(=O)COCCO)[C@H]1c1cccnc1	1808601188	IVUGZBBBROMGEL-FRFSOERESA-N	428.327	1.127	50	20	IDGD	
O=C(Cc1ccccc1F)N1CCCC2(CCN(C(=O)c3ccc(B(O)O)cc3)CC2)C1	1809215297	ILRSSKDWVXNOMT-UHFFFAOYSA-N	438.308	1.593	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)[C@@H](C)Cn2cncn2)[C@@H]1c1cccnc1	1810480048	MRWVSHKFHHHDRY-DIECFANBSA-N	449.353	1.799	50	20	IDGD	
O=C(/C=C/c1ccccc1)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2	1814027449	VQWBYFARWUWJRD-QPEODSHDSA-N	447.325	1.762	50	20	IDGD	
O=C(CNC(=O)c1cccs1)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1	1815919722	FWTISOWSNBNPHX-OLZOCXBDSA-N	439.925	1.493	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1ccns1	1816273328	LIGKHYXJUFPWJP-HNNXBMFYSA-N	425.279	1.166	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CN2CCNC2=N)n[nH]1	1817296249	CHDRIZKTVSMZMH-SJKOYZFVSA-N	430.340	1.478	50	20	IDGD	
CC(=O)Nc1cc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)[C@H](O)CCl)[nH]n2)ccn1	1818416592	TYNVLJLEGFEFJH-LSDHHAIUSA-N	434.884	1.669	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)COc2cccnn2)[nH]n1)[C@H](F)Br	1820937838	RLHIKNOQEYYUGA-ABAIWWIYSA-N	441.261	1.961	50	20	IDGD	
CC[C@@H](Br)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H]2CCC(=O)N2)[nH]n1	1822088624	WVQILIYRYDNZCB-NTZNESFSSA-N	426.315	1.854	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CNC(=O)OC)n[nH]1	1822625858	FPTDLQRRWWAAFY-JQWIXIFHSA-N	430.303	1.931	50	20	IDGD	
O=C(CCNC(=O)c1ccccc1)Nc1cc([C@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1	1823352836	MSPPZRVVCMNGHG-IAGOWNOFSA-N	447.923	1.822	50	20	IDGD	
C[C@H](NC(=O)c1ccccn1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](F)Cl)CC2	1824548736	KDWBDTCAFNUFMG-RBZYPMLTSA-N	439.900	1.803	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)C2CCOCC2)CC1	1826578407	DXHGHWSUCWJJNX-OAQYLSRUSA-N	428.338	1.026	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)ccn1	1829246434	ZLRPPGXLUDOGJZ-JOCHJYFZSA-N	435.333	1.617	50	20	IDGD	
O=C(C1CC(F)(F)C1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1829991790	VYFASQUIMOHMTF-RISCZKNCSA-N	429.233	1.179	50	20	IDGD	
COc1ccccc1CCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1830991705	DNGWXAXXOMSLOL-AZUAARDMSA-N	428.888	1.619	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)C3CCC(CO)CC3)CCO2)C1	1832514181	NEIOJXOEEMEEIW-MYKUNDNFSA-N	430.973	1.507	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)/C=C/c3ccoc3)CCO2)C1	1832652347	FUVXRNUTYRHZQA-HEFFKOALSA-N	427.295	1.533	50	20	IDGD	
O=C(/C=C/c1ccco1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1833078823	XXWWHADYKXMEKY-PKOQZONYSA-N	431.258	1.440	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@H](CC)NC(C)=O)CC2)CC1	1833093872	OECIPCRYIVEIER-MOPGFXCFSA-N	429.005	1.880	50	20	IDGD	
Cc1nc(CC(=O)N2CCO[C@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)c(C)s1	1833150129	OOCAATQFYJJFJZ-QGZVFWFLSA-N	436.361	1.563	50	20	IDGD	
O=C(CCBr)NC1CCN(C2CCN(C(=O)CN3CCCCC3)CC2)CC1	1834421098	DKHZCARYROPVST-UHFFFAOYSA-N	443.430	1.829	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)[C@H]3CCCO3)CC2)CC1	1834900028	MXGWMLWIJDRBTN-RHSMWYFYSA-N	430.387	1.768	50	20	IDGD	
CN1CCCC[C@H]1C(=O)N1CCC(N2CCC(NC(=O)CO[Si](C)(C)C)CC2)CC1	1835835072	MICYJXGYSRDORU-FQEVSTJZSA-N	438.689	1.894	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)c1cnc(Cl)s1	1835993129	XDAGBEBYTAIXMH-CYBMUJFWSA-N	435.377	1.581	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)Cc3cnccn3)CC2)CC1)[C@H](F)Br	1836414202	YRYQKOYPZSAGEX-KRWDZBQOSA-N	442.333	1.281	50	20	IDGD	
Cc1n[nH]c(C)c1CC(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836717547	GACHTMKYHVFABS-GOSISDBHSA-N	426.945	1.167	50	20	IDGD	
CCC(=O)N[C@@H](C)C(=O)N1CCC(OC2CCN(C(=O)[C@H](C)Br)CC2)CC1	1836817728	IRLMXKBXYDYVTP-KBPBESRZSA-N	446.386	1.683	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3c(C)nc4sccn34)CCO2)C1	1837145525	XPMHGCSVNYPWDJ-AUUYWEPGSA-N	440.953	1.792	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)C#CC3(O)CCCCC3)CCO2)C1	1837486349	BYOSRVMIDNEKNJ-XMSQKQJNSA-N	440.968	1.549	50	20	IDGD	
O=C(c1ccncn1)N1CCC(OC2CCN(C(=O)[C@H](F)Br)CC2)CC1	1838116918	QODLTCOTNYMZMX-HNNXBMFYSA-N	429.290	1.779	50	20	IDGD	
COc1c(Cl)ccnc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1838727981	CNNRIHHYDXMQHG-RHSMWYFYSA-N	436.267	1.348	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)C#CC(=O)O)CC2)CC1	1838764383	JIKUIYAPFOQCIF-OAHLLOKOSA-N	429.311	1.247	50	20	IDGD	
CN1CCC[C@H](C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)C1	1839067215	JHKFWFSEAQRHJB-SNRMKQJTSA-N	436.380	1.021	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCCCCC(=O)OC)C2)C1	1839149022	QICUPYAVKYXYDF-OXQOHEQNSA-N	432.945	1.584	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnn4c3CCC4)CCO2)C1	1839532953	KDYHYHPOAWVFLO-RTBURBONSA-N	445.347	1.136	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1[C@@H]3C=CS[C@@H]13)CCO2	1839700104	FQSWEAVADVZNAQ-REVBEMBVSA-N	431.352	1.101	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)cnc1C	1840031473	RJWXLYPMZGNQEA-AUUYWEPGSA-N	440.338	1.552	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(OC)c(F)c3)C2)C1	1840149163	GOMLGHQPBHBWOV-FOIQADDNSA-N	444.887	1.158	50	20	IDGD	
Cc1cc(C#N)cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)c1	1840189980	WDQZEGFKWXEPLJ-LJQANCHMSA-N	426.300	1.740	50	20	IDGD	
Cc1cc(C)n(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)n1	1840348662	VOSFFUAFNQLEPU-SFHVURJKSA-N	433.336	1.150	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)Cc2cc(OC)c(OC)c(OC)c2)C1	1841785928	QGWVEGDAPDFOSS-HNNXBMFYSA-N	440.924	1.712	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)Cc1ccc(F)c(F)c1)C2	1844263844	AKXACARVTMIIRS-UHFFFAOYSA-N	429.427	1.023	50	20	IDGD	
CCOC(=O)c1ncn2c1CC[C@@H](C(=O)N1CC3(CCCN3C(=O)[C@@H](Cl)CC)C1)C2	1845167107	JATODEMPTGAVDF-CABCVRRESA-N	436.940	1.843	50	20	IDGD	
Cn1nc(C(=O)N2CC3(CCCN3C(=O)[C@H](Br)Cc3ccccc3)C2)cc1O	1845940355	KTGRNXREQIKBMQ-OAHLLOKOSA-N	447.333	1.949	50	20	IDGD	
CC(C)(C)OC(=O)N1CC2(C[C@H]2C(=O)N2CCCC23CN(C(=O)[C@@H](O)CCl)C3)C1	1846115874	NSXOOXWLZDOJCW-KBPBESRZSA-N	427.929	1.047	50	20	IDGD	
C[C@@H](O)[C@H](NC(=O)c1ccccc1)C(=O)N1CC2(CCCN2C(=O)C(Cl)Cl)C1	1846386760	VFZZXSYJPQUOLW-OCCSQVGLSA-N	428.316	1.173	50	20	IDGD	
Cc1ccc(C(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)c(F)c1F	1846816076	AIGWYRVDCJSKRK-UHFFFAOYSA-N	429.427	1.403	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](C)CBr	1847498965	VSNMXVKKVKTQBG-GMLWRBGVSA-N	438.326	1.353	50	20	IDGD	
O=C1C[C@@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](F)Br)CN1C1CCCC1	1848040642	PKUZMJNQHKBGQW-AOLWHUPESA-N	430.318	1.670	50	20	IDGD	
COc1cn(-c2ccccc2)nc1C(=O)NNC(=O)c1cc(OC)c(OC)c(OC)c1	15662827	IESOQZZRIKYUSK-UHFFFAOYSA-N	426.429	1.982	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)/C=C/c1ccccc1)C(=O)NNC(=O)c1ccccn1	17328504	FTOYVCYDBOGREO-WKOYGUFESA-N	434.543	1.555	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)Cn1c(=O)oc2ccccc21	26633909	HZOXFLNBTNTPOY-NSHDSACASA-N	434.246	1.972	50	20	IDGD	
O=C(CSc1ccc(Cl)cc1)NNC(=O)c1cccc(CN2C(=O)CNC2=O)c1	26772559	VKKKGSOXNCGRAF-UHFFFAOYSA-N	432.889	1.945	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)CNC(=O)c2cnc3ccccc3c2O)c1C	107526990	FNFISBQQIPQLMI-HNNXBMFYSA-N	436.468	1.902	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)N1CCCN(C(=O)c2ccc(F)cc2)CC1	725872946	SXMAUORGKJTZII-UHFFFAOYSA-N	447.492	1.206	50	20	IDGD	
COc1ccc(N2CCCN(C(=O)NNC(=O)CNC(=O)c3cccs3)CC2)cc1	725873560	OONLZTVBNHARPB-UHFFFAOYSA-N	431.518	1.440	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)c1ccccc1C(=O)c1ccc(F)c(F)c1	725902859	VQOWPQYJMKFZMH-UHFFFAOYSA-N	427.363	1.980	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2cccn2C)nnn1C1CCN(C(=O)OC(C)(C)C)CC1	726157141	PWMKWGCGQKQZKV-UHFFFAOYSA-N	431.497	1.572	50	20	IDGD	
COC(=O)[C@@H](C)CNC(=O)/C(C#N)=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	726177866	XMGSAXXGHUHMKK-GRRFOWRYSA-N	443.891	1.911	50	20	IDGD	
COc1cc(/C=C\C(=O)N([C@@H]2CCS(=O)(=O)C2)N(C)C)cc(Br)c1O	728178991	GRYNCZUYKKRMOI-QMAVJUDZSA-N	433.324	1.669	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)COc3ccc([N+](=O)[O-])cc3)cc2)CC1	728212898	KOPIHQJMTKPXAO-UHFFFAOYSA-N	449.489	1.053	50	20	IDGD	
CC[C@H](C)C(=O)NNS(=O)(=O)c1ccc(S(=O)(=O)N2C[C@@H](C)C[C@@H](C)C2)cc1	728259518	FRSDPLOBTGKYPZ-ZNMIVQPWSA-N	431.580	1.709	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)[C@@H]1CCCN1c1ncnc2sccc12	728602574	HJPPNYOAPSLGEQ-AWEZNQCLSA-N	427.486	1.895	50	20	IDGD	
NS(=O)(=O)c1cccc(CNC(=O)NNC(=O)c2cc(F)ccc2Br)c1	728744863	GRFNHRMUVIYLIR-UHFFFAOYSA-N	445.270	1.380	50	20	IDGD	
O=C(Cn1cc([N+](=O)[O-])ccc1=O)NNC(=O)c1ccc(Br)cc1Cl	728827691	XUGSQJRFQIJNTK-UHFFFAOYSA-N	429.614	1.634	50	20	IDGD	
COc1ccc(CCC(=O)N2CCN(C(=O)NNC(=O)c3cccc(C#N)c3)CC2)cc1	728952998	JNGYCRQGPGOFNJ-UHFFFAOYSA-N	435.484	1.698	50	20	IDGD	
CCOc1cc2c(cc1[C@@H]1C[C@@H]1C(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1)O[C@H](C)C2	730535486	PSNRMEOCLZVWLJ-DSRCVFDASA-N	437.518	1.030	50	20	IDGD	
O=C(NN=Cc1sc(N2CCOCC2)nc1-c1ccccc1)[C@@H]1CCS(=O)(=O)C1	730576775	VZIWTYOXYKUAJF-OAHLLOKOSA-N	434.543	1.532	50	20	IDGD	
Cc1cc(C(=O)N2CCC[C@H]2C(=O)NNC(=O)COc2ccccc2O)ccc1[N+](=O)[O-]	730782586	PYWNIEKCHZWLRQ-INIZCTEOSA-N	442.428	1.440	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)[C@@H](c2ccccc2)N2CCCCC2=O)n1	731251947	NXUHHGDNPRNGNZ-HXUWFJFHSA-N	444.513	1.438	50	20	IDGD	
O=C(Cn1[nH]cc2c(=O)ncnc1-2)NNc1ccc(Br)cc1C(F)(F)F	731478527	LVADJZCNFHKELU-UHFFFAOYSA-N	431.172	1.996	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)c2sccc2S(=O)(=O)N(C)C)cc1	731958359	NYGNYFSVHHHACB-GFCCVEGCSA-N	441.531	1.626	50	20	IDGD	
CS(=O)(=O)Cc1nc2ccccc2n1CC(=O)NNc1nc(-c2cccnc2)no1	732110908	SOSPJFKOIQEXOD-UHFFFAOYSA-N	427.446	1.169	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)[C@H]2CCCN2c2ncnc3sccc23)C[C@@H](C)O1	732261538	DGNRVNFJLOUTCC-IIAWOOMASA-N	432.550	1.307	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@@H]2CC(c3cc(F)ccc3F)=NO2)c2ccccc2c1=O	732653738	GWHYQSOQMWDRAL-KRWDZBQOSA-N	441.394	1.649	50	20	IDGD	
O=C(NCc1ccc(C(=O)N2CCOCC2)cc1)NNC(=O)c1cnn(-c2ccccc2)c1	733338605	FQHWKIGEIPRWRA-UHFFFAOYSA-N	448.483	1.489	50	20	IDGD	
O=C(NNc1nccnc1Cl)[C@@H]1CCCN1S(=O)(=O)c1cccc([N+](=O)[O-])c1	734261539	KPUQYRCNOSYURS-LBPRGKRZSA-N	426.842	1.335	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(CNC(=O)NNc2cc(F)c(F)cc2F)cc1	734661886	QADRGSZRVXLXAY-UHFFFAOYSA-N	432.424	1.855	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(C(=O)NCC(=O)NNc2ccc(Cl)nn2)cc1	735688994	FWZKNSMSLLDESO-UHFFFAOYSA-N	440.913	1.034	50	20	IDGD	
Cc1ccc(O[C@@H](C)C(=O)N2CCN(CC(=O)NNC(=O)c3cccs3)CC2)c(C)c1	738333260	UEUAUEBRTDGLSB-KRWDZBQOSA-N	444.557	1.738	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)c2cc(C)c3c(O)nc(O)nc3n2)cc1OC	740748953	FGTCFEAMXQMORI-UHFFFAOYSA-N	427.417	1.617	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN(C(=O)COc2ccccc2)C1)[C@@H]1COc2ccccc2O1	741172010	GKEMDZXUNYRXDM-UZLBHIALSA-N	439.468	1.291	50	20	IDGD	
O=C(CCNS(=O)(=O)c1cccs1)NNC(=O)c1cccc(Br)c1	742771369	QKWZAGYCDYZPEM-UHFFFAOYSA-N	432.321	1.640	50	20	IDGD	
CN(C)c1nccc(NNC(=O)[C@H]2CCCN(C(=O)N3CCc4sccc4C3)C2)n1	743484987	VJQUSBMPCQBVDI-HNNXBMFYSA-N	429.550	1.938	50	20	IDGD	
CCOc1ccc(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)cc1OC	744621854	RNSKVJJKJQMOFG-UHFFFAOYSA-N	435.502	1.872	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)CC[S@@](=O)c2ccc3c(c2)OCCO3)c1	746093650	UPGHGPIMHNRPOZ-SSEXGKCCSA-N	432.498	1.799	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)[C@@]2(F)CCN(C(=O)OC(C)(C)C)C2)n1	748209970	OHFGWOKJCKHQCO-GOSISDBHSA-N	444.485	1.034	50	20	IDGD	
O=C(NNC(=O)[C@H]1CC12CCOCC2)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	748527038	AOPRRCRRYPAVCQ-LJQANCHMSA-N	432.484	1.966	50	20	IDGD	
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	749583570	MSMYRTSLDIJAJE-OXJNMPFZSA-N	434.504	1.517	50	20	IDGD	
N#C/C(=C/c1ccc(O)cc1)C(=O)OCC(=O)N(C1CCCC1)[C@@H]1CCS(=O)(=O)C1	750664860	YUMICCDLCQPXPH-MUMAZLPKSA-N	432.498	1.801	50	20	IDGD	
COC(=O)[C@H](NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1)c1cccc(C#N)c1	751446363	MOMFEGNFMGKPNV-LJQANCHMSA-N	430.486	1.022	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)c1cc(Cn2cc(Br)cn2)on1	751541308	VANFUNCHWABABY-UHFFFAOYSA-N	438.213	1.661	50	20	IDGD	
C[C@@H](NC(=S)NNC(=O)C1CCN(S(=O)(=O)c2ccc(F)c(F)c2)CC1)C1CC1	751621370	UUQXDJRPFMQEBL-LLVKDONJSA-N	446.545	1.659	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)c1cc(Cn2cc(Br)cn2)on1	752294769	CEZPMXSMVALFET-UHFFFAOYSA-N	434.250	1.781	50	20	IDGD	
Cc1nnnn1[C@H](Cc1ccc(F)cc1)C(=O)NNC(=S)NCCc1cccs1	753078841	QSQHYDYVYITYPU-MRXNPFEDSA-N	433.538	1.704	50	20	IDGD	
C[C@H](C[S@](C)=O)NC(=O)/C(C#N)=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	753152138	GSOLHWUWYUABSQ-BCWBPNSQSA-N	447.948	1.869	50	20	IDGD	
CCOC(=O)c1ccc(N2CC(NC(=O)NNC(=O)COc3ccccc3CC)C2)nc1	753281469	XZQPRALBLLBTPU-UHFFFAOYSA-N	441.488	1.419	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCOC[C@@H]2C[C@H](O)c2cccs2)cc1OC	753867205	JRWOLSXZFPTGNS-HOTGVXAUSA-N	449.529	1.351	50	20	IDGD	
COc1ccc(S(=O)(=O)NC2CC2)cc1NC(=O)NNC(=O)CCc1ccccc1O	755608983	CFMTUELROUWAEM-UHFFFAOYSA-N	448.501	1.627	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)NNC(=O)COc3ccccc3[N+](=O)[O-])cn2)C[C@H](C)O1	755864225	GSTVMHLJJGVCGM-KBPBESRZSA-N	444.448	1.835	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)NCCN2C(=O)[C@@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2=O)c1C	756097740	QZDCPUOMHYAGBU-WHEVEAIOSA-N	440.500	1.208	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)Nc1ccc(S(=O)(=O)NC2CC2)cc1	756777113	VACLDDDKVSBMNO-GFCCVEGCSA-N	436.465	1.887	50	20	IDGD	
COc1ccc(C(=O)NC2=S=C(C(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)C=C2)cc1	757528212	VYSWWRCKOYWSFT-UHFFFAOYSA-N	440.437	1.400	50	20	IDGD	
C[C@]1(NNC(=O)NCCCOc2ncc(C(F)(F)F)cc2Cl)CCS(=O)(=O)C1	757714592	ZJKVFXYHQXWXGN-AWEZNQCLSA-N	444.863	1.904	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)ccc1S(=O)(=O)N(C)C	757777795	ZEFPJYDNHXVEFE-UHFFFAOYSA-N	437.434	1.320	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)Nc2nccn(C)c2=O)c2ccccc2c1=O	757904989	CWMZLMYGQGQUCK-UHFFFAOYSA-N	425.449	1.147	50	20	IDGD	
COc1cc(C(=O)NCC(=O)NNc2nc(O)c3ccccc3n2)cc(OC)c1OC	758295819	JABWWDYMXVKZKN-UHFFFAOYSA-N	427.417	1.234	50	20	IDGD	
Cc1cc(Br)cn2cc(CCNC(=O)NN[C@@]3(C)CCS(=O)(=O)C3)nc12	758694096	BRRCGZKXCSWXRJ-INIZCTEOSA-N	444.355	1.329	50	20	IDGD	
CN(NC(=O)c1cnc(-c2ncccn2)s1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758785249	DAODVRBFVVDWHB-UHFFFAOYSA-N	447.521	1.849	50	20	IDGD	
CN(NC(=O)Cc1ccc(OCC#N)cc1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758787663	VBKXDRVEAKZGPP-UHFFFAOYSA-N	431.493	1.767	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCCOc2ccc(C(F)(F)F)cn2)c1	760836334	KDUGCFMMPLRIFR-UHFFFAOYSA-N	446.407	1.527	50	20	IDGD	
C[C@@H](NC(=O)OC(C)(C)C)[C@@H]1CN(CC(=O)NNC(=O)c2ccccc2Cl)CCO1	760977772	RKJUXBVMACGIEP-CJNGLKHVSA-N	440.928	1.715	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(OCC(F)F)nc2)c1	761196910	OEVFYXRLBSONFH-UHFFFAOYSA-N	428.417	1.051	50	20	IDGD	
C[C@H](CC(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	763305731	YJEZGDQTWFTGBH-RBSFLKMASA-N	446.570	1.177	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(-n2cnc3ccccc32)nc1	763445974	NLLIGOFUEOSBAG-UHFFFAOYSA-N	445.395	1.728	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2cccc(OC)c2)c1	763508356	GSUTWVORAHOQMQ-UHFFFAOYSA-N	448.501	1.125	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)Nc1ccc(F)cc1Br	763571258	KXGMOWJPBAJKBY-AWEZNQCLSA-N	438.209	1.514	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cc(C(=O)N(C)C)ccc2C)cc1C	763679517	KEEXNTWHAZFYRT-UHFFFAOYSA-N	426.473	1.479	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cncc(Br)c1	763679869	DSIDBWZTMTUMBH-UHFFFAOYSA-N	437.250	1.408	50	20	IDGD	
O=C(CC12CC3CC(CC(C3)C1)C2)NNC(=O)C(=O)Nc1ccc2c(c1)S(=O)(=O)CC2	763753458	WYAWZGOWWMQKDQ-UHFFFAOYSA-N	445.541	1.709	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2ccc(NC(=O)C3CC3)cc2)c1	763773105	VEBBAXVSNYQFLK-UHFFFAOYSA-N	426.429	1.452	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2nc3c(s2)COCC3)cc1	763862217	VWVQTFMFORENBU-NSHDSACASA-N	434.474	1.168	50	20	IDGD	
COc1cc(OC)c(OC)cc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccccc1F	763863846	DDTDGAXVFGVSRV-LLVKDONJSA-N	435.408	1.405	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1c(F)cccc1-n1cccn1	763865219	NTQBTDVPVAUUIL-GFCCVEGCSA-N	429.383	1.704	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cc(F)c(OC)cc2OC)cc1	763867590	XLWJNDYZOYHOLZ-GFCCVEGCSA-N	449.435	1.795	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)cc1OC	763911010	JOXAHUVZEMTAEU-UHFFFAOYSA-N	446.416	1.801	50	20	IDGD	
CC(C)CCn1ccc(NC(=O)C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)n1	763949797	RPRDUUYIQOTHBJ-UHFFFAOYSA-N	425.449	1.220	50	20	IDGD	
COC(=O)c1ccc(OCc2ccccc2)c(NC(=O)C(=O)NNC(=O)c2ccc[nH]2)c1	763980009	BAMFCNGLKLXEOF-UHFFFAOYSA-N	436.424	1.780	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)n(-c2ccccc2F)n1	763994872	ILDXYWZXJCWISO-UHFFFAOYSA-N	449.240	1.810	50	20	IDGD	
COC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1F	764003362	GOFRELRXVZDSSH-UHFFFAOYSA-N	432.364	1.175	50	20	IDGD	
O=C(NNC(=O)c1cnccn1)C(=O)Nc1ccc(Br)cc1Br	764033401	XPVOEZFRBICDBN-UHFFFAOYSA-N	443.055	1.401	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(C(F)(F)F)c2)cc1-n1cnnn1	764037451	KRWGEDVTCAYMSG-UHFFFAOYSA-N	449.349	1.089	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(CNC(=O)OC(C)C)cc2)c1O	764132151	LCRMLXKHZMBANW-UHFFFAOYSA-N	444.444	1.435	50	20	IDGD	
C=CCNC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(OC)cc2OC)cc1	764283536	BCERNTKGZIHQLD-UHFFFAOYSA-N	441.444	1.411	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C(=O)Nc1cccc(S(=O)(=O)NC)c1C)c1ccccc1	764330803	YHBWBHMOWHVIDY-HNNXBMFYSA-N	432.502	1.183	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)CNC(=O)c2cccnc2)ccc1OCc1cccnc1	764344661	HEMIMDVSBFELDU-UHFFFAOYSA-N	449.467	1.645	50	20	IDGD	
C[C@H](c1ccc(NC(=O)C(=O)NNC(=O)COCc2ccccc2)cc1)N1CCOCC1	764368353	VHPAXWXTDLSRHB-QGZVFWFLSA-N	440.500	1.383	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)CCC(=O)N2CCN(c3ccccn3)CC2)cc1	764549329	YACJOUXTDWNXFU-UHFFFAOYSA-N	425.489	1.045	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)cn1	765312957	MZEMZUFETGJSQF-UHFFFAOYSA-N	432.912	1.714	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)CSc2nnc(-c3ccncc3)n2Cc2ccco2)n[nH]1	765582620	DYHAXYHLJMRTIR-UHFFFAOYSA-N	438.473	1.566	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)[C@@H](C)Sc3nncn3C)n[nH]2)cc1OC	765596686	KCISMQVVSAUSRA-SNVBAGLBSA-N	431.478	1.164	50	20	IDGD	
CCOC(=O)N1CCC[C@H](C(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)C1	765753150	BFZWWNWCYCXGNY-FQEVSTJZSA-N	445.564	1.129	50	20	IDGD	
O=C(CC1CCCC1)NCC(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	765758425	MJZJBVMCRXMMJS-UHFFFAOYSA-N	449.983	1.302	50	20	IDGD	
CCC1(CC)[C@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)C[C@H]1OC	767162677	YHPKFUKOKNVUNI-HZPDHXFCSA-N	426.539	1.475	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)c1cc(COc2ccccc2F)on1	767249117	RVWFLJYOVHQPBD-UHFFFAOYSA-N	437.428	1.861	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)CO[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	767824463	OGCRECTYYMBTCS-OAHLLOKOSA-N	431.493	1.820	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc2c(c1)OCCCO2)NNc1ccc([N+](=O)[O-])cc1	768248186	DHYQOZPMBODRIO-UHFFFAOYSA-N	436.446	1.568	50	20	IDGD	
CCNC(=O)N(C)NC(=O)c1cc(C2CC2)nc2c1c(C)nn2[C@H]1CCS(=O)(=O)C1	768410186	QEJQFLRBPZDRAP-ZDUSSCGKSA-N	434.522	1.283	50	20	IDGD	
CCNS(=O)(=O)c1ccc(C)c(C(=O)NNc2c(OC)cccc2S(C)(=O)=O)c1	768641244	PMWZYRJKIXEKHU-UHFFFAOYSA-N	441.531	1.462	50	20	IDGD	
CNS(=O)(=O)c1ccc(C(=O)NNC(=O)Nc2cc(Cl)c(OC)cc2OC)cn1	770242163	RCSPJPITWFOTIY-UHFFFAOYSA-N	443.869	1.127	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)C3CCN(C(=O)OCc4ccccc4)CC3)nc21	770979853	MLODBQDWCKDUMM-UHFFFAOYSA-N	425.449	1.561	50	20	IDGD	
CCC(CC)n1nccc1C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	771044387	HIKKTDFYQRTVGC-UHFFFAOYSA-N	426.521	1.463	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)N[C@H]2CCO[C@]3(CCOC3)C2)nc1	771435341	QUYIYOHAUMRTQF-KBXCAEBGSA-N	427.527	1.076	50	20	IDGD	
COc1ccccc1[C@@]1(C)NC(=O)N(CC(=O)NNc2ccc(Br)nc2)C1=O	771582810	OHJYQVKFKDFUJS-GOSISDBHSA-N	448.277	1.763	50	20	IDGD	
O=C(CCN1C(=O)[C@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O)NNc1ccc(Br)c(F)c1	771682796	YTVSRVUJYNKRIV-UXOAXIEHSA-N	426.242	1.584	50	20	IDGD	
C[C@H](C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)c1ccccc1	771914365	QFYTWJBWYJZEGJ-KRWDZBQOSA-N	445.541	1.591	50	20	IDGD	
CCCCn1ncc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1C	772007470	ZDZBFDJOXWQNQS-UHFFFAOYSA-N	433.534	1.851	50	20	IDGD	
CCC(=O)N1CC[C@@H](C(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)C1	773049925	LAFMWGNVAVKTCG-QGZVFWFLSA-N	447.495	1.464	50	20	IDGD	
Cn1cc([C@@H](NC(=O)NNC(=O)CNC(=O)c2cccs2)c2ccc(F)cc2)cn1	773265830	JKSTZLASBYYDBY-KRWDZBQOSA-N	430.465	1.471	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)C(=O)Nc2cc(Br)cnc2-n2cccn2)n1	773481590	UQEDXRQVUQRPCM-UHFFFAOYSA-N	431.254	1.518	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cn(C)nc2C(F)(F)F)cc1OC	773532488	QIVPNJDANZLOLR-UHFFFAOYSA-N	443.382	1.636	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNc2ccc(C#N)cc2)cc(S(C)(=O)=O)c1	773700700	BSEBBFMNNLMOAG-UHFFFAOYSA-N	430.442	1.220	50	20	IDGD	
N#Cc1c(F)cccc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	777766380	JKDRZKFDTFCLBC-UHFFFAOYSA-N	430.461	1.947	50	20	IDGD	
O=C(N1CCN(S(=O)(=O)CBr)CC1)C1(c2ccc(F)cc2)CCOCC1	777836143	FUMJJYXGQNAALJ-UHFFFAOYSA-N	449.342	1.700	50	20	IDGD	
O=C(Cc1coc(-c2cccs2)n1)N1CCN(S(=O)(=O)CBr)CC1	777838874	XYJJSLJTBSTGQA-UHFFFAOYSA-N	434.337	1.772	50	20	IDGD	
CSCC[C@@H](NCC(=O)NNC(=O)Cc1nc(C)cs1)c1nnc2ccccn12	778107615	KWURRUDMSKWSDT-CYBMUJFWSA-N	433.563	1.268	50	20	IDGD	
O=C(COC(=O)c1ccc(Br)c(O)c1)NNC(=O)c1ccc([N+](=O)[O-])cc1	778829448	VXQONVIKSPHLLR-UHFFFAOYSA-N	438.190	1.681	50	20	IDGD	
COC(=O)c1ccccc1NNC(=O)CN1C(=O)N[C@@](C)(c2ccccc2OC)C1=O	780733685	XNFPDGVJBNLRTL-NRFANRHFSA-N	426.429	1.392	50	20	IDGD	
Cc1c(Cl)cccc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	780850484	HJEYWGUHYPKZOD-UHFFFAOYSA-N	437.905	1.744	50	20	IDGD	
Cc1ccc(CNC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])c(N2CCCC2)n1	781384842	GFOBQAGCUOKPPU-UHFFFAOYSA-N	428.449	1.808	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)Cc2cccc3ccccc23)c(OC)c1	782119881	AGZUMWOLNYNXSX-UHFFFAOYSA-N	435.436	1.964	50	20	IDGD	
Cc1c(/C=C(\C#N)C(=O)O[C@H](C(=O)N[C@@]2(C)CCS(=O)(=O)C2)C(C)C)cc(C#N)n1C	782628191	VUNIRPPFVOMRCZ-RHSYVANHSA-N	446.529	1.373	50	20	IDGD	
Cc1ccnc(-c2cccc(NC(=O)C(=O)NNC(=O)Cc3nc4ccccc4n3C)c2)n1	782895053	WYEJNUIVYZOUOB-UHFFFAOYSA-N	443.467	1.667	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)C(=O)Nc1cccc(Sc2ccccc2)c1	784005054	YENCJUJAXJWSLT-UHFFFAOYSA-N	438.465	1.947	50	20	IDGD	
CS(=O)(=O)CCOc1cccc(NC(=O)C(=O)NNc2ccc(OC(F)F)cc2)c1	784313338	KFIVQOJQFDMJAI-UHFFFAOYSA-N	443.428	1.793	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)cn1C	784835805	XBEXYEBHKDEMFN-UHFFFAOYSA-N	444.416	1.280	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N2CCCCC2)cc1NC(=O)C(=O)NNc1cccnn1	784858307	HTJQSNLRFNMAQI-UHFFFAOYSA-N	448.505	1.132	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)Cc2cc(-c3ccccc3)on2)cc1OC	785973745	BOCWHJWLKCLXBO-UHFFFAOYSA-N	439.424	1.906	50	20	IDGD	
COC[C@H](NC(=O)NNC(=O)c1csc(N2CCOCC2)n1)c1ccc(Cl)cc1	787378400	VNBLSGQECWSNFK-AWEZNQCLSA-N	439.925	1.965	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)Nc1ccc(S(=O)(=O)NCC2CC2)cc1	788006021	DPLWHVSKQJFLSN-UHFFFAOYSA-N	428.511	1.317	50	20	IDGD	
C[C@]1(NNC(=O)N[C@@H]2CCCN(c3ccc(Cl)cc3Cl)C2=O)CCS(=O)(=O)C1	788916920	RVVAMMYYPXUCMJ-DYVFJYSZSA-N	449.360	1.870	50	20	IDGD	
CN(C)[C@@H]1CCOc2c(NC(=O)C(=O)NNC(=O)Cc3c[nH]c4ccccc34)cccc21	789741503	WRTVOAGWPKZUGV-LJQANCHMSA-N	435.484	1.882	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)NCc1nc(-c2cccc(Br)c2)no1	790510539	RXDNKRIRXJEIBP-UHFFFAOYSA-N	431.250	1.967	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNc2cccc(F)c2[N+](=O)[O-])c(OC)c(OC)c1	790993864	LFKNYLNTEGPXOM-UHFFFAOYSA-N	436.352	1.620	50	20	IDGD	
COc1c(NC(=O)C(=O)NNC(=O)Cc2ccc(Cl)cc2)cc(Cl)cc1C(N)=O	793021900	NWRSHXDJFLRZMI-UHFFFAOYSA-N	439.255	1.430	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)N1CCC[C@@H](C=NNC(=O)c2cc([N+](=O)[O-])ccc2O)C1	794517002	YSTDSGXTZBCNFU-ZDUSSCGKSA-N	449.464	1.779	50	20	IDGD	
Cc1ccc2c(c1)C(=O)N([C@@H](C)C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1)C2=O	794711637	OQHBZSGKZQRWGQ-ZDUSSCGKSA-N	430.486	1.373	50	20	IDGD	
CC(=O)N1CCCC[C@@H]1C(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	794961467	UBAZAKRIRICVTH-HXUWFJFHSA-N	447.499	1.550	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)c1cc(S(N)(=O)=O)ccc1F	798335461	NRMNBAYDHDQOFE-UHFFFAOYSA-N	444.510	1.307	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)[C@@H](OC)c2cnn(C)c2)c2ccccc2c1=O	798830398	QWSKLQSBBQXHEQ-SFHVURJKSA-N	426.477	1.469	50	20	IDGD	
O=C(NC[C@H](O)c1cccc(Br)c1)NNC(=O)c1ccc(-n2cnnn2)cc1	799856524	APJNALYXSXMXRC-HNNXBMFYSA-N	446.265	1.102	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCCC(=O)OC2CCCCC2)nc1	802452934	CHRXOZNPXHSLKC-UHFFFAOYSA-N	427.527	1.660	50	20	IDGD	
C#Cc1cc(F)c(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3OC)[nH]n2)c(F)c1	802566744	APYUYRTXOFDMFM-UHFFFAOYSA-N	439.378	1.745	50	20	IDGD	
Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCC(C(=O)NNc2ncccc2F)CC1	804215590	XESVGAZSUFHEQW-UHFFFAOYSA-N	437.453	1.981	50	20	IDGD	
O=C(COC(=O)[C@@H]1C[C@H](c2ccccc2)OC1=O)NNC(=O)c1cccc([N+](=O)[O-])c1	808588137	HYBSFMZRHPRYSL-JKSUJKDBSA-N	427.369	1.203	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1	810375148	SGTIEFKOJKWKRZ-UHFFFAOYSA-N	447.391	1.333	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3c[nH]nc3-c3ccccn3)n[nH]2)cc1OC	810583861	GZKWDIVPDNKYTH-UHFFFAOYSA-N	433.428	1.954	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@@H]2CCC[C@H]3CN(C(C)=O)C[C@@H]32)c2ccccc2c1=O	812435072	YCMQBPAPYUDAQK-JCGIZDLHSA-N	440.504	1.007	50	20	IDGD	
COC[C@@]1(CNC(=O)NNC(=O)COc2ccc(OC)cc2)OCCc2ccccc21	812478645	ZPAXQUKNPUELFM-JOCHJYFZSA-N	429.473	1.519	50	20	IDGD	
Cc1cc(=O)c(C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)nn1-c1ccccc1F	812728878	CNHGICVNROHPRJ-UHFFFAOYSA-N	445.476	1.687	50	20	IDGD	
COC(=O)c1cn(-c2cccc(NC(=O)C(=O)NNc3ncccc3C(F)(F)F)c2)nn1	812983549	WILXBLJZCMIDQS-UHFFFAOYSA-N	449.349	1.550	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)cc1C(=O)N(C)C	813033764	KJFUPWVNIQLXPJ-UHFFFAOYSA-N	447.517	1.029	50	20	IDGD	
COC[C@@]1(C(=O)NNC(=O)NCCc2cccs2)CCN(C(=O)OC(C)(C)C)C1	813424650	SBISSAKHKOMIBV-LJQANCHMSA-N	426.539	1.895	50	20	IDGD	
O=C(CNC(=O)NNC(=O)c1cccc(Br)c1)NCCN1CCCCCC1	814307180	XFBFDPIBIRXOGY-UHFFFAOYSA-N	440.342	1.385	50	20	IDGD	
Cc1cc(OCc2ccc(C(=O)NNC(=O)CCn3ncn(C)c3=O)cc2)ccc1Cl	814716252	FKNOYVKJSHYPEN-UHFFFAOYSA-N	443.891	1.974	50	20	IDGD	
COc1cc(C(C)=NNC(=O)N[C@H]2CCS(=O)(=O)C2)ccc1OCCCC(=O)O	814815687	GNNJKIRCSYGOBN-AWEZNQCLSA-N	427.479	1.149	50	20	IDGD	
O=C(COC(=O)C1CCC(OC[C@H]2CCCO2)CC1)NNC(=O)c1cccc([N+](=O)[O-])c1	815346279	DEOWZGASRJHRLU-IUPXNIOVSA-N	449.460	1.653	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2coc(Sc3ncccn3)n2)c2ccccc2c1=O	816806158	UGKYTCMTUMWSHU-UHFFFAOYSA-N	437.441	1.420	50	20	IDGD	
Cc1c(NC(=O)[C@@H](C)SCC(=O)NNC(=O)CC2CC2)c(=O)n(-c2ccccc2)n1C	819115004	ZASHOVSONMPIBO-CQSZACIVSA-N	445.545	1.492	50	20	IDGD	
O=C(CC1CC1)NNC(=O)c1cc(Br)c(C(=O)NNC(=O)CC2CC2)o1	819131547	IEXXVMDMPXSLHI-UHFFFAOYSA-N	427.255	1.164	50	20	IDGD	
CCc1ccccc1OCC(=O)NN=Cc1c(N2CCOCC2)nc2ccccn2c1=O	864238329	ILJJHXFNHKEFLL-UHFFFAOYSA-N	435.484	1.623	50	20	IDGD	
O=C(Cc1ccc(S(=O)(=O)N2CCCCC2)cc1)NNC(=O)c1cccc([N+](=O)[O-])c1	866673999	OSCMHDZGVAALAO-UHFFFAOYSA-N	446.485	1.773	50	20	IDGD	
CC(C)(C)C(=O)NCCC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	871045664	NBMPHCXYTVEYGH-UHFFFAOYSA-N	438.550	1.175	50	20	IDGD	
O=C(CCSc1ccc(F)cc1)NNC(=O)CNS(=O)(=O)c1ccccc1F	913035254	MREFGHPXRMEIES-UHFFFAOYSA-N	429.470	1.573	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@@H](C(=O)NNC(=O)COc3ccccc3O)C2)cc1	913484493	JOOVYPUIKPAKPD-MRXNPFEDSA-N	447.513	1.328	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)[C@@H]1CS[C@@H](Cc2ccccc2F)C(=O)N1	914879962	CQFKEHWCCNTUEU-YJBOKZPZSA-N	447.488	1.203	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)CN(C)S(=O)(=O)c2cccnc2)c1	915131018	CTQWJWIGUSNFTR-UHFFFAOYSA-N	434.518	1.360	50	20	IDGD	
CC1CCN(C[C@@H](C)C(=O)NNC(=S)Nc2cccc(S(=O)(=O)N(C)C)c2)CC1	916117642	FYCQRABJYSRNBV-OAHLLOKOSA-N	441.623	1.623	50	20	IDGD	
Cc1cc(C)n(CC(=O)NN=Cc2ccc(C=NNC(=O)Cn3nc(C)cc3C)cc2)n1	916343221	QXBUILMJHWTIEZ-UHFFFAOYSA-N	434.504	1.614	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)NCCC(=O)N1CCN(C)CC1	916433505	YPSVHQUQGKSPDJ-MRXNPFEDSA-N	427.505	1.102	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)N[C@H](c1ccc(F)cc1)[C@H]1CCCO1	918126138	HCOLGWYNWVJRRZ-IAGOWNOFSA-N	449.508	1.983	50	20	IDGD	
CCCS(=O)(=O)N1CCCC[C@@H]1C(=O)NNC(=O)[C@H](C)Oc1ccc(OCC)cc1	918549400	KBSWFPLQQNKYQC-MAUKXSAKSA-N	441.550	1.594	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(-c3cnco3)cc2)cc1OC	919501928	ZSURSQQNJNCTPF-UHFFFAOYSA-N	425.397	1.977	50	20	IDGD	
Cn1cnnc1SCC(=O)Nc1cccc(C(=O)NNC(=O)NCc2ccco2)c1	920857866	UPIBWEPQNAAPFH-UHFFFAOYSA-N	429.462	1.283	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Nc2ccccc2N2CCN(C)CC2)cc(OC)c1OC	920929530	STPZNODXRHCYNP-UHFFFAOYSA-N	443.504	1.931	50	20	IDGD	
Cc1ccc(Cc2cnc(NC(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)s2)cc1F	920932700	FEBBPZYSYRWYGJ-LBPRGKRZSA-N	426.495	1.769	50	20	IDGD	
CC(C)[C@@H](C(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12)N1C[C@@H](C)O[C@H](C)C1	921201320	MNDPLKPHCAZFGB-QINHECLXSA-N	443.548	1.872	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)c2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1OC	1317952329	AQGUSHZJYWNCQL-QGZVFWFLSA-N	440.500	1.870	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)CCN3Cc4ccccc4C3=O)C2)C1	1778184083	XRADAGYEBVFMFZ-PGRDOPGGSA-N	433.936	1.880	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4c(c3)CNC4=O)C2)C1	1778729050	NLUBAKJLVKTNDB-BUXKBTBVSA-N	436.306	1.157	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@]2(C1)CN(C(=O)Cn1nnc3ccccc31)CCO2	1779294073	LAUWWQKXIMXQNF-FQEVSTJZSA-N	431.569	1.113	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3c[nH]c4ccc(OC)nc34)C2)C1	1780045789	FRTCIXPLIKTZNV-VLIAUNLRSA-N	436.896	1.269	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)nc(O)c1)C2)[C@H](F)Br	1780773227	HIFKAYYLRWBLJJ-HYSWKAIVSA-N	446.273	1.311	50	20	IDGD	
Cc1ncncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Br)C1	1780773343	ANABLCJJYJVJEU-JKIFEVAISA-N	429.290	1.603	50	20	IDGD	
Cc1nccn1CC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Br)C1	1780777391	ZOBJEYJPQIBNKN-FRFSOERESA-N	431.306	1.396	50	20	IDGD	
CCCc1ccc(C(=O)N2CC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)cc1	1780844803	QJEPUEOVPRKZMB-DEOSSOPVSA-N	436.317	1.076	50	20	IDGD	
Cc1cnc2c(C(=O)N3CCO[C@@]4(CCN(C(=O)[C@@H](F)Br)C4)C3)cnn2c1	1781331178	FZGICEINNUKRJH-CXAGYDPISA-N	440.273	1.172	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccnn1C)C2	1781900808	SQCOSBATMFVHBO-DDUZABMNSA-N	427.343	1.721	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3n[nH]c4ccc(C#N)cc34)C2)C1	1782198882	XRGAUIGRVAEHNJ-CWTRNNRKSA-N	446.305	1.661	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCCn2ccnc2)C1	1782484903	DWMRKLOHPJXNTE-MBOZVWFJSA-N	426.945	1.431	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)CSc3ccncc3)CCO2)C1	1783529538	LPMGLEVVIFQMLZ-SUMWQHHRSA-N	428.352	1.787	50	20	IDGD	
COc1ccc(F)cc1CC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1784084119	GPOCRINEBCFGCW-WMZOPIPTSA-N	447.276	1.897	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C3(c4cccc(Cl)c4)CC3)C[C@@H]21)[C@H](O)CCl	1784093629	ZKFVSYQYSWQRLK-RUGDWHBFSA-N	441.355	1.951	50	20	IDGD	
O=C([C@H](O)CCl)N1CCO[C@@]2(CCN(C(=O)[C@@H]3CCCN3Cc3ccccc3)C2)C1	1784239054	PBVGIMSELLVQPM-NNMXDRDESA-N	435.952	1.081	50	20	IDGD	
O=C(NC1(c2ccc(NC(=O)[C@H](O)CCl)cc2)CCC1)c1cc2n(n1)CCCNC2=O	1786134477	JJGPBBCYAUJQKN-QGZVFWFLSA-N	445.907	1.364	50	20	IDGD	
Cc1cc(CC(=O)Nc2ccc(C3(NC(=O)c4cccc(B(O)O)c4)CCC3)cc2)nn1C	1786220237	HVUJGVRJCKAWEZ-UHFFFAOYSA-N	446.316	1.399	50	20	IDGD	
Cc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)CBr)C[C@@H]32)cn1C	1787672748	YWZRGWPEZFTYMH-QCPWZWHMSA-N	426.355	1.958	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3nn(C)c4c3CCC4)[C@H]2C1	1788023127	DKUOFLHXZQSAHZ-DSPQJCBJSA-N	439.354	1.286	50	20	IDGD	
Cc1nccn1CC(=O)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1	1788143478	HSEZPBQNHVNLOR-UHFFFAOYSA-N	432.289	1.319	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc4c3NC(=O)C4=O)[C@H]2C1	1788434580	ZRSOYGDYGJYDBH-STECZYCISA-N	447.919	1.822	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3cc(C)[nH]n3)[C@H]2C1	1788693390	NMQMYLWARYCTEC-TUUVXOQKSA-N	427.343	1.414	50	20	IDGD	
Cc1cc(CC(=O)Nc2ccc(C3(NC(=O)c4ccc(B(O)O)cc4)CCC3)cc2)n[nH]1	1789586133	KVFLMFCNXMNWEZ-UHFFFAOYSA-N	432.289	1.388	50	20	IDGD	
COc1cccc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]3C2)n1	1789922789	SPGIFBKGCYWTCT-PLNCSYRRSA-N	444.301	1.303	50	20	IDGD	
CN(CC(=O)Nc1ccc(C2(NC(=O)CN)CCC2)cc1)NC(=O)NCc1ccccc1	1790380961	UCROBDLEQZNJRX-UHFFFAOYSA-N	438.532	1.425	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc(C)nc3)C[C@@H]21	1790961645	SSCBWFARBZNPAB-TUUVXOQKSA-N	425.327	1.552	50	20	IDGD	
COC(=O)[C@@H]1CC[C@H](C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]3C2)C1	1791055196	NMZRHUMLJXYEAQ-IBPCWRJOSA-N	445.354	1.339	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)Nc3nccs3)C[C@@H]21	1791057051	AGCOXJXENLCBMP-DGTMBMJNSA-N	445.383	1.707	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cn3cc(Cl)cn3)C[C@@H]21	1791058306	VXKOKFOWCOQJTM-XWUBHJNHSA-N	433.734	1.300	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)Nc3nccs3)C[C@@H]21	1791254415	MIGLSYVHDPIUCI-QTVXIADOSA-N	430.958	1.177	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cccc([N+](=O)[O-])c3)C[C@@H]21)C(Cl)Cl	1791292330	NYSJUWHPVXJKON-QEJZJMRPSA-N	430.288	1.921	50	20	IDGD	
CSCC[C@H](O)C(=O)NC1(c2ccc(NC(=O)CCC(=O)NN(C)C)cc2)CCC1	1791602564	OFGNSOSPSUDVFJ-KRWDZBQOSA-N	436.578	1.608	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21	1792148279	ABQDUOPGQRWKIU-DZKIICNBSA-N	426.300	1.720	50	20	IDGD	
CC(C)c1nc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)CBr)no1	1792868728	NDTYGJJMQLYQTM-JFILPPLUSA-N	443.342	1.356	50	20	IDGD	
C[C@@H](Nc1nccs1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCBr	1795112876	REVNQCDEIAIZIZ-NRWUCQMLSA-N	431.356	1.318	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1nnc(C)s1	1795822747	MIGYPRKCSKVMHR-NWJSVONSSA-N	431.356	1.152	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1nccc2[nH]ccc12	1796654630	KBLFNWKYLIKTNJ-CWNKPHDYSA-N	447.499	1.949	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1c[nH]c2ccc(OC)nc12	1798485895	OIMMKYGCFOJYSK-DMVWFOPNSA-N	436.896	1.029	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(O)cc1F	1799568706	WQJRZVKJBIXYRJ-VAECKANCSA-N	429.286	1.908	50	20	IDGD	
CN(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CC1CC1)C2)NC(=O)NCc1ccccc1	1799865011	XOYFWMGLQKJFQV-ACDBMABISA-N	427.549	1.771	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2	1800950292	HSJHKMAMMSXTHY-JRBZFYFNSA-N	443.338	1.116	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1c[nH]c3cc(OC)ccc13)C2	1800971449	ZFUSAKHPXBSVDY-POXQLVPFSA-N	449.935	1.562	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc3c1CCCC3)C2	1801012137	HPEMVMPZFQCYBH-FEJSZKPUSA-N	442.560	1.142	50	20	IDGD	
CC(C)(CCl)C(=O)NC[C@H]1CCN(C(=O)c2cnc(O)nc2O)[C@@H]1c1cccnc1	1802899515	QLKKWPSUXCIYDZ-UKRRQHHQSA-N	433.896	1.867	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2cccs2)[C@@H]1c1cccnc1	1805391591	DKBSFFREFNUAET-JXFKEZNVSA-N	429.546	1.836	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)CCN2CCN(C)CC2)[C@H]1c1cccnc1	1808260581	WZSOBWBFOIRKNN-ZJOUEHCJSA-N	436.000	1.742	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)c1cnc2ncccn12	1809332729	QODVONMSUSBTJM-BHYGNILZSA-N	428.880	1.044	50	20	IDGD	
CC[C@@H](C)[C@H](N)C(=O)N1CCCC2(CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CC2)C1	1809706887	GWDPDUBRGMLZRL-GNRVPKTPSA-N	444.580	1.725	50	20	IDGD	
Cc1cc(C)nc(C(=O)N2CCCC3(CCN(C(=O)CCC(=O)NN(C)C)CC3)C2)c1	1810327303	HGMOSJMNBPXUCL-UHFFFAOYSA-N	429.565	1.916	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@H]1CCN(C(=O)CCc2nc(N)n[nH]2)[C@@H]1c1cccnc1	1810545897	HDHQNXGWNWOJPC-DNVCBOLYSA-N	445.600	1.272	50	20	IDGD	
O=C1Cc2cccc(C(=O)NC[C@@H]3CCN(C(=O)[C@H](O)CCl)[C@@H]3c3cccnc3)c2N1	1812207979	LZUYKQMSYPITBG-XAUMDUMWSA-N	442.903	1.496	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)CCc2ccc(O)nn2)[C@@H]1c1cccnc1	1812328322	MWFMVFYHMNRTDS-KNBMTAEXSA-N	447.923	1.470	50	20	IDGD	
O=C(COc1ccc(F)cc1)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](O)CCl)CC2	1813717712	ZLQCAAUYGMAKMI-BXUZGUMPSA-N	427.885	1.873	50	20	IDGD	
Cc1ccc(CC(=O)N[C@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)o1	1815361398	DHOMGGVOAPIWCE-HNNXBMFYSA-N	439.302	1.193	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCCC[C@H]1c1cc(NC(=O)CCN2CCOCC2)n[nH]1	1817179913	OQTVPGWRIXQFJJ-KRWDZBQOSA-N	437.617	1.976	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](N)CCC(N)=O)n[nH]1	1817248836	FFJATBQHYRAIJO-GSDQYQHOSA-N	433.340	1.231	50	20	IDGD	
COc1ncccc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1	1817473041	APFNCRPZIAWHMR-SFHVURJKSA-N	449.276	1.113	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)CN3CCN(C(C)=O)CC3)sc2C1	1818896878	KYAWXRKVLRCKAC-UONOGXRCSA-N	441.985	1.237	50	20	IDGD	
Cn1cc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@H](O)CCl)CC3)c2cccnc21	1819428294	OSIMXEWKNXKWIQ-QMTHXVAHSA-N	433.921	1.855	50	20	IDGD	
C[Si](C)(C)OCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1nccnc1C(N)=O)CC2	1820167185	XWFBHDASNBFDBC-JTQLQIEISA-N	448.581	1.109	50	20	IDGD	
C[C@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)c3cc(CO)on3)sc2C1	1821706435	XUIYMGHKQSTCHW-YUMQZZPRSA-N	429.296	1.633	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)[C@H]1[C@H]2SC=C[C@H]21	1821706748	GQEBPYQSTZFQLC-WQCNXYOZSA-N	438.318	1.271	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2)c1ccc(F)cc1	1822177213	BSMWJXBJCUGMDD-INIZCTEOSA-N	439.277	1.502	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCc2ncc[nH]2)[nH]n1	1822416852	RKOCOVAZWBXBFP-HNNXBMFYSA-N	430.513	1.131	50	20	IDGD	
C#CCCCCC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1822581907	TXNJFQDWWQIQLA-GOSISDBHSA-N	437.504	1.908	50	20	IDGD	
O=C1NCc2cc(C(=O)N3CCC([C@@H]4CCCCN4C(=O)[C@@H](O)CCl)CC3)ccc21	1824186300	MRCSYLQCYBPZPN-OALUTQOASA-N	433.936	1.763	50	20	IDGD	
CC(C)O[C@H](C)C(=O)N[C@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1	1826088076	RDWZUKFUMRSUEB-OLZOCXBDSA-N	425.555	1.242	50	20	IDGD	
O=C(CNC(=O)C(F)(F)F)Nc1nc2c(s1)C[C@H](NC(=O)C(Cl)Cl)CC2	1826146353	QMSODERTCYIJSM-RXMQYKEDSA-N	433.239	1.537	50	20	IDGD	
CCOC(=O)/C=C/C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1	1826329032	AUTYXFATGLWRBR-DOJUMQAQSA-N	436.553	1.098	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC([C@H]2CCCCN2C(=O)CN2CCOCC2)CC1	1826717722	HWNBOCSFNOQSMO-NVXWUHKLSA-N	430.387	1.722	50	20	IDGD	
C[C@H]1CC[C@H](C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2ccc(B(O)O)cc2)CC3)CC1	1827153315	KMUQKWYEGGMKAT-ZQIUZPCESA-N	441.362	1.875	50	20	IDGD	
Cc1nc[nH]c1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1	1827837785	XUAFANOYBGHMSQ-GOSISDBHSA-N	439.520	1.264	50	20	IDGD	
COCc1oncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1	1827918981	JQMJALNVECXWIU-SFHVURJKSA-N	449.552	1.427	50	20	IDGD	
O=C(N[C@H]1CCc2nc(NC(=O)[C@@H]3CCCSC3)sc2C1)c1ccc(B(O)O)cc1	1828153886	ZZZYRDYEHDXSME-HIFRSBDPSA-N	445.375	1.192	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC([C@@H]2CCCCN2C(=O)C2=NNC(=O)C2)CC1	1828858426	GLESMMOXQBWFTR-DOMZBBRYSA-N	427.343	1.513	50	20	IDGD	
C[C@H](O)C(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)[C@@H](F)Cl)C2)C1	1829325275	GJJYIDXZMJJEKF-NBQZKYEYSA-N	441.887	1.354	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CN2CCNC2=N)CC1	1830316009	FTTAANHGLQJWSG-HNAYVOBHSA-N	432.396	1.682	50	20	IDGD	
CN(C)c1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)cn1	1830364691	PULOCDXWJKSZAO-NRFANRHFSA-N	438.956	1.483	50	20	IDGD	
CN1CCC[C@H]1C(=O)NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1	1833621239	NSBOIHLVXUCCML-KRWDZBQOSA-N	429.403	1.437	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)Cc3cncnc3)CC2)CC1	1833862489	FJBAIMPBYMREFJ-AWEZNQCLSA-N	438.370	1.374	50	20	IDGD	
Cc1cccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)n1	1834050524	DMWKJCIFJPWHMC-RBUKOAKNSA-N	430.332	1.696	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cnc(N(C)C)o3)CC2)CC1	1834096441	UKRCMIBXCYOENS-INIZCTEOSA-N	425.961	1.943	50	20	IDGD	
CCc1oncc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)Br)C2)C1	1834522117	FPGIPCVZHREZSP-PXAZEXFGSA-N	430.299	1.090	50	20	IDGD	
Cc1c(F)ccc(C(=O)NC2CCN(C3CCN(C(=O)[C@H](O)CCl)CC3)CC2)c1N	1834776187	ORUUDPVCPFXQFP-GOSISDBHSA-N	440.947	1.501	50	20	IDGD	
CO[C@@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1)c1ccccc1	1834928220	QDZDNDZVRYHMND-BEFAXECRSA-N	431.316	1.634	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)c3cnn(C)c3)CC2)CC1	1837469603	WPVDVVRJBZZHAX-ZDUSSCGKSA-N	427.343	1.816	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)CN3CCCCC3)CC2)CC1	1837801318	UVVKUVLFPZPXEU-LJQANCHMSA-N	429.989	1.725	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(Cl)ccn3)CCO2)C1	1837867371	OSIOPQMYRKHZMC-KSSFIOAISA-N	432.304	1.059	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(F)n3)CCO2)C1	1837902401	WXAIKBTWFJYSNF-SCLBCKFNSA-N	444.301	1.322	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)Cc3nnc(C)s3)CC2)CC1	1837953272	XLQFSANMYQMZCO-INIZCTEOSA-N	444.985	1.641	50	20	IDGD	
CCc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)no1	1838129339	PYIKDYJJRCSZGS-SJKOYZFVSA-N	430.299	1.090	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3[nH]cc4c3CCC4)CCO2)C1	1838456571	JBQLNTIBVBEVPB-YJYMSZOUSA-N	440.338	1.357	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3cccc(C#N)c3)C2)C1	1839141934	YJZHDYHNJGFJSQ-SIKLNZKXSA-N	433.936	1.965	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccnc3SC)C2)C1	1839146878	ZHALLTDTGJDARC-HNAYVOBHSA-N	427.954	1.891	50	20	IDGD	
CCc1noc(C)c1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839200894	RSYISEHBFIUHPU-PBHICJAKSA-N	448.289	1.306	50	20	IDGD	
O=C(/C=C/C1CCCC1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839202017	QQBBAMACIFCUMG-WXFDERKXSA-N	433.318	1.880	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(C)cc3F)CCO2)C1	1839260929	LKKKGQPMLGFTET-OXJNMPFZSA-N	428.888	1.458	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)CCBr)C3)C2)cc1O	1839265827	QVLZCRVJNFGRTI-IBGZPJMESA-N	441.322	1.556	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(O)c(F)c3)CCO2)C1	1839305645	UTMRVZCPZYBCKT-OALUTQOASA-N	449.306	1.838	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)c1ccc(C)cc1)CCO2	1839949038	OKYCXEASKXHZPR-LZNRXBQRSA-N	438.952	1.809	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CC3CCOCC3)C2)C1	1840032124	OEBFYLOEAYEMCH-RDTXWAMCSA-N	433.343	1.043	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)c3ccccn3)C2)C1	1840036006	CFNMOLGHPWEXGU-YZVOILCLSA-N	440.338	1.425	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3nc4ccccc4o3)C2)C1	1840154602	ADGXRVXLSAKDLM-XOBRGWDASA-N	437.880	1.152	50	20	IDGD	
CN(C)c1cccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)c1	1840188962	OCZPWACGJAIPPD-LJQANCHMSA-N	430.332	1.626	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)n1cccn1)CCO2	1840444087	CQQAPNUDICVFAV-RVKKMQEKSA-N	443.342	1.074	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H]2C[C@]21C(=O)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1	1841353948	ZIDRASVRBULKRJ-ARGWCVDVSA-N	427.929	1.189	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCCC12CN(C(=O)/C=C/c1cnccn1)C2	1841925538	HSLORKLBRDYGBD-JFDDCEBESA-N	449.939	1.825	50	20	IDGD	
COCC1(C(=O)N2CC3(CCCN3C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)CC1	1844691973	TZCMRWOJOCODSS-UHFFFAOYSA-N	431.445	1.764	50	20	IDGD	
CN(CC(=O)N1CCCC12CN(C(=O)c1cncs1)C2)NC(=O)NCc1ccccc1	1845038452	DAULBCCVWHKRQL-UHFFFAOYSA-N	442.545	1.306	50	20	IDGD	
Cc1cc(C(=O)N2CC3(CCCN3C(=O)CN(C)NC(=O)NCc3ccccc3)C2)no1	1845038527	OGCHJVHITUVRPD-UHFFFAOYSA-N	440.504	1.146	50	20	IDGD	
Cc1cc(C(=O)N2CC3(CCCN3C(=O)CN(C)NC(=O)NCc3ccccc3)C2)on1	1845038532	PADCXNVPUUYCTM-UHFFFAOYSA-N	440.504	1.146	50	20	IDGD	
CN[C@@H](CC(=O)N1CC2(CCCN2C(=O)/C(C#N)=C/c2ccc(F)cc2F)C1)C(=O)O	1845870830	GTDAVEWDDLTOMJ-VRXKTSEUSA-N	432.427	1.138	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@](F)(C(=O)N2CCCC23CN(C(=O)[C@@H](O)CCl)C3)C1	1846124182	WBEYGWMDUBNONI-XOBRGWDASA-N	447.935	1.529	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)c1ccc(-c3ccccc3)nc1)C2	1846385385	YWKBKDLZDUZODB-UHFFFAOYSA-N	435.528	1.939	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](O)CCl)[C@H](F)C1	1847556282	GWIUQTOZCBVKIW-RBGFHDKUSA-N	447.935	1.383	50	20	IDGD	
CCc1c(Br)c(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](O)CCl)nn1C	1847558524	BDKDCEALVJESAM-SRVKXCTJSA-N	433.734	1.160	50	20	IDGD	
CON(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)c1	20909596	IWKUQCKPEBSCAJ-GFCCVEGCSA-N	425.438	1.236	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CN2CCN(Cc3nc(N)c4ccccc4n3)CC2)cc1	22817515	KIDHNJZKAHDKSI-UHFFFAOYSA-N	433.516	1.099	50	20	IDGD	
Cc1cc(OCC(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)no1	24399760	RQCCATBVHOXPDE-UHFFFAOYSA-N	436.471	1.685	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2cccnc2OCC(F)(F)F)c2ccccc2c1=O	24481547	TYSRGHYUQXZARG-UHFFFAOYSA-N	435.362	1.827	50	20	IDGD	
CN1C(=C(C#N)C(=O)COC(=O)CN2C(=O)NC3(CCCC3)C2=O)N(C)c2ccccc21	25406072	XYTVOVGBSYTFAR-UHFFFAOYSA-N	437.456	1.285	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)CSc1ccc(C(N)=O)cc1[N+](=O)[O-]	27266178	WRQCCDOWYXFDFR-UHFFFAOYSA-N	438.849	1.909	50	20	IDGD	
Cc1cccc(NC(=S)NNC(=O)CN2C(=O)N[C@](C)(c3ccc(F)cc3)C2=O)c1	28660252	HLMCYMNPNWASRW-HXUWFJFHSA-N	429.477	1.919	50	20	IDGD	
Cc1ccc(NC(=O)C2CCN(C(=O)NNC(=O)CNC(=O)c3cccs3)CC2)nc1	725873751	QRCOBCCZLJVKDC-UHFFFAOYSA-N	444.517	1.273	50	20	IDGD	
COC(=O)c1cn(CC(=O)NNC(=O)c2csc(N3CCOCC3)n2)c2ccccc12	726088549	IMZVIASRDIUHGB-UHFFFAOYSA-N	443.485	1.182	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)CCOc2ccc(S(N)(=O)=O)cc2)c1C	726382129	NANDFIJAXOMZBJ-HNNXBMFYSA-N	435.502	1.335	50	20	IDGD	
CCn1cc(Br)cc1C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	726767347	QPNONVQGBMVRDI-UHFFFAOYSA-N	449.714	1.646	50	20	IDGD	
CCCn1nc(C(=O)NNS(=O)(=O)c2cccc(COC)c2)c2ccccc2c1=O	727349888	BBDVDLODBOEXSM-UHFFFAOYSA-N	430.486	1.576	50	20	IDGD	
O=C(NNC(=S)NCC1CCC1)C1CCN(S(=O)(=O)c2ccccc2F)CC1	727866401	GKFJBMHNBCMLRB-UHFFFAOYSA-N	428.555	1.522	50	20	IDGD	
COC(=O)c1csc(S(=O)(=O)NNC(=O)c2cc(OC)ccc2Br)c1	728508550	RUYVYCQXZLYPTF-UHFFFAOYSA-N	449.304	1.929	50	20	IDGD	
CSCC[C@H](C(=O)NNC(=O)c1cccc(C#N)c1)N1C(=O)[C@H]2CCCC[C@@H]2C1=O	728828191	KMWGUUSYVSPLCK-YESZJQIVSA-N	428.514	1.616	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)NC[C@@H](c1ccc(F)cc1)N1CCOCC1	730820156	GJEVFKZRLCQRDR-KRWDZBQOSA-N	432.452	1.314	50	20	IDGD	
CCCn1c(=O)n(CCC(=O)NNC(=O)CCN2C[C@H](C)O[C@H](C)C2)c2ccccc21	732259556	HHSYPPPUUYUERE-CALCHBBNSA-N	431.537	1.250	50	20	IDGD	
COc1nn(C)c2nc(C)c(CCC(=O)NNC(=O)CCN3C[C@H](C)O[C@@H](C)C3)c(C)c12	732264910	XYXILZWRJCQELF-KBPBESRZSA-N	446.552	1.173	50	20	IDGD	
Cc1ccc(C)c(S(=O)(=O)NCCC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c1	733169895	FTHUPCDMQADLSL-UHFFFAOYSA-N	441.513	1.619	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2ccccc2)c(F)cc1Br	734414725	NBWPSDAPRJBSDA-UHFFFAOYSA-N	431.239	1.998	50	20	IDGD	
COC[C@@H](NC(=O)NNC(=O)CNC(=O)c1ccco1)c1cccc(C(F)(F)F)c1	735761428	PNXPPPQDSOXOGQ-CYBMUJFWSA-N	428.367	1.746	50	20	IDGD	
Cc1nc(S(=O)(=O)N2CCC(C(=O)NNc3ncccc3C(F)(F)F)CC2)cn1C	740090955	BPNVXVYDPBQUMO-UHFFFAOYSA-N	446.455	1.686	50	20	IDGD	
O=C(COC(=O)c1ccccc1Cn1cccn1)NNC(=O)[C@@H]1COc2ccccc2O1	741348457	XQVUXLJEQXVXFR-IBGZPJMESA-N	436.424	1.076	50	20	IDGD	
C[C@H](CC(=O)NNC(=O)Cc1ccc(Cl)cc1)/N=C1/NS(=O)(=O)c2ccccc21	742480759	TWBKYKGBHHZBER-GFCCVEGCSA-N	434.905	1.547	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)[C@@H]3C[C@]34CCc3ccccc34)cc2)CC1	743334677	MKSTYSXKEYMPMG-GMAHTHKFSA-N	440.569	1.970	50	20	IDGD	
COc1ccccc1N1C[C@@H](C(=O)NNC(=O)c2cc(Br)ccc2O)CC1=O	743731878	BHQCBXWQQWNOSH-NSHDSACASA-N	448.273	1.977	50	20	IDGD	
Cc1cc(=O)n(CC(=O)NC(C)C)c(C)c1C(=O)NNc1nc(-c2cccnc2)no1	746242553	XFOBYNIVTXVYIP-UHFFFAOYSA-N	425.449	1.192	50	20	IDGD	
COc1cc(C)nc(NNC(=O)c2ccc(S(=O)(=O)N3C[C@H](C)O[C@@H](C)C3)cc2)n1	746630602	KLOPNUMOYZPFAL-KBPBESRZSA-N	435.506	1.348	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NCC(=O)NNc2ccc(C(F)(F)F)cc2)c1	747604857	IESOHZPDMXLXKG-UHFFFAOYSA-N	444.435	1.829	50	20	IDGD	
NC(=O)[C@@H]1CN(C(=O)C(=O)Nc2ccccc2S[C@@H](Cl)C(F)(F)F)CCO1	748001591	MOQUFHHSZUWTSX-LKFCYVNXSA-N	425.816	1.557	50	20	IDGD	
N#Cc1ccc(NNC(=O)c2ccc3c(c2)S(=O)(=O)N(C[C@H]2CCCO2)C3=O)cc1	748101068	UYRIVVJDEVQRCH-MRXNPFEDSA-N	426.454	1.639	50	20	IDGD	
COc1cccc(OC)c1Oc1ccc(CNC(=O)NNC(=O)C(=O)N2CCCC2)cn1	748458541	CJALWLPIUNPBKR-UHFFFAOYSA-N	443.460	1.344	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1=O	748632993	FRLPEXSZJGMNPA-WFASDCNBSA-N	444.435	1.165	50	20	IDGD	
O=C(Cc1cccc(F)c1)NCCNC(=O)NNC(=O)c1ccc(Br)s1	748826167	YCIGBDNBEFAQHB-UHFFFAOYSA-N	443.298	1.953	50	20	IDGD	
O=C(NNC(=O)c1ccccc1S(=O)(=O)N1CCOCC1)c1cc2ccccc2o1	749478964	RKRAANJWEQJMHL-UHFFFAOYSA-N	429.454	1.529	50	20	IDGD	
COc1ccc(CCN2C[C@H](C(=O)NNC(=O)CCc3ccccc3)CC2=O)cc1OC	749803213	CFTJKXNSFBJERO-LJQANCHMSA-N	439.512	1.875	50	20	IDGD	
CC(C)N1C[C@@H](NC(=O)NNC(=O)[C@H]2Cc3ccccc3CN2Cc2ccccc2)CC1=O	750646405	XREYIFTYYYUHQX-FCHUYYIVSA-N	449.555	1.953	50	20	IDGD	
CCOC(=O)NCCCC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	751538594	KBCWGKNKDGLJML-UHFFFAOYSA-N	440.522	1.149	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cc(S(N)(=O)=O)cc(C)c2C)ccc1OC(C)C	751557048	ZSGDWHWLTDEGPG-UHFFFAOYSA-N	435.502	1.821	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)NCc2ccc(C)cc2N2CCOCC2)c1	753925230	MIPHUPIOLNGUMJ-UHFFFAOYSA-N	428.489	1.993	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)Nc1ccc(Br)cc1Cl)S(C)(=O)=O	754128359	DCDSGHIDMSXHEM-ZETCQYMHSA-N	427.708	1.871	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)N[C@@H]1CCN(c2ncccc2F)C1	755084802	IUISDEFVDVPLKG-CYBMUJFWSA-N	449.512	1.045	50	20	IDGD	
C[C@H](C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1)[C@@H](C)NC(=O)OC(C)(C)C	755313019	PPOYRTRGHNQCIN-VHSXEESVSA-N	448.929	1.298	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)Nc1ccc(-c2csc(N3CCOCC3)n2)cc1	755580397	ANDJJMJNOOOZFT-AWEZNQCLSA-N	449.533	1.851	50	20	IDGD	
C[C@@H](CN1CCOCC1)C(=O)NN=Cc1cc(C(F)(F)F)ccc1N(C)CC(=O)O	755585967	XGXXIMCVSLJRTR-ZDUSSCGKSA-N	430.427	1.645	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)Nc2cccc(-n3nnnc3C)c2)cc1	755757421	VBUMMVHKAAFCKQ-CYBMUJFWSA-N	425.449	1.990	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)Nc1ccc(S(=O)(=O)c2ccc(F)cc2)cc1	756073608	QDOCLYALGJXQRH-ZDUSSCGKSA-N	439.465	1.863	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)Nc1cccc(S(=O)(=O)NC(C)(C)C)c1C	756672454	OWYOZYJIMZEBBX-ZDUSSCGKSA-N	430.527	1.276	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)Nc1ccc(S(=O)(=O)NC2CC2)cc1	756774345	BZSAAXGWCNCGRO-GFCCVEGCSA-N	436.465	1.887	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)Nc1nnc(CC(F)(F)F)s1	757720796	MOMAFJOXDBHMJC-UHFFFAOYSA-N	430.416	1.502	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2cccc3c2OCO3)c1	757996546	UHIQKIYFSFFHCI-UHFFFAOYSA-N	434.474	1.912	50	20	IDGD	
O=C(NCCOc1ccc(Cl)cn1)NNC(=O)c1csc(N2CCOCC2)n1	760712962	CNUKBXQELKRNKN-UHFFFAOYSA-N	426.886	1.051	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)N[C@@H]1CC[C@H]2SCCS[C@H]12	762527527	KOUZKBFPDXHJGC-RAIGVLPGSA-N	429.593	1.303	50	20	IDGD	
COc1cc(C(=O)NNC(=O)N[C@H]2CCCC[C@@H]2N2CCOCC2)cc(OC)c1OC	763536451	PZPKLAZCJQEWFX-HOTGVXAUSA-N	436.509	1.300	50	20	IDGD	
CC(=O)N(Cc1ccc(NC(=O)C(=O)NNC(=O)COc2cccc(C)c2)cc1)C1CC1	763631142	VFHZICMVFWQXSA-UHFFFAOYSA-N	438.484	1.671	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc2c(c1)NC(=O)CC2	763681643	HJJCWFRXSQSGFF-UHFFFAOYSA-N	426.429	1.135	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(-n2ccnc2C)nc1	763682217	POKAHKCJPKNQSC-UHFFFAOYSA-N	438.444	1.139	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2c(C)nn(-c3ccccc3)c2C)c1	763775393	QJQZICDHBWEMMJ-UHFFFAOYSA-N	437.456	1.906	50	20	IDGD	
COCCOc1ccc(C#N)cc1NC(=O)C(=O)NNC(=O)c1cc(OC)cc(OC)c1	763775472	RROALEDRGDYMEO-UHFFFAOYSA-N	442.428	1.000	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cc(C)n(-c3cccc(F)c3)n2)cc1	763813175	XOFRJPFIGJSPPA-UHFFFAOYSA-N	425.420	1.793	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccn(Cc3ccccn3)n2)c1C	763840243	JSWAIEIIZAFHQR-INIZCTEOSA-N	436.472	1.497	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cccc([C@H]3CNC(=O)C3)c2)c1C	763849773	MZOIPKINNFDZCJ-DOTOQJQBSA-N	438.484	1.460	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccccc2C(=O)N(C)C)cc1	763872015	IWRVWIZZLVNFAA-CQSZACIVSA-N	440.456	1.144	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccccc2OCc2cscn2)n1	763880033	ATQWEHRREFMMRQ-UHFFFAOYSA-N	428.474	1.322	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)Cn2nc(C)cc2C)cc1OC1CCCC1	763880631	IVGZZTUGZKADKQ-UHFFFAOYSA-N	429.477	1.616	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccnn2-c2ccncc2)cc1OC	763911439	NQKAXEBURWHQDE-UHFFFAOYSA-N	438.444	1.464	50	20	IDGD	
CCC(=O)Nc1ccc(C)c(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)c1	764005562	AYQDYQLNSBSMRQ-UHFFFAOYSA-N	426.429	1.514	50	20	IDGD	
CS(=O)(=O)NCCc1ccc(C(=O)NNC(=O)CSc2ccccc2O)s1	764045512	MTWWJJWVTGIVTM-UHFFFAOYSA-N	429.545	1.099	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(C(=O)N3CCSCC3)c2)c(O)c1	764105227	NHHRWXMCLKMLJE-UHFFFAOYSA-N	442.497	1.289	50	20	IDGD	
O=C(NNC(=O)c1ccoc1)C(=O)Nc1ccnn1Cc1ccc(OC(F)(F)F)cc1	764167591	IXKNPCHPQOSQEH-UHFFFAOYSA-N	437.334	1.823	50	20	IDGD	
CCOCCOc1c(Cl)cccc1NC(=O)C(=O)NNC(=O)c1scnc1C	764245227	AWBUDIHIJREPFV-UHFFFAOYSA-N	426.882	1.920	50	20	IDGD	
Cc1ncsc1C(=O)NNC(=O)C(=O)Nc1ccc(N2CCN(C)CC2)c(Cl)c1	764245653	HUWLZJDQAJNLFO-UHFFFAOYSA-N	436.925	1.256	50	20	IDGD	
O=C(NNC(=O)c1cccc(OC(F)F)c1)C(=O)Nc1ccccc1Cn1cncn1	764250748	MRKPWZUINLCNAU-UHFFFAOYSA-N	430.371	1.328	50	20	IDGD	
C=CCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cccc(OC(F)F)c2)cc1	764250837	OPEHSPIEXGBMLX-UHFFFAOYSA-N	432.383	1.604	50	20	IDGD	
CC(C)COC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)COc2ccccc2O)c1	764279904	HIWZPNIODUMDRO-UHFFFAOYSA-N	444.444	1.762	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)C(=O)Nc2ccc(Br)c(C(F)(F)F)c2)cn1	764359564	VQGAPGFGGLKLSQ-UHFFFAOYSA-N	434.172	1.601	50	20	IDGD	
Cc1nnnn1-c1cc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2F)ccc1F	764410420	GBDBDEOFLAGQCD-UHFFFAOYSA-N	435.778	1.302	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=S)Nc1ccc([N+](=O)[O-])cc1	764514073	JHIVUDUDRCSXDG-UHFFFAOYSA-N	442.501	1.370	50	20	IDGD	
COc1ccc(C=NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)c(OC)c1OC	764831926	WSHJFAATIBSVKY-UHFFFAOYSA-N	440.500	1.621	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2cccs2)[nH]n1)c1ccc(N2CCCS2(=O)=O)cc1	765569837	NSKMJLPMIPRMAJ-UHFFFAOYSA-N	431.499	1.753	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3ccc(S(C)(=O)=O)o3)n[nH]2)cc1OC	765597420	SYEXHXCFVXRPPJ-UHFFFAOYSA-N	434.430	1.165	50	20	IDGD	
CCOc1ccnc(N2CCCN(CC(=O)NNC(=O)c3cc(C)c(CC)s3)CC2)n1	767913753	VLXOUHSCNUDZRQ-UHFFFAOYSA-N	446.577	1.781	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc(C)o2)n(-c2ccc(C(F)(F)F)cn2)n1	768243573	XDNMBUCSTZPCRO-UHFFFAOYSA-N	436.350	1.896	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)[C@@H](C)N3C(=O)[C@H]4CCCC[C@H]4C3=O)n[nH]2)cc1	768268201	LLLUECOPJFLNDA-XYPHTWIQSA-N	437.500	1.964	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)CSc1nnnn1C1CCCC1	768636669	XQJWLFOBOKZNNA-UHFFFAOYSA-N	426.524	1.436	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)C(C)(C)C	769120694	NFJCMFDWWFAXLW-CQSZACIVSA-N	427.523	1.791	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)[C@H]1CCN(C(=O)OCc2ccccc2)C1	770133930	JOHKYIAZHUQBDO-KRWDZBQOSA-N	426.473	1.913	50	20	IDGD	
COc1ccc(-n2nc(C(=O)NNC(=O)c3csc(N4CCOCC4)n3)cc2C)cc1	770574961	NQTWQZUBRURTSO-UHFFFAOYSA-N	442.501	1.557	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)c3cccc(NC(=O)[C@H]4Cc5ccccc5O4)c3)nc21	770988749	ANSSTRMYTGQCKC-QGZVFWFLSA-N	445.439	1.768	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1cccc(NS(=O)(=O)c2cccs2)c1	772020619	FCEQGRQBRYNNPV-NSHDSACASA-N	425.488	1.652	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)[C@@H]1CSCN1C(=O)c1ccc(C(C)(C)C)cc1	772094480	DBSNJPYIXSVNLT-BBRMVZONSA-N	435.546	1.988	50	20	IDGD	
COc1ccc(C(=O)CCC(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)cc1F	772191981	IBKZIJMEZDJCIB-UHFFFAOYSA-N	435.839	1.914	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNS(=O)(=O)c1ccc2c(c1)C(=O)N(C)C2=O	773267847	XQMRQAFDYREYCC-SNVBAGLBSA-N	437.861	1.343	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1cccc(Cn2cncn2)c1	774010629	YLIFWSNERVBPOO-CYBMUJFWSA-N	442.863	1.533	50	20	IDGD	
Cc1cc(N2C[C@H](C(=O)NNC(=O)c3nn(-c4ccccc4)cc3O)CC2=O)ccc1F	780328196	OLYXYNAUQQQQNO-CQSZACIVSA-N	437.431	1.840	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)C[C@H](NC(=O)c3ccc(O)cc3)c3ccccc3)nc21	780509318	GXJBWMQHCORDLW-KRWDZBQOSA-N	447.455	1.779	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2OC)c(OC)c1	782120279	ICSHMHYQXQEKQV-UHFFFAOYSA-N	435.820	1.544	50	20	IDGD	
O=C1C[C@H](Cc2ccc(NC(=O)C(=O)NNc3ccc(Br)cc3)cc2)C(=O)N1	783008995	BICPDYVEWGJDKU-LBPRGKRZSA-N	445.273	1.736	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccc(F)cc2Cl)nc1	783264421	PEOVGHQOMFXHHZ-UHFFFAOYSA-N	429.861	1.643	50	20	IDGD	
Cn1c(=NNC(=O)C(=O)Nc2ccc(NC(=O)[C@@H]3CCCO3)cc2)sc2ccccc21	783349510	KLOCNVZHMTTWPH-INIZCTEOSA-N	439.497	1.928	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2ccc(C)c(S(=O)(=O)N3CCCCC3)c2)ncn1	783948512	PDPCWGDMJSPPRT-UHFFFAOYSA-N	432.506	1.350	50	20	IDGD	
COC(=O)CNC(=O)c1ccc(NC(=O)C(=O)NNc2ccc(OC(F)F)cc2)cc1	784308731	NDMXSOAKMRAYOY-UHFFFAOYSA-N	436.371	1.273	50	20	IDGD	
CN(c1ccccc1NC(=O)C(=O)NNc1ccc([N+](=O)[O-])cc1Cl)S(C)(=O)=O	784384979	XFUSRZLFBYCATH-UHFFFAOYSA-N	441.853	1.726	50	20	IDGD	
CN(C)c1nccc(NNC(=O)C(=O)Nc2ccc(=O)n(Cc3ccccc3Cl)c2)n1	784971196	VOMILHZSNQXMKX-UHFFFAOYSA-N	441.879	1.488	50	20	IDGD	
CC(C)(C)NC(=O)c1cccc(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)c1	785059982	FKFPEKCFUZKNNC-UHFFFAOYSA-N	436.472	1.191	50	20	IDGD	
COc1cc(F)cc(NNC(=O)C(=O)Nc2cccc(S(=O)(=O)NC3=NCCC3)c2)c1	785234620	NSPPXJKXJFLHCU-UHFFFAOYSA-N	449.464	1.387	50	20	IDGD	
CCN(C(=O)c1cc(NC(=O)C(=O)NNC(=O)Cc2ccccn2)ccc1Cl)C(C)C	787543449	WLPYLYZMECPBLQ-UHFFFAOYSA-N	445.907	1.934	50	20	IDGD	
COc1ccc(Cl)cc1N1C[C@@H](C(=O)NNc2ccccc2S(N)(=O)=O)CC1=O	788230831	ZMVUWKXIOCSEIW-NSHDSACASA-N	438.893	1.492	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12)c1ncnn1C	788886731	QESKFLVMIPAUJY-CQSZACIVSA-N	446.471	1.279	50	20	IDGD	
COCCOc1cc(C)ccc1NC(=O)C(=O)NNC(=O)[C@H]1OCC[C@H]1c1ccccc1	789815187	BHPPIDVAFGNXBE-PXNSSMCTSA-N	441.484	1.679	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)[C@@H](NC(=O)C(F)(F)F)C(C)C)n[nH]1	790003703	AAFVTISGIJAZCM-AWEZNQCLSA-N	427.383	1.549	50	20	IDGD	
COc1c(C(=O)N(C)C)cc(Cl)cc1S(=O)(=O)NNC(=O)c1cccc(C)n1	790071160	DLRPKRUMWJMKQX-UHFFFAOYSA-N	426.882	1.377	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)Cc2ccc(NC(=O)OC(C)(C)C)cn2)C[C@H](C)O1	792628367	HRWHRHBTYBWUHX-GJZGRUSLSA-N	435.525	1.618	50	20	IDGD	
CN(C)N(C(=O)c1ccc(S(=O)(=O)Nc2nccs2)cc1)[C@@H]1CCS(=O)(=O)C1	792851275	UYRBSDHQYKIFCL-CYBMUJFWSA-N	444.560	1.050	50	20	IDGD	
O=C(NNc1ccc2c(=O)[nH]ccc2c1)C(=O)Nc1cccn(Cc2ccc(F)cc2)c1=O	793065632	OOLUMDGPYKFURE-UHFFFAOYSA-N	447.426	1.959	50	20	IDGD	
COc1c(Cl)cccc1NC(=O)C(=O)NNC(=O)CNC(=O)OCc1ccccc1	797368496	BMIVWYYOMMEMOY-UHFFFAOYSA-N	434.836	1.361	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)[C@@](C)(O)CN2C(=O)NC3(CCCC3)C2=O)c(Cl)c1	802047861	IJGWYSDAZURXKC-SFHVURJKSA-N	437.884	1.417	50	20	IDGD	
COc1ccc(C2=NO[C@@H](CNC(=O)NNC(=O)c3ccc4c(c3)OCCO4)C2)cc1C	802360203	ZMKDKNDXPJCQBE-MRXNPFEDSA-N	440.456	1.912	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N[C@@H]2CCCN(C(=O)CCC(F)(F)F)C2)cc1OC	804892086	NCZXLXMLWDISEE-CYBMUJFWSA-N	446.426	1.981	50	20	IDGD	
COC(=O)c1cc(Br)c(OC)cc1NC(=O)C(=O)NNC(=O)C(C)(C)C	806962100	XYCXNCXMWGDTIC-UHFFFAOYSA-N	430.255	1.376	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)c1ccc(C)c(S(=O)(=O)NC2CCCC2)c1	807371638	PRKNSHUELZYZRD-UHFFFAOYSA-N	441.550	1.766	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NCCCn1cc(Br)cn1	807613954	VTEXAZWHBCIMJT-NSHDSACASA-N	428.262	1.973	50	20	IDGD	
CCCS(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)c2cc(OC)cc(OC)c2)cc1	808069288	SIFXAAPBKHAXTM-UHFFFAOYSA-N	442.515	1.511	50	20	IDGD	
COC(=O)c1c(F)ccc(NC(=O)C(=O)NNC(=O)c2cc(OC)cc(OC)c2)c1F	810385907	DSYMTJXBMMNQQU-UHFFFAOYSA-N	437.355	1.168	50	20	IDGD	
Cc1cc(C(F)(F)F)nn1CC(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	811246150	SEYKHMLSNPKTSU-UHFFFAOYSA-N	429.311	1.123	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)CNS(=O)(=O)c1c(C)c(C)cc(C)c1C	811399831	QTNYXFLHZOOFLG-UHFFFAOYSA-N	429.539	1.135	50	20	IDGD	
COC(=O)c1cn(-c2cccc(NC(=O)C(=O)NNC(=O)c3ccc(Cl)cc3)c2)nn1	812980648	YPRPWYQJDQVXNT-UHFFFAOYSA-N	442.819	1.107	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2nc(CC(F)(F)F)cs2)cc1OC	815563636	JJHQLWLIWVEBRO-UHFFFAOYSA-N	432.380	1.665	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1ccc(C(F)(F)F)nc1	815752188	HPVAJCITQBXDHD-UHFFFAOYSA-N	431.396	1.433	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)c1cc(S(C)(=O)=O)ncc1Cl	816810749	YONDXCMOGJRTGA-UHFFFAOYSA-N	427.866	1.377	50	20	IDGD	
CCOC(=O)c1ccc(C#N)c(SCC(=O)NNC(=O)c2ccc(OC)c(OC)c2)n1	818135104	MDRPKIPGPSCRTG-UHFFFAOYSA-N	444.469	1.700	50	20	IDGD	
CC(C)C[C@H](C(=O)NNC(=O)COc1ccccc1F)N1C(=O)[C@@H]2CC=CC[C@H]2C1=O	864020687	RQHPSVGFFXRUHB-BFYDXBDKSA-N	431.464	1.718	50	20	IDGD	
O=C(c1nnn(-c2ccc(Br)cc2)c1C(F)(F)F)N1CC[C@H](B(O)O)C1	864234134	NJBSYJXEFDNCTE-QMMMGPOBSA-N	432.993	1.738	50	20	IDGD	
O=C(N1CC[C@@H](B(O)O)C1)C1(S(=O)(=O)c2ccc(Br)cc2)CCCC1	864234698	UAARRWXISMAIOB-GFCCVEGCSA-N	430.129	1.611	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)c2cccc(CN3C(=O)CSC3=O)c2)c1	887557599	WZXPVUCIWKJQMM-UHFFFAOYSA-N	429.454	1.974	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CS[C@H](Cc2ccccc2F)C(=O)N1)c1c[nH]c2ccccc12	896280627	GPRMGPQOWSJNFD-ZWKOTPCHSA-N	426.473	1.911	50	20	IDGD	
CC(=O)c1cccc(S(=O)(=O)NCC(=O)NNC(=S)Nc2cccc(C)c2C)c1	913424997	PTYFFLQSXGQDFQ-UHFFFAOYSA-N	434.543	1.802	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1cccs1)C(=O)OCC(=O)NNC(=O)c1cccc(Cl)c1	915020584	IYCUBOUNIPXSHD-SNVBAGLBSA-N	445.906	1.073	50	20	IDGD	
CN(C)[C@H](CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)c1cccs1	915898161	TXKPGVBKEBUHPV-OAHLLOKOSA-N	439.563	1.245	50	20	IDGD	
O=C(NCc1ccc(S(=O)(=O)NC[C@@H]2CCCO2)cc1)NNc1ccc(Cl)nn1	916648888	DSQNRFOLRWWDCL-ZDUSSCGKSA-N	440.913	1.414	50	20	IDGD	
CC(C)N1C(=O)c2ccc(C(=O)NNC(=O)c3ccc4c(c3)OCO4)cc2S1(=O)=O	916743935	KENSFBFQHLYZHU-UHFFFAOYSA-N	431.426	1.043	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)N(C)CCCC(=O)NNC(=O)c2ccc(C)cc2O)cc1	918340710	BIEQTZYUVOVYEQ-UHFFFAOYSA-N	447.513	1.765	50	20	IDGD	
COC1(C(=O)OCC(=O)NNC(=O)c2ccc(C)cc2)CCN(C(=O)OC(C)(C)C)CC1	919518472	RHWXYVYSUMZXGK-UHFFFAOYSA-N	449.504	1.715	50	20	IDGD	
O=C(NC[C@@H]1CCN(c2ccc(F)cc2)C1)NNC(=O)c1csc(N2CCOCC2)n1	920046164	IKULYFFAEGVCPN-AWEZNQCLSA-N	448.524	1.589	50	20	IDGD	
O=C(NNC(=O)c1cc2ccccc2cc1NC(=O)C1CC1)N[C@H]1CCS(=O)(=O)C1	920746529	XAYQWDDQOCYKFT-HNNXBMFYSA-N	430.486	1.319	50	20	IDGD	
N#Cc1cccc(S(=O)(=O)NCC(=O)NNC(=O)c2cc3c(s2)CCCCC3)c1	920815581	CZVDRQJRGKTGQC-UHFFFAOYSA-N	432.527	1.628	50	20	IDGD	
CCO[C@H](C)c1noc(CN(C)C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)n1	1116155938	KKHRRRDPEJHYTL-CYBMUJFWSA-N	432.485	1.046	50	20	IDGD	
COc1ccc(C=O)c(OCC(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)c1	1321905225	GQFQGAUGPCTKJQ-UHFFFAOYSA-N	435.477	1.681	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2ccc(Br)c([N+](=O)[O-])c2)cc1	1332929612	NJALCZLGZVJUPI-UHFFFAOYSA-N	430.236	1.989	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)N[C@H]2CCO[C@@]3(CCOC3)C2)CC1	1337107901	CXOUZRGMMXREEP-YWZLYKJASA-N	426.514	1.302	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2nc[nH]c2[N+](=O)[O-])C1	1778063329	KDDDFLATGRNYLE-GLKRBJQHSA-N	444.286	1.229	50	20	IDGD	
CCn1nc(C(C)C)cc1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](Cl)COC)CCO2	1780403849	FJLDJHQJJZEHLW-MGPUTAFESA-N	426.945	1.724	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)C3(Br)CC3)CCO2)C1	1781234513	NUPCLNPHFSNSPK-UONOGXRCSA-N	428.154	1.980	50	20	IDGD	
COc1cc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](F)Cl)CCO3)cc([N+](=O)[O-])c1OC	1782116929	WDODGFKKDBGYQR-CRAIPNDOSA-N	445.831	1.590	50	20	IDGD	
C/C=C(\C)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2	1783068077	VPHXREJNXMMCKC-XGQGSGBZSA-N	429.945	1.915	50	20	IDGD	
CCc1cc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](Br)CC)C3)C2)nn1C	1783353748	ZYEUDKKYMMJDIA-KDOFPFPSSA-N	427.343	1.600	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)C1(C(=O)Nc3ccccc3)CC1)CCO2	1783871944	WZGMJBVLQIFLJF-UTKZUKDTSA-N	449.935	1.489	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)c3ccco3)C[C@@H]21	1783964763	ZWSBBRRWOPBYER-FDICVXPISA-N	429.311	1.324	50	20	IDGD	
Cc1nn(C)c(C)c1CC(=O)N1CC[C@]2(CN(C(=O)CCBr)CCO2)C1	1784508199	ZKTDPXXTOXXXLH-GOSISDBHSA-N	427.343	1.194	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)N3CCN(C)CC3)C[C@@H]21	1784620653	GBBOTHUCTPQRMT-VMXHOPILSA-N	429.005	1.010	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3c(F)c(C)nn3C)[C@H]2C1	1785779100	KGAPNQOLQYYECT-XUXIUFHCSA-N	445.333	1.634	50	20	IDGD	
COC(OC)C(=O)Nc1ccc(C2(NC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CCC2)cc1	1786251699	CWBFRAYIEUFYMW-VULFUBBASA-N	441.488	1.873	50	20	IDGD	
CCS(=O)(=O)N[C@@H](C)C(=O)Nc1ccc(C2(NC(=O)[C@H](Cl)COC)CCC2)cc1	1786338605	CXEGKRLEFVOBTA-XJKSGUPXSA-N	445.969	1.702	50	20	IDGD	
COc1ncccc1C(=O)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1	1788140137	JKKDAWLZOYMEKL-UHFFFAOYSA-N	445.284	1.832	50	20	IDGD	
CCc1[nH]nc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]3C2)c1F	1789922026	BXUNNLTWOSOFBE-KJWJVKQFSA-N	435.269	1.395	50	20	IDGD	
COc1ncc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]3C2)cc1F	1789922367	LQCSLUWXVYSBEU-DTCNJJKHSA-N	448.264	1.513	50	20	IDGD	
NC(=O)[C@@H](N)CCC(=O)NC1(c2ccc(NC(=O)[C@H](F)Br)cc2)CCC1	1790534841	UFEIHJAQJJGWCX-JSGCOSHPSA-N	429.290	1.404	50	20	IDGD	
O=C(CN(CCO)CCO)NC1(c2ccc(NC(=O)[C@@H](F)Br)cc2)CCC1	1790536754	SKTRFMCKSYTOON-MRXNPFEDSA-N	446.317	1.098	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3csc(N)n3)C[C@@H]21	1790961434	KSVCITQWIBKVQX-KQXIARHKSA-N	431.356	1.492	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)Oc3ccccn3)C[C@@H]21	1791065120	RIBQGGIIHJYDMQ-OWYFMNJBSA-N	440.338	1.612	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(F)(F)F)C[C@@H]21	1791251709	QNHJXWUTVNSBKF-YUDUHTQSSA-N	449.857	1.948	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCNC(=O)OC(C)(C)C)C[C@@H]21	1791256373	OJWPIUDKFDHMIA-VGWMRTNUSA-N	447.960	1.135	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(F)cc1C(F)(F)F)C2)[C@@H](O)CCl	1792983350	ICARRIWAGIJAOB-OWLDWWDNSA-N	438.805	1.647	50	20	IDGD	
CC(C)(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](O)CCl)C2)NC(=O)OC(C)(C)C	1793149431	LVDJTHXRTWCEPD-XGUBFFRZSA-N	431.961	1.918	50	20	IDGD	
CN(CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C(C)(C)F)NC(=O)NCc1ccccc1	1795926249	LYZNNZRTSVBNES-BCDXTJNWSA-N	433.528	1.719	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1noc2ccccc12)c1cccc(B(O)O)c1	1796213902	LIJXFOYNRLRSDC-BCDXTJNWSA-N	433.273	1.002	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C(=O)c1ccc(C)cc1)C2	1796893753	QAAVCPLBMUQPSY-INZAXJFKSA-N	449.511	1.950	50	20	IDGD	
CC(C)(C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnccc1C(=O)NN)c1ccccn1	1798443569	JGKHIZXOKDKODH-MUJYYYPQSA-N	436.516	1.310	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(OC)cc1OC	1798824202	SVUYFQPTYMNPRD-ZDFLXESQSA-N	426.897	1.161	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc3c(c1)NC(=O)CS3)C2	1799272698	XIDXGHUDYGTGMD-ZWUHOBOKSA-N	438.937	1.346	50	20	IDGD	
CC(=O)N[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@](C)(Cl)CCl)C(C)(C)C	1799273752	GHZCYMOTFLSDRD-ZEKKIGMLSA-N	436.380	1.363	50	20	IDGD	
C[C@@H](NNc1ccccc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Br	1799341946	AQSPDBMTGOVOOZ-QUEVPRLRSA-N	443.317	1.272	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1(Br)CC1)C2)[C@H](F)Br	1799348483	IYYGTQSQRGVFSU-JXUBOQSCSA-N	428.096	1.194	50	20	IDGD	
CC(C)N(C)CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C#N)=C/c1ccc(F)cc1F	1800334202	LPGJMXYPMTVYLH-SJXZZSFPSA-N	446.498	1.802	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(Cl)c(F)c1)c1ccc(B(O)O)cc1	1800334984	FASTZXAJYXPTNV-BJWYYQGGSA-N	430.672	1.725	50	20	IDGD	
Cn1cnc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C(Cl)Cl)c1C(F)(F)F	1801014742	ATPISGMJZNDSHI-AYMMMOKOSA-N	429.226	1.446	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C[C@@H]1COc3ccccc3O1)C2)C(Cl)Cl	1801015349	JPOWKPNBIXXOAP-IPJQOSJUSA-N	429.300	1.610	50	20	IDGD	
O=C(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(Cl)Cl)Nc1ccc(F)cc1	1801016674	QRHOLSABHRNISL-CULMDFNYSA-N	432.279	1.548	50	20	IDGD	
COc1ccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CO[Si](C)(C)C)C3)cc1F	1801504049	ADPARDGWGKGHEY-VPTLXERWSA-N	438.572	1.818	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H]1CCc3ccccc3C1)C2	1802338538	NFPUOLYLIVXKCH-BURNTYAHSA-N	426.561	1.803	50	20	IDGD	
NC[C@H](C(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]1c1cccnc1)c1ccccc1	1803138749	MKJHISWEFUXUOH-IYWMVGAKSA-N	430.936	1.430	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2nc3ccccc3[nH]2)[C@@H]1c1cccnc1)[C@H](O)CCl	1803139490	PZKYYMRTWDEDRP-BMGDILEWSA-N	427.892	1.877	50	20	IDGD	
CN(C)c1ccncc1C(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]1c1cccnc1	1803140531	FDXAXAYRQYOHFS-AYOQOUSVSA-N	431.924	1.462	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)/C=C/c2ccoc2)[C@@H]1c1cccnc1	1804320334	SMWZVNQSCNNVKO-SFPOZDJVSA-N	439.516	1.767	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)COc1ccc(C(=O)OC)cc1	1804601918	WAXDEXVIBGTMIJ-DFGXFYAUSA-N	438.908	1.744	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC2(CCN(C(=O)CN3CCOCC3)CC2)C1	1805382340	GLWCAWBEOYXYMR-MRXNPFEDSA-N	430.387	1.581	50	20	IDGD	
O=C([C@H](O)CCl)N1CCC2(CCCN(C(=O)[C@H]3CC(=O)N(C4CCCC4)C3)C2)CC1	1806604152	MRQSKSPVSGJKPT-FUHWJXTLSA-N	439.984	1.608	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)C2(N3CCN(C)CC3)CC2)[C@H]1c1cccnc1	1807950290	GBYWIJXKKWJYRO-HSALFYBXSA-N	448.011	1.885	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)CCNC(=S)NC)[C@@H]1c1cccnc1	1808263182	DCAYJGLITPJJSN-YQQAZPJKSA-N	425.986	1.589	50	20	IDGD	
Cc1c[nH]cc1C(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1808587624	DKLOIMFXTKSADM-DYESRHJHSA-N	426.521	1.411	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccnnc2O)[C@@H]1c1cccnc1)[C@H](F)Br	1808675679	DDAWHGFNWDNQPO-YUTCNCBUSA-N	438.257	1.587	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)c3cc(C(F)F)no3)CC2)C1	1809978374	RSSAFFGWYDVVPU-UHFFFAOYSA-N	447.247	1.451	50	20	IDGD	
Cn1cc(CC(=O)N2CC[C@H](CNC(=O)CO[Si](C)(C)C)[C@H]2c2cccnc2)cn1	1810547995	LAMVGRQMTMZTMT-WIYYLYMNSA-N	429.597	1.915	50	20	IDGD	
Cc1ocnc1C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1811076559	QLYZJESBUUPNEC-JXFKEZNVSA-N	428.493	1.071	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)NC(C)=O)[C@H]1c1cccnc1	1812779019	NZKCTTKHHVRTSO-ZCPGHIKRSA-N	439.354	1.786	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1)c1cnc(OCF)cn1	1816181462	ALJRFJJDESCYBJ-OLZOCXBDSA-N	426.836	1.411	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC[C@H]1c1cc(NC(=O)C2=NNC(=O)C2)n[nH]1	1819344460	WSXKYELHYAUNRM-CABZTGNLSA-N	425.287	1.451	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)C(F)(F)Cl)[nH]n1	1819404339	HSXLLBKRYNRBMK-GFCCVEGCSA-N	441.826	1.546	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)N[C@H]1CCc2nc(NC(=O)CO[Si](C)(C)C)sc2C1	1820165078	SSDFVLQHWSNWKL-QWRGUYRKSA-N	427.603	1.354	50	20	IDGD	
CCC1(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)[nH]n2)COC1	1821827073	FIIFDMSXAIHRJR-INIZCTEOSA-N	441.492	1.141	50	20	IDGD	
CN(C)C(=O)NCC(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H](F)Br)CC1	1823882380	SBSWNIARNUSCLR-DZGCQCFKSA-N	435.338	1.568	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](O)CCl)CC2)c1cn2c(F)cccc2n1	1824134929	VWRZPRDHGHIUBG-JOYOIKCWSA-N	437.884	1.755	50	20	IDGD	
COC(=O)C1(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)CO[Si](C)(C)C)CC3)CC1	1825278341	VWPDACRTXVBKRY-NSHDSACASA-N	425.583	1.860	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CN1CCOC1=O)CC2	1825635634	IZYBCEDYVQNALF-DTWKUNHWSA-N	431.312	1.291	50	20	IDGD	
O=C([C@@H]1CCCOC1)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827054485	GISQOWKBVPXHHF-TZIWHRDSSA-N	428.338	1.026	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(C4CC4)on3)CCO2)C1	1830198521	AWQTZDPBSYSYCA-OALUTQOASA-N	446.331	1.858	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830361851	GWONNEOFBYNBKL-JOCHJYFZSA-N	448.951	1.978	50	20	IDGD	
O=C([C@@H](O)CCl)N1CCC([C@@H]2CCCCN2C(=O)c2c(O)cc(O)cc2O)CC1	1830642459	DGCJQSMYDWFCFE-YOEHRIQHSA-N	426.897	1.636	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)Cc2ccc(F)cn2)CC1	1831870764	FRRZXFHKVQTNEZ-HXUWFJFHSA-N	447.555	1.756	50	20	IDGD	
Cc1cccnc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1	1831870890	IKDFKYAEJHTXQN-IBGZPJMESA-N	429.565	1.996	50	20	IDGD	
COc1ccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)nc1	1831873113	JZXLFZBAYJGDPS-HXUWFJFHSA-N	445.564	1.697	50	20	IDGD	
O=C(CCC1CCC1)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1	1833397428	DGUUYAYIDIVIDE-UHFFFAOYSA-N	441.381	1.132	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)CSCC(=O)O)CC2)CC1	1833535034	OSONMDFMRCOCBL-MRXNPFEDSA-N	434.002	1.783	50	20	IDGD	
O=C(CCBr)NC1CCN(C2CCN(C(=O)Cn3cccn3)CC2)CC1	1834421843	OQPLBNFOMNWPFH-UHFFFAOYSA-N	426.359	1.240	50	20	IDGD	
CC(C)NCCC(=O)NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1834782470	HABMWTBCWVCICP-QGZVFWFLSA-N	435.382	1.637	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3nc4ncccn4n3)CC2)CC1	1835350757	HJQVWTJBCHJCJM-KRWDZBQOSA-N	447.971	1.717	50	20	IDGD	
CC(C)N[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)CCBr)C2)C1)C(C)C	1835895282	YPFHGJBUCCLARP-HKUYNNGSSA-N	448.402	1.250	50	20	IDGD	
COc1ccccc1CC(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836718733	BTQIWXZTMXTZDI-IBGZPJMESA-N	438.952	1.836	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)Cn3ccnn3)CC2)CC1	1837981876	ZZVSWTWTUILCSA-MRXNPFEDSA-N	442.358	1.450	50	20	IDGD	
O=C1C[C@H](C(=O)N2CCC(OC3CCN(C(=O)[C@H](F)Br)CC3)CC2)CCN1	1838648233	NIRKGFOCUIWOPB-WBMJQRKESA-N	448.333	1.202	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(F)c(F)c3)CCO2)C1	1839011742	XXZDVUFATJTICL-SGTLLEGYSA-N	447.276	1.818	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc4c3cnn4C)C2)C1	1839144756	KBUYLJPGUCYCCH-DYESRHJHSA-N	434.924	1.661	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)Nc3nccs3)C2)C1	1839144844	MFRGGULKXZOHSP-DEYYWGMASA-N	430.958	1.417	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccc(F)cc3OC)C2)C1	1839149322	BQAWIHJVEFIKMP-UWJYYQICSA-N	442.915	1.851	50	20	IDGD	
N#Cc1ccc2[nH]nc(C(=O)N3CCO[C@@]4(COCCN(C(=O)[C@H](F)Cl)C4)C3)c2c1	1839487868	JSKPARRUTUVKFM-LPHOPBHVSA-N	435.843	1.039	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)C(F)(F)C(F)F)C2)C1	1839962923	VKEIQRABLGVZEW-QMTHXVAHSA-N	449.239	1.517	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)C3(CC)COC3)C2)C1	1839966352	BNNLWPMHRZIKMX-RDTXWAMCSA-N	433.343	1.043	50	20	IDGD	
Cc1cc(C)nc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)c1	1840032138	OHTPRXADMVMVNF-DNVCBOLYSA-N	440.338	1.552	50	20	IDGD	
CCCc1onc(C)c1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](Cl)COC)CCO2	1840152322	FNHRPJXQCLCAMO-YWZLYKJASA-N	443.928	1.259	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)COc3ccccc3C#N)CCO2)C1	1840818780	WYFOIDFICMAMEU-GCJKJVERSA-N	449.935	1.801	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)c2cc(-c3ccccc3)on2)C1	1840995463	KXRCESANAQVNJY-UHFFFAOYSA-N	425.489	1.532	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1)C1CC1	1841348520	VGDUZNXMXMNFFN-LSDHHAIUSA-N	429.945	1.483	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)C(F)(F)c1ccco1)C2	1843416822	FDZMJVLPTKUYQF-ZMOGYAJESA-N	433.415	1.709	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCCC12CN(C(=O)c1nc(O)n3c1CCCC3)C2	1846070722	ASMQLGFZVIIVMT-GFCCVEGCSA-N	425.327	1.916	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)c2ccc(Cn3nc(C)c([N+](=O)[O-])c3C)cc2)n1	14894342	IPTCMGUHIUQDIL-UHFFFAOYSA-N	425.449	1.731	50	20	IDGD	
O=C(CN1C(=O)c2cccc([N+](=O)[O-])c2C1=O)NNC(=O)C12CC3CC(CC(C3)C1)C2	15900642	PILYUEZNIMSIJY-UHFFFAOYSA-N	426.429	1.555	50	20	IDGD	
COc1ccc(C)cc1N1C[C@H](C(=O)NNC(=O)c2cc(Br)c[nH]2)CC1=O	28717598	VXKRRQYHFCSJQF-LLVKDONJSA-N	435.278	1.908	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=S)Nc1cccc(S(=O)(=O)N(C)C)c1	36275183	QKMRZWWWGDOHEB-UHFFFAOYSA-N	432.531	1.524	50	20	IDGD	
COCCCNC(=S)N(C)NC(=O)C1CCN(S(=O)(=O)c2ccc(C)cc2)CC1	726076783	COJNJWFXIXCEEJ-UHFFFAOYSA-N	442.607	1.270	50	20	IDGD	
Cc1cc(Br)ccc1NC(=O)CCNC(=O)NNC(=O)C(=O)N1CCCC1	726281528	XLZUACAQVOARRR-UHFFFAOYSA-N	440.298	1.039	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)c2n[nH]c(CC)c2[N+](=O)[O-])c2ccccc2c1=O	726382278	NVUZTYZJACGFSJ-UHFFFAOYSA-N	441.448	1.855	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)NCCCc2nc(C)no2)c2ccccc2c1=O	727603902	KEIQJFKLAQZESM-UHFFFAOYSA-N	441.492	1.855	50	20	IDGD	
CCOc1cc(C=NNC(=O)CN(C)C)cc(Br)c1OCC(=O)N(C)C	727650277	YHWJKKUNAAIFOQ-UHFFFAOYSA-N	429.315	1.327	50	20	IDGD	
NS(=O)(=O)c1ccc(CNC(=S)NNC(=O)c2c(Cl)cccc2Cl)cc1	727783845	NYNPJYXNSWLGJC-UHFFFAOYSA-N	433.342	1.950	50	20	IDGD	
CC(C)(C)c1noc(CCCC(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)n1	728328914	YUOFBLDMIGHNJD-OAHLLOKOSA-N	446.460	1.220	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1cc(Br)cnc1Cl	728846112	LRJGLBWZTNVGRD-UHFFFAOYSA-N	439.701	1.965	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1ccc(Br)c([N+](=O)[O-])c1	728846286	XCZNCGZZZHKWMY-UHFFFAOYSA-N	449.265	1.825	50	20	IDGD	
Cc1nn(-c2ccccc2)c(C)c1C(=O)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	728848143	XATCRDVYUCSFJL-UHFFFAOYSA-N	447.499	1.526	50	20	IDGD	
Nn1c(COc2ccccc2)nnc1SCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	729032299	CIDQLMIDKUWIPB-UHFFFAOYSA-N	443.445	1.032	50	20	IDGD	
CSCC[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)NNC(=O)Cc1ccccn1	729391878	QQGUHBLZIDNWPO-MRXNPFEDSA-N	431.474	1.231	50	20	IDGD	
CCN1CCC[C@@H]1CN1C[C@@H](C(=O)NNC(=O)c2ccc(Br)s2)CC1=O	729626153	JKVWERXXNQGWLY-NWDGAFQWSA-N	443.367	1.604	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NC[C@@H](O)c1cccc(C(F)(F)F)c1	730826464	KJOHSRLXEYRWQI-GFCCVEGCSA-N	430.408	1.561	50	20	IDGD	
CC(C)(C(=O)NNC(=O)c1cc(S(=O)(=O)N2CCSCC2)c[nH]1)c1ccccc1	731201929	XJRJQCIPZNHAIP-UHFFFAOYSA-N	436.559	1.491	50	20	IDGD	
CCCCCn1nc(C(=O)NNS(=O)(=O)C[C@@H]2CCCCO2)c2ccccc2c1=O	731902992	SZWLPKMGQDPRSJ-HNNXBMFYSA-N	436.534	1.720	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2cccc(CSc3nccn3C)c2)C[C@H](C)O1	732263108	JVXNHWBZYXHJER-HOTGVXAUSA-N	431.562	1.973	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N(C)Cc2cc[nH]n2)cc1	732660688	IFLFGPAKPMPLEF-LFIBNONCSA-N	433.472	1.723	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)CSc1ccc2c(c1)OCCO2	734240578	UHHOEPFDTVPVIW-UHFFFAOYSA-N	426.495	1.405	50	20	IDGD	
O=C(NNc1nccnc1Cl)c1cc(S(=O)(=O)N2CCOCC2)ccc1Cl	734261762	CNJMOPNKZGFNIY-UHFFFAOYSA-N	432.289	1.561	50	20	IDGD	
CC(C)Cc1ccc(CC(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)cc1	735117027	LQAGCTBONTWEEA-UHFFFAOYSA-N	445.589	1.902	50	20	IDGD	
C[C@H](SCc1ccccc1)C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	735117323	QXPJJJISCLBLRQ-INIZCTEOSA-N	449.602	1.783	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)c2ccc3c(=O)n(-c4ccccc4F)c(S)nc3c2)cn1	735470631	FMWMIPXPFVENFF-UHFFFAOYSA-N	438.444	1.622	50	20	IDGD	
COc1ccnc(NNC(=O)NC2CCN(C(=O)c3ccc(OC)c(OC)c3)CC2)n1	735760730	BMJWHZJRZZPIPQ-UHFFFAOYSA-N	430.465	1.433	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC(C(=O)NNc3ccnc(N(C)C)n3)CC2)cc1C	740113024	XKGUSXBFSLLDAS-UHFFFAOYSA-N	432.550	1.703	50	20	IDGD	
Cn1c(=O)n(C)c2cc(S(=O)(=O)NNC(=O)C3CCCC3)c(Br)cc21	741648557	KRRCFTBKKVSGNE-UHFFFAOYSA-N	431.312	1.139	50	20	IDGD	
CC(C)CC(=O)NCCC(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	741661581	VXEAEEMMFBBWRT-UHFFFAOYSA-N	449.511	1.758	50	20	IDGD	
CCOC(=O)[C@@H]1CCCN(C(=O)CN(C)C(=O)NNC(=O)c2cccc3ccccc23)C1	743628027	LJTAHEDFNACTBH-QGZVFWFLSA-N	440.500	1.928	50	20	IDGD	
COC(=O)Nc1ccccc1C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	744619088	HJNQKVPPVOQEFC-UHFFFAOYSA-N	434.474	1.643	50	20	IDGD	
O=C(C[C@H]1C(=O)Nc2ccccc21)NNc1ccccc1S(=O)(=O)N1CCOCC1	744620664	JNNASLIGOMWOTL-OAHLLOKOSA-N	430.486	1.277	50	20	IDGD	
CCc1ccc([C@@H](COC)NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)o1	745847165	MMPOSLRKECLURR-MRXNPFEDSA-N	438.506	1.424	50	20	IDGD	
CC[C@@H](Nc1c([N+](=O)[O-])c(C)nn1C)C(=O)NNC(=O)Cc1nc2ccccc2n1C	746095610	VKTYYKONNFCTBE-GFCCVEGCSA-N	428.453	1.104	50	20	IDGD	
COC(=O)c1ccsc1N1CC[C@@H](NC(=O)/C(C#N)=C\c2cc(C#N)n(C)c2C)C1=O	746642289	XUVSOEUTNGHCCD-XMCSSRMMSA-N	437.481	1.882	50	20	IDGD	
COc1ccc(Cl)cc1NC(=O)CCNC(=O)NNC(=O)CNC(=O)c1ccco1	747502245	KGFIKEXAWUQHIV-UHFFFAOYSA-N	437.840	1.031	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)CNC(=O)NCc2ccc([N+](=O)[O-])cc2)c1	748213638	CLAVQWZONUUSKM-UHFFFAOYSA-N	429.433	1.237	50	20	IDGD	
CN(C)S(=O)(=O)c1ccsc1C(=O)NNc1ccc(S(=O)(=O)C(F)F)cc1	748609489	DACXWBHGPQNDKY-UHFFFAOYSA-N	439.487	1.752	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3cccnc3N3CCCC3)cc2)CC1	748620467	QBCPVNABBBLISN-UHFFFAOYSA-N	444.561	1.375	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H]2CCC[C@H](N(C)C)C2)c1	749589848	JGYOTPCNNHPDQA-SJORKVTESA-N	439.582	1.534	50	20	IDGD	
Cc1ccc(CCCC(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)s1	751067313	WIHUBFZEBSATKP-UHFFFAOYSA-N	437.591	1.854	50	20	IDGD	
N#CCCCS(=O)(=O)c1ccc(C(=O)NNC(=O)CNC(=O)c2cccs2)cc1	751212673	WHFLBELHDAPZND-UHFFFAOYSA-N	434.499	1.017	50	20	IDGD	
O=C(CCCc1ccccc1)NNC(=O)NC[C@@H](O)CS(=O)(=O)c1cccs1	752161355	UCVDVDLHKAEUAX-OAHLLOKOSA-N	425.532	1.236	50	20	IDGD	
CC(C)C[C@@H](C)NC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	752688958	LIWLGHJBOYHMDQ-MRXNPFEDSA-N	440.566	1.405	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)c2cnn3c2C[C@@H](CNC(C)=O)CC3)o1	752888453	FMAUPUAAQSJDAA-HNNXBMFYSA-N	430.509	1.091	50	20	IDGD	
CCc1cc(Br)ccc1NNC(=O)c1ccc2c(=O)n(C)c(=O)n(C)c2n1	753174084	BOXXXSDVFKPBSU-UHFFFAOYSA-N	432.278	1.714	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)N[C@H]2CCCN(Cc3ccccn3)C2=O)cc1OC	753291087	VBUUNFQNNYIHSM-KRWDZBQOSA-N	441.488	1.624	50	20	IDGD	
CC(=O)NCc1ccc(S(=O)(=O)NCC(=O)NNc2ccc(C#N)c(Cl)c2)s1	753301879	AIXHGTDVNOUITK-UHFFFAOYSA-N	441.922	1.331	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)c2cc(S(=O)(=O)N(C)C)c(C)o2)cc1OC	753566781	WHLMCONKZPLHDD-UHFFFAOYSA-N	425.463	1.320	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CN2CCN([C@H](C(N)=O)c3ccc(Cl)cc3)CC2)cc1	754238914	NOGQWXBCWGZSOJ-FQEVSTJZSA-N	443.935	1.254	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)CCc2c(C)nc3c(c(O)nn3C)c2C)cc1	754548917	SHULQTSGWHJZCN-UHFFFAOYSA-N	439.472	1.536	50	20	IDGD	
CCCN(CCC)S(=O)(=O)N1CCN(C(=O)/C(C#N)=C\c2cc(C#N)n(C)c2C)CC1	754716915	FIGFAPUGAWCTJC-UYRXBGFRSA-N	446.577	1.623	50	20	IDGD	
CN(C)c1cccc(CNC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)n1	755096479	PNIYJYDMPQHYPJ-UHFFFAOYSA-N	446.533	1.076	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Nc2cc(S(C)(=O)=O)ccc2C)cc(OC)c1OC	755536704	RCSIGTWCHLFVAW-UHFFFAOYSA-N	437.474	1.891	50	20	IDGD	
C[C@@H]1CN(c2ccc(NC(=O)NNC(=O)[C@@H]3COc4ccccc4O3)cn2)C[C@@H](C)O1	755866909	ZYYQFPOXRKATDC-LBTNJELSSA-N	427.461	1.688	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc(F)c1F	755970044	ZIBHSRPVWRBPLV-UHFFFAOYSA-N	436.396	1.560	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)C(=O)Nc1ncc(Cc2ccccc2)s1	756155754	UBVHKVGUKPQEAJ-UHFFFAOYSA-N	448.468	1.109	50	20	IDGD	
CC(C)COc1ccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cn1	756603392	BLVGRXFRNBAUBO-UHFFFAOYSA-N	435.506	1.833	50	20	IDGD	
NC(=O)c1ccc(NNC(=O)c2ccc3c(c2)C(=O)N(CCc2ccccc2)C3=O)nn1	757400705	BHQHTYNWKHKTLP-UHFFFAOYSA-N	430.424	1.171	50	20	IDGD	
NC(=O)c1ccc(NNC(=O)c2cccc(S(=O)(=O)N3CCc4ccccc43)c2)nn1	757403639	DYBOSDKVJZWEME-UHFFFAOYSA-N	438.469	1.084	50	20	IDGD	
O=C(CCCNS(=O)(=O)c1ccc2c(c1)OCCCO2)NN=c1cc[nH]cc1Cl	757420181	RRUBFDFGBKAUIH-UHFFFAOYSA-N	440.909	1.520	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)Nc2cc(COC)ncn2)c2ccccc2c1=O	757720458	DPEPBTQZYIOIMS-UHFFFAOYSA-N	439.476	1.990	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2scnc2Br)cc1	757721200	UMUDAUYXYUWWAY-UHFFFAOYSA-N	447.336	1.296	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)Nc1cc(C(N)=O)ccc1-n1cc(C)cn1	757876703	PYERLYQGTKMVHI-UHFFFAOYSA-N	438.444	1.520	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)NCc2ccc(S(=O)(=O)NCC(C)C)cc2)c1	759662533	NLGUJVPDNQPIOR-UHFFFAOYSA-N	448.545	1.839	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)C(=O)Nc1cc2ccccc2nc1Br	760278551	ZCEUTSHBRUSZMX-UHFFFAOYSA-N	428.246	1.721	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)C(=O)c1ccc(Cl)s1	760451196	ZMNNQUQPYFAQCP-UHFFFAOYSA-N	434.905	1.190	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1ccc(C(N)=O)cc1)C(=O)NNC(=O)c1ccc(C(C)(C)C)cc1	763015233	XHPLGWQRRUMARC-CYBMUJFWSA-N	446.529	1.211	50	20	IDGD	
COC(=O)CCSc1cccc(NC(=O)C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c1	763445392	FXNFDIWQACTDGI-UHFFFAOYSA-N	446.441	1.650	50	20	IDGD	
CS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2F)cc1Cl	763556531	PJBXZDZEKXCNQJ-UHFFFAOYSA-N	428.829	1.250	50	20	IDGD	
CSc1cnn(-c2ccccc2)c1NC(=O)C(=O)NNC(=O)c1ccc2c(c1)OCO2	763559527	SMMXBPFTEZYFOS-UHFFFAOYSA-N	439.453	1.723	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)Nc1cccc(OC2CCCC2)c1	763569796	CBQAYHLNIQBNKO-IBGZPJMESA-N	425.441	1.934	50	20	IDGD	
COc1c(Cl)cc(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1Cl	763578808	QFSVWAZDQDOBKT-CQSZACIVSA-N	440.239	1.928	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1c(F)c(F)c(F)c(F)c1F	763661827	DBONULMWYKTMRS-UHFFFAOYSA-N	433.289	1.556	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccc(Cn2cccn2)c1	763684834	OQYHJIHNQZFDPZ-UHFFFAOYSA-N	437.456	1.495	50	20	IDGD	
Cc1nnc(-c2cccc(NC(=O)C(=O)NNC(=O)CN3CCCc4ccccc43)c2)o1	763729375	XIPWWHKSJGFQKA-UHFFFAOYSA-N	434.456	1.584	50	20	IDGD	
CCN(Cc1ccccc1NC(=O)C(=O)NNC(=O)COc1ccc(F)cc1)C(C)=O	763838963	WUYSFBWFGMZTSK-UHFFFAOYSA-N	430.436	1.359	50	20	IDGD	
CN(C)C(=O)c1cc(NC(=O)C(=O)NNC(=O)Cc2c[nH]c3ccccc23)ccc1F	763856176	DCNRAORSISWMMP-UHFFFAOYSA-N	425.420	1.337	50	20	IDGD	
COC(=O)c1ccc(OC)cc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccccc1F	763856261	GIBWIQAIFNRABV-LLVKDONJSA-N	433.392	1.174	50	20	IDGD	
CCN1CCN(c2ccc(NC(=O)C(=O)NNC(=O)Cc3ccc(F)cc3)c(C)c2)CC1	763918909	KYORRPCVJXXCAV-UHFFFAOYSA-N	441.507	1.605	50	20	IDGD	
CNC(=O)Cn1ccc2ccc(NC(=O)C(=O)NNC(=O)Cc3ccc(Cl)cc3)cc21	763936431	LBUSVJDMKSGQFB-UHFFFAOYSA-N	441.875	1.369	50	20	IDGD	
CC(C)(C)n1cc(C#N)c(NC(=O)C(=O)NNC(=O)c2ccc(Br)s2)n1	763940023	CQIJXIPBLSPOBB-UHFFFAOYSA-N	439.295	1.733	50	20	IDGD	
Cc1cc(S(C)(=O)=O)ccc1NC(=O)C(=O)NNC(=O)Cc1cccc2ccccc12	764019271	JLNNBWULQDCBCM-UHFFFAOYSA-N	439.493	1.880	50	20	IDGD	
O=C(NNC(=O)C1CCCC1)C(=O)Nc1c(C(=O)N2CCOCC2)oc2ccccc12	764066905	TUOYYLGZWXSDIC-UHFFFAOYSA-N	428.445	1.181	50	20	IDGD	
CNC(=O)CCOc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccc3ccccc3c2)cc1	764090807	GDTHBUPOEUJKQL-UHFFFAOYSA-N	448.479	1.683	50	20	IDGD	
O=C(CCCc1ccccc1)NNC(=O)C(=O)Nc1ccc(C[C@@H]2CC(=O)NC2=O)cc1	764223904	MWRUDBXRHBNESM-QGZVFWFLSA-N	436.468	1.001	50	20	IDGD	
O=C(NNC(=O)C1CCC1)C(=O)Nc1ccc(NC(=O)[C@H]2CCCO2)cc1C(F)(F)F	764341646	HFVWVKUEKHVJDN-CQSZACIVSA-N	442.394	1.709	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)CSc2nnc(-c3ccncc3)n2Cc2ccco2)cn1	765467173	CMTSUMLCTNYYES-UHFFFAOYSA-N	438.473	1.268	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)CCn2cnc3sccc3c2=O)n[nH]1	765600847	NVIDJJOTRRVLFI-UHFFFAOYSA-N	438.469	1.708	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1cccc(CS(=O)(=O)C2CCCCC2)c1	766261427	YVNXHIQNFAWTER-UHFFFAOYSA-N	447.517	1.815	50	20	IDGD	
CC(C)(C)n1cc(C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)cn1	766660794	RPNMORCBBRMLTQ-UHFFFAOYSA-N	432.956	1.870	50	20	IDGD	
O=C(NNc1ncnc2ccsc12)c1ccc(S(=O)(=O)NC[C@H]2CCCO2)cc1	766674665	XLPLAOYAWYGNTG-CYBMUJFWSA-N	433.515	1.906	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(F)cc1C(=O)N(C)C	768234610	VZUVHTDOWAXAGF-UHFFFAOYSA-N	446.435	1.091	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)c2nccc3c(S(N)(=O)=O)cccc23)cc1F	768478910	PLUFDLFTWWSZIJ-UHFFFAOYSA-N	449.489	1.661	50	20	IDGD	
N#Cc1ccc(C(=O)NNS(=O)(=O)c2cc([N+](=O)[O-])ccc2Br)cc1	768506388	QRLYAMQRHXVWMM-UHFFFAOYSA-N	425.220	1.852	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)Nc1cc(Br)cn(C)c1=O	769239130	DCGFBXBJFUPYMD-UHFFFAOYSA-N	445.295	1.709	50	20	IDGD	
Cc1c(C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)nnn1Cc1ccc(F)cc1	769546145	HSMYUOXGCMJHHJ-UHFFFAOYSA-N	436.403	1.264	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)c2nnn(Cc3ccc(F)cc3)c2C)c1	769550271	BHAFAWIEOBWRBH-UHFFFAOYSA-N	425.420	1.700	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCc1nnnn1CC1CC1	770324316	LMAAMAAWPWGJPQ-SNVBAGLBSA-N	438.286	1.144	50	20	IDGD	
CNS(=O)(=O)c1ccc(C)c(C(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)c1	772966894	LKGCXFDFQARXIV-GFCCVEGCSA-N	425.894	1.785	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)C(=O)Nc2ccc(S(=O)(=O)N3CCCCCC3)cc2)n1	773482386	XWUVVGSCGKWGPN-UHFFFAOYSA-N	446.533	1.740	50	20	IDGD	
COc1cc(C)c(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)cc1C	773641832	ZZSWLBZBLFRMJW-UHFFFAOYSA-N	435.506	1.476	50	20	IDGD	
COC(=O)CNC(=O)c1ccc(NC(=O)C(=O)NNc2ccc(C(F)(F)F)cc2)cc1	773769396	TZDPOGWRABLRCO-UHFFFAOYSA-N	438.362	1.690	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1CC(=O)O	774619324	TVJJVNBXRMHTPJ-UHFFFAOYSA-N	430.442	1.131	50	20	IDGD	
Cc1nc(N2CCOCC2)nc(O)c1CCC(=O)NNc1ccc(C(F)(F)F)cn1	775256776	OUMFZTCZOOGANN-UHFFFAOYSA-N	426.399	1.817	50	20	IDGD	
COc1cc(C)nc(NNC(=O)[C@H]2CC(C)C[C@@H]2C(=O)NNc2nc(C)cc(OC)n2)n1	775867798	OQJULLVOAFCOLH-KBPBESRZSA-N	444.496	1.149	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)N[C@@H]2CCO[C@]3(CCS(=O)(=O)C3)C2)c1C	776004653	UFECBXATSCYZPJ-BZXOFEEUSA-N	435.546	1.511	50	20	IDGD	
CO[C@@H]1[C@H](C)[C@@H](NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)C1(C)C	776067319	QPIJVGQCDPNGLS-KBRIMQKVSA-N	426.539	1.005	50	20	IDGD	
COC(=O)N1CCC([C@H](C)NC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)CC1	776922777	VFGGCDFEYVZLQK-LBPRGKRZSA-N	441.510	1.293	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc(Br)c(Cl)c(C(=O)O)c1)c1cnccn1	777600665	LGDNHTJDPOSLHS-UHFFFAOYSA-N	435.643	1.214	50	20	IDGD	
O=C([C@@H]1CCCN(Cc2ccccc2)C1)N1CCN(S(=O)(=O)CBr)CC1	777780218	YJODCZQLGLPGMN-QGZVFWFLSA-N	444.395	1.725	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(\C#N)C(=O)NNC(=O)CNC(=O)OC(C)(C)C)c1C	778437215	ZETLZQUXTPWBIB-VEJKBTLKSA-N	433.509	1.891	50	20	IDGD	
C[C@H]1CCN(C(=O)OC(C)(C)C)[C@@H](C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)C1	778835688	KEQHWWGZOVZLFV-UONOGXRCSA-N	443.545	1.877	50	20	IDGD	
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	779387616	OKTAUIKAFDWTFH-ZDUSSCGKSA-N	432.481	1.825	50	20	IDGD	
CCc1cnccc1CNC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	779408074	POFHEPQYSRTOHE-UHFFFAOYSA-N	431.518	1.573	50	20	IDGD	
COc1cccc(NNC(=O)Nc2cc(S(=O)(=O)N3CCOCC3)ccc2OC)n1	780453965	XCCLWGQPXBVYBE-UHFFFAOYSA-N	437.478	1.268	50	20	IDGD	
C[C@@](O)(CC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)c1ccccc1	780849886	QSHWHSCHUPPVJK-OAQYLSRUSA-N	431.514	1.530	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN[C@@H](CO)c2ccc(Br)cc2)n1	782075552	MBQPZUHBRVUOQR-ZDUSSCGKSA-N	427.324	1.227	50	20	IDGD	
CC(=O)N1CCN(Cc2cccc(NC(=O)C(=O)NNc3ccccc3[N+](=O)[O-])c2)CC1	782124121	NEUVHHDXJAGTCY-UHFFFAOYSA-N	440.460	1.341	50	20	IDGD	
CCOC(=O)c1cc2cc(NC(=O)C(=O)NN[C@@]3(C)CCS(=O)(=O)C3)ccc2s1	783426890	PBEHRSWUNDMVCD-SFHVURJKSA-N	439.515	1.215	50	20	IDGD	
CCN(CC)C(=O)COc1ccc(NC(=O)C(=O)NNc2cc(C)ncn2)cc1Cl	783949084	ZVZLXJCSZPQMJT-UHFFFAOYSA-N	434.884	1.767	50	20	IDGD	
Cc1c(C(C)(C)C)nn(-c2ccccc2)c1NC(=O)C(=O)NNC(=O)C(=O)N1CCCC1	784000109	WBDJBCZKVRURTE-UHFFFAOYSA-N	440.504	1.187	50	20	IDGD	
COc1ccc(C(C)(C)C)cc1NC(=O)C(=O)NNC(=O)CNC(=O)c1cccs1	784004608	HTRZVSCPGOTWCM-UHFFFAOYSA-N	432.502	1.570	50	20	IDGD	
O=C(NNC(=O)C1(Cc2ccc(OC(F)(F)F)cc2)CC1)N[C@@H]1CCS(=O)(=O)C1	784361144	UGTUVSXXGCFNBF-GFCCVEGCSA-N	435.424	1.425	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)C(C)C)cc1NC(=O)C(=O)NNc1ccc(Cl)nn1	784792355	QGHRTPGRDZBHHU-UHFFFAOYSA-N	440.913	1.549	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2cccc(C(F)(F)F)n2)cc1-n1nnnc1C	784952899	VEZNDSUBVQPURQ-UHFFFAOYSA-N	436.354	1.475	50	20	IDGD	
NS(=O)(=O)c1ccccc1NNC(=O)Cc1cccc(I)c1	788230782	XFSDFGAJPKRZIT-UHFFFAOYSA-N	431.255	1.624	50	20	IDGD	
CS(=O)(=O)c1cc(C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)cc([N+](=O)[O-])c1	788870383	DGDOBNRLKAGAHK-IRXDYDNUSA-N	433.442	1.332	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2cccc3c2OCC[C@H]3N(C)C)c1	789731377	DGWIWMOLBAKCPJ-GOSISDBHSA-N	442.472	1.489	50	20	IDGD	
CC(C)Oc1cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)ccc1C(N)=O	789740357	FRLVVUVBKSELLS-LBPRGKRZSA-N	446.435	1.265	50	20	IDGD	
CN(C)[C@H]1CCOc2c(NC(=O)C(=O)NNC(=O)CSc3ccccc3O)cccc21	789740579	WVCVVPXLAXKKKS-HNNXBMFYSA-N	444.513	1.656	50	20	IDGD	
O=C(NNC(=O)[C@H]1OCC[C@H]1c1ccccc1)C(=O)Nc1ccc(-c2csnn2)cc1	789811994	ICXBZIYEWAMODW-WMZOPIPTSA-N	437.481	1.864	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1cnn(-c2ccc(C)cc2)c1C(C)C	792267148	VYIKUKMCVXPNTN-HNNXBMFYSA-N	431.493	1.442	50	20	IDGD	
C[C@]1(C(N)=O)CCN(C(=O)NNC(=O)[C@H]2Cc3ccccc3CN2Cc2ccccc2)C1	792879440	KJYZIGKASRPBGI-YKSBVNFPSA-N	435.528	1.552	50	20	IDGD	
Cc1cc(C)c(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)cc1C=O	793711178	XKHUJONEKCSDNL-UHFFFAOYSA-N	430.530	1.809	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C2CCN(C3=NS(=O)(=O)c4ccccc43)CC2)n1	794074530	BVKQIAGLHPKHKR-UHFFFAOYSA-N	427.486	1.012	50	20	IDGD	
Cn1c(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc2ccccc2c1=O	794750756	HEOKHRHXKHAVRR-UHFFFAOYSA-N	433.512	1.512	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(C(=O)NNc2ccccc2S(=O)(=O)N(C)C)ccc1F	795169343	NPPILUXKFSBGTN-UHFFFAOYSA-N	444.510	1.083	50	20	IDGD	
Cc1ccc2c(c1)CC[C@@H](C(=O)OCC(=O)NNC(=O)[C@H]1COc3ccccc3O1)O2	796298656	JSMFYXFSESVWQD-RBUKOAKNSA-N	426.425	1.219	50	20	IDGD	
O=C(CN1CCN([C@@H]2CCN(Cc3ccccc3)C2)CC1)NNC(=O)c1ccc(F)cc1	796384263	NMFNEGHPAYCNTJ-JOCHJYFZSA-N	439.535	1.479	50	20	IDGD	
C[C@H](CNC(=O)OC(C)(C)C)C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	796839000	GDTXTOUWLPBUCC-CQSZACIVSA-N	442.538	1.311	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNC(=O)CNC(=O)OCc2ccccc2)cc1Cl	797368605	FISVOMTVDKGFAV-UHFFFAOYSA-N	448.863	1.751	50	20	IDGD	
Cc1ccc(N2CCOCC2)cc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccccc1F	797534601	AWBVPNXFRMHKCG-OAHLLOKOSA-N	444.463	1.524	50	20	IDGD	
Cc1c(C(=O)NNC(=O)COc2ccc(C#N)cc2)nnn1CCOc1ccc(F)cc1	800313383	CMTRCHLXFFZSHY-UHFFFAOYSA-N	438.419	1.516	50	20	IDGD	
Cn1cc(Oc2ccccc2C(=O)NNC(=O)c2csc(N3CCOCC3)n2)cn1	801104476	OSRNYGQPKHOSSG-UHFFFAOYSA-N	428.474	1.580	50	20	IDGD	
CC(C)(C)OC(=O)c1cnc(C(=O)NNC(=O)CNC(=O)OCc2ccccc2)cn1	801705453	QGEUDQPIIFDYHJ-UHFFFAOYSA-N	429.433	1.119	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)c2cn3ccc(Br)cc3n2)c1	803943096	QSGIZQCBMAMKKT-UHFFFAOYSA-N	442.229	1.586	50	20	IDGD	
Cc1ccc([C@H](CNC(=O)NNC(=O)c2c(C)nc3ccccn23)N2CCOCC2)o1	807023365	KMXQBAFZZGLTFJ-INIZCTEOSA-N	426.477	1.562	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)c1c(O)cnc2c(Br)cccc12	810307764	IIPHUVUTFWDULQ-UHFFFAOYSA-N	433.218	1.487	50	20	IDGD	
COC(=O)c1c(F)ccc(NC(=O)C(=O)NNC(=O)CSc2ccc(C)cc2)c1F	810386047	KBPILAUTWHLTFQ-UHFFFAOYSA-N	437.424	1.938	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)CCC(=O)N2CCOc3ccccc32)cc1	812729469	PZLRLXKESXVYLL-UHFFFAOYSA-N	432.502	1.586	50	20	IDGD	
O=C(NNC(=O)[C@H]1OCC[C@H]1c1ccccc1)C(=O)Nc1ncc(C(F)(F)F)s1	812992210	XIHBXXWJFMXSGL-JQWIXIFHSA-N	428.392	1.821	50	20	IDGD	
CCCc1nnc(SCC(=O)NNC(=O)c2cc(OC)ccc2Br)n1N	813439395	RXFQERXYYWAXPK-UHFFFAOYSA-N	443.327	1.269	50	20	IDGD	
CCOc1ccc(NNC(=O)C(=O)Nc2ccc(N3CCNC(=O)C3)c(Cl)c2)cc1	815815680	MQABVGNMPBYOHO-UHFFFAOYSA-N	431.880	1.757	50	20	IDGD	
COC(=O)c1ccc(C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)n1C	815827967	WKOHEUDNUXWQCT-UHFFFAOYSA-N	447.923	1.044	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)[C@H]1CCCN(c2ccccc2)C1=O	815933892	FKPPSWLQAFCJLB-QGZVFWFLSA-N	428.876	1.547	50	20	IDGD	
C[C@H](C(=O)N1CCN(S(=O)(=O)CBr)CC1)[C@H]1OCCc2sccc21	815964993	ZBTLLKLLFPIXKB-SMDDNHRTSA-N	437.381	1.824	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2cc(C(=O)NNc3cnnn3C)ccc2Cl)C[C@H](C)O1	816771763	ZTTVOHSWIHLWDR-QWRGUYRKSA-N	428.902	1.023	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)[C@H]1CCCN1C(=O)Cc1ccccc1	817053226	JIQIIJABGIGJNF-GOSISDBHSA-N	430.530	1.614	50	20	IDGD	
O=C(NCCCN1CCc2ccccc21)NNC(=O)c1csc(N2CCOCC2)n1	913463117	MBTUJIKCSFXSKR-UHFFFAOYSA-N	430.534	1.377	50	20	IDGD	
CCn1c(=O)nc(O)c2c(C(=O)NNC(=O)c3ccc4c(c3)OCO4)cc(C3CC3)nc21	914110009	XWPVFCBGFIXNKN-UHFFFAOYSA-N	437.412	1.198	50	20	IDGD	
CC(C)NC(=O)C(=O)NNC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S	914442756	KJBYDNWLYADQLI-FMIVXFBMSA-N	440.572	1.402	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Cc2ccc(S(N)(=O)=O)s2)ccc1OC(C)C	915188932	ITAWFQDGYMJCHP-UHFFFAOYSA-N	427.504	1.195	50	20	IDGD	
CNS(=O)(=O)c1ccc(CNC(=O)NNC(=O)Cc2ccc3ccccc3c2)s1	916232037	FNFAQSVINIZIBY-UHFFFAOYSA-N	432.527	1.883	50	20	IDGD	
O=C(NN=Cc1ccc(O)c([N+](=O)[O-])c1)c1cccc(S(=O)(=O)N2CCOCC2)c1	916257966	HVAZSHWPUCIFCP-UHFFFAOYSA-N	434.430	1.085	50	20	IDGD	
Cc1cc(C)n(-c2ccc(CNC(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)cn2)n1	916419364	GWUCAKMZKLPAKT-UHFFFAOYSA-N	446.471	1.275	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)NCCCN1CCN(c2ccccc2)CC1	916489818	PSPUGNAMEYTQDI-UHFFFAOYSA-N	435.532	1.799	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)CN(C)C(=O)[C@H](C)n1cccn1	917496107	MYVSRQWUMSBEPB-AWEZNQCLSA-N	426.502	1.796	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(Br)c(C(=O)O)c1)c1ccc(Cl)nc1	917747492	SCPZLGFPYQBMAG-UHFFFAOYSA-N	434.655	1.819	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C2CCN(S(=O)(=O)c3ccccc3F)CC2)c(O)c1	918338772	MDTKGTDQEHOYLH-UHFFFAOYSA-N	435.477	1.702	50	20	IDGD	
Cc1nn(C)c(C(=O)NNC(=O)[C@@H](C)Oc2cccc(Br)c2)c1[N+](=O)[O-]	918759350	VNUJDBCDBMLBMZ-SECBINFHSA-N	426.227	1.628	50	20	IDGD	
CCC[C@@H](C)N1C[C@H](C(=O)OCC(=O)NNC(=O)c2cc(Cl)ccc2OC)CC1=O	919586910	ZYBMRSUJLVVUFV-CHWSQXEVSA-N	439.896	1.690	50	20	IDGD	
Cc1cccc(N2CCN(S(=O)(=O)CC(=O)NNC(=O)c3ccccc3C)CC2)c1	919810551	LBZLJXXVACQAMA-UHFFFAOYSA-N	430.530	1.216	50	20	IDGD	
CC(C)CCSCC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	919880209	CKLNKIOILZBACD-UHFFFAOYSA-N	429.564	1.248	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@H](C)CN2C[C@@H](C)C[C@@H](C)C2)c2ccccc2c1=O	919924586	OMUCUYZLUITPFA-OWCLPIDISA-N	428.537	1.727	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)c3nc(S(C)(=O)=O)n4ccccc34)cc2C1	920274915	HTYKZIVAHQYGFN-NSHDSACASA-N	432.527	1.999	50	20	IDGD	
CCOc1ccc(CCC(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1	920411706	BYZKERRFKHZZER-LJQANCHMSA-N	428.441	1.549	50	20	IDGD	
CCOC(=O)C1(CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)CCCC1	1121711946	GKGNAKDWMCCNFS-UHFFFAOYSA-N	425.511	1.047	50	20	IDGD	
CNC(=O)c1ccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c(C)c1	1254704021	IZZLLHSVXCSFJW-UHFFFAOYSA-N	433.490	1.071	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)C3CCN(C(=O)c4ccc(F)cc4F)CC3)nc21	1322738561	MKUZDNZBOBTBAM-UHFFFAOYSA-N	431.403	1.343	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(C)c(C(=O)NNc2cncc(Br)c2)c1	1323080575	WCFVVBOSLRXDJW-UHFFFAOYSA-N	443.323	1.834	50	20	IDGD	
O=C(NC[C@@H](N1CCOCC1)C(F)(F)F)NNC(=O)c1ccc(Br)cc1	1323400047	RPAKMAZTRMKANC-GFCCVEGCSA-N	439.232	1.656	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2cncn2-c2ccccc2)cc(F)c1F	1323738742	MEHHKMJHGWSTSV-UHFFFAOYSA-N	436.396	1.560	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)Cn2cc(C(F)(F)F)ccc2=O)C1	1350948555	WEZYBINTDSOJKD-LBPRGKRZSA-N	446.426	1.662	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)CCc3ccc(OC)cc3F)C2)C1	1778286559	BYLXHKDKBTXMJR-UTKZUKDTSA-N	442.915	1.851	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@]2(C1)CN(C(=O)c1n[nH]c3ccc(C#N)cc13)CCO2	1779298655	HLAMLBOYPBPGDA-NRFANRHFSA-N	441.564	1.730	50	20	IDGD	
O=C(c1n[nH]c2cccc(F)c12)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781332429	HNOKLMBQWYYNSF-PBHICJAKSA-N	443.248	1.836	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cccc(NC(=O)OC)c3)C2)C1	1781443490	BHUYFNNWZQPJSQ-JXFKEZNVSA-N	439.896	1.562	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3c(F)cc(OC)cc3F)C2)C1	1781709762	LACUINNGLDZUDJ-DJJJIMSYSA-N	432.851	1.671	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C=N/N1CCCCC1)C2	1781997605	DQPYFCMODBFBGC-OSSLJJSHSA-N	443.386	1.755	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnn3c1OCCC3)C2	1782178011	CZPIPOUDYPMDSJ-JXXFODFXSA-N	440.928	1.047	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3nc4cc([N+](=O)[O-])ccc4[nH]3)C2)C1	1782187317	YULPVHFPBQEYLU-BFUOFWGJSA-N	435.868	1.932	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)CNC(=O)c3ccco3)CCO2)C1	1783343635	WDMDVFNUIWHKJQ-ACJLOTCBSA-N	442.310	1.013	50	20	IDGD	
COc1ncccc1CCC(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](C)Br)C2)C1	1783532585	PWCIFMNOHVDSLJ-KUHUBIRLSA-N	440.338	1.636	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cn(C(C)(C)C)nn3)CCO2)C1	1783537234	MYXDUDCXPXAQNS-SJKOYZFVSA-N	428.331	1.260	50	20	IDGD	
Cc1noc(C)c1CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]2C1	1783970239	UDGVFGNCYBQXCV-UMPQAUOISA-N	442.354	1.845	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H]3CCc4nc[nH]c4C3)C2)C1	1784353052	SJDWSQPWYODPJH-NJSLBKSFSA-N	439.354	1.518	50	20	IDGD	
CC(=O)Nc1ccccc1C(=O)N1CC[C@]2(CN(C(=O)CCBr)CCO2)C1	1785098815	QAUIWHJQCWAUCJ-IBGZPJMESA-N	438.322	1.874	50	20	IDGD	
C[C@H](Cn1cccn1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCBr)[C@H]2C1	1786401173	RKVSKOXIAALBSS-UGUYLWEFSA-N	427.343	1.284	50	20	IDGD	
N[C@@H](C(=O)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1)c1ccccn1	1788040710	QYIXXLDIVVGFJM-OAQYLSRUSA-N	444.300	1.209	50	20	IDGD	
Cc1nc(CC(=O)NC2(c3ccc(NC(=O)c4cccc(B(O)O)c4)cc3)CCC2)no1	1788145230	TWLOSIMRZOHEIO-UHFFFAOYSA-N	434.261	1.048	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)c3ncccc3F)CCC2)cc1)c1cccc(B(O)O)c1	1788148042	XZUFEUXMAYAHOJ-UHFFFAOYSA-N	433.248	1.962	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)COC(=O)C(F)(F)F)[C@H]2C1	1788530583	FXKVWOBLLLSMEG-VEABSNGSSA-N	449.253	1.308	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nc[nH]n3)C[C@@H]21	1790694501	WSYOLNWKTDZNKJ-MJKMTRRRSA-N	442.426	1.283	50	20	IDGD	
COC(=O)c1ccc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]3C2)cc1	1791298430	PVUHXZRFBDNGIR-JYJNAYRXSA-N	443.327	1.799	50	20	IDGD	
C[C@@H](Oc1ccccn1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21	1791618658	KTSKPFKQXXUESW-UGUYLWEFSA-N	440.338	1.614	50	20	IDGD	
C[C@H]1CCc2c(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@@H](C)CBr)n[nH]c21	1792867883	JQPKFEPEBYNHDP-BLXSCJOCSA-N	439.354	1.694	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCCc1ccccc1F	1792952046	XMLNNANVYJEQCV-AXVVYFOYSA-N	426.916	1.992	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCl)[C@H]1CC(=O)N(Cc2cccs2)C1	1793110552	KVKHLNOCVHEFSX-JBXGNFEISA-N	439.965	1.335	50	20	IDGD	
CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2)C(=O)c1ccccc1	1793229971	PIEOEXDWTJHUTA-MIFYACCESA-N	428.316	1.152	50	20	IDGD	
Cc1ncc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)/C(C#N)=C/c2ccc(F)cc2F)C3)[nH]1	1793538911	KNDNGNWGMXZTIQ-QYFXKUKHSA-N	441.438	1.807	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnsn1	1794383336	FNZMUFNFXRKOTD-XSDCOXNMSA-N	445.451	1.627	50	20	IDGD	
Cn1nncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C(C#N)=C/c1ccc(F)cc1F)C2	1794520674	HLXDJGVKABWUGG-RMWXTBGQSA-N	426.427	1.952	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)[C@H]1[C@H]2c3ccccc3S[C@H]21	1796191451	OASZBUWTRLLVPY-AZNOEYCNSA-N	448.353	1.506	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](N)Cc1cscn1	1796744098	DIIQACMJMDLDSZ-NXRJPMIISA-N	429.384	1.682	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cn2cc(Cl)ccc2n1	1796850235	AUBXLGARVLBJPQ-DMVWFOPNSA-N	441.315	1.445	50	20	IDGD	
C[C@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@](C)(Cl)CCl)C2)[C@@H]1SC(=N)NC1=O	1796881155	ZIFJLSDWHABODS-CTZDEMLISA-N	435.377	1.663	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccn2cncc2c1	1797501446	GOWSJQZDYRTUMX-JJAZEVLHSA-N	435.322	1.569	50	20	IDGD	
Cc1c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CO[Si](C)(C)C)ccc2c1OCCO2	1797955011	YOVYDVQVCWPMTD-CWPLJXCYSA-N	448.592	1.821	50	20	IDGD	
N#Cc1cccc(CCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)c1	1798439671	VOTPKJCSVFANIK-REPLKXPHSA-N	446.511	1.441	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc3c[nH]nc3c1)C2	1798440501	YANLDBCFNXYGDT-MUJYYYPQSA-N	433.472	1.127	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1=C2c3ccccc3C(=O)N2CC1	1798451023	DPCGEJCXEAWIPL-FTUNRGFVSA-N	443.931	1.864	50	20	IDGD	
CNCCCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C#N)=C/c1ccc(F)cc1F	1800333236	WZRWCKPKNWNXAT-JFABSOQWSA-N	432.471	1.461	50	20	IDGD	
C[C@H](Nc1cccnc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)Br	1800756959	RYSRMVNEUCYNJE-YMSVYLFOSA-N	425.327	1.255	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Oc1ccccn1)C2	1800762917	KIPNCAALFKOODS-QKDZRIPBSA-N	426.311	1.222	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c(C)nc3ccc(F)cn13)C2	1800979631	SDVAVWWXGLLYGM-YXPYIKCWSA-N	438.887	1.239	50	20	IDGD	
COc1cccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Br)C3)c1C	1801650791	GCQNLRJWFAZWIX-NOXHYTERSA-N	429.286	1.897	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CCc2ccccc2O1	1802234987	OUNHBCSMHWLBGC-DLRJPAPCSA-N	449.511	1.331	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cnnc3ccccc23)[C@@H]1c1cccnc1)[C@H](O)CCl	1803139750	VHQVIQJXRITNDM-CWFSZBLJSA-N	439.903	1.944	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CS[C@@H]2CCCCO2)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803142739	HKYVBJQLYZZZOA-RNIPGJKVSA-N	441.981	1.947	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc3nccnc3c2)[C@H]1c1cccnc1)[C@H](O)CCl	1803142912	MSLKSCXBGBKPMB-DBVUQKKJSA-N	439.903	1.944	50	20	IDGD	
Cc1cccc(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)n1	1807369091	AIRKAANEFCOHGG-DENIHFKCSA-N	444.300	1.098	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC2(CCCN(C(=O)[C@@H](CN)c3ccccc3)C2)CC1	1809882322	SJPZOWMBJKDZQQ-FQEVSTJZSA-N	443.592	1.333	50	20	IDGD	
CC(C)N[C@H](C(=O)N1CCCC2(CCN(C(=O)c3ccc(B(O)O)cc3)CC2)C1)C(C)C	1809941144	BSZAQDUAZGANIQ-NRFANRHFSA-N	443.397	1.234	50	20	IDGD	
C#CC(=O)N1CC[C@H](CNC(=O)c2cc([N+](=O)[O-])ccc2OC(C)=O)[C@@H]1c1cccnc1	1811358838	KUHQBBOOTWQMEW-IERDGZPVSA-N	436.424	1.868	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@H](CNC(=O)c2c[nH]c(=O)cn2)[C@H]1c1cccnc1	1811453706	LSMLDQGGZGDROT-CRFBAAHOSA-N	438.315	1.721	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2c3c(nn2C)CCC3)[C@@H]1c1cccnc1	1813034789	XTQOKWWBENUJTP-HHXXYDBFSA-N	445.951	1.877	50	20	IDGD	
COCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)CC2	1813753377	PCRCEYWMADPLOX-LLVKDONJSA-N	448.457	1.849	50	20	IDGD	
O=C(CN1C(=O)CSC1=S)NC[C@@H]1CCN(C(=O)[C@H](F)Cl)[C@H]1c1cccnc1	1814189140	MMSHBTNOEKMCHT-CQDKDKBSSA-N	444.941	1.482	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@H]1CCc2nc(NC(=O)CN3CCOCC3)sc2C1	1814568717	DZAQACIBQLUHRL-GTNSWQLSSA-N	435.377	1.624	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CN2C(=O)CNC2=O)n[nH]1	1815599833	SYCAKELBNPOECM-GTNSWQLSSA-N	445.307	1.190	50	20	IDGD	
Cc1ncccc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1	1817471383	XLNLRRLOMFDEEU-LJQANCHMSA-N	433.277	1.413	50	20	IDGD	
Nc1n[nH]c(CCC(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@@H](F)Br)CC3)n1	1819559600	AXBRPKIVTXWEJS-UPONEAKYSA-N	446.306	1.079	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)C2(F)CCC2)n[nH]1	1823076980	NZRASVVLPIEKPG-HNNXBMFYSA-N	429.456	1.606	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)[C@H]1CCCSC1	1823452376	GCUFBVRFAWSEDC-MAUKXSAKSA-N	442.350	1.539	50	20	IDGD	
COC(=O)c1ccc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)[C@@H](O)CCl)CC2)cn1	1824182517	FFYNRVCEIYLAIR-ROUUACIJSA-N	437.924	1.701	50	20	IDGD	
CCn1nccc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1	1826097789	NXUFPHLJMSOPRJ-FQEVSTJZSA-N	438.337	1.130	50	20	IDGD	
CSCC[C@H](O)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](C)Br)CC2	1826136145	VPOLQBSAOUPSNP-NGZCFLSTSA-N	436.397	1.953	50	20	IDGD	
C[C@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1)c1ccccn1	1827055246	SOZADORUJZUSQX-MBSDFSHPSA-N	449.360	1.798	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](N)Cc2cscn2)CC1	1827549841	KCOUIQHCMFOKBF-SQNIBIBYSA-N	443.013	1.886	50	20	IDGD	
C[C@@H](Cn1ccnc1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830370798	YPAYXTQSJFAVKR-OXJNMPFZSA-N	426.945	1.241	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)CNC(C)=O)C2)C1	1831640562	NRKABEKCIVLTST-JXFKEZNVSA-N	431.961	1.013	50	20	IDGD	
CSCC[C@H](O)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1	1831898150	KGNAZNCCQQGQMA-ROUUACIJSA-N	442.626	1.093	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)CC[C@@H]2CCOC2)CC1	1832452810	NBXAWMXRJILIFQ-XMSQKQJNSA-N	442.365	1.416	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(F)s3)CCO2)C1	1833218268	ASECJRZBVPZKJJ-ZBEGNZNMSA-N	435.315	1.741	50	20	IDGD	
N#Cc1ccc(F)c(C(=O)N2CCC(N3CCC(NC(=O)[C@@H](O)CCl)CC3)CC2)c1	1833311623	ACZYNHPVTZTEQX-IBGZPJMESA-N	436.915	1.482	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccnc3)CCO2)C1	1834009900	NQQLDSARTJRDMJ-QAPCUYQASA-N	426.311	1.325	50	20	IDGD	
O=C(CCBr)NC1CCN(C2CCN(C(=O)c3ccc[n+]([O-])c3)CC2)CC1	1834422509	RCUOIDBDVHFANM-UHFFFAOYSA-N	439.354	1.290	50	20	IDGD	
Cc1onc(C(=O)N2CCOC[C@]3(CN(C(=O)CCBr)CCO3)C2)c1C	1834819470	ONGCDTGLCKCXKH-KRWDZBQOSA-N	430.299	1.146	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)c3ccc(F)nc3)C2)C1	1834823361	PZTJYIWWFJVIPC-KRWDZBQOSA-N	430.274	1.076	50	20	IDGD	
O=C(Cc1ccccc1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1834997466	CPDLIXMNVIKFBJ-AEFFLSMTSA-N	429.286	1.376	50	20	IDGD	
O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)Cc1cccs1)CCO2	1836088040	ZVCAUCZANIGMSV-QGZVFWFLSA-N	431.352	1.532	50	20	IDGD	
Cc1nn(C)c(C(=O)N2CCC(OC3CCN(C(=O)[C@H](O)CCl)CC3)CC2)c1F	1836715130	JWHHYLVJKCPNCR-OAHLLOKOSA-N	430.908	1.080	50	20	IDGD	
C[C@H](Nc1cccnc1)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836716557	BLPGNPQKTVDXKO-KXBFYZLASA-N	438.956	1.480	50	20	IDGD	
O=C([C@@H](O)CCl)N1CCC(OC2CCN(C(=O)[C@H]3Cc4ccccc4O3)CC2)CC1	1836717406	WIXOMQXGZCPKRC-AZUAARDMSA-N	436.936	1.588	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)CCNC(=S)NC)CC2)CC1	1836922446	KKOPSBNVNNGUBX-KRWDZBQOSA-N	447.045	1.877	50	20	IDGD	
CC[C@@H](C(=O)N1CCOC[C@@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1)N(CC)CC	1837710155	LNMKUTVNQRTQMN-GHTZIAJQSA-N	443.661	1.415	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3c(C)nc4ccccn34)C2)C1	1839144447	ACJZHGZMYOPNDC-KKSFZXQISA-N	434.924	1.730	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3C[C@H]4CC[C@@H]3O4)C2)C1	1839155159	LSNXOBAWPJKKIZ-QGRWZNMESA-N	435.348	1.247	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)nc1	1839198057	RLNDSIWHYOXMPJ-RHSMWYFYSA-N	430.274	1.151	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(C4CC4)cc3)CCO2)C1	1839441457	VRXSBCGCJJBHAC-UGKGYDQZSA-N	436.936	1.888	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C=C/c3cccnc3)C2)C1	1840030997	BYXUEVUHZWWXEC-FKXXJOMMSA-N	438.322	1.335	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(F)ccc3F)C2)C1	1840034166	BVXRJRKSODFMNO-XIKOKIGWSA-N	447.276	1.818	50	20	IDGD	
Cc1cc(C)cc(CCC(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)c1	1840304662	KSOBRTNFAPOAHE-DENIHFKCSA-N	438.952	1.292	50	20	IDGD	
C[C@@H](Cc1ccco1)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCBr)C2)C1	1840468818	QLBPVSJZUIUHIL-HNAYVOBHSA-N	443.338	1.700	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3c[nH]c4ncccc34)CCO2)C1	1840870519	NHFAILKWAWQNHX-AVRDEDQJSA-N	448.951	1.969	50	20	IDGD	
CN1N=C(C(=O)N2CCCC23CN(C(=O)/C(C#N)=C/c2ccc(F)cc2F)C3)CCC1=O	1841864954	BVIJHLBCZRPYQO-OQLLNIDSSA-N	441.438	1.683	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2cc(C)n(C(F)F)n2)C1	1844784361	RJVAURKWYADGHY-ZMOGYAJESA-N	447.446	1.538	50	20	IDGD	
COCCOCCOCCOCCC(=O)N1CCCC12CN(C(=O)C(Cl)Cl)C2	1845246308	DQEXNRDRMKQDOY-UHFFFAOYSA-N	441.352	1.080	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc(Cl)ccc1F	1847385294	HTVUYQWEFBZLEB-IRXDYDNUSA-N	431.855	1.607	50	20	IDGD	
O=C(c1n[nH]c2ccc(Br)cc12)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl	1847560638	YLTZFJOYZYQQMX-MELADBBJSA-N	441.713	1.741	50	20	IDGD	
CC(C)(C)OC(=O)N1CC2(C[C@@H]2C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](O)CCl)C1	1847563990	SXHSYGISHOQRHA-CBBWQLFWSA-N	427.929	1.045	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)cc1[N+](=O)[O-]	16148379	MLVZGUWNVATXGV-UHFFFAOYSA-N	441.418	1.253	50	20	IDGD	
Cc1nn(-c2ccccc2)c(C)c1CC(=O)NNC(=O)c1csc(N2CCOCC2)n1	20910848	BZZCDASSAKXSCQ-UHFFFAOYSA-N	440.529	1.786	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@H]2CC(=O)N(c3ccc(C)c(F)c3)C2)cc(OC)c1OC	26356023	COEDOSIQQAIIIK-AWEZNQCLSA-N	445.447	1.974	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)[C@H]1CC(=O)N(Cc2ccccc2Cl)C1	26692469	JYSLUCNWYFBQBQ-KBXCAEBGSA-N	429.860	1.676	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)CCn1cnc2c(C)cccc2c1=O	26792071	PYKCMWBXXYODSK-UHFFFAOYSA-N	432.484	1.855	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	28959770	AWUWZYHJTKEPGL-UHFFFAOYSA-N	430.892	1.568	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cc(-c3cccs3)on2)cc1	138357149	DZZHAZIXWDTKKI-UHFFFAOYSA-N	434.499	1.793	50	20	IDGD	
Cc1csc([C@@](O)(CC(=O)NNC(=O)CNC(=O)c2cccs2)C(F)(F)F)n1	725739910	ORPIDHBVXLNCPI-AWEZNQCLSA-N	436.437	1.230	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)c1csc(-c2ccc(O)cc2)n1	726382615	XMRFDSFYFPRQGI-UHFFFAOYSA-N	431.499	1.884	50	20	IDGD	
CN1CCN(C(C)(C)CNC(=O)NNC(=O)c2cc(F)ccc2Br)CC1	728742555	IVJSKZHFTMIBJD-UHFFFAOYSA-N	430.322	1.558	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)Cc2c(C)[nH]c3ccnn3c2=O)c1	729371106	HIDRLANHBDWRFG-UHFFFAOYSA-N	434.250	1.106	50	20	IDGD	
C[C@@H]1CC(C)(C)C[C@@]2(C1)NC(=O)N(CC(=O)NNC(=O)CCc1ccccc1O)C2=O	730033962	HHEWWKUJHDIZEM-JLCFBVMHSA-N	430.505	1.609	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=O)CCc2ccccc2O)c1	730034164	XOSDVFRTVKLDPD-UHFFFAOYSA-N	425.894	1.690	50	20	IDGD	
Cn1ccnc1[C@@](O)(CCNC(=O)NNC(=O)c1cccc2ncccc12)C(F)(F)F	730114221	FBAFARYOJRLMTD-SFHVURJKSA-N	436.394	1.753	50	20	IDGD	
Cn1nc(SCC(=O)NN=Cc2ccc(-c3ccc(Cl)cc3)o2)c(=O)n(C)c1=O	730569151	QGYWRSRUCFFPSX-UHFFFAOYSA-N	433.877	1.635	50	20	IDGD	
O=C(CNC(=O)c1c(Cl)cccc1[N+](=O)[O-])NNC(=O)c1cc(-c2ccccc2)[nH]n1	731050023	AZKRWSVQMXARNF-UHFFFAOYSA-N	442.819	1.829	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(C)(C)c2ccccc2)cc1S(=O)(=O)NC1CC1	731201026	DXNDZEALXPUURQ-UHFFFAOYSA-N	431.514	1.875	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)[C@H]1CCCN(S(=O)(=O)Cc2ccccc2)C1	731491133	FVZRPOPIMTZKLU-KRWDZBQOSA-N	431.514	1.698	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)[C@H](c1ccccc1)N1CCN(C)CC1	732053445	BQKRGAVCFIABFI-QHCPKHFHSA-N	434.544	1.735	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)CCC/N=C1/NS(=O)(=O)c2ccccc21	732303951	ONKMXCVDNCZJCY-UHFFFAOYSA-N	436.515	1.052	50	20	IDGD	
O=C(COC(=O)c1ccn(-c2ccc(F)cc2)n1)NNC(=O)c1cccc([N+](=O)[O-])c1	732327117	FCYJEIOJKZEPOD-UHFFFAOYSA-N	427.348	1.538	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)/C(=C\c1ccco1)NC(=O)c1ccccc1	732957609	SMCSDOPYNPWJDW-FOWTUZBSSA-N	438.465	1.689	50	20	IDGD	
Cc1cccc(-n2c(NNC(=O)CC[C@@H]3NC(=O)NC3=O)nc3ccccc3c2=O)c1C	733264338	JHWGMEDYBJQYOQ-INIZCTEOSA-N	434.456	1.434	50	20	IDGD	
CS(=O)(=O)NC1(CNC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)CCCCC1	733641901	QUJDGDQFTWZOCJ-UHFFFAOYSA-N	434.522	1.068	50	20	IDGD	
Cn1c(=O)nc(O)c2nc(CCC(=O)NNc3ccc(Br)cc3Cl)[nH]c21	733807825	MMHCNBXMQHDOJC-UHFFFAOYSA-N	441.673	1.854	50	20	IDGD	
N#C/C(=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)NCCn1cccn1	734124171	XEWVMHVNODVIAL-FOWTUZBSSA-N	437.891	1.999	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)Nc2ncn(CC(=O)NCc3ccccc3)n2)cc(C#N)n1C	734126192	ZKKKOQOTWQSVNG-LSCVHKIXSA-N	428.456	1.659	50	20	IDGD	
O=P(CCN[C@@H]1CS(=O)(=O)C[C@@H]1N1CCOCC1)(c1ccccc1)c1ccccc1	734837404	IAYRBGNQVWXUFM-YADHBBJMSA-N	448.525	1.088	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2cccc(OC(F)F)c2)CC1	735118685	XUEPCQXWDSOFIX-UHFFFAOYSA-N	441.460	1.376	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc2c(c1)nc(CCC(=O)NNc1cccnn1)n2C	736704257	RDTAZISEAYNZQI-UHFFFAOYSA-N	431.522	1.470	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2cc(N3CCNC3=O)ccc2F)c2ccccc2c1=O	737766557	QUWMESGLFPSPAA-UHFFFAOYSA-N	438.419	1.160	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)c1ccc(S(=O)(=O)N=c2cc[nH]cc2)cc1	737926475	JPLDLIJMAGYJLI-UHFFFAOYSA-N	440.481	1.282	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)[C@@H]1CCN(c2cccc(Br)c2)C1=O	740851431	FAUSZLPVKHSBST-AWEZNQCLSA-N	439.310	1.254	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)N[C@@H]2CCC[C@@H](S(C)(=O)=O)C2)cc1	741094006	VPSPGYNVGWTNPD-CKEIUWERSA-N	427.523	1.539	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)[C@H]1CCCN(C(=O)N2CCc3sccc3C2)C1	741559086	PEHXSMDEQBEJEM-KRWDZBQOSA-N	427.530	1.723	50	20	IDGD	
CN(C)C(=O)CS(=O)(=O)c1ccc(C(=O)NNC(=O)c2c[nH]c3ccccc23)cc1	742037154	QZXYYBBFHAGQAF-UHFFFAOYSA-N	428.470	1.105	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)CSc2nnc(SCc3ccccc3)n2N)cc1	742449729	WQYISNQRFJLZEY-UHFFFAOYSA-N	439.526	1.709	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N[C@@H]2CCSC2)cc1	742778532	PAVNZWDQEKSZQA-XBNGYDHASA-N	425.514	1.963	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NCc2ccc(Cn3cncn3)cc2)cc1	743522825	VLNKDTWTXJRIOH-UHFFFAOYSA-N	443.489	1.266	50	20	IDGD	
Cc1sc2ncn(CC(=O)NNC(=O)Nc3ccc(S(C)(=O)=O)cc3)c(=O)c2c1C	743830362	SPSAELDJNXGLBM-UHFFFAOYSA-N	449.514	1.331	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)CS[C@@H](C)C(=O)Nc2cc(C)on2)c1	744550640	LIOUSHBYOLPHPA-ZDUSSCGKSA-N	434.474	1.356	50	20	IDGD	
O=C(NNC(=O)N1CCOCC1)c1ccccc1NS(=O)(=O)c1cc(F)ccc1F	745991845	GYHCTGBMPCIWQN-UHFFFAOYSA-N	440.428	1.452	50	20	IDGD	
Cc1nc2c(c(O)nn2C)c(C)c1CCC(=O)NNC(=O)[C@H](C)Oc1ccccc1F	746097732	MQXPDKQZFCAKLK-ZDUSSCGKSA-N	429.452	1.977	50	20	IDGD	
NS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cccc(Cl)c2)cc1Br	748045785	HRJKRJRYTCVUTH-UHFFFAOYSA-N	432.683	1.825	50	20	IDGD	
CC(C)[C@H](C(=O)NNC(=O)c1ccc(CSc2nncn2C)cc1)N1CCCC1=O	748555438	FRRLZIMSNJNYBX-QGZVFWFLSA-N	430.534	1.515	50	20	IDGD	
C[C@@H]1NC(C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)=NN(c2ccccc2)C1=O	748611163	GGHXERFEYLUFSX-NSHDSACASA-N	437.428	1.464	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1	748619616	TYBBWMZKXLCDTF-SOUVJXGZSA-N	426.489	1.321	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)[C@H]2CCCN2S(=O)(=O)c2cccs2)c1	749115436	XQOUKOHLPHBCKS-OAHLLOKOSA-N	439.515	1.380	50	20	IDGD	
O=C(Cn1ncc2ccc([N+](=O)[O-])cc21)NNc1nc(Br)cn2ccnc12	750247723	SPZDWAASEPJIIY-UHFFFAOYSA-N	431.210	1.893	50	20	IDGD	
O=C(CC1CCCCC1)NC1CCC(C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)CC1	751061277	DTDIKLZYHWGRGQ-AQFXKWCLSA-N	427.567	1.214	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)c1c2c(cc([N+](=O)[O-])c1[N+](=O)[O-])OCCO2	751273450	WEQLFQRUZDXLIK-UHFFFAOYSA-N	441.356	1.690	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN(C(=O)c2ccc3n[nH]cc3c2)C1)c1ccc([N+](=O)[O-])cc1	751284092	IASCOEHKSLFLEC-HNNXBMFYSA-N	436.428	1.785	50	20	IDGD	
C[C@H](NC(=O)OC(C)(C)C)[C@H](C)C(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	755365729	BLCSZFSFOPNYDL-RYUDHWBXSA-N	428.511	1.792	50	20	IDGD	
C[C@@H]1CN(c2nccnc2C#N)CCN1C(=O)NNC(=O)c1cccc(Br)c1	756947049	HDCPHLWKUOJLNR-GFCCVEGCSA-N	444.293	1.676	50	20	IDGD	
CN(NC(=O)c1ccc([N+](=O)[O-])cc1F)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758781960	JOKBKDUFBSDKPD-UHFFFAOYSA-N	425.417	1.983	50	20	IDGD	
COc1ccsc1S(=O)(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	760357440	VJAVFIUIGJHGDV-UHFFFAOYSA-N	434.540	1.649	50	20	IDGD	
O=C(NNc1nccc(N2CCOCC2)n1)c1ccc(I)c(O)c1	761094425	SQWOCEYCZQMGSN-UHFFFAOYSA-N	441.229	1.380	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)N[C@@H]1CCN(c2ccccc2C(N)=O)C1	761688773	NVWYNGWNAGFDBL-CQSZACIVSA-N	443.529	1.496	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)[C@@H](C)NC(=O)c1n[nH]c2ccccc12	762361357	NLKNGWCUDJEJES-GFCCVEGCSA-N	427.486	1.630	50	20	IDGD	
CN1CC[C@H](CNC(=O)NNC(=O)C(=O)Nc2ccccn2)[C@@H]1c1ccc(Cl)c(F)c1	763093308	VIYRHBVIQNSAGT-DYVFJYSZSA-N	448.886	1.836	50	20	IDGD	
O=C(NNC(=O)c1ccccc1Br)C(=O)Nc1ccc(N2CCOC2=O)cc1	763482709	JTPAZDYDQYDKAX-UHFFFAOYSA-N	447.245	1.805	50	20	IDGD	
Cc1cccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)c1C(=O)N1CCCC1	763548773	QNLJNHVYYXNGEF-UHFFFAOYSA-N	438.440	1.359	50	20	IDGD	
Cn1c(C2CC2)nc2cc(NC(=O)C(=O)NNC(=O)[C@H]3COc4ccccc4O3)ccc21	763574451	BJAGVIBRYFOUKD-GOSISDBHSA-N	435.440	1.377	50	20	IDGD	
COc1c(NC(=O)C(=O)NNC(=O)c2cc(C)n(-c3ccccc3)c2C)cccc1C(N)=O	763601321	GKQSNSWRGFSSID-UHFFFAOYSA-N	449.467	1.601	50	20	IDGD	
CC(C)c1ccccc1NC(=O)C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	763718281	JLNXPUXJWBLIRJ-UHFFFAOYSA-N	432.502	1.460	50	20	IDGD	
CC(C)n1ncc2cc(NC(=O)C(=O)NNC(=O)CN3CCCc4ccccc43)cnc21	763728245	KSTFIJWZZCSEQY-UHFFFAOYSA-N	435.488	1.551	50	20	IDGD	
Cc1cn(-c2ccccc2)nc1NC(=O)C(=O)NNC(=O)CN1CCCc2ccccc21	763735650	PYTRRTBQZMMTPB-UHFFFAOYSA-N	432.484	1.719	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(N(C)C)c2)c(Br)c1	763760801	SOHQKCXYCKBVKL-UHFFFAOYSA-N	435.278	1.923	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(NC(=O)[C@@H]3CCCO3)cc2)cc1	763813312	KXXXJJLOTBMCLX-SFHVURJKSA-N	440.456	1.277	50	20	IDGD	
CC(C)CC(=O)NNC(=O)C(=O)Nc1cc(Br)cnc1OCC(F)(F)F	763881521	GPQVDCPLULCCMM-UHFFFAOYSA-N	441.204	1.917	50	20	IDGD	
COC(=O)c1[nH]c(C)cc1NC(=O)C(=O)NNC(=O)c1sc(-c2ccccc2)nc1C	763901393	GFIQXCGKGSMOQL-UHFFFAOYSA-N	441.469	1.941	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)C(=O)Nc1cccc(CCC(F)(F)F)c1	763916649	ILWYVAQWFOGBIW-UHFFFAOYSA-N	447.377	1.557	50	20	IDGD	
O=C(Cc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1ccc(CN2CCCC2=O)cc1	763931233	DUKPVCVVICHLOX-UHFFFAOYSA-N	428.876	1.791	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1cc(F)ccc1Br	764003760	MZMXZSBJGQDBBF-UHFFFAOYSA-N	438.209	1.759	50	20	IDGD	
N#Cc1cccnc1-n1cc(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3c2)cn1	764067238	RUXCTXSHHFRHIP-UHFFFAOYSA-N	425.408	1.692	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(C)cc3)[nH]n2)c(Cl)n1	764111053	MUKYKQHHTSMTGF-UHFFFAOYSA-N	428.836	1.842	50	20	IDGD	
O=C(CC(F)(F)F)NNC(=O)C(=O)Nc1ccc(N2CCOCC2)cc1C(F)(F)F	764114881	GWQFLXYFKRNPPR-UHFFFAOYSA-N	442.316	1.580	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1O)C(=O)Nc1cccn(Cc2ccccc2)c1=O	764124472	IGXOWBKOBFZRQC-UHFFFAOYSA-N	440.843	1.655	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1O)C(=O)Nc1ccn(CCc2ccncc2)n1	764126741	OZIOHGIRBBVIKN-UHFFFAOYSA-N	428.836	1.280	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1cccc(C(=O)N2CCCC2)c1C	764136395	PZFWOTCVAZBGQZ-UHFFFAOYSA-N	438.484	1.568	50	20	IDGD	
COc1cc(Br)cc(C)c1NC(=O)C(=O)NNC(=O)[C@@H]1Cc2ccccc2O1	764152788	GEIVACVVBRBBLL-HNNXBMFYSA-N	448.273	1.856	50	20	IDGD	
CC1CCN(C(=O)c2ccc(NC(=O)C(=O)NNC(=O)c3ccc(C#N)cc3)cc2)CC1	764177405	MIODYPLFDIPGOM-UHFFFAOYSA-N	433.468	1.830	50	20	IDGD	
CC(C)CCC(=O)NNC(=O)C(=O)Nc1cc(S(=O)(=O)N(C)C)ccc1OC(C)C	764199699	QBQSHFATPAOKRW-UHFFFAOYSA-N	442.538	1.246	50	20	IDGD	
CSc1ccc(NC(=O)C(=O)NNC(=O)c2cc(Br)ccc2O)cn1	764278456	SCILIVXOHNXEHG-UHFFFAOYSA-N	425.264	1.671	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)C(=O)Nc1cccc(N2CCCNC2=O)c1	764281360	UQWCKFJSWNRHAM-UHFFFAOYSA-N	425.445	1.031	50	20	IDGD	
NC(=O)C1CCN(c2ccccc2NC(=O)C(=O)NNC(=O)c2cc3ccccc3o2)CC1	764330872	LFHLTIJFALJARZ-UHFFFAOYSA-N	449.467	1.534	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2cc3ccccc3o2)cc1NS(C)(=O)=O	764331676	XAUNEDKVRUMIRD-UHFFFAOYSA-N	446.441	1.213	50	20	IDGD	
Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)C(=O)NNC(=O)c1cnn(C)c1	764359281	OSKCLCXFGAICLC-UHFFFAOYSA-N	432.440	1.579	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1cc(C(=O)Nc2ccccc2)ccc1C	764401780	XJXDPWDQCGQZRO-HNNXBMFYSA-N	442.472	1.385	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)C(=O)Nc1cccnc1N1CCCCC1	764401853	TXEZAXCEKCGILK-UHFFFAOYSA-N	429.502	1.656	50	20	IDGD	
COc1cc(C=NNC(=O)c2cc(-c3cccs3)[nH]n2)cc(OC)c1OCC(N)=O	764787430	YTZOZTOFEAQWBM-UHFFFAOYSA-N	429.458	1.783	50	20	IDGD	
O=C(COc1ccc2c(c1)CCC2)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765733872	RVRABYMCJNWRDR-UHFFFAOYSA-N	436.512	1.160	50	20	IDGD	
C[C@@H](CC(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1)c1ccccc1F	765735020	GSTNLXMPMGFLDT-KRWDZBQOSA-N	426.492	1.925	50	20	IDGD	
Cc1noc(C)c1CSCC(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765735317	JVSVMDODBSKQBO-UHFFFAOYSA-N	445.545	1.130	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)[C@@H]1C[C@@H]1c1cccc(F)c1F	765739097	QGAZNXLYLVWCFU-QZTJIDSGSA-N	442.466	1.674	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)N[C@H]2CCC[C@@H]2C(=O)NC)c2ccccc2c1=O	766282907	CKHZUTGERKCVLC-HOTGVXAUSA-N	428.493	1.055	50	20	IDGD	
COc1ccc([C@@]2(C)NC(=O)N(CC(=O)NNc3ncnc4ccsc34)C2=O)cc1	766669025	DKWSODCBPNFQFN-LJQANCHMSA-N	426.458	1.610	50	20	IDGD	
Cc1cc(S(=O)(=O)N2CCN(S(=O)(=O)CBr)CC2)cc(C)c1F	767851753	UEGMUBWXOBQNRE-UHFFFAOYSA-N	429.333	1.431	50	20	IDGD	
CC(=O)Nc1ccccc1CC(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	767922839	CWSNUOBJRHTYSL-UHFFFAOYSA-N	433.509	1.917	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)CCNC(=O)OCC(F)(F)F)n[nH]1	768274725	XPDQJSTZWVBWIN-UHFFFAOYSA-N	429.355	1.525	50	20	IDGD	
COc1ccc(NNC(=O)CCc2c(C)nc3c(C(N)=O)cnn3c2C)c([N+](=O)[O-])c1	768331591	FWETWAJQYVUENA-UHFFFAOYSA-N	427.421	1.438	50	20	IDGD	
CSCCNC(=S)NNC(=O)c1cccc(S(=O)(=O)N2CCCCCC2)c1	769769789	OVJVXAVBQNNBKE-UHFFFAOYSA-N	430.621	1.723	50	20	IDGD	
O=C(CN1CCC(O)(c2ccccc2Cl)CC1)NNC(=O)c1cccc([N+](=O)[O-])c1	769814842	NDIXTRGOFUMOJE-UHFFFAOYSA-N	432.864	1.993	50	20	IDGD	
CC(=NNC(=O)N[C@H]1CCS(=O)(=O)C1)c1ccc(OC[C@@H]2CCCCO2)c(F)c1	771099913	HKSNMCVFOMTRFR-HOTGVXAUSA-N	427.498	1.984	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2ccc([N+](=O)[O-])c(C)c2)cc1	771185283	GKOXWNVPBXGMNG-UHFFFAOYSA-N	435.462	1.685	50	20	IDGD	
COc1ccccc1[C@]1(C)NC(=O)N(CC(=O)NNC(=O)c2ccc3ccccc3n2)C1=O	771217193	YCLNTBFFHZRSPF-QHCPKHFHSA-N	447.451	1.472	50	20	IDGD	
COc1ccc(C)cc1[C@@]1(C)NC(=O)N(CC(=O)NNC(=O)c2cccc(C#N)c2)C1=O	771258242	WWYMMWHVBIIBTA-JOCHJYFZSA-N	435.440	1.104	50	20	IDGD	
O=C(CCc1nc(-c2ccccn2)no1)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772195998	VXLAJWWBYCHOLQ-UHFFFAOYSA-N	428.836	1.181	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)Nc2ccc(N3CCOCC3)cn2)n[nH]1	772402662	APIGRLYJSJXBRM-UHFFFAOYSA-N	437.460	1.783	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCC2(Cc3ccccc3)CC2)c1	772631985	UFGCISITRHCZAV-UHFFFAOYSA-N	430.530	1.904	50	20	IDGD	
Cc1nnnn1/C(=C\c1ccccc1)C(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772883548	CVFBAXRMPUALTD-BOPFTXTBSA-N	439.863	1.097	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)N[C@@H]1CCCO[C@H]1CC(C)C	773133237	XAPIEFVXPBRAIB-CABCVRRESA-N	425.555	1.826	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)C(=O)Nc2ccc(C)c(NC(=O)CN3CCCCC3)c2)n1	773478744	METXIOXUQJPKKW-UHFFFAOYSA-N	439.520	1.908	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc([C@@H](C)N3CCOCC3)c2)cc1F	773885578	LJWJQXPIQHZOOC-OAHLLOKOSA-N	428.464	1.927	50	20	IDGD	
C[C@@H]1Oc2ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc3cccc(Cl)c3)cc2NC1=O	774008599	JBXTZEKAPZUGIG-WDEREUQCSA-N	446.847	1.613	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@@H](C(=O)NNc2ncc(Cl)cc2Cl)[C@H](C)O)cc1	775265322	LQEKBWYAPQQOQT-IINYFYTJSA-N	433.317	1.868	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NC[C@@H]2COC3(CCCCC3)O2)c2ccccc2c1=O	776064623	LUSCKVRTQBPTRM-CQSZACIVSA-N	429.477	1.436	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2N2CCOCC2)c1	776292087	OJNPXIKFXSCRMB-UHFFFAOYSA-N	430.417	1.523	50	20	IDGD	
CC(C)[C@@H]1CC(=NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)CCO1	776758110	GOKQBOHLGLHGBJ-FQEVSTJZSA-N	437.562	1.947	50	20	IDGD	
COc1cccc([C@H]2[C@H](NC(=O)NNC(=O)C(=O)Nc3ccccn3)CCN2C2CC2)c1	779400384	NOZUNAIQNJQYGU-MJGOQNOKSA-N	438.488	1.337	50	20	IDGD	
CCO[C@H]1C[C@@](NC(=O)OC(C)(C)C)(C(=O)NNC(=O)Cn2nc(C)cc2C)C1(C)C	780171237	HTYHZXQMXBVONH-YCRPNKLZSA-N	437.541	1.746	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)[C@H]2C[C@@]23CCN(C(=O)OC(C)(C)C)C3)c2ccccc2c1=O	780171338	LATFZZJJBKHYAE-IVZQSRNASA-N	441.488	1.342	50	20	IDGD	
COCC[C@@H](NC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1)c1ccco1	780884017	ZCKBJZQQBYRRKO-MRXNPFEDSA-N	438.506	1.317	50	20	IDGD	
COc1ccc(NNC(=O)CCNS(=O)(=O)c2cccc(Br)c2)nc1	781527043	PPEQRSVJHOYHLW-UHFFFAOYSA-N	429.296	1.664	50	20	IDGD	
CC[C@@H]1C[C@@H](CC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)CCO1	781552735	ZBIMIPYJSPCTKQ-DOTOQJQBSA-N	439.534	1.064	50	20	IDGD	
CN(C)N(C(=O)COc1cccc(I)c1)[C@@H]1CCS(=O)(=O)C1	782005577	ADYVPROZNYXABG-GFCCVEGCSA-N	438.287	1.162	50	20	IDGD	
O=C(CN1CCC[C@@H](n2ccc(C(F)(F)F)n2)C1)NNC(=O)c1ccc([N+](=O)[O-])cc1	782535976	KMFOUURNDPNBAI-CQSZACIVSA-N	440.382	1.908	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C(=O)Nc2cnc(-c3ccccc3)nc2)nc2ccccc21	782886578	QGDHVSOZMMUYDA-UHFFFAOYSA-N	429.440	1.359	50	20	IDGD	
Cn1c(=NNC(=O)C(=O)Nc2cccn(CC(F)(F)F)c2=O)sc2ccccc21	783349978	SJMWPGSFWDADOL-UHFFFAOYSA-N	425.392	1.534	50	20	IDGD	
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)NNC(=O)C12CC3CC(CC(C3)C1)C2	783805260	HXSXSMLHKFMGML-UHFFFAOYSA-N	437.474	1.907	50	20	IDGD	
CCC(=O)Nc1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)cc1	784212554	BJVFIJAIYOAFET-UHFFFAOYSA-N	445.501	1.558	50	20	IDGD	
CCCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNc2ccc(C(F)(F)F)nn2)cc1	784891236	KHMPJOPUZUOLHR-UHFFFAOYSA-N	446.411	1.729	50	20	IDGD	
N#Cc1ccc(NNC(=O)C(=O)Nc2cccc(CN3C(=O)CNC3=O)c2)cc1Cl	785092142	BZFBCWPUKLCPGS-UHFFFAOYSA-N	426.820	1.345	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1ccc2oc(N(C)C)nc2c1	785330439	HJKZESLADDHKJI-UHFFFAOYSA-N	447.473	1.388	50	20	IDGD	
CCN1CCc2ccc(NC(=O)C(=O)NNc3c(OC)cccc3S(C)(=O)=O)cc21	785331528	VOTFLSREBGMKGP-UHFFFAOYSA-N	432.502	1.563	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cccc(C(F)(F)F)n2)cc1	786414092	JPUHZSHPXXUMAQ-LLVKDONJSA-N	438.362	1.856	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)/C(C#N)=C/c3ccc(O)cc3)cc2)CC1	787465465	ZGVWDJGSXCCDPC-SAPNQHFASA-N	441.513	1.379	50	20	IDGD	
N#C/C(=C\c1ccc(O)cc1)C(=O)NC1CN(S(=O)(=O)c2ccc3c(c2)OCCO3)C1	787500101	QIKSRTVNEXQSMT-OQLLNIDSSA-N	441.465	1.260	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)c2cc([C@@H]3CCN(C(=O)OC(C)(C)C)C3)[nH]n2)c1O	787872933	ITCHENJXZHOJBJ-GFCCVEGCSA-N	445.476	1.923	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(Cl)s1)NNc1nnc(-c2ccccn2)s1	788560673	QUOXFFBFZNGVEK-UHFFFAOYSA-N	430.924	1.737	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NN=Cc1ccc(Br)cc1N1CCOCC1	788718707	WPUAOHAXDUFDQO-UHFFFAOYSA-N	446.305	1.561	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)NCC(=O)Nc2ccc(I)cc2)o1	790892281	UMASQLTWWXPPQN-UHFFFAOYSA-N	442.213	1.775	50	20	IDGD	
CCOC(=O)Nc1ccc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1	791839897	NNPSFLFUPHBRLX-QGZVFWFLSA-N	443.412	1.399	50	20	IDGD	
CNC(=O)c1cc2cc(NC(=O)C(=O)NNC(=O)c3cccc(OC(F)F)c3)ccc2[nH]1	792357051	YSYXRLAEVBVAHC-UHFFFAOYSA-N	445.382	1.529	50	20	IDGD	
O=C(NNC(=O)[C@@H](O)Cc1ccccc1)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	792929424	NJZARCAKGZQQDL-NRFANRHFSA-N	442.479	1.753	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@H]2C[C@@]2(C=NNC(=O)Cc2csc(N3CCOCC3)n2)C1	792939074	DEMVPMTXCQCYLB-VBKZILBWSA-N	435.550	1.881	50	20	IDGD	
Cc1ccn(-c2ccc(NC(=O)C(=O)NNC(=O)Cc3nc4ccccc4n3C)cc2)n1	793034725	ILTKACABZUKORL-UHFFFAOYSA-N	431.456	1.396	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)NCC2(S(C)(=O)=O)CCC2)cc1OC	793256201	KTGSRAPJIUDUSJ-UHFFFAOYSA-N	427.523	1.785	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)CN1C(=O)C(F)(F)Oc2ccccc21	794181849	CDJPWFHYKUBBST-UHFFFAOYSA-N	443.410	1.765	50	20	IDGD	
CCOc1cccc([N+](=O)[O-])c1C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	795711943	QXIGYSILPANJKY-INIZCTEOSA-N	445.384	1.138	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)C2CCN(c3oc(C)nc3C#N)CC2)cc1	796285642	QIMUKQRGGRTIOR-UHFFFAOYSA-N	425.445	1.384	50	20	IDGD	
Cn1cc(-c2cc(F)ccc2NC(=O)C(=O)NNC(=O)CSc2ccccc2O)cn1	797010817	HKSVTPBPXJFYFG-UHFFFAOYSA-N	443.460	1.810	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNC(=O)C(=O)Nc1ccc(C(F)(F)F)cc1	797368920	IXTIJHJJHCXHOT-UHFFFAOYSA-N	438.362	1.718	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(Cl)c(CN3CCOCC3)c2)n1	797539101	VWCMWQLZUMVBKO-UHFFFAOYSA-N	431.880	1.275	50	20	IDGD	
C=CCNC(=S)NNC(=O)c1cccc(S(=O)(=O)N2CCc3sccc3C2)c1	798306055	RBDCLTAVYJLSRL-UHFFFAOYSA-N	436.584	1.790	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])o2)cc1C	798307019	HBIJPTDSIJCYRI-AWEZNQCLSA-N	443.416	1.195	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2cc(Cl)cc(C(N)=O)c2)ccc1OC(C)C	799120418	NFWCZUCHVVUZBL-UHFFFAOYSA-N	441.893	1.858	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)Nc1ccc(O[C@H]2CCN(C)C2=O)cc1C	799238963	QBPPOWKVGUJFMB-IBGZPJMESA-N	442.472	1.845	50	20	IDGD	
CN1C(=O)COc2cc(NC(=O)NNC(=O)c3cc(Br)ccc3O)ccc21	799245366	ZDUSCJKJGXCIKN-UHFFFAOYSA-N	435.234	1.976	50	20	IDGD	
CCOc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NNC(=O)CN1CCCc2ccccc21	799257312	IBSAPFJESQDDSG-UHFFFAOYSA-N	441.444	1.532	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc(Br)cnc1Cl)c1ccc2c(c1)OCO2	800830650	FNRWUNGHGFWFHH-UHFFFAOYSA-N	434.655	1.850	50	20	IDGD	
C[C@H](CCNS(=O)(=O)c1ccccc1)NC(=O)NNc1ccc(-n2cccn2)nn1	802527032	RFJHUEVCQDVGEC-CQSZACIVSA-N	430.494	1.046	50	20	IDGD	
C[C@](O)(CSc1cccc(F)c1)C(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	803397244	RHTMCUANOYUJNW-SFHVURJKSA-N	441.506	1.925	50	20	IDGD	
Cc1nc2c3cccnc3nn2c(C)c1CCC(=O)O[C@@H](C)C(=O)NNC(=O)CC(C)C	803761285	JUVHWIBCDCZMKJ-HNNXBMFYSA-N	440.504	1.952	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)c2ccc(-c3noc(C(F)F)n3)cc2)c2ccccc2c1=O	806272702	JFCQXVIVTPDZAV-UHFFFAOYSA-N	440.366	1.996	50	20	IDGD	
C[C@@H](C#N)S(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1	806459001	RZJHOVFPBBRDJY-YVEFUNNKSA-N	430.442	1.365	50	20	IDGD	
O=C(CCOc1ccccc1)NNC(=O)C(=O)Nc1ccc(F)c(N2C(=O)CCC2=O)c1	806977692	VEEYPKKPONBIFS-UHFFFAOYSA-N	442.403	1.034	50	20	IDGD	
CN1CCN(C(=O)NNC(=O)c2cccn2C2CCN(C(=O)OC(C)(C)C)CC2)CC1	807383142	LZDIXFIROKCGOD-UHFFFAOYSA-N	434.541	1.662	50	20	IDGD	
O=C(NNc1cccc(F)n1)C(=O)Nc1ccc(S(=O)(=O)NC2=NCCCCC2)cc1	807391299	LUVZEEFIJPQBLU-UHFFFAOYSA-N	448.480	1.553	50	20	IDGD	
CCc1nnc(NC(=O)[C@@H](C)[C@@H](C)NC(=O)NNc2ccc(-n3cccn3)nn2)s1	807565170	HTTJTROGFHZGFN-WDEREUQCSA-N	430.498	1.366	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)NCc2ccncc2OC[C@@H]2CCOC2)cc1	807616861	YNRJHPAPFFTYEJ-QGZVFWFLSA-N	428.489	1.969	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)c1cc(C(C)C)nc2c1c(O)nc(=O)n2CC	808045504	MNGGVJDOFMEONM-UHFFFAOYSA-N	435.481	1.191	50	20	IDGD	
COc1cccc2c(C(=O)NNC(=O)c3cccc(S(=O)(=O)N4CCCC4)c3)n[nH]c12	809145672	COHSLMFRXMQYSS-UHFFFAOYSA-N	443.485	1.431	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)[C@H]1C[C@H](c2ccccc2)OC1=O	809702912	ASSUQHLSGDUFBD-SJLPKXTDSA-N	445.497	1.455	50	20	IDGD	
Cc1ccc(C)c(S(=O)(=O)NCC(=O)NNC(=O)c2cccc(Br)c2)c1	810448721	RGDSTLWAGBYGNI-UHFFFAOYSA-N	440.319	1.805	50	20	IDGD	
CC(C)CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	810585740	GQHHKYQPVNJWTQ-QGZVFWFLSA-N	441.467	1.474	50	20	IDGD	
CCCOc1ccc(C(=O)NN=C(C)c2ccc(S(=O)(=O)CC(N)=O)cc2)cc1OC	814755422	QEAYUIRZXYZUBV-UHFFFAOYSA-N	447.513	1.897	50	20	IDGD	
O=C(NNC(=O)c1ccc[nH]1)C(=O)Nc1ccc2c(c1)N(C(=O)Cc1ccccc1)CC2	815567376	WIGVOZIAPWJKFV-UHFFFAOYSA-N	431.452	1.546	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCc2nncn2C1)C(=O)Nc1cccc(C#Cc2cccs2)c1	815691839	CJVGPEBUMBNMAL-HNNXBMFYSA-N	434.481	1.088	50	20	IDGD	
COc1ccnc(NNC(=O)[C@H]2CCCCN2S(=O)(=O)c2ccc(C(C)=O)cc2)n1	914762492	HKGNLHIARDCPHI-MRXNPFEDSA-N	433.490	1.374	50	20	IDGD	
COc1ccc(CCNC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1	915883098	BJKAAOXCGOKCQK-UHFFFAOYSA-N	434.518	1.197	50	20	IDGD	
COc1ccc(N2CCN(CCCNC(=O)NNC(=O)Cn3nc(C)cc3C)CC2)cc1	916198497	PKIPGBTYRRDUGZ-UHFFFAOYSA-N	443.552	1.051	50	20	IDGD	
Cn1ccnc1[C@H](NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)c1cccc(F)c1	916224157	JBWUZUHBKPEIGP-QGZVFWFLSA-N	449.446	1.540	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCc2ccccc2Cn2ccnc2)c2ccccc2c1=O	916230475	CDHIIZJRJCBSEK-UHFFFAOYSA-N	445.483	1.805	50	20	IDGD	
CN1CCN(C(=O)c2ccc(CNC(=O)NNC(=O)c3cc4c(s3)CCC4)cc2)CC1	916389965	FKORUEOGZYQBAT-UHFFFAOYSA-N	441.557	1.769	50	20	IDGD	
CCN(CC)[C@H](CNC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)c1ccsc1	916436911	KXTUEOMNXFOXQZ-QGZVFWFLSA-N	428.522	1.751	50	20	IDGD	
COc1cc(C(=O)N2CCN(CC(=O)NNC(=O)c3cccc(Cl)c3)CC2)ccc1C	917141022	GLOPYNDLAVBHBF-UHFFFAOYSA-N	444.919	1.876	50	20	IDGD	
O=C(COC(=O)Cc1csc2ccccc12)NNC(=O)[C@@H]1COc2ccccc2O1	917285575	OQPQODOFQSIAON-KRWDZBQOSA-N	426.450	1.974	50	20	IDGD	
CCNS(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)c2cc(-c3ccccc3)on2)c1	917976114	CYJNYDSUJXHPST-UHFFFAOYSA-N	432.433	1.854	50	20	IDGD	
CN(C)[C@@H](CNC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)c1ccc(F)cc1	918090519	GOHWKEIUTZNKDJ-KRWDZBQOSA-N	426.452	1.320	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)NCC(F)(F)F)cc1S(=O)(=O)NCc1ccccc1	918708183	KUKWNDKWJXQQFR-UHFFFAOYSA-N	444.435	1.980	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)COCc1ccccc1	919799250	MTHYTMPRNSLHSE-MRXNPFEDSA-N	448.545	1.734	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CC=CC[C@H]1c1nc2ccccc2s1)N[C@H]1CCS(=O)(=O)C1	919889263	KHYREDAWZCGXHO-BFHYXJOUSA-N	434.543	1.864	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccc(Cl)cc2Cl)c1)N[C@H]1CCS(=O)(=O)C1	919889360	YFJSGEBWNYCEGB-NSHDSACASA-N	432.289	1.310	50	20	IDGD	
O=C(NC[C@H](c1cccc(F)c1)N1CCOCC1)NNC(=O)[C@H]1COc2ccccc2O1	921199320	GOVWLMHEMMSNRA-YLJYHZDGSA-N	444.463	1.369	50	20	IDGD	
O=C(NCCCS(=O)(=O)c1ccccc1)NNC(=O)c1nnc(O)c2ccccc12	921247148	BJJLUBVOJZAYOH-UHFFFAOYSA-N	429.458	1.143	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NCc3ccc4c(c3)CCC4)nc2)CC1	1115856176	HUYLLIGGOKKKCH-UHFFFAOYSA-N	444.561	1.333	50	20	IDGD	
CC(=O)Nc1cc(F)c(S(=O)(=O)NNC(=O)c2n[nH]c3c2CCCC3)c(F)c1Cl	1318814967	FDTCANHBUVHRPQ-UHFFFAOYSA-N	447.851	1.802	50	20	IDGD	
CC[C@]1(C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)CCN(C(=O)OC(C)(C)C)C1	1319365139	IOLFIUXWRBQZEB-QFIPXVFZSA-N	443.504	1.732	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cc(=O)n(C)c4ccccc34)CC2)cc1	1319777985	DJBKTSCQLLOUQG-UHFFFAOYSA-N	447.539	1.426	50	20	IDGD	
CN(C)[C@H]1CCCC[C@H]1NC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	1327831550	IJAKCAAAXTXNDZ-MSOLQXFVSA-N	437.566	1.288	50	20	IDGD	
CN(CC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Cl)C1)C(=O)c1ccccc1	1778023258	ZZBUHHGIOLVSQL-PLMTUMEDSA-N	439.915	1.807	50	20	IDGD	
O=C(/C=C1\C(=O)Nc2ccccc21)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2	1779283261	TVXIJXZXDSIRRQ-DBJQXLCISA-N	447.919	1.136	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)Cn2cncn2)C1	1779501618	CZTZWKYIHKEMBM-OIPACUDHSA-N	442.358	1.212	50	20	IDGD	
O=C(c1cccnc1-c1ccc(F)cc1)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1780348821	ZQQILAWFPXFCRL-AVRDEDQJSA-N	447.894	1.931	50	20	IDGD	
CCn1ccc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](F)Br)C2)n1	1780771648	OORQQNYEHGIRLT-CKEIUWERSA-N	431.306	1.721	50	20	IDGD	
CC(C)NC(=O)OC(C)(C)C(=O)N1CC[C@@]2(CN(C(=O)CCBr)CCO2)C1	1781020621	ZCQNJCUTNSYVDH-GOSISDBHSA-N	448.358	1.515	50	20	IDGD	
O=C(c1nccc2occc12)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781331371	PWFSNUAUJAZKQA-PBHICJAKSA-N	426.242	1.962	50	20	IDGD	
Cc1cc(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](C)Br)C2)nn1C	1781997079	BPBHRNHDMMKPFJ-ZSZQSSIHSA-N	441.370	1.568	50	20	IDGD	
O=C(CCc1cnc2[nH]ccc2c1)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2	1782062269	WLWRMLQBOJNOJQ-NJNPRVFISA-N	448.951	1.609	50	20	IDGD	
CCc1cc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](Cl)COC)C2)nn1C	1782173560	IPIGSPMKGHGFAR-XAUMDUMWSA-N	426.945	1.364	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccn3ccnc13)C2	1782176296	ZPCDQQCQGMTFJQ-CBGDNZLLSA-N	434.924	1.716	50	20	IDGD	
Cn1nccc1C(=O)N1CCO[C@]2(CCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1	1782863529	FPKCAQYHEQKXLF-VROYLXGSSA-N	441.438	1.749	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cnc4ncccn34)CCO2)C1	1783348021	SBHMECWNEONFKY-SCLBCKFNSA-N	436.310	1.346	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(N(C)C)nc3)CCO2)C1	1783536698	ILFFIAROJYLNET-FZKQIMNGSA-N	425.327	1.375	50	20	IDGD	
COc1ccc([C@H](O)C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)C(C)(C)CCl)C[C@@H]32)cc1	1783766091	QRLDQTZPWKSNAO-WNHJNPCNSA-N	438.952	1.973	50	20	IDGD	
Cc1cccc(C)c1SCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]2C1	1784091471	VLFHFJPWSNXPLZ-XSLAGTTESA-N	440.993	1.975	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)CCCn3ccnc3)C2)C1	1784402994	IBAXBLZGRLHTMD-QAPCUYQASA-N	427.343	1.667	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccnn3CCOC)C[C@@H]21	1784618438	PFBBKCUQAXFQAZ-CUSZFKRNSA-N	426.945	1.530	50	20	IDGD	
Cc1nn(C)c(C)c1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21	1784701449	SMOGRCABJNSNFX-KKUMJFAQSA-N	427.343	1.415	50	20	IDGD	
Cc1cccc(CCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Br)C[C@@H]32)n1	1785118701	PGEAXXLSVMMGIK-MBGYTDRXSA-N	442.329	1.993	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3c(F)c(C)nn3C)[C@H]2C1	1785779099	KGAPNQOLQYYECT-FQUUOJAGSA-N	445.333	1.634	50	20	IDGD	
COc1cnc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)CBr)C[C@@H]32)cn1	1786239044	DFMYYDMXWDCBJP-OSFYFWSMSA-N	441.326	1.110	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnn4c3CCC4)C[C@@H]21	1786407307	PAKKEOLZUBKQPR-NOLJZWGESA-N	425.327	1.208	50	20	IDGD	
CC[C@H](C)[C@H](N)C(=O)Nc1ccc(C2(NC(=O)c3cnccc3C(=O)NN)CCC2)cc1	1787990309	PESPAKAMJOMDDX-LIRRHRJNSA-N	438.532	1.806	50	20	IDGD	
Cc1ccc(C(=O)NC2(c3ccc(NC(=O)c4ccc(B(O)O)cc4)cc3)CCC2)c(O)n1	1788144605	SYGFBEKITGSWSL-UHFFFAOYSA-N	445.284	1.837	50	20	IDGD	
Cn1ccc(CC(=O)Nc2ccc(C3(NC(=O)c4cccc(B(O)O)c4)CCC3)cc2)n1	1788215790	FCLIGZZJCOXFIO-UHFFFAOYSA-N	432.289	1.090	50	20	IDGD	
C[C@H](Nc1ccccn1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21	1788779512	RZKBIPUTPKNLIR-VGWMRTNUSA-N	439.354	1.647	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(-c4ccncc4)[nH]n3)[C@H]2C1	1788926555	PFBVQZIVACPVTA-FPXQBCRKSA-N	447.923	1.319	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)c1ccc(O)c(F)c1	1790067679	VTYIIEDZUVYFSR-GVARAGBVSA-N	433.249	1.815	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC1(c2ccc(NC(=O)c3ccc(O)nc3)cc2)CCC1	1790106960	JAGUGIHXEPWEHR-UHFFFAOYSA-N	446.467	1.847	50	20	IDGD	
CCOC(=O)/C=C/C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](Br)CC)[C@H]2C1	1790961184	LBSUQTOWUIZKCI-HTKIHOTJSA-N	431.327	1.259	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1)c1cncc(O)c1	1791468091	OGVZZAFKRDAKIM-UHFFFAOYSA-N	431.257	1.529	50	20	IDGD	
C[C@H](C(=O)NC1(c2ccc(NC(=O)CCC(=O)NN(C)C)cc2)CCC1)N1C[C@@H]2C[C@H]2C1	1791601102	LXWYEAHNHWNXQJ-SQNIBIBYSA-N	441.576	1.834	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnc(Cl)nc1	1792369667	PCWCROLWBLTMAS-FOUMNBMASA-N	431.718	1.364	50	20	IDGD	
CN(CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1(C)COC1)NC(=O)NCc1ccccc1	1792697930	PDOXHMIAZLCWGE-REPLKXPHSA-N	443.548	1.007	50	20	IDGD	
CC1(C)CCC(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2ccc(B(O)O)cc2)CC1	1795735969	MJNPPCOJZIJRHM-HATOLVCRSA-N	442.365	1.176	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1Cc3[nH]nc(C(F)(F)F)c3C1)C2)[C@H](F)Cl	1796370396	JENPTRNQESIVCC-PEZYRPDVSA-N	438.809	1.267	50	20	IDGD	
Cn1nc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@](C)(Cl)CCl)C3)c2c1CCC2	1797048606	QMJOWNRJZFDQFL-CVGJEZRXSA-N	429.348	1.348	50	20	IDGD	
C[C@@H](C#N)c1cccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)c1	1798443488	BCOIIDKHYUZICU-FZDIXFNVSA-N	446.511	1.878	50	20	IDGD	
COc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Br)c(OC)c1	1799349428	ZTOWAMQORHEDMQ-OJXGSEEGSA-N	445.285	1.598	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3ncncc3c1)C2)[C@@H](F)Br	1799349822	LNHIIRQFXLRRSI-OCVGTWLNSA-N	437.269	1.524	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1nn(C)c(C)c1Br	1799445373	JSETXOCKFDTOCG-YVECIDJPSA-N	447.761	1.997	50	20	IDGD	
Cc1cc2nnc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)[C@H](F)Br)c(C)n2n1	1800159884	RMVDGACBNNWVTE-OXIQGZBJSA-N	439.289	1.683	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@]1(F)CCCC=C1F	1804563590	ABFWDAKUNGOQRG-RZNKXZLBSA-N	433.459	1.683	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC2(CCN(C(=O)[C@@H](C)n3cnnn3)CC2)C1	1805388879	DGAFWEPWIYGHGO-UONOGXRCSA-N	427.347	1.496	50	20	IDGD	
O=C([C@H](O)CCl)N1CCCC2(CCN(C(=O)[C@H]3C[C@@]34C(=O)Nc3ccccc34)CC2)C1	1805526336	RBRNKWJOJDHOLV-UQNRQAKVSA-N	445.947	1.727	50	20	IDGD	
O=C(CCBr)NC[C@H]1CCN(C(=O)c2ccc(O)nn2)[C@@H]1c1cccnc1	1806339189	JPUDPUBNHLKORC-CXAGYDPISA-N	434.294	1.682	50	20	IDGD	
CN1CCN(CC(=O)NC[C@H]2CCN(C(=O)C(C)(C)CCl)[C@@H]2c2cccnc2)CC1	1809599299	MZZUHQGNTCMRNU-UYAOXDASSA-N	436.000	1.600	50	20	IDGD	
C=CCOCCCC(=O)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1	1809968963	IZEYUDVPLCPJSK-UHFFFAOYSA-N	428.338	1.194	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)CN2CCCCC2=O)[C@H]1c1cccnc1	1813033978	YKZYHWUDPXOLGG-ZWOKBUDYSA-N	436.940	1.354	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2cncs2)[C@H]1c1cccnc1	1813069731	BBBCGNBDNPPAQA-KXBFYZLASA-N	430.534	1.231	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)[C@@H](O)CCl)n[nH]2)ncc1[N+](=O)[O-]	1814870669	AHYOWYNANJPNGB-HIFRSBDPSA-N	436.856	1.927	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H]1CCCO1)CC2	1817282378	CYXNLCLHQVSLGM-VXPFBLRFSA-N	444.517	1.368	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(O)nc(O)n2)n[nH]1	1818032143	SYBKSAIGNNWOGN-KCJUWKMLSA-N	439.270	1.700	50	20	IDGD	
CCN(C)[C@H](C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819404102	YMSXZAQSUIDJPR-CXAGYDPISA-N	442.524	1.054	50	20	IDGD	
O=C(CS[C@@H]1CCCCO1)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](O)CCl)CC2	1819860239	DXNYYJXKRQOPHQ-IXPVHAAZSA-N	433.983	1.915	50	20	IDGD	
CCC1(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)[nH]n2)COC1	1821827077	FIIFDMSXAIHRJR-MRXNPFEDSA-N	441.492	1.141	50	20	IDGD	
C=C(C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)C(F)(F)F	1821991744	CTYBIPFJKPFNMH-OAHLLOKOSA-N	436.199	1.514	50	20	IDGD	
CC(=O)OC[C@@H](OC(C)=O)C(=O)N1CCCC[C@H]1c1cc(NC(=O)C(Cl)Cl)n[nH]1	1822423808	MCJQNUOGZSDLQE-QWHCGFSZSA-N	449.291	1.700	50	20	IDGD	
C[C@@H](C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)n1cccc1	1822671625	NGZPRSRJQKOXIN-HNAYVOBHSA-N	435.293	1.458	50	20	IDGD	
CC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](C)N1CCN(C)CC1)CC2	1822849041	FPSYFAQXXJMBAC-MELADBBJSA-N	428.002	1.708	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CN1CCNC1=N)CC2	1822863977	WFOCPFUMTWEZOU-XXFAHNHDSA-N	433.365	1.131	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC[C@H]1C1CCN(C(=O)Cn2nccn2)CC1	1824093794	DEYHBMQSPVDKHH-HOCLYGCPSA-N	426.359	1.929	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)Cc2ccc(F)cn2)CC1	1827123788	WQMHCRQRASMALS-FQEVSTJZSA-N	447.555	1.756	50	20	IDGD	
Cc1n[nH]c(C)c1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1	1829171065	QZBYBJBNXHLHDL-GOSISDBHSA-N	432.569	1.633	50	20	IDGD	
O=C(c1cc(Cl)cnc1O)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1829564077	PRCUKKNPXBZJLR-INIZCTEOSA-N	438.695	1.314	50	20	IDGD	
O=C(Cc1ccc2ccccc2c1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1830724888	JEAOIBQTDMGFDE-REWPJTCUSA-N	446.931	1.438	50	20	IDGD	
COc1ncc(C(=O)N2CCC(N3CCC(NC(=O)[C@@H](O)CCl)CC3)CC2)cc1C	1833308947	FFEYUIJACLTCCO-SFHVURJKSA-N	438.956	1.184	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(O)nc(Cl)c3)CCO2)C1	1833574689	KWVCILGHVOOSLU-IFXJQAMLSA-N	446.331	1.918	50	20	IDGD	
CC(=O)CCC(=O)NC1CCN(C2CCN(C(=O)[C@H](C)CBr)CC2)CC1	1834435922	CLSANHWFNXOMLE-CQSZACIVSA-N	430.387	1.958	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)c1c[nH]c2nccc-2c1	1835013118	FFIFGQXWJPLTQQ-GOSISDBHSA-N	433.940	1.299	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CC3CCOCC3)CCO2)C1	1835423766	JPLGTQIICPQBFI-LPHOPBHVSA-N	447.370	1.433	50	20	IDGD	
Cn1cc(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)c2cccnc21	1835637480	FWLBKMNPWVRYBA-IBGZPJMESA-N	447.967	1.358	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(C=O)s3)CCO2)C1	1835942167	ZWMGZGXSXHZCLP-LJQANCHMSA-N	428.938	1.896	50	20	IDGD	
O=C(CS[C@@H]1CCCCO1)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836717253	PQGVWCJRTTZOAY-PKOBYXMFSA-N	449.013	1.845	50	20	IDGD	
CCc1cc(C(=O)N2CCC(OC3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)n(C)n1	1836717656	AGLAEUKLVKISCJ-SFHVURJKSA-N	426.945	1.194	50	20	IDGD	
O=C(CCBr)N1CCC(OC2CCN(C(=O)c3csnn3)CC2)CC1	1836942216	KIESBDGYMDHWDK-UHFFFAOYSA-N	431.356	1.935	50	20	IDGD	
CC(C)c1nc(C(=O)N2CCOC[C@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)co1	1837710139	KQOURBRCHOTQQO-FQEVSTJZSA-N	439.585	1.720	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](C)n3cncn3)CC2)CC1	1838787223	VSCOBJVVBAZRPD-RHSMWYFYSA-N	427.933	1.092	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(OC)cc3)CCO2)C1	1838967408	BTICLBJORAWTHE-FXAWDEMLSA-N	426.897	1.019	50	20	IDGD	
O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)c1cc(F)cc(F)c1)CCO2	1839001197	CXSXEPLQXCCQJT-SFHVURJKSA-N	447.276	1.820	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cccc(F)c3F)C2)C1	1839147991	JAUQWNDHGIRIGJ-YWZLYKJASA-N	430.879	1.981	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C[C@@H]3CCCCO3)C2)C1	1839150191	FGZOJCTUIMEQHK-ZYSHUDEJSA-N	437.364	1.638	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(CO)o3)C2)C1	1839153633	MEOWAXQJSDHRMQ-ZWKOTPCHSA-N	435.304	1.078	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CCCSC3)C2)C1	1839156376	NUEHOAJOXBFYOE-JCGIZDLHSA-N	439.405	1.822	50	20	IDGD	
CC(F)(F)C(C)(C)C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](F)Br)CCO2)C1	1839199385	VEYHDPQROMWVJO-ZBEGNZNMSA-N	445.276	1.815	50	20	IDGD	
Cc1ccc(F)c(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)c1	1839314161	TUZMLMYTFPABLW-LIRRHRJNSA-N	443.313	1.988	50	20	IDGD	
Cc1cc2cc(C(=O)N3CCO[C@]4(COCCN(C(=O)[C@H](O)CCl)C4)C3)ccc2[nH]1	1839614404	DQSWXENBAMTDEK-WIYYLYMNSA-N	435.908	1.146	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccn(CC)n3)C2)C1	1839963525	NHEIZROXKAUZKB-KSSFIOAISA-N	443.342	1.147	50	20	IDGD	
Cc1ccsc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2	1840031661	YXXCRFBUROJJPF-CXAGYDPISA-N	431.352	1.910	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)cc1F	1840034218	FAVIHVZUQTZODX-LIRRHRJNSA-N	443.313	1.988	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C(C)=C/c3cccs3)C2)C1	1840149772	ZQCHULTVZUGTFF-GDSHAZEPSA-N	442.965	1.862	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3c(F)cccc3F)C2)C1	1840153900	FGYNYHJQCNKGGY-YWZLYKJASA-N	446.878	1.218	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(C)cc3OC)C2)C1	1840156646	ROUYMEKEMWVUFD-UWJYYQICSA-N	440.924	1.327	50	20	IDGD	
COc1ncc(C(=O)N2CCCC23CN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C3)cc1F	1842213944	VIWGWTXDDYBVBR-DHRITJCHSA-N	442.451	1.180	50	20	IDGD	
Cc1oc2cc(O)ccc2c1C(=O)N1CCCC12CN(C(=O)c1ccc(B(O)O)cc1)C2	1843740925	AWBUZWFKUFYULN-UHFFFAOYSA-N	434.257	1.257	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1ccc(Cl)nc1F)C2	1844263789	VXXZIEWTMACCJX-UHFFFAOYSA-N	432.843	1.003	50	20	IDGD	
CC#CC[C@@H](C(=O)N1CCCC12CN(C(=O)c1cnccc1C(=O)NN)C2)c1ccccc1	1844336091	VHCVPLAAJAJDIE-LJQANCHMSA-N	445.523	1.699	50	20	IDGD	
CCN(C)[C@H](C)C(=O)N1CC2(CCCN2C(=O)c2cc([N+](=O)[O-])ccc2OC(C)=O)C1	1844693312	QODVKGZTDBZTML-CQSZACIVSA-N	432.477	1.677	50	20	IDGD	
O=C(OCCO)c1ccccc1C(=O)N1CCCC12CN(C(=O)[C@H](F)Br)C2	1844719687	STWUHFSALHXTDB-AWEZNQCLSA-N	443.269	1.343	50	20	IDGD	
O=C(O)CCSSCCNC(=O)c1ccc(S(=O)(=O)N2CCOCC2)cc1	2088604252	AEXPWQKKYBNBRX-UHFFFAOYSA-N	434.561	1.293	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(CCC(=O)NNC(=O)Cn2nc(C)cc2C)cc1	14894364	RFPAQSNYCORWKG-UHFFFAOYSA-N	435.550	1.311	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)c2c(N)n(C)c(=O)n(C)c2=O)c(C)n1-c1ccc2c(c1)OCO2	16881660	RGZDIFBILBIEJY-OVCLIPMQSA-N	447.451	1.592	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1)c1csc(N2CCOCC2)n1	20910803	HUVAARBFZXHOOA-UHFFFAOYSA-N	446.489	1.563	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)[C@@H]1CC(=O)N(c2ccccc2OC)C1	23686529	SVCRTACZXJAEQZ-OAHLLOKOSA-N	427.457	1.673	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)Cc2ccc(OC(F)F)cc2)ccc1Cl	26535380	OVVUGRLLHCDNAP-UHFFFAOYSA-N	433.820	1.593	50	20	IDGD	
COc1ccccc1-n1cnnc1SCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	36796143	ZGNQKGZOTQRHEI-UHFFFAOYSA-N	428.430	1.737	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)CCn2cnc3sc(C)c(C)c3c2=O)cc1	105539024	MMDVPPDBZRBZJF-UHFFFAOYSA-N	429.502	1.733	50	20	IDGD	
COc1cc(C(=O)NNc2nc(-c3ccncc3)no2)ccc1OCC(=O)NC(C)C	728070989	RHLJFFSVDXACMU-UHFFFAOYSA-N	426.433	1.801	50	20	IDGD	
O=C(CN1CCN(C(=O)c2c(F)cccc2Cl)CC1)NNC(=O)c1ccc(F)cc1	728290827	KELXETVMPXXMCL-UHFFFAOYSA-N	436.846	1.837	50	20	IDGD	
CN1C(=O)c2ccc(S(=O)(=O)NNC(=O)c3cccc(OC(F)F)c3)cc2C1=O	728510542	NEWDOKYQSBMFSU-UHFFFAOYSA-N	425.369	1.137	50	20	IDGD	
CN(C1CCCCC1)S(=O)(=O)N1CCN(C(=O)NNC(=O)c2cccc(C#N)c2)CC1	728954948	UWZAVNCVFDUVSR-UHFFFAOYSA-N	448.549	1.040	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(C(C)=NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1	729635625	DUIOOSAPOCRSSX-UHFFFAOYSA-N	427.486	1.849	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](CCNC(=O)NNC(=O)[C@H]2COc3ccccc3O2)C1	730138976	LGRKKMBVCIEOSR-WMLDXEAASA-N	434.493	1.804	50	20	IDGD	
CC(=O)c1cccc(S(=O)(=O)NCCC(=O)NNC(=O)c2cccc3ncccc23)c1	730287241	ONBAWXULSCRJQD-UHFFFAOYSA-N	440.481	1.567	50	20	IDGD	
CSCC[C@@H](C(=O)NNC(=O)Cc1ccccc1F)N1C(=O)c2ccccc2C1=O	731330137	QOHKKLAEPCGUOS-KRWDZBQOSA-N	429.473	1.934	50	20	IDGD	
CCCCN(C)C(=O)c1ccccc1S(=O)(=O)NNC(=O)c1ccc2c(c1)OCCO2	731469515	WZTACFXNNWGODL-UHFFFAOYSA-N	447.513	1.953	50	20	IDGD	
O=C(CNC(=O)OCC(F)(F)F)NNC(=O)COc1ccc(Br)cc1	732049931	FKNLORKKFGYXQL-UHFFFAOYSA-N	428.161	1.264	50	20	IDGD	
Cc1cc(C)cc(N2CC[C@H](C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)C2=O)c1	734240467	RSPCLGCUTJCEBD-MRXNPFEDSA-N	433.509	1.511	50	20	IDGD	
C[S@](=O)Cc1cccc(C(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)c1	734826071	VZNLBPZZLZDXGS-PMERELPUSA-N	438.550	1.909	50	20	IDGD	
Cc1ccc(N2CCCC2)c(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1	735027660	AUKINEXNQVSHPA-UHFFFAOYSA-N	430.530	1.920	50	20	IDGD	
CCOc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)c3cnn(C)c3)c2)cc1	735470594	CWARAYHTBCOHEK-UHFFFAOYSA-N	443.485	1.694	50	20	IDGD	
CCCC(=O)N1CSC[C@H]1C(=O)OCC(=O)NNC(=O)c1cc(C)c(CC)s1	736819980	XPNYTXFKODWPQI-LBPRGKRZSA-N	427.548	1.625	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1ccccc1CSc1nc[nH]n1	737837808	KWTXOVKAMCGWHN-UHFFFAOYSA-N	438.517	1.565	50	20	IDGD	
Cc1ccsc1S(=O)(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	741646585	FWEHEMLLQNIYOU-UHFFFAOYSA-N	443.572	1.854	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)c1ccc(Oc2cccc(Cl)c2Cl)nn1	741895328	RPUXJHXJRHUQOH-VIFPVBQESA-N	445.284	1.771	50	20	IDGD	
COc1ccccc1-c1noc([C@@H](C)NC(=O)NNC(=O)CNC(=O)c2ccco2)n1	743576579	GJCWTITXPUDCLG-LLVKDONJSA-N	428.405	1.160	50	20	IDGD	
Cc1ccc(NC(=S)NNC(=O)c2ccc(S(=O)(=O)CC(=O)N(C)C)cc2)cc1C	743823182	WQZNZBPYWCUYEP-UHFFFAOYSA-N	448.570	1.797	50	20	IDGD	
COc1cccc(SCC(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)c1	744620960	JMYMQLYCWPKPSB-UHFFFAOYSA-N	437.543	1.952	50	20	IDGD	
CC(C)[C@@H](C(=O)OCC(=O)NNC(=O)c1ccc(C#N)cc1)n1nnc(-c2ccccc2)n1	744847663	YISALFUMMMHOCR-IBGZPJMESA-N	447.455	1.413	50	20	IDGD	
COc1cccc(N2CCC[C@@H](NC(=O)NNC(=O)c3cc([N+](=O)[O-])ccc3O)C2)c1	745832538	YWBQEONWKAPSED-CYBMUJFWSA-N	429.433	1.922	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1ccccc1Cn1cccn1	746332919	SOFTZSNXZWTJRU-UHFFFAOYSA-N	441.513	1.709	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(OCC(F)(F)F)cc1)[C@@H]1COc2ccccc2O1	747408903	DMITZDDTXLQKQO-HNNXBMFYSA-N	432.376	1.777	50	20	IDGD	
COc1ccc(Cl)cc1NC(=O)CCNC(=O)NNc1ccc(-n2cccn2)nn1	747591247	QFFGSSOZLOKWEU-UHFFFAOYSA-N	430.856	1.979	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)c1ccc(C(=O)c2cc[nH]c2)cc1	748688825	ANSHTWMGSLYHTM-UHFFFAOYSA-N	425.470	1.614	50	20	IDGD	
CC(=NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1ccc(O)c([N+](=O)[O-])c1	749604458	UXNDEVPSDZDEGQ-UHFFFAOYSA-N	448.457	1.475	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN1C(=O)c1ccc2c(c1)OCO2)c1ccc(Cl)cc1O	749734585	NJDIFIXAOKXHOR-AWEZNQCLSA-N	431.832	1.840	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@@H]2CCC[C@H]([S@](=O)CC)C2)c2ccccc2c1=O	750670836	NEWRFGKMOWDIOS-FZTYZDATSA-N	433.534	1.440	50	20	IDGD	
O=C(COC(=O)c1cccc(C(F)(F)F)c1F)NNC(=O)[C@@H]1COc2ccccc2O1	750981343	QIEABONDLOOUJT-AWEZNQCLSA-N	442.321	1.989	50	20	IDGD	
C[C@@H]1C[C@H](NC(=O)NNC(=O)CNC(=O)c2cccs2)CCN1Cc1ccccc1	751098319	GADRMQZQCFUBCG-NVXWUHKLSA-N	429.546	1.861	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)c1ccc(S(=O)(=O)C2CCCC2)cc1	751212672	WFIDMNRHZIPIDH-UHFFFAOYSA-N	435.527	1.655	50	20	IDGD	
COC(=O)CCNC(=O)c1ccc(NC(=O)NNC(=O)COc2ccc(C)c(C)c2)cc1	755603765	NKBWEESJVBFLRS-UHFFFAOYSA-N	442.472	1.828	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc1C(N)=O	756326168	FJBFYDAETNXCHE-UHFFFAOYSA-N	445.501	1.345	50	20	IDGD	
CC(C)N(C)C(=O)c1ccc(Cl)c(NC(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)c1	756434402	MTMKLHYZIQAHFC-LBPRGKRZSA-N	430.914	1.408	50	20	IDGD	
CCn1cc(S(=O)(=O)NNC(=O)c2ccc(OC)c(Br)c2)c([N+](=O)[O-])n1	756939173	UHOVWXRTBQJYBH-UHFFFAOYSA-N	448.255	1.206	50	20	IDGD	
CN(C)CCOc1cc(CNC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)ccn1	762713211	YSDLYVULJJDWTI-UHFFFAOYSA-N	439.476	1.058	50	20	IDGD	
C=CC(=O)NCc1ccc(C(=O)NNC(=O)c2cc(-c3ccc(OC)c(OC)c3)[nH]n2)cc1	763146693	DYMZTVRBDMMCFA-UHFFFAOYSA-N	449.467	1.971	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)C(=O)NC1CC1	763433926	JZCHPDQAHYRHGA-INIZCTEOSA-N	429.477	1.030	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)Nc1ccc(Cl)c2cccnc12	763571063	KHCHKCRDJGBHPM-INIZCTEOSA-N	426.816	1.814	50	20	IDGD	
COC(=O)C(C)(C)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(OC)cc2)cc1	763662566	XKDOUIASOYQQQY-UHFFFAOYSA-N	443.456	1.311	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccn(CC(F)(F)F)c2=O)cc1C	763666926	MPKRNAGRHMRSHR-UHFFFAOYSA-N	440.378	1.192	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(C(=O)N(C)C)ccc1C	763685524	XDMDEXOWKKLSOM-UHFFFAOYSA-N	442.472	1.260	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(C)c(C(=O)N(C)C)c1	763712004	CMFLHUPRXPCCBI-UHFFFAOYSA-N	426.473	1.424	50	20	IDGD	
CS(=O)(=O)c1ccccc1NC(=O)C(=O)NNC(=O)CC12CC3CC(CC(C3)C1)C2	763737033	NUMZBULNCRDLHA-UHFFFAOYSA-N	433.530	1.783	50	20	IDGD	
Cc1ccc(NC(=O)C2CC2)cc1NC(=O)C(=O)NNC(=O)CN1CCCc2ccccc21	763746243	REMFWNVXVOSGMO-UHFFFAOYSA-N	449.511	1.882	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccn(-c3cccc(F)c3C#N)n2)cc1	763808769	FSYGJWBEKBIUML-UHFFFAOYSA-N	436.403	1.356	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cccc3c2OCCC3=O)c1C	763840086	IGJFIKOEFVUQRH-CQSZACIVSA-N	425.441	1.822	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)C(=O)Nc1cccnc1-n1cccn1	763848584	DDQUPFLWQWIFKN-OAHLLOKOSA-N	444.451	1.974	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccn(Cc2ccccn2)n1	763852551	YIYSRGNBNVLLEP-ZDUSSCGKSA-N	426.408	1.019	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccn(-c3ncccc3F)n2)c1C	763853455	KVZUXNOVOABKKS-CQSZACIVSA-N	440.435	1.577	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2cc(C(=O)OC(C)C)ccc2Cl)n1	763884173	BZLWFZPHFDBRNV-UHFFFAOYSA-N	435.868	1.505	50	20	IDGD	
CNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2ccc(COc3ccccc3)o2)c1	763956294	ZDBZCSBHFNYSDD-UHFFFAOYSA-N	436.424	1.618	50	20	IDGD	
COCCn1ncc2ccc(NC(=O)C(=O)NNC(=O)c3cc(Cl)ccc3O)cc21	763973954	IKVFMUZVNGDQPM-UHFFFAOYSA-N	431.836	1.441	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)C(=O)Nc1ccc(Oc2cccnc2)nc1	763994187	BEYZAVNRZSDCFY-UHFFFAOYSA-N	445.233	1.759	50	20	IDGD	
Cc1cccc(Oc2ccccc2NC(=O)C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)c1	763996961	HJYVSWNTRPLXRP-AWEZNQCLSA-N	431.470	1.308	50	20	IDGD	
Cc1ccc(-c2nnco2)cc1NC(=O)C(=O)NNC(=O)c1cc(Br)cn1C	764004666	KYLMGOVHZJKJKD-UHFFFAOYSA-N	447.249	1.546	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccccc2CN2C[C@H](C)O[C@H](C)C2)c(O)c1	764105854	ZHFNFMMEFHUZPW-IYBDPMFKSA-N	440.500	1.710	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2O1)C(=O)Nc1cccc(OC[C@@H]2CCCO2)c1	764154489	REMQZXJLYWSJQH-HKUYNNGSSA-N	425.441	1.334	50	20	IDGD	
CCN1CCN(c2ccc(NC(=O)C(=O)NNC(=O)CCc3ccco3)c(C)c2)CC1	764170182	VDZASJGXYUJWKE-UHFFFAOYSA-N	427.505	1.449	50	20	IDGD	
CC(C)(C)CC(=O)NNC(=O)C(=O)Nc1cccc(CS(=O)(=O)NC(C)(C)C)c1	764198874	KQZOUYCANODUBZ-UHFFFAOYSA-N	426.539	1.427	50	20	IDGD	
CCOc1cc(N2CCN(C)CC2)ccc1NC(=O)C(=O)NNC(=O)c1scnc1C	764245268	CCFNBDAYQGTUJN-UHFFFAOYSA-N	446.533	1.002	50	20	IDGD	
O=C(NNC(=O)c1cccc(OC(F)F)c1)C(=O)Nc1cccc(Cn2cncn2)c1	764250173	KSPBLKXALUVABA-UHFFFAOYSA-N	430.371	1.328	50	20	IDGD	
Cc1cc(S(C)(=O)=O)ccc1NC(=O)C(=O)NNC(=O)c1cccc2ncccc12	764253742	VLIZFRZWWZZIAE-UHFFFAOYSA-N	426.454	1.346	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)C(=O)Nc1cccc(NC(=O)[C@H](C)OC)c1)c1ccccc1	764327842	GHVMSIAXHDMOIW-KBXCAEBGSA-N	426.473	1.940	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)c(Cl)c1)C(=O)Nc1cccc(CN2CCCCC2=O)c1	764349293	IETNTQQBTAXOHY-UHFFFAOYSA-N	444.875	1.958	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1)C(=O)Nc1cccc(Cn2cncn2)c1	764386956	FVGBUDIOXWFZCO-UHFFFAOYSA-N	448.418	1.255	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1)C(=O)Nc1ccc(-c2ncon2)cc1	764389104	YSHLRUJCWFLXAR-UHFFFAOYSA-N	435.375	1.666	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NN=C1CCC(O)(C(F)(F)F)CC1	764829380	WDHUZJNMGBSCPK-UHFFFAOYSA-N	426.439	1.784	50	20	IDGD	
CNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cc(-c3ccccc3OC)[nH]n2)cc1	765598781	DWFHCNLXWZOZFX-UHFFFAOYSA-N	429.458	1.068	50	20	IDGD	
CCn1cnc2c1c(=O)n(CC(=O)NN=C1CC(C(F)F)C1)c(=O)n2Cc1ccccc1	766007964	PDWKCHAJLCHKSQ-UHFFFAOYSA-N	444.442	1.575	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N[C@H](C(N)=O)c2ccc(F)cc2)cc1Br	766618359	XVACHSKZIVTNOA-AWEZNQCLSA-N	439.241	1.767	50	20	IDGD	
NC(=O)COc1ccc(Cl)cc1S(=O)(=O)NNC(=O)CSc1ccccc1O	766851377	WXRQPOCHPFVVCG-UHFFFAOYSA-N	445.906	1.012	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)Cn1ncc2ccc([N+](=O)[O-])cc21	767285014	JWQRVJBTPRSJFC-UHFFFAOYSA-N	425.401	1.186	50	20	IDGD	
COc1ccc(NC(=O)COc2ccc(C(=O)NNC(=O)C(C)(C)O)cc2OC)cc1	768242791	AWQRRPXMSIRNCE-UHFFFAOYSA-N	431.445	1.253	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)NCC(=O)NNc2cc(C#N)cc(Cl)n2)cc1	769074415	LQKQNGMVEVGHBN-UHFFFAOYSA-N	437.865	1.205	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cc3c(s2)CC[C@H](C)C3)cc(OC)c1OCC(N)=O	769375081	IQYGRGYKLOFHAH-NSHDSACASA-N	447.513	1.829	50	20	IDGD	
CN1C(=C(C#N)C(=O)COC(=O)[C@H](NS(C)(=O)=O)C(C)(C)C)N(C)c2ccccc21	770108560	CEKQWWHPILYTRO-KRWDZBQOSA-N	434.518	1.384	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)c3cccc(CN4C(=O)c5ccccc5C4=O)c3)nc21	770969953	VXJKLPQDKMFXJQ-UHFFFAOYSA-N	443.423	1.622	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)N1CCC[C@@H]1C(=O)NNc1nc(O)c2cnn(C)c2n1	770972424	QUQSDNFAVSDHRP-CYBMUJFWSA-N	445.867	1.479	50	20	IDGD	
C[C@]1(c2ccc(F)c(Cl)c2)NC(=O)N(CC(=O)NNc2nccnc2Cl)C1=O	771735833	SSITYKCCYZGIFZ-MRXNPFEDSA-N	427.223	1.833	50	20	IDGD	
CCOc1ccc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)C3(O)CCC3)cc2)cc1	771853478	IIZRZOFVCMRSGE-UHFFFAOYSA-N	433.486	1.562	50	20	IDGD	
CC(C)CNS(=O)(=O)c1ccc(C(=O)O[C@H](C)C(=O)NNC(=O)CC(C)C)cc1	771995843	GOUOXKPSBPFXRY-CQSZACIVSA-N	427.523	1.360	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)c1cc(Br)c2c(c1)OCCO2	772067258	XLMDRKBJLPWUBC-SNVBAGLBSA-N	429.267	1.959	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)NCCNS(=O)(=O)c3cccnc3)cc2C1	772973365	KBBFVMXHFJZLRJ-LBPRGKRZSA-N	437.547	1.190	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)CCCCOc2ccc(S(C)(=O)=O)cc2)c1	773081625	GZZVSJQSKARFKB-UHFFFAOYSA-N	448.501	1.454	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2cc(C(F)(F)F)ccn2)n[nH]1	773547631	WZESMWSUXBGHID-UHFFFAOYSA-N	448.361	1.899	50	20	IDGD	
CC(C)c1nccnc1NNC(=O)C(=O)Nc1cccc(OCC(=O)N2CCCC2)c1	773998303	QHCSTICOULOPSL-UHFFFAOYSA-N	426.477	1.683	50	20	IDGD	
CCOC1CC(CNC(=O)NNC(=O)COc2cc(C)cc(C)c2)(N2CCOCC2)C1	775160193	XFQLHFHCTWEXBZ-UHFFFAOYSA-N	434.537	1.283	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@@H](C(=O)NNc2ncc(Cl)cc2Cl)[C@@H](C)O)cc1	775265323	LQEKBWYAPQQOQT-QMTHXVAHSA-N	433.317	1.868	50	20	IDGD	
COCC(=NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)C1CCCC1	780189246	VZQLZIMVHQDAMS-UHFFFAOYSA-N	437.562	1.949	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)CCNC(=O)OC(C)(C)C)N1CCN(c2ccc(F)cc2)CC1	780971541	NSPMIGSYVZTINT-HNNXBMFYSA-N	437.516	1.398	50	20	IDGD	
CC(=O)Nc1ccc(C)c(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1	781426992	PVMMWIGNTNAKCP-GOSISDBHSA-N	427.413	1.098	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2ccc(N3CCC(CN(C)C)CC3)cc2)nc1	782144860	FUMFZCCVCQQXJA-UHFFFAOYSA-N	426.521	1.950	50	20	IDGD	
CC1(C(=O)NNC(=O)CCN2CCN(C(c3ccccc3)c3ccccc3)CC2)COC1	782190373	ZOPRQUDKPKJBEB-UHFFFAOYSA-N	436.556	1.968	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)OCc2nnc(C)o2)cc1	782536260	SLKMJAVDYSEJCT-DHDCSXOGSA-N	436.428	1.776	50	20	IDGD	
C[C@@H]1CN(C)C(=O)CN1C(=O)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1	782564229	YEPBTAJKXFXOKO-UTKZUKDTSA-N	435.528	1.517	50	20	IDGD	
CCOC(=O)[C@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNc2ccc(OC)cc2)cc1F	783039125	GSYUHSBARDEDEN-LBPRGKRZSA-N	446.435	1.598	50	20	IDGD	
CNC(=O)CCOc1ccc(NC(=O)C(=O)NN=c2sc3ccccc3n2C)cc1	783349379	HXEQHSRXNKOVSI-UHFFFAOYSA-N	427.486	1.325	50	20	IDGD	
Cc1ccc(Br)cc1NC(=O)C(=O)NNC(=O)c1cc([N+](=O)[O-])ccc1O	785024166	SXXJIDIUVRHIDB-UHFFFAOYSA-N	437.206	1.771	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)C(=O)Nc3cccc4c3oc(=O)n4C)n[nH]2)c1	785126677	SDOWTMHGKOTUHV-UHFFFAOYSA-N	448.439	1.538	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)c1nnn(Cc2ccc(C(F)(F)F)cc2)c1C	785130554	DLPINRQOEAXYIX-UHFFFAOYSA-N	440.426	1.719	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)N2CCN(C(=O)/C(C#N)=C/c3ccc(F)cc3)CC2)C[C@@H](C)O1	785193961	USYRHTRZVRKHFP-LLAMLJDKSA-N	436.509	1.231	50	20	IDGD	
Nc1c(Cl)ccc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1Cl	786636510	IBYJTBYFLSMKEO-CYBMUJFWSA-N	440.239	1.720	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)[C@H](C)C2CN(C(=O)OC(C)(C)C)C2)n1	786984775	KBAZXNWZKQMSEN-GFCCVEGCSA-N	440.522	1.188	50	20	IDGD	
CC1(C)CCC[C@@]2(C1)NC(=O)N(CC(=O)NNc1nnc(-c3ccccn3)s1)C2=O	788556293	IEBGEOXRPAKPNA-IBGZPJMESA-N	429.506	1.934	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)ccc1Cl	789734530	COHAUUYMVZTBMT-UHFFFAOYSA-N	428.873	1.739	50	20	IDGD	
C[C@@H](c1cccc(N2CCOC2=O)c1)N(C)C(=O)NNC(=O)CNC(=O)c1cccs1	789839716	LGTULUUPMVCVNA-ZDUSSCGKSA-N	445.501	1.868	50	20	IDGD	
CC(C)OC(=O)CC[C@H](C)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	792300379	GUWANTJNHQQRLJ-ZDUSSCGKSA-N	428.511	1.001	50	20	IDGD	
CC(C)Cc1ncc(NC(=O)C(=O)NNC(=O)c2cc(F)ccc2Br)cn1	792356454	QVKQZOAOVIOIIZ-UHFFFAOYSA-N	438.257	1.976	50	20	IDGD	
Cc1ccn(-c2ccc(NC(=O)C(=O)NNC(=O)COc3ccccc3[N+](=O)[O-])cc2)n1	793022242	RQHRNWZMTZUNMG-UHFFFAOYSA-N	438.400	1.254	50	20	IDGD	
COC(=O)c1cc(F)cc(NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)c1F	797006202	XFQYOJNJKOJTSY-UHFFFAOYSA-N	430.367	1.492	50	20	IDGD	
Cc1ccc(N2CCOCC2)cc1NC(=O)C(=O)NNC(=O)c1cccc2ncccc12	797535295	LICIBCJTTQZSPI-UHFFFAOYSA-N	433.468	1.780	50	20	IDGD	
CO[C@H](C(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12)c1cnn(C)c1	798826082	HKOZGTFIHVYXRE-FQEVSTJZSA-N	446.467	1.327	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(C#N)c(Br)c2)c1O	806977359	FRVRCRVUJYMVSO-UHFFFAOYSA-N	433.218	1.435	50	20	IDGD	
COCc1cnc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)s1	807001411	ZKPUMJBPGMOONB-UHFFFAOYSA-N	438.409	1.665	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)c1cccc(NS(=O)(=O)C(F)(F)F)c1	807372147	ZMRMBEZNLHUXMY-UHFFFAOYSA-N	427.401	1.498	50	20	IDGD	
COCCOCc1ccc(CNC(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)cc1	813183336	XULXJBYYMJKTAB-UHFFFAOYSA-N	428.489	1.936	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)N3CCN([C@H](C)C(=O)NC4CC4)CC3)cc2C1	813496837	SUUIAEDKLYWPEO-UONOGXRCSA-N	433.578	1.512	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCC(CO)(c3ccccc3)CC2)cc1OC	814646960	ZBIQHMTYBABFNM-UHFFFAOYSA-N	427.501	1.491	50	20	IDGD	
CCOC(=O)CN1C(=O)C(F)(F)c2cc(NC(=O)C(=O)NNc3ccccc3)ccc21	815551525	XJUPKVYLOZFLKS-UHFFFAOYSA-N	432.383	1.770	50	20	IDGD	
Cc1ccc(COc2cccc(NC(=O)C(=O)NNC(=O)[C@H]3CCc4nncn4C3)c2)cc1	815692294	NWQJFIYXISRQEI-KRWDZBQOSA-N	448.483	1.514	50	20	IDGD	
Cc1c(C(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)nnn1-c1ccn(C)n1	815854134	PGWQKZISBLVHSF-UHFFFAOYSA-N	429.384	1.360	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)[C@H](C(C)C)N2CCCS2(=O)=O)c1	816716856	DXERZDVIKJHNKP-AWEZNQCLSA-N	448.339	1.739	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NN=Cc1c(N2CCOCC2)nc2ccccn2c1=O	874080468	VJLQWESUSCVRRC-OAHLLOKOSA-N	439.447	1.588	50	20	IDGD	
O=C(NN=Cc1c(N2CCOCC2)nc2ccccn2c1=O)c1ccc2c(c1)OCCO2	874103701	MSQMQNWSBTWOEH-UHFFFAOYSA-N	435.440	1.066	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@@H](C)C(=O)NNC(=O)CN1C(=O)[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O	912868670	JKNGSQRBDMHHCN-TZUPDSNESA-N	445.903	1.679	50	20	IDGD	
COc1ccc2c(c1)C[C@H](C(=O)OCC(=O)NNC(=O)c1cc(Cl)ccc1OC)CO2	915011719	CMWDSSAJIDEZTJ-ZDUSSCGKSA-N	448.859	1.913	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)N[C@@H](CCSC)c1nnc2ccccn12	916223087	JHCXXRVDHWVHNB-AWEZNQCLSA-N	444.517	1.942	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NC2CCN(CCc3ccccc3)CC2)c2ccccc2c1=O	916383000	WBDOGTVBPZCCIC-UHFFFAOYSA-N	448.527	1.585	50	20	IDGD	
CN(C)CCOc1cccc(CNC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)c1	916387160	DPZYYAFAXORASK-UHFFFAOYSA-N	438.488	1.663	50	20	IDGD	
CCCC(=O)N1CCC[C@@H](C(=O)NNC(=O)c2nn(CCC)c(=O)c3ccccc23)C1	917518725	CLPYHFRLLFNGIY-OAHLLOKOSA-N	427.505	1.606	50	20	IDGD	
COC(=O)[C@H](C)Sc1ccccc1C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	917665167	JWPVHCGWEZYJMX-LBPRGKRZSA-N	436.511	1.819	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)CCSc1nnnn1C	917922506	UMKRQHZBUGHMBB-VIFPVBQESA-N	429.300	1.070	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)N1CCN(c2oc(C3CC3)nc2C#N)CC1	918776582	SQOBXEXZOZEDSR-UHFFFAOYSA-N	434.460	1.556	50	20	IDGD	
COc1ccc(C)cc1C1(CNC(=O)NN[C@]2(C)CCS(=O)(=O)C2)CCOCC1	919923777	LJEQIAPWMFWECD-LJQANCHMSA-N	425.551	1.433	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@H]2CC(=O)N(c3cc(OC)c(OC)c(OC)c3)C2)cc1	1115834383	YRPKJQDJPNHZME-AWEZNQCLSA-N	443.456	1.535	50	20	IDGD	
CN(C(=O)OC(C)(C)C)[C@H](C(=O)NNC(=O)c1n[nH]c2c1CCCC2)c1cnn(C)c1	1257406150	YWJPMTVQMVULEQ-INIZCTEOSA-N	431.497	1.391	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)N[C@H]2CCCN(C(=O)c3ccccc3)C2)c1	1318175371	MDCKQVSTNFOYCT-KRWDZBQOSA-N	426.473	1.953	50	20	IDGD	
COC(=O)C(=O)NNC(=O)N[C@H]1CCCN(c2c(C)cc(Br)cc2C)C1=O	1323167320	BBCKHFIILITUES-LBPRGKRZSA-N	441.282	1.065	50	20	IDGD	
NC(=O)[C@H]1CCCN(c2ccc(C(=O)NNC(=O)c3cnn(-c4ccccc4)c3)cc2)C1	1338978094	YNSJINFDELLJQV-KRWDZBQOSA-N	432.484	1.649	50	20	IDGD	
CC[C@H](N=c1nn[nH]n1-c1ccccc1)C(=O)NNC(=O)Nc1ccc(OC(F)F)cc1	1340043101	RYPPGURRSJQHAG-HNNXBMFYSA-N	446.418	1.729	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)C3(F)CCCCC3)C2)C1	1778207347	SWHNRYBVVJBFQE-NSRYLYFRSA-N	447.511	1.623	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cc(-c3cccnc3)[nH]n1)CCO2	1779298180	GVJIGBINOPUVHV-NRFANRHFSA-N	443.580	1.767	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(CN(C(=O)c3cnco3)CCO2)C1	1780095659	TYWVCZMJZBQLFK-FQEVSTJZSA-N	444.400	1.265	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(C1)CN(C(=O)C(C)(C)F)CCO2	1780097265	UMGSZCUDLGNWCB-HXUWFJFHSA-N	437.424	1.712	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)c(OC)c1	1780536889	PYNMDFMVVOSDBN-DJJJIMSYSA-N	441.322	1.931	50	20	IDGD	
O=C(/C=C/C1CCCC1)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2	1780742634	OJFFGTKBJGHWFY-MQIXYZICSA-N	440.349	1.240	50	20	IDGD	
COc1cc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)ccc1O	1780745469	CBIRZZYRNAYXDB-BFUOFWGJSA-N	441.322	1.875	50	20	IDGD	
CN(C)c1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)cc1	1781334942	RMMXSYLEVHWZQM-QAPCUYQASA-N	428.302	1.887	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)CC3CCC(C)(C)CC3)C2)C1	1781408580	NZHPJPSHHFSLDD-QHCPKHFHSA-N	436.597	1.796	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cn3ccsc3n1)C2	1782175089	DDJNDZJYKQTCPR-ZBQZNYHESA-N	440.953	1.777	50	20	IDGD	
CC(=O)Nc1cc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)C(Cl)Cl)C2)ccn1	1782217593	PNEBCSFLBUCTAC-AUUYWEPGSA-N	443.331	1.971	50	20	IDGD	
C[C@@H](C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)Br)C2)n1cccn1	1782562268	RVVMZWSZCQEVMY-BASYENTBSA-N	427.343	1.741	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H]3CC(c4ccccc4)=NN3)C2)C1	1782606603	WXMXNFGTBDQKNZ-XMSQKQJNSA-N	432.952	1.848	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)C3CCC4(CC3)OCCO4)C2)C1	1782943671	KKQFSWNZEFNROK-QFBILLFUSA-N	430.929	1.003	50	20	IDGD	
CC(=O)N[C@H](C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](C)Br)C2)C1)C(C)(C)C	1783530505	ZVHMJDCQMCWSDQ-RVZJWNSFSA-N	432.359	1.151	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3nc(C)oc3C(F)(F)F)CCO2)C1	1783876507	WVSOLJGGLJXGSI-BZNIZROVSA-N	439.818	1.699	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/c3ccc(F)cc3F)C[C@@H]21)[C@H](O)CCl	1784085407	IVDDOAPNGWXOIJ-WVSAELBTSA-N	428.863	1.557	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cncc(N(C)C)c3)[C@H]2C1	1785557191	CDNYPRVOBSRDAB-OQUILHJVSA-N	439.354	1.524	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)CNC(=O)c3ccc(C)cc3)C2)C1	1785560964	MVRKFOPJJRMAGJ-PGRDOPGGSA-N	435.952	1.962	50	20	IDGD	
COc1cc(C(=O)NC2(c3ccc(NC(=O)c4cccc(B(O)O)c4)cc3)CCC2)ccn1	1788147792	HJSHVEZHEUWQLC-UHFFFAOYSA-N	445.284	1.832	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4ccccn4n3)C[C@@H]21)[C@@H](F)Br	1789922316	CWFYMFVNJVUZKI-DLKVLKDVSA-N	439.285	1.618	50	20	IDGD	
Cc1nc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]3C2)cs1	1789922359	LBKBWPNRGVGERM-GZCFXPHUSA-N	434.331	1.664	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc4cccnn4c3)[C@H]2C1	1790430318	LNUUJBOUYASPBY-BODMPHMZSA-N	449.349	1.959	50	20	IDGD	
CN1CCN(C2(C(=O)Nc3ccc(C4(NC(=O)[C@H](O)CCl)CCC4)cc3)CC2)CC1	1790445586	MJFCHENAPAPIOV-GOSISDBHSA-N	434.968	1.500	50	20	IDGD	
CCN(CC)C[C@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)Br)C[C@@H]21	1790606049	WKBUFMIIIBKECQ-WOYTXXSLSA-N	432.403	1.727	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(C(C)=O)[nH]n3)C[C@@H]21	1790961944	ZARLLYMJBQCZKK-JFILPPLUSA-N	441.326	1.379	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C34CC(C(=O)OC)(C3)C4)[C@H]2C1	1791013264	KZVRDDDBVRYKKP-ZRTOSOMMSA-N	426.941	1.717	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3c(O)cc(O)cc3O)C[C@@H]21	1791061053	PNQHITVDJOPCKY-OUCVZQCGSA-N	443.294	1.180	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3CCC[C@@H](C(=O)OC)C3)[C@H]2C1	1791245347	IOZQZSPNZMCHCF-ZMSHIADSSA-N	428.957	1.963	50	20	IDGD	
CCOc1ccsc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnccc1C(=O)NN)C2	1792432324	VAKQVYYLOHQOOQ-BTTYYORXSA-N	443.529	1.711	50	20	IDGD	
CC(C)c1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)CBr)n[nH]1	1792872529	MKXCKPBIUNAIMP-JFILPPLUSA-N	427.343	1.767	50	20	IDGD	
Cc1nc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCBr)C3)c(C)s1	1794177230	CWADKNUVQJCBNB-FVCICTRLSA-N	430.368	1.677	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2n(n1)CCNC2=O	1795350479	MCZZNFVGGHMOQP-DBYGNECLSA-N	428.320	1.115	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(-n2cnnc2)cc1	1795491721	QUCVGIWPGZJBSR-UKBAYJJMSA-N	431.924	1.878	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCBr)[C@H]1CC[C@@H]2CCC(=O)N2C1	1795495561	ZRKFFSYVDOCXGA-RBZJEDDUSA-N	426.355	1.811	50	20	IDGD	
Cn1c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)cc2ccccc21	1796189002	LGIUHSSJFYABOU-ACDBMABISA-N	431.301	1.424	50	20	IDGD	
Cc1c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)oc2ccccc12	1796189124	YUHZQAXNOUJUAR-REPLKXPHSA-N	432.285	1.987	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(C)oc1C)C2	1796440837	BAUKONQPHPIIOJ-HGQKDGAKSA-N	441.488	1.234	50	20	IDGD	
O=C1COc2ccc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)C(Cl)Cl)C4)cc2N1	1797450945	BTNJUOWGNOVUBL-QHBPRCKVSA-N	428.272	1.024	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc3cc(C)ccn3c1=O)C2	1799268366	WLNLXEVKDOLHER-KPEUIFRASA-N	432.908	1.224	50	20	IDGD	
COc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Br)cc1OC	1799349310	WINHFDJAYVDRKB-NOXHYTERSA-N	445.285	1.598	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(Cl)c(O)cc1O	1799445119	CYKHHDXUHWHSSB-HMVGFALLSA-N	433.288	1.208	50	20	IDGD	
CN(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H]1C[C@@H]1F)C2)NC(=O)NCc1ccccc1	1799869585	UBYWQWMGOSWOPI-PJVZLEMVSA-N	431.512	1.329	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)c1cccc(Br)c1)[C@H](O)CCl	1799870227	GLBYJAVTKLCEJI-JKJDWNRSSA-N	445.741	1.720	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)[C@@H]1Cc2ccccc2N1	1800318845	TVSHBIJWJFENMO-URLPEUOOSA-N	426.286	1.303	50	20	IDGD	
CC(C)[C@H](O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C#N)=C/c1ccc(F)cc1F	1800332215	HZQFIKVPVKGBCP-CCMRJRBYSA-N	433.455	1.478	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COc1ccccc1)C2	1800639395	UAGZLECVDXLDFB-CXHZTBPHSA-N	425.323	1.829	50	20	IDGD	
CCOC(=O)c1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CCC(=O)NN(C)C)C3)cc1	1800746942	TYGYBGSDGOONCZ-REPLKXPHSA-N	444.532	1.488	50	20	IDGD	
COc1ccc([C@H](O)C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)Br)cc1	1800754006	CJIMNDRQGCNDIK-YIUHCBHRSA-N	441.322	1.102	50	20	IDGD	
Cc1nc2ccncc2cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)Br	1800759575	WTCABBHGXVJASX-MKXCTONWSA-N	447.333	1.925	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(=O)c3ccccc3o1)C2)C(Cl)Cl	1801014550	ZBHWDAOJZORSEI-CULMDFNYSA-N	425.268	1.800	50	20	IDGD	
CC[C@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cn1cc(C)c(O)nc1=O)C2	1801807848	WLAJHFXDQRWQSZ-CRWXNKLISA-N	441.326	1.069	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1CCN(C(=O)[C@H](C)CC(N)=O)[C@@H]1c1cccnc1	1803011097	NEFYQZZOPRGVPE-LNCBFAARSA-N	439.354	1.630	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@H]1CCN(C(=O)[C@@H]2CNC(=O)O2)[C@@H]1c1cccnc1	1803011612	QVPNTLCLUYRKPF-REBRKWNGSA-N	439.310	1.227	50	20	IDGD	
COC(OC)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)CBr)[C@H]1c1cccnc1	1803344800	WRPIAPBPVPTACC-QEJZJMRPSA-N	428.327	1.737	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)n1	1804826301	VKPVIDDPWFMUAJ-KVSKMBFKSA-N	445.907	1.354	50	20	IDGD	
CN[C@H](CC(=O)NC[C@@H]1CCN(C(=O)[C@@](C)(Cl)CCl)[C@@H]1c1cccnc1)C(=O)O	1807206278	SPJQXYTYZQIFIZ-ZDXGLAPJSA-N	445.347	1.386	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc(F)cc2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1	1807373439	BCDSSKIHGKTIST-SIKLNZKXSA-N	447.275	1.534	50	20	IDGD	
Cc1noc(CC(=O)NC[C@@H]2CCN(C(=O)[C@@H](C)Br)[C@H]2c2cccnc2)n1	1807527710	GXIMNCHLRSCHSE-WHCBVINPSA-N	436.310	1.805	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCC2(CCCN(C(=O)CNCP(=O)(O)O)C2)CC1	1809662932	LEKOEKYEQVTZJW-OAHLLOKOSA-N	444.296	1.179	50	20	IDGD	
Cc1ocnc1C(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1811076561	QLYZJESBUUPNEC-OXQOHEQNSA-N	428.493	1.071	50	20	IDGD	
O=C(Cn1ccncc1=O)NC[C@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1	1812342640	YGCGVRQHQHBFRK-BEFAXECRSA-N	448.321	1.129	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)CCn2cncn2)[C@@H]1c1cccnc1	1812867352	ICOJYTULYHWQOK-YSVLISHTSA-N	435.326	1.553	50	20	IDGD	
C[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](O)CCl)n[nH]1	1814864784	SUQPDZOUJFDKIU-YUTCNCBUSA-N	443.932	1.915	50	20	IDGD	
Cc1cc(CC(=O)Nc2cc([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)nn1C	1814990117	AOLGHFMNIMYKTK-KRWDZBQOSA-N	444.540	1.059	50	20	IDGD	
C=CCC(F)(F)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1	1815360732	YBRFBLRQEYZNRW-CYBMUJFWSA-N	435.261	1.260	50	20	IDGD	
O=C(CCc1ccco1)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1815931676	DKBNWTMSZDZDIY-LJQANCHMSA-N	436.277	1.621	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CO[Si](C)(C)C)CC2	1817018100	VPVPFQCZMNVPDW-QWRGUYRKSA-N	427.603	1.354	50	20	IDGD	
CC(C)[C@@H](S)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1	1817473846	CFADNUJQPYCWDM-SJLPKXTDSA-N	430.339	1.350	50	20	IDGD	
Cc1cnc2c(C(=O)Nc3nc4c(s3)C[C@H](NC(=O)[C@H](O)CCl)CC4)cnn2c1	1819086122	ROIOMAZHNZHQBF-ZWNOBZJWSA-N	434.909	1.320	50	20	IDGD	
CC[C@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CN2CCS(=O)(=O)CC2)[nH]n1	1820853281	HZDRCDSIJZAXPD-DZGCQCFKSA-N	445.973	1.150	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)/C=C/c2cnc[nH]2)n[nH]1	1822664839	OBSDFCFFNNUVLW-FYCOFBDGSA-N	428.497	1.211	50	20	IDGD	
O=C(COc1cccnn1)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](F)Br)[nH]n1	1822754989	XYMJRZSKZJGTHB-IAQYHMDHSA-N	441.261	1.961	50	20	IDGD	
Cc1noc(N)c1C(=O)N[C@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1	1823005302	ZBGVCTOXJHWRKH-WKEGUHRASA-N	432.275	1.938	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)Cn3nccn3)sc2C1	1823119399	JQQXECIMKYOJML-UWVGGRQHSA-N	427.328	1.520	50	20	IDGD	
O=C1CC[C@H](C(=O)N2CCCC[C@@H]2C2CCN(C(=O)CCBr)CC2)CN1	1823834654	NHQJSBAFBJMCME-JKSUJKDBSA-N	428.371	1.917	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)Cn2cnnn2)CC1	1824094234	VENZLUWBOJNMLK-DZGCQCFKSA-N	427.347	1.324	50	20	IDGD	
C=CCO[C@@H](C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1	1824504518	PZNYLQLKXZNMFZ-UWJYYQICSA-N	428.338	1.191	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CNCP(=O)(O)O)CC1	1824614049	DPWGRTKBBMTXCF-JKSUJKDBSA-N	437.905	1.738	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@H](O)CCl)CC2)c1cnc2c(c1)CCNCC2	1824635408	JWVUGFYGUHHUII-CZUORRHYSA-N	449.964	1.052	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H]1CNC(=O)C1)CC2	1825451793	RFQWZFCEFDLXMU-UTLUCORTSA-N	429.340	1.365	50	20	IDGD	
CCOC(=O)/C=C/C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](C)Br)sc2C1	1825642998	YQMDUVNKKYIJIN-YJOJJWFDSA-N	430.324	1.958	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCN1CCOC1=O)CC2	1826000259	QBVJQFCSJYVNTL-MNOVXSKESA-N	430.914	1.151	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2nccnc2C(N)=O)CC1	1829511367	PILVYZJYTUVLME-HUUCEWRRSA-N	437.928	1.063	50	20	IDGD	
O=C([C@@H](F)Cl)N1CCC([C@H]2CCCCN2C(=O)c2cc(=O)nc3cccnn23)CC1	1829620910	WTUHZEBCFJDGCB-RDTXWAMCSA-N	435.887	1.857	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cc(C)n(C)n3)C2)C1	1831639848	FCAMRXPORFDIIB-YLJYHZDGSA-N	426.945	1.135	50	20	IDGD	
CCS(=O)(=O)CC(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H](C)Br)CC1	1831648425	FFOHEDAMMDGKSA-UKRRQHHQSA-N	437.400	1.824	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccc4ncnn4c3)C2)C1	1831654469	LBVGVSXOJCYBCD-LAUBAEHRSA-N	449.939	1.136	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3cc(F)ccn3)CCO2)C1	1832855992	VWECHNFIKPLUJC-PXNSSMCTSA-N	427.904	1.627	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)c1cccnc1Cl	1833007436	PGBIEQBVWITVFN-MRXNPFEDSA-N	429.348	1.520	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3nc(C)sc3C)CCO2)C1	1833151661	VKOJKNLCPKGJJO-HNAYVOBHSA-N	429.970	1.776	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cc4ccccn4n3)CC2)CC1)[C@H](O)CCl	1833310545	RKCKYUAMUWPBRI-LJQANCHMSA-N	433.940	1.119	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)nc1C	1833694984	FMBCOLWVUFENJY-IFXJQAMLSA-N	440.338	1.552	50	20	IDGD	
O=C(Cc1cncnc1)NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1	1833862064	BEUVGZBBHKIYNS-KRWDZBQOSA-N	442.333	1.281	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(F)cn3)CCO2)C1	1834480445	KZMWRPXHAZPXLX-RDTXWAMCSA-N	444.301	1.464	50	20	IDGD	
O=C(Cc1cccnc1)NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1834880442	DYEFYZXPJADNJE-GOSISDBHSA-N	441.345	1.886	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3[nH]nc4ccncc34)CC2)CC1	1835019139	PLLUMLAJZTXTTQ-QGZVFWFLSA-N	448.955	1.397	50	20	IDGD	
Cc1noc(CC(=O)N2CCC(N3CCC(NC(=O)[C@@](C)(Cl)CCl)CC3)CC2)n1	1836398198	BWPFMUXGGSDQPR-IBGZPJMESA-N	446.379	1.728	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)Cc3cscn3)CC2)CC1)[C@H](F)Br	1836412482	IFHPZQWUJDBTPU-INIZCTEOSA-N	447.374	1.948	50	20	IDGD	
C[C@@H](CC(N)=O)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1836911152	UHKJBXFJZGREKD-XHDPSFHLSA-N	436.322	1.187	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(C=O)s3)C2)C1	1837711335	DVTNPACMSNBLGS-IBGZPJMESA-N	440.594	1.482	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cc4ncccn4n3)CC2)CC1	1838312885	PQLTUKUPKGMGFN-QGZVFWFLSA-N	449.939	1.595	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cncc(F)c3)C2)C1	1839150930	CHTCDBLIJQBXTC-ROUUACIJSA-N	434.295	1.527	50	20	IDGD	
CCc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)nn1C	1839153589	LNRLBBGMNGQEJP-RTBURBONSA-N	447.363	1.289	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc4c3NC(=O)C4)CCO2)C1	1839573846	DBGFOFYPVGQMJV-KKSFZXQISA-N	435.908	1.269	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3nc(C)c(C)s3)C2)C1	1840154052	JJFDCYODJYGIID-RDTXWAMCSA-N	431.942	1.084	50	20	IDGD	
C[C@H](Nc1ccccn1)C(=O)N1CCOC[C@]2(CN(C(=O)C(Cl)Cl)CCO2)C1	1840188635	VBVSCYMXEDSGMR-SCLBCKFNSA-N	431.320	1.142	50	20	IDGD	
O=C(C1CCSCC1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1840925042	JVTBEWADQSNLSF-XJKSGUPXSA-N	439.347	1.277	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](CCO)C(=O)N1CCCC12CN(C(=O)CO[Si](C)(C)C)C2	1841430769	HTGQSNDKJFKODA-OAHLLOKOSA-N	443.617	1.317	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)[C@@H]2C[C@H]2c2ccc(Cl)cc2)C1	1843872766	BBBKMFUCACVWKU-VQTJNVASSA-N	438.720	1.641	50	20	IDGD	
COc1ccc(CCC(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)cc1	1844263954	OIKPLVBMLZGAKU-UHFFFAOYSA-N	437.500	1.144	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2ccc(Cl)cn2)C1	1844443064	BYLBMAGALJFQSC-ZMOGYAJESA-N	428.880	1.686	50	20	IDGD	
CC[C@@H](NC(C)=O)C(=O)N1CC2(CCCN2C(=O)c2cc([N+](=O)[O-])ccc2OC(C)=O)C1	1844691954	SBSPNFAFDZBVTE-QGZVFWFLSA-N	446.460	1.252	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)[C@@](C)(Cl)CCl)C1	1845170306	KPCVFJJGWAUNCP-QQZPLFJDSA-N	428.320	1.560	50	20	IDGD	
O=C([C@H]1ON=C(c2ccccc2)O1)N1CC2(CCCN2C(=O)[C@@H](F)Br)C1	1845218119	NFGVOJJVHNBYTR-MLGOLLRUSA-N	426.242	1.615	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2cccc3c2NC(=O)C3)C1	1845664874	YVRRQGOUPGMOCN-VULFUBBASA-N	448.483	1.132	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)CCCn2ccnc2C)C1	1846573632	LMZAKNLZPVAYFF-PCLIKHOPSA-N	439.520	1.309	50	20	IDGD	
COc1cc(C(=O)N2CCCC23CN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C3)ccc1F	1846801665	LMKCPYCMZHEXEV-AFUMVMLFSA-N	441.463	1.785	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@](C)(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](O)CCl)C1	1847568497	XSFAVAMSTGVZDJ-GXYOHSSGSA-N	443.972	1.825	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)C12CC(C(F)(F)F)(C1)C2	1847884343	FCEUUGRGLAOBID-IHWOHKJGSA-N	437.422	1.233	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cc(Cl)c(N)cc2OC)cc1OC	11457066	LUJDJXIQDUKEDO-UHFFFAOYSA-N	437.836	1.566	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2ccc(Cn3cccn3)cc2)cc1	14335595	GWPCJBLTDVAGMW-UHFFFAOYSA-N	441.513	1.322	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1	15314986	HBULNVRVCUVWRQ-UHFFFAOYSA-N	442.432	1.476	50	20	IDGD	
O=C(CCN1C(=O)COc2ccccc21)NNC(=O)COc1ccc(Br)cc1	16508007	QHJYIMGGAUJJRG-UHFFFAOYSA-N	448.273	1.791	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)CCNS(=O)(=O)c2cc(C)ccc2C)c1	17058656	CPVWYGASGOLSDS-UHFFFAOYSA-N	435.502	1.450	50	20	IDGD	
COc1cccc(CCC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1OC	19595834	LGEZVAWOCNTNCR-UHFFFAOYSA-N	435.502	1.348	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)c1ccc(C(F)(F)F)nc1	26220137	MVAALBKXDLXLRH-UHFFFAOYSA-N	442.419	1.960	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NC[C@H](c1cccc(F)c1)N1CCOCC1	726247078	XPWXEGFYALTHQQ-MRXNPFEDSA-N	449.508	1.021	50	20	IDGD	
C#Cc1cccc(NC(=S)NNC(=O)c2cccc(S(=O)(=O)NCCOC)c2)c1	727501290	QPCPTPYBGRUJCK-UHFFFAOYSA-N	432.527	1.224	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(S(=O)(=O)NNC(=O)CCCc2ccccc2)c1	727721696	OLVCVLSIHLJCJC-UHFFFAOYSA-N	425.532	1.269	50	20	IDGD	
COc1ccc(CCNC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c(OC)c1OC	727845831	BCSZENVPTFSGBW-QGZVFWFLSA-N	431.445	1.425	50	20	IDGD	
Cc1noc(C)c1S(=O)(=O)N1CCN(C(=O)NNC(=O)CCCc2ccccc2)CC1	727846821	ZRJXIDYEXKPBMH-UHFFFAOYSA-N	449.533	1.361	50	20	IDGD	
Cc1ccc(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)cc1[N+](=O)[O-]	728213205	UYHFZWXKHPFMKL-UHFFFAOYSA-N	433.490	1.596	50	20	IDGD	
CC(=O)c1ccc(CC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)cc1	728214894	UOWPCGUMFDXTAY-UHFFFAOYSA-N	430.530	1.511	50	20	IDGD	
CCc1nc(CN2CCN(C(=O)NNC(=O)CNC(=O)c3cccs3)CC2)cs1	728952135	UNQNCDDYXYMWMQ-UHFFFAOYSA-N	436.563	1.055	50	20	IDGD	
CC(C)c1c(C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)cnn1-c1ccc(Cl)cc1	729276702	KVRRLTZYVMWSBQ-LLVKDONJSA-N	427.914	1.348	50	20	IDGD	
Cc1ccc(CNC(=O)NCC(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)cc1	730076956	FHIUZRDKBDLJPZ-UHFFFAOYSA-N	431.518	1.378	50	20	IDGD	
O=C(COc1ccccc1O)NNS(=O)(=O)c1cc(Br)c(F)cc1F	730813323	FSSSRUFCKGKKOP-UHFFFAOYSA-N	437.218	1.821	50	20	IDGD	
COc1c(F)cc(Br)cc1S(=O)(=O)NNC(=O)COc1ccccc1O	730813338	GJWYECDVLPTSRB-UHFFFAOYSA-N	449.254	1.691	50	20	IDGD	
Cc1c(C(=O)NNC(=O)COc2ccc(C#N)cc2)nnn1-c1cccc2cnccc12	731185598	AMTPPWUQKSHWQG-UHFFFAOYSA-N	427.424	1.836	50	20	IDGD	
CC(C)(C(=O)NNC(=O)c1cc(-c2ccco2)nc2c(C(N)=O)ncn12)c1ccccc1	731200127	AYOQJGFKVLVZDV-UHFFFAOYSA-N	432.440	1.827	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)c1ccccc1	732246082	MGANRNILTFFSSV-KRWDZBQOSA-N	425.493	1.248	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)[C@H]2CCCN2S(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1	732959219	TXTATJSDGAKYHZ-QGZVFWFLSA-N	443.441	1.081	50	20	IDGD	
Cc1nnnn1/C(=C\c1ccc(F)cc1)C(=O)NNC(=O)c1cnn(-c2ccccc2)c1	733108196	LAMLZKMZLHMDQT-ODLFYWEKSA-N	432.419	1.766	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)CC[C@H]2NC(=O)N(c3ccc(C#N)cc3)C2=O)cc1C	733774395	NPDBFJWZAKEHMA-LJQANCHMSA-N	449.467	1.607	50	20	IDGD	
COc1ncc(C(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)cn1	733948137	QXWJYGHSWBZWRF-UHFFFAOYSA-N	430.424	1.318	50	20	IDGD	
CC(=O)NC[C@H]1CN(C(=O)/C(C#N)=C/c2cn(CCC#N)nc2-c2ccccc2)CCO1	735476868	UNNXMKXPCRJKNV-SRKIZSPNSA-N	432.484	1.734	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)C3(C#N)CCC3)c2)cc1	736064924	WMHSYMFKRYWBGW-UHFFFAOYSA-N	428.470	1.951	50	20	IDGD	
O=C(COC(=O)c1cc(O)nc2ccc(F)cc12)NNC(=O)c1ccc([N+](=O)[O-])cc1	738814652	FAIPANSJVRPYME-UHFFFAOYSA-N	428.332	1.606	50	20	IDGD	
CN(CC(=O)NNc1cccc(C(F)(F)F)n1)S(=O)(=O)c1cccc([N+](=O)[O-])c1	740141599	JLMUXICSOASDDO-UHFFFAOYSA-N	433.368	1.772	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCCN1Cc1ccccc1)c1csc(N2CCOCC2)n1	741144226	LFSNQTYTMNHVJJ-SFHVURJKSA-N	429.546	1.795	50	20	IDGD	
CC(C)(C)c1nc2ccc(S(=O)(=O)NNC(=O)N[C@@H]3CCS(=O)(=O)C3)cc2s1	743254974	WDZJITGRXLEVPM-SNVBAGLBSA-N	446.576	1.273	50	20	IDGD	
CCn1c(CCNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)nc2ccccc21	744305854	ZPVYWJPAOKREEG-UHFFFAOYSA-N	443.533	1.536	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)c2cc(Cl)c3c(c2)OCCCO3)cc1	744587668	RGJZMYNMBNFHOQ-UHFFFAOYSA-N	429.816	1.991	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)N2CCN(C(C)(C)C(N)=O)CC2)N(C)c2ccccc21	746006759	UTPCTCAMIHTNTF-UHFFFAOYSA-N	438.532	1.065	50	20	IDGD	
CC(C)N(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)Cc2cn3ccccc3n2)cc1	746553325	JEXHGGHEECMUPA-UHFFFAOYSA-N	429.502	1.367	50	20	IDGD	
O=C(CNC(=O)c1ccc(Br)cc1)NNC(=O)Cc1cn2ccccc2n1	747523592	LPIZXYUENZNYEX-UHFFFAOYSA-N	430.262	1.217	50	20	IDGD	
Cc1nn(C)c2ncc(C=NNC(=O)c3cccc(S(=O)(=O)N4CCOCC4)c3)cc12	747603139	WHFXMTVDYAMFOX-UHFFFAOYSA-N	442.501	1.062	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NCCOC)c(C(=O)NNC(=O)c2ccc[nH]2)c1	747664032	WRDZHYLTDUJAAD-UHFFFAOYSA-N	437.522	1.178	50	20	IDGD	
CCc1ccc(C(=O)NNc2cccc([N+](=O)[O-])c2)cc1S(=O)(=O)N1CCOCC1	748004032	RKYFEFJFFSMYIW-UHFFFAOYSA-N	434.474	1.935	50	20	IDGD	
NS(=O)(=O)c1ccc(CCC(=O)NNc2nc(-c3ccccn3)nc3c2CCC3)cc1	748339983	UQIARBNUWURPKX-UHFFFAOYSA-N	438.513	1.751	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)N2CCC([C@]3(C)NC(=O)NC3=O)CC2)c1C	748376039	RKFPLRFOMPXZFD-PFSBYRDKSA-N	427.505	1.495	50	20	IDGD	
Cc1c(NNC(=O)Cn2cnc3c(c(Br)nn3C)c2=O)cccc1[N+](=O)[O-]	748680434	HHUGHURQKUUWOM-UHFFFAOYSA-N	436.226	1.252	50	20	IDGD	
Cc1nn(C)c(C)c1S(=O)(=O)N[C@@H](C)C(=O)NNc1ccc([N+](=O)[O-])cc1Cl	748716471	GUDUQXARNNJJNP-VIFPVBQESA-N	430.874	1.409	50	20	IDGD	
COc1c(F)cc(CC(=O)NNc2ccc([N+](=O)[O-])cc2Cl)cc1S(N)(=O)=O	748726792	RWYSTSHVSXGBNP-UHFFFAOYSA-N	432.817	1.729	50	20	IDGD	
COCCOc1ccc(Cl)cc1C(=O)OCC(=O)NNC(=O)c1ccc(C#N)cc1	748934922	QHNJFIJYYQLLHN-UHFFFAOYSA-N	431.832	1.855	50	20	IDGD	
CC(C)C[C@H](/N=C1/NS(=O)(=O)c2ccccc21)C(=O)NNC(=O)CCc1ccccc1	749851862	MLJNSRYPLGYAGW-SFHVURJKSA-N	442.541	1.920	50	20	IDGD	
COC[C@H](NC(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1)C1CC1	750446730	OJXVHDRUBZCFLN-IBGZPJMESA-N	435.488	1.757	50	20	IDGD	
Cc1ccc(-n2ncc(C(=O)NNC(=O)CNC(=O)c3ccco3)c2C(F)(F)F)cc1	751204003	BFXYXDZFVIODQO-UHFFFAOYSA-N	435.362	1.984	50	20	IDGD	
Cc1ccc(C(=O)NNS(=O)(=O)c2ccc(OCCCC(=O)O)c(F)c2)c(O)c1	751271504	VPOPASUHABTAOO-UHFFFAOYSA-N	426.422	1.707	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=S)N[C@H](C)C3CC3)CC2)cc1	751617725	BXVRJMIXBCLMEH-CYBMUJFWSA-N	440.591	1.390	50	20	IDGD	
CN1C(=O)N[C@]2(CCC[C@@H]2CNC(=O)NNC(=O)c2ccc(Br)s2)C1=O	752003224	RXIOZYAMCGSXJF-GLEZIHRCSA-N	444.311	1.175	50	20	IDGD	
COC(=O)C[C@@H]1CN(C(=O)CCC(=O)C(C#N)=C2N(C)c3ccccc3N2C)CCO1	752747365	KUWLPIWJNHDMGO-OAHLLOKOSA-N	426.473	1.448	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2ccc(-n3nc(C)cc3C)cc2)n1	752856145	DDQQQAABLGCLBG-UHFFFAOYSA-N	427.486	1.801	50	20	IDGD	
COc1cccc(C[C@H](C(=O)NNC(=S)NCCc2cccs2)n2nnnc2C)c1	753076890	HLVHSWRIZCQDIV-QGZVFWFLSA-N	445.574	1.573	50	20	IDGD	
O=C(NNC(=O)N1CCS(=O)(=O)[C@@H]2CCCC[C@@H]21)c1cccc(Br)c1	753919570	VHMQEIRLZFRIFX-UONOGXRCSA-N	430.324	1.845	50	20	IDGD	
O=C(Cn1c(=O)ccn(Cc2ccccc2)c1=O)NNc1nc(C(F)(F)F)cs1	755855201	QNDMVHOQPVTDED-UHFFFAOYSA-N	425.392	1.677	50	20	IDGD	
CC(C)(C)S(=O)(=O)N1CCC(NC(=O)NNC(=O)c2cccc3ncccc23)CC1	755899784	RTIHBWROCFWEQM-UHFFFAOYSA-N	433.534	1.772	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@H]2C)ccc1NC(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1	756246242	TWBJTCBGEXPSJK-ZBFHGGJFSA-N	436.534	1.597	50	20	IDGD	
CS(=O)(=O)CCOc1ccc(Cl)cc1NC(=O)NNC(=O)Cc1cccnc1	756812819	GOTXWCQBZLIFLK-UHFFFAOYSA-N	426.882	1.554	50	20	IDGD	
C[C@H]1CN(C(=O)Cn2cc(NC(=O)NNC(=O)c3cc4c(s3)CCC4)cn2)C[C@H](C)O1	756836634	CHKAVYAEMJGFIT-STQMWFEESA-N	446.533	1.536	50	20	IDGD	
CCS(=O)(=O)c1ccc(CCC(=O)NNC(=O)c2cc(Br)c[nH]2)cc1	756871648	UOPWSJHBAORNHT-UHFFFAOYSA-N	428.308	1.965	50	20	IDGD	
CCOc1cc(Br)c(CC(=O)NNc2ccc(C(N)=O)nn2)cc1OCC	757407254	HUBLAOGXVIDCBH-UHFFFAOYSA-N	438.282	1.821	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(F)(F)[C@H](C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)C1	757758328	AKBSUPQVGZIBDJ-WFASDCNBSA-N	441.431	1.866	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1S(=O)(=O)NC1CC1	757863512	CSHBUFFUTYPMAJ-UHFFFAOYSA-N	433.446	1.810	50	20	IDGD	
CN(C)N(C(=O)CCn1cnc2sc3c(c2c1=O)CCCC3)[C@@H]1CCS(=O)(=O)C1	757867826	WZZQAXKBCTVNIF-CYBMUJFWSA-N	438.575	1.219	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)CCc2ccccc2C(=O)OC)c2ccccc2c1=O	758076092	LTCAYTCFEBRWMX-UHFFFAOYSA-N	436.468	1.987	50	20	IDGD	
COc1ccc(C(=O)NC2=S=C(C(=O)NNc3ccccc3S(C)(=O)=O)C=C2)cc1	758294460	IRDXVHYMHXEJRX-UHFFFAOYSA-N	445.522	1.577	50	20	IDGD	
O=C(CCc1nnc(-c2ccccc2)o1)N1CCN(S(=O)(=O)CBr)CC1	758524885	YAUDIVOFWHAXLJ-UHFFFAOYSA-N	443.323	1.496	50	20	IDGD	
CCN=c1nc(NCC)n2c(SCC(=O)NNc3cc(F)cc(OC)c3)n[nH]c2n1	759311386	VDEYNNWWFFZECB-UHFFFAOYSA-N	435.489	1.188	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2sccc2OC)c1	760335781	ACCUAGALKOEOCS-UHFFFAOYSA-N	447.560	1.411	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N2CCC(S(C)(=O)=O)CC2)cc1Br	760767661	ZKEVWGPDENZLCX-UHFFFAOYSA-N	434.312	1.321	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCOc2ncccc2Cl)c1	761779994	BYKOKVIRKRSKRB-UHFFFAOYSA-N	441.897	1.008	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)[C@H](C)NS(=O)(=O)c1cccs1	762370074	GPNHDELNZITRLS-NSHDSACASA-N	429.545	1.363	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)c1cc(F)c(O)c(F)c1	762621744	LDHWCSQAMDNWLT-UHFFFAOYSA-N	438.862	1.903	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)n(-c2ccc(F)cc2)n1	763558959	OSUFIFJPBIZRKW-UHFFFAOYSA-N	425.376	1.448	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cc(-n3cnnn3)ccc2F)c2ccccc2n1	763615928	RLKXGSQFQLTSER-UHFFFAOYSA-N	434.391	1.058	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1ccccc1SCCC(N)=O	763628652	LEHQBNNLHDXQKF-UHFFFAOYSA-N	440.485	1.010	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(C)cc2OCCN(C)C)c1	763631159	VSXCACBLZYSKEU-UHFFFAOYSA-N	428.489	1.409	50	20	IDGD	
Cc1ccnn1-c1ccccc1NC(=O)C(=O)NNC(=O)COc1ccc(Cl)cc1	763684110	FJKYPVWFAYNUBO-UHFFFAOYSA-N	427.848	1.999	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)cnc1Br	763737020	WHWNCSBPSIZAGZ-UHFFFAOYSA-N	446.305	1.691	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)C(=O)Nc2ccccc2F)c2ccccc2c1=O	763801131	HKSPRUCGKOIMSI-UHFFFAOYSA-N	425.420	1.735	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)N2CCc3ccc(Br)cc32)cc1	763809291	MUXKOOQJBYQNCF-UHFFFAOYSA-N	432.274	1.873	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(N3CCCS3(=O)=O)c2)cc1	763830667	RTDOUPNPVFBCKD-UHFFFAOYSA-N	430.486	1.189	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)OCC(=O)N3)c1C	763853480	ZPTXWJOBAVNDLT-CYBMUJFWSA-N	426.429	1.188	50	20	IDGD	
Cc1nnc(-c2cccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc3ccc(F)cc3)c2)n1C	763872084	KBHSIRGJFCYHRZ-LBPRGKRZSA-N	440.435	1.483	50	20	IDGD	
CCc1nn(C)cc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1cccc(Br)c1	763884428	WKZHLELULRZPAS-JTQLQIEISA-N	438.282	1.298	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(S(C)(=O)=O)c2)cc1OC	763910272	AUXBWDUYGDVRIK-UHFFFAOYSA-N	449.485	1.287	50	20	IDGD	
CCCc1c(NC(=O)C(=O)NNC(=O)Cc2ccc(F)cc2)cnn1-c1cc(C)ccn1	763933425	XWURTWGTHAULQQ-UHFFFAOYSA-N	438.463	1.996	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)c(O)c1	764105559	UONIGJHUNVEJIL-ZIAGYGMSSA-N	444.463	1.853	50	20	IDGD	
CC(C)(C)OC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)c(F)c1	764163932	NMWVRLZSWZEQSN-KRWDZBQOSA-N	443.431	1.871	50	20	IDGD	
O=C(CC1CCCC1)NNC(=O)C(=O)N1C[C@H](C(=O)N2CCCCC2)Oc2ccccc21	764184235	PCOWUSYDXAZHEF-LJQANCHMSA-N	442.516	1.521	50	20	IDGD	
O=C(CCc1ccccc1)NNC(=O)C(=O)Nc1ccc(S(=O)(=O)C(F)F)cc1	764186100	VZAHRXGGAFIQRE-UHFFFAOYSA-N	425.413	1.402	50	20	IDGD	
CN(C)CC(=O)NNC(=O)C(=O)Nc1ccc(Oc2ccc(C(F)(F)F)cn2)c(F)c1	764204315	QUHYSRCAUYKGNN-UHFFFAOYSA-N	443.357	1.679	50	20	IDGD	
COCC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2c(Cl)cccc2Cl)cc1	764220969	IJXKATKHKSVCNH-UHFFFAOYSA-N	439.255	1.978	50	20	IDGD	
CO[C@H](C)C(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)c1	764240022	XTGHZFJQGZEPAC-CQSZACIVSA-N	437.456	1.401	50	20	IDGD	
CCOCC(=O)NNC(=O)C(=O)Nc1ccc(C(=O)N2CCC[C@@H]2c2ccccc2)cc1	764319090	JRWOHMTZEUMRDV-LJQANCHMSA-N	438.484	1.786	50	20	IDGD	
CCNC(=O)N1CCc2ccc(NC(=O)C(=O)NNC(=O)c3ccc(Cl)cc3F)cc21	764411202	SQHBPADMUUSVNK-UHFFFAOYSA-N	447.854	1.971	50	20	IDGD	
O=C(CSc1nnc(-c2cccnc2)n1Cc1ccco1)NNC(=O)c1ccccn1	764430477	RBVLDZDGEVYNPF-UHFFFAOYSA-N	435.469	1.930	50	20	IDGD	
COc1nccnc1NNC(=O)[C@H](CCSC)NS(=O)(=O)c1ccccc1F	764481899	NSTCANLJJLCURE-LBPRGKRZSA-N	429.499	1.168	50	20	IDGD	
C[C@H]1CCCC[C@]12NC(=O)N(CC(=O)NNC(=O)c1cc(-c3cccs3)[nH]n1)C2=O	765569422	IOLNRIGYIUVHGO-WLRWDXFRSA-N	430.490	1.400	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3ccc(C)c([N+](=O)[O-])c3)CC2)cc1	765753946	GHEYTUZUDGWADW-UHFFFAOYSA-N	425.489	1.790	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](CC(F)F)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	765777179	IEAMHDFPOJYYSP-CYBMUJFWSA-N	442.467	1.389	50	20	IDGD	
CC(=O)N[C@@H](C(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1)C1CCCC1	766661515	WQINOIRABJSBMX-OAQYLSRUSA-N	449.983	1.300	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)N[C@@H]2COc3cc(OC)ccc3C2)nc1	768110697	FXSNHJJSTJHOFQ-HNNXBMFYSA-N	449.533	1.751	50	20	IDGD	
C[C@H]1CN(Cc2ccc(CNC(=O)NNc3nc(O)c4cnn(C)c4n3)cc2)C[C@@H](C)O1	770341301	MFSXKAIHFXMKSP-OKILXGFUSA-N	440.508	1.504	50	20	IDGD	
CCOC(=O)c1cn(C)nc1NC(=O)C(=O)NNc1ccc(Br)c(F)c1	770816054	QRRDHPIWHURMHI-UHFFFAOYSA-N	428.218	1.580	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)c3ccc4c(c3)C(=O)N(C3CCCCC3)C4=O)nc21	770974929	RKNNPMPJNSXJGH-UHFFFAOYSA-N	435.444	1.755	50	20	IDGD	
O=C(CN1C(=O)c2ccccc2S1(=O)=O)NNc1ccc(Br)c(F)c1	771682023	QZMAPZORAGLEFZ-UHFFFAOYSA-N	428.239	1.876	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1cc(Br)cc(S(C)(=O)=O)c1F	772064985	OURIMIADEDXOQT-ZETCQYMHSA-N	439.259	1.094	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@H]2CCO[C@H](C(C)C)C2)cc1	772616085	CAVQKGJEBAUGDQ-RDJZCZTQSA-N	426.539	1.150	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)Nc1cnn(Cc2nnc3n2CCCC3)c1	772636430	PLNFSTBHAAVTGD-UHFFFAOYSA-N	446.475	1.511	50	20	IDGD	
CCS(=O)(=O)Nc1ccccc1C(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772883502	BISUZORMCDYEEV-UHFFFAOYSA-N	438.893	1.179	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)[C@@H]1CCCCN1C(=O)c1ccccc1	772883515	BXUMONAECDIGOQ-SFHVURJKSA-N	442.903	1.799	50	20	IDGD	
Cc1cc(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)sc1C	773227038	PDHFGRRMAQRZJJ-UHFFFAOYSA-N	443.572	1.773	50	20	IDGD	
O=C(NNc1ccccc1[N+](=O)[O-])C(=O)Nc1cccc(S(=O)(=O)N2CCCC2)c1	773654500	DFUDWVBONMRVJB-UHFFFAOYSA-N	433.446	1.461	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)c2cc(Cl)c(OCC(N)=O)c(OC)c2)nc1C	778427630	DBNZRHKMUANJCO-UHFFFAOYSA-N	437.840	1.245	50	20	IDGD	
O=C(CCc1ccccc1O)NNS(=O)(=O)c1cc(C(=O)O)c(F)c(Cl)c1F	779832522	OOWIHOSZQJTCKC-UHFFFAOYSA-N	434.804	1.964	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)c2cc(Br)cc(S(N)(=O)=O)c2C)c1	780796416	XSQRUDMASCEXGF-UHFFFAOYSA-N	442.291	1.948	50	20	IDGD	
CCC1(C(=O)NNC(=O)CNC(=O)OC(C)(C)C)CCN(C(=O)c2ccccc2)CC1	781355626	BMLINKHRMSZHDX-UHFFFAOYSA-N	432.521	1.991	50	20	IDGD	
Cn1cc(CNC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c(-c2ccccc2)n1	782754178	VGDBZYNRQIHELM-UHFFFAOYSA-N	431.456	1.478	50	20	IDGD	
COc1ccc(Cn2nccc2NC(=O)C(=O)NNc2cc(C)nc(C)n2)c(OC)c1	783325613	ODYGZKSNIXOMJM-UHFFFAOYSA-N	425.449	1.437	50	20	IDGD	
Cc1ccccc1NC(=O)NNC(=O)C(=O)Nc1cc2c(cc1[N+](=O)[O-])OCCCO2	783411567	SZZUPAVQAAVXAZ-UHFFFAOYSA-N	429.389	1.856	50	20	IDGD	
CC(C)Cn1ncc(NC(=O)C(=O)NNC(=O)CNC(=O)c2cccs2)c1C(F)F	784004472	GPIDXENVFNQHPP-UHFFFAOYSA-N	442.448	1.054	50	20	IDGD	
CNC(=O)[C@@H]1CN(C(=O)C(=O)NNc2ccc(C#N)c(C(F)(F)F)c2)c2ccccc2O1	784231906	JXILQWIRAHGQAY-INIZCTEOSA-N	447.373	1.560	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2cccc([N+](=O)[O-])c2C)cc1-n1nnnc1C	784352902	ALDTYRBQHSXFEN-UHFFFAOYSA-N	426.393	1.278	50	20	IDGD	
O=C(NNc1nc(-c2ccccn2)nc2c1CCC2)[C@H]1CC=CC[C@H]1C(=O)N1CCOCC1	784783997	LQVJBTABOGSOHA-DLBZAZTESA-N	448.527	1.912	50	20	IDGD	
CNS(=O)(=O)c1ccc2c(c1)N(C(=O)C(=O)NNc1ccc(F)c(F)c1F)CC2	784807434	YMLLWUYCZWNCNR-UHFFFAOYSA-N	428.392	1.044	50	20	IDGD	
Cc1ccc(-n2nc(C)cc2NC(=O)C(=O)NNc2ccnc(Br)c2)nn1	784837643	ZWJYVLBBGYHGRD-UHFFFAOYSA-N	431.254	1.518	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNc2ccc(C(F)(F)F)nn2)c(C)c1	784891135	DWVWVCQJKCDTSA-UHFFFAOYSA-N	427.339	1.437	50	20	IDGD	
Cc1cc(S(N)(=O)=O)cc(NC(=O)C(=O)NNc2cccc(C(F)(F)F)n2)c1C	784954504	OMFZGMKYCWQDNK-UHFFFAOYSA-N	431.396	1.446	50	20	IDGD	
O=C(COC(=O)[C@@H]1[C@H]2CC[C@@H](O2)[C@@H]1C(F)(F)F)NNC(=O)c1cccc([N+](=O)[O-])c1	785809312	YQFLQIVNGCDAPY-OXHZDVMGSA-N	431.323	1.255	50	20	IDGD	
COCc1ncsc1C(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	786389432	BTBUHGKZBHHZEP-UHFFFAOYSA-N	437.953	1.522	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccc(Cl)cc2)cc1N1CCNC1=O	787544511	RUEDJEPCNAOXHA-UHFFFAOYSA-N	429.864	1.507	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(Oc2cccc(F)c2F)nc1	787550571	VBIKSGOUVKMQBF-LLVKDONJSA-N	438.387	1.290	50	20	IDGD	
CN(C)NC(=O)Nc1cccc(NC(=O)CN2C(=O)N[C@@](C)(c3ccc(F)cc3)C2=O)c1	788258404	ALCNYSRJDCYIQA-NRFANRHFSA-N	442.451	1.830	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1)NOC[C@H]1CCOC1	788327394	LCRKIQYLDYCLHO-INIZCTEOSA-N	437.460	1.301	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1ccccc1N1C[C@H]2CC[C@H]1C2	790957661	FBWHMUYXFHYTBS-KBPBESRZSA-N	441.513	1.253	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1cc([C@@H]2CCCOC2)nn1C	790965198	HWYYKTKOPZKKJF-QWHCGFSZSA-N	449.895	1.521	50	20	IDGD	
O=C(Cc1csc2ccc(Br)cc12)NNC(=O)[C@@H]1CCS(=O)(=O)C1	791477984	RCDFZTCMCDUWHS-SECBINFHSA-N	431.333	1.788	50	20	IDGD	
O=C(NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)Nc1cccc2c1CCO2	797670456	FHQNPWYXDQPLGO-UHFFFAOYSA-N	430.486	1.873	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)N[C@H]1COc2cc(F)c(Br)cc21	799912358	WGFYLVXMYNMDRV-NSHDSACASA-N	441.213	1.375	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNS(=O)(=O)c2cccc3c2OCO3)c1	800835410	YTSLZCRBIQFOMI-UHFFFAOYSA-N	429.248	1.810	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)CN1CCN(c2cc(C(F)(F)F)ccn2)CC1	801541718	KOTCORPYMFDYLQ-UHFFFAOYSA-N	435.450	1.921	50	20	IDGD	
C[C@@H](CCNS(=O)(=O)c1ccccc1)NC(=O)NNC(=O)c1c[nH]c2ccccc12	801797594	KNXBSTGYAQCVQJ-AWEZNQCLSA-N	429.502	1.869	50	20	IDGD	
NS(=O)(=O)c1ccc(CC(=O)NNC(=O)Nc2ccc(Br)cc2)cc1	802000339	RSHHYSRCRXTNLJ-UHFFFAOYSA-N	427.280	1.492	50	20	IDGD	
COc1ccc(C2=NO[C@H](CNC(=O)NNC(=O)c3ccc4c(c3)OCCO4)C2)cc1F	802350016	QSEOIEGOBFCRFE-AWEZNQCLSA-N	444.419	1.743	50	20	IDGD	
O=C(COC(=O)CCCS(=O)(=O)c1ccc(Cl)cc1)NNC(=O)c1ccccc1	803760488	FXRZCCNBXVAXMY-UHFFFAOYSA-N	438.889	1.898	50	20	IDGD	
CN(C)S(=O)(=O)C[C@H](NC(=O)NNC(=O)c1cccc2ncccc12)C(F)(F)F	805767214	GRBYSOCRFUNVAR-ZDUSSCGKSA-N	433.412	1.001	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3nccnc3c2Br)c(O)c1	806976858	YMDCQVFTWJTSTR-UHFFFAOYSA-N	444.245	1.806	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2cc(F)c(N3CCOCC3)cc2F)n1	807025870	XPVFOJQOHHTCGH-UHFFFAOYSA-N	449.462	1.519	50	20	IDGD	
COc1cccc(N2CCN(C(=O)NNC(=O)c3csc(N4CCOCC4)n3)CC2)c1	807128116	ANRMZIASWBRSRP-UHFFFAOYSA-N	446.533	1.165	50	20	IDGD	
CC(C)(C)[Si](C)(C)OCCN1CCN(S(=O)(=O)[C@@H]2CCS(=O)(=O)C2)CC1	808735406	UXTFGUBFFBTPRL-OAHLLOKOSA-N	426.677	1.143	50	20	IDGD	
COC(=O)C1(CS(=O)(=O)NNC(=O)c2ccc(OC)c(Br)c2)CCCC1	811684336	DUJDSCKTZIMFEZ-UHFFFAOYSA-N	449.323	1.755	50	20	IDGD	
COC[C@@]1(CNC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)OCCc2ccccc21	811880993	SFGVDGKLGVWTIF-HSZRJFAPSA-N	435.484	1.931	50	20	IDGD	
C[C@H](CC(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1)c1ccc(F)c(Br)c1	812535458	WROSACJIRKDZPH-MWLCHTKSSA-N	436.303	1.599	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)N[C@@H](CN1CCOCC1)c1ccc(C)cc1	813492091	IZHOQWBBHAKCKJ-IBGZPJMESA-N	442.516	1.786	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)[C@@H]2CCCN(c3ccccc3)C2=O)n1	814609206	ZKNTVVONKMGFON-OAHLLOKOSA-N	430.486	1.128	50	20	IDGD	
CCOC(=O)CN1C(=O)C(F)(F)c2cc(NC(=O)C(=O)NN(C)c3ccccc3)ccc21	815589922	GYVPPNCRIGMHTI-UHFFFAOYSA-N	446.410	1.794	50	20	IDGD	
CCOC(=O)c1ccc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)N(C)C)cc1	815752248	KMQWENZBKUEGEZ-UHFFFAOYSA-N	434.474	1.195	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NNC(=O)Cn2cnc3ccccc32)s1	896463963	BABUITGNCJDXKM-INIZCTEOSA-N	447.542	1.407	50	20	IDGD	
COc1ccc(S(=O)(=O)N[C@H](C)C(=O)NNC(=O)c2ccc3ccccc3n2)cc1	912768942	PZITYXOPNBKAED-CYBMUJFWSA-N	428.470	1.371	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2cccc(I)c2)C[C@@H](C)O1	912920814	DPRMBHURCLIMCP-TXEJJXNPSA-N	431.274	1.552	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)c1cc(C(F)(F)F)ccc1Cl)C(=O)NNC(C)=O	913173043	DRPZPKXRSUUOPA-NSHDSACASA-N	447.888	1.926	50	20	IDGD	
CNC(=O)CN1CCC(NC(=O)/C(C#N)=C\c2cc(C)n(C[C@H]3CCCO3)c2C)CC1	914780045	BFGWYYKNGWDPDB-JAORQVBISA-N	427.549	1.518	50	20	IDGD	
CC[C@H](CNC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)c1ccccc1	915920237	NWJDSKYNQUJIMJ-QGZVFWFLSA-N	446.577	1.838	50	20	IDGD	
O=C(COc1ccccc1-c1ccccc1)NNC(=O)NCCC(=O)N1CCOCC1	916251346	GZZGNCAWPQPWAU-UHFFFAOYSA-N	426.473	1.312	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCCNC(=O)NNC(=O)c2ccc3ccccc3n2)cc1	916281213	KEKZVWXCHSVKOW-UHFFFAOYSA-N	427.486	1.466	50	20	IDGD	
COc1cc(C)c([C@@H](C)NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1OC	916484233	BXRQZTKHKURBFC-CYBMUJFWSA-N	425.449	1.693	50	20	IDGD	
CCN1C(=O)c2ccc(C(=O)NNC(=O)c3ccc(Cl)cc3OC)cc2S1(=O)=O	917522076	HMSZNZZSIVHKNX-UHFFFAOYSA-N	437.861	1.588	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNS(=O)(=O)c1cc(C(=O)O)cc2c1CCC2	917721039	PLQFQIGHKSUPOS-UHFFFAOYSA-N	434.470	1.661	50	20	IDGD	
O=C(Cn1cnc2ccccc21)NNC(=O)[C@@H]1CCCN(C(=O)CCOc2ccccc2)C1	918552499	VRUOGRFBIJRSQC-GOSISDBHSA-N	449.511	1.891	50	20	IDGD	
CSCC[C@@H](NC(=O)c1ccc([N+](=O)[O-])o1)C(=O)NNC(=O)c1cccc(N(C)C)c1	919805617	BQYXRCCQYZTZIF-CQSZACIVSA-N	449.489	1.567	50	20	IDGD	
NC(=O)c1ccc(/C=C/C(=O)N2CCC[C@H]2C(=O)NNC(=O)c2c[nH]c3ccccc23)cc1	920031241	AAAGSZIZPQOKCD-JTPHSUOKSA-N	445.479	1.732	50	20	IDGD	
CC(C)(C)C(=O)Nc1ccc(S(=O)(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1	921205303	MCBCPMYRSDAVFR-KRWDZBQOSA-N	433.486	1.821	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NCCc2coc(-c3ccccc3)n2)c2ccccc2c1=O	1115958968	JHLVZSSKUUKKTR-UHFFFAOYSA-N	432.440	1.775	50	20	IDGD	
NC(=O)[C@@H]1CCCN(c2ccc(C(=O)NNC(=O)CSc3ccccc3O)cc2)C1	1116420319	SWQGIYXLIKXMDU-OAHLLOKOSA-N	428.514	1.647	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1)c1ccc(F)cc1F	1340529052	RHPJOZKBLKEMRC-OAHLLOKOSA-N	430.455	1.674	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)c2ccc(S(=O)(=O)NC[C@@H](C)O)cc2)c1C	1346622050	YGQKSAVXRPHPAA-ZBFHGGJFSA-N	449.529	1.191	50	20	IDGD	
CC(C)CNC(=O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@](C)(Cl)CCl)C2	1778119743	BILXWAAFADSCEX-MDASCCDHSA-N	436.380	1.509	50	20	IDGD	
O=C(c1cn2cc(F)ccc2n1)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1778545469	PNZWPINODIOWAR-PBHICJAKSA-N	443.248	1.607	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc(O)nc2)C1	1780125809	CGJSWKBRRABTIZ-ZBQZNYHESA-N	440.338	1.946	50	20	IDGD	
Cc1c(Br)c(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](F)Cl)CCO3)nn1C	1780367410	WZBRHECQZKEDOI-SWLSCSKDSA-N	437.697	1.469	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)c(O)c1	1780551505	YGNFJDCELDCGGO-DJJJIMSYSA-N	441.322	1.875	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cn1nnc3ccccc31)C2	1780700097	MAVPEQICXMKKQH-RRMPHLOHSA-N	433.940	1.963	50	20	IDGD	
Cc1nnc(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](F)Br)C2)o1	1780771949	WOQZAAJNUZHMMR-DIOULYMOSA-N	433.278	1.125	50	20	IDGD	
O=C(CCc1noc(-c2ccccc2)n1)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1780894351	KTQQBRZFXRVYRR-IIBYNOLFSA-N	448.907	1.099	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)o1	1781331000	CJWWOEDPMAKBKX-CZUORRHYSA-N	432.246	1.372	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)C3CCC4(CC3)OCCO4)C2)C1	1782943669	KKQFSWNZEFNROK-LPHOPBHVSA-N	430.929	1.003	50	20	IDGD	
O=C(c1nc[nH]n1)N1CCO[C@@]2(CCN(C(=O)[C@@H](Br)Cc3ccccc3)C2)C1	1783021777	BAZSQKMSLCDOPE-HNAYVOBHSA-N	448.321	1.254	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cccnc3OC)CCO2)C1	1783344412	QBFPILKABDKWGJ-KSSFIOAISA-N	426.311	1.707	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)[C@H](C)Br)CCO2)C1	1783355076	IZAYSMYLFVEDGJ-MJVIPROJSA-N	426.149	1.773	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)COc3cc(Cl)ccn3)CCO2)C1	1783533686	FOIMWZXRQJOKLN-PXAZEXFGSA-N	446.729	1.727	50	20	IDGD	
Cn1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]3C2)c(C(F)(F)F)c1	1784091287	YOWSLCDXKMZVCI-AZHAFVHUSA-N	437.846	1.237	50	20	IDGD	
C[C@@H](Cc1ccc(F)cc1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]2C1	1784094803	SHYAMDMJHLKGJK-SKMQDVENSA-N	426.916	1.584	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H]3CCc4nc[nH]c4C3)C2)C1	1784353074	WTAIHMGWPCWPDN-AGRHKRQWSA-N	429.348	1.581	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)COC(=O)C(F)(F)F)C[C@@H]21	1784618024	QZUWIFKRMNFGFM-CYDGBPFRSA-N	428.835	1.479	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@](C)(O)C(F)(F)F)[C@H]2C1	1784875999	OMYVXDXDYUCCHL-LYEQHPFYSA-N	435.270	1.516	50	20	IDGD	
O=C(CCc1cccc([N+](=O)[O-])c1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21	1784881982	AEKFABFVLYLPEX-DKIMLUQUSA-N	439.896	1.107	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](N)c3ccccn3)[C@H]2C1	1786866487	QVSIJXKPNPZMQW-CUINURIISA-N	439.354	1.092	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)c1ccc2cncn2c1	1788426804	JULDFNGEFLKQRZ-XIRDDKMYSA-N	435.322	1.713	50	20	IDGD	
C[C@H]1CC[C@H](C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)CC1	1788610866	CNOPCTRYWBNVGA-UKSSEWCLSA-N	443.548	1.105	50	20	IDGD	
CC(C)(C)n1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]3C2)nn1	1789924603	OQUJEBFTABOMFP-IMIFBBOLSA-N	446.321	1.317	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cn3cc(C)cn3)C[C@@H]21	1790962049	VCVQWYNUIJFNBA-VGWMRTNUSA-N	427.343	1.345	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)nc(Cl)c3)C[C@@H]21	1791056806	CJHIITFKRZZXAQ-UKJIMTQDSA-N	446.729	1.817	50	20	IDGD	
CC(C)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CC(=O)N(C3CCCC3)C1)C2	1792782182	HMFRKCFMKYLCOQ-GGXPGOJBSA-N	439.984	1.632	50	20	IDGD	
CC(C)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCn1c(=O)oc3ccccc31)C2	1792782396	NHGPJZYVTAXWRE-CCWDJLKJSA-N	449.935	1.839	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3cnccc3n1)C2	1792868423	YVWYVICYKZMNLB-LJGDNWOOSA-N	447.333	1.864	50	20	IDGD	
N#Cc1cccc(CCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)c1	1792939230	UCAHAPMJUCGADD-KOUNCHBCSA-N	431.301	1.123	50	20	IDGD	
C[C@H](CBr)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCc1ccc(O)nn1)C2	1792990695	GDDXUKNKHUOEDU-REBRKWNGSA-N	425.327	1.784	50	20	IDGD	
O=C(NC1(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](O)CCl)CC1)OCc1ccccc1	1793111498	LFEXINTWTCBLBM-MHORFTMASA-N	449.935	1.683	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nc(OC)ccc1[N+](=O)[O-])C2	1793449947	VCSHBWYXSXBAJY-OQMKEHIESA-N	440.884	1.609	50	20	IDGD	
CC(C)(C)c1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCBr)[nH]n1	1795115712	ISLGQGOCXFVJHS-DRXBFXEBSA-N	427.343	1.695	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCN1CCCCC1	1795289784	MACACPPGBWLGII-XLMAVXFVSA-N	430.387	1.483	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc2c[nH]nc12	1796176762	WKNNRCCWZLUPHU-OEYIWLLWSA-N	435.322	1.797	50	20	IDGD	
O=C(Cc1cc(F)ccc1Cl)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1	1796190176	YAWNOXLUJYBFQY-REPLKXPHSA-N	444.699	1.653	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)c1nc(Cl)ccc1F	1796190853	SZHFACVJSXMVKF-QDMKHBRRSA-N	431.660	1.120	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)c1ccc(N2CCCC2)c(F)c1	1798557794	CUFDFAZBMRWRTL-WTLGNFPFSA-N	439.915	1.229	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cncn1C)C2	1799220160	XZGLCKUUWPEHRA-QDMKHBRRSA-N	441.444	1.819	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)CNC(=O)OC(C)(C)C)C2	1799265102	ZNVMKBBDJWNCMV-RBZJEDDUSA-N	431.961	1.754	50	20	IDGD	
Cc1c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Br)nc2ccccn12	1799347477	NPQLFWQTTNXLCN-VZAMPYOESA-N	439.285	1.536	50	20	IDGD	
COc1ncc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)Br)cc1C	1800757725	JBSOKGMDGYYYFX-MHEUCROKSA-N	426.311	1.385	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc(F)cc1F)C2	1800761932	JSBVBKHDGBUEGK-MMPOEDRJSA-N	431.277	1.880	50	20	IDGD	
CS(=O)(=O)c1ccc(F)c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](O)CCl)C3)c1	1800845478	KXDQJPDXOJKWHF-AZKPJATDSA-N	432.901	1.081	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc(Cl)cc1OC)C2	1800979365	BZHPHPJQIWRONQ-QHHYFVSCSA-N	445.343	1.735	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1[C@H]2C=CS[C@H]21	1801319307	DDKBEGJMOGPBSO-HKUMGMRESA-N	427.530	1.634	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@H]1CCN(C(=O)c2c[nH]c(=O)cn2)[C@@H]1c1cccnc1	1803016468	XZBINXUKUVQCMX-SUYBPPKGSA-N	448.321	1.516	50	20	IDGD	
Cn1cccc1C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1	1805351684	FSSZOYLURLRIND-JXFKEZNVSA-N	447.499	1.052	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC2(CCCN(C(=O)CNC(=O)c3cccnc3)C2)CC1	1806872449	GMLHDLIZMMLTPJ-KRWDZBQOSA-N	436.940	1.296	50	20	IDGD	
Cc1c(C(=O)NC[C@@H]2CCN(C(=O)[C@H](F)Cl)[C@@H]2c2cccnc2)cn2[nH]cnc(=O)c12	1811303747	UPKHOSVSEQLONT-XKQJLSEDSA-N	446.870	1.580	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)[C@@H]2CCC(=O)N2C)[C@H]1c1cccnc1	1812869185	SIGIDSORJJXKFB-GUSZCTEKSA-N	437.338	1.492	50	20	IDGD	
C[C@H](C(=O)NC[C@@H]1CCN(C(=O)CO[Si](C)(C)C)[C@H]1c1cccnc1)n1cnnn1	1813471430	YFYXLIFILZCGOS-HFTRVMKXSA-N	431.573	1.187	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cccc(-n3cncn3)c2)[nH]n1)[C@@H](O)CCl	1814871732	CHUYHAORONPFOC-SJORKVTESA-N	443.895	1.896	50	20	IDGD	
O=C(CN1CCOC1=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](F)Br)[nH]n1	1815028607	VHKQTXNINMBPFX-ZWNOBZJWSA-N	432.250	1.545	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](C)NS(=O)(=O)CC)n[nH]1	1815167445	KKTLDIMLPLTCLR-DYEKYZERSA-N	433.962	1.747	50	20	IDGD	
Cc1ccc(C)c(C(=O)N[C@@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)c1	1815347741	NEKGABLEBFSWNS-QGZVFWFLSA-N	449.341	1.979	50	20	IDGD	
Cc1nc2ncccn2c1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1	1818667984	UBHVQNHEMNLRFI-UONOGXRCSA-N	431.884	1.666	50	20	IDGD	
C[C@@H]1CCC[C@H]1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnccc1C(=O)NN)CC2	1818880834	WUZMXCNKTQKALK-FRRDWIJNSA-N	442.545	1.804	50	20	IDGD	
CNC(=S)NCCC(=O)N[C@H]1CCc2nc(NC(=O)CO[Si](C)(C)C)sc2C1	1820165674	LONNIISMXCKCLU-NSHDSACASA-N	443.671	1.391	50	20	IDGD	
CCN(CC)C[C@@H](C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1	1821680132	OEGIXWLFKIPROW-AEFFLSMTSA-N	449.600	1.753	50	20	IDGD	
COC(=O)C12CC(C(=O)N3CCC([C@H]4CCCCN4C(=O)[C@@H](O)CCl)CC3)(C1)C2	1824184713	CUFAWUAHSIARQP-SHEVMCDFSA-N	426.941	1.549	50	20	IDGD	
O=C(CCc1ccc(O)nn1)Nc1nc2c(s1)C[C@H](NC(=O)C(Cl)Cl)CC2	1824491461	GQLFUDRFLQAQOR-SECBINFHSA-N	430.317	1.987	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CN1CCOC1=O)CC2	1825635638	IZYBCEDYVQNALF-RKDXNWHRSA-N	431.312	1.291	50	20	IDGD	
C[C@@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1)c1ccccn1	1827060345	YEMRVIWIVJATPK-WZONZLPQSA-N	449.360	1.798	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC([C@@H]2CCCCN2C(=O)Cn2ccnn2)CC1	1827235296	ZYYZWQIVQCLORZ-HOCLYGCPSA-N	426.359	1.929	50	20	IDGD	
C=C[C@H](O)C(C)(C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1	1828889737	VCHQQKYFBVDBJX-MOPGFXCFSA-N	436.597	1.552	50	20	IDGD	
CC(C)=NO[C@H](C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1	1830416113	QNOPIEKAJHAAQW-DYESRHJHSA-N	443.353	1.401	50	20	IDGD	
C[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1)n1ccnc1	1830981379	AFCMXILOQJQDGA-ZTFGCOKTSA-N	433.336	1.137	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)C3CCN(C(C)C)CC3)C2)C1	1831639940	HEIIZCQZNNTURB-UGKGYDQZSA-N	444.016	1.971	50	20	IDGD	
CC(=O)c1cc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)n[nH]1	1831871486	GOYPPFVUQQJYTL-IBGZPJMESA-N	446.552	1.219	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3ccccn3)CCO2)C1	1833188099	GOKCVQLVAFKYDG-PMACEKPBSA-N	444.359	1.707	50	20	IDGD	
C[C@@H](Cn1cccn1)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1833191609	OZSVUKUVNKQNRP-JXFKEZNVSA-N	426.945	1.241	50	20	IDGD	
CC(C)(CCl)C(=O)NC1CCN(C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1	1833215143	BQISTBQPNVVHEH-UHFFFAOYSA-N	438.956	1.943	50	20	IDGD	
CC[C@H](C)[C@@H](N)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](C)CBr)CC2)CC1	1833261965	FGXGSSCPNJPHIY-RLFYNMQTSA-N	445.446	1.962	50	20	IDGD	
Cc1cc(C(=O)NC2CCN(C3CCN(C(=O)CO[Si](C)(C)C)CC3)CC2)n(C)n1	1834188476	BVOILXGHBNDSQM-UHFFFAOYSA-N	435.645	1.765	50	20	IDGD	
C#CCO[C@H](C)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](C)Br)CC2)CC1	1836861500	BQZQBKCBBAECLY-HUUCEWRRSA-N	429.355	1.807	50	20	IDGD	
Cn1c(C(=O)N2CCC(OC3CCN(C(=O)CO[Si](C)(C)C)CC3)CC2)cccc1=O	1837378971	PFHCKYPWJNRGFL-UHFFFAOYSA-N	449.624	1.849	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)CCc3ccc[nH]3)CC2)CC1	1837938067	ADUBOVRAXCYAJQ-UHFFFAOYSA-N	447.580	1.319	50	20	IDGD	
Cc1noc(CC(=O)N2CCC(OC3CCN(C(=O)[C@H](F)Br)CC3)CC2)n1	1837950979	VLMVXSPOJCWSLW-INIZCTEOSA-N	447.305	1.610	50	20	IDGD	
C=CC(=O)N[C@@H](C)C(=O)N1CCC(OC2CCN(C(=O)[C@@](C)(Cl)CCl)CC2)CC1	1838427818	IISGEAJRCGVZNW-XOBRGWDASA-N	448.391	1.912	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cn4ccsc4n3)C2)C1	1839145470	IKZWRXNZBPPMEL-ACJLOTCBSA-N	426.926	1.483	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3C[C@@]3(F)Cl)C2)C1	1839155058	HKRUNHFILPYITQ-DDWPSWQVSA-N	431.719	1.604	50	20	IDGD	
O=C(/C=C/C1CCCC1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1839180706	ZBDHFXCFPMDBLV-BHMLKFMNSA-N	433.318	1.880	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)C3CCC(O)CC3)C2)C1	1839967567	QKOKKFBTHYUMNM-FCJNSDPXSA-N	447.370	1.167	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)/C=C/c3cccc(C)n3)C2)C1	1840149721	YWIDHBXYFCDGMX-RVLLMHTFSA-N	437.924	1.113	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3c[nH]c(C(C)(C)C)c3)C2)C1	1840151082	VXOLVQJYXLPYLZ-IIBYNOLFSA-N	441.956	1.636	50	20	IDGD	
COc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)ccc1O	1840189203	CPLQVAONWPEGRX-GOSISDBHSA-N	433.288	1.275	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)CSc2ccncc2)C1	1841964253	VNAJZMXBSRNYIN-BUVRLJJBSA-N	440.529	1.511	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)CCc1cccc(C)n1)C2	1843415269	GVGNVAHVPUXLBR-YZSQISJMSA-N	436.516	1.660	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)[C@H](C)n1ccnc1)C2	1844691947	QZBILRZGAMJDAR-AWEZNQCLSA-N	441.444	1.795	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)CCN1C(=O)c3ccccc3C1=O)C2	1846360718	BYDMNVVAYFPUMJ-INIZCTEOSA-N	433.892	1.130	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)c1cccc3c1OC(C)(C)C3)C2	1846384798	KAVOMSVERYHMRA-UHFFFAOYSA-N	428.533	1.590	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)C1CCN(C(C)C)CC1	1848052056	IQRHJGGLCLEHBM-TZPGLHDLSA-N	442.564	1.443	50	20	IDGD	
CSCC[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)NNC(=S)NC(C)(C)C	14895120	TYQFZMBZBBDYBS-ZDUSSCGKSA-N	427.552	1.740	50	20	IDGD	
C[C@H]1Oc2ccccc2N(CCC(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)C1=O	16192182	DIAYRUCDLFWFHF-CYBMUJFWSA-N	445.859	1.848	50	20	IDGD	
O=C(CCC(=O)N1CCC(c2ccccc2)=N1)NNC(=O)c1n[nH]c(=O)c2ccccc12	17195886	PODXPCDUGGPWBJ-UHFFFAOYSA-N	432.440	1.101	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2ccc(-n3cccc3)cc2)cc1	17406765	YHBUIKZGLZRPSR-UHFFFAOYSA-N	426.498	1.867	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)c2ccc3c(c2)SC2=NS(=O)(=O)CCN23)cc1	18096008	YMKWOSZXBLMYRK-UHFFFAOYSA-N	430.511	1.935	50	20	IDGD	
COc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)cc1	24299029	IRCAWXCDAMOKEY-QWHCGFSZSA-N	439.465	1.116	50	20	IDGD	
Cc1ccc(-c2noc(CN3CCN(CC(=O)NNC(=O)c4ccccc4)CC3)n2)cc1	97027770	VCHVMJZBOSPFOD-UHFFFAOYSA-N	434.500	1.624	50	20	IDGD	
CC[C@H](C)C(=O)N1CCC[C@H](C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)C1	726033398	GRTJDGBBBXAQTC-ZFWWWQNUSA-N	434.449	1.184	50	20	IDGD	
O=C(NNc1nc(-c2ccncc2)no1)c1ccc2c(c1)C(=O)N(C[C@H]1CCCO1)C2=O	726377163	MQEDILYCRIHGHZ-CQSZACIVSA-N	434.412	1.664	50	20	IDGD	
Cc1csc(SCc2ccccc2C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)n1	728377766	RVVPRDYYDFWSQZ-CYBMUJFWSA-N	425.557	1.940	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NN=Cc1cc(Br)c(O)c(Br)c1	728437891	XXHMDUIRCHZDJU-LURJTMIESA-N	443.117	1.305	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)c2csc(S(N)(=O)=O)c2)c1	728528434	AWKOYCYRRDEHEJ-UHFFFAOYSA-N	434.293	1.241	50	20	IDGD	
Cc1ccc(N2CCC(C(=O)OCC(=O)NNC(=O)Cc3nc(C)cs3)CC2)nc1	728729281	KTEBHDGMKMJIRH-UHFFFAOYSA-N	431.518	1.305	50	20	IDGD	
CC(C)[C@H](CNC(=O)NNC(=O)c1cc(F)ccc1Br)N1CCOCC1	728742743	NJLJHRGMYFAYJS-HNNXBMFYSA-N	431.306	1.889	50	20	IDGD	
C[C@H]1COCCN1CCNC(=O)NNC(=O)COc1ccc(OCc2ccccc2)cc1	729615093	XBQOXGXXHWXRQO-SFHVURJKSA-N	442.516	1.696	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)Cc1csc(-c2nc[nH]n2)n1	729856454	RLVITKRXYZPYKO-UHFFFAOYSA-N	437.279	1.460	50	20	IDGD	
CS(=O)(=O)Nc1cccc(CC(=O)NNC(=O)c2cc(F)ccc2Br)c1	730219406	BGPQMXUKAIDOEI-UHFFFAOYSA-N	444.282	1.963	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)[C@H]1CCN(c2ccc3c(c2)OCCO3)C1=O	730515604	VTPUYSYFTRYTMJ-DZGCQCFKSA-N	443.431	1.565	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CC[C@H]2NC(=O)N(c3cccc(C)c3)C2=O)cc1OC	730738443	UQRZJFOUGAEORW-MRXNPFEDSA-N	440.456	1.678	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)[C@H]1CCCN(C(=O)c2cccc3ccccc23)C1	732644989	CIEJRELYJFTITF-DLBZAZTESA-N	443.525	1.274	50	20	IDGD	
COc1c(C(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)c(C)nn1C	732751075	JOJAJTGFEDENQH-UHFFFAOYSA-N	449.514	1.674	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)c1cc(=O)c2cc(Br)ccc2[nH]1	732955968	FAANHYROCUAREG-UHFFFAOYSA-N	433.218	1.075	50	20	IDGD	
COCCN(CC(=O)N(C)C)C(=O)CCC(=O)C(C#N)=C1N(C)c2ccccc2N1C	733163156	GSXIDYYVEJOPTR-UHFFFAOYSA-N	427.505	1.220	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)Oc1ccccc1	733849136	DTSVIQXPFUAWQD-MRXNPFEDSA-N	446.529	1.883	50	20	IDGD	
CCc1ccccc1O[C@@H](C)C(=O)N1CCN(CC(=O)NNC(=O)c2ccccc2)CC1	736623932	URFBUPFWIZGMTJ-SFHVURJKSA-N	438.528	1.622	50	20	IDGD	
Cc1cc(CNC(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)n[nH]1	739019637	DPQQEPQKOFQFLT-UHFFFAOYSA-N	431.460	1.564	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2cc(F)ccc2O1)c1ccc(S(=O)(=O)N2CCCC2)cc1	740813395	GPKCYVLPRJRFMQ-SFHVURJKSA-N	433.461	1.375	50	20	IDGD	
CC(=NNC(=O)Cc1cc(O)nc(S)n1)c1ccc(S(=O)(=O)CC(F)(F)F)cc1	741758727	GNCAAHBYGYIEIY-UHFFFAOYSA-N	448.448	1.890	50	20	IDGD	
O=C(C[C@@H](C(=O)NN=Cc1ccccc1F)N1CCOCC1)NN=Cc1ccccc1F	741766395	LAQJOAMDNUGBNQ-FQEVSTJZSA-N	443.454	1.656	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)CN2C(=O)Cn3c(cc4ccccc43)C2=O)c1	743841999	LGNDIYVFTHVTMG-UHFFFAOYSA-N	434.452	1.467	50	20	IDGD	
Cc1ccc(C(=O)NC2CCN(CC(=O)NNC(=O)c3ccc(C#N)cc3)CC2)s1	744395269	PUBUTEJRFGDNPO-UHFFFAOYSA-N	425.514	1.584	50	20	IDGD	
C[C@H]1CCN(CC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)CCN1Cc1ccccc1	744427766	XZPSTJCWNLHNAQ-KRWDZBQOSA-N	425.489	1.952	50	20	IDGD	
O=C(NC[C@@H](c1cccc(F)c1)N1CCOCC1)NNC(=O)c1cc([N+](=O)[O-])ccc1O	745782005	ALXOBBUXWJCUAK-KRWDZBQOSA-N	447.423	1.457	50	20	IDGD	
Cc1ccc([C@H](NC(=O)NNC(=O)c2cnn(C)c2)c2cccc(S(C)(=O)=O)c2)cc1	745908691	NJBQFSCBJXHLON-IBGZPJMESA-N	441.513	1.866	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)c2cc(S(=O)(=O)N3CCCC3)ccc2O)cc1	745990955	MLVOWQULQDRMHE-UHFFFAOYSA-N	433.486	1.325	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)NCCNS(=O)(=O)c2cccs2)c1C	747437664	MWXTVKGDQNPSTR-CQSZACIVSA-N	440.547	1.441	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)NCCNS(=O)(=O)c2cccs2)cc1	747438495	XFLJSVWJSLBXSG-UHFFFAOYSA-N	426.524	1.128	50	20	IDGD	
O=C(C[C@@H](NC(=O)c1ccccc1Cl)c1ccccc1)NNC(=O)C(=O)N1CCCC1	748246773	PIVRFGBNEPNPCW-GOSISDBHSA-N	442.903	1.971	50	20	IDGD	
O=C(COCC(=O)NNc1c(F)cc(C(=O)NC2CC2)cc1F)NCc1cccnc1	748828331	YSSGOMMQQVRKLC-UHFFFAOYSA-N	433.415	1.028	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)[C@@H]2CCCN2C(=O)c2ccc3c(c2)OCO3)c1	749563312	ZYVOEIVRKGQCNA-SFHVURJKSA-N	439.468	1.863	50	20	IDGD	
COc1ccc(N2C[C@@H](C(=O)NNc3nc(Br)cn4ccnc34)CC2=O)cc1	750247052	QGSJIBMINNPCRF-NSHDSACASA-N	445.277	1.997	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C2=NN(c3ccccc3)[C@@H](C(C)=O)C2)cc(OC)c1OC	750845875	RJPOEUOXCCXYER-QGZVFWFLSA-N	440.456	1.697	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Cc2c(C)noc2Cl)c1	751280959	MFTOGDUIGLVTOK-UHFFFAOYSA-N	428.898	1.671	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)NCc2ccccc2OCC(=O)NC[C@H]2CCCO2)o1	752362818	ORARXYKTDQXLIH-MRXNPFEDSA-N	430.461	1.406	50	20	IDGD	
NC(=O)c1cc(CNC(=O)NNC(=O)CCCOc2ccc(Cl)cc2Cl)on1	752684941	QVUQHDXRCMNHLT-UHFFFAOYSA-N	430.248	1.770	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)Cc2ccc(C(=O)NNC(=O)N[C@H]3CCOC3)cc2)cc1	752699140	JVVGFYXTWZIVRY-SFHVURJKSA-N	446.529	1.549	50	20	IDGD	
O=C(NCc1c(F)c(F)cc(F)c1F)NNC(=O)C1CCN(c2ncccn2)CC1	753043523	VCQJHGMWXAZFBN-UHFFFAOYSA-N	426.374	1.780	50	20	IDGD	
CCCN(CCNC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)C(=O)OC(C)(C)C	754669595	UOLYFCYVLVAFKU-UHFFFAOYSA-N	446.508	1.525	50	20	IDGD	
O=C(NNC(=O)c1ccc2ccccc2n1)NC1CCN(S(=O)(=O)C(F)(F)F)CC1	755304183	WTDQBRAPSDWMRL-UHFFFAOYSA-N	445.423	1.493	50	20	IDGD	
Cc1ccc(Cc2cnc(NC(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)s2)cc1Cl	755474077	BIYUDNBQEHDSEH-SNVBAGLBSA-N	445.954	1.786	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)Nc1cc(C)nn1-c1nc(C)cc(C)n1	755516329	POCBOCZUMIVHJY-UHFFFAOYSA-N	425.449	1.828	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NC2CCN(S(=O)(=O)C(C)(C)C)CC2)cc1C	755874025	APNOYAMNIUEXIK-UHFFFAOYSA-N	440.566	1.605	50	20	IDGD	
CC[C@@H](C)NC(=O)c1ccc(NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1	756186163	HREXNFXIYYQEOA-CYBMUJFWSA-N	436.472	1.928	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)Cc2ccc(F)cc2)cc1S(=O)(=O)NC1CC1	756681161	HJSTTZXKNRDOSZ-UHFFFAOYSA-N	436.465	1.670	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)Nc2cc(S(=O)(=O)N(C)C)ccc2F)c1	756683386	MSAZAMQAORDVSH-UHFFFAOYSA-N	440.453	1.560	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)CN2C(=O)NC3(C[C@H](C)C[C@@H](C)C3)C2=O)c1	757733124	KTJJLRQXZMYUSK-ZIAGYGMSSA-N	431.493	1.001	50	20	IDGD	
COC(=O)C12CCC(C(=O)NNC(=O)CCN3CCN(c4ccccc4)CC3)(CC1)C2	757782192	XPRTWQPBNKVZTI-UHFFFAOYSA-N	428.533	1.470	50	20	IDGD	
CCS(=O)(=O)CCN(C)C(=O)NNC(=O)[C@@H](C)Oc1cccc(Br)c1	758653552	LIUUWEVTHBCNQM-LLVKDONJSA-N	436.328	1.324	50	20	IDGD	
Cc1nc(COc2cccc(C(=O)NNC(=O)Nc3ccc(S(C)(=O)=O)cc3)c2)no1	759789403	UTLPBEDKXOQKQT-UHFFFAOYSA-N	445.457	1.827	50	20	IDGD	
O=C(NNC(=O)c1cccc(-n2ccc(C(F)(F)F)n2)c1)c1ccc(-n2cnnn2)cc1	760301640	OOCBEPVDXXRBOE-UHFFFAOYSA-N	442.361	1.942	50	20	IDGD	
Cc1cc(C)n(-c2ccccc2CNC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)n1	760715581	BHXYSHBWRMWVQT-UHFFFAOYSA-N	431.460	1.609	50	20	IDGD	
CSc1cccc(N2C[C@@H](C(=O)NNc3nccc(N4CCOCC4)n3)CC2=O)c1	762853068	PWKGRSJOETUUOR-AWEZNQCLSA-N	428.518	1.531	50	20	IDGD	
CS(=O)(=O)c1c(F)cc(NC(=O)C(=O)NNC(=O)c2c[nH]c3ccccc23)cc1F	763536074	KXIVCROTMAVKEK-UHFFFAOYSA-N	436.396	1.249	50	20	IDGD	
CCCOc1ccccc1NC(=O)C(=O)NNC(=O)c1cc(OC)c(OC)c(OC)c1	763538597	DQUBZOUUJAWDLV-UHFFFAOYSA-N	431.445	1.901	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(-n3nc(C)cc3C)nc2)cc1OC	763551416	WQBKRVMBHBGVCO-UHFFFAOYSA-N	438.444	1.301	50	20	IDGD	
COC(=O)c1csc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)c1C	763604931	QDQUGQDXFJOCEL-UHFFFAOYSA-N	427.442	1.633	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)[nH]n1)C(=O)Nc1c(F)cccc1-n1cccn1	763605683	QJYOMKGXJJQTLU-UHFFFAOYSA-N	433.403	1.801	50	20	IDGD	
CC[C@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2cccc(C)c2)cc1	763624626	XLUQVNPLBJVIJY-HNNXBMFYSA-N	426.473	1.688	50	20	IDGD	
COc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NNC(=O)COc1cc(C)cc(C)c1	763649865	ZIGOBMZYFICWJY-UHFFFAOYSA-N	442.472	1.179	50	20	IDGD	
COCCn1nc(C)c(NC(=O)C(=O)NNC(=O)CSc2ccc(Cl)cc2)c1C	763732311	FBICHDXDTWBWOO-UHFFFAOYSA-N	439.925	1.678	50	20	IDGD	
CCS(=O)(=O)c1cc(F)ccc1NC(=O)C(=O)NNC(=O)c1cccc(N(C)C)c1	763753509	GMNXJHBWHCVDJZ-UHFFFAOYSA-N	436.465	1.085	50	20	IDGD	
CC(C)N(C)c1cccc(NC(=O)C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c1	763791562	VSGWFOWCSZTKFM-UHFFFAOYSA-N	436.472	1.178	50	20	IDGD	
CCOc1ccccc1NC(=O)C(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12	763791875	YCHXOHOCPHGFRW-UHFFFAOYSA-N	437.456	1.776	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccc(-c2noc(C3CC3)n2)c1	763812385	FWUHJHGHCOLALQ-UHFFFAOYSA-N	446.423	1.651	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccn(-c3ccccc3)n2)cc1	763877146	HVUFAUPEXPDHGP-HNNXBMFYSA-N	435.440	1.628	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccc2c(c1)C(=O)N(CC1CC1)C2=O	763920002	BEXIEUYLFXCDGH-UHFFFAOYSA-N	438.415	1.160	50	20	IDGD	
CN1CCN(c2ccccc2NC(=O)C(=O)NNC(=O)Cc2ccc(Cl)cc2)CC1	763933529	ZPTRXJKCWKRJMK-UHFFFAOYSA-N	429.908	1.420	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3cccc(OCC(N)=O)c3)cc2C1	763948481	KKPYHCLYCLSCHA-NSHDSACASA-N	430.486	1.137	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1cccc(-c2n[nH]c(C)n2)c1	764011404	HAALIYILYUWDDU-UHFFFAOYSA-N	428.836	1.842	50	20	IDGD	
CCOc1ccc(C(=O)N2CCCCC2)cc1NC(=O)C(=O)NNC(=O)C1CCCC1	764066927	UKJTWENNSZQKJV-UHFFFAOYSA-N	430.505	1.988	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cccc4c3oc(=O)n4C)n[nH]2)cc1	764109837	CHRBSWIKDINWKE-UHFFFAOYSA-N	434.412	1.230	50	20	IDGD	
CCS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)cc1	764125983	CKILEFCMYUIQBC-UHFFFAOYSA-N	425.850	1.239	50	20	IDGD	
COC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)CCc2ccc(OC)cc2)cc1F	764131230	IJSWQONIKDVHHU-UHFFFAOYSA-N	432.408	1.731	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(OCC(F)(F)F)cc2)c1O	764132104	JROXUCIYDVATSB-UHFFFAOYSA-N	427.335	1.742	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1ccc(OCc2cccnc2)cc1	764275474	LXSJMLYIFDWFJE-UHFFFAOYSA-N	436.424	1.531	50	20	IDGD	
CCCS(=O)(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)CCc2ccccc2O)c1	764288883	OECFKZFPDIAFGE-UHFFFAOYSA-N	448.501	1.263	50	20	IDGD	
CCOCC(=O)NNC(=O)C(=O)Nc1ccc(C(=O)N(C)C2CCCCC2)c(Cl)c1	764316515	FCWPPOPAZADZGQ-UHFFFAOYSA-N	438.912	1.867	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)c(OCCN(C)C)c1	764350030	YKWSEYHDVXZTBW-UHFFFAOYSA-N	434.880	1.694	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)C(=O)Nc1ccnn1CCc1ccccc1	764404603	MVFXDLWIXAAERM-UHFFFAOYSA-N	439.497	1.710	50	20	IDGD	
C[C@H](NC(=S)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1)c1cccs1	764518501	FUARAZKOEQFFDS-HNNXBMFYSA-N	431.587	1.762	50	20	IDGD	
CC(C)C[C@H](C(=O)NNC(=O)CSc1ccccc1O)N1C(=O)[C@H]2CC=CC[C@H]2C1=O	765248306	PWNLIDVLVGHIFX-OWCLPIDISA-N	445.541	1.998	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)[C@@H]1CSCN1C(=O)OC(C)(C)C	765321997	FXKCXGZLMHRCQD-LBPRGKRZSA-N	432.543	1.749	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)c3ccc(F)c(S(N)(=O)=O)c3)n[nH]2)cc1C	765567163	NCEBAYGRMRTXNP-UHFFFAOYSA-N	431.449	1.555	50	20	IDGD	
Cc1ccc(C(=O)CCC(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cc1	765739377	VHWVLQUPGDKHAA-UHFFFAOYSA-N	436.512	1.563	50	20	IDGD	
CC/C=C(/C)C(=O)N1CSC[C@H]1C(=O)OCC(=O)NNC(=O)Cc1ccccc1C	767335036	RHHFMNMCCSFERA-OLMDTSMNSA-N	433.530	1.486	50	20	IDGD	
O=C(CCC(=O)N1CCN(c2ccccc2)CC1)NNC(=O)c1cc(-c2ccccc2)[nH]n1	767825512	VXJRFJYFBZVSCH-UHFFFAOYSA-N	446.511	1.967	50	20	IDGD	
CC(C)(O)C(=O)NNC(=O)c1ccccc1SCC(=O)Nc1ccc2c(c1)OCO2	768259247	GOSSNVLKZJIRGG-UHFFFAOYSA-N	431.470	1.678	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)[C@@H](C)S(=O)(=O)C3CCOCC3)n[nH]2)cc1	768268415	PXNDKCNEVNIPRU-CYBMUJFWSA-N	434.518	1.382	50	20	IDGD	
O=C(NNc1nccc(N2CCOCC2)n1)[C@@H]1CCN(C(=O)OCc2ccccc2)C1	770622637	SKHPMKBQQNELHK-QGZVFWFLSA-N	426.477	1.415	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2c(F)cccc2Cl)cc1NS(C)(=O)=O	770811297	OOJOOLRDZULETN-UHFFFAOYSA-N	430.845	1.941	50	20	IDGD	
Cc1nc2ccccc2c(=O)n1-c1ccc(C(=O)NNc2nc(O)c3cnn(C)c3n2)cc1	770973527	DMBWSCZOWWWQQI-UHFFFAOYSA-N	442.439	1.833	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)NCc1nc2cc(OC)ccc2n1C	771392045	NNDCSWJBMHOQNJ-UHFFFAOYSA-N	427.461	1.890	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@@H](C(=O)NNc2ccnc(Br)c2)[C@H](C)O)cc1	771551684	HEZHTBBSXDJVJX-XHDPSFHLSA-N	443.323	1.324	50	20	IDGD	
NS(=O)(=O)c1cccc(N2C[C@@H](C(=O)NNc3c(F)cccc3Cl)CC2=O)c1	771674086	LCMZDOWHIIEWOB-JTQLQIEISA-N	426.857	1.623	50	20	IDGD	
C[C@H]1C[C@@H](NC(=O)NNC(=O)Cc2cn3ccccc3n2)CCN1C(=O)OC(C)(C)C	772465584	WIYZIWKHQOQQAX-GJZGRUSLSA-N	430.509	1.995	50	20	IDGD	
COC(=O)c1ccc(C(=O)OCC(=O)NNC(=O)c2cc(Cl)ccc2OC)c(F)c1	772531187	KYWQFPCMHGHCMQ-UHFFFAOYSA-N	438.795	1.892	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNS(=O)(=O)c1ccc2c(c1)NC(=O)CO2	773250198	ALJOQYJFMHTIOU-JTQLQIEISA-N	425.850	1.448	50	20	IDGD	
O=C(NNc1ccc2ccccc2n1)C(=O)Nc1ccccc1OCC(=O)N1CCOCC1	773655226	OQZNHHRDKMIORE-UHFFFAOYSA-N	449.467	1.554	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)c2cc(Cl)sc2S(N)(=O)=O)c1C	773714175	UMXBLHKDVJABGX-JTQLQIEISA-N	431.923	1.894	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccn(-c2ncccc2F)n1	774001721	ITPMICFKBFCBTG-LLVKDONJSA-N	446.826	1.613	50	20	IDGD	
Cc1sc2ncc(C(=O)OCC(=O)NNC(=O)c3cccc(Cl)c3)c(=O)n2c1C	775954643	OBTXGLYTGCTTST-UHFFFAOYSA-N	434.861	1.644	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)c1cn(-c2cccc(Cl)c2F)nn1	776335821	CPSDZMRZRBVNNX-UHFFFAOYSA-N	427.783	1.783	50	20	IDGD	
O=C(NC[C@@H]1COC2(CCOCC2)O1)NNC(=O)c1ccc(Br)cc1Cl	776909110	KZUHIDQWKBVFAY-LLVKDONJSA-N	448.701	1.969	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNS(=O)(=O)c1cc(Cl)cc(C(F)(F)F)c1	777619953	APZXGIAVKILANP-UHFFFAOYSA-N	425.772	1.691	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)NC[C@H]2COC3(CCOCC3)O2)c1	777760915	UPCBYROUUQCHKP-LBPRGKRZSA-N	444.282	1.324	50	20	IDGD	
CC(=O)N[C@H](CC(=O)NNC(=O)CCNC(=O)OC(C)(C)C)c1ccc(Cl)cc1	780973628	DGFSLVBEAKUTMV-OAHLLOKOSA-N	426.901	1.970	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NNC(=O)c2ccc(CSc3nncn3C)cc2)cn1	781659259	WPESCUBDHLWRCD-UHFFFAOYSA-N	448.530	1.524	50	20	IDGD	
COc1ccc(NC(=O)c2cccc(NC(=O)C(=O)NNc3cncc(Cl)n3)c2)cn1	783260312	YSYFWRMKJVZCNX-UHFFFAOYSA-N	441.835	1.868	50	20	IDGD	
O=C1CCc2cc(C(=O)NNC(=O)c3cccc(S(=O)(=O)N4CCCC4)c3)ccc2N1	783391946	DEZKDFAYEUSTLM-UHFFFAOYSA-N	442.497	1.431	50	20	IDGD	
CC(C)Cc1cc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)n(C)n1	783409861	YGMSOAINWBEHTB-UHFFFAOYSA-N	447.439	1.994	50	20	IDGD	
CS(=O)(=O)c1cc(Br)ccc1NC(=O)C(=O)NNc1ccnc(F)c1	784849265	TZUGMGZUBWEYJI-UHFFFAOYSA-N	431.243	1.469	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C(F)(F)F)c2ccccc2c1=O	785442934	GPVUEYXBZWUFMO-TUVASFSCSA-N	438.406	1.923	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)N[C@H]1CCCN(C2CCCCC2)C1=O	785569567	HADFRTUXUSRXRL-SFHVURJKSA-N	443.552	1.347	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2ccc(F)c(S(C)(=O)=O)c2)c2ccccc2c1=O	785690007	YDBXKZMVYXUWPT-UHFFFAOYSA-N	432.433	1.034	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNS(=O)(=O)c1cc(Cl)ccc1O[C@@H](C)COC	786723782	JFLPFKRRDMHGDA-NSHDSACASA-N	435.930	1.368	50	20	IDGD	
CCS(=O)(=O)CCn1cc(C)c(NC(=O)NNc2cccc(S(C)(=O)=O)c2)n1	786733447	YAQFWIDNKXYWQI-UHFFFAOYSA-N	429.524	1.178	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)[C@@H]1CCCN1c1ccccc1	787404844	ZETKQLAGXJUJOV-IBGZPJMESA-N	430.530	1.820	50	20	IDGD	
COC(=O)c1sc(S(=O)(=O)NNC(=O)c2cccc(OC)c2O)c(C)c1Cl	788481068	WGESLECYLRZBKR-UHFFFAOYSA-N	434.879	1.834	50	20	IDGD	
COc1nc(Br)ccc1NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	789390431	XJXLFECYIFIYIN-UHFFFAOYSA-N	447.249	1.566	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)C(=O)Nc1nc([C@H]2C[C@H]3CC[C@H]2C3)cs1	789758446	UNXWWSOXWYKJDG-SRVKXCTJSA-N	431.474	1.156	50	20	IDGD	
O=C(NNC(=O)[C@H]1OCC[C@H]1c1ccccc1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl	789811588	FLVLOPODYNPIIP-BBRMVZONSA-N	432.820	1.907	50	20	IDGD	
COC(=O)c1cc(Cl)cc(S(=O)(=O)NNC(=O)c2ccc(C)cc2O)c1OC	790054989	UGTMDLJRDXFYRO-UHFFFAOYSA-N	428.850	1.773	50	20	IDGD	
O=C(NC[C@H]1CCN(Cc2ccccc2)C1)NNC(=O)c1csc(N2CCOCC2)n1	792229773	YPMQMCHRQRAUQL-QGZVFWFLSA-N	444.561	1.446	50	20	IDGD	
CS(=O)(=O)Cc1nc2ccccc2n1CC(=O)NNC(=O)c1ccc2ccccc2n1	792545889	ONEHWBOGGVNMGV-UHFFFAOYSA-N	437.481	1.590	50	20	IDGD	
Cc1nc(COc2ccc(C(=O)NNC(=O)CNC(=O)OCc3ccccc3)cc2)no1	794071263	HHZYGCBALVNYIN-UHFFFAOYSA-N	439.428	1.644	50	20	IDGD	
O=C(COC(=O)C1CC(c2ccc(F)cc2)C1)NNC(=O)[C@H]1COc2ccccc2O1	796111973	PQWJAIVZBJNMTL-JFIBYHEFSA-N	428.416	1.850	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)Nc1ccc(OC(F)F)c(C(F)(F)F)c1	797662740	CTXKDPQTJLOYSP-ZETCQYMHSA-N	431.339	1.894	50	20	IDGD	
C=CCNC(=S)NNC(=O)c1cnc2c(cnn2Cc2ccc(OC)cc2OC)c1	798306175	AAUGBSCDVKCVSH-UHFFFAOYSA-N	426.502	1.792	50	20	IDGD	
N#Cc1ccc(NNC(=O)NCCNS(=O)(=O)Cc2ccon2)c(C(F)(F)F)c1	799599385	BQPUHTYYHYEBDW-UHFFFAOYSA-N	432.384	1.311	50	20	IDGD	
CSC[C@@H](C)C(=O)N1CCC(C(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)CC1	799627357	WUFPENOGEOEFQS-GFCCVEGCSA-N	449.581	1.968	50	20	IDGD	
CNS(=O)(=O)c1ccc(C(=O)NNc2cc([N+](=O)[O-])ccc2Br)cn1	800618041	DXWZGRNTLMGJJW-UHFFFAOYSA-N	430.240	1.417	50	20	IDGD	
COc1ccc(CSCC(=O)NNC(=O)C(=O)Nc2ccc(C)cc2)cc1[N+](=O)[O-]	801109573	UHSBJYVCXGWGBJ-UHFFFAOYSA-N	432.458	1.931	50	20	IDGD	
C[C@H](C(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)S(=O)(=O)c1ccc(F)cc1	802063642	NQPFGQKYJBDICV-LLVKDONJSA-N	443.478	1.244	50	20	IDGD	
Cc1ccc([C@@](O)(CC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)C(F)(F)F)o1	802068607	MFXGMWSWEOKUHK-INIZCTEOSA-N	449.407	1.984	50	20	IDGD	
Cc1ccc2c(c1)nc(CNC(=O)NNC(=O)c1sc(N3CCOCC3)nc1C)n2C	802322739	ZPQCEYQCYUBFFG-UHFFFAOYSA-N	443.533	1.627	50	20	IDGD	
CS(=O)(=O)CC[C@@H](NC(=O)c1ccccc1Cl)C(=O)NNc1ncccc1F	804214748	ORYVREYRRJKJAN-CQSZACIVSA-N	428.873	1.551	50	20	IDGD	
COC(=O)[C@@]1(C(F)(F)F)CCN(C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)C1	805110081	OEMSVYVVOCOCBU-QGZVFWFLSA-N	425.367	1.654	50	20	IDGD	
N[C@@](C(=O)NNC(=O)C1CCN(c2ncccn2)CC1)(c1cccc(F)c1)C(F)(F)F	806793944	VSOGARCZJGEAOA-GOSISDBHSA-N	440.401	1.396	50	20	IDGD	
O=C(CCCc1ccccc1)NNC(=O)C(=O)Nc1ccc(F)c(N2C(=O)CCC2=O)c1	806978376	YMGAMVNVIPVQMK-UHFFFAOYSA-N	440.431	1.588	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCC(C)CC2)s1	807369327	SHBAADJILPYWGQ-UHFFFAOYSA-N	447.579	1.719	50	20	IDGD	
Cc1cc(S(=O)(=O)Nc2ccccc2C(=O)NNC(=O)N2CCN(C)CC2)ccc1F	807383080	JQFJOWUVFGFMJH-UHFFFAOYSA-N	449.508	1.537	50	20	IDGD	
CC(=NNC(=O)Cc1cc[nH]n1)c1ccc(S(=O)(=O)Nc2ccc(C(=O)O)cc2)cc1	814955067	TYCRLQSBJXGLIG-UHFFFAOYSA-N	441.469	1.992	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2O)cc1)[C@H]1C[C@H]1C	815569328	PADCDTGSLNEULM-DYVFJYSZSA-N	440.456	1.318	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3ccnc(-c4ncc[nH]4)c3)cc2)CC1	815854974	YYCPDEJLZSQSHO-UHFFFAOYSA-N	441.517	1.165	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)CN2CCc3ccccc3C2=O)C1	816510784	GELZDCFHKHYJAX-INIZCTEOSA-N	430.505	1.479	50	20	IDGD	
Cc1nnnn1/C(=C/c1ccc(F)cc1)C(=O)NNC(=O)c1nnc(O)c2ccccc12	818028274	BAIQSXNRKZQTPK-MHWRWJLKSA-N	434.391	1.229	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CCn2cnc3sc(C)c(C)c3c2=O)cc1C	818328939	YZBNOMKROJSRBU-UHFFFAOYSA-N	441.513	1.868	50	20	IDGD	
O=C(c1ccc(Cl)c(NS(=O)(=O)c2ccc(F)cc2)c1)N1CC[C@H](B(O)O)C1	864233737	JVAKTMCBLCAZJR-LBPRGKRZSA-N	426.662	1.969	50	20	IDGD	
COc1ccc([C@@]2(C)NC(=O)N(NC(=O)/C(C#N)=C/c3cc(C#N)n(C)c3C)C2=O)cc1	906491636	JYXXNNBLSOLJLE-YTIHOSAGSA-N	432.440	1.619	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCCN(C(C)C)C(C)C)cc1	915891578	UWBKPDAGPBCETH-UHFFFAOYSA-N	427.571	1.065	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NC[C@H](Cc2ccccc2)N(C)C)nc1	915900886	IZIFAZYRFXVCNO-SFHVURJKSA-N	448.593	1.911	50	20	IDGD	
CCNC(=O)c1ccc(CNC(=O)NNc2ccc(S(=O)(=O)N(CC)CC)cn2)cc1	916392229	RBVGMPOZGWDQBK-UHFFFAOYSA-N	448.549	1.688	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NC[C@@H](C)N2CCC[C@H](C)C2)nc1	916450229	HNYBOPLFWQPCMY-JKSUJKDBSA-N	426.587	1.859	50	20	IDGD	
O=C(COC(=O)c1cc(Cl)c2c(c1)OCCO2)NNC(=O)[C@@H]1COc2ccccc2O1	917246466	ZYHUTQZPVUBWOO-INIZCTEOSA-N	448.815	1.255	50	20	IDGD	
O=C(CNC(=O)c1ccccc1I)NNC(=O)CC(F)(F)F	918366259	VCQFFFJJGKBXFE-UHFFFAOYSA-N	429.136	1.121	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccccc2OCCOC)c1	919684643	FNYDMIOJNMXGSV-UHFFFAOYSA-N	449.529	1.817	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CC=CC[C@@H]1c1nc2ccccc2s1)N[C@H]1CCS(=O)(=O)C1	919889266	KHYREDAWZCGXHO-MJBXVCDLSA-N	434.543	1.864	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCc2c(F)cccc2Cl)c1	1253000651	MLNWSNCPKNVPTL-UHFFFAOYSA-N	442.900	1.916	50	20	IDGD	
CN(C)N(C(=O)C1CCN(C(=O)c2ccc(F)cc2F)CC1)[C@H]1CCS(=O)(=O)C1	1321404202	UOJFMISXBZKRHM-HNNXBMFYSA-N	429.489	1.309	50	20	IDGD	
CN(C)C(=O)Nc1cccc(CNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1	1322144383	KGKIDRCOGZNAHD-UHFFFAOYSA-N	440.508	1.317	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)c1csc(Cc2ccc(Cl)cc2)n1	1322619724	SIICDSXLTAKMTG-UHFFFAOYSA-N	429.889	1.973	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc4n(n3)CCCC4)C2)C1	1778565360	XKCIPZZCYQVTBD-DNVCBOLYSA-N	439.354	1.836	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3c(C)nc4sccn34)C2)C1	1778721983	NAULKMQVPFLSLI-UGSOOPFHSA-N	426.926	1.402	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(NC(C)=O)o3)C2)C1	1779030323	OBIKWIADDBEWOX-FZKQIMNGSA-N	442.310	1.855	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ncccc3C(F)(F)F)C2)C1	1779717666	NSDMEWDGKJJIND-SUMWQHHRSA-N	435.830	1.798	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(CN(C(=O)/C=C/C3CC3)CCO2)C1	1780095396	OPWHCBQTFOPFQF-SNXGKTBFSA-N	443.456	1.930	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2)c1c(F)ccc(O)c1F	1781091418	RJEXSDGWKVZHCY-IQUTYRLHSA-N	432.851	1.398	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)c3cn4ncccc4n3)CCO2)C1	1781229285	FWOKAMLILSBJGY-QZTJIDSGSA-N	426.304	1.409	50	20	IDGD	
O=C(c1cn2ccccc2n1)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781329873	MFPPPIADSXFLNU-YOEHRIQHSA-N	425.258	1.468	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1nc3ncccn3n1)C2)C(Cl)Cl	1782217312	BHWRVVZANZQFEB-PIGZYNQJSA-N	427.292	1.056	50	20	IDGD	
O=C1CCc2ccc(C(=O)N3CC[C@@]4(C3)CN(C(=O)[C@@H](F)Br)CCO4)cc21	1782313339	VBLVKRHIJZKPRE-VQIMIIECSA-N	439.281	1.950	50	20	IDGD	
O=C(c1nc2ccc(F)cn2n1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1782569925	VJPQUNYUZVELKJ-MLGOLLRUSA-N	444.236	1.002	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(CCN(C(=O)[C@@H]3CC(c4ccccc4)=NN3)C2)C1	1782601017	GAIFJXDBTZYZKW-SIKLNZKXSA-N	444.608	1.434	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)N1CC[C@]2(CN(C(=O)[C@@H](Br)CC)CCO2)C1	1782711389	FUBICEAVBIUYJO-IIYDPXPESA-N	435.315	1.551	50	20	IDGD	
CN(C)CC(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](Br)Cc3ccccc3)C2)C1	1783024054	SZDRGFIOBYNVQW-PXNSSMCTSA-N	438.366	1.384	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(O)nc(O)c3)CCO2)C1	1783343514	VBOPSTWKFDAGDL-SJCJKPOMSA-N	428.283	1.110	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccn4ccnc4c3)CCO2)C1	1783349204	JPULTJFIQAHXGE-BEFAXECRSA-N	435.322	1.951	50	20	IDGD	
Cc1ccc(C(=O)C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)cc1	1783743384	LXZGZUYFUUNALF-CRAIPNDOSA-N	427.270	1.698	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)Cc3ccc(Cl)cc3OC)CCO2)C1	1783880172	CRTFHIBJCOPDTM-JXFKEZNVSA-N	445.343	1.975	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(OC)c(OC)c3O)CCO2)C1	1783881148	PFLQMZJSEUUFJI-XOBRGWDASA-N	442.896	1.107	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)CCCNC(=O)OC(C)(C)C)CCO2)C1	1783884064	OIUUILLOMIJFJT-FOIQADDNSA-N	447.960	1.375	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)Cc3ccc(O)cn3)C2)C1	1784644576	LENNTVZKLIUCGF-QAPCUYQASA-N	426.311	1.333	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3cscn3)[C@H]2C1	1787037614	VYOMSNMBGAGZIK-DHMWGJHJSA-N	430.368	1.696	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C3(C(=O)Nc4ccccc4)CC3)C[C@@H]21)[C@@H](F)Cl	1787443372	HATKLHIZVXOLTD-QSPRXWTASA-N	437.899	1.919	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(Cl)nc4n[nH]cc34)C[C@@H]21)[C@@H](F)Cl	1787446256	ZZSPSQSXMHYHHD-NVPWMLRNSA-N	430.267	1.739	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4ccnn4c3)C[C@@H]21	1788763835	WKDPBXRRYQIWEU-WDSOQIARSA-N	430.581	1.779	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3ccc4ncnn4c3)[C@H]2C1	1789714300	DQZPZZDGRPHTDN-ULQDDVLXSA-N	433.940	1.517	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cn3cc(Cl)cn3)C[C@@H]21	1790961854	SFHZRUMGVHAVPP-MXAVVETBSA-N	447.761	1.690	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)CBr)C[C@@H]21	1791055249	QANRDALNQFPLGS-VLJOUNFMSA-N	440.176	1.781	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnnc(Cl)c3)C[C@@H]21	1791056929	IDIDLYLUDPEACG-UKJIMTQDSA-N	431.718	1.507	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc([N+](=O)[O-])cc3F)C[C@@H]21	1791257153	QSLMREJJMGISSB-SIUGBPQLSA-N	443.859	1.581	50	20	IDGD	
COc1ccc(OCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]3C2)cc1	1791292524	WMJHVTYLNHGKLK-RCBQFDQVSA-N	431.316	1.857	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cccc(F)c1)C2	1792867937	OEDPJRSNFUVZOY-FRQROOTJSA-N	427.314	1.989	50	20	IDGD	
CCc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)CBr)nn1C	1792872625	RVUTWVMYKUEWCX-JFILPPLUSA-N	427.343	1.217	50	20	IDGD	
Cc1nn(C)c(C)c1CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)CBr	1792873456	YCTVUSHDJJYKTC-ZKRNXSKHSA-N	441.370	1.200	50	20	IDGD	
N#Cc1cccc(CCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)c1	1792939487	UQQKXFMLWOWWLK-REPLKXPHSA-N	446.511	1.441	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3c(Cl)cncc3s1)C2)[C@H](O)CCl	1792977034	PSFYWDWBSGPOJR-HMVGFALLSA-N	444.340	1.753	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H]1CCC[C@@H]1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCl	1793117642	UWGTXKQEZFGQNP-FQMQPWHVSA-N	443.972	1.918	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CC=CC[C@H]1C(=O)OC)C2	1793452601	CMLXOUFZHDGZKI-RFSXOUPVSA-N	426.941	1.739	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1c(F)ccc(F)c1F	1793646537	LFEGIROFKMLHKN-ZSMOCIRGSA-N	434.842	1.490	50	20	IDGD	
COc1cccc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCBr)n1	1795111311	BSBKGGGUXUBVDP-HBCWATKFSA-N	440.338	1.397	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)[C@@H]1[C@@H]2CCC[C@H]1c1ccccc1N2	1795498826	IGWMXUWYMAKDTF-LNDBJABFSA-N	447.963	1.554	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccn2cncc12	1797519796	HJJHZIUVDJORLA-ZJOBFFGXSA-N	435.322	1.569	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1c[nH]c2cnccc12	1797565118	SSOMDCPEHJLMBI-RBNVPPIJSA-N	435.322	1.940	50	20	IDGD	
CCCCC[C@H](C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnccc1C(=O)NN	1797753607	ACDHBRGOOMYVGW-GGXPGOJBSA-N	431.537	1.105	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc3c1OCCO3)C2	1799274846	DETICAAKJWCDPZ-KNLUSZGBSA-N	443.327	1.897	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(OC)c(O)cc1[N+](=O)[O-]	1799308623	LUDWKMVAMZLKPF-OPDFLTKYSA-N	441.868	1.815	50	20	IDGD	
COc1ccc([C@@H](O)C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Br)cc1	1799343161	OQQGAXRJESKQHE-UDUPFKKZSA-N	445.285	1.009	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc3[nH]ncc13)C2)[C@H](F)Br	1799346326	PDRNLAMEPFOGAX-OWLDWWDNSA-N	425.258	1.457	50	20	IDGD	
CCS(=O)(=O)N[C@@H](C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@](C)(Cl)CCl	1800076149	BQEDJWUAEIQJQH-DJUFWWRVSA-N	428.382	1.189	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](F)Br)c1cc(=O)nc2sccn12	1800160939	KZJQWBCWBIZZMK-WJZNIJOASA-N	443.298	1.698	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(NC(C)=O)o1)C2	1800642060	UHFKEALYLVFVIY-OQMKEHIESA-N	442.310	1.615	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/C(=O)c1cccs1)C2	1800756759	DMVCSQBFZQXYPA-QGKAELNQSA-N	441.347	1.860	50	20	IDGD	
CN1CCCn2nc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)[C@@H](F)Br)C4)cc2C1	1801184836	CBHSQKXUDUFGHK-OQMKEHIESA-N	442.333	1.661	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccc(F)cc1OC	1802181490	NDYXHPYPLNGZNS-QHHYFVSCSA-N	428.888	1.220	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](NC(C)=O)c1ccc(F)cc1)C2	1802283844	QTQJOULFTWFUQB-RHQZKXFESA-N	439.915	1.895	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H]2Cc3ccccc3CN2)[C@H]1c1cccnc1)[C@@H](O)CCl	1803138587	CRPRJQVFHHXKCZ-TUFLPTIASA-N	442.947	1.402	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2c(F)ccc(O)c2F)[C@H]1c1cccnc1)[C@@H](O)CCl	1803141791	UJEQUEIJKNUMQM-QITLCBANSA-N	439.846	1.985	50	20	IDGD	
C[C@H](Nc1ccccn1)C(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]1c1cccnc1	1803142629	FWFLCVHXIIOHEJ-WFEDQXDTSA-N	431.924	1.583	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc3cncn3c2)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803142855	KXKWMWSOZMMBCF-ZYSHUDEJSA-N	427.892	1.649	50	20	IDGD	
Cn1ncc2cc(C(=O)N3CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]3c3cccnc3)ccc21	1803142866	LICGQBXRXRQMGO-NSISKUIASA-N	441.919	1.888	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2ccns2)[C@H]1c1cccnc1	1805220725	JVYFCBWFPHLBFV-DNVCBOLYSA-N	430.534	1.231	50	20	IDGD	
C[C@@H](CS(C)(=O)=O)C(=O)N1CCCC2(CCN(C(=O)[C@H](F)Br)CC2)C1	1806046593	MBEGNDCTQHLOII-STQMWFEESA-N	441.363	1.589	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)CC(F)(F)F)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807365588	VWALQLLFNUBTMR-CRAIPNDOSA-N	435.211	1.033	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)ccn1	1807374801	JJTHAWZNEKOWLD-UNMCSNQZSA-N	444.300	1.098	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)cn1C	1807374844	JPGZNYQWMDUTSG-UGKGYDQZSA-N	446.316	1.042	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)c3ccc(F)cn3)CC2)C1	1809976589	IZFYAUYOHTUERH-UHFFFAOYSA-N	425.269	1.059	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC2(CCCN(C(=O)c3cc[nH]c4nccc3-4)C2)CC1	1810631676	PIBRXIOWZRKQGO-UHFFFAOYSA-N	446.316	1.353	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2cc(OC)nn2C)[C@H]1c1cccnc1	1813029563	PSIUDOJOGNXYRB-MPGHIAIKSA-N	435.912	1.397	50	20	IDGD	
Nc1n[nH]c(CCC(=O)N2CC[C@@H](CNC(=O)C(Cl)Cl)[C@@H]2c2cccnc2)n1	1813078445	PWSLZLDLEJHAKB-FZMZJTMJSA-N	426.308	1.224	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@@H]1c1cccnc1)[C@@H]1[C@H]2COC[C@H]21	1813659495	MNXKYQHZCYFIHT-IJOLSIAMSA-N	426.286	1.670	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](O)CCl)CC2)c1cnc(C(F)(F)F)cn1	1816084422	KQVGBWNMKANGMS-XVKPBYJWSA-N	449.842	1.777	50	20	IDGD	
CCn1ccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)n1	1816556377	BAZSWXRHEYEARS-MRXNPFEDSA-N	430.513	1.305	50	20	IDGD	
COC[C@H](NC(C)=O)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCBr)n[nH]1	1816782741	YRSRTOZCEPMTHZ-KBPBESRZSA-N	444.330	1.338	50	20	IDGD	
O=C1CCc2ccc(C(=O)Nc3cc([C@@H]4CCCCN4C(=O)[C@H](O)CCl)[nH]n3)nc2N1	1817809131	KRPSRUXJHUDBOU-LSDHHAIUSA-N	446.895	1.595	50	20	IDGD	
O=C(CS(=O)(=O)N1CCCC1)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](F)Cl)[nH]n1	1818108679	QFPXOISZQOOKLK-SWLSCSKDSA-N	435.909	1.362	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCc2nc(N)n[nH]2)n[nH]1	1819284875	TUCZGVWKDGOTKG-CYBMUJFWSA-N	434.577	1.586	50	20	IDGD	
Cc1ncoc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819402016	IUDBUXZIGVZSRE-OAHLLOKOSA-N	438.448	1.324	50	20	IDGD	
CCS(=O)(=O)CC(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](C)Br)n[nH]1	1822183969	IJEXZLNULQXHEW-JQWIXIFHSA-N	435.344	1.620	50	20	IDGD	
Cc1ccn(C)c1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1	1822415229	XBWQFPCDCKPXCT-MRXNPFEDSA-N	429.525	1.736	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)C1CCSCC1	1823544926	PLLHYUNWJYYASR-SFHVURJKSA-N	442.350	1.539	50	20	IDGD	
CCN1CCC(C(=O)Nc2cc([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)CC1	1823553093	REBOLFOTGCKQQM-GOSISDBHSA-N	447.584	1.507	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)[C@H](O)NC(=O)OC(C)(C)C)sc2C1	1823572406	XSVMKXHFXLZPTF-YHAQOWFVSA-N	446.957	1.916	50	20	IDGD	
C/C=C/C=C\C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnccc1C(=O)NN)CC2	1825107982	YSODIHDSFOPWJH-MJMJCPQHSA-N	426.502	1.500	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](Cl)COC)sc2C1	1826000102	KWPWRFRVOWFKEU-GMTAPVOTSA-N	431.946	1.017	50	20	IDGD	
CCC[C@H](NC(C)=O)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](Cl)COC)sc2C1	1826009578	VAHYTKXZBDDFLJ-DYEKYZERSA-N	430.958	1.614	50	20	IDGD	
O=C(CCc1ccc[nH]1)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827055006	RNJXCCUPIWURGT-JOCHJYFZSA-N	437.349	1.561	50	20	IDGD	
O=C([C@H]1CCC=CO1)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827057588	KPQDSNSCYHCAHS-NHCUHLMSSA-N	426.322	1.292	50	20	IDGD	
COCCCC(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1	1828923561	MFRPFBRVUPRPRE-LJQANCHMSA-N	431.537	1.345	50	20	IDGD	
C#CC(=O)N1CCC([C@@H]2CCCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)CC1	1830165683	JSTRJBWKELLXKE-NRFANRHFSA-N	439.560	1.586	50	20	IDGD	
C[C@@H](Nc1ccccn1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830364299	FIYFKOPPRSFSNR-IIBYNOLFSA-N	438.956	1.603	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3ccco3)CCO2)C1	1833052753	WRXAHPXAMIZSQX-APWZRJJASA-N	443.338	1.842	50	20	IDGD	
C[C@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)c3cnc[nH]3)CC2)CC1	1833262628	ZMUOHCFRSIAPBW-CYBMUJFWSA-N	426.359	1.626	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccs3)CCO2)C1	1833930213	IVINNWDFCPRNEO-DYVFJYSZSA-N	431.352	1.849	50	20	IDGD	
CC[C@H](C)[C@H](N)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)CBr)CC2)CC1	1834681739	GKPKHBYIWLHDIR-MPGHIAIKSA-N	445.446	1.962	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cccc(F)n3)CC2)CC1	1835907885	WABLVRGUHBPANZ-MRXNPFEDSA-N	426.920	1.660	50	20	IDGD	
C[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1)n1cccc1C=O	1835951456	FLHYNIROINRMHR-IIBYNOLFSA-N	439.940	1.583	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cc(CO)on3)CC2)CC1	1836186562	BPSYCXOWBWHVFL-KRWDZBQOSA-N	426.945	1.760	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnn4cc(C)cnc34)CCO2)C1	1836949471	NBHUSQHMENRTGU-OXJNMPFZSA-N	435.912	1.125	50	20	IDGD	
CCc1oncc1C(=O)N1CCC(OC2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1	1837568673	PBNRDBRWVHOAPX-UHFFFAOYSA-N	449.552	1.222	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(OC)ccn3)CCO2)C1	1837952387	UAJXOCMCJVXTSJ-OXJNMPFZSA-N	425.913	1.568	50	20	IDGD	
CCc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](C)CBr)C3)C2)no1	1838121968	RLPSFNZSDWYRHD-UGSOOPFHSA-N	444.326	1.338	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)c3c[nH]c(=O)cn3)CC2)CC1	1838539023	CZCXTKCKAZWTAR-LBPRGKRZSA-N	441.326	1.166	50	20	IDGD	
CSc1cccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)c1O	1838564233	DRQICCIQRBAKRX-MAUKXSAKSA-N	432.901	1.719	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(Cl)c3)CCO2)C1	1838920297	QWJLOKYSHPNBBO-APWZRJJASA-N	431.316	1.664	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(F)cc(F)c3)CCO2)C1	1839003602	PZXVCYKZTWEQGP-KPZWWZAWSA-N	447.276	1.818	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCCC(=O)OC(C)(C)C)C2)C1	1839141491	JXCZQAKVUMRPNB-IERDGZPVSA-N	446.972	1.972	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3nc4ccccn4c3C)C2)C1	1839144812	LITKMOJTVZIMSL-HRAATJIYSA-N	434.924	1.730	50	20	IDGD	
Cc1nccn1[C@H](C)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2	1839156526	RYQWXBKEYMBCFY-MDASCCDHSA-N	447.363	1.445	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H](F)Br)CCO2)C1	1839198592	KDEUMIMSMFXRGS-ABAIWWIYSA-N	429.714	1.398	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(O)cc3F)CCO2)C1	1839317032	HKFRDJNNPZPIKU-RBUKOAKNSA-N	449.306	1.838	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)ccc1F	1839321826	WQKICTWMPXYMIK-AUUYWEPGSA-N	443.313	1.988	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccc(F)cc3F)CCO2)C1	1839979274	FQDSFVAQJIBCBX-OXJNMPFZSA-N	430.879	1.981	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CSC3CCCC3)C2)C1	1840150091	FJZQSKXIHLDKHM-VQIMIIECSA-N	434.986	1.372	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C)cc(C#N)c3)C2)C1	1840154694	CWRJJFKLDTYGAS-WIYYLYMNSA-N	435.908	1.191	50	20	IDGD	
Cc1cccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)c1Cl	1840690051	LXQNRVZZKFPGPG-DNVCBOLYSA-N	431.316	1.318	50	20	IDGD	
Nc1c(C(=O)N2CCCC23CN(C(=O)[C@H](F)Br)C3)sc2nccnc12	1842992443	UDGMHWDDABSLRN-NSHDSACASA-N	428.287	1.781	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)c2[nH]cnc2C)C1	1843522622	YBDDONRHLLWXPZ-UHFFFAOYSA-N	427.417	1.682	50	20	IDGD	
C[C@H](Sc1cccs1)C(=O)N1CCCC12CN(C(=O)c1ccc(B(O)O)cc1)C2	1844167788	LYJUZHQZFQYRJV-AWEZNQCLSA-N	430.360	1.426	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC12CN(C(=O)[C@H](C)[C@H]1SC(=N)NC1=O)C2	1846070072	MYIBRVCVEWHIED-OUAUKWLOSA-N	431.356	1.166	50	20	IDGD	
CC(C)Oc1ccc(C(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)cc1C#N	1846878414	VTJFQXCHSATEDY-UHFFFAOYSA-N	447.300	1.156	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1ncc(Cl)cc1Cl	1847207323	CJBGIBRLQFLFOY-KBPBESRZSA-N	428.320	1.577	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CCN(C)C(C)=O	1848023125	NVXNCJIINLXVEX-ROUUACIJSA-N	446.460	1.204	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)C[C@@H](NC(N)=O)c2ccccc2)c2ccccc2c1=O	11148162	MSURVIAEQRJSCG-QGZVFWFLSA-N	436.472	1.367	50	20	IDGD	
CON(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)cc1	14939546	ZFFJYKQJPUNMRC-GFCCVEGCSA-N	425.438	1.236	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)CCNS(=O)(=O)c2ccc(C)c(C)c2)cc1C	17203476	NVWMNQWPRWFTGL-UHFFFAOYSA-N	433.530	1.815	50	20	IDGD	
COc1cccc2c1OCC[C@@H]2NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	726274398	PXROHWZYKCQJDW-INIZCTEOSA-N	448.501	1.413	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)NCC(=O)N(C)CCc3ccccn3)cc2C1	727473970	VCTKIJYLNRJPIY-CQSZACIVSA-N	429.546	1.913	50	20	IDGD	
O=C(NN=Cc1nccn1CC(F)(F)F)c1ccc(S(=O)(=O)N2CCCC2)cc1	727683248	DOFJCGHUOLZHHV-UHFFFAOYSA-N	429.424	1.994	50	20	IDGD	
NC(=O)c1ccc(/C=C\C(=O)N2CCC[C@@H]2C(=O)NNc2nc(-c3ccncc3)no2)cc1	728072196	ZPBAGGSFMDVAMI-CTEOGUNLSA-N	447.455	1.378	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)Cc3ccc4c(c3)CCC4)cc2)CC1	728214002	UQQUDIVYLXOKGI-UHFFFAOYSA-N	428.558	1.797	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CCCc2ccc3c(c2)CC(=O)N3)cc(OC)c1OC	729297152	WYAUPGDFYLUDKU-UHFFFAOYSA-N	427.457	1.991	50	20	IDGD	
O=C(COC(=O)c1sccc1OC(F)F)NNC(=O)[C@H]1COc2ccccc2O1	729775140	PYLKFHLBEWASAO-GFCCVEGCSA-N	428.369	1.494	50	20	IDGD	
CC(=NNC(=O)CCc1ccccc1O)c1ccc(S(=O)(=O)N2CCNCC2)cc1	729934998	WBZFKASSRCVFJZ-UHFFFAOYSA-N	430.530	1.459	50	20	IDGD	
CC(=O)c1csc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c1	730159563	LOFKNLQHIZBVDC-UHFFFAOYSA-N	437.499	1.046	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NN=c1cc[nH]c2ccccc12	730288370	GGTDWTYKJMZACQ-UHFFFAOYSA-N	440.525	1.754	50	20	IDGD	
O=C(NCc1nnnn1-c1ccccc1)NNC(=O)c1ccc(F)cc1Br	730672118	AMVFORATGRPOEP-UHFFFAOYSA-N	434.229	1.708	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Cn2nnc3ccccc3c2=O)cc1Br	732033497	IYJNKUDHGAOILA-UHFFFAOYSA-N	432.234	1.024	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)NCC2CCN(S(=O)(=O)C(F)F)CC2)c1	733045915	VPMOKYZKBDOZCQ-UHFFFAOYSA-N	448.492	1.277	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(Cl)s1)NNC(=O)c1cnn(-c2ccccc2)c1	733170442	XZEUCEPRBQLLFP-UHFFFAOYSA-N	439.906	1.327	50	20	IDGD	
CCc1cc(N2CCC[C@H](NC(=O)NNC(=O)c3cnn(-c4ccccc4)c3)C2)ncn1	733348205	IUQSOGYDIRAUMG-SFHVURJKSA-N	434.504	1.838	50	20	IDGD	
COc1ccccc1N(C)S(=O)(=O)c1ccc(C)c(C(=O)NNC(=O)CN(C)C)c1	733359256	JNMQXIAQKVKJPD-UHFFFAOYSA-N	434.518	1.151	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)N[C@@H]2CCN(C3CCN(C)CC3)C2)cc1OC	734284500	XCXYNZYGQDNOPF-GOSISDBHSA-N	447.580	1.987	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)cc1C	734807588	WSPHMLPBRNUVEW-UHFFFAOYSA-N	442.538	1.896	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2csc3c2CCCC3)CC1	735117457	UGYXTUNJOQLLIJ-UHFFFAOYSA-N	435.575	1.715	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cnn(C)c2)c([N+](=O)[O-])cc1OCc1cscn1	735444204	GNJFOTXOMMPXOZ-UHFFFAOYSA-N	432.418	1.447	50	20	IDGD	
Cc1ccc(S(=O)(=O)Nc2ccccc2F)cc1C(=O)NNC(=O)c1cnn(C)c1	735471344	UWIMRKUDRUTQAE-UHFFFAOYSA-N	431.449	1.743	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)CC3(O)CCCC3)c2)cc1	735837294	RGWPPCPLWVQANS-UHFFFAOYSA-N	447.513	1.952	50	20	IDGD	
O=C(NNc1cccnn1)c1cccc(NS(=O)(=O)c2ccc3c(c2)OCCO3)c1	736702028	SOYOVCKASYQEDB-UHFFFAOYSA-N	427.442	1.806	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)COc1ccc(C#N)cc1)[C@@H]1CN(Cc2ccccc2)CCO1	741431586	HNUQMQUZSAMPQI-UWJYYQICSA-N	437.500	1.557	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H]2SCCc3sccc32)c1	742471135	ONALIIBGJCBYGW-HNNXBMFYSA-N	425.557	1.790	50	20	IDGD	
N#Cc1ccc(S(=O)(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)c(C(F)(F)F)c1	743268400	PHJCNWBNHNBZJF-UHFFFAOYSA-N	430.320	1.814	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)N[C@H]1CC(=O)N(CCOc2ccccc2)C1	743509884	MQBBBNXCNIDRGS-INIZCTEOSA-N	442.472	1.084	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)[C@]23CCC(=O)N2c2ccccc2S3)c1	744618943	VMZLIQHDVKJHBV-OAQYLSRUSA-N	425.466	1.928	50	20	IDGD	
CCN(C)[C@H](C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1)c1ccccc1	745102657	YLENJXCGQIGTIW-ICSRJNTNSA-N	427.457	1.210	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)NNC(=O)N[C@H]1CC(=O)N(CCOc2ccccc2)C1	745848603	UNNHVUIIYQSELO-KRWDZBQOSA-N	435.484	1.721	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NC[C@H](C)Oc2ccccc2F)c2ccccc2c1=O	745891562	CXPKCLBXZRCEON-ZDUSSCGKSA-N	427.436	1.967	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2CCC[C@@H](C(=O)OC)C2)c1	746093709	SOBZQWUBRFTBIF-GDBMZVCRSA-N	439.534	1.458	50	20	IDGD	
CC[C@@H](C(=O)N1CCC(NC(=O)NNC(=O)[C@H](C)OCCOC)CC1)c1ccccc1	748623550	JRPUYGCGNKFZCG-QFBILLFUSA-N	434.537	1.553	50	20	IDGD	
CS(=O)(=O)Cc1ccccc1CNC(=O)NNC(=O)c1cccc(OC(F)F)c1	749588605	WNOWOSZRCHFRDP-UHFFFAOYSA-N	427.429	1.977	50	20	IDGD	
C[C@@H]1C(=O)Nc2cc(C(=O)OCC(=O)NNC(=O)c3ccc(Cl)cc3)ccc2N1C	750564695	CXAOIPQXZFXSPU-LLVKDONJSA-N	430.848	1.735	50	20	IDGD	
CN(C)C(=O)CN1C(=O)C(=NNC(=O)c2ccccc2O)c2cc(Br)ccc21	750917035	WXLANWCHNAGOHA-UHFFFAOYSA-N	445.273	1.724	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2cc(C(=O)O)ccc2O)cc1Br	751213056	NPPKMWMWZCNLNU-UHFFFAOYSA-N	445.247	1.485	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NCC2(CN3CCOCC3)CCCCC2)cc1	751820020	XGESHLBXPMNBFX-UHFFFAOYSA-N	434.537	1.687	50	20	IDGD	
CC(C)(C(=O)NNC(=O)Nc1cccc(S(=O)(=O)N2CCOCC2)c1)c1ccccc1	755353395	GKDQRQOAAKDYRA-UHFFFAOYSA-N	446.529	1.838	50	20	IDGD	
CC(C)(C)S(=O)(=O)N1CCC(NC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)CC1	755878180	VXMOABVMHBGDOP-UHFFFAOYSA-N	427.483	1.132	50	20	IDGD	
COc1cc(CN2CC[C@@H](NC(=O)NNC(=O)COc3ccc(C)cc3)C2)cc(OC)c1	756103974	WHUUMOAVFOBOKO-GOSISDBHSA-N	442.516	1.996	50	20	IDGD	
COc1cc(Br)c(NC(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)cc1OC	756183931	PVLCTZJITFAQJP-QMMMGPOBSA-N	436.284	1.054	50	20	IDGD	
O=C(NNC(=O)N1CCOCC1)[C@H]1CCC(=O)N1Cc1ccc(Br)cc1	756820698	VWCXVXBAZHZRMA-CQSZACIVSA-N	425.283	1.013	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CCc2ncc(NC(=O)NNC(=O)Cc3cc[nH]n3)cc2C1	757928659	UUOXIERPUUZTGX-CYBMUJFWSA-N	429.481	1.582	50	20	IDGD	
O=C(c1cn(-c2ccc(Cl)cc2)nn1)N1CCN(S(=O)(=O)CBr)CC1	758511557	AHVPOFDXNCELAQ-UHFFFAOYSA-N	448.730	1.361	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)N2CCN(S(=O)(=O)CBr)CC2)cc1	758516313	AGNKISWMYXYKHW-UHFFFAOYSA-N	432.384	1.968	50	20	IDGD	
COC(=O)C12CCC(C(=O)OCC(=O)NNC(=O)c3cc(Cl)ccc3OC)(CC1)C2	759258594	IFXRGPUQEKUWNF-UHFFFAOYSA-N	438.864	1.776	50	20	IDGD	
CN1C(=O)C[C@H](C(=O)NNC(=O)C(=O)Nc2ccccn2)[C@@H]1c1ccc(Cl)c(F)c1	759364853	PKBKTHGDIOVZQS-ZBEGNZNMSA-N	433.827	1.180	50	20	IDGD	
CC1(C)C(=O)N(C[C@@](C)(O)C(=O)NNC(=O)Cc2c[nH]c3ccccc23)c2ccccc21	760064626	AHZDSOXRTUNTIP-XMMPIXPASA-N	434.496	1.933	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)CCNC(=O)OC(C)(C)C)cc(S(=O)(=O)N(C)C)c1C	760439427	MDBOXZQCIAFPSI-UHFFFAOYSA-N	442.538	1.230	50	20	IDGD	
COc1cc(C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc2c1O[C@@H](C)C2	761066935	REYIYOJVGDSBBA-NSHDSACASA-N	429.385	1.545	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2cccc([C@@H]3CCOC3)c2)CC1	762251845	BWQIUSHZWNPHQT-GOSISDBHSA-N	445.545	1.279	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)C(=O)Nc1cccc(OC[C@@H]2CCCO2)c1	763446899	YETQAAQGCHSHRG-KRWDZBQOSA-N	428.401	1.552	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)Nc1ccc(Cl)cc1OC(F)F	763572745	OLLVMFJKQDPVFT-CQSZACIVSA-N	441.774	1.867	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(C#N)ccc1OC(F)F	763661435	BMGFEKXCXOKFRE-UHFFFAOYSA-N	434.355	1.333	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2cccc(NC(=O)[C@@H](C)OC)c2)c1	763772560	MVHJBADZBFFLNV-GFCCVEGCSA-N	444.444	1.077	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)C(=O)Nc2ccc(F)c(F)c2)c2ccccc2c1=O	763791395	QOSYDZKLFFXYFB-UHFFFAOYSA-N	429.383	1.655	50	20	IDGD	
COC(=O)C(C)(C)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)cc1	763806491	DRDGPSITOHWJSZ-UHFFFAOYSA-N	438.440	1.174	50	20	IDGD	
CO[C@H](C)C(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)COc2ccc(C)cc2)c1	763811771	MUQNKGQFGJIDQT-CQSZACIVSA-N	428.445	1.133	50	20	IDGD	
N#Cc1cccc(-c2csc(NC(=O)C(=O)NNC(=O)COc3ccc(F)cc3)n2)c1	763840272	PEWMDBQICWWUBK-UHFFFAOYSA-N	439.428	1.986	50	20	IDGD	
Cc1nc(-c2cccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc3ccccc3F)c2)n[nH]1	763852490	XYFSCPIYKKFMKB-LLVKDONJSA-N	426.408	1.473	50	20	IDGD	
COCCc1cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc3ccccc3c2)n(C)n1	763854819	UEVTYBIWWXCZRK-AWEZNQCLSA-N	439.472	1.316	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(C#N)cc2Cl)cc1	763872291	NJZHELPHMJKXAE-LBPRGKRZSA-N	428.832	1.968	50	20	IDGD	
CC(=O)Nc1cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)ccc1Cl	763873468	TXOILTFEVOTWFF-SNVBAGLBSA-N	436.827	1.991	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)OCCO3)cc1	763878614	RZVVORIIFVMOPT-CYBMUJFWSA-N	427.413	1.214	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccc(CCN3CCCCC3)cc2)n1	763893225	QDDXBLJWQGVGLH-UHFFFAOYSA-N	426.521	1.314	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)C(=O)Nc1cccc(CSC2CCCC2)c1	764002496	NDUPNCJXVGTDNO-AWEZNQCLSA-N	439.559	1.383	50	20	IDGD	
CN1C(=O)CCc2cc(NC(=O)C(=O)NNC(=O)c3cccc(Br)c3)ccc21	764058129	ASLNWCGDIDNAQT-UHFFFAOYSA-N	445.273	1.758	50	20	IDGD	
CCOC(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)c2cccc(Br)c2)c1	764058918	KJEKTKYAXWEBND-UHFFFAOYSA-N	448.273	1.954	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccccc2N2C[C@H](C)O[C@@H](C)C2)c(O)c1	764110587	RBYVPCRDRKMARE-GJZGRUSLSA-N	426.473	1.714	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1cc(C)nn1[C@H]1C[C@H]2CC[C@H]1C2	764135606	JKRFPRWZIQTERL-ZOBUZTSGSA-N	425.489	1.890	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)ccc1Br	764164813	UCXIDPHWMCQYMS-HNNXBMFYSA-N	434.246	1.547	50	20	IDGD	
O=C(CC1CCCC1)NNC(=O)C(=O)Nc1c(C(=O)N2CCOCC2)oc2ccccc12	764185892	XBDCNRKNHKOJMU-UHFFFAOYSA-N	442.472	1.571	50	20	IDGD	
CS(=O)(=O)c1ccc(F)c(NC(=O)C(=O)NNC(=O)c2c(Cl)cccc2Cl)c1	764221207	ILAWEVUVSBYSCW-UHFFFAOYSA-N	448.259	1.936	50	20	IDGD	
O=C(CCCc1cccs1)NNC(=O)C(=O)Nc1ccccc1S(=O)(=O)C(F)F	764342187	CHJADDAYCCLEQS-UHFFFAOYSA-N	445.469	1.853	50	20	IDGD	
COc1cc(OC)c(OC)cc1NC(=O)C(=O)NNC(=O)CSc1ccccc1OC	764392720	KJAMLNOLTZNKCR-UHFFFAOYSA-N	449.485	1.599	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)Nc3cccc([N+](=O)[O-])c3)CC2)cc1	765313732	UXZHJOPLSBNHJQ-UHFFFAOYSA-N	426.477	1.874	50	20	IDGD	
Cc1ccc(Br)c(S(=O)(=O)NNC(=O)CNC(=O)c2cccs2)c1	765642456	GBEQHNMEPMDCMX-UHFFFAOYSA-N	432.321	1.559	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)c1ccc2c(c1)CCO2	765756829	REHOMXISJFBBBF-UHFFFAOYSA-N	428.920	1.854	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)c2cc(C)ccc2S(N)(=O)=O)c1	767412913	ZNBMYEASFKZYSK-UHFFFAOYSA-N	442.291	1.488	50	20	IDGD	
O=C(COC(=O)C12C[C@H]3C[C@@H](CC(F)(C3)C1)C2)NNC(=O)[C@@H]1COc2ccccc2O1	767468578	JMTKSUXINYITAC-CJWRWJRQSA-N	432.448	1.826	50	20	IDGD	
COc1ccc2c(c1)OC[C@H](NC(=O)NNc1nc(O)c3cnn(C(C)(C)C)c3n1)C2	768105510	MWKHRKYMFYMCPZ-GFCCVEGCSA-N	427.465	1.925	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2c(C)cnn2Cc2ccccc2F)c1	769251137	DXZQRZRCEXLQLA-UHFFFAOYSA-N	439.447	1.852	50	20	IDGD	
CC(=O)N1CCc2c(NC(=O)C(=O)NNC(=O)c3cc(-c4ccccc4)[nH]n3)cccc21	769252282	IIFOZGQIXFVIHG-UHFFFAOYSA-N	432.440	1.385	50	20	IDGD	
COc1ccc(Cl)cc1N1C[C@H](C(=O)NNc2nc(O)c3cnn(C)c3n2)CC1=O	770989966	KBLUDIZKCDDCCQ-SECBINFHSA-N	431.840	1.227	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)CCNC(=O)Nc1ccc(Br)cc1	772024753	ZMBBWPOZLUUSRG-SNVBAGLBSA-N	429.271	1.450	50	20	IDGD	
COc1ccc([C@@H](OC)[C@@H](C)NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1	772076491	KZSQXYDOHNZMAK-ACJLOTCBSA-N	435.502	1.819	50	20	IDGD	
CN(C)C(=O)Nc1ccc(C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)c(Cl)c1	772225307	DHGCJJPLIJPWDU-UHFFFAOYSA-N	442.904	1.902	50	20	IDGD	
C[C@@H]1C[C@H](NC(=O)NNC(=O)[C@H]2COc3ccccc3O2)CCN1C(=O)OC(C)(C)C	772466241	XZLIMVLEUKSCKS-CKEIUWERSA-N	434.493	1.945	50	20	IDGD	
CC(=O)[C@@H]1CC(C(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)=NN1c1ccccc1	772898283	POVLIKAPBYDUJA-SFHVURJKSA-N	441.875	1.328	50	20	IDGD	
N#Cc1ccc(Cn2cnc(NC(=O)C(=O)NNc3ccc(C(F)(F)F)cn3)n2)cc1	773666299	LPUPSMGEHWIVAD-UHFFFAOYSA-N	430.350	1.694	50	20	IDGD	
N#Cc1ccc(Cl)c(S(=O)(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)c1	775252088	OHQQDWKOIPDNEI-UHFFFAOYSA-N	449.297	1.136	50	20	IDGD	
O=C(NNS(=O)(=O)c1cnn(CC(F)(F)F)c1)c1cccc(Br)c1	775282962	NSUWFYDYYRKPSJ-UHFFFAOYSA-N	427.202	1.831	50	20	IDGD	
O=C(NCCc1cnccn1)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	775455723	VEWMBTXKVFMJGQ-UHFFFAOYSA-N	446.514	1.526	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)c2cccc(Cc3cnc(N)s3)c2)cc1	775894087	GEIAGDSTSKDNGH-UHFFFAOYSA-N	435.465	1.806	50	20	IDGD	
COC(=O)c1cc(Br)c(S(=O)(=O)NNC(=O)c2cccc(C#N)c2)s1	777625079	XAECTEWCCIILSL-UHFFFAOYSA-N	444.288	1.792	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)[C@H]1CC[C@H](C(=O)NNC(=O)c2ncccc2C)CC1	777995352	LXWFCWQAPXVJSY-WKILWMFISA-N	438.488	1.122	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@]2(C[C@@H]2C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)C1	780173018	BHWYOMCFFXHKCB-QRWLVFNGSA-N	427.465	1.070	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NN=C3COCc4ccccc43)CC2)cc1	782254279	WOMGFFJUIQMJGG-UHFFFAOYSA-N	442.541	1.352	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)cc1)C(=O)Nc1cccc(N2CCN(CC3CC3)CC2)c1	782837728	REQSCGRAQGLAPS-UHFFFAOYSA-N	437.500	1.324	50	20	IDGD	
CS(=O)(=O)c1ccc(Cl)c(NC(=O)C(=O)NNc2ncnc3ccsc23)c1	783254993	PLPXOWGFDAWQQN-UHFFFAOYSA-N	425.879	1.830	50	20	IDGD	
COc1cc(C=NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)ccc1OCCC(=O)O	783798482	IEGSWFMCQHWLJT-UHFFFAOYSA-N	449.485	1.563	50	20	IDGD	
CS(=O)(=O)NCc1ccc(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2Cl)cc1	784391250	GHNLRYMJDFODCK-UHFFFAOYSA-N	441.853	1.379	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)C1(Cc2ccc(OC(F)(F)F)cc2)CC1	784793931	RSWYUCPTWKDHBD-UHFFFAOYSA-N	436.390	1.880	50	20	IDGD	
CCS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccnc(Br)c2)cc1	784837667	ZZYLPKFWHONOAS-UHFFFAOYSA-N	427.280	1.720	50	20	IDGD	
CC(=O)N1CCN(Cc2ccc(NC(=O)C(=O)NNc3ccc(Cl)nc3)cc2)CC1	784869718	ICHFDUTVAMIMIX-UHFFFAOYSA-N	430.896	1.481	50	20	IDGD	
CN(C)c1nccc(NNC(=O)C(=O)Nc2ccc(C(=O)N3CCCCC3)c(Cl)c2)n1	784971266	XMJHENRQQOWHHF-UHFFFAOYSA-N	445.911	1.904	50	20	IDGD	
Cc1cc(C(=O)N2CCOCC2)ccc1NC(=O)C(=O)NNc1cc(F)c(F)c(F)c1	785087435	SAXRPBNOGDOXMH-UHFFFAOYSA-N	436.390	1.967	50	20	IDGD	
O=C(NNc1nc(C(F)(F)F)cs1)C(=O)Nc1ccc2nc3n(c(=O)c2c1)CCC3	785146678	YKPCNYSCHCBBGW-UHFFFAOYSA-N	438.391	1.900	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2ccc(N3CCCC3=O)c(F)c2)n1	785224996	AEOVLUOFHHAUTQ-UHFFFAOYSA-N	429.456	1.671	50	20	IDGD	
NS(=O)(=O)c1ccccc1NNC(=O)[C@H]1CCCN(C(=O)c2ccc(Cl)cc2)C1	788232487	SWTSKCDXVVFABX-AWEZNQCLSA-N	436.921	1.983	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2nnn(CC3CCCC3)c2C)cc1OC	789187845	TVIMRAHYOMSKSE-UHFFFAOYSA-N	445.476	1.412	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2ccc(C(N)=O)c(OC(C)C)c2)c1	789731527	DUWDSPHXRPJFRX-UHFFFAOYSA-N	442.472	1.354	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)nn1[C@H](C)C1CC1	789817851	KOEIRQXUAJZXAS-LJHODMEESA-N	425.489	1.821	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNS(=O)(=O)c2ccc(OC(F)F)c(F)c2)cc1C	790342527	WHWSVOTUCUBQBH-UHFFFAOYSA-N	431.392	1.992	50	20	IDGD	
C[C@@]1(C2CC2)NC(=O)N(c2cccc(CNC(=O)NNC(=O)c3ccc(C#N)cc3)c2)C1=O	790691140	HNJQTEDYNBAQMZ-QHCPKHFHSA-N	446.467	1.927	50	20	IDGD	
Cc1c(C(=O)NNC(=O)Cc2cn3ccccc3n2)nnn1Cc1ccc(F)cc1F	790704909	GVZRCMBWLUUZSW-UHFFFAOYSA-N	425.399	1.564	50	20	IDGD	
CC(=O)N1CCCN(c2ccc(F)cc2NC(=O)C(=O)NN(C)c2ccccc2)CC1	790957684	MWXJVKNROWNDEL-UHFFFAOYSA-N	427.480	1.990	50	20	IDGD	
COc1ccc(OC)c(C2=NO[C@H](C(=O)NNC(=O)c3ccc4c(c3)OCCO4)C2)c1	791483802	QHMVPLRVYGZEPC-IBGZPJMESA-N	427.413	1.429	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@H]2CC(c3cccc(OC)c3)=NO2)c2ccccc2c1=O	792016937	CZRRJMIHMLFLCL-GOSISDBHSA-N	435.440	1.379	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)Cc2ccccc2F)cc(Cl)c1F	792265832	KAUKMMPHCCIBDV-UHFFFAOYSA-N	425.775	1.733	50	20	IDGD	
COCC1(C(=O)NNC(=O)Cn2cnc3ccccc32)CCN(C(=O)OC(C)(C)C)CC1	792807238	OGMOTMSRAHHZDL-UHFFFAOYSA-N	445.520	1.847	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)Cc2ccc(S(=O)(=O)N(C)C)cc2)cc1OC	792824602	NAGQNSYFGDTANR-UHFFFAOYSA-N	449.529	1.738	50	20	IDGD	
O=C(NN=Cc1c(Br)n[nH]c1Br)c1ccc(-n2cnnn2)cc1	792935180	AIIMTRBFQZNAMF-UHFFFAOYSA-N	440.059	1.674	50	20	IDGD	
CC(C)(C)c1cc(NC(=O)C(=O)NNC(=O)Cc2cccnc2)n(-c2ccc(C#N)cc2)n1	793025442	KMXVZTZVYBVGAP-UHFFFAOYSA-N	445.483	1.765	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)C(=O)Nc1ccc2c(c1)N(CC(F)F)C(=O)CS2	793026697	TWWIDJDHCGDYNG-UHFFFAOYSA-N	449.439	1.114	50	20	IDGD	
COCc1ncc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)s1	794741459	NLHKFIWYZWRGCX-UHFFFAOYSA-N	438.531	1.539	50	20	IDGD	
CCNC(=O)N(C)c1cccc(NC(=O)C(=O)NNC(=O)c2ccc(OC)cc2OC)c1	797010022	ZMDQEOPSIPUPKZ-UHFFFAOYSA-N	443.460	1.269	50	20	IDGD	
COC(=O)[C@H]1CC[C@H](C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)CC1	797791569	CKVKOKYETYOJME-KOMQPUFPSA-N	437.518	1.212	50	20	IDGD	
CN1C(=O)COc2cc(NC(=O)C(=O)NNC(=O)c3cc4c(s3)CCCCC4)ccc21	799258715	KCLBMFNCKAAALY-UHFFFAOYSA-N	442.497	1.772	50	20	IDGD	
NS(=O)(=O)Cc1cccc(CNC(=O)NNC(=O)c2ccc(Cl)cc2Cl)c1	800719831	ZPBDTEBXWIKMGY-UHFFFAOYSA-N	431.301	1.926	50	20	IDGD	
Cn1cc(Oc2ccccc2C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cn1	801463179	FUSFRDXZIBMWKM-UHFFFAOYSA-N	439.384	1.739	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCc2ccccc2)cc1C(=O)NNC(=O)N=c1cc[nH]cc1	802030026	UGZFBDBCHXMUII-UHFFFAOYSA-N	439.497	1.757	50	20	IDGD	
COC(=O)c1c(F)cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)cc1F	802566170	CFLCIASGVCXTCY-SECBINFHSA-N	439.346	1.444	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1cccc(Br)c1Cl	802566688	BFZQXTXKWGTYKV-UHFFFAOYSA-N	442.653	1.973	50	20	IDGD	
Cn1cc(NC(=O)C(=O)NNc2c(Br)cccc2Br)ccc1=O	802600186	NLDVQQAQNQVKEA-UHFFFAOYSA-N	444.083	1.992	50	20	IDGD	
O=C(CCS(=O)(=O)c1ccc2c(c1)OCCO2)NNc1ccc2c(=O)[nH]ccc2c1	803437969	XZVWFIBYACBAHR-UHFFFAOYSA-N	429.454	1.606	50	20	IDGD	
Cc1cc(=O)c(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cn1C1CC1	806306188	IOKYOJWFCKJTFG-UHFFFAOYSA-N	444.513	1.351	50	20	IDGD	
CCN1CCN(c2ccc(NC(=O)C(=O)NNc3ccc(-n4ccnc4)nn3)c(C)c2)CC1	807428646	HEXWSUBHJCEQDP-UHFFFAOYSA-N	449.519	1.194	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2cnn(-c3ccc(Cl)cc3)c2C)c1O	808934423	DTIJDLDOTJADKC-UHFFFAOYSA-N	443.847	1.948	50	20	IDGD	
COC[C@@]1(C(=O)NNC(=O)Cc2nc3ccccc3n2C)CCN(C(=O)OC(C)(C)C)C1	809983979	RGHIWIMEVWSXMZ-JOCHJYFZSA-N	445.520	1.537	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)/C=C/c1ccccc1)C(=O)NNc1ncncc1F	817071055	NHUZJDYEAMZBNC-TUPIDYKKSA-N	425.511	1.771	50	20	IDGD	
C[C@@H](Sc1nnnn1C1CC1)C(=O)NNC(=O)[C@H]1CCCN(C(=O)OC(C)(C)C)C1	819658838	PTBGBTOKHBYWNK-NEPJUHHUSA-N	439.542	1.283	50	20	IDGD	
N#Cc1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2ccc(Cl)cc2Cl)cc1	913216290	NWMUINOEYSZZLN-UHFFFAOYSA-N	427.269	1.605	50	20	IDGD	
CN(C)N(C(=O)c1cn(-c2ccccc2Br)nn1)[C@@H]1CCS(=O)(=O)C1	914717416	JHJZGHCHBALBEY-LLVKDONJSA-N	428.312	1.136	50	20	IDGD	
Cc1cc(C)c(N2C[C@@H](C(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)CC2=O)c(C)c1	914750519	JNOFSHTYORIGEL-INIZCTEOSA-N	447.495	1.673	50	20	IDGD	
CCOC(=O)N[C@@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)N(CC)CC)c1)C(C)C	915062951	LBPNCSMEKDJFKJ-MRXNPFEDSA-N	442.538	1.249	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)[C@@H](Cc2ccc(F)cc2)n2nnnc2C)cc1C	915695574	SPQFMWCXCCFNFT-LJQANCHMSA-N	426.452	1.748	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCCCN2CCCCCC2=O)nc1	915905716	XDYZNKQZVLILQD-UHFFFAOYSA-N	426.543	1.187	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)NCc3ccc(S(N)(=O)=O)s3)n[nH]2)cc1	915905975	AQCGRTPSOZWSPV-UHFFFAOYSA-N	434.503	1.238	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2ccc(Cn3cccn3)cc2)c1	916222363	AUCPKBNAIMTJMO-UHFFFAOYSA-N	427.486	1.479	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)NCc3ccc(N4CCOCC4)nc3)n[nH]2)cc1	916234464	GKSKRLSXWDDFKM-UHFFFAOYSA-N	435.488	1.761	50	20	IDGD	
COc1cccc(NCC(=O)NN=Cc2c(C)nn([C@@H]3CCS(=O)(=O)C3)c2Cl)c1	916360211	XTIDGQBFLBFRFH-CQSZACIVSA-N	439.925	1.775	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(C3CC3)n(C(C)(C)C)n2)c1	916723161	GXYQMDXRUGRBPD-UHFFFAOYSA-N	433.534	1.841	50	20	IDGD	
CCC(=O)N[C@H](CCSC)C(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12	917387966	SWUQLZCBWHBFBS-OAHLLOKOSA-N	433.534	1.386	50	20	IDGD	
Cc1ccccc1NC(=O)NNC(=O)c1ccc(S(=O)(=O)NC[C@H]2CCCO2)cc1	918691831	ZIMHRHALDCOKLJ-MRXNPFEDSA-N	432.502	1.919	50	20	IDGD	
CS(=O)(=O)NC[C@@H]1CCCN(C(=O)NNC(=O)c2ccc(Br)s2)C1	918778671	LXBJKCIWASLJHF-VIFPVBQESA-N	439.357	1.126	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)[C@@H](CC(C)C)N1C(=O)[C@H]2CC=CC[C@H]2C1=O	919822777	IYKSFNFOKQSZOY-FGTMMUONSA-N	427.501	1.751	50	20	IDGD	
O=C(NNC(=O)C1=NN(c2ccccc2)[C@@H](c2ccccc2)C1)N[C@H]1CCS(=O)(=O)C1	919888910	HPJYRCNKTUVDTM-QFBILLFUSA-N	441.513	1.512	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2ccc(-n3ccnc3)c(F)c2)c1	920239406	FNBZPFUYKGNJBJ-UHFFFAOYSA-N	431.449	1.559	50	20	IDGD	
CCCNC(=O)NNC(=O)c1cc(S(=O)(=O)N2CCCCC2)ccc1N1CCCC1	921042496	YNBCRZOEVATHBV-UHFFFAOYSA-N	437.566	1.815	50	20	IDGD	
O=C(CCCC[C@@H]1SC[C@H]2NC(=O)N[C@H]21)NNC(=O)c1cncn1-c1ccccc1	1318054453	LVIXWYOQZNCAOD-UWWQBHOKSA-N	428.518	1.359	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@@H]2CCOC2)c1	1318058378	VLXRDQKUVCYEQN-AWEZNQCLSA-N	448.501	1.477	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)c1ncoc1[C@@H]1CCCO1	1319220888	WYZJQUAEMDATOU-KRWDZBQOSA-N	447.923	1.758	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNS(=O)(=O)c2ccc3c(c2)CCCO3)CC1	1319750796	AGRLTIJRNSLIHR-UHFFFAOYSA-N	439.534	1.968	50	20	IDGD	
C[C@H](CCNC(=O)NNC(=O)CNC(=O)c1cccs1)N(C)C(=O)OC(C)(C)C	1321743081	GZQCQMYQXUDRSL-GFCCVEGCSA-N	427.527	1.454	50	20	IDGD	
O=C(NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12)c1ccc(O)cc1O	1342037878	SSAXJHNKAMUBRC-UHFFFAOYSA-N	430.420	1.931	50	20	IDGD	
Cc1nc[nH]c1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)CBr)C2	1778253883	HIBJZUOMUUIVHI-WPKBUWHJSA-N	427.343	1.877	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc4cccnn4n3)C2)C1	1779963746	SUSIOSIWJNKBTE-FZKQIMNGSA-N	436.310	1.204	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)N2CCN(C)CC2)C1	1780637212	QYPRXCWYMXVOEV-JPAWQOSXSA-N	443.032	1.544	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(Cl)c4nncn4c3)CCO2)C1	1781222157	WYNHBYFPCVOQCW-UGSOOPFHSA-N	426.304	1.844	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(S(C)(=O)=O)c(F)c3)CCO2)C1	1781223627	QPEXIIRZAQYEQB-IFXJQAMLSA-N	446.928	1.690	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc4nncn4c3)CCO2)C1	1781229897	KPRQHCQNISULLV-MSOLQXFVSA-N	426.304	1.409	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccccc3C(N)=O)CCO2)C1	1781234701	PXAVZOMLIODYKN-RBUKOAKNSA-N	428.316	1.465	50	20	IDGD	
O=C(c1nnsc1C1CC1)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781329919	NSSTZRIYDCLQRS-IUODEOHRSA-N	433.303	1.550	50	20	IDGD	
C[C@@H](C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)CBr)C2)n1ccnn1	1781545983	BEUSFIRFEDQHFW-OIPACUDHSA-N	442.358	1.384	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H]1COc3ccccc3O1)CCO2	1783530290	WLGKEXBEQVRPHD-CRFBAAHOSA-N	439.306	1.440	50	20	IDGD	
Cc1ccn2ncc(C(=O)N3CCO[C@]4(CCN(C(=O)[C@H](C)Br)C4)C3)c2c1	1783534748	OCBDQEJHWNIAFB-LIRRHRJNSA-N	435.322	1.870	50	20	IDGD	
COc1ccc([C@H](C)C(=O)N2CCO[C@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc1	1783933006	OGJCRXHZQQYMOM-SBUREZEXSA-N	446.548	1.002	50	20	IDGD	
CCO/C=C/C(=O)N1CC[C@@]2(C1)CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)CCO2	1784236397	ZTTWZXZYGUTSGA-VMLCMGRWSA-N	447.444	1.514	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(F)(F)C(F)(F)C(=O)O)C[C@@H]21	1784615804	ALKBWECADXKKLI-BJDJZHNGSA-N	446.825	1.729	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)Cn3cccn3)[C@H]2C1	1785445241	YOHMSHLRTRBYPX-VIQHNZTISA-N	441.370	1.672	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CN3CCc4sccc4C3)C[C@@H]21)[C@@H](F)Cl	1787444079	LXFRRUXPKUCSNL-YRBFXIGRSA-N	429.945	1.620	50	20	IDGD	
C[C@H](Nc1nccs1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21	1787486290	DOYSLCAFTKVFPL-VLJOUNFMSA-N	449.346	1.614	50	20	IDGD	
CC(C)(CCl)C(=O)NC1(c2ccc(NC(=O)c3cc(=O)n4[nH]nnc4n3)cc2)CCC1	1788407335	DDVQBHNOZVDBRV-UHFFFAOYSA-N	443.895	1.825	50	20	IDGD	
CCOC(=O)C1(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]3C2)CC1	1788764577	VBFXEQZPXLZHTH-JYJNAYRXSA-N	426.586	1.161	50	20	IDGD	
CCC(=O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C[C@@H]21	1790818879	JYBTZYCMGWEGFK-GOFCJJFNSA-N	431.439	1.831	50	20	IDGD	
COc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](O)CCl)C[C@@H]32)c(Cl)c1	1792016652	XZDOVBLFXNTMNK-GQGQLFGLSA-N	431.316	1.542	50	20	IDGD	
C[C@@H](CBr)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](O)NC(=O)OC(C)(C)C)C2	1792990637	BSQIYQCEBFTNDS-DKBOKBLXSA-N	448.358	1.499	50	20	IDGD	
Cc1nn(-c2ccccc2)c(O)c1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCl	1793111064	ZOXMRAHJPNBDBZ-ORQFMDKSSA-N	432.908	1.738	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CCCN1C	1793875884	PJXHJDCRGDLWMA-RCJHGTSTSA-N	444.488	1.866	50	20	IDGD	
O=C(Cc1cccnc1Cl)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2	1793952217	PFXBSKSAGFOXLM-YWVIFJGQSA-N	430.730	1.652	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](CCN)NC(=O)OC(C)(C)C	1796030811	PDYRFZJOIMHGOP-XFIYOXNOSA-N	430.977	1.884	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)c1cc(=O)c2ccccc2o1	1796185634	CGNXWHTYQCWYSD-BCDXTJNWSA-N	446.268	1.038	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCc1c[nH]c2ccccc12)c1ccc(B(O)O)cc1	1796270222	GRKYJFALOBSKJT-WKCHPHFGSA-N	445.328	1.732	50	20	IDGD	
C=C1C[C@@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Cl)N(C(=O)OC(C)(C)C)C1	1796369369	XECZURNAZOSAOJ-QRJUGERDSA-N	445.919	1.676	50	20	IDGD	
CCC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Cl	1796370718	LCUIHWZIYRMKHT-XLWJZTARSA-N	435.924	1.804	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccnn1-c1ccccc1	1796739021	PLGRFJJNOJJVDJ-LORHWOILSA-N	432.908	1.329	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2)c1ccc2c(c1)OCCO2	1796788022	RMMKBZQLVUAFRU-ZSBFGKGUSA-N	439.306	1.446	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1nn(C)c2c1CCC2	1797044123	LZZKGBBQAGKZCM-NFFDBFGFSA-N	439.354	1.143	50	20	IDGD	
Cc1cccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)c1F	1798439521	FAEVVDCRCNKROK-QDMKHBRRSA-N	425.464	1.698	50	20	IDGD	
Cc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Br)C3)n(C(F)F)n1	1798680531	ZGEDUGCXNHSCKX-RBLKWDMZSA-N	439.232	1.480	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CCN(C(=O)OC(C)(C)C)C1)C2	1799267784	FXIHTJZICQTESE-KSWRQPAISA-N	443.972	1.850	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(N2CCOCC2)c1	1799613434	YAZFYPYJYXCXIF-PIKOESSRSA-N	435.952	1.744	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)ccc1O	1799793998	PCYMVZVFTUFFTO-YHYOWMERSA-N	427.295	1.475	50	20	IDGD	
CN(C)[C@@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)c1ccccc1Cl	1800308815	BCPLPGFJEGYKCZ-BENORSOKSA-N	444.359	1.132	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cn1nc(C)cc1C)C2	1800640057	IXXWVSCDGDONSG-IVSAIRAKSA-N	427.343	1.263	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)Cc2ccc3c(c2)OCO3)[C@H]1c1cccnc1)[C@@H](O)CCl	1803137991	GHHHAHPADLNZAU-FIKGOQFSSA-N	445.903	1.659	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)cc1	1803146759	PUHQBXSISGXHRY-RLLQIKCJSA-N	444.919	1.959	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)C2=CCCS2)[C@H]1c1cccnc1	1803639727	IQDVOCLSSOVCBU-OXQOHEQNSA-N	431.562	1.481	50	20	IDGD	
O=C([C@H](F)Cl)N1CC[C@@H](CNC(=O)C(F)(F)C(F)(F)C(=O)O)[C@H]1c1cccnc1	1804042139	GZZSLZPHXALDFQ-AXFHLTTASA-N	443.756	1.977	50	20	IDGD	
O=C(/C=C/c1ccoc1)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1804314688	YLLWLEAJJHJYCB-GVHNWALWSA-N	445.284	1.387	50	20	IDGD	
Cc1nc(CC(=O)NC[C@H]2CCN(C(=O)CO[Si](C)(C)C)[C@H]2c2cccnc2)no1	1804496200	LCWZHNMZLGVIRA-UZLBHIALSA-N	431.569	1.873	50	20	IDGD	
Cn1cccc(C(=O)N2CC[C@H](CNC(=O)CCBr)[C@H]2c2cccnc2)c1=O	1806343127	SZXFYTQRUNMVOY-CRAIPNDOSA-N	447.333	1.885	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)CCN2CCOCC2)[C@H]1c1cccnc1	1806957117	QVYLYFUIECTHRT-WSTZPKSXSA-N	438.956	1.064	50	20	IDGD	
C[C@@H](C(=O)NC[C@@H]1CCN(C(=O)[C@H](F)Cl)[C@@H]1c1cccnc1)N1CCN(C)CC1	1807897518	AYBKPPJCOXHKEH-OWLYRPNTSA-N	425.936	1.258	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2nc[nH]c2[N+](=O)[O-])[C@@H]1c1cccnc1	1808371337	LZBUCZURYHYMOE-IPYPFGDCSA-N	436.856	1.286	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H](CNC(=O)[C@@H](F)Br)[C@@H]1c1cccnc1)n1ccnn1	1808679349	WKSSZMJLMKZYSZ-REBRKWNGSA-N	439.289	1.631	50	20	IDGD	
Cc1cccc(CC(=O)N2CCC3(CCCN(C(=O)c4ccc(B(O)O)cc4)C3)CC2)c1	1809968392	YYPCQWXWDZHPMJ-UHFFFAOYSA-N	434.345	1.762	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)CC2CCC2)[C@@H]1c1cccnc1	1810307673	FXKPFBKKRYTPMY-DYESRHJHSA-N	436.516	1.590	50	20	IDGD	
C[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](O)CCl)n[nH]1	1814864780	SUQPDZOUJFDKIU-IACUBPJLSA-N	443.932	1.915	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2nc(O)n3c2CCCC3)[nH]n1)[C@@H](O)CCl	1814872354	HDEWEEGDICDORT-OCCSQVGLSA-N	436.900	1.554	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCN(C)C)CC2	1817279946	MHYPTGRLMBKJAP-XIXVAHAYSA-N	445.549	1.141	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)/C=C/c2cccnc2)[nH]n1)c1cccc(B(O)O)c1	1817474626	WFHWXEYVSMUPGY-SQUSKLHYSA-N	445.288	1.504	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819403805	GMMGWQCUGZXYFG-ZFWWWQNUSA-N	433.900	1.732	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)C1(F)CCC1)CC2	1819801892	VBVGBGADXWVAGQ-SNVBAGLBSA-N	432.481	1.260	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](C)Cn3cncn3)sc2C1	1820077585	TVSVBASGHQICFH-GARJFASQSA-N	441.355	1.766	50	20	IDGD	
CC(=O)NC(C)(C)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1	1822998430	CWFNCQQQVHJYOK-KCJUWKMLSA-N	435.319	1.660	50	20	IDGD	
O=C(N[C@@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1)c1nc[nH]c1[N+](=O)[O-]	1823002170	ACGCJCMGYQBIMO-ANLVUFKYSA-N	447.246	1.691	50	20	IDGD	
Cc1ccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)c(O)c1	1823148534	UVJKTRJWVRZVIL-LJQANCHMSA-N	448.288	1.723	50	20	IDGD	
CC(C)(C)[C@@H](O)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1	1824134797	NWEPYRHMTVSSKY-OALUTQOASA-N	445.564	1.325	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCNC(C)=O)CC2	1825452146	XWSMOQSGWPAVAP-QWRGUYRKSA-N	431.356	1.755	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CSCC(=O)OC)CC2	1825994109	HVEJHVVPVJMZAM-VHSXEESVSA-N	435.955	1.215	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cn3ncccc3n1)CC2	1825999600	AJXUVRAJZRNREY-QWRGUYRKSA-N	434.909	1.665	50	20	IDGD	
COc1ccc(OCC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)cc1	1830234962	AEWOHPYNPFACBK-MJGOQNOKSA-N	430.860	1.065	50	20	IDGD	
CC(=O)O[C@@H](C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2)C(C)C	1830361732	BBDWOGXUOATKLS-OXQOHEQNSA-N	432.945	1.296	50	20	IDGD	
COc1cccc(C(=O)N2CCC(N3CCC(NC(=O)[C@H](O)CCl)CC3)CC2)c1F	1833313381	BRRCBUJUFJYTJE-QGZVFWFLSA-N	441.931	1.619	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)[C@H](C)n3cnnn3)CC2)CC1	1833535609	ZEMBMOHHQBBBND-WMLDXEAASA-N	425.965	1.213	50	20	IDGD	
C[C@](O)(C(=O)NC1CCN(C2CCN(C(=O)C(Cl)Cl)CC2)CC1)C(F)(F)F	1833641345	HLUMPEVQFUSVDX-HNNXBMFYSA-N	434.286	1.675	50	20	IDGD	
COc1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)n1	1833769131	VVBSUJKGZYXJID-OALUTQOASA-N	446.331	1.397	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccncc3)CCO2)C1	1834012275	WKBXSTWLAIPUDA-KSSFIOAISA-N	426.311	1.183	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccnc3OC)CCO2)C1	1834125292	OWMHCLNAZDPNJB-OXJNMPFZSA-N	425.913	1.568	50	20	IDGD	
O=C(CCBr)NC1CCN(C2CCN(C(=O)c3cnsn3)CC2)CC1	1834422477	OOGKOQPRTYCGFF-UHFFFAOYSA-N	430.372	1.508	50	20	IDGD	
Cc1cc(C(=O)N2CCC(N3CCC(NC(=O)CCBr)CC3)CC2)n[nH]1	1834423424	VFLYBTJEXGSLHV-UHFFFAOYSA-N	426.359	1.688	50	20	IDGD	
CCc1oncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1	1834521002	RTONUGOCTFZFKW-MSOLQXFVSA-N	434.320	1.543	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)c1ccc2ncncc2c1	1835586078	ZEIGWAXHKZPUPT-HXUWFJFHSA-N	445.951	1.415	50	20	IDGD	
C[C@H](Cn1cncn1)C(=O)NC1CCN(C2CCN(C(=O)C(C)(C)CCl)CC2)CC1	1835805401	FFCSAVKPFQULIL-MRXNPFEDSA-N	439.004	1.751	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](Cl)CC)CC2)CC1	1836397349	XYVOWVRITMKCMB-PBHICJAKSA-N	429.993	1.283	50	20	IDGD	
C[C@H](CC(N)=O)C(=O)N1CCC(OC2CCN(C(=O)CO[Si](C)(C)C)CC2)CC1	1836909780	GSOUPTSFVRANMU-OAHLLOKOSA-N	427.618	1.348	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccn4ccnc4c3)CCO2)C1	1836982776	RXRNQXXNNXOVGR-UWJYYQICSA-N	434.924	1.812	50	20	IDGD	
O=C(NCC(=O)N1CCC(OC2CCN(C(=O)[C@H](F)Cl)CC2)CC1)c1cccnc1	1837122511	ATDWMSBDLPKUJL-SFHVURJKSA-N	440.903	1.344	50	20	IDGD	
C[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1)N1C[C@H]2C[C@H]2C1	1837279268	SUNZTDICENZATA-PZTGFMGMSA-N	427.973	1.048	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)CCc3ccsc3)C2)C1	1837711784	PSOVPCDFTULINH-FQEVSTJZSA-N	440.638	1.989	50	20	IDGD	
O=C(CCc1ccc(O)nn1)N1CCC(OC2CCN(C(=O)[C@@H](F)Cl)CC2)CC1	1838085036	SQKHBSDIYLAVPU-GOSISDBHSA-N	428.892	1.648	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(C)nn3C(F)F)CCO2)C1	1838714567	MIEZOPCWZJJEPM-ACJLOTCBSA-N	434.871	1.674	50	20	IDGD	
CCn1nc(C(C)C)cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1838812666	PORQEKXUQHLJEQ-APWZRJJASA-N	430.908	1.631	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3c(F)cccc3F)CCO2)C1	1838864100	LSYJQPCRXFQUAQ-ORAYPTAESA-N	432.851	1.289	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3c(OC)cccc3OC)CCO2)C1	1838882507	JAALYMNEFKYWEF-YCRPNKLZSA-N	440.924	1.791	50	20	IDGD	
Cc1ccc(O)c(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)c1	1838893816	RKJLDKHPCCCTGA-CRAIPNDOSA-N	445.285	1.461	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCOc3ccccc3)C2)C1	1840151065	VQDIWQNJNGIOGE-NQIIRXRSSA-N	440.924	1.166	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccc(OC)c(F)c3)CCO2)C1	1840526127	ABHFJHLQBKIHQM-HRAATJIYSA-N	442.915	1.851	50	20	IDGD	
COc1ccc(F)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)c1	1840686886	KCZQCNDMPBNMPT-SFHVURJKSA-N	435.279	1.708	50	20	IDGD	
O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CCCSC1)CCO2	1840863827	UQLYKRKYVPVSKR-YOEHRIQHSA-N	435.384	1.371	50	20	IDGD	
C[C@H](C(=O)N1CC2(CCCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C1)C1(O)CCC1	1841924041	PANWOLWZJAPJOZ-CABCVRRESA-N	443.972	1.873	50	20	IDGD	
CN(CC(=O)N1CCCC12CN(C(=O)C(C)(C)C#N)C2)NC(=O)NCc1ccccc1	1845038247	JJIKYGDUDSGTJM-UHFFFAOYSA-N	426.521	1.086	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC12CN(C(=O)[C@@H](C)NC(=O)c1ccc(F)cc1)C2	1846178475	ZPFQXJUMPFFQIW-QWHCGFSZSA-N	440.313	1.931	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H]1CN(C(=O)OC(C)(C)C)CCO1	1847640238	FDUYURYHXTUBNG-VGWMRTNUSA-N	429.945	1.842	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1O	1847868441	BKVZEWPHMJRBBE-WOYTXXSLSA-N	443.972	1.824	50	20	IDGD	
Cc1[nH]nc(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)c1F	1848095767	NSZOUNBGNQNBPI-AVGNSLFASA-N	443.907	1.805	50	20	IDGD	
O=C(CCC(=O)c1cccs1)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	3554524	ZDOXWBGDLKXBMO-UHFFFAOYSA-N	435.527	1.957	50	20	IDGD	
O=C(NNC(=O)c1sccc1S(=O)(=O)N1CCCCC1)c1ccc2c(c1)OCO2	14075115	WWRKCOUKXKGPMJ-UHFFFAOYSA-N	437.499	1.726	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)CCc1c(C)nc2c(C(N)=O)cnn2c1C	108061458	ALEKQLCAHDEFDT-UHFFFAOYSA-N	444.879	1.501	50	20	IDGD	
N#Cc1ccc(N2CCN(CC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)CC2)c(F)c1	725803399	LWGVRHYFOLZLCU-UHFFFAOYSA-N	426.408	1.189	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(n2cc(C(=O)NNC(=O)c3ccccc3O)nn2)CC1	725879190	BGLHWUKCAPUCHX-UHFFFAOYSA-N	430.465	1.631	50	20	IDGD	
Cc1cccc(-c2nnc(S)n2CCC(=O)NNC(=O)CNC(=O)c2ccco2)c1	725901987	DLZNZPXIKQDKNJ-UHFFFAOYSA-N	428.474	1.103	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)N[C@@H](CN1CCCC1=O)c1ccccc1	726091851	BGIFFHLYQCXIEE-HNNXBMFYSA-N	429.502	1.172	50	20	IDGD	
O=C(NCCc1cccs1)NNC(=O)c1nccnc1C(=O)NCc1ccc(F)cc1	726529584	SIYZEPGXFGETAL-UHFFFAOYSA-N	442.476	1.794	50	20	IDGD	
NS(=O)(=O)Cc1cccc(C(=O)NNC(=S)Nc2cccc(Br)c2)c1	726631156	OSILWJAYKCIOPQ-UHFFFAOYSA-N	443.348	1.869	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cn(C)nc2C2CCCCC2)c1	726765611	VIBKEEPUWWCHLE-UHFFFAOYSA-N	433.534	1.793	50	20	IDGD	
Cc1ccc(C)c(-n2c(C)nnc2SCC(=O)N([C@@H]2CCS(=O)(=O)C2)N(C)C)c1	728178547	CITWFYGGRQLTIK-MRXNPFEDSA-N	437.591	1.777	50	20	IDGD	
CCOc1ccccc1C(=O)N1CCC[C@@H]1C(=O)NNC(=O)CNc1cccc(OC)c1	728205917	LSEFNUFFGBZLRY-LJQANCHMSA-N	440.500	1.958	50	20	IDGD	
CN1CCN(Cc2ccc(C(=O)NNc3ccc(S(=O)(=O)NC4CC4)cc3)cc2)CC1	728210098	RRRBGZMKCGDZIZ-UHFFFAOYSA-N	443.573	1.632	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)[C@H](c3ccccc3)N(C)C)cc2)CC1	728214631	COUHITBQQNPSHE-FQEVSTJZSA-N	431.562	1.369	50	20	IDGD	
CN(CCCNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)C(=O)OC(C)(C)C	729047685	MLADVWOTODGEBK-UHFFFAOYSA-N	435.529	1.280	50	20	IDGD	
Cc1cc(C)c(S(=O)(=O)N2CCC(C(=O)NNC(=O)Cc3cc[nH]n3)CC2)c(C)c1	730091530	GFENCKUGQJVQMU-UHFFFAOYSA-N	433.534	1.126	50	20	IDGD	
CC(=O)Nc1ccc(NS(C)(=O)=O)c(C(=O)NNC(=O)CCOc2ccccc2)c1	731435495	GANUGJCZQXRMGG-UHFFFAOYSA-N	434.474	1.247	50	20	IDGD	
Cc1c(C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)nnn1-c1cccc2cccnc12	731453573	MMWITDMFAWJTNV-SFHVURJKSA-N	430.424	1.725	50	20	IDGD	
O=Cc1ccc(OCC(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)c([N+](=O)[O-])c1	731626877	IHKCAKZAKQVNGP-UHFFFAOYSA-N	434.430	1.370	50	20	IDGD	
COc1ncnc(OC)c1C(=O)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1	732064981	MDSMZUMVEVFULH-IBGZPJMESA-N	447.495	1.882	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)Nc1ccc(CN2C(=O)CNC2=O)cc1	733333694	RLJBHCIOTDSZHZ-UHFFFAOYSA-N	433.428	1.391	50	20	IDGD	
CCOc1ccc(NC(=S)NNC(=O)[C@@H]2CC(=O)N(C[C@H]3CCCN3CC)C2)cc1	733358368	UBGAUSGCGNNCBN-NVXWUHKLSA-N	433.578	1.736	50	20	IDGD	
CCCn1nc(C(=O)NNS(=O)(=O)c2cccc3cccnc23)c2ccccc2c1=O	734740452	PFTFCQUZLDLJQK-UHFFFAOYSA-N	437.481	1.978	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)c2cccc(N3CCOC3=O)c2)CC1	734824894	LTRMTRDDDYSCNZ-UHFFFAOYSA-N	447.492	1.987	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)Cn2nnc([C@@H]3CN(Cc4ccccc4)CCO3)n2)cc1	735233352	SQGBOAPCGANSFD-IBGZPJMESA-N	435.488	1.016	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)Cc2csc(NC(=O)c3cccc(O)c3)n2)n1	735837888	ZWKXFXSGLMIYKS-UHFFFAOYSA-N	428.474	1.304	50	20	IDGD	
CN(C)C(=O)NNC(=O)c1occc1CS(=O)(=O)c1ccc(Br)cc1	742057857	JCFPAYJMFVFRGU-UHFFFAOYSA-N	430.280	1.932	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)C(=O)NCc2ccc(F)cc2)CC1	742076399	IJWSZIQBKKDWIM-UHFFFAOYSA-N	437.472	1.172	50	20	IDGD	
O=C(C[C@@H]1CN(Cc2ccccc2)CCO1)NNC(=O)C1CCN(c2ncccn2)CC1	743336766	MGYLXTATKCZYHM-HXUWFJFHSA-N	438.532	1.132	50	20	IDGD	
COc1ccc(C[C@H]2CCCN(C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)C2)cc1	743510396	WCXXXQMFMGIREG-QGZVFWFLSA-N	435.488	1.980	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1ccc(-c2ccco2)nc1O	743742603	ZWJRQHAHSJSXME-UHFFFAOYSA-N	429.458	1.724	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc2nc(O)cc(C(=O)NNC(=O)NC3CCCC3)c2c1	744054102	QKKWJVFZHUIKEG-UHFFFAOYSA-N	449.533	1.858	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)CCCc2nc(O)c3ccccc3n2)c1	744612205	VRNJRMCXLXQTCX-UHFFFAOYSA-N	433.424	1.534	50	20	IDGD	
O=Cc1ccc(OCC(=O)OCC(=O)NNC(=O)c2ccccc2)c(Br)c1	745589866	RDODTTTVCYEGLP-UHFFFAOYSA-N	435.230	1.645	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@H]2CCc3c(O)cccc32)cc1	745865134	BQPYKFQSSUTQJN-KRWDZBQOSA-N	432.502	1.339	50	20	IDGD	
NC(=O)COc1cccc(CNC(=O)NNC(=O)c2cc(F)ccc2Br)c1	745899895	QRMYFAMPNYCUBT-UHFFFAOYSA-N	439.241	1.597	50	20	IDGD	
Cc1ccc(C)n1-c1ccc(C(=O)NNC(=O)N[C@H]2C[C@H](C)N(c3cnn(C)c3)C2=O)cc1	745916713	FUVZWWHOEJNYFA-JXFKEZNVSA-N	449.515	1.966	50	20	IDGD	
COc1cc(C)nc(NNC(=O)[C@H]2CC(=O)N(CCc3ccc(OC)c(OC)c3)C2)n1	746632901	LDXGBXZUUMPCLF-HNNXBMFYSA-N	429.477	1.345	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2ccc[nH]2)cc1S(=O)(=O)N1C[C@H](C)C[C@@H](C)C1	747663406	MIJHSXFCFJFVSC-ZIAGYGMSSA-N	434.518	1.765	50	20	IDGD	
COCCOc1ccc(Cl)cc1C(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	748690108	ZGZYXAATRCQPKY-UHFFFAOYSA-N	430.848	1.687	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNS(=O)(=O)c1cc(C(=O)O)cc([N+](=O)[O-])c1	751145733	HCOGAUJMZLUALZ-UHFFFAOYSA-N	447.223	1.017	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c(Br)c1	751294770	SRKOATCUVUWCBI-UHFFFAOYSA-N	431.246	1.779	50	20	IDGD	
CCc1ccccc1-n1cc(O)c(C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)n1	752794597	SFLMLFQFKYZUQX-UHFFFAOYSA-N	428.470	1.619	50	20	IDGD	
COc1ccccc1-c1nnc(SCC(=O)NNC(=O)c2cccc(Cl)c2)n1N	753468268	GPRSNRDRVMSHIM-UHFFFAOYSA-N	432.893	1.874	50	20	IDGD	
CS(=O)(=O)N1CCC[C@@H]1CNC(=O)NNC(=O)c1cc2c(s1)CCCCCC2	753689700	QMANEEBCMXDKTD-CQSZACIVSA-N	428.580	1.775	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)Cc1cc(Cl)cc2c1OCC2	754848264	FWIPKKBIJJTJPQ-UHFFFAOYSA-N	436.921	1.880	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1cccc(NC(=O)NNC(=O)COc2ccccc2C#N)c1	755517063	YTFPYVWMGFRXNW-UHFFFAOYSA-N	445.501	1.867	50	20	IDGD	
CN1CC(=O)N(c2cccc(NC(=O)NNC(=O)c3ccc4c(c3)OCCO4)c2)C1=O	755994560	ZCDKACGUEGKABF-UHFFFAOYSA-N	425.401	1.323	50	20	IDGD	
COc1cc(CN2CC[C@@H](NC(=O)NNc3ccc(-n4cccn4)nn3)C2)cc(OC)c1	756102901	QCKHRIGLDULDEP-MRXNPFEDSA-N	438.492	1.580	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)ccc1F	756376830	MMOAFGXZXOFUJG-UHFFFAOYSA-N	436.465	1.622	50	20	IDGD	
CCCS(=O)(=O)Nc1ccc(NC(=O)NNC(=O)COc2ccccc2C#N)cc1	756571793	KOLWSUFNCXOKQU-UHFFFAOYSA-N	431.474	1.942	50	20	IDGD	
COC(=O)c1ccc(NC(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1C(=O)OC	756816832	BDXNJNVXHXGMRT-UHFFFAOYSA-N	429.385	1.498	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)Nc1ccccc1OCC(=O)N1CCOCC1	756873685	ISBBAGVYWRZOLC-UHFFFAOYSA-N	443.416	1.299	50	20	IDGD	
CN(C)c1nc2cc(NC(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)ccc2o1	757719534	ATXGKMZSUPOKDM-UHFFFAOYSA-N	446.489	1.611	50	20	IDGD	
C#CC[C@H](NC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1)c1ccccc1	757759533	DRRSCBVTYPHTAM-IBGZPJMESA-N	428.514	1.711	50	20	IDGD	
CC(=O)NCc1ccc(C(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)cc1	758781434	CYJMPOSBKMTLAG-UHFFFAOYSA-N	433.509	1.572	50	20	IDGD	
CC(C)CNS(=O)(=O)c1ccc(CNC(=O)NNC(=O)Cc2ccc(F)cc2)cc1	759666978	ZOBHJYLJNAHFRH-UHFFFAOYSA-N	436.509	1.833	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)Cc3cccc(OCC#N)c3)cc2)CC1	760496186	BIIVGZABIHTCIQ-UHFFFAOYSA-N	443.529	1.211	50	20	IDGD	
O=C(NN=C1CCS(=O)CC1)c1cc(S(=O)(=O)NCc2ccccc2)ccc1O	761805030	WCLHGBBQYNXJJA-UHFFFAOYSA-N	435.527	1.499	50	20	IDGD	
CNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2cc(C)n(-c3ccccc3)c2C)c1	763600845	DLUPTZHJPDLWNE-UHFFFAOYSA-N	433.468	1.853	50	20	IDGD	
CCNC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)COc2ccc(OC)cc2)c1	763661245	LOTUAZRXQQGDOO-UHFFFAOYSA-N	429.433	1.002	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cc(C)n(-c3ccc(C)cc3)n2)cc1	763666046	VJGOIJAJHQYQCT-UHFFFAOYSA-N	437.456	1.663	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cc(F)c(N3CCCC3)c(F)c2)cc1	763678144	DQSQVMZWHBHLHU-UHFFFAOYSA-N	443.410	1.602	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccc(OCc3ccccc3)cc2)nn1C	763680480	QAJDVCIJFURXNX-UHFFFAOYSA-N	437.456	1.472	50	20	IDGD	
CN1C(=O)c2ccc(NC(=O)C(=O)NNC(=O)CSc3ccc(Cl)cc3)cc2C1=O	763736886	WRLNNHCPDKGZNQ-UHFFFAOYSA-N	446.872	1.444	50	20	IDGD	
COC(=O)c1[nH]c(C)cc1NC(=O)C(=O)NNC(=O)c1ccc(OCCC(C)C)cc1	763766814	DKQUOERAAOVGCI-UHFFFAOYSA-N	430.461	1.934	50	20	IDGD	
O=C(NNC(=O)c1cc2c(s1)CCC2)C(=O)Nc1ccc(NC(=O)[C@@H]2CCCO2)cc1	763775519	VCPRRPPEMWUEKO-HNNXBMFYSA-N	442.497	1.754	50	20	IDGD	
Cc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1C	763796021	GVFBVNLUHIIQME-UHFFFAOYSA-N	444.513	1.488	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cc(N3CCCC3=O)ccc2F)cc1	763808462	BKAYVOFGWWHNRW-UHFFFAOYSA-N	428.420	1.426	50	20	IDGD	
COC(=O)NCc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)cc1	763847658	DVZOVVDVHXNSQE-HNNXBMFYSA-N	442.472	1.713	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)cc(OC)c1OC	763852449	WDCYIFMRXWYRRL-CQSZACIVSA-N	445.472	1.883	50	20	IDGD	
CCCOC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)cc1	763855922	CJYCCBIPRUUGAA-ZDUSSCGKSA-N	431.420	1.946	50	20	IDGD	
CCOC(=O)C1CCN(C(=O)c2ccc(NC(=O)C(=O)NNC(=O)CC(C)C)cc2)CC1	763889101	WYKSDRKQIFOSKI-UHFFFAOYSA-N	446.504	1.234	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)C(=O)Nc2cccc(-n3cnnn3)c2C)cc1	763897702	CGAUVPRUCRUHKR-UHFFFAOYSA-N	425.474	1.157	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccc(C(=O)NC2CCCC2)cc1	763932857	TUQNTYSGKCNSRA-UHFFFAOYSA-N	426.448	1.827	50	20	IDGD	
O=C(Cc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1ccccc1C(=O)N1CCOCC1	763936899	RLKGNZOVDBQJDP-UHFFFAOYSA-N	444.875	1.141	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CC[C@H](C)C3)ccc1-n1cnnn1	763938175	AZUAVDKHRCPPTK-NSHDSACASA-N	439.501	1.557	50	20	IDGD	
COCCOc1ncccc1NC(=O)C(=O)NNC(=O)c1cc2c(s1)CCCCC2	763962148	MDALBGDFIOBNCK-UHFFFAOYSA-N	432.502	1.837	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1cccc(CCN2CCCC2)c1	764003161	ANUWYNYFURGTGX-UHFFFAOYSA-N	438.484	1.496	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)Nc1ccc(-c2cc[nH]n2)cc1	764005130	VIROJJJENFSQHE-UHFFFAOYSA-N	431.250	1.577	50	20	IDGD	
CC(=O)N1CCc2cc(NC(=O)C(=O)NNC(=O)c3cc(-c4ccc(C)cc4)[nH]n3)ccc21	764112212	YJJCOOOMXWVVMH-UHFFFAOYSA-N	446.467	1.694	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1O)C(=O)Nc1ccccc1S(=O)(=O)C(F)F	764124648	MTLOVLBEXWACRK-UHFFFAOYSA-N	447.803	1.442	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(OCc3ccncc3)cc2)c1O	764131522	PSVFLGSIBLVPOQ-UHFFFAOYSA-N	436.424	1.775	50	20	IDGD	
COc1ccc(Cn2ncc(C)c2NC(=O)C(=O)NNC(=O)c2ccoc2)cc1OC	764168783	WQFJVDSTCIRTPU-UHFFFAOYSA-N	427.417	1.250	50	20	IDGD	
Cc1nc(-c2cccc(NC(=O)C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)c2)no1	764205035	XNGKHEIYXCDDJC-UHFFFAOYSA-N	446.464	1.436	50	20	IDGD	
COC(=O)c1ccc(OC(C)C)c(NC(=O)C(=O)NNC(=O)CCc2ccccc2O)c1	764280837	GOOAMBRJCZTTBY-UHFFFAOYSA-N	443.456	1.685	50	20	IDGD	
CCc1noc(C)c1NC(=O)C(=O)NNC(=O)c1ccc(OC)c(Br)c1	764325991	CUTWXRPWPKKSSN-UHFFFAOYSA-N	425.239	1.716	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)cc1OC	764387360	KROMYUUSBMKENO-UHFFFAOYSA-N	427.392	1.633	50	20	IDGD	
Cc1cc(Cl)ccc1OCCCC(=O)NNC(=O)[C@H](C)S(=O)(=O)C1CCOCC1	764457407	KQIAKPDIBWDJID-AWEZNQCLSA-N	446.953	1.937	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NN=C3[C@H]4CCCO[C@@H]4C3(C)C)CC2)cc1	764816882	DOKXYZKEXDQGQT-NQIIRXRSSA-N	448.589	1.609	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NN=C3COc4ccc(F)cc43)CC2)cc1	764818438	LATIJULBJUJLJL-UHFFFAOYSA-N	446.504	1.353	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)CCc3ccc(S(N)(=O)=O)cc3)n[nH]2)cc1	765576921	VNSVHPFXPJVNAX-UHFFFAOYSA-N	441.513	1.680	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)CCc3nc(C(C)C)no3)n[nH]2)cc1OC	765600662	SJCTZQKHBPCCMB-UHFFFAOYSA-N	428.449	1.994	50	20	IDGD	
COc1ccc(CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1Cl	765632396	DPBZBTMRHCMTSR-UHFFFAOYSA-N	425.898	1.786	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cc(F)cc4nccnc34)CC2)cc1	765748720	FXDXBTKFRZHLCR-UHFFFAOYSA-N	436.491	1.656	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)c1ccc2c(c1)OCO2	765758777	QHGCXQVQZWLWAV-UHFFFAOYSA-N	430.892	1.648	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@@H]3Oc4ccccc4O[C@H]3C)CC2)cc1	766647449	FEXLABPPGKKDKT-FDDCHVKYSA-N	438.528	1.489	50	20	IDGD	
COc1ccc(N2C[C@@H](C(=O)OCC(=O)NNC(=O)Cc3ccccc3C)CC2=O)cc1	767279174	OMSNMYNKFJDVBC-KRWDZBQOSA-N	439.468	1.290	50	20	IDGD	
CCS(=O)(=O)N1CCC[C@H](C(=O)NNC(=O)c2cc(-c3cc(C)ccc3C)[nH]n2)C1	768269586	ORHGPKAEJQDENV-HNNXBMFYSA-N	433.534	1.516	50	20	IDGD	
O=C(Cc1cc(F)c(F)cc1F)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	768291596	SNKXLOOCFWCNGP-UHFFFAOYSA-N	434.418	1.252	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)c3cccc([C@@]4(C)NC(=O)NC4=O)c3)n[nH]2)cc1C	769280126	FMPCXDWMUMDGNJ-HSZRJFAPSA-N	446.467	1.823	50	20	IDGD	
NS(=O)(=O)c1cc(F)cc(NC(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)c1	770026607	GAQFXZWHYBRSBC-UHFFFAOYSA-N	438.409	1.618	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CC(=O)N(c2c(F)cccc2F)C1)c1nnc(O)c2ccccc12	770577701	DVRFTLNFOYDLSC-SNVBAGLBSA-N	427.367	1.428	50	20	IDGD	
C[C@]1(c2ccc(Br)cc2)NC(=O)N(CC(=O)NNC(=O)c2ccccc2)C1=O	771217096	RSSXIAFPMCVGFH-LJQANCHMSA-N	445.273	1.677	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)c1ccc(S(=O)(=O)N(C)C(C)C)cc1	771970306	KRGZFLVFPQLORQ-CQSZACIVSA-N	427.523	1.454	50	20	IDGD	
Cc1nc(-c2ncccn2)sc1C(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772885324	ZLJRTJNZEIFYPN-UHFFFAOYSA-N	430.877	1.639	50	20	IDGD	
COc1ccc(C2(C(=O)NNC(=O)C(=O)NCc3ccc(Cl)cc3)CCOCC2)cc1	772898876	UKECJZRHUCKBSX-UHFFFAOYSA-N	445.903	1.861	50	20	IDGD	
O=C(NNc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cccc(S(=O)(=O)N2CCCCC2)c1	773656119	IWVVOKJNIPUEPM-UHFFFAOYSA-N	447.473	1.851	50	20	IDGD	
COC(=O)c1cc(C)ccc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1cccc(Cl)c1	774001445	GMXAXPKRTXVVHL-LBPRGKRZSA-N	433.848	1.988	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)NC[C@@H]1CC[C@@H](C(=O)N(C)C)O1	775460338	INSZFVXJOZOCKI-JVPBZIDWSA-N	428.489	1.573	50	20	IDGD	
CN(CCCc1[nH]nc(N)c1C#N)C(=O)CCC(=O)C(C#N)=C1N(C)c2ccccc2N1C	775550383	AQZOKEJBVPOCRU-UHFFFAOYSA-N	446.515	1.925	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)NCc2ccc(N3CCCS3(=O)=O)c(F)c2)c1	776246500	RIDNOGPMZPIEQK-UHFFFAOYSA-N	436.465	1.979	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@H](C)C2CCN(C(=O)OC)CC2)c2ccccc2c1=O	777254422	KGPAFEPAIOIRGV-CYBMUJFWSA-N	444.492	1.227	50	20	IDGD	
COCCO[C@@H]1COCC[C@H]1NC(=O)NNC(=O)c1ccc(F)cc1Br	777274228	HVYXYQWISOGIAT-ZIAGYGMSSA-N	434.262	1.353	50	20	IDGD	
CC(C)N1CCN(C(=O)NNC(=O)[C@H](C)Oc2cccc(Br)c2)CC1=O	779969090	CIFHTUVLANYFJT-LBPRGKRZSA-N	427.299	1.510	50	20	IDGD	
N#CC1=CCN(C(=O)c2cc(O)nc3ccc(S(=O)(=O)N4CCOCC4)cc23)CC1	780686947	QNRGFWNENVERPY-UHFFFAOYSA-N	428.470	1.257	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)c(OC)c1	782120935	MWXYDXXIZAYLFU-UHFFFAOYSA-N	435.820	1.300	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2cccc(S(=O)(=O)N3CCCCC3)c2)cc1	783023439	WZRPBQGVMQZWRP-UHFFFAOYSA-N	432.502	1.952	50	20	IDGD	
O=C1Cc2cc(NC(=O)C(=O)NNc3ccc(S(=O)(=O)C(F)(F)F)cc3)ccc2N1	783407374	BBMJGPGVJIWGCZ-UHFFFAOYSA-N	442.375	1.557	50	20	IDGD	
CSCCNC(=S)NNC(=O)c1cnn([C@H]2CCCN(C(=O)OC(C)(C)C)C2)c1	784690005	CQGMAGRQLXWMLN-AWEZNQCLSA-N	442.611	1.927	50	20	IDGD	
Cc1ccc(C(=O)NCC(F)(F)F)cc1NC(=O)C(=O)NNc1ccc(Cl)nn1	784789034	DAOIJWVVISISBU-UHFFFAOYSA-N	430.774	1.812	50	20	IDGD	
CC(C)N(C)S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2cccc([N+](=O)[O-])c2)cc1	784832082	YTTKBYQSWPFZCV-UHFFFAOYSA-N	435.462	1.706	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)C(=O)Nc2ccc(-c3nnnn3C(C)C)c(F)c2)c1	784852254	QXKDQTHSFBMJHO-UHFFFAOYSA-N	441.423	1.929	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1cccc(Cl)c1OC	785331221	QCBHJYKWAQRLRS-UHFFFAOYSA-N	427.866	1.843	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1N1CCNC1=O	786385282	GVEYHJRCJAALQU-UHFFFAOYSA-N	438.492	1.384	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2ccc(C(=O)NNC(=O)N3CCN(C)CC3)cc2)cc1	788165712	GCSBPQMKWPWEIU-UHFFFAOYSA-N	447.517	1.098	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(\C#N)C(=O)NCCCn2c(=O)ccn(C)c2=O)c1C	788219771	GOEBHXMONVMSTQ-QUYZQLMHSA-N	427.505	1.286	50	20	IDGD	
NS(=O)(=O)c1ccccc1NNC(=O)CCNC(=O)c1ccc(Br)cc1	788230764	WNDROXFLUGBHDD-UHFFFAOYSA-N	441.307	1.360	50	20	IDGD	
COc1ccc(S(=O)(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)cc1C	788916603	QZMBDKHLTYGKEE-UHFFFAOYSA-N	442.538	1.801	50	20	IDGD	
O=C(NNC(=O)c1ccn(CC(F)F)n1)c1cccc(S(=O)(=O)N2CCCCC2)c1	789866779	CLTOVVWNLNOCJM-UHFFFAOYSA-N	441.460	1.398	50	20	IDGD	
CNC(=O)c1cc2cc(NC(=O)C(=O)NNC(=O)c3cc(-c4ccccc4)on3)ccc2[nH]1	792355089	OZAZZBKYPJCHCX-UHFFFAOYSA-N	446.423	1.582	50	20	IDGD	
CN(C)N(C(=O)c1cccn2c(I)cnc12)[C@H]1CCS(=O)(=O)C1	792856507	ZSLKWGLFTHRSHX-JTQLQIEISA-N	448.286	1.045	50	20	IDGD	
CCOc1cc(N2CCN(C(=O)NNC(=O)Cc3cccnc3)CC2)ccc1[N+](=O)[O-]	792909074	SECDALCJVFAIJC-UHFFFAOYSA-N	428.449	1.494	50	20	IDGD	
O=C(NNC(=O)c1cc(F)c(F)cc1C(=O)c1ccccc1)N[C@H]1CCS(=O)(=O)C1	793178082	WMIAWYCAYCNLRH-LBPRGKRZSA-N	437.424	1.327	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)NC[C@H]2CCCN(C(C)=O)C2)c1	793312858	PECFGCSTSFGYLX-GFCCVEGCSA-N	427.299	1.660	50	20	IDGD	
CC(C)(O)[C@H](Oc1ccccc1)C(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	795760893	AKZUAQYXHDFCKW-QGZVFWFLSA-N	431.401	1.118	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cc(N3CCOCC3)ccc2C)cc1C	797535359	MWPCENIRAIHBFS-UHFFFAOYSA-N	440.500	1.613	50	20	IDGD	
CCS(=O)(=O)c1ccc(NC(=O)NNC(=O)CNC(=O)OCc2ccccc2)cc1	797611441	QTPKIOHODILNOK-UHFFFAOYSA-N	434.474	1.559	50	20	IDGD	
Cc1cc(O[C@@H]2CCN(C)C2=O)ccc1NC(=O)C(=O)NNC(=O)c1ccccc1F	799257325	ILVBJXAKLYPYAB-QGZVFWFLSA-N	428.420	1.143	50	20	IDGD	
NC(=O)c1cc(Br)cc(S(=O)(=O)NNC(=O)NCCc2cccs2)c1	799527782	SSCPSWFOJHPUQJ-UHFFFAOYSA-N	447.336	1.345	50	20	IDGD	
COCc1csc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)NC(C)(C)C)n1	806968718	NOIOHABEGUKODU-UHFFFAOYSA-N	441.535	1.448	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1c(C)c(C(F)(F)F)nn1C	806973441	BJFPYRDRIFPYSN-UHFFFAOYSA-N	443.382	1.311	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C(=O)Nc1ccc(F)c(S(=O)(=O)NC)c1)c1ccccc1	806979936	KJRKVRDNSZKXHQ-AWEZNQCLSA-N	436.465	1.014	50	20	IDGD	
CN(C)c1nccc(NNC(=O)C(=O)Nc2ccc(-n3ccc(C(F)(F)F)n3)cc2)n1	810398824	PPTQBDMCDFSSNE-UHFFFAOYSA-N	434.382	1.829	50	20	IDGD	
Cn1nnc(Br)c1C(=O)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1	810683835	LYEZRKVJTZXJCR-UHFFFAOYSA-N	428.190	1.628	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2cc(N(C)C)c3ccccc3n2)n1	811324783	TVFJULJCBSNGPQ-UHFFFAOYSA-N	427.486	1.613	50	20	IDGD	
O=C(NNS(=O)(=O)CCCN1C(=O)c2ccccc2C1=O)c1cc2ccccc2o1	811688455	PFIKULYSFXLHBT-UHFFFAOYSA-N	427.438	1.683	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N2C[C@@H](C)S(=O)(=O)[C@H](C)C2)cc1Br	811878767	NVVAPHICCOTREX-NXEZZACHSA-N	434.312	1.320	50	20	IDGD	
COc1ccc(-c2nn(CCC#N)cc2/C=C(\C#N)C(=O)NCc2cnnn2C)cc1OC	813797712	QPMTUUZISYUHPP-CXUHLZMHSA-N	446.471	1.833	50	20	IDGD	
CC(C)Oc1cc(F)ccc1NC(=O)C(=O)NNc1ccccc1S(=O)(=O)N(C)C	815751671	JGPSASAJZDTLSG-UHFFFAOYSA-N	438.481	1.945	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)c1cc(S(=O)(=O)NC)ccc1Cl	913459271	HGLOSOKFKGHYBF-UHFFFAOYSA-N	425.894	1.651	50	20	IDGD	
COc1ccc(C(=O)NN=C2CCN(S(=O)(=O)c3c(C)n[nH]c3C)CC2)cc1OC	914554480	LPBZGWUJTUWBTQ-UHFFFAOYSA-N	435.506	1.614	50	20	IDGD	
CC(=NNC(=O)[C@H](C)CN1C[C@@H](C)O[C@H](C)C1)c1ccc(O)c(CN2CCOCC2)c1	916365902	MOTIGTYSPLDUKU-KZNAEPCWSA-N	432.565	1.810	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)NCc1cccc(N2CCCC2=O)c1	916517750	QIUVCYVHEIHOEY-UHFFFAOYSA-N	427.417	1.631	50	20	IDGD	
Cc1cc(O[C@H](C)C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)ccc1Cl	917314103	YYTNTOCWCGNTIK-ACJLOTCBSA-N	448.859	1.946	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)NC[C@@H](c1ccc(C)cc1)N1CCOCC1	918098559	CJSFAMCIONWWNZ-IBGZPJMESA-N	442.516	1.786	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)c1cccc([N+](=O)[O-])c1	918217648	LKSJFXLGUUTUCU-GFCCVEGCSA-N	435.462	1.550	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)[C@@H]2CCCN(Cc3cccnc3)C2)c2ccccc2c1=O	920255442	WXDLHLQZKOECCN-GOSISDBHSA-N	448.527	1.875	50	20	IDGD	
O=C(CNC(=O)[C@@H]1c2ccccc2C(=O)N1Cc1ccccc1)NNC(=O)c1cccnc1	920273964	GRPQKGUHYVFZFH-NRFANRHFSA-N	443.463	1.356	50	20	IDGD	
CS(=O)(=O)CCNC(=O)/C(C#N)=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	920852059	QRHCBACUMKHZHX-GXDHUFHOSA-N	449.920	1.147	50	20	IDGD	
Cc1cc(S(=O)(=O)NNC(=O)c2cncn2-c2ccccc2)ccc1OCC(=O)O	1115922124	MSOYYKYOYDWPLX-UHFFFAOYSA-N	430.442	1.267	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)NCc1cccc(CN2CCN(C)CC2)c1	1318226654	VZYJYZOXEJKJIN-UHFFFAOYSA-N	425.533	1.516	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)Cn2ncc3ccccc3c2=O)CC1	1318565880	BMVBDBFLMMJXOC-UHFFFAOYSA-N	429.477	1.191	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2cncn2-c2ccccc2)cc2c1CCC2	1318972885	FZVUVBQUTMSXNT-UHFFFAOYSA-N	425.470	1.083	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)c3n[nH]cc3I)n[nH]2)cc1	1320317334	OPXRBIOFIDDMPN-UHFFFAOYSA-N	436.213	1.788	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H]1COc3ccccc3O1)C2)[C@@H](F)Cl	1778023181	XWFKRWLWPDJSHA-WOCWXWTJSA-N	426.872	1.875	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(CCN(C(=O)c3cccn(C(F)F)c3=O)C2)C1	1779357816	UPRZIIYTAZPXFM-QGZVFWFLSA-N	448.264	1.472	50	20	IDGD	
CCCC(=O)N[C@@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCBr)C2	1779514153	LEOKCHFWMWOJMG-QMTMVMCOSA-N	446.386	1.590	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@](C)(Cl)CCl)C2	1779534879	ILDNHBVROMUCHX-TUFGIGEDSA-N	434.364	1.427	50	20	IDGD	
CCn1nc(C(C)C)cc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2	1780219819	DBTHGKBSVQRWLO-DBXWQHBBSA-N	440.972	1.754	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cnc(-c4ccccn4)nc3)CCO2)C1	1781214318	TZEJNZOJXQXZCP-IIBYNOLFSA-N	429.908	2.000	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1CN(Cc3ccccc3)CCO1)CCO2	1781218377	HAUIFWLJXFSXMW-JTAQYXEDSA-N	449.979	1.735	50	20	IDGD	
COc1ccnc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](F)Br)C3)C2)c1OC	1781333158	DPHGAJIMSVJNKT-YOEHRIQHSA-N	446.273	1.233	50	20	IDGD	
O=C(c1ccc(Br)cc1O)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1781522081	AGNUKANYWDOVRA-PBHICJAKSA-N	447.713	1.198	50	20	IDGD	
CCOc1ccc(CC(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)cc1OC	1783699064	BCUBDPGUVFBWTB-IERDGZPVSA-N	440.924	1.066	50	20	IDGD	
Cc1csc(CCC(=O)N2CCO[C@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)c1	1783933513	OAZRXUNXIYHOOK-NRFANRHFSA-N	436.578	1.192	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3CCCCN3C)[C@H]2C1	1784105990	UGJSHMDHKDCDQL-VIQHNZTISA-N	430.387	1.481	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nnc4cc(C)nn4c3C)C[C@@H]21	1784618896	UYXXZDIYQUWYPW-QAETUUGQSA-N	448.955	1.742	50	20	IDGD	
C=CC[C@@H](NC(=O)OC(C)(C)C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21	1784786010	QFTKDSIYWOSKEP-QMHWVQJVSA-N	447.935	1.970	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(CC(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](F)Cl)CCO3)C1	1785480192	IHMFOCHIBBIKQG-HNAYVOBHSA-N	433.908	1.608	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Cl)C[C@@H]21)c1ncn(-c2cccc(F)c2)n1	1785544848	XSRUMWJGUHYGKL-VCOSZWKGSA-N	439.850	1.534	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc(OCF)cn3)[C@H]2C1	1785689238	PYCOWMRRWPADNP-XBPIAWKYSA-N	449.310	1.612	50	20	IDGD	
CCn1nc(C)cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)Br)C[C@@H]21	1787290782	ZTSBPILYHGOUKZ-YXWQFLTLSA-N	427.343	1.588	50	20	IDGD	
C[C@@H](Br)C(=O)NC1(c2ccc(NC(=O)[C@@H](N)CCC(N)=O)cc2)CCC1	1787978166	OCVKUDCGYDTYLM-RISCZKNCSA-N	425.327	1.497	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)c3ccc[n+]([O-])c3)CCC2)cc1)c1cccc(B(O)O)c1	1788145918	GJPZSZBGBFFKHO-UHFFFAOYSA-N	431.257	1.061	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC1(c2ccc(NC(=O)c3cnc(O)nc3O)cc2)CCC1	1788567865	WFWBJLKPVCXLCK-UHFFFAOYSA-N	442.476	1.009	50	20	IDGD	
C[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]21)n1ccccc1=O	1788750079	XODGIYHSJZLRAJ-TYNWYWJLSA-N	444.359	1.625	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]3C2)nc2nccn12	1788763669	OYQABHJCKGTQIO-BQFCYCMXSA-N	445.596	1.483	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(Cl)nn3)[C@H]2C1	1788834031	FZSGNEHJZRHSCG-MNXVOIDGSA-N	445.745	1.754	50	20	IDGD	
C[C@H](C(=O)Nc1ccc(C2(NC(=O)CCC(=O)NN(C)C)CCC2)cc1)N1C[C@@H]2C[C@H]2C1	1789446116	YSLGNZIEDVMAMJ-SQNIBIBYSA-N	441.576	1.834	50	20	IDGD	
CCNC(=O)N[C@@H](C)C(=O)Nc1ccc(C2(NC(=O)CCC(=O)NN(C)C)CCC2)cc1	1789488672	PZKJFAIZGPCQRL-HNNXBMFYSA-N	446.552	1.201	50	20	IDGD	
C=CCNC(=O)/C=C\C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]2C1	1789867744	ITJJLDASKVJXPM-XXUDPWSFSA-N	432.348	1.061	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4c(cnn4C)c3)C[C@@H]21	1791056443	YVWCZBXTHZKMMP-XJOINEQPSA-N	449.349	1.950	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)CBr)C[C@@H]21	1791249122	FIPQKUXTHBCVTK-YHQUGGNUSA-N	425.751	1.251	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3CCN(C(C)C)CC3)C[C@@H]21	1791252437	LZHMPYVNUACGDD-OKYOBFRVSA-N	429.989	1.340	50	20	IDGD	
C[C@@H](Oc1cccnc1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21	1791655299	MTEIMRXABZTXFF-ZLTXHLNPSA-N	444.301	1.519	50	20	IDGD	
Cc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCC(=O)NN(C)C)C3)cc1Cl	1792659765	VRJOLTNNVISIPW-CWPLJXCYSA-N	436.940	1.225	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1(Br)CC1)C2	1792874032	JJFBYBQIZWGZJQ-YFKTTZPYSA-N	438.160	1.535	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cncc(S(C)(=O)=O)c1)C2	1793445954	XUKAMFGEZUKOKR-YALNPMBYSA-N	443.953	1.096	50	20	IDGD	
COCCOCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2	1795784135	NHAULBKNCYTOMC-MUJYYYPQSA-N	449.460	1.435	50	20	IDGD	
CCOc1c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](Cl)CC)C3)cnc2c1cnn2C	1796074302	IPQYVEKDVGSRCK-RMHZUWNSSA-N	449.939	1.588	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)c1cccc(-c2cnco2)c1	1796192876	AVVSDQSICGFZAY-WKCHPHFGSA-N	445.284	1.587	50	20	IDGD	
C[C@H]1CCc2c(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@@](C)(Cl)CCl)C4)n[nH]c21	1796972414	SHPBDTGQHCYHMT-PCMWVUJGSA-N	429.348	1.899	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc3nc[nH]c13)C2	1798440300	KQRWAZGBJBXHLM-BTTYYORXSA-N	433.472	1.127	50	20	IDGD	
Cc1cc(C(=O)NCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](C)Br)C3)no1	1798511058	APOYTZOXCJMVEW-FVCCEPFGSA-N	427.299	1.134	50	20	IDGD	
Cc1cc2nnc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)CO[Si](C)(C)C)c(C)n2n1	1798626192	OXMSUHDOBDEVOL-MUJYYYPQSA-N	430.585	1.844	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1[C@@H](O)CCN1Cc1ccccc1)C2	1799272173	HIYCMVNRGYFTBV-WMDQAZIPSA-N	449.979	1.229	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(F)(F)c1ccco1)C2)[C@@H](F)Br	1799347464	PYMROSWPXGQENR-RBLKWDMZSA-N	425.201	1.652	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2)c1cccc(-n2cncn2)c1	1799774422	CZKVSRHQMYVMHE-JLVBRIDZSA-N	448.321	1.256	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@]1(C)CCCN1	1800005823	UKYPVBKPEVOCJA-JEZSTIGHSA-N	444.488	1.914	50	20	IDGD	
COc1cc(OC)cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)Br)c1	1800760665	ZHASRXFVGBQCTB-MBMVNNNZSA-N	441.322	1.690	50	20	IDGD	
CCOc1ccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Cl)C3)cc1OC	1800859634	OXVRERLKNVGGGD-FTUNRGFVSA-N	428.888	1.760	50	20	IDGD	
Cc1cc2nnc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)[C@@H](C)Br)c(C)n2n1	1801961767	RHWNLGKWLJKEKI-RUZUBIRVSA-N	435.326	1.776	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCc1cnc2[nH]ccc2c1	1802096354	IDHUOLHYMXMESR-REPLKXPHSA-N	440.548	1.507	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2c[nH]c3cnccc23)[C@H]1c1cccnc1)[C@@H](O)CCl	1803142676	GXTGCHQILAGSRN-JVPBZIDWSA-N	427.892	1.877	50	20	IDGD	
CCC(=O)N[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)[C@H](C)Br)[C@@H]1c1cccnc1	1803436564	GEZJTTVJKMHSJU-UICACZKSSA-N	439.354	1.786	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1)c1cc(O)ncn1	1803739413	VWODJMLSOGVPDB-SUMWQHHRSA-N	434.294	1.682	50	20	IDGD	
COc1ccc(C(=O)N2CCCC3(CCN(C(=O)CCC(=O)NN(C)C)CC3)C2)cn1	1806336137	KUUOCGZSWSNOCK-UHFFFAOYSA-N	431.537	1.308	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)c2ccccc2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1	1807376049	SPVJLTAQAWWVRK-IFMALSPDSA-N	429.285	1.395	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)C(F)(F)C(F)(F)C(=O)O)[C@@H]1c1cccnc1)[C@H](F)Cl	1808308388	JYGBMNHZHPXVAL-AXFHLTTASA-N	443.756	1.977	50	20	IDGD	
COc1cc(C(=O)NC[C@@H]2CCN(C(=O)C(Cl)Cl)[C@H]2c2cccnc2)nn1C	1811633345	BYABGCMPGFSXJZ-WFASDCNBSA-N	426.304	1.947	50	20	IDGD	
CCc1cc(C(=O)N2CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)n[nH]1	1813070560	IUBPIFPWPCNSHZ-HRAATJIYSA-N	441.536	1.060	50	20	IDGD	
N[C@@H](Cc1cccnc1)C(=O)N1CC[C@@H](CNC(=O)C(Cl)Cl)[C@H]1c1cccnc1	1813080876	ZSDIBAHIUYXVMG-YESZJQIVSA-N	436.343	1.856	50	20	IDGD	
CCNC(=S)NCC(=O)N1CC[C@@H](CNC(=O)C(Cl)Cl)[C@H]1c1cccnc1	1813081135	JDQHIRXXMRYFAH-GXTWGEPZSA-N	432.377	1.375	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1ccccc1O)CC2)c1cccc(B(O)O)c1	1815355104	MXIAEGSVEHAXEH-AWEZNQCLSA-N	437.286	1.068	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(C(=O)O)ncn2)n[nH]1	1816156298	WQFHZKFBHBLHCA-HZMBPMFUSA-N	436.856	1.458	50	20	IDGD	
O=C(CN1C(=O)CSC1=S)N[C@H]1CCc2nc(NC(=O)[C@@H](F)Cl)sc2C1	1817132777	SCHNZFCUGAVSRN-UPONEAKYSA-N	436.943	1.450	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)CCl)CC2)c1cn2cc(F)ccc2n1	1819102949	VBDCRNWTPQJLJA-MFKMUULPSA-N	437.884	1.755	50	20	IDGD	
Cc1nccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cnccc3C(=O)NN)n[nH]2)n1	1819403182	XBFYIKQOIBKDCD-KRWDZBQOSA-N	449.475	1.126	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)C(=O)Nc2cccnc2)[nH]n1	1822368662	CAYHEGUNLUJEOO-ZFWWWQNUSA-N	434.884	1.689	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)C[C@@H]2CCCCO2)[nH]n1	1822410686	PKWKZMOKCRZOSD-DOTOQJQBSA-N	434.541	1.734	50	20	IDGD	
Cc1ncc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)s1	1822416255	YAKUPTAZBLWEAA-AWEZNQCLSA-N	433.538	1.854	50	20	IDGD	
CCS(=O)(=O)CC(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@H](C)Br)CC1	1824468654	FMHGZULQRRGGRM-ZFWWWQNUSA-N	437.400	1.824	50	20	IDGD	
CCCC(=O)N[C@H](C)C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](Cl)COC)sc2C1	1826000457	SXCFZWYIOAKLSN-WOPDTQHZSA-N	430.958	1.614	50	20	IDGD	
Cc1ccn(C)c1C(=O)N[C@@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1	1826088851	QPXZBXXDABOMML-CYBMUJFWSA-N	432.550	1.389	50	20	IDGD	
C=CCC(F)(F)C(=O)N[C@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1	1826089623	HWSDNCYAXGCWTM-NSHDSACASA-N	429.493	1.640	50	20	IDGD	
O=C(/C=C/c1ccco1)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827056457	VGYUELUPPREWID-CZQLGGELSA-N	436.317	1.906	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1C1CCN(C(=O)C2CN(C)C2)CC1	1827679510	FLTHFZYSPDARIQ-KXWHUPIZSA-N	442.564	1.302	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3n[nH]c4c3CCCC4)C2)C1	1830358439	VJVCYPVLBYGUTI-NRFANRHFSA-N	438.956	1.624	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CC[C@H](N)C(N)=O)CC1	1831550463	WHIZDQQIEVUVCO-JYJNAYRXSA-N	445.402	1.372	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)N3C[C@H]4C[C@H]4C3)C2)C1	1831650881	LPJIOCLLHHBTGA-QKIGPUQLSA-N	427.973	1.191	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H]2CCOC2)CC1	1832376554	KHACKFHMCXMAEO-SPWWYGFFSA-N	443.548	1.777	50	20	IDGD	
O=C(Cc1ccc2c(c1)CCC2)NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1833717372	UYUAGRVVKGAFDV-JOCHJYFZSA-N	448.007	1.889	50	20	IDGD	
CN(C)c1ncc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)o1	1833900843	CWGKZMFJCYUODV-ZWKOTPCHSA-N	449.335	1.047	50	20	IDGD	
Cc1nc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)cs1	1834457202	QDAUPJUYILOXKJ-SWLSCSKDSA-N	436.303	1.212	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cc(-n4ccnc4)ccn3)CC2)CC1)[C@H](F)Cl	1835082363	ZOSJPRKYRFUAID-IBGZPJMESA-N	448.930	1.987	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(C=O)s3)CCO2)C1	1835947708	OSZCMRSAZLDBKS-YVEFUNNKSA-N	445.335	1.414	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)/C=C/c3cccnc3)C2)C1	1837709982	CACDGUAMOMVUGA-BXKJMJEDSA-N	433.581	1.403	50	20	IDGD	
Cc1ccccc1NCC(=O)N1CCOC[C@]2(C1)CN(C(=O)CO[Si](C)(C)C)CCO2	1837711790	QGJLPLPVURZNOS-QFIPXVFZSA-N	449.624	1.715	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)c3ccccc3)C2)C1	1837712611	ZUCSUNWKONQHSK-FPOVZHCZSA-N	436.581	1.028	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)c3nc[nH]n3)CC2)CC1	1838012987	APTZIUBWYWCQAQ-CQSZACIVSA-N	428.331	1.590	50	20	IDGD	
O=C(COC(=O)C(F)(F)F)N1CCC(OC2CCN(C(=O)[C@H](F)Cl)CC2)CC1	1838082333	GFYMEAPRSJKPDK-ZDUSSCGKSA-N	432.798	1.625	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)C3(F)CCC3)CC2)CC1	1838395461	UDPJTLJHLQKVMP-UHFFFAOYSA-N	447.511	1.190	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)c3ncon3)CC2)CC1	1838508176	VFWFKLJOMBNLBQ-AWEZNQCLSA-N	429.315	1.855	50	20	IDGD	
CC(C)n1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)n1	1838788097	KQJFMHOJFLAUJG-RHSMWYFYSA-N	447.305	1.225	50	20	IDGD	
Cc1cccc(C)c1NC(=O)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1839157603	YVBQOSBZMOEORT-OXQOHEQNSA-N	441.887	1.233	50	20	IDGD	
O=C(CCCn1cccc1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839203250	FVLQAUNZTIUDMU-WMZOPIPTSA-N	446.317	1.415	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CCCS3)C2)C1	1839967441	MJJGEGWJXOJKCT-GRDNDAEWSA-N	435.384	1.512	50	20	IDGD	
Cc1ncccc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)Br)CCO2	1840031243	JOUHYNJTBHLLRI-SCLBCKFNSA-N	426.311	1.243	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(O)ccc3F)C2)C1	1840034807	XSTCCSRBMZQQTD-SGTLLEGYSA-N	445.285	1.385	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1840144282	WUTJXLRTLAOHBP-IQUTYRLHSA-N	449.331	1.002	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(Cl)cc3F)C2)C1	1840149516	RNRLISYWEHBPNB-DNVCBOLYSA-N	449.306	1.803	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3Cc4ccccc4C3)C2)C1	1840155859	DZDSSMMILUKRHI-DENIHFKCSA-N	436.936	1.112	50	20	IDGD	
CCCCC[C@H](C)C(=O)N1CCOC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1	1840185437	QEVADOUYIHVDGS-AVRDEDQJSA-N	440.585	1.032	50	20	IDGD	
O=C(c1cccc2nccn12)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840189700	HUDWLFFVPNQDIR-SFHVURJKSA-N	427.288	1.208	50	20	IDGD	
CS(=O)(=O)c1ccc(Cl)c(C(=O)N2CC3(CCCN3C(=O)[C@H](O)CCl)C2)c1	1841354572	HXQMMFWXZNTIJQ-CQSZACIVSA-N	435.329	1.160	50	20	IDGD	
C[C@@H]1OCCN(C(=O)OC(C)(C)C)[C@H]1C(=O)N1CCCC12CN(C(=O)[C@@H](F)Cl)C2	1841691108	YZYJEOJDHLINIC-BFHYXJOUSA-N	433.908	1.749	50	20	IDGD	
CC(C)(C)OC(=O)NCC[C@@H](O)C(=O)N1CC2(CCCN2C(=O)CO[Si](C)(C)C)C1	1844378821	MJQDERXATBLNIV-OAHLLOKOSA-N	443.617	1.317	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCCC12CN(C(=O)c1cccnc1CS(C)(=O)=O)C2	1845169528	PRYGOQBREVYXAL-QGZVFWFLSA-N	448.372	1.680	50	20	IDGD	
CC#C[C@@H](CC(=O)N1CCCC12CN(C(=O)CCC(=O)NN(C)C)C2)c1ccc(O)cc1	1846414758	BNYYGXIQIDFGPJ-IBGZPJMESA-N	440.544	1.466	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H]1C[C@@H](O)CN1C(=O)OC(C)(C)C	1847868187	UXUGASMVTADSNZ-XAJHFOFHSA-N	443.972	1.966	50	20	IDGD	
CC(C)N(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1	15795024	RHBMYYVKQWKITN-GOSISDBHSA-N	433.486	1.317	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)[C@H]2CC(=O)N(c3ccc4c(c3)OCCO4)C2)c1	15886061	QWRHKIHKMCPJIN-INIZCTEOSA-N	439.468	1.654	50	20	IDGD	
CNc1ccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc1[N+](=O)[O-]	15948189	ZRCYBFKNRJECIM-UHFFFAOYSA-N	447.473	1.496	50	20	IDGD	
CCOC(=O)/C(C#N)=C/Nc1cc(S(=O)(=O)N(CC)CC)ccc1N1CCN(C)CC1	18991373	ALSGSHLVBUXKOE-WUKNDPDISA-N	449.577	1.851	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CCN2C(=O)COc3ccccc32)cc(OC)c1OC	26362481	UFYCNABZCJAALC-UHFFFAOYSA-N	429.429	1.289	50	20	IDGD	
CS(=O)(=O)NCCc1ccc(C(=O)NNC(=O)c2cc(-c3ccccc3)on2)cc1	28793475	PKGWTBAWXZQEKE-UHFFFAOYSA-N	428.470	1.508	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cccn2C)cc1S(=O)(=O)N[C@@H]1CCCC[C@@H]1C	726540522	GXDCLDGQUPFRHR-GOEBONIOSA-N	448.545	1.966	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)[C@H]2CCCC[C@H]2C(=O)N2CCCC2)c2ccccc2c1=O	728151218	XMGIUTQGEADNGQ-DOTOQJQBSA-N	425.489	1.123	50	20	IDGD	
COc1ccc2oc(C)c(C(=O)OCC(=O)NNC(=O)[C@H]3COc4ccccc4O3)c2c1	728329433	AEYJWFZYCBJKCL-GOSISDBHSA-N	440.408	1.894	50	20	IDGD	
COC(=O)c1ccccc1S(=O)(=O)NNC(=O)c1cc(F)ccc1Br	728509888	RJNVGMWRLDPEGA-UHFFFAOYSA-N	431.239	1.998	50	20	IDGD	
CCN(C[C@H]1COc2ccccc2O1)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	728960408	YIPNOOMVGLOUEB-KRWDZBQOSA-N	440.504	1.596	50	20	IDGD	
COc1cc(C(=O)NCC(=O)NNC(=O)Cn2ccc3ccccc32)cc(OC)c1OC	729540892	QDDPQYADOQJVKU-UHFFFAOYSA-N	440.456	1.245	50	20	IDGD	
C#CCN1CCC[C@H]1C(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	730104707	WLFCLIFGYPQLLK-INIZCTEOSA-N	432.527	1.408	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)[C@@H]1CCCN(S(=O)(=O)Cc2ccccc2)C1	730514798	LLZSRZVFNIVUBJ-QGZVFWFLSA-N	449.504	1.594	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CC[C@H]2NC(=O)N(c3ccc(Cl)cc3)C2=O)c1	730752922	VMLMCLIZIYIACT-MRXNPFEDSA-N	425.832	1.878	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)[C@@H]1CC(=O)N(c2ccccc2Br)C1	730778505	PIZQYUMGVXKSJG-GFCCVEGCSA-N	448.273	1.734	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)Nc1cc(N2CCCS2(=O)=O)ccc1F	730898816	KGWVVVTUGUOBQO-UHFFFAOYSA-N	438.437	1.303	50	20	IDGD	
C[C@H]1CCC[C@@H](NC(=O)CN2CCN(CC(=O)NNC(=O)c3ccccc3Cl)CC2)C1	731214871	URIDLAYRVKLRBM-DLBZAZTESA-N	449.983	1.414	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)c1sccc1S(=O)(=O)N1CCc2ccccc2C1	731879579	OHUBBWSSKJOTJQ-UHFFFAOYSA-N	445.526	1.601	50	20	IDGD	
N#Cc1ccc(N2C(=O)N[C@H](CCC(=O)NNC(=O)COc3ccc(F)cc3)C2=O)cc1	733774098	HGZKTRBKQBVYIX-QGZVFWFLSA-N	439.403	1.129	50	20	IDGD	
C[C@@H](CC(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1)c1ccccc1F	735118337	SJAOTDSHNSZMEY-HNNXBMFYSA-N	435.525	1.794	50	20	IDGD	
CN(CC1CC1)S(=O)(=O)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1	737757292	OVMZDCHECKJOIV-NRFANRHFSA-N	428.558	1.821	50	20	IDGD	
CCOC(=O)[C@@H](C)NC(=O)c1ccc(NC(=O)NNC(=O)COc2ccccc2O)cc1	743221561	ROXUFDXFJYMARM-CYBMUJFWSA-N	444.444	1.305	50	20	IDGD	
O=C(CCN1C(=O)[C@H]2CCCC[C@@H]2C1=O)NNC(=O)c1cc(Br)ccc1O	743732041	IPNIHJKAXYMMOJ-RYUDHWBXSA-N	438.278	1.481	50	20	IDGD	
O=C(/C=C\c1ccc2c(c1)OCO2)NNc1ccccc1S(=O)(=O)N1CCOCC1	744620560	KQJCKRQAUHUIIO-VURMDHGXSA-N	431.470	1.593	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)[C@H](O)c2ccc(Br)cc2)cc1	745043579	DDZKHJSKUAAIJP-MRXNPFEDSA-N	432.230	1.359	50	20	IDGD	
Cc1ccc(CN2C(=O)CC[C@@H]2C(=O)OCC(=O)NNC(=O)Cc2nc(C)cs2)cc1	745592190	JMTCBEDVHYBWTL-MRXNPFEDSA-N	444.513	1.184	50	20	IDGD	
CC(=O)N1CCN(S(=O)(=O)c2cccc(C(=O)NNc3cccc([N+](=O)[O-])c3)c2)CC1	748006246	KYOYGLFXTNHGCK-UHFFFAOYSA-N	447.473	1.205	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)[C@H]2CCCN(C(=O)c3ccc4n[nH]cc4c3)C2)cc1	751294666	QWDVEVWUYYQLOG-KRWDZBQOSA-N	435.484	1.950	50	20	IDGD	
CCNC(=O)C1(CNC(=O)NNC(=O)[C@H](C)Oc2cccc(Br)c2)CCC1	753030782	VNUFGTDUWBBTBA-LBPRGKRZSA-N	441.326	1.853	50	20	IDGD	
O=C(NNC(=O)c1ccc2nn[nH]c2n1)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	753985659	JUDINYALNDAGOT-UHFFFAOYSA-N	440.427	1.130	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNS(=O)(=O)c1cc(Br)cc(C#N)c1	754256859	IYKBMNIOIVCWNZ-UHFFFAOYSA-N	434.275	1.900	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1O)c1ccc(S(=O)(=O)N2CCCC2)cc1	754627490	CNWJLEPLVPMCEU-UHFFFAOYSA-N	434.430	1.160	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)Nc2cc(C)nn2[C@H]2CCS(=O)(=O)C2)cc1	755532814	MFBKCHYBWUWXDG-AWEZNQCLSA-N	437.547	1.805	50	20	IDGD	
CN1CC(=O)N(c2cccc(NC(=O)NNC(=O)c3cc(-c4ccccc4)[nH]n3)c2)C1=O	755993846	VWYGPVPCTQAKHB-UHFFFAOYSA-N	433.428	1.942	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ncc(Cc3ccccc3)s2)cc1	756163514	IPOIVBHNORJBFM-UHFFFAOYSA-N	435.465	1.770	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)COc2ccc(C#N)cc2)c(OCC(=O)N(C)C)c1	756203234	QCKNYRKMUANUTL-UHFFFAOYSA-N	425.445	1.565	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2ccc(OCCC(N)=O)cc2)c2ccccc2c1=O	756504497	UTVQKFVHZLHIBS-UHFFFAOYSA-N	438.444	1.137	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)Nc1cccc(S(=O)(=O)NC2CC2)c1C	756704440	HWWNGCIFHNTDPL-UHFFFAOYSA-N	432.502	1.840	50	20	IDGD	
CCO[C@@H]1COCC[C@@H]1NC(=O)NNC(=O)[C@@H](C)Oc1cccc(Br)c1	759217826	XKMDUCUBJUNQES-BYCMXARLSA-N	430.299	1.741	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)[C@](C)(O)CN2C(=O)C(C)(C)c3ccccc32)c1	760054081	SCNKLWPCLXSIBK-XMMPIXPASA-N	439.512	1.905	50	20	IDGD	
COC(=O)C12CCC(C(=O)NNC(=O)c3cc(-c4ccc(OC)c(OC)c4)[nH]n3)(CC1)C2	760485192	LOSTXICLTYYCAG-UHFFFAOYSA-N	442.472	1.978	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cccc([C@@H]3CCOC3)c2)cc1OC	761533393	BSLBSQAKMLHGBY-QGZVFWFLSA-N	428.441	1.826	50	20	IDGD	
Cc1cc(C(=O)O)cc(S(=O)(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)c1C	763439880	XALBEUWZGAOKCV-UHFFFAOYSA-N	429.495	1.616	50	20	IDGD	
Cc1cc(C(=O)N2CCCC2)ccc1NC(=O)C(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	763442097	LFWIXQXPFCDRBW-UHFFFAOYSA-N	439.428	1.539	50	20	IDGD	
CCc1cc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccncc3)nc3ccccc23)n(C)n1	763537426	CZNJFXKCBWEADE-UHFFFAOYSA-N	443.467	1.992	50	20	IDGD	
CO[C@H](CNC(=O)NNC(=O)c1csc(N2CCOCC2)n1)c1ccccc1Cl	763540185	YKZWVTHXPKRSHV-OAHLLOKOSA-N	439.925	1.965	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccccc2O[C@@H]2CCOC2)cc1OC	763550399	LSSYRVFGHRFFOR-CQSZACIVSA-N	429.429	1.271	50	20	IDGD	
Cc1nc(-c2cccc(NC(=O)C(=O)NNC(=O)[C@@H]3COc4ccccc4O3)c2)oc1C	763574467	ZSJLZHWLKUHLOD-SFHVURJKSA-N	436.424	1.884	50	20	IDGD	
COC(=O)[C@H](C)Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)cc1	763613279	LNAQMGLWKHITFJ-CQSZACIVSA-N	449.467	1.828	50	20	IDGD	
COC(=O)c1ccc(F)c(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)c1	763737023	WKEOVKYLCQJDNY-UHFFFAOYSA-N	428.420	1.151	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2ccnn2-c2cccc(Cl)c2)c1	763771475	AWNYFMPVGKQSRL-UHFFFAOYSA-N	443.847	1.943	50	20	IDGD	
CCS(=O)(=O)c1cc(F)ccc1NC(=O)C(=O)NNC(=O)c1cc2c(s1)CCC2	763784794	IDCLVUAPPUORCR-UHFFFAOYSA-N	439.490	1.569	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)cc1OCC(F)F	763837439	FYQFHPDFBJLWMF-UHFFFAOYSA-N	425.363	1.943	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cnn(-c3ncccc3C#N)c2)c1C	763852029	UDWXJFULTGLUNJ-OAHLLOKOSA-N	447.455	1.309	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(N)=O)c(Cl)c2)cc1OC	763912059	MLRUUBQZEVRTDR-UHFFFAOYSA-N	434.836	1.246	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(-n3cccn3)nc2)ccc1OC(C)C	763916289	LUHRQUUEGPIAOD-UHFFFAOYSA-N	438.444	1.463	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3cccc([C@@H]4CNC(=O)C4)c3)cc2C1	763944219	XXPSEQICTMSBHZ-DOMZBBRYSA-N	440.525	1.876	50	20	IDGD	
CCOC(=O)Cn1ccc2cc(NC(=O)C(=O)NNC(=O)Cc3ccsc3)ccc21	764034626	IGAVNJMMLBLHIH-UHFFFAOYSA-N	428.470	1.595	50	20	IDGD	
COc1ccc(N2C[C@H](C(=O)NNC(=O)CSc3ccccc3O)CC2=O)c(OC)c1	764043042	NXDHUEZQNMCXJU-CYBMUJFWSA-N	445.497	1.702	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)C1=NN(Cc2ccc(F)cc2)C(=O)CC1	764048268	XAGVUCIHAJJMSA-UHFFFAOYSA-N	430.461	1.949	50	20	IDGD	
O=C(COC(=O)c1cccc(OC(F)(F)F)c1)NNC(=O)[C@H]1COc2ccccc2O1	764064606	QVWJFCHNLFSFFX-OAHLLOKOSA-N	440.330	1.729	50	20	IDGD	
CC(C)(C)c1cc(NC(=O)C(=O)NNC(=O)c2cccc(C#N)c2)n(-c2ccccn2)n1	764235791	RSAWVRZJIASVCQ-UHFFFAOYSA-N	431.456	1.836	50	20	IDGD	
CC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(C#N)c2)c(C(F)(F)F)c1	764238192	QIVQMRSXBKNTLI-UHFFFAOYSA-N	433.346	1.935	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)C(=O)Nc1ccn(-c2ncccc2C(F)(F)F)n1	764267856	BDZXRFJWDFMBEA-UHFFFAOYSA-N	433.350	1.010	50	20	IDGD	
CC(C)OC(=O)c1c(NC(=O)C(=O)NNC(=O)Cc2cccnc2)sc2c1CCCC2	764268958	YZEKKCCJANNWHT-UHFFFAOYSA-N	444.513	1.916	50	20	IDGD	
O=C(NC1CC1)c1cc(F)c(NNC(=O)[C@@H]2CC(=O)N(Cc3ccccn3)C2)c(F)c1	764329338	JKGLDBSPBZGKSU-CYBMUJFWSA-N	429.427	1.744	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2ncccc2C)cc1OCc1ccncc1	764386399	HVUSPSRJDPNYFM-UHFFFAOYSA-N	435.440	1.772	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1)C(=O)Nc1ccc(-n2ccnn2)cc1	764387985	PDFTUVCTOBWVAI-UHFFFAOYSA-N	434.391	1.196	50	20	IDGD	
O=C(CCC(=O)N1CCN(c2ccccn2)CC1)NNC(=O)Cc1ccc(Cl)cc1	764568924	NCEBBRLWIPDVQT-UHFFFAOYSA-N	429.908	1.554	50	20	IDGD	
COc1cccc([C@@H](O)C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)c1	765175481	IYSPLNKWVWGPIU-OAQYLSRUSA-N	446.935	1.347	50	20	IDGD	
CCS[C@H](C)c1noc(CN(C)C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)n1	765634778	OPZOPTOYNCRCRE-LLVKDONJSA-N	431.482	1.346	50	20	IDGD	
O=C(CCOc1cccc(F)c1)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765734051	VVMISPNEVBAAEH-UHFFFAOYSA-N	428.464	1.200	50	20	IDGD	
Cc1cccc(OCCC(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)c1C	765738747	NTPPVNZOHGZGOG-UHFFFAOYSA-N	438.528	1.678	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)NC1CC(OCc2ccccc2)C1	766084429	HLWVDSFRZDXWHE-UHFFFAOYSA-N	431.518	1.672	50	20	IDGD	
CCc1ccc(C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1S(C)(=O)=O	766159284	UMIAPTJJTMZAFT-UHFFFAOYSA-N	449.441	1.179	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)N[C@@H]2CCC[C@H]2C(=O)NC)c2ccccc2c1=O	766277516	ULMUXFMOSZBUNR-IAGOWNOFSA-N	442.520	1.445	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@H](C)n3cnc4ccccc43)CC2)cc1	766647190	ASSIEOPJYHWTII-IBGZPJMESA-N	434.544	1.871	50	20	IDGD	
CN(C)C(=O)c1cc(F)ccc1NC(=O)C(=O)NNC(=O)c1cccc(C(F)(F)F)c1	768238539	CBEVABJSCLQTJR-UHFFFAOYSA-N	440.353	1.946	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc2c(c1)OCCCO2)NNc1ncnc2ccsc12	768290170	DFGBDONEMFXIMC-UHFFFAOYSA-N	435.487	1.274	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)Sc1nnc(-c2cc(-c3ccccc3)[nH]n2)n1N	768437881	KVVMAICDKLULDD-LBPRGKRZSA-N	428.522	1.723	50	20	IDGD	
CCc1cc(NNC(=O)c2cccc([C@]3(C)NC(=O)NC3=O)c2)nc(-c2ccccn2)n1	769083889	RHGATZXVOCLHRU-QFIPXVFZSA-N	431.456	1.913	50	20	IDGD	
C[C@@H](NC(=O)NNc1nc(O)c2cnn(C)c2n1)c1ccc(OCC(=O)NC2CC2)cc1	770340018	HBWBYGRJZLNRBF-LLVKDONJSA-N	440.464	1.114	50	20	IDGD	
CC(=O)c1cccc(OCc2cc(C(=O)NNC(=O)CNC(=O)c3ccco3)no2)c1	770720263	VKMZDBDTJHPUNA-UHFFFAOYSA-N	426.385	1.240	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccnn1-c1cccc(F)c1	770774512	OVBJFTOARYZYQB-GFCCVEGCSA-N	429.383	1.704	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1cccs1)C(=O)NNc1nc(O)c2cnn(C(C)(C)C)c2n1	770966073	JYTCCLQHQRAYTP-SECBINFHSA-N	439.523	1.159	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1ccc(OC)c(S(=O)(=O)NC2CCCC2)c1	771867524	LDGUNZVSCFNTSX-GFCCVEGCSA-N	441.506	1.019	50	20	IDGD	
CC(C)(C(=O)NNC(=O)N1CCC(Oc2ccnc(C(N)=O)c2)CC1)c1ccccc1	771979544	WNUWVENREMNEGO-UHFFFAOYSA-N	425.489	1.742	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)[C@@H]1CCCN(C(=O)c2ccncc2)C1	772194611	AVOQPCHYUCRTFQ-MRXNPFEDSA-N	443.891	1.051	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)c3cc(I)c(F)cc3F)nc21	772454636	POGINDLAVMMCIN-UHFFFAOYSA-N	446.155	1.709	50	20	IDGD	
CC(C)[C@H](C(=O)NNC(=O)c1cc(F)ccc1Br)N1CCCS1(=O)=O	772688555	QVRDSWRARSAWHB-CYBMUJFWSA-N	436.303	1.409	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NN=C1CCO[C@H](C)C1)N(S(C)(=O)=O)CC2	773189535	HWIJPVGSXBGVSJ-DYVFJYSZSA-N	439.534	1.624	50	20	IDGD	
O=C(NNc1cnc2ccccc2n1)C(=O)Nc1cccc(N2CCCS2(=O)=O)c1	773722919	PXZLVDXXOLKFPR-UHFFFAOYSA-N	426.458	1.252	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(N3CCNC(=O)C3)c(Cl)c2)cc1F	773885890	STWKUNGYNVUBNK-UHFFFAOYSA-N	447.854	1.123	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1cnn(-c2ccccn2)c1	774009975	SOIXVFBFOOZOMO-GFCCVEGCSA-N	428.836	1.474	50	20	IDGD	
CCCn1nc(C(=O)NN=C2C(=O)Nc3c(F)cc([N+](=O)[O-])cc32)c2ccccc2c1=O	774333592	IBXNIICCWQGVGD-UHFFFAOYSA-N	438.375	1.940	50	20	IDGD	
O=C(CN1CCC(O)(Cc2ccc(F)cc2)CC1)NNC(=O)c1ccc([N+](=O)[O-])cc1	775754943	VGNOYQNQYMUXON-UHFFFAOYSA-N	430.436	1.565	50	20	IDGD	
COC1(CNC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)CCCCC1	776184822	NNHSXBXCMGGCFO-UHFFFAOYSA-N	426.539	1.295	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NC[C@H]2COC3(CCCCCC3)O2)cc1	776954551	LPVQJECKBQOUKP-HNNXBMFYSA-N	440.522	1.892	50	20	IDGD	
COc1nc(C)c(Br)cc1C(=O)NNC(=O)CCN1C[C@H](C)O[C@@H](C)C1	777088435	DKCFZVXKMQGARH-QWRGUYRKSA-N	429.315	1.421	50	20	IDGD	
COC(=O)c1ccccc1NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1	777827537	CPDSPQBHLUJMOJ-UHFFFAOYSA-N	446.529	1.231	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)CCNS(=O)(=O)c2ccc(F)c(F)c2)nc1C	778423394	AYNLZHYVZPOUGX-UHFFFAOYSA-N	443.432	1.052	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNS(=O)(=O)c1ccc(C#N)cc1Cl	779829207	GDJPUNSKWIICRQ-UHFFFAOYSA-N	441.922	1.437	50	20	IDGD	
N#Cc1ccc(N2CCC[C@H](NC(=O)NNC(=O)Cc3cn4ccccc4n3)C2=O)cc1	780894797	SHAGSZFNGBZOLD-SFHVURJKSA-N	431.456	1.274	50	20	IDGD	
CC[C@H](C)NS(=O)(=O)Cc1cccc(NC(=O)C(=O)NNc2cncc(Cl)n2)c1	783259692	HSZMWXMNLVBZIR-NSHDSACASA-N	440.913	1.430	50	20	IDGD	
CC(C)Oc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)C(=O)NN(C)c1ccccc1	783432378	WKFLRKCMNBYNCZ-UHFFFAOYSA-N	434.518	1.830	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)Nc1cc(F)ccc1OC(F)F	785022767	JTTGHYHOHIGOFC-UHFFFAOYSA-N	428.279	1.441	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)C(=O)Nc1ccc(Oc2cccnc2)nc1	785067804	OTTPSZNRXOUWHO-UHFFFAOYSA-N	431.412	1.245	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(F)c(NC(=O)C(=O)NNc2ccc(Cl)c(F)c2)c1	785179247	ZKAKRILWJWKJTA-UHFFFAOYSA-N	432.836	1.950	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2ccc(C)c(N3CCNC3=O)c2)c2ccccc2c1=O	786386060	KNAZVCJPWVHFBH-UHFFFAOYSA-N	449.471	1.721	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)[C@@H]3CCC(=O)c4ccccc43)cc2)CC1	786426351	HLJQBCLEKLIAQV-HXUWFJFHSA-N	442.541	1.826	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(O[C@H]3CCOC3)cc2)cc1OC	789206460	RYHMENOGBAWSBK-KRWDZBQOSA-N	444.440	1.490	50	20	IDGD	
O=C(NNC(=O)[C@H]1OCC[C@H]1c1ccccc1)C(=O)Nc1cccnc1N1CCCCC1	789809592	AXBKGXOXAYZWNT-HKUYNNGSSA-N	437.500	1.731	50	20	IDGD	
COC(=O)c1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)[C@H]1OCC[C@H]1c1ccccc1	789813427	SSSGSXLZUJDPJO-YOEHRIQHSA-N	445.859	1.785	50	20	IDGD	
Cn1cc(NC(=O)C(=O)NNc2cccc(F)c2[N+](=O)[O-])cc(Br)c1=O	790996901	INFWKGAMPKBFTR-UHFFFAOYSA-N	428.174	1.277	50	20	IDGD	
O=C(NNc1cccc(F)c1[N+](=O)[O-])C(=O)Nc1ccc2nc3n(c(=O)c2c1)CCC3	791000968	UCJYTEGBIXJKHV-UHFFFAOYSA-N	426.364	1.472	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@H](C)n2ccc3ccccc3c2=O)c2ccccc2c1=O	791195716	TUWYSWCNSLHNDS-AWEZNQCLSA-N	431.452	1.754	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NC[C@@H](C)NC(=O)OC(C)(C)C)cc(OC)c1OC	792257969	MQZXBDOZLYILRF-LLVKDONJSA-N	426.470	1.570	50	20	IDGD	
CCc1c(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)cnn1C(CC)CC	792269687	UKSKNYSONVKUDK-UHFFFAOYSA-N	429.477	1.978	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)NC[C@@H](Cc2cccc(F)c2)C(=O)N2CCOCC2)n1	793088753	PPSHEOJXVADVBQ-QGZVFWFLSA-N	443.479	1.191	50	20	IDGD	
COC(=O)C1(CS(=O)(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)CCCCC1	793350399	MLVZVTBWIAALJR-UHFFFAOYSA-N	444.506	1.400	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)c1cccc(NN2C(=O)[C@H]3CC=CC[C@H]3C2=O)c1	793539272	LTOFFUNWTFTEAB-BGYRXZFFSA-N	448.479	1.943	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2C[C@H](c3ccccc3)[C@H]3COCC[C@H]32)cc1OC	796357076	BHHDKIXHRKMHBM-VAMGGRTRSA-N	439.512	1.969	50	20	IDGD	
CCNC(=O)N(C)c1cccc(NC(=O)C(=O)NN=c2sc3ccccc3n2C)c1	797045317	JNUXCRDJJXNNOP-UHFFFAOYSA-N	426.502	1.976	50	20	IDGD	
Cc1ccc(N2CCOCC2)cc1NC(=O)C(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	797536514	YEFDOQSYWVOJSD-UHFFFAOYSA-N	427.417	1.140	50	20	IDGD	
NS(=O)(=O)Cc1cccc(CNC(=O)NNC(=O)NCc2ccc(Cl)cc2)c1	800717249	IINWCRZLKSSRCL-UHFFFAOYSA-N	425.898	1.342	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)[C@H]2CCCN2C(=O)c2ccc3c(c2)OCO3)cc1	802053355	PEPPYTZNLVNKKY-MRXNPFEDSA-N	426.429	1.881	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCC(=O)NNC(=O)Nc1ccc2c(c1)OCO2	802107295	PMIRJJDCHYNSAU-CYBMUJFWSA-N	449.464	1.084	50	20	IDGD	
O=C(NC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1)NNC(=O)c1cccc([N+](=O)[O-])c1	802332408	LXDGXQJGCITPLV-INIZCTEOSA-N	425.401	1.667	50	20	IDGD	
CCCN(NC(=O)CCC(=O)Nc1ccc2c(n1)n(C)c(=O)n2C)C(=O)OC(C)(C)C	804592493	NXBNFNPVBPRPBR-UHFFFAOYSA-N	434.497	1.669	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)[C@H]2CCN(c3ccc(C#N)cc3F)C2)cc1	805589610	KZDGRDRHTGSCJU-KRWDZBQOSA-N	435.415	1.400	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)NCC2(N3CCOCC3)CCCCC2)nc2ccccc21	806998504	YNARJKFMKMZOOB-UHFFFAOYSA-N	428.537	1.481	50	20	IDGD	
CN(NC(=O)c1c[nH]nc1-c1ccccn1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	811032417	MMBSZKONQHGDEK-UHFFFAOYSA-N	429.481	1.721	50	20	IDGD	
CCn1nnnc1-c1cccc(NC(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)c1	812946464	WAUNUGZIRVDJGN-UHFFFAOYSA-N	430.494	1.759	50	20	IDGD	
COc1cccc2c(C(=O)NNC(=O)NC3CCN(C(=O)OC(C)(C)C)CC3)n[nH]c12	813456022	LABGEKOHEDGBNO-UHFFFAOYSA-N	432.481	1.915	50	20	IDGD	
O=C(CNC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)Nc1cc(Cl)ccc1Cl	813495451	BAKZWMXARAYMJV-UHFFFAOYSA-N	449.258	1.552	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2ccnc(NC(=O)C(C)C)c2)c2ccccc2c1=O	814731807	KJPUYMNCWBSCKW-UHFFFAOYSA-N	436.472	1.871	50	20	IDGD	
CC(=NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1)c1cccc(-n2cnnc2)c1	814879126	RICYJJXIIQCCDC-UHFFFAOYSA-N	431.500	1.566	50	20	IDGD	
CC(=NNC(=O)[C@H]1CCCN(C(=O)OC(C)(C)C)C1)c1ccc2[nH]c(=O)c(=O)[nH]c2c1	814972245	AAZGERBDSRQKLH-AWEZNQCLSA-N	429.477	1.704	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cc(F)cc(F)c2F)cc(OC)c1OC	815563899	RAMASWDQSSEGKU-UHFFFAOYSA-N	427.335	1.529	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)cc(OC)c1C	815567856	OADYVLHYLSKLRK-UHFFFAOYSA-N	425.239	1.503	50	20	IDGD	
CN(c1ccccc1NC(=O)C(=O)NNC(=O)[C@H]1CCc2nncn2C1)C1CCCC1	815692553	ULJNQYQBVNGZBA-AWEZNQCLSA-N	425.493	1.005	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNc2cccc(Cl)n2)nnn1CCOc1ccc(F)cc1	815726549	JKLWXZZVPQZSQB-UHFFFAOYSA-N	433.831	1.935	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)[C@@H]1[C@H]2CN(C(=O)OC(C)(C)C)C[C@H]21	816134478	DOLGAGOYEXAPPW-JYAVWHMHSA-N	425.507	1.655	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H]2CCN(Cc3ccccc3)C2)c1	816810396	KRDBGDGYECYZTM-SFHVURJKSA-N	430.530	1.220	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNS(=O)(=O)c1cccc(S(N)(=O)=O)c1	817974834	GBODHCSZZWFKQI-ZDUSSCGKSA-N	449.510	1.264	50	20	IDGD	
COc1cccc(/C=C(/C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)n2nnnc2C)c1	818029920	RAQBBODCIUYGKP-FDIDITGRSA-N	440.435	1.742	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(C)c(C(=O)NNC(=O)CNc2ccccc2OC)c1	825615188	LYTCMSCVXWWUGV-UHFFFAOYSA-N	448.545	1.907	50	20	IDGD	
O=C(NN=Cc1ccc(-n2cncn2)c(F)c1)c1ccc(S(=O)(=O)N2CCCC2)cc1	863966997	XPCAYUJHEOMYLI-UHFFFAOYSA-N	442.476	1.955	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NN=Cc1c(N2CCOCC2)nc2ccccn2c1=O	874080467	VJLQWESUSCVRRC-HNNXBMFYSA-N	439.447	1.588	50	20	IDGD	
Cc1cc(Cl)ccc1OCCCC(=O)NNC(=O)[C@@H]1CCCCN1S(C)(=O)=O	886895508	YHZXBMLDWPEGBW-HNNXBMFYSA-N	431.942	1.769	50	20	IDGD	
Cn1nc(SCC(=O)NN=Cc2ccc(-c3ccccc3F)s2)c(=O)n(C)c1=O	912808656	KGZDPBNGGRVJCJ-UHFFFAOYSA-N	433.490	1.589	50	20	IDGD	
CC(C)NC(=O)C(=O)NNC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S	914442757	KJBYDNWLYADQLI-XFXZXTDPSA-N	440.572	1.402	50	20	IDGD	
COc1ccnc(NNC(=O)c2ccc(OC)c(S(=O)(=O)N3C[C@@H](C)C[C@@H](C)C3)c2)n1	914763133	QISCISFLNQPQMB-OKILXGFUSA-N	449.533	1.917	50	20	IDGD	
CC(C)(C)[C@H]1CCc2sc(C(=O)NNC(=O)CN3CCS(=O)(=O)CC3)cc2C1	916144057	VVHQOVTYJUNBRI-AWEZNQCLSA-N	427.592	1.391	50	20	IDGD	
O=C(NCCCOCC1CC1)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	916200531	FCSWHZAGEMWWEE-UHFFFAOYSA-N	438.550	1.622	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)NC1CCN(CCN(C)C)CC1	916383015	XFOXFYSWUFVNET-KRWDZBQOSA-N	427.549	1.964	50	20	IDGD	
COCCOc1ccc(CNC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cn1	916513262	UOMLCDJPKUXUEP-UHFFFAOYSA-N	426.433	1.142	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCc2cccc(N3CCCC3=O)c2)nc1	916516038	JMIKEXWHOAUTKT-UHFFFAOYSA-N	446.533	1.721	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@@H]2Cc3ccccc3O2)c1	916516137	JXPLSEXBIMGHHD-KRWDZBQOSA-N	446.529	1.665	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)CN3C(=O)N[C@]4(CCCC[C@H]4C)C3=O)n[nH]2)cc1	917175684	HSKQOCRMFOKHQZ-PEBXRYMYSA-N	438.488	1.647	50	20	IDGD	
O=C(NC[C@H]1CCCOC1)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	918124477	SBYMPWRDNOQCMF-QGZVFWFLSA-N	446.529	1.536	50	20	IDGD	
O=C(NNC(=O)C1CCN(S(=O)(=O)c2ccccc2)CC1)c1ccc(Cl)cc1O	918358404	YNBHXDRNLZQTDL-UHFFFAOYSA-N	437.905	1.908	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C2CCN(c3ccc(C)cn3)CC2)c2ccccc2c1=O	919805658	FEZIBRIHWLWZKP-UHFFFAOYSA-N	434.500	1.797	50	20	IDGD	
CS(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)c(F)c1	919954364	JTGPHPWJHXZSPL-UHFFFAOYSA-N	445.538	1.723	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NCC2CCN(Cc3ccccc3)CC2)c2ccccc2c1=O	920280593	BWVRBCDVVGRFJW-UHFFFAOYSA-N	448.527	1.790	50	20	IDGD	
C=CCn1c2ccccc2n2nc(C)c(C(C)=NNC(=O)N[C@@H]3CCS(=O)(=O)C3)c12	920385172	WCMBRRKSUQFNHI-OAHLLOKOSA-N	428.518	1.994	50	20	IDGD	
COc1ccc(CCCNC(=O)NNC(=O)c2nnc(O)c3ccccc23)cc1OC	920920911	QRGPZAUANZUNAQ-UHFFFAOYSA-N	425.445	1.929	50	20	IDGD	
CCOC(=O)C1CCC(NC(=O)NNc2ccc(S(=O)(=O)N(CC)CC)cn2)CC1	921118093	JFOYIFJFLMIEFG-UHFFFAOYSA-N	441.554	1.860	50	20	IDGD	
N#Cc1ccc(N2C[C@H](C(=O)OCC(=O)NNC(=O)c3ccc(Cl)cc3)CC2=O)cc1	1318050726	RFZGHYWBAFOSFZ-OAHLLOKOSA-N	440.843	1.569	50	20	IDGD	
CCN(c1ccccc1)S(=O)(=O)c1ccc(OC)c(NC(=O)NNC(=O)CCO)c1	1320400778	LXYGUBKSHCGHEN-UHFFFAOYSA-N	436.490	1.446	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2ccc(NC(=O)c3ccc(O)nc3)cc2)C[C@H](C)O1	1321730463	KAIHHQYXBJCBJK-GJZGRUSLSA-N	441.488	1.300	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)/C=C\c1ccccc1)C(=O)NNC(=S)NC(C)C	1324990723	PRJKIVUXWQIGBD-WQTVUKCASA-N	430.621	1.602	50	20	IDGD	
Nc1cnnc(NNC(=O)CNS(=O)(=O)c2c(Cl)cccc2Cl)c1Cl	1326643590	XVUSKMWKWFAKIP-UHFFFAOYSA-N	425.685	1.441	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)c(O)n1	1780269695	RKNFSQYMHILJOM-KZULUSFZSA-N	426.311	1.570	50	20	IDGD	
COc1ccc(CC(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](O)CCl)C3)c(C#N)c1	1780687689	LVLJBWBDFZMFHQ-NNMXDRDESA-N	449.935	1.223	50	20	IDGD	
Cn1nc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@](C)(Cl)CCl)C3)C2)c2c1CCC2	1781230645	XYPNQNLXNMRVAS-MOPGFXCFSA-N	429.348	1.589	50	20	IDGD	
O=C(/C=N/O[C@@H]1CCCCO1)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781331184	GECXQGMWDUYLNH-LMHHVVARSA-N	436.278	1.036	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CN1CCCCC1)C2	1781997652	BWHGDGAJRGCHED-FRQCXROJSA-N	430.387	1.770	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1c(C)nc3ncccn13)C2	1782173151	ZAHRULQGQBJBQI-GCKMJXCFSA-N	449.939	1.419	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)C[C@H](N)c3cccnc3)CCO2)C1	1783532426	HTAGVRCCXCRSEH-DHSIGJKJSA-N	425.327	1.085	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)CCO2)C1	1783537977	VDEAYCOSYHKGEI-DIFFPNOSSA-N	442.266	1.527	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccnc3S)[C@H]2C1	1783544680	KTCAEOOYOICSDL-DHMWGJHJSA-N	442.379	1.995	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cc(Cl)ccc1F)CCO2	1783933283	UIBQMSOLKBBHLM-HXUWFJFHSA-N	440.903	1.296	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1sccc1Cl)CCO2	1783934531	CMPQRQYUDIGKDG-SFHVURJKSA-N	428.942	1.218	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)c1ncc(Cl)cn1	1785817084	GYAZHYMAEIGHLG-DRZSPHRISA-N	431.718	1.508	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccnc(Cl)n3)C[C@@H]21	1786406416	RKPLIJWYBVOJPO-GVXVVHGQSA-N	431.718	1.508	50	20	IDGD	
C[C@H](Br)C(=O)NC1(c2ccc(NC(=O)CN3C(=O)CNC3=O)cc2)CCC1	1786643658	BYWJLEYAIJKBJU-NSHDSACASA-N	437.294	1.456	50	20	IDGD	
C[C@H](Br)C(=O)NC1(c2ccc(NC(=O)C[C@H]3NC(=O)NC3=O)cc2)CCC1	1786764538	PAAPMQURDVYNTM-GXFFZTMASA-N	437.294	1.502	50	20	IDGD	
O=C(NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1)C(=O)c1ccco1	1788140183	MOAYRWSCHTZGRY-UHFFFAOYSA-N	432.241	1.590	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc(C)cn3)C[C@@H]21	1790961599	QQGZABFJKVLUPR-AYDFFVQHSA-N	425.327	1.552	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(OC)cc(OC)c3)C[C@@H]21	1791254233	QOKHJIOWRZTKIV-YFYLHZKVSA-N	440.924	1.551	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(Cl)nc1)C2	1792867144	YMPYMRVIGHMJPT-IKVITTDRSA-N	430.730	1.969	50	20	IDGD	
C[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)CBr)n1cccc1C=O	1792868469	YLLKWWLMKLOSSQ-JGFGOLAASA-N	440.338	1.482	50	20	IDGD	
C=CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCl	1793107119	NROONNGNIXEVFF-JKJDWNRSSA-N	429.945	1.694	50	20	IDGD	
CC(=O)N[C@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCl)c1ccc(F)cc1	1793115370	LRPLWASDMYYWEQ-ADHGMGHFSA-N	425.888	1.241	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ncc[nH]1)C2	1794141375	WVLHCFYUNYIOEQ-CRWXNKLISA-N	425.917	1.794	50	20	IDGD	
Cn1cncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)C2	1794836520	ZSOCHWLJYLYSJY-QYFXKUKHSA-N	441.438	1.509	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1n[nH]c2c1CCCC2	1796164817	OHGVGRIDXZATAO-RHQBZFHZSA-N	429.348	1.728	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)[C@H]1CCc2ccccc2O1	1796189958	FSIRAMLPJIDSTP-XAPVIXHLSA-N	434.301	1.012	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2nc[nH]c2c1	1797410452	FGPDFTIPSILCEE-LOUJCGABSA-N	435.322	1.940	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](F)c1ccccc1)C2	1798439670	VJOHCKJGJVCYBT-YYAJDYIMSA-N	425.464	1.648	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(F)cc1	1798926333	YDSVEHFRGVHSLD-WVNFENISSA-N	441.463	1.163	50	20	IDGD	
COc1ccc(C2(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@H](O)CCl)C4)CCC2)cc1	1799259286	QJQRUTSMVBRLPI-WTLGNFPFSA-N	436.936	1.306	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CCN1C(=O)OC(C)(C)C)C2	1799263309	JTNIDJZVCZJZMW-QRJUGERDSA-N	429.945	1.603	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(-n2c(O)nnc2O)cc1	1799311744	OQDDOXUMUWFZNG-SLBVQIDZSA-N	433.896	1.948	50	20	IDGD	
O=C(CCBr)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CC[C@H]2CCC(=O)N2C1	1799927171	IYNRMNBDSKUICX-RBGFHDKUSA-N	426.355	1.811	50	20	IDGD	
Cc1cccc2c(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)CCBr)C4)n[nH]c12	1800069224	ISDXBQLZGOCUSM-FVCICTRLSA-N	435.322	1.860	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](O)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCBr)C2	1800591216	RKVHOCUCUHYGNH-OPDFLTKYSA-N	434.331	1.253	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nccc3nc[nH]c13)C2	1800639532	IGOQYIWLOAHLMD-OPDFLTKYSA-N	436.310	1.335	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](CC)N(CC)CC)C2	1800639867	AJZAQRUGOIVJJZ-ZHCJQAHYSA-N	432.403	1.870	50	20	IDGD	
COC(=O)[C@H]1CC=CC[C@@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2	1800950294	HSJHKMAMMSXTHY-PFFSRIRZSA-N	443.338	1.116	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1C[C@@]12C(=O)Nc1ccccc12	1801929683	FKOLJBMYAZPZPM-HODVPAKSSA-N	431.920	1.788	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H]1CCc3ccccc3O1)C2	1802339677	HSTRDJZTCUZNMP-DMUMMCEESA-N	428.533	1.391	50	20	IDGD	
Cc1cc(F)cc(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)c1	1802477312	RJDMGBYXWASJLO-BCDXTJNWSA-N	439.491	1.627	50	20	IDGD	
CC(C)(C)n1ccc(C(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]2c2cccnc2)n1	1803141512	OLXBNADQTILDTA-KBAYOESNSA-N	433.940	1.952	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cc3cccnc3[nH]2)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803143098	TZZROOWEVFPYLS-RYQLBKOJSA-N	427.892	1.877	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CC1Cc2ccccc2C1)c1ccc(B(O)O)cc1	1804501285	NXOFBYKZMSXGEF-NUNAXRQHSA-N	432.329	1.423	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC2(CCCN(C(=O)[C@H]3CCCCO3)C2)CC1	1804955008	QDBHPBHMPVGPCG-GOSISDBHSA-N	429.521	1.099	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)CCC(F)(F)F)[C@H]1c1cccnc1)c1cccc(B(O)O)c1	1807370550	GSAZJZOQLDVHMZ-APWZRJJASA-N	449.238	1.424	50	20	IDGD	
CCC(=O)C(=O)N1CC[C@@H](CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@H]1c1cccnc1	1808416103	DRVCWKPAGMBQCS-AMZMXHDESA-N	438.488	1.201	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)c2ccc[nH]2)[C@@H]1c1cccnc1	1808417932	UABQGGNHVAPAQV-PFWGCWTJSA-N	447.499	1.863	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H](CNC(=O)CNC(C)=O)[C@H]1c1cccnc1	1812623561	ROHXYQORIDWELA-HLLBOEOZSA-N	425.327	1.397	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2coc(Cl)n2)[C@H]1c1cccnc1	1813070334	HVQDZKZXMZKDIJ-KDOFPFPSSA-N	448.911	1.416	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)[C@H]1C[C@@]1(F)Cl	1813151412	CIFMHQSFKRVSPK-VZRKHXGSSA-N	445.687	1.006	50	20	IDGD	
C=CC[C@@H](C(=C)C)C(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1	1815344240	PBNXQCXJZSBSOX-IRXDYDNUSA-N	439.346	1.817	50	20	IDGD	
C[C@@]1(C(=O)N[C@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)CC=CCC1	1815347891	VTTVZLPLVIPMNS-KSFYIVLOSA-N	439.346	1.795	50	20	IDGD	
COc1cccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)n1	1816270808	LWKXMNKKEJLFPA-INIZCTEOSA-N	443.508	1.492	50	20	IDGD	
C[C@@H](C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCBr)n[nH]1)n1cnnn1	1816784583	JBMFSOFHQGDDBS-JQWIXIFHSA-N	425.291	1.435	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](N)Cc3cscn3)sc2C1	1816989420	KRNPAYJPRKNXOX-DLOVCJGASA-N	443.982	1.335	50	20	IDGD	
CC(=O)OC[C@H](OC(C)=O)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](F)Cl)sc2C1	1817125365	MSAGNNDXGDJZPG-CDMKHQONSA-N	435.861	1.084	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)COc2ccccc2)[nH]n1)c1cccc(B(O)O)c1	1817473086	DSBIUBPCBPCNBN-FQEVSTJZSA-N	448.288	1.474	50	20	IDGD	
C[C@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](F)Cl)n[nH]1)[C@@H]1SC(=N)NC1=O	1818038652	ZLWGWTVBACECAG-HSDOENETSA-N	430.893	1.739	50	20	IDGD	
CC(=O)N1CCN(CC(=O)Nc2cc([C@H]3CCCCN3C(=O)[C@@H](F)Cl)[nH]n2)CC1	1818965802	YGKDHVFIHYDKQD-RHSMWYFYSA-N	428.896	1.100	50	20	IDGD	
Nc1n[nH]c(CCC(=O)Nc2cc([C@H]3CCCCN3C(=O)CCBr)[nH]n2)n1	1819282692	KBCHQAHIIZQCCC-LLVKDONJSA-N	439.318	1.520	50	20	IDGD	
CC1(C(=O)N[C@H]2CCc3nc(NC(=O)c4cnccc4C(=O)NN)sc3C2)CCCC1	1819789931	AHKGAZFGNWOYPQ-LBPRGKRZSA-N	442.545	1.948	50	20	IDGD	
CN1N=C(C(=O)N2CCCC[C@H]2c2cc(NC(=O)[C@H](F)Br)n[nH]2)CCC1=O	1820932207	ZIFCNSKDNIVGAO-FZMZJTMJSA-N	443.277	1.701	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(CO)on3)sc2C1	1821706428	XUIYMGHKQSTCHW-HTQZYQBOSA-N	429.296	1.633	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CC[C@@H](N)C(N)=O)CC1	1824094385	VOLYHPWOCYWJFJ-BMFZPTHFSA-N	445.402	1.230	50	20	IDGD	
CC(=O)N/C(C)=C/C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](F)Br)CC2	1824475199	HTXIJGAYGCPQMY-YNYHHFAJSA-N	433.303	1.786	50	20	IDGD	
CCNC(=S)NCC(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](C)Br)sc2C1	1825647654	UKWSIKMCDLZKRX-RKDXNWHRSA-N	448.412	1.323	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccnc2)CC1	1825822169	NFMJKTULRZHDTP-FQEVSTJZSA-N	436.516	1.627	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cscn2)CC1	1825987707	VJQDWDZXEOXPLR-GOSISDBHSA-N	442.545	1.689	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)COc1cccnn1)CC2	1826009074	LLHWCODVUPABTP-WDEREUQCSA-N	425.898	1.178	50	20	IDGD	
COC(=O)CCCCCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](O)CCl)CC2	1826232187	SZFVGOFEFKGKOI-DGCLKSJQSA-N	431.942	1.778	50	20	IDGD	
C[C@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H](F)Cl)CC1)[C@H]1SC(=N)NC1=O	1827666596	BWRBPEQAANTPLY-IGHBBLSQSA-N	432.949	1.943	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)cc1F	1830151304	ATGYLBZMHROVER-SFHVURJKSA-N	435.279	1.708	50	20	IDGD	
CCc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)no1	1830540064	MKFMVAAXIFQEGE-FZKQIMNGSA-N	444.326	1.338	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C13CC(F)(C1)C3)CCO2	1831580929	VOPSWCQFXLFGGY-CRZVIPCUSA-N	433.318	1.366	50	20	IDGD	
Cc1cccnc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)CBr)C2)C1	1831820607	BWEABKHAGCHKRE-KXBFYZLASA-N	440.338	1.491	50	20	IDGD	
O=C(c1sccc1F)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1831919376	LWHXQHVTNXFXPQ-IUODEOHRSA-N	439.278	1.648	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)[C@H]3CCCCN3C)CC2)CC1	1833319154	RLLVBDIIIQFMOZ-CRAIPNDOSA-N	443.430	1.826	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccs3)CCO2)C1	1833940499	NYNAORVGCULSSS-GUYCJALGSA-N	431.352	1.992	50	20	IDGD	
C[C@@H](C(=O)N1CCC(N2CCC(NC(=O)CCBr)CC2)CC1)n1ccnc1	1834422485	PADHYAPDGCEYPV-HNNXBMFYSA-N	440.386	1.801	50	20	IDGD	
O=C(CN1CCCCC1)NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1834612146	ASPHXMBDVFRRON-GOSISDBHSA-N	447.393	1.734	50	20	IDGD	
CCC1(C(=O)NC2CCN(C3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)CCC1	1835500927	QELYEUMRHOSRCX-UHFFFAOYSA-N	435.613	1.511	50	20	IDGD	
O=C(c1cc2c(s1)CCCC2)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1	1836875511	HHYIWGVJTIELCR-YWZLYKJASA-N	442.965	1.297	50	20	IDGD	
CC(C)c1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)on1	1838777629	QYXBSFSVJHKLBA-WMLDXEAASA-N	448.289	1.559	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(-n4ccnc4)ccn3)C2)C1	1839146389	NXOHUJLARHAFIF-DYESRHJHSA-N	447.923	1.355	50	20	IDGD	
C[C@H](C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2)N1C[C@@H]2C[C@H]2C1	1839153099	AZLZZEQMWPJNAG-GTXWJXBTSA-N	448.391	1.019	50	20	IDGD	
O=C(c1cc(O)ccc1F)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1839295951	AKNSIKROVJIGRT-WMLDXEAASA-N	449.248	1.292	50	20	IDGD	
O=C(c1cc(F)ccc1Cl)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1	1839325475	XATDBOFSSUJGCT-YJBOKZPZSA-N	435.279	1.149	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccccc3C(N)=O)CCO2)C1	1839349614	GTCBXKFFFAWNEO-UTKZUKDTSA-N	437.924	1.263	50	20	IDGD	
O=C(c1ccc2occc2c1O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1839564369	INRKIKJUAOQHIB-VQIMIIECSA-N	426.828	1.743	50	20	IDGD	
O=C(COc1ccccc1F)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1839970151	HOTRWGSTCODUDF-SFHVURJKSA-N	435.279	1.465	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)cn1	1840031534	SWGIFYRKKKSZEC-KDOFPFPSSA-N	426.311	1.243	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc(C)c(C)c3)C2)C1	1840149832	BEFPCCMMXNHGDH-PXNSSMCTSA-N	425.913	1.022	50	20	IDGD	
C=CCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1	1841352981	XOGVEUMZCUUFAY-GJZGRUSLSA-N	429.945	1.649	50	20	IDGD	
CC(C)(C)OC(=O)N1CC2(CC2)C[C@H]1C(=O)N1CCCC12CN(C(=O)[C@H](O)CCl)C2	1841392307	LVUISOHAWIKQDA-LSDHHAIUSA-N	441.956	1.579	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC2(CCCN2C(=O)CCS(=O)(=O)c2ccccc2)C1	1842744350	ZMOMDXNFCIGBRR-UHFFFAOYSA-N	438.622	1.905	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)c2cc(Cl)cc(Cl)n2)C1	1844567776	WORPNQUKFWAJKZ-UHFFFAOYSA-N	434.088	1.199	50	20	IDGD	
O=C(NC1(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](O)CCl)CC1)OCc1ccccc1	1847558352	CEUVNHRWVVIDFY-ULQDDVLXSA-N	435.908	1.247	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)CCc2c(C)nc3nc(N)nn3c2C)cc1	18071559	XGUPCEWMZQGKSI-AWEZNQCLSA-N	441.492	1.270	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)NNC(=O)c1ccc2c(c1)C(=O)N(C[C@H]1CCCO1)C2=O	25489417	NGGBCTMNCOGZCG-MRXNPFEDSA-N	446.463	1.947	50	20	IDGD	
O=C(COc1cccc([N+](=O)[O-])c1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	43803436	NNTXFZFETWDLJC-UHFFFAOYSA-N	448.457	1.219	50	20	IDGD	
O=C(COC(=O)/C=C\c1ccc2ccccc2n1)NNC(=O)[C@@H]1COc2ccccc2O1	212364280	IRQBAJOZHZOQCB-DUQGCJEPSA-N	433.420	1.779	50	20	IDGD	
CC(C)(CNC(=O)NNC(=O)CNC(=O)c1cccs1)c1ccc2c(c1)OCCO2	726249807	MLDAHHSTRUHNRT-UHFFFAOYSA-N	432.502	1.557	50	20	IDGD	
O=C(COc1cccnc1)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	726868611	AHXLVAHWXNBXKG-UHFFFAOYSA-N	432.483	1.784	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)CCCCN1CCOCC1	726868997	LVTFXACIKYJSHI-CQSZACIVSA-N	428.327	1.866	50	20	IDGD	
CCOc1ccccc1[C@@H](CC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)NC(C)=O	728238742	JDHUNROXEKYNRB-GOSISDBHSA-N	447.513	1.517	50	20	IDGD	
COC(=O)c1cccc(S(=O)(=O)NNC(=O)c2cc(F)ccc2Br)c1	728509378	CZVHMWXBRXIUNT-UHFFFAOYSA-N	431.239	1.998	50	20	IDGD	
CCc1c(C(=O)OCC(=O)NNC(=O)Cc2nc(C)cs2)cnn1-c1ccccc1	728722185	BAKIWGIYYFXECL-UHFFFAOYSA-N	427.486	1.747	50	20	IDGD	
O=C(NNS(=O)(=O)c1cccc(Br)c1)C1CCN(c2ncccn2)CC1	728856284	MFVYBWGKTNVZNE-UHFFFAOYSA-N	440.323	1.465	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1cnn2c(-c3ccccc3)ccnc12	728890444	QZMWCKZIDVQVMS-UHFFFAOYSA-N	442.483	1.864	50	20	IDGD	
COc1ccc(Cn2cc(C(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)cn2)cc1	731574231	OFHPSNMKYRBJBC-UHFFFAOYSA-N	428.470	1.418	50	20	IDGD	
CN(C)C(=O)CN1CCC(NC(=O)NNC(=O)c2cc(F)ccc2Br)CC1	731761900	MLDFBXYEQGJNDM-UHFFFAOYSA-N	444.305	1.085	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)N[C@@H]1CCN(c2ccccc2Cl)C1=O	732470169	UBCWXNJIDWJGBW-OAHLLOKOSA-N	427.848	1.726	50	20	IDGD	
CN(C)c1cccc(-c2nnc(SCC(=O)NNC(=O)c3ccccc3Cl)n2N)c1	735982748	KXTDYFXZDJAULO-UHFFFAOYSA-N	445.936	1.932	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)CN(C)S(=O)(=O)c2cccc([N+](=O)[O-])c2)c(C)c1	738506913	CXPITVOKJZXBOO-UHFFFAOYSA-N	449.489	1.092	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)[C@H]1CCCN(C(=O)COc2ccccc2)C1	741282831	QNIIPYYMHYAXFX-SFHVURJKSA-N	425.485	1.790	50	20	IDGD	
COc1ccc(S(N)(=O)=O)cc1C(=O)NNC(=O)NCc1cccc(C(F)(F)F)c1	742458044	RDPGLQSDZOPDCF-UHFFFAOYSA-N	446.407	1.506	50	20	IDGD	
CCCCNC(=O)NNS(=O)(=O)c1ccc(C)c(S(=O)(=O)N2CCCCC2)c1	743256704	OXVAVFJXVJJLCX-UHFFFAOYSA-N	432.568	1.462	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)[C@]2(C)CCc3ccccc3C2)CC1	743417806	DAARANBRMTYAFY-JOCHJYFZSA-N	443.573	1.656	50	20	IDGD	
CCO[C@@H](C)c1noc(CN(C)CC(=O)NNC(=O)c2cc(Cl)ccc2OC)n1	744411076	HONYOWNCJXMFTD-NSHDSACASA-N	425.873	1.722	50	20	IDGD	
C[C@@H](C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1)n1cnc2ccccc21	744619761	XNPHVGGAZFXATR-HNNXBMFYSA-N	429.502	1.762	50	20	IDGD	
CNC(=O)C1CCC(NC(=O)NNC(=O)COc2ccc(Br)cc2)CC1	745188173	TZGSYZGQEJSUBD-UHFFFAOYSA-N	427.299	1.463	50	20	IDGD	
O=C(NNC(=O)C(=O)N1CCCC1)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1	745903410	FSRSTLOXJAPOQB-CYBMUJFWSA-N	425.436	1.210	50	20	IDGD	
O=C1CN(S(=O)(=O)c2cccc(C(=O)NNc3ccc(OC(F)F)cc3)c2)CCN1	748643115	CJHNZJAMGXUESM-UHFFFAOYSA-N	440.428	1.165	50	20	IDGD	
COCCN1C(=O)c2ccc(C(=O)NNc3ccc(OC(F)F)cc3)cc2S1(=O)=O	748654347	JSJFGOUIDHUCNM-UHFFFAOYSA-N	441.412	1.836	50	20	IDGD	
Cc1cc(N2CCC(NC(=O)NNC(=O)[C@@H](C)Oc3ccc(F)cc3)CC2)nc(C)n1	749616805	UNCDYUVBELJYRF-CQSZACIVSA-N	430.484	1.999	50	20	IDGD	
CN(C)C(=O)CN1C(=O)C(=NNC(=O)c2ccncc2)c2cc(Br)ccc21	750912220	LYLBIGPRSUGBMF-UHFFFAOYSA-N	430.262	1.413	50	20	IDGD	
CCOC(=O)c1ccc(N2CC(NC(=O)NNC(=O)CSc3ccc(C)cc3)C2)nc1	753278154	BHSARINHXFKKET-UHFFFAOYSA-N	443.529	1.878	50	20	IDGD	
Cc1oc(S(N)(=O)=O)cc1C(=O)NNC(=O)c1ccc(Br)cc1Cl	754202390	XZPHFJOLWNAJNJ-UHFFFAOYSA-N	436.671	1.726	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)N[C@@H]1[C@@H]2CCO[C@@H]2C12CCC2	754672460	CBQLZTLSYZSFAM-TYPHKJRUSA-N	427.549	1.487	50	20	IDGD	
COC(=O)CCNC(=O)c1ccc(NC(=O)NNC(=O)COc2cc(C)ccc2C)cc1	755605056	YGZLQBLUVICRFC-UHFFFAOYSA-N	442.472	1.828	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)Nc1ccc(C(=O)NCC(F)(F)F)cc1	755690142	DFJZFJGOOMKCPB-UHFFFAOYSA-N	448.365	1.421	50	20	IDGD	
Cn1c(=O)c2cc(NC(=O)NNC(=O)c3c(Cl)cccc3Cl)cnc2n(C)c1=O	755848058	JKFIYEGOSXIKDX-UHFFFAOYSA-N	437.243	1.406	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)Nc1ccc(N2CCNC(=O)C2)c(Cl)c1	755938607	VSVYAXDKMPXZFK-UHFFFAOYSA-N	447.879	1.517	50	20	IDGD	
Cc1cc(C(=O)N2CCC(C)CC2)ccc1NC(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1	756089362	FFXVZWAUZHAIEB-INIZCTEOSA-N	436.534	1.455	50	20	IDGD	
COc1ccc(C#N)cc1NC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	756279926	WMZVXEIOOOQDFE-UHFFFAOYSA-N	443.485	1.818	50	20	IDGD	
O=C(COC(=O)c1cc(F)cc(C(F)(F)F)c1)NNC(=O)[C@@H]1COc2ccccc2O1	756637437	PFWAURQELOTJMY-HNNXBMFYSA-N	442.321	1.989	50	20	IDGD	
COC(=O)C(C)(C)c1ccc(NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1	756756555	IKOKKFAXPGGCSM-UHFFFAOYSA-N	437.456	1.851	50	20	IDGD	
COc1ccccc1N1CC[C@@H](NC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)C1=O	756942292	LKPUYXZJYLZRFJ-QGZVFWFLSA-N	434.456	1.630	50	20	IDGD	
COc1cc(C)ccc1CNC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	757746778	XRKJSACLDCPEOX-UHFFFAOYSA-N	448.549	1.161	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)Nc2c(C)nn([C@H]3CCS(=O)(=O)C3)c2C)c1	757871754	LTCKCSNBMZFWRA-INIZCTEOSA-N	449.533	1.708	50	20	IDGD	
Cc1ccc2nc(-c3cccnc3)cc(C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)c2c1	758035957	OSRHBQOIXBFLHL-CYBMUJFWSA-N	427.486	1.304	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)CC[C@@H](NC(=O)OC(C)(C)C)c1ccccc1	758046504	SWYCEDDKQZKPGL-DZGCQCFKSA-N	442.538	1.118	50	20	IDGD	
O=C(c1cncn1-c1ccc(F)cc1)N1CCN(S(=O)(=O)CBr)CC1	758528839	YDPKKQFNPCFIHS-UHFFFAOYSA-N	431.287	1.451	50	20	IDGD	
COc1cc(OC)cc(N2CCCN(CC(=O)NNC(=O)c3ccc(C)cc3)CC2)c1	758741793	ACHYACMXISXOPP-UHFFFAOYSA-N	426.517	1.986	50	20	IDGD	
CCOC(=O)N1[C@@H](C(=O)NNC(=O)C(=O)Nc2ccccn2)CC[C@@H]1c1ccc(C)o1	758832716	IHHFGFBUOCKOMM-ZIAGYGMSSA-N	429.433	1.431	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN(c2ncnc3sccc23)C1)C(=O)Nc1ccccn1	758838832	GQZPGYMMTDINIS-GFCCVEGCSA-N	425.474	1.089	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCc2nnc(C(C)(C)C)s2)nc1	758883010	MZVFDCYSKFHEOS-UHFFFAOYSA-N	427.556	1.744	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)N(C)CCCC(=O)NNc2ncccc2[N+](=O)[O-])cc1	759293647	AKBZQEWAIWIRAW-UHFFFAOYSA-N	435.462	1.736	50	20	IDGD	
NC(=O)[C@H]1CC[C@H](CNC(=O)NNC(=O)Nc2ccc(Br)cc2Cl)O1	759771785	DECFSUXTOLMSMS-LDYMZIIASA-N	434.678	1.471	50	20	IDGD	
O=C(NNc1ncc(F)cn1)c1ccc(Cl)c(S(=O)(=O)NC[C@@H]2CCCO2)c1	760905508	JHJRYVAUWLBONT-LBPRGKRZSA-N	429.861	1.483	50	20	IDGD	
CCCS(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)NC2CCCCC2)cc1F	762461722	AAZIHUUUJXBBBG-UHFFFAOYSA-N	436.531	1.803	50	20	IDGD	
Cc1cc(C(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)c(N)c([N+](=O)[O-])c1	763283764	RDXXBIDWZYJXHH-UHFFFAOYSA-N	436.469	1.735	50	20	IDGD	
COCCOc1c(Cl)cccc1NC(=O)C(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	763468761	UHOBACBKNKQKNH-UHFFFAOYSA-N	436.808	1.673	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(OCC2CCOCC2)cc1	763472494	UZOWTRFDSSJNHD-UHFFFAOYSA-N	442.428	1.800	50	20	IDGD	
Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)C(=O)NNC(=O)c1cccnc1	763491802	OSJFTYQFYHPRMT-IBGZPJMESA-N	447.499	1.433	50	20	IDGD	
O=C(NNC(=O)c1ccccc1O)C(=O)Nc1ccc(N2CCSCC2)c(Cl)c1	763528079	VIZKPQJMZUPILQ-UHFFFAOYSA-N	434.905	1.999	50	20	IDGD	
Cc1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	763529793	DBBUUGZQRZNWGQ-UHFFFAOYSA-N	443.935	1.947	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1ccc(F)c(Br)c1	763624279	LUFYSGJZBMPVLZ-UHFFFAOYSA-N	434.225	1.944	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)n(Cc2ccccc2)n1	763673354	CXSXZUJLZAKZCW-UHFFFAOYSA-N	432.440	1.276	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)ccc1Cl	763674867	PXLQDVDCIALHFN-UHFFFAOYSA-N	444.831	1.553	50	20	IDGD	
O=C(CSc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1ccc2c(c1)NC(=O)CO2	763736677	SQOINBIXWZMWFY-UHFFFAOYSA-N	434.861	1.549	50	20	IDGD	
O=C(NNC(=O)c1cccc(Cl)c1)C(=O)Nc1ccccc1S(=O)(=O)C(F)F	763750065	FXAIGOJLCJYXJG-UHFFFAOYSA-N	431.804	1.736	50	20	IDGD	
CNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc3ccccc3c2)cc1	763848333	BTWKHFYYBOFCDS-CQSZACIVSA-N	434.452	1.753	50	20	IDGD	
COC(=O)C(C)(C)c1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)cc1	763864862	LJNLDPAWEMYRIA-ZDUSSCGKSA-N	445.447	1.830	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1cc(F)cc(N2CCOCC2)c1	763865893	SMQIGCJVHOTIGU-CYBMUJFWSA-N	448.426	1.355	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2cc(C(=O)N(C)C(C)C)ccc2Cl)n1	763886787	YSFFVJQXLMTRNI-UHFFFAOYSA-N	448.911	1.420	50	20	IDGD	
COc1ccc2cc(NC(=O)C(=O)NNC(=O)c3nn(-c4ccccc4)cc3O)ccc2n1	763947625	CAVZYNSXYRQENJ-UHFFFAOYSA-N	446.423	1.534	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)Nc1ncn(C2CCCCC2)n1	764004798	MYYWIAVULUIMPS-UHFFFAOYSA-N	438.286	1.284	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)c(Br)n1	764005168	WDIPKRHEWVLZDI-UHFFFAOYSA-N	435.234	1.323	50	20	IDGD	
CON(C)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)Cc2cccc3ccccc23)cc1	764029551	UOQRSXABIJSHMB-UHFFFAOYSA-N	434.452	1.802	50	20	IDGD	
CCc1cc(O)nc(-c2cccc(NC(=O)C(=O)NNC(=O)c3ccccc3OC)c2)n1	764040677	IWCVAMMMGVMSPI-UHFFFAOYSA-N	435.440	1.820	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc(N2CCCC2=O)c(Cl)c1	764040830	NFTUFAGCXYJNNL-UHFFFAOYSA-N	430.848	1.875	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)nc1)C(=O)Nc1cccc(I)c1	764092813	NYMBCYPGYJAQSH-UHFFFAOYSA-N	444.616	1.739	50	20	IDGD	
CN1CCCN(c2ccc(NC(=O)C(=O)NNC(=O)c3ccc(Cl)cc3O)cc2)CC1	764125393	WWIBKVXIVKBOGA-UHFFFAOYSA-N	445.907	1.587	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2cccc(OC[C@H]3CCCO3)c2)cc1	764127860	TXSAYJOTIJQMDO-HXUWFJFHSA-N	441.484	1.972	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(F)c(C(=O)N(C)C)c2)o1	764139679	YFXHQHMYBCOPCD-UHFFFAOYSA-N	447.467	1.362	50	20	IDGD	
O=C(NNC(=O)c1ccoc1)C(=O)Nc1cc(I)ccc1Cl	764164550	TXIUOVFHFKEWGA-UHFFFAOYSA-N	433.589	1.937	50	20	IDGD	
O=C(Cc1ccccn1)NNC(=O)C(=O)Nc1cc(Cl)ccc1C(=O)N1CCCC1	764264720	RNBGOAPINDNFBZ-UHFFFAOYSA-N	429.864	1.300	50	20	IDGD	
COc1ccc(Br)c(NC(=O)C(=O)NNC(=O)COc2ccccc2O)c1	764276855	CQZZLKWWPSJHFF-UHFFFAOYSA-N	438.234	1.328	50	20	IDGD	
CC(C)(C(=O)NNC(=O)C(=O)Nc1cccc(S(=O)(=O)NC2CC2)c1)c1ccccc1	764314288	TYDAVYIEDHRDFV-UHFFFAOYSA-N	444.513	1.191	50	20	IDGD	
CN1CCN(Cc2cccc(NC(=O)C(=O)NNC(=O)c3ccc(Cl)cc3F)c2)CC1	764410302	FJNIBLGBXRTYNI-UHFFFAOYSA-N	447.898	1.626	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)C(=O)Nc2ccc(-n3cccn3)c(Cl)c2)c1	764431492	YWYQPDUTYJXZAY-UHFFFAOYSA-N	441.835	1.279	50	20	IDGD	
CCOc1cccc(C=NNC(=O)CN2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)c1	764820463	YZRPPIWEEXESSE-UHFFFAOYSA-N	444.557	1.850	50	20	IDGD	
CCn1c(O)nc2cc(C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)ccc2c1=O	765312831	CLFLFMKRJYMMAQ-UHFFFAOYSA-N	433.465	1.188	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)[C@@H]3Cc4ccccc4C(=O)O3)n[nH]2)cc1OC	765597485	HDYFPVTXNNDUFS-IBGZPJMESA-N	436.424	1.637	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)c1cc(S(=O)(=O)N(C)C)ccc1O	766967508	OPGXIZXBOYTBIT-LLVKDONJSA-N	425.438	1.010	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)C1(S(=O)(=O)c2ccccc2)CC1	767375938	TUDMRSHBCXLFST-UHFFFAOYSA-N	430.482	1.235	50	20	IDGD	
O=C(NNC(=O)c1cccc(Cl)c1)C(=O)Nc1cc(C2CC2)nn1-c1ncccn1	768237547	MYJKPXIZGNOYEY-UHFFFAOYSA-N	425.836	1.593	50	20	IDGD	
CC(=O)N1CCc2c(NC(=O)C(=O)NNC(=O)[C@H](C)Oc3cccc(C)c3C)cccc21	769265480	JVGDVLNDEZGPRN-HNNXBMFYSA-N	438.484	1.766	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@H]2C(=O)NNC(=S)NCCSC)c(OC)c1	770240069	MJUPQYYCLMIQDI-AWEZNQCLSA-N	426.564	1.167	50	20	IDGD	
NS(=O)(=O)c1ccc(F)c(C(=O)NNC(=S)Nc2cccc(Br)c2)c1	770997003	SZWSNSFOWPHWKO-UHFFFAOYSA-N	447.311	1.867	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)CNC(=O)c1cccc(O)c1	771605045	CMTBAPNJUHPDLF-LLVKDONJSA-N	436.262	1.499	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1cc(S(=O)(=O)N2CCCC2)ccc1Cl	771934563	ULAVLWOMAMVDAB-NSHDSACASA-N	431.898	1.227	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)C(=O)Nc2ccc(Cl)c(-n3nnnc3C3CC3)c2)n1	773478976	PVHCCCJYMDDHEB-UHFFFAOYSA-N	427.856	1.682	50	20	IDGD	
Cc1nc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)ccc1Br	773526913	GPSJQEYARBUBJL-JTQLQIEISA-N	439.241	1.845	50	20	IDGD	
CC(C)c1nccnc1NNC(=O)C(=O)Nc1cc(N2CCCS2(=O)=O)ccc1F	774000135	OTIXJCSPKQPCGA-UHFFFAOYSA-N	436.469	1.361	50	20	IDGD	
Cn1cc(S(=O)(=O)N2CCOCC2)cc1C(=O)NNc1ccc(C(F)(F)F)cn1	775243327	KIVBLOFEWBOXNW-UHFFFAOYSA-N	433.412	1.217	50	20	IDGD	
Cc1nn(-c2cncc3nnnn23)c(C)c1CC(=O)NNc1ccc(C(F)(F)F)cn1	775265282	JDDTVSQPLVCANG-UHFFFAOYSA-N	432.370	1.421	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)N[C@H](c1ccc(OC(F)F)cc1)C(F)(F)F	776012842	KEUYFBVLAHWCRF-GXSJLCMTSA-N	445.366	1.657	50	20	IDGD	
O=C(NNc1ccc(F)c(F)c1F)Nc1ccc(S(=O)(=O)N2CCOCC2)cn1	776062772	ZKQJFYPINAGTLQ-UHFFFAOYSA-N	431.396	1.668	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2cc(F)c(OC)c([N+](=O)[O-])c2)c(OC)c1	777626565	XKJUSZUVNYGYJQ-UHFFFAOYSA-N	429.382	1.383	50	20	IDGD	
O=C(COc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1cc2c(cc1F)NC(=O)CC2	778706873	GKUQPSOKQJQQDF-UHFFFAOYSA-N	434.811	1.529	50	20	IDGD	
CNC(=O)[C@H]1CN(C(=O)C(=O)NNc2ccccc2OC(F)(F)F)c2ccccc2O1	778797790	BZWYIHVUCNDDHS-OAHLLOKOSA-N	438.362	1.569	50	20	IDGD	
COc1ccc(Cl)cc1S(=O)(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	782463367	UQQMINCBMZPHJP-UHFFFAOYSA-N	447.922	1.222	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)N1CCO[C@@H](c2ccc(C(F)(F)F)cc2)C1	782502296	DUFCCWGEZQASHI-OAHLLOKOSA-N	440.378	1.843	50	20	IDGD	
CN(C)C(=O)CNC(=O)C(=O)NNC(=O)c1ccc(COc2ccc3ccccc3c2)cc1	782703411	YXNXOAINQXWBDK-UHFFFAOYSA-N	448.479	1.384	50	20	IDGD	
CCc1nnc(-c2cccc(NC(=O)C(=O)NNC(=O)Cc3nc4ccccc4n3C)c2)o1	782888222	UUTZEEKNZPCKJD-UHFFFAOYSA-N	447.455	1.514	50	20	IDGD	
O=C(NNC(=O)N1CCC(CCCn2ccnc2)CC1)C1CCN(c2ncccn2)CC1	783000915	DSNVXUSBZVUHAD-UHFFFAOYSA-N	440.552	1.823	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ncccc2C(F)(F)F)cc1-n1nnnc1C	783119853	LELNXAYRYPJDDL-UHFFFAOYSA-N	436.354	1.475	50	20	IDGD	
O=C(NNC(=O)C(=O)N1CCCC1)C(=O)Nc1ccc(Oc2ccc(Cl)cn2)cc1	784000121	WPXSDWCQESCKPC-UHFFFAOYSA-N	431.836	1.236	50	20	IDGD	
COc1c(Cl)cc(NC(=O)C(=O)NNC(=O)CNC(=O)c2cccs2)cc1Cl	784005413	ZUPLCELEEPYOJZ-UHFFFAOYSA-N	445.284	1.579	50	20	IDGD	
O=C(NNc1ccc(F)c(F)c1F)C(=O)Nc1ncn(CC(=O)N2CCCCCC2)n1	784812043	XMVYVSDDYKGUBB-UHFFFAOYSA-N	439.398	1.180	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)C(=O)Nc2cc(OC)c(OC)cc2C(=O)N(C)C)c1	784850693	ADJZIVNYJZELJL-UHFFFAOYSA-N	444.444	1.274	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2ccc(C(=O)N3CCN(C)CC3)cc2)cc1Cl	785118373	RPIPUVKTCVMOQS-UHFFFAOYSA-N	445.907	1.818	50	20	IDGD	
CNC(=O)c1ccc(C)c(NC(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)c1	785835267	LEEKKYHIEVKYQN-UHFFFAOYSA-N	448.524	1.996	50	20	IDGD	
Cc1ccc(C(=O)NCC2CC2)cc1NC(=O)C(=O)NNC(=O)COc1ccccc1O	785989893	ABTGGVVEKRLAGS-UHFFFAOYSA-N	440.456	1.005	50	20	IDGD	
NC(=O)c1ccc(SCC(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)c([N+](=O)[O-])c1	788869755	MBBNWXJRMTYRGX-KSSFIOAISA-N	444.469	1.506	50	20	IDGD	
CCc1ccc(C(=O)NNc2nc3ccccn3n2)cc1S(=O)(=O)N1CCOCC1	791254002	SGULVDJWCAULNZ-UHFFFAOYSA-N	430.490	1.070	50	20	IDGD	
CC1(CCNC(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)CC1	792202306	YGDSKTYMGMTXOO-UHFFFAOYSA-N	438.550	1.161	50	20	IDGD	
O=C(NNc1nc2ccccn2n1)C(=O)Nc1ccc(S(=O)(=O)C2CCCC2)cc1	792394226	ONLVXYFVLKVDSE-UHFFFAOYSA-N	428.474	1.527	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2ccc(C)c(Br)n2)c1	793021830	LPBWLIJDJRIKFX-UHFFFAOYSA-N	437.250	1.569	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1cccc(Br)n1	793024847	GKQCMXLCMXQZNQ-UHFFFAOYSA-N	439.291	1.731	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)c2cccc(NN3C(=O)[C@H]4CC=CC[C@H]4C3=O)c2)cc1	793290649	UVNJGUYDJHQRHA-KDURUIRLSA-N	429.436	1.911	50	20	IDGD	
O=C(NNc1nccc2sccc12)C(=O)Nc1cc(S(=O)(=O)N2CCCC2)ccn1	797055585	ZUZHHFWLRFJFLN-UHFFFAOYSA-N	446.514	1.558	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2cc(N3CCOCC3)ccc2C)c1	797534627	CEEFTKSUAMUGPB-UHFFFAOYSA-N	426.473	1.305	50	20	IDGD	
Cc1ccccc1NC(=O)NNC(=O)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(F)cc1	798311506	VBIKKLORJTUCLB-PBHICJAKSA-N	436.465	1.111	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)N[C@@H]1CCN(C(=O)Nc2ccccc2)C1	801005420	CHJLNIYVHVUANK-CQSZACIVSA-N	430.490	1.115	50	20	IDGD	
COc1ccc(-c2nnc(SCC(=O)NNC(=O)C(=O)Nc3ccc(C)cc3)o2)cc1	801105239	CBROZGGYRYCWFA-UHFFFAOYSA-N	441.469	1.932	50	20	IDGD	
Cc1cc([N+](=O)[O-])ccc1NNC(=O)Nc1cnn(CC(=O)N2C[C@H](C)O[C@H](C)C2)c1	806326126	LOKKTOLGBACIEC-OKILXGFUSA-N	431.453	1.884	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1nc(-c2ccc(F)cc2)cs1	806979255	XBJWSXBIUKQPEZ-UHFFFAOYSA-N	430.417	1.820	50	20	IDGD	
CNC(=O)c1cccc(NC(=O)C(=O)NNc2cnc3ccccc3n2)c1Br	806983741	FBIFDLYZFGCGTB-UHFFFAOYSA-N	443.261	1.834	50	20	IDGD	
CCOC(=O)CC(C)(C)CC(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	807243334	PPDCFCCZQYBIKG-UHFFFAOYSA-N	428.530	1.992	50	20	IDGD	
CCCN(CCC)S(=O)(=O)c1ccc(C(=O)NNC(=O)N2CCN(C)CC2)cc1	807382626	MJINUQDHNLICHB-UHFFFAOYSA-N	425.555	1.099	50	20	IDGD	
O=C(NNS(=O)(=O)c1c(F)cccc1OC(F)(F)F)c1ccc(-n2cnnn2)cc1	808069680	FOQJDIQROKIRLR-UHFFFAOYSA-N	446.342	1.323	50	20	IDGD	
CC(C)(C)OC(=O)N1CCOc2ccc(NC(=O)C(=O)NNc3ncc(F)cn3)cc2C1	812987659	SPKDCBXRVOVMFN-UHFFFAOYSA-N	446.439	1.827	50	20	IDGD	
COC(=O)C12CCC(C(=O)OCC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)(CC1)CC2	814591515	DSVBLXWIQLKNML-UHFFFAOYSA-N	433.417	1.413	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(C(C)=O)cc2)cc(OC)c1C	815566391	SCWAWDNUCKBUNJ-AWEZNQCLSA-N	443.456	1.768	50	20	IDGD	
C[C@H]1Cc2c[nH]nc2[C@H](C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)C1	816829935	JYNITXFPNPLPQO-SUMWQHHRSA-N	431.518	1.321	50	20	IDGD	
CC(C)[C@@H](NS(=O)(=O)c1ccc2c(c1)OCCCO2)C(=O)NNc1ncncc1F	817078994	CWNAXASAUPHXIJ-MRXNPFEDSA-N	439.469	1.223	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NN=C1CCn3cccc31)N(S(C)(=O)=O)CC2	818257143	IAMIIRQZMXTLEU-GOSISDBHSA-N	446.529	1.678	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)[C@H]2CC(=O)N(c3ccc4c(c3)CCC4)C2)c2ccccc2c1=O	914280301	LOELGLVTGXJHNI-INIZCTEOSA-N	445.479	1.236	50	20	IDGD	
COc1ccc2c(c1)C[C@H](C(=O)NNC(=O)CCN1CCN(c3ccccc3)CC1)CO2	914774369	FGTLTNGSPMITQL-IBGZPJMESA-N	438.528	1.606	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NC[C@@H](c2cccs2)N2CCN(C)CC2)cc1	915901003	BIVQKTHTCDDPIB-SFHVURJKSA-N	431.562	1.754	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)N[C@@H](C)c1cccc(S(N)(=O)=O)c1	916197378	RUWKTGIDOKRTBN-JTQLQIEISA-N	426.882	1.701	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)NCc1ccc(CS(=O)(=O)NC)cc1	916228530	FNSOUIBTPIQOPQ-UHFFFAOYSA-N	434.518	1.208	50	20	IDGD	
CN(C)[C@H](CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)c1ccsc1	916449823	OOFPXCGRCRWIJR-MRXNPFEDSA-N	439.563	1.245	50	20	IDGD	
CC[C@@H](C)NC(=O)c1cccc(CNC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1	916477282	WZCFBVCYJNNTLS-KUHUBIRLSA-N	426.473	1.885	50	20	IDGD	
CCCCN(C(=O)COC(=O)/C(C#N)=C/c1ccc(OC)cc1)[C@@H]1CCS(=O)(=O)C1	916613226	UISJDKRWTXMHJE-XCMFGDQWSA-N	434.514	1.961	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)NC2CC2)cc1)NNC(=O)c1ccc(Cl)cc1O	918359222	QMDSSMFCWVOCIQ-UHFFFAOYSA-N	437.905	1.880	50	20	IDGD	
O=C(NNC(=O)C1(S(=O)(=O)c2ccc(Cl)cc2)CC1)c1nnc(O)c2ccccc12	919692312	NHDSMVUZKJLYLF-UHFFFAOYSA-N	446.872	1.756	50	20	IDGD	
CNC(=O)NNC(=O)c1cc(S(=O)(=O)N(C)c2ccc(OC)cc2)ccc1Cl	919879898	NBDBFPWTDBRWFC-UHFFFAOYSA-N	426.882	1.748	50	20	IDGD	
O=C(Cn1c(S)nnc1-c1cccs1)NNC(=O)c1cncn1-c1ccccc1	1115831311	KFVINNHRAPYGQI-UHFFFAOYSA-N	425.499	1.942	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCC(=O)NNc2ccc(-c3ccccc3)nn2)cc1	1117637764	CLTHXTMBRCDIOR-UHFFFAOYSA-N	427.486	1.964	50	20	IDGD	
CN1CCC(N2CCC(NC(=O)NNC(=O)c3cncn3-c3ccccc3)CC2)CC1	1251398805	VMKHMNUSCXTGBF-UHFFFAOYSA-N	425.537	1.375	50	20	IDGD	
Cc1c(S(=O)(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)sc2cccc(F)c12	1319219426	QBVWUSVUCFMPKT-UHFFFAOYSA-N	432.462	1.948	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)CNC(=O)c2cc(F)cc(F)c2)CC1	1320317732	RWNLNRQRYOGPNS-UHFFFAOYSA-N	440.447	1.489	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNS(=O)(=O)c2ccc(NC(C)=O)c(F)c2)cc1	1321142204	MBEHQCMONJWPPZ-GFCCVEGCSA-N	439.465	1.960	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cnc(C)nc2C2CC2)c1	1321316611	BEIGAWBKQBWBEG-UHFFFAOYSA-N	431.518	1.768	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NC2CCN(C(=O)c3ccoc3)CC2)cc(OC)c1OC	1337480114	AGGOETFUMLESRS-UHFFFAOYSA-N	446.460	1.554	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCc1ccc(Br)o1	1338596773	DIRYNCYTSJAIQQ-UHFFFAOYSA-N	444.311	1.788	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4ncncc4c3)C2)C1	1778605453	UEAHWPWNVNDMTO-BFUOFWGJSA-N	433.306	1.857	50	20	IDGD	
O=C(c1c[nH]c2cccc(Cl)c12)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1778752358	SULFCRAMSQFTQV-HNAYVOBHSA-N	426.300	1.865	50	20	IDGD	
COc1cc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CO[Si](C)(C)C)C2)nn1C	1779546833	QUEFCPCJZGXRQA-OXQOHEQNSA-N	438.601	1.408	50	20	IDGD	
Cc1n[nH]c(C)c1CC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Br)C1	1780776968	MROSIMGWAICYBB-UWWQBHOKSA-N	445.333	1.773	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CN1CCCC1)C2	1781898034	ZRXQGDJSKSUAFU-FRQCXROJSA-N	430.387	1.770	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc3n(n1)CCCO3)C2)C(Cl)Cl	1782218075	QPSTVSUSBAEGOU-FZKQIMNGSA-N	431.320	1.597	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](C)Oc1ccccn1)CCO2	1783354015	LXSCTNONCCTIPI-YZVOILCLSA-N	440.338	1.852	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cnnc4ccccc34)CCO2)C1	1783534566	LRKGVHMUFWDCRI-BFUOFWGJSA-N	433.306	1.857	50	20	IDGD	
COc1ccnc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](C)Br)C3)C2)c1OC	1783537476	NUGRIWYGDXQKTQ-SGTLLEGYSA-N	442.310	1.326	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)CCc3ccc(OC)cc3F)CCO2)C1	1783874506	ICCAGJUKAWATEJ-DYESRHJHSA-N	442.915	1.851	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)CCc3ccc(N(C)C)cc3)CCO2)C1	1783879533	WPDCQLNMSWFSLS-SIKLNZKXSA-N	437.968	1.769	50	20	IDGD	
O=C(NC1(c2ccc(NC(=O)[C@H](O)c3ccco3)cc2)CCC1)c1cccc(B(O)O)c1	1785855667	ZOILPSRJYSERCG-HXUWFJFHSA-N	434.257	1.441	50	20	IDGD	
C[C@@H](Cn1cccn1)C(=O)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1	1786967880	CYYNSMVXKVDFKR-KRWDZBQOSA-N	446.316	1.647	50	20	IDGD	
CCCNC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]2C1	1789868448	XKUJMJRCRSXJDK-XLPNERPQSA-N	436.380	1.509	50	20	IDGD	
Cc1nccn1[C@@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]2C1	1789872544	IVINYLSZUGZMEP-DOQDNZIXSA-N	431.364	1.969	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3(C(=O)OC)CC3)[C@H]2C1	1790889151	INLXYLFMSPPNDO-FQUUOJAGSA-N	431.327	1.093	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3Cc4ccccc4CN3C)C[C@@H]21	1791252628	QGAMEARATBELKB-SXYSDOLCSA-N	449.979	1.277	50	20	IDGD	
CCOC(=O)C1(C(=O)NC2(c3ccc(NC(=O)CCC(=O)NN(C)C)cc3)CCC2)CC1	1791602650	WPIZXRFZCBHZFZ-UHFFFAOYSA-N	444.532	1.837	50	20	IDGD	
O=C(CN1C(=O)C=CC1=O)Nc1ccc(C2(NC(=O)[C@@H](F)Br)CCC2)cc1	1791695695	LWIBADIJOOEORC-MRXNPFEDSA-N	438.253	1.736	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CC1CCN(C)CC1	1792608012	UIKVPHDWAVAWCU-DFGXFYAUSA-N	430.387	1.481	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1cccc(O)c1)C2	1792871985	HAOVCHHHWKKPNR-JNNRSPCRSA-N	439.350	1.945	50	20	IDGD	
C=C1CC(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C1	1793879502	AVMPLDNWUXQCJU-YVSFHVDLSA-N	441.956	1.674	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cocn1	1794940693	PYTSBDJNQKAIAV-IVWMJMPLSA-N	444.400	1.025	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](N)c1cccc(Cl)c1	1795629888	KJNJJECNDFKHKH-APDPGRRMSA-N	444.757	1.713	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](N)c1cccc(Cl)c1	1796076979	RXKWTGKIZFRQCD-AXVVYFOYSA-N	435.956	1.351	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(-c2ccco2)no1	1796592237	DMYSXTIHMPEGEW-QDMKHBRRSA-N	429.477	1.559	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](CO)NC(=O)OC(C)(C)C	1796739609	CIZDKUCAXFMWHO-HPCHECBXSA-N	448.358	1.294	50	20	IDGD	
CCc1[nH]nc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)c1F	1796889774	GTGIMALLOXNCMP-MGGJZVGQSA-N	443.483	1.497	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1C[C@@H]1F)C2	1798523031	PEBBOMJVJIHWPS-UNSNBMSVSA-N	435.408	1.081	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc2ccnn12	1799903456	QFKBVRZPPGGZNK-VWPFQQQWSA-N	435.322	1.569	50	20	IDGD	
CC[C@@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc3n(n1)CCNC3=O)C2	1801798222	AVGUMZPSZIXEBR-YVECIDJPSA-N	438.326	1.052	50	20	IDGD	
CC[C@@H](NC(C)=O)C(=O)NC[C@H]1CCN(C(=O)CO[Si](C)(C)C)[C@H]1c1cccnc1	1802879258	HHSXBRODLKQMMF-GGPKGHCWSA-N	434.613	1.854	50	20	IDGD	
CC(C)(CCl)C(=O)NC[C@H]1CCN(C(=O)c2cc(O)nc(O)n2)[C@H]1c1cccnc1	1802899000	HRVPKJBDCXEAMO-CJNGLKHVSA-N	433.896	1.867	50	20	IDGD	
CC(C)(CCl)C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1802899412	ARQZMXHPQGGYTD-IEBWSBKVSA-N	443.740	1.346	50	20	IDGD	
O=C(/C=C/c1ccc([N+](=O)[O-])o1)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1	1803260184	NUNRIUGYCHRBML-CTAJETNHSA-N	448.863	1.902	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2ccsc2)[C@@H]1c1cccnc1	1805424838	KVPWMBUGFCXJBT-UZLBHIALSA-N	429.546	1.836	50	20	IDGD	
O=C(CN1CCCC1=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@H]1c1cccnc1	1806926311	YRYMTKVCUNKEIH-RRQGHBQHSA-N	441.301	1.400	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H]2C[C@H]2C2CC2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1	1807366003	RFPGTCXHNVPACL-UVUJQTEASA-N	433.317	1.127	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC2(CCCN(C(=O)c3ccccc3O)C2)CC1	1807864559	QXNAUADNHQSNKT-UHFFFAOYSA-N	437.500	1.549	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)C2(N3CCN(C)CC3)CC2)[C@@H]1c1cccnc1	1808275576	SKNBIZOTNATFOE-HSALFYBXSA-N	448.011	1.885	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H](CNC(=O)[C@H](C)NC=O)[C@@H]1c1cccnc1	1808381722	DOCDCAZDPACURR-UKMLZYKCSA-N	425.327	1.395	50	20	IDGD	
O=C(/C=C\C(=O)NC1CC1)NC[C@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1	1810123639	DZMOWQMIYKNFBM-VUTNTTQYSA-N	449.349	1.707	50	20	IDGD	
CC[C@H](NC(C)=O)C(=O)N1CC[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]1c1cccnc1	1810537861	QHGUOQIJAPXYOY-CMKODMSKSA-N	434.613	1.854	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H](CNC(=O)CCC(N)=O)[C@H]1c1cccnc1	1812634733	ZFWBCCYXLXMRBC-JKIFEVAISA-N	425.327	1.526	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)CCC(N)=O)[C@@H]1c1cccnc1	1812779263	QWLFIGMZEWZMDY-JKIFEVAISA-N	425.327	1.526	50	20	IDGD	
C=C(CC(=O)OCC)C(=O)N1CC[C@H](CNC(=O)[C@@H](Cl)COC)[C@H]1c1cccnc1	1813032137	GHNLBPYCPRWNCN-ZIFCJYIRSA-N	437.924	1.851	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2ccc(C#N)cc2)[C@@H]1c1cccnc1	1813072358	GQYIAPOQONTIEJ-NFBKMPQASA-N	448.527	1.646	50	20	IDGD	
NC(=O)c1ccc(C(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)cc1	1813733949	MEVAYKIUGJGBJF-RCCFBDPRSA-N	430.892	1.100	50	20	IDGD	
CC(C)(C)[C@H](O)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1814822856	PAWXQOPIUJJVSI-NVXWUHKLSA-N	443.508	1.121	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2ON=C(c3ccccc3)O2)[nH]n1)[C@H](O)CCl	1814872210	FNBFTFZQGSMRRH-MDOVXXIYSA-N	447.879	1.736	50	20	IDGD	
Cc1onc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)c1C	1815450703	LBAUTRXPLCJIGE-KRWDZBQOSA-N	437.265	1.314	50	20	IDGD	
Cc1nn(C)c(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)c1F	1816246073	ZEVQFGVSHKXGHJ-AWEZNQCLSA-N	448.503	1.270	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(=O)n3[nH]nnc3n2)n[nH]1	1817813347	VUKBKUXLLWDMSF-GFCCVEGCSA-N	447.887	1.107	50	20	IDGD	
CCOCCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)n[nH]1	1818114252	PQZVDKRLCPQPME-PTZPRWATSA-N	443.508	1.962	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2c[nH]c(=O)cn2)n[nH]1	1820242043	IPHBJOXDXWVQIT-GWCFXTLKSA-N	437.298	1.830	50	20	IDGD	
CCc1cc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@@H](Cl)COC)CC3)nn1C	1820971962	OROMHABTWJKXDY-PWSUYJOCSA-N	425.942	1.919	50	20	IDGD	
Cc1ccccc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2	1822005112	RJFVQOCGKRZKGM-MRXNPFEDSA-N	435.314	1.671	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)Cc3ccncc3)sc2C1	1822539856	NLUUEJBLBMNFBN-CQSZACIVSA-N	430.534	1.066	50	20	IDGD	
C[C@@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)n1cccc1	1822671627	NGZPRSRJQKOXIN-KXBFYZLASA-N	435.293	1.458	50	20	IDGD	
Cc1ccc(CC(=O)Nc2cc([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)o1	1822909848	JLGYRNXDKUWLNQ-QGZVFWFLSA-N	430.509	1.919	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](F)Cl)CC2)c1cnc2c(c1)CCNCC2	1824640219	QOAFKWZQTMKWGN-BLLLJJGKSA-N	437.928	1.987	50	20	IDGD	
O=C([C@@H]1CCCCO1)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827056024	QLGQXTNURLFVTR-SFTDATJTSA-N	428.338	1.169	50	20	IDGD	
CCc1cc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)n[nH]1	1827294141	WAMKNJVPHBLUCG-IBGZPJMESA-N	432.569	1.578	50	20	IDGD	
Cc1cc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)CC2)n[nH]1	1828924045	HVOCDIJEWQKSGM-IBGZPJMESA-N	439.520	1.264	50	20	IDGD	
CC[C@H](C)[C@H](N)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1	1828925340	JWHLEAZSLJDQSU-BEVDRBHNSA-N	444.580	1.292	50	20	IDGD	
COC[C@@H](NC(C)=O)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CO[Si](C)(C)C)CC1	1829116509	SAQANFGKWYRWGA-RTBURBONSA-N	441.645	1.609	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)COc3ccc(F)cc3)C2)C1	1830359872	XPEGMPLTUSPVJE-NRFANRHFSA-N	442.915	1.926	50	20	IDGD	
O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)COC1CCCCC1)CCO2	1830375530	IAQHCVJVPGFULG-IBGZPJMESA-N	447.370	1.577	50	20	IDGD	
Cc1ccc(SCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)cc1	1830731471	LRNPRRKQBDYDNY-YLJYHZDGSA-N	442.965	1.143	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3c[nH]c4nccc-4c3)C2)C1	1831647808	YZMLMRKFWLTJMD-UWJYYQICSA-N	434.924	1.992	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc4ccnn34)C2)C1	1831654564	VISKYSAZRMKXLX-DYESRHJHSA-N	434.924	1.812	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3cn[nH]c3)CCO2)C1	1832942175	IVEHGUMGCKJILT-QZTJIDSGSA-N	433.336	1.035	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)NC(=O)CC)CC2)CC1	1833529707	HFACTUANKBKKMA-QAPCUYQASA-N	429.005	1.880	50	20	IDGD	
CCn1nccc1C(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)Br)CC2)CC1	1834278043	FTXVNYWRSLZHRI-CQSZACIVSA-N	440.386	1.872	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3csc(C)n3)CCO2)C1	1834459865	QZSROONGISDXMK-SUMWQHHRSA-N	446.367	1.695	50	20	IDGD	
O=C(C#Cc1ccccc1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1835101990	MNBCIZYBEXVEDS-HKUYNNGSSA-N	439.281	1.185	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)C(Cl)Cl)CC2)CC1)c1ccc2nn[nH]c2c1	1836500722	QHVJOEFVGJOHFB-UHFFFAOYSA-N	439.347	1.947	50	20	IDGD	
O=Cc1ccc(C(=O)N2CCC(OC3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)s1	1836716776	QBQGFNZFQFPRTI-INIZCTEOSA-N	428.938	1.773	50	20	IDGD	
Cc1nc2sccn2c1C(=O)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1837146155	BPQQFIGSMCNHDM-KRWDZBQOSA-N	447.344	1.578	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)c3ccn(C)c3)CC2)CC1	1837374626	WCKJBYUIDDEDKO-UHFFFAOYSA-N	433.553	1.010	50	20	IDGD	
O=C(CCBr)N1CCC(OC2CCN(C(=O)Cn3ccnc3)CC2)CC1	1837532259	PJQNJXYKJRKVOM-UHFFFAOYSA-N	427.343	1.667	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3c(F)cccc3F)CCO2)C1	1838996602	VUDHESUZYPCTEE-MGPUTAFESA-N	446.878	1.218	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccnc3C)C2)C1	1839963563	OHLNHEKYSHWFTR-APWZRJJASA-N	440.338	1.634	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccncc3F)C2)C1	1839964242	KXANVHQQHASUSL-KDOFPFPSSA-N	444.301	1.464	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)/C=C/c3ccco3)C2)C1	1840031081	FKDROXHNDKJTTL-BMCXSGSRSA-N	427.295	1.533	50	20	IDGD	
Cc1cc(C)nc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)c1	1840032140	OHTPRXADMVMVNF-KXBFYZLASA-N	440.338	1.552	50	20	IDGD	
CC1=CC[C@H](C(=O)N2CCOC[C@@]3(CN(C(=O)[C@@H](C)Br)CCO3)C2)CC1	1840033241	YKYCYYXAUBPFMI-JTDSTZFVSA-N	429.355	1.973	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccccc3C3CC3)C2)C1	1840156202	KGPJKICDKITZGT-UGKGYDQZSA-N	436.936	1.888	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)N2CC3(CCCN3C(=O)[C@H](O)CCl)C2)C1	1841353941	ZBKSAVRYLUDWAE-HUUCEWRRSA-N	429.945	1.437	50	20	IDGD	
COc1ccc(F)cc1C(=O)N1CC2(CCCN2C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C1	1843417288	RENOTZKNIOGIGB-AFUMVMLFSA-N	441.463	1.785	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC12CN(C(=O)[C@H]1C[C@@]13C(=O)Nc1ccccc13)C2	1846178974	DCRYWFQGEGQMHV-ZGLRSVDFSA-N	432.318	1.883	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)c1ncsc1Br)C2	1846384762	FYFRKUAWLZEWEB-UHFFFAOYSA-N	444.355	1.096	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1ccc2c(c1)NC(=O)CO2	1847500979	IEYLOAMPWDDBPB-CQDKDKBSSA-N	436.306	1.864	50	20	IDGD	
COc1ccc(Cn2cc(CC(=O)N3CC[C@H]4[C@@H]3CCN4C(=O)[C@@H](O)CCl)cn2)cc1	1847556380	KRRFXUJSGJCDPX-UFYCRDLUSA-N	446.935	1.284	50	20	IDGD	
C[C@@H](C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)n1cccn1	1848098477	DQKPVWLTNVNNAZ-VGWMRTNUSA-N	439.944	1.778	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)[C@@H]1Oc2ccccc2O[C@@H]1C	10948604	RIXARGIGHGCMMD-ADLMAVQZSA-N	434.832	1.881	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)c2cc([N+](=O)[O-])cn2C)c2ccccc2c1=O	22181494	MRQLGZAGYWJGIO-UHFFFAOYSA-N	426.433	1.908	50	20	IDGD	
O=C(COC(=O)C1CCN(C(=O)Nc2ccccc2)CC1)NNC(=O)c1cccs1	22204825	YAHCNJIDRNGBPA-UHFFFAOYSA-N	430.486	1.996	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)CNC(=O)c1sc2ccccc2c1Cl	725902399	MGOMXSVTZPIKIZ-UHFFFAOYSA-N	434.861	1.455	50	20	IDGD	
COc1ccc([C@@H](CNC(=O)NNC(=O)CNC(=O)c2cccs2)N(C)C)cc1OC	726084739	STLHXZVAHSFCDQ-CQSZACIVSA-N	449.533	1.128	50	20	IDGD	
CC(=O)N(CCC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)Cc1ccccc1	726156133	DOOSNKZNYADRKQ-UHFFFAOYSA-N	446.529	1.137	50	20	IDGD	
CC[C@H](OC(=O)/C(C#N)=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(N)=O	726988334	OQDNNBIODSCCIL-WQMJKPAKSA-N	429.864	1.793	50	20	IDGD	
CCCn1nc(C(=O)NN=C2CCN(CCCC(=O)OC)CC2)c2ccccc2c1=O	727059020	IIWKPBJWEXLQRG-UHFFFAOYSA-N	427.505	1.941	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(Br)cn2)cc1OC	727551033	WNRVIBCGPLNPKP-UHFFFAOYSA-N	438.234	1.479	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNS(=O)(=O)c1cccc(-n2cnnn2)c1	728170518	ZBJSJQVYMZPBEJ-AWEZNQCLSA-N	438.469	1.593	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)[C@H](C)Oc2ccc3ccccc3c2)cc1C(N)=O	728170533	ZZHHDYJMFLLQJT-ZDUSSCGKSA-N	443.481	1.724	50	20	IDGD	
COc1cccc(-n2c(C)nnc2SCC(=O)N([C@H]2CCS(=O)(=O)C2)N(C)C)c1	728179357	JUEBAKUVRMCMOC-HNNXBMFYSA-N	439.563	1.169	50	20	IDGD	
Cc1ccc(O[C@H](C)C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)cc1	728212820	GPWAQASRRQOUDT-QGZVFWFLSA-N	432.546	1.842	50	20	IDGD	
CCc1ccc(OCC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)cc1	728213476	LVEOBGKAJRSDBR-UHFFFAOYSA-N	432.546	1.707	50	20	IDGD	
COc1cccc(/C=C(\C#N)C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1	728320738	YMXQWFZXSNBQDN-RNYZQXAPSA-N	437.408	1.133	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1nc(N2CCCC2)ncc1Cl	728845448	HSXGGLBDYGWOLC-UHFFFAOYSA-N	430.900	1.198	50	20	IDGD	
O=C(COC(=O)c1csc(I)c1)NNC(=O)c1ccccc1	730886986	MOYYDPPZLBZGLY-UHFFFAOYSA-N	430.223	1.971	50	20	IDGD	
Cc1c(C(=O)N([C@H]2CCS(=O)(=O)C2)N(C)C)nnn1-c1ccc(OC(F)F)cc1	731163678	RGXVMFISOMQTMZ-ZDUSSCGKSA-N	429.449	1.283	50	20	IDGD	
O=C1NC(=O)C2(CCC(C(=O)NNC(=O)c3ccc(Br)cc3Cl)CC2)N1	731474859	FSOMBBIBSMTWRI-UHFFFAOYSA-N	443.685	1.632	50	20	IDGD	
C=CCn1c(=O)c2ccccc2n2c(S[C@H](C)C(=O)NNC(=O)CC(C)C)nnc12	731904900	QSTGDXJKIUUGBI-CYBMUJFWSA-N	428.518	1.904	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)CN1C(=O)CCc2ccccc21	731957172	SZVIURYAGTZWCT-UHFFFAOYSA-N	432.274	1.955	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)CCS(=O)(=O)c1ccc2c(c1)OCCO2)c1ccccc1	731996866	GNQABETVOYICTC-KRWDZBQOSA-N	432.498	1.963	50	20	IDGD	
Cc1ccc(-n2c(C)cc(/C=C(\C#N)C(=O)NCC(=O)NCCN3CCOCC3)c2C)cc1	732155535	CJEIVRFTMVRAQE-PXLXIMEGSA-N	449.555	1.874	50	20	IDGD	
CCN(c1ccccc1)S(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=O)CN(C)C)c1	733359506	JCDCDVVWXHMITM-UHFFFAOYSA-N	438.937	1.878	50	20	IDGD	
CCCN(C(=O)[C@H](C)OC(=O)/C(C#N)=C\c1cc(C#N)n(C)c1C)[C@@H]1CCS(=O)(=O)C1	744630946	CETAGCFGYOXCKA-KRAYCAALSA-N	446.529	1.470	50	20	IDGD	
O=C(NCCc1ccn(-c2ccc(F)cc2)n1)NNC(=O)c1nnc(O)c2ccccc12	745892306	SYMLAPMYGAWHQC-UHFFFAOYSA-N	435.419	1.847	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)N[C@@H]2CCCN(CC(F)(F)F)C2=O)cc1	746340137	VVVDOKMJQQBAKM-IUODEOHRSA-N	446.426	1.736	50	20	IDGD	
O=C(NCCC(=O)N1CCN(c2ccccc2)CC1)NNC(=O)c1cc2c(s1)CCC2	748464347	BVHXHHKGKCECRC-UHFFFAOYSA-N	441.557	1.920	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)c2ccc(-c3n[nH]c(C4CC4)n3)cc2)c1	748898907	OIYXVWNGVHKCSY-UHFFFAOYSA-N	430.424	1.839	50	20	IDGD	
CCCCO[C@@H]1C[C@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)C1(C)C	748970858	POAXBLFHHCYKCQ-DLBZAZTESA-N	440.566	1.865	50	20	IDGD	
Cn1cnnc1SCC(=O)Nc1cccc(C(=O)NNC(=O)CCc2ccccc2)c1	749851989	VDMLMPONZKVLSU-UHFFFAOYSA-N	438.513	1.940	50	20	IDGD	
Cc1nn(-c2cncc3nnnn23)c(C)c1CC(=O)NNC(=O)c1ccc2ccccc2c1	749903461	FZOKHBWACQCPGY-UHFFFAOYSA-N	441.455	1.479	50	20	IDGD	
O=C(CCSc1ccnc2cc(Cl)ccc12)NNC(=O)[C@@H]1CCS(=O)(=O)C1	751225649	XYWVEUPZOUTKQR-LLVKDONJSA-N	427.935	1.953	50	20	IDGD	
COc1cc(N2C[C@H](C(=O)NNC(=S)N[C@@H](C)C3CC3)CC2=O)cc(OC)c1OC	751619191	LIIYNHHENBBHPL-WCQYABFASA-N	436.534	1.359	50	20	IDGD	
COc1cc(OC)cc(N2C[C@H](C(=O)NNC(=O)[C@H](C)Oc3ccccc3F)CC2=O)c1	752270985	NFLYUAXWPIDADQ-UONOGXRCSA-N	445.447	1.811	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)N[C@H]2CCCN(Cc3ccccn3)C2=O)cc1C	753289195	KOXMSHAXKZEBEI-IBGZPJMESA-N	425.489	1.599	50	20	IDGD	
Nc1nc(Cl)cc(NNC(=O)c2cc([N+](=O)[O-])ccc2I)n1	753464169	MYYYBMBDRSRAAT-UHFFFAOYSA-N	434.581	1.982	50	20	IDGD	
Cc1nn(-c2ccccc2)c2sc(C(=O)NNC(=O)NC[C@H](C)S(C)(=O)=O)cc12	754676042	QSZBNCBEYXLVHQ-NSHDSACASA-N	435.531	1.773	50	20	IDGD	
CCCOc1ccc(C(F)(F)F)cc1NC(=O)NNC(=O)[C@H](C)NS(C)(=O)=O	755417309	LLPGEJXRQDEPTK-VIFPVBQESA-N	426.417	1.585	50	20	IDGD	
COC(=O)CNC(=O)c1ccc(NC(=O)NNC(=O)c2ccc(Cl)cc2OC)cc1	755551435	YDFORPHKNSUXSG-UHFFFAOYSA-N	434.836	1.718	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2cc(C(=O)NC)ccc2Cl)c2ccccc2c1=O	755934293	QQKLNNXMPMSFCC-UHFFFAOYSA-N	442.863	1.896	50	20	IDGD	
O=C(NNC(=O)c1cn(-c2ccc(Br)cc2)cn1)C(=O)Nc1ccccn1	755966907	ILUKCHMZHVGRPN-UHFFFAOYSA-N	429.234	1.430	50	20	IDGD	
CN1CC(=O)N(c2cccc(NC(=O)NNC(=O)COc3ccc(Cl)cc3)c2)C1=O	755991422	IZUTVEMMLMKTCP-UHFFFAOYSA-N	431.836	1.970	50	20	IDGD	
O=C(CC1CCCC1)NNC(=O)Nc1ccc(F)c(S(=O)(=O)N2CCOCC2)c1	756031965	MVYKOLHGLNPLNQ-UHFFFAOYSA-N	428.486	1.580	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)NCCN2C(=O)[C@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2=O)cc1	756096065	ONEYHCYAFYVLIQ-DFEHZGFQSA-N	428.514	1.225	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)Nc2ccc3c(c2)N(C)C(=O)CO3)n[nH]1	756817013	GGYJRQRHFSFLMG-UHFFFAOYSA-N	436.428	1.907	50	20	IDGD	
CCOC(=O)c1sc([C@@H](C)NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)nc1C	756914889	VNFNEBCTCSOROF-LLVKDONJSA-N	444.477	1.309	50	20	IDGD	
O=C(COC(=O)COc1ccc(N2CCCC2=O)cc1)NNC(=O)c1cccc(Cl)c1	757004626	NYNBAZITPYXECV-UHFFFAOYSA-N	445.859	1.850	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3ccc(C(=O)NC4CC4)cc3)CC2)cc1	757095594	GQGRPACJPRHGBN-UHFFFAOYSA-N	449.555	1.466	50	20	IDGD	
COCCOc1c(Cl)cc(NC(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)cc1Cl	757891114	VQXFRFDLDDBWMO-VIFPVBQESA-N	440.305	1.606	50	20	IDGD	
CCOC(=O)[C@H]1CCC(=NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)C[C@H]1C	758120200	XQZNXPVZXYWYGB-XLIONFOSSA-N	428.533	1.916	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)[C@H](C)NC(=O)c2ccc(Cl)cc2)n1	758494966	ZUPHEAWRCHBDCV-NSHDSACASA-N	438.893	1.157	50	20	IDGD	
Cc1ccc(CNC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c(O[C@@H]2CCOC2)c1	758901198	OUWCTYJSMGRVIA-UZLBHIALSA-N	427.457	1.833	50	20	IDGD	
CO[C@](C)(C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1)c1ccccc1F	760066256	LRKBLUAZEIPVFT-KRWDZBQOSA-N	429.857	1.449	50	20	IDGD	
COCCOc1cc(C(=O)NNC(=O)CCN2C[C@H](C)O[C@H](C)C2)nc2ccccc12	760119188	ATKUXMOHOUTKDX-IYBDPMFKSA-N	430.505	1.520	50	20	IDGD	
O=C(NNc1nccc(N2CCOCC2)n1)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1	762851141	BDOLDPNWHQSRFG-LBPRGKRZSA-N	447.477	1.031	50	20	IDGD	
COc1ccc(C)cc1N1C[C@@H](C(=O)NNc2nccc(N3CCOCC3)n2)CC1=O	762860669	GLPQHVBTUVECKA-HNNXBMFYSA-N	426.477	1.126	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cc3c(C)nn(-c4ccccc4)c3s2)n(C)n1	763537459	DQDQWQFAOHDLBV-UHFFFAOYSA-N	437.485	1.837	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)c(OC)c1	763538940	HBKRNCFMKDHURH-UHFFFAOYSA-N	433.417	1.129	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2ccc(N3CCOC3=O)cc2)c1	763644865	NXNUFLRTQMHHAX-UHFFFAOYSA-N	426.429	1.425	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(Br)cc1F	763657706	PRWQBZZSQNYUJB-UHFFFAOYSA-N	440.225	1.762	50	20	IDGD	
O=C(NNC(=O)c1cc2c(s1)CCC2)C(=O)Nc1ccc2nc3n(c(=O)c2c1)CCC3	763784799	IEMYIFGWUBMISN-UHFFFAOYSA-N	437.481	1.293	50	20	IDGD	
CCc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc1	763796884	KLFIAMXFZKPVOX-UHFFFAOYSA-N	444.513	1.433	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccc([S@@](C)=O)c(F)c1	763865560	LJVZNUSTYXSPCB-XGCHSQQGSA-N	425.413	1.256	50	20	IDGD	
CN(C)CCc1ccc(NC(=O)C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc1	763944031	KFBIIJIYPLFEGW-UHFFFAOYSA-N	436.472	1.082	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)cc1N1CCOC1=O	763976854	GHHMHPPEQOLKIL-UHFFFAOYSA-N	448.819	1.411	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(C(F)(F)F)c2)cc1	764039895	BZUUEMURHFRIDU-UHFFFAOYSA-N	439.346	1.657	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(NC(=O)C(=O)NNC(=O)C2CCCC2)ccc1Cl	764078104	YJHYKRLTNJXGRB-UHFFFAOYSA-N	444.941	1.647	50	20	IDGD	
CC[C@H](C)C(=O)NNC(=O)C(=O)Nc1cc(S(=O)(=O)C(F)(F)F)ccc1OC	764081064	CDYWZOSSMAHWAX-QMMMGPOBSA-N	425.385	1.121	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc4c(c3)C(=O)N(C)C4=O)n[nH]2)cc1	764109900	DCFRJSDUNLYQRZ-UHFFFAOYSA-N	446.423	1.011	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)c(OCC(=O)N(C)C)c1	764118212	ZBRORONQFFOJOS-UHFFFAOYSA-N	448.863	1.221	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccccc1C(=O)NC(C)(C)C	764136925	WKULXNBKWZIVQM-UHFFFAOYSA-N	426.473	1.552	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(C(=O)N(C)C)ccc2C)o1	764138777	KEDHYCAHVCVHPI-UHFFFAOYSA-N	443.504	1.531	50	20	IDGD	
CCS(=O)(=O)c1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)CCc1ccco1	764168292	AXGKOLVBJAEUPD-UHFFFAOYSA-N	427.866	1.445	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1ccc(C(=O)NC2CCCC2)cc1	764275744	SXTREZGNJXQNEB-UHFFFAOYSA-N	440.456	1.230	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)C(=O)Nc1cccc(CN(C)C(=O)OC(C)(C)C)c1	764297772	YTYQIENCGSOZNT-UHFFFAOYSA-N	430.465	1.485	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2c[nH]nc2C)n(-c2ccccc2C(F)(F)F)n1	764298730	ZIVOKIWFOQQNIV-UHFFFAOYSA-N	435.366	1.631	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)NNC(=O)CNC(=O)c1cccnc1	764343732	RIBYUNCLVAJSLT-KRWDZBQOSA-N	441.488	1.095	50	20	IDGD	
CS(=O)(=O)Cc1ccccc1NC(=O)C(=O)NNC(=O)c1ccc(Cl)cc1F	764409919	APYIBMXAPASBPJ-UHFFFAOYSA-N	427.841	1.423	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NN=Cc3ccc(F)c(C)c3)CC2)cc1	764817278	OUKZRHARDXLMIF-UHFFFAOYSA-N	432.521	1.899	50	20	IDGD	
O=C(Cc1ccc(O)cc1)NCC(=O)NNC(=O)c1ccc(Br)cc1Cl	765489599	UEBSORGCMGSDRQ-UHFFFAOYSA-N	440.681	1.928	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2ccn(-c3ccc(F)cc3F)n2)c2ccccc2c1=O	766633006	RYHZMBKPKPWEKE-UHFFFAOYSA-N	438.394	1.955	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3ccc(N(C)C)c(F)c3)CC2)cc1	766642435	HXUWCKXYEGNILF-UHFFFAOYSA-N	427.524	1.779	50	20	IDGD	
Cc1cc(=O)n(CC(=O)NC(C)C)c(C)c1C(=O)NNc1ccccc1S(C)(=O)=O	766661719	HCTLCGJPYDNXIG-UHFFFAOYSA-N	434.518	1.150	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)c1ccc(=O)n(Cc2ccccc2)n1	767270482	ZLRAWVDTVKSEOX-UHFFFAOYSA-N	434.452	1.147	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)NC[C@@]1(N2CCOCC2)CCSC1	770298100	IKVGEBXGJAXEMN-KUHUBIRLSA-N	442.969	1.646	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)N[C@H]1CC(=O)N(c2c(F)cccc2F)C1	770856351	RFZQGENPNJVRSC-ZDUSSCGKSA-N	428.399	1.291	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)[C@@H]2CC(=O)N(c3c(F)cccc3F)C2)cc1	771153459	ZKKFDUIXKSILIC-CQSZACIVSA-N	442.378	1.194	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NN=Cc1c(N2CCOCC2)nc2ccccn12	771560057	BPOSGGQWRQFGIW-UHFFFAOYSA-N	440.891	1.591	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)[C@@H]1CCCN(C(=O)COc2ccccc2)C1	772147614	YJAPHRFHKFXACQ-DLBZAZTESA-N	433.505	1.429	50	20	IDGD	
CN(CC(=O)NNC(=O)c1cccc(C#N)c1)[C@@H](C(N)=O)c1cccc(Br)c1	772405731	UGAOSPHVDMJWSF-QGZVFWFLSA-N	444.289	1.240	50	20	IDGD	
COc1ccc([C@@H](OC)[C@H](C)NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1	772582976	QKVGKKUKAZMJMU-DJJJIMSYSA-N	439.472	1.662	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)[C@@H]1CCN(c2ccc(Cl)cc2)C1=O	772897892	NJDRCXDZPQTIMX-INIZCTEOSA-N	449.294	1.810	50	20	IDGD	
CC(C)Oc1ccc(S(=O)(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1	773235566	YQNNOGMJFXUPIE-UHFFFAOYSA-N	426.520	1.390	50	20	IDGD	
COc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)C(=O)NNc1ccc2ccccc2n1	773654343	GEPJOIJICMMFFB-UHFFFAOYSA-N	443.485	1.576	50	20	IDGD	
COc1ccc(Cn2cc(C(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)cn2)cc1OC	777402119	HSFBRHFKZSCOLP-UHFFFAOYSA-N	425.401	1.932	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNS(=O)(=O)c1ccc(F)c(Br)c1	777939788	IOFAJORZRYNDDW-UHFFFAOYSA-N	426.264	1.422	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)c2cnn(CCO[C@@H]3CCCCO3)c2C)nc1C	778422451	PERNIXFRPHCCHP-QGZVFWFLSA-N	432.481	1.767	50	20	IDGD	
Cc1cc(C)nc(-n2cc(C(=O)NNC(=O)CNC(=O)OC(C)(C)C)c(C(C)C)n2)n1	778441511	LRNUOKIKRUNXQM-UHFFFAOYSA-N	431.497	1.688	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)cc1Br	778712893	LPHQUEQAVZGBGU-INIZCTEOSA-N	448.273	1.937	50	20	IDGD	
COC(=O)c1ccccc1NNC(=O)[C@@H]1CN(Cc2nc(O)c3ccccc3n2)CCO1	780731430	IFOHGOLDVLTUKL-SFHVURJKSA-N	437.456	1.466	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H](C)[C@H]2CCCOC2)c1	780864081	ZOSJEIDDFJMBHT-ZBFHGGJFSA-N	426.539	1.476	50	20	IDGD	
O=C1C[C@@H](c2cccc(NC(=O)C(=O)NNC(=O)c3ccc(Cl)cc3Cl)c2)CN1	782925845	CMRZIGDBLHPSFP-LLVKDONJSA-N	435.267	1.997	50	20	IDGD	
O=C(NNc1ncnc2ccsc12)C(=O)Nc1ccc(S(=O)(=O)N2CCCC2)cc1	783261758	JKACTFLYNLMTIJ-UHFFFAOYSA-N	446.514	1.558	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2ccn(-c3cccc(C(F)(F)F)c3)n2)CCS(=O)(=O)C1	783427712	PULDVUUITNPEML-INIZCTEOSA-N	445.423	1.028	50	20	IDGD	
Cc1ccc(NNC(=O)C(=O)Nc2ccc(C)c(NC(=O)CN3CCCCC3)c2)nn1	783947809	LLJSLYYWUJLXSK-UHFFFAOYSA-N	425.493	1.600	50	20	IDGD	
O=C(NNc1cccnc1Cl)C(=O)Nc1cccc(Cn2nc3ccccn3c2=O)c1	784842461	VQLOROPJAPARKY-UHFFFAOYSA-N	437.847	1.675	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)C(=O)Nc2ccc(N3CCNC(=O)C3)c(Cl)c2)c1	784855322	XSFVMFXXQBCWJF-UHFFFAOYSA-N	445.863	1.145	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)nn1-c1cccc(F)c1	785060343	HWJQRTOAOVMEHN-UHFFFAOYSA-N	435.419	1.296	50	20	IDGD	
COc1cc(F)cc(NNC(=O)C(=O)Nc2ccc(F)c(-n3nnnc3C3CC3)c2)c1	785235235	QDRICSZUTICUHK-UHFFFAOYSA-N	429.387	1.908	50	20	IDGD	
CC(C)c1ccc(S(=O)(=O)c2ccc(NNC(=O)NCc3nnn(C)n3)cc2)cc1	787441064	LJGQXGYIUZBOMM-UHFFFAOYSA-N	429.506	1.993	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNS(=O)(=O)c1cnc2ccccc2c1	788138806	GLKGKYXCDKNXCR-UHFFFAOYSA-N	433.515	1.460	50	20	IDGD	
COCc1nc(OC)c2c(C)c(C(=O)NNc3ccccc3S(N)(=O)=O)sc2n1	788227267	AQLYLPGDOAPWEC-UHFFFAOYSA-N	437.503	1.559	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NN=Cc3cc(C)nc(Cl)c3)CC2)cc1	788720409	MZSVVMQHYKZKOM-UHFFFAOYSA-N	449.964	1.808	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2ccc(Cl)nc2C)c2ccccc2c1=O	789733291	YFIMUQMENPGZKT-UHFFFAOYSA-N	428.836	1.173	50	20	IDGD	
CC(C)COc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)cn1	789811140	VNMJQAFDWPOQAU-HKUYNNGSSA-N	426.473	1.775	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1cc([C@@H]2CCCOC2)nn1C	790965196	HWYYKTKOPZKKJF-CHWSQXEVSA-N	449.895	1.521	50	20	IDGD	
Cc1nc(C(=O)Nc2cccc(NC(=O)NN(C)C)c2)nn1-c1n[nH]c(C(F)(F)F)n1	791273423	VIASSCLGTPJUBH-UHFFFAOYSA-N	438.374	1.563	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2ccc3nc(C)n(C)c3c2)cc1	792808588	YGXWEMRSAKSUAP-UHFFFAOYSA-N	429.502	1.272	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)C(=O)Nc1cc(C(C)(C)C)nn1-c1ccc(C#N)cc1	793021226	AAZPLIRHMSVKFJ-UHFFFAOYSA-N	433.472	1.780	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(C)c(Br)n1	793023739	VLSVAAPKRGONJN-UHFFFAOYSA-N	435.278	1.880	50	20	IDGD	
CCc1onc(-c2ccccc2Cl)c1C(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1	793177579	VBPMHDNZWUCNQW-SNVBAGLBSA-N	426.882	1.689	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@@H]2COCCN2C2CCCC2)cc1Br	793485527	YPROCHJXPKZPKH-HNNXBMFYSA-N	426.311	1.862	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)c1cccc(NN2C(=O)[C@H]3CC=CC[C@@H]3C2=O)c1	793553275	DBOZWVCVAQWKKP-IRXDYDNUSA-N	441.488	1.031	50	20	IDGD	
N#CCc1ccccc1S(=O)(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	794577103	QRRXGNQCHNEEJV-UHFFFAOYSA-N	448.526	1.160	50	20	IDGD	
CC(C)c1ccc(C(=O)O)cc1S(=O)(=O)NNC(=O)CNC(=O)OCc1ccccc1	794598948	PMIQHICPVHJSCK-UHFFFAOYSA-N	449.485	1.744	50	20	IDGD	
C[C@@H]1Oc2ccccc2N(CCC(=O)NNc2ccccc2S(=O)(=O)N(C)C)C1=O	795168985	HOYVHWCQNGEZEF-AWEZNQCLSA-N	432.502	1.584	50	20	IDGD	
COC(=O)c1cc(F)cc(NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)c1F	796998232	CGXGJWKJVCPMIZ-UHFFFAOYSA-N	427.747	1.510	50	20	IDGD	
CCNC(=O)N(C)c1cccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2OC)c1	796998250	IGNKBSINVLXEOX-UHFFFAOYSA-N	447.879	1.914	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2cccc(S(=O)(=O)NC(C)(C)C)c2C)n1	797369748	HNGTXNDTVGGFDE-UHFFFAOYSA-N	447.517	1.175	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCc2ccco2)cc1C(=O)NNC(=O)NCC(F)(F)F	798314507	OJTOFSQCTOTNPF-UHFFFAOYSA-N	434.396	1.573	50	20	IDGD	
CCCCNS(=O)(=O)c1ccc(C)c(NC(=O)C(=O)NNc2ccc(OC)cn2)c1	799835597	UZKXDURNOCKGER-UHFFFAOYSA-N	435.506	1.559	50	20	IDGD	
COc1ccc([C@@H]2[C@H](C(=O)NNC(=O)C(=O)Nc3ccc(C)cc3)CCC(=O)N2C)cc1	801106227	PVLZRTHTECSCBG-UYAOXDASSA-N	438.484	1.699	50	20	IDGD	
Cc1nc2c(c(O)nn2C)c(C)c1CC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	802067393	DIYJAQZOMXECII-UHFFFAOYSA-N	446.489	1.090	50	20	IDGD	
C[C@@H]1CC(C)(C)C[C@@]2(C1)NC(=O)N(CC(=O)NNC(=O)Nc1ccc3c(c1)OCO3)C2=O	802100873	AVWFDIZBGPJHMZ-XUSGNXJCSA-N	445.476	1.705	50	20	IDGD	
O=C(CNC(=O)c1ccc(Br)cc1)NNC(=O)Nc1ccc2c(c1)OCO2	802105373	URPUZQKKHNEXMO-UHFFFAOYSA-N	435.234	1.761	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)NNC(=O)Nc2cc(OC)ccc2Cl)ccc1OC	802110842	VJJWDVIIMUSYGR-UHFFFAOYSA-N	442.881	1.732	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)NC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1	802330557	CALWHJGRIKTMIC-INIZCTEOSA-N	440.456	1.533	50	20	IDGD	
COCCOc1ccc(S(C)(=O)=O)cc1NC(=O)NNC(=O)c1ccc(Cl)nc1	806736202	KTYDZGCHAYRBTD-UHFFFAOYSA-N	442.881	1.630	50	20	IDGD	
C[C@H](Oc1ccccc1NC(=O)C(=O)NNC(=O)Cc1cn2ccccc2n1)C(F)(F)F	807020182	RQDXPFVFJSUDOI-LBPRGKRZSA-N	449.389	1.993	50	20	IDGD	
CCN1C[C@@H](CN(C)C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)Oc2ccccc21	807135123	KWOYDHLQFTXBLS-QGZVFWFLSA-N	436.476	1.236	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCc2cccc(NC(=O)OC)c2)c2ccccc2c1=O	807493434	NTSQJVUWPZOVQI-UHFFFAOYSA-N	438.444	1.739	50	20	IDGD	
COC(=O)c1cc(Br)cc(C(=O)O[C@@H](C)C(=O)NNC(=O)CC(C)C)c1	812699962	ZVIYFYYCUIJPIT-JTQLQIEISA-N	429.267	1.975	50	20	IDGD	
Cc1cc(N2C[C@@H](C(=O)NNc3ccc(S(=O)(=O)N(C)C)cc3)CC2=O)ccc1F	812731626	ONHRKGRGYRSTSR-AWEZNQCLSA-N	434.493	1.881	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)CCCN2CCN(c3ccccc3)CC2)cc1	812732368	CPPDUJPAFMOACR-UHFFFAOYSA-N	445.589	1.982	50	20	IDGD	
Cc1nnsc1CNC(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	813848513	AGGMAVRBGWKDMF-UHFFFAOYSA-N	449.500	1.693	50	20	IDGD	
CC(Cn1cc(C(F)(F)F)ccc1=O)=NNC(=O)Nc1ccc(S(N)(=O)=O)cc1	814969187	HUEVUTKMSIRGRG-UHFFFAOYSA-N	431.396	1.712	50	20	IDGD	
CC(C)Sc1c(Cl)cccc1NC(=O)C(=O)NNC(=O)[C@H]1CCc2nncn2C1	815692988	IILNJUUDRNLHAL-NSHDSACASA-N	436.925	1.781	50	20	IDGD	
C[C@H](Sc1nnnn1C1CC1)C(=O)NNC(=O)[C@H]1CCCN(C(=O)OC(C)(C)C)C1	819658844	PTBGBTOKHBYWNK-RYUDHWBXSA-N	439.542	1.283	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)NC2CCN([C@@H]3CCN(C)C3=O)CC2)c1C	819805334	XSCCNUPSKBDRTG-CKNGIZQFSA-N	427.549	1.470	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)N2CC(CN3CCN(C)CC3)C2)c(C)n1C[C@H]1CCCO1	820458390	DSBLSIQVVNYVOS-PKGQOAHCSA-N	425.577	1.897	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)[C@H]2CCCCN2S(=O)(=O)c2ccccc2)cc1	825588243	CNXGRZWIYUOVHR-LJQANCHMSA-N	430.530	1.798	50	20	IDGD	
CCc1c(C(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)cnn1-c1ccccn1	915060111	CYTHEDJYOKQTKP-UHFFFAOYSA-N	425.445	1.930	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)nn1-c1ccccc1)N[C@@H]1CCS(=O)(=O)C1	915880690	WCXSJWDFBLNQKN-MRXNPFEDSA-N	439.497	1.670	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NN=Cc1ccccn1)N(S(C)(=O)=O)CC2	916354989	HLXMESULKAPIAV-KRWDZBQOSA-N	432.502	1.498	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2cccc(N3CCCC3=O)c2)c1	916516209	PGBWZBOLDNMTJT-UHFFFAOYSA-N	430.486	1.361	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCCN1S(=O)(=O)c1cccs1)c1ccc(Cl)nc1	917253582	BPVKTBDPNGEUEV-GFCCVEGCSA-N	428.923	1.801	50	20	IDGD	
O=C(COC(=O)c1sccc1Br)NNC(=O)[C@H]1COc2ccccc2O1	917273344	MPMJWHVKSMNTDI-GFCCVEGCSA-N	441.259	1.655	50	20	IDGD	
O=C(COC(=O)c1c[nH]n2c1nc(=O)c1ccccc12)NNC(=O)c1cccc(Cl)c1	919466030	PAMWISMVTIKAOA-UHFFFAOYSA-N	439.815	1.447	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)[C@@H]2CCCCN2S(=O)(=O)CCC)cc1OC	919683250	UXLUFYSSQXTOAX-INIZCTEOSA-N	441.550	1.839	50	20	IDGD	
COc1ccccc1CC(=O)NN=Cc1ccc(OCC(=O)N2CCOCC2)c(OC)c1	920376296	PMXINBXQHBXTEM-UHFFFAOYSA-N	441.484	1.634	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)N[C@@H]2CC(=O)N(c3ccccc3)C2)c2ccccc2c1=O	921125840	WOJJLHCEITWGSU-OAHLLOKOSA-N	448.483	1.727	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)ccc1N1CCNC1=O	1116085466	MSQQYUDOBUZFSR-UHFFFAOYSA-N	445.520	1.933	50	20	IDGD	
CN1CCN(C(=O)NNC(=O)c2cc(Br)cc(Br)c2O)CC1	1262621472	MBNGIGTXONGATF-UHFFFAOYSA-N	436.104	1.519	50	20	IDGD	
O=C(Cn1cc(C(=O)NNC(=O)c2cncn2-c2ccccc2)cn1)NC1CCCCC1	1318871410	GXDGHOKNVUMMFG-UHFFFAOYSA-N	435.488	1.593	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cccc4c3NC(=O)C4=O)C2)C1	1778708284	ZBDYIEMKAMOMDJ-OAQYLSRUSA-N	433.892	1.530	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@]2(C1)CN(C(=O)C[C@H]1CNc3ccccc3O1)CCO2	1779297035	PEMVOIYCSLBDRA-HTAPYJJXSA-N	447.608	1.931	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)O)C2	1780055187	KFXGBRRIBHXBRL-WMHILYHISA-N	449.460	1.028	50	20	IDGD	
Cc1cnn(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](F)Br)C2)c1	1780773800	XAVSCQKAFNYYBB-FRFSOERESA-N	431.306	1.396	50	20	IDGD	
Cc1cc(Br)ccc1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1781564963	KWXALVLXACEZHS-MAUKXSAKSA-N	445.741	1.801	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1cnccn1)C2	1781997341	RYAHMIUAQLPFKU-JCKWVBRZSA-N	425.327	1.316	50	20	IDGD	
Cc1c(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)cc(Cl)cc1[N+](=O)[O-]	1781999397	PKBPZJWSUIBOHF-CRAIPNDOSA-N	446.287	1.600	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CCC(=O)NN(C)C)C2)c(O)c1	1782214008	HBTKKYBBUVZXBY-AUSIDOKSSA-N	446.548	1.201	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(CCN(C(=O)c3cc4cccnc4nc3O)C2)C1	1782259938	DFPIONYGLPCKSZ-LJQANCHMSA-N	449.305	1.564	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(F)nc3F)[C@H]2C1	1783384115	FWUTYVPYAVZUQG-UKJIMTQDSA-N	432.265	1.737	50	20	IDGD	
C[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](C)Br)C2)C1	1783529199	SUNDHWYKVVKZTL-FHSNZYRGSA-N	448.358	1.513	50	20	IDGD	
CO[C@@H](C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](C)Br)C2)C1)c1ccccc1	1783532878	ONBHTGVEPRGRHQ-OGWOLHLISA-N	425.323	1.987	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)c3ccco3)[C@H]2C1	1783566063	RNEDJWSFKBNASG-IICXDKKESA-N	429.311	1.466	50	20	IDGD	
O=C(/C=C/c1ccc(O)cc1Cl)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1783775088	PMLSESHFKUVIJL-JEDCVFLRSA-N	429.300	1.488	50	20	IDGD	
O=C(CCOc1ccc(F)cc1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21	1783786741	DLRLWGSMBWTOSJ-MGHWNKPDSA-N	428.888	1.174	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)CCc3cccnc3OC)CCO2)C1	1783872615	DLYKFRISPLZPES-OXJNMPFZSA-N	425.913	1.107	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)/C=C/c3cc(F)cc(OC)c3)CCO2)C1	1783879554	XDKYAHOMNZVCHA-CLJOXJKXSA-N	440.899	1.931	50	20	IDGD	
C=C1C[C@@H](C(=O)N2CC[C@@]3(CN(C(=O)[C@@H](F)Cl)CCO3)C2)N(C(=O)OC(C)(C)C)C1	1784089347	BNZIBRDCMVLUOC-MDOVXXIYSA-N	445.919	1.916	50	20	IDGD	
CC(=O)N[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)Br)C[C@@H]21)C(C)(C)C	1784310529	FGLJKMPXHBPEQE-AKSVOJBYSA-N	446.386	1.300	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CNC(=O)c3cc(C)on3)C[C@@H]21	1784618296	XWMDCQOWKJHAOW-MPTYRVRUSA-N	440.928	1.100	50	20	IDGD	
Cc1ncc(/C=C/C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)s1	1784687671	BKCRBJHDIUZFCT-XHCBAJNBSA-N	432.315	1.985	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3ccc(OC)nc3)[C@H]2C1	1785097677	WLIGLTBTNNKPAB-XSLAGTTESA-N	439.940	1.256	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)C/N=C/c3ccco3)C[C@@H]21	1786406080	HERBIIWUGXIBDN-CPXQMSAISA-N	426.311	1.463	50	20	IDGD	
Cc1cc(C(=O)Nc2ccc(C3(NC(=O)c4cnccc4C(=O)NN)CCC3)cc2)n(C)n1	1787374548	VQPNIMOXXTWHIU-UHFFFAOYSA-N	447.499	1.789	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)c1nc2ccccc2[nH]1	1787837857	LBAAKEUPVYEUJA-LWWSYDQCSA-N	439.285	1.847	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnn4ccccc34)[C@H]2C1	1787850960	KLBPMDSDJAQPJY-DNUAJFIVSA-N	449.349	1.959	50	20	IDGD	
C[C@@H](Nc1cnccn1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21	1788626208	MASXMYHOFVHUTJ-QPSCCSFWSA-N	440.342	1.042	50	20	IDGD	
CC(C)n1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCBr)C[C@@H]32)n1	1789368371	LGESWZHUIKBQGK-DZKIICNBSA-N	427.343	1.842	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ncc(Cl)cn3)C[C@@H]21	1789869214	YYMLHUJEYPCBBI-HTWFXAOOSA-N	435.739	1.960	50	20	IDGD	
C[C@H](Nc1nccs1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]2C1	1789922999	PWBDJTQZQBSYTI-PJSNJIKXSA-N	449.346	1.614	50	20	IDGD	
Cc1c(C(=O)Nc2ccc(C3(NC(=O)[C@H](O)CCl)CCC3)cc2)cn2[nH]cnc(=O)c12	1790011615	NVAGIBBPLONSHC-MRXNPFEDSA-N	443.891	1.678	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(NC(C)=O)c3)[C@H]2C1	1792008686	JTNMEDMHQKJIOZ-KANFNMMFSA-N	437.924	1.492	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=N/O[C@H]1CCCCO1)C2	1792870282	BECAOWXPMHYXPQ-ZTOXMCBWSA-N	446.342	1.136	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CC(=O)N(C2CCCC2)C1	1793775392	GKBRQTZSVASSEU-IMDBMMJGSA-N	439.984	1.775	50	20	IDGD	
COc1cccc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCBr)C3)n1	1794013442	AKZPGSBWAZCZMI-HBCWATKFSA-N	440.338	1.397	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccc(Br)cn1	1794157534	USFDHGRRVFHAMK-DJZPMSPPSA-N	444.757	1.994	50	20	IDGD	
CC(C)Cc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)Br)C3)n(C)n1	1796018392	XPTUNXHYMKBUAP-ZJOBFFGXSA-N	441.370	1.605	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CCC[C@H]2CCCC[C@H]21	1797266120	REOPKSMCSHLAJO-PEBBSFMPSA-N	448.608	1.556	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1CN(C(=O)OC(C)(C)C)C1	1797716048	KESYTJHOMNRSQU-QKPAOTATSA-N	429.945	1.745	50	20	IDGD	
C[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](O)CCl)C2	1797925555	JFAFRINMVHEXEA-CVWVJMLGSA-N	443.972	1.727	50	20	IDGD	
Cc1c[nH]c(C)c1CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnccc1C(=O)NN	1798439676	WBTYTWUGZUXYNS-BJWYYQGGSA-N	438.532	1.515	50	20	IDGD	
COc1cc(C#N)cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Br)C3)c1	1798578914	MVNFWXUYRTYDNT-XRGAULLZSA-N	440.269	1.461	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(-c2cnccn2)c1	1798588739	ISRWRCWWQUPGLK-DMUMMCEESA-N	444.919	1.601	50	20	IDGD	
CC(C)c1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)on1	1799450941	QLNWFFRIOUPMQG-BTTYYORXSA-N	426.477	1.362	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccn3c(C)cc(C)nc13)C2	1800979545	OVGOOWLKFDGICT-MVJTYMMSSA-N	434.924	1.408	50	20	IDGD	
Cc1cc(C)n(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)Br)C3)n1	1801247837	BIDCFQQHOCCGJG-MPTYRVRUSA-N	427.343	1.263	50	20	IDGD	
Cc1cc(NC(=O)CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](C)Br)no1	1801961066	DWZQNNGEEIELNP-RVMXOQNASA-N	427.299	1.733	50	20	IDGD	
COc1ccc(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)cc1F	1803208191	FPNPWKFIZDDUDT-REPLKXPHSA-N	440.280	1.009	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)[C@H](O)N2CCOCC2)[C@H]1c1cccnc1	1803691290	BMAAKIIJSVDTMB-JPLJXNOCSA-N	438.956	1.146	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](O)CCl)C3)CC1	1804589004	YYRXJXYYLXAQPH-YVSFHVDLSA-N	443.972	1.871	50	20	IDGD	
Cc1ccc(C(=O)NC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)nc1	1805874097	YVKLLXSJJZGMTA-PGRDOPGGSA-N	438.532	1.478	50	20	IDGD	
O=C(O)CSCC(=O)N1CC[C@@H](CNC(=O)CCBr)[C@@H]1c1cccnc1	1806347399	WUFAAFIRIDYONA-GUYCJALGSA-N	444.351	1.690	50	20	IDGD	
O=C(O)c1cc(C(=O)N2CCCC3(CCN(C(=O)CCBr)CC3)C2)ncn1	1807567774	QAVXHJPRWPZCEZ-UHFFFAOYSA-N	439.310	1.805	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)CCN2CCN(C)CC2)[C@@H]1c1cccnc1	1808260580	WZSOBWBFOIRKNN-SVFBPWRDSA-N	436.000	1.742	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1	1809969693	MQNBZEXVLJCSCH-IBGZPJMESA-N	441.164	1.448	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@H]1CCN(C(=O)c2cc(O)nc(O)n2)[C@H]1c1cccnc1	1810542444	RMUZZXDEODYGKH-KDOFPFPSSA-N	445.552	1.454	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC2(CCCN(C(=O)[C@@H](N)Cc3cscn3)C2)CC1	1810795110	ONJRRPCUTUJIQN-CVEARBPZSA-N	428.986	1.498	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2nc3ncccn3n2)[C@@H]1c1cccnc1	1813030389	IVMGAIUUWXXDRQ-HRCADAONSA-N	443.895	1.093	50	20	IDGD	
C[C@]1(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)CC=CCC1	1813579536	OFNCUJHVPSMOIV-HOKHCIIBSA-N	447.344	1.827	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2ccc(C(N)=O)cc2)[C@@H]1c1cccnc1	1813739026	CJCRVVJHPFNHJU-FHWLQOOXSA-N	444.919	1.754	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)C2(C#N)CCC2)[C@@H]1c1cccnc1	1814056395	BPDZRKSIJUJQIB-PXNSSMCTSA-N	426.521	1.154	50	20	IDGD	
C[C@H](CBr)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H]2C[C@H](O)CN2)[nH]n1	1814784378	WVEJCGVRFZZSAA-UVLXDEKHSA-N	428.331	1.156	50	20	IDGD	
Cc1onc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)c1C	1815450705	LBAUTRXPLCJIGE-QGZVFWFLSA-N	437.265	1.314	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc3n(n2)CCNC3=O)n[nH]1	1816625802	IHPIJLNOTCRGMW-SMDDNHRTSA-N	433.900	1.673	50	20	IDGD	
Cc1onc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)c1C	1817469631	BJPZCJAKRHETIS-KRWDZBQOSA-N	437.265	1.314	50	20	IDGD	
COCCn1ccc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@@H](Cl)COC)CC3)n1	1817618089	KFSSACUFLUSYMX-NEPJUHHUSA-N	441.941	1.466	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC[C@H]1c1cc(NC(=O)C2=NNC(=O)C2)n[nH]1	1819338571	RMZAKSHHMVKCQZ-CABZTGNLSA-N	425.287	1.309	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H]2C[C@@H]2C2CC2)[nH]n1	1819401678	NOBBSRINFJUCCU-VKJFTORMSA-N	437.504	1.760	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)CO[Si](C)(C)C)sc2C1	1820168686	JOWCOCXTPFEETN-LBPRGKRZSA-N	441.630	1.280	50	20	IDGD	
COC[C@H](NC(C)=O)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](F)Br)n[nH]1	1820935340	KQQQPYYAHRLAQT-OBJOEFQTSA-N	448.293	1.243	50	20	IDGD	
O=C(Cn1cccc([N+](=O)[O-])c1=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](F)Cl)[nH]n1	1821736968	HMUUNDXEBIYZOJ-NHYWBVRUSA-N	440.819	1.706	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1	1823013769	JEKBVKCWIUBFMA-MATHAZKKSA-N	428.711	1.999	50	20	IDGD	
C=CCNC(=O)/C=C\C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](Cl)COC)sc2C1	1825990898	GHJQYGKHZQHWNG-UXFRKABBSA-N	426.926	1.167	50	20	IDGD	
CCc1cc(C(=O)N[C@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)n[nH]1	1826085320	MSFJXUOCZWORHN-LBPRGKRZSA-N	433.538	1.027	50	20	IDGD	
CC(=O)C(C)(C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827049073	JLDHYXPWKVNZSN-FQEVSTJZSA-N	428.338	1.215	50	20	IDGD	
O=C(/C=C/c1cccnc1)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827049993	CMYXKZULKKCCFI-ZWPAVUJESA-N	447.344	1.708	50	20	IDGD	
Cc1cc(C)nc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)c1	1827054785	JTWJFZNWCBYMKB-QHCPKHFHSA-N	449.360	1.925	50	20	IDGD	
Cn1cc(F)cc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1	1827943278	IWWZEOQKAFEFDJ-FQEVSTJZSA-N	441.312	1.391	50	20	IDGD	
CC(C)[C@@H](S)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1	1828923552	LRQFUZLLMUCASO-RBUKOAKNSA-N	447.605	1.873	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(Cl)cnc3O)CCO2)C1	1829564273	MTODDLAVBRCGFT-KSSFIOAISA-N	432.304	1.528	50	20	IDGD	
Cn1ncc2cc(C(=O)N3CCOC[C@]4(C3)CN(C(=O)C(C)(C)CCl)CCO4)ccc21	1830362119	LSRZQFPXGLKPHP-QFIPXVFZSA-N	448.951	1.908	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)ccn1	1830539145	CMRBHGUSAJRBLU-KUHUBIRLSA-N	440.338	1.491	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cn3nnc4ccccc43)C2)C1	1831640356	LMUMAWJFZSFWEG-KKSFZXQISA-N	449.939	1.295	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4nonc4c3)C2)C1	1831645627	CTGCDBONIWQUTL-QRWLVFNGSA-N	436.896	1.700	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(O)cn2)CC1	1831872037	LQDPKEFISFHKBI-LJQANCHMSA-N	431.537	1.394	50	20	IDGD	
Cc1cc(CC(=O)N2CCC([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)n[nH]1	1831873757	WIFRQSHOFDVQII-IBGZPJMESA-N	432.569	1.253	50	20	IDGD	
Cc1ncccc1CCC(=O)N1CCO[C@@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1	1832636711	KAXOFHWIDHPCED-QFIPXVFZSA-N	449.624	1.631	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@H]3CCC(=O)NC3)CC2)CC1	1833117847	BTDVCCCDKNGDOG-MAUKXSAKSA-N	426.989	1.492	50	20	IDGD	
COc1nccnc1C(=O)N1CCC(N2CCC(NC(=O)C(C)(C)CCl)CC2)CC1	1833212026	HAPHXZMCEUJNFR-UHFFFAOYSA-N	437.972	1.935	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)CCc3ccsc3)CC2)CC1)[C@@H](O)CCl	1833310718	QGVZTJIBPJKQKT-SFHVURJKSA-N	427.998	1.852	50	20	IDGD	
Cc1ncc(C(=O)N2CCC(N3CCC(NC(=O)CCBr)CC3)CC2)[nH]1	1834422526	SWUUHANULNIIQC-UHFFFAOYSA-N	426.359	1.688	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccc(Cl)cc3)CCO2)C1	1835062282	GNUGOTWFIWNTOQ-YLJYHZDGSA-N	445.343	1.593	50	20	IDGD	
CC(C)c1nc(CC(=O)N2CCC(N3CCC(NC(=O)[C@@H](F)Cl)CC3)CC2)no1	1835078513	KAPFQCWGLDAKJU-QGZVFWFLSA-N	429.924	1.842	50	20	IDGD	
Cc1ccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)CCBr)C3)C2)cc1	1835081252	DBRYFAQTNMPCAU-HXUWFJFHSA-N	439.350	1.779	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)CC3CCOCC3)CCO2)C1	1835422706	ACRKSHZXKNGPRF-MOPGFXCFSA-N	437.364	1.496	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC1CCN(C2CCN(C(=O)C3CCC(O)CC3)CC2)CC1	1835837438	HJQSHMMFZHSUNU-UHFFFAOYSA-N	439.673	1.961	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC(OC2CCN(C(=O)C(=O)C3CC3)CC2)CC1	1836670023	KPABUGQOKYPJTP-ZDUSSCGKSA-N	429.355	1.995	50	20	IDGD	
O=C1NCc2cc(C(=O)N3CCC(OC4CCN(C(=O)[C@H](O)CCl)CC4)CC3)ccc21	1836717331	UDWKXELCGCJBGN-LJQANCHMSA-N	449.935	1.142	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc4ncnn4c3)CCO2)C1	1837164642	LMYSNKNOXURTAE-OXJNMPFZSA-N	435.912	1.207	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)C/N=C/c3ccco3)CCO2)C1	1837559895	JSDDZUCPGAEORK-HNNRIZOBSA-N	425.913	1.562	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cc[nH]c4nccc3-4)C2)C1	1837711971	YEQSFFGWRIXQJY-OAQYLSRUSA-N	446.580	1.436	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(Cl)nn3)C2)C1	1837715326	KHRSJDHAZZTQDK-SFHVURJKSA-N	442.976	1.052	50	20	IDGD	
CCc1nc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](Br)CC)C3)C2)co1	1838138362	UKJIUWBFULNCTA-FZKQIMNGSA-N	444.326	1.481	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1c(F)cccc1F)CCO2	1838863025	BNHFMRVWNAUXRM-FQEVSTJZSA-N	442.535	1.886	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](NC(C)=O)C(C)(C)C)C2)C1	1839141707	QJZHIXJFJJBESK-YRNRMSPPSA-N	431.961	1.011	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1	1839153655	NKNJTLSUDJMWOF-IAGOWNOFSA-N	441.428	1.531	50	20	IDGD	
CN1CCC[C@H](C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)C1	1839154284	JEHSDCJYCKDNPH-SNRMKQJTSA-N	436.380	1.021	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)cn1	1839197972	OEPYNZWVZFKRHV-PBHICJAKSA-N	430.274	1.151	50	20	IDGD	
CC(C)n1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)n1	1839201984	PMVOZRIOCWWRJV-WMLDXEAASA-N	447.305	1.225	50	20	IDGD	
C=CCC(F)(F)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H](C)Br)CCO2)C1	1840035375	PFWAMNXTUQELTG-DOMZBBRYSA-N	425.270	1.438	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1C[C@H]3CC[C@@H]1O3)CCO2	1840051424	ZSZLGMGOAWXCDF-GMKVZWAMSA-N	445.354	1.184	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)C(C)(F)F)C2)C1	1840150066	FBMNUVQMQRTGRP-SCLBCKFNSA-N	426.888	1.378	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(OC)cc3F)C2)C1	1840154679	CMWHRYCCQPNRAI-JXFKEZNVSA-N	444.887	1.158	50	20	IDGD	
COc1ccc(Cl)c(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)c1	1840653551	GHNLUYBWHJSHIS-MAUKXSAKSA-N	435.279	1.953	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)c2cc3ccc(Cl)cc3[nH]2)C1	1841000811	IUDPLJDVCZLWRD-UHFFFAOYSA-N	437.692	1.632	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC12CN(C(=O)[C@@H]1ON=C(c3ccccc3)O1)C2	1841288032	VGAFOZPMMWFOAX-ACJLOTCBSA-N	436.306	1.956	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)c2cc3sccc3s2)C1	1844032732	IDZVUMWETQBFAR-UHFFFAOYSA-N	426.328	1.773	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)Cc1cc(F)ccc1Cl)C2	1844263571	RQSRJYAOLJVHJN-UHFFFAOYSA-N	445.882	1.537	50	20	IDGD	
CO[C@H](C)[C@@H](C(=O)N1CCCC12CN(C(=O)[C@H](F)Cl)C2)N(C)C(=O)OC(C)(C)C	1845092354	PRNYGPKKJIUWQU-RDBSUJKOSA-N	435.924	1.995	50	20	IDGD	
O=C(CCCC[C@H]1CCSS1)NCCOCCOCCOCCOCCO	2332239863	SBWLDAYVUHENHK-KRWDZBQOSA-N	425.613	1.875	50	20	IDGD	
C=CCNS(=O)(=O)c1cccc(C(=O)NNc2nc3ccccc3c(=O)n2CC)c1	11163991	CNSPDKRFDKSYEJ-UHFFFAOYSA-N	427.486	1.638	50	20	IDGD	
CCOc1ccc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)C3=COCCO3)cc2)cc1	15737431	FAGVLIMAKRJTTN-UHFFFAOYSA-N	447.469	1.535	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cccc(CN3C(=O)CNC3=O)c2)ccc1OC(C)C	27238747	FPESGLRAUHQXRG-UHFFFAOYSA-N	440.456	1.609	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)c2cc(Br)c[nH]2)cc1NC(C)=O	28808836	MJKMJYZFYSJFHU-UHFFFAOYSA-N	431.268	1.368	50	20	IDGD	
O=C(NNC(=O)c1cccc2c1OCCO2)c1ccc(S(=O)(=O)N2CCCC2)cc1	60142535	VROJVDZCDDJPOP-UHFFFAOYSA-N	431.470	1.317	50	20	IDGD	
Cc1ccccc1C1(CNC(=O)NNC(=O)CNC(=O)c2cccs2)CCOCC1	725873910	UUYCLDKLIWBOIO-UHFFFAOYSA-N	430.530	1.865	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NN(C)C(=S)NCCCOC)ccc1C	726075507	IZOHPFKHAKITER-UHFFFAOYSA-N	430.596	1.513	50	20	IDGD	
NS(=O)(=O)c1ccc(CNC(=S)NNC(=O)Cc2ccc3ccccc3c2)cc1	726466147	FHIKTXRLMLRPNB-UHFFFAOYSA-N	428.539	1.725	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)NCC(=O)N(C)CCc2ccccn2)c1C	727608000	KASOZQWYCVDTTF-KRWDZBQOSA-N	427.505	1.497	50	20	IDGD	
O=C(Cn1ncc2ccc([N+](=O)[O-])cc21)NNc1ccc(S(=O)(=O)NC2CC2)cc1	728210197	XWQVIZCRULLJGK-UHFFFAOYSA-N	430.446	1.529	50	20	IDGD	
Cc1oc(-c2cccs2)nc1C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	728327479	BEVJDZJITTZTQH-AWEZNQCLSA-N	443.437	1.856	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1ccc(N2CCCC2)c([N+](=O)[O-])c1	728844702	BBJOYAISAAADJK-UHFFFAOYSA-N	439.476	1.663	50	20	IDGD	
CC(=O)N1C=Cc2ccccc2[C@@H]1CC(=O)NNC(=O)C1CCN(c2ncccn2)CC1	728847460	GLKUZEVKCWQPAM-FQEVSTJZSA-N	434.500	1.805	50	20	IDGD	
CC(C)(CNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)c1ccc2c(c1)OCO2	728952498	VDNPUGVTSGLSNI-UHFFFAOYSA-N	440.504	1.730	50	20	IDGD	
N#Cc1ccc(CS(=O)(=O)CC(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)cc1	728972966	WQKVVYVAQZHBRJ-UHFFFAOYSA-N	443.453	1.613	50	20	IDGD	
CCN(C)C(=O)c1cccc(C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c1	729124091	KMAZPWVZYFEXTE-UHFFFAOYSA-N	428.401	1.305	50	20	IDGD	
CS(=O)(=O)c1ccc(Br)c(C(=O)NNC(=O)CCc2ccccc2O)c1	730032958	PABFDTCFWAGVHM-UHFFFAOYSA-N	441.303	1.952	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)c1nnc(O)c2ccccc12)N1CCN(c2ccc(F)cc2)CC1	732257049	CVVXCAYIVIFVIL-AWEZNQCLSA-N	438.463	1.446	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCCCC(=O)NNc2ccccc2S(C)(=O)=O)cc1C	732303744	JIEJWWNMQLFIJL-UHFFFAOYSA-N	439.559	1.909	50	20	IDGD	
O=C(NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)o1)c1cnn(-c2ccccc2)c1	733108582	SDSWXIJRZDEBQC-UHFFFAOYSA-N	429.458	1.325	50	20	IDGD	
CCn1c(CCC(=O)NNc2cc(C)ncn2)nc2cc(S(=O)(=O)N(C)C)ccc21	734255381	ACSWUMPZIBWWOO-UHFFFAOYSA-N	431.522	1.481	50	20	IDGD	
COc1ccc([C@H]2[C@@H](C(=O)NNC(=O)c3nnc(O)c4ccccc34)CCC(=O)N2C)cc1	734417001	GPMATRJSVZEYCT-PXNSSMCTSA-N	449.467	1.715	50	20	IDGD	
O=C(NNc1ncc(C(F)(F)F)cc1Cl)N[C@H]1CCN(CCN2CCOCC2)C1	734685791	HQWPTPUOFNCOQP-ZDUSSCGKSA-N	436.866	1.786	50	20	IDGD	
COc1ccc(S(=O)(=O)C[C@@H](C)C(=O)NNC(=O)COc2ccc(C#N)cc2)cc1	735028643	MZBSTHJXGYNAEY-CQSZACIVSA-N	431.470	1.203	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)[C@@H](NC(=O)C12CC3CC(CC(C3)C1)C2)C(C)C	740851244	WBWHAFKYYYXJFE-NGOBRMJYSA-N	434.581	1.796	50	20	IDGD	
C[C@@H](CC(=O)NNC(=O)Cn1ccc2ccccc21)/N=C1/NS(=O)(=O)c2ccccc21	742643087	RKJHGOFWSCKKDP-AWEZNQCLSA-N	439.497	1.306	50	20	IDGD	
CCc1ccc([C@@H](COC)NC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)o1	743635749	WDKYNELYQXNVMX-CQSZACIVSA-N	437.522	1.775	50	20	IDGD	
CCCS(=O)(=O)Nc1ccc(C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)cc1	744942997	BOPSRVLZYMWGDB-UHFFFAOYSA-N	444.469	1.328	50	20	IDGD	
CC[C@H](C)NC(=O)c1cccc(CNC(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)c1	745503265	JZVVNFUDLCIOSE-LBPRGKRZSA-N	429.433	1.973	50	20	IDGD	
C[C@@H]1C[C@@H](NC(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)CCN1C	745856241	BWMONCFWSXRLDA-UZLBHIALSA-N	448.531	1.815	50	20	IDGD	
O=C(COC(=O)CSc1ccc(F)c(F)c1)NNC(=O)[C@H]1COc2ccccc2O1	746197790	KUHJCOSDMQXWKE-MRXNPFEDSA-N	438.408	1.588	50	20	IDGD	
COc1cccc(C(=O)NNS(=O)(=O)c2ccc([N+](=O)[O-])cc2C(F)(F)F)c1O	746591075	IPWGFRCBXYJULV-UHFFFAOYSA-N	435.336	1.951	50	20	IDGD	
COc1cc(C)nc(NNC(=O)c2cccc(S(=O)(=O)N3C[C@H](C)O[C@@H](C)C3)c2)n1	746622983	IBCOXWJMKGQQMH-KBPBESRZSA-N	435.506	1.348	50	20	IDGD	
C[C@H](CCNC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)N(C)Cc1ccccc1	746772706	BIBVKUOVYKKCOH-MRXNPFEDSA-N	436.516	1.788	50	20	IDGD	
COc1ccccc1C(=O)N[C@@H](CCS(C)(=O)=O)C(=O)NNc1cccc(C#N)c1	748037401	IQWRSFBCNKOUPO-KRWDZBQOSA-N	430.486	1.243	50	20	IDGD	
Cc1sc2nc(CS[C@@H](C)C(=O)NNC(=O)C(=O)N3CCCC3)nc(O)c2c1C	748247856	WFGQNQWOWZASIV-NSHDSACASA-N	437.547	1.405	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)NNC(=O)c2ccc(F)cc2Br)o1	748639285	DHCUTNUUAIMMSP-UHFFFAOYSA-N	435.227	1.981	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2OCCc3ccccc32)c1	749889195	VPYONUHTWGTXQW-LJQANCHMSA-N	431.514	1.792	50	20	IDGD	
COc1ccc([C@@H]2CCN(C(=O)NNC(=O)c3csc(N4CCOCC4)n3)C2)cc1	749919055	YQONABYNLGXNSI-OAHLLOKOSA-N	431.518	1.832	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(CC(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)C1	750510268	MHAKQNHVPLPYQS-UHFFFAOYSA-N	425.869	1.901	50	20	IDGD	
C[C@H]1C[C@H](NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)CCN1Cc1ccccc1	751097044	BBELASOEGMSVKL-FUHWJXTLSA-N	448.527	1.931	50	20	IDGD	
CC[C@H](C)C(=O)N1Cc2ccccc2C[C@@H]1C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	751295090	KRNNRBLAZPEKCA-MGPUTAFESA-N	447.499	1.423	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@](C)(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)C1	751886985	BDHKDYFHYUDRKK-JOCHJYFZSA-N	446.552	1.878	50	20	IDGD	
Cn1c(NNC(=O)CNC(=O)c2cccc(Br)c2)nc2ccccc2c1=O	752907950	PPOOFYOCBQKCCI-UHFFFAOYSA-N	430.262	1.569	50	20	IDGD	
O=C(CCCC(=O)c1ccc(Cl)c(Cl)c1)NNC(=O)N[C@@H]1CCS(=O)(=O)C1	753959062	RUMDOGVQGGVTAF-LLVKDONJSA-N	436.317	1.864	50	20	IDGD	
CCc1nnc(O)c(CNC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)c1CC	754652716	GNSYLZAMZHPNBS-UHFFFAOYSA-N	449.537	1.053	50	20	IDGD	
COCCOCCS(=O)(=O)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1	754748402	BWPWWUWLEMGGMH-NRFANRHFSA-N	447.557	1.227	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)NNC(=O)c2ccc(OCCC(C)C)c(OC)c2)co1	755414627	CSHORCKHHUIVOI-UHFFFAOYSA-N	439.490	1.696	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1cccc(NC(=O)c2cccs2)c1	755601672	IWXPMPPIEZRJMU-SNVBAGLBSA-N	425.492	1.091	50	20	IDGD	
COC(=O)[C@@H]1Cc2ccccc2CN1CC(=O)NNC(=O)c1ccc(OC)c(OC)c1	755863778	LMHPBOSJYHDLCC-KRWDZBQOSA-N	427.457	1.065	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)Nc1cccc(Cn2nc3ccccn3c2=O)c1	755937428	INWVWQMPFQLBDB-UHFFFAOYSA-N	446.423	1.740	50	20	IDGD	
CCc1c(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)cnn1CCC(C)C	756155740	SOQYCFDGXWWAHV-UHFFFAOYSA-N	439.314	1.982	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1ccc(NC(=O)c2ccco2)c(Cl)c1	756159598	CDBRMLOIBYVJOB-SECBINFHSA-N	443.869	1.276	50	20	IDGD	
COC(=O)c1ccc(NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1Cl	756649347	PASXPZIASVCUTM-UHFFFAOYSA-N	425.850	1.997	50	20	IDGD	
O=C(COc1ccccc1Cc1ccccc1)NNC(=O)NCC1CCS(=O)(=O)CC1	756754240	OXLBAGVFYNSMOJ-UHFFFAOYSA-N	445.541	1.811	50	20	IDGD	
C[C@H]1CN(C(=O)Cn2cc(NC(=O)NNC(=O)Cc3ccc(Cl)cc3)cn2)C[C@@H](C)O1	756836390	AAUNXCSUCBEWPU-OKILXGFUSA-N	448.911	1.568	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)Nc2ccccc2OCC(=O)N2CCOCC2)cc1	756875230	UOAUCFUNMDGQRJ-UHFFFAOYSA-N	442.472	1.464	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)NCc2cc(C)ncn2)cc1	757207822	IXZSWAXWGZOEGV-YVLHZVERSA-N	445.483	1.756	50	20	IDGD	
Cc1c(C#N)cccc1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	757733795	YSTGMIXJZGAWQC-UHFFFAOYSA-N	443.485	1.354	50	20	IDGD	
Cc1ccn(-c2ccc(C(=O)N3CCN(S(=O)(=O)CBr)CC3)cc2)n1	758518024	NTVZKKFLPXGUHL-UHFFFAOYSA-N	427.324	1.621	50	20	IDGD	
CCOc1cc2c(cc1[C@@H]1C[C@@H]1NC(=O)NNC(=O)C(=O)Nc1ccccn1)O[C@@H](C)C2	758753474	QKMJMDMJHGSCTG-NOLJZWGESA-N	439.472	1.629	50	20	IDGD	
CN(NC(=O)[C@@H]1CC(=O)Nc2cc(F)ccc21)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758785189	CBXCASOHHLYWEZ-OAHLLOKOSA-N	449.483	1.887	50	20	IDGD	
CS(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1Cl	759294647	ZABWDHTXZFNRSB-UHFFFAOYSA-N	439.877	1.659	50	20	IDGD	
Cc1cc(O)cc(=O)n1CC(=O)NNc1nc2ccccc2c(=O)n1CCCOC(C)C	759790687	OWXWBIZCUVVAOL-UHFFFAOYSA-N	441.488	1.531	50	20	IDGD	
COC(=O)C12CCC(C(=O)NNC(=O)c3ccc(S(=O)(=O)N4CCCC4)cc3)(CC1)C2	760068082	ZJBDZZVSKCBXCS-UHFFFAOYSA-N	449.529	1.356	50	20	IDGD	
CCOC(=O)[C@@H]1CCC(=NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)[C@H](C)C1	761267768	UJIMUFQPIXACRU-IEBWSBKVSA-N	428.533	1.916	50	20	IDGD	
Cc1cc(C(=O)O)cc(S(=O)(=O)NNC(=O)NCc2ccco2)c1Br	762471493	FXWXDEINUPHXRN-UHFFFAOYSA-N	432.252	1.741	50	20	IDGD	
O=C(NCCc1ccncc1)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	762667568	YMVPJVWCSFFRJB-UHFFFAOYSA-N	431.518	1.443	50	20	IDGD	
CCS(=O)(=O)c1ccc(Cl)c(C(=O)NNc2nccc(N3CCOCC3)n2)c1	762851130	BCVKBDWMXRDQEK-UHFFFAOYSA-N	425.898	1.517	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)COc2ccccc2Br)c2ccccc2c1=O	763285866	ZUZDOHKABZDLAR-UHFFFAOYSA-N	431.246	1.536	50	20	IDGD	
CCN1CCc2ccc(NC(=O)C(=O)NNC(=O)c3cc(OC)c(OC)c(OC)c3)cc21	763540051	PYPTUXFDCOXDDL-UHFFFAOYSA-N	442.472	1.495	50	20	IDGD	
COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NNC(=O)c1cc(OC)c(OC)c(OC)c1	763540369	UGMLMKIAUDKJIW-UHFFFAOYSA-N	448.388	1.029	50	20	IDGD	
CN(C)C(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)ccc1Cl	763550384	FCCFVEXBIKUGRZ-UHFFFAOYSA-N	432.820	1.170	50	20	IDGD	
Cc1ccc(NC(=O)C(C)C)cc1NC(=O)C(=O)NNC(=O)c1ccc2c(c1)OCO2	763550896	IQOYZMIXRCYYOB-UHFFFAOYSA-N	426.429	1.718	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)ccc1Br	763569394	AAAZAJMEIJJLHA-HNNXBMFYSA-N	434.246	1.683	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)C(=O)Nc2cc(C(N)=O)ccc2C)c1	763597266	MJNVNECIZXDRLF-UHFFFAOYSA-N	426.473	1.691	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(C)c(Br)c2)cc1	763662163	VDVZAJLHDOODAJ-UHFFFAOYSA-N	436.262	1.931	50	20	IDGD	
COc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NNC(=O)COc1cc(C)ccc1C	763665997	SJTNCJAWUMHPEL-UHFFFAOYSA-N	442.472	1.179	50	20	IDGD	
COc1cc(OC)cc(OCCNC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)c1	763674381	SQNZRWWXQPHWNY-UHFFFAOYSA-N	441.444	1.618	50	20	IDGD	
NC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccco3)nc3ccccc23)c1	763763567	LJBBBQIMSYAKJZ-UHFFFAOYSA-N	443.419	1.993	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3cc4c(s3)CCC4)cn2)C[C@H](C)O1	763781351	JRQBDOSCLPMVDN-STQMWFEESA-N	443.529	1.645	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)C(=O)Nc2ccc3ccn(C)c3c2)c2ccccc2c1=O	763790868	OZWYEQHYMNGXJC-UHFFFAOYSA-N	446.467	1.869	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2nnc(O)c3ccccc23)cc1OCC(F)F	763791898	YMPYJZBJIUKACR-UHFFFAOYSA-N	445.382	1.687	50	20	IDGD	
CCOc1cc(Cl)ccc1NC(=O)C(=O)NNC(=O)COc1ccccc1[N+](=O)[O-]	763802871	ICKSMPHCXBKYJE-UHFFFAOYSA-N	436.808	1.812	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(Br)c(F)c1	763812144	DHUOWRCXZJKQJB-UHFFFAOYSA-N	435.209	1.625	50	20	IDGD	
COC(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)c1	763851006	SJJBQFCSJAYADZ-JTQLQIEISA-N	437.811	1.819	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)cc1S(C)(=O)=O	763873546	VNWNBONHPVUGAK-GFCCVEGCSA-N	437.449	1.091	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2cc(Cl)ccc2C(=O)N2CCCC2)n1	763882879	XHUVVAYVWPAHDQ-UHFFFAOYSA-N	446.895	1.175	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3ccc(Cn4cncn4)cc3)cc2C1	763940305	FCQAYWUJXKKYNV-ZDUSSCGKSA-N	438.513	1.912	50	20	IDGD	
COC(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CC[C@H](C)C3)cc1	763941111	VWDRIONAVIAREO-LBPRGKRZSA-N	429.498	1.988	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)on1)C(=O)Nc1ccccc1CN1CCOCC1	764003717	LPAOQURWAMQGCO-UHFFFAOYSA-N	449.467	1.574	50	20	IDGD	
CC(C)OCCCn1c(NNC(=O)[C@H]2CN3CCCN2CC3)nc2ccccc2c1=O	764162363	PQZLRGOSXLTGOA-LJQANCHMSA-N	428.537	1.045	50	20	IDGD	
C[C@H]1COCCN1c1ccc(NC(=O)C(=O)NNC(=O)c2cccc3ncccc23)cc1	764252474	GHHAFLIZQDHDAX-HNNXBMFYSA-N	433.468	1.860	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cccc3ncccc23)cc1S(C)(=O)=O	764258098	UZJCRDJKSMAZFB-UHFFFAOYSA-N	426.454	1.346	50	20	IDGD	
CCOc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NNC(=O)CCc1ccccc1O	764289904	ZIPDODUBLXZIPT-UHFFFAOYSA-N	442.472	1.211	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)C(=O)Nc1ccc(I)cc1	764318852	JBWTYYSWMXAVQB-UHFFFAOYSA-N	441.200	1.759	50	20	IDGD	
CCn1nc(C)c(NC(=O)C(=O)NNC(=O)c2ccc(OC)c(Br)c2)c1C	764327011	SUBVIHMUHZKCBP-UHFFFAOYSA-N	438.282	1.691	50	20	IDGD	
CN(Cc1cccc(NC(=O)C(=O)NNC(=O)Cc2ccncc2)c1)Cc1cscn1	764353483	IGYOTBXEIBLJJR-UHFFFAOYSA-N	438.513	1.499	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)ccc1Cl	764382625	NMVYXWODWCZNIA-UHFFFAOYSA-N	447.860	1.978	50	20	IDGD	
Cc1ccc(S(C)(=O)=O)cc1NC(=O)C(=O)NNC(=O)c1cc(-c2cccs2)[nH]n1	764382634	NSPDUALBEHLPEE-UHFFFAOYSA-N	447.498	1.250	50	20	IDGD	
CCNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(C)c(C)c3)[nH]n2)c1	764388522	SMWFELLICKIPBJ-UHFFFAOYSA-N	448.483	1.843	50	20	IDGD	
CCNC(=O)c1ccc(C)c(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)c1	764394218	PWBNHOSPHYTOEZ-UHFFFAOYSA-N	430.486	1.329	50	20	IDGD	
CC(C)C[C@H](NC(=O)OCc1ccccc1)C(=O)N([C@H]1CCS(=O)(=O)C1)N(C)C	768127269	PARMAGYKRGKVNY-ROUUACIJSA-N	425.551	1.820	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2cc(C3CC3)nn2-c2ncccn2)cc1	768239315	JNXYTKPGDAPAHR-UHFFFAOYSA-N	449.471	1.267	50	20	IDGD	
O=C(Cn1cnc2ccc(Br)cc2c1=O)NNC(=S)Nc1ccccn1	768581487	QVJXNGKQZFFZGK-UHFFFAOYSA-N	433.291	1.572	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1	768612440	MXWPDQJMHKTREF-UHFFFAOYSA-N	431.430	1.950	50	20	IDGD	
Cc1cnn(Cc2ccccc2F)c1NC(=O)C(=O)NNC(=O)c1ccc2c(c1)OCO2	769250836	BHIPDUQSQOZEKE-UHFFFAOYSA-N	439.403	1.507	50	20	IDGD	
CNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cc(-c3ccc(C)c(C)c3)[nH]n2)cn1	770243899	FOWZJCCHNTZDTA-UHFFFAOYSA-N	428.474	1.071	50	20	IDGD	
C[C@H](CBr)COC(=O)[C@@H](NS(=O)(=O)c1ccc(Cl)cc1)[C@@H](C)O	770304771	KZNSOUNPUJGNGW-BREBYQMCSA-N	428.732	1.942	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)NCc3cccc(NC(=O)c4ccncc4)c3)nc21	770350720	OEBATQGXHNRMOR-UHFFFAOYSA-N	433.432	1.543	50	20	IDGD	
COc1ccc(N(CCC(=O)NN(C)C(N)=O)S(=O)(=O)c2ccc(C)cc2C)cc1	770436387	LBACROJXCUAOSF-UHFFFAOYSA-N	434.518	1.939	50	20	IDGD	
CCNS(=O)(=O)c1cccc(C(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)c1	770965447	BXSQVOWCJDAWIK-UHFFFAOYSA-N	433.494	1.342	50	20	IDGD	
Cc1cc(C=NNC(=O)C(=O)NCc2ccc(Cl)cc2)c(C)n1CCN1CCOCC1	771560361	GCLBKHNVLIDOSN-UHFFFAOYSA-N	445.951	1.857	50	20	IDGD	
N#Cc1ccc(S(=O)(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)cc1Cl	771609261	YVOOEIBGPJRJIH-UHFFFAOYSA-N	427.269	1.491	50	20	IDGD	
O=C(CCc1nnc(-c2ccsc2)o1)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772195742	PLKACGPWAHADIB-UHFFFAOYSA-N	433.877	1.848	50	20	IDGD	
COc1cc2c(cc1CNC(=O)NNC(=O)C1CCN(c3ncccn3)CC1)O[C@@H](C)C2	773003368	CDFVTDBKHPVQCP-AWEZNQCLSA-N	440.504	1.556	50	20	IDGD	
CC(C)[C@]1(C)C[C@H]1C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	773771261	REBBWLMQNUOJKW-RXVVDRJESA-N	437.562	1.470	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)C(=O)N(C)CC2	774009351	OGBIQJIZIBUNNI-LBPRGKRZSA-N	444.875	1.522	50	20	IDGD	
CCCn1nc(C(=O)NNS(=O)(=O)c2cc(C#N)ccc2Cl)c2ccccc2c1=O	775252436	KZYZRBRXKVNIRB-UHFFFAOYSA-N	445.888	1.955	50	20	IDGD	
CCC(CC)n1nc(C)cc1C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	776232042	OKXWPNLOYARSOC-UHFFFAOYSA-N	449.581	1.641	50	20	IDGD	
C[C@H]1OC(C)(C)N(C(=O)OC(C)(C)C)[C@@H]1C(=O)OCC(=O)NNC(=O)c1ccccc1	776477902	LGJGPUKWZDWZQM-CJNGLKHVSA-N	435.477	1.751	50	20	IDGD	
CC[C@@H](C)C(=O)N1Cc2ccccc2C[C@H]1C(=O)NNC(=O)CNC(=O)OC(C)(C)C	778441017	HMTKQQYAHLQHDM-PBHICJAKSA-N	432.521	1.658	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](NC(=O)NNC(=O)CNC(=O)c2cccs2)CC1	780682508	RXFHREQNHSPUIF-ZDUSSCGKSA-N	439.538	1.598	50	20	IDGD	
CC(C)(C)[C@@H](Br)C(=O)Nc1cccc(S(=O)(=O)N2CCNC(=O)C2)c1	781076916	WUIQXJOLCRHHCD-AWEZNQCLSA-N	432.340	1.555	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2cccc(C)c2F)c1	781557520	FCLPYCYBRHHTGQ-UHFFFAOYSA-N	443.522	1.788	50	20	IDGD	
CC(=NNC(=O)c1sc(N2CCOCC2)nc1C)c1ccc(N2CCNC2=O)cc1	782159570	SFRJGBHFZILZIN-UHFFFAOYSA-N	428.518	1.972	50	20	IDGD	
O=C(NCC1CC1)NNS(=O)(=O)c1cc(C(=O)O)c(Cl)cc1Br	782461960	GVTFCUVNKXJFCK-UHFFFAOYSA-N	426.676	1.703	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCc2cn(C)nc2-c2ccccc2)c2ccccc2c1=O	782755462	ZDJJSAKAJWLGGO-UHFFFAOYSA-N	445.483	1.961	50	20	IDGD	
CNC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2Cl)cc1	782927665	WACMEYQQICHPJG-UHFFFAOYSA-N	439.255	1.518	50	20	IDGD	
CC(=O)N[C@@H](CC(C)C)C(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	783568602	ZHAZOBNVXXSIDI-FQEVSTJZSA-N	449.515	1.700	50	20	IDGD	
Cc1cc2c(cc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)NC3CC3)cc1)OCO2	784210723	ZSEQTLRFCRKUIQ-UHFFFAOYSA-N	432.458	1.246	50	20	IDGD	
CC(C)(C)n1cc(C#N)c(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)n1	784218155	ZXZDCCGOIFFINJ-UHFFFAOYSA-N	445.505	1.032	50	20	IDGD	
N#Cc1ccc(NNC(=O)C(=O)Nc2ccc3c(c2)S(=O)(=O)CC3)cc1C(F)(F)F	784239423	BTZCUWDIAIXSKU-UHFFFAOYSA-N	438.387	1.989	50	20	IDGD	
C[C@@H]1CN(c2ccc(NC(=O)C(=O)NNc3ccc(C(F)(F)F)nn3)cn2)C[C@@H](C)O1	784891430	OYVAFFFBQZFUDG-GHMZBOCLSA-N	439.398	1.586	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)c3cc([C@H]4CCN(C(=O)OC(C)(C)C)C4)[nH]n3)nc21	787358835	KUSQDXVBKZDABB-JTQLQIEISA-N	443.468	1.273	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2cc([C@@H]3CCCO3)nn2C)c2ccccc2c1=O	788724033	CFBDDZSILOVJEU-HNNXBMFYSA-N	425.449	1.468	50	20	IDGD	
O=C(NC[C@H](Cc1cccc(F)c1)C(=O)N1CCOCC1)NNC(=O)c1ccccc1F	789310466	OBADKDLCKMKSKS-INIZCTEOSA-N	446.454	1.627	50	20	IDGD	
Cc1cnc(O)n1-c1ccccc1NC(=O)C(=O)NNC(=O)[C@H]1OCC[C@H]1c1ccccc1	789811138	VKYCKWAJEZYCJV-LPHOPBHVSA-N	449.467	1.545	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)NCc2cccc(N3C(=O)N[C@](C)(C4CC4)C3=O)c2)o1	790893160	FNYROHUPZVMXQK-OAQYLSRUSA-N	425.445	1.957	50	20	IDGD	
O=C(NNc1cccc(F)c1[N+](=O)[O-])C(=O)Nc1cccc(Cn2cccnc2=O)c1	790998465	NPZKFQCDQFMARU-UHFFFAOYSA-N	426.364	1.421	50	20	IDGD	
C[C@H](C(=O)NNc1nc2ccccn2n1)N1C(=O)c2ccc(Br)cc2C1=O	791243791	RJMOPEWUOWBEJA-SECBINFHSA-N	429.234	1.620	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)[C@H](CC(C)C)/N=C2/NS(=O)(=O)c3ccccc32)n1	794079834	CTXYFSDTWCPYEJ-INIZCTEOSA-N	429.502	1.304	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NN=Cc1ccc(OC(F)(F)F)c(Br)c1	794508122	LASLVZSFRMLKLS-ZETCQYMHSA-N	432.218	1.736	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)N[C@H]1COc2cc(F)c(Br)cc21	800052896	MMVVXUFLIQCBAZ-NSHDSACASA-N	447.261	1.877	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)N[C@@H]3COc4cc(F)c(Br)cc43)nc21	800745930	JIMMHLMIZATOLF-SNVBAGLBSA-N	438.217	1.730	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)N[C@@H](Cn2ccccc2=O)c2ccccc2)cc1	800764092	YJEIRDKRMDNHMX-FQEVSTJZSA-N	431.452	1.871	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2ccc(OC(F)F)cc2F)c1	802566627	YLBDGWPNTPRXJT-UHFFFAOYSA-N	427.335	1.844	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)NCCNS(=O)(=O)c2cccc(Cl)c2Cl)n1	805405602	LWWXPTKCXUGAOH-UHFFFAOYSA-N	446.316	1.619	50	20	IDGD	
COCCNC(=O)c1cccc(NC(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)c1	806629517	LDIZDSFYCJRMCI-UHFFFAOYSA-N	446.460	1.555	50	20	IDGD	
Cc1c(C(F)(F)F)nn(C)c1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccc(F)cc1	806975419	YEZZTGVONIJHIE-SECBINFHSA-N	431.346	1.440	50	20	IDGD	
COc1ccc([C@@H](CNC(=O)NNC(=O)COc2cccc(C)c2)N2CCOCC2)cc1	806998492	KPWFOILTZILJDC-OAQYLSRUSA-N	442.516	1.786	50	20	IDGD	
C[S@](=O)Cc1ccc(CNC(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)cc1	807558208	UVWGQZWMVKQIQD-PMERELPUSA-N	431.522	1.992	50	20	IDGD	
O=C(NC[C@@H]1CCCSC1)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	807597483	JQMDGPBKLCPOJZ-HNNXBMFYSA-N	440.591	1.948	50	20	IDGD	
Cn1ccnc(NNC(=O)C(=O)Nc2cnn(-c3ccc(F)cc3)c2C(F)(F)F)c1=O	810398009	FKMBGOTZXMPZFQ-UHFFFAOYSA-N	439.329	1.206	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)c2cc3c(=O)n4ccccc4nc3n2C)cc1	812728097	GZDAELKVLSWIEU-UHFFFAOYSA-N	440.485	1.193	50	20	IDGD	
CC(C)CNC(=O)N1CCC[C@@H](CC(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)C1	812732964	WPJSSHKTKCFBCO-INIZCTEOSA-N	439.582	1.848	50	20	IDGD	
Cc1nc(O)nc(O)c1CCC(=O)NNC(=O)COc1ccc(Br)cc1	813467392	GEDBWGHUISLTOS-UHFFFAOYSA-N	425.239	1.118	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCc2nncn2C1)C(=O)Nc1ccccc1COc1ccccc1	815691884	DQACXLPICJBWAL-HNNXBMFYSA-N	434.456	1.206	50	20	IDGD	
Cc1nnc(NNC(=O)c2cccc(NS(=O)(=O)c3ccc(F)c(F)c3)c2)nc1O	817280345	CUMSLQRCIKUSES-UHFFFAOYSA-N	436.400	1.722	50	20	IDGD	
Cc1cc(C)c(OCC(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c(C)c1	824090553	AUBUROUHIYHEIR-SFHVURJKSA-N	428.441	1.521	50	20	IDGD	
CC(C)C[C@H](C(=O)NNC(=O)c1cccc(N(C)C)c1)N1C(=O)[C@H]2CC=CC[C@@H]2C1=O	904225104	VDDMSBKFRPOXFP-GBESFXJTSA-N	426.517	1.880	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCc3sccc3C2)c1)c1cccnc1	913465861	BOBFAOHHDOCMCT-UHFFFAOYSA-N	442.522	1.965	50	20	IDGD	
CCN(Cc1ccc(OC)c(OC)c1)C(=O)NNC(=O)c1csc(N2CCOCC2)n1	913628065	RQTCLBDEVQHWLX-UHFFFAOYSA-N	449.533	1.873	50	20	IDGD	
Cc1cc(C=NNC(=O)COc2ccccc2[N+](=O)[O-])c(C)n1CCN1CCOCC1	915948972	YDRMANLVZIMOLT-UHFFFAOYSA-N	429.477	1.874	50	20	IDGD	
CNS(=O)(=O)Cc1ccc(CNC(=O)NNC(=O)[C@H](C)Oc2ccccc2F)cc1	916229145	RTOHOTWNWIMBQP-ZDUSSCGKSA-N	438.481	1.173	50	20	IDGD	
CC(=O)Nc1cccc([C@@H](C)NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1	916380056	AITLDLXQYLTPGQ-CYBMUJFWSA-N	447.517	1.601	50	20	IDGD	
CNC(=O)CN1CCC(NC(=O)NNC(=O)c2ccc(-n3c(C)ccc3C)cc2)CC1	916517201	YGYBHSJHUUJFOA-UHFFFAOYSA-N	426.521	1.249	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CCNS(=O)(=O)/C=C\c2ccccc2)cc1C	916562106	LKWACWJESGOTNP-QBFSEMIESA-N	444.513	1.370	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(S(C)(=O)=O)c([N+](=O)[O-])c2)cc1C	916562623	VXSXSCUCHXNWGZ-UHFFFAOYSA-N	434.430	1.015	50	20	IDGD	
O=C(COC(=O)c1cc(Cl)c2c(c1)OCO2)NNC(=O)[C@@H]1COc2ccccc2O1	917241756	CUJOJPNFGRLPFI-HNNXBMFYSA-N	434.788	1.213	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc(Br)ccc1[N+](=O)[O-])c1cccc([N+](=O)[O-])c1	917713545	KTPZQZTZWPXCPV-UHFFFAOYSA-N	445.207	1.889	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc(Br)ccc1[N+](=O)[O-])c1ccc2c(c1)OCO2	917717467	ICRABANVEFFXOH-UHFFFAOYSA-N	444.219	1.709	50	20	IDGD	
COc1ccc(C(=O)CCCC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1	917909035	MRVPSSDXWATATJ-UHFFFAOYSA-N	447.513	1.760	50	20	IDGD	
Cc1[nH]c(-c2ccncc2)nc(=O)c1CC(=O)NNC(=O)[C@@H](C)Oc1ccccc1F	917919006	LNEKSLUWCJLBSQ-CYBMUJFWSA-N	425.420	1.437	50	20	IDGD	
O=C(NCc1cccc(S(=O)(=O)NCc2cccc(F)c2)c1)NNC(=O)c1ccc[nH]1	918099084	SQZKJZAGLDCMMD-UHFFFAOYSA-N	445.476	1.777	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NCc2nc(C3CC3)no2)c2ccccc2c1=O	918232993	AQNXXVKQPOJEDZ-UHFFFAOYSA-N	425.449	1.601	50	20	IDGD	
Cc1oc(C(=O)NNC(=O)c2ccc(Cl)cc2O)cc1S(=O)(=O)N1CCCC1	918362718	VMWTUSZZPYNCMK-UHFFFAOYSA-N	427.866	1.806	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)c2cc([N+](=O)[O-])cc(S(C)(=O)=O)c2)c1C	920288243	PLJZWHSAGTVJTJ-ZDUSSCGKSA-N	435.458	1.844	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)c1ccc([S@@](C)=O)cc1	1116382643	BRBJBVBKSLOHPO-IDPPAEMMSA-N	427.486	1.376	50	20	IDGD	
CC(C)(C)C(=O)N1CCC(NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)CC1	1118385143	RJMXJKQVMJWXDQ-UHFFFAOYSA-N	431.541	1.061	50	20	IDGD	
O=C(c1cnnc2ccccc12)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1777728521	YDMZBXLEWCZJNQ-CRAIPNDOSA-N	437.269	1.764	50	20	IDGD	
Cn1c(=O)n(CC(=O)N2CC[C@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)c2ccccc21	1778161097	CAFAQYOTKWRVHU-QFIPXVFZSA-N	448.951	1.435	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)[C@@H]3CCC[C@H]4CCCC[C@@H]43)C2)C1	1778299015	NJHFVHOZYJEKIJ-ZBNTXBBCSA-N	448.608	1.796	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)C#CC3(O)CCCCC3)C2)C1	1779066622	BPSSQWSHWXEVGW-OXJNMPFZSA-N	441.366	1.688	50	20	IDGD	
Cn1cc(C(=O)N2CCO[C@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)c2cccnc21	1779296750	CPEGBWILKTYWNK-NRFANRHFSA-N	430.581	1.868	50	20	IDGD	
CN(C)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@](C)(Cl)CCl)C2)C1	1781228437	OOWJWDGODOBLNS-OALUTQOASA-N	429.348	1.827	50	20	IDGD	
O=C(c1cnnc2ccccc12)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781330189	SROYLMQKILNWGC-YJBOKZPZSA-N	437.269	1.764	50	20	IDGD	
Cc1nnsc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)Br)C1	1781999148	RFVYAAQMZXRPAM-NSODJVPESA-N	431.356	1.757	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H]1CC[C@H](O)CC1)C2	1782001130	AMFHTACLEPHLOW-DINLJIAVSA-N	431.371	1.835	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3n[nH]c4ccc(C#N)cc34)C2)C1	1782198883	XRGAUIGRVAEHNJ-HXPMCKFVSA-N	446.305	1.661	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)Cn3nc(C)cc3C)CCO2)C1	1783344097	MZUVKAWHRCALBO-YJBOKZPZSA-N	427.343	1.503	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(OC)nc3)CCO2)C1	1783344473	TVHWMEVJIAZGKX-KBXCAEBGSA-N	426.311	1.707	50	20	IDGD	
COc1cnc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](C)Br)C3)C2)c(F)c1	1783532661	QTSSXLJZQXGEHV-APPDUMDISA-N	430.274	1.456	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cc4n(n3)CCCC4)CCO2)C1	1783534711	YDXIPHBROLAHBE-SCLBCKFNSA-N	425.327	1.446	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cn(C)c4ncccc34)CCO2)C1	1783534714	YFNFEMYREQZLDA-BFUOFWGJSA-N	435.322	1.800	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1CCc3ccccc3[C@@H]1O)CCO2	1783870521	CSWPBVXDYMNELM-GHDARCQNSA-N	436.936	1.366	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)COc3ccc(Cl)c(F)c3)CCO2)C1	1783871784	VNKAZACHCFFBKS-HNAYVOBHSA-N	449.306	1.942	50	20	IDGD	
O=C1Nc2c(cccc2C(=O)N2CCO[C@@]3(CCN(C(=O)C(Cl)Cl)C3)C2)C1=O	1783946384	MFDRUOMFRSMVGH-GOSISDBHSA-N	426.256	1.069	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccn4c(O)nnc34)C[C@@H]21	1784618907	RTUXXSCIZMNVME-HNKHHVNMSA-N	435.912	1.436	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CNC(=O)c3cccs3)[C@H]2C1	1785336652	NUBVYMIDWUDJGG-AJNGGQMLSA-N	427.954	1.475	50	20	IDGD	
CCC[C@@H](Cl)C(=O)Nc1ccc(C2(NC(=O)c3cc(=O)n4[nH]nnc4n3)CCC2)cc1	1786443300	GTTHPAMASSKUTR-CQSZACIVSA-N	443.895	1.968	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CC(=O)N(C4CCCC4)C3)C[C@@H]21)[C@@H](F)Cl	1787444402	ZNPUBRSCICJMAG-RXXJBJGQSA-N	429.920	1.292	50	20	IDGD	
Cc1cccc(C)c1NC(=O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]2C1	1787449786	XNSISSDSGGRLJL-QBYUYEEZSA-N	425.888	1.756	50	20	IDGD	
CN(C)C(=O)c1cccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]3C2)c1	1787451440	QBKILVTXQAMIIV-LUKYLMHMSA-N	425.888	1.516	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(C)c([N+](=O)[O-])cn3)[C@H]2C1	1787640797	HFFAXUZTWBELGF-WSMBLCCSSA-N	440.884	1.145	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)COc3ccc(F)cc3)C[C@@H]21)[C@@H](F)Br	1789922118	CPQYVOFNCXMUOO-JIRONKKISA-N	447.276	1.875	50	20	IDGD	
CN(C)c1cncc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]3C2)c1	1789922901	XMAYGFCIOYZHDP-DDWPSWQVSA-N	443.317	1.431	50	20	IDGD	
Cc1nc2ccc(F)cn2c1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21	1790380954	FSGKOEKXYAZWEO-MJFSBKNWSA-N	426.851	1.910	50	20	IDGD	
CCOC(CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](Br)CC)[C@H]2C1)OCC	1790963993	QTRINMODNOMGAH-JONQDZQNSA-N	449.386	1.929	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)[C@H]1CCc2nc[nH]c2C1	1791530197	HPKPLEAMJIKWTM-PVIIJVKYSA-N	443.317	1.185	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COc1ccccc1)C2	1792867787	KWKYKRHWKCAWAW-ZXFNITATSA-N	425.323	1.686	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c[nH]nc3c1)C2	1792868214	RGEHVKWEURVQPE-FIUQPQMISA-N	435.322	1.797	50	20	IDGD	
Cc1cc(C)n(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)CBr)C3)n1	1794117788	GNAKQGSWLBTYJL-RMIITELYSA-N	427.343	1.121	50	20	IDGD	
Cc1cnc2c(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)CCBr)cnn2c1	1795115836	MYNGIPMRMNZPHC-YWVIFJGQSA-N	436.310	1.026	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc2nc[nH]c12	1796142188	VQJVIHVRWJLHLD-JFILPPLUSA-N	435.322	1.797	50	20	IDGD	
CC(C)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ncn(-c2ccccc2)n1	1796538857	BJHSCNIQINDGIS-SCAQPMJSSA-N	431.924	1.736	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccn2c(O)nnc12	1796727972	MFSPVFZAPUZOFX-OPDFLTKYSA-N	436.310	1.860	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1cc2cccnc2[nH]1	1797459711	SYEXOIIDPMIRSK-XCCSTKFXSA-N	425.258	1.457	50	20	IDGD	
Cn1ncc2cc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)c3cnccc3C(=O)NN)C4)ccc21	1797627611	HCIKKIMSQAEGPR-BJWYYQGGSA-N	447.499	1.137	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc3ccc(F)cn13)C2	1797957274	JRMRSVFUDKKKLL-HBCWATKFSA-N	434.544	1.528	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nc3ccccc3n(C)c1=O)C2	1799267894	HPQUHAPWTUGQER-UMPJEAMMSA-N	432.908	1.154	50	20	IDGD	
CC(C)N1CCC(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Br)CC1	1799344929	XZFAISIMUAAQQK-QKPAOTATSA-N	434.350	1.387	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2)c1cc2cccnc2nc1O	1799922345	LIEDZEFYTJSKBM-PTEHBNRSSA-N	425.272	1.342	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)[S@](=O)c1ccccc1	1800213880	AEFGTNVEVNIQOM-WDTOCKOWSA-N	442.965	1.026	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(S(C)(=O)=O)ccc1F	1800848995	PUIARWFMTWITDM-OQMKEHIESA-N	446.928	1.735	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(N3CCOCC3)c1)C2)C(Cl)Cl	1801017370	SBEZDUDUJWDSJC-SCAQPMJSSA-N	442.343	1.530	50	20	IDGD	
Cc1cccn2ncc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)c3cnccc3C(=O)NN)C4)c12	1801151678	OZUCVJOIMUJQOP-MUJYYYPQSA-N	447.499	1.207	50	20	IDGD	
COc1cc(C)ccc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2	1801707335	MIBXZJIMMBIRAL-NOXHYTERSA-N	429.286	1.897	50	20	IDGD	
CC[C@@H](NC(C)=O)C(=O)NC[C@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1	1802879777	IQKDSNQHSSNKDD-NUJGCVRESA-N	439.354	1.787	50	20	IDGD	
O=C(Cc1ncccn1)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@H]1c1cccnc1	1804694172	HBSWOLSBEAMYKM-JQFCIGGWSA-N	436.285	1.811	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC2(CCCN(C(=O)COC3CCCCC3)C2)CC1	1805272800	WRNATTHSQXIZFP-UHFFFAOYSA-N	436.597	1.940	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)c3cccc4c[nH]nc34)CC2)C1	1809978447	TXIHIHYQKBSPPQ-UHFFFAOYSA-N	446.316	1.401	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)C23CC(F)(C2)C3)[C@H]1c1cccnc1	1813068134	IVKHYUXAFJWIGJ-CEHZJVLFSA-N	431.512	1.353	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H]3CCC(=O)N3)sc2C1	1814040079	BINAQLJPWUNRPC-KKZNHRDASA-N	429.340	1.365	50	20	IDGD	
C[C@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)CCN3CCOCC3)sc2C1	1814648168	CGKHYMZXSPGRKU-RYUDHWBXSA-N	445.383	1.561	50	20	IDGD	
N#Cc1ccccc1OCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](O)CCl)n[nH]1	1814875507	BCCLKJCVFWGFOS-HZPDHXFCSA-N	431.880	1.952	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cn[nH]c2)n[nH]1	1818232277	ASEFJKIFULPTFI-YEEYNWEUSA-N	437.464	1.573	50	20	IDGD	
CCc1cc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)no1	1819891203	ZDDRNWVIJCYQEW-INIZCTEOSA-N	431.497	1.639	50	20	IDGD	
CC(C)O[C@H](C)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCC(=O)NN(C)C)CC2	1820015238	FXMSKGQVTJQRDU-CHWSQXEVSA-N	425.555	1.242	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](F)Br)CC2	1820148868	XBKKUOGGSLIFHT-DNSOKLHBSA-N	433.303	1.436	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCc2ccc[nH]2)[nH]n1	1822413952	JHLOYFMTXNMIIJ-KRWDZBQOSA-N	429.525	1.736	50	20	IDGD	
CO[C@@H](C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[nH]n1	1822450311	OPIZYLSPDKQTEE-IZYKNMJJSA-N	429.481	1.571	50	20	IDGD	
C=CCO[C@H](C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1	1824507247	KCPFUVCYWYAZGD-OXQOHEQNSA-N	443.548	1.510	50	20	IDGD	
Cc1nc(CC(=O)N[C@@H]2CCc3nc(NC(=O)[C@H](C)Br)sc3C2)no1	1825637010	PLSHKLIIKQVCSZ-IONNQARKSA-N	428.312	1.773	50	20	IDGD	
C=C[C@@H](O)C(C)(C)C(=O)N[C@@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1	1826087505	FXYAGJITTNTOSH-IUODEOHRSA-N	437.566	1.001	50	20	IDGD	
Cc1cccc(CC(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)n1	1827049050	HQUZMLODMMBFDY-QHCPKHFHSA-N	449.360	1.546	50	20	IDGD	
CC(C)(C)[C@H](O)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827055506	AHMTZEIAFHIFJQ-VQTJNVASSA-N	430.354	1.007	50	20	IDGD	
O=C(CN1C(=O)CSC1=S)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](F)Cl)CC2	1828244594	KXYSQHXXGBWUPG-KSBSHMNSSA-N	436.943	1.450	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnc(O)nc2O)CC1	1829101813	COLHXPQQOWVKJA-INIZCTEOSA-N	436.585	1.973	50	20	IDGD	
CCc1cc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)nn1C	1829478655	FAEPAWHWFRCLJC-HXUWFJFHSA-N	446.596	1.589	50	20	IDGD	
Cc1cccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)CCBr)C3)C2)n1	1830917224	JWMGSUGZIZYNTL-IBGZPJMESA-N	440.338	1.174	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3CC[C@@H](C(=O)OC)C3)C2)C1	1831638633	FKXLCNTXIQMOHJ-DLRJPAPCSA-N	444.956	1.440	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)c3ccco3)CC2)CC1	1833089621	JPEKCHBVKCHSTL-DYVFJYSZSA-N	442.354	1.668	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cnnc(Cl)c1)CCO2	1833209262	AWGSVTWSXSZVHA-SFHVURJKSA-N	442.976	1.052	50	20	IDGD	
COC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)[C@H](C)CBr)CC2)CC1	1833262237	KWYRMPNIQRZNOZ-CQSZACIVSA-N	446.386	1.542	50	20	IDGD	
Cc1cc(CC(=O)NC2CCN(C3CCN(C(=O)C(Cl)Cl)CC3)CC2)nn1C	1833370115	XPOQOOXLJABAEZ-UHFFFAOYSA-N	430.380	1.646	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1)c1ccnnc1	1834141800	MXRPJGTUTDSHND-HNNXBMFYSA-N	428.306	1.352	50	20	IDGD	
Cc1noc(CC(=O)NC2CCN(C3CCN(C(=O)CCBr)CC3)CC2)n1	1834849831	GVKDGRFPROFUOX-UHFFFAOYSA-N	442.358	1.277	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cc(CO)on3)CC2)CC1	1836186563	BPSYCXOWBWHVFL-QGZVFWFLSA-N	426.945	1.760	50	20	IDGD	
Cc1cncc(CCC(=O)N2CCC(OC3CCN(C(=O)[C@H](O)CCl)CC3)CC2)c1	1836715763	YXFRAVZBYXIDHC-HXUWFJFHSA-N	437.968	1.921	50	20	IDGD	
COC(=O)NCC(=O)N1CCC(OC2CCN(C(=O)CCBr)CC2)CC1	1837654586	DVYPMFYFASOCQB-UHFFFAOYSA-N	434.331	1.126	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3c(C)n[nH]c3C)CCO2)C1	1837808801	XUMOXASTSWXOSH-KSSFIOAISA-N	443.342	1.270	50	20	IDGD	
CC(C)CNC(=O)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](C)Br)CC2)CC1	1838108404	PXYRQFGFGXOXTJ-CQSZACIVSA-N	446.386	1.541	50	20	IDGD	
COc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)cc(Cl)n1	1838230403	BGQOYYZFOZNDPX-RHSMWYFYSA-N	436.267	1.348	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)[C@H]3C[C@@H](O)C3)CC2)CC1	1838269246	MLGZYRZVZYHJDU-VBQJREDUSA-N	431.371	1.929	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnc4snnc4c3)CCO2)C1	1838510051	VOCGNUWVQUDXJW-UGSOOPFHSA-N	439.925	1.174	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cn(C(C)(C)C)nn3)CCO2)C1	1838757729	FEDUNOMUCCCJRJ-KUHUBIRLSA-N	427.933	1.121	50	20	IDGD	
C[C@H](C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2)c1ccccn1	1839156161	DEAXBADPFDRACP-RYGJVYDSSA-N	444.359	1.878	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(F)n3)C2)C1	1839965187	PWKRLFYLTKAZNA-SCLBCKFNSA-N	444.301	1.464	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)cnc1C	1840031475	RJWXLYPMZGNQEA-KUHUBIRLSA-N	440.338	1.552	50	20	IDGD	
Cc1nc(F)ccc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)Br)CCO2	1840034485	NHTURJDJBQOAOI-SGTLLEGYSA-N	444.301	1.383	50	20	IDGD	
O=C([C@@H](O)CCl)N1CCOC[C@@]2(C1)CN(C(=O)C1(c3ccccc3)CCC1)CCO2	1840113028	BSDGFMGKDWXSCO-GHTZIAJQSA-N	436.936	1.164	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)ncc1[N+](=O)[O-]	1840187539	IBAFBHIKYJAJBM-KRWDZBQOSA-N	447.275	1.172	50	20	IDGD	
O=C(c1ccc(CO)c(F)c1)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840190089	CVMCWGLHGZEIOS-GOSISDBHSA-N	435.279	1.192	50	20	IDGD	
O=C(Cc1ccc(C(F)(F)F)cc1)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843013556	WZLVLWYUNPNIRU-UHFFFAOYSA-N	446.234	1.445	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1cc3cccn3cn1)C2	1843415958	IBWCFYYUCKMQJP-MFKUBSTISA-N	433.472	1.285	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@H]2C[C@@H](F)CN2C(=O)OC(C)(C)C)C1	1843820288	MELLLJVYTIRBMX-ILXRZTDVSA-N	447.935	1.791	50	20	IDGD	
CO[C@H](C)[C@@H](C(=O)N1CCCC12CN(C(=O)[C@@H](O)CCl)C2)N(C)C(=O)OC(C)(C)C	1845091625	BBPWSCGHQTXSDO-ILXRZTDVSA-N	447.960	1.060	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@H]1C[C@@H](O)CN1C(=O)OC(C)(C)C)C2	1845167857	YAVDDTRRANHLGI-KFWWJZLASA-N	429.945	1.578	50	20	IDGD	
O=C([C@H](O)CCl)N1CC2(CCCN2C(=O)c2cn3ccc(C(F)(F)F)cc3n2)C1	1845574510	DLBWRZJHDIMPCL-CYBMUJFWSA-N	430.814	1.770	50	20	IDGD	
Cc1c(C(=O)N2CCCC23CN(C(=O)c2ccc(B(O)O)cc2)C3)cccc1C(F)(F)F	1846875616	KOKUMMGZNHEPNN-UHFFFAOYSA-N	446.234	1.824	50	20	IDGD	
CC[C@@H](C)[C@@H](O)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1847838647	WUWSBNHOGDFCFB-OLMNGRFOSA-N	431.961	1.727	50	20	IDGD	
CN1CCC[C@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C1	1848099984	WKOBRNHMCWDUCC-QAETUUGQSA-N	442.988	1.662	50	20	IDGD	
CCCC[C@H](NC1=NS(=O)(=O)c2ccccc21)C(=O)NNC(=O)Cc1ccc(F)cc1	14392861	RXIBLSXAIWZPID-KRWDZBQOSA-N	446.504	1.813	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1	17202980	RYRJWSHCXWAXRQ-UHFFFAOYSA-N	431.514	1.928	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)CN2C(=O)N[C@](C)(c3ccc(F)cc3)C2=O)c1	25449117	LMJGKWMCMZWAEC-OAQYLSRUSA-N	427.436	1.120	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)c2sccc2S(=O)(=O)N2CCCCC2)n1	25596047	GMDBHYAYVCDJNU-UHFFFAOYSA-N	425.536	1.197	50	20	IDGD	
COC(=O)c1c(C)[nH]c(C(=O)NNC(=O)c2ccc(CSc3nncn3C)cc2)c1C	27068719	WXTCQMYNJNGIBO-UHFFFAOYSA-N	442.501	1.914	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)CCc2nc(=O)c3c(C)c(C)sc3[nH]2)cc1	109074926	GVORAXKHFKQLQQ-UHFFFAOYSA-N	429.502	1.802	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)CNC(=O)c1cccs1)N1CCN(c2ccccc2)CC1	725874441	ZOOSQSBJMXNBIT-MRXNPFEDSA-N	444.561	1.019	50	20	IDGD	
CCN1CCN(c2ccc(F)cc2[C@H](C)NC(=O)NN[C@]2(C)CCS(=O)(=O)C2)CC1	726279676	QTWBUAQRVYHBLQ-MGPUTAFESA-N	441.573	1.410	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=S)NCc3ccc(S(N)(=O)=O)cc3)n[nH]2)cc1	726464027	FUSYQZYCEDRJCE-UHFFFAOYSA-N	444.542	1.342	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1nc(-c2ccccc2)n(-c2ccccc2)n1	728372196	KTYFMCFSSFJRNY-OAHLLOKOSA-N	425.470	1.130	50	20	IDGD	
COC(=O)c1ccc(COc2ccccc2C=NNC(=O)[C@@H](C)NS(C)(=O)=O)cc1	728436278	FCYNYTSKCJRACN-CQSZACIVSA-N	433.486	1.440	50	20	IDGD	
CCN(C)[C@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)c1ccccc1	728602956	LZQKPJVXTFVJNE-FQEVSTJZSA-N	444.557	1.925	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)N2CCN(C(=O)c3ccccc3OC(F)F)CC2)c1	728953127	MWSUJDVVNVFQCY-UHFFFAOYSA-N	443.410	1.972	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)N[C@H](C)[C@@H](C)N2CCOCC2)c2ccccc2c1=O	729624666	WMOYFYLMJNKYIM-HUUCEWRRSA-N	430.509	1.031	50	20	IDGD	
CCCn1nc(C(=O)NNS(=O)(=O)c2cc(F)c(F)cc2F)c2ccccc2c1=O	729836755	ODMSMGKNXDJZLK-UHFFFAOYSA-N	440.403	1.847	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@@H]2C(=O)NNC(=O)CCc2ccccc2O)c(OC)c1	730034101	RZHOMYKUEIHPMX-GOSISDBHSA-N	441.484	1.794	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)N1CCC([C@H](O)c2ccc(F)cc2)CC1	731043614	IGVZBMJLUFCRAL-GOSISDBHSA-N	434.493	1.803	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)N1CCN(CC(=O)N2C[C@@H](C)C[C@@H](C)C2)CC1	731501032	XSQKTXQPRYQURU-CALCHBBNSA-N	431.537	1.172	50	20	IDGD	
CS(=O)(=O)CCN1CCC(NC(=O)NNC(=O)CSc2ccc(Cl)cc2)CC1	731760856	DQDZBXIDHPOBCJ-UHFFFAOYSA-N	448.998	1.272	50	20	IDGD	
COCCNS(=O)(=O)c1cccc(C(=O)NNc2ccc(Br)nc2)c1	732834171	FANWTRRGKYBLDQ-UHFFFAOYSA-N	429.296	1.526	50	20	IDGD	
O=C(NCCNC(=O)c1c(F)cccc1F)NNC(=O)c1nn(-c2ccccc2)cc1O	732996727	LHYKNBVYMQABFH-UHFFFAOYSA-N	444.398	1.230	50	20	IDGD	
CCC1CCC2(CC1)NC(=O)N(CC(=O)NNC(=O)c1cnn(-c3ccccc3)c1)C2=O	733108907	XZCXABOGMHKFBU-UHFFFAOYSA-N	438.488	1.524	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCCc2ccc3c(c2)CCO3)cc1	734069504	PAPUGHDMMRCBRO-UHFFFAOYSA-N	446.529	1.124	50	20	IDGD	
Cc1ccc2nc(CSCC(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)cn2c1	734239707	AKDNUFHFXKLIPC-UHFFFAOYSA-N	436.538	1.731	50	20	IDGD	
C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C	734241866	WVVDZDJGZBSCIP-LLVKDONJSA-N	427.483	1.931	50	20	IDGD	
COc1ccc([C@@H]2[C@H](C(=O)NNC(=O)COc3ccc(F)cc3)CCC(=O)N2C)cc1	734418708	HEVZVBAOIJBXEV-WIYYLYMNSA-N	429.448	1.970	50	20	IDGD	
Cc1ccc(C)c(S(=O)(=O)Nc2cccc(C(=O)NNC(=O)c3cnn(C)c3)c2)c1	735473420	VPKZVKGDGIXEKU-UHFFFAOYSA-N	427.486	1.913	50	20	IDGD	
O=C(COC(=O)c1ccccc1OC1CCC1)NNC(=O)[C@H]1COc2ccccc2O1	735740748	QRYLDOLPCKODHO-LJQANCHMSA-N	426.425	1.762	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1cc(-n2cccn2)ccn1	736849078	WKMUYABBPZUBGY-UHFFFAOYSA-N	429.820	1.547	50	20	IDGD	
C[C@@H]1CCC[C@H](NC(=O)CN2CCN(C(=O)NNC(=O)COCc3ccccc3)CC2)C1	738497450	VUXMJQBRPYORBN-QUCCMNQESA-N	445.564	1.257	50	20	IDGD	
C#CCSCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	740488127	ZOEGEUULCALHRY-UHFFFAOYSA-N	446.554	1.476	50	20	IDGD	
CCS(=O)(=O)NCc1ccc(C(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)cc1	741662253	MIVCQULYPYLJAN-MRXNPFEDSA-N	433.530	1.971	50	20	IDGD	
O=C(CC12CC3CC(CC(C3)C1)C2)NNC(=O)[C@H]1CCCCN1C(=O)c1ccc(O)nn1	741742477	HGEUPHPSQZYDGY-FBXSJCODSA-N	441.532	1.931	50	20	IDGD	
O=C(NNc1ncnc2[nH]cnc12)c1cccc(S(=O)(=O)N2CCc3ccccc32)c1	743471265	XJAMBECBFXWSCX-UHFFFAOYSA-N	435.469	1.861	50	20	IDGD	
Cn1ccc(N2CCC[C@@H](NC(=O)NNC(=O)c3c(Cl)cccc3Cl)C2=O)n1	743585784	PUTSRMRETYWRJT-GFCCVEGCSA-N	425.276	1.867	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)CCn2cc(Br)cn2)cc1	743830387	TXODIJJYQYBKEU-UHFFFAOYSA-N	430.284	1.292	50	20	IDGD	
O=C(NCCN1CCN(Cc2ccccc2)CC1)NNC(=O)c1cc([N+](=O)[O-])ccc1O	745296277	CWZADPXHDZWVAE-UHFFFAOYSA-N	442.476	1.062	50	20	IDGD	
C[C@@H]1CN(c2ccc(CNC(=O)NNC(=O)c3cc([N+](=O)[O-])ccc3O)cn2)C[C@@H](C)O1	745469144	TWQVXTSNBMMNCF-CHWSQXEVSA-N	444.448	1.453	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(\C#N)C(=O)NCCNS(=O)(=O)c2cccnc2)c1C	746272684	VUGWXAZQRLSCHR-ZVCOJXFSSA-N	445.545	1.709	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=O)Cc2cn3ccccc3n2)c1	746553200	HNJVKPIVCUNQME-UHFFFAOYSA-N	435.893	1.242	50	20	IDGD	
CN1CCN([C@H](CNC(=O)NNC(=O)CCOc2ccccc2)c2cccs2)CC1	747298812	HMORBNJCWFCLIQ-GOSISDBHSA-N	431.562	1.836	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)NCCCNC(=O)c1cccc(Br)c1	747586414	YARRMFCNIKGAAI-UHFFFAOYSA-N	434.294	1.537	50	20	IDGD	
COC(=O)c1cc(C)c(C)c(S(=O)(=O)NNC(=O)c2nnc(-c3ccccc3)o2)c1	747609942	YHWIUGYNHLGBAX-UHFFFAOYSA-N	430.442	1.763	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1)NNC(=O)c1ccc[nH]1	747662389	MWCPYPLCEQVBSZ-UHFFFAOYSA-N	438.815	1.817	50	20	IDGD	
COc1cc(OC)cc(N2CC[C@@H](NC(=O)NNc3ccc(-n4cccn4)nn3)C2=O)c1	747954150	HZGJONUGCHSXQV-MRXNPFEDSA-N	438.448	1.111	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)Nc1nc(-c2ccc3c(c2)CCC(=O)N3)cs1	748661603	MNOMKVJWWTUVTJ-LLVKDONJSA-N	433.490	1.899	50	20	IDGD	
C[C@@H]1CC(C)(C)CC[C@H]1NC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	748967244	JHLOVDVRYXPNIX-NVXWUHKLSA-N	438.598	1.859	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@H]3CCCN3C3CCCC3)CC2)cc1	749258390	LFXYXXGBPJSLFU-JOCHJYFZSA-N	427.593	1.667	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)N[C@@H]1CCN(c2cccc(Cl)c2)C1=O	750670498	MBIZELOHBUKDDU-OAHLLOKOSA-N	430.848	1.861	50	20	IDGD	
Cn1cc(NS(=O)(=O)c2ccsc2C(=O)NNC(=O)Cc2ccc(F)cc2)cn1	750719373	VTMAMIHYWJJQMU-UHFFFAOYSA-N	437.478	1.425	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2ccc(OC(C)(C)C)cc2)CC1	751066072	AWQQNJRLOXFXNW-UHFFFAOYSA-N	447.561	1.952	50	20	IDGD	
C[C@H](NC(=S)NNC(=O)CCn1cnc2ccc(Br)cc2c1=O)C1CC1	751617663	KBHXITJHVZRXHU-JTQLQIEISA-N	438.351	1.843	50	20	IDGD	
O=C(NNC(=O)N1CC[C@H](OCCCc2ccccc2)C1)c1ccc(-n2cnnn2)cc1	752000121	QWMUIFHWHAWVHR-FQEVSTJZSA-N	435.488	1.740	50	20	IDGD	
CCOC(=O)c1ccc(N2CC(NC(=O)NNC(=O)COc3cc(C)ccc3C)C2)nc1	753278771	HAPYNQGLEAKUPY-UHFFFAOYSA-N	441.488	1.473	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)N[C@H]1CCCN(Cc2ccccn2)C1=O	753298129	JJLSZTUVBABHRC-HNNXBMFYSA-N	429.502	1.401	50	20	IDGD	
N#Cc1cc(Br)cc(S(=O)(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1	754261622	WMGVADMMNBSATH-OAHLLOKOSA-N	438.259	1.470	50	20	IDGD	
COc1c(S(=O)(=O)NNC(=O)c2cccn2C)cc(Br)c(C)c1[N+](=O)[O-]	755000023	BKSDRBNGFSBZTM-UHFFFAOYSA-N	447.267	1.636	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNS(=O)(=O)c1cccc(Cl)c1Br	755027832	XHSNSTPYLORSQL-UHFFFAOYSA-N	426.720	1.717	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)Cc2ccncc2)cc1S(=O)(=O)N1CCCCC1	755412848	HVLCTCHHIBFYBR-UHFFFAOYSA-N	447.517	1.660	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N(CC)CC)cc1NC(=O)NNC(=O)c1cnccn1	755441548	LGLLRBXFRNFFME-UHFFFAOYSA-N	436.494	1.372	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1ncc(Cc2cc(F)cc(F)c2)s1	755474294	CDSWNGRNMZFPQH-QMMMGPOBSA-N	433.462	1.103	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)Nc2ccc(CC(=O)N3CCOCC3)cc2)cc1C	755862827	VFIMWJYUMQVKRX-UHFFFAOYSA-N	440.500	1.936	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc(C)c1Br	756163858	JRGRTSOPKJLNSN-OAHLLOKOSA-N	448.273	1.992	50	20	IDGD	
COC(=O)c1cccc(NC(=O)C(=O)NNc2ccnc(N(C)C)n2)c1Br	756199360	RKFMAISXQWHYRE-UHFFFAOYSA-N	437.254	1.174	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1ccc(Oc2ccc(Cl)cc2)nc1	756228288	RBDKTWJITOASAG-JTQLQIEISA-N	427.870	1.618	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1)Nc1cc(-n2cnnn2)ccc1F	756335525	GFQNGWIISVBAJC-UHFFFAOYSA-N	425.359	1.797	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)Nc2ccc(C(N)=O)c(F)c2)c2ccccc2c1=O	756351451	LSJLAOJDAXBHOZ-UHFFFAOYSA-N	440.435	1.901	50	20	IDGD	
NC(=O)CCNC(=O)c1cccc(NC(=O)NNC(=O)Cc2ccc3ccccc3c2)c1	756390293	GTGLXJKNXUZWTO-UHFFFAOYSA-N	433.468	1.840	50	20	IDGD	
CS(=O)(=O)NCc1ccc(NC(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)cc1	756628744	XEWWJHXHKGKYPL-UHFFFAOYSA-N	428.474	1.592	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(NC(=O)NNC(=O)C(C)(C)c2ccccc2)cc1	756784343	MMXKBRUNCBVZJG-UHFFFAOYSA-N	434.518	1.742	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)CN(C)C(=O)OCc1ccccc1	756796895	JDUHKRMNXOAHHZ-UHFFFAOYSA-N	447.517	1.318	50	20	IDGD	
COC(=O)c1ccc(NC(=O)NNC(=O)c2c(C)nc3ccccn23)cc1C(=O)OC	756819927	YHBWPLPGSONWDQ-UHFFFAOYSA-N	425.401	1.682	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)Nc3cnn(CC(=O)N4CCOCC4)c3)cc2C1	756833852	BIVSJQUJOMQXHK-ZDUSSCGKSA-N	446.533	1.395	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)NCCCN(C1CC1)S(=O)(=O)c1cccc(F)c1	757048739	AMTIZOFARXYEEG-UHFFFAOYSA-N	449.508	1.337	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)N[C@H]1CCCN(c2ccccc2F)C1=O	761815696	GQKGYNIXICVLFE-AWEZNQCLSA-N	445.407	1.639	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)NC1CCN(C(=O)c2ccco2)CC1	763464689	BWUDZIGWEVHIEH-UHFFFAOYSA-N	437.497	1.520	50	20	IDGD	
CN(C)C(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2ccccc2Br)c1	763482123	CVPCLLWYWMLWCR-UHFFFAOYSA-N	433.262	1.551	50	20	IDGD	
C[C@@H](c1ccccc1)n1ccc(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)n1	763575601	YTNZKOZSSPMECF-KBXCAEBGSA-N	435.440	1.418	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1ccc(C(=O)NCC(C)C)cc1	763630239	YEABOVBVOCWUHF-UHFFFAOYSA-N	436.472	1.428	50	20	IDGD	
CO[C@H](C)C(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)COc2cccc(C)c2)c1	763631090	UTRAPIGPKIKLQX-CQSZACIVSA-N	428.445	1.133	50	20	IDGD	
CC1CCN(c2cccc(NC(=O)C(=O)NNC(=O)COc3ccc(C#N)cc3)c2)CC1	763678631	JEIDHGRYRGSRGM-UHFFFAOYSA-N	435.484	1.959	50	20	IDGD	
CC(C)(C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2F)cc1	763681669	PIPGLQPDNYULRZ-UHFFFAOYSA-N	430.436	1.519	50	20	IDGD	
CCOCCCNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2cccc(Cl)c2)c1	763750943	ULWMZNIZZXCGBT-UHFFFAOYSA-N	446.891	1.896	50	20	IDGD	
Cc1nc(C)n(-c2ccccc2NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)n1	763866304	VLDCRPSFDXAKML-GFCCVEGCSA-N	440.435	1.577	50	20	IDGD	
O=C(NNC(=O)c1cccc2ccccc12)C(=O)Nc1cccc(CN2C(=O)CNC2=O)c1	764058510	RIMUNOCAZZMTOD-UHFFFAOYSA-N	445.435	1.291	50	20	IDGD	
CC1CCN(S(=O)(=O)c2ccc(NC(=O)C(=O)NNC(=O)C3CCCC3)cc2)CC1	764068686	PFUSXAOXKNNFEO-UHFFFAOYSA-N	436.534	1.383	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(C)cc3)[nH]n2)c(F)c1	764110150	GFXMTRJCOIQTRN-UHFFFAOYSA-N	439.403	1.711	50	20	IDGD	
Cc1cc(Br)c(NC(=O)C(=O)NNC(=O)CC(F)(F)F)cc1[N+](=O)[O-]	764115140	OENDKXVVHGSFIX-UHFFFAOYSA-N	427.133	1.704	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2c(F)cccc2-n2cccn2)cc1	764125842	CCRJCJHPAYHAOY-UHFFFAOYSA-N	425.420	1.739	50	20	IDGD	
CC(C)n1nnnc1-c1ccccc1NC(=O)C(=O)NNC(=O)[C@@H]1Cc2ccccc2O1	764163047	HKMUKBGXFWAGKC-KRWDZBQOSA-N	435.444	1.011	50	20	IDGD	
CN(C)CC(=O)NNC(=O)C(=O)Nc1cc(C(=O)OC(C)(C)C)ccc1Br	764210768	HKENUGGCWMODJW-UHFFFAOYSA-N	443.298	1.052	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)Cc2cc[nH]n2)sc2c1CC[C@@H](CC)C2	764292651	FWWIOEKQZRAZHZ-LLVKDONJSA-N	447.517	1.491	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NN/C=C3/C(=O)NC(=O)c4ccccc43)n[nH]2)cc1OC	764415008	XRIQLUVQOFVUGM-RVDMUPIBSA-N	433.424	1.639	50	20	IDGD	
O=C(CO)NNC(=O)C(=O)Nc1cc(Br)ccc1Oc1ccc(Cl)cc1	764429748	XHBIGKGDWDPGCI-UHFFFAOYSA-N	442.653	1.973	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1ccccc1CN(C)C(=O)OC(C)(C)C	766261982	PBGQIHHFNLGIRU-UHFFFAOYSA-N	430.465	1.934	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@@H](c3ccccc3)n3cccn3)CC2)cc1	766639466	AEWQZMMRHNLEMI-XMMPIXPASA-N	446.555	1.746	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)o1	766652475	PVGJGWXTDFNQCI-UHFFFAOYSA-N	441.532	1.340	50	20	IDGD	
CCCOc1ccc(S(=O)(=O)N2CCN(S(=O)(=O)CBr)CC2)cc1	767850318	JFHPMGALQKJXPM-UHFFFAOYSA-N	441.369	1.464	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C1=NN(Cc2ccccc2)C(=O)CC1	768630389	RVUACXZSPSILTC-UHFFFAOYSA-N	430.486	1.720	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)c2ccc(COc3ccccc3)o2)cn1	770219311	HHBZFRCKVGOWFA-UHFFFAOYSA-N	444.469	1.579	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)N[C@@H]1CC(=O)N(c2c(F)cccc2F)C1	770753345	GIIOZKNPQCZUFM-SECBINFHSA-N	442.220	1.805	50	20	IDGD	
COc1ccccc1C(=O)N[C@@H](CCSC)C(=O)NNc1nc(O)c2cnn(C)c2n1	770974636	NNOSWVSCMYDMSB-ZDUSSCGKSA-N	445.505	1.072	50	20	IDGD	
CCCCNC(=O)NNC(=O)CN1C(=O)N[C@@](C)(c2ccc(Br)cc2)C1=O	771250657	LNTRZWHEODAZAR-KRWDZBQOSA-N	440.298	1.347	50	20	IDGD	
CCc1cc(NNC(=O)c2ccc(S(=O)(=O)N(C)C)nc2)nc(-c2ccccn2)n1	771736266	ZWHLXLHOIXCQFT-UHFFFAOYSA-N	427.490	1.503	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1cccc(S(=O)(=O)Nc2ccc(OC)cc2)c1	771882486	PRYNISFAFBESLT-ZDUSSCGKSA-N	449.485	1.599	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)NCCNS(=O)(=O)c2cc(C)sc2C)c1	771947725	OEQXFSYLFXHYRL-UHFFFAOYSA-N	440.547	1.361	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)[C@@H](NC(=O)c1ccc(OC)cc1)c1ccccc1	772074842	HGJJMZYTAOKOCU-KUHUBIRLSA-N	427.457	1.655	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)c1ccc(-n2ccnc2S)cc1	772906780	VWOIRWLUJWCRBY-UHFFFAOYSA-N	429.889	1.892	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)CCC(=O)Nc1ccc2nc(O)[nH]c2n1	772995933	PGVUQWGCVSIVNU-SNVBAGLBSA-N	446.851	1.651	50	20	IDGD	
Cc1ccc(-n2nccc2NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)nn1	773498707	CJIFKZWWJLXYRQ-OAHLLOKOSA-N	437.460	1.141	50	20	IDGD	
CN1CCN(C(=O)Cc2ccc(NC(=O)C(=O)NNc3cnc4ccccc4n3)cc2)CC1	773722866	NHMGDCVACVOMGF-UHFFFAOYSA-N	447.499	1.028	50	20	IDGD	
Cc1cc(S(N)(=O)=O)ccc1CNC(=O)NNC(=O)[C@@H](C)Oc1cccc(Cl)c1	775199525	AKFJPGBLYZRVSP-GFCCVEGCSA-N	440.909	1.594	50	20	IDGD	
O=C(CC12CC3CC(CC(C3)C1)C2)NNC(=O)N[C@H]1CCO[C@@]2(CCS(=O)(=O)C2)C1	776075843	HAGLQFIWTKIWJI-SEDMMGJHSA-N	439.578	1.660	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(C(=O)NNc2ccc([N+](=O)[O-])cc2Br)cn1	779146026	ANGYMVPCQZPRPG-UHFFFAOYSA-N	444.267	1.760	50	20	IDGD	
COc1ccc(C[C@@H](C)C(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1OC	781237323	TXGADQLZKIUCFC-CYBMUJFWSA-N	434.518	1.637	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)c2cc3nn[nH]c3cc2F)cc1	781894957	FZKHIFCGXPYAHF-UHFFFAOYSA-N	426.437	1.593	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2ccc(C)c(S(=O)(=O)NC3CC3)c2C)nc(C)n1	783324337	HVGMMLHCKNTHTA-UHFFFAOYSA-N	432.506	1.233	50	20	IDGD	
COCC[S@](=O)Cc1cccc(NC(=O)C(=O)NN=c2sc3ccccc3n2C)c1	783349251	GTXNSKXJCOKVSP-PMERELPUSA-N	446.554	1.706	50	20	IDGD	
CCN(CC)CCNC(=O)c1cc(NC(=O)C(=O)NN=c2cc[nH]cc2)ccc1Cl	783370182	NFGYSBSPFVYIRW-UHFFFAOYSA-N	432.912	1.310	50	20	IDGD	
CCn1c(NNC(=O)[C@@H]2CC=CC[C@@H]2C(=O)N2CCOCC2)nc2ccccc2c1=O	784337211	NMRSQRKOOBZJMJ-CVEARBPZSA-N	425.489	1.301	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2cccnc2Cl)c(C)c1S(=O)(=O)NC1CC1	784842604	ZLLCBMDTOVAZDR-UHFFFAOYSA-N	437.909	1.874	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)C(=O)Nc2cccc([C@@H](C)N3CCOCC3)c2)c1	784853939	RLNBWMLFAOJHOR-OAHLLOKOSA-N	426.473	1.948	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)Nc1ccc(OC2CCC2)c(F)c1	785022975	DWLYCUXJAOEKII-UHFFFAOYSA-N	432.364	1.771	50	20	IDGD	
N#Cc1ccc(NNC(=O)C(=O)Nc2cnn(CC(=O)NC3CCCC3)c2)cc1Cl	785094905	LFLIEDFEPRSQPM-UHFFFAOYSA-N	429.868	1.549	50	20	IDGD	
COc1cc(F)cc(NNC(=O)C(=O)Nc2ccc(S(=O)(=O)N3CCCC3)cc2)c1	785247472	VMNLKSJLTZKQFF-UHFFFAOYSA-N	436.465	1.701	50	20	IDGD	
CS(=O)(=O)c1ccc(OCCCC(=O)NNc2ccccc2S(N)(=O)=O)cc1	788227510	FCRPPZCEDSAGGW-UHFFFAOYSA-N	427.504	1.040	50	20	IDGD	
CN(NS(=O)(=O)c1ccc2c(c1)CCO2)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	788918526	VMURRADXWFRNRU-UHFFFAOYSA-N	440.522	1.419	50	20	IDGD	
Nc1nc(Cl)cc(NNC(=O)Nc2ccc(N3CCN(C(=O)C4CC4)CC3)nc2)n1	789082542	VMMQBFKHIAPZKY-UHFFFAOYSA-N	431.888	1.314	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@@H](C(=O)NNC(=O)Cc2ccc(Cl)cc2)[C@H](C)O)cc1	789165878	BJAGDGOLHJPTDQ-SCLBCKFNSA-N	439.921	1.066	50	20	IDGD	
CC1(C)Cc2cccc(NC(=O)C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)c2O1	789584581	OGNDLRMPTCKJJW-UHFFFAOYSA-N	438.488	1.193	50	20	IDGD	
COc1c(C)cnc(Cn2cnc(NC(=O)C(=O)NNc3nccnc3C(C)C)n2)c1C	789782886	MKMBJLKLKTTXMW-UHFFFAOYSA-N	439.480	1.342	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)[C@H](CCS(C)(=O)=O)c3ccccc3)nc21	789942355	PGYOZEQACJDHGG-CQSZACIVSA-N	446.533	1.949	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)NCC(=O)NNc2cccc(F)c2[N+](=O)[O-])cc1	791148222	TYQTWFIJOBJESQ-UHFFFAOYSA-N	440.409	1.332	50	20	IDGD	
COC(=O)c1ccc(NC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])c(N(C)C)c1	792411305	WUTXBFSZRKNTJY-UHFFFAOYSA-N	431.405	1.679	50	20	IDGD	
CN(C)C(=O)Nc1ccc(CNC(=O)NNC(=O)CNC(=O)OCc2ccccc2)cc1	793215349	IRYFDPZXYUQJSR-UHFFFAOYSA-N	442.476	1.537	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)[C@H]2CCC[C@@H](C(=O)NNC(=O)c3cccc(C)n3)C2)n1	794081019	YMSWTAWYIRAYEY-IYBDPMFKSA-N	438.488	1.122	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNS(=O)(=O)c1ccc2c(c1)CCCC(=O)N2	794598579	HJYREKDZRSQLIZ-UHFFFAOYSA-N	446.485	1.197	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)[C@H]1CCC(F)(F)C1	794863808	YSPFDYFIWOCRPS-HNNXBMFYSA-N	445.488	1.223	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)CNC(=O)OCc2ccccc2)cc1S(C)(=O)=O	797638457	VEAYDSBRKRUVPL-UHFFFAOYSA-N	434.474	1.478	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccccc1[N+](=O)[O-])NNC(=O)C12CC3CC(CC(C3)C1)C2	798151656	WSAIYQZXKOQAFT-UHFFFAOYSA-N	436.490	1.237	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)[C@H]2CCc3cnn(C)c3C2)cc1	798825848	RSABIEYHHZHUET-HNNXBMFYSA-N	425.518	1.407	50	20	IDGD	
CN1C(=O)COc2cc(NC(=O)C(=O)NNc3nc(-c4ccc(Cl)cc4)no3)ccc21	799262308	RVQMYPRPZCWMQG-UHFFFAOYSA-N	442.819	1.827	50	20	IDGD	
CNC(=O)CNC(=O)c1cccc(NC(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)c1	800596745	PUAHBYVHBMJOIY-GFCCVEGCSA-N	447.879	1.436	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c(C)c1OC	804160750	AZLLHCMLNXPJOP-UHFFFAOYSA-N	447.513	1.872	50	20	IDGD	
COCCOc1ccc(S(C)(=O)=O)cc1NC(=O)NNc1cc(Cl)nc(N)n1	806737713	WNEBPUOSAJQESB-UHFFFAOYSA-N	430.874	1.290	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)c1ccc(S(=O)(=O)NCc2ccco2)cc1	807370746	UMDNUISHFFVGHP-UHFFFAOYSA-N	439.490	1.308	50	20	IDGD	
CC(C)[C@H](NC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)c1nncn1C	807431307	DBIHRPLEAKIYBD-IBGZPJMESA-N	428.541	1.055	50	20	IDGD	
N#Cc1ncn(-c2ccccc2NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2Cl)n1	810394931	JFJBUABXMBHKNU-UHFFFAOYSA-N	426.780	1.782	50	20	IDGD	
O=C(CNS(=O)(=O)c1cccc(F)c1)NNC(=O)c1cc(Br)ccc1O	810449186	HUPPROOIAZCLCN-UHFFFAOYSA-N	446.254	1.033	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)N[C@H]1c2ccccc2CC12CCOCC2	811872955	ZWIBONMDGUBPBC-SFHVURJKSA-N	428.514	1.903	50	20	IDGD	
NC(=O)Cc1ccc(CNC(=O)NNC(=O)COc2ccc(Br)cc2)cc1	811922383	QJHNTYRZVXAFQK-UHFFFAOYSA-N	435.278	1.386	50	20	IDGD	
Cc1cc(-n2cccn2)ccc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	813033287	MIHWALJMTQCQLV-UHFFFAOYSA-N	442.501	1.513	50	20	IDGD	
CC(C)Oc1ccc(F)cc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	813033430	SGCMTKYYAWLWKP-UHFFFAOYSA-N	438.481	1.945	50	20	IDGD	
COc1cnc(C(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)nc1	814718465	XZSCZMXHMXEFQO-UHFFFAOYSA-N	441.469	1.039	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(I)cc1)c1cccc([N+](=O)[O-])c1	906280189	PUHKALUVMPISKI-UHFFFAOYSA-N	447.210	1.823	50	20	IDGD	
CC(=O)c1cccc(S(=O)(=O)NCCC(=O)NNC(=O)CNc2ccc(C)cc2C)c1	913164233	AQTPNGXSRWQHBT-UHFFFAOYSA-N	446.529	1.434	50	20	IDGD	
C=CCNS(=O)(=O)c1cc(C(=O)NNC(=O)COc2ccc(C#N)cc2)ccc1F	914595730	OVMVHNVRXBBLDU-UHFFFAOYSA-N	432.433	1.002	50	20	IDGD	
CCCCn1nc(C(=O)NN=C(C)c2cccc(S(N)(=O)=O)c2)c2ccccc2c1=O	915946593	NMXROOSPBCWULI-UHFFFAOYSA-N	441.513	1.998	50	20	IDGD	
O=C(NN=C1CCN(c2cnccn2)CC1)c1ccc(S(=O)(=O)N2CCCC2)cc1	915946973	XKJYUYUVMQKUPY-UHFFFAOYSA-N	428.518	1.647	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)cc1S(C)(=O)=O	916134194	FGFJOARORSPCOK-UHFFFAOYSA-N	438.531	1.075	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC(NC(=O)NNC(=O)c3ccccc3F)CC2)cc1	916235748	RYRIIUORPUHCTF-UHFFFAOYSA-N	434.493	1.931	50	20	IDGD	
CC(=NNC(=O)[C@@H](C)CN1CCCCC1)c1ccc(S(=O)(=O)N2CCOCC2)cc1	916360959	LVWONVBDQOZSST-KRWDZBQOSA-N	436.578	1.670	50	20	IDGD	
CCC(=O)N1CCC[C@@H](C(=O)OCC(=O)NNC(=O)c2cc(Cl)ccc2OC)C1	919457359	SLZYTRBJWNGVGS-GFCCVEGCSA-N	425.869	1.301	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)NCC[C@](O)(c2nccn2C)C(F)(F)F)cc1	920044616	MTTDQHQNACLZQX-SFHVURJKSA-N	443.426	1.532	50	20	IDGD	
CCS(=O)(=O)N1CCC(C(=O)NNC(=O)c2ccc(OC)cc2)(c2ccccc2)CC1	1248437542	MIVRTQAECOYGRH-UHFFFAOYSA-N	445.541	1.840	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)N[C@H]2CCN(c3cnn(C)c3)C2)c1	1318625226	AKJGZGHOEUQVQN-NSHDSACASA-N	437.298	1.414	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc(Br)cnc1Cl)c1n[nH]c2c1CCCC2	1321221941	BPCCXNJEZRERSV-UHFFFAOYSA-N	434.703	1.723	50	20	IDGD	
O=C(NCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Cl)C1)c1cccs1	1778024213	SJZRKLKTIYDPOA-DDUZABMNSA-N	431.917	1.526	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3nc(O)n4c3CCCC4)C2)C1	1779349167	STSVCZYFHANKRW-SGTLLEGYSA-N	441.326	1.152	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H]1CC[C@H](O)CC1)C2)[C@@H](F)Br	1780777705	ZKMQSSAWDFTPHD-VFCJXBEMSA-N	435.334	1.742	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1CCN1C(=O)OC(C)(C)C)CCO2	1781215051	HDVCJDVMEWXZOW-AVYPCKFXSA-N	429.945	1.843	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](F)Br)C3)C2)c(O)c1	1781333807	JJKUGKAVOUNWMA-WMLDXEAASA-N	431.258	1.535	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CC2CCC2)C1	1783176673	JRDOTSUXBFEOEW-XMSQKQJNSA-N	429.521	1.003	50	20	IDGD	
COC(=O)[C@H]1CC=CC[C@@H]1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(C)(C)CCl)[C@H]2C1	1783856261	UCPJEIKHCBUFBG-ATIWLJMLSA-N	440.968	1.987	50	20	IDGD	
Cn1nc(C(F)(F)F)cc1C(=O)N1CCO[C@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783946242	KJGZNJRXEAYSOV-AWEZNQCLSA-N	429.226	1.686	50	20	IDGD	
COc1ccc2c(CC(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)[C@@H](O)CCl)C[C@@H]43)c[nH]c2c1	1784145029	CMEKZRYTHKBLPA-SIXJUCDHSA-N	449.935	1.298	50	20	IDGD	
CC(C)N[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCBr)[C@H]2C1)C(C)C	1786406032	MWEBIAUMZDZYIU-OVWQWFNUSA-N	432.403	1.774	50	20	IDGD	
CCC[C@H](NC(C)=O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCBr)[C@H]2C1	1786408085	GPGKRYDWQVVTSJ-VGWMRTNUSA-N	432.359	1.056	50	20	IDGD	
CCn1ccc(C(=O)Nc2ccc(C3(NC(=O)c4ccc(B(O)O)cc4)CCC3)cc2)n1	1787500241	UZAQGFHVJACMLZ-UHFFFAOYSA-N	432.289	1.644	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4nc[nH]c4c3)[C@H]2C1	1788330658	GNFFOGCPZAJSPM-YSLLHCQFSA-N	435.322	1.940	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)n3ccccc3=O)[C@H]2C1	1788750737	OIWULRSGNVHNER-QXKUPLGCSA-N	440.338	1.172	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](N)Cc3cccnc3)C[C@@H]21	1789865789	GVTXRGAVEJINCE-DRCYAFTPSA-N	443.375	1.167	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cn4cccnc4n3)C[C@@H]21)[C@@H](F)Br	1789925726	IFKMEZACTCCXSI-AUZPSNTRSA-N	440.273	1.013	50	20	IDGD	
Cc1ncc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]3C2)s1	1789927084	PSIURYJOUQXVOI-GZCFXPHUSA-N	434.331	1.664	50	20	IDGD	
CN1CCC[C@H](C(=O)Nc2ccc(C3(NC(=O)c4ccc(B(O)O)cc4)CCC3)cc2)C1	1790391256	LWDPHDINIOAEOH-SFHVURJKSA-N	435.333	1.456	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(=O)n3C)C[C@@H]21	1790960797	GHWXSFAJNRMWAG-YXWQFLTLSA-N	440.338	1.152	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3c(C)n[nH]c3C)C[C@@H]21	1790963214	OTVJUYHCSRMSKB-HJWJTTGWSA-N	441.370	1.722	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H](C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](O)CCl)C[C@@H]2C[C@@H]21	1793107826	XDXDPANEWCGADG-BYWHFUISSA-N	441.956	1.622	50	20	IDGD	
CC(C)(C)OC(=O)NC12CC(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)[C@H](O)CCl)(C1)C2	1793116756	SSRTUCCHUCTBGA-COZCDLTHSA-N	441.956	1.672	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(C(=O)O)n(C(C)C)n1)C2	1793445453	JANMPARVJYMKDR-UMPJEAMMSA-N	440.928	1.773	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2	1793455324	HYRZFBRFEYLVID-AKPDTCSLSA-N	438.908	1.814	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(=O)oc1	1795373594	LLKHPDZFGDWDQW-VFMVUTOHSA-N	425.445	1.026	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H]2C[C@@]21C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Cl	1796369555	YVFCOYSHJHMNGM-QUCNZTJFSA-N	445.919	1.510	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1ccc2nccnc2c1	1797057187	AQNSLCIIDKGVPB-NOXHYTERSA-N	437.269	1.524	50	20	IDGD	
Cc1cccc(C)c1NC(=O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CO[Si](C)(C)C	1797956427	UYOIWLYFMNNICK-XEMDLRDOSA-N	447.608	1.683	50	20	IDGD	
Cc1nc2ccc(F)cn2c1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CO[Si](C)(C)C	1797957654	WXPADSHULLPRHN-CCWDJLKJSA-N	448.571	1.837	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1c(F)cncc1F	1798241136	COEHFKCDPHXHDJ-DDIVZENXSA-N	432.265	1.737	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COC(C)C)C2	1798521579	OYVGLKJVDCQNQU-YVWYUNDQSA-N	449.460	1.148	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(F)n1	1798754840	WYQLJXRWNJVDBI-SSJPOKSSSA-N	426.452	1.607	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(C(F)(F)F)n1)c1cccc(B(O)O)c1	1798768435	PTFKYHPOKMUBPI-MUJYYYPQSA-N	447.222	1.346	50	20	IDGD	
CCOC(=O)c1cccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](O)CCl)C3)c1F	1799228186	CPVBUFZKFIIJKY-OQMKEHIESA-N	426.872	1.854	50	20	IDGD	
C#CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](Cl)CC	1799273843	ROCXHTGOECIKHU-BPKGMFCQSA-N	441.956	1.510	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](CN)c1ccccc1)C2	1799274777	HVKPBUKXOMFEKF-WFNPHZEWSA-N	428.360	1.555	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(OCC2CC2)cc1	1801825913	YYYDTDJUBWXGBJ-PIKOESSRSA-N	436.936	1.932	50	20	IDGD	
COc1cc(F)ccc1CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2	1802178789	WQWVYMKGVFKBBP-HBCWATKFSA-N	443.313	1.751	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H](C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](O)CCl)C3)C[C@H]2C[C@H]21	1804400990	KCPJBXKFWXFARO-WWDRVWNISA-N	441.956	1.622	50	20	IDGD	
O=C(/C=C/c1ccco1)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1804614933	QAAWGODSWHIAEZ-BVVUSLJFSA-N	445.284	1.387	50	20	IDGD	
O=C(CCBr)NC[C@H]1CCN(C(=O)COc2cccnn2)[C@H]1c1cccnc1	1806347104	SXJCTPZIQDNVLY-BEFAXECRSA-N	448.321	1.741	50	20	IDGD	
Cc1ccn(C)c1C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1807360040	GPUXMJRDURBHOR-KNQAVFIVSA-N	446.316	1.042	50	20	IDGD	
O=C(CCCC(F)(F)F)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1	1809968781	DWMZLHAWELHLMX-UHFFFAOYSA-N	440.271	1.944	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1CCN(C(=O)CN2CCCCC2=O)[C@H]1c1cccnc1	1810547314	DSJRSLCHJBWCPL-AVRDEDQJSA-N	446.624	1.951	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H](CNC(=O)Cn2ccncc2=O)[C@@H]1c1cccnc1	1812342738	BRMCYQWQEFOYNY-UTKZUKDTSA-N	443.580	1.196	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2cn(C)nc2OC)[C@@H]1c1cccnc1	1813029424	LRCRGBHKIRIULC-HYVNUMGLSA-N	435.912	1.397	50	20	IDGD	
COCCn1ccc(C(=O)N2CC[C@H](CNC(=O)[C@H](Cl)COC)[C@@H]2c2cccnc2)n1	1813030340	HXHCOCUHPLMCDH-LMMKCTJWSA-N	449.939	1.498	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1813067565	AQSCVEQFLKCDBC-UWVAXJGDSA-N	437.972	1.868	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1CCc2nc(NC(=O)CC(C)(C)O)sc2C1	1814336688	VLUNLSYEJZECHA-BTQGWNRHSA-N	446.533	1.350	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)CCl)CC2)c1ccc(-n2cnnc2)cc1	1814699759	XPYUATXEQPNPMR-DOMZBBRYSA-N	446.920	1.549	50	20	IDGD	
Cc1cccc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)c1	1815343899	VTAHKJNMZAMPDD-QGZVFWFLSA-N	435.314	1.671	50	20	IDGD	
Cc1ccnc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)c1	1815354604	LIRTUNMPTWNWHE-OAHLLOKOSA-N	436.302	1.066	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)Cc3cccnc3)sc2C1	1815705276	QGVCTAMUPZJWQK-AWEZNQCLSA-N	430.534	1.066	50	20	IDGD	
COCCCC(=O)N[C@@H]1CCc2nc(NC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)sc2C1	1817276123	MBPBJWSEVVGQNH-CJCQAYSXSA-N	446.533	1.616	50	20	IDGD	
CN[C@H](CC(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@](C)(Cl)CCl)[nH]n1)C(=O)O	1817370501	FPWVCLBUMDJKJF-BWACUDIHSA-N	434.324	1.701	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cnoc2C2CC2)[nH]n1)c1ccc(B(O)O)cc1	1817471508	QIEGMVAAOIULNZ-SFHVURJKSA-N	449.276	1.575	50	20	IDGD	
CC1=CC[C@@H](C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cccc(B(O)O)c2)CC3)CC1	1818622619	RLLPMVLFHVOBOP-PBHICJAKSA-N	439.346	1.795	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3cnn4cc(C)cnc34)sc2C1	1819091733	NQYVBYBRUNVYDU-WCQYABFASA-N	448.936	1.974	50	20	IDGD	
C[C@H](Br)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)C[C@@](C)(O)CC(=O)O)[nH]n1	1822191962	OVESZRZLEAQOMC-QAGHZCBJSA-N	445.314	1.801	50	20	IDGD	
CCc1[nH]nc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)c1F	1822413408	USJGBOKBYWYJAC-AWEZNQCLSA-N	448.503	1.513	50	20	IDGD	
COc1ccnc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)c1	1822415424	ZOXKMOIPBGNWFN-KRWDZBQOSA-N	443.508	1.492	50	20	IDGD	
CC(C)=NO[C@@H](C)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCC(=O)NN(C)C)CC2	1823088409	BVSPAEICWQAJRI-STQMWFEESA-N	438.554	1.229	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)CN2CCS(=O)(=O)CC2)CC1	1824977569	XWYBNIYDORAPCT-ZWKOTPCHSA-N	448.029	1.354	50	20	IDGD	
CC(=O)N(C)CCC(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](C)Br)sc2C1	1825635773	KLAXYUSFWUJKKC-MWLCHTKSSA-N	431.356	1.707	50	20	IDGD	
Cc1cnc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)cn1	1825873470	RYFLZEJQEGYIDC-OAQYLSRUSA-N	436.321	1.012	50	20	IDGD	
O=C1C[C@@H](C(=O)Nc2nc3c(s2)C[C@H](NC(=O)CCBr)CC3)CCN1	1826215573	UCGXXPGFSICNDC-VHSXEESVSA-N	429.340	1.366	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCC([C@H]2CCCCN2C(=O)CS(C)(=O)=O)CC1	1826629318	VPALXLHVUYDIPQ-RHSMWYFYSA-N	427.394	1.887	50	20	IDGD	
Cc1ncsc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827055886	IQYDPQCWZJGUHF-IBGZPJMESA-N	441.362	1.678	50	20	IDGD	
C[Si](C)(C)C#CCCCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1830731591	MTODHJWHIBPDLF-FXAWDEMLSA-N	445.032	1.094	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3c(O)cc(O)cc3O)C2)C1	1831654089	QHKVZOAZAAISPJ-JLTOFOAXSA-N	442.896	1.281	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)/C=C/c3cccnc3)CCO2)C1	1833104642	KWTPVKAKNLBOQP-FKXXJOMMSA-N	438.322	1.335	50	20	IDGD	
COc1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@](C)(Cl)CCl)C3)C2)n1	1833769129	VVBSUJKGZYXJID-MOPGFXCFSA-N	446.331	1.397	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3ccc(C=O)s3)CC2)CC1	1834805025	VAOQYZPLZCHJRU-QGZVFWFLSA-N	441.981	2.000	50	20	IDGD	
CCc1oncc1C(=O)N1CCOC[C@@]2(CN(C(=O)CCBr)CCO2)C1	1834819466	SRXQJGMAHYYENX-QGZVFWFLSA-N	430.299	1.092	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](F)Cl)CC2)CC1)c1ccc2c(n1)OCCO2	1835042108	QMUGVMMEAAUYLC-KRWDZBQOSA-N	440.903	1.572	50	20	IDGD	
O=C(c1ccnc(Cl)c1)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836714883	AGHGGCUTUCEINU-INIZCTEOSA-N	430.332	1.947	50	20	IDGD	
C=CC[C@H](C(=C)C)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCBr)C2)C1	1837305820	KFLCKIFAJIFDPC-VQIMIIECSA-N	429.355	1.996	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cncc(F)c3)C2)C1	1837712240	KYUCPIYLZGSYKJ-IBGZPJMESA-N	425.533	1.142	50	20	IDGD	
CC(C)/C=C/C(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1	1837922231	ZUFGAIFKJCIKLT-VOTSOKGWSA-N	428.338	1.191	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)cc1	1838966848	SXVWJFOTZWHMKD-NRFANRHFSA-N	436.581	1.617	50	20	IDGD	
O=C(CCc1ccc[nH]1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839198975	GXTSHNUEPBUGCA-RDJZCZTQSA-N	432.290	1.094	50	20	IDGD	
Cc1cc(F)cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)c1	1839202174	WNSJLSIRTUEKKB-CRAIPNDOSA-N	447.276	1.895	50	20	IDGD	
COc1cc(C)cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)c1	1839256637	NICAMIIOWKDBTF-IBGZPJMESA-N	431.316	1.877	50	20	IDGD	
Cc1nc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)cs1	1840031092	FLXMJJKRXQHYOT-ZBEGNZNMSA-N	432.340	1.305	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCCCCC(=O)OC)CCO2)C1	1840236829	XBZYMYQHZQEECJ-OXJNMPFZSA-N	432.945	1.584	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)C[C@@H](O)CNC(=O)OC(C)(C)C)C2	1841669863	XZZYRYFWWFMLPR-CABCVRRESA-N	431.961	1.873	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)CCc2cn[nH]c2)C1	1842032450	QCJMXVGDBYFKKA-UHFFFAOYSA-N	441.444	1.693	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC2(CCCN2C(=O)Cn2c(=O)n(C)c3ccccc32)C1	1843858868	SSZMZXYTQAZNKZ-AWEZNQCLSA-N	449.349	1.574	50	20	IDGD	
CO[C@H](C)[C@@H](C(=O)N1CCCC12CN(C(=O)[C@H](O)CCl)C2)N(C)C(=O)OC(C)(C)C	1845091626	BBPWSCGHQTXSDO-KFWWJZLASA-N	447.960	1.060	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC2(CCCN2C(=O)[C@@H](O)NC(=O)OC(C)(C)C)C1	1845440050	NCBDFMTVUMJWDM-NWDGAFQWSA-N	434.331	1.206	50	20	IDGD	
O=C1C[C@H](C(=O)N2CCCC23CN(C(=O)[C@H](Br)Cc2ccccc2)C3)CN1	1846000432	IVBCQDPNDWCHKB-JKSUJKDBSA-N	434.334	1.332	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)c1n[nH]c3c1CCc1ncccc1-3)C2	1846363161	SIDJYVGTURQRCB-HNNXBMFYSA-N	429.908	1.641	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)CN(Cc1ccccc1)C(=O)OC)C2	1846364740	HLEADTXMRXLGKU-QGZVFWFLSA-N	437.924	1.712	50	20	IDGD	
C#CCO[C@H](C)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1847800352	NFLYOFFLIHLGGW-UGUYLWEFSA-N	427.929	1.359	50	20	IDGD	
CCOc1ccc(C(=O)CCC(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1	12802949	PUAXNKVOCROTAB-UHFFFAOYSA-N	432.502	1.803	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1	16785853	CAJLQIMYWJUEQQ-HNNXBMFYSA-N	432.458	1.403	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)[C@@H]1CCCN(C(=O)c2ccc3n[nH]cc3c2)C1	725888719	BHSYUDHEPXXETQ-QGZVFWFLSA-N	435.484	1.814	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@@H](C)C(=O)NNC(=O)c1cccc(CS(N)(=O)=O)c1	726522356	HQSWDVOJSVTBGX-ZDUSSCGKSA-N	439.921	1.974	50	20	IDGD	
O=C(NCc1ccccc1-c1ccc(Cn2cccn2)cc1)NNC(=O)C(=O)NC1CC1	727229274	VZQQUAIWECIMAH-UHFFFAOYSA-N	432.484	1.707	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)NCC(=O)Nc2ccc(-n3cncn3)cc2)c1C	727712854	NQOPQVSNYZBVMD-YBFXNURJSA-N	447.499	1.994	50	20	IDGD	
CC[C@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	727723306	XAIYFHVYGFKHFW-WFASDCNBSA-N	431.493	1.634	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)c1cc([N+](=O)[O-])ccc1NCc1ccccc1	728384013	BTVFVHAMHVUDQN-AWEZNQCLSA-N	432.458	1.403	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)c2cnc3n(c2=O)CCS3)c1	728529124	SOQIUHPZNDFNOY-UHFFFAOYSA-N	425.264	1.195	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2cc(F)ccc2Br)cnn1-c1ccc(O)nn1	728549238	BJKHSQJDUYKXGY-UHFFFAOYSA-N	435.213	1.653	50	20	IDGD	
C[C@@H]1Oc2ccccc2N(CCC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)C1=O	728847429	DZLKAIPUFYMECW-HNNXBMFYSA-N	438.488	1.045	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)NC1CCN(Cc2ccccc2)CC1	728937917	DFJDDRNZLFZOKA-UHFFFAOYSA-N	437.548	1.688	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)COc1ccc2cc(Br)ccc2c1	729274607	VNJLGGKARATUFZ-JTQLQIEISA-N	444.307	1.066	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)c1ccc(S(=O)(=O)N2CCCCC2)cc1	730782471	PBCBFZWBQFGRSB-UHFFFAOYSA-N	433.486	1.407	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(/C#N)C(=O)NC2CCN(CC(=O)N(C)C)CC2)c1C	731655697	ZLSUNYHRFFWMQJ-BRLDDBHUSA-N	429.565	1.888	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)CCNS(=O)(=O)c1ccc(NC(C)=O)cc1)c1ccccc1	732306946	GWCZDHBLHMBGPG-LJQANCHMSA-N	446.529	1.655	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)N2CCC(C(=O)NNc3cc(C)ncn3)CC2)cc1	734254241	PBLDDPVFCYNPSQ-UHFFFAOYSA-N	447.517	1.506	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNS(=O)(=O)c1ccc(Oc2ccccc2Cl)cc1	734743103	KOTQKCRLPUICSW-LLVKDONJSA-N	447.922	1.380	50	20	IDGD	
CC(C)Oc1cccc([C@H](O)CNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1	735100424	SOJWPKHOSJKILY-LJQANCHMSA-N	442.520	1.544	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)CC[S@@](=O)c2ccc3c(c2)OCCO3)cc1OC	740749175	OODRDCBPJWWOCE-WJOKGBTCSA-N	448.497	1.824	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)CN(CC2CC2)C(=O)OC(C)(C)C)c2ccccc2c1=O	742473891	JAYGSWYIRPWRAN-UHFFFAOYSA-N	443.504	1.825	50	20	IDGD	
CN(C)[C@H](CNC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)c1ccsc1	743530084	PAHCVXMFLVBDAA-OAHLLOKOSA-N	425.536	1.790	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)[C@H]2CC(=O)N(c3ccc(F)cc3F)C2)cc1	744706896	IJAOXEHJQNLINT-AWEZNQCLSA-N	442.378	1.194	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)N[C@@H]1CCN(Cc2ccccc2)C1=O	744878255	ULZRYORZOVKYAQ-QGZVFWFLSA-N	434.456	1.323	50	20	IDGD	
Cc1cc(Br)c(N)c(C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)c1	745058956	OZXQFLLJFRESTA-UHFFFAOYSA-N	431.246	1.829	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NC[C@H](C)CN2CCN(C)CC2)cc1Br	745862957	QRDHTRXBBIAFRL-ZDUSSCGKSA-N	442.358	1.285	50	20	IDGD	
C[C@@H]1CCCN(S(=O)(=O)c2cc(C(=O)NNC(=O)N3CCOCC3)ccc2Cl)C1	745991755	GKXXVNZXOOUDQL-CYBMUJFWSA-N	444.941	1.447	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCCN1C(=O)c1ccc(O)nn1)c1cccc(Br)c1	746316656	OHDMMCMJCGBVOM-CQSZACIVSA-N	448.277	1.401	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)N[C@H]2CCCN(CC(F)(F)F)C2=O)cc1OC	746340479	ZRDGIPRWRVGIHP-ZDUSSCGKSA-N	446.426	1.981	50	20	IDGD	
NS(=O)(=O)c1cccc(N2C[C@H](C(=O)NNc3cccc4c3CCCC4)CC2=O)c1	748588624	POECUEXDUJABQZ-OAHLLOKOSA-N	428.514	1.709	50	20	IDGD	
COC(=O)Nc1ccccc1C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	748619601	MCSDCMVOTPOGLP-UHFFFAOYSA-N	447.517	1.558	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)NCC(=O)NNc2ccc([N+](=O)[O-])cc2Cl)cc1	749289828	SMCQRNMHIJWJLO-UHFFFAOYSA-N	426.838	1.872	50	20	IDGD	
NS(=O)(=O)Cc1cccc(C(=O)NNC(=O)COc2ccc(Br)cc2)c1	749715447	JAJDLXYMQSVFMV-UHFFFAOYSA-N	442.291	1.078	50	20	IDGD	
Cc1nc(S(=O)(=O)NCCC(=O)NNC(=O)c2cc3c(s2)CC[C@H](C)C3)cn1C	750663906	QTAVIWHOTQTPFT-NSHDSACASA-N	439.563	1.044	50	20	IDGD	
CC[S@](=O)[C@@H]1CCC[C@@H](NC(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)C1	750671793	VVRYPODTWITZMH-ZRBXUZRCSA-N	431.584	1.474	50	20	IDGD	
O=C(CCOc1ccccc1)NNC(=O)c1cccc(CN2CCS(=O)(=O)CC2)c1	751396909	GNHLOPUFVCCWES-UHFFFAOYSA-N	431.514	1.147	50	20	IDGD	
Cc1cc(S(N)(=O)=O)cc(C(=O)NNC(=O)c2ccc(Br)s2)c1C	751556582	PEWXAUTXJKWOQW-UHFFFAOYSA-N	432.321	1.850	50	20	IDGD	
COc1cc(OC)cc(N2C[C@@H](C(=O)OCC(=O)NNC(=O)c3ccccc3)CC2=O)c1	752581244	KWJFZVVSLIHSDK-HNNXBMFYSA-N	441.440	1.061	50	20	IDGD	
CN1C(=O)N[C@@]2(CCC[C@@H]2CNC(=O)NNC(=O)c2ccc(Cl)cc2Cl)C1=O	753020266	PWCJMWMAYQJQOJ-VVVCHXIZSA-N	428.276	1.658	50	20	IDGD	
N#Cc1ccc(CN2CC[C@H](NC(=O)NNC(=O)Cn3ccc4ccccc43)C2=O)cc1	753123600	BICBMTCYOUQWMX-IBGZPJMESA-N	430.468	1.644	50	20	IDGD	
C[C@H](C[S@](C)=O)NC(=O)/C(C#N)=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	753152151	GSOLHWUWYUABSQ-UYZAQBFNSA-N	447.948	1.869	50	20	IDGD	
CC(C)(C)OC(=O)NC1(CNC(=O)NNC(=O)c2nnc(O)c3ccccc23)CCC1	753330188	NJTVFMMVJWOXQV-UHFFFAOYSA-N	430.465	1.727	50	20	IDGD	
CN1CCN(C(=O)c2ccccc2NC(=O)NNC(=O)c2cc(Cl)ccc2O)CC1	755621939	DYGQZQPVWNLALF-UHFFFAOYSA-N	431.880	1.900	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)Nc2cccc(OCC(=O)N3CCCC3)c2)c1	755659373	YMCGNFBLKDXYRY-UHFFFAOYSA-N	440.460	1.508	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)Nc2ccc(CC(=O)N3CCOCC3)cc2)c1	755861644	HJRUZSBJABJXCR-UHFFFAOYSA-N	426.473	1.628	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2cccc3c2OCCO3)cc1	756150445	RGKGNAZQFYQVKS-UHFFFAOYSA-N	434.474	1.240	50	20	IDGD	
COC(=O)CCOc1ccc(NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1	756279309	RIPUKVMMCBMXIR-UHFFFAOYSA-N	425.405	1.071	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)[C@H]2CCC(=O)N2Cc2ccc(Br)cc2)n1	756408891	YDDPVUZZJYVMHJ-MRXNPFEDSA-N	448.321	1.601	50	20	IDGD	
NC(=O)c1ccc(NNC(=O)CCCOc2ccc(I)cc2)nn1	757392738	RWQPFNPVLFREHO-UHFFFAOYSA-N	441.229	1.482	50	20	IDGD	
Cn1cc(-c2nc3ccccn3c2NC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cn1	757663149	JJNOWWVVNRLFAT-MRXNPFEDSA-N	433.428	1.728	50	20	IDGD	
CC(C)CCn1nc(C(=O)NNC(=O)N=c2cc[nH]cc2[N+](=O)[O-])c2ccccc2c1=O	757805147	DWXGPBBTRZMBGX-UHFFFAOYSA-N	439.432	1.634	50	20	IDGD	
CC(C)CNS(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2cccc(N(C)C)c2)cc1	759666176	UMRZOCKAUQYLMB-UHFFFAOYSA-N	447.561	1.831	50	20	IDGD	
Cc1c(I)cccc1C(=O)NNC(=O)CCN1C[C@H](C)O[C@H](C)C1	760986465	ALLGVUUCCPDTCH-TXEJJXNPSA-N	445.301	1.860	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CSc2nc3cc([N+](=O)[O-])ccc3c(=O)n2C)c1	762483658	MEKWDPNNLBGESH-UHFFFAOYSA-N	427.442	1.703	50	20	IDGD	
COC(=O)c1cn([C@@H]2CCCN(C(=O)NNC(=O)c3cccc(OC(F)F)c3)C2)nn1	762569617	BIRKNJYEEWSZJJ-GFCCVEGCSA-N	438.391	1.358	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)ccc1F	763431662	DMXRAABKKJWDRX-UHFFFAOYSA-N	433.458	1.227	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)cc1OC	763550170	JYZQLIFSJIBJNV-UHFFFAOYSA-N	440.456	1.340	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)C2CC2)c(C(=O)N2[C@H](C)CCC[C@H]2C)cc1OC	763558374	NVJNKHZBFJGJAK-CHWSQXEVSA-N	446.504	1.603	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)Nc1ccc(-c2csnn2)cc1	763576468	AUQLUWUAIJPKQP-INIZCTEOSA-N	425.426	1.131	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2ccc(N3CCO[C@@H](C)C3)cc2)c1	763646816	KBMFQYNRYLVOQD-KRWDZBQOSA-N	440.500	1.693	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(Br)cc2C)cc1	763662115	VFZJESUSCJCRNK-UHFFFAOYSA-N	436.262	1.931	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(CN3CCCC3=O)cc2)cc1C	763666108	AXTZMYWFUJLJSC-UHFFFAOYSA-N	438.484	1.591	50	20	IDGD	
CCOC(=O)c1c(C)csc1NC(=O)C(=O)NNC(=O)CN1CCCc2ccccc21	763736508	VIBUPRIZVFLPIN-UHFFFAOYSA-N	444.513	1.772	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(OC)nc2OC)cc1	763860670	JXDBFWALIKVZRI-LBPRGKRZSA-N	432.433	1.051	50	20	IDGD	
CC(C)CNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)cc1	763865911	SQLBDDANUADCKN-AWEZNQCLSA-N	444.463	1.765	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)CC(C)C)cc1S(=O)(=O)N1CCCCC1	763881715	IVNDRKNOYIUHOI-UHFFFAOYSA-N	440.522	1.002	50	20	IDGD	
C#CCOc1ccc(F)cc1NC(=O)C(=O)NNC(=O)c1ccc(OCC)c(OC)c1	763901914	LGSCBSRUYAZZLL-UHFFFAOYSA-N	429.404	1.645	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(S(C)(=O)=O)ccc2C)cc1OC	763903889	WIKIIHRGNDCDPB-UHFFFAOYSA-N	449.485	1.206	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cc(C)c(=O)n(C)c2)ccc1OCCC(C)C	763913980	HYERSEWQWDBOAY-UHFFFAOYSA-N	444.488	1.527	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3ccc4c(c3)oc(=O)n4C)cc2C1	763938123	AMYAJPRSFCWRTH-JTQLQIEISA-N	428.470	1.718	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)C(=O)Nc1ccc(-c2ncon2)cc1	763943300	DUBKPDMEQYXKIM-UHFFFAOYSA-N	433.384	1.028	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)C(=O)Nc1ccn(Cc2ccccc2)n1	763996219	WYSLTBJWRLDFDU-UHFFFAOYSA-N	431.250	1.422	50	20	IDGD	
CCNC(=O)c1ccc(C)c(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)c1	763997028	ULIMSTKCCCKALT-UHFFFAOYSA-N	436.266	1.235	50	20	IDGD	
CC(=O)Nc1cc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)c(F)cc1F	764005276	WOFIKINOZSLDCY-UHFFFAOYSA-N	434.355	1.094	50	20	IDGD	
Cc1ccc(NC(=O)C2CC2)cc1NC(=O)C(=O)NNC(=O)c1ccc2c(c1)OCCO2	764006958	WIEGIMJCYQAORG-UHFFFAOYSA-N	438.440	1.514	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1ccc(N2CCOCC2)cc1C	764012042	MZBCZXHSXNKMNO-UHFFFAOYSA-N	446.891	1.893	50	20	IDGD	
O=C(NNC(=O)c1cccc(Br)c1)C(=O)Nc1ccc(-n2ccnn2)cc1	764062702	AMISJISIFRUNCF-UHFFFAOYSA-N	429.234	1.430	50	20	IDGD	
O=C(NNC(=O)c1ccc(F)cc1Br)C(=O)Nc1cnn(CC(F)F)c1	764084873	JIQMKUYEECYOKE-UHFFFAOYSA-N	434.172	1.450	50	20	IDGD	
CS(=O)(=O)CCOc1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)CC1CCCC1	764187135	DBNZXMOEROUFRX-UHFFFAOYSA-N	445.925	1.430	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)C(=O)Nc1cccc(-c2nnco2)c1	764203102	KAAALQFVTIYTIY-UHFFFAOYSA-N	432.437	1.127	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)OC(C)(C)C)cn1	764247908	LLUDCUFOHGSQHB-KRWDZBQOSA-N	426.477	1.798	50	20	IDGD	
CN1CCN(c2ccccc2NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)CC1	764343512	RUMAQOUVOSMYJU-UHFFFAOYSA-N	447.499	1.024	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccncc2)c2ccccc12	764352720	CFWCWTQMJBCSCX-UHFFFAOYSA-N	436.424	1.115	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)C(=O)N3CCc4cccc(C)c43)n[nH]2)cc1OC	764379226	SKQINBFPQPVUDW-UHFFFAOYSA-N	449.467	1.753	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc(CC(=O)OC)cc3)n[nH]2)cc1	764384959	ONGKRUHFLPIFGS-UHFFFAOYSA-N	449.467	1.754	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(C(=O)OCC(=O)NNC(=O)c2ccc(C)cc2)cc1	764462700	SZINKIIQTVRYIS-UHFFFAOYSA-N	447.513	1.644	50	20	IDGD	
NS(=O)(=O)c1ccc(CNC(=S)NNC(=O)c2cc(-c3cccs3)[nH]n2)cc1	764498580	WBDHXCMRSVQTGK-UHFFFAOYSA-N	436.544	1.095	50	20	IDGD	
Cn1c(=O)c2c(ncn2CC(=O)NN=Cc2ccc(SC(F)(F)F)cc2)n(C)c1=O	764818795	VVGXLOUPXPMHOL-UHFFFAOYSA-N	440.407	1.196	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C2CCN(S(=O)(=O)c3ccc(F)c(Cl)c3)CC2)n[nH]1	765586316	BCCVLRHYIPXHPM-UHFFFAOYSA-N	443.888	1.373	50	20	IDGD	
O=C(NCc1ccco1)NNC(=O)c1cc(I)cc([N+](=O)[O-])c1	765686227	SHCGSAVJWNBZKB-UHFFFAOYSA-N	430.158	1.937	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)c3ccc(C)c(F)c3)CC2)cc1	765731522	JGFLKQOTZGJXEW-UHFFFAOYSA-N	448.520	1.210	50	20	IDGD	
C[C@H](NC(=O)OC(C)(C)C)[C@H]1COCCC1=NNC(=O)Cc1cc(O)nc(S)n1	766016528	AZGHJYCUXPWANI-CMPLNLGQSA-N	425.511	1.435	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3ccccc3-c3nc(C)no3)CC2)cc1	766649494	QAKUUUYPIPNAMN-UHFFFAOYSA-N	448.527	1.932	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)CN1CCCCCC1=O	766659291	AGHXCGKUJVNTIH-UHFFFAOYSA-N	435.956	1.008	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)[C@@H]1Cc2ccccc2O1	766661834	ZHYCCHNOZIXKGT-FQEVSTJZSA-N	428.920	1.609	50	20	IDGD	
C[C@H](C(=O)OCC(=O)C(C#N)=C1N(C)c2ccccc2N1C)S(=O)(=O)C1CCOCC1	767495172	PFFPAKYDCOSIHO-CQSZACIVSA-N	447.513	1.402	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)c3c[nH]c4c(OC(F)(F)F)cccc4c3=O)nc21	767924415	BRLWPJOLFTYBKG-UHFFFAOYSA-N	435.322	1.566	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)c2c[nH]nc2-c2c(F)cccc2F)c1	768137029	JWWHRNMURPAYDT-UHFFFAOYSA-N	425.351	1.845	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cn(C)nc2-c2cccs2)cc1	768285316	OESNINIRUBUWMZ-UHFFFAOYSA-N	447.542	1.539	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)CN2C(=O)N[C@]3(CCCC(C)(C)C3)C2=O)c1	768571646	VAZNVWFAFBPDQT-QFIPXVFZSA-N	430.505	1.720	50	20	IDGD	
COc1ccccc1[C@@]1(C)NC(=O)N(CC(=O)NNC(=O)Nc2ccccc2C)C1=O	771251925	QXEAKXAQEMNELO-OAQYLSRUSA-N	425.445	1.624	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1cccc(S(=O)(=O)Nc2cccc(C)c2)c1	771869110	SVBKFOUUFUJBKE-CQSZACIVSA-N	433.486	1.899	50	20	IDGD	
COc1ccc(S(N)(=O)=O)cc1C(=O)NNC(=O)[C@@H](C)Oc1cccc(Cl)c1	772953823	JIJPYPHUMNYRRY-SNVBAGLBSA-N	427.866	1.225	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)c2cc(Cl)sc2S(N)(=O)=O)cc1	773713176	NOGAHSITEKBVLT-VIFPVBQESA-N	447.922	1.676	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2ccnn2[C@@H]2CCN(Cc3ccccc3)C2)n1	773724681	UUIHDCDKIIOXSU-MRXNPFEDSA-N	436.476	1.211	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)Nc1ccnn1[C@H]1CCS(=O)(=O)C1	776059668	QQBBOIMQQQJZGG-NSHDSACASA-N	427.870	1.371	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)NCc2ccc(CN3CCC(O)CC3)cc2)c1	776619902	CXFDLUCCDPOYHK-UHFFFAOYSA-N	432.546	1.873	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)[C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)nc1C	778422508	PTZUHEIBAABUMV-GFCCVEGCSA-N	448.461	1.679	50	20	IDGD	
Cc1cc(C(=O)NCC(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)ccc1[N+](=O)[O-]	782753475	FIZUGLYGNWTYEW-UHFFFAOYSA-N	442.400	1.773	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2ccc(S(=O)(=O)N3C[C@@H](C)C[C@H](C)C3)cc2)ncn1	783947504	BBAYPTICVPRINB-KBPBESRZSA-N	446.533	1.533	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2ccc(S(=O)(=O)N3C[C@H](C)C[C@@H](C)C3)cc2)ncn1	783947506	BBAYPTICVPRINB-ZIAGYGMSSA-N	446.533	1.533	50	20	IDGD	
Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)C(=O)NNC(=O)C(=O)N1CCCC1	784003391	VYYLNSHAUDHNTK-UHFFFAOYSA-N	449.467	1.154	50	20	IDGD	
Cc1cc(S(N)(=O)=O)cc(NC(=O)C(=O)NNc2ccc(Br)nc2)c1C	784807254	XPLQWVKIEBTOCR-UHFFFAOYSA-N	442.295	1.190	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)cc1C	784835242	JPUWQNHBGWJSCU-UHFFFAOYSA-N	441.412	1.860	50	20	IDGD	
C[C@H]1CN(c2ccccc2NC(=O)C(=O)NNc2cccc(S(C)(=O)=O)c2)C[C@H](C)O1	784841409	IOJPSXYSEJJFRH-GJZGRUSLSA-N	446.529	1.786	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)CCC(=O)Nc2ccc3nc(O)[nH]c3n2)cc1	787873677	NYAUKVBHGIYWER-UHFFFAOYSA-N	426.433	1.171	50	20	IDGD	
CN1CCN(C(=O)NNC(=O)c2nc(-c3cccs3)n(-c3ccc(F)cc3)n2)CC1	788169715	TYNQESYBHXDHKG-UHFFFAOYSA-N	429.481	1.737	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cc(-c3ccco3)nn2C(C)C)cc1	789733167	XXJSLCTVKGYVEY-UHFFFAOYSA-N	441.444	1.898	50	20	IDGD	
O=C(CNC(=O)NNC(=O)c1ccccc1)Nc1ccc(I)cc1	790654688	DJOWGWFTWPSQCZ-UHFFFAOYSA-N	438.225	1.874	50	20	IDGD	
Cc1cccnc1NNC(=O)C(=O)Nc1ccc(Cl)c(S(=O)(=O)N2CCCC2)c1	792376250	SJTGBBSZMGIHIQ-UHFFFAOYSA-N	437.909	1.910	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NCCSSC)cc1S(=O)(=O)N1CCCC1	793078572	OGRPSCGOYCBJKE-UHFFFAOYSA-N	447.604	1.936	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)c1ccccc1F)C(=O)NNC(=O)c1cccc(C)n1	794090388	SFBOTBKLNYOZIH-HNNXBMFYSA-N	440.522	1.390	50	20	IDGD	
O=C(NN=C1CCCc2ccc(O)cc21)c1cccc(S(=O)(=O)N2CCOCC2)c1	794453000	GNDCJWURCMDSPN-UHFFFAOYSA-N	429.498	1.884	50	20	IDGD	
Cc1nnnn1[C@H](Cc1ccccc1)C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	794721009	OIGJKOKPKKRUAN-GOSISDBHSA-N	429.506	1.159	50	20	IDGD	
COCCNC(=O)c1cccc(S(=O)(=O)NNC(=O)c2ccc(Cl)cc2O)c1	795300452	NURREZDLFRAOPO-UHFFFAOYSA-N	427.866	1.045	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)c1ccc(S(N)(=O)=O)c(Br)c1	798333461	NQZURTHZMYPPPU-UHFFFAOYSA-N	448.320	1.257	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)Nc1ccnc(OCc2ccccc2)c1	800622813	UFTDSFQEIWQWSA-LJQANCHMSA-N	448.435	1.587	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)c2ccc(S(=O)(=O)N(C)C)cc2)cc1	801105521	GJGQVYFSBBYWRL-AWEZNQCLSA-N	432.502	1.135	50	20	IDGD	
O=C(COC(=O)c1nn(-c2ccccc2F)cc1O)NNC(=O)c1ccc(Cl)cc1	801379218	WPSDVOGKAFWYTH-UHFFFAOYSA-N	432.795	1.988	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)N[C@@H](C)CCNS(=O)(=O)c1ccccc1	801798378	UQSWSRRXVPSVEV-HNNXBMFYSA-N	434.518	1.325	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)CC(=O)NNC(=O)Nc2cc(F)cc(F)c2)cc1F	802002408	NDLKSPLIHIMREZ-UHFFFAOYSA-N	429.376	1.933	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1ccnc(NC(=O)C2CC2)c1	803906475	KRWKXCUWLSITDM-UHFFFAOYSA-N	446.847	1.710	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)Nc2ccc(F)c(S(=O)(=O)N(C)C)c2)cc1	806544161	WEGPFKWXGZZWAI-UHFFFAOYSA-N	440.453	1.316	50	20	IDGD	
CNS(=O)(=O)c1cc(NC(=O)NNC(=O)c2cc(Br)c[nH]2)ccc1F	806544414	DULMWWSLGSXIFC-UHFFFAOYSA-N	434.247	1.291	50	20	IDGD	
Cc1cc(Cl)ccc1Cc1cnc(NC(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)s1	806793307	QLUPYSOLSMEMSF-SNVBAGLBSA-N	445.954	1.786	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NC[C@H](Cc1ccccc1)N(C)C	807005840	GCZIKSZXTXVHIR-KRWDZBQOSA-N	446.577	1.405	50	20	IDGD	
O=C(NNc1ncccc1F)C(=O)N1CCc2cc(S(=O)(=O)N3CCCCC3)ccc21	807303148	XPJSUXPGSZKVOX-UHFFFAOYSA-N	447.492	1.428	50	20	IDGD	
NC(=O)C[C@H]1CCN(C(=O)NNC(=O)[C@@H]2Cc3ccccc3CN2Cc2ccccc2)C1	808256046	KBUCGGOXSPLIMQ-NQIIRXRSSA-N	435.528	1.552	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)Nc2ccc(S(=O)(=O)N(C)C)cn2)c1C	808792544	KZVCDBRHBYQQRA-BOPFTXTBSA-N	431.518	1.942	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc3c2OCC(=O)N3)cc1	810386353	WDRQQZSLMODEKN-UHFFFAOYSA-N	440.456	1.842	50	20	IDGD	
Cc1cc(C(F)(F)F)ncc1NC(=O)C(=O)NNC(=O)c1cnn(-c2ccccc2)c1	810387510	YWIRSQHBNQELLK-UHFFFAOYSA-N	432.362	1.994	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)[C@H]2CCCN2C(=O)OCC(F)(F)F)cc1	812732936	DPLWAZZHHWEHJG-CYBMUJFWSA-N	438.428	1.543	50	20	IDGD	
COCCOCc1ccc(CNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1	812883732	YVHSDZGHBXCCFH-UHFFFAOYSA-N	442.520	1.387	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2c(I)cnn2C)c(OC)c1	815466973	NZCWYWZQNFVRHV-UHFFFAOYSA-N	430.202	1.117	50	20	IDGD	
COc1ccccc1C(=O)N[C@H](CCS(C)(=O)=O)C(=O)NNc1cccc(Cl)n1	817007450	CDCMQPFIWYUKIX-CYBMUJFWSA-N	440.909	1.420	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(C)(C)N1C(=O)c2ccccc2C1=O	817053678	BUMZKOANRPMLPB-UHFFFAOYSA-N	430.486	1.455	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1Cl	817971119	APWLDJLHDUECDV-UHFFFAOYSA-N	439.921	1.993	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)c1ccc(F)c(S(=O)(=O)NC(C)(C)C)c1	819727912	MGNHNOQWFLJOLT-UHFFFAOYSA-N	433.502	1.453	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)N[C@@H]2CCc3c(nc(C)n3CCO)C2)c1C	819745099	QJJXVHIASCAPAX-QDDTUJKSSA-N	425.533	1.829	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)c1sccc1S(=O)(=O)N1CCCC1	822616937	KFDHTZSZCVQOLW-UHFFFAOYSA-N	427.479	1.512	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)CNS(=O)(=O)c1ccc(Cl)cc1	912861351	VLEHQIXTWBIUOO-LLVKDONJSA-N	429.857	1.372	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)NCc1ccc(C(=O)N2CCOCC2)cc1	913627822	AOYCBBPMCZOCDV-UHFFFAOYSA-N	430.436	1.208	50	20	IDGD	
O=C(NCCNC(=O)c1ccc(Cl)cc1)NNC(=O)c1nn(-c2ccccc2)cc1O	914536272	OPYKKJNJGDIRED-UHFFFAOYSA-N	442.863	1.605	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Cc2ccc(-n3cccc3)cc2)c1	914748128	INHWRGZLYOYOEO-UHFFFAOYSA-N	426.498	1.731	50	20	IDGD	
COc1ccc2[nH]cc(CC(=O)NNC(=O)c3sc(N4CCOCC4)nc3C)c2c1	915287310	CZKRBPKAFKTZAE-UHFFFAOYSA-N	429.502	1.782	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)c2cc(S(=O)(=O)N3CCCC3)c(C)o2)cc1C	916107955	OUDKFLOVYULAKS-UHFFFAOYSA-N	435.502	1.829	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)N[C@@H]1CCN2CCCC[C@H]12	916638472	GWADOXWYEHNLNJ-RTBURBONSA-N	449.577	1.432	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2ccc(Cl)cc2O)cc1S(=O)(=O)NC1CC1	918357898	FTRFLRYLVRIWAM-UHFFFAOYSA-N	439.877	1.570	50	20	IDGD	
CS(=O)(=O)c1ccc(Br)c(S(=O)(=O)NNC(=O)C2CCCC2)c1	919957150	FLAHIWPCFXQXRN-UHFFFAOYSA-N	425.326	1.352	50	20	IDGD	
C[C@@H]1CCCC[C@@H]1CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	920241851	HAUMFFZBCRIEAL-NVXWUHKLSA-N	438.550	1.478	50	20	IDGD	
Cc1ccccc1-n1nc(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c2c1CCC2	920884937	UMXBAQQITQEICA-UHFFFAOYSA-N	428.456	1.720	50	20	IDGD	
Cc1nn([C@@H]2CCS(=O)(=O)C2)c(Cl)c1C=NNC(=O)Cc1nc2ccccc2n1C	1248410441	GPFXFUBFZSLJQA-CYBMUJFWSA-N	448.936	1.784	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)C(=O)c2cnn(C(C)(C)C)c2)cc1	1317892574	WRQBLCIATOOLHU-UHFFFAOYSA-N	441.517	1.703	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)Cc1ccc(S(=O)(=O)CCO)cc1	1320865979	RVOMEAPHMDPEOY-CYBMUJFWSA-N	440.905	1.263	50	20	IDGD	
COC(=O)c1csc(S(=O)(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)c1	1339205053	QFCJRCDCJAKHNI-UHFFFAOYSA-N	447.535	1.491	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc[nH]1)C2	1778090951	IVBKCCKCLMPGHU-GULKHOJOSA-N	440.504	1.276	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@]2(C1)CN(C(=O)c1[nH]cnc1-c1cccnc1)CCO2	1779298783	NZNICJGQVXONHE-NRFANRHFSA-N	443.580	1.767	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cccc(C(F)(F)F)n3)C2)C1	1779514389	CPTMTPDJZTWVOZ-SJCJKPOMSA-N	435.830	1.798	50	20	IDGD	
COc1cc(F)c(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](O)CCl)C3)c(F)c1	1780962106	GIDZJLUSVIDNKM-JXXFODFXSA-N	446.878	1.701	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1C[C@@]13C(=O)Nc1ccccc13)CCO2	1781221366	CPVGQUXIEFBXCQ-QDGJQWLKSA-N	431.920	1.744	50	20	IDGD	
CN(C)c1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@](C)(Cl)CCl)C3)C2)nc1	1781228608	VRXOMFVXGIQUIO-MOPGFXCFSA-N	429.348	1.827	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)c3cnc4snnc4c3)CCO2)C1	1781231088	GHKNRBLLOCSWGQ-IRXDYDNUSA-N	444.344	1.766	50	20	IDGD	
CC(C)(C)n1cc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](F)Br)C3)C2)nn1	1781335161	VAPCCFBNKJWSRD-LRDDRELGSA-N	432.294	1.167	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnc3ncccn13)C2)C(Cl)Cl	1782217669	WHHNLHCUUGKEQH-FZKQIMNGSA-N	426.304	1.661	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)[C@@H](C)Cn3ccnc3)CCO2)C1	1783354913	YPGFMTBKMXWPOB-RLFYNMQTSA-N	427.343	1.523	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)CN3CCCCC3=O)C2)C1	1783759110	BDHJLYGIEZJGDC-KBXCAEBGSA-N	430.343	1.002	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)CCc3cccc([N+](=O)[O-])c3)CCO2)C1	1783871224	OEKFWGCCHGRQQA-PXNSSMCTSA-N	439.896	1.611	50	20	IDGD	
CC(C)=NO[C@@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]2C1	1783971670	DNVCIPPNNYPCHZ-QXKUPLGCSA-N	432.359	1.798	50	20	IDGD	
COc1ccc(F)c(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)c1	1785017315	AWFRQQKIUIJDSG-RHSMWYFYSA-N	433.249	1.968	50	20	IDGD	
Cc1nc(N)sc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCBr)[C@H]2C1	1786406014	MBANNUTVXGPLCF-SRVKXCTJSA-N	431.356	1.412	50	20	IDGD	
Cc1cc(C)n(CC(=O)Nc2ccc(C3(NC(=O)c4ccc(B(O)O)cc4)CCC3)cc2)n1	1786893159	BPXANIWCYALHIE-UHFFFAOYSA-N	446.316	1.628	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3CN(C(=O)OC(C)(C)C)C3)[C@H]2C1	1788118302	RAMZSMFUJIJIJX-HJWJTTGWSA-N	443.972	1.850	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)[C@@H]3C[C@H]4CC[C@@H]3O4)CCC2)cc1)c1ccc(B(O)O)cc1	1788143563	NMAZULPBRBIDFG-NJYVYQBISA-N	434.301	1.682	50	20	IDGD	
CCn1nccc1C(=O)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1	1788146026	UKPNUEGHEHFSNW-UHFFFAOYSA-N	432.289	1.644	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)[C@H]3[C@H]4SC=C[C@H]43)CCC2)cc1)c1cccc(B(O)O)c1	1788150334	CXRKKODKMXNPKR-ZCNNSNEGSA-N	434.326	1.989	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21)[C@@H]1ON=C(c2ccccc2)O1	1788521667	FZCNJFABFKWKGP-MNUAXYBXSA-N	442.299	1.505	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(OC)cc3O)[C@H]2C1	1789483401	ZPLJXBKVSHENAK-PTOXDTDZSA-N	426.897	1.248	50	20	IDGD	
O=C(CC(=O)Nc1ccc(F)cc1)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21	1789683897	SICLGWPMGXCRCF-CQDKDKBSSA-N	446.306	1.938	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4c(c3)C(=O)CC4)[C@H]2C1	1790385668	GZKXROUUGSHJMG-BOLBYERCSA-N	434.920	1.663	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cn4c(F)cccc4n3)[C@H]2C1	1790423689	RXLUWHDSJKLNFD-YXWQFLTLSA-N	438.887	1.321	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3ccc(C)nc3C)[C@H]2C1	1791498856	YXWUXCLUXUEVFN-MUGJNUQGSA-N	437.968	1.865	50	20	IDGD	
C[C@@H](NNc1ccccc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@](C)(Cl)CCl)C2	1792507898	BZLBMEPXYZZYDF-YKORFQDJSA-N	443.375	1.818	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2)c1c(F)ccnc1Cl	1794236454	ULPJPWVNCDDLIQ-WDAIWFPHSA-N	434.693	1.862	50	20	IDGD	
CC(C)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ncn(-c2cccc(F)c2)n1	1794287125	DXDYNEVHELQBID-XOIINTDNSA-N	449.914	1.875	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnc(OCF)cn1	1794409471	CLYQTLZWVUXTHP-NWJSVONSSA-N	445.289	1.159	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](N)c1cccc(Cl)c1	1795630503	YMPBRQNZQJSSGT-IMPMIVQMSA-N	430.332	1.183	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(C)(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Cl)C1	1796365458	SIPVJVLOZUQLII-CRWXNKLISA-N	433.908	1.367	50	20	IDGD	
C[C@@H](O)[C@H](NC(=O)c1ccccc1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](F)Cl	1796804171	HOQAIKCBPDQFJT-KFTDAMQQSA-N	425.888	1.338	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2n(n1)CCCO2	1797438833	DXMPFQYANKFFTM-OQMKEHIESA-N	441.326	1.042	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C1\C(=O)Nc2ccccc21	1798349433	NCFDFYLADNETME-KXBHIGINSA-N	439.516	1.033	50	20	IDGD	
Cc1ccncc1CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnccc1C(=O)NN	1798440793	SKYBNCCCMLQXSF-BCDXTJNWSA-N	436.516	1.273	50	20	IDGD	
C[C@@H]1C[C@]1(C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1799158691	PRWOJHNXYOGHLQ-ZLXUVUDQSA-N	443.972	1.754	50	20	IDGD	
Cn1ncc2c(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@@H](F)Br)cccc21	1799347256	JYADTCUQWSFNTQ-OXUXUCFPSA-N	439.285	1.467	50	20	IDGD	
O=C([C@@H](F)Br)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(Cl)(Cl)Cl	1800585251	XOPFJNAGGDXJNY-ULAWRXDQSA-N	426.497	1.637	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c(c1)OCCO3)C2	1800758355	XOQCPOLLETWYSK-DPYKFYPSSA-N	439.306	1.444	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnc2c(c1)NC(=O)CS2	1801079330	LAJNNUPJGNNIOJ-XJFOESAGSA-N	438.937	1.631	50	20	IDGD	
C[C@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCC(=O)NN(C)C)C2)[S@@](=O)c1ccccc1	1801274579	BYSQYGMHLGEHLT-KTODCTLPSA-N	448.589	1.194	50	20	IDGD	
O=C(Cc1cnc2ccccn12)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1	1803097370	JEVMVERFYSLOOO-DJPFJPOOSA-N	441.919	1.578	50	20	IDGD	
Cc1cccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)c1Cl	1803619683	WFWIVWXSVXCOAB-BCDXTJNWSA-N	426.709	1.894	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1cccs1	1805385718	UUDDNBIKWFEOFB-XLIONFOSSA-N	435.314	1.456	50	20	IDGD	
N=C(N)SCC(=O)N1CC[C@H](CNC(=O)CCBr)[C@H]1c1cccnc1	1806341179	ZRNQWUUTVNWFCD-IUODEOHRSA-N	428.356	1.499	50	20	IDGD	
C[C@H](CC(N)=O)C(=O)N1CC[C@H](CNC(=O)CCBr)[C@H]1c1cccnc1	1806341712	FKRLJPOEWLYBIH-SUYBPPKGSA-N	425.327	1.384	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)nc1	1807369659	RKHQVXLTIGSPJB-KNQAVFIVSA-N	444.300	1.098	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)cn1	1807369711	SEUAQVGMXRDZDG-KNQAVFIVSA-N	444.300	1.098	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1	1807989346	AVCDVAQFMLLSSM-SCLBCKFNSA-N	449.305	1.992	50	20	IDGD	
COCCOCC(=O)N1CC[C@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]1c1cccnc1	1808295891	MWUSTTNQHWIGEY-SUMDDJOVSA-N	432.348	1.987	50	20	IDGD	
Cc1c[nH]cc1C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1808587632	DKLOIMFXTKSADM-UWJYYQICSA-N	426.521	1.411	50	20	IDGD	
Cc1ccc(CC(=O)N2CCCC3(CCN(C(=O)c4cccc(B(O)O)c4)CC3)C2)cc1	1809278976	AHEXEPDWWWFHPY-UHFFFAOYSA-N	434.345	1.762	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1CCN(C(=O)CCn2ccnn2)[C@@H]1c1cccnc1	1810549218	YOUVUNDIUMBZHO-FXAWDEMLSA-N	430.585	1.621	50	20	IDGD	
Cc1ccc(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)cc1	1811959112	IHQBRDDNXJVKRH-FYYLOGMGSA-N	443.312	1.703	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1	1812773764	IZERXCZMQNCLTQ-BYNSBNAKSA-N	432.746	1.861	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2ccsc2)[C@H]1c1cccnc1	1813070924	MKNWRWITNZAUDL-JXFKEZNVSA-N	429.546	1.836	50	20	IDGD	
O=C(CNC(=O)C(F)(F)F)NC[C@H]1CCN(C(=O)C(Cl)Cl)[C@@H]1c1cccnc1	1813100926	KAFSQYWXMPTXAQ-ZYHUDNBSSA-N	441.237	1.570	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H](CNC(=O)[C@H]2CCNC(=O)C2)[C@H]1c1cccnc1	1813139217	WVYURUSGJAPWDW-XAUMDUMWSA-N	432.597	1.465	50	20	IDGD	
CCn1nccc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1	1816562215	RNJVKWWQSHDZKR-OAHLLOKOSA-N	430.513	1.305	50	20	IDGD	
Cc1nnsc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1	1818256868	LFGBEAYCEPSQTO-ZDUSSCGKSA-N	434.526	1.249	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cnccc3C(=O)NN)n[nH]2)on1	1819402122	NXXNNHFIZSBKDX-OAHLLOKOSA-N	438.448	1.324	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](O)NC(=O)OCC)sc2C1	1819458118	IBOFLJSTFKPTIN-AMJWSMQMSA-N	432.930	1.527	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccncc1)CC2	1819795636	PVDWGPHTZMDIJU-GFCCVEGCSA-N	437.485	1.076	50	20	IDGD	
CN[C@H](CC(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@](C)(Cl)CCl)n[nH]1)C(=O)O	1820865114	OHNBDPWXADUEKS-BWACUDIHSA-N	434.324	1.701	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](O)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](F)Cl)[nH]n1	1821218839	JFXKQQKWQQZRDH-VHRBIJSZSA-N	433.868	1.779	50	20	IDGD	
O=C(N[C@@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1)c1n[nH]cc1[N+](=O)[O-]	1823006487	BCOMJDMOPVWHLB-GPXNAGAYSA-N	447.246	1.691	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)[C@@H]1CCCSC1	1823453301	SFKQZKXTONIMKR-CRAIPNDOSA-N	442.350	1.539	50	20	IDGD	
CN(CC(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H](O)CCl)CC1)C(=O)c1ccccc1	1824381637	RDDATMFKXPKCQN-UXHICEINSA-N	449.979	1.978	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccnnc1O)CC2	1825643125	ZQQXHHNPHDTZMB-SFYZADRCSA-N	426.296	1.648	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](C)Cn1cncn1)CC2	1825999922	GPGHBMFOADFTJB-TUAOUCFPSA-N	426.930	1.237	50	20	IDGD	
O=C(N[C@@H]1CCc2nc(NC(=O)C(Cl)Cl)sc2C1)c1cc2n(n1)CCNC2=O	1826096383	RXRWAKVJPZIQNW-SSDOTTSWSA-N	443.316	1.113	50	20	IDGD	
O=C(O)c1cnncc1C(=O)N[C@H]1CCc2nc(NC(=O)C(Cl)Cl)sc2C1	1826099290	FYYITUDLBMOVHI-LURJTMIESA-N	430.273	1.661	50	20	IDGD	
Cc1ncoc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827056381	UQRQVCLSTXUJNE-LJQANCHMSA-N	425.294	1.210	50	20	IDGD	
CCOC(=O)C(C)(C)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](Cl)COC)CC2	1828215410	VHFOGNPXGQAQFV-QWRGUYRKSA-N	431.942	1.898	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCCC[C@H]1C1CCN(C(=O)CNCP(=O)(O)O)CC1	1829102495	UBVSTFMJSGLXQD-INIZCTEOSA-N	449.561	1.182	50	20	IDGD	
O=C([C@H](O)CCl)N1CCC([C@@H]2CCCCN2C(=O)c2nc(O)n3c2CCCC3)CC1	1829134122	BLZMQBDQWZTIMO-DOTOQJQBSA-N	438.956	1.758	50	20	IDGD	
Cc1nc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)cs1	1830538091	VRNLKLPWFJCBQN-PXAZEXFGSA-N	446.367	1.553	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CN2CCNC2=N)CC1	1831650519	LSCIBXVEJVKOQV-ZFWWWQNUSA-N	428.375	1.229	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(C(N)=O)cc3)C2)C1	1831659838	WGJGYBMJBGMSFQ-UTKZUKDTSA-N	437.924	1.263	50	20	IDGD	
Cc1noc(C)c1CC(=O)N1CCC([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1	1831870467	CTUMLWQCXPESOL-FQEVSTJZSA-N	447.580	1.827	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)/C=C/c3ccco3)CCO2)C1	1833078568	JDUSIXQQOPMSLH-OJBOGMDESA-N	431.316	1.986	50	20	IDGD	
O=C(c1ccnc(C(F)(F)F)c1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1833794811	QSZMEJRDBKOXKO-CJNGLKHVSA-N	439.793	1.705	50	20	IDGD	
O=C(c1cnoc1C1CC1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1834617412	PSQWUTPMDNKYGZ-WMLDXEAASA-N	446.273	1.313	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3n[nH]cc3[N+](=O)[O-])CC2)CC1	1835867045	HMHXZKMTLXLZSL-OAHLLOKOSA-N	440.932	1.911	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC(OC2CCN(C(=O)c3cnc(O)[nH]3)CC2)CC1	1836672933	GRQHQGVOFOXFJH-LBPRGKRZSA-N	443.342	1.759	50	20	IDGD	
O=C(/C=N/N1CCCCC1)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836717312	TUULZAQBXMKPQB-LUJYGJGBSA-N	428.961	1.056	50	20	IDGD	
C=C[C@H](O)C(C)(C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)CBr)C2)C1	1837391335	LDRXRBBFJINYOJ-VCBZYWHSSA-N	447.370	1.047	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(Cl)ncn3)C2)C1	1837715324	KAIDPQBYQHNQGI-SFHVURJKSA-N	442.976	1.052	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)CO[Si](C)(C)C)CCO2	1837715506	UPOGSKNHJOYOFV-SFHVURJKSA-N	432.666	1.146	50	20	IDGD	
O=C(c1cc(-c2ccncc2)[nH]n1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1838011219	NJUNGTLLAQFRGM-APWZRJJASA-N	437.859	1.076	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(C)nn3C(F)F)CCO2)C1	1838714572	MIEZOPCWZJJEPM-UGSOOPFHSA-N	434.871	1.674	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnn4cc(C)cnc34)C2)C1	1839146349	XKMRGADFUSHRHZ-JXFKEZNVSA-N	435.912	1.125	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccnc(F)c3)C2)C1	1839150195	FIKRSLODVWPIPE-ZWKOTPCHSA-N	434.295	1.527	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)OC(C)C)C2)C1	1839965146	OCYZMWCNFCQUQJ-RLFYNMQTSA-N	435.359	1.430	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(F)cc(Cl)c3)C2)C1	1840156876	XDHQHRBLRVFJIY-QFBILLFUSA-N	449.306	1.803	50	20	IDGD	
COc1ccc(CCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)cc1	1840187872	BYKOYPRYSWLUMA-HXUWFJFHSA-N	445.343	1.888	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C1(C#N)CCC1)CCO2	1840812486	UJHQRPSBSDYATN-RDTXWAMCSA-N	428.327	1.168	50	20	IDGD	
O=C([C@@H](F)Cl)N1CCOC[C@@]2(C1)CN(C(=O)C1(c3ccccc3F)CC1)CCO2	1840858664	LEWKCYQJCDXGDD-VQIMIIECSA-N	428.863	1.848	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)Cc2ccc(Cl)c(F)c2)C1	1841208890	FGBQYTDBEQJYTN-UHFFFAOYSA-N	445.882	1.537	50	20	IDGD	
CC(C)NCCC(=O)N1CC2(CCCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C1	1841924534	XLBWVHLSUDBZRY-HNNXBMFYSA-N	430.977	1.710	50	20	IDGD	
CS(=O)(=O)c1cncc(C(=O)N2CCCC23CN(C(=O)CCBr)C3)c1	1842188477	QUPMRHNUODVQJL-UHFFFAOYSA-N	430.324	1.087	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)N2CCCC23CN(C(=O)[C@@H](O)CCl)C3)CC1	1843931117	LJMIVWJOFLSRAW-CVEARBPZSA-N	443.972	1.827	50	20	IDGD	
Cc1cc2nc(C(=O)N3CCCC34CN(C(=O)c3cnccc3C(=O)NN)C4)[nH]c2cc1C	1844216851	QCVYAMJIKQGZIP-UHFFFAOYSA-N	447.499	1.309	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)CC1Cc3ccccc3C1)C2	1844265559	ONTRGVAKMAUEEZ-UHFFFAOYSA-N	433.512	1.307	50	20	IDGD	
C=C[C@@H](O)C(C)(C)C(=O)N1CC2(CCCN2C(=O)c2cc([N+](=O)[O-])ccc2OC(C)=O)C1	1844692721	CJCAEFAMKNZUIU-GOSISDBHSA-N	445.472	1.910	50	20	IDGD	
C=CCNC(=O)/C=C\C(=O)N1CC2(CCCN2C(=O)/C(C#N)=C/c2ccc(F)cc2F)C1	1845870236	VQYUFRDSMRWPFG-CWMABMBHSA-N	440.450	1.934	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@H]1CC(=O)N(Cc3cccs3)C1)C2	1846360984	RBTWFZZYFJOWKD-GDBMZVCRSA-N	439.965	1.554	50	20	IDGD	
O=C(O)CCSSCCNC(=O)CCC(=O)N1CCN(c2ccccn2)CC1	2088599437	VPTKMCDTJOEPBR-UHFFFAOYSA-N	426.564	1.483	50	20	IDGD	
CS(=O)(=O)N1CCC(C(=O)NNC(=O)c2cc(-c3ccco3)nc3ccccc23)CC1	14329514	CJENGVJEZLASBH-UHFFFAOYSA-N	442.497	1.927	50	20	IDGD	
COc1ccc(CNC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1Br	726189416	YNLTXSDWOMPRFG-UHFFFAOYSA-N	446.265	1.578	50	20	IDGD	
C[C@H](NS(=O)(=O)c1ccc(Cl)cc1)C(=O)NNC(=O)[C@H](C)Oc1ccc(F)cc1	726238468	UBURKRVDZLKVRG-RYUDHWBXSA-N	443.884	1.761	50	20	IDGD	
CN(CCCNC(=S)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)c1ccccc1	726438196	RKDJMWOEHWZYPE-UHFFFAOYSA-N	449.602	1.572	50	20	IDGD	
O=C(COc1ccccc1OCC(F)(F)F)NNC(=O)c1ccc(-n2cnnn2)cc1	727672672	LQQHQSFULQZYAF-UHFFFAOYSA-N	436.350	1.443	50	20	IDGD	
CN1C(=O)c2ccc(S(=O)(=O)NNC(=O)c3c(Cl)cccc3Cl)cc2C1=O	727796061	DQWHPKSMYKXMAL-UHFFFAOYSA-N	428.253	1.843	50	20	IDGD	
Cc1c(NNC(=O)NCCC(=O)N2CCN(c3ncccn3)CC2)cccc1[N+](=O)[O-]	728131220	LHDVTPSOBZDQKN-UHFFFAOYSA-N	428.453	1.058	50	20	IDGD	
CN(C)N(C(=O)c1ccc2c(c1)C(=O)N(Cc1ccccc1)C2=O)[C@H]1CCS(=O)(=O)C1	728178446	AURDVOXWKAHBMU-KRWDZBQOSA-N	441.509	1.589	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)c2oc3ccccc3c2CS(C)(=O)=O)c1	728208335	RFTVMWLUQOZIQG-UHFFFAOYSA-N	431.470	1.859	50	20	IDGD	
COc1cc(C=NNC(=O)[C@@H](C)NS(C)(=O)=O)ccc1OC(=O)c1ccccc1F	728435584	FJDKGXHZIRUBNR-GFCCVEGCSA-N	437.449	1.441	50	20	IDGD	
NS(=O)(=O)Cc1ccc(C(=O)NNC(=O)c2cc(F)ccc2Br)cc1	728611101	VAUPGAXHUYPIEZ-UHFFFAOYSA-N	430.255	1.452	50	20	IDGD	
O=C(COC(=O)[C@@H]1CCCN1c1ncnc2sccc12)NNC(=O)c1cccs1	728674890	VTGXNRSZQLDKLY-LBPRGKRZSA-N	431.499	1.726	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)Cn1cc(Br)c([N+](=O)[O-])n1	728704358	FWBDXKGZJHLBQJ-UHFFFAOYSA-N	432.618	1.677	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)c1ccc(OCC(F)(F)C(F)F)nc1	729180999	NCUMVYCWMLOCBM-UHFFFAOYSA-N	434.371	1.613	50	20	IDGD	
CC[C@@H](N=c1nn[nH]n1-c1ccccc1)C(=O)NNC(=O)[C@H](C)Oc1ccccc1F	729283510	UARGZZKPSSWQNB-XJKSGUPXSA-N	427.440	1.029	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc3c(c2)nnn3C)c1	729296263	WYTDNAKRQNVNEK-UHFFFAOYSA-N	430.490	1.074	50	20	IDGD	
Cc1ccc(C(=O)N[C@H](CC(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)c2ccccc2)cc1	729827842	UISSDNDDXWLLBX-RTBURBONSA-N	443.525	1.438	50	20	IDGD	
COCCCNC(=S)N(C)NC(=O)Cc1csc(NC(=O)c2cccs2)n1	731652256	MCKKFQVGMLHFKX-UHFFFAOYSA-N	427.577	1.873	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)CNC(=O)c1cccs1)N1CCC(Cc2ccccc2)CC1	732065825	XFFFKKQRDSBTKU-INIZCTEOSA-N	428.558	1.969	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2cccc(C)c2)c1	740851610	OBZMPFWSINVHNV-UHFFFAOYSA-N	446.529	1.862	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)NCC2CCN(C(C)=O)CC2)cc1Cl	743594371	CHQMBCPWROXPFJ-UHFFFAOYSA-N	427.889	1.951	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=O)Nc2ccc(N(C)C)cc2)n(C)c1	743828407	JPENSUBDECEYMZ-UHFFFAOYSA-N	436.538	1.588	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)CN2CCCN(C(=O)c3cccc(Cl)c3)CC2)cc1	744390410	FUAIDCPYOAZYMI-UHFFFAOYSA-N	439.903	1.821	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)C[C@](O)(c2nc(C)cs2)C(F)(F)F)c1	744888124	CGOKZQGAHGGWDX-KRWDZBQOSA-N	445.419	1.904	50	20	IDGD	
CC(=O)[C@H]1CC(C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)=NN1c1ccccc1	745030033	RVSODHHXELZIGD-LJQANCHMSA-N	433.424	1.086	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)Cc2csc(NC(=O)C(C)(C)C)n2)cc1	745516597	WQEWFPOAYZGTNN-UHFFFAOYSA-N	432.502	1.983	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)N[C@H]2CCCN(CC(F)(F)F)C2=O)cc1OC	746338668	FBMKHANVNDVDLQ-LBPRGKRZSA-N	432.399	1.591	50	20	IDGD	
CC(C)(CNC(=O)NNC(=O)[C@H]1COc2ccccc2O1)c1ccc2c(c1)OCCO2	746733683	YTVMZRACGPLOOC-LJQANCHMSA-N	427.457	1.906	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)NC1CCN(CC(=O)Nc2ccccc2)CC1	746747138	LCYPCPVPGSIBSS-UHFFFAOYSA-N	449.515	1.310	50	20	IDGD	
CC(=O)NCC(=O)N1CCc2cc(C(=O)NNC(=O)c3ccc(Cl)cc3F)ccc21	747329183	DRTTYXFIPYMRSI-UHFFFAOYSA-N	432.839	1.579	50	20	IDGD	
O=C(CN1CCN(C(=O)OCc2ccccc2)CC1)NNC(=O)c1ccc([N+](=O)[O-])cc1	747349058	XGOYQNANMJKUOV-UHFFFAOYSA-N	441.444	1.310	50	20	IDGD	
CN(CC(C)(C)CNC(=O)OC(C)(C)C)C(=O)NNC(=O)CNC(=O)c1cccs1	747503084	QYFOEAMEVFJCSA-UHFFFAOYSA-N	441.554	1.701	50	20	IDGD	
C[C@@H]1CCC[C@@H](C)N1C(=O)COc1ccc(C(=O)NNC(=O)C(=O)N2CCCC2)cc1	748246603	MLXUEELHQAHIDL-HZPDHXFCSA-N	430.505	1.238	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)c2ccc(Br)c(S(C)(=O)=O)c2)n1	749160996	IRKJHOUAUPJTAS-UHFFFAOYSA-N	429.296	1.127	50	20	IDGD	
CSCC[C@H](NC(=O)c1ccc2ccccc2n1)C(=O)NNC(=O)N1CCOCC1	749220272	VEDOGTPECLDDFB-KRWDZBQOSA-N	431.518	1.159	50	20	IDGD	
N#C/C=C(/c1ccc([N+](=O)[O-])cc1)N1CCN(S(=O)(=O)c2ccc(C(N)=O)o2)CC1	750036528	QLLSJPDSMOMYLZ-CHHVJCJISA-N	431.430	1.158	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(S(=O)(=O)NCC(F)(F)F)cc1)c1ccccc1	751259738	FCWMPADWYBHZAT-UHFFFAOYSA-N	437.421	1.151	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(C(F)(F)F)cc1Cl)N[C@@H]1CCS(=O)(=O)C1	751540923	NCKMOVAXKDVFRE-MRVPVSSYSA-N	435.833	1.038	50	20	IDGD	
O=C(C[C@@H]1CSCCS1)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	751549179	RCPKOCWXARXKDV-CQSZACIVSA-N	429.589	1.471	50	20	IDGD	
Cc1onc(-c2cccc(Br)c2)c1C(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1	751561643	DJEJXPOXGHYIQU-NSHDSACASA-N	442.291	1.608	50	20	IDGD	
Cn1c(O)nc2ccc(C(=O)NNc3ccccc3S(=O)(=O)N3CCOCC3)cc21	752032337	BABIXVWCTUCLPR-UHFFFAOYSA-N	431.474	1.057	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCc1ccnc(OC(C)C)c1	752126816	LPSPRDAEBBPMLJ-UHFFFAOYSA-N	434.522	1.615	50	20	IDGD	
C[C@H](C[S@@](C)=O)NC(=O)/C(C#N)=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	753152148	GSOLHWUWYUABSQ-NVVWVFFXSA-N	447.948	1.869	50	20	IDGD	
Nc1nc(Cl)cc(NNC(=O)c2cccn3c(I)cnc23)n1	753451294	HSAYCTQOMANZAE-UHFFFAOYSA-N	429.609	1.721	50	20	IDGD	
NC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)NNc1ccc(C(F)(F)F)nn1	755191553	IYLUVZSOJRTWHT-NSHDSACASA-N	426.355	1.109	50	20	IDGD	
O=C(Cc1cc[nH]n1)NNC(=O)c1csc(S(=O)(=O)N2CCc3ccccc3C2)c1	755288076	DPUXONSMCBWCAC-UHFFFAOYSA-N	445.526	1.222	50	20	IDGD	
CC(=O)Nc1ccc(NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1	755494174	IBKGRAXZAKNQLP-UHFFFAOYSA-N	433.490	1.427	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccccc2C(=O)N2CCCC2)c1	755536780	UNVJRBHSGTWFNC-UHFFFAOYSA-N	430.486	1.793	50	20	IDGD	
CCCc1cnc(NC(=O)C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)s1	756165550	ZBFJJDBQKCSDIV-UHFFFAOYSA-N	444.561	1.394	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)Nc2cccc(S(=O)(=O)NC3CC3)c2C)c1	756707689	NFPYXZOLCGBXTK-UHFFFAOYSA-N	448.501	1.919	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNC(=O)Nc2ccn(CCS(C)(=O)=O)n2)cc1	756762849	WCQDCJVRWJOVKV-UHFFFAOYSA-N	437.522	1.819	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1cn(C(C)(C)C)nc1-c1ccccc1Cl	758039614	MLMTWQXKNNUDTG-NSHDSACASA-N	441.941	1.657	50	20	IDGD	
CCCc1c(C(=O)NNC(=O)C(=O)Nc2ccccn2)nnn1-c1cccc(Cl)c1	758835563	XJXWFLAHSVMLSP-UHFFFAOYSA-N	427.852	1.668	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2F)c1-n1cccc1)C(=O)Nc1ccccn1	758840877	SJTFJHQARQWAAG-UHFFFAOYSA-N	433.403	1.597	50	20	IDGD	
COCCOc1ccc(-n2nc(C)c(C(=O)NNc3ccc(C(=O)OC)cn3)n2)cc1	759729498	VYUUDLYBIXSUHY-UHFFFAOYSA-N	426.433	1.539	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(Cl)c(C[S@](C)=O)c2)cc1	763820816	JEZSODKOOZPSPD-LJAQVGFWSA-N	437.905	1.692	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)C(=O)Nc1ccc(OCC(F)(F)F)cc1	763922404	WSIWZWXNLCOKKX-UHFFFAOYSA-N	449.349	1.003	50	20	IDGD	
CCOC(=O)c1cc(-c2ccccc2)ccc1NC(=O)C(=O)NNC(=O)c1cnccn1	764023686	CVFULLYFPXWDIE-UHFFFAOYSA-N	433.424	1.720	50	20	IDGD	
CCC(CC)NC(=O)[C@@H]1CN(C(=O)C(=O)NNC(=O)CC2CCCC2)c2ccccc2O1	764185010	UQCFDEQXVRZHQC-IBGZPJMESA-N	444.532	1.813	50	20	IDGD	
CCC(CC)NC(=O)[C@H]1CN(C(=O)C(=O)NNC(=O)CC(C)(C)C)c2ccccc2O1	764197542	DFGHFBXCIUVNRN-QGZVFWFLSA-N	432.521	1.669	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)C(=O)Nc2cccc(OCC#N)c2)c1	764233225	TXYBWTFKDPOBNI-UHFFFAOYSA-N	447.245	1.760	50	20	IDGD	
O=C(Cc1ccccn1)NNC(=O)C(=O)Nc1ccc(NC(=O)C2CC2)cc1C(F)(F)F	764263271	DKLIBRGXMYCPFW-UHFFFAOYSA-N	449.389	1.778	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)ccc1O)C(=O)Nc1ccc(-c2cc[nH]n2)cc1	764276786	FYAWTJPSMDVXKR-UHFFFAOYSA-N	444.245	1.945	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)C(=O)Nc1ccc(N2CCCC2=O)cc1	764350836	MDKYXHHRSIHHJI-UHFFFAOYSA-N	432.440	1.399	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2ccnn2C2CCCC2)n[nH]1	764378318	YEYNSYLNWZZURP-UHFFFAOYSA-N	437.460	1.797	50	20	IDGD	
COC(=O)c1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)c1cc(-c2cccs2)[nH]n1	764381833	AHGLRCWDKVISBG-UHFFFAOYSA-N	447.860	1.978	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(C)c(C)c3)[nH]n2)cn1C	764386222	BZAOYNKGJQKWBI-UHFFFAOYSA-N	438.444	1.218	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1cccc(NC(=O)C2CC2)c1	764396860	CVIVPUGWSCWBQZ-UHFFFAOYSA-N	442.497	1.922	50	20	IDGD	
N#Cc1ccc(Cn2cnc(NC(=O)C(=O)NNC(=O)c3ccc(Cl)cc3F)n2)cc1	764413425	QMOFVDAUCDGEBT-UHFFFAOYSA-N	441.810	1.390	50	20	IDGD	
O=C(NNC(=O)[C@H]1COCCO1)C(=O)Nc1cc(C(F)(F)F)ccc1N1CCCCC1	764423609	CJTRYRLISQCSEL-OAHLLOKOSA-N	444.410	1.197	50	20	IDGD	
Cn1cc([N+](=O)[O-])c(C(=O)NNC(=O)c2nc(-c3ccccc3)n(-c3ccccc3)n2)n1	765467210	BXEITUVIZWKJQQ-UHFFFAOYSA-N	432.400	1.651	50	20	IDGD	
NC(=O)COc1ccc(Cl)cc1S(=O)(=O)NNC(=O)CCCc1ccccc1	766321330	LMQZSVCEQOQPFZ-UHFFFAOYSA-N	425.894	1.537	50	20	IDGD	
CCCC(=O)N1CCCC[C@H]1C(=O)NNC(=O)CN1CCN(Cc2ccc(C)cc2)CC1	766641898	NYIHVVNDOOFAKE-NRFANRHFSA-N	443.592	1.441	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1ccncc1Br	766651852	NSNPRWPDSQSJHW-UHFFFAOYSA-N	446.305	1.063	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)C(=O)Nc1ccccc1	766669270	PYRRWFIATFTDJO-UHFFFAOYSA-N	429.908	1.244	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCN([C@@H](C)c3nccs3)CC2)cc1OC	767013475	WVBHYOFNVKXLEK-AWEZNQCLSA-N	433.534	1.300	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)Cc1c(C)nc2c(c(C)nn2C)c1C	767285076	LGSWGZQUYHYDQJ-UHFFFAOYSA-N	437.500	1.678	50	20	IDGD	
COc1ccc(CN2CCCN(C(=O)NNC(=O)COCc3ccccc3)CC2=O)cc1	767326330	ZMSBDDSBSVEICI-UHFFFAOYSA-N	440.500	1.687	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@H](C(=O)NNC(=S)Nc3ccccn3)C2)s1	768577594	FXHVBGFCKPFNDZ-ZDUSSCGKSA-N	439.588	1.870	50	20	IDGD	
CC/C=C(\C)C(=O)N1CSC[C@H]1C(=O)NNc1c(OC)cccc1S(C)(=O)=O	768630524	SYYNEKVTHTXRJK-WHGQRRHOSA-N	427.548	1.800	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)Cc1cccc(NS(C)(=O)=O)c1	768636184	OQOXDVOQXKDKDE-UHFFFAOYSA-N	427.504	1.156	50	20	IDGD	
C[C@H](O)CNC(=O)/C(C#N)=C/c1cn(CCC(N)=O)nc1-c1cccc(Br)c1	769083757	PRZVHJADNUIIQH-FUEWVNAISA-N	446.305	1.592	50	20	IDGD	
Cc1noc(C)c1S(=O)(=O)NCC(=O)NNC(=O)c1cc2c(s1)CCCCCC2	769280778	RHZGMWNBKWNTOL-UHFFFAOYSA-N	440.547	1.751	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)c3ccc(=O)n(-c4ccc(F)cc4)n3)nc21	770966560	SADSZSAJVXOPHD-UHFFFAOYSA-N	438.423	1.729	50	20	IDGD	
O=C(CN1C(=O)N[C@@]2(CCc3ccccc32)C1=O)NNc1ccnc(Br)c1	771547044	LTBPIPBTTYZUPI-GOSISDBHSA-N	430.262	1.681	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)[C@@H]1CCCN1C(=O)c1cc(Cl)ccc1OC	771996024	ZBVUQZODUIGTBV-RISCZKNCSA-N	425.869	1.442	50	20	IDGD	
CCOC(=O)CON=C(C(=O)NNc1nc(-c2ccc(Cl)cc2)no1)c1cc[nH]n1	772278410	SHCNQUUSSXAAJV-UHFFFAOYSA-N	433.812	1.540	50	20	IDGD	
O=C(NNC(=O)c1cccc(Br)c1)N[C@@H]1CCCN(CC(F)(F)F)C1=O	773032583	TZFUVLRASDGTRS-LLVKDONJSA-N	437.216	1.946	50	20	IDGD	
Cc1ccn2c(=O)c(C(=O)NNC(=O)[C@H]3CCCN(C(=O)OC(C)(C)C)C3)cnc2c1	773410640	FCAZEYUNSYYBDH-AWEZNQCLSA-N	429.477	1.411	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1-n1cnnn1	773422886	ZMUQNSDBIURPEZ-AWEZNQCLSA-N	445.480	1.079	50	20	IDGD	
CN(C)C(=O)[C@H]1CC[C@H](CNC(=O)NNC(=O)c2ccc(Br)cc2Cl)O1	774699690	HSENOCMPWIYQKS-ZWNOBZJWSA-N	447.717	1.682	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)F)cc1)Nc1ccnn1[C@@H]1CCS(=O)(=O)C1	776052961	CDCUTVVQGRLLBU-LLVKDONJSA-N	449.461	1.388	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)[C@H](c2cnn(C)c2)N(C)C(=O)OC(C)(C)C)cc1	776327853	UCBIVSHGIOQHLU-SFHVURJKSA-N	430.509	1.896	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)c2c[nH]nc2-c2cnn(C)c2)c2ccccc2c1=O	780171761	DWQPNPWIOGQTFP-UHFFFAOYSA-N	448.487	1.785	50	20	IDGD	
O=C(NNc1ccc(C(F)(F)F)cn1)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(F)cc1	781032377	QGXWSHRLNHQRJA-OCCSQVGLSA-N	448.398	1.507	50	20	IDGD	
COc1ccc(CN(CC(=O)NNC(=O)c2ccc(F)cc2)[C@@H]2CCS(=O)(=O)C2)cc1	781349739	XOEWFSHSDHWCQC-GOSISDBHSA-N	449.504	1.285	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)Nc1cc(Br)cnc1-n1cccn1	782065916	XNOBCHBYKFDDQP-JTQLQIEISA-N	427.259	1.234	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(NC(=O)C(=O)NNc2ncncc2Cl)ccc1Cl	782158710	ILYFLISAHLKOJG-UHFFFAOYSA-N	433.277	1.116	50	20	IDGD	
COc1cccc(/C=C(/C#N)C(=O)O[C@H](C(=O)N[C@]2(C)CCS(=O)(=O)C2)C(C)C)c1	782445006	BNIBDXBDQNJBHP-UJJDTUCNSA-N	434.514	1.863	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2cc(N3CCCS3(=O)=O)ccc2Cl)cc1	783034544	BQFGXHYMIKMTBH-UHFFFAOYSA-N	438.893	1.970	50	20	IDGD	
COC(=O)c1cccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)c1	783407500	CJXVUKLDTADYFL-UHFFFAOYSA-N	445.375	1.849	50	20	IDGD	
NC(=O)COc1cccc(NC(=O)C(=O)NNc2ccc(OCC(F)(F)F)cc2)c1	784369304	YGDZTYVVXZNRLW-UHFFFAOYSA-N	426.351	1.574	50	20	IDGD	
CNS(=O)(=O)CCNC(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccc(Cl)cc1	784703818	DBHOJQIZBLMTOA-PTNGSMBKSA-N	446.920	1.690	50	20	IDGD	
COCCNC(=O)c1ccc(NC(=O)C(=O)NNc2cccc([N+](=O)[O-])c2)cc1Cl	784827381	BXPFLKCEWSEVQA-UHFFFAOYSA-N	435.824	1.706	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)F)cc1)C(=O)Nc1cncc(Br)c1	784835861	XFOAYMSUAFVYQM-UHFFFAOYSA-N	449.233	1.922	50	20	IDGD	
CCNC(=O)N(C)NC(=O)C(=O)Nc1cnc2c(c1)C[C@@H](NC(=O)OC(C)(C)C)CC2	784916552	YVVLDUQWEBCVRI-ZDUSSCGKSA-N	434.497	1.095	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)ccc1Cl	785060855	PRVPQILCTJBFQV-UHFFFAOYSA-N	429.820	1.103	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2ccccc2C(=O)NC(C)(C)C)n1	785226146	QOQOLRFLIWOTJU-UHFFFAOYSA-N	427.509	1.933	50	20	IDGD	
CCN1CCN(c2cccc(NC(=O)C(=O)NNc3nccc(N(CC)CC)n3)c2)CC1	785226518	IEGOKMLEDMRINT-UHFFFAOYSA-N	440.552	1.547	50	20	IDGD	
N#C/C(=C/c1ccccc1)C(=O)OCC(=O)NCc1ccc(C(=O)N2CCOCC2)cc1	785345391	ONNFQYPIHAVEIT-STZFKDTASA-N	433.464	1.926	50	20	IDGD	
CN(C)CCS(=O)(=O)c1ccccc1C(=O)NNC(=O)NCc1ccc(Cl)cc1	787434609	WELMSMQGYXQDKX-UHFFFAOYSA-N	438.937	1.820	50	20	IDGD	
CN1CCN(C(=O)NNC(=O)CCC[S@@](=O)c2ccc(Br)cc2)CC1	788168877	GVEKTKITTDZXQX-RUZDIDTESA-N	431.356	1.325	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)[C@H](C)[C@H](C)S(C)(=O)=O)c2ccccc2c1=O	788266538	XERBFJVUBLDQHO-KGLIPLIRSA-N	436.534	1.417	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NN=C2CCC[C@H](S(C)(=O)=O)C2)c1	788408237	JHNOLYQXIFXGRS-INIZCTEOSA-N	429.564	1.790	50	20	IDGD	
Cc1ccc(F)c(S(=O)(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)c1	788914571	CYIYEBFASLUTDY-UHFFFAOYSA-N	430.502	1.932	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)c(OC(C)C)c1	789736092	VJSBFUKAVDFOMM-UHFFFAOYSA-N	441.893	1.858	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)CCc2cccc(N(C)C)c2)cc1	792018017	NRLSFVBTJICIJE-UHFFFAOYSA-N	432.546	1.462	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)Cc2c[nH]c3ccccc23)cccc1NC(=O)N(C)C	792352699	GRMVNAFQRRTNHL-UHFFFAOYSA-N	436.472	1.898	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Cc2ccc3c[nH]nc3c2)c1	792774395	RKQIVPDBQKRPBM-UHFFFAOYSA-N	429.502	1.597	50	20	IDGD	
Cn1ccc2ccc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc3ccccc3)cc2c1=O	793024148	AYAQYJMUQIDQGK-UHFFFAOYSA-N	430.367	1.296	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2scnc2C)n(-c2nc3ccccc3s2)n1	793025493	LYCZQVNOKOBBPP-UHFFFAOYSA-N	441.498	1.955	50	20	IDGD	
O=C(CNS(=O)(=O)c1c[nH]c2ncccc12)NNC(=O)c1ccc(Cl)cc1F	796918123	XEFOBUNNXSBSQW-UHFFFAOYSA-N	425.829	1.095	50	20	IDGD	
COC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2ccc(C)cc2O)c1OC(C)C	799258600	HIVPMZSCCPEEPE-UHFFFAOYSA-N	429.429	1.674	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)c2nnn(CCOc3ccc(F)cc3)c2C)cn1	800330323	SFPVSTMZBHFVRL-UHFFFAOYSA-N	445.480	1.840	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)CN2C(=O)N[C@@](C)(c3ccc(C)cc3)C2=O)cc1	802057277	PAVKQQLAWBFZJB-NRFANRHFSA-N	425.445	1.624	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)C2CCN(C(=O)N3CCCC3)CC2)cc1	802063727	PBUJCGLILCQEKG-UHFFFAOYSA-N	437.522	1.171	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@H]2C(=O)NNc2ccc(-n3ccnc3)nn2)c(OC)c1	804957696	QRYFOOLEJBDOKF-INIZCTEOSA-N	437.460	1.427	50	20	IDGD	
CN(Cc1nc(-c2cccs2)no1)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	805067909	IJLYHORQQSXOGJ-UHFFFAOYSA-N	442.505	1.677	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)N[C@@H]1CCCN(C(=O)CCC(F)(F)F)C1	805140893	RBOSAZUUNAVDMA-OAHLLOKOSA-N	430.427	1.867	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1csc(-c2ccccc2)n1	806973532	QIAPQFFGESMPQZ-UHFFFAOYSA-N	426.454	1.984	50	20	IDGD	
COc1ccc(CS(C)(=O)=O)cc1NC(=O)C(=O)NN=c1sc2ccccc2n1C	806997817	WRAKTWPGRUARQV-UHFFFAOYSA-N	448.526	1.364	50	20	IDGD	
Cc1cc(F)ccc1NNC(=O)C(=O)N1C[C@@H](C[C@@H]2COCC(=O)N2)c2ccccc21	807001989	OQCYGFDHMCUJIB-GDBMZVCRSA-N	426.448	1.613	50	20	IDGD	
COc1ccc(C(=O)N[C@@H](C(=O)NNC(=O)N2CCN(C)CC2)c2ccccc2)cc1	807379860	GUOBJILYJIXCAQ-LJQANCHMSA-N	425.489	1.155	50	20	IDGD	
CN1CCN(C(=O)NNC(=O)c2ccc3c(c2)CCN(C(=O)OC(C)(C)C)CC3)CC1	807380964	YBOFAQGQDKXMJA-UHFFFAOYSA-N	431.537	1.624	50	20	IDGD	
CCOC(=O)C1CCN(S(=O)(=O)NNC(=O)c2ccc(OCCC(C)C)cc2)CC1	808069380	VEDQFORGKCUSTA-UHFFFAOYSA-N	441.550	1.866	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)Cc1sc(N2CCOCC2)nc1-c1ccccc1	810363888	GVDBBMLETBQIOU-UHFFFAOYSA-N	426.502	1.682	50	20	IDGD	
Cc1cc(C(=O)NCC(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)ccc1[N+](=O)[O-]	812733369	PJVUWDMGKXJEIL-UHFFFAOYSA-N	435.462	1.027	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1ccc(C)c(S(=O)(=O)C2CCCC2)c1	815572117	VAYZUEOURIZXDG-UHFFFAOYSA-N	433.490	1.592	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1ccc2c(c1)OC(C)(C)O2	815752164	GPUMIGFNRSKMTO-UHFFFAOYSA-N	434.474	1.526	50	20	IDGD	
O=C(NNc1ncncc1F)C(=O)Nc1ccc(-c2csc(N3CCOCC3)n2)cc1	815764735	STZBLCGLCIMBRR-UHFFFAOYSA-N	443.464	1.658	50	20	IDGD	
CCCNC(=O)[C@H]1CN(C(=O)C(=O)NNc2ccc(OCC)cc2)c2ccccc2O1	815815779	REHZONCTKXWAFD-LJQANCHMSA-N	426.473	1.849	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C[C@@](O)(c2nccn2C)C(F)(F)F)cc(OC)c1OC	818648143	OSOLQRVNCOTAEX-QGZVFWFLSA-N	446.382	1.047	50	20	IDGD	
CSc1ncc(Cl)c(C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)n1	825421352	SXXKBPPZCSCDSF-UHFFFAOYSA-N	425.810	1.378	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)COc2ccc(C(=O)c3ccccc3)cc2)C[C@H](C)O1	912919895	SOVLNECQBZEPKW-ROUUACIJSA-N	439.512	1.943	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)CN2C(=O)N[C@]3(C[C@H](C)CC(C)(C)C3)C2=O)cc1	913431553	RBWJJYIGLFQNRF-QRQCRPRQSA-N	429.521	1.691	50	20	IDGD	
CS(=O)(=O)Nc1ccc(CNC(=O)NNC(=O)c2cc(Br)c[nH]2)cc1	916380745	PFIQGDKUEKDPIU-UHFFFAOYSA-N	430.284	1.293	50	20	IDGD	
C=CCNS(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)c1	916561981	JLDNPIVZNRYTIR-UHFFFAOYSA-N	430.486	1.167	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)CCn3ccnc3)c2)cc1	917371859	BHGUICDGAQCROT-UHFFFAOYSA-N	443.485	1.544	50	20	IDGD	
COCCn1cc(C(=O)NNC(=O)[C@H](C)Oc2cccc(Br)c2)ccc1=O	917391817	GQNCUHWSIAHULW-LBPRGKRZSA-N	438.278	1.486	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)NC[C@H](c1cccc(C)c1)N1CCOCC1	919903668	FISXHKHLWXJHRL-HXUWFJFHSA-N	426.517	1.950	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)NCc1cccc(C(=O)N2CCOCC2)c1	920812160	VHKXJPFDBDGLPH-OAHLLOKOSA-N	444.463	1.596	50	20	IDGD	
CCCNC(=O)NNC(=O)c1ccc(OC)c(S(=O)(=O)N[C@@H]2CCCC[C@@H]2C)c1	921041615	FQOYZBPZMVBERG-DZGCQCFKSA-N	426.539	1.906	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)c1ccc([S@@](C)=O)cc1	1116382641	BRBJBVBKSLOHPO-FCJAZMSBSA-N	427.486	1.376	50	20	IDGD	
C[C@H](O)CNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2ccc(Cl)cc2Cl)cc1	1346619000	FAJATUVAHAXXIN-JTQLQIEISA-N	446.312	1.727	50	20	IDGD	
Cc1cccc2cc(C(=O)N3CC[C@]4(CN(C(=O)CCC(=O)NN(C)C)CCO4)C3)[nH]c12	1778456326	WZBOYVHEVQASIN-QHCPKHFHSA-N	441.532	1.293	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc(F)nc2C)C1	1779904167	IPPQOYTUHHJGJQ-RZQQEMMASA-N	427.904	1.910	50	20	IDGD	
O=C([C@@H](F)Br)N1CC[C@]2(C1)CN(C(=O)[C@H]1Cc3ccccc3CN1)CCO2	1781332093	ZQNMNENRWADXKC-MDZRGWNJSA-N	440.313	1.221	50	20	IDGD	
CC(C)(C)n1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](F)Br)C3)C2)nn1	1781335159	VAPCCFBNKJWSRD-BLLLJJGKSA-N	432.294	1.167	50	20	IDGD	
CC(=O)NC(C)(C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)Br)C1	1781997411	VABFSEFIKCCHPZ-WPKBUWHJSA-N	432.359	1.198	50	20	IDGD	
CC[S@@](=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)Br)C1	1781997578	CPMDNALNLNTGRE-RXWAYUDJSA-N	437.400	1.442	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCOCCOCCOC)C1	1782061152	GURXYZIHYPIYJI-DBXWQHBBSA-N	448.988	1.587	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)COc3ccc(O)cc3)CCO2)C1	1783338051	CXFOFRKVUZVHMY-APWZRJJASA-N	441.322	1.774	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3c(Cl)ccc4c3OCO4)CCO2)C1	1783876253	XSLUCOPZUICARX-YJYMSZOUSA-N	445.299	1.766	50	20	IDGD	
CC(=O)N[C@H](C(=O)N1CCO[C@@]2(CCN(C(=O)C(Cl)Cl)C2)C1)c1ccc(F)cc1	1783948162	CVMBCOVWGJCGOL-HNAYVOBHSA-N	446.306	1.637	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccn4nccc4c3)C[C@@H]21	1783966640	IQOOJOYMPJMPRN-KCMWZYNZSA-N	449.349	1.959	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21	1783972804	QDEZUFFQFITXFZ-WTPMCQDGSA-N	444.139	1.688	50	20	IDGD	
Cc1ccc2nc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]4C3)sc2c1	1784087031	VNPYGDGSQQAQIG-UGQVUOCMSA-N	437.949	1.798	50	20	IDGD	
Cc1ncc(CC(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)s1	1784433273	DOZBTRSXOGBLDO-PXAZEXFGSA-N	430.368	1.855	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CC[C@H](C(=O)OC)C3)C[C@@H]21	1784615593	SMDZQPYZXCNJAQ-PXOUGSPUSA-N	428.957	1.963	50	20	IDGD	
O=C(CCc1ccccc1Cl)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21	1786599621	GYXPIPJMHFSDSE-ONIAQPFYSA-N	429.344	1.852	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)c1nccc2nc[nH]c12	1787353321	ZQKBJVUFNZMBHH-OBJOEFQTSA-N	436.310	1.336	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(OC)cc(OC)c3)[C@H]2C1	1789548863	BSVHXJZEZQFEMA-YFYLHZKVSA-N	440.924	1.551	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4nn[nH]c4c3)C[C@@H]21	1789872826	ZWOYOGFFGINGOC-DYIBVVGTSA-N	440.331	1.788	50	20	IDGD	
Cc1cc(C)n(CCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]3C2)n1	1789926560	BWWKMIPTXCTHQG-QBYUYEEZSA-N	445.333	1.560	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc[nH]c4nccc3-4)C[C@@H]21	1791057159	FLXBONOUEYOIDU-KNPMLCFXSA-N	435.322	1.891	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3CC=CC[C@@H]3C(=O)OC)[C@H]2C1	1791236836	YVHQNAABFPTJFD-COZGXFGHSA-N	426.941	1.739	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(-c4ccco4)no3)C[C@@H]21	1791253598	BRKYXMMPMIWKIG-NUXNZHGMSA-N	437.880	1.782	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(-n4ccnc4)ccn3)C[C@@H]21	1791253780	JLRVXNRWISVEDD-XPYUAMARSA-N	447.923	1.114	50	20	IDGD	
CC(C)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(-c3ccncc3)[nH]n1)C2	1792783961	IKTCEECPITWIGQ-JLVBRIDZSA-N	431.924	1.940	50	20	IDGD	
C[C@H]1C[C@]1(C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1793879052	CWUASWKSYAVJMF-BCKAASPTSA-N	443.972	1.754	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCc1nnc(C)s1	1794109777	FYQYPIPVBWSIIO-OQMKEHIESA-N	445.383	1.542	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C[C@H](N)c1cccnc1	1795677750	DLDVCZGKVRPIDA-IJCAJFLPSA-N	439.354	1.092	50	20	IDGD	
Cc1c(F)ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCBr)C3)c1N	1795701340	PDPYJWASEHJRFP-DPIQGUFMSA-N	428.302	1.705	50	20	IDGD	
O=C(Cc1noc2ccccc12)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2	1795763764	LDHHPVJFSZMTEY-DBWKPXFBSA-N	436.306	1.745	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)c1ccc(Cl)nc1F	1796190730	FDMJSNMDRTXJSZ-QDMKHBRRSA-N	431.660	1.120	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCc1ccco1)C2	1796890816	LLKUPVAFFZCHMM-GSWMANSFSA-N	425.489	1.984	50	20	IDGD	
CCCc1onc(C)c1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(B(O)O)cc1)C2	1797083549	BWXGCLPPNQMZBI-BCDXTJNWSA-N	425.294	1.181	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc3c[nH]nc13)C2	1798440426	OUVFMYDYCCAXAS-QDMKHBRRSA-N	433.472	1.127	50	20	IDGD	
CN(C)c1cccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)c1	1798442131	YHMONMDHZONKAL-VBUUOAMHSA-N	436.516	1.317	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(C(F)(F)F)n1	1798769398	HEIJEZDKANCMFR-BTTYYORXSA-N	441.454	1.725	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(C)(C)OC(=O)NC(C)C	1799128719	TZGJADOXDKBECI-QKPAOTATSA-N	431.961	1.897	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CC[C@@H]2CCC(=O)N2C1)[C@@H](F)Br	1799930536	AUIFXNSWDPXXCJ-OHTRNCERSA-N	430.318	1.716	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1ccnc2ncccc12	1799978548	ROZMJMGNQWPKTM-JLUCKKNBSA-N	437.269	1.524	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)c1cnc2c(F)c(F)ccc2c1	1800066238	PTPXEQIYKCGLAO-IARIHHJXSA-N	439.846	1.316	50	20	IDGD	
CN1CCN(C2(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)[C@](C)(Cl)CCl)CC2)CC1	1800082594	WCQRUJVNTYWYSH-YYAJDYIMSA-N	431.408	1.641	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Cn1cccn1)C2	1800640303	QEKKCHCJOBSLJO-QMHWVQJVSA-N	427.343	1.282	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1n[nH]c3ccc(F)cc13)C2	1800758965	AMMDQFIJHBQEHF-YYHMBLRTSA-N	439.285	1.689	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc3snnc3c1)C2	1800760592	VCMMEVSXHSHWDG-GMTLJSCSSA-N	440.323	1.073	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1n[nH]c3c(Cl)cccc13)C2	1800979764	ZWLKFKPFIQVRFD-BAESOJJISA-N	441.315	1.673	50	20	IDGD	
Cn1ccc2c(O)ncc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)C(Cl)Cl)c21	1801016370	FGENZIBGWFEWCC-DDFAGTSDSA-N	427.288	1.286	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CC1CCC1	1802031129	XYVQIOPLUBDNIG-VPTLXERWSA-N	445.472	1.914	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CC23CCCN2CCC3)[C@@H]1c1cccnc1)[C@H](O)CCl	1803140389	CYIHNFSZOKVROC-NLWGTHIKSA-N	434.968	1.706	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@@H](CNC(=O)[C@H](C)CC(N)=O)[C@H]1c1cccnc1	1803664272	YIKDMWRKTWEWET-LNCBFAARSA-N	439.354	1.630	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCC2(CCCN(C(=O)CN3C(=O)CNC3=O)C2)CC1	1806590005	HPPUWJBXFAKLTE-KRWDZBQOSA-N	433.336	1.006	50	20	IDGD	
C[C@@H]1CCC[C@@H]1C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1807377097	XOQUVLSYLWSIHZ-JJJJLYANSA-N	435.333	1.517	50	20	IDGD	
Cc1noc(CC(=O)NC[C@@H]2CCN(C(=O)CO[Si](C)(C)C)[C@H]2c2cccnc2)n1	1807525939	SNQSLTNGHSUOEX-JXFKEZNVSA-N	431.569	1.873	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)[C@H]1CC[C@@H]2CCC(=O)N2C1	1807727255	RRTMNHSWNNCYOR-WRMBXCAGSA-N	448.951	1.088	50	20	IDGD	
Cc1[nH]ccc1C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1808755915	UPHKEMRLCYPCRM-LAUBAEHRSA-N	426.521	1.411	50	20	IDGD	
C#CCCCCC(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1	1810304215	ASPQOOSWXHXGEK-XMSQKQJNSA-N	448.527	1.593	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2cnncc2C(=O)O)[C@H]1c1cccnc1	1810806485	SKRIKXCLJCCBTQ-XOKHGSTOSA-N	431.880	1.907	50	20	IDGD	
Cc1cnoc1C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1	1811246328	MLBOLXKWJFUCKG-CRAIPNDOSA-N	449.471	1.010	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)C2(F)CC2)[C@H]1c1cccnc1	1812457017	ORJSXEIJJOKBLS-PMRLGZHMSA-N	440.479	1.724	50	20	IDGD	
CC(=O)N/C(C)=C/C(=O)N1CC[C@H](CNC(=O)[C@H](C)Br)[C@@H]1c1cccnc1	1812869057	QDYNLNLIRHYCAG-VCFSPYGVSA-N	437.338	1.911	50	20	IDGD	
CN1N=C(C(=O)N2CC[C@H](CNC(=O)C(Cl)Cl)[C@H]2c2cccnc2)CCC1=O	1813076683	YSOCSNPKDJJTGT-IUODEOHRSA-N	426.304	1.499	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cncn2-c2ccncc2)[nH]n1)[C@H](O)CCl	1814869214	LVUWRZZBYQHMMA-DOTOQJQBSA-N	443.895	1.896	50	20	IDGD	
CCc1ccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)cn1	1816323824	CRKPLYBKWSFHAP-FQEVSTJZSA-N	447.304	1.667	50	20	IDGD	
CC[C@H](O)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)n[nH]1	1818110366	CHVLKEUZXKXDTR-MKDRCZBFSA-N	429.481	1.307	50	20	IDGD	
O=C(/C=C\C(=O)NC1CC1)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](F)Br)CC2	1819531816	SEWIFIUOPWKFSS-FAYRYBEVSA-N	445.314	1.580	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)C(Cl)Cl)CC2	1819800968	VXGZNGLLEVBHJK-ZETCQYMHSA-N	443.316	1.171	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)Cc2cscn2)CC1	1827130584	VUPFZBVYMVXHJL-GOSISDBHSA-N	435.594	1.678	50	20	IDGD	
O=C(N[C@H]1CCc2nc(NC(=O)C3CCSCC3)sc2C1)c1cccc(B(O)O)c1	1828335882	FIDMKXQLYUEOPP-HNNXBMFYSA-N	445.375	1.192	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@H](O)N2CCOCC2)CC1	1828963916	KOGFVCSJSDIJLX-NSHGMRRFSA-N	429.989	1.664	50	20	IDGD	
CN1N=C(C(=O)N2CCC([C@H]3CCCCN3C(=O)[C@H](F)Br)CC2)CCC1=O	1830375644	FKXFPNPDCQOALR-ZBFHGGJFSA-N	445.333	1.905	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cc(C)n(C)n3)C2)C1	1831639846	FCAMRXPORFDIIB-XLIONFOSSA-N	426.945	1.135	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(N(C)C)nc3)C2)C1	1831652022	VQAVIDJTNLSQML-DYESRHJHSA-N	438.956	1.625	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccnc(Cl)n3)C2)C1	1831652361	ZJGGWFSDIUTYAL-FZKQIMNGSA-N	431.320	1.608	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)CC[C@@H]2CCOC2)CC1	1832450886	ATHJOAPLEUIPIX-XMSQKQJNSA-N	442.365	1.416	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)c3ccco3)CC2)CC1	1833089766	JPZFGTQLUBDFGL-WMZOPIPTSA-N	427.929	1.138	50	20	IDGD	
COc1cc(C)ccc1C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)CCl)CC2)CC1	1833312993	PBZFVQCCDQKKOR-LJQANCHMSA-N	437.968	1.789	50	20	IDGD	
CC[C@H](C(=O)NC1CCN(C2CCN(C(=O)[C@H](Cl)COC)CC2)CC1)N(CC)CC	1833539329	QOMCVERGXITHCO-WOJBJXKFSA-N	445.048	1.932	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)c3ncc[nH]3)CC2)CC1	1834029787	OQFSSZFXYVYUOM-CYBMUJFWSA-N	426.359	1.626	50	20	IDGD	
CN(C)c1ncc(C(=O)NC2CCN(C3CCN(C(=O)C(Cl)Cl)CC3)CC2)o1	1834098944	YUFNBQHKXFCVAV-UHFFFAOYSA-N	432.352	1.730	50	20	IDGD	
C=CCC(F)(F)C(=O)N1CCOC[C@@]2(CN(C(=O)CCBr)CCO2)C1	1834824892	OOOYZCSKIDCPIW-OAHLLOKOSA-N	425.270	1.439	50	20	IDGD	
C=C[C@@H](O)C(C)(C)C(=O)NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1	1835713655	KGTBFDOHGKCBEW-QGZVFWFLSA-N	444.414	1.916	50	20	IDGD	
CCCNC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)[C@@H](Cl)CC)CC2)CC1	1836394619	BCVRKXGDXATYFU-SFHVURJKSA-N	429.005	1.882	50	20	IDGD	
O=C(C(Cl)Cl)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1Cc3ccccc3O1)CCO2	1836654030	LXXYNTWEIPSGOE-KXBFYZLASA-N	429.300	1.250	50	20	IDGD	
O=C(c1cccc2c1OCC2)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836718375	WOSWUOWBXFRBKY-IBGZPJMESA-N	436.936	1.833	50	20	IDGD	
CC(=O)N(C)CCC(=O)N1CCC(OC2CCN(C(=O)[C@@H](C)Br)CC2)CC1	1837040852	BRXGMYUBLZRWFY-CQSZACIVSA-N	446.386	1.637	50	20	IDGD	
Cn1cnc(C(=O)N2CCC(OC3CCN(C(=O)[C@@H](F)Br)CC3)CC2)n1	1837383226	WXSDZKRTPZCXTL-CYBMUJFWSA-N	432.294	1.118	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(C#N)c[nH]3)CCO2)C1	1838738918	GDNFPJVKDKXSTJ-ROUUACIJSA-N	429.304	1.193	50	20	IDGD	
CCc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)n(C)n1	1839153087	AJBKZSBJTLTVRO-MOPGFXCFSA-N	447.363	1.289	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)c(O)n1	1839153401	HMVFMRNXQSIMHJ-MOPGFXCFSA-N	446.331	1.402	50	20	IDGD	
Cc1c(F)cccc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2	1840030403	KPWWKQCLTPCCNP-KUHUBIRLSA-N	443.313	1.988	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)[C@H]3C[C@]3(F)Cl)CCO2)C1	1840246531	FSXVYSZZDLZQHD-IPOQPSJVSA-N	431.719	1.604	50	20	IDGD	
O=C(c1cnc2ccc(C(F)(F)F)cn12)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1	1841351715	ZVWOAFSVCFLZQA-CYBMUJFWSA-N	430.814	1.770	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC2(CCCN2C(=O)c2cccc(N3CCCNC(=O)C3)n2)C1	1842304458	BKMUPQDULXQNKZ-UHFFFAOYSA-N	447.967	1.490	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)[C@@H]1CCCN1C(C)C)C2	1843417283	QWSGAYORAKPVRU-MRSJDWDVSA-N	428.537	1.197	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)C[C@H]1OCCc3ccccc31)C2	1844263534	NXKXCBHACWBXIM-HXUWFJFHSA-N	449.511	1.206	50	20	IDGD	
N=C1NCCN1CC(=O)N1CC2(CCCN2C(=O)[C@H](Br)Cc2ccccc2)C1	1845941431	YIWMLGLQUXFJCR-MRXNPFEDSA-N	448.365	1.036	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@]2(C[C@H]2C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](O)CCl)C1	1847564133	RMAIWOVBFDKKDL-GVZUZGFXSA-N	441.956	1.435	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](CCO)NC(=O)OC(C)(C)C	1847644497	XNVWNTOYPPGREB-XUXIUFHCSA-N	448.358	1.247	50	20	IDGD	
Cc1nn(-c2ccc(F)cc2)c2sc(C(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)cc12	9930927	HJPXFWHWZRUJHA-NSHDSACASA-N	436.490	1.730	50	20	IDGD	
Cc1nnc(NNC(=O)C2CCN(S(=O)(=O)c3ccc4ccccc4c3)CC2)[nH]c1=O	11335012	PMYVHNFEUHCPPM-UHFFFAOYSA-N	442.501	1.171	50	20	IDGD	
CSCC[C@@H](NC(=O)c1ccco1)C(=O)NNC(=O)Cc1nc2ccccc2n1C	15926067	AXSFFKNPXKBFNC-CQSZACIVSA-N	429.502	1.408	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)CCc2c(C)nc3cc(C)nn3c2C)c2ccccc2c1=O	28580435	QVIGZFNYIUZCQH-UHFFFAOYSA-N	447.499	1.778	50	20	IDGD	
CCn1c(=O)nc(O)c2c(C(=O)NNc3nc(-c4ccncc4)no3)cc(C(C)C)nc21	726370034	MXWAPWKBVGPZLY-UHFFFAOYSA-N	436.432	1.842	50	20	IDGD	
COc1ccc(CN2C[C@H](C(=O)NNC(=O)CNc3ccccc3OC)CC2=O)cc1	726620675	XWDNJCDFYLFGNT-MRXNPFEDSA-N	426.473	1.312	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)CN2C(=O)N[C@]3(CCCC[C@@H]3C)C2=O)cc1F	727498293	HYFGCVASOCZJDH-WLRWDXFRSA-N	437.497	1.653	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)c2cc(S(=O)(=O)N3CCCC3)c(C)o2)c(C)c1	728205576	PUEITYPFKNTALD-UHFFFAOYSA-N	434.518	1.862	50	20	IDGD	
COc1cccc(OCC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)c1	728216081	PTMOKJVJFJENTE-UHFFFAOYSA-N	434.518	1.153	50	20	IDGD	
Cc1cc(C)n(-c2ccc(CNC(=O)NNC(=O)C3CCN(c4ncccn4)CC3)cn2)n1	728945662	DLGDGXJRGHTWPG-UHFFFAOYSA-N	449.519	1.421	50	20	IDGD	
COc1cc(CNC(=O)NNC(=O)c2cccc(C#N)c2)ccc1OCC(=O)N(C)C	728948350	KETIRWJJMAEJDA-UHFFFAOYSA-N	425.445	1.178	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)N1CCN(S(=O)(=O)c2ccccc2)CC1	729510818	NYULBNSVEQLWMH-UHFFFAOYSA-N	441.513	1.389	50	20	IDGD	
O=C(COC(=O)c1ccc(Cl)c(Cl)c1O)NNC(=O)[C@H]1COc2ccccc2O1	730362568	QXSJNQFMFKEYDL-CYBMUJFWSA-N	441.223	1.843	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])c(C)c1	731492202	BODJIGOAZRIZGZ-QGZVFWFLSA-N	426.429	1.978	50	20	IDGD	
CCOC(=O)c1ccc(N2CCN(C(=O)NNC(=O)c3ccccc3OC)CC2)nc1	731500955	VRXMLLKFHBKBMI-UHFFFAOYSA-N	427.461	1.444	50	20	IDGD	
O=C(NNc1ccc(Br)nc1)C1CCN(S(=O)(=O)c2cccnc2)CC1	732837974	CUTPPKOEUGIKRD-UHFFFAOYSA-N	440.323	1.783	50	20	IDGD	
CN1CCC(N2CC[C@H](NC(=O)NNC(=O)c3ccc(COc4ccccc4)o3)C2)CC1	734284133	SOOJGDLRHWNPPV-KRWDZBQOSA-N	441.532	1.971	50	20	IDGD	
COCCOc1ccc(-n2nc(C)c(C(=O)NNC(=O)CNc3ccc(C)cc3)n2)cc1	735113930	CTSYFUGTEJCHOK-UHFFFAOYSA-N	438.488	1.782	50	20	IDGD	
O=C(NNC(=O)c1cc2cc(F)ccc2o1)c1cccc(S(=O)(=O)N2CCOCC2)c1	735419214	BHYIYGKIOPIBSS-UHFFFAOYSA-N	447.444	1.668	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)Nc3ccc4c(c3)OCO4)c2)cn1	735522743	XIJSHFJQKVIZIZ-UHFFFAOYSA-N	443.441	1.024	50	20	IDGD	
O=C(NNc1cccnn1)C1CCN(S(=O)(=O)c2cccc(OC(F)(F)F)c2)CC1	736697853	NDIGWIUDFMNBFM-UHFFFAOYSA-N	445.423	1.919	50	20	IDGD	
CCCC[C@@H](COC)NC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	737061163	KESOXVDYIWXQES-INIZCTEOSA-N	426.539	1.620	50	20	IDGD	
CCc1cc(NNC(=O)c2ccc(CN3C(=O)CNC3=O)cc2)nc(-c2ccccn2)n1	738530481	KEZCSVBXPCUTEE-UHFFFAOYSA-N	431.456	1.910	50	20	IDGD	
CCc1cc(NNC(=O)CCc2ccc(S(N)(=O)=O)cc2)nc(-c2ccccn2)n1	738531520	IZSLUBCSGRMPJV-UHFFFAOYSA-N	426.502	1.824	50	20	IDGD	
Cc1cc(C)c(S(=O)(=O)N2CCC(C(=O)NNc3ncnc4[nH]cnc34)CC2)c(C)c1	740746415	BELWKRCTRSRJPL-UHFFFAOYSA-N	443.533	1.822	50	20	IDGD	
O=C(COC(=O)[C@@H]1CCCN(Cc2ccccc2)C1)NNC(=O)c1ccc([N+](=O)[O-])cc1	741326574	LTSIYFZTPLACMA-GOSISDBHSA-N	440.456	1.811	50	20	IDGD	
CC(C)(C)C(=O)NCc1ccc(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1	741559380	UCURMROAAOAJFU-UHFFFAOYSA-N	438.532	1.817	50	20	IDGD	
CN(CC(=O)NNC(=O)c1cccc(C#N)c1)Cc1cc2c(cc1OC(F)F)OCO2	744405208	MVEOTPOQWPSXTE-UHFFFAOYSA-N	432.383	1.781	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)OCC(=O)NNC(=O)c2cccc(C)c2)c1	744474321	RABOTXWMFGKWDJ-UHFFFAOYSA-N	447.513	1.644	50	20	IDGD	
Cc1cccc(N2C[C@@H](C(=O)OCC(=O)NNC(=O)c3cccc(C#N)c3)CC2=O)c1C	744566364	FHBMECAZYFODCE-SFHVURJKSA-N	434.452	1.532	50	20	IDGD	
CCOc1ccc(/C=C(/C#N)C(=O)O[C@H](C)C(=O)N(CC)[C@@H]2CCS(=O)(=O)C2)cc1	744572186	XRGXRWFODJZMAR-LUFZQEEISA-N	434.514	1.960	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)Cc2cc(Cl)c3c(c2)OCCO3)cc1	744609987	AWQAFVBEPJZHSK-UHFFFAOYSA-N	429.816	1.530	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)N[C@H]2CCN(Cc3ccccc3)C2=O)cc1	744878512	ZCHMUIRNKMLRLB-JXFKEZNVSA-N	440.500	1.984	50	20	IDGD	
CCC(CC)c1cc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)on1	745865847	BPKFGDIGQRJOHU-UHFFFAOYSA-N	437.522	1.973	50	20	IDGD	
Cc1csc([C@@](O)(CC(=O)NNC(=O)COc2ccc(C#N)cc2)C(F)(F)F)n1	746820272	YEGCWYFVTSNBQS-INIZCTEOSA-N	428.392	1.690	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)NCc1ccc(Cn2cnc3ccccc32)cc1	748625454	RRNSWZMXNLEHJD-MRXNPFEDSA-N	425.489	1.967	50	20	IDGD	
Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	748640912	XSNMOYYOPPSMPZ-UHFFFAOYSA-N	427.460	1.238	50	20	IDGD	
CC[C@@H](CNC(=O)NNC(=O)c1csc(N2CCOCC2)n1)Oc1ccccc1F	748976041	CXPVXZDKPYZBBY-ZDUSSCGKSA-N	437.497	1.920	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)CNS(=O)(=O)c1ccc(Cl)s1	749837882	JGRQKPPFGKJAKK-UHFFFAOYSA-N	447.922	1.305	50	20	IDGD	
COc1ccc2nc(Cl)ccc2c1S(=O)(=O)NNC(=O)CNC(=O)c1ccco1	751283200	VBVAWGMMJFVUPV-UHFFFAOYSA-N	438.849	1.229	50	20	IDGD	
C[C@H](NC(=S)NNC(=O)c1ccc(S(=O)(=O)N2C[C@@H](C)O[C@H](C)C2)cc1)C1CC1	751619252	LVGAKPUAJYIURX-MCIONIFRSA-N	440.591	1.392	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)CCCCN2C(=O)c3ccccc3C2=O)c1	753599931	XHJMLIBZPIBLSG-UHFFFAOYSA-N	448.435	1.329	50	20	IDGD	
COC(=O)c1cc(Cl)ccc1S(=O)(=O)NNC(=O)c1cc(OC)cc(OC)c1	753771435	VTPNBJYWFCAKGG-UHFFFAOYSA-N	428.850	1.767	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)NCc1cn(-c2ccccc2)nn1	756070195	CHVMCXGAWXRJAC-UHFFFAOYSA-N	448.531	1.310	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)Nc2cnn(CC(=O)N3C[C@H](C)O[C@H](C)C3)c2)c1	756838145	LNQYNVAPQONJEL-IYBDPMFKSA-N	444.492	1.059	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)Nc1cc(Br)cn(C)c1=O	757589365	DLQANPUDYLDVKW-VIFPVBQESA-N	427.230	1.907	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N(C)CC(C)(C)O)cc1	758260620	NOTKGLWLGDLXNJ-LFIBNONCSA-N	425.489	1.570	50	20	IDGD	
O=C(c1cc2cc([N+](=O)[O-])ccc2o1)N1CCN(S(=O)(=O)CBr)CC1	758516349	AOJUGSHIZJETSA-UHFFFAOYSA-N	432.252	1.781	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N2CCC(C)(O)CC2)cc1	760008456	PIFRCCFJMJXKNQ-GHRIWEEISA-N	437.500	1.714	50	20	IDGD	
C[C@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	763132880	MOIPFOLXWJRETD-BBRMVZONSA-N	444.496	1.252	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)[C@@H](C)Sc2nnnn2C2CC2)n[nH]1	763151725	DPXQSVHVERXSQD-SNVBAGLBSA-N	428.478	1.349	50	20	IDGD	
Cc1[nH]c(-c2ccncc2)nc(=O)c1CC(=O)NNC(=O)c1cc(-c2cccs2)[nH]n1	763157852	LSJUXKJDWRUDRQ-UHFFFAOYSA-N	435.469	1.596	50	20	IDGD	
CC(=NNC(=O)c1cnn(-c2ccccc2)c1)c1c(C)nn(CCS(C)(=O)=O)c1C	763174788	DOGYVGCKGLCLNP-UHFFFAOYSA-N	428.518	1.884	50	20	IDGD	
COc1ccc2c(c1)[C@@H](C(=O)OCC(=O)NNC(=O)[C@@H]1COc3ccccc3O1)CC2	763450853	KUCQOCFWGNBRRL-KXBFYZLASA-N	426.425	1.256	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(OCC3CC3)cc2)cc(OC)c1OC	763539987	OTVZPNGQSZFTLB-UHFFFAOYSA-N	443.456	1.901	50	20	IDGD	
COc1ccc(Cn2nccc2NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)cc1	763557580	BXNQYGYRNJMAFA-UHFFFAOYSA-N	437.412	1.068	50	20	IDGD	
O=C(NNC(=O)c1sc2ccccc2c1Cl)C(=O)Nc1ccc(-n2nccn2)nc1	763577584	KUFSHISFEIYBDM-UHFFFAOYSA-N	441.860	1.930	50	20	IDGD	
CNC(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)c2c(C)nc3ccccn23)c1	763622989	BHZODJMVXLKNQY-UHFFFAOYSA-N	428.836	1.055	50	20	IDGD	
COc1ccc(C#N)cc1NC(=O)C(=O)NNC(=O)COc1cccc(C(F)(F)F)c1	763639290	LDOUGHUVTHPKCZ-UHFFFAOYSA-N	436.346	1.751	50	20	IDGD	
COC(=O)N(C)Cc1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2F)cc1	763679050	AHNJSLPUGLEAQH-UHFFFAOYSA-N	432.408	1.189	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cnn(CC(F)(F)F)c1	763681892	ODWKFKATORILHB-UHFFFAOYSA-N	429.355	1.009	50	20	IDGD	
O=C(NNC(=O)c1cc2c(s1)CCC2)C(=O)Nc1cccc(CN2CCCC2=O)c1	763781302	IRKDXWKAILHHFK-UHFFFAOYSA-N	426.498	1.759	50	20	IDGD	
O=C(NNC(=O)c1cc2c(s1)CCC2)C(=O)Nc1ccc(CN2C(=O)CCC2=O)cc1	763783516	PRQFODQQWOZRRS-UHFFFAOYSA-N	440.481	1.286	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)c(Br)c1	763806370	BXMSUOGMMIAGKE-UHFFFAOYSA-N	431.246	1.794	50	20	IDGD	
Cc1cn(-c2ccc(C#N)cn2)nc1NC(=O)C(=O)NNC(=O)Cc1c[nH]c2ccccc12	763861404	PDEUIQCXANWHDD-UHFFFAOYSA-N	442.439	1.257	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccccc1C(=O)N1CCCC1	763873912	XYSLTBQQVWSIRI-AWEZNQCLSA-N	442.447	1.615	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(OC)c(OC)cc2C)cc1OC	763904454	ZGNRWMFAWFYDEU-UHFFFAOYSA-N	431.445	1.819	50	20	IDGD	
O=C(Cc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1cccc(Cn2cccnc2=O)c1	763931390	FQMDCGGACXPEDJ-UHFFFAOYSA-N	439.859	1.274	50	20	IDGD	
Cn1ccnc1C(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)cc1	763979059	RVXNUJVDDDVOHB-UHFFFAOYSA-N	441.831	1.410	50	20	IDGD	
O=C(NNC(=O)c1ccc[nH]1)C(=O)Nc1ccc(I)cc1Cl	763980348	RPSFLRKURPXIGT-UHFFFAOYSA-N	432.605	1.672	50	20	IDGD	
C[C@@H]1CCCCN1CC(=O)Nc1ccc(F)c(NC(=O)C(=O)NNC(=O)C2CCCC2)c1	764068363	KGMLPTFYYAPPPV-CQSZACIVSA-N	447.511	1.915	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1Cl	764077085	HDMIMGCXPGQQFU-UHFFFAOYSA-N	439.877	1.542	50	20	IDGD	
C[C@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(NC(=O)C(=O)NNC(=O)CC3CC3)cc2)C1	764141563	BSZRQCXLEYBZKT-OKILXGFUSA-N	436.534	1.239	50	20	IDGD	
O=C(NNC(=O)c1ccoc1)C(=O)Nc1cccc(C(=O)Nc2ccc(Cl)cn2)c1	764159367	VYNHLWATXUVQHR-UHFFFAOYSA-N	427.804	1.980	50	20	IDGD	
CCCc1c(NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)cnn1-c1cc(C)ccn1	764164898	UTVMRJUTMCQKKL-LJQANCHMSA-N	448.483	1.618	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(OCc3noc(C4CC4)n3)cc2)c1	764236427	YIHJKYCTUPUWMF-UHFFFAOYSA-N	446.423	1.797	50	20	IDGD	
CNC(=O)c1ccc(OC)c(NC(=O)C(=O)NNC(=O)c2cccc(OC(F)F)c2)c1	764251739	XWFSJBIMEVQDAE-UHFFFAOYSA-N	436.371	1.056	50	20	IDGD	
O=C(Cc1ccccn1)NNC(=O)C(=O)Nc1ccn(-c2ncccc2C(F)(F)F)n1	764266321	ATSRVMBMFSWFLD-UHFFFAOYSA-N	433.350	1.010	50	20	IDGD	
COCCOc1c(Cl)cc(NC(=O)C(=O)NNC(=O)c2c[nH]nc2C)cc1Cl	764298186	QONOPDQOTXXWGX-UHFFFAOYSA-N	430.248	1.450	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C(=O)Nc1cccc(S(=O)(=O)N(C)C)c1)c1ccccc1	764327305	XCPKNEPMBILGEP-KRWDZBQOSA-N	432.502	1.217	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)C(=O)Nc1ccc(CC(=O)Nc2ccccc2F)cc1	764354913	ZXMGCATWQZSNHG-UHFFFAOYSA-N	449.442	1.731	50	20	IDGD	
O=C(NNC(=O)C(F)(F)Oc1ccccc1)C(=O)Nc1ccc(NC(=O)C2CC2)cc1	764370126	NGFLXHPZPNEYPW-UHFFFAOYSA-N	432.383	1.793	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2cnc(C(C)(C)C)nc2)n[nH]1	764376505	FAUBBLDQYCIQIL-UHFFFAOYSA-N	437.460	1.573	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)N[C@@H]2CCN(C3CCCCC3)C2=O)cc1	765882387	CJTSNIPQOPLCRZ-MRXNPFEDSA-N	437.522	1.359	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1ccccc1C(F)(F)F	766642854	NMWIPHUCZRNBOM-UHFFFAOYSA-N	434.418	1.924	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)CCC(=O)Nc1ccc2nc(O)[nH]c2n1	767161199	DQZYLWGTKWZFLQ-UHFFFAOYSA-N	442.432	1.007	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)O[C@H]2CCCNC2=O)cc1	767268589	QVYOIUYHZSZDIX-RXBGNRNISA-N	437.456	1.163	50	20	IDGD	
CN(NS(=O)(=O)CCc1cccs1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	767530677	UKAKKOVZQGNDPV-UHFFFAOYSA-N	432.568	1.730	50	20	IDGD	
COc1cc2c(cc1NC(=O)C(=O)NNC(=O)c1cc(C)nc3ccccc13)NC(=O)CC2	768234582	VKCAQKFCPOJBLT-UHFFFAOYSA-N	447.451	1.836	50	20	IDGD	
CCNc1nc(C)c(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)s1	768292147	WTCGHSRVOQIMRG-UHFFFAOYSA-N	430.534	1.102	50	20	IDGD	
COc1ccc(Br)c(CC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c1	769059174	GGUGJAZCBQVFKQ-UHFFFAOYSA-N	431.250	1.437	50	20	IDGD	
CCN(C(=O)[C@H](C)OC(=O)[C@@]12CC[C@@H](C[C@@H]1Br)C2)[C@H]1CCS(=O)(=O)C1	769983208	UGBLUTRROCVUAU-GGOFEBJYSA-N	436.368	1.907	50	20	IDGD	
CSCCNC(=S)NNC(=O)c1ccc([N+](=O)[O-])cc1I	770239284	JDNDDTWBMSUGFT-UHFFFAOYSA-N	440.288	1.671	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)[C@H]1CCCc2sccc21	771650508	RZYHMAIQVMLKIW-SFHVURJKSA-N	426.542	1.773	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cnn(CC(=O)NC3CCCC3)c2)ccc1OC(C)C	772047917	ROYGNYLXKLKAJZ-UHFFFAOYSA-N	443.504	1.813	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)[C@H](C(C)C)N2CCCS2(=O)=O)c1	772631057	PISCKOAXLQMOBJ-IBGZPJMESA-N	425.551	1.705	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1cc2c(cc1Br)CCC2	773547781	XURRTICWIIETJD-JTQLQIEISA-N	428.283	1.075	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1cc(NC(=O)C(=O)NNc2ccc(C#N)cc2)ccc1F	773697186	MPAXKVRTGBNLGM-UHFFFAOYSA-N	433.465	1.856	50	20	IDGD	
O=C(NNc1c(Cl)cccc1Cl)C(=O)Nc1ccn(CCN2CCOCC2)n1	773698433	FZHYXQFQFLOXPD-UHFFFAOYSA-N	427.292	1.604	50	20	IDGD	
CO[C@@H]1CCC[C@H]1CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	775459768	PDDVJIJQBJVTJA-FUHWJXTLSA-N	438.550	1.620	50	20	IDGD	
CC(C)Cc1cc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc(O)n1	777141682	CPQJPLFBJROAHL-QGZVFWFLSA-N	429.429	1.130	50	20	IDGD	
CN(C)c1ccc(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)cc1Cl	782886553	PYHRWKQJPYLERI-UHFFFAOYSA-N	428.880	1.621	50	20	IDGD	
C[C@H](c1ccccc1)n1ccc(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)n1	782893793	MEJAPKLXSVGXMY-OAHLLOKOSA-N	445.483	1.708	50	20	IDGD	
COC[C@@H](C)NS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccc(OC)cc2)cc1	783036920	KBFULIHRZUOWBU-CYBMUJFWSA-N	436.490	1.090	50	20	IDGD	
CN1CCC[C@@H](N(C)C(=O)c2ccc(NC(=O)C(=O)NNc3cncc(Cl)n3)cc2)C1	783268126	NVFZEQXNLRWHDF-OAHLLOKOSA-N	445.911	1.378	50	20	IDGD	
CNC(=O)[C@@H]1CN(C(=O)C(=O)NNc2ccc(Cl)cc2[N+](=O)[O-])c2ccccc2O1	783291091	LIMHFGWYEVZCRY-HNNXBMFYSA-N	433.808	1.232	50	20	IDGD	
CC(C)N1C(=O)C[C@H](NC(=O)NNC(=O)C(=O)NC2CC2)[C@@H]1c1ccc(Cl)c(F)c1	783320022	JCVKDIMSYQSDKE-HOCLYGCPSA-N	439.875	1.139	50	20	IDGD	
CCOc1cc(N2CCOC(C)(C)C2)ccc1NC(=O)C(=O)NNc1ccc(C)nn1	783951964	MUIQAJPSUAOUDK-UHFFFAOYSA-N	428.493	1.881	50	20	IDGD	
Cc1cnn(-c2ccc(C(N)=O)cc2NC(=O)C(=O)NNc2ccc(OC(F)F)cc2)c1	784312446	NPTORFWGNWPYFK-UHFFFAOYSA-N	444.398	1.963	50	20	IDGD	
O=C(NNc1cccnc1Cl)C(=O)Nc1ccccc1S(=O)(=O)N1CCCCC1	784843356	ISMVQLPIDCWMGI-UHFFFAOYSA-N	437.909	1.991	50	20	IDGD	
CCOC(=O)[C@@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNc2ccnc(F)c2)cc1F	784848607	HIMKDPFHANFJLH-SNVBAGLBSA-N	435.387	1.123	50	20	IDGD	
CCCCn1c(N)c(N(CC)C(=O)COC(=O)/C(C#N)=C/c2ccccc2)c(O)nc1=O	785365122	SUIWQJIKEXODQC-FOWTUZBSSA-N	439.472	1.834	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)NC[C@@H](Cc2cccc(F)c2)C(=O)N2CCOCC2)o1	789308203	ALJPQEJKRIAXRZ-MRXNPFEDSA-N	432.452	1.389	50	20	IDGD	
Cn1nc(-c2ccc(F)cc2F)cc1NC(=O)C(=O)NNc1ccc(-n2cccn2)nn1	789750596	LUAGWBXUVCRPOW-UHFFFAOYSA-N	439.386	1.423	50	20	IDGD	
Cc1cc(F)cc(-n2cc(C(=O)N3CCN(S(=O)(=O)CBr)CC3)nn2)c1	790013355	CSUMBCNJKKMXIV-UHFFFAOYSA-N	446.302	1.155	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cc4nccnc4cc3F)CC2)cc1	792237139	IBZHQFZEEGGWBJ-UHFFFAOYSA-N	436.491	1.656	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cc3c[nH]nc3cc2C)cc(OC)c1OC	792263674	AEKXSQGTMUBHBV-UHFFFAOYSA-N	427.417	1.297	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)C(=O)Nc1ccc2c(c1)N(CC(F)F)CCS2	793025576	MKZGWNJVESJJPF-UHFFFAOYSA-N	435.456	1.587	50	20	IDGD	
Cc1nc2cc(F)c(F)cc2n1CC(=O)OCC(=O)NNC(=O)c1cccc(C#N)c1	796014362	LWUSXKFRECICKX-UHFFFAOYSA-N	427.367	1.499	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)Nc2ccc(S(=O)(=O)N(C)C)cn2)c1	797652487	HWUWGUJBKLXYCL-UHFFFAOYSA-N	449.533	1.995	50	20	IDGD	
Cc1cc(O[C@H]2CCN(C)C2=O)ccc1NC(=O)C(=O)NNc1ccc([N+](=O)[O-])cc1	799260426	VWGFSKVEZJDXKC-KRWDZBQOSA-N	427.417	1.595	50	20	IDGD	
O=C(NCc1ccc(I)c(Cl)c1)NNC(=O)C(=O)NC1CC1	800742409	LCHDQFIGQUUPRV-UHFFFAOYSA-N	436.637	1.054	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)NCc2ncnn2C(C)(C)C)c1	800742734	CYQPMQXQLCLQAZ-UHFFFAOYSA-N	425.287	1.948	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(S(=O)(=O)NNC(=O)c2cccc(C)n2)c1	800843116	UYSSVBLMEBPPSD-UHFFFAOYSA-N	426.520	1.044	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2CC(=O)N(C(C)(C)C)[C@@H]2c2cnn(C)c2)cc1	801110840	HSSNEXOWHGHLAT-FUHWJXTLSA-N	440.504	1.203	50	20	IDGD	
O=C(CCC/N=C1/NS(=O)(=O)c2ccccc21)NNC(=O)Nc1cc(F)cc(F)c1	802002894	CAMHXHRTSLAGIA-UHFFFAOYSA-N	437.428	1.636	50	20	IDGD	
CC(C)NS(=O)(=O)c1c[nH]c(C(=O)NNC(=O)Nc2ccc(OC(F)F)cc2)c1	802047127	SKVDGCROUKCWQO-UHFFFAOYSA-N	431.421	1.769	50	20	IDGD	
Cc1ccc(C2=NO[C@@H](CNC(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)C2)cc1C	802376308	UHEUFPKAUKTYPZ-GOSISDBHSA-N	434.460	1.416	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1ccsc1	802390585	SWKWDBVQBWSIFW-CYBMUJFWSA-N	438.531	1.474	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN([C@H](CNC(=O)NNc2cccnn2)C(F)(F)F)CC1	802466988	DTLKCCPNBZAUNG-GFCCVEGCSA-N	433.435	1.586	50	20	IDGD	
C[C@@](O)(CN1Cc2ccccc2C1=O)C(=O)OCC(=O)NNC(=O)c1ccc(Cl)cc1	803468975	FBDWGORKYJEEEK-OAQYLSRUSA-N	445.859	1.051	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)N2CCC[C@@H]2C[C@@]2(C)NC(=O)NC2=O)c1C	804555472	PNIVZBWIGBWVEM-FRVPSTAWSA-N	427.505	1.638	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)[C@H]1CS[C@@]2(c3ccc(F)cc3)CCC(=O)N12	804954069	GOFJYYWAARCSJF-FOIQADDNSA-N	439.476	1.835	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)NNc2ccc(-n3ccnc3)nn2)cc(S(C)(=O)=O)c1	806337557	FNGDPGLRXQRKOF-UHFFFAOYSA-N	445.461	1.391	50	20	IDGD	
O=C(NCCCN1C(=O)NC2(CCCCC2)C1=O)NNc1ccc2c(=O)[nH]ccc2c1	806365951	FTTIPMWRZQRDAS-UHFFFAOYSA-N	426.477	1.799	50	20	IDGD	
COCc1cnc(NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)s1	806610723	WCSVZRBDKZQZSZ-UHFFFAOYSA-N	439.519	1.541	50	20	IDGD	
O=C(NNC(=O)c1ccc(F)cc1Br)C(=O)Nc1cccc2c1CNC2=O	806976091	DBVDNROLRFRZTL-UHFFFAOYSA-N	435.209	1.231	50	20	IDGD	
CCOC(=O)C(=O)c1cc(S(=O)(=O)NNC(=O)c2ccc(Cl)cc2OC)cn1C	808070837	BBTJIYBUVMVXIM-UHFFFAOYSA-N	443.865	1.056	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(Br)cc1)NNc1cnnc2ccccc12	810404709	VRTDXSQRZBNLEY-UHFFFAOYSA-N	436.291	1.814	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)[C@@H]2CCCN(C(=O)NC3CCCC3)C2)cc1	812731809	VMYPDSPMKBIZSH-OAHLLOKOSA-N	437.566	1.744	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCC(=O)Nc2ccc(F)c(F)c2)cc(OC)c1OC	813534986	LHVVKDWTWGOGOG-UHFFFAOYSA-N	438.387	1.573	50	20	IDGD	
Cc1nsc(NC2CC2)c1C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	814214414	AGHSDRLPYGWUCS-UHFFFAOYSA-N	449.558	1.885	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)[C@H]1CCCN(c2ccccc2)C1=O	814361821	GBAWUWZQPXJKPS-JOCHJYFZSA-N	449.555	1.789	50	20	IDGD	
CC(=NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)c1cc(N)ccc1F	814710522	OXSOHXFTWGKEAY-UHFFFAOYSA-N	448.520	1.902	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)COc2ccc(Cl)c(F)c2)ccc1Cl	814736886	UEEKPEPKRVWDAO-UHFFFAOYSA-N	436.248	1.620	50	20	IDGD	
Cn1cc(NC(=O)C(=O)NNC(=O)c2ccc(COc3ccc(Cl)cc3)cc2)nn1	815565249	HRJAASRCFUJXDX-UHFFFAOYSA-N	428.836	1.447	50	20	IDGD	
Cc1ccc([C@@]2(C)NC(=O)N(CC(=O)NNC(=O)COc3ccc(C)c(C)c3)C2=O)cc1	864001700	AKYQJMGWDXXTHA-HSZRJFAPSA-N	438.484	1.605	50	20	IDGD	
O=C(NN=Cc1ccc(Br)o1)c1cccc(S(=O)(=O)N2CCOCC2)c1	864217994	VYOZBKDDBCIGEV-UHFFFAOYSA-N	442.291	1.827	50	20	IDGD	
Cn1nc(C(=O)NN=Cc2ccccc2OCC(=O)N2CCCC2)c2ccccc2c1=O	916316576	XSYSBYAQTWHOOV-UHFFFAOYSA-N	433.468	1.699	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCC(CC(=O)N2CCCC2)CC1	917119917	KIFVNRJLOVNULM-UHFFFAOYSA-N	436.940	1.834	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3C[C@H](C)O[C@@H](C)C3)cc2)c(O)c1	918340962	HCUZXICSYJCHJG-GJZGRUSLSA-N	447.513	1.573	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Cc2ccc3c(c2)OCO3)c1	918548835	ARVHDQUHBBYLTO-UHFFFAOYSA-N	433.486	1.450	50	20	IDGD	
COc1ccc(S(=O)(=O)C[C@H](C)C(=O)NNC(=O)c2cncn2-c2ccccc2)cc1	1251902238	GOEVCDJSZAITPO-HNNXBMFYSA-N	442.497	1.752	50	20	IDGD	
O=C(NNC(=O)c1ncoc1[C@@H]1CCCO1)c1cccc(S(=O)(=O)N2CCCC2)c1	1321854650	PNYYQMNGVWKBCP-HNNXBMFYSA-N	434.474	1.385	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@@H](C)c2ccc(F)cc2F)cc1	1322120189	FRMMFURYEVCZME-ZDUSSCGKSA-N	425.457	1.845	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2n[nH]cc2Br)c1	1350731403	GSPCSANICDLIMJ-UHFFFAOYSA-N	444.311	1.278	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2nc[nH]c2[N+](=O)[O-])C1	1778060598	MLXMHPFLCXOVAI-VEVIJQCQSA-N	427.889	1.853	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](C(=O)N2CC[C@]3(CN(C(=O)[C@@H](F)Cl)CCO3)C2)C1	1778237821	LIRUTLGZCCKLBH-IQUTYRLHSA-N	433.908	1.608	50	20	IDGD	
Cn1cc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)c2cccnc21	1778768345	FNVHPSBCZBXNKD-KSSFIOAISA-N	439.285	1.707	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(Cl)Cl)C2)c1cc2ncccn2n1	1778978143	DULJJWHRQCTUCZ-FZKQIMNGSA-N	426.304	1.661	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@]2(C1)CN(C(=O)Cc1cccc(Cl)n1)CCO2	1779296613	WDKQEJVDDOPAOJ-LJQANCHMSA-N	425.989	1.959	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)cc1O	1779298699	HZLSBYXZGDFLIT-NRFANRHFSA-N	449.580	1.646	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(O)no2)C1	1779807279	PRLCMLOLRXFJFF-CJBNDPTMSA-N	430.299	1.681	50	20	IDGD	
Cc1ccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](F)Br)C3)c(O)n1	1780140424	HHTLVDRABNUPJR-HBUWYVDXSA-N	444.301	1.914	50	20	IDGD	
COc1cc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](F)Cl)CCO3)c([N+](=O)[O-])cc1O	1780193917	AQMXALABBCGFFT-YOEHRIQHSA-N	431.804	1.287	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc([N+](=O)[O-])[nH]2)C1	1780234027	QJNVQQHBMFMBMN-CJBNDPTMSA-N	443.298	1.834	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H]1C[C@H]3CC[C@@H]1O3)C2)[C@@H](F)Br	1780777697	YWJHEENGKCZLLD-TWEGOSIYSA-N	433.318	1.758	50	20	IDGD	
CC1=NN(c2ccc(C(=O)N3CC[C@@]4(C3)CN(C(=O)[C@H](F)Cl)CCO4)cc2)C(=O)C1	1780795791	JGQWOOLROLQLPP-FXAWDEMLSA-N	436.871	1.777	50	20	IDGD	
C[C@H](Nc1ccccn1)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@](C)(Cl)CCl)C2)C1	1781230334	RACVGIIKROAUJY-JVPBZIDWSA-N	429.348	1.948	50	20	IDGD	
CCCC(=O)N[C@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)Br)C1	1781998184	UXAKDEUKGRLFFN-NRTGNBEESA-N	446.386	1.589	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](C)n1ccnc1C)CCO2	1783352923	JJYYXZIMEXESRO-YEWWUXTCSA-N	427.343	1.756	50	20	IDGD	
CC(C)c1nc(CC(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](C)Br)C3)C2)no1	1783529331	IMBITAWWOSYFRK-PXAZEXFGSA-N	429.315	1.349	50	20	IDGD	
CCc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]3C2)n[nH]1	1783965882	WIFPSYINSQALIS-DUPGQFARSA-N	427.343	1.596	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)COCc3ccc(OC)cc3)C2)C1	1784098348	IZXPQGHNMKBUDN-GHTZIAJQSA-N	440.924	1.296	50	20	IDGD	
COc1ncc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)Br)C[C@@H]32)cc1F	1785640596	BZEFVQPODFVVRZ-MPXAEWJHSA-N	444.301	1.606	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)c1cc(C(F)F)no1	1787138039	AGEPXHKZVHEHPX-KWBADKCTSA-N	436.253	1.991	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC1(c2ccc(NC(=O)c3ccc(O)cn3)cc2)CCC1	1787584092	JRXLLDPDMOWOMK-UHFFFAOYSA-N	425.489	1.908	50	20	IDGD	
O=C(/C=N/N1CCCCC1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21	1788603971	DLOWYWRNZAUJDN-VCGYHUMSSA-N	433.322	1.128	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCN3CCCCC3)C[C@@H]21	1788761297	NXXMKWWUULNCGZ-FHWLQOOXSA-N	425.646	1.694	50	20	IDGD	
COC[C@H](NC(C)=O)C(=O)Nc1ccc(C2(NC(=O)[C@H](Cl)COC)CCC2)cc1	1789661205	IAKLUEBJIOXKSH-SJORKVTESA-N	425.913	1.525	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC1(c2ccc(NC(=O)c3cc(=O)ccn3C)cc2)CCC1	1790051840	WBXIFJROGUZODH-UHFFFAOYSA-N	439.516	1.506	50	20	IDGD	
Cc1cc(O)c([N+](=O)[O-])cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Cl)C[C@@H]21	1790292721	KJKCMXUQQMGBEB-UDNPPVAFSA-N	429.832	1.737	50	20	IDGD	
O=C(NC1(c2ccc(NC(=O)[C@@H]3[C@H]4C=CS[C@@H]43)cc2)CCC1)c1ccc(B(O)O)cc1	1791087010	JMKRLGNCTAUHSV-AQNXPRMDSA-N	434.326	1.989	50	20	IDGD	
Cn1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]3C2)c(C(F)(F)F)n1	1791298356	RQTCKQCSCGJPJK-QXEWZRGKSA-N	443.253	1.836	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1C[C@H]1c1ccc(F)cc1)c1ccc(B(O)O)cc1	1792910590	YWADVTCRFXBBCC-LILSUDLASA-N	436.292	1.561	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C=C/C1CC1	1793017346	UTFIPTCPHSPLBZ-CPVVTZALSA-N	443.456	1.690	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1(c2cccc(F)c2)CC1)c1ccc(B(O)O)cc1	1794031844	FEQLZFNGCJOPKI-WKCHPHFGSA-N	436.292	1.489	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cncc(S(C)(=O)=O)c1	1794625689	RLXBPIJUQZPUNX-KYZVSKTDSA-N	448.372	1.973	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc2nc[nH]c12	1796142189	VQJVIHVRWJLHLD-NFFDBFGFSA-N	435.322	1.797	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)c1c(Cl)cncc1Cl	1796185821	SLNIMDFBLZELEK-QDMKHBRRSA-N	448.115	1.634	50	20	IDGD	
COc1cccc(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)c1C	1796192288	WBRSIYCOWYYZFF-WKCHPHFGSA-N	436.317	1.178	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(Br)ccc1O)C2)[C@H](F)Cl	1796366308	RUPFKENYNRIZGI-WAYYCVMKSA-N	435.677	1.892	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1[nH]nnc1C	1796442310	KQRVZMQLXRIHGB-BTTYYORXSA-N	442.432	1.512	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)c1csc(-c2cccnc2)n1	1796483064	HTCFMCLWROTIOQ-XRGAULLZSA-N	436.921	1.008	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc2[nH]ncc12	1796622927	FWPJWCHABVYPPN-BTTYYORXSA-N	433.472	1.127	50	20	IDGD	
Cc1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CCC(=O)NN(C)C)C3)n(C(F)F)n1	1799405113	UATHJPDSHRIQDT-BTTYYORXSA-N	426.468	1.211	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CNC(=O)c1cccnc1)C2	1800078040	RMJMXJIHWUHDKR-YGTYGHESSA-N	427.332	1.686	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccnc(OC)c1)C2	1800642037	SMVWCRVYPKKGOJ-HLPPOEQASA-N	426.311	1.467	50	20	IDGD	
C[C@H](NC(=O)c1ccccn1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CO[Si](C)(C)C)C2	1801263082	WPPDPMINXDTYKV-NXOAAHMSSA-N	432.597	1.690	50	20	IDGD	
CCOC(=O)N1CCC(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](Cl)CC)C3)CC1	1801991270	YLRHAJWFGCSGST-YVSFHVDLSA-N	429.945	1.462	50	20	IDGD	
COC(=O)c1ccc(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CCC(=O)NN(C)C)C3)cc1	1802591468	PXHFTABKOVMILG-REPLKXPHSA-N	444.532	1.027	50	20	IDGD	
O=C1CC[C@H](C(=O)NC[C@@H]2CCN(C(=O)[C@H](F)Br)[C@H]2c2cccnc2)CN1	1802611229	SCXWGYVPORUWGY-SDADXPQNSA-N	441.301	1.304	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc3c(c2)OCO3)[C@H]1c1cccnc1)[C@H](O)CCl	1803138721	DWFSKTGYCZJHNN-FCEWJHQRSA-N	431.876	1.730	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cc(O)cc([N+](=O)[O-])c2)[C@@H]1c1cccnc1)[C@H](O)CCl	1803141276	NWBNZZOKTOAQSC-MORSLUCNSA-N	448.863	1.615	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2coc(Cl)n2)[C@@H]1c1cccnc1	1805020876	CHSARNORKYWYJM-KDOFPFPSSA-N	448.911	1.416	50	20	IDGD	
CCOC(=O)N[C@H](O)C(=O)N1CCC2(CCCN(C(=O)[C@@H](C)CBr)C2)CC1	1805385459	ZJXCKYLWAFPRAR-UONOGXRCSA-N	448.358	1.313	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2cccs2)[C@H]1c1cccnc1	1805391593	DKBSFFREFNUAET-OXJNMPFZSA-N	429.546	1.836	50	20	IDGD	
O=C(c1cc(-c2cccnc2)[nH]n1)N1CCC2(CCCN(C(=O)[C@H](O)CCl)C2)CC1	1805523133	PUWDMDBSPYHYHS-GOSISDBHSA-N	431.924	1.916	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)CCN2CCOCC2)[C@@H]1c1cccnc1	1806957114	QVYLYFUIECTHRT-HBFSDRIKSA-N	438.956	1.064	50	20	IDGD	
Cc1noc(CC(=O)N2CC[C@H](CNC(=O)[C@@H](F)Br)[C@@H]2c2cccnc2)n1	1808661373	KAMPMMCXRUNADH-UHOFOFEASA-N	440.273	1.712	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)c1ccn2ccnc2c1	1809871944	RVLLPJVDKBRCDE-JENIJYKNSA-N	427.892	1.649	50	20	IDGD	
C[C@@H](C(=O)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1)c1ccccn1	1809980250	QVXWWUXHISDCIU-GOSISDBHSA-N	435.333	1.410	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)[C@@H]2C[C@@H]2C2CC2)[C@@H]1c1cccnc1	1810293274	BSWJHRYRVQLMSC-HKJQZYRSSA-N	448.527	1.446	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2cnn3c2CCC3)[C@H]1c1cccnc1	1812143732	CWESGBNBILVOTP-HHXXYDBFSA-N	431.924	1.798	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)Cc2ncccn2)[C@H]1c1cccnc1	1812865859	YMRLJHBIAIGCRE-YEWWUXTCSA-N	432.322	1.904	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)CCn2ccnn2)[C@H]1c1cccnc1	1812867492	IYCSAWVDPUGRNT-LXZKKBNFSA-N	435.326	1.553	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2cccc(=O)n2O)[C@H]1c1cccnc1	1813029503	ODMGEIYPSKFOHY-MPGHIAIKSA-N	434.880	1.054	50	20	IDGD	
CC[S@](=O)CCC(=O)N1CC[C@H](CNC(=O)[C@H](Cl)COC)[C@@H]1c1cccnc1	1813032914	XXFNPZJGEZZXCO-NJVBMPMFSA-N	429.970	1.500	50	20	IDGD	
C=CCO[C@H](C)C(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1813069068	UESUUICGLHVCGP-PLMTUMEDSA-N	431.537	1.052	50	20	IDGD	
Cc1ccc(CC(=O)N2CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)o1	1813072485	CEPHFLBTPCJXRO-WZONZLPQSA-N	441.532	1.605	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)Cc2ccc(O)cn2)[C@H]1c1cccnc1	1813500371	ZRSKGGPKSYKXLW-ZAAXVRCTSA-N	432.908	1.685	50	20	IDGD	
CS(=O)(=O)c1ccc(C(=O)N[C@H]2CCc3nc(NC(=O)[C@H](F)Cl)sc3C2)nc1	1817117946	QIOQCVKJVFYMDL-SDBXPKJASA-N	446.913	1.702	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](F)Cl)sc2C1	1817122270	XBEKBVMUIAPOQC-RZUYCRIBSA-N	440.888	1.724	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2[nH]cc3c2CCC3)[nH]n1)c1ccc(B(O)O)cc1	1817472443	SMFKVUNNOHTJCR-LJQANCHMSA-N	447.304	1.526	50	20	IDGD	
O=C(/C=C\C(=O)NC1CC1)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](F)Br)CC2	1819531817	SEWIFIUOPWKFSS-JHYAKEMISA-N	445.314	1.580	50	20	IDGD	
CCNC(=S)NCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)CO[Si](C)(C)C)n[nH]1	1819596968	WINWDLCLTZKAHB-CQSZACIVSA-N	440.646	1.737	50	20	IDGD	
Cc1ocnc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1819943554	FXBUZBYGZNPPET-OAHLLOKOSA-N	438.448	1.324	50	20	IDGD	
CC[C@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](COC(C)=O)OC(C)=O)[nH]n1	1820856536	PKUYPRAPQVMFMT-IMJJTQAJSA-N	442.900	1.914	50	20	IDGD	
CN(CC(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H](O)CCl)CC1)C(=O)c1ccccc1	1824178174	DMDRMLDECDBCBN-UXHICEINSA-N	449.979	1.978	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)N[C@H]1CCc2nc(NC(=O)[C@H](Br)CC)sc2C1	1825445892	LDYNCKRXGDDCDL-OUAUKWLOSA-N	443.367	1.919	50	20	IDGD	
COC[C@H](NC(C)=O)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CCBr)CC1	1826358615	JDZVVANGAWCWCE-IRXDYDNUSA-N	446.386	1.542	50	20	IDGD	
Cc1cc[nH]c1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1	1828925050	CLETWOWJNLQKLO-LJQANCHMSA-N	438.532	1.869	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccon2)CC1	1828925992	WIMQWDDWADDJCO-GOSISDBHSA-N	426.477	1.220	50	20	IDGD	
CC(C)(C)c1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)cn1	1829569303	AILOCDRCSZQTBG-OXJNMPFZSA-N	427.904	1.984	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)cc1Cl	1830107414	QSDWCOCVUNJQEM-LPHOPBHVSA-N	431.316	1.318	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3c(O)cc(O)cc3O)C2)C1	1830363956	UUICJQVDYYYQQE-HXUWFJFHSA-N	442.896	1.138	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@H]2CCCS2(=O)=O)CC1	1831286316	VYQYSAZMKXFKEG-NUEKZKHPSA-N	449.411	1.967	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc4ccccn34)C2)C1	1831647159	RHCCQPVKFVQGTR-IIBYNOLFSA-N	434.924	1.812	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)C(F)(F)C(F)F)CC1	1831871953	XKTQTFHUGXGSGP-AWEZNQCLSA-N	438.466	1.880	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3cnccc3C)CCO2)C1	1833015206	OACGZYOTFJWWNP-GHTZIAJQSA-N	439.940	1.033	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3nccc4occc34)CC2)CC1)[C@@H](O)CCl	1833310177	AVYAGQNBCDDHPY-KRWDZBQOSA-N	434.924	1.613	50	20	IDGD	
C#CCO[C@@H](C)C(=O)NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1	1833466512	GXZCUVYMERDGLX-BBRMVZONSA-N	432.334	1.287	50	20	IDGD	
Cc1cc(C)n(CC(=O)NC2CCN(C3CCN(C(=O)C(Cl)Cl)CC3)CC2)n1	1833838687	KPNVNSVIYJTFSI-UHFFFAOYSA-N	430.380	1.875	50	20	IDGD	
Cc1noc(C)c1CCC(=O)NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1833846323	OVDDKJXITCXFOL-LJQANCHMSA-N	440.972	1.395	50	20	IDGD	
Cc1nc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)cs1	1834456939	FKEAYUAKQASGPF-DLBZAZTESA-N	436.361	1.758	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3noc4ccccc34)CCO2)C1	1835982877	YCNLLSRBAFLEIQ-HRAATJIYSA-N	435.908	1.844	50	20	IDGD	
CCc1noc(C)c1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)Br)C2)C1	1838060319	IKSPRABFGVQDKG-XIKOKIGWSA-N	444.326	1.399	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3cccc(C)n3)C2)C1	1840150085	FHZADVUUNZSZEP-NQIIRXRSSA-N	439.940	1.033	50	20	IDGD	
O=C(C(Cl)Cl)N1CCO[C@]2(COCCN(C(=O)C34CC(C(F)(F)F)(C3)C4)C2)C1	1840186890	QUPNRSLGIFHZIW-UYSNPLJNSA-N	445.265	1.979	50	20	IDGD	
Cc1c(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)nc2ccccn12	1840187609	NFGZBVDCHITVTR-IBGZPJMESA-N	441.315	1.516	50	20	IDGD	
O=C(c1ccc2ccnn2c1)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840189978	WDPNTUJBELCVSB-SFHVURJKSA-N	427.288	1.208	50	20	IDGD	
O=C([C@H](F)Br)N1CC2(CCCN2C(=O)Cn2ccc3sccc3c2=O)C1	1842020324	ICOKYDFJUZCIGD-AWEZNQCLSA-N	442.310	1.957	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)Cc1cc(C)[nH]n1)C2	1844692853	RVRKBWZJGMDALT-UHFFFAOYSA-N	441.444	1.611	50	20	IDGD	
COc1cc(C(=O)N2CC3(CCCN3C(=O)[C@H](F)Br)C2)c([N+](=O)[O-])cc1O	1845218554	MBIUOEABYGHBTD-ZDUSSCGKSA-N	446.229	1.817	50	20	IDGD	
C[C@@H]1OCCN(C(=O)OC(C)(C)C)[C@H]1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](F)Cl	1847890708	ACIHZUAVIMPCSL-BTFPBAQTSA-N	433.908	1.747	50	20	IDGD	
Cc1noc(CC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)n1	1848099837	YJXIJNCKYATLIS-IHRRRGAJSA-N	441.916	1.254	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)OCC(=O)N[C@H]2CCS(=O)(=O)C2)c(C)n1CCC(C)C	3535058	ZRGLWZWYXSQRBH-UDKWZTAFSA-N	435.546	1.905	50	20	IDGD	
O=C(COC(=O)CCN1C(=O)[C@@H]2CCCC[C@H]2C1=O)NNC(=O)c1ccc(Cl)cc1	9161784	UFFNOWYOLWSRAG-HUUCEWRRSA-N	435.864	1.210	50	20	IDGD	
O=C(COC(=O)COc1ccc2ccc(=O)oc2c1)NNC(=O)c1cccc([N+](=O)[O-])c1	10988440	QGUIZEBLSFHTNG-UHFFFAOYSA-N	441.352	1.084	50	20	IDGD	
CS(=O)(=O)N1CCc2cc(C(=O)NNC(=O)c3cc(-c4ccccc4)n[nH]3)ccc21	14805872	RFUJOWRVLCXNCN-UHFFFAOYSA-N	425.470	1.474	50	20	IDGD	
O=C(NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)C1=Cc2ccccc2OC1	15714422	XSOTUEVRCXEOGT-UHFFFAOYSA-N	427.482	1.708	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)c1cnc2sccn2c1=O	15762849	VATCRNSWRPHMHU-VIFPVBQESA-N	437.275	1.747	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CSc2nnc(COc3ccc(F)cc3)n2N)cc1	16371175	GMWPWDMLVJDUAT-UHFFFAOYSA-N	430.465	1.572	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@H](C)C(=O)NNC(=O)Cn1nnc2ccccc2c1=O	27202767	LSLOUPKNCOAHBK-CYBMUJFWSA-N	429.864	1.677	50	20	IDGD	
CC[S@](=O)c1ccccc1C(=O)OCC(=O)NNC(=O)c1ccc(OC)c(OC)c1	104847784	IBMVMTPMIGBOBW-SSEXGKCCSA-N	434.470	1.449	50	20	IDGD	
COc1ccc(C(=O)Nc2nc(CC(C)=NNC(=O)C(=O)NC3CC3)ns2)cc1OC	725852798	IAZBNNQGEQCCIR-UHFFFAOYSA-N	446.489	1.121	50	20	IDGD	
O=C(NCCC(=O)N1CCN(c2ncccn2)CC1)NNc1ccc(OC(F)F)cc1	726710556	GDNBOCSYHFTHQX-UHFFFAOYSA-N	435.435	1.443	50	20	IDGD	
CCc1nc(CCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cs1	726717557	ZOXQDWJODWFDGN-UHFFFAOYSA-N	425.536	1.143	50	20	IDGD	
O=C(COC(=O)c1cc(F)c(Cl)nc1Cl)NNC(=O)[C@H]1COc2ccccc2O1	728343826	QRVJYDOGFRQTRQ-GFCCVEGCSA-N	444.202	1.672	50	20	IDGD	
CC[C@@H](NC(=O)NNC(=O)C(=O)Nc1ccc(C)c(C)c1)c1cccc(S(N)(=O)=O)c1	729613098	NOJSUXAXJHCLNZ-QGZVFWFLSA-N	447.517	1.371	50	20	IDGD	
O=C(COC(=O)CCc1nc(-c2ccsc2)no1)NNC(=O)c1ccc([N+](=O)[O-])cc1	729920831	OUDXDSRHOOUOHW-UHFFFAOYSA-N	445.413	1.643	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H](CCNC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)C1	730138971	LGRKKMBVCIEOSR-PBHICJAKSA-N	434.493	1.804	50	20	IDGD	
C[C@H]1CCCN(S(=O)(=O)c2cc(C(=O)NNC(=O)CCc3ccccc3)n(C)c2)C1	730179825	CLZYPYRBLBOFNZ-INIZCTEOSA-N	432.546	1.840	50	20	IDGD	
O=C(CCCOc1ccc(Cl)cc1Cl)NNC(=O)Cn1[nH]cc2c(=O)ncnc1-2	730514408	GYFBIOLJHXDLDM-UHFFFAOYSA-N	439.259	1.385	50	20	IDGD	
COc1ccc(C(C)=NNC(=O)CSc2nnc(O)nc2O)cc1CN1CCCC1	730558880	VJLZCDCVOGWRDG-UHFFFAOYSA-N	432.506	1.520	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2ccc(COc3ccccc3C#N)o2)C[C@H](C)O1	732263120	KCAMRDBDSHIEEO-HOTGVXAUSA-N	426.473	1.991	50	20	IDGD	
CCN(CC)[C@@H](C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1)c1ccccc1	732351226	YACNYXPNDPZMGC-TZIWHRDSSA-N	441.484	1.600	50	20	IDGD	
CN1CCN(C)[C@@H](CNC(=O)NNC(=O)COc2ccc(OCc3ccccc3)cc2)C1	732474615	IKBBJILVOFWFAM-IBGZPJMESA-N	441.532	1.221	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)N[C@@H](Cc1ccccc1)CN1CCOCC1	732476593	PSYJBVXRPFPVKT-IBGZPJMESA-N	440.500	1.345	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NC2CCN(C[C@H]3CCCO3)CC2)c2ccccc2c1=O	734281783	KEWPNQMPAMXPBA-MRXNPFEDSA-N	442.520	1.004	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)c2ccc(C(=O)NNC(=O)c3cnn(C)c3)cc2)cc1	735446288	LARSTIFBLJKWHE-UHFFFAOYSA-N	427.486	1.628	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(N2CCCC2)c(C(=O)NNC(=O)c2cnn(C)c2)c1	735471460	YRXBNKKTCAZVHV-UHFFFAOYSA-N	448.549	1.126	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNS(=O)(=O)c2ccc3c(c2)N(C(C)=O)CCC3)c1	736062991	BJWXTGVWOWTLMB-UHFFFAOYSA-N	433.486	1.626	50	20	IDGD	
CCc1cc(NNC(=O)CCNS(=O)(=O)c2cccs2)nc(-c2ccccn2)n1	738530485	KVYJRGQADYDTIG-UHFFFAOYSA-N	432.531	1.974	50	20	IDGD	
CC[C@@H](COC)NC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	739049037	MNVVJSCVANFWEP-KRWDZBQOSA-N	434.518	1.534	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)C(=O)N1CCCC[C@@H]1C	743581744	FAYUUXQKLLCJEK-STQMWFEESA-N	425.511	1.215	50	20	IDGD	
C[C@H]1C[C@@H](NC(=O)NNC(=O)c2cccc(Br)c2)C(=O)N1c1cnn(C)c1	743686523	JIBXYIAZLAYUQU-IINYFYTJSA-N	435.282	1.321	50	20	IDGD	
N#Cc1cccc(NC(=O)C2CCN(CC(=O)NNC(=O)c3cccc(C#N)c3)CC2)c1	744392761	CXFYBRWVYZPKOP-UHFFFAOYSA-N	430.468	1.542	50	20	IDGD	
C[C@H](NC(=O)OC(C)(C)C)C1CCN(CC(=O)NNC(=O)c2cccc(C#N)c2)CC1	744398295	NPKRACDETLXDAY-HNNXBMFYSA-N	429.521	1.944	50	20	IDGD	
CC[C@H](NC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)c1ccncc1	745837075	WWDNAMRLCQPDJM-SFHVURJKSA-N	431.518	1.961	50	20	IDGD	
CCCN1CCC(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)CC1	745865127	BBNJWTZMVRZRMU-UHFFFAOYSA-N	437.566	1.290	50	20	IDGD	
O=C(NCCOC1CCC1)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	745904813	RDFILFWBFBTNJB-UHFFFAOYSA-N	435.484	1.958	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)N[C@@H]2CC(=O)N([C@@H]3C[C@H]3c3ccccc3)C2)cc1	745914361	NBYPHGLRAJTMIO-LSTHTHJFSA-N	438.484	1.561	50	20	IDGD	
O=C(NNC(=O)N1CCOCC1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1	745996178	PSRWPKKLBQGUOM-UHFFFAOYSA-N	445.398	1.903	50	20	IDGD	
O=C(CCOc1ccccc1)NNC(=O)[C@H]1CCCCN1S(=O)(=O)c1cccs1	747177421	AEEGNJYIEJQHIY-MRXNPFEDSA-N	437.543	1.908	50	20	IDGD	
O=C(Cn1nnc(-c2ccccc2)n1)NNC(=S)NCc1ccc(Br)cc1	747645180	GCHGRIASIQIIND-UHFFFAOYSA-N	446.334	1.798	50	20	IDGD	
CCn1c(CCC(=O)NNC(=O)c2ccc[nH]2)nc2cc(S(=O)(=O)N(C)C)ccc21	747662997	SZJBPSXAMVBEBC-UHFFFAOYSA-N	432.506	1.028	50	20	IDGD	
O=C(NCCCN1CCN(c2ccncc2)CC1)NNC(=O)c1ccc2ccccc2n1	748344029	RSABXNBXXOHQJO-UHFFFAOYSA-N	433.516	1.786	50	20	IDGD	
COc1ccc(-n2c(C)cc(/C=C(/C#N)C(=O)N3CCN4C(=O)NC(=O)[C@H]4C3)c2C)cc1	749253158	OIQIYCZVWUJFNA-ZZODWALSSA-N	433.468	1.772	50	20	IDGD	
O=C(CC1CCCC1)NNC(=O)C1CCN(S(=O)(=O)c2cccnc2Cl)CC1	749950844	LWOZJBVCQUZLGF-UHFFFAOYSA-N	428.942	1.863	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)c2cccn3c(I)cnc23)cc1	750611173	YHZNBRCGKIEMCT-UHFFFAOYSA-N	431.193	1.885	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)NCC1(CN2CCOCC2)CCCCC1	751810756	VEPCGWIMNHOVNX-UHFFFAOYSA-N	429.521	1.550	50	20	IDGD	
CCOCCOc1cc(C)ccc1CNC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	755087115	ODFPKEXQPJSHGS-UHFFFAOYSA-N	439.476	1.530	50	20	IDGD	
O=C(Cc1cc[nH]n1)NNC(=O)c1cccc(S(=O)(=O)Nc2ccc(Cl)cc2)c1	755277160	PLTTXKLVNFDGBX-UHFFFAOYSA-N	433.877	1.868	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)cn2)C[C@@H](C)O1	755865357	RDPFFRSDGSPOFL-OKILXGFUSA-N	437.464	1.137	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)Nc3ccc(C(N)=O)c(F)c3)n[nH]2)cc1OC	756353490	ZYODLUNWPAWWRU-UHFFFAOYSA-N	442.407	1.798	50	20	IDGD	
COc1cc(C(=O)N(C)C)ccc1NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1	756868566	KEIDZBFXVVUIJM-UHFFFAOYSA-N	441.492	1.256	50	20	IDGD	
NC(=O)c1cccc(NC(=O)NNC(=O)[C@H]2Cc3ccccc3CN2Cc2ccccc2)n1	757737689	CDZRKHQJGWMCKC-HXUWFJFHSA-N	444.495	1.960	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)cc(OC)c1Br	757904834	MCPZJXKZCKGKMB-QMMMGPOBSA-N	436.284	1.054	50	20	IDGD	
COc1ccc(-c2nn(CCC#N)cc2/C=C(/C#N)C(=O)N(C)[C@@H]2CCNC2=O)cc1OC	760103091	HTNYCEKPLDWNTL-MUMAZLPKSA-N	448.483	1.735	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Cc2ccc(F)cc2)nc1I	761136847	ZHBRKDYSDWJKNK-UHFFFAOYSA-N	429.189	1.838	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCCOc2ncccc2Cl)nc1	761780585	NNXOQYDSXGTKLE-UHFFFAOYSA-N	428.902	1.522	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H]1[C@@H]1COCCC1=NNC(=O)N[C@H]1CCS(=O)(=O)C1	762418679	RNWOSPZFFWTNBW-SQWLQELKSA-N	444.554	1.265	50	20	IDGD	
CN(C)CCOc1ccc(NC(=O)C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1Cl	763442066	KZYJSHHBIHLJCA-UHFFFAOYSA-N	449.851	1.588	50	20	IDGD	
Cc1cc(C)nc(-n2nc(C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)cc2C)n1	763577220	GGRBFWDAKGNHHX-UHFFFAOYSA-N	432.485	1.056	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(C)c(-n3cnnn3)c2)c2ccccc2n1	763619332	SQJMOZGEFGRXJX-UHFFFAOYSA-N	430.428	1.227	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C)c(C)c2)c(OCCN(C)C)c1	763680415	OYOXISWMCFXBSP-UHFFFAOYSA-N	442.516	1.717	50	20	IDGD	
CN(C)Cc1cccc(NC(=O)C(=O)NNC(=O)COc2ccc(Br)cc2)c1	763695781	WUOOISPAPVCKOG-UHFFFAOYSA-N	449.305	1.676	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])nn1-c1ccccc1	763803795	NVBARDBZZJAKCK-UHFFFAOYSA-N	438.400	1.254	50	20	IDGD	
CC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)cc1Cl	763807536	DHGFHSMACLBFBA-UHFFFAOYSA-N	429.820	1.335	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(F)cc1OCC(F)F	763807989	SSBBEGPDDOZEDZ-UHFFFAOYSA-N	436.346	1.506	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc3nc(C)cn3c2)cc1	763861914	TWJRCLGLQYACKU-CQSZACIVSA-N	425.445	1.595	50	20	IDGD	
CCOc1ccc(C#N)cc1NC(=O)C(=O)NNC(=O)c1ccc(OCC)c(OC)c1	763901095	LDZZOYTVGZNTHT-UHFFFAOYSA-N	426.429	1.764	50	20	IDGD	
CN(C)c1nc2cc(NC(=O)C(=O)NNC(=O)c3nn(-c4ccccc4)cc3O)ccc2o1	763947972	HYFULFFLBKHNKR-UHFFFAOYSA-N	449.427	1.185	50	20	IDGD	
CC(C)(C)OC(=O)N1CCc2ccc(NC(=O)C(=O)NNC(=O)c3ccc[nH]3)cc2C1	763980136	VJAPBIPCIQTZLB-UHFFFAOYSA-N	427.461	1.708	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(Br)c2)cc1NC(C)=O	764058151	BSYUYTUYCBKOAR-UHFFFAOYSA-N	449.261	1.816	50	20	IDGD	
CC(C)Oc1ccc(F)cc1NC(=O)C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	764084761	HJFGPTXFTYKWGP-UHFFFAOYSA-N	437.449	1.416	50	20	IDGD	
COc1cc(Br)cc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)nc2)c1	764101463	RGYMVGPFVJRHLF-UHFFFAOYSA-N	427.642	1.906	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cccc(-c4nncn4C)c3)n[nH]2)cc1	764110184	GUJNPXHFUWWSHB-UHFFFAOYSA-N	444.455	1.580	50	20	IDGD	
CO[C@H](C)C(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)c1	764126364	IRAZWVVHXRYZTG-SNVBAGLBSA-N	434.836	1.419	50	20	IDGD	
CCCCN(C)S(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)CC2CCCC2)cc1	764179829	WRLQSQKKIPQOQN-UHFFFAOYSA-N	438.550	1.773	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)C(=O)Nc1ccc(C(=O)N2CCCC2)cc1	764243117	MCABRRJFSQWASI-UHFFFAOYSA-N	433.468	1.663	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)C(=O)Nc1ccc(CC(=O)Nc2ccccc2F)cc1	764263407	HSBOCUVBAWEXSD-UHFFFAOYSA-N	449.442	1.731	50	20	IDGD	
O=C(NNC(=O)C1(O)CCSCC1)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	764674046	AHOJSSYNNQMPPK-UHFFFAOYSA-N	438.513	1.408	50	20	IDGD	
Cc1cc(I)cc(C(=O)NNC(=O)CNC(=O)c2ccco2)c1C	765381922	LIAZSZUVILHHQP-UHFFFAOYSA-N	441.225	1.692	50	20	IDGD	
COc1ccc(N2CCN(CCNC(=O)NNc3ccccc3S(C)(=O)=O)CC2)cc1	765718190	UORJEUVSRMJRAF-UHFFFAOYSA-N	447.561	1.547	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)[C@H]1CSCCS1	766659285	ABIRFJJLWFRTRV-MRXNPFEDSA-N	429.011	1.454	50	20	IDGD	
Cn1ncc([N+](=O)[O-])c1C(=O)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1	766838761	BCXJVLAUGPGUNE-SFHVURJKSA-N	434.456	1.716	50	20	IDGD	
Cn1cc(C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c(-c2cccs2)n1	768689739	SYYZDVTVRQWXDT-UHFFFAOYSA-N	429.414	1.675	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)CN2C(=O)N[C@]3(CCCC(C)(C)C3)C2=O)c1	768929044	UFMBXFILCFDVTA-NRFANRHFSA-N	431.493	1.145	50	20	IDGD	
CC/C=C(/C)C(=O)N1CSC[C@H]1C(=O)NNc1nc(O)c2cnn(C(C)(C)C)c2n1	770959792	ZSKZGXMIIKBQOL-YLBKJLTLSA-N	433.538	1.988	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)[C@@H](C)NC(=O)c1ccc(Br)s1	772036998	MSRPBQNHGAQXBT-ZJUUUORDSA-N	448.339	1.754	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)C2(OCc3ccccc3)CCOCC2)n1	772414126	GTNYIBVZDXOWBU-UHFFFAOYSA-N	447.513	1.451	50	20	IDGD	
COc1ccc(/C=C\C(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)cc1O	773390633	AAPHFOBIEJQGCZ-NTMALXAHSA-N	438.528	1.688	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)Cc2csc(N3CCOCC3)n2)cc1	773714015	SRFORPWQNFYRFC-AWEZNQCLSA-N	434.518	1.536	50	20	IDGD	
C[C@@H](NCC(=O)NNC(=O)c1cccc(Cl)c1)c1ccc(S(=O)(=O)N(C)C)cc1	775192251	QESNTKZWAVQIOH-CYBMUJFWSA-N	438.937	1.702	50	20	IDGD	
O=C(Cc1ccc2ccccc2c1)NNC(=O)Nc1ccc(C[C@H]2NC(=O)NC2=O)cc1	775700363	DKVVYTHOSQTOIP-LJQANCHMSA-N	431.452	1.986	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccc(NC(=O)NNc2cccc(S(C)(=O)=O)c2)nc1	776062836	KPYKZQWJVCYMQI-UHFFFAOYSA-N	441.535	1.711	50	20	IDGD	
Cn1cc([C@@H](NC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])c2ccc(F)cc2)cn1	776196172	GLAPTFKPBLEGRP-IBGZPJMESA-N	442.407	1.966	50	20	IDGD	
COC(=O)C1(c2ccc(S(=O)(=O)NNC(=O)c3cc([N+](=O)[O-])ccc3O)cc2)CC1	776280169	BSRDBFHWWWQUOM-UHFFFAOYSA-N	435.414	1.128	50	20	IDGD	
COCCO[C@@H]1COCC[C@@H]1NC(=O)NNC(=O)c1sc(-c2ccccc2)nc1C	776845947	IWMSHVXVJYBWME-JKSUJKDBSA-N	434.518	1.883	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNS(=O)(=O)c1ccc(NC(=O)C(F)(F)F)cc1	777939823	QSWPSGGOKZTMRV-UHFFFAOYSA-N	440.400	1.022	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)c2nn(-c3ccccc3F)c(C)cc2=O)nc1C	778425524	BDKARRNVGHEIFG-UHFFFAOYSA-N	426.408	1.712	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1S(=O)(=O)NNC(=O)CCCc1ccccc1	780388186	XILYTIRQENWRQC-UHFFFAOYSA-N	425.532	1.269	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(OCC(=O)NNc2ccnc(F)c2)c([N+](=O)[O-])c1	781366700	QKOJXAGRTYYFGW-UHFFFAOYSA-N	441.441	1.682	50	20	IDGD	
COc1cccc(/C=C(\C#N)C(=O)O[C@H](C(=O)N[C@]2(C)CCS(=O)(=O)C2)C(C)C)c1	782445007	BNIBDXBDQNJBHP-UMWZGDBLSA-N	434.514	1.863	50	20	IDGD	
Cn1c(NNC(=O)c2cccc(NS(=O)(=O)C(F)(F)F)c2)nc2ccccc2c1=O	782707302	WDWQVOQYOQFEMS-UHFFFAOYSA-N	441.391	1.952	50	20	IDGD	
COC(=O)c1ccc(-n2cc(C)cn2)c(NC(=O)C(=O)NNc2cncc(Cl)n2)c1	783259366	BWCSOIIMNRCFGK-UHFFFAOYSA-N	429.824	1.493	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NN=c2sc3ccccc3n2C)cc1C(=O)OC	783352042	VEBYFCNHQBJDBT-UHFFFAOYSA-N	442.453	1.384	50	20	IDGD	
CC(C)(C)OCc1ccc(NC(=O)C(=O)NNC(=O)CNC(=O)c2cccs2)cc1	784004701	JWLSORJQFXQOBS-UHFFFAOYSA-N	432.502	1.579	50	20	IDGD	
CS(=O)(=O)c1c(Cl)cccc1NC(=O)C(=O)NNc1ccc(Br)cn1	784340256	NWKCDXGLHXEWTJ-UHFFFAOYSA-N	447.698	1.983	50	20	IDGD	
CC(C)(C)N1C(=O)C[C@H](C(=O)NNC(=O)C(=O)NC2CC2)[C@@H]1c1ccc(Cl)c(F)c1	785066389	OIIZQTHYRVJCRE-LRDDRELGSA-N	438.887	1.593	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2ccc(C(=O)c3nccn3C)cc2)n1	785226144	QNXUXKBLXJPYKK-UHFFFAOYSA-N	436.476	1.369	50	20	IDGD	
COc1cc(F)cc(NNC(=O)C(=O)Nc2ccc(CN3C(=O)CCCC3=O)cc2)c1	785235315	VQTNLMJXAJCKKA-UHFFFAOYSA-N	428.420	1.955	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1cccc(-n2cccc2)c1	785331422	UPXCAJNQZDMSKD-UHFFFAOYSA-N	428.470	1.971	50	20	IDGD	
O=C(COC(=O)CCSc1ccc(F)cc1)NNC(=O)[C@H]1COc2ccccc2O1	787343987	ZUPSQQFUBBLCAR-QGZVFWFLSA-N	434.445	1.839	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ccc(OC)c(OC)c2)c(C)cc1C	788332140	XPAAXGUWADAUPM-UHFFFAOYSA-N	429.429	1.507	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(-n3ccc(C)n3)cc2)cc1	793021807	KGXCSIYLBSHDBP-INIZCTEOSA-N	449.467	1.937	50	20	IDGD	
O=C(NNS(=O)(=O)c1cnc2onc(-c3ccccc3)c2c1)[C@@H]1CCc2nncn2C1	793452355	YBHTVCNUELRNQR-CYBMUJFWSA-N	439.457	1.053	50	20	IDGD	
CCCCCn1nc(C(=O)NNS(=O)(=O)c2ccc(OC)nc2)c2ccccc2c1=O	795285147	WSIMMBCZCQWNKX-UHFFFAOYSA-N	445.501	1.614	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)CNC(=O)OCc2ccccc2)cccc1N(C)C	797369293	RZBCXNWQYWCDCN-UHFFFAOYSA-N	427.461	1.073	50	20	IDGD	
CCc1ccnc(CNC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1	798119949	SCZQEIKIRAZHGR-UHFFFAOYSA-N	431.518	1.573	50	20	IDGD	
N#Cc1cc(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)ccc1OC(F)(F)F	799834394	CXQXBWUXGLDLKY-HNNXBMFYSA-N	434.330	1.546	50	20	IDGD	
C[C@@H](c1ccc(S(N)(=O)=O)cc1)N(C)C(=O)NNC(=O)c1cc(Br)c[nH]1	799857359	OMFZLHWHBQTSDH-VIFPVBQESA-N	444.311	1.472	50	20	IDGD	
O=C(CSc1nnc(C2CC2)n1Cc1ccccc1)NNC(=O)CN1CCCC1=O	800695464	YATQOZDENDWFDB-UHFFFAOYSA-N	428.518	1.066	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)CN2C(=O)N[C@@](C)(c3ccc(F)cc3)C2=O)cc1	802060242	CKXRFPNMYXVJAS-FQEVSTJZSA-N	429.408	1.454	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)CCC[C@@]2(C)NC(=O)NC2=O)cc1Cl	802072113	KTUPICKSIJQUPB-QGZVFWFLSA-N	427.845	1.278	50	20	IDGD	
CCS(=O)(=O)N1CCC[C@@H](C(=O)NNC(=O)Nc2cc(Cl)c(OC)cc2OC)C1	802075923	QTVJZZNSJUISJB-LLVKDONJSA-N	448.929	1.572	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)N=c2ccnc3n(C)[nH]cc2-3)c(C)n1-c1ccccc1	806973503	PQURPUKYUIMHOY-UHFFFAOYSA-N	431.456	1.149	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)c2cnn(CCN(C)C)c2-c2ccccc2)c1	807116976	RMKAWABWXNIGES-UHFFFAOYSA-N	435.488	1.540	50	20	IDGD	
O=C(NNc1ncccc1F)C(=O)N1C[C@@H](C(=O)N2CCCCC2)Oc2ccccc21	807300503	NTOSUBFXNCEVEZ-KRWDZBQOSA-N	427.436	1.471	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)[C@@H]2CCN(c3ccccc3Cl)C2)c2ccccc2c1=O	809933144	TURPHJLBSMRUOA-CYBMUJFWSA-N	425.876	1.874	50	20	IDGD	
COc1cc(Cl)c(C)cc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	813033436	SLZHTRFUZRUVKC-UHFFFAOYSA-N	440.909	1.989	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)C[C@@H]1CCCS(=O)(=O)C1	814739418	OJBHBEYYYOOANS-RYUDHWBXSA-N	433.324	1.579	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)c2cnc(C3OCCO3)s2)C1	816510546	YWJPXQVQOUWQLL-NSHDSACASA-N	426.495	1.597	50	20	IDGD	
C[C@H]1CN(c2ccnc(C(=O)NNc3ccccc3S(=O)(=O)N(C)C)c2)C[C@H](C)O1	817054364	GKFCWYDTZVKXHB-GJZGRUSLSA-N	433.534	1.702	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)[C@@H]1CC(=O)N(c2cc(Cl)ccc2OC)C1	825624066	DJJNIEQOJVLRIT-CYBMUJFWSA-N	446.891	1.970	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)c(S(=O)(=O)NC[C@H]2CCCO2)c1)c1ccncc1	912768621	HGNMZOAXRLXBPM-CQSZACIVSA-N	438.893	1.267	50	20	IDGD	
CCNC(=O)CN1CCN(C(=O)/C(C#N)=C/c2cc(C)n(C[C@H]3CCCO3)c2C)CC1	913010179	UNABPIHXKQJSPP-NNVROAHOSA-N	427.549	1.471	50	20	IDGD	
O=C(COc1ccc2cc(Br)ccc2c1)NNC(=O)[C@@H]1CCS(=O)(=O)C1	916041824	KTJZWYRAULSKQJ-CYBMUJFWSA-N	441.303	1.563	50	20	IDGD	
O=C(CN1CCC(NC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)CC1)Nc1ccccc1	916240072	KURWTPHFLUTETI-UHFFFAOYSA-N	440.460	1.642	50	20	IDGD	
COCCOc1ccc(CNC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1	916514254	HOPRSBFNDIKBKP-UHFFFAOYSA-N	425.445	1.103	50	20	IDGD	
COc1cc(CNC(=O)NNC(=O)COc2cc(C)cc(C)c2)ccc1OCC(N)=O	916641060	UTHUFEGCACWVKO-UHFFFAOYSA-N	430.461	1.086	50	20	IDGD	
CNS(=O)(=O)c1ccc([C@@H](C)NC(=O)NNC(=O)COc2ccc(OC)cc2)cc1	919778482	CVEKGSNRMJFZSI-CYBMUJFWSA-N	436.490	1.074	50	20	IDGD	
CS(=O)(=O)c1ccc(Br)c(S(=O)(=O)NNC(=O)c2ccccc2O)c1	919954118	DQWQWKSGPARRDF-UHFFFAOYSA-N	449.304	1.182	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)CC2(CC(=O)N3CCOCC3)CCCC2)cc1	1317957342	JUXHQMCMSVLKIT-UHFFFAOYSA-N	431.533	1.975	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NC2CCN(Cc3ccncc3)CC2)cc1	1319233337	BMWFQGBGPGZEHB-UHFFFAOYSA-N	446.533	1.485	50	20	IDGD	
Cn1cc(N2CC[C@@H](NC(=O)NNc3ccc(S(=O)(=O)C(F)(F)F)cc3)C2)cn1	1322976228	RDNYAUFBIFHMOY-GFCCVEGCSA-N	432.428	1.619	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4nccn4c3)C2)C1	1778011836	PVUJEFRKYQQFID-LIRRHRJNSA-N	435.322	1.809	50	20	IDGD	
CCCc1onc(C)c1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2	1778262534	SJGCBRIJKDFQJR-YYFZDKIDSA-N	427.929	1.663	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H]1CC(c3ccccc3)=NN1)CCO2	1779299317	RIFNHLWADUDKFV-DENIHFKCSA-N	444.608	1.434	50	20	IDGD	
COC(=O)C1(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CO[Si](C)(C)C)C2)CC1	1779546387	SFPNBLOTXQWTKU-DNVCBOLYSA-N	426.586	1.305	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)c(OC)c1	1780532953	AZGSGJIXLZRUPL-NRFANRHFSA-N	436.581	1.999	50	20	IDGD	
Cc1c(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](F)Br)C2)cnn1C	1780771908	SHPWFISSTAKXAP-JKIFEVAISA-N	431.306	1.547	50	20	IDGD	
CC(=O)N[C@H](C(=O)N1CCO[C@]2(CCN(C(=O)[C@@](C)(Cl)CCl)C2)C1)C(C)(C)C	1781225099	DKPVJJNIZFWSJV-MDASCCDHSA-N	436.380	1.603	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)c3nc(O)n4c3CCCC4)CCO2)C1	1781230507	TXFFINDZXUDTMR-RBUKOAKNSA-N	445.347	1.605	50	20	IDGD	
O=C([C@H](F)Br)N1CC[C@]2(C1)CN(C(=O)[C@H](O)Cc1ccccc1)CCO2	1781332824	FOHKLVUQVNQVHY-VKJFTORMSA-N	429.286	1.110	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@H](C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)C1	1781334167	MPSFIQWCCIRRRM-HNSFDTNUSA-N	449.317	1.486	50	20	IDGD	
Cc1nccn1CCCC(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781334385	MXJHOVRJQDIFQS-NVXWUHKLSA-N	431.306	1.492	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(Cl)Cl)C2)c1nc2ccc(F)cn2n1	1781434225	CGWMQPBLEAIHGC-KZULUSFZSA-N	444.294	1.800	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cccc(F)c3[N+](=O)[O-])C2)C1	1781772041	ITIXOTSPTITYIX-FZKQIMNGSA-N	429.832	1.431	50	20	IDGD	
CC[C@H](NC)C(=O)N1CCO[C@]2(CCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1	1782864495	NAZJYPKJDYSXAA-ZMMSGNDHSA-N	432.471	1.700	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)CCc3cccc(O)c3)CCO2)C1	1783539470	JXUQPYYZMRSOER-KUHUBIRLSA-N	425.323	1.938	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3nc4cc(C)c(C)cc4[nH]3)CCO2)C1	1783877448	IZOIEDVSTZVDNN-BTYIYWSLSA-N	434.924	1.877	50	20	IDGD	
CCc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]3C2)no1	1783970571	WVMLOPPKKPKUFC-DSPQJCBJSA-N	428.327	1.861	50	20	IDGD	
C[C@H](Oc1ccccn1)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2	1784489120	UWCYHUWMVPHLFA-KYNGSXCRSA-N	430.332	1.915	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3CCC(CO)CC3)[C@H]2C1	1785051501	DBZMMURBCSQOHW-ZZTPGCILSA-N	445.398	1.796	50	20	IDGD	
O=C(Cc1cccc(C(F)(F)F)n1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21	1785281966	BTSPHZVCTWRVTM-MHEUCROKSA-N	449.857	1.222	50	20	IDGD	
COCCOCCOCCC(=O)NC1(c2ccc(NC(=O)[C@@H](O)CCl)cc2)CCC1	1786138865	YGGCKPNUHCMHQP-SFHVURJKSA-N	442.940	1.790	50	20	IDGD	
O=C(CC[C@H]1CNc2ccccc2C1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21	1786901181	RQEXIJYKGJZUQB-ITXZTEAGSA-N	449.979	1.630	50	20	IDGD	
N[C@H](CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)c1cccnc1	1786928426	IPPYOFIRTJSYLW-JBXGNFEISA-N	443.317	1.142	50	20	IDGD	
Cc1ncc(C(=O)Nc2ccc(C3(NC(=O)c4cnccc4C(=O)NN)CCC3)cc2)cn1	1787218661	IBXDWZRFBRAVFZ-UHFFFAOYSA-N	445.483	1.845	50	20	IDGD	
O=C(CCN1CCCC1)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1	1788149967	JTMXSQGWPIOBEN-UHFFFAOYSA-N	435.333	1.600	50	20	IDGD	
C[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)N1C[C@H]2C[C@H]2C1	1788509037	KRHLBAJFFRFMRO-DZTUFKMZSA-N	428.371	1.091	50	20	IDGD	
C[Si](C)(C)c1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](O)CCl)C[C@@H]32)co1	1788590254	LQRNKBCYYHHWLF-HNKHHVNMSA-N	428.989	1.018	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC1(c2ccc(NC(=O)CCN3CCOC3=O)cc2)CCC1	1789141076	RVRIZAXNOPOWHQ-UHFFFAOYSA-N	445.520	1.336	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)c1cc2cccnn2n1	1789144109	DVSJXKBCLVFTOO-HQRZJTNHSA-N	440.273	1.013	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1ccc(C2(NC(=O)C(=O)c3ccco3)CCC2)cc1	1789521129	JMIHMWRYHUJDBL-UHFFFAOYSA-N	447.451	1.909	50	20	IDGD	
NC[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]2C1)c1ccccc1	1789923087	XVYAWOCSYSQMGQ-QUSNUVHPSA-N	442.329	1.399	50	20	IDGD	
CN1Cc2ccccc2C[C@H]1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]2C1	1791294332	XFJRCPFGDWTQTQ-XSLAGTTESA-N	440.371	1.827	50	20	IDGD	
CC(C)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc(C(F)(F)F)cn1)C2	1792782880	BZWKACFHNQDCMX-GNXNZQSNSA-N	434.846	1.964	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCc1ccc(F)c(F)c1	1792825020	CBRGPMZBVFPVCK-BJWYYQGGSA-N	436.503	1.909	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(C)(C)c1ccccn1)C2	1792872004	IKNHASZMLQMZIH-MPTYRVRUSA-N	438.366	1.980	50	20	IDGD	
Cc1ccc(CCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)nc1	1794360937	AVPFOTHZUOIOFE-BCDXTJNWSA-N	436.516	1.273	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1noc3c1CCCC3)C2	1795112900	ROHKUDWEBMCNIO-DRXBFXEBSA-N	426.311	1.542	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)c1cccc(-c2ccccc2)n1	1796536026	HIIGOOLBFGJBHB-WOUAJJJCSA-N	429.904	1.552	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C=C/c1cnccn1)C2	1796893283	WOJGWXIZIHUZDH-LSGQOIPPSA-N	435.488	1.262	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnn(C)c1Cl	1798343130	NNWZMFGNRVIUAT-KQXIARHKSA-N	433.734	1.308	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccnc(Cl)n1	1798762342	IFXIQMJEUUWARE-SIENDBQGSA-N	443.895	1.516	50	20	IDGD	
CN(C)c1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@](C)(Cl)CCl)cn1	1799276226	BEUWTIXIFPBIBM-QHHYFVSCSA-N	429.348	1.587	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cc(C)n(C)n1)C2	1800637961	KYPDGSFCSWKWHQ-IARIHHJXSA-N	427.343	1.034	50	20	IDGD	
Cc1ncc(/C=C/C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)Br)s1	1800763292	VUBYWPYPBWDBFM-XMIFDPAWSA-N	428.352	1.838	50	20	IDGD	
COC(=O)[C@H]1CCC[C@@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)C(C)(C)CCl)C3)C1	1800962586	RVWBHYVGBNJGPJ-BPKGMFCQSA-N	428.957	1.820	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c(Cl)cncc1Cl)C2	1800973936	NKXZENXUTDZSHY-FJHTZYQYSA-N	436.723	1.845	50	20	IDGD	
Cc1cccc(C)c1NC(=O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(Cl)Cl	1801017384	SZRTVGDGWPWTPW-AGGWBTHJSA-N	428.316	1.635	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CCc2nc[nH]c2C1	1801266205	XZPYOUPADKXALK-CGEFAEBTSA-N	439.354	1.135	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(CO)c(F)c1	1801903081	JIVPMLQXBFVKTE-HPAJIGNASA-N	429.286	1.305	50	20	IDGD	
C[C@H](C#N)c1cccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CCC(=O)NN(C)C)c1	1802344318	WVMPRRHFWSWATF-GEALJGNFSA-N	425.533	1.938	50	20	IDGD	
COc1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CCC(=O)NN(C)C)C3)c(Cl)c1	1803747284	MSGGCRUMWMKZKP-QDMKHBRRSA-N	436.940	1.973	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2ccsc2)[C@H]1c1cccnc1	1805424834	KVPWMBUGFCXJBT-OXJNMPFZSA-N	429.546	1.836	50	20	IDGD	
Cc1ncccc1C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1807365677	ZJTGDAAPAXPTIZ-SIKLNZKXSA-N	444.300	1.098	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC2(CCCN(C(=O)c3ccn(C)n3)C2)CC1	1808435478	YRGLLEFOLSGEDG-LFVJCYFKSA-N	439.520	1.399	50	20	IDGD	
CC[C@H](NC(C)=O)C(=O)N1CC[C@H](CNC(=O)[C@@H](F)Br)[C@H]1c1cccnc1	1808649494	SIAMPOJQHKGDSD-QKPAOTATSA-N	443.317	1.693	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)c1ccc2ncnn2c1	1810052580	QYJJLIDEYZYSCQ-YXJHDRRASA-N	428.880	1.044	50	20	IDGD	
Cn1cccc(C(=O)N2CC[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]2c2cccnc2)c1=O	1810541955	WZTDPXZETFHQEO-FXAWDEMLSA-N	442.592	1.951	50	20	IDGD	
COc1cc(C(=O)NC[C@H]2CCN(C(=O)CO[Si](C)(C)C)[C@H]2c2cccnc2)nn1C	1811633290	DYLQKSZYYFSBQS-UZLBHIALSA-N	445.596	1.995	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)c2cccn(C)c2=O)[C@@H]1c1cccnc1	1812864419	HMAMQFYOGVLDIJ-YSVLISHTSA-N	447.333	1.883	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2ccc(O)cc2)[C@@H]1c1cccnc1	1813072772	KFUPRXRLVQSAMU-XMSQKQJNSA-N	439.516	1.480	50	20	IDGD	
CC(C)O[C@H](C)C(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1813073392	LVBJROMYUATWLR-PLMTUMEDSA-N	433.553	1.274	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)[C@@H]2C[C@H]3CC[C@@H]2O3)[C@@H]1c1cccnc1	1813074397	QPQNRVAHVNLMHB-FHRFECMSSA-N	443.548	1.028	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)C2CCC(O)CC2)[C@H]1c1cccnc1	1813075046	WXQVZHQUXOOEAW-UOCVTNFKSA-N	445.564	1.012	50	20	IDGD	
C[C@H](C(=O)NC[C@@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1)n1cncn1	1813400086	KVWBHSRXQXYKQT-UKPHBRMFSA-N	435.326	1.725	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)CN3CCNC3=N)sc2C1	1814927976	QDFXBFCWHYNPJS-VHSXEESVSA-N	443.371	1.069	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)[C@H](O)c1ccccc1	1817078816	KHHXCMJERBCSAQ-TZIWHRDSSA-N	448.288	1.129	50	20	IDGD	
C#CCCCC(=O)N[C@H]1CCc2nc(NC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)sc2C1	1817282735	LIFJYGRKCAYGCV-JUCPORTRSA-N	440.529	1.993	50	20	IDGD	
CN[C@H](CC(=O)N1CCCC[C@@H]1c1cc(NC(=O)CO[Si](C)(C)C)n[nH]1)C(=O)O	1819593465	ILHOGKAGXUFJJE-ZIAGYGMSSA-N	425.562	1.316	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1)c1cccn(C(F)F)c1=O	1819636789	SNPZNFJQJZVOHJ-CHWSQXEVSA-N	443.838	1.872	50	20	IDGD	
C[Si](C)(C)OCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)CSCC(=O)O)CC2	1820168511	GLVAJDNFYRZHDA-SNVBAGLBSA-N	431.612	1.724	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnc(O)nc2O)[nH]n1	1822187631	YBAYXKZPBMJINN-LDYMZIIASA-N	439.270	1.700	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN2CCCCC2=O)[nH]n1	1822373914	ARCXVEYLZMFAGF-ZFWWWQNUSA-N	425.917	1.668	50	20	IDGD	
CC[C@@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1)N(CC)CC	1822410681	ONQUKGWUWIAWLP-ZWKOTPCHSA-N	449.600	1.895	50	20	IDGD	
Cc1nn(C)c(C(=O)N2CCCC[C@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)c1F	1822412643	AMXZUCHXFAWPSG-AWEZNQCLSA-N	448.503	1.270	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)ccc2F)[nH]n1	1822415704	QVZOYWCBBUQLFB-KRWDZBQOSA-N	446.483	1.933	50	20	IDGD	
COC(=O)NCC(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](C)CBr)[nH]n1	1822620460	WHRBUERJJBXFGG-ZYHUDNBSSA-N	430.303	1.789	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@H]1CCc2nc(NC(=O)CN3C(=O)C=CC3=O)sc2C1	1826319873	TVQNKDNTNOVTAG-XYZCENFISA-N	445.328	1.216	50	20	IDGD	
CCC1(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)CC2)COC1	1828924679	XPDKDPQZGZERSE-IBGZPJMESA-N	443.548	1.345	50	20	IDGD	
COC[C@H](NC(C)=O)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CO[Si](C)(C)C)CC1	1829116506	SAQANFGKWYRWGA-RBUKOAKNSA-N	441.645	1.609	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccnc3S)CCO2)C1	1829798914	RCIIJLVJVRTWID-ROUUACIJSA-N	448.372	1.677	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccn(C(C)(C)C)n3)C2)C1	1830357576	AHNRNNUOASFYBY-NRFANRHFSA-N	440.972	1.973	50	20	IDGD	
CCN(CC)C[C@H](C)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830366108	KIJSZXGTYSQCSK-LAUBAEHRSA-N	432.005	1.686	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)C#Cc3ccccc3)C2)C1	1830537565	KMWSNEGZCSQVOI-DYESRHJHSA-N	449.345	1.526	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(Cl)nn3)C2)C1	1831650121	DCIWEGXJNWCUQJ-FZKQIMNGSA-N	431.320	1.608	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2nc[nH]c2[N+](=O)[O-])CC1	1831832373	GQGWHVIFUGGNRB-KBPBESRZSA-N	427.889	1.805	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)[C@H]2CCCS2)CC1	1832435199	YROXQWCAHDWTNB-VQTJNVASSA-N	430.379	1.495	50	20	IDGD	
CN1Cc2ccccc2C[C@@H]1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1832468852	SILBPZGRBVLPFO-LVCYWYKZSA-N	439.915	1.034	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1)c1ccccn1	1834126747	PPMJPMPKYZXWNV-INIZCTEOSA-N	427.318	1.957	50	20	IDGD	
CC(C)=CCCC(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1	1834798317	GXETUZYYKWPEGB-UHFFFAOYSA-N	441.381	1.298	50	20	IDGD	
CCc1cc(C(=O)NC2CCN(C3CCN(C(=O)[C@H](Cl)COC)CC3)CC2)n[nH]1	1834924325	XXYNHZRYABYOHB-QGZVFWFLSA-N	425.961	1.411	50	20	IDGD	
C=C[C@H](O)C(C)(C)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1835717276	OXEIGUUQVNKNES-JKSUJKDBSA-N	448.377	1.822	50	20	IDGD	
O=C(/C=N/O[C@@H]1CCCCO1)NC1CCN(C2CCN(C(=O)C(Cl)Cl)CC2)CC1	1835768528	JCDTUDLORDNOJG-NEIHUHTASA-N	449.379	1.891	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC1CCN(C2CCN(C(=O)[C@@H](O)c3ccco3)CC2)CC1	1835834682	DRMUAJULUNDLOO-FQEVSTJZSA-N	437.613	1.736	50	20	IDGD	
CN1CCC[C@H]1C(=O)N1CCC(OC2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1837002301	AOJFVDBTHOTXGI-JKSUJKDBSA-N	434.350	1.770	50	20	IDGD	
O=C(CCBr)N1CCC(OC2CCN(C(=O)c3ccc(O)nn3)CC2)CC1	1837367904	DQVLRTKHCAUJJV-UHFFFAOYSA-N	441.326	1.579	50	20	IDGD	
O=C(c1cc2ncsc2[nH]1)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1837753570	BEBQDCCYYNPHEB-INIZCTEOSA-N	433.317	1.498	50	20	IDGD	
C[C@H](C(=O)N1CCC(OC2CCN(C(=O)[C@H](F)Cl)CC2)CC1)N1CCN(C)CC1	1838084279	UHMOXKNYGDXGPT-QAPCUYQASA-N	432.968	1.155	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3nccnc3C(N)=O)CC2)CC1	1838508454	PCVLCFSGMMVIPM-OAHLLOKOSA-N	437.928	1.205	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3CC[C@H](C(=O)OC)CC3)C2)C1	1839142017	BQSSVPNMZNIADC-IAGYGMIVSA-N	444.956	1.440	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cccc(Cl)n3)C2)C1	1839142543	RPNPPGGSMVDDFR-DNVCBOLYSA-N	430.332	1.751	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4nn(C)cc4c3)C2)C1	1839148239	RYNZLEVYVWLTKD-UWJYYQICSA-N	434.924	1.661	50	20	IDGD	
COc1ncccc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2	1839151211	KVBJSPPDUNSYFU-RTBURBONSA-N	446.331	1.397	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1839961717	GHQCQBMIOVHGFB-GUYCJALGSA-N	439.778	1.881	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(C#N)cc3)C2)C1	1840034397	JSOHAEUOJFOEBS-KUHUBIRLSA-N	436.306	1.412	50	20	IDGD	
COCc1c[nH]c(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)c1	1840034824	YAPLBVBGSUFXAZ-UGSOOPFHSA-N	444.326	1.015	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3C[C@H]3c3ccccc3)C2)C1	1840156562	VEUQFDQICRPXDQ-WEMPKCCASA-N	436.936	1.500	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)n1cccc1)CCO2	1840355041	RHLNPNFPLFEFOB-HDMKZQKVSA-N	428.327	1.289	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)C2CCN(c3ccccc3)CC2)C1	1841310775	JYMHWTBKKQVNOW-UHFFFAOYSA-N	447.344	1.100	50	20	IDGD	
CC(C)(C)OC(=O)NC1CCC(C(=O)N2CC3(CCCN3C(=O)[C@H](O)CCl)C2)CC1	1841354701	PRQWERLXYINYKC-UYSNPLJNSA-N	443.972	1.873	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)C2CCC(C(F)(F)F)CC2)C1	1841798338	YXHKPKZXGCNMTN-UHFFFAOYSA-N	438.255	1.552	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)/C=C/c1cnc[nH]1)C2	1844693308	QJOBTSKKQAOTFP-ZZXKWVIFSA-N	439.428	1.774	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC12CN(C(=O)[C@H](O)CNC(=O)OC(C)(C)C)C2	1846068678	HPDSAUKVRRNJAQ-QWHCGFSZSA-N	448.358	1.249	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H]1C[C@@H]1c1ccc(F)c(F)c1	1847606285	LWHGXFRSGWMQCL-JYWFKMLOSA-N	440.255	1.264	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCNC(=O)OC(C)(C)C	1847870152	MYPUWIOZKYGGKI-VGWMRTNUSA-N	431.961	1.871	50	20	IDGD	
O=C(Cn1cnc2ccccc21)NNC(=O)c1ccc2c(c1)C(=O)N(C[C@H]1CCCO1)C2=O	17403656	RJDWXVBXMUQWGC-OAHLLOKOSA-N	447.451	1.273	50	20	IDGD	
O=C(NNC(=O)c1cc(Cl)ccc1O)c1cc(S(=O)(=O)N2CCSCC2)c[nH]1	109225588	GBRIJBGUOIOVGW-UHFFFAOYSA-N	444.922	1.186	50	20	IDGD	
Cn1ccnc1[C@@H](NC(=O)NNC(=O)CNC(=O)c1cccs1)c1ccc(F)cc1	725872640	RGHONHBKRAWSPO-INIZCTEOSA-N	430.465	1.471	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)[C@H](C(C)C)N1CCCC1=O	726036845	KJPXCJBPXXVVSV-KRWDZBQOSA-N	425.869	1.300	50	20	IDGD	
COCCCNC(=S)N(C)NC(=O)C[C@H](NC(C)=O)c1ccc(Br)cc1	726076863	HPQUDQCFNBJWQV-HNNXBMFYSA-N	445.383	1.890	50	20	IDGD	
COC(=O)[C@@H](C)CNC(=O)/C(C#N)=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	726177869	XMGSAXXGHUHMKK-NCPSJORJSA-N	443.891	1.911	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)CCC(=O)N(CCC#N)c2ccccc2)c2ccccc2c1=O	728151155	VDMXJDOWXCZPGL-UHFFFAOYSA-N	446.467	1.422	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2ccc(CN3CCCCC3=O)cc2)n1	728723101	ZONCIOSAAJMLDT-UHFFFAOYSA-N	444.513	1.511	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)c2ccc(Cl)c(S(=O)(=O)N3CCOCC3)c2)c1	728827896	DNQPPFBDZHKONK-UHFFFAOYSA-N	448.888	1.307	50	20	IDGD	
COCCOc1ccc(S(=O)(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1C	728854580	YYUOOIHSMWXJQA-UHFFFAOYSA-N	449.533	1.036	50	20	IDGD	
O=C(NCC1(N2CCSCC2)CCCC1)NNC(=O)C1CCN(c2ncccn2)CC1	729047496	IVUDAZPLRYMPHB-UHFFFAOYSA-N	447.609	1.385	50	20	IDGD	
CN(C)c1ccc(C(=O)c2ccccc2C(=O)NNC(=O)Cc2cc[nH]n2)cc1[N+](=O)[O-]	730092205	DERXVHRHSDSLPT-UHFFFAOYSA-N	436.428	1.619	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)c2cc(S(=O)(=O)N3CCC[C@@H](C)C3)cn2C)c(O)c1	730278541	LCJQWTHLFGNURM-CQSZACIVSA-N	434.518	1.535	50	20	IDGD	
CC(C)(C)OC(=O)N1CCCC[C@@H]1C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	730525219	KPGMOCBTRXRMFN-OAHLLOKOSA-N	425.507	1.641	50	20	IDGD	
COc1ccccc1C(=O)NNS(=O)(=O)c1cc(C(=O)O)sc1Br	731494219	QVSHXSCLWWDZKR-UHFFFAOYSA-N	435.277	1.841	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)NCCNC(=O)c1ccc(Br)cc1	731499749	DXADCZLTPFZWDS-UHFFFAOYSA-N	435.278	1.832	50	20	IDGD	
O=C(COC(=O)c1cccc(S(=O)(=O)CC(F)F)c1)NNC(=O)c1cccs1	731532130	YAZIDPBJSLWQBF-UHFFFAOYSA-N	432.426	1.405	50	20	IDGD	
Cc1c(NC(=O)[C@@H](C)SCC(=O)NNC(=O)C2CCC2)c(=O)n(-c2ccccc2)n1C	732142944	NHKKBUDEDPZEHH-CQSZACIVSA-N	445.545	1.492	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc([C@H](C)N[C@H](C)C(=O)NNC(=O)CC(C)C)cc1	732197202	XDAJSAVIEUCVSS-JKSUJKDBSA-N	426.583	1.950	50	20	IDGD	
CN1CCN(C)[C@@H](CNC(=O)NNC(=O)CCCOc2ccc(Cl)cc2Cl)C1	732475005	PKCKUSLYUSPCBM-AWEZNQCLSA-N	432.352	1.729	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)[C@@H](C)Oc2ccccc2Br)C[C@@H](C)O1	732828908	WJTKJXZSBKZBIE-MGPQQGTHSA-N	428.327	1.863	50	20	IDGD	
CCCC(=O)N1CSC[C@@H]1C(=O)NNc1nc2ccccc2c(=O)n1CCCOCC	733267450	XEBUMNRJYDAJCM-QGZVFWFLSA-N	447.561	1.968	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)NCCN3C(=O)CNC3=O)c3ccccc3n2)cc1	733657855	OBEWXDIVUSZADN-UHFFFAOYSA-N	446.467	1.706	50	20	IDGD	
COc1ccc(CN2CC[C@H](NC(=O)NNC(=O)c3ccc4ccccc4n3)C2=O)cc1	734541357	HJXYKCOSOYQCMR-FQEVSTJZSA-N	433.468	1.989	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)c2ccc(Cl)c(S(=O)(=O)N3CCCCC3)c2)cn1	735445089	FYAFDXRCEYLOCN-UHFFFAOYSA-N	425.898	1.323	50	20	IDGD	
O=C(NNc1cccnn1)c1cccc(S(=O)(=O)NCc2ccc3c(c2)OCO3)c1	736710974	QQTLKTCHILEPHK-UHFFFAOYSA-N	427.442	1.441	50	20	IDGD	
Cc1cccc([C@@H](CNC(=O)NNC(=O)COCc2ccccc2)N2CCOCC2)c1	738450288	HWRDFRILNVXTGG-OAQYLSRUSA-N	426.517	1.916	50	20	IDGD	
CC(C)NS(=O)(=O)c1cccc(CNC(=O)NNC(=O)COCc2ccccc2)c1	738450464	YPVBHSIWTCQWSI-UHFFFAOYSA-N	434.518	1.421	50	20	IDGD	
CN(C)C(=O)Nc1cccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1	739678475	BEAJOSKTZZCTLQ-UHFFFAOYSA-N	433.490	1.105	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCC[S@](=O)Cc2ccccc2)nc1	741422282	YOIHSABBLZMQAH-NDEPHWFRSA-N	439.563	1.343	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNS(=O)(=O)c2csc(C(=O)OC)c2)cc1	743251050	NLJRNDZVHIVHGQ-LLVKDONJSA-N	428.488	1.710	50	20	IDGD	
CN1CCN(c2cc(CNC(=O)NNC(=O)Nc3ccc(OC(F)F)cc3)ccn2)CC1	743537310	NVNMLMVVMDIWHY-UHFFFAOYSA-N	449.462	1.971	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1ccc(-n2cnnc2)cc1	744621664	XJCAFYNKENQKPW-UHFFFAOYSA-N	428.474	1.045	50	20	IDGD	
Cn1ncnc1COc1ccc(S(=O)(=O)NNC(=O)CCc2ccccc2O)cc1	746591634	NVOKSYOVYUXYPT-UHFFFAOYSA-N	431.474	1.042	50	20	IDGD	
CC(=NNC(=O)CCOc1ccccc1)c1ccc(S(=O)(=O)NCCC(=O)O)cc1	747059380	OCTLKVCWCROGAQ-UHFFFAOYSA-N	433.486	1.749	50	20	IDGD	
CSCC[C@H](C(=O)NNC(=O)c1ccc(C#N)cc1)N1C(=O)[C@@H]2CCCC[C@H]2C1=O	747176062	HSSYKFIIPMSFQW-BRWVUGGUSA-N	428.514	1.616	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)N[C@@H]2CCN(CC(F)(F)F)C2)c2ccccc2c1=O	747308196	NYENQCDHZRYDLZ-GFCCVEGCSA-N	440.426	1.558	50	20	IDGD	
Cc1nc(C(=O)NNC(=O)Cc2cccc3ccccc23)nn1-c1n[nH]c(C(F)(F)F)n1	747353706	KTFGZFWUBUDGNR-UHFFFAOYSA-N	444.377	1.870	50	20	IDGD	
CSC[C@H](C(=O)NNC(=O)c1cccc2cccnc12)N1C(=O)[C@H]2CCCC[C@H]2C1=O	747427145	CJFVNHCFVULMOM-HLLBOEOZSA-N	440.525	1.903	50	20	IDGD	
CCNS(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)c2ccc(CN(CC)CC)o2)c1	747712503	ASJKGIJWROKOTM-UHFFFAOYSA-N	440.497	1.634	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)N[C@H]1CCCN(Cc2ccc(F)cc2Cl)C1	748631185	LNRYJFRYDGEPQO-CJNGLKHVSA-N	430.908	1.825	50	20	IDGD	
C[C@]1(NNC(=O)NCCCOC2CCN(Cc3ccccc3)CC2)CCS(=O)(=O)C1	748970333	MQWVHXDFUOQDRI-NRFANRHFSA-N	438.594	1.439	50	20	IDGD	
C[C@H](NC(=S)NNC(=O)C1CCN(S(=O)(=O)c2ccccc2F)CC1)C1CC1	751619406	UZVDKSQKHDOBKQ-LBPRGKRZSA-N	428.555	1.520	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)[C@H]2CC(=O)N(CCOc3ccccc3Cl)C2)cc1	751787441	YCUUYYBQHPVJRU-INIZCTEOSA-N	426.860	1.900	50	20	IDGD	
CCN1C(=O)[C@@H]2CN(C(=O)/C(C#N)=C/c3cc(C)n(C[C@@H]4CCCO4)c3C)CCN2C1=O	752507427	IUFMYEOJYZDZFP-AQKLWOLUSA-N	439.516	1.686	50	20	IDGD	
COc1cc(OC)cc(N2C[C@H](C(=O)NNc3ccccc3S(C)(=O)=O)CC2=O)c1	752800132	KFADFMHTVKFWGM-CYBMUJFWSA-N	433.486	1.604	50	20	IDGD	
N#Cc1c(Br)cccc1S(=O)(=O)NNC(=O)c1ccc2c(c1)OCCO2	753016565	IRCZVZORJORRLR-UHFFFAOYSA-N	438.259	1.715	50	20	IDGD	
CCc1cc(Br)ccc1NNC(=O)c1ccc(S(=O)(=O)NCC(N)=O)o1	753173280	JGYJBZQYDPFEEC-UHFFFAOYSA-N	445.295	1.125	50	20	IDGD	
C[C@H](C[S@@](C)=O)NC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	753356139	BPCXDQLVLCFSRQ-DQQVXTMASA-N	444.560	1.260	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1)S(C)(=O)=O	754098807	BFBWPDUSNCQLSS-JXFKEZNVSA-N	444.557	1.377	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNS(=O)(=O)c2cc(Br)cc(C#N)c2)c1	754256916	JHCGQTXTHAYONA-UHFFFAOYSA-N	440.275	1.961	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Cc2cc[nH]n2)cc1S(=O)(=O)Nc1ccc(C)cc1	755289261	QDTHHUSRSVPJKO-UHFFFAOYSA-N	443.485	1.531	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)Nc1ccc(OC)c(-n2nnnc2C)c1	756322311	WVNAVUNIMHZQNZ-UHFFFAOYSA-N	427.421	1.220	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)NNC(=O)c2cncc(NC(C)=O)c2)cc1C	756513957	BNNDVBBEYOIJCU-UHFFFAOYSA-N	434.478	1.577	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)Nc2ccc(C[C@H]3CC(=O)NC3=O)cc2)c1	756816717	UDGRSCBCOYGAOJ-ZDUSSCGKSA-N	426.429	1.376	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2ccc(C(=O)NNc3ccc(C(N)=O)nn3)cc2)cc1	757392050	JTZXVSUTQVFUQH-UHFFFAOYSA-N	442.457	1.142	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)CCCOc2ccc(Cl)cc2Cl)co1	757626401	ADVBMAJGLBLCCK-UHFFFAOYSA-N	436.273	1.854	50	20	IDGD	
COc1ccc(C[C@@H](C)CNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1	758770546	SOLBYJFDHRRISB-MRXNPFEDSA-N	426.521	1.911	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)N[C@H]1CN(C(=O)OC(C)(C)C)C[C@H]1C#N	758780113	YCTFVPXMLCMENV-CVEARBPZSA-N	431.493	1.717	50	20	IDGD	
Cc1ccc(N2N=C(Br)C[C@H]2C(=O)NNC(=O)C(=O)Nc2ccccn2)cc1	758826401	CVIUNHRYHLGZEA-ZDUSSCGKSA-N	445.277	1.463	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)NCCN1C(=O)c2ccccc2C1=O	761663695	XZBGDNMGWGUHAS-UHFFFAOYSA-N	428.470	1.414	50	20	IDGD	
CN1C(=O)C[C@@H](C(=O)NNc2nccc(N3CCOCC3)n2)[C@@H]1c1cccc(Cl)c1	762860692	HGJNRJDUQWFZBK-QAPCUYQASA-N	430.896	1.629	50	20	IDGD	
Cc1nnnn1[C@H](Cc1cccc(F)c1)C(=O)NNC(=O)c1cc(-c2ccccc2)[nH]n1	762937655	KQXYZSWPZOHIHG-LJQANCHMSA-N	434.435	1.756	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)cn2)C[C@@H](C)O1	763442111	LIORQZRJKOUVLY-BETUJISGSA-N	442.432	1.003	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)Nc1cccc(N2C(=O)CNC2=O)c1	763482329	KBUQSHZLLLMMTC-UHFFFAOYSA-N	434.453	1.200	50	20	IDGD	
C[C@H]1CN(Cc2ccccc2NC(=O)C(=O)NNC(=O)c2ccccc2O)C[C@@H](C)O1	763529731	LSRZCLSTZPLDNX-GASCZTMLSA-N	426.473	1.401	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)Nc1cccc(CN2CCCCC2)c1	763573505	SPWMIFLFOZZMPW-FQEVSTJZSA-N	438.484	1.598	50	20	IDGD	
COC(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)COc2cc(C)ccc2C(C)C)cc1	763601912	NJDBRSSAVYYKLK-UHFFFAOYSA-N	441.484	1.999	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)COc2cccc(C(F)(F)F)c2)cc(OC)c1	763638607	CUMMDJJABSOVIL-UHFFFAOYSA-N	441.362	1.888	50	20	IDGD	
C=CCNC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2CC)cc1	763714301	SLHALRVFHZNNSX-UHFFFAOYSA-N	439.472	1.721	50	20	IDGD	
O=C(NNC(=O)c1cccc(Cl)c1)C(=O)Nc1cccc(C(=O)N2CCOCC2)c1	763749845	FWTIMVXHBFPFKV-UHFFFAOYSA-N	430.848	1.212	50	20	IDGD	
CCCCCn1nc(C)cc1NC(=O)C(=O)NNC(=O)c1cc(Br)c[nH]1	763995252	PELIPKFMWBPYEO-UHFFFAOYSA-N	425.287	1.872	50	20	IDGD	
CN(C)C(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)on2)cc1	764017218	VAFFDZMGNUFPIO-UHFFFAOYSA-N	435.440	1.372	50	20	IDGD	
CN1CC(=O)N(c2cccc(NC(=O)C(=O)NNC(=O)c3cccc4ccccc34)c2)C1=O	764050331	FUNNUPREDQKUCS-UHFFFAOYSA-N	445.435	1.638	50	20	IDGD	
COC(=O)c1c(NC(=O)C(=O)NNC(=O)Cc2ccccc2OC)sc2c1CCCC2	764138662	HLKDZEVEERYAMP-UHFFFAOYSA-N	445.497	1.751	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)CCOc2ccccc2)cc1C	764161064	NSZBZKPKKSRDPP-UHFFFAOYSA-N	448.501	1.312	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)CCc3ccco3)cc2F)C[C@@H](C)O1	764168345	DIFQJNZGDJTSEI-OKILXGFUSA-N	432.452	1.751	50	20	IDGD	
O=C(CC1CCCC1)NNC(=O)C(=O)Nc1ccc(F)c(N2CCCS2(=O)=O)c1	764187632	HMKAVYOIQVOIFG-UHFFFAOYSA-N	426.470	1.032	50	20	IDGD	
COCCOc1ccc(Br)cc1NC(=O)C(=O)NNC(=O)CCC(C)C	764199067	MFTVZKDOVWDDNM-UHFFFAOYSA-N	430.299	1.996	50	20	IDGD	
O=C(Cc1ccccn1)NNC(=O)C(=O)Nc1cc(Cl)ccc1N1CCSCC1	764265126	ZLOQAVXAZVCJRA-UHFFFAOYSA-N	433.921	1.617	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)N2CCC3(CC2)NC(=O)N(C)C3=O)c(C)n1C[C@H]1CCCO1	764406811	LIFFRRNCCUBKAB-TVNWYLLRSA-N	439.516	1.734	50	20	IDGD	
O=C(CSc1nnc(-c2cccnc2)n1Cc1ccco1)NNC(=O)c1ccncc1	764428346	AAYZYLGCCSJCNQ-UHFFFAOYSA-N	435.469	1.930	50	20	IDGD	
COc1nccnc1NNC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1	764482455	WHIAVGSNKWBCER-AWEZNQCLSA-N	436.450	1.080	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)[C@@H](C)NS(=O)(=O)c2ccc(C#N)cc2)cc1	764566729	OJCYLOUASHBIGJ-CQSZACIVSA-N	432.527	1.473	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)[C@H]1C[C@]12CCc1ccccc12	765738667	MJPFHMOSMWMUML-BWKNWUBXSA-N	432.524	1.496	50	20	IDGD	
Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	766261045	YGMXLMLVQSIFNN-UHFFFAOYSA-N	441.448	1.004	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1ccccc1	767236092	GZWWHXSIJCBEMK-FQEVSTJZSA-N	437.496	1.923	50	20	IDGD	
CCCCCCn1cc(S(=O)(=O)NNC(=O)c2ccc(Cl)cc2O)c(O)nc1=O	769625254	LXYSOQJJIFTHPT-UHFFFAOYSA-N	444.897	1.512	50	20	IDGD	
C[C@@H]1C[C@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)CCO1	770353469	CCEGPAWNPZSSEH-CRAIPNDOSA-N	446.529	1.677	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc2c(c1)CCN2C(=O)C(=O)NNc1c(F)cccc1Cl	770810824	DJCWCQNKSVZHNH-UHFFFAOYSA-N	440.884	1.762	50	20	IDGD	
Cc1oncc1C(=O)Nc1ccc(C(=O)O[C@@H](C)C(=O)NNC(=O)CC(C)C)c(O)c1	772144525	ULFLPOGNACDQAV-LBPRGKRZSA-N	432.433	1.680	50	20	IDGD	
CNC(=O)CCOc1ccc(NC(=O)C(=O)NNc2ncc(Cl)cc2Cl)cc1	773674476	ZQHJTCGUDCSCAM-UHFFFAOYSA-N	426.260	1.985	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2c(Cl)cccc2Cl)n([C@H]2CCS(=O)(=O)C2)n1	773691995	UNQLJSUUSNPNQO-JTQLQIEISA-N	446.316	1.940	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)[C@H](CC)N2CCO[C@H](CC)C2)c2ccccc2c1=O	773714891	YKAYSVAHOVXJJO-QAPCUYQASA-N	429.521	1.457	50	20	IDGD	
CN(C)N(C(=O)[C@@]1(F)CCN(C(=O)OCc2ccccc2)C1)[C@H]1CCS(=O)(=O)C1	776750271	OWFJOSZAQIUPSP-QFBILLFUSA-N	427.498	1.230	50	20	IDGD	
COC(=O)c1ccccc1NNC(=O)[C@H]1CC(=O)N(c2cc(OC)c(OC)c(OC)c2)C1	777773015	RNCIVHULZPXEAF-ZDUSSCGKSA-N	443.456	1.995	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)CCNC(=O)NC12CC3CC(CC(C3)C1)C2	778441384	UFTBEMYKNFIKMJ-UHFFFAOYSA-N	437.541	1.317	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)N[C@H]2CCCN(c3ccc(C#N)cc3)C2=O)c1	780894639	RDYBEJSZXSLIBH-IBGZPJMESA-N	437.456	1.715	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2ccc(C(=O)N3CCOCC3)c(Cl)c2)nc1	782141113	LEBPPCZNIXUNOS-UHFFFAOYSA-N	433.852	1.298	50	20	IDGD	
O=C(NNc1cccc(F)c1)C(=O)Nc1ccc(N2CCOCC2)cc1N1CCOCC1	783039766	MBCWZZJIYSEOEH-UHFFFAOYSA-N	443.479	1.581	50	20	IDGD	
Cc1ccccc1NC(=O)NNC(=O)C(=O)Nc1cccc(N2CCS(=O)(=O)CC2)c1	783416943	JARDOHQXJIDOHW-UHFFFAOYSA-N	445.501	1.021	50	20	IDGD	
O=C(NNc1ccc(-n2cccn2)nn1)C(=O)Nc1ccc(-c2ncc3n2CCCC3)cc1	783432812	DPGJQMAOUFHBSC-UHFFFAOYSA-N	443.471	1.944	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NN=C(C)[C@H]1CCCO1)N(S(C)(=O)=O)CC2	783809354	CBSYQIGJWQBLGS-IAGOWNOFSA-N	439.534	1.624	50	20	IDGD	
CC(C)Oc1ncccc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)C(F)F)cc1	784835372	MFCAKSIZFZNTIA-UHFFFAOYSA-N	428.417	1.947	50	20	IDGD	
COC(=O)Cc1ccccc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)C(F)F)cc1	784835808	IMSHCVAZKQXJSD-UHFFFAOYSA-N	441.412	1.480	50	20	IDGD	
O=C(NNc1ccc(-n2cccn2)nn1)C(=O)Nc1cc(F)cc(F)c1Br	785991166	AKYKPHXOIKAZRE-UHFFFAOYSA-N	438.192	1.785	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)C(=O)Nc1ccc(C2CCC2)cc1	787556268	FAEMYKWMMVSBPN-UHFFFAOYSA-N	429.502	1.647	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1ccc(O[C@H]2CCOC2)cc1	788724039	HGFQZQAFAMAETI-INIZCTEOSA-N	432.502	1.531	50	20	IDGD	
CN1C(=O)Cc2cc(NC(=O)C(=O)NNC(=O)c3cc(-c4ccc(F)cc4)[nH]n3)ccc21	789739217	IMKJLZSBIZQWRT-UHFFFAOYSA-N	436.403	1.134	50	20	IDGD	
O=C(NNC(=O)c1c[nH]c2ccccc12)c1ccc2c(c1)SC1=NS(=O)(=O)CCN12	789765775	RSVOAUGGYDSYMZ-UHFFFAOYSA-N	441.494	1.854	50	20	IDGD	
C[C@](O)(Cn1cc(C(F)(F)F)ccc1=O)C(=O)NNc1ccc(C(F)(F)F)nn1	792278926	PSIYCLYEDVRKGZ-ZDUSSCGKSA-N	425.289	1.570	50	20	IDGD	
C[C@]1(CCC(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)CCC(=O)N1	792803499	AFDIQJZYFLKCPB-XMMPIXPASA-N	447.495	1.655	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(Cn3cccn3)on2)c1	794195272	FQJTYTYZZXJWPI-UHFFFAOYSA-N	446.489	1.025	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2ccc(C(C)(C)C#N)cc2)CC1	795107786	DXVDPVGZOYWSEP-UHFFFAOYSA-N	442.545	1.576	50	20	IDGD	
CCOC(=O)c1ccc(F)c(S(=O)(=O)NNC(=O)c2cc(OC)cc(OC)c2)c1	795279428	CAGDWGIYHVFOOG-UHFFFAOYSA-N	426.422	1.643	50	20	IDGD	
C=C(CBr)COC(=O)[C@@H](NS(=O)(=O)c1ccc(Cl)cc1)[C@@H](C)O	795321829	YXHNIWBZATWMHM-MFKMUULPSA-N	426.716	1.862	50	20	IDGD	
Cc1cc(N(C)C)ccc1NC(=O)C(=O)NNC(=O)CNC(=O)OCc1ccccc1	797370289	YHRGQCWXDTZWTQ-UHFFFAOYSA-N	427.461	1.073	50	20	IDGD	
Cc1cc(O[C@@H]2CCN(C)C2=O)ccc1NC(=O)C(=O)NNc1cccc([N+](=O)[O-])c1	799257632	GXZFSMBWPNZEHN-QGZVFWFLSA-N	427.417	1.595	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NCCS(=O)(=O)CCc2ccccc2)cc1C	800756779	QHXBPHBNDWXJTG-UHFFFAOYSA-N	433.530	1.670	50	20	IDGD	
COC(=O)N(C)NC(=O)CS[C@@H](C)C(=O)Nc1c(C)n(C)n(-c2ccccc2)c1=O	804124251	HTLGGDGAXJBDBL-ZDUSSCGKSA-N	435.506	1.274	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1	804952485	PQENKSQFADFOMM-LLVKDONJSA-N	428.434	1.380	50	20	IDGD	
COc1cccc(NNC(=O)C(=O)Nc2cccc(F)c2Cn2cccc(C)c2=O)n1	806968768	PBWWZXDIQQYCOE-UHFFFAOYSA-N	425.420	1.830	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)C(=O)Nc1cc(Cl)cc2c1OCC(=O)N2	806978474	CPCCSEZYHINPAJ-UHFFFAOYSA-N	432.820	1.095	50	20	IDGD	
CNS(=O)(=O)c1cc(NC(=O)C(=O)NNc2ccccc2Br)ccc1F	806995695	NVTJCZRVYJYLDI-UHFFFAOYSA-N	445.270	1.578	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)c1n[nH]c2c1CN(C(=O)OC(C)(C)C)CC2	807369865	NADOCKUZULCRCN-UHFFFAOYSA-N	425.486	1.253	50	20	IDGD	
CSCC[C@H](NC(=O)c1ccc2ccccc2n1)C(=O)NNC(=O)N1CCN(C)CC1	807380058	ASQSINDAZHWZFC-SFHVURJKSA-N	444.561	1.075	50	20	IDGD	
Cc1c(Cl)c(C(F)(F)F)nn1CC(=O)NNC(=O)CCN1C[C@@H](C)O[C@H](C)C1	809981445	LEGKMHYKPPNRPX-NXEZZACHSA-N	425.839	1.510	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)c2ccc(F)c(NS(C)(=O)=O)c2)cc1	812730618	OVJUHOJKUUCIDC-UHFFFAOYSA-N	430.483	1.204	50	20	IDGD	
CC(CCc1ccc(OCC(=O)O)cc1)=NNC(=O)Nc1ccc(S(N)(=O)=O)cc1	814964185	OLOUPWKIBAVWDY-UHFFFAOYSA-N	434.474	1.928	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1)C1CC1	815564915	XCRLGDUNXXLPEO-IBGZPJMESA-N	438.440	1.128	50	20	IDGD	
Cc1ccc(-n2cccn2)cc1NC(=O)C(=O)NNc1ccccc1S(=O)(=O)N(C)C	815752310	NCGAEEPBPGAECL-UHFFFAOYSA-N	442.501	1.513	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)c2cnn(-c3ccccn3)c2N)cc1Cl	816596755	PCLCNGSDCRLKGG-UHFFFAOYSA-N	431.840	1.987	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CNC(=O)NCc2ccc(F)cc2)cc(OC)c1OC	821951029	JAQWLPHUZBRDBG-UHFFFAOYSA-N	434.424	1.112	50	20	IDGD	
O=C(COC(=O)C1(c2ccc(Cl)cc2)CC1)NNC(=O)[C@@H]1COc2ccccc2O1	845030519	VFZCWXWOFIGLJF-KRWDZBQOSA-N	430.844	1.902	50	20	IDGD	
CSC[C@H](C(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)N1C(=O)[C@@H]2CCCC[C@H]2C1=O	866751505	YREJYEYVYHOOOM-RBSFLKMASA-N	434.474	1.263	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@H](C)C(=O)NNC(=O)CCc1nc(O)c2cnn(C)c2n1	893057037	USIAHZDOCAPJAX-GFCCVEGCSA-N	446.895	1.887	50	20	IDGD	
COC[C@@H](C)n1c(C)cc(/C=C(\C#N)C(=O)OCC(=O)NC2CCN(C(C)=O)CC2)c1C	897620468	OXVLVVYADIVZDA-MBTVCVBTSA-N	444.532	1.890	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)[C@H]1CS[C@@H](Cc2ccccc2F)C(=O)N1	914879961	CQFKEHWCCNTUEU-QAPCUYQASA-N	447.488	1.203	50	20	IDGD	
Cc1ccc([C@H](CNC(=O)NNC(=O)COc2ccc(C#N)cc2)N2CCOCC2)o1	916229426	PNSPROYFELFBGJ-SFHVURJKSA-N	427.461	1.242	50	20	IDGD	
Cc1nn([C@@H]2CCS(=O)(=O)C2)c(Cl)c1C=NNC(=O)[C@H]1COc2ccccc2O1	916292275	VBXWHWGGKBKARC-MLGOLLRUSA-N	438.893	1.495	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)c1ccc(F)c(S(=O)(=O)N(C)C)c1	916361373	ZPAFRTMMVYNWHX-NSHDSACASA-N	427.429	1.444	50	20	IDGD	
COc1ccc(NC(C)=O)cc1S(=O)(=O)NNC(=O)C(=O)Nc1ccc(C)c(C)c1	916567547	PITLXKAKECURQW-UHFFFAOYSA-N	434.474	1.219	50	20	IDGD	
C[C@H](Cn1ccnc1)NC(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	916623223	KPZTZWCAKDGTIW-MRXNPFEDSA-N	445.483	1.674	50	20	IDGD	
O=C(NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)N[C@@H]1COc2ccccc2C1	916638793	LXFJLUCYLPWYTO-KRWDZBQOSA-N	444.513	1.419	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(C(C)(C)C)nn2C)c1	916726808	WTYQNTHPICJHJG-UHFFFAOYSA-N	435.550	1.823	50	20	IDGD	
O=C(NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)C1=NO[C@H](c2ccccc2)C1	917496711	KIHBJDJFLHOMGS-IBGZPJMESA-N	442.497	1.750	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@@H](C)C(=O)NNC(=O)CN(C)c1ncnc2[nH]cnc12	917920709	BHFYAKQWRHZMBO-LBPRGKRZSA-N	431.884	1.674	50	20	IDGD	
Cc1ccc([C@@H](CNC(=O)NNC(=O)COc2ccc(F)cc2)N2CCOCC2)cc1	918099626	WVGCZPBCHKNQRG-HXUWFJFHSA-N	430.480	1.917	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)CCc2c(C)nc3c(C(N)=O)cnn3c2C)cc1	919836200	CXLHIZWIWCNYGR-UHFFFAOYSA-N	438.488	1.166	50	20	IDGD	
NC(=O)c1ccc(/C=C/C(=O)N2CCC[C@@H]2C(=O)NNC(=O)Cc2ccc(F)cc2)cc1	920033383	YLFBXTDKHKTZJB-LKQLOZHYSA-N	438.459	1.319	50	20	IDGD	
COc1nc(C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)cc2ccccc12	920768803	YCXJKQLJYAFDHV-UHFFFAOYSA-N	427.486	1.920	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(Br)cc1)NNC(=O)c1ccccc1Cl	1115813729	SLIGWRLUTHKADR-UHFFFAOYSA-N	446.710	1.842	50	20	IDGD	
Cc1cnn(CC2CC2)c1NC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	1325340801	RLQWIUGUKROKCB-UHFFFAOYSA-N	446.533	1.853	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4nonc4c3)C2)C1	1777714362	OTRQJUICCFDKOF-KZULUSFZSA-N	437.294	1.697	50	20	IDGD	
C[C@@H](C(=O)N1CC[C@]2(CN(C(=O)CCBr)CCO2)C1)n1ccccc1=O	1779267368	ZTGZPAGYIRSAPG-KSSFIOAISA-N	426.311	1.024	50	20	IDGD	
CN(C)c1ccc([N+](=O)[O-])c(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](F)Cl)CCO3)c1	1780117153	GDWXWCCBJDSKDY-MAUKXSAKSA-N	428.848	1.639	50	20	IDGD	
Cc1ccccc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2	1780336324	OINYNXGBONBVGB-ZJSXRUAMSA-N	436.317	1.116	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1ccncc1)C2)[C@@H](F)Br	1780774033	UDBAIXPNTVIZCZ-QGPMSJSTSA-N	428.302	1.829	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc4c(c3)n(C)c(=O)n4C)CCO2)C1	1781219801	VCAJBKBKHZPOEW-YCRPNKLZSA-N	434.924	1.338	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)c3cc4n(n3)CCCO4)CCO2)C1	1781230171	OLWYLXZEWCVUMH-MSOLQXFVSA-N	431.320	1.345	50	20	IDGD	
COc1nccc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](F)Br)C3)C2)c1F	1781330920	IWHCLSFRFZYJPO-BLLLJJGKSA-N	434.237	1.363	50	20	IDGD	
Cc1cc(Br)ccc1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1781564965	KWXALVLXACEZHS-QAPCUYQASA-N	445.741	1.801	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CC[C@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)cc1O	1782127321	SVWPFQJWTFORDL-NRFANRHFSA-N	449.580	1.646	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCCn1ccnc1)C2	1782178025	FZKOHFOJZDBPIZ-MBOZVWFJSA-N	426.945	1.431	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](C)NC(=O)c3ccccn3)C2)C1	1782665877	CCBJYCTXLSHUEW-GCKMJXCFSA-N	436.940	1.437	50	20	IDGD	
O=C(CCNC(=O)c1ccccc1)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Cl)C2	1783102310	DQLCPAKAZGSCKO-HGHGUNKESA-N	439.915	1.855	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)Cc3ccccc3O)CCO2)C1	1783354831	GFBSQCPFTKCJPP-DNVCBOLYSA-N	425.323	1.938	50	20	IDGD	
CCOC(=O)C1(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](Br)CC)C3)C2)CC1	1783355854	YQYDEHAHZAOWGN-GUYCJALGSA-N	431.327	1.333	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(Cl)cnc3O)[C@H]2C1	1783399957	LTGDDOCMNBYWQG-RCBQFDQVSA-N	441.988	1.885	50	20	IDGD	
COc1ncc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](C)Br)C3)C2)cc1C	1783531962	GJSFRGTZOTUTCU-FZKQIMNGSA-N	426.311	1.626	50	20	IDGD	
CCn1nc(C(C)C)cc1C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](Cl)COC)C2)C1	1783881696	MIMICIJAGFFJPQ-QRWLVFNGSA-N	426.945	1.724	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc4ncccc4c3)C[C@@H]21)[C@H](O)CCl	1784085859	QLKWLZBRAVXDDK-XEYPJELSSA-N	431.920	1.357	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(-c4cccs4)on3)C[C@@H]21)[C@H](O)CCl	1784091173	KVPCIAVEVZCWNO-GMZLATJGSA-N	439.921	1.596	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CNC(=O)C(F)(F)F)C[C@@H]21	1784623454	GOKCOWSCNSFFIJ-CYDGBPFRSA-N	427.851	1.052	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cn3cc([N+](=O)[O-])cn3)[C@H]2C1	1785217810	JCWKKAJOXUPZDS-PLNCSYRRSA-N	448.307	1.007	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3c(C)noc3N)[C@H]2C1	1786840776	RYRFSSIUNPYTMJ-CYDGBPFRSA-N	429.315	1.332	50	20	IDGD	
COc1cc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]3C2)ccc1[N+](=O)[O-]	1787448606	BMTRPRATPLGMOT-RASHJEQFSA-N	443.859	1.660	50	20	IDGD	
CC(=O)N[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]2C1)c1ccc(F)cc1	1787448617	CJEGNPNGZQQOGR-HILJTLORSA-N	443.878	1.517	50	20	IDGD	
CCn1nc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)Br)C[C@@H]32)cc1C	1789003289	DGLYHPZASDSNBB-YXWQFLTLSA-N	427.343	1.588	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccn4cncc34)C[C@@H]21)[C@H](F)Br	1789926055	LMEVVOPROFPVSI-MZGVZZPPSA-N	439.285	1.618	50	20	IDGD	
CCOC(=O)c1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](O)CCl)C[C@@H]32)cc1	1790259572	PNUHRIVUNRWTKQ-FJIDUMEYSA-N	438.908	1.056	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc(C)cn3)C[C@@H]21	1790961600	QQGZABFJKVLUPR-YXWQFLTLSA-N	425.327	1.552	50	20	IDGD	
CC[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]2C1)N(CC)CC	1791054979	COZRHKZHHNUBJO-HMDCTGQHSA-N	432.403	1.870	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4cccn4cn3)C[C@@H]21	1791055861	JQGJMHZRNRIJOS-HPZZRFSDSA-N	435.322	1.711	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/c3cnc(C)s3)C[C@@H]21	1791256029	CZNPAWDFBIODBU-OQSFXPJBSA-N	427.954	1.698	50	20	IDGD	
CC(C)(C)OC(=O)N(CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCl)C1CC1	1793105597	FKHVORNRQYGLAP-SLBVQIDZSA-N	429.945	1.624	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1CCC3(CC1)OCCO3)C2	1793453707	SHWTZVCTWNBXJM-MHORFTMASA-N	428.957	1.917	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1ccc(C)nc1	1794456711	MHRQRXTVGBOJPI-INZAXJFKSA-N	436.516	1.705	50	20	IDGD	
Cc1c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCBr)nc2ccccn12	1795114506	QSNSWGGRXYVBON-ZSBFGKGUSA-N	435.322	1.631	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCBr	1795116380	DOXGJDYPUQDLGL-NOHGZBONSA-N	426.149	1.535	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1n[nH]c2c1CCCC2	1796164476	ANHDFXMDQBIRND-YJKIEOBBSA-N	429.290	1.182	50	20	IDGD	
C[Si](C)(C)C#CCCCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1	1796191520	SWBWLWBAZFTARE-WKCHPHFGSA-N	440.425	1.669	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1nc(OC)ccc1[N+](=O)[O-]	1796720262	BXZWXSPBLRFWKI-NWJSVONSSA-N	426.857	1.219	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](F)Cl)[C@H](O)C1	1796803670	AEAAHCBGHHOQKG-OHQCYIMMSA-N	447.935	1.777	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](C)[C@H]1SC(=N)NC1=O	1796879718	WYIAGMSQNLYVQP-IQMQYZSSSA-N	431.356	1.210	50	20	IDGD	
COc1ccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CO[Si](C)(C)C)c(C#N)c1	1797956347	RVKHBXHGNWSIAC-OPMZPASUSA-N	445.592	1.550	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ncccc1C(F)(F)F	1798919211	SEARFXUUMWWRIY-BTTYYORXSA-N	441.454	1.725	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CSc1ncccn1)C2	1799275384	VPTGDQKSJKOGBA-IFOZYUSPSA-N	433.361	1.395	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=N/O[C@H]1CCCCO1)C2	1799276498	KRIFEUILLBELED-LVTADRLUSA-N	436.336	1.341	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc([N+](=O)[O-])c2c1OCO2)[C@@H](O)CCl	1799341140	PCPJDUBSUGFDER-MIJXAVMKSA-N	425.825	1.175	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(CC#N)cc1	1799639161	KOQTWZJOUZCYJG-RUGDWHBFSA-N	434.334	1.987	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)COCCNC(=O)OC(C)(C)C	1800058119	ZOXKEZOUSDLVCO-QKPAOTATSA-N	447.960	1.420	50	20	IDGD	
Cc1nn(C)c(C)c1CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)CBr)C2	1801375441	WAJFKZVRWRROLL-MKXCTONWSA-N	441.370	1.200	50	20	IDGD	
COc1ccc(F)c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)Br)C3)c1	1801720092	WMOULHPHWKOJFW-OVZMXSCWSA-N	429.286	1.821	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2c(O)cc(O)cc2O)[C@H]1c1cccnc1)[C@H](O)CCl	1803141905	VLLHCHHCVBDJOL-XZOAIXRZSA-N	435.864	1.118	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1	1803148475	QGZPMCOEJZANSP-OJLVUWQFSA-N	427.885	1.249	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)CCNC(=S)NC)[C@H]1c1cccnc1	1803692071	PFSHIOYFOCUZHE-RYRKJORJSA-N	440.013	1.979	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1	1807989343	AVCDVAQFMLLSSM-FZKQIMNGSA-N	449.305	1.992	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)C(Cl)Cl)[C@@H]1c1cccnc1)c1cc(O)nc(O)n1	1808305423	ZPPNNRDMHSEPKW-GXFFZTMASA-N	426.260	1.406	50	20	IDGD	
Cc1cnc(C(=O)N2CCC3(CCCN(C(=O)c4cccc(B(O)O)c4)C3)CC2)s1	1809975105	TXNKKIUVKOSBBS-UHFFFAOYSA-N	427.335	1.290	50	20	IDGD	
Cc1nocc1C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1	1810297423	CBDDMJDZIVLWCE-HNAYVOBHSA-N	449.471	1.010	50	20	IDGD	
CC(C)(F)C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1	1810302444	KFJWUXILOBCJOQ-WMLDXEAASA-N	428.468	1.148	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1CCN(C(=O)Cc2ncccn2)[C@@H]1c1cccnc1	1810540423	NJYSGSTWPBRQGY-LAUBAEHRSA-N	427.581	1.972	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)[C@H](C)NC=O)[C@H]1c1cccnc1	1812776771	IDLVSQIHINGJKK-TUUVXOQKSA-N	425.327	1.395	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)[C@H](C)NC(C)=O)[C@H]1c1cccnc1	1812779017	NZKCTTKHHVRTSO-STECZYCISA-N	439.354	1.786	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)C[C@@H]2CCCCO2)[C@H]1c1cccnc1	1813068193	JQCJZKSVIHMRIU-YDHSSHFGSA-N	445.564	1.420	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@H](CNC(=O)CCn2ccnn2)[C@@H]1c1cccnc1	1813432323	GFLZCIBTMKOPFM-PXNSSMCTSA-N	430.585	1.621	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1	1816727895	BGNMZTZBHYIFAE-VHSXEESVSA-N	426.882	1.429	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](F)Br)CC2	1817021430	GEIPNQYCAVDTTF-MATHAZKKSA-N	436.307	1.193	50	20	IDGD	
CC(=O)Nc1cc([C@H]2CCCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)[nH]n1	1817021752	OAFDHVBKGFNANR-GOSISDBHSA-N	427.509	1.768	50	20	IDGD	
O=C(CN1C(=O)CSC1=S)N[C@H]1CCc2nc(NC(=O)[C@H](F)Cl)sc2C1	1817132775	SCHNZFCUGAVSRN-KGFZYKRKSA-N	436.943	1.450	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccccc2F)[nH]n1)c1cccc(B(O)O)c1	1817476369	CJXKEDNJGIPVTF-IBGZPJMESA-N	436.252	1.848	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CNC(=O)C(F)(F)F)n[nH]1	1822444185	KVIHDLUVPXLKHN-KOLCDFICSA-N	439.822	1.334	50	20	IDGD	
C[C@H](Cn1cncn1)C(=O)N[C@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1	1823008812	WRQRGEHICYTIOO-PTRXPTGYSA-N	445.318	1.673	50	20	IDGD	
CC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1	1828925370	KCKWOCQMVDCIRY-LJQANCHMSA-N	429.521	1.288	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(F)n2)CC1	1829224972	IFHOOYCXSSPOPH-FQEVSTJZSA-N	439.296	1.448	50	20	IDGD	
CN1CCN(C2(C(=O)N3CCCC[C@@H]3C3CCN(C(=O)[C@H](F)Cl)CC3)CC2)CC1	1830247854	ZSALMPCEUUBGBG-MSOLQXFVSA-N	428.980	1.921	50	20	IDGD	
Cc1ccc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)o1	1830545427	JHGNHJCRCFPYJH-KUHUBIRLSA-N	443.338	1.618	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)Nc3nccs3)C2)C1	1831645590	CMTDPYUXOJZDFN-ZRGWGRIASA-N	444.985	1.807	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C[C@H](N)c3cccnc3)C2)C1	1831645671	FEODZKNXORFTAY-BBTUJRGHSA-N	438.956	1.335	50	20	IDGD	
CCOC(=O)/C=C/C(=O)N1CCC([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1	1831872020	KTDMQOKPXVTDOW-DOJUMQAQSA-N	436.553	1.098	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)C/N=C/c2ccco2)CC1	1831873523	NDDXAJIAOLDBFI-WEKPXBEKSA-N	445.564	1.691	50	20	IDGD	
C=CCSCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1	1832458676	VHFOCVVFKYBCBH-IAGOWNOFSA-N	425.378	1.598	50	20	IDGD	
O=C(C(Cl)Cl)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1COc3ccccc3O1)CCO2	1832499718	WSMCAXAAXIVQKU-BEFAXECRSA-N	445.299	1.087	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3nnc(C)s3)CCO2)C1	1833020875	QNIWHSCXMFQBLP-KBXCAEBGSA-N	430.958	1.253	50	20	IDGD	
CC[C@H](C)[C@H](N)C(=O)NC1CCN(C2CCN(C(=O)CO[Si](C)(C)C)CC2)CC1	1834688207	KTHYCBFVJDUEQG-JXFKEZNVSA-N	426.678	1.783	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3c(C)noc3N)CC2)CC1	1834703014	REOMOZLYDBOKFW-HNNXBMFYSA-N	427.933	1.004	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)Cn3nnc4ccccc43)CC2)CC1)[C@H](F)Cl	1835079443	XPXCGDNTKRGKQN-IBGZPJMESA-N	436.919	1.537	50	20	IDGD	
C[C@@H](Nc1cnccn1)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](F)Cl)CC2)CC1	1835749559	VIAJLLMWPJBZOE-CXAGYDPISA-N	426.924	1.383	50	20	IDGD	
COc1ccc(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)c(F)c1	1836692859	CGRMSWNAMAUUOU-QUCCMNQESA-N	446.878	1.758	50	20	IDGD	
COc1ccccc1C(=O)N1CCO[C@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1	1838877212	STFBAFMMHASSOY-NRFANRHFSA-N	436.581	1.617	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc4c3cnn4C)C2)C1	1839144758	KBUYLJPGUCYCCH-UTKZUKDTSA-N	434.924	1.661	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3ccco3)C2)C1	1839150820	YIIFHKQNWRBIPI-MOPGFXCFSA-N	433.332	1.905	50	20	IDGD	
COC1(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)CCC1	1839203533	NVXYEGYOZWRXAM-WMLDXEAASA-N	437.306	1.093	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C1(Br)CC1)CCO2	1839205366	FZHUEFIWPVSDSX-CJNGLKHVSA-N	437.762	1.778	50	20	IDGD	
N#CCCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)CCO2	1839743285	HSMDMKVNDYCVSA-IHSQGBLNSA-N	444.438	1.632	50	20	IDGD	
COc1ccccc1CC(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1839952811	WMAFHHCZZWVVGP-JOCHJYFZSA-N	438.952	1.959	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CC=CCC3)C2)C1	1839961903	MSRUEOPKDRAXFL-GJYPPUQNSA-N	429.355	1.973	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3CC[C@@H](C)O3)C2)C1	1839965375	WXJHPTIQRLTVOR-BASYENTBSA-N	433.343	1.184	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(Cl)c3C)C2)C1	1840149780	ZXMDXLWFQVLATP-PXNSSMCTSA-N	445.343	1.972	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CNc3ccccc3C)C2)C1	1840152096	XGGGJPXPGIJBCC-LAUBAEHRSA-N	439.940	1.117	50	20	IDGD	
C[C@@H](O)[C@H](NC(=O)c1ccccc1)C(=O)N1CCCC12CN(C(=O)C(Cl)Cl)C2	1841224748	FDVALZAMXYGMFL-OCCSQVGLSA-N	428.316	1.173	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCCC12CN(C(=O)c1ccc(CS(C)(=O)=O)nc1)C2	1841226061	JNJWZMQGOCNPMW-UHFFFAOYSA-N	427.954	1.708	50	20	IDGD	
CC(C)C[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1	1841354730	RFYFHHASUNAIBY-LSDHHAIUSA-N	431.961	1.729	50	20	IDGD	
CC(C)Oc1ccc(C(=O)N2CC3(CCCN3C(=O)c3ccc(B(O)O)cc3)C2)cc1C#N	1843012746	NLYYVNLAWSRMMH-UHFFFAOYSA-N	447.300	1.156	50	20	IDGD	
O=C(c1c[nH]c2c(Cl)cccc12)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843014778	ANOUTJZEMHSNNH-UHFFFAOYSA-N	437.692	1.632	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1cccnc1S)C2	1843415053	GESCAHZUPYVEHA-YDZHTSKRSA-N	426.502	1.321	50	20	IDGD	
Cc1cc(C(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)c2cc(O)ccc2n1	1844020632	AZOUJCOUCQBHFB-UHFFFAOYSA-N	445.284	1.059	50	20	IDGD	
CC(=O)N[C@@H](C(=O)N1CCCC12CN(C(=O)[C@@H](F)Br)C2)c1ccc(F)cc1	1845009819	AEEDPCQIYZHIML-HUUCEWRRSA-N	444.276	1.897	50	20	IDGD	
Cc1sc2ncn(CC(=O)NNC(=O)c3nn(-c4ccccc4)cc3O)c(=O)c2c1C	10158711	ABLXJSFKQWXHSF-UHFFFAOYSA-N	438.469	1.427	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Cc2c[nH]c3ccccc23)cc(Cl)c1OCC(N)=O	14368735	MLXOCCJXPCUPNE-UHFFFAOYSA-N	430.848	1.698	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)ccc1C	15424938	RTMFIUUUFUFIMU-UHFFFAOYSA-N	433.486	1.099	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)CSc2ccc([N+](=O)[O-])cc2)c2ccccc2c1=O	25257883	SDKFLRUSCUGXLV-UHFFFAOYSA-N	427.442	1.878	50	20	IDGD	
Cn1cc(S(=O)(=O)NNC(=O)c2cc3c(s2)CC[C@@H](C(C)(C)C)C3)cc1C(N)=O	115631602	GKOLGXDCMHFIHV-GFCCVEGCSA-N	438.575	1.960	50	20	IDGD	
CCCS(=O)(=O)c1ccccc1C(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	117008610	UDTMGVWYUCSTLK-UHFFFAOYSA-N	428.470	1.192	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)NCCc2cccs2)c(C(=O)OC)s1	726520804	OHKZPYZDWOFEDO-UHFFFAOYSA-N	447.516	1.118	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc3c(s2)CCOC3)c1	728512533	YQWLYHFNFDSIBJ-UHFFFAOYSA-N	437.543	1.926	50	20	IDGD	
C[C@H]1CCCN(S(=O)(=O)c2cc(C(=O)NNC(=O)Cc3cc[nH]n3)ccc2Cl)C1	730091502	CJTCQLRJBUJLFH-LBPRGKRZSA-N	439.925	1.487	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cccc3ncccc23)cc(Cl)c1OCC(N)=O	730225370	CBTHIOQRFSEUTI-UHFFFAOYSA-N	428.832	1.836	50	20	IDGD	
O=C(CCCOc1ccc(Cl)cc1Cl)NNC(=O)NCCCN1C(=O)CNC1=O	731117365	HDMGGVRMIFOGQD-UHFFFAOYSA-N	446.291	1.425	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)c2nn(-c3ccc(F)cc3)ccc2=O)cc1	731571820	DQLCLJCGAKBHFE-AWEZNQCLSA-N	440.431	1.999	50	20	IDGD	
CCOc1ccccc1C(=O)N1CCC[C@H]1C(=O)NNC(=O)CCN1C[C@H](C)O[C@H](C)C1	732261351	CFKHUKLZCXKDOM-SCTDSRPQSA-N	446.548	1.337	50	20	IDGD	
CC(=O)c1cccc(S(=O)(=O)NCCC(=O)NNc2ccc(Br)nc2)c1	732836059	CHBUTXGHVPHHJP-UHFFFAOYSA-N	441.307	1.858	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c1	733108112	GODQXBHESIUPCG-UHFFFAOYSA-N	445.476	1.773	50	20	IDGD	
CC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)c1cnn(-c2ccccc2)c1	733171675	ULPFAWNXLWSAFB-OAQYLSRUSA-N	430.468	1.862	50	20	IDGD	
O=C(COC(=O)Cc1coc(-c2ccc(F)cc2)n1)NNC(=O)c1cccc([N+](=O)[O-])c1	733601870	AFMRPKPGMOGUAZ-UHFFFAOYSA-N	442.359	1.936	50	20	IDGD	
COc1ccccc1[C@@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)CNC(=O)c1ccco1	734813730	GCWMOBWXWJKNOX-QGZVFWFLSA-N	446.460	1.431	50	20	IDGD	
CCCCN1C(=O)CC[C@H](C(=O)NNC(=O)c2cnn(C)c2)[C@H]1c1ccc(OC)cc1	735446260	IRVKDCJLPBADMK-AZUAARDMSA-N	427.505	1.970	50	20	IDGD	
COC[C@H](C)CNC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	737064623	IYDPHIMIMBFYAZ-GFCCVEGCSA-N	426.520	1.775	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)[C@@H]1CCN(c2ccc3c(c2)OCCO3)C1=O	737927406	VXFPMGCUNVDVJE-KRWDZBQOSA-N	425.441	1.175	50	20	IDGD	
Cc1ccc(O[C@@H](C)C(=O)N2CCN(CC(=O)NNC(=O)c3ccccc3)CC2)c(C)c1	738332746	OWPMLFXPNGEXNA-IBGZPJMESA-N	438.528	1.676	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2cn(C)nc2-c2ccccc2OC)c2ccccc2c1=O	740813450	IWPCOKQMLTUBAB-UHFFFAOYSA-N	446.467	1.900	50	20	IDGD	
COc1cc(C(=O)NNC(=O)N[C@H]2CCC[C@@H](S(C)(=O)=O)C2)cc(OC)c1OC	740902936	SXRWNVOGJUIYSY-QWHCGFSZSA-N	429.495	1.012	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)c2ccc(Cl)c(N3CCNC3=O)c2)c2ccccc2c1=O	742474854	YRZTYNNQMWXWBS-UHFFFAOYSA-N	440.847	1.191	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H]2C[C@@]23CCCc2ccccc23)c1	743283754	FIVLKVYYYMJFRY-DENIHFKCSA-N	427.526	1.992	50	20	IDGD	
O=C(NNC(=O)c1cccc(OC(F)F)c1)N[C@@H]1CC(=O)N(CCOc2ccccc2)C1	743587582	JTQVJGWWZKXMPK-OAHLLOKOSA-N	448.426	1.912	50	20	IDGD	
COc1ccc(/C=C/C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)cc1OC	744620972	JUKUUVMDTREDMK-CSKARUKUSA-N	447.513	1.881	50	20	IDGD	
CCCS(=O)(=O)Nc1ccccc1C(=O)OCC(=O)NNC(=O)c1ccc(C#N)cc1	744828778	KNFLUTQXQCPTJL-UHFFFAOYSA-N	444.469	1.328	50	20	IDGD	
COc1cccc(O[C@@H](C)CNC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c1	745881131	FVLIRPPDUYYNCN-ZDUSSCGKSA-N	425.445	1.354	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)Oc1ccc(Cl)cc1	745912755	WXTZFBIAJYPTMU-GFCCVEGCSA-N	429.864	1.998	50	20	IDGD	
O=C(CCc1ccccc1)NNC(=O)[C@H]1CN(Cc2nc(O)c3ccccc3n2)CCO1	746194646	WDDHRWZLSPHQQT-LJQANCHMSA-N	435.484	1.316	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)c2ccc3c(c2)C(=O)N(Cc2ccco2)C3=O)c1	746299324	DIYUCXCRHSZPIZ-UHFFFAOYSA-N	447.407	1.504	50	20	IDGD	
Cc1cccc(N2C(=O)N[C@@H](CCC(=O)NNC(=O)Cc3cn4ccccc4n3)C2=O)c1	746547955	ACZNVUQKMPYNHJ-KRWDZBQOSA-N	434.456	1.238	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCC(=O)NNc2nc(C)cc(OC)n2)cc1OCC	746627167	GKNUIVFOPZWZRV-UHFFFAOYSA-N	439.494	1.013	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNS(=O)(=O)c2cc(C(=O)O)cc(Cl)c2C)cc1C	747597004	UXJGYFLMQAJFRI-UHFFFAOYSA-N	439.877	1.912	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN1C(=O)c1cc(Cl)ccc1Cl)C(=O)N1CCCC1	748240619	HWYZSIVXSLBALA-AWEZNQCLSA-N	427.288	1.368	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)c1cccc(CN2C(=O)CSC2=O)c1	751208152	ARYTYOWOKSCPAQ-UHFFFAOYSA-N	432.483	1.135	50	20	IDGD	
CC(C)Cn1[nH]c(CC(=O)NNC(=O)[C@H](C)Oc2cccc(Br)c2)cc1=O	751443670	PDIFOUULVNIPCG-LBPRGKRZSA-N	439.310	1.752	50	20	IDGD	
CCc1ncc(C=NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)s1	752160306	NCILADKEOPRQBA-UHFFFAOYSA-N	436.559	1.809	50	20	IDGD	
C[C@H](C(=O)NNC(=O)c1nnc(O)c2ccccc12)c1ccc(S(=O)(=O)N(C)C)cc1	752502876	IZWPRIPCBZZVGZ-LBPRGKRZSA-N	443.485	1.150	50	20	IDGD	
O=C(COCCNC(=O)c1ccccc1)NNc1c(F)cc(C(=O)NC2CC2)cc1F	752636698	OWLJOVVVVQFLAH-UHFFFAOYSA-N	432.427	1.747	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)NC[C@H]2CCC[C@@]23NC(=O)N(C)C3=O)c1C	753024830	QYZBNVFICDCISC-VTJXTGGHSA-N	431.493	1.122	50	20	IDGD	
O=C(NNC(=O)N1CCS(=O)(=O)[C@H]2CCCC[C@H]21)c1ccc(Br)s1	753811328	SSJUKALNEVDBKX-KOLCDFICSA-N	436.353	1.907	50	20	IDGD	
Cc1cccc(C)c1NCC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	755051357	MYVFPJZOQYZCKJ-UHFFFAOYSA-N	446.529	1.197	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@@H](C)C(=O)NNC(=O)Nc1ccn(CC(=O)N(C)C)n1	756310807	JSYYVAHIPGRMDW-ZDUSSCGKSA-N	436.900	1.862	50	20	IDGD	
COc1cccc(OC)c1CC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	756899169	AZBORSOKJOKJHF-UHFFFAOYSA-N	447.513	1.492	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)Nc2cc(C(=O)OC)n(C)c2)c2ccccc2c1=O	757670946	GHZHNBILBSCKME-UHFFFAOYSA-N	440.460	1.788	50	20	IDGD	
CN(NC(=O)CCS(=O)(=O)C1CCCC1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758782339	QNZWIYOQQKJSIB-UHFFFAOYSA-N	446.570	1.370	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccnn1Cc1ccc(F)cc1	760280687	WYHNFRXOZRHVPO-UHFFFAOYSA-N	441.419	1.244	50	20	IDGD	
CCc1ccccc1OCC(=O)NNS(=O)(=O)c1ccc(S(C)(=O)=O)c(F)c1	760334984	OCXLOJRPYNJKSN-UHFFFAOYSA-N	430.479	1.180	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)c1cnn(-c2ccccc2)c1Br	760435729	DZVYMPBCDNPYDE-UHFFFAOYSA-N	438.282	1.921	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)C(=O)Nc1cc(N2CCNC2=O)ccc1Cl	763442910	UUVBPKVAZYNYRW-UHFFFAOYSA-N	446.807	1.178	50	20	IDGD	
Cc1cnn(-c2ccc(NC(=O)C(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)cc2F)c1	763468874	WKIQXHWHDDAKBK-UHFFFAOYSA-N	426.364	1.628	50	20	IDGD	
CCOc1cc(F)ccc1NC(=O)C(=O)NNC(=O)c1cc(OC)c(OC)c(OC)c1	763539013	HIFNMCIJEDANDY-UHFFFAOYSA-N	435.408	1.650	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)C(=O)CCC3)cc(OC)c1OC	763540008	PFBYBDJYCVMBNQ-UHFFFAOYSA-N	441.440	1.631	50	20	IDGD	
CN(C)C1CCN(c2ccc(NC(=O)C(=O)NNC(=O)c3ccccc3F)cc2)CC1	763556010	JNIWRKHXALWOFC-UHFFFAOYSA-N	427.480	1.756	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccnn1Cc1ccc(C)o1	763648793	WOWSXGUBMCNZPH-UHFFFAOYSA-N	427.417	1.006	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(O[C@@H]3CCOC3)cc2)cc1C	763668144	YWFBZIJPKSAYBX-LJQANCHMSA-N	427.457	1.636	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)C(=O)Nc1ccc(Cl)c(C(=O)NC2CC2)c1	763678700	HQMADXSBEJBYGD-UHFFFAOYSA-N	448.838	1.536	50	20	IDGD	
COCCOc1cc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCC3)ccc1OC	763782759	UNJQQMJDAALPOK-UHFFFAOYSA-N	433.486	1.670	50	20	IDGD	
COc1cc(Cl)c(C)cc1NC(=O)C(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	763790217	GUIHMUOQNVOGBG-UHFFFAOYSA-N	443.847	1.304	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)C(=O)Nc1c(F)c(F)c(F)c(F)c1F	763803346	LRHKYQXKIILOSZ-UHFFFAOYSA-N	448.260	1.455	50	20	IDGD	
CCOc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NNC(=O)COc1ccc(C)cc1	763820050	DILGWQYHSBQPGP-UHFFFAOYSA-N	442.472	1.260	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cc(C(=O)OC)ccc2F)cc1	763865067	HRRTVSNCWQAKRK-LBPRGKRZSA-N	447.419	1.564	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cccnc2-n2cccn2)cc1	763877162	HYRZWISSKQZFQW-CQSZACIVSA-N	436.428	1.023	50	20	IDGD	
CC(C)CC(=O)NNC(=O)C(=O)Nc1ccc(NC(=O)[C@@H]2CCCO2)cc1C(F)(F)F	763881503	GMABFMAJKNHUHW-AWEZNQCLSA-N	444.410	1.955	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(F)cc2C(=O)OC)cc1OC	763910289	BTHICCLNMOADJH-UHFFFAOYSA-N	447.419	1.809	50	20	IDGD	
CCn1cnnc1-c1ccccc1NC(=O)C(=O)NNC(=O)c1cc(Cl)ccc1O	763974742	XAIFEQISGGCZRU-UHFFFAOYSA-N	428.836	1.724	50	20	IDGD	
CCCS(=O)(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2ccccc2OC)c1	764047684	KERLMRFFUWYJGN-UHFFFAOYSA-N	434.474	1.247	50	20	IDGD	
N#CCn1cc(NC(=O)C(=O)NNC(=O)c2ccc(Br)cc2Cl)cn1	764057384	ARFQWVISOHOART-UHFFFAOYSA-N	425.630	1.222	50	20	IDGD	
CCNC(=O)c1ccc(C)c(NC(=O)C(=O)NNC(=O)c2cccc(Br)c2)c1	764059674	WNURNENIOTVPOZ-UHFFFAOYSA-N	447.289	1.907	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2cc(-c3ccccc3)ns2)c1	764086448	UHBAEETWYNUOBJ-UHFFFAOYSA-N	444.494	1.613	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2cccc(OC[C@@H]3CCCO3)c2)c1O	764131365	FTGFAPOUKNKAQF-HNNXBMFYSA-N	429.429	1.358	50	20	IDGD	
Cc1nn(-c2ccc(C#N)cc2)c(NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)c1C	764154730	UGSWRMNADVZETC-LJQANCHMSA-N	444.451	1.450	50	20	IDGD	
CN(C)c1ccc(C(F)(F)F)cc1NC(=O)C(=O)NNC(=O)[C@@H]1Cc2ccccc2O1	764155325	YHENMQJDJGNJSE-INIZCTEOSA-N	436.390	1.861	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCCCC2)cc1NC(=O)C(=O)NNC(=O)c1ccoc1	764160691	XNTBQYDFVDILFE-UHFFFAOYSA-N	434.474	1.162	50	20	IDGD	
Cc1ncsc1C(=O)NNC(=O)C(=O)Nc1ccc(C(=O)N2CCCC[C@@H]2C)cc1	764245334	DIOCMQHXENENNZ-LBPRGKRZSA-N	429.502	1.866	50	20	IDGD	
CCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cccc(OC(F)F)c2)c(C)c1	764260136	PWEOBOOFBZXQHA-UHFFFAOYSA-N	434.399	1.746	50	20	IDGD	
CC(C)CNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)cc1	764379797	LANQNWFENGMVDS-UHFFFAOYSA-N	448.426	1.830	50	20	IDGD	
CC[C@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)cc1	764380236	UEODFCJUCBOPOA-ZDUSSCGKSA-N	448.426	1.973	50	20	IDGD	
CN(C)CCc1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)cc1	764386792	CLZDPRSDZQAYCX-UHFFFAOYSA-N	438.463	1.720	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1)C(=O)Nc1ccn(-c2ccccc2)n1	764388662	VDDVPACWFYQHIO-UHFFFAOYSA-N	433.403	1.801	50	20	IDGD	
CC(=NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C)c1cc(Cl)sc1Cl	764818078	NWTSZSLRVHGPPJ-UHFFFAOYSA-N	429.289	1.342	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)c3ccc(F)c(S(=O)(=O)NC)c3)n[nH]2)cc1	765575215	IAQBXIXBVAHIRW-UHFFFAOYSA-N	445.476	1.761	50	20	IDGD	
COc1ccccc1N(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)c2cc(C)[nH]n2)cc1	765587517	XVRXOSHUSBQQSD-UHFFFAOYSA-N	443.485	1.627	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)[C@H]3CCC[C@@H](C)C3)CC2)cc1	765727849	JCMCTRMPUORTHQ-MSOLQXFVSA-N	436.578	1.275	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)CCNC(=O)OC(C)(C)C)CC2)cc1	765747827	ICOJJAXSBPWRIF-UHFFFAOYSA-N	433.553	1.175	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H]2CCO[C@@H](C3CC3)C2)c1	765921274	ZRHGUFIIJBNWLQ-FUHWJXTLSA-N	438.550	1.619	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)c1ccc2n[nH]cc2c1	766668146	ILCMEWAAEFSJAA-UHFFFAOYSA-N	426.908	1.795	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)CN1CCN(C(=O)Cc2ccc(Cl)cc2)CC1	766853559	MBADLSIZGQIFIN-UHFFFAOYSA-N	442.947	1.725	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCC(=O)NN=c2cc[nH]cc2Cl)cc1OCC	768450209	VGAYKZGIQDBASZ-UHFFFAOYSA-N	428.898	1.376	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)CCC(=O)c1ccc2c(c1)OCCO2	768645547	QQXKZDVCAFVUQL-UHFFFAOYSA-N	434.470	1.976	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3cn(C)nc3C(C)(C)C)cc2)CC1	768945976	WCFJPFAIRIQQJT-UHFFFAOYSA-N	434.566	1.411	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCCc2cccc(C(=O)OC)c2)nc1	769007778	WPPTXCXYOWJCKM-UHFFFAOYSA-N	449.533	1.768	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)NC1CCN(CCC(=O)N(C)C)CC1	770514733	UBCCRWTWMIXRSF-CQSZACIVSA-N	439.944	1.380	50	20	IDGD	
COc1cccc(NC(=O)C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)c1F	770773903	MSQIHMQMXQYART-UHFFFAOYSA-N	441.419	1.525	50	20	IDGD	
Cc1c(C(=O)NNc2ccnc(Br)c2)cc(S(N)(=O)=O)cc1[N+](=O)[O-]	771553036	ZCLHSGCVOCWCTR-UHFFFAOYSA-N	430.240	1.465	50	20	IDGD	
Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	771606919	ZOTZVTPKYGYJER-UHFFFAOYSA-N	440.865	1.491	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)Cn1cnc2scc(-c3cccs3)c2c1=O	771902942	OHAYIKZHJBDCSZ-SNVBAGLBSA-N	434.499	1.676	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)[C@H](C(C)C)N2CCCS2(=O)=O)cc1OC	772630839	NSTWFWHTMAIFKL-SFHVURJKSA-N	441.550	1.695	50	20	IDGD	
CCn1cnc2c1c(=O)n(CC(=O)NN=C1CCO[C@@H](C)C1)c(=O)n2Cc1ccccc1	773193115	ODFUCYZVYNAFSA-HNNXBMFYSA-N	438.488	1.099	50	20	IDGD	
CN(C)C(=O)[C@@H]1CC[C@@H](CNC(=O)NNC(=O)c2ccc(F)cc2Br)O1	775462223	WWJJAPOZRCEDJL-GWCFXTLKSA-N	431.262	1.168	50	20	IDGD	
O=C(NNc1ccccn1)C1CCN(S(=O)(=O)c2ccc3c(c2)OCCCO3)CC1	777474585	LHFXVAXPRFVZEW-UHFFFAOYSA-N	432.502	1.787	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)[C@@H](C)NC(=O)CC(C)(C)C)n[nH]2)cc1OC	779040756	LKFYPPBWOFRRTM-GFCCVEGCSA-N	431.493	1.796	50	20	IDGD	
O=C(NCCS(=O)(=O)N1CCSCC1)NNc1ccccc1OC(F)(F)F	779561504	BSLNJOTZBHJBCW-UHFFFAOYSA-N	428.458	1.590	50	20	IDGD	
O=C(NN=c1cc[nH]cc1)[C@H]1CCCN(S(=O)(=O)c2ccc(Br)cc2)C1	780760022	VOXQPSKRMMAKPT-ZDUSSCGKSA-N	439.335	1.810	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1csc(N2CCOCC2)n1)[C@H]1CCCN(C2CCC2)C1	781399807	HSGRREQWNCGQBX-GJZGRUSLSA-N	436.582	1.577	50	20	IDGD	
COc1ccc(NNC(=O)Cc2ccc(CC(=O)NNc3ccc(OC)cn3)cc2)nc1	781535001	WQVJVKSWPAZKJS-UHFFFAOYSA-N	436.472	1.865	50	20	IDGD	
O=C(NNC(=O)C(=O)NC1CC1)C(=O)Nc1cccc(Oc2ccnc3ccccc23)c1	782965644	HMCGAQSXJDYQMZ-UHFFFAOYSA-N	433.424	1.392	50	20	IDGD	
CC(C)N1C(=O)C[C@@H](NC(=O)NNC(=O)C(=O)NC2CC2)[C@H]1c1ccc(Cl)c(F)c1	783320010	JCVKDIMSYQSDKE-GDBMZVCRSA-N	439.875	1.139	50	20	IDGD	
Cc1ccc(F)cc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	784230379	LSZRFLHCNPNJHE-UHFFFAOYSA-N	449.508	1.152	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2cccc(S(C)(=O)=O)c2)ccc1C(=O)NC(C)C	784839238	HKMBWEXYUWNYOD-UHFFFAOYSA-N	432.502	1.619	50	20	IDGD	
COc1ccc(C(=O)N2CCN(C)CC2)cc1NC(=O)C(=O)NNc1ccc(Cl)nc1	784874375	KCTVHFFLUUMWGW-UHFFFAOYSA-N	446.895	1.213	50	20	IDGD	
COCCCS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2cc(F)c(F)cc2F)cc1	784886429	KOIIZAGQGDTWGN-UHFFFAOYSA-N	445.419	1.996	50	20	IDGD	
CCNC(=O)N(C)NC(=O)C(=O)Nc1ccc(CN2CCN(c3ccccn3)CC2)cc1	784916981	FYEUUJJURNLQJE-UHFFFAOYSA-N	439.520	1.035	50	20	IDGD	
CCOc1cc2c(cc1NC(=O)C(=O)NNC(=O)c1cc([N+](=O)[O-])ccc1O)O[C@@H](C)C2	785023282	MNCIEYTVFMLKFO-JTQLQIEISA-N	444.400	1.422	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)Cn1c(=O)oc2cc([N+](=O)[O-])ccc21	785343754	HIZMCOUNGKBULM-JTQLQIEISA-N	434.792	1.771	50	20	IDGD	
Cn1cc(-c2ncccc2NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)cn1	786415116	XGAFSCLUCRYJNH-UHFFFAOYSA-N	428.836	1.300	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cccnc3-c3cnn(C)c3)n[nH]2)cc1	786416117	BPXSGRBKUVPFBX-UHFFFAOYSA-N	444.455	1.580	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)[C@@H]1CN(C)C(=O)c2ccccc21	787094119	OCIHFYNYHGUUNY-MRXNPFEDSA-N	445.859	1.522	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccn(C3CCN(C)CC3)n2)c1C	787542585	BGNLMPDVDRJOQS-MRXNPFEDSA-N	442.520	1.320	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ccc(Br)nc2)cc1N1CCNC1=O	787561155	HNRTUCSUUSNUFN-UHFFFAOYSA-N	433.266	1.764	50	20	IDGD	
O=C(CNC(=O)NCc1ccc([N+](=O)[O-])cc1)NNC(=O)[C@H]1OCC[C@H]1c1ccccc1	788873964	ISCYVYGRLAIRRI-HKUYNNGSSA-N	441.444	1.114	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)[C@@H]2CCN(CC(F)(F)F)C2)c2ccccc2c1=O	791457831	HBNRKPUAHCJNFI-GFCCVEGCSA-N	425.411	1.452	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CN2CCN([C@H](C#N)c3cccc(Cl)c3)CC2)c1	791622316	BNVSAKMSPQXZPM-HXUWFJFHSA-N	436.903	1.855	50	20	IDGD	
Cc1c(C(=O)OCC(=O)NNC(=O)c2ccccc2)nnn1Cc1ccc(F)cc1F	791660410	YFVHJJRYXAQXEV-UHFFFAOYSA-N	429.383	1.531	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1c(C)c(C)nn1-c1ccc(Cl)cc1	792265505	CJHULRUZOXCGGL-ZDUSSCGKSA-N	437.884	1.280	50	20	IDGD	
COc1cc(C(F)(F)F)ncc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccccc1F	792269248	OSPVEQZVLQGKBC-VIFPVBQESA-N	444.341	1.802	50	20	IDGD	
O=C(c1nc(Br)ccc1F)N1CCN(S(=O)(=O)CBr)CC1	792301420	RBDZPCRSKYIGCH-UHFFFAOYSA-N	445.108	1.423	50	20	IDGD	
CS(=O)(=O)C1(C(=O)NNC(=O)COc2ccc(OCc3ccccc3)cc2)CCC1	792796514	FUYYKBQELAWXKC-UHFFFAOYSA-N	432.498	1.759	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)nc1Br	793021856	MEIJLCXBQYCYFC-UHFFFAOYSA-N	432.234	1.189	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C[C@@H]1COCCN1C(=O)OC(C)(C)C	794779933	IGFSQJDGTUFLKQ-ZIAGYGMSSA-N	425.457	1.766	50	20	IDGD	
CC1=C(C(=O)NNc2ccccc2S(=O)(=O)NC(C)(C)C)[C@@H](C)n2ncnc2N1C	798982238	GRQVEKHDUUPHHE-CYBMUJFWSA-N	433.538	1.783	50	20	IDGD	
CC(=O)NCCN(Cc1ccsc1)C(=O)NNC(=O)c1cc(Br)c[nH]1	800983422	JAIOMNRKGIHTEV-UHFFFAOYSA-N	428.312	1.831	50	20	IDGD	
COc1ccc(-n2nnc(C(=O)NNC(=O)Nc3ccc(S(C)(=O)=O)cc3)c2C)cc1	802066268	SAVBORJSUNCGHJ-UHFFFAOYSA-N	444.473	1.454	50	20	IDGD	
COc1ccc(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)c(C)c1OC	804423988	DAIZHZXHKJZEGP-UHFFFAOYSA-N	435.502	1.790	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)NC[C@@H]2CCCC[C@H]2NS(C)(=O)=O)c1C	804495786	SIPYTQGUZUHPEP-SIWQTBBHSA-N	436.578	1.883	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)NC[C@@H]2CCCC[C@@H]2NS(C)(=O)=O)c1C	804495787	SIPYTQGUZUHPEP-UIAAKADISA-N	436.578	1.883	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)Nc1cc(C(F)(F)F)cc(Br)n1	806801222	SLADSUALJMUZJT-LURJTMIESA-N	445.217	1.450	50	20	IDGD	
Cc1sc2nc(CS[C@H](C)C(=O)NNC(=O)N3CCN(C)CC3)nc(O)c2c1C	807381531	YFGMWKZAMPQNDY-GFCCVEGCSA-N	438.579	1.624	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NN=Cc2ccc(S(N)(=O)=O)c(Cl)c2)c1	807949448	ISJQPKCYSKAXQQ-UHFFFAOYSA-N	444.922	1.002	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)C(=O)Nc2ccc(-c3ccccn3)cc2)c2ccccc2c1=O	810385922	FILXPCGYQGBZHB-UHFFFAOYSA-N	442.435	1.395	50	20	IDGD	
CN(C)c1cc(C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)nc2ccccc12	811324584	LXSOPWHFKCJDEW-UHFFFAOYSA-N	437.412	1.827	50	20	IDGD	
Cc1ccc(NC(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)cc1S(N)(=O)=O	812945742	UWUGZGQIQVMAFJ-UHFFFAOYSA-N	427.508	1.041	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2nc(C(C)(C)C)cs2)cc1	813033606	BFDGPOIAKGKUAQ-UHFFFAOYSA-N	425.536	1.773	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)C2(Cc3ccc(F)cc3)CCOCC2)n1	814489597	DERDEWQEHFLDHV-UHFFFAOYSA-N	449.504	1.863	50	20	IDGD	
COc1ccc(C=NNC(=O)Nc2ccc(S(N)(=O)=O)cc2)c(Br)c1O	814967646	TYSXBFNQBVPLNN-UHFFFAOYSA-N	443.279	1.966	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NN=C(CNS(C)(=O)=O)c2ccccc2)C1	814973157	DEDKSTIZIQKMGV-MRXNPFEDSA-N	438.550	1.703	50	20	IDGD	
COC(=O)C(C)(C)c1csc(NC(=O)C(=O)NNC(=O)CCCc2ccccc2)n1	815569073	GIBSRKQQAOZGBV-UHFFFAOYSA-N	432.502	1.703	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCCC2)cc1)NNC(=O)CNc1ccccc1	823328209	RDJTUWCYBFEICF-UHFFFAOYSA-N	430.530	1.663	50	20	IDGD	
O=C(NNC(=O)[C@]12CCC(=O)N1CCS2)c1nc(-c2ccccc2)n(-c2ccccc2)n1	892014768	SMGVQFMLAKTAQK-JOCHJYFZSA-N	448.508	1.761	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@@H]2C(=O)NNC(=O)COc2ccc(F)cc2)s1	894928019	ZENRDIPWERKDJI-OAHLLOKOSA-N	441.506	1.575	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)[C@H]1CCCCN1S(=O)(=O)c1cccs1	915686527	HPEHSHSGAWVHCF-OAHLLOKOSA-N	425.507	1.821	50	20	IDGD	
NS(=O)(=O)c1ccc(Br)c(C(=O)NNC(=O)COc2ccc(F)cc2)c1	915785138	NHPOBFDWDKKCHB-UHFFFAOYSA-N	446.254	1.076	50	20	IDGD	
COc1cccc(COCC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c1	915804215	DCSRBSWNEQFGDZ-UHFFFAOYSA-N	426.517	1.572	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)NCc1ccc(N2CCN(C)CC2)nc1	916245569	JPNSFBNQDFBVDM-HNNXBMFYSA-N	430.484	1.270	50	20	IDGD	
CC(C)[C@@H](CNC(=O)NNC(=O)c1ccc(Br)s1)N1CCN(C)CC1	916258175	MNYUWEMLCFJVFO-GFCCVEGCSA-N	432.388	1.727	50	20	IDGD	
CC(=NNC(=O)Cc1csc(C)n1)c1ccc(S(=O)(=O)NCCCC(=O)O)cc1	916317669	RHQVVEKFIKXVMG-UHFFFAOYSA-N	438.531	1.678	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)c1	916562070	KAMHJRVDJHJNSN-UHFFFAOYSA-N	446.529	1.734	50	20	IDGD	
COc1cccc(OCC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)c1	916743315	IYJFFPGJCKCELH-UHFFFAOYSA-N	447.513	1.710	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)c2ccc3c(c2)S(=O)(=O)N(C(C)C)C3=O)c1	916743346	AIGWAZYDSIZWCH-UHFFFAOYSA-N	447.469	1.332	50	20	IDGD	
Cc1noc(C)c1S(=O)(=O)N1CCC(C(=O)NNC(=O)c2ccc(Cl)nc2)CC1	917250992	PTSZCCBRCSOSLS-UHFFFAOYSA-N	441.897	1.202	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN(C)C(=O)c2ccc(Br)o2)cc1OC	917388720	TZGPIPGWYAAYCL-UHFFFAOYSA-N	440.250	1.593	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)Cc2ccc(C(=O)NNC(=O)c3cnns3)cc2)cc1	917393245	GYQIVQQMLIXJNZ-UHFFFAOYSA-N	445.526	1.742	50	20	IDGD	
CCCc1c(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)[nH]c(C)c1C(C)=O	917918734	CHYTWWKKFSOQCN-UHFFFAOYSA-N	440.909	1.854	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)N[C@@H](c2ccc(F)cc2)[C@H]2CCCO2)c2ccccc2c1=O	918126113	GNFOGXZPDJTCMZ-MSOLQXFVSA-N	439.447	1.937	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)c2ccc(F)c(S(=O)(=O)NC3CC3)c2)cc1	920012101	HNPYYJCEMIRVIO-UHFFFAOYSA-N	435.477	1.669	50	20	IDGD	
O=C(CN1CCN(C(=O)Cc2ccccc2Cl)CC1)NNC(=O)c1ccc(F)cc1	920836232	ABAOLXJODKBVEF-UHFFFAOYSA-N	432.883	1.627	50	20	IDGD	
COC(=O)COCC(=O)NNC(=O)c1ccc(CN2C(=O)c3cccc4cccc2c34)cc1	1261127882	AHBGNGXKSHADCG-UHFFFAOYSA-N	447.447	1.951	50	20	IDGD	
O=C(CCc1nc(-c2ccccc2)no1)NNC(=O)c1csc(N2CCOCC2)n1	1317724999	YJKGIKCOLCIBTD-UHFFFAOYSA-N	428.474	1.424	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2c[nH]cc(Cl)c2=O)c1	1321244424	VCEUWXNLYHNDAC-UHFFFAOYSA-N	426.882	1.134	50	20	IDGD	
Cn1nc2ccccc2c1C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	1324160419	ZPTPOCDTGYGVDF-UHFFFAOYSA-N	427.486	1.433	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)N[C@H]1CCO[C@]2(CCS(=O)(=O)C2)C1	1324924268	NMTCVEYGCDOXNO-YVEFUNNKSA-N	431.898	1.029	50	20	IDGD	
Cc1cc(C)n2ncc(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)[C@@H](O)CCl)C4)c2n1	1778555277	IWAVUBHWVGIJHE-CSODHUTKSA-N	449.939	1.073	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@]2(C1)CN(C(=O)c1ccc3ncncc3c1)CCO2	1779296834	HKRNAUUJZSFWEB-NRFANRHFSA-N	428.565	1.925	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)Cc2ccc3ncnn3c2)C1	1780551985	KVJFSLQRNPJUNI-CSODHUTKSA-N	449.939	1.040	50	20	IDGD	
O=C(C1CCC2(CC1)OCCO2)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781332654	CRNDPEHRMSKFMM-RHSMWYFYSA-N	449.317	1.440	50	20	IDGD	
CCOc1cccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)c1O	1781978992	NFTDGDRBRAANGH-MAUKXSAKSA-N	445.285	1.925	50	20	IDGD	
C=C(CC(=O)OCC)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)Br)C1	1782003338	JMKZTTZNRHPZEY-QMTMVMCOSA-N	445.354	1.793	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C1CCN(C(C)C)CC1)C2	1782171980	IQVQKWQQZNTAME-NNMXDRDESA-N	444.016	1.875	50	20	IDGD	
COCc1c[nH]c(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](Cl)COC)C2)c1	1782173722	NMQYGUMRNVRFEV-WRWLIDTKSA-N	427.929	1.542	50	20	IDGD	
CCOc1ccc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)C(Cl)Cl)C2)nn1	1782218280	JNZIKARRKXTYSU-FZKQIMNGSA-N	431.320	1.807	50	20	IDGD	
O=C1CSc2ncc(C(=O)N3CC[C@]4(C3)CN(C(=O)[C@@H](F)Cl)CCO4)cc2N1	1782425870	UNCKFJATGUDLOV-DYVFJYSZSA-N	428.873	1.104	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@@]2(C1)CN(C(=O)c1nc[nH]n1)CCO2	1782864846	XAZUBOHXRDSILV-CDXDBMBRSA-N	428.399	1.134	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCOc3ccc(C)cc3)[C@H]2C1	1783764943	KEUPNCRPUDVGTH-FFGOWVMKSA-N	438.952	1.997	50	20	IDGD	
CC(C)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc4c(c3)CCNCC4)C[C@@H]21	1783852722	KFWSZMHNJKWIHV-QRFRQXIXSA-N	448.995	1.628	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](C)Oc3cccnc3)C2)C1	1784547492	PIUZLDCPDSZCQC-IYOUNJFTSA-N	426.311	1.462	50	20	IDGD	
CC(C)n1nc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]3C2)cc1C(=O)O	1787444186	RGGPEZOGWIOEIK-GVARAGBVSA-N	430.864	1.290	50	20	IDGD	
Cc1ccc(NCCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](O)CCl)C[C@@H]32)c(C)c1	1788665086	DBRZFXOTHLOMJX-ZULIPRJHSA-N	437.968	1.685	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3CC[C@@H]4CCC(=O)N4C3)[C@H]2C1	1789770227	LRCZXBSRPMBFHL-UFYUIRFASA-N	425.957	1.385	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]2C1	1789871615	FWGUMQLNRGCCMJ-REZKGXPESA-N	439.336	1.764	50	20	IDGD	
C[C@@H](Cn1ccnc1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]2C1	1789873517	YOPHSTSXHOCKTO-GMHRPJKWSA-N	431.364	1.735	50	20	IDGD	
C[C@@H](O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](Br)Cc3ccccc3)[C@H]2C1	1790780304	VZSDURQHZCNYSB-XNJHUCFUSA-N	439.350	1.353	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)c3ccccc3)C[C@@H]21	1790961468	LRQCJJLQKCXLSL-ATIWLJMLSA-N	439.350	1.873	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)CBr)C[C@@H]21	1791055248	QANRDALNQFPLGS-PPCPHDFISA-N	440.176	1.781	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)CCSC)[C@H]2C1	1791308788	NQKOHGUIUVHHHM-AHDPXTMNSA-N	437.400	1.254	50	20	IDGD	
O=C(Cc1ccc(O)cn1)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1	1791935610	OFUDEMUXMNIXBF-UHFFFAOYSA-N	445.284	1.457	50	20	IDGD	
CCSc1ncccc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(B(O)O)cc1)C2	1792447193	PQTXUKOAUOEVDO-BCDXTJNWSA-N	439.346	1.439	50	20	IDGD	
CCOc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)CBr)nn1	1792872404	FHUMMJIHQFAOHD-NFFDBFGFSA-N	441.326	1.110	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CC[C@H](C(=O)OC)C1	1792970387	BRMUKQHTBMAXHS-CMXYNOPPSA-N	445.354	1.339	50	20	IDGD	
COc1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](O)CCl)nc1Br	1793113854	VIQWPRCKUIWYIX-LSCVPOLPSA-N	446.729	1.704	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1ccc(Cl)s1	1794171058	IKVVFJLEVRETAW-BTTYYORXSA-N	426.970	1.955	50	20	IDGD	
CC(C)(CCl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CCc2nc(O)nc(O)c2C1	1794382740	CDGVUTZDQQBGCY-YIYPIFLZSA-N	436.940	1.896	50	20	IDGD	
CC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)C2	1795144795	CMOGQDRGGVYPAP-RNCDSHHQSA-N	431.439	1.831	50	20	IDGD	
O=C1CC[C@H](C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](Br)Cc2ccccc2)C3)N1	1795826888	QYOSNKSZLZHRAI-CWQOZTLDSA-N	448.361	1.909	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1n[nH]c2c1CCCC2	1796166237	GRRFZDGMLWNZRM-LMWOUKEDSA-N	439.354	1.665	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)[C@@H]1[C@H]2Sc3ccccc3[C@H]21	1796188891	YMTNEJYEUKCYPT-HFABISMESA-N	448.353	1.506	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1noc2ccccc12	1796215671	XEIPNBUPULEXOM-QDMKHBRRSA-N	448.483	1.321	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(Br)cc1O)C2)[C@H](F)Cl	1796367278	DHEYMXOOAPJBDO-WAYYCVMKSA-N	435.677	1.892	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2cccnc2s1)c1cccc(B(O)O)c1	1797421397	IXMPGXBWJVNCIQ-BCDXTJNWSA-N	435.314	1.542	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(-c2ccccc2)no1	1798138807	CYNLZWPTHWANIA-RCJHGTSTSA-N	433.892	1.799	50	20	IDGD	
COc1cccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Br)c1F	1799352323	QGNAPBFJIYRLSY-ANGCBRKESA-N	433.249	1.728	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2)c1ccccc1-n1nccn1	1799670251	ASKCFDGKDQPFRT-ZSBFGKGUSA-N	448.321	1.256	50	20	IDGD	
N#CCc1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)cc1	1800542470	CXMPWPHZGMGDQB-BCDXTJNWSA-N	432.484	1.317	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(C)nc1OC)C2	1800642071	VBMXMXILJXCNMH-XRGAULLZSA-N	440.338	1.775	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)Br)C2	1800960790	JIZLYELZZYYQMJ-KLOLGFOXSA-N	443.338	1.115	50	20	IDGD	
CN1Cc2ccccc2C[C@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(Cl)Cl	1801015960	SKGVRRHUQDIESP-YVSFHVDLSA-N	426.344	1.436	50	20	IDGD	
Cc1ccc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Br)C3)c(C)n1	1801230896	KQVRLZUGTOLOMP-CYGHRXIMSA-N	442.329	1.911	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cn1nccn1)C2	1801440370	SXPSFBIKMNLLCW-FZBFXSHXSA-N	426.427	1.802	50	20	IDGD	
Cc1noc(C)c1CCC(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]1c1cccnc1	1803141337	MUDAZWFEEQNPBI-YVWKXTFCSA-N	434.924	1.925	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2cnc(N(C)C)o2)[C@H]1c1cccnc1	1805345685	IUGHZHCTAGBKEC-YQQAZPJKSA-N	435.912	1.709	50	20	IDGD	
CCOC(=O)/C=C/C(=O)N1CC[C@@H](CNC(=O)CCBr)[C@H]1c1cccnc1	1806339471	MPVADAMOTIIAEX-LBLGZAAXSA-N	438.322	1.992	50	20	IDGD	
CC(=O)N[C@H](C)C(=O)N1CC[C@@H](CNC(=O)CCBr)[C@@H]1c1cccnc1	1806346203	BLYAZAMCOSELPI-PVUWLOKVSA-N	425.327	1.397	50	20	IDGD	
COCCOCC(=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@@H]1c1cccnc1	1806760167	ZTHWBICUOAMQSE-NUEKZKHPSA-N	432.290	1.441	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCC2(CCCN(C(=O)C[C@H]3NC(=O)NC3=O)C2)CC1	1806849835	YZQAZKNNPJXKRJ-PXAZEXFGSA-N	433.336	1.052	50	20	IDGD	
Cc1[nH]ccc1C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1807375456	PFMCBYPYWRSUOS-WIYYLYMNSA-N	432.289	1.031	50	20	IDGD	
Cc1ccncc1C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1807375570	QBEJIUFSDXWYNH-UGKGYDQZSA-N	444.300	1.098	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2cnc3ncccn23)[C@@H]1c1cccnc1	1809333151	HJYCQOKRWAOGSE-RYRKJORJSA-N	442.907	1.698	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H](CNC(=O)CCc2nc(N)n[nH]2)[C@@H]1c1cccnc1	1810145892	DUJDLJUUFNONDW-PBHICJAKSA-N	433.944	1.686	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)[C@@H]2CC2(F)F)[C@H]1c1cccnc1	1810302588	LWSXZNYXRBZSMR-JQFCIGGWSA-N	444.442	1.055	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)c2ccc[nH]2)[C@@H]1c1cccnc1	1810619477	KOZNJQQGJUQQKP-FIAMHUAMSA-N	447.499	1.863	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)n2ccnn2)[C@H]1c1cccnc1	1812868804	MRMVZUVQLYMKTF-XRGAULLZSA-N	435.326	1.724	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@@H](CNC(=O)C[C@@](C)(O)CC(=O)O)[C@@H]1c1cccnc1	1813064581	ZNBCNZGGCSDXIN-UQASEVPWSA-N	439.940	1.968	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)Cc2ccsc2)[C@@H]1c1cccnc1	1813070451	GUIDTMGODOJTHK-PGRDOPGGSA-N	443.573	1.765	50	20	IDGD	
CC(C)O[C@H](C)C(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1813073390	LVBJROMYUATWLR-MMOPVJDHSA-N	433.553	1.274	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)C2CC(C)(C)C2)[C@H]1c1cccnc1	1813130086	VVANMEHOBQTDGE-DYESRHJHSA-N	429.565	1.897	50	20	IDGD	
COC(=O)NCC(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](C)CBr)n[nH]1	1814783962	YKTRBNDNMPZGSA-PWSUYJOCSA-N	430.303	1.789	50	20	IDGD	
Cc1cc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)c(C)o1	1816414636	AREBRIFFGMSUGE-LJQANCHMSA-N	436.277	1.919	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CC(C)(C)O)CC2	1817280361	UCMTZBYEFBFYOU-BTQGWNRHSA-N	446.533	1.350	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CC[C@H](N)C(N)=O)n[nH]1	1817358154	CABYPEVULPQGGM-GMXVVIOVSA-N	443.346	1.168	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCc2nc(N)n[nH]2)n[nH]1	1819286236	PALGJGYUVMUTCP-PIGZYNQJSA-N	443.339	1.971	50	20	IDGD	
CCO/C=C/C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819404401	IUZKAJICMUGMFZ-JCVNQNCUSA-N	427.465	1.264	50	20	IDGD	
CCn1nc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)cc1C	1819907570	IVZDQPWUVNGAIF-QGZVFWFLSA-N	444.540	1.613	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2c(F)cncc2F)n[nH]1	1819918210	PRJXHRSAIKCEGD-OAHLLOKOSA-N	449.462	1.762	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](O)CCl)CC2)c1nn[nH]c1C(F)(F)F	1821639612	UOGWQGFTRAVVCM-CAHLUQPWSA-N	438.819	1.106	50	20	IDGD	
O=C1C[C@H](C(=O)Nc2cc([C@H]3CCCCN3C(=O)CCBr)[nH]n2)CCN1	1822478025	FJWFJLKNZUBRJZ-DGCLKSJQSA-N	426.315	1.713	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H]2C[C@]2(F)Cl)n[nH]1	1822503970	IAAQHJPTJPQMJJ-BBEGDGIKSA-N	449.874	1.639	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H]1CCC(=O)NC1)CC2	1822857172	DBUVWJAMYCMGKD-YHTYYEMMSA-N	433.361	1.818	50	20	IDGD	
COC(=O)C1(C(=O)N[C@H]2CCc3nc(NC(=O)[C@@H](C)Br)sc3C2)CC1	1825647057	MOOVYODIBYPRBK-BDAKNGLRSA-N	430.324	1.792	50	20	IDGD	
C[C@H](C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2)n1cccc1	1826589046	SHPSUWGXNKDRBJ-CZUORRHYSA-N	438.318	1.111	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc4ccccn34)C2)C1	1830361842	GHZZUSQZWLWQCO-OAQYLSRUSA-N	434.924	1.669	50	20	IDGD	
CC[C@H](C)[C@H](O)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1	1831517012	LJWKFOZMVXVBEF-ZZCKCESHSA-N	425.353	1.086	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3ccco3)CCO2)C1	1833050644	APQNOYXSWPXFTH-RBUKOAKNSA-N	433.332	1.905	50	20	IDGD	
Cc1ccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)cn1	1833133532	IGHYADTZXRZFGR-BEFAXECRSA-N	440.338	1.172	50	20	IDGD	
CC(=O)N(C)[C@@H](C)C(=O)NC1CCN(C2CCN(C(=O)[C@H](C)Br)CC2)CC1	1835125394	PSKWCJWOHRLNBM-KBPBESRZSA-N	445.402	1.208	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc4cccc(C)c4[nH]3)CCO2)C1	1836856556	KPKWTPJLDNTNDH-HTAPYJJXSA-N	449.935	1.800	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccn4ccnc34)C2)C1	1837713044	DQKPXFWATZAGBL-NRFANRHFSA-N	446.580	1.256	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3c(F)cccc3F)C2)C1	1837714452	GZIKLCHKDIKTNK-HXUWFJFHSA-N	442.535	1.886	50	20	IDGD	
Cc1cnn(CC(=O)N2CCC(OC3CCN(C(=O)[C@H](C)Br)CC3)CC2)c1	1837979544	UXCIWTPKCHDVMX-HNNXBMFYSA-N	441.370	1.974	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C)n4ccnc4n3)C2)C1	1839148255	SLFALRPFVCJJLJ-YWZLYKJASA-N	435.912	1.125	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)ccn1	1839201132	WULCHWZBLFWILD-WMLDXEAASA-N	430.274	1.151	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccn(C)c3)C2)C1	1839963893	ZUWYNXFFHMZJCF-CRAIPNDOSA-N	428.327	1.269	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3CCC(O)CC3)C2)C1	1839967570	QKOKKFBTHYUMNM-YBSITQRDSA-N	447.370	1.167	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3c(C)nn(C)c3C)CCO2)C1	1840434518	DKEMYFMUIHGMIE-WIYYLYMNSA-N	440.972	1.443	50	20	IDGD	
Cc1cc(Cl)cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)c1	1840696470	SFCILCGDUKWDGF-QFBILLFUSA-N	431.316	1.318	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC12CN(C(=O)c1cncc(S(C)(=O)=O)c1)C2	1841286351	YEWVCJROBQYPFY-LBPRGKRZSA-N	444.351	1.333	50	20	IDGD	
Cn1c(=O)n(C)c2cc(C(=O)N3CC4(CCCN4C(=O)CCBr)C3)ccc21	1842638357	QAHMDFMOWUZSPR-UHFFFAOYSA-N	435.322	1.479	50	20	IDGD	
Cc1ccc(S(=O)(=O)CC(=O)N2CCCC23CN(C(=O)CO[Si](C)(C)C)C3)cc1	1842758460	MBBNEACTFGFCLA-UHFFFAOYSA-N	438.622	1.824	50	20	IDGD	
O=C([C@H]1C[C@H]1c1ccc(F)c(F)c1)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843010438	PVRKOFIAAWCTML-ROUUACIJSA-N	440.255	1.265	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)c2c[nH]c3nccc-3c2Cl)C1	1843286539	QZHWTLTYBJCYJK-UHFFFAOYSA-N	432.912	1.358	50	20	IDGD	
Cc1occ(C(F)(F)F)c1C(=O)N1CCCC12CN(C(=O)c1ccc(B(O)O)cc1)C2	1843533669	GKZITBDRWLFGKP-UHFFFAOYSA-N	436.195	1.417	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC2(CCCN2C(=O)Cc2ccncc2)C1	1845049098	CBGFNZWGTJWGPR-INIZCTEOSA-N	436.940	1.960	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)c2cnc3ccc(Cl)cc3c2)C1	1845610587	ZWQPOMJRRUBPLJ-UHFFFAOYSA-N	449.703	1.699	50	20	IDGD	
CCOC(=O)N(CC(=O)N1CCCC12CN(C(=O)[C@@H](O)CCl)C2)Cc1ccco1	1846529754	DUTZLCAFBDBLIC-HNNXBMFYSA-N	427.885	1.041	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)C(=O)c1ccc(Cl)cc1	1847544604	JBBQGJKZSFGNQB-IRXDYDNUSA-N	441.875	1.037	50	20	IDGD	
O=C(c1cn2ccc(C(F)(F)F)cc2n1)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl	1847561727	DISPOZIBHVMIHK-MELADBBJSA-N	430.814	1.768	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)CNS(=O)(=O)c2ccc(NC(C)C)c([N+](=O)[O-])c2)n1	14512538	HGLWLPOBEIEEFR-UHFFFAOYSA-N	437.482	1.244	50	20	IDGD	
CCOC(=O)N1CCC(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)CC1	15314842	ZHQRKACLSPSLJF-UHFFFAOYSA-N	431.537	1.215	50	20	IDGD	
CCOC(=O)NCCC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	46660665	GVQOEGBXPGJRHV-UHFFFAOYSA-N	448.501	1.062	50	20	IDGD	
O=C(C[C@H]1C(=O)Nc2ccccc21)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	116312306	JVKCBXAWLGXAAI-QGZVFWFLSA-N	442.497	1.358	50	20	IDGD	
Cc1cc(S(=O)(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)ccc1OCCCC(=O)O	726154843	BEPXJLLAXWJTPJ-UHFFFAOYSA-N	437.430	1.770	50	20	IDGD	
Cc1noc(CCNC(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)n1	726270819	GALHNYOSBBVDCM-UHFFFAOYSA-N	447.459	1.267	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2cccc(OC)c2)c1	727350042	QSHZADKWQQCGMD-UHFFFAOYSA-N	441.531	1.349	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@H](C(=O)NNC(=S)NCC3CCC3)C2)s1	727865995	JXCPYTPUNOYVLR-AWEZNQCLSA-N	430.621	1.753	50	20	IDGD	
Cn1nnnc1SCCC(=O)NNc1ccc(S(=O)(=O)Nc2ccccc2)cc1	728216823	IZLKAJMSEIMZBB-UHFFFAOYSA-N	433.519	1.636	50	20	IDGD	
CC[C@@H](C)C(=O)NNS(=O)(=O)c1ccc(S(=O)(=O)N2C[C@@H](C)C[C@@H](C)C2)cc1	728259517	FRSDPLOBTGKYPZ-QLFBSQMISA-N	431.580	1.709	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)N[C@H](CN1CCCC1)c1ccccc1	728959219	IHKRNWKWUBKCLX-HXUWFJFHSA-N	437.548	1.861	50	20	IDGD	
Cc1[nH]c2ccnn2c(=O)c1CC(=O)NNC(=O)c1ccc(Br)cc1Cl	729180547	XWBPSBFVQKMKIC-UHFFFAOYSA-N	438.669	1.751	50	20	IDGD	
Cn1c(=O)nc(O)c2c(C(=O)NNC(=O)Cn3ccc4ccccc43)cc(C3CC3)nc21	729451477	XJFXMVKTPGHLRK-UHFFFAOYSA-N	432.440	1.327	50	20	IDGD	
C[C@@]1(c2ccc(CNC(=O)NNC(=O)Cn3ccc4ccccc43)cc2)NC(=O)NC1=O	729612032	UMYUBEGDCNANQD-QFIPXVFZSA-N	434.456	1.227	50	20	IDGD	
CC(=O)N1c2ccc(S(=O)(=O)NNC(=O)Cn3ccc4ccccc43)cc2C[C@@H]1C	729667780	XHOWLRGNSHRHBE-AWEZNQCLSA-N	426.498	1.949	50	20	IDGD	
O=C(COc1ccccc1O)NNS(=O)(=O)c1ccc(Br)cc1[N+](=O)[O-]	730812297	NSMXZGMPDWVNKH-UHFFFAOYSA-N	446.235	1.451	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2ccc3c(c2)OCO3)nnn1-c1cccc2c1CCN(C)C2	731470172	RJPRZRQTVOMVHR-UHFFFAOYSA-N	434.456	1.367	50	20	IDGD	
COC(=O)c1ccc(CCC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1	731597852	UVANTXZTLXSHMN-UHFFFAOYSA-N	447.513	1.182	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2ccc3c(c2)C(=O)NC3=O)cc1Br	732234849	DTUKFAGBINGVGT-UHFFFAOYSA-N	433.218	1.808	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccccc1	732303635	KIIFLESAPXMTCN-QGZVFWFLSA-N	437.543	1.777	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(CNC(=O)NNC(=O)NCc2ccc(Cl)cc2)cc1	732992695	XDEMIFYCFRJXBW-UHFFFAOYSA-N	439.925	1.804	50	20	IDGD	
CNS(=O)(=O)c1cccc([C@@H](C)NC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c1	733647550	GFLAKQRQSSAECR-CQSZACIVSA-N	442.501	1.486	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NN=Cc2ccc(Br)cn2)cc1	733746557	SOOROOLRGODONQ-UHFFFAOYSA-N	425.308	1.923	50	20	IDGD	
O=C(NNC(=O)N1CCOCC1)c1ccn(-c2c(Cl)cc([N+](=O)[O-])cc2Cl)n1	736073101	ALQMUWVVPSCRHY-UHFFFAOYSA-N	429.220	1.774	50	20	IDGD	
CC(C)n1nc(C(=O)NNS(=O)(=O)CCOc2ccc(F)cc2)c2ccccc2c1=O	736419173	PUYULTMZBGDDPD-UHFFFAOYSA-N	448.476	1.760	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)CNC(=O)c2cccc([N+](=O)[O-])c2)cc1C	736736541	WKFXBPLCNXZLSL-UHFFFAOYSA-N	448.457	1.261	50	20	IDGD	
COc1cc(C(=O)N2CCN(C(=O)NNC(=O)COCc3ccccc3)CC2)ccc1C	738497248	PPQYJOYTZNDUKC-UHFFFAOYSA-N	440.500	1.719	50	20	IDGD	
O=C(COC(=O)[C@H]1CCCCN1Cc1ccccc1)NNC(=O)c1ccc([N+](=O)[O-])cc1	741354462	RJZAEELRUDMMER-LJQANCHMSA-N	440.456	1.954	50	20	IDGD	
Cc1cc(N2CCCS2(=O)=O)ccc1C(=O)NNC(=O)c1ccc2c(c1)OCCO2	741525768	XDJDHCUNHOKRCK-UHFFFAOYSA-N	431.470	1.381	50	20	IDGD	
C[C@@H](CC(=O)NN=c1sc2ccccc2n1C)/N=C1/NS(=O)(=O)c2ccccc21	742517047	XOQYCXVPGSPRKL-LBPRGKRZSA-N	429.527	1.689	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2cc(OC)ccc2Br)c[nH]1	743256347	AKGRZSLYJKOBTL-UHFFFAOYSA-N	432.252	1.196	50	20	IDGD	
CN(CCCNC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)C(=O)OC(C)(C)C	743604361	CALVCSVBVSPJPT-UHFFFAOYSA-N	443.526	1.683	50	20	IDGD	
N#Cc1ccnc(N2CCN(C(=O)NNC(=O)c3cccc(Br)c3)CC2)c1	743687956	SSRWNYNKCYUTBZ-UHFFFAOYSA-N	429.278	1.892	50	20	IDGD	
CC(=O)N1C[C@H](C(=O)NNC(=O)c2cc(Br)ccc2O)Oc2ccccc21	743731940	DMAPCTVDXXMYGM-MRXNPFEDSA-N	434.246	1.730	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)NCC2(O)CCS(=O)(=O)CC2)c(C)n1C[C@@H]1CCCO1	743756746	QTVHOWGJBALNDQ-MVDPLZLPSA-N	435.546	1.247	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)c2ccccc2c1=O	743901102	VRORQSMDZOBVBD-UHFFFAOYSA-N	429.477	1.342	50	20	IDGD	
CC(=NNC(=O)[C@@H]1COCCO1)c1ccc(S(=O)(=O)Nc2ccc(C(=O)O)cc2)cc1	745210527	DSTNNONXKBYUKJ-SFHVURJKSA-N	447.469	1.441	50	20	IDGD	
CCCN1CCC(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(CC)CC)c2)CC1	745866363	VZFZXNRAEVCNPT-UHFFFAOYSA-N	439.582	1.536	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(CC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)C1	746092118	DJABDEDCZSJZJG-UHFFFAOYSA-N	445.564	1.603	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@H](C(=O)NNC(=O)c2ccc(CSc3nncn3C)cc2)C1	746093370	PEBQYELRWOYBQN-JKSUJKDBSA-N	431.518	1.848	50	20	IDGD	
COC(=O)[C@H]1CCC[C@H](C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)C1	746093633	RMRLPPCQSFBAOE-HOCLYGCPSA-N	437.518	1.212	50	20	IDGD	
COc1cc(C)nc(NNC(=O)NCc2ccc(S(=O)(=O)N3CCCCC3)cc2)n1	746743498	MENGPVQJDJLPOI-UHFFFAOYSA-N	434.522	1.795	50	20	IDGD	
O=C(COC(=O)c1c(F)c(F)cc(F)c1F)NNC(=O)[C@@H]1COc2ccccc2O1	748218752	JYHOSWWPINAOAN-LBPRGKRZSA-N	428.294	1.387	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1ccc(C(N)=O)cc1)C(=O)NNc1ccc(OC(F)F)cc1	748661280	PYJJIWGCAZGAOW-SNVBAGLBSA-N	428.417	1.197	50	20	IDGD	
O=C(O)COc1ccc(S(=O)(=O)NNC(=O)c2cccc3cccnc23)cc1Cl	748694607	WVBMPGHZJGSYSJ-UHFFFAOYSA-N	435.845	1.975	50	20	IDGD	
O=C(NN=Cc1ccc(C(=O)O)[nH]1)c1cccc(S(=O)(=O)NCc2ccccc2)c1	749811573	CICQWTVZSOEINM-UHFFFAOYSA-N	426.454	1.955	50	20	IDGD	
CNS(=O)(=O)[C@@H]1CCN(C(=O)NNC(=O)c2ccc(Br)cc2Cl)C1	749818567	AFSWUCSTYHUGEJ-SECBINFHSA-N	439.719	1.080	50	20	IDGD	
CCCS(=O)(=O)N1CCCC[C@H]1C(=O)NNc1nc(Br)cn2ccnc12	750246429	LTUXDJVKQLAGCV-NSHDSACASA-N	445.343	1.529	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N[C@@H]2CC(=O)N(C(C)(C)C)C2)cc1Br	750663509	UROSWGFIGSXJIY-LLVKDONJSA-N	427.299	1.801	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H]2CCN(c3cccc(Cl)c3)C2)c1	751103501	QPFVJLZGXRPTMX-OAHLLOKOSA-N	436.921	1.966	50	20	IDGD	
CCOc1ccc(-c2noc(CCC(=O)NNC(=O)CNC(=O)c3ccco3)n2)cc1	751202273	QMAWERBFZFWPCK-UHFFFAOYSA-N	427.417	1.238	50	20	IDGD	
CC[C@H](C)C(=O)N1CCC[C@H](C(=O)NNC(=O)c2nn(CC)c(=O)c3ccccc23)C1	751291476	WFCAUBPXDCQOSV-GJZGRUSLSA-N	427.505	1.462	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)c(Br)c1	751293268	FQJFILAXDSVQIX-UHFFFAOYSA-N	441.307	1.826	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)c1cc(S(=O)(=O)N(C)C)oc1C	753276581	NGCYAHADOWFOLN-UHFFFAOYSA-N	433.490	1.212	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)NCCC(=O)NNc2ccc(C#N)c(Cl)c2)cc1	753524641	ZCVVYTXKQGNGAU-UHFFFAOYSA-N	435.893	1.982	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)[C@@H](c1cc(Cl)cc(Cl)c1)N1CCOCC1	753604988	IHJSZFDEKKUQNR-MRXNPFEDSA-N	445.347	1.819	50	20	IDGD	
CCCCCCOc1ccc(C(=O)NNC(=O)NC[C@H]2CCN(S(C)(=O)=O)C2)cc1	753671783	UIDSDWKXAWFWAT-MRXNPFEDSA-N	440.566	1.871	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)Cc2ccc(F)cc2)c(C)c([N+](=O)[O-])c1	753840345	JADHLDJBVZGRGU-UHFFFAOYSA-N	432.364	1.158	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)c3cccc(S(N)(=O)=O)c3C)n[nH]2)cc1	754475747	SOJXPZYGLFBWPO-UHFFFAOYSA-N	427.486	1.670	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)c([N+](=O)[O-])c1)c1ccc(S(=O)(=O)N2CCCC2)cc1	754843121	PQGVCJZMNOGFRE-UHFFFAOYSA-N	434.430	1.160	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1)Nc1cnns1	755336711	PPJJQWQGWTTXIT-UHFFFAOYSA-N	432.487	1.483	50	20	IDGD	
CCN(CCNC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)CCC(F)(F)F	755869577	QRQCTXYVGXIGEV-UHFFFAOYSA-N	428.415	1.152	50	20	IDGD	
Cn1cc(-c2nc3ccccn3c2NC(=O)NNC(=O)COc2ccc(C#N)cc2)cn1	757663942	KDFSCIZDBGTWLI-UHFFFAOYSA-N	430.428	1.838	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)N[C@H]2CN(C(=O)OC(C)(C)C)C[C@H]2C#N)cc1	758770406	LDXNTPJZYAZOCT-WBVHZDCISA-N	431.493	1.717	50	20	IDGD	
C[C@@H](NC(=O)OC(C)(C)C)[C@@H]1CCCN(C(=O)NNC(=O)CNC(=O)c2ccco2)C1	758861804	OCKQJDOUNGMDOX-ZIAGYGMSSA-N	437.497	1.375	50	20	IDGD	
COc1ccc(C(=O)NNc2ncccc2[N+](=O)[O-])cc1S(=O)(=O)NC1CCCC1	759303144	GYWMNUWBVQQIGW-UHFFFAOYSA-N	435.462	1.976	50	20	IDGD	
N#CC1=CCN(C(=O)c2cc(S(=O)(=O)N3CCOCC3)ccc2N2CCCCC2)CC1	760003223	IFJVOGAXRFHVAB-UHFFFAOYSA-N	444.557	1.994	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)c2ccc(Br)cc2-n2cncn2)c1O	760139599	UPYVVNIUKDBUCL-UHFFFAOYSA-N	432.234	1.819	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)c2ccc(I)c(O)c2)cc1	760799712	OYSGYHGTZQQVFB-UHFFFAOYSA-N	437.193	1.708	50	20	IDGD	
CC[C@@H](OC1CCCCC1)C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	761568395	QSWLUGQZBTYHCA-QGZVFWFLSA-N	439.582	1.589	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)CCNS(=O)(=O)c1ccc(F)cc1	761618672	HVEZSZXKXFCIPV-UHFFFAOYSA-N	441.506	1.442	50	20	IDGD	
Cn1ccc([C@H](NC(=O)NNC(=O)C(=O)Nc2ccccn2)c2ccc(Cl)cc2)n1	763159112	XFMITROLCMJBGF-MRXNPFEDSA-N	427.852	1.527	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNS(=O)(=O)c1c(Cl)nc2sccn12	763439963	ZDTUCHMXMHAPOW-UHFFFAOYSA-N	437.931	1.664	50	20	IDGD	
O=C(NNC(=O)c1ccccc1Br)C(=O)Nc1cnn(Cc2ccncc2)c1	763483404	RFFPBCDEIPVVRF-UHFFFAOYSA-N	443.261	1.489	50	20	IDGD	
COc1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)c1cc(OC)c(OC)c(OC)c1	763540482	VVAIXRMBBKQXIM-UHFFFAOYSA-N	437.836	1.774	50	20	IDGD	
CN1CCN(c2ccc(NC(=O)C(=O)NNC(=O)c3ccccc3F)cc2Cl)CC1	763568200	FJNWGEHLKJMDPG-UHFFFAOYSA-N	433.871	1.631	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)[nH]n1)C(=O)Nc1ccccc1O[C@H]1CCOC1	763603584	DNZRELVUFFGDQY-HNNXBMFYSA-N	435.440	1.644	50	20	IDGD	
CC(=O)N(Cc1ccc(NC(=O)C(=O)NNC(=O)c2c(C)nc3ccccn23)cc1)C1CC1	763628460	KSWCLTXXTMVODB-UHFFFAOYSA-N	448.483	1.553	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2cccc(N3CCOC3=O)c2)c1	763646668	GXTPJSULLKNSRM-UHFFFAOYSA-N	426.429	1.425	50	20	IDGD	
CN(C)c1ccc(C(F)(F)F)cc1NC(=O)C(=O)NNC(=O)COc1ccc(C#N)cc1	763673536	GKYXOTZJVKDWNS-UHFFFAOYSA-N	449.389	1.808	50	20	IDGD	
CN1CCc2ccc(NC(=O)C(=O)NNC(=O)COc3ccc(Br)cc3)cc21	763695586	PVNDRHIQOZVJAN-UHFFFAOYSA-N	447.289	1.606	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccn(-c3cccc(F)c3C#N)n2)c1	763754816	VJDPMONFEZJJQB-UHFFFAOYSA-N	435.419	1.349	50	20	IDGD	
Cc1ccc(N2CCOC2=O)cc1NC(=O)C(=O)NNC(=O)Cc1c[nH]c2ccccc12	763865942	XUNWVOYUDWLGIQ-UHFFFAOYSA-N	435.440	1.762	50	20	IDGD	
COc1cc(OC)c(OC)cc1NC(=O)C(=O)NNC(=O)CSc1ccc(C)cc1	763898314	PUVJDSQNGXOYJD-UHFFFAOYSA-N	433.486	1.899	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(CC(=O)OC)cc2)cc1OC	763902945	ZLCFEWWUQNWMHY-UHFFFAOYSA-N	429.429	1.209	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cnn(C[C@@H]3CCCO3)c2)ccc1OC(C)C	763916371	NZSBMNHXJCNRFD-INIZCTEOSA-N	445.476	1.258	50	20	IDGD	
O=C(NNC(=O)c1cc2c(s1)CCCCC2)C(=O)Nc1cnn(C[C@H]2CCCO2)c1	763961486	GHJFJEAFCFDNLK-OAHLLOKOSA-N	431.518	1.792	50	20	IDGD	
Cc1cccc(COc2cccc(NC(=O)C(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)c2)c1	764002436	MIASVSBNUJZOJL-INIZCTEOSA-N	445.497	1.095	50	20	IDGD	
C[C@@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3cc(-c4ccccc4)on3)cc2)CCO1	764017470	YLRNVDBWFKSTOD-OAHLLOKOSA-N	449.467	1.966	50	20	IDGD	
CCNC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)Cc2cccc3ccccc23)cc1	764028095	JFSWVGVBXVCAEP-UHFFFAOYSA-N	448.479	1.683	50	20	IDGD	
COC(=O)CSCc1cccc(NC(=O)C(=O)NNC(=O)c2ccccc2OC)c1	764042883	NCAUPAHPELNUJU-UHFFFAOYSA-N	431.470	1.501	50	20	IDGD	
Cc1cc(=O)n(C)cc1NC(=O)C(=O)NNC(=O)c1ccc(Br)cc1Cl	764059316	RRTHBAVCEPFZBE-UHFFFAOYSA-N	441.669	1.509	50	20	IDGD	
COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccc(C)cc2)[nH]n1	764110872	MIQJJPOWHVZMBL-UHFFFAOYSA-N	438.400	1.702	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2cccc(N3CCCNC3=O)c2)cc1	764126148	FXFVGEDCGOIMDM-UHFFFAOYSA-N	439.472	1.334	50	20	IDGD	
Cc1ccc(S(C)(=O)=O)cc1NC(=O)C(=O)NNC(=O)c1ccc(Cl)cc1O	764126338	HZSKMLVGXZYYOO-UHFFFAOYSA-N	425.850	1.157	50	20	IDGD	
COC(=O)CCCOc1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)cc1	764153601	MGCUGRQBGIEMIN-SFHVURJKSA-N	441.440	1.108	50	20	IDGD	
CC(=O)N(Cc1ccc(NC(=O)C(=O)NNC(=O)CCc2ccccc2O)cc1)C(C)C	764288945	OQDIBMJZDDTYBU-UHFFFAOYSA-N	440.500	1.868	50	20	IDGD	
O=C(NNC(=O)c1cc2ccccc2o1)C(=O)Nc1ccccc1C(=O)N1CCOCC1	764330701	GSXCSIGOQOTEHA-UHFFFAOYSA-N	436.424	1.305	50	20	IDGD	
COc1ccc(C(=O)NCC(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)cc1OC	764332982	CCHJACCQAWDAET-UHFFFAOYSA-N	448.426	1.747	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)Cc2ccncc2)cnc(Cl)c1Br	764352972	GDHLYXDQDZPXGN-UHFFFAOYSA-N	426.658	1.530	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2cc(F)cc(F)c2OC)n[nH]1	764376560	FPAMCZLATNVIRF-UHFFFAOYSA-N	445.382	1.772	50	20	IDGD	
Cc1nn(-c2ccccc2)cc1NC(=O)C(=O)NNC(=O)C(F)(F)Oc1ccccc1	764379289	VGQLEMNLWZVKAP-UHFFFAOYSA-N	429.383	1.938	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1cnn(Cc2ccncc2)c1	764392714	KHRMHEDKDUDCME-UHFFFAOYSA-N	440.485	1.213	50	20	IDGD	
CCc1cc(N2CCC[C@H](NC(=O)NNC(=O)CSc3ccccc3O)C2)ncn1	764407978	GCAMWABNXPCUGL-HNNXBMFYSA-N	430.534	1.836	50	20	IDGD	
COc1nccnc1NNC(=O)CC1(CC(=O)NNc2nccnc2OC)CCCC1	764485356	VIKQLOANRDNDRA-UHFFFAOYSA-N	430.469	1.211	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NN=Cc3cc(F)ccc3F)CC2)cc1	764816817	CXJQXGYORBOJEX-UHFFFAOYSA-N	436.484	1.730	50	20	IDGD	
C=CCNS(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)c1	765567520	GQRPSDIHIWJHDH-UHFFFAOYSA-N	431.499	1.677	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)[C@H]3Cc4ccccc4C(=O)O3)n[nH]2)cc1OC	765597486	HDYFPVTXNNDUFS-LJQANCHMSA-N	436.424	1.637	50	20	IDGD	
COc1cccc(OC)c1CC(=O)NNC(=O)CN1CCN(Cc2ccc(C)cc2)CC1	765754858	OIVNKLUKOPFLJS-UHFFFAOYSA-N	440.544	1.520	50	20	IDGD	
O=C(CCC(=O)Nc1ccc2nc(O)[nH]c2n1)NNC(=O)CSc1ccc(Cl)cc1	767164627	PXHPNTWXZWHIJE-UHFFFAOYSA-N	448.892	1.975	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)C(=O)Nc1cnc(Cl)c(Br)c1	768239299	YITJUSLXOZMRHX-UHFFFAOYSA-N	429.633	1.965	50	20	IDGD	
O=C(CCOc1ccccc1)NNC(=O)C(=O)Nc1cc(C2CC2)nn1-c1ncccn1	768240403	WDAFYGSUIMPSQS-UHFFFAOYSA-N	435.444	1.095	50	20	IDGD	
O=C(CCn1cnc2ccc(Br)cc2c1=O)NNC(=S)Nc1ccccn1	768584728	WIYIGOROFWRICJ-UHFFFAOYSA-N	447.318	1.962	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)F)cc1)Nc1cc(-n2cnnn2)ccc1F	770015457	YJGNLDSQTSYPKZ-UHFFFAOYSA-N	427.368	1.946	50	20	IDGD	
Cn1c(=O)n(C)c2cc(NC(=O)C(=O)NNc3ccc(Br)c(F)c3)ccc21	770816380	WUEALYILHVNXAV-UHFFFAOYSA-N	436.241	1.860	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)CSc3nnnn3C3CCCC3)nc21	770967154	DPJVDCRJQMZBEF-UHFFFAOYSA-N	432.514	1.624	50	20	IDGD	
COc1cc(C(C)=NNC(=O)C(=O)NCc2ccc(Cl)cc2)ccc1S(C)(=O)=O	771567843	MAMFLDGCOMREPJ-UHFFFAOYSA-N	437.905	1.909	50	20	IDGD	
CCc1ccc(N2C[C@H](C(=O)NNC(=O)C(=O)NCc3ccc(Cl)cc3)CC2=O)cc1	772188714	SYPANOHFJBSTGI-MRXNPFEDSA-N	442.903	1.719	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNS(=O)(=O)c1ccc(OCC(F)(F)F)nc1	777906638	DEELMUHIQRLUMI-UHFFFAOYSA-N	449.407	1.810	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)[C@H]2CC(=O)N(c3cc(OC)cc(OC)c3)C2)nc1C	778422244	XTFORRBCDGNJOF-ZDUSSCGKSA-N	443.460	1.475	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCOC[C@@H]2c2noc(C(C)C)n2)cc1OC	779633193	UYHGPELWUYFRKG-CQSZACIVSA-N	433.465	1.045	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNS(=O)(=O)c1ccc(C(F)(F)F)cc1F	780383424	XTWKYTZBDYGEII-UHFFFAOYSA-N	425.385	1.646	50	20	IDGD	
COC[C@@H](CNC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1)OC	781396308	LNFWXWZZUZRGJV-GFCCVEGCSA-N	442.519	1.154	50	20	IDGD	
CCC1(C(=O)NNC(=O)CCN2C[C@H](C)O[C@@H](C)C2)CCN(C(=O)c2ccccc2)CC1	781415071	DTJHPRGEGKEMGU-OALUTQOASA-N	444.576	1.966	50	20	IDGD	
Cc1c(/C=C(\C#N)C(=O)N2CCC[C@@H](S(=O)(=O)NC3CCCC3)C2)cc(C#N)n1C	781524241	SAWMQALAQPNNAY-OTJDAXFFSA-N	429.546	1.965	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)[C@H]2CN(C)C(=O)c3ccccc32)c2ccccc2c1=O	781866314	MBBBUFFIUSVMTP-SFHVURJKSA-N	433.468	1.437	50	20	IDGD	
Cn1ncc(NC(=O)C(=O)NNC(=O)c2cccc(Br)c2)c1C(F)(F)F	782117919	UNLDLJAFYGSJOT-UHFFFAOYSA-N	434.172	1.601	50	20	IDGD	
COC(=O)c1cc(Br)ccc1NC(=O)C(=O)NNc1ncncc1Cl	782159778	VJDDIXSRFIEMBP-UHFFFAOYSA-N	428.630	1.761	50	20	IDGD	
O=C(NNc1ncncc1Cl)C(=O)Nc1ccnn1Cc1cnn(-c2ccccc2)c1	782165052	BZLQLFIQNIHWEE-UHFFFAOYSA-N	437.851	1.642	50	20	IDGD	
CC(C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)cc1	782888345	WMZQFEGKSALQOT-UHFFFAOYSA-N	436.472	1.040	50	20	IDGD	
O=C(CN1c2cccc3cccc(c23)S1(=O)=O)NN=Cc1cn(Cc2cccnc2)nn1	783816434	LTRFYSPGBYEARS-UHFFFAOYSA-N	447.480	1.534	50	20	IDGD	
CC(C)COc1ccc(NC(=O)C(=O)NNC(=O)CNC(=O)c2ccco2)cc1Cl	784001728	CKPWMQXMEZTXHN-UHFFFAOYSA-N	436.852	1.484	50	20	IDGD	
CNC(=O)c1cc(NC(=O)C(=O)NNc2ccc(Br)cn2)ccc1Cl	784340925	SQTGZSGFHREWHP-UHFFFAOYSA-N	426.658	1.939	50	20	IDGD	
Cc1c(NNC(=O)C(=O)Nc2ccc(C(=O)NC3CCOCC3)cc2)cccc1[N+](=O)[O-]	784350397	GNBBKNPTMXNPEC-UHFFFAOYSA-N	441.444	1.894	50	20	IDGD	
NC(=O)CCOc1ccccc1NC(=O)C(=O)NNc1ccc(F)cc1Br	784802896	TZGXFFUSSATGHD-UHFFFAOYSA-N	439.241	1.924	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)C(=O)Nc2ccc(N3CCCC3=O)c(OC)c2)c1	784852147	RGJPMUXTNPZOKF-UHFFFAOYSA-N	426.429	1.690	50	20	IDGD	
O=C(NNc1ncc(F)cn1)C(=O)Nc1ccc(CC(=O)N2CCc3ccccc32)cc1	784957684	PSEQSNXCPSDNQA-UHFFFAOYSA-N	434.431	1.829	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc(-n4nccn4)cc3)n[nH]2)c1	785130538	UCFJIVMEFYKCIH-UHFFFAOYSA-N	444.455	1.674	50	20	IDGD	
O=C(NNc1nc(C(F)(F)F)cs1)C(=O)Nc1ccccc1CN1C(=O)CCC1=O	785147504	KXMXPPNKJOASTH-UHFFFAOYSA-N	441.391	1.893	50	20	IDGD	
COC(=O)CS(=O)(=O)Cc1ccc(CNC(=O)/C(C#N)=C\c2ccc(O)cc2)cc1	787429326	WLQHEYGPHMYNPY-ZDLGFXPLSA-N	428.466	1.703	50	20	IDGD	
COc1ccc(OC)c([C@H]2C[C@@H]2C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c1	788203409	XRJSKJPNQIVAOI-WBVHZDCISA-N	443.412	1.720	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1ccnc(Oc2ccc(F)cc2F)c1	789740052	SNOPOMLYJDJZDZ-NSHDSACASA-N	438.387	1.290	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)C(=O)Nc1nc2c(s1)CCCCC2	789756715	HPPUIORQXWAMHF-UHFFFAOYSA-N	449.558	1.935	50	20	IDGD	
Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)NNC(=O)CNC(=O)c1cccnc1	791055554	WOXPPOROWYHKEP-UHFFFAOYSA-N	436.222	1.252	50	20	IDGD	
COC(=O)c1nn(C)c(C)c1/C=C(\C#N)C(=O)Nc1cc2c(cc1[N+](=O)[O-])OCCO2	792866293	LLUFDUSFTUPZTA-IZZDOVSWSA-N	427.373	1.740	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NN=C[C@@]23C[C@@H]2CN(C(=O)OC(C)(C)C)C3)c1	792901874	YRZRDDOVPJDDLF-FOIQADDNSA-N	436.534	1.910	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N2C[C@@H](C)O[C@@]3(CCOC3)C2)cc1Br	792932111	LWDACGFSGMOADH-DIFFPNOSSA-N	428.283	1.692	50	20	IDGD	
COc1c(NC(=O)C(=O)NN=c2sc3ccccc3n2C)cc(Cl)cc1C(N)=O	793036123	JYMIOQGINXEPPN-UHFFFAOYSA-N	433.877	1.571	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)[C@@H](O)[C@H](O)c2nc3ccccc3s2)cc1	794717601	QPEJRUWHVKRDAI-HOTGVXAUSA-N	436.515	1.084	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)N1CCNC(=O)[C@H]1c1ccc(Br)cc1	796577904	ZHNHMDSJAQHNMR-BLLLJJGKSA-N	425.327	1.504	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)C(=O)Nc2cc(C(F)(F)F)ccc2Br)cn1	797006267	JHIVOIGVMZDZKP-UHFFFAOYSA-N	434.172	1.601	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2oc3ccccc3c2CS(C)(=O)=O)cc1	801109340	JVAYIWQEDPMSPT-UHFFFAOYSA-N	429.454	1.686	50	20	IDGD	
CN(C1CCCCC1)S(=O)(=O)c1cccc(C(=O)NNC(=O)N=c2cc[nH]cc2)c1	802025941	JJSQQSFDNQFCHR-UHFFFAOYSA-N	431.518	1.923	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](n2cc(C(=O)NNC(=O)N=c3cc[nH]cc3)cn2)C1	802035484	HYKULOJSEVZOBI-MRXNPFEDSA-N	429.481	1.739	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)c1occ2c1CCOC2	802762461	HRAOMZDEFBMMKK-UHFFFAOYSA-N	432.908	1.585	50	20	IDGD	
COC(=O)[C@]1(C(F)(F)F)CCN(C(=O)NNC(=O)c2cc(Br)c[nH]2)C1	804869573	VLFASFKLRCAIOB-LBPRGKRZSA-N	427.177	1.559	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NCCn2cc(Br)cn2)cc1	805838103	KOOPLLNQZWXPAG-UHFFFAOYSA-N	445.299	1.085	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)Nc1ccc(F)c(N2C(=O)CCC2=O)c1	806743494	FOSKFVFGNGWDGJ-UHFFFAOYSA-N	430.392	1.719	50	20	IDGD	
O=C(COc1cccc(C(F)(F)F)c1)NNC(=O)C(=O)Nc1cccc2c1CNC2=O	806973177	CKEFZGKNGVHXDI-UHFFFAOYSA-N	436.346	1.114	50	20	IDGD	
N#Cc1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2F)cc1Br	806974022	QALMSIKSTUDGRR-UHFFFAOYSA-N	435.209	1.625	50	20	IDGD	
CC(C)COC(=O)Nc1cccc(NC(=O)C(=O)NNc2ccc(-n3ccnc3)nn2)c1	807429291	RNKWCBSLMCAKHK-UHFFFAOYSA-N	438.448	1.949	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCC2(c3ccccn3)CCC2)cc1	807534080	LNVOOHRCANOPKQ-UHFFFAOYSA-N	445.545	1.463	50	20	IDGD	
CC(=O)Nc1ncc(S(=O)(=O)NNC(=O)c2cc(F)ccc2Br)s1	808089345	QKQGHNBADAMGGK-UHFFFAOYSA-N	437.272	1.626	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2cncnc2-c2ccccc2)ccc1Cl	809982350	CWVIBSUBRDVFBO-UHFFFAOYSA-N	431.861	1.519	50	20	IDGD	
N#Cc1ccc(NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc1F	810253128	MJYDCKKMDCQUEV-UHFFFAOYSA-N	431.449	1.948	50	20	IDGD	
CSCc1cccnc1C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	810413642	ISWIPHWDZVTYND-UHFFFAOYSA-N	436.563	1.033	50	20	IDGD	
CC[C@]1(CNC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)OCCc2ccccc21	812491518	AVAZPYKZRCLBLX-HSZRJFAPSA-N	435.484	1.756	50	20	IDGD	
Cc1cc(Cl)cnc1NC(=O)C(=O)NNC(=O)c1cc(Br)ccc1O	812980300	ORFMGGOZTSVDIJ-UHFFFAOYSA-N	427.642	1.911	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)N[C@@H]3CC34CCN(C(=O)OC(C)(C)C)CC4)nc21	813802518	MVEDRXPFSODTQL-GFCCVEGCSA-N	432.485	1.485	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCc2nncn2C1)C(=O)Nc1ccc(F)cc1OC1CCCC1	815691203	IGTPQCIDEKNUIZ-LBPRGKRZSA-N	430.440	1.087	50	20	IDGD	
Cn1nncc1NNC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(Br)s2)C1	816771690	WSGPASLMZWLENN-SECBINFHSA-N	449.356	1.183	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2Cl)c1	816810195	CMZQCMPVBKZNCF-UHFFFAOYSA-N	426.838	1.573	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2cnn3c2OCCC3)ccc1OCCC(C)C	821132368	ORHYCCJZSJTXRJ-UHFFFAOYSA-N	438.506	1.722	50	20	IDGD	
COCCNS(=O)(=O)c1cccc(C(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)c1	913055332	SBMSVJXHXUOWHZ-UHFFFAOYSA-N	435.546	1.589	50	20	IDGD	
CC(C)(C)C(=O)N1CCC[C@@H]1C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	914708314	UNBWZVWTPVDUEW-LJQANCHMSA-N	429.565	1.383	50	20	IDGD	
O=C(CNS(=O)(=O)c1cccs1)NNC(=O)Cc1nc(-c2ccccc2)cs1	915193493	CGMPEGMIGZURRL-UHFFFAOYSA-N	436.540	1.540	50	20	IDGD	
O=C(NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)N[C@H]1CCN2CCCC[C@H]12	916638384	FFFTUYGAXKJYER-ZWKOTPCHSA-N	435.550	1.042	50	20	IDGD	
CCNC(=O)c1cccc(CNC(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)c1	916645019	MKAVIOHQKDDYPW-UHFFFAOYSA-N	434.522	1.344	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)NCCS(=O)(=O)NCc2ccccc2)cc1	916645446	WCGFMPIJTQZYRB-UHFFFAOYSA-N	436.559	1.537	50	20	IDGD	
COc1cc(C=NNC(=O)[C@@H](C)CN2CCOCC2)c([N+](=O)[O-])cc1OCC(F)(F)F	921256003	JFHOBERBTXHALK-LBPRGKRZSA-N	448.398	1.963	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)[C@H](Cc2ccccc2)NC(=O)c2cccnc2)cc1	921301270	UQIICXADTNMJMO-NRFANRHFSA-N	432.480	1.958	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)NCc1ccccc1NS(C)(=O)=O	1317894970	XNTMMJBEYCNDTH-UHFFFAOYSA-N	436.490	1.366	50	20	IDGD	
Cc1nccn1-c1ncccc1CNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1	1318267653	LBHZRUOLEKCEKO-UHFFFAOYSA-N	435.492	1.113	50	20	IDGD	
Cc1ccc(S(C)(=O)=O)cc1C(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1	1318566882	PIUXKJFKIPXGMI-UHFFFAOYSA-N	439.534	1.807	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)NCc2ncnn2-c2ccccc2)CC1	1321180268	UOWMFTGIKOYELQ-UHFFFAOYSA-N	443.508	1.745	50	20	IDGD	
Cc1ccc(-n2cnnc2)c(C(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)c1	1321281217	JPPBZLXTJXMKSK-UHFFFAOYSA-N	428.493	1.984	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Nc2ccccc2S(=O)(=O)N1)Nc1ccc(Br)cc1	1340042283	ADXNYBVETBZLAD-CYBMUJFWSA-N	440.279	1.332	50	20	IDGD	
Cc1cnc2c(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)C(Cl)Cl)C4)cnn2c1	1779023620	NQGTXMZTYCIQGM-AUUYWEPGSA-N	440.331	1.969	50	20	IDGD	
C[C@H](C(=O)N1CC[C@]2(CN(C(=O)C(Cl)Cl)CCO2)C1)N1CSCSC1	1779150136	UNQWRZDYNNNSCU-IAQYHMDHSA-N	428.407	1.663	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](C)n3ccccc3=O)C2)C1	1779265579	WVXURZIYMLZVJQ-VCBZYWHSSA-N	440.338	1.270	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C2(Br)CC2)C1	1780784339	FZLLFCOQAOBHFR-WOSRLPQWSA-N	437.762	1.682	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](C)N(C)C(=O)OC(C)(C)C)C2)C1	1781041989	ZDMAMDLBEOYOHB-QEEYODRMSA-N	447.960	1.326	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)CCc3ccc(O)nn3)CCO2)C1	1781233715	YRNULGCCOYFISH-MSOLQXFVSA-N	431.320	1.181	50	20	IDGD	
Cc1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](O)CCl)C3)cc2c[nH]nc12	1781245745	KFMHUTRVXDYNTD-CBGDNZLLSA-N	434.924	1.599	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Cl)C2)[C@@H]1CC(c2ccccc2)=NN1	1781449862	VANHMPFYKOLMHO-TWFHAPMSSA-N	436.915	1.801	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(F)c(C)n1)C2	1782170909	FSADZKMCLRQJOG-JNAXZKDPSA-N	427.904	1.910	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(CCN(C(=O)[C@H]3CC(c4ccccc4)=NN3)C2)C1	1782601012	GAIFJXDBTZYZKW-KNQAVFIVSA-N	444.608	1.434	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2	1782708895	YJVXGCWKJFLURZ-OAUYIBNBSA-N	425.309	1.614	50	20	IDGD	
NC(=O)c1ccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)C(Cl)Cl)C3)cc1	1782866105	MKAOCFDPKMEACQ-AUUYWEPGSA-N	428.316	1.717	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3snnc3C3CC3)CCO2)C1	1783534356	ICRMKDAAQZGGIJ-MGPLVRAMSA-N	429.340	1.642	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc(C)nc3)[C@H]2C1	1785836678	NAXSBGDRKTUNIJ-HNKHHVNMSA-N	425.327	1.552	50	20	IDGD	
CC(=O)O[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCBr)[C@H]2C1)C(C)C	1786406832	JKKNIMUJZNHJTI-QBYUYEEZSA-N	433.343	1.339	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCBr)[C@H]3C2)nc1	1786406975	LAHFQYBKBLQJQV-NOLJZWGESA-N	426.311	1.469	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC1(c2ccc(NC(=O)C[C@H]3NC(=O)NC3=O)cc2)CCC1	1786762907	ZQPWRPIADNSIAK-FZKQIMNGSA-N	441.315	1.955	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4c(n3)NC(=O)CC4)[C@H]2C1	1787267009	OHGYCHLZFQYXCA-JKQORVJESA-N	434.924	1.577	50	20	IDGD	
COc1cc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]3C2)ccc1[N+](=O)[O-]	1787448607	BMTRPRATPLGMOT-YFPWBOGZSA-N	443.859	1.660	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3snnc3C3CC3)[C@H]2C1	1787740428	CWXWCXUOBCUKNM-BQUFFADESA-N	443.367	1.792	50	20	IDGD	
Cn1ncc2c(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)C(Cl)Cl)C[C@@H]43)cccc21	1788067131	AOCYQRHNFAWSFC-PJODQICGSA-N	425.316	1.970	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Cl)C[C@@H]32)C1	1788180748	JUQRQOQRTJQTQQ-QXKUPLGCSA-N	447.935	1.758	50	20	IDGD	
CNc1nsnc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]2C1	1789867397	ATBMYVVIXARTFT-YPIXOSSWSA-N	436.365	1.409	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cnc4ccccn34)C[C@@H]21	1791248826	ASVLGIUZZYIQFM-OWLYRPNTSA-N	434.924	1.110	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3n[nH]c4c(C)cccc34)C[C@@H]21	1791256739	GOGDEIHXIADNPB-HJWJTTGWSA-N	434.924	1.718	50	20	IDGD	
CN1Cc2ccccc2C[C@@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(C)(C)CCl	1792782058	AHAJPSZSVYZTAR-IYWMVGAKSA-N	433.980	1.898	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Nc1nccs1)C2	1792867542	CSNRZTUXUMVMPE-VJTDZRGJSA-N	445.383	1.564	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cn(C)nc1C(F)F)C2	1792867975	MFJKMIHSYGPOAB-KQXIARHKSA-N	449.296	1.592	50	20	IDGD	
C[C@@H](Cn1cccn1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)CBr	1792869838	BUDPHIYWJFBANX-GVRJEKJASA-N	427.343	1.140	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1(c3ccc(Cl)cc3)CCC1)C2)[C@@H](O)CCl	1792983188	COIUQCOGBTWFIW-DACLVMHWSA-N	441.355	1.951	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CNC(=O)OC(C)(C)C	1793011332	BNPQFUUBNCCYFO-HPCHECBXSA-N	448.358	1.294	50	20	IDGD	
CC(=O)N[C@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCl)c1ccc(F)cc1	1793115373	LRPLWASDMYYWEQ-ILOCAZANSA-N	425.888	1.241	50	20	IDGD	
CCc1nn(C)c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCBr)C3)c1Cl	1794423500	JTKWQLLMPYUMRH-QHBPRCKVSA-N	447.761	1.624	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccco1	1794614558	RAHBPHGINXHJBO-FQLMCAECSA-N	441.912	1.615	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2cccn2cn1	1797101552	GDHLYUFPNUVFSW-UESRRSCYSA-N	425.316	1.774	50	20	IDGD	
CN(C)c1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)C(Cl)Cl)C3)c1	1798539615	JSCWFVIGRNMGRY-QHBPRCKVSA-N	445.303	1.668	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(=O)nc3cccnn13)C2	1798626937	ASFWJHJOAVAETJ-QDMKHBRRSA-N	429.553	1.193	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(=O)nc2cccnn12	1799189327	OIARBTIUIUHIGD-RJAOAUJVSA-N	438.315	1.578	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3nn[nH]c3c1)C2	1799279865	VSPHDWCFPWCZJY-TYYYEBLRSA-N	426.304	1.397	50	20	IDGD	
COc1ccc(C)c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)Br)C3)c1	1799638703	KMGBXYAUYFZMCE-ZJOBFFGXSA-N	425.323	1.990	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(C(N)=O)cc1)C2	1800644159	LBMCAQYHLXVMES-QKPAOTATSA-N	438.322	1.162	50	20	IDGD	
C[C@H](Sc1ccccc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCC(=O)NN(C)C	1801010547	FSBGGXSAIDLKRG-OPOADAIRSA-N	448.589	1.130	50	20	IDGD	
Cc1ccc(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CCC(=O)NN(C)C)cc1[N+](=O)[O-]	1802338017	MCPFXNCZNPZUIV-BCDXTJNWSA-N	445.520	1.457	50	20	IDGD	
COCCOCCOCCOCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C(Cl)Cl	1802347241	IMCHVFJLNICZTA-QDMKHBRRSA-N	441.352	1.125	50	20	IDGD	
CC(C)(C)OC(=O)N1C(=O)CC[C@@H]1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](O)CCl)C2	1802617101	JLMKIEKTYPVIMZ-XLWJZTARSA-N	443.928	1.150	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccn(C(F)F)n2)[C@H]1c1cccnc1)[C@H](O)CCl	1803141147	LJPRWQRRHHEZQZ-CFVMTHIKSA-N	427.839	1.593	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]1c1cccnc1	1803146946	FHJJHXZAQIHHFX-HLLBOEOZSA-N	440.928	1.212	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)[C@@H](C)CS(C)(=O)=O)[C@H]1c1cccnc1	1803587598	HZYORIMNCAFXEJ-PQEBFOHHSA-N	445.969	1.022	50	20	IDGD	
C[C@H](CS(C)(=O)=O)C(=O)NC[C@H]1CCN(C(=O)C(Cl)Cl)[C@H]1c1cccnc1	1803591768	XLZIBYFJRHOPAY-BNOWGMLFSA-N	436.361	1.572	50	20	IDGD	
CCC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](O)CCl)C2	1804378562	FLTHVZKMOIEXJF-JKJDWNRSSA-N	431.961	1.918	50	20	IDGD	
O=C(CCBr)NC[C@H]1CCN(C(=O)c2ccc[n+]([O-])c2)[C@@H]1c1cccnc1	1806339091	IUIKFKJFXYAPET-CRAIPNDOSA-N	433.306	1.820	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)C2=CCCS2)[C@@H]1c1cccnc1	1813067922	HJXVYMUCXWNXPW-OXJNMPFZSA-N	431.562	1.481	50	20	IDGD	
O=C(CCn1ccnn1)NC[C@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1	1813432538	ZGVLKKZGRDOFBX-QAPCUYQASA-N	435.326	1.554	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2CC[C@H]3CCC(=O)N3C2)[nH]n1)[C@@H](O)CCl	1814872418	JTZYOMICPRJACB-VRKREXBASA-N	437.928	1.403	50	20	IDGD	
O=C(CN1CCOC1=O)Nc1cc([C@@H]2CCCCN2C(=O)CCBr)[nH]n1	1815023827	PNOBQHQKKVQKHQ-LBPRGKRZSA-N	428.287	1.639	50	20	IDGD	
CCCNC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](Cl)COC)[nH]n1	1815114098	PIQCUJIZTLMIKX-DZGCQCFKSA-N	427.933	1.962	50	20	IDGD	
CCC[C@@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN(C)C(=O)C(=O)O)[nH]n1	1815322002	GHTSVTILUKRPPP-YPMHNXCESA-N	427.889	1.352	50	20	IDGD	
O=C(C[C@H]1CCCCO1)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1815603291	NUUSJEPCLQHECC-MJGOQNOKSA-N	440.309	1.355	50	20	IDGD	
O=C(CC(F)(F)C(=O)O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](F)Br)CC2	1817096355	MQMJJCUEYZPUCY-MLUIRONXSA-N	444.229	1.856	50	20	IDGD	
O=C(/C=C1\C(=O)Nc2ccccc21)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](O)CCl)CC2	1819617521	FVHHVVDBLJBOCE-XIYDOYHKSA-N	446.916	1.691	50	20	IDGD	
Cc1cc(C(=O)NCC(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@@H](F)Cl)CC3)no1	1819931065	CMLSUCPGGKFNRH-AMIZOPFISA-N	429.861	1.316	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](F)Cl)[nH]n1)c1cc(=O)nc2cccnn12	1820144600	KPPSPJYFBPXNLB-MEDUHNTESA-N	433.831	1.653	50	20	IDGD	
CN[C@H](CC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](F)Br)n[nH]1)C(=O)O	1820932858	RUPJJPZQNGOBEH-BREBYQMCSA-N	434.266	1.155	50	20	IDGD	
CCS(=O)(=O)CC(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1	1822998331	CFBQIFGUVSZPGJ-RDDDGLTNSA-N	442.332	1.180	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](O)CCl)CC2)c1cccc(-n2cncn2)c1	1823717806	FXPQYWIDOCQWJW-SWLSCSKDSA-N	446.920	1.549	50	20	IDGD	
CC[C@H](C)[C@@H](O)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1	1824547943	DGTWTQBADMMERC-RYGJVYDSSA-N	445.564	1.325	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCC([C@H]2CCCCN2C(=O)CN2C(=O)CNC2=O)CC1	1824899290	QBIMIHCSJMVKME-OAHLLOKOSA-N	426.945	1.423	50	20	IDGD	
Cc1cc(CC(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)on1	1825016077	ADXIGDSNKZIUCC-OAQYLSRUSA-N	439.321	1.139	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCC([C@H]2CCCCN2C(=O)C[C@@H]2NC(=O)NC2=O)CC1	1825069940	GHKFUXREJRMWBM-LSDHHAIUSA-N	426.945	1.469	50	20	IDGD	
CCOC(=O)/C=C/C(=O)N[C@H]1CCc2nc(NC(=O)[C@H](C)Br)sc2C1	1825642995	YQMDUVNKKYIJIN-CAFLDADYSA-N	430.324	1.958	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCS(C)(=O)=O)CC2	1825646660	BGMPIPCDSMCSLC-DTWKUNHWSA-N	438.369	1.273	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](NC(C)=O)C(C)(C)C)CC2	1825993812	FPOFPCSHZNINAC-TYNCELHUSA-N	444.985	1.860	50	20	IDGD	
Cc1cccc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)n1	1827056359	SVYHONLCRIBFLF-QFIPXVFZSA-N	435.333	1.617	50	20	IDGD	
CCOc1ncccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1829536694	SFLVZBJWFYMSBA-NRFANRHFSA-N	439.940	1.815	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](O)c3ccco3)CCO2)C1	1829828269	BSAWWUSBCOKSMI-JLSDUUJJSA-N	435.304	1.006	50	20	IDGD	
Cc1cncc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)c1	1830537436	IHACDEBWDZBWTA-HNAYVOBHSA-N	440.338	1.491	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnn4ccncc34)C2)C1	1831645524	BTNIPLWSAZIZME-UZLBHIALSA-N	435.912	1.207	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccc4ncnn4c3)C2)C1	1831654466	LBVGVSXOJCYBCD-DYESRHJHSA-N	449.939	1.136	50	20	IDGD	
CCNC(=S)NCC(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H](C)Br)CC1	1831655766	AOQSIPYYYJLUBN-UKRRQHHQSA-N	447.443	1.874	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cncc(O)c2)CC1	1831702628	NGEBTCXAITZZBQ-IBGZPJMESA-N	431.537	1.394	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(OC)nn2C)CC1	1831826844	AUZDXMBLTPPZNJ-HZPDHXFCSA-N	426.945	1.916	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CN2CCN(C)CC2)CC1	1831830537	DUQPQBYIDUZMND-RBUKOAKNSA-N	429.005	1.107	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3cncc(C)c3)CCO2)C1	1832962047	DNRUZYUMYUOJMU-GHTZIAJQSA-N	439.940	1.033	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCC(N2CCC(NC(=O)c3ccc(O)nn3)CC2)CC1	1834071073	PHVFZNKSMOXJKJ-LJQANCHMSA-N	444.363	1.604	50	20	IDGD	
O=C(CN1CCCCC1)NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1	1834612147	ASPHXMBDVFRRON-SFHVURJKSA-N	447.393	1.734	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)c3ccc(F)cn3)C2)C1	1834819165	IMCKFQYDNUMURF-QGZVFWFLSA-N	430.274	1.076	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3F)CC2)CC1	1834942706	ZZNBYFDSNHGGJU-QGZVFWFLSA-N	426.920	1.660	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC1CCN(C2CCN(C(=O)[C@H](O)c3ccco3)CC2)CC1	1835834683	DRMUAJULUNDLOO-HXUWFJFHSA-N	437.613	1.736	50	20	IDGD	
CSCC[C@H](O)C(=O)N1CCC(N2CCC(NC(=O)CO[Si](C)(C)C)CC2)CC1	1835837418	GSUIRQBAFXKWPX-SFHVURJKSA-N	445.702	1.524	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3ccnc(OC)c3)CC2)CC1	1835933446	UXDXURUBLDNCHC-SFHVURJKSA-N	438.956	1.529	50	20	IDGD	
Cc1ncncc1C(=O)NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1	1835972581	AFBNEVPJULALOM-INIZCTEOSA-N	442.333	1.661	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3cscn3)CCO2)C1	1836044386	WTJIAALDXBTDOT-IRXDYDNUSA-N	436.361	1.378	50	20	IDGD	
CC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)c3cnncc3C(=O)O)CC2)CC1	1836396740	MYEGJUHLYZZHKY-KRWDZBQOSA-N	437.928	1.377	50	20	IDGD	
CCCC(=O)N[C@H](C)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](Cl)CC)CC2)CC1	1836396858	NOJGTRHKKBAZMN-QAPCUYQASA-N	429.005	1.880	50	20	IDGD	
O=C(c1ccc2c(c1)COC2)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836717219	NUHSLLVJAKUQSM-HXUWFJFHSA-N	436.936	1.929	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(OC2CCN(C(=O)C(C)C)CC2)CC1	1837628469	UAXMUFKVZYKPTK-LFVJCYFKSA-N	431.537	1.775	50	20	IDGD	
Cc1ccc(CCC(=O)N2CCOC[C@]3(C2)CN(C(=O)CO[Si](C)(C)C)CCO3)nc1	1837710437	YWNSIGSJWGXDSQ-QFIPXVFZSA-N	449.624	1.631	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cncc4cnccc34)CCO2)C1	1838465388	VJBLINRLCIAXPW-RXVVDRJESA-N	432.908	1.717	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(OC)cc3O)CCO2)C1	1838889582	XNVBTTAVWXMOHL-UZLBHIALSA-N	426.897	1.488	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(O)c(F)c3)C2)C1	1839154749	XCVAVPCHYVDGQE-RTBURBONSA-N	449.306	1.838	50	20	IDGD	
O=C(c1cn2c(F)cccc2n1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1839554976	SXDOAWBGCXQFPM-QAPCUYQASA-N	428.823	1.078	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3[nH]ccc3C)C2)C1	1839962326	ATSXYVIBLAGPIG-KDOFPFPSSA-N	428.327	1.567	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3c[nH]cc3C)C2)C1	1839964083	FVBAAQHZWMSPDR-QAPCUYQASA-N	428.327	1.567	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3C[C@@]3(F)Cl)C2)C1	1840035997	BYYYTGGBZMHHRX-AZHAFVHUSA-N	427.698	1.151	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cn3cnc4ccccc43)CCO2)C1	1840101139	ZCDIQXFWDFXGKL-JOCHJYFZSA-N	448.951	1.758	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)C3=COCCC3)CCO2)C1	1840217697	OSZSYSOAQNQVHI-MAUKXSAKSA-N	431.327	1.311	50	20	IDGD	
CC(C)C1(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)CCC1	1840613395	XMIGFPQWIZMMCS-WMLDXEAASA-N	435.334	1.960	50	20	IDGD	
COc1cc(Cl)cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)c1	1840742453	UQJGTXROLRBKSD-MAUKXSAKSA-N	435.279	1.953	50	20	IDGD	
CCn1ccc(C(=O)N2CCCC23CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C3)n1	1842514262	KHAPCNAKCZNVDM-HNNXBMFYSA-N	439.944	1.852	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC12CN(C(=O)c1cc(Cl)c3nncn3c1)C2	1846177449	PXIBGDBZTXTGQY-JTQLQIEISA-N	426.702	1.983	50	20	IDGD	
O=C([C@H](F)Cl)N1CC2(CCCN2C(=O)COCCOCCOCc2ccccc2)C1	1846258426	YRLIYWARNVALTQ-IBGZPJMESA-N	442.915	1.974	50	20	IDGD	
O=C1C[C@H](C(=O)N2CCCC23CN(C(=O)[C@H](Br)Cc2ccccc2)C3)CCN1	1846424580	ROZXXNHBJIMMND-IAGOWNOFSA-N	448.361	1.722	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC2(CCCN2C(=O)CN2C(=O)C=CC2=O)C1	1846461411	XPLLMBRLIHQFQR-OVCLIPMQSA-N	440.406	1.000	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc[n+]([O-])cc1	1848099263	HDLYKLAXEZFTRU-JYJNAYRXSA-N	438.912	1.268	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CCc1cc(F)ccn1	1848175404	KSJRWFDVEYONDM-NCBONNPESA-N	440.479	1.489	50	20	IDGD	
CSc1ccc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1[N+](=O)[O-]	9620468	QNSNKVIIGUDGDD-OAHLLOKOSA-N	447.425	1.461	50	20	IDGD	
C=C1c2ccccc2C(=O)N1[C@@H](C)C(=O)NNC(=O)c1cc(OC)c(OC)c(OC)c1	14074836	QXQBCXLTTZYPFK-ZDUSSCGKSA-N	425.441	1.989	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)COc2ccc(Cl)c(C)c2)cc1	17406492	FEAKMNXWYLWKHF-UHFFFAOYSA-N	439.921	1.804	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2ccc3c(c2)CCC(=O)N3)cc(OC)c1OC	18707395	IPCYMDJAQMXWGD-UHFFFAOYSA-N	435.458	1.220	50	20	IDGD	
CC(C)(C)c1ccc(C(=O)NNS(=O)(=O)c2ccc3c(c2)NC(=O)CC(=O)N3)cc1	28679380	RZVWNXSXSUBDHZ-UHFFFAOYSA-N	430.486	1.888	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1ccc(Br)cc1O	109364053	WPLWRMPBLDIQGR-UHFFFAOYSA-N	441.307	1.831	50	20	IDGD	
COC[C@@H](C)n1c(C)cc(/C=C(\C#N)C(=O)N2CCN(CC(=O)NC(C)C)CC2)c1C	207243395	QSNWVLKBTZDFRB-AGKWGAAGSA-N	429.565	1.888	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NCc1nnc2ccc(C(F)(F)F)cn12	726086220	IZXJTVUVJCGZOC-UHFFFAOYSA-N	441.395	1.070	50	20	IDGD	
CN(C)C(=O)[C@H]1CSCN1C(=O)CCC(=O)C(C#N)=C1N(C)c2ccccc2N1C	727383577	XFEITYKZJNSVOA-QGZVFWFLSA-N	427.530	1.647	50	20	IDGD	
CNS(=O)(=O)c1cccc([C@@H](C)NC(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)c1	727609321	JLWFXRBCJRBFQT-CHWSQXEVSA-N	438.481	1.593	50	20	IDGD	
CCOc1ccccc1CCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	727942076	SZMCUHUVZHLDOI-UHFFFAOYSA-N	434.518	1.522	50	20	IDGD	
O=C(CCC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)CCC(=O)c1cccs1	728890517	ULNLAEWDEFHAAK-UHFFFAOYSA-N	443.529	1.914	50	20	IDGD	
CC(C)[C@H]1CCC[C@@H](NC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)C1	729058853	QZAGGBQETVURGS-DLBZAZTESA-N	438.598	1.859	50	20	IDGD	
CCOc1ccc(NS(=O)(=O)c2cc(C(=O)NNC(=O)c3cnn[nH]3)ccc2C)cc1	729455535	KBZZXKVTIZUMPK-UHFFFAOYSA-N	444.473	1.387	50	20	IDGD	
Cc1ccc(C(=O)N[C@H](CC(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)c2ccccc2)cc1	729827841	UISSDNDDXWLLBX-RBUKOAKNSA-N	443.525	1.438	50	20	IDGD	
Cc1cccc(N2C(=O)N[C@H](CCC(=O)NNC(=O)[C@@H]3COc4ccccc4O3)C2=O)c1	730740303	BVUFKHVYAHLMQV-QAPCUYQASA-N	438.440	1.187	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)CC[C@H]2NC(=O)N(c3ccc(Cl)cc3)C2=O)c1O	730832846	NRMAGDXSAWKUOB-CQSZACIVSA-N	446.847	1.720	50	20	IDGD	
COc1ccccc1C(=O)NNS(=O)(=O)c1ccc(I)cc1	731494454	WDXWONMWSKHLAL-UHFFFAOYSA-N	432.239	1.923	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCCc2cccc(C(N)=O)c2)cc1Br	732245441	VQOFBILBVIXHLL-UHFFFAOYSA-N	435.278	1.743	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2oc3ccccc3c2CS(C)(=O)=O)C[C@@H](C)O1	732260110	AVWKVBFRUMJFEL-OKILXGFUSA-N	437.518	1.238	50	20	IDGD	
C[C@@H]1CCCC[C@@H]1OCC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	733088723	VGXFWLSUWKYKTQ-QAPCUYQASA-N	439.534	1.064	50	20	IDGD	
Cc1cc(C)cc(N2CC[C@@H](C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)C2=O)c1	734240466	RSPCLGCUTJCEBD-INIZCTEOSA-N	433.509	1.511	50	20	IDGD	
CN(CC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)[C@@H]1CCCN(c2ccccc2)C1=O	734488708	JGDXKUOPBXMRHO-GOSISDBHSA-N	425.445	1.483	50	20	IDGD	
CC(C)Oc1ccc([C@H](O)CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1	734853950	FMVPRZLEIFANEM-QGZVFWFLSA-N	449.533	1.445	50	20	IDGD	
CCOc1ccc(CC(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)cc1	735117599	YWOWLEHEOLWKJM-UHFFFAOYSA-N	433.534	1.102	50	20	IDGD	
O=C(NC[C@H](O)c1cc(Cl)cc(Cl)c1)NNC(=O)c1ccc(-n2cnnn2)cc1	735678314	MDCGIPITRNZTLH-HNNXBMFYSA-N	436.259	1.647	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCc2n[nH]cc2Br)c2ccccc2c1=O	739019332	BYGWRVYJCKKXBE-UHFFFAOYSA-N	434.254	1.046	50	20	IDGD	
C[C@@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(C(=O)NNc3ccnc(N(C)C)n3)cc2)C1	740105030	USLWCIWXZCTETC-HUUCEWRRSA-N	432.550	1.966	50	20	IDGD	
O=C(NNc1ncnc2[nH]cnc12)c1cccc(S(=O)(=O)NCc2cccs2)c1	740746095	IXNVBQMUTDRZQH-UHFFFAOYSA-N	429.487	1.650	50	20	IDGD	
COc1ccc(OC)c(-n2nnnc2SCC(=O)NNC(=O)c2cccc(C#N)c2)c1	741861646	SPAPHXLEAUEEEP-UHFFFAOYSA-N	439.457	1.104	50	20	IDGD	
O=C(NNC(=O)c1cccc(Br)c1)c1ccc(S(=O)(=O)NC2CC2)cc1	742771552	ZNPGNRHCDZSDKI-UHFFFAOYSA-N	438.303	1.965	50	20	IDGD	
CCCCOc1ccc(C(=O)NNS(=O)(=O)c2c[nH]c(C(=O)OC)c2)cc1OC	743251924	ZHMQZLUIJRSFOB-UHFFFAOYSA-N	425.463	1.612	50	20	IDGD	
COC(=O)c1ccc(Cl)c(S(=O)(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)c1	743268730	IELVJHRTZZIWCI-UHFFFAOYSA-N	429.794	1.364	50	20	IDGD	
C[C@H](C(=O)NNC(=O)c1cc(Br)ccc1O)n1nnc(-c2ccccc2)n1	743730470	ZHHJDUWTAAHQDA-SNVBAGLBSA-N	431.250	1.830	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CN2CCC[C@@H](C(=O)Nc3ccc(Cl)cn3)C2)c1	744389014	FRTNROMMJIWPBW-MRXNPFEDSA-N	440.891	1.718	50	20	IDGD	
CCCn1c(=O)n(CCC(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)c2ccccc21	744601501	PRNMLSSBNNCQIJ-UHFFFAOYSA-N	449.467	1.479	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1ccc(-n2cncn2)c(C)c1	745410125	IOFDKWXCPIVZKA-UHFFFAOYSA-N	443.847	1.856	50	20	IDGD	
CCN1CCO[C@@H](C(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)C1	746103574	PNAWXZLXOWIWFH-OAHLLOKOSA-N	438.531	1.031	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)CC2(CS(C)(=O)=O)CC2)c2ccccc2c1=O	746823249	XAMZRCOEUDFZSV-UHFFFAOYSA-N	448.545	1.563	50	20	IDGD	
Cn1nnnc1SCCC(=O)NNc1ccc(S(=O)(=O)Nc2nccs2)cc1	747942374	FHLMXMNUEKMKFG-UHFFFAOYSA-N	440.536	1.093	50	20	IDGD	
CNC(=O)COc1ccc(C(=O)NNc2nc(-c3ccccn3)nc3c2CCC3)cc1OC	748341139	QBMKSWDTHPBWNK-UHFFFAOYSA-N	448.483	1.918	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)NNC(=O)NCCCN1CCN(c2ccncc2)CC1	748464330	BNQIZHNXESPHOJ-UHFFFAOYSA-N	435.532	1.648	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)N[C@H](C)c1cc2c(cc1Br)OCCO2	748616578	CZJBUYZVMSLGCE-GHMZBOCLSA-N	446.298	1.663	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)NC[C@H]1CCN(c2cccc(Br)c2)C1	748625013	KGFXVVBDIUQODB-UONOGXRCSA-N	443.342	1.657	50	20	IDGD	
COc1cc(Br)ccc1C(=O)NNC(=O)c1csc(N2CCOCC2)n1	748697765	ULROGNTWAHQNFB-UHFFFAOYSA-N	441.307	1.826	50	20	IDGD	
CC[C@@H](NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)c1nnc2n1CCCCC2	749579158	HGXHBEFXPXQRCJ-MRXNPFEDSA-N	441.540	1.493	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2ccc(OC(C)C)c(OC)c2)oc1C	751142260	MNCBSVFLXRIKBL-UHFFFAOYSA-N	426.447	1.794	50	20	IDGD	
C[C@@H](SCC(=O)Nc1ccc(F)cc1)C(=O)NNC(=O)CNC(=O)c1cccs1	751209175	MHEJNEWMMIAOKI-LLVKDONJSA-N	438.506	1.525	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)c2ccc(Cl)c(S(=O)(=O)NC[C@H]3CCCO3)c2)o1	752522613	ADKCXYAWUPCHRR-CYBMUJFWSA-N	441.893	1.774	50	20	IDGD	
C[C@H](CS(=O)(=O)c1ccc(F)cc1)C(=O)NNC(=O)[C@H](C)Oc1ccc(F)cc1	755048171	DOGNUOLWMRYDGP-OLZOCXBDSA-N	426.441	1.990	50	20	IDGD	
N#C/C(=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)NC[C@@]1(O)CCOC1	755219237	QAAXHOQDCVUFOD-NMQRCDEWSA-N	443.891	1.253	50	20	IDGD	
COc1cc(CN2CC[C@H](NC(=O)NNC(=O)Cc3ccccc3OC)C2)cc(OC)c1	756097373	VEVDNKIRKSVDLH-SFHVURJKSA-N	442.516	1.860	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)Nc1ccc(C(=O)NCc2ccccc2)cc1	756206646	ZVQWTANHHWRMBY-INIZCTEOSA-N	430.486	1.204	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)Nc2ccc(S(=O)(=O)NCC3CC3)cc2)c1	756783098	DXIZLRBXASIBJS-UHFFFAOYSA-N	431.518	1.907	50	20	IDGD	
CS(=O)(=O)Cc1cc(F)ccc1NC(=O)NNC(=O)c1cc(Br)c[nH]1	757678167	KTQCVHXTEFQWOL-UHFFFAOYSA-N	433.259	1.927	50	20	IDGD	
CCCOc1ccc(-c2nc(C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)cs2)cc1	758054933	OYAGLJWQYGMENR-LLVKDONJSA-N	426.520	1.298	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)N[C@H]1CN(C(=O)OC(C)(C)C)C[C@H]1C#N	758758498	IKCXMKNMMMPUHC-KGLIPLIRSA-N	427.465	1.346	50	20	IDGD	
COc1ccc(Br)c(CN(C)C(=O)NNC(=O)CNC(=O)c2ccco2)c1	758957174	MQYWZBGCHPTMSG-UHFFFAOYSA-N	439.266	1.653	50	20	IDGD	
COc1ccc(-c2nn(CCC#N)cc2/C=C(/C#N)C(=O)N(C)C[C@H](O)CO)cc1OC	760012864	AKGVCHWYUHMEEV-VUZIPCMWSA-N	439.472	1.200	50	20	IDGD	
CC1(C)C(=O)N(C[C@](C)(O)C(=O)NNC(=O)COc2ccc(C#N)cc2)c2ccccc21	760054896	ZLXYQXGRCGTNMZ-QHCPKHFHSA-N	436.468	1.160	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NN=C2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)c1	760227622	YIWCURBUYFGDPM-MRXNPFEDSA-N	434.478	1.943	50	20	IDGD	
O=C(COC(=O)c1cnc([C@H]2CCCO2)s1)NNC(=O)[C@H]1COc2ccccc2O1	760673183	QDBLUASWLYFKIG-ZIAGYGMSSA-N	433.442	1.139	50	20	IDGD	
COC(=O)[C@H](C)Cc1ccc(NC(=O)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1	763468899	XLZKKZRXDUVXLN-GFCCVEGCSA-N	428.401	1.346	50	20	IDGD	
O=C(NNC(=O)c1ccccc1Br)C(=O)Nc1cccc(C(=O)NC2CC2)c1	763482046	DCWCVIKQCAGPCG-UHFFFAOYSA-N	445.273	1.741	50	20	IDGD	
CCN1CCN(c2ccc(Cl)cc2NC(=O)C(=O)NNC(=O)c2cccnc2)CC1	763490851	CNRGNXIWJDCORM-UHFFFAOYSA-N	430.896	1.277	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cccc([C@H](C)OC)c2)cc(OC)c1OC	763540080	QHFUGAMCOYVMIR-LBPRGKRZSA-N	431.445	1.820	50	20	IDGD	
Cc1nc(Br)ccc1NC(=O)C(=O)NNC(=O)[C@@H]1COc2ccccc2O1	763570705	HQCKUFDRZVSTDK-ZDUSSCGKSA-N	435.234	1.078	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)Nc1cc(Cl)cc2cccnc12	763572508	RVXJZLZDRLDIHL-INIZCTEOSA-N	426.816	1.814	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1ccccc1OCC(F)(F)F	763628194	HBSHRTYVMRKDIE-UHFFFAOYSA-N	435.362	1.984	50	20	IDGD	
Cc1cc(Br)ncc1NC(=O)C(=O)NNC(=O)c1c(C)nc2ccccn12	763628899	HLDKJCRKNRINAG-UHFFFAOYSA-N	431.250	1.508	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cnc(Br)cc2C)cc1	763662472	YQVYSRYXSXVSFS-UHFFFAOYSA-N	437.250	1.326	50	20	IDGD	
COC(=O)c1c(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)sc(C)c1C	763807926	RUTJIWNMCDYNKX-UHFFFAOYSA-N	430.442	1.188	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(-c3nnnn3C3CC3)c2)cc1	763822387	ZNELKXAWUBMRCM-UHFFFAOYSA-N	435.444	1.148	50	20	IDGD	
COC(=O)CCc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)cc1	763856202	DVYHBNOEAYDLJT-ZDUSSCGKSA-N	431.420	1.485	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(C)nn2-c2ccccc2)cc1OC	763912032	LBHDGBPUELOPIF-UHFFFAOYSA-N	437.456	1.988	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1cnn(Cc2ccccc2)c1	764011413	HDEXBHQOLPJBFF-UHFFFAOYSA-N	427.848	1.993	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1cnn(Cc2ccc(Cl)cc2)c1	764040083	CJUDBBXNDQVKQT-UHFFFAOYSA-N	427.848	1.993	50	20	IDGD	
O=C(NNC(=O)c1ccc(F)cc1Br)C(=O)Nc1cnn(-c2ccccc2)n1	764085665	YLVGWWPSOVLKCS-UHFFFAOYSA-N	447.224	1.569	50	20	IDGD	
COc1ncc(C)cc1NC(=O)C(=O)NNC(=O)c1ccc(F)cc1Br	764086343	QXWFEOWFYXKCPD-UHFFFAOYSA-N	425.214	1.700	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(F)c(NC(=O)Cc3ccccc3)c2)n[nH]1	764100293	ZNDSLVOQYQGPNG-UHFFFAOYSA-N	438.419	1.438	50	20	IDGD	
CN(C)C(=O)c1cc(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)ccc1Cl	764152757	VAFMLXHIFASUJM-INIZCTEOSA-N	430.848	1.131	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)C(=O)Nc2cnn(C)c2C(F)F)c1	764232381	OBRTXWVQRNDGQD-UHFFFAOYSA-N	446.208	1.529	50	20	IDGD	
COCCNS(=O)(=O)c1c[nH]c(C(=O)NNc2nc(-c3ccccn3)nc(C)c2C)c1	764324307	OKHMFWHJCHQXNQ-UHFFFAOYSA-N	445.505	1.165	50	20	IDGD	
COc1ccccc1Oc1ccc(NC(=O)C(=O)NNC(=O)c2cnn(C)c2)cc1F	764362882	JHTJYWFIYYFAOW-UHFFFAOYSA-N	427.392	1.760	50	20	IDGD	
COC(=O)c1cc(Br)c(F)cc1NC(=O)C(=O)NNC(=O)c1ccc(C)o1	764371913	PGPFXBQEVODXEM-UHFFFAOYSA-N	442.197	1.676	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)N2C[C@H](C)Oc3ccccc32)n[nH]1	764378003	UTVZEAKKDFFAKW-ZDUSSCGKSA-N	435.440	1.660	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1cccc(-n2ccnc2)c1	764393486	PFZIACGHRWWUSH-UHFFFAOYSA-N	425.470	1.759	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1ccc(-n2ccnc2)nc1	764395017	YHXLKIYNLKKZRW-UHFFFAOYSA-N	426.458	1.154	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=S)NCCc3cccnc3)n[nH]2)cc1OC	764499553	CPBOLFNHADPMLH-UHFFFAOYSA-N	426.502	1.841	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)c1ccc(Cl)c(NS(C)(=O)=O)c1	765314094	SVOVIAMOXNFAOJ-UHFFFAOYSA-N	448.929	1.777	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1cc([N+](=O)[O-])ccc1Cl	765734126	WYMBBCDCJMQIKA-UHFFFAOYSA-N	445.863	1.467	50	20	IDGD	
COCCN(C)CCCC1CCN(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)CC1	766519570	SVJFONOJCJJGFQ-UHFFFAOYSA-N	444.540	1.087	50	20	IDGD	
COc1cc(C(=O)OCC(=O)NNC(=O)Cc2ccccc2C)c(N)cc1OC(F)F	767283992	GDFNRTSXXQUWMR-UHFFFAOYSA-N	437.399	1.734	50	20	IDGD	
COc1ccc2c(c1)[C@@H](NC(=O)NNC(=O)C1CCN(c3ncccn3)CC1)CCO2	767328641	NZGUYPPNYCTKMK-KRWDZBQOSA-N	426.477	1.556	50	20	IDGD	
COc1ccc(NNC(=O)CN2C(=O)N[C@@](C)(c3ccc(F)cc3)C2=O)c([N+](=O)[O-])c1	768332748	SXJJAMQMZQZFKJ-IBGZPJMESA-N	431.380	1.653	50	20	IDGD	
CC(C)(C)C1CCC2(CC1)NC(=O)N(CC(=O)NNC(=S)Nc1ccccn1)C2=O	768585088	CPPMRBOTZYMXOW-UHFFFAOYSA-N	432.550	1.926	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)CC[C@]2(C)CCC(=O)N2)c2ccccc2c1=O	770548866	IAYTVVRDRHDCKQ-QFIPXVFZSA-N	427.505	1.797	50	20	IDGD	
C[C@H](C(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1)S(=O)(=O)c1ccc(F)cc1	772883489	BALMBACSTZVXQA-LLVKDONJSA-N	441.868	1.105	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)[C@@H]1CCCCN1C(=O)c1ccco1	772889692	SEKJKMBEWSVOJD-HNNXBMFYSA-N	432.864	1.392	50	20	IDGD	
CN1CCC[C@@H](N(C)C(=O)c2ccc(NC(=O)C(=O)NNc3cccc(C#N)c3)cc2)C1	773682802	NKPQBBRIRVJBCL-HXUWFJFHSA-N	434.500	1.806	50	20	IDGD	
N#Cc1ccc(NNC(=O)Nc2ccc(S(=O)(=O)N[C@@H]3CCS(=O)(=O)C3)cc2)cc1	775469702	GIBUIEHGYPGQTP-MRXNPFEDSA-N	449.514	1.172	50	20	IDGD	
CC(=NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1ccc(C(=O)O)c(F)c1	776757859	BDGFHUYALHHCSS-UHFFFAOYSA-N	449.460	1.699	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)N1CCN(c2nnc(C(F)(F)F)s2)CC1	776883626	XVEADOJBWZKQDE-UHFFFAOYSA-N	444.439	1.637	50	20	IDGD	
COc1ccc(C2(C(=O)NNC(=O)N[C@@H]3CCS(=O)(=O)C3)CCCC2)cc1OC	777367239	CUTVPSCLEVDXEY-CQSZACIVSA-N	425.507	1.033	50	20	IDGD	
Cn1c(CNC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)nc2cc(Cl)ccc21	777412767	ZFGZLRGQARBUQT-UHFFFAOYSA-N	425.840	1.347	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(OCC(F)(F)F)nc1)[C@@H]1COc2ccccc2O1	777906552	BXBHJTJCVZVNHM-ZDUSSCGKSA-N	433.364	1.172	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)[C@@H](O)[C@H](O)c2nc3ccccc3[nH]2)c(C)n1-c1ccccc1	779580411	ZGSKDZODBOCOBM-PMACEKPBSA-N	433.468	1.826	50	20	IDGD	
COc1cccc(NNC(=O)Nc2ccc(Cl)c(S(=O)(=O)N3CCOCC3)c2)n1	780446638	NMYZZRDKEOAKFA-UHFFFAOYSA-N	441.897	1.913	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@H]3CCC(=O)[C@H](C)C3(C)C)CC2)cc1	780927061	QNDWPZSHWAKLAZ-AZUAARDMSA-N	428.577	1.901	50	20	IDGD	
O=C(CSc1nnc(O)nc1O)NN=Cc1cc(C23CC4CC(CC(C4)C2)C3)n[nH]1	781124099	VLXSVZKINGEUPC-UHFFFAOYSA-N	429.506	1.716	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)NCc1cccc(S(=O)(=O)N(C)C)c1	782763425	AFPFDBVOILYZJK-ZDUSSCGKSA-N	438.481	1.374	50	20	IDGD	
COC(=O)c1ccc(C(F)(F)F)cc1NC(=O)C(=O)NNC(=O)c1ccc(O)cc1	782833051	XMFUCBDQNQCWCU-UHFFFAOYSA-N	425.319	1.597	50	20	IDGD	
Cc1cc(N(C)C)ccc1NC(=O)C(=O)NNC(=O)c1sc(N2CCOCC2)nc1C	782897394	OTSABXLDLXNBRR-UHFFFAOYSA-N	446.533	1.062	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2cc(N3CCCS3(=O)=O)ccc2Cl)nc(C)n1	783324334	HQMTUEZLNLOEOF-UHFFFAOYSA-N	438.897	1.369	50	20	IDGD	
CCNC(=O)COc1ccc(NC(=O)C(=O)NN=c2sc3ccccc3n2C)cc1	783351471	GSFAPIJQBYKJMZ-UHFFFAOYSA-N	427.486	1.325	50	20	IDGD	
Cn1c(=NNC(=O)C(=O)Nc2ccc(N3CCCS3(=O)=O)cc2)sc2ccccc21	783352178	ZVBGBEKLKBLDNB-UHFFFAOYSA-N	445.526	1.350	50	20	IDGD	
CN(C1CCCCC1)S(=O)(=O)c1ccccc1NC(=O)C(=O)NN=c1cc[nH]cc1	783370430	RUUGNXFWVVNOOR-UHFFFAOYSA-N	431.518	1.539	50	20	IDGD	
COC(=O)[C@@H](Cc1ccc(Cl)cc1)NNC(=O)Cc1csc(N2CCOCC2)n1	783575282	XCQYMXASBCMDOY-MRXNPFEDSA-N	438.937	1.581	50	20	IDGD	
COC(=O)c1c(F)cccc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)C(F)F)cc1	784835237	JLNHIZVATSIEJD-UHFFFAOYSA-N	445.375	1.690	50	20	IDGD	
COc1ccc2nc(NNC(=O)C(=O)Nc3ccccc3OCCC(N)=O)c(C)cc2c1	785163699	ZOMKDNKWICCPDU-UHFFFAOYSA-N	437.456	1.888	50	20	IDGD	
COc1cc(F)cc(NNC(=O)C(=O)Nc2ccc(S(=O)(=O)N(C)C3CC3)cc2)c1	785236930	KXWWVCXMEOKBDL-UHFFFAOYSA-N	436.465	1.699	50	20	IDGD	
C[C@H]1CCC[C@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)CC1	785945413	BRXBZJARONKOEQ-RDJZCZTQSA-N	438.550	1.620	50	20	IDGD	
CCc1nnc(-c2ccc(NC(=O)C(=O)NNC(=O)[C@H]3OCC[C@H]3c3ccccc3)cc2)o1	789810879	SFESBQCEXFJWNI-HKUYNNGSSA-N	449.467	1.958	50	20	IDGD	
O=C(NNC(=O)c1cc2ccccc2o1)C(=O)Nc1cccc(N2C(=O)CCCC2=O)c1	792356394	OKYQHIUFUKTLPH-UHFFFAOYSA-N	434.408	1.876	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCC2(S(C)(=O)=O)CCC2)cc1Br	792931175	GKJQGVIQMCEIBT-UHFFFAOYSA-N	434.312	1.369	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)C(=O)Nc2ccc3c(c2)N(CC(F)F)C(=O)CS3)n1	793018592	TWNXBAWEOSTQSM-UHFFFAOYSA-N	436.444	1.879	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C2CCC(NC(=O)C3CC3)CC2)n[nH]1	793749795	MMHNUFBOYWFXPV-UHFFFAOYSA-N	425.489	1.931	50	20	IDGD	
CCOC(=O)c1ccc(NNC(=O)[C@@H](NS(=O)(=O)c2ccc(C)cc2)[C@H](C)O)cc1C	794657979	MGHJDFCECPOPGG-KXBFYZLASA-N	449.529	1.651	50	20	IDGD	
CC(=NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1)c1cccc(N2CCC2=O)c1	794871102	FDOMMULDWCODCR-UHFFFAOYSA-N	428.514	1.893	50	20	IDGD	
Cc1cnn(C)c1C=NNC(=O)c1cc(S(=O)(=O)NCc2ccccc2)ccc1O	794887823	DWIBYNWZZYPRNR-UHFFFAOYSA-N	427.486	1.677	50	20	IDGD	
CCOC(=O)c1cc(S(=O)(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c(F)cc1C	795276857	DBUAJDUFEPBHAU-UHFFFAOYSA-N	425.394	1.842	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(F)c(N3CCOC3=O)c2)c1	796992597	TVRMRHBHIGXZIU-UHFFFAOYSA-N	430.392	1.256	50	20	IDGD	
O=C(NC[C@H]1CCCN1C1CCCCC1)NNC(=O)c1csc(N2CCOCC2)n1	798048308	SLNALGCMDHVECS-MRXNPFEDSA-N	436.582	1.721	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)C[C@@](O)(c2nc(C)cs2)C(F)(F)F)cc1	801106368	VJXVIOVWDGVTEH-MRXNPFEDSA-N	430.408	1.686	50	20	IDGD	
C[C@](O)(Cn1cc(C(F)(F)F)ccc1=O)C(=O)NNC(=O)Nc1cc(F)cc(F)c1	802005858	ZIEZGLBXZTZMNJ-INIZCTEOSA-N	434.321	1.749	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)c2c(C)oc(C)c2S(N)(=O)=O)c(OC)cc1Cl	802078309	LJSVTLZWJXNAQD-UHFFFAOYSA-N	446.869	1.681	50	20	IDGD	
Cc1cc(N2CCCS2(=O)=O)ccc1C(=O)NNC(=O)Nc1ccc2c(c1)OCO2	802101900	XLHWWGDAIOKUEO-UHFFFAOYSA-N	432.458	1.730	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2c(F)cccc2N2CCCC2)c1	805754866	GQZFJPSTDPXARQ-UHFFFAOYSA-N	434.493	1.974	50	20	IDGD	
O=C1COC[C@H](C[C@H]2CN(C(=O)C(=O)NNc3ccc(F)cc3F)c3ccccc32)N1	806997358	LHVMZAJXLVPWGO-JSGCOSHPSA-N	430.411	1.443	50	20	IDGD	
COC(=O)c1cc(Br)c(OC)cc1NC(=O)C(=O)NNc1ncc(F)cn1	807015748	GTFVOVMYNYPNIY-UHFFFAOYSA-N	442.201	1.255	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNc2ccc(-n3ccnc3)nn2)c(OC(F)F)c1	807429835	YKNNOBZUDQFQLZ-UHFFFAOYSA-N	447.358	1.132	50	20	IDGD	
COC(=O)c1c(F)cccc1NNC(=O)CCNS(=O)(=O)c1ccc(C(C)=O)cc1	808030496	XXRIKSJXVBRWCD-UHFFFAOYSA-N	437.449	1.627	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)c1cn(C2CCOCC2)nn1	809981469	LZWQJOFINXBURD-NSHDSACASA-N	438.282	1.621	50	20	IDGD	
COC(=O)c1c(F)ccc(NC(=O)C(=O)NNC(=O)COc2ccc(OC)cc2)c1C	810384258	BLMNZZFFIJCZDJ-UHFFFAOYSA-N	433.392	1.094	50	20	IDGD	
COC(=O)c1c(F)ccc(NC(=O)C(=O)NNC(=O)c2cc(OC)cc(OC)c2)c1C	810386198	PXKHRMPTVUXMPN-UHFFFAOYSA-N	433.392	1.338	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2ccc3c(c2)C(C)(C)CO3)CC1	810414517	VVRRKZDCZVCKLM-UHFFFAOYSA-N	445.545	1.445	50	20	IDGD	
CSc1nnnn1-c1cccc(NC(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)c1	812920205	GDGYKODDYVPTJW-UHFFFAOYSA-N	448.534	1.783	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)c2nnn(-c3ccn(C)n3)c2C)c1	818751156	WVHWJBQOAUBRKI-UHFFFAOYSA-N	434.254	1.615	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(CCC(=O)NNC(=O)CNc2ccccc2)cc1	823328288	ZZUCPFJEGFJJJW-UHFFFAOYSA-N	432.546	1.909	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)c2cnc3c(c2)c(O)nc(=O)n3C2CC2)cc1	893703215	YJAXCLZDDQLVOA-UHFFFAOYSA-N	425.470	1.694	50	20	IDGD	
Cc1ccc(-n2cnnc2SCC(=O)N([C@H]2CCS(=O)(=O)C2)N(C)C)cc1Cl	914838649	PGCGTOOVERAEQS-AWEZNQCLSA-N	443.982	1.814	50	20	IDGD	
NC(=O)c1ccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)cc1	915879991	AJXLHHCDILLIMK-UHFFFAOYSA-N	445.501	1.427	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCCNC(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)cc1	916276554	BLLKMSQBABVMRG-AWEZNQCLSA-N	438.481	1.210	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)c2nnc(O)c3ccccc23)CC1	916519601	FCXDCJTVCDHKHS-UHFFFAOYSA-N	430.465	1.679	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1)c1nncn1C	916580669	PFUNXLUNMIIGNR-NSHDSACASA-N	449.518	1.383	50	20	IDGD	
Cc1nn([C@H]2CCS(=O)(=O)C2)c(C)c1C=NNC(=O)COc1ccccc1[N+](=O)[O-]	917027584	DSGYQISKTHPORE-AWEZNQCLSA-N	435.462	1.297	50	20	IDGD	
COc1ccc([C@H](CNC(=O)NNC(=O)CC(F)(F)F)N2CCOCC2)cc1OC	918057352	JNUYBCABCCUMGB-ZDUSSCGKSA-N	434.415	1.360	50	20	IDGD	
CC[C@@H](NC(=O)NNC(=O)c1c(C)nc2ccccn12)c1ccccc1OCC(=O)NC	918220851	BTGXFXWTPOLGPZ-MRXNPFEDSA-N	438.488	1.863	50	20	IDGD	
O=C(CC(F)(F)F)NNC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1	918365651	AJTSRKHSLSSOGA-LBPRGKRZSA-N	438.384	1.238	50	20	IDGD	
CCCCS(=O)(=O)N1CCC[C@@H]1C(=O)OCC(=O)NNC(=O)c1cccc(Cl)c1	919362163	WCFMNRQMDUKIJQ-OAHLLOKOSA-N	445.925	1.239	50	20	IDGD	
CCC[C@@H](C)N1C[C@@H](C(=O)OCC(=O)NNC(=O)c2cc(Cl)ccc2OC)CC1=O	919586912	ZYBMRSUJLVVUFV-OLZOCXBDSA-N	439.896	1.690	50	20	IDGD	
Cc1nn(Cc2ccc(F)cc2)c(Cl)c1C(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1	919888913	HQEAWSNLSBDCHC-ZDUSSCGKSA-N	443.888	1.163	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)NC2CCN(C(=O)C3CC3)CC2)CC1	1116084048	NWGISHSLQQISBF-UHFFFAOYSA-N	437.541	1.365	50	20	IDGD	
C[C@H]1CCCN(C(=O)CCNC(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)C1	1263757888	IRPUAAQWIRDAOY-HNNXBMFYSA-N	439.557	1.613	50	20	IDGD	
COCc1ccccc1S(=O)(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1	1319900580	IVPKCOBGSFRWGJ-UHFFFAOYSA-N	427.523	1.790	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2cnn(Cc3cccnc3)c2)c2ccccc2c1=O	1321038390	WAHCFIDNTGYDDN-UHFFFAOYSA-N	432.444	1.523	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)NCCN2C(=O)COc3ccccc32)cc1	1321433769	MFQUAGVKUANXAW-HNNXBMFYSA-N	442.472	1.609	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)/C=C\c1ccccc1)C(=O)NNC(=S)NC(C)C	1324990722	PRJKIVUXWQIGBD-KUGGDMIFSA-N	430.621	1.602	50	20	IDGD	
COc1ccc(C(=O)N2CCCC2)cc1NC(=O)NNC(=O)c1n[nH]c2c1CCCC2	1325339265	HTXJJLQLMIDUAQ-UHFFFAOYSA-N	426.477	2.000	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2)c1ccc2cnccc2c1	1778605720	PAQGMZXKTHTTHV-NNMXDRDESA-N	431.920	1.962	50	20	IDGD	
CC(=O)N[C@H](C(=O)N1CCO[C@@]2(CCN(C(=O)CO[Si](C)(C)C)C2)C1)C(C)(C)C	1779293954	HWWUOSCIOGUYSS-YLJYHZDGSA-N	427.618	1.219	50	20	IDGD	
CC(=O)Nc1ccc(CC(=O)N2CCO[C@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)cc1	1779296895	KOZZGVSCOHNGGE-QFIPXVFZSA-N	447.608	1.869	50	20	IDGD	
COc1cc(C#N)cc(C(=O)N2CCO[C@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)c1	1779299106	TTYPQGLMUOWPQD-NRFANRHFSA-N	431.565	1.862	50	20	IDGD	
C#CCCCCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1	1779374902	GGRUQDPJLUAEQJ-AUSIDOKSSA-N	441.532	1.006	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)c(O)n1	1780269694	RKNFSQYMHILJOM-KPZWWZAWSA-N	426.311	1.570	50	20	IDGD	
CC[C@@H](NC(C)=O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Br)C1	1780770242	JUKHQQWEYXMFKC-VWPFQQQWSA-N	436.322	1.106	50	20	IDGD	
Cc1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C3)ccc1F	1780947888	JIVOMOQBQJJKHF-AUSIDOKSSA-N	448.539	1.635	50	20	IDGD	
O=C(c1c(F)ccc(O)c1F)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781334209	WFBFKVRUVSKCFW-CZUORRHYSA-N	437.212	1.804	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cccc(F)c3[N+](=O)[O-])C2)C1	1781772040	ITIXOTSPTITYIX-ACJLOTCBSA-N	429.832	1.431	50	20	IDGD	
O=C(c1cccc2nccn12)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1782361758	PMDDILVTAGZEQS-RHSMWYFYSA-N	425.258	1.468	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3(C)CCC3)[C@H]2C1	1783470962	BVQODIZSPRXWGS-SMKMMKTPSA-N	429.521	1.290	50	20	IDGD	
O=C(C[C@@H]1COc2ccccc2O1)N1CCO[C@@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783942123	IGENXGKLXZADKN-YJYMSZOUSA-N	429.300	1.850	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)COc3cccc(Cl)c3)C[C@@H]21)[C@@H](O)CCl	1784084557	XWSPZIYCOAKYTM-STECZYCISA-N	431.316	1.298	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4ccccc4o3)C[C@@H]21)c1cccc(B(O)O)c1	1786982994	KAOZOUVGETYDHX-JLMWRMLUSA-N	448.284	1.020	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)c1nc2ccccn2n1	1787263253	AVWYYFJKKMHQBT-ZJQBRPOHSA-N	440.273	1.013	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)c1ccc2n[nH]cc2c1	1787300899	AUNQWNKUMJPHEE-QRTARXTBSA-N	435.322	1.941	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)c1ccc(Cl)nn1	1788836823	OGGMNTGFCIBHHY-PZEZNAACSA-N	435.681	1.414	50	20	IDGD	
Cc1ncncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)CBr)C[C@@H]21	1788969147	RPQMUQRLHCBDCL-XTBFLFJDSA-N	425.327	1.409	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccccc3C(N)=O)C[C@@H]21	1789872833	XKEFQKPAKVUSKJ-JPZWVBCYSA-N	442.343	1.615	50	20	IDGD	
COc1ccc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]3C2)cc1	1789922165	FJYIRLWCGQCCTR-OWIUFQIYSA-N	443.313	1.908	50	20	IDGD	
Cc1n[nH]c(C)c1CC(=O)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1	1790583412	SFYAIAPMJNDSGO-UHFFFAOYSA-N	446.316	1.697	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3c(OC)cccc3OC)C[C@@H]21	1791254281	RXECGRMGBDTLPT-XSWJXKHESA-N	440.924	1.551	50	20	IDGD	
Cc1cccnc1CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)CBr	1792868801	PNJMJNCRWVCGCH-OAFZBRQQSA-N	438.366	1.943	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(Cl)cn1)C2	1792870746	KJRXNVVFBCAFDN-MCYUEQNJSA-N	430.730	1.969	50	20	IDGD	
C[C@@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCl	1793115916	AAFMDFULGLUQRN-LHKMKVQPSA-N	437.924	1.539	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(-n2cnnc2)cc1	1795493727	VYOLNHTVLFLLMD-XEMDLRDOSA-N	443.580	1.322	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1c[nH]c2nccc-2c1Cl	1796224464	HWFXGJGANYEZLE-YHYOWMERSA-N	441.315	1.625	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1Cc2ccccc2O1	1797224588	ANAZOEHPAMBLGX-CNGORYIKSA-N	437.334	1.611	50	20	IDGD	
C[C@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@](C)(Cl)CCl)C2)n1ccccc1=O	1797935500	IIOFQTWYNVSRBA-TWAUDHPGSA-N	430.332	1.235	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(Cl)nn1	1798034339	POCIDYRCYAHEOM-DYNIEEOBSA-N	431.718	1.364	50	20	IDGD	
CCc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](Br)CC)C3)n(C)n1	1798167905	IAWSXLREZAAEOC-FAXLKDOZSA-N	427.343	1.359	50	20	IDGD	
CN(C)c1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@](C)(Cl)CCl)C3)cn1	1798262523	SZIDRDJYYAJQBM-QHHYFVSCSA-N	429.348	1.587	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C=C/c1cccc(O)c1)C2	1798443102	RYUATOURBDTTDR-SRXHPEDYSA-N	435.484	1.356	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/c1ccc([N+](=O)[O-])o1)C2)[C@H](F)Br	1799343501	YVDBNCZXGVXFHB-OBCQIGCLSA-N	446.229	1.481	50	20	IDGD	
COC(=O)CCCCCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Br	1799352053	JNWJTSYEGKVNJX-NOXHYTERSA-N	437.306	1.390	50	20	IDGD	
COCCOCCOCCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](F)Br	1800163169	IVKGMWIHAJBFFP-FQLMCAECSA-N	439.322	1.385	50	20	IDGD	
CN(C)[C@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)c1ccccc1Cl	1800308818	BCPLPGFJEGYKCZ-WIZAYZPVSA-N	444.359	1.132	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](O)Cc1ccccc1	1800632358	OAXSPVPFEZCKOJ-FWEDZOCSSA-N	439.350	1.211	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cnc3ccccn23)[C@H]1c1cccnc1)[C@@H](O)CCl	1803138536	CFYPARKMCXVEFL-IEZWGBDMSA-N	427.892	1.649	50	20	IDGD	
O=C(CCc1ccc[nH]1)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1807458609	BMFSJFKQDQVGTP-AUSIDOKSSA-N	446.316	1.042	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)[C@H]1CC=CCC1	1808125550	QLIVTIMXWSBZGO-RBDMOPTHSA-N	433.317	1.437	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1808260795	XKNWHWCJYFEJMT-NEWSRXKRSA-N	429.713	1.098	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](O)C(=O)N1CC[C@H](CNC(=O)[C@@H](F)Cl)[C@@H]1c1cccnc1	1808314450	HHJKBNTXOWFDFA-HLPPOEQASA-N	444.891	1.465	50	20	IDGD	
COC(=O)NCC(=O)N1CC[C@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]1c1cccnc1	1808315731	JSIHZOKOLMOCNY-SIIHOXLZSA-N	431.320	1.680	50	20	IDGD	
O=C1CC[C@H](C(=O)N2CC[C@H](CNC(=O)[C@@H](F)Br)[C@H]2c2cccnc2)N1	1808662290	XHPZADGMAVQGGP-QHSBEEBCSA-N	427.274	1.057	50	20	IDGD	
Cc1cccc(CC(=O)N2CCCC3(CCN(C(=O)c4ccc(B(O)O)cc4)CC3)C2)c1	1809248150	BVVBMGXTPMYNOR-UHFFFAOYSA-N	434.345	1.762	50	20	IDGD	
Cc1ccc(CC(=O)N2CCC3(CCCN(C(=O)c4cccc(B(O)O)c4)C3)CC2)cc1	1809976564	GCTKETJCCXVZTL-UHFFFAOYSA-N	434.345	1.762	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)C(=O)N(C)C)[C@@H]1c1cccnc1	1812775870	CNYSYZIUCVFBDN-SOUVJXGZSA-N	425.327	1.349	50	20	IDGD	
O=C(Cc1ccc2c(c1)CCO2)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1	1812824105	JPAPHUWWTFKKCW-CNNODRBYSA-N	443.931	1.865	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(O)nc(O)n3)sc2C1	1817099609	YQFXWDAOIPBXBV-RKDXNWHRSA-N	425.898	1.978	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc4ncnn4c3)sc2C1	1819402820	QGGADOCFRDJJKC-VXGBXAGGSA-N	434.909	1.665	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CO[Si](C)(C)C)CC2	1819691261	XYPRPIVXPLPKOX-VXGBXAGGSA-N	441.630	1.614	50	20	IDGD	
CCNC(=S)NCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCBr)[nH]n1	1821642333	LAFXZHHTVWPYQW-LBPRGKRZSA-N	445.387	1.671	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)n(C)n2)[nH]n1	1822186105	GJOPNTFNHXTVBT-SKDRFNHKSA-N	425.287	1.938	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)C[C@H]2NC(=O)NC2=O)CC1	1825069935	GHKFUXREJRMWBM-CABCVRRESA-N	426.945	1.469	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cn(C(C)(C)C)nn1)CC2	1826004135	XILYXOJOWCNEGY-QWRGUYRKSA-N	440.957	1.969	50	20	IDGD	
CCc1ccc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)cn1	1827051353	UJJKVPYNNZJTAZ-QHCPKHFHSA-N	449.360	1.871	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@H](O)CCl)CC3)c1	1827741921	WPJJGUCMOZZPNS-DZGCQCFKSA-N	436.921	1.927	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)c2ccncc2O)CC1	1829175689	BKHNYJVZEXORNS-FQEVSTJZSA-N	437.305	1.014	50	20	IDGD	
O=C(C1CC1)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)[C@H](O)CCl)C2)C1	1829444799	UMWPZWCOJKVEQU-GCJKJVERSA-N	449.935	1.448	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)C3CC(F)(F)C3)CCO2)C1	1829990413	CQCYJHZGERABFH-CVEARBPZSA-N	429.291	1.724	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3ccc(OC)nc3)CCO2)C1	1832581324	DDWJZGFOAWTCOE-LAUBAEHRSA-N	439.940	1.497	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3c(C)noc3C)CCO2)C1	1833065421	CCXFMFJQTHWNJN-FXAWDEMLSA-N	427.929	1.698	50	20	IDGD	
C[C@@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)c3ccon3)CC2)CC1	1833262585	WWLMUCIZPCGSEN-ZDUSSCGKSA-N	427.343	1.891	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@@H]3CCCCN3C)CC2)CC1	1833323556	PYBLMGJRGFQRSD-MOPGFXCFSA-N	429.005	1.296	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)[C@H](C)N(C)C(C)=O)CC2)CC1	1833533093	VSDCUUHKVQBDKK-HNAYVOBHSA-N	429.005	1.832	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)c3nc4ncccn4n3)CC2)CC1	1833533196	YFOGKAWVLWOOLJ-QGZVFWFLSA-N	447.971	1.717	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)C[C@@](C)(O)CC(=O)O)CC2)CC1	1833534663	GIXLKECUKYNZBQ-DYESRHJHSA-N	445.988	1.581	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3ccnc(F)c3)CC2)CC1	1833589632	NRGFALVNPFSTJJ-KRWDZBQOSA-N	426.920	1.660	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(Cl)s3)CCO2)C1	1834059308	UIHANLNILAKOMU-PXAZEXFGSA-N	437.345	1.725	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCBr)CCO2)C1	1834819490	PKZHJOCGZBADCW-CJNGLKHVSA-N	425.751	1.635	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)c1ccc2cncn2c1	1835617856	YQTBAZCGQBCHRP-LJQANCHMSA-N	433.940	1.119	50	20	IDGD	
Cc1ccccc1NCC(=O)N1CCO[C@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1	1835865303	MXRLUBVTFCIONO-JOCHJYFZSA-N	449.624	1.715	50	20	IDGD	
O=C(CCc1c[nH]c2ccccc12)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1	1836104865	WQJUMABYFXTBBB-SIKLNZKXSA-N	449.935	1.157	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(C(C)(C)C)n[nH]3)CCO2)C1	1837993922	MDJYTNMNFIDKOZ-VBKZILBWSA-N	442.944	1.031	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnc(Cl)s3)CCO2)C1	1838160914	CVDGFHNQBABXOZ-ZBEGNZNMSA-N	438.333	1.120	50	20	IDGD	
Cc1cccc(C(=O)N2CCC(OC3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)c1	1838590059	BCIZMQWAEMISND-UHFFFAOYSA-N	444.576	1.980	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3c(F)cccc3F)CCO2)C1	1838995871	WKWNSIGURANALM-QRWLVFNGSA-N	430.879	1.981	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc4c3cnn4C)C2)C1	1839144759	KBUYLJPGUCYCCH-UWJYYQICSA-N	434.924	1.661	50	20	IDGD	
C[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1)c1ccc(O)cc1	1839171394	UKBIOEFRXBBEND-ORAYPTAESA-N	431.316	1.756	50	20	IDGD	
COc1ccccc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839201953	OMXMHDFGXBAUPD-YJBOKZPZSA-N	445.285	1.456	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3(COC)CC3)C2)C1	1839962662	NBPUDRHROJOLIX-KDOFPFPSSA-N	433.343	1.043	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cncnc3C)C2)C1	1839965993	RCTPQANGLUXJEQ-CRAIPNDOSA-N	441.326	1.029	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C=C/c3cccs3)C2)C1	1840151997	TXMRFOJBTQXFTI-HLIGJIKWSA-N	428.938	1.472	50	20	IDGD	
CC(=O)Nc1ccccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1840724256	UDNFUGKGERJTLE-APWZRJJASA-N	427.860	1.249	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)C(=O)c2ccc(Cl)cc2)C1	1841332985	ZXHAFNQJOBMROT-UHFFFAOYSA-N	441.875	1.038	50	20	IDGD	
Cc1ccc2nc(C(=O)N3CCCC34CN(C(=O)CCC(=O)NN(C)C)C4)sc2c1	1842566911	XFZNUUDFXLRERM-UHFFFAOYSA-N	429.546	1.795	50	20	IDGD	
COc1ccc([C@@H]2C[C@H]2C(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)cc1	1844263524	NHUFGHAGUMPHNY-RBUKOAKNSA-N	449.511	1.314	50	20	IDGD	
C#CCCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)[C@H](O)CCl)C2	1845130165	LPQKWBULIYGUBI-JKSUJKDBSA-N	441.956	1.486	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@]2(NC(=O)OC(C)(C)C)CCOC2)C1	1845208865	CYJBKVXHZRUJBG-JLTOFOAXSA-N	445.944	1.127	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC2(CCCN2C(=O)c2cc(S(C)(=O)=O)ccc2F)C1	1845567338	SBKDCYFUYVRQPS-LLVKDONJSA-N	447.326	1.830	50	20	IDGD	
O=C(c1cnn2c(-c3cccs3)ccnc12)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl	1847560601	XQHDMTGYRTWDJQ-OFQRWUPVSA-N	445.932	1.873	50	20	IDGD	
CC(C)CC(=O)NNC(=O)C1CCN(S(=O)(=O)c2ccc3c(c2)OCCO3)CC1	10160107	UUPJVGNSQNENAG-UHFFFAOYSA-N	425.507	1.052	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)c2cccc(S(=O)(=O)Nc3ccccc3F)c2)n1	15462521	RNKRGNNMFKBMLC-UHFFFAOYSA-N	445.476	1.901	50	20	IDGD	
Cc1ccc([C@]2(C)NC(=O)N(CC(=O)NNC(=O)c3cc(Br)c[nH]3)C2=O)cc1	24122613	ZYVKWBLVEFURKY-SFHVURJKSA-N	448.277	1.314	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2ccc3c(c2)NC(=O)CO3)ccc1OC(C)C	24260449	JTHLOFZROXQLSD-UHFFFAOYSA-N	435.458	1.437	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(C)cc3c[nH]nc23)c1	116660432	ALROSGYZHFWPRN-UHFFFAOYSA-N	429.502	1.977	50	20	IDGD	
O=C(CC1CCCCC1)NCCNC(=O)NNC(=O)c1csc(N2CCOCC2)n1	725859670	FVRUKROEUPHUGD-UHFFFAOYSA-N	438.554	1.010	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCc1nc(C)c2ccccc2n1	726611240	RIHQVXUQCYDBFW-UHFFFAOYSA-N	441.517	1.684	50	20	IDGD	
Cc1ncc(S(=O)(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)[nH]1	727349877	ALWSJMQOGBTDIR-UHFFFAOYSA-N	441.516	1.204	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3cc(=O)c4ccccc4o3)cc2)CC1	728213284	IJZZTOVQWRVVIF-UHFFFAOYSA-N	442.497	1.486	50	20	IDGD	
CN(C)CCCOc1ccc(CNC(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1	728604124	VGLUTKVMRCZVFM-UHFFFAOYSA-N	428.489	1.933	50	20	IDGD	
CCc1c(C(=O)OCC(=O)NNC(=O)Cc2nc(C)cs2)cnn1Cc1ccccc1	728726214	VPILTNWRSJJUJI-UHFFFAOYSA-N	441.513	1.806	50	20	IDGD	
CCS(=O)(=O)NCCCNC(=O)NNC(=O)c1ccc(Br)cc1Cl	728954582	JTDUQWQZJYLKRU-UHFFFAOYSA-N	441.735	1.376	50	20	IDGD	
CC(C)(C)OC(=O)N(CCNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)C1CC1	728962017	USGUDSUREYGKKI-UHFFFAOYSA-N	447.540	1.423	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)N2CCN(C(=O)c3ccc(O)nc3)CC2)c1C	729363679	QWQAPGJCGSHRSQ-MOSHPQCFSA-N	437.500	1.744	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)c1ccccc1S(=O)(=O)N1CCOCC1	729450575	CRHPCVUHJKVCSP-UHFFFAOYSA-N	442.497	1.123	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)[C@@H]2C[C@@H](O)CN2C(=O)OCc2ccccc2)c1	729509490	QYGDBQIUKLWELJ-MOPGFXCFSA-N	441.484	1.602	50	20	IDGD	
CCC(=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O)c1ccc(OC(F)F)cc1	730569390	XWLBEIHHTIRXLO-UHFFFAOYSA-N	427.433	1.103	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)NCCc1nc(-c2ccc(Cl)cc2)no1	731683416	SEVDRFWCGKBUSA-UHFFFAOYSA-N	432.824	1.286	50	20	IDGD	
CC[C@@H](C)[C@H](NC(=O)N1CCCC1)C(=O)NNC(=O)c1cc(OC)c(OC)c(OC)c1	731891674	BJRPIWBLYVZUHL-DYVFJYSZSA-N	436.509	1.694	50	20	IDGD	
CC(C)c1ccc(-n2c(NNC(=O)[C@H](C)NS(C)(=O)=O)nc3ccccc3c2=O)cc1	733365734	PZSLDJVECOFMMW-AWEZNQCLSA-N	443.529	1.890	50	20	IDGD	
O=C(NC[C@H]1CN(Cc2ccccc2)CCO1)NNC(=O)c1cnn(-c2ccccc2)c1	733639710	GPCPUDVSMXIAMA-NRFANRHFSA-N	434.500	1.717	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)NCCc1nc(-c2cccc(Cl)c2)no1	734168617	YPEIIDQYWWUFGW-UHFFFAOYSA-N	432.824	1.286	50	20	IDGD	
O=C(NNc1ncccc1Cl)[C@H]1CCCN1S(=O)(=O)c1cccc([N+](=O)[O-])c1	734247577	QBCXGHWXGBSXGG-CQSZACIVSA-N	425.854	1.940	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)[C@H]2CC(=O)Nc3cc(F)ccc32)CC1	734825259	XNCRZONGTOLJCD-HNNXBMFYSA-N	449.483	1.981	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)[C@H]2CCC[C@@H](C(F)(F)F)C2)CC1	735118894	ZKTBRYIYKRFSOG-UONOGXRCSA-N	449.499	1.830	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2ccc(Cl)nc2)cc(NS(C)(=O)=O)c1OC	742548695	IMKJFLBSWRTNRL-UHFFFAOYSA-N	428.854	1.199	50	20	IDGD	
CCOC(Cn1cc(C(=O)NNC(=O)c2cccc(Br)c2)nn1)OCC	742769825	QQTOJHORDZPNHW-UHFFFAOYSA-N	426.271	1.515	50	20	IDGD	
CN(CC(=O)NNC(=O)c1cccc(Br)c1)S(=O)(=O)c1ccccc1	742771877	GTIYDHHJURSKRH-UHFFFAOYSA-N	426.292	1.531	50	20	IDGD	
CCc1ccccc1NC(=O)CN1CCN(CC(=O)NNC(=O)c2ccc(C#N)cc2)CC1	744385922	ZPLARSYFKHBLMN-UHFFFAOYSA-N	448.527	1.138	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CN2CCCN(S(=O)(=O)c3ccccc3)CC2)c1	744391509	WKLBYVNBLWWNQL-UHFFFAOYSA-N	430.530	1.153	50	20	IDGD	
Cc1ccc(C(=O)N[C@H](C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)C(C)C)cc1	744450729	IDJNVHKXMORDQB-FQEVSTJZSA-N	436.468	1.626	50	20	IDGD	
O=C(Cn1ccc(C(F)(F)F)n1)NNc1ccccc1S(=O)(=O)N1CCOCC1	744622002	UOLVSIRMKGHNAP-UHFFFAOYSA-N	433.412	1.066	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc(Br)ccc1Br)N1CCOCC1	745833848	GSEOHZMXFFMBQY-UHFFFAOYSA-N	443.117	1.447	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)CCN/C(O)=C2\N=CC=CC2=O)c1	746215261	MJVXQVDVEURNIA-BMRADRMJSA-N	437.250	1.135	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)C2CC(OCc3ccccc3)C2)c1	746816147	NAMUHPMBLZTJMN-UHFFFAOYSA-N	431.514	1.693	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)Cc2ccncc2)c1	747429529	PTRHZFDNJJCIMN-UHFFFAOYSA-N	440.481	1.895	50	20	IDGD	
Cc1nc(Cl)cc(NNC(=O)C2CCN(S(=O)(=O)c3c(C)noc3C)CC2)n1	747979549	FXDJTSZQPVKEHE-UHFFFAOYSA-N	428.902	1.587	50	20	IDGD	
CC(=O)c1cccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)CC(F)(F)F)CC2)c1	748864650	GPTQAZBEQYNRBM-UHFFFAOYSA-N	435.424	1.390	50	20	IDGD	
CC[C@H](Oc1cccc(C)c1)C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	749536280	MSVBFCNSEULNMA-SFHVURJKSA-N	447.561	1.627	50	20	IDGD	
NS(=O)(=O)c1ccc(NC(=O)NNc2nc(Br)cn3ccnc23)cc1	749985035	DQYMSGSGMTWIDM-UHFFFAOYSA-N	426.256	1.288	50	20	IDGD	
Cc1nn(-c2cncc3nnnn23)c(C)c1CC(=O)NNc1ccc(OC(F)(F)F)cc1	750424986	WNZWQQIKJYRTMS-UHFFFAOYSA-N	447.381	1.906	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)[C@H]1CCCCN1C(=O)OCc1ccccc1	751212332	QLYUKARBIAFHQI-MRXNPFEDSA-N	444.513	1.817	50	20	IDGD	
COc1cc(I)c(C(=O)NNC(=O)c2ccncc2)cc1OC	751281613	BJTZTGLDFYTBNJ-UHFFFAOYSA-N	427.198	1.778	50	20	IDGD	
CN(C[C@@H](O)CN1CCOCC1)C(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccccc1	751431850	RZZJWJCQNSAIBO-VOSMRYOYSA-N	448.527	1.522	50	20	IDGD	
COc1cc(OC)cc(N2C[C@@H](C(=O)NNC(=O)CNc3ccc(C)cc3C)CC2=O)c1	752793285	RXWKHLBDFJFKLR-INIZCTEOSA-N	440.500	1.933	50	20	IDGD	
COc1cc(OC)cc(N2C[C@H](C(=O)NNC(=O)CNc3ccc(C)cc3C)CC2=O)c1	752793313	RXWKHLBDFJFKLR-MRXNPFEDSA-N	440.500	1.933	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)c1ccnc(O[C@H]2CCOC2)c1	754009875	NBODYRTUTOWPHO-HNNXBMFYSA-N	436.262	1.852	50	20	IDGD	
Cn1cc(C=NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c2ccccc21	755467671	SHVYYIVUVZRKEQ-UHFFFAOYSA-N	426.498	1.963	50	20	IDGD	
CCN1CCN(C(=O)c2ccc(NC(=O)NNC(=O)c3ccc4c(c3)OCO4)cc2)CC1	756253509	UDCZVIVVNPXBNZ-UHFFFAOYSA-N	439.472	1.660	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)Nc2cccc(S(=O)(=O)NC3CC3)c2C)cc1	756703560	CUEKWYVJIZHJRS-UHFFFAOYSA-N	432.502	1.976	50	20	IDGD	
CNC(=O)Cn1ccc2ccc(NC(=O)NNC(=O)c3nn(-c4ccccc4)cc3O)cc21	756763555	XDVWVVIFRNXEFR-UHFFFAOYSA-N	447.455	1.745	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)COc2ccccc2F)cc1NS(C)(=O)=O	756781488	FMVBQNSOIAVLJZ-UHFFFAOYSA-N	426.426	1.438	50	20	IDGD	
O=C(CN1C(=O)c2cc(Br)ccc2S1(=O)=O)NNC(=O)c1ccccc1	757751288	SDEXGOLRJSEQNF-UHFFFAOYSA-N	438.259	1.055	50	20	IDGD	
Cc1ccc(Cl)cc1N1CC[C@H](CNC(=O)NNC(=O)C(=O)Nc2ccccn2)C1	758740232	MAIYLMGPUVCDST-CQSZACIVSA-N	430.896	1.839	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)c2cc(S(=O)(=O)Nc3ccccc3F)c[nH]2)nc1	759737783	GKJFGXUGIMKPOT-UHFFFAOYSA-N	433.421	1.893	50	20	IDGD	
O=C(NN=C1CCOc2c1cc(Br)cc2[N+](=O)[O-])[C@H]1CCS(=O)(=O)C1	761805401	ZZPYEBFYVQQIHU-QMMMGPOBSA-N	432.252	1.395	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C[C@@H](C)/N=C2/NS(=O)(=O)c3ccccc32)n1	762892635	AGILTCCQXJETHK-CYBMUJFWSA-N	431.522	1.283	50	20	IDGD	
O=C(NNC(=O)c1cccnc1)C(=O)Nc1cc(Br)ccc1-n1cccn1	763494392	BPHJJGKRHUMBQP-UHFFFAOYSA-N	429.234	1.430	50	20	IDGD	
O=C(NNC(=O)c1ccccc1O)C(=O)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1	763531495	OHJFRZRBFIJLEO-KRWDZBQOSA-N	448.483	1.435	50	20	IDGD	
CCOc1cc(C(=O)N(C)C)ccc1NC(=O)C(=O)NNC(=O)c1c[nH]c2ccccc12	763536877	WMXRAFMGUMBREO-UHFFFAOYSA-N	437.456	1.668	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(-c3nccc(C)n3)c2)cc1OC	763551246	NEEMXSVZOGDYDO-UHFFFAOYSA-N	435.440	1.869	50	20	IDGD	
CCc1nnc(-c2cccc(NC(=O)C(=O)NNC(=O)[C@H]3COc4ccccc4O3)c2)o1	763577598	HZOAREPIWCTLDD-MRXNPFEDSA-N	437.412	1.225	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2cc(C)n(-c3ccccc3)c2C)c(OC)n1	763601830	IRRFOXKBIIXIFX-UHFFFAOYSA-N	437.456	1.906	50	20	IDGD	
CNC(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc(C)n(-c3ccccc3)c2C)cc1	763602490	QRILFTTZGNCZSU-UHFFFAOYSA-N	447.495	1.782	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2c(C)nc3ccccn23)ccc1Cl	763629877	QVDHYZKMHKFMFU-UHFFFAOYSA-N	429.820	1.482	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2-c2ccccc2)c(=O)n(C)c1	763643715	JHUZVKCUMSINLZ-UHFFFAOYSA-N	434.452	1.526	50	20	IDGD	
CCn1nnnc1-c1cccc(NC(=O)C(=O)NNC(=O)COc2cc(C)ccc2C)c1	763668084	HULMVGBMVCRCAB-UHFFFAOYSA-N	437.460	1.142	50	20	IDGD	
CN(C)C(=O)c1cc(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)ccc1Cl	763673323	CRXVINVVSFBLFO-UHFFFAOYSA-N	443.847	1.078	50	20	IDGD	
COc1cc2nc(C)sc2cc1NC(=O)C(=O)NNC(=O)COc1ccccc1F	763680220	SQSLEGPUKOSFPK-UHFFFAOYSA-N	432.433	1.917	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2c(F)c(F)c(F)c(F)c2F)cc1	763682108	RLKQLSPGYHMQCP-UHFFFAOYSA-N	428.273	1.419	50	20	IDGD	
O=C(NCc1ccc(N2CCCS2(=O)=O)cc1)NNC(=O)c1cccc2ncccc12	763695566	OSSFVVIVNVINBY-UHFFFAOYSA-N	439.497	1.919	50	20	IDGD	
O=C(NNC(=O)c1cc2c(s1)CCC2)C(=O)Nc1ncn(Cc2ccc(Cl)cc2)n1	763783027	JYAKXUIXSHWPKL-UHFFFAOYSA-N	444.904	1.930	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2ccc3ncccc3c2)c2ccccc2c1=O	763785623	KDFJJRCZAWTYIV-UHFFFAOYSA-N	430.424	1.364	50	20	IDGD	
COC(=O)c1cc(F)c(F)cc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccc(F)cc1	763864590	DDZYBNJXJISGBR-VIFPVBQESA-N	439.346	1.444	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)NNC(=O)C(=O)Nc1ccc(N2CCOCC2)c(F)c1	763865444	PZGBNDGLCCMHTM-UHFFFAOYSA-N	439.447	1.472	50	20	IDGD	
COCCn1ccc2ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc3ccc(F)cc3)cc21	763866438	PPTJZYCFBDBGCA-AWEZNQCLSA-N	442.447	1.980	50	20	IDGD	
C[C@@H]1Oc2ccc(NC(=O)C(=O)NNC(=O)c3cc4c(s3)CC[C@@H](C)C4)cc2NC1=O	763943084	QRDHXCNNXYXXRC-MNOVXSKESA-N	442.497	1.992	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3ccccc3OCCC(N)=O)cc2C1	763949246	OEPYDQVOAIUQBG-GFCCVEGCSA-N	444.513	1.527	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccn(-c2ncccc2C(F)(F)F)n1	763957561	DATOFKSHBMKINI-UHFFFAOYSA-N	432.362	1.994	50	20	IDGD	
COC(=O)c1c(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)sc(C)c1C	763994219	BKSCAWMVXRKARU-UHFFFAOYSA-N	443.279	1.642	50	20	IDGD	
COc1cccc(Oc2ccc(NC(=O)C(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)cc2)c1	763997072	IDNOMRBTHTYDRV-CYBMUJFWSA-N	447.469	1.008	50	20	IDGD	
O=C(NNC(=O)c1cccc(Br)c1)C(=O)Nc1cccc(C(=O)NC2CC2)c1	764063849	YWPXFLSZMVGJCT-UHFFFAOYSA-N	445.273	1.741	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(N3CCN(C)CC3)c(Cl)c2)c(O)c1	764105168	KZJLZJFKJHWXDD-UHFFFAOYSA-N	445.907	1.506	50	20	IDGD	
CC(C)COC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)c1	764152055	OEBSVJQGIHVADJ-SFHVURJKSA-N	440.456	1.981	50	20	IDGD	
O=C(NNC(=O)c1cccc(OC(F)F)c1)C(=O)Nc1ccc(O[C@@H]2CCOC2)cc1	764259750	NMIJPRVRJJXOOH-MRXNPFEDSA-N	435.383	1.855	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)Cc2cccnc2)cc1I	764267012	QICUZEAQAFCKBT-UHFFFAOYSA-N	438.225	1.323	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2O)nn1-c1cccc(F)c1	764276081	YTOCJSIHVIQXAH-UHFFFAOYSA-N	427.392	1.190	50	20	IDGD	
Cc1cc(NC(=O)CSCC(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)no1	764334539	WRCGYSHSMMUFLZ-UHFFFAOYSA-N	439.444	1.968	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)C(=O)Nc1cc(F)ccc1OC[C@H]1CCCO1	764367799	ZUSPAYZFROSHPV-QGZVFWFLSA-N	445.447	1.686	50	20	IDGD	
O=C(NNC(=O)C(F)(F)Oc1ccccc1)C(=O)Nc1ccc(CN2CCCC2=O)cc1	764380189	RBLCJZQUHBYYGJ-UHFFFAOYSA-N	446.410	1.567	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc4c(c3)CC(=O)N4)n[nH]2)cc1	764384618	GUYBYQXUDSDOPC-UHFFFAOYSA-N	432.440	1.533	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1ccn(-c2cccc(C(F)(F)F)c2)n1	764400493	QAOLOXRXMOCNNE-LLVKDONJSA-N	443.382	1.029	50	20	IDGD	
O=C(NNC(=O)c1ccnn1C1CCCC1)c1ccc(S(=O)(=O)N2CCCC2)cc1	764545071	RFVWXRQSNAUFKR-UHFFFAOYSA-N	431.518	1.858	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)c2ccc(C#N)cc2)cc1F	765637391	RKVIXGPLYQGWOK-UHFFFAOYSA-N	426.451	1.082	50	20	IDGD	
C[C@H](Oc1ccc(F)c(F)c1)C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765738663	MECMRAAKMDYIJY-HNNXBMFYSA-N	446.454	1.338	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H]2CCO[C@H](c3ccccc3)C2)c1	765915465	JHQBBQYRUPVDPL-MJGOQNOKSA-N	446.529	1.801	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)N[C@@H]2CCC[C@H]2C(=O)NC)c2ccccc2c1=O	766282908	CKHZUTGERKCVLC-HZPDHXFCSA-N	428.493	1.055	50	20	IDGD	
CN(C)c1ccc(C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)cc1	768291312	PVAHEPHYUYQTEN-UHFFFAOYSA-N	429.952	1.985	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(C)c(C(=O)NNc2ccc(OC)cc2[N+](=O)[O-])c1	768328758	HSYWHZURIROBKS-UHFFFAOYSA-N	438.462	1.593	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc3c2CCN3C(C)=O)o1	769264165	BUKUVKQWRTWWSM-UHFFFAOYSA-N	441.488	1.430	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](C(=O)OCC(=O)NNC(=O)c1cccc(C#N)c1)C(C)(C)C	769611492	LJKDTEUACIVTGL-MRXNPFEDSA-N	432.477	1.802	50	20	IDGD	
NS(=O)(=O)c1ccc(C(=O)NNC(=O)c2ccc(COc3ccccc3)o2)c(F)c1	769737552	CVVZWTMGVRYDKB-UHFFFAOYSA-N	433.417	1.720	50	20	IDGD	
CSCCNC(=S)NNC(=O)[C@H]1CCCN(S(=O)(=O)Cc2ccccc2)C1	769765017	HUNRCNMUMYPMBM-HNNXBMFYSA-N	430.621	1.087	50	20	IDGD	
CSCCNC(=S)NNC(=O)[C@@H]1CC(=O)N(c2ccccc2Br)C1	769770842	ZHXQAAXQPOGJGT-SNVBAGLBSA-N	431.381	1.660	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)NCC3(NC(=O)OC(C)(C)C)CCCCC3)nc21	770366239	GXUBBHOMJTUSAF-UHFFFAOYSA-N	434.501	1.923	50	20	IDGD	
CC(C)(C)C(=O)NCCc1ccc(S(=O)(=O)NNC(=O)c2ccc(C#N)cc2)s1	770634764	KZGKPKFWRPOCHX-UHFFFAOYSA-N	434.543	1.948	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)N1CCC(C(=O)N2CCOCC2)CC1	770648110	FEGFYZZUEXDTRT-CQSZACIVSA-N	438.912	1.419	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ccc(Br)c(F)c2)cc1S(N)(=O)=O	770816074	OXCVAWQIYONKMH-UHFFFAOYSA-N	445.270	1.626	50	20	IDGD	
COc1ccc(C)cc1[C@@]1(C)NC(=O)N(CC(=O)NNc2ccccc2[N+](=O)[O-])C1=O	771217972	VXDOMTOSPUNFHD-HXUWFJFHSA-N	427.417	1.822	50	20	IDGD	
O=C(NNc1cc(F)c(F)cc1F)C(=O)Nc1cnn(Cc2nnc3n2CCCC3)c1	773678903	TYTYQASAWBATOK-UHFFFAOYSA-N	434.382	1.358	50	20	IDGD	
C[C@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(NC(=O)C(=O)NNc3ncccn3)cc2)C1	773723637	CIIDYTKXTQVYQV-OKILXGFUSA-N	432.506	1.225	50	20	IDGD	
CCOCCONC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	776197368	RKUDLJFDXHYKON-UHFFFAOYSA-N	436.490	1.077	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)[C@@]1(F)CCN(C(=O)OCc2ccccc2)C1	776972990	HETXOKJIHGJUMC-JOCHJYFZSA-N	439.447	1.775	50	20	IDGD	
CCCCSc1ccc([N+](=O)[O-])cc1C(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1	777367287	FZGXZXXPQXOYNR-LLVKDONJSA-N	430.508	1.618	50	20	IDGD	
Cc1nn(C)c(-n2cccn2)c1C(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12	778296563	YBIOGKQQQRFJID-UHFFFAOYSA-N	434.460	1.280	50	20	IDGD	
O=C(NNC(=O)[C@@H](O)[C@@H](O)c1nc2ccccc2s1)c1ccc(Br)s1	779488140	CUGWDESRWKDWKX-NWDGAFQWSA-N	442.316	1.976	50	20	IDGD	
COc1ccc(NNC(=O)[C@H]2CCCCN2S(=O)(=O)c2ccc([N+](=O)[O-])cc2)nc1	781521700	WINLPYVPSOVXGV-MRXNPFEDSA-N	435.462	1.685	50	20	IDGD	
CC(=NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1)c1ccc(N2CCNC2=O)cc1	782158991	NVJTUVAETHYIMR-UHFFFAOYSA-N	435.893	1.671	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)C(=O)Nc1c(F)cc(Cl)cc1F	782896437	ILMVNHOELYRPJZ-UHFFFAOYSA-N	445.835	1.311	50	20	IDGD	
O=C(NNc1cncc(Cl)n1)C(=O)Nc1ccnn1Cc1cnn(-c2ccccc2)c1	783266646	WYCRYTWOGIQEGT-UHFFFAOYSA-N	437.851	1.642	50	20	IDGD	
CC1CCN(c2ccc(NC(=O)C(=O)NNC(=O)CNC(=O)c3cccs3)cc2)CC1	784003837	PJTSFBIVJUGTHU-UHFFFAOYSA-N	443.529	1.500	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)C(=O)Nc1ccc(F)c(F)c1F	784213399	LSWHCKUYKVTNLO-UHFFFAOYSA-N	428.392	1.626	50	20	IDGD	
O=C(NNC(=O)c1cc(I)c(Cl)cc1Cl)C(=O)NC1CC1	784832336	NZVUBXQOEKCOPI-UHFFFAOYSA-N	442.040	1.638	50	20	IDGD	
CNC(=O)Cn1nc(NC(=O)C(=O)NNc2ccc(Br)cc2Cl)cc1C	784840893	HARQHFKRDCFEFV-UHFFFAOYSA-N	443.689	1.435	50	20	IDGD	
O=C(NNc1ccc(C(F)(F)F)nn1)C(=O)Nc1cccc(Cl)c1-n1cncn1	784891450	QDESMARZRTWJDS-UHFFFAOYSA-N	426.746	1.811	50	20	IDGD	
CCCN1C(=O)CCc2cc(NC(=O)C(=O)NNC(=O)Cc3cn4ccccc4n3)ccc21	785067299	JUUWVMAPHKVOOV-UHFFFAOYSA-N	448.483	1.352	50	20	IDGD	
CON(C)S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2cc(F)c(F)c(F)c2)cc1	785083080	DLNFOPSTSUKGIW-UHFFFAOYSA-N	432.380	1.368	50	20	IDGD	
O=C(NNc1c(F)cc(C(=O)NC2CC2)cc1F)C(=O)Nc1cccc(-n2ccnn2)c1	785099564	ITDPWJRNIOGGTH-UHFFFAOYSA-N	441.398	1.520	50	20	IDGD	
COCCOc1cccc(NC(=O)C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)c1	785101715	DRNAZXXHTJYQAI-UHFFFAOYSA-N	448.426	1.964	50	20	IDGD	
COc1ccc([C@]2(C)NC(=O)N(NC(=O)COC(=O)/C(C#N)=C\c3ccccc3)C2=O)cc1	785365827	MOQUTKZCLLCUKF-RUCLTWSYSA-N	448.435	1.644	50	20	IDGD	
Cc1cccc(OCCCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1C	787400422	QGROYJMZNZKCMN-UHFFFAOYSA-N	448.545	1.967	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)cc1N1CCNC1=O	787541952	YOFJCXMSQSEVAB-UHFFFAOYSA-N	447.455	1.314	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NN=Cc2ccc3c(c2)NC(=O)CO3)c1	788698899	NWYQECIALZMKAA-UHFFFAOYSA-N	430.486	1.812	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(-n3cccn3)cc2C)cc1	789584103	CXPFCHVLQOMPDV-MRXNPFEDSA-N	449.467	1.937	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccccc1	790065845	SXTSHUAIKOIQIF-INIZCTEOSA-N	427.523	1.166	50	20	IDGD	
COCCNC(=O)CSc1ccccc1C(=O)NNC(=O)c1ccc2c(c1)OCCO2	791012543	OJZMUIPRNZNEOR-UHFFFAOYSA-N	445.497	1.387	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)[C@](C)(O)Cn1cc(C(F)(F)F)ccc1=O	792016515	RNMNWEJVZZSTKO-ADLMAVQZSA-N	445.369	1.372	50	20	IDGD	
COC(=O)c1nc([C@@H]2CCCN2C(=O)NNC(=O)CNC(=O)c2ccco2)sc1C	792880987	BUPOCBOETUFOBR-NSHDSACASA-N	435.462	1.139	50	20	IDGD	
COc1ccc(Cn2cc(NC(=O)C(=O)NNC(=O)c3ccc(Cl)cc3O)cn2)cc1	793026317	PVDLJDCTZPHCIQ-UHFFFAOYSA-N	443.847	1.699	50	20	IDGD	
Cc1cc(F)c(C(=O)O)cc1S(=O)(=O)NNC(=O)CCCNC(=O)OC(C)(C)C	793415104	IROOWSPCXFZLPN-UHFFFAOYSA-N	433.458	1.447	50	20	IDGD	
COC(=O)c1cccc(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)c1OC(C)C	799258770	LGTLQDQBWKRZFL-UHFFFAOYSA-N	447.419	1.564	50	20	IDGD	
CCOCCCn1c(NNC(=O)c2cc(F)cc3nn[nH]c23)nc2ccccc2c1=O	800494548	XYTCUNCQAARUFY-UHFFFAOYSA-N	425.424	1.990	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2cc(Br)cn2C)c(C)c(OC)c1	800623358	NNZFUISNZJZXQT-UHFFFAOYSA-N	439.266	1.513	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)c1cncc(-n2ccnn2)c1	801795861	FZGJHRPMWIGJGQ-LLVKDONJSA-N	431.250	1.653	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)Nc2ccc3c(c2)OCO3)ccc1OCC(=O)OC	802105836	IHAPQCQKXQWJHY-UHFFFAOYSA-N	431.401	1.832	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccc(NC(=O)CC(F)(F)F)cc2)n1	802566141	BEZRGMGGXIWOQW-UHFFFAOYSA-N	440.382	1.177	50	20	IDGD	
CCc1nnc(NC(=O)[C@H](C)[C@H](C)NC(=O)NNC(=O)[C@H]2COc3ccccc3O2)s1	805880950	SNVZBNXDLJLOPG-UHIISALHSA-N	448.505	1.234	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(N2CCOCC2)c(NC(=O)NNc2ncccc2F)c1	806367279	KYOZXFQTDRNSKC-UHFFFAOYSA-N	438.485	1.456	50	20	IDGD	
CNS(=O)(=O)c1cc(NC(=O)NNC(=O)c2cccc(OC(F)F)c2)ccc1F	806546506	RWWBSKYYAMUZPL-UHFFFAOYSA-N	432.380	1.802	50	20	IDGD	
O=C1COC[C@@H](C[C@H]2CN(C(=O)C(=O)NNc3ncccc3Cl)c3ccccc32)N1	806967355	DPCXJDRDTYANQJ-QWHCGFSZSA-N	429.864	1.214	50	20	IDGD	
CSc1nnnn1-c1cccc(NC(=O)C(=O)NNc2nccnc2C2CCC2)c1	807461457	FMNXYHKOCOMASI-UHFFFAOYSA-N	425.478	1.524	50	20	IDGD	
COC(=O)c1c(F)ccc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c1C	810387042	CPTDBZFQBPZFQY-UHFFFAOYSA-N	439.403	1.506	50	20	IDGD	
N#Cc1ncn(-c2ccccc2NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2F)n1	810389618	JYRGIXRBKYOCPR-UHFFFAOYSA-N	427.783	1.331	50	20	IDGD	
COC(=O)c1c(F)ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2F)c1F	810390739	XNEUVSSQVVNVEK-UHFFFAOYSA-N	429.738	1.944	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2ccc3c(c2)C(C)(C)CO3)cc1OC	811337511	PKYIASGPISMWPY-UHFFFAOYSA-N	428.441	1.992	50	20	IDGD	
C/C(C=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O)=C/c1ccccc1OC(F)F	811636877	NJTMKYQENUEINH-LCAGBKGCSA-N	439.444	1.378	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)N1CCN(c2ccccc2)CC1	812560202	RLPYSKVIDKJUFE-HNNXBMFYSA-N	430.892	1.604	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NN=Cc2c(C)nn(C)c2N)c1	814688824	MWNLBLAYIHWTQP-UHFFFAOYSA-N	442.501	1.884	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)cc1)[C@H]1C[C@H]1C	815608320	XKGLWTHHFRTJHU-KUHUBIRLSA-N	448.483	1.424	50	20	IDGD	
O=C(c1cnc2c(F)ccc(F)c2c1)N1CCN(S(=O)(=O)CBr)CC1	815964579	MUBPLXADWWWIIR-UHFFFAOYSA-N	434.262	1.953	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@H]2CCCN(c3ccccc3)C2=O)cc1	816596944	XZBJFZPPIRDESZ-QGZVFWFLSA-N	430.486	1.686	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)c1cc(Cl)ccc1Cl)C(=O)NNc1nc[nH]n1	816633280	VUJTWDJZUAFPBK-JTQLQIEISA-N	439.350	1.655	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)[C@H](c1cccc(F)c1)N1CCOCC1	817053679	BVNXPYKZSKFJPR-IBGZPJMESA-N	436.509	1.593	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)c2ccc(CS(N)(=O)=O)cc2)c1	818763495	PDOCUOLIJRZPPI-UHFFFAOYSA-N	442.291	1.781	50	20	IDGD	
CCS(=O)(=O)N[C@@H](CCSC)C(=O)NNC(=O)[C@@H](C)Oc1cccc(C)c1C	818857716	HEKBCPIAPGRXFE-CABCVRRESA-N	431.580	1.279	50	20	IDGD	
CSCC[C@@H](NC(=O)c1ccccc1Br)C(=O)N1CC[C@H](B(O)O)C1	864233173	HPXPFUGESSLOQI-SMDDNHRTSA-N	429.145	1.376	50	20	IDGD	
O=C(NCCCN1CCCCC1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	916196033	KLDZYGHYEOISKH-UHFFFAOYSA-N	437.566	1.291	50	20	IDGD	
O=C(NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)NC1CCN(C2CC2)CC1	916239672	GCDQEAOGQQMCFS-UHFFFAOYSA-N	435.550	1.042	50	20	IDGD	
CCn1cnc2c1c(=O)n(CC(=O)NN=Cc1cccc(F)c1)c(=O)n2Cc1ccccc1	916331768	KIWPFWCLSOADPA-UHFFFAOYSA-N	448.458	1.717	50	20	IDGD	
O=C(NCc1ccnc(OCC(F)(F)F)c1)NNC(=O)c1ccc2c(c1)OCCO2	916396465	SAJJFDPUQUPLFI-UHFFFAOYSA-N	426.351	1.938	50	20	IDGD	
C[C@@H]1C[C@@H](C)CN(CCCNC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)C1	916461201	YEROPTIMIQQRGJ-NHCUHLMSSA-N	444.624	1.897	50	20	IDGD	
COc1cc(CNC(=O)NNC(=O)c2cc3c(s2)CC[C@@H](C)C3)ccc1OCC(N)=O	916641148	ZOSKBTHXIUHYFE-GFCCVEGCSA-N	446.529	1.890	50	20	IDGD	
NC(=O)[C@@H]1CC(C(=O)NNC(=O)Cc2ccc3ccccc3c2)=NN1c1ccc(F)cc1	917197860	PVROKGORODYDLP-FQEVSTJZSA-N	433.443	1.789	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc2c(c1)CCCC2)NNC(=O)c1ccc(Cl)nc1	917253281	AVGUZEALAZQIBK-UHFFFAOYSA-N	436.921	1.743	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)[C@@H]2CCN(c3cccc(Br)c3)C2=O)n1	917391847	JNJYZLGDKMIKER-HNNXBMFYSA-N	434.294	1.463	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)c1cc(Br)c2c(c1)OCO2	919805847	VSRSCVDFAGCIQH-UHFFFAOYSA-N	431.202	1.901	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1)N[C@H]1CCS(=O)(=O)C1	919961162	VLGBJYIMTOFSLV-ZETCQYMHSA-N	435.833	1.038	50	20	IDGD	
CCN(CC)C(=O)c1ccc(S(=O)(=O)NNC(=O)c2c(C)nc3ccccn23)cc1	920308814	FTBQBSGBPIZKHM-UHFFFAOYSA-N	429.502	1.748	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1c[nH]c(Br)c1	1252332349	VQNPMUXLBXUFEA-UHFFFAOYSA-N	429.296	1.555	50	20	IDGD	
CC(C)[C@H](C(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1)N1C[C@H](C)O[C@H](C)C1	1318667454	FMSRJHYZKWCBAL-SOLBZPMBSA-N	440.585	1.915	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNS(=O)(=O)c1cnc2c(cnn2C)c1	1324179394	VVBYOUQFRLNFIK-CYBMUJFWSA-N	425.470	1.899	50	20	IDGD	
Cc1nc[nH]c1CSCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](C)Br)CCO2	1778913878	UOWVPCMATOSRHH-YVEFUNNKSA-N	445.383	1.565	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc3n(n2)CCCO3)C1	1779036415	RIAPLHUDTSXPLA-AKCHCHLHSA-N	440.928	1.047	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(CCN(C(=O)/C=C/C(=O)NCc3ccco3)C2)C1	1779209372	XYHKDBVWTWMIPI-BXKJMJEDSA-N	449.580	1.133	50	20	IDGD	
CC(C)(C)n1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)C(Cl)Cl)C3)nn1	1780195382	ZQKXPXASECJYDW-FZKQIMNGSA-N	432.352	1.964	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)CCC(=O)N3CCCC3)CCO2)C1	1781224713	NJHNOUHLMSGQJE-MOPGFXCFSA-N	434.364	1.455	50	20	IDGD	
CC(=O)N/C(C)=C/C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Br)C2	1781463801	QFHBWZDVAZPMGH-PAKQUKTESA-N	434.306	1.231	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)COc1cccnn1)C2	1782002949	YIEPWXYVFKYRTD-HBUWYVDXSA-N	441.326	1.153	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)COCc1ccccc1)C2	1782170613	SNBWPWGBMGYFIY-WOIUINJBSA-N	438.952	1.971	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@]1(F)CCCCC1(F)F)CCO2	1783875641	SADLCKUKTUCYJD-IAOVAPTHSA-N	426.863	1.988	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cccc3cccnc13)CCO2	1783934977	NXZWNPQUJJOHBG-QHCPKHFHSA-N	439.516	1.051	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cc3cc(F)ccc3[nH]1)CCO2	1783935221	PBZYFIDMPDJOJE-JOCHJYFZSA-N	445.495	1.124	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1ccc3ccoc3c1)CCO2	1783937937	YQEIXNVLDNDFQA-QFIPXVFZSA-N	428.489	1.249	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN3CCC(C)CC3)[C@H]2C1	1784320841	PTGPIEZXDWEDFT-XSLAGTTESA-N	444.414	1.872	50	20	IDGD	
COc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]3C2)ccc1[N+](=O)[O-]	1787450489	ZPHGTIUTWDNMOQ-APYUEPQZSA-N	429.832	1.731	50	20	IDGD	
CCCc1onc(C)c1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](Cl)COC)C[C@@H]21	1787655396	SFTHDBGDPOAVIZ-JKQORVJESA-N	427.929	1.783	50	20	IDGD	
CC[C@H](C)[C@@H](N)C(=O)NC1(c2ccc(NC(=O)c3cnccc3C(=O)NN)cc2)CCC1	1789522888	SNYJLZOIUBQSOW-IFXJQAMLSA-N	438.532	1.806	50	20	IDGD	
COc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Br)C[C@@H]32)ccc1O	1789602850	DMHOTOKMCBKAFZ-GVAFMPQTSA-N	445.285	1.685	50	20	IDGD	
COc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Cl)C[C@@H]32)cc1N(C)C	1789817346	RQJMFLAFGGOEDC-USJZOSNVSA-N	427.904	1.889	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)c1cc2cccnn2c1	1790431451	UGASYEAGMRIUTC-JQFCIGGWSA-N	435.322	1.713	50	20	IDGD	
CCn1nc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]3C2)cc1C	1791059364	WXKMFQBEFRQMCR-HOSILWTGSA-N	427.343	1.588	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21	1791060996	NXSOYCIZHSURPZ-AJBSGBCOSA-N	430.112	1.440	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(-n4ccnc4)ccn3)C[C@@H]21)C(Cl)Cl	1791296640	QCRYVTDBWGMXRI-NOLJZWGESA-N	438.315	1.664	50	20	IDGD	
COC(=O)[C@H]1CC[C@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@](C)(Cl)CCl)C3)CC1	1793608998	HXJSLGBBXQCGJY-HLROQWKMSA-N	449.375	1.792	50	20	IDGD	
CC(C)N[C@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)CBr)C2)C(C)C	1795713176	FRKWLEXTWLSTKN-KSWRQPAISA-N	432.403	1.630	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cn1cc(Cl)cn1	1795758421	XGZFORJREHTLGX-MCYUEQNJSA-N	433.734	1.157	50	20	IDGD	
COCc1c[nH]c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)c1	1796891681	FWGDALJOKRXLST-FWKYCFCSSA-N	440.504	1.547	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(Cl)cn1	1798063724	PSOQGRCEJJDZJQ-MCYUEQNJSA-N	430.730	1.969	50	20	IDGD	
CCOCCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O	1798523007	NKUHWDCVZKQPGL-YVWYUNDQSA-N	449.460	1.150	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)ccc1F	1799525846	JCRUUIUJNBKGOA-OVZMXSCWSA-N	429.286	1.766	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(F)cc([N+](=O)[O-])c1	1799631736	OEUDSOIASNMUJG-BTABJRDXSA-N	444.257	1.721	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1cc(Br)ccc1O)[C@H](O)CCl	1800048335	XUSZOQUCZOPQDD-HLPPOEQASA-N	445.741	1.935	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1snnc1C1CC1)C2	1800640894	LGYRRKYHTJVCJB-RNJOBUHISA-N	443.367	1.792	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@](C)(Cl)CCl)C2	1800642628	SQFSYRNIVYBKJW-IXRFVVGDSA-N	430.170	1.986	50	20	IDGD	
CCOc1ncc(Cl)cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](Cl)COC	1800976904	LDIVWBBGLZEASI-NOXHYTERSA-N	446.331	1.591	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CC(C)(C)C(=O)OC(C)(C)C)C2	1800979081	SEKIDBRVUFGIHL-JYYAWHABSA-N	446.972	1.588	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc3cccnc3s1)C2	1802336632	RFXPHQHXUNPTMR-MUJYYYPQSA-N	429.546	1.921	50	20	IDGD	
CN(C)c1cncc(C(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)c1	1803142055	VNWUPLQWGMNODH-AYOQOUSVSA-N	431.924	1.462	50	20	IDGD	
CCS(=O)(=O)CC(=O)NC[C@H]1CCN(C(=O)CO[Si](C)(C)C)[C@H]1c1cccnc1	1803513208	OXKPRCWGRSJULQ-APWZRJJASA-N	441.626	1.374	50	20	IDGD	
CC(C)[C@@H](S)C(=O)N1CCCC2(CCN(C(=O)c3cnccc3C(=O)NN)CC2)C1	1806062706	DWJQFGTZYCUTNW-QGZVFWFLSA-N	433.578	1.484	50	20	IDGD	
CN1N=C(C(=O)N2CC[C@H](CNC(=O)CO[Si](C)(C)C)[C@@H]2c2cccnc2)CCC1=O	1810539726	IKADJEWVZQHUBB-UZLBHIALSA-N	445.596	1.547	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H](CNC(=O)Cn2ccncc2=O)[C@H]1c1cccnc1	1812342736	BRMCYQWQEFOYNY-DYESRHJHSA-N	443.580	1.196	50	20	IDGD	
C=CCC(F)(F)C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1812667494	DKOIDCVSEDUOLY-PKOBYXMFSA-N	443.259	1.292	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)[C@H](C)Cn2cncn2)[C@H]1c1cccnc1	1812867599	SPEUGBNBODVCNG-OHFALNGGSA-N	449.353	1.799	50	20	IDGD	
CSCC(C)(C)C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1813068984	RDUMRFOBFKOQTM-XLIONFOSSA-N	449.621	1.850	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H](CNC(=O)CCn2cncn2)[C@H]1c1cccnc1	1813318751	MWPHGFBEXSWGPJ-YLJYHZDGSA-N	430.585	1.621	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)[C@@H](O)CCl)n[nH]2)cc1O	1814874740	CCTQZCVJYQPEOX-WBVHZDCISA-N	449.895	1.979	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)CCC(F)(F)F)[nH]n1)c1ccc(B(O)O)cc1	1817471440	OBFSUXPKRRTSJP-OAHLLOKOSA-N	438.215	1.738	50	20	IDGD	
CC(=O)C[C@H](C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1	1817479203	JXPJCJOPZPGSCY-UGSOOPFHSA-N	426.282	1.011	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](C)S)[nH]n1	1818113062	AMZBMYBSUYQBOB-RWKNQCGYSA-N	431.522	1.854	50	20	IDGD	
Cc1cc2nnc(C(=O)Nc3nc4c(s3)C[C@H](NC(=O)[C@H](O)CCl)CC4)c(C)n2n1	1818244755	JNYMHJGXBCSJHN-ZYHUDNBSSA-N	449.924	1.023	50	20	IDGD	
O=C(COC(=O)C(F)(F)F)N[C@@H]1CCc2nc(NC(=O)C(Cl)Cl)sc2C1	1826099997	ZCCCDDUZGIXBBU-RXMQYKEDSA-N	434.223	1.964	50	20	IDGD	
CCOC(=O)N[C@@H](O)C(=O)N1CCC([C@H]2CCCCN2C(=O)CCBr)CC1	1826358328	DRLPZBYQJOEWRL-ZBFHGGJFSA-N	448.358	1.456	50	20	IDGD	
COc1cc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)ccn1	1829277464	FKMUQBBOOPDJDY-IBGZPJMESA-N	445.564	1.697	50	20	IDGD	
Cc1ccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)c(C)n1	1829530078	MSBHBNHUWBJDQX-QHCPKHFHSA-N	449.360	1.925	50	20	IDGD	
C[C@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](F)Br)CC1)n1cnnn1	1830381040	DZEIOTBDJODGGQ-KWCYVHTRSA-N	431.310	1.544	50	20	IDGD	
Cc1oncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)CBr)CCO2	1830537612	LGBPYRGDKIZZDM-SJKOYZFVSA-N	430.299	1.084	50	20	IDGD	
CCNC(=S)NCC(=O)N1CCCC[C@H]1C1CCN(C(=O)CCBr)CC1	1831090402	FESJETYDNRVBBJ-HNNXBMFYSA-N	447.443	1.875	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H]2C[C@H](O)CN2)CC1	1831552133	MOQVQUZTEAUATE-QAETUUGQSA-N	430.387	1.502	50	20	IDGD	
CC(=O)c1cc(C(=O)N2CCC([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)n[nH]1	1831871490	GOYPPFVUQQJYTL-LJQANCHMSA-N	446.552	1.219	50	20	IDGD	
Cc1ccncc1CCC(=O)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1833015927	YPUIHHRVNLNRKO-IBGZPJMESA-N	430.332	1.583	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)CCCc3ccncc3)CC2)CC1)[C@@H](O)CCl	1833308298	QFZLHNZTHOHFFU-FQEVSTJZSA-N	436.984	1.576	50	20	IDGD	
O=C(CCC1CCC1)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1	1833398089	ZAOAKSRLCGHGRC-UHFFFAOYSA-N	441.381	1.132	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(O)n3)CCO2)C1	1834193745	YGROLTGXTYZMDZ-ZWKOTPCHSA-N	432.304	1.094	50	20	IDGD	
CCOC(=O)/C=C/C(=O)NC1CCN(C2CCN(C(=O)[C@](C)(Cl)CCl)CC2)CC1	1834406919	XLPJVISPMHQEPW-DPZZJQGRSA-N	448.391	1.914	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)c1cc2cnccc2[nH]1	1835611637	TUJOPMGCJXGMDD-LJQANCHMSA-N	433.940	1.348	50	20	IDGD	
C[C@@H](Cn1ccnc1)C(=O)N1CCC(N2CCC(NC(=O)CO[Si](C)(C)C)CC2)CC1	1835837377	FOZIMLNMNUNNMJ-SFHVURJKSA-N	449.672	1.942	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@@H]3CCCN(C)C3)CC2)CC1	1836351652	GIHMDTYPKONXOP-APWZRJJASA-N	429.005	1.154	50	20	IDGD	
O=C(CSc1ncccn1)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836716569	CHLLJUUDZYAYKN-MRXNPFEDSA-N	442.969	1.167	50	20	IDGD	
O=C([C@H](O)CCl)N1CCC(OC2CCN(C(=O)C3(C(F)(F)F)CC3)CC2)CC1	1836717165	LBQYOSHFDPJESU-CQSZACIVSA-N	426.863	1.927	50	20	IDGD	
O=C(c1[nH]nc2ccncc12)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836718015	PDHUVQKGKBDYLC-QGZVFWFLSA-N	435.912	1.170	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cn4cccnc4n3)CCO2)C1	1836885302	ROMJVXVLRDKQCM-QRWLVFNGSA-N	435.912	1.207	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3CCCSC3)C2)C1	1837717829	OXKWSWQQMKVLLA-QFBILLFUSA-N	430.643	1.438	50	20	IDGD	
C[C@@H](C(=O)N1CCC(OC2CCN(C(=O)C(Cl)Cl)CC2)CC1)N1CCN(C)CC1	1838627176	NXLNMRODBLADOW-HNNXBMFYSA-N	449.423	1.425	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@H](C)n3cncn3)CC2)CC1	1838787225	VSCOBJVVBAZRPD-WMLDXEAASA-N	427.933	1.092	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)cc1F	1838916000	MYQRIIUBYUMVEW-YJBOKZPZSA-N	447.276	1.895	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cccc([N+](=O)[O-])c3)C2)C1	1839141958	ZFJSMNSEYYCDJO-XLIONFOSSA-N	439.896	1.611	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(NC(C)=O)n3)C2)C1	1839142698	WOBDLZLWSGYABH-FOIQADDNSA-N	438.912	1.127	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc4c3NC(=O)C4)C2)C1	1839148192	QGEXSRALYIQYQI-HRAATJIYSA-N	435.908	1.269	50	20	IDGD	
C=C(C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2)C(F)(F)F	1839155255	PNFJCJOCFDYKQT-HUUCEWRRSA-N	433.254	1.798	50	20	IDGD	
C=C(C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](Br)CC)C2)C1)C(F)(F)F	1839894916	YRVSDQCKGPKGRZ-SWLSCSKDSA-N	443.260	1.735	50	20	IDGD	
O=C(Cc1cc(F)ccc1F)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840190122	GHSYSMRUEGUCQA-SFHVURJKSA-N	437.270	1.767	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3cc(F)ccc3OC)CCO2)C1	1840250745	MMCGQJGOHGUXJW-DYESRHJHSA-N	442.915	1.851	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CCc3nc[nH]c3C1)CCO2	1840361258	URXLBSNHHPKZBC-CKJXQJPGSA-N	438.956	1.379	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)/C=C/c3ccc(C)s3)CCO2)C1	1840397415	ZPILLCACWQDAMA-ZARSWLQMSA-N	442.965	1.780	50	20	IDGD	
C[C@@H](Oc1ccccn1)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1840427791	ROAWFBQCDPYUPG-ACJLOTCBSA-N	432.304	1.109	50	20	IDGD	
C#CCO[C@H](C)C(=O)N1CCCC12CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1841598955	NKLIKTXSIPNWLJ-CABCVRRESA-N	427.929	1.360	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)Cc1ccc3c(c1)CCCO3)C2	1844264416	QAEHHXJTWPLIGM-UHFFFAOYSA-N	449.511	1.070	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cncc(S(C)(=O)=O)c1	1848329707	QNOUIHIUJMXSND-GRDNDAEWSA-N	434.345	1.537	50	20	IDGD	
C=CCNS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H](C)Oc2ccc(OCC)cc2)c1	18071946	VQRZQNOPAKBXBW-OAHLLOKOSA-N	447.513	1.778	50	20	IDGD	
C=CCNS(=O)(=O)c1ccc(C(=O)OCC(=O)NNC(=O)c2ccc(C)cc2)cc1	26015694	FXESOEONIFKMHL-UHFFFAOYSA-N	431.470	1.077	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)CNC(=O)c1cc(-c2ccccc2)on1	109865941	ZLCACSPHDFVLBO-CYBMUJFWSA-N	426.404	1.825	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)NCCN2CCOC(C)(C)C2)N(C)c2ccccc21	725726244	SMAFNGYWOCMRMX-UHFFFAOYSA-N	425.533	1.884	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)NCc2ccco2)cc1NC(=O)c1ccccn1	728507833	ZLOJZRWSQXKIHP-UHFFFAOYSA-N	445.457	1.628	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)[C@H]2CCCN2C(=O)/C=C/c2ccc(C(N)=O)cc2)c1	728825638	IPBMNPUGVPBIPS-UFUQCMIWSA-N	431.452	1.123	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2ccc(Br)cc2Cl)cs1	728869833	DZRDWCGYAUJYOM-UHFFFAOYSA-N	438.712	1.886	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc([C@H](C)NC(=O)NNC(=O)Cc2cccnc2)cc1	728956906	AILUDHWVOILVIG-HNNXBMFYSA-N	433.534	1.746	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCCCOc2ccccc2C)cc1	729622310	XRLZQVJJTPQURW-UHFFFAOYSA-N	448.545	1.723	50	20	IDGD	
COC(=O)c1ccc(C(F)(F)F)cc1S(=O)(=O)NNC(=O)c1ccc(C#N)cc1	730203376	NNEGPQXNQQSGOE-UHFFFAOYSA-N	427.360	1.987	50	20	IDGD	
CCC(=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O)c1ccc(Br)cc1	730569101	NGVGZXLSZVCNFK-UHFFFAOYSA-N	440.323	1.264	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])nc2ccccc21	731050560	NFCGJCBAJWVVAM-UHFFFAOYSA-N	444.835	1.255	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCCOC[C@H]1CCOC1	731680450	LSCTUDDVMCXAES-STQMWFEESA-N	430.299	1.600	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)CCCCN2CCOCC2)cc1	732050489	VSQYXXHYEOXINP-UHFFFAOYSA-N	432.550	1.371	50	20	IDGD	
CN1C(=O)C(=O)N(CC(=O)NNC(=O)c2cc(-c3ccccc3)nc3ccccc23)C1=O	733088821	WEBWNGFJEHCMOI-UHFFFAOYSA-N	431.408	1.083	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)N[C@@H]2CCN(CCN3CCOCC3)C2)c1C	734467994	NTGRJDIJTVEZFF-ONQWYEKWSA-N	429.565	1.181	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)CCNC(=O)Cc2ccccc2)CC1	734824483	AAWCOFZLCHCIAQ-UHFFFAOYSA-N	447.536	1.465	50	20	IDGD	
COc1ccc(C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)c(Cl)c1	735116628	AFZJPHVVYXNJNQ-UHFFFAOYSA-N	439.925	1.437	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2cncc3ccccc23)CC1	735118669	XDWPHYMIJMEBHC-UHFFFAOYSA-N	426.502	1.323	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCCCc2ccc(O)cc2)cc1	735761551	SQHROGGFFKUXJT-UHFFFAOYSA-N	434.518	1.284	50	20	IDGD	
O=C(CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)NNC(=O)COCc1ccccc1	737637305	UYQTWYXQVCHEKD-UHFFFAOYSA-N	428.401	1.647	50	20	IDGD	
COc1ccc(C(=O)NNc2ccnc(N(C)C)n2)cc1S(=O)(=O)NC1CCCC1	740102862	GWZKYUNFXZGBKY-UHFFFAOYSA-N	434.522	1.529	50	20	IDGD	
CN(C)c1nccc(NNC(=O)CNC(=O)c2ccccc2I)n1	740113510	BUAPANJONAPSFU-UHFFFAOYSA-N	440.245	1.020	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2ccc(OC)c(Br)c2)cs1	743259104	QVRVQEYISYBHAN-UHFFFAOYSA-N	449.304	1.929	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NCc2ccnc(-n3cccn3)c2)cc1	743535271	ZAGMFWFXHACKAL-UHFFFAOYSA-N	429.462	1.207	50	20	IDGD	
CC(C)(CC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)NC(=O)OC(C)(C)C	743830312	RIEJFOHKSWVRQU-UHFFFAOYSA-N	428.511	1.936	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2cccc(Br)c2)cc(S(N)(=O)=O)c1C	743836993	XKELHGSBMJJSNZ-UHFFFAOYSA-N	426.292	1.788	50	20	IDGD	
CC[C@H](C)NC(=O)[C@H](C)NC(=O)NNC(=O)[C@H](C)Oc1cccc(Br)c1	744277822	OMUQJMMIRLZREZ-SRVKXCTJSA-N	429.315	1.850	50	20	IDGD	
CN(C)c1ccc(CCC(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)cc1	744622073	VOOGSDWQKSMJEC-UHFFFAOYSA-N	432.546	1.849	50	20	IDGD	
COc1ccc(C(=O)Oc2ccc(C=NNC(=O)C(=O)NC3CC3)cc2OC)cc1OC	744824305	VZWNNGHFTCCTAJ-UHFFFAOYSA-N	441.440	1.660	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)[C@H](c2ccccc2)N2CCCCC2=O)cc1	744991670	QYSIZGGQSHRUII-NRFANRHFSA-N	434.452	1.616	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1ccc(-n2cncn2)cc1C	745415425	PBDJQZXBJOOOGA-UHFFFAOYSA-N	443.847	1.856	50	20	IDGD	
O=C(NNC(=O)[C@@]1(O)CCN(Cc2ccccc2)C1)c1ccc(F)cc1Br	746136555	YJSMIURGHCNSLZ-LJQANCHMSA-N	436.281	1.986	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@]2(O)CCN(Cc3ccccc3)C2)cc1Br	746250646	RMDYKQIZGVQYBD-FQEVSTJZSA-N	448.317	1.856	50	20	IDGD	
CCO/C=C(/C#N)C(=O)N1CCN(S(=O)(=O)c2ccc(Br)s2)CC1	746510606	ARFXMLWJRDXXPI-KHPPLWFESA-N	434.337	1.787	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)c2cnn(CC(=O)NC3CCCCC3)c2)cc1OC	746577513	MXKDVAXEKVQLPU-UHFFFAOYSA-N	443.504	1.814	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)Cc1cn2ccccc2n1)[C@H]1CN(Cc2ccccc2)CCO1	746766983	IBDNHDGHBKJDDC-FXAWDEMLSA-N	436.516	1.497	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2ccc(Cl)cc2F)cc(S(N)(=O)=O)cc1[N+](=O)[O-]	747429525	PMWNWPWKCVLBKX-UHFFFAOYSA-N	430.801	1.418	50	20	IDGD	
C[C@@H](NC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)[C@H](C)c1ccccc1	747589840	UIWGQROBHOAQMQ-DLBZAZTESA-N	446.577	1.836	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(C(=O)NNc2nc(-c3ccccn3)nc3c2CCC3)o1	748338401	WJWVKERISDASSW-UHFFFAOYSA-N	428.474	1.628	50	20	IDGD	
CNS(=O)(=O)c1ccc(C)c(C(=O)NNc2nc(Br)cn3ccnc23)c1	750242863	ABYFCBPNTFCEFS-UHFFFAOYSA-N	439.295	1.465	50	20	IDGD	
C[C@@H](CCNC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)c1ccccc1	750336750	LCXFPHHRXZYGTJ-KRWDZBQOSA-N	446.577	1.838	50	20	IDGD	
CC(C)NC(=O)C(=O)NNS(=O)(=O)c1scc(Br)c1Br	751209210	YBXWZAOODNOFAW-UHFFFAOYSA-N	449.146	1.107	50	20	IDGD	
C[C@H]1C[C@H](C)CN(c2ccc(C(=O)NNC(=O)CNC(=O)c3ccco3)cc2[N+](=O)[O-])C1	751212808	YPRLDZVNIQTJRO-KBPBESRZSA-N	443.460	1.861	50	20	IDGD	
O=C(O)CCCOc1ccc(S(=O)(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1F	751261234	TYCUUOKHNRPZCZ-UHFFFAOYSA-N	441.393	1.601	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCC(=O)NNC(=O)NC2CCCC2)cc1OCC	751382979	CLAIQDSRIPDCTQ-UHFFFAOYSA-N	428.511	1.035	50	20	IDGD	
CN1C(=O)N[C@@]2(CCC[C@@H]2CNC(=O)NNC(=O)c2ccc(Br)s2)C1=O	752003218	RXIOZYAMCGSXJF-ANRSDYALSA-N	444.311	1.175	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)c2cc(S(N)(=O)=O)cc(Cl)c2F)cc1OC	752265342	QPQQTRVQAJUOIH-UHFFFAOYSA-N	445.856	1.609	50	20	IDGD	
CSCCNC(=S)NNC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(C)cc2)C1	752731039	SXKNFPZPVJODBE-AWEZNQCLSA-N	430.621	1.254	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1ccc(-n2cccc2)nc1	753320740	SXWKPWWWPQFWGM-UHFFFAOYSA-N	427.486	1.650	50	20	IDGD	
O=C(NNC(=O)[C@@H](c1cc(Cl)cc(Cl)c1)N1CCOCC1)C(=O)N1CCCC1	753534773	WEKZIOQQMFLWSF-OAHLLOKOSA-N	429.304	1.137	50	20	IDGD	
Cc1ccc(S(=O)(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c(C)c1C(=O)O	753780417	PGMYPYHJVJLYIL-UHFFFAOYSA-N	433.490	1.018	50	20	IDGD	
C[C@@](O)(CN1Cc2ccccc2C1=O)C(=O)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	756882773	ZMZFBNWTSWANHM-JOCHJYFZSA-N	437.431	1.384	50	20	IDGD	
CN(C1CCCCC1)S(=O)(=O)c1ccc(C(=O)NNc2ccc(C(N)=O)nn2)cc1	757391167	BVMSZFOACILMMO-UHFFFAOYSA-N	432.506	1.286	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)CN2C(=O)NC3(C[C@H](C)C[C@@H](C)C3)C2=O)cc1	757640322	UQEQNEPFZITDKD-HUUCEWRRSA-N	430.505	1.522	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(F)(F)[C@H](C(=O)NNC(=O)COc2ccc(C#N)cc2)C1	757758448	DELCAOXYNVLXBG-HNNXBMFYSA-N	438.431	1.977	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)[C@H](Sc1cc(F)ccc1F)c1ccccc1	758029421	KSDIACOSBLAIAC-MEDUHNTESA-N	443.497	1.883	50	20	IDGD	
COc1ccc(COCCCC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1	760392888	XMINZRLSKOPOPI-UHFFFAOYSA-N	427.505	1.846	50	20	IDGD	
CCOC(=O)c1cc(S(=O)(=O)NNC(=O)c2ccc(COc3ccccc3)o2)cn1C	760511605	ZAWXMAQRBVPHLL-UHFFFAOYSA-N	447.469	1.997	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)CN1C(=O)N[C@@]2(CCCC[C@@H]2C)C1=O	761622934	ZXXAYBKMQPZYKV-RNODOKPDSA-N	434.518	1.435	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)ccc1C	763539033	IBFKVRWJMMTLMR-UHFFFAOYSA-N	445.428	1.207	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)C(=O)Nc1ccc(-c2noc(C(F)F)n2)cc1	763551559	PNKPOZQJYKWTAL-UHFFFAOYSA-N	445.338	1.803	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)C(=O)Nc2ccc(C(N)=O)c(F)c2)c1	763598065	TXHAKTZGTAQEJB-UHFFFAOYSA-N	430.436	1.521	50	20	IDGD	
CN(C)CCOc1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)cc1	763615057	XKJSQXQMTOAOGP-UHFFFAOYSA-N	436.472	1.417	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(C(=O)N[C@H](C)CC)cc1	763712337	OQQJKPLJORMHBR-OAHLLOKOSA-N	440.500	1.942	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)c(F)cc1F	763745440	FYWKZLNFNGITBE-UHFFFAOYSA-N	446.410	1.290	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2ccc(CCN3CCCC3)cc2)c1	763770993	DLFZSTDFSTYRRF-UHFFFAOYSA-N	440.500	1.742	50	20	IDGD	
CCNC(=O)COc1cccc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCC3)c1	763781939	PALJNFRTOAOWRP-UHFFFAOYSA-N	430.486	1.151	50	20	IDGD	
O=C(NNC(=O)c1cc2c(s1)CCC2)C(=O)Nc1ccc(CN2CCOC2=O)cc1	763784336	VRAIRUFPEJLHQB-UHFFFAOYSA-N	428.470	1.589	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cccc(-c3nnco3)c2)cc1	763861861	RKVUOIYBNFBUMK-CYBMUJFWSA-N	439.428	1.689	50	20	IDGD	
Cc1ccc(S(C)(=O)=O)cc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccccc1F	763865041	NEJMASSNPOOAQI-LBPRGKRZSA-N	437.449	1.091	50	20	IDGD	
CN(C)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)Cc2c[nH]c3ccccc23)cc1Cl	763865102	JAPCYXINAMCSBJ-UHFFFAOYSA-N	441.875	1.852	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)C(=O)Nc1cnn(CC(F)F)c1	763902247	SWECDMZXIHAIGR-UHFFFAOYSA-N	434.428	1.980	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)C(=O)Nc1cnc(-c2ccccc2)s1	763917262	SOZNMBCXIBKNDZ-UHFFFAOYSA-N	434.441	1.186	50	20	IDGD	
CS(=O)(=O)CCc1ccc(NC(=O)C(=O)NNC(=O)c2cccc3ccccc23)cc1	764059051	YLEDDJYIHNBSNK-UHFFFAOYSA-N	439.493	1.827	50	20	IDGD	
CN1CCN(Cc2cccc(NC(=O)C(=O)NNC(=O)c3ccc4ccccc4c3)c2)CC1	764064362	JDHPEAHVRSQWDT-UHFFFAOYSA-N	445.523	1.987	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2cccnc2-c2ccccc2)c1	764076583	BXMXEWHQJGPULX-UHFFFAOYSA-N	438.465	1.552	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cnc(-c3ccccc3)nc2)o1	764139165	PFHJRGGIVGPCGF-UHFFFAOYSA-N	436.472	1.978	50	20	IDGD	
Cn1cnnc1-c1cccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)c1	764388417	RULMTMGCMBRDPG-UHFFFAOYSA-N	448.418	1.411	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1ccc2c(c1)CCC(=O)N2C	764398283	ROJMFYZWLGPHDC-UHFFFAOYSA-N	442.497	1.482	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)N[C@@H]2CCN(c3ccc(Cl)c(F)c3)C2=O)cc1	764512330	MPNLYAUTDVRKLV-QGZVFWFLSA-N	445.838	1.865	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)CN3CCN(C(=O)c4ccccc4)CC3)n[nH]2)cc1	765734630	AZZBNKLFAKVFTL-UHFFFAOYSA-N	446.511	1.604	50	20	IDGD	
CC(C)OCc1ccc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cc1	765738660	MCSFDCJHAVJCOT-UHFFFAOYSA-N	438.528	1.831	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)c2csc(S(C)(=O)=O)c2)CC1	766557384	VCFUIDJIGKKYGY-UHFFFAOYSA-N	446.551	1.495	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1c(F)c(F)cc(F)c1F	766639794	AQBBOMGNXZRJKL-UHFFFAOYSA-N	438.381	1.462	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)Cn1nnc(-c2ccc(Cl)cc2)n1	768631044	ZHPQTXPGHFFQAZ-UHFFFAOYSA-N	436.881	1.549	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NCC(C)(C)c3ccncc3)nc2)CC1	768986660	VXDIZLWJMVDBCS-UHFFFAOYSA-N	447.565	1.017	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCCc2cccc(C(=O)OC)c2)c2ccccc2c1=O	769009450	RJTCKOLAAPUVAZ-UHFFFAOYSA-N	437.456	1.390	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccc(C)c1Br	769252382	JBAKSASAOXHZQX-UHFFFAOYSA-N	436.262	1.931	50	20	IDGD	
CC(C)(C)c1nnc2ccc(C(=O)NNC(=O)c3csc(N4CCOCC4)n3)cn12	769539306	XGJIUMWRRYPSCV-UHFFFAOYSA-N	429.506	1.395	50	20	IDGD	
CCOC(=O)c1cnn2c(C(=O)NNC(=O)Cn3c(CC)nc4ccccc43)ccnc12	769617371	OXMPNMAGIJFXRO-UHFFFAOYSA-N	435.444	1.279	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN2CCC(Oc3ccnc(C(N)=O)c3)CC2)cc1C	772331807	HVFVNMKLGPYYHQ-UHFFFAOYSA-N	445.545	1.417	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)Nc1cnn(Cc2nnc3n2CCCC3)c1	772635848	HAXKUZKQFHIRKY-UHFFFAOYSA-N	442.505	1.510	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)cc1NS(C)(=O)=O	772885054	UBBKLYWMGCSDGO-UHFFFAOYSA-N	438.893	1.097	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)[C@H](O)[C@H](O)c1nc2ccccc2s1	772998995	YVCIHABHGAEGNE-JQAFLVLXSA-N	435.889	1.959	50	20	IDGD	
CN(C)C(=O)N1CCC(C(=O)NNC(=O)[C@H]2CCCN(C(=O)OC(C)(C)C)C2)CC1	773411853	AUWFLGHSRKDTFE-HNNXBMFYSA-N	425.530	1.175	50	20	IDGD	
O=C(NNc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(S(=O)(=O)C[C@@H]2CCCO2)cc1	773642862	HHBWQOJQGOUGSC-INIZCTEOSA-N	448.457	1.629	50	20	IDGD	
O=C(NNc1cnc2ccccc2n1)C(=O)Nc1ccc(F)c(N2CCCS2(=O)=O)c1	773722996	URVKKPMICPTLAH-UHFFFAOYSA-N	444.448	1.391	50	20	IDGD	
CC(C)c1nccnc1NNC(=O)C(=O)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1	773999341	GZPJDOHWFCGQQI-UHFFFAOYSA-N	446.533	1.856	50	20	IDGD	
O=C(NN=CCCc1ccc2c(c1)CCO2)c1cccc(S(=O)(=O)N2CCOCC2)c1	774311126	LRANGHWHTAOXJR-UHFFFAOYSA-N	443.525	1.991	50	20	IDGD	
CC[C@H](NCC(=O)NNC(=O)c1ccc(OC)c(OC)c1)c1ccc2c(c1)OCCO2	775203457	RWWHAKNXJDMDDO-INIZCTEOSA-N	429.473	1.977	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)Nc2ccc(S(=O)(=O)NC(C)(C)C)cn2)cc1	776062390	FVHALIKLHSOGBL-UHFFFAOYSA-N	435.506	1.699	50	20	IDGD	
O=C(COC(=O)c1cccc([N+](=O)[O-])c1N1CCOCC1)NNC(=O)c1cccs1	776451589	XDQIRFZMYSSKCW-UHFFFAOYSA-N	434.430	1.111	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@H]2C(=O)NNc2cccc(S(C)(=O)=O)c2)c(OC)c1	776534372	KFZNPIIOFIYLLE-SFHVURJKSA-N	447.513	1.855	50	20	IDGD	
C[C@H]1C(=O)CC[C@@H](C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)C1(C)C	780951596	ZTRCOHOURCOFOL-YJBOKZPZSA-N	436.578	1.707	50	20	IDGD	
CCOc1ccccc1N1C[C@@H](C(=O)NNC(=O)CCNC(=O)OC(C)(C)C)CC1=O	780974129	QJASKDHPTAFBKF-AWEZNQCLSA-N	434.493	1.500	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2cc(Br)ccc2O)ccc1F	782117469	OUWCWEFOOKGVKK-UHFFFAOYSA-N	426.198	1.702	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)c2cccc(NS(=O)(=O)C(F)(F)F)c2)c1	782557089	SFMUAUNSWJVKEF-UHFFFAOYSA-N	445.379	1.376	50	20	IDGD	
C[C@@H]1CN(c2ccc(NC(=O)C(=O)NNc3ncnc4ccsc34)cn2)C[C@@H](C)O1	783254643	IJJQVPRYTONFJK-VXGBXAGGSA-N	427.490	1.782	50	20	IDGD	
Cc1c([N+](=O)[O-])cn(CC(=O)NNC(=O)c2ccc(C#N)cc2)c(=O)c1Br	783925194	SLZVXEZRNDYEQL-UHFFFAOYSA-N	434.206	1.160	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2ccc(Cl)c(S(=O)(=O)N3CCCC3)c2)ncn1	783947677	DNEPDPHSKVXMLB-UHFFFAOYSA-N	438.897	1.305	50	20	IDGD	
C[C@H](c1ccccc1)n1ccc(NC(=O)C(=O)NNC(=O)CNC(=O)c2cccs2)n1	784003774	OOIHLKBRQRZEKU-CYBMUJFWSA-N	440.485	1.070	50	20	IDGD	
Cc1cc(C)cc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)c1	784229661	FUICZUURTMQXNK-UHFFFAOYSA-N	445.545	1.321	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNc2ccnc(F)c2)c(Br)cc1F	784848313	HWHVKCUXHGTXOH-UHFFFAOYSA-N	429.177	1.991	50	20	IDGD	
CCOC(=O)[C@@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNc2ccc(Cl)nc2)cc1	784875506	UZBYJNXYUGRFNA-LLVKDONJSA-N	433.852	1.498	50	20	IDGD	
COc1c(NC(=O)C(=O)NNc2c(F)cc(F)cc2Br)cccc1C(N)=O	785010809	KJVIMSAYFOZHJW-UHFFFAOYSA-N	443.204	1.917	50	20	IDGD	
CNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2cc(-c3cc(C)ccc3C)[nH]n2)c1C	785129043	OEMQQVHSZSVBDB-UHFFFAOYSA-N	448.483	1.761	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1c(C)cc(N(C)C)cc1C	785331274	RQOOYLOJTCTUFY-UHFFFAOYSA-N	434.518	1.863	50	20	IDGD	
O=C(CCc1ccc(O)nc1)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	787438440	BKUZPPUUVNIJQC-UHFFFAOYSA-N	431.924	1.338	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cc([C@@H]3CCCO3)nn2C)cc1	789741002	MHZOCXAISJAVNM-DYVFJYSZSA-N	443.460	1.028	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)[C@H]1CC(=O)N(c2cccc(Br)c2)C1	790063943	RQYUVPOGXQMEPM-LBPRGKRZSA-N	442.310	1.739	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)NCc2cccc(N3C(=O)N[C@@](C)(C4CC4)C3=O)c2)n1	790846647	NTXUOMYPPNCOMX-QFIPXVFZSA-N	436.472	1.759	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)[C@H]2COCCN2C2CCCC2)cc1	792788098	WJZHNRMDGDFYSC-GOSISDBHSA-N	444.561	1.512	50	20	IDGD	
NC(=O)[C@H](NC(=O)NNC(=O)COCc1ccccc1)c1cccc(Br)c1	792954083	CYEQNFBNBJXFOL-MRXNPFEDSA-N	435.278	1.523	50	20	IDGD	
COc1c(NC(=O)C(=O)NNC(=O)c2cccc(Cl)c2)cc(Cl)cc1C(N)=O	793021555	DWNVQQQMBXJLLR-UHFFFAOYSA-N	425.228	1.501	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2CCCN(C(=O)c3ccc(F)cc3)C2)cc1	793212628	KMQJMCMHPGIZEX-INIZCTEOSA-N	426.448	1.772	50	20	IDGD	
COc1ccc(CN2C[C@H](C(=O)NNc3ccccc3S(=O)(=O)N(C)C)CC2=O)cc1	795168343	NIYAQOQVUQZQRN-MRXNPFEDSA-N	446.529	1.437	50	20	IDGD	
CCOC(=O)c1cc(S(=O)(=O)NNC(=O)c2nnc(-c3ccccc3)o2)c(F)cc1C	795303693	ROWAJHHVSIEBGA-UHFFFAOYSA-N	448.432	1.984	50	20	IDGD	
C[C@H]1[C@H](NCC(=O)NNC(=O)c2cccc(C#N)c2)[C@H](C)CCN1C(=O)OC(C)(C)C	796646383	AYBRUKDKAZBUHK-ZRGWGRIASA-N	429.521	1.943	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2CC(c3ccccc3[N+](=O)[O-])=NO2)cc1C	798310375	WOVJDVCFIIRJEA-QGZVFWFLSA-N	425.401	1.491	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2ccn(-c3cccc(C#N)c3)n2)c2ccccc2c1=O	798829775	JKFNXCUOPJJWBS-UHFFFAOYSA-N	427.424	1.549	50	20	IDGD	
Cc1cccc(-n2c(C)cc(/C=C(/C#N)C(=O)NCCC(=O)NS(C)(=O)=O)c2C)c1	800553211	JZXGIZGFOMZMPK-PDGQHHTCSA-N	428.514	1.892	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)Cc2csc(NC(=O)c3ccoc3C)n2)cc1	801107224	QSFFQKBVTPPKME-UHFFFAOYSA-N	441.469	1.934	50	20	IDGD	
NS(=O)(=O)Cc1ccc(C(=O)NNC(=O)Nc2ccc(Br)cc2)cc1	801994205	BPWNHBISVAJDPH-UHFFFAOYSA-N	427.280	1.704	50	20	IDGD	
CSC[C@H](C(=O)NNc1ccc2c(=O)[nH]ccc2c1)N1C(=O)[C@@H]2CCCC[C@H]2C1=O	803431534	BZOSLYOJBUVJLJ-BRWVUGGUSA-N	428.514	1.878	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)NC3C[C@@H]4CC[C@H](C3)N4CC(=O)N(C)C)cc2C1	804869046	SGCCIWZKHUZGLJ-HZTRTUMWSA-N	447.605	1.901	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)CNC(=O)OCc2ccccc2)c(Cl)cc1F	807069938	HUKQMEADHHETHV-UHFFFAOYSA-N	436.827	1.800	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)cc2[nH]ccc12	808934456	GMVGZYFRGGAUKX-UHFFFAOYSA-N	430.804	1.713	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)c2cn(C3CCOCC3)nn2)cc(OCC)c1OCC	809949319	ISHFFCBYWBXPII-UHFFFAOYSA-N	447.492	1.901	50	20	IDGD	
O=C(NN=Cc1cc(I)cc([N+](=O)[O-])c1)[C@@H]1CCS(=O)(=O)C1	811636578	JKUZPOXYFIHCTP-SECBINFHSA-N	437.215	1.084	50	20	IDGD	
CC[C@H]1[C@H](C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)CCN1C(=O)OC(C)(C)C	813367943	PZZSJRAXNXWDPN-CVEARBPZSA-N	429.481	1.459	50	20	IDGD	
COCCC(C)=NNC(=O)C[C@@H]1c2cc(OC)c(OC)cc2CCN1S(C)(=O)=O	814759259	WQVFAKOGLGEDIP-MRXNPFEDSA-N	427.523	1.481	50	20	IDGD	
CCC(=O)Nc1ccc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)N(C)C)cc1	815750416	ANBPIOIWXMCBDM-UHFFFAOYSA-N	433.490	1.367	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2noc3ccc(Cl)cc23)CC1)C(=O)Nc1ccccn1	815788537	HYYXBJZXJSWIQD-UHFFFAOYSA-N	442.863	1.879	50	20	IDGD	
Cn1ncc(I)c1C(=O)NNC(=O)Nc1ccc2c(c1)OCO2	816597132	FYXFTBLNASCODA-UHFFFAOYSA-N	429.174	1.220	50	20	IDGD	
CC(C)[C@@H](NS(=O)(=O)C1CC1)C(=O)NNC(=O)c1ccc(COc2ccccc2)o1	816829533	VEEJMGKTMVQJNS-GOSISDBHSA-N	435.502	1.726	50	20	IDGD	
O=C(/C=C\c1ccc(I)o1)NNC(=O)[C@H]1COc2ccccc2O1	859443723	QHWGFNQFLWPLPO-FWPCIQOSSA-N	440.193	1.885	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@@H]2CS[C@H](Cc3ccccc3F)C(=O)N2)cc1OC	886540035	VOBHWLFNRBKOOF-MAUKXSAKSA-N	447.488	1.447	50	20	IDGD	
CSC[C@H](C(=O)NNC(=O)Cc1ccc(Cl)cc1)N1C(=O)[C@H]2CCCC[C@H]2C1=O	913160101	NWEAXKGTTJAQPP-OWCLPIDISA-N	437.949	1.937	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2ccc(Br)s2)cc1	913161222	SKXKPEABMMYKOX-UHFFFAOYSA-N	432.321	1.559	50	20	IDGD	
COc1cc(NS(=O)(=O)c2cc(C(=O)NNC(=O)C3CC3)ccc2OC)cc(OC)c1	913415770	GIMUBCTYLHGANP-UHFFFAOYSA-N	449.485	1.684	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)CCc1ccc(S(=O)(=O)NC2CC2)cc1	913465567	QEEPGQSYSYIMCP-UHFFFAOYSA-N	445.541	1.849	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)[C@@H](C)NS(=O)(=O)c2ccc(Cl)cc2)c1	913534442	CLLGIOHFWNXRMQ-LLVKDONJSA-N	441.893	1.485	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)N2CCN(C(=O)c3ccc4c(c3)OCO4)CC2)cc(C#N)n1C	914503564	YJAVVRPHUFDTFY-NVMNQCDNSA-N	431.452	1.825	50	20	IDGD	
CC(C)N(CCNC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)C(C)C	915891282	OWYKVYLCZVBYCB-UHFFFAOYSA-N	439.582	1.534	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NCc2ccc(Cn3cccn3)cc2)c2ccccc2c1=O	916222958	QZDLFLOSCOIMAJ-UHFFFAOYSA-N	431.456	1.323	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)nn1C	917523388	YUXGMMKTQRJUOI-UHFFFAOYSA-N	427.486	1.282	50	20	IDGD	
O=C(NCCCCn1ccnc1)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	918139769	XOIBKSINEPVSMQ-UHFFFAOYSA-N	434.522	1.092	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)CN2C(=O)N[C@]3(C[C@H](C)CC(C)(C)C3)C2=O)c1O	919756797	MCLKRQVYOIHREX-GTJPDFRWSA-N	432.477	1.299	50	20	IDGD	
CNC(=O)NNC(=O)CN1C(=O)/C(=C/c2ccc(Br)cc2)SC1=S	919879493	ILPGVHUQQZQVCA-POHAHGRESA-N	429.321	1.611	50	20	IDGD	
CCc1c(C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)cnn1-c1cccc(Cl)c1	919886526	SBSRZUUJKKMITN-LBPRGKRZSA-N	425.898	1.219	50	20	IDGD	
CCOc1ccc(Nc2ncccc2C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)cc1	919888144	AOOLPDXLWMQAJM-AWEZNQCLSA-N	433.490	1.355	50	20	IDGD	
CC(=O)N1CCN(c2ccc(C(=O)NNC(=O)NCc3ccco3)cc2[N+](=O)[O-])CC1	920856425	IFZPVUGNICJDGK-UHFFFAOYSA-N	430.421	1.001	50	20	IDGD	
COc1ccc(CCN2C[C@@H](C(=O)NNC(=O)NCc3ccco3)CC2=O)cc1OC	920856477	MKLLAHSHWQWQKV-HNNXBMFYSA-N	430.461	1.218	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)NNC(=O)COc2ccc(C)cc2)cc1OC	920930819	VZEQSNFXZCKKJQ-UHFFFAOYSA-N	436.490	1.997	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)cc2c1OCCO2	1116085105	XBMONRKMVGSOJJ-UHFFFAOYSA-N	435.477	1.875	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)CC1(CC(=O)N2CCOCC2)CCCC1	1317709765	DFNLZTFEVMXEJC-INIZCTEOSA-N	435.496	1.940	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)c2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1	1318234457	NSLLYJHKGHWUIH-MRXNPFEDSA-N	425.489	1.270	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)CN(C)C(=O)OC(C)(C)C	1318438329	AAQDQLGQYAKNEW-HNNXBMFYSA-N	449.556	1.526	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1csc(N2CCOCC2)n1)c1ccc([S@](C)=O)cc1	1323013860	ARTSHUOXWHHYAA-ZNNHIBJESA-N	437.547	1.422	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)C[C@H]2CCCS(=O)(=O)C2)cc1	1324415291	LDAOSWQZYIKAAP-CQSZACIVSA-N	437.547	1.083	50	20	IDGD	
O=C(NNC(=O)c1cncn1-c1ccccc1)c1nccn2c(Br)cnc12	1324748991	AUSTVTGXJAQKME-UHFFFAOYSA-N	426.234	1.752	50	20	IDGD	
O=C(NNC(=O)[C@H]1CS[C@@]2(c3ccc(F)cc3)CCC(=O)N12)c1n[nH]c2c1CCCC2	1337156152	QZRFZTFTJIOJLX-IIBYNOLFSA-N	443.504	1.779	50	20	IDGD	
Cc1nc2sccn2c1C(=O)N1CC[C@@]2(CN(C(=O)CCBr)CCO2)C1	1778716617	ZACOPRGYPUFWCZ-QGZVFWFLSA-N	441.351	1.933	50	20	IDGD	
O=C(/C=N/O[C@@H]1CCCCO1)N1CC[C@@]2(C1)CN(C(=O)CCBr)CCO2	1779101142	KHCCEJFXVDVQOK-JURCDDRXSA-N	432.315	1.130	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)N2CCO[C@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)n1	1779296422	PUOIBZQUHIXLBX-FQEVSTJZSA-N	434.569	1.335	50	20	IDGD	
C[C@@H](Nc1cnccn1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(Cl)Cl)C2	1779394815	SNQRWNGYDFQXMS-SNUQEOBHSA-N	430.336	1.595	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc(Cl)nn2)C1	1779632769	NDEAHEDQIFSYNY-RVZJWNSFSA-N	431.320	1.511	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccnnc2O)C1	1779966562	OVIYCSKIHJSYJE-XTQGRXLLSA-N	427.299	1.093	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H]2CCCN(C)C2)C1	1780575880	CHJFMQFUJRLQHB-YIOZNXECSA-N	430.387	1.626	50	20	IDGD	
CC(C)c1nc(CC(=O)N2CCO[C@]3(CCN(C(=O)[C@](C)(Cl)CCl)C3)C2)no1	1781225045	SNZZTQHDAGTBHH-QZTJIDSGSA-N	433.336	1.802	50	20	IDGD	
C[C@H](Nc1ccccn1)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781331913	RTXJKGYKGWEHIC-QEORTHHSSA-N	429.290	1.402	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnn4c3OCCC4)C2)C1	1782273726	JVWGXKHXZPNFKL-SCLBCKFNSA-N	441.326	1.140	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc4cccnn4c3)C2)C1	1782387765	BATRZCJXVBEOBC-APWZRJJASA-N	435.322	1.951	50	20	IDGD	
Cc1ccn2c(C(=O)N3CC[C@@]4(CN(C(=O)CCBr)CCO4)C3)cnc2c1	1782488507	UHDOUXJSBGQYAK-LJQANCHMSA-N	435.322	1.871	50	20	IDGD	
O=C([C@@H](F)Br)N1CCO[C@]2(CCN(C(=O)C(F)(F)c3ccco3)C2)C1	1782723321	PNOFUMDIXVKGNS-BXUZGUMPSA-N	425.201	1.892	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)COc3ccccc3OC)CCO2)C1	1783869125	OBKLLGDMQNCWBV-YWZLYKJASA-N	426.897	1.158	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cc(N4CCCC4)ccn3)CCO2)C1	1783873995	BBTIAAREFYJZNJ-DYESRHJHSA-N	436.940	1.379	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C3CCN(c4ccccc4)CC3)C[C@@H]21)[C@H](O)CCl	1784084603	YTNCHEZLEABSMQ-WJMWBRGCSA-N	449.979	1.482	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(CCN(C(=O)[C@H]3CCc4nc[nH]c4C3)C2)C1	1784346408	WYKRFMIGBPDZEX-SCLBCKFNSA-N	425.327	1.130	50	20	IDGD	
O=C(Cc1ccc(Br)cn1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Cl)C[C@@H]21	1785384138	FNJKIOVOAHUZQF-LOHUMSBYSA-N	448.720	1.901	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(C)(C)NCCC#N)[C@H]2C1	1786857213	CKLFHSCAGHPIFU-UGUYLWEFSA-N	443.386	1.279	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1(c2ccc(NC(=O)c3ncn(C)n3)cc2)CCC1	1787249115	RWTOBOUCEUXKRC-MZJWZYIUSA-N	448.487	1.697	50	20	IDGD	
C=CCC(CC=C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1	1788607801	JNWHCTHYAGXXOA-VDGAXYAQSA-N	441.532	1.047	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCCCn3cccc3)[C@H]2C1	1788712381	PDBVPCLWYCGPLF-VJANTYMQSA-N	425.957	1.892	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC1(c2ccc(NC(=O)c3cnn4ccncc34)cc2)CCC1	1789070048	DNINEVYDMOPBEL-UHFFFAOYSA-N	449.515	1.850	50	20	IDGD	
C[C@H](C(=O)NC1(c2ccc(NC(=O)c3cnccc3C(=O)NN)cc2)CCC1)n1ccnn1	1789521690	DHYQAMQUYMNYEQ-CQSZACIVSA-N	448.487	1.286	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)NC(=O)c3ccccc3)C[C@@H]21	1789864361	RGCZACSGHHZXDX-WRNCNIFXSA-N	435.952	1.802	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4n(n3)CCCN(C)C4)C[C@@H]21	1789865306	QSJZVWOUTRVNLD-XPYUAMARSA-N	437.972	1.329	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(C(N)=O)cc3)C[C@@H]21	1789872506	HKZAZOPAAZWKPQ-ULMVMLMRSA-N	442.343	1.615	50	20	IDGD	
Cc1cc(C)nc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]3C2)c1	1789923234	ZXMNKWCXDNXVTM-DARAHFNDSA-N	428.302	1.982	50	20	IDGD	
NC(=O)CC[C@H](N)C(=O)NC1(c2ccc(NC(=O)[C@@H](F)Br)cc2)CCC1	1790534787	RTMMIPUVIOPFLB-GXTWGEPZSA-N	429.290	1.404	50	20	IDGD	
CCOC(=O)C1(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCBr)C[C@@H]32)CC1	1790718694	PVHURJFVVKPFLZ-IHRRRGAJSA-N	431.327	1.094	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cscn3)C[C@@H]21	1790962272	YLPHVHMEDCEQIV-MHEUCROKSA-N	430.368	1.839	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CSc3ccncc3)C[C@@H]21	1791057851	YJEPVPGCZGYTQB-VRKREXBASA-N	442.379	1.937	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1ccc(C2(NC(=O)Cn3ccccc3=O)CCC2)cc1	1791600207	UGFUPTLUFSENEH-UHFFFAOYSA-N	439.516	1.355	50	20	IDGD	
C#CC[C@H](NC(=O)OC(C)(C)C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Cl)C[C@@H]21	1792257974	QZCIPHXNJVSVDJ-UVPYHEFZSA-N	445.919	1.417	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ncc(Cl)cc1Cl	1792414495	MRRRKHYIWRHSND-RDBQEKCUSA-N	436.723	1.845	50	20	IDGD	
COc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C(C)(C)CCl)c(O)c1OC	1792784529	IXMWLXAHABDQNX-YWVIFJGQSA-N	440.924	1.878	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCl)c1ccc(-c2ccc(O)nn2)cc1	1793114538	HUOSYGPXWKRQBK-DFGXFYAUSA-N	430.892	1.701	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CCC(=O)N1	1795702739	IRUHOWVSTAQCPR-ZPLALWFASA-N	428.439	1.789	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc3ccccc13)C2)c1ccc(B(O)O)cc1	1795734514	ROJWGBSJWCNCGH-BBIADKPPSA-N	444.296	1.037	50	20	IDGD	
COc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Cl)cc([N+](=O)[O-])c1OC	1796366949	POEZYPDVDHPYNH-VAECKANCSA-N	445.831	1.350	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1snnc1C1CC1	1796706887	WCIAODADYVKBDO-JJHQXXDFSA-N	433.361	1.855	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(C)(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Cl)C3)C1	1797275247	FAFUZMRXRCTTLH-XJFOESAGSA-N	433.908	1.367	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccn(-c3ccccc3)n1)C2	1797957320	HGZDUMUWXKHURB-UPHUGPLXSA-N	442.592	1.927	50	20	IDGD	
CC#CC[C@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(B(O)O)cc1)C2)c1ccccc1	1798553638	QUHVIVZQEFVUBX-KIHHCIJBSA-N	444.340	1.815	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(OC)cc(OC)c1	1798899304	SNUYVHVUMIGVEU-LTCOOKNTSA-N	426.897	1.161	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c(c1)OCCO3)C2	1799275568	YFMVUAOBRNKILU-ACNBBOPNSA-N	443.327	1.897	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc(OCF)cn1)C2	1799275933	GOYWGTUDEPAEOS-KOZDUTSQSA-N	435.283	1.222	50	20	IDGD	
C[C@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1ccc(O)cc1	1799302226	KXKGOXZFYUCNFO-LLKOPVJYSA-N	429.286	1.776	50	20	IDGD	
CC(C)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1C[C@@]12C(=O)Nc1ccccc12	1800733376	GGFWJQALQXSAGH-XMWNQWDJSA-N	445.947	1.751	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccnn1-c1ccccc1)C2	1800978064	KUCSSPHIYSDORS-HIRMHNASSA-N	432.908	1.329	50	20	IDGD	
COC[C@H](NC(C)=O)C(=O)N1CC[C@@H](CNC(=O)C(C)(C)CCl)[C@H]1c1cccnc1	1802900942	IEGPZPQEXLTSJX-OKZBNKHCSA-N	438.956	1.504	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CC23CCCN2CCC3)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803140386	CYIHNFSZOKVROC-CMKODMSKSA-N	434.968	1.706	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cccn3nccc23)[C@H]1c1cccnc1)[C@@H](O)CCl	1803148663	WCDFWBVQHCMTHM-SNRMKQJTSA-N	427.892	1.649	50	20	IDGD	
COc1cnc(C(=O)NC[C@@H]2CCN(C(=O)[C@H](C)Br)[C@H]2c2cccnc2)cn1	1806046575	JXQNOWDIKZJACX-JDFRZJQESA-N	448.321	1.983	50	20	IDGD	
Cc1cccnc1C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1807366961	WJBMRLJFXPNMAG-DENIHFKCSA-N	444.300	1.098	50	20	IDGD	
C=CCC(F)(F)C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1807374494	ZSBJLZJGAKZJRD-IEBWSBKVSA-N	443.259	1.292	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1CCN(C(=O)Cn2ccnn2)[C@H]1c1cccnc1	1808302045	ASBRYSORSMINFA-ZVZYQTTQSA-N	425.320	1.615	50	20	IDGD	
COCC(=O)N1CCCC2(CCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CC2)C1	1809186948	HLGSRSXIEQLONY-HNNXBMFYSA-N	431.961	1.996	50	20	IDGD	
CCn1nc(C)cc1C(=O)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1	1809967081	RWZCHXIRFCMSIR-UHFFFAOYSA-N	438.337	1.050	50	20	IDGD	
CCc1nc(C(=O)N2CCC3(CCCN(C(=O)c4ccc(B(O)O)cc4)C3)CC2)co1	1809971524	YNECBUHEPIRYAD-UHFFFAOYSA-N	425.294	1.075	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H](CNC(=O)CCc2nc(N)n[nH]2)[C@@H]1c1cccnc1	1810153039	VDVWYOLMOAFYAY-BEFAXECRSA-N	445.600	1.272	50	20	IDGD	
Cc1[nH]ccc1C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1	1810302128	GQXXIRFYFRXVIC-OXJNMPFZSA-N	447.499	1.350	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(=O)cco2)n[nH]1	1816652666	ZOBRWMXPKNVMBY-HNNXBMFYSA-N	430.465	1.042	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H]1CC[C@H]3CCC(=O)N3C1)CC2)[C@@H](F)Cl	1817128803	QTBSXOUDTHTRFR-YYHMBLRTSA-N	428.917	1.991	50	20	IDGD	
CC(=O)C(C)(C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1	1817473888	FIGIGRDQBZSGIS-KRWDZBQOSA-N	426.282	1.011	50	20	IDGD	
Cc1ccc(O)c(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)c1	1817476331	BNPDIAVMHRIUIK-LJQANCHMSA-N	448.288	1.723	50	20	IDGD	
CC(=O)C[C@H](C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1	1817479201	JXPJCJOPZPGSCY-SCLBCKFNSA-N	426.282	1.011	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](C)S)[nH]n1	1818113061	AMZBMYBSUYQBOB-QSINWOOJSA-N	431.522	1.854	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)CCl)CC2)c1cn2ccsc2n1	1819214860	WOHZYSYEGODAIP-KCJUWKMLSA-N	425.923	1.678	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)C3=NNC(=O)C3)sc2C1	1819672985	FOXSNXSFEAYPLA-JGVFFNPUSA-N	428.312	1.105	50	20	IDGD	
CC(C)=NO[C@H](C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1	1820977509	ZSPISJJYWNKNQP-ZBFHGGJFSA-N	435.529	1.576	50	20	IDGD	
O=C([C@@H]1CC[C@@H]2CCC(=O)N2C1)N1CCC([C@H]2CCCCN2C(=O)[C@@H](O)CCl)CC1	1824185625	YXORMCXRTSJZKF-MKXGPGLRSA-N	439.984	1.607	50	20	IDGD	
COc1cc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)n(C)n1	1825478406	GEXIUFMTTUJQGL-KRWDZBQOSA-N	448.568	1.035	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCCn1ccnc1)CC2	1826008718	GCRBNELMOXQTTO-QWHCGFSZSA-N	425.942	1.986	50	20	IDGD	
O=C(CSc1nc[nH]n1)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](F)Br)CC2	1826673730	OFOSOTQNADFNPE-QUBYGPBYSA-N	449.331	1.656	50	20	IDGD	
O=C(c1cncc(O)c1)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827060535	ONXFNCXPZVHBHG-NRFANRHFSA-N	437.305	1.014	50	20	IDGD	
C#CC(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)[C@@H](Cl)COC)C2)C1	1829267652	XCHOFVFMRZFCDB-AVRDEDQJSA-N	447.919	1.326	50	20	IDGD	
O=C(c1ncc(Cl)cc1Cl)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1829606796	MVEVDXPIIYDJCA-CJNGLKHVSA-N	440.686	1.993	50	20	IDGD	
Cc1noc(C)c1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2	1830537460	ITHYMJLEABZPPA-SGTLLEGYSA-N	444.326	1.392	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CCCCN1C)CCO2	1830762904	LPHKCQCUCYBQNY-FCEWJHQRSA-N	446.386	1.101	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3csc(C)n3)CCO2)C1	1832963820	GJCUSUVMELNCCL-VQIMIIECSA-N	429.970	1.858	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)N1CCC(N2CCC(NC(=O)C(C)(C)CCl)CC2)CC1	1833215128	AGDQUXQERMQOOZ-INIZCTEOSA-N	429.993	1.270	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)C3(C(=O)OC)CC3)CC2)CC1	1833534972	PXRCKTZTLAOIOF-KRWDZBQOSA-N	427.973	1.919	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3csnc3C)CCO2)C1	1833749789	VWOFTSIHXNCCNN-YOEHRIQHSA-N	446.367	1.695	50	20	IDGD	
CC[C@@H](NC(C)=O)C(=O)N1CCC(N2CCC(NC(=O)CCBr)CC2)CC1	1834421491	KDRRRATWCFMRCR-QGZVFWFLSA-N	445.402	1.258	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)c3ccccc3)CC2)CC1	1834583489	SWWPFVYEHVOEMI-PMACEKPBSA-N	437.968	1.545	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)c1ccc2c(c1)OCO2	1835280110	RUCNAQDAGRVOGW-KRWDZBQOSA-N	437.924	1.200	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)n1cccc1C=O)CCO2	1835957195	BJCJUMKHDJRXQD-RIFZZMRRSA-N	425.913	1.335	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC(OC2CCN(C(=O)Cn3ccnn3)CC2)CC1	1836670189	BITHGJPORYHTNE-CQSZACIVSA-N	442.358	1.308	50	20	IDGD	
O=C([C@H](O)CCl)N1CCC(OC2CCN(C(=O)[C@H](O)Cc3ccccc3)CC2)CC1	1836719196	PERIFSFSJIAESQ-WOJBJXKFSA-N	438.952	1.188	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@@H]3CCCCN3C)CC2)CC1	1836728622	CIZJCIJZYUSCIJ-OALUTQOASA-N	429.989	1.723	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)CN3CCOCC3)CC2)CC1	1836918867	KFPRNIMQMIKHIM-IBGZPJMESA-N	429.989	1.725	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@H](O)N3CCOCC3)CC2)CC1	1836922865	QNCKUPYOHUNCBT-RXVVDRJESA-N	445.988	1.043	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc4cncn4c3)CCO2)C1	1837118624	XPOHKJJMUNARNT-WIYYLYMNSA-N	434.924	1.812	50	20	IDGD	
COc1ncccc1C(=O)N1CCOC[C@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1837712200	ISCUEZFAQNPMCC-FQEVSTJZSA-N	437.569	1.012	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(F)cnc3Cl)CCO2)C1	1837859521	HMSLOSSQBSRWAV-KDOFPFPSSA-N	434.295	1.962	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3c(F)cncc3F)CCO2)C1	1838161262	GVTBVUQERDUURY-ORAYPTAESA-N	431.867	1.837	50	20	IDGD	
C[C@H](C(=O)N1CCC(OC2CCN(C(=O)CO[Si](C)(C)C)CC2)CC1)n1cnnn1	1838432440	VSYISSNVTDPMCS-OAHLLOKOSA-N	438.605	1.084	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3nnc(C)s3)C2)C1	1839142425	OIHZKADPFKPBPT-RDTXWAMCSA-N	430.958	1.253	50	20	IDGD	
CCn1nccc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2	1839151358	PCXURXMMYRGJAN-ROUUACIJSA-N	433.336	1.209	50	20	IDGD	
Cc1cccc(F)c1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839203758	VJJLGPPHHCKYGS-YJBOKZPZSA-N	447.276	1.895	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3CCC(F)(F)C3)C2)C1	1840029544	JALBQCLNLUKFGZ-ZENOOKHLSA-N	439.297	1.662	50	20	IDGD	
O=C(c1cnc2ccccn12)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840188500	NCRKSKYIGSFMGX-SFHVURJKSA-N	427.288	1.208	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)C(=O)OCC)CCO2	1840882488	ONWKGRNURZGHPV-YWZLYKJASA-N	432.945	1.440	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(F)(C(=O)N2CCCC23CN(C(=O)[C@H](O)CCl)C3)CC1	1841077585	LJVHZMHPEUKMEK-CQSZACIVSA-N	447.935	1.529	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC2(CCCN2C(=O)[C@@H](O)CNC(=O)OC(C)(C)C)C1	1841298036	QHNPEKCQGIRKEM-OLZOCXBDSA-N	448.358	1.106	50	20	IDGD	
CCOc1c(C(=O)N2CCCC23CN(C(=O)[C@H](Cl)COC)C3)cnc2c1cnn2C	1843214841	HVCTYKIGZVMLNM-OAHLLOKOSA-N	435.912	1.438	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)CCc1ncc[nH]1)C2	1844693146	BDIINCOVECBDAZ-UHFFFAOYSA-N	441.444	1.693	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)N1CCCC12CN(C(=O)c1cnccc1C(=O)NN)C2	1844983195	GZNZZWIXAXSKIZ-UHFFFAOYSA-N	443.891	1.478	50	20	IDGD	
COC(=O)c1ccc(CC(=O)N2CC3(CCCN3C(=O)[C@@H](F)Br)C2)s1	1845219053	SMMSWLQRFGMMAZ-CYBMUJFWSA-N	433.299	1.971	50	20	IDGD	
CCOC(=O)N[C@@H](O)C(=O)N1CC2(CCCN2C(=O)/C(C#N)=C/c2ccc(F)cc2F)C1	1845871246	FQZRNVVQTFOHMP-AAKUMTKESA-N	448.426	1.140	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cccnc1CS(C)(=O)=O	1847865398	QYUHCLDBZIQYSC-XIRDDKMYSA-N	427.954	1.849	50	20	IDGD	
COc1ccc(-c2noc(CCC(=O)NNC(=O)Cc3nc4ccccc4n3C)n2)cc1	10123635	QLFDAACKLVSWBW-UHFFFAOYSA-N	434.456	1.955	50	20	IDGD	
Cc1cccc(N2C[C@@H](C(=O)NNC(=O)c3csc(N4CCOCC4)n3)CC2=O)c1C	12801413	QGNROPNVPAFDJH-HNNXBMFYSA-N	443.529	1.411	50	20	IDGD	
Cc1nn(Cc2ccccc2)c2sc(C(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)cc12	16785866	DADLKPFDGKHVNR-CQSZACIVSA-N	432.527	1.650	50	20	IDGD	
CCNS(=O)(=O)c1ccc(C(=O)NNC(=O)[C@@H](C)Oc2ccc(OCC)cc2)cc1	18071971	MPNYSFISQOAGJC-CQSZACIVSA-N	435.502	1.612	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)c2ccc(CCNS(C)(=O)=O)s2)c1C	18103701	YVNGWAGQPRPICQ-CQSZACIVSA-N	439.559	1.685	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)c1ccc(NC2CC2)nc1	115784541	UQLSKGIKHWSJED-UHFFFAOYSA-N	429.502	1.515	50	20	IDGD	
NS(=O)(=O)c1ccc(CNC(=S)NNC(=O)Cc2cccc3ccccc23)cc1	726451100	IAOCJLCOYGGQJE-UHFFFAOYSA-N	428.539	1.725	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)on1)Nc1ccccc1CN1C(=O)CNC1=O	726873537	PDJKLTQHRRONKV-UHFFFAOYSA-N	434.412	1.860	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)C[C@@H](C)NC(=O)C1CCCCC1	727365554	HUFMYFIAONORTN-CYBMUJFWSA-N	437.566	1.524	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)CN2C(=O)N[C@@]3(CCCC[C@H]3C)C2=O)cc1F	727498291	HYFGCVASOCZJDH-NSPYISDASA-N	437.497	1.653	50	20	IDGD	
C[C@@H](CC(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)NC(=O)C1CCCCC1	727535070	NBYICVYMJLRADG-ZDUSSCGKSA-N	434.449	1.374	50	20	IDGD	
COc1cccc(C[C@H](C(=O)NNC(=O)c2cccc(OC(F)F)c2)n2nnnc2C)c1	728485258	UEJYBJYJQDBQBT-QGZVFWFLSA-N	446.414	1.837	50	20	IDGD	
O=C(CN1C(=O)NC2(CCCCC2)C1=O)NNC(=O)c1cc(F)ccc1Br	728548623	LUFXTEDVIJDWIX-UHFFFAOYSA-N	441.257	1.604	50	20	IDGD	
CCOc1cc(C#N)cc(Br)c1OCC(=O)NNC(=O)Cc1cccnc1	728851697	UDHAFJCYGAFEIC-UHFFFAOYSA-N	433.262	1.883	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Cc2c(C)nc3cc(O)nn3c2C)cc(OC)c1OC	729258343	PARRGPOODHMNME-UHFFFAOYSA-N	429.433	1.081	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(C(=O)NNC(=O)Cn2ccc3ccccc32)cc1	729450230	SQUUKHCWJKGMDY-UHFFFAOYSA-N	430.486	1.027	50	20	IDGD	
CC[C@@H](NC(=O)NNC(=O)[C@H](C)Oc1ccccc1F)c1cccc(S(N)(=O)=O)c1	729613508	UBXYWIBRIVLXCE-BLLLJJGKSA-N	438.481	1.722	50	20	IDGD	
C=CCN1CCC(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)CC1	730124886	HSZPKTKTAQIOHB-UHFFFAOYSA-N	435.550	1.066	50	20	IDGD	
CCOCC(=O)NNC(=O)NCc1cccc(S(=O)(=O)NCc2cccc(F)c2)c1	731282942	ZULMAGZHQFNKBC-UHFFFAOYSA-N	438.481	1.171	50	20	IDGD	
O=C(CCCCCNS(=O)(=O)c1ccc2c(c1)OCCO2)NNC(=O)C1CCC1	732141772	VSRXGQOFCWEVRW-UHFFFAOYSA-N	425.507	1.244	50	20	IDGD	
CC(C)NC(=O)Nc1cccc(C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c1	732326101	WJRVRUYOPMGQQM-UHFFFAOYSA-N	443.416	1.743	50	20	IDGD	
CCNC(=O)CCCC(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	732749761	DRAANXLCFPOPBX-UHFFFAOYSA-N	435.484	1.512	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)[C@H]2CC(=O)N(C[C@@H]3CCCN3CC)C2)o1	733139208	FIAOCVAPWLMUBS-IRXDYDNUSA-N	433.553	1.215	50	20	IDGD	
COc1ccc(-c2nc(CN3CCN(CC(=O)NNC(=O)C4CC4)CC3)cs2)cc1	733193131	DWTJKRUDCZGBLO-UHFFFAOYSA-N	429.546	1.494	50	20	IDGD	
COc1ccc(COCCC(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1	736065516	JJQNICJJKIYZJK-UHFFFAOYSA-N	441.893	1.364	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1cc(Cl)cc([N+](=O)[O-])c1	736065978	YBOYOMWVXDOWPR-UHFFFAOYSA-N	425.854	1.925	50	20	IDGD	
COc1ccc(N2C[C@@H](C(=O)NNC(=O)COCc3ccccc3)CC2=O)c(OC)c1	737637329	WHLQEFRQEZSHRU-INIZCTEOSA-N	427.457	1.421	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)c2cc(N3CCNC3=O)ccc2F)cc1C	738699235	PPNNAJIMCCFQMN-UHFFFAOYSA-N	448.476	1.906	50	20	IDGD	
CC(C)[C@H](C(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)N1C[C@H](C)O[C@H](C)C1	741018876	CZBOMKFPTJSWDF-QWQRMKEZSA-N	436.465	1.033	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)N[C@@H](CNC(=O)OC(C)(C)C)C2CC2)nc2ccccc21	741435995	SRHATIBYIGBCIG-HNNXBMFYSA-N	430.509	1.750	50	20	IDGD	
CCO[C@H](C)c1noc(CN2CCN(C(=O)/C(C#N)=C\c3cc(C#N)n(C)c3C)CC2)n1	742793253	LRUZRWSOMLFAMH-LTKMBJGESA-N	437.504	1.937	50	20	IDGD	
COc1ccc(OCCCS(=O)(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)cc1	743268547	XMNAMQDXWWFMSJ-UHFFFAOYSA-N	425.419	1.342	50	20	IDGD	
CC(C)(CNC(=O)NNC(=O)c1nn(-c2ccccc2)cc1O)NC(=O)OC(C)(C)C	745927491	WNNQSLMCBQGICA-UHFFFAOYSA-N	432.481	1.825	50	20	IDGD	
O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)NNC(=O)N1CCOCC1	745988169	SXSBXEHDRMTIJH-ACCUITESSA-N	440.572	1.803	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)c2ccc(OC)c(S(=O)(=O)NC)c2)o1	746392873	SJXALPMBUSQPGT-UHFFFAOYSA-N	438.506	1.113	50	20	IDGD	
CC(=O)N1CC[C@](C)(C(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)C1	746827279	MSMMBYLZBLRUFH-QHCPKHFHSA-N	447.499	1.408	50	20	IDGD	
Cc1cccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)C(=O)N3CCCC3)c2)c1	748246057	DWOPYDBYZHXHTC-UHFFFAOYSA-N	430.486	1.179	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(C#N)c[nH]2)c1	748287156	IHIOKTLYRGCJBJ-UHFFFAOYSA-N	439.453	1.771	50	20	IDGD	
CN(C)N(C(=O)c1cc(O)nc2c(Br)cccc12)[C@@H]1CCS(=O)(=O)C1	750165912	DRDYRUFNTZGCOH-SNVBAGLBSA-N	428.308	1.809	50	20	IDGD	
CC(C)N1C[C@H](NC(=O)NNC(=O)[C@H]2Cc3ccccc3CN2Cc2ccccc2)CC1=O	750646408	XREYIFTYYYUHQX-FGZHOGPDSA-N	449.555	1.953	50	20	IDGD	
COC[C@@H](C)n1c(C)cc(/C=C(/C#N)C(=O)NNC(=O)CNC(=O)c2ccco2)c1C	751204931	SMJFSUXUDDNLGT-KDVQLTRESA-N	427.461	1.390	50	20	IDGD	
CNC(=O)[C@@H](C)NC(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccc(OC)c(OC)c1	752748399	YMXPXJZZIWHPOA-KWZJRMENSA-N	436.472	1.639	50	20	IDGD	
CSC[C@@H](C(=O)NNc1nc2ccccc2c(=O)n1C)N1C(=O)[C@H]2CCCC[C@H]2C1=O	752906422	ITWPADVZGSVRIQ-ZENOOKHLSA-N	443.529	1.283	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NC[C@H]2CCCCS2(=O)=O)c2ccccc2c1=O	753265733	WQNKUWFXXXQKHJ-CQSZACIVSA-N	449.533	1.108	50	20	IDGD	
CCCC[C@H](NC(=O)[C@@H](C)NC(=O)C(C)(C)C)C(=O)NNc1cc(Cl)nc(N)n1	753450339	TWWSCCRMUOSSML-MNOVXSKESA-N	427.937	1.381	50	20	IDGD	
COC(=O)c1cc2c(cc1NC(=O)C(=O)NNc1ccc([N+](=O)[O-])cc1Cl)OCO2	753851478	ANHWADGTIOBCEC-UHFFFAOYSA-N	436.764	1.845	50	20	IDGD	
COc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NNc2ccc(-c3ccccc3)nn2)cc1	754469661	HEMKTZJOZAMAPI-AWEZNQCLSA-N	427.486	1.962	50	20	IDGD	
C[C@@]1(c2ccc(C(=O)OCC(=O)NNC(=O)c3cccc(Cl)c3)cc2)NC(=O)NC1=O	754525214	OIKAIQBCQDDIQX-FQEVSTJZSA-N	444.831	1.013	50	20	IDGD	
CC[C@@]1(c2ccccc2)NC(=O)N(NC(=O)COC(=O)/C(C#N)=C/c2ccc(O)cc2)C1=O	754538553	UWUCEGJZHSLQLR-DTPJYZGHSA-N	448.435	1.731	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2cc(OC)c(OC)c(OC)c2)c2ccccc2c1=O	755349326	UZLLPOPEZRSQHA-UHFFFAOYSA-N	441.444	1.909	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)Nc2nc(CN3CCOCC3)cs2)cc1	755452319	GMAKRLMAFAIKCZ-AWEZNQCLSA-N	447.517	1.798	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2cccc(CN3CCOC3=O)c2)c1	755826336	ARDUVSRSKNVHRG-UHFFFAOYSA-N	432.458	1.509	50	20	IDGD	
CC(C)(C)S(=O)(=O)N1CCC(NC(=O)NNC(=O)COc2ccccc2F)CC1	755901341	UVBCWOHXTOMHGE-UHFFFAOYSA-N	430.502	1.128	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)Nc1ccc(C(=O)N2CCOCC2)cc1	755933380	KWFVBESQGCEOIQ-AWEZNQCLSA-N	430.436	1.918	50	20	IDGD	
N#CCc1ccc(OCc2cccc(NC(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)c2)cc1	755952064	DQKUKCTXKGYDFE-QGZVFWFLSA-N	442.497	1.919	50	20	IDGD	
COCCOc1cc(C)ccc1CNC(=O)NNC(=O)c1nnc(O)c2ccccc12	756099125	GEMMYTIYLVVKJT-UHFFFAOYSA-N	425.445	1.813	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)Nc1cccc(Cn2cncn2)c1	756150001	NFLDSNBIKTWSBY-UHFFFAOYSA-N	448.531	1.691	50	20	IDGD	
C[C@H](c1ccc(NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1)N1CCOCC1	756507134	BXOXBYYRADKCIB-OAHLLOKOSA-N	436.476	1.522	50	20	IDGD	
CSCCNC(=S)NNC(=O)[C@@H]1CCC(=O)N1Cc1ccc(Br)cc1	756892928	MEWKHGDCSHYWJS-ZDUSSCGKSA-N	445.408	1.798	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)CCc1cc(Cl)ccc1Br	758045480	OSLALXWKCFSSMT-MRVPVSSYSA-N	426.720	1.120	50	20	IDGD	
O=C(Cc1csc(-c2ccoc2)n1)N1CCN(S(=O)(=O)CBr)CC1	758528347	SECWWTHVMDUCEB-UHFFFAOYSA-N	434.337	1.772	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccnn2[C@@H](C)C2CC2)cc1	760276813	DDOGBXGPAPCOBH-KBPBESRZSA-N	429.477	1.806	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2cc3ccccc3nc2Br)CCS(=O)(=O)C1	760299686	AGUIFKMSXSLZOW-MRXNPFEDSA-N	441.307	1.134	50	20	IDGD	
N#CCCn1cc(/C=C(\C#N)C(=O)OCC(=O)NC(=O)NC2CC2)c(-c2ccccc2)n1	761384560	ICRLZFCNQZZFTE-LFIBNONCSA-N	432.440	1.902	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)c1ccc2c(c1)CCN2S(C)(=O)=O	761623683	FCUUPHFQBGTWPA-UHFFFAOYSA-N	435.527	1.571	50	20	IDGD	
CN(C)c1ccc2c(c1)N(C)C(=O)C2=NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	761749790	NHIRUVVFMBXTBB-UHFFFAOYSA-N	429.502	1.113	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)[C@@H]2CCCN2C(=O)NCc2cccc(Br)c2)n[nH]1	763139073	UEDGRZZEHCCSBM-HNNXBMFYSA-N	449.309	1.616	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(N3CCOCC3)c(F)c2)cc1OC	763551808	SEGWBMUDEKSWJX-UHFFFAOYSA-N	446.435	1.079	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)Nc1ccc(OCc2ccncc2)cc1	763579558	YFPMBKQGPSKOKL-HXUWFJFHSA-N	448.435	1.587	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(N3C(=O)CCC3=O)c(C)c2)c1	763619068	NKTMQLNGLIYRNU-UHFFFAOYSA-N	438.440	1.122	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)NCc2ccc(N3CCCS3(=O)=O)cc2)cc1	763709669	RDGROTRTZRBGHW-UHFFFAOYSA-N	446.533	1.828	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(OC)cc1C(=O)OC	763716197	CCVIBPDCZBQGEO-UHFFFAOYSA-N	429.429	1.209	50	20	IDGD	
O=C(NNC(=O)C12CC3CC(CC(C3)C1)C2)C(=O)Nc1ccc(CN2CCOC2=O)cc1	763732380	BIJCHXLHXSYENG-UHFFFAOYSA-N	440.500	1.941	50	20	IDGD	
CCNC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)cc1	763735973	VKCZAVSIILUVLH-UHFFFAOYSA-N	442.516	1.504	50	20	IDGD	
Cc1ccncc1NC(=O)C(=O)NNC(=O)c1nn(CCC(C)C)c(=O)c2ccccc12	763844303	YXQBLJDUUPCCLU-UHFFFAOYSA-N	436.472	1.546	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)C(=O)Nc2cccc(-n3nnnc3C)c2)cc1	763892313	YBJXKBRNVQJJFE-UHFFFAOYSA-N	425.474	1.157	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)C(=O)Nc1ccc(SC(F)F)cc1	763916179	BDQISDQNXYVLSI-UHFFFAOYSA-N	433.400	1.377	50	20	IDGD	
CSc1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	763921130	HZURMJPLPKTXFI-UHFFFAOYSA-N	431.865	1.437	50	20	IDGD	
O=C(NNC(=O)c1ccc(COc2ccccc2)o1)C(=O)Nc1ccc(-n2cccn2)nc1	763950101	QMJUVJFXEDBGQB-UHFFFAOYSA-N	446.423	1.839	50	20	IDGD	
COC(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(C)cc3)[nH]n2)cc1	764112288	VEHHYCBSEXLAMT-UHFFFAOYSA-N	435.440	1.500	50	20	IDGD	
CCOC(=O)c1cc(C)sc1NC(=O)C(=O)NNC(=O)c1ccc(Cl)cc1O	764117935	UYYCEQUGUKYQNK-UHFFFAOYSA-N	425.850	1.992	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2cc(F)c(N3CCCC3)c(F)c2)c1O	764132410	VTVYPLNMTSPCMK-UHFFFAOYSA-N	434.399	1.679	50	20	IDGD	
O=C(Cc1ccccn1)NNC(=O)C(=O)Nc1cccc(C(=O)OCc2ccccc2)c1	764264984	WOAAOEZLMSVSPO-UHFFFAOYSA-N	432.436	1.767	50	20	IDGD	
CCN(C(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)Cc2cc[nH]n2)cc1)c1ccccc1	764286659	ZOARHATUOTWBOB-UHFFFAOYSA-N	448.483	1.334	50	20	IDGD	
O=C(CN1CCN(c2ccccn2)CC1)NNc1c(F)cc(C(=O)NC2CC2)cc1F	764332990	CEAXLXRJBXWRML-UHFFFAOYSA-N	430.459	1.517	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)C(=O)Nc1ccc(Oc2ccc(Cl)nn2)cc1	764355101	ZMDDGDBNMQHYNU-UHFFFAOYSA-N	426.820	1.646	50	20	IDGD	
COC(=O)c1ccsc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccccc2OC)[nH]n1	764376265	APMGZLGELIHTDD-UHFFFAOYSA-N	443.441	1.333	50	20	IDGD	
O=C(NNC(=O)C(F)(F)Oc1ccccc1)C(=O)Nc1csc(-c2ccccn2)n1	764379821	LRZBDMYVXXJHRU-UHFFFAOYSA-N	433.396	1.963	50	20	IDGD	
CCOCCC1(CNC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)CCC1	765632976	JCMHLEZQFFQXNK-UHFFFAOYSA-N	425.555	1.829	50	20	IDGD	
C[C@@H](CC(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1)c1ccc(F)cc1	765737454	FOWDTCNCUGILLX-KRWDZBQOSA-N	426.492	1.925	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cc(C)cc([N+](=O)[O-])c3N)CC2)cc1	766640602	GXIACAOITIZCOY-UHFFFAOYSA-N	440.504	1.373	50	20	IDGD	
CCn1nc(C)c(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)c1Cl	766655654	XVJJDMSVFPDZDH-UHFFFAOYSA-N	432.912	1.084	50	20	IDGD	
CCC(=O)N1CCC[C@@H](C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)C1	766659272	AAWQWJQBBJJEPD-GOSISDBHSA-N	449.983	1.254	50	20	IDGD	
O=C(NNc1ncnc2ccsc12)c1ccc(F)c(S(=O)(=O)Cc2ncon2)c1	766668995	CKEDOHPNIZTRJO-UHFFFAOYSA-N	434.434	1.944	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2CCCc3cccnc32)c1	767403777	PLJLVDHKSWPFKN-GOSISDBHSA-N	430.530	1.993	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1C	767737619	MPQNAEOZKGDAMX-UHFFFAOYSA-N	426.517	1.742	50	20	IDGD	
CC(C)OCCCn1c(NNC(=O)C(=O)N2CCC[C@@H](C)C2)nc2ccccc2c1=O	767922007	NDQXTEWOYVFMDR-MRXNPFEDSA-N	429.521	1.913	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2c(C)cnn2Cc2ccccc2F)c1O	769264239	CMBKUAXNSSIPQL-UHFFFAOYSA-N	441.419	1.493	50	20	IDGD	
CCNC(=O)N(C)NC(=O)c1ccc(OC)c(S(=O)(=O)N2C[C@@H](C)C[C@H](C)C2)c1	770549174	MHKKCBVINSYTLT-KBPBESRZSA-N	426.539	1.668	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)[C@H]3CCN(c4ccc(F)cc4)C3=O)nc21	770966572	SCRBYAACBPBORG-CYBMUJFWSA-N	427.440	1.922	50	20	IDGD	
O=C(CCNS(=O)(=O)c1cccc([N+](=O)[O-])c1)NNc1ccnc(Br)c1	771537481	MSZMQLJAZCJLGA-UHFFFAOYSA-N	444.267	1.564	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@H]2C(=O)O[C@@H](C)C(=O)NNC(=O)CC(C)C)c(OC)c1	771989681	VJRUSJLZMBDLRV-YOEHRIQHSA-N	449.504	1.434	50	20	IDGD	
CC[C@@H](C)NS(=O)(=O)c1cccc(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2)c1	773643533	AXLGGYIEFHXDBC-GFCCVEGCSA-N	435.462	1.753	50	20	IDGD	
CNS(=O)(=O)c1ccc2c(c1)N(C(=O)C(=O)NNc1ncc(Cl)cc1Cl)CC2	773678306	NSJUINPTMIOTEP-UHFFFAOYSA-N	444.300	1.329	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccc(CCN(C)C)cc1	774009370	OMOWCKTXLPCEBC-CQSZACIVSA-N	432.908	1.998	50	20	IDGD	
CS(=O)(=O)C[C@@H](NC(=O)NNC(=O)c1cc(Br)c[nH]1)c1ccccc1	774278653	IPTKBLRJVZYQAL-CYBMUJFWSA-N	429.296	1.507	50	20	IDGD	
CC(C)C(=O)NNS(=O)(=O)c1cc(C(=O)O)c(Br)cc1Br	775669157	GVRWDBVQUZJDJE-UHFFFAOYSA-N	444.101	1.875	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc2c(c1)OCCCO2)NNc1ccc(C(F)(F)F)cn1	776264094	NBEGKSZUDJCMBU-UHFFFAOYSA-N	446.407	1.683	50	20	IDGD	
COc1cccc([C@@H]2[C@@H](C(=O)NNC(=O)c3cccc(OC)c3O)CC(=O)N2C2CC2)c1	776467229	KDYPEWMTBSJYTR-FXAWDEMLSA-N	439.468	1.923	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)N[C@@H]2CC(=O)N([C@@H]3C[C@H]3c3ccccc3)C2)c1	776623750	PIQTWBDJGGHTEY-NZSAHSFTSA-N	428.514	1.873	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)NC[C@H]2COC3(CCOCC3)O2)c(C)n1-c1ccccc1	777755227	BNZWBRONMOTZHW-SFHVURJKSA-N	428.489	1.960	50	20	IDGD	
CC[C@@H](C)n1nc(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)cc1C	778392336	LYHHCIXWLZLGRG-OAHLLOKOSA-N	434.566	1.856	50	20	IDGD	
CC(C)N(C)S(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)CNC(=O)OC(C)(C)C)c1	778440311	DVSKZULOJKVBMD-UHFFFAOYSA-N	446.501	1.140	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)COc1ccc(I)cc1	778441211	PRYBWAKCQXOABP-UHFFFAOYSA-N	449.245	1.342	50	20	IDGD	
CCN1C[C@H](CN(C)CC(=O)NNC(=O)c2ccc(OC)c(OC)c2)Oc2ccccc21	781437527	YFKDGWAOCLENAZ-KRWDZBQOSA-N	442.516	1.684	50	20	IDGD	
CC(C)CCNS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2cncc(Cl)n2)cc1	783266389	SGVBMMCBHULDIH-UHFFFAOYSA-N	440.913	1.536	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)NC[C@H]2COC(C)(C)O2)c2ccccc2c1=O	783267052	GKEDCHDKAMNNNK-AWEZNQCLSA-N	431.493	1.682	50	20	IDGD	
O=C(NNc1ccc(Br)cn1)C(=O)Nc1ccc(C(=O)N2CCOCC2)cc1	784339415	IVAKVZFDFFEXQQ-UHFFFAOYSA-N	448.277	1.398	50	20	IDGD	
CN(C)C(=O)CNC(=O)c1ccc(NC(=O)C(=O)NNc2ccc(F)cc2)cc1Cl	784784578	OEYPTKQGPSLGCH-UHFFFAOYSA-N	435.843	1.379	50	20	IDGD	
COC(=O)c1ccc(Cl)c(NC(=O)C(=O)NNc2cccc(S(C)(=O)=O)c2)c1	784841691	OIBJGDGFODSKGZ-UHFFFAOYSA-N	425.850	1.612	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)C(=O)Nc2cnn(-c3cnc4ccccc4n3)c2)c1	784854394	XJFXNEPFROKOJT-UHFFFAOYSA-N	431.412	1.684	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C[C@@H](NC(=O)OC(C)(C)C)C2CC2)c2ccccc2c1=O	785013980	OQAWPTKBRLVPQA-MRXNPFEDSA-N	443.504	1.871	50	20	IDGD	
O=C1CN(c2ccc(NC(=O)C(=O)NNc3cc(C(F)(F)F)ccc3F)cc2)CCN1	785170557	JEJPDISAJQTNPB-UHFFFAOYSA-N	439.369	1.863	50	20	IDGD	
O=C(COC(=O)c1nc(Cl)ccc1Cl)NNC(=O)[C@H]1COc2ccccc2O1	785188732	CEEYTXVWCGDECM-GFCCVEGCSA-N	426.212	1.533	50	20	IDGD	
COCc1ncsc1C(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	786392263	PVIVYXPBHVKIQY-UHFFFAOYSA-N	437.953	1.522	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)c2cc(N3CCNC(=O)C3)ccn2)c1	786684414	WYQZWVMJYQBIPN-UHFFFAOYSA-N	425.489	1.290	50	20	IDGD	
CCOC(=O)c1csc(CCNC(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)n1	786849242	TWOAWKCISFSRAA-UHFFFAOYSA-N	448.509	1.789	50	20	IDGD	
CC(C)CN1C[C@H]2CN(C(=O)NNC(=O)c3ccc(Br)s3)CCN2C1=O	787756430	HKIKGPBZAIYLCL-LLVKDONJSA-N	444.355	1.943	50	20	IDGD	
CN(C)[C@@H]1CCOc2c(NC(=O)C(=O)NNC(=O)Cc3cn4ccccc4n3)cccc21	789767555	BDMBOBVHJNCIOB-QGZVFWFLSA-N	436.472	1.048	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)c2nnn(Cc3ccc(F)cc3F)c2C)cc1	791662713	DFKUGEAWSRHVCR-UHFFFAOYSA-N	443.410	1.839	50	20	IDGD	
COC(=O)c1ccc(NC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)c(N(C)C)c1	792414400	DKGFEVGZCZRIAT-UHFFFAOYSA-N	438.444	1.897	50	20	IDGD	
O=C(Cc1ccc2n[nH]cc2c1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	792773348	FYBLETJBRYPFDS-UHFFFAOYSA-N	427.486	1.351	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1	794064124	WIGODFHTAVKCJO-UHFFFAOYSA-N	427.417	1.857	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2cc(Br)cnc2-n2cccn2)n1	797369657	CWCUVKBWUHQGMZ-UHFFFAOYSA-N	444.249	1.133	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2CCCN(C(=O)Cc3ccc(F)cc3)C2)cc1	801108876	UHZMWHPJCPCEHW-KRWDZBQOSA-N	440.475	1.701	50	20	IDGD	
C[C@@H](CCNS(=O)(=O)c1ccccc1)NC(=O)NNC(=O)c1cccc2ncccc12	801797784	MPTVOAUZSXZOES-HNNXBMFYSA-N	441.513	1.936	50	20	IDGD	
CSC[C@H](C(=O)NNC(=O)Nc1ccc2c(c1)OCO2)N1C(=O)[C@H]2CCCC[C@@H]2C1=O	802104816	LACQKMOSPACJFG-MELADBBJSA-N	448.501	1.475	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NC[C@@H]2CC(c3ccc(OC)cc3)=NO2)cc1	802363163	KDWCTTQCOSPWIO-SFHVURJKSA-N	428.445	1.606	50	20	IDGD	
N#Cc1ccc(N2CC[C@H](C(=O)NNC(=O)C(=O)NCc3ccc(Cl)cc3)C2)c(F)c1	804534501	RGAVZICTKPFULB-HNNXBMFYSA-N	443.866	1.641	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@H]2CCCN2C(=O)C(F)(F)F)cc1Br	806840129	LLQGAASTTJBPQW-SNVBAGLBSA-N	438.200	1.772	50	20	IDGD	
Cc1cc(S(=O)(=O)NCCNC(=O)NNc2ccc3c(=O)[nH]ccc3c2)c(C)s1	807000173	LHSDZDJACJZIRS-UHFFFAOYSA-N	435.531	1.811	50	20	IDGD	
C[C@H]1[C@H](NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)CCN1Cc1ccccc1	807622260	QRNRGMPYAGBRON-HNAYVOBHSA-N	430.530	1.697	50	20	IDGD	
CC(C)n1cc(C=NNC(=O)c2cc(S(=O)(=O)NCc3ccccc3)ccc2O)nn1	807959931	GTKJVTNVFJJVEJ-UHFFFAOYSA-N	442.501	1.807	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1cc(C)n(-c2ccc(F)cc2F)n1	808934562	LCVZPAJXDUTAIJ-UHFFFAOYSA-N	443.410	1.796	50	20	IDGD	
CC/C=C(\C)C(=O)NNC(=O)C[C@@H]1c2cc(OC)c(OC)cc2CCN1S(C)(=O)=O	809999533	OFVRMGAZJFPQEN-ROCHPLJESA-N	439.534	1.456	50	20	IDGD	
O=C(CCc1ncccn1)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	812532586	YRVWZSXQJGEQJV-UHFFFAOYSA-N	428.452	1.629	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)c2ccc(Cl)c(NS(C)(=O)=O)c2)cc1	812728573	PUCXHDZZSNNGSQ-UHFFFAOYSA-N	446.938	1.719	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccnc(-c3ncc[nH]3)c2)c1	814194144	AKEVNSWLCSWKQA-UHFFFAOYSA-N	442.501	1.577	50	20	IDGD	
CC(=O)Nc1cc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)N(C)C)ccc1C	815751170	SYYMEZMRJBBHKI-UHFFFAOYSA-N	433.490	1.286	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NNC(=O)[C@H]2CCN(c3ccc(F)cc3)C2=O)C1	816510237	PWDCRLMABHRLDF-RHSMWYFYSA-N	448.495	1.973	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)[C@H](NS(=O)(=O)C1CC1)C(C)C	816827252	KGWUIUOMYBRNAC-OAHLLOKOSA-N	436.559	1.986	50	20	IDGD	
Cc1cc(F)ccc1S(=O)(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	873921099	STLOLJMMYQMDIG-UHFFFAOYSA-N	441.506	1.542	50	20	IDGD	
O=C(Cc1cccc2ccccc12)NNC(=O)C1CCN(c2ccc3nncn3n2)CC1	914448114	JVROSWOBLXEHNY-UHFFFAOYSA-N	429.484	1.884	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)[C@@H]2CCCN(C(=O)Cc3ccccc3)C2)c2ccccc2c1=O	914750686	WQBHRPVQJRMTTC-QGZVFWFLSA-N	447.495	1.176	50	20	IDGD	
COCCOC(=O)c1c(C)[nH]c(C(=O)NNC(=O)c2nnc(O)c3ccccc23)c1C	915636588	WNVFAVUZYXBRHA-UHFFFAOYSA-N	427.417	1.158	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)n2nc(C)cc2n1	916743496	MDERIQJIGVLZCO-UHFFFAOYSA-N	442.501	1.205	50	20	IDGD	
CCOc1ccc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)c3cnns3)cc2)cc1	917393941	ZUABSIFXAXXDSE-UHFFFAOYSA-N	447.498	1.812	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)c1nc2ncc(Br)cn2n1	919809806	KUMRLLNTIYCPMQ-UHFFFAOYSA-N	429.032	1.052	50	20	IDGD	
COC(=O)N1CCC(NC(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)CC1	920051344	IWXURUGNRCHTKG-UHFFFAOYSA-N	430.465	1.152	50	20	IDGD	
CN(C)C(=O)COc1ccccc1C=NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	920368378	NKILSCDPXGZQQF-UHFFFAOYSA-N	438.893	1.218	50	20	IDGD	
COc1ccc2cc(C(=O)OCC(=O)NNC(=O)[C@@H]3COc4ccccc4O3)[nH]c2c1	928989701	DPQMZRPPAGFJIB-SFHVURJKSA-N	425.397	1.321	50	20	IDGD	
Cc1nn(-c2ccccc2)c2sc(C(=O)NNC(=O)N[C@@H](C)c3nnnn3C)cc12	1123738502	VORMXWIEYBZEBT-NSHDSACASA-N	425.478	1.624	50	20	IDGD	
COc1cccc(C[C@@H](O)C(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)c1	1326124322	LJAVDVOHGSGAPO-QGZVFWFLSA-N	436.509	1.234	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)c2ccccc2NS(C)(=O)=O)CC1	1328653341	LMDPFDGDHDJTLK-UHFFFAOYSA-N	440.522	1.466	50	20	IDGD	
CC(C)C[C@@H](C(=O)NNC(=O)c1n[nH]c2c1CCCC2)N1C(=O)[C@H]2CC=CC[C@H]2C1=O	1337139591	GQSZNCSTEMPIBI-VBQJREDUSA-N	427.505	1.415	50	20	IDGD	
CC1(C)NC(=O)N(CCCNC(=O)NNC(=O)c2ccc(F)cc2Br)C1=O	1527949451	GUQANFPQJLXLTC-UHFFFAOYSA-N	444.261	1.253	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2nccc3[nH]ccc23)C1	1777904645	BWHGFFCHIQWVLW-QLVMHMETSA-N	434.924	1.944	50	20	IDGD	
O=C(c1cc(Cl)cc2nn[nH]c12)N1CC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1780223161	AUCSOLDUONHZFQ-MRXNPFEDSA-N	432.695	1.859	50	20	IDGD	
C[C@@H](Cn1cccn1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Br)C1	1780770997	OTEQXYNIAUHOBK-LUXYFRNMSA-N	445.333	1.724	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3c(Br)cnn3C)CCO2)C1	1781219600	VLFYPERUDBYJNB-WBMJQRKESA-N	433.734	1.644	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(OC(F)F)cc3)C2)C1	1781703305	BFFTYKNQBCXDQZ-DNVCBOLYSA-N	432.851	1.985	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)C2)C1	1781765624	HBUYDKUPBMVZFD-CRAIPNDOSA-N	429.832	1.431	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cn1ccnc1C)C2	1781905268	MPNMUAQMFCYKOZ-GPMSIDNRSA-N	441.370	1.879	50	20	IDGD	
C[C@@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)Br)C1)n1cncn1	1782002906	WXHFTPDSXPDACW-UMPJEAMMSA-N	428.331	1.136	50	20	IDGD	
O=C([C@@H]1Cc2[nH]nc(C(F)(F)F)c2C1)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Cl)CCO2	1782847009	KJPPSPUAJOOUTF-LUFJJVMOSA-N	438.809	1.508	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)COC(=O)C(F)(F)F)CCO2)C1	1783349652	QMRCWCFLDSYEPZ-HZMBPMFUSA-N	445.232	1.095	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)COCc3ccc(C)c(C)c3)CCO2)C1	1783874545	DRBOULNKYWRUEV-DENIHFKCSA-N	438.952	1.904	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cc3ccccc3o1)CCO2	1783934387	FOOPRVNYBBEEKK-QFIPXVFZSA-N	428.489	1.249	50	20	IDGD	
O=C(c1cnc(-c2ccccn2)nc1)N1CCO[C@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783943027	DRGKCAMJDXOTBH-IBGZPJMESA-N	436.299	1.786	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H]3CCc4nc[nH]c4C3)C2)C1	1784345998	UVZOZQJMIPKPJF-BIENJYKASA-N	439.354	1.376	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](C)Oc3cccnc3)C2)C1	1784539710	NOZAVRKMHCQGDO-ZRGWGRIASA-N	440.338	1.710	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)C3(F)CN(C(=O)OC(C)(C)C)C3)C2)C1	1785687159	KHAODJFQRZMJHU-AUUYWEPGSA-N	447.935	1.793	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3c[nH]c4ncccc34)C[C@@H]21	1786407353	YQJCCYYBAKADNU-RCBQFDQVSA-N	435.322	1.941	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3(C(F)(F)F)CCC3)[C@H]2C1	1786757912	YKIIEKICLZJWOL-FQUUOJAGSA-N	426.863	1.953	50	20	IDGD	
C[C@H](Br)C(=O)NC1(c2ccc(NC(=O)C[C@@H]3NC(=O)NC3=O)cc2)CCC1	1786764537	PAAPMQURDVYNTM-GWCFXTLKSA-N	437.294	1.502	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)c1noc2c1CCCC2	1787308109	KUSIGNCJVNOUQR-ZAJUMQRFSA-N	444.301	1.837	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cn3nc(C)cc3C)C[C@@H]21	1790961228	MWKMENCLUKUUGY-NXOAAHMSSA-N	441.370	1.653	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(C)(C)C(C)(F)F)C[C@@H]21	1791287932	DWTHHMMSHCNIBQ-KKUMJFAQSA-N	432.512	1.021	50	20	IDGD	
C[C@@H](Cn1ccnc1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]21	1791628393	NNQOXDQCFOCZJZ-SIBFUHKCSA-N	431.364	1.735	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CC1CCN(C)CC1	1792608014	UIKVPHDWAVAWCU-KYHPRHEASA-N	430.387	1.481	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)n1cccc1C=O)C2	1792868471	YLLKWWLMKLOSSQ-LBKYZSNHSA-N	440.338	1.482	50	20	IDGD	
Cc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)CBr)c(C)n1C	1792872335	AIZFCRKCSJMRIB-FIUQPQMISA-N	426.355	1.876	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCC(=O)N1CCCC1	1793803958	IXNVBVDSAAYTJJ-QOIYZWAUSA-N	434.364	1.215	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2cccn2cn1	1797655111	VJIPDORTCCRBRO-SSYSSCGSSA-N	447.499	1.720	50	20	IDGD	
Cn1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)C(Cl)Cl)C3)c(C(F)(F)F)n1	1798113875	ZBTSLLZGOAVOIA-DIYOJNKTSA-N	429.226	1.446	50	20	IDGD	
CC(=O)N[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@](C)(Cl)CCl)C(C)(C)C	1799273751	GHZCYMOTFLSDRD-YHZMMZGRSA-N	436.380	1.363	50	20	IDGD	
C[C@H](Nc1cccnc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@](C)(Cl)CCl	1799275046	LUUDWXCRSMEUJA-WXZWTWHISA-N	429.348	1.708	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN(C)NC(=O)NCc1ccccc1)C2	1800072881	GMXVHCWZRVHMHF-FCGDIQPGSA-N	449.983	1.988	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)NC(=O)OC(C)(C)C	1800590915	SRFFCQUBPVSKPN-DKBOKBLXSA-N	448.358	1.499	50	20	IDGD	
CCOC(=O)C1(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](Br)CC)CC1	1800642867	AJLQVNBKUHMGHL-CRWXNKLISA-N	431.327	1.093	50	20	IDGD	
Cc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCBr)C3)cc(C)c1O	1801700982	DQRHATUBXXVQKX-SCAQPMJSSA-N	425.323	1.997	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]2c2cccnc2)n(C(F)F)n1	1803142532	ZISNQHXZSGIIMA-FVQBIDKESA-N	441.866	1.901	50	20	IDGD	
Cn1cccc(C(=O)NC[C@H]2CCN(C(=O)CO[Si](C)(C)C)[C@@H]2c2cccnc2)c1=O	1803833947	JSOCSQHUEZEEJK-YLJYHZDGSA-N	442.592	1.951	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC2(CCCN(C(=O)c3cccnc3Cl)C2)CC1	1804660905	NOZZWYQOWKWJAH-UHFFFAOYSA-N	435.956	1.953	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC2(CCCN(C(=O)C3CC(O)C3)C2)CC1	1805417267	ACWZDFOICYYLKY-BUVRLJJBSA-N	429.521	1.123	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCCC2(CCN(C(=O)c3cc(=O)n4[nH]nnc4n3)CC2)C1	1806157067	QPOXGOREGSAFDT-CYBMUJFWSA-N	435.916	1.065	50	20	IDGD	
Cc1noc(CC(=O)N2CC[C@@H](CNC(=O)CCBr)[C@@H]2c2cccnc2)n1	1806340774	MZFKBDLNKWLCGG-KSSFIOAISA-N	436.310	1.807	50	20	IDGD	
O=C(CCBr)NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1	1806340978	SNQMGIBXKFKZSW-SCLBCKFNSA-N	449.305	1.992	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)Cc2ccccc2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807363822	OVGQNFRQUKYSNN-QPPBQGQZSA-N	443.312	1.324	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)ccn1	1807374795	JJTHAWZNEKOWLD-IRLDBZIGSA-N	444.300	1.098	50	20	IDGD	
Cc1nnc(CC(=O)NC[C@@H]2CCN(C(=O)[C@@H](F)Br)[C@@H]2c2cccnc2)o1	1807478297	GXJZEHDFIOZHJP-APHBMKBZSA-N	440.273	1.712	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H](CNC(=O)[C@H](F)Cl)[C@@H]1c1cccnc1)[C@@H]1SC(=N)NC1=O	1808313559	ZWEIQGZARGRXRO-SWTDPAGASA-N	441.916	1.424	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC2(CCCN(C(=O)CN3CCCC3=O)C2)CC1	1809556130	OGLAUACIJUKMPF-OAHLLOKOSA-N	428.371	1.871	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)c1cccn2ccnc12	1809888177	WLQMIOANSICWJS-SZMVWBNQSA-N	427.892	1.649	50	20	IDGD	
O=C(c1cc(F)cc(F)c1)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1	1809978058	SNTZQFPQTCHLQJ-UHFFFAOYSA-N	442.271	1.803	50	20	IDGD	
CCCC(=O)N[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](Cl)COC)[C@@H]1c1cccnc1	1810513880	IGNOIDOJDKPLOJ-QSOKESPWSA-N	438.956	1.646	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2ccc3nn[nH]c3c2)[C@H]1c1cccnc1	1812302072	QJZHQRHFSZCMKS-JTDSTZFVSA-N	442.907	1.926	50	20	IDGD	
O=C(Cn1ccncc1=O)NC[C@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1	1812342641	YGCGVRQHQHBFRK-DNVCBOLYSA-N	448.321	1.129	50	20	IDGD	
C/C=C/C=C\C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1	1812578943	VOUJBGPIQBDFGX-PWNNCYNXSA-N	434.500	1.532	50	20	IDGD	
Cc1cccc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)c1	1815361056	UVHQOCFPUQOBMZ-KRWDZBQOSA-N	435.314	1.671	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ncc(F)cc2F)n[nH]1	1815448244	MIOLYLRWJRFAPC-HNNXBMFYSA-N	449.462	1.762	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2nc3ncccn3n2)n[nH]1	1818621207	UKDLCXLFDSXSMH-DGCLKSJQSA-N	432.872	1.407	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CO[Si](C)(C)C)n[nH]1	1819595323	HSPSWGJHAYAWPF-HIFRSBDPSA-N	438.605	1.961	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2[nH]cc3c2CCC3)n[nH]1	1820107025	FATNJPJYCZAGBL-KRWDZBQOSA-N	441.536	1.905	50	20	IDGD	
C=C(C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2)C(F)(F)F	1825263966	FEPRUOGJTFDQIN-GFCCVEGCSA-N	439.224	1.167	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](C)n1ccccc1=O)CC2	1826000593	YBYYTDPPPIWHHX-AVGNSLFASA-N	438.937	1.732	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(=O)n3[nH]cnc3n2)CC1	1827049515	OWEXQEFTIRXKOB-ZBFHGGJFSA-N	434.928	1.668	50	20	IDGD	
CC[C@H](C)[C@@H](O)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827055805	JZGHQRMUIFQNEJ-ORYQWCPZSA-N	430.354	1.007	50	20	IDGD	
C=CCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCN2C(=O)OCc1ccccc1	1828551977	YLTSHQAEMJHEIF-PGRDOPGGSA-N	449.935	1.614	50	20	IDGD	
CC(C)(C)[C@H](O)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1	1828923274	BCXJRCXWDSVJBU-RTBURBONSA-N	445.564	1.325	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CCC(F)(F)C1)CCO2	1829657817	CEEHCUBCQHGUSL-ZENOOKHLSA-N	439.297	1.662	50	20	IDGD	
O=C([C@H](O)CCl)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2CC[C@H]3CCC(=O)N3C2)CC1	1830208814	FTUUBURWZRMXSA-YDZRNGNQSA-N	439.984	1.607	50	20	IDGD	
Cn1nc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)c2c1CCC2	1830362204	OACRNTVDOVXHNB-NRFANRHFSA-N	438.956	1.244	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](OC(C)=O)C(C)C)C2)C1	1831651199	NTYKEMHLIIZXQB-ABSDTBQOSA-N	432.945	1.438	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3c(C)n[nH]c3C)C2)C1	1831654480	UCOGSDRDQFTJGM-FXAWDEMLSA-N	426.945	1.433	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H](C)n2cnnn2)CC1	1832287915	SYNFMGYZVDWUSF-IIAWOOMASA-N	441.374	1.885	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3ccc(C)cn3)CCO2)C1	1832995363	IUFUIYABSLGUNS-WIYYLYMNSA-N	439.940	1.033	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3ccn4cncc4c3)CC2)CC1)[C@@H](O)CCl	1833310141	KONBLKBVJJNMGQ-IBGZPJMESA-N	433.940	1.119	50	20	IDGD	
Cc1nc(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](F)Cl)CC3)CC2)c(=O)[nH]c1C	1833938614	HEGFCJZCDSJLJG-MRXNPFEDSA-N	427.908	1.106	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cncc(C)c3)CCO2)C1	1834288112	LDYFQUVQZRLGTE-LPHOPBHVSA-N	440.338	1.634	50	20	IDGD	
Cc1cscc1C(=O)N1CCOC[C@@]2(CN(C(=O)CCBr)CCO2)C1	1834821399	ICCXMTFHJDIXOP-QGZVFWFLSA-N	431.352	1.912	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1)[C@@H]1CC1(F)F	1835450668	PJIYSEKIETTXKU-STQMWFEESA-N	426.277	1.904	50	20	IDGD	
CNc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)cc1	1835606181	FCLPICSQQXQCIW-NRFANRHFSA-N	435.597	1.650	50	20	IDGD	
CC(=O)N(C)CCC(=O)N1CCC(N2CCC(NC(=O)[C@@H](F)Br)CC2)CC1	1836413479	GHSMOWADAMFYFT-QGZVFWFLSA-N	449.365	1.117	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC(OC2CCN(C(=O)[C@H](C)CC(N)=O)CC2)CC1	1836670863	VLWLIGLPYQXXEU-ZIAGYGMSSA-N	446.386	1.528	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)/C=C/c3cc(C)on3)CCO2)C1	1837552325	KQIBLCQHTZJVPZ-YWFTZVROSA-N	425.913	1.860	50	20	IDGD	
O=C(CCBr)N1CCC(OC2CCN(C(=O)Cc3cnc[nH]3)CC2)CC1	1837653686	QYYDDMRYJMMPEE-UHFFFAOYSA-N	427.343	1.736	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(F)n3)CCO2)C1	1837910463	TWVWBVAGMAQJDV-SJCJKPOMSA-N	430.274	1.074	50	20	IDGD	
Cc1nc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCBr)C3)C2)sc1C	1838406249	UJBJRIMKGIOHPY-QGZVFWFLSA-N	446.367	1.615	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(F)ccc3F)CCO2)C1	1838860407	FVYXNRYDIUNBBH-XIKOKIGWSA-N	447.276	1.818	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3ccc(OC)nc3)C2)C1	1839142348	NCLVAJBAKJVJRS-UTKZUKDTSA-N	439.940	1.497	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccnc4ncccc34)C2)C1	1839147906	GQEMQKWKOBJEAR-UTKZUKDTSA-N	432.908	1.717	50	20	IDGD	
Cc1cc(/C=C/C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)no1	1839200386	JPJNQDDYGSHOGZ-YTUMRWECSA-N	446.273	1.143	50	20	IDGD	
Cc1cc(F)ccc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839203417	KOBIKPFAVBGZFL-QAPCUYQASA-N	447.276	1.895	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)Oc1ccccc1)CCO2	1839219829	XIGSHMMXYYPVKI-PLMTUMEDSA-N	440.924	1.164	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1nc3ccccc3o1)CCO2	1839502223	JEPWPTZXURJKOP-NRFANRHFSA-N	447.564	1.749	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cscc3OC)C2)C1	1840152335	FSWHCEYAEHYNDF-KBXCAEBGSA-N	432.926	1.081	50	20	IDGD	
O=C(C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2)c1ccc(Cl)cc1	1840186401	HAGPDZJXIMYMPY-GOSISDBHSA-N	449.718	1.783	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCCn3ccnc3C)CCO2)C1	1840388343	UIKAOAFWEZRHFN-YLJYHZDGSA-N	426.945	1.446	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@H]2CC(=O)N(Cc3ccccc3)C2)C1	1841505729	QYMUWTGAFLPQCW-MSOLQXFVSA-N	433.936	1.492	50	20	IDGD	
O=C(c1cc2sccc2s1)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843014035	QFKYOSZHVCBGML-UHFFFAOYSA-N	426.328	1.773	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)[C@@H](C)Nc1nccs1)C2	1843416058	UMONKQRMSPEHNC-CBOPYVSYSA-N	443.533	1.281	50	20	IDGD	
CN(CC(=O)N1CCCC12CN(C(=O)c1ccns1)C2)NC(=O)NCc1ccccc1	1845038499	JIPNDHIDUDOPFN-UHFFFAOYSA-N	442.545	1.306	50	20	IDGD	
CN(CC(=O)N1CCCC12CN(C(=O)c1cc(F)c[nH]1)C2)NC(=O)NCc1ccccc1	1845039317	FAXISLVMBQGPGD-UHFFFAOYSA-N	442.495	1.317	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@]1(NC(=O)OC(C)(C)C)CCOC1)C2	1845166372	QSFLNPYJMOPSAO-XOBRGWDASA-N	429.945	1.891	50	20	IDGD	
CCOc1ccc(Cl)cc1C(=O)N1CC2(CCCN2C(=O)CCC(=O)NN(C)C)C1	1846385626	AOQIEOVZLJNLSM-UHFFFAOYSA-N	436.940	1.929	50	20	IDGD	
CCC(=O)N[C@H](C)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)/C(C#N)=C/c1ccc(F)cc1F	1847742233	XRRSXLUUIDYPCO-NGQCVYHVSA-N	430.455	1.988	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NN[C@H](C(=O)NC2CC2)c2ccc(F)cc2)cc1	10834529	MJMNGJDJCKWQGN-FQEVSTJZSA-N	448.520	1.395	50	20	IDGD	
COc1ccc(-n2nnnc2SCC(=O)NNC(=O)c2cc(Cl)ccc2OC)cc1	10861155	VZZXIWYXFGAGBJ-UHFFFAOYSA-N	448.892	1.886	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@H](C)NC(=O)OCc2ccccc2)cc(OC)c1OC	26687630	SDYPCJSVKVFSIJ-ZDUSSCGKSA-N	431.445	1.788	50	20	IDGD	
CCc1noc(CCCC(=O)NNC(=O)c2cccc(S(=O)(=O)N(CC)CC)c2)n1	108112493	DAHHSSVGWXJFEF-UHFFFAOYSA-N	437.522	1.446	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCCO[C@H]1CCCC[C@@H]1C	117322260	QBFRMVDIENRNKG-ZFWWWQNUSA-N	425.555	1.827	50	20	IDGD	
Cc1ccc(NC(=O)[C@H]2CCCN(C(=O)NNC(=O)CNC(=O)c3cccs3)C2)nc1	725872558	DPEBULSFQPJULN-AWEZNQCLSA-N	444.517	1.273	50	20	IDGD	
O=C(NNC(=S)NCCc1ccccn1)c1ccc(S(=O)(=O)N2CCCC2)cc1	726122047	OASNTUCAWYUKBP-UHFFFAOYSA-N	433.559	1.218	50	20	IDGD	
C[C@]1(c2ccc(CNC(=O)NNC(=O)Cc3ccc(Cl)cc3)cc2)NC(=O)NC1=O	726282123	JFWCONDQGDQMKD-HXUWFJFHSA-N	429.864	1.468	50	20	IDGD	
CC[C@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1	727114416	RSAUMTXHWXWVFA-HNNXBMFYSA-N	442.538	1.066	50	20	IDGD	
CCOc1ccc(OCC)c(NC(=S)NNC(=O)c2csc(S(N)(=O)=O)c2)c1	727492437	QSVNAXQULAYDJN-UHFFFAOYSA-N	444.560	1.824	50	20	IDGD	
CN(C)N(C(=O)CCCCOc1ccc(S(C)(=O)=O)cc1)[C@H]1CCS(=O)(=O)C1	728162180	UAWWUSUZHQPQCY-HNNXBMFYSA-N	432.564	1.132	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)COc3ccccc3Cl)cc2)CC1	728213093	FGUHGEHTRMNTRB-UHFFFAOYSA-N	438.937	1.798	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(Br)cc1)C1CCN(c2ncccn2)CC1	728856303	NANWUJYTHDGRHC-UHFFFAOYSA-N	440.323	1.465	50	20	IDGD	
O=C(CCCCC/N=C1/NS(=O)(=O)c2ccccc21)NNC(=O)Cc1cccnc1	728891951	MJGGPLSEHALLJO-UHFFFAOYSA-N	429.502	1.071	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Cc2ccccc2Br)c1	729297617	AZKYRPTXYDYIDJ-UHFFFAOYSA-N	440.319	1.703	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)N2CCN(Cc3cnn(C)c3)CC2)N(C)c2ccccc21	729975328	ROMRMQWLMNRPMQ-UHFFFAOYSA-N	447.543	1.735	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)Cc2cc[nH]n2)c1	730091585	MJHQFOMDDAJFIC-UHFFFAOYSA-N	429.458	1.223	50	20	IDGD	
C[C@H]1CCCN(S(=O)(=O)c2cc(C(=O)NNC(=O)Cc3ccc(F)cc3)n(C)c2)C1	730205691	VORQERKEYIDAJJ-AWEZNQCLSA-N	436.509	1.589	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)Cc2cccc(NS(C)(=O)=O)c2)cc1OC	730205794	XCNXEPMFZAQMCU-UHFFFAOYSA-N	435.502	1.859	50	20	IDGD	
C[C@@H]1CCCN(S(=O)(=O)c2cc(C(=O)NNC(=O)Cc3ccccc3F)n(C)c2)C1	731330083	MVMAVKWWPABUNX-CQSZACIVSA-N	436.509	1.589	50	20	IDGD	
COC[C@@H](C)n1c(C)cc(/C=C(\C#N)C(=O)NC2CCN(CC(=O)N(C)C)CC2)c1C	731655700	ZLSUNYHRFFWMQJ-XNHPLOEXSA-N	429.565	1.888	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2c[nH]nc2C)cc(S(=O)(=O)N2CCC(C)CC2)c1C	731851865	UYPPXNKYQRSAST-UHFFFAOYSA-N	433.534	1.830	50	20	IDGD	
COc1ccc(-n2c(C)cc(/C=C(/C#N)C(=O)N3CC[C@@H](S(N)(=O)=O)C3)c2C)cc1	732664242	LLQNTAJHJRWCHW-ZZODWALSSA-N	428.514	1.899	50	20	IDGD	
O=C(NNc1ccc(Br)nc1)c1ccc(S(=O)(=O)N2CCOCC2)o1	732837418	FJXCUCMTDIVUQF-UHFFFAOYSA-N	431.268	1.215	50	20	IDGD	
CNS(=O)(=O)c1ccc(C(=O)NNc2cc(C(F)(F)F)nc(-c3cccnc3)n2)o1	734257944	XYALXRYDPLHDMX-UHFFFAOYSA-N	442.379	1.815	50	20	IDGD	
O=C(NNc1nccnc1Cl)c1ccc(Cl)c(S(=O)(=O)NC[C@H]2CCCO2)c1	734261644	RJQCJYYGTFWCGC-LLVKDONJSA-N	446.316	1.998	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC(C(=O)NNc3ncnc4[nH]cnc34)CC2)cc1C	740746841	RWGMDILTYCKNQT-UHFFFAOYSA-N	429.506	1.514	50	20	IDGD	
CC1(C)[C@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)[C@@H]2CCO[C@H]21	741425553	LWWMJRIDWMGFGD-GVDBMIGSSA-N	436.534	1.229	50	20	IDGD	
C[C@H]1CN(C[C@H](C)C(=O)NN=Cc2c(N3CCOCC3)nc3ccccn23)C[C@@H](C)O1	741812003	JWFRTZJJENDFID-OKZBNKHCSA-N	428.537	1.366	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)[C@H]2CCN(c3cccc(Cl)c3)C2=O)c2ccccc2c1=O	742034841	WZVALLDNOVOZON-MRXNPFEDSA-N	439.859	1.401	50	20	IDGD	
CC(C)(C)c1nc2ccc(S(=O)(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)cc2s1	743250643	GWIQPDSVNCZBKP-JTQLQIEISA-N	431.561	1.338	50	20	IDGD	
CCOc1ccc(S(=O)(=O)Nc2cccc(C(=O)NNC(=O)N3CCOCC3)c2)cc1	745992825	LEFWBJPQFZOWMH-UHFFFAOYSA-N	448.501	1.573	50	20	IDGD	
O=C(NCCNS(=O)(=O)c1cccnc1)NNC(=O)c1ccc(Cl)cc1Cl	746326946	VVZBQDKFNYDGKJ-UHFFFAOYSA-N	432.289	1.311	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)CCNC(=O)c1ccc2ccccc2c1	746602636	SQEDCNWRZRRGEA-UHFFFAOYSA-N	443.504	1.815	50	20	IDGD	
CSCC[C@@H](NC(=O)c1ccc2ccccc2n1)C(=O)NNc1nccn(C)c1=O	747937660	JCTHGBJXFBJXEU-MRXNPFEDSA-N	426.502	1.323	50	20	IDGD	
CC(C)(C)CC(=O)N1CCC[C@H]1C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	748162570	UYPJATDNZJMNPI-FQEVSTJZSA-N	443.592	1.773	50	20	IDGD	
COc1cc(OC)cc(N2CC[C@H](NC(=O)NNC(=O)c3c(C)nc4ccccn34)C2)c1	748660925	HEERSHSFOSHDHR-HNNXBMFYSA-N	438.488	1.883	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)[C@H]1CCn2ccnc2C1	749258030	JCOCEZBILNNLPS-INIZCTEOSA-N	430.940	1.064	50	20	IDGD	
CCCN1CCC[C@H]1C(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	749560650	DEKGTCDGGSNSGT-FQEVSTJZSA-N	444.557	1.801	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)[C@@H]1CCCN(C(=O)C2CC2)C1	750123236	YLVMSEDKPKZNRF-CYBMUJFWSA-N	437.880	1.301	50	20	IDGD	
Cc1nnc2n1C[C@@H](C(=O)NNC(=O)c1nc(-c3ccccc3)n(-c3ccccc3)n1)CC2	750715606	STHKCBBYJSVUNH-KRWDZBQOSA-N	442.483	1.858	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)Cn2c(S)nnc2-c2ccc(Cl)cc2)cc1	751199838	LHRZNSUTVGSHOJ-UHFFFAOYSA-N	442.888	1.985	50	20	IDGD	
Cc1nn(-c2ccccc2)c2nc(C(=O)NNC(=O)CNC(=O)c3cccs3)ccc12	751206155	FEZGCHGTGYDGOQ-UHFFFAOYSA-N	434.481	1.981	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C1=Cc2cc(Br)ccc2OC1	751208492	DWOUOTDCQXINJP-UHFFFAOYSA-N	436.287	1.864	50	20	IDGD	
C[C@H](SCC(=O)Nc1ccc(F)cc1)C(=O)NNC(=O)CNC(=O)c1cccs1	751209176	MHEJNEWMMIAOKI-NSHDSACASA-N	438.506	1.525	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)c2cc(Cn3cc(Br)cn3)on2)c1	751540516	HCNYVMARYONULX-UHFFFAOYSA-N	434.250	1.830	50	20	IDGD	
CN(C)N(C(=O)[C@@H]1CC(=O)N(CCOc2ccccc2Cl)C1)[C@H]1CCS(=O)(=O)C1	752761890	CFDCBYWSVCDCFT-CABCVRRESA-N	443.953	1.060	50	20	IDGD	
C[C@@H](C(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)c1ccc(S(C)(=O)=O)cc1	753481715	DHSPGGSAXAAFEH-GFCCVEGCSA-N	449.441	1.106	50	20	IDGD	
O=C(NNC(=O)N1CCO[C@@H](CCc2ccccc2)C1)C1CCN(c2ncccn2)CC1	754187424	TWSLFXMXCCPHDF-FQEVSTJZSA-N	438.532	1.767	50	20	IDGD	
O=C(NCc1ccco1)NNC(=S)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1	754392858	SIXXIWHVZLHDEL-UHFFFAOYSA-N	439.519	1.001	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NNc2cccnc2Cl)o1	754479816	GJKLRKQFJVSZHY-LBPRGKRZSA-N	442.881	1.801	50	20	IDGD	
Cc1ccc(C(=O)N(C)C)cc1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	755888815	HYKDRYMAUGHGEM-UHFFFAOYSA-N	447.517	1.414	50	20	IDGD	
CC(=O)Nc1c(C)ccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1C	756143633	LCTSBCDZCTVREB-UHFFFAOYSA-N	447.517	1.979	50	20	IDGD	
CCc1ccc(NC(=O)NNC(=O)COc2ccc(Cl)cc2)cc1S(N)(=O)=O	756526956	UZDGHMNEBRRJCC-UHFFFAOYSA-N	426.882	1.782	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)COc2ccccc2F)cc1N1CCCS1(=O)=O	756704202	HCNIEHGDGNFJCD-UHFFFAOYSA-N	436.465	1.906	50	20	IDGD	
Cc1nc(-c2ccc(C)c(NC(=O)NNC(=O)C3CCN(c4ncccn4)CC3)c2)n[nH]1	756871606	OHULRBPHVJCCNL-UHFFFAOYSA-N	435.492	1.948	50	20	IDGD	
Cc1cnn(-c2ccc(S(=O)(=O)NNC(=O)c3ccc4c(c3)OCCO4)cc2F)c1	757646213	UUOSZVXTUKCSTA-UHFFFAOYSA-N	432.433	1.714	50	20	IDGD	
CS(=O)(=O)CCc1ccc(NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1	757749580	RTJLEXGAVLIYFK-UHFFFAOYSA-N	446.533	1.133	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)Cc1cccc(OCc2ccc(Cl)cc2)c1	758024493	HBCPSQYEPFEUHS-ZDUSSCGKSA-N	439.921	1.547	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)c1cccnc1Nc1cccc(C(F)(F)F)c1	758034119	DPQYUUNJHMVUEE-SNVBAGLBSA-N	445.423	1.543	50	20	IDGD	
CO[C@H]1Cc2ccc(NC(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)cc2C1	758053522	DXOOQOXDTKEDHP-KRWDZBQOSA-N	432.502	1.517	50	20	IDGD	
CS(=O)(=O)N1CCc2c(NC(=O)NNC(=O)c3nnc(O)c4ccccc34)cccc21	758299067	ORYHUUHTASMQFI-UHFFFAOYSA-N	442.457	1.124	50	20	IDGD	
C[C@H](CC(=O)N1CCN(S(=O)(=O)CBr)CC1)C(=O)c1cccc(F)c1	758513804	ULNTVBURZJLMOV-GFCCVEGCSA-N	435.315	1.861	50	20	IDGD	
Cc1ccc(-c2nc(C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)cs2)n1C	759020551	ODUSIRSQIYOGMY-UHFFFAOYSA-N	425.518	1.925	50	20	IDGD	
COc1ccc(-c2nn(CCC#N)cc2/C=C(/C#N)C(=O)NCCc2nc[nH]n2)cc1OC	759227608	PRSYHDVHCPFBNV-YBEGLDIGSA-N	446.471	1.865	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)N=c1cc[nH]cc1I	760028953	KJWYJCRQOXNRGN-UHFFFAOYSA-N	426.214	1.512	50	20	IDGD	
CN(C)CC1(CNC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)CCCC1	760174166	BSHXFYSOEZCTLJ-UHFFFAOYSA-N	430.597	1.651	50	20	IDGD	
COc1ccc2c(c1)OC[C@H]2CC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1	760264484	PZUXCFCDQKESDD-OAHLLOKOSA-N	447.513	1.338	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)c1nc(-c2ccccc2)no1	760288229	WNWBMMXZAQOOQN-CYBMUJFWSA-N	433.432	1.460	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)C1(NC(=O)OC(C)(C)C)CC1	761520951	ATXRYGQCSCJSOG-UHFFFAOYSA-N	441.868	1.710	50	20	IDGD	
C[C@@H](OC1CCCCCC1)C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	761568899	ZJJNXVZWOCWWGP-MRXNPFEDSA-N	439.582	1.589	50	20	IDGD	
CCC(=O)N1CC[C@H](NC(=O)NNC(=O)[C@H]2Cc3ccccc3CN2Cc2ccccc2)C1	762381687	DAGYSWYRXIJQMY-FCHUYYIVSA-N	449.555	1.955	50	20	IDGD	
O=C(CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@@H]12)NNC(=O)c1cc(-c2cccs2)[nH]n1	763157858	MAIGBIGHCMJRFQ-DUVNUKRYSA-N	434.547	1.625	50	20	IDGD	
COC(=O)c1cccc(C#Cc2cccc(NC(=O)C(=O)NNC(=O)c3cccnc3)c2)c1	763488957	RYSOXTNGTREPLQ-UHFFFAOYSA-N	442.431	1.668	50	20	IDGD	
COC(=O)c1c(F)cccc1NC(=O)C(=O)NNC(=O)c1cc(OC)c(OC)c(OC)c1	763539169	JRJKWRNSGCIZJW-UHFFFAOYSA-N	449.391	1.038	50	20	IDGD	
O=C(COc1cccc(C(F)(F)F)c1)NNC(=O)C(=O)Nc1c[nH]nc1-c1ccccn1	763641533	XANICSLLXFFARU-UHFFFAOYSA-N	448.361	1.655	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccnn1-c1cccc(Cl)c1	763657371	KXUFABIHDONTHG-UHFFFAOYSA-N	443.847	1.699	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(C(=O)N(C)C)c(Cl)c2)cc1	763662682	YUTHQFQKBDZHIJ-UHFFFAOYSA-N	448.863	1.215	50	20	IDGD	
COC(=O)c1cc(Cl)ccc1NC(=O)C(=O)NNC(=O)CN1CCCc2ccccc21	763736375	SPIWAAVVMQHKTF-UHFFFAOYSA-N	444.875	1.665	50	20	IDGD	
Cc1nc(Br)ccc1NC(=O)C(=O)NNC(=O)CN1CCCc2ccccc21	763745738	JMOSYJWNUNCSPN-UHFFFAOYSA-N	446.305	1.691	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(Cl)c2N2CCOCC2)cc1	763822019	UOVWEZMSMACIQC-UHFFFAOYSA-N	446.891	1.650	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3oc(=O)n(CCN(C)C)c3c2)cc1	763829653	DKUAGIMBYCFBLW-UHFFFAOYSA-N	439.472	1.118	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(-n3cncn3)c(F)c2)c1C	763853424	YYKHZLGBRMVYGT-CQSZACIVSA-N	440.435	1.577	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)OC)c(F)c2)cc1	763862598	YKJSZVJJRXCMKI-LBPRGKRZSA-N	447.419	1.564	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cccc(-n3ccnn3)c2)cc1	763862601	YOIXWKNJEAGTMA-AWEZNQCLSA-N	438.444	1.219	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)C(=O)Nc2ccc(S(C)(=O)=O)cc2C)cc1	763898165	MIBQDGAJJHZNLY-UHFFFAOYSA-N	435.527	1.585	50	20	IDGD	
COc1cc(C)c(NC(=O)C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc1OC	763947285	AQYBOJUENIBPQP-UHFFFAOYSA-N	439.428	1.303	50	20	IDGD	
O=C(Cc1ccsc1)NNC(=O)C(=O)Nc1cccc(N2C(=O)c3ccccc3C2=O)c1	764025326	PKNWSQYRSSLSKL-UHFFFAOYSA-N	448.460	1.877	50	20	IDGD	
O=C(NNC(=O)c1cccc(Br)c1)C(=O)Nc1ccc(N2CCOC2=O)cc1	764059009	MNIHYBUVOBBLGZ-UHFFFAOYSA-N	447.245	1.805	50	20	IDGD	
O=C(NNC(=O)C1CCCC1)C(=O)Nc1ccc(C(=O)NCc2ccccn2)c(Cl)c1	764067119	YJJSMWIJOUIHGK-UHFFFAOYSA-N	443.891	1.941	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1O)C(=O)Nc1ccccc1CN1CCOCC1	764117693	PEVBUCVCMSKQAU-UHFFFAOYSA-N	432.864	1.278	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)C(=O)Nc1cccc(OC[C@@H]2CCCO2)c1	764243364	VLVOPZGSLCTIGE-IBGZPJMESA-N	436.468	1.985	50	20	IDGD	
O=C(Cc1ccccn1)NNC(=O)C(=O)Nc1ccc(=O)n(Cc2ccccc2Cl)c1	764267160	QDBMMKIAOKATGB-UHFFFAOYSA-N	439.859	1.274	50	20	IDGD	
COCC(=O)NNC(=O)C(=O)Nc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(C(F)(F)F)c1	764303837	PJYFKWNWYUDHMT-QWRGUYRKSA-N	432.399	1.051	50	20	IDGD	
CCNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)c1	764376793	HYEXTSDLDXOXEB-UHFFFAOYSA-N	426.458	1.288	50	20	IDGD	
CN(C)CCOc1ccc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)cc1	764378596	KEFMFOQFNYXEDM-UHFFFAOYSA-N	436.415	1.385	50	20	IDGD	
COc1cc(C(=O)N(C)C)ccc1NC(=O)C(=O)NNC(=O)c1ccc(Cl)cc1F	764411083	QQBMEIBLSKGWMJ-UHFFFAOYSA-N	436.827	1.589	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NN=Cc1cnn(-c2ccc(F)cc2)c1	764830702	NTLUHPXAOXMVAI-UHFFFAOYSA-N	434.475	1.920	50	20	IDGD	
CC(C)(C)OC(=O)N1CCO[C@@H](C(=O)NNC(=O)c2ccc(F)cc2Br)C1	764940666	TYEXRCOTOIVQFX-CYBMUJFWSA-N	446.273	1.985	50	20	IDGD	
C[C@@H](c1ccsc1)N1CCN(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)CC1	765194349	MPEHQCMIKCWNGC-AWEZNQCLSA-N	426.506	1.457	50	20	IDGD	
O=C(CCCc1nc2ccccc2[nH]1)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765738793	OKCKHSBTGBCIOD-UHFFFAOYSA-N	448.527	1.491	50	20	IDGD	
O=C(Cc1ccc2c(c1)CCO2)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	765752334	RFYOZQXLNMLXMT-UHFFFAOYSA-N	442.947	1.783	50	20	IDGD	
CCNC(=O)N(C)NC(=O)[C@@H](CCS(C)(=O)=O)NC(=O)c1ccc(C(C)(C)C)cc1	768411104	WYROUVRBMLERRE-MRXNPFEDSA-N	440.566	1.210	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1n[nH]c(C)c1Br	768623513	QGMVCLOUUJKXON-UHFFFAOYSA-N	445.657	1.761	50	20	IDGD	
C[C@H](CNC(=O)OC(C)(C)C)NC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	768954773	STJQDOQEIMGLTA-LLVKDONJSA-N	429.499	1.339	50	20	IDGD	
COc1ccccc1[C@@H](CNC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)OC(C)C	770304589	BLQOBNXKKACWIZ-LJQANCHMSA-N	439.476	1.781	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)NCc3cnn(CC(F)(F)F)c3)nc21	770410729	CPXZMWAUVGIWHK-UHFFFAOYSA-N	427.391	1.872	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)NCc2ccc(Br)cc2N2CCOCC2)cn1	770416078	JVTHWJARNPGLQB-UHFFFAOYSA-N	437.298	1.163	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)c3cc(F)ccc3I)nc21	770973726	GWWGEUUNGVXITF-UHFFFAOYSA-N	428.165	1.570	50	20	IDGD	
CO[C@H](c1ccc(F)cc1)[C@H](C)NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	771434575	PLBKRLONPMQWLV-SGTLLEGYSA-N	427.436	1.793	50	20	IDGD	
COc1ccc(/C=C\C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1O	771845518	MIMSOYVCSCHBOF-NTMALXAHSA-N	445.497	1.660	50	20	IDGD	
O=C(NCC1CCN(c2ccncc2)CC1)NNC(=O)C1CCN(c2ncccn2)CC1	771963488	BTVKPJLRTAYGPZ-UHFFFAOYSA-N	438.536	1.335	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)[C@H](C)NC(=O)c1ccc(Br)s1	772036995	MSRPBQNHGAQXBT-VHSXEESVSA-N	448.339	1.754	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)c1cc(S(=O)(=O)N(C)C)ccc1O	772996254	HHNPHTXFIQUIPD-LLVKDONJSA-N	441.893	1.524	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)C(=O)Nc2cc(C)nn2-c2ccc(C)nn2)cc1	773498645	BOWDLEDPBGIRHG-UHFFFAOYSA-N	439.501	1.466	50	20	IDGD	
CCN1CCN(C(=O)c2ccc(NC(=O)C(=O)NNc3ccccc3[N+](=O)[O-])cc2)CC1	773651146	OZFACKGTMYVPBR-UHFFFAOYSA-N	440.460	1.454	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ccccc2[N+](=O)[O-])cc1OCC(=O)NC1CC1	773654096	PTSPOQCNOLKKNC-UHFFFAOYSA-N	443.416	1.343	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccc(-n2ccnn2)cc1	774008264	KPCSXSLEAAZOSK-LBPRGKRZSA-N	428.836	1.474	50	20	IDGD	
Cc1ccc(-n2nccc2NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)nn1	774010222	WOINKTYNULCMMT-GFCCVEGCSA-N	443.851	1.178	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)NCCC(C)(C)O)cc1	775967255	GJOFZECZDCOQJV-VBKFSLOCSA-N	425.489	1.618	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1)Nc1ccnn1[C@@H]1CCS(=O)(=O)C1	776054297	FGFNKJQXQICHPG-CYBMUJFWSA-N	447.452	1.238	50	20	IDGD	
CO[C@@H]1[C@@H](C)[C@@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)C1(C)C	776069695	NNCONXDKEMDFJL-IAOVAPTHSA-N	438.550	1.475	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2ccc(OCC(F)(F)F)nc2)cc1OC	777907085	MHNRAQRYXNXAAX-UHFFFAOYSA-N	435.380	1.663	50	20	IDGD	
CN(C)C(=O)COc1ccccc1C(F)(F)C(=O)NNC(=O)c1cccc(N(C)C)c1	778543787	FZHAVFOFYUYRJW-UHFFFAOYSA-N	434.443	1.773	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)C(=O)Nc1ccccc1-c1c(F)cccc1F	778711284	XNULKNCHASSMQD-LLVKDONJSA-N	437.424	1.152	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(C(=O)NNC(=O)CCNC(=O)OC(C)(C)C)cc1	780970501	CXYFCFVIOWXQKA-UHFFFAOYSA-N	428.511	1.049	50	20	IDGD	
Cn1ncc(NC(=O)C(=O)NNC(=O)c2ccc(Br)s2)c1C(F)(F)F	782120936	NASPZHYGNWCJSM-UHFFFAOYSA-N	440.201	1.663	50	20	IDGD	
Cc1csc(-c2ccc(NC(=O)C(=O)NNC(=O)CNC(=O)c3ccco3)cc2)n1	784004456	NUVWLTLTYYAFRL-UHFFFAOYSA-N	427.442	1.227	50	20	IDGD	
COC(=O)c1ccc(C)c(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)c1	784835806	IKFHNYRLUOEPMH-UHFFFAOYSA-N	441.412	1.860	50	20	IDGD	
COCC1(C(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)CCC1	785684054	IJEITKFUKRSEBU-UHFFFAOYSA-N	431.514	1.743	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc(Cl)ccc1OCC1CCC1)[C@@H]1CCS(=O)(=O)C1	786724183	MYUUOZDYKTXOAV-GFCCVEGCSA-N	436.939	1.263	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)NCc2ccc(Cl)cc2)c1	787427887	GYNLJAZSXPIGDT-UHFFFAOYSA-N	428.873	1.874	50	20	IDGD	
CS(=O)(=O)c1cc(NC(=O)C(=O)NNC(=O)CCc2ccccc2O)ccc1Cl	788334449	VGDSZNAISZNGNZ-UHFFFAOYSA-N	439.877	1.168	50	20	IDGD	
CCOC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)cc1	789822226	UNBLOUCLHUXULC-ROUUACIJSA-N	425.441	1.522	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(\C#N)C(=O)N2CCN(C(=O)C(=O)NC(C)C)CC2)c1C	790903405	CRNJABCGCWWTSN-RONKMWSCSA-N	443.548	1.415	50	20	IDGD	
CC(=O)N1CCCN(c2ccc(F)cc2NC(=O)C(=O)NNc2ccc(C#N)cc2)CC1	790954095	QZHZEOWYTMOBPC-UHFFFAOYSA-N	438.463	1.838	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NCC2(S(C)(=O)=O)CCC2)c2ccccc2c1=O	793268378	CGPCZLXCSFVLJP-UHFFFAOYSA-N	449.533	1.108	50	20	IDGD	
Cn1cc2c(n1)CCCC2=NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	794465368	NTRMHUBJLYBRNO-UHFFFAOYSA-N	445.545	1.230	50	20	IDGD	
CCOC(=O)c1ccc(F)c(S(=O)(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c1	795293551	IYTNCEUFMRZVGD-UHFFFAOYSA-N	444.462	1.029	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2c(C)nsc2NC2CC2)cc1OC	796644311	SQHTWJCOSFMEDC-UHFFFAOYSA-N	434.474	1.661	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(F)c(N3CCOC3=O)c2)c1	796989968	NXAFDARCZMVEGF-UHFFFAOYSA-N	429.408	1.248	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)c(OC)c(C)c1OC	797012299	OYYKYGBCXAXQBF-UHFFFAOYSA-N	449.485	1.605	50	20	IDGD	
CNC(=O)[C@]1(C)CCN(C(=O)NNC(=O)[C@H](C)Oc2cccc(Br)c2)C1	797606922	TUCMAHMOYHZAKR-APPDUMDISA-N	427.299	1.415	50	20	IDGD	
Cc1ccc(-c2nnc(S)n2CC(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)cc1	798308723	MMRHDOLCRQQMEE-UHFFFAOYSA-N	438.513	1.945	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)NCCN1CCN(C)C(C)(C)C1	799686347	SSBLUNAOZXBTMV-QGZVFWFLSA-N	427.549	1.964	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccc(I)cc2)cc1	801110731	FMMVSWAPMSSBAI-UHFFFAOYSA-N	437.237	1.928	50	20	IDGD	
Cn1c(S)nc2cc(C(=O)NNC(=O)Nc3ccc(S(C)(=O)=O)cc3)ccc2c1=O	802067865	OWQCNTUIHMRGGV-UHFFFAOYSA-N	447.498	1.092	50	20	IDGD	
CC(C)[C@H](NC(=O)OC(C)(C)C)C(=O)NCC(=O)NNc1ccc2c(=O)[nH]ccc2c1	803429979	PWXZDZYPMQPLCH-KRWDZBQOSA-N	431.493	1.637	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)NC3C[C@@H]4CC[C@H](C3)N4CC(=O)N(C)C)cc2C1	804869047	SGCCIWZKHUZGLJ-LNRIEFBSSA-N	447.605	1.901	50	20	IDGD	
COc1ccc(CN2CC[C@H](NC(=O)NNC(=O)c3ccccc3OC)C2=O)c(OC)c1	805096810	CDIZHMYKFBXJCL-KRWDZBQOSA-N	442.472	1.458	50	20	IDGD	
COc1ccc(CN2CC[C@H](NC(=O)NNc3nc(C)cc(OC)n3)C2=O)c(OC)c1	806029480	LAXQXCQXDLDPBH-HNNXBMFYSA-N	430.465	1.238	50	20	IDGD	
CC(C)(C(=O)NNC(=O)CNC(=O)c1cccs1)S(=O)(=O)c1ccc(Cl)cc1	806736302	JJMXHOWXUGHIND-UHFFFAOYSA-N	443.934	1.531	50	20	IDGD	
Cc1cc([N+](=O)[O-])ccc1NNC(=O)C(=O)Nc1ccc(CC(=O)N2CCOCC2)cc1	807455337	CSDVUQTZJKUWLW-UHFFFAOYSA-N	441.444	1.386	50	20	IDGD	
COC(=O)c1ccc(Cl)c(C(=O)N2CCN(S(=O)(=O)CBr)CC2)c1	810912256	WDDQQTYONISRHX-UHFFFAOYSA-N	439.715	1.567	50	20	IDGD	
CC(C)(C)OC(=O)NC/C=C\CNC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	812473470	KEDGOVHTNDNMCK-WAYWQWQTSA-N	426.495	1.115	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ncc(C(F)(F)F)s2)cc1OC	812978646	ADCDBYRWRKEELU-UHFFFAOYSA-N	432.380	1.969	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2cc3c(cc2F)NC(=O)CC3)cc1	813034071	XKVBDNUYESYWON-UHFFFAOYSA-N	449.464	1.043	50	20	IDGD	
Cc1ccccc1NC(=O)NNC(=O)C(=O)Nc1nnn(Cc2ccccc2F)c1C	815590292	QLPLXDWVSGEMDH-UHFFFAOYSA-N	425.424	1.874	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCc2nncn2C1)C(=O)Nc1cccc(CSC2CCCC2)c1	815692049	IHTDKHOYXLCDMK-HNNXBMFYSA-N	442.545	1.802	50	20	IDGD	
O=C(NNc1nc[nH]n1)c1cc(S(=O)(=O)NCCOc2ccccc2)ccc1Cl	816634447	IKQXOWNNZHSMST-UHFFFAOYSA-N	436.881	1.572	50	20	IDGD	
O=C(NNC(=O)c1csc(COc2ccc(F)cc2)n1)c1ccc(-n2cnnn2)cc1	894394818	QULVXTBFJKXKEF-UHFFFAOYSA-N	439.432	1.912	50	20	IDGD	
O=C(NNC(=O)C1CCN(C(=O)COc2ccccc2)CC1)c1cc(Br)c[nH]1	914847154	VCDVIKPXCRCAAZ-UHFFFAOYSA-N	449.305	1.856	50	20	IDGD	
C[C@@H]1CN(c2ccc(C(=O)OCC(=O)NNC(=O)c3cccc(Cl)c3)cn2)C[C@@H](C)O1	915039347	ZBBSSCZYHYDGQN-ZIAGYGMSSA-N	446.891	1.967	50	20	IDGD	
COc1cc(CNC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)ccc1OC(F)F	915931632	CWMHHTRAJFDCBM-UHFFFAOYSA-N	443.428	1.844	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NCc2ccc(C(=O)N3CCCC3)cc2)cc1	916253123	SQFLCPFAHSNUGC-UHFFFAOYSA-N	426.473	1.841	50	20	IDGD	
Cc1ncc2c(n1)CC[C@@H](NC(=O)NNC(=O)COc1ccc(Br)cc1)C2	916318758	XRQRYTFLPFDLLC-CQSZACIVSA-N	434.294	1.814	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)NC1CCN(CCN(C)C)CC1	916383016	XFOXFYSWUFVNET-QGZVFWFLSA-N	427.549	1.964	50	20	IDGD	
CCS(=O)(=O)N(C)CCCNC(=O)NNC(=O)c1ccc(Br)s1	916580434	YSOLNFJRYISZEP-UHFFFAOYSA-N	427.346	1.126	50	20	IDGD	
COc1cccc(/C=C(/C#N)C(=O)OCC(=O)NN2C(=O)NC3(CCC(C)CC3)C2=O)c1	916612987	KLQPQOGLBAPSHT-YBEGLDIGSA-N	440.456	1.677	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)NCc1cccc(C(=O)NC2CC2)c1	916648947	OOEAOTOAWYCBSP-UHFFFAOYSA-N	427.417	1.396	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)[C@@H]2CC(=O)N(c3ccc(Cl)cc3)C2)nc2ccccc21	916736319	IPNZMUNKPTVIJD-CYBMUJFWSA-N	425.876	1.970	50	20	IDGD	
Cc1cc(C)nc(SCC(=O)NN=Cc2c(C)nn([C@H]3CCS(=O)(=O)C3)c2C)n1	917025496	YGGCBNSUKOEUJY-HNNXBMFYSA-N	436.563	1.509	50	20	IDGD	
Cc1c(NC(=O)CSCC(=O)NNC(=O)C(C)(C)C)c(=O)n(-c2ccccc2)n1C	917180346	UQUVSBKITCYGNM-UHFFFAOYSA-N	433.534	1.350	50	20	IDGD	
CCOc1ccc(C(=O)NNS(=O)(=O)c2ccc(CCNC(C)=O)cc2)cc1OC	917727066	ATDHRVGDJZFMOD-UHFFFAOYSA-N	435.502	1.396	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)N(C)CC(=O)N[C@@H]2CCS(=O)(=O)C2)c(C)n1CC(C)C	919747024	XJIORFAEZVYEGU-MMWCCMKASA-N	434.562	1.430	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCCN2C(=O)c3ccccc3C2=O)ccc1OC(C)C	919788213	FWRMQQDMIIIWRY-UHFFFAOYSA-N	440.456	1.723	50	20	IDGD	
CN(C)C(=O)CN1CCN(C(=O)/C(C#N)=C\c2cn(CCC#N)nc2-c2ccccc2)CC1	920430602	SXGUFKDJLWUDJE-HKWRFOASSA-N	445.527	1.603	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)NNC(=O)Cc2ccccc2OC)cc1OC	920940364	DZODNHLHNVAETE-UHFFFAOYSA-N	436.490	1.861	50	20	IDGD	
Cc1nnnn1[C@@H](Cc1cccc(F)c1)C(=O)NNC(=O)c1cncn1-c1ccccc1	1115852727	JWEYVLFLJLTTBW-SFHVURJKSA-N	434.435	1.551	50	20	IDGD	
O=C(CCCC[C@@H]1SC[C@H]2NC(=O)N[C@@H]21)NNC(=O)c1ccc(Br)cc1	1318053824	CUNFBZYMOUPTGF-IPYPFGDCSA-N	441.351	1.936	50	20	IDGD	
CC1(C)C(=O)N(C[C@](C)(O)C(=O)NNC(=O)c2cncn2-c2ccccc2)c2ccccc21	1320884066	NBIFDEQISRYOGD-DEOSSOPVSA-N	447.495	1.709	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](N)Cc2cccnc2)C1	1778056841	FGWYLYCLLJVTKM-NNMXDRDESA-N	448.640	1.317	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cccc4c3NC(=O)C4=O)C2)C1	1778709041	WSGSANUIPVBAMA-YCRPNKLZSA-N	433.892	1.672	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C=C\C(=O)NC2CC2)C1	1779224830	CUZUABJFIZUTLU-KAOBVQAUSA-N	425.957	1.743	50	20	IDGD	
Cn1cc2cc(C(=O)N3CCO[C@@]4(CCN(C(=O)CO[Si](C)(C)C)C4)C3)ccc2n1	1779298159	AYXOZGXVUFVFCC-OAQYLSRUSA-N	430.581	1.868	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cnn3cccc(F)c13)CCO2	1779299578	XLFJJWLZGHODNQ-FQEVSTJZSA-N	434.544	1.768	50	20	IDGD	
COc1cc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)ccn1	1779555056	CGMQMPIMNZKROX-FZKQIMNGSA-N	426.311	1.565	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnn(C)c3Cl)C2)C1	1779863865	WPBFVTFMGYNSPQ-MLGOLLRUSA-N	433.734	1.691	50	20	IDGD	
Cn1ccc2c(O)ncc(C(=O)N3CC[C@@]4(C3)CN(C(=O)C(Cl)Cl)CCO4)c21	1779979856	WAYMTPOLZDFAHI-GOSISDBHSA-N	427.288	1.526	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)COc1cccnn1)C2	1780714359	BGIXLHDSBGILMR-NIKGAXFTSA-N	445.347	1.606	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1cnccn1)C2)[C@H](F)Br	1780770112	CDFSQALCPZGRPW-UKPHBRMFSA-N	429.290	1.224	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnn(C)c1Cl)C2	1781997982	POHTUHULTYYXNU-XTQGRXLLSA-N	447.761	1.984	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)Cc3noc(C(C)C)n3)CCO2)C1	1783345061	YNGAAPDRLKUWKI-FZKQIMNGSA-N	443.342	1.739	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3nc4ccc(F)cn4n3)CCO2)C1	1783535614	FVJHHNTWZBYRGO-APPDUMDISA-N	440.273	1.095	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)Cc3ccc(NC(C)=O)cc3)CCO2)C1	1783875815	UEQZFQDPNDRNSA-GHTZIAJQSA-N	437.924	1.271	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)COc3cc(Cl)ccn3)CCO2)C1	1783878423	YHNCXGXAEBZZGL-RDTXWAMCSA-N	432.304	1.198	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cnccn3)C[C@@H]21	1783964483	VQKBLNXADPZPST-SDADXPQNSA-N	425.327	1.030	50	20	IDGD	
C[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]2C1)n1cccn1	1783974438	NUZJXDFTKDBROY-QXKUPLGCSA-N	427.343	1.455	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)C(=O)c1ccc(Cl)cc1	1784059937	HPFCMQFIZJOLEW-TUUVXOQKSA-N	429.300	1.102	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3CC[C@@H](C(=O)OC)C3)[C@H]2C1	1784075235	FSOKFFSEGRXXGW-COZGXFGHSA-N	428.957	1.963	50	20	IDGD	
Cc1cc(C)cc(CCC(=O)N2CC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c1	1784221682	FBLRADSRWAUKEC-DEOSSOPVSA-N	444.576	1.439	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](NC(C)=O)C(C)(C)C)[C@H]2C1	1784313135	SANFHXPFVNVVOW-IECFSIQFSA-N	429.989	1.924	50	20	IDGD	
CCCNC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)Br)C[C@@H]21	1784376024	LCPKCEXSVREYPR-QPSCCSFWSA-N	432.359	1.056	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCOCCOCCOC)C[C@@H]21	1784622159	FLUGQOIVLKUMIP-VJANTYMQSA-N	448.988	1.443	50	20	IDGD	
O=C(c1cc(F)ccc1C(F)(F)F)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1785211666	QXXAEWZOVHAUQZ-RHSMWYFYSA-N	438.805	1.888	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)c1cc[nH]c2nccc1-2	1787326623	KUVYDTRRJRQJRX-RCBQFDQVSA-N	435.322	1.893	50	20	IDGD	
Cn1cc(F)cc1C(=O)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1	1788145546	ADKBFKQSAYTKIV-UHFFFAOYSA-N	435.264	1.906	50	20	IDGD	
O=C1COc2ccc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)C(Cl)Cl)C[C@@H]43)cc2N1	1788363390	CHHRXHYSQUVGPP-HUBLWGQQSA-N	442.299	1.415	50	20	IDGD	
C[C@@H](Nc1cccnc1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]2C1	1788764041	GJMJSANYYRYTMC-NEPXVJNWSA-N	434.613	1.713	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4nccnc4c3)C[C@@H]21	1791253541	DOAZIHWVEBSPSB-GGXPGOJBSA-N	432.908	1.477	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3occc3Br)C[C@@H]21	1791254979	YSVCMYYAMXNWBJ-VTPLQMEGSA-N	449.729	1.889	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)n3cc(C)cn3)[C@H]2C1	1791598992	GCSQYKNMTTYJBE-HMDCTGQHSA-N	441.370	1.906	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(=O)c3cccn3C)[C@H]2C1	1791690356	VFLAJHSUYRIHNY-HOSILWTGSA-N	440.338	1.219	50	20	IDGD	
Cc1nccn1[C@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21	1791701636	BHRYHSLNPYULGI-OEAJRASXSA-N	427.343	1.517	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1(c3ccc(Cl)cc3)CCC1)C2)[C@H](O)CCl	1792983189	COIUQCOGBTWFIW-LTCOOKNTSA-N	441.355	1.951	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c(Br)cnn1C)C2	1793449782	MXVURVVOJBLMFT-XCCSTKFXSA-N	447.761	1.793	50	20	IDGD	
COCCCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1793879537	CURIOUSZPFWILW-IVSAIRAKSA-N	447.960	1.135	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCc1cc(F)ccn1	1794027255	ZRWIRGQRWBEHFK-ZDFLXESQSA-N	442.329	1.916	50	20	IDGD	
C[C@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)n1cccc1C=O	1795750714	WDRQEUNOKXUFPB-AMVBZWJASA-N	430.274	1.142	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1ccc(S(C)(=O)=O)cc1	1795852711	UZQWNOITEIWGIV-DFGXFYAUSA-N	442.965	1.525	50	20	IDGD	
Cc1cc(NC(=O)CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](C)Br)C3)no1	1796870771	RIFPUGKMJOINLP-RVMXOQNASA-N	427.299	1.733	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)C(C)(C)CCl)C3)C1	1797143292	PUPILCPEFMHFEM-MUJYYYPQSA-N	443.972	1.708	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1cccn2cncc12	1797523861	QQEXZNRHRVBGTG-JLUCKKNBSA-N	425.258	1.228	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2cc[nH]c2cc1F)c1cccc(B(O)O)c1	1799272765	XTPLHFHKMGNBHW-BCDXTJNWSA-N	435.264	1.552	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cn3cc(F)ccc3n1)C2)[C@@H](F)Br	1799349857	MGURLCQCJOYYEQ-ANGCBRKESA-N	443.248	1.367	50	20	IDGD	
C[C@H](NC=O)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](Br)Cc1ccccc1)C2	1800098893	VCNXLFZWCSDDSR-JFMONLCZSA-N	436.350	1.765	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc(OCF)cn1)C2	1800639433	WCGGSYPVQKOHQP-NWJSVONSSA-N	445.289	1.159	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCn1nc(C)cc1C)C2	1800644531	ZLOLCCMBTIKFIC-DFGXFYAUSA-N	441.370	1.653	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)Br)C1	1800762854	HHDOQUULAYPDJF-SDSMMKDESA-N	445.354	1.339	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(-c3cnco3)c1)C2	1800976868	BEPBYGBSXUSOKX-ZMMAXQRCSA-N	433.892	1.799	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H]2C[C@H]2C[C@@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2	1802137397	FAJFJHNLERGVGG-OLHNTFIZSA-N	445.919	1.508	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1CCN(C(=O)CCn2ccnn2)[C@H]1c1cccnc1	1803017636	MZCRHFBFBPTDQI-HFTRVMKXSA-N	449.353	1.800	50	20	IDGD	
CC(C)[C@H](S)C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1803607378	CNSSSTBNFYXRPL-DBVUQKKJSA-N	435.594	1.415	50	20	IDGD	
Cn1ncc(C(=O)N2CCCC3(CCN(C(=O)[C@H](O)CCl)CC3)C2)c1C(F)(F)F	1807393663	ISAMBGKVWIPCQT-CYBMUJFWSA-N	436.862	1.883	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)c2cnoc2)[C@@H]1c1cccnc1	1808521667	MTCCXVLHLQULSN-YRJCQSRDSA-N	449.471	1.523	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC2(CCCN(C(=O)c3cncc(F)c3)C2)CC1	1808569133	GKTQCQNBOIHRQU-UHFFFAOYSA-N	425.269	1.059	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC2(CCCN(C(=O)[C@H](CN)c3ccccc3)C2)CC1	1809882323	SJPZOWMBJKDZQQ-HXUWFJFHSA-N	443.592	1.333	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)c3cccc(F)c3F)CC2)C1	1809978096	XONNVCJZFUARTH-UHFFFAOYSA-N	442.271	1.803	50	20	IDGD	
C[C@H](C(=O)NC[C@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1)n1ccnn1	1812397024	YDBYCEJUSRBDRQ-FRFSOERESA-N	435.326	1.725	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2cnc3[nH]ncc3c2)[C@@H]1c1cccnc1	1813031202	RAFWDSPNYQQYTC-FHLIZLRMSA-N	442.907	1.926	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2coc(Cl)n2)[C@H]1c1cccnc1	1813070336	HVQDZKZXMZKDIJ-KSSFIOAISA-N	448.911	1.416	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](O)CCl)CC2)c1ccc(-n2cnnc2)cc1	1814699765	XPYUATXEQPNPMR-SWLSCSKDSA-N	446.920	1.549	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](O)C(C)C)CC2	1817276578	VIFNDWRQZFIFJU-QGEKPWAMSA-N	446.533	1.206	50	20	IDGD	
C=C[C@@H](O)C(C)(C)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCC(=O)NN(C)C)CC2	1819720262	DVPWMAVYCHOWEP-IUODEOHRSA-N	437.566	1.001	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)CNC(=O)c3cc(C)on3)sc2C1	1819931267	RWDQFINAFSGZST-QWRGUYRKSA-N	439.925	1.799	50	20	IDGD	
C[C@H](C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](F)Br)[nH]n1)n1ccnn1	1821724455	DWKALMQVFKLCNZ-XWIASGKRSA-N	428.266	1.945	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccnc2C(N)=O)[nH]n1	1822367335	LQKIGPMBGUXIGD-JSGCOSHPSA-N	434.884	1.463	50	20	IDGD	
CN1C(=O)CC[C@H]1C(=O)N[C@@H]1CCc2nc(NC(=O)[C@](C)(Cl)CCl)sc2C1	1822870541	SYPDBTMHWLRQCN-MIHTYCSTSA-N	433.361	1.912	50	20	IDGD	
O=C1OCCN1CC(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H](F)Br)CC1	1824333229	ANWSKDHSSCARMG-HIFRSBDPSA-N	434.306	1.749	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H](C)NS(=O)(=O)CC)CC1	1824462723	APVUABBILRPXSM-XIRDDKMYSA-N	436.018	1.951	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)CN2CCCCC2)CC1	1826700764	DEPJFWRSPAEMPO-JOCHJYFZSA-N	441.381	1.086	50	20	IDGD	
C[C@H](C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](F)Br)CC2)n1cncn1	1826799828	VZWJGJRKEUGQLA-FYBVGQRMSA-N	431.291	1.598	50	20	IDGD	
O=C(C1CC(F)(F)C1)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827055966	PNGZUQRBMYVSGK-LJQANCHMSA-N	434.292	1.645	50	20	IDGD	
C=CCC(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)[C@@H](O)CCl)C2)C1	1829350038	YISXMNLAAHDPRG-PGRDOPGGSA-N	449.935	1.614	50	20	IDGD	
Cc1ncccc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2	1830537453	IQAIKUBKVCYFGM-LIRRHRJNSA-N	440.338	1.491	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3CCC(O)CC3)C2)C1	1830544039	LQNIMXJGTQNXNA-XTUQQUOLSA-N	447.370	1.025	50	20	IDGD	
O=C(Cc1cc(F)ccc1Cl)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1830726581	QXMNIAJGPRPGDL-QFBILLFUSA-N	449.306	1.078	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccccc3C(N)=O)C2)C1	1831653503	GVJRTJZZTGNGMS-UTKZUKDTSA-N	437.924	1.263	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3c(C)nn(C)c3C)C2)C1	1831659190	OEAIZTHCSKEZMX-GHTZIAJQSA-N	440.972	1.443	50	20	IDGD	
CC(C)[C@@H](S)C(=O)N1CCC([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1	1831871983	YEZCUBJDJNXWOL-YLJYHZDGSA-N	426.627	1.934	50	20	IDGD	
O=C(Cc1cc(F)ccc1Cl)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1	1832264591	IPGKJRWDBKKEQD-APWZRJJASA-N	449.306	1.078	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)C[C@@H]3CCCCO3)CC2)CC1	1833684119	PSFJPDXBGFBPHM-RBUKOAKNSA-N	429.989	1.771	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)Cn3ccnc3)CC2)CC1	1834264081	QWZAVNNRYYPOAS-OAHLLOKOSA-N	440.386	1.486	50	20	IDGD	
C=CCC(CC=C)C(=O)N1CCOC[C@@]2(CN(C(=O)CCBr)CCO2)C1	1834818731	CYSKOJQDGIGWAG-LJQANCHMSA-N	429.355	1.996	50	20	IDGD	
Cc1nc[nH]c1C(=O)NC1CCN(C2CCN(C(=O)[C@H](C)CBr)CC2)CC1	1835189830	FKZSGDZZFQOGRB-CYBMUJFWSA-N	440.386	1.934	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccccn3)CCO2)C1	1836184775	NKBDXUJCEFRECQ-DNVCBOLYSA-N	440.338	1.112	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc4nccn4c3)CCO2)C1	1836574324	QYXJTWQZXAYWJO-UWJYYQICSA-N	434.924	1.812	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC(OC2CCN(C(=O)[C@@H]3C[C@@H]3C3CC3)CC2)CC1	1836657043	KYCVXNFJFGVOKR-FGZHOGPDSA-N	440.349	1.025	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc4ncnn4c3)CCO2)C1	1837164644	LMYSNKNOXURTAE-OXQOHEQNSA-N	435.912	1.207	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)c3cscn3)CC2)CC1	1837493998	HOMOVYUQOKMTFC-UHFFFAOYSA-N	437.566	1.128	50	20	IDGD	
O=C(CCBr)N1CCC(OC2CCN(C(=O)c3ccnnc3O)CC2)CC1	1837654364	DXAKNWOCENVGND-UHFFFAOYSA-N	441.326	1.579	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cncc4cnccc34)CCO2)C1	1838460754	LYYUJHPDUWMVGJ-QFIPXVFZSA-N	446.935	1.965	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(COC)c[nH]3)CCO2)C1	1838512954	UWRIRSGZFNWRRM-JXFKEZNVSA-N	427.929	1.639	50	20	IDGD	
CC(C)c1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)on1	1838777626	QYXBSFSVJHKLBA-PBHICJAKSA-N	448.289	1.559	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3ccccc3C)CCO2)C1	1839942996	SSNUOHVXXVSVTQ-UGKGYDQZSA-N	438.952	1.638	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CC=CCC3)C2)C1	1839965844	MSRUEOPKDRAXFL-TXPKVOOTSA-N	429.355	1.973	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc4cccnc34)C2)C1	1840152733	RJPIXWGEANIDHS-AVRDEDQJSA-N	447.919	1.559	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CC[C@H](O)CC1)CCO2	1840271504	BDXBIRGPOUWOMT-YKTARERQSA-N	447.370	1.167	50	20	IDGD	
COc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)cc(OC)c1C	1840756871	SRJLYHYEOOFZBJ-YLJYHZDGSA-N	444.887	1.617	50	20	IDGD	
O=C(Cc1ccc(Cl)c(F)c1)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843010387	KYFIYGDONXKWHN-UHFFFAOYSA-N	430.672	1.219	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)c2cc3sccc3s2)C1	1844032842	VYMODBBNFNLBQX-UHFFFAOYSA-N	426.328	1.773	50	20	IDGD	
O=C([C@@H](Br)Cc1ccccc1)N1CC2(CCCN2C(=O)COCCO)C1	1845213316	ZRVRUWCAFHEFIN-INIZCTEOSA-N	425.323	1.205	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@H]2C[C@@H](O)CN2C(=O)OC(C)(C)C)C1	1846217640	YYIHTVYETRNPJU-KFWWJZLASA-N	429.945	1.578	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)Cn1c(=O)n(C)c2ccccc21	1847501317	NBQPQRPRZLCZFV-COXVUDFISA-N	449.349	1.573	50	20	IDGD	
O=C(c1cn2c(C(F)(F)F)cccc2n1)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl	1847562433	SPXLWPZUKZFHLN-RWMBFGLXSA-N	430.814	1.768	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc(O)ncn1	1847889539	JIHGEIVUGDAWIC-IHRRRGAJSA-N	439.900	1.130	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H]1C=C[C@H](NC(=O)OC(C)(C)C)C1	1848096821	CKQVWSFSLDADJJ-ALYAQQCSSA-N	441.956	1.911	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)CCNc2ccccc2[N+](=O)[O-])c2ccccc2c1=O	11659860	MQXLHLWSBYWCHX-UHFFFAOYSA-N	438.444	1.978	50	20	IDGD	
CCc1ccccc1N1C[C@H](C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)CC1=O	13082430	LLLUINHVMZWENO-MRXNPFEDSA-N	433.468	1.954	50	20	IDGD	
CC(C)c1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1	15525033	FLQRJESDKSWSHI-UHFFFAOYSA-N	431.514	1.906	50	20	IDGD	
Cc1ccn2cc(C(=O)NNC(=O)c3ccc(S(=O)(=O)N4CCCC4)cc3)nc2c1	15714386	HNUWHXWUIATXJF-UHFFFAOYSA-N	427.486	1.502	50	20	IDGD	
COc1ccc([C@@]2(C)NC(=O)N(CC(=O)NNC(=O)c3ccc4ccccc4n3)C2=O)cc1	21007871	UTRKESXXOJCHTQ-HSZRJFAPSA-N	447.451	1.472	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)CCNS(=O)(=O)c1ccc(C)c(C)c1	26736067	CVWDHNONJFJEFI-UHFFFAOYSA-N	449.529	1.597	50	20	IDGD	
O=C(Cc1ccc2ccccc2c1)NNC(=O)Cn1c(=O)ccn(Cc2ccccc2)c1=O	195679602	DWGDYQPDAOXNJL-UHFFFAOYSA-N	442.475	1.602	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1ccc(C)c(C(=O)NNC(=O)C(=O)NC(C)C)c1	726614583	YDKCFCORZRSJST-UHFFFAOYSA-N	448.501	1.090	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=S)NCC(C)(C)CN(C)C)c2ccccc2c1=O	727068117	YQTQFRMAWDYCAI-UHFFFAOYSA-N	432.594	1.893	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)[C@H]2CCCN2C(=O)c2ccc3c(c2)OCO3)c1	728208514	WLDFJKMDQCALBM-QGZVFWFLSA-N	440.456	1.288	50	20	IDGD	
CC(=O)Nc1cc(F)c(S(=O)(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1Cl	729665207	DVNCRFXAGNUOKL-UHFFFAOYSA-N	443.840	1.832	50	20	IDGD	
CCS(=O)(=O)N[C@H](CCSC)C(=O)NNC(=O)c1cc2c(s1)CCCCC2	730516947	FWFOQBLRWITVJR-CYBMUJFWSA-N	433.621	1.839	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])c(C)c1	731050135	DSJGHQMVBBQNRA-UHFFFAOYSA-N	433.852	1.854	50	20	IDGD	
CC(C)(C(=O)NNC(=O)[C@@H]1C[C@@H](O)CN1C(=O)OCc1ccccc1)c1ccccc1	731231213	JWRMNJUAIHIONP-MOPGFXCFSA-N	425.485	1.884	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)N1CCN(C(=O)c2ccc(OCc3ccccc3)cc2)CC1	732197102	CSRXBOVWZLLIKI-GOSISDBHSA-N	438.528	1.969	50	20	IDGD	
COc1ccc(CC(=O)O)cc1S(=O)(=O)NNC(=O)c1cnn(-c2ccccc2)c1	733123144	UYAOSUOZUJNUCV-UHFFFAOYSA-N	430.442	1.131	50	20	IDGD	
COc1ccccc1CN(CC(=O)NNC(=O)Cc1nc(C)cs1)C[C@H]1CCCO1	734151502	JCQHHIBVWFTCOQ-QGZVFWFLSA-N	432.546	1.831	50	20	IDGD	
CC(C)N1CC[C@@H](NC(=O)NNC(=O)[C@H](C)Oc2cccc(Br)c2)C1=O	734162567	MAASKHWWNLIMTH-SMDDNHRTSA-N	427.299	1.556	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNS(=O)(=O)c1ccc(OC)c(C(=O)N(C)C)c1	734419262	OFQBSSMOMHIFTJ-UHFFFAOYSA-N	441.893	1.682	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)N[C@H]1CCCN(c2cccc(F)c2)C1	734855668	QYZBHIZNUDJPIR-HNNXBMFYSA-N	448.524	1.732	50	20	IDGD	
Cc1cc(NNC(=O)CCCCCNS(=O)(=O)c2ccc3c(c2)OCCO3)nc(C)n1	736718641	KXZZQTFUTOVKJV-UHFFFAOYSA-N	449.533	1.847	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)c1ccc(S(=O)(=O)NC[C@H]2CCCO2)cc1	737923441	MZCWOYFRKXJVMA-GOSISDBHSA-N	447.513	1.122	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)N[C@H]1CCN(c2ccc(Cl)cc2)C1=O	740484284	RDNKPTFDHKNUCL-HNNXBMFYSA-N	440.847	1.738	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)CC[S@](=O)c1ccc2c(c1)OCCO2	740749409	XXXJRPYBBQLFJC-FZPQWHJUSA-N	436.461	1.710	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)[C@@H](NC(=O)c1ccc(OC)cc1)c1ccccc1	740850200	ZCVQJTQANMGAJE-IBGZPJMESA-N	440.500	1.619	50	20	IDGD	
C[C@H]1CN(C(=O)NNC(=O)CNC(=O)c2cccs2)CC[C@@H]1NC(=O)OC(C)(C)C	740912935	JKUGERVFBVTAGO-STQMWFEESA-N	439.538	1.454	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@H]2CCCN(C(=O)COc3ccccc3)C2)cc1OC	741172106	JTCBFHUREQTWCD-KRWDZBQOSA-N	441.484	1.782	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc1N1CCNC1=O	743292664	HVKQYFDMHJSBBF-UHFFFAOYSA-N	436.428	1.191	50	20	IDGD	
O=C1C[C@H](Cc2ccc(C(=O)NNC(=O)c3ccc(F)cc3Br)cc2)C(=O)N1	743313993	PVEQDSVPAXHXLT-LBPRGKRZSA-N	448.248	1.868	50	20	IDGD	
CC1CCN([C@H](C)CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)CC1	743340765	KDLYWDSYGDZGLE-OAHLLOKOSA-N	425.555	1.001	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)C2CCN(c3nc4ccccc4o3)CC2)c1	744531738	LVEAPMKJLADXRL-UHFFFAOYSA-N	447.451	1.920	50	20	IDGD	
CC(=NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1nc2ccccc2n1C	744555507	NSKAYLPBGIFVPA-UHFFFAOYSA-N	441.513	1.748	50	20	IDGD	
CC(=O)Nc1cc(NC(C)=O)cc(C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)c1	744613187	CXDXYJCTBSOJMA-UHFFFAOYSA-N	437.412	1.093	50	20	IDGD	
COc1ccc(/C=C\C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)cc1OC	744620973	JUKUUVMDTREDMK-NTMALXAHSA-N	447.513	1.881	50	20	IDGD	
Cc1cc(=O)c(C(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)c[nH]1	746093564	SFLDZFUUTWAWIN-UHFFFAOYSA-N	440.481	1.237	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)c2cnn(CC(=O)NC3CCCCC3)c2)cc1C	746580295	UXPWXSCLBSBLMJ-UHFFFAOYSA-N	427.505	1.789	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCCC(=O)NNC(=O)Cc2cn3ccccc3n2)cc1C	746637588	RHRYDWVJQNEGIG-UHFFFAOYSA-N	429.502	1.010	50	20	IDGD	
O=C(COc1ccccc1O)NNS(=O)(=O)c1ccc([N+](=O)[O-])cc1Br	746665552	RLHKKSAUOVWGAO-UHFFFAOYSA-N	446.235	1.451	50	20	IDGD	
O=C(Cn1c(S)nc2ccccc2c1=O)NNc1ccc(S(=O)(=O)C(F)F)cc1	746689157	SPVHUTQSYYVDQM-UHFFFAOYSA-N	440.453	1.825	50	20	IDGD	
COc1cc(C)nc(NNC(=O)CN2C(=O)N[C@@](C)(c3ccc4ccccc4c3)C2=O)n1	746694195	QDXMIHMEUUQJIO-QFIPXVFZSA-N	434.456	1.857	50	20	IDGD	
COc1cc(I)c(Cl)cc1C(=O)NNc1nccn(C)c1=O	747945234	FBDIPZQYHWPZSS-UHFFFAOYSA-N	434.621	1.804	50	20	IDGD	
NS(=O)(=O)c1cccc(N2C[C@H](C(=O)NNc3ccc(F)c(F)c3F)CC2=O)c1	748220369	NVNRARZMOIXVIA-SECBINFHSA-N	428.392	1.248	50	20	IDGD	
CSCC[C@@H](NC(=O)c1ccc([N+](=O)[O-])o1)C(=O)NNC(=O)[C@H]1Cc2ccccc2O1	748273310	DVPZJJRNROWNKW-IUODEOHRSA-N	448.457	1.190	50	20	IDGD	
O=C(NCCC(=O)N1CCN(c2ccccc2)CC1)NNc1ccc(-n2cccn2)nn1	748466461	YQVZOSVPTWLPSR-UHFFFAOYSA-N	435.492	1.027	50	20	IDGD	
Cc1c(NNC(=O)[C@@H]2CCCC[C@@H]2C(=O)N[C@@H]2CCS(=O)(=O)C2)cccc1[N+](=O)[O-]	748687220	XCWOQGUKJNMCEM-QLFBSQMISA-N	438.506	1.456	50	20	IDGD	
CON(C)S(=O)(=O)c1cc(C(=O)NNC(=O)CCc2ccccc2)ccc1Cl	749802664	NRFHSVIHZXEZPE-UHFFFAOYSA-N	425.894	1.916	50	20	IDGD	
O=C(NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)c1ccc(-n2cnnc2)cc1	750665288	VXFKQECQFCLBPZ-UHFFFAOYSA-N	440.485	1.127	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(=O)n(-c3cccc(F)c3)c2)c1	751234063	WSUNOBQVBAZDQT-UHFFFAOYSA-N	429.429	1.455	50	20	IDGD	
N#Cc1ccc(CN2CC[C@@H](NC(=O)NNC(=O)c3cc(Br)c[nH]3)C2=O)cc1	753034899	XBSZSKGWCFWHIC-CQSZACIVSA-N	445.277	1.394	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)c1ncoc1-c1cccc(C(F)(F)F)c1	753428392	FVCNPGRBKCHFEC-UHFFFAOYSA-N	433.346	1.946	50	20	IDGD	
COC(=O)c1coc(S(=O)(=O)NNC(=O)c2ccc(OC)c(Br)c2)c1	753955241	SFAXHBJXLMUCSW-UHFFFAOYSA-N	433.236	1.461	50	20	IDGD	
COc1cccc(-c2nc(C)c(C(=O)NNC(=O)c3csc(N4CCOCC4)n3)[nH]2)c1	755409318	FYMHTCQJQKMNSM-UHFFFAOYSA-N	442.501	1.762	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)Nc2ccc(S(=O)(=O)N3CCC(C)CC3)cc2)n1	755425120	YZMKSSCCNQDNHL-UHFFFAOYSA-N	448.549	1.773	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1ncc(Cc2ccc(F)c(F)c2)s1	755479913	RQORRJPOTXKWOE-MRVPVSSYSA-N	433.462	1.103	50	20	IDGD	
CC(=O)NCc1ccc(NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1	756553175	JXYZUKQJDMXTQI-UHFFFAOYSA-N	438.532	1.688	50	20	IDGD	
COC(=O)CCCc1nnc(NC(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)s1	756684036	JQPQCXKOWWQNEG-SNVBAGLBSA-N	425.442	1.793	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)NCCCN(C1CC1)S(=O)(=O)c1cccc(F)c1	757023011	IIQUESMQXYWPFR-UHFFFAOYSA-N	449.508	1.337	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)C(=O)c1ccc(Cl)s1	757768540	WZRPOCQUQZRPHL-UHFFFAOYSA-N	441.918	1.830	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)c1cccc(OCc2ccc(Cl)cc2)c1	758041373	YNXXLIGVWIKIJM-GFCCVEGCSA-N	425.894	1.618	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](CCC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)C1	758404025	XMHIICAAMBMQID-AWEZNQCLSA-N	439.534	1.888	50	20	IDGD	
CCc1nc(CN2CCC(CNC(=O)NNC(=O)C(=O)Nc3ccccn3)CC2)cs1	758763298	HRACJEWSUMYBEA-UHFFFAOYSA-N	445.549	1.282	50	20	IDGD	
Cc1ccc(CNC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c(O[C@H]2CCOC2)c1	758901192	OUWCTYJSMGRVIA-JXFKEZNVSA-N	427.457	1.833	50	20	IDGD	
NC(=O)[C@@H]1CC[C@@H](CNC(=O)NNC(=O)c2cc(-c3ccccc3)nc3ccccc23)O1	760204305	QGKFQZRXJCGQLY-YWZLYKJASA-N	433.468	1.879	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	760799538	OKBILPWSVVAPJL-HNNXBMFYSA-N	449.464	1.262	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)c1cccc([C@@]2(C)NC(=O)NC2=O)c1	762374280	UUQZMMBAIYHSMJ-HXUWFJFHSA-N	428.470	1.303	50	20	IDGD	
O=C(NCCc1ccncc1)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	762666943	ZFBVVYVKIZGZAD-UHFFFAOYSA-N	442.483	1.970	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)c1ccc(OC)c(I)c1	763402018	FERSPGCRGCQGOZ-UHFFFAOYSA-N	433.246	1.366	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3oc(N(C)C)nc3c2)cc1OC	763542019	CZFKFHWRNODXPE-UHFFFAOYSA-N	427.417	1.311	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(CN3CCOC3=O)cc2)cc1OC	763550715	KGLICASMFNESAW-UHFFFAOYSA-N	442.428	1.056	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2ccc(NC(=O)C3CC3)nc2)c1	763668792	PMUXRYZWVXRQQF-UHFFFAOYSA-N	425.445	1.212	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccccc1C[S@](C)=O	763684286	IXRSYMBOODBIPT-PMERELPUSA-N	433.486	1.129	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)cc1C(=O)N(C)C	763839367	GAHNABXAMVCCPW-INIZCTEOSA-N	440.500	1.867	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)C(=O)Nc1cccc2c1oc(=O)n2C	763850867	BIFOJBXWUWZIIW-ZDUSSCGKSA-N	448.435	1.838	50	20	IDGD	
CNC(=O)c1cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)ccc1Cl	763852652	XEKCMRAIXPYCQF-CYBMUJFWSA-N	446.891	1.870	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cnn(CC(F)(F)F)c2)cc1	763861214	MTINUOWRPREUFB-NSHDSACASA-N	443.382	1.398	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cccc(C(=O)OC)c2)cc1	763861836	QYUXFIAAHQROGT-CYBMUJFWSA-N	429.429	1.425	50	20	IDGD	
C#CCOc1cccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(OCC)cc2)c1	763862496	XVGZKBXGFDXKRM-HNNXBMFYSA-N	425.441	1.651	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccc(Oc3ccc(Cl)nn3)cc2)n1	763893218	PVEMJXLYQWIBTC-UHFFFAOYSA-N	443.851	1.522	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)C(=O)Nc2ccc(NC(=O)C3CC3)nc2)cc1	763895823	HLWIWYKLPIPVGX-UHFFFAOYSA-N	427.486	1.617	50	20	IDGD	
Cn1c(=O)n(C)c2cc(NC(=O)C(=O)NNC(=O)CCSc3ccc(F)cc3)ccc21	763895920	SZWVXQZEVKGSLY-UHFFFAOYSA-N	445.476	1.284	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)C(=O)Nc1ccc(Oc2ccccn2)cc1	763916746	KKOWBAMYDWLNEC-UHFFFAOYSA-N	444.411	1.249	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc1F	763945030	RYJUXURSGUTKOT-UHFFFAOYSA-N	427.392	1.515	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)C(=O)Nc1cccc(CN(C)C(=O)C(F)(F)F)c1	763957872	LLWZNISUPOBLEM-UHFFFAOYSA-N	436.390	1.915	50	20	IDGD	
Cc1ccc(Cn2nccc2NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)s1	764164409	PCBXQCKAMGPBPV-MRXNPFEDSA-N	425.470	1.391	50	20	IDGD	
CN(c1ccccc1NC(=O)C(=O)NNC(=O)CCCc1ccccc1)S(C)(=O)=O	764224464	QGIDCUWGSQEVPJ-UHFFFAOYSA-N	432.502	1.191	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2scnc2C)c(OC(F)F)c1	764247207	OTAUGDBJIWMKCL-UHFFFAOYSA-N	428.373	1.239	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1cccc(N2CCCCC2=O)c1	764278400	YBRMIFOWNOKYSQ-UHFFFAOYSA-N	426.429	1.074	50	20	IDGD	
Cc1ccc(C(=O)N2C[C@@H](C)C[C@H](C)C2)cc1NC(=O)C(=O)NNC(=O)c1cnn(C)c1	764360454	YGALHEWGVLDSEL-KBPBESRZSA-N	440.504	1.246	50	20	IDGD	
Cc1ccc(C(=O)N2C[C@H](C)C[C@@H](C)C2)cc1NC(=O)C(=O)NNC(=O)c1cnn(C)c1	764360457	YGALHEWGVLDSEL-ZIAGYGMSSA-N	440.504	1.246	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(Oc2ccc(Cl)cc2)nc1	764401756	XDWZIIBQEKGAGP-LBPRGKRZSA-N	436.852	1.665	50	20	IDGD	
Cc1cc(C(=O)NN=C2C(=O)N(Cc3ncon3)c3ccc(Br)cc32)n[nH]1	764795527	TVTQSKUTVNSCKZ-UHFFFAOYSA-N	430.222	1.545	50	20	IDGD	
COC(=O)c1ccc(C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)nc1	765758342	JMKGLHQBICPUPF-UHFFFAOYSA-N	445.907	1.100	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)cc1S(C)(=O)=O	765887711	XVWOQPITUMIHQT-UHFFFAOYSA-N	427.523	1.718	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)Cn3c(C)nc4ccccc43)CC2)cc1	766639881	AXXMPVZWGQGBRK-UHFFFAOYSA-N	434.544	1.618	50	20	IDGD	
CCc1c(C(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)[nH]c(C)c1C(C)=O	766648009	HXQPDWJMRPDTCG-UHFFFAOYSA-N	439.560	1.975	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1ccco1	767298874	RGFHBPXCASCGLU-QGZVFWFLSA-N	427.457	1.516	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)c1cc(Br)cnc1N(C)C	767349108	ZFXRPSGVSBCIQR-UHFFFAOYSA-N	449.305	1.765	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2ncc3ccccc32)cc1Cl)N[C@H]1CCS(=O)(=O)C1	767682948	HETQKTNFUYUFBY-ZDUSSCGKSA-N	447.904	1.810	50	20	IDGD	
COc1c(C)cc(S(=O)(=O)N2CCN(S(=O)(=O)CBr)CC2)cc1C	767848538	AZBCHSJUIUDKBT-UHFFFAOYSA-N	441.369	1.301	50	20	IDGD	
CCn1c(NNC(=O)CN2C(=O)N[C@@]3(CCCC(C)(C)C3)C2=O)nc2ccccc2c1=O	768929247	XPBJCEIYTJPTDF-JOCHJYFZSA-N	440.504	1.750	50	20	IDGD	
O=C(NNc1ccc(Br)c(F)c1)N[C@@H]1CCO[C@@]2(CCS(=O)(=O)C2)C1	771342535	PSQKTEGSWBVNFU-ABAIWWIYSA-N	436.303	1.951	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)CCc1nc(O)c2c3c(sc2n1)CCC3	771914666	PGGUYGXVGYKPNV-NSHDSACASA-N	434.518	1.943	50	20	IDGD	
COC(=O)c1c(F)cccc1NNC(=O)Cn1c(=O)ccn(Cc2ccccc2)c1=O	773625708	KFUVBMUMXBJUQI-UHFFFAOYSA-N	426.404	1.127	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNc2cccc(Cl)c2C)cc(S(C)(=O)=O)c1	773766433	LMVWNVYECOCOEN-UHFFFAOYSA-N	439.877	1.920	50	20	IDGD	
CCCNC(=O)[C@@H]1CN(C(=O)C(=O)NNC(=O)c2ccc(C)c(F)c2)c2ccccc2O1	773888127	AJUXOHKWVCSNNL-SFHVURJKSA-N	442.447	1.216	50	20	IDGD	
COCCOc1cccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)c1	774002134	MURQFASNMKGVLW-CYBMUJFWSA-N	435.864	1.919	50	20	IDGD	
COc1ccccc1[C@@](N)(C(=O)NNC(=O)c1cc(Br)c[nH]1)C(F)(F)F	776101074	URUAVJMPAUTZSE-CQSZACIVSA-N	435.200	1.963	50	20	IDGD	
CCc1ccccc1S(=O)(=O)NNC(=O)c1cccc(S(=O)(=O)N(CC)CC)c1	777593677	KQWFIMWMTQMHMP-UHFFFAOYSA-N	439.559	1.903	50	20	IDGD	
COc1ccc(C(=O)CCCC(=O)N2CCN(S(=O)(=O)CBr)CC2)cc1	777831742	JBYHJPWKHPZHTA-UHFFFAOYSA-N	447.351	1.875	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)N[C@@H]1CCCC[C@@H]1CNC(=O)OC(C)(C)C	778679569	BDRGHWIKYTXEDG-ZIAGYGMSSA-N	443.545	1.925	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@@H](C(=O)NNc2ccccc2Br)[C@@H](C)O)cc1	779537047	OBUKMINNCHAGPF-MLGOLLRUSA-N	442.335	1.929	50	20	IDGD	
O=C(COc1ccccc1-c1ccccc1)NNC(=O)[C@@H](O)[C@@H](O)c1nc2ccccc2[nH]1	779580430	ZQPMWLUXENFVNV-YADHBBJMSA-N	446.463	1.851	50	20	IDGD	
C=CCn1c(=O)c2ccccc2n2c(SCC(=O)NNc3ncncc3Cl)nnc12	781829827	GYWWTFBPQAFQRT-UHFFFAOYSA-N	442.892	1.909	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)COC2(C)CN(C(=O)OC(C)(C)C)C2)cc1C	782659197	CUBORISHIOXCIU-UHFFFAOYSA-N	434.493	1.415	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C(=O)Nc2ccc(F)cc2OCC2CC2)nc2ccccc21	782892408	CJVCRTXVKDKSSK-UHFFFAOYSA-N	439.447	1.830	50	20	IDGD	
CN(c1ccccc1)S(=O)(=O)c1cccc(NC(=O)C(=O)NN=c2cc[nH]cc2)c1	783369779	CYQAHOPHEKVAFK-UHFFFAOYSA-N	425.470	1.410	50	20	IDGD	
COC(=O)CN1CCN(c2ccc(NC(=O)C(=O)NN(C)c3ccccc3)cc2)CC1	783431092	AZELMIWGBGJHKP-UHFFFAOYSA-N	425.489	1.088	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)NC[C@H]2CCCCS2(=O)=O)cc1Cl	784436414	LHVSUJNKELYZLG-SNVBAGLBSA-N	434.902	1.660	50	20	IDGD	
COc1ccc(S(=O)(=O)NC2CC2)cc1NC(=O)C(=O)NNc1ccccc1Cl	784778912	MLZKCRSBBJGUQQ-UHFFFAOYSA-N	438.893	1.871	50	20	IDGD	
CNC(=O)c1ccc(NC(=O)C(=O)NNc2ccc(Br)nc2)cc1Cl	784809997	WQIFQBOSTYQJJA-UHFFFAOYSA-N	426.658	1.939	50	20	IDGD	
O=C(NNc1cccnc1Cl)C(=O)Nc1cc(N2CCCS2(=O)=O)ccc1F	784839517	ZFOFVYRKTHEAFG-UHFFFAOYSA-N	427.845	1.496	50	20	IDGD	
Cc1ccc(F)c(NNC(=O)C(=O)Nc2ccc(NC(=O)CN3CCOCC3)cc2)c1	784883866	ILIQRIYRUDFWKH-UHFFFAOYSA-N	429.452	1.487	50	20	IDGD	
CCN1CCN(c2ccc(Cl)cc2NC(=O)C(=O)NNc2ccnc(N(C)C)n2)CC1	784970459	VUIQSXJXNIDRJG-UHFFFAOYSA-N	446.943	1.420	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)C(=O)Nc1cc(F)ccc1Br	785060736	KQAZHJRVNLKQEP-UHFFFAOYSA-N	434.225	1.565	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1ccc2c(c1)CCCC(=O)N2	785330470	IHDAUOOFTLCMDD-UHFFFAOYSA-N	446.485	1.455	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc(F)c(F)c1)NNc1nnc(-c2ccccn2)s1	788558241	KJVQFLLKZUGKKZ-UHFFFAOYSA-N	440.457	1.690	50	20	IDGD	
COC(=O)c1cccc(Cl)c1S(=O)(=O)NNC(=O)c1cc([N+](=O)[O-])ccc1O	790069000	RKRBVWDSKUSQBG-UHFFFAOYSA-N	429.794	1.364	50	20	IDGD	
O=C(NNc1nc2ccccn2n1)C(=O)Nc1cc(-c2nnc3n2CCCCC3)ccc1F	792393883	HJMAFESTSCXYEL-UHFFFAOYSA-N	449.450	1.935	50	20	IDGD	
COC(=O)C1(CS(=O)(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)CCCCC1	793414331	DPMITNCJUXIELL-UHFFFAOYSA-N	445.925	1.030	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)[C@@H](O)Cc1ccccc1	793683793	VANULDVSNMSUAM-FQEVSTJZSA-N	430.936	1.209	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)CN1C(=O)C(F)(F)Oc2ccccc21	795152811	WBEHNYGNQDICHQ-UHFFFAOYSA-N	440.428	1.398	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2ccc(F)c(N3CCOC3=O)c2)c1	796989947	NCZYZANFMRRNFY-UHFFFAOYSA-N	446.391	1.199	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)c1cn2c(n1)CCCC2	799696256	QVODRKXXSGAIJO-UHFFFAOYSA-N	430.940	1.452	50	20	IDGD	
CC(=NNC(=O)N[C@@H]1CCS(=O)(=O)C1)c1c[nH]c2ccc(Br)cc2c1=O	799877128	NVQLHSOCCJZHFE-LLVKDONJSA-N	441.307	1.501	50	20	IDGD	
CC[C@@](O)(C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1)c1cccc(Cl)c1	800320190	SZKMKZFSOSFMLL-UTKZUKDTSA-N	448.859	1.468	50	20	IDGD	
Cc1c(I)cc([N+](=O)[O-])cc1C(=O)NNC(=O)N1CCOCC1	801143989	XNPHVWHHHBAEGI-UHFFFAOYSA-N	434.190	1.194	50	20	IDGD	
Cc1nc(C(=O)NNC(=O)Nc2ccc(Cl)cc2)nn1-c1n[nH]c(C(F)(F)F)n1	802018516	KDNVZCKBIJQDSQ-UHFFFAOYSA-N	429.750	1.833	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)c2ccc(CS(C)(=O)=O)o2)c(OC)cc1Cl	802080857	RMJRJAMGSHTSMD-UHFFFAOYSA-N	431.854	1.961	50	20	IDGD	
C[C@@H](CCNS(=O)(=O)c1ccccc1)NC(=O)NNc1ccc(-n2cccn2)nn1	802527031	RFJHUEVCQDVGEC-AWEZNQCLSA-N	430.494	1.046	50	20	IDGD	
CN(C(=O)OC(C)(C)C)[C@@H](C(=O)NNC(=O)CNC(=O)OC(C)(C)C)c1cnn(C)c1	803054455	OWFMWUIAFLDFRV-CQSZACIVSA-N	440.501	1.000	50	20	IDGD	
COc1ccc(CS(C)(=O)=O)cc1NC(=O)NNC(=O)CSc1ccccc1O	806638077	CNWKWVSOJUVLHO-UHFFFAOYSA-N	439.515	1.890	50	20	IDGD	
COc1ccc(CS(C)(=O)=O)cc1NC(=O)NNC(=O)COc1ccc(C#N)cc1	806639538	STCOMOOTNPCYCM-UHFFFAOYSA-N	432.458	1.343	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)NNC(=O)[C@@H]3COc4ccccc4O3)cc2C1	807026175	KSMFTXHABYONPS-ABAIWWIYSA-N	430.486	1.688	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cnc(C(F)(F)F)cc1C	810384352	DAGILLAPWVFTMY-UHFFFAOYSA-N	426.351	1.582	50	20	IDGD	
Cc1nc(Cl)cc(NNC(=O)CNS(=O)(=O)c2ccc(OC(F)(F)F)cc2)n1	810438232	PSDURSZCZHAQIK-UHFFFAOYSA-N	439.803	1.759	50	20	IDGD	
O=C(CNS(=O)(=O)c1cccc(F)c1)NNC(=O)c1cccc(Br)c1	810447644	BBLYSNIFLPDWJQ-UHFFFAOYSA-N	430.255	1.328	50	20	IDGD	
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	812728817	ATQNTIVFNJROKP-FQEVSTJZSA-N	443.529	1.609	50	20	IDGD	
Cc1cnc(Br)c(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)c1	812978989	HXPWWNVMLYWFNM-SNVBAGLBSA-N	439.241	1.845	50	20	IDGD	
CCCN1C(=O)c2ccccc2N2C(=O)CC[C@@]12C(=O)NNC(=O)Cc1ccccc1F	815539659	UGSADLSWYXZGEK-HSZRJFAPSA-N	438.459	1.905	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCc2nncn2C1)C(=O)Nc1ccc2nc(C3CC3)sc2c1	815693348	UNWNHRAWLYRWMA-LLVKDONJSA-N	425.474	1.114	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)c2ccc(=O)n(-c3cnn(C)c3)c2)c1	816717355	YMSADEPMTJANIS-UHFFFAOYSA-N	446.261	1.877	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)O[C@@H](C)C(=O)N2CCN(C(C)=O)CC2)c1C	853510749	RTABYUFBFPSVPS-IZQLPPHKSA-N	430.505	1.281	50	20	IDGD	
Nc1ccc(C(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)cc1OC(F)(F)F	857480117	ZUYRFGGNXBBHBJ-UHFFFAOYSA-N	430.770	1.898	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc2nc(O)cc(C(=O)NNC(=O)c3ccncc3)c2c1	865930529	VQTAOAUBOMPBBL-UHFFFAOYSA-N	443.485	1.441	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)O[C@H](C)C(=O)N2CCC[C@@H](C(N)=O)C2)c1C	913027173	JVAYMONHKFTAOU-JURCDDRXSA-N	430.505	1.314	50	20	IDGD	
Cc1nc(C#N)c(N2CCN(C(=O)COC(=O)/C(C#N)=C/c3cc(C#N)n(C)c3C)CC2)o1	915384631	DPHLDFLIPBLMGP-CAOOACKPSA-N	447.455	1.172	50	20	IDGD	
CCC[C@H](C)NC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	915886725	BLXYIMLYCJVQDG-HNNXBMFYSA-N	426.539	1.159	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCCc2ccc3c(c2)OCO3)nc1	915932754	ZNRVUUXOWYGSAK-UHFFFAOYSA-N	435.506	1.710	50	20	IDGD	
CN1CCN(C(C)(C)CNC(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)CC1	916258766	HINDYWIAAUFRMG-UHFFFAOYSA-N	437.488	1.632	50	20	IDGD	
CC(=NNC(=O)C1=S=C2CCCC2=C1)c1ccc(S(=O)(=O)NCCC(=O)O)cc1	916315685	ZZNWVSHNIDCEQR-UHFFFAOYSA-N	435.527	1.482	50	20	IDGD	
Cc1nn([C@@H]2CCS(=O)(=O)C2)c(Cl)c1C=NNC(=O)COc1ccc(F)cc1	916331231	JKLVKSZDRGBWIM-CYBMUJFWSA-N	428.873	1.873	50	20	IDGD	
Cc1ccccc1C(=O)NNS(=O)(=O)c1c(C)cc(C)c(NS(C)(=O)=O)c1C	917726451	IZNNZRCDGDJNDP-UHFFFAOYSA-N	425.532	1.915	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)NCCC(=O)N[C@@H]2CCS(=O)(=O)C2)c(C)n1CCC(C)C	918570817	XYLJYKRQMWYMKR-NURJGKTBSA-N	448.589	1.868	50	20	IDGD	
Cc1nn2cccnc2c1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	918689103	PACDHZLVOMQEKP-UHFFFAOYSA-N	442.501	1.287	50	20	IDGD	
Cn1c(=NNC(=O)CCNS(=O)(=O)c2cccc([N+](=O)[O-])c2)sc2ccccc21	920338007	DYMXPSITQYQERK-UHFFFAOYSA-N	435.487	1.449	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)c1cccc(N2CCOC2=O)c1	920967087	CNZYGCYRZFOFGQ-CYBMUJFWSA-N	446.485	1.752	50	20	IDGD	
Cc1nn(-c2ccccc2)c2sc(C(=O)NNC(=O)NCC(=O)N3CCCC3)cc12	1116109832	RIHVNRJKYCUDNE-UHFFFAOYSA-N	426.502	1.962	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2n[nH]c3c2CCCC3)nnn1CCOc1ccc(F)cc1	1116918492	BMKIIWOWIIUJMD-UHFFFAOYSA-N	427.440	1.481	50	20	IDGD	
CC(C)(C)c1ccc(NNC(=O)[C@H]2CN(Cc3nc(O)c4ccccc4n3)CCO2)nn1	1319184004	JARGWWHRGSPHST-MRXNPFEDSA-N	437.504	1.767	50	20	IDGD	
CC1CCN(CCC(=O)NN=Cc2c(N3CCOCC3)nc3ccccn3c2=O)CC1	1337205587	VTHOLUJEHZUDEY-UHFFFAOYSA-N	426.521	1.103	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnn4ccncc34)C2)C1	1777988351	LBKSGXBQNROZDJ-ZWKOTPCHSA-N	426.304	1.409	50	20	IDGD	
C[C@H](Cn1cncn1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Br)C2	1779500507	OWICPJFKTYGXNW-VWPFQQQWSA-N	446.321	1.119	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(CN(C(=O)CC3CC3)CCO2)C1	1780096711	FVXZDVSNJCJGBS-OAQYLSRUSA-N	431.445	1.764	50	20	IDGD	
CCC(=O)N[C@@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@](C)(Cl)CCl)C1	1780706701	NYWHSUXOCDVFRB-WTVLQJKYSA-N	436.380	1.651	50	20	IDGD	
Cn1cccc1C(=O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@](C)(Cl)CCl)C1	1780715676	ULPBMWBLFFSBEP-UIAACRFSSA-N	444.359	1.958	50	20	IDGD	
CCc1ccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)cc1	1780789664	VDBQPJNOVQTDMB-HSZRJFAPSA-N	437.500	1.005	50	20	IDGD	
C[C@H](Nc1cnccn1)C(=O)N1CCO[C@]2(CCN(C(=O)[C@](C)(Cl)CCl)C2)C1	1781229711	IKNSFGNVRAUHHY-MORSLUCNSA-N	430.336	1.343	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)Cn2ccnc2C)C1	1781558889	LPQLAFACZKJZGU-FRQCXROJSA-N	441.370	1.879	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1cnc[nH]1)C2	1781899860	AUWKXHQWWSMCIF-IIDMSEBBSA-N	427.343	1.640	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc[n+]([O-])c1)C2	1781901559	QKFSVFCQSHQKIG-GPMSIDNRSA-N	440.338	1.621	50	20	IDGD	
Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1781983873	RUAIHEHIVAHTKK-KDOFPFPSSA-N	429.832	1.086	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@H](C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](O)CCl)C3)C1	1782161085	BMPJVGFZCBYUEZ-IXBXCVQTSA-N	444.956	1.079	50	20	IDGD	
O=C([C@@H](O)Cc1ccccc1)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1783339781	NCLHJVVPARZIQN-RLFYNMQTSA-N	429.286	1.110	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(OC)nc3)CCO2)C1	1783344478	TVHWMEVJIAZGKX-RDTXWAMCSA-N	426.311	1.707	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)Cc3ccccc3O)CCO2)C1	1783354833	GFBSQCPFTKCJPP-HNAYVOBHSA-N	425.323	1.938	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(C(F)(F)F)nn3C)CCO2)C1	1783877031	DMDDLTPHRVVQRI-BZNIZROVSA-N	438.834	1.136	50	20	IDGD	
COc1cccc(Cl)c1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]2C1	1784095411	GCMCHYGLSASBJB-GMZLATJGSA-N	431.316	1.542	50	20	IDGD	
COc1ccc(CC(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)cc1F	1784706132	PWBNVNFGWSZJMY-SJLPKXTDSA-N	447.276	1.897	50	20	IDGD	
O=C(Cc1c(F)ccc(F)c1F)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21	1784832713	RCDBZODSSNQPOQ-SPGJAERMSA-N	434.842	1.226	50	20	IDGD	
C[C@@H](Cn1cccn1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)CBr)C[C@@H]21	1785435865	CJLZKNYBYFUFFN-XAJHFOFHSA-N	441.370	1.530	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4cncn4c3)C[C@@H]21	1786406977	LDPWRRGYQOVHCL-XIRDDKMYSA-N	435.322	1.713	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)c1cnn2ccccc12	1787854255	ZNVXKWFRFJGILC-MZGVZZPPSA-N	439.285	1.618	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN(C)C(=O)OC(C)(C)C)C[C@@H]21	1789860882	FHSRUZPRJJTEPC-VGWMRTNUSA-N	431.961	1.850	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](O)C(=O)Nc1ccc(C2(NC(=O)[C@@H](O)CCl)CCC2)cc1	1790729017	CPOZOJCSHOGFLI-WMLDXEAASA-N	441.912	1.563	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCCn3ccnc3)C[C@@H]21	1791065391	WZTNYCIEUPHHJR-VGWMRTNUSA-N	427.343	1.426	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CC[C@H]3CCOC3)[C@H]2C1	1791812591	ZVKJEKBWHRDKGI-XAJHFOFHSA-N	431.371	1.814	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1C[C@@H]1c1ccc(F)cc1	1792907880	ABWNMPZFEPKYIG-IVDHNXQLSA-N	430.524	1.940	50	20	IDGD	
O=C(Cc1cc(F)cc(F)c1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2	1795842626	SAQMEHHDAKEMMR-OXUXUCFPSA-N	435.240	1.787	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1csc2c1CCCO2	1796096980	GGEZOZSKAFXTJQ-NOXHYTERSA-N	428.938	1.530	50	20	IDGD	
C[C@H]1Oc2ccc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@@H](F)Cl)cc2NC1=O	1796366128	NMEDJUKOXMYWHS-LFIDFRPQSA-N	425.844	1.144	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2c(c1)OCO2	1796786905	MPVVXQFDNDBLGV-UESRRSCYSA-N	429.300	1.855	50	20	IDGD	
CC(=O)O[C@@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C(C)C	1796891984	TVFBDFMJSHKQGF-LGZBGAKXSA-N	445.520	1.346	50	20	IDGD	
Cc1nc2cccc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)c3ccc(B(O)O)cc3)C4)c2s1	1797383088	AHMQFKVBWWAYSA-BCDXTJNWSA-N	449.341	1.850	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C=C/C(=O)NCc1ccco1	1797890085	QWCOESMAGKDAMR-WEPLXLJNSA-N	437.924	1.449	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)COC(=O)C(F)(F)F	1798345029	JPNGLBHDADBPLY-LMLFDSFASA-N	429.233	1.904	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc3cc[nH]c3c1)C2	1798440447	RFCRLNLIZBLGAN-BJWYYQGGSA-N	432.484	1.732	50	20	IDGD	
COC[C@@H](C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O	1798522585	AWANNEVKOJFYOP-NFWAQSGPSA-N	449.460	1.006	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(-c2ccccc2)no1)c1cccc(B(O)O)c1	1798815594	UIZZWRJYZPUYJF-ACDBMABISA-N	445.284	1.587	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](N)c1cccc(Cl)c1)C2	1800757079	UETQQYFAZIIMJH-MIGXYKPQSA-N	444.757	1.713	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)c1ccc(O)cc1)C2	1800759947	SSDUAKFAJABAHQ-RPVAFNKOSA-N	425.323	1.869	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccc(SC)cc1	1801180406	MYOAGSKYPXYNLW-LORHWOILSA-N	426.966	1.794	50	20	IDGD	
CCc1nn(C)c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CCC(=O)NN(C)C)c1Cl	1802333198	MPCFGTCYAQDLMS-BTTYYORXSA-N	438.960	1.261	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2c[nH]c3ncccc23)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803139654	SIJAYZSFTMIPGB-JCGIZDLHSA-N	427.892	1.877	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CCc2cc(F)ccn2)[C@H]1c1cccnc1)[C@H](O)CCl	1803140268	CAJFAPGDGQAXRC-CVAIRZPRSA-N	434.899	1.854	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H](CNC(=O)c2cc(O)ncn2)[C@@H]1c1cccnc1	1803736760	JZFTVPBTKWGRBT-MRRJBJDNSA-N	448.321	1.928	50	20	IDGD	
C[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCC2(CCCN(C(=O)[C@@H](O)CCl)C2)CC1	1805528341	ROGFKQRVJNWDJR-CABCVRRESA-N	431.961	1.731	50	20	IDGD	
CC(C)CNC(=O)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)Br)[C@H]1c1cccnc1	1808453375	UYQWDOOUCAUZEE-KBMXLJTQSA-N	439.354	1.643	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](F)Cl)[C@@H]1c1cccnc1)c1cc2n(n1)CCCNC2=O	1809678905	KMXHKTFKWMBJIN-XKQJLSEDSA-N	448.886	1.266	50	20	IDGD	
Cc1occc1C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1	1810299512	RDTQOBWLBCFTLK-UZLBHIALSA-N	448.483	1.615	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2cccc(F)n2)[C@H]1c1cccnc1	1810769951	XUQRUZAGRCTMRN-HRAATJIYSA-N	442.495	1.308	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)c2ncn(C)n2)[C@H]1c1cccnc1	1812774824	IGNXOUZNIXILTK-ILXRZTDVSA-N	435.326	1.703	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)Cn2cncn2)[C@H]1c1cccnc1	1812776851	OAAHKVXKBCSQTK-VYDXJSESSA-N	435.326	1.553	50	20	IDGD	
CC(=O)NCCC(=O)N1CC[C@H](CNC(=O)[C@H](C)Br)[C@@H]1c1cccnc1	1812868173	TVWPYWYWSMNYJQ-MJEQTWJJSA-N	425.327	1.397	50	20	IDGD	
Cc1nscc1C(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1	1815337485	SSBDWIHAHOVEMU-ZDUSSCGKSA-N	442.331	1.127	50	20	IDGD	
O=C(/C=C\C(=O)NC1CC1)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](F)Br)[nH]n1	1819271994	MSZSBKIFCNADFO-OPXNRTNISA-N	442.289	1.927	50	20	IDGD	
CC[C@H](C)[C@@H](N)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819402117	NWZOVJBKADKOOH-BJOOFOGMSA-N	442.524	1.088	50	20	IDGD	
CC(C)=NO[C@H](C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1820968912	HXIBTQXSGDPUSD-RDTXWAMCSA-N	441.297	1.196	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H]1CCC(=O)NC1)CC2	1822857170	DBUVWJAMYCMGKD-GBNMTWHSSA-N	433.361	1.818	50	20	IDGD	
Cn1ccc(=O)cc1C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1	1823006404	FBNWAIIAEBQYFD-OQPBUACISA-N	443.298	1.758	50	20	IDGD	
Cc1cccn2ncc(C(=O)Nc3nc4c(s3)C[C@H](NC(=O)[C@@H](O)CCl)CC4)c12	1824335147	QFBWMJDVGUFEHN-RISCZKNCSA-N	433.921	1.925	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H]1CCCS1)CC2	1826092078	KTVFRLNYTFAFIS-WCQYABFASA-N	425.580	1.324	50	20	IDGD	
Cc1c(C(=O)N2CCCC[C@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)cnn1C	1826108079	ZOUUCFGYHUANFL-IBGZPJMESA-N	432.569	1.335	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)C(=O)Nc2cccnc2)CC1	1829045309	UOSVZXLETSXVNU-QZTJIDSGSA-N	436.940	1.894	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CCc3ccoc3C1)CCO2	1830940373	KWSHOYXZEQHASY-LLGFUMIMSA-N	440.924	1.095	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc4[nH]ncc4c3)C2)C1	1831651544	RAPVNPOVNDKJPB-OXQOHEQNSA-N	435.912	1.435	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3cnccc3C)CCO2)C1	1833015207	OACGZYOTFJWWNP-NQIIRXRSSA-N	439.940	1.033	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cccc4c3OCC4)CC2)CC1)[C@@H](O)CCl	1833309845	BBXHGQOLWCEOEI-IBGZPJMESA-N	435.952	1.406	50	20	IDGD	
Cc1nc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCBr)C3)C2)ccc1F	1833460250	CJGUTPJBZJLDJV-GOSISDBHSA-N	444.301	1.384	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@](C)(Cl)CCl)C3)C2)cn1	1833998961	AWEKONXAFWAFRA-RTBURBONSA-N	430.332	1.696	50	20	IDGD	
Cc1nc(C)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)s1	1834079726	RXRQLRDSTCXPEX-PIGZYNQJSA-N	446.367	1.613	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCBr)CCO2)C1	1834819798	WHVXIKIIFAXNQZ-MRXNPFEDSA-N	425.751	1.493	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)[C@H](C)CS(C)(=O)=O)CC2)CC1	1836394740	FHUXLTDHUGSVGO-RHSMWYFYSA-N	436.018	1.256	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC1CCN(C2CCN(C(=O)CN3CCOCC3)CC2)CC1	1836398343	GVNFMMKHWQYDAO-HXUWFJFHSA-N	449.423	1.127	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836718928	JARGOFIFTNFLQM-INIZCTEOSA-N	447.960	1.109	50	20	IDGD	
CCc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@](C)(Cl)CCl)C3)C2)nn1C	1838276387	VIEAADVNGAPTBG-RTBURBONSA-N	447.363	1.289	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cc(OC)n(C)n3)CC2)CC1	1838561930	JOJBLERYSXKBDO-INIZCTEOSA-N	442.944	1.295	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)OC(=O)NC(C)C)C2)C1	1839146999	DGPNGCGHQRNPQD-YWZLYKJASA-N	447.960	1.373	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnn4cccc(C)c34)C2)C1	1839148513	ZOUBMLLOAURIOA-LAUBAEHRSA-N	434.924	1.730	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)s1	1839198182	WNHKXXWGNQJJKJ-CZUORRHYSA-N	435.315	1.817	50	20	IDGD	
O=C(c1cccc2nccn12)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1839552986	GIEUIUOADODVDD-SFHVURJKSA-N	427.288	1.208	50	20	IDGD	
C=C(C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)CBr)C2)C1)C(F)(F)F	1839891073	JWVPBXUNUNFCGL-XHDPSFHLSA-N	443.260	1.592	50	20	IDGD	
CCc1ncsc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](Cl)COC)CCO2	1840154006	HVUHAZJJYCMKCE-FZKQIMNGSA-N	431.942	1.029	50	20	IDGD	
O=C(C1CCSCC1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1840925041	JVTBEWADQSNLSF-CZUORRHYSA-N	439.347	1.277	50	20	IDGD	
COc1ccc(Br)cc1C(=O)N1CCCC12CN(C(=O)[C@H](O)CCl)C2	1845280834	AHEATLLBIYMTOL-CYBMUJFWSA-N	431.714	1.874	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)c1cccc(C(F)(F)F)n1)C2	1846385187	AXEROLNBFROQJN-UHFFFAOYSA-N	427.427	1.290	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H]2CC[C@@H](C2)[C@H]1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl	1847564101	QXRKPNFYOXINNT-UYLCUJDWSA-N	441.956	1.576	50	20	IDGD	
CC(C)N(C)S(=O)(=O)c1cccc(C(=O)OCC(=O)NNC(=O)c2cccs2)c1	9751749	UCBQNXUXQJKLAU-UHFFFAOYSA-N	439.515	1.395	50	20	IDGD	
CCNc1ccc(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1[N+](=O)[O-]	15314996	LZGKJSOEAIQKON-UHFFFAOYSA-N	440.504	2.000	50	20	IDGD	
COc1ccccc1N1C[C@@H](C(=O)OCC(=O)NNC(=O)c2ccc(C)cc2)CC1=O	21607078	BVMSSAJWOIKIBD-INIZCTEOSA-N	425.441	1.361	50	20	IDGD	
COc1ccc(Cl)cc1CC(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	26535070	JNTDROOEZFTGMQ-UHFFFAOYSA-N	432.285	1.653	50	20	IDGD	
C[C@H]1Oc2ccccc2N(CCC(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)C1=O	110551131	JECFJDKIDGMNRW-CQSZACIVSA-N	444.513	1.775	50	20	IDGD	
COC[C@@H](C)n1c(C)cc(/C=C(\C#N)C(=O)N2CCN(CC(=O)N3CCCC3)CC2)c1C	206012118	PIMKSZIDODSFJS-VZMFNRANSA-N	441.576	1.986	50	20	IDGD	
CCS(=O)(=O)N1CCC(C(=O)NNC(=S)Nc2ccc(OC(C)C)cc2)CC1	727497448	SAVVUMWLQOBCJU-UHFFFAOYSA-N	428.580	1.853	50	20	IDGD	
COCCNS(=O)(=O)c1cccc(C(=O)NNC(=O)c2c(Cl)cccc2Cl)c1	727806372	WPFIIWUNAPKYDZ-UHFFFAOYSA-N	446.312	1.993	50	20	IDGD	
CN(C)N(C(=O)c1ccc(F)c(S(=O)(=O)N2CCCCC2)c1)[C@H]1CCS(=O)(=O)C1	728176413	OHDLCMZDXKUTKL-HNNXBMFYSA-N	447.554	1.106	50	20	IDGD	
CN(C)N(C(=O)Cc1csc(NC(=O)c2cccs2)n1)[C@H]1CCS(=O)(=O)C1	728179731	UWYWNTRNPQYYDA-LBPRGKRZSA-N	428.561	1.492	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)c2ccc3c(c2)C(=O)N(C)C3=O)c1	728529907	TUWYVHCGRNEIJM-UHFFFAOYSA-N	432.230	1.758	50	20	IDGD	
COc1ccc(CCN2C[C@H](C(=O)NNC(=O)c3cccc(C#N)c3)CC2=O)cc1OC	728827258	KNWAXHOOJJIOCR-GOSISDBHSA-N	436.468	1.428	50	20	IDGD	
C#Cc1ccc(C(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)cn1	728858075	DNUNAJXKOABIHP-UHFFFAOYSA-N	426.479	2.000	50	20	IDGD	
C[C@H](C(=O)N(C)CC(=O)NNC(=O)c1ccc(Br)cc1Cl)n1cccn1	728869797	CTUAAMNELMLZLH-SNVBAGLBSA-N	442.701	1.780	50	20	IDGD	
O=C(NCC1(c2ccccc2)CCOCC1)NNC(=O)C1CCN(c2ncccn2)CC1	728949699	VCIZPTDMVDGKGC-UHFFFAOYSA-N	438.532	1.772	50	20	IDGD	
C[C@@H]1CC(=O)Nc2ccccc2N1C(=O)CN(C)C(=O)NNC(=O)c1cccc(C#N)c1	728954896	RQPDVFCDDLNQBD-CQSZACIVSA-N	434.456	1.608	50	20	IDGD	
C[C@H]1CN(C(=O)c2ccc(CNC(=O)NNC(=O)Cc3cccnc3)cc2)C[C@@H](C)O1	728958256	YXLSTMMNESXEDC-IYBDPMFKSA-N	425.489	1.404	50	20	IDGD	
O=C(Cc1ccccc1Br)NNC(=O)c1csc(N2CCOCC2)n1	729300684	QWZUTTIXAHKVEV-UHFFFAOYSA-N	425.308	1.746	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1cccc2c1O[C@@H](C)C(=O)N2	729300966	UPQKFNNRINBHBP-NSHDSACASA-N	431.474	1.082	50	20	IDGD	
O=C(CN1C(=O)Cn2c(cc3ccccc32)C1=O)NNC(=O)c1cccc2ncccc12	730227493	AUNAPLAHUKNSDA-UHFFFAOYSA-N	427.420	1.633	50	20	IDGD	
O=C(NNC(=O)C1CCC1)c1cccc(NS(=O)(=O)c2ccc3c(c2)OCCO3)c1	732143120	SLDYLEDLTAUSQY-UHFFFAOYSA-N	431.470	1.820	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)N[C@@H](Cc1ccccc1)CN1CCOCC1	732476446	JSPCEMYKIIYPRK-IBGZPJMESA-N	442.516	1.348	50	20	IDGD	
CCc1cc(N2CCC[C@H](NC(=O)NNC(=O)COc3ccc(OC)cc3)C2)ncn1	732914019	JPRPOSNRPFJXLM-INIZCTEOSA-N	428.493	1.426	50	20	IDGD	
O=C(NNC(=O)N1CCN(c2ccc([N+](=O)[O-])nc2)CC1)c1cnn(-c2ccccc2)c1	733351186	TULMAYWQIBCZMQ-UHFFFAOYSA-N	436.432	1.352	50	20	IDGD	
Cc1cc(NNC(=O)CSCC(=O)Nc2c(C)n(C)n(-c3ccccc3)c2=O)ncn1	734254627	SSARRHAJTRCXJZ-UHFFFAOYSA-N	441.517	1.398	50	20	IDGD	
CCO[C@H]1C[C@@H](O)C12CCN(CC(=O)NNC(=O)c1cc(Cl)ccc1OC)CC2	741255361	JGNAOGGNSWUFAK-SJORKVTESA-N	425.913	1.362	50	20	IDGD	
O=C(O)c1ccc(S(=O)(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1Cl	743257958	SCSFXZIQURDTCR-UHFFFAOYSA-N	439.881	1.054	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)[C@@H]2CCCN(C(=O)Nc3ccccc3)C2)c1	744594613	SRGZUPDOCNJSNB-GOSISDBHSA-N	449.467	1.807	50	20	IDGD	
CCCc1ccc(N2C[C@H](C(=O)OCC(=O)NNC(=O)c3ccc(C#N)cc3)CC2=O)cc1	744683039	QHYGBGVBUASXEG-LJQANCHMSA-N	448.479	1.868	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)NCCCN2C(=O)COc3ccccc32)c1	745856986	LUUUGYANSRSUPD-UHFFFAOYSA-N	426.473	1.828	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCN(c3ccc4ccccc4n3)CC2)cc1OC	746470189	QOUYJHAHJFBRAO-UHFFFAOYSA-N	449.511	1.835	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(N2CCOCC2)c(C(=O)NNc2cccc([N+](=O)[O-])c2)c1	748005946	SKINPJUTBXEVNK-UHFFFAOYSA-N	449.489	1.439	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)NC1CCN(c2cc(CC)ncn2)CC1	748663285	JTTKLXJVFCHWOF-UHFFFAOYSA-N	442.520	1.816	50	20	IDGD	
N#Cc1cnc2ccccc2c1N1CCN(CC(=O)NNC(=O)c2ccc(F)cc2)CC1	748810052	IIMBJOQPSSVEKT-UHFFFAOYSA-N	432.459	1.829	50	20	IDGD	
COCCOCC(=O)NC1CCC(C(=O)NNC(=O)c2cc3ccccc3cc2O)CC1	748831549	WRLWHECCSRKJAA-UHFFFAOYSA-N	443.500	1.644	50	20	IDGD	
Cc1nn(C)c(C)c1C(=O)NC1(C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)CCCC1	749322540	DCVSVWUKFISLSD-UHFFFAOYSA-N	428.449	1.449	50	20	IDGD	
CS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cc(Br)c[nH]2)cc1[N+](=O)[O-]	750841642	OVNNSRWUIBOLDQ-UHFFFAOYSA-N	431.224	1.164	50	20	IDGD	
COc1cc([N+](=O)[O-])ccc1OC(=O)c1cc(S(=O)(=O)N2CCOCC2)ccc1F	751175147	ZXKPXFSRBVTYMK-UHFFFAOYSA-N	440.405	1.983	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)[C@@H]2CC(=O)N(c3cc(OC)cc(OC)c3)C2)c1	752791025	FSODNEWYBWDIOE-CQSZACIVSA-N	442.472	1.325	50	20	IDGD	
CC(=O)NC[C@H]1CCn2ncc(C(=O)NNC(=O)c3cc(-c4ccc(C)cc4)[nH]n3)c2C1	752834480	RASCWYILCBZRQH-HNNXBMFYSA-N	435.488	1.355	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCc2csc([C@H](C)OC)n2)c2ccccc2c1=O	753057149	PGSVLBIIZQZVHT-NSHDSACASA-N	430.490	1.725	50	20	IDGD	
O=C(O)c1ccc(S(=O)(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1C(F)(F)F	754740926	MXPKIDSXWBZUCA-CQSZACIVSA-N	446.359	1.553	50	20	IDGD	
CCc1cnc(NC(=O)C(=O)NNC(=O)c2ccc(OC)c(Br)c2)s1	756169227	IESPEWODYRPREG-UHFFFAOYSA-N	427.280	1.876	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c2cccnc12	756237045	FRBXWTUDLXQHLC-UHFFFAOYSA-N	443.485	1.960	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1ccnc(Oc2ccccc2Cl)c1	756741897	YQABZIIZEAFPSU-SNVBAGLBSA-N	427.870	1.618	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c(N(C)C)n1	757754597	UKALWHQIDWGHDY-UHFFFAOYSA-N	446.533	1.707	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)c1cn(Cc2ccccc2)nc1-c1cccs1	758041262	XTNLDYKAORHUSF-CYBMUJFWSA-N	447.542	1.359	50	20	IDGD	
O=C([C@@H]1CCCN(Cc2cccnc2)C1)N1CCN(S(=O)(=O)CBr)CC1	758516641	FACIDMYHIYISMD-MRXNPFEDSA-N	445.383	1.120	50	20	IDGD	
CN1C(=O)C[C@@H](C(=O)NNc2nc(O)c3cnn(C)c3n2)[C@@H]1c1ccc(Cl)c(F)c1	759108211	QJWHKPAYILWJHN-OTYXRUKQSA-N	433.831	1.524	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)NC[C@@H]2CN(Cc3ccccc3)CCCO2)cc1	759350418	DCWFXLRRJOVCAP-OAQYLSRUSA-N	437.500	1.559	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)c2ccc(Sc3nncn3C)c([N+](=O)[O-])c2)nc1	759730544	JZMTZCRUVXPVAN-UHFFFAOYSA-N	429.418	1.813	50	20	IDGD	
COC(=O)[C@@H](C)Cc1ccc(NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1	760090440	RYELXTZUIYTTQZ-ZDUSSCGKSA-N	437.456	1.752	50	20	IDGD	
CC(C)(c1ccc(NC(=O)C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)cc1)C(F)(F)F	760278579	ZRKGKBYQTOVKKX-JTQLQIEISA-N	435.424	1.047	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)C2=Cc3cc(Br)ccc3OC2)C[C@@H](C)O1	762188711	ANQZDAVYRSSTEF-BETUJISGSA-N	438.322	1.872	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)[C@@H]2CC(=O)N(c3ccc4c(c3)OCCO4)C2)n1	762912453	KBIPAXDXEOIECN-CQSZACIVSA-N	426.477	1.590	50	20	IDGD	
Cc1ccc(I)cc1C(=O)NNC(=O)CNC(=O)c1cccs1	763319754	BBORZKMOXQHXDZ-UHFFFAOYSA-N	443.266	1.852	50	20	IDGD	
COC(=O)c1cc(C)c(C)c(S(=O)(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)c1	763439346	LVEGFFXDGPMYSY-UHFFFAOYSA-N	443.522	1.704	50	20	IDGD	
Cc1nn(CC(F)(F)F)c(C)c1CC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	763549821	VIKTYLSUOUFEGF-UHFFFAOYSA-N	432.424	1.469	50	20	IDGD	
COCCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2F)cc1Cl	763557226	YAHYLLITQZCBES-UHFFFAOYSA-N	436.827	1.255	50	20	IDGD	
O=C(NNC(=O)c1ccccc1F)C(=O)Nc1cccc(C(=O)NCc2ccccn2)c1	763561047	HRMFSNZKBCNKHS-UHFFFAOYSA-N	435.415	1.550	50	20	IDGD	
C[C@H](C#N)CSc1ccccc1NC(=O)C(=O)NNC(=O)[C@@H]1COc2ccccc2O1	763578336	ORHMASNRXQFARA-DYVFJYSZSA-N	440.481	1.864	50	20	IDGD	
CCOC(=O)c1c(C)csc1NC(=O)C(=O)NNC(=O)COc1ccccc1CC	763716910	OZSGHCVKAJMYTB-UHFFFAOYSA-N	433.486	1.961	50	20	IDGD	
COCCOc1ncccc1NC(=O)C(=O)NNC(=O)CC12CC3CC(CC(C3)C1)C2	763736913	UJPRHBQITXGXDT-UHFFFAOYSA-N	430.505	1.799	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(C(=O)OC)cc(OC)c2OC)cc1	763831674	RAJXXMMZSJHLAM-UHFFFAOYSA-N	429.429	1.453	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1cccc(NC(=O)C2CC2)c1	763865948	MMLLWLSQHHCCKZ-LBPRGKRZSA-N	428.420	1.728	50	20	IDGD	
CNC(=O)c1cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)ccc1Cl	763870719	BVKOVJQFZOMFHY-JTQLQIEISA-N	436.827	1.392	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccc(Br)cc2Cl)n1	763886308	SFXQMFLJZMKWFW-UHFFFAOYSA-N	428.674	1.702	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cc3c(cc2Cl)OCO3)cc1OC	763902697	WNIWLVROCLNDCX-UHFFFAOYSA-N	435.820	1.876	50	20	IDGD	
CNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CC[C@H](C)C3)c1C	763938391	DXWAXEOMOHJCIY-NSHDSACASA-N	428.514	1.941	50	20	IDGD	
O=C(NNC(=O)c1cc(Cl)ccc1O)C(=O)Nc1cccc(CN2CCOC2=O)c1	763979299	SULKONKJWYLVCM-UHFFFAOYSA-N	432.820	1.398	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)C(=O)Nc1ccc(NC(=O)c2ccco2)c(Cl)c1	763992460	FFICUGGPUVZYAQ-UHFFFAOYSA-N	429.820	1.924	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2cc(Br)cn2C)cnn1-c1ccccc1	764003088	YARHSHDTUUMDIU-UHFFFAOYSA-N	445.277	1.681	50	20	IDGD	
C=CCN(CC=C)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)nc2)cc1	764098964	QRSIUEDZVIZSTK-UHFFFAOYSA-N	441.875	1.949	50	20	IDGD	
COCCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)CCc2ccco2)cc1Cl	764172088	POXFWJDVDPYMAH-UHFFFAOYSA-N	436.852	1.028	50	20	IDGD	
CN(Cc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(C#N)cc2)c1)C(=O)C(F)(F)F	764177184	KOIMJPMTIGZNSR-UHFFFAOYSA-N	447.373	1.479	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CC(C)(C)C)cc1NC(=O)CN1CCCCC1	764199953	VIGGYCGMVMNWMC-UHFFFAOYSA-N	431.537	1.942	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(-n3nccn3)cc2C(F)(F)F)c1	764234586	GZJAOWXMZAZDEV-UHFFFAOYSA-N	443.345	1.557	50	20	IDGD	
Cn1ccnc1-c1csc(NC(=O)C(=O)NNC(=O)c2cccc(OC(F)F)c2)n1	764249674	CNNWBQFVMPHUTM-UHFFFAOYSA-N	436.400	1.545	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)ccc1O)C(=O)Nc1ccc2nccnc2c1	764280388	NZLMCCREVLQDCI-UHFFFAOYSA-N	430.218	1.498	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)C(C)(C)c3ccccc3)cn2)C[C@H](C)O1	764309219	NONVMWYEZMWONP-HOTGVXAUSA-N	439.516	1.759	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)C(=O)Nc1ccc(OC2CCCC2)nc1	764342832	KLVMQHZAMHOMFO-UHFFFAOYSA-N	434.456	1.988	50	20	IDGD	
CNC(=O)Cn1ccc2ccc(NC(=O)C(=O)NNC(=O)c3ccc(O)c(Cl)c3)cc21	764349391	MHVWVKBLKNMTGP-UHFFFAOYSA-N	443.847	1.146	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1F)C(=O)Nc1cccn(CC(F)(F)F)c1=O	764410585	SZIXJTIFXQZWKJ-UHFFFAOYSA-N	434.733	1.603	50	20	IDGD	
Cc1ccc2nc(-c3ccc(NC(=O)C(=O)NNC(=O)[C@H]4COCCO4)cc3)sc2c1	764424743	KWJJDABGWDDYHL-MRXNPFEDSA-N	440.481	1.773	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3cc(OC)c(O)c(OC)c3)n[nH]2)cc1OC	764752415	WIQLXMRABRCHRG-UHFFFAOYSA-N	442.428	1.892	50	20	IDGD	
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)NNC(=O)c1csc(N2CCOCC2)n1	765197759	XWGHSAFNOIBCSF-DOTOQJQBSA-N	444.561	1.444	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)c2cc(S(=O)(=O)N(C)C)oc2C)n[nH]1	765595578	MVEKYVREWNCOER-UHFFFAOYSA-N	447.473	1.312	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1cccc2c1CCN2C(=O)OC(C)(C)C	766272850	XQPKXOYFXUFXCV-UHFFFAOYSA-N	428.449	1.865	50	20	IDGD	
O=C(CNc1cccc(Cl)c1)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	766635592	ANZFDNPYDRYOAT-UHFFFAOYSA-N	429.908	1.357	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNc2ncnc3ccsc23)sc1Br	766677094	YATXBJNCBGUNJA-UHFFFAOYSA-N	434.322	1.920	50	20	IDGD	
C=CCOc1cc(OC)ccc1C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	766801922	SGXWPVCYKANSJI-IBGZPJMESA-N	442.424	1.404	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)c2cc(OC(F)F)n(C)n2)c2ccccc2c1=O	767046794	VZVXRVKTALHNKF-UHFFFAOYSA-N	448.430	1.996	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(N2C[C@@H](C(=O)N3CC=C(C#N)CC3)CC2=O)cc1	767160438	QEVAKIDEIOJRTA-KRWDZBQOSA-N	430.530	1.752	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)NCCC(=O)Nc3ccc(Br)cc3)nc21	770350891	PZTBYUMTGSCRMC-UHFFFAOYSA-N	449.269	1.486	50	20	IDGD	
COc1ccc(Cl)cc1N1CC[C@@H](NC(=O)NNc2nc(O)c3cnn(C)c3n2)C1	770372103	QLGGWJDVOMCBCB-LLVKDONJSA-N	432.872	1.636	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1ccc(C(N)=O)cc1)C(=O)NNc1ncccc1C(F)(F)F	771022305	LNFCIXNQNAUMQY-SECBINFHSA-N	431.396	1.009	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)CN1C(=O)c2ccccc2N2C(=O)CC[C@]12C	771986177	VFFBGAYSOILUJQ-RCDICMHDSA-N	444.488	1.111	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)CCCNC(=O)c2cccnc2)c2ccccc2c1=O	772352860	OMJKHNVBSTVTHO-UHFFFAOYSA-N	436.472	1.344	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)[C@H](C(C)C)N2CCCS2(=O)=O)c(C)n1-c1ccccc1	772631062	PNAOORMUHDXDPA-IBGZPJMESA-N	432.546	1.915	50	20	IDGD	
COC(=O)c1cc(OC)c(OC)cc1NC(=O)C(=O)NNc1ccc(C(F)(F)F)cn1	773667818	SNYNLZMPJVNBBV-UHFFFAOYSA-N	442.350	1.986	50	20	IDGD	
O=C(NNc1ncc(Cl)cc1Cl)C(=O)Nc1ccccc1C(=O)N1CCOCC1	773677610	QELPIGYTTNFWHZ-UHFFFAOYSA-N	438.271	1.943	50	20	IDGD	
O=C(NNc1cnccn1)[C@H]1Cc2ccccc2CN1S(=O)(=O)c1ccc(F)cc1	775279061	RUXBOHZDANVAEC-GOSISDBHSA-N	427.461	1.875	50	20	IDGD	
CN(C)C(=O)[C@H]1CC[C@@H](CNC(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)O1	775461519	QZUFSTKRBCSOQV-WCQYABFASA-N	438.428	1.242	50	20	IDGD	
CN(C)C(=O)[C@H]1CC[C@@H](CNC(=O)CCC(=O)C(C#N)=C2N(C)c3ccccc3N2C)O1	775576727	NDPIEPZHRBDLHS-MGPUTAFESA-N	439.516	1.409	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)COC1CCN(C(=O)OC(C)(C)C)CC1	777097010	KNUZDGDZQPLJGZ-UHFFFAOYSA-N	431.493	1.820	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1cc(C)n(-c2ccc(F)cc2)n1	777275656	VSTSEKJYZFBQQM-UHFFFAOYSA-N	444.492	1.996	50	20	IDGD	
CN(C)Cc1c(C(=O)N2CCN(S(=O)(=O)CBr)CC2)oc2ccccc12	777777360	HRQVTLOVTYLROM-UHFFFAOYSA-N	444.351	1.934	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@H](C(=O)NNc2ccc([N+](=O)[O-])cc2Cl)[C@H](C)O)cc1	779533364	FANCMSXQALNZMS-ZBEGNZNMSA-N	442.881	1.728	50	20	IDGD	
COc1ccc(NNC(=O)NCc2ccc(S(=O)(=O)NC[C@H]3CCCO3)cc2)nc1	780964722	UMUCLFKJGQLIOI-MRXNPFEDSA-N	435.506	1.374	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)NCc2ccccc2CN2CC[C@@H](O)C2)cc1OC	781833022	JDIURYWBOUICLV-LJQANCHMSA-N	442.516	1.805	50	20	IDGD	
O=C(NNc1cncc(Cl)n1)C(=O)N1C[C@H](C(=O)N2CCCCC2)Oc2ccccc21	783260327	ZJHOKZTXQFSREY-OAHLLOKOSA-N	444.879	1.380	50	20	IDGD	
C[C@@H]1CN(c2ccc(NC(=O)C(=O)NN=c3sc4ccccc4n3C)cn2)C[C@@H](C)O1	783349378	HWXKRFODIJMHTI-ZIAGYGMSSA-N	440.529	1.819	50	20	IDGD	
Cn1c(=NNC(=O)C(=O)Nc2ccc(CS(C)(=O)=O)c(F)c2)sc2ccccc21	783349382	HXOCQBFZKJZQQX-UHFFFAOYSA-N	436.490	1.494	50	20	IDGD	
Cc1ccc(NNC(=O)C(=O)Nc2ccnn2Cc2ccccc2Br)nn1	783953962	SIOUZRIYVBMIAK-UHFFFAOYSA-N	430.266	1.874	50	20	IDGD	
N#CCc1ccc(OCc2cccc(NC(=O)C(=O)NNC(=O)C(=O)N3CCCC3)c2)cc1	784000111	WCKIPJUEYATFDP-UHFFFAOYSA-N	449.467	1.040	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)C(=O)Nc1ccc(Oc2cccc(F)c2)cc1	784002034	JOXFFTVDLRDJNV-UHFFFAOYSA-N	440.387	1.727	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)cc1C	784213856	QHHVZCGYJAEXFC-UHFFFAOYSA-N	446.485	1.304	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2ccc(C#N)c(C(F)(F)F)c2)n(-c2ncccn2)n1	784238640	RQNSQVCSDRJZFO-UHFFFAOYSA-N	430.350	1.943	50	20	IDGD	
COC(=O)C1(CNC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)CCCCC1	784564745	SAYYZJUPMDLVRW-UHFFFAOYSA-N	426.495	1.549	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCCCC2)cc1NC(=O)C(=O)NNc1ccnc(F)c1	784852358	WSGCLXKAJNJETG-UHFFFAOYSA-N	435.481	1.786	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNc2cc(F)c(F)cc2F)ccc1S(=O)(=O)N(C)C	784886399	IBXLYDJTCWYEIW-UHFFFAOYSA-N	446.407	1.445	50	20	IDGD	
CCc1cc(Br)ccc1NC(=O)C(=O)NNC(=O)Cc1cn2ccccc2n1	785060859	PXMSZKDSJQBAMK-UHFFFAOYSA-N	444.289	1.988	50	20	IDGD	
COC(=O)c1ccc(S(=O)(=O)NNC(=O)c2cc(C)nc3ccccc23)c(OC)c1	785480265	FKSPGEBZLNVFJP-UHFFFAOYSA-N	429.454	1.962	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2nn(-c3cccc(F)c3)cc2O)c1	785687534	YBDHTIZPJMSGEH-UHFFFAOYSA-N	447.448	1.042	50	20	IDGD	
Cc1ccc(NC(=O)[C@@H](C)OC(=O)/C(C#N)=C/C2CC2)cc1S(=O)(=O)N1CCOCC1	786679238	YADUCDRNGFAXMF-QAEAHILHSA-N	447.513	1.746	50	20	IDGD	
CCS(=O)(=O)CCn1cc(C)c(NC(=O)NNC(=O)Cn2ccc3ccccc32)n1	786735732	WLEJRXLGAMKRRL-UHFFFAOYSA-N	432.506	1.434	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)C(=O)Nc1ccc(Cl)cc1-n1cccn1	788337748	KCFNJTMYIMKAJD-UHFFFAOYSA-N	437.847	1.502	50	20	IDGD	
COc1cc(NNC(=O)C(=O)Nc2ccccc2N(C)S(C)(=O)=O)ccc1Cl	789804444	DLMNQLMVFSXQJY-UHFFFAOYSA-N	426.882	1.826	50	20	IDGD	
Cc1cccnc1NNC(=O)c1cc(-c2ccc3c(c2)OCO3)nc2c1c(O)nc(=O)n2C	791224347	DHQIMLINUQBJPR-UHFFFAOYSA-N	446.423	1.890	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)CCSCc2ccccc2)CC1	792639817	XRZSHGQJQBACGC-UHFFFAOYSA-N	449.602	1.784	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNS(=O)(=O)c1cc([N+](=O)[O-])cc(Cl)c1F	795346649	BSKWBLNRYUTFDK-UHFFFAOYSA-N	426.810	1.222	50	20	IDGD	
CNC(=O)COc1ccc(NC(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)c(C)c1	797681103	UQZYCFMBSQXDLM-UHFFFAOYSA-N	446.460	1.612	50	20	IDGD	
C=CCNC(=S)NNC(=O)c1c[nH]c2ccc(I)cc2c1=O	798306170	XCXGZFHUQRTPCM-UHFFFAOYSA-N	428.255	1.428	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C(C)C)n2nnc(-c3ccccc3)n2)cc1C	798309330	KMKPSVQDQVSUBF-SFHVURJKSA-N	435.488	1.940	50	20	IDGD	
Cc1cc(O[C@H]2CCN(C)C2=O)ccc1NC(=O)NNC(=O)c1ccc2c(c1)OCO2	799238272	CCUQVNWRQKIITB-KRWDZBQOSA-N	426.429	1.800	50	20	IDGD	
NC(=O)c1cc(Br)cc(S(=O)(=O)NNC(=O)c2cccc(Cl)c2)c1	799519179	QBQKWDKAJXDAQW-UHFFFAOYSA-N	432.683	1.825	50	20	IDGD	
CCOC(=O)C=c1sc(=Cc2cccc(CCl)c2)c(=O)n1CC(=O)N(CC)CC	799890629	SHYISYCGFLDZPU-UHFFFAOYSA-N	436.961	1.689	50	20	IDGD	
O=C(CN1C(=O)[C@@H]2[C@@H](C1=O)[C@H]1C=C[C@H]2C1)NNc1cc([N+](=O)[O-])ccc1Br	800621298	QGUQZNPBPWUHOM-DMAMZFHHSA-N	435.234	1.608	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)NCCNS(=O)(=O)c2ccc(F)cc2Cl)n1	801060207	YEFXTJCMJRYGCH-UHFFFAOYSA-N	429.861	1.105	50	20	IDGD	
Cc1ccc([C@@]2(C)NC(=O)N(CC(=O)NNC(=O)Nc3cc(F)cc(F)c3)C2=O)cc1	802002780	BQEDGXUNQARPSN-HXUWFJFHSA-N	431.399	1.893	50	20	IDGD	
CC(C)[C@H](NC(=O)OC(C)(C)C)C(=O)NCC(=O)NNC(=O)Nc1cc(F)cc(F)c1	802005209	YUQGSDZWZIVBFC-HNNXBMFYSA-N	443.451	1.783	50	20	IDGD	
CS(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)c2ccccc2)c(Br)c1	802720413	HFEJZYUXGVIKSD-UHFFFAOYSA-N	433.305	1.476	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)C(C)(C)S(=O)(=O)c1ccc(Cl)cc1	807206607	XBLSPPHPWPQXEJ-UHFFFAOYSA-N	433.914	1.564	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)NC2C[C@@H]3CC[C@H](C2)N3CC(=O)N(C)C)cc1OC	807514519	WEHKAEREQAJKGK-ALOPSCKCSA-N	447.536	1.122	50	20	IDGD	
O=C(NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1)c1cc2n(n1)CCO2	809984734	WVYPMOQEROBAJW-UHFFFAOYSA-N	433.471	1.213	50	20	IDGD	
Cc1nn(C)c(Cl)c1C=NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	812486882	MCVZPPLWVAGRGQ-UHFFFAOYSA-N	425.898	1.167	50	20	IDGD	
COc1cc(CNC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)ccc1C#N	812543083	FQANNGICGQATIA-UHFFFAOYSA-N	445.501	1.026	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)[C@H](O)c1ccc(Cl)cc1F	813363146	CWXAAGDXTQDVMK-HXUWFJFHSA-N	434.899	1.872	50	20	IDGD	
O=C(NNc1nc(-c2cccnc2)no1)C1(S(=O)(=O)c2ccccc2)CCOCC1	813448610	PQDWUAGVSCHTML-UHFFFAOYSA-N	429.458	1.598	50	20	IDGD	
CNS(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=O)CNc2ccccc2OC)c1	825649574	XHTVZGMQHOLFHR-UHFFFAOYSA-N	426.882	1.130	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NNC(=S)NCCc2cccs2)cc1	838819300	JQSHLRMPYSEZHO-ZDUSSCGKSA-N	426.589	1.461	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)CCc1nc(-c2ccco2)no1	900571380	NSEBJRLQZNTZRA-UHFFFAOYSA-N	448.819	1.929	50	20	IDGD	
CC(C)C[C@@H](C(=O)NNC(=O)COc1ccc(F)cc1)N1C(=O)[C@H]2CC=CC[C@H]2C1=O	910865369	TWYUREXRBLOYFF-KSZLIROESA-N	431.464	1.718	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCc3sccc3C2)c1)c1ccncc1	913465647	ZWUCPZQQCQKBEQ-UHFFFAOYSA-N	442.522	1.965	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCCOc2ccc(C)cc2C)cc1	915929485	BROJFDICTSPUHO-UHFFFAOYSA-N	448.545	1.642	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)NC[C@@H](c2ccccc2)N2CCOCC2)nc2ccccc21	916508809	FAKQGSXOAZQTOT-FQEVSTJZSA-N	436.516	1.520	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CNC(=O)c2ccc(Br)cc2)cc1	916830445	YUURENTYRBQDPQ-UHFFFAOYSA-N	433.262	1.273	50	20	IDGD	
Cc1occc1C(=O)NCC(=O)NNC(=O)c1ccc(CSc2nncn2C)cc1	917021879	XMLOSAPYHKYIQF-UHFFFAOYSA-N	428.474	1.200	50	20	IDGD	
C#Cc1cccc(NC(=O)CN(C)CC(=O)NNC(=O)c2cc(Cl)ccc2OC)c1	917155938	OOIVVRWOKCVINE-UHFFFAOYSA-N	428.876	1.661	50	20	IDGD	
O=C(CN1CCN(C(=O)COc2ccc(Cl)cc2)CC1)NNC(=O)c1ccc(F)cc1	917164927	RSCUMZJDGAINKV-UHFFFAOYSA-N	448.882	1.463	50	20	IDGD	
COc1cc(S(=O)(=O)NNC(=O)c2cc(Br)c[nH]2)cc(C(=O)O)c1OC	917730282	AIXOLTFSWANQOZ-UHFFFAOYSA-N	448.251	1.116	50	20	IDGD	
COC(=O)c1ccc(Br)c(S(=O)(=O)NNC(=O)c2ccc(Cl)nc2)c1	917745878	AZMNIFRGPSDMNC-UHFFFAOYSA-N	448.682	1.907	50	20	IDGD	
COC1(C(=O)NNC(=O)[C@H]2COc3ccccc3O2)CCN(C(=O)OC(C)(C)C)CC1	917905800	JAKZULXYJURFTG-MRXNPFEDSA-N	435.477	1.390	50	20	IDGD	
Cc1ccc([C@@H](CNC(=O)NNC(=O)COc2ccccc2C#N)N2CCOCC2)cc1	918099218	MQUOAEVABFWLLP-HXUWFJFHSA-N	437.500	1.649	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)N[C@H](c2ccc(F)cc2)[C@@H]2CCCO2)c2ccccc2c1=O	918126116	GNFOGXZPDJTCMZ-ZWKOTPCHSA-N	439.447	1.937	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)Cc2c(C)nc(-c3cccnc3)nc2O)cc1OC	918205928	XOZSRTFZLAGJMB-UHFFFAOYSA-N	437.456	1.964	50	20	IDGD	
COc1cccc(C(=O)N2CCN(C(=O)NNC(=O)c3c(C)nc4ccccn34)CC2)c1	918776784	ZQSFZGCRGSLFPJ-UHFFFAOYSA-N	436.472	1.464	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)CN(C)C(=O)c1ccc(Br)s1	919822108	QYXHIICUXXCCFS-UHFFFAOYSA-N	440.319	1.981	50	20	IDGD	
O=C(NNC(=O)c1ccccc1C(=O)c1ccc(Cl)cc1)N[C@@H]1CCS(=O)(=O)C1	919889928	WYEGLPHHDMGQTI-CQSZACIVSA-N	435.889	1.702	50	20	IDGD	
Cc1ccc(-n2ncc(C(=O)NNC(=O)N[C@H]3CCS(=O)(=O)C3)c2C(F)(F)F)cc1	919889960	XNEYKCCXNFHZHW-NSHDSACASA-N	445.423	1.331	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)NC[C@@H]2CCCOC2)cc1	920855272	ZWDTUAWRSFQARL-GYKGCMEESA-N	437.500	1.884	50	20	IDGD	
O=C(NCCc1nc(Cc2ccccc2)no1)NNC(=O)c1cc(Br)c[nH]1	1121801392	POYUTYOZNKFGQE-UHFFFAOYSA-N	433.266	1.938	50	20	IDGD	
O=C(CSc1nnc(C[C@H]2CCS(=O)(=O)C2)o1)NNC(=O)c1cccc(Cl)c1	1317732599	WTLYXSBPQMNILY-SNVBAGLBSA-N	444.922	1.254	50	20	IDGD	
CCOC(=O)COc1ccc(C=NNC(=O)c2sc(N3CCOCC3)nc2C)cc1	1319012492	RSODGNPKKJMRBP-UHFFFAOYSA-N	432.502	1.994	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cncn1-c1ccncc1)C2)[C@@H](F)Cl	1778023711	BWRPQKIACKBFKS-MBOZVWFJSA-N	435.887	1.929	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccn(C(F)F)c1=O)C2)[C@@H](F)Cl	1778031535	YTAADBQMHSFYTP-SNUQEOBHSA-N	435.830	1.905	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(CCN(C(=O)c3n[nH]c4c(F)cccc34)C2)C1	1778634759	QQGONMBEDIPHBT-HXUWFJFHSA-N	434.544	1.997	50	20	IDGD	
O=C(c1c[nH]c2cccc(Cl)c12)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1778752355	SULFCRAMSQFTQV-BEFAXECRSA-N	426.300	1.865	50	20	IDGD	
CC[S@@](=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CO[Si](C)(C)C)C1	1779545516	VMARBXJUBAYFKS-OVBXVEMXSA-N	432.659	1.511	50	20	IDGD	
CCOc1ccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)nn1	1780426001	CJIOBUCIBYVXCW-QZTJIDSGSA-N	431.320	1.555	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1ccc(F)cn1)C2)[C@@H](F)Br	1780771496	IZKQSDOXNZYLRZ-QGPMSJSTSA-N	446.292	1.968	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cccn3nccc23)C1	1781297768	LBPRPESGBCENTG-YRISNDGFSA-N	434.924	1.716	50	20	IDGD	
O=C(c1cnc2snnc2c1)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781333260	FJBWXWDBVJLFAO-IAQYHMDHSA-N	444.286	1.220	50	20	IDGD	
O=C(CCCc1cccnc1)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781335570	VWXHAAZQARVFNL-WMZOPIPTSA-N	428.302	1.925	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3c(O)cc(O)cc3O)C2)C1	1781810076	XPUHEEIHYOVOQB-VOJFVSQTSA-N	443.294	1.278	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)COc1cccnn1)C2	1782002950	YIEPWXYVFKYRTD-PMUMKWKESA-N	441.326	1.153	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(F)c(N(C)C)c(F)c3)C2)C1	1782110395	VDPVODCYTYOMNX-VLIAUNLRSA-N	445.894	1.728	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3c4c(nn3C)CCC4)C2)C1	1782440428	AZNUUMBKLWVHKI-SGTLLEGYSA-N	425.327	1.136	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(CCN(C(=O)c3cnn4cccc(F)c34)C2)C1	1782549693	VJPZQTUJEWSQMK-SFHVURJKSA-N	439.285	1.702	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)C3CCC(CO)CC3)CCO2)C1	1783341739	DNHODZPVKFFEAT-YBSITQRDSA-N	431.371	1.789	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cc4ccccn4n3)CCO2)C1	1783348044	SRLCIGKVZOOGGE-DNVCBOLYSA-N	435.322	1.951	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc4c(c3)CC(=O)N4)CCO2)C1	1783533751	GZMNMRBMPHVVGU-BUXKBTBVSA-N	436.306	1.408	50	20	IDGD	
O=C(Cc1c(F)cccc1Cl)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21	1783810100	DKYFFZFUBPAPSC-SCTFDZSOSA-N	433.307	1.601	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)Cc3cc([N+](=O)[O-])ccc3F)CCO2)C1	1783873164	LVFFKOMJLGIXQI-BEFAXECRSA-N	443.859	1.360	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)Cc3ccc(OC)cc3Cl)CCO2)C1	1783873763	UISISQQFLJMPHC-YLJYHZDGSA-N	445.343	1.975	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cccc(F)c3[N+](=O)[O-])CCO2)C1	1783882456	YZYLOYBYMREKQY-UGSOOPFHSA-N	429.832	1.431	50	20	IDGD	
Cc1nnsc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]2C1	1783965322	IJDGNOXJTSLOOD-BQUFFADESA-N	431.356	1.471	50	20	IDGD	
CC(=O)NCC(C)(C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]21	1784644300	RXYPQPDBFRFPMC-XMDUPGNXSA-N	436.380	1.365	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccnc3OC)[C@H]2C1	1786013043	HNRXGUWMAFFUMH-TUUVXOQKSA-N	440.338	1.857	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(O)n3)[C@H]2C1	1786042868	BFGZAIVATKFDIP-ABHRYQDASA-N	426.311	1.412	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCSC(=N)N)[C@H]2C1	1786849325	CBRMAJCSMPOGFK-RVMXOQNASA-N	435.388	1.156	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cnc4ccccn34)C[C@@H]21	1791248822	ASVLGIUZZYIQFM-DKIMLUQUSA-N	434.924	1.110	50	20	IDGD	
CCCc1onc(C)c1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](Cl)COC)[C@H]2C1	1791254936	XGRZCBAJQNTNFB-JKQORVJESA-N	427.929	1.783	50	20	IDGD	
CCC[C@@H](NC(C)=O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)Br)C[C@@H]21	1792189460	VMTSSUJWUBHLNI-CHUNWDLHSA-N	432.359	1.054	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(=O)nc3sccn13)C2	1793449305	YHRJWPGJORLWMT-OQMKEHIESA-N	438.937	1.367	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1[nH]nc2ccncc12	1796210448	AXKWRRRTLMCIBM-MCYUEQNJSA-N	436.310	1.192	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1Cc3[nH]nc(C(F)(F)F)c3C1)C2)[C@@H](F)Cl	1796370392	JENPTRNQESIVCC-JAQPXOGNSA-N	438.809	1.267	50	20	IDGD	
Cc1cc(C)n2ncc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)C(C)(C)CCl)C4)c2n1	1796919320	UKEZVRUCRICVRL-SCAQPMJSSA-N	433.940	1.814	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C/N=C/c1ccco1	1797835974	TWZITHOWSRGEQX-NSBGJDIASA-N	426.311	1.319	50	20	IDGD	
Cc1nc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CO[Si](C)(C)C)c(C)s1	1797952689	GPTYIPLYSPQKJG-CCWDJLKJSA-N	425.627	1.744	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(-c2ccncc2)[nH]n1	1798146765	RWMNJWNFXGOWEW-CWPLJXCYSA-N	443.580	1.526	50	20	IDGD	
O=C(/C=C/C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](F)Br)C2)NCc1ccco1	1798570113	AYAZGXZFPHRJGS-GINROYPMSA-N	442.285	1.781	50	20	IDGD	
COc1c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)Br)C3)ccc(F)c1F	1799676419	UPDCJDBNNVGCRP-ZVXAKGHKSA-N	447.276	1.960	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)COCCO)[C@H](Br)Cc1ccccc1	1800150120	GMOCVFMGFPDSND-XMTFNYHQSA-N	439.350	1.640	50	20	IDGD	
C/C=C(\C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1800463611	WESIMJPHULHPCR-YYTNDJERSA-N	429.945	1.674	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccn3ccnc3c1)C2	1800641693	HMPOKFJDRNXEHN-IVSAIRAKSA-N	435.322	1.711	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cncn1-c1ccncc1)C2	1800758338	SZFNTPUWUCHRQS-ZJOBFFGXSA-N	448.321	1.254	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c[nH]c3cccc(OC)c13)C2	1800979392	DIFDOWBGIOFLPP-FCIKYMEBSA-N	435.908	1.634	50	20	IDGD	
Cc1cc2[nH]c(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)CCC(=O)NN(C)C)cc2s1	1801012658	DUEIADMXRSUVPO-VTEUUUEMSA-N	447.561	1.114	50	20	IDGD	
CC[C@@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCc1ccc(O)nn1)C2	1801806711	NIVSRYCCBBUZAF-LXTVHRRPSA-N	425.327	1.927	50	20	IDGD	
COc1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CCC(=O)NN(C)C)cc(Cl)n1	1802336961	CBELUNVDTIBWED-QDMKHBRRSA-N	437.928	1.368	50	20	IDGD	
COc1c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CCC(=O)NN(C)C)ccc(F)c1F	1802337881	DFIZRZQPCXWINL-BTTYYORXSA-N	438.475	1.598	50	20	IDGD	
C=CCO[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1803571095	MOYZEDXQAJSAIM-MMOPVJDHSA-N	431.537	1.052	50	20	IDGD	
C[C@H](CNC(=O)OC(C)(C)C)C(=O)N1CCC2(CCCN(C(=O)[C@@H](O)CCl)C2)CC1	1805514919	GTIBCQXWANCZEN-CVEARBPZSA-N	445.988	1.978	50	20	IDGD	
CC(C)(C)CC(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1	1806306394	JFLUJGGWXHSLMY-OXQOHEQNSA-N	438.532	1.836	50	20	IDGD	
O=C(CCBr)NC[C@@H]1CCN(C(=O)CN2CCCC2=O)[C@@H]1c1cccnc1	1806341203	ZVHVHBVCSMMUQR-HNAYVOBHSA-N	437.338	1.495	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)[C@@H]2CCC(=O)N2)[C@@H]1c1cccnc1	1812774698	CWWLAUBMLLZFIH-QBYUYEEZSA-N	437.338	1.540	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)CCSC(=N)N)[C@@H]1c1cccnc1	1813030782	LCJGFFJLTJFOFX-IJEWVQPXSA-N	427.958	1.358	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)CSC(=N)N)sc2C1	1814730866	WKNLGHQGEPXGEU-YUMQZZPRSA-N	434.385	1.855	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)C[C@@H](N)c3cccnc3)sc2C1	1815182607	LCGPQEDNEINHSI-MELADBBJSA-N	437.953	1.794	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccc(O)n2)n[nH]1	1816461565	ZSPSWHIXFSLLEI-HNNXBMFYSA-N	429.481	1.189	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](F)Br)CC2	1817305910	ZTAFTVIANLVBOM-JWKOBGCHSA-N	435.319	1.612	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc(C3CC3)on2)[nH]n1)c1cccc(B(O)O)c1	1817475451	OGFVRZIGRYOCKN-GOSISDBHSA-N	449.276	1.575	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc3n(n2)CCCO3)n[nH]1	1819091094	PBDWAMNKLDTQEG-WFASDCNBSA-N	436.900	1.948	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1)c1cccc(-n2cncn2)c1	1821295722	CQKASAJOXPHWFL-DLBZAZTESA-N	443.895	1.896	50	20	IDGD	
CN[C@H](CC(=O)N[C@@H]1CCc2nc(NC(=O)[C@@](C)(Cl)CCl)sc2C1)C(=O)O	1822863640	QFSPTZADENKTPW-FUXNSRLFSA-N	437.349	1.354	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCc1ccccn1)CC2	1826080559	QTWQUBHWJKNRTI-OAHLLOKOSA-N	444.561	1.456	50	20	IDGD	
CN1CCN(CCC(=O)N[C@@H]2CCc3nc(NC(=O)C(Cl)Cl)sc3C2)CC1	1826096205	LNTOCUWFABCLLO-LLVKDONJSA-N	434.393	1.496	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(O)cn2)CC1	1826212269	DADOJEHTZQDLHI-NRFANRHFSA-N	437.305	1.014	50	20	IDGD	
Cc1cc(C)n(CCC(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@H](O)CCl)CC3)n1	1826573326	IDTKMZWJCQRSFF-GXTWGEPZSA-N	425.942	1.558	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CCN(C)C)CC1	1826708765	NRGNXZGJEZZTQF-SVVBGHPLSA-N	444.580	1.692	50	20	IDGD	
C[C@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1)c1ccccn1	1827055243	SOZADORUJZUSQX-FDDCHVKYSA-N	449.360	1.798	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(F)(F)Cl)C2)C1	1830544247	RIXPDWNHTSXLIT-MFKMUULPSA-N	433.677	1.305	50	20	IDGD	
CC(C)[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1)c1ccccc1	1830838400	QFIOTHSDNHWSKD-IPJJNNNSSA-N	438.952	1.482	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)COc2ccc(O)nn2)CC1	1831834737	HFDREFVWGBOQEW-JKSUJKDBSA-N	440.928	1.435	50	20	IDGD	
CC(C)(C)c1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)ccn1	1833369137	PFKYVOQOLSOVHT-UZLBHIALSA-N	427.904	1.984	50	20	IDGD	
CC[C@H](C)[C@H](O)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)Br)CC2)CC1	1833503754	ZGRFDBQIZNFRBH-VBQJREDUSA-N	432.403	1.748	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnc(C)nc3)CCO2)C1	1833817058	IJDIZVGBKRDYKT-MAUKXSAKSA-N	441.326	1.029	50	20	IDGD	
Cn1cncc1C(=O)NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1	1834243986	NFKCTSYFZGWANA-UHFFFAOYSA-N	426.359	1.390	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccc(F)c(F)c3)CCO2)C1	1835144389	USPRBOLRFGWSPH-YWZLYKJASA-N	446.878	1.218	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](OC(C)=O)C(C)C)CC2)CC1	1835650462	JZGYJKRPOWOVPX-MOPGFXCFSA-N	445.988	1.400	50	20	IDGD	
Cc1noc(C)c1CCC(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836715321	PLXVGCRLSNANTM-LJQANCHMSA-N	441.956	1.822	50	20	IDGD	
O=C(c1cnc2ccccn12)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836717541	XXDDACFEVIOFSU-SFHVURJKSA-N	434.924	1.546	50	20	IDGD	
CCn1nc(C(=O)N2CCOC[C@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)cc1C	1837715233	DHJUGSDTNMENSI-FQEVSTJZSA-N	438.601	1.133	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccnc(Cl)n3)C2)C1	1837715609	ZZAZRJVVONKUTO-GOSISDBHSA-N	442.976	1.052	50	20	IDGD	
O=C(c1ccnc2c1OCO2)N1CCC(OC2CCN(C(=O)[C@H](F)Cl)CC2)CC1	1838082232	DZQLDZFYKRHZPZ-INIZCTEOSA-N	427.860	1.957	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ncccc3F)CCO2)C1	1838252643	ZWGUWXFCSDZSEQ-SJKOYZFVSA-N	430.274	1.074	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(OC)cc3O)CCO2)C1	1838887701	RBXJTIOGKZCXNL-UTKZUKDTSA-N	440.924	1.878	50	20	IDGD	
Cc1ncccc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839197649	DQQSREAGSITSKC-RHSMWYFYSA-N	430.274	1.151	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccsc3)C2)C1	1839963411	JKZOVJGKFMLILS-PBHICJAKSA-N	431.352	1.992	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ocnc3C)C2)C1	1839963850	YKSYXMRJUMOULV-DYVFJYSZSA-N	430.299	1.227	50	20	IDGD	
COC(=O)C12CC(C(=O)N3CCO[C@@]4(COCCN(C(=O)C(C)(C)CCl)C4)C3)(C1)C2	1840004941	XDLXPKMPHNQZQR-XVAXZDLZSA-N	442.940	1.051	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(F)cc3F)C2)C1	1840153910	FPDLLKZLYSVIFR-DNVCBOLYSA-N	432.851	1.289	50	20	IDGD	
Cc1cc(NC(=O)CC(=O)N2CC3(CCCN3C(=O)[C@@H](C)CBr)C2)no1	1841286581	NUANHPXBLXYPMA-NSHDSACASA-N	427.299	1.546	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CCC[C@H](C(=O)N2CC3(CCCN3C(=O)[C@@H](O)CCl)C2)C1	1841354043	FQJSNULDDAFWOP-XHSDSOJGSA-N	443.972	1.873	50	20	IDGD	
CC[C@@H](C)[C@H](O)C(=O)N1CCCC12CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2	1841635271	MPJRQAVOHWTERB-ACJLOTCBSA-N	433.461	1.744	50	20	IDGD	
O=C([C@H](O)CCl)N1CC2(CCCN2C(=O)CCc2nc(-c3ccc(F)cc3)no2)C1	1842021366	UGZYZSRLTJHIJN-OAHLLOKOSA-N	436.871	1.611	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)c2cccc(O)n2)C1	1842450641	OBMQJYYMGFJNAV-UHFFFAOYSA-N	440.412	1.752	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)c2cccc(-c3ccccc3)n2)C1	1843480507	QXYODNHDILHZEZ-UHFFFAOYSA-N	435.528	1.939	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)CSc1ccccc1)C2	1844264019	UXODDHNZSYFXFD-UHFFFAOYSA-N	425.514	1.294	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H]1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](F)Br	1847959275	XBQZZVAAVCSUAL-RVMXOQNASA-N	434.306	1.888	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)c2ccc(NS(C)(=O)=O)cc2)c2ccccc2c1=O	11553719	CIAUMRSZAKBRAR-UHFFFAOYSA-N	443.485	1.424	50	20	IDGD	
COc1ccc([N+](=O)[O-])cc1C(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12	17197399	GCFGOZRKYVBXNP-UHFFFAOYSA-N	425.401	1.969	50	20	IDGD	
COc1cc(NC(=O)[C@H]2C[C@@H]2C)c(C(=O)NNC(=O)CNC(=O)c2ccco2)cc1OC	725740236	CWMWZVJEXIVBDJ-RYUDHWBXSA-N	444.444	1.082	50	20	IDGD	
CNC(=O)COc1ccc(C(=O)NNC(=S)Nc2ccc(OC)c(F)c2)cc1OC	727500261	VODCMFRNAHMEOO-UHFFFAOYSA-N	436.465	1.599	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNS(=O)(=O)c2cc(C(=O)O)n(C)c2)c1	728508194	JZAQHIHXCLCEKK-UHFFFAOYSA-N	432.252	1.118	50	20	IDGD	
Cn1ccnc1[C@@H](NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)c1ccccc1	728943672	AIPQVFZMVVNULI-SFHVURJKSA-N	434.504	1.547	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H](C(C)C)N2CCCCC2)c1	729295873	PISFZMILMYSMTF-LJQANCHMSA-N	438.594	1.989	50	20	IDGD	
CSCC[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)NNC(=O)Cc1ccccc1F	731345365	QDEGZJKIYZNJMR-KRWDZBQOSA-N	448.476	1.976	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNC(=O)NC2CCN(CCC(=O)N(C)C)CC2)cc1	731544451	WXMAZDFTRBKKML-UHFFFAOYSA-N	447.580	1.998	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)[C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])o2)o1	732062136	RERATFZEONYYNM-CQSZACIVSA-N	447.448	1.688	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2ccc(N3CCOCC3)nc2)cc1Br	732173920	MMYFXPJRRRDQMI-UHFFFAOYSA-N	435.278	1.764	50	20	IDGD	
CSCC[C@H](NC(=O)Cc1ccccc1)C(=O)NNC(=O)c1cccc(N(C)C)c1	732751048	IZPHYIODBLTYBA-IBGZPJMESA-N	428.558	1.994	50	20	IDGD	
Cc1nc2c(C(N)=O)cnn2c(C)c1CCC(=O)NNC(=O)c1cnn(-c2ccccc2)c1	733108336	MYAGNVMESJOOFN-UHFFFAOYSA-N	446.471	1.025	50	20	IDGD	
O=C(CNC(=O)NNC(=O)c1cnn(-c2ccccc2)c1)Nc1ccc(F)c(F)c1F	733336048	IKXPCXJGIAXYAU-UHFFFAOYSA-N	432.362	1.872	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)c1nn(-c2ccccc2)c2c1CCC2	734241943	XRRXKOOYBPTTCF-UHFFFAOYSA-N	428.493	1.830	50	20	IDGD	
C[C@H]1CN([C@@H](CNC(=O)NNC(=O)c2cnn(C)c2)c2c(F)cccc2Cl)CCO1	735580215	RYRAXPWKPYZEGY-LRDDRELGSA-N	438.891	1.619	50	20	IDGD	
Cn1cc(S(=O)(=O)N2CCC(NS(=O)(=O)c3ccc(CCCl)cc3)CC2)cn1	741256661	CVOBXVWDYPVJGB-UHFFFAOYSA-N	446.982	1.333	50	20	IDGD	
Cc1c(S(=O)(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cnn1-c1ccc(Cl)cc1	742025404	MMWHYAKBOVSZGU-KRWDZBQOSA-N	448.888	1.984	50	20	IDGD	
CC(C)c1nc(C(=O)NNC(=O)CCN2C[C@H](C)O[C@H](C)C2)nn1-c1ccccc1F	743289360	SCIXBLXKXMWSIQ-GASCZTMLSA-N	432.500	1.790	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@@H]2C[C@@H]2c2cccc(F)c2)cc1	743356448	MSHDFTNQJDBDSV-QZTJIDSGSA-N	434.493	1.641	50	20	IDGD	
CN1CCN(c2ccc(CNC(=O)NNC(=O)c3cccc(Br)c3)cn2)CC1	743528592	KQUPMEQINWXKDM-UHFFFAOYSA-N	447.337	1.740	50	20	IDGD	
COc1cccc(-c2noc([C@H](C)NC(=O)NNC(=O)[C@@H]3COc4ccccc4O3)n2)c1	743703152	IHSXPPVOTZMJKE-SJCJKPOMSA-N	439.428	1.977	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(N2CCOCC2)c(C(=O)NNc2ccc(Cl)nc2)c1	743816724	UIQZBFYPLFVAOO-UHFFFAOYSA-N	439.925	1.579	50	20	IDGD	
O=C(NNc1ccc(Cl)nc1)[C@H]1CCCN1S(=O)(=O)c1cccc([N+](=O)[O-])c1	743817979	JOADFIADJKUENL-CQSZACIVSA-N	425.854	1.940	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCc3c(cccc3N3CCOC3=O)C2)n1	744412811	SUSSHKXAYCYPFD-UHFFFAOYSA-N	429.502	1.156	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)Cn2cnc3sc(C)c(C)c3c2=O)c1	744559456	TWNZWOGNHAZKDM-UHFFFAOYSA-N	428.470	1.388	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1ccc(C(F)(F)F)nc1	744621052	MYRKVDGNHDTOTO-UHFFFAOYSA-N	430.408	1.878	50	20	IDGD	
CCc1nc(C(=O)OCC(=O)NNC(=O)Cc2nc(C)cs2)nn1-c1ccccc1F	745245415	YACVBJQIHLSWNC-UHFFFAOYSA-N	446.464	1.281	50	20	IDGD	
C[C@@]1(NNC(=O)NCCOc2ncc(C(F)(F)F)cc2Cl)CCS(=O)(=O)C1	745846159	DRTMVJYMSZTXKS-CYBMUJFWSA-N	430.836	1.514	50	20	IDGD	
CCO[C@@H]1C[C@@H](NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)C12CCC2	745851334	OVLVBSUVSLIKEX-WOJBJXKFSA-N	429.565	1.877	50	20	IDGD	
O=C(Cc1ccc2ccccc2c1)NNC(=O)NCCNS(=O)(=O)c1cccs1	747437235	FIVUHXYWEDBXEE-UHFFFAOYSA-N	432.527	1.753	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)c2ccc(S(=O)(=O)CCCC#N)cc2)nc2ccccc21	748214362	QLQIGZZLHAYQEG-UHFFFAOYSA-N	439.497	1.654	50	20	IDGD	
COC(=O)c1cc(OC)c(S(=O)(=O)NNC(=O)c2ccc(OC)c(OC)c2)s1	748791378	ROTUCWRTTDEUSC-UHFFFAOYSA-N	430.460	1.184	50	20	IDGD	
O=C(Cc1ccc(S(=O)(=O)N2CCOCC2)s1)NNc1cc(F)c(F)cc1F	748797641	VMOKHMTUXAWRLL-UHFFFAOYSA-N	435.449	1.872	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN1S(=O)(=O)c1cccs1)c1ccc(Cl)cc1O	749265913	OQAHOZPPARIJDX-LBPRGKRZSA-N	429.907	1.721	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cc3ccccc3o2)cc1	749478915	PBPXRTPCWHBQKX-UHFFFAOYSA-N	444.469	1.473	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)[C@@H]2CCCN2C(=O)c2ccc3c(c2)OCO3)c2ccccc21	749563921	OENRAUCHTPEZAO-SFHVURJKSA-N	434.452	1.973	50	20	IDGD	
CCCN(CC)c1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cn1	750862692	ICLDCWYTTORHRT-UHFFFAOYSA-N	433.534	1.643	50	20	IDGD	
NS(=O)(=O)c1cc(Cl)c(F)c(C(=O)NNC(=O)c2cc(Br)c[nH]2)c1	752267905	HRSDDYZRELTVMP-UHFFFAOYSA-N	439.650	1.292	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)c1c[nH]nc1-c1ccc2c(c1)OCO2	752702538	WLDJJKQIJFAEFD-UHFFFAOYSA-N	431.449	1.871	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@H](CC(C)C)N1CCCCC1=O	755050433	ZDKKHEGTNKBUMY-HNNXBMFYSA-N	437.566	1.476	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3cn(C)nc3C(F)F)cc2)CC1	755181118	FSKHTHVCYBHHGO-UHFFFAOYSA-N	428.465	1.051	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)n([C@@H]2CCS(=O)(=O)C2)n1	755529144	CEQCLYRRGAJGNM-JKSUJKDBSA-N	449.533	1.788	50	20	IDGD	
N#CCOc1cccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1	755931239	CMWICIHOAHYAQS-UHFFFAOYSA-N	443.485	1.840	50	20	IDGD	
CN1CCC/C1=N/S(=O)(=O)c1ccc(NC(=O)NNC(=O)Cc2ccncc2)cc1	756074337	XWZFATMITQHPGL-ULJHMMPZSA-N	430.490	1.290	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)NCCN2C(=O)[C@@H]3[C@@H](C2=O)[C@H]2C=C[C@H]3C2)c1C	756097733	QZDCPUOMHYAGBU-DZBHQSCQSA-N	440.500	1.208	50	20	IDGD	
CC(=O)N(C)c1ccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1	756262221	OYWGKXUNYSKQCB-UHFFFAOYSA-N	433.490	1.386	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)Nc2ccc(N3CCOCC3)c(F)c2)c2ccccc2c1=O	756335303	BZDFVMHXKOTUSP-UHFFFAOYSA-N	440.435	1.376	50	20	IDGD	
CN1CCCN(S(=O)(=O)c2cccc(NC(=O)NNC(=O)c3ccccc3F)c2)CC1	756357590	FOOLUESMUBBEPD-UHFFFAOYSA-N	449.508	1.618	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@H](C)c2ccc([S@@](C)=O)cc2)c2ccccc2c1=O	756736883	JFDXGSZNCTURBE-WAJSEHEASA-N	441.513	1.859	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1cc(Br)cc(C(F)(F)F)c1	756788287	CHGCKXDFWUWOAR-LURJTMIESA-N	447.233	1.558	50	20	IDGD	
COCCCNC(=O)NNC(=O)[C@H]1CCC(=O)N1Cc1ccc(Br)cc1	756814470	ZTMHVSJLCYKYJF-CQSZACIVSA-N	427.299	1.307	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)c2cccc3c2oc(=O)n3C)cc1	756859872	YYLMGIKGQOEDFT-UHFFFAOYSA-N	438.469	1.627	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)Cc1c(OC)cccc1OC	757159078	MKYMZRFQQOWPFM-UHFFFAOYSA-N	436.848	1.913	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)COc2ccc(C)cc2)ccc1S(=O)(=O)N(C)C	757776487	QLUYOAMTUSRXEX-UHFFFAOYSA-N	436.490	1.486	50	20	IDGD	
COCc1nc2n(n1)C[C@@H](NC(=O)NNC(=O)c1ccc(F)cc1Br)CC2	757791641	ZOPNGLDWZHFRTD-JTQLQIEISA-N	441.261	1.285	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)nn1CCC#N	757831477	RXFPOFMCFPAXAF-UHFFFAOYSA-N	445.505	1.356	50	20	IDGD	
COC(=O)C[C@H](C)C(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccc(OC)cc2)c1	758355427	TZUXUZYVGSSFNA-ZDUSSCGKSA-N	449.485	1.456	50	20	IDGD	
CC[C@@H](CN1CCCC1)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(CC)CC)c1	758844420	HYVOZSVRLFROAP-KRWDZBQOSA-N	439.582	1.536	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NC[C@@H](C[C@@H](C)O)c2ccccc2)nc1	759610507	MDTKCZWEKVVEFA-NVXWUHKLSA-N	435.550	1.949	50	20	IDGD	
C[C@H]1CN(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)C[C@H](c2ccsc2)O1	759747098	CTSUROPWXFVKPS-WMLDXEAASA-N	430.534	1.957	50	20	IDGD	
COC[C@@H](C)NC(=O)/C(C#N)=C/c1ccc(OCCn2cc(C(=O)O)nn2)c(Cl)c1	763113452	ILCVASQMCYFDMA-CWZJEYLYSA-N	433.852	1.767	50	20	IDGD	
CCOc1cc2c(cc1NC(=O)C(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)O[C@@H](C)C2	763466542	JEPRYGAQVFKMJV-NSHDSACASA-N	428.401	1.717	50	20	IDGD	
CC(C)NC(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c1	763469917	DUGRHKPRGCMKFW-UHFFFAOYSA-N	447.835	1.786	50	20	IDGD	
Cc1cnn(-c2ccc(C(N)=O)cc2NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2)c1	763505820	NQUXWYZGYSPZMW-UHFFFAOYSA-N	440.847	1.333	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(OC[C@@H]3CCCO3)cc2)cc1OC	763544263	UDLUJYQIUHMQHE-KRWDZBQOSA-N	443.456	1.661	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)cc1F	763686028	IQLANIWCOLGURP-UHFFFAOYSA-N	439.827	1.669	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(C(=O)NC2CC2)ccc1C	763711285	GOBMSWXQEVBNJI-UHFFFAOYSA-N	438.484	1.615	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2ccc(O[C@@H]3CCOC3)cc2)c1	763772881	PRQCBNCWNANMSC-MRXNPFEDSA-N	429.429	1.271	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2ccc(C(C)=O)c(C)c2)c2ccccc2c1=O	763785567	IGVGWWFZDPMDSM-UHFFFAOYSA-N	435.440	1.327	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)C(=O)Nc2cc(F)ccc2OC(F)F)c2ccccc2c1=O	763790515	JUXYUGSRNFCSAM-UHFFFAOYSA-N	449.345	1.074	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(F)c(Br)c1	763807731	FRSPTMAVSZNSIQ-UHFFFAOYSA-N	435.209	1.625	50	20	IDGD	
Cn1ccnc1Sc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)cc1	763838975	COBONOHMZJXVKY-UHFFFAOYSA-N	443.460	1.875	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccc(N2CCOC[C@H]2C)cc1	763852343	WRLOELAUXZYGJX-HUUCEWRRSA-N	444.463	1.604	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cccc(C(=O)N(C)C)c2)cc1	763861910	TVOWEVJIBALGDV-CQSZACIVSA-N	442.472	1.341	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1cccc(N2CCCCC2=O)c1	763864267	HRZYHYCUEBBISL-CQSZACIVSA-N	442.447	1.896	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)Cn2nc(C)cc2C)cc1OCC(F)(F)F	763891572	OOGBAWHZWFGYCK-UHFFFAOYSA-N	443.382	1.236	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(C(F)(F)F)cnc2O)cc1OC	763901071	FIXXITSSIMBHTN-UHFFFAOYSA-N	442.350	1.613	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(C(=O)NC)c2)cc1OC	763911926	SEOYYZAKMVGBEC-UHFFFAOYSA-N	428.445	1.243	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ccc(OC(C)C)c(OC)c2)ccc1C	763916359	NQJSHRNYBOZNIH-UHFFFAOYSA-N	443.456	1.977	50	20	IDGD	
COC(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)c1	763976137	RSCUXFQQAPEFIX-UHFFFAOYSA-N	426.212	1.885	50	20	IDGD	
O=C(NNC(=O)c1cc(Cl)ccc1O)C(=O)Nc1cccc(-c2nnnn2C2CC2)c1	763977468	ROEPFHOREGLORS-UHFFFAOYSA-N	441.835	1.434	50	20	IDGD	
Cc1ccc(Cn2nccc2NC(=O)C(=O)NNC(=O)c2cc(Br)cn2C)o1	764002387	LXNSBEKIVRVDNS-UHFFFAOYSA-N	449.265	1.334	50	20	IDGD	
O=C(Cc1ccc2ccccc2c1)NNC(=O)C(=O)Nc1ncn(Cc2ccccc2)n1	764085878	WIVXSSWDVFODSW-UHFFFAOYSA-N	428.452	1.808	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(N3CCO[C@H](C)C3)cc2)c1O	764131497	HKRGEVVNWMEHHN-CYBMUJFWSA-N	428.445	1.026	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1cccc(NC(=O)c2ccncc2)c1	764135454	GVEIKJIEQMANGX-UHFFFAOYSA-N	447.451	1.671	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2O1)C(=O)Nc1ccc(-n2cncn2)c(Cl)c1	764167791	MIXWHYRZUGVHSU-INIZCTEOSA-N	426.820	1.010	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)C(=O)Nc2ccc(C(N)=O)c(C)c2)c1	764231990	LQGRNKNYVSRJEH-UHFFFAOYSA-N	449.261	1.265	50	20	IDGD	
O=C(Cc1ccccn1)NNC(=O)C(=O)Nc1ccc(C(=O)N2CCc3ccccc32)cc1	764267097	NIALUXKJVRTGBH-UHFFFAOYSA-N	443.463	1.613	50	20	IDGD	
CC(C)(C)c1ccc(Cn2nccc2NC(=O)C(=O)NNC(=O)Cc2cccnc2)cc1	764267170	AFAZYYPSCPYGQJ-UHFFFAOYSA-N	434.500	1.953	50	20	IDGD	
C#CCOc1ccc(NC(=O)C(=O)NNC(=O)c2cc(F)ccc2Br)cc1	764270772	SXYSGZBCJAYYKT-UHFFFAOYSA-N	434.221	2.000	50	20	IDGD	
C[C@H]1CN(Cc2ccccc2NC(=O)C(=O)NNC(=O)Cc2ccccc2F)C[C@H](C)O1	764313321	KYIKHEQLXNILLO-HOTGVXAUSA-N	442.491	1.764	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C(=O)Nc1ccccc1SCCC(N)=O)c1ccccc1	764327540	ARSRAPAMFCHNKZ-HNNXBMFYSA-N	428.514	1.934	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc4c(c3)CN(C)C4)n[nH]2)cc1	764385154	TUVTZRIVVBWOGG-UHFFFAOYSA-N	432.484	1.984	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1ccc(-n2cccn2)c(F)c1	764397375	HUTZSRTVYPHFIM-UHFFFAOYSA-N	443.460	1.898	50	20	IDGD	
COc1nccnc1NNC(=O)CN1C(=O)N[C@](C)(c2ccc(Br)cc2)C1=O	764469223	DYMRGJAFYKLHBM-QGZVFWFLSA-N	449.265	1.158	50	20	IDGD	
COc1nccnc1NNC(=O)c1cc(C(C)C)nc2c1c(O)nc(=O)n2CC(C)C	764469567	FJAFHTHZABUIOR-UHFFFAOYSA-N	427.465	1.832	50	20	IDGD	
O=C(NNc1ccc(-n2cccn2)nn1)N[C@H]1CCN(c2ccc(Cl)c(F)c2)C1=O	764510855	DUUMSYRLTRXTCQ-AWEZNQCLSA-N	430.831	1.886	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)CSCC(=O)Nc2cc(C)on2)n[nH]1	765601269	JXLSTUFJZUASDM-UHFFFAOYSA-N	444.473	1.515	50	20	IDGD	
Cc1nn2cccnc2c1C(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	766663777	NPVWCOUNUYPONP-UHFFFAOYSA-N	441.923	1.270	50	20	IDGD	
O=C(Cc1n[nH]c2ccccc12)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	766664934	YGOBWPBAWINMAN-UHFFFAOYSA-N	440.935	1.724	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NCC(=O)NNC(=O)NCc1cccc(C(F)(F)F)c1	766837176	DNICBNPFNIHFGF-UHFFFAOYSA-N	447.414	1.177	50	20	IDGD	
COc1cc2c(cc1OC)CN(C(=O)CCC(=O)NNC(=O)c1ccc(C)cc1O)CC2	767885113	YTOLGBQMUALCRO-UHFFFAOYSA-N	441.484	1.844	50	20	IDGD	
CC(=O)N1CCN(S(=O)(=O)c2ccc(C(=O)NNc3ccc([N+](=O)[O-])cc3)cc2)CC1	768247412	RBOZANOTNQPFLQ-UHFFFAOYSA-N	447.473	1.205	50	20	IDGD	
CCCC(=O)N1CCC[C@@H](C(=O)NNC(=O)c2cc(-c3ccc(OC)c(OC)c3)[nH]n2)C1	768277945	UEPUXMYWZDSYLL-OAHLLOKOSA-N	443.504	1.894	50	20	IDGD	
NC(=O)c1cc(C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)nn1-c1ccccc1	768278681	JCVIKWAKZRBBDJ-UHFFFAOYSA-N	433.403	1.575	50	20	IDGD	
N#Cc1cc(Cl)nc(NNC(=O)[C@H]2CN(Cc3nc(O)c4ccccc4n3)CCO2)c1	768708403	XPEFOSLUBJLOQN-OAHLLOKOSA-N	439.863	1.600	50	20	IDGD	
Cn1ccnc1[C@@H](O)[C@@H]1CCCN(C(=O)NNC(=O)c2cc(Br)c[nH]2)C1	769950983	DKOQBOBNSWAZLG-MFKMUULPSA-N	425.287	1.311	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2ncoc2-c2ccc(F)cc2)ccc1Cl	770207171	BUMVUYIUARMUMK-UHFFFAOYSA-N	438.824	1.856	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)N1CC[C@H](C(=O)NCC(F)(F)F)C1	770646492	FKULJLBAMFAFQR-MNOVXSKESA-N	436.818	1.849	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1cccc(S(=O)(=O)N2CCCC[C@H]2C)c1	771938869	MKVQYEASPPGIMG-KGLIPLIRSA-N	425.507	1.352	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1ccc(S(=O)(=O)Nc2ccc(C)cc2)cc1	771966750	DHXFZEQQDFWOQU-CQSZACIVSA-N	433.486	1.899	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)[C@@H]1CCCN1C(=O)c1cc(Cl)ccc1OC	771996017	ZBVUQZODUIGTBV-FZMZJTMJSA-N	425.869	1.442	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)c1ccc(=O)n(-c2cccc(F)c2)c1	772187840	GXLLOTCKWBRGIK-UHFFFAOYSA-N	442.834	1.707	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2)cc1	773644081	YPQUBQIXGDBIDS-UHFFFAOYSA-N	435.462	1.707	50	20	IDGD	
O=C(NNC(=O)[C@H]1COCCN1CC(F)(F)F)c1ccc(COc2ccccc2)o1	773712417	IEARBDSYYSMXEZ-OAHLLOKOSA-N	427.379	1.883	50	20	IDGD	
Cn1ncc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1-c1ccccc1	775123390	FHVWQTXWKWOIFY-GOSISDBHSA-N	436.424	1.231	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)Nc2ccnn2[C@@H]2CCS(=O)(=O)C2)cc1	776059967	STDBTCGDECYKNQ-UKRRQHHQSA-N	449.489	1.066	50	20	IDGD	
COC1(CNC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)CCCCC1	776184397	BNEZWLQRCGIYCA-UHFFFAOYSA-N	438.550	1.764	50	20	IDGD	
Cc1cc(C)n2nc(C)c(C(=O)NN(C)C(=O)N3CCN(C(=O)OC(C)(C)C)CC3)c2n1	776206561	ULEOGGCCBZFJFN-UHFFFAOYSA-N	445.524	1.904	50	20	IDGD	
COc1cccc([C@H]2[C@H](C(=O)NNC(=O)COc3ccc(C#N)cc3)CC(=O)N2C2CC2)c1	776558190	NHWJYUMPBMFBRQ-OFNKIYASSA-N	448.479	1.845	50	20	IDGD	
COc1cc(C(=O)CCC(=O)NNC(=O)c2cncc(NC(C)=O)c2)cc(OC)c1OC	776981939	AMURUDMFDROBBU-UHFFFAOYSA-N	444.444	1.490	50	20	IDGD	
Cc1ccc(-n2cc(C(=O)N3CCN(S(=O)(=O)CBr)CC3)nn2)cc1	777777018	CDCPOTPBOSNABS-UHFFFAOYSA-N	428.312	1.016	50	20	IDGD	
COc1ccc2nc(NNC(=O)CCNS(=O)(=O)c3cn(C)c(C)n3)c(C)cc2c1	778481688	ZKAFARKOFHYEHO-UHFFFAOYSA-N	432.506	1.405	50	20	IDGD	
C[C@@H](C(=O)N(C)CC(=O)NNc1ccc([N+](=O)[O-])cc1Br)n1cccn1	779146291	VBMAZRWBTNSTRI-JTQLQIEISA-N	425.243	1.717	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)[C@@H](NS(=O)(=O)c1ccc(C)cc1)[C@@H](C)O)c1ccccc1	779515776	BKQMRXYBGOHGJU-MNEFBYGVSA-N	433.530	1.364	50	20	IDGD	
CC(=O)N1CCN(c2cccc(NC(=O)C(=O)NNC(=O)c3cccc(Cl)c3)c2)CC1	782121380	WRBRYXIXIJMQND-UHFFFAOYSA-N	443.891	1.408	50	20	IDGD	
CCN(CC)C(=O)CCC1CCN(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)CC1	782495889	ZULDDCPTKNWVKV-UHFFFAOYSA-N	442.524	1.377	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2cc(F)cc(Cl)c2)nc1	783262343	CPKXFCKKLPEUOR-UHFFFAOYSA-N	429.861	1.643	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2c(F)c(F)c(F)c(F)c2F)c1	783811844	YBBHUSRASLSOBB-UHFFFAOYSA-N	444.359	1.409	50	20	IDGD	
Cc1ccnc(NNC(=O)C(=O)Nc2ncn(Cc3cccc(Br)c3)n2)c1	783934503	SSNYBKQHKMRHOO-UHFFFAOYSA-N	430.266	1.874	50	20	IDGD	
Cc1cccn2cc(-c3ccc(NC(=O)C(=O)NNC(=O)C(=O)N4CCCC4)cc3)nc12	783996001	AJXMSCFQAVVUPQ-UHFFFAOYSA-N	434.456	1.018	50	20	IDGD	
COC(=O)c1cc(C(C)C)ccc1NC(=O)C(=O)NNC(=O)CNC(=O)c1cccs1	784003799	OYBJGEXVHQJHER-UHFFFAOYSA-N	446.485	1.174	50	20	IDGD	
COC(=O)c1csc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)c1	784216631	MBMRWMUGBHVUCE-UHFFFAOYSA-N	438.487	1.057	50	20	IDGD	
CCC(CC)NC(=O)[C@@H]1CN(C(=O)C(=O)NNc2nccnc2Cl)c2ccccc2O1	784780900	SFAMBLPTLHJUQV-HNNXBMFYSA-N	446.895	1.672	50	20	IDGD	
O=C(NNc1ccnc(Br)c1)C(=O)Nc1cccc(N2CCCNC2=O)c1	784836855	DKXZGAJGQJBLGO-UHFFFAOYSA-N	433.266	1.846	50	20	IDGD	
O=C(NNc1ccc(Cl)nc1)C(=O)Nc1cccc(S(=O)(=O)N2CCCCC2)c1	784869677	FPTTXXLHCNXPKX-UHFFFAOYSA-N	437.909	1.991	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)c(N(C)C)n1	785108679	UQCRYCMWAHTQQN-UHFFFAOYSA-N	432.431	1.708	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2ccc(N3C[C@H](C)O[C@@H](C)C3)nc2)n1	785226927	XJPKYUYRHVNGKK-GJZGRUSLSA-N	442.524	1.413	50	20	IDGD	
O=C(COC(=O)c1c2c(nc3ccccc13)CCC2)NNC(=O)[C@H]1COc2ccccc2O1	788410245	MCEKEMUHFKJQHZ-HXUWFJFHSA-N	447.447	1.868	50	20	IDGD	
COc1ccc(NNC(=O)[C@@H]2CC(=O)C[C@@H](C)[C@H]2C(=O)NNc2ccc(OC)cn2)nc1	791147441	ZMPUCJFHPNXZMW-SMNXXWJPSA-N	442.476	1.312	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc(-n2cccn2)c1	791962788	KVAJJYCGHGFJBB-UHFFFAOYSA-N	436.476	1.740	50	20	IDGD	
COc1ccc(OCC(=O)NN=C[C@@H]2CCCN(C(=O)CNC(=O)OC(C)(C)C)C2)cc1	794469013	QCHMGVGERAIZLC-INIZCTEOSA-N	448.520	1.939	50	20	IDGD	
CC(C)(C)OC(=O)N1CCOC[C@H]1CC(=O)NNC(=O)c1cnn(-c2ccccc2)c1	796435296	SWSGSDDEOICNJA-QGZVFWFLSA-N	429.477	1.659	50	20	IDGD	
Cc1cc(Cn2nnc(C(=O)OCC(=O)NNC(=O)c3ccc(Cl)cc3)c2C)on1	796522147	MWARNAIEZAKVNW-UHFFFAOYSA-N	432.824	1.203	50	20	IDGD	
CC(=O)N[C@@](C)(C(=O)NNc1cc(C#N)cc(Cl)n1)c1ccc(S(C)(=O)=O)cc1	797749671	XPTWOALZUDDPQM-GOSISDBHSA-N	435.893	1.505	50	20	IDGD	
CCOc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NNC(=O)c1cc(OC)cc(OC)c1	799257931	WQJXOQVBHOCZIW-UHFFFAOYSA-N	432.389	1.410	50	20	IDGD	
C[C@@H](NC(=O)CCc1ccccc1)C(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	799418564	BYDYRSSUKYOQMR-CQSZACIVSA-N	432.502	1.380	50	20	IDGD	
Cc1nn(C)c(Br)c1C(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	801506756	VFGWRQDIEKLVPD-UHFFFAOYSA-N	440.210	1.017	50	20	IDGD	
CCOC(Cn1cc(C(=O)NNC(=O)Nc2ccc(Br)cc2)nn1)OCC	801996518	KRHRYICONXBSLH-UHFFFAOYSA-N	441.286	1.906	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)[C@H](NS(C)(=O)=O)C(C)(C)C)cc1Cl	802075188	LXNUNZKMJBFXGB-ZDUSSCGKSA-N	436.918	1.474	50	20	IDGD	
CSC[C@H](C(=O)NNc1ccc(-n2ccnc2)nn1)N1C(=O)[C@@H]2CCCC[C@H]2C1=O	804955936	ZGCUZIGCJTXITE-MGPQQGTHSA-N	429.506	1.012	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)[C@H](c1cnn(C)c1)N(C)C(=O)OC(C)(C)C	806365678	SVUDBNWVLXXALS-SFHVURJKSA-N	446.508	1.596	50	20	IDGD	
COc1ccnc(NNC(=O)NCCNS(=O)(=O)c2cccc(Cl)c2Cl)n1	807455059	WAQARHGJOBDKLJ-UHFFFAOYSA-N	435.293	1.397	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)CCCn2c(C)cc(=O)cc2C)cc1	809983198	DAWSGRHAEJEWMH-UHFFFAOYSA-N	448.545	1.022	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)Nc1cnn(-c2ccc(F)cc2)c1C(F)(F)F	810322976	SISOHVBUMYCMKV-VIFPVBQESA-N	449.386	1.618	50	20	IDGD	
CC(C)Cc1noc(-c2cc(Cl)ccc2NC(=O)C(=O)NNC(=O)[C@H]2CCCO2)n1	815779040	PEYZCUICUDHLAN-CQSZACIVSA-N	435.868	1.853	50	20	IDGD	
CCCCCCOc1ccc(C(=O)NNC(=O)c2nc(N)nc(N3CCOCC3)n2)cc1	816830396	FSPBPAUYXKSZEC-UHFFFAOYSA-N	443.508	1.324	50	20	IDGD	
COC(=O)c1c(F)cccc1NNC(=O)[C@H](NS(=O)(=O)c1ccc(C)cc1)[C@H](C)O	819710282	DREOXNFNFLXQPN-YVEFUNNKSA-N	439.465	1.092	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNC(=O)c2cnc3c(c2)c(=O)n(C)c(=O)n3C)cc1	862045586	UBEVOXWPQFYDBQ-UHFFFAOYSA-N	439.472	1.132	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)[C@H]2CS[C@@H](Cc3ccccc3F)C(=O)N2)cc1C	888438408	YWLYTQNELVYPHF-MOPGFXCFSA-N	445.516	1.812	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)CCN2C(=O)[C@@H]3CCCC[C@H]3C2=O)cc1OC	913069821	PLDJPLGYGYXLDQ-HZPDHXFCSA-N	431.489	1.810	50	20	IDGD	
Cc1ccc(OCCC(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c(C)c1	914586387	ZJBKGEVKAWONTM-IBGZPJMESA-N	428.441	1.603	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)CNS(=O)(=O)c1ccccc1F	915787922	NIXWWABSINMNHW-AWEZNQCLSA-N	445.472	1.872	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)CS(=O)(=O)C2CCCC2)c2ccccc2c1=O	916129324	FEIJNGCZKHVRLZ-UHFFFAOYSA-N	448.545	1.705	50	20	IDGD	
COc1cccc(CCNC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c1	916382299	ZALCYKRKEWNORW-UHFFFAOYSA-N	425.533	1.780	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNS(=O)(=O)c2cc(F)ccc2C)cc1	917720782	LHMMZSYKXVEMPR-UHFFFAOYSA-N	429.495	1.073	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNS(=O)(=O)c2cccc(C(=O)NC3CC3)c2)cc1	917725940	XJPUCGFLMWFUCB-CQSZACIVSA-N	447.513	1.755	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NN=C1COc2ccc(F)cc21	918153925	UNMJFXZXCHTFQH-UHFFFAOYSA-N	447.488	1.692	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)NCc1cccc(CN2CCOCC2)c1	918223031	CKGCUNZLSROGFX-UHFFFAOYSA-N	426.517	1.991	50	20	IDGD	
O=C(CS(=O)(=O)c1cccc(Br)c1)NNC(=O)c1ccc(Cl)nc1	918597306	RUXIFBYCLJIKTF-UHFFFAOYSA-N	432.683	1.732	50	20	IDGD	
C[C@@H](Nc1ccc(C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)cc1[N+](=O)[O-])c1ccccn1	919693765	BXCKMXRMMYZKRN-TZMCWYRMSA-N	447.473	1.359	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)Cc1c(C)nn(C(F)F)c1C	920884309	GWEFFMJOJCMXTH-UHFFFAOYSA-N	428.465	1.500	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)Nc1ccnn1C[C@@H]1CCOC1	1325804626	ZQOJDWDYNDVFHW-LBPRGKRZSA-N	438.282	1.914	50	20	IDGD	
CN(NC(=O)c1cncc(OCC(F)F)c1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	1342979940	NKFGPVSUGFTNBD-UHFFFAOYSA-N	443.451	1.975	50	20	IDGD	
Cc1nc2ncccn2c1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1777901734	QJYNGIHYBSTDOK-CXAGYDPISA-N	440.273	1.172	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cn1ccccc1=O)C2)[C@@H](F)Br	1780771927	UMFYMXFQNYUNSG-MZMPZRCHSA-N	444.301	1.053	50	20	IDGD	
CC1=NN(c2ccc(C(=O)N3CC[C@@]4(C3)CN(C(=O)[C@@H](F)Cl)CCO4)cc2)C(=O)C1	1780795800	JGQWOOLROLQLPP-YLJYHZDGSA-N	436.871	1.777	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)COCCNC(=O)OC(C)(C)C)CCO2)C1	1781216829	OYBHPBLXWJNVOE-YWZLYKJASA-N	447.960	1.375	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)C3=NN(c4ccccc4)C(=O)C3)CCO2)C1	1781218513	NRJZRKQBVKIJAE-IERDGZPVSA-N	432.908	1.627	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cnc4cc(C)ccn4c3=O)CCO2)C1	1781218834	KGDKKSXENPBXFI-IERDGZPVSA-N	432.908	1.464	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCc2ccc(O)nn2)C1	1781466043	YFPHWMFXDWTGHA-IIBYNOLFSA-N	438.956	1.894	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCN1CCOCC1)C2	1781997665	CIQGJIQAZFUBHU-GPMSIDNRSA-N	446.386	1.006	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(CCN(C(=O)[C@@H]3CC(c4ccccc4)=NN3)C2)C1	1782602017	YHOZQDADKGXLND-PXNSSMCTSA-N	449.349	1.368	50	20	IDGD	
C=C(Oc1ccccc1O)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](C)Br)C2)C1	1783533903	BBGJOKXIGYSGSY-YJYMSZOUSA-N	439.306	1.898	50	20	IDGD	
COc1ccc([C@@H](O)C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)C(C)(C)CCl)[C@H]3C2)cc1	1783847219	HKBZYYTXKAGNQH-DSLXNQLJSA-N	438.952	1.973	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cc(Cl)cnc3OC)CCO2)C1	1783869320	OSBXWYARNAIIJO-RDTXWAMCSA-N	432.304	1.441	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3c(C)cc(C(N)=O)cc3C)CCO2)C1	1783877700	NMRGVQOBHAGIPL-KKSFZXQISA-N	437.924	1.100	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cncc(O)c3)C[C@@H]21	1783973815	DFCKQKWMKJEFKC-KNPMLCFXSA-N	426.311	1.412	50	20	IDGD	
COc1cccc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCBr)C[C@@H]32)n1	1785197641	TXNOTZOAICZXAB-BPUTZDHNSA-N	440.338	1.397	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(N4C(=O)C=CC4=O)cc3)C2)C1	1785222387	BBBFINOGHQDMSQ-JTSKRJEESA-N	445.903	1.577	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)CCc3c[nH]c4ncccc34)C2)C1	1785489017	YPURSYOVIDMQTE-LAUBAEHRSA-N	434.924	1.579	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ncc(Cl)cn3)[C@H]2C1	1785820462	QSWUASJOSGHLAW-QEJZJMRPSA-N	426.977	1.575	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3(C)CC3)[C@H]2C1	1786291909	RZQGFHAQULVOOL-VGWMRTNUSA-N	443.972	1.898	50	20	IDGD	
COCCn1nccc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(C)(C)CCl)C[C@@H]21	1787624052	BGPYAPHZMPGKQL-ZOBUZTSGSA-N	426.945	1.388	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC1(c2ccc(NC(=O)[C@@H](N)c3ccccn3)cc2)CCC1	1788042508	GTWFREIPASCOGJ-NRFANRHFSA-N	438.532	1.589	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1ccc(C2(NC(=O)c3ccncn3)CCC2)cc1	1789521370	AQHOLLYFKXWQEX-UHFFFAOYSA-N	431.456	1.537	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21)c1cc(O)cc([N+](=O)[O-])c1	1790216650	FIWAORCIFAGOFJ-HERUPUMHSA-N	432.260	1.697	50	20	IDGD	
O=C(NC1(c2ccc(NC(=O)[C@@H]3C[C@H]4CC[C@@H]3O4)cc2)CCC1)c1ccc(B(O)O)cc1	1791456076	OOAOTYNTAPWXFB-NJYVYQBISA-N	434.301	1.682	50	20	IDGD	
O=C(CCCn1ccnc1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21	1791567232	FULHKRMPKUCYJR-RZLSGREXSA-N	431.306	1.334	50	20	IDGD	
CCOc1ncccc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@](C)(Cl)CCl)C2	1792380494	WQMZEMLRUUIIRK-FCIKYMEBSA-N	430.332	1.920	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/c1ccc(O)cc1Cl)C2)[C@H](O)CCl	1792982498	FLULOLQTPCXIDU-SUYSFODASA-N	429.300	1.248	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCc1ccc(C)c(F)c1	1793310913	AGHSIMZUQIUBFX-CLWJZODNSA-N	426.916	1.910	50	20	IDGD	
O=C(CCc1cc(F)ccn1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2	1794026497	IZPWUNOVVUYUET-OXUXUCFPSA-N	432.265	1.433	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H]1CCC(=O)N1)C2	1794142760	NCFNUATZIJXKCR-KHMAMNHCSA-N	442.944	1.035	50	20	IDGD	
CCc1nn(C)c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](Cl)COC)C3)c1Cl	1794424864	BKEGANWRDINGKT-OXIQGZBJSA-N	433.336	1.093	50	20	IDGD	
Cc1nc(C)c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)CBr)C3)s1	1794696516	UOWLKJCBKSCGFB-WBMYTEFPSA-N	430.368	1.994	50	20	IDGD	
Cn1cnc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)/C(C#N)=C/c2ccc(F)cc2F)C3)n1	1794937661	FCOHUZBANVSTDU-RMWXTBGQSA-N	426.427	1.952	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCN1CCN(C)CC1	1795886523	HACKBEHAWKPFTL-YVSFHVDLSA-N	429.403	1.436	50	20	IDGD	
CC(C)Cc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCBr)C3)n(C)n1	1796016071	YAYOTIRWGIXQID-ZSBFGKGUSA-N	441.370	1.607	50	20	IDGD	
Cc1cc(C)cc(CCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)c1	1796192314	ZHUVVIHOCPGJQZ-NUNAXRQHSA-N	434.345	1.868	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC=C(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Cl)C1	1796365565	YZRBESHAFQWPDJ-QKPAOTATSA-N	445.919	1.678	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnn2ncccc12	1796709896	HMQWOZPKTBDIHP-LCFLCXBCSA-N	448.487	1.115	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1c[nH]c2ncccc12	1797392711	XOHIRAMBFVYAMP-CWNKPHDYSA-N	447.499	1.949	50	20	IDGD	
Cc1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)nc2ccccc12	1797512357	BNFHHSHLQFBDHU-ACDBMABISA-N	443.312	1.789	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](C)N1C[C@H]2C[C@@H]2C1	1798317884	UTQYOJRRQQFBGG-NYYKCLMLSA-N	440.548	1.099	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cn1cccc([N+](=O)[O-])c1=O)C2	1798628650	BMWVUXMYZSMUMQ-QDMKHBRRSA-N	436.541	1.246	50	20	IDGD	
COc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CO[Si](C)(C)C)C3)c(OC)c1	1798822612	CFJXQBBHTKUILQ-YVWYUNDQSA-N	436.581	1.759	50	20	IDGD	
C[C@@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1ccc(O)cc1	1799302227	KXKGOXZFYUCNFO-MIGXYKPQSA-N	429.286	1.776	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cnc3ccccn13)C2)[C@@H](F)Br	1799341997	BQHUGMXGWLGDHI-CZAMWMTLSA-N	439.285	1.157	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1n[nH]c(C3CC3)c1F)C2)[C@@H](F)Br	1799347741	RYXGKWQEIJILDZ-SZRLZVLASA-N	433.253	1.320	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc3c1OCCO3)C2)[C@@H](F)Br	1799347967	ZPWGUBJSPKCJKQ-YHYOWMERSA-N	443.269	1.352	50	20	IDGD	
CC[C@H](O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](Br)Cc1ccccc1	1800433383	IVUPHIMRJJZLGZ-ADHGMGHFSA-N	439.350	1.353	50	20	IDGD	
C[C@H](CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCC(=O)NN(C)C)C2)c1ccccc1	1800601410	RGTDPWLHODFLBZ-YQYRJILISA-N	430.549	1.143	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(OC)nc1)C2	1800640424	XJHYPCHRAITDQV-FQLMCAECSA-N	426.311	1.467	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Oc1ccccn1)C2	1800643965	ALVFLSAKDBMLQF-LFYQSXPISA-N	440.338	1.612	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnn(C(C)(C)C)c1)C2	1800757263	CATYZUYRKHPZHF-REBRKWNGSA-N	427.343	1.625	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Nc1ccccn1)C2	1800759567	WKSSXXDTXORYRN-AQDIXCGQSA-N	425.327	1.255	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(C(=O)OC)cc1C	1801912012	RNCQVMAUGAOSKF-MVJTYMMSSA-N	438.908	1.239	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc(F)c1[N+](=O)[O-])C2	1802337936	IFJLYOCREIXWBN-BTTYYORXSA-N	435.456	1.359	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H]2Cc3ccccc3CN2)[C@@H]1c1cccnc1)[C@H](O)CCl	1803138583	CRPRJQVFHHXKCZ-DOIPELPJSA-N	442.947	1.402	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2nnsc2C2CC2)[C@H]1c1cccnc1)[C@@H](O)CCl	1803139474	PZIIXTHFSAGGSW-DZKIICNBSA-N	435.937	1.730	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)C2=CCCS2)[C@@H]1c1cccnc1	1803639729	IQDVOCLSSOVCBU-UZLBHIALSA-N	431.562	1.481	50	20	IDGD	
CCOc1cnc(C(=O)NC[C@@H]2CCN(C(=O)[C@H](Cl)COC)[C@H]2c2cccnc2)cn1	1804919634	MQQWEXFUULBKRL-FCEWJHQRSA-N	447.923	1.844	50	20	IDGD	
CC(=O)NC[C@H]1CCN(C(=O)CN(C)NC(=O)NCc2ccccc2)[C@@H]1c1cccnc1	1806718583	HNGHDAXCFUNELC-IFMALSPDSA-N	438.532	1.454	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@@H](CNC(=O)CN)[C@H]1c1cccnc1	1807029405	PSRDEWRTZBBGJV-YQQAZPJKSA-N	439.944	1.178	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)cn1C	1807363435	ORHCMRPGPVDDOX-UGKGYDQZSA-N	446.316	1.042	50	20	IDGD	
Cc1[nH]ccc1C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1807375451	PFMCBYPYWRSUOS-NQIIRXRSSA-N	432.289	1.031	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)CNC(=O)c2cccnc2)[C@@H]1c1cccnc1	1808252175	ZHUFPVVKNIBPRL-XKGZKEIXSA-N	443.935	1.930	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1808259643	LPHMXHRGXNRRCW-YTQUADARSA-N	429.713	1.098	50	20	IDGD	
CCn1nc(C)cc1C(=O)N1CCCC2(CCN(C(=O)CCC(=O)NN(C)C)CC2)C1	1810539788	WWSXWTFITVSBKZ-UHFFFAOYSA-N	432.569	1.429	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)Cn2ccnn2)[C@H]1c1cccnc1	1812777953	ZNLDFRVWROOQFD-ZOBUZTSGSA-N	435.326	1.553	50	20	IDGD	
C[C@H](Cc1ccccn1)C(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1	1813287806	XFWSYKOJRWKVQE-MCYKXBRJSA-N	430.936	1.961	50	20	IDGD	
Cc1ccc(CC(=O)N[C@@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)o1	1815347709	LLAFDCQOUIBZSB-OAHLLOKOSA-N	439.302	1.193	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H]2CCCO2)n[nH]1	1817655972	HKCAKZAJDMPZME-XKHFHUKESA-N	441.492	1.715	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3cnn4cccnc34)sc2C1	1818991674	NKIAQAIQWGLRAC-CMPLNLGQSA-N	434.909	1.665	50	20	IDGD	
CCOC(=O)N[C@@H](O)C(=O)Nc1cc([C@H]2CCCCN2C(=O)C(C)(C)CCl)[nH]n1	1819238005	OXUIRWWFBAFVAE-DOMZBBRYSA-N	429.905	1.731	50	20	IDGD	
CCNC(=O)N[C@@H](C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CO[Si](C)(C)C)n[nH]1	1819595321	HSPSWGJHAYAWPF-DZGCQCFKSA-N	438.605	1.961	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H]1CCC=CO1)CC2	1819797836	MBNYZIDGICJIND-IAQYHMDHSA-N	442.501	1.060	50	20	IDGD	
Cc1cc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@@H](O)CCl)CC3)n(C(F)F)n1	1821567612	PWIIQULXPFKQMB-KWQFWETISA-N	433.868	1.869	50	20	IDGD	
Cc1cc(C)cc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cccc(B(O)O)c2)CC3)c1	1822155188	KODNOGZQTYKMDG-SFHVURJKSA-N	449.341	1.979	50	20	IDGD	
Cc1cnn([C@@H](C)C(=O)Nc2cc([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)c1	1822750493	CGHUZWBLMDAJDA-RDJZCZTQSA-N	444.540	1.541	50	20	IDGD	
CC[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H]1CCC(=O)N1C)CC2	1825452026	UXPRDBXVXKPILI-UMNHJUIQSA-N	443.367	1.849	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H]1CCC(=O)N1C)CC2	1825646059	OHYDUNBMYMRADW-KKZNHRDASA-N	429.340	1.459	50	20	IDGD	
Cc1nc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)co1	1825953751	LKJSSYFLHAACIW-FQEVSTJZSA-N	425.294	1.210	50	20	IDGD	
O=C(c1[nH]cc2c1CCC2)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827057897	MLERSZLYRMNDRA-JOCHJYFZSA-N	449.360	1.730	50	20	IDGD	
C[C@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1)n1cccc1	1827060454	JDVFCELMFQNGCW-XMSQKQJNSA-N	437.349	1.662	50	20	IDGD	
O=C1CCc2ccc(C(=O)N3CCCC[C@H]3C3CCN(C(=O)[C@@H](O)CCl)CC3)nc2N1	1827394683	TUGHXXPEYONVCB-ROUUACIJSA-N	448.951	1.799	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccnc2)CC1	1828926001	WXROAMNZYUMTPG-HXUWFJFHSA-N	436.516	1.627	50	20	IDGD	
Cc1nc2ncccn2c1C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830362362	SCRXPKUTVKJULO-NRFANRHFSA-N	449.939	1.373	50	20	IDGD	
COc1cc(C#N)cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)c1	1830364688	PSFLTXHEXANOJK-QFIPXVFZSA-N	449.935	1.902	50	20	IDGD	
C[C@@H](Oc1ccccn1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830370510	SHUQILIUXXXBDW-IIBYNOLFSA-N	439.940	1.570	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(F)(F)Cl)C2)C1	1830544245	RIXPDWNHTSXLIT-GWCFXTLKSA-N	433.677	1.305	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3noc(C)c3C)CCO2)C1	1831984216	FKKPWCYXSAZQLT-KDOFPFPSSA-N	444.326	1.535	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3coc(C)n3)CCO2)C1	1834213987	XQTVKCSRLZJOFO-SUMWQHHRSA-N	430.299	1.227	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cncc(F)c3)CCO2)C1	1834361168	MCOWBZPLDZPMKV-YVEFUNNKSA-N	430.274	1.074	50	20	IDGD	
Cc1nc(F)ccc1C(=O)N1CCOC[C@@]2(CN(C(=O)CCBr)CCO2)C1	1834823125	JYDNNWLNUUYJRC-GOSISDBHSA-N	444.301	1.384	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3nc[nH]c3[N+](=O)[O-])CC2)CC1	1835103029	BIFATFNBHBKMOL-CQSZACIVSA-N	426.905	1.521	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3ccc4ncnn4c3)CC2)CC1	1835633175	RTIJQWHYQFOBMN-SFHVURJKSA-N	448.955	1.168	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC(N2CCC(NC(=O)c3ccc(O)nc3)CC2)CC1	1836142629	JQPRTRWMPNEDDS-UHFFFAOYSA-N	434.613	1.824	50	20	IDGD	
C[C@@H](Nc1ccccc1)C(=O)N1CCO[C@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1	1837338405	KIBXYWRLJVXEHB-GCJKJVERSA-N	449.624	1.795	50	20	IDGD	
C/C(=C\c1ccc(C)o1)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1	1837575853	FWQKZHJQUKOHIM-OHVBHTQWSA-N	426.897	1.047	50	20	IDGD	
Cc1noc(CC(=O)N2CCC(OC3CCN(C(=O)CCBr)CC3)CC2)n1	1837653487	GEVHTOGUFZWNOA-UHFFFAOYSA-N	443.342	1.704	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)Cc3nnc(C)o3)CC2)CC1	1837940559	YGXMVKSMONTJQT-INIZCTEOSA-N	428.917	1.173	50	20	IDGD	
CN1CCN(C2(C(=O)N3CCC(OC4CCN(C(=O)[C@H](F)Cl)CC4)CC3)CC2)CC1	1838083940	HSIUXPOWQFIMNR-SFHVURJKSA-N	444.979	1.299	50	20	IDGD	
CN(C)c1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)cc1	1838963004	DGVOTSXLVWSHFL-QFIPXVFZSA-N	449.624	1.674	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cncc(F)c3)C2)C1	1839150931	CHTCDBLIJQBXTC-ZWKOTPCHSA-N	434.295	1.527	50	20	IDGD	
Cc1nc(F)ccc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2	1839153783	SGXIVCDMMQJETP-OALUTQOASA-N	448.322	1.835	50	20	IDGD	
C[C@H](Cn1ccnc1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2	1839155032	GWHZAPQNQXPVDX-LZQZEXGQSA-N	447.363	1.212	50	20	IDGD	
Cc1ncsc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839198225	XFVHYUIMPYASKN-IUODEOHRSA-N	436.303	1.212	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc4nn[nH]c4c3)CCO2)C1	1839628173	SQOVQRRSQXIEJK-QRWLVFNGSA-N	435.912	1.435	50	20	IDGD	
CC(C)C(=O)N1CCOC[C@@]2(CN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)CCO2)C1	1839743303	IYDSEFWFBYRTSB-IXNCKXOBSA-N	433.455	1.984	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ncc(F)cc3F)C2)C1	1840030547	PAIZBZZFVZSKAI-GTNSWQLSSA-N	448.264	1.213	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)C3CCSCC3)C2)C1	1840035933	KYCORZLUWROFCP-SUMWQHHRSA-N	435.384	1.369	50	20	IDGD	
O=C([C@@H]1CCc2ccccc2O1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1840136649	HBAUEOOZXOFILF-ZWOKBUDYSA-N	426.872	1.371	50	20	IDGD	
COC1(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)CBr)C3)C2)CCC1	1840615180	ALCCWYUDYDEMEB-BEFAXECRSA-N	447.370	1.433	50	20	IDGD	
Cc1cc(Cl)cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)c1	1840696471	SFCILCGDUKWDGF-VQIMIIECSA-N	431.316	1.318	50	20	IDGD	
Cc1ccc(S(=O)(=O)CC(=O)N2CCCC23CN(C(=O)[C@H](C)Br)C3)cc1	1842759053	XGAOJOIMUXGAGC-AWEZNQCLSA-N	443.363	1.756	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1	1843442785	WTKZSJTVQPYPBO-CYBMUJFWSA-N	433.306	1.766	50	20	IDGD	
Cc1cn2c(=O)c(C(=O)N3CCCC34CN(C(=O)[C@H](C)Br)C4)cnc2s1	1843785910	GXNOVETZGRARMF-NSHDSACASA-N	439.335	1.665	50	20	IDGD	
Cc1nc2ccncc2cc1C(=O)N1CC2(CCCN2C(=O)c2cnccc2C(=O)NN)C1	1844264313	FPOBHKOYJKGXGS-UHFFFAOYSA-N	445.483	1.068	50	20	IDGD	
COc1cc(OC)c(F)c(C(=O)N2CCCC23CN(C(=O)CCC(=O)NN(C)C)C3)c1	1844708233	JPCJZWPJZDBLGL-UHFFFAOYSA-N	436.484	1.033	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)c2c(Cl)ccc(Cl)c2O)C1	1845477197	DDVZUNARJSYZDX-UHFFFAOYSA-N	443.331	1.889	50	20	IDGD	
CC(C)[C@H](CC(=O)N1CCCC12CN(C(=O)[C@@H](O)CCl)C2)NC(=O)OC(C)(C)C	1846293201	AHFJRVBWYXJMSG-GJZGRUSLSA-N	431.961	1.729	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)Cc1cccnc1Cl	1848135939	UMRYQLYLGGXQDI-QVICEKFBSA-N	442.907	1.613	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1ccc2c(c1)C[C@H](c1ccccc1)OC2=O	10302004	RAQVLJPAWBLRTE-CRAIPNDOSA-N	428.466	1.337	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNS(=O)(=O)c2ccc3c(c2)CCN3C(C)=O)cc1	15245259	PPRYGCDRQWPVNY-AWEZNQCLSA-N	447.513	1.771	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COc2ccccc2F)cc1S(=O)(=O)NC(C)C	15889614	YQYCFWWURVOODV-UHFFFAOYSA-N	439.465	1.361	50	20	IDGD	
COc1ccc(-c2nc(C)c(C(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)s2)cc1OC	16786325	ODZNXYIBNHFVSA-LBPRGKRZSA-N	439.515	1.331	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2c(C)nc3ccccn23)cc(S(=O)(=O)N(C)C)c1C	17581992	OQPBQNVNOJAIID-UHFFFAOYSA-N	429.502	1.585	50	20	IDGD	
COc1ccc(-c2nnc(S)n2CC(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)cc1	24298078	YMKGGTFVNXHXDD-GFCCVEGCSA-N	445.476	1.996	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CSc2nncn2-c2ccccc2F)cc1OC	25101168	GMYNVLWBQZKFNS-UHFFFAOYSA-N	431.449	1.977	50	20	IDGD	
C#CCNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cc3c(s2)CC[C@H](C)C3)cc1	27331879	AKSPSMGXFAZYJF-ZDUSSCGKSA-N	431.539	1.859	50	20	IDGD	
COc1ccc(C)cc1CN1CCN(CC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)CC1	29193255	BIHCHTDCPWWTKH-UHFFFAOYSA-N	441.488	1.491	50	20	IDGD	
CN(CCc1ccccn1)C(=O)CNC(=O)NNC(=O)CCSc1ccc(F)cc1	727608107	MHXYIHMSYPGWAM-UHFFFAOYSA-N	433.509	1.734	50	20	IDGD	
COc1ccc(C(=O)Oc2ccc(C=NNC(=O)[C@@H](C)NS(C)(=O)=O)cc2OC)cc1	728436814	SWLSUJZRUUTBKY-CYBMUJFWSA-N	449.485	1.311	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)n1	728721828	IFFVAYCQOCBVPU-UHFFFAOYSA-N	444.429	1.092	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)[C@@H]1CSCN1C(=O)c1ccc(Cl)cc1	729180464	BHZCMMDKNPURHC-ZDUSSCGKSA-N	436.877	1.026	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N(C)CC(=O)N1CCCC1	729222809	STYKPWKZYBUCSX-GFCCVEGCSA-N	427.299	1.511	50	20	IDGD	
CCC(CC)N1C[C@H](C(=O)NNC(=O)c2ccc(CSc3nncn3C)cc2)CC1=O	729297053	RPBGIFPXPBOVQF-MRXNPFEDSA-N	444.561	1.906	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)NNC(=O)c1c(F)ccc(S(=O)(=O)NC2CC2)c1F	729836285	XFWVQMMCDGREHX-UHFFFAOYSA-N	448.451	1.891	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)NCCS(=O)(=O)N2CCSCC2)c1C	730499637	CLDPHHVABURZMV-AQTBWJFISA-N	440.591	1.153	50	20	IDGD	
O=C(NNS(=O)(=O)c1csc(-c2ccccc2)n1)C1CCN(c2ncccn2)CC1	730512640	IZRFJEXSJWIJOT-UHFFFAOYSA-N	444.542	1.826	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)[C@@H]2CCCN(S(=O)(=O)Cc3ccccc3)C2)c1O	730590375	RAKZGBQAKJBVIB-MRXNPFEDSA-N	447.513	1.404	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)COc1ccccc1O)c1ccc(S(=O)(=O)N(C)C)cc1	730903712	PLGAZVGGVXDTTC-CYBMUJFWSA-N	436.490	1.113	50	20	IDGD	
CN(C)C(=O)CCN1CCC(NC(=O)NNC(=O)CSc2ccc(Cl)cc2)CC1	731543862	OSRBLPNBJGJFPZ-UHFFFAOYSA-N	441.985	1.705	50	20	IDGD	
Cc1cccc(-c2nnc(S)n2CCC(=O)NNC(=O)CCN2C[C@H](C)O[C@H](C)C2)c1	732261874	GJWUNQLPASRXRJ-IYBDPMFKSA-N	446.577	1.579	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)c2c(C)n[nH]c2n1	734825475	HEUAWFAAWSENFX-UHFFFAOYSA-N	431.497	1.918	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@H]2CCC[C@H]2NC(=O)OC(C)(C)C)c2ccccc2c1=O	739679126	PHVYPAIQIGENEP-JKSUJKDBSA-N	443.504	1.871	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)CCc1nc(O)c2c3c(sc2n1)C[C@@H](C)CC3	740853318	NWYGUGPXQCFSCI-NSHDSACASA-N	447.561	1.907	50	20	IDGD	
Cc1nn(C)c2sc(C(=O)N[C@H](C)C(=O)NNC(=O)[C@H](C)Oc3ccccc3F)cc12	742037258	VMYMEJBWKHMCFQ-NEPJUHHUSA-N	447.492	1.816	50	20	IDGD	
CC(C)CCn1c(=O)c2ccccc2n2c(SCC(=O)NNC(=O)C3CC3)nnc12	742445051	JNFHGMFUCWZPNS-UHFFFAOYSA-N	428.518	1.740	50	20	IDGD	
CC(=O)N[C@@H](CC(=O)NNC(=O)CCN1C[C@H](C)O[C@H](C)C1)c1ccc(F)cc1F	743291550	QVMHEEAFKQTYAR-JCGVRSQUSA-N	426.464	1.179	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N[C@H](C)CN2CCN(c3ccccc3)CC2)cc1OC	743520163	DRVBEYQGDRQXKS-QGZVFWFLSA-N	441.532	1.859	50	20	IDGD	
COc1cccc(-c2noc([C@H](C)NC(=O)NNC(=O)[C@H]3COc4ccccc4O3)n2)c1	743703154	IHSXPPVOTZMJKE-YVEFUNNKSA-N	439.428	1.977	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2ccc(N(C)C)cc2)cc1S(=O)(=O)N(C)C	743827186	YTUNPPWOUMKUHW-UHFFFAOYSA-N	435.506	1.478	50	20	IDGD	
O=C(CCn1cnc2ccccc21)NNc1ccccc1S(=O)(=O)N1CCOCC1	744619553	SFOQAVZBVZOZPT-UHFFFAOYSA-N	429.502	1.591	50	20	IDGD	
CCN(CCCNC(=O)NNC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)OC(C)(C)C	745604245	FJMDKRYRMFXDBC-UHFFFAOYSA-N	425.442	1.892	50	20	IDGD	
COc1cc(C(=O)NNC(=O)N[C@H]2C[C@H](C)N(c3cnn(C)c3)C2=O)ccc1OC(C)C	745916136	BACARLQJOCWSGE-BBRMVZONSA-N	444.492	1.354	50	20	IDGD	
CC[C@@H]1Oc2cc([C@H](C)NC(=O)NNC(=O)COc3ccccc3O)ccc2NC1=O	745934066	YMBGBMHKCMXORW-LRDDRELGSA-N	428.445	1.972	50	20	IDGD	
CC(C)c1nc(C#N)c(NNC(=O)c2cccc(S(=O)(=O)NC[C@H]3CCCO3)c2)o1	746339113	HPTKKKUXWJKMGN-CQSZACIVSA-N	433.490	1.884	50	20	IDGD	
CCO[C@@H](CCNC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1)C(C)C	746421456	QWLUCDHXSLGZTF-KRWDZBQOSA-N	428.555	1.397	50	20	IDGD	
COC(=O)c1ccsc1N1CC[C@@H](NC(=O)NNC(=O)Cc2ccccc2OC)C1=O	746779565	JKYSMDNRJPKKRF-CQSZACIVSA-N	446.485	1.222	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)N1CC[C@]2(CCCN(Cc3ccccc3)C2)C1	747501981	HKSUJXWKVVDDOH-QHCPKHFHSA-N	439.516	1.738	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@@H]3CCCN3C3CCCC3)CC2)cc1	749258391	LFXYXXGBPJSLFU-QFIPXVFZSA-N	427.593	1.667	50	20	IDGD	
C[C@]1(c2ccc(C(=O)NNc3nc(Br)cn4ccnc34)cc2)NC(=O)NC1=O	751069892	DZJDZOVONZQKMM-QGZVFWFLSA-N	444.249	1.303	50	20	IDGD	
COC(=O)COc1c(C)cc(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1C	752309984	JAOUXSIBEZGHKH-UHFFFAOYSA-N	441.488	1.323	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cccc2)nc1)c1ccc(S(=O)(=O)N2CCCC2)cc1	753276455	JEGCLTPRXORYKI-UHFFFAOYSA-N	439.497	1.732	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)[C@H](c1cc(Cl)cc(Cl)c1)N1CCOCC1	753604986	IHJSZFDEKKUQNR-INIZCTEOSA-N	445.347	1.819	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NN=c2sc3ccccc3n2C)c(C)c([N+](=O)[O-])c1	753842757	XYWITRHZXQLLLS-UHFFFAOYSA-N	443.441	1.814	50	20	IDGD	
O=C(CCc1cccc([N+](=O)[O-])c1)NNc1ccccc1S(=O)(=O)N1CCOCC1	755427693	IKKJPBPEHRYXIU-UHFFFAOYSA-N	434.474	1.692	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)Nc1ccc(C(=O)N2CCOCC2)cc1	755932528	AZEODLXFPMOMHF-UHFFFAOYSA-N	436.266	1.716	50	20	IDGD	
CCN(CC)CCOc1cc(NC(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)ccc1OC	756279418	CRVMZPVWEGIEBP-AWEZNQCLSA-N	442.538	1.003	50	20	IDGD	
CN1C(=O)CCc2cc(NC(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)ccc21	756418845	RAZWORAASFBGPD-UHFFFAOYSA-N	445.501	1.312	50	20	IDGD	
COc1ccc(S(=O)(=O)NC(C)(C)C)cc1NC(=O)NNC(=O)c1ccccc1O	756671863	JWBWMPLDCLKUKW-UHFFFAOYSA-N	436.490	1.944	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)[C@](C)(O)CN2Cc3ccccc3C2=O)c1C	756796332	HYAJBFZOTQPROK-QMHKHESXSA-N	425.485	1.625	50	20	IDGD	
Cc1nc(-c2cccc(C(F)(F)F)c2)[nH]c1C(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1	756951098	YCIOWKJBCNQUFN-LBPRGKRZSA-N	445.423	1.535	50	20	IDGD	
Cc1nc(Cl)cc(NNC(=O)c2cc(Br)cc(S(N)(=O)=O)c2C)n1	757388061	MUNJLNYRGGBZBH-UHFFFAOYSA-N	434.703	1.914	50	20	IDGD	
Cc1cc(N2C[C@H](C(=O)NNc3ccc(C(N)=O)nn3)CC2=O)ccc1Br	757406518	CDNVRBZIQADHGW-SNVBAGLBSA-N	433.266	1.143	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(F)(F)[C@H](C(=O)NNC(=O)CNC(=O)c2ccco2)C1	757909563	PXCRPIUCRCYPPO-NSHDSACASA-N	430.408	1.049	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)Nc2cnc3c(c2)C[C@H](NC(=O)OC(C)(C)C)CC3)cn1	757929446	UIAGRSFNXPWESO-CQSZACIVSA-N	429.481	1.664	50	20	IDGD	
COCC(=O)N(C)CC(=O)NNC(=O)c1ccc(CSc2nc3ccccc3[nH]2)cc1	758050859	JFOUJWZNNMUHAR-UHFFFAOYSA-N	441.513	1.721	50	20	IDGD	
O=C(N1CCN(S(=O)(=O)CBr)CC1)C(F)(F)c1c(F)cccc1F	758514100	ZKQFDVHLVBQWFM-UHFFFAOYSA-N	433.221	1.883	50	20	IDGD	
Cc1cc(S(=O)(=O)NNC(=O)CNC(=O)c2cccs2)cc(C(=O)O)c1Cl	759096769	JZOIHPNADXXRRC-UHFFFAOYSA-N	431.879	1.148	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2ccc(Cl)c(S(C)(=O)=O)c2)n1	761432036	WQGSVWVRARTVAN-UHFFFAOYSA-N	445.906	1.055	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)c1ccc(S(N)(=O)=O)c(Cl)c1	761636508	IVVBMIZMASBSOD-UHFFFAOYSA-N	429.907	1.549	50	20	IDGD	
Cc1c(C(=O)NNc2nccc(N3CCOCC3)n2)nnn1-c1cccc2cnccc12	762859517	DQLGUUMBKOBVSC-UHFFFAOYSA-N	431.460	1.507	50	20	IDGD	
Cc1cc(S(C)(=O)=O)ccc1NC(=O)C(=O)NNC(=O)c1ccc2ccccc2n1	763449883	IGAKDVIKPXNBRV-UHFFFAOYSA-N	426.454	1.346	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1cc(F)cc(N2CCOCC2)c1	763630111	WPNAEKICJQMHIY-UHFFFAOYSA-N	440.435	1.018	50	20	IDGD	
Cc1nc(C)n(-c2ccccc2NC(=O)C(=O)NNC(=O)COc2ccccc2F)n1	763678632	FRDGUQXSZICWCZ-UHFFFAOYSA-N	426.408	1.188	50	20	IDGD	
COCCn1ncc2ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc3ccc(F)cc3)cc21	763870648	AVWNJNCGBVUFIL-CYBMUJFWSA-N	443.435	1.375	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1cccc(Cl)c1-n1cncn1	763872209	MBGAUVRYTJHCMZ-LLVKDONJSA-N	446.826	1.613	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc(OC2CCOCC2)c(C)c1	764040393	GSGCBUFWJIVXHB-UHFFFAOYSA-N	427.457	1.961	50	20	IDGD	
O=C(NNC(=O)C1CCCC1)C(=O)Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1	764066698	RQJGPRWNQHAPPB-UHFFFAOYSA-N	436.534	1.527	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)CC)cc1S(=O)(=O)N(CC)CC	764083276	QBNNQQAQXXCHBV-CYBMUJFWSA-N	442.538	1.248	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1cc(N2CCOC2=O)ccc1C	764139232	PDBMMTGIVWZKFO-UHFFFAOYSA-N	426.429	1.289	50	20	IDGD	
COc1ccc(NC(=O)c2cccc(NC(=O)C(=O)NNC(=O)CC(C)(C)C)c2)cn1	764198221	FCDMXLBOPUFWRM-UHFFFAOYSA-N	427.461	1.865	50	20	IDGD	
CC(C)(C)CC(=O)NNC(=O)C(=O)Nc1cnc2c(c1)C[C@@H](NC(=O)OC(C)(C)C)CC2	764199856	YDCJWRCUVZVUCW-AWEZNQCLSA-N	447.536	1.986	50	20	IDGD	
CNC(=O)c1cc(NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)ccc1Cl	764240016	XPIFFLHDASFWRJ-UHFFFAOYSA-N	427.848	1.440	50	20	IDGD	
CSc1nnnn1-c1cccc(NC(=O)C(=O)NNC(=O)c2cccc3ncccc23)c1	764257980	RQOVYULKKWSAAB-UHFFFAOYSA-N	448.468	1.332	50	20	IDGD	
O=C(Cc1cc[nH]n1)NNC(=O)C(=O)Nc1cccc(OCc2ccc(Cl)cc2)c1	764286406	UOXIBBBOJMIPRV-UHFFFAOYSA-N	427.848	1.971	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)C(=O)Nc1cccc(OC[C@@H]2CCCO2)c1	764351015	NVYVGUDCHVSEFG-FQEVSTJZSA-N	449.467	1.830	50	20	IDGD	
C[C@@H]1COCCN1c1ccc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)cc1	764369576	IGEIIKNQLTYPBJ-CQSZACIVSA-N	448.426	1.669	50	20	IDGD	
COc1ccc(CN(C)C)cc1NC(=O)C(=O)NNC(=O)c1cc(-c2cccs2)[nH]n1	764383176	XJDOXLFLQJHQGW-UHFFFAOYSA-N	442.501	1.608	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1cc(C(F)(F)F)cnc1O	764392577	GLFUPPTYZXMJPV-UHFFFAOYSA-N	444.391	1.693	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)C(=O)Nc1ccc(N2CCCC2=O)c(F)c1	764401168	MXRDRHFZDIFQQZ-UHFFFAOYSA-N	446.460	1.536	50	20	IDGD	
Cc1cc(O[C@H](C)c2ccccc2)ccc1NC(=O)C(=O)NNC(=O)[C@H]1COCCO1	764424964	LGMPFYANNUEDLN-DNVCBOLYSA-N	427.457	1.636	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)C(=O)Nc2cccc(Cl)c2-n2cccn2)c1	764432259	DLUHJGBMWIUEKK-UHFFFAOYSA-N	441.835	1.279	50	20	IDGD	
Cn1ncc(C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)c1C(F)F	766660348	KMPUKPFNLUCIHB-UHFFFAOYSA-N	440.882	1.590	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)[C@@H]1CCN(c2cccc(Cl)c2)C1=O	767352290	DGQTUARWIIZTRG-GOSISDBHSA-N	443.887	1.935	50	20	IDGD	
O=C(CCc1ccccc1O)NNS(=O)(=O)c1ccc(OC[C@@H]2CCOC2)c(F)c1	767461690	LQNPCHCTTTYRRD-CQSZACIVSA-N	438.477	1.889	50	20	IDGD	
CCOc1ccc(NC(=S)NNC(=O)[C@@H](C)NS(=O)(=O)c2cccc(C#N)c2)cc1	767854262	BEIOSPKOERNUMM-CYBMUJFWSA-N	447.542	1.642	50	20	IDGD	
CC(C)c1cc(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3n2)n(-c2ncccn2)n1	768229246	AMRAPYNYBIDDLR-UHFFFAOYSA-N	444.455	1.734	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)NC1CCN([C@H]2CCCC[C@H]2O)CC1	769159654	DYNUFGDBBVBZCK-ZWKOTPCHSA-N	442.520	1.290	50	20	IDGD	
COCCC(=O)N1CCC(NC(=O)NNC(=O)[C@H](C)Oc2ccc3ccccc3c2)CC1	769166403	XLPMYKPQKRFUJW-INIZCTEOSA-N	442.516	1.965	50	20	IDGD	
CSc1cccc(N2C[C@H](C(=O)NNC(=O)c3ccc4c(c3)OCCO4)CC2=O)c1	770390208	DBHJEGOOFXNSCS-CQSZACIVSA-N	427.482	1.994	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)N[C@H]3CCN(CC(F)(F)F)C3=O)nc21	770393156	BIJHNPADABYZLE-VIFPVBQESA-N	430.391	1.076	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)NNC(=O)Cc1cn2ccccc2n1	770649597	PWKGNUKIASDURC-GFCCVEGCSA-N	430.852	1.359	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)N[C@H]1CC(=O)N(c2c(F)cccc2F)C1	771434159	LTIQPIYQZKGQNN-JTQLQIEISA-N	442.382	1.363	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)CN2C(=O)N[C@](C)(c3ccccc3OC)C2=O)n1	771652721	GBFNEECPXNAQLS-OAQYLSRUSA-N	441.492	1.242	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)c1ccc2c(=O)n3c(nc2c1)CCCCC3	771848505	BBOUXGYHAJBNIB-CQSZACIVSA-N	428.489	1.862	50	20	IDGD	
COc1ccc(/C=C/C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)cc1O	773229091	HBFNODATHNVAJG-VQHVLOKHSA-N	433.486	1.578	50	20	IDGD	
N#Cc1cccc(NNC(=O)C(=O)Nc2cccc(S(=O)(=O)N3CCCCC3)c2)c1	773698788	LVODSGHLAWZZKU-UHFFFAOYSA-N	427.486	1.815	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(N2CCCC2)c(NC(=O)NNC(=O)CN(C)C)c1	775435062	QOAAZOSVUZHQQR-UHFFFAOYSA-N	440.570	1.032	50	20	IDGD	
O=C(CN1CCCN(c2nc3ccc([N+](=O)[O-])cc3[nH]2)CC1)NNC(=O)c1ccccc1	775672048	BKODHPSGIILQBP-UHFFFAOYSA-N	437.460	1.444	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)Nc2ccc(C[C@@H]3NC(=O)NC3=O)cc2)c1C	775706850	JAIQBSJRHWXTGT-PBHICJAKSA-N	439.472	1.674	50	20	IDGD	
O=C(CC12CC3CC(CC(C3)C1)C2)NNC(=O)N[C@@H]1CCO[C@@]2(CCS(=O)(=O)C2)C1	776075844	HAGLQFIWTKIWJI-YLDPQQDWSA-N	439.578	1.660	50	20	IDGD	
COC(=O)c1ccccc1NNC(=O)c1cccc(S(=O)(=O)NC[C@H]2CCCO2)c1	777774520	NDNPZIYJTQTNRB-OAHLLOKOSA-N	433.486	1.687	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)NNC(=O)CNC(=O)OC(C)(C)C)cc2C1	778589687	SSOADOSTANGRIV-JTQLQIEISA-N	425.511	1.373	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)C(=O)Nc1csc2ccccc12	782897732	SUCWBZYFMXZTON-UHFFFAOYSA-N	445.526	1.903	50	20	IDGD	
COc1ccc(C(=O)N2CCN(C)CC2)cc1NC(=O)C(=O)NNc1ccc(Cl)cc1	783339404	FPSXUOQXDHQZJX-UHFFFAOYSA-N	445.907	1.818	50	20	IDGD	
Cc1ccccc1NC(=O)NNC(=O)C(=O)Nc1cc(F)c(S(C)(=O)=O)c(F)c1	783417557	VCECCJJFHSQRFC-UHFFFAOYSA-N	426.401	1.468	50	20	IDGD	
O=C(NNc1ccc(-n2cccn2)nn1)C(=O)Nc1ccc(-n2cnc3ccccc32)nc1	783433179	MZTZRWAJRSOBRO-UHFFFAOYSA-N	440.427	1.478	50	20	IDGD	
O=C(NNc1ccc(Cl)nn1)C(=O)N1C[C@@H](C(=O)N2CCCCC2)Oc2ccccc21	784789773	PICVTUPGDUCTGE-HNNXBMFYSA-N	444.879	1.380	50	20	IDGD	
CC[C@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNc2cccc(S(C)(=O)=O)c2)cc1	784839641	MXXOWNJKAYZPDB-ZDUSSCGKSA-N	432.502	1.700	50	20	IDGD	
Cn1cc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC3CCCCCCC3)cn2)cn1	784935258	YRTFCCQUGVUVRL-UHFFFAOYSA-N	449.537	1.288	50	20	IDGD	
CCOC(=O)c1cnn(-c2cccc(NC(=O)C(=O)NNc3ncc(F)cn3)c2)c1C	784956313	KTQPDBWVJSYJJY-UHFFFAOYSA-N	427.396	1.368	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ccnc(N(C)C)n2)cc1S(=O)(=O)NC(C)(C)C	784970445	HIFULEMCJQFKFX-UHFFFAOYSA-N	449.537	1.010	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)C(=O)Nc3cnn(-c4ncccn4)c3)n[nH]2)c1	785126732	CZKUXFPKLHCPDM-UHFFFAOYSA-N	445.443	1.069	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)c1ccc2cncn2c1	786390645	IILZIGVTFQORFT-UHFFFAOYSA-N	426.908	1.567	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)[C@H]2CCCN(C(=O)NC3CCCC3)C2)cc1	786810542	GCUNTDUDOXKZIV-KRWDZBQOSA-N	430.505	1.663	50	20	IDGD	
CCNC(=O)Nc1ccc(C)c(NC(=O)C(=O)NNc2cccc(S(C)(=O)=O)c2)c1	787540218	HIVKNIINWFTZJA-UHFFFAOYSA-N	433.490	1.622	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cc(-n3cccn3)ccc2C)cc1	789584569	NXQPOLVPTUTHKT-MRXNPFEDSA-N	449.467	1.937	50	20	IDGD	
COc1c(C)cnc(Cn2cnc(NC(=O)C(=O)NNC(=O)CC3CCCC3)n2)c1C	789735496	QHKLAYSDKPTLEF-UHFFFAOYSA-N	429.481	1.013	50	20	IDGD	
Cc1ccc(C)c(S(=O)(=O)NCC(=O)NNC(=O)c2cc(-c3ccccc3)on2)c1	789901268	KFXJIBKXFSNBRO-UHFFFAOYSA-N	428.470	1.698	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)C1CCN(S(=O)(=O)c2ccc(C)cc2)CC1	790062874	BQGYZLIILHJAEJ-UHFFFAOYSA-N	441.550	1.332	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])c1	790742423	QSQJOOROMUFXAU-UHFFFAOYSA-N	434.767	1.806	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCC(Oc3ccc(F)nc3)CC2)cc1OC	792387275	BIIQJOLULRWBCN-UHFFFAOYSA-N	432.452	1.542	50	20	IDGD	
CNS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2sc(-c3ccccc3)nc2C)nc1	792392899	GAPZORODLSZXRS-UHFFFAOYSA-N	446.514	1.888	50	20	IDGD	
O=C(NNc1ccc2c(=O)[nH]ccc2c1)C(=O)Nc1ccc2nc(N3CCOCC3)oc2c1	793071129	YUYFOTWCMIYYGO-UHFFFAOYSA-N	448.439	1.588	50	20	IDGD	
CSSCCNC(=O)C(=O)Nc1ccc(S(=O)(=O)/N=C2\CCCN2C)cc1	793079822	VGFDEADSNCIIFP-XMHGGMMESA-N	430.577	1.565	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)c1cccc(NN2C(=O)[C@H]3CC=CC[C@@H]3C2=O)c1	793539274	LTOFFUNWTFTEAB-PMACEKPBSA-N	448.479	1.943	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cnc(COC)s2)c1	794743112	WNLICHBXWIMTEO-UHFFFAOYSA-N	426.520	1.395	50	20	IDGD	
COc1ccccc1O[C@@H]1CCCN(CC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)C1	796568126	ULETWWJFXSKMGX-QGZVFWFLSA-N	428.445	1.908	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2cccc(C)n2)cc(C(=O)NNC(=O)c2cccc(C)n2)c1	797245576	LLGIZAWDZNMIKB-UHFFFAOYSA-N	446.467	1.551	50	20	IDGD	
CCn1ncc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)c1C(F)(F)F	799258650	JIKMYXCWRRKZIA-VIFPVBQESA-N	431.346	1.614	50	20	IDGD	
CN(C)Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)ccc1Cl	799258936	PDALBJDCHXNFQQ-UHFFFAOYSA-N	429.864	1.438	50	20	IDGD	
CCOc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NNC(=O)[C@H]1OCC[C@H]1c1ccccc1	799262910	GGJXXLSJSRMRAD-YJBOKZPZSA-N	442.428	1.652	50	20	IDGD	
Cc1c(C(=O)NNC(=O)COCc2ccccc2)nnn1CCOc1ccc(F)cc1	799940877	FMIMHPCMCRQOIT-UHFFFAOYSA-N	427.436	1.782	50	20	IDGD	
CNC(=O)CNC(=O)c1cccc(NC(=O)NNC(=O)COc2cc(C)cc(C)c2)c1	800597431	WQIFAVSEFANKCM-UHFFFAOYSA-N	427.461	1.011	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCc1ccc(C#N)c(Cl)c1	800983811	VJHVYWQONBBRDD-UHFFFAOYSA-N	434.909	1.957	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2nnn(-c3cccc4c3CCN(C)C4)c2C)cc1	801108417	NJNBZPNIVCQQMA-UHFFFAOYSA-N	447.499	1.272	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(C(F)(F)F)nc1C	802566519	TWUZJIZVUFPXPT-UHFFFAOYSA-N	440.378	1.972	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccc(OC(F)F)nc1	802575385	NQDNDIAVHLACKG-SECBINFHSA-N	428.779	1.890	50	20	IDGD	
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)NNc1ccc(-n2ccnc2)nn1	804953885	BTPXZPYWYYBPCE-GOSISDBHSA-N	432.488	1.970	50	20	IDGD	
C[C@H]1CCCN(S(=O)(=O)c2cc(C(=O)NNc3ccc(-n4ccnc4)nn3)n(C)c2)C1	804958915	RXEGPHNIXFZPHQ-AWEZNQCLSA-N	444.521	1.178	50	20	IDGD	
CCOC(=O)C(C)(C)c1csc(NC(=O)C(=O)NNC(=O)c2c[nH]c3ccccc23)n1	806972752	KECQORXWJCOCPX-UHFFFAOYSA-N	443.485	1.865	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1c(C)c(C(F)(F)F)nn1C	806974043	RBVCYJGLAUYQNU-UHFFFAOYSA-N	427.383	1.475	50	20	IDGD	
Cc1cc(OCc2ccc(C(=O)NNC(=O)NCC(=O)NCC#N)cc2)ccc1Cl	807553047	KRJSMRQXQHTCQS-UHFFFAOYSA-N	429.864	1.811	50	20	IDGD	
O=C(NNC(=O)c1ccc(F)cc1Br)C(=O)Nc1ccc2c(c1)C(=O)OC2	808934685	QNRHTFDOASJPED-UHFFFAOYSA-N	436.193	1.658	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)C(=O)N2CCN(c3ccccc3)CC2)c1	812446612	BKQUUZBMHYKAIY-UHFFFAOYSA-N	438.528	1.993	50	20	IDGD	
Cc1nc(Cn2nnc(NC(=O)C(=O)NNc3ccc(OC(F)(F)F)cc3)c2C)no1	815558133	RRARFWMLNSANMG-UHFFFAOYSA-N	440.342	1.307	50	20	IDGD	
CC(=O)Nc1ccc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)N(C)C)cc1C	815752569	XLIXTJATKMKGRH-UHFFFAOYSA-N	433.490	1.286	50	20	IDGD	
CCOc1ccc(NNC(=O)C(=O)Nc2ccc(S(=O)(=O)N(C)C)c(OC)c2)cc1	815815882	WSXLQJUZUTXRBL-UHFFFAOYSA-N	436.490	1.426	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)C(=O)Nc2cc(C3CC3)n(C)n2)c1	815866611	ILSHZPIGGROSPP-UHFFFAOYSA-N	436.266	1.928	50	20	IDGD	
CC(C)[C@@H](NS(=O)(=O)C1CC1)C(=O)NNC(=O)COc1ccc(Br)cc1	816810490	NPPLWTXAZFAUAV-OAHLLOKOSA-N	448.339	1.082	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)CCCC[C@@H]1SC[C@H]2NC(=O)N[C@@H]21	817053457	SFUDWIYCUOUDIQ-KEYYUXOJSA-N	441.579	1.106	50	20	IDGD	
CCOc1ccc(NNC(=O)c2ccc(S(=O)(=O)N3CCN(C(C)=O)CC3)cc2)cc1	817908650	KKUQPNYXGJCEQO-UHFFFAOYSA-N	446.529	1.695	50	20	IDGD	
COc1cccc(/C=C(\C#N)C(=O)O[C@@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)c1	849204083	QHPUXYWPRGJWEE-LERPTODRSA-N	429.454	1.820	50	20	IDGD	
Nc1nc(Cl)c(C=NNC(=O)c2nn(-c3ccccc3)cc2O)c(N2CCCC2)n1	863967502	LWALBAQVWWZWSX-UHFFFAOYSA-N	426.868	1.968	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)NCCC(=O)NNC(=O)COc2cc(C)cc(C)c2)cc1	863997196	UNAGHTCWYMRQGI-UHFFFAOYSA-N	447.513	1.401	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)c2cccc(CN3C(=O)CSC3=O)c2)cc1	882437403	GEQQLKYUCQGGNG-UHFFFAOYSA-N	428.470	1.764	50	20	IDGD	
COc1ccc([N+](=O)[O-])cc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)C2CC2)c1	913415850	WAIJYKQGLKMFNF-UHFFFAOYSA-N	434.430	1.575	50	20	IDGD	
O=C(COC(=O)Cn1ncc2ccc([N+](=O)[O-])cc21)NNC(=O)c1ccc(Cl)cc1	915525365	XRCJNLCPYWKNID-UHFFFAOYSA-N	431.792	1.602	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)N[C@H](CCSC)c1nnc2ccccn12	916223088	JHCXXRVDHWVHNB-CQSZACIVSA-N	444.517	1.942	50	20	IDGD	
Cc1nc(CCNC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cs1	916254869	UIGATWLUZXKWSK-UHFFFAOYSA-N	437.547	1.423	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)CCc1ccc(S(=O)(=O)NC)cc1	916829877	TXDSNLOONLJWRQ-UHFFFAOYSA-N	443.529	1.287	50	20	IDGD	
CN(CCP(=O)(c1ccccc1)c1ccccc1)CC(=O)N[C@H]1CCS(=O)(=O)C1	917107133	UWKOWQZXFWOXAK-SFHVURJKSA-N	434.498	1.236	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)c3ccc4c(c3)CCN4S(C)(=O)=O)n[nH]2)cc1	917178244	OBXGWYOGONAPLO-UHFFFAOYSA-N	439.497	1.782	50	20	IDGD	
Cn1nc(SCC(=O)NN=Cc2ccc(-c3cccs3)cc2F)c(=O)n(C)c1=O	917544547	IQDJMOBADVVJBC-UHFFFAOYSA-N	433.490	1.589	50	20	IDGD	
O=C(CCn1c(=O)nc(O)c2ccccc21)NNC(=O)c1ccc(F)cc1Br	918340170	DLUGNFDWZJNXPE-UHFFFAOYSA-N	449.236	1.855	50	20	IDGD	
CC(=O)NC1(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)CCCCC1	918399661	RVTDFZASOIJCGZ-UHFFFAOYSA-N	436.534	1.071	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCOCC3)o2)c2ccccc2n1	918692003	PNEWXCVYBRXFHN-UHFFFAOYSA-N	444.469	1.232	50	20	IDGD	
O=C(NCc1cccc(C(=O)NC[C@@H]2CCCO2)c1)NNc1ccc(-n2cccn2)nn1	920349193	WGUOTXRNJMLXBD-KRWDZBQOSA-N	436.476	1.397	50	20	IDGD	
O=C(NCCc1c(F)cccc1Cl)NNC(=O)c1csc(N2CCOCC2)n1	1116273911	DHKQHSGOKHCJOG-UHFFFAOYSA-N	427.889	1.959	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCc2ccccc2S(=O)(=O)NC(C)(C)C)cc1	1318030235	GQTFRIFMPMXQMK-UHFFFAOYSA-N	434.518	1.916	50	20	IDGD	
CC(C)[C@H](NS(=O)(=O)c1ccc(Br)cc1)C(=O)NNc1cccnn1	1323744855	POKYDPJWMFGKJD-AWEZNQCLSA-N	428.312	1.685	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc(Br)cc2c1OCC2)c1n[nH]c2c1CCCC2	1337815451	LMHJNTFKJNOHFU-UHFFFAOYSA-N	441.307	1.609	50	20	IDGD	
O=C(c1cc2cccn2cn1)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1778051156	NRCGAWFRHTVLLD-WMLDXEAASA-N	425.258	1.468	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2)c1nnsc1C1CC1	1778287947	AAQIVKWHYYZPHQ-SNUQEOBHSA-N	428.942	1.143	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cccc3c2cnn3C)C1	1778715417	SMOIZDRYDRIIOD-LRXVAGHRSA-N	448.951	1.955	50	20	IDGD	
CO/C=C(\C)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2	1778838639	SXJPYCNUXNSUPW-HGNZPNQYSA-N	445.944	1.499	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)o1	1779031212	QZIXHTZDDOTPQQ-GTNSWQLSSA-N	428.283	1.465	50	20	IDGD	
O=C(c1cnc2snnc2c1)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1780071559	KHOIKUQILQIOJN-XHDPSFHLSA-N	444.286	1.220	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(CN(C(=O)c3cc[nH]n3)CCO2)C1	1780095009	BQNAEHAUYVDTNP-HXUWFJFHSA-N	443.416	1.001	50	20	IDGD	
COc1cc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)ccc1O	1780752258	KZBYHVDEVXEBKE-KPZWWZAWSA-N	427.295	1.628	50	20	IDGD	
C[C@@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Br)C1)n1ccnn1	1780776593	HRDUIRAHGJMUCW-VPWBDBDCSA-N	432.294	1.044	50	20	IDGD	
O=C(c1[nH]nc2ncccc12)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781330540	BIHCPUIKYBCZRL-BLLLJJGKSA-N	426.246	1.092	50	20	IDGD	
CSCC(C)(C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCC(=O)NN(C)C)C1	1782210273	LXTVTMBNBNEUMC-IIBYNOLFSA-N	442.626	1.263	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnn4c3CCC4)C2)C1	1782322909	UYBJEYQZWNCXMZ-KBXCAEBGSA-N	425.327	1.446	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)Cc3ccc(Cl)cc3OC)C2)C1	1782904052	NJSISZVMEJYGFM-OXQOHEQNSA-N	445.343	1.975	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)Cc3ccc(OC)c(F)c3)CCO2)C1	1783879872	YYRMWSGYKMYJPK-YWZLYKJASA-N	428.888	1.461	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cc([N+](=O)[O-])c(O)cc3C)CCO2)C1	1783880278	GXTJFTJLXXUPFI-LIRRHRJNSA-N	441.868	1.306	50	20	IDGD	
Cc1cc2cccc(C(=O)N3CCO[C@]4(CCN(C(=O)CCC(=O)NN(C)C)C4)C3)c2[nH]1	1783935730	YGSRIEMIXZFOLX-QHCPKHFHSA-N	441.532	1.293	50	20	IDGD	
CN(C)c1cccc(OCC(=O)N2CCO[C@]3(CCN(C(=O)C(Cl)Cl)C3)C2)c1	1783942394	NTDBIOICPKZENL-LJQANCHMSA-N	430.332	1.765	50	20	IDGD	
O=C(CCc1cncc(C(F)(F)F)c1)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1784295952	AEFINCRQYLDDGU-YJBOKZPZSA-N	449.857	1.463	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)Cc3cnc(C)s3)C2)C1	1784440866	UHVWLRWPDNECEG-YOEHRIQHSA-N	430.368	1.997	50	20	IDGD	
Cc1nc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Br)C[C@@H]32)cs1	1785296567	MYEGJJMCTROVDD-GZCFXPHUSA-N	434.331	1.664	50	20	IDGD	
COc1ncccc1CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CO[Si](C)(C)C)C[C@@H]21	1785310109	UXPJCJHJSGMXNC-FHWLQOOXSA-N	449.624	1.854	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)C3CCN(CC)CC3)C2)C1	1785647539	IWSGYQPVXFVGGY-QFBILLFUSA-N	430.387	1.722	50	20	IDGD	
C[C@@H](Cn1cccn1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCBr)[C@H]2C1	1786401175	RKVSKOXIAALBSS-VGWMRTNUSA-N	427.343	1.284	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCBr)[C@H]2C1	1786408847	GPLATUWPBPARJC-JUFZMCDQSA-N	430.170	1.987	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCBr)[C@H]3C2)nn1C(F)F	1786408994	NGYQFFNMFKDVQV-OBJOEFQTSA-N	449.296	1.965	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3ccc(F)cn3)[C@H]2C1	1787035336	BHPXDLKAJVJBLE-SJWGOKEGSA-N	442.329	1.916	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)[C@H](O)CCl)CCC2)cc1)c1cccn2c(O)nnc12	1788518703	LQYBZBSEXGTZGG-OAHLLOKOSA-N	429.864	1.782	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3CC(c4ccccc4)=NN3)[C@H]2C1	1790545408	OPJKGDSOLARKFL-TXTPUJOMSA-N	432.952	1.750	50	20	IDGD	
CC(C)c1nc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]3C2)no1	1791057438	UYPZFTWVEUBMBM-RFGFWPKPSA-N	443.342	1.499	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1ccc(C2(NC(=O)c3cc(=O)ccn3C)CCC2)cc1	1791601170	RSHCLHIFZSGQIK-UHFFFAOYSA-N	439.516	1.506	50	20	IDGD	
O=C(COc1cccc(Cl)c1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2	1792748193	BQRXWZMNSDHFRD-OXUXUCFPSA-N	449.704	1.999	50	20	IDGD	
Cc1ccc(C(=O)C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)CBr)cc1	1792872264	UJDSDVCYDXLPCW-LLLHUVSDSA-N	437.334	1.798	50	20	IDGD	
Cc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)CBr)nn1C(F)F	1792872721	ZCONTXMSKCFBBN-SGESHTKJSA-N	449.296	1.821	50	20	IDGD	
CN1Cc2ccccc2C[C@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(C)(C)CCl)C2	1793824096	BCAKLDPZSOLLSO-YRPNKDGESA-N	433.980	1.898	50	20	IDGD	
C[C@@H]1[C@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Cl)CCN1C(=O)OC(C)(C)C	1796370875	OJHLHBAXVJXANQ-BKQXGZDCSA-N	447.935	1.756	50	20	IDGD	
COc1ccccc1C(=O)N1CC(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](F)Cl)C1	1796803984	FZQKNKAZIZTZHV-BASYENTBSA-N	437.899	1.940	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2ccccn2n1	1796834831	OVTODKGHFXNFSI-UESRRSCYSA-N	425.316	1.774	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CN(Cc2ccccc2)CCO1	1797248131	JFEGVRHOLBUUED-FDKIHUSFSA-N	449.979	1.494	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2n(n1)CCCC2	1797442634	NXBMWIBVGJMEFN-AODNKKSCSA-N	429.348	1.659	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(C)(C)n1nc(C)ccc1=O	1797910942	HNJVCYFSMDTYQG-DFGXFYAUSA-N	438.956	1.284	50	20	IDGD	
COc1cc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)C(Cl)Cl)C3)ccc1[N+](=O)[O-]	1799252102	LBDSVWOGSJOOEL-DRXBFXEBSA-N	446.287	1.539	50	20	IDGD	
Cn1cc2cc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)CO[Si](C)(C)C)C4)ccc2n1	1799912277	BJFWPFUPLVLIBV-XEMDLRDOSA-N	430.581	1.628	50	20	IDGD	
COc1ccccc1CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)Br	1800762068	MMNYCQSVFNOQAA-FRQROOTJSA-N	425.323	1.611	50	20	IDGD	
O=C(CCc1c[nH]c2ccc(F)cc12)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2	1800840527	PLNFHESJPFIDND-ZZXMYQEDSA-N	437.899	1.429	50	20	IDGD	
O=C(CCCc1cccnc1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2	1801479763	WPVIWTBUYBUWNA-YALNPMBYSA-N	428.302	1.684	50	20	IDGD	
COc1ccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Br)C3)cc1F	1801502400	AZAATNMIXFXOKQ-CZAMWMTLSA-N	447.276	1.657	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ncn(C)c1C(F)(F)F)C2	1802336714	WCZMYAMBICDJIS-CLLJXQQHSA-N	444.458	1.064	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1CCN(C(=O)CS(C)(=O)=O)[C@H]1c1cccnc1	1803009267	SGDPYJPDMKHYML-INWMFGNUSA-N	446.367	1.163	50	20	IDGD	
O=C(/C=C/c1ccoc1)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1804313872	LXCOVXWLVSLOAS-ZBVIIRNFSA-N	445.284	1.387	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H](CNC(=O)c2cnnn2C)[C@@H]1c1cccnc1	1804745563	AVNLJOKZEIOUMJ-YCPHGPKFSA-N	435.326	1.703	50	20	IDGD	
Cn1ccc(CC(=O)NC[C@@H]2CCN(C(=O)[C@@H](F)Br)[C@H]2c2cccnc2)n1	1807518330	SXTPPGOUDKCWER-RRQGHBQHSA-N	438.301	1.754	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)c1nccc2nc[nH]c12	1808129940	YDBGZXFNABQETG-YEWWUXTCSA-N	428.880	1.272	50	20	IDGD	
O=C(NCCC(=O)N1CC[C@H](CNC(=O)[C@H](F)Cl)[C@H]1c1cccnc1)c1ccc[nH]1	1808308509	KPHUXTAVDJGYMI-OLMNPRSZSA-N	435.887	1.770	50	20	IDGD	
CC[S@](=O)CCC(=O)N1CC[C@H](CNC(=O)[C@H](F)Br)[C@H]1c1cccnc1	1808668148	JEENIZKEFXRTEG-XRHZQSTLSA-N	448.358	1.937	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC2(CCCN(C(=O)C(=O)c3ccccc3)C2)CC1	1808982965	YRMXGIYSKHFUTP-UHFFFAOYSA-N	449.511	1.413	50	20	IDGD	
O=Cc1ccc(C(=O)N2CCCC3(CCN(C(=O)c4cccc(B(O)O)c4)CC3)C2)s1	1809982468	RFBHBOZSPBVMHA-UHFFFAOYSA-N	440.330	1.399	50	20	IDGD	
C/C=C/C=C\C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1	1812578942	VOUJBGPIQBDFGX-CYEZIGSKSA-N	434.500	1.532	50	20	IDGD	
COC(=O)C1(C(=O)NC[C@H]2CCN(C(=O)CCBr)[C@H]2c2cccnc2)CC1	1812685642	YNWYWKYTPYQHNK-ZBFHGGJFSA-N	438.322	1.826	50	20	IDGD	
CNc1nsnc1C(=O)N1CC[C@H](CNC(=O)[C@@H](Cl)COC)[C@@H]1c1cccnc1	1813028864	WFZKEYQOMKKQSQ-IPYPFGDCSA-N	438.941	1.548	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2c(F)c(C)nn2C)[C@H]1c1cccnc1	1813029528	OPWDWCMGSVDFPI-VYDXJSESSA-N	437.903	1.836	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2cnncc2C(=O)O)[C@@H]1c1cccnc1	1813031981	STWIBAHKFNEQMR-RRQGHBQHSA-N	447.879	1.143	50	20	IDGD	
CC[S@](=O)CCC(=O)N1CC[C@H](CNC(=O)[C@@H](Cl)COC)[C@H]1c1cccnc1	1813032910	XXFNPZJGEZZXCO-LZMSYLRASA-N	429.970	1.500	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)CCS(C)(=O)=O)[C@@H]1c1cccnc1	1813573192	DHTZYWCMELAOGG-BQFCYCMXSA-N	429.970	1.930	50	20	IDGD	
C[C@@H](CBr)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN2CCOC2=O)[nH]n1	1814778355	GJFZGMVAQAPMRW-AAEUAGOBSA-N	442.314	1.885	50	20	IDGD	
C[C@@H]1CCC[C@H]1C(=O)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1	1815356686	LJDSZPSNAXOQHD-DAXOMENPSA-N	427.335	1.485	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccnc2)n[nH]1	1816376820	MDPKGMQAHQIAMT-QGZVFWFLSA-N	434.460	1.423	50	20	IDGD	
O=C(C#Cc1ccccc1)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1816954562	DZZUUIXHXXPVCC-OAQYLSRUSA-N	442.284	1.447	50	20	IDGD	
O=C(C#Cc1ccccc1)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1816954646	GIGFZMALCJJDAI-OAQYLSRUSA-N	442.284	1.447	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3cnc(O)nc3O)sc2C1	1817079125	LHPQLIJRQFPTAO-WPRPVWTQSA-N	425.898	1.978	50	20	IDGD	
C[C@H](NC(=O)c1cnccn1)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](F)Cl)sc2C1	1817125493	PNQUPRJTIBFWIR-IGJMFERPSA-N	440.888	1.198	50	20	IDGD	
CCc1oncc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1	1817473422	SHZRJCXXYZSUFJ-KRWDZBQOSA-N	437.265	1.260	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cnccc3C(=O)NN)n[nH]2)ccn1	1819403500	PSGXXYPPRSBNJZ-GOSISDBHSA-N	448.487	1.731	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(F)c[nH]1)CC2	1819800906	UYRCUVGPIWLQDG-JTQLQIEISA-N	443.464	1.148	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2c[nH]c(=O)cn2)n[nH]1	1820248016	GKAWUWQVZBKNBV-GWCFXTLKSA-N	437.298	1.972	50	20	IDGD	
CS(=O)(=O)CC(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](F)Br)n[nH]1	1820932955	WHTYQOSMYDTWLI-CABZTGNLSA-N	425.280	1.137	50	20	IDGD	
O=C(/C=C\C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](F)Br)n[nH]1)NC1CC1	1820935497	NJURNCUNAMWXMY-GORHOLETSA-N	442.289	1.927	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cncc(O)c2)n[nH]1	1822233317	IPAAIUFKZUHTRI-INIZCTEOSA-N	429.481	1.189	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](C)N3CCN(C)CC3)sc2C1	1822702364	PFGPQKANRKAVEF-BFHYXJOUSA-N	428.002	1.708	50	20	IDGD	
C[C@H](C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1)n1cncn1	1823014334	UGWXXKPIFRXNQL-XLDPMVHQSA-N	431.291	1.598	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](O)CCl)CC2)c1cccc(-n2cncn2)c1	1823717808	FXPQYWIDOCQWJW-WFASDCNBSA-N	446.920	1.549	50	20	IDGD	
CN(C)C(=O)NCC(=O)N1CCCC[C@H]1C1CCN(C(=O)CCBr)CC1	1823881009	YXJWTMLAIHZOBG-HNNXBMFYSA-N	431.375	1.662	50	20	IDGD	
CC(C)(C)[C@H](O)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1	1824134800	NWEPYRHMTVSSKY-RBUKOAKNSA-N	445.564	1.325	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1c3c(nn1C)CCC3)CC2	1826004648	PXCCGMHKJFZNLA-JQWIXIFHSA-N	437.953	1.845	50	20	IDGD	
Cc1ccc(C(=O)N[C@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)c(O)n1	1826088859	QWHFUGXAJPKXAV-LBPRGKRZSA-N	446.533	1.151	50	20	IDGD	
O=C(c1cccc(F)n1)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827057541	HYUQEHUVACEKAT-FQEVSTJZSA-N	439.296	1.448	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccnc3Cl)CCO2)C1	1829501737	QWDRRRVEGJZACQ-YVEFUNNKSA-N	446.729	1.588	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CN2C(=O)CNC2=O)CC1	1830314209	UEPVYKZRWFOGKL-IFXJQAMLSA-N	447.363	1.394	50	20	IDGD	
Cc1nocc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2	1830537183	CKWSKVWQKQCRPE-SJCJKPOMSA-N	430.299	1.084	50	20	IDGD	
Cc1cc(Cl)cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)c1	1830738602	QMYPWJHDCVLXJZ-QFBILLFUSA-N	431.316	1.318	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)C2CCC(O)CC2)CC1	1832002753	QUOPBNHGTMHSOH-SOAGJPPSSA-N	436.597	1.530	50	20	IDGD	
CC(C)N[C@@H](C(=O)NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)C(C)C	1834785412	WTEXPJBBQISFNH-RBUKOAKNSA-N	431.021	1.180	50	20	IDGD	
O=C(Cc1ccccc1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1834997468	CPDLIXMNVIKFBJ-SJLPKXTDSA-N	429.286	1.376	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3cscn3)CCO2)C1	1836044600	BBEDMINJXCQUAO-WMLDXEAASA-N	446.367	1.316	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)C(Cl)Cl)CC2)CC1)c1ccnc2c1OCO2	1836094025	VLPXYHRRPNBWKC-UHFFFAOYSA-N	443.331	1.799	50	20	IDGD	
Cc1cc(CC(=O)N2CCC(N3CCC(NC(=O)[C@@H](F)Br)CC3)CC2)on1	1836413559	JEHFRCJITVXUTC-QGZVFWFLSA-N	445.333	1.788	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)c3ccnnc3)CC2)CC1	1837430261	ISZUITQJUBNNLV-ZDUSSCGKSA-N	425.327	1.872	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)CCBr)C3)C2)ccn1	1837935413	FYZRBVHPGDHYAF-SFHVURJKSA-N	426.311	1.245	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3[nH]nc4ccncc34)CC2)CC1	1838049418	XIDXBLUODIWNCR-KRWDZBQOSA-N	449.939	1.824	50	20	IDGD	
C#CCCC(=O)N1CCC(OC2CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CC2)CC1	1838102964	QYWZZILLCLANEF-KOEQRZSOSA-N	441.532	1.532	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCC(OC2CCN(C(=O)Cn3nccn3)CC2)CC1	1838638741	KEBQNLHUOLFDFO-SFHVURJKSA-N	432.352	1.513	50	20	IDGD	
O=C([C@@H](F)Cl)N1CCOC[C@]2(C1)CN(C(=O)C1(c3ccc(F)c(F)c3)CC1)CCO2	1839042472	YMBJRJXHOXWKSM-APWZRJJASA-N	446.853	1.987	50	20	IDGD	
O=C(c1ccc(-c2cc[nH]n2)cc1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1839396101	WXTJWIALMMIEET-YLJYHZDGSA-N	436.871	1.681	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3ccc(C)cc3)CCO2)C1	1839939392	QWADPFGFHOVOMW-KNQAVFIVSA-N	438.952	1.638	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3ccccc3C)CCO2)C1	1839942995	SSNUOHVXXVSVTQ-SIKLNZKXSA-N	438.952	1.638	50	20	IDGD	
CCc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](Br)CC)CCO3)n[nH]1	1839964471	SLUYGDOIVXZILM-KSSFIOAISA-N	443.342	1.216	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3sccc3F)C2)C1	1840030601	PXIBITZBHRGZTI-BDJLRTHQSA-N	435.315	1.741	50	20	IDGD	
C[C@H](Oc1cccnc1)C(=O)N1CCOC[C@@]2(CN(C(=O)C(Cl)Cl)CCO2)C1	1840190932	VXTJJPHLENKRBZ-UGSOOPFHSA-N	432.304	1.109	50	20	IDGD	
C#CCCCCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](Br)CC)C2)C1	1840295115	WXGHVZCCHPFDFL-LPHOPBHVSA-N	429.355	1.810	50	20	IDGD	
O=C(c1ccccc1OC(F)F)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1840744742	VDTBGDHVLNJLCZ-KDOFPFPSSA-N	436.814	1.892	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2ccc3ncncc3c2)C1	1844090399	PBZRGARMVSXNEZ-JFLMPSFJSA-N	445.483	1.581	50	20	IDGD	
Cc1ccc(=O)n(C(C)(C)C(=O)N2CCCC23CN(C(=O)[C@@H](C)Br)C3)n1	1844354682	LQVHOSPVVRTTSF-CYBMUJFWSA-N	425.327	1.274	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@H](NC(C)=O)c2cccc(Cl)c2)C1	1845019011	HSGRFXPIIRWZMP-DLBZAZTESA-N	442.343	1.974	50	20	IDGD	
CN1C(=O)CC[C@H]1C(=O)N1CC2(CCCN2C(=O)[C@H](Br)Cc2ccccc2)C1	1845941933	AKGRXFHOFRPMDE-SJORKVTESA-N	448.361	1.817	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@]23C[C@H]2CCN3C(=O)OC(C)(C)C)C1	1846192707	PEEHJEJUNUUJNW-WIEQDCTASA-N	441.956	1.843	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@]2(O)CCN(C(=O)OC(C)(C)C)C2)C1	1846410351	NYJIVKWKFPQAFL-QVKFZJNVSA-N	443.972	1.969	50	20	IDGD	
Cc1c(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](C)CBr)cn2[nH]cnc(=O)c12	1847498512	GIPTUSHCYGWDHV-BPNCWPANSA-N	436.310	1.177	50	20	IDGD	
Cc1c(/C=C(\C#N)C(=O)OCC(=O)NC(=O)Nc2ccc3c(c2)OCCO3)cc(C#N)n1C	10957251	JMDYUSMRDCNONG-VIZOYTHASA-N	449.423	1.775	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)CCn2c(=O)n(C)c3ccccc32)c2ccccc2c1=O	14282608	TZQNQBOYVSERDP-UHFFFAOYSA-N	448.483	1.311	50	20	IDGD	
O=C(NNC(=O)c1cc2c(s1)CCC2)c1cccc(S(=O)(=O)NC[C@@H]2CCCO2)c1	21782126	BVEABRGZJIGHIB-HNNXBMFYSA-N	449.554	1.769	50	20	IDGD	
CS(=O)(=O)c1cc(C(=O)NNC(=O)c2cc(Br)c[nH]2)cc([N+](=O)[O-])c1	109039352	QMDYYLSMLXXNNE-UHFFFAOYSA-N	431.224	1.164	50	20	IDGD	
O=C(CN1CCN(C(=O)CC2CCCCC2)CC1)NNC(=O)c1ccc([N+](=O)[O-])cc1	725802978	XLUNNOSKMNQADK-UHFFFAOYSA-N	431.493	1.470	50	20	IDGD	
CC(C)(C(=O)NNC(=O)c1ccncc1)S(=O)(=O)c1ccc(Br)cc1	726155325	LYIWCICCBCRBHY-UHFFFAOYSA-N	426.292	1.858	50	20	IDGD	
COc1ccc(CN2C[C@H](C(=O)NNC(=O)[C@@H](C)Oc3ccccc3F)CC2=O)cc1	726497527	BWHHBQGCLXTSIP-GDBMZVCRSA-N	429.448	1.798	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)c2ccccc2c1=O	726498653	MHHJIZVFPGOWOD-UHFFFAOYSA-N	427.421	1.108	50	20	IDGD	
C#Cc1cccc(NC(=S)NNC(=O)[C@H]2CS[C@H](Cc3ccccc3F)C(=O)N2)c1	727499681	LAPULZZQLMSYGM-QZTJIDSGSA-N	442.541	1.968	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@H](c2ccccc2)N2CCC(O)CC2)c2ccccc2c1=O	727765300	SMORPRBRDGRFIZ-NRFANRHFSA-N	449.511	1.375	50	20	IDGD	
NC(=O)c1ccc(/C=C\C(=O)N2CCC[C@@H]2C(=O)NNc2nc(-c3ccccc3)no2)cc1	728079373	GWHUTBPPGIAVFI-ADYSOMBNSA-N	446.467	1.983	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)[C@@H]3CCOc4ccccc43)cc2)CC1	728213934	HJGWDOBOFXJGFO-LJQANCHMSA-N	430.530	1.632	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)C2CCN(C(=O)OCC(C)C)CC2)n1	728730822	XERYXYLAEIBPFP-UHFFFAOYSA-N	440.522	1.189	50	20	IDGD	
CNC(=O)c1ccc(CNC(=O)NNC(=O)c2cc(OC)ccc2Br)cc1	728742485	DPJHRZSXMCEPMQ-UHFFFAOYSA-N	435.278	1.962	50	20	IDGD	
Cc1ccccc1CCC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	728800279	RVBRHMPMJMLTRY-UHFFFAOYSA-N	431.514	1.410	50	20	IDGD	
CON(C)S(=O)(=O)c1cccc(C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)c1	728974751	ZYRKBBZDXAUNPD-UHFFFAOYSA-N	449.457	1.622	50	20	IDGD	
COc1cc(C(=O)NN[C@H](C(N)=O)c2ccc(Br)cc2)cc(OC)c1OC	729677176	ZUAVEPYDRFQVJY-HNNXBMFYSA-N	438.278	1.936	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)Cc2c(C)nc3[nH]n(C)c(=O)c3c2C)cc1	730103846	HLXLGLFIHFIAFR-CQSZACIVSA-N	441.488	1.435	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)CC1=CCCCC1	730161325	XOOOKJAFZTUZFT-UHFFFAOYSA-N	435.546	1.678	50	20	IDGD	
COc1cc(C(=O)NNC(=O)COc2ccccc2O)ccc1OCC(=O)NC(C)C	730779229	YMKVEIYGKCBLAM-UHFFFAOYSA-N	431.445	1.144	50	20	IDGD	
COC(=O)c1c(S(=O)(=O)NNC(=O)c2cc3c(s2)CCCCCC3)n[nH]c1C	732045708	NWKGERWGOSEVQY-UHFFFAOYSA-N	426.520	1.849	50	20	IDGD	
O=C(NNC(=O)C1CCC1)c1ccc(NS(=O)(=O)c2ccc3nc(O)[nH]c3c2)cc1	732144248	PRNASLWSXIRBGO-UHFFFAOYSA-N	429.458	1.630	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2csc(I)c2)C[C@@H](C)O1	732263195	LIFQPYONQZNLRC-AOOOYVTPSA-N	437.303	1.613	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)[C@H]1CCCN(C(=O)c2ccc3n[nH]cc3c2)C1	732303444	DZJVRFPNXBHFAH-HNNXBMFYSA-N	441.513	1.962	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@H]2C(=O)NNc2ccccc2S(C)(=O)=O)c(OC)c1	732303522	ASJWEEDPSDDHKW-KRWDZBQOSA-N	447.513	1.855	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NNc2nc3ccccc3c(=O)n2C)n(C)c1	733264004	VKKLBHMRJLMLQS-UHFFFAOYSA-N	432.506	1.059	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)[C@@H](O)C(C)(C)C)c2)cc1	735837039	PEIJMMWSVJHKOH-QGZVFWFLSA-N	435.502	1.664	50	20	IDGD	
CC[C@H](Nc1c([N+](=O)[O-])c(C)nn1C)C(=O)NNc1nc2ccccc2c(=O)n1CC	735880248	PIVVIGLNUMGFGP-ZDUSSCGKSA-N	428.453	1.700	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)c2cccc(-n3cccn3)n2)CC1	736563722	ZVHFQFVGBHXNTC-UHFFFAOYSA-N	429.481	1.611	50	20	IDGD	
C[C@H](Cc1ccccc1F)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	737466582	RUPSPEYYQCSTOZ-OAHLLOKOSA-N	449.504	1.486	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)c1c(F)ccc(S(=O)(=O)NC2CC2)c1F	737923119	LIPSYHMUCXKZDB-UHFFFAOYSA-N	439.440	1.383	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2ccc(NC(=O)OC(C)(C)C)cc2O)C[C@@H](C)O1	740922007	NJRYOKNWOKJUEP-OKILXGFUSA-N	436.509	2.000	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)[C@@H]2CCCN(C(=O)COc3ccccc3)C2)cc1	741206954	HFTVAWYBETWJAV-GOSISDBHSA-N	425.485	1.839	50	20	IDGD	
CC(=O)Nc1cccc(-n2nnnc2SCC(=O)NNC(=O)c2cccc(C#N)c2)c1	741849721	CRQZBGIWBYRZFL-UHFFFAOYSA-N	436.457	1.046	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2ccc(N(C)C(C)=O)cc2)cc(OC)c1OC	742025694	QSYOIKMMTQLSCD-UHFFFAOYSA-N	437.474	1.318	50	20	IDGD	
Cc1nn(C)c2sc(C(=O)N[C@@H](C)C(=O)NNC(=O)Cn3cnc4ccccc43)cc12	742034441	ZLBUQQLDJXSFEP-LBPRGKRZSA-N	439.501	1.259	50	20	IDGD	
COc1cc(C(=O)NNC(=O)N[C@@H]2C[C@@H](C)N(c3ccccc3)C2=O)cc(OC)c1OC	743506936	SWRNSMARCDUQGA-CZUORRHYSA-N	442.472	1.850	50	20	IDGD	
CC(=NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1)c1ccc2c(c1)NC(=O)CO2	744729467	VTTZBFGVOGHAEX-UHFFFAOYSA-N	430.486	1.487	50	20	IDGD	
CC[C@@H](C)[C@H](NC(=O)N1CCCC1)C(=O)OCC(=O)NNC(=O)c1cccc(C#N)c1	745060712	WNVFYDGAGRITIQ-KDOFPFPSSA-N	429.477	1.083	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCc2nccn2C1)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	746347217	SLALGVDWHHBETB-IBGZPJMESA-N	442.483	1.609	50	20	IDGD	
Cc1cccn2cc(CCNC(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)nc12	746778547	WOFKGGMQIKSTDL-UHFFFAOYSA-N	444.517	1.080	50	20	IDGD	
CC(=O)c1cccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)Cc3ccncc3)CC2)c1	747322613	FJAKISHMIGUKKD-UHFFFAOYSA-N	444.513	1.075	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)c1ccccc1F)C(=O)NNC(=O)c1cccn1C	747599135	NXVIQUCSDXKSAX-CYBMUJFWSA-N	428.511	1.025	50	20	IDGD	
O=C(Cc1ccc(Cl)cc1)NNC(=O)NCCC(=O)N1CCN(c2ccccc2)CC1	748465664	QAVMNCCQTIXXAV-UHFFFAOYSA-N	443.935	1.952	50	20	IDGD	
Cc1cc(Br)ccc1NNC(=O)C1=NN([C@H]2CCS(=O)(=O)C2)C(=O)CC1	748737041	OFMXPTYZRKZBLI-LBPRGKRZSA-N	443.323	1.366	50	20	IDGD	
COCCS(=O)(=O)c1ccc(C(=O)NNC(=O)c2ccc(Cl)cc2OC)cc1	749565468	RPVPFFXMDCGQCO-UHFFFAOYSA-N	426.878	1.844	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)c1cccc(NC(=O)[C@@H]2Cc3ccccc3O2)c1	751202313	BZMCSMGZYPDUNO-IBGZPJMESA-N	448.435	1.413	50	20	IDGD	
CCn1c(=O)c(C(=O)/C(C#N)=C/c2ccc(C(=O)OC)[nH]2)c(N)n(Cc2ccccc2)c1=O	751512762	KIXQLYLCJDZGAZ-RVDMUPIBSA-N	447.451	1.565	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)NCCN1C(=O)[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O	755262167	YSMOUWNMXQZQGT-DPDCMNJDSA-N	432.864	1.100	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)Nc1ccc(N2CCCS2(=O)=O)cc1	755596124	ZVZJWWJWTHEYGH-UHFFFAOYSA-N	449.445	1.366	50	20	IDGD	
COc1cc(C)ccc1Oc1ccc(NC(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)cn1	755886386	KZRDFHFCNHTSQX-LBPRGKRZSA-N	437.478	1.281	50	20	IDGD	
C#CCOc1cccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1	756480602	WRBUFZYTPDLOAC-UHFFFAOYSA-N	442.497	1.950	50	20	IDGD	
CNS(=O)(=O)c1ccc(C)c(NC(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)c1	756524592	HLHQLIHHIDDFMO-UHFFFAOYSA-N	446.464	1.899	50	20	IDGD	
C[C@@](O)(CN1Cc2ccccc2C1=O)C(=O)NNC(=O)c1cc(-c2cccs2)[nH]n1	756878162	DVWFNIBZDJUKMG-HXUWFJFHSA-N	425.470	1.306	50	20	IDGD	
CC(C)CN1CC[C@H](CNC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)C1	757292775	VZLOUASPLBJMMR-HXUWFJFHSA-N	430.597	1.507	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)c(Cl)c1)C(=O)Nc1ccnn1Cc1ccc(F)cc1	760291935	RMSNDPXTLADHOP-UHFFFAOYSA-N	431.811	1.829	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1csc(N2CCOCC2)n1)c1noc(-c2ccccc2)n1	761800493	RUHHYNWYPLEUPS-GFCCVEGCSA-N	443.489	1.735	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNS(=O)(=O)c1cnn(Cc2ccccc2)c1	763439847	WFTUWTQQFQLQEY-UHFFFAOYSA-N	437.522	1.546	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)C(=O)Nc1cccc(Cl)c1N1CCOCC1	763441774	JOXZWQIKBGDNEF-UHFFFAOYSA-N	447.835	1.485	50	20	IDGD	
Cc1nc(-c2ccccc2NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)no1	763604908	PNQDLPDSQBCVFM-UHFFFAOYSA-N	431.412	1.835	50	20	IDGD	
COC(=O)c1c(NC(=O)C(=O)NNC(=O)COc2cc(C)ccc2C)sc(C)c1C	763669253	VVGQMFRXHNXACU-UHFFFAOYSA-N	433.486	1.933	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(CCN3CCCC3)cc2)cc1	763673414	FAWXZPRJHHVDSV-UHFFFAOYSA-N	435.484	1.361	50	20	IDGD	
COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NNC(=O)CN1CCCc2ccccc21	763746240	RCASGXKNYJTPFT-UHFFFAOYSA-N	427.417	1.142	50	20	IDGD	
Cc1c(F)cccc1NC(=O)C(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12	763791558	VLEOPTIZGOISSX-UHFFFAOYSA-N	425.420	1.825	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)C(=O)Nc2cccc(C#N)c2C)c2ccccc2c1=O	763806139	ZPWNXACJZHGKRA-UHFFFAOYSA-N	446.467	1.776	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)C2=S=C3CC[C@H](C)CC3=C2)n(C2CCOCC2)n1	763947894	DPFXRMLSBZXQPV-LBPRGKRZSA-N	445.545	1.467	50	20	IDGD	
CCOC(=O)c1ccsc1NC(=O)C(=O)NNC(=O)c1ccc(Cl)cc1OC	764012516	SDKOHYCMHGZSBX-UHFFFAOYSA-N	425.850	1.987	50	20	IDGD	
O=C(NNC(=O)c1cccc(Br)c1)C(=O)Nc1cccc2c1OCCC2=O	764058978	LUWUBJKQODLBPW-UHFFFAOYSA-N	432.230	1.814	50	20	IDGD	
Cc1nn(C)c2ncc(NC(=O)C(=O)NNC(=O)c3cccc(Br)c3)cc12	764059372	SSVXQQINXIHNKU-UHFFFAOYSA-N	431.250	1.439	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cnn(-c4ccccn4)c3)n[nH]2)cc1	764112061	VFEFJYDOKNXACC-UHFFFAOYSA-N	430.428	1.366	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1cccc([C@@H](C)N2CCOCC2)c1	764131075	DKEBUGCARHLVPN-MRXNPFEDSA-N	440.500	1.417	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1cccc(NC(=O)c2ccncc2)c1	764278084	QPOUDCFGMIWZRW-UHFFFAOYSA-N	449.423	1.204	50	20	IDGD	
CCCS(=O)(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2cc3ccccc3o2)c1	764330523	GBHRCVBMLPYLFS-UHFFFAOYSA-N	444.469	1.984	50	20	IDGD	
COCC[S@](=O)Cc1cccc(NC(=O)C(=O)NNC(=O)c2cc3ccccc3o2)c1	764330995	KPUWMHCOQNIVPG-HKBQPEDESA-N	443.481	1.728	50	20	IDGD	
CCCOC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1	764346007	QPYHPQXBPSJUPW-UHFFFAOYSA-N	435.440	1.839	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2cccs2)[nH]n1)C(=O)Nc1cnn(Cc2ccccc2)c1	764376897	LFGXDDDTWBVLAV-UHFFFAOYSA-N	435.469	1.783	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc(-n4nccn4)nc3)n[nH]2)cc1	764384574	DRRPVEQWFZSXTA-UHFFFAOYSA-N	445.443	1.015	50	20	IDGD	
Cc1cc(Br)c(NC(=O)C(=O)NNC(=O)c2ncccc2C)cc1[N+](=O)[O-]	764386225	UITVFPALPIEJNP-UHFFFAOYSA-N	436.222	1.769	50	20	IDGD	
Nc1c(Cl)c(Cl)nc(C(=O)NNS(=O)(=O)c2cccc3nonc23)c1Cl	765032485	WDXRNFFTOVBLIQ-UHFFFAOYSA-N	437.652	1.784	50	20	IDGD	
CC(=O)N[C@H](Cc1c[nH]c2ccc(Br)cc12)C(=O)NNC(=O)c1cc(C)[nH]n1	765588058	RWXIPDFCQYHQRC-OAHLLOKOSA-N	447.293	1.470	50	20	IDGD	
NS(=O)(=O)c1ccc(CCC(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)cc1	765618729	GICNCLUAVWSMSE-UHFFFAOYSA-N	431.449	1.257	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1cc(-c2cccs2)[nH]n1	765736498	TYGOPCQOCIUUBF-UHFFFAOYSA-N	438.513	1.357	50	20	IDGD	
COC(=O)NNC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc(Br)s1	765846491	JOVWUNBHMYPXKZ-MRVPVSSYSA-N	426.314	1.441	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N1CCC(CCC(N)=O)CC1	767190332	YUOYBOLIEABNIF-LBPRGKRZSA-N	441.326	1.935	50	20	IDGD	
CC(C)OCCCn1c(NNC(=O)CS(=O)(=O)C(C)(C)C)nc2ccccc2c1=O	767477125	HTDKERZREVDVMI-UHFFFAOYSA-N	438.550	1.868	50	20	IDGD	
COCCCS(=O)(=O)c1ccc(NC(=O)NNC(=O)COc2ccccc2O)cc1	767960209	WGBJLUKZBCQAAH-UHFFFAOYSA-N	437.474	1.434	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)NCCn2cc([N+](=O)[O-])cn2)cc1Cl	768536788	KSJSDYWEJDVEPR-UHFFFAOYSA-N	427.805	1.498	50	20	IDGD	
N#Cc1cc(Cl)nc(NNC(=O)c2ccc(F)c(S(=O)(=O)Cc3ncon3)c2)c1	769057991	ZZZJLYDNFNFFJE-UHFFFAOYSA-N	436.812	1.860	50	20	IDGD	
C[C@]1(c2cccc(C(=O)NNc3nc(Br)cn4ccnc34)c2)NC(=O)NC1=O	769165414	ACULDLMJLDOKMH-QGZVFWFLSA-N	444.249	1.303	50	20	IDGD	
CCc1c(C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cnn1-c1ccc(OC)cc1	769848560	DLTSJBLUQYYOTE-UHFFFAOYSA-N	442.497	1.922	50	20	IDGD	
COc1ccnc(NNC(=O)CN2C(=O)N[C@@](C)(c3ccc(Br)cc3)C2=O)n1	771262035	ASKCGCJOIASFCX-KRWDZBQOSA-N	449.265	1.158	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1cc(C(C)C)nc2c1c(O)nc(=O)n2CC(C)C	771992379	GANDGSQYMUKFNK-GFCCVEGCSA-N	447.492	1.379	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)[C@H]1CCCN(C(=O)c2ccc3n[nH]cc3c2)C1	772068678	NFMBFCGYWLYDLZ-HOCLYGCPSA-N	443.504	1.540	50	20	IDGD	
Cc1ccn(CC(=O)NNc2nc3ccccc3c(=O)n2CCCOC(C)C)c(=O)c1	772278056	KMRHXPSXEJLWBF-UHFFFAOYSA-N	425.489	1.825	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@@H](C)C(=O)NNC(=O)[C@@H](C(C)C)N1CCCS1(=O)=O	772629274	DCROVMCYBKHQMK-GOEBONIOSA-N	445.969	1.932	50	20	IDGD	
CC(C)(C)OC(=O)NC1(C(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)CCCC1	772889229	CIEVLMUEMMCKGN-UHFFFAOYSA-N	438.912	1.941	50	20	IDGD	
N#CCCn1cc(/C=C(/C#N)C(=O)OCCN2CCCS2(=O)=O)c(-c2ccccc2)n1	773096458	OYKGGJXWEBLXNV-JXAWBTAJSA-N	439.497	1.949	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)c1ccc(F)c(S(=O)(=O)N(C)C)c1	773171193	HYEXCKWOIRULIC-LLVKDONJSA-N	443.884	1.958	50	20	IDGD	
CC(=O)Nc1cc(C)c(S(=O)(=O)NNC(=O)c2cnn(C)c2)cc1Br	774618186	ITOKDWNCPIUZLM-UHFFFAOYSA-N	430.284	1.073	50	20	IDGD	
O=C(NCCc1cnccn1)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1	774697245	KXGPKFUWXOBZIX-QFIPXVFZSA-N	430.512	1.977	50	20	IDGD	
Cc1nnccc1NC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	776484398	HBRNSCQFWJEAJP-UHFFFAOYSA-N	440.485	1.730	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)N[C@H]2CCCN(Cc3cccc(C(F)(F)F)c3)C2=O)cn1	777753327	WNBGDOWHVAZBCR-HNNXBMFYSA-N	438.410	1.574	50	20	IDGD	
CC[C@@H](C)Oc1cc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)ccn1	777759548	RACNYFKUAPDBNU-CQSZACIVSA-N	449.533	1.653	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(F)(F)c2ccccc2OCC(=O)N(C)C)c1	778525613	YRDHYVNHGXMQLV-UHFFFAOYSA-N	435.427	1.780	50	20	IDGD	
CC[C@@H](NC(=O)NNC(=O)CNC(=O)OC(C)(C)C)[C@H]1CN(Cc2ccccc2)CCO1	778699333	FIGKFSJEMOYVHM-QZTJIDSGSA-N	449.552	1.521	50	20	IDGD	
CCC[C@H]1C[C@@H](C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)CCO1	780522443	VBBQSASTJTYBBF-HOTGVXAUSA-N	425.555	1.056	50	20	IDGD	
CC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)CCNC(=O)OC(C)(C)C	780974300	USVRORZOQMVLAZ-QGZVFWFLSA-N	431.493	1.277	50	20	IDGD	
CC(C)C(=O)Nc1nc(CC(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cs1	782351664	MQEPFLQUSQGXNC-UHFFFAOYSA-N	449.445	1.193	50	20	IDGD	
COc1cc(F)c(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)cc1F	783263185	IGNKNSUFNYUHNV-UHFFFAOYSA-N	443.432	1.137	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)[C@H]2CC=CC[C@@H]2C(=O)N2CCOCC2)cc1OC	784297602	YOXULQRMFJZROO-IRXDYDNUSA-N	431.489	1.296	50	20	IDGD	
O=C(NNc1ccc(Br)cn1)C(=O)Nc1ccc(CN2CCOC2=O)cc1	784340278	VUGXJHUJIAJYIG-UHFFFAOYSA-N	434.250	1.878	50	20	IDGD	
CNS(=O)(=O)CCNC(=O)NNC(=O)c1cn(-c2ccccc2)nc1-c1ccccc1	784659569	XWPRUMVIOXJOHC-UHFFFAOYSA-N	442.501	1.033	50	20	IDGD	
CS(=O)(=O)c1ccccc1-n1cc(NC(=O)C(=O)NNc2cccc([N+](=O)[O-])c2)cn1	784833851	RYFFSELPDQXQMZ-UHFFFAOYSA-N	444.429	1.266	50	20	IDGD	
CCOC(=O)c1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)cc1	784835455	AAWKLWXUVSCPBX-UHFFFAOYSA-N	441.412	1.941	50	20	IDGD	
Cc1cc(NC(=O)COC(=O)/C(C#N)=C\c2ccccc2)n([C@@H]2CCS(=O)(=O)C2)n1	785343401	FFQJUZBAGCKWNX-LPPOOGIUSA-N	428.470	1.640	50	20	IDGD	
O=C(Cc1ccccc1CO)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	787439422	JTUQNTXDUSVIIV-UHFFFAOYSA-N	430.936	1.340	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2ccc(C)c(C(=O)NNC(=O)N3CCN(C)CC3)c2)cc1	788166531	PMXZAJNAWGXOJU-UHFFFAOYSA-N	445.545	1.706	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2cc([C@H]3CCCOC3)nn2C)c1	790951815	MALGJYSMOOLLLM-HNNXBMFYSA-N	429.477	1.096	50	20	IDGD	
COc1ccc(OC)c(C2=NO[C@@H](C(=O)NNC(=O)c3cnn(-c4ccccc4)c3)C2)c1	791589927	TZQLLVSIZMOPHR-HXUWFJFHSA-N	435.440	1.844	50	20	IDGD	
O=C(NNC(=O)c1ccccc1Br)C(=O)Nc1ccc2c(c1F)CCNC2=O	793023164	JSVHGTAJGYBHGI-UHFFFAOYSA-N	449.236	1.274	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)c(F)cc1C	793024809	FNAHCNQDIAKUSO-KRWDZBQOSA-N	429.404	1.400	50	20	IDGD	
CSSCCNC(=O)C(=O)Nc1ccc(F)c(NC(=O)CCN2CCOCC2)c1	793076950	WUNDMUQDGZKDJX-UHFFFAOYSA-N	444.554	1.552	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNS(=O)(=O)c2ccc(C#N)c(F)c2)CC1	793393840	IFMZRQDTSIFBIK-UHFFFAOYSA-N	441.485	1.589	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C2CCN(S(=O)(=O)c3ccc4c(c3)CCC4)CC2)n1	794077773	ZOADWTFQJXFRBU-UHFFFAOYSA-N	442.541	1.741	50	20	IDGD	
Cn1c(N)c(C(=O)/C(C#N)=C\c2cnn(-c3ccc(C(F)(F)F)cc3)c2)c(=O)n(C)c1=O	794688065	WBKARVLQWRLWNX-GHXNOFRVSA-N	444.373	1.661	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNC(=O)C(=O)Nc1ccc2scnc2c1	797369979	RYPRCCLMENBVHB-UHFFFAOYSA-N	427.442	1.309	50	20	IDGD	
COC(=O)c1c(NC(=O)C(=O)NNC(=O)c2cccc(C)n2)sc2c1CCCCC2	797371570	ZQLLQQNXNXWRAU-UHFFFAOYSA-N	430.486	1.907	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)Nc1cc(S(=O)(=O)N2CCCC2)ccn1	797675390	RUWKQIGGJZITQD-UHFFFAOYSA-N	433.490	1.236	50	20	IDGD	
CC(C)CCn1nc(C(=O)NNS(=O)(=O)c2ccc(C#N)s2)c2ccccc2c1=O	797815783	XVCHNSQBMLLZCU-UHFFFAOYSA-N	445.526	1.999	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)CNC(=O)COc2ccccc2)c(OC)cc1Cl	802078089	FVCOAPAIVVNDCZ-UHFFFAOYSA-N	436.852	1.705	50	20	IDGD	
O=C(CCC/N=C1/NS(=O)(=O)c2ccccc21)NNC(=O)c1cc(Cl)ccc1O	802599627	ZQMNXPHIPITUEJ-UHFFFAOYSA-N	436.877	1.326	50	20	IDGD	
COC(=O)N(C)NC(=O)c1ccc(NC(=O)C[C@@H]2SC(N3CCCC3)=NC2=O)cc1	804125171	NMWIQSWHEVMEJI-AWEZNQCLSA-N	433.490	1.452	50	20	IDGD	
NC(=O)c1ccc(/C=C\C(=O)N2CCC[C@H]2C(=O)NNc2nccnc2C2CCC2)cc1	805461504	FZPUETONWDKOFS-YFWYWMRJSA-N	434.500	1.991	50	20	IDGD	
C[C@H]1CN(C(=O)Cn2cc(NC(=O)NNc3nccnc3C3CCC3)cn2)C[C@H](C)O1	806325416	FJLJKMOSWFZSFR-KBPBESRZSA-N	428.497	1.725	50	20	IDGD	
C[C@H](C#N)S(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1	806458994	RZJHOVFPBBRDJY-PXAZEXFGSA-N	430.442	1.365	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2cc3n(n2)CCCC3)c1	806717885	AUPUYIPLNBHNQX-UHFFFAOYSA-N	434.522	1.716	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2cccc(F)c2Cl)c1	806973709	JPIUDUKGOUKIOX-UHFFFAOYSA-N	442.856	1.129	50	20	IDGD	
CCN(CC)CC(=O)Nc1cccc(NC(=O)C(=O)NNc2cnc3ccccc3n2)c1	806983926	JHKWMISHCQZOJW-UHFFFAOYSA-N	435.488	1.992	50	20	IDGD	
CN1CCC(Oc2ccc(CNC(=O)NNC(=O)COc3ccc(C#N)cc3)cc2)CC1	807254624	FNPIUSDPRFQPLL-UHFFFAOYSA-N	437.500	1.941	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNc2ncccc2F)cc(Br)c1F	807300710	IWMZQSJJFHQZTP-UHFFFAOYSA-N	429.177	1.991	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)N[C@@H]1CCCN(C(=O)N2CCCC2)C1	807458088	SITKLLJXOQYFBN-OAHLLOKOSA-N	441.492	1.202	50	20	IDGD	
O=C(NCc1noc2c1CCCC2)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	807619182	WWZHPTWHRGIUJB-UHFFFAOYSA-N	447.517	1.482	50	20	IDGD	
CCCS(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1	808071012	JXXUDRRHTFERKU-UHFFFAOYSA-N	440.499	1.265	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3ccnc(C(F)(F)F)c3)cc2)CC1	809665483	YHDJLZJELGLJHF-UHFFFAOYSA-N	443.451	1.793	50	20	IDGD	
N#Cc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(Br)cc2)cc1F	810384900	KNXFTHDLOTWXAV-UHFFFAOYSA-N	435.209	1.625	50	20	IDGD	
O=C(CNS(=O)(=O)c1cccc(Br)c1)NNc1ncccc1[N+](=O)[O-]	810528994	YXGMJRXKOTUOHZ-UHFFFAOYSA-N	430.240	1.174	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NC[Si](C)(C)c1ccccc1	812214506	UYZVWLZIDRICPE-UHFFFAOYSA-N	433.610	1.387	50	20	IDGD	
O=C(NNC(=O)C(=O)N1CCN(c2ccccc2)CC1)Nc1ccc(OC(F)F)cc1	813575778	DAZZWYBUBQQARY-UHFFFAOYSA-N	433.415	1.790	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CSc2nnc3ccc(Br)cn23)c1	814785905	MYLZTTGZHRCHAX-UHFFFAOYSA-N	431.275	1.917	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCc2nncn2C1)C(=O)Nc1cc(Cl)ccc1N1CCCCC1	815692399	QDODBZKBTCKNKT-ZDUSSCGKSA-N	445.911	1.270	50	20	IDGD	
CN(C/C=C\C(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1)CC(F)(F)F	816087904	PYZGTDOKLKTSJK-SREVYHEPSA-N	437.463	1.672	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)/C=C\c1ccccc1)C(=O)NNc1nnc(C)c(O)n1	817278412	AGFFDPLQIUFMCH-RBJHHQRMSA-N	438.535	1.041	50	20	IDGD	
COc1cccc(/C=C(/C(=O)NNC(=O)COc2cc(C)ccc2C)n2nnnc2C)c1	818023666	NWJTZMMTIMGVDN-UNOMPAQXSA-N	436.472	1.831	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)[C@H](CC(C)C)N2C(=O)[C@H]3CC=CC[C@H]3C2=O)cc1	913431302	CZHUGUPZAPZQAL-OTWHNJEPSA-N	426.517	1.920	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2cccc(C(=O)NNC(=O)NC3CCCCC3)c2)C[C@H](C)O1	913449222	LZBALVVPUKCRQC-GJZGRUSLSA-N	438.550	1.761	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)CCc1c(C)nc2c(C#N)cnn2c1C	914775530	SLMLDJIMXUJMHQ-UHFFFAOYSA-N	436.472	1.776	50	20	IDGD	
COc1ccc(O)c(C=NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1	915915104	OCQIIRUOUMUUOB-UHFFFAOYSA-N	447.513	1.505	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)NC2CCN(S(C)(=O)=O)CC2)cc1OC	916237712	FUUAMDPMGDXRIJ-UHFFFAOYSA-N	442.538	1.242	50	20	IDGD	
CNS(=O)(=O)c1ccc(C(C)=NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1	916271994	OTXINADAGJWBPR-UHFFFAOYSA-N	443.573	1.647	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)N[C@@H]3C[C@H]4C[C@H]3[C@@H]3CCC[C@H]43)nc2)CC1	916585147	QCFNSNLFOFCMEG-RXABAKJHSA-N	448.593	1.469	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)N1CCc2sccc2C1	916619343	IOGBPDRMNWIDCG-CYBMUJFWSA-N	436.559	1.542	50	20	IDGD	
O=C(NCc1ccc(S(=O)(=O)N2CCCC2)cc1)NNC(=O)c1ccc([N+](=O)[O-])cc1	916647880	OYABBBSLRUBDTF-UHFFFAOYSA-N	447.473	1.524	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)NCc1cccc(CN2CCOCC2)c1	918223461	HUGDPOBMYHIRDO-UHFFFAOYSA-N	443.460	1.336	50	20	IDGD	
CCS(=O)(=O)N1CCC(C(=O)NNC(=O)c2ccc(C)cc2O)(c2ccccc2)CC1	918337816	VFOXYORVUHBDLD-UHFFFAOYSA-N	445.541	1.845	50	20	IDGD	
CC(C)(C)c1cc(NC(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)n(-c2ccc(F)cc2)n1	920933311	SUKJYJIJEQGNHI-LBPRGKRZSA-N	437.497	1.896	50	20	IDGD	
CC(=O)N1CCC[C@@H](CNC(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)C1	1116879703	KVHVUSUGDCYSKC-HNNXBMFYSA-N	425.530	1.222	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NN=C[C@H](C#N)C(C)C)N(S(C)(=O)=O)CC2	1319380781	LIMRYOLRQXPCMY-RDJZCZTQSA-N	436.534	1.850	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)Cc1ccc(S(=O)(=O)CCO)cc1	1320865980	RVOMEAPHMDPEOY-ZDUSSCGKSA-N	440.905	1.263	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H]1C[C@@]13C(=O)Nc1ccccc13)C2)[C@@H](F)Cl	1778027818	AQCUIZHNAXOHEC-LTAPKTKJSA-N	449.910	1.945	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc3nncn3c2)C1	1779073686	SFZRQRPQLJICSE-RZQQEMMASA-N	435.912	1.111	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CO[Si](C)(C)C)C1)N1C[C@H]2C[C@@H]2C1	1779545535	VUFJJVNYQLNTHV-ACMVSEJYSA-N	437.657	1.692	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)Cc1ccccc1)C2	1779546397	USGGCGDTHSYTJW-MIZPHKNDSA-N	448.636	1.955	50	20	IDGD	
C#CCCCC(=O)N1CCO[C@]2(CCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1	1780098708	RALZFFQUXJRDLS-JOCHJYFZSA-N	443.456	1.767	50	20	IDGD	
N#Cc1cc(CC(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](F)Br)C3)C2)ccc1F	1781333273	NHPVTBSVAZFQTM-WMZOPIPTSA-N	442.260	1.760	50	20	IDGD	
C/C=C/C=C\C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2	1781729922	DNLXSISHIHMWNS-RRCJGGNMSA-N	441.532	1.767	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)C3CCC4(CC3)OCCO4)C2)C1	1782943924	FAXXWWKTUMLSMQ-RTBURBONSA-N	449.375	1.986	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(C1)CN(C(=O)C(C)(C)NC(=O)OC(C)(C)C)CCO2	1783871815	WBCZIRHYPRKTMX-JLTOFOAXSA-N	447.960	1.373	50	20	IDGD	
Cc1ccc(C)c(CC(=O)N2CCO[C@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)c1	1783936177	FEOWYGZKUZFUCT-QHCPKHFHSA-N	430.549	1.049	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CC3CCN(C)CC3)C[C@@H]21	1783964153	LLTNSEARXQYLOE-DKIMLUQUSA-N	444.414	1.729	50	20	IDGD	
O=C(CN1CCc2sccc2C1)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21	1785101220	HSXFUVINIVZERZ-KKUMJFAQSA-N	446.400	1.890	50	20	IDGD	
C[C@H](C(=O)Nc1ccc(C2(NC(=O)[C@@H](O)CCl)CCC2)cc1)[C@@H]1SC(=N)NC1=O	1788633824	YVNRFJBIDWBJLF-BPNCWPANSA-N	438.937	1.523	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)Nc3ccccn3)[C@H]2C1	1788783333	QNJOYAXIKZCNLO-QXKUPLGCSA-N	439.354	1.645	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccnc(Cl)n3)[C@H]2C1	1788875428	MRVFNBRNBPXURG-YDHLFZDLSA-N	426.977	1.575	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(C#N)cc(OC)c3)[C@H]2C1	1789258959	BYQWBABBHANTOH-FZDIXFNVSA-N	435.908	1.414	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc4[nH]ncc4c3)C[C@@H]21	1789867829	GWRXNMXMHMZWMX-MBIOBJJBSA-N	440.331	1.788	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccn4ccnc34)C[C@@H]21)[C@@H](F)Br	1789926165	PNFIKAVVSBPKAQ-CYUUQNCZSA-N	439.285	1.618	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=N/N3CCCCC3)C[C@@H]21)[C@@H](F)Br	1789926434	XZDJWEZWDMVZFB-VCGYHUMSSA-N	433.322	1.128	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CC3CCN(C)CC3)C[C@@H]21	1790962062	PBDZGMLKKRKSPM-XSLAGTTESA-N	444.414	1.872	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN3CCCCC3=O)[C@H]2C1	1791181981	DCRSCENKUIUNNA-XLPNERPQSA-N	434.364	1.215	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3ccccc3F)C[C@@H]21	1791256367	NYUZKZIDQCQXLC-DWRORGKVSA-N	426.916	1.992	50	20	IDGD	
Cc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)CBr)n(C(F)F)n1	1792872464	JFSSKXIRPRSORA-ZKCLLBTKSA-N	449.296	1.821	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@@H](C)C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](F)Cl)C3)cc1	1793146814	IPJMQHNEQVKBSZ-KSXIZUIISA-N	445.944	1.834	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ncc(F)cc1F	1793575168	UWBHGVYNDYAJSM-DYNIEEOBSA-N	432.265	1.594	50	20	IDGD	
Cc1ccc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)CBr)C3)cn1	1794045697	VSWQMTZDECRPPF-UEILYKACSA-N	438.366	1.943	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Cl	1796368894	RSVVNUFBTSEJIJ-AIEDFZFUSA-N	433.908	1.510	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(F)(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Cl)C1	1796370962	PRCAURLMGDPRJW-YVECIDJPSA-N	437.871	1.069	50	20	IDGD	
COc1cscc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnccc1C(=O)NN)C2	1797162699	RAWXHJQIAPLTAO-CLLJXQQHSA-N	429.502	1.321	50	20	IDGD	
O=C(CCBr)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(=O)nc2sccn12	1799095288	MBPPUPLVSMXYSL-ZSBIGDGJSA-N	439.335	1.793	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cncc3cnccc13)C2)[C@H](F)Br	1799348803	PVDQWTGYSYXSTK-VZAMPYOESA-N	437.269	1.524	50	20	IDGD	
CCN(CC)C[C@H](C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)CBr)C2	1800218286	NQUKZWYHCWRCOB-VIQHNZTISA-N	432.403	1.585	50	20	IDGD	
CCS(=O)(=O)c1ccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Cl)C3)cc1	1800431653	WURFTTZRVJSXRW-DACLVMHWSA-N	446.928	1.147	50	20	IDGD	
CO[C@@H](C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](Br)Cc1ccccc1	1800435954	GEOCVFQNNAOUBA-MWTISTBLSA-N	439.350	1.617	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1sc(N)nc1C)C2	1800639828	OHXWRQUSINSIIA-USZNOCQGSA-N	431.356	1.410	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnoc1COC)C2	1800641217	SAEUYBARGQTAET-WJNVRWDZSA-N	430.299	1.198	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1occc1Br)C2	1802336231	KFULYZOVBPDUNK-CLLJXQQHSA-N	441.326	1.667	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)[C@@H]2CC=CCC2)[C@H]1c1cccnc1	1803033403	LQRQSEMEHOUECY-SFGWALBWSA-N	427.549	1.817	50	20	IDGD	
COc1cccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)c1F	1803994854	AIKZLHQHPWPLMN-BJWYYQGGSA-N	426.253	1.080	50	20	IDGD	
CN(C)C(=O)c1cccc(C(=O)N2CCC3(CCCN(C(=O)[C@@H](O)CCl)C3)CC2)c1	1805529081	JMSKDZQTWVNGEO-SFHVURJKSA-N	435.952	1.833	50	20	IDGD	
Cc1noc(C)c1C(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1805538581	SOVASYZDWFWNBQ-UTKZUKDTSA-N	442.520	1.379	50	20	IDGD	
Cc1[nH]ccc1C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1807375453	PFMCBYPYWRSUOS-RXVVDRJESA-N	432.289	1.031	50	20	IDGD	
C[C@@H](Cc1ccco1)C(=O)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1	1809980187	KMKAYYBVZWGPKJ-SFHVURJKSA-N	438.333	1.683	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H](CNC(=O)[C@@H](O)N2CCOCC2)[C@H]1c1cccnc1	1810350322	XXGCSRGVTQLZRA-ZHALLVOQSA-N	438.956	1.003	50	20	IDGD	
Cc1ccc(C(=O)C(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)cc1	1812962000	YLAOWJXMHNYLPF-IPMKNSEASA-N	429.904	1.878	50	20	IDGD	
Cc1cncc(C(=O)N2CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)c1	1813070360	ICTFAIJHVAUOFD-GCJKJVERSA-N	438.532	1.478	50	20	IDGD	
CC(=O)N[C@H](C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](C)CBr)n[nH]1	1814783268	MLVJITOCAYCVPG-MISXGVKJSA-N	428.331	1.957	50	20	IDGD	
COC(=O)[C@@H]1CC[C@H](C(=O)Nc2cc([C@H]3CCCCN3C(=O)[C@@H](O)CCl)[nH]n2)C1	1814859506	WMPUTYSSXQNASX-MXYBEHONSA-N	426.901	1.591	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@](C)(O)C(F)(F)F)n[nH]1	1815533539	NKCRBVHCUYGZDM-ZSGNIPIJSA-N	426.823	1.969	50	20	IDGD	
O=C([C@@H](O)CCl)N1CCCC[C@H]1c1cc(NC(=O)C(F)(F)C(F)(F)C(=O)O)n[nH]1	1815563308	KJKCYSFNCWNCOJ-IUCAKERBSA-N	444.769	1.357	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](N)CCC(N)=O)n[nH]1	1817249014	BVUIPDUWZGOHMR-GMXVVIOVSA-N	443.346	1.168	50	20	IDGD	
O=C(N[C@@H]1CCc2nc(NC(=O)C3(F)CCCCC3)sc2C1)c1cccc(B(O)O)c1	1818743696	VEZVNOVCVPXUHH-OAHLLOKOSA-N	445.325	1.721	50	20	IDGD	
O=C(N[C@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1)c1ccc(O)nn1	1823001682	JBJWWQDLQUKSSO-KGFZYKRKSA-N	430.259	1.555	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)[C@@H](O)CCl)CC2)n1	1825409096	QQGSDYYNUTYHBF-ROUUACIJSA-N	436.940	1.873	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H]1CNC(=O)O1)CC2	1825441527	ZMEGRIYNQGWPCG-NRPADANISA-N	431.312	1.337	50	20	IDGD	
CCn1ccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)n1	1826094368	NRYAOIKNHPQNBN-LJQANCHMSA-N	432.569	1.509	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](C)n3cnnn3)sc2C1	1826973974	WFOFOZUUUSUHGY-OPRDCNLKSA-N	442.343	1.334	50	20	IDGD	
Cc1nccn1[C@@H](C)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCC(=O)NN(C)C)CC2	1827042393	CUPCADYQEFIDNY-GXTWGEPZSA-N	447.565	1.194	50	20	IDGD	
O=C1NCCCn2nc(C(=O)N3CCCC[C@H]3C3CCN(C(=O)[C@H](F)Cl)CC3)cc21	1828500300	MZJUPOOXHIJUDF-RDJZCZTQSA-N	439.919	1.784	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4nc[nH]c4c3)C2)C1	1830362405	VNJKINGUVTWJBQ-OAQYLSRUSA-N	434.924	1.898	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cncc(F)c3)C2)C1	1830537313	DDXZJGNADORGAS-FZKQIMNGSA-N	444.301	1.322	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1830732831	BMLSOYGUAIRSHA-KXBFYZLASA-N	447.315	1.018	50	20	IDGD	
Cc1cc(C)cc(CCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)c1	1830738663	RRFJSBGACVOVPW-SIKLNZKXSA-N	438.952	1.292	50	20	IDGD	
O=C(C(Cl)Cl)N1CCOC[C@@]2(C1)CN(C(=O)C1(c3ccc(O)cc3)CC1)CCO2	1830813407	YTHQVKILWNMDPE-LJQANCHMSA-N	443.327	1.684	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3cccc(OC)n3)CCO2)C1	1832762757	GHSDOBIBMSFWJE-LAUBAEHRSA-N	439.940	1.497	50	20	IDGD	
COc1cccnc1CCC(=O)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1832869691	DCCVEKWZVLEUDL-LJQANCHMSA-N	446.331	1.283	50	20	IDGD	
COc1ncccc1CCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1833000355	PWZIKEALWFAZLC-QFBILLFUSA-N	429.876	1.014	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(F)s3)CCO2)C1	1833212458	VDMJPEXJMADJBA-SJKOYZFVSA-N	449.342	1.988	50	20	IDGD	
Cn1cnc(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](F)Br)CC3)CC2)c1	1834286679	OHMRJTGKKFAYQG-OAHLLOKOSA-N	430.322	1.296	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](C)CBr)C3)C2)nc1	1834371732	QCANXNPEHMPNQP-HNAYVOBHSA-N	440.338	1.491	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccn(CC)n3)CCO2)C1	1834408944	LULGHAZWUFGUDE-KBXCAEBGSA-N	443.342	1.147	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnc(OC)c(C)c3)CCO2)C1	1834579526	AKPQMVKYFQWWCN-JXFKEZNVSA-N	425.913	1.486	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC1CCN(C2CCN(C(=O)C3CCOCC3)CC2)CC1	1835833493	JWZRAOINPJXZLT-UHFFFAOYSA-N	425.646	1.836	50	20	IDGD	
CC[S@@](=O)CCC(=O)N1CCC(N2CCC(NC(=O)CO[Si](C)(C)C)CC2)CC1	1835837020	MEBNOLBTENBAHJ-MUUNZHRXSA-N	445.702	1.568	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(F)c(C)c3N)CCO2)C1	1835875525	YZDJMNKOQBUCLB-QRWLVFNGSA-N	443.903	1.040	50	20	IDGD	
CC(=O)N/C(C)=C/C(=O)N1CCC(N2CCC(NC(=O)[C@@H](F)Br)CC2)CC1	1836414131	YIJPNKOECUQVRB-FMQWLBJXSA-N	447.349	1.288	50	20	IDGD	
O=C(c1n[nH]c2c1CCCC2)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836717826	KTLHEBHZXWLXGO-GOSISDBHSA-N	438.956	1.500	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@H]3CCCS3(=O)=O)CC2)CC1	1836922730	OVSJJWASPSTLCE-ZWKOTPCHSA-N	449.013	1.970	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3n[nH]c4c(F)cccc34)CCO2)C1	1837058905	PIQUXIHNHFAPDQ-JLTOFOAXSA-N	438.887	1.789	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3cccs3)C2)C1	1837710330	VPGZHGUSPXIOQP-HXUWFJFHSA-N	440.638	1.989	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccnc(Cl)n1)CCO2	1837923981	CJSRKOYDUUEAFT-GOSISDBHSA-N	442.976	1.052	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3Cc4ccccc4CN3)C2)C1	1839144522	CVGBGZCWBKQZEL-WOIUINJBSA-N	435.952	1.175	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)CC3CCOCC3)C2)C1	1839151929	IJZPDEVERHQBMQ-OALUTQOASA-N	437.364	1.496	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3[C@H]4C=CS[C@@H]43)C2)C1	1839966681	MISKWBCQELRTKT-FQRJBHLQSA-N	445.379	1.491	50	20	IDGD	
COc1cccc(/C=C/C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)c1	1839994769	FBSUNWZBCIKQPX-HOHWPDKRSA-N	426.872	1.699	50	20	IDGD	
CC(C)n1nccc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2	1840033384	BYPJJNRUKHXIDR-KDOFPFPSSA-N	443.342	1.317	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(Cl)c3C)C2)C1	1840149779	ZXMDXLWFQVLATP-FXAWDEMLSA-N	445.343	1.972	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)Cc3ccco3)C2)C1	1840156131	IXIQXPILGHLUIN-KNBMTAEXSA-N	428.913	1.168	50	20	IDGD	
O=C(C(Cl)Cl)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3COc4ccccc4O3)C2)C1	1840186231	BVUFJGRTFIPHJY-HNAYVOBHSA-N	445.299	1.087	50	20	IDGD	
COc1ccccc1CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840189678	GNQZQRVWSYUEBD-LJQANCHMSA-N	431.316	1.498	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)Cn1ccnc1)CCO2	1840429525	VYTXBQOMHZPUGM-UWVAXJGDSA-N	426.945	1.383	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)c(O)c1	1840670721	RYFCTAUPUDBXQD-YJBOKZPZSA-N	445.285	1.461	50	20	IDGD	
Cn1cc(-n2cc(C(=O)N3CC4(CCCN4C(=O)[C@@H](O)CCl)C3)c3ccccc32)cn1	1841351314	RUJATAGDUUIYHA-IBGZPJMESA-N	441.919	1.781	50	20	IDGD	
C[C@@H](C(=O)N1CC2(CCCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C1)n1ccnn1	1841925425	UIJCPDAEOSLBGG-KBPBESRZSA-N	440.932	1.175	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@H](O)[C@H](C(=O)N2CCCC23CN(C(=O)C(C)(C)CCl)C3)C1	1845103949	PDLMSYZOPIBQFL-HUUCEWRRSA-N	443.972	1.683	50	20	IDGD	
Cc1nn2cc(CC(=O)N3CC4(CCCN4C(=O)[C@@H](F)Br)C3)nc2s1	1845216245	FCLDDXFHPDTOAL-GFCCVEGCSA-N	430.303	1.536	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)[C@H]2CCc3cccc(Cl)c32)C1	1845867539	FTCRKGJPXDFHKU-INIZCTEOSA-N	432.952	1.946	50	20	IDGD	
O=C(c1c[nH]c(=O)cn1)N1CC2(CCCN2C(=O)[C@H](Br)Cc2ccccc2)C1	1845942269	VXQRUEFKVFBXKR-OAHLLOKOSA-N	445.317	1.593	50	20	IDGD	
Cn1c(CC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2cnccc2C(=O)NN)cc2ccccc21	1847461616	YZMQRAMPNWBWEB-SFTDATJTSA-N	446.511	1.235	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)cc(Cl)c1OCC(N)=O	11237147	UNNROFFJMXBGMM-JTQLQIEISA-N	439.827	1.580	50	20	IDGD	
O=C(NNC(=O)c1cc(Cl)ccc1F)c1cccc(S(=O)(=O)N2CCOCC2)c1	15424946	BUVORJOQYILBHB-UHFFFAOYSA-N	441.868	1.575	50	20	IDGD	
CCCn1c(CCC(=O)NNC(=O)c2ccccc2O)nc2cc(S(N)(=O)=O)ccc21	17575208	HXDWPFSSHJSCIU-UHFFFAOYSA-N	445.501	1.193	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2cc(-c3ccccc3)n[nH]2)nnn1-c1cccc([N+](=O)[O-])c1	24491601	ODLRJDHKTMFFNK-UHFFFAOYSA-N	432.400	1.949	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)c1sccc1S(=O)(=O)N1CCCC1	25322765	WFAWKINHJNQGJR-LBPRGKRZSA-N	441.506	1.900	50	20	IDGD	
CN(C)C(=O)Cn1cc(C(=O)NNC(=O)CCCOc2ccc(Cl)cc2Cl)nn1	108922553	AFGVCHQHKDMUCK-UHFFFAOYSA-N	443.291	1.293	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)[C@@H]1CCCN1S(=O)(=O)c1cccs1	109845811	QPSWGKFJSPXSQL-AWEZNQCLSA-N	438.531	1.169	50	20	IDGD	
C[C@@H]1CCCN(Cc2ccc(CNC(=O)NNC(=O)CNC(=O)c3ccco3)cc2)C1	725872771	RSHKSOSGESLQFV-MRXNPFEDSA-N	427.505	1.772	50	20	IDGD	
CCc1[nH]nc(C(=O)NNC(=O)[C@H](C)Oc2cccc(Br)c2)c1[N+](=O)[O-]	726382320	PXQZWSIXLNTAGN-QMMMGPOBSA-N	426.227	1.871	50	20	IDGD	
O=C(NNC(=O)c1ccc[nH]1)c1ccc(Cl)c(S(=O)(=O)NC[C@@H]2CCCO2)c1	726629597	JKPIBBOFHQDLJE-LBPRGKRZSA-N	426.882	1.200	50	20	IDGD	
COc1cc(C(=O)NNC(=O)N[C@@H]2CCc3nc(C)nn3C2)ccc1OCCC(C)C	727228989	KRPZEVGSFUKMHG-MRXNPFEDSA-N	430.509	1.979	50	20	IDGD	
C#Cc1cccc(NC(=S)NNC(=O)CCNS(=O)(=O)c2ccc(OCC)cc2)c1	727501592	ZRXAJMHCFRNZJE-UHFFFAOYSA-N	446.554	1.753	50	20	IDGD	
COc1cccc(CO[C@H](C)C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1	728326017	AWUDBYAIAAYXRX-KUHUBIRLSA-N	444.440	1.131	50	20	IDGD	
COc1cc(C=NNC(=O)[C@H](C)NS(C)(=O)=O)cc(OC)c1OCc1ccccc1	728434153	JAWBXBOESVKEGV-AWEZNQCLSA-N	435.502	1.671	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@H]2CCCN2C(=O)CNC(C)=O)ccc1OCCC(C)C	728513080	QJXQGJNMIDKKGZ-QGZVFWFLSA-N	448.520	1.008	50	20	IDGD	
Cn1c(C=NNC(=O)c2ccc(Br)cc2Cl)nc2c1c(O)nc(=O)n2C	728782200	JHLGBLFBSKYAKU-UHFFFAOYSA-N	439.657	1.552	50	20	IDGD	
C[C@H](C(=O)Nc1cccc(F)c1)N1CCN(C(=O)NNC(=O)Cc2cccnc2)CC1	728957245	ONTWBARFMJTEFV-OAHLLOKOSA-N	428.468	1.149	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)O[C@H](C)C(=O)N[C@@H]2CCS(=O)(=O)C2)c(C)n1CC(C)C	729254448	BXJHRNJNDYLNOZ-ZZZURREISA-N	435.546	1.903	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1cccc2c1O[C@H](C)C(=O)N2	729300965	UPQKFNNRINBHBP-LLVKDONJSA-N	431.474	1.082	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NN[C@@H](C(N)=O)c2ccc(Br)cc2)c1	729677029	YCMMACOAHDLWOI-CQSZACIVSA-N	426.292	1.314	50	20	IDGD	
Cc1c(/C=C(\C#N)C(=O)N2CCC(C(=O)NCCCN3CCCC3)CC2)cc(C#N)n1C	733975288	NUHIWVLGJOYZKM-KGENOOAVSA-N	436.560	1.953	50	20	IDGD	
C[C@@H](CC(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)S(=O)(=O)c1ccc(F)cc1	734240448	REESKAARRWRIMM-LBPRGKRZSA-N	446.501	1.233	50	20	IDGD	
O=C(NNC(=O)N1CCN(c2cccc(F)c2F)CC1)c1ccc(-n2cnnn2)cc1	734517065	OFRBVWQJNXIQHV-UHFFFAOYSA-N	428.403	1.117	50	20	IDGD	
COc1ccc(CN2CC[C@H](NC(=O)NNC(=O)[C@@H](C)Oc3ccccc3F)C2=O)cc1	734685816	VVTUNGLASPTDKY-KDOFPFPSSA-N	444.463	1.733	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)N[C@@H](C)C(=O)N2CCCC[C@@H]2C)c2ccccc2c1=O	737053931	FXZKETLQCZIPKU-GJZGRUSLSA-N	442.520	1.711	50	20	IDGD	
CC(=NNC(=O)CNc1ccc(C)cc1)c1cccc(S(=O)(=O)N2CCOCC2)c1	739400280	OYLSVCQSLYHOLH-UHFFFAOYSA-N	430.530	1.968	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2ccc(C(=O)NNc3ncnc4[nH]cnc34)cc2)cc1	740746299	RQDRLFBFRHDRHY-UHFFFAOYSA-N	439.457	1.919	50	20	IDGD	
Cc1cc(N2C[C@@H](C(=O)NNc3ncnc4[nH]cnc34)CC2=O)ccc1Br	740746547	ONKKYFDHXXLDDI-JTQLQIEISA-N	430.266	1.920	50	20	IDGD	
CC(=O)N[C@H](Cc1c[nH]c2ccc(Br)cc12)C(=O)NNC(=O)c1ccc[nH]1	742037948	BJSMMQPBHWHKIQ-MRXNPFEDSA-N	432.278	1.767	50	20	IDGD	
Cc1nn(C)c2sc(C(=O)N[C@@H](C)C(=O)NNc3nc(-c4cccnc4)no3)cc12	742073119	SJKJCQABCONRHW-JTQLQIEISA-N	426.462	1.650	50	20	IDGD	
CCOc1cc(C=NNC(=O)Cc2cc(O)nc(O)n2)cc(Br)c1OC	743445299	NSLGLIAEUXXBKH-UHFFFAOYSA-N	425.239	1.750	50	20	IDGD	
Cc1cccc2c(CCNC(=O)NNC(=O)c3csc(N4CCOCC4)n3)c[nH]c12	743510597	ZFYQLCARGHBGDX-UHFFFAOYSA-N	428.518	1.956	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)c2cc(Br)c3c(c2)OCO3)cc1	744849177	XJFVHGJBDWXZIK-UHFFFAOYSA-N	446.213	1.667	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)C[C@H](C)S(=O)(=O)c2ccc(F)cc2)c1	744957646	MREQNOVNMPTGLE-AWEZNQCLSA-N	436.461	1.691	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1cc([N+](=O)[O-])ccc1O)c1ccc(N2CCOC2=O)cc1	745779322	CKEHFRANTRUNQA-NSHDSACASA-N	429.389	1.962	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCc2sc(C)nc2C)cc1	745860924	GKHQJABUFBKWBZ-UHFFFAOYSA-N	425.536	1.219	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)[C@@H]2CCCN2C(=O)Nc2ccc3c(c2)OCCO3)c1	746218437	WVPAUSUVCWFDHP-KRWDZBQOSA-N	435.440	1.787	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1	751209154	LRFJUEZPSLPLAK-UHFFFAOYSA-N	431.474	1.450	50	20	IDGD	
Cc1nc(-c2cccnc2)nc(O)c1CCC(=O)NNC(=O)COc1ccc(C#N)cc1	751289793	FUDJRQBNGFMTGD-UHFFFAOYSA-N	432.440	1.583	50	20	IDGD	
COc1cc(OC)cc(-n2nnnc2CN(C)C(=O)/C(C#N)=C/c2cc(C#N)n(C)c2C)c1	752763909	YVXNQDISCLRFBC-OMCISZLKSA-N	446.471	1.764	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNS(=O)(=O)c2cc3ccccc3o2)cc1	753981594	NWSDRACZHBJNMX-UHFFFAOYSA-N	437.499	1.371	50	20	IDGD	
CC1(C)CN=C(N2CCN(C(=O)NNC(=O)c3cnn(-c4ccccc4)c3)CC2)S1	754108506	XSKSMPVEXHIODQ-UHFFFAOYSA-N	427.534	1.726	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@H](C)c1ccc([N+](=O)[O-])cc1F	754849106	KZTGIOQIDJEJFC-SNVBAGLBSA-N	437.453	1.900	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)Nc2cc(S(=O)(=O)NC)ccc2C)cc1OC	756523508	CCSXIFPIUNCCDA-UHFFFAOYSA-N	436.490	1.777	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)Nc1nc(SCc2ccccc2)ns1	757695874	LPJJROJKYSLJLY-NSHDSACASA-N	427.533	1.418	50	20	IDGD	
C[C@H]1C[C@H](NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)CN1Cc1ccccc1	757737611	DZAGIHURDHVPIZ-PXNSSMCTSA-N	437.548	1.686	50	20	IDGD	
COCc1nc2n(n1)C[C@H](NC(=O)NNC(=O)c1cc(C)n(-c3ccccc3)c1C)CC2	757777341	PVKIIOYIYNQMPB-MRXNPFEDSA-N	437.504	1.791	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)Nc1ccc2nc(N3CCOCC3)oc2c1	757778166	YYZISHXGCRNEJP-UHFFFAOYSA-N	441.444	1.905	50	20	IDGD	
Cc1nn([C@@H]2CCS(=O)(=O)C2)c(C)c1NC(=O)NNC(=O)c1cc(Cl)ccc1O	757871899	QUFPRYXYUHXHGQ-GFCCVEGCSA-N	441.897	1.685	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)CCc1nc2cc(C(F)(F)F)ccc2s1	758047918	ZNHQSFRBGGJWDF-QMMMGPOBSA-N	438.453	1.333	50	20	IDGD	
O=C(NNC(=S)NC[C@@H]1CCCCO1)c1cccc(S(=O)(=O)N2CCCCC2)c1	758171355	FTRPMPYMMZBSIA-INIZCTEOSA-N	440.591	1.539	50	20	IDGD	
CCCN(CCC)C(=O)CCC(=O)N1CCN(S(=O)(=O)CBr)CC1	758527390	JUUVHDXLOSPLIU-UHFFFAOYSA-N	426.377	1.242	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C1=NN(c2ccc(F)cc2)[C@@H](C(N)=O)C1	762360554	FODQOASWWIMMDX-OAHLLOKOSA-N	445.476	1.194	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)c2ccc3c(c2)C(=O)N(C[C@@H]2CCCO2)C3=O)n1	762909725	VNHXNEPJRJXUJJ-HNNXBMFYSA-N	438.488	1.855	50	20	IDGD	
CN(C)CCC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3n2)cc1	763453963	DMYRIUGEYPKQRD-UHFFFAOYSA-N	448.483	1.525	50	20	IDGD	
O=C(NNC(=O)c1ccncc1)C(=O)Nc1ccnn1Cc1ccc(OC(F)(F)F)cc1	763465473	XZQYCGDHFJBXOY-UHFFFAOYSA-N	448.361	1.625	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1ccccc1OC[C@H]1CCCCO1	763466057	GGMMPZNNEUIEKM-MRXNPFEDSA-N	442.428	1.942	50	20	IDGD	
CC(C)(C)NC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c1	763468395	JZHKJUYQSYZDSH-UHFFFAOYSA-N	427.417	1.523	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)n(-c2ccccc2F)n1	763472571	YRLUJGIPHKIQPT-UHFFFAOYSA-N	426.364	1.628	50	20	IDGD	
O=C(NNC(=O)c1cccnc1)C(=O)Nc1cc(C(=O)N2CCCCC2)ccc1Cl	763491543	NCHIDJZPIHVIRM-UHFFFAOYSA-N	429.864	1.761	50	20	IDGD	
COc1cc(C(=O)NNC(=O)N[C@@H]2CCCC[C@H]2N2CCOCC2)cc(OC)c1OC	763536453	PZPKLAZCJQEWFX-HZPDHXFCSA-N	436.509	1.300	50	20	IDGD	
O=C(COc1cccc(C(F)(F)F)c1)NNC(=O)C(=O)Nc1ccc2c(c1)CC(=O)N2	763639027	JBKXCUBWRXTPLA-UHFFFAOYSA-N	436.346	1.365	50	20	IDGD	
COC(=O)c1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)COc1ccccc1OC	763657477	NKOHYQRNSASBCX-UHFFFAOYSA-N	435.820	1.300	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2cc(F)cc(N3CCOCC3)c2)c1	763669381	WWYISXLPYMRXAF-UHFFFAOYSA-N	444.463	1.444	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)c(Br)c1	763674238	NZPABLAVDXUJFR-UHFFFAOYSA-N	431.246	1.794	50	20	IDGD	
Cc1cc(N2CCOCC2)ccc1NC(=O)C(=O)NNC(=O)COc1ccccc1F	763680958	XRONILVSWZETKI-UHFFFAOYSA-N	430.436	1.136	50	20	IDGD	
CC(=O)Nc1cc(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)c(F)cc1F	763684462	LTSZBBXVGXXMIU-UHFFFAOYSA-N	440.790	1.742	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)C(=O)Nc1ccc2nccnc2c1	763696204	UHGALGIYLHPCMD-UHFFFAOYSA-N	444.245	1.557	50	20	IDGD	
CCOc1cc(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)ccc1OC	763727940	HGXSQUZBYALILU-UHFFFAOYSA-N	426.473	1.633	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)C(=O)Nc1ccc(CC(F)(F)F)cc1	763804126	KQTWUWHFUBVXJN-UHFFFAOYSA-N	440.334	1.865	50	20	IDGD	
COCCn1nc(C)c(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCCCC3)c1C	763968412	PGBDSIMFMOGKSB-UHFFFAOYSA-N	433.534	1.876	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1cccc(-c2noc(C3CC3)n2)c1	764007060	YMCKNBMLWVEWPW-UHFFFAOYSA-N	449.423	1.785	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1cccc(OCCN(C)C)c1	764013138	VHLXMEWBWDCKCZ-UHFFFAOYSA-N	434.880	1.689	50	20	IDGD	
COC(=O)c1c(C2CC2)csc1NC(=O)C(=O)NNC(=O)Cc1ccccc1OC	764131006	COYZCSACYBSDHR-UHFFFAOYSA-N	431.470	1.749	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(-n3cccn3)c(Cl)c2)c1O	764131610	QPJZWMAQSHOVBV-UHFFFAOYSA-N	429.820	1.640	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc3c2OCCC3=O)o1	764138186	ACMZIZTYRFVYQM-UHFFFAOYSA-N	428.445	1.486	50	20	IDGD	
COC(=O)c1ccc(C(F)(F)F)cc1NC(=O)C(=O)NNC(=O)c1ccc(C#N)cc1	764177979	ZNGYHPWCXNQGST-UHFFFAOYSA-N	434.330	1.763	50	20	IDGD	
C[C@@H](c1ccc(NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)cc1)N1CCOCC1	764239528	NYVVHCRJJSTVEO-KRWDZBQOSA-N	449.511	1.821	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)C(=O)Nc1ccc(C(=O)NCC(F)(F)F)cc1	764319800	SJMHZYZQSGVUCZ-UHFFFAOYSA-N	440.353	1.446	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cnn(C(C)(C)C)c2)cc1Br	764326806	OMUBJHUMUICVJB-UHFFFAOYSA-N	438.282	1.809	50	20	IDGD	
CCN(Cc1ccccc1NC(=O)C(=O)NNC(=O)C(F)(F)Oc1ccccc1)C(C)=O	764380173	QMHWBBIUANYMQE-UHFFFAOYSA-N	448.426	1.813	50	20	IDGD	
COC(=O)CCOc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2F)cc1	764410523	PKUIPTUQKZJSTE-UHFFFAOYSA-N	437.811	1.821	50	20	IDGD	
CCOc1ccc(-n2c(SCC(=O)NNC(=O)NC)nnc2-c2cccnc2)cc1	765071458	YSZGNWVZNFXBHN-UHFFFAOYSA-N	427.490	1.780	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3ccc(-n4cccn4)cc3)CC2)cc1	765748875	RVSHNCLUYMJTCW-UHFFFAOYSA-N	432.528	1.760	50	20	IDGD	
CN1CCN(C[C@H](NC(=O)NNc2ccccc2S(C)(=O)=O)c2ccccc2)CC1	765826253	TWUIDXASFNJQFC-IBGZPJMESA-N	431.562	1.705	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)nc1Cl	766334343	VGYHGIINRVIPTO-UHFFFAOYSA-N	438.893	1.603	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)cc1OC(F)F	767246137	BGOUIOKYMKXESU-UHFFFAOYSA-N	432.428	1.365	50	20	IDGD	
CC(=O)N1CCc2c(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc3ccc(F)cc3)cccc21	769266714	PTYXYZYVLQXCHW-GFCCVEGCSA-N	428.420	1.288	50	20	IDGD	
C[S@@](=O)c1cccc(C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)c1	770247616	UHWPFZLBGMILGL-SSEXGKCCSA-N	448.976	1.656	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)N[C@H]1C[C@@H](C)N(c2cnn(C)c2)C1=O	770654762	CWFNELLJFYFOCT-WQGACYEGSA-N	434.884	1.365	50	20	IDGD	
Cc1ccccc1[C@@H](CC(=O)NNc1nc(O)c2cnn(C(C)(C)C)c2n1)NC(N)=O	770958842	PVHJICJTQOESFY-CQSZACIVSA-N	426.481	1.838	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)CCCNC(=O)c1cccnc1	772047463	QMWQALVAEJRDSB-ZDUSSCGKSA-N	449.305	1.969	50	20	IDGD	
C[C@@H]1C(=O)Nc2cc(C(=O)NNC(=O)C(=O)NCc3ccc(Cl)cc3)ccc2N1C	772191977	HWBDXODBHCCBJV-LLVKDONJSA-N	429.864	1.194	50	20	IDGD	
CC(C)(C)OC(=O)N1CCSC[C@H]1CC(=O)NNc1nccc(N2CCOCC2)n1	772476383	JFUFDPQBKYQQJD-CQSZACIVSA-N	438.554	1.499	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)Cc2csc(NC(=O)c3ccccc3)n2)c1	773087802	LZHHUKINVGOXMB-UHFFFAOYSA-N	438.469	1.753	50	20	IDGD	
CCN(CC)C(=O)COc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(C)c(F)c2)c1	773890999	XSTRKKSQBUKBMT-UHFFFAOYSA-N	444.463	1.781	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1cccc(Br)n1	775616207	FJJRFICEGKPJDN-UHFFFAOYSA-N	446.305	1.063	50	20	IDGD	
Cc1cc(S(=O)(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)c(C)o1	776280667	LBHMRGUGKNBONE-UHFFFAOYSA-N	440.953	1.677	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)/C(=C\c1cccnc1)NC(=O)c1ccccc1	778441427	KQPKZSAIDLUIKQ-SFQUDFHCSA-N	439.472	1.525	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)N[C@@H](CO)Cc1c[nH]c2ccccc12	778589216	PQFXKKHAZLUDRF-CQSZACIVSA-N	444.517	1.009	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)N2CCN(C(C)(C)CO)CC2)N(C)c2ccccc21	778944234	LUTXHYPVQHEFMD-UHFFFAOYSA-N	425.533	1.572	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)[C@@H](O)[C@H](O)c1nc2ccccc2s1	779511855	SVSLOLQKWBRELA-IRXDYDNUSA-N	448.526	1.275	50	20	IDGD	
O=C(COc1ccccc1O)NNS(=O)(=O)[C@@H]1CCCN(C(=O)c2ccccc2)C1	779622445	ADFGBRZTZCRYGB-MRXNPFEDSA-N	433.486	1.026	50	20	IDGD	
O=C(NC[C@H]1CCC=CO1)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	780735775	UZZBVPWVFAEVAO-GOSISDBHSA-N	444.513	1.802	50	20	IDGD	
N#C/C(=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)O[C@H]1CCOC1=O	782180075	CSSXNRSMNSIUSM-OVHOFWQVSA-N	428.832	1.845	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C(=O)Nc2ccc3nc(C4CC4)oc3c2)nc2ccccc21	782884586	FRBVJIDPIUAECO-UHFFFAOYSA-N	432.440	1.921	50	20	IDGD	
CC[C@H](C)NS(=O)(=O)c1cccc(NC(=O)C(=O)NNc2cccc([N+](=O)[O-])c2)c1	784833153	JNXVIUACTWPJII-LBPRGKRZSA-N	435.462	1.753	50	20	IDGD	
Cc1cc(NC(=O)COC(=O)/C(C#N)=C/c2ccccc2)n([C@H]2CCS(=O)(=O)C2)n1	785343400	FFQJUZBAGCKWNX-KGZWWPETSA-N	428.470	1.640	50	20	IDGD	
CN(C)CCOCCNC(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1	788014439	RBYLVJADGCQJTC-JOCHJYFZSA-N	439.560	1.522	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)[C@@H]1CCC(=O)c2cccn21	788762590	RGDSMEBLAUZSLZ-IBGZPJMESA-N	443.935	1.624	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)CCOCC(F)(F)C(F)F)cc1	790115170	ZIBQBNBTBLGCGI-UHFFFAOYSA-N	443.419	1.070	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)NCc2ccc(N3C(=O)N[C@](C)(C4CC4)C3=O)cc2)n1	790846895	OUJFQDMMPGHGDV-JOCHJYFZSA-N	436.472	1.759	50	20	IDGD	
COc1cc(Cl)c(Cl)cc1NC(=O)C(=O)NNC(=O)CNC(=O)c1cccs1	792281786	ZRCQMOFMFXGKIZ-UHFFFAOYSA-N	445.284	1.579	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)C2(S(C)(=O)=O)CCC2)c2ccccc2c1=O	792813911	ZJVIKRGAYXCIIL-UHFFFAOYSA-N	434.518	1.315	50	20	IDGD	
Cn1ccc2ccc(NC(=O)C(=O)NNC(=O)c3ccccc3Br)cc2c1=O	793023735	VDGCJCMWRIEAJK-UHFFFAOYSA-N	443.257	1.701	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNC(=O)NCc1nc(-c2cccc(F)c2)no1	793207462	OTIPNDXLAFUTDE-UHFFFAOYSA-N	442.407	1.633	50	20	IDGD	
Cn1cc(-c2cc(F)ccc2NC(=O)C(=O)NNc2cccc(S(C)(=O)=O)c2)cn1	796982575	DKFAYJPQTPCZBL-UHFFFAOYSA-N	431.449	1.712	50	20	IDGD	
CCNC(=O)N(C)c1cccc(NC(=O)C(=O)NNC(=O)COc2ccc(C)cc2)c1	796989295	DZXZLLBIDKPFBE-UHFFFAOYSA-N	427.461	1.326	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)ccc1Cl	798335468	NWZWDNOQDWQMFB-UHFFFAOYSA-N	439.849	1.741	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(OC(F)(F)F)c(C#N)c2)c1O	799835853	YSRSAHQAOXLGGO-UHFFFAOYSA-N	438.318	1.571	50	20	IDGD	
CCC(CC)[C@@H](C(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)N1CCOCC1	802063903	SLCXWFZQWYXALG-KRWDZBQOSA-N	426.539	1.380	50	20	IDGD	
Cc1nn(CCC#N)c(C)c1CCC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	802064127	YACCOMDZBPNTTL-UHFFFAOYSA-N	432.506	1.603	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)[C@@H]2CC(=O)N(CC(F)(F)F)C2)cc1Cl	802075755	JSNHPUSEWJKMFH-MRVPVSSYSA-N	438.790	1.921	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(C(=O)NNC(=O)Nc2ccc3c(c2)OCO3)ccc1Cl	802103004	IRANXBBZBPDVCG-UHFFFAOYSA-N	440.865	1.786	50	20	IDGD	
COc1ccc(Cl)c(NC(=O)NNC(=O)c2cc(S(=O)(=O)N(C)C)oc2C)c1	802115257	NSXQONOPBJNHLO-UHFFFAOYSA-N	430.870	1.967	50	20	IDGD	
C[C@@H]1CCCCN1S(=O)(=O)c1cccc(C(=O)NNc2ccc(-n3ccnc3)nn2)c1	804953293	KLZDAOVLGNDZGH-OAHLLOKOSA-N	441.517	1.982	50	20	IDGD	
N#Cc1ncn(CCNC(=O)NNC(=O)[C@H]2Cc3ccccc3CN2Cc2ccccc2)n1	805029579	MRKROAOIQSYEOM-HXUWFJFHSA-N	444.499	1.107	50	20	IDGD	
O=C1COC[C@@H](C[C@@H]2CN(C(=O)C(=O)NNc3ccc(F)cc3F)c3ccccc32)N1	806997360	LHVMZAJXLVPWGO-TZMCWYRMSA-N	430.411	1.443	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)Cn2cnc3sccc3c2=O)C1	808011348	UCWXKKLJLGYGRR-LBPRGKRZSA-N	435.506	1.253	50	20	IDGD	
CN(C)C(=O)COc1c(Cl)cc(S(=O)(=O)NNC(=O)NCC2CC2)cc1Cl	808080025	APHNAWPSKSBJHP-UHFFFAOYSA-N	439.321	1.363	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)C(=O)OC3)cc1	808934956	ZGORDDGUBLKSAN-GFCCVEGCSA-N	427.413	1.309	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2nc3cc(Cl)ccn3n2)c1	810247898	ZQWPWTQBVYYDCG-UHFFFAOYSA-N	437.869	1.100	50	20	IDGD	
COc1cc(C)nc(NNC(=O)NCc2cccc(N3C(=O)NC4(CCCC4)C3=O)c2)n1	811955201	PLMAHAOWEUWRLH-UHFFFAOYSA-N	439.476	1.989	50	20	IDGD	
COCCn1ccc(NC(=O)C(=O)NNc2cc(C(=O)OC)ccc2Br)n1	815866032	MDTAQKQSSJPDSK-UHFFFAOYSA-N	440.254	1.160	50	20	IDGD	
COC(=O)c1cc(NNC(=O)C2CCN(S(=O)(=O)c3cn(C)c(C)n3)CC2)ccc1C	816687595	GWHUDVRDCNEVAT-UHFFFAOYSA-N	449.533	1.368	50	20	IDGD	
O=C(Cc1cncc(O)c1)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	816830510	IVJAFPIZFRMIBQ-UHFFFAOYSA-N	432.483	1.653	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)[C@H](O)[C@@H](O)c2nc3ccccc3[nH]2)c1	818751012	VGXCCVOIJXHAKI-HUUCEWRRSA-N	449.261	1.650	50	20	IDGD	
Cc1ccc(S(=O)(=O)NNC(=O)[C@H]2COc3ccccc3O2)c(Br)c1	912979315	GQHYIRWDIPRICF-CQSZACIVSA-N	427.276	1.907	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)NCC(=O)NNC(=S)Nc2ccc(C)c(C)c2)cc1	913432210	JNLGASDLBLTIFC-UHFFFAOYSA-N	434.543	1.802	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)CNS(=O)(=O)c1ccc(Cl)cc1	913457403	CYKDKJBBFFWZIV-UHFFFAOYSA-N	441.893	1.243	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)c1cn(-c2ccccc2C(F)(F)F)nn1	914728692	HJXRGPIDXMLVCB-INIZCTEOSA-N	433.346	1.887	50	20	IDGD	
O=C(Cc1nc(-c2ccccc2)cs1)NNC(=O)[C@@H]1CC(=O)N(CC(F)(F)F)C1	914755589	HAFSYILUSNORJK-GFCCVEGCSA-N	426.420	1.911	50	20	IDGD	
COc1cc(-n2cnnn2)c(Cl)cc1C(=O)NNC(=O)c1nnc(O)c2ccccc12	916092052	UCLADYPZVHIFBQ-UHFFFAOYSA-N	440.807	1.048	50	20	IDGD	
CCNC(=O)COc1ccc(CNC(=O)NNC(=O)c2cc3c(s2)CCC3)cc1OC	916389147	QNETVVNSKKDSPS-UHFFFAOYSA-N	446.529	1.905	50	20	IDGD	
O=C1CN(C(=O)c2ccc(CNC(=O)NNC(=O)c3cccc(Cl)c3)cc2)CCN1	916391633	JBPLZYCBRPKLST-UHFFFAOYSA-N	429.864	1.056	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCc1ccc(C(N)=O)cc1	916530932	SPFPYOQGNIWOSJ-NSHDSACASA-N	435.278	1.846	50	20	IDGD	
O=C(NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)N[C@@H]1CCN2CCCC[C@H]12	916638378	FFFTUYGAXKJYER-QZTJIDSGSA-N	435.550	1.042	50	20	IDGD	
CC(C)(C)n1cc(C(=O)C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cn1	916736291	GQNOSBCRGMPTNW-UHFFFAOYSA-N	447.517	1.067	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)NC[C@@H]2CCCO2)c1)c1ccc(Cl)nc1	917253488	ODTPRSZCMZZHNV-AWEZNQCLSA-N	438.893	1.267	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2nnn(-c3ccccc3)c2C)c2ccccc2c1=O	917565184	NBOJAXRBXSEIKN-UHFFFAOYSA-N	431.456	1.770	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NC[C@@H](c2ccc(F)cc2)N(C)C)c2ccccc2c1=O	918090280	FPQBKLUCKNYAEM-SFHVURJKSA-N	440.479	1.802	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)NCc1ccc(CN2CCCC2=O)cc1	918124765	DNJOVRGXDGMTNV-UHFFFAOYSA-N	441.444	1.627	50	20	IDGD	
Cc1nc2ccnn2c(C)c1CCC(=O)OCC(=O)NNC(=O)c1ccc(Cl)cc1	919483909	BXGWDXXLRDOQPZ-UHFFFAOYSA-N	429.864	1.937	50	20	IDGD	
Cc1c(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)cnn1-c1cccc(C(F)(F)F)c1	919889465	MQPZLTFGZWBANE-GFCCVEGCSA-N	445.423	1.331	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@@H]2CCCN2Cc2ccccc2)cc1	919963403	LDWYAIUZBVMZTG-FQEVSTJZSA-N	444.557	1.428	50	20	IDGD	
NC(=O)c1ccc(/C=C/C(=O)N2CCC[C@H]2C(=O)NNC(=O)c2cccc(Cl)c2)cc1	920021936	RGLULYJYBJLHME-MZEUMTGBSA-N	440.887	1.904	50	20	IDGD	
COc1nc(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc2ccccc12	921302509	XMWMGLNQOSFRKN-UHFFFAOYSA-N	434.861	1.619	50	20	IDGD	
COCCOc1ccc(F)cc1S(=O)(=O)NNC(=O)c1cncn1-c1ccccc1	1116739650	RWHZMXKVYUJVEZ-UHFFFAOYSA-N	434.449	1.660	50	20	IDGD	
CC(C)(C)OC(=O)N1CCOC[C@@H]1CC(=O)NNC(=O)c1cncn1-c1ccccc1	1117127369	HXMNOLNZBFLVNQ-INIZCTEOSA-N	429.477	1.659	50	20	IDGD	
O=C(NNC(=O)[C@H]1CC(=O)N(CCOc2ccccc2Cl)C1)c1n[nH]c2c1CCCC2	1319519760	YEIBBEOFESIUQP-ZDUSSCGKSA-N	445.907	1.630	50	20	IDGD	
Cn1ccc(NNC(=O)c2ccc(NS(=O)(=O)c3ccc4c(c3)OCCO4)cc2)n1	1320978413	KSCUSPVSJHYSNU-UHFFFAOYSA-N	429.458	1.749	50	20	IDGD	
Cn1cnc(-c2ccc(C(=O)NNC(=O)C3CCN(C(=O)OC(C)(C)C)CC3)cc2)n1	1323582017	IBSQLIKUIFHNBV-UHFFFAOYSA-N	428.493	1.890	50	20	IDGD	
CN1CCN(c2ncc(C=NNC(=O)C3CCN(C(=O)OC(C)(C)C)CC3)cn2)CC1	1335769033	UMVLNOWYKZLOFG-UHFFFAOYSA-N	431.541	1.326	50	20	IDGD	
Cc1nn([C@H]2CCS(=O)(=O)C2)c(Cl)c1C=NNC(=O)COc1ccccc1O	1347634930	YUQVWBGMRUIDTG-LBPRGKRZSA-N	426.882	1.439	50	20	IDGD	
Cn1c(=O)c(C(=O)N2CC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)nc2ccccc21	1777889140	MYAVVMNEQPMDRI-LJQANCHMSA-N	439.299	1.181	50	20	IDGD	
Cc1cnc2c(C(=O)N3CC[C@@]4(C3)CN(C(=O)[C@H](F)Br)CCO4)cnn2c1	1778526050	IASJZIRRVGNEIW-SUMWQHHRSA-N	440.273	1.172	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCN2CCOC2=O)C1	1778784280	YDSRCZGALHSTJM-PMUMKWKESA-N	446.342	1.126	50	20	IDGD	
C[C@H](Nc1cnccn1)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2	1779059271	RLKQDZDVMRMAPM-VHSSKADRSA-N	430.336	1.343	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@]2(C1)CN(C(=O)c1nc3ccc(F)cn3n1)CCO2	1779299038	MUSQZIRNYCOELI-IBGZPJMESA-N	435.532	1.163	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccnc(Cl)n1)C2)[C@H](F)Br	1780775081	XZBLDYJDMYBBFD-BFQNTYOBSA-N	449.708	1.948	50	20	IDGD	
CC(C)NC(=O)OC(C)(C)C(=O)N1CC[C@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1781022390	JQCBIAUBGSMRLA-FQEVSTJZSA-N	443.617	1.581	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)/C=C/C(=O)NCc3ccccc3)CCO2)C1	1781211515	WUWCMOSEXNFHDR-ISUMYKINSA-N	433.936	1.706	50	20	IDGD	
O=C([C@H](F)Br)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)c1ccccc1Cl)CCO2	1781334803	QAUARZUIBIVORV-JKIFEVAISA-N	449.704	1.894	50	20	IDGD	
CCc1cc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](C)Br)C2)n(C)n1	1781998212	VPSLQJIHBDNACJ-URKNILKWSA-N	441.370	1.893	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(NC(C)=O)c(O)c3)C2)C1	1782135908	OJGXAZJDDHPJOG-MGPUTAFESA-N	439.896	1.048	50	20	IDGD	
O=C(c1cnc[nH]1)N1CCO[C@]2(CCN(C(=O)[C@@H](Br)Cc3ccccc3)C2)C1	1783019613	YCOPLXRYMLVGGD-JXFKEZNVSA-N	447.333	1.859	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)C(=O)c3cccn3C)CCO2)C1	1783354535	STVKDSYZPDFZLR-SCLBCKFNSA-N	426.311	1.211	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)CCc3ccnc(OC)c3)CCO2)C1	1783872608	CWSBLRNYDXKSMQ-OXQOHEQNSA-N	425.913	1.107	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3nc4cc(C)c(C)cc4[nH]3)CCO2)C1	1783877459	IZOIEDVSTZVDNN-YCRPNKLZSA-N	434.924	1.877	50	20	IDGD	
Cc1cnn([C@H](C)C(=O)N2CC[C@@]3(CN(C(=O)[C@@H](C)CBr)CCO3)C2)c1	1784442197	LWPVFNHNMCYATQ-DAYGRLMNSA-N	427.343	1.613	50	20	IDGD	
O=C(CNc1ccc(F)cc1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21	1786812366	WEYBUGIMYVAKCO-JIRONKKISA-N	446.292	1.908	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc4[nH]ncc4c3)[C@H]2C1	1788274652	ZTHUUSXZOFZZLL-TZMKYKESSA-N	440.331	1.788	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3snnc3C3CC3)C[C@@H]21)[C@H](F)Br	1789922203	AHAJKAWVGVAVBR-RMIALFOJSA-N	447.330	1.699	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]2C1	1789924805	DUEFALKESPZIQB-ORMBPQIASA-N	430.112	1.440	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4ncnn4c3)C[C@@H]21)[C@@H](F)Br	1789925286	CYMNQDNMEZFRAR-PWNZVWSESA-N	440.273	1.013	50	20	IDGD	
C[C@H](Nc1cnccn1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]2C1	1791056290	RAGQFGMOWSTTNS-QTVXIADOSA-N	440.342	1.040	50	20	IDGD	
COc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]3C2)ccn1	1791058799	FVPZSHXVCXMVBA-UNQGMJICSA-N	426.311	1.467	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3CCC[C@H](C(=O)OC)C3)[C@H]2C1	1791247589	LPKHKTYUHMIZBN-QQCJEOGWSA-N	444.956	1.199	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc(F)c(C#N)c3)C[C@@H]21	1791253521	DVDPKYDPVXOLAA-XPYUAMARSA-N	437.899	1.473	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnn(C)c1Cl)C2	1792872666	URISPBFKBRUHLI-KQXIARHKSA-N	433.734	1.308	50	20	IDGD	
COc1ccc([C@H]2C[C@@H]2C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CCC(=O)NN(C)C)C3)cc1	1793523805	FBTRENSTNMZSNP-QIYLELGZSA-N	442.560	1.810	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cnc3ccccn13)C2	1795112931	HQFLLAWNDGCBFO-HBCWATKFSA-N	435.322	1.251	50	20	IDGD	
C[C@@H](CN)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](Br)Cc1ccccc1)C2	1795514559	DREJJLMTZCVQDL-MWTISTBLSA-N	438.366	1.177	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)c1ccn(-c2ccccc2)n1	1796188551	SWFSRFZSQFXYGZ-NUZGMZIFSA-N	444.300	1.118	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1=NO[C@H](c3ccccc3)C1)C2	1797955841	IUOYXEUEQHATOX-NZGUISNBSA-N	445.592	1.945	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](NC(C)=O)c1ccc(F)cc1	1799054131	QBSVEDBPIRJJEX-PTIUUAQKSA-N	439.915	1.610	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@](C)(Cl)CCl)C1	1799278423	GAXMZPNTTSDWMR-MXSVDAKMSA-N	449.375	1.792	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)c(O)c(Cl)c1	1799770482	XPSYOSAIZBUSRK-WJNVRWDZSA-N	433.288	1.208	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cn2c(F)cccc2n1	1799999567	LLHWZVWRJVWNDP-FIXGWNCBSA-N	443.306	1.913	50	20	IDGD	
COc1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CCC(=O)NN(C)C)C3)c(O)c1OC	1800572879	LMVQSHVNACJGJX-QDMKHBRRSA-N	448.520	1.034	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cnc(C)s1)C2	1800644066	GTQHNYOUVKBQQP-FAXLKDOZSA-N	430.368	1.757	50	20	IDGD	
CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(Cl)Cl)C(=O)c1ccccc1	1801015914	XTYLRBZXPKCTSP-MIFYACCESA-N	428.316	1.152	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C13CC(C(F)(F)F)(C1)C3)C2	1802335076	XMWYHEFWRCSJRG-JQTNIVROSA-N	430.471	1.730	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)CCN2C(=O)C=CC2=O)[C@@H]1c1cccnc1	1803686200	LGZJXUSZAZZEBA-XGHQBKJUSA-N	446.935	1.810	50	20	IDGD	
Cc1csc(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)c1	1803770636	KOHAKORTWFDHIX-NQIIRXRSSA-N	449.341	1.765	50	20	IDGD	
O=C(Cc1cncnc1)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@H]1c1cccnc1	1804651212	QIPAOWSDQWVVRS-XIRDDKMYSA-N	436.285	1.811	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)c2ccncc2)[C@@H]1c1cccnc1	1805476766	TZDJFYHZOPJUQG-XLIONFOSSA-N	445.483	1.109	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)C[C@@](C)(O)CC(=O)O)[C@H]1c1cccnc1	1808278112	OSKOLZWLQLFVBB-BPQOCRPUSA-N	425.913	1.721	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@H]1CCN(C(=O)Cn2cnnn2)[C@@H]1c1cccnc1	1808294744	CEDYKVBHKZZTJJ-UNEWFSDZSA-N	426.308	1.010	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H](CNC(=O)[C@H](F)Cl)[C@@H]1c1cccnc1)N1CCN(C)CC1	1808316226	WWGWHPPDBHXFIH-BGTYHANMSA-N	425.936	1.258	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)c2cn[nH]c2)[C@@H]1c1cccnc1	1808608538	XPUMXZKVDVYISK-ZUPKNDBLSA-N	448.487	1.258	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)Cn2nccn2)[C@H]1c1cccnc1)[C@@H](F)Br	1808676538	UFKNVKHXIWCNID-AEGPPILISA-N	425.262	1.070	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)[C@H]2CNC(=O)C2)[C@H]1c1cccnc1	1812778652	JBFMZQLZYTYSMY-IVSAIRAKSA-N	437.338	1.397	50	20	IDGD	
CNC(=S)NCCC(=O)N1CC[C@H](CNC(=O)C(Cl)Cl)[C@H]1c1cccnc1	1813078083	NJPAALOOGRROEX-TZMCWYRMSA-N	432.377	1.375	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H]2CCCS2(=O)=O)[C@H]1c1cccnc1)C(Cl)Cl	1813081727	ZKPMCLMDUFHMKQ-IHRRRGAJSA-N	434.345	1.468	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)[C@@H](O)CCl)n[nH]2)ncc1[N+](=O)[O-]	1814870674	AHYOWYNANJPNGB-ZFWWWQNUSA-N	436.856	1.927	50	20	IDGD	
O=C(CCC(=O)N1CCCC1)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1	1815639328	XLZCGDWUXHOTSU-GJZGRUSLSA-N	425.917	1.404	50	20	IDGD	
O=C(N[C@H]1CCc2nc(NC(=O)[C@@H](F)Cl)sc2C1)c1n[nH]c2c1CS(=O)(=O)C2	1817121550	MZINKFKRPXCUTN-PWCHPLFNSA-N	447.901	1.055	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CNCP(=O)(O)O)n[nH]1	1817231667	FHZLYBXXTHPSFZ-LBPRGKRZSA-N	435.849	1.392	50	20	IDGD	
Cc1cc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)[nH]n2)c[nH]1	1818329704	XZHTZMRYETXGOL-QGZVFWFLSA-N	436.476	1.664	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)Cc2cccnc2)[nH]n1	1819402921	NVHXJDLPLOPJQN-GOSISDBHSA-N	448.487	1.352	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)C(=O)Nc2cccnc2)n[nH]1	1819530809	FTLSUNULXBSKKQ-UKRRQHHQSA-N	434.884	1.689	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)CNC(=O)c3cc(C)on3)sc2C1	1819931269	RWDQFINAFSGZST-WDEREUQCSA-N	439.925	1.799	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](Br)CC)CC2	1820148461	LTANEVCVEOMLDQ-MXWKQRLJSA-N	443.367	1.919	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccc(C#N)c2)n[nH]1	1820486399	KFGTWAJQFCQYOR-SFHVURJKSA-N	437.504	1.960	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CS(C)(=O)=O)CC2	1822863083	FVVSEDBDMYTDAO-XLKFXECMSA-N	428.363	1.336	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)Cc1c(C)n[nH]c1C)CC2	1826007183	TUJDEURKBVFGKB-DGCLKSJQSA-N	425.942	1.892	50	20	IDGD	
C#CCCCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1)CC2	1826037518	KYMNUIZYSGPXQY-JUCPORTRSA-N	440.529	1.993	50	20	IDGD	
C[C@H](C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2)n1cccc1	1826589197	ZLSNBSIKXVCVJH-CJNGLKHVSA-N	438.318	1.111	50	20	IDGD	
O=C([C@@H]1C[C@H]2CC[C@@H]1O2)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827053150	FMUVGAKPGRDIRX-YSFYHYPLSA-N	440.349	1.167	50	20	IDGD	
CC[C@@H](NC(N)=O)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CO[Si](C)(C)C)CC1	1829101908	HNLBPVPAFXQHHB-SJORKVTESA-N	426.634	1.905	50	20	IDGD	
Cn1nc2c(c1C(=O)N1CCOC[C@]3(C1)CN(C(=O)C(C)(C)CCl)CCO3)CCC2	1830366267	NGKPQXYROHBCBZ-NRFANRHFSA-N	438.956	1.244	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC([C@@H]2CCCCN2C(=O)Cn2nccn2)CC1	1830428010	XDRRZXNKAMAELA-HOCLYGCPSA-N	426.359	1.929	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](C)Br)CC1	1831652855	KSSBBFORAZFAJO-SNPRPXQTSA-N	431.375	1.836	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)[C@H]2CCCOC2)CC1	1832868692	VJWTWMGMVIWSOE-PZJWPPBQSA-N	428.338	1.026	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3cc(C)cs3)CCO2)C1	1832985866	XJEUEHKYRMYDSH-YLJYHZDGSA-N	444.981	1.699	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3cccnc3OC)CCO2)C1	1833003752	SCMANDWBVOSCDS-UWJYYQICSA-N	439.940	1.497	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cc(Cl)ccn3)CC2)CC1)[C@H](O)CCl	1833311691	AIPPFBOYNLCXSX-QGZVFWFLSA-N	429.348	1.520	50	20	IDGD	
CC(=O)NC(C)(C)C(=O)NC1CCN(C2CCN(C(=O)CO[Si](C)(C)C)CC2)CC1	1833486435	AZISLMIUQUCRHI-UHFFFAOYSA-N	440.661	1.324	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1)c1cc(O)ncn1	1833554592	APJAEIQUQSDQJB-HNNXBMFYSA-N	444.305	1.058	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3n[nH]c(C4CC4)c3F)CCO2)C1	1833677769	STRRIGYDGPEIKQ-XOBRGWDASA-N	442.919	1.904	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)c3cccnc3S)C2)C1	1834820328	YXEWOGBGSBVURU-KRWDZBQOSA-N	444.351	1.225	50	20	IDGD	
C[C@]1(C(=O)N2CCOC[C@@]3(CN(C(=O)CCBr)CCO3)C2)CC1(F)F	1834826369	MUTNLIMQULPIOG-HUUCEWRRSA-N	425.270	1.273	50	20	IDGD	
CC(C)CNC(=O)C(=O)NC1CCN(C2CCN(C(=O)[C@H](C)Br)CC2)CC1	1835129298	OZHBOLNYDGAATK-AWEZNQCLSA-N	445.402	1.114	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)[C@H]3C[C@@H](O)C3)CC2)CC1	1835444531	BJUNXIBLFCIBIX-XOKHGSTOSA-N	430.387	1.502	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C1(F)CCCCC1)CCO2	1836620373	OLVAZGUDZOJPJI-RHSMWYFYSA-N	435.334	1.899	50	20	IDGD	
O=C(c1ccc2cncn2c1)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836717577	YKCZOCGSSGSSCF-LJQANCHMSA-N	434.924	1.546	50	20	IDGD	
COc1ccc(C(=O)N2CCC(OC3CCN(C(=O)[C@H](O)CCl)CC3)CC2)nc1	1836718364	WIFUGESAYHZSTL-GOSISDBHSA-N	425.913	1.302	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](C)N(C)C(C)=O)CC2)CC1	1838106564	AFGBEGDKSVVGOT-KDOFPFPSSA-N	431.961	1.106	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)C(F)(F)Cl)CC2)CC1	1838789756	ZBNUEXFRWINONR-UHFFFAOYSA-N	438.903	1.190	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(Cl)c3)CCO2)C1	1838920300	QWJLOKYSHPNBBO-QFBILLFUSA-N	431.316	1.664	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccnc3S)C2)C1	1839149509	JJMKJNWPTCQYFV-MSOLQXFVSA-N	448.372	1.677	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnoc3C3CC3)C2)C1	1839151195	KMIZRWKDDVSDIY-RTBURBONSA-N	446.331	1.858	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnn4c3OCCC4)CCO2)C1	1839516158	CVWKMEPDOTUEHS-OXQOHEQNSA-N	440.928	1.143	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccnc(Cl)c3)C2)C1	1840030966	BKTCYWVEOQXYJS-SJCJKPOMSA-N	446.729	1.588	50	20	IDGD	
COCc1c[nH]c(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)c1	1840034823	YAPLBVBGSUFXAZ-SCLBCKFNSA-N	444.326	1.015	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)C1CCN(c3cc(OC)ncn3)CC1)C2	1845163421	WHVBSMFZJLHJLO-MRXNPFEDSA-N	435.956	1.922	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc(O)n[nH]1	1848099418	KVOADLOXKYUCSL-AVGNSLFASA-N	427.889	1.063	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)CN2C(=O)N[C@@](C)(c3ccc(F)cc3)C2=O)c1	25449113	LMJGKWMCMZWAEC-NRFANRHFSA-N	427.436	1.120	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)CNC(=O)c1ccco1)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	726271890	XZCUPEGFCGVGRA-ZIAGYGMSSA-N	437.497	1.375	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)N[C@H](CN2CCN(C)CC2)c2ccccc2)c1	727945537	LODOTRPWOYLPPD-OAQYLSRUSA-N	441.532	1.637	50	20	IDGD	
CNC(=O)c1ccc(C(=O)NNC(=O)c2nc(-c3ccccc3)n(-c3ccccc3)n2)cn1	728511708	ABWCESDNRRWZEV-UHFFFAOYSA-N	441.451	1.764	50	20	IDGD	
O=C(NNC(=O)c1cnc(-c2ccc3c(c2)OCO3)s1)c1ccc(-n2cnnn2)cc1	728513308	WJZCSHZEFFCZKH-UHFFFAOYSA-N	435.425	1.589	50	20	IDGD	
CCC1(CC)NC(=O)N(CC(=O)NNC(=O)c2cc(F)ccc2Br)C1=O	728550812	ILNZWIDYCJWFQI-UHFFFAOYSA-N	429.246	1.460	50	20	IDGD	
CC(C)(C)CC(=O)NNC(=O)NCc1ccc(S(=O)(=O)NC[C@@H]2CCCO2)cc1	728595726	SSNCBLGYDFKTJP-HNNXBMFYSA-N	426.539	1.411	50	20	IDGD	
CN(CC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)c1nc2ccccc2s1	728983168	CJLMJKDJYJEKFW-UHFFFAOYSA-N	425.518	1.587	50	20	IDGD	
Cc1nc(-c2ncccn2)nc(O)c1CC(=O)NNC(=O)c1cc(-c2ccccc2)[nH]n1	729284308	SFKOVNSSNWHMPV-UHFFFAOYSA-N	430.428	1.341	50	20	IDGD	
COC(=O)c1cc(C(=O)OC)cc(S(=O)(=O)NNC(=O)Cn2ccc3ccccc32)c1	729667238	KIIMIKWLODSXMV-UHFFFAOYSA-N	445.453	1.224	50	20	IDGD	
C#CCNS(=O)(=O)c1cccc(C(=O)NNC(=S)Nc2ccc(N(C)C)cc2)c1	729690032	YYAQGWNLICIVAJ-UHFFFAOYSA-N	431.543	1.296	50	20	IDGD	
CC[C@H](Nc1ccccc1)C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	729863177	OFWYHXZWDAHQLZ-FQEVSTJZSA-N	431.562	1.957	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)c1ccc(S(=O)(=O)NCc2ccco2)cc1	730782775	VLOYYZNRFGBKIL-UHFFFAOYSA-N	445.453	1.304	50	20	IDGD	
NC(=O)[C@@H]1CCCN(Cc2cccc(CNC(=O)NNC(=O)Cc3ccc(F)cc3)c2)C1	731118544	UKESFZZRTMTCAY-LJQANCHMSA-N	441.507	1.596	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(/C#N)C(=O)OCCN(C)S(=O)(=O)N(C)C)c1C	731144446	GRSHUCOSWLDXQG-GZQZNAIASA-N	426.539	1.501	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])o2)c1	732050664	ZMUTUMNJHWDPSV-HNNXBMFYSA-N	430.417	1.636	50	20	IDGD	
CCn1c(=O)nc(O)c2c(C(=O)NNc3nc(-c4cccnc4)no3)cc(C(C)C)nc21	732110894	SFWAWLLNEFYRDA-UHFFFAOYSA-N	436.432	1.842	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)N[C@@H]2CCN(c3ccccc3Cl)C2=O)nc2ccccc21	732469431	DSQYCJCSHKZYHD-OAHLLOKOSA-N	440.891	1.905	50	20	IDGD	
Cc1[nH]c(-c2ccncc2)nc(=O)c1CC(=O)NNC(=O)c1cnn(-c2ccccc2)c1	733169920	HEJDUXDOWWJDKM-UHFFFAOYSA-N	429.440	1.330	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)NC2CCN(C[C@H]3CCCO3)CC2)cc1	734280076	DINAMSSOTUMSHN-OXQOHEQNSA-N	434.537	1.826	50	20	IDGD	
CCCCS(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)c2ccccc2F)cc1	737752751	RUYXOIQDSFHPFA-UHFFFAOYSA-N	429.495	1.991	50	20	IDGD	
CC(C)[C@H](C(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)N1C[C@H](C)O[C@H](C)C1	741024996	BNYDSUWBCREBQP-QWQRMKEZSA-N	436.465	1.033	50	20	IDGD	
CC(C)c1nc(C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)nn1-c1ccccc1F	742034796	WJNOESIYRFUPRI-UHFFFAOYSA-N	449.446	1.852	50	20	IDGD	
Cc1nn(C)c(C)c1C[C@H](C)C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	742035085	YCXRGHLRAFUAKO-AWEZNQCLSA-N	447.561	1.461	50	20	IDGD	
CC(C)(C)C(=O)NNC(=O)CSc1nnc(N2CCOCC2)n1-c1cccc(F)c1	742451671	WYQQPHSFFPKERB-UHFFFAOYSA-N	436.513	1.529	50	20	IDGD	
Cc1oc(-n2cccc2)c(C#N)c1C(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	742595758	XRWDEZPGAQZPGH-UHFFFAOYSA-N	437.368	1.777	50	20	IDGD	
C[C@@H]1C[C@@H](C)CN(CCCNC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)C1	743549011	TZRHBRSSCIHUPA-HUUCEWRRSA-N	425.555	1.794	50	20	IDGD	
CC(C)[C@H](NC(=O)c1ccccn1)C(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	743829799	DNBGWKILYIBVIK-INIZCTEOSA-N	433.490	1.092	50	20	IDGD	
O=C(Cc1ccc(-n2cccn2)cc1)NNc1ccccc1S(=O)(=O)N1CCOCC1	744622528	XJPVWOTUYSUWNK-UHFFFAOYSA-N	441.513	1.579	50	20	IDGD	
Cc1c(C(=O)NNC(=O)Cc2cccc3ccccc23)cc(S(N)(=O)=O)cc1[N+](=O)[O-]	746110107	XYDHTZMNJVOFBC-UHFFFAOYSA-N	442.453	1.708	50	20	IDGD	
O=C(CCNC(=O)c1ccc(Br)cc1)NNC(=O)Cc1cn2ccccc2n1	746549518	ZLYZVXFTCARQJJ-UHFFFAOYSA-N	444.289	1.607	50	20	IDGD	
CN1C(=O)C[C@@H](C(=O)NNC(=O)Cc2cn3ccccc3n2)[C@@H]1c1cccc(Cl)c1	746556256	OYQGLVHPVFLSLN-UZLBHIALSA-N	425.876	1.897	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)C1CCN(S(=O)(=O)c2ccc(F)c(F)c2)CC1	747324548	JADOFFAGOINMOE-UHFFFAOYSA-N	438.456	1.151	50	20	IDGD	
CCc1c(C(=O)NNC(=O)c2ccc(CSc3nncn3C)cc2)[nH]c(C)c1C(N)=O	747719233	JUQSOKBPVMLZDC-UHFFFAOYSA-N	441.517	1.480	50	20	IDGD	
O=C(CCn1c(=O)nc(O)c2ccccc21)NNc1nc(-c2ccccn2)nc2c1CCC2	747988749	RCMYKVBDWSRIGS-UHFFFAOYSA-N	443.467	1.976	50	20	IDGD	
O=C(NCCC(=O)N1CCN(c2ccccc2)CC1)NNC(=O)c1cccc([N+](=O)[O-])c1	748465815	SGEMVOFMXZAYFG-UHFFFAOYSA-N	440.460	1.278	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)N[C@H]1CCN(c2cccc(Cl)c2)C1=O	750266344	IAHLOKWJRCSFOW-HNNXBMFYSA-N	432.864	1.863	50	20	IDGD	
Cc1cccc(-n2c(NNC(=O)Cn3ccc(O)nc3=O)nc3ccccc3c2=O)c1C	752006012	HLBFCQIQCTUDFY-UHFFFAOYSA-N	432.440	1.408	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)NNC(=O)c2ccc(Br)s2)ccc1F	752398989	DIGNNOSAIGVFGC-UHFFFAOYSA-N	436.284	1.633	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)N[C@@H]2CCN(c3ccccn3)C2)nc1	753729206	SDDUOXVTFZOJAJ-OAHLLOKOSA-N	433.538	1.412	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)c2cc(S(N)(=O)=O)oc2C)cc1OC	754182030	LKWFCNZXIROZAU-UHFFFAOYSA-N	425.463	1.498	50	20	IDGD	
CN(CCCC(=O)NNc1ccc(C(F)(F)F)nn1)C1=NS(=O)(=O)c2ccccc21	755193573	GXRFDEFUUFLQOP-UHFFFAOYSA-N	442.423	1.800	50	20	IDGD	
CCc1c(NC(=O)C(=O)NNC(=O)c2cncc(NC(C)=O)c2)cnn1CCC(C)C	756170401	UWRNRNPWXDCQCS-UHFFFAOYSA-N	429.481	1.245	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2cnn(Cc3ccccn3)c2)c1	756740424	WGCNPZDNMXJUHA-UHFFFAOYSA-N	443.489	1.043	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)Nc2cnn(-c3cnc4ccccc4n3)c2)cc1	757783051	QFYCDTYBLDUCIQ-UHFFFAOYSA-N	428.412	1.919	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)[C@@H]2CC(=O)N(c3cc(OC)c(OC)c(OC)c3)C2)nc1	759728441	FMMGMRVNGHYOJB-CYBMUJFWSA-N	444.444	1.390	50	20	IDGD	
C[C@@H]1CN(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)C[C@@H](c2ccsc2)O1	759747094	CTSUROPWXFVKPS-PBHICJAKSA-N	430.534	1.957	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)c1cc(Br)c2c(c1)OCO2	760439599	JFTWGEPFMJDSDI-UHFFFAOYSA-N	430.255	1.854	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)N[C@H]1CCCN(c2ccccc2F)C1	762530538	YYFSSWZJDXWCJG-AWEZNQCLSA-N	448.524	1.732	50	20	IDGD	
NS(=O)(=O)c1ccc(C(=O)NNC(=O)c2ccc(Br)cc2Cl)cn1	762745690	UGCSMRQZZHFOHZ-UHFFFAOYSA-N	433.671	1.220	50	20	IDGD	
COc1cc(C(=O)NNc2nccc(N3CCOCC3)n2)cc(OC)c1OC(F)F	762861274	NAAYLTLVKCYUDN-UHFFFAOYSA-N	425.392	1.689	50	20	IDGD	
Cc1ccc(Cl)cc1S(=O)(=O)N1CCN(S(=O)(=O)CBr)CC1	763205951	IMGLBZOCHSRCKF-UHFFFAOYSA-N	431.761	1.637	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)NCCN1CCN(Cc2ccccc2)CC1	763473562	OQMTYWXXMVITPK-UHFFFAOYSA-N	443.573	1.633	50	20	IDGD	
O=C(NNC(=O)c1ccccc1Br)C(=O)Nc1cccc(Cn2cncn2)c1	763483802	VQMPPTPOZAIKBG-UHFFFAOYSA-N	443.261	1.489	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(N3CCCC3)c(F)c2)cc1OC	763551899	SWQNVYLLLZMZGU-UHFFFAOYSA-N	430.436	1.843	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1Cl	763570855	JEOZFNRDINZRJT-QGZVFWFLSA-N	449.847	1.291	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1cccc(Cl)c1S(C)(=O)=O	763629430	JPABRWZJUOOYHV-UHFFFAOYSA-N	449.876	1.099	50	20	IDGD	
CC[C@@H](C)n1ncc(NC(=O)C(=O)NNC(=O)COc2ccccc2OC)c1C1CC1	763662479	IHYGXIIAYKHTEK-CYBMUJFWSA-N	429.477	1.905	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(Cl)ccc1N(C)C	763683813	AQPFPVWUBGLFCJ-UHFFFAOYSA-N	434.880	1.970	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)C(=O)Nc1ccc2c(c1)OCO2	763695844	YLPRJBKOEIMZIO-UHFFFAOYSA-N	436.218	1.343	50	20	IDGD	
COc1cc(C(=O)N(C)C)ccc1NC(=O)C(=O)NNC(=O)C12CC3CC(CC(C3)C1)C2	763732099	ACABEBNSHUBZNC-UHFFFAOYSA-N	442.516	1.699	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)C(=O)Nc2cccc(C(=O)NC(C)(C)C)c2)c1	763757419	HYVKSCOLTDADNF-UHFFFAOYSA-N	425.489	1.681	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3cccc(N(C)C)c3)cc2)CCO1	763758148	OZUHIRRJANXTLE-HNNXBMFYSA-N	425.489	1.377	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)C(=O)Nc2cc(S(C)(=O)=O)ccc2Cl)c1	763760224	IBNDLFKXUVAXJY-UHFFFAOYSA-N	438.893	1.209	50	20	IDGD	
Cn1cc(Br)cc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCC3)c1=O	763784905	JTUXJHTUXKQXNO-UHFFFAOYSA-N	439.291	1.098	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)n(-c2ccc(F)cc2)n1	763839373	GFPHINIMJNTXDN-UHFFFAOYSA-N	429.383	1.624	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccnn1Cc1ccccc1F	763840839	YPISXLAJQVISKY-UHFFFAOYSA-N	429.383	1.375	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cccc(Cn3cncn3)c2)c1C	763854052	NWFZCCAQGGTRNM-MRXNPFEDSA-N	436.472	1.497	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1cc(F)cc(N2CCOCC2)c1	763873901	XWGKIKNDPYJXLD-ZDUSSCGKSA-N	448.426	1.355	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(C3CC3)n(CC)n2)cc1OC	763911566	HHYONUBJFDOZFM-UHFFFAOYSA-N	429.477	1.978	50	20	IDGD	
COc1c(F)cc(F)cc1NC(=O)C(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	763951154	ZFTGXXOSHIEBDZ-UHFFFAOYSA-N	431.355	1.264	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1Cl	764005600	CKAUVJPFTPYYRV-UHFFFAOYSA-N	449.847	1.536	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)[C@H]1CC(=O)N(c2ccc3c(c2)OCCO3)C1	764042999	NNNITAFWGPWLRE-ZDUSSCGKSA-N	443.481	1.456	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)nc1)C(=O)Nc1cnn(-c2cnc3ccccc3n2)c1	764101445	QXGSPLVSNSRUEL-UHFFFAOYSA-N	436.819	1.264	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2O1)C(=O)Nc1ccnn1-c1ccc(Cl)cc1	764152065	CBOYCRVKHYJCQQ-INIZCTEOSA-N	425.832	1.615	50	20	IDGD	
CCOc1cc(Br)ccc1NC(=O)C(=O)NNC(=O)[C@H]1Cc2ccccc2O1	764166638	FMEVIKOVUOGJIZ-MRXNPFEDSA-N	448.273	1.937	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)C(=O)Nc1ccc(-c2ccc[nH]2)cc1	764261051	WWBWSVJDKVDQAP-UHFFFAOYSA-N	433.472	1.474	50	20	IDGD	
CN1CCN(c2ccc(NC(=O)C(=O)NNC(=O)Cc3ccccc3F)cc2Cl)CC1	764314292	SWJUHKXPEZXOHG-UHFFFAOYSA-N	447.898	1.560	50	20	IDGD	
CCNS(=O)(=O)c1ccc(CNC(=O)NNC(=O)CSc2ccc(C)cc2)cc1	764373058	IJMJYKKZIRWXSS-UHFFFAOYSA-N	436.559	1.916	50	20	IDGD	
O=C(NNC(=O)[C@H]1COCCO1)C(=O)Nc1ccc(F)cc1-c1nc2ccccc2s1	764424721	KOWUGSXKODPIRD-OAHLLOKOSA-N	444.444	1.604	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2ccc(NC(C)=O)c(F)c2)c2ccccc2c1=O	764748272	NGFNTUAGZCUEMG-UHFFFAOYSA-N	425.420	1.979	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)CNC(=O)NC3CCCCC3)n[nH]2)cc1OC	765596766	LPGCYPMHUNFSIJ-UHFFFAOYSA-N	444.492	1.487	50	20	IDGD	
CS(=O)(=O)Nc1cc(C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)ccc1F	765621920	ZTIKKMQLLRLOBI-UHFFFAOYSA-N	435.412	1.801	50	20	IDGD	
CC(C)(C)OC(=O)NCc1cc(C(=O)NNC(=O)c2nnc(O)c3ccccc23)ccn1	766134089	VOISVGXWAWECQH-UHFFFAOYSA-N	438.444	1.830	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2cc(C(C)C)nn2-c2ncccn2)c1	768229421	BRLFWWPWCKZFCP-UHFFFAOYSA-N	437.460	1.259	50	20	IDGD	
O=C(CNC(=O)N1CCc2ccccc2C1)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	768275626	CVIZBNKNMSTCNH-UHFFFAOYSA-N	436.447	1.745	50	20	IDGD	
CCn1c(SCC(=O)NNC(=O)c2cc(Cl)ccc2OC)nnc1-c1cnccn1	768413562	FJFBPVVOUUSOMO-UHFFFAOYSA-N	447.908	1.970	50	20	IDGD	
Cc1cc(N2CCC[C@H](NC(=O)NNC(=O)c3cnn(C)c3)C2=O)ccc1Br	768431421	UAWQWQPVLVZVPM-HNNXBMFYSA-N	449.309	1.631	50	20	IDGD	
COc1ccc(Br)c(CC(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)c1	768704599	PEKKHALGKGLWIY-UHFFFAOYSA-N	446.257	1.876	50	20	IDGD	
C[C@]1(c2ccc(F)c(Cl)c2)NC(=O)N(CC(=O)NNC(=O)c2ccccc2O)C1=O	770220242	BHMUHLJBYSMSFF-LJQANCHMSA-N	434.811	1.413	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)/C=C/c2ccc(OC)c(O)c2)c1	771845514	MCPIELRPPCLRHS-ZRDIBKRKSA-N	447.513	1.906	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)Cc2ccc(C(=O)NNC(=O)C3(O)CCC3)cc2)cc1	771861830	ZPZVHFCOPTYIFR-UHFFFAOYSA-N	431.514	1.492	50	20	IDGD	
CCOC(=O)c1cnn(-c2cccc(NC(=O)C(=O)NNc3nc(C)cc(C)n3)c2)c1C	773477977	FOWBLYZOXSPASA-UHFFFAOYSA-N	437.460	1.846	50	20	IDGD	
C#C[C@@H](NC(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1)[C@H]1CCCO1	776226854	ILXFOZFJNHBBOD-WOJBJXKFSA-N	445.483	1.513	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)c1ccc(Br)cc1C(F)(F)F	776292519	ASDAFLQAPRGEPZ-ZETCQYMHSA-N	429.214	1.664	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)[C@H]2CCCCN2S(=O)(=O)c2ccccc2)c1	776540248	STSORSLBRQPBJZ-GOSISDBHSA-N	437.543	1.777	50	20	IDGD	
CC(=O)N/C(=C/c1ccccc1)C(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	776718808	LRHJZPNMFHMKNT-LICLKQGHSA-N	426.385	1.076	50	20	IDGD	
COC(=O)c1ccccc1NNC(=O)CCNS(=O)(=O)c1ccc2c(c1)OCCCO2	777828654	RPOCAUNNXYRWNK-UHFFFAOYSA-N	449.485	1.446	50	20	IDGD	
O=C1Cc2cc(CCCC(=O)N3CCN(S(=O)(=O)CBr)CC3)ccc2N1	777838909	YNTGKKVOCIRGLW-UHFFFAOYSA-N	444.351	1.330	50	20	IDGD	
CCOC(=O)N1CCC([C@H](C)NC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])CC1	779669362	NPPBRSURKTZPBL-ZDUSSCGKSA-N	437.453	1.561	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)C1CCN(c2ccc3cccc(O)c3n2)CC1	780951084	WKYGJCRFVOIJKM-UHFFFAOYSA-N	427.505	1.609	50	20	IDGD	
Cc1c(C(=O)NNC(=O)CCNC(=O)OC(C)(C)C)nnn1-c1cccc2cnccc12	780971735	RSEKDEQAHIMMNF-UHFFFAOYSA-N	439.476	1.800	50	20	IDGD	
Cn1cc(-c2ccc(F)c(C(=O)N3CCN(S(=O)(=O)CBr)CC3)c2)cn1	782774138	PEUNZPFVZOADTG-UHFFFAOYSA-N	445.314	1.666	50	20	IDGD	
O=C(NNc1ncnc2ccsc12)C(=O)Nc1cccc(OCC(=O)N2CCCC2)c1	783253034	FGRVDLPXCLOCDR-UHFFFAOYSA-N	440.485	1.774	50	20	IDGD	
O=C(NNc1cncc(Cl)n1)C(=O)Nc1ccc(CC(=O)N2CCSCC2)cc1	783267495	HTKFCCAGGKMHNI-UHFFFAOYSA-N	434.909	1.330	50	20	IDGD	
CCCCN(C)S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2cc(C)nc(C)n2)cc1	783327178	YBJKHQSEJLBVKY-UHFFFAOYSA-N	434.522	1.596	50	20	IDGD	
COc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)C(=O)NNc1ccc(F)cc1F	783344573	BYMHFYCKRWIOQK-UHFFFAOYSA-N	428.417	1.306	50	20	IDGD	
O=C(NNC(=O)C(=O)N1CCCC1)C(=O)Nc1ccccc1SCc1ccccc1	783999723	QVXSTENTKVDMNS-UHFFFAOYSA-N	426.498	1.687	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1ccc(Cl)cc1OC(F)F	784003951	ARJZYEGYQPIFKP-UHFFFAOYSA-N	446.819	1.519	50	20	IDGD	
CCc1cccc2c1N(C(=O)C(=O)NNc1ccc(S(=O)(=O)NC3CC3)cc1)CC2	784213416	MHSNJXIKLFHSLK-UHFFFAOYSA-N	428.514	1.722	50	20	IDGD	
CC(=O)N1CCN(c2cccc(NC(=O)C(=O)NNc3cccc([N+](=O)[O-])c3C)c2)CC1	784358364	UJOVSENRFYQBTR-UHFFFAOYSA-N	440.460	1.654	50	20	IDGD	
CCOC(=O)c1cn(C)nc1NC(=O)C(=O)NNc1ccc(OCC(F)(F)F)cc1	784370102	GJSDKUURJKQVOC-UHFFFAOYSA-N	429.355	1.620	50	20	IDGD	
O=C(NNc1ccc(C(F)(F)F)nn1)C(=O)Nc1ccc(=O)n(Cc2ccccc2)c1	784888558	ZEGNJIIMCFLPOT-UHFFFAOYSA-N	432.362	1.787	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2ccc(OCc3noc(C)n3)cc2)n1	785233634	MINLELXWGVPJST-UHFFFAOYSA-N	440.464	1.675	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])cc1N1CCNC1=O	786347298	ZWTDSOJAVKXHEZ-UHFFFAOYSA-N	428.405	1.665	50	20	IDGD	
CCOC(=O)[C@](C)(CNC(=O)NNC(=O)[C@@H]1COc2ccccc2O1)c1ccccc1	787311733	YSXDXQDXNPGWNA-PGRDOPGGSA-N	427.457	1.678	50	20	IDGD	
COc1ccc(C(=O)CNC(=O)CCC(=O)NNC(=O)NCc2ccc(Cl)cc2)cc1	787436160	OLBPKKNIVHCHKB-UHFFFAOYSA-N	446.891	1.958	50	20	IDGD	
Cn1c(=NNC(=O)c2sccc2S(=O)(=O)N2CCOCC2)sc2ccccc21	789971070	RDJOJVCGMIQSTC-UHFFFAOYSA-N	438.556	1.568	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)N2CCN(C(=O)C(=O)NC(C)C)CC2)c(C)n1CC(C)C	790898820	BYOAIIPFXJPRPG-NDENLUEZSA-N	427.549	1.863	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@@](C)(O)Cn2c(C)cccc2=O)cc1Br	792163573	DSHMRQUVQWOYLO-SFHVURJKSA-N	438.278	1.140	50	20	IDGD	
C[C@](O)(Cn1cc(C(F)(F)F)ccc1=O)C(=O)NNc1ccccc1S(C)(=O)=O	792238887	YLUHNZLSCYHWPI-INIZCTEOSA-N	433.408	1.165	50	20	IDGD	
CN1CCC/C1=N/S(=O)(=O)c1ccc(NC(=O)NNc2nc3ccccn3n2)cc1	792248812	MXFHSMNXPHWMME-JLPGSUDCSA-N	428.478	1.691	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNS(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-]	794598805	NMMXBTZSCXPAEE-UHFFFAOYSA-N	442.837	1.484	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1ccnc(NC(=O)C2CC2)c1	794780478	KZKQPOMOIHWHED-UHFFFAOYSA-N	430.490	1.106	50	20	IDGD	
COC(=O)c1cc(Cl)c(Cl)cc1NC(=O)C(=O)NNC(=O)Cc1ccccn1	797536216	XBOQULUDDZHPSK-UHFFFAOYSA-N	425.228	1.504	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)c2cncc(-n3ccnn3)c2)CC1	801903743	YVKVOQRANUVMRK-UHFFFAOYSA-N	430.469	1.006	50	20	IDGD	
CN1CC(=O)N(CCCC(=O)NNC(=O)Nc2ccc(Br)cc2Cl)C1=O	802043828	RUSULUHTHQSHAZ-UHFFFAOYSA-N	446.689	1.929	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c(C)c1OC	804146863	IQLCORIZECZKFJ-UHFFFAOYSA-N	426.517	1.986	50	20	IDGD	
COC[C@@]1(CNC(=O)NNC(=O)c2cccc(C#N)c2)CCCN1C(=O)OC(C)(C)C	805066822	ARCREDYHISQBTL-NRFANRHFSA-N	431.493	1.918	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(F)c(N2CCCNC2=O)c1	806972182	KOJQZLXUUIUDQY-UHFFFAOYSA-N	444.379	1.053	50	20	IDGD	
CCN(C)C(=O)c1cccc(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)c1	806974126	VZPFHHPYBOPLOV-UHFFFAOYSA-N	437.500	1.317	50	20	IDGD	
O=C(Cc1ccccn1)NNC(=O)C(=O)Nc1cc(C(F)(F)F)cc(Br)n1	806978530	FNBVOMRXQFMHBN-UHFFFAOYSA-N	446.183	1.587	50	20	IDGD	
N#Cc1ncn(-c2ccccc2NC(=O)C(=O)NNc2ccc(Br)cn2)n1	810394729	GXRZKJABTJMUGT-UHFFFAOYSA-N	427.222	1.378	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)cc1	812728620	SMFYENOGAGOEAE-UHFFFAOYSA-N	430.446	1.788	50	20	IDGD	
COc1ccc(C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)nc1Br	812729372	KRRUGOGDRPLMSM-UHFFFAOYSA-N	429.296	1.860	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)Nc1cccc(N2C(=O)NC(C)(C)C2=O)c1	812972707	NPCCNYPFBCPVQP-UHFFFAOYSA-N	441.444	1.762	50	20	IDGD	
COC(=O)c1cn(-c2cccc(NC(=O)C(=O)NNc3cccc(C(F)(F)F)n3)c2)nn1	812988121	ZRPPHLDRPQZJPO-UHFFFAOYSA-N	449.349	1.550	50	20	IDGD	
O=C(NNC(=O)c1cc(F)ccc1Cl)c1cccc(S(=O)(=O)N2CCOCC2)c1	814195030	ROMHWIHHSFNUDL-UHFFFAOYSA-N	441.868	1.575	50	20	IDGD	
O=C(NNc1cccc(Cl)n1)C(=O)Nc1cccc(Cn2nc3ccccn3c2=O)c1	815726099	OLZFJXHETJTRFR-UHFFFAOYSA-N	437.847	1.675	50	20	IDGD	
COc1cc(Cl)cc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)c1	815826932	GCVNQTUWJKVDDY-UHFFFAOYSA-N	430.892	1.568	50	20	IDGD	
CN(NC(=O)c1nn(C)cc1Br)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	816087794	LSFKLBKVFCQXAQ-UHFFFAOYSA-N	445.318	1.432	50	20	IDGD	
Cn1cc(S(=O)(=O)NCC(=O)NNc2cc(C(F)(F)F)cc(C(F)(F)F)c2)cn1	817014331	CJXCHJJXWQDOAM-UHFFFAOYSA-N	445.345	1.879	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNS(=O)(=O)c2ccc(F)cc2Cl)ccc1Cl	903939724	ZRDVPQDKFXUZGB-UHFFFAOYSA-N	442.277	1.403	50	20	IDGD	
CN1CC[C@@H](C(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)CC1=O	906376909	DOVYDIHXYAIAQU-MRXNPFEDSA-N	433.468	1.074	50	20	IDGD	
CC(=O)Nc1cccc(-n2nnnc2SCC(=O)NNC(=O)c2cccc(Cl)c2)c1	913123511	QECZECPAYWLMHF-UHFFFAOYSA-N	445.892	1.827	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)NC[C@H](c1cccs1)N1CCOCC1	915894242	XKCPXYMGZHYBCV-OAHLLOKOSA-N	434.518	1.539	50	20	IDGD	
CN(C)[C@H](CNC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)c1ccco1	915897152	XFFLQPRMJWEKRD-LJQANCHMSA-N	428.537	1.425	50	20	IDGD	
COc1ccccc1[C@H](NC(=O)NNC(=O)COc1ccc(C#N)cc1)c1nccn1C	916228294	KXDZUCZBPHMINA-FQEVSTJZSA-N	434.456	1.799	50	20	IDGD	
COc1cc(C=NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)ccc1OCC(=O)O	916276922	RPJOGFQDISODQD-UHFFFAOYSA-N	449.485	1.238	50	20	IDGD	
COc1cc(C=NNC(=O)[C@@H](C)CN2CCOCC2)ccc1OC(=O)c1cccnc1	916364565	PJVAGJJKVKHHAD-INIZCTEOSA-N	426.473	1.728	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@H]2C(=O)NNC(=O)c2ccc(C)cc2O)c(OC)c1	918339494	OYZXAONNDQYRTJ-KRWDZBQOSA-N	427.457	1.784	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)c1ccc(OC)c(S(=O)(=O)NC(C)(C)C)c1	919822936	VNPHRLRRTSCZRU-UHFFFAOYSA-N	449.529	1.784	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)NCCNC(=O)c2ccc(F)cc2)cc1	919916434	KJSBVFGQMGJCNI-AWEZNQCLSA-N	432.452	1.752	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@@H]1CCCN(CC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)C1	920419172	SDPRDEQVGVEHFT-AWEZNQCLSA-N	435.481	1.593	50	20	IDGD	
CCCCNC(=O)NNC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1	920765038	HDFREUOHJJPWMQ-ZDUSSCGKSA-N	427.483	1.126	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NCc1cccnc1N1CCN(C)CC1	921248068	QRRINLDOXMHPKJ-HNNXBMFYSA-N	430.484	1.270	50	20	IDGD	
CN1C[C@H](C(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)c2ccccc2C1=O	1320906130	RXIMZVOBMAMHIY-KRWDZBQOSA-N	430.505	1.650	50	20	IDGD	
Cc1nc(Cn2nnc(C(=O)NNc3c(F)cc(C(=O)NC4CC4)cc3F)c2C)no1	1322237875	KCRIZGDDOGQJAI-UHFFFAOYSA-N	432.391	1.254	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCCNS(=O)(=O)c2ccc(Cl)cc2C)cc1	1323827330	JMKLSMOBVLDDMR-UHFFFAOYSA-N	440.909	1.580	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)c1ncoc1[C@@H]1CCCO1	1333510754	XTKFSBZLFHTLOV-KRWDZBQOSA-N	447.923	1.758	50	20	IDGD	
CN(CC(=O)NNC(=O)c1n[nH]c2c1CCCC2)C(=O)c1ccc(Br)s1	1337594524	RNHNKNURJKNKEZ-UHFFFAOYSA-N	440.323	1.646	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)NCc2c(F)cccc2NS(C)(=O)=O)cc1	1340189103	YZVYAZUSHZXHFA-UHFFFAOYSA-N	438.485	1.799	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H]3Cc4ccccc4O3)C2)C1	1778243399	ZUTMXIVBEATBQT-LIVBEALHSA-N	437.334	1.851	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc4ncccn4n3)C2)C1	1778464925	BYNMHMRIMMHXMK-ROUUACIJSA-N	426.304	1.409	50	20	IDGD	
Cn1cc(C(=O)N2CC[C@@]3(CN(C(=O)CCBr)CCO3)C2)c2cccnc21	1778767164	HGNIVBOWLDLVGA-LJQANCHMSA-N	435.322	1.802	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc([N+](=O)[O-])[nH]2)C1	1780233773	KJHYOIKVCVOSHI-WPKBUWHJSA-N	428.873	1.304	50	20	IDGD	
COc1cccc(OC)c1C(=O)N1CC[C@@]2(CN(C(=O)CCBr)CCO2)C1	1780538135	FMDNZDLNNQTANI-LJQANCHMSA-N	441.322	1.932	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)C3(N4CCN(C)CC4)CC3)C2)C1	1781106346	PVOBANHNPJBKGC-FXAWDEMLSA-N	426.989	1.004	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(OC)c(OC)cc3C)C2)C1	1781895019	WLIMFYODNSWEAZ-HRAATJIYSA-N	440.924	1.710	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)N1C[C@H]3C[C@H]3C1)C2	1781998132	UNGAABAUGNMIJY-MVKVRZLJSA-N	442.398	1.624	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)n1cccc1C=O)C2	1782170275	GNLBQZNKQYJQEI-DZKDUJFISA-N	439.940	1.629	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1nccc3nc[nH]c13)C2	1782172405	AVZXMOLXLYHIQN-WAWZGNHOSA-N	435.912	1.339	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H]1Cc3ccccc3CN1)C2	1782172525	DZVAPMMQARTVNQ-DZCCDHAISA-N	449.979	1.469	50	20	IDGD	
O=C(c1cccn2nccc12)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1782333390	RPUYGYCUXCWJPO-PBHICJAKSA-N	425.258	1.468	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H]2CCCOC2)C1	1783211142	XHTQPEPUJDXYRV-WFXMFSGNSA-N	431.371	1.958	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccc4c(c3)CCN4C)CCO2)C1	1783534797	ZITYZQZQIIJQKA-VBKZILBWSA-N	436.350	1.906	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)/C=C/c3ccc(OC)cc3F)C2)C1	1783660236	IIAQDOPJVAHGGV-VYHZTRRPSA-N	440.899	1.931	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cc(OC)c(C)c(OC)c3)CCO2)C1	1783884108	PSSFGYCUZLQCHX-IIBYNOLFSA-N	440.924	1.710	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)C(=O)c1ccc(Cl)cc1	1784059935	HPFCMQFIZJOLEW-HNKHHVNMSA-N	429.300	1.102	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)C1CCC(C(F)(F)F)CC1	1784868879	XUVKAKJHSJMXCK-CBNMCHAISA-N	440.890	1.935	50	20	IDGD	
CC(C)(C)OC(=O)N1CC=C(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](F)Cl)CCO3)CC1	1785319327	UKPXZQIBCSRQSQ-FOIQADDNSA-N	445.919	1.918	50	20	IDGD	
CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)NC1(c2ccc(NC(=O)[C@@H](O)CCl)cc2)CCC1	1786138602	NKAZVSKYRBCFRN-MSOLQXFVSA-N	447.923	1.191	50	20	IDGD	
CS(=O)(=O)c1ccc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Cl)C[C@@H]32)cc1	1786700758	ZPMSQDUVDJSTIC-OWIUFQIYSA-N	446.928	1.147	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](CN)c3ccccc3)[C@H]2C1	1786922781	DJXRJMMTXOEZSE-YRPNKDGESA-N	433.625	1.560	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)n3cccc3C=O)[C@H]2C1	1786994862	LCOYQUVZBKOHPM-BJMQQELFSA-N	440.338	1.625	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cn4ccccc4n3)[C@H]2C1	1787838782	HIQBKETZDOAOEH-JKQORVJESA-N	449.349	1.959	50	20	IDGD	
C[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]21)N1C[C@H]2C[C@H]2C1	1788513617	ZGEUMQHCUPKMCR-YLRNSDIYSA-N	432.392	1.543	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCN3CCOC3=O)C[C@@H]21	1789868453	VERZYIBBASEZOX-WZTLGTBRSA-N	436.336	1.045	50	20	IDGD	
CCOC(=O)c1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](O)CCl)C[C@@H]32)cc1	1790259573	PNUHRIVUNRWTKQ-XSLAGTTESA-N	438.908	1.056	50	20	IDGD	
COC(=O)c1ccc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Cl)C[C@@H]32)cc1	1791417165	TWDLAJWTALVQQU-OVWQWFNUSA-N	426.872	1.530	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3c[nH]c4ncccc34)[C@H]2C1	1792206877	TXFQGWPLYYSQFK-WNHJNPCNSA-N	448.951	1.729	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(C)(C)CCl	1792785926	HYXBPROTYTZBKW-MIFYACCESA-N	431.961	1.756	50	20	IDGD	
COc1ccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](O)CCl)c(Cl)c1	1792974758	BPAWXQYINAMIDG-ZDFLXESQSA-N	431.316	1.080	50	20	IDGD	
Cc1ccc(-c2ncccc2C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](O)CCl)cc1	1792976687	JMFABHOGCYLJOU-PIKOESSRSA-N	443.931	1.860	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(C(F)F)no1	1795913266	KGHAFNHZCJGRGI-ORXSELOVSA-N	436.253	1.846	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CSC(=N)N	1795945930	WPSNJFGMWRQFTD-RNJOBUHISA-N	447.989	1.383	50	20	IDGD	
Cc1cc(Br)cnc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Cl	1796363139	RHWRKSCFVFMCFS-DJBIQUGXSA-N	434.693	1.890	50	20	IDGD	
Cc1nc(Br)sc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2	1796742369	OQLXBFCWQZGWRE-PKIKSRDPSA-N	440.722	1.952	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccncc1C(F)(F)F)c1ccc(B(O)O)cc1	1797098862	MTBSTJNYXKEIQM-MUJYYYPQSA-N	447.222	1.346	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1n[nH]c2ccc(F)cc12	1797480322	DPEHYIKDWIXWFF-ZVXAKGHKSA-N	439.285	1.689	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cn2ccc(Cl)cc2n1	1797663951	KHACAEUTGHLRIF-MUJYYYPQSA-N	446.939	1.613	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccnc1OCC1CC1)C2	1800973501	BJUJWXCJEQZBAL-MVJTYMMSSA-N	437.924	1.327	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)Cc1ccc(F)cc1)C2	1800979737	YAVHHRQYUNERIL-XYYYAOKXSA-N	426.916	1.848	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc([N+](=O)[O-])c3c1OCO3)C2)C(Cl)Cl	1801016367	DUKJTKUUXNCDRI-BZBKMWRSSA-N	446.243	1.330	50	20	IDGD	
Cc1ncc(/C=C/C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)Br)C3)s1	1801494211	MPUPPEQWKQBJOV-XMIFDPAWSA-N	428.352	1.838	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)[C@@H]1CC=CCC1	1803026601	QLIVTIMXWSBZGO-AGHHOFFYSA-N	433.317	1.437	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]2c2cccnc2)c(O)c1	1803141375	NMQPGCUEODXQTD-NIKGAXFTSA-N	433.892	1.715	50	20	IDGD	
Cc1csc(C(=O)N2CCCC3(CCN(C(=O)c4cccc(B(O)O)c4)CC3)C2)c1	1806241255	WUTCCVINLBWYPK-UHFFFAOYSA-N	426.347	1.895	50	20	IDGD	
O=C(CCBr)NC[C@H]1CCN(C(=O)CCn2cncn2)[C@H]1c1cccnc1	1806346270	DXMYQQHLYAVULL-QAPCUYQASA-N	435.326	1.554	50	20	IDGD	
CC(C)C1(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)CCC1	1807373723	FFCMUKIZHFMOJG-IFMALSPDSA-N	449.360	1.907	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@@H](CNC(=O)c2cc(O)nc(O)n2)[C@H]1c1cccnc1	1808295524	KSRFDQJOYGVYCO-XJKSGUPXSA-N	433.896	1.867	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)[C@@H]2C[C@@H]2F)[C@H]1c1cccnc1	1808408083	GPBFKUXVZXGEPR-WETNBHBUSA-N	440.479	1.579	50	20	IDGD	
Cc1ccoc1C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1808494429	PMBCMZKAYYHYOP-AZUAARDMSA-N	433.273	1.296	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cnsn2)[C@@H]1c1cccnc1)[C@@H](F)Br	1808652203	WEYLAMVAKZQHKI-CYZMBNFOSA-N	428.287	1.943	50	20	IDGD	
CN1C(=O)CC[C@H]1C(=O)NC[C@H]1CCN(C(=O)CO[Si](C)(C)C)[C@H]1c1cccnc1	1808768667	BKFULTGBSUVPFL-UWVAXJGDSA-N	432.597	1.560	50	20	IDGD	
O=C(CCBr)N1CCCC2(CCN(C(=O)c3cc(O)nc(O)n3)CC2)C1	1809067168	WACPUYKPIMFXOH-UHFFFAOYSA-N	427.299	1.518	50	20	IDGD	
Cc1cccc(CC(=O)N2CCCC3(CCN(C(=O)c4cccc(B(O)O)c4)CC3)C2)c1	1809248845	XDUHEUIJBILDEQ-UHFFFAOYSA-N	434.345	1.762	50	20	IDGD	
O=C1CCc2ccc(C(=O)N3CCCC4(CCN(C(=O)[C@H](O)CCl)CC4)C3)nc2N1	1810474181	LNDBFYJUQIMMEU-MRXNPFEDSA-N	434.924	1.411	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@H]1CCN(C(=O)CN2CCCCC2=O)[C@@H]1c1cccnc1	1810547325	DSJRSLCHJBWCPL-XMSQKQJNSA-N	446.624	1.951	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCSC)[C@@H]1c1cccnc1	1813032440	BISUDBISSDEXOS-MWDXBVQZSA-N	429.970	1.455	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)c3cnccc3F)sc2C1	1815972023	BVIPZJOZDWYPID-LLVKDONJSA-N	434.497	1.276	50	20	IDGD	
O=C(CCBr)N[C@@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1	1816722482	IOEQEVOZWKETTR-SECBINFHSA-N	441.307	1.960	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)/C=C/c2ccoc2)[nH]n1)c1ccc(B(O)O)cc1	1817470816	HUAMBUFHCZNGNS-ROSSNEFBSA-N	434.261	1.702	50	20	IDGD	
Cc1noc(C)c1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1	1817471401	YNAXHZGEAAEXNW-QGZVFWFLSA-N	437.265	1.314	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CO)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](F)Cl)n[nH]1	1818037243	HDBSHMKSGODSEU-OUCADQQQSA-N	447.895	1.822	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)CCNC(=S)NC)sc2C1	1819802370	MMQOKPKBOCSPIN-WDEREUQCSA-N	432.015	1.947	50	20	IDGD	
COc1cccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)c1	1820514006	JSBGLLPNLWFDJN-FQEVSTJZSA-N	448.288	1.718	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CN2CCCCC2=O)[nH]n1	1822373911	ARCXVEYLZMFAGF-DZGCQCFKSA-N	425.917	1.668	50	20	IDGD	
COc1ccnc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)c1	1822415426	ZOXKMOIPBGNWFN-QGZVFWFLSA-N	443.508	1.492	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H]2CCCSC2)[nH]n1	1822418293	ZFAQTBMCKUMUFM-GDBMZVCRSA-N	436.582	1.918	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CN2C(=O)C=CC2=O)n[nH]1	1822531479	HWOOXEYKKNILEP-JQWIXIFHSA-N	438.282	1.110	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)C[C@H]2NC(=O)NC2=O)CC1	1824011678	ZKPSVXGLZRLWGR-HUUCEWRRSA-N	426.945	1.469	50	20	IDGD	
O=C([C@@H](O)CCl)N1CCC([C@H]2CCCCN2C(=O)C(F)(F)C(F)(F)C(=O)O)CC1	1824865607	GUHKOWDNCGTWKU-NEPJUHHUSA-N	446.825	1.561	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](C)Cn1cncn1)CC2	1825999924	GPGHBMFOADFTJB-UTUOFQBUSA-N	426.930	1.237	50	20	IDGD	
Cc1cccc(CC(=O)N[C@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)c1	1826085427	TURWXYUWJKNMED-INIZCTEOSA-N	443.573	1.979	50	20	IDGD	
O=C([C@@H]1[C@@H]2C=CS[C@@H]12)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827053466	QKUWRZRCLBRKNZ-DOIPELPJSA-N	440.374	1.475	50	20	IDGD	
Cc1ccc(CC(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2ccc(B(O)O)cc2)CC3)o1	1827080176	FPLRMBQXRXHUDM-HNNXBMFYSA-N	439.302	1.193	50	20	IDGD	
O=C([C@H](F)Cl)N1CCC([C@H]2CCCCN2C(=O)c2n[nH]c3c2CS(=O)(=O)C3)CC1	1827270650	UITYZNOJWPWRHY-ZBFHGGJFSA-N	446.932	1.606	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1CCc2nc(NC(=O)C34CC(C3)C4)sc2C1	1827354557	SNDWJKPZVUWYFW-IMKMIKCMSA-N	426.502	1.168	50	20	IDGD	
CC/C=C(\C)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnccc1C(=O)NN)CC2	1827452716	KDMJOUSTADQJQC-QNCMIEPLSA-N	428.518	1.724	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@H]1CCc2nc(NC(=O)CC3CCC3)sc2C1	1828109431	QPQGGFIPEVHFCA-LBPRGKRZSA-N	428.518	1.558	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2c[nH]c(=O)cn2)CC1	1829718725	ZUIMVSMRWSHYCP-DOMZBBRYSA-N	425.327	1.787	50	20	IDGD	
Cc1ccc(F)cc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1830077677	CGUBDFVPOGXZNL-CRAIPNDOSA-N	447.276	1.895	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)[C@@H](C)CC)CCO2	1831518001	LRYNJHXKVXOGIQ-XSWJXKHESA-N	435.359	1.023	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CC(=O)OC(C)(C)C)C2)C1	1831639586	CPAGKLUIWOGMPT-MGPUTAFESA-N	432.945	1.582	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)CCCc3cccnc3)CC2)CC1)[C@H](O)CCl	1833313159	YBSMBCKFXVCJPM-HXUWFJFHSA-N	436.984	1.576	50	20	IDGD	
C#CCO[C@@H](C)C(=O)NC1CCN(C2CCN(C(=O)[C@](C)(Cl)CCl)CC2)CC1	1833466819	SDNRCOZHFBJVPM-MGPUTAFESA-N	432.392	1.833	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1)c1cc(=O)cco1	1834342687	YMAPWEIDXMTBAE-UHFFFAOYSA-N	440.338	1.610	50	20	IDGD	
COC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)CCBr)CC2)CC1	1834421130	JUXZIIBPUNDXSY-UHFFFAOYSA-N	432.359	1.296	50	20	IDGD	
Cc1nc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)cs1	1834460348	ZZCPLAXZRZUYLD-ZBEGNZNMSA-N	432.340	1.305	50	20	IDGD	
O=C(Cn1nnc2ccccc21)N1CCC(OC2CCN(C(=O)[C@H](F)Cl)CC2)CC1	1837025035	HFCMQZAYKBDKOS-IBGZPJMESA-N	437.903	1.964	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cc(C)nc(O)c3)CC2)CC1	1838090173	FZFXRXLKIWDJOY-GOSISDBHSA-N	439.940	1.962	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccc4c(c3)OCO4)C2)C1	1839143787	HZJBKJMHSIWIEC-KKSFZXQISA-N	438.908	1.432	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3c(F)ccc(O)c3F)C2)C1	1839146906	ABCOTTLFWNFVTK-CWTRNNRKSA-N	432.851	1.758	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(C=O)s3)C2)C1	1839151669	ABWAQMOOSSICKI-QZTJIDSGSA-N	449.356	1.867	50	20	IDGD	
Cc1ccncc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)Br)CCO2	1840032793	KFXQYYUSZUTCHO-KSSFIOAISA-N	426.311	1.243	50	20	IDGD	
CC(C)n1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)n1	1840034533	OJESPYLHQOLSPK-KSSFIOAISA-N	443.342	1.317	50	20	IDGD	
C[C@H](Nc1nccs1)C(=O)N1CCOC[C@@]2(CN(C(=O)C(Cl)Cl)CCO2)C1	1840187496	FMTKBRLFHXOKKS-ZBEGNZNMSA-N	437.349	1.204	50	20	IDGD	
C[C@]1(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)CC=CCC1	1840557187	SBBKMJODTNLZBU-FHLIZLRMSA-N	433.318	1.880	50	20	IDGD	
O=C(CCc1c[nH]c2ncccc12)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1840871129	TZAJCSXOASOUKQ-XLIONFOSSA-N	438.887	1.486	50	20	IDGD	
CC(C)n1nc(C(=O)N2CCCC23CN(C(=O)[C@@H](F)Br)C3)cc1C(=O)O	1842261057	PGFTWLXZYAYLOV-GFCCVEGCSA-N	431.262	1.670	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H]2C[C@@H](C[C@@H]2O)[C@H]1C(=O)N1CC2(CCCN2C(=O)[C@@H](F)Cl)C1	1843366577	GPWQDKCZZNEOGQ-YYFQZIEXSA-N	445.919	1.483	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2O)C1	1843824739	DDSLUFLGNXKDHW-JYJNAYRXSA-N	443.972	1.825	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1ccc2c(c1)C[C@@H](c1ccccc1)OC2=O	10301999	RAQVLJPAWBLRTE-QAPCUYQASA-N	428.466	1.337	50	20	IDGD	
COc1ccc(SCCC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1	12614938	SCQVDVAQYHNSND-UHFFFAOYSA-N	437.543	1.889	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCCC2)cc1)NNC(=O)Cc1ccc(F)cc1	15765423	UCZCALZORZSQAK-UHFFFAOYSA-N	433.505	1.933	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C[C@](O)(c2nccn2C)C(F)(F)F)cc1OC	105566976	LQSPZXUJIDBHSV-SFHVURJKSA-N	444.410	1.819	50	20	IDGD	
Cc1ccc(C(=O)N2CCN(C(=O)NNC(=O)CNC(=O)c3cccs3)CC2)cc1F	725872036	AIPUTTYHEZQQPJ-UHFFFAOYSA-N	447.492	1.124	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)CC3CCCCC3)CC2)cc1	727348540	UGAWIBIDBWQLCL-UHFFFAOYSA-N	436.578	1.419	50	20	IDGD	
CC(=O)NNC(=O)c1cc(I)ccc1I	727847704	QWSYMQFCBKZRAZ-UHFFFAOYSA-N	429.983	1.677	50	20	IDGD	
COCCOc1cccc(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)c1	728216349	XJIRHRSXVWFBGH-UHFFFAOYSA-N	448.545	1.405	50	20	IDGD	
COc1ccccc1C(=O)N[C@@H](CCSC)C(=O)NNC(=O)c1cccc(C#N)c1	728872845	QLQXJKAXXZBIQE-KRWDZBQOSA-N	426.498	1.880	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(C)cc([N+](=O)[O-])c2N)c1	729510177	WHCLXYUDOVWRPU-UHFFFAOYSA-N	449.489	1.591	50	20	IDGD	
CS(=O)(=O)CCCC(=O)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1	731188480	BTCCVVOBHZVYCT-FQEVSTJZSA-N	429.542	1.586	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)c1csc(S(=O)(=O)N2CCc3ccccc3C2)c1	732086870	LXIJYAUQHUORJA-UHFFFAOYSA-N	445.526	1.601	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2ncoc2-c2ccccc2)cc1	732549476	YCOOJLOFUJLRRF-UHFFFAOYSA-N	428.470	1.732	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCC[C@@H](CNC(=O)C(C)(C)C)C1	732990041	ZQQDLKMJBFQUQF-AWEZNQCLSA-N	438.956	1.984	50	20	IDGD	
O=C(Cn1c(S)nnc1-c1cccs1)NNC(=O)c1cnn(-c2ccccc2)c1	733169970	KRCRZSHMMXHGDB-UHFFFAOYSA-N	425.499	1.942	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)c1ccc(CSc2nc[nH]n2)cc1	734242235	YDMRHPYWBVDGFP-UHFFFAOYSA-N	435.510	1.566	50	20	IDGD	
O=C(Cn1[nH]cc2c(=O)ncnc1-2)NNc1cc(C(F)(F)F)nc(-c2cccnc2)n1	734257104	FADBEMALIDTZJA-UHFFFAOYSA-N	431.338	1.085	50	20	IDGD	
CN(Cc1ccccc1Br)C(=O)CCNC(=O)NNC(=O)c1cnn(C)c1	735582388	ZBOQXSDQMPZQEI-UHFFFAOYSA-N	437.298	1.175	50	20	IDGD	
O=C(NCc1ccc(O)c(F)c1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	739058263	DWAXILKJABULSK-UHFFFAOYSA-N	436.465	1.460	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)CN(C)C(=O)c1ccc(Br)s1	740850145	VQHKGBKERHISOH-UHFFFAOYSA-N	433.328	1.035	50	20	IDGD	
C[C@H](CC(=O)NNC(=O)Cc1c[nH]c2ccccc12)/N=C1/NS(=O)(=O)c2ccccc21	742478215	NGQVCMSVSZCDGU-CYBMUJFWSA-N	439.497	1.375	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cc(Br)c[nH]2)cc(NC(C)=O)c1OC	742490210	ZHUGAKUXKUZTAV-UHFFFAOYSA-N	425.239	1.828	50	20	IDGD	
O=C(NNC(=S)NCc1ccc(OC(F)(F)F)cc1)c1ccc(-n2cnnn2)cc1	742977214	VJAHHWSFGJXEOI-UHFFFAOYSA-N	437.407	1.870	50	20	IDGD	
Cc1c(C)c(C)c(S(=O)(=O)NCCC(=O)NNc2ncnc3[nH]cnc23)c(C)c1C	743471596	QTLPZTZMKMHGQW-UHFFFAOYSA-N	431.522	1.707	50	20	IDGD	
CN1CCC(N2CCC(NC(=O)NNC(=O)c3cccc(Br)c3)CC2)CC1	743589785	YYKBVQATFVAAIX-UHFFFAOYSA-N	438.370	1.952	50	20	IDGD	
O=C(CSCC(=O)N1CCCCC1)NNC(=O)c1cc(Br)ccc1O	743730030	LYNCQVIODSBXMU-UHFFFAOYSA-N	430.324	1.661	50	20	IDGD	
Cc1ccc(C)c(S(=O)(=O)NCCC(=O)NNC(=O)Nc2ccc(N(C)C)cc2)c1	743828540	RPQZLGACWQYZAU-UHFFFAOYSA-N	433.534	1.891	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNS(=O)(=O)c2cc(C)cc(C(=O)O)c2O)cc1	743836438	PSPSELNBWUXDPU-GFCCVEGCSA-N	438.458	1.575	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)[C@]23CCC(=O)N2c2ccccc2S3)cc1	744618995	WZXVUDKNILPZBB-OAQYLSRUSA-N	436.449	1.491	50	20	IDGD	
COc1ccc(Br)cc1C(=O)OCC(=O)NNC(=O)Cc1nc(C)cs1	745120761	HTKHIYRAVJEBAW-UHFFFAOYSA-N	442.291	1.770	50	20	IDGD	
O=C(NNC(=O)[C@H](O)c1ccccc1)c1nn(Cc2ccccc2)c(=O)c2ccccc12	746094816	FJNPZJOMFAXHDN-OAQYLSRUSA-N	428.448	1.939	50	20	IDGD	
CCc1ccccc1OCC(=O)NNS(=O)(=O)c1ccc(OCc2ncnn2C)cc1	746591022	HQQBFOSRKGGELK-UHFFFAOYSA-N	445.501	1.345	50	20	IDGD	
Nc1ccc(Br)c(C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c1	747105103	VQPPEKFBWIGLOP-UHFFFAOYSA-N	437.206	1.558	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@@H]3CCN(C)c4ccccc43)CC2)cc1	750786540	CUNJQWXACNRVGN-JOCHJYFZSA-N	435.572	1.884	50	20	IDGD	
O=C(/C=C/c1ccc(I)o1)NNC(=O)CNC(=O)c1cccs1	751215655	UZKHUOHNQQWQJC-GQCTYLIASA-N	445.238	1.536	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc(Cl)ccc1[N+](=O)[O-])c1csc(N2CCOCC2)n1	751264608	WVGMBRJGBKAYQV-UHFFFAOYSA-N	447.882	1.165	50	20	IDGD	
NS(=O)(=O)c1cc(Cl)c(F)c(C(=O)NNC(=O)c2cc(-c3ccccc3)on2)c1	752268620	QOGOMUUZIZZMSF-UHFFFAOYSA-N	438.824	1.856	50	20	IDGD	
C[C@@H]1CCN(c2cc(C(=O)OCC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)ccn2)C1	752600783	AFMWRCAPXGVRAF-CYBMUJFWSA-N	427.417	1.454	50	20	IDGD	
COc1cccc([C@@H](C)CC(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)c1	753276012	CABPQVKRQSFPEP-NSHDSACASA-N	425.894	1.951	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2ccc(-n3cnnn3)c(C)c2)c2ccccc2c1=O	755680613	RWVGZNUUUNUBPO-UHFFFAOYSA-N	433.432	1.167	50	20	IDGD	
COc1ccc(C(=O)N2CCOCC2)cc1NC(=O)NNC(=O)c1cc(Cl)ccc1O	756256326	HGNRWLBLZJNOSZ-UHFFFAOYSA-N	448.863	1.993	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)Nc2ccc(OC)c(-n3nnnc3C)c2)cc1	756320812	QKFNLJJYHJADMF-UHFFFAOYSA-N	425.449	1.773	50	20	IDGD	
COCc1nc2n(n1)C[C@H](NC(=O)NNC(=O)COc1cc(C)ccc1C(C)C)CC2	757795295	LRMORXXWBQFBFP-OAHLLOKOSA-N	430.509	1.581	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1ccnc(OCC(F)F)c1	758079927	WGSZAVHFLNWKBF-UHFFFAOYSA-N	427.433	1.402	50	20	IDGD	
CC(=NNC(=O)C(=O)Nc1ccccn1)c1ccc(S(=O)(=O)NCc2ccco2)cc1	758387070	GKRQAFWBXZSRBG-UHFFFAOYSA-N	441.469	1.632	50	20	IDGD	
CCO[C@@H]1COCC[C@@H]1NC(=O)NNC(=O)[C@H](C)Oc1cccc(Br)c1	759217832	XKMDUCUBJUNQES-TUKIKUTGSA-N	430.299	1.741	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)c2cn(C3CCN(C(=O)OC(C)(C)C)CC3)nn2)nc1	759722054	VLFQCEOSGMGHKU-UHFFFAOYSA-N	445.480	1.789	50	20	IDGD	
CC1(Cn2cc(C(=O)NNc3ccc(S(=O)(=O)Nc4ccccc4)cc3)nn2)COC1	760238191	OIBBLKJFBLCFPO-UHFFFAOYSA-N	442.501	1.872	50	20	IDGD	
Cc1ccnc(-n2nccc2NC(=O)C(=O)NNC(=O)C2=S=C3CCCCCC3=C2)c1	760276239	ATQLVNPWQQLQSP-UHFFFAOYSA-N	438.513	1.644	50	20	IDGD	
NC(=O)CC[C@@H](NS(=O)(=O)c1ccccc1C(F)(F)F)C(=O)NNc1ccccn1	760489245	DYTQSOOGTJJNKF-GFCCVEGCSA-N	445.423	1.156	50	20	IDGD	
CC[C@@H](C)n1ncc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1C1CC1	760627911	SSBWYMDJMKERSD-FZKQIMNGSA-N	442.472	1.876	50	20	IDGD	
CCCS(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)c2ccccc2)c(OC)c1	761268066	ZWSOHQINFYPBBF-UHFFFAOYSA-N	427.504	1.470	50	20	IDGD	
Cc1sc(Cl)nc1C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	762871318	OEPMOKFNUNVEQK-UHFFFAOYSA-N	430.943	1.193	50	20	IDGD	
COC(=O)c1cc(C(=O)NNC(=O)c2cc(-c3ccc(OC)c(OC)c3)[nH]n2)ccn1	763146150	BQCLEZUAQSEEIB-UHFFFAOYSA-N	425.401	1.350	50	20	IDGD	
CCN(CC)C(=O)COc1ccc(C(C)=NNC(=O)CNC(=O)c2cccnc2)cc1	763199083	LXGLIVRRFZRXOP-UHFFFAOYSA-N	425.489	1.599	50	20	IDGD	
Cc1ccc(Cn2nccc2NC(=O)C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)s1	763455385	RGLANGPHNUZXLD-UHFFFAOYSA-N	428.430	1.609	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(Oc2ccccc2)c(NC(=O)C(=O)NNC(C)=O)c1	763515834	UTHIMMWNDWYWNA-UHFFFAOYSA-N	448.501	1.615	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2ccccc2C(=O)N2CCCCC2)c1	763623907	QOPNAJVNQPNKTC-UHFFFAOYSA-N	438.484	1.786	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(F)cc1Br	763662551	JLDKFOLSWOLUAJ-UHFFFAOYSA-N	440.225	1.762	50	20	IDGD	
CCN1CCC(n2nccc2NC(=O)C(=O)NNC(=O)COc2cc(C)ccc2C)CC1	763664618	CXZMKQNWXPLCPW-UHFFFAOYSA-N	442.520	1.322	50	20	IDGD	
CNC(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)COc2cc(C)ccc2C)c1	763665094	DQUARQWJRMRPDS-UHFFFAOYSA-N	432.864	1.481	50	20	IDGD	
COC(=O)N(C)Cc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(N(C)C)c2)cc1	763760208	HCZRUSGNGIHSGJ-UHFFFAOYSA-N	427.461	1.351	50	20	IDGD	
CCn1cnnc1-c1ccccc1NC(=O)C(=O)NNC(=O)c1cc(OC)cc(OC)c1	763771996	KAMBJOIYRWTOFC-UHFFFAOYSA-N	438.444	1.382	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2ccc(OCC3CC3)cc2)c2ccccc2c1=O	763785113	FJXKKIAOTOJDQZ-UHFFFAOYSA-N	449.467	1.605	50	20	IDGD	
O=C(CCc1nc(-c2ccc(Cl)cc2)no1)NNC(=O)CNC(=O)c1cccnc1	763818630	MRQJYHWLNNPUES-UHFFFAOYSA-N	428.836	1.295	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)CCC(=O)N3C)c1C	763838905	CQRBVUBFIXUTJW-OAHLLOKOSA-N	438.484	1.766	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)cc1N1CCOC1=O	763855854	BTBCAKHMRXDTHL-ZDUSSCGKSA-N	444.419	1.644	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cccc(-c3nnco3)c2)cc1	763861862	RKVUOIYBNFBUMK-ZDUSSCGKSA-N	439.428	1.689	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(OCC#N)c2)cc1OC	763910315	DITFOTRNNLIPCY-UHFFFAOYSA-N	426.429	1.786	50	20	IDGD	
CNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CC[C@@H](C)C3)c1C	763938389	DXWAXEOMOHJCIY-LLVKDONJSA-N	428.514	1.941	50	20	IDGD	
Cc1ccn(C)c(=O)c1NC(=O)C(=O)NNC(=O)c1ccc(-c2ccc(F)cc2)s1	763976638	XVKAVTZMLVKVBK-UHFFFAOYSA-N	428.445	1.961	50	20	IDGD	
O=C(NNC(=O)c1ccc[nH]1)C(=O)Nc1ccnn1Cc1cccc(Br)c1	763980661	LAPDWTGSSLMTLL-UHFFFAOYSA-N	431.250	1.422	50	20	IDGD	
COc1cc(OC)c(Cn2nccc2NC(=O)C(=O)NNC(=O)C2CCCC2)c(OC)c1	764077580	QXWGEEZARVALJB-UHFFFAOYSA-N	445.476	1.233	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)CCc3ccco3)cc2F)C[C@H](C)O1	764168344	DIFQJNZGDJTSEI-KBPBESRZSA-N	432.452	1.751	50	20	IDGD	
O=C(CCCc1ccccc1)NNC(=O)C(=O)Nc1cc(F)cc(N2CCOCC2)c1	764225123	YPFKTZWRSXORRS-UHFFFAOYSA-N	428.464	1.771	50	20	IDGD	
Cc1nc(-c2ccc(NC(=O)C(=O)NNC(=O)c3cccc(OC(F)F)c3)cc2)n[nH]1	764251765	YHTAURUQCOEWHP-UHFFFAOYSA-N	430.371	1.781	50	20	IDGD	
O=C(Cc1ccccn1)NNC(=O)C(=O)Nc1ccn(-c2cccc(C(F)(F)F)c2)n1	764263171	ALDBCWCZYXDOHR-UHFFFAOYSA-N	432.362	1.615	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)C[C@@H](C)O1	764319423	DYLHBJLKBXRSNL-SCTDSRPQSA-N	432.521	1.434	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)C(=O)Nc1cc(S(N)(=O)=O)cc(C)c1C)c1ccccc1	764329905	QOWHKEZZEDEKBI-MRXNPFEDSA-N	432.502	1.231	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1)C(=O)Nc1ccccc1-n1ccnn1	764387234	GTJFJBDWAKMUTO-UHFFFAOYSA-N	434.391	1.196	50	20	IDGD	
Cc1nc(-c2cccc(NC(=O)C(=O)NNC(=O)c3cc(-c4ccc(F)cc4)[nH]n3)c2)n[nH]1	764388337	QXLHZIYCIXJTTF-UHFFFAOYSA-N	448.418	1.709	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)cc1F	764389141	ZVFMLNYWSBVUGL-UHFFFAOYSA-N	443.366	1.541	50	20	IDGD	
CCc1noc(-c2cc(Cl)ccc2NC(=O)C(=O)NNC(=O)[C@H](C)OCCOC)n1	764398937	IUIAVFVJGAQCBL-JTQLQIEISA-N	439.856	1.090	50	20	IDGD	
COc1ccc(Sc2ccc(NC(=O)C(=O)NNC(=O)[C@@H]3COCCO3)cc2)cc1	764424231	GTDZDZMTENJKNX-KRWDZBQOSA-N	431.470	1.348	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)C(=O)Nc2ccc(Cl)c3ncccc23)c1	764434841	ZGNCUKYGZPRTAB-UHFFFAOYSA-N	426.820	1.641	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)N[C@H](C)Cn2ncc3ccccc3c2=O)cc1C	764460282	FBQQQYBKYPCEFY-OAHLLOKOSA-N	436.472	1.371	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNS(=O)(=O)c3c(F)cccc3F)CC2)cc1	765125466	FXUMDBRZIXZWJK-UHFFFAOYSA-N	438.500	1.401	50	20	IDGD	
C#CCNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)cc1	765617076	RTNASPQPNWMDJE-UHFFFAOYSA-N	441.444	1.202	50	20	IDGD	
CC(=O)Nc1ccc(CC(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)cc1	765748835	RIAQVLVPSCEWEM-UHFFFAOYSA-N	437.544	1.461	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)N[C@@H]1CC(=O)N(c2ccc(Cl)c(F)c2)C1	766554027	SQRWAFCCEDPELV-CYBMUJFWSA-N	444.854	1.805	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)c1cc(S(=O)(=O)N(C)C)ccc1O	766968732	VLLRTXYASNSGDZ-UHFFFAOYSA-N	445.501	1.016	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)Nc1nc(CN2CCOCC2)cs1	767221727	LJFXFNJHUPOZEK-UHFFFAOYSA-N	441.535	1.536	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)CO[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	767730783	RCIFAUFBUCMYPF-OAHLLOKOSA-N	437.493	1.638	50	20	IDGD	
COc1ccc(CN2CCCN(CC(=O)NNC(=O)Cc3ccccc3C)CC2=O)cc1	767931253	OHOLHAFICKUKCI-UHFFFAOYSA-N	438.528	1.428	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc2c(cc1OC)CCC(=O)N2	768238623	RQIDVFBCWMQDSP-UHFFFAOYSA-N	440.456	1.307	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)c2cccc([C@@]3(C)NC(=O)NC3=O)c2)cc1	768915095	XSJOHEZKHIPXIT-WHEQGISXSA-N	440.456	1.368	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)CN2C(=O)N[C@]3(CCCC(C)(C)C3)C2=O)cc1	768927358	GFFLMKOBPKDVDF-NRFANRHFSA-N	431.493	1.145	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)c2nccn3c(Br)cnc23)cc1	769875296	AEIWOFYHKWXUET-UHFFFAOYSA-N	432.234	1.418	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)c1cc(C(F)(F)F)ccc1Br	770258123	RZEDKECAUSSUIK-ZETCQYMHSA-N	429.214	1.664	50	20	IDGD	
CS(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)CCCc2ccccc2)cc1F	771142051	DCZXNBUZAMAMEH-UHFFFAOYSA-N	429.495	1.530	50	20	IDGD	
Cc1cccc(F)c1NNC(=O)NCc1ccccc1S(=O)(=O)N1CCN(C)CC1	771328805	ZRDNZZNWFPGUHX-UHFFFAOYSA-N	435.525	1.897	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@H](C(=O)NNc2ccnc(Br)c2)[C@H](C)O)cc1	771551682	HEZHTBBSXDJVJX-NHYWBVRUSA-N	443.323	1.324	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1cnn([C@H]2CCCN(C(=O)OC(C)(C)C)C2)c1	772300799	NWCNZFQRLKZCLN-ZFWWWQNUSA-N	437.497	1.558	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)C[C@H]2CSCCN2C(=O)OC(C)(C)C)C[C@@H](C)O1	772374222	NVKUYGCMPASZCX-OAGGEKHMSA-N	444.598	1.376	50	20	IDGD	
CC(C)(C(=O)NNC(=O)Nc1ccc(S(=O)(=O)N2CCOCC2)cn1)c1ccccc1	776062636	YXVXMCKAYZTYET-UHFFFAOYSA-N	447.517	1.233	50	20	IDGD	
NS(=O)(=O)c1ccc(N2CCOCC2)c(C(=O)NNc2ccc3ccccc3n2)c1	777462209	FNAOGDDPUHAMFH-UHFFFAOYSA-N	427.486	1.476	50	20	IDGD	
Cc1nc(Cc2nnc(SCC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)o2)cs1	779999915	HMSKTODCXKQGTM-UHFFFAOYSA-N	434.459	1.887	50	20	IDGD	
O=C(COC(=O)c1ccc(OC2CCCC2)nc1)NNC(=O)c1cccc([N+](=O)[O-])c1	781760090	UIRNAMQBFGRREP-UHFFFAOYSA-N	428.401	1.929	50	20	IDGD	
O=S(=O)(CBr)NCCc1ccc(S(=O)(=O)N2CCCCC2)s1	782453835	JJNNZRSJRBOPFN-UHFFFAOYSA-N	431.399	1.737	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N[C@H](CO)C1CCOCC1	782494579	WBJDOWLSQAMFSB-XHDPSFHLSA-N	430.299	1.334	50	20	IDGD	
O=C(NNc1ccc(-n2cccn2)nn1)C(=O)Nc1ccc(OC(F)F)c2ncccc12	783433159	LSYTUWPFDGYHBN-UHFFFAOYSA-N	440.370	1.894	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNc3ccnc(Br)c3)cn2)C[C@@H](C)O1	784837266	KWSCJVIDVBYBCK-TXEJJXNPSA-N	449.309	1.935	50	20	IDGD	
COc1cccc(NNC(=O)C(=O)Nc2cccc(N3C(=O)c4ccccc4C3=O)c2)n1	784847539	HXPGOVVTQIKOLJ-UHFFFAOYSA-N	431.408	1.973	50	20	IDGD	
CCNC(=O)N(C)NC(=O)C(=O)Nc1c(C)cnn1[C@H]1CCN(Cc2ccccc2)C1	784916336	OHOCJFSWBJERJZ-KRWDZBQOSA-N	427.509	1.270	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)C(=O)Nc1ccc(OC2CCC2)c(F)c1	785061038	RLJHKPSVWGHYLY-UHFFFAOYSA-N	425.420	1.733	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2cc(S(N)(=O)=O)cc(C)c2C)cc1Cl	785120323	RCRFLSJXOHKHNV-UHFFFAOYSA-N	426.882	1.695	50	20	IDGD	
O=C(COC(=O)[C@@H](Cc1ccccc1)NC(=O)c1cccnc1)NNC(=O)c1ccccc1	785764739	GERNEVQDVGEJAM-HXUWFJFHSA-N	446.463	1.427	50	20	IDGD	
Cc1ccc(CNC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c(-n2cc(Cl)cn2)n1	786835084	YJQOCKFGLMFZIW-QGZVFWFLSA-N	442.863	1.900	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3cn(C)nc3-c3ccoc3)cc2)CC1	790001130	RWMSSJOQMSATNX-UHFFFAOYSA-N	444.517	1.373	50	20	IDGD	
O=C(NNc1cccc(F)c1[N+](=O)[O-])c1cc(S(=O)(=O)N2CCSCC2)c[nH]1	790588691	JQPGLBHIHCDQEG-UHFFFAOYSA-N	429.455	1.556	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)NC(=O)OC(C)(C)C	792265957	ZSOIWKXHAOOJJF-NSHDSACASA-N	429.499	1.339	50	20	IDGD	
O=C(NNC(=O)[C@@H]1[C@H]2[C@H]3C[C@@H]4[C@H]5[C@@H](C[C@H]42)[C@@H]1[C@@H]53)c1cccc(S(=O)(=O)N2CCCC2)c1	792773389	HHULZLRMLZSAFO-MMERRTHSSA-N	441.553	1.626	50	20	IDGD	
CCOC(=O)Cc1cccc(S(=O)(=O)NNC(=O)c2cc(Br)c[nH]2)c1	795290067	JUBVPJWBFOGLSM-UHFFFAOYSA-N	430.280	1.506	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CN2CCC[C@H](NC(=O)CCCc3ccccc3)C2)c1	796080838	XYJTVVQAAYREIK-QFIPXVFZSA-N	447.539	1.923	50	20	IDGD	
Cc1nc2ccccc2c(C)c1CC(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	798694086	BJPIWRFZEILJRH-OAQYLSRUSA-N	449.463	1.925	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)c1cc([N+](=O)[O-])cc(I)c1C	801152608	AJDCKJVOJLTZCE-UHFFFAOYSA-N	429.174	1.614	50	20	IDGD	
COc1ccccc1[C@@]1(C)NC(=O)N(CC(=O)NNC(=O)Nc2ccc(Cl)cc2)C1=O	802017686	WOTAQDCCMJNXIT-HXUWFJFHSA-N	445.863	1.969	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)c2ccc(CS(N)(=O)=O)cc2)cc1Cl	802072893	YMAYBOJAKALVAO-UHFFFAOYSA-N	442.881	1.612	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)CC[S@](=O)c2ccc3c(c2)OCCO3)cc1	802117835	FAGJDBZVAGSBBJ-PMERELPUSA-N	432.502	1.874	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(C(F)(F)F)nc1C	802565632	DBGSMPJGEOLLQV-UHFFFAOYSA-N	426.351	1.582	50	20	IDGD	
O=C(NNc1ccc2c(=O)[nH]ccc2c1)c1ccc(S(=O)(=O)N2CCOCC2)cc1	803437495	NNALZXQYXHJMTE-UHFFFAOYSA-N	428.470	1.306	50	20	IDGD	
O=C1COC[C@@H](C[C@H]2CN(C(=O)C(=O)NNc3cccc([N+](=O)[O-])c3)c3ccccc32)N1	806968180	ALVLPTFVYXTNAT-DZGCQCFKSA-N	439.428	1.073	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2c(C)c(C(F)(F)F)nn2C)c1	806973398	ONWVHRISCXNRFN-UHFFFAOYSA-N	427.383	1.529	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCCCC2)cc1NC(=O)C(=O)NNc1ncccc1F	807302118	XFBXSNLRAJBFSO-UHFFFAOYSA-N	435.481	1.786	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)C[C@@H](CC(C)(C)C)C(=O)NNC(=O)c1cccn1C	808038231	PODFNWPBBKNMDN-AWEZNQCLSA-N	430.509	1.028	50	20	IDGD	
Cc1ccc(S(=O)(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1C(=O)OC(C)C	808068900	LJGCWBWHAJBXOE-SFHVURJKSA-N	434.470	1.710	50	20	IDGD	
CCSc1cccc(Br)c1NC(=O)NNC(=O)[C@H](C)NS(C)(=O)=O	810307052	VSOAIVJNCXUEFP-QMMMGPOBSA-N	439.357	1.652	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)[C@@H]1CCN(c2ccccc2F)C1	810462460	RJYBLPCWUYKBSY-MRXNPFEDSA-N	448.520	1.816	50	20	IDGD	
Cc1cccc(Br)c1C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	811272734	UPDATDQNFCYVBU-HNNXBMFYSA-N	449.257	1.902	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)CNS(=O)(=O)c1ccc(C#N)cc1	811462020	JZFAXKZFPLRNMA-GFCCVEGCSA-N	436.877	1.105	50	20	IDGD	
CCCn1c(C)cc(/C=C(\C#N)C(=O)OCc2c(N(C)C)n(C)c(=O)n(C)c2=O)c1C	814063911	QMSXKKGRHVABOM-GZTJUZNOSA-N	427.505	1.629	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C2(S(C)(=O)=O)CCOCC2)ccc1OCCC(C)C	814103865	XCFOZEKZAIDCTQ-UHFFFAOYSA-N	442.534	1.475	50	20	IDGD	
O=C(CCc1cncnc1)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	814266360	FYLILAPNHSUBGF-UHFFFAOYSA-N	428.456	1.572	50	20	IDGD	
CNc1nccc(C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)c1[N+](=O)[O-]	816805897	LRGIYFOPVYYQSZ-UHFFFAOYSA-N	425.405	1.397	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)[C@]2(c3ccccc3)CCC(=O)NC2)c2ccccc2c1=O	816806124	SFNCROGWMUFSCK-XMMPIXPASA-N	447.495	1.586	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)CN2C(=O)N[C@@](C)(c3ccc(F)cc3)C2=O)c1	818484573	UDVHYCADSKFDLE-NRFANRHFSA-N	428.420	1.128	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCCC2)cc1	825624998	VCAFLHHUKSGGAW-UHFFFAOYSA-N	446.529	1.743	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)Cc1ccccc1O[C@@H]1CCOC1	857431686	PUHJLIIOPKUCLA-MRXNPFEDSA-N	446.529	1.460	50	20	IDGD	
O=C(Nc1nc(CC(=O)N2CC[C@H](B(O)O)C2)cs1)c1ccc(Br)o1	864231546	PCQTYHCHFCSZOQ-QMMMGPOBSA-N	428.073	1.369	50	20	IDGD	
CCOc1ccc(NC(=S)NNC(=O)CNS(=O)(=O)c2ccc(C)c(C)c2)cc1	913444444	VJHQDCYFZYTTSD-UHFFFAOYSA-N	436.559	1.998	50	20	IDGD	
O=C(COC(=O)Cn1ncc2ccc([N+](=O)[O-])cc21)NNC(=O)c1cccc(Cl)c1	915522274	ULIBQYBQHCUPKN-UHFFFAOYSA-N	431.792	1.602	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCC(C)(C)N2CCCCC2)cc1	915899664	QNWFKGSXJWAAOI-UHFFFAOYSA-N	439.582	1.210	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)C1CCN(CC(F)(F)F)CC1	916099337	HLHHCZHSECETQZ-UHFFFAOYSA-N	441.498	1.620	50	20	IDGD	
Cn1ccnc1[C@H](NC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)c1ccc(F)cc1	916220751	ZGDKUTNKXVAJKY-QGZVFWFLSA-N	445.476	1.696	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)NCC2(NS(C)(=O)=O)CCCCC2)c1C	916253836	OKJQLLNDFGJNMW-INIZCTEOSA-N	440.566	1.653	50	20	IDGD	
NC(=O)c1cc(NC(=O)NNC(=O)COc2ccc(Br)cc2)ccc1F	916376280	GWEDBLFBQDBYLL-UHFFFAOYSA-N	425.214	1.919	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)NCC[C@](O)(c2nccn2C)C(F)(F)F)c1	916378563	OMJAVUAUEPTKGN-KRWDZBQOSA-N	445.398	1.222	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(CNC(=O)/C(C#N)=C\c2cc(C#N)n(C)c2C)cc1	918604864	VPJTYQHQPSEJCS-ZDLGFXPLSA-N	441.513	1.353	50	20	IDGD	
C[C@@H](Nc1ccc(C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)cc1[N+](=O)[O-])c1ccccn1	919693764	BXCKMXRMMYZKRN-OCCSQVGLSA-N	447.473	1.359	50	20	IDGD	
CS(=O)(=O)N1CCC[C@@H](NC(=O)NNC(=O)c2cc3c(s2)CCCCCC3)C1	920240469	UQCOJYOIYQLUMY-CQSZACIVSA-N	428.580	1.775	50	20	IDGD	
O=C(CNC(=O)c1ccc(Br)cc1)NNC(=O)NCCc1cccs1	920888911	CJOPMFAYQABGNG-UHFFFAOYSA-N	425.308	1.814	50	20	IDGD	
CN1CCN(Cc2cccc(CNC(=O)NNC(=O)c3cnn(-c4ccccc4)c3)c2)CC1	1251830576	KSPAJLRWNXQYCP-UHFFFAOYSA-N	447.543	1.764	50	20	IDGD	
COC(=O)CCOc1ccc(S(=O)(=O)NNC(=O)c2cncn2-c2ccccc2)cc1	1317952638	ANXCMBOELGMAST-UHFFFAOYSA-N	444.469	1.438	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2ccc(Cn3cccc3)cc2)cc1	1318286859	QNSBTOJTDYJOCV-UHFFFAOYSA-N	440.525	1.927	50	20	IDGD	
C=C[C@@H](COC)NC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	1325634144	FPHZXNBHRHAOQP-KRWDZBQOSA-N	432.502	1.310	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnc(O)nc2O)C1	1778005319	VRKVIONEWYSVCX-BFUOFWGJSA-N	426.901	1.280	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(C)(C(=O)N2CC[C@@]3(CN(C(=O)[C@H](F)Cl)CCO3)C2)C1	1778315154	WBVCWGCBXQZYHH-ORAYPTAESA-N	433.908	1.608	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@]2(CN(C(=O)/C=C3\C(=O)Nc4ccccc43)CCO2)C1	1779296836	HMAUPPLYABOVGC-SJAXDAAESA-N	443.576	1.704	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc3cccnn3n2)C1	1779992155	RHQGNCPJSKVPSF-WIYYLYMNSA-N	445.596	1.708	50	20	IDGD	
CC(C)(C)n1cc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)nn1	1780354614	UMMYBQXMTZCAOG-MLGOLLRUSA-N	432.294	1.167	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3nn[nH]c3C(F)(F)F)C2)C1	1780365871	SQISZOVVWKHYPV-ISVAXAHUSA-N	440.220	1.050	50	20	IDGD	
CC(C)(C)OC(=O)C(C)(C)CC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1780886694	RNUUROMQRAGFQM-VLIAUNLRSA-N	432.945	1.174	50	20	IDGD	
Cc1ccc(C(=O)C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)cc1	1781334122	MJEXIYARAXVPET-CRAIPNDOSA-N	427.270	1.698	50	20	IDGD	
C[C@@H](Oc1ccccc1)C(=O)N1CC[C@]2(CN(C(=O)[C@H](F)Br)CCO2)C1	1781378587	KATLOJPJSPDBCY-QIIPPGSGSA-N	429.286	1.974	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)COC(=O)C(F)(F)F)C2)C(Cl)Cl	1782218051	NVSKOOXINCRXIF-YMTOWFKASA-N	435.226	1.410	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](O)c1ccccc1)CCO2	1783343921	XAOARCIYVPGEQF-FCEWJHQRSA-N	425.323	1.723	50	20	IDGD	
CC(=O)Nc1ccccc1C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](C)Br)C2)C1	1783535967	CEOZXDXUBIMCBU-BFUOFWGJSA-N	438.322	1.872	50	20	IDGD	
C[C@@H](NNc1ccccc1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CO[Si](C)(C)C)C[C@@H]21	1783553032	AOJSQTASPPHPTN-UMGGQSCQSA-N	448.640	1.823	50	20	IDGD	
Cc1cnc2c(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)C(C)(C)CCl)[C@H]4C3)cnn2c1	1783850482	XROYQZMKYDOIIO-XIRDDKMYSA-N	433.940	1.896	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)Cc3cc4ccccc4n3C)CCO2)C1	1783867845	BWILDVKOJATSCU-PGRDOPGGSA-N	433.936	1.805	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)C1(c3ccc(F)cc3)CC1)CCO2	1783933326	HOALRNUVANQAEP-JOCHJYFZSA-N	446.523	1.060	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4cccn4cn3)C[C@@H]21	1783966558	GWWBOBKPNFSRKK-DNUAJFIVSA-N	449.349	1.959	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H]1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Cl)C[C@@H]21	1784819575	KRBZAOSNWYWHQN-YYFQZIEXSA-N	433.908	1.510	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc4c3cnn4C)[C@H]2C1	1788067524	KGFMMWPDZDNJEQ-KUZCPNRJSA-N	434.924	1.420	50	20	IDGD	
Cc1ncc(C(=O)NC2(c3ccc(NC(=O)c4ccc(B(O)O)cc4)cc3)CCC2)cn1	1788140449	YHBLKWHAAUGCON-UHFFFAOYSA-N	430.273	1.526	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)Nc3cnccn3)[C@H]2C1	1788630312	LRCHGRBTHWUALS-MRLBHPIUSA-N	440.342	1.040	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1ccc(C2(NC(=O)c3cncnc3)CCC2)cc1	1789521328	WVJUCOXZCAGHQQ-UHFFFAOYSA-N	431.456	1.537	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3c4c(nn3C)CCC4)[C@H]2C1	1790462217	KNGXWMYCXIQQQI-DSPQJCBJSA-N	439.354	1.286	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cc(C)n(C)n3)C[C@@H]21	1790957953	GDXYOUVVRHIKPU-HJWJTTGWSA-N	441.370	1.424	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(-c4ccccn4)[nH]n3)C[C@@H]21)C(Cl)Cl	1791298283	MQVLTAPUVMFHCR-MKBNYLNASA-N	438.315	1.869	50	20	IDGD	
Cc1cc(C)n(CCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)Br)C[C@@H]32)n1	1791511251	JMFMJFMFPNCWNC-QZWWFDLISA-N	441.370	1.653	50	20	IDGD	
CCN1CCC(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)CBr)CC1	1792872865	BNEOQCHERSEWLP-MXASKKJJSA-N	430.387	1.339	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1[C@@H]3CCC[C@H]1c1ccccc1N3)C2)[C@@H](O)CCl	1792976318	CCVIDQFGBAZKHV-OAXNIYSNSA-N	447.963	1.554	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@]1(C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2	1793646680	ITVKDPYGDIEUIK-MTCCJSQRSA-N	447.935	1.900	50	20	IDGD	
COc1ncc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@](C)(Cl)CCl)C3)cc1F	1794364900	VTIOPTPXAIKAKJ-JPVZDGGYSA-N	434.295	1.669	50	20	IDGD	
CN(C)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2	1794472022	ASAZNYFEISNPGM-JLUCKKNBSA-N	429.290	1.041	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccno1	1794740344	BMUZVDRAJDSQFA-IVWMJMPLSA-N	444.400	1.025	50	20	IDGD	
CN(CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccco1)NC(=O)NCc1ccccc1	1794961738	OBLARRPVCDUZMN-REPLKXPHSA-N	439.516	1.878	50	20	IDGD	
N=C(N)NCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCCCCCCCCCCl)C2	1795539412	VRFTVUUMCXTKLF-XEMDLRDOSA-N	444.020	1.809	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)[C@@H]1[C@@H]2Sc3ccccc3[C@H]21	1796188893	YMTNEJYEUKCYPT-WXBORZKFSA-N	448.353	1.506	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1CCCO1	1796337600	PDPMOLMDVIAXSE-XFIYOXNOSA-N	429.945	1.936	50	20	IDGD	
CC(=O)Nc1ccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CO[Si](C)(C)C)cc1	1797956930	OWVQSCNHYXDYDY-OPMZPASUSA-N	447.608	1.629	50	20	IDGD	
Cc1cnc(Cl)c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)c1	1798439175	LPWWTGCAIPTLKA-BTTYYORXSA-N	442.907	1.608	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(-c2ccccc2)no1	1798816592	SHDBIVPKWWUOEH-BCDXTJNWSA-N	439.516	1.966	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1nc2ccccc2o1	1799908974	QBOWOYFNHVJXIS-DJBIQUGXSA-N	426.242	1.722	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cn2c(F)cccc2n1	1800001614	SBZICIWVHNUNAM-LSSIXWDNSA-N	439.285	1.460	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)n1cc(C)cn1)C2	1800644324	PNKJZFQYNFDGSR-QMHWVQJVSA-N	427.343	1.516	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Nc1cccnc1)C2	1800756957	RYSRMVNEUCYNJE-QKDZRIPBSA-N	425.327	1.255	50	20	IDGD	
COC(=O)CCCCCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)Br	1800762952	LIGNFZMNZSPJSD-ZJOBFFGXSA-N	433.343	1.483	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3cnccc3nc1C)C2	1800977335	XAXVQPUOIOMMQG-LORHWOILSA-N	432.908	1.395	50	20	IDGD	
C[C@@H](NNc1ccccc1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCC(=O)NN(C)C	1802328755	DJQBAGFEKXHXNS-OQIJWPOYSA-N	430.553	1.003	50	20	IDGD	
COc1ccc(CC(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)cc1O	1802817638	HFOGVRYDRKEHJF-YRISNDGFSA-N	447.919	1.644	50	20	IDGD	
CC(C)(CCl)C(=O)NC[C@@H]1CCN(C(=O)[C@H](O)N2CCOCC2)[C@H]1c1cccnc1	1802901518	SVOZJNYRQCCKJE-BZSNNMDCSA-N	438.956	1.003	50	20	IDGD	
COc1cc(F)ccc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(B(O)O)cc1)C2	1803472680	PTCSFGBIQPOYPQ-BCDXTJNWSA-N	426.253	1.080	50	20	IDGD	
Cc1nc(CC(=O)NC[C@@H]2CCN(C(=O)[C@@H](F)Br)[C@H]2c2cccnc2)no1	1804493227	OJARGBRJSCGQCX-VBNZEHGJSA-N	440.273	1.712	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2cccnc2C(N)=O)[C@@H]1c1cccnc1	1804812281	SBXFGTOZDSOZLC-ZVZYQTTQSA-N	429.908	1.913	50	20	IDGD	
O=C(/C=C\C(=O)N1CC[C@H](CNC(=O)CCBr)[C@@H]1c1cccnc1)NC1CC1	1806344480	ZVASNPGSJNSWHD-VUTNTTQYSA-N	449.349	1.707	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1807366916	VXEJFXIYJTXDHB-PKOBYXMFSA-N	443.740	1.346	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)[C@H]2CC=CCC2)[C@H]1c1cccnc1	1808147781	LQRQSEMEHOUECY-LRXVAGHRSA-N	427.549	1.817	50	20	IDGD	
N[C@@H](Cc1cscn1)C(=O)NC[C@@H]1CCN(C(=O)C(Cl)Cl)[C@@H]1c1cccnc1	1808209895	DXSWMDNNDPMQFV-AEGPPILISA-N	442.372	1.918	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1CCN(C(=O)c2c[nH]c(=O)cn2)[C@@H]1c1cccnc1	1808304578	INSWGCNTFGQLIN-CRFBAAHOSA-N	438.315	1.721	50	20	IDGD	
COc1cscc1C(=O)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1	1809977914	LJXPMULUBSGJEK-UHFFFAOYSA-N	442.346	1.595	50	20	IDGD	
N#Cc1ccc(C(=O)N2CCC3(CCCN(C(=O)c4cccc(B(O)O)c4)C3)CC2)cc1	1809978166	ZKFQFSUNICPQHN-UHFFFAOYSA-N	431.301	1.397	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)C2(F)CCC2)[C@H]1c1cccnc1	1810308767	NSRDXBNQMFUDCC-YJBOKZPZSA-N	440.479	1.292	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@H]1CCN(C(=O)CCn2ccnn2)[C@H]1c1cccnc1	1810549220	YOUVUNDIUMBZHO-XLIONFOSSA-N	430.585	1.621	50	20	IDGD	
Cc1ccn(C)c1C(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1811609940	BSPPXAWDMOKECD-XMSQKQJNSA-N	440.548	1.421	50	20	IDGD	
CN1CCCn2nc(C(=O)NC[C@@H]3CCN(C(=O)[C@@H](F)Cl)[C@@H]3c3cccnc3)cc2C1	1812286544	ZLDQDZDYCWXBKV-KFKAGJAMSA-N	448.930	1.968	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H](CNC(=O)[C@@H]2CNC(=O)C2)[C@@H]1c1cccnc1	1812635455	IVAMSUKIIWYFFF-UTXMOHQDSA-N	437.338	1.255	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)COc2cccnn2)[C@H]1c1cccnc1	1812868243	VTGBLSJKUXHNSL-JOQOYGCGSA-N	448.321	1.740	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)/C=C/c2ccco2)[C@@H]1c1cccnc1	1813070680	KTSPDBMNSWYMDO-VUHGIWPJSA-N	439.516	1.767	50	20	IDGD	
CNc1ccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)cc1	1817471478	OXQNJIMOPPRFGR-HXUWFJFHSA-N	447.304	1.751	50	20	IDGD	
Cn1ncc2cc(C(=O)Nc3nc4c(s3)C[C@H](NC(=O)[C@H](O)CCl)CC4)ccc21	1818544025	RVVRBUXJDNMUCL-IUODEOHRSA-N	433.921	1.855	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2nc[nH]c2[N+](=O)[O-])[nH]n1	1822367833	BIKIWNPWKFDOFY-GXSJLCMTSA-N	425.833	1.601	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCCn2ccnc2)[nH]n1	1822416661	KGHQDCCGEUGPJQ-KRWDZBQOSA-N	444.540	1.452	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H]2CCNC(=O)C2)n[nH]1	1822483547	DKFNENWSDLRMHL-GVXVVHGQSA-N	426.315	1.711	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCn1ccnn1)CC2	1822868913	CDSGWUZGHZRARU-MGPLVRAMSA-N	431.349	1.973	50	20	IDGD	
O=C(CN1CCOCC1)N[C@@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1	1823002247	BZFYGLMEDILFFK-NOZJJQNGSA-N	435.319	1.078	50	20	IDGD	
N=C(N)SCCC(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1	1823002565	DQEZHMQYYISXAS-QUBYGPBYSA-N	438.348	1.762	50	20	IDGD	
O=C(c1nn[nH]c1C(F)(F)F)N1CCC([C@H]2CCCCN2C(=O)[C@@H](O)CCl)CC1	1824185459	JMWHVHIALGRUKZ-NEPJUHHUSA-N	437.850	1.657	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](C)n3ccnn3)sc2C1	1824680514	ZNCIGPYSHSHODB-GMTAPVOTSA-N	441.355	1.939	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1nccnc1OC)CC2	1825994149	QQPFUPZNOKFAMF-VHSXEESVSA-N	425.898	1.421	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc3nncn3c1)CC2	1826000320	RXHOFDNBLCDWOZ-NWDGAFQWSA-N	434.909	1.665	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1	1826089695	LTPHGWWTAACDMD-ZJUUUORDSA-N	446.371	1.212	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)c2cncs2)CC1	1826132685	YZFFFOJWANCZIH-GOSISDBHSA-N	427.335	1.370	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnoc2)CC1	1828926454	IBRIWZYCWKKUBG-SFHVURJKSA-N	426.477	1.220	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CCCCO1)CCO2	1829908310	DTZMDBPYQYAFHR-IIDMSEBBSA-N	433.343	1.043	50	20	IDGD	
COc1cc(Cl)cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)c1	1830738045	KWOKETCNUGAOHR-LPHOPBHVSA-N	447.315	1.018	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)Oc3cccnc3)C2)C1	1831657852	BREYDIBDIBRJGR-PLMTUMEDSA-N	439.940	1.713	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cncc(F)c2)CC1	1831871995	JTKICJSAYJVRSC-IBGZPJMESA-N	433.528	1.827	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccncc2F)CC1	1831873203	MWOVAOZVKMJCAN-IBGZPJMESA-N	433.528	1.827	50	20	IDGD	
O=C([C@@H](F)Cl)N1CCOC[C@]2(C1)CN(C(=O)C1(c3cccc(F)c3)CC1)CCO2	1832364538	FPPYTJQJUFLWQR-APWZRJJASA-N	428.863	1.848	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)/C=C/c3ccco3)CCO2)C1	1833078553	ZVYFDZOGVBTEFC-BYQXYHSISA-N	427.295	1.533	50	20	IDGD	
C[C@H](Cn1cccn1)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1833191612	OZSVUKUVNKQNRP-UZLBHIALSA-N	426.945	1.241	50	20	IDGD	
CCc1[nH]nc(C(=O)N2CCC(N3CCC(NC(=O)[C@H](O)CCl)CC3)CC2)c1Cl	1833310770	RPQADTBKSSXGSS-OAHLLOKOSA-N	446.379	1.410	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)C(F)(F)c3ccco3)CC2)CC1)[C@H](O)CCl	1833312559	XIWZPRUPZIGJIO-OAHLLOKOSA-N	433.883	1.543	50	20	IDGD	
CC(C)NCCC(=O)NC1CCN(C2CCN(C(=O)[C@H](C)Br)CC2)CC1	1834782749	ANUVFBOLRNMSJO-HNNXBMFYSA-N	431.419	1.730	50	20	IDGD	
O=C(/C=C/c1ccccc1)N1CCO[C@@]2(COCCN(C(=O)CCBr)C2)C1	1835105800	ZDRNNLFLRIHJEX-ROUKRRSUSA-N	437.334	1.941	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1835305249	NHDNBKQVLVJAAZ-SFHVURJKSA-N	447.967	1.428	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc(Cl)nc3)C2)C1	1837708782	PAQOTYMWEUNZMD-GOSISDBHSA-N	442.976	1.052	50	20	IDGD	
C[C@@H](Cc1ccco1)C(=O)N1CCOC[C@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1837717698	MCSSHXGWHWMSCT-UWJYYQICSA-N	438.597	1.766	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](C)CBr)C3)C2)ccn1	1837934810	NLGSGPRPGLGYJD-KUHUBIRLSA-N	440.338	1.491	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(C)nc3OC)CCO2)C1	1838172303	NVQJFHUSKAMPKM-UWJYYQICSA-N	439.940	1.876	50	20	IDGD	
O=C(c1cc(Cl)cc2nn[nH]c12)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1838618624	CWBHFCOZXOGQBE-PBHICJAKSA-N	446.266	1.216	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccnc4ncccc34)C2)C1	1839147907	GQEMQKWKOBJEAR-UWJYYQICSA-N	432.908	1.717	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc4c3NC(=O)C4)C2)C1	1839148195	QGEXSRALYIQYQI-KKSFZXQISA-N	435.908	1.269	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(C#N)cc3)C2)C1	1839154214	GYMXJQXFTHGEMS-PMACEKPBSA-N	440.327	1.865	50	20	IDGD	
Cc1ccc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)cn1	1839197532	AHNVGLWNUNZJNI-AEFFLSMTSA-N	444.301	1.079	50	20	IDGD	
C[C@]1(C(=O)N2CCOC[C@@]3(CN(C(=O)[C@@H](F)Br)CCO3)C2)CC1(F)F	1839203489	MNXRNVQWOFRXIS-LERXQTSPSA-N	429.233	1.179	50	20	IDGD	
O=C(c1cn2c(F)cccc2n1)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1839556187	JIYKSKNVGPCOKR-SFHVURJKSA-N	445.278	1.347	50	20	IDGD	
O=C(Cc1ccccc1O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1839908901	GAJWAOCLRGULPC-FUHWJXTLSA-N	445.285	1.082	50	20	IDGD	
Cc1cc(/C=C/C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)no1	1840033608	LDJWCQSUGLSFEF-MDEMMKGOSA-N	442.310	1.236	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4cc[nH]c4c3)C2)C1	1840152380	GWQDOZUVQLJYOF-LAUBAEHRSA-N	435.908	1.492	50	20	IDGD	
O=C(c1cccc2c[nH]nc12)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840187591	LPFHASPHZCHZPW-GOSISDBHSA-N	427.288	1.437	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)nn1C(F)F	1840188960	OBWRINHCPVUVRG-MRXNPFEDSA-N	441.262	1.460	50	20	IDGD	
COc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)c(OC)c1	1840189070	ULMLTMKOYXJKOL-LJQANCHMSA-N	447.315	1.578	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC2(CCCN2C(=O)c2ccc(N3CCOCC3)cn2)C1	1842266261	OLTRPEUNRCIVQU-IBGZPJMESA-N	441.359	1.972	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)c2nn(-c3ccccc3)c3c2COC3)C1	1843228751	WDRBBWUBPDZTBO-QGZVFWFLSA-N	444.919	1.973	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC2(CCCN2C(=O)[C@@H](C)[C@@H]2SC(=N)NC2=O)C1	1843402828	QIGBZELVJPCKEO-VWYCJHECSA-N	431.356	1.023	50	20	IDGD	
Cc1ccc2cc(C(=O)N3CCCC34CN(C(=O)c3cnccc3C(=O)NN)C4)ccc2n1	1843751963	OAHPHKOPZWRJDW-UHFFFAOYSA-N	444.495	1.673	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)COc2cccc(N3CCCC3=O)c2)cc1	10604445	AKFJQUWLRRBVRV-UHFFFAOYSA-N	425.441	1.505	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)CN1C(=O)N[C@@](C)(C2CC2)C1=O	12689193	BYHLJRYJODPPBJ-FQEVSTJZSA-N	427.486	1.600	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccco2)[nH]n1)c1cccc(S(=O)(=O)N2CCCC2)c1	23055822	RKPZVMQZEWPQNQ-UHFFFAOYSA-N	429.458	1.529	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)CNC(=O)CC2CCCC2)c1	116569515	RKLAWULZSQRGTG-UHFFFAOYSA-N	438.550	1.175	50	20	IDGD	
CCOC(=O)c1ccc(N2CCCN(CC(=O)NNC(=O)c3cccs3)CC2)nc1	725799506	VNNIGZWYTWLYMU-UHFFFAOYSA-N	431.518	1.293	50	20	IDGD	
Cc1noc(CCNC(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)n1	726270859	GYPVBSRHNXLHQB-UHFFFAOYSA-N	447.455	1.323	50	20	IDGD	
C[C@@H]1CN(c2ccc(C(=O)NNc3ccc(S(=O)(=O)NC4CC4)cc3)cn2)C[C@@H](C)O1	726867552	NCQJMYQRHXLHFW-HUUCEWRRSA-N	445.545	1.893	50	20	IDGD	
O=C1CC(=O)Nc2cc(S(=O)(=O)NNC(=O)c3c(Cl)cccc3Cl)ccc2N1	727796409	NXFABEZATVZRHG-UHFFFAOYSA-N	443.268	1.897	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)[C@@H]2CCCC[C@@H]2C(=O)N2CCCC2)c2ccccc2c1=O	728151229	XMGIUTQGEADNGQ-WBVHZDCISA-N	425.489	1.123	50	20	IDGD	
C[C@@H](NC(=O)c1n[nH]c2ccccc12)C(=O)OCC(=O)NNC(=O)c1cccc(Cl)c1	728367131	XPOPSOWQGVCKSM-LLVKDONJSA-N	443.847	1.339	50	20	IDGD	
CC(C)[C@@H](C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)S(=O)(=O)C1CCCCC1	728513227	UMPZVMZBQNGIFT-KRWDZBQOSA-N	434.522	1.195	50	20	IDGD	
O=C(CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@@H]12)NNC(=O)c1cccc(OC(F)F)c1	728543921	NYIRNHWCTGYUFX-KCQAQPDRSA-N	428.461	1.775	50	20	IDGD	
CCOC(=O)C1CCN(C(=O)CN(C)C(=O)NNC(=O)c2ccc3ccccc3c2)CC1	728947196	PYIZSAJDLYZPRF-UHFFFAOYSA-N	440.500	1.928	50	20	IDGD	
O=C(NNC(=O)N1CCN(c2cccc(Cl)c2)CC1)C1CCN(c2ncccn2)CC1	728960103	UKYSXWWBYPMLKX-UHFFFAOYSA-N	443.939	1.909	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2ccc(CSc3nncn3C)cc2)c(N)c([N+](=O)[O-])c1	729517681	YCCIIQRRCOMYJQ-UHFFFAOYSA-N	441.473	1.981	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(S(=O)(=O)NC2CC2)cc1)c1cccc2ncccc12	730203984	NIYYLRIOZQEJNU-UHFFFAOYSA-N	446.510	1.299	50	20	IDGD	
CC1(C)CC(=O)c2cc(C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)c(O)nc2C1	730285035	FRMUDENDNVGQTH-UHFFFAOYSA-N	438.488	1.410	50	20	IDGD	
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC[C@@H](C(=O)NNC(=O)C(C)(C)c2ccccc2)C1	731200957	CRGXQTJRVWUXPH-MRXNPFEDSA-N	447.561	1.552	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)N(C)CCCOc1ccc(S(C)(=O)=O)cc1	731501003	WZTFOFKLDLJVHO-UHFFFAOYSA-N	435.502	1.854	50	20	IDGD	
O=C(CCN1CCN(C(=O)[C@H]2CCCO2)CC1)NNC(=O)c1c(Cl)cccc1Cl	731986963	GPJRYNIXWQVXPY-OAHLLOKOSA-N	443.331	1.468	50	20	IDGD	
O=C(NNc1nc(-c2ccc(Cl)cc2)no1)[C@H]1CC(=O)N(CCN2CCOCC2)C1	732975167	CEGACSRGSNWJFB-AWEZNQCLSA-N	434.884	1.014	50	20	IDGD	
CCOCCCn1c(NNC(=O)[C@@H]2CCCN(C(=O)C3CC3)C2)nc2ccccc2c1=O	733268047	HYQSDOYXINZWLE-QGZVFWFLSA-N	441.532	1.915	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc2c(c1)OCCCO2)NNc1cc(F)c(F)cc1F	734554758	HNEYJEDYRYAFNM-UHFFFAOYSA-N	431.392	1.687	50	20	IDGD	
COc1ccc(CN2CC[C@@H](NC(=O)NNC(=O)COc3cc(C)ccc3C)C2=O)cc1	734684218	MKCCVQMASZMBRO-LJQANCHMSA-N	440.500	1.822	50	20	IDGD	
CN(C)N(C(=O)c1nn(-c2ccc(F)cc2)cc1Br)[C@@H]1CCS(=O)(=O)C1	735424997	WZCHBHXHFYRASA-CYBMUJFWSA-N	445.314	1.880	50	20	IDGD	
C[C@@H]1Cc2ccccc2N1S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cnn(C)c2)c1	735445222	PDCTVTIQOFOVCO-CQSZACIVSA-N	439.497	1.635	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)CCc2nc(-c3ccoc3)no2)CC1	739733198	LDQRZUOAPGCKTP-UHFFFAOYSA-N	448.480	1.992	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Cc2ccc(S(=O)(=O)C(F)F)cc2)cc1OC	740634326	KOCXZHQADZLHLG-UHFFFAOYSA-N	428.413	1.704	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN(C(=O)COc2ccccc2)C1)c1cnn(-c2ccccc2)c1	741188885	OOCWGDWSOFYLFT-SFHVURJKSA-N	447.495	1.951	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2cccc(S(=O)(=O)Nc3ccccc3Cl)c2)nnn1C	741659774	PITIZLXCUBLDNL-UHFFFAOYSA-N	448.892	1.653	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)c1cc(N2CCOC2=O)ccc1F	741693519	PTADHGPSCFRBGT-UHFFFAOYSA-N	425.417	1.251	50	20	IDGD	
CN(C)C(=O)CS(=O)(=O)c1ccc(C(=O)NN=c2sc3ccccc3n2C)cc1	741879244	AJZVQTRXAJJBCO-UHFFFAOYSA-N	432.527	1.347	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2c[nH]c3ccccc23)cc(NS(C)(=O)=O)c1OC	742487275	NTAUAMOGJIPYNF-UHFFFAOYSA-N	432.458	1.631	50	20	IDGD	
CC(C)[C@H](NC1CCOCC1)C(=O)NNc1ccccc1S(=O)(=O)NC(C)(C)C	743417113	YANRTECPORIATN-SFHVURJKSA-N	426.583	2.000	50	20	IDGD	
CCN(C[C@H]1CCN(Cc2ccccc2)C1)C(=O)NNC(=O)CNC(=O)c1ccco1	743576684	IWKDGFDTXHBNFJ-SFHVURJKSA-N	427.505	1.594	50	20	IDGD	
O=C(COC(=O)[C@H]1SCCc2ccccc21)NNC(=O)[C@@H]1COc2ccccc2O1	745472207	GYWRVHSZAMXCDU-HKUYNNGSSA-N	428.466	1.548	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@@H]2C[C@@H](C)N(c3ccccc3)C2=O)c2ccccc2c1=O	745880809	BLQOHXOCUGHDAE-RDTXWAMCSA-N	448.483	1.554	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H]2CCCN(C(=O)NC3CCCC3)C2)c1	746123961	VFRSTPDXLIANJV-HNNXBMFYSA-N	436.534	1.215	50	20	IDGD	
Cc1cc(=O)n(CC(=O)NC(C)C)c(C)c1C(=O)NNc1nc(-c2ccncc2)no1	746200710	AKEFYCSYPHODPX-UHFFFAOYSA-N	425.449	1.192	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNc1ccc(S(=O)(=O)Nc2nccs2)cc1	747945411	YUVQIZNRKCHOJD-UHFFFAOYSA-N	427.508	1.912	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2nn(-c3ccc(F)cc3)cc2O)c1	748010455	OSFYHFRCRKPPHB-UHFFFAOYSA-N	447.448	1.042	50	20	IDGD	
CC(C)[C@@H](C(=O)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1)N1CCCS1(=O)=O	748520472	QULUCTYXYBRFGU-ZDUSSCGKSA-N	443.469	1.483	50	20	IDGD	
Cc1nn(-c2ccccc2)c2sc(C(=O)NNC(=O)N[C@H]3CCCN(C)C3=O)cc12	748662618	AQNMYYJEFBGNQG-HNNXBMFYSA-N	426.502	1.960	50	20	IDGD	
COC(=O)c1cc(OC)c(S(=O)(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)s1	748791736	ZIEJASDWOGLBDN-UHFFFAOYSA-N	441.487	1.108	50	20	IDGD	
Cc1ccsc1CCCC(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	749243637	YQZMCIPHIZFCHH-UHFFFAOYSA-N	437.591	1.854	50	20	IDGD	
CCC(=O)NCc1cc(S(=O)(=O)NNC(=O)c2ccc(Cl)cc2O)ccc1OC	751540955	OOHMJOHMXZZIRP-UHFFFAOYSA-N	441.893	1.704	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)NCC2(CN3CCOCC3)CCCCC2)cc1	751817526	IYLSZGCUFRUJKW-UHFFFAOYSA-N	429.521	1.550	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)NCc2[nH]cnc2C)cc1	754346933	VWVGMNKSUOUTOB-CXUHLZMHSA-N	433.472	1.689	50	20	IDGD	
O=C(Cc1cc[nH]n1)NNC(=O)c1cc(I)ccc1Br	755282349	PFWGWUOAIDLWLO-UHFFFAOYSA-N	449.046	1.781	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2cc(C)nn2[C@@H]2CCS(=O)(=O)C2)cc1OC	755530935	IDYFJITUJRELEV-CYBMUJFWSA-N	437.478	1.035	50	20	IDGD	
CON(C)S(=O)(=O)c1ccc(NC(=O)NNC(=O)COc2ccc(F)cc2)cc1	755531307	DCMHLHCMPZPMSN-UHFFFAOYSA-N	426.426	1.239	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)c2cccc(N(C)C)c2)ccc1S(=O)(=O)N(C)C	757777778	YPIRNZXHLVIEAI-UHFFFAOYSA-N	435.506	1.478	50	20	IDGD	
Cc1nn([C@H]2CCS(=O)(=O)C2)c(C)c1NC(=O)NNC(=O)COc1ccc(F)cc1	757871948	RLYXXJZKNPCONW-AWEZNQCLSA-N	439.469	1.230	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(F)(F)[C@@H](C(=O)NNC(=O)C(=O)Nc2ccccn2)C1	757986978	QAYCVYKPCCYNBN-LLVKDONJSA-N	427.408	1.060	50	20	IDGD	
C[C@H](CC(=O)N1CCN(S(=O)(=O)CBr)CC1)NC(=O)C1CCCCC1	758527422	KGABQIPAKZUNGL-CYBMUJFWSA-N	438.388	1.288	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cn(Cc3cccc(F)c3)nn2)cc(OC)c1OC	759109919	ZAHPXFUVCCSZII-UHFFFAOYSA-N	429.408	1.566	50	20	IDGD	
CCCS(=O)(=O)N1CCCC[C@@H]1C(=O)NNC(=O)CSc1ccccc1OC	762372665	CJDSOOQRDREPIT-CQSZACIVSA-N	429.564	1.529	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)c1cn(CCOc2ccc(C=O)cc2Cl)nn1	763377281	XYXUYXRAUVQPPX-UHFFFAOYSA-N	443.847	1.906	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)C(=O)Nc1cccc(C(=O)N2CCCCC2)c1	763550659	JDIJKJLWEVZDIY-UHFFFAOYSA-N	438.440	1.441	50	20	IDGD	
CCOC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(OC)c(OC)c2)cc1	763551530	YAPHXYFKWWJZFH-UHFFFAOYSA-N	430.417	1.672	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(OC(C)C)c(NC(=O)C(=O)NNC(=O)C2CC2)c1	763557467	GVOYQGCKORUVKC-UHFFFAOYSA-N	440.522	1.000	50	20	IDGD	
CCCS(=O)(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)COc2cccc(C)c2)c1	763631317	YAKFZVSKUPPYGL-UHFFFAOYSA-N	448.501	1.312	50	20	IDGD	
NC(=O)c1cccc(NC(=O)C(=O)NNC(=O)COc2ccccc2-c2ccccc2)n1	763641110	FEEFHTPGGUMSSK-UHFFFAOYSA-N	433.424	1.012	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(-n3cc(C)cn3)c(F)c2)cc1	763661527	NLQIAFOIBYBYBI-UHFFFAOYSA-N	441.419	1.493	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)cc1NC(C)=O	763683868	BSAQRWOTONKNCF-UHFFFAOYSA-N	434.836	1.472	50	20	IDGD	
CS(=O)(=O)N1CCc2c(NC(=O)C(=O)NNC(=O)c3cccc(Cl)c3)cccc21	763751104	WXXSQEJOPVNFKW-UHFFFAOYSA-N	436.877	1.062	50	20	IDGD	
Cc1cn2cc(NC(=O)C(=O)NNC(=O)c3nn(C(C)C)c(=O)c4ccccc34)ccc2n1	763791378	QKDQBRBQRRBENJ-UHFFFAOYSA-N	447.455	1.333	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)C(=O)N2CCc3cccc(C)c32)c2ccccc2c1=O	763801173	JXSKQVJTSKDFDK-UHFFFAOYSA-N	447.495	1.855	50	20	IDGD	
C=CCNC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)cc1	763839289	IYKXTRXQZUIEFP-UHFFFAOYSA-N	429.408	1.298	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(OC(C)C)nc2)cc1	763878578	RMHZERQCOKXAPP-AWEZNQCLSA-N	428.445	1.625	50	20	IDGD	
CC(C)CC(=O)NNC(=O)C(=O)Nc1ccc(S(=O)(=O)N2C[C@@H](C)C[C@H](C)C2)cc1	763883914	SHHLISDRYYGVJA-GJZGRUSLSA-N	438.550	1.485	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)ccc1Cl	764004178	TYZQQFXRBOKYTH-UHFFFAOYSA-N	433.804	1.298	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)Nc1cccnc1N1CCCCC1	764004678	LESQGELEMRKGHM-UHFFFAOYSA-N	449.309	1.573	50	20	IDGD	
CCS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)on2)cc1	764017133	RHOHJWOVRUCZHF-UHFFFAOYSA-N	442.453	1.535	50	20	IDGD	
COCC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)on2)cc1	764017228	VNILVCTYNATOKC-UHFFFAOYSA-N	437.412	1.326	50	20	IDGD	
CCS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)Cc2cccc3ccccc23)cc1	764035766	HQBFTVUGWSTQQQ-UHFFFAOYSA-N	439.493	1.962	50	20	IDGD	
COCCOc1cccc(NC(=O)C(=O)NNC(=O)c2cccc(Br)c2)c1	764062757	CORLNKXHTMWYRP-UHFFFAOYSA-N	436.262	1.874	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(NC(=O)C(=O)NNC(=O)CC(C)(C)C)ccc1Cl	764199994	WHOAHNAMASSXGV-UHFFFAOYSA-N	446.957	1.893	50	20	IDGD	
O=C(Cc1ccccn1)NNC(=O)C(=O)Nc1ccc(-n2nccc2C(F)(F)F)cc1	764264950	WDAIEEUVQKVZOM-UHFFFAOYSA-N	432.362	1.615	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(S(=O)(=O)N3CCC[C@@H](C)C3)cc2)o1	764371717	KEKFELCZUJAFCB-CYBMUJFWSA-N	448.501	1.408	50	20	IDGD	
CCN1CCN(c2ccc(Cl)cc2NC(=O)C(=O)NNC(=O)c2ncccc2C)CC1	764389779	YZKYPVPJVGKNGE-UHFFFAOYSA-N	444.923	1.585	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)c(Br)n1	764392914	ALGJAVLRJJBCGW-UHFFFAOYSA-N	439.291	1.736	50	20	IDGD	
Cc1cc(NNC(=O)Cc2ccc(CC(=O)NNc3cc(C)nc(C)n3)cc2)nc(C)n1	764460905	CDDDIFVQRWTWOC-UHFFFAOYSA-N	434.504	1.872	50	20	IDGD	
C[C@@H](CC(=O)NNC(=O)CSc1ccccc1O)/N=C1/NS(=O)(=O)c2ccccc21	765249261	QOYIFXKTYVMYQL-LBPRGKRZSA-N	448.526	1.149	50	20	IDGD	
N#Cc1ccc(CS(=O)(=O)CC(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)cc1	765569353	GMRCAMONHYIFIP-UHFFFAOYSA-N	429.483	1.386	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765738898	PUGJAYWNQTWLHG-MRXNPFEDSA-N	444.919	1.713	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)cc(OC)c1C	765748808	ISGIEMPKPMRZLQ-UHFFFAOYSA-N	440.544	1.899	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cccnc2)n(-c2ccc(C(F)(F)F)cn2)n1	768231879	HZNOYPSXOZXRMS-UHFFFAOYSA-N	433.350	1.389	50	20	IDGD	
CC(C)c1cc(NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)n(-c2ncccn2)n1	768236972	IOGLJIWHEQBJTR-UHFFFAOYSA-N	443.851	1.544	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(C)(C)O)cc1S(=O)(=O)N1CCCc2ccccc21	768244793	NRCQFMJRAWTXKU-UHFFFAOYSA-N	447.513	1.369	50	20	IDGD	
N#Cc1cc(Cl)nc(NNC(=O)CNS(=O)(=O)c2ccc3c(c2)OCCCO3)c1	768711717	RWTFKTUMJXXCPS-UHFFFAOYSA-N	437.865	1.190	50	20	IDGD	
C[C@@H]1CCC[C@H]1CC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	768964171	CEASIXOUHFRYDJ-AEFFLSMTSA-N	437.562	1.614	50	20	IDGD	
CC(=O)N1CCc2c(NC(=O)C(=O)NNC(=O)c3cccc(OC(F)F)c3)cccc21	769266182	MLDQNGXSXXPTNT-UHFFFAOYSA-N	432.383	1.597	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)Nc2ccc(OC(F)F)cc2)cn1	770243981	YRJGBUMMIJYQGU-UHFFFAOYSA-N	429.405	1.400	50	20	IDGD	
CCNS(=O)(=O)[C@@H]1CCN(C(=O)CCC(=O)C(C#N)=C2N(C)c3ccccc3N2C)C1	771403196	KCZJZRANNQZVRG-OAHLLOKOSA-N	445.545	1.197	50	20	IDGD	
C[C@H]1C[C@H](CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)CCO1	771424818	AQCZSKOGMNXYTA-JKSUJKDBSA-N	438.550	1.620	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C1=NN(c2ccc(F)cc2)[C@H](C(N)=O)C1	772968135	DCGYVWPXSUEEPQ-DIFFPNOSSA-N	447.854	1.514	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)C(=O)Nc2ccc(CC(=O)N3CCSCC3)cc2)n1	773478121	HAKGCORYBHOLEC-UHFFFAOYSA-N	428.518	1.293	50	20	IDGD	
COc1ccc(N2CCN(C(=O)/C=C\C(=O)NNc3cc(Cl)nc(N)n3)CC2)cc1	773862359	SMGQZYSDRWDNMP-SREVYHEPSA-N	431.884	1.069	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)Nc1ccc(S(=O)(=O)NC(C)(C)C)cn1	776063535	UYIUMLMFPUSUDM-UHFFFAOYSA-N	445.505	1.581	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1Cl)N[C@H]1CCO[C@@]2(CCS(=O)(=O)C2)C1	776077051	PWZDHPJFZHLZQZ-ZBEGNZNMSA-N	436.317	1.674	50	20	IDGD	
Cc1nc([C@H]2COCCN2C(=O)CCC(=O)C(C#N)=C2N(C)c3ccccc3N2C)no1	779694478	XQMNDHUJPCIMLD-GOSISDBHSA-N	436.472	1.949	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cc(Cl)ncc2Cl)cc1	780170984	HOQXOFWHWCSMFY-UHFFFAOYSA-N	431.301	1.779	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCC2CCN(CC(F)(F)F)CC2)c1	780632802	OMOKKAKJYLVOPT-UHFFFAOYSA-N	436.456	1.308	50	20	IDGD	
CCNC(=O)N(C)NC(=O)c1ccc(OC)c(S(=O)(=O)N[C@H]2CCCC[C@H]2C)c1	780711477	LWLKNHJOMSVYHJ-HIFRSBDPSA-N	426.539	1.858	50	20	IDGD	
COCCn1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)c(C)n1	782538501	YCHVQNAXLMGFDD-UHFFFAOYSA-N	449.533	1.087	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NCc1cccc(S(=O)(=O)N(C)C)c1	782764324	WOAVKDIJRXOISP-CYBMUJFWSA-N	438.481	1.374	50	20	IDGD	
O=C(NNc1ncc(C(F)(F)F)cc1Cl)C(=O)Nc1ccc(-n2cnnn2)cc1	782854409	RFEYQEAPSKFNTE-UHFFFAOYSA-N	426.746	1.811	50	20	IDGD	
Cc1ccccc1NC(=O)NNC(=O)C(=O)Nc1ccc2c(c1)C(=O)N(CC1CC1)C2=O	783410788	JJXRPVZSCCCQAK-UHFFFAOYSA-N	435.440	1.792	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1ccc(C#N)cc1F	784833173	JMCLHSALOAFYCA-UHFFFAOYSA-N	433.465	1.856	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNc2ccnc(F)c2)c(C(=O)N2CCCCC2)cc1OC	784851406	CDMJLNWGLRPMAF-UHFFFAOYSA-N	445.451	1.946	50	20	IDGD	
Cn1ccnc(NNC(=O)C(=O)Nc2cc(I)ccc2Cl)c1=O	785086458	PIKLKUIMLBTGDK-UHFFFAOYSA-N	447.620	1.120	50	20	IDGD	
O=C(NNc1nc(C(F)(F)F)cs1)C(=O)Nc1cccc(CN2C(=O)CNC2=O)c1	785145086	CVKUZNWTRAESPZ-UHFFFAOYSA-N	442.379	1.296	50	20	IDGD	
CN(CC(=O)NNC(=O)C1CC1)Cc1cccc(Br)c1OC[C@@H]1CCCO1	785518117	ONJAHPHPKYQXOF-HNNXBMFYSA-N	440.338	1.996	50	20	IDGD	
Cc1ccnc(-n2nc(C)cc2NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1	786091289	ANRGDCDDMWWASN-UHFFFAOYSA-N	435.492	1.743	50	20	IDGD	
COC(=O)CCc1cccc(NC(=O)C(=O)NNC(=O)CSc2ccc(C)cc2)c1	786413996	JBZCENGOWXIEMX-UHFFFAOYSA-N	429.498	1.979	50	20	IDGD	
Cc1ccc(-n2cc(NC(=O)C(=O)NNC(=O)Cc3nc4ccccc4n3C)cn2)c(C)c1	786422401	JFTDQBSPKSOARU-UHFFFAOYSA-N	445.483	1.704	50	20	IDGD	
CCC1(CC)Oc2ccc(NC(=O)C(=O)NNC(=O)Cc3cn4ccccc4n3)cc2O1	787901083	LOIHLCZQDMONIA-UHFFFAOYSA-N	437.456	1.950	50	20	IDGD	
CN(NS(=O)(=O)CCc1ccccc1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	788915911	MPVCTPGDFHUZHO-UHFFFAOYSA-N	426.539	1.668	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(O[C@@H]3CCOC3)cc2)cc1OC	789206461	RYHMENOGBAWSBK-QGZVFWFLSA-N	444.440	1.490	50	20	IDGD	
CS(=O)(=O)CC[C@H](C(=O)NNC(=O)c1nn(-c2ccccc2)cc1O)c1ccccc1	790488069	YMODNEDLACWGAC-KRWDZBQOSA-N	442.497	1.557	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)COc2ccc(C)cc2)cc(Cl)c1F	792268950	QNMZTJYOCVRAPJ-UHFFFAOYSA-N	437.811	1.739	50	20	IDGD	
Cc1onc(-c2ccc(C(F)(F)F)cc2)c1C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O	792317382	UXVLYPMGILYNAU-QMMMGPOBSA-N	434.396	1.368	50	20	IDGD	
COc1cc(C)cnc1C(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	792606318	MJFCVZUXJWERAZ-UHFFFAOYSA-N	431.924	1.631	50	20	IDGD	
O=C(NNC(=O)c1cc(F)ccc1Br)C(=O)Nc1cnc(CC2CC2)nc1	793026507	RQXZFMITCBXQAV-UHFFFAOYSA-N	436.241	1.730	50	20	IDGD	
O=C(NNc1ccc2c(=O)[nH]ccc2c1)C(=O)Nc1ccc(CCN2CCOCC2)cc1	793070908	VNAVOBHHSANHTA-UHFFFAOYSA-N	435.484	1.485	50	20	IDGD	
C[C@H](C(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1)N(C)CC(F)(F)F	793814313	OWWSIRYVOHBHBI-GFCCVEGCSA-N	425.452	1.505	50	20	IDGD	
C[C@@H](CNC(=O)OC(C)(C)C)C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	796838996	GDTXTOUWLPBUCC-AWEZNQCLSA-N	442.538	1.311	50	20	IDGD	
CNC(=O)COc1ccc(NC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)c(C)c1	797678995	DMGSLJABNGQKEV-UHFFFAOYSA-N	438.444	1.478	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)/C=C\c2ccc([N+](=O)[O-])cc2)cc1OC	798128857	BFEAIJNYOKBZPS-YHYXMXQVSA-N	429.385	1.630	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2nn(-c3ccccc3F)cc2O)n1	801377901	HMYBVEYLMQHHCT-UHFFFAOYSA-N	433.421	1.029	50	20	IDGD	
CC1CCC(NS(=O)(=O)CC(=O)NNC(=O)Nc2ccc(OC(F)F)cc2)CC1	802045431	PNHYYSZCSBKMDL-UHFFFAOYSA-N	434.465	1.939	50	20	IDGD	
COc1cccc(C(=O)NCC(=O)NNC(=O)Nc2cc(OC)c(Cl)cc2OC)c1	802084916	OTDIOQQOARFSPI-UHFFFAOYSA-N	436.852	1.949	50	20	IDGD	
COc1ccc(C2=NO[C@H](CNC(=O)NNC(=O)COc3ccc(C#N)cc3)C2)cc1C	802358197	ZEMGIMYLJWQOPO-SFHVURJKSA-N	437.456	1.778	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCC1(c2ccccn2)CCC1	804867559	FSUWKWGKRCCBGW-UHFFFAOYSA-N	430.534	1.749	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1)C(=O)Nc1ccc(F)c(N2C(=O)CCC2=O)c1	806973034	WTQMICLOVFCEHK-UHFFFAOYSA-N	432.795	1.532	50	20	IDGD	
O=C(NNc1ccc([N+](=O)[O-])cc1Br)C(=O)Nc1cccc2c1CNC2=O	806986085	PZUKWCRRWYFZAI-UHFFFAOYSA-N	434.206	1.683	50	20	IDGD	
COCCNC(=O)c1cccc(NC(=O)C(=O)NNc2ccccc2Br)c1	806995943	RAOJDLKHSJHPKY-UHFFFAOYSA-N	435.278	1.907	50	20	IDGD	
Cc1cccc(NS(=O)(=O)c2cc(C(=O)NNC(=O)N3CCN(C)CC3)ccc2C)c1	807382304	AEMKXPZSHFZQFP-UHFFFAOYSA-N	445.545	1.706	50	20	IDGD	
COc1ccc(CS(C)(=O)=O)cc1NC(=O)C(=O)NNc1ccc([N+](=O)[O-])cc1C	807456342	IBJLRLFZBMYDKD-UHFFFAOYSA-N	436.446	1.538	50	20	IDGD	
CC/C=C(/C)C(=O)NNC(=O)C[C@@H]1c2cc(OC)c(OC)cc2CCN1S(C)(=O)=O	809999537	OFVRMGAZJFPQEN-VXXVJXPCSA-N	439.534	1.456	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cc(F)c(F)cc2OC)cc1	810386017	JDHOJJUVVABSQO-LLVKDONJSA-N	437.399	1.926	50	20	IDGD	
COc1ccc(NNC(=O)CNS(=O)(=O)c2ccc(OC)c(OC)c2)c([N+](=O)[O-])c1	810605436	ITTMYXIWKCUFJE-UHFFFAOYSA-N	440.434	1.042	50	20	IDGD	
O=C(NN=Cc1c[nH]nc1-c1cccs1)c1cccc(S(=O)(=O)N2CCOCC2)c1	812375717	FNYHUCABWHHWRF-UHFFFAOYSA-N	445.526	1.923	50	20	IDGD	
CO[C@](C)(C(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1)C1CC1	812452319	FDPGOVRJCZIMFX-NRFANRHFSA-N	431.514	1.741	50	20	IDGD	
O=C(CC(F)(F)F)NNC(=O)NCc1cccc(N2C(=O)NC3(CCCC3)C2=O)c1	812560764	QTCLRWUUTDTUCO-UHFFFAOYSA-N	427.383	1.838	50	20	IDGD	
Cc1ccc(CN(C)C)cc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	813033970	TWKPDGUBRVCQTI-UHFFFAOYSA-N	433.534	1.389	50	20	IDGD	
Cc1cc(CNC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)nc(N2CCCC2)n1	813857560	XUGOFBWCSDADSE-UHFFFAOYSA-N	436.476	1.421	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@H](C)C(=O)NNC(=O)c1ccc2c(c1)NC(=O)CNC2=O	814229989	VNWYPKZWQQUTLH-GFCCVEGCSA-N	444.875	1.867	50	20	IDGD	
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC(=NNC(=O)CSc2ccccc2O)CC1	814970801	DLKTWNJQHYXZSH-UHFFFAOYSA-N	437.547	1.781	50	20	IDGD	
COC(=O)C(C)(C)c1csc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)n1	815568413	GTWKKLZDZSIGGY-UHFFFAOYSA-N	440.865	1.352	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)[C@@H]1C[C@H]2C[C@H]2N1C(=O)OC(C)(C)C	815890525	JNKWHZKSRFBVSV-MCIONIFRSA-N	426.514	1.837	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)Cc3ncc[nH]3)c2)cc1	816828161	UFLAUMODNCPILK-UHFFFAOYSA-N	429.458	1.223	50	20	IDGD	
CCOc1ccc(NNC(=O)CNS(=O)(=O)c2ccc(CNC(C)=O)s2)cc1	817921117	JKNWNBJQABXTGR-UHFFFAOYSA-N	426.520	1.205	50	20	IDGD	
COc1cccc(C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c1OC(F)F	849196935	ICEMIJQMZHTWOY-UHFFFAOYSA-N	439.327	1.823	50	20	IDGD	
Cn1c(=O)c2cc(C(=O)NNC(=O)c3cc4c(s3)CCCCC4)cnc2n(C)c1=O	862152202	YICIEUGEHOVSGD-UHFFFAOYSA-N	427.486	1.037	50	20	IDGD	
COc1ccc([N+](=O)[O-])cc1NS(=O)(=O)c1cccc(C(=O)N2CC[C@@H](B(O)O)C2)c1	864234768	VRWSIKFRSUPTSN-CYBMUJFWSA-N	449.250	1.093	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2ccc(F)cc2Cl)c1	903901992	SCONCPLBAWHFAI-UHFFFAOYSA-N	435.886	1.353	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)CNS(=O)(=O)c2c(Cl)cccc2Cl)cc1	913431329	GHJNJNOEDDLQFS-UHFFFAOYSA-N	445.328	1.840	50	20	IDGD	
CCOc1ccc(NC(=S)NNC(=O)CNC(=O)c2cc(OC)cc(OC)c2)cc1	913443891	CCTHOTYSOYTRJK-UHFFFAOYSA-N	432.502	1.850	50	20	IDGD	
N#C/C(=C/c1cn(CCC(N)=O)nc1-c1cccc(Br)c1)C(=O)OCCO	914057711	YECQRCDJSHAVAN-JYRVWZFOSA-N	433.262	1.630	50	20	IDGD	
Cc1ccc(OCCNC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1	915889509	FGVKBTWCWXVVEH-UHFFFAOYSA-N	434.518	1.333	50	20	IDGD	
Cc1ccc(S(=O)(=O)Oc2ccc(S(=O)(=O)NNC(=O)c3cccn3C)cc2)cc1	917729053	CEVGEBCMRQMYEV-UHFFFAOYSA-N	449.510	1.725	50	20	IDGD	
CC[C@@H](NC(=O)NNC(=O)c1csc(N2CCOCC2)n1)c1ccc2c(c1)OCCO2	918133169	UMNICKFBPYKNKE-CQSZACIVSA-N	447.517	1.846	50	20	IDGD	
O=C(CNC(=O)NCc1ccco1)NNC(=S)Nc1cccc(Br)c1	918681332	GRYFCWXDUFDKII-UHFFFAOYSA-N	426.296	1.859	50	20	IDGD	
O=C(NCC(F)(F)F)NNC(=O)C1CCN(S(=O)(=O)/C=C\c2ccccc2)CC1	918707164	AXGUWTLOYKCCJU-FLIBITNWSA-N	434.440	1.592	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)N[C@H]2CCCOc3ccc(F)cc32)c2ccccc2c1=O	919791397	PFGIVCQZDCEMOZ-INIZCTEOSA-N	425.420	1.931	50	20	IDGD	
C[C@@H](Sc1ccc(Br)cc1)C(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1	919886320	REHWJTFNKXULMN-KOLCDFICSA-N	436.353	1.447	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1nnc(O)c2ccccc12)c1ccc(N2CCOC2=O)cc1	920990557	VWBLYGRPFTUSSK-LBPRGKRZSA-N	436.428	1.997	50	20	IDGD	
C[C@H](Cc1ccc(F)cc1)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	920999131	GKYMPSMUKOZTKJ-OAHLLOKOSA-N	449.504	1.486	50	20	IDGD	
CCCNC(=O)NNC(=O)CCc1nc2cc(S(=O)(=O)N(CC)CC)ccc2n1C	921040860	JWKPYGAQOAEBIV-UHFFFAOYSA-N	438.554	1.277	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)[C@@H](Cc2ccccc2)NC(=O)c2cccnc2)c1	921305409	PFBARKFCWOFVHS-OAQYLSRUSA-N	431.496	1.950	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)N[C@@H]1CCCc2c1cnn2Cc1ccccc1	1318134521	BWLLPHVRECTXAW-QGZVFWFLSA-N	436.472	1.662	50	20	IDGD	
CNC(=O)c1cccc(C(=O)NNc2nc3ccccc3c(=O)n2CCCOC(C)C)n1	1322590023	ZNQUGXUPAFQHFX-UHFFFAOYSA-N	438.488	1.723	50	20	IDGD	
CCOC(=O)N1CCC[C@H](C(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)C1	1322957870	PKFPBJPFPJGZOK-HNNXBMFYSA-N	426.514	1.649	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3ccc(OCC4CC4)nc3)cc2)CC1	1338492870	GIBPEDYITXQEAF-UHFFFAOYSA-N	445.545	1.563	50	20	IDGD	
CCCS(=O)(=O)N1CCC(NC(=O)NNC(=O)c2cncn2-c2ccccc2)CC1	1340194335	BPWPPMIYMIMYQN-UHFFFAOYSA-N	434.522	1.021	50	20	IDGD	
CN1CCc2cc(C(=O)N3CC[C@]4(C3)CN(C(=O)[C@H](F)Br)CCO4)ccc21	1777920633	NLOTUQICHROWJX-LPHOPBHVSA-N	440.313	1.813	50	20	IDGD	
C/C=C/C=C\C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C1	1778092793	QVUFYRYQKVFXJK-RRCJGGNMSA-N	441.532	1.767	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(O)no2)C1	1779801359	LOJACJOKJQRHEW-XTQGRXLLSA-N	430.299	1.539	50	20	IDGD	
O=C(Cc1ccncc1)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Br)C2	1780565639	IBARFUKRUIFIRW-QGPMSJSTSA-N	428.302	1.829	50	20	IDGD	
N#Cc1ccc(F)c(C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](F)Br)C3)C2)c1	1781331928	BGCOKXLWPYHOOT-YOEHRIQHSA-N	428.233	1.831	50	20	IDGD	
O=C(c1n[nH]c2c(F)cccc12)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781332180	VHZUWPYAYIVQSN-RHSMWYFYSA-N	443.248	1.836	50	20	IDGD	
O=C(c1cccc2nccn12)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781332185	DRRHKHXCCGVSAI-YOEHRIQHSA-N	425.258	1.468	50	20	IDGD	
O=C([C@@H](O)Cc1ccccc1)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781332818	FOHKLVUQVNQVHY-MPGHIAIKSA-N	429.286	1.110	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2)C1CCC2(CC1)OCCO2	1781638131	IKZGNWWUYDEUFM-MBOZVWFJSA-N	444.956	1.033	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCC(=O)NN(C)C)C1	1782208957	DDWBCEDVQJMWDZ-JXXFODFXSA-N	430.977	1.281	50	20	IDGD	
C[C@@H](C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Br)C2)n1cncn1	1782532330	XLAWEKCGZIHHCZ-RSUWNVLCSA-N	432.294	1.044	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cccc4ccnn34)CCO2)C1	1783352972	LOXJLDFNXPCRNV-DNVCBOLYSA-N	435.322	1.951	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H]2[C@@H](C1)[C@@H]2C(=O)N1CC[C@@]2(CN(C(=O)[C@H](F)Cl)CCO2)C1	1783502188	MXPDOFWFPXGDLF-MLVCSTQZSA-N	445.919	1.464	50	20	IDGD	
CC[C@H]1CC[C@H](C(=O)N2CC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)CC1	1783605854	PRKZXMGXDOAPGX-BSRJHKFKSA-N	428.338	1.026	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccncc3C(F)(F)F)CCO2)C1	1783874540	IOICBYIRCDUNAM-PBHICJAKSA-N	435.830	1.798	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(C)cc3-n3nccn3)CCO2)C1	1783880907	GUCAAFKXHRYNCP-DYESRHJHSA-N	447.923	1.273	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)Cc3ccc(C)c([N+](=O)[O-])c3)CCO2)C1	1783882204	WIOUCJLHJKNLKG-OXJNMPFZSA-N	439.896	1.529	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)CC1CCC(C)(C)CC1)CCO2	1783934631	JPBKSKPZIXMGRR-HSZRJFAPSA-N	436.597	1.796	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H](CC(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](F)Cl)CCO3)C1	1784152515	NXATUEUOHJUAEU-NBQZKYEYSA-N	447.935	1.998	50	20	IDGD	
Cc1cc(C)n(CCC(=O)N2CC[C@@]3(CN(C(=O)CCBr)CCO3)C2)n1	1784318025	WVGOWOAVWPKKFQ-SFHVURJKSA-N	427.343	1.505	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(-c4ncc[nH]4)cc3)C2)C1	1785156690	ZNDYHDCIEJRFIR-UTKZUKDTSA-N	432.908	1.774	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](CN)c3ccccc3)[C@H]2C1	1786924895	UHCHYHOEHYFVJJ-VPMQLGLMSA-N	442.387	1.945	50	20	IDGD	
Cn1nc(C(F)(F)F)cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]2C1	1787448213	YICJCNMGQAIWMB-LKAMGYQZSA-N	426.798	1.567	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccncc3F)[C@H]2C1	1787757292	KBLDIIFMMUXENY-ZIEJDFEHSA-N	428.302	1.988	50	20	IDGD	
O=C([C@H](O)CCl)N1CC[C@H]2CO[C@@H](CNC(=O)C3(c4cccc(Cl)c4)CC3)[C@H]2C1	1788086853	AJTKXEIFEVCXLJ-RUGDWHBFSA-N	441.355	1.951	50	20	IDGD	
CCn1ccc(C(=O)NC2(c3ccc(NC(=O)c4ccc(B(O)O)cc4)cc3)CCC2)n1	1788140359	UPYLSLIGANFBPD-UHFFFAOYSA-N	432.289	1.644	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)c1n[nH]c2cc(Cl)ccc12	1788409498	OLVBJIOYHLDXQL-NZBMOFRJSA-N	441.315	1.409	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3nnc(-c4ccccc4)o3)[C@H]2C1	1788664961	KIZFBBMUIYAVKT-NXOAAHMSSA-N	448.907	1.584	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnn(C)c3Cl)[C@H]2C1	1789080403	CMHVHOQWIYHYLU-IMIFBBOLSA-N	447.761	1.698	50	20	IDGD	
Cc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)CBr)C[C@@H]32)c(O)n1	1789308243	HZKTUYVSOUVBOP-MZGVZZPPSA-N	440.338	1.720	50	20	IDGD	
CN(C)c1cncc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]3C2)c1	1789922904	XMAYGFCIOYZHDP-VCOSZWKGSA-N	443.317	1.431	50	20	IDGD	
CCN1CCC(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]3C2)CC1	1789926956	MCAAUEWCYVBOGY-VGWMRTNUSA-N	434.350	1.389	50	20	IDGD	
COC(=O)Nc1cccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](O)CCl)C[C@@H]32)c1	1789980355	HZWNDVQAGXBPTO-HJWJTTGWSA-N	439.896	1.058	50	20	IDGD	
COc1ccc(F)c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](O)CCl)C[C@@H]32)c1OC	1790157050	BUJJMORLBBCCRV-GMZLATJGSA-N	444.887	1.036	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)n3cccn3)C[C@@H]21	1790963734	LAPKLXVYIKGKNJ-CWVYHPPDSA-N	427.343	1.597	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cn4cc(F)ccc4n3)C[C@@H]21)C(Cl)Cl	1791294881	WALCEXLGDBAQAE-JKOKRWQUSA-N	429.279	1.870	50	20	IDGD	
CCSc1ncccc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](Cl)COC)C2	1792399837	XYNQOPAIUVIEJI-OCVGTWLNSA-N	427.954	1.651	50	20	IDGD	
Cc1nccn1CCCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)CBr	1792873200	OLNHXOSDPBFSTR-NYCLONFESA-N	441.370	1.592	50	20	IDGD	
Cc1cccc(C)c1N1C[C@H](C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](O)CCl)CC1=O	1793110967	SYWVOZVOEMBYEK-UJWQCDCRSA-N	447.963	1.894	50	20	IDGD	
COc1cccc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Br)C3)n1	1794015369	OBXNYQQVBMIBTH-CZAMWMTLSA-N	444.301	1.303	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccccc1-n1nccn1)C2	1795115067	DZRDNJRYJSDYJS-ZSBFGKGUSA-N	448.321	1.256	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](Br)Cc1ccccc1)C2)[C@@H]1C=CCN1	1796314588	AZVZTKPYACSDNW-MTHXSQLBSA-N	448.361	1.110	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@](O)(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](F)Cl)C1	1796810103	PIDOWZJFCKPEPB-IMDDZUEWSA-N	433.908	1.531	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2)c1cccc(OC2CCOCC2)n1	1798374196	UHQOPISFHXCGFC-GGNLRSJOSA-N	441.887	1.377	50	20	IDGD	
COc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)Br)C3)c(OC)c1	1798824352	XHAQJRXXCOAZTP-KOFHJDLBSA-N	441.322	1.690	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1cc(F)ccn1)C2	1799273813	JMOWQDYBLXGMGH-OESLAJAZSA-N	432.323	1.979	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)c1cnc2c(F)c(F)ccc2c1	1800066239	PTPXEQIYKCGLAO-YXPYIKCWSA-N	439.846	1.316	50	20	IDGD	
Cc1nnc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)Br)s1	1800756309	AGDSEGSDTVRKEV-ADGXKJENSA-N	431.356	1.152	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CC[C@@H](N)C(N)=O)C2	1801437110	HPZBTXIPMABBMV-HDAOGJMZSA-N	445.470	1.103	50	20	IDGD	
COC(=O)NCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C(C#N)=C/c1ccc(F)cc1F	1801438573	ABQGPTLGYFZGCR-RMWXTBGQSA-N	432.427	1.866	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CSc1ccccc1[N+](=O)[O-])[C@@H](O)CCl	1802181171	KNDDNKXXZNVFDE-XFMPKHEZSA-N	427.910	1.925	50	20	IDGD	
CC(C)(C)OC(=O)NCC(C)(C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2	1802243334	LIFMIAHAWSNBLZ-CRWXNKLISA-N	435.924	1.661	50	20	IDGD	
COc1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CCC(=O)NN(C)C)cc1OC	1802337579	ZINHZNYVBJHQFH-BJWYYQGGSA-N	432.521	1.329	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc3nc[nH]c3c2)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803143119	UKIDLCJRNSPFMP-ZYSHUDEJSA-N	427.892	1.877	50	20	IDGD	
Cn1cccc(C(=O)NC[C@H]2CCN(C(=O)CO[Si](C)(C)C)[C@H]2c2cccnc2)c1=O	1803833946	JSOCSQHUEZEEJK-XLIONFOSSA-N	442.592	1.951	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC2(CCCN(C(=O)CC(=O)OC(C)(C)C)C2)CC1	1806361336	UITPPWNRFJTUBO-UHFFFAOYSA-N	438.569	1.322	50	20	IDGD	
Cc1c[nH]cc1C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1807361116	HKGRULNWPSMUJE-NQIIRXRSSA-N	432.289	1.031	50	20	IDGD	
Cc1noc(CC(=O)NC[C@@H]2CCN(C(=O)[C@@H](F)Br)[C@H]2c2cccnc2)n1	1807525504	UYBJVXRFIYSWPM-VBNZEHGJSA-N	440.273	1.712	50	20	IDGD	
O=C(Cc1ccsc1)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1807559771	PNFSQNLNCZUSJF-UGKGYDQZSA-N	449.341	1.385	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)c1ccc2c(c1)OCCO2	1808989439	NXKKIVSKNAETEN-SQGPQFPESA-N	445.903	1.772	50	20	IDGD	
Cc1ccc(CC(=O)N2CCC3(CCCN(C(=O)c4cccc(B(O)O)c4)C3)CC2)cn1	1809974872	DSFVLYRINLYUAF-UHFFFAOYSA-N	435.333	1.157	50	20	IDGD	
CC(C)c1cc(C(=O)N2CCC3(CCCN(C(=O)c4cccc(B(O)O)c4)C3)CC2)n[nH]1	1809978067	TWJUPQLZFDGGLJ-UHFFFAOYSA-N	438.337	1.372	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)c3onc4ccccc34)CC2)C1	1809980796	ULOIYOHWNHJULV-UHFFFAOYSA-N	447.300	1.666	50	20	IDGD	
CC(C)O[C@H](C)C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1813073385	LVBJROMYUATWLR-BLIXFSHQSA-N	433.553	1.274	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H]2CCCCO2)n[nH]1	1814505818	HPNUUECYHQXIHN-IAGOWNOFSA-N	441.492	1.283	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)CCN3CCN(C)CC3)sc2C1	1814583736	VTLJFUPPIHCWBO-UONOGXRCSA-N	428.002	1.710	50	20	IDGD	
C[C@H](CBr)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2CCC(=O)N2)[nH]n1	1814780331	MBAAHPSAFUUWCZ-MDZLAQPJSA-N	426.315	1.711	50	20	IDGD	
CN(CC(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1)C(=O)c1ccccc1	1815086122	BRECWPBXUJPAOI-DLBZAZTESA-N	447.923	1.774	50	20	IDGD	
Cc1ccccc1C(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1	1815343824	QVTITWGBUOAPRH-INIZCTEOSA-N	435.314	1.671	50	20	IDGD	
Cc1cccnc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1815396469	HIRJJTRHNKCZPX-SFHVURJKSA-N	433.277	1.413	50	20	IDGD	
CC(=O)OC[C@H](OC(C)=O)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](F)Cl)[nH]n1	1819430721	BJTSJJCINAYBLD-KCQAQPDRSA-N	432.836	1.431	50	20	IDGD	
C[Si](C)(C)OCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1nc[nH]c1[N+](=O)[O-])CC2	1820164786	JCOGYBRZMDQIKN-VIFPVBQESA-N	438.542	1.852	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CN(CCO)CCO)n[nH]1	1822022404	DDZJPDCIHWRLCF-GOEBONIOSA-N	429.949	1.096	50	20	IDGD	
COc1cc(C(=O)N[C@H]2CCc3nc(NC(=O)[C@H](F)Br)sc3C2)nn1C	1823007060	KMRSHYSHAMEONO-MADCSZMMSA-N	446.302	1.802	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H](O)c2ccco2)CC1	1823772863	AUQPBHSALYWJDI-LAUBAEHRSA-N	434.537	1.306	50	20	IDGD	
C=CCSCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1	1824958205	OHHCSHPITHCGJT-IBGZPJMESA-N	445.589	1.838	50	20	IDGD	
O=C(CCn1cncn1)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](F)Br)CC2	1826608633	OVGQUPYVYBXUPR-UFBFGSQYSA-N	431.291	1.427	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](N)c2ccccn2)CC1	1826917979	VKPCNJDXILBRGF-UGKGYDQZSA-N	444.580	1.074	50	20	IDGD	
O=C([C@H]1CCC=CO1)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827051891	ILFQRMAHIFZVOG-NHCUHLMSSA-N	426.322	1.292	50	20	IDGD	
O=C(c1cnccc1F)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827052858	KTCCXKGKNHSLHO-NRFANRHFSA-N	439.296	1.448	50	20	IDGD	
O=C([C@H]1CCCSC1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827055479	YUXQCTLTICZKCN-FPOVZHCZSA-N	444.406	1.743	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)C3CCSCC3)sc2C1	1828343933	KODALTIPJNJIHH-CYBMUJFWSA-N	439.607	1.571	50	20	IDGD	
CCOC(CC(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2)OCC	1830370212	MNPJLSUPOMJZQC-FQEVSTJZSA-N	434.961	1.497	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)no1	1830537694	MEPNOXODCAGEPM-SJKOYZFVSA-N	430.299	1.084	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccnc(Cl)n3)C2)C1	1831652358	ZJGGWFSDIUTYAL-ACJLOTCBSA-N	431.320	1.608	50	20	IDGD	
CCOC(=O)N[C@H](O)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@H](C)Br)CC1	1831655658	XHSOUKXXNXHVJO-NWANDNLSSA-N	448.358	1.454	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1COc3ccccc3O1)CCO2	1832501028	YUGMBXBEPSMBKL-KLHJMIIUSA-N	438.908	1.300	50	20	IDGD	
CCCc1onc(C)c1C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)CCl)CC2)CC1	1833310947	YNZRMJCMZRMRQR-QGZVFWFLSA-N	440.972	1.720	50	20	IDGD	
COc1cccc(/C=C/C(=O)N2CCC(N3CCC(NC(=O)[C@H](O)CCl)CC3)CC2)c1	1833312003	IGEXCBMYJVWZGM-YAQIIAKESA-N	449.979	1.880	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)[C@H]1CCCCC1(F)F	1833548391	GELLRBGFCPWMEI-SJORKVTESA-N	435.943	1.983	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1)c1ccc[n+]([O-])c1	1833910067	KZWPJVJUAXTKFF-INIZCTEOSA-N	443.317	1.196	50	20	IDGD	
Cn1ncnc1C(=O)NC1CCN(C2CCN(C(=O)[C@@](C)(Cl)CCl)CC2)CC1	1834075728	PRKBVNFIVLEAEI-SFHVURJKSA-N	431.368	1.237	50	20	IDGD	
CNCCCC(=O)NC1CCN(C2CCN(C(=O)[C@H](C)CBr)CC2)CC1	1834711147	RXWBJJGUKCLQKR-OAHLLOKOSA-N	431.419	1.589	50	20	IDGD	
COc1ccc(C(=O)NC2CCN(C3CCN(C(=O)C(C)(C)CCl)CC3)CC2)nn1	1836053989	VGHBILHWJDORKY-UHFFFAOYSA-N	437.972	1.935	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)c3cnn4ncccc34)CC2)CC1	1836393895	ALOOMEZDYKAVFW-GOSISDBHSA-N	432.956	1.932	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)CN3CCCCC3)CC2)CC1)[C@@H](F)Br	1836412596	NKJMKIFPCFLMOS-GOSISDBHSA-N	447.393	1.734	50	20	IDGD	
O=C([C@H](O)CCl)N1CCC(OC2CCN(C(=O)[C@H]3Cc4ccccc4CN3)CC2)CC1	1836717499	DJGZCIZVUXTGBF-NHCUHLMSSA-N	449.979	1.299	50	20	IDGD	
CN1C(=O)CC[C@H]1C(=O)N1CCC(OC2CCN(C(=O)[C@H](F)Br)CC2)CC1	1838649029	SKWKKTKNQSPQPR-HOCLYGCPSA-N	448.333	1.296	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3cccc(C#N)c3)C2)C1	1839141932	YJZHDYHNJGFJSQ-DENIHFKCSA-N	433.936	1.965	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3n[nH]c4cccc(F)c34)C2)C1	1839147876	FVUYVTHZXZKVRZ-RBZFPXEDSA-N	438.887	1.789	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(F)(F)C(F)F)C2)C1	1839150097	BTDRZESTXXCTNJ-KBPBESRZSA-N	439.233	1.580	50	20	IDGD	
Cc1cc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)on1	1839150251	GNTQCUSSSAPOKX-ZWKOTPCHSA-N	434.320	1.218	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ncc(F)cc3F)C2)C1	1840030546	PAIZBZZFVZSKAI-DIFFPNOSSA-N	448.264	1.213	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(F)cn3C)C2)C1	1840033018	QPBJLEHHJBVSBH-YVEFUNNKSA-N	432.290	1.018	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C[C@@H]3C[C@@H]4CC[C@H]3C4)C2)C1	1840155408	BCDBOXWKNKITPD-DLUQJKKWSA-N	428.957	1.523	50	20	IDGD	
CCOC(CC(=O)N1CCO[C@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1)OCC	1840281889	UQQWOVUAROBTFQ-HXUWFJFHSA-N	446.617	1.084	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)n1ccnc1C)CCO2	1840489558	YNRMRJMRSCBKSW-OXFYSEKESA-N	426.945	1.616	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CCCOC1)CCO2	1840878451	HRACCOGVWWGWQV-RLFYNMQTSA-N	433.343	1.043	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2cnn3ccc(C)cc23)C1	1843306110	OHQOEXARFCVHGT-WGOQTCKBSA-N	447.499	1.594	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)[C@@H]2C[C@@H]2c2ccc(Cl)cc2)C1	1843872767	BBBKMFUCACVWKU-WOJBJXKFSA-N	438.720	1.641	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2c(F)cccc2Cl)C1	1844863286	BFFYCADILJYURS-UHFFFAOYSA-N	431.855	1.608	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCCC12CN(C(=O)c1cncc(S(C)(=O)=O)c1)C2	1846069091	GZDZSMIZZYUJGA-CQSZACIVSA-N	444.351	1.476	50	20	IDGD	
Cc1ccc(CNC(=O)NCC(=O)NNC(=O)COc2ccc(Br)cc2)cc1	14055878	AGHMNHUFGFLEPQ-UHFFFAOYSA-N	449.305	1.783	50	20	IDGD	
O=C(CSc1ccc(S(=O)(=O)N2CCCC2)cn1)NNC(=O)c1cccs1	17226293	BVYRCOPBPKDPAO-UHFFFAOYSA-N	426.545	1.481	50	20	IDGD	
Cc1cc(C)n2nc(NC(=O)NNC(=O)CCN3CCN(c4ccccc4)CC3)nc2n1	725853575	VTPOFLRWPAGZKQ-UHFFFAOYSA-N	437.508	1.106	50	20	IDGD	
CN(Cc1ccc(N2CCOCC2)cc1)C(=O)NNC(=O)CNC(=O)c1cccs1	725873320	WYSGRVABTJWSRQ-UHFFFAOYSA-N	431.518	1.187	50	20	IDGD	
O=C(COC(=O)Cc1c[nH]c2cc(Cl)ccc12)NNC(=O)[C@@H]1COc2ccccc2O1	728342899	JOHSVGLLCMUOLG-SFHVURJKSA-N	443.843	1.894	50	20	IDGD	
O=C(CCCS(=O)(=O)N1CCCC1)NNC(=O)c1cc(F)ccc1Br	728545639	AOAZBXJQLFBGJK-UHFFFAOYSA-N	436.303	1.555	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)N1CCC(C(=O)N2CCC[C@@H](C)C2)CC1	728945223	WSIPZIOTJCWCDH-OAHLLOKOSA-N	426.521	1.968	50	20	IDGD	
COc1ccc(C(C)=NNC(=O)CSc2nnc(O)nc2O)cc1CN1CCCCC1	730558236	FUVPDNYPRQZDAJ-UHFFFAOYSA-N	446.533	1.910	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCN(c2ccc3c(c2)OCCO3)C1=O)c1ccc(Cl)cc1O	730590899	WFRWKZJSYBSZFT-CQSZACIVSA-N	431.832	1.631	50	20	IDGD	
COC[C@@H](C)n1c(C)cc(/C=C(/C#N)C(=O)NC2CCN(CC(=O)N(C)C)CC2)c1C	731655699	ZLSUNYHRFFWMQJ-SYERDGIWSA-N	429.565	1.888	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)[C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])o2)c1	732050596	WIMVZNRMSOBQKA-CQSZACIVSA-N	430.417	1.636	50	20	IDGD	
CC(=O)N[C@H](CC(=O)NNC(=O)CCN1C[C@H](C)O[C@H](C)C1)c1c(F)cccc1F	732263728	OATRVAWGKHZXGI-IIYDPXPESA-N	426.464	1.179	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)[C@@H]1CCN(c2ccc3c(c2)OCCO3)C1=O	732303732	MZABPZAIBZDHLP-AWEZNQCLSA-N	431.470	1.358	50	20	IDGD	
Cc1[nH]nc(C(=O)NNc2nc3ccccc3c(=O)n2CCCOC(C)C)c1[N+](=O)[O-]	733265520	FUXDRJWNZNKUQO-UHFFFAOYSA-N	429.437	1.908	50	20	IDGD	
C[C@H]1CN(c2ccc(CNC(=O)NNC(=O)c3cnn(-c4ccccc4)c3)cn2)CCO1	733342512	YLFJIWFASARPDG-INIZCTEOSA-N	435.488	1.637	50	20	IDGD	
Cc1cc(=O)c(C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)nn1-c1ccccc1	734239920	ZSAATTUKDMNSGM-UHFFFAOYSA-N	430.465	1.010	50	20	IDGD	
CCc1nc(COc2ccc(C(=O)NNC(=O)CNC(=O)c3cccs3)cc2)no1	734321586	JFHSNHVGNZJURK-UHFFFAOYSA-N	429.458	1.464	50	20	IDGD	
CCN1CCC[C@@H]1CNC(=S)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	734766062	AFISZMAAFUFVGR-OAHLLOKOSA-N	428.603	1.549	50	20	IDGD	
C[C@@H]1CCCC[C@H]1OCC(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	735117566	XQZMTQHIPXSLIT-HZPDHXFCSA-N	425.555	1.056	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)N1CCN(C(=O)Cc2ccc(Cl)cc2)CC1	738496035	KWGQNBIYRBCKPE-UHFFFAOYSA-N	444.919	1.984	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)[C@@]2(C)CCc3ccccc3C2)CC1	743417808	DAARANBRMTYAFY-QFIPXVFZSA-N	443.573	1.656	50	20	IDGD	
CCN(Cc1ccccc1)C(=O)CNC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	743561446	ATWJWPMYOKRNCI-UHFFFAOYSA-N	447.517	1.475	50	20	IDGD	
CC(C)c1nc(C#N)c(NNC(=O)c2sccc2S(=O)(=O)N2CCOCC2)o1	746299502	XEXHDQIDIBFQGZ-UHFFFAOYSA-N	425.492	1.509	50	20	IDGD	
CCO[C@@H](CCNC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)C(C)C	746422020	SRLCGCCDSDCDSZ-KRWDZBQOSA-N	442.586	1.095	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)C1(NC(=O)NCc2ccccc2)CCCC1	746638050	VGZQTNBMXDVIHK-UHFFFAOYSA-N	434.500	1.836	50	20	IDGD	
O=C(CN1C(=O)N[C@@]2(CCc3ccccc32)C1=O)NNC(=O)c1ccc(Cl)cc1F	747330395	UFPRZTUFZXBWDV-HXUWFJFHSA-N	430.823	1.634	50	20	IDGD	
CCS(=O)(=O)N1CCN(C(=O)/C(C#N)=C/c2cc(C)n(C[C@H]3CCCO3)c2C)CC1	748055257	OXNROXQSTDVMGG-UMSHPIDHSA-N	434.562	1.685	50	20	IDGD	
O=C(CN1CCN(c2ccc3ccccc3n2)CC1)NNC(=O)c1ccc([N+](=O)[O-])cc1	749160221	VBKBRQZQYLMJQX-UHFFFAOYSA-N	434.456	1.726	50	20	IDGD	
C[C@H](O)c1ccc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1	749348726	SSKCLRXIMLCPMM-HNNXBMFYSA-N	446.529	1.669	50	20	IDGD	
COc1ccccc1N1CC[C@H](CNC(=O)NNC(=O)c2ccc3c(c2)OCCO3)C1	749929959	AEFXQXOWSXAGOQ-OAHLLOKOSA-N	426.473	1.937	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)c3cccc(F)c3I)nc21	750313239	ONTATNQWKDVNQA-UHFFFAOYSA-N	428.165	1.570	50	20	IDGD	
C[C@@H]1C[C@@H](NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)CCN1Cc1ccccc1	751098564	GNSZNRJVIOBIAJ-APWZRJJASA-N	434.504	1.659	50	20	IDGD	
CC[C@@H](C)C(=O)N1CCC[C@@H](C(=O)NNC(=O)c2nn(CC)c(=O)c3ccccc23)C1	751291478	WFCAUBPXDCQOSV-HUUCEWRRSA-N	427.505	1.462	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)NCC1(CN2CCOCC2)CCCCC1	751809231	FDGOZUYBMJISRC-UHFFFAOYSA-N	428.537	1.490	50	20	IDGD	
COc1cc(OC)cc(N2C[C@@H](C(=O)NNC(=S)Nc3ccc(OC)nc3)CC2=O)c1	752521521	PGPHCVWSMWLAOJ-LBPRGKRZSA-N	445.501	1.478	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H]2C[C@@H](C)N(C3CC3)C2)c1	753943513	PBONWJCPDXZODX-GDBMZVCRSA-N	437.566	1.286	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)c3cn(-c4ccc(Br)cc4)cn3)nc21	755895733	KNXINKSGPVFTLC-UHFFFAOYSA-N	429.238	1.774	50	20	IDGD	
COCCOc1ccc(NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c(C)c1	756018651	ORVVIMVQIBDODO-UHFFFAOYSA-N	428.493	1.880	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)[C@](C)(O)CN2Cc3ccccc3C2=O)c1C	756796335	HYAJBFZOTQPROK-WAIKUNEKSA-N	425.485	1.625	50	20	IDGD	
COC(=O)c1cc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)ccc1C	756843369	DEDHFLFPOGSJAL-UHFFFAOYSA-N	434.474	1.498	50	20	IDGD	
CC[C@H]1CN(C(=O)NNC(=O)CNC(=O)c2ccco2)CC[C@@H]1NC(=O)OC(C)(C)C	757020613	PTDGQXBOJUJHTB-KBPBESRZSA-N	437.497	1.375	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1ccc(-n2nccc2-c2ccc(F)cc2)cc1	758040049	NICWRSIZSVPKDS-ZDUSSCGKSA-N	445.476	1.377	50	20	IDGD	
O=C(CN1C(=O)c2ccc(Br)cc2C1=O)NNc1nc(O)c2ccccc2n1	758309545	UVZKOWAFCBLCOO-UHFFFAOYSA-N	442.229	1.837	50	20	IDGD	
CC(=O)N[C@H](CC(=O)N1CCN(S(=O)(=O)CBr)CC1)c1cccs1	758534886	LHADUYHJZZOMEH-GFCCVEGCSA-N	438.369	1.142	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)NCCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)c1	758692099	HNLDVRIBYHCFLX-UHFFFAOYSA-N	442.475	1.098	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)c2cnn(-c3cccnc3)c2)cc1	759690748	UCYMKODFKDYOLJ-UHFFFAOYSA-N	434.485	1.763	50	20	IDGD	
CN(NC(=O)C(C)(C)NC(=O)C(F)(F)F)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	760505729	QKNLRQIGJRKZLB-UHFFFAOYSA-N	439.435	1.079	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)NCC(=O)N1CCc2ccccc2C1	761679492	DNCFOMSYYUBHCI-UHFFFAOYSA-N	428.514	1.703	50	20	IDGD	
C[C@H](C(=O)NNc1nccc(N2CCOCC2)n1)N1CCN(c2ccc(F)cc2)CC1	762860696	HIKMZTCFRMYNGE-MRXNPFEDSA-N	429.500	1.106	50	20	IDGD	
CCOC(=O)C1=NN(c2ccccc2)[C@H](C(=O)NNc2nccc(N(CC)CC)n2)C1	762905461	AJYCMUORQXZYHN-KRWDZBQOSA-N	425.493	1.964	50	20	IDGD	
Cc1[nH]c(-c2ccncc2)nc(=O)c1CC(=O)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	763174005	UDGRRWIDJYPRLB-UHFFFAOYSA-N	447.430	1.673	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(C(=O)N2CCCC2)cc1	763472511	VYBMPLJPPQONBV-UHFFFAOYSA-N	425.401	1.231	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc3ccccc3cc2O)cc1S(C)(=O)=O	763521440	DYOJQMFSFUJKAK-UHFFFAOYSA-N	441.465	1.657	50	20	IDGD	
Cn1c(C2CC2)nc2cc(NC(=O)C(=O)NNC(=O)[C@@H]3COc4ccccc4O3)ccc21	763574453	BJAGVIBRYFOUKD-SFHVURJKSA-N	435.440	1.377	50	20	IDGD	
CCOC(=O)c1c(F)cccc1NC(=O)C(=O)NNC(=O)c1cc(OC)cc(OC)c1	763774825	HCXPUTMZWHOTCL-UHFFFAOYSA-N	433.392	1.419	50	20	IDGD	
COC(=O)[C@H](C)Cc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)cc1	763839204	ZROSXIRRDTUZOQ-CYBMUJFWSA-N	431.420	1.342	50	20	IDGD	
Cc1nc(Br)ccc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccccc1F	763858478	SVEGRYWZIJIMAX-SNVBAGLBSA-N	439.241	1.845	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)CCCC(=O)N2	763864230	HHGZBPBVFQFQAD-GFCCVEGCSA-N	428.420	1.654	50	20	IDGD	
CCn1cnnc1-c1cccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)c1	763873874	XORIDHKZYUAILA-ZDUSSCGKSA-N	440.435	1.658	50	20	IDGD	
COC(=O)c1sccc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccc(C(C)=O)cc1	763877465	KGNIOHDJRSFCEA-NSHDSACASA-N	433.442	1.291	50	20	IDGD	
CCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Br)s2)cc1	763939831	OHVZFYSSMAJMGZ-UHFFFAOYSA-N	439.291	1.660	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc4oc(N(C)C)nc4c3)n[nH]2)cc1	764112338	VZTSNIPNXHLYGA-UHFFFAOYSA-N	447.455	1.992	50	20	IDGD	
C[C@H]1CN(Cc2ccccc2NC(=O)C(=O)NNC(=O)CCc2ccco2)C[C@@H](C)O1	764176750	FRCFGFJBCBRKBK-IYBDPMFKSA-N	428.489	1.608	50	20	IDGD	
CC[C@H](C)NS(=O)(=O)c1cccc(NC(=O)C(=O)NNC(=O)CCc2ccccc2)c1	764186426	WVPJGQWVYYHUDS-HNNXBMFYSA-N	446.529	1.482	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(NC(=O)c3ccccc3)nc2)c1	764233668	CUOJXIGWLRJSMW-UHFFFAOYSA-N	428.408	1.605	50	20	IDGD	
Cc1cc(C)nc(Sc2ccc(NC(=O)C(=O)NNC(=O)Cc3cccnc3)cc2)n1	764267201	CJIAOCVVSWPVJG-UHFFFAOYSA-N	436.497	1.968	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)C(=O)Nc1ccnn1Cc1ccc(Cl)c(F)c1	764269094	VLYYFEWDYPLPDZ-UHFFFAOYSA-N	430.827	1.448	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2ccn(C3CCCC3)n2)CC1	764324763	YXHUXTMDMXXQBM-UHFFFAOYSA-N	433.538	1.086	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C(=O)Nc1cnn(CC(=O)NC2CCCC2)c1)c1ccccc1	764328939	UEZNKLXPRVVBOQ-SFHVURJKSA-N	440.504	1.222	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C(=O)Nc1ccc(C(=O)c2nccn2C)cc1)c1ccccc1	764330131	RIHCIWUUJCQMRB-SFHVURJKSA-N	433.468	1.931	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1	764397562	AELQEIIOIYHNME-AWEZNQCLSA-N	443.460	1.468	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1ccnn1Cc1ccc(C)o1	764398196	PNXFPIRQACRIBX-UHFFFAOYSA-N	443.485	1.720	50	20	IDGD	
Cn1c(N)c(C(=O)/C(C#N)=C/c2cc(Br)cc3c2OCC3)c(=O)n(C)c1=O	764883515	ACWAYIXBDIQQJK-VZUCSPMQSA-N	431.246	1.153	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)N[C@H]1CCO[C@@H](c2ccccc2)C1	765192127	FIBJGKVTWQMJSB-DOTOQJQBSA-N	431.518	1.844	50	20	IDGD	
COC(=O)NNC(=O)C(=O)Nc1ccc(F)cc1-c1nc(CCOc2ccccc2)no1	765374694	WLJCATZJMMFQTE-UHFFFAOYSA-N	443.391	1.823	50	20	IDGD	
CC(=O)c1c(C)[nH]c(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)c1C	766648537	HTCSZEQNKHWSOT-UHFFFAOYSA-N	425.489	1.053	50	20	IDGD	
Cc1cc(OCC(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc(C)c1Cl	767526435	ANPXTKDUMQAWNT-KRWDZBQOSA-N	448.859	1.866	50	20	IDGD	
COC(=O)c1[nH]c(C)c(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c1C	769036479	FQEHFLOQAWNMJW-UHFFFAOYSA-N	427.505	1.391	50	20	IDGD	
CN(C)C(=O)c1cccc(CNC(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)c1	770342492	RNKMHUCSONJSFV-UHFFFAOYSA-N	426.481	1.815	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)NCc3ccc(CS(C)(=O)=O)cc3)nc21	770352597	WTQOWNPVXXMWDB-UHFFFAOYSA-N	447.521	1.658	50	20	IDGD	
O=C(CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)NNC(=O)c1ccc2c(c1)OCCO2	770423992	DZEMFEMFASNKCP-UHFFFAOYSA-N	442.384	1.515	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)N[C@@H]1CCN(c2cccc(Br)c2)C1=O	772352261	ADJUTHABHMQJAS-OAHLLOKOSA-N	432.278	1.523	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cnc(Oc3ccccc3)cn2)c1	773179586	DNQLGWORQQMXHU-UHFFFAOYSA-N	441.469	1.594	50	20	IDGD	
COCCOc1ccc(Br)cc1NC(=O)C(=O)NNc1nc(C)cc(C)n1	773478245	NCOJTAKWSUTMMT-UHFFFAOYSA-N	438.282	1.963	50	20	IDGD	
COc1cc(C(=O)NNc2cccc(S(C)(=O)=O)c2)cc(Cl)c1OCC(N)=O	776528173	RRMDTXGMRBICFP-UHFFFAOYSA-N	427.866	1.373	50	20	IDGD	
CC(C)N1C(=O)C[C@H](C(=O)NNC(=O)N2CCOCC2)[C@@H]1c1ccc(Cl)c(F)c1	776704632	DIKGLSGPGILRMD-GUYCJALGSA-N	426.876	1.850	50	20	IDGD	
CCOC(=O)N1CCC[C@H]([C@@H](C)NC(=O)NNC(=O)c2cc(Br)c[nH]2)C1	776844081	DLLYUFFCDVOHLP-MNOVXSKESA-N	430.303	1.978	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CN2CCNC(=O)[C@H]2c2ccccc2Br)c1	777715571	CDPXLYYRKWICEL-GOSISDBHSA-N	445.317	1.692	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-]	778640456	LQFVQYOXUOJWLO-UHFFFAOYSA-N	425.854	1.613	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccccc1S(=O)(=O)NC1CC1)c1ccc2ccccc2n1	780363138	KTKIJNLGGVAZOB-UHFFFAOYSA-N	446.510	1.299	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)NCc2ccccc2CN2CC[C@@H](O)C2)c1	781957501	ZUYLXYRMEVXWFF-HXUWFJFHSA-N	426.517	1.779	50	20	IDGD	
CC(=O)N1CCN(c2cccc(NC(=O)C(=O)NNC(=O)c3c[nH]c4ccccc34)c2)CC1	782121690	SHDMOCGOAAJMHV-UHFFFAOYSA-N	448.483	1.236	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2c(F)cc(Cl)cc2F)nc1	783259201	WSCUQTKVFLKNGW-UHFFFAOYSA-N	447.851	1.782	50	20	IDGD	
COc1cccc(CC2CCN(C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)CC2)c1	784174202	MLHDWQYRTXEIOS-UHFFFAOYSA-N	435.488	1.980	50	20	IDGD	
Cc1nc(C)c(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)NC(C)(C)C)s1	784832921	GYDYCQIEQSBERU-UHFFFAOYSA-N	425.536	1.919	50	20	IDGD	
O=C(NNc1cc(F)c(F)cc1F)C(=O)Nc1cccc(N2CCS(=O)(=O)CC2)c1	784891187	HUSWFRLGVFTYJT-UHFFFAOYSA-N	442.419	1.421	50	20	IDGD	
COC(=O)CNC(=O)c1ccc(NC(=O)C(=O)NNc2nc3ccccc3cc2C)cc1	785154886	RVUVPPZQDUEYKT-UHFFFAOYSA-N	435.440	1.528	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)CCCC[C@@H]2SC[C@@H]3NC(=O)N[C@H]23)c1C	785300102	ZTTUUNFKJQFOAP-MRHSLFKSSA-N	434.562	1.944	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2cc(C(=O)NCC3CC3)ccc2C)c1	785988042	JLNBQZWZBKTEGW-UHFFFAOYSA-N	438.484	1.608	50	20	IDGD	
COCCc1ccccc1NC(=O)C(=O)NNC(=O)c1cc(OC)c(OC)c(OC)c1	786413992	JBPDMJHTKWVFPQ-UHFFFAOYSA-N	431.445	1.301	50	20	IDGD	
CCN(CC)Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1	787889720	QUKDGLKFONNOKJ-UHFFFAOYSA-N	426.473	1.699	50	20	IDGD	
C[C@@H](NC(=O)c1ccc(Br)s1)C(=O)NNc1ccc(-n2ccnc2)nn1	788175548	UTHCAUVZAKWFNV-SECBINFHSA-N	436.295	1.748	50	20	IDGD	
NS(=O)(=O)c1ccccc1NNC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccccc1	788230552	PTSFVKQMKYEJLY-INIZCTEOSA-N	438.531	1.021	50	20	IDGD	
Nc1nc(Cl)cc(NNC(=O)Nc2cc(C3CC3)nn2[C@H]2CCS(=O)(=O)C2)n1	789132792	IAALLKVEPVGDNQ-VIFPVBQESA-N	426.890	1.294	50	20	IDGD	
CC(C)c1csc(NC(=O)C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)n1	789731716	GLQMFLSDEJGXRG-UHFFFAOYSA-N	442.501	1.957	50	20	IDGD	
C[C@H](c1cccc(N2CCOC2=O)c1)N(C)C(=O)NNC(=O)CNC(=O)c1cccs1	789839712	LGTULUUPMVCVNA-CYBMUJFWSA-N	445.501	1.868	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)[C@@H]1COCCN1C1CCCC1	790065326	LXBYPXCDFWBFTB-INIZCTEOSA-N	426.311	1.619	50	20	IDGD	
CCc1nn(C)c(CC)c1CC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	790109611	FSHUZMSDBCXNJE-UHFFFAOYSA-N	426.565	1.447	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)Cn2ccc3ccccc3c2=O)c2ccccc2c1=O	790461015	BTGYOZASJRKEKJ-UHFFFAOYSA-N	431.452	1.754	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)N[C@H]2CCN(Cc3ccc(F)cc3)C2=O)cc1C	790673040	OOAVLAWOEYKLTB-SFHVURJKSA-N	441.463	1.513	50	20	IDGD	
CSSCCNC(=O)CCn1c(=O)oc2cc(S(=O)(=O)N3CCCC3)ccc21	791113430	ILHTXSIQPYKFAP-UHFFFAOYSA-N	445.588	1.897	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1c[nH]c2ncc(Br)cc12	792142991	WPWUPFOZDKGQDQ-UHFFFAOYSA-N	444.293	1.793	50	20	IDGD	
O=C(NNc1cccc(F)c1[N+](=O)[O-])C(=O)Nc1cccc(N2C(=O)CCCC2=O)c1	792368008	JQRDFEVQZKNNBM-UHFFFAOYSA-N	429.364	1.859	50	20	IDGD	
O=C(NNc1c(F)cc(C(=O)NC2CC2)cc1F)C(=O)Nc1cnc(CC2CC2)nc1	793050379	ONBJALPARTVPOY-UHFFFAOYSA-N	430.415	1.681	50	20	IDGD	
COCc1cc(C(=O)OC)cc(S(=O)(=O)NNC(=O)c2ccc(Cl)cc2O)c1	793366606	CRBNNAPSZZAWHF-UHFFFAOYSA-N	428.850	1.602	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)c2cc(C3CC3)nc3c2c(O)nc(=O)n3CC(C)C)n1	794090690	XRVFMDXGEVJQMP-UHFFFAOYSA-N	436.472	1.809	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@@H](O)c2cccc(C(F)(F)F)c2)c2ccccc2c1=O	794774081	CFNXRHYBQDMYBF-INIZCTEOSA-N	434.374	1.930	50	20	IDGD	
Cc1ccc2c(c1)CC[C@H](C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1)O2	795109698	PLKDJSCVZOFDGU-GOSISDBHSA-N	445.545	1.163	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(C)(C)[C@@H]1C(=O)OCC(=O)NNC(=O)c1cccc(C#N)c1	796222526	PYIJILHZHZLDGZ-INIZCTEOSA-N	430.461	1.508	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNC(=O)C(=O)Nc1cccc(C(F)(F)F)n1	797369417	VRXKRXVXNBFVSA-UHFFFAOYSA-N	439.350	1.113	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNS(=O)(=O)c2ccc(C#N)s2)CC1	797816019	CDIWDXLYPDRFJE-UHFFFAOYSA-N	429.524	1.512	50	20	IDGD	
C=CCNC(=S)NNC(=O)c1cc(S(=O)(=O)Nc2ccccc2OC)ccc1O	798305588	WAWYJFNITRDRCZ-UHFFFAOYSA-N	436.515	1.497	50	20	IDGD	
CC(C)C[C@@H](/N=C1/NS(=O)(=O)c2ccccc21)C(=O)NNC(=O)Nc1ccccc1	801992346	JXIIZCHGUDMEAY-MRXNPFEDSA-N	429.502	1.993	50	20	IDGD	
Cc1cc(Br)c(C(=O)NNC(=O)CNC(=O)c2cccnc2)cc1Cl	805190241	CHAZUPCYOKJZHE-UHFFFAOYSA-N	425.670	1.997	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)C(=O)Nc1cccc(-c2ncc3n2CCCC3)c1	807429140	MIFUJBFLJUSGGQ-UHFFFAOYSA-N	443.471	1.944	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)NC1C[C@@H]2CC[C@H](C1)N2CC(=O)N(C)C	807515189	ZQAMGMMXAWSGGL-WZYMTQMTSA-N	435.500	1.007	50	20	IDGD	
CNC(=O)c1cc(Oc2ccc(NC(=O)C(=O)NNC(=O)c3ccc[nH]3)cc2F)ccn1	810384951	SMYVTQUVQULUMR-UHFFFAOYSA-N	440.391	1.100	50	20	IDGD	
Cn1c(=O)c2c(ncn2CC(=O)NN=Cc2c[nH]c3ccc(C(C)(C)C)cc23)n(C)c1=O	811645863	YIMIFIJVVQSVJX-UHFFFAOYSA-N	435.488	1.363	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)CCC(=O)N2CCC(c3ccccc3)=N2)cc1	812732339	BDMQYRQVIJITPF-UHFFFAOYSA-N	443.529	1.797	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)Nc1cccc(N2C(=O)N[C@@](C)(C3CC3)C2=O)c1	812985940	KSINGFRBOLKUFP-YUNKPMOVSA-N	433.465	1.116	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)n(-c2ccccc2)n1	813033079	DNVIJEZVCZAQOY-UHFFFAOYSA-N	442.501	1.513	50	20	IDGD	
CC(C)C[C@@H](C)n1nccc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	813033395	RDBCYJZJQFKYES-CQSZACIVSA-N	436.538	1.822	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)[C@@H]1CCCN(c2ccccc2)C1=O	814361822	GBAWUWZQPXJKPS-QFIPXVFZSA-N	449.555	1.789	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2nnn(Cc3ccccc3F)c2C)c(O)c1	815568747	SHTQWERMKVCDSY-UHFFFAOYSA-N	426.408	1.188	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)CCc2ccccc2O)cc1)[C@@H]1C[C@@H]1C	815569185	KAHKRTKZQFULTK-IFXJQAMLSA-N	438.484	1.872	50	20	IDGD	
CCCc1nc(C)c(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)N(C)C)s1	815751562	FDXYUVOZOUERPZ-UHFFFAOYSA-N	425.536	1.736	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2CCO[C@H](c3ccccc3)O2)c1	816810229	DXHDVFNWZDFUPO-PXNSSMCTSA-N	433.486	1.202	50	20	IDGD	
COC(=O)NNC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(Br)s2)C1	822760718	REFVMLCPFDYCIU-MRVPVSSYSA-N	426.314	1.299	50	20	IDGD	
CC[C@@H](C)NS(=O)(=O)c1ccc(C(=O)NNC(=O)CNc2ccccc2OC)cc1	825649405	QAFMBZFGVPBSAI-CQSZACIVSA-N	434.518	1.645	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2CCN(C(C)C)C[C@H]2c2cnn(C)c2)cc1C	849485548	GXBFOLAKGOFJFB-UXHICEINSA-N	440.548	1.637	50	20	IDGD	
CCOc1ccc(NS(=O)(=O)c2ccc(C)c(C(=O)N3CC[C@H](B(O)O)C3)c2)cc1	864234630	YBKWFWJRLCITSA-HNNXBMFYSA-N	432.307	1.883	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNS(=O)(=O)c3ccc(S(C)(=O)=O)cc3)cc2C1	874076187	AOPGZWHFGUTWSC-NSHDSACASA-N	428.557	1.900	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)Cc2ccc(C(=O)NN=C3CCS(=O)(=O)C3)cc2)cc1	912781163	VRGNVGPIYIEZOQ-UHFFFAOYSA-N	449.554	1.720	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)c1cccc(S(=O)(=O)NCCOC)c1	913465536	LKCQEDSNKNTEKU-UHFFFAOYSA-N	435.502	1.014	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)c1cccc(S(=O)(=O)NC2CCCC2)c1	913476977	XILJGGYHNRQKBS-UHFFFAOYSA-N	446.529	1.789	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)[C@@H]1CC(=O)N(c2ccccc2)C1	914988986	LIZVJQBHCWJMKS-CYBMUJFWSA-N	445.859	1.706	50	20	IDGD	
Cc1ccc(-c2nc(C(=O)OCC(=O)NNC(=O)[C@H]3COc4ccccc4O3)cs2)o1	915255594	UBWDXAZBVJDBFS-MRXNPFEDSA-N	443.437	1.856	50	20	IDGD	
Cc1ccc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1	915888501	OAPUIJCNMMHJIL-UHFFFAOYSA-N	432.502	1.160	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NC[C@@H](c1cccs1)N1CCN(C)CC1	915902135	QDPQVNRVFYDFGZ-QAPCUYQASA-N	449.552	1.974	50	20	IDGD	
CCN(CCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)c1ccccc1	916197948	BVXODGPLYQLJPJ-UHFFFAOYSA-N	447.561	1.798	50	20	IDGD	
COc1cc(CNC(=O)NN[C@@]2(C)CCS(=O)(=O)C2)ccc1OCC(F)(F)F	916389473	YFYVPTCEPCHONH-HNNXBMFYSA-N	425.429	1.517	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NC[C@@H](c1ccsc1)N(C)C	916450023	XJSLKUVVBHCJQP-AWEZNQCLSA-N	438.579	1.597	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NCCN2CCC[C@H](C)C2)c2ccccc2c1=O	916452486	MUNQKKPIYNITLA-INIZCTEOSA-N	428.537	1.873	50	20	IDGD	
COc1ccnc(NNC(=O)NCc2ccc(S(=O)(=O)N3CCC[C@H](C)C3)cc2)n1	918228114	LKXHAIVQYLSTEZ-AWEZNQCLSA-N	434.522	1.732	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)ccc1N1CCNC1=O	919690996	YBKITNORRSDQRS-UHFFFAOYSA-N	444.517	1.201	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)CCNC(=O)c1ccc(Br)cc1	919820243	QHTJONLAHGOUOQ-UHFFFAOYSA-N	434.290	1.968	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)NC[C@@H](c2ccc(C)o2)N2CCOCC2)cc1	919899841	WPPFOPBPGBKMLD-IBGZPJMESA-N	430.505	1.933	50	20	IDGD	
C[C@@]1(NNC(=O)NC[C@H]2CCN(c3cccc(Br)c3)C2)CCS(=O)(=O)C1	920049165	RJINZYCHOKXTLB-CXAGYDPISA-N	445.383	1.656	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)Nc1nc(CN2CCOCC2)cs1	920928564	QIWKACFIJBMLRT-UHFFFAOYSA-N	429.462	1.091	50	20	IDGD	
CNC(=O)Cc1ccccc1NC(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	1116736015	KHCGTBBVPZPBKX-UHFFFAOYSA-N	448.524	1.616	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@H]2CCOC2)c1	1318058380	VLXRDQKUVCYEQN-CQSZACIVSA-N	448.501	1.477	50	20	IDGD	
Cc1cc(C)nc(SCc2ccc(C(=O)NNC(=O)c3ccc(C(N)=O)nc3)cc2)n1	1318073443	GVGCVEFIUVSBEY-UHFFFAOYSA-N	436.497	1.954	50	20	IDGD	
Cn1c(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](O)CCl)C3)cc2ccccc21	1778419120	WNJCYTXXXNEEKG-WOIUINJBSA-N	433.936	1.906	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnn3ncccc13)C2	1779543782	QAIMPMNDZVTQIW-WIYYLYMNSA-N	445.596	1.708	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H]3CC=CCC3)C2)C1	1781153258	DXYLYYYRDANWEX-HRJSYZDASA-N	427.505	1.307	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(-c4cc[nH]n4)cc3)C2)C1	1781882476	FBEQSYAJZMEZSQ-UWJYYQICSA-N	432.908	1.774	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)CC(N)=O)C2	1781897137	CVINIAUMVPRGQZ-UHQDVWGKSA-N	432.359	1.185	50	20	IDGD	
C=CC(=O)N[C@@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](Br)CC)C1	1781901329	KUXIHDQDDDNLSS-XTDOFWJNSA-N	444.370	1.365	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C1CCC(CO)CC1)C2	1782171817	GVKOIURDXZEFMU-HVYUGYKRSA-N	430.973	1.553	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)n2cc(C)cn2)C1	1782515099	DNJLFXIEZFKKMP-MIALQEHNSA-N	426.945	1.520	50	20	IDGD	
O=C(c1cn[nH]c1)N1CCO[C@@]2(CCN(C(=O)[C@@H](Br)Cc3ccccc3)C2)C1	1783022563	JYVXPVGESFTHPT-FXAWDEMLSA-N	447.333	1.859	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(OC)cn3)CCO2)C1	1783347980	QZANVRKUCDKQJH-KDOFPFPSSA-N	426.311	1.707	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@@H](C(=O)N2CC[C@@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)C1	1783863865	NIMIPDXUDJZILC-CBGDNZLLSA-N	440.613	1.647	50	20	IDGD	
Cc1cnn([C@H](C)C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]3C2)c1	1783973518	BVRBLURKTBMZTC-NRKLIOEPSA-N	441.370	1.763	50	20	IDGD	
C[C@H](Nc1cnccn1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCBr)[C@H]2C1	1786406037	FDICRUUOECXNIQ-AJNGGQMLSA-N	440.342	1.042	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](N)c3ccccn3)[C@H]2C1	1786866488	QVSIJXKPNPZMQW-HZRXROBNSA-N	439.354	1.092	50	20	IDGD	
O=C(CCc1cncnc1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21	1787043766	RENDRZVDSWORRO-RZLSGREXSA-N	429.290	1.079	50	20	IDGD	
CCn1nc(C)cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)Br)C[C@@H]21	1787290781	ZTSBPILYHGOUKZ-HOSILWTGSA-N	427.343	1.588	50	20	IDGD	
COC(=O)c1ccc(OCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]3C2)cc1	1787451255	CWOOXOWAXAYGRM-MBGYTDRXSA-N	442.871	1.366	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4c(cnn4C)c3)[C@H]2C1	1788062431	MZGAKWYSMDBXNM-GKEYINFOSA-N	449.349	1.950	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C=N/N3CCCCC3)[C@H]2C1	1788603767	RPXHJEUHFFQONS-CKCGSTQVSA-N	443.386	1.611	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nnsc3C3CC3)C[C@@H]21	1788762709	OYIVBOSCVVIYFC-KKUMJFAQSA-N	438.626	1.860	50	20	IDGD	
CCN(CC)C[C@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21	1790604399	SDIVWVCSQALKNF-QXKUPLGCSA-N	436.366	1.635	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc(OCF)cn3)C[C@@H]21	1791056776	ARKCCOJNIOTETA-MNXVOIDGSA-N	445.289	1.159	50	20	IDGD	
O=C(NC1(c2ccc(NC(=O)[C@@H]3[C@@H]4C=CS[C@@H]34)cc2)CCC1)c1ccc(B(O)O)cc1	1791087012	JMKRLGNCTAUHSV-XUVXKRRUSA-N	434.326	1.989	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(Cl)cnc1O	1792386508	VFJYVQHLIUKCFO-DYNIEEOBSA-N	446.729	1.675	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COCc1ccccc1)C2	1792868390	XVKAGDRQAVVAKW-RMRDIRSESA-N	439.350	1.824	50	20	IDGD	
COc1cc(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](O)CCl)cc(OC)c1OC	1793106685	GXWIUHRPWKTISM-QKPAOTATSA-N	440.924	1.493	50	20	IDGD	
CN(CCCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCl)C(=O)OC(C)(C)C	1793117473	NYDBGGBYXRNJQZ-FZKCQIBNSA-N	431.961	1.871	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COc1ccc(O)cc1)C2	1795113262	RZQILVQCXXTWHE-IVWMJMPLSA-N	427.295	1.146	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCBr	1795117072	LQKIZEIUPXXOQC-JRBZFYFNSA-N	443.338	1.116	50	20	IDGD	
N[C@@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1cccc(Cl)c1	1795628572	TYNCGMUMFYMXES-BJBXXJATSA-N	448.720	1.620	50	20	IDGD	
COc1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)cc1Cl	1796190506	GNBVSCSPJDTYOE-BCDXTJNWSA-N	442.708	1.594	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)c1csc2c1CCCO2	1796190986	LWPYQOTUBGWUCM-BJWYYQGGSA-N	440.330	1.319	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccccc1C)C2	1796441646	NFPYSWIBYDHMTJ-KLQCHYFMSA-N	437.500	1.332	50	20	IDGD	
COC(=O)c1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@](C)(Cl)CCl)C3)cn1	1796563822	IMXRAUNUIQJAER-QPWUGHHJSA-N	444.315	1.308	50	20	IDGD	
CC(C)(C)OC(=O)N1CCOC[C@H]1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](F)Cl	1796809030	MJAJVHBZRVMBIL-AICCOOGYSA-N	433.908	1.795	50	20	IDGD	
C[C@H]1CCc2c(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@@H](C)Br)C4)n[nH]c21	1796973435	CQXZWQLCDKPIPX-NQUGEPOWSA-N	425.327	1.446	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1Cc2ccccc2O1	1797226723	HFMXMQPTDCQTOS-AENLNBOZSA-N	427.328	1.816	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccc(NC(C)=O)cc1	1797233160	NVDHPUHBPBONOE-YNVMFWSZSA-N	437.924	1.031	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H]1C[C@H]1c1ccccc1)C2	1798443500	CJXZCAGDZITJJP-SQIBXOBRSA-N	433.512	1.741	50	20	IDGD	
C=CC[C@H](C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O	1798522976	KWBOLICUMKXXMZ-NTNQKNOYSA-N	445.472	1.936	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3nonc3c1)C2)[C@@H](F)Br	1799346860	CUCDSARKMLUBOR-RDBQEKCUSA-N	427.230	1.117	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cn1cnc3ccccc31)C2)[C@@H](F)Br	1799347153	KXXOWSOHMCJZBX-CZAMWMTLSA-N	439.285	1.316	50	20	IDGD	
N#Cc1ccc(F)c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Br)c1	1799348690	MVWOQTGLQJPRLP-JLUCKKNBSA-N	428.233	1.591	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2cccnn2c1	1800008707	BCAWPCUPXFUAMG-MVWRLGRASA-N	425.316	1.774	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2)c1cnc2ccc(F)cn12	1800058994	ZNZHKSXIZILRKX-DPIQGUFMSA-N	439.285	1.462	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1ccc(F)nc1)C2	1800756376	CBOFFILFLHYUSJ-MBMVNNNZSA-N	428.302	1.526	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C[C@@H]1OCCc3ccccc31)C2	1800971445	YZWUYAHDTBFDNN-KVNUXVDHSA-N	436.936	1.534	50	20	IDGD	
NC(=O)NCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](Br)Cc1ccccc1	1801572023	GFSDVLXPXVFESR-FZKCQIBNSA-N	437.338	1.299	50	20	IDGD	
COCCOCCOCCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@](C)(Cl)CCl)C2	1802086189	SNDXMNCLIYULHY-YYAJDYIMSA-N	439.380	1.931	50	20	IDGD	
CC(C)(CCl)C(=O)NC[C@H]1CCN(C(=O)CCc2nc(N)n[nH]2)[C@@H]1c1cccnc1	1802901069	LZZLHQVDZPMFJV-RHSMWYFYSA-N	433.944	1.686	50	20	IDGD	
COc1cc(C(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)ccc1O	1803142369	YZAZRDCFRRYSPZ-SUMDDJOVSA-N	433.892	1.715	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2cncs2)[C@H]1c1cccnc1	1805977194	PSXNDKVNMZDYKE-HNAYVOBHSA-N	430.534	1.231	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H](CNC(=O)CN2CCNC2=N)[C@H]1c1cccnc1	1807119729	ZVTVHIIQXDFWCX-OGWOLHLISA-N	441.363	1.164	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)Cn2cc(C)c(O)nc2=O)[C@H]1c1cccnc1	1808285721	SNOCZMHTKXJFDH-RYRKJORJSA-N	447.923	1.376	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)C#CC2CC2)[C@H]1c1cccnc1	1808408437	IPEOUTCMGZIXFJ-HAXQJHAESA-N	446.511	1.635	50	20	IDGD	
O=C(CCBr)N1CCCC2(CCN(C(=O)c3n[nH]cc3[N+](=O)[O-])CC2)C1	1809067310	WZXPYIKOTJDZOQ-UHFFFAOYSA-N	428.287	1.948	50	20	IDGD	
Cc1c[nH]cc1C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1	1810301940	DYPSUDSADNXTRV-OXJNMPFZSA-N	447.499	1.350	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)c1ccn(C(F)F)n1	1810904722	FXFLSYPWKLHQMQ-AEGPPILISA-N	427.839	1.593	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)C2=NNC(=O)C2)[C@@H]1c1cccnc1	1812776630	TYPYVJOFKFSCCO-DVOMOZLQSA-N	436.310	1.137	50	20	IDGD	
CCOc1cnc(C(=O)N2CC[C@H](CNC(=O)[C@H](Cl)COC)[C@H]2c2cccnc2)cn1	1813029740	VNTUEXHGORQORI-GPMSIDNRSA-N	447.923	1.844	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2cccc(F)n2)[C@@H]1c1cccnc1	1813074230	RKZVYYWIGBIHMB-HRAATJIYSA-N	442.495	1.308	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)CNC(=O)OC)[C@H]1c1cccnc1	1813270090	YYVIDIMPQUUIEQ-OFQRWUPVSA-N	441.326	1.617	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](N)CN)sc2C1	1817075044	RNPIWFMBLYTVGJ-QPAPFBILSA-N	446.483	1.226	50	20	IDGD	
Cc1cc(C)nc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)c1	1817471178	FQJJSNBUDVIKCU-FQEVSTJZSA-N	447.304	1.721	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)CCBr)[nH]n1)c1cnc(O)nc1O	1818019723	ODVZZNXJYUIDOC-LLVKDONJSA-N	439.270	1.702	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc(F)nc2)n[nH]1	1819695939	FUEJPBJCEIXQCI-HNNXBMFYSA-N	431.472	1.623	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)C(=O)Nc3cccnc3)sc2C1	1820052619	UKYLSCDVPLHZAC-ZYHUDNBSSA-N	437.909	1.343	50	20	IDGD	
Cc1nc(C(=O)N[C@H]2CCc3nc(NC(=O)CO[Si](C)(C)C)sc3C2)c(=O)[nH]c1C	1820160929	KMXWIIIMIAAJOE-LBPRGKRZSA-N	449.609	1.921	50	20	IDGD	
C[C@H](Br)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](C)n2cnnn2)[nH]n1	1822192727	VWHJGVXFZVKCPM-UMNHJUIQSA-N	425.291	1.433	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)C[C@](C)(O)CC(=O)O)[nH]n1	1822374111	DHRNEIMFDTWFIS-FNFWKMNBSA-N	430.889	1.271	50	20	IDGD	
CC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](C)N1CCN(C)CC1)CC2	1822849037	FPSYFAQXXJMBAC-BFHYXJOUSA-N	428.002	1.708	50	20	IDGD	
C[C@@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1ccccn1	1822898969	SRLITIVVUUXFGA-QRWLVFNGSA-N	447.304	1.594	50	20	IDGD	
Cc1nscc1C(=O)N[C@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1	1826080521	PELQZYQHEQVLRR-NSHDSACASA-N	436.563	1.507	50	20	IDGD	
O=C([C@H]1CCCS1(=O)=O)N1CCC([C@H]2CCCCN2C(=O)CCBr)CC1	1826359786	OMVHEDWBZIFEHQ-HZPDHXFCSA-N	449.411	1.968	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)CCn3ccnn3)sc2C1	1826879338	MZOGPDNYWDICAM-NXEZZACHSA-N	427.328	1.520	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@H](O)CCl)CC3)cc1	1827726343	CVPIIIULFSBOHL-DZGCQCFKSA-N	436.921	1.927	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)c2ncccc2F)CC1	1829459000	OATDUONYJMBDJF-HXUWFJFHSA-N	439.296	1.448	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc([N+](=O)[O-])o3)CCO2)C1	1829490442	VMQWYWCVVUTPES-ZBEGNZNMSA-N	446.254	1.041	50	20	IDGD	
CC(C)(C)c1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)cn1	1829569304	AILOCDRCSZQTBG-OXQOHEQNSA-N	427.904	1.984	50	20	IDGD	
CCNC(=S)NCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H](C)Br)CC1	1831092695	AJHPHHUAEFUBPU-UKRRQHHQSA-N	447.443	1.874	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)c1ccccc1)CCO2	1832232276	OQZQWLJKNMZLRC-URLQWDBASA-N	443.313	1.937	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)[C@@H]3CC=CCC3)CC2)CC1	1833271433	DTPIAALQBUTHNN-GOSISDBHSA-N	433.597	1.287	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cc4cccnc4[nH]3)CC2)CC1)[C@@H](O)CCl	1833309824	AJXQTGQEKXIMOE-SFHVURJKSA-N	433.940	1.348	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cc(C(F)F)no3)CC2)CC1)[C@@H](O)CCl	1833310889	XRUDYSWVFZLDAJ-AWEZNQCLSA-N	434.871	1.397	50	20	IDGD	
Cc1nc(C)c(C(=O)N2CCOC[C@@]3(CN(C(=O)CCBr)CCO3)C2)o1	1834823118	JPEUUCMPKLWQLP-QGZVFWFLSA-N	430.299	1.146	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cnn4c3OCCC4)CC2)CC1)[C@H](F)Cl	1835081097	HNXDFUVCHSCSHG-INIZCTEOSA-N	427.908	1.385	50	20	IDGD	
COc1nccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)c1F	1836232760	CQAHHICGYSLEDS-FQEVSTJZSA-N	443.903	1.564	50	20	IDGD	
CC(C)N1CCC[C@H]1C(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836720588	XOMMJAPWRGYRCQ-OALUTQOASA-N	429.989	1.458	50	20	IDGD	
N#Cc1cccc(C(=O)N2CCO[C@]3(COCCN(C(=O)CCBr)C3)C2)c1	1838906669	YDRNIUIVEWBVLI-IBGZPJMESA-N	436.306	1.413	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(F)ccc3OC)C2)C1	1839148591	CZEXVCJGCAGJJE-OXJNMPFZSA-N	428.888	1.922	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)cn1	1839151326	NVSOXJSBHTZBBP-RBUKOAKNSA-N	430.332	1.696	50	20	IDGD	
COc1cc(C)ccc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840190808	OIXLHVGMHOREKS-LJQANCHMSA-N	431.316	1.877	50	20	IDGD	
C[C@@H](Cn1ccnc1)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1840428699	SXDIDXVSSQCNGS-JXFKEZNVSA-N	426.945	1.241	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)COc2cccc3ccccc23)C1	1841882683	ONSUEAMMFCILTD-UHFFFAOYSA-N	438.528	1.795	50	20	IDGD	
Cc1noc(N)c1C(=O)N1CC2(CCCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C1	1841924547	YMFNJNJVDRKZBE-LBPRGKRZSA-N	441.916	1.514	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)N1CCCC12CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1843424393	NOXZUALEFNPZDX-HIFRSBDPSA-N	444.960	1.189	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)[C@@H]2CCc3cccc(Cl)c32)C1	1845865531	PAIRHPPRFMESOG-GOSISDBHSA-N	438.720	1.567	50	20	IDGD	
O=C(c1cn2ccc(C(F)(F)F)cc2n1)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl	1847561725	DISPOZIBHVMIHK-IHRRRGAJSA-N	430.814	1.768	50	20	IDGD	
Cn1ncc(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](F)Br)c1C(F)(F)F	1848304624	QTTMVDBWJJTVBI-ATZCPNFKSA-N	427.196	1.945	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)C[C@@H](NC(C)=O)c2cccs2)c2ccccc2c1=O	11148177	FZINDRDZICPNFE-MRXNPFEDSA-N	441.513	1.897	50	20	IDGD	
Cn1c(=O)c2ccccc2n2c(SCC(=O)NNC(=O)c3ccc(Cl)cc3)nnc12	16321360	KLBTVZRBAFFWGS-UHFFFAOYSA-N	442.888	1.788	50	20	IDGD	
CSc1nc2nc(C)c(CC(=O)NNC(=O)Cc3nc4ccccc4n3C)c(C)n2n1	26538571	YGMHZEUBMWTWOM-UHFFFAOYSA-N	438.517	1.282	50	20	IDGD	
CC(=O)c1cccc(O[C@@H](C)C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1	109375348	QHSCFDPVUQXTFQ-AWEZNQCLSA-N	433.486	1.368	50	20	IDGD	
CCc1ccccc1-n1cnnc1SCC(=O)NNC(=O)CNC(=O)c1ccco1	725740939	LEPZSJSEECRZBZ-UHFFFAOYSA-N	428.474	1.092	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)NCc1cccc(C(=O)NCc2ccco2)c1	726102497	VOUVFTCGJJERJU-UHFFFAOYSA-N	439.428	1.063	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)CCCc2ccccc2)cc1	727716884	JGCOFOJXVPVDJZ-UHFFFAOYSA-N	446.529	1.436	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)[C@H]1CCCN1c1ncnc2sccc12	728600787	SWWBVRWRPMJEEC-OAHLLOKOSA-N	426.502	1.928	50	20	IDGD	
Cc1cc([N+](=O)[O-])cc(S(=O)(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1C	728855888	DTTATGVMEJEONN-UHFFFAOYSA-N	434.478	1.228	50	20	IDGD	
CC[C@@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)c1nc(C)cs1	729623935	NYGFRZFHTDTRKZ-CQSZACIVSA-N	425.536	1.797	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)[C@H]1COc2ccccc2O1)N1CCN(c2ccc(F)cc2)CC1	731865407	DNJXLTNRTZWQRF-MGPUTAFESA-N	428.464	1.324	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCCN2C(=O)CSC2=O)cc1Br	732243787	UDDRYICOEFGRMI-UHFFFAOYSA-N	431.268	1.097	50	20	IDGD	
Cc1nc(CN2CCC(CNC(=O)NNC(=O)COc3ccc(C#N)cc3)CC2)oc1C	732475575	JSNZKKSCNLJUGG-UHFFFAOYSA-N	440.504	1.785	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)N[C@H]2CCN(c3ccccc3C(N)=O)C2)cc1	732575422	AUYXMUOUTMZMQJ-INIZCTEOSA-N	425.489	1.336	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)c1cc(=O)c2cc(Br)ccc2[nH]1	732959601	GIODDMRJZDOGEZ-UHFFFAOYSA-N	432.230	1.836	50	20	IDGD	
CS(=O)(=O)Nc1ccc(CNC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1	733339609	OJVJOBYMWRQIRA-UHFFFAOYSA-N	428.474	1.388	50	20	IDGD	
COCCCNC(=O)NNC(=O)[C@@H]1CCC(=O)N(C)[C@H]1c1ccc(C(F)(F)F)cc1	734427107	AQXRWAMBSWETDC-ZBFHGGJFSA-N	430.427	1.982	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)c(C)c1	734807341	LPLUNSMMGSBPLZ-UHFFFAOYSA-N	442.538	1.896	50	20	IDGD	
CC[C@@H](Cc1ccccc1)C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	735117906	IMQKLKFQDJCYFH-SFHVURJKSA-N	431.562	1.730	50	20	IDGD	
CCOC(=O)N1[C@H](C(=O)NNC(=O)CNC(=O)c2cccs2)CC[C@@H]1c1ccc(C)o1	736482999	WNMYAAPWRVHCGQ-KGLIPLIRSA-N	448.501	1.889	50	20	IDGD	
CC(=NNC(=O)Cc1csc(N2CCOCC2)n1)c1ccc(S(C)(=O)=O)c(F)c1	741759866	QFIWLAOKQWAQCF-UHFFFAOYSA-N	440.522	1.605	50	20	IDGD	
COc1cc(NC(=O)NNC(=S)NCCCN2CCOCC2)c(OC)cc1Cl	741854588	QJMIMUYVNHHIIX-UHFFFAOYSA-N	431.946	1.580	50	20	IDGD	
CC(=O)N[C@H](Cc1c[nH]c2ccc(Br)cc12)C(=O)NNC(=O)c1ccncc1	742031568	LCIYEIKJEFFWEZ-QGZVFWFLSA-N	444.289	1.834	50	20	IDGD	
CC(=O)Nc1cc(F)c(S(=O)(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)cc1Cl	743268323	LQVKKZRKKAKMIS-UHFFFAOYSA-N	446.800	1.675	50	20	IDGD	
Cc1cc2c(cc1C)O[C@@H](C(=O)NNc1ccc(S(=O)(=O)N3CCN(C)CC3)cc1)C2	743334869	OBKPPXYESMELAA-OAQYLSRUSA-N	444.557	1.686	50	20	IDGD	
CCc1nncn1CCNC(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1	743573531	CZSUTNUUVPSVPY-OAQYLSRUSA-N	447.543	1.798	50	20	IDGD	
C[C@H](CN1CCN(c2ccccn2)CC1)NC(=O)NNC(=O)Nc1ccc(N(C)C)cc1	743618792	KZRRVXIURBLHBL-QGZVFWFLSA-N	440.552	1.694	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CN2CCN(C(=O)Cc3ccccc3Cl)CC2)c1	744391563	ZIHWTSCPJMFKLD-UHFFFAOYSA-N	439.903	1.360	50	20	IDGD	
COc1ccc(Cn2cc(C(=O)OCC(=O)NNC(=O)c3ccc(C#N)cc3)cn2)cc1	745002539	YWWRXFVCHDZOJI-UHFFFAOYSA-N	433.424	1.430	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2ccc(OC3CCOCC3)cc2)n1	745256057	SMZXYQJQCAIEIU-UHFFFAOYSA-N	433.486	1.556	50	20	IDGD	
Nc1ccc(C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1Br	745463593	PTDGHLGNVSJUFV-UHFFFAOYSA-N	437.206	1.558	50	20	IDGD	
COc1cc(/C=C/C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc(OC)c1O	745513036	PVAKQBIVJCUZKD-VOTSOKGWSA-N	445.384	1.335	50	20	IDGD	
NC(=O)[C@@H]1CCCN(CCCNC(=O)NNc2c(F)cc(F)cc2Br)C1	745831217	UHRDDFWRPNJWDE-SNVBAGLBSA-N	434.285	1.941	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)NCCOc1ncccc1F	746795649	KYHZGNCZICQGBE-UHFFFAOYSA-N	427.230	1.771	50	20	IDGD	
COC(=O)CCc1c(C)nn(-c2ccc(C(=O)NNC(=O)Cc3ccncc3)cc2)c1C	747324072	YKDLQKWPKTXDTA-UHFFFAOYSA-N	435.484	1.993	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)c1cccc(CN2CCS(=O)(=O)CC2)c1	747337406	QRFBPYMNLGCUJC-HNNXBMFYSA-N	449.504	1.285	50	20	IDGD	
O=C(CCCNS(=O)(=O)c1cccc(C(F)(F)F)c1)NNC(=O)Cc1ccncc1	747428769	FPZFQEGCKSOTFZ-UHFFFAOYSA-N	444.435	1.549	50	20	IDGD	
Cc1nc(Cl)cc(NNC(=O)c2ccc(S(=O)(=O)NC[C@@H]3CCCO3)cc2)n1	747979394	DDBJPADFNDIRGJ-ZDUSSCGKSA-N	425.898	1.653	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCC(=O)NNc2cccc([N+](=O)[O-])c2)cc1OCC	747995809	XKMRBWRVEQEVDH-UHFFFAOYSA-N	438.462	1.814	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2c(F)c(F)cc(F)c2F)cc1	748516277	AYSZFACIXLOGCW-UHFFFAOYSA-N	433.383	1.633	50	20	IDGD	
CCS(=O)(=O)N1CCC[C@H](C(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)C1	748520354	ODNNWGQQGMWNCG-NSHDSACASA-N	443.469	1.485	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1	748619614	TYBBWMZKXLCDTF-QLFBSQMISA-N	426.489	1.321	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3cc(-c4ccco4)on3)cc2)CC1	748621276	ZMRWRASSEDVDMQ-UHFFFAOYSA-N	431.474	1.628	50	20	IDGD	
O=C(O)COc1ccc(S(=O)(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1Cl	748689576	MHPIJCWSBUOMDG-UHFFFAOYSA-N	429.794	1.335	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)[C@@H]2CCCN2C(=O)c2ccc3c(c2)OCO3)c1	749562134	MRDBLQXRZBMPLZ-KRWDZBQOSA-N	439.468	1.863	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)C(=O)Nc2ccc(Cl)cc2)cc1	751200322	MJEZYZZOXYVAHV-UHFFFAOYSA-N	438.893	1.055	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)[C@@H]1CC(c2ccc(Cl)cc2Cl)=NO1	751203975	UHKDNYXYSYYMRC-AWEZNQCLSA-N	425.228	1.657	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1c[nH]nc1-c1cccnc1	752488443	AXQOYUYYQJVFDV-UHFFFAOYSA-N	428.474	1.250	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@@H](C)c2ccc(S(C)(=O)=O)cc2)c2ccccc2c1=O	753276982	RWXIMUOELBIRCU-ZDUSSCGKSA-N	442.497	1.385	50	20	IDGD	
C[C@@H](CS(=O)(=O)c1ccc(F)cc1)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	755285163	IEYVVGOKCOMPTK-AWEZNQCLSA-N	449.508	1.090	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)Nc2cccc(S(=O)(=O)N3CCOCC3)c2)cc1	755354630	SJBVUGPCNSKGQK-UHFFFAOYSA-N	429.458	1.046	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N(CC)CC)cc1NC(=O)NNC(=O)c1ccccn1	755442106	QBYDVGVPHCQQKO-UHFFFAOYSA-N	435.506	1.977	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)Nc1ccc(CN2C(=O)CCC2=O)cc1	755661242	GMZBRRAHHXOXEQ-UHFFFAOYSA-N	447.492	1.793	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)Nc1cccc(C(=O)NCCC(N)=O)c1	756395421	WWLHSOSGYJKDLI-LBPRGKRZSA-N	431.424	1.051	50	20	IDGD	
COCCS(=O)(=O)c1ccc(NC(=O)NNC(=O)CCc2ccc(OC)cc2)cc1	756555112	RETQYZKAOFMSFE-UHFFFAOYSA-N	435.502	1.901	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)Nc1cc(Br)c(=O)n(C)c1	757676488	AOSOIZZDKZDDOW-UHFFFAOYSA-N	425.239	1.388	50	20	IDGD	
COC(=O)[C@@H](C)Oc1ccc(C=NNC(=O)Cc2csc(N3CCOCC3)n2)cc1	758373747	IVDPNNCETVNCIH-CQSZACIVSA-N	432.502	1.613	50	20	IDGD	
CC(C)OCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	758717824	LMVIHOPGSROHTF-UHFFFAOYSA-N	434.518	1.534	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCO[C@H](c3cccc(OC(F)F)c3)C2)n1	759362592	CPKPJCRDOQZWES-HNNXBMFYSA-N	440.472	1.816	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)N[C@H]2CCCN(c3ccccc3F)C2)c2ccccc2c1=O	763079378	OTNIGJVZGNCALH-AWEZNQCLSA-N	438.463	1.686	50	20	IDGD	
COc1cc(C(=O)NN[C@@H](C(N)=O)c2cccc(Br)c2)cc(OC)c1OC	763376772	GQCOITHMZNWLDS-OAHLLOKOSA-N	438.278	1.936	50	20	IDGD	
COc1ccccc1OC[C@@H](C)CNC(=O)NNC(=O)c1csc(N2CCOCC2)n1	763459971	CMVKTJUTHBJFFW-AWEZNQCLSA-N	449.533	1.647	50	20	IDGD	
CC(C)(C)OC(=O)N1CCc2cc(NC(=O)C(=O)NNC(=O)c3ccncc3)ccc21	763463521	ZXUYIAKCKWYYNU-UHFFFAOYSA-N	425.445	1.779	50	20	IDGD	
CN1CCN(c2ccc(NC(=O)C(=O)NNC(=O)c3ccccc3O)cc2Cl)CC1	763529986	OLZFMXXIKSKBFW-UHFFFAOYSA-N	431.880	1.197	50	20	IDGD	
O=C(NNC(=O)c1ccccc1F)C(=O)Nc1ccn(-c2ncccc2C(F)(F)F)n1	763562318	TYPZWTGBBXSSKN-UHFFFAOYSA-N	436.325	1.825	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)Nc1ccnn1CCc1ccccc1	763569723	BEBYYIOYILRPJX-GOSISDBHSA-N	435.440	1.052	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)Nc1ccc(Oc2ccncc2)cc1	763577018	GCHBYCJKTVVUST-IBGZPJMESA-N	434.408	1.800	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(OCC(=O)N(C)C)cc2)c2ccccc2n1	763610467	GUCIZWDMCYTCAG-UHFFFAOYSA-N	449.467	1.410	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(C(=O)OC)c(F)c1	763682734	VCKXALACDPKNIX-UHFFFAOYSA-N	433.392	1.176	50	20	IDGD	
CCCOc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1	763717984	FGLUDRGZVUHZLF-UHFFFAOYSA-N	448.501	1.125	50	20	IDGD	
CS(=O)(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)c2cccc(Cl)c2)c1	763750959	VISZIJBAVOALLT-UHFFFAOYSA-N	430.269	1.797	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(C)cc2C(=O)OC)cc1	763859663	DQQWQRJYQRNVEO-CQSZACIVSA-N	443.456	1.734	50	20	IDGD	
CN1C(=O)CCc2cc(NC(=O)C(=O)NNC(=O)c3cc(Br)c[nH]3)ccc21	763997036	ULYXZLFBLPACMR-UHFFFAOYSA-N	434.250	1.086	50	20	IDGD	
C[C@@H](Oc1ccccc1NC(=O)C(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1ccccc1	764001594	BFWBDXPDLIKFSS-GDBMZVCRSA-N	445.497	1.347	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cc(Br)cn2C)n(-c2ccccc2)n1	764004517	FVJLGSBNTNZUHP-UHFFFAOYSA-N	445.277	1.681	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1ccc(F)cc1Br	764005589	CBQVHDWSDOKHNA-UHFFFAOYSA-N	438.209	1.759	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1cccc(Cl)c1-n1cccn1	764005608	CKRCYNZATLUGRK-UHFFFAOYSA-N	441.831	1.697	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)Cc1ccc(S(=O)(=O)C(F)F)cc1	764043848	YJXGYXDCBRZWGA-UHFFFAOYSA-N	430.454	1.871	50	20	IDGD	
O=C(Cc1ccc2ccccc2c1)NNC(=O)C(=O)Nc1ccn(-c2ncccc2F)n1	764090530	AUMGAYQGPXBDHQ-UHFFFAOYSA-N	432.415	1.888	50	20	IDGD	
O=C(CC(F)(F)F)NNC(=O)C(=O)Nc1ccc(C(=O)NCCc2ccccc2)cc1	764115091	MXVFQVSCWWHTAT-UHFFFAOYSA-N	436.390	1.697	50	20	IDGD	
COC(=O)[C@H](C)Cc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(OC)c2O)cc1	764130205	DAKMSDLKWUDJGH-GFCCVEGCSA-N	429.429	1.152	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(CN3C(=O)CSC3=O)cc2)cc1	764177839	WWGOYGKTWDWJTB-UHFFFAOYSA-N	437.437	1.153	50	20	IDGD	
O=C(Cc1ccccn1)NNC(=O)C(=O)Nc1ccnn1Cc1ccc(Cl)c(F)c1	764264264	ORPUKUSKWBJPRE-UHFFFAOYSA-N	430.827	1.448	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1ccn(-c2ccccc2Cl)n1	764274881	FYKDONJNXGHCCU-UHFFFAOYSA-N	429.820	1.396	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)ccc1O)C(=O)Nc1cccc(OCCF)c1	764280372	NQPPDOFLXJORJE-UHFFFAOYSA-N	440.225	1.903	50	20	IDGD	
CCOC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)c2cc3ccccc3o2)cc1	764331670	ZYPWPMWRUQWPCB-UHFFFAOYSA-N	425.397	1.774	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)C(=O)Nc1ccc(Br)nc1	764343048	MOBCZFHJEBAENH-UHFFFAOYSA-N	429.234	1.430	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C)c(S(=O)(=O)NC3CC3)c2C)o1	764367093	FOUFVTZPJVSQNQ-UHFFFAOYSA-N	434.474	1.045	50	20	IDGD	
CN1C(=O)CCc2cc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc3ccccc3)ccc21	764369280	BNTWTGSQKLSORG-UHFFFAOYSA-N	432.383	1.353	50	20	IDGD	
CCc1ncsc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccc(OC)c(OC)c2)[nH]n1	764377969	FJHFCNBFEXIACE-UHFFFAOYSA-N	444.473	1.513	50	20	IDGD	
CNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)c1C	764386558	AUQAIGWVLXBNSU-UHFFFAOYSA-N	438.419	1.284	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)[C@@H](C)NS(=O)(=O)c2ccc(C#N)cc2)o1	765097423	GIWIWDBJEZALPS-CQSZACIVSA-N	447.517	1.121	50	20	IDGD	
CCOC(=O)NNC(=O)C(=O)Nc1ccc(S(=O)(=O)N2C[C@@H](C)C[C@H](C)C2)cc1	765413245	DUGIFASTLGBRNM-STQMWFEESA-N	426.495	1.069	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1ccc(NC(=O)C2CC2)cc1	765737117	WPTRSTIYPKTOQS-UHFFFAOYSA-N	449.511	1.254	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2cc(Br)c(C)nc2O)c2ccccc2c1=O	765974732	ZBILKMPGVNXISU-UHFFFAOYSA-N	446.261	1.663	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1ccc(S(=O)(=O)c2ccc(F)cc2)cc1	766261315	SIBRHFHTSLJFGB-UHFFFAOYSA-N	445.432	1.539	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)ccc1OC(C)C	768229401	BGMYPCZCKSEOCC-SFHVURJKSA-N	429.429	1.408	50	20	IDGD	
CCn1nc(C(=O)NN=Cc2c(C)nn(CC(=O)OC(C)C)c2C)c2ccccc2c1=O	768350458	SJQVLZARUYLJLZ-UHFFFAOYSA-N	438.488	1.945	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)CN1C(=O)N[C@](C)(c2ccccc2OC)C1=O)c1ccccc1	771265685	FVRFSEXABFBEIC-WAIKUNEKSA-N	438.484	1.803	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)N[C@@H]1CCO[C@]2(CCOC2)C1	771442534	MRLKUIAZMCGXTE-CXAGYDPISA-N	428.283	1.496	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)C[C@@H](NC(C)=O)c1ccc(Br)cc1	771900546	DYHZQUKUMPSXAD-IINYFYTJSA-N	428.283	1.506	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)CCNS(=O)(=O)c1c(C)c(C)c(C)c(C)c1C	771925949	CRQWETQVBLSGBY-MRXNPFEDSA-N	441.550	1.386	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1cccc(S(=O)(=O)N[C@H](C)c2ccccc2)c1	771936814	BRKDWAJWLUVFKN-CABCVRRESA-N	447.513	1.829	50	20	IDGD	
Cc1cc(C)c(C)c(S(=O)(=O)NCC(=O)O[C@@H](C)C(=O)NNC(=O)CC(C)C)c1C	771942409	ZXLCMBJCKDKEHR-INIZCTEOSA-N	441.550	1.324	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)c1cc(S(N)(=O)=O)cc(Cl)c1Cl	772135399	GCLBCINJGDRNIZ-MRVPVSSYSA-N	440.305	1.380	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNS(=O)(=O)c1ccc(S(C)(=O)=O)cc1	773263856	ITXAGIXFYVGEND-NSHDSACASA-N	432.907	1.521	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NNC(=O)CCOc2cccc(C(N)=O)c2)C1	773411376	KAPFTOXUBILULA-OAHLLOKOSA-N	434.493	1.349	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2)ccc1Cl	773655638	DRSMICPKMZABCS-UHFFFAOYSA-N	441.853	1.580	50	20	IDGD	
O=C(NNc1ccc(C(F)(F)F)cn1)C(=O)Nc1ccc(S(=O)(=O)NC2CC2)cc1	773667301	WBJOEECRSPMCNK-UHFFFAOYSA-N	443.407	1.623	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)Nc3ccccc3C)CC2)cc1	775403143	MGVUTYISMSWCHN-UHFFFAOYSA-N	445.545	1.463	50	20	IDGD	
O=C1CCc2cc(NC(=O)C(=O)NNC(=O)c3ccccc3Br)c(F)cc2N1	778706198	OGVMSLUQXRNSLN-UHFFFAOYSA-N	449.236	1.873	50	20	IDGD	
COc1ccc(Cn2nccc2NC(=O)NNC(=O)c2cnccn2)c(OC)c1OC	779460649	DMYFFHUQMXVCCV-UHFFFAOYSA-N	427.421	1.214	50	20	IDGD	
COc1ccc(Cn2nccc2NC(=O)NNC(=O)Cn2nc(C)cc2C)c(OC)c1	779468161	QRTPOALFZFNZER-UHFFFAOYSA-N	427.465	1.615	50	20	IDGD	
O=C(NCc1ccco1)NNS(=O)(=O)c1ccc(S(=O)(=O)C(F)(F)F)cc1	780383268	DVOVYNRFRODZMV-UHFFFAOYSA-N	427.382	1.266	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)C3(OC)CCC3)c2)cc1	781928852	AOOLUXOZNOSDJG-UHFFFAOYSA-N	433.486	1.826	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)NCc2cccc(S(=O)(=O)N(C)C)c2)cc1	782770570	STWGPGSHQJLSBZ-UHFFFAOYSA-N	436.559	1.868	50	20	IDGD	
CCC(C)(C)OCc1ccccc1NC(=O)C(=O)NNC(=O)CNC(=O)c1cccs1	784004326	WNQFLQHSBCSWML-UHFFFAOYSA-N	446.529	1.969	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)c(OCc2ccccc2)c1	784462410	GUQXNDLSHLUEOV-HNNXBMFYSA-N	433.486	1.862	50	20	IDGD	
COCCOc1ccc(C#N)cc1NC(=O)C(=O)NNc1ccc(Br)nc1	784808702	BMVGBYLTHSAEMD-UHFFFAOYSA-N	434.250	1.823	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)Nc1cccc(OC(F)(F)F)c1	785022191	CYJWLCRUIVIPJU-UHFFFAOYSA-N	428.279	1.599	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)Nc1cnn(-c2ccccc2F)c1	785023668	NPYLXDJUWDJCPK-UHFFFAOYSA-N	428.336	1.025	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2ccc(N3CCOC[C@@H]3C)cc2)n1	785226481	HMILRXHERWTGEZ-HNNXBMFYSA-N	427.509	1.630	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1ccnn1Cc1ccc(C)o1	785330362	GCUVHIZEMXGQCP-UHFFFAOYSA-N	447.473	1.327	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)Nc2ccc(Cl)c(S(C)(=O)=O)c2)c2ccccc2c1=O	788309325	KIBCPKVYRQNKND-UHFFFAOYSA-N	449.876	1.457	50	20	IDGD	
O=C(NCCCNC(=O)c1ccc(Br)cc1)NNc1nc2ccccn2n1	790277449	POASPDRMCRWSRT-UHFFFAOYSA-N	432.282	1.938	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NC[C@@H]2N(C)CCCC2(C)C)nc1	790896479	OVYIXHWVFUSVMI-INIZCTEOSA-N	426.587	1.859	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)NCc2ccc(N3C(=O)N[C@](C)(C4CC4)C3=O)cc2)o1	790901716	ZNNSPVSRPLCXOW-OAQYLSRUSA-N	425.445	1.957	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)c1ccccc1F)C(=O)NNc1nc2ccccn2n1	791240088	UZZFSRMFTRBSID-CYBMUJFWSA-N	438.510	1.412	50	20	IDGD	
C[C@@]1(c2ccc3ccccc3c2)NC(=O)N(CC(=O)NNc2nc3ccccn3n2)C1=O	792513741	RVEBWFWTAUHSLL-QFIPXVFZSA-N	429.440	1.793	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNC(=O)Cn1ncc2ccc([N+](=O)[O-])cc21	794075239	GWLPZIAHCOXGHL-UHFFFAOYSA-N	426.389	1.018	50	20	IDGD	
CCC(=O)Nc1ccc(S(=O)(=O)NNC(=O)CNC(=O)OCc2ccccc2)cc1	794596509	GXLPZZKISRPXQO-UHFFFAOYSA-N	434.474	1.271	50	20	IDGD	
Cc1cccc(C(=O)NNS(=O)(=O)c2cc(C(=O)O)cc(Br)c2C)n1	794599211	DTYPIRJQRLVMLF-UHFFFAOYSA-N	428.264	1.782	50	20	IDGD	
CCOC(=O)c1ccc(OC)c(S(=O)(=O)NNC(=O)c2ccc(OC)c(OC)c2)c1	795279942	AOAHZDFVECQVEW-UHFFFAOYSA-N	438.458	1.512	50	20	IDGD	
O=C(CN1CCN([C@H]2CCN(Cc3ccccc3)C2)CC1)NNC(=O)c1cccs1	796384892	QAAPWFHECSZWPX-IBGZPJMESA-N	427.574	1.401	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)cc1OC	797006315	KPACQFYSCNNSSP-UHFFFAOYSA-N	437.355	1.240	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(-n3nccn3)cc2C(F)(F)F)n1	797370476	DQXGMQLMLVSUOX-UHFFFAOYSA-N	433.350	1.389	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)C(=O)Nc2cc(-c3ccnn3C)ccc2C)c1	799258925	KXRSMKMCUGOKHL-UHFFFAOYSA-N	435.444	1.149	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)Cn2c(S)nc3ccccc3c2=O)cc1C	801107314	GMYIWIWLJYUUNA-UHFFFAOYSA-N	425.470	1.088	50	20	IDGD	
CC(C)[C@@H](NC(=O)c1ccc(Cl)s1)C(=O)NNC(=O)CNC(=O)OC(C)(C)C	801184184	LILAYDHRFWCSCG-CYBMUJFWSA-N	432.930	1.828	50	20	IDGD	
C[C@@H]1CC(CCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)C[C@@H](C)O1	802510938	WWTRYSHQQRJJDL-ZIAGYGMSSA-N	426.539	1.475	50	20	IDGD	
COCCCOc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(C)c(F)c2)cc1OC	806986379	LAXQRGYUFNIORZ-UHFFFAOYSA-N	433.436	1.958	50	20	IDGD	
O=C(NNc1c(F)cc(C(=O)NC2CC2)cc1F)C(=O)Nc1cccc2c1CNC2=O	807020524	MRJNQCBEEHVPAK-UHFFFAOYSA-N	429.383	1.182	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(-c3ccccn3)cc2)c1	810385059	VVDYMAYSXGTRKU-UHFFFAOYSA-N	438.465	1.552	50	20	IDGD	
CC(C[C@H]1CCC(=O)N1)=NNC(=O)c1cc(S(=O)(=O)NCc2ccccc2)ccc1O	811637248	XQKUTMUEJQVQLJ-MRXNPFEDSA-N	444.513	1.645	50	20	IDGD	
CCc1ccc(C#CC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1	814360931	PWQXZVSNDVQEIF-UHFFFAOYSA-N	425.510	1.846	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2cccc(Cl)n2)cc1S(=O)(=O)NC1CC1	815728756	SHNATPCSWXEKIA-UHFFFAOYSA-N	439.881	1.266	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCO1)C(=O)Nc1ccc(Cl)cc1I	815779929	CACPPOINLFXJTA-SNVBAGLBSA-N	437.621	1.210	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)[C@@H]2CS[C@H](Cc3ccccc3F)C(=O)N2)c1	891387468	BCWUKWLKOZPYKW-ZWKOTPCHSA-N	447.488	1.447	50	20	IDGD	
N#Cc1ccc(S(=O)(=O)NCC(=O)NNC(=O)CCSc2ccc(F)cc2)cc1	913035342	XBVXHFUZLUPCFH-UHFFFAOYSA-N	436.490	1.305	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)CCNS(=O)(=O)c2cccs2)cc1OC	913069848	SCZIOCOINKMJKS-UHFFFAOYSA-N	441.531	1.675	50	20	IDGD	
C[C@H]1CC(C)(C)C[C@]2(C1)NC(=O)N(CC(=O)NNC(=O)Cn1cnc3ccccc31)C2=O	913495819	OZNRMSYUCLGFOW-FPTDNZKUSA-N	440.504	1.321	50	20	IDGD	
COc1ccnc(NNC(=O)c2ccc(Cl)c(S(=O)(=O)NC[C@@H]3CCCO3)c2)n1	914763006	JLJDIXNYRHHWNR-LBPRGKRZSA-N	441.897	1.353	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1cnn(-c2ccccn2)c1C	914948400	VFJDSSKKVDWMRG-UHFFFAOYSA-N	443.847	1.856	50	20	IDGD	
Cc1ccc([C@](O)(CC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)C(F)(F)F)o1	915077166	GVARNGUKYJHACE-MRXNPFEDSA-N	434.392	1.593	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)[C@H]2CCCN(S(=O)(=O)c3ccccc3)C2)cc1C	915188505	SUIYCYNOZODGBN-SFHVURJKSA-N	445.541	1.931	50	20	IDGD	
COCC(=O)NC1CCN(C(=O)/C(C#N)=C/c2cc(C)n(C[C@@H]3CCCO3)c2C)CC1	915705788	TXBVLWXJIJYMHS-SRKIZSPNSA-N	428.533	1.945	50	20	IDGD	
CN(C)N(C(=O)c1cccc(CS(=O)(=O)c2ccccc2)c1)[C@@H]1CCS(=O)(=O)C1	916040985	LOYHOYBGXUQPGO-GOSISDBHSA-N	436.555	1.766	50	20	IDGD	
O=C(NCc1ccnc(OCC(F)(F)F)c1)NNC(=O)[C@H]1COc2ccccc2O1	916397543	UGQYMBNVSQBYNJ-CQSZACIVSA-N	426.351	1.693	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCCN2CCc3ccccc3C2)nc1	916443684	RWMQLTNSMBJDAI-UHFFFAOYSA-N	432.550	1.453	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)NCCCN2CCN(Cc3ccccc3)CC2)n1	916490138	WSGYIDICMJXBHX-UHFFFAOYSA-N	427.553	1.038	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)nc2ccccc21	916519828	LNAVBEPPOMKUCQ-UHFFFAOYSA-N	430.509	1.846	50	20	IDGD	
CCCCN(C(=O)COC(=O)/C(C#N)=C\c1ccc(OC)cc1)[C@@H]1CCS(=O)(=O)C1	916613227	UISJDKRWTXMHJE-XUDLPTGHSA-N	434.514	1.961	50	20	IDGD	
O=C(NCCCn1nc2n(c1=O)CCCC2)NNC(=O)c1cc2c(s1)CCCCC2	916650166	QPDROLSAPKERBO-UHFFFAOYSA-N	432.550	1.746	50	20	IDGD	
O=C(CCOc1ccccc1Br)NNC(=O)c1ccc(-n2cnnn2)cc1	917924822	AKBJGGCLVWHOTD-UHFFFAOYSA-N	431.250	1.655	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)[C@H](C)n3cccn3)c2)cc1	918186803	LTCQIEGFZCKBEZ-AWEZNQCLSA-N	443.485	1.715	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)Nc1ccc2c(c1)C(=O)NC2=O	920933307	LSHOWKPVYPSCQU-VIFPVBQESA-N	447.245	1.953	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)NCc1ccc(-n2ccnc2)cc1	921244357	AXUZZBBWPMUHDX-UHFFFAOYSA-N	447.543	1.915	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)NC[C@@H](c2cccc(F)c2)N2CCOCC2)cc1	921247276	CUJVVJHHWYECKO-FQEVSTJZSA-N	441.463	1.480	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)NCCCS(=O)(=O)c1ccccc1	921247608	ISDVNZYOYNUEIS-UHFFFAOYSA-N	436.446	1.168	50	20	IDGD	
Cc1cc(C(=O)NNS(=O)(=O)c2cc(S(C)(=O)=O)ccc2F)c2ccccc2n1	921295505	PVNOJBAVPPFXCQ-UHFFFAOYSA-N	437.474	1.709	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCC(=O)NNC(=O)Cc2ccc3ccccc3c2)cc1	1261200847	LQMYGNXIXUTSQQ-UHFFFAOYSA-N	441.509	1.907	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)OCC(=O)N[C@@H]2CCS(=O)(=O)C2)c(C)n1C[C@@H]1CCCO1	1317696652	KWQOZOIWCLPFLH-XBHWDRPYSA-N	449.529	1.037	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2ccc3ccccc3c2)cc1	1325878077	HYRQUADFVNKNTG-UHFFFAOYSA-N	427.482	1.978	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(O)nc4ccccc34)C2)C1	1777763704	RBQGOWLHTMPWMO-IERDGZPVSA-N	433.892	1.638	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4c(c3)CC(=O)N4)C2)C1	1778394135	YALSXXGHNQQYBU-WOJBJXKFSA-N	440.327	1.861	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3cn4cccnc4n3)C2)C1	1778473951	GFNJVVFUMGOYQE-UGSOOPFHSA-N	436.310	1.204	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@]2(C1)CN(C(=O)c1ccccc1C1CC1)CCO2	1779034997	ZAISNIHBCGSSMJ-DEOSSOPVSA-N	449.511	1.320	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccccc1C1CC1)CCO2	1779034998	ZAISNIHBCGSSMJ-XMMPIXPASA-N	449.511	1.320	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@]2(C1)CN(C(=O)Cc1cccc(Cl)n1)CCO2	1779296612	WDKQEJVDDOPAOJ-IBGZPJMESA-N	425.989	1.959	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnnc(Cl)c1)C2)[C@H](F)Br	1780770886	ICXPMIZMLMUKCP-PVXIVEMSSA-N	449.708	1.948	50	20	IDGD	
O=C(c1nccc2[nH]ccc12)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781332004	YFIQAOFGOFAFSF-PBHICJAKSA-N	425.258	1.697	50	20	IDGD	
O=C(c1ccc([N+](=O)[O-])cc1F)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781334069	UURUFOPPYCOKDE-BBRMVZONSA-N	448.220	1.868	50	20	IDGD	
Cc1cc(C)n(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](C)Br)C2)n1	1781996446	JUPSOGQKNXMIKB-FRQCXROJSA-N	441.370	1.797	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1c[nH]c3ncccc13)C2	1782172877	PLLIFDOAZCLMCL-CBGDNZLLSA-N	434.924	1.944	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C#CC1(O)CCCCC1)C2	1782175163	FNXSWXHRLJPQOI-WAOWUJCRSA-N	440.968	1.453	50	20	IDGD	
C[C@H](C(=O)N1CC[C@]2(CN(C(=O)C(Cl)Cl)CCO2)C1)[S@@](=O)c1ccccc1	1782685223	FQCFITJGFGPRMO-PFTQGLRFSA-N	433.357	1.816	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnc4c(c3)CCNCC4)C2)C1	1782728596	ZRPSKAUIRTZDRZ-AVRDEDQJSA-N	434.968	1.621	50	20	IDGD	
Cn1nncc1C(=O)N1CCO[C@]2(CCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1	1782864395	VEPZCDFSFVTEIW-OMKLEDIQSA-N	442.426	1.144	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)Cc3cc(C)n(C)n3)CCO2)C1	1783344125	QOXKTAAVEZGYNP-YJBOKZPZSA-N	427.343	1.274	50	20	IDGD	
O=C([C@@H]1CCc2ccccc2O1)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1783845547	MIQSUXGXJGRERP-BXWFABGCSA-N	441.297	1.901	50	20	IDGD	
CC(C)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4c(n3)OCCO4)C[C@@H]21	1783850787	SRFWJQPOKUJUCC-ZQIUZPCESA-N	437.924	1.711	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)Cc3cc(F)ccc3OC)CCO2)C1	1783878308	CWMBJAIAWWVQDL-JXFKEZNVSA-N	428.888	1.461	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(C)c(NC(C)=O)c3)CCO2)C1	1783879755	ANXOSUCIIKROEO-UTKZUKDTSA-N	437.924	1.651	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccccc3O)C[C@@H]21	1783974539	OVZKQVCYUASUGS-VKZRIFJHSA-N	439.350	1.945	50	20	IDGD	
O=C(Cc1cnccn1)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1	1786225459	XVJMHCWFVPMSTM-UHFFFAOYSA-N	430.273	1.147	50	20	IDGD	
C[C@@H](Nc1cccnc1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21	1786866111	GHEATAMWBFEAJM-MLEONAHRSA-N	443.317	1.552	50	20	IDGD	
CC(=O)N[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]2C1)c1ccc(F)cc1	1787448618	CJEGNPNGZQQOGR-OGCZYDBJSA-N	443.878	1.517	50	20	IDGD	
CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]2C1	1787451576	WWSRYJQKBJVOLO-RMEBNNNOSA-N	435.924	1.804	50	20	IDGD	
C[C@H](Cn1ccnc1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]2C1	1789873514	YOPHSTSXHOCKTO-CUGJGTHOSA-N	431.364	1.735	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(=O)c3ccco3)C[C@@H]21	1790958307	OWVVERDGUBTTTP-XPCVCDNBSA-N	427.295	1.616	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3ncc[nH]3)C[C@@H]21	1790964225	UUABGDZFEKNTLE-XQLPTFJDSA-N	427.343	1.496	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CNC(=O)OC(C)(C)C)[C@H]2C1	1790990737	UQURLAZOWTUJOP-XUXIUFHCSA-N	448.358	1.274	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(CO)c(F)c3)C[C@@H]21	1791256379	OSJXOIWALQHSNM-OVWQWFNUSA-N	428.888	1.165	50	20	IDGD	
Cc1cc(NC(=O)CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](C)CBr)no1	1792988441	ZTYDGEVWPGZSCI-DEQVHRJGSA-N	441.326	1.981	50	20	IDGD	
CC(C)N1CCC(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CO[Si](C)(C)C)C3)CC1	1793798908	YIIPKVNFJLSCPM-OPVJXMOQSA-N	425.646	1.548	50	20	IDGD	
Cn1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCBr)c(C(F)F)n1	1795114370	AIGQILJXQVTJBQ-DDFAGTSDSA-N	435.269	1.346	50	20	IDGD	
COc1ccc(F)cc1CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCBr	1795117094	MLJVLKPZJHWTMF-HBCWATKFSA-N	443.313	1.751	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1cccc2nc[nH]c12	1796145332	ZFJDURAPAYXPPM-YJKIEOBBSA-N	425.258	1.457	50	20	IDGD	
Cc1nc2ccncc2cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)Br)C2	1797362196	KJLJANBCULKFAA-MKXCTONWSA-N	447.333	1.925	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](Br)Cc1ccccc1)C2)[C@H]1C[C@@H]1F	1800378939	WAWOTSUDZBSREV-RFSXOUPVSA-N	439.325	1.940	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)Br	1800761629	DDASGFXVDQXRAR-HGCLJGPKSA-N	426.149	1.533	50	20	IDGD	
COC(=O)[C@H]1CC=CC[C@@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(C)(C)CCl)C2	1800951420	DBBGPCWSNWILKF-QEOTZNIISA-N	426.941	1.596	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cn3ccc(Cl)cc3n1)C2	1800977680	COBIJMDRNWHYKW-IFOZYUSPSA-N	441.315	1.445	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)Cc2ccc3c(c2)OCO3)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803137995	GHHHAHPADLNZAU-XGHQBKJUSA-N	445.903	1.659	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CS[C@@H]2CCCCO2)[C@H]1c1cccnc1)[C@@H](O)CCl	1803142736	HKYVBJQLYZZZOA-DKKFBQAASA-N	441.981	1.947	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC2(CCCN(C(=O)[C@@H]3C[C@@H]3C3CC3)C2)CC1	1805360331	RWRZCQBUQNXPCW-QZTJIDSGSA-N	425.533	1.576	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)c2ccco2)[C@H]1c1cccnc1	1805377635	PXFCVZVKTVJTBM-DNVCBOLYSA-N	434.456	1.307	50	20	IDGD	
O=C(COc1ccccc1)N1CCCC2(CCN(C(=O)c3ccc(B(O)O)cc3)CC2)C1	1809178098	ORBIOMNVEPMZGR-UHFFFAOYSA-N	436.317	1.290	50	20	IDGD	
CCC1(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)CCC1	1809647521	QMLXNNNNRQSLHX-FPOVZHCZSA-N	435.333	1.661	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)c3ccc4[nH]ccc4n3)CC2)C1	1809978654	IEIULNYEKNDNEC-UHFFFAOYSA-N	446.316	1.401	50	20	IDGD	
COC[C@H](NC(C)=O)C(=O)NC[C@H]1CCN(C(=O)C(C)(C)CCl)[C@@H]1c1cccnc1	1810558569	GKDPIXLTDBKLLR-FGTMMUONSA-N	438.956	1.504	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC2(CCCN(C(=O)[C@@H](CC)NC(N)=O)C2)CC1	1810822696	AGRNGXSURGANGC-ZIAGYGMSSA-N	431.375	1.838	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2[nH]nc3ncccc23)[C@H]1c1cccnc1	1813029894	BALQJQNSUUZNNH-HFTRVMKXSA-N	442.907	1.926	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)CC(F)(F)C(=O)O)[C@H]1c1cccnc1	1813031093	OAQKRKSPNQDLAW-IPYPFGDCSA-N	433.839	1.451	50	20	IDGD	
C[C@H](CBr)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CC[C@H](N)C(N)=O)[nH]n1	1814781085	WAGKHAVMXZEHOK-NTZNESFSSA-N	443.346	1.026	50	20	IDGD	
C[C@@H](CBr)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCS(C)(=O)=O)[nH]n1	1814783618	QXVJSVIBCUKQLE-AAEUAGOBSA-N	449.371	1.868	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cnc3c(c2)CCNCC3)[nH]n1)[C@@H](O)CCl	1814874749	CUWYXBCEAJOLAA-MSOLQXFVSA-N	446.939	1.399	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CC[C@@H](N)C(N)=O)n[nH]1	1817358153	CABYPEVULPQGGM-DMDPSCGWSA-N	443.346	1.168	50	20	IDGD	
O=C(CCc1ccc[nH]1)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1817529738	JVUONXJSSMCLFA-LJQANCHMSA-N	435.293	1.356	50	20	IDGD	
Cc1ccnc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cnccc3C(=O)NN)n[nH]2)c1	1819402959	POPDQHRBYVGDIG-GOSISDBHSA-N	448.487	1.731	50	20	IDGD	
Cc1n[nH]c(C)c1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1819663136	SKTXFNFRGCVDRN-QGZVFWFLSA-N	436.281	1.049	50	20	IDGD	
CN1CCN(CC(=O)N[C@@H]2CCc3nc(NC(=O)[C@@](C)(Cl)CCl)sc3C2)CC1	1822864809	HSKXHVROGUKLRN-XIKOKIGWSA-N	448.420	1.539	50	20	IDGD	
Cn1cccc(C(=O)N[C@@H]2CCc3nc(NC(=O)[C@@H](F)Br)sc3C2)c1=O	1822999482	SERZLPUSXPSNKD-PRHODGIISA-N	443.298	1.758	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3cnn4c3OCCC4)sc2C1	1824001934	ZXBXENIODZEEFJ-CMPLNLGQSA-N	439.925	1.602	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CCN2C(=O)C=CC2=O)CC1	1824773530	GANOGPJTLBBIBJ-IRXDYDNUSA-N	439.940	1.175	50	20	IDGD	
CC(=O)N[C@H](C)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](C)CBr)CC2	1825210944	DQVJSVPZKBKLLS-NGZCFLSTSA-N	431.356	1.611	50	20	IDGD	
CC[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ncn(C)n1)CC2	1825445261	QUBICBANUOFYQS-DTWKUNHWSA-N	427.328	1.671	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](OC(C)=O)C(C)C)CC2	1825999657	BTTOPAVSDNMFGT-HUBLWGQQSA-N	431.942	1.897	50	20	IDGD	
CN1CCN(C2(C(=O)N[C@@H]3CCc4nc(NC(=O)C(Cl)Cl)sc4C3)CC2)CC1	1826104663	VANHGKFLFZHHJY-LLVKDONJSA-N	446.404	1.639	50	20	IDGD	
CC(C)(C)[C@@H](O)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827055504	AHMTZEIAFHIFJQ-PMACEKPBSA-N	430.354	1.007	50	20	IDGD	
CC(C)O[C@@H](C)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827057593	KQADPMAUJJAVFH-LAUBAEHRSA-N	430.354	1.413	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)C2CC(O)C2)CC1	1827677380	RHKCZAOGYZYWDP-QRPGEEMDSA-N	443.548	1.511	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC([C@@H]2CCCCN2C(=O)CCc2nc(N)n[nH]2)CC1	1828807148	MSWXSHVJNMHPLH-INIZCTEOSA-N	436.633	1.791	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc4c3NC(=O)C4)C2)C1	1830366301	OVRRSLJWTOEQEF-JOCHJYFZSA-N	449.935	1.516	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(F)c3)C2)C1	1830543003	GZMIPNYHDVBOLQ-KUHUBIRLSA-N	443.313	1.927	50	20	IDGD	
O=C(Cn1ccc2c(F)cccc21)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1830653200	YHMGDYWWHOKHGB-ICSRJNTNSA-N	441.862	1.771	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CN3CCC(C)CC3)C2)C1	1831639490	ACHVNPQBPBAOFV-WIYYLYMNSA-N	429.989	1.582	50	20	IDGD	
CCS(=O)(=O)N[C@H](C)C(=O)N1CCC([C@H]2CCCCN2C(=O)C(Cl)Cl)CC1	1831875189	UXJAONXUFIAIED-TZMCWYRMSA-N	442.409	1.738	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)N1CCC(N2CCC(NC(=O)C(C)(C)CCl)CC2)CC1	1833214433	AUOSIIAHUKKOOW-OAHLLOKOSA-N	426.989	1.514	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)C(C)(C)C)CC2)CC1	1833282763	HJRXLXAKIHQKAA-RHSMWYFYSA-N	446.430	1.996	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)CN3CCCC3=O)CC2)CC1	1833532283	KDFHZMJXMBUQHA-SFHVURJKSA-N	426.989	1.588	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)CSc3nc[nH]n3)CC2)CC1	1833535032	OSBMBWXVFGATOK-MRXNPFEDSA-N	443.017	1.876	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1)c1ccncc1	1834138827	UPTLJGOXHJKZGV-INIZCTEOSA-N	427.318	1.957	50	20	IDGD	
Cc1ncoc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)CBr)C2)C1	1834363328	ZMXUKCICTCIFMK-PXAZEXFGSA-N	430.299	1.084	50	20	IDGD	
O=C(Cc1cnc[nH]1)NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1	1835062072	ZZHWUNCJBLQJOA-UHFFFAOYSA-N	426.359	1.309	50	20	IDGD	
Cc1nc2ncccn2c1C(=O)NC1CCN(C2CCN(C(=O)[C@H](F)Cl)CC2)CC1	1835373789	LZKRYDJGJKHHKB-KRWDZBQOSA-N	436.919	1.757	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3ccc[nH]3)CCO2)C1	1836016064	VGLJSIWKZADCGV-RBUKOAKNSA-N	432.348	1.640	50	20	IDGD	
Cc1ccccc1C(=O)NC1CCN(C2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1	1836254857	MEBZMEVKHVBJAT-UHFFFAOYSA-N	443.592	1.553	50	20	IDGD	
Cc1noc(N)c1C(=O)N1CCC(N2CCC(NC(=O)[C@H](F)Br)CC2)CC1	1836412500	KBANYGQIRDZCOZ-AWEZNQCLSA-N	446.321	1.441	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3noc4c3CCCC4)CCO2)C1	1836429526	HJERBPHQKLLMKZ-FOIQADDNSA-N	425.913	1.641	50	20	IDGD	
CC/C=C(\C)C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1	1837920968	NEIZXMQTLSULEK-HAVNEIBRSA-N	428.338	1.335	50	20	IDGD	
O=C(c1[nH]cnc1-c1cccnc1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1838495892	KHUKMFOVPUYRSB-LPHOPBHVSA-N	437.859	1.076	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)cc1F	1838915998	MYQRIIUBYUMVEW-QAPCUYQASA-N	447.276	1.895	50	20	IDGD	
COc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)ccc1C	1838988741	LIJAZLFVSVNLMA-IBGZPJMESA-N	431.316	1.877	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(C=O)s3)C2)C1	1839151671	ABWAQMOOSSICKI-ZWKOTPCHSA-N	449.356	1.867	50	20	IDGD	
O=C(c1cccc(F)c1[N+](=O)[O-])N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1839356789	KRVZVBARZVGBPX-PBHICJAKSA-N	433.795	1.338	50	20	IDGD	
C[C@H](CC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1)Oc1ccccc1	1839746978	GBWVJVIVKRDVEL-XFQXTVEOSA-N	428.888	1.835	50	20	IDGD	
O=C(C(Cl)Cl)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)(Cl)Cl)CCO2	1839923319	XRUAHRDTAFUDAU-NSHDSACASA-N	428.527	1.617	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3nccs3)C2)C1	1839963320	HRORBUZBKUJOKV-WBMJQRKESA-N	432.340	1.387	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1840144283	WUTJXLRTLAOHBP-KSMMKXTCSA-N	449.331	1.002	50	20	IDGD	
COc1ccccc1OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840187190	LTSYHCPZSNNDBH-IBGZPJMESA-N	447.315	1.334	50	20	IDGD	
O=C(C(Cl)Cl)N1CCO[C@]2(COCCN(C(=O)[C@@H]3Cc4ccccc4O3)C2)C1	1840188652	VYWNBCPLSWWYFP-KXBFYZLASA-N	429.300	1.250	50	20	IDGD	
CO[C@@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1	1840211561	GTFWSWWFFFCVKW-UDVCIYDASA-N	449.454	1.363	50	20	IDGD	
COc1ccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)cc1F	1840526497	IXWMLVMELKMASA-HKUYNNGSSA-N	432.851	1.368	50	20	IDGD	
CCOC(=O)c1c(CCC(=O)N2CCCC23CN(C(=O)[C@@H](Cl)COC)C3)c[nH]c1C	1841456093	LFTFGLIKURXMKH-INIZCTEOSA-N	439.940	1.890	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)COc2ccc(Cl)c(F)c2)C1	1841566326	FSWKJLLEYGCBEN-UHFFFAOYSA-N	446.671	1.055	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1cc(C)c3n[nH]cc3c1)C2	1843416680	MLIPNLOPXXZTRF-CVKSISIWSA-N	447.499	1.822	50	20	IDGD	
O=C([C@H](O)CCl)N1CC2(CCCN2C(=O)c2cn3cc(C(F)(F)F)ccc3n2)C1	1844060773	MBRYPLCPYJSMPA-CYBMUJFWSA-N	430.814	1.770	50	20	IDGD	
C=C[C@H](O)C(C)(C)C(=O)N1CC2(CCCN2C(=O)c2cc([N+](=O)[O-])ccc2OC(C)=O)C1	1844692722	CJCAEFAMKNZUIU-SFHVURJKSA-N	445.472	1.910	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC12CN(C(=O)c1ccc(S(C)(=O)=O)cn1)C2	1846069211	NWFYNXNIRFOUCP-ZDUSSCGKSA-N	444.351	1.476	50	20	IDGD	
COc1c(Cl)cccc1C(=O)N1CCCC12CN(C(=O)c1cnccc1C(=O)NN)C2	1846852881	QDIDVHMBLOANPO-UHFFFAOYSA-N	443.891	1.478	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(F)(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](O)CCl)CC1	1847283434	JKYLDJIELWZGCX-SOUVJXGZSA-N	447.935	1.527	50	20	IDGD	
CCOC(=O)N(CC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl)Cc1ccco1	1847562849	BWAFMIHVLXPZMU-HRCADAONSA-N	427.885	1.040	50	20	IDGD	
O=Cc1ccccc1-c1cncc(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](O)CCl)c1	1847563711	OWDYFNRQBZESTA-SLFFLAALSA-N	427.888	1.976	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)c2ccc(Cn3cncn3)cc2)c2ccccc2c1=O	11651946	MTQZSDAVQDVRDS-UHFFFAOYSA-N	431.456	1.692	50	20	IDGD	
CCC1CCC2(CC1)NC(=O)N(CC(=O)NNC(=O)c1ccc(OC)c(OC)c1)C2=O	69044164	MIHWBGYVGHUWFC-UHFFFAOYSA-N	432.477	1.356	50	20	IDGD	
Cn1ccnc1[C@@](O)(CC(=O)NNC(=O)c1ccc(Br)cc1)C(F)(F)F	97037527	LCDJIRCXCBSLGI-AWEZNQCLSA-N	435.200	1.784	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H](c2ccccc2)n2cccn2)c1	109764024	JQMIANYJPMPTRR-GOSISDBHSA-N	427.486	1.184	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=S)NCC3CCC3)CC2)cc1	727867091	OMGURMUXICROPA-UHFFFAOYSA-N	440.591	1.391	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)N[C@@H](CN2CCN(C)CC2)c2ccccc2)cc1	727945461	JMTUJMZJKVSIAP-QFIPXVFZSA-N	439.560	1.947	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCCC(=O)NC(C)(C)C	728065004	NQDANNALIJZGCF-LLVKDONJSA-N	429.315	1.852	50	20	IDGD	
COc1cc(Br)ccc1C(=O)OCC(=O)NNC(=O)Cc1nc(C)cs1	728734209	XIPLGMSUZVBGJD-UHFFFAOYSA-N	442.291	1.770	50	20	IDGD	
O=C(Cc1cccnc1)NNS(=O)(=O)c1cc2c(cc1Br)OCCO2	728856507	SXNNODWUJYXVFE-UHFFFAOYSA-N	428.264	1.168	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)[C@H]1CC(=O)N(c2ccc3c(c2)OCCO3)C1	730034081	QWATZSJWHFCYRR-HNNXBMFYSA-N	425.441	1.297	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)COc1ccccc1O)c1cc(F)ccc1N1CCN(C)CC1	730907248	FMAPYQYWTQSDRF-HNNXBMFYSA-N	445.495	1.754	50	20	IDGD	
CC1CCC(N2C[C@H](C(=O)OCC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)CC2=O)CC1	731385523	NMXBRLKDMLOWSP-OGVSOVDVSA-N	446.460	1.326	50	20	IDGD	
C[C@H](NC(=O)CCC(=O)NNC(=O)c1ccncc1)C(=O)c1ccc(Br)cc1	732048650	CRGGERXMEBWAON-LBPRGKRZSA-N	447.289	1.773	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])o1	732050090	LQRVYFJVTHQLQJ-GFCCVEGCSA-N	432.389	1.027	50	20	IDGD	
C[C@@H]1Cc2ccccc2N1C(=O)[C@@H]1CCCC[C@H]1C(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1	732751880	ZGANWYXRBQRIPW-BZZMCLGOSA-N	447.557	1.353	50	20	IDGD	
CC(C)NC(=O)C(=O)NNC(=O)[C@H]1CCC(=O)N(C)[C@@H]1c1ccc(C(F)(F)F)cc1	734418783	NKYLBDUOCIUCOU-DZGCQCFKSA-N	428.411	1.287	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)[C@@H]2CC(=O)N(C)[C@@H]2c2cccc(Cl)c2)C[C@@H](C)O1	734543612	QJIGMONQYVUAJE-PNQCTFMGSA-N	436.940	1.506	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)c2cc3c(nc2O)CCCC3=O)CC1	734824693	IGSBVZSHSMVPCI-UHFFFAOYSA-N	447.492	1.650	50	20	IDGD	
CC(=O)NCCNC(=O)NNc1ccc(S(=O)(=O)NC2CCCCCCC2)cn1	735577786	YNGYBKZKNCLNND-UHFFFAOYSA-N	426.543	1.235	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNC(=O)N[C@H]2CCN(c3cnn(C)c3)C2=O)cc1	735584744	YQFOPFLKLQWPOD-SFHVURJKSA-N	428.493	1.595	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COCc2ccccc2)cc1S(=O)(=O)NC(C)(C)C	737635235	WCZZEZDSOLCSMW-UHFFFAOYSA-N	449.529	1.750	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NN=Cc2c(Cl)nc(N)nc2N2CCCC2)cc1	741767722	BQZBYVPQWMHGCO-UHFFFAOYSA-N	437.913	1.872	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)Nc1ccc(S(=O)(=O)NCC2CC2)cc1	743212485	IQXKXFOMGUPPPI-UHFFFAOYSA-N	434.474	1.312	50	20	IDGD	
COC(=O)c1ccc(F)cc1S(=O)(=O)NNC(=O)c1cccc(Br)c1	743264155	PKFQESBSGHEVKR-UHFFFAOYSA-N	431.239	1.998	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)C[C@H](C)/N=C2/NS(=O)(=O)c3ccccc32)c(C)c1	743294930	BJIHQOSTJMFPAA-HNNXBMFYSA-N	443.529	1.380	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)N[C@H]2CC(=O)N(CCOc3ccccc3)C2)c1	743636128	GBPUHSFWCGDYKK-KRWDZBQOSA-N	425.489	1.377	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	744619575	SQHZYPCDAUNMEW-UHFFFAOYSA-N	428.511	1.065	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)[C@H]2CCCN2C(=O)Cc2ccccc2)c1	744862410	NNFNGKWLYNJAIC-LJQANCHMSA-N	434.452	1.096	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)c2nnn(-c3cccc([N+](=O)[O-])c3)c2C)c1	745016039	BYJXIUWUKUYAIY-UHFFFAOYSA-N	438.400	1.410	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2cc(N3CCOC3=O)ccc2F)n1	745132995	HMRGKDBYJLDWRO-UHFFFAOYSA-N	436.421	1.094	50	20	IDGD	
Cc1nnc(-c2cccc(C(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)c2)o1	746094279	VSCSKNMQXPFYPJ-UHFFFAOYSA-N	429.458	1.370	50	20	IDGD	
Cc1[nH]nc(C(F)(F)F)c1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	746578855	BGQHEWOVYYSUJR-UHFFFAOYSA-N	445.423	1.596	50	20	IDGD	
CSCC[C@H](NC(=O)NNC(=O)Cc1cn2ccccc2n1)c1nnc2ccccn12	746739333	AQZPHQSCJBPTFE-HNNXBMFYSA-N	438.517	1.744	50	20	IDGD	
N#Cc1ccc(C(=O)NNS(=O)(=O)c2cc(Br)ccc2[N+](=O)[O-])cc1	747072856	RBQCDKJYJSTAOU-UHFFFAOYSA-N	425.220	1.852	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)NNC(=O)c1cccc(Br)c1	747508863	TXCNYFINIRVJBI-UHFFFAOYSA-N	431.250	1.315	50	20	IDGD	
Cc1c(C(=O)O)cc(Br)cc1S(=O)(=O)NNC(=O)Cc1cccnc1	747613405	HFYSGBMQKMXKBZ-UHFFFAOYSA-N	428.264	1.403	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)[C@@]1(F)CCN(C(=O)OC(C)(C)C)C1	748542798	RZJAURDNZZDZBP-GOSISDBHSA-N	433.481	1.191	50	20	IDGD	
CC(C)OCCS(=O)(=O)NCC(=O)NNC(=S)Nc1ccc(OC(C)C)cc1	748867114	VNXQRPPILAYAJZ-UHFFFAOYSA-N	432.568	1.136	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)[C@@H]1CCCN1C(=O)c1ccc2c(c1)OCO2	749561981	TURMJTSLLKRORZ-DYVFJYSZSA-N	443.431	1.774	50	20	IDGD	
C[C@@H](NC(=O)c1n[nH]c2ccccc12)C(=O)NNc1nc(Br)cn2ccnc12	750248850	YCTKTTRSVPNEFU-SECBINFHSA-N	443.265	1.630	50	20	IDGD	
Cc1cc(S(=O)(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)c(F)cc1F	753360309	IXNKARHSUOCSRU-UHFFFAOYSA-N	432.474	1.498	50	20	IDGD	
COc1ccc([C@]2(C)NC(=O)N(CC(=O)NNc3ccc(C(F)(F)F)nn3)C2=O)cc1	755197314	IAEJNBYKBSQWEI-KRWDZBQOSA-N	438.366	1.414	50	20	IDGD	
CNC(=O)c1cccc(NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1	755516058	VRHKNRONJJAKHM-UHFFFAOYSA-N	445.501	1.297	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NN=Cc1cn(C)nc1C)N(S(C)(=O)=O)CC2	755571448	BLMJUFAXCQAIAP-QGZVFWFLSA-N	449.533	1.145	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)Nc1cccc(S(=O)(=O)NC2CC2)c1	755584631	DWYASVNRELQOOP-LBPRGKRZSA-N	436.465	1.887	50	20	IDGD	
CCNC(=O)COc1ccc(NC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])cc1	755649012	YPFDVJVGATVOBY-UHFFFAOYSA-N	431.405	1.341	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c(OC)n1	756249114	UUHYMBHQCZNPPK-UHFFFAOYSA-N	449.489	1.350	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)Nc2cc(C3CC3)nn2[C@@H]2CCS(=O)(=O)C2)c1	756857923	YMCCGMBOVRYIQI-OAHLLOKOSA-N	428.474	1.458	50	20	IDGD	
O=C(NCc1cc([N+](=O)[O-])ccc1Cl)NNC(=O)C1CCN(c2ncccn2)CC1	756933173	ZKROHUIJBCLNTA-UHFFFAOYSA-N	433.856	1.785	50	20	IDGD	
CS(=O)(=O)CCn1cccc(NC(=O)NNC(=O)c2cc3ccccc3cc2O)c1=O	757779885	ARNMWISMPYTTPC-UHFFFAOYSA-N	444.469	1.218	50	20	IDGD	
O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)N1CCN(S(=O)(=O)CBr)CC1	758522104	FAIZDHJRHGLDMV-UHFFFAOYSA-N	445.295	1.445	50	20	IDGD	
Cc1c(CNC(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)cnn1C	759608454	LTKUPUZGVLLYDT-UHFFFAOYSA-N	445.487	1.575	50	20	IDGD	
O=C(NCCOc1cccc(C(F)(F)F)n1)NNC(=O)c1cc([N+](=O)[O-])ccc1O	759623470	RIZBASVQIHJNCN-UHFFFAOYSA-N	429.311	1.737	50	20	IDGD	
Cc1nnnn1-c1ccc(F)c(NC(=O)COC(=O)/C(C#N)=C/c2cc(C#N)n(C)c2C)c1	761060880	QYIPTCIVDLNFRK-GIDUJCDVSA-N	448.418	1.717	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)N[C@@H]1CC[C@H]2SCCS[C@H]12	762526392	DVQMTPUMXANXAR-YRGRVCCFSA-N	443.620	1.612	50	20	IDGD	
COc1ccccc1OC[C@@H](C)CNC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	763460465	JLYOMIHUIMDTRU-AWEZNQCLSA-N	425.449	1.330	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)C(=O)Nc1c2c(nn1-c1ccccc1)CCC2	763559777	VGQKNDNGCHDFDS-UHFFFAOYSA-N	433.424	1.489	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(CN3CCOC3=O)cc2)c2ccccc2n1	763618613	DFJHSQMYWGUUDY-UHFFFAOYSA-N	447.451	1.895	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1ccc(N2CCSCC2)cc1	763623661	FCLLJTXFRGJXQC-UHFFFAOYSA-N	438.513	1.596	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2cc(F)ccc2OC[C@@H]2CCCO2)c1	763630945	SHIQVMRPILHZLK-KRWDZBQOSA-N	445.447	1.857	50	20	IDGD	
CC(C)(C)n1nccc1NC(=O)C(=O)NNC(=O)COc1cccc(C(F)(F)F)c1	763640298	WGORDRDATLYVDZ-UHFFFAOYSA-N	427.383	1.822	50	20	IDGD	
COCc1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2-c2ccccc2)ncn1	763644733	XXZOQRIKSWYCOG-UHFFFAOYSA-N	435.440	1.455	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccc(CN2CCCCC2)c1	763657456	MWVLXHGUCKSYBL-UHFFFAOYSA-N	440.500	1.846	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccnn2Cc2ccccc2F)cc1	763660400	BTJLCCJHRYXUAK-UHFFFAOYSA-N	441.419	1.244	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)C(=O)Nc2cccc3c2OCO3)c2ccccc2c1=O	763789909	GCYCMIGWQBNRIK-UHFFFAOYSA-N	437.412	1.106	50	20	IDGD	
CCCc1c(NC(=O)C(=O)NNC(=O)Cn2nc(C)cc2C)cnn1-c1cc(C)ccn1	763891182	LCQKWIAYRPDZKJ-UHFFFAOYSA-N	438.492	1.128	50	20	IDGD	
CCOc1ccc(OC)cc1NC(=O)C(=O)NNC(=O)c1ccc(OCC)c(OC)c1	763901229	IBGDDBHSZBBHBM-UHFFFAOYSA-N	431.445	1.901	50	20	IDGD	
CCN(C(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)c2cnccn2)cc1)c1ccccc1	764025636	XRKZPFRBRNRTED-UHFFFAOYSA-N	446.467	1.472	50	20	IDGD	
CC(C)(C)S(=O)(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)Cc2ccsc2)c1	764033492	GOICQGGWSUVZLJ-UHFFFAOYSA-N	437.543	1.790	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cc(C)[nH]n2)n(-c2ccccc2C(F)(F)F)n1	764106611	NEYHTEDOKKMURB-UHFFFAOYSA-N	435.366	1.631	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2cc(C(=O)NC3CC3)ccc2C)cc1	764127242	RETDTUUBYSYWJT-UHFFFAOYSA-N	438.484	1.615	50	20	IDGD	
CC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)cc1C	764204595	PXYLXNGRYFCNCH-UHFFFAOYSA-N	435.481	1.344	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)C(=O)Nc2cccc(NC(=O)c3ccncc3)c2)c1	764236423	YGBAFJWHCJRVJS-UHFFFAOYSA-N	428.408	1.605	50	20	IDGD	
COC(=O)c1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)Cn1ccc2ccccc21	764243770	YSLBKNQVNTZMHE-UHFFFAOYSA-N	428.832	1.867	50	20	IDGD	
O=C(Cc1ccccn1)NNC(=O)C(=O)Nc1ccc(F)cc1I	764267090	NETKLDXJSHBGCV-UHFFFAOYSA-N	442.188	1.154	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1ccccc1CN1CCSCC1	764276196	ZRZHZEKZKXFULY-UHFFFAOYSA-N	444.513	1.106	50	20	IDGD	
C[C@H](NC(=O)c1n[nH]c2ccccc12)C(=O)NNc1c(F)cc(C(=O)NC2CC2)cc1F	764333592	WUAOIEQJLLCUGX-JTQLQIEISA-N	442.426	1.995	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)c(Cl)c1)C(=O)Nc1ccc(=O)n(Cc2ccccc2)c1	764346290	VKJZZMWMOXWJCA-UHFFFAOYSA-N	440.843	1.655	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccnn2Cc2cccc(Br)c2)o1	764368751	YREQXRJMVUTLFQ-UHFFFAOYSA-N	446.261	1.995	50	20	IDGD	
NC(=O)c1cc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)ccc1Cl	764380082	OCMUXZCKUJADHU-UHFFFAOYSA-N	426.763	1.197	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2ccc(C(=O)NNC(=O)c3cc(C)oc3C)o2)c(C)o1	764519812	YIWBSVXARPTTDI-UHFFFAOYSA-N	428.401	1.849	50	20	IDGD	
Cc1cc(C)cc(-c2ccc(C=NNC(=O)Cn3cnc4c3c(=O)n(C)c(=O)n4C)cc2)c1	764812433	KUSIYVRSSGXZEJ-UHFFFAOYSA-N	444.495	1.868	50	20	IDGD	
Cn1c(=O)c2c(ncn2CC(=O)NN=C2CCc3cc(Cl)cc(Cl)c32)n(C)c1=O	764817220	OLHWPBUIRGVVMS-UHFFFAOYSA-N	435.271	1.207	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NN=Cc3ccc(F)cc3C)CC2)cc1	764819591	RTNCCTQXYVDBJP-UHFFFAOYSA-N	432.521	1.899	50	20	IDGD	
COc1cc(C=O)c([N+](=O)[O-])cc1OCC(=O)NNC(=O)CSc1ccccc1O	765247735	IGZGAWPWKVXKPB-UHFFFAOYSA-N	435.414	1.440	50	20	IDGD	
Cc1sc2ncn(CC(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)c(=O)c2c1C	765317825	WRMPQYOKZHQYMJ-UHFFFAOYSA-N	437.522	1.527	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1ccc2c(c1)OCCCO2	765735306	JSHAWUZOZQUKAX-UHFFFAOYSA-N	438.484	1.067	50	20	IDGD	
CCCn1nc(C(=O)NNS(=O)(=O)c2ccc(C#N)c(C)c2)c2ccccc2c1=O	766547092	JFISKQPAPPTPQO-UHFFFAOYSA-N	425.470	1.610	50	20	IDGD	
Cc1c(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)cnn1CC(C)C	767084258	OBEMILWMQOSZFB-UHFFFAOYSA-N	434.566	1.541	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)c1cc2c(cc1F)NC(=O)CC2	767740871	WOESUDNGHFIFSI-UHFFFAOYSA-N	439.491	1.684	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2csc(-c3ncccc3F)n2)c1	768267515	TWVHZNJQVUQHSY-UHFFFAOYSA-N	449.489	1.669	50	20	IDGD	
CCC(=O)N1CCC[C@H](C(=O)NNC(=O)c2cc(-c3ccc(OC)c(OC)c3)[nH]n2)C1	768275272	ABBMLPJQOWDUAE-AWEZNQCLSA-N	429.477	1.504	50	20	IDGD	
COC(=O)c1cc(F)c(Br)c(S(=O)(=O)NNC(=O)c2ccc(C)o2)c1	769867748	AFZDQNRDIMUESZ-UHFFFAOYSA-N	435.227	1.900	50	20	IDGD	
C[C@@H](NC(=O)NNc1nc(O)c2cnn(C)c2n1)c1cc(F)ccc1N1CCC(O)CC1	770395916	NWCRGOLJTKOFQT-LLVKDONJSA-N	444.471	1.556	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)NCCS(=O)(=O)NCC1CCC1	770514852	WSIUUMWUHGDNMP-GFCCVEGCSA-N	432.930	1.157	50	20	IDGD	
CCN1CCN(c2cccc(NC(=O)C(=O)NNC(=O)Cc3c[nH]c4ccccc34)c2)CC1	770773302	FVTBGYJYLCVPAY-UHFFFAOYSA-N	448.527	1.638	50	20	IDGD	
CCOC(=O)N1[C@H](C(=O)NNc2nc(O)c3cnn(C)c3n2)CC[C@H]1c1ccc(C)o1	770982981	KGGZNYQYLGWOQC-STQMWFEESA-N	429.437	1.776	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)[C@H]3CCCN(c4ncnc5sccc45)C3)nc21	770990097	LDZWOZOCRPAMLS-JTQLQIEISA-N	425.478	1.433	50	20	IDGD	
Cc1nc2ccccc2n1CCC(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	771886381	XGEFGGQKVYZRGH-UHFFFAOYSA-N	435.893	1.497	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)[C@H](NC(=O)c1cc(Cl)ccc1F)[C@@H](C)O	772041364	KHYIRDWGKQVKEO-OHUAYANFSA-N	445.875	1.084	50	20	IDGD	
N#Cc1ccc(C=NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)c(F)c1	772832682	JBMGQWQDHBLRJB-UHFFFAOYSA-N	444.488	1.801	50	20	IDGD	
CC(C)NC(=O)Nc1cccc(C(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)c1	772897757	LRXQRVBTOBQYOM-UHFFFAOYSA-N	431.880	1.947	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)cccc1-n1cnnn1	774008808	LXVSNUAJNDYSAJ-GFCCVEGCSA-N	443.851	1.178	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NC[C@@H]2COC3(CCCCC3)O2)nc1	776064363	JVWGQWQGXKWZKH-OAHLLOKOSA-N	441.554	1.814	50	20	IDGD	
CC(C)NC(=O)Nc1ccc(C(=O)N2CCN(S(=O)(=O)CBr)CC2)cc1	777777781	PAPGEDPBSYKCAB-UHFFFAOYSA-N	447.355	1.657	50	20	IDGD	
COc1ccc2nc(NNC(=O)[C@@H](C)NS(=O)(=O)c3c(C)nn(C)c3C)c(C)cc2c1	778477147	PXOOLPJEKMTEOV-CYBMUJFWSA-N	446.533	1.712	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(-c3ncn(C)n3)cc2)cc1OC	780278037	UHIOTAVMZKHDKA-UHFFFAOYSA-N	439.428	1.117	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2ccc(S(=O)(=O)N3CCC[C@@H](C)C3)cc2)nc1	782139814	BYZSHGFHXAMWQG-CQSZACIVSA-N	447.517	1.593	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)C(=O)Nc1ccc2scnc2c1	782898034	XGEMDXLQWMMSIG-UHFFFAOYSA-N	446.514	1.298	50	20	IDGD	
COC(=O)COc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2Cl)c1	782926544	WSJLQXFOVFQYLN-UHFFFAOYSA-N	440.239	1.945	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H]2CO[C@H](C)C2)c1	784147035	WSRQOAAMUIRUHX-UKRRQHHQSA-N	433.486	1.682	50	20	IDGD	
CNS(=O)(=O)c1cc(NC(=O)C(=O)NNc2ccc(Br)cn2)ccc1C	784338822	CERJZPFLGFZUDD-UHFFFAOYSA-N	442.295	1.142	50	20	IDGD	
CN(C)CCC(=O)Nc1ccc(NC(=O)C(=O)NNc2ccc(Br)nc2)cc1	784806669	NPDQPYRVFYDOGX-UHFFFAOYSA-N	449.309	1.816	50	20	IDGD	
COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NNc1c(F)cc(C(=O)NC2CC2)cc1F	785100109	PMTOQTAMPNKJON-UHFFFAOYSA-N	449.370	1.856	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)c2cc([C@@H]3CCN(C(=O)OC(C)(C)C)C3)[nH]n2)n1	786670443	REAYGQQDLNSJTC-CQSZACIVSA-N	431.497	1.409	50	20	IDGD	
CC(C(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)=C1CN(C(=O)OC(C)(C)C)C1	786967468	QGXORYJOTULQGZ-UHFFFAOYSA-N	448.432	1.466	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2nc3c(s2)CCCC3)n[nH]1	789739463	OPEKYWHZVPBAOI-UHFFFAOYSA-N	440.485	1.820	50	20	IDGD	
CC(=O)NC[C@H]1CCn2ncc(C(=O)NNC(=O)CCSc3ccc(F)cc3)c2C1	792736238	GISYEOXWPXBQJU-AWEZNQCLSA-N	433.509	1.664	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(O)ccc2[N+](=O)[O-])c1	794741813	PQPVUUOAOPHZGF-UHFFFAOYSA-N	436.446	1.406	50	20	IDGD	
CO[C@H]1CCC[C@H](CC(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)C1	795107819	FSXJIBBDRWRGMX-HOTGVXAUSA-N	425.555	1.056	50	20	IDGD	
Cc1nc2cc(F)c(F)cc2n1CC(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	796016180	ZQPLTRXGIXHUDV-UHFFFAOYSA-N	447.354	1.536	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CN2CC[C@H](N3CCN(C(=O)OC(C)(C)C)CC3)C2)cc1	796620366	ZKFAOOINFYQTJC-IBGZPJMESA-N	445.564	1.383	50	20	IDGD	
CN(C)NC(=O)Nc1cccc(NC(=O)Cn2c(=O)ccn(Cc3ccccc3)c2=O)c1	798130012	FXDABXCNTJPVBW-UHFFFAOYSA-N	436.472	1.295	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](Cc2cccc(F)c2)n2nnnc2C)cc1C	798308191	SPPUGZQQTOPCDV-GOSISDBHSA-N	439.451	1.307	50	20	IDGD	
O=C(NCC(F)(F)F)NNC(=O)c1cccn2c(I)cnc12	798315675	ZEVYVKSFUSJDOQ-UHFFFAOYSA-N	427.124	1.445	50	20	IDGD	
O=C(NNc1ccc(F)cc1)C(=O)Nc1cnc(N2CCOCC2)c(Br)c1	799257534	FLSJFWKNUMJSOF-UHFFFAOYSA-N	438.257	1.902	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)c(C)c(OC)c1	800629650	WEPBGGUPBXEARC-UHFFFAOYSA-N	448.501	1.535	50	20	IDGD	
C[C@]1(c2ccc(Br)cc2)NC(=O)N(CC(=O)NNc2ncccc2F)C1=O	804219543	LJPFLDABPOPMLG-QGZVFWFLSA-N	436.241	1.894	50	20	IDGD	
CN(C)S(=O)(=O)C[C@@H](NC(=O)NNC(=O)c1cccc(OC(F)F)c1)C(F)(F)F	805066330	YSQQONJQSUUGBB-SNVBAGLBSA-N	448.370	1.054	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)NCc2ccncc2OC[C@H]2CCOC2)nc2ccccc21	807616282	RJIGPDDZDFFGFZ-HNNXBMFYSA-N	438.488	1.457	50	20	IDGD	
CN(C)c1c(C=NNC(=O)c2cc(-c3ccco3)nc3ccccc23)c(=O)n(C)c(=O)n1C	807951036	DZQGPDRFXUXWIP-UHFFFAOYSA-N	446.467	1.722	50	20	IDGD	
COC[C@@]1(C(=O)NNc2nccc(N3CCOCC3)n2)CCN(C(=O)OC(C)(C)C)C1	810558981	IGCMGTZQBGOGSF-HXUWFJFHSA-N	436.513	1.030	50	20	IDGD	
CC(=NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1)c1cc(CO)on1	812222784	ROGDSXIEFHIUDE-UHFFFAOYSA-N	428.470	1.799	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(=NNC(=O)Cc2cc(O)nc(O)n2)[C@@H]([C@@H]2CCOC2)C1	812226856	VEHFWPLJZHPVAP-TZMCWYRMSA-N	435.481	1.196	50	20	IDGD	
COC[C@@]1(CNC(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)OCCc2ccccc21	812476993	FMCHFNZUOPXACJ-HSZRJFAPSA-N	440.500	1.687	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1ncc(C(F)(F)F)s1	812988661	IIKAMSBPQWSTQL-UHFFFAOYSA-N	438.409	1.656	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)ccc1Cl	813033467	UZBUKMMSOUEDCV-UHFFFAOYSA-N	426.882	1.681	50	20	IDGD	
CCn1c(NNC(=O)c2c(I)cnn2C)nc2ccccc2c1=O	814269695	BMVDJVOHBSVPEK-UHFFFAOYSA-N	438.229	1.511	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)C(=O)Nc2cn(C)nc2OC)c1	815865655	BBWCFCIOCOUZGA-UHFFFAOYSA-N	426.227	1.060	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)C(=O)Nc2cn(C)c(=O)cc2C)c1	815866196	SHOCFBVMNPJXPC-UHFFFAOYSA-N	437.250	1.325	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)/C=C\CN(C)CC(F)(F)F)n[nH]2)cc1OC	815887215	YGKLYGTXVISMFE-PLNGDYQASA-N	441.410	1.905	50	20	IDGD	
COc1ccc(-c2nnc(S)n2CC(=O)NNC(=O)CNc2ccccc2OC)cc1	825643515	CGZNYYJZELSDII-UHFFFAOYSA-N	442.501	1.511	50	20	IDGD	
Cc1ccc([C@@]2(C)NC(=O)N(CC(=O)NNC(=S)NCCc3cccs3)C2=O)cc1	838851456	ZCXHGALZOHXJGB-HXUWFJFHSA-N	445.570	1.562	50	20	IDGD	
Cc1cc(S(=O)(=O)Nc2ccccc2C(=O)N2CC[C@@H](B(O)O)C2)cc([N+](=O)[O-])c1C	864233178	HQADBMYODQXQMC-CQSZACIVSA-N	447.278	1.701	50	20	IDGD	
CS(=O)(=O)CC[C@H](Cc1cccc(Br)c1)C(=O)N1CC[C@H](B(O)O)C1	864234879	XUGOGIJTAPQHMK-KGLIPLIRSA-N	432.145	1.118	50	20	IDGD	
COCCCNC(=S)N(C)NC(=O)c1ccccc1S(=O)(=O)N1CCCCC1	871595837	SZFZOYMEZSOWES-UHFFFAOYSA-N	428.580	1.349	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(/C#N)C(=O)O[C@H](C)C(=O)N2CCC[C@@H](C(N)=O)C2)c1C	913150253	QQHMEDGSGSJBTA-HDAOJYPJSA-N	444.532	1.875	50	20	IDGD	
C=CCNC(=S)NNC(=O)c1ccc(Cl)c(S(=O)(=O)N2C[C@H](C)O[C@H](C)C2)c1	913435558	ASSXPOVOQLKEDA-TXEJJXNPSA-N	446.982	1.433	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc23)c2ccccc2c1=O	914750548	LUQMRBNRZCHZBG-UHFFFAOYSA-N	435.400	1.666	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)[C@@H](Cc2ccc(F)cc2)n2nnnc2C)c1	915691083	KKZHHONZIDSMRI-GOSISDBHSA-N	428.424	1.383	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)Nc1ccccc1Cl	915879519	IWIOWGNXKCDGKA-UHFFFAOYSA-N	438.893	1.827	50	20	IDGD	
O=C(NCc1ccncc1)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	915882439	PVWFYBXKYQMGOT-UHFFFAOYSA-N	439.497	1.704	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NCCc2ccc(OC(F)F)cc2)c2ccccc2c1=O	915924726	DKOYXBABEYBQJG-UHFFFAOYSA-N	431.399	1.722	50	20	IDGD	
CCc1ncncc1C(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	916034081	OPOBTRIBYWGWBC-UHFFFAOYSA-N	428.452	1.872	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)NCCCN2C(=O)NC3(CCCCC3)C2=O)c1	916268784	QVDODCPAMJHESM-UHFFFAOYSA-N	430.509	1.341	50	20	IDGD	
Cc1ncc2c(n1)CC[C@@H](NC(=O)NNC(=O)CCN1CCN(c3ccccc3)CC1)C2	916320164	HIJGOJUUOCNUIT-LJQANCHMSA-N	437.548	1.185	50	20	IDGD	
CN(CCCNC(=O)NNC(=O)COc1ccccc1Cc1ccccc1)S(C)(=O)=O	916580392	UUQUGBOOWVJAMM-UHFFFAOYSA-N	448.545	1.268	50	20	IDGD	
O=C(COC(=O)c1nn(-c2ccccc2)cc1O)NNC(=O)c1cccc([N+](=O)[O-])c1	917944958	IPRJJUWJGIDDAB-UHFFFAOYSA-N	425.357	1.104	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)N1CCCCC1	918122132	WNHPZCMTEOULKE-MRXNPFEDSA-N	437.566	1.290	50	20	IDGD	
COc1cc([C@H](C)NC(=O)NNC(=O)C(=O)NC2CC2)ccc1OCc1ccncc1	918227605	HEBSMGFXKAZBSR-ZDUSSCGKSA-N	427.461	1.339	50	20	IDGD	
Cc1oc(C)c(S(N)(=O)=O)c1C(=O)OCC(=O)C(C#N)=C1N(C)c2ccccc2N1C	919134827	RAEDDAHXHLJBKY-UHFFFAOYSA-N	444.469	1.591	50	20	IDGD	
CCCS(=O)(=O)Nc1ccccc1C(=O)OCC(=O)NNC(=O)c1ccc(C)cc1	919559058	GBHUYHFCUFEDSQ-UHFFFAOYSA-N	433.486	1.765	50	20	IDGD	
C[C@@H]1C[C@@H](C)CN(C(C)(C)CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)C1	919788928	XEILYQJCMALTPC-HUUCEWRRSA-N	438.598	1.680	50	20	IDGD	
N#Cc1ccccc1COc1ccc(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)cc1	919886823	VHYWQNDHAUCOAK-QGZVFWFLSA-N	428.470	1.268	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2ccc(OCCOC)nc2)c2ccccc2c1=O	920213170	RRDMYGYUEDANMX-UHFFFAOYSA-N	426.433	1.303	50	20	IDGD	
CC(C)C[C@@H](/N=C1/NS(=O)(=O)c2ccccc21)C(=O)NNC(=O)NCc1ccco1	920856622	VRFKMHGGZRBGRS-OAHLLOKOSA-N	433.490	1.263	50	20	IDGD	
CSC[C@H](C(=O)NNC(=O)NCCc1cccs1)N1C(=O)[C@H]2CCCC[C@@H]2C1=O	920860470	FHCUWQVUGBGXAJ-SOUVJXGZSA-N	438.575	1.528	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)Nc2cccc(CN3CCC[C@H]3C(N)=O)c2)c1	920930305	FSRSYLUFWZUYSV-FQEVSTJZSA-N	439.516	1.985	50	20	IDGD	
CN1C(=C(C#N)C(=O)COC(=O)CNS(=O)(=O)c2ccccc2)N(C)c2ccccc21	1317776998	OUDOXCLTKOFUFA-UHFFFAOYSA-N	440.481	1.399	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ncoc2[C@H]2CCCO2)c1	1339125905	MVVWCQSHYLLXGH-OAHLLOKOSA-N	436.490	1.631	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2)c1cc(-c2ccco2)no1	1777838204	QFBJVVVRTJLHIN-WIBUTAKZSA-N	437.880	1.662	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2)c1ccc2cc(O)ccc2n1	1778508430	YDSPCFFQCMFCSL-WOIUINJBSA-N	447.919	1.668	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)/C=C/c3cc(C)on3)C2)C1	1779132942	YSVBIPLFWNEGDN-CHABLROBSA-N	426.311	2.000	50	20	IDGD	
C=C(C)CC(C)(C)C(=O)N1CC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1	1779240039	DUAIQHSERUXMNO-JOCHJYFZSA-N	429.521	1.121	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cc(-c3cccnc3)[nH]n1)CCO2	1779298183	GVJIGBINOPUVHV-OAQYLSRUSA-N	443.580	1.767	50	20	IDGD	
COc1nc(C)ccc1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2	1779738088	IBKFJLGHTJHRCC-ORAYPTAESA-N	440.338	1.873	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cn(C(C)(C)C)nn3)C2)C1	1780355933	CJNOUQGXUYPWDQ-SJCJKPOMSA-N	428.331	1.260	50	20	IDGD	
CC1CCN(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](F)Br)C2)CC1	1780770417	NAHNXCMZDFPNTB-HHXXYDBFSA-N	448.377	1.923	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)[C@@H]3Cc4ccccc4CN3)CCO2)C1	1781227484	MJFFZSARQWGEQY-WMQCIHAUSA-N	440.371	1.767	50	20	IDGD	
CCOC(=O)C1(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)CO[Si](C)(C)C)C3)CC1	1781620911	CZRJSVAWOXRNBR-OXQOHEQNSA-N	440.613	1.695	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnc(N(C)C)o1)C2	1781996571	NPNBLBDUEUZPPC-RVZJWNSFSA-N	443.342	1.652	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3nc4cc([N+](=O)[O-])ccc4[nH]3)C2)C1	1782187318	YULPVHFPBQEYLU-DJJJIMSYSA-N	435.868	1.932	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3n[nH]c4ccc(C#N)cc34)C2)C1	1782198880	XRGAUIGRVAEHNJ-BLVKFPJESA-N	446.305	1.661	50	20	IDGD	
O=C(C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](Br)Cc3ccccc3)C2)C1)C1CC1	1783017833	FXCGLNIIKPJCLG-LAUBAEHRSA-N	449.345	1.802	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)Cc3cccc(OC)n3)CCO2)C1	1783342089	GQIUHDLMTNHTPO-HNAYVOBHSA-N	440.338	1.636	50	20	IDGD	
CC(C)Cc1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc1	1783935504	VMONZJJIHRJJCI-DEOSSOPVSA-N	444.576	1.702	50	20	IDGD	
O=C(Cc1cnc2ccccn12)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21	1784048787	FNLGBFVODGTPNF-QEJZJMRPSA-N	425.316	1.660	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3c[nH]c4nccc-4c3Cl)C[C@@H]21)[C@H](O)CCl	1784090791	MXVUUXWNSOBGBT-HPEDKQMDSA-N	441.315	1.361	50	20	IDGD	
COC(=O)c1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]3C2)c(C)c1	1787451402	NHGXUDRBOZUPTN-QSPRXWTASA-N	426.872	1.909	50	20	IDGD	
CC(C)N1CCC[C@H]1C(=O)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1	1788145417	PHDUWQUDASJMTH-QFIPXVFZSA-N	449.360	1.987	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3Cc4ccccc4CN3)C[C@@H]21	1788765316	ZPQXKRCCCSOGBU-TUFLPTIASA-N	445.636	1.532	50	20	IDGD	
Cc1onc(-c2ccncn2)c1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21	1789191910	FCUCWYWRLDCDJB-GWIFVGGISA-N	437.859	1.568	50	20	IDGD	
CCOc1ccccc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]21	1789479330	KKWXQNSMIFFAMJ-QRFRQXIXSA-N	446.548	1.052	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21)[C@H]1CC[C@@H]2CCC(=O)N2C1	1789770625	ABIJFUUNPNDFFX-RMEBNNNOSA-N	432.348	1.171	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nnc4cc(C)nn4c3C)C[C@@H]21	1789859678	KNGARXXMJTVIST-VGWMRTNUSA-N	434.928	1.352	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]2C1	1789924700	BIXCNLUBCXAVAE-QNWJLWSRSA-N	439.278	1.218	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(OC)cc3F)[C@H]2C1	1790049374	ZXPXXVRLNTULIV-PTOXDTDZSA-N	428.888	1.681	50	20	IDGD	
CN(CC(=O)NC1(c2ccc(NC(=O)[C@](C)(Cl)CCl)cc2)CCC1)C(=O)C(=O)O	1790494096	WLHATWYVGFAGBC-GOSISDBHSA-N	444.315	1.900	50	20	IDGD	
CCN(CC)C[C@@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CO[Si](C)(C)C)C[C@@H]21	1790602962	QHCIYHVTUYIIEY-XWSJACJDSA-N	427.662	1.796	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1ccc(Cl)c(F)c1)c1ccc(B(O)O)cc1	1792840071	XQQVUQBRVWTTEJ-BCDXTJNWSA-N	444.699	1.653	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN(C)C(=O)c1ccccc1	1793227796	IHFLWUHFEBLSOB-DMUMMCEESA-N	435.952	1.756	50	20	IDGD	
C#CCCCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1793879251	SLPSOFJLJOUJPR-DFGXFYAUSA-N	441.956	1.512	50	20	IDGD	
COc1cc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Br)C3)ccn1	1793901725	RYNUYFZGOOBYNZ-DLTLXFJOSA-N	444.301	1.303	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1nc(Cl)ccc1F)c1cccc(B(O)O)c1	1794524135	MAJUPIVPMCHNBV-QDMKHBRRSA-N	431.660	1.120	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)Nc1cccnc1	1795611779	ROKQWZXBNKKWMS-IPVBOJNNSA-N	425.327	1.255	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2ccccn2n1	1796831357	UJKACSXSFPLPLH-ZJOBFFGXSA-N	435.322	1.569	50	20	IDGD	
C#CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](Cl)CC	1799273847	ROCXHTGOECIKHU-QEOTZNIISA-N	441.956	1.510	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccccc1-n1nccn1	1799672028	ZBKFMQFRGXNXDG-ZJOBFFGXSA-N	448.321	1.254	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H]2C[C@]21C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2	1800849820	QIRBMFFDFAUQKP-NMQXAITKSA-N	445.919	1.510	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/c1ccc(O)cc1Cl)C2	1800981820	SYSODLYWXYOKLT-UYDRDUHSSA-N	443.327	1.902	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1=COCC1	1801543749	KIHOUFQUYLZCSR-FZKCQIBNSA-N	443.928	1.012	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](Br)Cc1ccccc1)C2)C1=COCC1	1801548881	QZYBJNHKQWYJPV-RDGPPVDQSA-N	449.345	1.886	50	20	IDGD	
COc1ccc(F)c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Br)C3)c1	1801716725	XWQZKSZCYIDATF-OWLDWWDNSA-N	433.249	1.728	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2	1802123952	XSNBUTNCSLSKPT-DABQJJPHSA-N	438.352	1.685	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc3ncnn3c2)[C@H]1c1cccnc1)[C@H](O)CCl	1803142784	JDXLCVRAEGAYNU-LESCRADOSA-N	428.880	1.044	50	20	IDGD	
O=C(CN1CCOC1=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@@H]1c1cccnc1	1803337817	ROPVXWOUEBJSPO-NWANDNLSSA-N	443.273	1.230	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)CCN2C(=O)C=CC2=O)[C@H]1c1cccnc1	1803686197	LGZJXUSZAZZEBA-FIKGOQFSSA-N	446.935	1.810	50	20	IDGD	
N=C(N)SCCC(=O)N1CC[C@H](CNC(=O)CCBr)[C@@H]1c1cccnc1	1806340865	PASPNQFYUXXSIY-CJNGLKHVSA-N	442.383	1.889	50	20	IDGD	
COc1ccc(CC(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)cc1	1806582849	FDCHDVPSEBBQCY-HFSMHLIXSA-N	431.920	1.938	50	20	IDGD	
O=C(C[C@@H]1CCCCO1)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1	1809968822	GDCHYDJUTGSNEL-FQEVSTJZSA-N	428.338	1.170	50	20	IDGD	
Cc1cncc(CCC(=O)N2CCC3(CCCN(C(=O)c4ccc(B(O)O)cc4)C3)CC2)c1	1809969355	RVVWGYQIVWCELN-UHFFFAOYSA-N	449.360	1.547	50	20	IDGD	
CC(=O)NC(C)(C)C(=O)N1CC[C@H](CNC(=O)CO[Si](C)(C)C)[C@H]1c1cccnc1	1810537509	JAAJBGHXULHLOH-IEBWSBKVSA-N	434.613	1.854	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2cccn(C)c2=O)[C@H]1c1cccnc1	1813028954	ZBRAELSAUAZSFM-SZMVWBNQSA-N	432.908	1.354	50	20	IDGD	
Cc1ccc(CC(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2ccc(B(O)O)cc2)CC3)cc1	1813978255	BIFUXQOKDYKTRY-GOSISDBHSA-N	449.341	1.600	50	20	IDGD	
C=CCOCCCC(=O)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1	1815350347	RPYYIBJJTPZBGK-INIZCTEOSA-N	443.334	1.032	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)CCc3cnn(C)c3)sc2C1	1815438070	WUKCBKULRIZWRB-CHWSQXEVSA-N	425.942	1.675	50	20	IDGD	
CC(C)(CCl)C(=O)N[C@H]1CCc2nc(NC(=O)c3cnc(O)nc3O)sc2C1	1817078373	XOKKQHVLIBGOQA-QMMMGPOBSA-N	425.898	1.835	50	20	IDGD	
CC(C)=NO[C@@H](C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1	1817472519	NJBQCZPIJBNVSW-KSSFIOAISA-N	441.297	1.196	50	20	IDGD	
C=CCSCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1	1817474134	NHOYKIKFUVKTRG-QGZVFWFLSA-N	428.323	1.315	50	20	IDGD	
CNC(=S)NCCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)CO[Si](C)(C)C)n[nH]1	1819595669	VSHDFGSDAABNNX-CQSZACIVSA-N	440.646	1.737	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)N[C@@H]1CCc2nc(NC(=O)CO[Si](C)(C)C)sc2C1	1820164726	GFURLKFEYHYXPV-DGCLKSJQSA-N	426.615	1.773	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)c3ccnnc3O)sc2C1	1821101656	AGRDNAUFZBYVOZ-SFYZADRCSA-N	426.296	1.648	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1)[C@H]1CC(c2ccccc2)=NN1	1821611735	XUSYDHSZJLJDCD-FGTMMUONSA-N	444.923	1.768	50	20	IDGD	
C[C@H](Br)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CN2CCOC2=O)[nH]n1	1822183378	BVWCJPKSXGWJTL-CMPLNLGQSA-N	428.287	1.637	50	20	IDGD	
O=C1C[C@H](C(=O)Nc2cc([C@@H]3CCCCN3C(=O)[C@@H](F)Br)[nH]n2)CCN1	1822486271	VGGWEBYTHXJELP-OLUVUFQESA-N	430.278	1.619	50	20	IDGD	
Cc1ccn2c(C(=O)Nc3nc4c(s3)C[C@H](NC(=O)[C@@H](O)CCl)CC4)cnc2c1	1824298909	CBDRUQDXQHBRMF-RISCZKNCSA-N	433.921	1.925	50	20	IDGD	
Cc1ccc(CC(=O)N2CCCC[C@@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)cn1	1825297805	PTKCNJRDNKVKRO-OAQYLSRUSA-N	443.592	1.925	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)Cn1cncn1)CC2	1825446267	ASYHEMDJKSCOTD-UWVGGRQHSA-N	427.328	1.520	50	20	IDGD	
CC[C@H](NC(C)=O)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](C)Br)sc2C1	1825631925	NEJDBWJGVPGGRA-IEBDPFPHSA-N	431.356	1.753	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CN2CCOCC2)CC1	1826717723	HWNBOCSFNOQSMO-RDJZCZTQSA-N	430.387	1.722	50	20	IDGD	
O=C(c1cc(-c2ccccc2)on1)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1	1829589623	VFECQIQVPDQXFB-UTKZUKDTSA-N	449.891	1.011	50	20	IDGD	
Cc1cc(C)n(CCC(=O)N2CCOC[C@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)n1	1830369896	DPQQULZYDASXMV-NRFANRHFSA-N	440.972	1.611	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3CCC(O)CC3)C2)C1	1830544038	LQNIMXJGTQNXNA-QAVIERHMSA-N	447.370	1.025	50	20	IDGD	
Cc1cccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)n1	1830920999	CLYFJTITEMXXFQ-FUHWJXTLSA-N	444.301	1.079	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CC[C@@H](N)C(N)=O)CC1	1831550466	WHIZDQQIEVUVCO-XHSDSOJGSA-N	445.402	1.372	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)Cc2ccccn2)CC1	1831870560	AKWYKRCTVLIZHO-HXUWFJFHSA-N	429.565	1.617	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3scnc3C3CC3)CC2)CC1)[C@@H](O)CCl	1833308048	GVQDXADCALWGPK-INIZCTEOSA-N	440.997	1.805	50	20	IDGD	
C[C@H](Cc1ccccn1)C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)CCl)CC2)CC1	1833313154	XULYTQCDUBMULB-OXQOHEQNSA-N	436.984	1.432	50	20	IDGD	
O=C(CCBr)NC1CCN(C2CCN(C(=O)/C=C/c3cnc[nH]3)CC2)CC1	1834423537	QBYHOYWUVNHBKW-OWOJBTEDSA-N	438.370	1.780	50	20	IDGD	
O=C(COc1ccc(F)cc1)NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1834472426	KAZPAHNZMXBUDX-LJQANCHMSA-N	441.931	1.376	50	20	IDGD	
O=C(c1scnc1C(F)(F)F)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1834571642	XDHTXWBFAZMAOQ-SMDDNHRTSA-N	445.822	1.766	50	20	IDGD	
O=C(COc1ccc(F)cc1)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836716837	UEKMVMYZSMOPMN-LJQANCHMSA-N	442.915	1.803	50	20	IDGD	
O=C(c1cc2n(n1)CCCC2)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836717648	ZUJYBGYTSZBFFO-LJQANCHMSA-N	438.956	1.431	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)C(=O)c3ccccc3)C2)C1	1837712206	JCWGTLIKGFUDNL-NRFANRHFSA-N	434.565	1.177	50	20	IDGD	
COCCOCC(=O)N1CCC(OC2CCN(C(=O)[C@H](F)Br)CC2)CC1	1837768225	KBCKLDAFRNTFAT-INIZCTEOSA-N	439.322	1.339	50	20	IDGD	
Cn1cc(CC(=O)N2CCC(OC3CCN(C(=O)CO[Si](C)(C)C)CC3)CC2)cn1	1838432307	LVRBFGSJRRJBFE-UHFFFAOYSA-N	436.629	1.813	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3c(F)cccc3F)C2)C1	1839146607	QIUISSPELISPSO-MGPUTAFESA-N	430.879	1.981	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3cccnc3)C2)C1	1839152204	RBACPJCLLPQTKU-PMACEKPBSA-N	444.359	1.707	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCBr)C3)C2)cc1O	1839265828	QVLZCRVJNFGRTI-LJQANCHMSA-N	441.322	1.556	50	20	IDGD	
CCSc1ncccc1C(=O)N1CCCC12CN(C(=O)c1cccc(B(O)O)c1)C2	1840989398	IWVWIEXKRJOLRG-UHFFFAOYSA-N	425.319	1.004	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)[C@@H](O)c2ccco2)C1	1841071193	PXPARRYHOGKUGM-SFHVURJKSA-N	443.412	1.664	50	20	IDGD	
O=C(CCBr)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1	1843441858	GFEVQHHXYPKMAB-UHFFFAOYSA-N	433.306	1.768	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)c2nc3c(=O)[nH]c4ccccc4n3n2)C1	1843808482	FPWFBPCVLJLZGY-ZDUSSCGKSA-N	442.907	1.795	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC2(CCCN2C(=O)[C@@H](C)NC(=O)c2ccc(F)cc2)C1	1845004502	POWXTESTGCCKTK-CHWSQXEVSA-N	440.313	1.931	50	20	IDGD	
CCOc1ccc(Cl)cc1C(=O)N1CCCC12CN(C(=O)CCC(=O)NN(C)C)C2	1845395393	HTEVRAGSFMMXMY-UHFFFAOYSA-N	436.940	1.929	50	20	IDGD	
COc1ccc(C)c(C(=O)N2CCCC23CN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C3)c1	1845407983	YFCMTRRBHAPFOG-PCLIKHOPSA-N	437.500	1.955	50	20	IDGD	
C[C@H](NC(=O)c1ccc(F)cc1)C(=O)N1CC2(CCCN2C(=O)[C@@H](C)Br)C1	1846178474	ZPFQXJUMPFFQIW-OLZOCXBDSA-N	440.313	1.931	50	20	IDGD	
Cc1cc(C(=O)N2CC3(CCCN3C(=O)CCC(=O)NN(C)C)C2)c(C(F)(F)F)o1	1846384421	RACLCFXXTDNZER-UHFFFAOYSA-N	430.427	1.797	50	20	IDGD	
O=C1c2ccccc2C(=O)N1CCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CCBr	1848085247	PDTWKGIJJYXQBE-HOTGVXAUSA-N	448.317	1.660	50	20	IDGD	
Cc1cc(=O)c(C(=O)NNC(=O)Cc2nc3ccccc3n2C)nn1-c1ccccc1F	15855474	YGCQHTYLQHXOMM-UHFFFAOYSA-N	434.431	1.570	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)CCNC2=NS(=O)(=O)c3ccccc32)o1	109019620	HUSCCFNROAXBGI-UHFFFAOYSA-N	447.517	1.011	50	20	IDGD	
O=C(Cc1ccc(S(=O)(=O)N2CCCC2)s1)NNc1nc(-c2ccncc2)no1	726369758	GTOYXNOSTOHZBN-UHFFFAOYSA-N	434.503	1.663	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)[C@@H]2Cc3ccccc3N2C(C)=O)c2ccccc2c1=O	726499005	QECDNKCMTHPCCN-IBGZPJMESA-N	433.468	1.545	50	20	IDGD	
COc1ccc(C(=O)Nc2cc(F)ccc2C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)cc1	726524053	OFUHESNYUBPNMU-CYBMUJFWSA-N	449.460	1.282	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)N[C@H](C)C(=O)N1CCCC[C@H]1C	726610896	MPOZUCGXULXHHJ-TZMCWYRMSA-N	438.554	1.022	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2csc(-c3cnccn3)n2)c2ccccc2c1=O	728231824	PHTIJVFLOVBHGC-UHFFFAOYSA-N	435.469	1.795	50	20	IDGD	
CC(=O)N(c1ccc(Cl)cc1)c1nc(C=NNC(=O)[C@@H](C)NS(C)(=O)=O)cs1	728434972	RSSXKZHJZOAKJC-SNVBAGLBSA-N	443.938	1.869	50	20	IDGD	
N#Cc1cccc(C(=O)NNS(=O)(=O)c2ccc(S(=O)(=O)N3CCCCC3)cc2)c1	728853309	CLFIJTKHVDRRBN-UHFFFAOYSA-N	448.526	1.356	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)c2ccccc2F)cc1Br	729166997	CZHQQIQKFQTVJN-UHFFFAOYSA-N	444.282	1.913	50	20	IDGD	
N#Cc1ccc(Oc2ccc(C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)cc2)nc1	732051738	CYAWLLVETWOOHY-UHFFFAOYSA-N	426.396	1.796	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)CC2CCN(C(=O)OC(C)(C)C)CC2)C[C@H](C)O1	732259260	BNQSMOOKLDWNQN-HOTGVXAUSA-N	426.558	1.670	50	20	IDGD	
O=C(COC(=O)[C@@H]1CC(=O)N(c2ccc(F)cc2)C1)NNC(=O)c1cccc([N+](=O)[O-])c1	732340893	AGHLJEZARPTGHU-CYBMUJFWSA-N	444.375	1.091	50	20	IDGD	
O=C(NNC(=O)c1ccc(Br)s1)N[C@H]1CCN(CC(F)(F)F)C1=O	732573821	ZOUSBFBBDJWLEZ-LURJTMIESA-N	429.218	1.618	50	20	IDGD	
C[C@@]1(NNC(=O)N[C@@H]2CCN(c3cccc(OC(F)(F)F)c3)C2)CCS(=O)(=O)C1	734067329	JQFGFINCZZNMQE-MLGOLLRUSA-N	436.456	1.545	50	20	IDGD	
COc1ccnc(C(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)c1	734809135	DWWFBNLBRNQPRW-UHFFFAOYSA-N	429.440	1.867	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)N1CCc2ccccc2C1	743523586	BCWGUDQVZIJDAF-OAHLLOKOSA-N	445.545	1.873	50	20	IDGD	
CCOc1ccc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)CCCC(N)=O)cc2)cc1	746347608	YWOSMXFBPXOJBD-UHFFFAOYSA-N	448.501	1.303	50	20	IDGD	
CN(CC(=O)NNC(=O)[C@@H]1COc2ccccc2O1)c1ccc(C(F)(F)F)cc1C=O	746447131	RCEGLRRRIBUACB-KRWDZBQOSA-N	437.374	1.942	50	20	IDGD	
CCCn1c(=O)nc(O)c2c(C(=O)NNc3nc(C)cc(OC)n3)cc(C3CC3)nc21	746627271	LGFXFEGWWDKLTJ-UHFFFAOYSA-N	425.449	1.648	50	20	IDGD	
COc1cc(C)nc(NNC(=O)CCNS(=O)(=O)c2ccc(OC(F)(F)F)cc2)n1	746630732	NEHCQOTZLUQVBQ-UHFFFAOYSA-N	449.411	1.504	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCC(=O)NC1CCCC1	746726599	WZAPIOJJNWYYMH-NSHDSACASA-N	427.299	1.606	50	20	IDGD	
Cc1csc([C@](O)(CC(=O)NNC(=O)c2nnc(O)c3ccccc23)C(F)(F)F)n1	746818341	XGLDMMCEHWOWOT-MRXNPFEDSA-N	441.391	1.702	50	20	IDGD	
CC(C)c1nc(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)nn1-c1ccccc1Cl	748232183	KOZJXQUGDIYYJQ-LLVKDONJSA-N	440.913	1.175	50	20	IDGD	
NS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)CC23CC4CC(CC(C4)C2)C3)cc1	748545815	ZGAMXDOJAXLZPV-UHFFFAOYSA-N	434.518	1.026	50	20	IDGD	
Cc1ccccc1NCCC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	748619581	LCZMDBDDWVRORI-UHFFFAOYSA-N	431.562	1.876	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)N[C@@H]1CCN(c2cccc(OC(F)(F)F)c2)C1	748636843	XYOINJZLGPIAOJ-CHWSQXEVSA-N	434.415	1.546	50	20	IDGD	
O=C(NNC(=O)c1ccc2nncn2c1)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	749402955	CRMUJEAXXXQYOC-UHFFFAOYSA-N	439.439	1.506	50	20	IDGD	
O=C(CCC/N=C1/NS(=O)(=O)c2ccccc21)NNC(=O)c1cc2ccccc2o1	749477755	SINSPIAFUHWVMK-UHFFFAOYSA-N	426.454	1.713	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)c1csc(N2CCOCC2)n1)CNC(=O)OC(C)(C)C	749768029	HLHDPJPNQUFFKY-GFCCVEGCSA-N	442.542	1.085	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN[C@@](C)(C(N)=O)c2cccc(C(F)(F)F)c2)n1	750056320	JBOGKQIECQSCHQ-QGZVFWFLSA-N	443.451	1.151	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)N[C@@H]2CCN(c3cccc(Cl)c3)C2=O)cc1	750671985	WPJHQSBQWCZGFR-QGZVFWFLSA-N	432.864	1.863	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)Cc1csc(-c2ccc3c(c2)OCO3)n1	751211252	FHUDQPRYICMJDL-UHFFFAOYSA-N	444.494	1.720	50	20	IDGD	
CCOCCC1(CNC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)CC1	752687564	RUJRZAUIASYGOU-UHFFFAOYSA-N	438.550	1.622	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2ccc(-n3cccc3)nc2)cc1	753276419	IMVMCIKWRWEDFB-UHFFFAOYSA-N	427.486	1.262	50	20	IDGD	
O=C(COc1ccc(OCc2ccccc2)cc1)NNC(=O)[C@H]1CCCCS1(=O)=O	753614552	UQDXGSYGSAEHFI-LJQANCHMSA-N	432.498	1.759	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C(=O)Nc1cc2c(cc1C(=O)OC)OCO2)c1ccccc1	753839989	FTURLYKQWVBPHT-ZDUSSCGKSA-N	427.413	1.482	50	20	IDGD	
C[C@H](NCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	754319181	PMTLPFPEAXRYOU-GOEBONIOSA-N	449.508	1.981	50	20	IDGD	
C[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	755314799	ZTEXJUYPIRDURV-QZTJIDSGSA-N	447.580	1.895	50	20	IDGD	
CCc1nc(C=NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c2ccccn12	755466521	FIVFEKPCXPECAE-UHFFFAOYSA-N	441.513	1.682	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)Nc1cccc(OCC(=O)N2CCCC2)c1	755657626	RHHMVUUNCBINQX-LJQANCHMSA-N	440.456	1.681	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)Nc2cccc(C(=O)N3CCOCC3)c2)cc1	755935183	ZUZQIFSUHJTTSY-UHFFFAOYSA-N	426.473	1.953	50	20	IDGD	
Cc1c(NC(=O)NNC(=O)COCc2ccccc2)cccc1C(=O)N1CCOCC1	756184574	HVJNIEVECRPCSC-UHFFFAOYSA-N	426.473	1.837	50	20	IDGD	
Cn1cc(CCC(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c2ccccc21	756666809	MKSXKHICJHPUOO-FQEVSTJZSA-N	437.452	1.642	50	20	IDGD	
C[C@H](CS(=O)(=O)c1ccc(F)cc1)C(=O)OCC(=O)NNC(=O)c1ccc(C#N)cc1	756714367	UTGQFJRISILKCO-CYBMUJFWSA-N	447.444	1.112	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)c1ccc(Br)cc1-n1cncn1	758054899	NPMQMFXWUCPENZ-INIZCTEOSA-N	444.245	1.631	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2cc(S(C)(=O)=O)cc(C)c2C)c2ccccc2c1=O	758072700	XZTNGICFYAJUIW-UHFFFAOYSA-N	442.497	1.512	50	20	IDGD	
O=C(C[C@H](NC(=O)c1ccccc1)c1ccccc1)NNC(=O)C(=O)Nc1ccccn1	758828860	WUFPSXZFUFBDCC-SFHVURJKSA-N	431.452	1.729	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NC[C@H](C[C@H](C)O)c2ccccc2)c2ccccc2c1=O	759612517	SLHMPLFVNFYZMO-RDJZCZTQSA-N	437.500	1.915	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)c1ccc(I)c(O)c1	760801522	YMSJNRXZUFASQA-CQSZACIVSA-N	440.193	1.598	50	20	IDGD	
Cn1c(SCC(=O)NNC(=O)c2ccc(C#N)cc2)nc2cc([N+](=O)[O-])ccc2c1=O	762482528	GLWXZKRXEBXBFN-UHFFFAOYSA-N	438.425	1.267	50	20	IDGD	
O=C(NNc1nccc(N2CCOCC2)n1)[C@H]1CCCN(C(=O)c2ccc(F)cc2)C1	762855567	GYXVTKUICHVVSS-INIZCTEOSA-N	428.468	1.448	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)CSc3cccc[n+]3[O-])n[nH]2)cc1OC	763146221	CIZRMSJJRPHVCA-UHFFFAOYSA-N	429.458	1.281	50	20	IDGD	
O=C(NNC(=O)c1cccnc1)C(=O)Nc1cc(C(F)(F)F)ccc1N1CCOCC1	763491781	NZOPXDDXDZGIMW-UHFFFAOYSA-N	437.378	1.337	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)NNC(=O)c1cnn(-c2ccccc2)c1	763506537	GTJGXQZWLOCOQM-UHFFFAOYSA-N	426.458	1.345	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(F)cc2Cl)cc(OC)c1OC	763540071	QFYHJRARBQNSHQ-UHFFFAOYSA-N	425.800	1.905	50	20	IDGD	
COC(=O)c1cc(Cl)cc(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1	763573852	VCCVGZDGJYACNJ-OAHLLOKOSA-N	433.804	1.053	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)Nc1ccc(OCc2ccncc2)cc1	763579557	YFPMBKQGPSKOKL-FQEVSTJZSA-N	448.435	1.587	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(C(=O)NC(C)(C)C)c2)c1	763624462	WVCZPKUORTUCKN-UHFFFAOYSA-N	426.473	1.688	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2ccc(O[C@@H]3CCOC3)cc2)c1	763647848	QCXZTVOXXBAWOO-GOSISDBHSA-N	427.457	1.636	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccccc1-c1noc(C)n1	763681783	NBUDNOJCRZZEPN-UHFFFAOYSA-N	439.428	1.609	50	20	IDGD	
CCc1noc(-c2ccc(C)c(NC(=O)C(=O)NNC(=O)COc3ccccc3F)c2)n1	763682383	NCIVDYWZZJPPCK-UHFFFAOYSA-N	441.419	1.911	50	20	IDGD	
O=C(COc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1ccnc(OCC(F)(F)F)c1	763694427	INPIPWOKKWGGCT-UHFFFAOYSA-N	446.769	1.841	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2ccccc2S(=O)(=O)C(C)C)c1	763772927	QZWOTLGSOXNHBG-UHFFFAOYSA-N	449.485	1.286	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)C(=O)N2C[C@H](C)Oc3ccccc32)c2ccccc2c1=O	763790625	MAXVCOULQJRWRN-AWEZNQCLSA-N	449.467	1.553	50	20	IDGD	
Cn1ccc(NC(=O)C(=O)NNC(=O)c2nc(-c3ccccc3)n(-c3ccccc3)n2)n1	763804481	NJQKFFYIKWNXGS-UHFFFAOYSA-N	430.428	1.068	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)C(=O)Nc1ccc(-c2csnn2)cc1	763805005	ZSRWNKSCKICXRP-UHFFFAOYSA-N	442.413	1.278	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)c(OC)c1OC	763849566	KFOVGKYUPARVTI-NSHDSACASA-N	435.408	1.405	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cccc(F)c2C(=O)OC)cc1	763860500	HWNAYWXYSXUJFA-LBPRGKRZSA-N	447.419	1.564	50	20	IDGD	
O=C(CCSc1ccc(F)cc1)NNC(=O)C(=O)Nc1cnn(C[C@@H]2CCCO2)c1	763895759	RWCPJSAXUKRWKK-HNNXBMFYSA-N	435.481	1.470	50	20	IDGD	
COCCOc1cccc(NC(=O)C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)c1	763945039	SFUQFHNUYPJXKH-UHFFFAOYSA-N	439.428	1.003	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cccc(C(F)(F)F)c2)ccc1-n1cnnn1	764041245	ZFIYKTIWLWZCCN-UHFFFAOYSA-N	433.350	1.389	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc(Br)cc2Cl)cn(C)c1=O	764059350	SLMWDYHOXFQFEC-UHFFFAOYSA-N	441.669	1.509	50	20	IDGD	
COc1cc(Cl)c(C)cc1NC(=O)C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	764085824	OXOMVRKUCWEMLB-UHFFFAOYSA-N	439.877	1.460	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(C)c(I)c2)n[nH]1	764097447	DOZYYJYEGLWXIO-UHFFFAOYSA-N	427.202	1.031	50	20	IDGD	
CNC(=O)Cn1ccc2ccc(NC(=O)C(=O)NNC(=O)c3ccc(Cl)cc3O)cc21	764127055	RRMOCDUQHKFOIC-UHFFFAOYSA-N	443.847	1.146	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2O1)C(=O)Nc1ccc(OCc2cccnc2)cc1	764165398	YJNKLLCMAMMSCK-HXUWFJFHSA-N	432.436	1.750	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)Cc2ccccn2)cnc(Cl)c1Br	764267281	QWZDUOIJMRJRPB-UHFFFAOYSA-N	426.658	1.530	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)Cc3ccccc3F)cc2F)C[C@H](C)O1	764313264	JSVIGQRPCMYJQO-KBPBESRZSA-N	446.454	1.907	50	20	IDGD	
CCNC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c1	764350193	AARULQMVRUDXLK-UHFFFAOYSA-N	435.444	1.413	50	20	IDGD	
CCn1c2ccccc2c2cc(NC(=O)C(=O)NNC(=O)[C@@H](C)OCCOC)ccc21	764399115	ZFPXJBPPWHBLAV-CQSZACIVSA-N	426.473	1.952	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)C(=O)Nc1ccc(CN2CCCC2=O)cc1	764401712	QVSPSBRKQUBMON-UHFFFAOYSA-N	442.497	1.393	50	20	IDGD	
Cn1cc(C=NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)c(-c2cccnc2)n1	764827320	IETUCUUMDKHHAB-UHFFFAOYSA-N	431.500	1.390	50	20	IDGD	
C[C@@H]1CCCC[C@]12NC(=O)N(CC(=O)NNC(=O)c1cc(-c3cccs3)[nH]n1)C2=O	765569423	IOLNRIGYIUVHGO-WYRIXSBYSA-N	430.490	1.400	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)CN2C(=O)[C@@H](C)Oc3ccccc32)n[nH]1	765595571	MSKUBPXFYVBBGQ-CYBMUJFWSA-N	435.440	1.660	50	20	IDGD	
O=C(NNC(=O)C(F)(F)C1(O)CCC1)c1nn(Cc2ccccc2)c(=O)c2ccccc12	767192034	QUDSMIFIQFFUSK-UHFFFAOYSA-N	442.422	1.756	50	20	IDGD	
O=S(=O)(CBr)N1CCN(S(=O)(=O)c2ccccc2OC(F)F)CC1	767849587	HCUYAKLJVFPYHO-UHFFFAOYSA-N	449.295	1.277	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)c3ccc([C@]4(C)NC(=O)NC4=O)cc3)n[nH]2)c1	768269045	GHJSVDIEUDSRLW-QHCPKHFHSA-N	446.467	1.823	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNS(=O)(=O)c3cncc(Cl)c3)CC2)cc1	768286176	WVYWOGHLPSOVKY-UHFFFAOYSA-N	437.953	1.171	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)Sc1nnc(-c2cc(-c3ccc(CC)cc3)[nH]n2)n1N	768417212	RVVUMGKBZPUNHB-NSHDSACASA-N	428.522	1.649	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2C(=O)N[C@@]3(CCCC(C)(C)C3)C2=O)cc1OC	768571138	NVIGUHBRUDQEDM-OAQYLSRUSA-N	432.477	1.356	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)CCC(=O)c2ccc(Cl)cn2)c2ccccc2c1=O	768962202	JZUTUWDTNOOWFQ-UHFFFAOYSA-N	427.848	1.889	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)c3cc(N4CCNC4=O)ccc3F)nc21	770958955	UPSMTUZIPRSOHU-UHFFFAOYSA-N	428.428	1.713	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1ccc2c(c1)C(=O)N(CCc1ccccc1)C2=O	771968879	POGWAHWUWBMKMX-AWEZNQCLSA-N	437.452	1.628	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)C[C@H]1CSCCN1C(=O)OC(C)(C)C	772207094	LZNBHTHVJOWCDM-KBPBESRZSA-N	431.555	1.854	50	20	IDGD	
C[C@H]1C[C@@H](NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)CCN1C(=O)OC(C)(C)C	772339911	QJJRSYXEHFUMFH-ZFWWWQNUSA-N	444.496	1.394	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)N[C@@H]2CC(=O)N(C3CCCCC3)C2)nc1	772550743	UDUBSPZXIXKYMZ-CQSZACIVSA-N	438.554	1.328	50	20	IDGD	
COCCCOc1ccc(Cl)cc1S(=O)(=O)NNC(=O)COc1ccccc1O	772644005	MUDPZTDMHWSPMO-UHFFFAOYSA-N	444.893	1.849	50	20	IDGD	
O=C(NNc1ccc(C(F)(F)F)cc1)C(=O)Nc1ccc(CN2C(=O)CNC2=O)cc1	773769556	ZIVWFDGPBACMJW-UHFFFAOYSA-N	435.362	1.839	50	20	IDGD	
CO[C@H](c1ccc(Br)cc1)[C@H](C)NC(=O)NN[C@@]1(C)CCS(=O)(=O)C1	774338764	BBOQCXSUPBIHLO-PJODQICGSA-N	434.356	1.906	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)N[C@@H](c1ccc(OC(F)F)cc1)C(F)(F)F	776011794	BHDSZKPIVPWHGN-XVKPBYJWSA-N	448.370	1.160	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)NC[C@H](c2cccc(F)c2)N2CCOCC2)c1	776619131	QDPRMXPCMIJPSN-LJQANCHMSA-N	436.509	1.929	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)N2CCC(C(=O)NNc3ccccn3)CC2)cc1	777473175	ZIQAMAZWBOAHSV-UHFFFAOYSA-N	432.502	1.802	50	20	IDGD	
CN(CC(=O)NNC(=O)c1cccs1)[C@H](C(N)=O)c1cccc(Br)c1	777723251	GEVALISVPNWWMU-AWEZNQCLSA-N	425.308	1.430	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2cc(C)n(-c3cccc(C#N)c3)n2)c2ccccc2c1=O	779866084	SFNDUDCIEBELHW-UHFFFAOYSA-N	441.451	1.857	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)[C@@H](c2cccc(Cl)c2)N(C)C)cc1OC	780102494	HKCATFBJUHBVMB-LJQANCHMSA-N	449.891	1.964	50	20	IDGD	
COc1ccc(NNC(=O)CN2C(=O)N[C@](C)(c3ccc(Br)cc3)C2=O)nc1	781537467	POFFKYWWSHWHHT-GOSISDBHSA-N	448.277	1.763	50	20	IDGD	
O=C(NNc1nc2ccccc2s1)C(=O)Nc1ccc(CC(=O)N2CCOCC2)cc1	782813682	FHVAXIAEFNWJSM-UHFFFAOYSA-N	439.497	1.779	50	20	IDGD	
Cc1ccc(C(=O)NCC(F)(F)F)cc1NC(=O)C(=O)NNC(=O)c1ccc(O)cc1	782834065	QDVBMDXHENSFMT-UHFFFAOYSA-N	438.362	1.392	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)c2cccnc12	782884558	CBVPHJKNFJTJSU-UHFFFAOYSA-N	432.440	1.459	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)Cc1cc(F)cc2c1OCOC2	783430330	HRKSVQHSSXSVOK-UHFFFAOYSA-N	442.491	1.594	50	20	IDGD	
Cc1c(NNC(=O)C(=O)Nc2ccc(C[C@H]3CC(=O)NC3=O)cc2)cccc1[N+](=O)[O-]	784357631	GNZUZILLSNZGFJ-ZDUSSCGKSA-N	425.401	1.190	50	20	IDGD	
Cc1cc(Br)ccc1NNC(=O)C(=O)Nc1ccn(CCS(C)(=O)=O)n1	784412902	LDMCDVBTXQCNQV-UHFFFAOYSA-N	444.311	1.080	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNc2nc(-c3ccc(Cl)cc3)no2)cn1	784800245	YAZPOQOICRBTQE-UHFFFAOYSA-N	432.824	1.892	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)Nc1cc(C(F)(F)F)ccc1F	785023522	KDAGUPVOQNHMEW-UHFFFAOYSA-N	430.270	1.858	50	20	IDGD	
NS(=O)(=O)c1ccccc1NNC(=O)C[C@H]1Sc2ccc(Cl)cc2NC1=O	788230832	ZNRDTOSDGCSEQI-CYBMUJFWSA-N	426.907	1.934	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2Cc3cc(Br)ccc3O2)c1	791511912	BQKNPCAWHIWDQJ-HNNXBMFYSA-N	439.287	1.617	50	20	IDGD	
C=CCn1c(S)nc2cc(C(=O)NNC(=O)COc3ccccc3F)ccc2c1=O	791960676	NDZGHQFDNQJGKW-UHFFFAOYSA-N	428.445	1.850	50	20	IDGD	
C[C@](O)(Cn1cc(C(F)(F)F)ccc1=O)C(=O)NNC(=O)CCCc1ccccc1	792128513	OEUXFNWFKGWKCH-IBGZPJMESA-N	425.407	1.788	50	20	IDGD	
CC(C)c1c(C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)cnn1-c1ccccc1Cl	792317680	XKYSUQKCKAWEJY-NSHDSACASA-N	427.914	1.348	50	20	IDGD	
O=C(NNc1cc(Cl)cc(Cl)c1)C(=O)Nc1cnn(CCN2CCOCC2)c1	792445236	ROPQBXJJPHFROB-UHFFFAOYSA-N	427.292	1.604	50	20	IDGD	
O=C(CN1CCCc2ccccc21)NNC(=O)C(=O)Nc1cccc(Br)n1	793023781	WBROOBOUSRELQX-UHFFFAOYSA-N	432.278	1.383	50	20	IDGD	
CC[C@@H](C)[C@H](NC(=O)N1CCCC1)C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	794710364	IKFRNUOLKNZKFO-PBHICJAKSA-N	425.555	1.600	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C[C@@H]1CN(C(=O)OC(C)(C)C)CCO1	795162491	ZZXSCWKRYPRYSO-CQSZACIVSA-N	442.538	1.406	50	20	IDGD	
Cc1ccc(N2CCOCC2)cc1NC(=O)C(=O)NNC(=O)c1c(C)nc2ccccn12	797534917	GQGLBNJANDHNBS-UHFFFAOYSA-N	436.472	1.187	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNc2c(OC)cccc2S(C)(=O)=O)c(C)c(OC)c1	800632677	QJOZUBUEJVBUMO-UHFFFAOYSA-N	437.474	1.506	50	20	IDGD	
CCOC(=O)C1=NN(c2ccccc2)[C@H](C(=O)NNC(=O)C(=O)Nc2ccc(C)cc2)C1	801108067	BEHPOQUQLQLKER-SFHVURJKSA-N	437.456	1.279	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(S(=O)(=O)NC3CCCC3)c2)cc1	801109784	BTVKCCPBYHMJRA-UHFFFAOYSA-N	444.513	1.616	50	20	IDGD	
CC(C)C[C@H](/N=C1/NS(=O)(=O)c2ccccc21)C(=O)NNC(=O)Nc1ccccc1	801992345	JXIIZCHGUDMEAY-INIZCTEOSA-N	429.502	1.993	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2cnnn2-c2ccccc2Cl)cc1	802066209	JQCDGBJMFFWJJJ-UHFFFAOYSA-N	434.865	1.791	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCCC(=O)NNc2ccc3c(=O)[nH]ccc3c2)cc1	803437880	UHZXNSYJJSRCRU-UHFFFAOYSA-N	430.486	1.739	50	20	IDGD	
COCc1cnc(NC(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)s1	806605063	IYLLIBUQKATMOW-UHFFFAOYSA-N	428.515	1.931	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cccc(F)c2Cl)cc(OC)c1OC	806972561	DEXOSPCTEFQCOE-UHFFFAOYSA-N	425.800	1.905	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccccc2O[C@@H](C)C(F)(F)F)n1	806974809	HCESEIRCJBTLCV-LBPRGKRZSA-N	427.383	1.616	50	20	IDGD	
O=C1COC[C@@H](C[C@@H]2CN(C(=O)C(=O)NNc3cc(F)c(F)cc3F)c3ccccc32)N1	807014044	PCPKXHWVNADGMG-VXGBXAGGSA-N	448.401	1.583	50	20	IDGD	
COc1ccc(-c2ocnc2C(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1	809556796	NZBJIPJVMQHXCY-UHFFFAOYSA-N	429.458	1.718	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)CNS(=O)(=O)c1ccc(Cl)cc1	810793151	UZMJKZTYUMOGMI-UHFFFAOYSA-N	443.934	1.567	50	20	IDGD	
CCOC(=O)c1ccc(NNC(=O)CNS(=O)(=O)c2ccc(C(C)=O)cc2)cc1C	812723224	IYASLADVGGSGOU-UHFFFAOYSA-N	433.486	1.796	50	20	IDGD	
C[C@@H]1CN(c2cccc(F)c2)CCN1C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	814295796	GANWJTBLVDZYDK-MRXNPFEDSA-N	441.511	1.784	50	20	IDGD	
CC(C)(C)OC(=O)N1CCc2c(cccc2NC(=O)C(=O)NNc2ncncc2F)C1	815765580	WECAPVODWQBTAH-UHFFFAOYSA-N	430.440	1.991	50	20	IDGD	
CCOc1ccc(NNC(=O)C(=O)Nc2cccc(S(=O)(=O)NC3=NCCC3)c2)cc1	815815455	AZZUSJRRQBTQOA-UHFFFAOYSA-N	445.501	1.638	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)/C=C\c2ccc(NS(C)(=O)=O)cc2)cc1C	818327188	CDFBFIVPOYTYLN-XFFZJAGNSA-N	430.486	1.474	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)c2ccc(S(N)(=O)=O)cc2F)c1	818750001	ACCWJLDFKCGVSC-UHFFFAOYSA-N	446.254	1.779	50	20	IDGD	
COC(=O)c1c(F)cccc1NNC(=O)CN1C(=O)N[C@@](C)(c2ccc(F)cc2)C1=O	819710350	HRTALVLNCUSZBN-FQEVSTJZSA-N	432.383	1.662	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cnn1-c1ccccc1F	844255487	QOJWFIYYIDBMIP-UHFFFAOYSA-N	445.476	1.645	50	20	IDGD	
O=C(NN=Cc1ccc(Br)o1)C(=O)NN=Cc1ccc(Br)o1	864537304	ZCSVLNHHTNCVRH-UHFFFAOYSA-N	432.028	1.998	50	20	IDGD	
CC(=O)Nc1c(C)cccc1C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	878456667	QVQZMHXXHIRGBQ-QGZVFWFLSA-N	427.413	1.098	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)[C@@H]2CS[C@@H](Cc3ccccc3F)C(=O)N2)cc1	888625560	TXBBKBZBESKOKZ-ROUUACIJSA-N	442.472	1.066	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@@]1(C)Cc2ccccc2C(=O)O1	892831541	HTXJURLCLSCIOT-HXUWFJFHSA-N	430.486	1.221	50	20	IDGD	
O=C(NNc1ncccn1)[C@@H]1CCCN(S(=O)(=O)c2ccc(Br)cc2)C1	913043934	NDEYUMGGXMSLNT-GFCCVEGCSA-N	440.323	1.783	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)NCCCn2ccnc2)c2ccccc2c1=O	915880596	QOFDXBFJPJLWAQ-UHFFFAOYSA-N	425.493	1.818	50	20	IDGD	
O=C(NNS(=O)(=O)c1cccc(F)c1)c1cccc(S(=O)(=O)N2CCCCC2)c1	916107925	RWXBFCDDDXNCFB-UHFFFAOYSA-N	441.506	1.624	50	20	IDGD	
CC(=NNC(=O)c1ccc2c(c1)OCO2)c1ccc(S(=O)(=O)N2CCNCC2)cc1	916289166	CGHXUFVZSKIDHG-UHFFFAOYSA-N	430.486	1.163	50	20	IDGD	
CN1CCN(C(=O)c2ccc(CNC(=O)NNC(=O)COc3ccccc3F)cc2)CC1	916390351	LICDJUDYSGYOPO-UHFFFAOYSA-N	443.479	1.123	50	20	IDGD	
C[C@H](CN1CCCCC1)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	916462054	PEJRUWYEEGSXEW-MRXNPFEDSA-N	437.566	1.290	50	20	IDGD	
C[C@@H](CN1CCOCC1)NC(=O)NNC(=O)[C@@H](C)Oc1cccc(Br)c1	916470109	JKVMDPZYJURHDY-QWHCGFSZSA-N	429.315	1.268	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCCCN(C)C(=O)OC(C)(C)C)c2ccccc2c1=O	916580226	ZABJQJWBFISEQU-UHFFFAOYSA-N	446.508	1.617	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCc2nncn2-c2ccccc2)cc(OC)c1OC	916580794	XCMGUYMNLYIPAC-UHFFFAOYSA-N	426.433	1.437	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)NCc2cccc(S(N)(=O)=O)c2)cc1OC	916625712	MMDYTZDASJOBQO-UHFFFAOYSA-N	436.490	1.276	50	20	IDGD	
CC(C)Oc1ncc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1Cl	917975200	LJOYPNUOYBWUHI-MRXNPFEDSA-N	449.847	1.666	50	20	IDGD	
O=C(CCCOc1cccc(Br)c1)NNC(=O)N[C@H]1CCS(=O)(=O)C1	919885873	OOKSMLHMBSXZBB-LBPRGKRZSA-N	434.312	1.126	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)C1(c2ccc(F)cc2)CCOCC1	919972669	JBHAXEHIGIQHRW-UHFFFAOYSA-N	448.520	1.937	50	20	IDGD	
CCOc1ccc(OCc2ccc(C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)cc2)cc1	920298647	QHULMTJHRWOXDX-CQSZACIVSA-N	435.502	1.363	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1cc(C(=O)NNC(=O)NC2CC2)ccc1Br	920766441	PQBCWZQMTSUSIZ-UHFFFAOYSA-N	433.328	1.632	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)Nc2cccc(CN3CCC[C@H]3C(N)=O)c2)cc1C	920930309	FUFPFGCKBZMJET-FQEVSTJZSA-N	439.516	1.985	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN(C(=O)COc2ccccc2)C1)c1cncn1-c1ccccc1	1116125822	METXIBLJSQILMQ-GOSISDBHSA-N	447.495	1.951	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCCN1S(=O)(=O)c1cccs1)c1n[nH]c2c1CCCC2	1337476612	XATVZGZVQHERGJ-CQSZACIVSA-N	437.547	1.354	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3cn4ncccc4n3)C2)C1	1777950963	RISZPWITUDKLLD-UGSOOPFHSA-N	436.310	1.204	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@](C)(Cl)CCl)C2	1777983710	NTQWRBWGKXCRNQ-QIZIZJAASA-N	437.368	1.184	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Cl)C1	1778026488	VWTXHAYVPINFRT-BYZSLHIBSA-N	441.891	1.169	50	20	IDGD	
Cc1cnc2c(C(=O)N3CC[C@@]4(C3)CN(C(=O)[C@](C)(Cl)CCl)CCO4)cnn2c1	1778525418	FUMIQYXIDGWGGL-RTBURBONSA-N	440.331	1.718	50	20	IDGD	
Cc1ccc(C)c(C(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1	1779034086	LXDQKDCAQWFBME-QHCPKHFHSA-N	437.500	1.059	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(C4CC4)cc3)CCO2)C1	1779036995	LRLSXTVXPUICRZ-DEOSSOPVSA-N	449.511	1.320	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)C(=O)Nc3cccnc3)C2)C1	1779205683	BOOXOTADSUAHRP-KSSFIOAISA-N	439.310	1.024	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](OC(C)=O)C(C)C)C1	1779207360	FENVYVHNSPVAGZ-PDOICOKGSA-N	432.945	1.342	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3[nH]cnc3-c3cccnc3)C2)C1	1780055935	GIHMVBXRSZBCEG-QRWLVFNGSA-N	433.896	1.169	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(CN(C(=O)c3ccno3)CCO2)C1	1780095631	ROOQOIPKTZGUAC-FQEVSTJZSA-N	444.400	1.265	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)cc1OC	1780658164	GCWDVHGYJJYYPM-YJYMSZOUSA-N	441.322	1.931	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)nc(O)c1)C2)[C@@H](F)Br	1780773228	HIFKAYYLRWBLJJ-JDSLSITLSA-N	446.273	1.311	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C2(F)CCC2)C1	1782820478	PLBYBQLUKJQYKB-AMODZNIKSA-N	447.511	1.527	50	20	IDGD	
COc1ccccc1CC(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](C)Br)C2)C1	1783540353	UQDOHSKHQULWGH-AUUYWEPGSA-N	425.323	1.851	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)CN3CCc4sccc4C3)CCO2)C1	1783874189	ZQWCSNODDIDWOB-JXFKEZNVSA-N	441.981	1.190	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(CC(C)C)nn3C)CCO2)C1	1783874300	CNGACLBPHODHAF-UZLBHIALSA-N	426.945	1.316	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(NC(C)=O)c(O)c3)CCO2)C1	1783881841	NDODQQQAXMDYGF-QRWLVFNGSA-N	439.896	1.048	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccn4cncc34)C[C@@H]21	1783966498	FXBZPGJMJSOCIR-OAOQPFQOSA-N	449.349	1.959	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3c(C)c[nH]c3C)[C@H]2C1	1784220522	HKAHTOBYTRXPDF-WNHJNPCNSA-N	425.957	1.798	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)cc1	1785106872	PIMAAJBJIQPVRH-MAUKXSAKSA-N	442.285	1.779	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3cccnc3OC)[C@H]2C1	1785313201	BBRWHFHCQHFLGC-FJIDUMEYSA-N	439.940	1.256	50	20	IDGD	
Cc1snc2sc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)[C@@H](O)CCl)C[C@@H]43)cc12	1787279232	SVBIMCLQDAGQCN-PYJNHQTQSA-N	443.978	1.859	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3[nH]nc4ccncc34)[C@H]2C1	1787340966	WIENGNSEGZQPJE-QRTARXTBSA-N	431.569	1.403	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCS(=O)(=O)c3ccccc3)C[C@@H]21)[C@H](F)Cl	1787445924	UGVJVKYWRGGQNA-MBGYTDRXSA-N	446.928	1.365	50	20	IDGD	
COCc1oncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CO[Si](C)(C)C)C[C@@H]21	1787721562	AZFLRYGRZBUNQY-BPUTZDHNSA-N	425.558	1.266	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc4cnccc4nc3C)[C@H]2C1	1788290005	RPZSFHNMKGYVMT-RNVRALISSA-N	446.935	1.785	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CC(=O)N(C4CCCC4)C3)C[C@@H]21	1789859105	YSTSCUMVCUWQAK-FQQAFBJJSA-N	439.984	1.775	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CC(F)(F)C(=O)O)C[C@@H]21	1790962161	VXIGMQNAVSRRKP-BJDJZHNGSA-N	441.269	1.250	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3n[nH]c4c3CCCC4)C[C@@H]21	1791057432	LXNFIJNWKVYMKS-DUPGQFARSA-N	439.354	1.665	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccnn3-c3ccccc3)C[C@@H]21	1791254274	MTVUXJJSENACNS-CAIZAGQASA-N	446.935	1.719	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccnc3SC)C[C@@H]21	1791255378	PACOYFAGTNLZBX-HNKHHVNMSA-N	427.954	1.651	50	20	IDGD	
CCOC(CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](Br)CC)C[C@@H]21)OCC	1791421040	XYQSLIPDAFVIOQ-VGWMRTNUSA-N	449.386	1.929	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCCn3ccnc3)[C@H]2C1	1791559667	FCTOGZBMTUZEMP-QZWWFDLISA-N	441.370	1.674	50	20	IDGD	
COc1cc(C(=O)NC2(c3ccc(NC(=O)CCC(=O)NN(C)C)cc3)CCC2)n(C)n1	1791599639	OQHPPRDOAVKXQV-UHFFFAOYSA-N	442.520	1.549	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1cc(Cl)cnc1O	1792390393	XWDPJVOOUACQGZ-VVJJBPBLSA-N	436.665	1.334	50	20	IDGD	
O=C(CCc1noc(-c2ccccc2)n1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCl	1793115141	AHEGLSWKPIEUEF-YYIAUSFCSA-N	432.908	1.907	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@H](F)C[C@H]1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCl	1793117195	GOPMRNILQNSIPV-KXKVQDCLSA-N	447.935	1.572	50	20	IDGD	
C=CC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2	1793597149	DRBCAHPLYMLVTA-AIEDFZFUSA-N	433.908	1.580	50	20	IDGD	
CC(C)(C)OC(=O)NCCCCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](O)CCl)C2	1793867879	JFVAXTTZRCXNEO-QKPAOTATSA-N	431.961	1.919	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccsc1	1794637272	RWZJNTCUXNMWJS-OEDQRSTHSA-N	429.502	1.085	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccnc1CS(C)(=O)=O	1794724746	NJZWSVLPQJPYOM-FQLMCAECSA-N	443.953	1.132	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(Cl)s1	1795040643	YGARLACDWHCVBL-ZSBIGDGJSA-N	433.921	1.966	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc3n(n1)CCC3)C2	1796892526	LXBYETULKOONII-YVLAOCGESA-N	437.504	1.215	50	20	IDGD	
CC(C)=NO[C@H](C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C(C)=N/NC(=O)c1ccc[nH]1	1796892653	BQKMEEQBFZIFQV-CXRKSGDCSA-N	430.509	1.560	50	20	IDGD	
COc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Br)C3)ccc1C	1798971008	LMQBPFAONIPTSR-XRGAULLZSA-N	429.286	1.897	50	20	IDGD	
COC(=O)CCCCCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@](C)(Cl)CCl	1799278858	ZJIVVMZCMSMHPI-QOIYZWAUSA-N	437.364	1.936	50	20	IDGD	
C[C@@H](Oc1cccnc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Br	1799351861	DAGSPITZHHLAJW-AMVBZWJASA-N	430.274	1.129	50	20	IDGD	
COc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Br)ccc1F	1799352419	WHJCKYCIVFWWTO-BAESOJJISA-N	433.249	1.728	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CCCN1C(C)C	1801573927	FKHIWQSPKLPTNR-QEOTZNIISA-N	430.387	1.622	50	20	IDGD	
C=C(C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2)C(F)(F)F	1801701358	XECPNABEYSOMJW-MGGJZVGQSA-N	425.411	1.877	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1CCN(C(=O)[C@H]2CNC(=O)C2)[C@@H]1c1cccnc1	1803016154	SWLDQRLYHJBSTH-DUFGSWQCSA-N	437.338	1.255	50	20	IDGD	
CC(C)[C@H](S)C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1803599286	WLFKABWXWKWJQP-RLLQIKCJSA-N	441.362	1.035	50	20	IDGD	
C[C@@H](C(=O)N1CCCC2(CCN(C(=O)c3cnccc3C(=O)NN)CC2)C1)C1(O)CCC1	1804837366	YTEDBDXPYVJRJW-INIZCTEOSA-N	443.548	1.081	50	20	IDGD	
Cc1cc[nH]c1C(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1805012659	QJRJKKPUXYAICU-DYESRHJHSA-N	426.521	1.411	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)CCC(F)(F)F)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807362744	ITLFKUGFHGUWRI-VQIMIIECSA-N	449.238	1.424	50	20	IDGD	
C#CC(=O)N1CC[C@@H](CNC(=O)CN(C)NC(=O)NCc2ccccc2)[C@@H]1c1cccnc1	1807451838	FRIOJGNKHSNQCB-REWPJTCUSA-N	448.527	1.067	50	20	IDGD	
Cn1nncc1C(=O)N1CC[C@H](CNC(=O)[C@@](C)(Cl)CCl)[C@@H]1c1cccnc1	1808291929	QWQNULQGQLYZQY-XUWXXGDYSA-N	425.320	1.766	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)C(C)(C)F)[C@@H]1c1cccnc1	1808414182	GDGJIKBXCXXNLT-AENKRZKSSA-N	442.495	1.970	50	20	IDGD	
CC(C)c1cc(C(=O)N2CCCC3(CCN(C(=O)c4ccc(B(O)O)cc4)CC3)C2)no1	1808737651	LVKKFRPMDMOZJA-UHFFFAOYSA-N	439.321	1.636	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)c1cnnc2ccccc12	1809135608	GCQAYIBWTXLVCK-RYGJVYDSSA-N	439.903	1.944	50	20	IDGD	
Cc1ccoc1C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1	1810303387	RHNNUVZCGMUXSF-VQIMIIECSA-N	448.483	1.615	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1	1812362762	DXJZQBRNOYLGRC-BVUBDWEXSA-N	427.885	1.249	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2cncs2)[C@@H]1c1cccnc1	1813069730	BBBCGNBDNPPAQA-HNAYVOBHSA-N	430.534	1.231	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)[C@@H]2C[C@H]3CC[C@@H]2O3)[C@@H]1c1cccnc1	1813074399	QPQNRVAHVNLMHB-SXUUSABNSA-N	443.548	1.028	50	20	IDGD	
COc1ccc(CC(=O)Nc2cc([C@H]3CCCCN3C(=O)[C@H](O)CCl)[nH]n2)cc1O	1814647620	SJFUXFITRKBAIV-GDBMZVCRSA-N	436.896	1.958	50	20	IDGD	
COc1ncccc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1	1816433247	XFQSXEWZFQIPCW-MRXNPFEDSA-N	443.508	1.492	50	20	IDGD	
C#CCCCC(=O)N[C@@H]1CCc2nc(NC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)sc2C1	1817282736	LIFJYGRKCAYGCV-WOLHVBPDSA-N	440.529	1.993	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](COC(C)=O)OC(C)=O)n[nH]1	1819432168	ARPDKYIVACWFAQ-IMJJTQAJSA-N	442.900	1.914	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@H]1CCc2nc(NC(=O)/C=C\C(=O)NC3CC3)sc2C1	1819529430	XBJAFEZWOYMSDV-YXVBKTCISA-N	436.610	1.741	50	20	IDGD	
C[C@H](C(=O)Nc1nc2c(s1)C[C@H](NC(=O)C(Cl)Cl)CC2)N1CCN(C)CC1	1822697104	IXZPZZUWSHBZNA-GHMZBOCLSA-N	434.393	1.495	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)Cn3nccn3)sc2C1	1823119400	JQQXECIMKYOJML-VHSXEESVSA-N	427.328	1.520	50	20	IDGD	
Cc1ccc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)CCC(=O)NN(C)C)CC3)cc1O	1823209271	XDVSOCBPFCCBHD-CQSZACIVSA-N	445.545	1.756	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)CNC(=S)NCC)sc2C1	1824492539	OZVSIUCFJMGJKS-WDEREUQCSA-N	432.015	1.947	50	20	IDGD	
CC(C)[C@@H](S)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1	1824537663	LTYDZJJWXAZEEL-WOJBJXKFSA-N	432.395	1.554	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](C)Br)sc2C1	1825642341	PRIJMAKBFCEZHU-IVZWLZJFSA-N	429.340	1.529	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cn3ncccc3n1)CC2	1825999601	AJXUVRAJZRNREY-WDEREUQCSA-N	434.909	1.665	50	20	IDGD	
COc1ccccc1C(=O)N[C@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1	1826088604	GZNGCQSWOBNFEB-ZDUSSCGKSA-N	445.545	1.751	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2nccs2)CC1	1826111735	SHEZKWVSTNPCGC-QGZVFWFLSA-N	442.545	1.689	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)CCc2ccc[nH]2)CC1	1827111427	LADXFJIMKJDQNY-HXUWFJFHSA-N	431.581	1.940	50	20	IDGD	
CC(C)C1(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cccc(B(O)O)c2)CC3)CCC1	1827394545	NWVAIACTZJDWTB-INIZCTEOSA-N	441.362	1.875	50	20	IDGD	
CCOc1ncccc1C(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1829536697	SFLVZBJWFYMSBA-OAQYLSRUSA-N	439.940	1.815	50	20	IDGD	
C[C@H](Cn1cccn1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830358624	PSXRQGHAWCKCPZ-OXQOHEQNSA-N	426.945	1.241	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc4nccn34)C2)C1	1830365923	JNIWCFWTBLHXOH-NRFANRHFSA-N	434.924	1.669	50	20	IDGD	
O=C(c1cc(O)nc(O)n1)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](F)Br)CC1	1830379001	ZPIHBFBXHIKOBZ-GXTWGEPZSA-N	445.289	1.812	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)Cn2ccncc2=O)CC1	1831655955	GKHLFXWWOLVGNV-GDBMZVCRSA-N	439.354	1.646	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)c1ncc(F)cc1F	1833601157	MXRWUNIZOSYGIZ-INIZCTEOSA-N	430.883	1.145	50	20	IDGD	
N#CCC(=O)N1CCO[C@@]2(COCCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1	1834767528	SXAMDKWRHAZVMH-JUALLIRVSA-N	430.411	1.242	50	20	IDGD	
Cc1noc(CC(=O)NC2CCN(C3CCN(C(=O)[C@H](F)Br)CC3)CC2)n1	1834851650	MHHOSZXJYAHPQA-INIZCTEOSA-N	446.321	1.183	50	20	IDGD	
CC(=O)N(C)[C@@H](C)C(=O)NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1	1835121611	GXENMBJLZRQFQA-AWEZNQCLSA-N	445.402	1.210	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3ccn(CCOC)n3)CC2)CC1	1835186161	MHAKEEDREQWXIE-GOSISDBHSA-N	439.988	1.732	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](C)Cn3cncn3)CC2)CC1	1835805374	CQTSNTIYFFKWHK-QFBILLFUSA-N	439.004	1.893	50	20	IDGD	
O=C(/C=C/c1cccs1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1835966216	MPGOLCKDGNRPFW-PKOQZONYSA-N	447.326	1.908	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCC(OC2CCN(C(=O)CCN3CCOCC3)CC2)CC1	1836623591	UWPVSAISYABQEZ-UHFFFAOYSA-N	444.016	1.972	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cn4cccnc4n3)CCO2)C1	1836885301	ROMJVXVLRDKQCM-MGPUTAFESA-N	435.912	1.207	50	20	IDGD	
O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)c1ccncc1Cl)CCO2	1837884983	NCFDTIZYYFECOL-KRWDZBQOSA-N	446.729	1.590	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@@H]3C[C@H]4CC[C@@H]3O4)CC2)CC1	1838776162	UJTPAKRKEAHQSF-MKXGPGLRSA-N	428.957	1.806	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(C#N)cc3)C2)C1	1839154215	GYMXJQXFTHGEMS-UXHICEINSA-N	440.327	1.865	50	20	IDGD	
Cc1ccc(F)c(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)c1	1839202157	WELNUQXLMMKWTH-YJBOKZPZSA-N	447.276	1.895	50	20	IDGD	
C[C@H](C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H](F)Br)CCO2)C1)n1cccc1	1839202799	QBLQVBRTJVFEFO-CKEIUWERSA-N	432.290	1.196	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc4nccn34)CCO2)C1	1839549903	VIGQZFNRZNAGGI-KKSFZXQISA-N	434.924	1.812	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3ccco3)C2)C1	1840031359	NKSAKQJTZUFKFS-KSSFIOAISA-N	429.311	1.452	50	20	IDGD	
CC1=CC[C@H](C(=O)N2CCOC[C@]3(CN(C(=O)[C@H](C)Br)CCO3)C2)CC1	1840033239	YKYCYYXAUBPFMI-BXWFABGCSA-N	429.355	1.973	50	20	IDGD	
CCCc1onc(C)c1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](Cl)COC)CCO2	1840152319	FNHRPJXQCLCAMO-FOIQADDNSA-N	443.928	1.259	50	20	IDGD	
C[C@H](Cc1ccccn1)C(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1840330734	NNTWQRANCWOKFD-VGOFRKELSA-N	437.968	1.982	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H](C(=O)N2CCCC23CN(C(=O)[C@H](O)CCl)C3)[C@H](F)C1	1841517440	UZGZDFRGENBRHR-RBSFLKMASA-N	447.935	1.385	50	20	IDGD	
Cc1cc(C(=O)N2CC3(CCCN3C(=O)c3ccc(B(O)O)cc3)C2)c(C(F)(F)F)o1	1843010945	XRNSLQZIPXNCGW-UHFFFAOYSA-N	436.195	1.417	50	20	IDGD	
CCOC(=O)c1ncn2c1CC[C@H](C(=O)N1CC3(CCCN3C(=O)[C@@H](F)Cl)C1)C2	1843365926	SAQHIQILBNKLEC-SWLSCSKDSA-N	426.876	1.360	50	20	IDGD	
O=C([C@@H](O)CCl)N1CC2(CCCN2C(=O)c2cccc3nc(C(F)(F)F)[nH]c23)C1	1843772041	YGZXUEWNJLQRSC-LBPRGKRZSA-N	430.814	1.998	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC12CN(C(=O)[C@@H](CCN)NC(=O)OC(C)(C)C)C2	1846176433	IJVSBJLMXCTMSR-CHWSQXEVSA-N	447.374	1.215	50	20	IDGD	
Cc1cccc(NS(=O)(=O)c2cc(C(=O)NNc3nnc(C)c(=O)[nH]3)ccc2C)c1	10899243	FSHZPSHSDNKQLQ-UHFFFAOYSA-N	428.474	1.648	50	20	IDGD	
O=C(CCn1c(=S)[nH]c2ccccc2c1=O)NNC(=O)c1n[nH]c(=O)c2ccccc12	17195576	RNYDLZUDMLJCSO-UHFFFAOYSA-N	436.453	1.147	50	20	IDGD	
O=C1Nc2cccc(Br)c2/C1=N/NC(=O)c1csc(N2CCOCC2)n1	17650459	UJDSICNJBMSJHG-UHFFFAOYSA-N	436.291	1.828	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)c2ccc(NS(=O)(=O)c3ccccc3)cc2)n1	22685359	MKHCOOWXPAWTQQ-UHFFFAOYSA-N	427.486	1.762	50	20	IDGD	
CSCC[C@@H](NC(=O)c1ccccc1)C(=O)NNC(=O)c1ccc2c(c1)OCCO2	115342360	QSIDOCDEIYHIFG-MRXNPFEDSA-N	429.498	1.771	50	20	IDGD	
CSCC[C@H](NC(=O)c1ccc2ccccc2n1)C(=O)NNC(=O)c1cccn1C	116390083	DEOBPUSQMLQBIQ-KRWDZBQOSA-N	425.514	1.886	50	20	IDGD	
Cc1ccc(Cl)cc1N1CC[C@H](CNC(=O)NNC(=O)CNC(=O)c2ccco2)C1	726616148	KCDIRKUXBUKIBT-CQSZACIVSA-N	433.896	1.828	50	20	IDGD	
O=C(CCN1C(=O)COc2ccccc21)NNc1ccc(S(=O)(=O)NC2CC2)cc1	726867801	VKUAUECICCPLNR-UHFFFAOYSA-N	430.486	1.386	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)c2cc([N+](=O)[O-])cc3c2OCCO3)cc1	727295309	FUYBHKWOBDFOLC-GFCCVEGCSA-N	431.401	1.993	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)CS(=O)(=O)Cc2ccc(C#N)cc2)cc1F	727499562	SHHFBSZTUPGJCB-UHFFFAOYSA-N	436.490	1.639	50	20	IDGD	
CC[C@@H](Cc1ccccc1)NC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	727943944	KMQJCPDKMWEEJX-SFHVURJKSA-N	446.577	1.665	50	20	IDGD	
CCS(=O)(=O)N[C@H](CCSC)C(=O)NNC(=O)c1cccc(OC(F)F)c1	728487976	HKNTYMVTQAZAGR-GFCCVEGCSA-N	425.479	1.110	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)NC[C@H](C(C)C)N2CCOCC2)c1	728742367	BTDJYEJDANXLDJ-MRXNPFEDSA-N	443.342	1.759	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1ccc(CN2CCCCC2=O)cc1	728846166	SVRMZOSZKXCLTC-UHFFFAOYSA-N	436.516	1.667	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)NCCCCN2CCN(c3ncccn3)CC2)cc1	729233812	WRKRWJQVPQNNBX-UHFFFAOYSA-N	425.537	1.585	50	20	IDGD	
COc1ccc(C(C)=NNC(=O)CSc2nnc(O)nc2O)cc1Br	730558060	DVVHCNBRJNJUIS-UHFFFAOYSA-N	428.268	1.686	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@H]2C(=O)NNC(=O)c2ccccc2OC)c(OC)c1	731493450	YRGPTKZUBXRYKX-KRWDZBQOSA-N	427.457	1.778	50	20	IDGD	
Cc1cc(C)c(S(=O)(=O)N2CCC(C(=O)NNC(=O)c3c[nH]nc3C)CC2)c(C)c1	731851643	JDSGGYSNCPEQGB-UHFFFAOYSA-N	433.534	1.505	50	20	IDGD	
CCCc1ccc(N2C[C@H](C(=O)NNC(=O)CCN3C[C@@H](C)O[C@H](C)C3)CC2=O)cc1	732264681	WGQMYZARKDEADY-ZHALLVOQSA-N	430.549	1.639	50	20	IDGD	
CCOCCCn1c(NNC(=O)Cn2cc(Br)cn2)nc2ccccc2c1=O	733266840	OAOKOCPLCXLPBX-UHFFFAOYSA-N	449.309	1.925	50	20	IDGD	
CN(C)C(=O)[C@@H]1CCC[C@@H](NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)C1	734220758	JKTGDJHZRMCNSG-RTBURBONSA-N	444.580	1.176	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)C[C@@H](c1ccccc1)N1CCOC1=O	734240312	NSWKLNVRGRWDLU-HNNXBMFYSA-N	435.481	1.425	50	20	IDGD	
Cc1nn(C(C)C)c(C)c1S(=O)(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	734419923	VDOQMKQNXUCYCB-UHFFFAOYSA-N	449.942	1.005	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)c1	735117642	ZXIBPDARBJECTL-MRXNPFEDSA-N	433.534	1.237	50	20	IDGD	
C[C@H]1[C@@H](C)S(=O)(=O)CCN1C(=O)CCC(=O)C(C#N)=C1N(C)c2ccccc2N1C	736269800	GSMRTVBKZONAFN-LSDHHAIUSA-N	430.530	1.691	50	20	IDGD	
COc1cccc(OCCCNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)c1	738449218	AUSFZVNQPGZXKH-UHFFFAOYSA-N	435.506	1.401	50	20	IDGD	
O=C(NNC(=O)N1CCC[C@@H](C(=O)c2ccc(F)cc2)C1)c1ccc(-n2cnnn2)cc1	738451284	YXWOANQAAWMYAC-MRXNPFEDSA-N	437.435	1.751	50	20	IDGD	
CS(=O)(=O)[C@@H]1CCC[C@@H](NC(=O)NNC(=O)c2cc(F)ccc2Br)C1	741093365	QDTVDNQNOKNGTR-GHMZBOCLSA-N	436.303	1.888	50	20	IDGD	
Cn1c(NNC(=O)[C@H]2CCCN(C(=O)COc3ccccc3)C2)nc2ccccc2c1=O	741216347	RWLRVTVBNJCHLK-INIZCTEOSA-N	435.484	1.694	50	20	IDGD	
Cc1nn(C)c2sc(C(=O)N[C@@H](C)C(=O)NNC(=O)[C@H]3COc4ccccc4O3)cc12	742033990	WVDQDBOGCHPIGF-XHDPSFHLSA-N	443.485	1.049	50	20	IDGD	
CCN(CCNC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)C(=O)OC(C)(C)C	743590877	BTAKECUTSLYNPB-UHFFFAOYSA-N	443.526	1.683	50	20	IDGD	
CCc1ccc(N2C[C@@H](C(=O)NNC(=O)Nc3ccc(S(C)(=O)=O)cc3)CC2=O)cc1	743831253	UGOUCLFHIGERFK-HNNXBMFYSA-N	444.513	1.858	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(N2CCCCC2)c(C(=O)NNC(=O)NC2CCCC2)c1	744059531	QERWDRUCVVROKV-UHFFFAOYSA-N	437.566	1.814	50	20	IDGD	
CC(=O)N1C=Cc2ccccc2[C@@H]1CC(=O)OCC(=O)NNC(=O)c1ccc(C#N)cc1	744522602	JRKOQSXLGVKDJA-FQEVSTJZSA-N	432.436	1.827	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)c2ccc(S(=O)(=O)NC(C)(C)C)cc2)c1	744556689	RYMUFXMZZYHVAX-UHFFFAOYSA-N	447.513	1.690	50	20	IDGD	
C[C@@H](NC(=O)C1CCCCC1)C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	744621707	ZGXBMTFVTDNAIC-OAHLLOKOSA-N	438.550	1.236	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)N[C@@H]2CC(=O)N([C@@H]3C[C@@H]3c3ccccc3)C2)nc2ccccc21	745914124	IZYUBECAFITKOA-MBOZVWFJSA-N	446.511	1.603	50	20	IDGD	
O=C(CC[S@](=O)c1ccc2c(c1)OCCO2)NNC(=O)c1nnc(O)c2ccccc12	746097299	ZLLLVZIXJQJUBX-HKBQPEDESA-N	442.453	1.066	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)Cc2csc(NC(=O)c3ccco3)n2)c1	746299227	BACJSYVMISGJBA-UHFFFAOYSA-N	428.430	1.346	50	20	IDGD	
O=C(NCc1cccc(NC(=O)c2cccc(F)c2)c1)NNC(=O)C(=O)N1CCCC1	748458551	CRACTIZXTJTGKG-UHFFFAOYSA-N	427.436	1.531	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(CC(=O)NNc2ccc([N+](=O)[O-])cc2Cl)C(=O)C1	748725399	DCKUYXXFQMUPFD-UHFFFAOYSA-N	427.845	1.771	50	20	IDGD	
Cc1nn(-c2cncc3nnnn23)c(C)c1CC(=O)NNC(=O)C12CC3CC(CC(C3)C1)C2	749604256	SPGHKURLNUWHDD-UHFFFAOYSA-N	449.519	1.228	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)NC[C@@H]2CCN(S(C)(=O)=O)C2)c(C)n1-c1ccccc1	753673281	YKPFOGYMAAWJDG-INIZCTEOSA-N	433.534	1.320	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN2CC[S@@](=O)C[C@@H]2c2cnn(CC)c2)cc1C	753814264	WUJKOUSINYIDEW-MHTXLSKPSA-N	437.591	1.402	50	20	IDGD	
COC(=O)c1cc2c(cc1NC(=O)C(=O)NNC(=O)c1cc3ccccc3o1)OCO2	753842101	XPUXZTWPHOIKFS-UHFFFAOYSA-N	425.353	1.348	50	20	IDGD	
Cn1nc(SCC(=O)NN=Cc2ccc(Br)c(Cl)c2)c(=O)n(C)c1=O	754923537	ODIRTQLNXLDDDZ-UHFFFAOYSA-N	446.714	1.137	50	20	IDGD	
COC(=O)CCNC(=O)c1ccc(NC(=O)NNC(=O)c2ccc(O)c(Cl)c2)cc1	755601974	BMSIIBOMYJIUKK-UHFFFAOYSA-N	434.836	1.805	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)Nc1ccc(NC(=O)[C@H]2CCCO2)cc1	755640496	HWQFANSYNNKJDA-MRXNPFEDSA-N	436.428	1.919	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)Nc2cccc(C(=O)N3CCOCC3)c2)cc1	755934859	WYRDZYOKNJUGRA-UHFFFAOYSA-N	428.445	1.399	50	20	IDGD	
CNS(=O)(=O)c1ccc(NC(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)cc1	756650216	UKCMLDWGTMPCDZ-UHFFFAOYSA-N	429.499	1.052	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)CN2C(=O)NC3(C[C@H](C)C[C@@H](C)C3)C2=O)cc1	757734270	MUDODKDWHNTSML-ZIAGYGMSSA-N	431.493	1.001	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)c1cnc(OCc2ccccc2)cn1	757937731	JKSBYBARIHMGIW-UHFFFAOYSA-N	430.465	1.524	50	20	IDGD	
CCCN(CCC)C(=O)CCCC(=O)N1CCN(S(=O)(=O)CBr)CC1	758519032	VQEIVRHGJIROFL-UHFFFAOYSA-N	440.404	1.632	50	20	IDGD	
O=C(NCCOc1ccc(C(F)(F)F)cn1)NNC(=O)c1nnc(O)c2ccccc12	761778025	DRNLOZWQUZIWMZ-UHFFFAOYSA-N	436.350	1.772	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)CN2C(=O)N[C@](C)(c3ccc(OC)cc3)C2=O)n1	762902142	MQCJUGWJYUQADN-OAQYLSRUSA-N	441.492	1.242	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(Br)cc2C(F)(F)F)n[nH]1	763134528	GEGROSBGUHKIPL-UHFFFAOYSA-N	434.172	1.899	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccccn2)cc1NC(=O)CN1CCCCC1	763466326	GBQRSGZNPLBHRJ-UHFFFAOYSA-N	438.488	1.214	50	20	IDGD	
COCC[S@@](=O)Cc1cccc(NC(=O)C(=O)NNC(=O)c2c[nH]c3ccccc23)c1	763535542	HKSYZLPBXGPCDH-WJOKGBTCSA-N	442.497	1.463	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cc(C#N)ccc2OC(F)F)cc1	763661250	MPJUMWNOIHJUEQ-UHFFFAOYSA-N	434.355	1.333	50	20	IDGD	
CN1CCCN(c2ccc(NC(=O)C(=O)NNC(=O)COc3ccccc3F)cc2)CC1	763682378	MZHUZMLSMLZAAY-UHFFFAOYSA-N	443.479	1.133	50	20	IDGD	
COC(=O)Cc1ccccc1NC(=O)C(=O)NNC(=O)CSc1ccc(Cl)cc1	763733749	ICKVNIVCVVGELJ-UHFFFAOYSA-N	435.889	1.934	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2cccc(OCCc3ccccc3)c2)n1	763882692	VVVZXMMLUPXQKB-UHFFFAOYSA-N	435.484	1.908	50	20	IDGD	
COC(=O)NCc1ccc(NC(=O)C(=O)NNC(=O)CSc2ccc(C)cc2)cc1	763897084	UPYNUVWALHCXCL-UHFFFAOYSA-N	430.486	1.729	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cccc([S@@](C)=O)c2)ccc1OC(C)C	763916620	PUBMRCMTPLNZQR-SSEXGKCCSA-N	433.486	1.620	50	20	IDGD	
Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)C(=O)NNC(=O)c1ccc[nH]1	763980715	ZQODASZNOZGQBR-QGZVFWFLSA-N	435.488	1.366	50	20	IDGD	
CC[C@@H](C)Sc1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)c(C)c1	764001903	GPHOQDVGFRRWGE-CHWSQXEVSA-N	427.548	1.406	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1cc(F)ccc1N1CCCCC1	764006290	OCQJSJQGAQAQBR-UHFFFAOYSA-N	442.447	1.987	50	20	IDGD	
NC(=O)c1ccc(F)c(NC(=O)C(=O)NNC(=O)c2ccc(F)cc2Br)c1	764085807	OUBMXVNPSOCKLL-UHFFFAOYSA-N	441.188	1.226	50	20	IDGD	
CC(C)CCC(=O)NNC(=O)C(=O)Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1	764203490	TVJYRJRRJAOGHL-UHFFFAOYSA-N	438.550	1.773	50	20	IDGD	
CCc1ncsc1NC(=O)C(=O)NNC(=O)c1cc(OC)ccc1Br	764231498	JPOYWOQUIAPPBH-UHFFFAOYSA-N	427.280	1.876	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1cccc(C(=O)c2ccccc2)c1	764276721	AYEDSQJTIMDWJU-UHFFFAOYSA-N	433.420	1.788	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)cc1[N+](=O)[O-]	764387306	JLPNDONDGVLRDL-UHFFFAOYSA-N	442.363	1.532	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)[C@@H](C)NS(=O)(=O)c2ccc(C#N)cc2)c1	764523453	HKKJRGCUBSYWOC-OAHLLOKOSA-N	430.486	1.068	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)[C@@H]3CC34CCCC4)CC2)cc1	765729428	RYLUAKVKQRBUTI-SFHVURJKSA-N	434.562	1.029	50	20	IDGD	
C[C@@H](NC(=O)C(C)(C)C)C(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	765751054	HYYFBZVWDRTHJA-OAHLLOKOSA-N	437.972	1.156	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1cc(I)ccc1Cl	766260285	CJKJXSABHDTQRK-UHFFFAOYSA-N	447.620	1.825	50	20	IDGD	
O=C(NNc1nccc(N2CCOCC2)n1)[C@@H]1CC(=O)N(c2ccc(Cl)c(F)c2)C1	767148754	QBCGMTUTLGRVFW-GFCCVEGCSA-N	434.859	1.602	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNS(=O)(=O)c2cnc(Cl)c(OC)c2)cc1	767437422	GSBQVPQYZITLBK-NSHDSACASA-N	429.882	1.919	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CN2CCNC(=O)[C@H]2c2ccccc2Br)cc1	767743095	OPTUSCRLNASCPG-GOSISDBHSA-N	445.317	1.692	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)c1sc2nc3n(c(=O)c2c1C)CCC3	768637329	DTYXVVPQNQDUKJ-UHFFFAOYSA-N	448.526	1.882	50	20	IDGD	
CNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cc(-c3cc(C)ccc3C)[nH]n2)cn1	770248209	XRRMVAUPRCAAMQ-UHFFFAOYSA-N	428.474	1.071	50	20	IDGD	
CC(C)[C@@H](CNC(=O)NNc1nc(O)c2cnn(C(C)(C)C)c2n1)N1CCN(C)CC1	770342906	WGSMOGWATQGHMB-OAHLLOKOSA-N	433.561	1.185	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)[C@H](c3ccccc3)N3CCC(O)CC3)nc21	771010743	ZIOLJNDICCCSJW-KRWDZBQOSA-N	439.520	1.928	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1cccs1)C(=O)NNC(=O)c1cc(-c2cccs2)[nH]n1	771043792	AJHTWFWLKHLMIO-SECBINFHSA-N	425.517	1.328	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)c1cn([C@H]2CCS(=O)(=O)C2)nc1C(C)C	772160805	FPOBVGMSOBOPEK-KBPBESRZSA-N	442.538	1.105	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)NCCNS(=O)(=O)c1cc(C)sc1C	772623464	GJOVWLCYEKVNJH-UHFFFAOYSA-N	440.547	1.225	50	20	IDGD	
CC(=O)Nc1cc(NC(C)=O)cc(C(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)c1	772885226	WNMMGCHNKAAUCC-UHFFFAOYSA-N	445.863	1.334	50	20	IDGD	
CC(C)(C)C(=O)Nc1nccnc1C(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772904489	IYXDAMGNDPFJSK-UHFFFAOYSA-N	432.868	1.192	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(Cl)cn2)cc1Br	773549055	FKKAHEAHQGYGNW-UHFFFAOYSA-N	427.642	1.906	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(CS(=O)(=O)C(C)C)c2)cc1F	773890860	VKBDGBCGIRYWJL-UHFFFAOYSA-N	435.477	1.857	50	20	IDGD	
COc1ccc(S(=O)(=O)NC2CC2)cc1NC(=O)C(=O)NNc1nccnc1C(C)C	773993023	QEEFKGOZCXEZEN-UHFFFAOYSA-N	448.505	1.131	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccc(-n2cncn2)c(F)c1	774009017	NBSLXXGDYSXPKP-LLVKDONJSA-N	446.826	1.613	50	20	IDGD	
CO[C@@H]1[C@H](C)[C@H](NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)C1(C)C	776067321	QPIJVGQCDPNGLS-XOKHGSTOSA-N	426.539	1.005	50	20	IDGD	
COCC[C@@H](NC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)c1ccco1	780883863	XKOZAZHZKAVINN-LJQANCHMSA-N	429.521	1.900	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NC[C@@H]1CC(=O)N(C2CC2)C1	780887302	OXXVHKGWBBLADF-NEPJUHHUSA-N	439.310	1.558	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)Nc1ccc(OC2COC2)cc1	782094477	KDZMZVLERXDMHL-UHFFFAOYSA-N	439.516	1.829	50	20	IDGD	
Cc1ccc(C)c(NNC(=O)C(=O)Nc2cc(S(=O)(=O)N3CCOCC3)ccc2C)c1	783366326	BOLBPQXPAJVDRQ-UHFFFAOYSA-N	446.529	1.715	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NN[C@@]2(C)CCS(=O)(=O)C2)c(-c2nc(C3CC3)no2)c1	783424557	FQOIQBGVPDTQCD-IBGZPJMESA-N	433.490	1.059	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)C(=O)Nc1ccccc1C#Cc1ccccc1	784001693	BNWFAQMIPQJGHL-UHFFFAOYSA-N	430.420	1.195	50	20	IDGD	
Cc1c(NNC(=O)C(=O)Nc2cccc(OCCS(C)(=O)=O)c2)cccc1[N+](=O)[O-]	784357903	NGTIWTACNOIRJO-UHFFFAOYSA-N	436.446	1.408	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)NC[C@@H]2CCCCS2(=O)=O)cc1Cl	784436411	LHVSUJNKELYZLG-JTQLQIEISA-N	434.902	1.660	50	20	IDGD	
C[C@H]1CN(C(=O)c2ccc(NC(=O)C(=O)NNc3nccnc3Cl)cc2)C[C@@H](C)O1	784778369	WWRBCQVOWMMZCJ-TXEJJXNPSA-N	432.868	1.461	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNc2cc(Cl)ccn2)cc(S(C)(=O)=O)c1	784856988	XKYCYVCCSNAZPH-UHFFFAOYSA-N	440.865	1.397	50	20	IDGD	
C[C@@H](Nc1ccc(C(=O)NNC(=O)N2CCN(C)CC2)cc1[N+](=O)[O-])c1ccccn1	788169088	IHOIKKNCWSYYKH-CQSZACIVSA-N	427.465	1.765	50	20	IDGD	
CN(C)NC(=O)Nc1cccc(NC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c1	788259395	QPYZOLYWJQUEAI-UHFFFAOYSA-N	447.517	1.558	50	20	IDGD	
N#Cc1ccc(S(=O)(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)cc1Br	788490347	CNQVEGZVAJCXAM-UHFFFAOYSA-N	441.219	1.558	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cnc1Br	788582328	AMHRCJQXJCZHQJ-UHFFFAOYSA-N	432.234	1.819	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCC(=O)c2cccn21)c1cccc(S(=O)(=O)N2CCCCC2)c1	788727093	WGGJDPMSABOAFG-SFHVURJKSA-N	444.513	1.642	50	20	IDGD	
CC(C)(C)C(=O)NC1CCC(C(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)CC1	788762493	LBKBLSAZPZJVPI-UHFFFAOYSA-N	438.550	1.964	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=S)NCCc2ccc(F)cc2)cc1	789173489	OGGDNRDUYLDXFL-UHFFFAOYSA-N	438.550	1.493	50	20	IDGD	
COC(=O)c1csc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)c1C	789810687	PYQJXAXPZGXVBZ-ZFWWWQNUSA-N	431.470	1.502	50	20	IDGD	
N#Cc1ccc(C[C@@H](C#N)C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1	791449488	QMEUGNMVNHJEMA-NRFANRHFSA-N	430.512	1.600	50	20	IDGD	
O=C(Cc1ncccc1F)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	792015545	YYOCWEKGUMDVMX-UHFFFAOYSA-N	442.472	1.703	50	20	IDGD	
O=C(NNC(=O)c1c[nH]c2ncc(Br)cc12)c1ccc(-n2cnnn2)cc1	792031467	WZFGETZOFFIRMM-UHFFFAOYSA-N	427.222	1.376	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cccc(N(C)C)c2)cc(Cl)c1F	792266971	CGVUDRBXJUARPR-UHFFFAOYSA-N	436.827	1.731	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)c3cnn(CCO)c3-c3ccccc3)nc21	793476282	DVHMRTAZKQYRMM-UHFFFAOYSA-N	436.476	1.900	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)[C@H]1CCN(CC(F)(F)F)C1	795736939	AZXMYJOBMUCPDB-JTQLQIEISA-N	437.802	1.537	50	20	IDGD	
CC(=O)c1cc(Br)ccc1OCC(=O)NNC(=O)COc1ccccc1O	796253455	IJPVBDZNDOVTNY-UHFFFAOYSA-N	437.246	1.963	50	20	IDGD	
CSCC[C@H](NC(=O)c1ccc2ccccc2n1)C(=O)NNC(=O)NCC(F)(F)F	798315493	VSTNFUGQLHNDCU-AWEZNQCLSA-N	443.451	1.979	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2ccn(-c3cccc(C#N)c3)n2)c2ccccc2c1=O	798353408	INTNEZTZCLPJGG-UHFFFAOYSA-N	441.451	1.939	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1cc(F)c(Br)cc1Cl	799233309	JCYBINLXLCTUJC-YFKPBYRVSA-N	431.671	1.332	50	20	IDGD	
Cc1ccc(OCc2ccccc2)c(NC(=O)C(=O)NN[C@@]2(C)CCS(=O)(=O)C2)c1	799836090	WBJQBNIBOWERJF-NRFANRHFSA-N	431.514	1.711	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccc(F)cc2OCCC(F)(F)F)n1	800623484	PSTFAQCIGTVGMD-UHFFFAOYSA-N	445.373	1.756	50	20	IDGD	
O=C(NNC(=O)N1CCC[C@H](CN2CCOCC2)C1)c1ccc(Br)s1	800984374	RSSIKEMMWOPYJA-GFCCVEGCSA-N	431.356	1.909	50	20	IDGD	
O=C(N=c1cc[nH]cc1)NNC(=O)c1ccc(S(=O)(=O)Nc2ccccc2F)cc1	802035197	BWZVOCIABMBVMT-UHFFFAOYSA-N	429.433	1.910	50	20	IDGD	
CCN1CCC[C@@H]1CN1C[C@H](C(=O)NNC(=O)Nc2cc(OC)ccc2Cl)CC1=O	802107989	FFACXBXYWWLDPL-ZIAGYGMSSA-N	437.928	1.834	50	20	IDGD	
Cc1ccc(Cc2ccccn2)cc1NC(=O)C(=O)NNC(=O)Cc1cn2ccccc2n1	802572348	PCPKOVHTMHOQSE-UHFFFAOYSA-N	442.479	1.957	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)N[C@H]1CCN(Cc2ccccc2)C1	807007307	CCMMDCGGXOHZCU-INIZCTEOSA-N	430.534	1.198	50	20	IDGD	
O=C(NNc1ncccc1F)C(=O)Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1	807301689	ORCBJVNNJYDHJA-UHFFFAOYSA-N	435.481	1.867	50	20	IDGD	
COc1ccc(CN2CC[C@H](NC(=O)NNc3nc4ccccn4n3)C2=O)c(OC)c1	807577827	KKEMOWMMPMFGOV-HNNXBMFYSA-N	425.449	1.174	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)[C@@H]1COc2ccccc2O1)c1ccc(N2CCCNC2=O)cc1	812944296	LFIIWOADCUIKTF-LIRRHRJNSA-N	439.472	1.838	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2cccc(Cn3cccn3)c2)cc1	813033524	XPXJIDNIHQIXGJ-UHFFFAOYSA-N	442.501	1.264	50	20	IDGD	
Cc1cc(C(=O)NNc2nc3ccccn3n2)cc(C(=O)NNc2nc3ccccn3n2)c1	813534977	KNQYFMAWYNISIP-UHFFFAOYSA-N	442.443	1.594	50	20	IDGD	
C[S@](=O)c1ccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc1	813633547	NAEFPVOHRFMHJE-NDEPHWFRSA-N	435.527	1.283	50	20	IDGD	
Cc1c(CS(C)(=O)=O)cccc1NC(=O)NNc1ccccc1S(=O)(=O)N(C)C	814639334	MUOLRLWIAVUNFA-UHFFFAOYSA-N	440.547	1.939	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2ccccc2F)nnn1CCOc1ccc(F)cc1	815564945	YCRLCAAFUSKSDL-UHFFFAOYSA-N	444.398	1.343	50	20	IDGD	
COc1cccc([C@]2(C)NC(=O)N(NC(=O)/C(C#N)=C\c3cc(C#N)n(C)c3C)C2=O)c1	863708992	VXEUXTZKYSNQOR-YDBYVANFSA-N	432.440	1.619	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)NC2CC2)cc1)NNC(=O)c1ccc2c(c1)OCO2	913465279	PUQHGYLQWCDEMS-UHFFFAOYSA-N	431.470	1.250	50	20	IDGD	
CC(C)C[C@@H](C(=O)NNC(=O)Cn1cnc2ccccc21)N1C(=O)[C@H]2CC=CC[C@H]2C1=O	913496618	CCVMDYCKYKOVDS-FCEWJHQRSA-N	437.500	1.550	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)COc2ccc(C=O)cc2OC)c2ccccc2c1=O	913597133	VFMZGTBFPNJXHG-UHFFFAOYSA-N	438.440	1.468	50	20	IDGD	
O=C(CCC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)CCC(=O)c1cccs1	915188890	DGXNSZGOQSQCFH-UHFFFAOYSA-N	426.458	1.497	50	20	IDGD	
CCCNC(=O)CN1CCC(NC(=O)NNC(=O)c2ccc(Cl)cc2OC)CC1	915257883	ODBCBLKEBHPZHX-UHFFFAOYSA-N	425.917	1.283	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)Cn2cnc3ccc(Br)cc3c2=O)cc1	915593978	RZUFTTIAIHCJPN-UHFFFAOYSA-N	445.273	1.694	50	20	IDGD	
Cn1ccnc1[C@@H](NC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)c1cccc(F)c1	916223920	GXMBGADVWKSQAU-KRWDZBQOSA-N	445.476	1.696	50	20	IDGD	
COc1ccc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cn1	916233795	MPSLPHQZTIQMPB-UHFFFAOYSA-N	433.490	1.019	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)NC[C@@]1(N2CCOCC2)CCSC1	916637260	XDDXFUOVSNQOKK-FQEVSTJZSA-N	438.550	1.002	50	20	IDGD	
CCN1CCN(S(=O)(=O)c2ccc(Cl)c(C(=O)NNC(=O)C(C)(C)C)c2)CC1	917182689	UOHYGNQICUMKLP-UHFFFAOYSA-N	430.958	1.473	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)NCC(=O)NNc2ccc(Cl)cc2[N+](=O)[O-])cc1	917213874	BVQIOEWMOLPSSC-UHFFFAOYSA-N	426.838	1.872	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNS(=O)(=O)c1cc(OC)c(OC)c(C(=O)O)c1	917731198	JVLHIZZNQJGQEX-UHFFFAOYSA-N	444.849	1.687	50	20	IDGD	
O=C(CN1C(=O)[C@H]2CCCC[C@@H]2C1=O)NNC(=O)c1ccc(F)cc1Br	918340586	UJLWZHVHNKIEEG-QWRGUYRKSA-N	426.242	1.524	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)N2CCN(c3cnccn3)CC2)N(C)c2ccccc21	919698714	VHFJOFYQIYWDAU-UHFFFAOYSA-N	431.500	1.796	50	20	IDGD	
Cc1ccc2c(c1)CC[C@@H]2NC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	919920017	HYHDWUFWHZYAKJ-IBGZPJMESA-N	444.561	1.640	50	20	IDGD	
CC(C)CN1C(=O)/C(=C/NNC(=O)CSc2ccc(Cl)cc2)C(=O)NC1=S	920978604	MKDDQKDGFZSYMS-NTUHNPAUSA-N	426.951	1.836	50	20	IDGD	
O=C(NC[C@H]1CCN(c2ccc(F)c(F)c2)C1)NNC(=O)[C@H]1COc2ccccc2O1	921076715	IXMRMBMDIGUSHF-BFUOFWGJSA-N	432.427	1.962	50	20	IDGD	
CC(C)(C)c1ccc(NNC(=O)NCCNS(=O)(=O)c2ccc(F)cc2F)nn1	1116921106	WDGBOAQGAMUZLA-UHFFFAOYSA-N	428.465	1.657	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H]2COc3ccc(F)cc3C2)c1	1319556153	DGFDEQKMOROKTF-MRXNPFEDSA-N	449.504	1.869	50	20	IDGD	
O=C(NNC(=O)c1n[nH]c2c1CCCC2)Nc1ccc(CC(=O)N2CCSCC2)cc1	1320118877	SQYLBDNTZMZPNR-UHFFFAOYSA-N	442.545	1.873	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4cnccc4n3)C2)C1	1777736598	YHZSPJJBALNRQM-ORAYPTAESA-N	433.306	1.857	50	20	IDGD	
CC(C)n1cnc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)CO[Si](C)(C)C)C3)n1	1778280233	RPJFFSIVXOQLEB-OXQOHEQNSA-N	437.617	1.838	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnc4[nH]ncc4c3)C2)C1	1778417666	CHWKKXAMMTXLRF-KBXCAEBGSA-N	436.310	1.575	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(C1)CN(C(=O)C13CC(C1)C3)CCO2	1780098668	GQNMMWORWORWSP-KGSCVUAUSA-N	443.456	1.764	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccccc3C(=O)OCCO)C2)C1	1780156732	VNDDGWLTZVEFQT-DYESRHJHSA-N	438.908	1.297	50	20	IDGD	
C[C@@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Br)C1)n1ccnc1	1780770413	NAADIMZLMLJKEZ-QDEZUTFSSA-N	431.306	1.649	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ncn(-c4cccc(F)c4)n3)CCO2)C1	1781213464	JFNYTYNUUITJHQ-OXQOHEQNSA-N	435.887	1.867	50	20	IDGD	
C=C(CC(=O)OCC)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](C)CBr)CCO2	1781264270	RKEIVTSGQUXPKO-RDTXWAMCSA-N	431.327	1.357	50	20	IDGD	
Cc1cnc2c(C(=O)N3CCO[C@]4(CCN(C(=O)[C@H](F)Br)C4)C3)cnn2c1	1781331180	FZGICEINNUKRJH-GUYCJALGSA-N	440.273	1.172	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(C#N)cc(OC)c1)C2	1782173473	DOZUGNFKTGJKFE-NNMXDRDESA-N	449.935	1.948	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cn1cnc3ccccc31)C2	1782180397	ZPXGVLQDTWBIOQ-ZWDAVXSWSA-N	448.951	1.804	50	20	IDGD	
COCC(=O)N1CCO[C@]2(CCN(C(=O)[C@H](Br)Cc3ccccc3)C2)C1	1783024002	SKOZINZGULLQQK-VQIMIIECSA-N	425.323	1.469	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(CCN(C(=O)[C@@H](O)Cc3ccccc3)C2)C1	1783334660	UZKKSZJOHWPDOO-LPHOPBHVSA-N	425.323	1.205	50	20	IDGD	
COc1ncc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](C)Br)C3)C2)cc1F	1783532680	RHJUINFAIFWOMC-GTNSWQLSSA-N	430.274	1.456	50	20	IDGD	
CC(C)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nn[nH]c3C(F)(F)F)C[C@@H]21	1783852392	YDPXNEVTANUVSF-DCAQKATOSA-N	437.850	1.682	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)C(=O)c3ccc(Cl)cc3)CCO2)C1	1783870633	DCFFJBMLJKTAQO-KXBFYZLASA-N	429.300	1.606	50	20	IDGD	
C=C(CC(=O)OCC)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]2C1	1783972660	MDZQWMKDBXEHOY-UGUYLWEFSA-N	445.354	1.507	50	20	IDGD	
CC(C)(C)OC(=O)NC(C)(C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21	1784813641	YAAFIJZXZSLDAJ-XUXIUFHCSA-N	435.924	1.804	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccccc3OC(F)F)C2)C1	1785149168	YDKWANNVJCXNAE-IFXJQAMLSA-N	432.851	1.985	50	20	IDGD	
CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](Cl)COC)CCO2	1785347619	AFKQRSXOYRQBHQ-SIFCLUCFSA-N	447.960	1.373	50	20	IDGD	
O=C(CCN1CCCCC1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21	1786577852	OUAAHIOWKOLBLN-QBYUYEEZSA-N	434.350	1.533	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nc4cc([N+](=O)[O-])ccc4[nH]3)C[C@@H]21)[C@H](F)Cl	1787449228	DMRXDIGWJXBBCQ-YIVQXAGMSA-N	439.831	1.599	50	20	IDGD	
CN(C)c1ncc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]3C2)o1	1789865734	AQMSOAYLJNYRFW-RSLFNQERSA-N	433.336	1.570	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3n[nH]c4c(C)cccc34)[C@H]2C1	1790480105	VMSSFUZCEPPOFV-HJWJTTGWSA-N	434.924	1.718	50	20	IDGD	
Cc1ccc(C)c(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]32)c1	1790929958	LBGBQVPUGKRMSC-JBACZVJFSA-N	444.576	1.199	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc[n+]([O-])cc3)C[C@@H]21	1790960340	BVJJYGQTVAWOCP-JONQDZQNSA-N	426.311	1.087	50	20	IDGD	
Cc1cnn([C@H](C)C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](C)Br)[C@H]3C2)c1	1791064959	NRCLQSDCPLJJPK-QRJUGERDSA-N	427.343	1.516	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC1(c2ccc(NC(=O)[C@@H]3CCCS3(=O)=O)cc2)CCC1	1791177364	CDNYZPMWKBUFQL-CVEARBPZSA-N	428.938	1.952	50	20	IDGD	
CSc1ccc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](O)CCl)C[C@@H]32)cc1	1791452946	GWLBFOZEFFRPDD-DKIMLUQUSA-N	426.966	1.530	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1ccc(C2(NC(=O)c3ccc4nncn4c3)CCC2)cc1	1791601531	HPBHPWPAUGQLIK-UHFFFAOYSA-N	449.515	1.850	50	20	IDGD	
O=C(CCc1ncc[nH]1)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1	1791757781	ORHAKABDZIJTFN-UHFFFAOYSA-N	432.289	1.470	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1CC(O)C1	1793017001	XVITWXSGYOYHKI-ZTPJQAPRSA-N	431.445	1.543	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)c1cnc(Cl)c(Cl)c1	1796188733	NJZCXQLVUDBOGL-MUJYYYPQSA-N	448.115	1.634	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2cnccc2n1	1796895870	QQVGKSYUUFREJN-DPYKFYPSSA-N	433.306	1.616	50	20	IDGD	
CN(CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1CC1(F)F)NC(=O)NCc1ccccc1	1797736231	FAJHHIBJKHGLAI-XMTFNYHQSA-N	449.502	1.626	50	20	IDGD	
O=C1COc2ccc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)[C@H](F)Br)C4)cc2N1	1798112227	ZJGUNEAOGWWGLM-BUWBCJGYSA-N	440.269	1.960	50	20	IDGD	
COc1ccc(F)cc1CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)Br	1800762962	LTRNGIKPAQPAIG-GNTLTTKYSA-N	443.313	1.750	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CCc3ccccc3[C@@H]1O)C2	1800970386	DCHGQZFIOVFKQD-ZNRYJCSXSA-N	436.936	1.126	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cn3cccnc3n2)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803143112	UJVVUXGEWAURHI-BHYGNILZSA-N	428.880	1.044	50	20	IDGD	
COC(=O)C12CC(C(=O)N3CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]3c3cccnc3)(C1)C2	1803146999	FPWOIOOBNUYPQB-FHARDALYSA-N	435.908	1.030	50	20	IDGD	
CC(=O)N[C@@H](Cc1cccc(F)c1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](O)CCl)C2	1804215501	BLUCESWOCNKXPB-PJVZLEMVSA-N	439.915	1.111	50	20	IDGD	
Cn1nc(C(=O)NC[C@@H]2CCN(C(=O)CO[Si](C)(C)C)[C@@H]2c2cccnc2)cc1O	1804895270	IJPDYPUJFRGIAQ-HNAYVOBHSA-N	431.569	1.692	50	20	IDGD	
Nc1c(C(=O)N2CCC3(CCCN(C(=O)[C@@H](O)CCl)C3)CC2)sc2nccnc12	1805520050	ZQFQPDBCJQKTBW-LBPRGKRZSA-N	437.953	1.718	50	20	IDGD	
Cc1cncc(C(=O)NC[C@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)c1	1805771513	HUBFROFOOYDTBE-XMSQKQJNSA-N	438.532	1.478	50	20	IDGD	
COC(=O)[C@H]1CC[C@H](C(=O)N2CCCC3(CCN(C(=O)[C@H](O)CCl)CC3)C2)CC1	1806374089	POAMZPDSTBOGES-BRWVUGGUSA-N	428.957	1.797	50	20	IDGD	
O=C(Cc1ccccc1)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1806512650	OTEJSLRONBJNEB-URXFXBBRSA-N	443.312	1.324	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1807359000	CFYJIGBDXUUTHT-HKUYNNGSSA-N	443.740	1.346	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)c2ccsc2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807365616	ZELJTVZSESFBOB-YLJYHZDGSA-N	435.314	1.456	50	20	IDGD	
Cc1ncsc1C(=O)N1CCCC2(CCN(C(=O)c3ccc(B(O)O)cc3)CC2)C1	1808457344	IMMJIKWYPJNJCZ-UHFFFAOYSA-N	427.335	1.290	50	20	IDGD	
O=C(COC1CCCCC1)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1	1809977874	KUFMLKPLGSKNGP-UHFFFAOYSA-N	442.365	1.561	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)o1	1810295708	VTMYUCLZYXVFLQ-OXQOHEQNSA-N	448.483	1.615	50	20	IDGD	
C[C@H](NC(=O)c1cnccn1)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Cl)[C@H]1c1cccnc1	1810446729	IXZDQLGVENNDPM-ZFZWDLNGSA-N	448.886	1.230	50	20	IDGD	
COc1cc(C(=O)N2CC[C@H](CNC(=O)CO[Si](C)(C)C)[C@@H]2c2cccnc2)n(C)n1	1810541892	WUOGCWUZSAKEEU-UZLBHIALSA-N	445.596	1.995	50	20	IDGD	
Cc1nc(C(=O)N2CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)cs1	1813070443	JATYFPWSWSISHS-OXQOHEQNSA-N	444.561	1.539	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@H]1CCc2nc(NC(=O)CSC(=N)N)sc2C1	1814717843	ZJIZCLUMXNBSBF-SFYZADRCSA-N	434.385	1.713	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccccn2)n[nH]1	1816366481	ATIGZSXCNVWAQX-QGZVFWFLSA-N	434.460	1.423	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC[C@H]1c1cc(NC(=O)Cn2cnnn2)n[nH]1	1817613557	RYBRGLAWZBYUEQ-PWSUYJOCSA-N	425.291	1.120	50	20	IDGD	
CC(=O)OC[C@H](OC(C)=O)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](F)Cl)n[nH]1	1818039996	NSICFMWGTKGJSI-IPYPFGDCSA-N	432.836	1.431	50	20	IDGD	
CN1CCc2cc(C(=O)Nc3nc4c(s3)C[C@H](NC(=O)[C@@H](O)CCl)CC4)ccc21	1818416110	UQPYOUXQYWXYJV-CJNGLKHVSA-N	434.949	1.961	50	20	IDGD	
O=C1Nc2c(C(=O)Nc3cc([C@@H]4CCCCN4C(=O)[C@@H](O)CCl)[nH]n3)cccc2C1=O	1819193832	UAGMXGOTGLDBLG-KBPBESRZSA-N	445.863	1.450	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)C2=NNC(=O)C2)n[nH]1	1819344459	WSXKYELHYAUNRM-BXKDBHETSA-N	425.287	1.451	50	20	IDGD	
CC(C)(C)c1cc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@@H](O)CCl)CC3)[nH]n1	1820554773	ZILKOAOKXSUDQT-SKDRFNHKSA-N	425.942	1.989	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CS(C)(=O)=O)[nH]n1	1820864154	RMPMFDGNKWMOTJ-ABAIWWIYSA-N	425.338	1.683	50	20	IDGD	
C[C@](O)(CC(=O)O)CC(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](F)Br)n[nH]1	1820937984	XLUZDBSNCMMRNV-JMPLFQLZSA-N	449.277	1.708	50	20	IDGD	
CN1C(=O)CC[C@H]1C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](F)Br)[nH]n1	1820955332	LCBQONABUHXGTC-SUNKGSAMSA-N	430.278	1.713	50	20	IDGD	
Cc1ccc(O)c(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)CCC(=O)NN(C)C)CC3)c1	1821990873	OWTVTQNKHSJZAV-ZDUSSCGKSA-N	445.545	1.756	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)c3cccc(C#N)c3)sc2C1	1822034316	SAAVSKKWGJBETJ-HNNXBMFYSA-N	440.529	1.614	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H]2CCCSC2)[nH]n1	1822418294	ZFAQTBMCKUMUFM-GOEBONIOSA-N	436.582	1.918	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCn1ccnn1)CC2	1825453361	WXKWGRIFXGELAD-MNOVXSKESA-N	441.355	1.910	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc3cn[nH]c3cn1)CC2	1825999984	HNKJAFYWAMNWLT-MNOVXSKESA-N	434.909	1.894	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)/C=N/O[C@@H]1CCCCO1)CC2	1826000295	QVHZNVOFLYFESH-NNUZQQSMSA-N	444.941	1.838	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](C)CN)CC1	1826792418	MUOJCUGUNIGLLG-ZBBDXVTFSA-N	430.553	1.335	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(CO)o2)CC1	1829275295	XRHYNLVZJAXGSZ-SFHVURJKSA-N	434.537	1.378	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])[nH]2)CC1	1829836135	RXWJYKAZBCGWSS-KRWDZBQOSA-N	448.524	1.529	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)COc3ccccc3OC)CCO2)C1	1830229620	XZUNYFUGIUWLFK-IIBYNOLFSA-N	440.924	1.548	50	20	IDGD	
CC1=C(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)CCO1	1830538878	SQBSATYUWRQMRT-UGSOOPFHSA-N	431.327	1.168	50	20	IDGD	
CCn1nccc1C(=O)N1CCC([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1	1831872497	ZLFCWFVSETVQGE-GOSISDBHSA-N	432.569	1.509	50	20	IDGD	
CCc1[nH]nc(C(=O)N2CCC(N3CCC(NC(=O)[C@@H](O)CCl)CC3)CC2)c1Cl	1833310769	RPQADTBKSSXGSS-HNNXBMFYSA-N	446.379	1.410	50	20	IDGD	
COc1ncc(C(=O)N2CCO[C@@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)cc1F	1833479543	QWJZXHUXQYYCGV-FQEVSTJZSA-N	443.903	1.564	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCC(N2CCC(NC(=O)c3cncnc3)CC2)CC1	1834237186	RTWJCCSIRNRWSO-LJQANCHMSA-N	428.364	1.898	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCBr)CCO3)C2)c(O)c1	1834826832	YATKFZHWCZLFOK-LJQANCHMSA-N	441.322	1.556	50	20	IDGD	
Cc1cc(NC(=O)CC(=O)N2CCC(N3CCC(NC(=O)[C@H](F)Cl)CC3)CC2)no1	1835079886	ZPBINNIQGHPPNG-SFHVURJKSA-N	443.907	1.418	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC1CCN(C2CCN(C(=O)c3cc(C#N)c[nH]3)CC2)CC1	1835836131	LZGWIPQUFFDQFG-UHFFFAOYSA-N	431.613	1.923	50	20	IDGD	
O=C(c1cn2ccsc2n1)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836717395	WEFRGFFVDILIEF-MRXNPFEDSA-N	440.953	1.608	50	20	IDGD	
O=C(c1cc(Cl)cc(Cl)n1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1838240002	FXNDEDRCAKEAEB-BBRMVZONSA-N	440.686	1.993	50	20	IDGD	
Cc1n[nH]c(C)c1C(=O)N1CCC(OC2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1	1838445073	YYSJZUQFYGTISX-UHFFFAOYSA-N	448.568	1.012	50	20	IDGD	
CC(C)c1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)n[nH]1	1838698697	UXLCZHVJIFRYET-WMLDXEAASA-N	447.305	1.294	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3noc4c3CCCC4)C2)C1	1839143575	AUCWQFRXECAFKC-MGPUTAFESA-N	425.913	1.641	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(CO)c(F)c3)C2)C1	1839149684	OFUSCFMHLOOOHL-UZLBHIALSA-N	428.888	1.405	50	20	IDGD	
CN(C)c1c(F)cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)cc1F	1839468861	HVHUYWLQHXNKLT-QFBILLFUSA-N	449.857	1.635	50	20	IDGD	
C#CCCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)CCO2	1839743754	RPSSMYBGDBKRPO-JBSURENYSA-N	443.450	1.742	50	20	IDGD	
Cc1ccc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)o1	1840036834	RMQFBPSRBXGKIO-RDTXWAMCSA-N	429.311	1.370	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3cccc(C#N)c3)C2)C1	1840149085	DKRNAMUDIZEQMH-DENIHFKCSA-N	449.935	1.201	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCCc3ccncc3)C2)C1	1840150800	QPYZFPDKWVERMS-NQIIRXRSSA-N	439.940	1.115	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(F)ccc3OC)C2)C1	1840156946	YPRRNOGBWTYRIS-JXFKEZNVSA-N	444.887	1.158	50	20	IDGD	
O=C(c1cc(O)cc([N+](=O)[O-])c1)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840189155	AFBZMYXVYHADJR-KRWDZBQOSA-N	448.259	1.174	50	20	IDGD	
CCOc1cccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)c1	1840189282	JDWODPTUAVKCHH-LJQANCHMSA-N	431.316	1.959	50	20	IDGD	
O=C(CCCc1cccnc1)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1840513872	VWOVELRCHOFWBG-IBGZPJMESA-N	430.332	1.664	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)c(Cl)c1	1840693725	PJPKQWNDMQIZQC-LPHOPBHVSA-N	431.316	1.318	50	20	IDGD	
COC(=O)CSCC(=O)N1CCCC12CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)C2	1841614635	AZSCSLXAGFTZRU-VIZOYTHASA-N	449.479	1.981	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC2(CCCN2C(=O)[C@H]2CCc3nc(O)nc(O)c3C2)C1	1842058366	FYUUQJMICVFFCE-BBATYDOGSA-N	443.331	1.432	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2ccc3nonc3c2)C1	1843675451	FSCSRKFUHBUQDG-YDZHTSKRSA-N	435.444	1.174	50	20	IDGD	
CC(C)(C)OC(=O)N1CCCO[C@@H](C(=O)N2CCCC23CN(C(=O)[C@H](F)Cl)C3)C1	1843817920	IRHHVYUZIAGZGK-KGLIPLIRSA-N	433.908	1.750	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)C1(c3ccc(F)cc3)CC1)C2	1844263423	DNHIBHWXJRALCE-UHFFFAOYSA-N	437.475	1.373	50	20	IDGD	
Cn1c(=O)n(C)c2cc(C(=O)N3CC4(CCCN4C(=O)[C@](C)(Cl)CCl)C3)ccc21	1845170800	ONFVHRTUBYBZFI-LJQANCHMSA-N	439.343	1.930	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@H](O)CCNC(=O)OC(C)(C)C)C1	1845221391	SWZKBVYBBDXMRH-CABCVRRESA-N	431.961	1.873	50	20	IDGD	
CC(C)(C)OC(=O)N1CC2(CC(C(=O)N3CC[C@H]4[C@@H]3CCN4C(=O)[C@H](O)CCl)C2)C1	1847564624	YHVCJBHDQHXGEB-HRCADAONSA-N	441.956	1.435	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)C2CCN(S(=O)(=O)c3cc([N+](=O)[O-])ccc3C)CC2)n1	14509889	LSUUTWLUOAQTOZ-UHFFFAOYSA-N	448.505	1.854	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NN[C@H](C(=O)NC2CC2)c2ccccc2)c1	15467708	GONOQQBTJYVXAG-FQEVSTJZSA-N	444.557	1.971	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)cc1OC	16095404	XFSHAQNMTZOYKK-UHFFFAOYSA-N	446.485	1.618	50	20	IDGD	
CC(C)(C)OC(=O)NNC(=O)c1ccc(NS(=O)(=O)c2ccc3[nH]c(=O)[nH]c3c2)cc1	17398227	OQMWEAPOANQUEK-UHFFFAOYSA-N	447.473	1.827	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)C[C@H](C)NC(=O)c1ccccc1	22905228	JWSDALLEUNWQSV-ZDUSSCGKSA-N	431.518	1.258	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccco2)on1)c1cccc(S(=O)(=O)N2CCCC2)c1	24576184	LTGPFSHOKRFIOL-UHFFFAOYSA-N	430.442	1.794	50	20	IDGD	
Cc1ccc(S(=O)(=O)NC(C)(C)C)cc1C(=O)NNC(=O)[C@H]1COc2ccccc2O1	26974349	TZFYFODVDBJNKZ-GOSISDBHSA-N	447.513	1.673	50	20	IDGD	
CC(=O)N1CCc2cc(C(=O)NNC(=O)c3nn(C(C)C)c(=O)c4ccccc34)ccc21	28580923	WZYSFCHYAPRDGN-UHFFFAOYSA-N	433.468	1.961	50	20	IDGD	
COc1ccc(NC(C)=O)cc1S(=O)(=O)NNC(=O)c1cc(Br)c[nH]1	28808847	VISUPFDYKRDOPY-UHFFFAOYSA-N	431.268	1.368	50	20	IDGD	
O=C(NNC(=O)C1(c2cccc(Br)c2)CC1)c1ccc(-n2cnnn2)cc1	71849184	ICFPFTCOSSQXTM-UHFFFAOYSA-N	427.262	1.918	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)c2ccc(CN3C(=O)CCC3=O)cc2)o1	109008141	VJMLBZGREBEJBA-UHFFFAOYSA-N	426.473	1.845	50	20	IDGD	
O=C(COC(=O)c1nc(-c2ccccc2)cs1)NNC(=O)[C@H]1COc2ccccc2O1	116786920	JDZCFMAIYCWQRD-QGZVFWFLSA-N	439.449	1.954	50	20	IDGD	
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)Cc1nc2ccccc2n1C	726082194	PTSBKYDABSEOSB-IBGZPJMESA-N	432.484	1.492	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2ccc(-n3ncc(C#N)c3N)cc2)c2ccccc2c1=O	727241367	YUHHKXXEEVSQAG-UHFFFAOYSA-N	442.439	1.131	50	20	IDGD	
CC(C)NC(=O)CNC(=S)NNC(=O)COc1ccc(-c2ccc(C#N)cc2)cc1	727270980	UBCVRUYAMFGWSM-UHFFFAOYSA-N	425.514	1.624	50	20	IDGD	
CN(C)N(C(=O)c1ccc2c(c1)C(=O)N(Cc1ccco1)C2=O)[C@@H]1CCS(=O)(=O)C1	728180196	PYPMYIWNBKFWPR-CQSZACIVSA-N	431.470	1.182	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3c[nH]nc3-c3ccncc3)cc2)CC1	728215574	GTAOJQLHFIFOES-UHFFFAOYSA-N	441.517	1.165	50	20	IDGD	
COc1cccc(CO[C@H](C)C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1	728326013	AWUDBYAIAAYXRX-AUUYWEPGSA-N	444.440	1.131	50	20	IDGD	
O=C(CCn1c(=O)nc(O)c2ccccc21)NNC(=O)c1cc(F)ccc1Br	728548689	OSEGTMURHSJBLK-UHFFFAOYSA-N	449.236	1.855	50	20	IDGD	
Cc1nn(-c2ccccc2)c(C)c1CC(=O)NNC(=O)C1CCN(c2ncccn2)CC1	728848035	UBFHHUMYFVEXJS-UHFFFAOYSA-N	433.516	1.886	50	20	IDGD	
CNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2ccc(Br)cc2Cl)o1	728869849	FZKFLDTYAGVOCH-UHFFFAOYSA-N	436.671	1.678	50	20	IDGD	
CCOC(=O)[C@@H]1CCCN(C(=O)CN(C)C(=O)NNC(=O)c2ccc3ccccc3c2)C1	728946980	NYOQXCVMGRGBRE-LJQANCHMSA-N	440.500	1.928	50	20	IDGD	
Cc1cccc(CN2CCN(C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)CC2)c1	728958152	UMJQFAPCJZVIGZ-UHFFFAOYSA-N	437.548	1.560	50	20	IDGD	
CCOC(=O)[C@H]1CCCN(C(=O)CN(C)C(=O)NNC(=O)Cn2ccc3ccccc32)C1	729506988	LRULOJTVDFTTGC-KRWDZBQOSA-N	443.504	1.116	50	20	IDGD	
Cn1nc(SCC(=O)NN=C(/C=C/c2ccccc2)c2ccccc2)c(=O)n(C)c1=O	730571449	ROSZUHOLJFDJFW-HGVZUJKNSA-N	435.509	1.805	50	20	IDGD	
CCC[C@H](NC(=O)NNC(=O)COc1ccccc1O)C(=O)N1CCc2sccc2C1	730911893	RGXQZGFVPWMZNC-HNNXBMFYSA-N	446.529	1.917	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)N1CCC([C@@H](O)c2ccc(Cl)cc2)CC1	731500180	DTKXMBCDLAKNJC-SFHVURJKSA-N	434.880	1.849	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1)c1cccc([N+](=O)[O-])c1	731952910	FHYLBWKULMILAT-GFCCVEGCSA-N	433.402	1.630	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Cn2cc(Br)cn2)cc1Br	732036180	ZWPOUUPZFFVQJZ-UHFFFAOYSA-N	432.072	1.878	50	20	IDGD	
O=C(COC(=O)c1nc(N2CCCC2)ncc1Cl)NNC(=O)c1cccc([N+](=O)[O-])c1	732326936	GAVMVGYXGFJIML-UHFFFAOYSA-N	448.823	1.256	50	20	IDGD	
COc1cc(C(=O)NNC(=O)N[C@@H]2CCN(c3ccccc3F)C2=O)cc(OC)c1OC	732820158	IEBGZGROZVVWPC-CQSZACIVSA-N	446.435	1.601	50	20	IDGD	
CCc1cc(N2CCC[C@H](NC(=O)NNC(=O)COc3ccccc3CC)C2)ncn1	732914100	JVIWHYNQRHGYRL-SFHVURJKSA-N	426.521	1.980	50	20	IDGD	
O=C(CN1C(=O)N[C@@]2(CCc3ccccc32)C1=O)NNC(=O)NCc1ccc(Cl)cc1	733003257	COACYXSUTFDSNS-OAQYLSRUSA-N	441.875	1.564	50	20	IDGD	
Cc1c(NNC(=O)NCc2ccccc2S(=O)(=O)N(C)CCO)cccc1[N+](=O)[O-]	733043431	NXWWMNWWACMGEG-UHFFFAOYSA-N	437.478	1.342	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)NCc2ccnc(OC3CCOCC3)c2)cc1	733653896	MPGXUEJJXVHKTA-UHFFFAOYSA-N	425.445	1.420	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCCc1ccc2c(c1)CCO2	734006405	CVKBHJCLWNJYEO-UHFFFAOYSA-N	431.518	1.410	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)NCCc1ccc2c(c1)CCO2	734067847	ABGBISGUVDCNPE-UHFFFAOYSA-N	437.544	1.707	50	20	IDGD	
N#Cc1ccccc1OCc1cccc(C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)c1	734124128	VWIBNCPDOAKLOU-KRWDZBQOSA-N	428.470	1.268	50	20	IDGD	
CC1CCC(N2CCN(C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)CC2)CC1	734527490	WCQVYSLUXBUJPZ-UHFFFAOYSA-N	429.569	1.630	50	20	IDGD	
COc1ccc(CN2CC[C@@H](NC(=O)NNC(=O)[C@@H](C)Oc3ccc(F)cc3)C2=O)cc1	734682488	AZENGMNGRORFLS-AUUYWEPGSA-N	444.463	1.733	50	20	IDGD	
O=C(NNC(=O)c1cccc(-n2cccn2)c1)c1ccc(S(=O)(=O)N2CCCC2)cc1	735027804	DUOMUTQUDDJPMV-UHFFFAOYSA-N	439.497	1.732	50	20	IDGD	
Cc1ccc(C(=O)N2CCN(C(=O)NNC(=O)COCc3ccccc3)CC2)cc1F	738496486	QPTKDJKJBZPRBF-UHFFFAOYSA-N	428.464	1.850	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)N[C@H]2CCC[C@@H](S(C)(=O)=O)C2)nc1	741093160	NPGQSLJMGFTDHA-UONOGXRCSA-N	447.583	1.094	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CSc2nnc(-c3cccc(N(C)C)c3)n2N)c1	742454767	SWWOQOVNHCNYKQ-UHFFFAOYSA-N	425.518	1.587	50	20	IDGD	
O=C(Cc1csc(N2CCOCC2)n1)NNC(=S)N[C@H]1CCc2ccccc2C1	742976218	XXTPNFUJUDLCEO-INIZCTEOSA-N	431.587	1.575	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)[C@H](C)NC(=O)c2cc3c(C)nn(C)c3s2)cc1	743293786	KBCKZFSDBBNCAT-LBPRGKRZSA-N	444.517	1.330	50	20	IDGD	
CS(=O)(=O)Cc1cccc(C(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)c1	743829806	DQBXVNHXRXFRJD-UHFFFAOYSA-N	425.488	1.101	50	20	IDGD	
O=C(NNC(=O)C1CCN(S(=O)(=O)c2cccnc2Cl)CC1)NC1CCCC1	744053961	JACYPXUDJBCLBC-UHFFFAOYSA-N	429.930	1.409	50	20	IDGD	
O=C(NCCOc1ccc(Br)cc1)NNC(=O)[C@@H]1COc2ccccc2O1	744296025	NTBGTTFOEIKXAM-INIZCTEOSA-N	436.262	1.998	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)CCCc2nnc(-c3ccccc3)o2)c1	744742784	PBVTUEHLFFLEDP-UHFFFAOYSA-N	433.424	1.935	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)C[C@H]2CN(Cc3ccccc3)CCO2)cc1	745102324	QHULOVULYWIOBY-FQEVSTJZSA-N	436.468	1.154	50	20	IDGD	
CC[C@@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)c1ccncc1	745835812	DODZKSPMVWKONC-GOSISDBHSA-N	431.518	1.961	50	20	IDGD	
CC(C)(CNC(=O)NNC(=O)COc1ccccc1[N+](=O)[O-])NC(=O)OC(C)(C)C	745926104	FTCAKMKMCFFFGW-UHFFFAOYSA-N	425.442	1.607	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)CCN2CCN(c3cccc(C)c3)CC2)c1	746095310	ODWGYVUUGQCNEE-UHFFFAOYSA-N	426.517	1.986	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)CCc2nc(O)c3c(C)c(C)sc3n2)c1	746307254	PVKJGEMXQMPHED-UHFFFAOYSA-N	428.474	1.761	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)c1cccc(CS(=O)(=O)NC(C)(C)C)c1	746385754	IMNBFLRTNBPNNV-UHFFFAOYSA-N	448.545	1.786	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)[C@@H]1CC(=O)N(Cc2ccccc2Cl)C1	746549707	VBSRGMTUNNAGIH-OAHLLOKOSA-N	425.876	1.726	50	20	IDGD	
Cc1nc(Cl)cc(NNC(=O)c2ccc(S(=O)(=O)NC[C@H]3CCCO3)cc2)n1	747979393	DDBJPADFNDIRGJ-CYBMUJFWSA-N	425.898	1.653	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(Br)s1)NNc1cccc([N+](=O)[O-])c1	748004350	GCFYYJJKDMDSSR-UHFFFAOYSA-N	435.281	1.840	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)NCc1ccc(N(C)C(=O)c2ccncc2)cc1	748629151	ACOQSSSVWBDAIH-OAHLLOKOSA-N	429.477	1.240	50	20	IDGD	
COCCS(=O)(=O)c1ccc(C(=O)NNC(=S)NCCc2cccs2)cc1	750093034	RSQPMMSEKJDAJT-UHFFFAOYSA-N	427.573	1.520	50	20	IDGD	
O=C1Nc2cccc(Cl)c2C1=NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	750912127	KMBVHDBSWUJQEV-UHFFFAOYSA-N	448.888	1.447	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)C1CCN(C(=O)c2cccc3ccccc23)CC1	751204689	MMBJPVQTQXZRJR-UHFFFAOYSA-N	448.479	1.862	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NC[C@@H]2CCC[C@@]23NC(=O)N(C)C3=O)ccc1OC(C)C	752023258	KIVCHLGIFPDWLG-LHSJRXKWSA-N	447.492	1.147	50	20	IDGD	
Cc1nn(-c2ccccc2)c2sc(C(=O)NNC(=O)NC[C@@H](C)S(C)(=O)=O)cc12	754676041	QSZBNCBEYXLVHQ-LLVKDONJSA-N	435.531	1.773	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)Nc2ccc(S(=O)(=O)C(F)F)cc2)cc1	755445230	XWVQJPKDZAGJLK-UHFFFAOYSA-N	429.401	1.923	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2cccc(-n3nnnc3C)c2)c2ccccc2c1=O	755759407	NYBZDBBFIFEDGI-UHFFFAOYSA-N	433.432	1.167	50	20	IDGD	
CN(C1CC1)S(=O)(=O)c1ccc(NC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1	756400232	CPXPRBTTXIVRTH-UHFFFAOYSA-N	433.446	1.844	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2cnn(CC(F)(F)F)c2)cc1	756650200	UJGABIXNGGRBGP-UHFFFAOYSA-N	448.427	1.227	50	20	IDGD	
CCn1nnnc1-c1cccc(NC(=O)NNC(=O)c2nn(CC)c(=O)c3ccccc23)c1	756683555	FVJWHGCTPWSJFJ-UHFFFAOYSA-N	447.459	1.556	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)[C@@H]1CCc2n[nH]cc2C1	757097006	XOEPPAFLTKTZSK-OAHLLOKOSA-N	430.940	1.133	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)C(=O)Nc1ccccn1)c1nc(-c2ccc(Cl)cc2)no1	758825692	KXSDBOHSWAQOFZ-JTQLQIEISA-N	429.824	1.815	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccc(F)cc2)c1C(F)(F)F)C(=O)Nc1ccccn1	758840553	JRROQPQXHIRRLC-UHFFFAOYSA-N	436.325	1.825	50	20	IDGD	
CCNS(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)CSc2ccccc2OC)c1	762410313	UREQNUKSEMBERC-UHFFFAOYSA-N	441.506	1.686	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)N[C@@H]1CC[C@@H]2SCCS[C@H]21	762527530	KOUZKBFPDXHJGC-WXHSDQCUSA-N	429.593	1.303	50	20	IDGD	
CCOc1ccccc1[C@H](CC(=O)NNc1nccc(N2CCOCC2)n1)NC(C)=O	762851492	QQFHHZGTIUXEKE-KRWDZBQOSA-N	428.493	1.423	50	20	IDGD	
O=C(NNc1nccc(N2CCOCC2)n1)[C@@H]1CCCN(C(=O)c2ccc(F)cc2)C1	762855568	GYXVTKUICHVVSS-MRXNPFEDSA-N	428.468	1.448	50	20	IDGD	
CCOC(=O)c1ccccc1NC(=O)C(=O)NNC(=O)c1cc(OC)c(OC)c(OC)c1	763544421	XLWKCSJRANRBLC-UHFFFAOYSA-N	445.428	1.289	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)[nH]n1)C(=O)Nc1cnn(Cc2ccccn2)c1	763605601	VSRUVTAYCKZGIY-UHFFFAOYSA-N	430.428	1.116	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cc(C)nn2-c2ccccc2F)cc1	763659194	LAZNNERVVMJWED-UHFFFAOYSA-N	441.419	1.493	50	20	IDGD	
COCCOc1ccc(F)cc1NC(=O)C(=O)NNC(=O)COc1ccc(C)c(C)c1	763664773	GJLPUNRHWQZQEH-UHFFFAOYSA-N	433.436	1.633	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)c(OC)cc1Cl	763678095	CODUSCPJWUVDHW-UHFFFAOYSA-N	432.820	1.394	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2F)c(Br)c1	763681154	LBGRHFIOFAXBBF-UHFFFAOYSA-N	440.225	1.762	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)C(=O)Nc1ccn(-c2ccccc2Cl)n1	763681928	KPPZUWNEFADLLY-UHFFFAOYSA-N	431.811	1.830	50	20	IDGD	
O=C(NNC(=O)c1cccc(Cl)c1)C(=O)Nc1cccc(N2CCCS2(=O)=O)c1	763752183	FLGUUBROASTLHK-UHFFFAOYSA-N	436.877	1.280	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)N2CCc3cc(F)c(F)cc32)c2ccccc2c1=O	763785037	BHFXZKSUEXSIBI-UHFFFAOYSA-N	441.394	1.045	50	20	IDGD	
C[C@@H](NC(=O)c1cccc(Cl)c1Cl)C(=O)NNC(=O)CNC(=O)c1cccnc1	763818741	OFLSVUISQXKDAI-SNVBAGLBSA-N	438.271	1.084	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccc(OCC(F)(F)F)nc1	763839228	GRQXIBCBGJLGPB-UHFFFAOYSA-N	430.314	1.327	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccccc1C(=O)N1CCCC1	763863742	BPRLFQQHCXHYCJ-CQSZACIVSA-N	442.447	1.615	50	20	IDGD	
CCN1CCC(n2nccc2NC(=O)C(=O)NNC(=O)Cc2ccc(Cl)cc2)CC1	763936344	GLOMNBLLQHGIQS-UHFFFAOYSA-N	432.912	1.522	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3ccc(-n4cncn4)c(F)c3)cc2C1	763940365	GXWAGAOPVCKHPU-LLVKDONJSA-N	442.476	1.992	50	20	IDGD	
C[C@H](C(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)Cc2ccsc2)c1)n1cccn1	764024432	GUCNOGRFTUEHSK-CYBMUJFWSA-N	440.485	1.473	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)nc2)ccc1Cl	764092177	GYNJDYFWDBYGPC-UHFFFAOYSA-N	425.228	1.965	50	20	IDGD	
O=C(CC(F)(F)F)NNC(=O)C(=O)Nc1ccc(C(=O)N2CCc3ccccc32)cc1	764114460	BORIPNMNWADGAK-UHFFFAOYSA-N	434.374	1.928	50	20	IDGD	
CC(C)n1cnnc1-c1ccccc1NC(=O)C(=O)NNC(=O)[C@H]1Cc2ccccc2O1	764155310	YBZJLKUXJBTIRH-GOSISDBHSA-N	434.456	1.616	50	20	IDGD	
O=C(CCc1ccccc1)NNC(=O)C(=O)Nc1ccc(F)c(N2CCCS2(=O)=O)c1	764184676	COQCCORDJMKAEX-UHFFFAOYSA-N	448.476	1.084	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)C(=O)Nc1cccc(OCC(=O)Nc2ccccc2)c1	764296305	XNBCTLCHAZDYFL-UHFFFAOYSA-N	436.428	1.135	50	20	IDGD	
Cc1ccc(S(C)(=O)=O)cc1NC(=O)C(=O)NNC(=O)c1ccc(O)c(Cl)c1	764349825	RIFACSJLSASSIO-UHFFFAOYSA-N	425.850	1.157	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)C(=O)Nc1ccnn1-c1cccc(Cl)c1	764365889	HOEKTXRZIIUZEH-UHFFFAOYSA-N	427.848	1.828	50	20	IDGD	
Cn1ccnc1-c1cccc(NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)c1	764381953	DBAFJJPMDCDVOV-UHFFFAOYSA-N	435.469	1.938	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)C(=O)Nc1cccc(S(=O)(=O)NC(C)(C)C)c1C	764386156	AEDGXGCOAZIFRT-UHFFFAOYSA-N	447.517	1.175	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1c(-c2ccncc2)noc1C	764560572	XGWVPECKDBJBGO-UHFFFAOYSA-N	428.474	1.721	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)NCc2ccc(N3CCCS3(=O)=O)cc2)c1	764773687	QXIYBKQZDPPWFN-UHFFFAOYSA-N	446.529	1.753	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)c3cc(S(=O)(=O)NC)ccc3C)n[nH]2)cc1	765572369	YQJMUYFSNAOYEA-UHFFFAOYSA-N	441.513	1.930	50	20	IDGD	
COC(=O)c1ccc(C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)cn1	765758955	RFRWNFQYLQEJKA-UHFFFAOYSA-N	445.907	1.100	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)[C@H]1Cc2ccccc2O1	766664905	XFTXXASOGCDIKZ-HXUWFJFHSA-N	428.920	1.609	50	20	IDGD	
Cn1c(N)c(C(=O)/C(C#N)=C/c2ccc(Br)cc2[N+](=O)[O-])c(=O)n(C)c1=O	767717417	LWYOHZFYZYXFLN-WEVVVXLNSA-N	434.206	1.127	50	20	IDGD	
COC(=O)c1c(CC(=O)NNc2c(OC)cccc2S(C)(=O)=O)[nH]c(C(C)=O)c1C	768636475	SCIKZTBYEMFLHX-UHFFFAOYSA-N	437.474	1.410	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)CS(=O)(=O)CCCc1ccccc1	768637391	HATWIWXVDHIABO-UHFFFAOYSA-N	440.543	1.589	50	20	IDGD	
O=C(CCc1cnn(-c2ccccc2)c1)NNC(=O)c1csc(N2CCOCC2)n1	768990319	STUPKUSTPBMEPF-UHFFFAOYSA-N	426.502	1.559	50	20	IDGD	
O=C(NNc1cccc([N+](=O)[O-])c1)Nc1ccc(F)c(S(=O)(=O)N2CCOCC2)c1	769975216	TWPAQLOWGXOHNB-UHFFFAOYSA-N	439.425	1.903	50	20	IDGD	
CCOC(=O)N1CC[C@@H](NC(=O)NNC(=O)[C@H](C)Oc2cccc(Br)c2)C1	770325035	MYECFUWXDZXEKX-WCQYABFASA-N	443.298	1.778	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)N[C@@H]1C[C@@H](C)N(c2cnn(C)c2)C1=O	770654739	CWFNELLJFYFOCT-BFQNTYOBSA-N	434.884	1.365	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2ccc(Br)c(F)c2)ccc1-n1cnnn1	770816086	PMTXSVLOCCWWPQ-UHFFFAOYSA-N	434.229	1.954	50	20	IDGD	
CC[C@H](C(=O)NNc1nc(O)c2cnn(C)c2n1)n1nnc(-c2ccc(Cl)cc2)n1	770973632	NZCVUEONWXENKS-GFCCVEGCSA-N	428.844	1.470	50	20	IDGD	
CN(CCO)S(=O)(=O)c1ccccc1CNC(=O)NNc1c(F)cccc1Cl	771322748	ZDQIGNWELXDLFA-UHFFFAOYSA-N	430.889	1.918	50	20	IDGD	
COC(=O)c1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c(F)c1	771847919	ZUFZTMYXGXFBDQ-UHFFFAOYSA-N	449.460	1.472	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)C[C@@H](O)c2cccc(F)c2)c1	772556399	VZTUHSXEAQUWIC-GOSISDBHSA-N	437.493	1.741	50	20	IDGD	
CC(C)[C@H](NC(=O)NC(C)(C)C)C(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772888468	JIBBPNGOAZZWAF-AWEZNQCLSA-N	425.917	1.226	50	20	IDGD	
O=C(Cn1cc(NC(=O)C(=O)NNc2ccc(C(F)(F)F)cn2)cn1)NC1CCCC1	773665497	FXUZUJUIWXMOQG-UHFFFAOYSA-N	439.398	1.438	50	20	IDGD	
CCCc1nnc(S)n1CC(=O)NNC(=O)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	774244301	HZJFJECPAMKRPV-GFCCVEGCSA-N	426.543	1.314	50	20	IDGD	
C[C@@H](NCC(=O)NNC(=O)c1cccc(C#N)c1)c1cc(F)ccc1N1CCC(O)CC1	775355163	ACSSHMSJNIWQGU-OAHLLOKOSA-N	439.491	1.770	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1)c1ccc(OC)cc1	775781165	ZWDFUKSLIQZIEZ-OAQYLSRUSA-N	438.528	1.794	50	20	IDGD	
O=C(CSc1ccc(Cl)cc1)NNC(=O)Nc1ccnn1[C@@H]1CCS(=O)(=O)C1	776052794	BOKWLIZFXADAKE-GFCCVEGCSA-N	443.938	1.841	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)N[C@@H]3CCO[C@]4(CCS(=O)(=O)C4)C3)cc2C1	776077000	PQUUKQWCLUREND-BBEGDGIKSA-N	441.575	1.553	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])c1	776537646	LYMJVDXGHJAUBF-UHFFFAOYSA-N	426.838	1.525	50	20	IDGD	
COC(=O)[C@@H](NCC(=O)NNC(=O)c1cccs1)c1ccc(Br)cc1	777614065	YDXHGLWYYFCVRO-AWEZNQCLSA-N	426.292	1.776	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)[C@H](CSC)N2C(=O)[C@@H]3CCCC[C@H]3C2=O)nc1C	778427958	GZGCKATYQQTXOV-NFAWXSAZSA-N	449.533	1.312	50	20	IDGD	
COC[C@H](C)n1ccc(NC(=O)C(=O)NNC(=O)c2cc(C)n(-c3ccccc3)c2C)n1	778706480	RZOOJCXDIVJYMY-HNNXBMFYSA-N	438.488	1.898	50	20	IDGD	
COC[C@@H](C)n1ccc(NC(=O)C(=O)NNC(=O)c2ccc(COc3ccccc3)o2)n1	778709180	DABDQJHPJHBGQC-CQSZACIVSA-N	441.444	1.662	50	20	IDGD	
Cc1cc(Br)ncc1NC(=O)C(=O)NNc1cccc(S(C)(=O)=O)c1	784841620	MUESPDCAICZVSK-UHFFFAOYSA-N	427.280	1.638	50	20	IDGD	
COc1cccc(NNC(=O)C(=O)Nc2ccc(S(=O)(=O)N3CCC[C@H](C)C3)cc2)n1	784846628	ULDMMJKUUBUSNR-AWEZNQCLSA-N	447.517	1.593	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNc2ccc(C(F)(F)F)nn2)c(OC)c(OC)c1	784891224	JOXWUSDQNQKKOI-UHFFFAOYSA-N	443.338	1.381	50	20	IDGD	
C[C@@H]1CCCCN1CC(=O)Nc1ccc(F)c(NC(=O)C(=O)NNc2ncc(F)cn2)c1	784950399	YXSJJUNBHXSNNF-GFCCVEGCSA-N	447.446	1.650	50	20	IDGD	
COC(=O)[C@](C)(CNC(=O)NNC(=O)c1csc(N2CCOCC2)n1)c1ccccc1	787256186	ZHJSMXZZQYPFEP-HXUWFJFHSA-N	447.517	1.055	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2O)cc1C(=O)N(C)C(C)C	787542768	QRMJTKPBNVEFLY-UHFFFAOYSA-N	442.472	1.346	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cccc1N1CCNC1=O	787550601	WGYNQTLDQYONFO-UHFFFAOYSA-N	447.455	1.110	50	20	IDGD	
CN(NS(=O)(=O)Cc1cccc(F)c1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	788918828	YTQDGHXHKIDANF-UHFFFAOYSA-N	430.502	1.765	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)c(OC)c1OC	789809748	FRZLJTUFGPKATC-YOEHRIQHSA-N	443.456	1.371	50	20	IDGD	
CCS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)cc1	789811926	GZBKAXQFQMELKG-ROUUACIJSA-N	445.497	1.139	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)c1c[nH]nc1-c1ccoc1	789991604	UITBEFAIUMEGMM-UHFFFAOYSA-N	442.907	1.902	50	20	IDGD	
O=C(NNC(=O)c1nc(Br)ccc1Br)C(=O)Nc1ccccn1	790773225	VXUSCAFLIZIFDC-UHFFFAOYSA-N	443.055	1.401	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H](OC)C2CC2)c1	792010892	BSAHJGRJDRNVKZ-GOSISDBHSA-N	433.486	1.682	50	20	IDGD	
O=C(NC[C@H]1CCCO1)Nc1ccc(NC(=O)C(=O)NNc2nc3ccccn3n2)cc1	792389363	UAXJUZCXCBPQSW-OAHLLOKOSA-N	438.448	1.112	50	20	IDGD	
CN(C)N(C(=O)[C@H]1CCCN(C(=O)Nc2ccccc2F)C1)[C@@H]1CCS(=O)(=O)C1	792855048	NMBQPPPYTNTOPI-LSDHHAIUSA-N	426.514	1.562	50	20	IDGD	
COC(=O)c1cc(Cl)cc(Cl)c1S(=O)(=O)NNC(=O)COc1ccccc1O	795824437	NCBSMVYTDWKPHY-UHFFFAOYSA-N	449.268	1.874	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(F)cc2-c2cnn(C)c2)cc1	796991730	IFRBCDJSWNPVHE-UHFFFAOYSA-N	441.419	1.400	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNC(=O)C(=O)N1CCc2c(Cl)cccc21	797368595	DVEIVIJDXHQDDN-UHFFFAOYSA-N	430.848	1.303	50	20	IDGD	
Cc1c(C(=O)NNC(=O)NCC(F)(F)F)nnn1C1CCN(C(=O)OC(C)(C)C)CC1	798316152	JVUARDGQHUMWDJ-UHFFFAOYSA-N	449.434	1.665	50	20	IDGD	
N#Cc1cccc(-n2ccc(C(=O)NNC(=O)CCN3CCN(c4ccccc4)CC3)n2)c1	798347541	JCGUHCWCIWIVDE-UHFFFAOYSA-N	443.511	1.717	50	20	IDGD	
Cc1cn(-c2ccc(F)cc2)nc1C(=O)NNC(=O)c1csc(N2CCOCC2)n1	801104120	CVRDXAZFYYJERB-UHFFFAOYSA-N	430.465	1.688	50	20	IDGD	
CN(CC(=O)NNC(=O)Nc1ccc(Cl)cc1)S(=O)(=O)c1cccc([N+](=O)[O-])c1	802020814	IOQSPEHMAXTUIT-UHFFFAOYSA-N	441.853	1.722	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)c2cc(C)ccc2S(N)(=O)=O)cc1Cl	802074891	BNLCBKPNDRETTQ-UHFFFAOYSA-N	442.881	1.780	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)CSCC(=O)N2CCOCC2)cc1Cl	802076108	UUPPLWOFVWCZFF-UHFFFAOYSA-N	446.913	1.102	50	20	IDGD	
CCCCNC(=O)NNS(=O)(=O)c1ccc(S(C)(=O)=O)cc1Br	802721699	AHNBAAGAQXKIDE-UHFFFAOYSA-N	428.330	1.145	50	20	IDGD	
NS(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)Nc2ccc(Br)cc2)c1	803395869	FCKKWSGZJSJDCL-UHFFFAOYSA-N	431.243	1.702	50	20	IDGD	
CCOCCS(=O)(=O)NCC(=O)NNc1ccc(-c2cccc(C(F)(F)F)c2)nn1	804210566	NGQDFWMFKFIEEN-UHFFFAOYSA-N	447.439	1.561	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NC[C@H]1CCCS(=O)(=O)C1	804880758	NDJBTSZACYNMFD-VXGBXAGGSA-N	448.339	1.372	50	20	IDGD	
COc1ccc(CS(C)(=O)=O)cc1NC(=O)NNC(=O)c1c(C)nc2ccccn12	806638667	HDLDBTHTCCWFMN-UHFFFAOYSA-N	431.474	1.662	50	20	IDGD	
O=C1COc2c(cc(Cl)cc2NC(=O)C(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)N1	806974116	VEKJIXQGYHOEDH-UHFFFAOYSA-N	446.891	1.973	50	20	IDGD	
CNS(=O)(=O)c1cc(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2Cl)ccc1F	807005639	KEBCFFXFWAWJPA-UHFFFAOYSA-N	445.816	1.377	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCCc2ccc3c[nH]nc3c2)nc1	807242748	HDOJMDGMAOGIEZ-UHFFFAOYSA-N	431.522	1.857	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ccc(-n3ccnc3)nn2)c(-c2nc(C3CC3)no2)c1	807428477	AKPVQBNPRJIWRV-UHFFFAOYSA-N	445.443	1.980	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)NCCCn1cc(Br)cn1	807614179	ZBPLGOYALJNWKT-UHFFFAOYSA-N	426.271	1.454	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc2c(c1)nc(CCC(=O)NN(C)CCOC)n2C	808075429	YQHWCAOJFVGCSH-UHFFFAOYSA-N	425.555	1.146	50	20	IDGD	
Cc1nc2ccc(NC(=O)NNC(=O)c3ccc(S(=O)(=O)N4CCCC4)cc3)cn2n1	809897640	QNFXPXADASRWCR-UHFFFAOYSA-N	443.489	1.289	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2cc(C(=O)OC)ccc2Cl)c2ccccc2c1=O	809933037	OCTQTBXLQMKQRE-UHFFFAOYSA-N	428.832	1.931	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cccc3c2OCC(=O)N3)c(C)n1-c1ccccc1	810384893	KHCPWFHZZVQVCY-UHFFFAOYSA-N	447.451	1.825	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1C	810398068	FWVZGPVIQPRUAP-UHFFFAOYSA-N	427.486	1.229	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)C3(c4cccc(Br)c4)CC(=O)C3)nc21	810401518	UMVPCFGZJYNTBT-UHFFFAOYSA-N	431.250	1.575	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccc(OC(F)F)cc2)cc1	813033125	GAWBNOBHKXRCFC-UHFFFAOYSA-N	428.417	1.620	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2cc(F)c(F)cc2Cl)cc1	813033209	JTAHTTFCAUVVOC-UHFFFAOYSA-N	432.836	1.950	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cnn(C)c2I)c(OC)c1	815466732	IRCOPAJYMVKCAI-UHFFFAOYSA-N	430.202	1.117	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2)nnn1CCOc1ccc(F)cc1	815573460	LEPIHARGKDPKNJ-UHFFFAOYSA-N	443.395	1.795	50	20	IDGD	
COC(=O)C(C)(C)c1csc(NC(=O)C(=O)NNc2ccnc(Br)c2)n1	815601057	MLEQVWYRGNYGRA-UHFFFAOYSA-N	442.295	1.833	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccc([C@@H]3CCOC3)cc2)cc1	815657336	WGBBJZYJCZVWFO-OAHLLOKOSA-N	432.502	1.523	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)c1ccc(Br)cc1)C(=O)NNc1nc[nH]n1	816634122	ZCWNFBYCMYESJY-NSHDSACASA-N	449.356	1.111	50	20	IDGD	
C[C@@H]1CN(c2ccnc(C(=O)NNc3ccccc3S(=O)(=O)N(C)C)c2)C[C@@H](C)O1	817054365	GKFCWYDTZVKXHB-HUUCEWRRSA-N	433.534	1.702	50	20	IDGD	
COc1ccccc1NC(=S)NNC(=O)CN1C(=O)N[C@]2(CCc3ccccc32)C1=O	913440952	LNUJSKGSKPXIMB-NRFANRHFSA-N	439.497	1.406	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)N1CCN(CC(=O)N2CCCC[C@H]2C)CC1	913462923	IMQKALVCNQIINM-MRXNPFEDSA-N	441.536	1.016	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)c1ccc(F)c(S(=O)(=O)NC(C)(C)C)c1	914604021	LPFNIJJHGGOFRO-UHFFFAOYSA-N	447.492	1.933	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NN=C2CCN(c3cnccn3)CC2)c1	915935519	PLTAWAKXJRYXNN-UHFFFAOYSA-N	430.534	1.893	50	20	IDGD	
CCCn1nc(C(=O)NNS(=O)(=O)c2ccc(C)c(C(=O)O)c2)c2ccccc2c1=O	916102435	QOWXKKNVDZNYMU-UHFFFAOYSA-N	444.469	1.436	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCCCN2C[C@H](C)O[C@H](C)C2)nc1	916249783	KCYSGNFGUMSQSY-IYBDPMFKSA-N	442.586	1.238	50	20	IDGD	
CC(=NNC(=O)c1ccc2c(c1)OCO2)c1ccc(S(=O)(=O)NCCC(=O)O)cc1	916289133	ABUAYLKCXGSULP-UHFFFAOYSA-N	433.442	1.322	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)NCc2ccc(N3CCc4ccccc4C3)nc2)n1	916432909	UEBYMTMUVDGLCF-UHFFFAOYSA-N	433.516	1.988	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NC[C@@H](C)N2CCN(c3ccccc3)CC2)cc1OC	916514802	NWVOMTLRHXLXAG-QGZVFWFLSA-N	441.532	1.859	50	20	IDGD	
COc1cc(CNC(=O)NNC(=O)COc2cccc(C)c2)ccc1OCC(=O)N(C)C	916641480	LOOKGPFVBGIRFO-UHFFFAOYSA-N	444.488	1.380	50	20	IDGD	
CCn1c(SCC(=O)NNC(=O)C(=O)Nc2ccc(C)cc2)nnc1-c1ccco1	916830484	BNVJRGPQMBGAFD-UHFFFAOYSA-N	428.474	1.745	50	20	IDGD	
N#Cc1ccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1	916968779	JBSXTLHUOLBFSQ-UHFFFAOYSA-N	429.458	1.046	50	20	IDGD	
CCS(=O)(=O)N1CCC[C@@H](C(=O)NNC(=O)COc2cc(C)ccc2C(C)C)C1	918552359	QRMDBDNIHRGFEA-MRXNPFEDSA-N	425.551	1.706	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)CCC(=O)N2CCc3sccc3C2)cc1	919599158	LZRSJYQJVZONQI-UHFFFAOYSA-N	429.498	1.726	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccncc2)nc2ccccc12)N[C@@H]1CCS(=O)(=O)C1	919884715	KQQKHNKKWYMYTE-CQSZACIVSA-N	425.470	1.428	50	20	IDGD	
COc1ccc(-n2ccc(CNC(=O)NNC(=O)COc3ccccc3[N+](=O)[O-])n2)cc1	919916224	DYAVLIOCIWJYOB-UHFFFAOYSA-N	440.416	1.699	50	20	IDGD	
C[C@@H]1CN(Cc2cccc(CNC(=O)NNC(=O)c3ccc4c(c3)OCCO4)c2)CCO1	920237799	MZPZETHNIIZPPA-MRXNPFEDSA-N	440.500	1.823	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)c1cc([N+](=O)[O-])cc(S(C)(=O)=O)c1	920287688	ILVOHLUGZXVBPN-UHFFFAOYSA-N	445.457	1.372	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)[C@@H](C)OC[C@@H]1CCCCO1	921225872	KXGSJZCGVYHQSP-OCCSQVGLSA-N	428.869	1.627	50	20	IDGD	
CN1CCc2nc3ccccc3c(C(=O)NNC(=O)c3nnc(O)c4ccccc34)c2C1	934990773	NNMZZDCOGNZCDQ-UHFFFAOYSA-N	428.452	1.946	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)c1ccc([S@](C)=O)cc1	1116382642	BRBJBVBKSLOHPO-GTMAHKLRSA-N	427.486	1.376	50	20	IDGD	
CC/C=C(/C)C(=O)N1CSC[C@@H]1C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C	1251873829	FWRZXHBRNLRHFG-FFXRNRBCSA-N	429.543	1.099	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)NCc2cccc(CN3CCN(C)CC3)c2)c1	1318284668	YWXQVGZOUGPBID-UHFFFAOYSA-N	425.533	1.652	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)c3cn(-c4ccc(Br)cc4)nn3)nc21	1319291025	JQMLRTJZVAZWNC-UHFFFAOYSA-N	430.226	1.169	50	20	IDGD	
Nc1cnnc(NNC(=O)c2cc(I)cc([N+](=O)[O-])c2)c1Cl	1319631246	WSBVRXBIRLAPOL-UHFFFAOYSA-N	434.581	1.982	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)N2CCC(C(=O)NNc3ccn(C)n3)CC2)cc1	1321387905	BRIMALXNCQXHOV-UHFFFAOYSA-N	435.506	1.141	50	20	IDGD	
CNc1ccc([N+](=O)[O-])cc1C(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	1321435617	YHWQQHIIZNMRBP-UHFFFAOYSA-N	436.469	1.886	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3cc4c(cn3)OCCC4)cc2)CC1	1342145416	IGDJGUGLTAWPNU-UHFFFAOYSA-N	431.518	1.100	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)COc3cc(Cl)ccn3)C2)C1	1779231889	BVXPSDMYARLTEV-PXAZEXFGSA-N	446.729	1.727	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@@H](C(=O)N2CCO[C@@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)C1	1779301788	VPQZLTKWTHMZHR-CBGDNZLLSA-N	440.613	1.647	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Br)C2)c1ccnnc1O	1779965169	HMTFYVUMTSCUMD-BFQNTYOBSA-N	431.262	1.000	50	20	IDGD	
COc1c(Cl)ccnc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2	1780171749	NCQCAWDSGVVGLR-IQUTYRLHSA-N	446.331	1.471	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1nc[nH]c1[N+](=O)[O-])C2	1780712220	XKHRLHAJUQMPCU-SSKCKEOISA-N	448.307	1.682	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(OC)c(OC)c3O)C2)C1	1781826964	OCHLBCYAFUCEAX-VLIAUNLRSA-N	426.897	1.870	50	20	IDGD	
Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1781983872	RUAIHEHIVAHTKK-KBXCAEBGSA-N	429.832	1.086	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(C)nc(O)c1)C2	1782173146	YPPPRPMWRDKBMO-RZQQEMMASA-N	425.913	1.477	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCn1nc(C)cc1C)C2	1782177871	FJSKRQMQOGOSQG-DBXWQHBBSA-N	440.972	1.658	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)c1cnc(Cl)nc1	1783377495	BVMYISCXTOGSPL-DRZSPHRISA-N	431.718	1.508	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3csc4c3CCCC4)C[C@@H]21)[C@@H](O)CCl	1784092141	HTWALZOQZHRBJW-CSFVBSKPSA-N	426.966	1.820	50	20	IDGD	
Cc1cc(C)n(CCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCBr)[C@H]3C2)n1	1786407900	ZDODPEMJSPNRIX-ULQDDVLXSA-N	441.370	1.655	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C=C3\C(=O)Nc4ccccc43)[C@H]2C1	1788533409	DLAXKAUBTDRZJE-MSBMTRHWSA-N	447.919	1.256	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C=N/N3CCCCC3)[C@H]2C1	1788603768	RPXHJEUHFFQONS-HGRLGPAASA-N	443.386	1.611	50	20	IDGD	
CC(C)n1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)Br)C[C@@H]32)n1	1789373289	YVJKVGALHNBREC-HOSILWTGSA-N	427.343	1.841	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C[C@H](N)c3cccnc3)C[C@@H]21	1789866268	MUXFANMXDMEWEV-DRCYAFTPSA-N	443.375	1.688	50	20	IDGD	
Cc1cccc(CCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]3C2)n1	1789922047	DEUDMGWVIJHXPI-MBGYTDRXSA-N	442.329	1.993	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc4nc[nH]c34)C[C@@H]21	1791057165	FYJIMCJCRCWRJF-DUPGQFARSA-N	435.322	1.940	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Nc1nccs1)C2	1792867555	CSNRZTUXUMVMPE-XGFWRYKXSA-N	445.383	1.564	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cncc(N(C)C)c1)C2	1792870192	LXOPPWLERTVOEL-FAYQHZLMSA-N	439.354	1.382	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1C[C@@H]1c1ccc(F)cc1)c1cccc(B(O)O)c1	1792910366	XDPFQTWHGHMVIJ-PVIWCNJMSA-N	436.292	1.561	50	20	IDGD	
CC(C)(C)OC(=O)N1CC=C(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](O)CCl)C3)C1	1793423440	WAVGENGNFHCQBO-QKPAOTATSA-N	427.929	1.401	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2)c1ccc(Cl)nc1F	1794243281	AQQRDGXCAXLXEJ-WDAIWFPHSA-N	434.693	1.862	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)c1ccc2ncccc2c1	1796188991	KSCQZLWOUSNEFI-WKCHPHFGSA-N	429.285	1.480	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](N)Cc1cscn1	1796744100	DIIQACMJMDLDSZ-OPYWOCCESA-N	429.384	1.682	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc3c(c1)CCO3)C2	1797956608	QLSNJRNBYNGBPP-OPMZPASUSA-N	432.593	1.605	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](F)c1ccccc1)C2	1798439669	VJOHCKJGJVCYBT-RCJHGTSTSA-N	425.464	1.648	50	20	IDGD	
CN(C)c1cccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)c1	1799627387	LFRXZPJAIIHMHP-VBUUOAMHSA-N	436.516	1.317	50	20	IDGD	
O=C(CCBr)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CC[C@@H]2CCC(=O)N2C1	1799927168	IYNRMNBDSKUICX-DGXTUMSLSA-N	426.355	1.811	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C[C@H](O)CNC(=O)OC(C)(C)C	1800180031	OGUYDYDQAWPQQR-QRJUGERDSA-N	431.961	1.918	50	20	IDGD	
C[C@]1(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)/C(C#N)=C/c2ccc(F)cc2F)CCCN1	1800334143	BWUDFCYCGDAXAC-AOAJYTEHSA-N	444.482	1.603	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccnc1S)C2	1800638261	WFRJBLXUAZCMHF-XCCSTKFXSA-N	428.352	1.747	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1n[nH]c3c(F)cccc13)C2	1800759591	XBLVPQPMTJETQM-DYNIEEOBSA-N	439.285	1.689	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCBr)C3)c1	1801786164	NKDPDOMTLYYESP-JLVBRIDZSA-N	438.322	1.633	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H]1C[C@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Cl)C3)C1	1802083737	HQNUUUNPIAZTTM-LOVFCKMRSA-N	433.908	1.414	50	20	IDGD	
CNC(=S)NCCC(=O)N1CC[C@H](CNC(=O)C(C)(C)CCl)[C@H]1c1cccnc1	1802900710	DVQYLRSAOSTXQT-NVXWUHKLSA-N	440.013	1.836	50	20	IDGD	
O=C(O)c1cc(C(=O)NC[C@H]2CCN(C(=O)C(Cl)Cl)[C@@H]2c2cccnc2)ncn1	1804974269	RBXVNTQEZJGQRE-BXUZGUMPSA-N	438.271	1.693	50	20	IDGD	
Cc1cc(C(=O)NC[C@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)no1	1805840060	YRPVDDWQDIBQMK-UZLBHIALSA-N	428.493	1.071	50	20	IDGD	
Cc1ncccc1C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1807369946	ZJNSGZAVHKJZAU-KNQAVFIVSA-N	444.300	1.098	50	20	IDGD	
CO[C@H](C)C(=O)N1CC[C@H](CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@H]1c1cccnc1	1808416135	FHLNZNOLLGQKFV-DJPGYCMPSA-N	440.504	1.256	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CCn2ccnn2)[C@H]1c1cccnc1)[C@H](F)Br	1808681546	VSRPKQJFJVDSBZ-BPUTZDHNSA-N	439.289	1.460	50	20	IDGD	
Cc1cnc2c(C(=O)NC[C@@H]3CCN(C(=O)[C@H](O)CCl)[C@@H]3c3cccnc3)cnn2c1	1809830171	AZFUWZPCARVPNI-CGTJXYLNSA-N	442.907	1.352	50	20	IDGD	
Cc1cc(CCC(=O)N2CCC3(CCCN(C(=O)c4ccc(B(O)O)cc4)C3)CC2)ccn1	1809969001	KVBFPOWRQBFFBX-UHFFFAOYSA-N	449.360	1.547	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)[C@@H](C)Cn2cncn2)[C@H]1c1cccnc1	1810480050	MRWVSHKFHHHDRY-XJNFMUPTSA-N	449.353	1.799	50	20	IDGD	
Cc1cnoc1C(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1811250583	SEOUXCDAKYWNRA-APWZRJJASA-N	428.493	1.071	50	20	IDGD	
Cc1cc(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)n(C(F)F)n1	1811520981	NZEJHGRWSJETEL-BPUTZDHNSA-N	441.866	1.901	50	20	IDGD	
CC[S@](=O)CCC(=O)N1CC[C@H](CNC(=O)[C@H](Cl)COC)[C@H]1c1cccnc1	1813032916	XXFNPZJGEZZXCO-VSDHEAMUSA-N	429.970	1.500	50	20	IDGD	
Cc1nc(C)c(C(=O)N2CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)o1	1813073868	PKQBHDBTKNIPQY-FXAWDEMLSA-N	442.520	1.379	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](C)CS(C)(=O)=O)n[nH]1	1815232011	DCUQULVAKBSYJL-OBJOEFQTSA-N	434.946	1.336	50	20	IDGD	
Cc1cccnc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1815396795	MXHDSPFVJLHFAF-GOSISDBHSA-N	433.277	1.413	50	20	IDGD	
O=C(N[C@@H]1CCc2nc(NC(=O)C3(F)CCCCC3)sc2C1)c1ccc(B(O)O)cc1	1818743188	BIVUEGFYRIWSLB-OAHLLOKOSA-N	445.325	1.721	50	20	IDGD	
CCOC(=O)N[C@@H](O)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)C(C)(C)CCl)CC2	1819458905	YSDUDFHBKQYXQC-RNCFNFMXSA-N	432.930	1.385	50	20	IDGD	
CNC(=S)NCCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](C)Br)n[nH]1	1822188947	LVVVAVYYWXUSDH-ZYHUDNBSSA-N	445.387	1.669	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)C(C)(C)CNC(C)=O)[nH]n1	1822372137	ZJZJJVIDVIXILP-DZGCQCFKSA-N	427.933	1.818	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)ccn1	1822415077	RXMWQCXIVINGAJ-KRWDZBQOSA-N	427.509	1.792	50	20	IDGD	
O=C(N[C@@H]1CCc2nc(NC(=O)[C@@H]3CC[C@@H]4CCC(=O)N4C3)sc2C1)[C@@H](O)CCl	1822621397	FHFDPIOVCSRKMO-BYNQJWBRSA-N	440.953	1.056	50	20	IDGD	
CC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)Cn1cc([N+](=O)[O-])cn1)CC2	1822840709	BUSMBXUVFZDFLB-ONGXEEELSA-N	426.886	1.877	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)C1=NNC(=O)C1)CC2	1825445845	JOFAJRDXMXLIIE-YUMQZZPRSA-N	428.312	1.105	50	20	IDGD	
O=C(CN1CCCCC1=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCBr)CC2	1825860660	NOAJVXQACLLAER-NSHDSACASA-N	443.367	1.853	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC([C@H]2CCCCN2C(=O)Cn2ccnn2)CC1	1827235290	ZYYZWQIVQCLORZ-GDBMZVCRSA-N	426.359	1.929	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4n[nH]cc4c3)C2)C1	1830357868	NJPRFEOOJPWMML-NRFANRHFSA-N	434.924	1.898	50	20	IDGD	
CCCNC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](Cl)CCC)CCO2	1831640717	QMTCYJDAWJUMFV-JXFKEZNVSA-N	431.961	1.157	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)C2=NN(C)C(=O)CC2)CC1	1831648454	GOQDCAULEHMUSW-XJKSGUPXSA-N	441.370	1.998	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(C)nc3O)C2)C1	1831653815	FAGRVDPDBJWVQO-OXJNMPFZSA-N	425.913	1.573	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CC[C@H](C(=O)OC)CC1)CCO2	1832013102	HIKUVSYUDVWDJG-BZLDKRAPSA-N	444.956	1.440	50	20	IDGD	
CC(C)(CCl)C(=O)NC1CCN(C2CCN(C(=O)CN3CCCC3=O)CC2)CC1	1833214110	BKVSKXJPKVYSMH-UHFFFAOYSA-N	426.989	1.445	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3c(F)cccc3F)CC2)CC1)[C@H](O)CCl	1833313520	IYBSONBAMDQDIF-QGZVFWFLSA-N	429.895	1.750	50	20	IDGD	
C#CCO[C@H](C)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)CBr)CC2)CC1	1833464244	SLYOTZWTFRIDBN-JKSUJKDBSA-N	442.398	1.627	50	20	IDGD	
CCc1oncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1	1834521004	RTONUGOCTFZFKW-ROUUACIJSA-N	434.320	1.543	50	20	IDGD	
O=C(CCN1CCCCC1)N1CCOC[C@@]2(C1)CN(C(=O)CCBr)CCO2	1834822168	BNJZBJGNYZNXDG-LJQANCHMSA-N	446.386	1.104	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cnn4ncccc34)CC2)CC1	1835040174	NTCOLXULXFRFKS-GOSISDBHSA-N	432.956	1.932	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1835123554	ACXSUFKMQQDYHO-MLGOLLRUSA-N	449.365	1.115	50	20	IDGD	
CC(C)NCCC(=O)N1CCC(N2CCC(NC(=O)CO[Si](C)(C)C)CC2)CC1	1835833591	VODMTHFHCXTZMI-UHFFFAOYSA-N	426.678	1.798	50	20	IDGD	
Cc1nccnc1C(=O)N1CCC(N2CCC(NC(=O)CO[Si](C)(C)C)CC2)CC1	1835836020	BHMOTFXCAOAXNB-UHFFFAOYSA-N	433.629	1.822	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)/C=C/c3cccs3)CCO2)C1	1835968403	IIEKEFUHYROODZ-QDYBUIJZSA-N	428.938	1.472	50	20	IDGD	
CC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)c3cn4ncccc4n3)CC2)CC1	1836393955	DHYHFJRTNLHOQN-KRWDZBQOSA-N	432.956	1.932	50	20	IDGD	
CN1N=C(C(=O)N2CCC(OC3CCN(C(=O)C(C)(C)CCl)CC3)CC2)CCC1=O	1836622176	XWYITWXQEXYGPD-UHFFFAOYSA-N	440.972	1.858	50	20	IDGD	
O=C(c1cncc(C(F)(F)F)c1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1838181092	IBVCNDXOIIWGJN-CZUORRHYSA-N	439.793	1.705	50	20	IDGD	
Cc1ccc(O)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)c1	1838892813	BWJOUBJGAHMASE-OAQYLSRUSA-N	436.581	1.622	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3c(C)noc3C)C2)C1	1839142745	YRVKEMZYSRJGBV-YLJYHZDGSA-N	427.929	1.698	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CN3CCCCC3)C2)C1	1839151826	FCMHKEBRXOPQLR-RBUKOAKNSA-N	436.380	1.165	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3cccc(F)c3F)CCO2)C1	1839982752	ZEGNLEFBVUVGPC-MGPUTAFESA-N	430.879	1.981	50	20	IDGD	
CC(C)c1ccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)cc1	1839999970	CTPNGJFMJBIEQR-KNQAVFIVSA-N	438.952	1.409	50	20	IDGD	
Cc1nc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)ccc1F	1840031040	DNHRHVKAKPYXBC-XIKOKIGWSA-N	444.301	1.383	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)COc3ccccc3C#N)CCO2)C1	1840818000	FHZQDQSANGVKAM-QFIPXVFZSA-N	449.935	1.658	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)C[C@H]2OCCc3ccccc32)C1	1841553789	UQKMEBHRRSVSLK-HXUWFJFHSA-N	449.511	1.206	50	20	IDGD	
CO[C@H](C)[C@@H](C(=O)N1CC2(CCCN2C(=O)[C@H](F)Cl)C1)N(C)C(=O)OC(C)(C)C	1843365463	RXYPDGRWUUVFIZ-RDBSUJKOSA-N	435.924	1.995	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2occc2Br)C1	1843484697	VGESHVRYMFNWAS-UHFFFAOYSA-N	448.277	1.171	50	20	IDGD	
COc1ccc([N+](=O)[O-])c(C(=O)N2CCCC23CN(C(=O)[C@@H](C)Br)C3)n1	1843586697	FLVOIYNYRZYLNA-SNVBAGLBSA-N	427.255	1.599	50	20	IDGD	
C#CCOCCOCCOCCOCCOCCOCCOCCBr	2048532402	KJXXVJVAPLDNTE-UHFFFAOYSA-N	427.332	1.131	50	20	IDGD	
COc1ccc(-c2n[nH]cc2C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)cc1	10887574	YFRJSCUNMCCEMG-UHFFFAOYSA-N	442.501	1.762	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)CCS(=O)(=O)c1ccc2c(c1)OCCO2	28714627	QTEUPPBFJYHUMA-UHFFFAOYSA-N	444.469	1.039	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)CCc2c(C)nn(CCC#N)c2C)c2ccccc2c1=O	46541999	VDDFQLPQXGLUOU-UHFFFAOYSA-N	435.488	1.537	50	20	IDGD	
CCCCS(=O)(=O)N1CCC(C(=O)NNC(=O)c2ccc(Cl)cc2OC)CC1	108054846	DWZCWLYUDVLVER-UHFFFAOYSA-N	431.942	1.952	50	20	IDGD	
C[C@@H](c1ccc(S(C)(=O)=O)cc1)N(C)C(=O)NNC(=O)CNC(=O)c1cccs1	725872292	CGNVRTRFLPXLIB-LBPRGKRZSA-N	438.531	1.315	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)CCNC(=O)c2ccc(C)cc2O)cc1	726379889	UUGNHIWJJBLGAP-HNNXBMFYSA-N	429.473	1.834	50	20	IDGD	
CN(C)N(C(=O)Cn1c(S)nnc1-c1ccc(Cl)cc1)[C@H]1CCS(=O)(=O)C1	728178894	MFKKYBMGMPQKFJ-ZDUSSCGKSA-N	429.955	1.380	50	20	IDGD	
CCOc1ccc(OCC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)cc1	728212788	DYGOFCHCKHKOER-UHFFFAOYSA-N	448.545	1.544	50	20	IDGD	
CCN(CCNC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)C(=O)OC(C)(C)C	729233680	LSVRSDRBVKLHIG-UHFFFAOYSA-N	428.511	1.291	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN(S(=O)(=O)Cc2ccccc2)C1)c1ccc2c(c1)OCO2	730512730	PYIVDEWBGLGGKT-KRWDZBQOSA-N	445.497	1.418	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)[C@H]2CCN(c3ccc4c(c3)OCCO4)C2=O)cc1C	730513027	ULOOYHAGORSBNN-GOSISDBHSA-N	439.468	1.654	50	20	IDGD	
CN(C)C(=O)CCN1CCC(NC(=O)NNC(=O)CCSc2ccc(F)cc2)CC1	731544197	SVOQNKCSKPTJHV-UHFFFAOYSA-N	439.557	1.581	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)[C@@H]2CCCN2c2ncnc3sccc23)C[C@@H](C)O1	732261537	DGNRVNFJLOUTCC-FMKPAKJESA-N	432.550	1.307	50	20	IDGD	
C[C@]1(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)CCOC1	733654977	PMONGAUSVWYUAU-OAQYLSRUSA-N	446.529	1.536	50	20	IDGD	
N#Cc1ccc(N2C(=O)N[C@@H](CCC(=O)NNC(=O)CCc3ccccc3O)C2=O)cc1	733806683	JMBJCFHFOBLOIH-KRWDZBQOSA-N	435.440	1.249	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)[C@H]2Cc3ccccc3C(=O)O2)CC1	734825004	PXVNSNXHRZMJAU-MRXNPFEDSA-N	432.477	1.498	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)COCc2ccccc2)sc1Br	737922897	DWGXUPIPBXDQAO-UHFFFAOYSA-N	448.320	1.136	50	20	IDGD	
CN1CCN(CCCNC(=O)NNC(=O)COCc2ccccc2)[C@@H](c2ccccc2)C1	738456101	CVEQKZQLXNLZAZ-JOCHJYFZSA-N	439.560	1.912	50	20	IDGD	
CC(C)(C)OC(=O)N(CC(=O)NNC(=O)CNC(=O)c1cccs1)C[C@@H]1CCCO1	741921811	YFIYRBBBMRSGFD-ZDUSSCGKSA-N	440.522	1.041	50	20	IDGD	
Cc1nn(C)c(C)c1S(=O)(=O)N[C@H](C)C(=O)NNc1ccc(Cl)cc1[N+](=O)[O-]	742047983	IITNKYOSILVWQP-SECBINFHSA-N	430.874	1.409	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C[C@@H](C)/N=C2/NS(=O)(=O)c3ccccc32)c1	742471248	BFZVIPSFWLSQFK-CQSZACIVSA-N	430.486	1.039	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)c1ccc(F)c(Br)c1	742477030	FMLBQJJFFIMTFM-UHFFFAOYSA-N	429.271	1.956	50	20	IDGD	
O=C(Cc1ccc(NC(=O)C2CC2)cc1)NNC(=O)c1csc(N2CCOCC2)n1	742478409	NZNWAEFGEWHNGR-UHFFFAOYSA-N	429.502	1.332	50	20	IDGD	
C[C@H]1NC(C(=O)NNC(=O)c2cccc(Br)c2)=NN(c2ccccc2)C1=O	742773138	NZCJJEBGMQFGIZ-LLVKDONJSA-N	430.262	1.549	50	20	IDGD	
O=C(NC[C@H]1CCCN(Cc2ccccc2)C1)NNC(=O)c1ccc(-n2cnnn2)cc1	743359120	RUPIIJHKAWLYPR-GOSISDBHSA-N	434.504	1.519	50	20	IDGD	
CC(=NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1ccc2c(c1)COC2	743418424	YTKGACSXLNPKAS-UHFFFAOYSA-N	429.498	1.892	50	20	IDGD	
CN(C)C(=O)COc1cccc(CNC(=O)NNC(=O)Nc2ccc(N(C)C)cc2)c1	743540816	YRQZZERCEKDMHG-UHFFFAOYSA-N	428.493	1.756	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)N[C@@H]2CC(=O)N(CCOc3ccccc3)C2)c1	743636129	GBPUHSFWCGDYKK-QGZVFWFLSA-N	425.489	1.377	50	20	IDGD	
O=C(CCN1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O)Oc1ccc([N+](=O)[O-])cc1Br	744168160	KCGHMCVSBVHZMK-GBOPCIDUSA-N	439.218	1.815	50	20	IDGD	
COc1ccc(C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)cc1Br	744583579	FYHFMWJQSNQWKP-UHFFFAOYSA-N	432.230	1.947	50	20	IDGD	
Cc1ccc(C)n1-c1nc(CC(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)cs1	744764410	QZNWEIZODVUBBJ-UHFFFAOYSA-N	437.481	1.969	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)CCCNC(=O)c2ccc(F)cc2)cc1	744854449	SEZUYTVJBOVGGN-UHFFFAOYSA-N	426.404	1.212	50	20	IDGD	
CC(=O)[C@@H]1CC(C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)=NN1c1ccccc1	745029002	KQKXBOPIRSUJOY-IBGZPJMESA-N	433.424	1.086	50	20	IDGD	
CC(C)(C)C(=O)Nc1nc(CC(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)cs1	745515937	MIWOEBLCOCEPEU-UHFFFAOYSA-N	443.485	1.546	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)N[C@H](C)c1nc(C(C)(C)C)no1	745917776	PLGZFRNBLNZRAF-LLVKDONJSA-N	437.526	1.674	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)CCN/C(O)=C2/N=CC=CC2=O)c1	746215263	MJVXQVDVEURNIA-ICFOKQHNSA-N	437.250	1.135	50	20	IDGD	
NC(=O)NCCCCCC(=O)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1	747787831	XIOSXVCSBAIKOL-NRFANRHFSA-N	437.544	1.990	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)NC2CCN(C3CCN(C)CC3)CC2)cc1	747990667	URPMUUYKLROXSE-QGZVFWFLSA-N	447.580	1.742	50	20	IDGD	
O=C(NNc1ccc(Br)cc1F)C1=NN([C@H]2CCS(=O)(=O)C2)C(=O)CC1	748190205	TWOAFNLUCXIZCF-JTQLQIEISA-N	447.286	1.197	50	20	IDGD	
O=C(NCCC(=O)N1CCN(c2ccccn2)CC1)NNC(=O)c1ccc2ccccc2n1	748467558	TZJMDGOCUIBGEO-UHFFFAOYSA-N	447.499	1.313	50	20	IDGD	
C=CCN1C(=O)C(=O)N(CC(=O)NNC(=O)c2ccc(-c3ccc(F)cc3)s2)C1=O	748545943	AFUKABNHXHMBOL-UHFFFAOYSA-N	430.417	1.292	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1oc2ccccc2c1CSc1ncccn1	748614570	VRYNBMDKZWRMQY-GFCCVEGCSA-N	446.510	1.711	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)[C@@H]2CCCN2C(=O)c2ccc3ccccc3c2O)n1	750663266	LIJMUMBUMPMZTP-IBGZPJMESA-N	435.484	1.811	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)[C@H]2CC(=O)N(CCOc3ccccc3Cl)C2)c1	751888230	DBZBSXDKGKJBLB-INIZCTEOSA-N	426.860	1.900	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)NNC(=O)c2cc(F)ccc2Br)ccc1F	752521169	KOJFJLUWUXBOCY-UHFFFAOYSA-N	448.245	1.710	50	20	IDGD	
C[C@@H]1C[C@H](CCNC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)CCO1	753336945	RYMHWHVRFBNNID-HZPDHXFCSA-N	438.550	1.620	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2cccc(OC(F)F)c2)cc(F)c1F	755976484	ZEJIVKNPVSUWCR-UHFFFAOYSA-N	436.339	1.976	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)CN2CCC[C@H](NC(=O)c3cc4ccccc4o3)C2)cc1	756039157	JAKTXEPASLEDJH-IBGZPJMESA-N	445.479	1.960	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)Nc2cccc(S(=O)(=O)/N=C3/CCCCCN3C)c2)n[nH]1	756164971	ITNHDSXPNSLPPL-UQQQWYQISA-N	447.521	1.778	50	20	IDGD	
C[C@H]1C[C@H](C)CC2(C1)NC(=O)N(CC(=O)NNC(=O)c1cccc(OC(F)F)c1)C2=O	756978169	QZXUGLDUYKMYER-RYUDHWBXSA-N	438.431	1.796	50	20	IDGD	
Cc1cc(N2C[C@@H](C(=O)NNc3ccc(C(N)=O)nn3)CC2=O)ccc1Br	757406514	CDNVRBZIQADHGW-JTQLQIEISA-N	433.266	1.143	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNS(=O)(=O)c2cccc(F)c2C(=O)OC)cc1	757645404	LLILALUTMGFWQG-LBPRGKRZSA-N	440.449	1.788	50	20	IDGD	
O=C([C@@H](c1ccccc1)n1cccn1)N1CCN(S(=O)(=O)CBr)CC1	758534130	CIOJKBBCSQGHNK-OAHLLOKOSA-N	427.324	1.299	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)NCCCc1ccc2c(c1)OCCO2	758893984	GTODSMXYKDGWGG-UHFFFAOYSA-N	430.417	1.708	50	20	IDGD	
N#C/C(=C\c1cn(CC(=O)O)nn1)C(=O)Nc1cccc(S(=O)(=O)N2CCCCC2)c1	759074961	ZCVSHXPLKUFKOT-NTEUORMPSA-N	444.473	1.083	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccnn1Cc1ccc(F)cc1	760278547	YZYMHXFJAFCOIL-ZDUSSCGKSA-N	443.410	1.763	50	20	IDGD	
CN(NC(=O)c1cn(C)c(=O)c2ccccc12)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	760506796	YLGQDZQLORSFFV-UHFFFAOYSA-N	443.504	1.788	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)[C@@H](C)NS(=O)(=O)c2cccc(C(F)(F)F)c2)nc1	760788477	IQPUUJZWYBDEOM-SNVBAGLBSA-N	446.407	1.697	50	20	IDGD	
Cn1ccnc1C(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3n2)cc1	763453847	CEFNZDWBYGDZAW-UHFFFAOYSA-N	442.435	1.599	50	20	IDGD	
O=C(NNC(=O)c1cccnc1)C(=O)Nc1cnn(-c2ccccc2Br)c1	763494749	IMVIJHFNGIUMBP-UHFFFAOYSA-N	429.234	1.430	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2cc3ccccc3cc2O)c(OC)c1OC	763518399	VHOFXLONWQHICC-UHFFFAOYSA-N	439.424	1.971	50	20	IDGD	
COCCc1cc(NC(=O)C(=O)NNC(=O)c2sc3ccccc3c2Cl)n(C)n1	763576776	CEZVBUKJCVATOW-UHFFFAOYSA-N	435.893	1.877	50	20	IDGD	
Cc1ccc(Cn2nccc2NC(=O)C(=O)NNC(=O)COc2ccc(C)c(C)c2)o1	763665306	SWEJPDSWKWPFBG-UHFFFAOYSA-N	425.445	1.615	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2cccnc2N2CCCCC2)c1	763666008	TXZXHAKFKUDGJL-UHFFFAOYSA-N	425.489	1.854	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2cc(SC)ccc2C)c2ccccc2c1=O	763785507	GWNHQCBEZYWKEL-UHFFFAOYSA-N	439.497	1.846	50	20	IDGD	
COc1ccc(Cn2nccc2NC(=O)C(=O)NNC(=O)COc2ccc(C)cc2)cc1	763822045	VAYCQFHFSADSMU-UHFFFAOYSA-N	437.456	1.413	50	20	IDGD	
Cc1ccc(-c2noc(CCC(=O)NNC(=O)CNC(=O)c3cccnc3)n2)cc1F	763824727	MAPUEOGWTTUMEZ-UHFFFAOYSA-N	426.408	1.089	50	20	IDGD	
CCOc1cc(C(=O)N(C)C)ccc1NC(=O)C(=O)NNC(=O)c1ccc(CC)cc1	763832504	UVZXMYYAYAQJEM-UHFFFAOYSA-N	426.473	1.749	50	20	IDGD	
O=C(CCSc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccn(Cc2ccncc2)n1	763895971	VMVJRNJLWMPMSC-UHFFFAOYSA-N	442.476	1.734	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(CN(C)C)ccc2C)cc1OC	763902084	MXWZQEHDYKQZBZ-UHFFFAOYSA-N	428.489	1.864	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3ccc(-n4nccn4)nc3)cc2C1	763948239	ILYJNEODZYMGBH-NSHDSACASA-N	425.474	1.248	50	20	IDGD	
O=C(NNC(=O)c1ccc(COc2ccccc2)o1)C(=O)Nc1cnn(-c2ccccn2)c1	763955792	RGDVHICGHXESFU-UHFFFAOYSA-N	446.423	1.839	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)C(=O)Nc1ccccc1CS(=O)(=O)c1ccccc1	763996195	NDNOKUOALYWVTJ-UHFFFAOYSA-N	440.481	1.399	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)on2)cc1C(=O)N(C)C	764003556	GSOXIEGNWBTQMA-UHFFFAOYSA-N	435.440	1.752	50	20	IDGD	
CN(C)CCn1ncc(C(=O)NNC(=O)c2ccc3c(c2)OCCO3)c1-c1ccccc1	764009793	KGCZFTQUFGGFRD-UHFFFAOYSA-N	435.484	1.958	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cccc(C(F)(F)F)c2)cc1	764037698	UFQWWOHGHHVYAU-UHFFFAOYSA-N	429.376	1.509	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccn(-c2ccc(Cl)cc2C#N)n1	764040307	DZTXWDCTISYDLC-UHFFFAOYSA-N	438.831	1.806	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2cccc(C(F)(F)F)c2)c1	764078618	YNSUUILDCBFMFC-UHFFFAOYSA-N	429.376	1.509	50	20	IDGD	
Cc1ccc(Cn2cccc(NC(=O)C(=O)NNC(=O)c3ccc(Cl)nc3)c2=O)cc1	764100201	ISAZRGRSMOBYRW-UHFFFAOYSA-N	439.859	1.653	50	20	IDGD	
C[S@@](=O)Cc1cc(NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)ccc1Cl	764163478	JKSNRDIGLCOJSX-HYDGNGQDSA-N	435.889	1.308	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(Cl)c(C(=O)NC3CC3)c2)cc1	764177053	IACONHWTTULGLL-UHFFFAOYSA-N	425.832	1.504	50	20	IDGD	
COC(=O)c1ccc(N2CCCC2)c(NC(=O)C(=O)NNC(=O)CCc2ccccc2)c1	764192431	JMYMZNDVFAGQPB-UHFFFAOYSA-N	438.484	1.792	50	20	IDGD	
O=C(NNC(=O)c1cccc(OC(F)F)c1)C(=O)Nc1ccccc1CN1CCNC1=O	764250855	PDZXFEWDXRNWPE-UHFFFAOYSA-N	447.398	1.213	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)ccc1O)C(=O)Nc1cc(F)c(F)cc1F	764276940	JIPLZEMIIJIXGB-UHFFFAOYSA-N	432.152	1.972	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C(=O)Nc1cccc(NC(=O)[C@@H](C)OC)c1)c1ccccc1	764327843	GHVMSIAXHDMOIW-KDOFPFPSSA-N	426.473	1.940	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)C(=O)Nc1ccc(C)c(S(=O)(=O)N(C)C)c1)c1ccccc1	764330953	ZONOVJDBTCQCSZ-QGZVFWFLSA-N	446.529	1.525	50	20	IDGD	
COc1cccc(Cn2nccc2NC(=O)C(=O)NNC(=O)c2ncccc2C)c1OC	764385744	GRGUXWYARFNYED-UHFFFAOYSA-N	438.444	1.052	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)n(C(C)(C)C)n1	764387268	HYYJPKABQMPQRX-UHFFFAOYSA-N	427.440	1.875	50	20	IDGD	
CC(C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)cc1	764394615	UMKJLVIIMKIVJW-UHFFFAOYSA-N	430.486	1.409	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)[C@H](C)S(=O)(=O)C2CCOCC2)c1	764519707	BLXGLMHXEABGEX-HNNXBMFYSA-N	426.535	1.627	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)[C@@H]2CN(C(=O)OC(C)(C)C)CCO2)cc1F	765439351	YDRDRSUYASBQLX-AWEZNQCLSA-N	428.486	1.788	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)CN3Cc4ccccc4C3=O)n[nH]2)cc1OC	765597441	FHZZAVQHFLUBJL-UHFFFAOYSA-N	435.440	1.511	50	20	IDGD	
COc1cccc(OCC(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)c1	765751402	KRKFFUWUOJRGHP-UHFFFAOYSA-N	446.935	1.693	50	20	IDGD	
CN(c1ccccc1)S(=O)(=O)c1cccc(NC(=O)C(=O)NNc2cnccn2)c1	766260733	UHRHDPLUXQURQR-UHFFFAOYSA-N	426.458	1.384	50	20	IDGD	
CN(C)Cc1cccc(C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)c1	766663721	MMTWLYWSJXWCNI-UHFFFAOYSA-N	443.979	1.980	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N1CCC(CCC(N)=O)CC1	767190330	YUOYBOLIEABNIF-GFCCVEGCSA-N	441.326	1.935	50	20	IDGD	
O=C(NNC(=O)c1ccc(Br)c(C(F)(F)F)c1)N[C@@H]1CCS(=O)(=O)C1	768561786	GSUPOOGWSRISBX-MRVPVSSYSA-N	444.229	1.599	50	20	IDGD	
CCS(=O)(=O)NCc1ccc(C(=O)NNc2c(OC)cccc2S(C)(=O)=O)cc1	768637417	BCAMQMJJTCDZNZ-UHFFFAOYSA-N	441.531	1.295	50	20	IDGD	
C[C@@H](CNC(=O)NNc1nc(O)c2cnn(C)c2n1)Oc1ccccc1Br	770402079	OEDXGYURZRDFGU-VIFPVBQESA-N	436.270	1.925	50	20	IDGD	
Cc1cc2c(N3CCC[C@@H]3C(=O)NNC(=O)CNC(=O)c3ccco3)ncnc2s1	770529630	BTFFEQSVWBRLEU-CYBMUJFWSA-N	428.474	1.139	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)c1cnc2c(c1)NC(=O)CO2	770586481	GRPHVVYYMKGGNB-VIFPVBQESA-N	435.234	1.404	50	20	IDGD	
NC(=O)CCOc1ccccc1NC(=O)C(=O)NNc1ccc(Br)c(F)c1	770809913	CPAHGAFCZBTNTF-UHFFFAOYSA-N	439.241	1.924	50	20	IDGD	
C[C@H]1NC(C(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)=NN(c2ccccc2)C1=O	770970114	YMDYLYFKFPZKPV-LLVKDONJSA-N	437.464	1.068	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)c3cn(-c4ccccc4Br)nn3)nc21	770973763	HOFRENDPGHSHEX-UHFFFAOYSA-N	430.226	1.169	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)C(=O)N2CCC(C)CC2)c2ccccc2c1=O	771606337	OPCYMYRSVHDWII-UHFFFAOYSA-N	427.505	1.606	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)CN1C(=O)c2ccccc2N2C(=O)CC[C@]12C	771986168	VFFBGAYSOILUJQ-JLCFBVMHSA-N	444.488	1.111	50	20	IDGD	
Cc1ccc(S(N)(=O)=O)c(C(=O)NNC(=O)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)c1	773412213	UDOWLEZPNGCQKP-CYBMUJFWSA-N	440.522	1.051	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1cccc(N2CCOC2=O)c1	774006149	BGSFMLMPDQTZAG-LBPRGKRZSA-N	446.847	1.850	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)N[C@@H](CS(C)(=O)=O)c2ccccc2)nc2ccccc21	774285543	WONABGZCUCJWQY-INIZCTEOSA-N	429.502	1.232	50	20	IDGD	
CCOC1CC(CNC(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)(N2CCOCC2)C1	775145661	ICAKKJHVWHJHBS-IZINQKCZSA-N	438.500	1.193	50	20	IDGD	
CC1(C)OCC(C)(C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)CO1	775616213	FQPRROWDYOVRAO-UHFFFAOYSA-N	438.956	1.394	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)Nc2ccnn2[C@@H]2CCS(=O)(=O)C2)c1	776060565	YSQNLRHGXVLWGE-OAHLLOKOSA-N	449.533	1.906	50	20	IDGD	
CC(C)NC(=O)C(=O)NNC(=O)[C@@H]1CC(=O)N(C(C)C)[C@H]1c1ccc(Cl)c(F)c1	776703498	XGJKAVMWURRPGP-WBMJQRKESA-N	426.876	1.449	50	20	IDGD	
CC(C)Oc1ccc([C@@H]2CCCC2=NNC(=O)CSc2nn(C)c(=O)n(C)c2=O)cc1	776763795	PMKSOPUWCMLZEF-INIZCTEOSA-N	445.545	1.798	50	20	IDGD	
O=C(CCOc1ccccc1Cl)N1CCN(S(=O)(=O)CBr)CC1	777831436	AKSJQIFHROOVHU-UHFFFAOYSA-N	425.732	1.935	50	20	IDGD	
COc1ccc(N2CCN(C(=O)/C=C/C(=O)NNC(=O)NC3CCCCC3)CC2)cc1	778217877	LLLPACRROKQKBQ-VAWYXSNFSA-N	429.521	1.563	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)c2cnn(-c3ccc(OCC)nn3)c2C)nc1C	778421863	HLJFMLQVLNBQIC-UHFFFAOYSA-N	426.437	1.401	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CNC(=O)OC(C)(C)C)c1I	778438335	URDQEWQQLYCALU-UHFFFAOYSA-N	433.246	1.885	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)Nc2cc(S(=O)(=O)N(C)C)ccc2N(C)C)c1	780468306	KTMSNTONSKNROK-UHFFFAOYSA-N	435.506	1.938	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2cn(-c3cccc(Cl)c3)nn2)cc1	781028792	GAGCQVUMBDGTGU-UHFFFAOYSA-N	434.865	1.791	50	20	IDGD	
COCCN(CCOC)S(=O)(=O)c1ccc(C(=O)NNc2ccnc(F)c2)cc1	781367007	YOYVVBLMDRILQV-UHFFFAOYSA-N	426.470	1.261	50	20	IDGD	
CN(C)CCc1ccccc1NC(=O)C(=O)NNC(=O)c1cc(-c2cccs2)[nH]n1	782702241	LAVIYPBABRDTQN-UHFFFAOYSA-N	426.502	1.642	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(NC(=O)C(=O)NNc2ccc(Cl)cc2[N+](=O)[O-])c1	783290826	HEKRPSMIQTZSSO-UHFFFAOYSA-N	441.853	1.580	50	20	IDGD	
Cn1c(=NNC(=O)C(=O)Nc2cccc(C(=O)N3CCOCC3)c2)sc2ccccc21	783351952	PTIOCBLXSVBJKN-UHFFFAOYSA-N	439.497	1.283	50	20	IDGD	
Cn1ccc2ccc(NC(=O)C(=O)NNc3ccc(S(=O)(=O)NC4CC4)cc3)cc21	784210348	OXTVKCNLDGSJQB-UHFFFAOYSA-N	427.486	1.701	50	20	IDGD	
COc1cc2c(cc1NC(=O)C(=O)NNc1ccc(Br)nc1)NC(=O)CC2	784813901	TVKMIJQFQSABLL-UHFFFAOYSA-N	434.250	1.819	50	20	IDGD	
CSc1c(F)cc(NC(=O)C(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)cc1F	785023339	FWTDYTNDNJKHDR-UHFFFAOYSA-N	426.357	1.700	50	20	IDGD	
Cc1c(Cl)cc(F)c(NC(=O)C(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)c1F	785024491	ZYQVUPCFWYLBRV-UHFFFAOYSA-N	428.735	1.940	50	20	IDGD	
COc1ccc(COCc2cccc(NC(=O)C(=O)NNc3nccn(C)c3=O)c2)cc1	785085699	CVJGMMASBRBBIK-UHFFFAOYSA-N	437.456	1.588	50	20	IDGD	
Cn1c(=O)oc2c(NC(=O)C(=O)NNc3c(F)cc(C(=O)NC4CC4)cc3F)cccc21	785099778	KLAVYAMPHNWWAV-UHFFFAOYSA-N	445.382	1.384	50	20	IDGD	
COc1cc(C)c(NC(=O)C(=O)NNc2c(OC)cccc2S(C)(=O)=O)cc1F	785336867	CBLKXHHHFZLDAA-UHFFFAOYSA-N	425.438	1.637	50	20	IDGD	
CN(NC(=O)Nc1cccc2c1oc(=O)n2C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	785860145	HRKCDXBVPJVBLX-UHFFFAOYSA-N	448.480	1.773	50	20	IDGD	
CS(=O)(=O)c1cc(NC(=O)C(=O)NNC(=O)CCCc2cccs2)ccc1Cl	788333900	QJRJCHIESZEQKN-UHFFFAOYSA-N	443.934	1.914	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NC[C@H](C)NC(=O)OC(C)(C)C)cc(OC)c1OC	792257972	MQZXBDOZLYILRF-NSHDSACASA-N	426.470	1.570	50	20	IDGD	
CCOC(=O)c1nn(C)cc1/C=C(\C#N)C(=O)Nc1cc2c(cc1[N+](=O)[O-])OCCO2	792865167	BKGLJKDJDZCZSV-IZZDOVSWSA-N	427.373	1.822	50	20	IDGD	
CCn1ncnc1CNC(=O)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1	792879063	DJRFAYQYGBMGQY-FQEVSTJZSA-N	433.516	1.756	50	20	IDGD	
CC(=NNC(=O)c1ccc(O)c(O)c1)c1ccc(S(=O)(=O)NCCCN(C)C)cc1	794556970	LCTGLCGVTCDFLW-UHFFFAOYSA-N	434.518	1.482	50	20	IDGD	
CCC(=NNC(=O)[C@H](C)CN1CCOCC1)c1ccc(Cl)c(S(=O)(=O)NC)c1	794851179	PJHFFQQNHOTRDA-CYBMUJFWSA-N	430.958	1.447	50	20	IDGD	
COc1cc(Cl)c(C)cc1NC(=O)C(=O)NNC(=O)CNC(=O)OCc1ccccc1	797369396	UVFUUMDCYZQAIF-UHFFFAOYSA-N	448.863	1.669	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)Nc1ccc(S(=O)(=O)N(C)C)cn1	797653203	LMWRTGXOKJHJLJ-UHFFFAOYSA-N	439.519	1.286	50	20	IDGD	
Cc1nc(C(=O)NNC(=O)c2cc(-c3ccco3)nc3ccccc23)nn1-c1nc[nH]n1	798272693	AFKOSWAEFWRMLC-UHFFFAOYSA-N	429.400	1.577	50	20	IDGD	
C[C@@H](c1ccccc1)N(C)C(=O)CN(C)CC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	800500681	UENMGZJJJBOCOR-HNNXBMFYSA-N	427.461	1.507	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCC(=O)NNC(=O)Nc2ccccc2)cc1OCC	801992513	QWQUWQPJBJUTPA-UHFFFAOYSA-N	436.490	1.615	50	20	IDGD	
CS(=O)(=O)Cc1nc2ccccc2n1CC(=O)NNC(=O)Nc1cc(F)cc(F)c1	802001784	UJYZIKLWILOWAM-UHFFFAOYSA-N	437.428	1.712	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2cc(S(C)(=O)=O)ccc2F)cc1	802066333	UPAHERXOEBRERV-UHFFFAOYSA-N	429.451	1.099	50	20	IDGD	
Cc1c(/C=C(\C#N)C(=O)N[C@H](C)CCNS(=O)(=O)c2ccccc2)cc(C#N)n1C	802323692	LTTOBSTXPZVJDM-CLXYIWAZSA-N	425.514	1.985	50	20	IDGD	
CS(=O)(=O)CC[C@@H](NC(=O)c1ccc(Cl)cc1)C(=O)NNc1ncccc1F	804211176	HQUKOKCKUPBIAO-CQSZACIVSA-N	428.873	1.551	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccc(C(=O)N(C)CC)c1	806973783	JVGYLENEBUDHFN-UHFFFAOYSA-N	426.473	1.506	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1cc(Cl)ccc1C(F)(F)F	807004536	PKIAABWVEGMMHW-UHFFFAOYSA-N	448.810	1.936	50	20	IDGD	
Cn1cccc(NC(=O)C(=O)NNc2ccc(-c3cccc(C(F)(F)F)c3)nn2)c1=O	807298639	FWJVXIODIQLQRO-UHFFFAOYSA-N	432.362	1.943	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@@H](C)c2c(F)cncc2F)cc1	807556869	RJHAQOQZINDROX-LBPRGKRZSA-N	441.460	1.380	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNS(=O)(=O)c2cnc(NC(C)=O)s2)cc1	808070213	QXFSTQDDGSNFLB-JTQLQIEISA-N	428.492	1.277	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNS(=O)(=O)c1c(F)cccc1OC(F)(F)F	808086782	HUNNRDGKLBPACG-UHFFFAOYSA-N	425.316	1.057	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)[C@H]1C[C@@H](c2ccccc2)OC1=O	809539107	YRIRUDLNWBGNPR-RTWAWAEBSA-N	436.512	1.651	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)CNS(=O)(=O)c1c(Cl)cccc1Cl	810192841	AKOYVFUKPFKCCQ-UHFFFAOYSA-N	446.312	1.670	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)CNS(=O)(=O)c2ccc(Cl)cc2)o1	810201450	YPDUHYMFZHGIDJ-UHFFFAOYSA-N	442.925	1.514	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)Nc3cc(N(C)C)ncn3)n[nH]2)cc1OC	810217394	CMFYXCXCNUCFGH-UHFFFAOYSA-N	426.437	1.416	50	20	IDGD	
Cc1cc(C(F)(F)F)ncc1NC(=O)C(=O)NNC(=O)c1cc(Br)cn1C	810384231	HNBPHQRDKSACMO-UHFFFAOYSA-N	448.199	1.910	50	20	IDGD	
COC(=O)c1c(F)ccc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)c1C	810387365	SPAYEOUBNFAXRV-UHFFFAOYSA-N	439.346	1.678	50	20	IDGD	
NC(=O)c1ccc(OCC(F)F)c(NC(=O)C(=O)NNc2cc(F)c(F)c(F)c2)c1	810399623	XCYWINRTBXMXLR-UHFFFAOYSA-N	432.305	1.929	50	20	IDGD	
O=C(COC(=O)[C@H]1CCN(c2ccccc2F)C1)NNC(=O)c1ccc([N+](=O)[O-])cc1	811377599	CYJLHXUNBJNGOA-AWEZNQCLSA-N	430.392	1.565	50	20	IDGD	
CCOC(=O)c1ccc(NNC(=O)CC/N=C2/NS(=O)(=O)c3ccccc32)cc1C	812720688	AVWACPIGHXXCST-UHFFFAOYSA-N	430.486	1.744	50	20	IDGD	
O=C(NCc1cccc(NC(=O)c2ccncc2)c1)NNC(=O)[C@H]1CCc2nncn2C1	814281695	VCQFYQMPEHNTRQ-INIZCTEOSA-N	434.460	1.018	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)CNC(=O)OC(C)(C)C)c1ccc(N2CCCOC2=O)cc1	814449148	HFKINFVJDWBANU-ZDUSSCGKSA-N	435.481	1.949	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(OC(=O)NC)c2)cc1OC	815567384	WPHCJSXIZVUGMX-UHFFFAOYSA-N	430.417	1.212	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNc2ncncc2F)nnn1Cc1ccc(C(F)(F)F)cc1	815766112	OQRNBJMVBAYPTQ-UHFFFAOYSA-N	438.345	1.665	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)CN2C(=O)[C@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2=O)c1	816716200	BKCSYAQHMZUJLG-VUKUWZNJSA-N	448.273	1.486	50	20	IDGD	
CCOC(=O)[C@H](CC(=O)NNC(=O)[C@@H](C)Oc1cccc(Br)c1)C(C)=O	816828547	IQZOWYJPJGSFLS-BXUZGUMPSA-N	429.267	1.522	50	20	IDGD	
Nc1nc(C(=O)NNC(=O)c2ccc(-c3ccc(F)cc3)s2)nc(N2CCOCC2)n1	816829729	CATYRBSOWJNLNP-UHFFFAOYSA-N	443.464	1.233	50	20	IDGD	
O=C(COC(=O)c1ccc(C(F)(F)F)nc1)NNC(=O)[C@@H]1COc2ccccc2O1	844260127	ZWLXCKLDKDHJJZ-ZDUSSCGKSA-N	425.319	1.245	50	20	IDGD	
O=C(c1cc(S(=O)(=O)N2CCCCC2)ccc1Br)N1CC[C@@H](B(O)O)C1	864232805	CLQJADTYITVABR-GFCCVEGCSA-N	445.144	1.313	50	20	IDGD	
COc1cc(CNC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc(OC)c1OC	915932358	XPJNWHQHDBJDCZ-UHFFFAOYSA-N	441.444	1.104	50	20	IDGD	
COc1ccc([N+](=O)[O-])cc1CNC(=O)NNC(=O)c1cc(OC)c(OC)c(OC)c1	918018370	SVOHLZYXCSXETM-UHFFFAOYSA-N	434.405	1.773	50	20	IDGD	
Cc1cc(C)n2nc(C)c(C(=O)NNC(=O)CCN3CCN(c4ccccc4)CC3)c2n1	918191614	HZYUTUYDICAGDD-UHFFFAOYSA-N	435.532	1.628	50	20	IDGD	
CCn1c(=O)c(=O)[nH]c2cc(C(=O)NNC(=O)c3ccc(F)cc3Br)ccc21	918339491	PFPZIVAJRSPGFC-UHFFFAOYSA-N	449.236	1.686	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)[C@@H](C)Sc2nnnn2C2CC2)c2ccccc2c1=O	918410403	YTAXUAZBYNZJLX-LLVKDONJSA-N	442.505	1.241	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)NCc1ccccc1CS(=O)(=O)NC(C)C	919898683	DHGMIUHEUUDESI-UHFFFAOYSA-N	448.545	1.596	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)NCc1cccc(NC(=O)[C@H]2CCCO2)c1	920237811	NELSJDMXWVAPRA-LJQANCHMSA-N	426.473	1.886	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)NCc1cccc(C(=O)NC[C@H]2CCCO2)c1	920347574	ILABHFHBGYSMPS-LJQANCHMSA-N	428.464	1.808	50	20	IDGD	
Cc1ccccc1C1(C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)CCOCC1	920671705	FQANFAIAEBBYPE-UHFFFAOYSA-N	441.440	1.956	50	20	IDGD	
CN(C)Cc1cccc(NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1	920930056	FWXQVEGRSQNBPP-UHFFFAOYSA-N	445.545	1.999	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)CC2(CC(=O)N3CCOCC3)CCCC2)nc2ccccc21	1115824405	FNXYGKACTAKLRZ-UHFFFAOYSA-N	441.532	1.463	50	20	IDGD	
COc1ccc(C(=O)NN=C(C)c2ccc(S(=O)(=O)NCCCC(=O)O)cc2)cc1	1317674294	VFUYRPLTUZVNRV-UHFFFAOYSA-N	433.486	1.992	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1ccccc1N1CCCC1=O	1319303042	NRODFBSFWSEBJM-UHFFFAOYSA-N	449.511	1.032	50	20	IDGD	
O=C(NNc1cncc(Br)c1)c1cc(S(=O)(=O)N2CCSCC2)c[nH]1	1319647702	LESXHLBWXIGCOX-UHFFFAOYSA-N	446.352	1.667	50	20	IDGD	
CCn1nc(C)cc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](Cl)COC)C2	1777845982	OKWFNTFUDFQSTK-XAUMDUMWSA-N	426.945	1.593	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H]1CC(=O)N(C3CCCC3)C1)C2)[C@@H](F)Cl	1778021943	FCGCWMVOOZICMV-AUSMBZDKSA-N	443.947	1.826	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2)c1snnc1C1CC1	1778362753	GOLOYOBCJMTUJC-VEVIJQCQSA-N	428.942	1.143	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCBr)C2)c1ccnnc1O	1779965986	NTVNKLKJLQMSJN-CXAGYDPISA-N	427.299	1.095	50	20	IDGD	
Cc1c(C(=O)N2CC[C@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)cn2[nH]cnc(=O)c12	1780016678	MYLSTXZQIIVHQJ-FQEVSTJZSA-N	435.912	1.040	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](C)CNC(=O)OC(C)(C)C)CCO2	1781211279	OOLBDQWYKWVWEF-SIFCLUCFSA-N	431.961	1.995	50	20	IDGD	
O=C(c1cc(Cl)cnc1O)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781325234	FMIRKELBAAYPNP-NHYWBVRUSA-N	436.665	1.575	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)COc2ccccc2F)C1	1781908756	LOWQAIUEXRHBSQ-RRMPHLOHSA-N	442.915	1.972	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)Cn2ccnc2)C1	1782549987	ZXDOQGMFNHMIEE-AXVVYFOYSA-N	426.945	1.287	50	20	IDGD	
CC(C)N1CCC(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](C)Br)C3)C2)CC1	1783530139	SLWWXLIAIYQYTG-HNAYVOBHSA-N	430.387	1.720	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1CC[C@H]3CCC(=O)N3C1)CCO2	1783538070	SPMDRLBUHUTJTM-YGTYGHESSA-N	442.354	1.001	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)CCc3cccc(OC)n3)CCO2)C1	1783873499	PTLUFVHDDPLOIB-JXFKEZNVSA-N	425.913	1.107	50	20	IDGD	
COc1c(C)cc(C(=O)N2CCO[C@@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc1C	1783934412	GEXBYGFJZMIEBI-HSZRJFAPSA-N	446.548	1.129	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)c(F)c1F	1783938463	YVJSCTHHFHAWDG-OAQYLSRUSA-N	438.475	1.090	50	20	IDGD	
COc1ccc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]3C2)c(Cl)c1	1784086546	YBISHZZCDYAJAP-PLYYQAHHSA-N	445.343	1.471	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)Cc3ccc(OC)c(F)c3)C2)C1	1784703820	ASWQYSOVUDMPPB-FOIQADDNSA-N	428.888	1.461	50	20	IDGD	
COC(=O)c1ccc(OCC(=O)N2CC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)cc1	1785721855	CKVXUCDCHYGWNY-LJQANCHMSA-N	445.299	1.486	50	20	IDGD	
C[C@H](C(=O)Nc1ccc(C2(NC(=O)CCC(=O)NN(C)C)CCC2)cc1)n1ccnc1	1786234576	AEYIPLLZESMKGL-MRXNPFEDSA-N	426.521	1.951	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4[nH]ccc4n3)C[C@@H]21	1786406812	HAVLJQGDZRLNJA-DCGLDWPTSA-N	435.322	1.941	50	20	IDGD	
COC(=O)c1ccc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]3C2)cc1	1787448806	BYJAJMKGHIBXLL-OVWQWFNUSA-N	426.872	1.530	50	20	IDGD	
Cc1nn(C)cc1C(=O)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1	1788140261	MIILACPCTAMIJJ-UHFFFAOYSA-N	432.289	1.470	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)c1c[nH]c2cnccc12	1788455990	RMBYVEQYGGOSLM-NHJBHEPMSA-N	439.285	1.847	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccn(-c4ccccc4)n3)[C@H]2C1	1789349585	PRDALGSZSCNGTG-CAIZAGQASA-N	446.935	1.719	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4nc(CO)[nH]c4c3)C[C@@H]21	1789859796	ORGRFRMAWUTXJQ-AFIMGQEJSA-N	434.924	1.666	50	20	IDGD	
CC(C)Oc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](O)CCl)C[C@@H]32)c(F)c1	1790273801	BWJFCQVSNODXAX-IVJVFBROSA-N	442.915	1.806	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)N3C[C@H]4C[C@H]4C3)C[C@@H]21	1790961248	XOUHJYZOYQNHCO-LSLQXUBYSA-N	442.398	1.480	50	20	IDGD	
CC(=O)N[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]2C1)C(C)(C)C	1791055065	HXHDQBGEPDAJIT-AKSVOJBYSA-N	446.386	1.300	50	20	IDGD	
C[C@H](Nc1ccccn1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]2C1	1791056145	OYYPLKJTKFCLOB-YXMSTPNBSA-N	439.354	1.645	50	20	IDGD	
CCOC(=O)/C=C/C(=O)NC1(c2ccc(NC(=O)CCC(=O)NN(C)C)cc2)CCC1	1791599645	OVFFPJXRCKWOBP-OUKQBFOZSA-N	430.505	1.613	50	20	IDGD	
COc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCBr)C3)cc1F	1792675792	BEJDTIAQCPBKPT-FVCICTRLSA-N	429.286	1.823	50	20	IDGD	
Cc1cncc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)CBr)c1	1792870156	JJSCKDWDGKAKPE-RMRDIRSESA-N	438.366	1.943	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c(F)cncc1F)C2	1792872577	PGXUGSHFLWTANT-YYHMBLRTSA-N	432.265	1.594	50	20	IDGD	
CCOC(=O)C(C)(C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)CBr	1792872839	AGYKFOOSCQGDIJ-FQUUOJAGSA-N	433.343	1.196	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3ncccc3[nH]1)C2	1792873499	BIBPDRHEEJZPNF-JRATXPSKSA-N	435.322	1.797	50	20	IDGD	
COc1ccc2[nH]cc(/C=C/C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@H](O)CCl)c2c1	1792979702	BHHGAXHXOQPIRS-KWHUGRLPSA-N	447.919	1.379	50	20	IDGD	
CCCCCc1ncc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](O)CCl)s1	1792983471	IXVUMPVPTLXIOA-UMPJEAMMSA-N	429.970	1.679	50	20	IDGD	
O=C(Cc1cccc(Cl)n1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2	1794194607	USOOLJWCRUGFCE-DPIQGUFMSA-N	430.730	1.652	50	20	IDGD	
CC(C)(O)CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)C2	1795366614	RFRMXFBPUOVUBS-AHHPBITISA-N	433.455	1.622	50	20	IDGD	
O=C(Cc1noc2ccccc12)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1	1796191251	PQGHDNYIHGBEOS-BCDXTJNWSA-N	433.273	1.002	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(N2CCCC2)ccn1	1796583898	KPAMPVSUFMGZTD-HIRMHNASSA-N	436.940	1.139	50	20	IDGD	
Cc1ccc(C(=O)C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)cc1	1798443596	LWYIKLWDXFVFGL-BJWYYQGGSA-N	435.484	1.128	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnn(C)c1)C2	1799220002	DLXHDGURCCRNKG-MUJYYYPQSA-N	441.444	1.819	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cc3cccnn3n2)[C@@H]1c1cccnc1)[C@H](O)CCl	1803142182	XVMFPKCBLGLYTP-BMGDILEWSA-N	428.880	1.044	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc3ccnn3c2)[C@H]1c1cccnc1)[C@@H](O)CCl	1803148255	PRHJKFMFOSASQX-SNRMKQJTSA-N	427.892	1.649	50	20	IDGD	
Cc1cccc(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)n1	1805508381	VCIVTIOIYONZPZ-DENIHFKCSA-N	444.300	1.098	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)CCSC(=N)N)[C@@H]1c1cccnc1	1807127972	YFPZQVGPVISVKY-LNSITVRQSA-N	442.383	1.888	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc(F)cc2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807368116	YZNOODCCNHLLNV-UGKGYDQZSA-N	447.275	1.534	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@@H]1c1cccnc1	1808232219	LPIRRNSTKDAABI-IGQOVBAYSA-N	444.305	1.225	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@H]1CCN(C(=O)Cn2ccnn2)[C@@H]1c1cccnc1	1808302043	ASBRYSORSMINFA-KYJSFNMBSA-N	425.320	1.615	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC2(CCCN(C(=O)c3ccnc(Cl)c3)C2)CC1	1808361471	MKNPWRRBOTYCHP-UHFFFAOYSA-N	441.724	1.573	50	20	IDGD	
Cc1c(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)nc2ccccn12	1809078721	ZBPYIXGZUXUYBG-ABSDTBQOSA-N	441.919	1.957	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2cn3cccnc3n2)[C@H]1c1cccnc1	1809778823	BVEZRYBQZVUAJR-SOLBZPMBSA-N	442.907	1.698	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC2(CCCN(C(=O)c3n[nH]c4c3CS(=O)(=O)C4)C2)CC1	1810261408	VMKOKNVDPJQGKR-AWEZNQCLSA-N	442.969	1.700	50	20	IDGD	
C[C@H](Cn1cncn1)C(=O)NC[C@@H]1CCN(C(=O)CO[Si](C)(C)C)[C@H]1c1cccnc1	1810476042	BLFXWQBJTUXXLB-KPFFTGBYSA-N	444.612	1.867	50	20	IDGD	
CC(=O)N[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)[C@H](C)CBr)[C@@H]1c1cccnc1	1812645910	NOYGEKNUKJIZOD-UTJXIGIESA-N	439.354	1.643	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2ncn(C(C)C)n2)[C@H]1c1cccnc1	1813030700	LNGQERYJZGYKLI-IKGGRYGDSA-N	434.928	1.827	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)ccn1	1813073257	KJCZDLLBUHPVRR-KNQAVFIVSA-N	438.532	1.478	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)Cc3ccc(F)cc3)sc2C1	1813934797	UNTPXWMBDFSZNC-HNNXBMFYSA-N	447.536	1.810	50	20	IDGD	
O=C(/C=C/c1cccnc1)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1815959952	HGZHSCDTFDPPNS-OJWOGGGRSA-N	445.288	1.504	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCBr)CC2	1817017377	XGLNZVKNRRLFJX-IUCAKERBSA-N	432.344	1.287	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN(C)C)[nH]n1	1818111496	NWZUUUBNOBQMNW-OHHQFBAHSA-N	428.497	1.097	50	20	IDGD	
CC(=O)N1CCN(CC(=O)Nc2cc([C@@H]3CCCCN3C(=O)[C@@H](F)Cl)[nH]n2)CC1	1818965803	YGKDHVFIHYDKQD-WMLDXEAASA-N	428.896	1.100	50	20	IDGD	
CCNC(=O)N[C@@H](C)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CO[Si](C)(C)C)CC2	1819691255	XYPRPIVXPLPKOX-NWDGAFQWSA-N	441.630	1.614	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H]3CCC=CO3)sc2C1	1819733266	RAFKJGNGXMKTHW-ABAIWWIYSA-N	442.501	1.060	50	20	IDGD	
COc1cc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)ccn1	1819782809	LKMPPLWGUVWJEZ-GOSISDBHSA-N	449.276	1.113	50	20	IDGD	
CCOC(=O)N[C@H](O)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](C)Br)n[nH]1	1822188697	HVKKXDGMMWEVJB-DRCTWCGVSA-N	446.302	1.250	50	20	IDGD	
C[C@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1)n1ccnc1	1824313686	ZNZZNQJHQOEVOH-UTKZUKDTSA-N	438.337	1.057	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H]1[C@H]3SC=C[C@H]31)CC2	1826089710	MFOWWFOZIMMRKC-KRRMDGCSSA-N	435.575	1.303	50	20	IDGD	
Cc1ccc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)nc1C	1827050303	MADYXQIMCMIBFT-QHCPKHFHSA-N	449.360	1.925	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H](O)N2CCOCC2)CC1	1828965654	QOASDFSIMOARMP-QZTJIDSGSA-N	429.989	1.522	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cn3nnc4ccccc43)C2)C1	1830357993	JKLOHMSLSCSWLD-OAQYLSRUSA-N	449.939	1.153	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)cc(O)n1	1830358093	PLNUTHLZNNFXCF-HXUWFJFHSA-N	425.913	1.431	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccc(O)cn3)C2)C1	1831658953	KFGXSZUGZXXDII-PXNSSMCTSA-N	425.913	1.194	50	20	IDGD	
O=C(C[C@@H]1CCCCO1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1832346049	HXJHTNOINMRVQR-YSVLISHTSA-N	437.306	1.093	50	20	IDGD	
O=C([C@H](O)CCl)N1CCC([C@@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)CC1	1832896425	HVLZEPWUSPLLBK-UONOGXRCSA-N	448.010	1.066	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccn(CC)n3)CCO2)C1	1834408947	LULGHAZWUFGUDE-KDOFPFPSSA-N	443.342	1.147	50	20	IDGD	
C[C@@H](C(=O)N1CCC(N2CCC(NC(=O)CCBr)CC2)CC1)n1cccn1	1834423382	IWGBBDXYUIMDSU-HNNXBMFYSA-N	440.386	1.801	50	20	IDGD	
C=CC[C@@H](C(=C)C)C(=O)N1CCOC[C@]2(CN(C(=O)CCBr)CCO2)C1	1834823422	UDVJQBXJPTZCLP-LPHOPBHVSA-N	429.355	1.996	50	20	IDGD	
Cc1cccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)CCBr)C3)C2)c1	1835038369	DECOJXICWQNPGF-HXUWFJFHSA-N	439.350	1.779	50	20	IDGD	
C[C@@H](Nc1nccs1)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1835104937	ROMBVHWHLKOBBU-CJNGLKHVSA-N	444.001	1.115	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](OC)c1ccccc1)CCO2	1835285600	NUWWGHNNQDZAOA-WFXMLNOXSA-N	440.924	1.084	50	20	IDGD	
C=C[C@H](O)C(C)(C)C(=O)NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1	1835713651	KGTBFDOHGKCBEW-KRWDZBQOSA-N	444.414	1.916	50	20	IDGD	
CCc1cc(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](Cl)COC)CC3)CC2)no1	1835984037	HSURQXCFKUOUJE-KRWDZBQOSA-N	426.945	1.676	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cc(O)ncn3)CC2)CC1)[C@@H](F)Br	1836413775	PISKLWTWLLTBFB-OAHLLOKOSA-N	444.305	1.058	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C1(C(F)(F)F)CC1)CCO2	1836723487	OHKPETUSKLTMAN-WFASDCNBSA-N	428.835	1.039	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc4c(c3)CC(=O)N4)CCO2)C1	1836784151	HGIJNAZZUXTSPG-VGOFRKELSA-N	449.935	1.659	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc4c(c3)CC(=O)N4)CCO2)C1	1836789589	MEUYHOGOSZOSQX-HRAATJIYSA-N	435.908	1.269	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc4cccnc4n3)CCO2)C1	1836826860	RAJPELNOHXJQDK-QFIPXVFZSA-N	446.935	1.965	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)Cn3ccncc3=O)CC2)CC1	1836921930	CQXJLHSLDMUBBF-SFHVURJKSA-N	438.956	1.649	50	20	IDGD	
O=C(CCBr)N1CCC(OC2CCN(C(=O)CCn3cncn3)CC2)CC1	1837654581	DNKLVWACYXRQGM-UHFFFAOYSA-N	442.358	1.452	50	20	IDGD	
Cc1nnc(CC(=O)N2CCC(OC3CCN(C(=O)CO[Si](C)(C)C)CC3)CC2)o1	1837939997	MZXCUOHFTYJDRH-UHFFFAOYSA-N	438.601	1.771	50	20	IDGD	
CC(=O)NCCC(=O)N1CCC(OC2CCN(C(=O)[C@@](C)(Cl)CCl)CC2)CC1	1838638654	IQTVUSQWQVWBCW-IBGZPJMESA-N	436.380	1.748	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccncc3)CCO2)C1	1839057472	FDXUCAADJCPWQH-BEFAXECRSA-N	440.338	1.112	50	20	IDGD	
Cc1nn(C)c(C)c1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2	1839150347	JUVXLWQCUXDXIE-RTBURBONSA-N	447.363	1.343	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(O)n3)C2)C1	1839151343	OKZRZRNTNYWMEF-ZWKOTPCHSA-N	432.304	1.094	50	20	IDGD	
C=CCC(F)(F)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](F)Br)CCO2)C1	1839202672	MLSSTLQMCZDYRN-SMDDNHRTSA-N	429.233	1.345	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccs3)C2)C1	1839963195	CXTMGFIEPMKARF-GUYCJALGSA-N	431.352	1.992	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C=C/c3ccco3)C2)C1	1840031082	FKDROXHNDKJTTL-BYQXYHSISA-N	427.295	1.533	50	20	IDGD	
CCOC(CC(=O)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1)OCC	1840282262	JGUYTHPLAJYASW-QGZVFWFLSA-N	427.325	1.036	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)/C=C/c3cnc(C)s3)CCO2)C1	1840520272	XELFNZBQFRUHKZ-CHYGHELMSA-N	427.954	1.939	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)c(Cl)c1	1840734552	VFGOBSNZNPFPFH-MAUKXSAKSA-N	435.279	1.953	50	20	IDGD	
O=C(c1cc(Br)c(O)cc1F)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1	1841352478	RQZHKJLVCSUUAP-CYBMUJFWSA-N	435.677	1.711	50	20	IDGD	
O=C1CSc2ncc(C(=O)N3CC4(CCCN4C(=O)CCBr)C3)cc2N1	1842638621	ZXZINGIHILLFMF-UHFFFAOYSA-N	439.335	1.728	50	20	IDGD	
Cc1ccc2cc(C(=O)N3CC4(CCCN4C(=O)c4ccc(B(O)O)cc4)C3)ccc2n1	1843011391	YFEIBQISRYCYPD-UHFFFAOYSA-N	429.285	1.354	50	20	IDGD	
COc1cc(Cl)cc(C(=O)N2CC3(CCCN3C(=O)c3ccc(B(O)O)cc3)C2)c1	1843012561	AVEMOFSBCCNOEL-UHFFFAOYSA-N	428.681	1.159	50	20	IDGD	
O=C(c1ccc(C(F)(F)F)cc1)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843014488	PTZKKWYEPHMFIY-UHFFFAOYSA-N	432.207	1.516	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@]2(C(=O)N3CC4(CCCN4C(=O)[C@@H](F)Cl)C3)C[C@H]1CO2	1843365337	KEIGAFCQXUFNES-QUJCMNEKSA-N	431.892	1.503	50	20	IDGD	
Cc1cccc(C)c1SCC(=O)N1CCCC12CN(C(=O)c1ccc(B(O)O)cc1)C2	1844374497	JHDKATRTVQWVFL-UHFFFAOYSA-N	438.358	1.593	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)c1coc(C)n1)C2	1844692204	URTXPUAVGQHMEV-UHFFFAOYSA-N	428.401	1.947	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2c(F)ccc(Cl)c2F)C1	1846865974	TXGHVJDMRLMSNB-UHFFFAOYSA-N	449.845	1.748	50	20	IDGD	
C#CCNS(=O)(=O)c1ccc(C(=O)NNc2nc3ccccc3c(=O)n2CC)cc1	11165857	VLXXHWPWAXVKSK-UHFFFAOYSA-N	425.470	1.085	50	20	IDGD	
N#C/C(=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)OCC(=O)NC1CC1	11374911	HBXNRQNKJBZIBL-NTEUORMPSA-N	441.875	1.808	50	20	IDGD	
CCCC[C@H](NC1=NS(=O)(=O)c2ccccc21)C(=O)NNC(=O)c1ccccc1F	14290615	NZBIAXZGLPIZJA-INIZCTEOSA-N	432.477	1.884	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)COc1ccc([N+](=O)[O-])cc1	15314648	JGKOLTRYGIRITH-UHFFFAOYSA-N	427.461	1.333	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)cc(OC)c1OCC(N)=O	15758609	HYXPDRYLJQGVGZ-AWEZNQCLSA-N	445.472	1.413	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)CCN2C(=O)[C@@H](C)Oc3ccccc32)c2ccccc2c1=O	17190774	QSNONENFTVDXFC-CQSZACIVSA-N	449.467	1.382	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)CCNS(=O)(=O)c1ccc(F)cc1	21026875	OUWNQQPHDNIQEW-UHFFFAOYSA-N	429.857	1.617	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CCn2cnc3sc(C)c(C)c3c2=O)cc1OC	23401444	AVNSQASBWQJZQA-UHFFFAOYSA-N	430.486	1.943	50	20	IDGD	
CCOc1ccccc1N1C[C@@H](C(=O)NNC(=O)c2cc(Br)c[nH]2)CC1=O	24122374	UUKBHYHDRHPRHA-NSHDSACASA-N	435.278	1.990	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)CN3C(=O)COc4ccc([N+](=O)[O-])cc43)cc2C1	24310092	SIBNWZARZOGHGD-NSHDSACASA-N	444.469	1.968	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Cc2ccc3c(c2)OCCO3)c1	27205941	GBTWSGOWEJLECK-UHFFFAOYSA-N	447.513	1.492	50	20	IDGD	
CC(=O)c1cccc(O[C@H](C)C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1	109375349	QHSCFDPVUQXTFQ-CQSZACIVSA-N	433.486	1.368	50	20	IDGD	
C=CCNC(=S)NNC(=O)C1CCN(C(=O)c2ccc(Br)cc2)CC1	725908772	SORAKODPPZRNRF-UHFFFAOYSA-N	425.352	1.983	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCc2nc(C)c3ccccc3n2)c2ccccc2c1=O	726715851	UFCKRNPJLKYBRH-UHFFFAOYSA-N	431.456	1.812	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)c2ccc(C)c(S(=O)(=O)NCC#N)c2)cc1OC	726883850	MHJYCAHROFEZKF-UHFFFAOYSA-N	446.485	1.279	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)[C@@H]1CCCN1C(=O)OCC(F)(F)F	727786939	HOLHLJBCKNVLFI-LBPRGKRZSA-N	433.383	1.775	50	20	IDGD	
O=C(CCCc1ccccc1)NNC(=O)N1CCN(S(=O)(=O)Cc2ccccc2)CC1	727846182	LMEJZULUYUENLY-UHFFFAOYSA-N	444.557	1.898	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)OCC(=O)NNC(=O)[C@H]3COc4ccccc4O3)on2)cc1	728324191	REPBWENXMWNKCY-LJQANCHMSA-N	437.408	1.794	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)NCCCOC[C@H]2CCCO2)c1	728740799	HXSYDUHZNOVWFG-CYBMUJFWSA-N	430.299	1.987	50	20	IDGD	
CC[C@H](N=c1nn[nH]n1-c1ccccc1)C(=O)NNC(=O)[C@H](C)Oc1cccc(C)c1C	729282721	GSUCSPQJEXCKLW-WMZOPIPTSA-N	437.504	1.506	50	20	IDGD	
CC(C)NC(=O)CCCC(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	729284509	XBDXOXGFQMWDNS-UHFFFAOYSA-N	449.515	1.844	50	20	IDGD	
O=C(CN1C(=O)N[C@@]2(CCc3ccccc32)C1=O)NNC(=O)Cn1ccc2ccccc21	729450165	NYIRUVCLSOCCCB-HSZRJFAPSA-N	431.452	1.182	50	20	IDGD	
N#CCN1CCC(NC(=O)NNC(=O)[C@@H]2Cc3ccccc3CN2Cc2ccccc2)CC1	730674815	OWAGPTPLVKQVTN-QHCPKHFHSA-N	446.555	1.932	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)CCn3ccnn3)c2)c(C)c1	732049664	YJOPUVOWGQHFEZ-UHFFFAOYSA-N	442.501	1.547	50	20	IDGD	
COc1ncnc(OC)c1C(=O)NNC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1	732053702	JMMPEAILJIDFOD-UHFFFAOYSA-N	445.439	1.816	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)NCCNC(=O)c2ccc(C)cc2)cc1	732468521	UTQGKKDVACGEHS-MRXNPFEDSA-N	428.489	1.921	50	20	IDGD	
CCOc1ncc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1Cl	732851692	ORCWNHWZEFRHAM-HNNXBMFYSA-N	435.820	1.278	50	20	IDGD	
CCc1cc(N2CCC[C@@H](NC(=O)NNC(=O)c3nnc(O)c4ccccc34)C2)ncn1	732913619	BSHGVEFQGJDGFY-CQSZACIVSA-N	436.476	1.301	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)C[C@@H]2Oc3ccccc3NC2=O)CC1	734825521	IWQNLLVSVWRKJE-INIZCTEOSA-N	447.492	1.506	50	20	IDGD	
Cc1ccccc1[C@H](C)CC(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	735117983	LONCHGXDLHKPDI-QGZVFWFLSA-N	431.562	1.963	50	20	IDGD	
O=C(CC1CCOCC1)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	735269008	BOFPHYNPJQSQNU-UHFFFAOYSA-N	431.514	1.743	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)CCc2c(C)nc3ncnn3c2C)cc1C	736744059	JKHVISOXDVHUAJ-UHFFFAOYSA-N	444.517	1.610	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)[C@H]1CS[C@]2(c3ccc(F)cc3)CCC(=O)N12	740852377	XYLXHHSPAQMDLT-QRWLVFNGSA-N	436.509	1.169	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)c2ccc(C[C@H]3CC(=O)NC3=O)cc2)cc1OC	741144667	YVZRMSLHOGQPGY-KRWDZBQOSA-N	439.468	1.764	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)[C@H]2CCCCN2C(=O)c2ccc(O)nn2)c1C	741740642	CTEWGEJNEWTIJV-NVXWUHKLSA-N	441.488	1.409	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)CNC(=O)c1ccco1)Oc1cccc(Br)c1	743577896	UBZTXXQXQGEURR-LLVKDONJSA-N	439.266	1.570	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2cnc(-c3ccccc3)nc2)ccc1Cl	743845256	DDOACDICKKQDDY-UHFFFAOYSA-N	431.861	1.519	50	20	IDGD	
Cc1nc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)no1	745855251	UEBBPPSFWRJETJ-UHFFFAOYSA-N	444.473	1.001	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2c(C)nn(CCCl)c2C)cc1	746094292	WMCBMZQFHBVXFQ-UHFFFAOYSA-N	441.941	1.129	50	20	IDGD	
CC(C)[C@@H](NS(=O)(=O)c1ccc2ccccc2c1)C(=O)NNc1nccn(C)c1=O	747938099	POJRBQOTVASIPJ-QGZVFWFLSA-N	429.502	1.380	50	20	IDGD	
CN1CCC[C@H](NC(=O)NNC(=O)[C@H]2Cc3ccccc3CN2Cc2ccccc2)C1=O	748664609	LRVANZWEAVQWOB-LEWJYISDSA-N	435.528	1.565	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)N[C@H]1CCN(CCCc2ccccc2)C1=O	750292988	VRARDZZSPZCJOG-PXNSSMCTSA-N	438.484	1.391	50	20	IDGD	
O=C(CCN1CCOCC1)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	750865881	NHWALOYRSFYXHC-UHFFFAOYSA-N	438.531	1.032	50	20	IDGD	
CCC(=O)NCc1cc(S(=O)(=O)NNC(=O)c2c[nH]c3ccccc23)ccc1OC	751538418	JIKVPUGXNSCNBA-UHFFFAOYSA-N	430.486	1.826	50	20	IDGD	
Cc1nnnn1[C@@H](Cc1ccc(F)cc1)C(=O)NNC(=S)NCCc1cccs1	753078840	QSQHYDYVYITYPU-INIZCTEOSA-N	433.538	1.704	50	20	IDGD	
COc1cccc(-c2noc([C@@H](C)NCC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)n2)c1	755052292	CEPJDWKVJKCNFZ-GFCCVEGCSA-N	440.416	1.765	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)Nc1ccc(NC(=O)c2ccco2)cc1	755599743	PCZNEEKOQRSCJK-UHFFFAOYSA-N	432.400	1.974	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)Nc1cccc(N2CCCS2(=O)=O)c1	755887295	BSNURWUJCKGKNN-CYBMUJFWSA-N	436.465	1.986	50	20	IDGD	
COc1ccc(C(=O)N(C)C)cc1NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	756122289	MADBYLQRXWVKEC-UHFFFAOYSA-N	438.444	1.110	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)Nc1cccc(N2CCS(=O)(=O)CC2)c1	756204432	AVVJTQHRHZMKBE-UHFFFAOYSA-N	446.485	1.159	50	20	IDGD	
C[C@@]1(c2cccc(C(=O)OCC(=O)NNC(=O)c3ccc(Cl)cc3)c2)NC(=O)NC1=O	756222201	AOFYDYOREMZXHD-FQEVSTJZSA-N	444.831	1.013	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)Nc1cccc(CS(=O)(=O)c2ccccc2)c1	756533386	DIGCRCXNNCGFDA-HNNXBMFYSA-N	435.502	1.865	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2ccc3c(c2)OCO3)cc1S(=O)(=O)NC1CC1	756682095	MPCAADUGTQLWJQ-UHFFFAOYSA-N	448.457	1.331	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)c2cnc3c(c2)c(O)nc(=O)n3C2CC2)c(OC)c1	757186788	DXGMLUKIVCMLFI-UHFFFAOYSA-N	425.401	1.384	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)Nc1cnn(-c2ccccc2Br)c1	757775164	GIOWJGVFCRIAKR-NSHDSACASA-N	426.271	1.839	50	20	IDGD	
Cc1c(C(=O)NNC(=O)Cc2nc3ccccc3n2C)cnn1CCO[C@@H]1CCCCO1	758078149	IQVOTPVPCZPDGX-OAQYLSRUSA-N	440.504	1.625	50	20	IDGD	
O=C(NNc1nc(O)c2ccccc2n1)[C@@H]1CN(Cc2nc(O)c3ccccc3n2)CCO1	758296275	WYUMXBKNMCLOTN-KRWDZBQOSA-N	447.455	1.328	50	20	IDGD	
CN(Cc1cc(Br)cn1C)C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	758833056	DKJXULVPQPKWFU-UHFFFAOYSA-N	433.270	1.250	50	20	IDGD	
CCS(=O)(=O)c1cccc(S(=O)(=O)NNC(=O)c2cccc(OC(F)F)c2)c1	760362954	MTMOTUHVOSJCPL-UHFFFAOYSA-N	434.442	1.705	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2c(C)nn(CC(F)F)c2C)cc1	760618576	FCEBSGUARKHCJN-UHFFFAOYSA-N	443.476	1.155	50	20	IDGD	
COC(=O)c1cn([C@@H]2CCN(C(=O)NNC(=O)c3ccc(Br)s3)C2)nn1	760654175	ASMAZFONHDOWPJ-MRVPVSSYSA-N	443.283	1.190	50	20	IDGD	
C[C@@H](NC(=O)OC(C)(C)C)[C@@H]1CN(C(=O)NNC(=O)COCc2ccccc2)CCO1	760775446	GGOHTPYAMQDWMO-WBVHZDCISA-N	436.509	1.558	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2cnc(-c3cccnc3)s2)ccc1Cl	761205692	PTBGAFZNYKLNJX-UHFFFAOYSA-N	437.890	1.581	50	20	IDGD	
O=C(NC[C@@H]1CCCO1)Nc1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2)cc1	763424578	BXXIXIPDMUYABN-KRWDZBQOSA-N	425.445	1.387	50	20	IDGD	
CCOc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NNC(=O)c1ccc2ccccc2n1	763450568	MVQMCVDGRDDYLK-UHFFFAOYSA-N	449.467	1.735	50	20	IDGD	
CC(C)S(=O)(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)c2c[nH]c3ccccc23)c1	763541633	ZXGWIROYUFKCRF-UHFFFAOYSA-N	442.497	1.891	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)N1CCc2ccc(Br)cc21	763571376	IKTHNVMMYWOTKQ-MRXNPFEDSA-N	446.257	1.326	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)Nc1ccc(OC2CCCC2)nc1	763572998	PGSXGYUDXWSVBD-KRWDZBQOSA-N	426.429	1.329	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)N1CCc2ccc(Br)cc21	763647220	PBRWLQOMVSMKMP-UHFFFAOYSA-N	448.273	1.573	50	20	IDGD	
COC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)COc2cc(C)ccc2C)cc1F	763665625	ZXYVZXXPYMEXKB-UHFFFAOYSA-N	432.408	1.786	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccccc2O[C@H]2CCOC2)cc1C	763667009	OCGULLPTNGPKDA-KRWDZBQOSA-N	427.457	1.636	50	20	IDGD	
CCNC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)COc2ccccc2CC)c1	763716231	DTDLSTSINOUPJB-UHFFFAOYSA-N	427.461	1.555	50	20	IDGD	
CSc1cnn(-c2ccccc2)c1NC(=O)C(=O)NNC(=O)C1=S=C2CCCC2=C1	763783511	PQJKFGQCWFEYNN-UHFFFAOYSA-N	441.538	1.882	50	20	IDGD	
Cc1ccc(Br)cc1NC(=O)C(=O)NNC(=O)c1nnc(O)c2ccccc12	763790748	NYIZGGYYSIQRFX-UHFFFAOYSA-N	444.245	1.806	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)OC)c(C(=O)OC)c2)cc1	763831309	IHFMEKBTZXIVDL-UHFFFAOYSA-N	427.413	1.222	50	20	IDGD	
C[C@H]1CN(c2ccccc2NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)C[C@H](C)O1	763840341	SSMVMKDDMXWKKV-GJZGRUSLSA-N	444.463	1.604	50	20	IDGD	
Cc1ccc(C(N)=O)cc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccc2ccccc2c1	763850918	BRNGMUADYCGUAS-CQSZACIVSA-N	434.452	1.801	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)C(=O)Nc1cccc(-n2cnnn2)c1	763855272	VHYLMSXVAPBTOC-CQSZACIVSA-N	445.439	1.369	50	20	IDGD	
COCCn1ncc2ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc3ccccc3F)cc21	763865820	QRYFSAMFQRNPEY-ZDUSSCGKSA-N	443.435	1.375	50	20	IDGD	
C[C@@H](c1ccc(NC(=O)C(=O)NNC(=O)Cc2c[nH]c3ccccc23)cc1)N1CCOCC1	763865992	YZZOEEXDRDQOEA-INIZCTEOSA-N	449.511	1.890	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(C)c(NC(C)=O)c2)cc1	763867471	VGAYRPKKNAYABL-AWEZNQCLSA-N	442.472	1.906	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cc(C)nn2-c2ccccc2)cc1	763875746	AAJWHONWXPLHFT-MRXNPFEDSA-N	449.467	1.937	50	20	IDGD	
CN1CC(=O)N(c2cccc(NC(=O)NNC(=O)CSc3ccccc3O)c2)C1=O	763926395	FPBXXINZQLAYPR-UHFFFAOYSA-N	429.458	1.736	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)C(=O)Nc1cc(C(=O)N2CCCCC2)ccc1Cl	763992831	JLEJCPTYMNKURP-UHFFFAOYSA-N	431.880	1.704	50	20	IDGD	
CCOC(=O)/C=C/c1ccc(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)cc1	763996928	HBWDPWMZNUKNGT-VMPITWQZSA-N	449.261	1.753	50	20	IDGD	
CNC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)on2)ccc1Cl	764017158	SJMHIYMYSWRNJH-UHFFFAOYSA-N	441.831	1.754	50	20	IDGD	
CCS(=O)(=O)c1cccc(CC(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)c1	764058172	CWCFWOBLXBHQNS-UHFFFAOYSA-N	437.543	1.607	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(NC(=O)OC(C)(C)C)nc2)c(O)c1	764109311	KDKDGKLPHYXALA-UHFFFAOYSA-N	429.433	1.842	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccnc(OCC(F)(F)F)c2)c1O	764132291	TZTPJFISVCNZMI-UHFFFAOYSA-N	428.323	1.137	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(OC3CCOCC3)c(C)c2)c1O	764132730	QEOQHQFSUXFFNK-UHFFFAOYSA-N	443.456	1.667	50	20	IDGD	
CC(C)N1CCN(c2cccc(NC(=O)C(=O)NNC(=O)c3ccc(C#N)cc3)c2)CC1	764176736	GVKAZEFVFCTDRV-UHFFFAOYSA-N	434.500	1.488	50	20	IDGD	
CCC(C)(C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)Cc2ccccn2)cc1Cl	764264232	OITDYERPKLDIPX-UHFFFAOYSA-N	445.907	1.982	50	20	IDGD	
CCOC(=O)/C=C/c1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2O)cc1	764275756	TWWAVUUUTRHVNR-FMIVXFBMSA-N	427.413	1.133	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)CCc2ccccc2O)sc(C)c1C	764280524	BYZCTPHDCMOBLI-UHFFFAOYSA-N	433.486	1.966	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)CN(C(=O)OC(C)(C)C)CC2	764295130	JQEUTAWBIQAISQ-UHFFFAOYSA-N	442.476	1.411	50	20	IDGD	
CN(C)C(=O)COc1cccc(NC(=O)C(=O)NNC(=O)C(C)(C)c2ccccc2)c1	764302043	IGECDWGANQEREJ-UHFFFAOYSA-N	426.473	1.217	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(NC(C)=O)cc2)cc1Br	764325978	CSAQJEREWBIJOS-UHFFFAOYSA-N	449.261	1.816	50	20	IDGD	
COc1ccc(NC(C)=O)cc1NC(=O)C(=O)NNC(=O)c1cnn(-c2ccccc2)c1	764346329	WSHGAPZRTNYRBR-UHFFFAOYSA-N	436.428	1.239	50	20	IDGD	
CC(=NNC(=O)Cn1nnc(-c2ccccc2)n1)c1ccc(Cl)c(S(N)(=O)=O)c1	764654853	QJEVZKLZUMIOKL-UHFFFAOYSA-N	433.881	1.181	50	20	IDGD	
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1	765243493	KYZBQBCETZPWTP-PXNSSMCTSA-N	437.548	1.544	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)cc(OC)c1OCC(N)=O	765565371	PVRMCXUUQXGMLY-UHFFFAOYSA-N	445.457	1.094	50	20	IDGD	
Cc1cc(Cl)ccc1OCC(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765736770	AORXZWRINFWZNV-UHFFFAOYSA-N	444.919	1.633	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NCc2cccc(N3CCCS3(=O)=O)c2)cc1	765893108	OQNRGXYIOABJHH-UHFFFAOYSA-N	432.502	1.444	50	20	IDGD	
CCN1CCN(c2ccc(Cl)cc2NC(=O)C(=O)NNc2nccnc2OC)CC1	766265008	VBFJMVYRHYYARF-UHFFFAOYSA-N	433.900	1.362	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)CN1CCN(c2oc(-c3ccco3)nc2C#N)CC1	766848980	OXHUHJQUIMNGJW-UHFFFAOYSA-N	448.483	1.627	50	20	IDGD	
O=C(CCCc1cccs1)NNC(=O)C(=O)Nc1cc(C2CC2)nn1-c1ncccn1	768242587	UPMYPKHNIWLGKH-UHFFFAOYSA-N	439.501	1.710	50	20	IDGD	
CNS(=O)(=O)c1cccc(CNC(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)c1	770168361	OQLPDDDUEMYWMI-GFCCVEGCSA-N	440.909	1.546	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)N[C@@H]3CCN(c4ccc(C(F)(F)F)cc4)C3)nc21	770394591	CYLHLGBJIWVJRN-LLVKDONJSA-N	436.398	1.993	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)[C@H]1CC(=O)N(c2c(F)cccc2F)C1	770758465	VGQASBONEPXDMZ-NSHDSACASA-N	441.435	1.173	50	20	IDGD	
Cc1nc2cc(O)nn2c(C)c1CCC(=O)NNc1nc(O)c2cnn(C(C)(C)C)c2n1	770965315	IVTVYWDATYIQQV-UHFFFAOYSA-N	439.480	1.728	50	20	IDGD	
CCC(CC)n1ccc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)n1	771043879	CRBIGXBKGZSRTL-UHFFFAOYSA-N	426.521	1.463	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)cc1	771045047	LAKNGNRAMVFESV-LBPRGKRZSA-N	433.515	1.575	50	20	IDGD	
C[C@@H]1C[C@H](CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)CCO1	771424816	AQCZSKOGMNXYTA-HZPDHXFCSA-N	438.550	1.620	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)C1(S(=O)(=O)c2ccc(Cl)cc2)CC1	771970347	XZMBTUBCOHKNRH-GFCCVEGCSA-N	430.910	1.772	50	20	IDGD	
Cc1occc1C(=O)Nc1nc(CC(=O)O[C@@H](C)C(=O)NNC(=O)CC(C)C)cs1	772257020	KEPXCZUGYXCSCO-LBPRGKRZSA-N	436.490	1.965	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCC2CCN(c3ccncc3)CC2)c2ccccc2c1=O	772610734	CZHWIFIEUKJVGV-UHFFFAOYSA-N	449.515	1.672	50	20	IDGD	
Cc1nn(CCC#N)c(C)c1CCC(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772906731	UYWONZBFJDTSCQ-UHFFFAOYSA-N	430.896	1.463	50	20	IDGD	
O=C1CN(c2ccc(NC(=O)C(=O)NNc3ccc4ccccc4n3)cc2Cl)CCN1	773661075	DRBJJMZGCLLQDY-UHFFFAOYSA-N	438.875	1.906	50	20	IDGD	
CC[C@@H](C)NS(=O)(=O)Cc1cccc(NC(=O)C(=O)NNc2ccc(C#N)cc2)c1	773701432	RTVGHTQTFKXSQG-CQSZACIVSA-N	429.502	1.858	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1cccnc1OCC(F)F	774010268	XKTTUDPWCVPQBB-JTQLQIEISA-N	442.806	1.932	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(N2C[C@@H](C(=O)NCCCSC#N)CC2=O)cc1	774298593	SEGGBPOXLVTKIO-HNNXBMFYSA-N	438.575	1.791	50	20	IDGD	
Cc1cc(C(=O)N2CCN(S(=O)(=O)CBr)CC2)ccc1-n1cncn1	777837579	OGXUKGAQVOHYRG-UHFFFAOYSA-N	428.312	1.016	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)[C@@H](Cc2ccc(F)cc2)n2nnnc2C)nc1C	778424077	LTCWOTMTRCDJCC-MRXNPFEDSA-N	428.428	1.323	50	20	IDGD	
CCO[C@H]1C[C@](NC(=O)OC(C)(C)C)(C(=O)NNc2nc(O)c3cnn(C)c3n2)C1(C)C	780701239	UMKJVIQCGSBARQ-YUNKPMOVSA-N	449.512	1.611	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)c2ccc(OC)c(-n3cnnn3)c2)cc1	781560004	NKKQPXODINGEJV-ZDUSSCGKSA-N	426.433	1.298	50	20	IDGD	
CCc1cccc(CC)c1NC(=O)C(=O)NNC(=O)c1sc(N2CCOCC2)nc1C	782897252	MRJMOJIFZOHPPU-UHFFFAOYSA-N	445.545	1.813	50	20	IDGD	
CN(C)C(=O)COc1cccc(NC(=O)C(=O)NNc2ncccc2C(F)(F)F)c1	783120784	QGFVVMIFNWNVKA-UHFFFAOYSA-N	425.367	1.649	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2cccc(CSC3CCCC3)c2)CCS(=O)(=O)C1	783428878	YHARLQFUJSGIKQ-IBGZPJMESA-N	425.576	1.999	50	20	IDGD	
CCOC(=O)[C@H](C)NC(=O)c1ccc(NC(=O)C(=O)NN(C)c2ccccc2)cc1F	783434380	KFNGAJDEBWOAQP-ZDUSSCGKSA-N	430.436	1.613	50	20	IDGD	
Cc1cc(Br)ccc1NNC(=O)C(=O)Nc1ccc(-n2ncn(C)c2=O)cc1	784415530	XIHSMZAPPQKVHP-UHFFFAOYSA-N	445.277	1.724	50	20	IDGD	
Cc1ccc(C(=O)N2CCSCC2)cc1NC(=O)C(=O)NNc1ccc(Cl)nn1	784790106	VBLXNKQBEKDGJZ-UHFFFAOYSA-N	434.909	1.709	50	20	IDGD	
O=C(NNc1ccc(Cl)nn1)C(=O)Nc1cccc(F)c1I	784792217	IZWNDZBCMYWVQY-UHFFFAOYSA-N	435.584	1.956	50	20	IDGD	
CCCN1C(=O)CCc2cc(NC(=O)C(=O)NNc3cccc(S(C)(=O)=O)c3)ccc21	784839014	FBJDDHGHJNKSPL-UHFFFAOYSA-N	444.513	1.861	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNc3ccc(C(F)(F)F)nn3)cn2)C[C@@H](C)O1	784891431	OYVAFFFBQZFUDG-PHIMTYICSA-N	439.398	1.586	50	20	IDGD	
Cc1nc2cc(C(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)ccc2n1Cc1ccsc1	788427229	FHIIGKSSULRJFK-HNNXBMFYSA-N	432.527	1.650	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc2c(c1)COC2)NNc1nnc(-c2ccccn2)s1	788567045	AOUYWIOITVDCRC-UHFFFAOYSA-N	432.487	1.052	50	20	IDGD	
COc1ccc(S(=O)(=O)NC(C)(C)C)cc1NC(=O)NNc1cc(Cl)nc(N)n1	789104109	AHKBFYKVACPGPD-UHFFFAOYSA-N	443.917	1.946	50	20	IDGD	
COc1cc(Cl)c(S(=O)(=O)NNC(=O)CNC(=O)c2cccs2)cc1OC	790338648	GOZKYVVICVNFGY-UHFFFAOYSA-N	433.895	1.158	50	20	IDGD	
O=C(Cc1ccc(S(=O)(=O)N2CCOCC2)s1)NNc1cccc(F)c1[N+](=O)[O-]	791148458	ZWOCYJHZAKJPTC-UHFFFAOYSA-N	444.466	1.502	50	20	IDGD	
CCS(=O)(=O)c1ccc([C@@H](C)NCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1	792949587	OUVAIGPJLVJRAQ-CYBMUJFWSA-N	434.474	1.500	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)[C@H]2COCCN2C2CCCC2)CC1	793517723	KXDRQLOZSDJSHI-QGZVFWFLSA-N	439.557	1.360	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)[C@H](c2cnn(C)c2)N(C)C(=O)OC(C)(C)C)c1	794768699	XQHQBRZRUOAPIU-KRWDZBQOSA-N	447.492	1.807	50	20	IDGD	
COCCNC(=O)c1cccc(S(=O)(=O)NNC(=O)CCCc2cccs2)c1	795316277	LHBICLJMPRTOGY-UHFFFAOYSA-N	425.532	1.457	50	20	IDGD	
O=C(CN[C@H](CO)c1ccccc1OC(F)(F)F)NNC(=O)c1cccc([N+](=O)[O-])c1	796526245	SEQWCHNQRGWNFE-CQSZACIVSA-N	442.350	1.578	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)CNC(=O)OCc2ccccc2)cnn1C1CCCC1	797368531	CUFGARFJVVGXJL-UHFFFAOYSA-N	442.476	1.319	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)NCC(C)C)c(Cl)c2)n1	797369808	LCQAFYZJKXCWIE-UHFFFAOYSA-N	431.880	1.829	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNS(=O)(=O)c1cc(Cl)cc(C(N)=O)c1	799120609	PZOQFHZVHKTTOH-UHFFFAOYSA-N	427.866	1.226	50	20	IDGD	
CSC[C@H](C)C(=O)N1CCC(C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)CC1	799298043	SVZVZTVYZQKPKK-KBPBESRZSA-N	425.526	1.978	50	20	IDGD	
NC(=O)[C@@H]1CC(C(=O)NNc2cc([N+](=O)[O-])ccc2Br)=NN1c1ccccc1	800618201	KMUHOYIHLNENDR-HNNXBMFYSA-N	447.249	1.921	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)CNC(=O)NCc2ccco2)c(OC)cc1Cl	802082620	WJHMZEUPXFRFGO-UHFFFAOYSA-N	425.829	1.602	50	20	IDGD	
CN(C(=O)OC(C)(C)C)[C@@H](C(=O)NNc1cccc(S(C)(=O)=O)c1)c1cnn(C)c1	803038429	SFMUDKIMOXGBOP-MRXNPFEDSA-N	437.522	1.875	50	20	IDGD	
O=C(NNc1cccc(F)n1)C(=O)N1C[C@H](C(=O)N2CCCCC2)Oc2ccccc21	807390778	OPSDKIJDLSWQGQ-MRXNPFEDSA-N	427.436	1.471	50	20	IDGD	
CC[C@H](C)NS(=O)(=O)c1cccc(NC(=O)C(=O)NNc2nccnc2C2CCC2)c1	807460426	PBRFIHMKTTXGOI-ZDUSSCGKSA-N	446.533	1.903	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccn3ccnc3c2)c1	810230367	UVTBOMAPYPEEND-UHFFFAOYSA-N	430.490	1.831	50	20	IDGD	
CC1(C)CCCc2sc(NC(=O)C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)nc21	810386003	IPWRHWANXLLBNL-UHFFFAOYSA-N	440.489	1.132	50	20	IDGD	
CC1(C)COc2ccc(C(=O)OCC(=O)NNC(=O)[C@H]3COc4ccccc4O3)cc21	811336148	GZPNBRGODOJORJ-GOSISDBHSA-N	426.425	1.501	50	20	IDGD	
CCOC(=O)c1ccc(NNC(=O)[C@@H](C)NS(=O)(=O)c2c(C)nn(C)c2C)cc1C	812724157	VCOSQJMDINFUJX-CYBMUJFWSA-N	437.522	1.332	50	20	IDGD	
COc1ccc([C@H](O)C2CCN(CC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)CC2)cc1	812857174	IBPKKXODLDWOKS-NRFANRHFSA-N	442.472	1.810	50	20	IDGD	
COC(=O)Nc1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)cc1	813033812	MMLRZUMGKUFHGE-UHFFFAOYSA-N	435.462	1.197	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)c1c(I)cnn1C	814101048	HJSNMJCEWLFKGE-MRVPVSSYSA-N	432.193	1.392	50	20	IDGD	
CCCCCn1nc(C)cc1NC(=O)C(=O)NNc1ccccc1S(=O)(=O)N(C)C	815751636	HWSAJWNYDBVUTJ-UHFFFAOYSA-N	436.538	1.714	50	20	IDGD	
CCOc1ccc(NNC(=O)C(=O)Nc2ccc(CC(=O)N3CCN(C)CC3)cc2)cc1	815816414	VHYBMSGGMAHFMQ-UHFFFAOYSA-N	439.516	1.484	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)C(=O)Nc2cn(C)nc2C2CC2)c1	815866368	YIFPPEWVMIXHMI-UHFFFAOYSA-N	436.266	1.928	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)N2CCC3(CC2)NC(=O)NC3=O)c(C)n1C[C@H]1CCCO1	904158831	ANFNCASSMNQDFF-UWKDKTGGSA-N	425.489	1.392	50	20	IDGD	
CCCCn1c(C)cc(/C=C(/C#N)C(=O)N(CC)CC(=O)N[C@H]2CCS(=O)(=O)C2)c1C	912663450	FHRMXEHTOWMOBV-CBXNMNPBSA-N	448.589	1.964	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)O[C@H](C)C(=O)N2CCC[C@H](C(N)=O)C2)c1C	913027172	JVAYMONHKFTAOU-HUVWLSNQSA-N	430.505	1.314	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)N2CCN(S(=O)(=O)N(C)C)CC2)c(C)n1C[C@H]1CCCO1	914504007	IMKXNBOMDQYZEW-QRRJMBGHSA-N	449.577	1.142	50	20	IDGD	
CCOc1ccccc1OCC(=O)NN=C1CCN(S(=O)(=O)c2c(C)n[nH]c2C)CC1	914559274	GSERJXBIXYBDIY-UHFFFAOYSA-N	449.533	1.761	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)[C@H](Cc2cccc(F)c2)n2nnnc2C)c1	915695238	FIHJJLHXXLKWOU-SFHVURJKSA-N	426.452	1.748	50	20	IDGD	
Cc1nnnn1[C@@H](Cc1ccc(F)cc1)C(=O)NNC(=O)c1ccc2c(c1)OCCO2	915696363	ZSIJUFBBLKJJML-INIZCTEOSA-N	426.408	1.137	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NC[C@@H]2CN(Cc3ccccc3)CCO2)cc1	915894071	HBXBYUUQYCRHJH-HXUWFJFHSA-N	428.489	1.305	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)CN(C)C(=O)c2ccc(Br)o2)cc1	917393540	QMTZJQKEWCJTQF-UHFFFAOYSA-N	439.266	1.382	50	20	IDGD	
CCOc1ccc(C(=O)NNS(=O)(=O)c2ccc3c(c2)CCCC(=O)N3)cc1OC	917727100	BPDPQTNIHAYRGS-UHFFFAOYSA-N	433.486	1.992	50	20	IDGD	
Cc1nccc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)n1	918106880	WMJZXAFXVJLSNK-UHFFFAOYSA-N	432.506	1.104	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1cc(-c2ccccc2)nn1-c1ccccc1	920298058	IOJHYRBLYJUSPF-AWEZNQCLSA-N	427.486	1.238	50	20	IDGD	
Cc1ccc(C)c(S(=O)(=O)NCC(=O)NNC(=O)c2ccc(Br)cc2)c1	1115819697	QYMFRILGZCZXHY-UHFFFAOYSA-N	440.319	1.805	50	20	IDGD	
CCOCCCN1CC[C@H](NC(=O)NNC(=O)c2cncn2-c2ccccc2)[C@@H](C)C1	1116080425	ITUAMFDOCACGNP-HKUYNNGSSA-N	428.537	1.953	50	20	IDGD	
Cn1c(C(=O)O)cc(Br)c1C=NNC(=O)c1nn(C)c(=O)c2ccccc12	1251898811	HNDHOJFRBRZWEY-UHFFFAOYSA-N	432.234	1.497	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCC2CCN(S(=O)(=O)C(F)(F)F)CC2)cc1	1318470196	WTSZNLVAHITMNT-UHFFFAOYSA-N	438.428	1.201	50	20	IDGD	
CC(C)(C=NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1)S(C)(=O)=O	1324433665	QCXFTIBKWRPEFL-UHFFFAOYSA-N	426.502	1.927	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H]1ON=C(c3ccccc3)O1)C2)[C@@H](F)Cl	1778029548	CCLOAIXPHCWLMC-XWYPRVOQSA-N	439.871	1.769	50	20	IDGD	
C/C=C(/C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C1	1778092564	IQDPFMHJZPBRSP-IXIAIYGASA-N	429.521	1.601	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)ncc1[N+](=O)[O-]	1779295227	AZILODVUFZZZLI-LJQANCHMSA-N	436.541	1.593	50	20	IDGD	
C[Si](C)(C)c1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](O)CCl)C3)co1	1779347761	HFYDHEKALNNEAJ-JXXFODFXSA-N	443.016	1.552	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)nc(O)c1)C2	1779543924	UEMXPUVXRCUWNI-FOIQADDNSA-N	437.569	1.472	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(-c4ccccc4)[nH]n3)C2)C1	1780291452	ZVFQATHHIRWBDQ-IERDGZPVSA-N	432.908	1.774	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)c3cnn4cccnc34)CCO2)C1	1781230274	OYXVKGNDMNMNOT-QZTJIDSGSA-N	426.304	1.409	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnn3c2CCC3)C1	1781286348	XACREMSEUUKCIR-URKNILKWSA-N	439.354	1.740	50	20	IDGD	
Cc1cc(CCC(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)ccn1	1781325622	GJIIWPBNKOTTMO-AEFFLSMTSA-N	428.302	1.843	50	20	IDGD	
CN(C)c1cccc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](F)Br)C3)C2)c1	1781334166	MNXZIMDRNSZNDX-MAUKXSAKSA-N	428.302	1.887	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1c(F)cncc1F)C2	1782173457	CBOMMVDDLHJQBA-IOHHAYIISA-N	431.867	1.741	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccn3ccnc3c1)C2	1782175416	LPLLDOXOKNXWEK-CSODHUTKSA-N	434.924	1.716	50	20	IDGD	
COC(=O)c1ccc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)C(Cl)Cl)C2)cn1	1782217627	QUKJKQNAOJHQDG-AUUYWEPGSA-N	444.315	1.799	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)n2cncn2)C1	1782532932	DEHTVALJTUBCEO-OIPACUDHSA-N	442.358	1.527	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)CCc3ccc(O)nn3)CCO2)C1	1783355831	YDYMTQYQLBDOSS-KDOFPFPSSA-N	441.326	1.118	50	20	IDGD	
Cc1cc2cccc(C(=O)N3CCO[C@@]4(CCN(C(=O)CCC(=O)NN(C)C)C4)C3)c2[nH]1	1783935716	YGSRIEMIXZFOLX-HSZRJFAPSA-N	441.532	1.293	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc4ccccn34)C[C@@H]21	1783967795	WZASVJDGIYLJJD-JKQORVJESA-N	449.349	1.959	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cn4[nH]cnc(=O)c4c3C)C[C@@H]21	1784621080	YIXNEKJAIPWHOW-LLLHUVSDSA-N	449.939	1.332	50	20	IDGD	
COc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)Br)C[C@@H]32)cn1	1784765323	ZAEDGDRMVRAICS-UNQGMJICSA-N	426.311	1.467	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(C(F)(F)F)ccn3)[C@H]2C1	1788967103	YOJYQWTXBWHKML-PCBIJLKTSA-N	449.857	1.948	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3[nH]nc4ccncc34)C[C@@H]21	1789866540	RBEOHGYIAVOTBG-KNNTWTGDSA-N	440.331	1.788	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CCc4nc[nH]c4C3)C[C@@H]21	1789872962	MKAJSJWXDWTOFL-KWQCBRBASA-N	443.375	1.731	50	20	IDGD	
C[C@H](Cn1cccn1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]2C1	1789922546	OQJQJZXQOKTHTH-QTVXIADOSA-N	431.306	1.189	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1(c2ccc(NC(=O)COCCO)cc2)CCC1	1790529985	YASGMISQCCRUQJ-CVKSISIWSA-N	441.488	1.263	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4n(n3)CCC4)C[C@@H]21	1790960342	BXZNDHJCUMUFOX-FAYQHZLMSA-N	439.354	1.596	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3ccc(F)nc3)C[C@@H]21	1791056991	KCUQPOSZKCXIBJ-OEAJRASXSA-N	442.329	1.916	50	20	IDGD	
O=C(Cn1cnc2ccccc21)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21	1791174227	RDPYOQZHUOTHLS-MPGHIAIKSA-N	449.349	1.801	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1Cc3ccccc3N1)C2	1792871981	GRXYKIZXMWKTQU-UIVXMWCNSA-N	436.350	1.644	50	20	IDGD	
C[C@H](CBr)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](C)N1CCN(C)CC1)C2	1792991662	RFMWQFFIVATLTA-BPKGMFCQSA-N	429.403	1.292	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cn1c(=O)n(C)c3ccccc31)C2	1793449823	NCPZJMNJTAUMFZ-QOIOWGMHSA-N	448.951	1.337	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1COc2ccccc2O1	1793840037	CCPXJFZAHOMRKG-BAAGSCJXSA-N	434.565	1.268	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C(F)(F)C(F)(F)C(=O)O	1793978229	OIPNAFNHFOPGPI-LURQLKTLSA-N	433.196	1.763	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccn(C(C)(C)C)n1	1794416739	QPZGOHFWFUWEDT-HGTKMLMNSA-N	441.370	1.872	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(C)(C)F	1795483597	YNUJBOCYISEUBV-CRWXNKLISA-N	435.924	1.456	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccc(F)cn1	1795797911	SVVUXZQHBPEVJX-DJZPMSPPSA-N	428.302	1.526	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2cn[nH]c2cn1	1797579380	FVOPQDWIFLHRSM-VFFTVRQLSA-N	436.310	1.192	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(C)(C)Oc1ccc(C)cn1	1799095088	WVSREPOZVTXUFE-KYHPRHEASA-N	439.940	1.391	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c(cnn3C)c1)C2	1800640889	LAYPQDDJQMNRIG-KYHPRHEASA-N	449.349	1.950	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1=NO[C@H](c3ccccc3)C1)C2	1800978030	JUQKLBQDMKMHLQ-NZKYLMMGSA-N	435.908	1.347	50	20	IDGD	
CCOC(=O)c1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C(Cl)Cl)cc1	1801016467	CITVJUWAFABUFK-QDMKHBRRSA-N	429.300	1.870	50	20	IDGD	
CCOC(=O)C(C)(C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](Br)CC)C2	1802091558	PORQXHRZOVNGFF-XJFOESAGSA-N	433.343	1.339	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)[C@@H]2CC=CCC2)[C@@H]1c1cccnc1	1803033402	LQRQSEMEHOUECY-LZNRXBQRSA-N	427.549	1.817	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1c(F)ccc(Cl)c1F)c1ccc(B(O)O)cc1	1803798104	LAJKMQWKRRHUQX-QDMKHBRRSA-N	448.662	1.864	50	20	IDGD	
N[C@@H](Cc1cscn1)C(=O)NC[C@H]1CCN(C(=O)C(Cl)Cl)[C@H]1c1cccnc1	1808209898	DXSWMDNNDPMQFV-SNPRPXQTSA-N	442.372	1.918	50	20	IDGD	
Cc1ncc(C(=O)NC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)s1	1808907070	HPHJXIBRPGQQEQ-JXFKEZNVSA-N	444.561	1.539	50	20	IDGD	
C=CC[C@H](C)C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1	1810306396	YFHAUYAQMSXJHT-VPWXQRGCSA-N	436.516	1.612	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)Cn2nccn2)[C@H]1c1cccnc1	1812777237	NXJHIYPXMULSEG-VYDXJSESSA-N	435.326	1.553	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)CCc2cnccn2)[C@@H]1c1cccnc1	1813447813	YSTRLGUWRNLVOR-KPFFTGBYSA-N	431.924	1.764	50	20	IDGD	
CC(C)(CCl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1814696992	HMPHCFRZPXQWAU-HNNXBMFYSA-N	447.927	1.979	50	20	IDGD	
CN(CC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](O)CCl)n[nH]1)C(=O)OC(C)(C)C	1814869562	SJORPPZKHIWVEF-ZIAGYGMSSA-N	443.932	1.868	50	20	IDGD	
O=C(/C=C/c1ccoc1)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1815749048	FYFKIYGDNQSXPG-ROSSNEFBSA-N	434.261	1.702	50	20	IDGD	
O=C(N[C@H]1CCc2nc(NC(=O)[C@@H](F)Cl)sc2C1)c1cc2n(n1)CCCNC2=O	1817121795	BMFYEAFFEDQMSY-ISVAXAHUSA-N	440.888	1.233	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)C(=O)c2ccccc2)[nH]n1)c1ccc(B(O)O)cc1	1817471674	VLUNCRPQVUZTOT-IBGZPJMESA-N	446.272	1.278	50	20	IDGD	
O=C(C/N=C/c1ccco1)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1819477710	RJYBIQFBNPAWFJ-NZYROCMPSA-N	449.276	1.108	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3c4c(nn3C)CCC4)sc2C1	1824245687	YEDLDEWRSMYUDH-CMPLNLGQSA-N	437.953	1.845	50	20	IDGD	
CC[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)COCCOC)CC2	1825444980	HNBNDANZADTWQI-GHMZBOCLSA-N	434.356	1.892	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1c(F)c(C)nn1C)CC2	1825993578	KUIDAHLNKIRURF-ZJUUUORDSA-N	429.905	1.804	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ncccc1F)CC2	1826087953	MDFXJAQDHOQLEP-NSHDSACASA-N	434.497	1.276	50	20	IDGD	
O=C(CCc1ccco1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827049977	BJCWJYRIQQHIGB-QFIPXVFZSA-N	438.333	1.826	50	20	IDGD	
COCCn1ccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)[C@H](O)CCl)CC2)n1	1827824114	OSHVNQLJHGICEX-ZWKOTPCHSA-N	426.945	1.363	50	20	IDGD	
Cc1cc2nnc(C(=O)N3CCCC[C@H]3C3CCN(C(=O)[C@H](O)CCl)CC3)c(C)n2n1	1828144800	OEWYXYCYDGDQLY-DLBZAZTESA-N	448.955	1.574	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CN2C(=O)CNC2=O)CC1	1830314211	UEPVYKZRWFOGKL-LIRRHRJNSA-N	447.363	1.394	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CSc3ncccn3)C2)C1	1830358507	WSFNNZPZHCXQDP-LJQANCHMSA-N	442.969	1.290	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccnc3)C2)C1	1830537707	MKOKEZJHDBFKKN-RDTXWAMCSA-N	426.311	1.183	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccncc3)C2)C1	1830543401	RAVRTSBSUIPFLF-BEFAXECRSA-N	440.338	1.112	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(Cl)cnc3O)C2)C1	1831639000	JHTNZLBTKZGJKA-HNAYVOBHSA-N	446.331	1.918	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(Cl)nn3)C2)C1	1831650122	DCIWEGXJNWCUQJ-SCLBCKFNSA-N	431.320	1.608	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)C[C@@H]1CCCCO1)CCO2	1832345479	YUNSOWMAXLWJDK-PXNSSMCTSA-N	428.602	1.254	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3ccc(C)nc3)CCO2)C1	1832912904	LHMCHPASEZOWIA-GHTZIAJQSA-N	439.940	1.033	50	20	IDGD	
C=CC(=O)N[C@@H](C)C(=O)N1CCC(N2CCC(NC(=O)C(C)(C)CCl)CC2)CC1	1833214431	AUOSIIAHUKKOOW-HNNXBMFYSA-N	426.989	1.514	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnc(OCC)cn3)CCO2)C1	1833430068	OXWKOOHMJNXQAD-QRWLVFNGSA-N	440.928	1.353	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cn(C)nc3C)CC2)CC1	1833583656	CDWBCPXSYVQCIG-GOSISDBHSA-N	425.961	1.168	50	20	IDGD	
CC(C)(C)n1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)n1	1833590028	BNIJQJQULNJWHS-GOSISDBHSA-N	433.336	1.512	50	20	IDGD	
CCc1nn(C)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)c1Cl	1833593554	SOYOLOWPMVTZDO-PBHICJAKSA-N	437.299	1.240	50	20	IDGD	
CCn1nccc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1	1834418091	CNPTXSIMFUNQDR-ZWKOTPCHSA-N	433.336	1.209	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](F)Cl)CC2)CC1)[C@H]1Cc2ccccc2CN1	1835085232	ZSVGVDQVXQFNNS-UXHICEINSA-N	436.959	1.807	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cn4cccnc4n3)CCO2)C1	1836882355	ALXMPCRPDSMYLD-FQEVSTJZSA-N	435.912	1.064	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc4cncn4c3)CCO2)C1	1837118621	XPOHKJJMUNARNT-GHTZIAJQSA-N	434.924	1.812	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cccc(O)n3)CC2)CC1	1837473858	PPXHRBNWSRIQFJ-MRXNPFEDSA-N	425.913	1.653	50	20	IDGD	
CC[C@@H](NC(N)=O)C(=O)N1CCC(OC2CCN(C(=O)CCBr)CC2)CC1	1837653779	YDUHFGBJMDOCCC-OAHLLOKOSA-N	447.374	1.217	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)CSC3CCCC3)C2)C1	1837710054	GCSBVZQJPDXTES-HXUWFJFHSA-N	444.670	1.970	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)CCC(F)(F)F)C2)C1	1837711810	REFWWECHOFXFEN-MRXNPFEDSA-N	426.508	1.637	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3ccc[nH]3)C2)C1	1839152366	XFVOFJNSPSDQNT-MOPGFXCFSA-N	432.348	1.640	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)C#Cc3ccccc3)C2)C1	1839963409	JJWLIFWBNJVCJA-RXVVDRJESA-N	449.345	1.668	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(C)c(OC)c3)C2)C1	1840154552	ZGIWQSITDKGQKF-LAUBAEHRSA-N	440.924	1.327	50	20	IDGD	
O=C(Cc1ccc2c(c1)CCO2)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840189650	DSVXOZSXYWFIDT-HXUWFJFHSA-N	443.327	1.424	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCCc3cccnc3)CCO2)C1	1840513500	CLLBBGWVWVSDNA-NQIIRXRSSA-N	439.940	1.115	50	20	IDGD	
CC(C)(C)OC(=O)NC1(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)CC1	1840956372	RYLARAKNCDRACB-SCLBCKFNSA-N	449.907	1.035	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(F)(C(=O)N2CC3(CCCN3C(=O)[C@@H](O)CCl)C2)CC1	1841348043	FIWFRAZTFUHNCK-AWEZNQCLSA-N	447.935	1.529	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](O)[C@@H](C(=O)N2CC3(CCCN3C(=O)[C@@H](F)Cl)C2)C1	1843363858	CTHUZSNORSEDGI-MELADBBJSA-N	433.908	1.342	50	20	IDGD	
CCC1(C(=O)N2CC3(CCCN3C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)COC1	1844693160	DCMFBADICVHMBF-UHFFFAOYSA-N	431.445	1.764	50	20	IDGD	
CC[C@H](C)CC(=O)N1CC2(CCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)C1	1845038181	AYDLQSJEWIZUMK-SFHVURJKSA-N	429.565	1.972	50	20	IDGD	
O=C(c1nc2c(=O)[nH]c3ccccc3n2n1)N1CC2(CCCN2C(=O)C(Cl)Cl)C1	1846387759	JUEODUKPVPGCLN-UHFFFAOYSA-N	435.271	1.192	50	20	IDGD	
Cc1ccc(=O)n(C(C)(C)C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](C)CBr)n1	1847498853	PHILUYSDDZWYGH-SNPRPXQTSA-N	439.354	1.520	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)Cn2c(=O)n(CC)c3ccccc32)c2ccccc2c1=O	10752069	WXBGQFARGCGXQH-UHFFFAOYSA-N	448.483	1.404	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1cc(-c2ccco2)n(-c2ccc(Cl)cc2)n1	25452949	PJWGJOKQDLZWNY-GFCCVEGCSA-N	448.888	1.981	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2cc(C)n(-c3ccccc3)c2C)cnn1-c1ccc(=O)[nH]n1	29610282	JAPKRVWPBFRPGL-UHFFFAOYSA-N	431.456	1.746	50	20	IDGD	
COCCS(=O)(=O)c1ccc(C(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)cc1	109995045	YSCQOMVHTBXNSA-MRXNPFEDSA-N	434.514	1.952	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)CCc2nc(-c3ccc(Cl)cc3)no2)C[C@H](C)O1	726164410	QMFYVPNPUFSHEO-KBPBESRZSA-N	435.912	1.969	50	20	IDGD	
CCOC(=O)C1=NN(c2ccccc2)[C@H](C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)C1	727752134	IDXZXZJUNFZGGS-KRWDZBQOSA-N	425.401	1.554	50	20	IDGD	
O=C(COC(=O)CCCc1ccc2c(c1)CC(=O)N2)NNC(=O)c1ccc([N+](=O)[O-])cc1	729765164	ZZKVYSYOPHMFHL-UHFFFAOYSA-N	440.412	1.417	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NCCOc1ccc(S(C)(=O)=O)cc1	730067314	WVJQIJAAOINFHJ-ZDUSSCGKSA-N	439.465	1.406	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)c2cc(S(=O)(=O)N3CCC[C@H](C)C3)cn2C)c(O)c1	730278537	LCJQWTHLFGNURM-AWEZNQCLSA-N	434.518	1.535	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@@H]2C(=O)NNC(=O)Cc2ccccc2F)c(OC)c1	731330489	XRZSBJBQTFMSTF-GOSISDBHSA-N	429.448	1.838	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)N(C)Cc1ccccc1	732246392	ROYOHJUTABPVMZ-KRWDZBQOSA-N	425.537	1.544	50	20	IDGD	
CC[C@@H](C#N)Oc1cccc(CNC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c1	733851904	MPVQKUAUIHYDQR-HNNXBMFYSA-N	434.456	1.759	50	20	IDGD	
CCOCCCN1CC[C@H](NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)[C@H](C)C1	734682532	BXDIBUMYSFFOOB-QAPCUYQASA-N	444.536	1.015	50	20	IDGD	
CCOCCCN1CC[C@H](NC(=O)NNC(=O)c2cc(Br)c[nH]2)[C@H](C)C1	734683311	GVFVAZMEAUMATP-OCCSQVGLSA-N	430.347	1.858	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)COc2ccc([N+](=O)[O-])cc2)CC1	734824610	FXXVGQVELNULMM-UHFFFAOYSA-N	437.453	1.704	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)[C@@H]2CC(=O)N(C(C)(C)C)C2)CC1	734826019	TVIQVLXVSMZKDA-CYBMUJFWSA-N	425.530	1.363	50	20	IDGD	
O=C(COC(=O)Cc1csc(-c2ccoc2)n1)NNC(=O)[C@H]1COc2ccccc2O1	738855599	NAQJOSUNPCGJOA-MRXNPFEDSA-N	443.437	1.476	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@H](C)Cc2ccc(C)s2)cc1	739045411	LWSXQLOLWSFQCV-CQSZACIVSA-N	438.575	1.947	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc2c(c1)OCCCO2)NNc1ncccc1C(F)(F)F	740100422	NBNHSCUVCSGEMI-UHFFFAOYSA-N	446.407	1.683	50	20	IDGD	
COc1ccc(-c2n[nH]c(CNC(=O)NNC(=O)[C@@H](C)Oc3ccc(F)cc3)n2)cc1	741414035	KXKAPLGHGPCOAU-GFCCVEGCSA-N	428.424	1.917	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)NCc1nc(-c2ccc(F)cc2)n[nH]1	741416311	PGKKENTYOSGWDL-UHFFFAOYSA-N	428.424	1.919	50	20	IDGD	
CC(=NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1ccc(S(=O)(=O)CC(F)(F)F)cc1	741758268	BRSKBFNFZXRKCJ-GFCCVEGCSA-N	426.438	1.298	50	20	IDGD	
O=C(Cc1cccc([N+](=O)[O-])c1)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	742035124	ZRYRVBLUCMSFBX-UHFFFAOYSA-N	432.458	1.383	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)[C@@H](NC2CCOCC2)C(C)C)c2ccccc2c1=O	743284280	AEXQXIJFXILMMK-SFHVURJKSA-N	429.521	1.361	50	20	IDGD	
COC(=O)c1ccc(CCNC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)cc1	743523390	NEMJDYUSYWLRNI-UHFFFAOYSA-N	434.474	1.455	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)CN2CCN(c3c(C#N)cnc4ccccc34)CC2)cc1	744394001	WXXGJEXAEMFNQP-UHFFFAOYSA-N	439.479	1.561	50	20	IDGD	
CC(C)S(=O)(=O)c1ccc(C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)cc1	744786449	QSJFJXPQYPIYAO-UHFFFAOYSA-N	429.454	1.358	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)CSc2nnc(-c3cccs3)n2C)c1	744925126	CQBVERYDXRYKPX-UHFFFAOYSA-N	445.526	1.949	50	20	IDGD	
CN(C)C(=O)NNC(=O)/C(C#N)=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	746015111	XDRWEEJJIMAZEQ-UKTHLTGXSA-N	429.868	1.288	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NN=Cc1cnc2cnc(Br)cn12	746372515	QBRHALIZPWAYER-UHFFFAOYSA-N	426.275	1.650	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)c1ccc2c(c1)C(=O)N(C[C@@H]1CCCO1)C2=O	746556372	UUELVWDTBNJCTK-INIZCTEOSA-N	447.451	1.113	50	20	IDGD	
COc1cc(C)nc(NNC(=O)NCc2ccc(C(=O)N3C[C@H](C)O[C@@H](C)C3)cc2)n1	746757304	OALWPLMHQDZKKG-GJZGRUSLSA-N	428.493	1.869	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H](COC)c2ccco2)c1	746769698	FXXXOARPPQCGMY-INIZCTEOSA-N	438.506	1.642	50	20	IDGD	
N#CCCn1cc(/C=C(\C#N)C(=O)N2CCO[C@H](C(N)=O)C2)c(-c2ccc(Cl)cc2)n1	747783017	XTHFUKFSXXAJBW-KAPURRDVSA-N	438.875	1.737	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)c2ccc(S(N)(=O)=O)c(Br)c2)cc1	748045579	OIBOFHKCKCCGAB-UHFFFAOYSA-N	426.292	1.734	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)N[C@H]1CCCN(Cc2ccc(F)cc2Cl)C1	748631183	LNRYJFRYDGEPQO-BBRMVZONSA-N	430.908	1.825	50	20	IDGD	
CC[C@H](Oc1cccc(C)c1)C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	749333232	KINKTMAOJQFOPW-HNNXBMFYSA-N	425.894	1.914	50	20	IDGD	
Cc1ccc(S(=O)(=O)C2(C(=O)NNC(=O)CNC(=O)c3cccs3)CCCC2)cc1	750826067	IDEZMIJYPPBQOI-UHFFFAOYSA-N	449.554	1.720	50	20	IDGD	
Cc1c(C(=O)NNC(=O)CNC(=O)c2ccco2)cnn1-c1ccc(Br)cc1	751201336	HWNMKWMHPGXQIT-UHFFFAOYSA-N	446.261	1.727	50	20	IDGD	
O=C(NC[C@H](O)CS(=O)(=O)c1cccs1)NNC(=O)c1cccc(OC(F)F)c1	752169143	QMIGPFOABMBIND-NSHDSACASA-N	449.457	1.128	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)NC[C@H]2CCCN2S(C)(=O)=O)cc1OC	753115594	OMZRLXZVPGTAKF-OAHLLOKOSA-N	442.538	1.242	50	20	IDGD	
Cc1cccc(CC(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)c1Cl	754232463	DSZDAQKDOPPSGG-UHFFFAOYSA-N	437.953	1.665	50	20	IDGD	
O=C(NNc1ccc(C(F)(F)F)nn1)c1ccc2c(c1)SC1=NS(=O)(=O)CCN12	755295229	VWMAEMMDMMSZOU-UHFFFAOYSA-N	444.420	1.864	50	20	IDGD	
Cc1cccn2c(C=NNC(=O)c3cccc(S(=O)(=O)N4CCOCC4)c3)cnc12	755467018	LZKHQHSJHVEDLA-UHFFFAOYSA-N	427.486	1.428	50	20	IDGD	
CN(CC(=O)O)c1ccc(C(F)(F)F)cc1C=NNC(=O)Cc1cc(O)nc(S)n1	755618877	STZNVVYWYGYDMI-UHFFFAOYSA-N	443.407	1.703	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)[C@@H]1CCC(=O)N1Cc1ccc(Br)cc1	755719188	DANOZRQMYXOFIY-RISCZKNCSA-N	440.294	1.429	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)Nc1cc(N2CCCS2(=O)=O)ccc1F	756156134	ZUCGOUOUHVZSNK-UHFFFAOYSA-N	436.465	1.770	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)Nc3ccn(C)n3)c2)cc1	756293437	HNIQTNFDOVSEOM-UHFFFAOYSA-N	444.473	1.696	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)Nc2cccc(CS(=O)(=O)C(C)C)c2)c1	756552058	BYZVKFIEZZBEEN-UHFFFAOYSA-N	433.490	1.830	50	20	IDGD	
COC(=O)c1cc(NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)ccc1C	756845204	PXOPOVPOMXBODL-UHFFFAOYSA-N	448.501	1.563	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2C(=O)NC3(C[C@@H](C)C[C@H](C)C3)C2=O)cc1OC	756857930	SQKQFMWTILKHFH-STQMWFEESA-N	432.477	1.212	50	20	IDGD	
O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)NNC(=O)c1csc(N2CCOCC2)n1	758078808	BAHLGBWDCYVIFZ-UHFFFAOYSA-N	430.446	1.373	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)NC[C@@H]1CN(Cc2ccccc2)CCCO1	758851201	BGNWYFPEYKYINN-LJQANCHMSA-N	436.516	1.878	50	20	IDGD	
O=C(O)c1cc(S(=O)(=O)NNC(=O)C(F)(F)Oc2ccccc2)ccc1[N+](=O)[O-]	760361955	YDQCOLGRBBYIQC-UHFFFAOYSA-N	431.329	1.274	50	20	IDGD	
C[C@H]1CN(Cc2ccccc2)C[C@@H](C)[C@@H]1NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	761793718	RNHMDONQFOVZFP-LFUKPOHLSA-N	448.531	1.763	50	20	IDGD	
CC(C)(C)C1=S=C(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)C=C1	763124043	GFSUNGKIFZZPNH-UHFFFAOYSA-N	435.571	1.926	50	20	IDGD	
COC(=O)c1cc(OC)c(S(=O)(=O)NNC(=O)CSc2ccccc2O)s1	763410501	OEFLUORNPUTREB-UHFFFAOYSA-N	432.501	1.351	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccncc2)n(-c2cccc(Br)c2)n1	763463337	FYIPLBAEWDLFMV-UHFFFAOYSA-N	443.261	1.738	50	20	IDGD	
O=C(NNC(=O)c1ccccn1)C(=O)Nc1cnn(-c2ccccc2Br)c1	763463509	KDEOZGSMEIZYAK-UHFFFAOYSA-N	429.234	1.430	50	20	IDGD	
CC(=O)NNC(=O)C(=O)Nc1cc(Br)ccc1I	763518747	XVBUHUMCXWLQQE-UHFFFAOYSA-N	426.008	1.160	50	20	IDGD	
O=C(NNC(=O)c1ccccc1F)C(=O)Nc1ccc2nc(N3CCOCC3)sc2c1	763562481	WLBKHZWNFOUJQE-UHFFFAOYSA-N	443.460	1.672	50	20	IDGD	
Cc1ccnc(-c2ccc(NC(=O)C(=O)NNC(=O)COc3ccc(C#N)cc3)cc2)n1	763681759	NBHOMVGBQKFXIC-UHFFFAOYSA-N	430.424	1.489	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)cnn1-c1ccccc1	763729108	UQICOHBACMBURV-UHFFFAOYSA-N	432.484	1.719	50	20	IDGD	
COc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NNC(=O)c1cc2c(s1)CCC2	763781251	HODIZHIWFCVRBO-UHFFFAOYSA-N	430.486	1.347	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(N3CCOC3=O)cc2)cc1OC	763901963	ORIJKCNWZCUTPF-UHFFFAOYSA-N	442.428	1.450	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)NC(=O)CO3)ccc1OC(C)C	763916277	LDOZJNYBUBNKKR-UHFFFAOYSA-N	442.428	1.213	50	20	IDGD	
Cc1cnn(Cc2cc(F)ccc2F)c1NC(=O)C(=O)NNC(=O)Cc1ccsc1	764035285	QYHXZYLWZADEMK-UHFFFAOYSA-N	433.440	1.908	50	20	IDGD	
CC[C@@H](C)C(=O)NNC(=O)C(=O)Nc1cc(F)c(I)c(F)c1	764080885	CAIWMMLSZKDRCY-ZCFIWIBFSA-N	425.173	1.701	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)CCc2ccccc2)cc1-n1nnnc1C1CC1	764192863	PUJVLCCBQKFNAC-UHFFFAOYSA-N	449.471	1.267	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(NC(=O)C(=O)NNC(=O)CCCc2ccccc2)c1	764226630	PFSJZOUHPTUEGK-UHFFFAOYSA-N	432.502	1.046	50	20	IDGD	
C#CCOc1cccc(NC(=O)C(=O)NNC(=O)c2cc(F)ccc2Br)c1	764271134	WDPFAPGHSHJTNO-UHFFFAOYSA-N	434.221	2.000	50	20	IDGD	
CC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2cc(Br)ccc2O)cc1	764279912	HSUMYUCFAWGUCB-UHFFFAOYSA-N	435.234	1.513	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)CCc2ccccc2O)sc2c1CCC2	764289211	PUHCTJGAVHZGAE-UHFFFAOYSA-N	445.497	1.838	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)c2cnn(C)c2)sc2c1CC[C@@H](CC)C2	764360499	YZXJECDSTUSPIL-LLVKDONJSA-N	447.517	1.573	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)C(=O)Nc1cnn(Cc2ccc(Cl)cc2)c1	764367363	VODWWOWLHACTJU-UHFFFAOYSA-N	441.875	1.888	50	20	IDGD	
O=C(CN1CCC(C(=O)NCCCN2CCCCC2)CC1)NNC(=O)c1ccccc1	764384162	SMJBOYKEZUMQBB-UHFFFAOYSA-N	429.565	1.152	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cnn(C)c3C(F)F)n[nH]2)cc1	764385090	QWHXZYAZVOUHRM-UHFFFAOYSA-N	431.403	1.710	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNC(=O)CSc2ccccc2OC)cc1OC	764393877	SJATUCMJTWUKKJ-UHFFFAOYSA-N	433.486	1.981	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNS(=O)(=O)c2cnn(-c3ccccn3)c2C)cc1	765031002	UJHHHKRJVUXIRT-HNNXBMFYSA-N	445.501	1.751	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)Nc2cccc(S(N)(=O)=O)c2)n[nH]1	765311711	RLDMSZADAOHPRF-UHFFFAOYSA-N	430.446	1.199	50	20	IDGD	
CC/C=C(\C)C(=O)N1CSC[C@@H]1C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C	765320098	LAPHHANXDSFIQG-MAUPQMMJSA-N	428.555	1.697	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2nccc(OC)n2)c(I)c1	765700436	XVZKVYNREXFMMI-UHFFFAOYSA-N	443.201	1.180	50	20	IDGD	
Cc1cccc(C)c1OCCC(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765739192	QSYBDXVCNJSHGJ-UHFFFAOYSA-N	438.528	1.678	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc([N+](=O)[O-])c(Cl)c2)c1	767162334	YSBZSIUHBYOMAA-UHFFFAOYSA-N	426.838	1.573	50	20	IDGD	
C[C@]1(c2ccc(C(=O)NNC(=O)c3cc(-c4ccc(F)cc4)[nH]n3)cc2)NC(=O)NC1=O	768279764	RLHSSQYYHDYKLT-OAQYLSRUSA-N	436.403	1.345	50	20	IDGD	
CC(C)O[C@H]1C[C@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)C1(C)C	768448579	MRIIUCAFQKCSSO-HOTGVXAUSA-N	426.539	1.473	50	20	IDGD	
COCCN1CCN(C(=O)NNC(=O)c2ccc(Br)cc2Cl)CC1=O	768724424	AHQNVRRYFIILNF-UHFFFAOYSA-N	433.690	1.248	50	20	IDGD	
C[C@H](CBr)COC(=O)[C@H](NS(=O)(=O)c1ccc(Cl)cc1)[C@@H](C)O	770304773	KZNSOUNPUJGNGW-GIPNMCIBSA-N	428.732	1.942	50	20	IDGD	
Cc1cc(N2CC[C@@H](NC(=O)NNC(=O)[C@H](C)Oc3cccc(Cl)c3)C2=O)n(C)n1	770648369	GDKMTQDPCWSKJQ-SWLSCSKDSA-N	434.884	1.285	50	20	IDGD	
COc1ccc(N2C[C@@H](C(=O)NNc3nc(O)c4cnn(C(C)(C)C)c4n3)CC2=O)cc1	770959513	WUWIIOPIMQYRFO-LBPRGKRZSA-N	439.476	1.792	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(CCC(=O)NNc2nc(O)c3cnn(C)c3n2)cc1	770979499	FUOBDSSBFYCCCG-UHFFFAOYSA-N	447.521	1.175	50	20	IDGD	
CC(C)c1n[nH]c(C(=O)NNC(=O)c2ccc(CSc3nncn3C)cc2)c1[N+](=O)[O-]	771220342	QRDZHSHBEZADFA-UHFFFAOYSA-N	444.477	1.937	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1	772131820	IYDOTJBJSDUXLM-NWDGAFQWSA-N	440.478	1.386	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)c2cc(S(=O)(=O)NC(C)(C)C)ccc2C)c1	773086078	AQJBWNPRHNPAJC-UHFFFAOYSA-N	447.517	1.500	50	20	IDGD	
Cc1nc(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)ccc1Br	773524144	FHPIBCWJWXLCMY-UHFFFAOYSA-N	441.669	1.971	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNc2cnc3ccccc3n2)cccc1C(=O)N1CCOCC1	773719205	SHBWKMJAZRVRQN-UHFFFAOYSA-N	434.456	1.492	50	20	IDGD	
O=C(Cc1sc(N2CCOCC2)nc1-c1ccccc1)NNc1ncnc2[nH]cnc12	774438323	RWJBYWALACKPSW-UHFFFAOYSA-N	436.501	1.999	50	20	IDGD	
COC[C@H](C)C(C)=NNC(=O)C[C@@H]1c2cc(OC)c(OC)cc2CCN1S(C)(=O)=O	777876671	BAJPSYYLZZNSAO-SUMWQHHRSA-N	441.550	1.727	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)C(=O)Nc1cc(Cl)ccc1OC1CCCC1	778711272	XJXLPMQOVLBZCA-NSHDSACASA-N	443.909	1.182	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CC[C@H]([C@@H](C)NC(=O)OC(C)(C)C)C2)n1	778985538	YTGMFWZUYYDDFI-KGLIPLIRSA-N	425.555	1.377	50	20	IDGD	
Cc1ccc(C(F)(F)C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cc1	780645519	CUAUJOPZCNSSRK-UHFFFAOYSA-N	430.455	1.692	50	20	IDGD	
COC(=O)C1(CNC(=O)NNC(=O)c2ccc(COc3ccccc3)o2)CCOCC1	781782949	WLXXDOSEFJSAFM-UHFFFAOYSA-N	431.445	1.772	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2ccnn2Cc2cnn(-c3ccccc3)c2)nc1	782145294	PSEKCKLBPJCTII-UHFFFAOYSA-N	432.444	1.603	50	20	IDGD	
O=C(COc1ccccc1NC(=O)C(=O)NNC(=O)c1ccc(O)cc1)Nc1cccnc1	782834442	WITIEOUHBWIESP-UHFFFAOYSA-N	449.423	1.204	50	20	IDGD	
CSCc1ccccc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)NC(C)C)cn1	783264349	NFZHFSGIJBTYLG-UHFFFAOYSA-N	437.547	1.713	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)C(=O)Nc1ccc(Cl)c(Br)c1	784004337	LEEPTLIHRJUXEC-UHFFFAOYSA-N	443.641	1.211	50	20	IDGD	
O=C(Cn1cc(NC(=O)C(=O)NNc2ccc(OC(F)F)cc2)cn1)NC1CCCC1	784310989	MOZUFKZLAGTZJL-UHFFFAOYSA-N	436.419	1.625	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)(F)F)cc1)c1cc(N2CCOCC2)ccn1	784447350	UPWUJEUTSAZYDQ-UHFFFAOYSA-N	430.408	1.969	50	20	IDGD	
O=C(NNc1nc(-c2ccc(Cl)cc2)no1)C(=O)Nc1ccc2c(c1)C(=O)NCC2	784794354	BJQFAXGGGBLBMU-UHFFFAOYSA-N	426.820	1.758	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)CCCOc1ccc2c(c1)NC(=O)CC2	784799930	ANNOVYPVYNGBFA-UHFFFAOYSA-N	427.457	1.965	50	20	IDGD	
CC(C)(C)OC(=O)NCCOc1cccc(NC(=O)C(=O)NNc2ncc(F)cn2)c1	784950165	NREZZYPMBNKHJV-UHFFFAOYSA-N	434.428	1.601	50	20	IDGD	
COC(=O)c1cc(OC)c(OC)c(OC)c1NC(=O)C(=O)NNc1cccc(F)c1F	785017515	VUIXACFRYAVXCX-UHFFFAOYSA-N	439.371	1.859	50	20	IDGD	
Cc1ccc(Br)nc1C(=O)NNC(=O)c1csc(N2CCOCC2)n1	786685983	BIHCFBHCAGKUHZ-UHFFFAOYSA-N	426.296	1.520	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1nc(Br)cs1	788630216	JKHCOVOACIRWHG-UHFFFAOYSA-N	432.325	1.582	50	20	IDGD	
COc1cc(NNC(=O)NCc2ccccc2S(=O)(=O)N(C)CCO)ccc1Cl	789002310	QBIABNJIBVSHBA-UHFFFAOYSA-N	442.925	1.788	50	20	IDGD	
CN(CC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)[C@@H]1CCN(Cc2ccccc2)C1=O	789524255	AOKQRUXEUJIMPC-GOSISDBHSA-N	425.445	1.089	50	20	IDGD	
CO[C@H]1CCOc2c(NC(=O)C(=O)NNC(=O)[C@H]3COc4ccccc4O3)cccc21	790957560	UKHCWQZNWXXNOY-WMLDXEAASA-N	427.413	1.083	50	20	IDGD	
COc1cccc(C2=NO[C@H](C(=O)NNC(=O)c3nn(C(C)C)c(=O)c4ccccc34)C2)c1	792016031	JSQPUTDUDBDGPI-IBGZPJMESA-N	449.467	1.940	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)c1cc(Cn2cccn2)on1	794180641	MOGKYUHDWOWORQ-NSHDSACASA-N	434.250	1.910	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)CN2C(=O)C(F)(F)Oc3ccccc32)cc1OC	794200940	PTBWEZNCRGVUGY-UHFFFAOYSA-N	435.383	1.873	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNS(=O)(=O)c1cc(Cl)ccc1Br	797432148	OKCAVKGIRATGFX-UHFFFAOYSA-N	442.719	1.937	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2ccc(OC)c(OCCO)c2)c2ccccc2c1=O	798317252	XHUTZFQITZYTBT-UHFFFAOYSA-N	440.456	1.261	50	20	IDGD	
Cc1oc(S(N)(=O)=O)cc1C(=O)NNc1ccccc1S(=O)(=O)NC(C)(C)C	798335094	FNIPTOSSBGFWMD-UHFFFAOYSA-N	430.508	1.069	50	20	IDGD	
Cc1ccc(-c2ccnn2C)cc1NC(=O)C(=O)NNC(=O)CSc1ccccc1O	799258542	DJNAIUNXSSVBKO-UHFFFAOYSA-N	439.497	1.979	50	20	IDGD	
COc1ccc(-n2c(C)cc(/C=C(\C#N)C(=O)OCC(=O)N3CCNC(=O)C3)c2C)cc1	800704456	FRPKJGYRQRUDPO-WOJGMQOQSA-N	436.468	1.511	50	20	IDGD	
COC(=O)c1c(F)cc(NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1F	801836701	BKGPSQYDBFDQAI-UHFFFAOYSA-N	431.355	1.465	50	20	IDGD	
CCCN(NC(=O)Cn1cc(S(=O)(=O)N(CC)CC)ccc1=O)C(=O)OC(C)(C)C	804594462	BFGPQTYQSPLWDI-UHFFFAOYSA-N	444.554	1.557	50	20	IDGD	
COc1cc(OC)cc(N2CC[C@H](NC(=O)NNc3ccc4c(=O)[nH]ccc4c3)C2=O)c1	806906350	QRSZGLHVKORIAB-IBGZPJMESA-N	437.456	1.977	50	20	IDGD	
Cc1c(C(F)(F)F)nn(C)c1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccccc1F	806975139	OWALDZBSZLHMQG-SECBINFHSA-N	431.346	1.440	50	20	IDGD	
O=C(CCCc1cccs1)NNC(=O)C(=O)Nc1cc(Cl)cc2c1OCC(=O)N2	806979604	BNNJQBUFLJZYOR-UHFFFAOYSA-N	436.877	1.841	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCCn2cc(Br)cn2)c2ccccc2c1=O	807530172	WAXAAMBJCKIXKK-UHFFFAOYSA-N	448.281	1.020	50	20	IDGD	
COc1ccc(C(=O)NNc2cccc(F)n2)cc1S(=O)(=O)NCc1ccccn1	807749883	YSKZULPZGDLXJD-UHFFFAOYSA-N	431.449	1.860	50	20	IDGD	
C[C@@H]1CCCN(c2cc(C(=O)OCC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)ccn2)C1	812654080	SEHHLGCRQCYXTM-CQSZACIVSA-N	441.444	1.844	50	20	IDGD	
Cc1cc(S(N)(=O)=O)cc(NC(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)c1C	812943604	DGQGOHRUWCNMLH-UHFFFAOYSA-N	441.535	1.350	50	20	IDGD	
COC(=O)c1ccc(C=NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)n1C	814879195	QQVNZQXFVOMXRS-UHFFFAOYSA-N	431.924	1.733	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)COc2cccc(C)c2)cc1)[C@@H]1C[C@@H]1C	815564859	VNJFTYZXMBNGSK-MGPUTAFESA-N	438.484	1.921	50	20	IDGD	
Cc1cc(OCc2ccccc2)ccc1NC(=O)C(=O)NNC(=O)[C@H]1CCc2nncn2C1	815691206	IJKMABJGQPSUND-KRWDZBQOSA-N	448.483	1.514	50	20	IDGD	
CCN1CCN(C(=O)Cc2ccc(NC(=O)C(=O)NNc3cccc(Cl)n3)cc2)CC1	815726381	AVJKWZPUTQLZQO-UHFFFAOYSA-N	444.923	1.523	50	20	IDGD	
CS(=O)(=O)c1ccccc1-n1cc(NC(=O)C(=O)NNc2cccc(Cl)n2)cn1	815728511	GSEUIWWAJVMJIX-UHFFFAOYSA-N	434.865	1.406	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCO1)C(=O)Nc1cccc(C(=O)Nc2ccc(Cl)cn2)c1	815778909	JURSVBYQKLTJMK-CQSZACIVSA-N	431.836	1.252	50	20	IDGD	
O=C(NNc1cccc(Cl)n1)c1ccc2c(c1)S(=O)(=O)N(C[C@H]1CCCO1)C2=O	817008812	IUUDRJCLMIRJDI-GFCCVEGCSA-N	436.877	1.815	50	20	IDGD	
O=C(COC(=O)CCNC(=O)c1ccc([N+](=O)[O-])cc1)NNC(=O)c1cccc(Cl)c1	848949263	HMAMAVSNWZJHMK-UHFFFAOYSA-N	448.819	1.373	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)c1ccccc1-n1cnnn1	849202000	JWMBTSULAAHYFU-NSHDSACASA-N	431.250	1.653	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)O[C@H](C)C(=O)N2CCN(C(C)=O)CC2)c1C	853510752	RTABYUFBFPSVPS-VJOZSWGJSA-N	430.505	1.281	50	20	IDGD	
COCCCn1c(S)nc2cc(C(=O)NNC(=O)NC3CCCCC3)ccc2c1=O	887675721	GNJIFXAPEIEULJ-UHFFFAOYSA-N	433.534	1.998	50	20	IDGD	
COc1ccc([N+](=O)[O-])cc1NS(=O)(=O)c1ccc(C(=O)NNc2ncccn2)cc1	913040491	XNZNJNLHUMDRNS-UHFFFAOYSA-N	444.429	1.951	50	20	IDGD	
N#C/C(=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)OC[C@@H]1CNC(=O)O1	914005700	UTKWRMCKVMICJI-UDYBNVKDSA-N	443.847	1.637	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)CCCOc1ccc2c(c1)CCC(=O)N2	914595337	AJBHMMFINWRZSB-UHFFFAOYSA-N	427.457	1.965	50	20	IDGD	
Cc1ccccc1[C@@H](CC(=O)OCC(=O)NNC(=O)c1ccc(Cl)cc1)NC(N)=O	914644351	UEMDWWCBPONZFZ-MRXNPFEDSA-N	432.864	1.752	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NC[C@H](c1cccs1)N1CCN(C)CC1	915902134	QDPQVNRVFYDFGZ-MAUKXSAKSA-N	449.552	1.974	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)NCC(=O)N(C)C)c2)c(C)c1	915912951	DRRILZLRPHEPLX-UHFFFAOYSA-N	447.517	1.136	50	20	IDGD	
O=C(NNC(=O)c1cc(S(=O)(=O)Nc2ccccc2F)c[nH]1)c1ccc([N+](=O)[O-])cc1	916091398	PIZRPKMRRQLTAA-UHFFFAOYSA-N	447.404	1.938	50	20	IDGD	
CC(C)NC(=O)C(=O)NNC(=O)c1nn(-c2ccc(Br)cc2)c2c1CCCC2	916111094	XMONGGXFZJANON-UHFFFAOYSA-N	448.321	1.799	50	20	IDGD	
CC(C)NS(=O)(=O)Cc1ccc(CNC(=O)NNc2ccc(-n3cccn3)nn2)cc1	916228637	LHNRVGNAVLWTNQ-UHFFFAOYSA-N	444.521	1.316	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)NCc2cccc(NS(C)(=O)=O)c2)cc1C	916246944	ZBDNYIDCYGNHNK-UHFFFAOYSA-N	433.490	1.144	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)NCc2ccc(-n3cncn3)nc2)cc1	916395072	AEWHTFNLLMFVSI-CQSZACIVSA-N	425.449	1.359	50	20	IDGD	
CCCC(=O)Nc1ccc(CNC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1	916513912	KPLQITSMYREMEQ-UHFFFAOYSA-N	432.502	1.973	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCc2ccc(S(C)(=O)=O)cc2)cc(OC)c1OC	916568225	VXUIFOVMMAXQPY-UHFFFAOYSA-N	437.474	1.260	50	20	IDGD	
COc1ccc(C)cc1CNC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	916601589	DCQFDGUINTYVTQ-UHFFFAOYSA-N	446.529	1.932	50	20	IDGD	
O=C(CN1C(=O)N[C@]2(CCc3ccccc32)C1=O)NNC(=O)c1ccc2ccccc2c1	918109066	ZNXJFALATIULGS-DEOSSOPVSA-N	428.448	1.994	50	20	IDGD	
CN1C(=C(C#N)C(=O)COC(=O)[C@H]2CCCCN2S(C)(=O)=O)N(C)c2ccccc21	919243379	SEXYMPJPDGKKNC-QGZVFWFLSA-N	432.502	1.234	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCCS(=O)(=O)c2ccc(Cl)cc2)cc1OC	919785681	GZSUMBHNAWVTFF-UHFFFAOYSA-N	441.893	1.775	50	20	IDGD	
Cc1ccc(C)c(C(=O)c2ccccc2C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)c1	919889813	USOFPDBYBNQEKN-HNNXBMFYSA-N	429.498	1.666	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)NCc2cccc(NC(=O)[C@H]3CCCO3)c2)c1	920238105	QUGMXHLJBBYEMW-LJQANCHMSA-N	442.472	1.966	50	20	IDGD	
CCC(=O)N1CCCC[C@H]1C(=O)NNC(=O)c1ccc(CSc2nncn2C)cc1	920288517	WXSBRJCIEZKHKA-INIZCTEOSA-N	430.534	1.660	50	20	IDGD	
CCn1c(NNC(=O)c2cc3c(c(S(N)(=O)=O)c2)CCC3)nc2ccccc2c1=O	1323040277	ZVKXGYSGHHQLOT-UHFFFAOYSA-N	427.486	1.309	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)ccc1N1CCN(C)CC1	1337766687	PXOLAVBVFLRGBR-UHFFFAOYSA-N	445.545	1.617	50	20	IDGD	
O=C(c1cn2ccc(Cl)cc2n1)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1778057634	KZTLHMYMKFJANC-KSSFIOAISA-N	427.288	1.031	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2n[nH]c3c2CC[C@H]3C)C1	1778603759	AAMJBROVVKZFJT-CRKCHWSSSA-N	438.956	1.841	50	20	IDGD	
CC(C)Cc1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)n(C)n1	1779296346	PGSZWGWRYRVLIJ-OAQYLSRUSA-N	436.629	1.914	50	20	IDGD	
CN(C)C(=O)NCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@](C)(Cl)CCl)C1	1780706564	LDFRBHYZVAPMQF-FSPWUOQZSA-N	437.368	1.008	50	20	IDGD	
Cc1nc(N)sc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)Br)C1	1781998472	WOFDUQSFFWGVMR-GSDQYQHOSA-N	445.383	1.945	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)Cc2ccc(O)cn2)C1	1782635964	PLDRPJJSYRTZJO-MBOZVWFJSA-N	425.913	1.097	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc4c(c3)NC(=O)CC4)CCO2)C1	1783880648	GNZAPWAYNGRBAA-IERDGZPVSA-N	435.908	1.269	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccc(C3CC3)cc1)CCO2	1783934940	ODSVTVUBPZBQSW-HSZRJFAPSA-N	428.533	1.381	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/c3ccc(F)cc3F)C[C@@H]21)[C@@H](O)CCl	1784085406	IVDDOAPNGWXOIJ-FSIDXWPRSA-N	428.863	1.557	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)NC(=O)OC(C)(C)C)C[C@@H]21	1784620051	ICZMTQARILKECG-BWJWTDLKSA-N	447.960	1.217	50	20	IDGD	
C[C@H](Cn1cccn1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21	1785437729	OUOVTNPXMJKVRU-UGUYLWEFSA-N	427.343	1.284	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H]1C[C@H](C(=O)N2CC[C@]3(CN(C(=O)[C@H](F)Cl)CCO3)C2)C1	1785512662	ASMOGDICSFSKNW-WFTHSTBKSA-N	433.908	1.654	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccccc3O)C[C@@H]21	1786407256	LPRPNFNANIYHCG-ZOBUZTSGSA-N	425.323	1.699	50	20	IDGD	
Cn1cc(CCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Br)C[C@@H]32)cn1	1787012300	PIPZDNGCSBCYGA-RZLSGREXSA-N	431.306	1.023	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC1(c2ccc(NC(=O)c3nc4ccccn4n3)cc2)CCC1	1788404198	UTPYKAGFSAJMQF-UHFFFAOYSA-N	449.515	1.850	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21	1789871779	FJNXJDJTBZTJPA-ROKJBNPBSA-N	434.133	1.893	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3cccc(C#N)c3)C[C@@H]21	1791249913	UGDFWBBGYDOKGB-MUGJNUQGSA-N	433.936	1.724	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3occc3Br)C[C@@H]21	1791254977	YSVCMYYAMXNWBJ-IMIFBBOLSA-N	449.729	1.889	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CC[C@H]4CCC(=O)N4C3)C[C@@H]21)C(Cl)Cl	1791296773	ZVEGVOLQDINUSE-YTFOTSKYSA-N	432.348	1.171	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1ccc(C2(NC(=O)[C@H]3CCNC(=O)C3)CCC2)cc1	1791602664	YNLSXBKTSLYFJM-HNNXBMFYSA-N	429.521	1.020	50	20	IDGD	
COC1(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)CBr)C[C@@H]32)CCC1	1791849694	ZQPBOKOCWYYJMT-VGWMRTNUSA-N	431.371	1.956	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2)c1cc(=O)c2ccccc2o1	1792766730	JLHYYXFNECGPGE-CULMDFNYSA-N	425.268	1.800	50	20	IDGD	
CC(C)(C)OC(=O)NCCCCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2	1793634733	FSAJAVBWZJIVBD-XRGAULLZSA-N	435.924	1.805	50	20	IDGD	
Cc1cccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)c1Cl	1796190661	VXIGBVMDBPQZNM-BCDXTJNWSA-N	426.709	1.894	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2)c1ncsc1Br	1796493115	GYFCGSLEARWKME-PJFCORBGSA-N	426.695	1.643	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C(=O)c1ccco1)C2	1796890618	AYOUPRWENJTQCH-NGYDUSEUSA-N	425.445	1.235	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)Br)C3)o1	1797749852	WZIQRNOSVBHPRT-BTABJRDXSA-N	428.283	1.225	50	20	IDGD	
O=C(NC1(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](O)CCl)C3)CC1)OCc1ccccc1	1797854889	GEXWYQGWOUNFJO-MHORFTMASA-N	449.935	1.683	50	20	IDGD	
CCC[C@@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnccc1C(=O)NN)n1cccc1	1798440298	KODFEECKEYUAGQ-CLWJZODNSA-N	438.532	1.780	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(C(F)(F)F)nn1C	1798875505	RNYUPOZBVJYOCD-CLLJXQQHSA-N	444.458	1.064	50	20	IDGD	
O=C(Cc1n[nH]c2cc(Cl)ccc12)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2	1799078766	JQNYDZOROZJGGU-OBSGGCNASA-N	429.279	1.883	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CC(c2ccccc2)=NN1	1800158716	XTUVNQVWYZROKL-CNGORYIKSA-N	449.349	1.126	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2)[C@H]1Cc2[nH]nc(C(F)(F)F)c2C1	1800321660	XVBZPJJJOLWNGS-VIWFTRRCSA-N	438.809	1.267	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)nc(Cl)c1)C2	1800758283	RUUBFXJDWXNCOL-CBRVECNMSA-N	432.702	1.427	50	20	IDGD	
COc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)Br)c(F)c1	1800759965	UQLOLEJOFOZOIJ-LSSIXWDNSA-N	429.286	1.821	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](CC1CC1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2	1800903489	VQUBFXCIVFBRLD-YIDVYQOGSA-N	447.935	1.804	50	20	IDGD	
CN(C)c1cccc(OCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C(Cl)Cl)c1	1801016009	XALWQFBIOPSIAF-FVCICTRLSA-N	430.332	1.525	50	20	IDGD	
Cc1cnn([C@H](C)C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)CBr)C3)c1	1801335576	PTZLIPZMLWKCTM-NPJQDHAYSA-N	427.343	1.373	50	20	IDGD	
CC[C@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnccc1C(=O)NN)C2	1801802600	YQFHMLPZRJPAMC-OXIQGZBJSA-N	438.326	1.110	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H](CNC(=O)[C@H]2CCC(=O)NC2)[C@@H]1c1cccnc1	1802611310	SUFXWOWAGQYYPA-RPWFAHAXSA-N	441.359	1.850	50	20	IDGD	
CCO/C=C/C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN(C)NC(=O)NCc1ccccc1)C2	1802669888	MAPJTDZMBMYSIM-PODJEOQNSA-N	443.548	1.521	50	20	IDGD	
CN(C)C(=O)NCC(=O)NC[C@@H]1CCN(C(=O)CO[Si](C)(C)C)[C@H]1c1cccnc1	1802679259	HHNYQZRVAZPYGO-LPHOPBHVSA-N	435.601	1.210	50	20	IDGD	
COc1cc(CCC(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)ccn1	1803135721	GESVPCVQIOHMTL-OPYAIIAOSA-N	446.935	1.724	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1)c1ccc[n+]([O-])c1	1804778712	AECZIWWKZSFWQS-CRAIPNDOSA-N	433.306	1.820	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H](CNC(=O)c2ncnn2C)[C@@H]1c1cccnc1	1805281128	GKMMFVFILTUBHV-ILXRZTDVSA-N	435.326	1.703	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@@H](C(=O)N2CCC3(CCCN(C(=O)[C@@H](O)CCl)C3)CC2)C1	1805527875	FTGBCTBKVYIOCG-ZACQAIPSSA-N	428.957	1.797	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)Cc2cccs2)[C@H]1c1cccnc1	1807552317	SYBUKWRSKUALLB-VGOFRKELSA-N	443.573	1.765	50	20	IDGD	
CC(C)Cc1cc(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)n(C)n1	1807841435	DRDSCBVNDVSJJC-FFZOFVMBSA-N	447.967	1.933	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)[C@@H]1Cc2ccccc2CN1	1808235930	WNNNOFOEODNIGE-UWHLTILDSA-N	442.947	1.402	50	20	IDGD	
CC(=O)NC(C)(C)C(=O)N1CC[C@H](CNC(=O)[C@@H](F)Br)[C@@H]1c1cccnc1	1808649055	IZSOEYAFKGOYNZ-QLFBSQMISA-N	443.317	1.693	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)CCNC(=S)NC)[C@H]1c1cccnc1	1810314725	JNRZBTVTIKCNBV-YQQAZPJKSA-N	425.986	1.589	50	20	IDGD	
Cc1cnoc1C(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1811250586	SEOUXCDAKYWNRA-VQIMIIECSA-N	428.493	1.071	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)[C@H]2C[C@@H]2F)[C@@H]1c1cccnc1	1812476282	WAGNJVIXONUZGJ-VMULSPLHSA-N	440.479	1.579	50	20	IDGD	
CC(=O)NCCC(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)Br)[C@@H]1c1cccnc1	1812663373	JZIPOVINJFDEFA-ISTRZQFTSA-N	425.327	1.397	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2cc3cccnn3n2)[C@H]1c1cccnc1	1813030521	CXGOPFFERWQHAU-IEZWGBDMSA-N	442.907	1.698	50	20	IDGD	
CN1CCCn2nc(C(=O)N[C@@H]3CCc4nc(NC(=O)[C@H](F)Cl)sc4C3)cc2C1	1817133011	CNWXCVNZSQUFML-BMIGLBTASA-N	440.932	1.935	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@@H]2CCCS2)[nH]n1)c1ccc(B(O)O)cc1	1817475863	XAAPAEWBJICILB-SJORKVTESA-N	428.323	1.291	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)CN3CCN(C)CC3)sc2C1	1818804753	BMCYBJNPEWRQBC-NEPJUHHUSA-N	444.399	1.086	50	20	IDGD	
O=C1Nc2c(C(=O)Nc3cc([C@H]4CCCCN4C(=O)[C@H](O)CCl)[nH]n3)cccc2C1=O	1819193835	UAGMXGOTGLDBLG-ZIAGYGMSSA-N	445.863	1.450	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)C2=COCC2)[nH]n1	1819404190	CWBQYVWWMIBLIC-MRXNPFEDSA-N	425.449	1.018	50	20	IDGD	
Cc1cc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)ccc1O	1821096942	SLQGKXFJOQTQAE-IBGZPJMESA-N	448.288	1.723	50	20	IDGD	
N=C(N)SCCC(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1	1823002553	DQEZHMQYYISXAS-LDWIPMOCSA-N	438.348	1.762	50	20	IDGD	
COCC1(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1	1824480510	JSRFYZGSPJHYQU-HXUWFJFHSA-N	428.338	1.026	50	20	IDGD	
CCOC(=O)C1(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@@H](Cl)COC)CC3)CC1	1824869645	YBNPZDGVRLQNGL-MNOVXSKESA-N	429.926	1.652	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H]3CCCO3)sc2C1	1825580191	JZIKXFQAMRIGID-VXPFBLRFSA-N	444.517	1.368	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnn3ncccc13)CC2	1825997864	DELZFWCZFLXKJB-JQWIXIFHSA-N	434.909	1.665	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnn3cc(C)cnc13)CC2	1826000071	JZQXKPRSNGRLAO-DGCLKSJQSA-N	448.936	1.974	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](O)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H](F)Cl)CC1	1827615006	KCKYTRBPFSJDRS-SOUVJXGZSA-N	435.924	1.984	50	20	IDGD	
C/C=C/C(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)[C@H](O)CCl)C2)C1	1829269482	VDQIFRWXEPUMRF-AKBBZARKSA-N	449.935	1.614	50	20	IDGD	
CC(C)=NO[C@@H](C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1	1830416116	QNOPIEKAJHAAQW-LAUBAEHRSA-N	443.353	1.401	50	20	IDGD	
CN1CCCC[C@H]1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1	1830773025	OTYCXUOYVHFNDX-IPELMVKDSA-N	436.380	1.163	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@H](O)CCl)CC1	1831578707	SBRYIFHBKNXPQW-JKSUJKDBSA-N	431.961	1.731	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CN2C(=O)C=CC2=O)CC1	1831656020	DDNNDWVJBRBQHC-ZFWWWQNUSA-N	440.338	1.315	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3cc(C)no3)CCO2)C1	1832573762	PRUPFTVTKIITMK-QAPCUYQASA-N	444.326	1.155	50	20	IDGD	
CC[C@@H](NC(C)=O)C(=O)NC1CCN(C2CCN(C(=O)CO[Si](C)(C)C)CC2)CC1	1833098737	YFSWJKFSSYMWBH-LJQANCHMSA-N	440.661	1.324	50	20	IDGD	
N#Cc1cccc(CCC(=O)NC2CCN(C3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)c1	1833238118	ZPXLDVMZBYAPMH-NRFANRHFSA-N	446.979	1.662	50	20	IDGD	
Cc1cnc(Cl)c(C(=O)NC2CCN(C3CCN(C(=O)[C@H](O)CCl)CC3)CC2)c1	1834324726	QQNFOBDKDYAEPA-QGZVFWFLSA-N	443.375	1.828	50	20	IDGD	
Cc1noc(N)c1C(=O)NC1CCN(C2CCN(C(=O)CO[Si](C)(C)C)CC2)CC1	1834700676	MKDHJIQSXAGMRR-UHFFFAOYSA-N	437.617	1.602	50	20	IDGD	
Cc1c(F)cccc1C(=O)N1CCOC[C@@]2(CN(C(=O)CCBr)CCO2)C1	1834819561	HDAQEHXEMDBLFO-LJQANCHMSA-N	443.313	1.989	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccccc3)CCO2)C1	1834990893	TXRFEZVVEWCCOV-OXQOHEQNSA-N	439.350	1.717	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC1CCN(C2CCN(C(=O)CCn3cncn3)CC2)CC1	1835837355	DCCNELXHJJPECC-UHFFFAOYSA-N	436.633	1.091	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H]3CCCOC3)CC2)CC1)[C@H](F)Br	1836414404	JJWCEBNKAFVNNV-BBRMVZONSA-N	434.350	1.675	50	20	IDGD	
CCc1noc(C)c1C(=O)N1CCO[C@@]2(COCCN(C(=O)CCBr)C2)C1	1838054649	XPPHUZXDXXZGJR-GOSISDBHSA-N	444.326	1.400	50	20	IDGD	
CC[S@@](=O)CCC(=O)N1CCC(OC2CCN(C(=O)[C@@H](Cl)COC)CC2)CC1	1838363060	SVSMDZPTOQKOAS-YMGMXPECSA-N	437.002	1.398	50	20	IDGD	
COc1ccccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1838876805	IDTLEINSJZALPG-YJBOKZPZSA-N	445.285	1.456	50	20	IDGD	
COc1ncccc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2	1839151209	KVBJSPPDUNSYFU-OALUTQOASA-N	446.331	1.397	50	20	IDGD	
O=C(c1ccc(O)cc1F)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839201745	HZISFEJJQVIXPZ-YOEHRIQHSA-N	449.248	1.292	50	20	IDGD	
C=C(C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2)C(F)(F)F	1839203104	ZWRJUZWOYCMXFP-GXFFZTMASA-N	433.196	1.252	50	20	IDGD	
O=C(c1cc(O)ccc1F)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1839295950	AKNSIKROVJIGRT-RHSMWYFYSA-N	449.248	1.292	50	20	IDGD	
O=C(c1cnn2cccc(F)c12)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1839620724	RHOUAYJUYHBEOU-SFHVURJKSA-N	445.278	1.347	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3c[nH]c(C)c3)C2)C1	1839964160	ITJFGCCHHAVXMM-YJBOKZPZSA-N	428.327	1.567	50	20	IDGD	
O=C(c1c(F)ccc(O)c1F)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840189157	ARFOLPXNCOBAAM-KRWDZBQOSA-N	439.242	1.544	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)CC[C@H]3CCOC3)CCO2)C1	1840585155	AITHNGOHRPBKDT-JTDSTZFVSA-N	447.370	1.291	50	20	IDGD	
COC1(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)CCC1	1840616954	IGPAATOWYTUQMT-WMLDXEAASA-N	437.306	1.093	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2ccc(F)c(C)c2N)C1	1842989150	XIXAOUUDSCFJLQ-VULFUBBASA-N	440.479	1.667	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)c1cnc(C)cn1)C2	1844692156	NXTDQQQGTXJXFQ-UHFFFAOYSA-N	439.428	1.749	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](CO)NC(=O)OC(C)(C)C	1847498213	DHMNGVXGDZAVLL-XUXIUFHCSA-N	448.358	1.105	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc(=O)nc2sccn12	1847498550	IKPKLMUZKOABTE-SRVKXCTJSA-N	439.335	1.602	50	20	IDGD	
O=C(NC1(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](O)CCl)CC1)OCc1ccccc1	1847558353	CEUVNHRWVVIDFY-YESZJQIVSA-N	435.908	1.247	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CN1CCC(C)CC1	1847709478	ALOWKJVAFFGXEB-YCNOHHLFSA-N	428.537	1.054	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H]1C[C@H](O)CN1C(=O)OC(C)(C)C	1847869704	UXUGASMVTADSNZ-WOYTXXSLSA-N	443.972	1.966	50	20	IDGD	
Cc1nc(COc2ccc(C(=O)NNC(=O)c3nn(-c4ccccc4)cc3O)cc2)no1	11676978	ZGGXTDBIECQWEZ-UHFFFAOYSA-N	434.412	1.923	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1C	28030256	OPWCUVOXWZHBSF-UHFFFAOYSA-N	437.543	1.715	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)[C@@H](c1ccccc1)N1CCN(C)CC1	727765412	ZULIOJSUGAQZRH-JOCHJYFZSA-N	426.517	1.600	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(C(=O)N(C)C)cc2)c1	728187194	AEGICVPNDPHOJF-UHFFFAOYSA-N	446.529	1.494	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2ccc(NNC(=O)Cn3cccn3)c([N+](=O)[O-])c2)cc1	729295327	XISVLGRQJLQCFY-UHFFFAOYSA-N	446.445	1.744	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NCc2ccc(CN3CCC(O)CC3)cc2)cc1	729621586	PDUHLEGSOATDDM-UHFFFAOYSA-N	442.516	1.561	50	20	IDGD	
Cc1ccccc1OCCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	729622313	XXIWOADWGKCDDU-UHFFFAOYSA-N	434.518	1.658	50	20	IDGD	
O=C(NNC(=O)c1c[nH]c2ccccc12)c1c(F)ccc(S(=O)(=O)NC2CC2)c1F	729836451	CGPJJSNVOYNUPW-UHFFFAOYSA-N	434.424	1.962	50	20	IDGD	
CC(C)(C(=O)NNC(=O)CCNS(=O)(=O)c1cccc([N+](=O)[O-])c1)c1ccccc1	731201794	RVBKSRGCBVAPIT-UHFFFAOYSA-N	434.474	1.388	50	20	IDGD	
CC(C)(C(=O)NNC(=O)N1CCN(c2ccc(S(N)(=O)=O)cc2)CC1)c1ccccc1	731221569	DYQBEVYTKWFJOT-UHFFFAOYSA-N	445.545	1.175	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)N1CCN(S(=O)(=O)c2c(C)c(C)c(C)c(C)c2C)CC1	731848510	GDIYVDBXMARSFW-GOSISDBHSA-N	438.594	1.481	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Cc2c(C)[nH]c3ccnn3c2=O)cc1Br	732033614	LVDUCDQXDZFFBL-UHFFFAOYSA-N	434.250	1.106	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)N1CCN(C(=O)c2ccccc2OC(F)F)CC1	732196361	FOYYIPODHRSHJE-AWEZNQCLSA-N	426.464	1.628	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)CCNC(=O)N2CCc3ccccc3C2)c1	732264976	KZPAVXKLJGTBRL-UHFFFAOYSA-N	426.473	1.623	50	20	IDGD	
CNS(=O)(=O)[C@H]1CCCN(C(=O)NNC(=O)c2ccc(COc3ccccc3)o2)C1	733335841	FBNKZBOIBRSGNK-INIZCTEOSA-N	436.490	1.227	50	20	IDGD	
COc1ccc(-c2nnc(S)n2CC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1	733364180	HYDRGSUGWYMETP-UHFFFAOYSA-N	449.496	1.889	50	20	IDGD	
Cc1nn(CCCl)c(C)c1C(=O)Nc1ccc(N2CCN(S(C)(=O)=O)CC2)nc1	733934963	OWHBVINHTQYKSM-UHFFFAOYSA-N	440.957	1.468	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)c2cc(S(=O)(=O)N3CCCCC3)ccc2Cl)cn1	735444436	KPAOQSCNPUIEIE-UHFFFAOYSA-N	425.898	1.323	50	20	IDGD	
CCc1nc(C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)nn1-c1ccccc1	735462384	XDZKLRUKRTXBPJ-UHFFFAOYSA-N	441.517	1.506	50	20	IDGD	
C[C@@H](CN1CCN(c2ccccn2)CC1)NC(=O)NNC(=O)c1ccc2ccccc2n1	735520022	XVQNZOMXPUNNOX-KRWDZBQOSA-N	433.516	1.785	50	20	IDGD	
CC[C@H](COC)NC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	739049607	QOHYUSWPAHNCAT-GFCCVEGCSA-N	426.520	1.918	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cccc(CN(C)C)c2)c1	741277133	MYLBMUIPKVBJFC-UHFFFAOYSA-N	432.546	1.854	50	20	IDGD	
CC(C)NC(=O)C(=O)NNC(=O)c1nn(-c2cccc(Br)c2)c2c1CCC2	741662504	OVQVIBGBQDEBAU-UHFFFAOYSA-N	434.294	1.409	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H]1CC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	742535373	QKURIUJACHVANY-CQSZACIVSA-N	425.507	1.641	50	20	IDGD	
O=C(CCN1C(=O)[C@H]2[C@H](C1=O)[C@H]1CC[C@H]2O1)NNc1nc(-c2ccc(Cl)cc2)no1	742668640	AUCTYRWQSUPYKS-QHSBEEBCSA-N	431.836	1.386	50	20	IDGD	
CCN(CC)CCN1C(=O)C(=NNC(=O)c2nn(C)c(=O)c3ccccc23)c2ccccc21	744738770	KUPHTFVXAKEOHG-UHFFFAOYSA-N	446.511	1.756	50	20	IDGD	
CCc1nc(C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)nn1-c1ccccc1F	745239928	RCXJOYRBQHSFBB-UHFFFAOYSA-N	436.403	1.458	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)N[C@@H]2[C@@H]3CCCO[C@H]3C2(C)C)nc1	745859916	HEIXCEMFKKZZHX-USXIJHARSA-N	425.555	1.942	50	20	IDGD	
Cc1cc(=O)c(C(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)c[nH]1	746110795	QXYYWXBYGQUOCF-UHFFFAOYSA-N	429.440	1.460	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2ccc(Br)nc2)ccc1Cl	746576015	DPUROUVBTWACLY-UHFFFAOYSA-N	433.671	1.220	50	20	IDGD	
Cn1ccnc(NNC(=O)c2cccc(S(=O)(=O)N3CCc4ccccc43)c2)c1=O	747941638	MDKHGUGODJNDSI-UHFFFAOYSA-N	425.470	1.289	50	20	IDGD	
Cc1ccsc1[C@@H]1C[C@H]1C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	747975395	LLGDFBWAGYZNGI-QZTJIDSGSA-N	426.542	1.765	50	20	IDGD	
C[C@H](c1ccncc1)N1CCC(NC(=O)NNC(=O)[C@H]2COc3ccccc3O2)CC1	748020462	HPIYAQQYSZUQDM-FOIQADDNSA-N	425.489	1.777	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)N[C@H]1CCN(c2ccc(C(F)(F)F)cc2)C1=O	748635888	SPIKHEDSPJYINQ-RISCZKNCSA-N	432.399	1.193	50	20	IDGD	
Cc1cc(Br)ccc1NNC(=O)CCn1cnc2c1c(=O)n(C)c(=O)n2C	748748647	OVWMMKUMWMYFRB-UHFFFAOYSA-N	435.282	1.038	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN1C(=O)c1ccc2c(c1)OCO2)c1cc(Br)c[nH]1	749562519	KCXZWWKKYQEOEZ-ZDUSSCGKSA-N	449.261	1.572	50	20	IDGD	
O=C(NNC(=O)[C@@H]1OCCc2ccccc21)c1ccc(S(=O)(=O)N2CCCC2)cc1	750054770	NTKZJGREMOMVFO-LJQANCHMSA-N	429.498	1.546	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)CN2CCCN(C(=O)CCc3ccccc3)CC2)cc1	751481381	CWTIOUSZJTZZCQ-UHFFFAOYSA-N	433.512	1.486	50	20	IDGD	
COC(=O)c1cc2c(cc1NC(=O)C(=O)NNC(=O)c1cc3c(s1)CCC3)OCO2	753840391	JOBLJVKEFHSHKX-UHFFFAOYSA-N	431.426	1.152	50	20	IDGD	
CCc1c(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cnn1CCC(C)C	756165514	XLFOLAAQKKSNCM-SFHVURJKSA-N	429.477	1.418	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)NNC(=O)c1ccc(Cl)nc1	756673911	BDVIINWQKGWCJM-UHFFFAOYSA-N	441.897	1.851	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)Nc2cnn(CC(=O)N3C[C@@H](C)O[C@H](C)C3)c2)cc1	756836680	CTRWUBDYAWBIPP-HUUCEWRRSA-N	428.493	1.548	50	20	IDGD	
O=C(CCc1ccccc1)NNC(=O)Nc1ccccc1OCC(=O)N1CCOCC1	756874097	NIWWEHITXYFQOS-UHFFFAOYSA-N	426.473	1.710	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N1CCO[C@H]([C@H]2CCCO2)C1	756916592	RKQVTAMETXOENN-MAZHCROVSA-N	442.310	1.837	50	20	IDGD	
CCS(=O)(=O)c1ccc(CCC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1	756971608	CEWVRSDJFVMLCC-UHFFFAOYSA-N	445.545	1.267	50	20	IDGD	
Cc1cc(=O)c(C(=O)NNc2ccc(C(N)=O)nn2)nn1-c1ccccc1C(F)(F)F	757402732	OQAUHMNXJIYGSQ-UHFFFAOYSA-N	433.350	1.206	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H]2CN(C3CC3)C[C@@H]2C)c1	757790156	ALRYUYXZLOPLNU-KBXCAEBGSA-N	437.566	1.144	50	20	IDGD	
CC(C)n1ncc2cc(C(=O)N3CCN(S(=O)(=O)CBr)CC3)cnc21	758534489	HKAKEYPQXDAYDV-UHFFFAOYSA-N	430.328	1.452	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)COc1ccc(Br)cc1)CC1(C)OCCO1	758851200	DLCQEOFNMBZWBA-GFCCVEGCSA-N	430.299	1.948	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)CN1C(=O)N[C@](C)(c2ccccc2)C1=O	761634654	ZMDDELPLYNHXMV-OAQYLSRUSA-N	442.497	1.402	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)Cc1c(C)nc(-c2ncccn2)nc1O	762362128	URBBAWWUCCLYFO-UHFFFAOYSA-N	440.485	1.438	50	20	IDGD	
C[C@@H](O)c1cn(CC(=O)NNC(=O)[C@@H]2Cc3ccccc3CN2Cc2ccccc2)nn1	763032959	PHMNUYMNXHWUJX-IERDGZPVSA-N	434.500	1.106	50	20	IDGD	
O=S(=O)(CBr)N1CCN(S(=O)(=O)c2cc(F)c(F)cc2F)CC1	763206630	QVOUWLXPTGLWRZ-UHFFFAOYSA-N	437.259	1.092	50	20	IDGD	
O=C(NNC(=O)c1c[nH]c2ccccc12)C(=O)Nc1cccn(Cc2ccccc2)c1=O	763540090	QQOHOAGBQFXRNP-UHFFFAOYSA-N	429.436	1.778	50	20	IDGD	
CCOC(=O)c1cc(CC)sc1NC(=O)C(=O)NNC(=O)[C@@H]1COc2ccccc2O1	763573880	VTRVQXJSKHHOLE-HNNXBMFYSA-N	447.469	1.413	50	20	IDGD	
COc1cc2nc(C)sc2cc1NC(=O)C(=O)NNC(=O)COc1ccccc1OC	763658378	WCHKLCDYHBRAOL-UHFFFAOYSA-N	444.469	1.787	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(F)ccc1OC(F)F	763664728	ZEFQNOHKKPXEFQ-UHFFFAOYSA-N	427.335	1.601	50	20	IDGD	
CCOC(=O)c1ccsc1NC(=O)C(=O)NNC(=O)COc1ccc(Cl)cc1	763684421	LEZZEVNGJYOQHZ-UHFFFAOYSA-N	425.850	1.743	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccc(Br)cc2)ccc1N(C)C	763693259	DJRXHGNXPYZTND-UHFFFAOYSA-N	449.305	1.988	50	20	IDGD	
CCn1cnnc1-c1ccccc1NC(=O)C(=O)NNC(=O)CN1CCCc2ccccc21	763745260	BJSJPULZCXPMMV-UHFFFAOYSA-N	447.499	1.504	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)ccc1N1CCSCC1	763837598	JIRIILOYIMTZNE-UHFFFAOYSA-N	446.504	1.852	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccc(N2CCOC[C@H]2C)cc1	763865180	JEEMDTLHRPVGET-HUUCEWRRSA-N	444.463	1.604	50	20	IDGD	
CC(C)CC(=O)NNC(=O)C(=O)Nc1cnc2c(c1)C[C@@H](NC(=O)OC(C)(C)C)CC2	763886419	XQDUMPBYNKYUFE-AWEZNQCLSA-N	433.509	1.596	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ccc(OC(C)C)c(OC)c2)cn1C	763921211	JGNLWRHKYXFNGD-UHFFFAOYSA-N	432.433	1.007	50	20	IDGD	
CC(C)CCn1ccc(NC(=O)C(=O)NNC(=O)c2cc(Br)cn2C)n1	764002590	OIGRHGWLCNYJLS-UHFFFAOYSA-N	425.287	1.430	50	20	IDGD	
Cc1cc(Br)ncc1NC(=O)C(=O)NNC(=O)c1ccc2c(c1)OCCO2	764005552	AIHUVSOAUZJKGP-UHFFFAOYSA-N	435.234	1.323	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1ccc(C(=O)NC(C)C)cc1	764012546	SPCXZSLTPHPVCG-UHFFFAOYSA-N	432.864	1.887	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2cccc(CCN3CCCC3)c2)c1O	764130393	GQGZDUGOBWCYGI-UHFFFAOYSA-N	426.473	1.439	50	20	IDGD	
Cn1nccc1NC(=O)C(=O)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1	764178519	CEJRSTDNAYFCCS-IBGZPJMESA-N	432.484	1.133	50	20	IDGD	
CN(C)CC(=O)NNC(=O)C(=O)Nc1ccc(Oc2cccc(C(F)(F)F)n2)cc1	764204381	SZPAEQPYEXXWRS-UHFFFAOYSA-N	425.367	1.540	50	20	IDGD	
COCCOc1ncccc1NC(=O)C(=O)NNC(=O)c1c(Cl)cccc1Cl	764221565	UGWKKRFRYNZLBH-UHFFFAOYSA-N	427.244	1.813	50	20	IDGD	
CC(C)Sc1ccccc1NC(=O)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	764266533	MCZZQOPTMTURFV-UHFFFAOYSA-N	442.545	1.980	50	20	IDGD	
O=C(Cc1ccccn1)NNC(=O)C(=O)Nc1ccnn1Cc1cccc(Cl)c1Cl	764271144	WQPGJEUDDPMETK-UHFFFAOYSA-N	447.282	1.962	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)Cc2cc[nH]n2)cc1NC(=O)OC(C)(C)C	764294124	VJUQCOMOROGHPX-UHFFFAOYSA-N	432.437	1.094	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)C(=O)N(CC1CC1)C2=O)c1ccccc1	764328360	DVPDEUFDLPFOSX-KRWDZBQOSA-N	448.479	1.972	50	20	IDGD	
CCN1CCC[C@H]1CN1C[C@@H](C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)CC1=O	764332942	BISXGAOWVDXOMU-HOCLYGCPSA-N	449.502	1.633	50	20	IDGD	
O=C(CCCc1cccs1)NNC(=O)C(=O)Nc1ccc(C(=O)N2CCOCC2)cc1	764342041	STNWPAJHGYXSQD-UHFFFAOYSA-N	444.513	1.329	50	20	IDGD	
COC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)c1	764389073	XTARVXFJALEXFF-UHFFFAOYSA-N	425.376	1.402	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1cccc(C(=O)NC2CC2)c1	764393257	FFULNWHSYKVQPX-UHFFFAOYSA-N	442.497	1.466	50	20	IDGD	
CC(C)(C)c1ncc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)s1	765735092	HOYLCJARGNJIHK-UHFFFAOYSA-N	429.546	1.660	50	20	IDGD	
O=C(CCc1nc2ccccc2[nH]1)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765738533	LCEUNWDXIQQWIW-UHFFFAOYSA-N	434.500	1.101	50	20	IDGD	
O=C(NNC(=O)N1CCC([C@H](O)C(F)(F)F)CC1)C1CCN(c2ncccn2)CC1	765751558	NFYWLLNCVYFQMT-AWEZNQCLSA-N	430.431	1.069	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)C=C2CN(C(=O)OC(C)(C)C)C2)cc1OC	766147040	WIELBRUSGGNWKH-UHFFFAOYSA-N	449.460	1.185	50	20	IDGD	
Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C(=O)NNC(=O)CN1CCCc2ccccc21	766259115	PPMGKUZNUVILMR-UHFFFAOYSA-N	425.445	1.750	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNc2nccnc2OC)ccc1NC(=O)OC(C)(C)C	766261664	GJUHXZWGSYKOQU-UHFFFAOYSA-N	432.437	1.923	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)CN1C(=O)CCOc2ccccc21	767273868	KPWZOOKRKCBXLT-UHFFFAOYSA-N	425.441	1.044	50	20	IDGD	
Cc1ccc(-c2n[nH]c(SCC(=O)OCC(=O)NNC(=O)c3cccs3)n2)cc1	767419648	OYBZICFXVSFIRI-UHFFFAOYSA-N	431.499	1.938	50	20	IDGD	
CC(=O)Nc1ccc(Cl)c(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)c1	767821560	CJRXOEJXSXQMKV-UHFFFAOYSA-N	445.284	1.674	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](OCC(=O)OCC(=O)NNC(=O)c2cccs2)C1	768067644	ZUGMQJAXXDIIHV-CYBMUJFWSA-N	441.506	1.468	50	20	IDGD	
CCOc1cccc(-c2nnc(SCC(=O)NNC(=O)c3ccc(F)cc3)n2N)c1	768422214	DWVJYRJYNMOROP-UHFFFAOYSA-N	430.465	1.750	50	20	IDGD	
CO[C@@H](CNC(=O)OC(C)(C)C)CC(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	769845084	DLZWZZFFNAVNEX-CQSZACIVSA-N	433.465	1.269	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N(C)C)nc2)c(C)n1-c1ccccc1	770209253	NQZFRDBYWYSVPF-UHFFFAOYSA-N	441.513	1.814	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)c1ccc(S(=O)(=O)N(C)C)nc1	770209497	UUYKDOGNISVYTQ-CQSZACIVSA-N	442.497	1.714	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)cc1S(N)(=O)=O	770483833	HLNGIBONGCECRX-NSHDSACASA-N	426.882	1.916	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)c1ccc(Cl)c(S(=O)(=O)N(C)C)c1	771941461	SIFBSFKODCSXTF-LLVKDONJSA-N	433.914	1.329	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)[C@H](c1ccccc1F)N1CCOCC1	772898273	OYOVEBFIRYOLTG-SFHVURJKSA-N	448.882	1.316	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)C(=O)Nc1ccc2c(c1)CCC(=O)N2CC1CC1	773496012	JAZBDSYLZBOBMT-UHFFFAOYSA-N	438.459	1.844	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1cc(I)ccc1C	773502728	YQWDONCREJRSSX-UHFFFAOYSA-N	427.202	1.480	50	20	IDGD	
CS(=O)(=O)Nc1ccc(OCCNC(=O)NNc2ccccc2S(C)(=O)=O)cc1	773784763	IEZLNBSBUJEORL-UHFFFAOYSA-N	442.519	1.167	50	20	IDGD	
Cc1nn(C)c2ncc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc3cccc(Cl)c3)cc12	774003514	WPLSMHCIGSBLAK-NSHDSACASA-N	430.852	1.484	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)NCc2ccc(S(N)(=O)=O)c(C)c2)c2ccccc2n1	775227271	YZRLJCOYBBNQNO-UHFFFAOYSA-N	427.486	1.643	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NC[C@@H]1COC2(CCCCC2)O1	775715215	UNGZRUPRVDMCLU-CQSZACIVSA-N	439.538	1.308	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCS(=O)(=O)c2ccccc2C1	775885852	CWTQUYQFZYRYPG-UHFFFAOYSA-N	437.905	1.399	50	20	IDGD	
COc1ccc(Cn2cc(C(=O)NNC(=O)COc3ccccc3O)cn2)cc1OC	778766632	VVSOKZWDBZQBHL-UHFFFAOYSA-N	426.429	1.494	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)[C@@H](O)[C@@H](O)c3nc4ccccc4s3)nc21	779518345	WYWYBFIIOLFUMC-QWHCGFSZSA-N	443.489	1.434	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2ccc(C#N)cc2Cl)c1	779829185	FTRUUDWEJSPPIW-UHFFFAOYSA-N	442.906	1.085	50	20	IDGD	
O=C(NN=c1cc[nH]cc1)C(=O)Nc1cccc(CS(=O)(=O)c2ccc(F)cc2F)c1	783378326	FVPHYJUQRWRAFG-UHFFFAOYSA-N	446.435	1.837	50	20	IDGD	
Cc1ccccc1NC(=O)NNC(=O)C(=O)Nc1ccc2oc(=O)n(CCN(C)C)c2c1	783411547	SFURCKDMQFCORA-UHFFFAOYSA-N	440.460	1.256	50	20	IDGD	
O=C(CCSc1ccc(F)cc1)NNC(=O)[C@H]1CC=CC[C@@H]1C(=O)N1CCOCC1	784297222	VJTLXBBDOKDNJF-ROUUACIJSA-N	435.521	1.897	50	20	IDGD	
CCOC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)cc1C#N	785067275	JFFCXACCXNJNBM-UHFFFAOYSA-N	449.427	1.103	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccc(OC)cc2)c1)[C@@H](C)O	790070488	UMADUDIMLSDJTO-ACJLOTCBSA-N	435.502	1.664	50	20	IDGD	
CC(C)(C)n1cc(C(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)nn1	790254273	OYVGTUFUSJBDAH-UHFFFAOYSA-N	445.487	1.810	50	20	IDGD	
O=C(NNc1nc2ccccn2n1)C(=O)Nc1ccc(F)cc1I	792395216	QXSBFJAMIFZCAK-UHFFFAOYSA-N	440.176	1.555	50	20	IDGD	
CS(=O)(=O)C[C@H](NC(=O)NNC(=O)CNC(=O)OCc1ccccc1)c1ccccc1	793137923	RPPAHUWDXSTTRX-KRWDZBQOSA-N	448.501	1.029	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2ccc(OC(C)C)c(OC)c2)cnc1C	793351361	WRWCXPAPESHPEH-UHFFFAOYSA-N	437.474	1.596	50	20	IDGD	
CCOC(=O)c1ccc(OC)c(S(=O)(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c1	795325877	QIDPPNFGZDUTKS-UHFFFAOYSA-N	444.469	1.681	50	20	IDGD	
COC(=O)[C@H]1CC[C@H](C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)CC1	797786685	HMYXXDMOWQGYNY-SHTZXODSSA-N	437.518	1.212	50	20	IDGD	
C[S@@](=O)c1ccc(CC(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)cc1	797903160	AHZFLQZDBNIOFD-MUUNZHRXSA-N	437.543	1.131	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CO[C@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1C	798309025	FSIWXBWOUAJZNU-KRWDZBQOSA-N	448.520	1.805	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)c(C)c(OC)c1	800634657	NASXELKYNDGXFH-LPHOPBHVSA-N	427.457	1.671	50	20	IDGD	
O=C(CN1CCN(c2cncc3ccccc23)CC1)NNC(=O)c1ccc([N+](=O)[O-])cc1	801949625	PUTZXOOTQDQRFM-UHFFFAOYSA-N	434.456	1.726	50	20	IDGD	
Cc1nn(C)c(-n2ccnc2C)c1C(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	802068037	XHVCQYBUOLRFEW-UHFFFAOYSA-N	431.478	1.093	50	20	IDGD	
COC(=O)c1c(F)cc(NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)cc1F	802566210	DUSCGBGIEQMWDG-UHFFFAOYSA-N	427.747	1.510	50	20	IDGD	
O=C(CCc1ccco1)NNC(=O)C(=O)Nc1ccc(NC(=O)CC(F)(F)F)cc1	802567029	LHCZNSVLBMALKV-UHFFFAOYSA-N	426.351	1.889	50	20	IDGD	
COc1ccc(S(C)(=O)=O)cc1S(=O)(=O)NNC(=O)c1cc(C)nc2ccccc12	802719977	ABYADJDNQYQPIW-UHFFFAOYSA-N	449.510	1.579	50	20	IDGD	
O=C(NNC(=O)C(=O)NC1CC1)C(=O)Nc1nc(CC23CC4CC(CC(C4)C2)C3)cs1	806993478	AFQYSXKFAFZAFB-UHFFFAOYSA-N	445.545	1.267	50	20	IDGD	
Cc1nc(S(=O)(=O)NNC(=O)c2cccc(OC(F)F)c2)c(Br)n1C	808089030	OOSBIDQIDLETOP-UHFFFAOYSA-N	439.238	1.716	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(Cl)cc1)NNC(=O)c1cccc(OC(F)F)c1	810344106	FDJHVWJEQZPUKY-UHFFFAOYSA-N	433.820	1.681	50	20	IDGD	
CC(=NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1cccc(CN(C)C)c1	814688953	QFQHREYYFJDPSV-UHFFFAOYSA-N	444.557	1.923	50	20	IDGD	
COC(=O)C(C)(C)CC=NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	814710297	LVPWLAQXLGESRF-UHFFFAOYSA-N	439.534	1.331	50	20	IDGD	
CCOCCCn1c(NNC(=O)c2cc(Cn3cccn3)on2)nc2ccccc2c1=O	815604714	YZMWADBKNIRLMR-UHFFFAOYSA-N	437.460	1.813	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccn(-c3ccc(Br)cc3)n2)n1	815630832	YWMLESYNYSBXAO-UHFFFAOYSA-N	443.261	1.738	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(Br)c(C(=O)NNc2ncncc2F)c1	817078506	HXMNXRJMUUIUJP-UHFFFAOYSA-N	448.274	1.060	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)[C@H]2CCCN2S(=O)(=O)c2ccc(C)s2)c1	887572973	ILHPDDMHZXJKLD-MRXNPFEDSA-N	437.543	1.744	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NNC(=O)COc2ccc(F)cc2)s1	894928018	ZENRDIPWERKDJI-HNNXBMFYSA-N	441.506	1.575	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)CSCC(=O)N1CCOCC1	912601279	MOEGYZJTLKHDBT-HNNXBMFYSA-N	431.514	1.347	50	20	IDGD	
O=C(NCCNS(=O)(=O)c1cccc(Cl)c1)NNC(=O)c1c[nH]c2ccccc12	914539312	PVEOEUNRJWCNMG-UHFFFAOYSA-N	435.893	1.744	50	20	IDGD	
O=C(NNC(=O)C1CCCC1)c1cccc(S(=O)(=O)NCc2ccc3c(c2)OCO3)c1	914848852	FEDKJSXDWIXAIR-UHFFFAOYSA-N	445.497	1.845	50	20	IDGD	
CS(=O)(=O)N1CCC[C@H]1C(=O)NNC(=O)c1cc(-c2ccco2)nc2ccccc12	915188428	MWAUETYLQRQJSR-KRWDZBQOSA-N	428.470	1.680	50	20	IDGD	
Cc1c(/C=C(\C#N)C(=O)N2CCN(c3ccc(S(N)(=O)=O)cc3)CC2)cc(C#N)n1C	915290841	YIWKKFYJMSSFMT-GZTJUZNOSA-N	438.513	1.108	50	20	IDGD	
CSCC[C@H](NC(=O)NNC(=O)c1ccc2c(c1)OCCO2)c1nnc2ccccn12	916223977	RRUBHMOYSCFYIU-AWEZNQCLSA-N	442.501	1.939	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C2CCN(C(=O)CCOc3ccccc3)CC2)n1	917392155	SBRGJURXRUKMAW-UHFFFAOYSA-N	427.505	1.355	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1cccc(NC(=O)NC2CC2)c1	917520965	GQXUMHFSEHUSDK-UHFFFAOYSA-N	444.517	1.647	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNS(=O)(=O)c2cc(C(=O)O)ccc2F)cc1	918063222	JHNINTDVAHITRE-NSHDSACASA-N	426.422	1.700	50	20	IDGD	
O=C(CCc1ncc(-c2ccccc2Cl)o1)NNC(=O)N[C@H]1CCS(=O)(=O)C1	919889698	RREKHSAXXAXOML-NSHDSACASA-N	426.882	1.445	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)Nc1ccc(N2CCN(C)CC2)cc1C	920930871	SXXWOYYKJVCVDA-UHFFFAOYSA-N	427.505	1.987	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)[C@H]2CC(=O)N(Cc3ccccn3)C2)CC1	1116088705	QVRIYBONJDGQPP-INIZCTEOSA-N	445.520	1.225	50	20	IDGD	
COCCn1cc(NC(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)ccc1=O	1116585841	LOBUOVZZPRHLFU-UHFFFAOYSA-N	440.460	1.252	50	20	IDGD	
Cc1ncc(Br)c(C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)n1	1116736768	BXOSBVAOLIFGSK-UHFFFAOYSA-N	426.296	1.745	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)C(C)(C)Oc2ccccc2)CC1	1252256960	YRYKUJWOMNCDMX-UHFFFAOYSA-N	433.534	1.318	50	20	IDGD	
O=C(Cc1c[nH]c2cnccc12)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	1261241363	HQQXAYPRABBZRE-UHFFFAOYSA-N	440.935	1.724	50	20	IDGD	
C[C@H](C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1)c1ccc(F)c(F)c1	1318764285	HRBCDAPWHDJYNN-ZDUSSCGKSA-N	439.488	1.543	50	20	IDGD	
CN1CCN(Cc2cccc(CNC(=O)NNc3ccccc3S(C)(=O)=O)c2)CC1	1323989257	CYOMSNSLEGHRAK-UHFFFAOYSA-N	431.562	1.664	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2c(F)ccc(S(=O)(=O)NC3CC3)c2F)cc1	1326764097	WCSBVDIFUJRTJM-UHFFFAOYSA-N	425.413	1.489	50	20	IDGD	
CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)NNC(=O)c1n[nH]c2c1CCCC2	1339945328	GGLVGZFKRKOPEO-GOSISDBHSA-N	426.452	1.417	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc3n[nH]cc3c2)C1	1777863703	JCUCCANFLCYNJX-HGHGUNKESA-N	434.924	1.944	50	20	IDGD	
COC(=O)C12CCC(C(=O)N3CC[C@]4(CN(C(=O)[C@@H](F)Cl)CCO4)C3)(CC1)CC2	1778303222	QMPUNFILACBMRG-CKIVDRAYSA-N	430.904	1.864	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnc3ncccn23)C1	1778653455	SMCRKUGNULKOIA-DYESRHJHSA-N	445.596	1.708	50	20	IDGD	
COc1cccc(CCC(=O)N2CCO[C@@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)n1	1779293789	BYMKWIJERILLGI-OAQYLSRUSA-N	435.597	1.704	50	20	IDGD	
COc1ccc([C@H](O)C(=O)N2CCO[C@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)cc1	1779294861	QLEROKVHFDBUFY-FPOVZHCZSA-N	436.581	1.410	50	20	IDGD	
COCCn1nccc1C(=O)N1CCO[C@]2(CCN(C(=O)[C@@](C)(Cl)CCl)C2)C1	1781229957	NGBMBJJDESGDIB-ZWKOTPCHSA-N	433.336	1.209	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cncnc1)C2	1781900879	XACSJGDAOBKYAX-HDMKZQKVSA-N	425.327	1.778	50	20	IDGD	
CC[C@H](NC(C)=O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)Br)C1	1781995532	OXVDVANMEYBMCX-MJXUCMMTSA-N	432.359	1.198	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1cnn(C)c1)C2	1782002193	OAEBJJCVXLRFRS-DDUZABMNSA-N	427.343	1.260	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1nc3ccccc3[nH]1)C2	1782172753	NBPMVQNBMBTDSG-AVBTWRTFSA-N	434.924	1.944	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cccc4nccn34)C2)C1	1782362935	DRMPQARTVPJLJI-LIRRHRJNSA-N	435.322	1.951	50	20	IDGD	
CC/C=C(\C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnccc1C(=O)NN)C2	1782837962	QCPCAHWHAIUTHY-FDNMTVOUSA-N	429.521	1.169	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(C)nn3CC)CCO2)C1	1783343355	UPIRFAQJWZSQHM-KSSFIOAISA-N	427.343	1.828	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cn(C(C)(C)C)nn3)CCO2)C1	1783351871	MQTRGIWZMSXUJV-FZKQIMNGSA-N	442.358	1.650	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)COc3ccccc3OC)[C@H]2C1	1783779064	QSUVKOIKVRJHEQ-FPXQBCRKSA-N	440.924	1.308	50	20	IDGD	
Cc1cc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]3C2)n[nH]1	1783967850	YMLYUOGMMMSCBT-XTBFLFJDSA-N	427.343	1.271	50	20	IDGD	
COC(=O)c1ccc(CC(=O)N2CC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)cc1	1784160349	HZPMQQCSBIESBG-LJQANCHMSA-N	429.300	1.649	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3[nH]nc4ccncc34)C[C@@H]21	1786406145	UMFCNNYWNZFTPH-WHOFXGATSA-N	436.310	1.336	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)[C@@H](O)c3ccco3)CCC2)cc1)c1ccc(B(O)O)cc1	1788140048	FSVHTGAARPTTOZ-FQEVSTJZSA-N	434.257	1.441	50	20	IDGD	
O=C(NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1)C(=O)c1ccccc1	1788145900	CNGMKRKMVXBFCV-UHFFFAOYSA-N	442.280	1.997	50	20	IDGD	
O=C(Cc1cscn1)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1	1788202695	WRTSRBQKWOBFKN-UHFFFAOYSA-N	435.314	1.813	50	20	IDGD	
CC(C)n1nccc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21	1788934150	SDANQDWUDBNTQE-NZBPQXDJSA-N	431.306	1.748	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3cncnc3)C[C@@H]21	1789866608	UZXQIFJAFJSSHS-IUVQAAGXSA-N	429.348	1.625	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)COc3ccc(O)cc3)C[C@@H]21	1789867936	NKOSCFLCIKGCLZ-FDRFZEDHSA-N	445.343	1.987	50	20	IDGD	
CCCC(=O)N[C@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]2C1	1789870230	ABWYKHJUYKGKNT-QWHKOUAISA-N	436.380	1.507	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cccnc3Cl)C[C@@H]21)[C@@H](F)Br	1789922497	NUMLKTXTFOBKAR-PWNZVWSESA-N	448.720	1.948	50	20	IDGD	
Cc1ccc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]3C2)cn1	1789922947	YVEUUFBXTOYNAQ-QBYUYEEZSA-N	428.302	1.603	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CCc4nc[nH]c4C3)C[C@@H]21)[C@H](F)Br	1789926935	LRKJZYUSXZJXQJ-IKUJJKIKSA-N	443.317	1.185	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)c3ccccc3)C[C@@H]21	1791057499	FAAYQLXIRQYPCA-JVNPIMRCSA-N	425.323	1.483	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc3ccnn13)C2	1792874641	VPFBRAVTFQZAQH-ZJOBFFGXSA-N	435.322	1.569	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1cccc(O)c1)C2	1795117163	PUJMTZVGRNYZPC-CCWDJLKJSA-N	425.323	1.699	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](N)Cc1cscn1	1796748334	WPGZVZIJJBEGMN-RCSLCFTFSA-N	429.384	1.825	50	20	IDGD	
Cc1c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)oc2ccccc12	1797416198	KPSLLBJCPGUWFV-REPLKXPHSA-N	432.285	1.987	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C#CC1(O)CCCCC1	1797784568	KQGOVFXTKZRRSU-HIRMHNASSA-N	431.360	1.511	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1nc(O)n2c1CCCC2)[C@H](F)Br	1798660719	SGMAXZDFBJBHEQ-MIJXAVMKSA-N	429.290	1.867	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(-n2c(O)nnc2O)cc1	1799311746	OQDDOXUMUWFZNG-UKMLZYKCSA-N	433.896	1.948	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)cc([N+](=O)[O-])c1	1799732702	KQDPMHUEMGLMNO-ABXQLRGKSA-N	446.287	1.740	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](C)N1CCN(C)CC1	1799965404	MCECCBXNKBEABU-OVYGPGRDSA-N	429.403	1.292	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2)[C@H]1CC(c2ccccc2)=NN1	1800157539	DNKXARPYDAXORK-OCVGTWLNSA-N	425.316	1.146	50	20	IDGD	
Cc1ccc(F)c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)c1	1800433706	DDEQCLHAQXZEGR-QDMKHBRRSA-N	425.464	1.698	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cn3ccsc3n1)C2	1800759677	ZVEZJEYWKBCJHW-HNCHTBHHSA-N	427.324	1.382	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(C#N)c1Cl)C2	1800978678	HRLXFNBDHDYOQE-YXPYIKCWSA-N	426.300	1.669	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/c1cc(F)cc(OC)c1)C2	1800981376	MLPSIQPVNSXYKW-JGWYLNEVSA-N	440.899	1.691	50	20	IDGD	
CC[C@@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CNC(=O)c1ccco1)C2	1801798519	RCSQHXQDIKLUIM-XJFOESAGSA-N	426.311	1.821	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(OC(C)C)c(C#N)c1	1801850671	SVGKVONJEDKGIM-AJYBTWMASA-N	449.935	1.802	50	20	IDGD	
CC(=O)Nc1ccc(Cl)c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](O)CCl)C3)c1	1801906316	PYRHNZLKIXLXTH-CZAMWMTLSA-N	444.315	1.101	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1	1803012110	WCAHDGDZPOXFOP-UNQGMJICSA-N	432.746	1.718	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC2(CCCN(C(=O)[C@H]3CCC(=O)NC3)C2)CC1	1804970603	CNZGJKKRGPBXED-CABCVRRESA-N	428.371	1.775	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1CCN(C(=O)[C@H]2CCC(=O)NC2)[C@H]1c1cccnc1	1808290814	YLRCWXAVIADTCF-PYWIUJKZSA-N	441.359	1.850	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2cnn3cccnc23)[C@@H]1c1cccnc1	1809745332	OYWWKCRUPQJLQV-NJAFHUGGSA-N	442.907	1.698	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)c1ccc2ncncc2c1	1809916037	VAZHMSDDUGCBNM-VDGAXYAQSA-N	439.903	1.944	50	20	IDGD	
C[C@@H](Cc1ccncc1)C(=O)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1	1809974334	UOOINPMVTWSDFC-IBGZPJMESA-N	449.360	1.485	50	20	IDGD	
Cn1cc(CC(=O)NC[C@H]2CCN(C(=O)CO[Si](C)(C)C)[C@H]2c2cccnc2)cn1	1813457136	JXDOSMIWWUPDPK-NQIIRXRSSA-N	429.597	1.915	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CNC(=O)N(C)C)n[nH]1	1814566104	CGODFXISXOVBKH-ZYHUDNBSSA-N	429.319	1.456	50	20	IDGD	
Cc1cnc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)s1	1815337067	LCTUFNZNZAYVQB-CYBMUJFWSA-N	442.331	1.127	50	20	IDGD	
O=C(Cn1cccc([N+](=O)[O-])c1=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](F)Cl)sc2C1	1817133849	IYFFRCBIGVIROA-AMIZOPFISA-N	443.844	1.360	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2[nH]cc3c2CCC3)[nH]n1)c1ccc(B(O)O)cc1	1817472440	SMFKVUNNOHTJCR-IBGZPJMESA-N	447.304	1.526	50	20	IDGD	
O=C(Cc1cscn1)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1817546035	JNHDJWMJIYTCCZ-QGZVFWFLSA-N	439.306	1.095	50	20	IDGD	
CCOCCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819404150	BBFZSGVAWGJFGB-MRXNPFEDSA-N	429.481	1.141	50	20	IDGD	
COc1ccc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)CCC(=O)NN(C)C)CC3)cc1	1822226919	HGWAATVNZACDNF-CQSZACIVSA-N	445.545	1.751	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CN1CCOCC1)CC2	1822863468	KVCOFWKNZSSCEK-GTNSWQLSSA-N	435.377	1.624	50	20	IDGD	
COc1cc(C(=O)N[C@H]2CCc3nc(NC(=O)[C@@H](F)Br)sc3C2)nn1C	1823007056	KMRSHYSHAMEONO-JVXZTZIISA-N	446.302	1.802	50	20	IDGD	
CC(C)N1CCC[C@H]1C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1	1823022995	SOWJHMKUJLDZNH-MSOLQXFVSA-N	447.584	1.648	50	20	IDGD	
C=CC[C@H](C)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnccc1C(=O)NN)CC2	1825125950	AWWSGQXEZWJOIL-RYUDHWBXSA-N	428.518	1.580	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)CCc2ccco2)CC1	1825247125	ZJQHZHKGVXWUQX-JOCHJYFZSA-N	438.333	1.826	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)Cn1ccnn1)CC2	1825446657	HFYMPINLADANCB-ZJUUUORDSA-N	427.328	1.520	50	20	IDGD	
Cc1cccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)n1	1825848507	BCQZOJNFODQINR-QFIPXVFZSA-N	435.333	1.617	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnc3ncccn13)CC2	1826000191	OCFKFFZPPYHDRY-MNOVXSKESA-N	434.909	1.665	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)C[C@H]1CCCCO1)CC2	1826082745	CBRCMVWWQCFEAM-ZIAGYGMSSA-N	437.566	1.387	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CS(C)(=O)=O)CC1	1826630042	XIMGOVSIXSNPFV-CABCVRRESA-N	437.400	1.824	50	20	IDGD	
O=C([C@@H]1CCCS1)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827059644	FMGSSWVHCIIDMT-UXHICEINSA-N	430.379	1.495	50	20	IDGD	
Cc1ccnc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)c1	1827059968	YXYZRRNBHCFIDX-QFIPXVFZSA-N	435.333	1.617	50	20	IDGD	
C[C@@H](C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCC(=O)NN(C)C)CC2)c1ccccn1	1827074189	LHQDQUYIIMUNBZ-ZIAGYGMSSA-N	444.561	1.627	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)Cc2ccsc2)CC1	1827161758	SGLVBHZCDVAJEZ-OAQYLSRUSA-N	440.374	1.904	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(C=O)s3)C2)C1	1830358138	QYEFGTHJZRCJAR-IBGZPJMESA-N	428.938	1.896	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cncc(N(C)C)c3)C2)C1	1831644337	VRKOLTCQXPYXFP-GHTZIAJQSA-N	438.956	1.625	50	20	IDGD	
Cc1cnc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)cn1	1831872115	OTXBFUOZXCXBJQ-IBGZPJMESA-N	430.553	1.391	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)CCc2cnccn2)CC1	1832263675	UZBTUTRYQXVOIB-HXUWFJFHSA-N	444.580	1.402	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnc(OCC)cn3)CCO2)C1	1833430067	OXWKOOHMJNXQAD-MGPUTAFESA-N	440.928	1.353	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)nc1	1834378673	SUVRHKOJIDYSFM-KBXCAEBGSA-N	426.311	1.243	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccc(F)cc3)CCO2)C1	1835052162	TWOWCKCBJXONGH-LIRRHRJNSA-N	443.313	1.608	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3cscn3)CCO2)C1	1836044381	WTJIAALDXBTDOT-DLBZAZTESA-N	436.361	1.378	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)C3=C(C)OCC3)CCO2)C1	1836274503	FRNJALHEBWXEOR-QAPCUYQASA-N	431.327	1.311	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@H](C)N3CCN(C)CC3)CC2)CC1	1836375121	XNKLRIPWQLISNY-FXAWDEMLSA-N	442.048	1.211	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)CN3CCC(C)CC3)CC2)CC1	1836806048	WSXJXYCOYCMJMP-HXUWFJFHSA-N	444.016	1.971	50	20	IDGD	
O=C(c1ccccc1)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1	1837919145	JPKQZXDKHSJVCG-UHFFFAOYSA-N	436.317	1.292	50	20	IDGD	
C[C@H](C(=O)N1CCC(OC2CCN(C(=O)[C@H](F)Br)CC2)CC1)n1ccnn1	1838648149	JYFPQWQWVGXYJO-DOMZBBRYSA-N	446.321	1.528	50	20	IDGD	
O=C(CC1(O)CCC1)N1CCC(OC2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1838648322	QXIMQHXXCUCZMJ-MRXNPFEDSA-N	435.334	1.981	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3c(F)cccc3F)CCO2)C1	1838995872	WKWNSIGURANALM-YWZLYKJASA-N	430.879	1.981	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C=C/c3cccnc3)C2)C1	1839150740	WHKMSHMCFDDFBT-IKLBINMZSA-N	442.343	1.788	50	20	IDGD	
Cc1nc(F)ccc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2	1839153785	SGXIVCDMMQJETP-RTBURBONSA-N	448.322	1.835	50	20	IDGD	
Cc1nscc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839197878	KOKRGLCMRKXYQK-SWLSCSKDSA-N	436.303	1.212	50	20	IDGD	
O=C(Cc1ccc([N+](=O)[O-])cc1F)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1839788369	DAKQHNMUVQNIPR-WMZOPIPTSA-N	447.822	1.267	50	20	IDGD	
Cc1cscc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)Br)CCO2	1840033001	QFRIYVFIBZHKRO-GUYCJALGSA-N	431.352	1.910	50	20	IDGD	
CCc1nc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)co1	1840033534	IHICUIJXYNJZTC-YVEFUNNKSA-N	430.299	1.090	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccccc3Cl)C2)C1	1840151509	FFFXLGYGAWXUMY-FXAWDEMLSA-N	445.343	1.593	50	20	IDGD	
O=C(c1onc2ccccc12)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840189781	LMKHXQSEQMRSFY-GOSISDBHSA-N	428.272	1.702	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)CCN2C(=O)c3ccccc3C2=O)C1	1841911354	YMXVIOUVZXUBQW-INIZCTEOSA-N	433.892	1.130	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1c[nH]c3nccc-3c1)C2	1843415831	RUQGQXKPOUBDEX-VULFUBBASA-N	433.472	1.466	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)c2ncccc2-c2ccccc2)C1	1843543780	AGBOTQHGEZNSIK-UHFFFAOYSA-N	441.296	1.559	50	20	IDGD	
CC(=O)C[C@@H](C)C(=O)N1CC2(CCCN2C(=O)c2cc([N+](=O)[O-])ccc2OC(C)=O)C1	1844693348	VJQUMNRIGMPBKD-CYBMUJFWSA-N	431.445	1.952	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC12CN(C(=O)Cc1ccc(S(C)(=O)=O)cc1)C2	1846176405	GTQYIUINNMOMQU-CYBMUJFWSA-N	443.363	1.619	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)Cc1ccc(Br)cn1)C2	1846360965	QLUXDNGMLWDWKH-CQSZACIVSA-N	430.730	1.844	50	20	IDGD	
C[C@H]1CC[C@@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](O)CCl)N1C(=O)OC(C)(C)C	1847217856	QPYQWVCFCHKZMO-QXKUPLGCSA-N	429.945	1.576	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1ccc(Cl)nc1F	1848287948	AQDUPSNYFXHMFL-KBPBESRZSA-N	432.843	1.002	50	20	IDGD	
CC(C)C[C@H](C(=O)OCC(=O)NNC(=O)c1ccccc1)N1C(=O)[C@H]2CC=CC[C@@H]2C1=O	9206012	XGPPYANLUWOCMO-OKZBNKHCSA-N	441.484	1.357	50	20	IDGD	
COC(=O)c1cc(CNC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)ccc1OC	9958512	GHXHVMJPOGKAFM-UHFFFAOYSA-N	439.428	1.517	50	20	IDGD	
O=C(Cc1csc(N2CCOCC2)n1)NN[C@H](C(=O)NC1CC1)c1ccc(F)cc1	10836980	BFQARRLWKHYPFF-SFHVURJKSA-N	433.509	1.302	50	20	IDGD	
O=C(NN[C@H](C(=O)NC1CC1)c1ccccc1)c1ccc(S(=O)(=O)N2CCCC2)cc1	15474781	DTYMFHHLWBXQPF-FQEVSTJZSA-N	442.541	1.725	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)C(=O)c2c(C)nn(C)c2C)c2ccccc2c1=O	16205281	CXQABLWYTKOOOW-UHFFFAOYSA-N	438.488	1.581	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)[C@@H]1CC(=O)N(Cc2ccc(C)cc2)C1	25413228	VEHDRRMMFMIHND-GOSISDBHSA-N	425.485	1.969	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)CN1C(=O)N[C@@]2(CCc3ccccc32)C1=O	27266415	FKAKAZAWBYQLDY-OAQYLSRUSA-N	442.859	1.503	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)[C@@H]2CCCN2C(=O)c2ccc(Br)cc2)n1	303086077	GOWBYILAGPNLHH-INIZCTEOSA-N	448.321	1.715	50	20	IDGD	
CC(=O)N[C@H](CC(=O)NNC(=O)c1nn(-c2ccccc2)cc1O)c1c(F)cccc1F	727483791	ZHKBJGXVGAGMAM-MRXNPFEDSA-N	443.410	1.885	50	20	IDGD	
O=C(NNS(=O)(=O)c1cccc(COCC(F)(F)C(F)F)c1)N1CCOCC1	727796637	DHKVBFJGIUURSR-UHFFFAOYSA-N	429.392	1.339	50	20	IDGD	
Cc1cc(C)n([C@@H](C)CC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)n1	728216088	PXUPNCOVQWFWHZ-KRWDZBQOSA-N	434.566	1.530	50	20	IDGD	
O=C(CSc1nnc(O)nc1O)NN=Cc1csc(-c2ccc3c(c2)OCO3)n1	728425526	JFPKEAIGYDZUTI-UHFFFAOYSA-N	432.443	1.377	50	20	IDGD	
COC(=O)/C=C\c1cc(OC)c(OC)c(S(=O)(=O)NNC(=O)c2cccc(C#N)c2)c1	728853510	PMZZKRGCFNBIOC-FPLPWBNLSA-N	445.453	1.385	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)/C=C/c1ccccc1)C(=O)NNC(=O)Cc1cccnc1	728893380	JQVLRADBMXYFHP-HGZMWJMZSA-N	448.570	1.484	50	20	IDGD	
C[C@@H]1Oc2ccccc2N(CC(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)C1=O	728974399	MYQPEFQGHUMRIO-NSHDSACASA-N	425.413	1.940	50	20	IDGD	
O=C(Nc1sccc1C(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1ccc2c(c1)CCC2	729303101	HDMFUBBEPZQVMH-OAHLLOKOSA-N	447.538	1.685	50	20	IDGD	
O=C(NNC(=O)[C@H]1CS[C@H](Cc2ccccc2F)C(=O)N1)c1cccc2ncccc12	730226523	OIDHZPMJDZPJMU-RTBURBONSA-N	438.484	1.978	50	20	IDGD	
CN1CCN(CCCNC(=O)NNC(=O)COc2ccccc2O)[C@@H](c2ccccc2)C1	730823051	OKXALANCULHDTH-LJQANCHMSA-N	441.532	1.480	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)Cn1c(S)nnc1-c1ccc(Cl)cc1	730835149	DBKBELXUDBGGQN-UHFFFAOYSA-N	433.877	1.819	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNS(=O)(=O)c2ccc(N3CCCC3=O)cc2)cc1C	731058256	URBAMDLKZVDUBA-UHFFFAOYSA-N	430.486	1.378	50	20	IDGD	
O=C(CCCCOc1ccc(Br)cc1)NNC(=O)[C@@H]1CCS(=O)(=O)C1	731163513	JLBGCGZULHRSLG-GFCCVEGCSA-N	433.324	1.580	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(CNC(=O)NNC(=O)Cc2ccccc2F)cc1	731358269	LUXLITWDWMRJPV-UHFFFAOYSA-N	436.509	1.929	50	20	IDGD	
Cc1cnc2c(S(=O)(=O)N3CCN(C(=O)NNC(=O)C(C)(C)C)CC3)cccc2c1	731499198	MOYLQSZSMUFUCR-UHFFFAOYSA-N	433.534	1.636	50	20	IDGD	
CC(C)CCC(=O)NCC(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	732050940	NPRGJXBFVYLGNA-UHFFFAOYSA-N	449.511	1.758	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCC2(C(=O)N(C)C)CCCC2)nc1	733658993	QAKCYBCDOCNAJH-UHFFFAOYSA-N	440.570	1.387	50	20	IDGD	
Cc1nn2c(=O)c3ccccc3[nH]c2c1C=NNC(=O)NCCNC(=O)OC(C)(C)C	734304148	SBZNEBKMSAPUJO-UHFFFAOYSA-N	427.465	1.642	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)cc1[N+](=O)[O-]	734825015	QJVMEZPVWUMTHX-UHFFFAOYSA-N	437.453	1.947	50	20	IDGD	
CN(c1ccc(OCC(=O)NNC(=O)c2cnn(C)c2)cc1)S(=O)(=O)c1cccs1	735445414	UAMWWKXUAHAGCA-UHFFFAOYSA-N	449.514	1.147	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)c1ccccc1F)C(=O)NNc1ccc(Cl)nn1	735689112	KRTWQKXUIWOGTN-NSHDSACASA-N	433.918	1.812	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N[C@@H]2CCC[C@H](S(C)(=O)=O)C2)cc1Br	740915707	QLHXOFNNKLEWGT-NEPJUHHUSA-N	448.339	1.758	50	20	IDGD	
CS(=O)(=O)CCNC(=S)NNC(=O)Nc1ccc(Br)cc1Cl	741856117	HWVZWAOERVGZOD-UHFFFAOYSA-N	429.749	1.648	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C2(NS(=O)(=O)c3c(C)noc3C)CCCC2)cc1	742241879	NTUKSLAKOJHEBI-UHFFFAOYSA-N	434.518	1.906	50	20	IDGD	
Cc1cc(Cl)ccc1OCCCC(=O)NNC(=O)CN1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O	742465111	DCJVMWZBKKAPHW-RGCFKVTRSA-N	449.891	1.117	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)C[C@@H]1CCCN1C(=O)OC(C)(C)C	742676623	JXEXKICXYUAMFG-ZDUSSCGKSA-N	429.518	1.631	50	20	IDGD	
CS(=O)(=O)Nc1cc(C(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)ccc1F	743830834	KWYKYTOKEISVAL-UHFFFAOYSA-N	444.466	1.067	50	20	IDGD	
CC[C@H]1Oc2cc([C@@H](C)NC(=O)NNC(=O)CNC(=O)c3ccco3)ccc2NC1=O	745933195	UUJWFELGHFXJDF-BXUZGUMPSA-N	429.433	1.211	50	20	IDGD	
CN1CCO[C@@H](C(=O)NNC(=O)c2ccc(CSc3nc4ccccc4[nH]3)cc2)C1	746092429	OLTHUKSPJIRAIY-GOSISDBHSA-N	425.514	1.947	50	20	IDGD	
Cc1cccc(N2CCN(CCC(=O)NNC(=O)c3nnc(O)c4ccccc34)CC2)c1	746097082	VFMOPMORGAXETN-UHFFFAOYSA-N	434.500	1.617	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CC[C@H](N(C)Cc3ccccc3)C2)cc1OC	746485075	VPLKPAAPQNUJEQ-IBGZPJMESA-N	426.517	1.671	50	20	IDGD	
Cc1c(C(=O)NNC(=O)Cc2cn3ccccc3n2)nnn1-c1cccc2c1CCN(C)C2	746549273	OLSBJJOPNORANZ-UHFFFAOYSA-N	444.499	1.215	50	20	IDGD	
COC(=O)c1ccsc1N1CC[C@@H](NC(=O)NNC(=O)COc2cccc(C)c2)C1=O	746780051	LYJIXGINEIRLSA-OAHLLOKOSA-N	446.485	1.358	50	20	IDGD	
NC(=O)N[C@@H](CC(=O)NNC(=O)C(=O)N1CCCC1)c1cccc(Oc2ccccc2)c1	748246313	IMDUOVVYCYHTPH-SFHVURJKSA-N	439.472	1.348	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)N[C@@H]1CCCSC1	748969399	ZWBZWBBFTIBJQN-OAHLLOKOSA-N	426.564	1.701	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCCN2CCCc3ccccc32)c2ccccc2c1=O	749214235	RKCOUOSCTWIVAG-UHFFFAOYSA-N	434.500	1.813	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCN2CCCc3ccccc32)c1	749214241	RRKYRRAJMWONCJ-UHFFFAOYSA-N	445.545	1.334	50	20	IDGD	
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	749583574	MSMYRTSLDIJAJE-UZLBHIALSA-N	434.504	1.517	50	20	IDGD	
O=C(NCCc1cccs1)NNC(=O)[C@@H]1CCCN1C(=O)c1ccc2c(c1)OCO2	749586632	WJCSFTTXIBMXCA-HNNXBMFYSA-N	430.486	1.655	50	20	IDGD	
O=Cc1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)[nH]1	749864649	PTUBVIVMSFBABW-UHFFFAOYSA-N	426.454	1.381	50	20	IDGD	
O=C(/C=C\c1ccc(I)o1)NNC(=O)CNC(=O)c1ccco1	751211097	BTHHORWKALHCJE-XQRVVYSFSA-N	429.170	1.068	50	20	IDGD	
CC(C)[C@H]1OCCC[C@H]1CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	753033260	BBZQUAYAJLCEPT-DOTOQJQBSA-N	426.539	1.332	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)NCc2[nH]cnc2C)cc1	754346936	VWVGMNKSUOUTOB-SXGWCWSVSA-N	433.472	1.689	50	20	IDGD	
CCCC[C@@H](NC(=O)[C@@H](C)NC(=O)C(C)(C)C)C(=O)NNC(=O)c1ccc2c(c1)OCO2	755038029	IPWILCRBWUMJGQ-UKRRQHHQSA-N	448.520	1.402	50	20	IDGD	
CCCC[C@@H](NC(=O)[C@H](C)NC(=O)C(C)(C)C)C(=O)NNC(=O)c1ccc(Cl)nc1	755185831	NPKCBXWNHLKAIG-GXTWGEPZSA-N	439.944	1.722	50	20	IDGD	
CN(C(=O)c1ccccc1NC(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1)C1CCCCC1	756117492	BWEIXPYDXFUUDK-AWEZNQCLSA-N	436.534	1.679	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)Nc2ccn(CC(=O)N(C)C)n2)cc1OC	756312252	ZLLQZRWDFKDXAQ-UHFFFAOYSA-N	432.481	1.625	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)Nc2ccc(C[C@H]3CC(=O)NC3=O)cc2)o1	756814139	CXPIGLXBUVZTBA-HNNXBMFYSA-N	441.488	1.793	50	20	IDGD	
COCc1nc2n(n1)C[C@@H](NC(=O)NNC(=O)c1ccc(COc3ccccc3)o1)CC2	757795526	MQQGOEJSVMYQBC-AWEZNQCLSA-N	440.460	1.556	50	20	IDGD	
N#Cc1c(F)cccc1-n1ccc(NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)n1	757979693	SFUFYRZKFGPNKG-UHFFFAOYSA-N	449.450	1.742	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)Nc3ncn(C(C)(C)C)n3)n[nH]2)cc1OC	758014190	DRCIWZBFALCCNC-UHFFFAOYSA-N	428.453	1.907	50	20	IDGD	
Cc1c(C(=O)NNC(=O)Cn2cnc3ccccc32)cnn1CCO[C@H]1CCCCO1	758068645	NWIWWUDGQMZZLT-FQEVSTJZSA-N	426.477	1.546	50	20	IDGD	
O=C(Cc1ccn(-c2ccccc2)n1)N1CCN(S(=O)(=O)CBr)CC1	758528598	WOCBQFRCKJBMJA-UHFFFAOYSA-N	427.324	1.241	50	20	IDGD	
CCS(=O)(=O)NCC(=O)NNc1nc2ccccc2c(=O)n1-c1ccc(C(C)C)cc1	759101296	IADJXBLRAJMYAC-UHFFFAOYSA-N	443.529	1.892	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)CN2CCN(C(=O)OCc3ccccc3)CC2)nc1	759721135	BKGLFEICIPGSJQ-UHFFFAOYSA-N	427.461	1.266	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1)C(=O)Nc1cnns1	760277808	SNNVISWFTWOFSU-QGZVFWFLSA-N	436.497	1.251	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2ccnn2Cc2ccc(F)cc2)c1	760278221	AYYJUGMGPCVXTE-UHFFFAOYSA-N	439.447	1.852	50	20	IDGD	
CNC(=O)CCOc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3n2)cc1	763451050	UQQBGPNQXMKMCG-UHFFFAOYSA-N	435.440	1.149	50	20	IDGD	
Cc1nc(N2CCOCC2)ccc1NC(=O)C(=O)NNC(=O)c1ccc2ccccc2n1	763451363	VZSNFIVWFRWQIH-UHFFFAOYSA-N	434.456	1.175	50	20	IDGD	
Cc1ccc(F)cc1NC(=O)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	763511387	BDJYFGBDSSFETH-UHFFFAOYSA-N	448.476	1.318	50	20	IDGD	
CCOCCOCc1cccc(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1	763574257	YAFGJSOHVZADTP-LJQANCHMSA-N	443.456	1.166	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1ccccc1S(=O)(=O)C(C)C	763624123	JILCYNDZMYWTEM-UHFFFAOYSA-N	443.485	1.225	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cnc3c(cnn3C(C)C)c2)cc1	763660209	ZPDRIXWQGVYBRC-UHFFFAOYSA-N	426.433	1.186	50	20	IDGD	
COc1cc(F)c(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)cc1OC	763686704	QCGWJRJXIVJANP-UHFFFAOYSA-N	425.800	1.661	50	20	IDGD	
O=C(CSc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1ccc2c(c1)OCC(=O)N2	763732198	BLYCFEAIGWBLTL-UHFFFAOYSA-N	434.861	1.549	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)C(=O)Nc2ccccc2OC(C)(C)C)c2ccccc2c1=O	763789815	FDGYBUHUEKHXOO-UHFFFAOYSA-N	437.456	1.511	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)C(=O)Nc2ccc(C)nc2O)c2ccccc2c1=O	763801167	JHCSYURMKIPOLS-UHFFFAOYSA-N	438.444	1.005	50	20	IDGD	
COC(=O)c1ccc(OC(C)C)c(NC(=O)C(=O)NNC(=O)COc2ccc(C)cc2)c1	763809167	KGSVRFFODBJYGC-UHFFFAOYSA-N	443.456	1.734	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(N3CCO[C@H](C)C3)cc2)cc1	763812691	VGHUJAJRAYZVGC-MRXNPFEDSA-N	426.473	1.385	50	20	IDGD	
CCCS(=O)(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)COc2ccc(C)cc2)c1	763820412	HAJBBFZPZUPUNM-UHFFFAOYSA-N	448.501	1.312	50	20	IDGD	
COC(=O)c1ccc(C)c(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(C(C)=O)cc2)c1	763879497	WZFJNPCCLAYPSG-AWEZNQCLSA-N	441.440	1.538	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1ccccc1N1CCOC1=O	764012580	SVNWMVZFXASQIM-UHFFFAOYSA-N	432.820	1.705	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccccc1C(=O)N1CCC(C)CC1	764043824	WUWCNEKYQKYUID-UHFFFAOYSA-N	438.484	1.967	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(C)cc2O)cc1Cl	764111065	UKJTYSGZMISQRF-UHFFFAOYSA-N	435.820	1.306	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2O1)C(=O)Nc1ccc(CCN2CCCCC2)cc1	764167547	KSFOJHWTSAOYTO-OAQYLSRUSA-N	436.512	1.805	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(C#N)c2)cc1Cl	764238243	RLMPRXNYLGTBMV-UHFFFAOYSA-N	430.804	1.163	50	20	IDGD	
CN(C)CCOc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(C#N)c2)cc1Cl	764242424	QNQFVNAJRKQFRF-UHFFFAOYSA-N	429.864	1.552	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(-c3nnc(C)o3)cc2)c(OC)c1	764286552	MADBENKYPOUFEA-UHFFFAOYSA-N	425.401	1.462	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3cnn(-c4ccccc4)c3)cc2)CCO1	764352035	XQAXRYJNFCFSLK-INIZCTEOSA-N	448.483	1.497	50	20	IDGD	
N#CCCSc1ccc(C(F)(F)F)cc1NC(=O)C(=O)NNC(=O)[C@@H]1COCCO1	764431986	HLXWLKCRWGEBMF-LBPRGKRZSA-N	446.407	1.212	50	20	IDGD	
CC(=O)NNC(=O)Nc1cc(S(=O)(=O)N2CCOCC2)ccc1N1CCCCCC1	765115365	JZZWUVYEIHSUIK-UHFFFAOYSA-N	439.538	1.261	50	20	IDGD	
CC1(C)CCC[C@]2(C1)NC(=O)N(CC(=O)NNC(=O)CSc1ccccc1O)C2=O	765247981	BZXAENJGBXUHCZ-HXUWFJFHSA-N	434.518	1.523	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)cc(Cl)c1OCC(N)=O	765567342	FUVGECVZKIAUTN-UHFFFAOYSA-N	449.876	1.739	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)CCc2ccc(S(N)(=O)=O)cc2)n[nH]1	765595607	NZHLEGZXOOLLLO-UHFFFAOYSA-N	443.485	1.127	50	20	IDGD	
CCCn1ncc(C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)c1C1CC1	766192675	PEQXYGLGYBRZJB-UHFFFAOYSA-N	447.565	1.259	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(OC[C@@H]2CCOC2)c(F)c1)c1ccc2c(c1)OCO2	767437041	DGMPMGVBYGURTB-GFCCVEGCSA-N	438.433	1.593	50	20	IDGD	
O=C(CCn1c(S)nc2ccccc2c1=O)NNC(=O)c1cc(-c2cccs2)[nH]n1	768260671	MDIAOWLAFBUWJM-UHFFFAOYSA-N	440.510	1.988	50	20	IDGD	
CS(=O)(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)NNc1nc2ccccc2[nH]1	768494295	GGQJYBIYUNCYHR-KRWDZBQOSA-N	445.501	1.736	50	20	IDGD	
O=C(NNc1ccc(OC(F)(F)F)cc1)Nc1ccn(CC(=O)N2CCOCC2)n1	770035425	ZZBLVUPWSXEOCZ-UHFFFAOYSA-N	428.371	1.789	50	20	IDGD	
Cc1nn(-c2cncc3nnnn23)c(C)c1CC(=O)Oc1ccc([N+](=O)[O-])c2ncccc12	770127972	HWRZJEIRLWZDGZ-UHFFFAOYSA-N	445.399	1.926	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)c1cccc(OCC(F)(F)F)c1	770141673	NFWUPDPLHNQFLW-UHFFFAOYSA-N	430.408	1.996	50	20	IDGD	
C[C@]1(c2ccc(F)c(Cl)c2)NC(=O)N(CC(=O)NNC(=O)NCC(F)(F)F)C1=O	770223246	QPAOPNGUIUJBAY-CQSZACIVSA-N	439.753	1.139	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)c1ccc(Br)cc1-n1cncn1	772221671	SCFJUMREIGGQNN-LLVKDONJSA-N	438.282	1.769	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)c2ccc(N3CCNC3=O)cc2)C1	773416559	CETGIURHTUEDFJ-HNNXBMFYSA-N	431.493	1.624	50	20	IDGD	
Cc1cc(C)cc(C(=O)NCC(=O)NNC(=O)[C@H]2CCCN(C(=O)OC(C)(C)C)C2)c1	773417745	IFFHLTXYDGLQNY-INIZCTEOSA-N	432.521	1.828	50	20	IDGD	
Cc1nc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)ccc1Br	773526914	GPSJQEYARBUBJL-SNVBAGLBSA-N	439.241	1.845	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2cccc(-c3ncc4n3CCCC4)c2)CCS(=O)(=O)C1	773644267	IUHFUZITWGZXCJ-HXUWFJFHSA-N	431.518	1.023	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NC[C@@H]2COC3(CCCC3)O2)c2ccccc2c1=O	774301466	GUSYFMVNPDIKKS-OAHLLOKOSA-N	443.504	1.826	50	20	IDGD	
O=C(NCc1cccnn1)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	775035428	ZMZULGLFAISYJZ-UHFFFAOYSA-N	440.485	1.099	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(Br)cc1F)[C@H]1COc2ccccc2O1	775251519	UTJPKPZBXWOGAX-CYBMUJFWSA-N	431.239	1.738	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)N[C@@H]2CCO[C@]3(CCS(=O)(=O)C3)C2)c1C	776004656	UFECBXATSCYZPJ-MHOPCPDLSA-N	435.546	1.511	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)Nc2ccnn2[C@@H]2CCS(=O)(=O)C2)c2ccccc2n1	776059775	RPNJPZLFAHWMMD-CYBMUJFWSA-N	428.474	1.566	50	20	IDGD	
CC(=NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1)C1CCS(=O)(=O)CC1	777444317	ZTEQGWMYRPVTLY-UHFFFAOYSA-N	440.997	1.775	50	20	IDGD	
COc1cccc([C@H]2[C@@H](C(=O)NNC(=O)CNC(=O)OC(C)(C)C)CC(=O)N2C2CC2)c1	778442787	FAQRTDRLWRRMLD-LPHOPBHVSA-N	446.504	1.419	50	20	IDGD	
NC(=O)c1ccc(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2Br)cc1F	778759711	NNVHMWZCVCDOAL-UHFFFAOYSA-N	440.185	1.677	50	20	IDGD	
COc1ccc(Cn2nccc2NC(=O)NNC(=O)c2ccncc2)c(OC)c1OC	779461239	GSOTZTHMUSEKLQ-UHFFFAOYSA-N	426.433	1.819	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)[C@H]2C[C@]23CCN(C(=O)OC(C)(C)C)C3)c2ccccc2c1=O	780171346	LATFZZJJBKHYAE-QRQCRPRQSA-N	441.488	1.342	50	20	IDGD	
C=C(C)COc1cccc(NC(=O)C(=O)NNC(=O)c2csc(N3CCOCC3)n2)c1	782898040	XMVOOVAQCJVXGB-UHFFFAOYSA-N	445.501	1.334	50	20	IDGD	
CCN1CCN(c2cccc(NC(=O)C(=O)NNc3ncnc4ccsc34)c2)CC1	783252748	BXGSFFYESWCKLT-UHFFFAOYSA-N	425.518	1.915	50	20	IDGD	
CCC(CC)NC(=O)[C@@H]1CN(C(=O)C(=O)NNc2cncc(Cl)n2)c2ccccc2O1	783258999	TXOIBQSWVOLZFJ-HNNXBMFYSA-N	446.895	1.672	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccccc2O[C@@H](C)C#N)nc1	783262485	DWWIKRLGZNFUTD-ZDUSSCGKSA-N	446.489	1.141	50	20	IDGD	
CCOC(=O)c1ccccc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)NC(C)C)cn1	783263668	IUAUCOCJYYJCPY-UHFFFAOYSA-N	449.489	1.027	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2cc(N3CCNC3=O)ccc2Cl)n1	785225169	FRTAZHJFDUBYSX-UHFFFAOYSA-N	446.899	1.588	50	20	IDGD	
CCS(=O)(=O)CCn1cc(C)c(NC(=O)NNC(=O)c2cc(Cl)ccc2O)n1	786725254	RYGVWZVLPYUPSJ-UHFFFAOYSA-N	429.886	1.452	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2cc(F)cc(Br)c2F)n1	787542667	DHNFOUPLNIJFME-UHFFFAOYSA-N	430.209	1.327	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)[C@H]1CC(=O)N(C2CC2)[C@H]1c1cccc(OC)c1	788164950	WMIOCDNXPNJNMG-HKUYNNGSSA-N	433.505	1.684	50	20	IDGD	
CC(C)(C)[C@H]1CCc2nc(NC(=O)C(=O)NN[C@]3(C)CCS(=O)(=O)C3)sc2C1	789751293	VLASUXMOZMCUJH-BBATYDOGSA-N	428.580	1.431	50	20	IDGD	
CCc1ccc(NC(=O)C(=O)NNc2ccc(Cl)c(OC)c2)cc1S(N)(=O)=O	789795836	GCOLUQHLLGASAG-UHFFFAOYSA-N	426.882	1.640	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)cc1F	789811144	VZTODZFIUMYYDG-YOEHRIQHSA-N	429.404	1.271	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)CCN1CCN(C(=O)OC(C)(C)C)CC1	792017073	XFEIVQDXZJLEKI-HNNXBMFYSA-N	438.500	1.683	50	20	IDGD	
Cc1cccc(=O)n1C[C@@](C)(O)C(=O)NNc1ccccc1S(=O)(=O)NC(C)(C)C	792267094	HFEWNINWUHWMCT-HXUWFJFHSA-N	436.534	1.128	50	20	IDGD	
CCOC(=O)c1csc([C@H]2CCCN2CC(=O)NNC(=O)c2cccc(C#N)c2)n1	792471349	STQBGZGOMNERKC-MRXNPFEDSA-N	427.486	1.790	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)C(=O)Nc1nc(C(F)(F)F)cs1	793021336	CGDWQOMFGPLBNK-UHFFFAOYSA-N	433.324	1.235	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)nc1)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1	793026896	UXPOVYGFZFGODR-UHFFFAOYSA-N	442.613	1.805	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CCCCCC(=O)NNC(=O)c2cccc(C)n2)n1	794081300	BMVRXWBOYNKDRD-UHFFFAOYSA-N	426.477	1.266	50	20	IDGD	
Cc1[nH]c(-c2ccncc2)nc(=O)c1CC(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	794717798	BMJQIRMPCKUEEG-UHFFFAOYSA-N	442.501	1.076	50	20	IDGD	
O=C(NNC(=O)c1occ2c1CCOC2)c1cccc(S(=O)(=O)N2CCCCC2)c1	794741462	NMBXKSKYLINMPB-UHFFFAOYSA-N	433.486	1.602	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H]2CN(CC(=O)NNC(=O)c3ccc(C#N)cc3)CC[C@H]21	795134532	WYLNUOVKDFNAGT-QZTJIDSGSA-N	427.505	1.651	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)c1cc2sc(N3CCCC3)nc2s1	795181206	JKIZLZKDZHQFEG-UHFFFAOYSA-N	430.515	1.544	50	20	IDGD	
COC(=O)c1cc(F)cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)c1F	796989282	DMQZCPZHMGEYFQ-VIFPVBQESA-N	439.346	1.444	50	20	IDGD	
Cc1ccc(F)c(NC(=O)C(=O)NNC(=O)COc2ccccc2O)c1Br	797004000	FXIGRIWFDONKNK-UHFFFAOYSA-N	440.225	1.767	50	20	IDGD	
O=C(NNc1ncncc1Cl)C(=O)Nc1ccc(Cl)c(CN2CCOCC2)c1	797537303	HYJGUBWEOHSHNZ-UHFFFAOYSA-N	425.276	1.697	50	20	IDGD	
CC1=C(C(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)[C@@H](C)n2ncnc2N1C	798992535	CUPPUAKICAOCIZ-CQSZACIVSA-N	448.528	1.199	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N(C)[C@H](C)c2ccc(S(N)(=O)=O)cc2)c(OC)c1	799920464	GSACPASKIUBBGV-GFCCVEGCSA-N	436.490	1.399	50	20	IDGD	
COc1cccc(C(=O)NNS(=O)(=O)c2cc(Br)cnc2Cl)c1O	800834846	YDDCWZDFCCPGIR-UHFFFAOYSA-N	436.671	1.835	50	20	IDGD	
COc1ccc(C2=NO[C@H](CNC(=O)NNC(=O)COc3ccccc3C#N)C2)cc1F	802344858	YJSAYALVFDRKAZ-HNNXBMFYSA-N	441.419	1.608	50	20	IDGD	
CCc1nnc(NC(=O)[C@@H](C)[C@H](C)NC(=O)NNC(=O)c2c(C)nc3ccccn23)s1	804867892	NTEITFYIJFXZDI-QWRGUYRKSA-N	444.521	1.664	50	20	IDGD	
COC(=O)CC[C@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)c1c(C)nc2ccccn12	806345425	XOJVYYUQLPEBGP-ZDUSSCGKSA-N	433.465	1.250	50	20	IDGD	
O=C(NNc1c(F)cc(F)cc1Br)NC1CCC2(CC1)NC(=O)NC2=O	807546528	WEBXMPBBTFSSAO-UHFFFAOYSA-N	432.225	1.874	50	20	IDGD	
C/C=C(\CC)C(=O)NNC(=O)C[C@H]1c2cc(OC)c(OC)cc2CCN1S(C)(=O)=O	809999858	TVVSJZRWTWWGGK-XNWJVHIKSA-N	439.534	1.456	50	20	IDGD	
COC(=O)Cc1cccc(S(=O)(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)c1	811675634	KDMBPGPORSPZJS-UHFFFAOYSA-N	438.458	1.051	50	20	IDGD	
Cc1c(Cl)c(C(F)(F)F)nn1CC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	813368092	VZAPYQGZSYVMCN-UHFFFAOYSA-N	428.762	1.301	50	20	IDGD	
CCCS(=O)(=O)Nc1cccc(NC(=O)NNC(=O)[C@@H]2CCc3nncn3C2)c1C	814633144	AXFOKCSEUFDCIP-CYBMUJFWSA-N	435.510	1.154	50	20	IDGD	
CS(=O)(=O)c1ccc(-c2csc(CC(=O)NNC(=O)NCc3ccco3)n2)cc1	815113288	WQEXPKFDUYWDSE-UHFFFAOYSA-N	434.499	1.880	50	20	IDGD	
CCOC(=O)c1nc(NC(=O)C(=O)NNC(=O)C(C)(C)c2ccccc2)sc1C(C)=O	815569497	WKOLTWWIEUUXQW-UHFFFAOYSA-N	446.485	1.586	50	20	IDGD	
COc1ccc(C(=O)N2CCCCCC2)cc1NC(=O)C(=O)NNc1ncncc1F	815765128	GWBLSHWZTHFVEF-UHFFFAOYSA-N	430.440	1.722	50	20	IDGD	
CCOc1ccc(NNC(=O)C(=O)Nc2ccc(S(=O)(=O)N3CCOCC3)cc2)cc1	815816801	ODVBVXVLTUALNK-UHFFFAOYSA-N	448.501	1.188	50	20	IDGD	
O=C(NCc1ccccc1)NC1(C(=O)NNC(=O)[C@H]2COc3ccccc3O2)CCCC1	876140169	WWVUHJUUMKTKNO-LJQANCHMSA-N	438.484	1.786	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)CC(C)C)N(S(C)(=O)=O)CC2	913161855	ZLFSGKJXUQYJDN-OAHLLOKOSA-N	427.523	1.146	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCCCOc1ccccc1F	914533682	INKRHCNEBWXRKJ-UHFFFAOYSA-N	437.497	1.840	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)[C@@H]2CC(=O)N(C3CCCCC3)C2)c2ccccc2c1=O	914713107	HVASSYAAFAGDBE-OAHLLOKOSA-N	439.516	1.749	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)[C@@H]2CCCCN2S(=O)(=O)c2cccs2)cc1	915689585	QLJKHHTWKDJVCS-INIZCTEOSA-N	437.543	1.826	50	20	IDGD	
O=C(NCCCN1CCN(c2ccccc2)CC1)NNC(=O)[C@@H]1COc2ccccc2O1	916489041	LHVWDCMCPBMEBJ-NRFANRHFSA-N	439.516	1.369	50	20	IDGD	
COc1cc(CNC(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)ccc1OCCO	918229070	WIVBUVYYPIEPEY-INIZCTEOSA-N	431.489	1.981	50	20	IDGD	
O=C(NNC(=O)C1(S(=O)(=O)c2ccc(Cl)cc2)CC1)[C@H]1COc2ccccc2O1	919689811	CTHQIUDWFKQTBI-MRXNPFEDSA-N	436.873	1.634	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)NC1CCN(CC(=O)Nc2ccccc2)CC1	919901378	NIEXTUUAHWXCTI-UHFFFAOYSA-N	439.516	1.671	50	20	IDGD	
CCOc1ccc(C(=O)NNS(=O)(=O)c2ccc(F)c(S(C)(=O)=O)c2)cc1OC	920310413	PJJHGYUKMOAFDC-UHFFFAOYSA-N	446.478	1.260	50	20	IDGD	
CC(=NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)c1cccc(OCC(=O)N(C)C)c1	920482645	PANMSABWYZXWIY-UHFFFAOYSA-N	446.529	1.558	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N[C@H](C)Cn2ccnc2)cc1	920850660	CIXFYOHNSJJISP-YCPFAOKUSA-N	447.499	1.742	50	20	IDGD	
Cn1cc(N2CC[C@@H](NC(=O)NNC(=O)COc3ccc(Br)cc3)C2)cn1	1116092159	BBWHTJAEOMYFSR-CYBMUJFWSA-N	437.298	1.171	50	20	IDGD	
O=C(NNC(=O)c1ccccc1Cl)Nc1ccc(S(=O)(=O)N2CCOCC2)cn1	1116678003	NXTJNZBASZVHFM-UHFFFAOYSA-N	439.881	1.222	50	20	IDGD	
Cc1c(Br)cc(C(=O)NNC(=O)c2cncn2-c2ccccc2)c(=O)n1C	1116778173	XDDSNFYXCWUFRG-UHFFFAOYSA-N	430.262	1.717	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(/C#N)C(=O)N2CCS(=O)(=O)C[C@H]2C(=O)OC)c1C	1121236916	GECAJNZTNAPZRX-NBDTWVDXSA-N	437.518	1.018	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N[C@@H]2CCN(c3cc(OC)cc(OC)c3)C2=O)cc1	1252519359	WKAXYUSPUWTEND-GOSISDBHSA-N	428.445	1.462	50	20	IDGD	
C[C@](O)(Cn1cc(C(F)(F)F)ccc1=O)C(=O)NNC(=O)c1cncn1-c1ccccc1	1344337245	ZHFPAFSRSFFKKE-IBGZPJMESA-N	449.389	1.265	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc4ccc(OC)cc4[nH]3)C2)C1	1777771316	YKVYOGLPAKNGON-KKSFZXQISA-N	435.908	1.874	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4c(c3)n(C)c(=O)n4C)C2)C1	1777867690	QXADGSXHICDMLI-QVKFZJNVSA-N	434.924	1.338	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnc4[nH]ncc4c3)C2)C1	1778417668	CHWKKXAMMTXLRF-KSSFIOAISA-N	436.310	1.575	50	20	IDGD	
O=C(c1c[nH]c2cccc(Cl)c12)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1778752356	SULFCRAMSQFTQV-DNVCBOLYSA-N	426.300	1.865	50	20	IDGD	
CC[C@H]1CC[C@H](C(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)CC1	1779034138	OHUILDFSYYCABC-QQMNAOGKSA-N	443.548	1.345	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc3cn[nH]c3cn2)C1	1779194642	IFTFZBRXLLFNIW-JNAXZKDPSA-N	435.912	1.339	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1CCc3ccccc3[C@@H]1O)CCO2	1779294435	GCEFCMWYHLBLGT-NWSQWKLXSA-N	446.620	1.964	50	20	IDGD	
Cc1ccc(=O)n(C(C)(C)C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](F)Cl)C3)n1	1779506920	MUWYFBSKSHUJLF-AKCHCHLHSA-N	442.919	1.335	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(-c4ccccn4)[nH]n3)C2)C1	1779632293	ZOKRKRIWSIBGHW-ORAYPTAESA-N	448.321	1.699	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccn(C(F)F)n2)C1	1779760960	ZBVRXVCVPXNRFS-WPKBUWHJSA-N	434.871	1.660	50	20	IDGD	
COc1cc(C#N)cc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)c1	1780172915	KWOMPJQIYBIFOG-MAUKXSAKSA-N	440.269	1.701	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc([N+](=O)[O-])[nH]3)C2)C1	1780418742	CGKMWMYLTMQKKW-BZNIZROVSA-N	429.271	1.540	50	20	IDGD	
CCOc1ccc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)nn1	1780426000	CJIOBUCIBYVXCW-MSOLQXFVSA-N	431.320	1.555	50	20	IDGD	
CN(C)c1ccc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)cc1	1780728136	ODQBUDVHRSRVQM-YJBOKZPZSA-N	428.302	1.887	50	20	IDGD	
COc1cc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](F)Br)C2)n(C)n1	1780771031	QRQJGFHUWVHVTH-HACGYAERSA-N	447.305	1.247	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)c3[nH]nc4ncccc34)CCO2)C1	1781226791	ACQSIXVPHCRPHG-QZTJIDSGSA-N	426.304	1.638	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)c3ccccc3C(N)=O)CCO2)C1	1781234699	PXAVZOMLIODYKN-OALUTQOASA-N	428.316	1.465	50	20	IDGD	
Cc1nn(C)c(C)c1CC(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781333548	FTQXJKZGHWCXCQ-WBVHZDCISA-N	431.306	1.100	50	20	IDGD	
Cc1ccc(CCC(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](O)CCl)C3)c(C)n1	1782420555	MGSFGKWHHRMLDD-WOIUINJBSA-N	437.968	1.745	50	20	IDGD	
O=C(CCCn1ccnc1)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Br)C2	1782487544	MHMTUTYFRPHXDS-UWWQBHOKSA-N	445.333	1.868	50	20	IDGD	
C#CCO[C@H](C)C(=O)N1CCO[C@]2(CCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1	1782861972	NNYAUKJLLNAIQM-RRUNJLRJSA-N	443.450	1.740	50	20	IDGD	
COc1cccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](O)CCl)C3)c1F	1783088642	ARQCXFREGDUIMO-YYFZDKIDSA-N	428.888	1.562	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)Cc3cccc([N+](=O)[O-])c3)CCO2)C1	1783527230	ALKQUCAKCBSILG-ACJLOTCBSA-N	440.294	1.751	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccccc3-n3nccn3)CCO2)C1	1783537789	RLKAPYHHWQHWOI-IFXJQAMLSA-N	448.321	1.494	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(C)(C)CCl)[C@H]2C1)[C@H]1SC(=N)NC1=O	1783850410	HLVVIAAHXRFJDW-HTVCTNPSSA-N	444.985	1.034	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3c[nH]c4cccc(OC)c34)CCO2)C1	1783880605	FYPAGDLGEFCCAB-YCRPNKLZSA-N	435.908	1.874	50	20	IDGD	
CCn1nc(C(C)C)cc1C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](Cl)COC)C2)C1	1783881690	MIMICIJAGFFJPQ-FOIQADDNSA-N	426.945	1.724	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cc(C)c(C(=O)O)c(C)c3)CCO2)C1	1783882838	QZIGWKSRRFKXLD-IIBYNOLFSA-N	438.908	1.699	50	20	IDGD	
Cc1cc2cc(C(=O)N3CCO[C@@]4(CCN(C(=O)CCC(=O)NN(C)C)C4)C3)ccc2[nH]1	1783936169	DXNMDMMOJUTJHY-HSZRJFAPSA-N	441.532	1.293	50	20	IDGD	
CC(C)c1nn2ccccc2c1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]2C1	1784089741	HBQMZYNRTKWKGD-LAQRGFTBSA-N	448.951	1.651	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3ccc[nH]3)[C@H]2C1	1787022558	KGVQHMRNPFWBTH-OHFALNGGSA-N	426.355	1.958	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)c1cccc2nc[nH]c12	1787295867	LSNSKVQKGNSBBC-NOLJZWGESA-N	435.322	1.941	50	20	IDGD	
C[C@@H](Cn1ccnc1)C(=O)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1	1788143855	ZCQXJPOHSRDILZ-KRWDZBQOSA-N	446.316	1.647	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3n[nH]c4ccc(F)cc34)[C@H]2C1	1788388267	GOTBQTNZOKUMHV-RMIITELYSA-N	438.887	1.549	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3c[nH]c4cnccc34)C[C@@H]21)[C@@H](F)Br	1789926170	PPGWJXLPXGPXTL-NHJBHEPMSA-N	439.285	1.847	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3cnccn3)C[C@@H]21)[C@H](F)Br	1789927565	ZANRBMAPQNFDRD-PCBIJLKTSA-N	429.290	1.079	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C(=C/c3ccco3)NC(C)=O)[C@H]2C1	1790180598	AATUKSLPHWYZPB-FQMHSQOMSA-N	437.924	1.754	50	20	IDGD	
O=C([C@H](O)CCl)N1CC[C@H]2CO[C@@H](CNC(=O)C3(c4ccc(Cl)cc4)CC3)[C@H]2C1	1790751333	ZBIQDZAZHJDCFU-RUGDWHBFSA-N	441.355	1.951	50	20	IDGD	
CC(C)c1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]3C2)cc1	1791290675	JYZMFDPEEXAJAO-ACRUOGEOSA-N	444.576	1.776	50	20	IDGD	
COC(=O)c1ccc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]3C2)s1	1791296721	WTLZBOCKFXVMQB-DRZSPHRISA-N	449.356	1.861	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(CO)c(F)c3)[C@H]2C1	1792092525	FCQAZGJTXKSAQI-OVWQWFNUSA-N	428.888	1.165	50	20	IDGD	
CCC[C@H](NC(C)=O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)Br)C[C@@H]21	1792189461	VMTSSUJWUBHLNI-DGVSKKNDSA-N	432.359	1.054	50	20	IDGD	
Cc1c[nH]c(C)c1CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2	1793101587	FJSMAEWLHVPCLZ-DLTLXFJOSA-N	430.318	1.844	50	20	IDGD	
Cc1nn2cc(CC(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)C(Cl)Cl)C4)nc2s1	1793666249	HMFZWKWCUFHGMF-DDFAGTSDSA-N	432.333	1.035	50	20	IDGD	
COc1ncccc1CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CO[Si](C)(C)C)C2	1794096208	ZSXSZEIUSYDVAK-XEMDLRDOSA-N	435.597	1.464	50	20	IDGD	
Cn1c(=O)n(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CCBr)c2ccccc21	1795492540	PEADDASHPDULLR-QDMKHBRRSA-N	449.349	1.763	50	20	IDGD	
C[C@H](Nc1nccs1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@](C)(Cl)CCl)C2	1796414934	HCADKCMSWSAQIX-QLLRCSDMSA-N	435.377	1.769	50	20	IDGD	
COc1ncc(Cl)cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CO[Si](C)(C)C	1797953204	UCGGOKYLJSJYFI-FVCICTRLSA-N	441.988	1.798	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2cc[nH]c2cc1F	1799277392	VYKDEVDYVGHNAE-MUJYYYPQSA-N	429.496	1.932	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(F)c1[N+](=O)[O-])C2)[C@@H](F)Br	1799349248	SFUWYHBPRUEDPP-XSPYEYLBSA-N	448.220	1.628	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccccc1-n1nccn1	1799672027	ZBKFMQFRGXNXDG-VWPFQQQWSA-N	448.321	1.254	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccccc1O)C2	1800644454	UNEFKUDFOBJMMQ-KRXQYRFLSA-N	425.323	1.698	50	20	IDGD	
O=C(Cc1ccc(F)cc1F)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2	1800659554	LHOUJVKJRLYUGF-OXUXUCFPSA-N	435.240	1.787	50	20	IDGD	
CC(=O)N[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(Cl)Cl)c1ccc(F)cc1	1801016387	HGUSFWZUTVHNNR-XRGAULLZSA-N	446.306	1.396	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cn1cnnn1)C2	1801436321	IRIDWNSIEBJPEH-SELDRTEESA-N	427.415	1.197	50	20	IDGD	
O=C1Cc2cccc(C(=O)N3CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]3c3cccnc3)c2N1	1803146375	AOOURBOKANHFHZ-WRWLIDTKSA-N	442.903	1.496	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)CNCP(=O)(O)O)[C@H]1c1cccnc1	1803688440	BOYXWJKIHRNKKW-ZOBUZTSGSA-N	446.872	1.220	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)C1CCCCC1	1806223907	CBANRYTWGILEQM-UNMCSNQZSA-N	435.333	1.661	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)C(F)F)[C@@H]1c1cccnc1	1806431450	JUUGJPZKNVQKQB-LTNORGLKSA-N	432.431	1.487	50	20	IDGD	
C[C@H](Nc1cccnc1)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1	1807149632	AJNRVVFONPWHJJ-OYSPMZIOSA-N	431.924	1.583	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)c2cc[nH]n2)[C@@H]1c1cccnc1	1808407791	DQEJDDBRWKJTID-RUVVGEKZSA-N	448.487	1.258	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@H](CNC(=O)c2cc[n+]([O-])cc2)[C@@H]1c1cccnc1	1811193965	QIZLFRWYVLKNIV-ICSRJNTNSA-N	428.565	1.886	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2nn(C)c3c2CCC3)[C@H]1c1cccnc1	1813030158	GOBYFTBACCDNCD-KNBMTAEXSA-N	445.951	1.877	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)CC2CCOCC2)[C@@H]1c1cccnc1	1813071474	QVRNLIHLEHSSFS-AUSIDOKSSA-N	445.564	1.277	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@@H](CNC(=O)CCn2cncn2)[C@H]1c1cccnc1	1813316866	YDCUVXRHAVFPGN-UWWQBHOKSA-N	449.353	1.800	50	20	IDGD	
CC(C)(CCl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1814693943	KUNCIWHTWAVHJQ-MRXNPFEDSA-N	432.717	1.660	50	20	IDGD	
COc1nccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)[C@H](O)CCl)n[nH]2)c1F	1814870528	VSMDZBNEPIDVMN-CHWSQXEVSA-N	425.848	1.858	50	20	IDGD	
C[C@H](CC(N)=O)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](C)CBr)[nH]n1	1815291552	OOLUMCPDWHVSJZ-MDZLAQPJSA-N	428.331	1.944	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)C1CCCCC1)CC2)c1ccc(B(O)O)cc1	1815339716	MZSFVDMLKIJPGS-INIZCTEOSA-N	427.335	1.629	50	20	IDGD	
O=C(Cc1ccccc1)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1	1815339906	TXRKLRDVXUSKAL-QGZVFWFLSA-N	435.314	1.291	50	20	IDGD	
C=C(C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1)C(F)(F)F	1815348020	BOSNJPKNMSHNGG-GFCCVEGCSA-N	439.224	1.167	50	20	IDGD	
COC[C@H](NC(C)=O)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](F)Br)[nH]n1	1819611826	NUNSKBNIIWTARU-OUCADQQQSA-N	448.293	1.243	50	20	IDGD	
CC(=O)N(C)[C@@H](C)C(=O)N[C@H]1CCc2nc(NC(=O)CO[Si](C)(C)C)sc2C1	1820164725	GFURLKFEYHYXPV-AAEUAGOBSA-N	426.615	1.773	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cnc(O)nc2O)[nH]n1)[C@H](F)Br	1820932959	WKZJJDRIVQNQDS-KOLCDFICSA-N	443.233	1.607	50	20	IDGD	
CCNC(=S)NCC(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](F)Br)n[nH]1	1820936986	LBZXXOYIBOVCJB-GWCFXTLKSA-N	449.350	1.576	50	20	IDGD	
Cc1cn(CC(=O)N2CCCC[C@H]2c2cc(NC(=O)C(Cl)Cl)n[nH]2)c(=O)nc1O	1822423161	ORTTXAGFZJPZRG-NSHDSACASA-N	443.291	1.476	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](Br)CC)sc2C1	1825445891	LDYNCKRXGDDCDL-MXWKQRLJSA-N	443.367	1.919	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(O)n2)CC1	1825945727	ANWKULLCQSKEJO-GOSISDBHSA-N	431.537	1.394	50	20	IDGD	
O=C(CNC(=O)c1ccco1)N[C@@H]1CCc2nc(NC(=O)C(Cl)Cl)sc2C1	1826098994	NRLJPYYZPAORFW-MRVPVSSYSA-N	431.301	1.882	50	20	IDGD	
CSCC(C)(C)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827050259	LGCUWFJWEHUTNH-HXUWFJFHSA-N	446.422	1.989	50	20	IDGD	
Cc1cnc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)cn1	1827051360	VDUVXPZBFXUYCO-NRFANRHFSA-N	436.321	1.012	50	20	IDGD	
O=C(c1cncc(F)c1)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827051363	VGXUFLWOTGZUJQ-OAQYLSRUSA-N	439.296	1.448	50	20	IDGD	
Cc1ccc(CC(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cccc(B(O)O)c2)CC3)o1	1827081152	YRVILFFMESJNDU-HNNXBMFYSA-N	439.302	1.193	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H]2CCCO2)CC1	1827679434	CHFAFVSRPFPMKC-LZVXGSKFSA-N	443.548	1.919	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)on1	1830537797	OVNVHJFBWXSEAH-SJKOYZFVSA-N	430.299	1.084	50	20	IDGD	
O=C(Cc1c(F)cccc1Cl)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1830720001	QQOUPWCRBRSVHV-LPHOPBHVSA-N	449.306	1.078	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3c[nH]c4nccc-4c3)C2)C1	1831647805	YZMLMRKFWLTJMD-LAUBAEHRSA-N	434.924	1.992	50	20	IDGD	
Cc1cc(CC(=O)N2CCC([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)no1	1831876498	GPSHZWNEHAETIE-IBGZPJMESA-N	433.553	1.518	50	20	IDGD	
Cc1cc(CC(=O)N2CCCC[C@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)no1	1832135934	UITIPEJPEFNGHG-IBGZPJMESA-N	433.553	1.518	50	20	IDGD	
O=C(Cc1ccc(Cl)s1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1	1832599505	CLCNZMKTMKXAMF-GUYCJALGSA-N	437.345	1.000	50	20	IDGD	
O=C(/C=C/c1cccnc1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1833103605	WSGFITGTPGWATM-CMDLKFMISA-N	442.285	1.242	50	20	IDGD	
O=C(c1nc(Cl)ccc1F)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1833245456	WRXBAZGFQZIWGL-MRXNPFEDSA-N	440.686	1.748	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)CCc3cc(F)ccn3)CC2)CC1)[C@@H](O)CCl	1833308606	XBKLHRGZCIDDQL-IBGZPJMESA-N	440.947	1.325	50	20	IDGD	
Cc1cc(C(=O)N2CCC(N3CCC(NC(=O)[C@@H](O)CCl)CC3)CC2)cc(C)c1O	1833313090	VAZCANQUWRUGJS-IBGZPJMESA-N	437.968	1.794	50	20	IDGD	
CC[C@H](C)[C@@H](O)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)CBr)CC2)CC1	1833494549	DRJRDHPIWOCSIA-RLFYNMQTSA-N	446.430	1.996	50	20	IDGD	
CCc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@](C)(Cl)CCl)C3)C2)cn1	1833892837	UWUJXXXAWCHHKU-UXHICEINSA-N	444.359	1.950	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cc4n(n3)CCCO4)CC2)CC1)[C@H](F)Cl	1835080639	RQEGLEXTQQKEEG-KRWDZBQOSA-N	427.908	1.385	50	20	IDGD	
CC(C)n1cnc(C(=O)NC2CCN(C3CCN(C(=O)C(Cl)Cl)CC3)CC2)n1	1835205694	LKGBVKFPWIKAMJ-UHFFFAOYSA-N	431.368	1.848	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CNc3ccc(F)cc3)CCO2)C1	1835583165	JQNFHYCBLVCRQC-XLIONFOSSA-N	427.904	1.711	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnc4[nH]ncc4c3)CCO2)C1	1836807727	CKTOFWBFBFLFSA-JXFKEZNVSA-N	435.912	1.435	50	20	IDGD	
NC(=O)c1ncccc1C(=O)N1CCC(OC2CCN(C(=O)[C@H](F)Cl)CC2)CC1	1837249296	HGMHAWCVWURHQP-INIZCTEOSA-N	426.876	1.327	50	20	IDGD	
O=C(CCBr)N1CCC(OC2CCN(C(=O)c3cnsn3)CC2)CC1	1837295127	XDHHHGFYRLOIBW-UHFFFAOYSA-N	431.356	1.935	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3nc(C)c(C)s3)CCO2)C1	1838411960	RXFCVYLAFYIKEF-RDTXWAMCSA-N	431.942	1.084	50	20	IDGD	
O=C(C(Cl)Cl)N1CCC(OC2CCN(C(=O)[C@@H]3CCCS3(=O)=O)CC2)CC1	1838739859	AUEDRGACWJIJHD-AWEZNQCLSA-N	441.377	1.366	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3snnc3C3CC3)C2)C1	1839144916	OHXVYTGRIUEGAK-ACJLOTCBSA-N	428.942	1.503	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4c(c3)CC(=O)N4)C2)C1	1839146457	ZHNSVGCEEGFRBQ-HRAATJIYSA-N	435.908	1.269	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(F)n3)C2)C1	1839153517	IXCGIHYQVNJIIQ-ZWKOTPCHSA-N	434.295	1.527	50	20	IDGD	
O=C(/C=C/c1ccccc1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839198825	CDZAVIBCMIBRPK-JISXSJDESA-N	441.297	1.847	50	20	IDGD	
C[C@H](Cc1ccc(F)cc1)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1	1839762967	LSDIRNAIDBZTCV-FYINFDKHSA-N	442.915	1.060	50	20	IDGD	
COc1cscc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)Br)CCO2	1840032924	NPKKINFKLMRBBM-SJCJKPOMSA-N	447.351	1.610	50	20	IDGD	
Cc1ccc(F)c(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)c1	1840035656	ZMZAUJSAQIANMY-IFXJQAMLSA-N	443.313	1.988	50	20	IDGD	
C[C@H](Cc1ccco1)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1840471697	HBUQSFQSZDCLGF-QIIPPGSGSA-N	447.301	1.605	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(F)c(OC)c3)CCO2)C1	1840683316	FBEPXYZXWBLPKM-FOIQADDNSA-N	444.887	1.158	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@]1(C)C(=O)N1CCCC12CN(C(=O)[C@H](O)CCl)C2	1841774444	FDOYTWXPTSBNHW-KUHUBIRLSA-N	429.945	1.579	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC2(CCCN2C(=O)[C@H]2CCc3nc(O)nc(O)c3C2)C1	1842058367	FYUUQJMICVFFCE-VOJFVSQTSA-N	443.331	1.432	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2ccc(C(F)(F)F)[nH]2)C1	1844399701	VEYJNSAHBOOCOE-UHFFFAOYSA-N	436.394	1.163	50	20	IDGD	
O=C([C@H]1C[C@@]12C(=O)Nc1ccccc12)N1CC2(CCCN2C(=O)[C@H](F)Br)C1	1845219614	AIJIEIAWCBQOKM-UHYGZKCKSA-N	436.281	1.790	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)[C@@H]1CCc3cccc(Cl)c31)C2	1846385926	MKEOADAVOBNWAJ-MRXNPFEDSA-N	432.952	1.946	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@]2(O)CCN(C(=O)OC(C)(C)C)C2)C1	1846412026	JVKGFRPEMOKPOR-VLIAUNLRSA-N	429.945	1.579	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)COCCOCCOCCOC	1847868229	XDYCYMBZJNCBCY-BZSNNMDCSA-N	434.961	1.292	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(CNC(=O)NNC(=O)COc2cccc(C)c2)cc1	9863067	XQOIJLWZGPAHTQ-UHFFFAOYSA-N	448.545	1.935	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)c1cccc(S(=O)(=O)NC2CC2)c1	10159414	PFMJJULROGNLAC-UHFFFAOYSA-N	441.469	1.093	50	20	IDGD	
CC(=O)N[C@H](CC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)c1cccs1	11329841	NPSCCNVJJCPHMF-LJQANCHMSA-N	443.573	1.675	50	20	IDGD	
COc1ccc(CN2C(=O)c3ccccc3C2=O)cc1C(=O)NNC(=O)c1cccnc1	15507709	LZXOEUUEAOUTJV-UHFFFAOYSA-N	430.420	1.961	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)C2=Cc3ccccc3OC2)c1	15633367	MMBHPBGYCDPIPS-UHFFFAOYSA-N	429.498	1.954	50	20	IDGD	
CC(=O)c1c[nH]c(C(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)c1	17521272	COOIUVZWNFURII-UHFFFAOYSA-N	440.481	1.771	50	20	IDGD	
C[C@H]1Cc2cc(C(=O)NNC(=O)c3cc(Br)c[nH]3)ccc2N1S(C)(=O)=O	24123706	KCQCWBFXQACJOV-VIFPVBQESA-N	441.307	1.563	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCC(C(=O)Nc3cccc(F)c3)CC2)n1	725802611	VDFIXOQLJMSGQL-UHFFFAOYSA-N	433.509	1.631	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNS(=O)(=O)c2sc(NC(C)=O)nc2C)cc1	727351140	GDAUAGSQAHKMAF-NSHDSACASA-N	442.519	1.586	50	20	IDGD	
O=C(NNc1nc(-c2cccnc2)no1)C1CCN(S(=O)(=O)c2cccnc2)CC1	728076777	ILYGGRCHKVGWAA-UHFFFAOYSA-N	429.462	1.071	50	20	IDGD	
C[C@@H](C(=O)N(C)CC(=O)NNC(=O)c1cc(F)ccc1Br)n1cccn1	728546085	NAITXWHVDRPWKS-JTQLQIEISA-N	426.246	1.265	50	20	IDGD	
CN(Cc1ccn(-c2ccccc2)n1)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	728961718	MPOYGGNGIAJCAF-UHFFFAOYSA-N	434.504	1.752	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCCN1CCOC[C@H]1C	729614199	JQYCREMEMYARFR-CHWSQXEVSA-N	429.315	1.268	50	20	IDGD	
O=C(NNC(=O)C1CCC1)c1cc(S(=O)(=O)N2CCCC2)ccc1Br	732140705	APXSJMFJXKKFDE-UHFFFAOYSA-N	430.324	1.795	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)N[C@@H]1CCN(c2ccccc2Cl)C1=O	732236426	VTBCRXRCMLWOIP-OAHLLOKOSA-N	440.851	1.065	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCCNC(=O)c2cccnc2)cc1Br	732255477	GJTLUYSSBXDWIT-UHFFFAOYSA-N	436.266	1.227	50	20	IDGD	
COC(=O)c1cc(OC(=O)CN2C(=O)N[C@](C)(c3ccccc3)C2=O)ccc1[N+](=O)[O-]	732653015	BDKINMHCNRRQLH-HXUWFJFHSA-N	427.369	1.754	50	20	IDGD	
COC(=O)COc1ccc(S(=O)(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1	733123191	WZDQMFOVMSIINK-UHFFFAOYSA-N	430.442	1.047	50	20	IDGD	
CN(C)C(=O)COc1cccc(CNC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c1	733339032	GUFOCNZREUHHTJ-UHFFFAOYSA-N	436.472	1.484	50	20	IDGD	
CC(C)OCCCn1c(NNC(=O)c2ccc3c(c2)C(=O)NC3=O)nc2ccccc2c1=O	733361749	AEXLRYMEJISMLB-UHFFFAOYSA-N	449.467	1.852	50	20	IDGD	
O=C(NNC(=O)c1c(Cl)cccc1Cl)N[C@@H]1CCN(CCN2CCOCC2)C1	734686961	ZCJRMFQYHHYMMU-CYBMUJFWSA-N	430.336	1.344	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)N[C@@H]2CC(=O)N(c3ccc(Oc4ccccc4)cc3)C2)cn1	735583218	WNRVXDKYZOMMJJ-MRXNPFEDSA-N	434.456	1.962	50	20	IDGD	
O=C(CNC(=O)c1ccccc1I)NNc1ccc(Cl)nn1	735688618	DCPJXEORKPNMAY-UHFFFAOYSA-N	431.621	1.608	50	20	IDGD	
Cc1nn(CCCl)c(C)c1C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	735834330	PMHPITJILMJHKJ-UHFFFAOYSA-N	427.914	1.064	50	20	IDGD	
O=C(Oc1ccc([N+](=O)[O-])cc1Br)[C@@H]1CC(=O)N([C@H]2CCS(=O)(=O)C2)C1	739311487	QBZMPBOWBZOLSQ-KOLCDFICSA-N	447.263	1.298	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2Br)C[C@@H](C)O1	740075402	HDJVTILVABFEKA-GHMZBOCLSA-N	429.271	1.618	50	20	IDGD	
O=C(COC(=O)c1cccc(OCC(F)(F)F)n1)NNC(=O)c1cccc([N+](=O)[O-])c1	740422582	QJMQNIUDRSKYMS-UHFFFAOYSA-N	442.306	1.549	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)[C@H]1CCCN(C(=O)COc2ccccc2)C1	741190867	GVCILBDPOUEQLW-IBGZPJMESA-N	425.485	1.668	50	20	IDGD	
CS(=O)(=O)CC[C@@H](Cc1cccc(Br)c1)C(=O)NNc1cnccn1	741283680	DLFHGNMASATIFZ-ZDUSSCGKSA-N	427.324	1.976	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)Cn2c(-c3cccc(Br)c3)noc2=O)c1	741853142	PRZZCNMGBRUJDS-UHFFFAOYSA-N	442.229	1.599	50	20	IDGD	
O=C(CCNc1ncc(C(F)(F)F)cc1Cl)NNC(=O)N[C@H]1CCS(=O)(=O)C1	742056306	ZRNFAHDSTZPEEJ-VIFPVBQESA-N	443.835	1.073	50	20	IDGD	
O=C(NNC(=O)c1nc2ncc(Br)cn2n1)Nc1ccc(OC(F)F)cc1	743832446	SLHYAXHWSVEVAX-UHFFFAOYSA-N	442.180	1.955	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCCN1c2ccccc2C[C@H]1C	744277809	NSHFUHLDWJBYOP-CQSZACIVSA-N	444.561	1.683	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)c2nn(CC(C)C)c(=O)c3ccccc23)c1	744560213	MDTZLYNBMRJUCZ-UHFFFAOYSA-N	436.468	1.979	50	20	IDGD	
O=C(COC(=O)[C@@H]1SCCc2sccc21)NNC(=O)[C@H]1COc2ccccc2O1	745636812	OCQBVNHYDXZWIJ-RHSMWYFYSA-N	434.495	1.609	50	20	IDGD	
C[C@]1(NNC(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2=O)CCS(=O)(=O)C1	745875097	KXNIMDKDFJXMHF-KSSFIOAISA-N	446.476	1.164	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)c1cccc(CS(=O)(=O)NC(C)(C)C)c1	746385421	CAAFXCHFRCBKPR-UHFFFAOYSA-N	443.529	1.935	50	20	IDGD	
C[C@H]1C[C@H](C)CN(C(=O)CN2CCN(C(=O)NNC(=O)c3ccc(C#N)cc3)CC2)C1	747102149	ANOZGFXOVGMBQZ-IRXDYDNUSA-N	426.521	1.035	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@@H]1CCCN1C(=O)CC(C)(C)C	748211951	APVYGSFORUUARX-AWEZNQCLSA-N	437.566	1.476	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(C(=O)c3cc[nH]c3)cc2)c1	748688868	CKJHMBGPAUNSEG-UHFFFAOYSA-N	440.481	1.571	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NN=Cc1ccn(C)c1)N(S(C)(=O)=O)CC2	749854255	JTWFCIXAIRVVLX-KRWDZBQOSA-N	434.518	1.442	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@@H](C(=O)OCC(=O)NNC(=O)c2cc(Cl)ccc2OC)C1	750921615	KERVWDRSOAHGSN-VXGBXAGGSA-N	426.853	1.632	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)c2ccc(Br)cc2[N+](=O)[O-])c1	750968439	SBAKCKBSDJICOR-UHFFFAOYSA-N	447.201	1.847	50	20	IDGD	
CCCNC(=O)Nc1ccc(CC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1	751324436	FTIRRQNNUQGLSY-UHFFFAOYSA-N	432.502	1.625	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)c2cc(S(N)(=O)=O)cc(C)c2C)cc1	751545870	GXACWNVXOJDDBD-AWEZNQCLSA-N	435.502	1.578	50	20	IDGD	
COc1cc(N2C[C@@H](C(=O)NNC(=S)N[C@@H](C)C3CC3)CC2=O)cc(OC)c1OC	751619187	LIIYNHHENBBHPL-AAEUAGOBSA-N	436.534	1.359	50	20	IDGD	
COc1cc(NC(=O)CNC(=O)NNC(=O)c2cccc(OC(F)F)c2)cc(OC)c1	752007792	WPHUGTXADFOQEX-UHFFFAOYSA-N	438.387	1.888	50	20	IDGD	
C[C@@H]1C[C@@H](CCNC(=O)NNC(=O)CNC(=O)c2ccco2)CN1Cc1ccccc1	753046579	MAQVVLIGLVOGNO-SJLPKXTDSA-N	427.505	1.641	50	20	IDGD	
CC1(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)CCOCC1	753552043	RTABBIAHMSNCFI-UHFFFAOYSA-N	438.550	1.622	50	20	IDGD	
C[C@H](CS(=O)(=O)c1ccc(F)cc1)C(=O)NNC(=O)Cc1nc2ccccc2n1C	755047236	YBKPZHUQKAHEKE-CYBMUJFWSA-N	432.477	1.512	50	20	IDGD	
CCCC[C@H](NC(=O)[C@@H](C)NC(=O)C(C)(C)C)C(=O)NNC(=O)c1ccc(Cl)nc1	755185833	NPKCBXWNHLKAIG-OCCSQVGLSA-N	439.944	1.722	50	20	IDGD	
CCCOc1ccc(C(F)(F)F)cc1NC(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O	755417307	LLPGEJXRQDEPTK-SECBINFHSA-N	426.417	1.585	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2cccc(S(C)(=O)=O)c2)c2ccccc2c1=O	755556017	CTUAELKCHFCLKY-UHFFFAOYSA-N	429.458	1.286	50	20	IDGD	
CC(C)(C)OC(=O)Nc1ccccc1CC(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1	755646592	WYXWXRLBWIJDGM-ZDUSSCGKSA-N	426.495	1.094	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)Nc2ccc(CC(=O)N3CCOCC3)cc2)cc1	755861541	GGORHTXATWTEJG-UHFFFAOYSA-N	442.472	1.328	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)Nc1cccc(C(=O)N2CCOCC2)c1	755933323	KFFIIDXLASYVQW-AWEZNQCLSA-N	430.436	1.918	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)ccc1NC(=O)OC(C)(C)C	755940944	ZBWPZKXCGURXJH-JTQLQIEISA-N	445.498	1.133	50	20	IDGD	
COc1ccccc1N1CC[C@@H](NC(=O)NNC(=O)COc2ccc(C)c(C)c2)C1=O	757285533	KDGOLOKCGDMXKA-QGZVFWFLSA-N	426.473	1.827	50	20	IDGD	
COCC[C@H](Cc1cccc(Br)c1)C(=O)NNC(=O)C(=O)Nc1ccccn1	758835751	YNXWKIHSJLECPQ-CQSZACIVSA-N	449.305	1.825	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc(Br)cc1)NNc1ncccc1[N+](=O)[O-]	759297929	PKZJREYLLJKWBT-UHFFFAOYSA-N	444.267	1.564	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NC[C@H]2CN(Cc3ccccc3)CCCO2)cc1	759341259	FNRHHBVGMOJBNL-NRFANRHFSA-N	442.516	1.696	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)[C@H]2CCCN(S(=O)(=O)c3ccc(C)cc3)C2)nc1	759738481	ILKCKBPZIAWRIK-INIZCTEOSA-N	432.502	1.721	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2cccnc2OCC(F)F)c2ccccc2c1=O	760232640	BVKLZOMCEURCJN-UHFFFAOYSA-N	431.399	1.920	50	20	IDGD	
CC(=O)N[C@H](CC(=O)NNC(=O)CCNC(=O)OC(C)(C)C)c1c(F)cccc1F	760443193	RLYGDKZJKIUXOL-CQSZACIVSA-N	428.436	1.594	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C)c(C)c(NC(=O)C(=O)NNC(=O)C(C)(C)C)c1	761063541	KKDRRIAGGAFHLL-UHFFFAOYSA-N	426.539	1.466	50	20	IDGD	
CC[C@@H](NC(=O)NNc1ccc(-n2cccn2)nn1)[C@H]1CN(Cc2ccccc2)CCO1	761795867	XLPDSQUOWWDUJW-RTBURBONSA-N	436.520	1.968	50	20	IDGD	
O=C(NNc1nccc(N2CCOCC2)n1)C1=Cc2cc(Br)ccc2OC1	762263077	ZEEHZODRLWAASH-UHFFFAOYSA-N	432.278	1.995	50	20	IDGD	
C[C@@H](C(=O)NNc1nccc(N2CCOCC2)n1)N1CCN(c2ccc(F)cc2)CC1	762860695	HIKMZTCFRMYNGE-INIZCTEOSA-N	429.500	1.106	50	20	IDGD	
COc1cc2cc(C(=O)NNc3nccc(N4CCOCC4)n3)[nH]c2c(OC)c1OC	762860814	JRVAOYPVFOVAKQ-UHFFFAOYSA-N	428.449	1.577	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)CCCC[C@@H]3SC[C@H]4NC(=O)N[C@@H]43)n[nH]2)cc1	762952939	OCCVJHJXPRYMCD-AOIWGVFYSA-N	442.545	1.872	50	20	IDGD	
CC(C)C(CNC(=O)c1ccc([N+](=O)[O-])cc1)=NNC(=O)CNC(=O)c1cccnc1	763193548	QRIONQFXMWRCAB-UHFFFAOYSA-N	426.433	1.278	50	20	IDGD	
COC(=O)c1cc(C(C)C)ccc1NC(=O)C(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	763472574	YSPQVMMZQWXDQK-UHFFFAOYSA-N	428.401	1.905	50	20	IDGD	
COc1ccccc1OC[C@@H](C)CNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1	763497275	DRDWGZCFPNLZPV-INIZCTEOSA-N	442.520	1.747	50	20	IDGD	
Cc1cc(C(=O)N2CCSCC2)ccc1NC(=O)C(=O)NNC(=O)c1ccccc1O	763527829	RXZAWQMTRDHGGP-UHFFFAOYSA-N	442.497	1.289	50	20	IDGD	
CNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)COc2ccc(C(C)(C)C)cc2)c1C	763596295	VAIGADQJCACTNG-UHFFFAOYSA-N	440.500	1.817	50	20	IDGD	
CNC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)cc1	763736837	ZXGHGYSRYIMCLD-UHFFFAOYSA-N	428.489	1.114	50	20	IDGD	
CN(C)CCCOc1ccc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCC3)cc1	763783054	ZQEAHKQBSDKRFB-UHFFFAOYSA-N	430.530	1.967	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)C(=O)Nc2cc(CC)on2)c2ccccc2c1=O	763801364	PXYWTSCWOYSPJZ-UHFFFAOYSA-N	426.433	1.147	50	20	IDGD	
COCCOc1ccccc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1cccc(C)c1C	763849743	MSKQFXZIAUFOTQ-INIZCTEOSA-N	429.473	1.882	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cccc(-n3ccnc3)c2)cc1	763862514	XVNBUKPWLYUYBT-OAHLLOKOSA-N	437.456	1.824	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1cccn(CC(F)(F)F)c1=O	763865099	IETHQOTVKPJAPE-JTQLQIEISA-N	444.341	1.103	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1cccc(OC[C@@H]2CCCO2)c1	763866401	PADQMOSUGUAMFI-KUHUBIRLSA-N	445.447	1.937	50	20	IDGD	
CNC(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)on2)c1	764004103	QZDWXWRXAFLJBJ-UHFFFAOYSA-N	441.831	1.754	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3ccc4c(c3)OCCO4)cc2)CCO1	764006710	SYPVQVOJZRHEJK-AWEZNQCLSA-N	440.456	1.083	50	20	IDGD	
O=C(NNC(=O)c1cccc(C(F)(F)F)c1)C(=O)Nc1ccn(Cc2ccncc2)n1	764040859	ONZGHCBVCWSABM-UHFFFAOYSA-N	432.362	1.745	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc([S@](C)=O)c(F)c3)n[nH]2)cc1	764110277	HHRNQBVYQSDWCC-HKBQPEDESA-N	443.460	1.661	50	20	IDGD	
O=C(CN1CCCCCC1)Nc1cccc(NC(=O)C(=O)NNC(=O)c2ccoc2)c1	764165510	ZZUQZJZRKDDNKD-UHFFFAOYSA-N	427.461	1.494	50	20	IDGD	
Cc1cc(Br)c(NC(=O)C(=O)NNC(=O)c2ccc(C#N)cc2)cc1[N+](=O)[O-]	764179554	UQRILPIOXKNYTE-UHFFFAOYSA-N	446.217	1.937	50	20	IDGD	
CC(C)CCNS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)CC2CCCC2)cc1	764185903	XEZXKKDXCVVXQF-UHFFFAOYSA-N	438.550	1.677	50	20	IDGD	
COC(=O)c1ccc(N2CCCC2)c(NC(=O)C(=O)NNC(=O)c2scnc2C)c1	764246466	PTLRYGAKRHPVEG-UHFFFAOYSA-N	431.474	1.238	50	20	IDGD	
COC(=O)c1cc(Br)ccc1NC(=O)C(=O)NNC(=O)c1scnc1C	764247438	XHLDHEQFBMQYAA-UHFFFAOYSA-N	441.263	1.400	50	20	IDGD	
CCN1CCN(c2ccc(NC(=O)C(=O)NNC(=O)c3cccc4ncccc34)cc2)CC1	764258028	SQPOUQVWSXYKBS-UHFFFAOYSA-N	446.511	1.776	50	20	IDGD	
N#Cc1cccnc1-n1cc(NC(=O)C(=O)NNC(=O)c2cccc(OC(F)F)c2)cn1	764259370	FWUPOQAUTQSBRA-UHFFFAOYSA-N	441.354	1.140	50	20	IDGD	
COCCNS(=O)(=O)c1c[nH]c(C(=O)NNc2ccc(Br)c(C)c2)c1	764323506	DAQDGEBOMOBXRN-UHFFFAOYSA-N	431.312	1.767	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)C(=O)Nc1ccc(-n2nccn2)cc1C(F)(F)F	764352704	BPUYVUBNOZFRSL-UHFFFAOYSA-N	433.350	1.010	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)CCC(=O)N2CCN(c3ccccn3)CC2)cc1C	764523032	JRTLABRCOCCFOU-UHFFFAOYSA-N	439.516	1.354	50	20	IDGD	
COCCSc1ccc([N+](=O)[O-])cc1C(=O)NNc1nccc(N2CCOCC2)n1	764653724	DACDEDAHTFJOBO-UHFFFAOYSA-N	434.478	1.717	50	20	IDGD	
NS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)cc1Cl	765569356	GNHYSOPEGHJJBD-UHFFFAOYSA-N	425.879	1.514	50	20	IDGD	
COc1ccc(OC)c(C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)c1	765753214	AXZLXTGTBMXZIS-UHFFFAOYSA-N	446.935	1.936	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1ccc(C(=O)NCCc2ccccc2)cc1	766261387	WZCIXXFQZKQWFL-UHFFFAOYSA-N	434.456	1.540	50	20	IDGD	
COC(=O)c1nccc2c(S(=O)(=O)NNC(=O)c3c(C)nc4ccccn34)cccc12	766308085	OKIRXZPRMZQTGO-UHFFFAOYSA-N	439.453	1.601	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)c1ccc(N2C(=O)CCC2=O)c([N+](=O)[O-])c1	766665701	GVVHUHAJSNDROR-UHFFFAOYSA-N	448.395	1.509	50	20	IDGD	
CC[C@@H](NC(=O)NNc1ccccc1S(C)(=O)=O)c1ccccc1OCC(=O)NC	766878392	CVRYBDRLCLEYCV-OAHLLOKOSA-N	434.518	1.992	50	20	IDGD	
CN(C)CCS(=O)(=O)c1ccccc1C(=O)NNC(=O)c1cc(-c2ccccc2)on1	767204204	KVCPANHOMKQLJK-UHFFFAOYSA-N	442.497	1.752	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)[C@@H](C)c1ccc(S(C)(=O)=O)cc1	768630311	QFGOHEGPCHQOIC-LBPRGKRZSA-N	426.516	1.749	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2ccnc(CNC(=O)OC(C)(C)C)c2)C[C@@H](C)O1	768687986	NVUFKKCDBIJZLT-GASCZTMLSA-N	435.525	1.367	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1cnn(C)c1Cc1ccccc1	770112276	ZDTFOJWMIZNNOZ-UHFFFAOYSA-N	440.529	1.687	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)CCCC[C@@H]3SC[C@@H]4NC(=O)N[C@@H]34)nc21	770967604	XYXUNBYFKGMDTN-SGMGOOAPSA-N	448.553	1.456	50	20	IDGD	
O=C(NNc1ccc(Br)c(F)c1)C1=NN([C@H]2CCS(=O)(=O)C2)C(=O)CC1	771681353	JTWJQANATSVOGH-JTQLQIEISA-N	447.286	1.197	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1cnc(Oc2ccccc2)cn1	773187818	PZYJPZUSTBVFGR-UHFFFAOYSA-N	440.485	1.945	50	20	IDGD	
Cc1ccc(-n2nccc2NC(=O)C(=O)NNC(=O)c2cc(C)nc3ccccc23)nn1	773494448	RURRQBJGMLZJAK-UHFFFAOYSA-N	430.428	1.227	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2cccc(C(=O)N3CCc4ccccc43)c2)n1	773723583	BPRKZPFTZJXDMU-UHFFFAOYSA-N	432.440	1.770	50	20	IDGD	
O=C(NNC(=O)c1cc2c(s1)CCCCC2)N[C@H]1CCO[C@@]2(CCS(=O)(=O)C2)C1	776076514	MDYXZRDTYXYLPV-LIRRHRJNSA-N	441.575	1.697	50	20	IDGD	
Cc1nn(C)c(-n2cccn2)c1C(=O)NNC(=O)[C@H](C)Oc1cccc(Br)c1	778297486	NEMXAWVSKCMVSA-LBPRGKRZSA-N	447.293	1.905	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N[C@@H](C)c2ncon2)cc1	778408978	HOQKVFOQPAPHAB-GRRFOWRYSA-N	435.444	1.601	50	20	IDGD	
COc1ccc(N(C)S(=O)(=O)c2ccc(Cl)c(C(=O)NN(C)C(N)=O)c2)cc1	778412830	SGKQIFSYCQFQEE-UHFFFAOYSA-N	426.882	1.829	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)c1ccc(-n2cc(Br)cn2)cc1	778437683	IYIQKNALAJNRRZ-UHFFFAOYSA-N	438.282	1.921	50	20	IDGD	
CC(C)(C)OC(=O)N1Cc2ccc(CNC(=O)NN[C@@]3(C)CCS(=O)(=O)C3)cc2C1	780771057	LEVIHNPDNKNCIP-FQEVSTJZSA-N	438.550	1.818	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)[C@H]2CC(c3ccccc3[N+](=O)[O-])=NO2)cc1OC	781934851	ZKGIEZCMBFBMTQ-GOSISDBHSA-N	428.401	1.956	50	20	IDGD	
Cc1ccc(F)cc1C(=O)C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	782016495	FVMCXDKNYAXNMT-UHFFFAOYSA-N	434.493	1.396	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)CCc2c(C)nc3c(C(N)=O)cnn3c2C)cc1Cl	782798342	RSYURQVQVNGXIC-UHFFFAOYSA-N	444.879	1.961	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C(=O)Nc2ccc3c(c2)nc(C2CC2)n3C)nc2ccccc21	782887398	OGGAXKMBUFYHQB-UHFFFAOYSA-N	445.483	1.666	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ccc(C(F)(F)F)nn2)cc1S(=O)(=O)N(C)C	784891535	VYAVXDCKWWEZNV-UHFFFAOYSA-N	446.411	1.136	50	20	IDGD	
Cn1ccnc(NNC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2Sc2cccs2)c1=O	785090826	YPRIQSDENHKNRH-UHFFFAOYSA-N	446.470	1.983	50	20	IDGD	
CS(=O)(=O)c1ccccc1CC(=O)NNC(=O)COc1ccc(Br)cc1	785685015	UPPXFEWHBIWNSV-UHFFFAOYSA-N	441.303	1.622	50	20	IDGD	
Cc1csc(C(=O)NNC(=O)C(=O)Nc2ccccn2)c1I	787118802	KHHQVLVADUTLQE-UHFFFAOYSA-N	430.227	1.456	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(-c2ccsc2)nn1C	787541877	XULUCAOQPZPHIT-UHFFFAOYSA-N	427.486	1.876	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)Cn1c(S)nc2ccccc2c1=O	789330945	HBUAYUVLTKRURS-UHFFFAOYSA-N	436.497	1.445	50	20	IDGD	
Cc1c(Br)ccc(NC(=O)C(=O)NNc2ccc(-n3cccn3)nn2)c1F	789750507	JTTLPODODPIHDZ-UHFFFAOYSA-N	434.229	1.954	50	20	IDGD	
O=C(NNC(=O)[C@H]1OCC[C@H]1c1ccccc1)C(=O)Nc1cnn(-c2ccccc2F)c1	789809601	BEMBXDJSOCZDCE-LPHOPBHVSA-N	437.431	1.670	50	20	IDGD	
O=C(NNC(=O)[C@H]1OCC[C@H]1c1ccccc1)C(=O)Nc1cc2c(cc1Cl)OCCO2	789812042	IMYRKOZKNUXFJC-UGSOOPFHSA-N	445.859	1.770	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2cccc(N(C)C)c2)cccc1NC(=O)N(C)C	792352059	AMLOTLUYAOYHPS-UHFFFAOYSA-N	426.477	1.554	50	20	IDGD	
CCOC(=O)c1csc([C@@H]2CCCN2CC(=O)NNC(=O)Cc2nc(C)cs2)n1	792470376	IRVFGUJCASQWAM-ZDUSSCGKSA-N	437.547	1.612	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)[C@]12CCC(=O)N1c1ccccc1C(=O)N2C1CC1	792798863	QOPIFHBJOLKLGW-DEOSSOPVSA-N	448.479	1.527	50	20	IDGD	
CC(C)[C@@H](NC(=O)NNC(=O)CNC(=O)OCc1ccccc1)c1nc(C2CC2)no1	792975583	DRWJNXKUSKFDTJ-MRXNPFEDSA-N	430.465	1.901	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)N(CC(F)F)C(=O)CS2	793021787	JKFRJCFNSDLFHC-UHFFFAOYSA-N	437.428	1.129	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)C(=O)Nc2cnc(C(C)C)nc2)c1	797004400	JSMNMSTYZKUIFO-UHFFFAOYSA-N	436.266	1.771	50	20	IDGD	
COC(=O)c1ccccc1NNC(=O)[C@](C)(NC(C)=O)c1ccc(S(C)(=O)=O)cc1	797749911	CYKHMTCBSOYHDP-HXUWFJFHSA-N	433.486	1.371	50	20	IDGD	
COC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2ccccc2OC)c1OC(C)C	799258996	QIMSJNHNFZDZRW-UHFFFAOYSA-N	429.429	1.669	50	20	IDGD	
CC(=O)NCCN(Cc1ccsc1)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	801013563	ZZFWPRKFLAISCL-UHFFFAOYSA-N	445.549	1.134	50	20	IDGD	
COc1cc(CC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)cc(OC)c1OC	802065521	DGTQRDBSYRIYBX-UHFFFAOYSA-N	437.474	1.511	50	20	IDGD	
C[C@@H]1C[C@@H](C)CC2(C1)NC(=O)N(CC(=O)NNC(=O)Nc1ccc3c(c1)OCO3)C2=O	802093699	WXQVGZLQWJBBRN-VXGBXAGGSA-N	431.449	1.315	50	20	IDGD	
COc1ccc(Cl)c(NC(=O)NNC(=O)C2=NN(c3ccccc3)C(=O)[C@H](C)N2)c1	802111696	PEZBTNRORJFXRS-NSHDSACASA-N	430.852	1.840	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@H]2CC(c3c(F)cccc3F)=NO2)cc1	803397518	WYIFHDLDRHIWJA-OAHLLOKOSA-N	438.412	1.714	50	20	IDGD	
Cc1cc([N+](=O)[O-])ccc1NNC(=O)c1cc(S(N)(=O)=O)ccc1N1CCOCC1	805384208	AHBFYBVDBYZUGJ-UHFFFAOYSA-N	435.462	1.144	50	20	IDGD	
Cc1cc(I)cc(NC(=O)C(=O)NNC(=O)CCc2ccco2)c1	806977386	GYDLTWVLWSZGRF-UHFFFAOYSA-N	441.225	1.911	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)Nc1cccc2c1OCC(=O)N2	810256824	HDUOVYJVPOEVFB-UHFFFAOYSA-N	438.488	1.383	50	20	IDGD	
Cc1nc2ccc(NC(=O)C(=O)NNC(=O)c3sc(-c4ccccc4)nc3C)cn2n1	810386419	YHEUSDDTILTPNW-UHFFFAOYSA-N	435.469	1.869	50	20	IDGD	
CCOCCCn1c(NNC(=O)[C@H]2CCc3nnn(C)c3C2)nc2ccccc2c1=O	810398656	GAHZHTUSFNCTMF-AWEZNQCLSA-N	425.493	1.200	50	20	IDGD	
COC[C@@]1(C(=O)NNc2ccc(S(C)(=O)=O)cc2)CCN(C(=O)OC(C)(C)C)C1	810681832	YCFIWSRFMRRUSN-LJQANCHMSA-N	427.523	1.807	50	20	IDGD	
COCc1cc(Cl)cc(S(=O)(=O)NNC(=O)c2csc(N3CCOCC3)n2)c1	811677578	CRFHFXXPHGPQHZ-UHFFFAOYSA-N	446.938	1.403	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)Cn2cc(Br)ccc2=O)cc1	812731823	WCVUPLDVQSNKPR-UHFFFAOYSA-N	429.296	1.004	50	20	IDGD	
CCCCS(=O)(=O)Nc1ccc(NC(=O)NNC(=O)[C@H]2CCc3nncn3C2)cc1	814646567	JZYULFLWGBGQLI-ZDUSSCGKSA-N	435.510	1.235	50	20	IDGD	
CC(=NNC(=O)[C@H](C)Oc1cccc(C)c1C)c1ccc(S(=O)(=O)CC(N)=O)cc1	814748161	IWMWWRBRIGXSFN-INIZCTEOSA-N	431.514	1.870	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)C(=O)Nc1cccc(S(=O)(=O)C2CCCCC2)c1	815569062	FQLNMFWGFHZAOE-UHFFFAOYSA-N	433.490	1.224	50	20	IDGD	
Cc1noc(-c2ccccc2)c1NC(=O)C(=O)NNc1ccccc1S(=O)(=O)N(C)C	815752313	NHDVZCHSZQLTEF-UHFFFAOYSA-N	443.485	1.982	50	20	IDGD	
Cn1c(CCC(=O)NNC(=O)CC2CC2)nc2cc(S(=O)(=O)N3CCCCC3)ccc21	819114265	CXVFWTDIXDHMCU-UHFFFAOYSA-N	447.561	1.628	50	20	IDGD	
Cc1c(NC(=O)[C@H](C)SCC(=O)NNC(=O)CC2CC2)c(=O)n(-c2ccccc2)n1C	819115003	ZASHOVSONMPIBO-AWEZNQCLSA-N	445.545	1.492	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)CCn1c(S)nnc1-c1cccs1	825644131	VJNLPVWYAROHHL-UHFFFAOYSA-N	432.531	1.954	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)CCNS(=O)(=O)c2c(C)cc(C)cc2C)c1	825806071	YCWIXRIABAKXFG-UHFFFAOYSA-N	448.545	1.548	50	20	IDGD	
Cc1cccc([C@H](CC(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)NC(N)=O)c1	914642176	FOBGPBMFICFPBB-INIZCTEOSA-N	432.864	1.752	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)[C@@H]2CC(=O)N(c3ccc(F)cc3F)C2)cc1	914995712	YEGQYXFOBAJBMT-CQSZACIVSA-N	431.395	1.631	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)N2CCC[C@H](NS(C)(=O)=O)C2)c(C)n1C[C@H]1CCCO1	915203861	VXNPYZIUIUSHMV-OHBNSYPMSA-N	434.562	1.731	50	20	IDGD	
CNS(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2cc(-c3ccc(C)cc3)[nH]n2)s1	916232576	QLTYYQJADMSEER-UHFFFAOYSA-N	448.530	1.499	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)N[C@@H](CN2CCCC2=O)c2ccccc2)cc1	916459909	QPADJEQFTPIBKY-IBGZPJMESA-N	426.473	1.768	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NC[C@@H](c2ccccc2)N2CCOCC2)cc1OC	916508601	AXDSQWHJKZGTSC-SFHVURJKSA-N	428.489	1.721	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)NCc3cc[nH]n3)c2)c(C)c1	916637590	UUSKADHCJWBUSS-UHFFFAOYSA-N	442.501	1.972	50	20	IDGD	
O=C(Cc1ccc2ccccc2c1)NNC(=O)c1ccc(S(=O)(=O)N2CCOCC2)o1	917197895	SHDPSEXWWRRFSR-UHFFFAOYSA-N	443.481	1.457	50	20	IDGD	
O=C(NCc1ccc(Cl)nc1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	918080278	MBZDEAVKNOOMPO-UHFFFAOYSA-N	437.909	1.664	50	20	IDGD	
C[C@@H](COc1ccccc1)NC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	918088810	QRPKNQXXKGLIDC-IBGZPJMESA-N	425.533	1.997	50	20	IDGD	
Cc1nn(CC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c(C)c1Cl	918293662	CVONQWNDKIGTCO-UHFFFAOYSA-N	439.925	1.399	50	20	IDGD	
O=C(NC[C@H]1Cc2ccccc21)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	919657923	CRLSBYZPPNSXFR-QGZVFWFLSA-N	428.514	1.755	50	20	IDGD	
O=C(NNC(=O)c1cccc(OCc2cn3ccccc3n2)c1)N[C@@H]1CCS(=O)(=O)C1	919889682	RFWYGVMMMJMJFN-OAHLLOKOSA-N	443.485	1.044	50	20	IDGD	
CN(C)N(C(=O)[C@@H]1CC(=O)N(c2cc(Cl)cc(Cl)c2)C1)[C@H]1CCS(=O)(=O)C1	919988105	LETGBHXMCYJOMB-RISCZKNCSA-N	434.345	1.839	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)CNS(=O)(=O)c2ccc3ccccc3c2)c1	920239469	NWAIFWQHXHONHJ-UHFFFAOYSA-N	426.498	1.645	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1)NNC(=O)c1ccc2ccccc2c1	920437245	OTBCIRNNNYWHAE-UHFFFAOYSA-N	442.453	1.878	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)[C@@H]2CCCN(CC(F)(F)F)C2)cc1OC	920647541	AUMFOHBDFYMXQA-CYBMUJFWSA-N	447.410	1.282	50	20	IDGD	
CCCNC(=O)NNC(=O)C1CCN(S(=O)(=O)c2cccc(C(F)(F)F)c2)CC1	921041841	RKISOEMVQBORPO-UHFFFAOYSA-N	436.456	1.847	50	20	IDGD	
COc1ccc([C@H]2[C@@H](C(=O)NNC(=O)c3n[nH]c4c3CCCC4)CCC(=O)N2C)cc1	1251882117	QNRQCGXHSGTBIP-JXFKEZNVSA-N	425.489	1.668	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)c1cccc(NS(=O)(=O)CC)c1	1317788586	CRNZRTYAMHELJM-UHFFFAOYSA-N	429.502	1.822	50	20	IDGD	
Cn1ncc2c(C(=O)N3CC[C@@]4(C3)CN(C(=O)[C@@H](F)Br)CCO4)cccc21	1778031658	OPOPFJFMUYIGEU-CRAIPNDOSA-N	439.285	1.707	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(C(=O)N2CC[C@@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)C1	1778120735	IWRVNVFXJYUBIS-OAQYLSRUSA-N	443.972	1.948	50	20	IDGD	
COc1ccc(CCC(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)c(F)c1	1778289315	YAHKFACUXYVQSS-YLJYHZDGSA-N	428.888	1.197	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cccnn2)C1	1779650219	RKYOZUAWQCOBID-DDUZABMNSA-N	425.327	1.635	50	20	IDGD	
CCc1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](C)Br)C3)n(C)n1	1779768021	CAGZPZKOANTZIB-VVFCZOMOSA-N	441.370	1.893	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)c3cccc(C#N)c3Cl)C2)C1	1780193450	ZOYGOTBRCPABCV-OAQYLSRUSA-N	447.923	1.028	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCBr)C2)[C@H](F)Br	1780771912	SOKUOPGHQDNYGG-SCDSUCTJSA-N	444.139	1.976	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)c3cnn4cccnc34)CCO2)C1	1781230275	OYXVKGNDMNMNOT-ROUUACIJSA-N	426.304	1.409	50	20	IDGD	
COc1cc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)ccc1F	1781335095	TXIMCUYGWZYILH-PBHICJAKSA-N	433.249	1.968	50	20	IDGD	
C[C@H]1CC[C@H](C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2ccc(B(O)O)cc2)C3)CC1	1782684627	URHUQVHAVBDTGX-ZUXGEGRZSA-N	442.365	1.320	50	20	IDGD	
C=CCC(F)(F)C(=O)N1CC[C@@]2(CN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CCO2)C1	1783194494	CUYMBSNEFSGUPE-ANRKENSESA-N	437.447	1.162	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccc([N+](=O)[O-])o3)CCO2)C1	1783338205	DUNLSKJERBOLPB-MEDUHNTESA-N	430.255	1.805	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)CSc3ncccn3)CCO2)C1	1783533498	YFZREYNJOCZZIX-BLLLJJGKSA-N	429.340	1.182	50	20	IDGD	
CC(=O)c1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)CBr)C[C@@H]32)n[nH]1	1785838492	STLAKZIWKWXAML-LESCFKLSSA-N	441.326	1.237	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1(c2ccc(NC(=O)c3ncnn3C)cc2)CCC1	1787232381	YZYSQPHTLVEFHY-CCVNUDIWSA-N	448.487	1.697	50	20	IDGD	
CC(C)(C)OC(=O)NC1(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]3C2)CC1	1787451347	JZWXYNUZOLYUBD-XUXIUFHCSA-N	433.908	1.558	50	20	IDGD	
C[C@@H](C(=O)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1)n1ccnc1	1788140106	IKJUUIAQLQEYBW-INIZCTEOSA-N	432.289	1.572	50	20	IDGD	
COc1ccc(C(=O)NC2(c3ccc(NC(=O)c4ccc(B(O)O)cc4)cc3)CCC2)nc1	1788141297	SZIRGQWUXFGHRA-UHFFFAOYSA-N	445.284	1.832	50	20	IDGD	
Cc1nnc(CC(=O)NC2(c3ccc(NC(=O)c4cccc(B(O)O)c4)cc3)CCC2)o1	1788143874	QDYYJTSPTXDQIC-UHFFFAOYSA-N	434.261	1.048	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3CCC(CO)CC3)C[C@@H]21	1788765786	RIZKMRMQYDELBG-LKIAZTKLSA-N	426.630	1.616	50	20	IDGD	
CCOCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)[C@H]2C1	1789222260	LDTZPTOCTZMNOO-FNHZYXHNSA-N	449.460	1.150	50	20	IDGD	
O=C([C@@H](O)CCl)N1CC[C@H]2CO[C@@H](CNC(=O)C3(c4ccc(F)c(F)c4)CC3)[C@H]2C1	1789703829	KCERSEACANFTIR-ZUXXIDCJSA-N	442.890	1.576	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnn4c3CCC4)[C@H]2C1	1790390628	HBGZVUNBBWHLPJ-DSPQJCBJSA-N	425.327	1.206	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cncc(O)c3)[C@H]2C1	1791113344	VSOQVIBTZJFUNC-DDWPSWQVSA-N	426.311	1.554	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](Cl)COC)[C@H]2C1	1791257362	BZFCOYWUMXRPTD-HPCHECBXSA-N	425.751	1.393	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1c(Cl)cncc1Cl	1792410648	IJPRPUHXKSHFAQ-FJHTZYQYSA-N	436.723	1.845	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C(C)(C)CCl)C1	1792785653	NSBNEOGNCYVILW-OVYGPGRDSA-N	428.957	1.820	50	20	IDGD	
Cc1cccc(-c2cnccc2C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](O)CCl)c1	1792976713	KRDQTGPJRZXXGY-JWWGGVBKSA-N	443.931	1.860	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CCCCN1Cc1ccccc1)C2)[C@H](O)CCl	1792978557	GFDSTUFEJGQTQS-LUYSREMJSA-N	449.979	1.230	50	20	IDGD	
C[C@H](CBr)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(=O)nc3cccnn13)C2	1792990303	IAWCCSCLCIDQCE-YIYPIFLZSA-N	448.321	1.372	50	20	IDGD	
COc1cc(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](O)CCl)C3)cc(OC)c1OC	1793899237	YAXGGWCISHMOGY-QKPAOTATSA-N	440.924	1.493	50	20	IDGD	
Cc1ccc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)CBr)C3)cn1	1794045696	VSWQMTZDECRPPF-KUZCPNRJSA-N	438.366	1.943	50	20	IDGD	
Cn1cnc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)c1	1794141050	IIHUURJNVJPWNV-XGUBFFRZSA-N	439.944	1.804	50	20	IDGD	
Cc1ccc(CCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)s1	1794311930	JRLAKFUABUMXBL-REPLKXPHSA-N	426.347	1.621	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)c1ccc(C(F)(F)F)cc1	1796188434	FSIAJTACVJHTJT-REPLKXPHSA-N	446.234	1.951	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cn1ccnn1	1796330882	LRPGEKHLYNCXHW-QDMKHBRRSA-N	442.432	1.064	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)CBr)C2	1796837809	IFXVXMAJBPMIDF-FAYQHZLMSA-N	449.349	1.877	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1cc2cccn2cn1	1797101615	MOCXPHJSRYLRQI-BAESOJJISA-N	425.258	1.228	50	20	IDGD	
CCOc1c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](Cl)CC)cnc2c1cnn2C	1799270152	RREJBEAWMOZPPM-RMHZUWNSSA-N	449.939	1.588	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(C(F)(F)F)c1)c1ccc(B(O)O)cc1	1799644803	HMJDNYJRYBSHIO-REPLKXPHSA-N	446.234	1.951	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccn2nccc12	1799974027	BDLCTTKHVQSKQQ-YXPYIKCWSA-N	435.322	1.711	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](F)Br)c1nn[nH]c1C(F)(F)F	1800161403	VUSBYTTZGICHNJ-JTGULSINSA-N	428.184	1.766	50	20	IDGD	
CCN(CC)[C@@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)c1ccccc1	1800300718	QZNPUGJYSGQOQE-USYVTKNRSA-N	437.968	1.259	50	20	IDGD	
O=C(C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](Br)Cc1ccccc1)C1CC1	1800433649	YQXUXLCWAGTEDJ-MHORFTMASA-N	449.345	1.561	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CSc1ncccn1)C2	1800639584	JNRGCZFFGUIQDC-QVHKTLOISA-N	443.367	1.332	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cn(C(C)(C)C)nn1)C2	1800642495	LMOUPHZZDIUWHV-XFMPKHEZSA-N	442.358	1.410	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cc([N+](=O)[O-])ccc1F)C2	1800974317	SAUHUTFXEMYPFZ-HRJSJKBJSA-N	443.859	1.120	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(-c3ccccc3)[nH]n1)C2	1800978335	ALUPORYIFSHXPK-YYAJDYIMSA-N	432.908	1.534	50	20	IDGD	
CC[C@@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnccc1C(=O)NN)C2	1801802599	YQFHMLPZRJPAMC-NWJSVONSSA-N	438.326	1.110	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H](CNC(=O)[C@H]2CCC(=O)NC2)[C@H]1c1cccnc1	1802607957	FCWBRYBGHFGBCA-FUHIMQAGSA-N	432.597	1.465	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cc3cccn3cn2)[C@@H]1c1cccnc1)[C@H](O)CCl	1803142781	JDBBZGJCEZBZGE-KFKAGJAMSA-N	427.892	1.649	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)C#CC2CC2)[C@@H]1c1cccnc1	1803451037	PQNVPCXJBGAQPU-IOMHJHRISA-N	446.511	1.635	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC2(CCN(C(=O)CN3CCN(C)CC3)CC2)C1	1805384204	LSESVEVSSJGKOA-KRWDZBQOSA-N	443.430	1.496	50	20	IDGD	
Cc1ccc(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)cn1	1805453574	CGYJIUZKGQKUAS-SIKLNZKXSA-N	444.300	1.098	50	20	IDGD	
CC(=O)N(C)CCC(=O)N1CC[C@@H](CNC(=O)CCBr)[C@@H]1c1cccnc1	1806343273	TZBINBGCLREYAZ-LPHOPBHVSA-N	439.354	1.741	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)C(C)(C)F)[C@@H]1c1cccnc1	1806980586	JLCNNVFJMOCFFG-RMEHUUNGSA-N	442.495	1.970	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H](CNC(=O)CN)[C@@H]1c1cccnc1	1807029404	PSRDEWRTZBBGJV-VYDXJSESSA-N	439.944	1.178	50	20	IDGD	
O=C1CC[C@H](C(=O)N2CC[C@H](CNC(=O)[C@@H](F)Br)[C@@H]2c2cccnc2)N1	1808662291	XHPZADGMAVQGGP-RJZRQDKASA-N	427.274	1.057	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)c2ccccc2)[C@H]1c1cccnc1	1811670325	OQAVNQCIMGSQOB-WIYYLYMNSA-N	444.495	1.714	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1ccc(F)cc1	1811900965	QGYBWBAQRGWKNT-SIKLNZKXSA-N	447.275	1.534	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2cccnc2C(N)=O)[C@@H]1c1cccnc1	1813027797	DGRAFCMWHCRCNW-UWWQBHOKSA-N	445.907	1.149	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2ccc(F)s2)[C@H]1c1cccnc1	1813070125	GEVGQLLQRKPWFP-QRWLVFNGSA-N	447.536	1.975	50	20	IDGD	
Cc1ccn(C)c1C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1813072373	GRQPQMSNKKVVIO-GCJKJVERSA-N	440.548	1.421	50	20	IDGD	
O=C1C[C@H](C(=O)NC[C@@H]2CCN(C(=O)CCBr)[C@H]2c2cccnc2)CCN1	1813133738	OAOWDRSXEJJGBC-XUWXXGDYSA-N	437.338	1.399	50	20	IDGD	
C#CCCCCC(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1813223766	UNWJBXFLFGMWLK-NZQKXSOJSA-N	433.317	1.275	50	20	IDGD	
O=C(N[C@@H]1CCc2nc(NC(=O)[C@H]3Cc4ccccc4CN3)sc2C1)[C@H](O)CCl	1817132315	IJGAYUNCBOMFBI-FVQBIDKESA-N	434.949	1.369	50	20	IDGD	
COCCn1nccc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](Cl)COC)CC2	1817594541	GASFLSKNGNFCOO-RYUDHWBXSA-N	441.941	1.466	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CO)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](F)Cl)[nH]n1	1817974887	RAWRNPJAEMABAT-SCRDCRAPSA-N	447.895	1.822	50	20	IDGD	
CN1CCN(CC(=O)Nc2cc([C@@H]3CCCCN3C(=O)[C@](C)(Cl)CCl)[nH]n2)CC1	1818913790	MOEKLOLULQLKMM-HNAYVOBHSA-N	445.395	1.886	50	20	IDGD	
Cc1ccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cnccc3C(=O)NN)n[nH]2)cn1	1819401811	BAKSSBMUQCDSQX-GOSISDBHSA-N	448.487	1.731	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCc2nc(N)n[nH]2)[nH]n1	1820866938	QBXRPBJPQOFTMI-PIGZYNQJSA-N	443.339	1.971	50	20	IDGD	
CCCNC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](Cl)COC)n[nH]1	1822371874	URCFRHACICRCJO-UKRRQHHQSA-N	427.933	1.962	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)C[C@](C)(O)CC(=O)O)n[nH]1	1822415763	XHPKZUHQFRLRFK-SRBZOADZSA-N	430.889	1.271	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1	1823356635	UWHSKELNYWHGRZ-UONOGXRCSA-N	443.932	1.916	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ncn(C(C)C)n1)CC2	1825997842	CYGUFSZFPWMONG-GHMZBOCLSA-N	426.930	1.795	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](C)Cn1ccnc1)CC2	1826008708	GAKSCWBCYZECDH-AVGNSLFASA-N	425.942	1.842	50	20	IDGD	
N=C1NCCN1CC(=O)N1CCC([C@@H]2CCCCN2C(=O)CCBr)CC1	1826357906	VOAWVTFYLAXIDQ-HNNXBMFYSA-N	428.375	1.231	50	20	IDGD	
O=C(c1ccncc1O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827052325	VJRJALQCRAKFLT-HXUWFJFHSA-N	437.305	1.014	50	20	IDGD	
O=C([C@@H]1[C@@H]2C=CS[C@@H]12)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827060315	FSZSHMBBAYSHSP-DOIPELPJSA-N	440.374	1.475	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)Cc2ccncc2)CC1	1830174251	PEXQZFQEZMAHGP-JOCHJYFZSA-N	435.333	1.237	50	20	IDGD	
CN(C)c1ncc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)o1	1830357934	IFEOZNXEKYHQDU-IBGZPJMESA-N	428.917	1.076	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3n[nH]c4ccccc34)C2)C1	1830362381	UCLBRKWSEHDGNI-OAQYLSRUSA-N	434.924	1.898	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(F)cn3)C2)C1	1830537170	CITWDBNBMJBMSV-FZKQIMNGSA-N	444.301	1.322	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2[C@H]3C=CS[C@@H]32)CC1	1831159172	HQGGPUQKGGUSFC-OVQGTLEDSA-N	434.606	1.854	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnn4ccccc34)C2)C1	1831646096	FNHJIDJGKFRLPI-LAUBAEHRSA-N	434.924	1.812	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](CN)c3ccccc3)C2)C1	1831646142	IAAUFBVPAZFPBF-CNNODRBYSA-N	437.968	1.593	50	20	IDGD	
CCOC(=O)N[C@H](O)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H](C)Br)CC1	1831655656	XHSOUKXXNXHVJO-AEGPPILISA-N	448.358	1.454	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccnc(F)c3)CCO2)C1	1831905044	OTHCXRVSAKASKV-ZWKOTPCHSA-N	434.295	1.527	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)C2CCC(O)CC2)CC1	1832001391	ZEVAMAFTQOYLEB-UDJZJCJKSA-N	442.365	1.151	50	20	IDGD	
C[C@H](Cn1ccnc1)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1	1832227640	SAMBZRRIICJHOS-QUCCMNQESA-N	446.596	1.512	50	20	IDGD	
Cc1ncccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1834040000	XBDUVAWQDRMOBY-YOEHRIQHSA-N	430.274	1.151	50	20	IDGD	
Cn1cncc1C(=O)NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1834245082	USIMDYTUFRURGP-OAHLLOKOSA-N	430.322	1.296	50	20	IDGD	
Cn1ccnc1C(=O)NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1	1834268681	XUUTZWANQZPMDE-UHFFFAOYSA-N	426.359	1.390	50	20	IDGD	
CC(C)c1cc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCBr)CCO3)C2)no1	1834819261	MMAFEAJMVLOKFD-GOSISDBHSA-N	444.326	1.653	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)c1ccccc1)CCO2	1835289361	BUEAOULLQNZQQT-PZJWPPBQSA-N	436.581	1.028	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC(N2CCC(NC(=O)c3cc(C#N)c[nH]3)CC2)CC1	1836169588	WCJWGYNDOKOBBB-UHFFFAOYSA-N	431.613	1.923	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCC(OC2CCN(C(=O)CN3CCCC3=O)CC2)CC1	1836623524	NJRCNZVQVXMIFR-UHFFFAOYSA-N	427.973	1.872	50	20	IDGD	
C[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1)n1ccccc1=O	1837680369	IQBNLGMAPJSDPS-IERDGZPVSA-N	439.940	1.131	50	20	IDGD	
O=C(c1ccc(OCCCO)cc1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1838547562	FTHBXEMHJYGFHL-FXAWDEMLSA-N	444.887	1.052	50	20	IDGD	
Cc1nc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)cs1	1839151054	HCHOJUMBGHIKKG-IRXDYDNUSA-N	436.361	1.758	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H]3Cc4ccccc4N3)CCO2)C1	1839733331	CXPYHAYVGUYZCV-AVRDEDQJSA-N	435.952	1.745	50	20	IDGD	
COc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)s1	1840031497	RUPAOQYMYKUCDZ-PXAZEXFGSA-N	447.351	1.610	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cc(F)cc(F)c3)C2)C1	1840152131	XYWURGVGKXFCBD-FXAWDEMLSA-N	446.878	1.218	50	20	IDGD	
Cc1noc(C)c1CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840186169	FKGUTDGXQNMDSO-GOSISDBHSA-N	434.320	1.484	50	20	IDGD	
COc1ccc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)cc1F	1840190620	DVVGGCYSGWLGHX-IBGZPJMESA-N	449.306	1.637	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)c2nc3ccc(C(F)(F)F)cn3n2)C1	1843156015	RSZJEAFKOVMQGJ-GFCCVEGCSA-N	445.829	1.819	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2nc(C)c(C)s2)C1	1844620846	IAIWBJZWCMZMBG-YDZHTSKRSA-N	428.518	1.711	50	20	IDGD	
CN(CC(=O)N1CC2(CCCN2C(=O)[C@H]2CC=CCC2)C1)NC(=O)NCc1ccccc1	1845127313	IWIAWEPDKBQUQW-FQEVSTJZSA-N	439.560	1.892	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCCC12CN(C(=O)CN1CCCC1=O)C2	1845870833	HEMHPDIXRNLGKB-CXUHLZMHSA-N	428.439	1.698	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CCN1C(=O)Cc2ccccc2C1=O	1847610064	YYMGNHSFVYGUQW-SQNIBIBYSA-N	431.920	1.821	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCNC(=O)OC(C)(C)C	1847870154	MYPUWIOZKYGGKI-YHUYYLMFSA-N	431.961	1.871	50	20	IDGD	
Cc1ccc(C)c(S(=O)(=O)NCCC(=O)NNC(=O)c2cc(Cl)ccc2O)c1	10600764	FRUPONYPGBMFGH-UHFFFAOYSA-N	425.894	1.792	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)c1cnc2n(c1=O)CCS2	15762859	UPWIQCPOJDDSTO-VIFPVBQESA-N	439.291	1.340	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1cc([N+](=O)[O-])ccc1OC	19284767	QPRWNIWIXONELZ-UHFFFAOYSA-N	437.792	1.883	50	20	IDGD	
O=C(CNC(=O)c1ccccc1I)NNC(=O)c1ccccc1F	26971950	UVSZGKHJHSYPRT-UHFFFAOYSA-N	441.200	1.621	50	20	IDGD	
COc1ccc(N2C[C@@H](C(=O)NNC(=O)[C@H]3COc4ccccc4O3)CC2=O)c(OC)c1	27068337	ZITCOWSZGRNCKN-ORAYPTAESA-N	441.440	1.044	50	20	IDGD	
O=C1CC(=O)Nc2cc(S(=O)(=O)NNC(=O)c3ccc4ccccc4n3)ccc2N1	28678374	FAMLEYKYCUVDPF-UHFFFAOYSA-N	425.426	1.139	50	20	IDGD	
Cc1ccc(CC(=O)N2CCN(C(=O)NNC(=O)c3c(C)nc4ccccn34)CC2)cc1	725859379	DSSVZDMEICKDBE-UHFFFAOYSA-N	434.500	1.692	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)c2ccc(S(N)(=O)=O)c(Cl)c2)c1C	725907520	LAPNXODYMKIJOM-LBPRGKRZSA-N	425.894	1.833	50	20	IDGD	
COCCCNC(=S)N(C)NC(=O)CCNS(=O)(=O)c1ccc2ccccc2c1	726076732	AMWOECCYZIFURF-UHFFFAOYSA-N	438.575	1.382	50	20	IDGD	
CS(=O)(=O)Cc1c(C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)oc2ccccc12	726496589	AAFZYJUQNKWCPR-KRWDZBQOSA-N	430.438	1.578	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCCC[C@H]2[C@@H](C)NC(=O)OC(C)(C)C)n1	726598206	BPGZHFGLNFEXRL-CABCVRRESA-N	439.582	1.909	50	20	IDGD	
CCCn1c(=O)nc(O)c2c(C(=O)NNc3nc(-c4cccnc4)no3)cc(C3CC3)nc21	728079069	JNEXKBQPRGTWDQ-UHFFFAOYSA-N	448.443	1.986	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2cnc(OC(C)C)c(Cl)c2)n1	728731413	ACOPIEPSVQPBBV-UHFFFAOYSA-N	426.882	1.834	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)N1CCN(S(=O)(=O)c2cccc(Cl)c2)CC1	728956909	ANUZFCMJUCSAMT-UHFFFAOYSA-N	437.909	1.025	50	20	IDGD	
Cc1noc(CNC(=O)/C(C#N)=C\c2cn(CCC(N)=O)nc2-c2ccc(Cl)cc2)n1	729329483	MRRPNRWSGMALKX-ZSOIEALJSA-N	439.863	1.994	50	20	IDGD	
CCOc1cc(Br)c(CC(=O)NNC(=O)Cc2cc[nH]n2)cc1OCC	730102623	IBRIBHLIHZPGPH-UHFFFAOYSA-N	425.283	1.902	50	20	IDGD	
COc1ccccc1C/C(C)=C\C(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1	730206212	WEYKTRIROALQBC-VKAVYKQESA-N	445.541	1.961	50	20	IDGD	
O=C(COc1ccccc1OCc1ccccc1)NNC(=O)N[C@@H]1CCS(=O)(=O)C1	730774629	WFULFLVIEIOIQT-MRXNPFEDSA-N	433.486	1.162	50	20	IDGD	
COc1cc(OC)c(CCNC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c(OC)c1	731045649	GABAYIQKYLCYRR-LJQANCHMSA-N	431.445	1.425	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)c2sccc2S(=O)(=O)N(C)C)cc1	731958361	NYGNYFSVHHHACB-LBPRGKRZSA-N	441.531	1.626	50	20	IDGD	
COC(=O)c1ccc(-c2ccc(/C=C(\C#N)C(=O)c3c(N)n(C)c(=O)n(C)c3=O)o2)cc1	732578819	SORMYMQMVBKAGZ-GXDHUFHOSA-N	434.408	1.503	50	20	IDGD	
O=C(CN1CCN([C@H](CO)c2ccc(Cl)cc2)CC1)NNC(=O)c1ccc(F)cc1	732668328	YJIWNOOVNOZRKT-LJQANCHMSA-N	434.899	1.591	50	20	IDGD	
CSc1nc(C)c(CCC(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)c(C)n1	734240474	SAAHOFFCAREDCO-UHFFFAOYSA-N	426.543	1.603	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1	734241440	FHQGPSXRHOTRRP-UHFFFAOYSA-N	436.469	1.664	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CSc1nnc(-c2ccccn2)n1N	735620431	ADAHCTKYAYFBBY-UHFFFAOYSA-N	433.881	1.269	50	20	IDGD	
N#Cc1ccc(N2C(=O)N[C@H](CCC(=O)NNC(=O)COCc3ccccc3)C2=O)cc1	737636810	GHSXMPGXJCOMLS-GOSISDBHSA-N	435.440	1.127	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)CCn1cnc2sc3c(c2c1=O)CCCC3	740852292	UGKOWVUERARZLR-UHFFFAOYSA-N	433.534	1.179	50	20	IDGD	
Cc1cc(Br)ccc1C(=O)N1CCC[C@@H](C(=O)NNC(=O)CN(C)C)C1	743333799	ZDHDVEMCALLQPG-CYBMUJFWSA-N	425.327	1.319	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NCc2n[nH]cc2Br)cc1	743623944	FLEPNKPROMMVIP-UHFFFAOYSA-N	431.272	1.112	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)C1CCCCC1	745839157	TZDGLURGUANTEV-OAHLLOKOSA-N	438.550	1.620	50	20	IDGD	
C[C@H]1C[C@H](NC(=O)NNC(=O)c2cc3c(s2)CCCCC3)C(=O)N1c1cnn(C)c1	745916845	GJIOLGXJVRYMOE-WFASDCNBSA-N	430.534	1.889	50	20	IDGD	
NC(=O)COc1ccc(C=NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1	745984385	QKPVGIULUNMGJY-UHFFFAOYSA-N	430.486	1.099	50	20	IDGD	
CCOc1cc(C#N)cc(Br)c1OCC(=O)NNC(=O)N1CCOCC1	745986236	OUQFECLWFDCRPW-UHFFFAOYSA-N	427.255	1.171	50	20	IDGD	
C[C@H](C(=O)NNC(=O)CSc1ccc(Cl)cc1)N1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O	746093728	LOXOLCJWPPXCBS-YUHPLZMDSA-N	437.905	1.130	50	20	IDGD	
C[C@H]1OC(C)(C)N(C(=O)OC(C)(C)C)[C@H]1C(=O)NNC(=O)CNC(=O)c1cccs1	746198622	XNFZWMPATRUGOP-BXUZGUMPSA-N	440.522	1.386	50	20	IDGD	
COCCCNC(=O)NNS(=O)(=O)c1cc(Br)cc(C(F)(F)F)c1	746591409	LIPILXASKVECBY-UHFFFAOYSA-N	434.234	1.997	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2ccc(-c3n[nH]c(C4CC4)n3)cc2)n1	748898963	USAVEOYKNFDTLT-UHFFFAOYSA-N	440.485	1.661	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)C[C@@H](NC(=O)c1ccccc1)c1ccccc1	751206605	JWFSDGJMKVADIW-GOSISDBHSA-N	434.452	1.718	50	20	IDGD	
CCOc1ccccc1C(=O)N1CCC[C@H]1C(=O)NNC(=O)CNC(=O)c1cccs1	751210006	ZTEURKTYWIJVNI-HNNXBMFYSA-N	444.513	1.329	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)c1ccc(CS(=O)(=O)C(F)F)cc1	751458962	VFCIETULUUOWRD-OAHLLOKOSA-N	426.397	1.425	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)NCc2cnc(N(C)C)n2C)c1	751807264	QBVMKNOWXDSKFS-UHFFFAOYSA-N	425.287	1.401	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1cccc(OCc2cn3ccccc3n2)c1	754753573	DPTWSEJGJNBXKW-OAHLLOKOSA-N	428.470	1.109	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)Nc2ccccc2C(=O)N2CCCC2)c2ccccc2c1=O	755530755	HQKMSVOYVWZBBI-UHFFFAOYSA-N	434.456	1.636	50	20	IDGD	
COc1cc(C=NNC(=O)c2cc(Br)c[nH]2)c([N+](=O)[O-])cc1OCC(=O)O	755618182	WPJHZORBMGIDPB-UHFFFAOYSA-N	441.194	1.921	50	20	IDGD	
C[C@@H]1CN(c2ccc(NC(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)cn2)C[C@@H](C)O1	755867101	YAUQHYABDDGAQS-ZIAGYGMSSA-N	447.517	1.565	50	20	IDGD	
CN(C)C(=O)Cn1ccc(NC(=O)NNC(=O)COc2cccc(C(F)(F)F)c2)n1	756311698	SPSRVWWUPUWGKH-UHFFFAOYSA-N	428.371	1.222	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)Nc1ccc(CNS(C)(=O)=O)cc1	756624878	HERUNJWSKFYIFR-UHFFFAOYSA-N	426.882	1.864	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)ccc1C(=O)N(C)C	756704487	ITGRPVUFCLWNKU-UHFFFAOYSA-N	425.493	1.556	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)Nc2ccc(S(=O)(=O)NC3CC3)cc2)cc1C	756776387	OLQZRJZGAXTKLR-UHFFFAOYSA-N	432.502	1.976	50	20	IDGD	
Cc1cnn(-c2ccc(S(=O)(=O)NNC(=O)[C@H]3COc4ccccc4O3)cc2F)c1	757644741	KOGLMUXGRZGFNN-GOSISDBHSA-N	432.433	1.469	50	20	IDGD	
C[C@@H]1C[C@@H](NC(=O)NNC(=O)c2csc(N3CCOCC3)n2)CN1Cc1ccccc1	757722123	JPHADHFSPGWWLD-NVXWUHKLSA-N	444.561	1.587	50	20	IDGD	
COCc1nc2n(n1)C[C@@H](NC(=O)NNC(=O)[C@H](C)Oc1ccc3ccccc3c1)CC2	757773487	CFMBHWOLYYGKFU-YOEHRIQHSA-N	438.488	1.690	50	20	IDGD	
COCCCS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2cncc(NC(C)=O)c2)cc1	757823897	UKGCLRYZHUOJHF-UHFFFAOYSA-N	449.489	1.317	50	20	IDGD	
CN(C)N(C(=O)[C@H]1CN(C(=O)OC(C)(C)C)CCC1(F)F)[C@@H]1CCS(=O)(=O)C1	757871585	OOABTHARQBPVDT-CHWSQXEVSA-N	425.498	1.371	50	20	IDGD	
COc1cc(C(=O)NNc2nc(O)c3ccccc3n2)cc(NS(C)(=O)=O)c1OC	758299467	KOGBBZJKOLZYST-UHFFFAOYSA-N	433.446	1.481	50	20	IDGD	
Cc1c(C(=O)NNC(=O)Cc2cn3ccccc3n2)cnn1CCO[C@@H]1CCCCO1	759252100	VHTPMEWHIRBTLI-HXUWFJFHSA-N	426.477	1.386	50	20	IDGD	
COC(=O)[C@H](C)Cc1ccc(NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1	760077466	OQRSOURLVOUJAG-CYBMUJFWSA-N	433.486	1.908	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NN=C2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)ccc1Cl	760232972	PMVSMCFXSGYDFG-CYBMUJFWSA-N	440.869	1.993	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)c1ccc(I)c(O)c1	761168246	JTZPBRZOCCTNKI-UHFFFAOYSA-N	449.245	1.673	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)c1cc(S(=O)(=O)N(C)C)c(C)o1	761637334	PCPLDAGSFQEEDY-UHFFFAOYSA-N	427.504	1.400	50	20	IDGD	
Cc1cc(C(=O)NC(C)C)ccc1NC(=O)C(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	763445105	FATFFXFZCVSKLK-UHFFFAOYSA-N	427.417	1.441	50	20	IDGD	
COC(=O)CCOc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3n2)cc1	763450320	MHTZFCOYRRCGMR-UHFFFAOYSA-N	436.424	1.576	50	20	IDGD	
O=C(Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccccn2)cc1)Nc1ccccc1F	763463965	ORINSIJUOQBLEA-UHFFFAOYSA-N	435.415	1.802	50	20	IDGD	
Cc1ccc(Cn2nccc2NC(=O)C(=O)NNC(=O)c2ccccc2Br)o1	763483219	PNCSISFYQZTOIG-UHFFFAOYSA-N	446.261	1.995	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2O)cc1OCc1ccncc1	763528273	NYVGEFGOJJBRPT-UHFFFAOYSA-N	436.424	1.775	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(Cl)c2)cc1Cl	763747414	KKHIGJRQAQZMEH-UHFFFAOYSA-N	440.239	1.945	50	20	IDGD	
Cc1ccc(C#N)cc1NC(=O)C(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12	763790917	PSDWORIWULPLSW-UHFFFAOYSA-N	432.440	1.557	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)C(=O)Nc2ccccc2N(C)C)c2ccccc2c1=O	763791500	TVHSHYZSYOWEHC-UHFFFAOYSA-N	436.472	1.443	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)C(=O)Nc2cccnc2Cl)c2ccccc2c1=O	763801316	NUTWBBSENDMTPY-UHFFFAOYSA-N	442.863	1.645	50	20	IDGD	
CCOC(=O)c1cc(CC)sc1NC(=O)C(=O)NNC(=O)COc1ccc(C)cc1	763809297	MXMMPQXHVYQYOQ-UHFFFAOYSA-N	433.486	1.961	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)ccc1C	763842226	XMOBLVUGKYXCRN-HNNXBMFYSA-N	427.457	1.952	50	20	IDGD	
COC(=O)c1cc(OC)ccc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccc(F)cc1	763872180	LGJGIDWAMMJRIH-NSHDSACASA-N	433.392	1.174	50	20	IDGD	
CC(C)CC(=O)NNC(=O)C(=O)Nc1ccc(C(=O)NCc2ccccn2)c(Cl)c1	763882105	KEICJHRHOCBERF-UHFFFAOYSA-N	431.880	1.797	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(N)=O)c(C)c2)cc1OC	763912804	VAGPOBKVVHURNR-UHFFFAOYSA-N	442.472	1.681	50	20	IDGD	
Cc1nnc(-c2cccc(NC(=O)C(=O)NNC(=O)Cc3ccc(Cl)cc3)c2)n1C	763931604	KOUAPNLBYNXCPR-UHFFFAOYSA-N	426.864	1.773	50	20	IDGD	
COCC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CC[C@H](C)C3)cc1	763939256	CNHJAWSQBWGHNX-LBPRGKRZSA-N	444.513	1.858	50	20	IDGD	
Cc1nn(-c2ccccc2)c(C)c1NC(=O)C(=O)NNC(=O)c1cc(Br)c[nH]1	763996934	HGNZCWLYJFCTQJ-UHFFFAOYSA-N	445.277	1.979	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)N1CCc2cc(F)c(F)cc21	764004841	OQTNRQXZWTWHNE-UHFFFAOYSA-N	427.205	1.416	50	20	IDGD	
CCn1nnnc1-c1cccc(NC(=O)C(=O)NNC(=O)CCc2ccc(OC)cc2)c1	764128011	XOKOVUCQLFQQSE-UHFFFAOYSA-N	437.460	1.087	50	20	IDGD	
CC(C)OCCCn1c(NNC(=O)[C@@H]2CN3CCCN2CC3)nc2ccccc2c1=O	764162362	PQZLRGOSXLTGOA-IBGZPJMESA-N	428.537	1.045	50	20	IDGD	
C[C@@H]1CCCN(S(=O)(=O)c2ccc(NC(=O)C(=O)NNC(=O)c3ccoc3)cc2)C1	764163290	IIHZWNJMLVHEFY-CYBMUJFWSA-N	434.474	1.100	50	20	IDGD	
CCOc1cc2c(cc1NC(=O)C(=O)NNC(=O)CCc1ccccc1O)O[C@H](C)C2	764277667	GJDORBVXLDTEBA-CYBMUJFWSA-N	427.457	1.833	50	20	IDGD	
CC(C)Oc1cc(Br)cc(NC(=O)C(=O)NNC(=O)Cc2ccncc2)c1	764354829	XVBNMJWCGUATRV-UHFFFAOYSA-N	435.278	1.960	50	20	IDGD	
CCN(Cc1ccccc1NC(=O)C(=O)NNC(=O)COCc1ccccc1)C(C)=O	764367429	WOTNCYCNTJVDRS-UHFFFAOYSA-N	426.473	1.358	50	20	IDGD	
Cc1ccc(-c2nnco2)cc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	764388408	RSAZENGTEDPFBV-UHFFFAOYSA-N	449.402	1.974	50	20	IDGD	
COC(=O)c1ccc(F)c(NC(=O)C(=O)NNC(=O)CSc2ccccc2OC)c1	764394894	WLGGNOPEDIGMTJ-UHFFFAOYSA-N	435.433	1.499	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)C(=O)Nc2ccn([C@H](C)c3ccccc3)n2)c1	764433722	QWZFHQLCAAUZBO-CYBMUJFWSA-N	435.444	1.246	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@@H](C)S(=O)(=O)C2CCOCC2)ccc1OC(C)C	764569927	DEJTZWQJQZPHRQ-CYBMUJFWSA-N	428.507	1.226	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNS(=O)(=O)c1cncc(F)c1	765119061	MIFHHIMOCBBSEO-UHFFFAOYSA-N	441.916	1.001	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNS(=O)(=O)c3ccc(Cl)cc3)CC2)cc1	765126173	JNYZYWCCPDUKBX-UHFFFAOYSA-N	436.965	1.776	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2cncc(Cl)n2)c(I)c1	765711821	YKLIIABJEAYWJO-UHFFFAOYSA-N	447.620	1.825	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)C[C@H]3OCCc4ccccc43)CC2)cc1	765749619	ZIANSIAFTAYWTK-HSZRJFAPSA-N	436.556	1.964	50	20	IDGD	
Cc1nn2cc(S(=O)(=O)NNC(=O)c3cccc(OC(F)F)c3)cnc2c1Cl	766322532	QSTBAUPQEHJTSK-UHFFFAOYSA-N	431.808	1.916	50	20	IDGD	
CC(C)(C)[C@@H](Br)C(=O)OCc1nnnn1-c1ccc(S(C)(=O)=O)cc1	766745503	FXEVCIPRNYGCAD-ZDUSSCGKSA-N	431.312	1.919	50	20	IDGD	
CCCS(=O)(=O)Nc1ccc(C(=O)OCC(=O)NNC(=O)Cc2ccccc2C)cc1	767329917	OOQNRCPHBHSJBH-UHFFFAOYSA-N	447.513	1.694	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCN(S(=O)(=O)CBr)CC2)c(C)c1F	767851606	RGJDJDMAAIWCET-UHFFFAOYSA-N	445.332	1.131	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cc(C3CC3)nn2-c2ncccn2)cc1C	768233262	LZRGHLMTUYKSCC-UHFFFAOYSA-N	449.471	1.321	50	20	IDGD	
CC(C)(C)OC(=O)N1CCO[C@H](C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)C1	768242922	KRAPNWJUOLEETG-HNNXBMFYSA-N	440.447	1.936	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1	768629059	DXXQGIKRELKVFG-UHFFFAOYSA-N	431.430	1.950	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)NCC2(C)OCCO2)cc1	769025141	VSQHHGRZJRPJJX-LFIBNONCSA-N	439.472	1.220	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)Nc1cccn(CC(F)(F)F)c1=O	769240732	JEHJQPKLCIWEEJ-UHFFFAOYSA-N	434.396	1.971	50	20	IDGD	
Cc1cccc(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1Br	769257224	XWWQDKMAPPJSNU-AWEZNQCLSA-N	434.246	1.683	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccnn2-c2cccc(F)c2)cc1OC	770775226	XQLXIEQXDJPFQM-UHFFFAOYSA-N	427.392	1.428	50	20	IDGD	
O=C(NNc1ccc(Br)c(F)c1)C(=O)Nc1cc(-n2cnnn2)ccc1F	770816563	XWLZLDIAJDFAEB-UHFFFAOYSA-N	438.192	1.785	50	20	IDGD	
Cc1c(C(=O)NNc2nc(O)c3cnn(C)c3n2)nnn1-c1ccc(OC(F)F)cc1	770981518	ZEMFIDGYDRTYIQ-UHFFFAOYSA-N	431.363	1.316	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNS(=O)(=O)c1cccc(F)c1[N+](=O)[O-]	771609271	ZIJDOTQQCQXWPW-UHFFFAOYSA-N	430.801	1.013	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)CCNS(=O)(=O)c1cccc(Cl)c1	771856411	TXXIRHCZCSXSMP-LBPRGKRZSA-N	433.914	1.134	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc(F)ccc1Br)c1cc([N+](=O)[O-])ccc1O	771904281	VDQATUUUPCEPEU-UHFFFAOYSA-N	434.199	1.825	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)C1CCN(c2oc(-c3ccco3)nc2C#N)CC1	771996865	IYFMWGNERUGYCX-LBPRGKRZSA-N	429.433	1.512	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)Nc1ccc(OCC(F)F)c(C(F)(F)F)c1	772538377	PZWYTBIKBBTDHK-MRVPVSSYSA-N	445.366	1.937	50	20	IDGD	
CCCCC(=O)N1CSC[C@H]1C(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772898800	SJCSFNTWZPGRKA-AWEZNQCLSA-N	426.926	1.195	50	20	IDGD	
Cc1cc(CNC(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)ccc1S(N)(=O)=O	775226158	QRQLQDCDECXQNV-LBPRGKRZSA-N	440.909	1.594	50	20	IDGD	
N#Cc1ccc(NNC(=O)Nc2ccc(S(=O)(=O)N[C@H]3CCS(=O)(=O)C3)cc2)cc1	775469700	GIBUIEHGYPGQTP-INIZCTEOSA-N	449.514	1.172	50	20	IDGD	
O=C(CCc1ccco1)NNC(=O)c1cccc(C(=O)NNC(=O)CCc2ccco2)c1	775528063	UEKLKFHCLBKCNU-UHFFFAOYSA-N	438.440	1.660	50	20	IDGD	
CCO[C@@H]1C[C@H](NC(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)[C@H]1Oc1ccccc1	776530923	JEIGKVHUAINGJS-CGTJXYLNSA-N	430.417	1.869	50	20	IDGD	
CCO[C@@H]1C[C@@H](NC(=O)NNC(=O)c2nnc(O)c3ccccc23)[C@@H]1Oc1ccccc1	776535718	WZCAMDXAJIQIOV-LMMKCTJWSA-N	437.456	1.904	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)N[C@H]2CCN(C(=O)CCc3ccccc3)C2)c1	776626864	CBNUOYADVZLHSU-SFHVURJKSA-N	430.530	1.950	50	20	IDGD	
COCCOc1cc(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)ccn1	776737241	YWOCAQXJBXWEPE-UHFFFAOYSA-N	427.505	1.080	50	20	IDGD	
CC(=NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)C1CCS(=O)(=O)CC1	777417850	BSWVKOGNSOPNQW-UHFFFAOYSA-N	427.548	1.402	50	20	IDGD	
CCNS(=O)(=O)c1ccccc1S(=O)(=O)NNC(=O)c1ccc2ccccc2c1	777609998	NOWDUYQQNJBJFP-UHFFFAOYSA-N	433.511	1.761	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)N[C@H]1CCCN(c2ccc(C#N)cc2)C1=O	779964078	DFUIFMZHOMOOLU-KRWDZBQOSA-N	431.456	1.654	50	20	IDGD	
CSc1ccccc1S(=O)(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	780364437	AXCKTIBDFMRRFY-UHFFFAOYSA-N	429.545	1.282	50	20	IDGD	
COc1cc(S(=O)(=O)NNC(=O)Cc2cccnc2)c(OC)cc1Br	780386531	GORBLIOOIATHIP-UHFFFAOYSA-N	430.280	1.414	50	20	IDGD	
CNC(=O)[C@H]1CN(CC(=O)NNC(=O)c2cc(Cl)ccc2OC)c2ccccc2O1	781732586	XIABPZOZJUVYQE-QGZVFWFLSA-N	432.864	1.123	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)c2cc(F)ccc2C)c1	781930736	TWUNAVUKVBLSEM-UHFFFAOYSA-N	435.477	1.809	50	20	IDGD	
Cc1cc(S(N)(=O)=O)cc(NC(=O)C(=O)NNc2ccccc2Br)c1C	782989268	VTKUUDTVCGJMPX-UHFFFAOYSA-N	441.307	1.795	50	20	IDGD	
Cc1cc(Sc2ncccn2)ccc1NC(=O)C(=O)NN[C@]1(C)CCS(=O)(=O)C1	783427304	RIEXVILIPVSWFX-GOSISDBHSA-N	435.531	1.073	50	20	IDGD	
Cc1ccc(NNC(=O)C(=O)Nc2ccc(CCn3nnc(-c4ccccc4)n3)cc2)nn1	783952222	FUDRQDNKDUOIIC-UHFFFAOYSA-N	443.471	1.763	50	20	IDGD	
CC(C)(C)NC(=O)c1ccccc1NC(=O)C(=O)NNc1cccc(S(C)(=O)=O)c1	784842274	WMJSOIUBTUAJNY-UHFFFAOYSA-N	432.502	1.700	50	20	IDGD	
Cc1cc(C(=O)NC2CCCCC2)ccc1NC(=O)C(=O)NNc1ccnc(N(C)C)n1	784971172	UUVUFHWNWBFHMD-UHFFFAOYSA-N	439.520	1.995	50	20	IDGD	
Cc1ccc(-n2cc(C)cn2)c(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)c1	785060838	OTMSBPLNJVQXLT-UHFFFAOYSA-N	431.456	1.465	50	20	IDGD	
O=C(Nc1cccc(S(F)(F)(F)(F)F)c1)C(=O)N1CCN2C(=O)C(=O)NC[C@H]2C1	785211825	NSFPJKKBUNGHTC-JTQLQIEISA-N	442.366	1.452	50	20	IDGD	
CCC(=O)Nc1ccc(C)c(NC(=O)C(=O)NNc2c(OC)cccc2S(C)(=O)=O)c1	785330773	LVIMGZRWBCNFTG-UHFFFAOYSA-N	448.501	1.837	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)C(=O)Nc1ccc(Cl)cc1-c1ccccc1	785992033	VCWGUFGJYDQOPE-ZDUSSCGKSA-N	435.889	1.528	50	20	IDGD	
Cc1ccc(-n2cc(NC(=O)C(=O)NNC(=O)COc3ccc(C#N)cc3)cn2)c(C)c1	786414289	KOYMSVHFEYQFFI-UHFFFAOYSA-N	432.440	1.526	50	20	IDGD	
CC(=O)N[C@H](CC1CCC1)C(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	787442121	VZXHCOOOKSANKU-HXUWFJFHSA-N	449.983	1.300	50	20	IDGD	
CC(C)(C)OC(=O)N1CC2(C[C@@H]2C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)C1	789283618	FBNIBYTUCZQODS-CQSZACIVSA-N	448.432	1.156	50	20	IDGD	
C#CCOc1cc(F)ccc1NC(=O)C(=O)NNC(=O)[C@H]1OCC[C@H]1c1ccccc1	789809627	CEHMFSZYLAGOIW-LPHOPBHVSA-N	425.416	1.496	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2cc(OC)c(C)c([N+](=O)[O-])c2)c2ccccc2c1=O	790116583	MLBJJPBTYVVZKA-UHFFFAOYSA-N	425.401	1.716	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)[C@@](C)(O)Cn1cc(C(F)(F)F)ccc1=O	792024240	YJYFXAPUFKBCCB-ZMZPIMSZSA-N	445.369	1.372	50	20	IDGD	
Cc1nc2ccc(Br)cn2c1C(=O)NNC(=O)CNC(=O)c1cccs1	793338003	RKXORVFFKVDHEX-UHFFFAOYSA-N	436.291	1.658	50	20	IDGD	
CCc1ccccc1N1C[C@@H](C(=O)NNc2ccccc2S(=O)(=O)N(C)C)CC1=O	795168749	TWPPYNJMSFGNTC-INIZCTEOSA-N	430.530	1.996	50	20	IDGD	
Cc1oc(S(N)(=O)=O)cc1C(=O)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1	798334567	HKUHWBFUKQZXRO-UHFFFAOYSA-N	427.382	1.286	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(Cl)c(CN(C)C)c2)cc1	799257355	JQMXZDWOHABVEF-UHFFFAOYSA-N	434.880	1.575	50	20	IDGD	
Cc1ccccc1NC(=O)NNC(=O)C(=O)Nc1ccc(O[C@@H]2CCN(C)C2=O)cc1C	799261119	NXLARTCSPXFBQX-GOSISDBHSA-N	439.472	1.704	50	20	IDGD	
CC(C)(C)OC(=O)NCC[C@@H]1CCCN(C(=O)NNC(=O)CNC(=O)c2ccco2)C1	799367311	BKDXLIMJHLGZGY-AWEZNQCLSA-N	437.497	1.377	50	20	IDGD	
CC(CC(C)(C)c1c[nH]c2ccccc12)=NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C	799483443	PNFUIMBJVUOWRU-UHFFFAOYSA-N	449.515	1.775	50	20	IDGD	
COc1cccc(C2(C(=O)OCC(=O)NNC(=O)[C@@H]3COc4ccccc4O3)CC2)c1	803791580	DBJPRPXOSROIJI-SFHVURJKSA-N	426.425	1.257	50	20	IDGD	
COC(=O)c1c(C)csc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccc(C(C)=O)cc1	806975235	REJAUFOGCKZBEB-LBPRGKRZSA-N	447.469	1.599	50	20	IDGD	
Cn1ncc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c1-c1ccccc1	806979850	HXIMVMIIYQQNDD-UHFFFAOYSA-N	429.440	1.673	50	20	IDGD	
CS(=O)(=O)c1cc(CNC(=O)NNC(=O)c2ccccc2O)cc(C(F)(F)F)c1	807222340	MCFMGUPPICSKSY-UHFFFAOYSA-N	431.392	1.959	50	20	IDGD	
CSSCCNC(=O)N1CCN([C@H]2CCCN(c3cc(C)nn3C)C2=O)CC1	807230989	GDRLQFFWJDODMH-HNNXBMFYSA-N	426.612	1.562	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2ccc(-n3ccnc3)nn2)nn1-c1cccc(Cl)c1	807428742	JYGSOZHISQYKKP-UHFFFAOYSA-N	437.851	1.892	50	20	IDGD	
CN(C)C(=O)CN1[C@H]2CC[C@H]1CC(NC(=O)NNC(=O)Cc1cccc3ccccc13)C2	807513465	CBAYDDHTVNMOSN-PMACEKPBSA-N	437.544	1.796	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)NC1CCN(C(=O)c2cc(Cl)c[nH]2)CC1	807514221	LZETYFAPQYVGGM-UHFFFAOYSA-N	434.840	1.825	50	20	IDGD	
COCC(C)(C)CCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	807582893	WHPLPBBZMLWAJC-UHFFFAOYSA-N	440.566	1.868	50	20	IDGD	
CCCNS(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)c2cccc(Cl)c2)cc1	808068483	AXWKIIQTSFKTDH-UHFFFAOYSA-N	431.923	1.652	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)OCC(=O)Nc2ccc3c(c2)C(=O)N(C)C3=O)cc(C#N)n1C	809303837	UEPCXAOHFCFVEF-NSIKDUERSA-N	431.408	1.520	50	20	IDGD	
COC[C@]1(C(=O)NNC(=O)CNc2cccc(OC)c2)CCN(C(=O)OC(C)(C)C)C1	810006768	PJMPYOPDDGXOIV-NRFANRHFSA-N	436.509	1.528	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCC(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)cc1	810383076	YEIDAABIDDDFEV-UHFFFAOYSA-N	433.494	1.017	50	20	IDGD	
COc1ccc(CNC(=O)NNC(=O)CSc2ccc(C)cc2)cc1S(N)(=O)=O	812427973	BWBFYEGHNCZYLY-UHFFFAOYSA-N	438.531	1.274	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cc(C#N)cc(N(C)C)c3)CC2)cc1	814413927	OSKYVMWTGWKGOB-UHFFFAOYSA-N	434.544	1.512	50	20	IDGD	
COC(=O)c1c(F)cccc1NNC(=O)CN1C(=O)N[C@](C)(c2ccc(OC)cc2)C1=O	819711513	XTENKHIBZWITDN-OAQYLSRUSA-N	444.419	1.531	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2cccc(C(=O)NNS(=O)(=O)c3ncc[nH]3)c2)c(C)c1	821118924	HKOUJHMIHWUGLF-UHFFFAOYSA-N	449.514	1.451	50	20	IDGD	
Cc1cccc(-c2nnc(-c3ccc(C(=O)NNC(=O)[C@@H]4CCS(=O)(=O)C4)cc3)o2)c1	880177261	PVQIGYNSMDBFEN-QGZVFWFLSA-N	440.481	1.908	50	20	IDGD	
COC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCN(Cc3ccccc3)CC2)c1	913176813	XLHUOMLEHDNEOP-UHFFFAOYSA-N	432.502	1.194	50	20	IDGD	
CCOc1ccc(NC(=S)NNC(=O)CNS(=O)(=O)c2ccccc2F)cc1	913444012	SWWKOQMXBPSRBM-UHFFFAOYSA-N	426.495	1.521	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cc(Cl)c(Cl)n2C)cc1OC	914906732	DXGFTDXSQNZJHG-UHFFFAOYSA-N	430.244	1.967	50	20	IDGD	
CC(C)NC(=O)C(=O)NNC(=O)c1nn(-c2cccc(Br)c2)c2c1CCCC2	916111039	UKLJMQSGWJXPPT-UHFFFAOYSA-N	448.321	1.799	50	20	IDGD	
CCCn1c(C)cc(/C=C(\C#N)C(=O)N2CCN(C(=O)C(=O)N3CCCC3)CC2)c1C	916433417	PJSQPUBTZBROKA-HMMYKYKNSA-N	425.533	1.715	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCCN2CCc3ccccc32)c1	916458148	WVMJRORMBVWUKM-UHFFFAOYSA-N	445.545	1.334	50	20	IDGD	
CCOc1ccc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1[N+](=O)[O-]	916655446	ZUWFJSWPKFVXMW-KRWDZBQOSA-N	445.384	1.138	50	20	IDGD	
O=C(NNC(=O)C1CCN(C2=NS(=O)(=O)c3ccccc32)CC1)c1ccc(Cl)nc1	917250976	ORJOFKWKTRCWHA-UHFFFAOYSA-N	447.904	1.357	50	20	IDGD	
C=CCNC(=O)c1cccc(S(=O)(=O)NNC(=O)COc2ccccc2OCC)c1	917721354	VNVWQGKZHGGCGO-UHFFFAOYSA-N	433.486	1.390	50	20	IDGD	
CN(Cc1cccc(Br)c1)C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	918001572	CAARKVXCPXFJIG-UHFFFAOYSA-N	430.266	1.911	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)CCCNC(=O)c2ccc(F)cc2)c2ccccc2c1=O	919805662	FJNJBYSWDSIJBK-UHFFFAOYSA-N	425.420	1.044	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)c2ccc(Br)cc2n1	919886481	RVPDBTAVWAMDSL-NSHDSACASA-N	441.307	1.437	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(OCC2CCCCC2)cc1)N[C@@H]1CCS(=O)(=O)C1	919960752	GQQKVWFGLFWHNS-OAHLLOKOSA-N	445.563	1.325	50	20	IDGD	
CC(C)(C)C(=O)N1CCC[C@H](C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)C1	920714939	GZJXOKXIAONMCE-AWEZNQCLSA-N	434.449	1.184	50	20	IDGD	
CCNC(=O)NNC(=O)c1cc(S(=O)(=O)NCCOc2ccccc2)ccc1Cl	920858824	GGYAGJCKUCWMQX-UHFFFAOYSA-N	440.909	1.661	50	20	IDGD	
O=C(C[C@@H]1CCS(=O)(=O)C1)NNc1ccc(S(=O)(=O)Nc2nccs2)cc1	1252518987	QCDYLDJWJDOXOV-NSHDSACASA-N	430.533	1.212	50	20	IDGD	
CN1CCN(Cc2cccc(CNC(=O)NNC(=O)c3nnc(O)c4ccccc34)c2)CC1	1318226112	KOBAHIHGMCWXBS-UHFFFAOYSA-N	449.515	1.227	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)N[C@H]2CCC[C@@H](S(C)(=O)=O)C2)CC1	1318801338	RWQJJBJJSVGODI-LSDHHAIUSA-N	446.570	1.320	50	20	IDGD	
Cc1c(C(=O)N2CC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)oc2ccccc12	1777751508	RSSSICFTXRJDOA-HSZRJFAPSA-N	442.516	1.558	50	20	IDGD	
CCn1nc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](O)CCl)C3)c2ccccc21	1777765415	BCKSADLRUPEWNS-NJNPRVFISA-N	448.951	1.783	50	20	IDGD	
C=CC(=O)N[C@@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CO[Si](C)(C)C)C2	1779535057	ZQNVSCQOSQDNAP-RZQQEMMASA-N	425.602	1.043	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2c[nH]c(=O)cn2)C1	1780123874	FLIDPCOVSFFRCU-FSPWUOQZSA-N	431.320	1.134	50	20	IDGD	
COc1cc(C(=O)N2CC[C@]3(CN(C(=O)CCBr)CCO3)C2)ccc1O	1780747600	JNOJBBFHCLTUMX-SFHVURJKSA-N	427.295	1.629	50	20	IDGD	
O=C(c1nc(O)n2c1CCCC2)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781331240	HEHTWIUALIDSJO-CXAGYDPISA-N	445.289	1.059	50	20	IDGD	
CC(=O)N/C(=C\c1ccco1)C(=O)N1CC[C@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1781865435	IMQOTKTUKCJBKZ-CNEDASOKSA-N	449.580	1.438	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(O)n1)C2	1781996882	XDILGLLBTWAMSY-RVZJWNSFSA-N	426.311	1.698	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(Cl)Cl)C2)[C@@H]1CCc2nc[nH]c2C1	1782459301	FSPGURXKOUGLCW-KPAZRMRSSA-N	429.348	1.832	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)[C@@H]3Cc4ccccc4CN3)CCO2)C1	1783534001	CPZPZSOZVLSWHJ-LIVBEALHSA-N	436.350	1.314	50	20	IDGD	
COc1ccc([C@@H]2C[C@H]2C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]3C2)cc1	1784085041	BQAQQPSXKQSMSH-XVAUXIKLSA-N	436.936	1.378	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(-c4ccccc4)nc3)C[C@@H]21)[C@H](O)CCl	1784091436	UIBIRDIDDJSKNS-MMKMLUHNSA-N	443.931	1.942	50	20	IDGD	
C[C@H](Sc1ccccc1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21	1784348477	HYNSHDLOGHIRRM-XWJBARJFSA-N	426.966	1.747	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(F)(F)C(F)(F)C(=O)O)[C@H]2C1	1784917122	BQVIALSDAJFPIP-NAKRPEOUSA-N	432.798	1.339	50	20	IDGD	
Cc1cccnc1CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21	1785206082	LPNDJBZWQJOHKE-DNUAJFIVSA-N	442.329	1.993	50	20	IDGD	
O=C(CCNC(=O)c1ccc[nH]1)Nc1ccc(C2(NC(=O)[C@@H](O)CCl)CCC2)cc1	1786829531	XTYKJZWSDABMQC-KRWDZBQOSA-N	432.908	1.868	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3n[nH]c4c3CCCC4)[C@H]2C1	1787315023	ARVLGXDIBUDMIV-ZVZYQTTQSA-N	434.613	1.733	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CC(F)(F)F)C[C@@H]21	1787508918	SQPARAIXYQCWIL-RJSLJBRQSA-N	443.426	1.053	50	20	IDGD	
NC(=O)[C@H](N)CCC(=O)Nc1ccc(C2(NC(=O)[C@@H](F)Br)CCC2)cc1	1788059935	BPWYDPHFDYFXRI-TZMCWYRMSA-N	429.290	1.404	50	20	IDGD	
CCc1cc(C(=O)Nc2ccc(C3(NC(=O)c4ccc(B(O)O)cc4)CCC3)cc2)n[nH]1	1788332872	VJPOOURIHGDIMP-UHFFFAOYSA-N	432.289	1.713	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CSCc3[nH]cnc3C)[C@H]2C1	1788540872	DUKSMUXGCPEFJH-MPTYRVRUSA-N	444.985	1.185	50	20	IDGD	
C=C[C@H](O)C(C)(C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](Br)CC)C[C@@H]21	1788575736	BTUPOGGDIACZNY-QMHWVQJVSA-N	431.371	1.713	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCC3CCCC3)C[C@@H]21	1788610799	VEROBSWTOXOICT-VDGAXYAQSA-N	443.548	1.249	50	20	IDGD	
COCc1c[nH]c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCBr)C[C@@H]32)c1	1789211968	ZGJBYSCNCZEPQM-DZKIICNBSA-N	428.327	1.539	50	20	IDGD	
Cc1ncccc1CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]2C1	1789922123	HUFPAXQPRGXJGV-NBOOPKSLSA-N	442.329	1.993	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(C)(C)NCCC#N)C[C@@H]21	1790961313	IALHBLYQRKSNLP-VGWMRTNUSA-N	443.386	1.421	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)c3ccccc3)C[C@@H]21	1790961474	LRQCJJLQKCXLSL-KFGODFMUSA-N	439.350	1.873	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3nc(C)no3)C[C@@H]21	1790962171	WUQFBXADHBLPGD-XUXIUFHCSA-N	429.315	1.074	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3nc(C)sc3C)C[C@@H]21	1791252575	OFOZRHUSZMIIFC-JKQORVJESA-N	429.970	1.536	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3Cc4ccccc4CN3C)C[C@@H]21	1791252625	QGAMEARATBELKB-FCMAGTKHSA-N	449.979	1.277	50	20	IDGD	
Cc1ccc(/C=C/C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]32)s1	1791584759	IPYZMNWHHOUPSX-YMKQDGHPSA-N	448.589	1.422	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Nc1cccnc1)C2	1792867926	NVPGVNDHSKQCPA-WVCIDPQESA-N	439.354	1.503	50	20	IDGD	
CC(C)(C)OC(=O)N1C(=O)CC[C@H]1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCl	1793116108	GLLHKBAAKHZOSM-AICCOOGYSA-N	443.928	1.150	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnccc1C(F)(F)F	1795075559	NFFXLEDVGYAENP-BTTYYORXSA-N	441.454	1.725	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1ccc(Cl)cc1)c1cccc(B(O)O)c1	1795660381	ZUQIPNJWXLZJDR-ACDBMABISA-N	426.709	1.514	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1nccc2nc[nH]c12	1796241304	BUJUOBSQJPJCSE-OPDFLTKYSA-N	436.310	1.335	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](C)n1ccnc1)C2	1796890696	FXPKTXXKLGPOIA-PIEAIKFESA-N	425.493	1.216	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cn2ccsc2n1	1797485772	IRJFDKOEOVJDDE-KQXIARHKSA-N	427.324	1.382	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)COCc1ccccc1)C2	1798439134	GADFUQRNTSLGPK-BCDXTJNWSA-N	437.500	1.154	50	20	IDGD	
CN(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccno1)C2)NC(=O)NCc1ccccc1	1799864656	CNBCKAGRQZLOTQ-BCDXTJNWSA-N	440.504	1.273	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(C)cc1-n1nccn1)C2	1800979323	ZUMGWGSNADQVDH-LORHWOILSA-N	447.923	1.033	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc2c(c1)NC(=O)CC2	1801149164	NMJXFLDEYVRCTG-BCDXTJNWSA-N	441.532	1.196	50	20	IDGD	
C[C@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cn1cccc([N+](=O)[O-])c1=O)C2	1801966536	LNICMBGTNBRDEE-RVMXOQNASA-N	441.282	1.178	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1CCN(C(=O)[C@H]2CNC(=O)C2)[C@H]1c1cccnc1	1803016164	SWLDQRLYHJBSTH-JWDQPFGJSA-N	437.338	1.255	50	20	IDGD	
CC1(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](O)CCl)C3)CN(C(=O)OC(C)(C)C)C1	1804579468	ZAYQCIDTDQWTQF-QKPAOTATSA-N	443.972	1.871	50	20	IDGD	
O=C(CC1CCCC1)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1806190326	VBENIMJUWZDULD-OFNKIYASSA-N	435.333	1.661	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H](CNC(=O)[C@H]2CCC(=O)N2)[C@@H]1c1cccnc1	1806816804	BLOMHALAVBYELF-DLTWYDFYSA-N	437.338	1.540	50	20	IDGD	
Cc1c[nH]cc1C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1808581032	RMAHIIVMYWSTPI-WIYYLYMNSA-N	432.289	1.031	50	20	IDGD	
C[C@@H](Nc1ccccc1)C(=O)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1	1809978943	YTGNALSGUJZRIE-LJQANCHMSA-N	449.360	1.712	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)Cc2cncnc2)[C@@H]1c1cccnc1	1812864604	JDIUNKDMNGWFKY-QANKJYHBSA-N	432.322	1.904	50	20	IDGD	
Cc1nn(C)c(C)c1CC(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1	1813415570	MMDCYBXXLZZPFC-QRFRQXIXSA-N	433.940	1.280	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)CN3CCCC3=O)sc2C1	1814601219	GJCSABQCFGTNOO-VHSXEESVSA-N	429.340	1.461	50	20	IDGD	
O=C(Cc1cccs1)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2	1815589787	OEDKOCXYSVWLEM-AWEZNQCLSA-N	441.343	1.353	50	20	IDGD	
Cc1ncccc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1816391655	FLAPMPPELJCDGB-IBGZPJMESA-N	433.277	1.413	50	20	IDGD	
CCc1oncc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1816605093	LWXOGFXYLRFBQH-KRWDZBQOSA-N	437.265	1.260	50	20	IDGD	
O=C(N[C@@H]1CCc2nc(NC(=O)[C@H](F)Cl)sc2C1)c1cc2n(n1)CCCNC2=O	1817121796	BMFYEAFFEDQMSY-OQPBUACISA-N	440.888	1.233	50	20	IDGD	
CNCCCC(=O)N[C@H]1CCc2nc(NC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)sc2C1	1817279798	FZJUMZCMDUOENY-UQJRAWQTSA-N	445.549	1.189	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCc2cnn(C)c2)n[nH]1	1817517596	UKXQSGUHLIHMBI-QGZVFWFLSA-N	444.540	1.141	50	20	IDGD	
CN1CCN(CC(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@](C)(Cl)CCl)CC3)CC1	1818802926	OQYSVSCIUDCMDM-KZULUSFZSA-N	448.420	1.539	50	20	IDGD	
C=CCSCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819401778	RYTUECPKGYASAJ-MRXNPFEDSA-N	443.533	1.633	50	20	IDGD	
Cc1cnoc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819403273	BOCCEXYRRJQQFF-OAHLLOKOSA-N	438.448	1.324	50	20	IDGD	
Cc1nccnc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1819951489	ZEABAFRQRRJOGK-MRXNPFEDSA-N	449.475	1.126	50	20	IDGD	
CC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnccc1C(=O)NN)CC2	1822850182	PTLJQHYIFDJXTD-JOYOIKCWSA-N	436.925	1.385	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)C2CC(F)(F)C2)CC1	1823852233	REEIBWWLJNJEQJ-SFHVURJKSA-N	449.502	1.964	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H]1CCC(=O)N1C)CC2	1825646062	OHYDUNBMYMRADW-YWVKMMECSA-N	429.340	1.459	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)Cc1cccc(F)c1)CC2	1826085051	BCHBKZLTKOKDCQ-HNNXBMFYSA-N	447.536	1.810	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H]1CCCS1(=O)=O)CC2)C(Cl)Cl	1826103749	ZVFGYEITLSPDTQ-XVKPBYJWSA-N	426.347	1.436	50	20	IDGD	
O=C(Cn1ccncc1=O)N1CCC([C@H]2CCCCN2C(=O)CCBr)CC1	1826359633	LYOUNGOOOYDXPS-MRXNPFEDSA-N	439.354	1.648	50	20	IDGD	
Cc1cc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)cnc1C	1827056337	SHZGMDPTAMWEAL-HSZRJFAPSA-N	449.360	1.925	50	20	IDGD	
CCOC(=O)N[C@H](O)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)C(C)(C)CCl)CC1	1828760391	OFWJILZAPOTHHQ-HZPDHXFCSA-N	431.961	1.936	50	20	IDGD	
CCC(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)[C@H](O)CCl)C2)C1	1828824082	UENHFXHYPDPXLG-UTKZUKDTSA-N	437.924	1.448	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ncccc2F)CC1	1829462247	UGIUDIPXQWPNSU-SFHVURJKSA-N	433.528	1.827	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccn4nccc4c3)C2)C1	1830362399	UZVTUPYHYGFFAX-OAQYLSRUSA-N	434.924	1.669	50	20	IDGD	
O=C(c1cccc2ccccc12)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1830728134	PTRCGTMGMRRHBW-UGKGYDQZSA-N	432.904	1.510	50	20	IDGD	
O=C(c1cc(F)cc(Cl)c1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1830738797	TXAIGUBCJXHFCR-MAUKXSAKSA-N	435.279	1.149	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H]2CCCO2)CC1	1831620952	LAIKEDZYPHZXGP-MOYYENFUSA-N	443.548	1.919	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)C/N=C/c3ccco3)C2)C1	1831649854	CFFWAWYJXHWHOO-VRFIZVPASA-N	425.913	1.562	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)CC[C@@H]2CCOC2)CC1	1831876935	NCEGAILXHOJYKK-UYAOXDASSA-N	436.597	1.796	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3nc(Cl)ccc3F)CCO2)C1	1833242194	ADLZUIMCGMSXKU-KPZWWZAWSA-N	434.295	1.962	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ncc(OC)cc3F)CCO2)C1	1833630080	WZKGMNZMQVQKIV-QRWLVFNGSA-N	443.903	1.707	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)o1	1835732944	CNQVCQJSGLZWFE-INIZCTEOSA-N	440.928	1.023	50	20	IDGD	
C[C@@H](C(=O)N1CCC(N2CCC(NC(=O)CO[Si](C)(C)C)CC2)CC1)C1(O)CCC1	1835835206	USRAQEMJQLKNDF-KRWDZBQOSA-N	439.673	1.961	50	20	IDGD	
CC(C)CNC(=O)C(=O)N1CCC(N2CCC(NC(=O)[C@@](C)(Cl)CCl)CC2)CC1	1836398365	OONZMBKMEPBGJE-FQEVSTJZSA-N	449.423	1.567	50	20	IDGD	
Cc1cc(C)n(CC(=O)N2CCC(OC3CCN(C(=O)[C@H](O)CCl)CC3)CC2)n1	1836714917	CQDLBHDZTBAPKQ-GOSISDBHSA-N	426.945	1.098	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](C)n3ccnc3)CC2)CC1	1836779965	JQSOSBNQGXAQGB-CRAIPNDOSA-N	426.945	1.697	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3ccc[n+]([O-])c3)CC2)CC1	1837244155	AGKUNHFHDUHUDJ-GOSISDBHSA-N	425.913	1.186	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CSc3ccncc3)C2)C1	1839142203	JHLUIOBYRFWCLZ-LPHOPBHVSA-N	427.954	1.648	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C#N)cc(OC)c3)C2)C1	1839146677	RZXDLSQUALIPCE-WIYYLYMNSA-N	435.908	1.654	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)cn1C	1839153454	YWFLPVYOYZNGFW-OALUTQOASA-N	432.348	1.640	50	20	IDGD	
O=C(c1ccc(F)s1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839198421	ZXFSTTTWKPOSDM-IUODEOHRSA-N	439.278	1.648	50	20	IDGD	
O=C(c1cccc2nscc12)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1839576260	USVFFAPPUVJYFB-QAPCUYQASA-N	427.885	1.901	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)OC(=O)OCC)CCO2	1839681623	UXXYLCLPZJIVBP-ZRGWGRIASA-N	434.917	1.412	50	20	IDGD	
O=C(C[C@@H]1C[C@@H]2CC[C@H]1C2)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1839915229	JKCIWHHWBRRCNJ-YEAFQPLXSA-N	447.345	1.960	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3oc(C)nc3C)C2)C1	1839965467	ZIVYRAODLQWLSY-KSSFIOAISA-N	444.326	1.535	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(OC)ccc3F)C2)C1	1840156143	JFBPHYCSCKXHGQ-OXJNMPFZSA-N	444.887	1.158	50	20	IDGD	
O=C(c1scnc1C1CC1)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840186319	IWNLRSBCJHDPTA-KRWDZBQOSA-N	434.345	1.894	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3cnc(C)s3)CCO2)C1	1840398144	PSPZPVMEXNESGE-APWZRJJASA-N	429.970	1.858	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCCC12CN(C(=O)c1cc(O)no1)C2	1841924670	OHJGPVMLRLFYHJ-NSHDSACASA-N	428.873	1.329	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)c2ccc(=O)oc2)C1	1842576710	QFJGCWMJUFQVGP-UHFFFAOYSA-N	441.396	1.604	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)Cc1ccccc1F)C2	1843415800	OBYRLAOCRRYYFB-MFKUBSTISA-N	425.464	1.706	50	20	IDGD	
Cn1c(=O)n(C)c2cc(C(=O)N3CCCC34CN(C(=O)CO[Si](C)(C)C)C4)ccc21	1843734245	YSBOHOUUSFNVMD-UHFFFAOYSA-N	430.581	1.546	50	20	IDGD	
C=CC(=O)N[C@@H](C)C(=O)N1CCCC12CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1844368874	DKCMIXUNBIBGJJ-KBPBESRZSA-N	442.944	1.013	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCCC12CN(C(=O)c1cnc3c(c1)NC(=O)CS3)C2	1844378989	FBQUFNVXJAUCLJ-UHFFFAOYSA-N	434.594	1.794	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)Cc1noc(C)n1)C2	1844692058	BEAWHBVWSXBLJV-UHFFFAOYSA-N	443.416	1.271	50	20	IDGD	
O=C([C@H](Br)Cc1ccccc1)N1CC2(CCCN2C(=O)c2c[nH]c(=O)cn2)C1	1844763979	SCGVIKLDTAGSPM-OAHLLOKOSA-N	445.317	1.593	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@H](O)c2cccc(Br)c2)C1	1845042162	BEGBTPWBUVCSHN-LSDHHAIUSA-N	445.741	1.940	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)c1csc(C(F)(F)F)n1)C2	1846385340	RWRMMXPEBIFIDY-UHFFFAOYSA-N	433.456	1.352	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC2(CCCN2C(=O)/C=C/c2cnc[nH]2)C1	1846531981	VWXLYAGHOIQTJM-NFAHFFEMSA-N	437.928	1.758	50	20	IDGD	
COc1ccc(-c2nnc(SCC(=O)NNC(=O)[C@@H]3COc4ccccc4O3)o2)cc1	8633394	WGJZITFFLHGXIR-INIZCTEOSA-N	442.453	1.825	50	20	IDGD	
O=C(COC(=O)c1cc(I)ccc1O)NNC(=O)c1cccs1	10590246	UKCRNDZUSFPCSN-UHFFFAOYSA-N	446.222	1.676	50	20	IDGD	
CCn1c(=O)c(=O)[nH]c2cc(C(=O)NNC(=O)Cc3nc(-c4ccccc4)cs3)ccc21	10600009	NQOXZUVGGYNAFI-UHFFFAOYSA-N	449.492	1.837	50	20	IDGD	
COc1ccc(Cc2nnc(SCC(=O)NNC(=O)c3ccc(C)cc3)n2N)cc1	10921201	ZZGMCWVTJLHQPA-UHFFFAOYSA-N	426.502	1.453	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)CNC(=O)c2cccc(Cl)c2)c2ccccc2c1=O	17190367	KESHWIDNBMHMFO-UHFFFAOYSA-N	427.848	1.261	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)[C@H](C)NS(=O)(=O)c2ccc(Cl)cc2)c1	17203123	YMGNVSBJBZWZIO-AWEZNQCLSA-N	439.921	1.850	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)c2ccc(COc3ccccc3)o2)cc1S(N)(=O)=O	26631958	VDWUUGIHZKOZSK-UHFFFAOYSA-N	429.454	1.889	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN(C(=O)c2ccc(F)cc2)C1)c1ccc(-n2cnnn2)cc1	27093841	YKMHUJQNLDZNBK-MRXNPFEDSA-N	437.435	1.115	50	20	IDGD	
CCn1cc(NC(=S)NNC(=O)CN2c3cccc4cccc(c34)S2(=O)=O)cn1	726123457	KIDBRWKGGPDBMP-UHFFFAOYSA-N	430.515	1.583	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)NC[C@H](c1ccc(Cl)cc1)N1CCOCC1	726245898	CJFJFFOKLSJVKC-MRXNPFEDSA-N	449.895	1.067	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cccc(CN3CCOCC3)c2)cc(OC)c1OC	727753173	UGEQDBCGSAVRMP-UHFFFAOYSA-N	429.473	1.619	50	20	IDGD	
CCCS(=O)(=O)N1CCCC[C@H]1C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	728211059	FPGIHUAQWXNOLU-KRWDZBQOSA-N	444.579	1.165	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COc2ccccc2O)cc1S(=O)(=O)N1CCCCC1	730781769	BBZXFCQHPLYORN-UHFFFAOYSA-N	447.513	1.715	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)NC[C@@H](c1ccc(Cl)cc1)N1CCOCC1	730824512	HXLUMXZUUUBDKQ-KRWDZBQOSA-N	448.907	1.828	50	20	IDGD	
Cc1cc(C)nc(SCc2ccc(C(=O)NNC(=O)CCCS(C)(=O)=O)cc2)n1	731165448	VBXQQJOOWFGQGS-UHFFFAOYSA-N	436.559	1.972	50	20	IDGD	
O=C(COC(=O)c1cccc(N2CCOC2=O)c1)NNC(=O)c1cccc([N+](=O)[O-])c1	732324043	BCLWFTWJCKNEBL-UHFFFAOYSA-N	428.357	1.169	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc(S(=O)(=O)N(C)C)c1C	733110506	NHBRUOZLMAIRCA-UHFFFAOYSA-N	441.513	1.814	50	20	IDGD	
COc1ccc([C@H]2[C@@H](C(=O)NNC(=O)CNC(=O)c3cccs3)CCC(=O)N2C)cc1	734321518	IKADREZDARAQOA-KXBFYZLASA-N	444.513	1.244	50	20	IDGD	
COc1ccc([C@@H](CNC(=O)NNC(=O)COCc2ccccc2)N2CCOCC2)cc1	738963211	MDWFNKMLXKXWFL-OAQYLSRUSA-N	442.516	1.616	50	20	IDGD	
Cc1cc(C=NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)c(C)n1CCN1CCOCC1	741770722	MSORHOMYYBNILS-UHFFFAOYSA-N	447.561	1.996	50	20	IDGD	
CN(C)c1cc(CNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c2ccccc2n1	743589021	ODBFSKUGQOLMIA-UHFFFAOYSA-N	448.531	1.838	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)CN2C(=O)COc3ccc([N+](=O)[O-])cc32)cc1	743829340	MJZXYOHYBLHKKM-UHFFFAOYSA-N	428.405	1.239	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(CCNC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)CC1	744896236	UEYFRNLAUKTLEO-UHFFFAOYSA-N	436.469	1.092	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)N[C@@H]1CC(=O)N(CCOc2ccccc2)C1	745848653	VEYUHYBDDOJPKM-GOSISDBHSA-N	440.500	1.638	50	20	IDGD	
O=C(NCCc1ccn(-c2ccc(F)cc2)n1)NNC(=O)c1ccc2c(c1)OCCO2	745891866	HEHHPAMAWHXRQN-UHFFFAOYSA-N	425.420	1.969	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCCC(=O)OC(C)(C)C)c1	745931126	MTVHJHQWSDNKCX-UHFFFAOYSA-N	428.511	1.003	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)[C@H]1CCCN(C(=O)CCOc2ccccc2)C1	746544962	CIJMMPGPJKUNTF-SFHVURJKSA-N	449.511	1.732	50	20	IDGD	
COc1cc(C)nc(NNC(=O)NCc2ccccc2OCC(=O)NC[C@H]2CCCO2)n1	746757114	DSVIQLIDTYGUPB-MRXNPFEDSA-N	444.492	1.294	50	20	IDGD	
COC(=O)c1ccsc1N1CC[C@@H](NC(=O)NNC(=O)c2cccc(Cl)c2)C1=O	746778394	BCPMFQJLDXATRO-CYBMUJFWSA-N	436.877	1.938	50	20	IDGD	
CSCc1noc(CCC(=O)NNC(=O)c2ccc(CSc3nncn3C)cc2)n1	746822034	MBLDQJFFRNCOHQ-UHFFFAOYSA-N	447.546	1.747	50	20	IDGD	
O=C(NCCC(=O)N1CCN(c2ccccc2)CC1)NNC(=O)c1c[nH]c2ccccc12	748465278	NQQJFLPAKIZPNJ-UHFFFAOYSA-N	434.500	1.851	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)NC[C@@H]1CCN(c2cccc(Br)c2)C1	748625004	KGFXVVBDIUQODB-KBPBESRZSA-N	443.342	1.657	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)[C@@H]1CCCN1S(=O)(=O)c1cccs1	749262607	XERAPLCUEIXIIF-ZDUSSCGKSA-N	439.515	1.136	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)C(=O)Nc1ccc(Cl)cc1	751051648	PMJYUMNUMQZMJV-UHFFFAOYSA-N	429.908	1.638	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccc(C(=O)NNC(=O)CNC(=O)c2cccs2)cc1	751209908	XVFIYQFRRPAVNR-UHFFFAOYSA-N	438.531	1.016	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CC(=O)N(CCOc2ccccc2Cl)C1)c1ccc2c(c1)OCO2	751540509	KNZABJBUTIRZLM-CQSZACIVSA-N	445.859	1.757	50	20	IDGD	
CS(=O)(=O)NCc1ccc(C(=O)NNC(=O)NCc2cccc(C(F)(F)F)c2)o1	753595868	KVBUNYWWWFEOQI-UHFFFAOYSA-N	434.396	1.492	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)c1ccnc(O[C@@H]2CCOC2)c1	754000349	MPTRMIPBZKDBFM-HXUWFJFHSA-N	439.516	1.223	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NC(=O)NNC(=O)COc2ccc(C#N)cc2)cc1	755517719	PPQDJXSGOHHRMZ-UHFFFAOYSA-N	431.474	1.477	50	20	IDGD	
CCn1cc([N+](=O)[O-])c(C(=O)OCC(=O)NNC(=O)c2cc(Cl)ccc2OC)n1	755573371	IHTQFHCPIQTJEI-UHFFFAOYSA-N	425.785	1.091	50	20	IDGD	
O=C(CCC(=O)NC1CCCC1)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	756003755	VOLRFEZBRNJGSI-UHFFFAOYSA-N	449.983	1.444	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)Nc2cccnc2N2CCOCC2)n[nH]1	756186123	HGMSASKYVISCMP-UHFFFAOYSA-N	437.460	1.783	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)cc1-n1nnnc1C	756318464	IHRQWNNPGIWXST-UHFFFAOYSA-N	433.432	1.836	50	20	IDGD	
COCCNC(=O)Cn1cc(NC(=O)NNC(=O)c2cc3c(s2)CC[C@H](C)C3)cn1	756836440	AMFZWQVZBXXSPJ-LBPRGKRZSA-N	434.522	1.299	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)Nc2cnn(CC(=O)N3C[C@H](C)O[C@@H](C)C3)c2)c1	756838121	LNQYNVAPQONJEL-HOTGVXAUSA-N	444.492	1.059	50	20	IDGD	
O=C([C@@H]1CC(=O)N(c2ccccc2F)C1)N1CCN(S(=O)(=O)CBr)CC1	758523294	ODJPXSOGJBRXNG-GFCCVEGCSA-N	448.314	1.005	50	20	IDGD	
Cc1c(C(=O)NNC(=O)C(=O)Nc2ccccn2)cnn1-c1cccc(C(F)(F)F)c1	758832280	WJRVIQIINNWIHY-UHFFFAOYSA-N	432.362	1.994	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cccc(-c3nnc(C)o3)c2)cc1OC	758979077	IFPKHTVCOZSHAY-UHFFFAOYSA-N	440.412	1.680	50	20	IDGD	
CCO[C@@H]1C[C@H](NC(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)[C@@]12CCCO2	760140944	DXBRYUABVDDGKC-DAYGRLMNSA-N	427.527	1.121	50	20	IDGD	
Cc1ccnc(-n2nccc2NC(=O)C(=O)NNC(=O)c2cc(Br)cn2C)c1	760277582	NNSPUCNXGYTDQN-UHFFFAOYSA-N	446.265	1.076	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)CNC(=O)c1ccc(OC)c([N+](=O)[O-])c1	761633878	OLHFSHDHJFKJSY-UHFFFAOYSA-N	448.457	1.282	50	20	IDGD	
CNS(=O)(=O)c1cccc(CNC(=O)NNC(=O)CSc2ccccc2OC)c1	761663478	HHYBYCIVKFDRLD-UHFFFAOYSA-N	438.531	1.226	50	20	IDGD	
CCOc1cc(N2CCN(C)CC2)ccc1NC(=O)C(=O)NNC(=O)c1ccccc1	763430082	KDVHIWFQWJCYMT-UHFFFAOYSA-N	425.489	1.237	50	20	IDGD	
CCOc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	763441347	BNOKXPYVYDZSAI-UHFFFAOYSA-N	443.416	1.095	50	20	IDGD	
C#CCOc1cc(F)ccc1NC(=O)C(=O)NNC(=O)c1ccccc1Br	763484117	XZQQHAHRHNQICD-UHFFFAOYSA-N	434.221	2.000	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cnn(CC(C)C)c2C)cc(OC)c1OC	763539067	IIIUYVHGYGCLNL-UHFFFAOYSA-N	433.465	1.273	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cc3c(cc2F)CCC(=O)N3)cc1OC	763551736	ZSOVRSXPCJXTGZ-UHFFFAOYSA-N	430.392	1.127	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)Nc1c(F)cccc1Br	763572972	OXWDYQRVSWPURF-ZDUSSCGKSA-N	438.209	1.514	50	20	IDGD	
CC(C)(C)c1ccc(OCC(=O)NNC(=O)C(=O)Nc2c[nH]nc2-c2ccccn2)cc1	763601393	YKAIAUIQMCCRAO-UHFFFAOYSA-N	436.472	1.934	50	20	IDGD	
COC(=O)[C@@H](C)Cc1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2F)cc1	763681699	PPFYHJBACVDAHX-ZDUSSCGKSA-N	431.420	1.342	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(-c3noc(C4CC4)n3)c2)cc1	763681907	PGDLORFUUQNOGR-UHFFFAOYSA-N	446.423	1.651	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccccc1-n1nccc1C	763682879	QWKYCMQDTFYTLH-UHFFFAOYSA-N	437.456	1.744	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccc(CN2CCCC2=O)cc1	763871635	ICWWIOAUXXVVTI-AWEZNQCLSA-N	442.447	1.502	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccc(-n2cnc3ccccc32)nc1	763921012	OZCWOGJFPUCNGA-UHFFFAOYSA-N	432.415	1.888	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)C(=O)Nc1ccc(C(F)(F)F)nc1	763945091	VYNIJRBJVLJIBK-UHFFFAOYSA-N	434.334	1.391	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)C(=O)Nc1ccc(CCCc2ccccc2)cc1	763999500	XGQDLYVBTCANFF-SFHVURJKSA-N	443.525	1.383	50	20	IDGD	
COc1ccc(I)c(NC(=O)C(=O)NNC(=O)C2CCCC2)c1	764064217	GBWHWGLOACMZAR-UHFFFAOYSA-N	431.230	1.576	50	20	IDGD	
COCCOC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)nc2)c1	764091400	DNMKJXHWEVAPCU-UHFFFAOYSA-N	435.824	1.330	50	20	IDGD	
CCOc1cc2c(cc1NC(=O)C(=O)NNC(=O)Cc1ccccc1OC)O[C@@H](C)C2	764131814	SBXYFIBRJIUZJP-ZDUSSCGKSA-N	427.457	1.746	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2O1)C(=O)Nc1cccc(NC(=O)c2ccncc2)c1	764168503	PWUFEGFIPBXVKP-LJQANCHMSA-N	445.435	1.424	50	20	IDGD	
O=C(CCc1ccco1)NNC(=O)C(=O)Nc1ccn(-c2ncccc2C(F)(F)F)n1	764169235	OIUMVTMIHPLYQH-UHFFFAOYSA-N	436.350	1.598	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl	764203586	ALBANMKONNCDJT-UHFFFAOYSA-N	443.844	1.639	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1cc(Cl)ccc1Br	764277634	LSAJUVNVNFNUEA-UHFFFAOYSA-N	442.653	1.973	50	20	IDGD	
CCOC(=O)/C=C/c1ccc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1	764345935	MRVQFJJPDMNUKZ-JLHYYAGUSA-N	447.451	1.848	50	20	IDGD	
C[C@@H](NC(=O)OC(C)(C)C)c1ccc(NC(=O)C(=O)NNC(=O)c2cnn(C)c2)cc1	764360450	YCJQAQUDXDZYDA-GFCCVEGCSA-N	430.465	1.406	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1cc(F)c(F)cc1Cl	765734026	UXIMDHXFQAHZSA-UHFFFAOYSA-N	436.846	1.837	50	20	IDGD	
O=C(CCn1cnc2ccccc21)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	766640741	FPZHMZKBJHZMDE-UHFFFAOYSA-N	434.500	1.032	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)C1=NN(Cc2ccccc2)C(=O)CC1	767285610	OKOUAZSTZHSXFL-UHFFFAOYSA-N	436.468	1.407	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1cc(C(C)C)nn1-c1ncccn1	768240451	WZHUCYZDXUNKBN-UHFFFAOYSA-N	437.460	1.123	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)[C@@H](C)OC[C@@H]3CCCCO3)n[nH]2)cc1OC	768275712	DUOHVHWGDHIGPX-HIFRSBDPSA-N	432.477	1.829	50	20	IDGD	
C[C@@]1(NNC(=O)N[C@@H]2CC(=O)N(Cc3ccccc3C(F)(F)F)C2)CCS(=O)(=O)C1	768519193	LUVMHOAOGFAJQJ-CXAGYDPISA-N	448.467	1.187	50	20	IDGD	
COc1ccc(C(=O)NNC(=S)NCCSC)c(I)c1	770238646	BLHNVFJCLHWGNV-UHFFFAOYSA-N	425.317	1.772	50	20	IDGD	
Cc1cc(C(=O)NNc2nc(O)c3cnn(C)c3n2)c2cnn(Cc3cccs3)c2n1	770991505	RZGLSGSDVQXYBL-UHFFFAOYSA-N	435.473	1.989	50	20	IDGD	
COC(=O)c1c(OC)ccc(S(=O)(=O)NNC(=O)CCc2ccccc2O)c1OC	771608151	RNXCIARMMQVZBY-UHFFFAOYSA-N	438.458	1.138	50	20	IDGD	
Cc1oc(C(=O)O[C@H](C)C(=O)NNC(=O)CC(C)C)cc1S(=O)(=O)N1CCCC1	772019910	JATWARHXNRNJEW-CYBMUJFWSA-N	429.495	1.111	50	20	IDGD	
COc1ccc(C(=O)NCC(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)cc1OC	772970480	CXFPEUKSJRZXNW-LBPRGKRZSA-N	435.864	1.702	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)COC1CN(C(=O)OC(C)(C)C)C1	772995877	PBQNWKNDCAUOHE-GFCCVEGCSA-N	427.885	1.891	50	20	IDGD	
CNS(=O)(=O)c1ccc(C(=O)NNC(=O)[C@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1	773417065	PMGUMFQPZRAOAF-AWEZNQCLSA-N	440.522	1.003	50	20	IDGD	
COc1ccc(C(=O)NNc2cnc3ccccc3n2)cc1S(=O)(=O)N1CCOCC1	774779226	KICODVLTNQUSJP-UHFFFAOYSA-N	443.485	1.416	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)N[C@H](c1cccc2ccccc12)C(F)(F)F	776009682	MYSFYAHPDDTOIE-QMTHXVAHSA-N	432.424	1.711	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1C[C@H](N2CCCC2)[C@H](SC)C1	776487122	VYUHDLOMBIJFCS-DOTOQJQBSA-N	426.970	1.621	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1	776615785	ATQBNKMHWANZOJ-MRXNPFEDSA-N	445.545	1.618	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)nc1C	778424016	JYQMOBBAEDLRBB-UHFFFAOYSA-N	444.404	1.701	50	20	IDGD	
CC(=O)N1CCC(=NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c2ccccc2C1	778537842	CCBUUJWMPGYWJM-UHFFFAOYSA-N	428.514	1.823	50	20	IDGD	
COC(=O)[C@@H]1CN(CC(=O)NNC(=O)c2cc(Cl)ccc2OC)c2ccccc2O1	779029268	OUIHNLFZKVFNHQ-KRWDZBQOSA-N	433.848	1.550	50	20	IDGD	
O=C(NNC(=O)[C@H](O)[C@@H](O)c1nc2ccccc2[nH]1)c1ccc(COc2ccccc2)o1	779582364	NGQZTHUAFAUXMH-RTBURBONSA-N	436.424	1.590	50	20	IDGD	
CC(C)N(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)CCNC(=O)OC(C)(C)C)cc1	780973877	JBZVRNONZNCVTR-UHFFFAOYSA-N	442.538	1.391	50	20	IDGD	
COc1ccc(C)cc1NC(=O)C(=O)NNC(=O)c1sc(N2CCOCC2)nc1C	782898349	ZQSZHBXQYOIDHP-UHFFFAOYSA-N	433.490	1.005	50	20	IDGD	
NS(=O)(=O)c1cc(F)cc(NC(=O)C(=O)NNc2ccccc2Br)c1	782983191	ASFWYCNISIBTRC-UHFFFAOYSA-N	431.243	1.317	50	20	IDGD	
O=C(NNc1ccccc1Br)C(=O)Nc1ccc(CN2C(=O)CNC2=O)cc1	782988733	MSFGXBHOUYEKAT-UHFFFAOYSA-N	446.261	1.583	50	20	IDGD	
COC(=O)[C@@H]1CN(C(=O)C(=O)NNc2ccc(Br)cc2)c2ccccc2O1	783006130	OCSVGFWUPZZFRC-HNNXBMFYSA-N	434.246	1.859	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)[C@H]1CCCCS1	783029415	YPIKTRFABHSXMK-QGZVFWFLSA-N	441.575	1.073	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2ccc(C(=O)N3C[C@@H](C)O[C@H](C)C3)cc2)nc(C)n1	783324383	KEOXRESSCCILJM-ZIAGYGMSSA-N	426.477	1.425	50	20	IDGD	
CC(C)N(C)c1ccc(NC(=O)C(=O)NNC(=O)CNC(=O)c2cccs2)cc1F	784003642	KCOSJDIYCYGGKV-UHFFFAOYSA-N	435.481	1.248	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)Nc1ccc(F)cc1C(F)(F)F	785023457	JANMNHNOCMCYSJ-UHFFFAOYSA-N	430.270	1.858	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)C(=O)Nc3cnc4c(c3)COCC4)n[nH]2)c1	785126904	UEIQPLZQMWJUKT-UHFFFAOYSA-N	434.456	1.561	50	20	IDGD	
COC[C@H](NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)c1ccc(Cl)cc1	787375299	WLDLSJLDVDICHY-INIZCTEOSA-N	429.864	1.919	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2cccc3ccn(C)c23)cc1	788311517	WUEQIIYBBZQJRR-UHFFFAOYSA-N	429.502	1.960	50	20	IDGD	
CS(=O)(=O)c1cc(NC(=O)C(=O)NNC(=O)Cc2ccc(F)cc2)ccc1Cl	788332087	WRHDDZAXJMFTLB-UHFFFAOYSA-N	427.841	1.211	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)CCOCC(F)(F)C(F)(F)F	790119871	CLOAFTXICJSBKQ-UHFFFAOYSA-N	446.398	1.653	50	20	IDGD	
COc1ccc(Cn2cc(NC(=O)C(=O)NNc3ccc(C(F)(F)F)nn3)cn2)cc1	793048485	IMSIQPMWTFTBSX-UHFFFAOYSA-N	435.366	1.831	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)c1ccc(Br)cn1	793239943	QRHNNPYXOUOIIZ-SNVBAGLBSA-N	441.307	1.953	50	20	IDGD	
CN1CCN(Cc2cccc(C(=O)NNc3ccc(S(=O)(=O)N(C)C)cc3)c2)CC1	794722678	ZPUDEQHKHRTCMG-UHFFFAOYSA-N	431.562	1.441	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(C)c(I)c2)n1	797370939	WNYLAJKPTFEJFL-UHFFFAOYSA-N	438.225	1.703	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(S(=O)(=O)C(F)(F)F)cc2)cc1	801107949	ALDDYWLXLBMSOM-UHFFFAOYSA-N	429.376	1.688	50	20	IDGD	
CN(CC(=O)NNC(=O)Nc1ccc(Cl)cc1Cl)S(=O)(=O)c1cccnc1	802085972	QYBORLSPXIIBAT-UHFFFAOYSA-N	432.289	1.862	50	20	IDGD	
COc1ccc(Cl)c(NC(=O)NNC(=O)c2cc(OC)c(S(N)(=O)=O)s2)c1	802110912	XKYCLNOJKJGFFS-UHFFFAOYSA-N	434.883	1.533	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)N3CCC[C@H](CN(C)S(C)(=O)=O)C3)cc2C1	804868378	GDGAWMSQQXNSSD-ZIAGYGMSSA-N	442.607	1.831	50	20	IDGD	
O=C(NC[C@H](N1CCOCC1)C(F)(F)F)NNC(=O)c1cccc(OC(F)F)c1	805065932	RXBZLHWEUPEYHE-LBPRGKRZSA-N	426.342	1.495	50	20	IDGD	
CC[C@@H]1CN(C(=O)NNC(=O)c2ccc(OC)c(Br)c2)C[C@@H](C)S1(=O)=O	805103835	FGRZSHRKWVZPNM-ZYHUDNBSSA-N	448.339	1.710	50	20	IDGD	
Nc1nc(C2CCCC2)ncc1C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	806281449	YREOUGXLDLMDSN-UHFFFAOYSA-N	437.548	1.690	50	20	IDGD	
Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)NNC(=O)CCN1C[C@H](C)O[C@H](C)C1	806338814	AFRURPTZJFHLDN-PHIMTYICSA-N	443.298	1.926	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1cc(NC(=O)C(=O)NNc2ncccc2F)ccc1F	807302177	OOVFJOUCQNJRTP-UHFFFAOYSA-N	427.433	1.518	50	20	IDGD	
COc1cccc(NC(=O)CN(C)C(=O)COC(=O)/C(C#N)=C/c2cc(C#N)n(C)c2C)c1	809303680	SFNAHSBKXGQLEI-CAOOACKPSA-N	449.467	1.761	50	20	IDGD	
CCOC(=O)c1cc(S(=O)(=O)NNC(=O)c2ccc[nH]2)cc(Br)c1C	811680846	QKTWBEYHEHSMJN-UHFFFAOYSA-N	430.280	1.886	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)CCCNC(=O)c2ccc(F)cc2F)cc1	812732633	OFHXHJHDRDWFTC-UHFFFAOYSA-N	440.472	1.868	50	20	IDGD	
Cc1nc(N2CCOCC2)ccc1NC(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	812955228	ORDHIJORQRJFDT-UHFFFAOYSA-N	434.522	1.626	50	20	IDGD	
C[C@@H](Cc1cnc2ccccc2n1)C(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	815934284	UNACDPPHUUCUMA-ZDUSSCGKSA-N	425.876	1.926	50	20	IDGD	
COC(=O)c1cc(NNC(=O)CNC(=O)c2cc(OC)c(OC)c(OC)c2)ccc1C	816689567	OGPRVJIVTFRNPH-UHFFFAOYSA-N	431.445	1.681	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)[C@H](CC(C)C)N2C(=O)[C@@H]3CC=CC[C@H]3C2=O)c1	863971750	DITLFVHJZKLAOD-QRVBRYPASA-N	427.501	1.887	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2ccc(C(=O)NNC(=O)c3ccncc3)cc2)cc1	912769594	ZSOVATQWLWIDCB-UHFFFAOYSA-N	426.454	1.966	50	20	IDGD	
C[C@H]1NC(C(=O)NNC(=O)CSc2ccc(Cl)cc2)=NN(c2ccccc2)C1=O	915188377	INBITNZCIYZUQD-GFCCVEGCSA-N	431.905	1.918	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)NCc2ccc(N3CCN(C)CC3)nc2)c1	916245559	JAAVLXXDMLYIJD-UHFFFAOYSA-N	426.521	1.360	50	20	IDGD	
CCN1CCN(Cc2ccccc2CNC(=O)NNC(=O)COc2ccc(F)cc2)CC1	916419682	GHFDBGPSROOHOC-UHFFFAOYSA-N	443.523	1.873	50	20	IDGD	
CC[C@@H](C)NC(=O)c1cccc(CNC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c1	916476729	KYLFXHBECZOODE-CQSZACIVSA-N	436.476	1.335	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCCS(=O)(=O)NC(C)(C)C)ccc1OC(C)C	916622255	CUCCYJPBYUDYTP-UHFFFAOYSA-N	430.527	1.144	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)CCc2c(C)nc3c(C(N)=O)cnn3c2C)cc1	916733742	JGVVLVGTUVQVJG-UHFFFAOYSA-N	440.529	1.626	50	20	IDGD	
NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)cc2)C1	918119310	RYWKWQMPKHAMAH-MRXNPFEDSA-N	440.460	1.441	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)N2CCCN(S(C)(=O)=O)CC2)N(C)c2ccccc21	919702714	MATJTNDVVPBCOZ-UHFFFAOYSA-N	445.545	1.151	50	20	IDGD	
Cc1sc(=O)n(CC(=O)NNC(=O)[C@H](C)Oc2cccc(Br)c2)c1C	919810514	IOHVJZFNLPHPAV-JTQLQIEISA-N	428.308	1.904	50	20	IDGD	
CS(=O)(=O)NCCC(=O)NNC(=O)c1ccc(COc2ccc(Cl)cc2)cc1	920411965	MIVATXMTKDWGGR-UHFFFAOYSA-N	425.894	1.619	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)NC[C@H](c1cccc(F)c1)N1CCOCC1	921200957	IHNKTGMVLFHXMX-GOSISDBHSA-N	440.479	1.799	50	20	IDGD	
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC[C@@H](C(=O)NNC(=O)c2ccccc2Cl)C1	1115988420	ZJCQLKMZKOWEBP-CYBMUJFWSA-N	439.925	1.542	50	20	IDGD	
CC(=NNC(=O)c1ccc(Br)cc1)c1ccc(S(=O)(=O)CC(N)=O)cc1	1117739941	UTTHOUGBTQXDRJ-UHFFFAOYSA-N	438.303	1.862	50	20	IDGD	
NS(=O)(=O)c1ccc(OCCSCC(=O)NNC(=O)c2ccccc2Cl)cc1	1251172779	PWEQXMRMKLPOKF-UHFFFAOYSA-N	443.934	1.561	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C=NNC(=O)CCN1CCN(c2ccccc2)CC1	1317705664	LXMSUAWQMLVSLK-UHFFFAOYSA-N	442.589	1.951	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)[C@]2(C)Cc3ccccc3C(=O)O2)CC1	1318556470	CJNPPEATAFNFPC-QFIPXVFZSA-N	431.489	1.953	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2c3ccccc3nn2C)c1	1320367085	JAQXFDSQTXZQMW-UHFFFAOYSA-N	429.502	1.679	50	20	IDGD	
O=C(NNC(=O)c1n[nH]c2c1CCCC2)c1ccc(N2CCCS2(=O)=O)cc1Cl	1339297984	PXPBKMCIBUQWLZ-UHFFFAOYSA-N	437.909	1.557	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)c3cccc4cnccc34)C2)C1	1778612356	DARBVXINUSQQBK-QHCPKHFHSA-N	439.516	1.051	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccnc(Br)c3)C2)C1	1779401796	ADMUYVRVEARWQS-CXAGYDPISA-N	446.729	1.541	50	20	IDGD	
CC[S@](=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CO[Si](C)(C)C)C1	1779545518	VMARBXJUBAYFKS-TUZCJGOLSA-N	432.659	1.511	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(C1)CN(C(=O)C(C)(C)F)CCO2	1780097262	UMGSZCUDLGNWCB-FQEVSTJZSA-N	437.424	1.712	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C2(N3CCN(C)CC3)CC2)C1	1780652305	UHBLNGBBCHVSCJ-WAOWUJCRSA-N	441.016	1.298	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)NC(=O)OC(C)(C)C)C2	1780707092	HCVLKCISUNITCJ-VOMKJEOTSA-N	447.960	1.361	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)C3CCC4(CC3)OCCO4)CCO2)C1	1781231868	GMFZHKDMBKGGCT-RTBURBONSA-N	449.375	1.986	50	20	IDGD	
O=C(c1cnnc2ccccc12)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781330186	SROYLMQKILNWGC-CRAIPNDOSA-N	437.269	1.764	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnc4c(c3)NC(=O)CS4)C2)C1	1782422434	JUVDMKQXYNMZBM-BFUOFWGJSA-N	438.937	1.587	50	20	IDGD	
CC(C)(C)OC(=O)N(CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21)C1CC1	1783688831	NDJISNGHGYTTKS-QEWYBTABSA-N	447.935	1.900	50	20	IDGD	
O=C(Cc1cc([N+](=O)[O-])ccc1F)N1CCO[C@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783942967	QLMCNIHDQLXZAD-QGZVFWFLSA-N	434.251	1.910	50	20	IDGD	
O=C([C@@H](F)Br)N1CCO[C@@]2(CCN(C(=O)[C@H](O)c3ccccc3Cl)C2)C1	1784253969	VQERYDMRBIQVCE-CKEIUWERSA-N	449.704	1.894	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(F)F)C[C@@H]21	1785075603	ROSZCHKLYMTROP-CYDGBPFRSA-N	439.887	1.363	50	20	IDGD	
CC(C)(C)n1ncc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](O)CCl)C[C@@H]32)c1Cl	1785712117	CMYNMFRIOLQUIF-MHEUCROKSA-N	447.363	1.485	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)c1n[nH]c(C2CC2)c1F	1785766469	XNGACQGSARHUGU-VEABSNGSSA-N	447.280	1.710	50	20	IDGD	
Cc1cc(C(=O)Nc2ccc(C3(NC(=O)c4cccc(B(O)O)c4)CCC3)cc2)n(C)n1	1787372664	DRHNLDNIHWXQDZ-UHFFFAOYSA-N	432.289	1.470	50	20	IDGD	
Cc1cc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)CBr)C[C@@H]32)n[nH]1	1788688736	IHXSOHAYAPTDMA-MZGVZZPPSA-N	427.343	1.271	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(Cl)nn3)[C@H]2C1	1788836762	LJAOATPFZCLVFZ-NDBFUVGKSA-N	435.739	1.960	50	20	IDGD	
C=C[C@@H](O)C(C)(C)C(=O)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1	1789492458	CHQTVABUCBMYPX-HXUWFJFHSA-N	436.317	1.687	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc(Cl)nc3)C[C@@H]21	1789868181	RQYAKGDYDYQLRM-HTWFXAOOSA-N	435.739	1.960	50	20	IDGD	
CC(C)N[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]2C1)C(C)C	1789922670	NVTIKSXXUYATPV-RFBLXINOSA-N	436.366	1.679	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3ccc(C)nc3C)C[C@@H]21	1791256280	KZSJZOPTCLCXAW-HAGHYFMRSA-N	437.968	1.865	50	20	IDGD	
COC(=O)C12CC(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)[C@@H](C)CBr)(C1)C2	1792993949	VBBDSZAYEMWNLH-DUGJLFPFSA-N	427.339	1.999	50	20	IDGD	
CC(C)(C)OC(=O)CCCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2	1793022719	UYDHHZBBQVGYSP-ZSBFGKGUSA-N	447.370	1.873	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCC1CCCC1	1795036149	MCXSIDPBXBNEMV-CUCQEMJRSA-N	443.548	1.680	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(Cl)nc2n[nH]cc12	1796054529	YIXALVFKTUHZKA-FJHTZYQYSA-N	426.304	1.832	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1csc(Br)n1)C2)[C@H](F)Cl	1796364328	CMLURPSPPRNCMF-MBLNEYKQSA-N	426.695	1.643	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@]1(F)CCCCC1(F)F	1797212894	MCJZRMJDJCOBBI-WLZFUECHSA-N	426.863	1.747	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2n(n1)CCCO2	1797436800	FVAXZRPAPADZNQ-ABXQLRGKSA-N	431.320	1.105	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C=N/N1CCCCC1	1797744085	LHZSCYMVZKRHSR-IIZDTNSWSA-N	429.359	1.221	50	20	IDGD	
COc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CO[Si](C)(C)C)cc1N(C)C	1797956237	LZUHFFLWLXWENX-UPHUGPLXSA-N	449.624	1.816	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(-c2ccncc2)[nH]n1	1798826768	XWKLAQIUJZFXFB-BJWYYQGGSA-N	439.520	1.097	50	20	IDGD	
COc1ccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Br)cc1C	1799344935	YJCPFTMJASQXKJ-DACLVMHWSA-N	443.313	1.826	50	20	IDGD	
COc1ccc(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CCC(=O)NN(C)C)C3)c(C#N)c1	1800035414	OOIVOCMOHIVFLL-REPLKXPHSA-N	441.532	1.121	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccnn1)C2	1800333322	GEUTXXWLXLWTFX-AOWDBCOTSA-N	439.422	1.565	50	20	IDGD	
CC(C)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1C[C@@]12C(=O)Nc1ccccc12	1800760971	GGFWJQALQXSAGH-IVTYCSMISA-N	445.947	1.751	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(C)nn1-c1ccccc1)C2	1800975965	ZWSSBHATPCFNQX-WQDJSCAQSA-N	446.935	1.638	50	20	IDGD	
CC(C)[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCC(=O)NN(C)C)c1ccccc1	1801010611	LNNBFPHGXVVUHO-YDLSIGKMSA-N	444.576	1.389	50	20	IDGD	
COc1ccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C(Cl)Cl)c([N+](=O)[O-])c1	1801017251	FLKIMDYASJVASY-DRXBFXEBSA-N	446.287	1.539	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)Cn1ccnc1	1801375581	GQTWIHNTXWQPJA-RBZJEDDUSA-N	427.343	1.282	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc(O)c([N+](=O)[O-])c2)[C@@H]1c1cccnc1)[C@H](O)CCl	1803141182	MKYVAYHQBCAUSB-BMGDILEWSA-N	448.863	1.615	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](F)Cl)C3)CC1	1804088094	AGRULWVAVIOJJC-IVSAIRAKSA-N	446.951	1.712	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@H]2c2cccnc2)n1	1804826303	VKPVIDDPWFMUAJ-WDYCEAGBSA-N	445.907	1.354	50	20	IDGD	
C=CCNC(=O)/C=C\C(=O)N1CCCC2(CCN(C(=O)[C@H](C)Br)CC2)C1	1804857949	SJNPGNFPJKFSGE-YVACAVLKSA-N	426.355	1.859	50	20	IDGD	
CC(=O)C(C)(C)C(=O)N1CCCC2(CCN(C(=O)c3cnccc3C(=O)NN)CC2)C1	1805831761	FELZHZUIJSZZDX-UHFFFAOYSA-N	429.521	1.145	50	20	IDGD	
O=C(CCBr)NC[C@@H]1CCN(C(=O)CCn2cncn2)[C@H]1c1cccnc1	1806346271	DXMYQQHLYAVULL-YJBOKZPZSA-N	435.326	1.554	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)CC(F)(F)C(=O)O)[C@H]1c1cccnc1	1808294367	KFSZFHYXRWPKFS-VNHYZAJKSA-N	433.839	1.451	50	20	IDGD	
CN[C@@H](CC(=O)N1CCCC2(CCN(C(=O)[C@@H](C)CBr)CC2)C1)C(=O)O	1809829310	MJQXPWGWZRMLGW-KBPBESRZSA-N	432.359	1.311	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)C(Cl)Cl)[C@@H]1c1cccnc1	1810242038	ZSNPNNLTMMSJLB-KWCYVHTRSA-N	430.336	1.599	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)CNC(=O)c2cc(C)on2)[C@@H]1c1cccnc1	1810379378	JOWBRTZOJUEEOT-GJYPPUQNSA-N	447.923	1.831	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1CCN(C(=O)CCN2CCOC2=O)[C@@H]1c1cccnc1	1810546036	LIJRYBDBAXCUOM-FXAWDEMLSA-N	448.596	1.781	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2ccc(C#N)cc2)[C@@H]1c1cccnc1	1811893500	IFAJBUKGMIIQKN-REWPJTCUSA-N	448.527	1.646	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1ccc(O)cc1	1811933385	ZBSMVICZBCJANC-SIKLNZKXSA-N	445.284	1.100	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)COc2ccc(O)nn2)[C@@H]1c1cccnc1	1812353323	VFBBEUNWGRQLTH-VCBZYWHSSA-N	433.896	1.679	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2cccc(=O)n2C)[C@@H]1c1cccnc1	1813029141	CIICUAFBMVFGSO-JTDSTZFVSA-N	432.908	1.354	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)[C@H](C)N2C[C@@H]3C[C@H]3C2)[C@H]1c1cccnc1	1813030989	IITYWEZOYIGCNG-ZXIXUEFNSA-N	434.968	1.681	50	20	IDGD	
C[C@H](Cc1ccccn1)C(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1	1813287807	XFWSYKOJRWKVQE-VUBSUSDNSA-N	430.936	1.961	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)c1	1813894891	KFFUVQVVHVSSCU-IHPCNDPISA-N	444.919	1.959	50	20	IDGD	
Cc1cccc(CC(=O)Nc2nc3c(s2)C[C@H](NC(=O)CCC(=O)NN(C)C)CC3)c1	1813914155	PQXMBILNBVXZSS-MRXNPFEDSA-N	443.573	1.979	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](O)c2ccco2)n[nH]1	1814463688	IYGPHSCDIGGRMM-LIRRHRJNSA-N	432.481	1.101	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@H]2COc3ccccc3O2)[nH]n1)[C@@H](O)CCl	1814867139	GOQFOECDBOVKCL-GRDNDAEWSA-N	434.880	1.842	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](C)Br)CC2	1817023492	DZFBNTYILSLQIE-HLTSFMKQSA-N	432.344	1.285	50	20	IDGD	
Cc1ccc(=O)n(C(C)(C)C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@H](F)Cl)CC3)n1	1820090135	XXMHZTDTUOKLMW-HZMBPMFUSA-N	441.916	1.890	50	20	IDGD	
COC[C@H](NC(C)=O)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@](C)(Cl)CCl)n[nH]1	1820866743	SAIXINFPZPVVHP-SUNYJGFJSA-N	448.351	1.789	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCc2nc(N)n[nH]2)[nH]n1	1820866937	QBXRPBJPQOFTMI-GTNSWQLSSA-N	443.339	1.971	50	20	IDGD	
C[C@H](Br)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H]2CCCS2(=O)=O)[nH]n1	1822188443	JOZKJODDYHCERF-CYZMBNFOSA-N	447.355	1.762	50	20	IDGD	
CC(C)N[C@@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1)C(C)C	1822413940	IYMIHPXWLMBWLJ-DYESRHJHSA-N	449.600	1.797	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])o2)CC1	1823618584	ZAPQSUDQJRRZPU-INIZCTEOSA-N	449.508	1.794	50	20	IDGD	
CCS(=O)(=O)CC(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](C)Br)sc2C1	1825635398	FBZFYSKMJNMACC-RKDXNWHRSA-N	438.369	1.273	50	20	IDGD	
O=C(c1cncc(F)c1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827051362	VGXUFLWOTGZUJQ-NRFANRHFSA-N	439.296	1.448	50	20	IDGD	
Cc1cc(C(=O)NCC(=O)N2CCCC[C@@H]2C2CCN(C(=O)[C@@H](F)Cl)CC2)no1	1828986324	LQFLCHHLTBBFIN-NVXWUHKLSA-N	428.892	1.867	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(Cl)cnc3O)CCO2)C1	1829557878	SXJLXNBZMQDJKG-BEFAXECRSA-N	446.331	1.918	50	20	IDGD	
N#Cc1cccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)c1	1829952101	DEPOBCHTIYNXET-HSZRJFAPSA-N	445.328	1.785	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2CNC(=O)C2)CC1	1831408591	BYXRXNDELWCYTE-KBMXLJTQSA-N	428.371	1.773	50	20	IDGD	
Cc1cccnc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)Br)C2)C1	1831840362	AREROODRMHCBKV-KDOFPFPSSA-N	426.311	1.243	50	20	IDGD	
Cc1ccsc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)Br)C2)C1	1833948564	QSOCNDUYPQWUGT-CXAGYDPISA-N	431.352	1.910	50	20	IDGD	
Cc1cc(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](F)Br)CC3)CC2)no1	1834251153	JAJROCOSOVOFKZ-OAHLLOKOSA-N	431.306	1.859	50	20	IDGD	
O=C(C(=O)N1CCO[C@@]2(COCCN(C(=O)CCBr)C2)C1)c1ccccc1	1834702108	UJKUBIRCUSSDNG-LJQANCHMSA-N	439.306	1.111	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)C#Cc3ccccc3)CCO2)C1	1835102139	MMHALQXYKORMON-JXFKEZNVSA-N	435.318	1.278	50	20	IDGD	
O=C([C@@H](F)Br)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836717879	LMIBJLJTYNJKDL-CHWSQXEVSA-N	429.714	1.275	50	20	IDGD	
Cc1ccoc1C(=O)N1CCC(OC2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1	1838115310	CVCYRFLSSNHXAK-UHFFFAOYSA-N	434.537	1.573	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)C3CC(C)(C)C3)CC2)CC1	1838789524	RTFMOJDGZFZKFD-UHFFFAOYSA-N	436.597	1.794	50	20	IDGD	
Cc1ccc(O)c(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)c1	1838894450	TYGQIGPFZFFZLX-LIRRHRJNSA-N	441.322	1.554	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccnc(F)c3)C2)C1	1839150194	FIKRSLODVWPIPE-ROUUACIJSA-N	434.295	1.527	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccccc3O)C2)C1	1839151534	VQHYLBRJXFURQZ-RBUKOAKNSA-N	431.316	1.699	50	20	IDGD	
C[C@H](Sc1ccccn1)C(=O)N1CCOC[C@@]2(CN(C(=O)C(Cl)Cl)CCO2)C1	1840190734	KHYFUOOWTUSWTM-UGSOOPFHSA-N	448.372	1.822	50	20	IDGD	
O=C([C@H](F)Br)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1C[C@@]1(F)Cl)CCO2	1840247415	YRZYXOMUWCWOQF-QOBDMFJFSA-N	431.661	1.058	50	20	IDGD	
Cc1ccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)o1	1840508673	DLCUVUMYRNIYGY-WBVHZDCISA-N	433.274	1.277	50	20	IDGD	
O=C(c1ccc2c(c1)CCCO2)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1840660873	FYMHGNBTRDDKOG-HXUWFJFHSA-N	443.327	1.885	50	20	IDGD	
O=C([C@@H]1[C@H]2Sc3ccccc3[C@H]21)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843011633	XSGRJQDTJOAVHO-UFYCRDLUSA-N	434.326	1.071	50	20	IDGD	
O=C(c1cc(Cl)sc1Cl)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843011770	QPWIHTSLFOUPGC-UHFFFAOYSA-N	439.129	1.866	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](O)[C@@](C)(C(=O)N2CC3(CCCN3C(=O)[C@H](F)Cl)C2)C1	1843361705	IMAVYWZANMRNEF-NJSLBKSFSA-N	447.935	1.732	50	20	IDGD	
C=CC(=O)N[C@@H](C)C(=O)N1CCCC12CN(C(=O)[C@H](Br)Cc1ccccc1)C2	1844372627	UDEHPRAHPNTGGS-DOTOQJQBSA-N	448.361	1.887	50	20	IDGD	
CCOC(=O)N[C@H](O)C(=O)N1CC2(CCCN2C(=O)/C(C#N)=C/c2ccc(F)cc2F)C1	1845871247	FQZRNVVQTFOHMP-LEHPZIBWSA-N	448.426	1.140	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)c1ccc(CCN3CCCC3)nc1)C2	1846362186	PPOHQPXKYBOAQO-IBGZPJMESA-N	434.968	1.791	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2ccc3c(c2)CCCO3)C1	1846780204	MGPBJMHCHSORLZ-WGOQTCKBSA-N	449.511	1.963	50	20	IDGD	
COc1ccc(C(=O)N2CCCC23CN(C(=O)c2ccc(B(O)O)cc2)C3)c(Cl)c1	1846848659	SGKSJRVZWWSGDV-UHFFFAOYSA-N	428.681	1.159	50	20	IDGD	
CN(CC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)C(C)(C)C#N)NC(=O)NCc1ccccc1	1847348088	MBDSZQNCWGRLID-ROUUACIJSA-N	426.521	1.084	50	20	IDGD	
O=C(NNC(=O)N1CCN(CCc2ccccc2)CC1)c1csc(N2CCOCC2)n1	28799720	HQRLMTVNZAWXNO-UHFFFAOYSA-N	444.561	1.194	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)CN2C(=O)[C@H](C)Oc3ccccc32)c2ccccc2c1=O	115401825	LENLZOSDQVRPJY-AWEZNQCLSA-N	449.467	1.553	50	20	IDGD	
COc1ccc(N2C[C@H](C(=O)NNC(=O)Cn3ccc4ccccc43)CC2=O)c(OC)c1	729449957	LXGFTQGVBAYBCK-MRXNPFEDSA-N	436.468	1.859	50	20	IDGD	
CC[C@@H](NC(=O)NNC(=O)COc1ccc(C)c(C)c1)c1cccc(S(N)(=O)=O)c1	729613064	MYSHWNCZUBRSTC-GOSISDBHSA-N	434.518	1.811	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)CSc1nnnn1CC(F)(F)F	729965946	JTHAKAJZNJIJPL-UHFFFAOYSA-N	442.427	1.087	50	20	IDGD	
Cc1ccc(-n2nc(C(=O)NNC(=O)N[C@@H]3CCS(=O)(=O)C3)c3c2CCC3)c(C)c1	730213150	IHMRDBFDQUSNDJ-CQSZACIVSA-N	431.518	1.109	50	20	IDGD	
O=C(NNS(=O)(=O)c1csc(-c2cccc(Br)c2)n1)N1CCOCC1	730767370	QGJWXNIZPBHGNG-UHFFFAOYSA-N	447.336	1.808	50	20	IDGD	
COc1cc2c(cc1OC)CN(C(=O)CCCNC(=O)NNC(=O)c1ccc[nH]1)CC2	731119486	SWCDJJFFZFMVON-UHFFFAOYSA-N	429.477	1.341	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)CN1C(=O)N[C@@](C)(c2ccc(OC)cc2)C1=O)c1ccccc1	731995903	CRZMJHFGBVSBLW-JPYJTQIMSA-N	438.484	1.803	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CCc2c(C)nc3ncnn3c2C)cc1Br	732033250	PCZHVOAUUIBHPW-UHFFFAOYSA-N	447.293	1.906	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)NCc1ccc(N(C)S(C)(=O)=O)cc1	732236095	OSXUIHUFRHTMCQ-UHFFFAOYSA-N	430.490	1.183	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CCNC(=O)N2CCc3ccccc3C2)cc1OC	732265008	MKZDZOHCVGTILS-UHFFFAOYSA-N	426.473	1.623	50	20	IDGD	
O=C(NCCSCCOc1cccc(Br)c1)NNC(=O)C(=O)NC1CC1	732472569	DXLGHHXNKAATJM-UHFFFAOYSA-N	445.339	1.170	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)c2ccc(S(C)(=O)=O)o2)c2ccccc2c1=O	733126239	OHAHFIJMJYGZCX-UHFFFAOYSA-N	446.485	1.658	50	20	IDGD	
NC(=O)c1cc(C(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)nn1-c1ccccc1	733540816	ITRZVVWOGKEOKC-UHFFFAOYSA-N	441.831	1.243	50	20	IDGD	
O=C(NNC(=O)N1CCN(c2cccc(F)c2F)CC1)C1CCN(c2ncccn2)CC1	734527571	ZSUREOOOYTUDGX-UHFFFAOYSA-N	445.474	1.534	50	20	IDGD	
CC(=O)NCC(=O)N1CCc2cc(C(=O)NNC(=O)c3ccc(Cl)cc3O)ccc21	735686993	DFLUFIYVZPYNGR-UHFFFAOYSA-N	430.848	1.146	50	20	IDGD	
CCOC(=O)N1CCC(C(=O)OCC(=O)NNC(=O)c2cc(C)c(CC)s2)CC1	736735150	JVZXPRQMRPUVAP-UHFFFAOYSA-N	425.507	1.792	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)N[C@@H](C)C(=O)N2CCCC[C@@H]2C)nc1	737048061	RSDNMGKSKTWWMA-KBPBESRZSA-N	426.543	1.184	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)COCc1ccccc1)c1cccc(S(=O)(=O)N(C)C)c1	739006250	RNBDJKMRSRULIC-HNNXBMFYSA-N	434.518	1.545	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NCCNc2nccc(C(F)(F)F)n2)cc1	739046382	SGBSATUGZQGNJL-UHFFFAOYSA-N	428.371	1.325	50	20	IDGD	
CS(=O)(=O)[C@H]1CCC[C@@H](NC(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)C1	741093547	SZFYPNSMUACULD-YPMHNXCESA-N	443.469	1.962	50	20	IDGD	
CC(=NNC(=O)[C@@H](C)CN1C[C@H](C)O[C@H](C)C1)c1cccc(N2CCCS2(=O)=O)c1	741162639	AYEWETSXVQIARR-YESZJQIVSA-N	436.578	1.812	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)OCC(=O)NNC(=O)c2cccc(C)c2)c1C	744457593	RBVZRJUXZDSTPU-NDENLUEZSA-N	438.484	1.971	50	20	IDGD	
CC(C)[C@H](C(=O)OCC(=O)NNC(=O)c1cccc(C#N)c1)S(=O)(=O)C1CCCCC1	744953422	KZVXPHXVGJUMLD-LJQANCHMSA-N	449.529	1.635	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)Cc1cc2c(cc1Br)OCCO2	746549968	KTCDLIXCNZBSTK-UHFFFAOYSA-N	445.273	1.801	50	20	IDGD	
COc1cc(C)nc(NNC(=O)[C@@H]2CCCN2C(=O)Nc2ccc3c(c2)OCCO3)n1	746623787	QDXTYYJHHFUDSQ-AWEZNQCLSA-N	428.449	1.704	50	20	IDGD	
COc1cc(C)nc(NNC(=O)C2CCN(S(=O)(=O)c3cccc(C(C)=O)c3)CC2)n1	746634643	KUENUJPBJLIISP-UHFFFAOYSA-N	447.517	1.540	50	20	IDGD	
COc1c(F)cc(CC(=O)NNC(=O)c2cccc3cccnc23)cc1S(N)(=O)=O	747422562	MWGQRDJKBSNIIZ-UHFFFAOYSA-N	432.433	1.034	50	20	IDGD	
Cn1c(=O)nc(O)c2c(C(=O)NNC(=O)c3ccc(Cl)cc3F)cc(C3CC3)nc21	747430680	AKBHCFVLBFHHFK-UHFFFAOYSA-N	431.811	1.779	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(=O)n(CC(=O)NNc2cccc([N+](=O)[O-])c2C)c1	748665629	HJSYYKBUACRNPL-UHFFFAOYSA-N	437.478	1.239	50	20	IDGD	
NS(=O)(=O)Cc1ccc(C(=O)NNC(=O)COc2ccc(Br)cc2)cc1	748830863	NKEVJXJKJKFWTP-UHFFFAOYSA-N	442.291	1.078	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)NCc1ccccc1CS(C)(=O)=O	749586925	AQOJRQKIRIEUPL-UHFFFAOYSA-N	435.502	1.539	50	20	IDGD	
CCO[C@H]1C[C@@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)C1(CC)CC	749617590	QBTQOXBXNMEWDD-SJORKVTESA-N	440.566	1.865	50	20	IDGD	
CC[S@](=O)[C@@H]1CCC[C@H](NC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)C1	750297294	QSYBKCCJTCKHFI-SSWHHONOSA-N	430.552	1.506	50	20	IDGD	
O=C(NNC(=O)N1CC[C@@H](OCCCc2ccccc2)C1)c1ccc(-n2cnnn2)cc1	752000122	QWMUIFHWHAWVHR-HXUWFJFHSA-N	435.488	1.740	50	20	IDGD	
CCc1cc(Br)ccc1NNC(=O)c1cc2c(=O)n(C)c(=O)n(C)c2n1C	753175183	AEHMHKCWBOAJTF-UHFFFAOYSA-N	434.294	1.658	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)CCOC2CCOCC2)c2ccccc2c1=O	753277037	ULANETYJRAMNJP-UHFFFAOYSA-N	430.505	1.933	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N(C)C[C@@H]2CCN(C(C)=O)C2)cc1Br	754855611	MKKLWPWFYYSHRK-LBPRGKRZSA-N	427.299	1.612	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)Nc1ccc(NC(=O)[C@H]2CCCO2)cc1	755640630	KHKUVVYWZXJTMY-MSOLQXFVSA-N	426.429	1.797	50	20	IDGD	
COc1cc(C=NNC(=O)CNC(=O)c2cccs2)c([N+](=O)[O-])cc1OCC(=O)O	755679648	SNTUHPZDBRXHJN-UHFFFAOYSA-N	436.402	1.008	50	20	IDGD	
C[C@]1(CNC(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)CCCO1	756077605	GOJMBQHIXXHZMF-JOCHJYFZSA-N	435.488	1.902	50	20	IDGD	
C[C@@H]1CCCN(CC(=O)NNC(=O)c2cccc(C#N)c2)[C@@H]1CNC(=O)OC(C)(C)C	756548636	CAKVVUZOKQDLJF-CRAIPNDOSA-N	429.521	1.944	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)[C@@](C)(O)CN2Cc3ccccc3C2=O)cc1OC	756796130	FBFXVQSCYNQMIL-QHCPKHFHSA-N	441.484	1.652	50	20	IDGD	
CCn1c(SCC(=O)NNC(=O)c2ccc(C#N)cc2)nc2ccc(F)cc2c1=O	756928790	VXIQMYBVLJBEME-UHFFFAOYSA-N	425.445	1.980	50	20	IDGD	
Cc1cc(C)c(S(=O)(=O)N2CCC(C(=O)NNc3ccc(C(N)=O)nn3)CC2)c(C)c1	757393171	UAZSTWOHEARGEO-UHFFFAOYSA-N	446.533	1.045	50	20	IDGD	
CO[C@@H]1Cc2ccc(NC(=O)NNC(=O)CN(C)S(=O)(=O)c3ccc(C)cc3)cc2C1	758054765	ILHMBDLICNNNAC-GOSISDBHSA-N	446.529	1.582	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1ccc2c(c1)CCC(=O)N2C	758078814	BDKDJGHARYEJAB-UHFFFAOYSA-N	429.502	1.272	50	20	IDGD	
COc1cc(N2CCN(C(=O)NNC(=O)Cc3cccnc3)CC2)cc(OC)c1OC	759252989	FGJJWIPKSWGGCX-UHFFFAOYSA-N	429.477	1.213	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)N=c2cc[nH]cc2I)c1	760033706	JGNKYTKQAPDIHS-UHFFFAOYSA-N	426.214	1.648	50	20	IDGD	
O=C(COC(=O)C1=Cc2cc(F)ccc2OC1)NNC(=O)[C@@H]1COc2ccccc2O1	761640886	IPKJRWAFVXZDNP-SFHVURJKSA-N	428.372	1.132	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)NCCc2ccnn2C)cc1	762709411	GYHIGJJPYWIIQL-GHRIWEEISA-N	447.499	1.433	50	20	IDGD	
Cc1nnnn1[C@@H](Cc1cccc(F)c1)C(=O)NNC(=O)c1cc(-c2cccs2)[nH]n1	763159359	WYUJBKLQYSCBCS-INIZCTEOSA-N	440.464	1.817	50	20	IDGD	
O=C(NNS(=O)(=O)c1c(Br)cc2nc(O)oc2c1Cl)c1ccccn1	763418501	WVXIRFAKZOLTJX-UHFFFAOYSA-N	447.654	1.968	50	20	IDGD	
CC(C)(C)c1nsc(NC(=O)C(=O)NNC(=O)c2ccccc2Br)n1	763482025	CPMHDLZRDRUUIA-UHFFFAOYSA-N	426.296	1.998	50	20	IDGD	
COCCOc1cc(C)ccc1NC(=O)C(=O)NNC(=O)c1ccc(OC)c(OC)c1	763550578	FYVZANVFVVSBFB-UHFFFAOYSA-N	431.445	1.437	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(N3CCC(N(C)C)CC3)c(F)c2)c(C)o1	763585666	COKOMMAEGZCMCN-UHFFFAOYSA-N	445.495	1.966	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)[nH]n1)C(=O)Nc1cccc(N2CCOC2=O)c1	763605484	UHERUYFXBSXVKR-UHFFFAOYSA-N	434.412	1.433	50	20	IDGD	
COc1ccc(Cn2nccc2NC(=O)C(=O)NNC(=O)c2c(C)nc3ccccn23)cc1	763630238	WMSIKYVTOWFMRM-UHFFFAOYSA-N	447.455	1.296	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cc(C)ccc2-n2cc(C)cn2)cc1	763660577	BWKTURUVVXLTJR-UHFFFAOYSA-N	437.456	1.663	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(NC(C)=O)ccc1Cl	763681432	GBSFBEATGVVQIF-UHFFFAOYSA-N	448.863	1.862	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)ccc1C(=O)NC(C)C	763682240	TWFIXIRSHXNGPE-UHFFFAOYSA-N	437.456	1.170	50	20	IDGD	
O=C(NNC(=O)C12CC3CC(CC(C3)C1)C2)C(=O)Nc1cccc(N2CCNC2=O)c1	763728648	YZTVIFDETHZRAI-UHFFFAOYSA-N	425.489	1.519	50	20	IDGD	
O=C(NNC(=O)c1cccc(Cl)c1)C(=O)Nc1cc2c(cc1[N+](=O)[O-])OCCCO2	763747643	CWTQYDURNYVERL-UHFFFAOYSA-N	434.792	1.809	50	20	IDGD	
COCC[S@@](=O)Cc1cccc(NC(=O)C(=O)NNC(=O)c2cccc(N(C)C)c2)c1	763757368	HMLMBUJPYUSIHP-WJOKGBTCSA-N	446.529	1.047	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)C(=O)Nc1cc(-c2ccccc2)ns1	763809387	VVZGCBFPVDORPR-UHFFFAOYSA-N	441.425	1.883	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cccc(C(=O)N(C)C)c2)c1C	763847527	CKRQVKJWNASWJD-HNNXBMFYSA-N	426.473	1.559	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(N3CCCC3=O)cc2)c1C	763850659	OUXZYWTWYYUVOJ-MRXNPFEDSA-N	438.484	1.984	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)ccc1NC(C)=O	763851031	SYOQWRFUVBPSNK-LLVKDONJSA-N	432.408	1.346	50	20	IDGD	
COC(=O)CCc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)cc1	763871024	CIOSAXLLFWEORK-CYBMUJFWSA-N	431.420	1.485	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cc(C#N)ccc2Cl)cc1	763871050	CZQWGJMFXDQWBF-LBPRGKRZSA-N	428.832	1.968	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2c[nH]nc2-c2ccccn2)cc1	763876524	GKCZQZPUZPAAKQ-ZDUSSCGKSA-N	436.428	1.228	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@@H](C)C(=O)NNC(=O)C(=O)Nc1cc(C)c(=O)n(C)c1	763884801	YBGMHZPFIQLGNX-ZDUSSCGKSA-N	434.880	1.517	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2cccc(C[S@](=O)C(C)(C)C)c2)n1	763892917	NETOVSRGIPESNU-PMERELPUSA-N	433.534	1.333	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CC[C@H](C)C3)cn1C	763941971	LGAXVRISYYYKSX-NSHDSACASA-N	432.502	1.788	50	20	IDGD	
O=C(NNC(=O)c1ccc[nH]1)C(=O)Nc1ccc(Br)cc1Br	763979802	LYJDVHINSDLRLH-UHFFFAOYSA-N	430.056	1.939	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1F	764006078	KOWBLQGRXQCVRO-UHFFFAOYSA-N	433.392	1.022	50	20	IDGD	
CS(=O)(=O)N1CCCc2cc(C(=O)NNC(=O)CSc3ccccc3O)ccc21	764048438	YSBNIDHLPTULFS-UHFFFAOYSA-N	435.527	1.658	50	20	IDGD	
CN(C)C(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(Br)c2)cc1	764063214	LEUCNCXMKUZEGP-UHFFFAOYSA-N	447.289	1.480	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccccc3Cn3cncn3)n[nH]2)cc1	764111805	TZAUXZGGNFSXDZ-UHFFFAOYSA-N	444.455	1.425	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)cc1C(=O)NC(C)C	764124582	KXNQXCUOHNLIHR-UHFFFAOYSA-N	432.864	1.892	50	20	IDGD	
O=C1CCc2ccc(NC(=O)C(=O)NNC(=O)c3cc(F)ccc3Br)cc2N1	764270705	QZBBNXJIURGEKT-UHFFFAOYSA-N	449.236	1.873	50	20	IDGD	
Cc1cc(Br)cc(C)c1NC(=O)C(=O)NNC(=O)COc1ccccc1O	764275617	PEDDXIOZDCZPII-UHFFFAOYSA-N	436.262	1.936	50	20	IDGD	
COc1cc(OC)c(OC)cc1NC(=O)C(=O)NNC(=O)c1cnn(-c2ccccc2)c1	764350248	BYDHKMDUMYCEOB-UHFFFAOYSA-N	439.428	1.298	50	20	IDGD	
O=C(Cc1csc2nccn12)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	764462114	DSIKJQRNDVKZRE-UHFFFAOYSA-N	447.542	1.574	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)CCC(=O)N1CCc2sccc2C1	765311612	YWYNMKRVKNCBPX-UHFFFAOYSA-N	438.550	1.865	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)c1cc(I)cc(C)c1C	765472746	POHOTOBPYYQUQT-UHFFFAOYSA-N	431.274	1.974	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3nnc(O)c4ccccc34)CC2)cc1	765749337	XAUCIAIXKRRRCU-UHFFFAOYSA-N	434.500	1.223	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN(C(=O)OCc2ccccc2)C1)C(=O)Nc1ccccn1	766654435	MJCVEDXJUYNBOA-INIZCTEOSA-N	425.445	1.216	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cnn(CC(C)C)c2C2CC2)cc1	768286072	UPSBIXQWDLMAAJ-UHFFFAOYSA-N	447.561	1.807	50	20	IDGD	
CC(C)c1cccc2c1OCCCC2=NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C	768483299	JZJFUPFRNUOJDN-UHFFFAOYSA-N	438.488	1.250	50	20	IDGD	
COc1ccc([C@]2(C)NC(=O)N(CC(=O)NNc3cc(C#N)cc(Cl)n3)C2=O)cc1	768711930	ZPPDVZUPJLTVOV-IBGZPJMESA-N	428.836	1.526	50	20	IDGD	
COc1cc(C(=O)N(C)C)ccc1NC(=O)NNc1c(OC)cccc1S(C)(=O)=O	769243863	UVKPBXOALJWBTG-UHFFFAOYSA-N	436.490	1.958	50	20	IDGD	
C[C@@H]1CCC2=S=C(C(=O)NNC(=O)C(=O)Nc3ccnn3-c3cccc(F)c3)C=C2C1	770771941	QEXDRLAXARKXBG-GFCCVEGCSA-N	441.488	1.935	50	20	IDGD	
Cc1ccc(S(=O)(=O)n2ccc(C(=O)NNc3nc(O)c4cnn(C)c4n3)c2)cc1	770980299	OTFREZLLBGEBOY-UHFFFAOYSA-N	427.446	1.173	50	20	IDGD	
Cc1cc(S(=O)(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)ccc1[N+](=O)[O-]	771607273	LGBAXYHOLHUKIR-UHFFFAOYSA-N	426.838	1.183	50	20	IDGD	
COc1cc(Cl)ccc1S(=O)(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	771607663	PQWHKQFKHPJWFM-UHFFFAOYSA-N	432.285	1.628	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)CCC(=O)Nc1ccc2nc(O)[nH]c2n1	772995928	PGVUQWGCVSIVNU-JTQLQIEISA-N	446.851	1.651	50	20	IDGD	
CCOC(=O)N1CCC([C@@H](C)NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)CC1	777684098	QGBGTAOMLKIFAK-CYBMUJFWSA-N	440.522	1.291	50	20	IDGD	
COCCc1nnc(-c2cccc(C(=O)OCC(=O)NNC(=O)c3ccc(C#N)cc3)c2)o1	778924214	BKSXMOYBMWOVOY-UHFFFAOYSA-N	449.423	1.415	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)c1cc(F)cc2c(=O)c3cc(F)ccc3[nH]c12	780232848	CDMURVFOBBGCIJ-VIFPVBQESA-N	435.408	1.155	50	20	IDGD	
CN1C(=C(C#N)C(=O)COC(=O)c2cn(C)nc2-c2cnn(C)c2)N(C)c2ccccc21	781303410	GSOHSBWQTSJZCI-UHFFFAOYSA-N	431.456	1.868	50	20	IDGD	
CSC1(C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)CCC1	781858306	VOYYGBWGZUVREP-UHFFFAOYSA-N	441.575	1.073	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)NCC(C)(C)C#N)c1	781953451	IGEWFYPWTVESJD-UHFFFAOYSA-N	445.501	1.990	50	20	IDGD	
CC(=O)N1CCN(Cc2cccc(NC(=O)C(=O)NNC(=O)c3ccccc3C)c2)CC1	782121431	YICSHLSYJQXACM-UHFFFAOYSA-N	437.500	1.059	50	20	IDGD	
COc1ccc(NC(=O)c2cccc(NC(=O)C(=O)NNC(=O)c3ccc(O)cc3)c2)cn1	782831804	HCHRZLLBTOAPQO-UHFFFAOYSA-N	449.423	1.448	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C(=O)Nc2cccc(N3CCCCC3)c2)nc2ccccc21	782893308	GHIBDBHCMLKKCK-UHFFFAOYSA-N	434.500	1.892	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2cccc(OCc3cccc(F)c3)c2)CCS(=O)(=O)C1	783426589	NWSQDFMINFLRNP-FQEVSTJZSA-N	435.477	1.541	50	20	IDGD	
Cc1cc(N2CCCC[C@@H]2C)ccc1NC(=O)C(=O)NNC(=O)CNC(=O)c1ccco1	784003031	ZWBOOISSPSJFQK-HNNXBMFYSA-N	441.488	1.483	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNc2ccc(C#N)c(C(F)(F)F)c2)cccc1-n1cnnn1	784233015	ZKIKVCAMGKKQGR-UHFFFAOYSA-N	430.350	1.943	50	20	IDGD	
Cc1cc(C)n(-c2ccc(C(F)(F)F)cc2NC(=O)C(=O)NNc2nccn(C)c2=O)n1	785085786	FURKCXLASQKOHC-UHFFFAOYSA-N	449.393	1.683	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)cn1C	785099505	HJGPGDIEPHKXNB-UHFFFAOYSA-N	449.414	1.454	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1cccc(Cn2cccn2)c1	785337146	DGSRCVDUQRYCQS-UHFFFAOYSA-N	443.485	1.425	50	20	IDGD	
Cc1cc2c(cc1C)[C@@H](C(=O)OCC(=O)NNC(=O)[C@@H]1COc3ccccc3O1)CO2	786955501	FCYREFRJBGKKDX-KXBFYZLASA-N	426.425	1.310	50	20	IDGD	
CS(=O)(=O)Cc1nc2ccccc2n1CC(=O)NNc1nnc(-c2ccccn2)s1	788566538	DGIDXHMRXXTYRN-UHFFFAOYSA-N	443.514	1.638	50	20	IDGD	
CN(NS(=O)(=O)c1ccc(F)cc1F)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	788916379	NNSMKXWBGYHGQG-UHFFFAOYSA-N	434.465	1.763	50	20	IDGD	
CN1CCN(C(=O)c2ccc(NC(=O)C(=O)NNc3cccc(F)c3[N+](=O)[O-])cc2)CC1	790997540	RUJUJJFRQJNMGF-UHFFFAOYSA-N	444.423	1.203	50	20	IDGD	
CCS(=O)(=O)c1ccc([C@@H](C)NCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1	792950192	PIBSKACGLMJVKQ-CYBMUJFWSA-N	434.474	1.500	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1cccc(Cl)n1	793017451	FLSLMFBRZAKJKK-UHFFFAOYSA-N	425.898	1.894	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1cc(F)ccc1-n1cccn1	793594298	XEBGRBLNNUTYQL-UHFFFAOYSA-N	445.476	1.789	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccccc1S(=O)(=O)C(F)F)c1ccc(Cl)nc1	794579574	MDIYXJVFCVZSOT-UHFFFAOYSA-N	425.822	1.355	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)CNC(=O)OC(C)(C)C)c(Br)c1	794597249	VTHSXRMNGNYUKX-UHFFFAOYSA-N	438.300	1.292	50	20	IDGD	
CNC(=O)c1cc(Cl)cc(S(=O)(=O)NNC(=O)c2cccc3ncccc23)c1OC	795320136	WQYPUYZUSBWTGB-UHFFFAOYSA-N	448.888	1.880	50	20	IDGD	
CNC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)CCCc2cccs2)c(C)c1	797005992	HSVPMTANCYWKMR-UHFFFAOYSA-N	432.502	1.290	50	20	IDGD	
CCc1ccnc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1	798119216	XVFQLRJAQQSMEV-UHFFFAOYSA-N	431.518	1.573	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)OCC(=O)N3C)c1C	799258374	ALOFJQJLOIIWQU-AWEZNQCLSA-N	440.456	1.212	50	20	IDGD	
CN(C)c1cccc(CCC(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1	801876941	SKNVXQFKLGWMQD-LJQANCHMSA-N	427.457	1.216	50	20	IDGD	
CC(C)(C)OC(=O)N(CC(=O)NNC(=O)Nc1ccc2c(c1)OCO2)C[C@@H]1CCCO1	802105285	SKBFQQDQIPWQGP-AWEZNQCLSA-N	436.465	1.984	50	20	IDGD	
CC(=O)Nc1ccc(NS(C)(=O)=O)c(C(=O)NNC(=O)Nc2ccc(N(C)C)cc2)c1	802125150	OHSIXPKEXOACKA-UHFFFAOYSA-N	448.505	1.549	50	20	IDGD	
COc1ccc(S(C)(=O)=O)cc1S(=O)(=O)NNC(=O)C12CC3CC(CC(C3)C1)C2	802720848	OXCZJVLAYJYREO-UHFFFAOYSA-N	442.559	1.625	50	20	IDGD	
C[C@@H](Cn1ccc2ccccc21)C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	802762569	IWSRZCTYSRNCNJ-IBGZPJMESA-N	447.539	1.883	50	20	IDGD	
COCCNC(=O)CSc1ccccc1C(=O)NNc1ccc(-n2ccnc2)nn1	804957193	DOFUCPLXESFJHT-UHFFFAOYSA-N	427.490	1.274	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)NCCCN2C(=O)c3ccccc3C2=O)c1	805820403	MERNXNBXLDETRI-UHFFFAOYSA-N	426.429	1.334	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)Nc1ccc(F)c(S(=O)(=O)NC)c1	806545509	XYIKWUGVVZOVTL-UHFFFAOYSA-N	440.453	1.364	50	20	IDGD	
O=C(CCc1ccccc1)NNC(=O)C(=O)Nc1cc(F)c(N2CCOCC2)cc1F	806978247	SLTPDHYQZXILRZ-UHFFFAOYSA-N	432.427	1.520	50	20	IDGD	
O=C(N[C@H](C(=O)NNc1nccc(N2CCOCC2)n1)c1ccccc1)c1ccccc1	807076261	ZCFQNVJWKFBERY-FQEVSTJZSA-N	432.484	1.928	50	20	IDGD	
CN1CCN(C(=O)NNC(=O)[C@H]2CC(=O)N(C)[C@H]2c2ccc(Cl)c(Cl)c2)CC1	807382312	AGVWLYLSDHYMGV-LRDDRELGSA-N	428.320	1.501	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)C(=O)Nc1ccccc1OC[C@@H]1CCCCO1	807429742	WXXNHSIIBVLYIR-HNNXBMFYSA-N	437.460	1.692	50	20	IDGD	
O=C(CCSc1ccc(F)cc1)NNC(=O)NC[C@H](N1CCOCC1)C(F)(F)F	807541535	OELCDVDWULFMLR-AWEZNQCLSA-N	438.447	1.901	50	20	IDGD	
COC[C@]1(C(=O)NNC(=O)CNc2ccccc2OC)CCN(C(=O)OC(C)(C)C)C1	810007565	LHIHZVPMLPIGHQ-NRFANRHFSA-N	436.509	1.528	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)Nc1ccc(C(N)=O)cc1OCC(F)F	810306810	OZMBSIQSZZGHCQ-UHFFFAOYSA-N	433.371	1.533	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)N1CCC[C@@H](CNC(=O)C(F)(F)F)C1	811876102	JAPFXTPLBUDLIS-ZDUSSCGKSA-N	425.411	1.773	50	20	IDGD	
COc1cc2c(cc1NC(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1)NC(=O)CC2	812962515	UHJCDPCYAQNNJP-UHFFFAOYSA-N	433.490	1.979	50	20	IDGD	
CC(C)[C@H](NC(=O)COc1ccccc1)C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	814999856	ANISXOCIJDCZGL-IBGZPJMESA-N	447.513	1.071	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1cc(Cl)ccc1OC(F)(F)F	815571276	ZJCCUOQDJGPPNR-MRVPVSSYSA-N	427.763	1.376	50	20	IDGD	
CC(C)c1nc2ccc(NC(=O)C(=O)NNC(=O)[C@H]3CCc4nncn4C3)cc2s1	815691409	PHMLIACXXNZNNM-NSHDSACASA-N	427.490	1.360	50	20	IDGD	
CCOc1ccc(NNC(=O)C(=O)N2C[C@H](C[C@H]3COCC(=O)N3)c3ccccc32)cc1	815817120	DJKSISWLTMFYLB-RDJZCZTQSA-N	438.484	1.564	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3c[nH]c(C(F)(F)F)c3)cc2)CC1	815854426	BZWKVIWDFDXEFB-UHFFFAOYSA-N	431.440	1.727	50	20	IDGD	
CCCCCCOc1ccc(C(=O)NNC(=O)[C@H]2CCCN(S(N)(=O)=O)C2)cc1	816830888	YDVWHFAPUCGCBU-INIZCTEOSA-N	426.539	1.322	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)c1nnn(-c2cccc([N+](=O)[O-])c2)c1C	818898342	NNEDCBXFJMQMIB-UHFFFAOYSA-N	425.405	1.366	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)/C(=C\c2ccccc2)n2nnnc2C)cc1	912608305	ZQVUKDFNJLAHJJ-AUQXIXNCSA-N	436.472	1.993	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)[C@H]1CC(=O)N(C(C)(C)C)C1	914931328	RPMZRVIDBIOGSA-NSHDSACASA-N	425.869	1.300	50	20	IDGD	
COc1cc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)ccc1O	916369988	XDYUAOHSPCLECZ-UHFFFAOYSA-N	448.501	1.330	50	20	IDGD	
CCNC(=O)COc1ccc(CNC(=O)NNC(=O)Cc2ccc(Cl)cc2)cc1OC	916388895	LPFKODFNPCBWLR-UHFFFAOYSA-N	448.907	1.937	50	20	IDGD	
O=C(NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)N[C@H]1CCN2CCC[C@@H]2C1	916574191	WZFAHGVQHJDICX-DLBZAZTESA-N	435.550	1.042	50	20	IDGD	
O=C(NC[C@@H]1CCN(CC(F)(F)F)C1)NNC(=O)c1nn(-c2ccccc2)cc1O	916577901	KVMVGPGOCACCJO-LBPRGKRZSA-N	426.399	1.406	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)Cc2ccc(F)c(Br)c2)c1	917513923	NWLOKOFSTSDJJP-UHFFFAOYSA-N	429.267	1.995	50	20	IDGD	
CCN1C(=O)c2ccc(C(=O)NNC(=O)[C@@H](C)Oc3cccc(C)c3C)cc2S1(=O)=O	917520072	UOFJCFGMTIHKGC-CQSZACIVSA-N	445.497	1.696	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@@H]1CCCCN1C(=O)c1ccco1	918421850	YMUOAZAGBNRGHP-AWEZNQCLSA-N	447.517	1.337	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)CS(=O)(=O)Nc1ccc(OC(C)C)cc1	918478591	FAPALLPDUZXNOD-UHFFFAOYSA-N	445.501	1.633	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)c2ccc(CCNS(C)(=O)=O)s2)cc1	919835422	IOFOBWFBCWHLDR-UHFFFAOYSA-N	425.532	1.242	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccc(Cl)cc2Cl)c1)N[C@@H]1CCS(=O)(=O)C1	919889358	YFJSGEBWNYCEGB-LLVKDONJSA-N	432.289	1.310	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1cccc(NC(=O)c2ccc3nc[nH]c3c2)c1	920288681	YHMQZKWDKXZDNM-CQSZACIVSA-N	441.469	1.011	50	20	IDGD	
CCNC(=O)CNC(=O)/C(C#N)=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	920852813	XDTDTIMTASDEHD-NTEUORMPSA-N	428.880	1.238	50	20	IDGD	
NC(=O)[C@@H]1CCCN1Cc1cccc(NC(=O)NNC(=O)c2ccc3c(c2)OCCO3)c1	920933321	TWAQAVXLRFRAON-KRWDZBQOSA-N	439.472	1.374	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)CCc2nc3ccccc3oc2=O)c2ccccc2c1=O	933476219	RQSLETCXRIWURL-UHFFFAOYSA-N	433.424	1.312	50	20	IDGD	
CNS(=O)(=O)c1ccc(CC(=O)NNc2nc(-c3ccccn3)nc3c2CCC3)cc1	1116599158	LPXINKIIMGHDBK-UHFFFAOYSA-N	438.513	1.621	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2[nH]nnc2C)C1	1777746471	REBIKQOETGXHSE-PBFPGSCMSA-N	428.331	1.414	50	20	IDGD	
C#CCCCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C1	1778095029	QNVRYVNDVAJNGY-RCBCJABQSA-N	441.532	1.438	50	20	IDGD	
C[C@H](NC(=O)c1ccccc1)C(=O)N1CCO[C@]2(CCN(C(=O)CO[Si](C)(C)C)C2)C1	1779300144	PAINNTMJMFTSQR-JTSKRJEESA-N	447.608	1.486	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnn3c1CCC3)C2	1779546419	WGKQLTSMEWDQMZ-WIYYLYMNSA-N	434.613	1.808	50	20	IDGD	
CCC[C@H](NC(C)=O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CO[Si](C)(C)C)C1	1779546614	ZDQZVQUMCQXKPM-WAOWUJCRSA-N	441.645	1.657	50	20	IDGD	
Cc1n[nH]c(C)c1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Br)C2	1779610393	XBJIJQWWUPRREE-HACGYAERSA-N	431.306	1.845	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCN1CCN(C)CC1)C2	1780702282	MJAOTOHFGCNNAE-WAOWUJCRSA-N	429.005	1.155	50	20	IDGD	
O=C(c1cc2cn[nH]c2cn1)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781331516	MBZJRNCZYRVNFY-CJNGLKHVSA-N	426.246	1.092	50	20	IDGD	
C[C@H](C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1)n1cccc1C=O	1781332121	ZXDGBHDJEKBCTG-IFIJOSMWSA-N	430.274	1.382	50	20	IDGD	
O=C(c1cnc2ccc(F)cn12)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781333876	TTYFAWGYIQSLBB-RHSMWYFYSA-N	443.248	1.607	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(CO)on1)C2	1781902940	LJUMYMZETHIFKJ-JCKWVBRZSA-N	444.326	1.468	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)Br)C1)C1(O)CCC1	1781995856	XRVVZNVLOHEMTO-ATNYBXOESA-N	431.371	1.835	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](C)Br)C2)n(C)n1	1781996881	XCJMYFHWBWHJCH-JCKWVBRZSA-N	427.343	1.639	50	20	IDGD	
O=C(c1ccc2c(Cl)ccnc2c1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1782201445	ADRNLRNELSEQGS-FXAWDEMLSA-N	438.311	1.931	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc3nncn3c1)C2)C(Cl)Cl	1782217935	BVIQTKKZUVADLD-FZKQIMNGSA-N	426.304	1.661	50	20	IDGD	
O=C(O)CSCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCBr)C2	1782223013	SZBKEEOVLKOTOD-MLGOLLRUSA-N	437.356	1.103	50	20	IDGD	
CCC[C@H](NC(C)=O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCBr)C2	1783185146	MOOFTIURFANNBZ-FRQCXROJSA-N	446.386	1.590	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)CCBr)CCO2)C1	1783342161	JHPKMKVSVRDKHG-SMDDNHRTSA-N	426.149	1.775	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc4c(cnn4C)c3)CCO2)C1	1783534695	YBUQKVQWNQSZCP-YJYMSZOUSA-N	435.322	1.800	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H]1CC(c3ccccc3)=NO1)CCO2	1783871043	MDVAWQMEZQAFOU-YRISNDGFSA-N	435.908	1.263	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cc(C(F)(F)F)nn3C)CCO2)C1	1783877028	DMDDLTPHRVVQRI-BDJLRTHQSA-N	438.834	1.136	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)Cc3ccc(F)cc3OC)CCO2)C1	1783883791	KDGNRECXYOYLLO-OXJNMPFZSA-N	428.888	1.461	50	20	IDGD	
CCn1nc(C)cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]2C1	1783966088	ZBKNYBMBVXCSSM-QEWYBTABSA-N	441.370	1.836	50	20	IDGD	
CC(C)=NO[C@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]2C1	1783971669	DNVCIPPNNYPCHZ-QRJUGERDSA-N	432.359	1.798	50	20	IDGD	
Cn1c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]3C2)ccc1C(F)(F)F	1784090360	BBAXDLPJDUUOPM-IMIFBBOLSA-N	437.846	1.237	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)CCc3ccc(N(C)C)cc3)C2)C1	1784246809	OUWPHDYZRHFGFO-UGKGYDQZSA-N	437.968	1.769	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)/C=C/c3ccccc3[N+](=O)[O-])C2)C1	1785551359	UULKVMMGUVKDPU-OJCVGBIZSA-N	437.880	1.692	50	20	IDGD	
CC(C)(C)OC(=O)NC1(C(=O)N2CC[C@@]3(CN(C(=O)C(Cl)Cl)CCO3)C2)CC1	1785714793	DLXGNCMXXFXFQU-QGZVFWFLSA-N	436.336	1.677	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)COc3ccc(C(=O)OC)cc3)C2)C1	1785721659	XLLBPNTUSBUSIM-UTKZUKDTSA-N	438.908	1.699	50	20	IDGD	
CC[C@H](NC(C)=O)C(=O)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1	1785865066	HBBBABALNARLGW-FQEVSTJZSA-N	437.305	1.029	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/C3CCCCC3)C[C@@H]21)c1cccc(B(O)O)c1	1786984730	BUMWYSUKGYTTHX-LPCYXGDASA-N	440.349	1.096	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3cc(F)cc(F)c3)[C@H]2C1	1787079332	BPPOPSYEUJBCME-MGHWNKPDSA-N	430.879	1.741	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc([N+](=O)[O-])cc4c3OCC4)C[C@@H]21)[C@@H](F)Cl	1787448209	YFRAJCOFCUMUCZ-JIRONKKISA-N	441.843	1.657	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccn4nccc4c3)[C@H]2C1	1788445419	KWKXWBKNPBDREA-KCMWZYNZSA-N	449.349	1.959	50	20	IDGD	
CN1CCC(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]3C2)CC1	1788761948	HWBISBWUUPHIIU-FHWLQOOXSA-N	425.646	1.550	50	20	IDGD	
COc1cccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Br)C[C@@H]32)c1	1789539975	ZHEQVHQGCBCOBI-TUUVXOQKSA-N	429.286	1.979	50	20	IDGD	
CCc1nc(C(=O)Nc2ccc(C3(NC(=O)c4ccc(B(O)O)cc4)CCC3)cc2)co1	1789849815	KDJGHJMGQJBRPS-UHFFFAOYSA-N	433.273	1.978	50	20	IDGD	
N#Cc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](O)CCl)C[C@@H]32)c(Cl)c1	1790228355	SHNIVMFQRAQSMI-CSFVBSKPSA-N	426.300	1.405	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc4ccnn34)[C@H]2C1	1790345450	SRDGUOPYZQIXRL-RMRKRWHISA-N	435.322	1.711	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)Cn3ccnc3)[C@H]2C1	1791630421	PBELBQSQTMTZPY-QXKUPLGCSA-N	427.343	1.282	50	20	IDGD	
COC(=O)c1ccc(OCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Cl)C[C@@H]32)cc1	1792340181	QKQMIJURUBGJOR-OWIUFQIYSA-N	442.871	1.366	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1n[nH]c3c1CCCC3)C2	1792868268	SSTFLOMMQKHJSF-JFILPPLUSA-N	439.354	1.523	50	20	IDGD	
O=C(CCCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2)Nc1ccccc1	1792937140	OADXNMPHRVZXAG-GTYSZEQSSA-N	425.888	1.919	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(F)ccc1C(F)(F)F)C2)[C@H](O)CCl	1792983340	HXGMAHVZVFETSL-ANGCBRKESA-N	438.805	1.647	50	20	IDGD	
COCCn1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](C)CBr)n1	1792987806	CCGDYYLVTMXXMY-APIJFGDWSA-N	427.343	1.812	50	20	IDGD	
C[C@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCBr	1795113299	VXLLDQPETUFZDI-XPCVCDNBSA-N	448.358	1.274	50	20	IDGD	
CO[C@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)Br)C2)c1ccccc1	1795376731	SQZDRYOQUIDCIG-RKOFLFEYSA-N	425.323	1.747	50	20	IDGD	
N[C@@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1cccc(Cl)c1	1795628575	TYNCGMUMFYMXES-OBRUSBNWSA-N	448.720	1.620	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)c1ncccc1-c1ccccc1	1796644846	ATJJWSQJXUICRC-UKBAYJJMSA-N	429.904	1.552	50	20	IDGD	
CN(C)c1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCBr)C3)cn1	1798261067	IJLNKYTZJPWUQH-XOIINTDNSA-N	425.327	1.136	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CNc1ccc(F)cc1)C2	1798439405	YPICZSIZUGLQNS-BJWYYQGGSA-N	440.479	1.188	50	20	IDGD	
C/C(=C\c1cccnc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Br	1799351783	AKYNBPLZMKNMLV-OQBSVPFQSA-N	426.286	1.765	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](C)N1CCN(C)CC1	1799965402	MCECCBXNKBEABU-NNXHMXCWSA-N	429.403	1.292	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@H](O)CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C(Cl)Cl)C2	1800183027	YIZYMXOGJBJJFG-YVECIDJPSA-N	438.352	1.704	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1c(C)noc1C)C2	1800640034	HBPDQLBAOWYFIR-CXHZTBPHSA-N	442.354	1.987	50	20	IDGD	
COc1cccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCBr)C3)c1C	1800818769	MXPFWMAHFDWQDA-CWPLJXCYSA-N	439.350	1.921	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C#Cc1ccc(Cl)cc1)C2	1800971470	ZQSSGKGRIFYVSW-HIRMHNASSA-N	425.312	1.535	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)c1ccc(F)c(C(F)(F)F)c1	1801856065	TVSMAFRYZJDBAI-BAESOJJISA-N	438.805	1.647	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@H]2[C@H](C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)[C@@H](O)CCl)C4)[C@@H]2C1	1801897945	UHCNPKPDMHQHNB-DPNXGZFNSA-N	441.956	1.337	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@H]1CCN(C(=O)c2cnnn2C)[C@@H]1c1cccnc1	1803009018	OFSPNDCSTGRNPE-XNRPHZJLSA-N	435.326	1.561	50	20	IDGD	
CN(C)c1cncc(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)c1	1804848837	VEMGQQMAVBZKGV-ZYSHUDEJSA-N	431.924	1.462	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)C(C)(C)F)[C@@H]1c1cccnc1	1808414194	GDGJIKBXCXXNLT-PMRLGZHMSA-N	442.495	1.970	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1cccc(F)c1	1811800262	KSESSBCITKDUOH-DENIHFKCSA-N	447.275	1.534	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1	1812362765	DXJZQBRNOYLGRC-SYAUCNOPSA-N	427.885	1.249	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)CN2CCSCC2)[C@@H]1c1cccnc1	1813027886	HTCNDFCMKJKJCM-ZIFCJYIRSA-N	440.997	1.390	50	20	IDGD	
CSCC[C@H](O)C(=O)NC[C@@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1	1813092514	WGXMJNNRYMABEN-YQQAZPJKSA-N	444.395	1.986	50	20	IDGD	
CC1(C)CC(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)C1	1813126876	YDLQMIYBKGUXRA-GHTZIAJQSA-N	435.333	1.517	50	20	IDGD	
O=C(Cn1ccccc1=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](F)Br)CC2	1815448961	XJINFDOVCBPCLU-XPTSAGLGSA-N	443.298	1.608	50	20	IDGD	
Cc1oncc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1816514575	KQBIKCLJFXCHRF-INIZCTEOSA-N	438.448	1.324	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc3n(n2)CCNC3=O)n[nH]1	1816625796	IHPIJLNOTCRGMW-FZMZJTMJSA-N	433.900	1.673	50	20	IDGD	
O=C(Cn1cccc([N+](=O)[O-])c1=O)N[C@H]1CCc2nc(NC(=O)[C@H](F)Cl)sc2C1	1817133856	IYFFRCBIGVIROA-SDBXPKJASA-N	443.844	1.360	50	20	IDGD	
Cc1ccncc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1818337044	LAWHQHZBLNBYTB-SFHVURJKSA-N	448.487	1.731	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@H](F)Cl)CC2)c1cc2n(n1)CCCNC2=O	1818913244	HFIXZYPMPYOAMH-OQPBUACISA-N	440.888	1.233	50	20	IDGD	
CCNC(=O)N[C@@H](C)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CO[Si](C)(C)C)CC2	1819691258	XYPRPIVXPLPKOX-RYUDHWBXSA-N	441.630	1.614	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)[C@@H]1[C@H]2C=CS[C@H]21	1821707114	KIJXAQXVOAPUKZ-IWKCEXAMSA-N	438.318	1.271	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2nc(C)c(C)[nH]c2=O)[nH]n1	1822367255	JWUCKDZFUVOFAW-JSGCOSHPSA-N	436.900	1.670	50	20	IDGD	
CCS(=O)(=O)N[C@H](C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)C(Cl)Cl)n[nH]1	1822419362	WWKFWYLZRUWEIF-KOLCDFICSA-N	440.353	1.533	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)C(F)(F)C(F)F)CC2	1826083204	KQKBJCHUDSEZQH-QMMMGPOBSA-N	439.435	1.329	50	20	IDGD	
Cc1nocc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827050773	FTJVAGJJMHOQRJ-HXUWFJFHSA-N	425.294	1.210	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H](C)Br)CC1	1827567407	ULVDYIZKISRZNY-SNPRPXQTSA-N	431.375	1.836	50	20	IDGD	
CC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1	1828925367	KCKWOCQMVDCIRY-IBGZPJMESA-N	429.521	1.288	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3nc4ccccn4n3)C2)C1	1831647848	ZJKOKCFPUVPQAL-MGPUTAFESA-N	435.912	1.207	50	20	IDGD	
Cc1ccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)c(O)n1	1831873716	UNQPZNDBAGNNJI-LJQANCHMSA-N	445.564	1.702	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)CC[C@@H]2CCOC2)CC1	1832456270	LYXBWDBDURVYPB-QUCCMNQESA-N	436.597	1.796	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)Cc3csc(C)n3)CC2)CC1	1833819237	GBUNUJJCFHOCOD-GOSISDBHSA-N	443.013	1.819	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccs3)CCO2)C1	1833930214	IVINNWDFCPRNEO-GUYCJALGSA-N	431.352	1.849	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3ncc[nH]3)CC2)CC1	1834034356	SYENWZIEYTZHQM-HNNXBMFYSA-N	426.359	1.768	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCC(N2CCC(NC(=O)CCN3CCOCC3)CC2)CC1	1834635034	LRTXDUVEKHGKOH-UHFFFAOYSA-N	443.032	1.545	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)Cc3ccc(F)cn3)C2)C1	1834822430	NGPIPVWMQPGWCM-SFHVURJKSA-N	444.301	1.005	50	20	IDGD	
Cc1nnsc1C(=O)NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1	1835182830	WVHKZXSWLDKLTL-AWEZNQCLSA-N	448.362	1.722	50	20	IDGD	
CC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](Br)Cc3ccccc3)C2)C1	1835204354	AZEOLDFPMRNWLU-MJGOQNOKSA-N	425.323	1.469	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc4n[nH]cc4c3)CCO2)C1	1836424607	SWJZJYLLUSPYBP-OAQYLSRUSA-N	434.924	1.898	50	20	IDGD	
CCC(=O)N[C@H](C)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](C)Br)CC2)CC1	1836817734	IRLMXKBXYDYVTP-ZIAGYGMSSA-N	446.386	1.683	50	20	IDGD	
Cn1nc(C(=O)N2CCC(OC3CCN(C(=O)CCBr)CC3)CC2)cc1O	1837269643	PMUUGTPTITUFRE-UHFFFAOYSA-N	443.342	1.523	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)C/N=C/c3ccco3)CCO2)C1	1837559909	JSDDZUCPGAEORK-WRJCRLLZSA-N	425.913	1.562	50	20	IDGD	
COC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)[C@H](C)Br)CC2)CC1	1837663756	XBQZNKNUWVTNDT-ZDUSSCGKSA-N	433.343	1.722	50	20	IDGD	
Cc1nc(C)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)o1	1838007433	BLZIFXVJLCSJBQ-APPDUMDISA-N	430.299	1.145	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)c(O)n1	1838672164	KDNSIJOYCIMLAX-RBUKOAKNSA-N	446.331	1.402	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(C)n4ccnc4n3)C2)C1	1839148253	SLFALRPFVCJJLJ-MGPUTAFESA-N	435.912	1.125	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(OC)cc3F)CCO2)C1	1839293048	NVSHGOKOAAXSEE-JXFKEZNVSA-N	444.887	1.158	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)ccc1O	1839310250	FPLABBSEURCVHD-CRAIPNDOSA-N	445.285	1.461	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cncc(O)c3)C2)C1	1839966855	RNCHPFFLOLCXTP-QAPCUYQASA-N	442.310	1.031	50	20	IDGD	
O=C(c1nc(Cl)ccc1F)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840186716	TWTBONXRXONIPG-MRXNPFEDSA-N	440.686	1.748	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@H](NC(=O)c1ccccc1)[C@@H](C)O)C2	1841666635	OSSNDLMUCKQRCN-NXHRZFHOSA-N	435.952	1.777	50	20	IDGD	
O=C([C@@H](F)Br)N1CC2(CCCN2C(=O)c2ccc(N3CCOCC3)cn2)C1	1842266302	VEJZLUCDBRXEKX-OAHLLOKOSA-N	441.301	1.426	50	20	IDGD	
Cc1noc(-c2ccccc2)c1C(=O)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843011298	PWZBBCLVEDGJTM-UHFFFAOYSA-N	445.284	1.461	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2ccncc2Cl)C1	1844440378	JBTPOPBHYPWCJM-ZMOGYAJESA-N	428.880	1.686	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@H](CC(=O)OC)NC(=O)OC(C)(C)C)C2	1845167443	COBIIULMOBSGSU-KBPBESRZSA-N	445.944	1.664	50	20	IDGD	
CC(=O)N(C)[C@@H](C)C(=O)N1CC2(CCCN2C(=O)/C(C#N)=C/c2ccc(F)cc2F)C1	1845871142	SWGGKOSSMBPLLB-VEJKBTLKSA-N	430.455	1.942	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC12CN(C(=O)[C@H](C)NC(=O)c1ccc(F)cc1)C2	1846178476	ZPFQXJUMPFFQIW-STQMWFEESA-N	440.313	1.931	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)C1CN(C(=O)c3ccccc3OC)C1)C2	1846360521	RHRZNTNHURXUSL-QGZVFWFLSA-N	449.935	1.224	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)/C=C/c1cc(F)c(F)c(F)c1)C2	1846386108	CLENBVWHRFMIDB-GQCTYLIASA-N	438.450	1.694	50	20	IDGD	
O=C1COc2ccc(Cl)cc2N1CC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](F)Cl	1848034838	RWZGHIGJDKMRFA-NVGCLXPQSA-N	430.263	1.802	50	20	IDGD	
Cc1cc(NC(=O)[C@@H](C)SCC(=O)NNC(=S)NCCc2cccs2)no1	11516794	YNDWCHUQYZZANY-LLVKDONJSA-N	427.577	1.843	50	20	IDGD	
Cc1nnc(NNC(=O)c2cccc(S(=O)(=O)N(C)c3cccc(Cl)c3)c2)[nH]c1=O	11548125	AICBNXXHFOMOFB-UHFFFAOYSA-N	448.892	1.709	50	20	IDGD	
CCOC(=O)NNC(=O)c1cccc(NC(=O)C[C@@H]2SC(N3CCCCC3)=NC2=O)c1	21771979	HDQXSOCLWYDEPL-HNNXBMFYSA-N	447.517	1.890	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CC[C@H](CNC(=O)OC(C)(C)C)C1	725810537	QEQBKXFCTWKNRF-CYBMUJFWSA-N	440.928	1.956	50	20	IDGD	
Cc1cc(C)nc(SCc2ccc(C(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)cc2)n1	727943002	TVJCTSGPOZLTRG-INIZCTEOSA-N	434.543	1.581	50	20	IDGD	
CCOC(=O)C1=NN(c2ccccc2)[C@H](C(=O)NNC(=O)c2ccc(OC)c(OC)c2)C1	728454962	CJDGPUYEAOIESZ-KRWDZBQOSA-N	440.456	1.663	50	20	IDGD	
CCC1(CC)NC(=O)N(CC(=O)NNC(=O)c2cc(OC)ccc2Br)C1=O	728528946	NYKVQBRJCHAWQZ-UHFFFAOYSA-N	441.282	1.329	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)c(OC)c1	730021207	ATFZPAZBXBWFQB-UHFFFAOYSA-N	448.432	1.019	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc2c(c1)OCCCO2)NN=c1cc[nH]c2ccccc12	730288363	FSZUYQVSKBCJBW-UHFFFAOYSA-N	428.470	1.240	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)NCc2nnnn2-c2ccccc2)cc1	730672777	LTEDWDSDGGMGHO-CQSZACIVSA-N	425.449	1.359	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)c2cccc(S(=O)(=O)Cc3ccccc3)c2)n1	730769550	VGEJEDRKUNYMCR-UHFFFAOYSA-N	426.498	1.935	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)NC2CCN(CCC(=O)N(C)C)CC2)c1C	731543646	OKFKNJDIVWCNSY-KRWDZBQOSA-N	433.553	1.344	50	20	IDGD	
CCOCCN1CCN(C(=O)CCC(=O)C(C#N)=C2N(C)c3ccccc3N2C)CC1	732122136	XSCFIDLHEJFOPI-UHFFFAOYSA-N	425.533	1.838	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)cc1Br	732244935	MVXINONBAKBLET-UHFFFAOYSA-N	431.287	1.926	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2cnc(-c3ccc4c(c3)OCO4)s2)C[C@@H](C)O1	732264913	YADWWCITMATHIX-BETUJISGSA-N	432.502	1.799	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)CC[C@@H]2NC(=O)N(c3ccc(C#N)cc3)C2=O)c(C)c1	733805390	STMUPSKQEXQLKH-IBGZPJMESA-N	448.483	1.640	50	20	IDGD	
COc1cc(C(C)=NNC(=O)NCCNC(=O)OC(C)(C)C)ccc1S(C)(=O)=O	734303625	ASKUPKONDSWCLR-UHFFFAOYSA-N	428.511	1.647	50	20	IDGD	
COc1cc(C#N)ccc1OCC(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	734825370	CDOUTXOFTTVURP-UHFFFAOYSA-N	447.492	1.676	50	20	IDGD	
O=C(NNc1ccc(Cl)cc1Cl)C(=O)Nc1ccn(CC(=O)N2CCOCC2)n1	735272982	JBEKYGGRHGJUMD-UHFFFAOYSA-N	441.275	1.131	50	20	IDGD	
CCCC[C@H](COC)NC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	737061164	KESOXVDYIWXQES-MRXNPFEDSA-N	426.539	1.620	50	20	IDGD	
O=C(NN=C1CCN(CCN2CCOCC2)CC1)c1cc(Br)ccc1O	741768447	DBUZLGOEPPJUCU-UHFFFAOYSA-N	425.327	1.669	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)[C@H](c1ccc(Cl)cc1Cl)N1CCOCC1	742696876	DIALCCTXHLLLSM-INIZCTEOSA-N	445.347	1.819	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)c2ccc(N3CCCS3(=O)=O)cc2C)c1	743295198	HTRVQOPHLZHLLP-UHFFFAOYSA-N	432.502	1.417	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cc(-c3ccc(C)cc3)[nH]n2)cc1N1CCNC1=O	743309595	OOUDATWITGKQKV-UHFFFAOYSA-N	434.456	1.998	50	20	IDGD	
COC(=O)N1CCC[C@H](NC(=O)NNC(=O)Nc2cc(Cl)c(OC)cc2OC)C1	743583942	RNDQYZRLJOCRSK-JTQLQIEISA-N	429.861	1.924	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NCCn2c(=O)oc3ccccc32)cc1	743598800	OJMKBRWLCIWNEF-UHFFFAOYSA-N	433.446	1.034	50	20	IDGD	
O=C(CCN1C(=O)NC2(CCCC2)C1=O)NNC(=O)c1cc(Br)ccc1O	743732045	ITHGSUOCJBHGQI-UHFFFAOYSA-N	439.266	1.170	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)COc2ccc(Br)cc2)cc1	744466877	GIWISELWEJMGOM-UHFFFAOYSA-N	432.230	1.704	50	20	IDGD	
CC(C)(C)OC(=O)NC1(C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)CCCC1	744964107	PLNRHCSCWSYNER-UHFFFAOYSA-N	430.461	1.700	50	20	IDGD	
Cc1nc(-c2cccnc2)nc(O)c1CCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	745414141	YXWJYUMGHFDQCY-SFHVURJKSA-N	435.440	1.473	50	20	IDGD	
NS(=O)(=O)c1cccc(CNC(=O)NNC(=O)Nc2ccc(OC(F)F)cc2)c1	745593228	GXSIEHVXHHVKPX-UHFFFAOYSA-N	429.405	1.471	50	20	IDGD	
C[C@@H](CN1CCN(c2ccccc2)CC1)NC(=O)NNC(=O)c1cc([N+](=O)[O-])ccc1O	745837437	HZBCCDGPUBUGQZ-HNNXBMFYSA-N	442.476	1.455	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@H]2CCN(c3ccc(C)cc3)C2=O)c2ccccc2c1=O	745852859	ZJOCGGOPXCTVSM-SFHVURJKSA-N	448.483	1.474	50	20	IDGD	
CCCn1c(=O)nc(O)c2c(C(=O)NNc3nc(C)cc(OC)n3)cc(C(C)C)nc21	746634741	OLVYERFQJCIHDH-UHFFFAOYSA-N	427.465	1.894	50	20	IDGD	
Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCC(C(=O)NNC(=O)c2ccc[nH]2)CC1	747663431	NBAJOBVPVKDFOC-UHFFFAOYSA-N	435.462	1.093	50	20	IDGD	
NC(=O)c1ncn2c(C(=O)NNC(=O)c3cc4ccccc4o3)cc(-c3ccco3)nc12	749473759	GGWBFQLGGREVBN-UHFFFAOYSA-N	430.380	1.909	50	20	IDGD	
CC[C@@H](Oc1cccc(C)c1)C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	750405445	GBAUKCVURLLYJN-VQIMIIECSA-N	428.441	1.683	50	20	IDGD	
COC[C@@H](NC(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1)C1CC1	750446733	OJXVHDRUBZCFLN-LJQANCHMSA-N	435.488	1.757	50	20	IDGD	
O=C(COC(=O)[C@H]1CCCN1Cc1ccc(F)cc1)NNC(=O)c1ccc([N+](=O)[O-])cc1	750501016	FBYFCNXAVJDZBZ-GOSISDBHSA-N	444.419	1.703	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)c1cn(-c2ccccc2Br)nn1	751209268	NLFTXTXGYUWXGK-UHFFFAOYSA-N	449.290	1.282	50	20	IDGD	
C[C@@H](NC(=S)NNC(=O)c1cccc(NC(=O)CSc2nncn2C)c1)C1CC1	751617532	BRGXYJLIXSGYSP-LLVKDONJSA-N	433.563	1.453	50	20	IDGD	
N#C/C(=C/c1ccc(F)cc1)C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	752576821	BXBHWUWSEIJGSV-RGEXLXHISA-N	435.459	1.338	50	20	IDGD	
CC[C@@H](CS(=O)(=O)c1ccccc1)NC(=O)NNC(=O)Cc1nc2ccccc2n1C	752704269	MJYAACHUZROPMI-HNNXBMFYSA-N	443.529	1.699	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)Nc1cc(F)c(I)c(F)c1	756280993	NICZJTYJZLWXCL-SSDOTTSWSA-N	443.188	1.774	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)Nc3ccc(C)c(C(N)=O)c3)n[nH]2)cc1OC	756327402	SFNKTCQGNRRBTP-UHFFFAOYSA-N	438.444	1.968	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)Nc2ccc(F)c(-n3nnnc3C)c2)cc1OC	756335675	KWKVSOGLBXRPBA-UHFFFAOYSA-N	429.412	1.984	50	20	IDGD	
O=C(NCCc1ccccc1OC(F)(F)F)NNC(=O)c1ccc(-n2cnnn2)cc1	756914049	MSXWOYNBQQKTOU-UHFFFAOYSA-N	435.366	1.748	50	20	IDGD	
COCc1nc2n(n1)C[C@@H](NC(=O)NNC(=O)c1ccc(Br)s1)CC2	757784967	BUKNTMQLWRMYFN-QMMMGPOBSA-N	429.300	1.208	50	20	IDGD	
CN(NC(=O)CCNC(=O)OC(C)(C)C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758781796	HDRNIXGLGXZAAU-UHFFFAOYSA-N	429.518	1.537	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](CCC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)C1	759020454	NNFMGOWBILLZCX-INIZCTEOSA-N	446.552	1.878	50	20	IDGD	
COc1cc(F)cc(NNC(=O)[C@H]2CN(Cc3nc(O)c4ccccc4n3)CCO2)c1	759314992	MYWGLQYBYAROOY-GOSISDBHSA-N	427.436	1.827	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)NCc2cnn(C)c2C)cc1	759763324	GSQBCYMEWWOPRT-LICLKQGHSA-N	447.499	1.699	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)Nc1cccc(CN2C(=O)CNC2=O)c1	761222002	HDBUULNTJYBYLF-UHFFFAOYSA-N	443.485	1.692	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)NCCc2ccnn2C)c2ccccc2c1=O	763170590	RSXKOKUBBWCGNU-UHFFFAOYSA-N	425.493	1.507	50	20	IDGD	
O=C(NNC(=O)c1cccnc1)C(=O)Nc1cc(Br)ccc1N1CCCC1	763492341	WLPUUKHHAIVUNY-UHFFFAOYSA-N	432.278	1.844	50	20	IDGD	
C[C@@H](c1ccccc1)n1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)n1	763575603	YTNZKOZSSPMECF-KSSFIOAISA-N	435.440	1.418	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cccc(C(=O)N3CCSCC3)c2)c(C)o1	763577015	RCBDNBOVUDIVTO-UHFFFAOYSA-N	430.486	1.485	50	20	IDGD	
CNC(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)c1	763599904	ANXMMDKANDMGMG-UHFFFAOYSA-N	440.847	1.489	50	20	IDGD	
CC(C)(C)c1ccc(OCC(=O)NNC(=O)C(=O)Nc2cnn(-c3ccncc3)c2)cc1	763600124	NHVPKNZIGBSVHZ-UHFFFAOYSA-N	436.472	1.730	50	20	IDGD	
Cc1noc(COc2ccc(NC(=O)C(=O)NNC(=O)c3c(C)nc4ccccn34)cc2)n1	763629748	SEOILEMHLNLIHU-UHFFFAOYSA-N	449.427	1.313	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)NCc1ccc(N2CCCS2(=O)=O)cc1	763640556	ATZBCQMAICIOBX-UHFFFAOYSA-N	448.501	1.145	50	20	IDGD	
CCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2cc(C)cc(C)c2)c(C)c1	763645633	WNVJOSWWUKQPQG-UHFFFAOYSA-N	426.473	1.526	50	20	IDGD	
CCN(Cc1ccccc1NC(=O)C(=O)NNC(=O)COc1cc(C)ccc1C)C(C)=O	763669236	VMRISPUJKVHYRV-UHFFFAOYSA-N	440.500	1.837	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)NCc2ccc(N3CCCS3(=O)=O)cc2)c1	763696696	ZCFPDBVHKYAICU-UHFFFAOYSA-N	431.518	1.437	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)NCc2ccc(N3CCCS3(=O)=O)cc2)c1	763703158	BHMLMIDLIIBAAU-UHFFFAOYSA-N	448.501	1.388	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(CN3C(=O)CSC3=O)cc2)cc1	763832852	WHEFXIGXXFXQEA-UHFFFAOYSA-N	440.481	1.844	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc3ccccc3c2)cn1C	763849850	LAQZXHVIUNMFSO-CYBMUJFWSA-N	438.440	1.518	50	20	IDGD	
Cc1ccc(C(N)=O)cc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccc2ccccc2c1	763850916	BRNGMUADYCGUAS-AWEZNQCLSA-N	434.452	1.801	50	20	IDGD	
CCCNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)c1	763866033	NEKIISKMRCRYTC-ZDUSSCGKSA-N	430.436	1.519	50	20	IDGD	
CCOCCOc1ccc(Br)cc1NC(=O)C(=O)NNC(=O)CC(C)C	763882340	NLQLQBVJEITDOK-UHFFFAOYSA-N	430.299	1.996	50	20	IDGD	
CC(C)CC(=O)NNC(=O)C(=O)Nc1ccc(Cl)c(S(=O)(=O)N2CCCC2)c1	763889110	XJRKNQMOLTYELI-UHFFFAOYSA-N	430.914	1.257	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)nc(C)n3C)cc1OC	763912789	UDPQMDIKLXFDQX-UHFFFAOYSA-N	425.445	1.689	50	20	IDGD	
COc1ccc(C(=O)N2CCCCCC2)cc1NC(=O)C(=O)NNC(=O)C1CCCC1	764077456	NZRVUESVRBPGGS-UHFFFAOYSA-N	430.505	1.988	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc([C@@H](C)NC(=O)OC(C)(C)C)cc2)n[nH]1	764106304	HXFMRZMODXYZRR-GFCCVEGCSA-N	430.465	1.704	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccn(-c3ccc(Cl)cc3C#N)n2)c(O)c1	764111571	YJZDKDVCNIDVTQ-UHFFFAOYSA-N	438.831	1.811	50	20	IDGD	
CS(=O)(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)cc1F	764241876	NAUQEGGDDOPNCX-UHFFFAOYSA-N	446.460	1.111	50	20	IDGD	
CCS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cccc3ncccc23)cc1	764257457	HFVYHQRCJZDOBT-UHFFFAOYSA-N	426.454	1.428	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc([N+](=O)[O-])c2)cc1Br	764325953	BSYLHXLOQILKBJ-UHFFFAOYSA-N	437.206	1.766	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)Cn1c2ccccc2c(=O)c2ccccc21	764345872	ZQJTXPSHKSWSRX-UHFFFAOYSA-N	429.436	1.127	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@@H]2CCCC[C@H]2N2CCOCC2)c2ccccc2c1=O	764374506	KXLPTTGGNVTSCO-QZTJIDSGSA-N	442.520	1.004	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2c(-c3ccccn3)noc2C)cc1	764534029	ORVWLCIUQSFMEX-UHFFFAOYSA-N	443.485	1.435	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)Nc1nc(CS(C)(=O)=O)no1	765247269	PURMGMQXPGHZBK-NSHDSACASA-N	433.446	1.388	50	20	IDGD	
CCCC(=O)N1CCC[C@H](C(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)C1	766650610	XIYHBYYWJRJXCW-NRFANRHFSA-N	443.592	1.299	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)CN1CCN(C(=O)c2c(F)cccc2F)CC1	766879344	YQJOLVICANNCGO-UHFFFAOYSA-N	430.455	1.421	50	20	IDGD	
COc1cccc(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)c1[N+](=O)[O-]	767992796	UEGFSALORJXXRX-UHFFFAOYSA-N	436.446	1.381	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(C)(C)O)cc1S(=O)(=O)Nc1cccc(Cl)c1	768248023	TVXROOKWEJXNNR-UHFFFAOYSA-N	425.894	1.981	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2ccc(C(=O)NNC(=S)Nc3ccccn3)cc2)C[C@@H](C)O1	768578221	DJWXEYZGXMPJMS-OKILXGFUSA-N	449.558	1.511	50	20	IDGD	
COCCN1CCN(C(=O)/C(C#N)=C\c2cn(CCC#N)nc2-c2ccccc2)CC1=O	769146876	NHZCJPOABGZURH-RGEXLXHISA-N	432.484	1.688	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cccc([S@](C)=O)c3)CC2)cc1	770247939	WNFPWORZOOEEQW-PMERELPUSA-N	428.558	1.311	50	20	IDGD	
COC(=O)CCN1CCN(C(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)[C@@H](C)C1	770655596	FTZUBLCCXNVWSY-KBPBESRZSA-N	426.901	1.417	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)c3cc(C(N)=O)n(-c4ccccc4)n3)nc21	770966542	MMEJCKUGWVCEGK-UHFFFAOYSA-N	435.448	1.328	50	20	IDGD	
Cc1c(C(=O)NNC(=O)[C@H]2CCCN(C(=O)OC(C)(C)C)C2)cnn1-c1ccccn1	773420950	PWNXPARPVRLULN-HNNXBMFYSA-N	428.493	1.984	50	20	IDGD	
COc1cc(SC)ccc1NC(=O)C(=O)NNC(=O)Cc1nc2ccccc2n1C	773613899	SXPRZPNSXQCYDU-UHFFFAOYSA-N	427.486	1.632	50	20	IDGD	
COc1ccc(S(=O)(=O)C(F)(F)F)cc1NC(=O)C(=O)NNc1ccc(C#N)cc1	773700510	MAGIVXKCIRRVLN-UHFFFAOYSA-N	442.375	1.942	50	20	IDGD	
CN(NC(=O)CCC(=O)NC1CCCC1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776202805	XKFAHXZUBLZDTR-UHFFFAOYSA-N	425.530	1.461	50	20	IDGD	
COC(=O)c1ccccc1NNC(=O)c1cc(S(=O)(=O)N2CCOCC2)ccc1OC	777772696	IXNQSJMJKYSAKI-UHFFFAOYSA-N	449.485	1.260	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H](CC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)C1	777800946	NCVYURSYKBXWQY-ZDUSSCGKSA-N	440.522	1.890	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(OC3CCCC3)nc2)c1	781666142	KMQKXVYMBSYLSY-UHFFFAOYSA-N	432.502	1.728	50	20	IDGD	
CCOc1cc(N2CCN(C)CC2)ccc1NC(=O)C(=O)NNc1ncncc1Cl	782159882	YCSVILYZXCCPIC-UHFFFAOYSA-N	433.900	1.362	50	20	IDGD	
Cc1nc(NC(=O)OC(C)(C)C)sc1C(=O)NNC(=O)CNC(=O)c1cccnc1	782556432	QYLHQPRJKMJLLW-UHFFFAOYSA-N	434.478	1.385	50	20	IDGD	
CCN1CCN(S(=O)(=O)c2cccc(NC(=O)C(=O)NNc3ccccc3F)c2)CC1	782707197	JTOBHYWPNGASTF-UHFFFAOYSA-N	449.508	1.234	50	20	IDGD	
CC(C)OCc1cccc(NC(=O)C(=O)NNC(=O)c2csc(N3CCOCC3)n2)c1	782896292	FAUMHKKTZKWTMO-UHFFFAOYSA-N	447.517	1.304	50	20	IDGD	
O=C(NNc1ncnc2ccsc12)C(=O)Nc1ccc(S(=O)(=O)C(F)F)cc1	783261991	LGDHVKMZPVVFHA-UHFFFAOYSA-N	427.414	1.769	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1ccc2c(c1)OCO2	784833741	RXKLJTJEUJOJEJ-UHFFFAOYSA-N	434.474	1.574	50	20	IDGD	
CNC(=O)[C@H]1CN(C(=O)C(=O)NNc2cc(C(F)(F)F)ccc2F)c2ccccc2O1	785167276	RRYXEFPAAQTYCM-OAHLLOKOSA-N	440.353	1.828	50	20	IDGD	
C[C@@H]1[C@@H](C(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)CCN1C(=O)OC(C)(C)C	786249889	LQZDKZDLKBAOBG-DOMZBBRYSA-N	438.912	1.749	50	20	IDGD	
CCc1[nH]nc(C(=O)N2CCN(S(=O)(=O)CBr)CC2)c1Br	790013387	DCZBYOSKNLJAJY-UHFFFAOYSA-N	444.149	1.175	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2ccc3c(=O)n(C)c(S)nc3c2)cc(OC)c1OC	790082015	VRONCMIJZQOZQD-UHFFFAOYSA-N	444.469	1.323	50	20	IDGD	
O=C(CCNS(=O)(=O)c1c(Cl)cccc1Cl)NNc1nc2ccccn2n1	791262672	ZDDZCWVYZARCNB-UHFFFAOYSA-N	429.289	1.848	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(CCC(=O)NNC(=O)c2cccc(OC(F)F)c2)CC1	792136246	KQWAVRUOKSIHLX-UHFFFAOYSA-N	442.463	1.992	50	20	IDGD	
COc1cc(C(F)(F)F)ncc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccccc1F	792269244	OSPVEQZVLQGKBC-SECBINFHSA-N	444.341	1.802	50	20	IDGD	
Cc1ccc(-n2ncc(NC(=O)C(=O)NN[C@]3(C)CCS(=O)(=O)C3)c2C(C)C)cc1	792278560	SZGJTTZWNSJBAW-HXUWFJFHSA-N	433.534	1.441	50	20	IDGD	
CC(C)(C)OC(=O)CCc1cccc(NC(=O)C(=O)NNC(=O)Cc2ccccn2)c1	792355329	FXSBADLWWXKHEU-UHFFFAOYSA-N	426.473	1.685	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)c2cnn3c2C[C@@H](CNC(C)=O)CC3)cc1OC	792736958	TUNKGYSGGQEEHQ-AWEZNQCLSA-N	429.477	1.064	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)NC[C@H](Cc2cccc(F)c2)C(=O)N2CCOCC2)n1	793088749	PPSHEOJXVADVBQ-KRWDZBQOSA-N	443.479	1.191	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)c(C)cc1F	793399958	DWRPDFFTXHDTNV-UHFFFAOYSA-N	427.366	1.158	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)c2sccc2S(=O)(=O)N2CCSCC2)n1	794087273	ZOGIVSWNFIGMNJ-UHFFFAOYSA-N	426.545	1.264	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNS(=O)(=O)c1ccc(C(=O)O)c(Cl)c1	794598985	QSFTZBDVPBVCKO-UHFFFAOYSA-N	441.849	1.274	50	20	IDGD	
CC(C)CC(=O)N[C@@H](CC(N)=O)C(=O)NNC(=O)c1ccc(-c2ccc(F)cc2)s1	798154078	VDFHDVLENPYKEA-AWEZNQCLSA-N	434.493	1.722	50	20	IDGD	
CCOc1ccccc1CN1CCN(C(=O)NNC(=O)CNC(=O)c2ccco2)[C@@H](C)C1	799367960	OTDKNLUXHRCWKY-INIZCTEOSA-N	443.504	1.355	50	20	IDGD	
N#Cc1ccc(NNC(=O)C(=O)Nc2ccc(S(N)(=O)=O)cc2)c(C(F)(F)F)c1	799747576	BUXZJDFOKLRJHY-UHFFFAOYSA-N	427.364	1.306	50	20	IDGD	
Cc1ccc(C2=NO[C@@H](CNC(=O)NNc3ccc(S(=O)(=O)NC(C)C)cn3)C2)cc1	800754227	QWJXQVXTVKIFIA-MRXNPFEDSA-N	446.533	1.896	50	20	IDGD	
COCCOc1cncc(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c1	800797463	NZIYWWSCWUSLTI-UHFFFAOYSA-N	427.505	1.080	50	20	IDGD	
CC(C)[C@@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	802065460	AXLGDBVWQMHIME-CQSZACIVSA-N	428.511	1.792	50	20	IDGD	
O=C(NCCNS(=O)(=O)c1ccc(F)cc1Cl)NNc1cccc([N+](=O)[O-])c1	802430956	AZIZDZXBJRKKOD-UHFFFAOYSA-N	431.833	1.992	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)N[C@H](C)CCNS(=O)(=O)c2ccccc2)c1	802528420	YLZCJXDRBPHJRT-QGZVFWFLSA-N	448.545	1.770	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)C(C)(C)c2cc(F)cc(C#N)c2)cc1OC	803926281	SZRKTZJUCFBIMS-UHFFFAOYSA-N	443.431	1.997	50	20	IDGD	
Cc1nc(S(=O)(=O)N2CCC(C(=O)NNc3nccnc3C3CCC3)CC2)cn1C	805469199	OFARHUWIYJBYHB-UHFFFAOYSA-N	433.538	1.330	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)C(=O)Nc1ccc2nccnc2c1Br	806979869	JCABPSMVXIFXJL-UHFFFAOYSA-N	446.236	1.860	50	20	IDGD	
O=C(NCCNS(=O)(=O)c1ccc(F)cc1F)NNc1ccc2c(=O)[nH]ccc2c1	807208622	SVTIPPGOOHWLET-UHFFFAOYSA-N	437.428	1.411	50	20	IDGD	
CCn1nc(C(=O)NN=C2C(=O)N(CCN(C)C)c3ccccc32)c2ccccc2c1=O	807952816	OCSFITCESOZMSW-UHFFFAOYSA-N	432.484	1.459	50	20	IDGD	
CN(C)CCOc1ccc(/C=C\C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1	808371237	OZESCCQOKYGLBI-TWGQIWQCSA-N	438.532	1.494	50	20	IDGD	
N#Cc1ncn(-c2ccccc2NC(=O)C(=O)NNc2ccnc(Br)c2)n1	810396899	HAXBQAMALFVAJF-UHFFFAOYSA-N	427.222	1.378	50	20	IDGD	
O=C(NNC(=O)c1ccc[nH]1)c1csc(S(=O)(=O)N2CCc3ccccc3C2)c1	810545413	HMAXVMVRAMRCIK-UHFFFAOYSA-N	430.511	1.898	50	20	IDGD	
O=C(CN1CCN(CCOc2ccccc2Cl)CC1)NNC(=O)c1ccc(F)cc1	811930495	UJYAORWTKYYFNC-UHFFFAOYSA-N	434.899	1.937	50	20	IDGD	
Cc1nc(C(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)c(C)o1	814207007	OWAFVHOEYZVICP-UHFFFAOYSA-N	428.470	1.845	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)C3(C(C)=O)CC3)c2)cc1	814698218	VWKGLDDNRFPZLA-UHFFFAOYSA-N	431.470	1.626	50	20	IDGD	
O=C(NNC(=O)c1cccnc1)C(=O)Nc1ccc2c(c1)N(C(=O)Cc1ccccc1)CC2	815563465	CZSFFUKRUKZFBR-UHFFFAOYSA-N	443.463	1.613	50	20	IDGD	
CCc1cccc(Oc2ccc(NC(=O)C(=O)NNC(=O)[C@@H]3CCc4nncn4C3)cn2)c1	815692164	KYBXHIWXXCPPRJ-OAHLLOKOSA-N	449.471	1.376	50	20	IDGD	
COC(=O)c1cc(NNC(=O)c2cc(-c3ccco3)nc3c(C(N)=O)ncn23)ccc1C	816689229	YRHJIZQEZKBYAX-UHFFFAOYSA-N	434.412	1.940	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCc2nn[nH]c21)c1nc(-c2ccccc2)n(-c2ccccc2)n1	816828459	GKWBREOBQZPUNH-MRXNPFEDSA-N	428.456	1.934	50	20	IDGD	
O=C(CN1CCCC1=O)NNC(=O)C1CCN(C(=O)c2ccc(C(F)(F)F)cc2)CC1	818032010	FQFHLMUXAULJLH-UHFFFAOYSA-N	440.422	1.327	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)CNS(=O)(=O)c2ccc(C)c(C)c2)cc1	912842405	BWLQGZPHVUPPOP-MRXNPFEDSA-N	449.529	1.595	50	20	IDGD	
Cc1ccc(C)c(N2N=C(C(=O)NNC(=O)CCN3C[C@@H](C)O[C@H](C)C3)CCC2=O)c1	912919881	SGOYBLALYREDDQ-IAGOWNOFSA-N	429.521	1.433	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccccc1F)NNC(=O)c1cc2c(s1)CCCCC2	913403990	CCXPHQFKPDMKKP-UHFFFAOYSA-N	425.507	1.896	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C[C@H](NC(N)=O)c2cccc(C)c2)c2ccccc2c1=O	913632680	OFAIPUAWYTXWFI-KRWDZBQOSA-N	436.472	1.286	50	20	IDGD	
CS(=O)(=O)NCCNC(=O)C(=O)Nc1ccccc1S[C@H](Cl)C(F)(F)F	915756788	DMVDPERLMOSKGX-LBPRGKRZSA-N	433.861	1.510	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)NC[C@@H](c1cccs1)N1CCN(C)CC1	915902140	QDRZQQFNTMLXCG-WBVHZDCISA-N	449.552	1.974	50	20	IDGD	
N#Cc1cccc(OCC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1	916092330	DHAOMRYIGOWKSB-UHFFFAOYSA-N	428.470	1.183	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)NCCS(=O)(=O)NC(C)(C)C	916622239	BNGTVRHZHAVUKC-AWEZNQCLSA-N	436.534	1.655	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2ccc3c(c2)S(=O)(=O)N(C2CC2)C3=O)cc1OC	916743386	BECANNUVGVLDCG-UHFFFAOYSA-N	445.453	1.086	50	20	IDGD	
CCCn1c(C)cc(/C=C(\C#N)C(=O)OCC(=O)N2CCN(CC(=O)N(C)C)CC2)c1C	917226948	VRCWCOYMAAADLW-DEDYPNTBSA-N	443.548	1.198	50	20	IDGD	
CS(=O)(=O)c1ccc(Cl)c(S(=O)(=O)NNC(=O)c2ccc(Cl)cc2O)c1	917758067	NOTHSYLMXKUFKK-UHFFFAOYSA-N	439.298	1.726	50	20	IDGD	
CCS(=O)(=O)N1CCC[C@H](C(=O)NNC(=O)c2ccc(OCCC(C)C)cc2)C1	918552511	WEJPGSDPYOIIPF-KRWDZBQOSA-N	425.551	1.934	50	20	IDGD	
Cc1ccc(C(=O)N2CCN(C(=O)NNC(=O)c3c(C)nc4ccccn34)CC2)cc1F	918776657	VQIOCMREAHPCNE-UHFFFAOYSA-N	438.463	1.903	50	20	IDGD	
O=C(CNC(=O)c1cc(F)cc(F)c1)NNC(=O)COc1ccc(Br)cc1	919962554	MMWRHULSFLWWTG-UHFFFAOYSA-N	442.216	1.684	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)[C@H]2CC(=O)N(c3ccc(OC)cc3)C2)o1	920249030	ZFZVSMVJLGLPRF-HNNXBMFYSA-N	428.489	1.944	50	20	IDGD	
COc1cc(C=NNC(=O)N[C@@H]2CCS(=O)(=O)C2)ccc1OCc1c(C)noc1C	920384240	JQTIGKUKVYGDMP-OAHLLOKOSA-N	436.490	1.699	50	20	IDGD	
COc1ccc(CNC(C)=O)cc1S(=O)(=O)NNC(=O)NCCc1cccs1	920833917	DLDIMPPLJJNFMB-UHFFFAOYSA-N	426.520	1.128	50	20	IDGD	
N#C/C(=C/c1cn(CCC(N)=O)nc1-c1ccc(Br)cc1)C(=O)NCCO	920847392	DEFXTBCGPOPRIK-LCYFTJDESA-N	432.278	1.203	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)NC[C@@H](c2cccc(F)c2)N2CCOCC2)c1	921201431	NTFUGDBFWDSKAL-FQEVSTJZSA-N	430.480	1.917	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)C23C[C@H]4C[C@@H](CC(O)(C4)C2)C3)cc1	1115818990	ZRYZODHWBFYAIA-AJHHTPGJSA-N	435.546	1.094	50	20	IDGD	
CC(C)[C@@H](CNC(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1)N1CCOCC1	1116091461	GBILWZJRZAQTNH-QGZVFWFLSA-N	441.573	1.321	50	20	IDGD	
CO[C@@H](C)c1nc(CNC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)cs1	1252692333	WULGJMFHIUUEIX-JTQLQIEISA-N	427.508	1.790	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)c1n[nH]cc1I	1255031030	DQFSXQHFWZCHMA-UHFFFAOYSA-N	438.229	1.388	50	20	IDGD	
CCOCCCn1c(NNC(=O)[C@@H]2CC23CCS(=O)(=O)CC3)nc2ccccc2c1=O	1259651830	LDXWFQKDBAAYNH-INIZCTEOSA-N	448.545	1.481	50	20	IDGD	
CNC(=O)c1cccc(CNC(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)c1	1318922065	WVHIBUOJUFWPJE-UHFFFAOYSA-N	433.509	1.524	50	20	IDGD	
CNC(=O)c1ccc(NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)c(C)c1	1320124682	MFZHNHSCVYTRQR-UHFFFAOYSA-N	447.517	1.136	50	20	IDGD	
COCc1oncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Br)C2	1778344248	UBLWWXIBVPNCME-CKEIUWERSA-N	448.289	1.639	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnn3ccncc23)C1	1778685292	RDWWHFBBWSQDDX-XAUMDUMWSA-N	435.912	1.111	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(CCN(C(=O)c3cnc4snnc4c3)C2)C1	1780069952	NKAPFEMUGOEAHS-MRXNPFEDSA-N	440.323	1.315	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(OC)cc(OC)c3F)C2)C1	1780132515	JDQDEAXFWBVXTR-QRWLVFNGSA-N	444.887	1.540	50	20	IDGD	
CC(C)n1ccc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)n1	1780376887	IJRLMOZZXUUBCI-KSSFIOAISA-N	427.343	1.939	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)c(O)c1	1780551507	YGNFJDCELDCGGO-YJYMSZOUSA-N	441.322	1.875	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc3c(n1)OCCO3)C2	1780702789	SGVUWBWTJMNCKG-AVBTWRTFSA-N	437.924	1.998	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Br)C1)n1ccnc1	1780770414	NAADIMZLMLJKEZ-VMUDFCTBSA-N	431.306	1.649	50	20	IDGD	
C[C@H](NC(=O)c1ccc(F)cc1)C(=O)N1CC[C@]2(CN(C(=O)C(Cl)Cl)CCO2)C1	1780907413	YJIIKPAGYLRVQE-HXPMCKFVSA-N	446.306	1.578	50	20	IDGD	
O=C(CCc1ccc(F)nc1)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781325569	FODQDLSJPFHBBL-NVXWUHKLSA-N	432.265	1.674	50	20	IDGD	
O=C(c1cnc2ccoc2c1)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781332056	YRQZYPSYZURWFM-WMLDXEAASA-N	426.242	1.962	50	20	IDGD	
C[C@H](Cc1ccncc1)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781335098	VSCIPYBPAQTREG-SIIHOXLZSA-N	428.302	1.781	50	20	IDGD	
CCOC(=O)C(C)(C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)Br)C1	1782001295	DAXGQXULGCGNSJ-IQUTYRLHSA-N	447.370	1.873	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(CCN(C(=O)c3ccc(C4CC4)cc3)C2)C1	1782020587	MRVVXWYVYBVDDK-XMMPIXPASA-N	434.301	1.001	50	20	IDGD	
CN1CCC[C@H]1C(=O)N1CCO[C@@]2(CCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1	1782864120	QXPAGRCIUMKGGO-QMMMIWPZSA-N	444.482	1.796	50	20	IDGD	
CCOc1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](Br)CC)C3)C2)nn1	1783353705	ZGAKVGHGUZYFAD-UGSOOPFHSA-N	441.326	1.492	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)CNc3ccc(F)cc3)CCO2)C1	1783532855	OIRJQCHHRDMAJH-FZKQIMNGSA-N	428.302	1.851	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](C)Br)C2)C1	1783534725	NQNBGYPKVXALRG-YJYMSZOUSA-N	435.322	1.870	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)CNC(=O)OC(C)(C)C)CCO2)C1	1783538430	CQXZNOFDKFYMMK-SJKOYZFVSA-N	434.331	1.124	50	20	IDGD	
COc1cc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](C)Br)C3)C2)cc(Cl)n1	1783538759	VPRXDBWWEDATFT-GTNSWQLSSA-N	446.729	1.971	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3N(C)C)[C@H]2C1	1785758736	GZACSXPYHAOWPQ-RMRKRWHISA-N	439.354	1.524	50	20	IDGD	
COc1ncccc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21	1786011059	LWHZHVPBLROFMB-DOERSZECSA-N	430.274	1.374	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3(Br)CC3)C[C@@H]21	1786408886	JBMASUMLQAMFJK-SRVKXCTJSA-N	438.160	1.679	50	20	IDGD	
COc1ccc([N+](=O)[O-])c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Cl)C[C@@H]32)n1	1787750868	URTAKRMIYLPPRG-OUCVZQCGSA-N	430.820	1.126	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC1(c2ccc(NC(=O)CCSC(=N)N)cc2)CCC1	1788022924	VZPDMYVGSSHFGZ-UHFFFAOYSA-N	434.566	1.510	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccn4ccnc34)[C@H]2C1	1788368602	DGHKSIDFSGVLQO-SDADXPQNSA-N	435.322	1.711	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3CCCN(C)C3)[C@H]2C1	1789744970	KUVOSIPREQSAGK-XAJHFOFHSA-N	430.387	1.481	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)Cn3cccn3)C[C@@H]21	1790960795	GGGYHMQMFPUWKP-XAJHFOFHSA-N	441.370	1.672	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(OC(F)F)cn3)C[C@@H]21	1791252946	ZMBZLEJNQZTYCT-ZIEJDFEHSA-N	447.866	1.530	50	20	IDGD	
C[C@H](Br)C(=O)NC1(c2ccc(NC(=O)CN3C(=O)C=CC3=O)cc2)CCC1	1791694932	XVRMYSKWFJFXBQ-LBPRGKRZSA-N	434.290	1.829	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(C2CC2)on1	1792703048	ICTCTJUHPMLYCG-YGSHXTJESA-N	426.311	1.786	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CCN1C(=O)OC(C)(C)C	1793630885	XNMHZRXCOOFITM-QEOTZNIISA-N	443.972	1.993	50	20	IDGD	
CC(C)c1nc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)CBr)C3)no1	1793995990	DDCKDDXCZDOKOV-NFFDBFGFSA-N	443.342	1.356	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Cl	1796368906	RSVVNUFBTSEJIJ-XLWJZTARSA-N	433.908	1.510	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1(C)CCCCC1)C2	1796446412	VEBVTYIBHWCULJ-BRTCSPBQSA-N	443.548	1.680	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(C)nn1-c1ccccc1	1796475175	VXDWVSRAWLNVGK-WQDJSCAQSA-N	446.935	1.638	50	20	IDGD	
C[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](O)CCl)C2	1797925557	JFAFRINMVHEXEA-WBAHDQRJSA-N	443.972	1.727	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1[nH]cnc1-c1cccnc1	1798495249	QLFGOYIXSCDHFP-ALXJQNPVSA-N	443.580	1.526	50	20	IDGD	
CC(=O)Nc1ccc(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CCC(=O)NN(C)C)cc1	1802336598	OMGKRFTYSDNIIF-ACDBMABISA-N	443.548	1.199	50	20	IDGD	
COc1cccc2[nH]cc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)CCC(=O)NN(C)C)c12	1802338000	HAQPUOKTWVEOBD-MUJYYYPQSA-N	441.532	1.801	50	20	IDGD	
CC(C)(CCl)C(=O)NC[C@H]1CCN(C(=O)CNCP(=O)(O)O)[C@H]1c1cccnc1	1802900324	VDBPCMLWWRRQLS-ZBFHGGJFSA-N	446.872	1.077	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)CC(N)=O)[C@@H]1c1cccnc1	1803011099	NEFYQZZOPRGVPE-UICACZKSSA-N	439.354	1.630	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@H]1CCN(C(=O)c2cnc(O)[nH]2)[C@@H]1c1cccnc1	1803013213	BDSYFSFNIKEPGY-UXIGCNINSA-N	436.310	1.861	50	20	IDGD	
C[C@H](CS(C)(=O)=O)C(=O)NC[C@H]1CCN(C(=O)C(Cl)Cl)[C@@H]1c1cccnc1	1803591776	XLZIBYFJRHOPAY-MRVWCRGKSA-N	436.361	1.572	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)[C@H](C)Cn2cccn2)[C@H]1c1cccnc1	1804724002	YWHFJTUJGMVNPA-OQIJWPOYSA-N	433.940	1.874	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2cccn2C)[C@H]1c1cccnc1	1805358960	SBHNGDHPYIITLY-DYESRHJHSA-N	426.521	1.113	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)s1	1807363696	PPWPKVMVMBRKLD-GHTZIAJQSA-N	449.341	1.765	50	20	IDGD	
Cc1ccc(C(=O)N2CCC3(CCCN(C(=O)c4ccc(B(O)O)cc4)C3)CC2)nc1C	1809967738	JGTPNJYPDRLTNX-UHFFFAOYSA-N	435.333	1.537	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)c3cc(C4CC4)on3)CC2)C1	1809968255	TUSLOKWZYLHJCU-UHFFFAOYSA-N	437.305	1.390	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2ccccc2C(N)=O)[C@H]1c1cccnc1	1813034130	BLFZGLFWTUIKMD-MNEFBYGVSA-N	444.919	1.754	50	20	IDGD	
O=C1NCc2cc(C(=O)N3CCCC[C@H]3c3cc(NC(=O)[C@@H](O)CCl)n[nH]3)ccc21	1814872378	HINBJRRQMHFOMC-HOTGVXAUSA-N	431.880	1.559	50	20	IDGD	
Cc1cc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)ccn1	1815360861	PQUPSXSBAULPQI-MRXNPFEDSA-N	436.302	1.066	50	20	IDGD	
Cc1c(C(=O)Nc2cc([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)cnn1C	1816565120	JDTIQVCFOMZFJH-MRXNPFEDSA-N	430.513	1.131	50	20	IDGD	
COC[C@H](NC(C)=O)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCBr)n[nH]1	1816782745	YRSRTOZCEPMTHZ-UONOGXRCSA-N	444.330	1.338	50	20	IDGD	
CCC(=O)C(=O)N[C@H]1CCc2nc(NC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)sc2C1	1817282790	MEGXCPQLYNTGTB-QPDIMOPTSA-N	430.490	1.168	50	20	IDGD	
Cc1nc2ncccn2c1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)CCl)CC2	1818389250	QVPNCGVLMHOYDF-PWSUYJOCSA-N	434.909	1.320	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1)[C@@H]1ON=C(c2ccccc2)O1	1819296595	VISWEHQETHBJAF-AVYPCKFXSA-N	447.879	1.736	50	20	IDGD	
COC[C@H](NC(C)=O)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@](C)(Cl)CCl)[nH]n1	1819611685	KTVGTWYSZUWZMA-DEYYWGMASA-N	448.351	1.789	50	20	IDGD	
N#CC1(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cnccc4C(=O)NN)sc3C2)CCC1	1819800907	CUQUJRCVYQGTKM-LLVKDONJSA-N	439.501	1.061	50	20	IDGD	
Cc1cc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)c(C)n1C	1820058914	DURDITBIGKBPNV-HXUWFJFHSA-N	449.320	1.665	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1)c1cnc2snnc2c1	1820150778	PSGFQAPCCCNZMA-QWHCGFSZSA-N	435.897	1.715	50	20	IDGD	
C[Si](C)(C)OCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCSC(=N)N)CC2	1820162709	MUTIWLDPFYJYKB-SNVBAGLBSA-N	429.644	1.923	50	20	IDGD	
C[Si](C)(C)OCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](N)Cc1cccnc1)CC2	1820164773	IHLCQSGCLIFBGU-GJZGRUSLSA-N	447.637	1.872	50	20	IDGD	
CN1C(=O)CC[C@H]1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](F)Br)n[nH]1	1820939400	HVRAUBGOPCLMQS-UHIISALHSA-N	430.278	1.713	50	20	IDGD	
CC(=O)N/C(=C\c1ccco1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1	1821223523	WQEZMHFPSURPRU-CBNFBOEASA-N	449.895	1.772	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](C)Br)n[nH]1	1822186763	IWKKTMYJNSGWLK-NHCYSSNCSA-N	429.319	1.632	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cncc(F)c2)[nH]n1	1822412865	IBCHUYYTHYCFPF-INIZCTEOSA-N	431.472	1.623	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(F)n2)[nH]n1	1822414869	MJAWHZDVWHKYNO-OAHLLOKOSA-N	431.472	1.623	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(O)nc(O)n1)CC2	1822863065	FRQLIIBPDZHTBB-HYORBCNSSA-N	446.316	1.806	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H](O)CCl)CC1	1824186009	NLZPQRQBRCGYKI-ZSYWTGECSA-N	440.968	1.961	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@H]1CCc2nc(NC(=O)CN3CCCCC3=O)sc2C1	1825864105	DWXPYVFZHYRPMW-ZDUSSCGKSA-N	438.626	1.919	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](N)Cc1cscn1)CC2	1825998874	OEDGYKUPASJWSV-USWWRNFRSA-N	443.982	1.335	50	20	IDGD	
O=C(c1cccs1)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827051484	ZAJKRWLKLPOAJK-LJQANCHMSA-N	426.347	1.975	50	20	IDGD	
O=C(C1CCOCC1)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827055240	VTHFYGVQTHMMJF-NRFANRHFSA-N	428.338	1.026	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)COc3ccccc3F)C2)C1	1830365149	BCMNEBYGQXANLJ-NRFANRHFSA-N	442.915	1.926	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccnc4ncccc34)C2)C1	1830366306	PEGMERWKIXYIPN-QFIPXVFZSA-N	446.935	1.965	50	20	IDGD	
Cc1noc(CC(=O)N2CCC(N3CCC(NC(=O)C(C)(C)CCl)CC3)CC2)n1	1833214383	VPGOHJIWRKABJM-UHFFFAOYSA-N	425.961	1.757	50	20	IDGD	
COc1cc(C)cc(C(=O)N2CCC(N3CCC(NC(=O)[C@H](O)CCl)CC3)CC2)c1	1833313303	FTEDOMBHFZWPJH-HXUWFJFHSA-N	437.968	1.789	50	20	IDGD	
O=C([C@H](O)CCl)N1CCC(N2CCC(NC(=O)C3(c4ccc(O)cc4)CC3)CC2)CC1	1833328975	OKJGGYKBUBDSMK-HXUWFJFHSA-N	449.979	1.595	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](F)Cl)CC2)CC1)[C@H]1Cc2ccccc2CN1	1835085233	ZSVGVDQVXQFNNS-WOJBJXKFSA-N	436.959	1.807	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@H](C)N3C[C@@H]4C[C@H]4C3)CC2)CC1	1835676415	DAZIZPMTKZUMNT-BOSXTWCSSA-N	441.016	1.152	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)/C=C/c3cc(C)on3)CCO2)C1	1837552324	KQIBLCQHTZJVPZ-HOQHSMRBSA-N	425.913	1.860	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(-c4cccnc4)[nH]n3)CCO2)C1	1838031043	IADGNPGFDLMQJF-IIBYNOLFSA-N	447.923	1.559	50	20	IDGD	
Cc1ccc(OC(C)(C)C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)nc1	1839052851	PYVXOYFIGXJZKG-OXQOHEQNSA-N	443.903	1.538	50	20	IDGD	
Cc1nccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)n1	1839152586	FAPHAXCKVLBWBT-MSOLQXFVSA-N	431.320	1.091	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccnc4ncccc34)CCO2)C1	1839542628	ADSKEWJJHAZXJC-UTKZUKDTSA-N	432.908	1.717	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cc(F)ccc3F)C2)C1	1840155662	CCNXTZDAJKTKKU-UZLBHIALSA-N	446.878	1.218	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(F)cc3C)CCO2)C1	1840778468	BRVYBRVMXJOGPU-YLJYHZDGSA-N	428.888	1.458	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)c2c(C)nn(-c3ccccc3)c2O)C1	1842194957	ZKIWVRXNZLGZKZ-INIZCTEOSA-N	432.908	1.957	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)c1cncc(O)c1)C2	1844693174	FPJMHGUKUNRXQF-UHFFFAOYSA-N	440.412	1.752	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCCC12CN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2	1846070090	OEYQUXDNZHWSSA-LNOXHEFASA-N	438.326	1.497	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@H]1CN(Cc3ccccc3)CCO1)C2	1846362444	FCZPYJUPGLEBCD-RTBURBONSA-N	435.952	1.345	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](O)CCl)C1	1847563577	KQCMWFXLFCPTRO-UGUYLWEFSA-N	429.945	1.435	50	20	IDGD	
Cc1ncc(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)cn1	1848095634	HTDVKUQREOUZAM-JYJNAYRXSA-N	437.928	1.733	50	20	IDGD	
COc1ccc(Cc2nnc(SCC(=O)NNC(=O)c3ccc(F)cc3)n2N)cc1	10921192	CLOMZWHHPSOQDO-UHFFFAOYSA-N	430.465	1.284	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)C[C@@H](NC(N)=O)c2cccs2)c2ccccc2c1=O	14044653	LMRAYKHLZGSZGQ-CQSZACIVSA-N	442.501	1.600	50	20	IDGD	
O=C(Cc1csc(N2CCOCC2)n1)NNC(=S)NCCSc1ccccc1	18139024	DBEKCZHDXKHXTP-UHFFFAOYSA-N	437.616	1.810	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)[C@@H]1CS[C@]2(C)CCC(=O)N12	21957790	OQCNQOWNBLABKX-KPZWWZAWSA-N	441.893	1.107	50	20	IDGD	
CC(C)(C)NC(=S)NNC(=O)CCn1cnc2ccc(Br)cc2c1=O	28716991	NOHCLGZRNZAXLK-UHFFFAOYSA-N	426.340	1.843	50	20	IDGD	
COCC[C@H](C)NC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	726260229	ABXHWNALGSUSRE-HNNXBMFYSA-N	434.518	1.534	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)[C@H]1CC(=O)N(Cc2ccc(OC)cc2)C1	726522489	MPCUHISSLAQGJE-KRWDZBQOSA-N	449.511	1.803	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)N[C@@H](CN2CCN(C)CC2)c2ccccc2)c1	727843787	SUPVKUAOUGZNOP-NRFANRHFSA-N	425.533	1.693	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2c(Cl)nc3sccn23)cc(OC)c1OC	728501612	PLSZZJCHKLGJGR-UHFFFAOYSA-N	446.894	1.698	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2cc3sc(N(C)C)nc3s2)n1	728729050	GGQNMHVBJKSCBI-UHFFFAOYSA-N	439.544	1.736	50	20	IDGD	
COc1ccc(-n2cnnc2SCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cn1	728794781	OBPUIECCGPJQJN-UHFFFAOYSA-N	429.418	1.132	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)[C@@H]1C[C@@H](O)CN1C(=O)OCc1ccccc1	729511523	KWFROXUFCUQAIS-SJORKVTESA-N	437.456	1.176	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)[C@H]2CSCN2C(=O)CC(C)(C)C)n1	730325919	CGFBAFDLEIGBPG-GFCCVEGCSA-N	442.563	1.022	50	20	IDGD	
Cc1cc(C=NNC(=O)CSc2nn(C)c(=O)n(C)c2=O)c(C)n1C1CCCCC1	730571852	UZHNSDRERYAJTN-UHFFFAOYSA-N	432.550	1.645	50	20	IDGD	
COc1cc2ncn(CCCC(=O)NNC(=O)Cc3ccccc3F)c(=O)c2cc1OC	731328777	GEXFNLJUIDVTIT-UHFFFAOYSA-N	442.447	1.723	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN(C)[C@@H](C)CNC(=O)OC(C)(C)C	732207755	KZRGULSMTPJKTJ-LBPRGKRZSA-N	428.917	1.955	50	20	IDGD	
CCOCCCn1c(NNC(=O)c2ccc(-n3ccnc3)nn2)nc2ccccc2c1=O	733266873	OTBQLEBRYDGVAF-UHFFFAOYSA-N	434.460	1.556	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)CC[C@@H]2NC(=O)N(c3ccc(C#N)cc3)C2=O)c1	733775067	XDDQUZSPZXYNFI-IBGZPJMESA-N	449.467	1.607	50	20	IDGD	
COc1cccc(OCCCNC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c1	739038721	JXZYLFJKAQFNIM-UHFFFAOYSA-N	425.445	1.355	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)c1cn(-c2cccc(C(F)(F)F)c2)nn1	739474256	QSLKOFHILVNRKV-INIZCTEOSA-N	433.346	1.887	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCN(Cc3nc4ccccc4s3)CC2)n1	741213195	WHILGPJXSIDBPD-UHFFFAOYSA-N	444.586	1.569	50	20	IDGD	
Cc1nn(C)c2sc(C(=O)N[C@@H](C)C(=O)NNc3nc4ccccc4c(=O)n3C)cc12	742075574	CVBIWLDAAKUOJT-NSHDSACASA-N	439.501	1.452	50	20	IDGD	
COCCNC(=O)C1CCN(C(=O)NNC(=O)c2cccc(Br)c2)CC1	743687370	PIRBCQINOXNNTD-UHFFFAOYSA-N	427.299	1.278	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@H]2CC(=O)N(c3ccccc3F)C2)cc1	743829753	CXGXQAJNVNYJAO-LBPRGKRZSA-N	434.449	1.435	50	20	IDGD	
Cc1ccc(-n2nnc(C(=O)NNC(=O)Nc3ccc(S(C)(=O)=O)cc3)c2C)cc1	743830612	IGTJCLUBYUXCKW-UHFFFAOYSA-N	428.474	1.754	50	20	IDGD	
Cc1ccc(N2C[C@H](C(=O)NNC(=O)Nc3ccc(S(C)(=O)=O)cc3)CC2=O)cc1F	743830973	NXCHBYKBHLKTKV-CYBMUJFWSA-N	448.476	1.743	50	20	IDGD	
O=C(CN1C(=O)[C@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O)Oc1ccc([N+](=O)[O-])cc1Br	744168128	IZLTUABMXVCFPK-RFHZTLPTSA-N	425.191	1.425	50	20	IDGD	
CN(CC(=O)NNC(=O)c1ccc(C#N)cc1)CC(=O)Nc1ccccc1Br	744383614	SXWXFAIBIVPSEU-UHFFFAOYSA-N	444.289	1.652	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1ccc(-c2ccco2)nc1O	744621677	YEOUGHIKBOZNRL-UHFFFAOYSA-N	444.469	1.825	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@@H]2CCN(Cc3ccccc3)C2=O)c2ccccc2c1=O	744878183	QOIHTTHGOOFOPY-GOSISDBHSA-N	448.483	1.162	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)[C@H](c2ccccc2)N2CCC(O)CC2)cc1	744964427	RQZGXLTYFAALOC-NRFANRHFSA-N	436.468	1.060	50	20	IDGD	
CCO[C@@H]1C[C@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)C12CCCC2	745918009	MQYQAHMUMUSGBJ-DLBZAZTESA-N	438.550	1.619	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2c(Cl)cccc2Cl)cc(S(N)(=O)=O)cc1[N+](=O)[O-]	746210619	QNVUYJDSFYXZPB-UHFFFAOYSA-N	447.256	1.932	50	20	IDGD	
Cc1noc(C(F)(F)F)c1C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	746331799	JNAKFUVRBJNOBU-UHFFFAOYSA-N	434.396	1.780	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)c1cc(Br)cc(S(N)(=O)=O)c1C	747385574	BQRJTNMKDSJZLO-UHFFFAOYSA-N	442.291	1.488	50	20	IDGD	
Cc1nc(Cl)cc(NNC(=O)c2ccc(S(=O)(=O)N3C[C@H](C)O[C@@H](C)C3)cc2)n1	747982921	GBQMMTVNKUEQLR-RYUDHWBXSA-N	439.925	1.993	50	20	IDGD	
O=C(Cn1c(=O)ccn(Cc2ccccc2)c1=O)NNc1ccccc1Br	748066174	LYFDOOXTJMOQQS-UHFFFAOYSA-N	429.274	1.964	50	20	IDGD	
N#CCCCS(=O)(=O)c1ccc(C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1	748163086	ZLMOFDLGEZZGII-SFHVURJKSA-N	429.454	1.365	50	20	IDGD	
CCC[C@H](NC(=O)NNC(=O)[C@@H](C)OCCOC)C(=O)N1CCc2sccc2C1	748633476	ZBGNLLOLCFNCRY-HIFRSBDPSA-N	426.539	1.183	50	20	IDGD	
CN1CC[C@H](C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)c2ccccc21	750778880	ILHRZDJMXMYSEF-KRWDZBQOSA-N	430.530	1.774	50	20	IDGD	
COc1cc(N2C[C@H](C(=O)NNC(=S)N[C@H](C)C3CC3)CC2=O)cc(OC)c1OC	751619189	LIIYNHHENBBHPL-DGCLKSJQSA-N	436.534	1.359	50	20	IDGD	
O=C(CC12CC3CC(CC(C3)C1)C2)NNC(=O)NC1CCN(S(=O)(=O)C2CC2)CC1	753964676	AHPOHMZSIGAIAS-UHFFFAOYSA-N	438.594	1.880	50	20	IDGD	
CN(C)c1ccc(S(=O)(=O)N(C)C)cc1NC(=O)NNC(=O)c1ccc(C#N)cc1	755531972	LCGTXBNWSXWHFW-UHFFFAOYSA-N	430.490	1.341	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)Nc1ccccc1C(=O)N1CCN(C)CC1	755625352	YWFONPGUVAYARE-HNNXBMFYSA-N	443.479	1.834	50	20	IDGD	
O=C(COc1cccc(C(F)(F)F)c1)NNC(=O)Nc1cnn(CC(=O)NC2CC2)c1	756796960	SITQXOSRHQUOOC-UHFFFAOYSA-N	440.382	1.412	50	20	IDGD	
CC[C@H]1CC[C@H](C(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)O1	756901019	GCMHWGCIPWASIP-PKOBYXMFSA-N	431.514	1.884	50	20	IDGD	
CCO[C@@H]1C[C@@H](NC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)[C@]12CCCO2	759322812	QYFFVWBKKBCGIB-IIDMSEBBSA-N	426.495	1.152	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)Cc2ccc(S(=O)(=O)NCC)cc2)cc1OC	759358686	YIXZQDDAOJVHIW-UHFFFAOYSA-N	449.529	1.786	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)Nc1cccc(S(=O)(=O)Nc2ccccc2)c1	760947415	JBTOBKSLTFJUSG-AWEZNQCLSA-N	436.490	1.692	50	20	IDGD	
CNC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)c2cc3ccccc3cc2O)cc1	763527101	MBFQZCRFTZBNKX-UHFFFAOYSA-N	436.424	1.070	50	20	IDGD	
Cn1ccc2c(NC(=O)C(=O)NNC(=O)CCN3CCN(c4ccccc4)CC3)cccc21	763530291	HHSMZWLYXANUDF-UHFFFAOYSA-N	448.527	1.477	50	20	IDGD	
Cc1cc(Oc2ncccn2)ccc1NC(=O)C(=O)NNC(=O)[C@@H]1COc2ccccc2O1	763571802	OTJJBRIOAFOPGC-SFHVURJKSA-N	449.423	1.503	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cccc(OCC(=O)N3CCCC3)c2)c(C)o1	763576139	GLXVVYWEIUKMEI-UHFFFAOYSA-N	428.445	1.297	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)C(=O)Nc1ccc([S@@](=O)C(F)(F)F)cc1	763682205	ZBYVQAYXNGTDTG-SSEXGKCCSA-N	447.366	1.618	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)c3nccn3C)cc2)c1	763754034	KMVMQGLSLUPPAM-UHFFFAOYSA-N	434.456	1.117	50	20	IDGD	
COC(=O)c1cc2cc(NC(=O)C(=O)NNC(=O)c3cc(OC)cc(OC)c3)ccc2o1	763773451	XTFKNDRFTZHKHM-UHFFFAOYSA-N	441.396	1.636	50	20	IDGD	
COc1cc(Br)cc(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)c1	763806906	IBRHSPPZSWZGJQ-UHFFFAOYSA-N	447.245	1.494	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)[C@@H]1CCCN(C(=O)c2ccc(Cl)cc2)C1	763824141	GIUMYAPZRKHCGU-MRXNPFEDSA-N	443.891	1.165	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)C[C@H](NC(=O)c1ccccc1)c1ccccc1	763825522	QZLHBAMHHOTPHZ-FQEVSTJZSA-N	445.479	1.520	50	20	IDGD	
CO[C@@H](C)C(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)Cc2c[nH]c3ccccc23)c1	763860599	KAWZFEQSTNLNLX-ZDUSSCGKSA-N	437.456	1.470	50	20	IDGD	
COC(=O)c1cc(Cl)cc(NC(=O)C(=O)NNC(=O)Cc2c[nH]c3ccccc23)c1	763861490	RIXQHPIAFNEPSZ-UHFFFAOYSA-N	428.832	1.937	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cc(C)n([C@H](C)C3CC3)n2)cc1	763878635	SDGAJNFZTDLJIN-UKRRQHHQSA-N	441.488	1.919	50	20	IDGD	
CCCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)Cn2nc(C)cc2C)cc1Cl	763885605	NGNBWUDUWVSGBI-UHFFFAOYSA-N	434.884	1.079	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)C(=O)Nc2ccc(C(=O)N(C)C)c(C)c2)cc1	763890573	BYLIWRDDLYOKAA-UHFFFAOYSA-N	428.514	1.883	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1OCC(F)F	763917171	QNLRZFNKAODMTC-UHFFFAOYSA-N	445.386	1.014	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccc3ccccc3c2)cc1S(N)(=O)=O	764083388	BQTUCCNXNYNDGC-UHFFFAOYSA-N	440.481	1.124	50	20	IDGD	
O=C1C[C@@H](c2cccc(NC(=O)C(=O)NNC(=O)Cc3ccc4ccccc4c3)c2)CN1	764084231	IXXBXSYFRLZQSI-LJQANCHMSA-N	430.464	1.772	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)C(=O)Nc1cc(F)c(F)cc1Cl	764260891	SQAXXRNDFXUDAU-UHFFFAOYSA-N	438.822	1.411	50	20	IDGD	
CCOCC(=O)NNC(=O)C(=O)Nc1ccc(CCn2cc(Br)cn2)cc1	764325548	OHMSOBBNNAMFGK-UHFFFAOYSA-N	438.282	1.011	50	20	IDGD	
CCOCC(=O)NNC(=O)C(=O)Nc1cccc(Oc2ncc(Br)cn2)c1	764325607	PPKASMWRKKRHQR-UHFFFAOYSA-N	438.238	1.154	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F	764367076	SZHFOIRAFMTXQQ-UHFFFAOYSA-N	438.343	1.499	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)N2CCCc3ccc(F)cc32)n[nH]1	764378422	ZSEUUFPLWXQOCM-UHFFFAOYSA-N	437.431	1.965	50	20	IDGD	
Cc1nc(-c2cccc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc3ccccc3)c2)no1	764380303	UVJVTIMVFZFAKZ-UHFFFAOYSA-N	431.355	1.803	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1c(C)cc(Br)cc1Cl	764397153	GJXYSWHOEYDFOW-SECBINFHSA-N	436.690	1.548	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2cc3c4c(c2)CC(=O)N4CCC3)cc1OC	764931141	ABLYPMAJZBINPL-UHFFFAOYSA-N	431.470	1.162	50	20	IDGD	
CC(=O)NNC(=O)Nc1cc(S(=O)(=O)N2CCOCC2)ccc1Oc1ccccc1	765111437	HEHWXCXDEGKGRN-UHFFFAOYSA-N	434.474	1.672	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)[C@H]1CCN(c2ccc3c(c2)OCCO3)C1=O	765250686	HNEHMWSPSBIODO-CQSZACIVSA-N	443.481	1.456	50	20	IDGD	
O=C(C[C@H]1OCCc2ccccc21)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765733619	NYPGEHHTICQZPS-OAQYLSRUSA-N	436.512	1.296	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)c1ccccc1[N+](=O)[O-]	765755213	PJFPGQQLRWYDDA-UHFFFAOYSA-N	431.880	1.827	50	20	IDGD	
CN(C)[C@@H](C(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1)c1ccccc1	766664448	QRMPXQSYZITDAK-JOCHJYFZSA-N	443.979	1.908	50	20	IDGD	
C[C@]1(c2cccc(C(=O)NNC(=O)c3ccc(COc4ccccc4)o3)c2)NC(=O)NC1=O	768930304	PSUKUHVZWCGALB-HSZRJFAPSA-N	448.435	1.988	50	20	IDGD	
C[C@@]1(c2cccc(C(=O)NNC(=O)c3ccc(COc4ccccc4)o3)c2)NC(=O)NC1=O	768930305	PSUKUHVZWCGALB-QHCPKHFHSA-N	448.435	1.988	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](C(=O)OCC(=O)NNC(=O)c1ccc(C#N)cc1)C(C)(C)C	769606930	DDTDCOPMKDEHMM-MRXNPFEDSA-N	432.477	1.802	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)c3ccc(F)c(I)c3)nc21	770979825	LHRXANXZRPCVCA-UHFFFAOYSA-N	428.165	1.570	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1ccc(S(=O)(=O)Nc2nccs2)cc1	772183661	PTFNNXDKXHJHTK-JTQLQIEISA-N	426.476	1.047	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)Nc2ccc(N3CCOCC3)cn2)cc1	772405553	MFBUDXFORKMMAX-OAHLLOKOSA-N	427.461	1.741	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)cc1C(=O)O	773266254	RRNGAWDEOMQIFM-JTQLQIEISA-N	428.850	1.824	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2cc([N+](=O)[O-])c(C)cc2Br)n1	773724487	PISKMMQILGDCLJ-UHFFFAOYSA-N	425.199	1.546	50	20	IDGD	
COCC[S@](=O)Cc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(C)c(F)c2)c1	773890662	YTOHGEPAPOYZKC-PMERELPUSA-N	435.477	1.429	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccccc1Cn1cncn1	774010653	YSEZZXAQVLZREL-CYBMUJFWSA-N	442.863	1.533	50	20	IDGD	
O=C(NCc1cccnn1)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	775039254	KLXYNQSPTUJMAY-UHFFFAOYSA-N	429.444	1.323	50	20	IDGD	
COc1cccc([C@@H]2[C@@H](C(=O)NNC(=O)Cn3nc(C)cc3C)CC(=O)N2C2CC2)c1	776448347	SBAAUZNVEQKHMF-GHTZIAJQSA-N	425.489	1.408	50	20	IDGD	
N#CCc1ccccc1CC(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	776983755	OPZHZCNUJZDOCW-UHFFFAOYSA-N	439.947	1.914	50	20	IDGD	
O=C(NC[C@@H]1COC2(CCOCC2)O1)NNC(=O)c1ccc(F)cc1Br	777754489	KFUUEGUTPGEQDU-LLVKDONJSA-N	432.246	1.454	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)CSc2nncn2-c2ccc(OC)cc2)nc1C	778430083	XDKHBUJZKBFCJG-UHFFFAOYSA-N	443.489	1.786	50	20	IDGD	
COc1ccc(-n2cc(O)c(C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)n2)cc1	779512784	RFIBNAZLMLMHKI-UHFFFAOYSA-N	437.460	1.054	50	20	IDGD	
CC(C)CN(C(=O)CN1CC=C(C#N)CC1)c1c(O)nc(=O)n(Cc2ccccc2)c1N	779585474	BZUVBUOYPDAFOJ-UHFFFAOYSA-N	436.516	1.724	50	20	IDGD	
CC(C)S(=O)(=O)c1ccc(CC(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)cc1	781337601	HTUDGZHGIOGZSW-UHFFFAOYSA-N	442.538	1.266	50	20	IDGD	
CCOC(=O)COc1c(Br)cc(C)cc1C=NNC(=O)C(=O)N1CCCC1	781592125	XBLSFEYVGIIAOI-UHFFFAOYSA-N	440.294	1.772	50	20	IDGD	
CS(=O)(=O)CC[C@H](NC(=O)c1ccc(Cl)cc1)C(=O)NNc1ncncc1Cl	781804350	HJUZIEGOUKFOGY-ZDUSSCGKSA-N	446.316	1.460	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)Cc3cncs3)c2)cc1	782667031	IOBFJKKHGCCJLI-UHFFFAOYSA-N	446.510	1.956	50	20	IDGD	
COc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)C(=O)NNc1nc2ccccc2s1	782814721	WKYQKOKOIFDNAY-UHFFFAOYSA-N	449.514	1.637	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C(=O)Nc2cc3c(cc2Cl)OCO3)nc2ccccc21	782894095	LCSYZNZPJXEZBH-UHFFFAOYSA-N	429.820	1.284	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1cc(NC(=O)C(=O)NNc2cncc(Cl)n2)ccc1F	783266327	RADUHCYILKQNLL-UHFFFAOYSA-N	444.876	1.428	50	20	IDGD	
NC(=O)Cc1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)cc1	783407330	AFTJFWDVTMIIQB-UHFFFAOYSA-N	444.391	1.090	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2ccc(N3CCNC(=O)C3)nc2)ccc1Br	783921797	XWBPDAUPERTMIU-UHFFFAOYSA-N	447.293	1.171	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1cccc(C#Cc2ccccn2)c1	784003714	MNRIIKWINJRDLF-UHFFFAOYSA-N	447.476	1.059	50	20	IDGD	
CCCCCn1nc(C)cc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	784210082	BCWVPZNEYILUHQ-UHFFFAOYSA-N	448.549	1.904	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)NC2CCN(c3cc(C)[nH]n3)CC2)cc1	784661044	HSXFKKJXLCQTGW-OAHLLOKOSA-N	430.509	1.884	50	20	IDGD	
CC(C)N(C)S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ncccc2Cl)cc1	784814852	OZULWMCKLGODHK-UHFFFAOYSA-N	425.898	1.846	50	20	IDGD	
O=C(NNc1ccnc(Br)c1)C(=O)Nc1ccc2c(c1)S(=O)(=O)CC2	784837544	XNCLPYADNJLLSU-UHFFFAOYSA-N	425.264	1.256	50	20	IDGD	
COc1cccc(NNC(=O)C(=O)Nc2ccc(C(=O)N3C[C@H](C)O[C@@H](C)C3)cc2)n1	784844465	ZDLMEABVVAJGAU-KBPBESRZSA-N	427.461	1.421	50	20	IDGD	
O=C(NNc1ccnc(F)c1)C(=O)N1CCc2cc(S(=O)(=O)N3CCCCC3)ccc21	784851879	KYZMRPHEHQBSER-UHFFFAOYSA-N	447.492	1.428	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)C(=O)Nc2cccc(S(=O)(=O)NC(C)(C)C)c2)c1	784852673	XARGBKGNGLBLLM-UHFFFAOYSA-N	448.501	1.632	50	20	IDGD	
CC[C@]1(C)Oc2ccc(NC(=O)C(=O)NNC(=O)CNC(=O)c3cccs3)cc2O1	785995225	UEOUMTQNZJWNAF-LJQANCHMSA-N	432.458	1.161	50	20	IDGD	
CN(C)Cc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccsc2)cc1Br	786417142	MGXAZPDSRLZZHB-UHFFFAOYSA-N	439.335	1.901	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2ncc(C(C)(C)C)s2)c2ccccc2c1=O	789732404	PBGGLUGMMALUIL-UHFFFAOYSA-N	442.501	1.570	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccnc(Oc3ccc(F)cc3F)c2)n1	789740705	HDVNHSBAEYLUDF-UHFFFAOYSA-N	444.398	1.752	50	20	IDGD	
Cc1ccc(-c2nnc(S)n2CCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1	790089658	GYBWMHGDTIWVBK-KRWDZBQOSA-N	439.497	1.920	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)[C@H]1CC(=O)N(C)[C@H]1c1ccc(Cl)c(Cl)c1	790664108	PLVVBJOIODNTQF-LRDDRELGSA-N	443.331	1.965	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(OC)c(NC(=O)C(=O)NNc2ncccc2C)c1	792375023	DNDJEMGGWCBXLP-UHFFFAOYSA-N	435.506	1.511	50	20	IDGD	
CCC(=NNC(=O)c1ccc(-n2cnnn2)cc1)c1ccc(Cl)c(S(N)(=O)=O)c1	794479981	JLYHXRNSRZXGHA-UHFFFAOYSA-N	433.881	1.507	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H]2CN(CC(=O)NNC(=O)c3ccc(C#N)cc3)CC[C@H]21	795134534	WYLNUOVKDFNAGT-ZWKOTPCHSA-N	427.505	1.651	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C[C@@H]2COCCN2C(=O)OC(C)(C)C)o1	795557206	HYSQANWRAQBSCI-OAHLLOKOSA-N	438.525	1.908	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN2C(=O)c3cccc(Cl)c3S2(=O)=O)cc1C	799318967	STTKOLBQTKWVRI-UHFFFAOYSA-N	441.918	1.878	50	20	IDGD	
CCn1cnc2c1c(=O)n(CC(=O)NN=C1CCC13CCC3)c(=O)n2Cc1ccccc1	799871472	YNEGELPJNKVFLT-UHFFFAOYSA-N	434.500	1.864	50	20	IDGD	
C[C@H](c1ccc(S(N)(=O)=O)cc1)N(C)C(=O)NNC(=O)c1cccc(OC(F)F)c1	799917631	ZGWZSJGABDBNCY-LLVKDONJSA-N	442.444	1.983	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)c1nnn(CCOc2ccc(F)cc2)c1C	800320591	FBHZTDSHHQZVLC-UHFFFAOYSA-N	437.435	1.836	50	20	IDGD	
CN(C)S(=O)(=O)c1c[nH]c(C(=O)NNC(=O)Nc2ccc(Br)cc2)c1	801994838	MRBWMGMQNYLRPS-UHFFFAOYSA-N	430.284	1.494	50	20	IDGD	
O=C(CN1C(=O)c2ccc(Br)cc2C1=O)NNc1ccc(-n2ccnc2)nn1	804953510	SIUYQJRCPPQBTA-UHFFFAOYSA-N	442.233	1.164	50	20	IDGD	
CNS(=O)(=O)c1cc(NC(=O)C(=O)NNc2nc3ccccc3cc2C)ccc1F	807021634	KCMPMOVHMQNKHE-UHFFFAOYSA-N	431.449	1.672	50	20	IDGD	
Cc1ccc(S(=O)(=O)NNC(=O)CNC(=O)OC(C)(C)C)cc1C(=O)OC(C)C	808104673	LRMFZNJYVLFTFQ-UHFFFAOYSA-N	429.495	1.394	50	20	IDGD	
N#Cc1cccc(S(=O)(=O)NCC(=O)NNc2ccc(Br)cc2F)c1	810681392	OWWDDSGSMITKNY-UHFFFAOYSA-N	427.255	1.881	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)c2ccc(CN3C(=O)CCC3=O)cc2)cc1	812732247	XZERSYWXBSBXLK-UHFFFAOYSA-N	430.486	1.343	50	20	IDGD	
CC(C)(O)CN1CCC(=NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)CC1	814212669	ICPQAZLKYRCYCR-UHFFFAOYSA-N	436.578	1.814	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cccc(OC(=O)NC)c2)cc1	815566124	JQOTYUKSMYCBPL-ZDUSSCGKSA-N	444.444	1.357	50	20	IDGD	
O=C(Cc1ccccn1)NNC(=O)C(=O)Nc1cccc(S(=O)(=O)C2CCCCC2)c1	815569350	PWXAIGAVVVJGMT-UHFFFAOYSA-N	444.513	1.517	50	20	IDGD	
Cc1ccc(Oc2ccc(NC(=O)C(=O)NNC(=O)[C@@H]3CCc4nncn4C3)cn2)cc1	815691533	SVTKKFLARZJICO-CQSZACIVSA-N	435.444	1.122	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)Cc2csc(NC(=O)c3ccco3)n2)c1	825791354	HREXUQCFZUBHPA-UHFFFAOYSA-N	429.458	1.799	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)[C@@H](CC(C)C)N1C(=O)[C@H]2CC=CC[C@H]2C1=O	864001385	ZETSQZQEUOVHOB-IXDOHACOSA-N	443.500	1.587	50	20	IDGD	
Cn1ccnc1[C@@H](NC(=O)NNC(=O)c1nnc(O)c2ccccc12)c1ccccc1F	916224723	QSXWRTRKNNNIID-INIZCTEOSA-N	435.419	1.942	50	20	IDGD	
O=C(NN=Cc1ccc2c(c1)OCCO2)c1cccc(S(=O)(=O)N2CCOCC2)c1	916258777	KUZSBEWELCNQDC-UHFFFAOYSA-N	431.470	1.243	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NC[C@H]2CCN(CC(F)(F)F)C2)nc1	916577751	FIURURACSHVXGA-GFCCVEGCSA-N	438.476	1.279	50	20	IDGD	
CCOC(=O)c1c(S(=O)(=O)NNC(=O)[C@@H](C)Oc2ccc(OCC)cc2)n[nH]c1C	917725249	JNLJTEIZEFKJDZ-GFCCVEGCSA-N	440.478	1.071	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNS(=O)(=O)c1ccc([C@H](C)NC(C)=O)s1	918399092	JYKWAOXCYALABZ-LBPRGKRZSA-N	441.531	1.732	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)N[C@@H](C)c2ccc(S(=O)(=O)N(C)C)cc2)cc1	919909003	PWNIXBDCPRKFFJ-HNNXBMFYSA-N	448.545	1.970	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)N[C@@H](C)CN2C[C@H](C)C[C@@H](C)C2)nc1	919923915	BKLKGUHUNGXAFU-OAGGEKHMSA-N	426.587	1.761	50	20	IDGD	
CCn1c(NNC(=O)/C(=C\c2ccc(F)cc2)n2nnnc2C)nc2ccccc2c1=O	920444220	BTSSDAAQOXOQIK-LDADJPATSA-N	434.435	1.992	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)COc1ccc(C(N)=O)cc1	920583138	MZCLADCNXBVDHD-LLVKDONJSA-N	436.262	1.542	50	20	IDGD	
NC(=O)[C@H]1CCCN(c2ccc(C(=O)NNC(=O)CSc3ccccc3O)cc2)C1	1116420318	SWQGIYXLIKXMDU-HNNXBMFYSA-N	428.514	1.647	50	20	IDGD	
Cc1nn([C@H]2CCS(=O)(=O)C2)c2nc(C3CC3)cc(C(=O)NNC(=O)NC3CC3)c12	1317992434	BGIVLEUBSDYYLG-ZDUSSCGKSA-N	432.506	1.083	50	20	IDGD	
O=C(NCCN1C(=O)COc2ccccc21)NNC(=O)c1ccc(Br)s1	1321432359	BWVZLIGSZNVNHQ-UHFFFAOYSA-N	439.291	1.880	50	20	IDGD	
COc1nc(Cl)c(C=NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)n1C	1326228310	VUAUYHLBPMGRHJ-UHFFFAOYSA-N	425.898	1.631	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3nn(C)c4c3CCC4)C2)C1	1777963958	ATOFERRKKFGBTP-KPZWWZAWSA-N	425.327	1.136	50	20	IDGD	
O=C1COc2ccc(C(=O)N3CC[C@@]4(C3)CN(C(=O)C(Cl)Cl)CCO4)cc2N1	1778577254	ICSPGTLQNDTHNL-GOSISDBHSA-N	428.272	1.265	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ncc(Cl)cn1)C2)[C@@H](F)Br	1780771222	WWXCYOUZXLFMFD-XHBSWPGZSA-N	449.708	1.948	50	20	IDGD	
CC(C)=NO[C@@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Br)C2	1780808722	IGBTZJUNMCHVDQ-QDEZUTFSSA-N	436.322	1.992	50	20	IDGD	
Cn1cc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](F)Br)C3)C2)c(C(F)F)n1	1781329761	JMFAWOJKXDMKHO-NHYWBVRUSA-N	439.232	1.492	50	20	IDGD	
CC(C)NC(=O)OC(C)(C)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](C)Br)C2)C1	1783538910	YSHAESGCDMKVOG-UGSOOPFHSA-N	448.358	1.513	50	20	IDGD	
Cc1cc2[nH]c(C(=O)N3CCO[C@]4(CCN(C(=O)CCC(=O)NN(C)C)C4)C3)cc2s1	1783936602	JUOQWQMWSKQTSK-NRFANRHFSA-N	447.561	1.354	50	20	IDGD	
C[C@H](Nc1cccnc1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCBr)[C@H]2C1	1786405885	IGHJWNAANXVXEW-OTRWWLKZSA-N	439.354	1.647	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3sc4nccnc4c3N)[C@H]2C1	1786953295	WGVDXYJHEUJMQU-RVMXOQNASA-N	437.953	1.884	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4c(n3)NC(=O)CC4)[C@H]2C1	1787267010	OHGYCHLZFQYXCA-MPTYRVRUSA-N	434.924	1.577	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccccc3Cl)[C@H]2C1	1789453000	RUAZDZORIWCSMO-ZVZYQTTQSA-N	436.940	1.306	50	20	IDGD	
C=C[C@H](O)C(C)(C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](Br)CC)[C@H]2C1	1790960679	PVAKXMIWMUPIOJ-QXKUPLGCSA-N	431.371	1.713	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)Sc3ccccn3)C[C@@H]21	1791256678	UKSHKXIXZAFFEX-WOYTXXSLSA-N	441.981	1.796	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)NC(=O)OC(C)(C)C	1792760987	ZGWUENNTUWKZRI-QMHWVQJVSA-N	431.961	1.897	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cn1cnc3ccccc31)C2	1792872194	QSGIFESGATWPDA-BKEDOTJMSA-N	449.349	1.657	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(C)(C)F)C2	1793880769	FYKZMDBWHDQFJD-CRWXNKLISA-N	435.924	1.456	50	20	IDGD	
COc1ncc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)Br)C3)cc1C	1794985121	GSGFOPITYYLPAN-REBRKWNGSA-N	426.311	1.385	50	20	IDGD	
COc1ccc(F)cc1CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1	1796192106	JKPINKGPHDXIPY-ACDBMABISA-N	440.280	1.009	50	20	IDGD	
Cc1cc(Br)cnc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Cl	1796363142	RHWRKSCFVFMCFS-RDBQEKCUSA-N	434.693	1.890	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)Nc1nccs1	1796417562	LLRCYASEBMCKHC-HPCHECBXSA-N	445.383	1.707	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](CO)NC(=O)OC(C)(C)C	1796739610	CIZDKUCAXFMWHO-RGDJUOJXSA-N	448.358	1.294	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H](C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](O)CCl)C3)C1	1797816685	ONCUNRNGISTVLO-LJIZCISZSA-N	429.945	1.481	50	20	IDGD	
O=C(Cc1c(F)cccc1F)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2	1798983600	NFSNZZQOVBQZBU-GYHMKYFYSA-N	435.240	1.787	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(Cl)nn1)C2	1800641417	APCVGHWJLCWDOC-MIJXAVMKSA-N	431.718	1.507	50	20	IDGD	
C#CCCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2	1802022324	PQFVXBOPKMPBGO-YVWYUNDQSA-N	429.429	1.137	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)CCc2nc(N)n[nH]2)[C@@H]1c1cccnc1	1803691698	IXLFCILREBNOJY-RVKKMQEKSA-N	433.944	1.828	50	20	IDGD	
O=C(CCN1C(=O)C=CC1=O)NC[C@@H]1CCN(C(=O)C(Cl)Cl)[C@@H]1c1cccnc1	1803916693	JHHNHHWSTRLTIH-SUMWQHHRSA-N	439.299	1.206	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)C2CCCCC2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807362424	GZJSRWHCRVDWOY-IFMALSPDSA-N	435.333	1.661	50	20	IDGD	
O=C(Cn1ccccc1=O)NC[C@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1	1807438361	WOSYXATZFCXPON-OXQOHEQNSA-N	447.333	1.734	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)CC(F)(F)C(=O)O)[C@@H]1c1cccnc1	1808294369	KFSZFHYXRWPKFS-YDHLFZDLSA-N	433.839	1.451	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)[C@@H](F)Cl)[C@@H]1c1cccnc1	1808312360	CWASSIKAKNUWRB-LRHAEKHYSA-N	448.886	1.756	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)c1nnsc1C1CC1	1808734198	WBEOPRSFPNWICF-DZKIICNBSA-N	435.937	1.730	50	20	IDGD	
Cc1ncc(C(=O)N2CCC3(CCCN(C(=O)c4ccc(B(O)O)cc4)C3)CC2)s1	1809972707	ZXSNOAAWMNACEA-UHFFFAOYSA-N	427.335	1.290	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2ccc3ncnn3c2)[C@H]1c1cccnc1	1810060026	NVJNRTJHKFIJEC-HHXXYDBFSA-N	442.907	1.698	50	20	IDGD	
Cc1occc1C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1	1810299510	RDTQOBWLBCFTLK-OXQOHEQNSA-N	448.483	1.615	50	20	IDGD	
C[C@H](CBr)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CS(C)(=O)=O)[nH]n1	1814780305	LJOXVFISBQFHAX-PWSUYJOCSA-N	435.344	1.477	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(-n3cccn3)nc2)[nH]n1)[C@@H](O)CCl	1814873047	JLUIQEITSNUAFS-HOTGVXAUSA-N	443.895	1.896	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)C#Cc2ccccc2)n[nH]1	1816960117	CTRZUJNAGRLJPB-IBGZPJMESA-N	436.516	1.827	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)Cc2ccncc2)[nH]n1)c1ccc(B(O)O)cc1	1817472807	YUKJDCXMHIJQBK-LJQANCHMSA-N	433.277	1.033	50	20	IDGD	
Cc1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2	1817766968	HXWOHZISGNYJAV-OAHLLOKOSA-N	436.302	1.066	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](O)CCl)CC2)c1cnc2ccccc2n1	1817952270	AKFDXTTYLGFLAQ-ZUZCIYMTSA-N	431.905	1.912	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](O)C(C)C)[nH]n1	1818111020	YMFKJVWHCNMJTD-DWLLQQPHSA-N	443.508	1.553	50	20	IDGD	
O=C(C/N=C/c1ccco1)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1819477833	YIEQLZOMFXTYMJ-BBMHEYIBSA-N	449.276	1.108	50	20	IDGD	
CC(C)n1nccc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1	1819816390	BKJCDIBOWXKQOP-INIZCTEOSA-N	444.540	1.866	50	20	IDGD	
Cc1ncncc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1819868235	MHCNNJCEAJLLBR-QGZVFWFLSA-N	449.475	1.126	50	20	IDGD	
N#Cc1cccc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2ccc(B(O)O)cc2)CC3)c1	1822027266	HQCMOCNORPPOEF-KRWDZBQOSA-N	446.297	1.234	50	20	IDGD	
CNC(=S)NCCC(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](C)Br)n[nH]1	1822188945	LVVVAVYYWXUSDH-PWSUYJOCSA-N	445.387	1.669	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2C[C@H]3CC[C@@H]2O3)[nH]n1	1822416673	KIBJPEQVIZTPJI-JHNDHUHGSA-N	432.525	1.342	50	20	IDGD	
O=C(CN1C(=O)C=CC1=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](F)Br)[nH]n1	1822529549	CIAUBILLNSTHKK-BONVTDFDSA-N	442.245	1.017	50	20	IDGD	
Cc1cc(CC(=O)Nc2cc([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)no1	1822699392	FNGRWAVXYFGFPQ-INIZCTEOSA-N	431.497	1.314	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnsn2)CC1	1825522059	IUOVZDALQCMTGJ-QGZVFWFLSA-N	443.533	1.084	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CSc1nc[nH]n1)CC2	1826008893	JUNPPFOFEIZGNF-BDAKNGLRSA-N	430.943	1.219	50	20	IDGD	
Cc1cccnc1C(=O)N[C@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1	1826083810	SKAOJMAHXOBHPL-ZDUSSCGKSA-N	430.534	1.445	50	20	IDGD	
O=C1NCCn2nc(C(=O)N3CCCC[C@H]3C3CCN(C(=O)[C@H](F)Cl)CC3)cc21	1826197049	IRTGFANCGRWXLG-HOCLYGCPSA-N	425.892	1.394	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC([C@H]2CCCCN2C(=O)CN2CCOCC2)CC1	1826714278	NTDQMFUHZXLGKV-SJLPKXTDSA-N	444.414	1.969	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC([C@@H]2CCCCN2C(=O)CC[C@@H](N)C(N)=O)CC1	1826936689	ZBIKJBFCXBXOCV-SJORKVTESA-N	426.634	1.050	50	20	IDGD	
CCC[C@@H](NC(C)=O)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830370612	NJJOFSOYNLEUEL-OXQOHEQNSA-N	431.961	1.013	50	20	IDGD	
CCn1nccc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)CBr)CCO2	1830537603	KZUXFEZYAVAXAD-RDTXWAMCSA-N	443.342	1.004	50	20	IDGD	
CCC1(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)COC1	1831276145	QVOOBWGLHVSFCK-IBGZPJMESA-N	443.548	1.345	50	20	IDGD	
Cc1cn(CC(=O)N2CCCC[C@@H]2C2CCN(C(=O)[C@H](F)Cl)CC2)c(=O)nc1O	1832772932	HBLOVFUEFYMNBY-ZBFHGGJFSA-N	428.892	1.411	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3cccc(OC)n3)CCO2)C1	1832823780	BZVHCMOPRIWAII-UWJYYQICSA-N	439.940	1.497	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3ccc([N+](=O)[O-])o3)CC2)CC1	1833006216	NFGACXZYROYEEU-OAHLLOKOSA-N	442.900	1.627	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)CNC(=O)N(C)C)CC2)CC1	1833143623	WRZMJPOUHHIBAV-QGZVFWFLSA-N	429.993	1.237	50	20	IDGD	
Cc1nc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)c(C)s1	1833150128	OOCAATQFYJJFJZ-KRWDZBQOSA-N	436.361	1.563	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3csnc3C)CC2)CC1	1834044406	XUVBHGXLVAXGHZ-KRWDZBQOSA-N	428.986	1.891	50	20	IDGD	
Cc1ncncc1C(=O)N1CCC(N2CCC(NC(=O)CCBr)CC2)CC1	1834423405	STPHQTFBAFGXLU-UHFFFAOYSA-N	438.370	1.755	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)[C@H](F)c3ccccc3)C2)C1	1834818743	DDOHTJULLAEKAU-IEBWSBKVSA-N	443.313	1.939	50	20	IDGD	
CCc1ncsc1C(=O)N1CCOC[C@]2(CN(C(=O)CCBr)CCO2)C1	1834823749	IGHWKOLHQBSLCP-KRWDZBQOSA-N	446.367	1.561	50	20	IDGD	
COCC1(C(=O)N2CCC(N3CCC(NC(=O)[C@H](F)Br)CC3)CC2)CC1	1836413334	BZPXFOLOPBMTEF-HNNXBMFYSA-N	434.350	1.675	50	20	IDGD	
CC[C@H](C)[C@@H](O)C(=O)N1CCC(N2CCC(NC(=O)[C@H](F)Br)CC2)CC1	1836414167	XECFJGGAILHZEQ-MAZHCROVSA-N	436.366	1.656	50	20	IDGD	
O=C(c1cc(O)ccc1F)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836717450	DNNMPPJGRXNGER-SFHVURJKSA-N	428.888	1.743	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@H](COC)NC(C)=O)CC2)CC1	1836923482	ZJPPEGYRZXNONP-MOPGFXCFSA-N	445.988	1.544	50	20	IDGD	
O=C(CS[C@H]1CCCCO1)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1837510635	OXLSKRHUXVEQBJ-WMLDXEAASA-N	441.377	1.506	50	20	IDGD	
Cn1cc(F)cc1C(=O)N1CCOC[C@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1837713118	IOZAPRMMWZRSQL-IBGZPJMESA-N	427.549	1.086	50	20	IDGD	
Cn1cc(F)cc1C(=O)N1CCOC[C@@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1837713119	IOZAPRMMWZRSQL-LJQANCHMSA-N	427.549	1.086	50	20	IDGD	
Cc1cnc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)s1	1839151529	VEWOPFVKPPIWNL-IAGOWNOFSA-N	436.361	1.758	50	20	IDGD	
CCN(CC)C[C@@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1	1839678457	XZVHIIYJMLVCOT-WIYYLYMNSA-N	443.661	1.272	50	20	IDGD	
C=C[C@H](O)C(C)(C)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](Br)CC)CCO2)C1	1839965004	KNPAKIMNHISJEI-ZRGWGRIASA-N	447.370	1.189	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cncnc3C)C2)C1	1839965995	RCTPQANGLUXJEQ-QAPCUYQASA-N	441.326	1.029	50	20	IDGD	
O=C(Cc1ccc2c(c1)CCO2)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1839999843	XJCRTQZPTCRAOK-FQEVSTJZSA-N	443.327	1.424	50	20	IDGD	
CCc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)no1	1840033837	SDIQXFPDYJKZLG-SJKOYZFVSA-N	430.299	1.090	50	20	IDGD	
COc1cccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)c1C	1840070502	VVLQHSJHEGATHN-AZUAARDMSA-N	428.888	1.537	50	20	IDGD	
COC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)C(C)(C)CCl)C1	1841226062	JTSUYGFYBFEDHE-AWEZNQCLSA-N	431.961	1.995	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](CC1CC1)C(=O)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1	1841354152	KJPQMPWIHZJAOJ-CABCVRRESA-N	429.945	1.483	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)CCc2cccc([N+](=O)[O-])c2)C1	1841808439	SBGJPEOKFWPSAJ-UHFFFAOYSA-N	431.493	1.104	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCCC12CN(C(=O)CN1CCCC1)C2	1841923978	KOAMFQKCGFFFMO-HNNXBMFYSA-N	428.961	1.418	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC2(CCCN2C(=O)[C@@H]2CCc3nc(O)nc(O)c3C2)C1	1842058368	FYUUQJMICVFFCE-ZMZPIMSZSA-N	443.331	1.432	50	20	IDGD	
Cc1nccc(C(=O)N2CCCC23CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C3)n1	1843549522	VTUPQLBQSZUNDS-HNNXBMFYSA-N	437.928	1.734	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)[C@@H]2[C@H]3Sc4ccccc4[C@H]32)C1	1844271244	VUGKYTNPQYLNDL-UFYCRDLUSA-N	434.326	1.071	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)c2ccc(N3N=C(C)CC3=O)cc2)C1	1844961298	YGYWLVQXZAZGSN-KRWDZBQOSA-N	432.908	1.870	50	20	IDGD	
CCCCCc1ncc(C(=O)N2CCCC23CN(C(=O)c2ccc(B(O)O)cc2)C3)s1	1845792010	DKKJGUKODOKDIV-UHFFFAOYSA-N	441.362	1.686	50	20	IDGD	
COC(=O)C1(C(=O)N2CCCC23CN(C(=O)c2cc([N+](=O)[O-])ccc2OC(C)=O)C3)CC1	1846018050	FUYFOSQGLLGZNK-UHFFFAOYSA-N	445.428	1.290	50	20	IDGD	
C=CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)[C@@H](Cl)COC)C1	1846360551	SNPPXWAUIDEQSN-LSDHHAIUSA-N	429.945	1.913	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@H](Cc1cccc(F)c1)NC(C)=O)C2	1846365671	NMJBZDUDKBTBNX-ZWKOTPCHSA-N	439.915	1.330	50	20	IDGD	
CC(C)[C@@H](S)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CN(C)NC(=O)NCc1ccccc1	1847826943	NMIDNSUJTCDMJF-CMKODMSKSA-N	447.605	1.489	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NNC(=O)c2c(C)nc3ccccn23)cc1	14841944	LUGCPTHYKPFGSN-KRWDZBQOSA-N	441.513	1.565	50	20	IDGD	
CC(C)Cn1c(CCC(N)=O)nnc1SCC(=O)NNC(=O)c1ccc(Cl)cc1	17274584	UUZFVEXHPUMEHG-UHFFFAOYSA-N	438.941	1.559	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccccc1)c1cccc([N+](=O)[O-])c1	21001462	HDUXNSYNQLYYCA-KRWDZBQOSA-N	432.458	1.599	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccccc1)[C@@H]1COc2ccccc2O1	22084898	GJKHMQJRQOPZCI-LPHOPBHVSA-N	445.497	1.217	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NC[C@H](O)c1ccc(OC(F)(F)F)cc1	725873955	VLQPHDSGIWJNTB-LBPRGKRZSA-N	446.407	1.441	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)CNC(=O)c1cccs1)c1ccc(NC(=O)C2CC2)cc1	725874075	XBDYSVTUHPKRNE-GFCCVEGCSA-N	429.502	1.918	50	20	IDGD	
CC[C@@H](C)C(=O)Nc1cccc(CNC(=O)NNC(=O)CNC(=O)c2cccs2)c1	725874431	ZGBJGILXDSBNGY-CYBMUJFWSA-N	431.518	1.993	50	20	IDGD	
CCOCCOc1ccc(S(=O)(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1	728853856	DRXPBSYRROOWLO-UHFFFAOYSA-N	449.533	1.118	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)CCNS(=O)(=O)c1ccc2c(c1)CCCC2	731494163	RDYDIJDCECELMK-UHFFFAOYSA-N	431.514	1.704	50	20	IDGD	
Cn1c(N)c(C(=O)/C(C#N)=C\c2ccc(-n3cnc4ccccc43)cc2)c(=O)n(C)c1=O	732578586	RSIUXGNZQPEXHB-PTNGSMBKSA-N	426.436	1.795	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)(F)F)cc1)N[C@@H]1CCN(CC(F)(F)F)C1=O	732589550	DBRLSHONODMKMU-SNVBAGLBSA-N	448.345	1.769	50	20	IDGD	
CCOCCCn1c(NNC(=O)c2ccc(S(C)(=O)=O)cc2)nc2ccccc2c1=O	733268343	KEHBZQDVUZQNEP-UHFFFAOYSA-N	444.513	1.984	50	20	IDGD	
CC(C)(C)OC(=O)N1CCCC[C@H](NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)C1	733336494	UTEJOPFBKKJFNS-HNNXBMFYSA-N	444.496	1.396	50	20	IDGD	
N#Cc1ccc(N2C(=O)N[C@H](CCC(=O)NNC(=O)Cc3c[nH]c4ccccc34)C2=O)cc1	733774247	KOQXWIPAVUHDOQ-LJQANCHMSA-N	444.451	1.635	50	20	IDGD	
CN(C)[C@H](CNC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)c1c(F)cccc1F	734675692	LAQUAAWTZXAVDR-MRXNPFEDSA-N	444.442	1.459	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)c2cnn(C)c2)cc1S(=O)(=O)NCc1ccccc1	735472977	IFGJUHCUBKUJCJ-UHFFFAOYSA-N	427.486	1.282	50	20	IDGD	
Cc1nnnn1[C@@H](Cc1ccccc1)C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	735653569	KMOTVRAZGRWIEZ-IBGZPJMESA-N	441.517	1.349	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)NCCCN1CCN(c2ccccc2)CC1	738457364	SNKJHHOPGSFDEY-UHFFFAOYSA-N	425.533	1.746	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)c1cn(-c2cccc(C(F)(F)F)c2)nn1	739474262	QSLKOFHILVNRKV-MRXNPFEDSA-N	433.346	1.887	50	20	IDGD	
CS(=O)(=O)[C@@H]1CCC[C@@H](NC(=O)NNC(=O)COc2ccc(Br)cc2)C1	741092222	AIQPNDUBBWWQLD-TZMCWYRMSA-N	448.339	1.514	50	20	IDGD	
O=C(NNC(=O)c1nccn2ccnc12)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	741144178	IMVRVWVKWRBBAT-UHFFFAOYSA-N	439.439	1.506	50	20	IDGD	
COc1ccc(-c2n[nH]c(CNC(=O)NNC(=O)[C@H](C)Oc3ccc(F)cc3)n2)cc1	741414040	KXKAPLGHGPCOAU-LBPRGKRZSA-N	428.424	1.917	50	20	IDGD	
CC(=O)N[C@@H](CC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)c1ccc(F)cc1F	741535330	MPZXIALDJLMDSP-KRWDZBQOSA-N	439.440	1.397	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@@H](C)NC(=O)c2cc3c(C)nn(C)c3s2)cc1OC	742033275	MDORHGXIBDNTPX-LLVKDONJSA-N	445.501	1.540	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)COc1ccc(Br)cc1)n1nnc(-c2ccccc2)n1	742471996	WFMWFFJWPLFGTI-LBPRGKRZSA-N	445.277	1.890	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2ccc(C(=O)O)cc2F)cc1Br	743259101	QKACSVMJNKRQEJ-UHFFFAOYSA-N	447.238	1.918	50	20	IDGD	
C[C@@H](CN1CCN(c2ccccc2)CC1)NC(=O)NNC(=O)[C@H]1COc2ccccc2O1	743632427	GRGUGXRNNNZEON-LAUBAEHRSA-N	439.516	1.368	50	20	IDGD	
CN(CC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)c1ccccc1	743841908	FMPFWXZZNIFANZ-UHFFFAOYSA-N	430.530	1.759	50	20	IDGD	
COc1cc(C)nc(NNC(=O)c2cc(S(=O)(=O)N3CCOCC3)ccc2Cl)n1	746622665	CDIIYQBZBOKVET-UHFFFAOYSA-N	441.897	1.225	50	20	IDGD	
CC[C@H](NC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)c1nnc2n1CCCCC2	749581846	KDTWLESDFXZGFC-HNNXBMFYSA-N	449.537	1.895	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(CC(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)C1	750508235	OVGUMCIVXHBXMB-UHFFFAOYSA-N	425.869	1.901	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@@H]2CCCN2C(=O)OC(C)(C)C)c2ccccc2c1=O	750668901	WZWKVIUFYOUATK-HNNXBMFYSA-N	429.477	1.577	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)N[C@@H]3CCS(=O)(=O)C3)c3c(C)noc3n2)cc1	751363930	YJKDMYGSQOUJRF-CQSZACIVSA-N	443.485	1.638	50	20	IDGD	
CC[C@@H](CS(=O)(=O)c1ccccc1)NC(=O)NNC(=O)COc1ccccc1C#N	752708000	ZFSTULVJHGROHT-INIZCTEOSA-N	430.486	1.520	50	20	IDGD	
COC(=O)c1cccc([C@@H](NNC(=O)c2sc(N3CCOCC3)nc2C)C(=O)OC)c1	753998839	MAWXNTCKUMJNAH-OAHLLOKOSA-N	448.501	1.223	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)c1cn(-c2ccccc2)nc1-c1ccccc1)S(C)(=O)=O	754673182	FJGNLFOTAHBFPE-HNNXBMFYSA-N	441.513	1.916	50	20	IDGD	
C[C@@H](C(=O)N1CCCC1)N1CCN(C(=O)NNC(=O)c2cccc(OC(F)F)c2)CC1	755148316	HFUBDZTWRUEQBB-AWEZNQCLSA-N	439.463	1.271	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)c2coc(S(=O)(=O)N(C)C)c2)c1	755857748	WPWPUBQEHYWXEH-UHFFFAOYSA-N	446.279	1.376	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)NNC(=O)[C@H]3COc4ccccc4O3)cn2)C[C@@H](C)O1	755866911	ZYYQFPOXRKATDC-QWQRMKEZSA-N	427.461	1.688	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)cc1-n1nnnc1C	756317873	DQCDSGSRTPNBOH-UHFFFAOYSA-N	439.461	1.897	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2cccn(CC(F)(F)F)c2=O)c1	757656444	IYNMBZFFZGMHNQ-UHFFFAOYSA-N	432.380	1.281	50	20	IDGD	
CNS(=O)(=O)c1cccc(NC(=O)NNC(=O)c2nnc(O)c3ccccc23)c1C	757721468	MCPAJDMAGGBLML-UHFFFAOYSA-N	430.446	1.018	50	20	IDGD	
CN(C)N(C(=O)[C@@H]1CN(C(=O)OC(C)(C)C)CCC1(F)F)[C@@H]1CCS(=O)(=O)C1	757871588	OOABTHARQBPVDT-OLZOCXBDSA-N	425.498	1.371	50	20	IDGD	
CCn1ncc2c(C(=O)NNC(=O)C(=O)Nc3ccccn3)cc(-c3ccccc3)nc21	758837391	AQFFIBQMXPFRGE-UHFFFAOYSA-N	429.440	1.913	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)N2CCC(C(=O)NNc3ncccc3[N+](=O)[O-])CC2)cc1	759289358	CABMVEQDEWRBRQ-UHFFFAOYSA-N	447.473	1.736	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)C2CCN(C(=O)c3cc(OC)cc(OC)c3)CC2)nc1	759725624	UHTBOISKKKJBKX-UHFFFAOYSA-N	442.472	1.881	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)c1c[nH]nc1-c1ccc2c(c1)OCCO2	760442562	LUPVQKWMZJAWQK-UHFFFAOYSA-N	431.449	1.524	50	20	IDGD	
O=C(NCCC[C@H]1CCCCO1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	761037027	KRQQJCUOHCOMFP-QGZVFWFLSA-N	438.550	1.764	50	20	IDGD	
CCc1csc(-n2cc(C(=O)OCC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)cn2)n1	762889185	OKAPTNJZQXWYJM-UHFFFAOYSA-N	444.429	1.417	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)C(=O)Nc1ccc(OC[C@H]2CCCO2)cc1	763549311	XECZLFSBIQZUGV-MRXNPFEDSA-N	427.413	1.373	50	20	IDGD	
COC(=O)c1[nH]c(C)cc1NC(=O)C(=O)NNC(=O)c1cc(C)n(-c2ccccc2)c1C	763602869	SZPXRRCUYPVGMI-UHFFFAOYSA-N	437.456	1.917	50	20	IDGD	
CCOC(=O)c1cc(F)c(F)cc1NC(=O)C(=O)NNC(=O)COc1ccc(C#N)cc1	763682520	VNEWHOXEJLBUMT-UHFFFAOYSA-N	446.366	1.178	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(C)(C)C)cc2)c1	763718987	SSRLEHAJOGTIEN-UHFFFAOYSA-N	446.529	1.634	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2cccc(-c3ccnc(C)n3)c2)c1	763774295	ASAQJRHWICHQGL-UHFFFAOYSA-N	435.440	1.869	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2cc(N3CCOC3=O)ccc2C)c1	763775869	WTIMVMUOAAHJTM-UHFFFAOYSA-N	442.428	1.369	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)nc(C)n3C)cc1	763864618	DKGAJLHMZNHVKY-ZDUSSCGKSA-N	439.472	1.834	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(N(C)C(C)=O)cc2)cc1	763873192	SCUZEAXGGQBUPV-CQSZACIVSA-N	440.456	1.425	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)N2CCc3cc(Br)cc(F)c32)n1	763885991	PJBSHINSSYXZKU-UHFFFAOYSA-N	438.257	1.138	50	20	IDGD	
COC(=O)c1cc(Br)c(F)cc1NC(=O)C(=O)NNC(=O)c1cccn1C	763996199	NJUOQYNVCOTERS-UHFFFAOYSA-N	441.213	1.113	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)CCN2C(C)=O	764012007	LNMWIGVAWKNZPH-UHFFFAOYSA-N	430.848	1.657	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1ccc([S@](C)=O)c(F)c1	764013104	UWJMFALOTBCSGM-NDEPHWFRSA-N	427.841	1.625	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(C)cc2O)c(OC(F)F)c1	764105746	XTHCVDLQIQJZMU-UHFFFAOYSA-N	437.355	1.488	50	20	IDGD	
CCn1nccc1NC(=O)C(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1	764179585	UYYRUBBAOFJJQJ-HXUWFJFHSA-N	446.511	1.616	50	20	IDGD	
CC(=O)Nc1cc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)ccc1F	764387944	OLUUABAQGJGYSV-UHFFFAOYSA-N	442.382	1.713	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(Sc2ncccn2)cc1C	764398396	GZDOATVCBDFHLA-CYBMUJFWSA-N	433.490	1.074	50	20	IDGD	
COCCn1ncc2ccc(NC(=O)C(=O)NNC(=O)CSc3ccccc3O)cc21	764401134	LHXVHGFBVKQJOO-UHFFFAOYSA-N	443.485	1.267	50	20	IDGD	
COC(=O)NNC(=O)C(=O)Nc1cccc(CS(=O)(=O)c2ccc(F)cc2F)c1	765372506	OOJDTGMKTMNWOG-UHFFFAOYSA-N	427.385	1.264	50	20	IDGD	
O=C(CNC(=O)c1ccc(Br)o1)NNC(=O)c1cc(-c2cccs2)[nH]n1	765566452	WOFVTJKETOGCKR-UHFFFAOYSA-N	438.263	1.685	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3N)CC2)cc1	766648965	LZNSTMYVDLNQFG-UHFFFAOYSA-N	426.477	1.064	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)N[C@@H]1CCCc2c[nH]nc21	767227573	TVJBYTPMNXTWMA-MRXNPFEDSA-N	432.506	1.216	50	20	IDGD	
N#C/C(=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)O[C@H]1CCCNC1=O	767234391	BVHLNFVXSZEUGZ-QXSWTLKVSA-N	441.875	1.808	50	20	IDGD	
Cc1ccc(S(N)(=O)=O)c(C(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)c1	767846914	WJIKILKCAAQHPI-UHFFFAOYSA-N	437.421	1.693	50	20	IDGD	
Cn1ccnc1[C@](O)(CC(=O)NNC(=O)c1cc(-c2cccs2)[nH]n1)C(F)(F)F	768262659	LQHUYGBANRUNIT-OAHLLOKOSA-N	428.396	1.473	50	20	IDGD	
CCn1c(SCC(=O)NNC(=O)c2ccc(OC)c(OC)c2)nnc1-c1cnccn1	768414028	KVBGMDNFUGMOPW-UHFFFAOYSA-N	443.489	1.326	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)Cn2cc(-c3ccccc3)c(C)n2)n1	769353500	KOLFCXXTZSOWPG-UHFFFAOYSA-N	427.486	1.557	50	20	IDGD	
CCCCCCn1cc(S(=O)(=O)NNC(=O)NCCc2cccs2)c(O)nc1=O	769623680	DIJNOHZNDLDTAJ-UHFFFAOYSA-N	443.551	1.326	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)[C@H](NS(C)(=O)=O)C(C)(C)C)c1	770949998	IRVVANRKCXRJLY-LBPRGKRZSA-N	436.328	1.183	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1)NNc1ccnc(Br)c1	771537872	QZSLAOVAPAVPNQ-UHFFFAOYSA-N	444.267	1.564	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)O[C@H](C)C(=O)NNC(=O)CC(C)C)s1	771932906	ZJRYBFLFLJYMDD-KGLIPLIRSA-N	445.563	1.335	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)c1ccc(Br)cc1-n1cncn1	772221675	SCFJUMREIGGQNN-NSHDSACASA-N	438.282	1.769	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)c2ccc(NC(=O)N(C)C)cc2Cl)C[C@@H](C)O1	772371833	BZSWAOMHIQDRLJ-CHWSQXEVSA-N	425.917	1.694	50	20	IDGD	
CC(C)(C)OC(=O)CCCCNC(=O)NNC(=O)c1csc(N2CCOCC2)n1	773448389	LLGXKAODTBPMQB-UHFFFAOYSA-N	427.527	1.436	50	20	IDGD	
Cc1ccc(-n2nc(C)cc2NC(=O)C(=O)NNC(=O)c2cc(C)nc3ccccc23)nn1	773494152	PHFLGCFJGXRAEJ-UHFFFAOYSA-N	444.455	1.535	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(NC(=O)C(=O)NNc2ccc(C(F)(F)F)cn2)c1	773668997	DMWIAQNOYFOWKA-UHFFFAOYSA-N	431.396	1.433	50	20	IDGD	
O=C(NNc1ccc(C(F)(F)F)cn1)C(=O)Nc1cccc(C(=O)N2CCOCC2)c1	773669157	INABSZXDGPCMCH-UHFFFAOYSA-N	437.378	1.655	50	20	IDGD	
CN1CCN(C[C@H](NC(=O)NNc2cccc(S(C)(=O)=O)c2)c2ccccc2)CC1	776619720	KKFHXJPOFAHRLW-FQEVSTJZSA-N	431.562	1.705	50	20	IDGD	
Cc1nc(N)nc(C)c1C(=O)NNC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1	777841072	YEAVPOJPDHWOTC-UHFFFAOYSA-N	428.456	1.998	50	20	IDGD	
COC[C@@H](C)n1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(C)cc3)[nH]n2)n1	778712547	HUTKVCCMXCBBFB-CYBMUJFWSA-N	425.449	1.189	50	20	IDGD	
Cc1nn(C)c(-n2cccn2)c1C(=O)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1	779011358	HMEOJMJVGIQPJM-UHFFFAOYSA-N	428.396	1.965	50	20	IDGD	
Nc1nc(Cl)cc(NNC(=O)[C@@H]2CCN(c3cccc(Br)c3)C2=O)n1	779373674	USRCVAUGYBJXJG-JTQLQIEISA-N	425.674	1.971	50	20	IDGD	
O=C(CNC(=O)c1cccc(O)c1)NNc1ccc(S(=O)(=O)Nc2nccs2)cc1	779381074	MIJVIXZFNLVIIM-UHFFFAOYSA-N	447.498	1.523	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1)c1ncn(C)n1	780703879	UUEGTBWZLXWOQD-OXJNMPFZSA-N	433.516	1.834	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)C1CCN(C(=O)COc2ccccc2)CC1	780970940	HIGBJGFBKFDIDV-UHFFFAOYSA-N	448.520	1.366	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)NCc2ccccc2CN2CC[C@H](O)C2)c1	781956421	UGBAAUCUMUEZEU-FQEVSTJZSA-N	426.517	1.779	50	20	IDGD	
COC(=O)c1ccc(C(F)(F)F)cc1NC(=O)C(=O)NNc1ccc(-n2cccn2)nn1	783432797	DDWOBFZIQPIRGL-UHFFFAOYSA-N	449.349	1.550	50	20	IDGD	
O=C(NNC(=O)c1cccc2nn[nH]c12)c1cccc(S(=O)(=O)N2CCCCC2)c1	783510532	MOWHZLHJBUIBPU-UHFFFAOYSA-N	428.474	1.207	50	20	IDGD	
Cc1ccnc(NNC(=O)C(=O)Nc2cccc(S(=O)(=O)/N=C3\CCCN3C)c2)c1	783931496	ROVJSDHPOADQQW-JJIBRWJFSA-N	430.490	1.285	50	20	IDGD	
CNS(=O)(=O)c1ccc(C)c(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2Cl)c1	784384098	QAFQFESCEQLOGD-UHFFFAOYSA-N	441.853	1.547	50	20	IDGD	
COc1cc(C(=O)N(C)C)ccc1NC(=O)C(=O)NNc1ccc(Br)nc1	784806236	DJWDPMZKEMWPCO-UHFFFAOYSA-N	436.266	1.636	50	20	IDGD	
C[C@@H](NC(=O)c1ccc(Br)s1)C(=O)NNc1ccccc1S(N)(=O)=O	788230507	OLBKZCLXBIJHRI-MRVPVSSYSA-N	447.336	1.420	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc4c(c3)CC(=O)N4C)n[nH]2)cc1	789732715	DYLVHVAKVWIONG-UHFFFAOYSA-N	432.440	1.304	50	20	IDGD	
Cn1nc(-c2ccc(F)cc2F)cc1NC(=O)C(=O)NNC(=O)COc1ccc(F)cc1	789740011	DMOMLIZLMYSNKZ-UHFFFAOYSA-N	447.373	1.669	50	20	IDGD	
O=C(NNC(=O)[C@H]1OCC[C@H]1c1ccccc1)C(=O)Nc1cccc(N2CCOCC2)c1	789811034	BZPKZGDQTHKDKH-PMACEKPBSA-N	438.484	1.182	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)[C@@H](CCS(C)(=O)=O)c3ccccc3)nc21	789942353	PGYOZEQACJDHGG-AWEZNQCLSA-N	446.533	1.949	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N2CC[C@@H](N3CCCC3=O)C2)cc1Br	791024530	XXXOAZLBQOEAMO-GFCCVEGCSA-N	425.283	1.509	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2cccc(C(=O)NNc3nc4ccccn4n3)c2)C[C@@H](C)O1	791242544	REMUADBGFKOFKX-OKILXGFUSA-N	430.490	1.284	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(NC(=O)N(C)C)c2C)cc1C	792352050	ALOTXOIUPSRTMP-UHFFFAOYSA-N	441.488	1.870	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)N2CCN(CC(=O)Nc3ccccc3Cl)CC2)n1	793219587	AFOQLTDCPSXSRG-UHFFFAOYSA-N	430.896	1.654	50	20	IDGD	
CC(=O)Nc1cc(NC(C)=O)cc(C(=O)NNC(=O)CNC(=O)OCc2ccccc2)c1	794064353	CBKBKQQRVQSXPB-UHFFFAOYSA-N	441.444	1.291	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccccc1S(=O)(=O)C(F)F)c1cc2c(s1)CCC2	794577178	SPCXOGAUXDIXTC-UHFFFAOYSA-N	436.483	1.856	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)CCc1ccc([N+](=O)[O-])cc1[N+](=O)[O-]	795168383	OKIUZFWELGNFPO-UHFFFAOYSA-N	437.434	1.829	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2ccc3nc(C)n(C)c3c2)cc1OC	796029483	KZOOAIUCBVUSLS-UHFFFAOYSA-N	426.429	1.517	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@H]2C(=O)OCC(=O)NNC(=O)c2ccccc2)cc1	798791551	TZSLFESSZFJPIP-SFHVURJKSA-N	425.441	1.304	50	20	IDGD	
CO[C@H](C(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1)c1cnn(C)c1	798863094	SPRUNKHAZNXZER-IBGZPJMESA-N	446.471	1.271	50	20	IDGD	
CC(C)(COCc1ccccc1)C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	800290758	RAORDLKZXBTSBJ-IBGZPJMESA-N	442.468	1.760	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)c2ccc(C)c(S(N)(=O)=O)c2)c(OC)cc1Cl	802084314	SQNDBRVABUTHLO-UHFFFAOYSA-N	442.881	1.780	50	20	IDGD	
CC(C)(C)OC(=O)N(CC(=O)NNC(=O)Nc1ccc2c(c1)OCO2)C[C@H]1CCCO1	802105286	SKBFQQDQIPWQGP-CQSZACIVSA-N	436.465	1.984	50	20	IDGD	
COc1ccc(CN2CC[C@@H](NC(=O)NNC(=O)c3ccccc3C)C2=O)c(OC)c1	804868756	OQGYGZUKGSJJKL-GOSISDBHSA-N	426.473	1.757	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)N[C@H]1CC(=O)N(c2ccc(Cl)c(F)c2)C1	805248687	JTZNPDKQNMUVKX-NSHDSACASA-N	430.831	1.886	50	20	IDGD	
CC(=O)NCc1ccc(S(=O)(=O)NCC(=O)NNc2ccc([N+](=O)[O-])cc2C)s1	805375790	WYBMXQAIPRNRGR-UHFFFAOYSA-N	441.491	1.022	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)c1cnn(CCN(C)C)c1-c1ccccc1	806365421	OOJDCALKQQWMPL-UHFFFAOYSA-N	436.516	1.993	50	20	IDGD	
COCCNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)Cc2ccc3ccccc3c2)c1	806976078	CVSCBTUAQFPIKN-UHFFFAOYSA-N	448.479	1.545	50	20	IDGD	
CCc1ccc(NC(=O)C(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1Cl	806993342	VNGZENCHZITFEH-UHFFFAOYSA-N	437.909	1.595	50	20	IDGD	
COc1cc(OC)c(OC)cc1CNC(=O)NNC(=O)c1cc(OC)c(OC)c(OC)c1	807105126	UIKOQPRSTZPWJP-UHFFFAOYSA-N	449.460	1.882	50	20	IDGD	
O=C(CCC(=O)N1CCN(c2ccccn2)CC1)NNC(=S)NCCc1cccs1	807917243	RDXYMDFIMDDCHW-UHFFFAOYSA-N	446.602	1.310	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)C1(S(=O)(=O)c2ccccc2)CCOCC1	808614905	AYWNWFUUDKAXPA-HNNXBMFYSA-N	440.518	1.135	50	20	IDGD	
C[C@@]1(NNC(=O)NCc2ccc(C(=O)OCc3ccccc3)cc2)CCS(=O)(=O)C1	812538856	VQYCEFFMUUSFAF-OAQYLSRUSA-N	431.514	1.925	50	20	IDGD	
COc1ccc([C@@H](O)C2CCN(C(=O)NNC(=O)CNC(=O)c3cccs3)CC2)cc1	812882672	UIAFPKIWHLKMMR-LJQANCHMSA-N	446.529	1.673	50	20	IDGD	
N#Cc1cc(C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cnc1C(F)(F)F	815478618	BYYQEWHIRDAGRL-UHFFFAOYSA-N	437.290	1.498	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(Br)c(C#N)c2)c(OC)c1	815568966	AMBPCMHPRVINDK-UHFFFAOYSA-N	447.245	1.738	50	20	IDGD	
CC(C)Oc1ccc(-c2ccc(NC(=O)C(=O)NNC(=O)[C@H]3COCCO3)c(F)c2)cc1	815570571	GYXXHBCFZDKPGX-LJQANCHMSA-N	445.447	1.781	50	20	IDGD	
O=C(NNc1ncncc1F)C(=O)Nc1ccc(C(=O)NCc2ccccc2F)cc1	815766033	LVOQJKKTLYVEKB-UHFFFAOYSA-N	426.383	1.767	50	20	IDGD	
CCC[C@@H](NC(=O)NCc1ccc(Br)cc1)C(=O)N1CC[C@@H](B(O)O)C1	864234527	SGIIBGSGOZTJLX-UKRRQHHQSA-N	426.120	1.492	50	20	IDGD	
Cc1nn(C)c2[nH]c(=O)c(CCC(=O)NNC(=O)Cc3nc4ccccc4n3C)c(C)c12	914846170	BMOALMPTVWKYJI-UHFFFAOYSA-N	435.488	1.088	50	20	IDGD	
CN1CCN(CCCNC(=O)NNc2ccc(-n3cccn3)nn2)[C@@H](c2ccccc2)C1	916485247	LOJUULVNIZSACN-LJQANCHMSA-N	435.536	1.667	50	20	IDGD	
COc1ccc(N2CCCN(CC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)CC2)cc1	917207736	HHGUSXKIJXEVQD-UHFFFAOYSA-N	427.461	1.577	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)c3ccc(F)c(S(=O)(=O)N(C)C)c3)n[nH]2)cc1	918695278	QWJAJMXTPNAULC-UHFFFAOYSA-N	445.476	1.849	50	20	IDGD	
CSCC[C@H](NC(=O)c1ccc([N+](=O)[O-])o1)C(=O)NNC(=O)c1cccc(N(C)C)c1	919805616	BQYXRCCQYZTZIF-AWEZNQCLSA-N	449.489	1.567	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])cc(OC)c1OC	920308488	SZCHIBFUOZXPTF-UHFFFAOYSA-N	445.837	1.897	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)Nc2cccc(CN3CCC[C@@H]3C(N)=O)c2)cc1	920930966	XWXGFVFPZOAKRD-LJQANCHMSA-N	441.488	1.377	50	20	IDGD	
O=C(NNC(=O)[C@H]1CS[C@H](Cc2ccccc2F)C(=O)N1)c1cccc([N+](=O)[O-])c1	935812233	ICUFFJRRLOKURZ-HZPDHXFCSA-N	432.433	1.338	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)C2(c3cccc(C#N)c3)CC2)CC1	1182816104	OXEQMTRMRYSUOR-UHFFFAOYSA-N	440.529	1.064	50	20	IDGD	
O=C(Cn1c(=O)oc2ccccc21)NNc1ccc(S(=O)(=O)Nc2nccs2)cc1	1318911205	WCKFRJHDZDDVPD-UHFFFAOYSA-N	445.482	1.995	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNS(=O)(=O)c2cnc(Cl)c(F)c2)CC1	1324622485	FGUQYYMOGDGBKF-UHFFFAOYSA-N	436.893	1.831	50	20	IDGD	
CC(=O)O[C@H](C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2)C(C)C	1778792335	NSSWZYHCXPMPKQ-YEWWUXTCSA-N	433.343	1.435	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H]3ON=C(c4ccccc4)O3)C2)C1	1778870870	KDFCGZPPJMAQDX-ORYQWCPZSA-N	435.908	1.959	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)CSCc3[nH]cnc3C)C2)C1	1778914129	XNRZZZSUKKAGCW-RDTXWAMCSA-N	430.958	1.035	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1csc(N)n1)C2	1779543964	VGGAVLJMIACWPY-RDTXWAMCSA-N	426.615	1.704	50	20	IDGD	
CCSc1cccnc1C(=O)N1CC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1	1780466285	YCJHXTSYEKYUAN-NRFANRHFSA-N	449.577	1.010	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)COC(=O)C(F)(F)F)C2	1780704831	UCOSOEPHBVLMAC-HWWQOWPSSA-N	428.835	1.623	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)CC(F)(F)C(=O)O)C2)[C@@H](F)Br	1780773725	UJCAUDYHGHKXLL-GLXFQSAKSA-N	445.232	1.301	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)[C@@H]3CCc4nc[nH]c4C3)CCO2)C1	1781231879	BBHHBKCGABSXCB-VMDGZTHMSA-N	429.348	1.581	50	20	IDGD	
Cc1cccn2ncc(C(=O)N3CCO[C@]4(CCN(C(=O)[C@H](F)Br)C4)C3)c12	1781332285	FUUPLRXHNYZBLI-YJBOKZPZSA-N	439.285	1.777	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](C)Nc1nccs1)CCO2	1783347773	ONOCVDRWGWLFKX-GDZNZVCISA-N	445.383	1.947	50	20	IDGD	
C[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CC[C@@]2(CN(C(=O)[C@@H](F)Cl)CCO2)C1	1783508692	CKGKNFPXTDAYCS-KKVAFCGZSA-N	441.887	1.666	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C[C@@H]3CCCCO3)C[C@@H]21	1783969413	MAEKSFZAXOHBHL-WOYTXXSLSA-N	431.371	1.956	50	20	IDGD	
Cc1cccc(CCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Br)C[C@@H]32)n1	1785118702	PGEAXXLSVMMGIK-OWIUFQIYSA-N	442.329	1.993	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(C)c([N+](=O)[O-])cn3)[C@H]2C1	1787640798	HFFAXUZTWBELGF-ZJOBFFGXSA-N	440.884	1.145	50	20	IDGD	
CC(C)=CCCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1	1788610020	LXYQPLDARHEWKE-SNRMKQJTSA-N	429.521	1.025	50	20	IDGD	
C[C@H](NC(=O)c1ccc(F)cc1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Cl)C[C@@H]21	1789695220	WARJPPOOXBVEJT-MUMJOVGASA-N	443.878	1.458	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3[nH]nc4ncccc34)C[C@@H]21	1789865928	JOTFGKWAAGXVLP-MDWPOOTQSA-N	440.331	1.788	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3Cc4ccccc4O3)C[C@@H]21)[C@@H](F)Br	1789925681	HHFLZHXTOFLYLU-XPYWIHLFSA-N	441.297	1.660	50	20	IDGD	
Cc1ncc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]3C2)s1	1789927086	PSIURYJOUQXVOI-NHULGOKLSA-N	434.331	1.664	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)c1ccc(-c2cc[nH]n2)cc1	1790186036	CRLCEHLJJVBFSJ-CAMMJAKZSA-N	432.908	1.270	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnn4c3CCC4)[C@H]2C1	1790391036	ZEHWJYWCYJJTBI-FAYQHZLMSA-N	439.354	1.596	50	20	IDGD	
O=C(C[C@@H]1NC(=O)NC1=O)NC1(c2ccc(NC(=O)[C@@H](F)Br)cc2)CCC1	1790532886	WKPWNNZVXZDNCC-WCQYABFASA-N	441.257	1.409	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3C[C@H]4CC[C@@H]3O4)[C@H]2C1	1791087037	WDNPBBVZBMVIPG-KDNLLOOPSA-N	429.355	1.565	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1ccc(C2(NC(=O)CCn3ccnn3)CCC2)cc1	1791603386	UZBPNQMOGFIQPG-UHFFFAOYSA-N	427.509	1.175	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)c1ccccc1OC(F)(F)F	1792666967	SEFZSTJNCNMXFR-NDPMZMCLSA-N	436.814	1.388	50	20	IDGD	
C[C@@H]1[C@@H](C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](O)CCl)CCN1C(=O)OC(C)(C)C	1793117421	KACPLADROIHRRB-JHMPBIJASA-N	443.972	1.870	50	20	IDGD	
Cc1ccc(CCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)c(C)n1	1796190548	KYVYUZAFGACJFS-KOUNCHBCSA-N	435.333	1.263	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cn1ccc3sccc3c1=O)C2)[C@@H](F)Cl	1796362070	YRRWVQXTWFWEPB-OXUXUCFPSA-N	427.885	1.187	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H]1C[C@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Cl)C1	1796370928	PBMPTPKCNUDISW-LOVFCKMRSA-N	433.908	1.414	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CC1CC1)C2	1798522460	ZBYPJMUYMZBFNV-YVWYUNDQSA-N	431.445	1.523	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1nc(O)n2c1CCCC2	1798661120	LQUQFERUFXNHRE-FVCCEPFGSA-N	425.327	1.960	50	20	IDGD	
Cc1nccn1CCCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@](C)(Cl)CCl	1799278627	RLMFRDHXXNIIDG-HIRMHNASSA-N	431.364	1.798	50	20	IDGD	
CCOCCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN(C)NC(=O)NCc1ccccc1	1799869691	WUUHSAWESVEVJP-ACDBMABISA-N	445.564	1.397	50	20	IDGD	
Cc1cc(C)n2ccc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)CCBr)C4)c2n1	1800136975	VZYUGGXJAAENOW-JLVBRIDZSA-N	449.349	1.939	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1n[nH]c2c(Cl)cccc12	1800895699	PJVNUPZHGZWOMJ-BTTYYORXSA-N	446.939	1.841	50	20	IDGD	
C[C@@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc3c(c1)n(C)c(=O)n3C)C2	1801962411	IOXHDHZHTGONEW-REBRKWNGSA-N	449.349	1.912	50	20	IDGD	
COC(=O)NCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2	1802701485	WUSHOJVBYKPOME-BTTYYORXSA-N	448.432	1.128	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cccc3nc[nH]c23)[C@@H]1c1cccnc1)[C@H](O)CCl	1803139859	XFVVZQKSKMSYJG-POZUXBRTSA-N	427.892	1.877	50	20	IDGD	
Cc1nc2ncccn2c1C(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1	1803142470	DOEBJDXFNYFYSL-RYRKJORJSA-N	442.907	1.352	50	20	IDGD	
CCS(=O)(=O)CC(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)Br)[C@@H]1c1cccnc1	1803518086	PKOLPVUFUXMYER-IVMMDQJWSA-N	446.367	1.306	50	20	IDGD	
Cn1cccc(C(=O)NC[C@@H]2CCN(C(=O)CO[Si](C)(C)C)[C@H]2c2cccnc2)c1=O	1803833945	JSOCSQHUEZEEJK-PXNSSMCTSA-N	442.592	1.951	50	20	IDGD	
COc1ccc(CCC(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)cn1	1804261083	SFFSOOBPAZQQEN-WFXMLNOXSA-N	446.935	1.724	50	20	IDGD	
O=C(CCc1ccc(F)nc1)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1	1804436316	DOZSXDVIESOOEQ-ABSDTBQOSA-N	434.899	1.854	50	20	IDGD	
Cc1cccc(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)n1	1805508505	WAKHIDJQLFHGNL-SIKLNZKXSA-N	444.300	1.098	50	20	IDGD	
Cc1nc(CC(=O)N2CCCC3(CCN(C(=O)CCC(=O)NN(C)C)CC3)C2)cs1	1807045187	HBBWTIBTYCVVKX-UHFFFAOYSA-N	435.594	1.598	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)C2(N3CCN(C)CC3)CC2)[C@@H]1c1cccnc1	1807950293	GBYWIJXKKWJYRO-UFYCRDLUSA-N	448.011	1.885	50	20	IDGD	
Cc1cc(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)c[nH]1	1808774185	BQTHDJVKYBZMKB-GHTZIAJQSA-N	432.289	1.031	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)c3nc4ccccc4[nH]3)CC2)C1	1809972047	LFKZHHXZZMEFOB-UHFFFAOYSA-N	446.316	1.401	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)c1ccc2cncn2c1	1810007413	UUIDWUVLEVGUGL-SNRMKQJTSA-N	427.892	1.649	50	20	IDGD	
CC(=O)N/C(C)=C/C(=O)NC[C@@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1	1812317770	YYMIIBOZYSVBRX-UZLNTIBLSA-N	437.338	1.912	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](Cl)COC)[C@H]1c1cccnc1	1812368208	YHOKHOUAXNCOAA-IWCQGFGOSA-N	441.912	1.903	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CN2CCOC2=O)n[nH]1	1815028878	RJYBAZYIXSCHTN-ZYHUDNBSSA-N	428.287	1.637	50	20	IDGD	
Cc1ccsc1C(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1	1815339901	SSLYUCBVQSKAGD-AWEZNQCLSA-N	441.343	1.732	50	20	IDGD	
O=C(CCc1ccoc1)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1	1815347909	XCQCAQLJAJWZNP-MRXNPFEDSA-N	439.302	1.275	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CNCP(=O)(O)O)n[nH]1	1817232157	NIOSFMNEEUKEBB-YPMHNXCESA-N	435.849	1.534	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)Cc2ccsc2)[nH]n1)c1ccc(B(O)O)cc1	1817471705	XNWCOGQDJVGNLR-SFHVURJKSA-N	438.318	1.700	50	20	IDGD	
O=C(Cn1ccccc1=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](F)Br)[nH]n1	1817520339	PLPVAMIIVMNDTE-WBMJQRKESA-N	440.273	1.954	50	20	IDGD	
C=CCO[C@H](C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819401617	LCAYALLYDUHBJZ-CXAGYDPISA-N	441.492	1.305	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@](C)(Cl)CCl)CC2	1820148864	WRXRHFIQBLPIMV-GPHJXTMHSA-N	433.361	1.982	50	20	IDGD	
Cc1cc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)CCC(=O)NN(C)C)CC3)ccn1	1820490933	KQJOTXTVOARXHI-CQSZACIVSA-N	430.534	1.445	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)CC[C@@H]2CCOC2)[nH]n1	1822417672	LJNKJXOOZLDKMD-NVXWUHKLSA-N	434.541	1.592	50	20	IDGD	
CC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)Cn1cc(C)c(O)nc1=O)CC2	1822858096	WHDPHIUWMVPDQS-QWRGUYRKSA-N	439.925	1.343	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(=O)n3[nH]nnc3n2)CC1	1824614244	JUFFPOSIUZDSSN-HOCLYGCPSA-N	449.943	1.453	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)C[C@@H]2NC(=O)NC2=O)CC1	1825069816	ATNULYLPPYDEIR-JYJNAYRXSA-N	426.945	1.612	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](C)Cn1cncn1)CC2	1825640583	CYMNJGVFXBVNEG-VWYCJHECSA-N	441.355	1.766	50	20	IDGD	
CC(C)c1cc(C(=O)N[C@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)on1	1826088786	OXAHZOOBSMDMAW-LBPRGKRZSA-N	448.549	1.853	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CN2CCNC2=N)CC1	1826873580	NCXHQFWLKOHRPA-CVEARBPZSA-N	442.402	1.620	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@H]1CCc2nc(NC(=O)C3CC(=O)C3)sc2C1	1828062407	RYJDHSBOTSZAMA-LUKCILAXSA-N	442.501	1.168	50	20	IDGD	
Cc1ncoc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2	1830537608	LFKSLKIMHSOMRO-YVEFUNNKSA-N	430.299	1.084	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccnc3OCC)C2)C1	1831638462	CWWMLIFAKDGNQN-LAUBAEHRSA-N	439.940	1.958	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ncc(F)cc3F)C2)C1	1831641013	UMJBXGTYZAMMHL-IFXJQAMLSA-N	431.867	1.837	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4n(n3)CCCC4)C2)C1	1831650220	FQCMRZNRRQGONE-UWJYYQICSA-N	438.956	1.697	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)c2cc(F)c[nH]2)CC1	1831706188	BLDPCVPLZSWUKI-HXUWFJFHSA-N	427.285	1.381	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CCc2nc(N)n[nH]2)CC1	1831830973	KYFCLSDJDFNHNK-CABCVRRESA-N	426.949	1.193	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CCc2ccc(O)nn2)CC1	1831834966	LSVOFMLZXQRKNG-MSOLQXFVSA-N	438.956	1.988	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cn3nnc4ccccc43)CCO2)C1	1832199012	PWNYJJCQUOOHIX-KKSFZXQISA-N	449.939	1.295	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)C[C@H]3CCCCO3)CCO2)C1	1832350414	HJONAKIBMVRBQF-DAYGRLMNSA-N	433.343	1.185	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1)[C@@H](O)c1ccco1	1833088718	XBGHRPAPBFGZQG-HOTGVXAUSA-N	446.317	1.575	50	20	IDGD	
CC(C)(CCl)C(=O)NC1CCN(C2CCN(C(=O)CN3CCOCC3)CC2)CC1	1833214372	UYOQUYDRBZDOPH-UHFFFAOYSA-N	429.005	1.155	50	20	IDGD	
C[C@H](CS(C)(=O)=O)C(=O)NC1CCN(C2CCN(C(=O)C(Cl)Cl)CC2)CC1	1833484098	CLIUNDHNMUFMRI-GFCCVEGCSA-N	442.409	1.042	50	20	IDGD	
Cc1ncc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@](C)(Cl)CCl)C3)C2)cn1	1833814632	DBIZKOMBYGMWQV-MSOLQXFVSA-N	431.320	1.091	50	20	IDGD	
CN(C)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)[C@H](F)Cl)CC2)CC1	1834015763	NYRSNWNJLJERTR-SFHVURJKSA-N	425.936	1.867	50	20	IDGD	
Cc1noc(CC(=O)NC2CCN(C3CCN(C(=O)[C@](C)(Cl)CCl)CC3)CC2)n1	1834851957	ZPAQEYGGISKAAO-LJQANCHMSA-N	446.379	1.728	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccc(F)c(F)c3)CCO2)C1	1835140421	GUJLZQWDLYKDDC-MGPUTAFESA-N	430.879	1.981	50	20	IDGD	
COc1nc(C)ccc1C(=O)NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1835999626	WVKQHSLNJUIHFJ-SFHVURJKSA-N	438.956	1.184	50	20	IDGD	
Cc1nccn1[C@@H](C)C(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836720565	XFVOPHOPDDPQKX-KBXCAEBGSA-N	426.945	1.351	50	20	IDGD	
O=C(CCC1CCC1)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1	1836796405	MIOUFISFDIJYNF-UHFFFAOYSA-N	442.365	1.559	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cccc(Cl)n3)C2)C1	1839142545	RPNPPGGSMVDDFR-KXBFYZLASA-N	430.332	1.751	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)COc3cccnc3)C2)C1	1839150513	OFWFEWWPQIGLBV-OALUTQOASA-N	446.331	1.153	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCBr)C2)C1	1839150911	BUZKFIXKZXIAAM-LSDHHAIUSA-N	446.169	1.464	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccccn3)C2)C1	1839152328	WOQAERVWOSBOPD-MOPGFXCFSA-N	430.332	1.317	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3[C@H]4C=CS[C@@H]43)C2)C1	1839155148	KLUZMZQLCNTEKO-ZVPUSRDESA-N	435.373	1.554	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cncc(O)c3)C2)C1	1839155633	ZOTMKMSVFUYHFV-ROUUACIJSA-N	432.304	1.094	50	20	IDGD	
COC1(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)CCC1	1839156498	RIHRQLMUPWEPIJ-IEBWSBKVSA-N	437.364	1.638	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3ccoc3)C2)C1	1839156622	WCDCKPRKHNLWBZ-OALUTQOASA-N	433.332	1.905	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3oc(C)nc3C)C2)C1	1839965465	ZIVYRAODLQWLSY-KBXCAEBGSA-N	444.326	1.535	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(F)c3C)C2)C1	1840149199	HSHNGKIGSIJKHP-JXFKEZNVSA-N	428.888	1.458	50	20	IDGD	
CC[C@H](C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](Cl)COC)CCO2)c1ccccc1	1840151271	ZEEQSADZWBUSMW-NNMXDRDESA-N	438.952	1.890	50	20	IDGD	
COc1cc(Br)ccc1CC(=O)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1	1841354113	IWNAHFWZHLPPJW-CQSZACIVSA-N	445.741	1.803	50	20	IDGD	
CS(=O)(=O)Cc1ncccc1C(=O)N1CC2(CCCN2C(=O)CCBr)C1	1842637332	BKSBPAGYBZQJIF-UHFFFAOYSA-N	444.351	1.228	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)CCc2ccccc2Cl)C1	1842753696	XZPRGYAJPJOJFV-UHFFFAOYSA-N	426.709	1.470	50	20	IDGD	
CC[C@@H](NC(N)=O)C(=O)N1CCCC12CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)C2	1843338739	DLSSJEWYPJTBOK-LEHPZIBWSA-N	431.443	1.522	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)C1CCC(CO)CC1)C2	1843415339	MUMBZAUIHPMRLX-BUVRLJJBSA-N	429.521	1.123	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC12CN(C(=O)c1c(Br)cnn1C)C2	1846176972	QDROEIMBTBITEZ-VIFPVBQESA-N	434.132	1.783	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)c1cc(S(C)(=O)=O)ccc1F)C2	1846364576	XWRLSECHONUYLH-CQSZACIVSA-N	432.901	1.300	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2cc(C)c(O)c(C)c2)C1	1846794486	CGLWWFOLMYOLJJ-PCLIKHOPSA-N	437.500	1.960	50	20	IDGD	
O=C(/C=C/c1ccc(F)cc1F)N1CC[C@H]2[C@@H]1CCN2C(=O)c1ccc(B(O)O)cc1	1847985249	KAGBIAFWLUFLEZ-SSFOPSIHSA-N	426.228	1.173	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CCN1C(=O)c2ccccc2C1=O	1848087130	KJTCUJZYOPCUIV-KCXAZCMYSA-N	448.317	1.658	50	20	IDGD	
Cc1cc(=O)c(C(=O)NNC(=O)c2cc(Br)c[nH]2)nn1-c1ccccc1F	28717565	DUBMEEGIBUJNSU-UHFFFAOYSA-N	434.225	1.845	50	20	IDGD	
Cc1c(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cnn1-c1ccccn1	105967944	AKAWFJPUMPQXGS-UHFFFAOYSA-N	433.516	1.549	50	20	IDGD	
COc1cccc2c1OCC[C@@H]2NC(=O)NNC(=O)c1csc(N2CCOCC2)n1	725874682	LRQFGRXWIGHXKX-ZDUSSCGKSA-N	433.490	1.456	50	20	IDGD	
COCCCN1CCC(NC(=O)NNC(=O)COc2ccc(Br)cc2)CC1	727031526	UMWINTBIKQIACD-UHFFFAOYSA-N	443.342	1.659	50	20	IDGD	
CCC[C@H](NC(=O)NNC(=O)Cn1nc(C)cc1C)C(=O)N1CCc2sccc2C1	727227537	BDPIPIYTUMZRKO-INIZCTEOSA-N	432.550	1.645	50	20	IDGD	
CCn1cc(S(=O)(=O)NNC(=O)[C@H]2Cc3ccccc3CN2Cc2ccccc2)cn1	727360185	ZKXQXZXLCHHYAC-OAQYLSRUSA-N	439.541	1.840	50	20	IDGD	
CC(C)CCC(=O)NNC(=O)N1CCN(S(=O)(=O)c2cccc([N+](=O)[O-])c2)CC1	727482805	UHLXNHHHWCQPJM-UHFFFAOYSA-N	427.483	1.078	50	20	IDGD	
COc1ccccc1C(=O)N[C@H](CCS(C)(=O)=O)C(=O)NNc1ccc(F)cc1F	727865770	VOCLEKSJFVKOLV-MRXNPFEDSA-N	441.456	1.650	50	20	IDGD	
COC[C@@H](C)n1c(C)cc(/C=C(/C#N)C(=O)N2CCN(C(=O)CN3CCCC3)CC2)c1C	728551766	MZGPHJMYMPYQMT-HBEGMLAUSA-N	441.576	1.986	50	20	IDGD	
Cc1c(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)nnn1-c1ccccc1Cl	728846957	XVSUSOKLJPBCCC-UHFFFAOYSA-N	440.895	1.697	50	20	IDGD	
CS(=O)(=O)c1ccc(OCCNC(=O)NNC(=O)Cc2ccc(Cl)cc2)cc1	730066076	CYCIGNSCYBFVQV-UHFFFAOYSA-N	425.894	1.695	50	20	IDGD	
COCCN(CCOc1ccc(F)cc1)C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	731218303	AEHZFVYJKRCZEL-UHFFFAOYSA-N	443.439	1.183	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2nnc(O)c3ccccc23)nnn1-c1ccc2c(c1)OCCO2	731454014	YORWLQLBSVBOBG-UHFFFAOYSA-N	447.411	1.071	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1)c1ccc2c(c1)OCO2	732051272	DLZXAFUBHRIRKT-LLVKDONJSA-N	432.414	1.451	50	20	IDGD	
CCOc1ccccc1[C@H](CC(=O)NNC(=O)CCN1C[C@H](C)O[C@H](C)C1)NC(C)=O	732259609	IHEZXHMAGZBYFE-FCEWJHQRSA-N	434.537	1.299	50	20	IDGD	
Cc1cc(CSc2ncccc2C(=O)NNC(=O)CCN2C[C@@H](C)O[C@H](C)C2)no1	732260161	BNYDYTGTPPERHW-HUUCEWRRSA-N	433.534	1.931	50	20	IDGD	
O=C(CCNC(=O)N1CCc2ccccc2C1)NNC(=O)c1nn(-c2ccccc2)cc1O	732262616	VQPSELUJFBCIEE-UHFFFAOYSA-N	448.483	1.497	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)c2cn(-c3ccccc3C(F)(F)F)nn2)C[C@@H](C)O1	732263137	KSAFPRDBHVUFBC-CHWSQXEVSA-N	440.426	1.546	50	20	IDGD	
Cc1nc(CN2CCC(CNC(=O)NNc3ccc(-n4cccn4)nn3)CC2)oc1C	732475547	IFBNHLTZPUUEST-UHFFFAOYSA-N	425.497	1.805	50	20	IDGD	
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC[C@H](C(=O)NNc2cc(F)c(F)cc2F)C1	734553478	NUPGCEGYQHWYSL-NSHDSACASA-N	431.440	1.988	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)[C@@H]2CC(c3ccccc3)=NO2)CC1	734824929	NMNIUXXVUPQJTK-KRWDZBQOSA-N	431.493	1.910	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)N[C@@H]2CCN(c3cnn(C)c3)C2=O)c(C)n1C[C@@H]1CCCO1	735447905	GWHXHLXQKKXKSP-SYWXZGPASA-N	436.516	1.846	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccnc(-n3cccn3)c2)c1	739676641	ZMIVXYWWCWEKJR-UHFFFAOYSA-N	442.501	1.373	50	20	IDGD	
O=C(CCSCc1nc(O)c2ccccc2n1)NNC(=O)CNC(=O)c1cccs1	739709830	OTDXHXTZASOPSY-UHFFFAOYSA-N	445.526	1.598	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCCCCC2)cc1C(=O)NNc1ncnc2[nH]cnc12	740746836	RFACFYLFQBRTFV-UHFFFAOYSA-N	445.505	1.683	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1ccc2c(c1)OCCO2)[C@H]1CN(Cc2ccccc2)CCO1	741285226	ZMMDBOWFVKJYKJ-HRAATJIYSA-N	440.500	1.691	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)N[C@@H]2[C@@H]3CCO[C@H]3C2(C)C)c2ccccc2c1=O	741426228	QLWPUGNSVMAZGL-CGTJXYLNSA-N	427.505	1.954	50	20	IDGD	
CCCn1nc(C(=O)NNS(=O)(=O)c2c(C)nn(CC)c2C)c2ccccc2c1=O	741647933	SZUMBEMEQFXVRN-UHFFFAOYSA-N	432.506	1.263	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2c(C(C)C)nn(C)c2Cl)cc1	741661628	XDRCSEDFYVMTEA-UHFFFAOYSA-N	441.941	1.587	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)[C@H]1CCCN(C(=O)N2CCc3sccc3C2)C1	741696042	WNASHYQVYAJYKT-HNNXBMFYSA-N	449.577	1.390	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CN2CCN(C(=O)c3cccc4ccccc34)CC2)c1	744386508	NLMSMJDERQXMDP-UHFFFAOYSA-N	441.491	1.930	50	20	IDGD	
Cc1ccc(N2C[C@@H](C(=O)OCC(=O)NNC(=O)c3cccc(C#N)c3)CC2=O)cc1F	744496530	BAPRYBXMNXGQHG-INIZCTEOSA-N	438.415	1.363	50	20	IDGD	
O=C(COC(=O)c1cc(N2CCOC2=O)ccc1F)NNC(=O)c1cccc([N+](=O)[O-])c1	745135454	WWMAWVJFHJCMLB-UHFFFAOYSA-N	446.347	1.309	50	20	IDGD	
O=C(NC[C@H](c1cccc(F)c1)N1CCOCC1)NNC(=O)c1cc([N+](=O)[O-])ccc1O	745782009	ALXOBBUXWJCUAK-QGZVFWFLSA-N	447.423	1.457	50	20	IDGD	
C[C@@H]1C[C@@H](NC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)C(=O)N1c1ccccc1	745883032	RHVSKZIYWHIFEA-CXAGYDPISA-N	445.501	1.620	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN(C)C2CCN(C(=O)OC(C)(C)C)CC2)n1	746661071	FZZZOUGGCDSOGF-UHFFFAOYSA-N	425.555	1.473	50	20	IDGD	
O=C(NNc1cc(F)c(F)c(F)c1)NC1CCN(S(=O)(=O)C2CCOCC2)CC1	746768272	BTCNTKHYAHKZQQ-UHFFFAOYSA-N	436.456	1.703	50	20	IDGD	
CCOCCCn1c(NNC(=O)[C@H]2CCCN2c2ncccn2)nc2ccccc2c1=O	747393870	VAMQLVPGESTDJX-GOSISDBHSA-N	437.504	1.725	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NCCNS(=O)(=O)c2cccs2)cc1C	747437648	MSAWCZIGLXDUOD-UHFFFAOYSA-N	426.520	1.053	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)NCCOc2ncccc2C(F)(F)F)nc2ccccc21	747446597	BLURMXQLTXDHPT-UHFFFAOYSA-N	436.394	1.939	50	20	IDGD	
CC(C)CN1C[C@H](C(=O)NNc2ccc(S(=O)(=O)Nc3nccs3)cc2)CC1=O	747944708	WVSOQZUXULBDQE-CYBMUJFWSA-N	437.547	1.892	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)COc2ccc3c(C)cc(=O)oc3c2)n1	748128529	ATCUOSQBDOBMJT-UHFFFAOYSA-N	445.453	1.178	50	20	IDGD	
O=C(COC(=O)Cc1coc2cc(F)ccc12)NNC(=O)[C@H]1COc2ccccc2O1	748229206	MYJCIAQMBWYKGB-GOSISDBHSA-N	428.372	1.645	50	20	IDGD	
CCOC(=O)N1CCN(S(=O)(=O)NNC(=O)c2cc3c(s2)CC[C@@H](C)C3)CC1	748673977	IVUHDLAQQVJXEV-GFCCVEGCSA-N	430.552	1.126	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)Cc2ccc(C(=O)NNC(=O)c3ccnn3C)cc2)cc1	748830977	LRIILMGVWMIWQG-UHFFFAOYSA-N	441.513	1.624	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCc2ccc(OCC3CC3)nc2)c2ccccc2c1=O	749187462	LVEMADKIGNECCO-UHFFFAOYSA-N	436.472	1.744	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3cc(-c4ccccn4)no3)cc2)CC1	751060566	HTLUJGAEBKLPPJ-UHFFFAOYSA-N	442.501	1.430	50	20	IDGD	
Cc1noc(C)c1[C@H](C)CNC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	752700011	LKRDXUGGPCVSRQ-MRXNPFEDSA-N	428.537	1.938	50	20	IDGD	
O=C(Nc1ccccc1S[C@@H](Cl)C(F)(F)F)C(=O)N1CCN(CCO)CC1	755311179	ZAWGGQIYNGXXOX-OAHLLOKOSA-N	425.860	1.981	50	20	IDGD	
COC(=O)CNC(=O)Cc1ccc(NC(=O)NNC(=O)COc2cc(C)ccc2C)cc1	755862978	YTTMBGGVRFFXRC-UHFFFAOYSA-N	442.472	1.367	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)Nc2cccc(Cn3nc4ccccn4c3=O)c2)n1	755938220	NZCNOXFZKJDXEP-UHFFFAOYSA-N	434.460	1.211	50	20	IDGD	
NC(=O)CCOc1ccccc1NC(=O)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	756068664	XWSCZHSIQROWJS-UHFFFAOYSA-N	426.408	1.937	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2ccc(CCC(=O)OC)cc2)c2ccccc2c1=O	756432490	IRGJJXFOHWXSNN-UHFFFAOYSA-N	437.456	1.989	50	20	IDGD	
CN(Cc1cccc(NC(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)c1)C(=O)OC(C)(C)C	756664873	QSNYSDITTUFMCK-CQSZACIVSA-N	440.522	1.641	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)Nc2cnn(-c3ccccc3S(C)(=O)=O)c2)c1O	756706236	NWNNDTRPNOHNSU-UHFFFAOYSA-N	445.457	1.457	50	20	IDGD	
COC(=O)c1cc(NC(=O)NNC(=O)c2nnc(O)c3ccccc23)c(OC)c(OC)c1	756742136	KIIUNEDUBDDHID-UHFFFAOYSA-N	441.400	1.606	50	20	IDGD	
CC(C)c1ccc(S(=O)(=O)N2CCC(C(=O)NNc3ccc(C(N)=O)nn3)CC2)cc1	757390150	BCGFPTACBSVVJE-UHFFFAOYSA-N	446.533	1.243	50	20	IDGD	
Cc1ccccc1NS(=O)(=O)c1ccc(C(=O)NNc2ccc(C(N)=O)nn2)cc1	757406467	BNRYPJLLJWYCLP-UHFFFAOYSA-N	426.458	1.442	50	20	IDGD	
NC(=O)c1ccc(NNC(=O)c2cccc(S(=O)(=O)Nc3cccc(Cl)c3)c2)nn1	757406479	BSNUBYSPFNIUEG-UHFFFAOYSA-N	446.876	1.787	50	20	IDGD	
COc1ccc(C(C)(C)C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1OC	757644038	JSNXTENCJZPEEU-UHFFFAOYSA-N	427.505	1.835	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)Nc1ccccc1CN1CCNC1=O	757920949	UMMMNILCQWHLIP-UHFFFAOYSA-N	434.497	1.669	50	20	IDGD	
CCOc1nc(C(F)(F)F)ccc1C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	758287043	VBRMKDYHONNTKQ-UHFFFAOYSA-N	438.410	1.967	50	20	IDGD	
O=C(NNS(=O)(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)c1ccccc1O	760334475	HCWXZAYYWFYVPO-UHFFFAOYSA-N	439.515	1.190	50	20	IDGD	
CCc1ccc(-c2noc([C@H](C)NC(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)n2)cc1	760718577	VUTBJRZLJGEBHC-ZDUSSCGKSA-N	447.459	1.980	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)ccc1Cl	763471324	HTBSMPKSBZUSST-UHFFFAOYSA-N	434.792	1.825	50	20	IDGD	
O=C(NNC(=O)c1ccccc1O)C(=O)Nc1ccc(C(=O)NCCc2ccccc2)cc1	763530660	YUMYHOHZZVGHEP-UHFFFAOYSA-N	446.463	1.764	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cnn(CC(C)C)c2C(F)F)cc1OC	763541749	AXLCEEPPKSOPFF-UHFFFAOYSA-N	439.419	1.894	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)Nc1ccc(Oc2cccnc2)nc1	763569454	AAYFUMQMIFGXNE-KRWDZBQOSA-N	435.396	1.195	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)C(=O)Nc2cccnc2-n2cccn2)c1	763596281	UKEQXTRAUPWAON-UHFFFAOYSA-N	436.472	1.864	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(F)c(Br)c2)cc1	763675194	UGMMZONMADWECL-UHFFFAOYSA-N	435.209	1.625	50	20	IDGD	
Cc1cc(C)n(-c2ccc(NC(=O)C(=O)NNC(=O)COc3ccccc3F)cc2F)n1	763682296	LYPPEJPKCIOIDF-UHFFFAOYSA-N	443.410	1.932	50	20	IDGD	
CN(C)C(=O)c1cc(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)ccc1F	763685420	VGBYEADOLVDJHQ-UHFFFAOYSA-N	436.827	1.346	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)C(=O)Nc1cccc(-c2noc(C3CC3)n2)c1	763838062	MMQOIOJCYLEGTM-UHFFFAOYSA-N	439.403	1.918	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cc(OC)c(OC)cc2C)cc1	763861229	NBFYPZAAPLBKLN-AWEZNQCLSA-N	445.472	1.964	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)NNC(=O)C(=O)Nc1ccccc1CN1CCNC1=O	763865249	NBRAKLOLMYUAHK-UHFFFAOYSA-N	434.456	1.022	50	20	IDGD	
Cc1ccnn1-c1ccccc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccc(F)cc1	763865598	LREAQEDZPRULTK-CQSZACIVSA-N	425.420	1.873	50	20	IDGD	
O=C(NNC(=O)c1ccc(Br)s1)C(=O)Nc1c[nH]nc1-c1ccccn1	763938559	HVOOYWBTLSXQSL-UHFFFAOYSA-N	435.263	1.695	50	20	IDGD	
CNC(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Br)s2)cc1	763940095	DHAIFNFUZZHDDB-UHFFFAOYSA-N	439.291	1.199	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)CC(C)(C)O2	764002441	MISWWXCHQFPUQK-UHFFFAOYSA-N	435.278	1.901	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)c1cnn(CC(=O)NC2CCCCC2)c1	764047850	XBOSATPIKHOZTJ-UHFFFAOYSA-N	431.518	1.591	50	20	IDGD	
O=C(NNC(=O)c1ccc2ccccc2c1)C(=O)Nc1ccc2nc3n(c(=O)c2c1)CCC3	764061781	MZKBGGPUJSCULY-UHFFFAOYSA-N	441.447	1.896	50	20	IDGD	
CCNC(=O)c1ccc(C)c(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(C)cc3)[nH]n2)c1	764110188	GYMWWVCNGSOYCX-UHFFFAOYSA-N	448.483	1.843	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccnn2-c2cccc(Cl)c2)c1O	764131557	IFBHLBWRKQJRIX-UHFFFAOYSA-N	429.820	1.640	50	20	IDGD	
O=C(CCc1ccco1)NNC(=O)C(=O)Nc1cc(Br)cnc1-n1cccn1	764168857	HJDLEDHWOQFJEN-UHFFFAOYSA-N	447.249	1.342	50	20	IDGD	
COC(=O)[C@H](C)Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)cc1	764169093	UFJIGPKPDPFZFP-ACJLOTCBSA-N	425.441	1.128	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)C(=O)Nc1cc(C(F)(F)F)ccc1-n1cccn1	764264548	UZNVNQXLJABPCV-UHFFFAOYSA-N	432.362	1.615	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)N1CCc2ccc(Br)cc21	764276885	DQFKRBFZZGNISZ-UHFFFAOYSA-N	434.246	1.270	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)C(=O)Nc1c2c(nn1-c1ccccc1)CCC2	764287837	AYEMOHZDFPXMMM-UHFFFAOYSA-N	433.468	1.785	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)Cc2ccccc2F)sc2c1CCC2	764320516	ZQGBXUYXKZCLTL-UHFFFAOYSA-N	433.461	1.881	50	20	IDGD	
NC(=O)[C@@H]1CC(C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)=NN1c1ccccc1	764329032	FHXJBRMCCSYKIC-KRWDZBQOSA-N	442.426	1.420	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)C(=O)Nc1ccc(S(=O)(=O)NC2CC2)cc1)c1ccccc1	764329251	VTXYCYRKBBFEHZ-GOSISDBHSA-N	444.513	1.407	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)C(=O)Nc1ccc(CN2C(=O)CNC2=O)cc1)c1ccccc1	764330282	TXMRSCPRILBGPJ-QGZVFWFLSA-N	437.456	1.018	50	20	IDGD	
COc1cccc(NNC(=O)Cc2ccc(CC(=O)NNc3cccc(OC)n3)cc2)n1	764342536	POKKLBIIIHBGJL-UHFFFAOYSA-N	436.472	1.865	50	20	IDGD	
Cc1cc(C(=O)N2CCCC2)ccc1NC(=O)C(=O)NNC(=O)c1ccc(O)c(Cl)c1	764349727	UJWHJOVYKXZRCZ-UHFFFAOYSA-N	444.875	1.990	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)N[C@@H](Cc1ccccc1)CN1CCOCC1	764408454	IERZXADTVIJWPX-SFHVURJKSA-N	444.557	1.758	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)c1ccc2c(c1)COC2	765753316	DXEUHYVCXPFXAX-UHFFFAOYSA-N	428.920	1.949	50	20	IDGD	
CCOc1ccc(C(=O)N2CCCCC2)cc1NC(=O)C(=O)NNc1nccnc1OC	766264798	OYQPRGWDFOWQOK-UHFFFAOYSA-N	442.476	1.592	50	20	IDGD	
CC(C)CCC(=O)NCC(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	766668697	MKDPYTOKBFPCDC-UHFFFAOYSA-N	437.972	1.157	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1ccc(C#N)cc1)C(=O)NNC(=O)c1cc(-c2ccccc2)[nH]n1	767823198	HMCRWDAQRSVFJX-CYBMUJFWSA-N	438.469	1.076	50	20	IDGD	
N#Cc1ccccc1NC(=O)CCCC(=O)NNC(=O)c1csc(N2CCOCC2)n1	770394548	KMKCWMKDRDFUDH-UHFFFAOYSA-N	442.501	1.421	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)CCCN3C(=O)c4cccc5cccc(c45)C3=O)nc21	770974773	QFSJJSGRZLVRKV-UHFFFAOYSA-N	445.439	1.742	50	20	IDGD	
CO[C@@H](c1ccc(F)cc1)[C@H](C)NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	771434571	PLBKRLONPMQWLV-KPZWWZAWSA-N	427.436	1.793	50	20	IDGD	
Cn1c(N)c(C(=O)/C(C#N)=C/c2ccc3ccc(Br)cc3n2)c(=O)n(C)c1=O	771520492	MGQSBDQEQMLGHT-YRNVUSSQSA-N	440.257	1.767	50	20	IDGD	
C[C@H]1CN(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)[C@H](C)CN1C(=O)OC(C)(C)C	771904787	MWYZDEZNBHFBOM-KGLIPLIRSA-N	444.496	1.346	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)[C@@H](c1ccc(Cl)cc1Cl)N1CCOCC1	772160321	CEHKKIGSTRDWMX-MEDUHNTESA-N	432.304	1.856	50	20	IDGD	
CC(=O)N1CCc2ccccc2[C@H]1CC(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772195758	PZGPKVOMHJQCSP-LJQANCHMSA-N	442.903	1.640	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)[C@@H]1CCN(c2ccc(F)cc2)C1=O	772897772	LWVSMUKFJHCKPW-INIZCTEOSA-N	432.839	1.296	50	20	IDGD	
CCC(=O)N1CC[C@@H](C(=O)NNC(=O)c2nc(-c3ccccc3)n(-c3ccccc3)n2)C1	773061051	XYVMXIYIBKKVNJ-QGZVFWFLSA-N	432.484	1.954	50	20	IDGD	
Cc1oc2ccc(NC(=O)C(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)cc2c1C	773493841	JCOANUILYOHKTE-UHFFFAOYSA-N	433.424	1.696	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2cc(OC)c(OC)cc2Br)n1	773730664	JVBAHAJPZJDJKS-UHFFFAOYSA-N	426.227	1.347	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccc(OC2COC2)cc1	774008253	KNOFTBKKJFMMTE-GFCCVEGCSA-N	433.848	1.671	50	20	IDGD	
C[C@@]1(NNC(=O)N[C@@H]2CCN(c3ccccc3C(F)(F)F)C2=O)CCS(=O)(=O)C1	776183779	WCOLJOYLVVXJMQ-MLGOLLRUSA-N	434.440	1.192	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)[C@H](c2cnn(C)c2)N(C)C(=O)OC(C)(C)C)c1	776315261	SIJMFVTZBOHJKK-KRWDZBQOSA-N	430.509	1.855	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2ccc(N)c(OC(F)(F)F)c2)n1	778357133	LWNYVZBJZGSVAQ-UHFFFAOYSA-N	432.380	1.479	50	20	IDGD	
Cc1ccc(-n2cnnc2SCC(=O)NNC(=O)CNC(=O)OC(C)(C)C)cc1C	778448053	KLPTZIMGUKHGBD-UHFFFAOYSA-N	434.522	1.648	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)c3cc(S(=O)(=O)N(C)C)cn3C)n[nH]2)c1	778690589	ZMDBXHITLVIUPR-UHFFFAOYSA-N	444.517	1.357	50	20	IDGD	
O=C(/C=C\C(=O)Nc1ccc2n[nH]cc2c1)NNC(=O)C(=O)NCc1ccc(Cl)cc1	778958773	SRMACHHQRXKXCZ-FPLPWBNLSA-N	440.847	1.175	50	20	IDGD	
COC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(NC(=O)NNc3ccccn3)cc2)C1	779012361	UANKAZVIGXKBFU-AWEZNQCLSA-N	433.490	1.804	50	20	IDGD	
O=C(O)c1cc(S(=O)(=O)NNC(=O)[C@H]2COc3ccccc3O2)c(F)c(Cl)c1F	779830504	WKIAVEVBUAHNJZ-SNVBAGLBSA-N	448.787	1.466	50	20	IDGD	
C[C@H](CS(=O)(=O)c1ccc(F)cc1)C(=O)NNC(=O)CCNC(=O)OC(C)(C)C	780978197	NCGSHJKYMPWVNA-GFCCVEGCSA-N	431.486	1.298	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2cnc3ncc(Br)cc3c2)C[C@H](C)O1	781886838	USMGRYLHWPBGNM-RYUDHWBXSA-N	436.310	1.653	50	20	IDGD	
C[C@@H]1CCCCN1CC(=O)Nc1ccc(F)c(NC(=O)C(=O)NN=c2cc[nH]cc2)c1	783376202	JELNMDDTNVJLQZ-CQSZACIVSA-N	428.468	1.537	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccc(OCC(F)(F)F)cc2)cn1	784368630	MWMHVAGJYCPEFI-UHFFFAOYSA-N	432.380	1.508	50	20	IDGD	
O=C(NNc1cc(F)c(F)cc1F)C(=O)Nc1cccc(S(=O)(=O)NC2CC2)c1	784891869	ILTBHLALHYIXOV-UHFFFAOYSA-N	428.392	1.626	50	20	IDGD	
CCOc1nc2ccc(C(=O)NNC(=O)c3sc(N4CCOCC4)nc3C)cc2[nH]1	788267275	LQYZXCBZJIKHLW-UHFFFAOYSA-N	430.490	1.638	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2cccc3ccn(C)c23)n[nH]1	788333014	KGIICMLDYDXRTD-UHFFFAOYSA-N	432.440	1.977	50	20	IDGD	
O=C(NNC(=O)c1ccnc(Oc2ccc(F)cc2F)c1)N[C@H]1CCS(=O)(=O)C1	788744225	XDARLFSEFFEORN-LBPRGKRZSA-N	426.401	1.283	50	20	IDGD	
Cc1cc(F)cc(-n2cc(C(=O)OCC(=O)NNC(=O)Cc3nc(C)cs3)nn2)c1	789060328	ZHCQTADVMVEWQL-UHFFFAOYSA-N	432.437	1.027	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cccc(N3CCC3=O)c2)cc1	790951057	BMMQGKANJZXKTE-CQSZACIVSA-N	440.456	1.375	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(C(F)(F)F)c(OC)c2)cc1	790951499	GXZWVAGJXPGRPQ-UHFFFAOYSA-N	441.362	1.888	50	20	IDGD	
CC(C)(C)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)cc1[N+](=O)[O-]	793023303	LRJLEORHDXJLDD-UHFFFAOYSA-N	439.428	1.929	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)[C@@H]1N(C(=O)OC(C)(C)C)CC1(C)C	793516930	COOWYSYGJGQLSU-LBPRGKRZSA-N	429.518	1.487	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)[C@H]1CCN(c2ccc(C#N)cc2F)C1	795182414	VFCCGWJLRLRRES-HNNXBMFYSA-N	431.493	1.917	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(N3CCC(CN(C)C)CC3)cc2)n1	797370267	XSJZYPNNECFLRV-UHFFFAOYSA-N	438.532	1.568	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)Nc2ccc(S(=O)(=O)N(C)C)cn2)c2ccccc2n1	797652654	MTVGLQYWFRCRFN-UHFFFAOYSA-N	428.474	1.655	50	20	IDGD	
CCOCCCn1c(NNC(=O)c2cc(S(N)(=O)=O)oc2C)nc2ccccc2c1=O	798326275	CJDRYFBYAXEGJC-UHFFFAOYSA-N	449.489	1.129	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)N[C@@H]1CCc2ccccc2OC1	800983709	SEZVYMMEPJMKLJ-OAHLLOKOSA-N	431.518	1.626	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)Nc2nnn(CCOc3ccc(F)cc3)c2C)n1	801818261	MBEBFNZOXQQIFK-UHFFFAOYSA-N	430.444	1.471	50	20	IDGD	
COc1ccc(C2=NO[C@H](CNC(=O)NNC(=O)COc3ccccc3OC)C2)cc1	802358783	DBHHNJHWBSRSOL-INIZCTEOSA-N	428.445	1.606	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN([C@@H](CNC(=O)NNc2ncccn2)C(F)(F)F)CC1	802465829	SOKSGSLFTHESBT-LBPRGKRZSA-N	433.435	1.586	50	20	IDGD	
CC(=O)N1CCCC[C@@H]1C(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	802762560	IRFBYDQVKVSYPH-LJQANCHMSA-N	435.956	1.006	50	20	IDGD	
COc1ccc(NC(=O)NNc2ccc(-n3ccnc3)nn2)cc1-n1nnnc1C1CC1	806341661	OJDNTMBNTAUTFS-UHFFFAOYSA-N	433.436	1.673	50	20	IDGD	
CCN(CC)CC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2ccccc2OC)c1	806976582	HELRXWMOOVAEFQ-UHFFFAOYSA-N	441.488	1.375	50	20	IDGD	
CNS(=O)(=O)c1cc(NC(=O)C(=O)NNC(=O)CCC2CCCCC2)ccc1F	806977910	DGIDCAGETXNRIR-UHFFFAOYSA-N	428.486	1.180	50	20	IDGD	
C[C@@H]1[C@@H](NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)CCN1Cc1ccccc1	807619983	CXXRVLIGWBYGQV-XLIONFOSSA-N	437.548	1.686	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2ccnc(C(F)(F)F)c2)CC1	809682777	BTENPQNONXPMCP-UHFFFAOYSA-N	444.439	1.188	50	20	IDGD	
O=C(CNS(=O)(=O)c1c(Cl)cccc1Cl)NNc1nc(-c2cccnc2)no1	810339469	KBEYJOBJRKEFIV-UHFFFAOYSA-N	443.272	1.860	50	20	IDGD	
C=Cc1ccc(CCNC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)cc1	813198441	KEFLULQHJFUUNO-UHFFFAOYSA-N	444.561	1.530	50	20	IDGD	
Cc1cnn(C)c1S(=O)(=O)NC(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccccc1	813988977	SWBHHDGUCZBCKF-GZTJUZNOSA-N	449.496	1.918	50	20	IDGD	
N#Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2F)ccc1Br	815565156	DYYZGSPRSVNGFF-UHFFFAOYSA-N	435.209	1.625	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)[C@@H](c1ccccc1F)N1CCOCC1	817053695	CILBDYKLKVHGOU-LJQANCHMSA-N	436.509	1.593	50	20	IDGD	
O=C(CN1C(=O)COc2ccc(Cl)cc21)NNC(=O)c1nn(-c2ccccc2)cc1O	818032163	RALIEAKLPPYXIO-UHFFFAOYSA-N	441.831	1.418	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)CN2c3cccc4cccc(c34)S2(=O)=O)cc1	901413928	VUDXGUZXNDJRDL-UHFFFAOYSA-N	425.466	1.883	50	20	IDGD	
O=C(C[C@H]1OC(=O)c2ccccc21)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	912642976	XBNUVKORSVJMRU-GOSISDBHSA-N	443.481	1.534	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cnn(C)c2C(F)(F)F)cc1OC	915572854	OAMOZHVBDSEFGP-UHFFFAOYSA-N	430.339	1.074	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NC[C@H](c2ccccc2)N(C)C)cc1	915891111	GZRHPKYQYLRZAB-LJQANCHMSA-N	447.561	1.249	50	20	IDGD	
Cc1nn([C@@H]2CCS(=O)(=O)C2)c(Cl)c1C=NNC(=O)CNc1ccccc1F	915919609	CQIQPXVDSALAIZ-GFCCVEGCSA-N	427.889	1.906	50	20	IDGD	
O=C(NCCCN1CCN(Cc2ccccc2)CC1)NNc1ccc(-n2cccn2)nn1	916488040	FOUAQAGCSBCHQC-UHFFFAOYSA-N	435.536	1.496	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2cn(C)c3ccccc23)cc1	916646745	LIBDCRNJQHNPJO-UHFFFAOYSA-N	429.502	1.573	50	20	IDGD	
Cc1n[nH]c(C)c1CC(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	916833947	CHSYVAKFDKDKEG-UHFFFAOYSA-N	430.468	1.788	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@H]1CCCN1Cc1ccccc1	918759346	VKLIASJAYQFFIO-QGZVFWFLSA-N	429.546	1.714	50	20	IDGD	
CCS(=O)(=O)N(C)CCCNC(=O)CCC(=O)C(C#N)=C1N(C)c2ccccc2N1C	919715089	RKPOHJUEBIQWET-UHFFFAOYSA-N	447.561	1.445	50	20	IDGD	
Cn1c(C=NNC(=O)COc2ccccc2-c2ccccc2)nc2c1c(O)nc(=O)n2C	920360629	SQCCBLVDGCXPRD-UHFFFAOYSA-N	432.440	1.569	50	20	IDGD	
O=C(NCc1ccco1)NNS(=O)(=O)c1ccc(S(=O)(=O)N2CCCCC2)cc1	920832458	RBSPQJMVMHYTSM-UHFFFAOYSA-N	442.519	1.147	50	20	IDGD	
C[C@H]1CN(Cc2csc(NC(=O)NNC(=O)COc3ccc(C#N)cc3)n2)C[C@@H](C)O1	920930543	OHCBGYDXPBWRDK-OKILXGFUSA-N	444.517	1.856	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)[C@@H](Cc2ccccc2)NC(=O)c2cccnc2)c1	921302261	YEYCMOMMXODGJJ-OAQYLSRUSA-N	448.479	1.901	50	20	IDGD	
COc1ccc(S(=O)(=O)CCC(=O)NNc2ccccc2S(=O)(=O)N(C)C)cc1	1117726818	KXCJUQPUALCSRF-UHFFFAOYSA-N	441.531	1.253	50	20	IDGD	
O=C(NC[C@H](N1CCOCC1)C(F)(F)F)NNC(=O)c1ccc(Br)cc1	1323400054	RPAKMAZTRMKANC-LBPRGKRZSA-N	439.232	1.656	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cccn3c(O)nnc23)C1	1777958701	NFMOQZXBMNJPKX-BXTJHSDWSA-N	435.912	1.580	50	20	IDGD	
CCn1nc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)cc1C	1779713668	CXKBQGNSJOVXIL-SCLBCKFNSA-N	427.343	1.686	50	20	IDGD	
C[C@@H](Cn1ccnc1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)Br)C1	1782002721	UYZUFDDNCLVGOH-WFXMFSGNSA-N	441.370	1.817	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1nn(C)c3c1CCC3)C2	1782172550	GNLWCKLWZLXTIE-QLVMHMETSA-N	438.956	1.290	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(C)n3ccnc3n1)C2	1782179163	OZPKWHWBUDGDNH-LUQKVYGDSA-N	449.939	1.419	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cccc4c3NC(=O)C4)C2)C1	1782411981	MNODMKXDJXHLLB-VQTJNVASSA-N	440.327	1.861	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4nn[nH]c4c3)C2)C1	1782582711	HFAMIARRMOBWCV-QZTJIDSGSA-N	426.304	1.638	50	20	IDGD	
O=C(/C=C/c1cnccn1)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCBr)C2	1782616989	HJCLHRODFILJAR-CUKLOCQMSA-N	437.338	1.789	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H]1CCOC1)CCO2	1782867627	MPVAVKPTKGCBOJ-NDPADWDBSA-N	431.439	1.738	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(C)nc3O)CCO2)C1	1783353707	ZIDMNSDMEFATKI-KDOFPFPSSA-N	426.311	1.713	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](C)Oc1cccnc1)CCO2	1783353992	LAAZJBDDSZLTOE-ALKREAHSSA-N	440.338	1.852	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(O)c(O)c(Cl)c3)CCO2)C1	1783882229	WTXMLJCVGWNNGN-UGSOOPFHSA-N	433.288	1.449	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccn(C)c3=O)C[C@@H]21	1783970408	YVVKXRISXVDFNT-VRKREXBASA-N	440.338	1.010	50	20	IDGD	
N#Cc1cccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]3C2)c1Cl	1784091462	VHUDNNNILWXDQN-HNKHHVNMSA-N	426.300	1.405	50	20	IDGD	
CC(C)c1nc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCBr)C[C@@H]32)no1	1785207906	RHSIEQPXDNRZFM-IHRRRGAJSA-N	443.342	1.500	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc(OCF)cn3)[C@H]2C1	1785689235	PYCOWMRRWPADNP-MMNXLFCMSA-N	449.310	1.612	50	20	IDGD	
Cn1ccc(=O)cc1C(=O)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1	1788147885	MRXXZQROECDGKF-UHFFFAOYSA-N	445.284	1.127	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC1(c2ccc(NC(=O)Cc3cnc[nH]3)cc2)CCC1	1788552957	FIABLUINTTWQEB-UHFFFAOYSA-N	433.472	1.399	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)c1ccnc(Cl)n1	1788876264	XJHZXMZARDPPCC-QSFUFRPTSA-N	435.681	1.414	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)N3CCN(C)CC3)[C@H]2C1	1789795176	QLTYMYUBEZZCHJ-BCYZHJNNSA-N	429.005	1.010	50	20	IDGD	
CCOC(=O)C(C)(C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]2C1	1789927054	OQDIRLOACUIACY-CYDGBPFRSA-N	437.306	1.246	50	20	IDGD	
Cc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Br)C[C@@H]32)cc1O	1790015400	QFCDXZYFDHXZJG-SDADXPQNSA-N	429.286	1.984	50	20	IDGD	
COc1nc(C)ccc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)Br)[C@H]2C1	1791059326	UDRQYPYZUQDUDK-SDADXPQNSA-N	440.338	1.775	50	20	IDGD	
C[C@H](Br)C(=O)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1	1791433867	GYIWITALSIQLHX-ZDUSSCGKSA-N	445.122	1.898	50	20	IDGD	
CCOC(=O)N[C@H](O)C(=O)NC1(c2ccc(NC(=O)[C@@H](C)Br)cc2)CCC1	1791434053	DAJUXSLQJULLFC-IAQYHMDHSA-N	442.310	1.968	50	20	IDGD	
CC(=O)N[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)CBr)C(C)(C)C	1792868517	CBRDWJSBKPWWHI-SLZITWOASA-N	446.386	1.158	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccnc(Cl)n1)C2	1792870621	GXRAHYNMBAEJRN-HNCHTBHHSA-N	431.718	1.364	50	20	IDGD	
CN(C)c1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@](C)(Cl)CCl)C3)nc1	1794460959	CQFGLQQQDBCILN-UESRRSCYSA-N	429.348	1.587	50	20	IDGD	
O=C(Cc1ccc(F)c(F)c1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2	1795295710	OCSGXUHZFFAHMY-IVWMJMPLSA-N	431.277	1.882	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](O)c1ccccc1)C2	1796892221	OLTQXCKKOCEQKE-GBQRPGIHSA-N	437.500	1.492	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2cncn2c1	1797526069	KPECPQVLUDJLIZ-JJAZEVLHSA-N	435.322	1.569	50	20	IDGD	
Cc1nc[nH]c1CSCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2	1797663688	AYUXCAKNFSRLIM-BAESOJJISA-N	449.346	1.231	50	20	IDGD	
CCc1noc(C)c1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](Br)CC)C2	1798177886	SUFINRWSHZESTM-ZWUHOBOKSA-N	428.327	1.922	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1CCN(c2ccccn2)CC1	1799089148	KDHKRBGBNJHVMB-DMUMMCEESA-N	434.968	1.905	50	20	IDGD	
Cc1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)c(F)c1	1800306628	BTHWNHDBPHQNPX-QDMKHBRRSA-N	425.464	1.698	50	20	IDGD	
COc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)Br)cc1F	1800754536	QYNVJNRYVIMFBZ-YGSHXTJESA-N	429.286	1.821	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3sccn3c1)C2	1800757174	VQMUGIUOKSGCAX-IKVITTDRSA-N	426.336	1.987	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H]2C[C@]21C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2	1800772874	QIRBMFFDFAUQKP-CMVVLZHBSA-N	445.919	1.510	50	20	IDGD	
CC(=O)NCCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2	1801689687	VYACTJYNDJOPBU-MUJYYYPQSA-N	446.460	1.298	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)[C@@H](C)NS(=O)(=O)CC)[C@@H]1c1cccnc1	1803507160	NRAHMOHNFVAAGH-SIXLDLHFSA-N	444.985	1.433	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)CSC1=S)[C@H](F)Br	1804336172	ZFRBARWFLDUNTP-NHRVJRKFSA-N	438.344	1.175	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC2(CCCN(C(=O)C34CC(F)(C3)C4)C2)CC1	1806122141	YWEJUNNORLENTP-UHFFFAOYSA-N	429.496	1.422	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H](CNC(=O)[C@H]2CCC(=O)N2)[C@@H]1c1cccnc1	1806809956	BBKZPLLVOUYEJH-MMTVNHQJSA-N	437.338	1.397	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)CNCP(=O)(O)O)[C@H]1c1cccnc1	1807024191	MHUWLHUWJCMLMP-YQQAZPJKSA-N	446.872	1.220	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)COC(=O)C(F)(F)F)[C@@H]1c1cccnc1)[C@H](F)Cl	1808313614	INDYPEPFHIVTTP-UHTWSYAYSA-N	425.766	1.727	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)c2cn[nH]c2)[C@H]1c1cccnc1	1808416479	AFPFUTZLWCXAES-ZUPKNDBLSA-N	448.487	1.258	50	20	IDGD	
Cn1cnc(C(=O)N2CC[C@H](CNC(=O)[C@H](F)Br)[C@@H]2c2cccnc2)n1	1808652139	UFJPROGDNYAWLQ-AGIUHOORSA-N	425.262	1.220	50	20	IDGD	
CC[C@@H](C)[C@@H](N)C(=O)N1CCCC2(CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CC2)C1	1809706889	GWDPDUBRGMLZRL-SQTGLUCBSA-N	444.580	1.725	50	20	IDGD	
O=C(Cc1cccs1)N1CCCC2(CCN(C(=O)c3ccc(B(O)O)cc3)CC2)C1	1810106831	ZTNYFSWKQJOJOP-UHFFFAOYSA-N	426.347	1.515	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2cnc(OC)cn2)[C@@H]1c1cccnc1	1813029124	CBVVARPNRFGJKA-RLFYNMQTSA-N	433.896	1.454	50	20	IDGD	
CNC(=S)NCCC(=O)N1CC[C@H](CNC(=O)C(Cl)Cl)[C@@H]1c1cccnc1	1813078082	NJPAALOOGRROEX-OCCSQVGLSA-N	432.377	1.375	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)c2cc(O)nc(O)n2)[C@@H]1c1cccnc1)C(Cl)Cl	1813080257	NZDMKULDCAUAMT-ZWNOBZJWSA-N	426.260	1.406	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)COc2cccnn2)[C@@H]1c1cccnc1	1813391438	MPGMTBSNIXSQRM-YEWWUXTCSA-N	448.321	1.740	50	20	IDGD	
Cc1ccc(CC(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)o1	1813509950	OKGRCIHSTCCPDG-WMZHIEFXSA-N	447.300	1.225	50	20	IDGD	
O=C(CCBr)Nc1cc([C@@H]2CCCCN2C(=O)c2cnc(O)nc2O)[nH]n1	1816780620	AGVMVSWHHAKPAS-NSHDSACASA-N	439.270	1.702	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](O)CCl)CC2)c1ccc2c(n1)OCCO2	1816951825	DBLLDLVDCQOEGW-JOYOIKCWSA-N	438.893	1.135	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3cnncc3C(=O)O)sc2C1	1820502147	FBQRNHICBXVCOT-KWQFWETISA-N	439.881	1.111	50	20	IDGD	
CCNC(=S)NCC(=O)Nc1cc([C@H]2CCCCN2C(=O)CCBr)[nH]n1	1821642332	LAFXZHHTVWPYQW-GFCCVEGCSA-N	445.387	1.671	50	20	IDGD	
CC[C@@H](Br)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CNC(=O)OC)[nH]n1	1822092756	VKLUCXMODNYSSF-ZYHUDNBSSA-N	430.303	1.931	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCN2CCOC2=O)[nH]n1	1822370312	MLARHOSKDBYPCR-GXTWGEPZSA-N	427.889	1.498	50	20	IDGD	
CC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc3n(n1)CCNC3=O)CC2	1822844293	YBFGIGSUVIKXOG-VHSXEESVSA-N	436.925	1.326	50	20	IDGD	
Cn1ccc(CC(=O)N[C@H]2CCc3nc(NC(=O)[C@@H](F)Br)sc3C2)n1	1823003496	LLRYUCSYNICRCF-ISVAXAHUSA-N	430.303	1.722	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)Cn2cc(C)c(O)nc2=O)n[nH]1	1823368078	HGFUMGUUVMDYLM-OCCSQVGLSA-N	436.900	1.690	50	20	IDGD	
CC[C@H](C)[C@H](O)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1	1824548416	OZDIIZLAJIXVLD-NDXORKPFSA-N	430.354	1.007	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)C23CC(F)(C2)C3)CC1	1824577773	ZJKJFGSEFMEKOE-YUVSOPLDSA-N	428.313	1.492	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CNC(=O)N(C)C)CC2	1825440277	NWBGWEFBCCVKPG-UWVGGRQHSA-N	446.371	1.500	50	20	IDGD	
CC[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCn1cncn1)CC2	1825453288	VEKPVWDALIFAOQ-WDEREUQCSA-N	441.355	1.910	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)c2cscn2)CC1	1825986192	PPEBFEWWWWOIAS-IBGZPJMESA-N	427.335	1.370	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)Cc1cc(C)n(C)n1)CC2	1825995171	UIGZFZPJLONJLN-YPMHNXCESA-N	425.942	1.594	50	20	IDGD	
Cc1ccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)nc1	1826070434	CQKKPNVELTYNHE-JOCHJYFZSA-N	435.333	1.617	50	20	IDGD	
CCS(=O)(=O)CC(=O)N1CCC([C@@H]2CCCCN2C(=O)CCBr)CC1	1826353168	OTYPZDDSDSGKGP-HNNXBMFYSA-N	437.400	1.826	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)CN)C2)C1	1829221865	YSRVHDUBTHUTFV-LAUBAEHRSA-N	436.940	1.415	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cccnc3Cl)C2)C1	1830357649	CBLFEEDYKLBTKJ-HXUWFJFHSA-N	444.359	1.999	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)CS[C@@H]3CCCCO3)C2)C1	1830364663	OAISPLRPALQFNX-XLIONFOSSA-N	449.013	1.968	50	20	IDGD	
Cc1cc(CC(=O)N2CCC([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)on1	1831871933	XCIPJPKWTCGTAG-IBGZPJMESA-N	433.553	1.518	50	20	IDGD	
COc1cccc(/C=C/C(=O)N2CCC(N3CCC(NC(=O)[C@@H](O)CCl)CC3)CC2)c1	1833312001	IGEXCBMYJVWZGM-LYSGITKLSA-N	449.979	1.880	50	20	IDGD	
O=C(COc1cccnc1)NC1CCN(C2CCN(C(=O)C(Cl)Cl)CC2)CC1	1833760653	YUUZIGQSSLRNAP-UHFFFAOYSA-N	429.348	1.836	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC(N2CCC(NC(=O)CSC(=N)N)CC2)CC1	1834653948	FETDDYWQYUATDD-UHFFFAOYSA-N	429.663	1.036	50	20	IDGD	
O=C(c1nccc2[nH]ccc12)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1836448284	WPFYOKVZHGGAIP-SFHVURJKSA-N	427.288	1.437	50	20	IDGD	
O=C(c1ccn2cncc2c1)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836717136	KCEPXNSLSLYGKY-IBGZPJMESA-N	434.924	1.546	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc4c(c3)CNC4=O)CCO2)C1	1837147394	LBLSUVDASQOKJO-AVRDEDQJSA-N	449.935	1.408	50	20	IDGD	
O=C(c1ccc[n+]([O-])c1)N1CCC(OC2CCN(C(=O)[C@H](F)Br)CC2)CC1	1837241979	KOPGJDUQIHKKOE-INIZCTEOSA-N	444.301	1.623	50	20	IDGD	
CC(F)(F)C(C)(C)C(=O)N1CCOC[C@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1837710121	JJFQCPDIIRERNM-IBGZPJMESA-N	436.572	1.976	50	20	IDGD	
C[C@@H](C(=O)N1CCC(OC2CCN(C(=O)[C@H](F)Cl)CC2)CC1)n1ccccc1=O	1838082938	UWERUZFLZFMCOR-KSSFIOAISA-N	427.904	1.942	50	20	IDGD	
Cc1ccncc1C(=O)N1CCC(OC2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1	1838162445	ZNGATBNLFWEJQC-UHFFFAOYSA-N	445.564	1.375	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)/C=C\C(=O)NC3CC3)CC2)CC1	1838365286	YXJIHECJHOTCTC-PYTPGESOSA-N	441.956	1.074	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@H](C)Cn3cncn3)CC2)CC1	1838421347	OACOXGNHTNBTOL-CRAIPNDOSA-N	441.960	1.167	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3ccncc3O)CC2)CC1	1838447014	KUNKSQWTFNWXAA-QGZVFWFLSA-N	425.913	1.653	50	20	IDGD	
COc1ccc2[nH]cc(C(=O)N3CCO[C@]4(COCCN(C(=O)[C@@H](F)Cl)C4)C3)c2n1	1838487668	CSYNAOKDXCNMLR-VQIMIIECSA-N	440.859	1.176	50	20	IDGD	
O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(F)cc(F)c1)CCO2	1839001196	CXSXEPLQXCCQJT-GOSISDBHSA-N	447.276	1.820	50	20	IDGD	
COc1ccnc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)c1	1839153353	HGIIXLWBONMVOH-RTBURBONSA-N	446.331	1.397	50	20	IDGD	
C[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1)c1ccccn1	1840503929	PHSIEEBNJVGJSJ-CWFSZBLJSA-N	444.359	1.878	50	20	IDGD	
O=C([C@H](Br)Cc1ccccc1)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1	1841353958	ZTDDELCXAPUEAS-CABCVRRESA-N	429.742	1.796	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC2(CCCN2C(=O)CN2CCOC2=O)C1	1841484931	IONZYPBUKUZKPO-OVCLIPMQSA-N	430.411	1.527	50	20	IDGD	
O=C([C@@H]1[C@@H]2Sc3ccccc3[C@H]21)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843014280	TVYIDGHMSZUTFQ-SLFFLAALSA-N	434.326	1.071	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1nccc3occc13)C2	1843415746	IQNOACQVMFWTAM-AFUMVMLFSA-N	434.456	1.779	50	20	IDGD	
COc1nc(C)ccc1C(=O)N1CC2(CCCN2C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C1	1843416248	OMAOXCQCWPRQGM-MFKUBSTISA-N	438.488	1.350	50	20	IDGD	
O=C(Cc1csc(-c2ccccn2)n1)NNC(=O)c1csc(N2CCOCC2)n1	12804286	PRUMAPCKQKWURE-UHFFFAOYSA-N	430.515	1.502	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(N3CCCC3=O)cc2)c1	15896107	MOFNFGKRVQEUNM-UHFFFAOYSA-N	430.486	1.139	50	20	IDGD	
O=C(NNC(=S)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1)c1ccccc1O	16238371	QWXPHRZCYYTIRY-UHFFFAOYSA-N	436.515	1.045	50	20	IDGD	
COCCNC(=O)CSc1ccccc1C(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	27339768	DQENNGYEHVXTRC-UHFFFAOYSA-N	432.458	1.524	50	20	IDGD	
COc1ccccc1-c1nnc(SCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)n1N	36185685	SPJUYBSHWVMYCI-UHFFFAOYSA-N	443.445	1.129	50	20	IDGD	
Cc1cc(Cl)ccc1O[C@H](C)C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	104497438	BACIVKZLXHDQOZ-FZKQIMNGSA-N	448.859	1.946	50	20	IDGD	
Cn1cc(S(=O)(=O)N2CCCCC2)cc1C(=O)NNC(=O)c1ccc2c(c1)OCCO2	106068451	RSHTYAOZOBDLRA-UHFFFAOYSA-N	448.501	1.046	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)c2cc(=O)n(C)c3ccccc23)c2ccccc2c1=O	107909326	IHUHWVZAIUKZGT-UHFFFAOYSA-N	431.452	1.904	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)Cn1cnc2ccc(Br)cc2c1=O	303392019	YHMPLVCTETWOBH-UHFFFAOYSA-N	433.237	1.688	50	20	IDGD	
Cc1cc(C)n(-c2ccc(CNC(=O)NNC(=O)CNC(=O)c3cccs3)cn2)n1	725873095	KCQNOWVTQYKOPB-UHFFFAOYSA-N	427.490	1.206	50	20	IDGD	
C[C@@H]1CCCCN1S(=O)(=O)c1cccc(C(=O)N([C@H]2CCS(=O)(=O)C2)N(C)C)c1	728180723	WVDVSNFQJNZAJQ-WBVHZDCISA-N	443.591	1.356	50	20	IDGD	
O=C(COC(=O)c1ccccc1OCC1CC1)NNC(=O)[C@H]1COc2ccccc2O1	728344966	UVVMNSUWUGVMPE-LJQANCHMSA-N	426.425	1.620	50	20	IDGD	
O=C(Cn1c(COc2ccccc2)nc2ccccc21)NNC(=O)[C@H]1CCS(=O)(=O)C1	728376854	LBSMTNTYDPMMNZ-HNNXBMFYSA-N	442.497	1.197	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)c2cc(S(=O)(=O)N(C)C)c[nH]2)c1	728527422	IMAFCNBYAKZMNP-UHFFFAOYSA-N	445.295	1.111	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)c2cnc3nc(O)nc(O)c3c2)c1	728527513	LYLKYMUWHCBLKF-UHFFFAOYSA-N	434.206	1.282	50	20	IDGD	
Cc1ccc(NC(=O)CSCC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1	728844778	CWISEAIOHDVFGX-UHFFFAOYSA-N	442.545	1.521	50	20	IDGD	
C[C@H]1Oc2c(cccc2C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)NC1=O	729296741	CLTPDRMPGJOWTO-MRXNPFEDSA-N	437.500	1.379	50	20	IDGD	
COc1ccc([C@@]2(C)NC(=O)N(CC(=O)NNC(=O)c3cccc4ncccc34)C2=O)cc1	730227795	NEGSLDSCTAFXOY-HSZRJFAPSA-N	447.451	1.472	50	20	IDGD	
CC(C)COc1ccccc1C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	731378884	RDQVNUFIRKCAOD-IBGZPJMESA-N	428.441	1.866	50	20	IDGD	
O=C(CN(CCO)Cc1cnn(Cc2ccccc2)c1)NNC(=O)c1cccc(Cl)c1	731847638	ZJUVEVVPEYWVRF-UHFFFAOYSA-N	441.919	1.840	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)c2ccc(-c3nc(=O)o[nH]3)cc2)c2ccccc2c1=O	731862042	XUJWSDMHTQWUSE-UHFFFAOYSA-N	434.412	1.396	50	20	IDGD	
C[C@@H](NC(=O)CCC(=O)NNC(=O)c1cccn1C)C(=O)c1ccc(Br)cc1	732051832	AYWMYYXHGFLKBG-GFCCVEGCSA-N	449.305	1.716	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)N2CCC(CS(N)(=O)=O)CC2)c(C)n1C[C@@H]1CCCO1	732071484	HFWRYWIUZVEFIK-FHTAPLDASA-N	434.562	1.718	50	20	IDGD	
Cc1ccc(S(=O)(=O)n2ccc(C(=O)NNC(=O)c3ccc4c(c3)OCO4)c2)cc1	732258351	KTSRKNNZDGYMME-UHFFFAOYSA-N	427.438	1.837	50	20	IDGD	
O=C(NCCCCN1C(=O)c2ccccc2C1=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	732471809	LVLJYALXUYCTHH-UHFFFAOYSA-N	425.401	1.615	50	20	IDGD	
Cc1cc(F)ccc1N1CCC[C@H](NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)C1	735330263	XDOBPGIWUKJMIT-KRWDZBQOSA-N	438.467	1.723	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)CCC(=O)c2ccc(I)cc2)cn1	735471125	PSVHHRNURNMDAD-UHFFFAOYSA-N	426.214	1.449	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NC[C@H](C)CN2CCOCC2)cc1Br	739060007	VVNNJBBKZORFTL-LBPRGKRZSA-N	429.315	1.370	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2ccc(C[C@@H]3CC(=O)NC3=O)cc2)ccc1OC(C)C	741144586	WEOATEZEFAQPDA-QGZVFWFLSA-N	439.468	1.762	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)cc1NC(=O)Nc1ccccc1	741175398	KIVVDADBDOSQDY-OAHLLOKOSA-N	430.486	1.835	50	20	IDGD	
CC(C)(C)OC(=O)N(CC(=O)NNC(=O)COc1ccccc1F)C[C@H]1CCCO1	742034438	ZKUCYWXIIDTGCH-CQSZACIVSA-N	425.457	1.768	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Cc2ccc(NC(=O)C3CC3)cc2)c1	742470806	KFLNFKFXBCZITQ-UHFFFAOYSA-N	444.513	1.289	50	20	IDGD	
C=CCNS(=O)(=O)c1cc(C(=O)NNC(=O)Nc2ccc(N(C)C)cc2)ccc1F	743827285	CRUPGCFDWSEAJF-UHFFFAOYSA-N	435.481	1.823	50	20	IDGD	
C[C@]1(c2ccccc2)NC(=O)N(CC(=O)NNC(=O)Nc2ccc(OC(F)F)cc2)C1=O	743833260	MXQWNORSQCFSHW-HXUWFJFHSA-N	447.398	1.908	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccc([N+](=O)[O-])s3)CC2)c1	744388851	XOMJNEVAZHZLBZ-UHFFFAOYSA-N	431.474	1.184	50	20	IDGD	
COc1cc(/C=C\C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)cc(OC)c1O	745511729	KILFVIVWHNCOKN-YVMONPNESA-N	425.397	1.299	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)c2ccccc2Cn2cncn2)cc1C	745528442	UJRDKKGMGMAYKK-UHFFFAOYSA-N	427.486	1.877	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)N[C@@H]1CC(=O)N([C@H]2C[C@@H]2c2ccccc2)C1	745914063	HKSXBDWHJOVKCK-QRQLOZEOSA-N	426.448	1.692	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)c2cc(C)c3c(O)nc(O)nc3n2)c1	746215213	LPAHCCIPXXONCN-UHFFFAOYSA-N	448.233	1.590	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(/C#N)C(=O)NCCNS(=O)(=O)c2cccnc2)c1C	746272683	VUGWXAZQRLSCHR-YLRSXTQRSA-N	445.545	1.709	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)[C@@H]1CCCN(C(=O)COc2ccccc2)C1	746549716	VSXOAUYTYTZJMU-QGZVFWFLSA-N	435.484	1.342	50	20	IDGD	
CCn1c(NNC(=O)c2nc(C)n(-c3n[nH]c(C(F)(F)F)n3)n2)nc2ccccc2c1=O	747203486	YWSHSGHVJJRJMO-UHFFFAOYSA-N	448.369	1.199	50	20	IDGD	
COc1ccc([C@H](CNC(=O)NNC(=O)CCOc2ccccc2)N2CCOCC2)cc1	747300184	VYAYDJWHUDDECP-NRFANRHFSA-N	442.516	1.868	50	20	IDGD	
CCN(C[C@H]1CCN(CC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)C1)CC(F)(F)F	747968110	SVAKDBVCJLHTEG-CYBMUJFWSA-N	431.415	1.562	50	20	IDGD	
Cc1ccc(NC(=S)NNC(=O)c2cnc3c(c2C)c(=O)n(C)c(=O)n3C)cc1C	748058951	OWSYKGVFYBBPJX-UHFFFAOYSA-N	426.502	1.189	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(-c3n[nH]c(C)n3)cc2)cc1OC	748453653	FZDRBFVOMVCCPB-UHFFFAOYSA-N	439.428	1.415	50	20	IDGD	
CNC(=O)COc1cccc(CC(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)c1	748520709	ABCIQYKKNIBWPG-UHFFFAOYSA-N	445.419	1.791	50	20	IDGD	
CC(C)[C@H](C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1)N1CCCCC1	748618498	CXQNYBBSPZIOKQ-HXUWFJFHSA-N	437.610	1.576	50	20	IDGD	
CCc1cc(N2CCC(NC(=O)NNC(=O)CCc3ccc(OC)cc3)CC2)ncn1	748662913	CIZPXCPMOMIWPZ-UHFFFAOYSA-N	426.521	1.980	50	20	IDGD	
CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)NNC(=O)[C@H]1COc2ccccc2O1	749330846	AZQBUEMLMHINDH-YLJYHZDGSA-N	440.431	1.342	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)c1ccc(-c2n[nH]c(C3CC3)n2)cc1	749392176	SERTVGAMDDPNJW-UHFFFAOYSA-N	429.481	1.818	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2C[C@H](NC(C)=O)Cc3ccccc32)cc1OC	749549650	FQNQVKPRWYHUNC-QGZVFWFLSA-N	426.473	1.032	50	20	IDGD	
Cc1ccc(NC(=O)C2(CNC(=O)NNC(=O)C(=O)N3CCCC3)CCCC2)cc1C	749594461	VZJFXMAPJCSLKX-UHFFFAOYSA-N	429.521	1.755	50	20	IDGD	
O=C(CCc1ccccc1)NNC(=O)c1sccc1S(=O)(=O)N1CCSCC1	749799096	XCRKOLLDYINQSF-UHFFFAOYSA-N	439.584	1.879	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cnn1CCC(C)C	750065458	BHGSYIZYEVNIOT-UHFFFAOYSA-N	427.914	1.613	50	20	IDGD	
Cc1noc(C)c1S(=O)(=O)N1CCN(C(=O)NNC(=O)c2cc3ccccc3o2)CC1	750284402	IYDOKCKAKWLKLQ-UHFFFAOYSA-N	447.473	1.399	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cc(C)nc3[nH]nc(C)c23)cc1OC	750618240	GRHBOCYKOKQSLO-UHFFFAOYSA-N	427.417	1.210	50	20	IDGD	
Cc1cc(C)nc(SCc2ccc(C(=O)NNC(=O)[C@H](C)N3CCN(C)CC3)cc2)n1	750658730	JEVLTXODCODTAU-KRWDZBQOSA-N	442.589	1.783	50	20	IDGD	
CN(C)C(=O)COC1CN(C(=O)/C(C#N)=C/c2cn(CCC#N)nc2-c2ccccc2)C1	752740314	OEHSMJAAZMTTFE-WOJGMQOQSA-N	432.484	1.686	50	20	IDGD	
CN(CC(=O)NNC(=O)c1cc2c(s1)CC[C@H](C(C)(C)C)C2)[C@@H]1CCS(=O)(=O)C1	753564151	OPCRQHOKMVTUIP-LSDHHAIUSA-N	441.619	1.779	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)NC[C@H]2CCCN2S(C)(=O)=O)N(C)c2ccccc21	753716128	BHSYZAHMUSMKKC-OAHLLOKOSA-N	445.545	1.197	50	20	IDGD	
COc1cccc(-c2nc(C)c(C(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)[nH]2)c1	755498479	IRRAGZZMEFRMOX-UHFFFAOYSA-N	428.470	1.872	50	20	IDGD	
CN(C)C(=O)COc1ccc(NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1	755646796	QKTHUYRFDLMMSZ-UHFFFAOYSA-N	434.474	1.024	50	20	IDGD	
C[C@@H]1CCC[C@@H](OCc2cccc(NC(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)c2)C1	756255681	AJEHAVIFNSOYPV-CKEIUWERSA-N	426.539	1.872	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1cccc(C(=O)OCc2ccccc2)c1	756449102	IKFGDGQHYPCMCC-CYBMUJFWSA-N	434.474	1.134	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2ccc(Cl)cc2F)cc1	756785468	VAVRXLACXPHKHS-UHFFFAOYSA-N	444.872	1.870	50	20	IDGD	
Cc1c(F)cccc1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	756837255	FXWRMPDYZVSKQR-UHFFFAOYSA-N	436.465	1.622	50	20	IDGD	
Cc1nn([C@@H]2CCS(=O)(=O)C2)c(C)c1NC(=O)NNC(=O)c1c(C)nc2ccccn12	757870849	AUCJUIDRYGDIBT-CQSZACIVSA-N	445.505	1.282	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)Cc1cccc(OCc2ccccc2Cl)c1	758029321	KHEJJWFHHCOGQM-CYBMUJFWSA-N	439.921	1.547	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1ccc(Oc2ccccc2C#N)c(Cl)c1	758046652	HWZZSQNEHPBRCY-NSHDSACASA-N	436.877	1.703	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(F)cc2[N+](=O)[O-])c1	758149250	UBODWVXVJVPURA-UHFFFAOYSA-N	438.437	1.839	50	20	IDGD	
C#CCN1C(=O)C(=NNC(=O)C(=O)Nc2ccccn2)c2cc(Br)ccc21	758382553	XKOVCMCMKFNHCA-UHFFFAOYSA-N	426.230	1.283	50	20	IDGD	
CC1(C)C(=O)Nc2ccc(C(=O)N3CCN(S(=O)(=O)CBr)CC3)cc21	758536505	YBUFSAZKMDADEG-UHFFFAOYSA-N	430.324	1.356	50	20	IDGD	
O=S(=O)(c1ccc2nc(O)[nH]c2c1)N1CCN(CCI)CC1	759328761	UQYQEVZVDFDPTA-UHFFFAOYSA-N	436.275	1.010	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)N=c2cc[nH]cc2I)c1	760030917	UUKAOTLKYTWIGA-UHFFFAOYSA-N	425.230	1.641	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)CSc2nc(C)c(C)c(C)c2C#N)n1	760172235	KRQPDJZBNYHNNP-UHFFFAOYSA-N	447.542	1.669	50	20	IDGD	
Cc1c(/C=C(\C#N)C(=O)NC[C@H](O)COc2ccc3c(c2)CCC(=O)N3)cc(C#N)n1C	762368082	IBUSRZMKDVEAQR-CQXYXCHQSA-N	433.468	1.553	50	20	IDGD	
O=C(COC/C=C/c1ccccc1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	763105025	AEAKRUIABHVLOJ-JXMROGBWSA-N	443.525	1.962	50	20	IDGD	
COc1ccc(C=NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)s1	763122300	VUJAUWYKWZSARR-UHFFFAOYSA-N	437.543	1.861	50	20	IDGD	
C[C@@H]1C[C@@H](C(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)CCC1=O	763273068	XOKNPNHDBVNXPO-QAPCUYQASA-N	443.525	1.931	50	20	IDGD	
COc1ccc(C(=O)N2CCCCCC2)cc1NC(=O)C(=O)NNC(=O)c1ccncc1	763463238	CDOQVTLGSDCNQE-UHFFFAOYSA-N	439.472	1.506	50	20	IDGD	
CN(Cc1ccccc1NC(=O)C(=O)NNC(=O)c1ccncc1)C(=O)OC(C)(C)C	763463964	IUIOMMRJQUZGQG-UHFFFAOYSA-N	427.461	1.848	50	20	IDGD	
Cc1nccn1-c1ccc(CNC(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)cn1	763472101	DSYXZWMIDOBNAW-UHFFFAOYSA-N	431.497	1.711	50	20	IDGD	
COC(=O)C(C)(C)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2OC)cc1	763657691	PIZZAWWACMCHMN-UHFFFAOYSA-N	443.456	1.311	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(Cl)cc(C(=O)OC)c1	763682978	YEASWQCUMUACEE-UHFFFAOYSA-N	449.847	1.690	50	20	IDGD	
C=CCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)cc1	763686574	OIGQLCDYPJIUDI-UHFFFAOYSA-N	430.848	1.421	50	20	IDGD	
COc1cc(C(=O)N(C)C)ccc1NC(=O)C(=O)NNC(=O)COc1ccc(Cl)cc1	763695426	ULAUGFCVINNVSL-UHFFFAOYSA-N	448.863	1.215	50	20	IDGD	
COc1ncccc1NC(=O)C(=O)NNC(=O)COc1ccccc1Cc1ccccc1	763717897	CCAXRUPIDCSQRP-UHFFFAOYSA-N	434.452	1.846	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(Cl)cc2F)c1	763719003	TWBLQUUZKUZZCN-UHFFFAOYSA-N	442.856	1.129	50	20	IDGD	
CC[C@H](C)Oc1ccc(NC(=O)C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1	763786522	PHXACIDTXXEJHP-ZDUSSCGKSA-N	437.456	1.511	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc([S@](C)=O)c(F)c2)c1C	763847556	DCVCIOBGTZSOSU-OSXTUODASA-N	435.477	1.733	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)cc1F	763865046	NGGZVTLATHMUOJ-LBPRGKRZSA-N	437.399	1.543	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccc(CN3CCc4ccccc43)cc2)n1	763881771	PRTWFIQIEFPDRX-UHFFFAOYSA-N	446.511	1.849	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)C(=O)Nc2ccc3c(c2)N(C)C(=O)CO3)cc1	763890664	FBHVBRFVWPERCV-UHFFFAOYSA-N	428.470	1.228	50	20	IDGD	
O=C(NNC(=O)c1ccc(Br)s1)C(=O)Nc1cnn(Cc2ccccn2)c1	763940638	LVQGQLLTKMVWLK-UHFFFAOYSA-N	449.290	1.550	50	20	IDGD	
O=C(NNC(=O)c1ccc2ccccc2c1)C(=O)Nc1ccccc1C(=O)N1CCOCC1	764064995	TXQGPGLESUMRAN-UHFFFAOYSA-N	446.463	1.712	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)N3CCC[C@@H](C)C3)cc2C)n[nH]1	764098936	QGSQYJLVBZVLDP-GFCCVEGCSA-N	426.477	1.298	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)C(=O)Nc1ccnn1Cc1cccc2ccccc12	764263298	CIXKEBXSWWGAHX-UHFFFAOYSA-N	428.452	1.808	50	20	IDGD	
CC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2cc(F)ccc2Br)cc1	764276733	FJZKNVOQLASQKH-UHFFFAOYSA-N	437.225	1.946	50	20	IDGD	
C[C@@H](C#N)CSc1ccccc1NC(=O)C(=O)NNC(=O)COc1ccccc1O	764278189	LNWHZKUCDNCKIB-ZDUSSCGKSA-N	428.470	1.809	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)C(=O)Nc1ccc(C[C@H]2CC(=O)NC2=O)cc1)c1ccccc1	764327807	FMVYYJVMYIYMRH-FUHWJXTLSA-N	436.468	1.172	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)n(Cc2ccccc2)n1	764349514	MJDSJJNPVSUXOE-UHFFFAOYSA-N	427.848	1.999	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cccc(-n4cnnn4)c3)n[nH]2)cc1	764385142	SUALLBOYCBUFFY-UHFFFAOYSA-N	445.443	1.015	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cncc(NC(C)=O)c2)ccc1Cl	764434319	URXIGUUMIHTKIP-UHFFFAOYSA-N	447.835	1.270	50	20	IDGD	
Cc1cccc(C)c1NC(=O)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	764462350	GSSPNPOLLGXZAO-UHFFFAOYSA-N	444.513	1.488	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@@H](C)S(=O)(=O)C2CCOCC2)cc1Br	765500370	DQIWPBSRLQTSMA-SNVBAGLBSA-N	449.323	1.201	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)c3cnn(-c4ccc(O)nn4)c3C)n[nH]2)c1	765575602	KJLXZKCOBGBPEW-UHFFFAOYSA-N	432.444	1.758	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)c2c[nH]c3ccccc23)cc1F	765643719	SYZVDNSNWKLOHC-UHFFFAOYSA-N	440.478	1.692	50	20	IDGD	
COc1ccc(CC(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)cc1	765753216	BACUEWCEINNZRF-UHFFFAOYSA-N	430.936	1.856	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1cccnc1SC(F)F	766636706	RVAVYFGDZNYYGP-UHFFFAOYSA-N	449.483	1.615	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)c1cccc2c[nH]nc12	766669768	SOOMYFBYXDYZEF-UHFFFAOYSA-N	426.908	1.795	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)CS(=O)(=O)C(C)(C)C)c2ccccc2c1=O	767191737	IKVFLCDZNWVWGP-UHFFFAOYSA-N	436.534	1.561	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)CO[C@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1	768067403	LGFATYLNTHPCNY-KRWDZBQOSA-N	449.504	1.715	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CCc2ccccc2)cc1NC(=O)CCN(C)C	768239893	QPBLDRWDLXKDLK-UHFFFAOYSA-N	439.516	1.604	50	20	IDGD	
COc1ccc(NNC(=O)c2ccc3c(c2)CCN3C(=O)CNC(C)=O)c([N+](=O)[O-])c1	768327547	BSHRGOHZDMNNLW-UHFFFAOYSA-N	427.417	1.386	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)CNC(=O)c1ccccc1OC(F)F	768737124	KHWGGWUEDJPTBO-UHFFFAOYSA-N	443.428	1.573	50	20	IDGD	
C[C@]1(c2cccc(C(=O)NNc3ccc(S(=O)(=O)C(F)F)cc3)c2)NC(=O)NC1=O	769020695	OQQUWIDIJCMYFA-GOSISDBHSA-N	438.412	1.494	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)[C@H]1CCN(C(=O)OCc2ccccc2)C1	770703180	ZKLTYGVZESDHOQ-INIZCTEOSA-N	434.493	1.707	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)N[C@@H]1CC(=O)N(c2c(F)cccc2F)C1	770772189	MHEGXPRJEAOBIO-CQSZACIVSA-N	440.410	1.900	50	20	IDGD	
Cc1ccc(C(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)cc1NS(C)(=O)=O	770966471	RAZSENXZCXGSAP-UHFFFAOYSA-N	433.494	1.724	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1cccs1)C(=O)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	771045222	MZDVSISNOPURMV-SNVBAGLBSA-N	437.478	1.405	50	20	IDGD	
O=C(CN1C(=O)N[C@]2(CCc3ccccc32)C1=O)NNc1ccnc(Br)c1	771547045	LTBPIPBTTYZUPI-SFHVURJKSA-N	430.262	1.681	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)NC[C@H](O)C(C)C)cc1	771601370	IYALJCZPEDPIAL-LZOLKVDOSA-N	425.489	1.474	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)/C(=C\c1cccs1)n1nnnc1-c1ccccc1	771914461	RZIIKQGPNCXKCO-HKJJFUAXSA-N	440.485	1.889	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2ccc(Br)c(C)n2)c1	773522680	CGPGJAGJVAWNOD-UHFFFAOYSA-N	437.250	1.569	50	20	IDGD	
COC(=O)c1c(F)cccc1NNC(=O)c1sccc1S(=O)(=O)N1CCOCC1	773640723	FUOQZGPNZLBEGO-UHFFFAOYSA-N	443.478	1.452	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2cnc3ccccc3n2)cc1	773718736	NIDYMVDYWGOZES-UHFFFAOYSA-N	428.474	1.398	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)c1cnc(C2OCCO2)s1	774314787	DPQOKVVUHMEQGP-UHFFFAOYSA-N	428.264	1.791	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)CNC(=O)c1sc2ccccc2c1Cl	778519181	VBTVXRFFGGDJIR-UHFFFAOYSA-N	440.909	1.957	50	20	IDGD	
COC(=O)[C@H]1CN(CC(=O)NNC(=O)c2cc(Cl)ccc2OC)c2ccccc2O1	779029271	OUIHNLFZKVFNHQ-QGZVFWFLSA-N	433.848	1.550	50	20	IDGD	
CCSc1cc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)ccn1	779684650	OGSNQXFQSYRCBS-UHFFFAOYSA-N	437.547	1.588	50	20	IDGD	
CCNC(=O)N(C)NC(=O)c1ccc(Cl)c(S(=O)(=O)N2C[C@H](C)O[C@H](C)C2)c1	780710781	HZJOOVGFFNCWOQ-TXEJJXNPSA-N	432.930	1.444	50	20	IDGD	
CC[C@H]1C[C@H](CC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)CCO1	781552738	ZBIMIPYJSPCTKQ-WBVHZDCISA-N	439.534	1.064	50	20	IDGD	
CCOc1cc(N2CCOC(C)(C)C2)ccc1NC(=O)C(=O)NNC(=O)c1ccoc1	782117905	UGRJDGCBZJRPSW-UHFFFAOYSA-N	430.461	1.693	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C(=O)Nc2ccccc2Br)nc2ccccc21	782884058	FCFALFLTPLXQIK-UHFFFAOYSA-N	430.262	1.664	50	20	IDGD	
CCN1CCN(c2ccc(NC(=O)C(=O)NN=c3sc4ccccc4n3C)cc2)CC1	783349804	QSIFARXFPCINPV-UHFFFAOYSA-N	438.557	1.952	50	20	IDGD	
COCCCn1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)n1	783409843	XKUFUIRRNCPWML-UHFFFAOYSA-N	449.411	1.295	50	20	IDGD	
O=C(NNC(=O)C(=O)N1CCCC1)C(=O)Nc1cccc(OCc2ccc(Cl)cc2)c1	783996679	IIRXHBLWDBVGLC-UHFFFAOYSA-N	444.875	1.627	50	20	IDGD	
O=C(NNC(=O)C(=O)N1CCCC1)C(=O)Nc1ccnc(Oc2ccccc2Cl)c1	784000226	QPJADYOFLOVBHJ-UHFFFAOYSA-N	431.836	1.236	50	20	IDGD	
Cc1cc(N(C)C)cc(C)c1NC(=O)C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	784214081	UPPSJGZCSAJKOD-UHFFFAOYSA-N	445.545	1.892	50	20	IDGD	
O=C(NNc1ncc(F)cn1)C(=O)Nc1cc(C(F)(F)F)ccc1N1CCOCC1	784950187	PAVGTSQXMCHYBA-UHFFFAOYSA-N	428.346	1.553	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1ccccc1OCC(F)F	785330786	MBQGCZLAOPEWOI-UHFFFAOYSA-N	443.428	1.824	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1ccnn1C1CCCCC1	785331187	PQZYSCNGEPNLHZ-UHFFFAOYSA-N	435.506	1.882	50	20	IDGD	
Cc1ccnc(-n2nc(C)cc2NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c1	786070855	MKBVJAFFVOHSAC-UHFFFAOYSA-N	428.474	1.754	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc(Cl)ccc1OCC1CCC1)[C@H]1CCS(=O)(=O)C1	786724184	MYUUOZDYKTXOAV-LBPRGKRZSA-N	436.939	1.263	50	20	IDGD	
Cc1ccc(CNC(=O)NNC(=O)CNC(=O)c2cccs2)c(-n2cc(Cl)cn2)n1	786832667	YHQSZBPDIQIBAG-UHFFFAOYSA-N	447.908	1.551	50	20	IDGD	
C[C@@H](C(=O)OCC(=O)NNC(=O)c1cccc(C#N)c1)C1CN(C(=O)OC(C)(C)C)C1	786985755	PJZZHZJLMZCENO-CYBMUJFWSA-N	430.461	1.365	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(Cl)c(S(C)(=O)=O)c2)cc1F	788332887	HLWJHJQTHKBUFG-UHFFFAOYSA-N	427.841	1.591	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1nc([C@@H]2C[C@H]3CC[C@H]2C3)cs1	789734078	ATBBPBDQGIMPBN-RWMBFGLXSA-N	430.486	1.917	50	20	IDGD	
CCC[C@H]1CCc2nc(NC(=O)C(=O)NNC(=O)c3cncc(NC(C)=O)c3)sc2C1	789740723	YTEQUSLOAHZJRF-LBPRGKRZSA-N	444.517	1.801	50	20	IDGD	
CCC[C@@H](CCCS(C)(=O)=O)C(=O)NNC(=O)c1nn(CC)c(=O)c2ccccc12	789869009	PYVSFBKZGIFDGR-AWEZNQCLSA-N	436.534	1.419	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)[C@@H]1Cc2cc(Br)ccc2O1	792659382	OLIITQZXZAFEOR-ZDUSSCGKSA-N	428.283	1.815	50	20	IDGD	
Cn1cc(C(=O)CCC(=O)NNC(=O)c2ccc(CSc3nncn3C)cc2)cn1	792788081	WIDZZPNBBVTKMY-UHFFFAOYSA-N	427.490	1.265	50	20	IDGD	
O=C(COC(=O)[C@H]1CCS(=O)(=O)c2ccccc21)NNC(=O)c1cccc(Cl)c1	792816494	FDUCBCMKVROBQZ-HNNXBMFYSA-N	436.873	1.605	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(OC)c(NC(=O)C(=O)NCCSSC)c1	793076875	VDOYOIYDXHIPTF-UHFFFAOYSA-N	435.593	1.792	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccccc1S(=O)(=O)C(F)F)c1ccc2c(c1)OCO2	794579178	SJBLMTKFNZRCEI-UHFFFAOYSA-N	434.398	1.035	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)CNC(=O)NCc2ccc(Cl)cc2)cc1	794731007	OWRWGYTXGGXVAL-UHFFFAOYSA-N	439.925	1.533	50	20	IDGD	
C[C@H]1[C@H](NCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)[C@H](C)CCN1C(=O)OC(C)(C)C	796646449	BOLGNUPDNIXAGK-QWQRMKEZSA-N	449.508	1.979	50	20	IDGD	
C[C@@H]1Oc2ccc(NC(=O)NNC(=O)CNC(=O)OCc3ccccc3)cc2NC1=O	797611108	UBFPEHBVIFEHTG-LBPRGKRZSA-N	427.417	1.485	50	20	IDGD	
CN(C)c1ccc(NC(=S)NNC(=O)Cc2ccc(S(=O)(=O)N(C)C)cc2)cc1	798125121	LDRKAHDSWDYEOG-UHFFFAOYSA-N	435.575	1.563	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2CSCN2C(=O)c2ccccc2)cc1C	798308936	DSSVQGGRYRUDOX-QGZVFWFLSA-N	426.498	1.605	50	20	IDGD	
O=C(NNc1nc(-c2ccccc2)no1)c1ccc(F)c(S(=O)(=O)N2CCOCC2)c1	801153800	QAILXINLYMLUON-UHFFFAOYSA-N	447.448	1.654	50	20	IDGD	
NC(=O)CC[C@H](NC(=O)CCC1CCCC1)C(=O)NNC(=O)Nc1ccc2c(c1)OCO2	802104522	FPXIGHPVOUXWOB-HNNXBMFYSA-N	447.492	1.289	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)NC[C@H]2CC(c3ccc4c(c3)CCO4)=NO2)c1	802337272	HVXDPFRXJKSFRL-GOSISDBHSA-N	440.456	1.776	50	20	IDGD	
COC(=O)c1c(F)cc(NC(=O)C(=O)NNC(=O)CCc2ccc(OC)cc2)cc1F	802567308	QMUPDLKNZXVXMZ-UHFFFAOYSA-N	435.383	1.479	50	20	IDGD	
CCc1nnc(NC(=O)[C@H](C)[C@H](C)NC(=O)NNC(=O)COCc2ccccc2)s1	805141396	DKIVLWODVUJDCM-OLZOCXBDSA-N	434.522	1.611	50	20	IDGD	
O=C(NNC(=O)c1ccccc1O)C(=O)Nc1ccc2nccnc2c1Br	806972511	BXPVWBWQABMEMU-UHFFFAOYSA-N	430.218	1.498	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cnn(CC(C)C)c2C2CC2)cc1	806973938	YGZVNLAJHOEBKP-UHFFFAOYSA-N	429.477	1.590	50	20	IDGD	
COCc1cnc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc3ccccc3c2)s1	806975464	ZRRHMAZFQMGRQW-GFCCVEGCSA-N	428.470	1.996	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc(F)c(N2CCCNC2=O)c1	806976657	JYXOQUHDJUGERA-UHFFFAOYSA-N	429.408	1.154	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1ccc(Cl)cc1OCC(F)F	806979165	UGKXHMLWKPWINS-UHFFFAOYSA-N	443.790	1.854	50	20	IDGD	
COCc1csc(NC(=O)C(=O)NNC(=O)c2ccc(OC)c(Br)c2)n1	806979580	ALMWYANOHXRNEK-UHFFFAOYSA-N	443.279	1.460	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1nc(-c2ccc(F)cc2)cs1	807006812	SYRCVSHORLMCFJ-UHFFFAOYSA-N	447.473	1.527	50	20	IDGD	
O=C(CNc1ccccc1)NNC(=O)CNS(=O)(=O)c1ccccc1C(F)(F)F	809991750	BWLZOYYFCXCONA-UHFFFAOYSA-N	430.408	1.243	50	20	IDGD	
COC[C@@]1(C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)CCN(C(=O)OC(C)(C)C)C1	810398732	OJHJVLCDNXXSQC-JOCHJYFZSA-N	443.504	1.907	50	20	IDGD	
O=C(NNC(=O)c1c(O)cnc2c(Br)cccc12)C(=O)Nc1ccccn1	810527874	PETKYUZLLNZPGO-UHFFFAOYSA-N	430.218	1.498	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)Nc1nc(CN2CCOCC2)cs1	813837557	PFTBSNGLOQHXBV-UHFFFAOYSA-N	440.551	1.374	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2cccc(Cl)c2)nnn1Cc1ccccc1F	815565308	JVUOPQCGRRMWSR-UHFFFAOYSA-N	430.827	1.827	50	20	IDGD	
CC(C)Oc1ccc(-c2ccc(NC(=O)C(=O)NNC(=O)[C@@H]3COCCO3)c(F)c2)cc1	815570570	GYXXHBCFZDKPGX-IBGZPJMESA-N	445.447	1.781	50	20	IDGD	
COC(=O)c1csc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)N(C)C)c1C	815751713	KZMHUGKKNHWUQU-UHFFFAOYSA-N	440.503	1.175	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)NCC2(O)CN(C(=O)OC(C)(C)C)C2)c1C	819623987	KNDDKGYDTPKADR-VCHYOVAHSA-N	432.521	1.756	50	20	IDGD	
CS(=O)(=O)c1cc(S(=O)(=O)NNC(=O)c2ccc3c(c2)OCCO3)ccc1Cl	821135029	IGINTFLRTDORQM-UHFFFAOYSA-N	446.890	1.138	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)cnn1-c1ccccn1	914750277	AJTUMGHKFRDMEO-UHFFFAOYSA-N	431.456	1.941	50	20	IDGD	
CNS(=O)(=O)c1c[nH]c(C(=O)OCC(=O)NN=C(c2ccccc2)c2ccccc2)c1	915423492	QNSZSKCSLCRPQD-UHFFFAOYSA-N	440.481	1.648	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)[C@@H]1CCCCN1S(=O)(=O)c1cccs1	915686526	HPEHSHSGAWVHCF-HNNXBMFYSA-N	425.507	1.821	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCCOCc2ccccc2)c1	916213106	YTJYSLIRBRLDQR-UHFFFAOYSA-N	434.518	1.488	50	20	IDGD	
CCCc1noc(CCCC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)n1	916736562	ZVDXZUBHZMKGJU-UHFFFAOYSA-N	437.522	1.121	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)N[C@H](C)CN1C[C@H](C)C[C@@H](C)C1	919924741	VJHZJXQAAZEYBE-RBSFLKMASA-N	438.598	1.599	50	20	IDGD	
O=C(NNC(=O)C(=O)NC1CC1)N[C@H]1CC(=O)N(c2ccc(Oc3ccccc3)cc2)C1	920243780	VLSFFHIWOKPMNE-HNNXBMFYSA-N	437.456	1.193	50	20	IDGD	
Cc1cccc(-n2cc(C(=O)NNC(=O)C3CCN(C(=O)OC(C)(C)C)CC3)nn2)c1	1116083789	LSDAEDVLWWQDCM-UHFFFAOYSA-N	428.493	1.984	50	20	IDGD	
CCOc1ccccc1C(=O)NCC(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1	1320345065	JJVRRPVBWREEKZ-UHFFFAOYSA-N	448.520	1.610	50	20	IDGD	
COc1cccc([C@@H]2[C@H](C(=O)NNC(=O)c3n[nH]c4c3CCCC4)CC(=O)N2C2CC2)c1	1323487165	KNZNZFJHMOGKAC-DYESRHJHSA-N	437.500	1.810	50	20	IDGD	
Cc1nn([C@H]2CCS(=O)(=O)C2)c2nc(C3CC3)cc(C(=O)NNc3ncncc3F)c12	1324581685	AAHLTVGNSDKYAQ-LBPRGKRZSA-N	445.480	1.663	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc4ccc(OC)cc4[nH]3)C2)C1	1777771300	YKVYOGLPAKNGON-HRAATJIYSA-N	435.908	1.874	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnc3c(c1)CCNCC3)C2)[C@H](F)Cl	1778028381	JAUMKDCFWHDEBA-LVCYWYKZSA-N	438.931	1.432	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc3cccnc3nc1O)C2)[C@H](F)Cl	1778028422	JIYAZVHDEQQWBO-QEEYODRMSA-N	436.871	1.997	50	20	IDGD	
Cn1cnc(C(=O)N2CCO[C@@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)c1C(F)(F)F	1779295341	JIQCCMKNQVNYGY-QGZVFWFLSA-N	448.518	1.734	50	20	IDGD	
CCOC(=O)c1cc(C(=O)N2CC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)ccn1	1780323582	LOUJBGSNYWFFMT-SFHVURJKSA-N	430.288	1.506	50	20	IDGD	
CC(C)(NCCC#N)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Br)C1	1780771774	PULAZDQEKQSZPW-HBUWYVDXSA-N	447.349	1.473	50	20	IDGD	
COc1ncccc1CCC(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781326269	MOQRJSNQVRSGRJ-YJBOKZPZSA-N	444.301	1.543	50	20	IDGD	
COc1cccc(OC)c1C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781333646	HSQCOUCENNYDCK-QAPCUYQASA-N	445.285	1.838	50	20	IDGD	
COc1ccc2[nH]cc(/C=C/C(=O)N3CC[C@]4(C3)CN(C(=O)[C@@H](O)CCl)CCO4)c2c1	1781389126	XECIZNKXKZRBTJ-VIWWTTNSSA-N	447.919	1.619	50	20	IDGD	
CCOc1cnc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](Br)CC)C3)C2)cn1	1783342585	CAIKOIIOVIAJIY-UGSOOPFHSA-N	441.326	1.492	50	20	IDGD	
CC(C)c1ccc(CC(=O)N2CC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)cc1	1783431125	VMVAAJPWIZJHCE-DEOSSOPVSA-N	444.576	1.555	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)CCN3Cc4ccccc4C3=O)CCO2)C1	1783875548	RNPJAHCJYANYDF-PGRDOPGGSA-N	449.935	1.116	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(F)(F)C(F)F)C[C@@H]21	1783970367	YABIDSFZQMGNEE-RCWTZXSCSA-N	433.240	1.898	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3[C@@H]4C=CS[C@@H]34)C[C@@H]21	1783975140	ZYLGLLLICLTHCU-UQYNZRTDSA-N	429.380	1.872	50	20	IDGD	
Cc1ccc(CCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]3C2)cc1F	1784084972	ADWFAKHXAJQDNS-CAMMJAKZSA-N	426.916	1.646	50	20	IDGD	
Cc1cc(C)c(OCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](O)CCl)C[C@@H]32)c(C)c1	1784358510	PWGWQNSLOYWXKE-VJANTYMQSA-N	438.952	1.570	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc(N(C)C)o3)[C@H]2C1	1785886940	VARCVJFOUYEZCF-FQUUOJAGSA-N	443.342	1.507	50	20	IDGD	
COc1nccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CO[Si](C)(C)C)C[C@@H]32)c1F	1787136021	CZKMKTJPCMRKIA-BPUTZDHNSA-N	439.560	1.674	50	20	IDGD	
C[C@H](C(=O)Nc1ccc(C2(NC(=O)[C@H](O)CCl)CCC2)cc1)[C@@H]1SC(=N)NC1=O	1788633827	YVNRFJBIDWBJLF-GDLCADMTSA-N	438.937	1.523	50	20	IDGD	
C[C@H](C(=O)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1)N1C[C@H]2C[C@@H]2C1	1789440672	GCUJJSBAQFKLNE-BHIYHBOVSA-N	447.344	1.454	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)ON=C(C)C)C[C@@H]21	1790963307	RHLUKPBDVYXXDS-GVRJEKJASA-N	432.359	1.941	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]3C2)cn1	1791055130	KHRSPWBTPYUXGX-UNQGMJICSA-N	426.311	1.467	50	20	IDGD	
Cc1c(C(=O)NC2(c3ccc(NC(=O)CCC(=O)NN(C)C)cc3)CCC2)cnn1C	1791599841	WWMKVNWJJTUQID-UHFFFAOYSA-N	426.521	1.849	50	20	IDGD	
CC(C)(C)OC(=O)N(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2)C1CC1	1792637756	WMLHAZOIOJMYRD-NOXHYTERSA-N	433.908	1.510	50	20	IDGD	
CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(C)(C)CCl)C(=O)OC(C)(C)C	1792783037	IYJYMUKCVDCIGW-MIFYACCESA-N	431.961	1.708	50	20	IDGD	
Cc1ncccc1CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)CBr	1792868735	NFDMNJQDPYTKLJ-UEILYKACSA-N	438.366	1.943	50	20	IDGD	
COc1ccnc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)CBr)c1	1792870236	AJBNBDNVLHVMOS-JFILPPLUSA-N	426.311	1.324	50	20	IDGD	
COc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)CBr)c(O)c1	1792872363	BFIRYTOYUNVSFF-JRATXPSKSA-N	441.322	1.635	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Oc1cccnc1)C2	1792873005	IOHNQXJBXQYIHB-SVZOTFJBSA-N	440.338	1.470	50	20	IDGD	
C[C@@H](O)[C@H](NC(=O)c1ccccc1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](F)Cl)C2	1792879477	PJHKMEDPZMBSEO-KFTDAMQQSA-N	425.888	1.338	50	20	IDGD	
O=C(CCS(=O)(=O)c1ccccc1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCl	1793110857	ZFMIBGXFWXTCLC-JYYAWHABSA-N	428.938	1.088	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H]2[C@@H](C1)[C@@H]2C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCl	1793116895	YGHYJQUNXRHETR-PZLJCXPPSA-N	441.956	1.337	50	20	IDGD	
COc1ccccc1CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCBr	1795116606	XJOLORGCWIWTDC-CCWDJLKJSA-N	425.323	1.612	50	20	IDGD	
COCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C#N)=C/c1ccc(Br)cc1)C2	1795207260	VXVZQRMYEOKIGW-SQABCVSLSA-N	448.317	1.592	50	20	IDGD	
CC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN(C)NC(=O)NCc1ccccc1)C2	1795529659	BXPOYNBGKLJBFS-ACDBMABISA-N	443.548	1.340	50	20	IDGD	
COc1nccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)CBr)C3)c1F	1795908625	XQXVLFDTXUJKFB-OHTBPHCPSA-N	444.301	1.464	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1csc2c1CCCO2	1796094594	KWGRXFSYBDYUFM-DJBIQUGXSA-N	447.326	1.967	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)[C@H]1C[C@@H]1c1ccc(F)cc1	1796187923	LVACUJWDKSFNBC-YHINDDMVSA-N	436.292	1.561	50	20	IDGD	
COC(=O)c1ccccc1CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Cl	1796364093	FGDJSJAMPRJRKG-DACLVMHWSA-N	426.872	1.530	50	20	IDGD	
Cn1ncc(Br)c1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2	1796749024	GGIPWNQOHDIGSD-DIYOJNKTSA-N	440.125	1.190	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)Br)C3)o1	1797749850	WZIQRNOSVBHPRT-ADGXKJENSA-N	428.283	1.225	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CS[C@@H]1CCCCO1)C2	1798440621	TYIFAPWTEIXWBI-NXEZDXNNSA-N	447.561	1.197	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCCc1ccncc1)C2	1798440786	RXIWABCETRMZTB-BCDXTJNWSA-N	436.516	1.355	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H]1C[C@@H]1c1ccccc1)C2	1798443498	CJXZCAGDZITJJP-DSJDWBEOSA-N	433.512	1.741	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnco1)C2	1798522765	WUWTUERDSGRHLA-IVWMJMPLSA-N	444.400	1.025	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(OC)c(O)cc1[N+](=O)[O-]	1798595137	OFKTYTJYHPBLNN-WYFUGZQLSA-N	441.868	1.530	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CC[C@@H]2CCC(=O)N2C1	1799149889	QVLBJWOOZQPWGF-MSOBSMHVSA-N	446.375	1.213	50	20	IDGD	
Cc1cccnc1CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Br	1799344828	WKIKTUQJBKITJZ-RMHZUWNSSA-N	428.302	1.603	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc3[nH]ncc13)C2	1800639990	RJDHZKURWGJMCY-DJZPMSPPSA-N	435.322	1.940	50	20	IDGD	
C[C@@H](Oc1cccnc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2	1801403928	GWSGYWYIAFCNOI-GGUBGCTKSA-N	430.274	1.129	50	20	IDGD	
C[C@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H]1CC[C@H]3CCC(=O)N3C1)C2	1801968470	WHBBVEZCQFGXNI-OHQCYIMMSA-N	426.355	1.809	50	20	IDGD	
CCOC(=O)N[C@H](O)C(=O)N1CC[C@@H](CNC(=O)C(C)(C)CCl)[C@H]1c1cccnc1	1802900630	CALCATQSINCROU-ARFHVFGLSA-N	440.928	1.417	50	20	IDGD	
CC(C)(CCl)C(=O)NC[C@H]1CCN(C(=O)COc2ccc(O)nn2)[C@H]1c1cccnc1	1802904680	NFGKRERWMIYGJA-BEFAXECRSA-N	447.923	1.927	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cnnc3ccccc23)[C@H]1c1cccnc1)[C@H](O)CCl	1803139749	VHQVIQJXRITNDM-BEVDRBHNSA-N	439.903	1.944	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)CC(=O)NC)[C@@H]1c1cccnc1	1803483249	ULQYJLSSSLGAJR-ZQIUZPCESA-N	425.327	1.397	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)NC[C@H]1CCN(C(=O)CN)[C@H]1c1cccnc1	1804239578	NVVUZWPHYVHUSS-VYDXJSESSA-N	439.944	1.178	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC2(CCCN(C(=O)c3ccc([N+](=O)[O-])o3)C2)CC1	1804650059	PHFHLNWIAYIYSC-UHFFFAOYSA-N	435.481	1.406	50	20	IDGD	
O=C(CCBr)NC[C@H]1CCN(C(=O)c2ccnnc2O)[C@@H]1c1cccnc1	1806342534	KJBMNEYYXOUEFX-CZUORRHYSA-N	434.294	1.682	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)CSC(=N)N)[C@@H]1c1cccnc1	1807009775	QTJUVGZHQXSBJE-SUHUHFCYSA-N	428.356	1.497	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)CNC(=O)c2cccnc2)[C@H]1c1cccnc1	1808252174	ZHUFPVVKNIBPRL-QRFRQXIXSA-N	443.935	1.930	50	20	IDGD	
Cc1ccc(C(=O)N2CCC3(CCCN(C(=O)c4ccc(B(O)O)cc4)C3)CC2)c(F)c1	1809969960	WQOYMJBJOVLWNO-UHFFFAOYSA-N	438.308	1.973	50	20	IDGD	
C[C@H](NC(=O)c1cnccn1)C(=O)N1CCC2(CCCN(C(=O)[C@@H](F)Cl)C2)CC1	1810904859	USJRWQKKJWLYCO-DZGCQCFKSA-N	425.892	1.361	50	20	IDGD	
COC(=O)NCC(=O)N1CC[C@H](CNC(=O)[C@@H](C)Br)[C@@H]1c1cccnc1	1812868305	YAASURNGTGIXTG-KYOSRNDESA-N	427.299	1.227	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H](CNC(=O)CN2C(=O)C=CC2=O)[C@@H]1c1cccnc1	1813175992	NUMYNKVUQURPAA-BEFAXECRSA-N	432.908	1.277	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)C2CCSCC2)[C@@H]1c1cccnc1	1814238967	ORBBCHKCCHMQIA-RXVVDRJESA-N	447.605	1.604	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cnn(-c3cccnc3)c2)[nH]n1)[C@@H](O)CCl	1814869481	QJNSBTBUUJBGSI-IRXDYDNUSA-N	443.895	1.896	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)C2CCC3(CC2)OCCO3)[nH]n1)[C@H](O)CCl	1814874688	AGGYCCKPSNSXBJ-JKSUJKDBSA-N	440.928	1.935	50	20	IDGD	
Cn1nc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)CCBr)n[nH]2)cc1O	1816780801	ASONNCBBHQORQM-LBPRGKRZSA-N	425.287	1.940	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CS(C)(=O)=O)n[nH]1	1817054046	WPXVDUSMTQQRAP-ZYHUDNBSSA-N	435.344	1.477	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC[C@H]1c1cc(NC(=O)Cn2cnnn2)n[nH]1	1817617684	YZBLLZCVSKCINI-JQWIXIFHSA-N	425.291	1.262	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCN2CCOC2=O)n[nH]1	1818850381	TWOVKHQDQRIDAL-GXTWGEPZSA-N	427.889	1.498	50	20	IDGD	
C[Si](C)(C)OCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCN2C(=O)C=CC2=O)[nH]n1	1819591905	PGLPZLFMWYWTQK-HNNXBMFYSA-N	447.568	1.568	50	20	IDGD	
CC(=O)N(C)CCC(=O)N[C@H]1CCc2nc(NC(=O)CO[Si](C)(C)C)sc2C1	1820160635	UIYXZTQADKDYBV-ZDUSSCGKSA-N	426.615	1.775	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)Nc1cc([C@H]2CCCCN2C(=O)C(O)O)[nH]n1	1821775690	KJVVJPPZYWRLML-NYUWMOHMSA-N	431.399	1.598	50	20	IDGD	
C[C@H](Br)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2nc3ncccn3n2)[nH]n1	1822187458	VIPQLGFTSKIPFC-JQWIXIFHSA-N	447.297	1.937	50	20	IDGD	
CC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CNC(=O)c1cccnc1)CC2	1822841948	YLQRQHVNRHXNAT-OLZOCXBDSA-N	435.937	1.898	50	20	IDGD	
O=C(CCN1CCOC1=O)N[C@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1	1823006504	CDZPMEVKJZJKHB-UFBFGSQYSA-N	449.302	1.588	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H]2CCCS2)n[nH]1	1823010726	IFELMYCZRMEKSH-JKSUJKDBSA-N	443.533	1.610	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CN2C(=O)CNC2=O)CC1	1824899327	REYSXCLFIIJSOO-CVEARBPZSA-N	426.945	1.565	50	20	IDGD	
CCc1ccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)cn1	1825749060	KCNUPVCLMJZWKS-HSZRJFAPSA-N	449.360	1.871	50	20	IDGD	
CC1=C(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CCO1	1827281243	MKYRNNCQTXPVLU-OAQYLSRUSA-N	426.322	1.294	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4c[nH]nc4c3)C2)C1	1830358665	YWOMPDRJJFFDQH-OAQYLSRUSA-N	434.924	1.898	50	20	IDGD	
O=C(c1ccc(Cl)cc1F)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1830720053	RVLKSKVXFXRCPP-MAUKXSAKSA-N	435.279	1.149	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4nccn4c3)C2)C1	1831647520	XCUSONUBDASFCJ-DYESRHJHSA-N	434.924	1.812	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(O)nc2)CC1	1831873140	BGMQZDZGCSULEG-SFHVURJKSA-N	431.537	1.394	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)COC(C)(C)C)CCO2)C1	1832306923	KEYHUSOFDGFYGN-KDOFPFPSSA-N	435.359	1.289	50	20	IDGD	
CC(C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1	1832315701	HWVWVBGYEGIRLO-ROUUACIJSA-N	425.353	1.494	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnc(OC)c(F)c3)CCO2)C1	1833485770	SFEKRFMUHHGGIY-IFXJQAMLSA-N	429.876	1.317	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)cn1	1833998374	GSXBIIZKXDWFGP-KBXCAEBGSA-N	426.311	1.243	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(C)cn3)CCO2)C1	1834378220	AYLVTMLMLBHFDX-BEFAXECRSA-N	440.338	1.634	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(C)cn3)CCO2)C1	1834378223	AYLVTMLMLBHFDX-KXBFYZLASA-N	440.338	1.634	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnoc3C3CC3)CCO2)C1	1834617416	PXTFJLIXPYPITF-MOPGFXCFSA-N	446.331	1.858	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)C[C@H](NC)C(=O)O)CC2)CC1	1834740681	QFFANBLOXFZEHD-SJORKVTESA-N	430.977	1.028	50	20	IDGD	
O=C(NCC(=O)N1CCC(N2CCC(NC(=O)[C@@H](F)Cl)CC2)CC1)c1cccs1	1835078501	JOOZDWNRUHFXFX-QGZVFWFLSA-N	444.960	1.584	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)COc3ccccc3C)CCO2)C1	1835155414	PUQQGFHFDQYUME-UTKZUKDTSA-N	440.924	1.084	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC1CCN(C2CCN(C(=O)c3cc[n+]([O-])cc3)CC2)CC1	1835836318	YJLHDTZDASMCIQ-UHFFFAOYSA-N	434.613	1.357	50	20	IDGD	
CC(C)N[C@@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)CCBr)C2)C1)C(C)C	1835895285	YPFHGJBUCCLARP-IEBWSBKVSA-N	448.402	1.250	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836717752	IWRLSSANOSXOQO-SFHVURJKSA-N	448.951	1.855	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cccc(OC)n3)CC2)CC1	1837353362	RFCQIIISAIJPDF-QGZVFWFLSA-N	439.940	1.956	50	20	IDGD	
O=C(CCBr)N1CCC(OC2CCN(C(=O)Cn3ccnn3)CC2)CC1	1837653790	YJEIGVKPPKWUEN-UHFFFAOYSA-N	428.331	1.062	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)C3Cc4ccccc4C3)C2)C1	1837717587	IFHAPJKLLUOXAF-HSZRJFAPSA-N	446.620	1.709	50	20	IDGD	
O=C(c1cc(-c2ccncc2)[nH]n1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1838011220	NJUNGTLLAQFRGM-LPHOPBHVSA-N	437.859	1.076	50	20	IDGD	
CCn1nc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)cc1C	1838150655	NSBCJEOIRZJHKU-HXUWFJFHSA-N	438.601	1.133	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(OC)cc3OC)CCO2)C1	1838880282	LFTPUOFFKBPEJQ-DYESRHJHSA-N	440.924	1.791	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)cc1	1838967296	VWBDGBCPOYVJPN-QAPCUYQASA-N	445.285	1.456	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3nnc(-c4ccccc4)o3)C2)C1	1839146233	WVERXWSYUABJNF-IIBYNOLFSA-N	448.907	1.824	50	20	IDGD	
C=CCC(F)(F)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2	1839155247	PJQZROQNHWJALI-HZPDHXFCSA-N	429.291	1.891	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc4c(c3)C(=O)CC4)CCO2)C1	1839528802	NCRDPQNMKSYKEO-GCJKJVERSA-N	434.920	1.903	50	20	IDGD	
O=C(Cc1ccccc1O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1839908902	GAJWAOCLRGULPC-SJLPKXTDSA-N	445.285	1.082	50	20	IDGD	
Cc1ccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](C)CBr)C3)C2)o1	1840506848	SBSZHGPVORAXDY-AUUYWEPGSA-N	443.338	1.618	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(F)cc3OC)CCO2)C1	1840641113	OOZOVMRPGYQNOE-OXQOHEQNSA-N	428.888	1.922	50	20	IDGD	
O=C([C@H](O)CCl)N1CC2(CCCN2C(=O)/C=C/c2ccc(Cn3ccnc3)cc2)C1	1841981076	CWTSRHLVCQESIS-OVKVCFKUSA-N	428.920	1.748	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)c2ccc(C(F)(F)F)nc2)C1	1842476774	MXLYNKHKUWRHHR-UHFFFAOYSA-N	427.427	1.290	50	20	IDGD	
O=C(c1cc2cc(F)c(F)cc2[nH]1)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843011623	WXUPYIZCZYKUQW-UHFFFAOYSA-N	439.227	1.257	50	20	IDGD	
N#C/C(=C\c1ccc(Br)cc1)C(=O)N1CC2(CCCN2C(=O)CCC(N)=O)C1	1845995004	YFFLUBYYAVEQDY-XNTDXEJSSA-N	445.317	1.825	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@H]1CN(C(=O)OC(C)(C)C)CCO1)C2	1846365664	MULLWRJGFIHKNS-LSDHHAIUSA-N	445.944	1.080	50	20	IDGD	
COC(=O)CCCCCC(=O)N1CCCC12CN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2	1846427740	VYPBIJDCIPLXSR-LFVJCYFKSA-N	445.520	1.447	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CN1C(=O)CSC1=S	1847501465	CGBLJEDDCPECJT-VWYCJHECSA-N	434.381	1.080	50	20	IDGD	
O=C(c1cn2cc(C(F)(F)F)ccc2n1)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl	1847562690	CIKLVRICDIUYOE-MELADBBJSA-N	430.814	1.768	50	20	IDGD	
CC(C)c1csc(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2cnccc2C(=O)NN)n1	1848291758	CTZCFVBPUHGKMK-HOTGVXAUSA-N	428.518	1.394	50	20	IDGD	
C[C@@H]1CN(S(=O)(=O)c2cccc(C(=O)NNC(=O)c3ccccc3O)c2)C[C@@H](C)O1	17573694	FPJYJNPIZWPDFP-ZIAGYGMSSA-N	433.486	1.265	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cc3c(C)nn(C)c3s2)cc1OC	21697307	XRTIKYJJTHPJJN-UHFFFAOYSA-N	432.458	1.578	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)c1cc(OC)c(OCC(N)=O)c(OC)c1	24630189	RGXKJGSNWLOWRT-UHFFFAOYSA-N	437.836	1.305	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)c1ccc(Cl)c(S(=O)(=O)NC[C@H]2CCCO2)c1	726540315	FGOGZDYGKRXLSD-CYBMUJFWSA-N	440.909	1.211	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)[C@H]2CCCN(C(=O)c3ccc4n[nH]cc4c3)C2)cc1	728204510	SGSRTCOZDVKKJH-KRWDZBQOSA-N	434.500	1.983	50	20	IDGD	
CC[C@@H](N=c1nn[nH]n1-c1ccccc1)C(=O)NNC(=O)c1ccc(Cl)cc1OC	729512553	JVVUHUVOOPZTPO-OAHLLOKOSA-N	429.868	1.398	50	20	IDGD	
O=C(CN1CCC([C@H](O)c2ccc(F)cc2)CC1)NNC(=O)c1cccc([N+](=O)[O-])c1	731038671	PBAVFKIKWNAOPI-HXUWFJFHSA-N	430.436	1.941	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)N1CCN(S(=O)(=O)c2ccc(C)c(C)c2)CC1	731499808	IEVZTJQBFZJHEE-UHFFFAOYSA-N	446.529	1.673	50	20	IDGD	
COc1ccnc(NNC(=O)NCCC(=O)N(C)Cc2ccccc2Br)n1	732469369	GSKOMBXZRZDYPM-UHFFFAOYSA-N	437.298	1.923	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)N[C@H]2CCN(CC(F)(F)F)C2=O)c1	732590974	ZESCFWZCMSJVGW-AWEZNQCLSA-N	430.427	1.991	50	20	IDGD	
COC(=O)c1cc(OC(=O)CCc2c(C)nc(N3CCOCC3)nc2O)ccc1[N+](=O)[O-]	732653522	YEOPIOKEYAGDNC-UHFFFAOYSA-N	446.416	1.560	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)N[C@H](Cc1ccccc1)CN1CCOCC1	733649663	AUKLJIBXVWSUAT-OAQYLSRUSA-N	448.527	1.760	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)c1cccn(Cc2ccccc2)c1=O	734239392	OBGTZFULOUJICV-UHFFFAOYSA-N	429.477	1.365	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)[C@H]1CCCC[C@@H]1C(=O)N1CCCC1	734241593	RIXBEQUMMKGIRA-GJZGRUSLSA-N	425.530	1.270	50	20	IDGD	
CCOc1ccccc1N1C[C@@H](C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)CC1=O	734242223	XSFSMTPSYLPASD-AWEZNQCLSA-N	449.508	1.293	50	20	IDGD	
CS(=O)(=O)N1CCCC[C@@H]1C(=O)NNc1cc(C(F)(F)F)nc(-c2ccccn2)n1	734258872	OPNGSPREEXDHJJ-GFCCVEGCSA-N	444.439	1.815	50	20	IDGD	
CCc1cc(NNC(=O)C2=NN(c3ccccc3)[C@@H](C(N)=O)C2)nc(-c2ccccn2)n1	734357254	RDJFBPJEAHSSTB-GOSISDBHSA-N	430.472	1.664	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCOC2CCCCCC2)c1	735762632	OTLIJZSOVYUYTC-UHFFFAOYSA-N	426.539	1.620	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN2CCN(Cc3cn4ccccc4n3)CC2)cc1C	736308789	RPFRLJVJDRENGG-UHFFFAOYSA-N	440.573	1.845	50	20	IDGD	
CSCC[C@H](C)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	737063525	HLUYRJUNFSWVJC-AWEZNQCLSA-N	428.580	1.947	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)c2ccc(Br)c([N+](=O)[O-])c2)c1	741820773	NCFGIPFRTWFNEH-UHFFFAOYSA-N	447.201	1.847	50	20	IDGD	
CC(C)(C)c1ccccc1S(=O)(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	742026973	YGGJWIPFWTUIOR-UHFFFAOYSA-N	445.950	1.908	50	20	IDGD	
Cc1nn(C)c2sc(C(=O)N[C@@H](C)C(=O)NNc3nc(-c4ccncc4)no3)cc12	742062151	KPVFXVLCQFIJJY-JTQLQIEISA-N	426.462	1.650	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)N2CC[C@H](CN3CCOCC3)C2)N(C)c2ccccc21	742103669	BNSHAFBZEPBWAV-GOSISDBHSA-N	437.544	1.838	50	20	IDGD	
Cc1ccc(N2C(=O)CC[C@H](C(=O)NNC(=O)C(=O)NC3CC3)[C@H]2c2cccs2)cc1	744463540	KAEIRKQQSTYQJW-LPHOPBHVSA-N	440.525	1.967	50	20	IDGD	
CC(C)(C)c1ccc(C(=O)NCC(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)cc1	744465546	MMRHVDICJXZINQ-UHFFFAOYSA-N	436.468	1.590	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)CC1	744583949	PJPNAFGRJBGHSL-UHFFFAOYSA-N	430.461	1.510	50	20	IDGD	
COc1ccc(COCC(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)cc1	744621285	NQOXQHCGTPPSIZ-UHFFFAOYSA-N	435.502	1.376	50	20	IDGD	
COc1cc(C(=O)Oc2ccc(C=NNC(=O)C(=O)NC3CC3)cc2)cc(OC)c1OC	744823948	KEUMTXWNLXSXNZ-UHFFFAOYSA-N	441.440	1.660	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)[C@@H]1COc2ccccc2O1)n1nnc(-c2ccc(Cl)cc2)n1	746080719	ZNUCAWSTEIOTDV-PBHICJAKSA-N	442.863	1.932	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)c1cc2c(s1)CCCCC2)N1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O	746099511	ABXBNQDBUVRVPY-GAYZEQNSSA-N	431.514	1.329	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2O)CC1	746457907	UAGUOYNFQHDLTM-UHFFFAOYSA-N	446.891	1.273	50	20	IDGD	
COC[C@H](NC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1)c1ccc(C)o1	746769964	IZBSMISRGOCPQK-INIZCTEOSA-N	438.506	1.235	50	20	IDGD	
Cc1nc(Cl)cc(NNC(=O)c2cccc(S(=O)(=O)N3C[C@H](C)O[C@@H](C)C3)c2)n1	747982188	UWMIXXDCCKCLAE-RYUDHWBXSA-N	439.925	1.993	50	20	IDGD	
Cc1nc(Cl)cc(NNC(=O)CN(C)S(=O)(=O)c2ccc(Br)cc2)n1	747982954	HAZAQNCSZZNXPR-UHFFFAOYSA-N	448.730	1.965	50	20	IDGD	
Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)NNC(=O)C1CCN(c2ncccn2)CC1	748642572	HEZGBWQBBINUAF-UHFFFAOYSA-N	434.478	1.228	50	20	IDGD	
CC(C)CCn1nc(C(=O)NNS(=O)(=O)c2cncc(F)c2)c2ccccc2c1=O	748790452	HAJPLADHNNAFDL-UHFFFAOYSA-N	433.465	1.600	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)[C@H]2CCCN2C(=O)c2ccc3c(c2)OCO3)c1	749470797	ANWQLNDGQUZERI-QGZVFWFLSA-N	441.440	1.498	50	20	IDGD	
O=C(NNC(=O)[C@H]1OCCc2ccccc21)c1ccc(S(=O)(=O)N2CCCC2)cc1	750054766	NTKZJGREMOMVFO-IBGZPJMESA-N	429.498	1.546	50	20	IDGD	
CC[S@](=O)[C@@H]1CCC[C@H](NC(=O)NNC(=O)c2csc(N3CCOCC3)n2)C1	750265227	AHLUFHGODXLSAU-HSRKRZFJSA-N	429.568	1.004	50	20	IDGD	
COCCCN1C(=O)C(=NNC(=O)CN2CCCC2=O)c2cc(Br)ccc21	750935828	ZFLSCOYHKILUSN-UHFFFAOYSA-N	437.294	1.275	50	20	IDGD	
C[C@H]1C[C@@H](NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)CCN1Cc1ccccc1	751098569	GNSZNRJVIOBIAJ-LPHOPBHVSA-N	434.504	1.659	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)C1CCN(c2ccc(C(F)(F)F)cn2)CC1	751204669	LKNVMWPERCJSMB-UHFFFAOYSA-N	439.394	1.487	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)c1cc(Cn2cc(Br)cn2)on1	751545717	CHPMDGFQGGTOMB-UHFFFAOYSA-N	438.213	1.661	50	20	IDGD	
CCSc1ccc(CC(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1	751918609	YCJMUHUJCWCFPJ-SFHVURJKSA-N	430.482	1.872	50	20	IDGD	
COc1ccc(-c2nn(-c3ccccc3)cc2CC(=O)NNC(=O)C(=O)NC(C)C)cc1	753005085	IMDUSSXRWRNJAN-UHFFFAOYSA-N	435.484	1.762	50	20	IDGD	
O=C(NC[C@@H]1CCCCS1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	753256473	VEXRBKDLIWKXTN-HNNXBMFYSA-N	426.564	1.701	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N2CCOCC2)cc1NC(=O)NNC(=O)[C@H](C)CC	755440443	AEYWHRHPPCRHDZ-CYBMUJFWSA-N	428.511	1.305	50	20	IDGD	
O=C(NNC(=O)c1ccncc1)Nc1cccc(S(=O)(=O)NC2=NCCCCC2)c1	755495692	NTXGWWYUSHCULP-UHFFFAOYSA-N	430.490	1.799	50	20	IDGD	
CON(C)S(=O)(=O)c1ccc(NC(=O)NNC(=O)c2c(C)nc3ccccn23)cc1	755531327	DLBYKEBQEBPMKE-UHFFFAOYSA-N	432.462	1.291	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1O)Nc1ccc(CC(=O)N2CCOCC2)cc1	755862828	VKQOQEIIRLWQFI-UHFFFAOYSA-N	432.864	1.913	50	20	IDGD	
COC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2scnc2C)c1Br	756154933	JJMBIQQVOXICTQ-UHFFFAOYSA-N	441.263	1.400	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCc2n[nH]cc2C1)c1nn(Cc2ccccc2)c(=O)c2ccccc12	756862550	DZYUIMZFZVDAQZ-MRXNPFEDSA-N	442.479	1.734	50	20	IDGD	
C[C@H]1C[C@@H](C)C[C@]2(C1)NC(=O)N(CC(=O)NNC(=O)c1cc(-c3ccccc3)[nH]n1)C2=O	757634533	UDCZFMMWVSRHBD-HSAQVAQVSA-N	438.488	1.584	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cc(Br)nn3C)CC2)cc1	757981314	WCKRVSIQXIOTDM-UHFFFAOYSA-N	449.353	1.070	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N(C)CC(C)(C)O)cc1	758260621	NOTKGLWLGDLXNJ-WJDWOHSUSA-N	425.489	1.570	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NC[C@H](C)CC2(C)OCCO2)nc1	758856503	YHZYMUKHZKSEPI-CQSZACIVSA-N	429.543	1.527	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)CCCN(C)S(=O)(=O)c2ccc(C(C)=O)cc2)nc1	759729745	LFVYPCDPVKXSBJ-UHFFFAOYSA-N	448.501	1.615	50	20	IDGD	
Cc1c(NC(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)cnc(Cl)c1Br	760067779	DABYAXVNUXQWAD-SSDOTTSWSA-N	425.692	1.393	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cc(C(=O)NNc3nnc(C)c(O)n3)ccc2F)cc1	760120602	JCLCJZBOYCRQLB-UHFFFAOYSA-N	448.436	1.591	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NCc2nnc(-c3ccccc3)s2)c2ccccc2c1=O	760191926	GTDQKTMPOGYPIU-UHFFFAOYSA-N	435.469	1.596	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@@H](C)C(=O)NNC(=O)c1ccc(S(N)(=O)=O)nc1	762738832	UBYGFNIIEPKVIK-NSHDSACASA-N	426.882	1.228	50	20	IDGD	
CSCC[C@H](NC(=O)c1ccccc1)C(=O)NNc1nccc(N2CCOCC2)n1	762855429	NWQRVQJRESPUAV-INIZCTEOSA-N	430.534	1.308	50	20	IDGD	
O=S(=O)(CBr)N1CCN(S(=O)(=O)Cc2ccc(F)c(Cl)c2)CC1	763206953	ZDUZBJZCZPRDQA-UHFFFAOYSA-N	449.751	1.609	50	20	IDGD	
CN(NC(=O)c1cccc(C[S@](C)=O)c1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	763282252	MLPMQAWAITYZEA-PMERELPUSA-N	438.550	1.814	50	20	IDGD	
C[C@@H]1COCCN1c1ccc(NC(=O)C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1	763445951	NAEXMYXYVASEMU-CYBMUJFWSA-N	427.417	1.220	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)C(=O)Nc1ccc(F)cc1OCC(F)F	763679883	PULWAMJSIITMCK-UHFFFAOYSA-N	429.326	1.774	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1cccc(Cl)c1-n1cncn1	763856909	IVDUHQZTCMCKSL-LLVKDONJSA-N	446.826	1.613	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccc(-n2cncn2)c(Cl)c1	763863857	DLYYEUFNCSNNHZ-LLVKDONJSA-N	446.826	1.613	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccc(CN2CCOC2=O)cc1	763870733	BUJUEAIKHSAEDS-ZDUSSCGKSA-N	444.419	1.331	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)N(C)C)c(C)c2)cc1OC	763902721	XBMZQQLVXILBER-UHFFFAOYSA-N	442.472	1.504	50	20	IDGD	
CC(=O)N(C)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Br)s2)cc1	763941154	OOOQYDMLXXAGFV-UHFFFAOYSA-N	439.291	1.893	50	20	IDGD	
O=C(NNC(=O)c1cccc(C(F)(F)F)c1)C(=O)Nc1cccc(C(=O)NC2CC2)c1	764037069	HQGYUDNEPQKARV-UHFFFAOYSA-N	434.374	1.997	50	20	IDGD	
Cn1nc2c(c1NC(=O)C(=O)NNC(=O)c1ccc(Br)cc1Cl)CCC2	764058547	KDMDOBWVGSXQLE-UHFFFAOYSA-N	440.685	1.724	50	20	IDGD	
CS(=O)(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3c2)c1	764062347	XPIFPDGOKLTHMS-UHFFFAOYSA-N	425.466	1.784	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc(CC(=O)N(C)C)cc3)n[nH]2)cc1	764110419	JTNRNWORTBIZDF-UHFFFAOYSA-N	448.483	1.416	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2ccc(O[C@H]3CCOC3)cc2)cc1	764127115	OCLRXAFJFHNQSK-IBGZPJMESA-N	427.457	1.582	50	20	IDGD	
CCCS(=O)(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(C#N)cc2)c1	764181366	BGBQEEYWXJJDBM-UHFFFAOYSA-N	429.458	1.110	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(NC(=O)C(=O)NNC(=O)CC2CCCC2)ccc1C	764187818	JEJHZXQPEFXSRK-UHFFFAOYSA-N	438.550	1.692	50	20	IDGD	
CN(C)C(=O)c1cc(NC(=O)C(=O)NNC(=O)CCc2ccccc2O)ccc1Cl	764278475	QCSOIKQBCHQYLS-UHFFFAOYSA-N	432.864	1.466	50	20	IDGD	
O=C(Cc1cc[nH]n1)NNC(=O)C(=O)Nc1cccc(-c2cn(Cc3ccccc3)nn2)c1	764294435	ZJSHUEAJFWORSA-UHFFFAOYSA-N	444.455	1.045	50	20	IDGD	
O=C1C[C@H](c2cccc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc3ccccc3)c2)CN1	764379698	HRCREHHNVMIJEG-ZDUSSCGKSA-N	432.383	1.048	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)nn1-c1cccc(F)c1	764399960	BTOHGNMIRCPXBN-UHFFFAOYSA-N	443.460	1.904	50	20	IDGD	
CCOc1ccc(NC(=S)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cc1	764514130	JVZQOZJOLPDNQO-UHFFFAOYSA-N	441.557	1.861	50	20	IDGD	
CC(=O)OCCc1cccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1	764701267	MOXQPPOQIMQMNO-UHFFFAOYSA-N	448.501	1.509	50	20	IDGD	
CCc1ccc(S(=O)(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cc1	765119103	PUKODQHZGXOTCX-UHFFFAOYSA-N	430.530	1.017	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2cccc(NS(=O)(=O)c3ccc(F)c(F)c3)c2)n[nH]1	765588396	ZVILYNXKIMLWMF-UHFFFAOYSA-N	435.412	1.872	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1coc(-c2ccccc2)n1	765736934	CDKNACUZOJTXPJ-UHFFFAOYSA-N	433.468	1.561	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)CN1CCN(Cc2ccc(C)cc2)CC1	766643362	LBVLMIUCWCFZES-UHFFFAOYSA-N	425.533	1.381	50	20	IDGD	
C[C@H](Cc1ccc(F)c(Br)c1)NC(=O)NNC(=O)C(=O)Nc1ccccn1	767127507	SCNLJTCSEHIKHC-SNVBAGLBSA-N	438.257	1.883	50	20	IDGD	
O=C(NNC(=O)c1cccc(OC(F)F)c1)NC1CCN([C@H]2CCCC[C@H]2O)CC1	767943475	NXSQVFQSAQNUGO-DLBZAZTESA-N	426.464	2.000	50	20	IDGD	
COc1cc2c(cc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccccc1F)NC(=O)CC2	768238632	SAMBYPPKHFXUSR-LLVKDONJSA-N	444.419	1.272	50	20	IDGD	
CC(C)[C@H](NC(=O)OC(C)(C)C)C(=O)NCC(=O)NNc1nc(-c2ccccc2)no1	768391696	GPUUWEBOEBAUTO-HNNXBMFYSA-N	432.481	1.845	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2ccc3c(c2)C(C)(C)C(=O)N3)cc1OC	768705202	UMZJELRHXOLALV-UHFFFAOYSA-N	441.440	1.552	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)c2ccc(S(C)(=O)=O)c(Br)c2)c(O)c1	769742719	UXHRORRBIPMOPI-UHFFFAOYSA-N	427.276	1.941	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)N[C@@H]3CCCC[C@H]3CNC(=O)OC(C)(C)C)nc21	770402662	UAEJEDAHZRPJTO-WCQYABFASA-N	434.501	1.779	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)N[C@H]1CC(=O)N(c2c(F)cccc2F)C1	771432384	ABXSOOKEGJQVAD-NSHDSACASA-N	449.370	1.388	50	20	IDGD	
COc1ccc([C@@]2(C)NC(=O)N(CC(=O)NNc3ccc(F)c([N+](=O)[O-])c3)C2=O)cc1	771596626	MJGVBEGEYCAODW-LJQANCHMSA-N	431.380	1.653	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)O[C@H](C)C(=O)NNC(=O)CC(C)C)ccc1F	771876905	ZVYJUOOSQWGSPB-CYBMUJFWSA-N	445.513	1.595	50	20	IDGD	
C[C@H]1CN(C(=O)OC(C)(C)C)[C@@H](C)CN1C(=O)NNC(=O)CNC(=O)c1cccs1	771955727	BUWZPKVFEXEFEJ-STQMWFEESA-N	439.538	1.548	50	20	IDGD	
COc1ccc([C@@H]2[C@@H](C(=O)O[C@@H](C)C(=O)NNC(=O)CC(C)C)CCC(=O)N2C)cc1	772136630	MWEBIDRJCGMRLJ-GZRFBZBPSA-N	433.505	1.730	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2C[C@@H](C)N(C(=O)OC(C)(C)C)C[C@H]2C)n1	772330475	LCWMZZNLLBEDQL-ZIAGYGMSSA-N	425.555	1.471	50	20	IDGD	
CC(C)c1nccnc1NNC(=O)CNS(=O)(=O)c1ccc(Br)s1	772845623	UHAXPHJRHNNZJO-UHFFFAOYSA-N	434.341	1.846	50	20	IDGD	
CO[C@H](c1ccc(Br)cc1)[C@@H](C)NC(=O)NN[C@@]1(C)CCS(=O)(=O)C1	774338766	BBOQCXSUPBIHLO-WPGHFRTFSA-N	434.356	1.906	50	20	IDGD	
C[C@H]1CN(CCOc2ccc(CCNC(=O)NNC(=O)C(=O)N3CCCC3)cc2)C[C@@H]1C	775455971	VKLRSWQBCZVMJX-ROUUACIJSA-N	445.564	1.149	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)Nc1ccc(S(=O)(=O)N2CCOCC2)cn1)c1ccccc1	776061607	MMJPOHGKIMGPBZ-KRWDZBQOSA-N	447.517	1.449	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)nc1	776063761	WUKVYYCFUSZIEL-HNNXBMFYSA-N	449.489	1.151	50	20	IDGD	
CN(NC(=O)CCNC(=O)c1cccs1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776204170	BXMOPBZNOQNKBD-UHFFFAOYSA-N	439.538	1.504	50	20	IDGD	
COc1cccc([C@@H]2[C@H](C(=O)NNc3nc(O)c4cnn(C)c4n3)CC(=O)N2C2CC2)c1	776475202	DEUPFRBMPBLREL-RHSMWYFYSA-N	437.460	1.273	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@@H]2C(=O)NNc2cccc(S(C)(=O)=O)c2)s1	776534720	RAOJCLBUMAZHPA-OAHLLOKOSA-N	443.572	1.756	50	20	IDGD	
Cc1cccc([C@H](CNC(=O)NNC(=O)CNC(=O)OC(C)(C)C)N2CCOCC2)c1	778602784	PNQIULFDEKDJFV-KRWDZBQOSA-N	435.525	1.223	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(OC)c(C(=O)NNc2cc(Cl)nc(N)n2)c1	779373694	WOMOOQDCQURGDH-UHFFFAOYSA-N	428.902	1.508	50	20	IDGD	
O=C(/C=C\c1ccc(O)c(O)c1)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	779533304	IMVYXIVTNODHHV-YWEYNIOJSA-N	444.919	1.730	50	20	IDGD	
Cc1cccc(-n2c(NNC(=O)CN3CCN(C)C(=O)C3)nc3ccccc3c2=O)c1C	780694941	OELRFLPIQATGGF-UHFFFAOYSA-N	434.500	1.220	50	20	IDGD	
COCCO[C@H]1CCN(C(=O)NNC(=O)[C@@H](C)Oc2cccc(Br)c2)C1	780951962	MHJQQVZUOUSJIX-DOMZBBRYSA-N	430.299	1.695	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)c1cc(Br)c2c(c1)OCCO2	780972059	YIFWWDVDGSGRKE-UHFFFAOYSA-N	444.282	1.896	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2ccc(C(=O)N(C)[C@H]3CCCN(C)C3)cc2)nc1	782148146	CWRNBJTWISDPIJ-KRWDZBQOSA-N	440.504	1.338	50	20	IDGD	
O=S(=O)(CBr)NC[C@H]1CCC[C@@H](NS(=O)(=O)CBr)C1	782437526	NFINHOUFEHCWDE-DTWKUNHWSA-N	442.195	1.089	50	20	IDGD	
CCNC(=O)COc1ccc(NC(=O)C(=O)NNc2ccc(Cl)cc2[N+](=O)[O-])cc1	783290623	CRYRFGFSHQYRDE-UHFFFAOYSA-N	435.824	1.845	50	20	IDGD	
CC(C)c1ccc(Cn2nccc2NC(=O)C(=O)NN[C@@]2(C)CCS(=O)(=O)C2)cc1	783426397	LRQLSKGWRRGONG-FQEVSTJZSA-N	433.534	1.191	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)[C@@H]2CC=CC[C@H]2C(=O)N2CCOCC2)cc1OC	784297601	YOXULQRMFJZROO-IAGOWNOFSA-N	431.489	1.296	50	20	IDGD	
CC(C)NC(=O)C(=O)NNC(=O)[C@@H]1CC(=O)N(C(C)(C)C)[C@H]1c1ccc(Cl)c(F)c1	785064153	CRVISJWCIMBDTO-WBMJQRKESA-N	440.903	1.839	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)NCc3ccc(S(C)(=O)=O)s3)nc21	786886557	LXVLDVAVYCTLID-UHFFFAOYSA-N	439.523	1.578	50	20	IDGD	
CCN(CC)Cc1ccc(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)cc1	787896053	JVGRVYDXKQBOSD-UHFFFAOYSA-N	436.516	1.744	50	20	IDGD	
COc1cccc([C@@H]2[C@@H](C(=O)NNc3ccc(-n4ccnc4)nn3)CC(=O)N2C2CC2)c1	788178350	NMDSXBIUUKPGPP-LAUBAEHRSA-N	433.472	1.866	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)CCCC[C@@H]2SC[C@@H]3NC(=O)N[C@H]23)cc1OC	788831768	RFOIFQQURLOKMA-OWQGQXMQSA-N	436.534	1.581	50	20	IDGD	
CCS(=O)(=O)c1ccc(CNC(=O)NNC(=O)COc2ccccc2OC)s1	792218359	SRHXBXYUDCFZGQ-UHFFFAOYSA-N	427.504	1.460	50	20	IDGD	
CCN(C(=O)OC(C)(C)C)[C@H](C)CNC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	792310480	LUFICDVSAPSNOX-CYBMUJFWSA-N	432.485	1.252	50	20	IDGD	
O=C(Cc1ccc(I)cc1)NNC(=O)[C@H]1COc2ccccc2O1	792564490	WTXAAVNHONXUOS-OAHLLOKOSA-N	438.221	1.821	50	20	IDGD	
COC(=O)[C@]1(c2ccccc2)CCN(CC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)C1	794802888	ICZRQAKYKPTOJM-OAQYLSRUSA-N	426.429	1.173	50	20	IDGD	
COc1ccc([C@H]2[C@H](C(=O)NNC(=O)C(=O)Nc3ccc(C)c(C)c3)CC(=O)N2C)cc1	798309005	SUUBIQKBPVNFNY-QUCCMNQESA-N	438.484	1.618	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)C2=NO[C@@H](CNC(=O)OC(C)(C)C)C2)cc1C	798310932	YDBHGVIFIKXROG-CQSZACIVSA-N	433.465	1.059	50	20	IDGD	
COC(=O)c1cccc(NC(=O)C(=O)NNc2cccc(S(C)(=O)=O)c2)c1OC(C)C	799257832	KZHHVAZFVKQIEX-UHFFFAOYSA-N	449.485	1.746	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)Cc2csc(-c3nc[nH]n3)n2)c(OC)cc1Cl	802079882	FGLBAJXMGYVUPS-UHFFFAOYSA-N	437.869	1.994	50	20	IDGD	
O=C(Cc1nc(-c2ccccc2)cs1)NNC(=O)CN1C(=O)[C@H]2CCCC[C@@H]2C1=O	802580944	BLOJCSZRIRBCSN-GJZGRUSLSA-N	426.498	1.675	50	20	IDGD	
Cc1noc(C)c1S(=O)(=O)NCC(=O)NNC(=O)Cc1nc(-c2ccccc2)cs1	802581095	NWRWSVUTVYIKOX-UHFFFAOYSA-N	449.514	1.083	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)O[C@H](C)c2nncn2C)cc1	805361299	VJINYRMMWNIXGC-KWZJRMENSA-N	449.471	1.774	50	20	IDGD	
CC(=O)N[C@@](C)(C(=O)NNc1nccnc1C1CCC1)c1ccc(S(C)(=O)=O)cc1	805464566	KLQLTPVQNIJKAT-HXUWFJFHSA-N	431.518	1.642	50	20	IDGD	
CN(C)[C@@H](CNC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)c1ccccc1Cl	807010283	YDQZFMOALFGBFN-KRWDZBQOSA-N	428.884	1.563	50	20	IDGD	
COCCOc1c(Cl)cc(S(=O)(=O)NNC(=O)Cc2cccnc2)cc1Cl	808088330	DULROJDJLWYLRM-UHFFFAOYSA-N	434.301	1.966	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)c3cncn3C)c2)c(C)c1	809551112	QHRXNGWWWDOOIP-UHFFFAOYSA-N	427.486	1.913	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)C(=O)Nc1ccc(Br)c([N+](=O)[O-])c1	810387303	ORODAMMGFRLWDB-UHFFFAOYSA-N	439.197	1.825	50	20	IDGD	
CN(NC(=O)COc1cc(F)cc(F)c1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	811032243	DVWTUAIQGKVSFP-UHFFFAOYSA-N	428.436	1.979	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2ccc3c(c2)OCCO3)cc1	813467326	DQPHTBXDCBDEGA-UHFFFAOYSA-N	434.474	1.240	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H]2CCN(c3ccccc3F)C2)c1	813853859	LIEHZJKQGUEHMU-OAHLLOKOSA-N	449.508	1.299	50	20	IDGD	
N#Cc1cc(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)cnc1C(F)(F)F	814735763	GGINWUQCWONQKL-UHFFFAOYSA-N	426.380	1.340	50	20	IDGD	
CCC(=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O)c1ccccc1OC(F)F	814785590	XWWSNPBFWZHAGZ-UHFFFAOYSA-N	427.433	1.103	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCc2nncn2C1)C(=O)Nc1cccnc1-c1ccc(Cl)s1	815692387	PXBUFXJSWGNHRE-JTQLQIEISA-N	445.892	1.404	50	20	IDGD	
CCOc1ccc(NNC(=O)C(=O)Nc2ccc(S(=O)(=O)N3CCCC3)cc2)cc1	815816444	WPLIUUWCFCNLHK-UHFFFAOYSA-N	432.502	1.952	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)c1sccc1S(=O)(=O)N1CCCC1	849185995	JILZGGQXWJOXAF-UHFFFAOYSA-N	439.515	1.381	50	20	IDGD	
COc1ccc(OCCNC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1	916215005	VSWHLFCLLLILAO-UHFFFAOYSA-N	441.532	1.617	50	20	IDGD	
Cc1nn(-c2ccccc2)c2sc(C(=O)NNC(=O)NC[C@H]3CCS(=O)(=O)C3)cc12	916375348	WLZGPRJNOKHEQD-CYBMUJFWSA-N	447.542	1.774	50	20	IDGD	
CSCC[C@@H](NC(=O)c1ccccc1)C(=O)NNC(=O)C(=O)Nc1ccc(C)c(C)c1	916561816	GKJFBWLUCUIEQP-GOSISDBHSA-N	442.541	1.941	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)N[C@H]1CCN2CCCC[C@H]12	916639260	SFLHWMIWJHIYOO-ZWKOTPCHSA-N	435.550	1.042	50	20	IDGD	
Cc1ccc(-n2nnc(C(=O)NNC(=O)c3ccc(Cl)c(S(N)(=O)=O)c3)c2C)cc1	917919134	MXFNISLUSAVBQP-UHFFFAOYSA-N	448.892	1.260	50	20	IDGD	
CC(=O)N1C[C@@H](C(=O)NNC(=O)COc2ccc(Br)cc2)Oc2ccccc21	919665491	ZRKJLLLJQALONM-KRWDZBQOSA-N	448.273	1.789	50	20	IDGD	
CN(C)C(=O)C[C@H](NC(=O)NNC(=O)COc1ccccc1[N+](=O)[O-])c1ccccc1	920045962	FMLYDYBUDMUERB-HNNXBMFYSA-N	429.433	1.524	50	20	IDGD	
COC(=O)/C=C/c1cc(OC)c(OC)c(S(=O)(=O)NNC(=O)NCc2ccco2)c1	921020400	JAZQBMAYFSHXEN-VOTSOKGWSA-N	439.446	1.176	50	20	IDGD	
CCCNC(=O)NNC(=O)c1ccc(CNS(=O)(=O)c2ccc(C(C)=O)cc2)cc1	921042950	WRMTUVFDUTXVAG-UHFFFAOYSA-N	432.502	1.722	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNS(=O)(=O)c2ccc3c(c2)CCO3)CC1	1116084325	FTZICCDUMJFSFQ-UHFFFAOYSA-N	425.507	1.578	50	20	IDGD	
COC(=O)C1CCC(NC(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)CC1	1116091095	WFAGWKBPIOMYLM-UHFFFAOYSA-N	426.514	1.696	50	20	IDGD	
O=C(CSc1ccc(C(=O)N2CCCC2)cn1)NNC(=O)c1ccc([N+](=O)[O-])cc1	1248537864	LTXVSXICSMCGPB-UHFFFAOYSA-N	429.458	1.779	50	20	IDGD	
COCCN1C(=O)c2ccc(C(=O)NNc3ccc(C(C)(C)C)nn3)cc2S1(=O)=O	1318639976	YYXJSKMXCSDLBY-UHFFFAOYSA-N	433.490	1.322	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNS(=O)(=O)c3ccc(CC#N)cc3)CC2)cc1	1319750807	RCCZSSSOZNLFCN-UHFFFAOYSA-N	441.557	1.188	50	20	IDGD	
CN1CCN(c2ccc(CNC(=O)NNC(=O)c3cncn3-c3ccccc3)cn2)CC1	1321725371	UOOOYBFQLCZIOE-UHFFFAOYSA-N	434.504	1.163	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc4cnccc4nc3C)C2)C1	1778441492	RRSQDNRQTMPWJF-UWJYYQICSA-N	432.908	1.636	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cn4cccnc4n3)C2)C1	1778473935	GFNJVVFUMGOYQE-FZKQIMNGSA-N	436.310	1.204	50	20	IDGD	
COc1ccnc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)c1	1779535099	NGMILNKEWSJFAK-FZKQIMNGSA-N	426.311	1.565	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2)c1ccc2c(c1)C(=O)CC2	1781276709	GOZCZOHNLBSZJV-WOIUINJBSA-N	434.920	1.543	50	20	IDGD	
COc1cccnc1CCC(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781325418	CWRDUXQHTAJSPT-WMZOPIPTSA-N	444.301	1.543	50	20	IDGD	
C=CC[C@@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2	1781740075	VPIHVZVDKVDHDY-NNKDJZKXSA-N	443.548	1.847	50	20	IDGD	
CCCCC[C@@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2	1781816479	AQXGTPGFBAVGSK-MEKIYTOJSA-N	444.381	1.710	50	20	IDGD	
O=C(c1ccc2ccnn2c1)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1782404385	CDUALQXRPAMHER-YOEHRIQHSA-N	425.258	1.468	50	20	IDGD	
C[C@H](Oc1ccccc1)C(=O)N1CC[C@@]2(CN(C(=O)[C@@H](F)Br)CCO2)C1	1783321029	KATLOJPJSPDBCY-JOQOYGCGSA-N	429.286	1.974	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc([N+](=O)[O-])o3)CCO2)C1	1783338206	DUNLSKJERBOLPB-ZBEGNZNMSA-N	430.255	1.805	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)CCCn3ccnc3C)CCO2)C1	1783354715	VBEMFQUIFRCEGA-APWZRJJASA-N	441.370	1.975	50	20	IDGD	
CCOC(CC(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](Br)CC)C2)C1)OCC	1783355918	ZWKOQZQUPSLPFO-KBXCAEBGSA-N	435.359	1.779	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc4cccnc4n3)CCO2)C1	1783534279	SBTJTALFEHZFCP-DJJJIMSYSA-N	433.306	1.857	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)COc3cccc(N(C)C)c3)CCO2)C1	1783873188	LZIZGOVTRGIKHJ-RXVVDRJESA-N	439.940	1.215	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3c(C)cc(C(N)=O)cc3C)CCO2)C1	1783877698	NMRGVQOBHAGIPL-IERDGZPVSA-N	437.924	1.100	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(=O)ccn3C)C[C@@H]21	1783970596	XFLFDZSYKMRLQM-RMRKRWHISA-N	440.338	1.010	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(-c4ccccc4)on3)C[C@@H]21)[C@H](O)CCl	1784084164	MKRSRZREUIIZMN-BVYOLEPJSA-N	433.892	1.535	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc4cc(Cl)ccn34)C[C@@H]21)[C@@H](O)CCl	1784089933	MIRCHHSGHBAIJK-MZGVZZPPSA-N	441.315	1.181	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ncccc3C(F)(F)F)C[C@@H]21)[C@@H](O)CCl	1784091617	YYCYNLPGGUOKBV-IMIFBBOLSA-N	435.830	1.293	50	20	IDGD	
CN(CCCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2)C(=O)OC(C)(C)C	1785582563	SGMJBPXCPUWKNO-YWZLYKJASA-N	447.960	1.063	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(F)nc3F)C[C@@H]21	1786404278	BINTVEDQYFOGMR-DRZSPHRISA-N	432.265	1.738	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCBr)[C@H]2C1	1786407756	SORLSHIAQQDSHQ-IHRRRGAJSA-N	448.358	1.276	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)c1nnsc1C1CC1	1787679856	QQFAUMCCJJKVGM-AYGWYOGXSA-N	447.330	1.699	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4nccn4c3)[C@H]2C1	1788056909	YBWINLNWLPFNOF-BZSNNMDCSA-N	430.581	1.779	50	20	IDGD	
CC(C)=NO[C@@H](C)C(=O)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1	1788144251	AEOSTTYQULLVCG-INIZCTEOSA-N	437.305	1.915	50	20	IDGD	
Cn1ccc(CC(=O)Nc2ccc(C3(NC(=O)c4cnccc4C(=O)NN)CCC3)cc2)n1	1788217472	OGCZZEUSQUXDMR-UHFFFAOYSA-N	447.499	1.409	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cn4cccnc4n3)[C@H]2C1	1788313598	WRCAROZJQOTYBL-OSFYFWSMSA-N	436.310	1.106	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(O)cc([N+](=O)[O-])c3)[C@H]2C1	1790216906	VBBGEEATTZQDSJ-SPOWBLRKSA-N	441.868	1.148	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cn(C)nc3C)C[C@@H]21	1790957928	FFMXALNMPRVVGX-TUUVXOQKSA-N	427.343	1.495	50	20	IDGD	
COc1ccc([C@@H](O)C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]3C2)cc1	1791292518	WISGKKSAWQIQHJ-QCEMKRCNSA-N	431.316	1.512	50	20	IDGD	
C[C@H](Cc1ccccc1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2C1	1791293319	UYBKBZGKHSRSDF-HZEGPAAWSA-N	444.576	1.218	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(OCCCO)cc3)C[C@@H]21)C(Cl)Cl	1791296706	VIFXABJKCJBSMT-XIRDDKMYSA-N	445.343	1.845	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](CN)c1ccccc1)C2	1792867958	ONTJXQUIYGXNIM-SOVHRIKKSA-N	438.366	1.350	50	20	IDGD	
Cc1ncccc1CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)CBr	1792868734	NFDMNJQDPYTKLJ-KUZCPNRJSA-N	438.366	1.943	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(Cl)nn1)C2	1792870946	MVZAXSKLXQZJKV-DYNIEEOBSA-N	431.718	1.364	50	20	IDGD	
CCc1ncsc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)CBr	1792872627	SCCHEWPIKCAHTQ-FMSGJZPZSA-N	430.368	1.940	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(CC#N)cc1)C2	1792873560	DFSUJIUPWFZMDW-RUGDWHBFSA-N	434.334	1.987	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CCc3cccc(Cl)c31)C2)[C@H](O)CCl	1792984081	SDJQUNMPUFHXGR-HEBKJCSOSA-N	427.328	1.559	50	20	IDGD	
CC(C)(C)OC(=O)N1CCO[C@H](C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](F)Cl)C3)C1	1793241577	JWHKUDCLUVSIHF-AIEDFZFUSA-N	433.908	1.795	50	20	IDGD	
C#CCO[C@H](C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)C2	1793348000	VRYMTRRUEWKHSI-ILCOLZDNSA-N	443.450	1.500	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cn3nc(C)sc3n1)C2	1793447337	DTTTXACDQUJEAG-IARIHHJXSA-N	439.969	1.639	50	20	IDGD	
O=C(CCn1c(=O)oc2ccccc21)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2	1793985006	KXLMTWXVCAKPPO-LZDSYCOUSA-N	425.844	1.109	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnn(-c2cccnc2)c1	1794445505	LFIZUIKODRNYDF-JJAZEVLHSA-N	448.321	1.254	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)c1	1796188346	SHFGHTIQGKATOS-WKCHPHFGSA-N	436.317	1.314	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(=O)oc1)C2	1796889722	CEXOWPVDHGBYDM-VFMVUTOHSA-N	425.445	1.026	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1csnc1C)C2	1796890061	XBRAYQJIPYVBCI-BFEVCPCASA-N	428.518	1.837	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)no1)C2	1799220724	VSGLZPOVQYOGRS-CLLJXQQHSA-N	444.400	1.779	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1=CCN(C(=O)OC(C)(C)C)C1)C2	1799263172	HBRLLKSCGUOAPS-YYIAUSFCSA-N	441.956	1.771	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1Cc3[nH]nc(C(F)(F)F)c3C1)C2	1799272447	ROJGHGKFTFLBPN-IMTAKKMFSA-N	448.873	1.750	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cn3ccsc3n1)C2	1799276306	IUEKDQHVEIMERD-WYFUGZQLSA-N	431.345	1.835	50	20	IDGD	
CN(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H]1CCOC1)C2)NC(=O)NCc1ccccc1	1799869081	AZVZXZSHAJPVIZ-YSTOQKLRSA-N	443.548	1.007	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](F)Br	1800156794	BHEOORBJHZZACD-XFMPKHEZSA-N	427.274	1.140	50	20	IDGD	
COc1ccc(Cl)cc1CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2	1800403327	VFAXIFWJZRDJMF-HRJSJKBJSA-N	431.316	1.080	50	20	IDGD	
COc1cc(C#N)cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)Br)c1	1800760574	SUMXDEHSJZBSOR-FIUQPQMISA-N	436.306	1.553	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)[C@H]1CCc2ccccc21	1801114883	ZSORLXVERPTSGA-QMPXSYISSA-N	425.298	1.997	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(S(C)(=O)=O)c(F)c1)C2	1802284046	OMRRDMADBHVLGM-LXTVHRRPSA-N	446.928	1.735	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc3cncn3c2)[C@@H]1c1cccnc1)[C@H](O)CCl	1803142853	KXKWMWSOZMMBCF-KFKAGJAMSA-N	427.892	1.649	50	20	IDGD	
O=C(c1cncn1-c1ccncc1)N1CCC2(CCCN(C(=O)[C@H](O)CCl)C2)CC1	1805517507	HFBSBGOFHWNPHM-GOSISDBHSA-N	431.924	1.712	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)[C@@H]2CC=CCC2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1	1807367106	XGUFMDRFYGLXLO-NQSCKRDGSA-N	433.317	1.437	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)[C@@H](O)Cc2ccccc2)[C@@H]1c1cccnc1	1812773563	UNUJJDDHCFEJBK-ANULTFPQSA-N	445.947	1.945	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)n2cnnn2)[C@@H]1c1cccnc1	1812867938	PGEXJCWWNZREOY-MYZSUADSSA-N	436.314	1.119	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2cc(F)c[nH]2)[C@@H]1c1cccnc1	1812922368	WJVFATSIMIBXHT-QRWLVFNGSA-N	430.484	1.241	50	20	IDGD	
CCc1cc(C(=O)N2CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)n[nH]1	1813070561	IUBPIFPWPCNSHZ-IERDGZPVSA-N	441.536	1.060	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)C2(C#N)CCC2)[C@H]1c1cccnc1	1813074799	VWOLAANRHWDBFN-XLIONFOSSA-N	426.521	1.154	50	20	IDGD	
O=C(COc1cccnn1)NC[C@@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1	1813389493	RRFYHMGPQOAVRZ-HNAYVOBHSA-N	448.321	1.741	50	20	IDGD	
C=CCOCCCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1	1815208060	QYYJCLFGAQTWQV-KRWDZBQOSA-N	434.541	1.758	50	20	IDGD	
Cc1ccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)c(C)n1	1820046662	LZYKUEGZAXANMZ-FQEVSTJZSA-N	447.304	1.721	50	20	IDGD	
C[Si](C)(C)OCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1n[nH]cc1[N+](=O)[O-])CC2	1820165299	CXOVVZJNPYANTC-VIFPVBQESA-N	438.542	1.852	50	20	IDGD	
COC[C@H](NC(C)=O)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](F)Br)n[nH]1	1820935341	KQQQPYYAHRLAQT-OUCADQQQSA-N	448.293	1.243	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1cc([C@H]2CCCCN2C(=O)C2=NNC(=O)C2)[nH]n1	1822085788	DXZWHCWOZAVFBL-JOYOIKCWSA-N	425.287	1.451	50	20	IDGD	
C[C@H](Br)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccnc2C(N)=O)[nH]n1	1822186343	KYXIPJPRBHOPDP-GWCFXTLKSA-N	449.309	1.993	50	20	IDGD	
C=C(C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1)C(F)(F)F	1822416788	PJHUQAGGQMHBTA-CYBMUJFWSA-N	430.431	1.893	50	20	IDGD	
CC(C)=CCCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2	1822731062	UDFHVQSTNVPKJZ-INIZCTEOSA-N	427.335	1.795	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)C[C@H]2NC(=O)NC2=O)CC1	1824610127	WVLVZGNITDYPRV-ARFHVFGLSA-N	426.945	1.612	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](C)n1cncn1)CC2	1825648059	XEDPAIAXVHAYLY-GUBZILKMSA-N	427.328	1.691	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cn(C)nc1OC)CC2	1825994453	ULTFQFMPEWUWEY-ONGXEEELSA-N	427.914	1.365	50	20	IDGD	
O=C(CCc1cccnc1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827052745	DAHKAZGLVJHQDZ-QHCPKHFHSA-N	449.360	1.628	50	20	IDGD	
Cc1ccc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)nc1	1827056009	NOYDAUHILFHNJY-QFIPXVFZSA-N	435.333	1.617	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccnc3Cl)CCO2)C1	1829500725	GAROCVRXUZWMNP-KSSFIOAISA-N	432.304	1.059	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3cccc(C#N)c3)CCO2)C1	1830462339	BSYWTTGFTJQTSM-SIKLNZKXSA-N	449.935	1.201	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(OC)nc3)C2)C1	1831641201	XCGJEQXSGNQLLU-OXJNMPFZSA-N	425.913	1.568	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3n[nH]c4c3CCCC4)C2)C1	1831646245	JYAILRWPBLSJJA-IERDGZPVSA-N	438.956	1.766	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(OC)cc3O)C2)C1	1831655268	VKJJZBARXGUZOH-UTKZUKDTSA-N	440.924	1.878	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2nc3ncccn3n2)CC1	1831832279	FTZJFRDFAMPDQR-CVEARBPZSA-N	434.928	1.611	50	20	IDGD	
C=CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2	1832552064	XDYVUFLTZCDYLH-MGPUTAFESA-N	445.944	1.151	50	20	IDGD	
O=C(CN1CCc2sccc2C1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1832584433	BPXSETOTQKVFNB-IEBWSBKVSA-N	445.944	1.097	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3cncc(OC)c3)CCO2)C1	1832916266	MMUNNOSRVGUCQG-GHTZIAJQSA-N	439.940	1.497	50	20	IDGD	
CC(=O)N1CCC(N2CCC(NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CC2)CC1	1833726778	HGUIUOZHTOSHLB-KRWDZBQOSA-N	430.977	1.710	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)Cc3ccc(C)nc3)CC2)CC1	1833866424	GQPUFZVREVCZMR-FQEVSTJZSA-N	436.984	1.758	50	20	IDGD	
CCc1oncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)Br)C2)C1	1834522125	FPGIPCVZHREZSP-YVEFUNNKSA-N	430.299	1.090	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)[C@@H]1CNc2ccccc21	1834726078	DEYAYYCMNNYEPY-QUCCMNQESA-N	434.968	1.367	50	20	IDGD	
O=C(Cc1noc2ccccc12)NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1834815497	JOWITPKXVMRKJD-IBGZPJMESA-N	448.951	1.542	50	20	IDGD	
CC(C)CNC(=O)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1835130470	IHWZOAVTOJUWHN-OAHLLOKOSA-N	449.365	1.021	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3cn[nH]c3)CC2)CC1	1835174572	PLRXPMPPXOTSCP-MRXNPFEDSA-N	426.359	1.768	50	20	IDGD	
COC(=O)C1(C(=O)N2CCC(N3CCC(NC(=O)CO[Si](C)(C)C)CC3)CC2)CC1	1835837704	QCNFOFQLTYZBKF-UHFFFAOYSA-N	439.629	1.363	50	20	IDGD	
CCn1nc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)c2ccccc21	1836342702	FNGAZJLUMXIVHG-FXAWDEMLSA-N	438.887	1.661	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)c3cnnn3C)CC2)CC1	1837232510	BXRNXVAPBKEKBH-HNNXBMFYSA-N	442.358	1.601	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)C(=O)c3ccccc3)C2)C1	1837712207	JCWGTLIKGFUDNL-OAQYLSRUSA-N	434.565	1.177	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(C=O)s3)C2)C1	1839151668	ABWAQMOOSSICKI-MSOLQXFVSA-N	449.356	1.867	50	20	IDGD	
CCN(CC)C[C@@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1839674864	LEWCFMVFQHPPFF-UTKZUKDTSA-N	432.005	1.686	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)C3CCC(O)CC3)C2)C1	1839967568	QKOKKFBTHYUMNM-GETDIDHLSA-N	447.370	1.167	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3c[nH]c4ccccc34)C2)C1	1840154128	LZQZYLOHZAOHKP-XMSQKQJNSA-N	449.935	1.421	50	20	IDGD	
O=C(c1nc(Cl)ccc1F)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840186714	TWTBONXRXONIPG-INIZCTEOSA-N	440.686	1.748	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)C3CC(C)(C)C3)CCO2)C1	1840222736	NEFUFQZSDFQWHI-LIRRHRJNSA-N	431.371	1.910	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC2(CCCN2C(=O)CN2CCCC2=O)C1	1842832143	MKQOPSBPHWOXDO-CXUHLZMHSA-N	428.439	1.698	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CO)C(=O)N1CC2(CCCN2C(=O)[C@@](C)(Cl)CCl)C1	1845170277	IQCZHLFIQKIMFH-SJCJKPOMSA-N	438.352	1.312	50	20	IDGD	
O=C1C[C@@H](C(=O)N2CCCC23CN(C(=O)[C@H](Br)Cc2ccccc2)C3)CCN1	1846424579	ROZXXNHBJIMMND-DLBZAZTESA-N	448.361	1.722	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)CCc2c[nH]c3ncccc23)C1	1847028380	FMULNBRHIGQBPH-UHFFFAOYSA-N	447.499	1.011	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H]1CCC[C@@H]1C(=O)N1CCCC12CN(C(=O)[C@@H](O)CCl)C2	1847085247	XUELNKKHSIGQJB-KKUMJFAQSA-N	429.945	1.483	50	20	IDGD	
COc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](C)CBr)n1	1847498477	KVSWIJUWJJCRFY-WOPDTQHZSA-N	441.282	1.845	50	20	IDGD	
Cc1nc[nH]c1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1848100162	UIRYMSTUJVNYAY-IHRRRGAJSA-N	425.917	1.666	50	20	IDGD	
Cc1ccc(S(=O)(=O)c2ccc(NNC(=O)c3cc(S(N)(=O)=O)cn3C)cc2)cc1	23418367	MCIRLIUPXBJVLV-UHFFFAOYSA-N	448.526	1.571	50	20	IDGD	
O=C(NNC(=O)c1ccc(COc2ccccc2)o1)c1cccc(CN2C(=O)CNC2=O)c1	26632661	LBVIFQUWXMAVQL-UHFFFAOYSA-N	448.435	1.985	50	20	IDGD	
COc1cc(C=NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc(OC)c1O	254752279	SICSYFOBBMYOEW-UHFFFAOYSA-N	433.486	1.958	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C[C@H]1Sc2ccc(Cl)cc2NC1=O	725740425	DPVXLPPRDNHHFQ-CYBMUJFWSA-N	438.918	1.782	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)CN1C(=O)Cn2c(cc3ccccc32)C1=O	725878229	MIBSUVXCDFWMBQ-UHFFFAOYSA-N	434.452	1.413	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NC2CCC(NC(C)=O)CC2)nc1	726276320	QIKQKWTVWCPQLQ-UHFFFAOYSA-N	426.543	1.186	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)COc2ccccc2OCC(F)(F)F)c1	727664614	XCRWTMYMZHOPQB-UHFFFAOYSA-N	446.403	1.871	50	20	IDGD	
COc1ccc([C@@]2(C)NC(=O)N(CC(=O)NNC(=O)CCCc3ccccc3)C2=O)cc1	727717053	ROLOVJLACPSGLQ-HSZRJFAPSA-N	438.484	1.633	50	20	IDGD	
Cc1cccc([C@H](CC(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)NC(N)=O)c1	728209782	LXELCLKLDBBXJR-SFHVURJKSA-N	431.518	1.679	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)CCOCc3ccccc3)cc2)CC1	728214655	DJVWUPQGUWVTDA-UHFFFAOYSA-N	432.546	1.673	50	20	IDGD	
C[C@@H]1C[C@@H](C)CN(C(=O)CN2CCN(C(=O)NNC(=O)c3cccc(C#N)c3)CC2)C1	728954651	LNEYIICFPDDPIU-IAGOWNOFSA-N	426.521	1.035	50	20	IDGD	
N#CCCCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	729056581	KHDDTEBOBQGCNK-UHFFFAOYSA-N	429.502	1.803	50	20	IDGD	
CC(C)N1C(=O)c2ccc(C(=O)NNC(=O)C(C)(C)c3ccccc3)cc2S1(=O)=O	731176819	CNRDIDVZIKOSCB-UHFFFAOYSA-N	429.498	1.978	50	20	IDGD	
Cc1n[nH]cc1S(=O)(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	732045054	AAMMERXCAJTMGA-UHFFFAOYSA-N	438.473	1.043	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)c1csc(N2CCOCC2)n1)N(C)Cc1ccccc1	732236505	XXHQCCYAHNQESQ-HNNXBMFYSA-N	432.550	1.444	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2ccc(CNC(=O)C3CCCC3)cc2)C[C@H](C)O1	732263037	YYRPQCADMIFJHV-IRXDYDNUSA-N	430.549	1.753	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCCN(C)CC(F)(F)F)nc1	732703437	GLWKGEUQXLUBAI-UHFFFAOYSA-N	426.465	1.232	50	20	IDGD	
COc1ccc(CN2C[C@H](C(=O)NNC(=O)c3cnn(-c4ccccc4)c3)CC2=O)cc1	733108110	GKRCVKREEXRFCC-QGZVFWFLSA-N	433.468	1.691	50	20	IDGD	
CCOCCCn1c(NNC(=O)c2ccc(-n3cncn3)nc2)nc2ccccc2c1=O	733268876	SWSBXGCMPNLYTI-UHFFFAOYSA-N	434.460	1.556	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NCCN2CCN(C(=O)C3CCCCC3)CC2)cc1	733651694	NUHQDMKPLKSLNZ-UHFFFAOYSA-N	445.564	1.429	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)CCn1nnc2ccccc2c1=O	734250984	SHJKRWICCXARDY-UHFFFAOYSA-N	444.517	1.402	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)[C@H](Cc2ccccc2)n2nnnc2C)cc1	735630507	ILXWNUZJTFKPNZ-QRWLVFNGSA-N	438.488	1.779	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)NCc2nonc2C)cc1	736152964	PSOGDMYGRMNSGR-OQLLNIDSSA-N	435.444	1.349	50	20	IDGD	
Cc1ccc([C@H](CN2CCOCC2)NC(=O)NNC(=O)COCc2ccccc2)cc1	738497146	LCOXISHICFJABV-NRFANRHFSA-N	426.517	1.916	50	20	IDGD	
Cc1noc(C)c1C[C@@H](C)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	739049305	IJGXHHZNUYJVHG-CYBMUJFWSA-N	449.533	1.651	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN(C)Cc2ccc(S(C)(=O)=O)cc2)cc1OC	740887317	QHGXPSYABLPDFZ-UHFFFAOYSA-N	435.502	1.000	50	20	IDGD	
CCCNC(=O)NNC(=O)[C@H](CCS(C)(=O)=O)Cc1cccc(Br)c1	741211234	FVUKBXFVPXBDBF-CYBMUJFWSA-N	434.356	1.783	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)N[C@@H](C)[C@H]2CN(Cc3ccccc3)CCO2)c1	741268240	WCWISMRKFPUVCH-GHTZIAJQSA-N	426.517	1.994	50	20	IDGD	
CC(C)CNC(=O)N1CCC[C@@H](C(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)C1	741362221	SWKRTBMIFQCMKF-OAHLLOKOSA-N	438.912	1.722	50	20	IDGD	
COCc1cc(C(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)no1	742473983	PKWXBHGVAHPWBK-UHFFFAOYSA-N	433.424	1.654	50	20	IDGD	
O=C(CCN1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O)NNC(=O)c1cc2c(s1)CCCCC2	742481802	BXLVNDZWUMHISO-HLNSBACISA-N	431.514	1.331	50	20	IDGD	
O=C(NCCN1C(=O)c2ccccc2C1=O)NNC(=O)c1cccc(Br)c1	743687878	UAQDUHTVQWZKTO-UHFFFAOYSA-N	431.246	1.689	50	20	IDGD	
O=C(CN1C(=O)CCOc2ccccc21)NNC(=O)c1cc(Br)ccc1O	743730421	WXMSEIZEDFLWCT-UHFFFAOYSA-N	434.246	1.731	50	20	IDGD	
NC(=O)[C@H]1CCCN(CCCNC(=O)NNC(=O)CSc2ccc(Cl)cc2)C1	745833617	ZBQOYHFZXDWCFV-ZDUSSCGKSA-N	427.958	1.350	50	20	IDGD	
C[C@@H](CN1CCN(c2ccccc2)CC1)NC(=O)NNC(=O)Cc1nc2ccccc2n1C	745839194	OKFXAVMRAJPTAL-SFHVURJKSA-N	449.559	1.657	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)N[C@@H]3C[C@@]3(C)c3ccccc3)nc2)CC1	745859459	YZUSOTKCISYERJ-NQIIRXRSSA-N	444.561	1.374	50	20	IDGD	
O=C(COC[C@@H]1CCCO1)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	746385516	FNQCYMYBGXVEJY-IBGZPJMESA-N	436.472	1.345	50	20	IDGD	
CSCc1noc(CCC(=O)NNC(=O)COc2ccc(Br)cc2)n1	746774852	DDUBTRHAGSNZRP-UHFFFAOYSA-N	429.296	1.854	50	20	IDGD	
COc1ccc(C(=O)NCC(=O)NNc2nc(-c3ccccn3)nc3c2CCC3)cc1OC	747982705	JIAOUFVBCWTDOF-UHFFFAOYSA-N	448.483	1.918	50	20	IDGD	
O=C(COC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1)NN=C(c1ccccc1)c1ccccc1	748485779	ODIHUIDDBJCXLX-UHFFFAOYSA-N	434.408	1.869	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)N[C@@H]2CCCN(Cc3ccccn3)C2=O)cc1C	753289334	LHFMTYKUNWDAFK-GOSISDBHSA-N	438.488	1.159	50	20	IDGD	
C[C@H](NC(=O)OC(C)(C)C)[C@H](C)C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	755314718	ZKAOEJNGBXBDPL-STQMWFEESA-N	442.538	1.247	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)Nc3ccc(-n4nccn4)nc3)n[nH]2)cc1OC	755948583	BCZQJIKRPALFKZ-UHFFFAOYSA-N	449.431	1.536	50	20	IDGD	
COc1ccccc1OCC(=O)Nc1cccc(NC(=O)NNC(=O)c2cnn(C)c2)c1	756096163	PHANYDVFNGJAGC-UHFFFAOYSA-N	438.444	1.913	50	20	IDGD	
COc1ccc(C(=O)N(C)C)cc1NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1	756121566	JNDKMTBYZZHWAG-UHFFFAOYSA-N	441.492	1.256	50	20	IDGD	
CSc1cc2c(cc1NC(=O)NNC(=O)c1nn(C)c(=O)c3ccccc13)OCCO2	756299906	BTPDMIJCRPQIFC-UHFFFAOYSA-N	441.469	1.893	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)c2ccc(C)cc2O)ccc1S(=O)(=O)N1CCCC1	756585736	MIFJJYHEXQKSKU-UHFFFAOYSA-N	448.501	1.960	50	20	IDGD	
CNC(=O)Cn1ccc2ccc(NC(=O)NNC(=O)COc3ccccc3OC)cc21	756757447	CDMHETRFYRWITG-UHFFFAOYSA-N	425.445	1.628	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)c2nn(CC)cc2[N+](=O)[O-])c2ccccc2c1=O	756798589	ZERUTSVWZVPAIO-UHFFFAOYSA-N	441.448	1.786	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)Nc1cc(C2CC2)nn1[C@@H]1CCS(=O)(=O)C1	756857323	URQGRIAHOWQMER-CYBMUJFWSA-N	447.473	1.315	50	20	IDGD	
CCOC(=O)c1sc([C@H](C)NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)nc1C	756914891	VNFNEBCTCSOROF-NSHDSACASA-N	444.477	1.309	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)NCc1cc2c(cc1OC(F)F)OCO2	757251099	MSNNFGXTBPOHFC-UHFFFAOYSA-N	434.355	1.798	50	20	IDGD	
C[C@@H]1C[C@@H](C)CC2(C1)NC(=O)N(CC(=O)NNC(=O)NCc1ccc(Cl)cc1)C2=O	757648346	QPYXOYARCQDYKJ-CHWSQXEVSA-N	435.912	1.917	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)Nc2ccc(S(N)(=O)=O)cc2)c1	757674961	YQOCZWSCYFPKAX-UHFFFAOYSA-N	443.279	1.572	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2ccccc2O[C@@H](C)C#N)cc1	757979306	YLRCNTSKDLUDEY-HNNXBMFYSA-N	445.501	1.759	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)Nc1cccc2c1CCN2S(C)(=O)=O	758301661	WJRGMTZGCBQGAV-GFCCVEGCSA-N	436.465	1.768	50	20	IDGD	
COC(=O)[C@H](C)Cc1ccc(NC(=O)C(=O)NNc2cccc(S(C)(=O)=O)c2)cc1	759401312	MVWLPRCIWVEEBW-CYBMUJFWSA-N	433.486	1.524	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc2c(c1)COC2)NNC(=O)c1cccc2ccccc12	759800978	CCVCKLYHMFSSDL-UHFFFAOYSA-N	425.466	1.610	50	20	IDGD	
C[C@@H](C[C@H]1CCOC1)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	760194069	MYGOQUIUYNWUIS-JKSUJKDBSA-N	438.550	1.620	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNS(=O)(=O)c1ccc([N+](=O)[O-])c(C(=O)O)c1	760340015	RXZIQIXLFNXASI-UHFFFAOYSA-N	429.794	1.578	50	20	IDGD	
C[C@H](NS(=O)(=O)c1ccc(Cl)cc1)C(=O)NNC(=O)CCNC(=O)OC(C)(C)C	760441601	ACTXZYCQWSUUBW-NSHDSACASA-N	448.929	1.069	50	20	IDGD	
CC(C)NC(=O)C(=O)NNS(=O)(=O)c1ccc(OC(F)(F)F)cc1Br	762463566	VLHRAHXIKASBFP-UHFFFAOYSA-N	448.217	1.182	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)c3ccn(C)c3)c2)cc1	763108198	KJROTMVHOGWVJP-UHFFFAOYSA-N	428.470	1.909	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)N[C@H]1CCN(C(=O)C2CCCC2)C1	763527926	RBDUMNDVUFKONU-HNNXBMFYSA-N	425.530	1.413	50	20	IDGD	
O=C(CSc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1cnn(C[C@@H]2CCCO2)c1	763733857	IASBRLXZOPDNRE-AWEZNQCLSA-N	437.909	1.594	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)NC(=O)[C@H](C)O3)c1C	763850531	OONOEDBTATZCTD-UONOGXRCSA-N	440.456	1.576	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)C(=O)Nc1cccnc1-n1cncn1	763853597	MUCPZYLECCTDDF-CQSZACIVSA-N	445.439	1.369	50	20	IDGD	
COC(=O)c1ccc(C)c(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)c1	763854396	PZZXZFIUAFZRPE-OAHLLOKOSA-N	427.457	1.952	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccc(C(=O)N2CCCC2)cc1	763865031	HMKCOBMZUANGQO-AWEZNQCLSA-N	442.447	1.615	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)c(C)c1	763873733	YGCSBNYRKRXQQI-CYBMUJFWSA-N	447.419	1.239	50	20	IDGD	
CCOc1cc(C(=O)N(C)C)ccc1NC(=O)C(=O)NNC(=O)Cc1ccc(F)cc1	763918368	BLTRRDPREHMTSK-UHFFFAOYSA-N	430.436	1.255	50	20	IDGD	
Cc1nc(Br)ccc1NC(=O)C(=O)NNC(=O)c1cc(Br)c[nH]1	763995224	OQZQGEDBWKTAMI-UHFFFAOYSA-N	445.071	1.643	50	20	IDGD	
CCOC(=O)/C=C\c1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1	764006254	NKDJRXZCCYMPOL-YHYXMXQVSA-N	439.424	1.434	50	20	IDGD	
O=C1C[C@@H](Cc2ccc(NC(=O)C(=O)NNC(=O)c3cccc4ccccc34)cc2)C(=O)N1	764050658	GNUYIGSFTHQXNP-MRXNPFEDSA-N	444.447	1.445	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(N3CCOC[C@H]3C)cc2)c1O	764132085	JJCAMHGBHGHAMO-CYBMUJFWSA-N	428.445	1.026	50	20	IDGD	
CCCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(C#N)cc2)cc1	764177271	NDGBNWSUPYCJOP-UHFFFAOYSA-N	429.458	1.110	50	20	IDGD	
O=C(CC1CCCC1)NNC(=O)C(=O)Nc1cc(N2CCCS2(=O)=O)ccc1F	764179864	WYAXGXDQDPBFPP-UHFFFAOYSA-N	426.470	1.032	50	20	IDGD	
Cc1cccc(Cn2nccc2NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)c1	764245084	MIRWBTFKQZKOMZ-UHFFFAOYSA-N	430.468	1.981	50	20	IDGD	
CCC(C)(C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)Cc2cccnc2)cc1Cl	764269181	ZIZBXXQHZXGPPU-UHFFFAOYSA-N	445.907	1.982	50	20	IDGD	
N#Cc1ccc(Oc2ccc(NC(=O)C(=O)NNC(=O)COc3ccccc3O)cn2)cc1	764280258	LRKWGPRYPIMFMD-UHFFFAOYSA-N	447.407	1.616	50	20	IDGD	
CC(C)(C(=O)NNC(=O)C(=O)Nc1ccccc1SCCC(N)=O)c1ccccc1	764314133	PNPQOXIIERZINI-UHFFFAOYSA-N	428.514	1.718	50	20	IDGD	
O=C(NNc1nccc(N2CCOCC2)n1)[C@@H]1CCCN1C(=O)OCc1ccccc1	764328691	HYEJYNKXRMIKCL-KRWDZBQOSA-N	426.477	1.558	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1ccc2c(c1)CCC(=O)N2	764399141	ZZZPXDISIFYSSN-UHFFFAOYSA-N	428.470	1.458	50	20	IDGD	
COCc1ccc(C=NNC(=O)CN2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)cc1	764817826	IVUTVNFAQTZFLM-UHFFFAOYSA-N	444.557	1.598	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNS(=O)(=O)c3ccc(F)c(F)c3)CC2)cc1	765127457	QGAVWVXHVXCNNG-UHFFFAOYSA-N	438.500	1.401	50	20	IDGD	
COCc1nc(C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)cs1	765756147	LTKUQOSSQYFQRE-UHFFFAOYSA-N	437.953	1.522	50	20	IDGD	
C[C@H](NC(=O)OC(C)(C)C)[C@H]1COCCC1=NNC(=O)c1ccc(-n2cnnn2)cc1	766015499	MIZSWYZXPNZRGK-XJKSGUPXSA-N	429.481	1.698	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)CN3CCCCCCC3=O)CC2)cc1	766649705	SMPSUCIUOBIBFK-UHFFFAOYSA-N	429.565	1.053	50	20	IDGD	
O=C(CCC1CCCCC1)NNC(=O)C(=O)Nc1cc(C2CC2)nn1-c1ncccn1	768239280	IQVVJESDSNPEIS-UHFFFAOYSA-N	425.493	1.986	50	20	IDGD	
COc1ccc(NNC(=O)CN2C(=O)N[C@]3(CCc4ccccc43)C2=O)c([N+](=O)[O-])c1	768332181	GOQYBAYLNSMLFX-FQEVSTJZSA-N	425.401	1.440	50	20	IDGD	
CC1(C)CCC[C@@]2(C1)NC(=O)N(CC(=O)NNC(=O)c1cnn(-c3ccccc3)c1)C2=O	768569373	QBSBDCIQVBAMMR-QFIPXVFZSA-N	438.488	1.524	50	20	IDGD	
CSCCNC(=S)NNC(=O)CC[C@H]1NC(=O)N(c2ccc(Cl)cc2)C1=O	770247178	NMNAUUIRSYVONV-GFCCVEGCSA-N	429.955	1.403	50	20	IDGD	
CC(C)(C)OC(=O)N1CCO[C@@H](CC(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)C1	770966717	OMBLHIXVSWIEQG-LBPRGKRZSA-N	449.512	1.756	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)COc1ccc(Br)cc1C=O	772014075	TZOQOMYBQJFRDG-LLVKDONJSA-N	429.267	1.766	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)[C@H](C(C)C)N2CCCS2(=O)=O)cc1OC	772632138	WTYPVJYEYQNRNE-KRWDZBQOSA-N	427.523	1.305	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)[C@@H]1CCCN(Cc2cccnc2)C1	772885062	UHOVUNFNDXGXOK-QGZVFWFLSA-N	429.908	1.411	50	20	IDGD	
CNS(=O)(=O)c1ccc(CCC(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)cc1	772969305	LQJDIJFXQLGAOA-CYBMUJFWSA-N	439.921	1.796	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NNC(=O)C2CCN(c3cnccn3)CC2)C1	773414367	KJSBCGNUNYJNLG-MRXNPFEDSA-N	432.525	1.488	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1ccc(Br)cn1	773546738	PQYJTMBZPNCURB-UHFFFAOYSA-N	439.291	1.731	50	20	IDGD	
CC[C@@H](C)NS(=O)(=O)c1ccc(C(=O)NNc2cccc(S(C)(=O)=O)c2)cc1	776532444	AOYDORIWOQIRKX-CYBMUJFWSA-N	425.532	1.924	50	20	IDGD	
O=C(Cc1n[nH]c2c1CCCC2)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	777273701	DOODCMXXKOZYPV-UHFFFAOYSA-N	444.967	1.450	50	20	IDGD	
O=C(CN(CCO)Cc1cc(Br)ccc1F)NNC(=O)c1cccs1	777579127	QJFLAXKCWHEQOI-UHFFFAOYSA-N	430.299	1.905	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)[C@H](Cc2ccccc2)NC(=O)c2cccnc2)nc1C	778427441	XZKMVRKXGOJJLO-IBGZPJMESA-N	448.483	1.841	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@@H](C(=O)NNc2ccc([N+](=O)[O-])cc2Cl)[C@@H](C)O)cc1	779533361	FANCMSXQALNZMS-BDJLRTHQSA-N	442.881	1.728	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(Br)c(Cl)c1Cl)N1CCOCC1	780383365	HEQNTISLZUIHBT-UHFFFAOYSA-N	433.111	1.991	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNc2cc(C)nc(C)n2)cc(OC)c(OC)c1OC	783326413	DXMBMHXSXCVLQM-UHFFFAOYSA-N	447.448	1.378	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc2c(c1)CCN2C(=O)C(=O)NNc1cccc2c1CCCC2	783451753	SKCIEOPQXRMXNL-UHFFFAOYSA-N	442.541	1.848	50	20	IDGD	
CNS(=O)(=O)c1ccc(C)c(NC(=O)C(=O)NNc2ccc(OC(F)F)cc2)c1	784312825	QZZVSKRYRNTTEZ-UHFFFAOYSA-N	428.417	1.586	50	20	IDGD	
COCCN1C(=O)CCc2cc(NC(=O)C(=O)NNc3cccc([N+](=O)[O-])c3C)ccc21	784350366	FHAJYWYHHXLHRU-UHFFFAOYSA-N	441.444	1.911	50	20	IDGD	
CS(=O)(=O)c1cccc(Oc2ccc(NC(=O)C(=O)NNc3ncc(F)cn3)cc2)c1	784949368	CNMIOTQGVVHWKM-UHFFFAOYSA-N	445.432	1.893	50	20	IDGD	
COc1cc(F)cc(NNC(=O)C(=O)Nc2cccc(S(=O)(=O)NC3CC3)c2C)c1	785242361	YRKPOJIGDQBLII-UHFFFAOYSA-N	436.465	1.665	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1nnn(CC2CCCC2)c1C	788723934	FNDOHDDXSJMNSA-UHFFFAOYSA-N	433.538	1.453	50	20	IDGD	
Cn1nc(-c2ccc(F)cc2F)cc1NC(=O)C(=O)NNC(=O)c1ccc2c(c1)OCO2	789730509	SVDQGWUFXNZBQU-UHFFFAOYSA-N	443.366	1.494	50	20	IDGD	
CN(C)[C@H]1CCOc2c(NC(=O)C(=O)NNC(=O)Cc3c[nH]c4ccccc34)cccc21	789741502	WRTVOAGWPKZUGV-IBGZPJMESA-N	435.484	1.882	50	20	IDGD	
CC(C)(C)OC(=O)NCCc1nc(C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cs1	789941839	MMLFBFNWKLPVTB-HNNXBMFYSA-N	448.501	1.811	50	20	IDGD	
CCS(=O)(=O)c1ccc([C@H](C)NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1	790655266	GYFZHCYWBMXFPD-ZDUSSCGKSA-N	443.489	1.161	50	20	IDGD	
CN(NC(=O)CCOCC(F)(F)C(F)F)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	790885731	FUPBGRRSEJDGNW-UHFFFAOYSA-N	444.426	1.929	50	20	IDGD	
Cc1cccc(=O)n1C[C@@](C)(O)C(=O)NNC(=O)COc1ccccc1-c1ccccc1	792014508	JCXUYVUIGGVVLR-XMMPIXPASA-N	435.480	1.801	50	20	IDGD	
CCn1cc([C@H](O)CN(CC(=O)NNC(=O)c2cccc(C#N)c2)Cc2ccccc2)cn1	792364525	GADQXBDQOBSUSG-JOCHJYFZSA-N	446.511	1.771	50	20	IDGD	
COc1ccc(OC)c(C2=NO[C@@H](C(=O)NNC(=O)CNc3ccccc3OC)C2)c1	792628382	HVAMOUZWYRQMFV-LJQANCHMSA-N	428.445	1.465	50	20	IDGD	
Cc1nc2c(cnn2C(C)C)cc1C(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	792703060	AVCDUYHNNQYXHN-UHFFFAOYSA-N	440.416	1.847	50	20	IDGD	
C[C@H](Cn1ncc2ccccc21)C(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	792853800	POACAQBAQYDRQL-CYBMUJFWSA-N	425.401	1.585	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)C(=O)Nc2cccc(F)n2)c2ccccc2c1=O	793022628	ZEOPODVNPOBRRJ-UHFFFAOYSA-N	440.435	1.521	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C2=NN(c3ccc(F)cc3)[C@H](C(N)=O)C2)c2ccccc2n1	799008787	BEUYJHIYMKSZFF-IBGZPJMESA-N	434.431	1.564	50	20	IDGD	
C[C@H](C(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)C1CN(C(=O)OC(C)(C)C)C1	802064424	QAQQFTPFDBJECV-LBPRGKRZSA-N	440.522	1.746	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)[C@H]2CC(=O)N(CC(F)(F)F)C2)c(OC)cc1Cl	802084391	UTXSAGKGQZLEED-QMMMGPOBSA-N	438.790	1.921	50	20	IDGD	
O=C(CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)NNC(=O)Nc1ccc2c(c1)OCO2	802107743	YLOBZXYFEHTAMM-UHFFFAOYSA-N	443.372	1.865	50	20	IDGD	
C[C@H](Oc1ccc(C=O)cc1)C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	802828051	UIHNFQXXGAHGMC-INIZCTEOSA-N	446.529	1.346	50	20	IDGD	
COc1ccc(-c2nn(CCC#N)cc2/C=C(/C#N)C(=O)N(C)CCC(N)=O)cc1OC	804743930	WSZAGBXXPPCSAL-WJDWOHSUSA-N	436.472	1.722	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(NC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)ccc1F	806543787	HVIDYZMEICFBPO-UHFFFAOYSA-N	425.398	1.451	50	20	IDGD	
O=C(CNS(=O)(=O)c1c(F)cccc1F)NNC(=O)c1cccc(OC(F)F)c1	810343929	AUMRQPIMYSERDM-UHFFFAOYSA-N	435.355	1.306	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)NCC(=O)NNc2cccc(C(F)(F)F)n2)cc1	810427245	CSRQZJBHYBUSHJ-UHFFFAOYSA-N	446.407	1.699	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C[C@H]2COCCN2C(=O)OC(C)(C)C)cc1	812733370	PKWHNQZVRMKTAO-HNNXBMFYSA-N	442.538	1.406	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)C(=O)N1CCN(c2ccccc2)CC1	813365122	GAZYJWYRSGHMSB-UHFFFAOYSA-N	434.500	1.095	50	20	IDGD	
Cc1nsc(NC2CC2)c1C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	814222401	KDWSAJXBIGEYGX-UHFFFAOYSA-N	429.911	1.401	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cc(Cl)ccc2I)n[nH]1	815567774	LOHLTYMRDBWIEO-UHFFFAOYSA-N	447.620	1.376	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCc2nncn2C1)C(=O)Nc1ccc(Cl)cc1Br	815692581	VIUGERMTAMQNEI-QMMMGPOBSA-N	441.673	1.043	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)N(C)C)cnn1C1CCCC1	815751515	CHJDJSPAYHKRIS-UHFFFAOYSA-N	434.522	1.639	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)N(C)C)cnn1-c1ccccc1	815752134	FANHFNRJYNWZAZ-UHFFFAOYSA-N	442.501	1.513	50	20	IDGD	
COCCN(C)NC(=O)c1ccc(S(=O)(=O)Nc2cc([N+](=O)[O-])ccc2OC)cc1	816561926	QMCRCMUWDMJPDL-UHFFFAOYSA-N	438.462	1.627	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)c1cc([N+](=O)[O-])ccc1N1CCOCC1	817053633	ZQOWGVJSANRIFR-UHFFFAOYSA-N	449.489	1.439	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)CCC[C@]2(C)NC(=O)NC2=O)c1	818756677	HJXIDPPNUOVMBK-INIZCTEOSA-N	427.255	1.447	50	20	IDGD	
CCn1c(S)nc2cc(C(=O)NNC(=O)CNc3ccc(OC)cc3)ccc2c1=O	825548642	DJFIHYUVHRMRFR-UHFFFAOYSA-N	427.486	1.587	50	20	IDGD	
COc1ccc([C@H](CNC(=O)NNC(=O)Cc2ccc(F)cc2)N2CCOCC2)cc1	838512844	AHLXLRRMXZVLEN-FQEVSTJZSA-N	430.480	1.781	50	20	IDGD	
Cn1c(=O)nc(O)c2cc(C(=O)NNC(=O)c3ccc(-c4ccc(F)cc4)s3)cnc21	896239588	NLKZJLHARCFDQV-UHFFFAOYSA-N	439.428	1.977	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2cncn2-c2ccc(F)cc2)ccc1Cl	913036944	LMXBPISIVCVKTI-UHFFFAOYSA-N	437.840	1.387	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCc2nc3ccccc3s2)cc1	915878038	DAKGJADFNQKOGP-UHFFFAOYSA-N	447.542	1.756	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)NCc1cccnc1N1CCOCC1	916399868	COTHILKANCGIMU-UHFFFAOYSA-N	429.477	1.226	50	20	IDGD	
O=C(NC[C@H]1CCN(c2ccccc2)C1)NNC(=O)c1csc(N2CCOCC2)n1	916580042	SSXGWCXFPZGIGZ-OAHLLOKOSA-N	430.534	1.450	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)NCC(=O)Nc1ccc(Br)cc1	918001656	DSNBJKAKZGUYMA-UHFFFAOYSA-N	445.277	1.988	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)NCCC(=O)N[C@@H]2CCS(=O)(=O)C2)c(C)n1CC(C)C	919715441	VWUGQKMVDXRQCO-SZVPOVDMSA-N	434.562	1.478	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)CCc1ccc(S(=O)(=O)NC2CC2)cc1	919822930	VDEYKTWUUNWLJJ-UHFFFAOYSA-N	431.514	1.459	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)CNC(=O)c2ccc(OC)c([N+](=O)[O-])c2)cc1	919833152	WGRXRQDJSILRRV-UHFFFAOYSA-N	430.417	1.122	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)NC[C@@]2(N3CCOCC3)CCSC2)c1C	919980812	RKQOYECKNNVTOG-IMEWXKHHSA-N	432.590	1.982	50	20	IDGD	
O=C(NCc1cccc(C(=O)N2CCOCC2)c1)NNC(=O)c1ccc2ccccc2n1	920420023	PISNLHUWGRSYDC-UHFFFAOYSA-N	433.468	1.851	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2ccc(CN3CCCC3=O)cc2)c1	1251150857	SSCNEKQRVBXTBS-UHFFFAOYSA-N	444.513	1.357	50	20	IDGD	
O=C(CCc1nc2cccnc2[nH]1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	1339271106	BHWOVIRBNDFLQU-UHFFFAOYSA-N	442.501	1.136	50	20	IDGD	
O=C(NC[C@@H]1CC(=O)N(Cc2ccccc2)C1)NNC(=O)c1nnc(O)c2ccccc12	1341214128	FOHGQNCOVDEYMC-HNNXBMFYSA-N	434.456	1.328	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnc4sc(C)cn4c3=O)C2)C1	1777988972	FLIXNWOYXXGKGS-LIRRHRJNSA-N	438.937	1.525	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cn4ccsc4n3)C2)C1	1778632147	UPHUKVGJFJHLDM-ZBEGNZNMSA-N	427.324	1.623	50	20	IDGD	
CCc1cc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)nn1C	1779830308	VZEXQGWBWSEZDS-ACJLOTCBSA-N	427.343	1.457	50	20	IDGD	
O=C(c1ccncc1-c1ccccc1)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1779852949	KYUIOOLVWLFSAD-KNQAVFIVSA-N	429.904	1.792	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(=O)n1O)C2	1780710294	NBMSOYKKFWRBPP-MDASCCDHSA-N	446.331	1.449	50	20	IDGD	
Cc1noc(N)c1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@](C)(Cl)CCl)C1	1780713485	VRYMUFPDIVBCKN-NXOUGTEYSA-N	433.336	1.929	50	20	IDGD	
CC(=O)N(C)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Br)C1	1780771057	RLHPOKVXGFMKIK-UKPHBRMFSA-N	436.322	1.059	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](F)Br)C2)n(C)n1	1780771118	DOWXRXYJJSVSGO-JKIFEVAISA-N	431.306	1.547	50	20	IDGD	
CC(C)(NCCC#N)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Br)C1	1780771777	PULAZDQEKQSZPW-QWQRMKEZSA-N	447.349	1.473	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)c3cnn4ccncc34)CCO2)C1	1781230246	ROMMBXKGVZTZEP-QZTJIDSGSA-N	426.304	1.409	50	20	IDGD	
O=C([C@H](F)Br)N1CC[C@]2(C1)CN(C(=O)[C@@H]1CCc3nc[nH]c3C1)CCO2	1781333108	CJJVJDQZVYZFAK-WHCBVINPSA-N	429.290	1.035	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCN(C)C(C)=O)C2	1781901547	PVEYWXCVEQIWQW-FRQCXROJSA-N	446.386	1.542	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)Cc1ccccc1)CCO2	1783355849	YILOJXLBDHFEER-SQGPQFPESA-N	439.350	1.593	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cn(C)nc3C(F)F)CCO2)C1	1783533954	CBMAWWXGZOTYDC-QLJPJBMISA-N	435.269	1.585	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](C)NC(=O)OC(C)(C)C)CCO2	1783540178	SUNDHWYKVVKZTL-VEVIJQCQSA-N	448.358	1.513	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](C)Oc1ccccn1)CCO2	1783540333	UFQNSOPCKPQGOK-IYOUNJFTSA-N	426.311	1.462	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)c3ccco3)[C@H]2C1	1783554627	NXEBXVNDFRERQH-FDICVXPISA-N	429.311	1.324	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@H]1C(=O)N1CC[C@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1783848877	ASWAAHPMTFMNGH-LZJOCLMNSA-N	438.597	1.423	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1csc3c1CCCC3)CCO2	1783935004	MXLHWMXGBASYKV-QFIPXVFZSA-N	448.589	1.443	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)N2CCO[C@]3(CCN(C(=O)C(Cl)Cl)C3)C2)c1	1783939565	JQQRCTCVPZJTEP-KRWDZBQOSA-N	435.329	1.337	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4ccccn4n3)C[C@@H]21	1783965948	XRXIOSAZNRYSOJ-OAOQPFQOSA-N	449.349	1.959	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc4c(Cl)cccn34)C[C@@H]21)[C@@H](O)CCl	1784089805	JLWDXVFFBVAWIZ-APYUEPQZSA-N	441.315	1.181	50	20	IDGD	
C[C@H](Sc1cccs1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]2C1	1784091806	CPFZZNNAMGXVSQ-LXFSFDBISA-N	432.995	1.808	50	20	IDGD	
COc1cccc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)c1F	1785299928	DYSBCIMBXHYMNR-PBHICJAKSA-N	433.249	1.968	50	20	IDGD	
O=C1CSc2ncc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]4C3)cc2N1	1787449198	CYKXGWAHTCXQNC-PBLBJHRBSA-N	442.900	1.254	50	20	IDGD	
C[C@H](C(=O)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1)N1C[C@H]2C[C@H]2C1	1788142185	IWWXFCYVKXRKHY-QRQLOZEOSA-N	447.344	1.454	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4cncn4c3)C[C@@H]21	1788764585	OENAYMMJXYKMPP-WDSOQIARSA-N	430.581	1.779	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnncc3C(=O)O)C[C@@H]21	1789870851	ZUCOEMWETJCHOT-CQDXQUMASA-N	445.303	1.004	50	20	IDGD	
CN(C)CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C(C#N)=C/c3ccc(F)cc3F)[C@H]2C1	1790693387	IUPSHZVPCXMZIS-TYDTZWSASA-N	432.471	1.413	50	20	IDGD	
CCOC(=O)C1(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]3C2)CC1	1791063952	YHUVWBOBDWGWLA-RFGFWPKPSA-N	431.327	1.093	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nc(Cl)ccc3F)C[C@@H]21	1791252249	GBBIRLXQIZCCRG-FMSGJZPZSA-N	434.295	1.721	50	20	IDGD	
Cc1nccn1[C@H](C)C(=O)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1	1791929340	DMEKXQUIDCIRNZ-MRXNPFEDSA-N	446.316	1.880	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(Cl)cn1)C2	1792870747	KJRXNVVFBCAFDN-OHTBPHCPSA-N	430.730	1.969	50	20	IDGD	
COCCOCCOCCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](C)CBr	1792993498	LDOYVIYDMDBMAL-WCXIOVBPSA-N	449.386	1.725	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cn1nnc2ccccc21	1793714599	YTTPFGWEOIWEPQ-OESLAJAZSA-N	440.331	1.257	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)Cn1cccn1	1794210032	DJPGNZNUCNFINK-QMHWVQJVSA-N	427.343	1.282	50	20	IDGD	
CC(C)c1nc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCBr)no1	1795111340	DFNDEDDAERBRHB-DRXBFXEBSA-N	429.315	1.110	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COCc1ccccc1)C2	1795112406	FWEVMQWOWGJJDT-HGKCTWBKSA-N	425.323	1.578	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CC[C@@H]1CNc2ccccc2C1	1795651081	DSPAWZAAOIYLMB-WTLZFGJLSA-N	449.979	1.894	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](NC(=O)OC(C)(C)C)C1CC1	1796363873	WGJGUANPOOFVEV-JJTUDDRGSA-N	443.972	1.897	50	20	IDGD	
Cn1ncc2cc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@H](F)Br)C4)ccc21	1797085941	LWLJUYPDEUPPBK-XRGAULLZSA-N	439.285	1.467	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2n(n1)CCC2	1797510068	SUWAAHRVRVQOIY-NFFDBFGFSA-N	425.327	1.064	50	20	IDGD	
Cn1ccc2cccc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)c3cnccc3C(=O)NN)C4)c21	1797582004	CPQRZRPOYFVLBI-BJWYYQGGSA-N	446.511	1.742	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1[nH]nc3ccncc13)C2	1799275519	VCHNOLYDABEICZ-WZTYKQCMSA-N	426.304	1.397	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cn3cc(F)ccc3n1)C2	1799277277	VNYUPSXCZXSJBX-JZGBQWHFSA-N	443.306	1.913	50	20	IDGD	
COc1ccc(F)c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Br)c1	1799352328	QLLWXQYSLJNNKQ-OWLDWWDNSA-N	433.249	1.728	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1Cc2ccccc2N1	1800317753	DVNAQSLGAFVDNE-DTYCBIMDSA-N	436.350	1.786	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc[nH]1)C2)[C@@H](Br)Cc1ccccc1	1800435550	KEVIXTCVMLPHPQ-DFGXFYAUSA-N	447.333	1.619	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CCc2ccccc2O1	1800955021	NRMMFBJLHREVRF-QMQAMEMWSA-N	437.334	1.753	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccncc1C(F)(F)F)C2	1800978699	ZBPNPGHYWCXHOG-BAESOJJISA-N	435.830	1.557	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)n1cc(C)cn1	1801344150	MGBLMPYVOPARDK-QMHWVQJVSA-N	427.343	1.516	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc3nccn3c2)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803142671	GSEXIVDAIXHMNE-VDZJLULYSA-N	427.892	1.649	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCCC2(CCN(C(=O)c3cnccc3C(=O)NN)CC2)C1	1805262544	YACDBHBCUISPSJ-UHFFFAOYSA-N	435.956	1.795	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1ccsc1	1805418968	AOHTZUSXEMGMBA-XLIONFOSSA-N	435.314	1.456	50	20	IDGD	
Cc1cccc(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)c1	1807375416	OPEVEFDSGWHXCY-FYYLOGMGSA-N	443.312	1.703	50	20	IDGD	
Cn1ccc(CC(=O)NC[C@@H]2CCN(C(=O)[C@@H](F)Br)[C@@H]2c2cccnc2)n1	1807518328	SXTPPGOUDKCWER-IAOVAPTHSA-N	438.301	1.754	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)Cn2ccnn2)[C@H]1c1cccnc1)[C@H](F)Br	1808663225	YRWIHCYOYXYZRS-QEJZJMRPSA-N	425.262	1.070	50	20	IDGD	
O=C(Cc1ccsc1)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1	1809976641	MBOHFQSTADNRDA-UHFFFAOYSA-N	426.347	1.515	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1CCN(C(=O)CN2CCCC2=O)[C@H]1c1cccnc1	1810542027	VILSCWYMVFIBKX-UWJYYQICSA-N	432.597	1.561	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2ccnc3c2OCO3)[C@H]1c1cccnc1	1811316056	QJCMLZGRMWQRQM-BHYGNILZSA-N	446.891	1.779	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)C(C)(C)CNC(C)=O)[C@H]1c1cccnc1	1813027955	HEHWIMAHKJYFKP-SQNIBIBYSA-N	438.956	1.504	50	20	IDGD	
NC(=O)c1nccnc1C(=O)N1CC[C@H](CNC(=O)C(Cl)Cl)[C@H]1c1cccnc1	1813078191	GLNQECKPYAEVJM-BXUZGUMPSA-N	437.287	1.094	50	20	IDGD	
C[C@@H](C(=O)N1CC[C@H](CNC(=O)C(Cl)Cl)[C@@H]1c1cccnc1)N1CCN(C)CC1	1813078799	KWRHHSJGFVUHKI-UAGQMJEPSA-N	442.391	1.527	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)Cc2cnn(C)c2)[C@@H]1c1cccnc1	1813459982	OUYNIDHHDGUYOR-OWQGQXMQSA-N	434.338	1.847	50	20	IDGD	
C[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](O)CCl)n[nH]1	1814864782	SUQPDZOUJFDKIU-UBHSHLNASA-N	443.932	1.915	50	20	IDGD	
C[C@H](CS(C)(=O)=O)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)C(Cl)Cl)[nH]n1	1815232694	PQMPDXGZDDZECI-KOLCDFICSA-N	425.338	1.886	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(=O)cco2)n[nH]1	1816652668	ZOBRWMXPKNVMBY-OAHLLOKOSA-N	430.465	1.042	50	20	IDGD	
CCNC(=S)NCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCBr)n[nH]1	1816784559	KZCBNVGEJZBCDO-GFCCVEGCSA-N	445.387	1.671	50	20	IDGD	
Cc1ccn2ncc(C(=O)Nc3nc4c(s3)C[C@H](NC(=O)[C@H](O)CCl)CC4)c2c1	1816930607	AYAJNDBMNBKFGW-IAQYHMDHSA-N	433.921	1.925	50	20	IDGD	
O=C(N[C@H]1CCc2nc(NC(=O)[C@H](F)Cl)sc2C1)c1cc2n(n1)CCCNC2=O	1817121797	BMFYEAFFEDQMSY-SDBXPKJASA-N	440.888	1.233	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1)c1ccc2nc(CO)[nH]c2c1	1818538445	JIZIDWFZVVSZPV-JKSUJKDBSA-N	446.895	1.684	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H]3CC3(F)F)sc2C1	1818679829	XUCOBOKZHRWWGO-KWQFWETISA-N	436.444	1.023	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1ccc(F)nc1	1819692623	ZPNBYKMOHGACSO-KRWDZBQOSA-N	437.240	1.243	50	20	IDGD	
O=C(CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H](O)CCl)CC1)N1CCCC1	1824178791	KUYBHTXGZIPXFX-ZWKOTPCHSA-N	427.973	1.608	50	20	IDGD	
O=C(CN1CCCCC1=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](F)Br)CC2	1825865738	MXFZJMGTZYNKSU-YMTOWFKASA-N	447.330	1.758	50	20	IDGD	
Cc1cnc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)cn1	1825873582	UFEJGGJJFCQTJK-NRFANRHFSA-N	436.321	1.012	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(C(N)=O)cc1)CC2	1826008780	HDOJOFRNPVKLED-CHWSQXEVSA-N	436.921	1.722	50	20	IDGD	
O=C(c1ccnc(F)c1)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827050383	QHMCLDPBOSDDME-HXUWFJFHSA-N	439.296	1.448	50	20	IDGD	
O=C(Cc1ccccn1)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827055346	XWUKCBGFVABDFJ-JOCHJYFZSA-N	435.333	1.237	50	20	IDGD	
CC1=C(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CCO1	1827283233	SBRABQUCUZKWSB-FQEVSTJZSA-N	441.532	1.613	50	20	IDGD	
CNC(=S)NCCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H](Cl)COC)CC1	1828931301	GVCJYYAAUYMBNO-HZPDHXFCSA-N	433.018	1.344	50	20	IDGD	
CCc1cc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)no1	1829378455	OKNBONBYOCMCRR-NRFANRHFSA-N	439.321	1.464	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3[nH]nc4ncccc34)C2)C1	1830357379	AUUBUKWBKQQNOT-FQEVSTJZSA-N	435.912	1.293	50	20	IDGD	
C[C@H](Oc1cccnc1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830369843	CGJHCPOYNIKYSV-HRAATJIYSA-N	439.940	1.570	50	20	IDGD	
CC(C)(CCl)C(=O)NC1CCN(C2CCN(C(=O)c3nc4ncccn4n3)CC2)CC1	1833215207	JSYWVOWBTXRBNQ-UHFFFAOYSA-N	447.971	1.575	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(F)s1)CCO2	1833215928	JIWHKYUIPQFSET-GOSISDBHSA-N	430.574	1.809	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)[C@H](C)n3ccnc3)CC2)CC1	1833378982	ZTSQERRFQJKCET-GJZGRUSLSA-N	440.386	1.799	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)CN3CCC(C)CC3)CC2)CC1	1833407443	JMWYHWNTZYFLCD-FQEVSTJZSA-N	443.032	1.544	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccnc3C)CCO2)C1	1834043385	WAROZWAOPLMSQQ-APWZRJJASA-N	440.338	1.634	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)Cc3cccs3)C2)C1	1834822511	RSSRUNXHKJHISM-KRWDZBQOSA-N	431.352	1.532	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)c1cccc2c[nH]nc12	1835006840	XBTDJOWWBLXMTG-SFHVURJKSA-N	433.940	1.348	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccc4c(c3)OCO4)CCO2)C1	1835171291	WIFJRFFQHQOMHE-HRAATJIYSA-N	438.908	1.432	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCC(OC2CCN(C(=O)CN)CC2)CC1	1837089222	AEQCPQZIYUOBHC-INIZCTEOSA-N	446.976	1.076	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccncc3F)C2)C1	1839152462	ABFAWKHMRBUQCX-MSOLQXFVSA-N	434.295	1.527	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3F)C2)C1	1840032008	KUMIAUAYOQZAIU-YVEFUNNKSA-N	430.274	1.074	50	20	IDGD	
CCOC(CC(=O)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2)OCC	1840190837	PYERRRDVAKPJOQ-KRWDZBQOSA-N	427.325	1.036	50	20	IDGD	
C[C@H]1CC[C@@H](C(=O)N2CCCC23CN(C(=O)[C@@H](O)CCl)C3)N1C(=O)OC(C)(C)C	1841010668	WSUWEZWROPQRPI-KKUMJFAQSA-N	429.945	1.578	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC2(CCCN2C(=O)[C@@H]2CCN2C(=O)OC(C)(C)C)C1	1841766472	QFYQOAAZIPNRHM-OLZOCXBDSA-N	430.343	1.983	50	20	IDGD	
C[C@H](Br)C(=O)N1CC2(CCCN2C(=O)c2ccc(N3CCOCC3)cn2)C1	1842266393	FNXHKBBYQBDBHK-AWEZNQCLSA-N	437.338	1.519	50	20	IDGD	
CCn1c(-n2nc(C(=O)N3CC4(CCCN4C(=O)[C@H](F)Cl)C3)cc2C)cccc1=O	1843363404	CBTFEJXHDWFXSY-KRWDZBQOSA-N	435.887	1.714	50	20	IDGD	
COc1ccc2cc(C(=O)N3CC4(CCCN4C(=O)c4cnccc4C(=O)NN)C3)[nH]c2c1	1844264087	CBZTWCZARSZBFA-UHFFFAOYSA-N	448.483	1.306	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC2(CCCN2C(=O)c2cc(=O)nc3sccn23)C1	1844625756	VHLUCJQAVWHVQQ-SNVBAGLBSA-N	425.308	1.356	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@]1(F)CCN(C(=O)OC(C)(C)C)C1)C2	1846362517	JBAUFAANLZWGFC-VLIAUNLRSA-N	447.935	1.793	50	20	IDGD	
CS(=O)(=O)NCCc1ccc(C(=O)NNC(=O)CCSc2ccc(F)cc2)s1	12683233	GYKARWWMLIUYRY-UHFFFAOYSA-N	445.563	1.922	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)CNC(=O)NCc1ccc(F)cc1	14350724	VZZPESSPBLZYMI-UHFFFAOYSA-N	426.452	1.385	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCN(c2ccccc2OC)CC1	28901731	ODMAWJMXFKMYRC-UHFFFAOYSA-N	432.908	1.940	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)CSCc2ccc(C#N)cc2)cc1	107696860	WRRKFYPPENPINJ-UHFFFAOYSA-N	446.554	1.568	50	20	IDGD	
Cc1cc(C(=O)N2CCC[C@@H]2C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)ccc1[N+](=O)[O-]	110314378	JKNOVFKSALNLNS-QGZVFWFLSA-N	441.400	1.877	50	20	IDGD	
O=C(NCCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1)NNc1ccc(OC(F)F)cc1	726709466	WKHGYEITJHNAKO-UHFFFAOYSA-N	445.404	1.801	50	20	IDGD	
NC(=O)[C@H]1CCCN1Cc1cccc(NC(=O)NNC(=O)c2cc(Cl)ccc2O)c1	726874486	WTXSMRIVKFIVSO-MRXNPFEDSA-N	431.880	1.962	50	20	IDGD	
COCCC(=O)NNC(=O)c1ccc(Cl)c(S(=O)(=O)Nc2ccccc2OC)c1	727098730	QJSCLTYUCGLETF-UHFFFAOYSA-N	441.893	1.947	50	20	IDGD	
CNS(=O)(=O)c1cccc([C@@H](C)NC(=O)NNC(=O)Cc2nc3ccccc3n2C)c1	727608269	OMGOIJJBDJRMIV-CYBMUJFWSA-N	444.517	1.116	50	20	IDGD	
CN(CCc1ccccn1)C(=O)CNC(=O)NNC(=O)CSc1ccc(Cl)cc1	727608875	YZNJKXNHUMABSF-UHFFFAOYSA-N	435.937	1.859	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)N[C@H](C)c2cccc(S(=O)(=O)N(C)C)c2)c1	727610879	WDBAMIPNBIKDIN-OAHLLOKOSA-N	434.518	1.716	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)CCc2nc(-c3ncccn3)no2)c2ccccc2c1=O	727722430	KFLMZMJULMWZTM-UHFFFAOYSA-N	448.443	1.211	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1ccc(S(=O)(=O)C(F)F)cc1	728845381	JDNQIDGYJIKAJD-UHFFFAOYSA-N	439.444	1.151	50	20	IDGD	
C[C@H](COc1ccc(F)cc1F)NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1	728948917	JZLYEBMGMUFZQD-CYBMUJFWSA-N	434.447	1.769	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)NCc2cccnc2N2CCC(C(N)=O)CC2)c1	729220828	BJUZOEIGKDCLAM-UHFFFAOYSA-N	440.504	1.001	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@H](C)C(=O)NNC(=O)COCC(=O)NCc1cccnc1	731185036	BAQOFAOYMSKVOH-OAHLLOKOSA-N	448.907	1.600	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)[C@@H]1COc2ccccc2O1)N1CCN(c2ccc(F)cc2)CC1	731865409	DNJXLTNRTZWQRF-YWZLYKJASA-N	428.464	1.324	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])o2)cc1OC	731874638	KKTDZELOERHSTH-ZDUSSCGKSA-N	446.416	1.661	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C[C@@H](C)O1	732259891	ZLTZGZMQKKKLEP-SCTDSRPQSA-N	448.564	1.769	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)N[C@H]2CCN(c3ccccc3Cl)C2=O)cc1	732469770	MJONKNILVZYGGG-INIZCTEOSA-N	432.864	1.863	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)[C@H](CCSC)NC(=O)Cc2ccccc2)cn1	732838223	AEVBRMUUUSBHDC-INIZCTEOSA-N	447.586	1.888	50	20	IDGD	
O=C(COC(=O)c1cc(=O)c2cc(Br)ccc2[nH]1)NNC(=O)c1ccccc1	733013419	FKLZHZPMTNIKGO-UHFFFAOYSA-N	444.241	1.909	50	20	IDGD	
O=C(NCC(=O)N1CCN(c2ccccc2)CC1)NNC(=O)NCc1ccc(Cl)cc1	733039554	XECLNSUCSAYSHW-UHFFFAOYSA-N	444.923	1.702	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)[C@@H](Cc2ccc(F)cc2)n2nnnc2C)cc1	733515855	KHPYBAVWRMXKGY-GOSISDBHSA-N	440.435	1.217	50	20	IDGD	
CN(C)c1ncc(Br)cc1C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C	734240382	PTMUFQTWEXUWPM-UHFFFAOYSA-N	445.318	1.379	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)CC[C@H]2NC(=O)N(c3ccc(Cl)c(Cl)c3)C2=O)cn1	735446227	GBFNRRBTJXUZJV-CYBMUJFWSA-N	439.259	1.393	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN2CCN(C(=O)c3cccc(F)c3)CC2)cc1C	736307789	CIVIJHPDOCSJOR-UHFFFAOYSA-N	432.521	1.977	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)c1ccc2c(c1)SC1=NS(=O)(=O)CCN12	737637315	VSZSRHOXZQDPGV-UHFFFAOYSA-N	446.510	1.276	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)C[C@@H]2CCOC2)c1	739676321	SVVSYWJCCVLNQO-AWEZNQCLSA-N	433.486	1.684	50	20	IDGD	
CCOC(=O)c1cnn(-c2ccc(C(=O)NNC(=O)C(=O)NC(CC)CC)cc2)c1C	740852247	ROHWGBNAEVXHMV-UHFFFAOYSA-N	429.477	1.423	50	20	IDGD	
Cc1nn(C)c2sc(C(=O)N[C@H](C)C(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)cc12	742031966	UPHRDKYOWDOELL-SNVBAGLBSA-N	430.446	1.431	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)c2ccc(C[C@@H]3CC(=O)NC3=O)cc2)o1	742246941	IRZGVIJSBSIGMM-MRXNPFEDSA-N	426.473	1.401	50	20	IDGD	
O=C(NCCCN1C(=O)CCC1=O)NNC(=O)Nc1ccc(Br)cc1Cl	743597913	KGWMCJJQQULMRZ-UHFFFAOYSA-N	446.689	1.977	50	20	IDGD	
O=C(CNC(=O)c1ccc(Br)o1)NNC(=O)c1cccc(Br)c1	743728550	SNSRDUZNCPOQSX-UHFFFAOYSA-N	445.067	1.996	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)cc1	743830203	QAYCCYRMAFSHGP-UHFFFAOYSA-N	431.430	1.806	50	20	IDGD	
CCCC(=O)N1CCCC[C@H]1C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	744620373	CHGHFIUJADDGNA-KRWDZBQOSA-N	438.550	1.332	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)NC[C@H](C)CN2CCN(C)CC2)c1	745860154	LDIMBEYREJAOHK-ZDUSSCGKSA-N	442.358	1.285	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)CCOc2ccc(S(C)(=O)=O)cc2)cc1OC	746516683	UQKGPVBBRDWKJK-UHFFFAOYSA-N	436.486	1.728	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)c2cnn(CC(=O)NC3CCCCC3)c2)c(C)c1	746677526	CIFUEKFRSDYNCI-UHFFFAOYSA-N	426.521	1.822	50	20	IDGD	
CCOc1ccc(NC(=S)NNC(=O)CNC(=O)NCc2ccc([N+](=O)[O-])cc2)cc1	748360205	MDKWYTXPLWNICU-UHFFFAOYSA-N	446.489	1.811	50	20	IDGD	
CNS(=O)(=O)C[C@@H]1CCCN1C(=O)NNC(=O)c1ccc(COc2ccccc2)o1	750265220	AGJVFNGQMWIUBC-AWEZNQCLSA-N	436.490	1.227	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N[C@@H]1CC(=O)N(C(C)(C)C)C1	750660174	PGCQRRRAVIJXHQ-WCQYABFASA-N	441.326	1.946	50	20	IDGD	
CSC[C@@H](C(=O)NNc1ccc(C(F)(F)F)nn1)N1C(=O)[C@H]2CCCC[C@H]2C1=O	755191542	IQZOAPPJZLBHMK-AXFHLTTASA-N	431.440	1.845	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1	755434109	JKMDTINAUFROHT-HNNXBMFYSA-N	442.538	1.456	50	20	IDGD	
CN(C1CCCCC1)S(=O)(=O)c1ccc(NC(=O)NNC(=O)Cc2cc[nH]n2)cc1	755447734	QWXUILGNMBFSLI-UHFFFAOYSA-N	434.522	1.758	50	20	IDGD	
CCOC(=O)/C=C/c1ccc(NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1	755847833	YCCSMQALNPIMPG-JLHYYAGUSA-N	435.440	1.976	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)N[C@@H](C)CNC(=O)OC(C)(C)C)nc1	756020367	KESMILNLYJOKGC-ZDUSSCGKSA-N	444.558	1.651	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)Nc3cc(F)cc(S(N)(=O)=O)c3)n[nH]2)cc1C	756516204	RIKVNNIEDGEAMU-UHFFFAOYSA-N	446.464	1.947	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2ccn(CCc3ccncc3)n2)c2ccccc2c1=O	756730593	RIFWMGMMSKEFNY-UHFFFAOYSA-N	446.471	1.717	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)Nc2cnn(C[C@H]3CCCO3)c2)n[nH]1	756737633	WZHSKXUKZMEHSI-CQSZACIVSA-N	425.449	1.927	50	20	IDGD	
CSCC[C@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	756746844	YAKYMZMUVFOBGV-AWEZNQCLSA-N	449.533	1.985	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2cccc(Br)c2)cc1-n1cnnn1	756747828	RPICLBSOPKPHNW-UHFFFAOYSA-N	432.238	1.900	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccn(CC(F)F)n2)c1	756867272	HSVVZTWVPIHLGN-UHFFFAOYSA-N	444.464	1.645	50	20	IDGD	
CCn1cc(S(=O)(=O)NNC(=O)c2sc(-c3ccccc3)nc2C)c([N+](=O)[O-])n1	756929516	GUSMLNRFJTVTGT-UHFFFAOYSA-N	436.475	1.866	50	20	IDGD	
CC(C)CCn1nc(C(=O)NNC(=O)Nc2cccc(C(N)=O)n2)c2ccccc2c1=O	757740718	QGIPKUYCYJSQLU-UHFFFAOYSA-N	437.460	1.403	50	20	IDGD	
CNC(=O)Cn1nc(NC(=O)NNC(=O)COc2ccccc2-c2ccccc2)cc1C	757822376	IXJNJUMVLRLPHS-UHFFFAOYSA-N	436.472	1.836	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)Nc2cc(C)n(CC(=O)NC)n2)cc1OC	757823544	RRCKJRDCBGJIQM-UHFFFAOYSA-N	432.481	1.592	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)c1ccc(Oc2cccc(Cl)c2Cl)nc1	758044922	AOMHYKHHWWCHIK-SECBINFHSA-N	447.300	1.879	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)c1ccc(NC(=O)OC(C)(C)C)cc1Cl	758047326	LZMMEMLUBSTOOX-SECBINFHSA-N	434.902	1.386	50	20	IDGD	
O=C1NC(=O)C2(CCC(=NNC(=O)c3cccc(S(=O)(=O)N4CCCCC4)c3)CC2)N1	758094086	OUGKBWBMQVIHTA-UHFFFAOYSA-N	447.517	1.099	50	20	IDGD	
CCc1nnc(C)cc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	758995951	CIVPXALBMPHPES-UHFFFAOYSA-N	431.518	1.597	50	20	IDGD	
COCCS(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1	759383109	HLFYIFKANHGCOY-UHFFFAOYSA-N	436.446	1.159	50	20	IDGD	
CCO[C@@H]1C[C@H](NC(=O)NNc2ccc(S(=O)(=O)N(CC)CC)cn2)[C@]12CCCO2	760140427	CICFFFBHWBJVDS-FRQCXROJSA-N	441.554	1.465	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CCNC(=O)[C@H]2CCCN2C(=O)OC(C)(C)C)c(O)c1	760799265	MZVCBGJPXPHPKX-OAHLLOKOSA-N	434.493	1.367	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCCC(=O)NNC(=O)Cc1ccccc1F	760813587	KMTGRWOKGSURRT-INIZCTEOSA-N	436.484	1.421	50	20	IDGD	
C[C@H](NC(=O)OC(C)(C)C)[C@H]1CN(CC(=O)NNC(=O)c2ccccc2Cl)CCO1	760977777	RKJUXBVMACGIEP-XJKSGUPXSA-N	440.928	1.715	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H]1[C@H]1COCCC1=NNC(=O)CNC(=O)c1cccnc1	762433883	JRIVKTIEZRBKNY-WMZOPIPTSA-N	445.520	1.720	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)c(F)c1	763439736	PXFCUDJGIYRZCI-UHFFFAOYSA-N	432.474	1.399	50	20	IDGD	
COc1cc(OC)c(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)cc1F	763615108	XQHQQOYDGKBNHY-UHFFFAOYSA-N	427.392	1.633	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2cc(N3CCOC3=O)ccc2C)c1	763624946	PXPSWLGQEBIQOO-UHFFFAOYSA-N	426.429	1.425	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(C(=O)NC(C)C)c(C)c1	763656845	GFZWRLXVWVRUKO-UHFFFAOYSA-N	442.472	1.307	50	20	IDGD	
CCNC(=O)c1ccc(C)c(NC(=O)C(=O)NNC(=O)COc2ccc(C)c(C)c2)c1	763665282	RZYDXPOGFHDXQW-UHFFFAOYSA-N	426.473	1.526	50	20	IDGD	
Cc1ccnc(Oc2ccc(NC(=O)C(=O)NNC(=O)COc3ccc(C#N)cc3)cc2)n1	763679281	LKQXZLYVFJEWKA-UHFFFAOYSA-N	446.423	1.614	50	20	IDGD	
O=C(COc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1ccc(NC(=O)C2CC2)nc1	763693921	CSPSCCBGVDKMNZ-UHFFFAOYSA-N	431.836	1.248	50	20	IDGD	
C=C(C)COc1cccc(NC(=O)C(=O)NNC(=O)c2nn(CC)c(=O)c3ccccc23)c1	763787362	YKQIIWBVAOVRRE-UHFFFAOYSA-N	449.467	1.771	50	20	IDGD	
CCc1c(C(=O)NNC(=O)CNC(=O)c2cccnc2)nnn1-c1cccc(Cl)c1	763825653	UQJIBIHTDHAQGJ-UHFFFAOYSA-N	427.852	1.069	50	20	IDGD	
CC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)cc1Cl	763848490	CIUFLDNSQCSVNQ-SNVBAGLBSA-N	436.827	1.991	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccccc2-n2ccnn2)cc1	763873614	WLYZZAYIQFQPPG-CQSZACIVSA-N	436.428	1.023	50	20	IDGD	
CCOc1cc(F)ccc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccc(C(C)=O)cc1	763877431	JIAGWDZAACDQHO-ZDUSSCGKSA-N	431.420	1.980	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2cc(Br)cn2C)c2cccnc12	764005283	XCYHTRKSVIZSJX-UHFFFAOYSA-N	446.261	1.744	50	20	IDGD	
O=C(NNC(=O)c1cnccn1)C(=O)Nc1ccc(Cl)cc1I	764024046	HQCIFHLJVJALOG-UHFFFAOYSA-N	445.604	1.134	50	20	IDGD	
COC(=O)c1ccc(C(F)(F)F)cc1NC(=O)C(=O)NNC(=O)Cc1ccsc1	764035041	YLDRMGWQGAUSES-UHFFFAOYSA-N	429.376	1.882	50	20	IDGD	
CC[C@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(C(=O)NCc2ccccn2)c(Cl)c1	764082460	NZQQIRMDZRXXQV-LBPRGKRZSA-N	431.880	1.797	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(N3CCCN(C)CC3)cc2)c(O)c1	764110323	IYUUVJQJNMDFKX-UHFFFAOYSA-N	425.489	1.242	50	20	IDGD	
O=C(NNC(=O)c1ccoc1)C(=O)Nc1ccnn1Cc1ccccc1Br	764160068	MULSCNZHMNNCJY-UHFFFAOYSA-N	432.234	1.687	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)CC2CCCC2)cc1OC	764183112	BJPYNCPKZHKJLG-UHFFFAOYSA-N	426.495	1.123	50	20	IDGD	
CS(=O)(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)c2cccc3ncccc23)c1	764260286	OXEDPVGVRKYLNS-UHFFFAOYSA-N	446.872	1.691	50	20	IDGD	
C=CCNC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(OC(F)F)c2)cc1	764260543	ZWNFFWUZPJPZNM-UHFFFAOYSA-N	447.398	1.995	50	20	IDGD	
CNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(OC)c(Br)c2)cc1	764326512	LHOVVFOONNELTE-UHFFFAOYSA-N	449.261	1.217	50	20	IDGD	
CN(C)CCC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2cc3ccccc3o2)cc1	764332629	VUMRKGJUVWLULA-UHFFFAOYSA-N	437.456	1.723	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)c(Cl)c1)C(=O)Nc1cccc(N2CCCCC2=O)c1	764349527	NEENBIMUFTVEJP-UHFFFAOYSA-N	430.848	1.962	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc(CC(N)=O)cc3)n[nH]2)cc1C	764388584	SWYMICULMZKHDG-UHFFFAOYSA-N	434.456	1.121	50	20	IDGD	
CCOC(=O)c1ccccc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	764389203	ZUGMARGUBFUVNS-UHFFFAOYSA-N	439.403	1.792	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1cc(Br)ccc1OC(C)C	764401939	ZYJWXRBFMCBFFJ-LLVKDONJSA-N	446.298	1.374	50	20	IDGD	
Cc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NNC(=O)CSc1ccccc1O	764405749	XSVFMSQFAFAOSA-UHFFFAOYSA-N	430.486	1.281	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)N[C@@H]1CCN(c2ccc(Cl)c(F)c2)C1=O	764510852	DNPWMEHRDRIUEX-MRXNPFEDSA-N	444.854	1.805	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)CCC(=O)N1CCN(c2ccccn2)CC1	764564399	SDABKKFYYOFLDJ-INIZCTEOSA-N	443.479	1.264	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)[C@@H]1COc2ccccc21	765756011	JWLFEMKHFIKCIN-GOSISDBHSA-N	428.920	1.781	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)C2=NN(CC(C)C)C(=O)CC2)c1	766646878	XMUCVMWDXXOZJZ-UHFFFAOYSA-N	425.283	1.853	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2ccn(-c3ccc(F)cc3F)n2)n1	766825242	KOMDHTPAVBQCSY-UHFFFAOYSA-N	435.412	1.462	50	20	IDGD	
COC(=O)CS(=O)(=O)Cc1ccc(CNC(=O)NNc2ncnc3ccsc23)cc1	767096266	JNBMNSYQMVEPQB-UHFFFAOYSA-N	449.514	1.605	50	20	IDGD	
COc1cc2c(cc1NC(=O)C(=O)NNC(=O)c1ccc(O)c(Cl)c1)NC(=O)CC2	768241787	JRCNSPRVHYIVBC-UHFFFAOYSA-N	432.820	1.339	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccc(Br)c(C(=O)NNC(=O)C(C)(C)O)c1	768245676	DIZIDDKCZGENQD-UHFFFAOYSA-N	436.328	1.058	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)c3ccc([C@@]4(C)NC(=O)NC4=O)cc3)n[nH]2)cc1C	768255655	HQQTYIRAFZGOAS-HSZRJFAPSA-N	446.467	1.823	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)CCCNC(=O)NC1CCCCC1	768636269	QQVZRQLHHZSDNU-UHFFFAOYSA-N	426.539	1.954	50	20	IDGD	
CSCCNC(=S)NNC(=O)c1sc(-c2c(C)c(C)nn(C)c2=O)nc1C	770248451	YLPLGAJCJILZPS-UHFFFAOYSA-N	426.593	1.301	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)C(=O)N(Cc1ccco1)C2=O)c1ccc2c(c1)OCCO2	770392892	ZVWFEHLBSHELRB-UHFFFAOYSA-N	447.403	1.922	50	20	IDGD	
Cc1cccc(F)c1NNC(=O)C(=O)Nc1cnn(CC(=O)N2C[C@H](C)O[C@H](C)C2)c1	770822111	UKWBAIJRTJXRQR-OKILXGFUSA-N	432.456	1.048	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)CCNc3ccc(C(F)(F)F)cc3[N+](=O)[O-])nc21	770972878	AVLYIQVLPGKQKV-UHFFFAOYSA-N	440.342	1.941	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)[C@@]34CCC(=O)N3c3cc(Cl)ccc3S4)nc21	770980745	UJMQDKQWQLEJNH-KRWDZBQOSA-N	431.865	1.794	50	20	IDGD	
C[C@H](NS(=O)(=O)c1cccs1)C(=O)NNc1c(F)cc(C(=O)NC2CC2)cc1F	771047764	OSGACLOQGKFARQ-VIFPVBQESA-N	444.485	1.729	50	20	IDGD	
COc1ccccc1[C@]1(C)NC(=O)N(CC(=O)NNc2nc(-c3ccccc3)no2)C1=O	771483415	QZDVTWQPJCFCAK-NRFANRHFSA-N	436.428	1.656	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N[C@H](C)c2nnc(C)o2)cc1	771568796	YTXBLQOCRFSMPG-BVTUPMQUSA-N	449.471	1.910	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@@H]2CCO[C@H](C(C)C)C2)cc1	772616086	CAVQKGJEBAUGDQ-WBVHZDCISA-N	426.539	1.150	50	20	IDGD	
O=C(NNC(=O)c1cccc(OC(F)F)c1)Nc1cnn(Cc2nnc3n2CCCC3)c1	772636254	MAIGOXRPOXYZDJ-UHFFFAOYSA-N	446.418	1.927	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)c1cc([N+](=O)[O-])cc(S(C)(=O)=O)c1	772954133	PGJZLVMKMDSWIR-JTQLQIEISA-N	441.849	1.880	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NNC(=O)CCn2cnc3sccc3c2=O)C1	773422751	YDWXINKQVLDVCS-CYBMUJFWSA-N	449.533	1.643	50	20	IDGD	
Nc1nc(Cl)cc(NNC(=O)C2CCN(S(=O)(=O)c3ccc(F)c(F)c3)CC2)n1	773863642	YNAUAEHSWUGSLU-UHFFFAOYSA-N	446.867	1.534	50	20	IDGD	
COC(=O)[C@@H](C)n1cccc1C=NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	774576401	VMWFBCRALUHYRM-OAHLLOKOSA-N	432.502	1.771	50	20	IDGD	
CCOC1CC(CNC(=O)NNC(=O)Cc2cccc3ccccc23)(N2CCOCC2)C1	775147455	SGJSHUFCUAARHF-UHFFFAOYSA-N	440.544	1.983	50	20	IDGD	
COc1cc(C(=O)NCC(=O)NNc2cccc(S(C)(=O)=O)c2)ccc1OC(F)F	776534224	WXJCEUHTYHYMJA-UHFFFAOYSA-N	443.428	1.573	50	20	IDGD	
CCn1c(=O)nc(O)c2c(C(=O)NNc3cccc(S(C)(=O)=O)c3)cc(C(C)C)nc21	776714355	ACZPQOTYRNHNFX-UHFFFAOYSA-N	445.501	1.801	50	20	IDGD	
O=C(Cc1csc(-c2ccccn2)n1)N1CCN(S(=O)(=O)CBr)CC1	777833179	VGVSFJXQWADMLT-UHFFFAOYSA-N	445.364	1.574	50	20	IDGD	
CC(=O)Nc1cc(F)c(S(=O)(=O)NNC(=O)CNC(=O)OC(C)(C)C)cc1Cl	777941733	WCQRVSFLNACMEU-UHFFFAOYSA-N	438.865	1.272	50	20	IDGD	
O=C(CCc1ccco1)NNC(=O)[C@H]1CC[C@H](C(=O)NNC(=O)CCc2ccco2)CC1	777977713	WYEWHCHIGIXAFM-WKILWMFISA-N	444.488	1.539	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)c2cncc(I)c2)nc1C	778428519	CUQCOQOYWBSZMG-UHFFFAOYSA-N	427.202	1.718	50	20	IDGD	
CNS(=O)(=O)c1ccc(C)c(NC(=O)C(=O)NNc2ccccc2OC(F)(F)F)c1	778800091	SJPVNGAZMNGYBV-UHFFFAOYSA-N	446.407	1.884	50	20	IDGD	
COc1cccc(C(=O)c2ccc(C(=O)NNC(=O)N[C@H]3CCS(=O)(=O)C3)cc2)c1	780458555	CTCVSCLMPVYOKY-INIZCTEOSA-N	431.470	1.057	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1c[nH]nc1-c1ccsc1	780925037	AAXUHDRBKGJIDQ-UHFFFAOYSA-N	438.513	1.357	50	20	IDGD	
C[C@H]1C[C@H](C)CN(C(=O)CN2CCN(CC(=O)NNC(=O)c3cccc(Cl)c3)CC2)C1	782100613	HAXMSFSJBQIDSR-IRXDYDNUSA-N	449.983	1.223	50	20	IDGD	
Cn1c(=O)n(C)c2cc(NC(=O)C(=O)NNC(=O)c3ccc(Cl)cc3Cl)ccc21	782927490	SHHNXRZUWXTKLY-UHFFFAOYSA-N	436.255	1.584	50	20	IDGD	
Cn1cc(Br)cc(NC(=O)C(=O)NNc2ncccc2C(F)(F)F)c1=O	783121475	MYVSQBWAEFSQAB-UHFFFAOYSA-N	434.172	1.643	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2ccc(NC(=O)CN3CCCCCC3)cc2)nc(C)n1	783327034	VSBQDYBUEYAZOG-UHFFFAOYSA-N	439.520	1.990	50	20	IDGD	
Cc1cc(C)cc(NNC(=O)C(=O)Nc2ccc(C(=O)NCCN3CCOCC3)cc2)c1	783356154	GXPAPYRNYCYPIM-UHFFFAOYSA-N	439.516	1.447	50	20	IDGD	
Cc1ccccc1NC(=O)NNC(=O)C(=O)Nc1cc(N2CCCS2(=O)=O)ccc1F	783416921	HYWZHBCVDFTBBD-UHFFFAOYSA-N	449.464	1.465	50	20	IDGD	
O=C(NNc1ccc(-n2cccn2)nn1)C(=O)Nc1cnc(Cl)c(Br)c1	783433689	YTVNQWPLRNSKDQ-UHFFFAOYSA-N	437.645	1.555	50	20	IDGD	
O=C(NNC(=O)C(=O)N1CCCC1)C(=O)Nc1ccc(Br)c2ccccc12	784002994	OCIQVLNNVKOSGG-UHFFFAOYSA-N	433.262	1.311	50	20	IDGD	
Cc1c(NNC(=O)C(=O)Nc2ccc(N3CCC(C(N)=O)CC3)cc2)cccc1[N+](=O)[O-]	784357577	DGZHAWFXYODRIZ-UHFFFAOYSA-N	440.460	1.687	50	20	IDGD	
CCOC(=O)c1cc(F)c(F)cc1NC(=O)C(=O)NNC(=O)Cc1cn2ccccc2n1	785060715	JZMNKKKPFLPGMT-UHFFFAOYSA-N	445.382	1.118	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2ccccc2C(=O)N2CCN(C)CC2)cc1Cl	785114211	KNDRHZYQLDWYJX-UHFFFAOYSA-N	445.907	1.818	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCC(=O)c2ccccc21)c1cccc(S(=O)(=O)N2CCCC2)c1	785669301	AYCJTKVWGVTIPB-LJQANCHMSA-N	441.509	1.992	50	20	IDGD	
COc1cc(CC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)cc(OC)c1O	789872231	ZLEMTMJNSOXYGC-UHFFFAOYSA-N	436.490	1.015	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)COCc2ccccc2)cc(Cl)c1F	792266255	OYGSRUAEUQEPSO-UHFFFAOYSA-N	437.811	1.568	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)cccc1NC(=O)N(C)C	792352144	BVEQPSRLNZSEBV-ZDUSSCGKSA-N	445.451	1.781	50	20	IDGD	
Cc1cnn(C)c1S(=O)(=O)NNC(=O)c1nn(CCC(C)C)c(=O)c2ccccc12	795282217	BYGJAJAQMIMBCE-UHFFFAOYSA-N	432.506	1.108	50	20	IDGD	
Cc1ccc(S(=O)(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)cn1	795335817	PZOPHDVPQOJYDR-UHFFFAOYSA-N	437.953	1.171	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)C2CCC(NC(=O)C3CC3)CC2)cc1OC	795957634	KVFPVQLAXUOAOD-UHFFFAOYSA-N	447.488	1.093	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2cccc3ncccc23)c(OC)c(C)c1OC	797009947	YMUIGIVIJNWWFB-UHFFFAOYSA-N	438.440	1.969	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)Nc1cc(S(=O)(=O)N2CCCC2)ccn1	797675496	YPWYHIGNFHXZCV-UHFFFAOYSA-N	433.446	1.061	50	20	IDGD	
Cc1c(/C=C(\C#N)C(=O)N2CCN(CC(=O)N3C[C@@H](C)C[C@@H](C)C3)CC2)cc(C#N)n1C	798117151	SHIYMQQIXAZRFU-CFOWESNQSA-N	436.560	1.761	50	20	IDGD	
COc1ccccc1CONC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	798537899	SGIRZZYIQSDQOQ-UHFFFAOYSA-N	448.501	1.556	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2csc(CCNC(=O)OC(C)(C)C)n2)cc1	801107140	MZHQJGNXPPOXMJ-UHFFFAOYSA-N	447.517	1.918	50	20	IDGD	
Cc1cc(F)ccc1-n1cc(O)c(C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)n1	801427885	XBNYRCNOTSDZFA-UHFFFAOYSA-N	437.387	1.515	50	20	IDGD	
O=C(COC(=O)c1ccc(CN2CCCC2)cc1)NNC(=O)c1cccc([N+](=O)[O-])c1	801869444	CEOJLYKPISIOFT-UHFFFAOYSA-N	426.429	1.809	50	20	IDGD	
O=C(COCc1cccnc1)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	805157757	UQIOFUHWJANDQJ-UHFFFAOYSA-N	446.510	1.922	50	20	IDGD	
COc1nnccc1NC(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	808902305	SUGXPBNPCNPWRA-UHFFFAOYSA-N	445.443	1.654	50	20	IDGD	
C#CC[C@@]1(C(=O)NNC(=O)c2nnc(O)c3ccccc23)CCCN1C(=O)OC(C)(C)C	809537811	SJXNYYODGZEAMP-QFIPXVFZSA-N	439.472	1.889	50	20	IDGD	
Cc1nc2ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc3ccc4ccccc4c3)cn2n1	810386434	ZUSIYDRWOBCPHA-CYBMUJFWSA-N	432.440	1.744	50	20	IDGD	
CCS(=O)(=O)c1ccc(CCC(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)cc1	812732252	YETDGJAUXCDYSF-UHFFFAOYSA-N	439.559	1.806	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(-n3cc(C(=O)OC)nn3)c2)cc1	812979112	JLMISNILMWKOOZ-UHFFFAOYSA-N	436.428	1.016	50	20	IDGD	
O=C1CN(Cc2cccc(NC(=O)C(=O)NNc3cccc(C(F)(F)F)n3)c2)CCN1	812987835	UZWOCFVHMUGUKN-UHFFFAOYSA-N	436.394	1.114	50	20	IDGD	
Cc1ccccc1-n1nccc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	813033432	SJPRNVNOVXZKRS-UHFFFAOYSA-N	442.501	1.513	50	20	IDGD	
CC(=NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1)c1cccc(-n2cnnc2)c1	814730401	AEYRRQCOLXXMDP-UHFFFAOYSA-N	426.502	1.737	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1nnc(C(C)(C)C)s1	815752488	USSHKGUZOYPVNI-UHFFFAOYSA-N	426.524	1.168	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCS(=O)(=O)C1)c1nc(-c2ccccc2)n(-c2ccccc2)n1	816828920	UJZNHNDALBJFEU-INIZCTEOSA-N	439.497	1.520	50	20	IDGD	
Cc1cc2ncc(C(=O)NNC(=O)c3cccc(S(=O)(=O)N4CCCC4)c3)c(C)n2n1	818797592	AAMRMVQAVZMJAU-UHFFFAOYSA-N	442.501	1.205	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2ccc(OCC(F)(F)F)nc2)n1	834417545	SGWRHYVYZDTHMX-UHFFFAOYSA-N	432.380	1.335	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)[C@@H]2CS[C@H](Cc3ccccc3F)C(=O)N2)cc1	892122179	SKIPRCAJRDGXLX-ZWKOTPCHSA-N	431.489	1.503	50	20	IDGD	
CCCCN1C(=O)c2ccc(C(=O)NNC(=O)CCN3C[C@H](C)O[C@@H](C)C3)cc2C1=O	912921357	NOGKXGBRISWQFA-GJZGRUSLSA-N	430.505	1.343	50	20	IDGD	
COc1ccc(S(=O)(=O)N[C@H](C)C(=O)NNC(=O)Cc2ccc(Cl)cc2)cc1	913159966	CHQVLLPHQRRIPU-GFCCVEGCSA-N	425.894	1.406	50	20	IDGD	
CC(=O)c1cccc(S(=O)(=O)NCC(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)c1	913423013	MUNBVNICOKKTFU-UHFFFAOYSA-N	441.469	1.019	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)Cn3ccc(=O)n(C)c3=O)c3ccccc3n2)cc1	915059661	KVWGPRUXAZIEFS-UHFFFAOYSA-N	443.463	1.532	50	20	IDGD	
O=C(CN1CCCCC1=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	915131343	FOELBDAOYFDRFI-UHFFFAOYSA-N	433.468	1.218	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)COCc2cccc(OC)c2)c1	915616398	LJNCWXQFQRZJMS-UHFFFAOYSA-N	449.529	1.704	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NCCSCc2ccccc2F)c2ccccc2c1=O	915924293	ZEVPBXXIQMIDLG-UHFFFAOYSA-N	429.477	1.950	50	20	IDGD	
CC(=NNC(=O)c1c(C)nc2ccccn12)c1ccc(S(=O)(=O)NCCC(=O)O)cc1	915931906	PYYZTWBDDPLYME-UHFFFAOYSA-N	443.485	1.550	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NN=C(C)c1ccncc1)N(S(C)(=O)=O)CC2	916354547	FHCQKMQKLXJTEG-SFHVURJKSA-N	446.529	1.888	50	20	IDGD	
O=C(NCc1cc[nH]n1)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	916637526	PJZBCVCKODNARK-UHFFFAOYSA-N	428.474	1.032	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NCCNc2ncccc2C#N)c2ccccc2c1=O	916641165	BJEJKVDPCXCXPB-UHFFFAOYSA-N	448.487	1.519	50	20	IDGD	
CCc1c(C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)[nH]c(C)c1C(C)=O	916736257	DUKFTUXJVBMAMA-UHFFFAOYSA-N	434.518	1.478	50	20	IDGD	
O=C(NCc1cccc(CN2CCOCC2)c1)NNC(=O)[C@H]1COc2ccccc2O1	918223854	PJWGIDQCAPCSSR-HXUWFJFHSA-N	426.473	1.189	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C2=NN(c3ccc(F)cc3)[C@@H](C(N)=O)C2)cc1	919833860	HKVJTOBKMRBDKF-GOSISDBHSA-N	427.436	1.035	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)[C@H](CSC)N2C(=O)[C@H]3CCCC[C@@H]3C2=O)cc1	919836522	VWZCPKUBVSGPES-BZSNNMDCSA-N	447.557	1.682	50	20	IDGD	
CCCS(=O)(=O)N1CCC(NC(=O)NNC(=O)CCc2ccc(OC)cc2)CC1	919903202	OAIKHSJVBBUQPU-UHFFFAOYSA-N	426.539	1.162	50	20	IDGD	
C[C@@H](COc1ccc(F)cc1F)NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	919921913	JILKXLDAMRRIKZ-NSHDSACASA-N	431.399	1.623	50	20	IDGD	
COc1ccc(OCCCNC(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)cc1	919922504	PVKCJXSJDONXQW-UHFFFAOYSA-N	437.522	1.872	50	20	IDGD	
N#C/C(=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)NC[C@H]1COCCO1	920854913	UOTSAKAAVPUZNZ-DWCFMXGVSA-N	443.891	1.517	50	20	IDGD	
O=C(NCCCN1C(=O)NC2(CCCC2)C1=O)NNC(=O)c1cncn1-c1ccccc1	1115850659	XTRBUPFDNWERJI-UHFFFAOYSA-N	439.476	1.071	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCCCOc2ccccc2)c1	1115853608	IJEOXMFDFAYPLN-UHFFFAOYSA-N	434.518	1.740	50	20	IDGD	
CCOC(=O)c1cnn(-c2cccc(NC(=O)NNC(=O)CCO)c2)c1C(F)(F)F	1116610443	UKOLFZRTGDZGGK-UHFFFAOYSA-N	429.355	1.603	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C=NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	1317712864	UVADRASDNMUDCL-UHFFFAOYSA-N	437.547	1.302	50	20	IDGD	
O=C(NCCc1coc(-c2ccccc2)n1)NNC(=O)c1csc(N2CCOCC2)n1	1318346563	YUIAJPKUCBLEJR-UHFFFAOYSA-N	442.501	1.821	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)[C@H]1CC(=O)N(C)c2ccccc21	1318572771	KMTRAPOJYKIYHK-AWEZNQCLSA-N	445.859	1.803	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN(c2ncnc3sccc23)C1)c1n[nH]c2c1CCCC2	1319112935	MHKKYAIPVOINRZ-LBPRGKRZSA-N	425.518	1.971	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)NCCN2C(=O)COc3ccccc32)cc1	1321433770	MFQUAGVKUANXAW-OAHLLOKOSA-N	442.472	1.609	50	20	IDGD	
CSC[C@@H](C)C(=O)N1CCC(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)CC1	1327031380	MROZHLWUXBNDIX-OAHLLOKOSA-N	448.593	1.078	50	20	IDGD	
O=C(c1ccc2nonc2c1)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1777718654	CZIBULUXJJCSBJ-XJKSGUPXSA-N	427.230	1.357	50	20	IDGD	
O=C(CCCCn1cccc1)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2	1779481990	PUDYFFOZBZNWST-DBXWQHBBSA-N	425.957	1.772	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cn(C)nc3C(F)(F)F)C2)C1	1779544858	VXCYLEYFAYCWPO-WBMJQRKESA-N	438.834	1.136	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(O)nn1)C2)[C@H](F)Br	1780770952	MLQKGXKPBBCNRC-PVXIVEMSSA-N	431.262	1.000	50	20	IDGD	
CCOc1cnc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)cn1	1781326962	VOINPOWZZHONRN-CZUORRHYSA-N	431.262	1.009	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781330325	WITAKTNYZNIARV-CRAIPNDOSA-N	439.285	1.777	50	20	IDGD	
CC(=O)N[C@@](C)(C(=O)N1CC[C@]2(CN(C(=O)[C@H](F)Cl)CCO2)C1)c1ccccc1F	1781415936	IGVAIJQNQWHAFQ-DBVUQKKJSA-N	443.878	1.541	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cn1ccc(C)n1)C2	1781900519	DLGIFIOVOVXCNS-GPMSIDNRSA-N	441.370	1.879	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](Cl)COC)C1	1782179254	ITSHFACOWAGDED-UMPJEAMMSA-N	439.778	1.928	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C1(Br)CC1)C2	1782179788	UNDUOKXNGIHNBI-XJKCOSOUSA-N	437.762	1.682	50	20	IDGD	
Cc1nc2sccn2c1C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](C)Br)C2)C1	1783534541	VXUTYBRKLOIASY-GTNSWQLSSA-N	441.351	1.931	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cccc(-n4cncn4)c3)CCO2)C1	1783535295	BHRQYBKYPZDEQS-AUUYWEPGSA-N	448.321	1.494	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cn4ccc(Cl)cc4n3)CCO2)C1	1783874062	CDZUMOANGBEXFE-KUHUBIRLSA-N	441.315	1.685	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)Cc3ccc(OC)c(F)c3)CCO2)C1	1783879864	YYRMWSGYKMYJPK-FOIQADDNSA-N	428.888	1.461	50	20	IDGD	
CCC[C@@H](C(=O)N1CCO[C@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1)n1cccc1	1783934314	DJPDSTRPFVFYAN-AVRDEDQJSA-N	433.553	1.032	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc(F)cc3Cl)C[C@@H]21)[C@H](O)CCl	1784085225	DHMSLHQHEDJWCV-SDNTUTLCSA-N	433.307	1.601	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(CCN(C(=O)C34CC(C3)C4)C2)C1	1784835299	XUKNENUHOSJSOD-KGSCVUAUSA-N	443.456	1.764	50	20	IDGD	
COc1cccc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)Br)C[C@@H]32)n1	1785201437	KGSPDOCMHURQSF-VRKREXBASA-N	440.338	1.396	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CC3CCCC3)[C@H]2C1	1786315376	IMGQRNBRNIEUNI-QXDWZXEQSA-N	443.548	1.680	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21)C1CC1	1787440821	PHLXORMEXLLPEY-QXKUPLGCSA-N	447.935	1.804	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)n3ccccc3=O)[C@H]2C1	1788750735	OIWULRSGNVHNER-OWYFMNJBSA-N	440.338	1.172	50	20	IDGD	
COC(OC)C(=O)NC1(c2ccc(NC(=O)c3cnccc3C(=O)NN)cc2)CCC1	1789519981	WUYQVDJAAOSDDG-UHFFFAOYSA-N	427.461	1.052	50	20	IDGD	
C[C@H](NC(=O)c1cnccn1)C(=O)Nc1ccc(C2(NC(=O)[C@H](O)CCl)CCC2)cc1	1789597762	QSLKBQPSGGUYOH-SUMWQHHRSA-N	445.907	1.329	50	20	IDGD	
COC[C@H](NC(C)=O)C(=O)Nc1ccc(C2(NC(=O)[C@H](F)Br)CCC2)cc1	1789660312	RBJLJTPZPWFTMR-GJZGRUSLSA-N	444.301	1.962	50	20	IDGD	
CCOC(=O)O[C@@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]21	1790609461	ANHZQQIGHNTFCS-NTIKPUAMSA-N	439.336	1.764	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)N3C[C@H]4C[C@@H]4C3)C[C@@H]21	1790961253	XOUHJYZOYQNHCO-XFUVECHXSA-N	442.398	1.480	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(C4CC4)cc3)C[C@@H]21	1791293906	NIOSDSWFTIDUGM-ACRUOGEOSA-N	442.560	1.530	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(-c2ccccc2)on1)c1cccc(B(O)O)c1	1792459914	OSFWZQQQDZANSV-ACDBMABISA-N	445.284	1.587	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c(F)ccc(O)c1F)C2	1792873928	GVMBSUDLWXSMGU-DJQAVVSRSA-N	447.276	1.905	50	20	IDGD	
CCOC(=O)[C@@H]1CCC[C@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](Cl)COC)C3)C1	1792958732	UKSAKQTWNQYJAX-RFSXOUPVSA-N	444.956	1.199	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@](F)(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](O)CCl)C1	1793111835	YCTUMGOUFGHRNG-YJVQVXSTSA-N	447.935	1.573	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1C[C@H]1c1ccc(OC)cc1	1793301262	ILVRBQMRWCPLFU-BVTPCJTOSA-N	436.936	1.642	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](C)NS(=O)(=O)CC	1793536245	QLJXZMKAUDHRTA-HPCHECBXSA-N	438.388	1.126	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C(C#N)=C/c1ccc(F)cc1F)C2	1796761779	DYZYEQHHXMAAJG-ZPLALWFASA-N	445.470	1.957	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2c(c1)n(C)c(=O)n2C	1796980717	HCBKODYVJJCUJN-YYAJDYIMSA-N	448.951	1.488	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cn2cc(F)ccc2n1	1797429517	RSRGMFXFVOOCPL-HBCWATKFSA-N	434.544	1.528	50	20	IDGD	
CC(C)(C)c1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Br)C3)[nH]n1	1798133760	WNDHATQYGLBVKW-RDBQEKCUSA-N	431.306	1.601	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1(C(F)(F)F)CC1)C2	1798440602	SJBKHIBUAZXMNR-ZSBIGDGJSA-N	425.411	1.279	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc[nH]c3nccc1-3)C2	1799274954	FGBYRIUCKXBLNK-RHQBZFHZSA-N	425.316	1.954	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cn3ccsc3n1)C2)[C@H](F)Br	1799350036	QDWNERSDGMEVDK-QCMRWSPLSA-N	431.287	1.290	50	20	IDGD	
COc1ccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Br)cc1F	1799352447	XGKPAVXBYNAWPU-CZAMWMTLSA-N	447.276	1.657	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc2ccnn12	1799905086	PKXMEDONAQNSJN-YXPYIKCWSA-N	435.322	1.711	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCOCCOCCOCCOC	1800206625	WREXUCZVNHFVIK-RDGPPVDQSA-N	448.988	1.728	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)Oc1cccnc1)C2	1800644242	OUDJCZPGMJCRQM-CTTHAOKLSA-N	440.338	1.612	50	20	IDGD	
COc1ncccc1CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)Br	1800756843	JONOIQSWJWMNCW-JJAZEVLHSA-N	440.338	1.396	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1c[nH]c3ccccc13)C2	1800975784	TWOAVFNTGJNABY-HPNQWNLUSA-N	433.936	1.944	50	20	IDGD	
COC(=O)c1ccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C(Cl)Cl)s1	1801016688	SCGSJPTYXWCGHF-WDAIWFPHSA-N	435.329	1.471	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@H]1CCN(C(=O)CCn2cncn2)[C@@H]1c1cccnc1	1803018176	XOBGTFAXCGIKFE-QGPMSJSTSA-N	449.353	1.800	50	20	IDGD	
O=C(Cc1cnc2ccccn12)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1	1803097365	JEVMVERFYSLOOO-CDXJDZJCSA-N	441.919	1.578	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cc3cccn3cn2)[C@H]1c1cccnc1)[C@H](O)CCl	1803142780	JDBBZGJCEZBZGE-IPELMVKDSA-N	427.892	1.649	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)CCc2ccc[nH]2)[C@@H]1c1cccnc1	1807464128	TWUKRICDFAVBND-MBSDFSHPSA-N	440.548	1.421	50	20	IDGD	
O=C1NCCCn2nc(C(=O)N3CC[C@H](CNC(=O)[C@H](F)Cl)[C@H]3c3cccnc3)cc21	1808314563	YPVNPPTWIDJICC-XYPHTWIQSA-N	448.886	1.266	50	20	IDGD	
Cc1[nH]ccc1C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1808755917	UPHKEMRLCYPCRM-UWJYYQICSA-N	426.521	1.411	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)c1c[nH]c2ncccc12	1809120812	XYXNIYCJUPGEGA-BMGDILEWSA-N	427.892	1.877	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@H]2c2cccnc2)o1	1810292111	WRTXABYLKQUJEK-DAYGRLMNSA-N	434.880	1.552	50	20	IDGD	
COc1nn(C)cc1C(=O)N1CC[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]1c1cccnc1	1810540980	NYANZZGXBTWDET-QFBILLFUSA-N	445.596	1.995	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)Cn2cncn2)[C@@H]1c1cccnc1	1812776853	OAAHKVXKBCSQTK-YQQAZPJKSA-N	435.326	1.553	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)CCc2cncnc2)[C@@H]1c1cccnc1	1813030772	KZCWDUGFOQYPDM-WSTZPKSXSA-N	431.924	1.764	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)[C@@H]2C[C@@H]2C2CC2)[C@@H]1c1cccnc1	1813067843	GGXMRZXCWZIMRH-JZJXAQOMSA-N	427.549	1.507	50	20	IDGD	
C[C@@H](C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1)C1(O)CCC1	1814428977	RGQNOTRBOOFUJS-GOEBONIOSA-N	434.541	1.326	50	20	IDGD	
Cc1cnc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)s1	1816282961	AOSAKBCHPUBFNI-INIZCTEOSA-N	439.306	1.474	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CN2CCOCC2)n[nH]1	1817151866	QWZIACLLNISHPG-ZFWWWQNUSA-N	442.358	1.908	50	20	IDGD	
CCc1oncc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1	1817473423	SHZRJCXXYZSUFJ-QGZVFWFLSA-N	437.265	1.260	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cccc(F)n2)[nH]n1)c1cccc(B(O)O)c1	1817476971	UZQMMGVQEGSRLP-QGZVFWFLSA-N	437.240	1.243	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3ncn(C(C)C)n3)sc2C1	1817689831	BTZZDKVRXGCZQQ-QWRGUYRKSA-N	426.930	1.795	50	20	IDGD	
C[C@H](Nc1nccs1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1	1818083243	CFECMJILTVZMPI-WCFLWFBJSA-N	426.930	1.959	50	20	IDGD	
CC(C)CNC(=O)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](C)Br)n[nH]1	1822187672	YPPWADNVRQKLJU-YPMHNXCESA-N	428.331	1.957	50	20	IDGD	
CS(=O)(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](F)Br)[nH]n1	1822973181	UPMAYBHZGBZPJY-GXFFZTMASA-N	439.307	1.527	50	20	IDGD	
Cn1nc(C(=O)N[C@H]2CCc3nc(NC(=O)[C@H](F)Br)sc3C2)cc1O	1823003163	WHUANCVNSQBODR-KGFZYKRKSA-N	432.275	1.499	50	20	IDGD	
Cc1ccc(C(=O)NCC(=O)N2CCC([C@@H]3CCCCN3C(=O)[C@@H](O)CCl)CC2)cc1	1824188212	PUQAILSPVOFYOQ-PMACEKPBSA-N	449.979	1.944	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)CN3CCCCC3=O)sc2C1	1825868008	NCIWRIJBLKVLNF-MNOVXSKESA-N	443.367	1.851	50	20	IDGD	
CSCC(C)(C)C(=O)N[C@@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1	1826083828	SVMPAYPIQAJBEX-GFCCVEGCSA-N	441.623	1.817	50	20	IDGD	
Cc1cc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)no1	1827051070	MLDYECBDUPBMNN-HXUWFJFHSA-N	425.294	1.210	50	20	IDGD	
COCC1(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)CC2)CC1	1828923877	YNFRIFMKAQINQT-LJQANCHMSA-N	443.548	1.345	50	20	IDGD	
COC[C@H](NC(C)=O)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CO[Si](C)(C)C)CC1	1829116503	SAQANFGKWYRWGA-OALUTQOASA-N	441.645	1.609	50	20	IDGD	
C/C=C/C(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)[C@H](O)CCl)C2)C1	1829269485	VDQIFRWXEPUMRF-VWPBMBFCSA-N	449.935	1.614	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)C1(O)CCC1)CCO2	1829731533	NRRNCTLVDKFNAF-VKJFTORMSA-N	447.370	1.025	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](O)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H](F)Cl)CC1	1830667982	QMOUNJWWWGEGFS-RBSFLKMASA-N	435.924	1.984	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3Cc4ccccc4O3)C2)C1	1831651827	SWGSOWBRBPLEQU-LRXVAGHRSA-N	436.936	1.854	50	20	IDGD	
CC(C)N1CCC(C(=O)N2CCO[C@@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)CC1	1832406568	SWIBNAQGQQSQCU-QFIPXVFZSA-N	444.016	1.828	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)/C=C/c3ccoc3)CCO2)C1	1832643949	XGJMKECMTAAJIC-JDDKEMAESA-N	441.322	1.780	50	20	IDGD	
CC(C)NCCC(=O)N1CCC(N2CCC(NC(=O)[C@@H](C)CBr)CC2)CC1	1833263858	WKIIPLPWVOJGCN-INIZCTEOSA-N	445.446	1.977	50	20	IDGD	
Cc1ccn2c(C(=O)N3CCC(N4CCC(NC(=O)[C@@H](O)CCl)CC4)CC3)cnc2c1	1833312245	MLQNPPWDXNJWFV-IBGZPJMESA-N	447.967	1.428	50	20	IDGD	
Cc1ccc(C(=O)NC2CCN(C3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)o1	1833570176	BPVDUYSUXRGJIV-UHFFFAOYSA-N	433.553	1.146	50	20	IDGD	
O=C(CCBr)NC1CCN(C2CCN(C(=O)[C@@H]3CCCCO3)CC2)CC1	1834421861	ZIEBLKDYRJFIBT-KRWDZBQOSA-N	430.387	1.912	50	20	IDGD	
O=C(c1ccnc2ncccc12)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836718889	GPFCSCAUTNTMBD-LJQANCHMSA-N	446.935	1.842	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cc(C(C)=O)[nH]n3)CC2)CC1	1837367289	ADOBJXLLLJOAEE-INIZCTEOSA-N	440.928	1.478	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CCC=CO1)CCO2	1837406186	HFXPIAUSCNEAIX-RKVPGOIHSA-N	431.327	1.167	50	20	IDGD	
CCn1nc(C)cc1C(=O)N1CCOC[C@@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1837711892	VZSKXORXUZEISR-HXUWFJFHSA-N	438.601	1.133	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)C(F)(F)c3ccco3)C2)C1	1837715876	PFFYXIXZKPYJEA-SFHVURJKSA-N	446.523	1.679	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)CSC(=N)N)CC2)CC1	1837831693	XRLPWLYBNWJWEA-LLVKDONJSA-N	435.388	1.395	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)C(=O)c3cccn3C)CC2)CC1	1838786902	RWTUOFWVVGVAIJ-KRWDZBQOSA-N	439.940	1.460	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccc(F)cn3)C2)C1	1839152431	ZACIDTBXKVJXIQ-OALUTQOASA-N	448.322	1.456	50	20	IDGD	
Cn1cc(F)cc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2	1839153056	UASJGKYJIQCONZ-ROUUACIJSA-N	436.311	1.471	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccnc(F)c3)C2)C1	1840030113	ANBIABKJNQXUAG-PXAZEXFGSA-N	430.274	1.074	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@H]1C(=O)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1840144285	WUTJXLRTLAOHBP-PJIJBLCYSA-N	449.331	1.002	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)COc3ccccc3C)C2)C1	1840152155	ZJKQKQVRBPZZKR-DYESRHJHSA-N	440.924	1.084	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccccc3C3CC3)C2)C1	1840156200	KGPJKICDKITZGT-SIKLNZKXSA-N	436.936	1.888	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)c1	1840729554	SEZMBQODZGZEFP-LPHOPBHVSA-N	427.860	1.249	50	20	IDGD	
O=C(C(Cl)Cl)N1CCOC[C@@]2(C1)CN(C(=O)C1Cc3ccccc3C1)CCO2	1840944342	CJYYAMZNZOJLIS-FQEVSTJZSA-N	427.328	1.662	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)Cc2cc(F)cc(F)c2)C1	1843075273	LCKGPVJXDPMUGU-VULFUBBASA-N	443.454	1.845	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)C2=NO[C@H](c3ccccc3)C2)C1	1843864659	NAYYABZTWDPBEE-SFHVURJKSA-N	427.505	1.080	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1ccc(OC(F)F)cc1)C2	1844264838	NBJMQSOAOAGBIN-UHFFFAOYSA-N	445.426	1.417	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2cc3ccoc3cn2)C1	1845579110	HVUXGZKEJMKMPX-AFUMVMLFSA-N	434.456	1.779	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H]2CC[C@@H]1[C@@H](C(=O)N1CC[C@H]3[C@@H]1CCN3C(=O)[C@H](O)CCl)C2	1847568108	BGBBOBBLZDVLLS-CVWVJMLGSA-N	441.956	1.576	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)c1cccc(N2CCCS2(=O)=O)c1	11677504	FNZHVQCYAHMKBF-UHFFFAOYSA-N	441.469	1.193	50	20	IDGD	
CCOc1ccc(CN2CCN(CC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)CC2)cc1	27567725	GLEPUADSCLERFN-UHFFFAOYSA-N	441.488	1.572	50	20	IDGD	
O=C(CCC(=O)c1ccc2c(c1)OCCCO2)NNC(=O)CNC(=O)c1cccs1	725740111	BCVPTQFEKSAASD-UHFFFAOYSA-N	431.470	1.450	50	20	IDGD	
Cc1cc(C(=O)N2CCC[C@@H]2C(=O)NNC(=O)COc2ccc(F)cc2)ccc1[N+](=O)[O-]	726522826	YBKTUIGDMAEHJK-GOSISDBHSA-N	444.419	1.873	50	20	IDGD	
O=C(COC(=O)c1csc(-c2ccccn2)n1)NNC(=O)c1ccc([N+](=O)[O-])cc1	726642387	CTVSWFIOSKSBMZ-UHFFFAOYSA-N	427.398	1.731	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)CCCc2ccccc2)sc1Br	727869149	DAEKIXZGTHFZDT-UHFFFAOYSA-N	446.348	1.942	50	20	IDGD	
CCSc1cc(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)ccn1	728215573	GPXKEEUQMREWST-UHFFFAOYSA-N	435.575	1.887	50	20	IDGD	
CC(C)NC(=O)NNS(=O)(=O)c1ccc(S(=O)(=O)N2C[C@@H](C)C[C@H](C)C2)cc1	728263363	XECQEEOZWDRBCD-KBPBESRZSA-N	432.568	1.254	50	20	IDGD	
O=C(O)c1cc(C(=O)O)cc(S(=O)(=O)NNC(=O)c2cccc(OC(F)F)c2)c1	728510827	VYYLEVOEKNWQAR-UHFFFAOYSA-N	430.341	1.308	50	20	IDGD	
CCS(=O)(=O)N1CCC[C@H](C(=O)NNC(=O)c2cc(F)ccc2Br)C1	728546505	WJPFKOKFJPAEIQ-JTQLQIEISA-N	436.303	1.411	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2cccc(C#N)c2)cc1OCC	728871729	BJXSFBFFIWMBHI-UHFFFAOYSA-N	446.485	1.095	50	20	IDGD	
CC(C)Cn1c(=O)nc(O)c2c(C(=O)NNC(=O)Cc3cccnc3)cc(C(C)C)nc21	728892350	UOCRFHKSHQDFFL-UHFFFAOYSA-N	438.488	1.675	50	20	IDGD	
CSCC[C@H](NC(=O)c1ccc2ccccc2n1)C(=O)NNC(=O)Cc1cccnc1	728892920	CUDKFDDAICZMRB-IBGZPJMESA-N	437.525	1.871	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NC[C@H]2CN3CCC[C@H]3CO2)c2ccccc2c1=O	729619016	NWXSJKXTQAOZSM-HOTGVXAUSA-N	442.520	1.004	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NN=Cc1c(N2CCOCC2)nc2ccccn2c1=O	729637902	MZYLWZFTJMRYKX-UHFFFAOYSA-N	430.468	1.636	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)[C@H]2CC(=O)N(C3CCC(C)CC3)C2)n1	731382756	MKYSOQBZXWPCOC-BLZCZZARSA-N	436.534	1.112	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)NCC(=O)N1CCN(c2ccc(Cl)cc2)CC1	731406157	QKEISZBTYITLBR-UHFFFAOYSA-N	447.898	1.701	50	20	IDGD	
CCCCOc1ccc(C(=O)NNS(=O)(=O)c2n[nH]c(C)c2C(=O)OC)cc1OC	732045260	FWIKYJNVZLOKEC-UHFFFAOYSA-N	440.478	1.316	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)N[C@H]1CCCN(c2cc(N3CCOCC3)ncn2)C1	732914217	IZKCGETVVNYNDU-KRWDZBQOSA-N	439.520	1.235	50	20	IDGD	
O=C(NCCS(=O)(=O)NCc1ccccc1)NNC(=O)NCc1ccc(Cl)cc1	733037758	GMDAVJGDYRPYPD-UHFFFAOYSA-N	439.925	1.473	50	20	IDGD	
O=C(Oc1ccc([N+](=O)[O-])cc1Br)[C@H]1CC(=O)N([C@@H]2CCS(=O)(=O)C2)C1	739311486	QBZMPBOWBZOLSQ-GXSJLCMTSA-N	447.263	1.298	50	20	IDGD	
CN(CC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)c1ccccc1[N+](=O)[O-]	742469329	WPCGCSADKULSKH-UHFFFAOYSA-N	440.504	1.391	50	20	IDGD	
C[C@]1(c2ccccc2)NC(=O)N(CC(=O)NNC(=O)c2cccc(Br)c2)C1=O	742768889	BNSYEPCTYRFQOH-LJQANCHMSA-N	445.273	1.677	50	20	IDGD	
Cc1ccc(S(=O)(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1Br	743252094	KBXULTHCTLSFQD-OAHLLOKOSA-N	427.276	1.907	50	20	IDGD	
CC(C)[C@@H](NC1CCOCC1)C(=O)NNC(=O)c1ccc(CSc2nncn2C)cc1	743296559	CVDUBDSPOHWFRS-GOSISDBHSA-N	446.577	1.662	50	20	IDGD	
CC1(C)C(=NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)[C@H]2CCCO[C@H]21	743423831	XTISLISJEZOZBW-WIYYLYMNSA-N	449.573	1.947	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)Cn2nnc(-c3ccccc3)n2)cc1Cl	743805182	LIFXSMQGKJYRAV-UHFFFAOYSA-N	431.840	1.864	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)[C@H]2CC(=O)N(c3ccc4c(c3)OCCO4)C2)cc1	743827918	UXIWALCBIKRQRJ-AWEZNQCLSA-N	439.472	1.730	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)CN2C(=O)[C@H]3CCCC[C@H]3C2=O)cc1Cl	743834667	OWHJFIBRTHESDJ-PHIMTYICSA-N	438.868	1.685	50	20	IDGD	
O=C(CCCc1nc(C2CC2)no1)NNc1ccccc1S(=O)(=O)N1CCOCC1	744620953	JHBDSKROXXVDII-UHFFFAOYSA-N	435.506	1.434	50	20	IDGD	
O=C(NC[C@H](c1cccs1)N1CCOCC1)NNC(=O)c1cc([N+](=O)[O-])ccc1O	745278901	OCHALPMPYNRMMN-CQSZACIVSA-N	435.462	1.379	50	20	IDGD	
C[C@H]1CN(C(C)(C)CNC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)C[C@@H](C)O1	745408887	NMKGSWUCPVYMNJ-OKILXGFUSA-N	441.554	1.314	50	20	IDGD	
C[C@@H](CCc1cccn1C)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	745876072	VTTLIRZOVWAZDA-INIZCTEOSA-N	447.561	1.775	50	20	IDGD	
O=C(NNC(=O)N1CCOCC1)c1cc(S(=O)(=O)NC2CC2)c(Cl)cc1Cl	745992752	JOZXABMBIHCHCV-UHFFFAOYSA-N	437.305	1.121	50	20	IDGD	
CC[C@H](NC(=O)NNC(=O)Cc1cn2ccccc2n1)c1cccc(S(N)(=O)=O)c1	746758480	JQLUQKBVFIORFZ-INIZCTEOSA-N	430.490	1.006	50	20	IDGD	
CN(C)N(C(=O)CCCN1C(=O)c2cccc3cccc(c23)C1=O)[C@@H]1CCS(=O)(=O)C1	746949225	ILENGDKSSZKPBT-MRXNPFEDSA-N	443.525	1.708	50	20	IDGD	
C[C@H](c1ccncc1)N1CCC(NC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)CC1	748020465	HPIYAQQYSZUQDM-QRWLVFNGSA-N	425.489	1.777	50	20	IDGD	
CCS(=O)(=O)N1CCN(C(=O)CCC(=O)C(C#N)=C2N(C)c3ccccc3N2C)CC1	748056478	XEDZGIJKOBEBCD-UHFFFAOYSA-N	445.545	1.151	50	20	IDGD	
O=C(NNc1ccc(Br)cc1F)C1=NN([C@@H]2CCS(=O)(=O)C2)C(=O)CC1	748190206	TWOAFNLUCXIZCF-SNVBAGLBSA-N	447.286	1.197	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2cccc(N(C)C)c2)c1	748465348	GYNMZPFBWPUXSK-UHFFFAOYSA-N	447.561	1.927	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)/C(C#N)=C/c2ccc(O)cc2)cc1OC	750664157	ROKSRUAWCJDXAQ-OQLLNIDSSA-N	425.397	1.321	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)[C@H]1CC(c2ccc(Cl)cc2Cl)=NO1	751203984	UHKDNYXYSYYMRC-CQSZACIVSA-N	425.228	1.657	50	20	IDGD	
C[C@@H]1CCCCN1S(=O)(=O)c1ccc(C(=O)NNC(=O)CNC(=O)c2ccco2)cc1	751206353	FLPAZDCINFNISA-CQSZACIVSA-N	448.501	1.034	50	20	IDGD	
C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NNC(=O)CNC(=O)c1cccs1	751211940	NABTYSXFDVHVIM-VIFPVBQESA-N	426.838	1.654	50	20	IDGD	
CC[C@H](CS(=O)(=O)c1ccccc1)NC(=O)NNC(=O)c1nnc(O)c2ccccc12	752703897	LPCFUOWLQGODEB-CYBMUJFWSA-N	443.485	1.532	50	20	IDGD	
COc1ccc(Cl)cc1S(=O)(=O)N1CCN(C(=O)NNC(=O)C2CCCC2)CC1	753337810	ZBPFIEOGBAXLCV-UHFFFAOYSA-N	444.941	1.586	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)Nc1cccc(S(=O)(=O)N2CCOCC2)c1	755353023	FHKWQLRSTFOVFS-UHFFFAOYSA-N	449.445	1.082	50	20	IDGD	
O=C1CN(c2ccc(NC(=O)NNC(=O)CCc3ccccc3O)cc2Cl)CCN1	755938181	NKPLEUONQNGXPF-UHFFFAOYSA-N	431.880	1.767	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)Nc2ccc(C)cc2OCC(=O)N(C)C)c1	756203251	QIKUBXLUBQCIBO-UHFFFAOYSA-N	428.449	1.282	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)Nc2ccc(CNS(C)(=O)=O)cc2)o1	756625403	KKBGMGAGDVEZDF-UHFFFAOYSA-N	437.522	1.637	50	20	IDGD	
C[C@H]1C[C@@H](C)C[C@]2(C1)NC(=O)N(CC(=O)NNC(=O)Cc1c[nH]c3ccccc13)C2=O	756868763	XVDYJVMJOGLGRO-HSAQVAQVSA-N	425.489	1.605	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)Nc1cnn(-c2cnc3ccccc3n2)c1	757784079	PPXBYKQLGBTYBA-UHFFFAOYSA-N	441.411	1.931	50	20	IDGD	
CCc1ccc(S(C)(=O)=O)cc1C(=O)NNC(=O)c1csc(N2CCOCC2)n1	758079497	LOERPHILPKQIOG-UHFFFAOYSA-N	438.531	1.020	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@H](NC(=O)NNC(=O)c2ccc3c(c2)OCCO3)[C@H](C#N)C1	758759364	LHDDJHZRPMRLCG-ZIAGYGMSSA-N	431.449	1.161	50	20	IDGD	
CCNS(=O)(=O)c1ccc(CC(=O)NNC(=O)c2cccc(OC(F)F)c2)cc1	759379328	PICXSALGRUYXLQ-UHFFFAOYSA-N	427.429	1.590	50	20	IDGD	
Cc1nc2c(c(C)nn2C)c(C)c1CCC(=O)NNC(=O)CCNC(=O)OC(C)(C)C	760439823	LSNNCPPFYNSVNS-UHFFFAOYSA-N	432.525	1.888	50	20	IDGD	
O=C(Cn1cnc(-c2ccccc2)n1)NNc1ccccc1S(=O)(=O)N1CCOCC1	761814026	PSTZKCMWTASKEV-UHFFFAOYSA-N	442.501	1.109	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(OCc2ccccc2)nc1	763467417	FRIYXWCHTNROLB-UHFFFAOYSA-N	435.396	1.969	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(NC(=O)[C@H](C)OC)c2)cc1OC	763550643	ORIZOFRYHXEBBO-LBPRGKRZSA-N	444.444	1.077	50	20	IDGD	
COc1ccc(C(=O)N2CCCC2)cc1NC(=O)C(=O)NNC(=O)c1cc(C)oc1C	763583299	KTYZEYIOTIKABL-UHFFFAOYSA-N	428.445	1.541	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccnn2CCc2ccccc2)cc1	763661995	RPKCMMZDXBXHRU-UHFFFAOYSA-N	437.456	1.299	50	20	IDGD	
COCCOc1c(Cl)cccc1NC(=O)C(=O)NNC(=O)COc1ccc(C#N)cc1	763681103	KHYZQRZAKVKLAQ-UHFFFAOYSA-N	446.847	1.402	50	20	IDGD	
CCc1cc(NC(=O)C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)ccc1C	763737185	PDUJREYRRVUJOU-UHFFFAOYSA-N	446.529	1.272	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2cccc(N(C)C)c2)cccc1N1CCOC1=O	763753095	FJRGBXBIIWCIEO-UHFFFAOYSA-N	425.445	1.417	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cc(C)n([C@@H](C)C3CC3)n2)cc1	763878630	SDGAJNFZTDLJIN-DZGCQCFKSA-N	441.488	1.919	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c2cccnc2c1C	763922152	SVCIMIFQEIJUSE-UHFFFAOYSA-N	430.428	1.227	50	20	IDGD	
CCN1CCC(n2nccc2NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)CC1	763977986	ZBBJKLTVJRWHJR-UHFFFAOYSA-N	434.884	1.299	50	20	IDGD	
NC(=O)CCOc1ccccc1NC(=O)C(=O)NNC(=O)c1cccc(C(F)(F)F)c1	764037941	XKHAEXONOSKNDQ-UHFFFAOYSA-N	438.362	1.359	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccn(-c3ccccc3Cl)n2)c1O	764130360	FRTIICULEPWYOE-UHFFFAOYSA-N	429.820	1.640	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccc(OCC(F)(F)F)nc1	764132250	MJABETZZTPDDJW-UHFFFAOYSA-N	426.351	1.360	50	20	IDGD	
Cc1cc(C(=O)NCC(C)C)ccc1NC(=O)C(=O)NNC(=O)COc1ccccc1O	764274825	DHHZTRBRTPUTBC-UHFFFAOYSA-N	442.472	1.251	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cnccc2SC)cc1Br	764326355	GEDUNFLELOUPBW-UHFFFAOYSA-N	439.291	1.974	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)C(=O)Nc1ccc(N2CCSCC2)c(Cl)c1	764354480	SUKPYFZRYGGDHB-UHFFFAOYSA-N	433.921	1.617	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)C(=O)Nc1ccnn1Cc1cnn(-c2ccccc2)c1	764387176	PKMXDAOTNLTFDU-UHFFFAOYSA-N	444.455	1.220	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1cc(C(C)(C)C)nn1-c1cccc(C)c1	764399983	OOMYBDKOACZJEF-HNNXBMFYSA-N	445.520	1.616	50	20	IDGD	
COc1ccc(C)cc1N1C[C@@H](C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)CC1=O	765321414	XZRQFNLGCBKQET-HNNXBMFYSA-N	448.520	1.809	50	20	IDGD	
CNS(=O)(=O)c1ccc([C@H](C)NC(=O)NNc2ccccc2S(C)(=O)=O)cc1	765686400	PWRRYTKJDDIFQQ-LBPRGKRZSA-N	426.520	1.386	50	20	IDGD	
Cc1ccc(C)c(OCCC(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)c1	765735265	JBQOOOZZIWKPSE-UHFFFAOYSA-N	438.528	1.678	50	20	IDGD	
C=C1c2ccccc2C(=O)N1CC(=O)NNC(=O)CN1CCN(Cc2ccc(C)cc2)CC1	765754002	JEYSEYTWFWPRPK-UHFFFAOYSA-N	447.539	1.387	50	20	IDGD	
O=C(Cc1ccccc1[N+](=O)[O-])NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	765755922	JDKSXKUQRLJEMC-UHFFFAOYSA-N	445.907	1.756	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2cnn(C3CCOCC3)c2C)c2ccccc2c1=O	766327216	QHZQWSMCHKDKBJ-UHFFFAOYSA-N	438.488	1.738	50	20	IDGD	
O=C(NNC(=O)c1ccn(-c2ccc(F)cc2F)n1)c1csc(N2CCOCC2)n1	766628628	FXLMBHURASVJSQ-UHFFFAOYSA-N	434.428	1.518	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)[C@@H]1CS[C@H](Cc2ccccc2F)C(=O)N1	766669058	FXKPNGMJOYVSQU-JKSUJKDBSA-N	437.518	1.515	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN(C)Cc2nc(O)c3sccc3n2)cc1OC	767961452	ZDLHYHJTSXYDTC-UHFFFAOYSA-N	431.474	1.307	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)CCCS(=O)(=O)N3CCCC3)n[nH]2)c1	768268656	DUPBNRUXASZKQG-UHFFFAOYSA-N	433.534	1.660	50	20	IDGD	
CSCC[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)NNC(=S)Nc1ccccn1	768585439	MDMNKITZSHCFDO-CQSZACIVSA-N	448.530	1.859	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCC2(C)Cc3ccccc3C2)cc1	770313315	SNPXZJLTRWLMPB-UHFFFAOYSA-N	444.557	1.751	50	20	IDGD	
COc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NNc2ccnc(Br)c2)cc1	771560011	BRKASVKAGFWQMF-JTQLQIEISA-N	429.296	1.663	50	20	IDGD	
CC(C)(C)OC(=O)N1CCSC[C@@H]1CC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	772009835	KEFMSEGMGNAVBT-BBRMVZONSA-N	437.518	1.716	50	20	IDGD	
Cc1csc([C@@](O)(CC(=O)O[C@H](C)C(=O)NNC(=O)CC(C)C)C(F)(F)F)n1	772064596	OECMCRNSYLZRHQ-BMIGLBTASA-N	425.429	1.717	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1cc(S(=O)(=O)CC)ccc1Br	772258250	NSLITBPGDVCLMA-SECBINFHSA-N	435.296	1.345	50	20	IDGD	
O=C(NNC(=O)N1CC[C@H]2[C@@H](CCCN2C2CC2)C1)c1csc(N2CCOCC2)n1	772973576	RLNYSFKELALDFM-YOEHRIQHSA-N	434.566	1.283	50	20	IDGD	
C[C@H]1Oc2ccccc2N(CC(=O)NNC(=O)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)C1=O	773416525	BUQDVZZANCXDAV-HUUCEWRRSA-N	446.504	1.595	50	20	IDGD	
CCS(=O)(=O)c1ccc(C(=O)NNC(=O)[C@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1	773420818	PMSIKRFTTRNGHG-HNNXBMFYSA-N	439.534	1.888	50	20	IDGD	
COC[C@H](C)NS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2c(F)cccc2F)cc1	773705850	JDBYJPNTFIVFEP-NSHDSACASA-N	442.444	1.360	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2cccc3c2CCN(C(=O)OC(C)(C)C)C3)n1	773736687	SDSDCAWTIUIGHZ-UHFFFAOYSA-N	442.476	1.860	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)CCNS(=O)(=O)c2ccccc2Cl)c1	776527354	FIDMPSVXJDSDSV-UHFFFAOYSA-N	431.923	1.555	50	20	IDGD	
Cc1cc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)nn1[C@@H](C)C1CC1	777192805	YCFVHLHYZBYHDV-SCLBCKFNSA-N	428.445	1.307	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NN=C(C)C2CCS(=O)(=O)CC2)c1	777419427	ZLBUKWVNODVRRA-UHFFFAOYSA-N	429.564	1.648	50	20	IDGD	
COc1cccc(CO[C@H](C)C(=O)N2CCN(S(=O)(=O)CBr)CC2)c1	777779483	MTVDQPYUIGEAGZ-CYBMUJFWSA-N	435.340	1.427	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)CNC(=O)c2cccc(Br)c2)nc1C	778428246	AGIXWCFIICUODV-UHFFFAOYSA-N	436.266	1.597	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)Cc1cccc(I)c1	778438434	SBEVOOPUVZCTOJ-UHFFFAOYSA-N	433.246	1.506	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)[C@H](O)[C@@H](O)c3nc4ccccc4s3)n[nH]2)cc1	779499449	HLWSDCNAALTFCU-QZTJIDSGSA-N	437.481	1.850	50	20	IDGD	
CCO[C@H]1C[C@@](NC(=O)OC(C)(C)C)(C(=O)NNc2nc(O)c3cnn(C)c3n2)C1(C)C	780701230	UMKJVIQCGSBARQ-FKIZINRSSA-N	449.512	1.611	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2ccc(F)cc2Br)cc1-n1cnnn1	781680623	REUYZLODQKEASU-UHFFFAOYSA-N	435.213	1.647	50	20	IDGD	
C[C@@H]1CN(S(=O)(=O)c2cccc(C(=O)NNc3ncncc3Cl)c2)C[C@@H](C)O1	781813773	LSWANCYXLPGCJZ-VXGBXAGGSA-N	425.898	1.685	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@H](C)C#N)c1	781948585	BRKWZBQZMLAQKO-CYBMUJFWSA-N	431.474	1.600	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(OCC(F)F)cc1)C1CCN(c2ncccn2)CC1	783825980	HFPJAZPSJARBRL-UHFFFAOYSA-N	441.460	1.347	50	20	IDGD	
Cc1ccc(NNC(=O)C(=O)Nc2ccc(S(=O)(=O)N(C)C3CCCCC3)cc2)nn1	783951313	GPYPVKWEEVKGNM-UHFFFAOYSA-N	446.533	1.820	50	20	IDGD	
COc1cccc(NNC(=O)C(=O)Nc2cccc(CS(=O)(=O)NC(C)(C)C)c2)n1	784843757	PSPYCHKTSZGGQD-UHFFFAOYSA-N	435.506	1.390	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1cccc(NC(=O)C(=O)NNc2cc(Cl)ccn2)c1	784856407	IUVUKUQGPCGTEU-UHFFFAOYSA-N	425.898	1.894	50	20	IDGD	
C[C@H](C(=O)Nc1ccc(NC(=O)C(=O)NNc2cc(F)c(F)cc2F)cc1)n1cncn1	784891519	UWAXKFLVADZWLB-SNVBAGLBSA-N	447.377	1.977	50	20	IDGD	
CCOC(=O)c1cc(S(=O)(=O)NNC(=O)NCc2ccccc2)cc([N+](=O)[O-])c1C	786731520	CATGNLFRBDFQIT-UHFFFAOYSA-N	436.446	1.773	50	20	IDGD	
CCC1(CC)Oc2ccc(NC(=O)C(=O)NNC(=O)COc3ccccc3O)cc2O1	787890267	YGWRTBCMPFCFOG-UHFFFAOYSA-N	429.429	1.845	50	20	IDGD	
COc1nc(Br)ccc1NC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	789380134	RHHLXWWKVPOFGY-UHFFFAOYSA-N	443.279	1.723	50	20	IDGD	
Cc1c(Br)ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)c1F	789733108	VWQKWDRRRKXZPW-UHFFFAOYSA-N	449.236	1.933	50	20	IDGD	
Cn1nc([C@H]2CCCO2)cc1NC(=O)C(=O)NNC(=O)c1ccc(Cl)cc1Cl	789749512	QTGIUAFCFLFXHE-CYBMUJFWSA-N	426.260	1.978	50	20	IDGD	
Cc1c(Br)ccc(NC(=O)C(=O)NNC(=O)CNC(=O)c2ccco2)c1F	789758980	WNJGTKVAZICMPR-UHFFFAOYSA-N	441.213	1.006	50	20	IDGD	
C=CCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)cc1	789812322	KZCCAXMYUFEXBD-OALUTQOASA-N	436.468	1.261	50	20	IDGD	
COc1cccc(C=NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)n1	790144675	XOACDRHWQMEYNO-UHFFFAOYSA-N	432.502	1.194	50	20	IDGD	
CC(C)(C)c1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(N3CCC3=O)c2)cc1	790951928	MSBOVHMSTZUOIR-UHFFFAOYSA-N	438.484	1.886	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)[C@H]1CCS(=O)(=O)c2ccccc21	791054953	GRWOBUHQNQUAGN-HNNXBMFYSA-N	435.889	1.065	50	20	IDGD	
CCc1c(NC(=O)C(=O)NNC(=O)c2nnc(O)c3ccccc23)cnn1C(CC)CC	792267976	JLFCBLYRRVFKHO-UHFFFAOYSA-N	439.476	1.855	50	20	IDGD	
CCOc1cc(NC(=O)C(=O)NNc2nc3ccccn3n2)c([N+](=O)[O-])cc1OCC	792394666	LKJURFAZKJLZJC-UHFFFAOYSA-N	429.393	1.517	50	20	IDGD	
CN(C)N(C(=O)c1cc(S(=O)(=O)Nc2ccccc2F)c[nH]1)[C@H]1CCS(=O)(=O)C1	792853622	FYMTUBROUQFAEV-LBPRGKRZSA-N	444.510	1.061	50	20	IDGD	
COc1c(NC(=O)C(=O)NNC(=O)c2ccc(C)cc2O)cc(Cl)cc1C(=O)N(C)C	793026081	OTWNJGNIKBEYMR-UHFFFAOYSA-N	448.863	1.464	50	20	IDGD	
O=C(NCc1ccc(I)cc1Cl)NNC(=O)C(=O)NC1CC1	793490336	DJEDMNYOFNADSB-UHFFFAOYSA-N	436.637	1.054	50	20	IDGD	
CC(=O)N1CCN(c2ccc(C(=O)NNC(=O)c3cccc(C)n3)cc2[N+](=O)[O-])CC1	794081313	CFHPSTCHZJXXEK-UHFFFAOYSA-N	426.433	1.042	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)c1occ2c1CCC2	794808324	CTCAXBIFXSYZDE-UHFFFAOYSA-N	447.513	1.183	50	20	IDGD	
COc1cccc(S(=O)(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)c1	795182515	SQQDQTRJBPRIEO-UHFFFAOYSA-N	428.511	1.493	50	20	IDGD	
CCc1ccccc1OCC(=O)NNS(=O)(=O)c1cccc(C(=O)NCCOC)c1	795280451	HVJFAYXKYDRBEN-UHFFFAOYSA-N	435.502	1.014	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1cc(N2CCOCC2)ccc1C	797534892	DZYMWGJGMHVXHE-UHFFFAOYSA-N	446.891	1.893	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNS(=O)(=O)c2cc(Cl)cc(C(N)=O)c2)cc1	799120181	KOYVAINRJUFYHD-NSHDSACASA-N	441.893	1.615	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(OCC(F)(F)F)c(F)c2)c1O	800622420	FAFSITJXYMWVQE-UHFFFAOYSA-N	445.325	1.881	50	20	IDGD	
COc1ccc(C2=NO[C@@H](CNC(=O)NNC(=O)c3ccc(OC)c(OC)c3)C2)cc1	802368895	WZCKCXJWVGTKLF-MRXNPFEDSA-N	428.445	1.850	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(OC(F)F)cc1F	802565890	PTVLHUZGXLMZKL-UHFFFAOYSA-N	427.335	1.601	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccc(F)c(N2CCCNC2=O)c1	806975541	DOINBVYDCVHEPO-UHFFFAOYSA-N	431.399	1.213	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)c1nnn(-c2cccc3c2CCN(C)C3)c1C	807371622	PCZCTMKOVOFCQH-UHFFFAOYSA-N	430.509	1.114	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)CNS(=O)(=O)c2ccccc2F)o1	810200150	KDDFNBPTAVKYLM-UHFFFAOYSA-N	426.470	1.000	50	20	IDGD	
CCOC(=O)c1cc(S(=O)(=O)NNC(=O)c2cnccn2)cc(Br)c1C	811679772	RUNJKXSJMUHCEH-UHFFFAOYSA-N	443.279	1.348	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@@H]2CCC[C@@H]3CN(C(C)=O)C[C@H]32)c2ccccc2c1=O	812435074	YCMQBPAPYUDAQK-ZTFGCOKTSA-N	440.504	1.007	50	20	IDGD	
COCCCS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2cccc(Cl)n2)cc1	815728392	AXIGYKKYKXONRC-UHFFFAOYSA-N	426.882	1.627	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1ccc(-n2cccn2)c(F)c1	815751521	COEYUMLFVOBIRD-UHFFFAOYSA-N	446.464	1.344	50	20	IDGD	
CCS(=O)(=O)N1CCC(C(=O)NNc2cc(C(=O)OC)ccc2Br)CC1	816717475	DCCJVCATPVXXRE-UHFFFAOYSA-N	448.339	1.741	50	20	IDGD	
CCS(=O)(=O)c1ccc(F)c(C(=O)NNc2ccccc2S(=O)(=O)N(C)C)c1	817051295	JNPICPQFOKWUDZ-UHFFFAOYSA-N	429.495	1.627	50	20	IDGD	
NC(=O)N[C@H](CC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)c1ccccc1	821892975	ZICXAYQAMJFQHE-HXUWFJFHSA-N	438.532	1.146	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)c3c(C)noc3n2)cc1	836699109	CXXLXKHJCMFFDA-CQSZACIVSA-N	428.470	1.702	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)Cn1cnc2sc(C)c(C)c2c1=O	869770728	GFLXVZPTFYREMT-UHFFFAOYSA-N	430.486	1.700	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NN=Cc2c(Cl)nc(N)nc2N2CCOCC2)cc1	874080064	HGBIHGSAEGZCRY-ZDUSSCGKSA-N	448.911	1.865	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)Nc1ccc(F)cc1F	915879492	CSMUQWPQSYDRGA-UHFFFAOYSA-N	440.428	1.452	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)CCS(=O)(=O)C2CCCC2)c2ccccc2c1=O	916093038	XZTCPDDSQWVCNE-UHFFFAOYSA-N	434.518	1.486	50	20	IDGD	
O=C(CCN1CCN(C(c2ccccc2)c2ccccc2)CC1)NNC(=O)c1cn[nH]c1	916097068	QLQVIUQMKWZMBC-UHFFFAOYSA-N	432.528	1.968	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC(NC(=O)NNC(=O)Cc3ccc(F)cc3)CC2)cc1	916235713	OKILGTXQSLRQLL-UHFFFAOYSA-N	448.520	1.860	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)N2CCN(CC(=O)N(C)C)CC2)c(C)n1C[C@H]1CCCO1	917367045	JDQVYZYEHFIQAG-DMMSUNFISA-N	427.549	1.423	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)c2ccc(Br)s2)cc1C(=O)O	917727910	RWVJLZXAVUHDIS-UHFFFAOYSA-N	435.277	1.841	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1ccc2c(c1)NC(=O)CO2	918056330	HDGUASIBPZZIOB-UHFFFAOYSA-N	433.804	1.298	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)c1ccc2c(c1)S(=O)(=O)N(C1CC1)C2=O	919822244	IJKYALHFEBVHBS-UHFFFAOYSA-N	429.454	1.006	50	20	IDGD	
N#Cc1ccccc1Sc1ccccc1C(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1	919889355	LKSDSLLSMYHZAM-AWEZNQCLSA-N	430.511	1.841	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)CCCNC(=O)c2ccsc2)ccc1Cl	920277293	QFFYWWHUPMIWPF-UHFFFAOYSA-N	444.922	1.020	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1)NNC(=O)c1cccc(Cl)c1	920424551	DGWMMGXANFGDRT-UHFFFAOYSA-N	426.838	1.378	50	20	IDGD	
COc1ccc([N+](=O)[O-])c(C(=O)OCC(=O)NNC(=O)c2cc(Cl)ccc2OC)c1	920704722	DBCKHOCIUYZNRY-UHFFFAOYSA-N	437.792	1.883	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)Nc1cccc(CN2C(=O)CNC2=O)c1	920928545	OSHIKVIPZGGVTN-UHFFFAOYSA-N	449.427	1.096	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1nnc(O)c2ccccc12)c1cccc(N2CCOC2=O)c1	920984476	UYQZGBXLFXENEV-GFCCVEGCSA-N	436.428	1.997	50	20	IDGD	
C=C[C@H](COC)NC(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccc(OC)cc2)c1	1116619533	PNFRLVLUPQHXFB-OAHLLOKOSA-N	448.501	1.641	50	20	IDGD	
Cc1ccn(-c2cccc(C(=O)NNc3ccccc3S(=O)(=O)N3CCOCC3)c2)n1	1252332955	ZLMIUZDDOGSQCL-UHFFFAOYSA-N	441.513	1.959	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1)[C@H](C)N1CCOCC1	1318971781	DHPKVLBLVPAGGF-GJZGRUSLSA-N	427.546	1.073	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2nc3ccccn3n2)C1	1777816953	VHFQBMBAKCSTFV-BXTJHSDWSA-N	435.912	1.111	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc4n(n3)CCCC4)C2)C1	1778562319	ZTRDZCFBISJQSE-RTBURBONSA-N	429.348	1.899	50	20	IDGD	
CC1=CC[C@H](C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2ccc(B(O)O)cc2)C3)CC1	1778748939	SJHHCLRLSFJODP-SNYIIPAISA-N	440.349	1.240	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)o1	1779024580	UUPBAQJBDSHCNH-KPZWWZAWSA-N	442.310	1.713	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2)c1ccc(C(F)(F)F)[nH]1	1779577580	STJIFEHXNKOWEK-DXCKQFNASA-N	437.846	1.761	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)C3=Cc4ccccc4NC(=O)C3)C2)C1	1779991520	VIRNJLLUDKGCBT-VGSWGCGISA-N	447.919	1.496	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)nn1C(F)F	1780307589	PWUBCHBRRHNMKQ-GOSISDBHSA-N	430.528	1.882	50	20	IDGD	
C=CCNC(=O)/C=C\C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Br)C1	1780770455	OGRFJMKHKUKREY-JEWVKGLTSA-N	446.317	1.049	50	20	IDGD	
COc1nccc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@](C)(Cl)CCl)C3)C2)c1F	1781228130	WZEDOIOUUBQEOY-MSOLQXFVSA-N	434.295	1.909	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc4nonc4c3)CCO2)C1	1781229311	GHDWJLGBKIXILX-QZTJIDSGSA-N	427.288	1.903	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)c3cc4n(n3)CCCC4)CCO2)C1	1781229924	LHVJUMFKLNHGLH-RTBURBONSA-N	429.348	1.899	50	20	IDGD	
O=C(c1ccc2cnccc2n1)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781329950	ONHFWIAUGLDFML-CRAIPNDOSA-N	437.269	1.764	50	20	IDGD	
O=C(c1cc(F)cc([N+](=O)[O-])c1)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1781768172	CXTFPVIUHQFVGY-CJNGLKHVSA-N	448.220	1.868	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@](C)(Cl)CCl)C2	1782178466	JUWWJSOHXVPJBY-BQGCOEIASA-N	429.772	1.990	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H]1[C@H]3COC[C@H]31)CCO2	1782868196	XCOIAOIHZOMAGQ-LTFLBFIOSA-N	443.450	1.594	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@]1(F)CCCCC1(F)F)CCO2	1783934359	FPLDERKSGJWNPG-MOPGFXCFSA-N	448.486	1.107	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4cccnn4c3)C[C@@H]21	1786407311	PFBLBASVFDXGIT-JQFCIGGWSA-N	435.322	1.713	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)[C@H]3SC(=N)NC3=O)[C@H]2C1	1787492483	FQZGPTGPPLAXEA-HCDMYHGNSA-N	444.985	1.176	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C=N/O[C@@H]3CCCCO3)[C@H]2C1	1788658716	MRUJGYOHWXHDGI-LIWHVUMVSA-N	441.601	1.347	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cncc(S(C)(=O)=O)c3)C[C@@H]21	1789858815	QSDVPUTXQRPPIO-SJWGOKEGSA-N	443.953	1.096	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc(OCF)cn3)C[C@@H]21	1789868430	FPGVSNVLPQXKAU-MMNXLFCMSA-N	449.310	1.612	50	20	IDGD	
COc1nc(C)ccc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]2C1	1789924476	GEFGWQXGWUCESH-CYUUQNCZSA-N	444.301	1.682	50	20	IDGD	
Cc1nccn1CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)CBr)C[C@@H]21	1790646521	LFGHQPQXDLUGCT-OEAJRASXSA-N	427.343	1.202	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cc(C)[nH]n3)C[C@@H]21	1790960933	UMBIWDNXQNKSAK-HNKHHVNMSA-N	427.343	1.414	50	20	IDGD	
Cc1cc(C)n(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)CBr)n1	1792871863	AVWNTSFFGMUZIP-PTOXDTDZSA-N	441.370	1.511	50	20	IDGD	
COc1nc(C)ccc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)CBr	1792872631	SCWYCTDXKIMXCB-OEYIWLLWSA-N	440.338	1.633	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(CO)c(F)c1)C2	1792873354	VHKUAMTYGYCGMI-RMIITELYSA-N	443.313	1.552	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2)[C@@H]1CC(=O)N(C2CCCC2)C1	1793779466	HQYGXIPQHDWYHP-NFFDBFGFSA-N	432.348	1.171	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ncc[nH]1	1794837342	QSEXYBCAIVQQNO-BTTYYORXSA-N	427.417	1.809	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cn1cnnn1	1796299100	FSJKWRVKKKCBMT-SELDRTEESA-N	427.415	1.197	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccnc3ncccc13)C2	1797957520	URKDYFQQJMTDHR-CCWDJLKJSA-N	428.565	1.685	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2	1798522301	OHAQFIYJJHAKQJ-OJXGSEEGSA-N	443.815	1.258	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1(C)CC1)C2	1798522704	OXXDZBAZBOJZEK-ZSBFGKGUSA-N	431.445	1.523	50	20	IDGD	
COc1ccnc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)Br)C3)c1OC	1798769028	NIFAGUVOPXOLJE-NRWUCQMLSA-N	442.310	1.085	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCCCn1cccc1)C2)[C@@H](F)Br	1799349474	GSJUFISOWIZRNS-YALNPMBYSA-N	430.318	1.939	50	20	IDGD	
C[C@@H](Sc1ccccn1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Br	1799352434	WTRRXUSIWOGXFM-GGUBGCTKSA-N	446.342	1.842	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2)c1ccc(-c2ccc(O)nn2)cc1	1799840231	NOSORKHCZTVFTJ-LTCOOKNTSA-N	434.855	1.587	50	20	IDGD	
COc1cc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C(Cl)Cl)ccc1[N+](=O)[O-]	1801017292	KAJXGBIFEWDBFL-DRXBFXEBSA-N	446.287	1.539	50	20	IDGD	
Cc1ccc(C(=O)C(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]2c2cccnc2)cc1	1803146314	NGJNFRYDOXXCBH-GUDVDZBRSA-N	429.904	1.878	50	20	IDGD	
CCC[C@@H](NC(C)=O)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2	1804206793	KBXNLZMYTAEVGF-NZDARZTISA-N	444.536	1.063	50	20	IDGD	
C#CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](Cl)COC)C2	1804376054	HVQFPKRGXNQXRQ-JJTUDDRGSA-N	441.956	1.795	50	20	IDGD	
Cc1cc[nH]c1C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1805004971	PVLMHFDUYGIERV-NQIIRXRSSA-N	432.289	1.031	50	20	IDGD	
Cn1cnc(C(=O)NC[C@@H]2CCN(C(=O)[C@H](F)Br)[C@@H]2c2cccnc2)n1	1805327277	WIUVHRXXHNLGCG-XQQFMLRXSA-N	425.262	1.220	50	20	IDGD	
Cc1nc(C(=O)NC[C@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)co1	1805694515	OXYGNMMJURAYTC-OXQOHEQNSA-N	428.493	1.071	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)Cc2cccs2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807362201	FNSOCICLWSJFOA-XMSQKQJNSA-N	449.341	1.385	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)cn1C	1807363430	ORHCMRPGPVDDOX-SIKLNZKXSA-N	446.316	1.042	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)CNC(=O)c2cc(C)on2)[C@H]1c1cccnc1	1808263853	PZBGKVRYINPCNK-GJYPPUQNSA-N	447.923	1.831	50	20	IDGD	
C/C(=C/C(=O)N1CC[C@H](CNC(=O)[C@H](F)Br)[C@@H]1c1cccnc1)C(=O)O	1808681451	UBMKBVSDAJPGJF-HMKMOVAISA-N	428.258	1.809	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2cc(OC)n(C)n2)[C@@H]1c1cccnc1	1811636770	ZSKULOXGCBQARC-MPGHIAIKSA-N	435.912	1.397	50	20	IDGD	
CC[C@@H](NC(C)=O)C(=O)N1CC[C@H](CNC(=O)[C@@H](C)Br)[C@@H]1c1cccnc1	1812864554	WBLWXELPJCVNQA-YYQUZTFQSA-N	439.354	1.786	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1ccc(F)cn1	1816587563	ODSQFHOENYTTHB-SFHVURJKSA-N	437.240	1.243	50	20	IDGD	
CN[C@@H](CC(=O)Nc1cc([C@@H]2CCCCN2C(=O)CO[Si](C)(C)C)[nH]n1)C(=O)O	1817366941	DDZLZQVKNKLINR-KBPBESRZSA-N	425.562	1.316	50	20	IDGD	
CC(C)[C@@H](S)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819401705	PGLHCJQUJBBZEU-DOTOQJQBSA-N	445.549	1.669	50	20	IDGD	
C=CCOCCCC(=O)N1CCCC[C@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1	1822410674	OMRVVABSXHWTJB-KRWDZBQOSA-N	434.541	1.758	50	20	IDGD	
O=C(N[C@@H]1CCc2nc(NC(=O)[C@@H]3CC[C@@H]4CCC(=O)N4C3)sc2C1)[C@H](F)Cl	1822624187	XWKYQSFXRGXJDE-CZFOOCMKSA-N	428.917	1.991	50	20	IDGD	
C[C@@H]1C[C@@]1(C)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnccc1C(=O)NN)CC2	1822650439	NINIETOQYVBRPF-SUTOTMHJSA-N	428.518	1.414	50	20	IDGD	
CC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](COC(C)=O)OC(C)=O)CC2	1822850549	STIWEQNIEXLQMR-OBJOEFQTSA-N	445.925	1.567	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H]2CCCS2)n[nH]1	1823010724	IFELMYCZRMEKSH-HOTGVXAUSA-N	443.533	1.610	50	20	IDGD	
O=C(Cc1ccc2c(c1)CCO2)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](O)CCl)CC2	1825528892	JPIMJMDGHUNGFS-DZGCQCFKSA-N	435.933	1.832	50	20	IDGD	
O=C1C[C@H](C(=O)N2CCC([C@H]3CCCCN3C(=O)CCBr)CC2)CCN1	1826360782	VIICEMJXQNFIKO-HZPDHXFCSA-N	428.371	1.917	50	20	IDGD	
O=C1CCCN1CC(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H](F)Br)CC1	1826728994	RCYFCEXMWIBXMW-WMLDXEAASA-N	432.334	1.919	50	20	IDGD	
O=C([C@H]1CCC=CO1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827051889	ILFQRMAHIFZVOG-LEWJYISDSA-N	426.322	1.292	50	20	IDGD	
COc1ccccc1OCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1830230405	CAYUNUGAECPOJW-MJGOQNOKSA-N	430.860	1.065	50	20	IDGD	
CN1C(=O)CC[C@H]1C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](F)Br)CC1	1830380425	NBPWNTDMFITFHW-OFQRWUPVSA-N	432.334	1.917	50	20	IDGD	
O=C(c1cccc(F)c1Cl)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1830733878	WTZQZBASVYGJDZ-KBXCAEBGSA-N	435.279	1.149	50	20	IDGD	
O=C(C(Cl)Cl)N1CCC([C@H]2CCCCN2C(=O)[C@@H]2CCCS2(=O)=O)CC1	1831286486	XPWCLCVYYDZLCB-KGLIPLIRSA-N	425.378	1.987	50	20	IDGD	
Cc1onc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)c1C	1831984282	HGRFJSIZJIMPTF-PXAZEXFGSA-N	430.299	1.145	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)C3CCC(CO)CC3)CCO2)C1	1832523165	NMJHZKJNERDNHG-YHRBYZFPSA-N	447.370	1.025	50	20	IDGD	
Cc1cc(C)n(CC(=O)N2CCO[C@@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)n1	1833034759	KEGXMYNLBUVEMO-FQEVSTJZSA-N	426.945	1.221	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@]3(F)CCCC=C3F)CC2)CC1)[C@@H](O)CCl	1833313619	NCUGNEDMVRKSDZ-OXJNMPFZSA-N	433.927	1.903	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)CCc3nc(N)n[nH]3)CC2)CC1	1833533953	VNKJOASIUUYVJW-INIZCTEOSA-N	439.992	1.299	50	20	IDGD	
Cn1cc(C(=O)NC2CCN(C3CCN(C(=O)[C@@](C)(Cl)CCl)CC3)CC2)cn1	1834194462	CHKGGLAAZUWMPM-IBGZPJMESA-N	430.380	1.842	50	20	IDGD	
CC(=O)NC1CCN(C2CCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CC2)CC1	1834549492	QXIWUFNDDWZNEZ-KRWDZBQOSA-N	430.977	1.710	50	20	IDGD	
COc1cccc(C(=O)N2CCOC[C@]3(CN(C(=O)CCBr)CCO3)C2)c1	1834824248	ZWHVPSIIDQRWLA-IBGZPJMESA-N	441.322	1.550	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)N1CCC(N2CCC(NC(=O)[C@@H](F)Cl)CC2)CC1	1835083712	RKTRYLFVMCYOOI-MRXNPFEDSA-N	434.940	1.617	50	20	IDGD	
O=C(C#Cc1ccccc1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1835101996	MNBCIZYBEXVEDS-IEBWSBKVSA-N	439.281	1.185	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)c1cnc2ccccn12	1835348570	DJNIFYJQPCFLJU-SFHVURJKSA-N	433.940	1.119	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC(OC2CCN(C(=O)[C@@H]3CNC(=O)C3)CC2)CC1	1836673596	HXICQZVTKVAIPQ-KGLIPLIRSA-N	444.370	1.152	50	20	IDGD	
Cc1cc(C(=O)N2CCC(OC3CCN(C(=O)[C@H](O)CCl)CC3)CC2)n(C(F)F)n1	1836718544	RCWVXRSILCZRPV-MRXNPFEDSA-N	448.898	1.799	50	20	IDGD	
O=C(CCC1CCC1)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1	1836796511	ZRTWDRMCOACWFI-UHFFFAOYSA-N	442.365	1.559	50	20	IDGD	
CCCC(=O)N[C@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](Cl)CCC)C2)C1	1837671017	ZDKRBJGNILOYIS-GQIGUUNPSA-N	431.961	1.155	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)cc1	1838967857	ZOGGKFFDIONFHW-KUHUBIRLSA-N	441.322	1.549	50	20	IDGD	
COC(=O)Nc1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)c1	1839244910	QEMXJYFXFDXZQI-KXBFYZLASA-N	443.859	1.469	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CCCC(F)(F)F)C2)C1	1840030196	CXZJFMCHBIDOQX-WFASDCNBSA-N	445.276	1.959	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CSC3CCCC3)C2)C1	1840030684	SUJKPZBRBGEMCE-RDTXWAMCSA-N	449.411	1.902	50	20	IDGD	
O=C(c1cccc2c1OCC2)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840187777	WMYGKGYGBHFRMQ-IBGZPJMESA-N	429.300	1.495	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)C3CCSCC3)CCO2)C1	1840922371	IEYMVHGFZHKREB-RDTXWAMCSA-N	449.411	1.617	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H](F)C[C@H]1C(=O)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1	1841351129	GVBSOPFNWYLEDK-HZSPNIEDSA-N	433.908	1.137	50	20	IDGD	
O=C(c1cn2ccc(Br)cc2n1)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1	1841351411	PDPDEERHGFMENS-ZDUSSCGKSA-N	441.713	1.514	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@H]2C[C@H](O)CN2C(=O)OC(C)(C)C)C1	1843105027	YYIHTVYETRNPJU-ZNMIVQPWSA-N	429.945	1.578	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC2(CCCN2C(=O)c2ccc(O)nc2)C1	1844764915	NTESAKVKYVDCSS-AWEZNQCLSA-N	438.912	1.736	50	20	IDGD	
CC(=O)N[C@@H](C(=O)N1CCCC12CN(C(=O)[C@@H](C)Br)C2)c1ccc(F)cc1	1845010424	SBPBTHDUMFNFEJ-MLGOLLRUSA-N	440.313	1.990	50	20	IDGD	
Cc1oncc1C(=O)N1CC2(CCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)C1	1845038519	MPTCWQWAGMMULX-UHFFFAOYSA-N	440.504	1.146	50	20	IDGD	
CCC(=O)N[C@@H](C)C(=O)N1CC2(CCCN2C(=O)/C(C#N)=C/c2ccc(F)cc2F)C1	1845870305	ACGZMZGTNHSWGR-FSEGOYHTSA-N	430.455	1.990	50	20	IDGD	
C/C=C/C=C\C(=O)N1CCCC12CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2	1845976092	SOXWDCPAIWXTEP-JIJKKIFDSA-N	425.533	1.668	50	20	IDGD	
COC(=O)Nc1cccc(C(=O)N2CC3(CCCN3C(=O)CCC(=O)NN(C)C)C2)c1	1846385392	AKEQNKABFVRKCI-UHFFFAOYSA-N	431.493	1.055	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)C[C@@H](O)CNC(=O)OC(C)(C)C	1847870162	NBGLHYXAFJUCGZ-WCVJEAGWSA-N	431.961	1.871	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)c2ccccc2c1=O	15720984	PUZJVSGPPWMLCL-CQSZACIVSA-N	443.504	1.825	50	20	IDGD	
COC(=O)c1ccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc1	17455829	ADSDSRQJFGOGQV-UHFFFAOYSA-N	431.470	1.333	50	20	IDGD	
Cc1ccsc1C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	25166085	FZQCBLCVUXQMFH-UHFFFAOYSA-N	437.543	1.471	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)[C@H](C)NC(=O)c2cccs2)c2ccccc2c1=O	105452043	IBLYHVHPUPWKIB-LBPRGKRZSA-N	427.486	1.448	50	20	IDGD	
CC(C)Oc1ccc(NS(=O)(=O)CC(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1	108659954	HBTNIKAPUZNZEG-UHFFFAOYSA-N	449.485	1.448	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)CCNC(=O)c2ccc(C)cc2O)cc1	726379890	UUGNHIWJJBLGAP-OAHLLOKOSA-N	429.473	1.834	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)N[C@H](C)c1cccc(S(=O)(=O)NC)c1	727608065	KOPBXTAGPOEMLI-CQSZACIVSA-N	434.518	1.628	50	20	IDGD	
COc1ccccc1CN1CCN(CC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)CC1	728056013	XAPFLEBOPPCKIB-UHFFFAOYSA-N	427.461	1.182	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)CCc3cccc(F)c3F)cc2)CC1	728213927	HELJPRMOODRBSY-UHFFFAOYSA-N	438.500	1.977	50	20	IDGD	
O=C(COC(=O)CCOc1ccc(Cl)cc1)NNC(=O)[C@H]1COc2ccccc2O1	728328814	MDRCLDQBUNPZST-QGZVFWFLSA-N	434.832	1.640	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)c2ccccc2)cc1NC(=O)c1ccccn1	728501206	BLCFUDNQBAGMLB-UHFFFAOYSA-N	426.454	1.966	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(S(=O)(=O)NNC(=O)c2cccc(OC(F)F)c2)c1	728510918	YBNCCARPQIMPNT-UHFFFAOYSA-N	449.457	1.162	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)C(C)(C)c2ccc3c(c2)OCCO3)n1	728734210	XJLUBJHIHYUVQR-UHFFFAOYSA-N	433.486	1.434	50	20	IDGD	
O=C(NNC(=O)N1CCCN(c2nccs2)CC1)C1CCN(c2ncccn2)CC1	728959760	PCMABAHEFDIAQL-UHFFFAOYSA-N	430.538	1.103	50	20	IDGD	
O=C(NC[C@H](c1ccco1)N1CCCCC1)NNC(=O)C1CCN(c2ncccn2)CC1	729044189	IWPYJUDSMYESMK-GOSISDBHSA-N	441.536	1.844	50	20	IDGD	
CN(C)[C@@H](CNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)c1cccc(F)c1	729045216	ROXAWVRYVZTISN-SFHVURJKSA-N	429.500	1.465	50	20	IDGD	
CC[C@H](N=c1nn[nH]n1-c1ccccc1)C(=O)NNC(=O)Cc1ccc2ccccc2c1	729521779	BHRMQXPJUYSHLB-FQEVSTJZSA-N	429.484	1.818	50	20	IDGD	
CS(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)Cn2ccc3ccccc32)c(F)c1	729667634	USTVJKXPNWUWCA-UHFFFAOYSA-N	440.478	1.162	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCCOc2ccc(F)c(F)c2)c2ccccc2c1=O	730128953	LXZONWQIFFCEJG-UHFFFAOYSA-N	431.399	1.718	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(C(=O)NNC(=O)COc2ccccc2O)ccc1Cl	730780725	UEOWFULNQNTORU-UHFFFAOYSA-N	427.866	1.136	50	20	IDGD	
Cc1c(C(=O)OCC(=O)NNC(=O)c2ccccc2)nnn1-c1ccc(OC(C)C)cc1	731378468	OHDAFTDTBMIHCB-UHFFFAOYSA-N	437.456	1.981	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H]2CCOc3ccc(F)cc32)c1	731760712	WYDYGCOOZSOFFC-INIZCTEOSA-N	436.465	1.544	50	20	IDGD	
C[C@]1(c2ccc(CNC(=O)NNC(=O)c3cnn(-c4ccccc4)c3)cc2)NC(=O)NC1=O	733648189	USGJXFYBTZRILZ-JOCHJYFZSA-N	447.455	1.071	50	20	IDGD	
O=C(NCCN1C(=O)CNC1=O)C(=O)Nc1ccccc1S[C@@H](Cl)C(F)(F)F	733671445	VEZRHLTXHFRCOE-CYBMUJFWSA-N	438.815	1.512	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NC[C@@H](C)Oc2ccccc2)cc1	733850541	VZJQMUAXSOJPQO-MRXNPFEDSA-N	434.518	1.413	50	20	IDGD	
COc1cc(F)c([C@H](C)NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1OC	734009700	AZNBWBIUVCYVFK-ZDUSSCGKSA-N	446.483	1.941	50	20	IDGD	
O=C(NNc1cnccn1)C1CCN(S(=O)(=O)c2ccc3c(c2)OCCCO3)CC1	734243839	APEBDSLYTCSONB-UHFFFAOYSA-N	433.490	1.182	50	20	IDGD	
O=C(NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1)N[C@@H]1CCN(C2CC2)C1	734286080	YTNREBGZPOWAJY-CYBMUJFWSA-N	449.558	1.730	50	20	IDGD	
O=C(Cn1nnc(C2(NC(=O)c3ccccc3)CCCC2)n1)NNC(=O)c1cccs1	734983167	YXYXFHJPWRNLCQ-UHFFFAOYSA-N	439.501	1.395	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CSc2nnc(N3CCOCC3)s2)cc1C	735979812	SCBYJDJXKWLLID-UHFFFAOYSA-N	427.577	1.860	50	20	IDGD	
COC(=O)c1cc(Br)cc(S(=O)(=O)NNC(=O)c2ccc(C#N)cc2)c1	736063810	WKPSNMAFVGMIAZ-UHFFFAOYSA-N	438.259	1.731	50	20	IDGD	
O=C(NNC(=O)N1CCN(C(=O)N2CCCCC2)CC1)c1cc(Br)c[nH]1	736650571	XABIIAGLQGFMJG-UHFFFAOYSA-N	427.303	1.355	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)c2ccnc(-n3cccn3)c2)cc1	739676098	OCUDTCQGNDZPBO-UHFFFAOYSA-N	434.485	1.763	50	20	IDGD	
CC(C)(C)Cc1nc(-c2ccc(C(=O)NNC(=O)N[C@H]3CCS(=O)(=O)C3)cc2)no1	741671532	HKBSXJYXRMLDKQ-AWEZNQCLSA-N	435.506	1.456	50	20	IDGD	
O=C(CCn1nc(O)c2ccccc2c1=O)NNC(=O)c1cccc(Br)c1	742769088	KEQSOPNIHCFKMV-UHFFFAOYSA-N	431.246	1.716	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NC[C@@H]2CCN(c3ccccc3)C2)cc1	743552501	UKRORFWVRPIZNR-HNNXBMFYSA-N	431.518	1.952	50	20	IDGD	
O=C(NNC(=O)N1CCn2c(Cc3ccccc3)nnc2C1)c1cnn(-c2ccccc2)c1	743609238	RNSWCEULCIGSMS-UHFFFAOYSA-N	442.483	1.925	50	20	IDGD	
CCOc1ccc(N2C(=O)c3ccc(C(=O)NNC(=O)C(=O)NC(C)C)cc3C2=O)cc1	744446948	PVRHIAWMWDENRX-UHFFFAOYSA-N	438.440	1.172	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@H](C)C(=O)OC(C)C)c1	745905807	NMFGJIOXLLZMGN-AWEZNQCLSA-N	442.538	1.249	50	20	IDGD	
COc1cc2c(cc1CNC(=O)NNC(=O)c1nn(C)c(=O)c3ccccc13)O[C@@H](C)C2	746348397	XNCKONBTASMOFR-LBPRGKRZSA-N	437.456	1.410	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)c1ccc(F)c(S(=O)(=O)N2CCCC2)c1	746550788	VGHCBHMJHWZTNX-UHFFFAOYSA-N	445.476	1.262	50	20	IDGD	
Cn1ccnc(NNC(=O)c2ccc(Cl)c(S(=O)(=O)N3CCCCCC3)c2)c1=O	747938700	XZJVKQIAJLURFB-UHFFFAOYSA-N	439.925	1.755	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCCC(=O)N2CCCCCC2)c2ccccc2c1=O	748463635	ZBYOOACYJUZTDS-UHFFFAOYSA-N	428.493	1.153	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)NCc1cccc(NC(=O)c2ccc(F)cc2)c1	748617233	JNKHEOZLBDVFHZ-CQSZACIVSA-N	432.452	1.960	50	20	IDGD	
Cc1nn(C)c(Cl)c1C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	748618321	BUCPSXYIMUKFOD-UHFFFAOYSA-N	426.930	1.075	50	20	IDGD	
O=C(NCc1cccc(COCC(F)(F)F)c1)NNC(=O)c1ccc(-n2cnnn2)cc1	749767669	CMWGSZHXXLAKGR-UHFFFAOYSA-N	449.393	1.885	50	20	IDGD	
O=C(CCN1C(=O)COc2ccccc21)NNc1nc(Br)cn2ccnc12	750247671	QVRMEFWFAQNQKF-UHFFFAOYSA-N	431.250	1.751	50	20	IDGD	
CC(C)NC(=O)C(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	750873684	VNGDGJMLMWICSY-SFHVURJKSA-N	426.473	1.196	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)NNC(=O)c2cc(C)n(-c3ccccc3)c2C)c(C)o1	751298035	WBAFVNOEQYGMHK-UHFFFAOYSA-N	430.486	1.978	50	20	IDGD	
CO[C@@H](C)c1nc(CNC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)cs1	752356217	LBOKDHUXPHMOFP-NSHDSACASA-N	440.551	1.596	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1ccccc1-n1ccnn1	752491031	VZEDSUHTOQXCLN-UHFFFAOYSA-N	428.474	1.045	50	20	IDGD	
CSCC[C@@H](NC(=O)c1ccccc1)C(=O)NNc1nc2ccccc2c(=O)n1C	752901888	HBYOQFWXSRCNGO-QGZVFWFLSA-N	425.514	1.928	50	20	IDGD	
CCOC(=O)c1ccc(N2CC(NC(=O)NNC(=O)[C@@H](C)Oc3ccc(F)cc3)C2)nc1	753279828	OMKGZCZPXZQUDQ-CYBMUJFWSA-N	445.451	1.384	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N(C)CC[C@H](C)O)cc1	756959838	UWEDYTOSINSMBD-ZKMNFCBKSA-N	425.489	1.570	50	20	IDGD	
CC[C@@H]1CN(CC(=O)NNC(=O)c2cccc(C#N)c2)CC[C@H]1NC(=O)OC(C)(C)C	757113858	ZSZLWTNYTBYGMQ-SJLPKXTDSA-N	429.521	1.944	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)NNC(=O)c2ccc(C#N)cc2)cc(S(C)(=O)=O)c1	757609086	LXGFEFRJXHWGSH-UHFFFAOYSA-N	430.442	1.605	50	20	IDGD	
CN(NC(=O)c1cnn(-c2ccccc2)n1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758786054	IUKFCXWXIWRGNH-UHFFFAOYSA-N	429.481	1.517	50	20	IDGD	
CCCC(=O)N1CCCC[C@@H]1C(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758786532	NDVUSUJOAMOCIZ-MRXNPFEDSA-N	439.557	1.803	50	20	IDGD	
CC(C)C(=O)N1CCC(C(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)CC1	758787651	UTWWOYWSXHDLRQ-UHFFFAOYSA-N	439.557	1.517	50	20	IDGD	
O=C(NNC(=O)c1ccc(=O)n(Cc2ccccc2Cl)c1)C(=O)Nc1ccccn1	758841866	WNTWTLIJBKHYDM-UHFFFAOYSA-N	425.832	1.345	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)CNS(=O)(=O)c1ccc2c(c1)COC2	759690102	NZSTWXZTERHPCQ-UHFFFAOYSA-N	439.877	1.118	50	20	IDGD	
C[C@@]1(c2ccccc2)CN(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)CCO1	759718758	PEZAUKVTTDTJRD-FQEVSTJZSA-N	431.518	1.582	50	20	IDGD	
O=C(COc1ccc(OCc2ccccc2)cc1)NNC(=O)C(=O)Nc1cnns1	760280234	SSLTZKHDDCJGLF-UHFFFAOYSA-N	427.442	1.282	50	20	IDGD	
CC(C)(C)n1cc(C#N)c(NC(=O)C(=O)NNC(=O)c2ccccc2Br)n1	763482978	PYJQGTQAMKRKIE-UHFFFAOYSA-N	433.266	1.672	50	20	IDGD	
O=C(COc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1cccc(N2CCOC2=O)c1	763686821	VIHFOXIFRVUCGI-UHFFFAOYSA-N	432.820	1.462	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc2c(c1)NC(=O)[C@@H](C)O2	763712414	QGYLFBJTXLBPGT-GFCCVEGCSA-N	426.429	1.133	50	20	IDGD	
CC(C)c1cccc(NC(=O)C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1	763718909	RZCWXILMQOPVPF-UHFFFAOYSA-N	432.502	1.460	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)CC23CC4CC(CC(C4)C2)C3)ccc1-n1cnnn1	763738484	UQUIUBFDDXFEDP-UHFFFAOYSA-N	437.504	1.663	50	20	IDGD	
CC(C)OCc1cccc(NC(=O)C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c1	763785093	DJIRLXWOAXIPBW-UHFFFAOYSA-N	437.456	1.258	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2ccccc2CSC)c2ccccc2c1=O	763787104	VYNAKFLHRWYODV-UHFFFAOYSA-N	439.497	1.679	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(C(=O)N3CCCCC3)c2)cc1	763809340	NOPMHDPYHGGPLB-UHFFFAOYSA-N	438.484	1.786	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccnn1Cc1ccccn1	763848640	DWBBQIXDZPWKAL-ZDUSSCGKSA-N	426.408	1.019	50	20	IDGD	
CC(=O)Nc1c(C)ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)c1C	763850417	NCPKQEHDTJBMNP-CYBMUJFWSA-N	430.436	1.954	50	20	IDGD	
COCCOc1cc(C)ccc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccccc1F	763858481	SVMONHIMSZXFAN-CQSZACIVSA-N	433.436	1.713	50	20	IDGD	
CCN(CC)C(=O)COc1cccc(NC(=O)C(=O)NNC(=O)Cc2ccc(F)cc2)c1	763931578	IJHKQLSBGLVRNT-UHFFFAOYSA-N	444.463	1.402	50	20	IDGD	
CS(=O)(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCCCC3)c1	763962175	MXXNSNOOMOWQLA-UHFFFAOYSA-N	449.554	1.961	50	20	IDGD	
O=C(NNC(=O)c1cc(Cl)ccc1O)C(=O)Nc1cccc(CN2CCCCC2=O)c1	763973664	DTIISSGDCILMFT-UHFFFAOYSA-N	444.875	1.958	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2cc(Br)cn2C)cc1OC	764002151	JMAMVAZIKQMOQU-UHFFFAOYSA-N	425.239	1.205	50	20	IDGD	
COc1cc(OC)c(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2OC)cc1F	764019076	GARIZULLDHVEQD-UHFFFAOYSA-N	425.800	1.905	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccccc1	764048320	XQBBAJPCKPAAMZ-INIZCTEOSA-N	449.554	1.875	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc4c(c3)oc(=O)n4C)n[nH]2)cc1	764111675	OTBKZEFBRVXCBS-UHFFFAOYSA-N	434.412	1.230	50	20	IDGD	
COC(=O)c1ccc(OC(C)C)c(NC(=O)C(=O)NNC(=O)c2cccc(OC)c2O)c1	764132114	JWJZSPKKWCWNJE-UHFFFAOYSA-N	445.428	1.374	50	20	IDGD	
Cc1nn(-c2ccc(C#N)cc2)c(NC(=O)C(=O)NNC(=O)COc2ccccc2O)c1C	764280944	UWARNMKLPNNQDV-UHFFFAOYSA-N	448.439	1.231	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)C(=O)Nc1cccn(Cc2ccccc2)c1=O	764289959	ZYHPHRBREAEGJQ-UHFFFAOYSA-N	434.452	1.321	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2ccc(F)c(I)c2)C[C@H](C)O1	764321391	UUTNEBNJSVESKC-QWRGUYRKSA-N	449.264	1.691	50	20	IDGD	
Cn1ccnc1Sc1ccc(NC(=O)C(=O)NNC(=O)COCc2ccccc2)cc1	764366883	QBCGJJUKPCQTHM-UHFFFAOYSA-N	439.497	1.874	50	20	IDGD	
CNC(=O)c1ccc(C)c(NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)c1	764377363	OGAHVHKDEHUFHL-UHFFFAOYSA-N	426.458	1.206	50	20	IDGD	
Cn1c(=O)c2c(ncn2CC(=O)NN=Cc2ccc(-c3ccc(Cl)cc3)o2)n(C)c1=O	764813273	XWLWBPLYNVKNHG-UHFFFAOYSA-N	440.847	1.497	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)c1ccc(S(=O)(=O)NC2CC2)cc1	765314377	YUIMFELHHQRJDH-UHFFFAOYSA-N	440.522	1.193	50	20	IDGD	
O=C(CCOc1ccccc1Cl)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765738544	LTTRDIITWGKLHL-UHFFFAOYSA-N	444.919	1.714	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)cc1	765753432	XZXWIROPJVHSPF-UHFFFAOYSA-N	441.919	1.556	50	20	IDGD	
O=C(CCCn1ccccc1=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	766661145	RYBCRJUEHSTWPE-UHFFFAOYSA-N	445.951	1.247	50	20	IDGD	
COc1ccc(Cc2nnc(SCC(=O)NNC(=O)Cc3ccccc3C)n2N)cc1	767901809	YVSZGVCYAPWYCF-UHFFFAOYSA-N	440.529	1.382	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)[C@@H]3CC(=O)N(Cc4ccccn4)C3)n[nH]2)c1	768278859	OSFJTKCPPFQAMS-MRXNPFEDSA-N	432.484	1.898	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)/C(=C/c1ccccc1)n1nnnc1C	768631095	ZKQNPQSBMNKLDB-QINSGFPZSA-N	428.474	1.535	50	20	IDGD	
Cc1ccc(NC(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)cc1S(N)(=O)=O	770035947	YNFJHPWWFQPPEE-UHFFFAOYSA-N	434.446	1.787	50	20	IDGD	
CCOCCCn1c(NNC(=O)c2cnc3c(c2)NC(=O)CO3)nc2ccccc2c1=O	770754066	POLYUJJOLAGPKQ-UHFFFAOYSA-N	438.444	1.306	50	20	IDGD	
NC(=O)CCOc1ccc(NC(=O)C(=O)NNc2ccc(Br)c(F)c2)cc1	770815752	MXSGEGFBPDNUCM-UHFFFAOYSA-N	439.241	1.924	50	20	IDGD	
CC(=O)[C@@H]1CC(C(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)=NN1c1ccccc1	770958098	IDSAATPCBUDDAL-INIZCTEOSA-N	436.476	1.954	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)CCN3CCN(c4ccccn4)CC3)nc21	770968299	URACPCJAXZYYRC-UHFFFAOYSA-N	439.524	1.337	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2cnc3sc(C)cn3c2=O)c2ccccc2c1=O	771607460	XQJDONOTJDYROX-UHFFFAOYSA-N	438.469	1.259	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)[C@@H]1CCCN1C(=O)c1ccc2c(c1)OCO2	772066633	ZLOMKYHPEPHHEI-ZFWWWQNUSA-N	433.461	1.145	50	20	IDGD	
C[C@@H]1CN(c2ccnc(C(=O)NNC(=O)C(=O)NCc3ccc(Cl)cc3)c2)C[C@@H](C)O1	772517863	KJBTVDDGUVUCHZ-ZIAGYGMSSA-N	445.907	1.426	50	20	IDGD	
O=C(CCC(=O)N1CCc2sccc2C1)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772899140	YZHSQMGWMJTWNG-UHFFFAOYSA-N	448.932	1.530	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)c1sccc1S(=O)(=O)N(C)C	772955472	UQVZHQCVJPDKOD-JTQLQIEISA-N	431.923	1.880	50	20	IDGD	
COCCNC(=O)c1ccc(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2)cc1Cl	773642853	GQMOISRJSDAVGI-UHFFFAOYSA-N	435.824	1.706	50	20	IDGD	
O=C1CN(c2ccc(NC(=O)C(=O)NNc3ccc([N+](=O)[O-])cc3)cc2Cl)CCN1	773645085	TUNAIWIWQZZCKF-UHFFFAOYSA-N	432.824	1.266	50	20	IDGD	
COC(=O)c1ccc(N2CCCC2)c(NC(=O)C(=O)NNC(=O)c2ccc(C)c(F)c2)c1	773889038	LCYMBWCSRONWAR-UHFFFAOYSA-N	442.447	1.921	50	20	IDGD	
C[C@H](NCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)c1ccc(N2CCOC2=O)cc1	775266824	MFMPQOXJHYVBJU-ZDUSSCGKSA-N	427.417	1.663	50	20	IDGD	
CCC(CC)n1nc(C)cc1C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	775642860	IOXYHFLURDETTC-UHFFFAOYSA-N	427.914	1.928	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)Nc2ccc(C[C@@H]3NC(=O)NC3=O)cc2)c1	775704183	AEOAOOIPRGKDST-INIZCTEOSA-N	425.445	1.286	50	20	IDGD	
COCCO[C@H]1COCC[C@H]1NC(=O)CCC(=O)C(C#N)=C1N(C)c2ccccc2N1C	777395198	UYJDELJKBYMWDQ-UTKZUKDTSA-N	442.516	1.594	50	20	IDGD	
CCNC(=O)N(C)NC(=O)CN1CCN(Cc2ccc(Br)cc2F)CC1	780708510	FZMPWGMLPBXOCN-UHFFFAOYSA-N	430.322	1.398	50	20	IDGD	
C=CCn1c(=O)c2ccccc2n2c(SCC(=O)NNc3cccc(OC)n3)nnc12	780772582	FRQIDNJPEVIXNK-UHFFFAOYSA-N	437.485	1.869	50	20	IDGD	
C[C@@H]1C(=O)CC[C@H](C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)C1(C)C	780951593	ZTRCOHOURCOFOL-CRAIPNDOSA-N	436.578	1.707	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2ccc(-c3cn4ccccc4n3)cc2)CCS(=O)(=O)C1	783428455	WNBFJGUYFOWPEL-HXUWFJFHSA-N	427.486	1.138	50	20	IDGD	
COc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)C(=O)NNc1cccc2c1CCCC2	783454586	GVVSBIPAKOCPEZ-UHFFFAOYSA-N	446.529	1.906	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1ccc(Oc2ccccn2)cc1	784003224	BZNMERKUCREUQB-UHFFFAOYSA-N	439.453	1.451	50	20	IDGD	
CCOc1cc(N2CCN(C)CC2)ccc1NC(=O)C(=O)NNc1ncccc1Cl	784816476	YTHZFOFFIJRAGX-UHFFFAOYSA-N	432.912	1.967	50	20	IDGD	
O=C(NNc1ccnc(Br)c1)C(=O)Nc1ccc2nc3n(c(=O)c2c1)CCC3	784828461	IMUFTHWJIDEQJV-UHFFFAOYSA-N	443.261	1.582	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1cccc(NC(=O)C(=O)NNc2cccc([N+](=O)[O-])c2)c1	784833793	PIORYZKBYHAVBX-UHFFFAOYSA-N	435.462	1.753	50	20	IDGD	
COCCS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccc(Cl)c(F)c2)cc1	785179809	QOYYGRYQDHYYMB-UHFFFAOYSA-N	429.857	1.981	50	20	IDGD	
Cn1nc(-c2ccsc2)cc1NC(=O)C(=O)NNC(=O)CN1CCCc2ccccc21	787541050	JYUGFGXXPORIGZ-UHFFFAOYSA-N	438.513	1.687	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(C(=O)Nc2cccc(NC(=O)NN(C)C)c2)cc1	788263356	YQKFMSJLQRTZTI-UHFFFAOYSA-N	435.506	1.462	50	20	IDGD	
C[C@H]1C[C@@H](C)C[C@]2(C1)NC(=O)N(CC(=O)NNc1nnc(-c3ccccn3)s1)C2=O	788557992	DQPPIULRNRBZQI-SLAYPKMVSA-N	429.506	1.790	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)C(=O)Nc1nc2c(s1)CCCCC2	789731150	DJAJQZOKICSSRI-UHFFFAOYSA-N	440.485	1.703	50	20	IDGD	
CCn1c(=O)c(C(=O)/C(C#N)=C\c2cn(C(C)(C)C)nn2)c(N)n(Cc2ccccc2)c1=O	790216722	TYOHZPGEEYDZJK-WJDWOHSUSA-N	447.499	1.797	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2nnn(Cc3ccc(F)cc3F)c2C)cc1C	791090429	JRMZRNTYKRCUPT-UHFFFAOYSA-N	442.426	1.930	50	20	IDGD	
CCN(CC)C(=O)COc1cccc(NC(=O)C(=O)NNc2nc3ccccn3n2)c1	792393769	GCUGWTPUAHNYHX-UHFFFAOYSA-N	425.449	1.058	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN([C@H]2CCN(CC(=O)NNC(=O)c3ccc(F)cc3)C2)CC1	796614331	NPIXFGAARWLHGS-SFHVURJKSA-N	449.527	1.214	50	20	IDGD	
CC(F)(F)c1cccc(NC(=O)C(=O)NNC(=O)CNC(=O)OCc2ccccc2)c1	797369000	LMPNCLZRMUDYGK-UHFFFAOYSA-N	434.399	1.811	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H](O)[C@@H](O)c2nc3ccccc3s2)cc1C	798308368	WWDOWPSIEHCIPC-HZPDHXFCSA-N	428.470	1.094	50	20	IDGD	
CSC[C@@H](C)C(=O)N1CCC(C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)CC1	799298049	SVZVZTVYZQKPKK-ZIAGYGMSSA-N	425.526	1.978	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)/C(=C/c2cccnc2)NC(=O)c2ccccc2)cc1	801109588	UUDRQKYLYHYBNQ-ZHZULCJRSA-N	443.463	1.947	50	20	IDGD	
Cc1c(C)c(C)c(S(=O)(=O)NCCC(=O)NNC(=O)N=c2cc[nH]cc2)c(C)c1C	802022746	GOZHKUHUVHGSKV-UHFFFAOYSA-N	433.534	1.567	50	20	IDGD	
COc1ccc(Cl)c(NC(=O)NNC(=O)c2cccc([C@@]3(C)NC(=O)NC3=O)c2)c1	802114724	DEQWRMVNHUBAJT-LJQANCHMSA-N	431.836	1.870	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NN=Cc2c(C)nn(-c3ccccn3)c2C)cc1	802705812	SZXFBXVTISPMEW-UHFFFAOYSA-N	440.529	1.963	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)[C@](C)(O)C3CC3)c2)cc1	804146379	RGYQMYCMPZXWKG-HXUWFJFHSA-N	433.486	1.418	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)[C@H]1CCN(c2ccccc2Br)C1=O	804952378	LASKYEWSNKKOLR-GFCCVEGCSA-N	442.277	1.921	50	20	IDGD	
CS(=O)(=O)N1CC(CNC(=O)NNc2ccc(-c3cccc(C(F)(F)F)c3)nn2)C1	805314569	MNHPAXDNUCGUSM-UHFFFAOYSA-N	444.439	1.680	50	20	IDGD	
Cc1cc([N+](=O)[O-])ccc1NNC(=O)Nc1cnn(CC(=O)N2C[C@@H](C)O[C@H](C)C2)c1	806326129	LOKKTOLGBACIEC-ZIAGYGMSSA-N	431.453	1.884	50	20	IDGD	
O=C1COC[C@H](C[C@H]2CN(C(=O)C(=O)NNc3ccc(Cl)cc3)c3ccccc32)N1	806997376	MEADSNYJRUQNFR-BBRMVZONSA-N	428.876	1.819	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NNC(=O)c2cc([N+](=O)[O-])c(F)cc2N)C1	808011632	ZMQBBDHMSZZAOF-SNVBAGLBSA-N	425.417	1.724	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(Br)s1)NNc1nc2ccccc2[nH]1	810792544	CFZDNNQWSUDUCY-UHFFFAOYSA-N	430.309	1.809	50	20	IDGD	
Cc1cc(C)c(C)c(S(=O)(=O)NCC(=O)NNc2ccc(-n3ccnc3)nn2)c1C	811455553	LLSPWKDGHLTLEC-UHFFFAOYSA-N	429.506	1.318	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)[C@@H]2CCN(c3ccc(C#N)cc3F)C2)cc1	812733244	KSKVFRJSFIXCJG-OAHLLOKOSA-N	431.493	1.917	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)Cc2c(F)cc([N+](=O)[O-])cc2F)cc1	813576087	KVTNQGDFYDEFHF-UHFFFAOYSA-N	428.373	1.672	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@H](F)C[C@H]1CNC(=O)NNC(=O)Cc1cn2ccccc2n1	813814598	SDLLBQDTUDCMOA-ZFWWWQNUSA-N	434.472	1.555	50	20	IDGD	
CCC(CC)(CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)OC	813870933	HZNBKVNBIWDAGE-UHFFFAOYSA-N	426.539	1.620	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)C(=O)Nc1cc(Cl)ccc1I	815566665	AZYUZKOFKNUKST-UHFFFAOYSA-N	446.632	1.683	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCc2nncn2C1)C(=O)Nc1ccccc1Sc1ccccc1	815691995	HBNFENXRVLQYAA-CQSZACIVSA-N	436.497	1.778	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)c1nnn(-c2ccccc2F)c1C(F)(F)F	819727435	FMYATSUPIWAVAK-UHFFFAOYSA-N	433.362	1.975	50	20	IDGD	
CSC[C@H](C(=O)NNC(=O)COc1ccc(C)cc1)N1C(=O)[C@@H]2CCCC[C@H]2C1=O	901472738	HMFZWVFZYCSHQM-BRWVUGGUSA-N	433.530	1.428	50	20	IDGD	
Cc1ccc(C)c(N2N=C(C(=O)NNC(=O)CCN3C[C@H](C)O[C@H](C)C3)CCC2=O)c1	912919880	SGOYBLALYREDDQ-CALCHBBNSA-N	429.521	1.433	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)CNS(=O)(=O)c2cccc(F)c2)cc1OC	913069787	JIRKBZCIZGUVDT-UHFFFAOYSA-N	439.465	1.363	50	20	IDGD	
N#C/C(=C\c1cn(CCC(N)=O)nc1-c1ccc(Br)cc1)C(=O)OCCO	914328222	JRVISPAAJZASPC-UKTHLTGXSA-N	433.262	1.630	50	20	IDGD	
O=C(CCOC[C@H]1CCCO1)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	915618289	FICFIPNEZMUEBM-QGZVFWFLSA-N	439.534	1.208	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)c2cccc(S(=O)(=O)NC[C@@H]3CCCO3)c2)cc1	915774472	SYRAAPNPRBLMCO-SFHVURJKSA-N	447.513	1.292	50	20	IDGD	
O=C(CN1CCN(c2c(F)c(F)c(F)c(F)c2F)CC1)NNC(=O)c1ccccc1	916149850	ILFURANSFMGBDL-UHFFFAOYSA-N	428.361	1.965	50	20	IDGD	
Cn1ccnc1[C@@H](NC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)c1ccccc1F	916223613	BRYUTSOYSCGQOV-KRWDZBQOSA-N	445.476	1.696	50	20	IDGD	
COc1ccccc1[C@@H](NC(=O)NNC(=O)COc1ccccc1C#N)c1nccn1C	916229014	RHAASYRAJSDSCQ-HXUWFJFHSA-N	434.456	1.799	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)NCCc2cn3c(n2)CCCC3)c2ccccc2c1=O	916578270	BLMLZSOUDRKISN-UHFFFAOYSA-N	437.504	1.697	50	20	IDGD	
O=C(NCc1cnn(Cc2ccccc2)c1)NNC(=O)c1csc(N2CCOCC2)n1	916579637	ICNHUDVIYNDKDE-UHFFFAOYSA-N	441.517	1.369	50	20	IDGD	
O=C(CN1CCN(c2cccc([N+](=O)[O-])c2)CC1)NNC(=O)c1ccc([N+](=O)[O-])cc1	917119719	SPIJDGIJEVBKRK-UHFFFAOYSA-N	428.405	1.086	50	20	IDGD	
CON(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(-c3ccc(C)cc3)[nH]n2)c1	917178580	XSXRMTKMODGFEX-UHFFFAOYSA-N	443.485	1.642	50	20	IDGD	
COC(=O)COc1cccc(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c1	917532303	RPWOWMDVJSPMEI-UHFFFAOYSA-N	440.500	1.212	50	20	IDGD	
Cc1cc(C)cc(N2CC[C@H](C(=O)NNC(=O)c3csc(N4CCOCC4)n3)C2=O)c1	919690112	JEZUSJDBXRLTDA-MRXNPFEDSA-N	443.529	1.411	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)N[C@@H](C)c1ccc(OCC(=O)NC2CC2)cc1	919904364	JAUKJZFUQFWORT-HNNXBMFYSA-N	440.500	1.987	50	20	IDGD	
COc1ccc(C)cc1C1(CNC(=O)NNC(=O)Cn2nc(C)cc2C)CCOCC1	919924393	XJOIOGCZGHPFNS-UHFFFAOYSA-N	429.521	1.896	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)c1cccc(NC(=O)CCn2ccnc2)c1	920093580	YVCRTLNCHJHAHT-UHFFFAOYSA-N	431.456	1.943	50	20	IDGD	
Cn1cc(/C=C(\C#N)C(=O)c2c(N)n(C)c(=O)n(C)c2=O)c(-c2cc3ccccc3o2)n1	920397645	BVYGLRLXKKZQQD-MDWZMJQESA-N	430.424	1.603	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)NCc1cccc(OCCN2CCOCC2)c1	920920966	SZNHBOLXZAFDMK-UHFFFAOYSA-N	446.479	1.446	50	20	IDGD	
O=C(NNC(=O)[C@H]1CS[C@@H](Cc2ccccc2F)C(=O)N1)c1cccc([N+](=O)[O-])c1	935812231	ICUFFJRRLOKURZ-CVEARBPZSA-N	432.433	1.338	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)C2(O)Cc3ccccc3C2)c2ccccc2c1=O	1318851771	VLGPRQKPNWWCRD-UHFFFAOYSA-N	434.496	1.878	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2nc3ccccc3[nH]2)C1	1778472395	ILXUSCQBQRUCGD-AVBTWRTFSA-N	434.924	1.944	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cn4cc(F)ccc4n3)C2)C1	1778542167	KRPUDIKNDPFWNX-KPZWWZAWSA-N	439.285	1.700	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C=N/N2CCCCC2)C1	1779363929	NXRICFXZXXYYJL-QEORTHCHSA-N	428.961	1.226	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)Nc2ccccn2)C1	1779566720	KXLUFUPQCHEHMQ-KYFSNAEOSA-N	438.956	1.650	50	20	IDGD	
O=C(c1cnc(-c2ccccc2)s1)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1779750286	IJHGOUDLLFAZNK-YWZLYKJASA-N	435.933	1.853	50	20	IDGD	
C=C(CC(=O)OCC)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CO[Si](C)(C)C)C2	1780738688	WRNAFSZVGZAQTB-DYESRHJHSA-N	440.613	1.861	50	20	IDGD	
O=C(CC(=O)N1CC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2)Nc1ccc(F)cc1	1780883664	LSONXIJUIRDKQV-SFHVURJKSA-N	432.279	1.788	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)[C@@H]3CCc4nc[nH]c4C3)CCO2)C1	1781231882	BBHHBKCGABSXCB-ZNZDAUKMSA-N	429.348	1.581	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCc2cnccn2)C1	1782578638	SJWNJIDLFBZMDP-IDHHARJASA-N	439.354	1.707	50	20	IDGD	
CO[C@H](C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](C)Br)C2)C1)c1ccccc1	1783532872	ONBHTGVEPRGRHQ-ALKREAHSSA-N	425.323	1.987	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)Cn3cnc4ccccc43)C2)C1	1783752934	UQCPNHRSDYYPJG-IFXJQAMLSA-N	435.322	1.650	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)Cc3ccc4ncccc4c3)CCO2)C1	1783870943	JWBNWLDSEJKFNN-XMSQKQJNSA-N	431.920	1.861	50	20	IDGD	
CCc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]3C2)n(C)n1	1783969186	FLMKUVQJPOAYID-RMRKRWHISA-N	441.370	1.607	50	20	IDGD	
CC#C[C@H](CC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](Cl)COC)CCO2)c1ccc(O)cc1	1784019190	CCPHBQRMBSJCPM-QMHWCDLVSA-N	448.947	1.973	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3csc4c3CCCC4)C[C@@H]21)[C@H](O)CCl	1784092143	HTWALZOQZHRBJW-SDNTUTLCSA-N	426.966	1.820	50	20	IDGD	
CC(=O)N[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)Br)C[C@@H]21)C(C)(C)C	1784310532	FGLJKMPXHBPEQE-YDMUCJKGSA-N	446.386	1.300	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3ccc(F)nc3)C[C@@H]21	1786400990	KYEVPSUKTVUVJV-JYJNAYRXSA-N	442.329	1.918	50	20	IDGD	
Cn1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCBr)C[C@@H]32)c(C(F)F)n1	1787735443	GNDQRPFLZYMKAG-GVXVVHGQSA-N	449.296	1.736	50	20	IDGD	
C[C@H](Br)C(=O)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1	1788143556	MZDULWYKJJDUAM-ZDUSSCGKSA-N	445.122	1.898	50	20	IDGD	
CN(C)c1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]3C2)nc1	1788760905	GCQJJJZDDAQKGR-IEZWGBDMSA-N	434.613	1.592	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc4c3OCC4)C[C@@H]21)[C@H](F)Br	1789922759	MCCAMLIJAHONLA-QEWYBTABSA-N	441.297	1.905	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)ccc3O)C[C@@H]21)[C@H](F)Br	1789923266	BQURCFIJGRQIFL-HLHNXRDNSA-N	431.258	1.382	50	20	IDGD	
Cc1ccc(C(=O)C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](C)Br)[C@H]3C2)cc1	1791063377	GSIJXJOLPCUMGN-HJWJTTGWSA-N	437.334	1.941	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1ccc(C2(NC(=O)CC[C@H](N)C(N)=O)CCC2)cc1	1791434797	ZTEBXXDVKNQJPR-RISCZKNCSA-N	425.327	1.497	50	20	IDGD	
CC(C)N1CCC[C@H]1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21	1791810415	NNGKIUIZKVWHFO-UVPYHEFZSA-N	434.350	1.529	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(Cl)nn1)C2	1792870947	MVZAXSKLXQZJKV-NJBDSQKTSA-N	431.718	1.364	50	20	IDGD	
COc1ncccc1CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2	1794094397	GIZVBBGNNJHGFO-XRGAULLZSA-N	444.301	1.303	50	20	IDGD	
Cc1csc(CCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)c1	1796190829	QACAPFZVHZKDMS-REPLKXPHSA-N	426.347	1.621	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCNc1ccc(C)cc1C	1797827720	XXODQWJJXGFYBT-NYUBLWNDSA-N	437.968	1.949	50	20	IDGD	
COc1ccc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@](C)(Cl)CCl)cn1	1799273810	JMLMHLZBLVCTID-BAAGSCJXSA-N	444.359	1.849	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3sccn3c1)C2)[C@@H](F)Br	1799346303	OYLFSWPMAWVPDI-ZMJPVWNMSA-N	430.299	1.895	50	20	IDGD	
COCCOCCOCCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@](C)(Cl)CCl	1800084390	JZJCIXXWOQGLBG-YYAJDYIMSA-N	439.380	1.931	50	20	IDGD	
C[C@@H](NC=O)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](Br)Cc1ccccc1)C2	1800098895	VCNXLFZWCSDDSR-SOVHRIKKSA-N	436.350	1.765	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CCc2ccccc2O1	1800955019	NRMMFBJLHREVRF-CNGORYIKSA-N	437.334	1.753	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccccc1OC(F)F)C2	1800982727	JVMPFTPLELCNLH-FAXLKDOZSA-N	432.851	1.745	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CCCN1C(C)C	1801573926	FKHIWQSPKLPTNR-BPKGMFCQSA-N	430.387	1.622	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cc3cnccc3[nH]2)[C@@H]1c1cccnc1)[C@H](O)CCl	1803143252	XVTNNUWBVCTBQR-GDIGMMSISA-N	427.892	1.877	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)C#CC2CC2)[C@@H]1c1cccnc1	1803451035	PQNVPCXJBGAQPU-HAXQJHAESA-N	446.511	1.635	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(F)c(F)c(Cl)c1)c1cccc(B(O)O)c1	1803804071	LAORXIIFCXMFDT-MUJYYYPQSA-N	448.662	1.864	50	20	IDGD	
COC[C@H](NC(C)=O)C(=O)N1CCC2(CCCN(C(=O)[C@@H](C)CBr)C2)CC1	1805385302	VYZIWHGFJPKQSL-HOCLYGCPSA-N	446.386	1.400	50	20	IDGD	
C=CCOCCCC(=O)N1CCCC2(CCN(C(=O)c3cccc(B(O)O)c3)CC2)C1	1806013600	CWZHCUPBSDWWEF-UHFFFAOYSA-N	428.338	1.194	50	20	IDGD	
Cc1nnc(CC(=O)NC[C@@H]2CCN(C(=O)CCBr)[C@H]2c2cccnc2)o1	1807467389	MLPOQZDEQQMIEU-KSSFIOAISA-N	436.310	1.807	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H]2[C@H]3COC[C@H]32)[C@@H]1c1cccnc1)[C@@H](F)Br	1808680035	GOLMOTZNVVARPR-KPRKPIBOSA-N	426.286	1.670	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)[C@@H]3[C@@H]4C=CS[C@@H]34)CC2)C1	1809973365	IZKIUMIFIBIBPU-IPMKNSEASA-N	426.347	1.086	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)c3coc(Cl)n3)CC2)C1	1809974854	BRJWWLHARBCUEX-UHFFFAOYSA-N	431.685	1.166	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)n3)C2)CC1	1810888671	HARNSSVDYUQVJV-QGZVFWFLSA-N	431.320	1.969	50	20	IDGD	
C[C@H](C(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1)n1cccc1	1813074998	WPVAPTPXCOFOHY-ZWCUEREDSA-N	440.548	1.523	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)[C@@H](C)n2cncn2)[C@H]1c1cccnc1	1813403017	CYPRKOSJZIKZSF-SJXGUFTOSA-N	435.326	1.724	50	20	IDGD	
C[C@H](C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](F)Br)[nH]n1)n1cncn1	1822768429	GCURNWCTMKVLOX-XWIASGKRSA-N	428.266	1.945	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCS(C)(=O)=O)n[nH]1	1822967583	RRTFRITYLDPYBT-AAEUAGOBSA-N	449.371	1.868	50	20	IDGD	
CC(=O)N(C)CCC(=O)N[C@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1	1823003337	YJFDIRZFJMDTAB-ZANVPECISA-N	435.319	1.614	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)C1=NN(C)C(=O)CC1)CC2	1825636649	YGOBDVIZVJZHGW-BDAKNGLRSA-N	442.339	1.447	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)N[C@H]1CCc2nc(NC(=O)[C@H](C)Br)sc2C1	1825641581	PRWFVKRBOCBJKR-CIUDSAMLSA-N	432.344	1.285	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@H]1CCc2nc(NC(=O)CCn3ccnn3)sc2C1	1826868947	MZNUARKUGBNZMD-MNOVXSKESA-N	441.355	1.768	50	20	IDGD	
Cc1nscc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827056579	ZGOYTTVKOZHOBV-HXUWFJFHSA-N	441.362	1.678	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)Cc2cccnc2)CC1	1827202303	WOONODWMYXGYFM-QFIPXVFZSA-N	435.333	1.237	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H]2CCCOC2)CC1	1828925577	LWMFOLAYHFQPQU-FXAWDEMLSA-N	443.548	1.345	50	20	IDGD	
N#Cc1c[nH]c(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)c1	1829775888	APLOXSBEJFUNJQ-HXUWFJFHSA-N	449.515	1.432	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccnc3)C2)C1	1830537706	MKOKEZJHDBFKKN-KSSFIOAISA-N	426.311	1.183	50	20	IDGD	
Cc1cccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)c1Cl	1830737306	GZZUIAXZHCXRDV-HNAYVOBHSA-N	431.316	1.318	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)Br)C2)C1	1831656376	DRFWMONOPQRQDR-WWGRRREGSA-N	425.751	1.634	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H]3C[C@H]3c3ccccc3)CC2)CC1)[C@@H](O)CCl	1833312876	JXVSBXVCRZGDAC-HBMCJLEFSA-N	433.980	1.961	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)s1	1833422483	VJQRWWUUUTWPCA-IBGZPJMESA-N	442.610	1.678	50	20	IDGD	
Cc1nc(CC(=O)NC2CCN(C3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)c(C)s1	1833868208	CGHGOBKLQCVHND-SFHVURJKSA-N	443.013	1.474	50	20	IDGD	
COc1ncccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1	1834128470	DQQSJPYHZMNBQH-HXUWFJFHSA-N	437.569	1.012	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)C(C)(C)NCCC#N)CC2)CC1	1834717037	JRRHKUSRRVGCTB-SFHVURJKSA-N	442.004	1.094	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3cccc(F)c3)CCO2)C1	1835027542	APJHGAWNVLARAM-IFXJQAMLSA-N	443.313	1.608	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cncn3-c3ccncc3)CC2)CC1)[C@H](F)Cl	1835078725	UHWFSIJZRDREKP-IBGZPJMESA-N	448.930	1.987	50	20	IDGD	
C[C@@H](Nc1ccccn1)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](F)Cl)CC2)CC1	1835084164	OHSPGZHYJGPVMF-RDTXWAMCSA-N	425.936	1.988	50	20	IDGD	
O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)CCC(F)(F)F)CCO2	1835319896	NINOAJGDCKELRL-AWEZNQCLSA-N	431.249	1.570	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cccc(O)n3)CC2)CC1	1837473857	PPXHRBNWSRIQFJ-INIZCTEOSA-N	425.913	1.653	50	20	IDGD	
Cc1cccc(CCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)CO[Si](C)(C)C)CCO3)n1	1837710039	DRWPZVBKGOGTJG-JOCHJYFZSA-N	449.624	1.631	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3Cl)C2)C1	1837715554	WUNWCHXAQLEGNR-LJQANCHMSA-N	441.988	1.657	50	20	IDGD	
COc1ccsc1C(=O)N1CCO[C@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1	1838294407	ATKRSHDFYBYYFC-IBGZPJMESA-N	442.610	1.678	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(OC)cc3O)CCO2)C1	1838889579	XNVBTTAVWXMOHL-JXFKEZNVSA-N	426.897	1.488	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CS[C@@H]3CCCCO3)C2)C1	1839145421	HGDABOQDWFUAMF-WDYCEAGBSA-N	434.986	1.720	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)/C=C/c3cccnc3)C2)C1	1839150742	WHKMSHMCFDDFBT-UVEXCMSLSA-N	442.343	1.788	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C=C/c3cnc[nH]3)C2)C1	1839154975	FBRUXLLKAQGDHW-QBAOTHAWSA-N	431.320	1.116	50	20	IDGD	
O=C(c1cc(F)cc([N+](=O)[O-])c1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1839353799	QRZHNEGDKUVZAN-YOEHRIQHSA-N	433.795	1.338	50	20	IDGD	
CCN(CC)C[C@@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)CCBr)C2)C1	1839675414	CJZHKIWMTWCGIS-APWZRJJASA-N	448.402	1.206	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccccc3O)C2)C1	1840031471	RIPQQAYREIOMHA-SCLBCKFNSA-N	427.295	1.246	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)c3ccc(O)cc3)C2)C1	1840154734	FCEKPCSWKRRAJL-YWMUFLPLSA-N	440.924	1.206	50	20	IDGD	
Cc1cccc(/C=C/C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)n1	1840187043	IPTKAULYJJYYKZ-ZMBJWTFHSA-N	428.316	1.663	50	20	IDGD	
O=C(c1cc(F)cc(Cl)c1)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1	1840708823	DEFLWRVZAARLNS-CRAIPNDOSA-N	435.279	1.149	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@H]1C[C@H](O)CN1C(=O)OC(C)(C)C)C2	1841668526	YZSGFAMIZBWNNU-JYJNAYRXSA-N	443.972	1.968	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC=C(C(=O)N2CCCC23CN(C(=O)[C@H](O)CCl)C3)C1	1841918509	NJDOGYNWNFMQLJ-OAHLLOKOSA-N	427.929	1.357	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2cnc3cc(C)ccn23)C1	1845695681	VJZVRRDXNVTTJU-WGOQTCKBSA-N	447.499	1.594	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC12CN(C(=O)CCn1c(=O)oc3ccccc31)C2	1846175650	KMZQOTBKNXSEIK-ZDUSSCGKSA-N	436.306	1.971	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@]1(F)CCN(C(=O)OC(C)(C)C)C1)C2	1846362515	JBAUFAANLZWGFC-JLTOFOAXSA-N	447.935	1.793	50	20	IDGD	
CC(C)NS(=O)(=O)Cc1ccc(CNC(=O)NNC(=O)Cc2ccc(F)cc2)cc1	10409417	ZHILSWRRIDODGF-UHFFFAOYSA-N	436.509	1.727	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)CCc2nc(-c3ccccc3)no2)c1	21869477	VPZXVQKUUUHHLN-UHFFFAOYSA-N	443.485	1.381	50	20	IDGD	
Cc1cccc(NC(=S)NNC(=O)CN2C(=O)N[C@@](C)(c3ccc(F)cc3)C2=O)c1	28660249	HLMCYMNPNWASRW-FQEVSTJZSA-N	429.477	1.919	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2nn(-c3ccccc3F)c(C)cc2=O)cc1OC	28776754	LWGDUBQLZGGSDE-UHFFFAOYSA-N	426.404	1.772	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2ccccc2-n2cccn2)cc1	117147733	QVVLXWWLBRGBLP-UHFFFAOYSA-N	427.486	1.262	50	20	IDGD	
O=C(NNC(=O)[C@@H]1C[C@H](O)CN1S(=O)(=O)c1ccc(Cl)cc1)c1ccccc1F	725906048	NXJJFAPJTGBJRU-LRDDRELGSA-N	441.868	1.064	50	20	IDGD	
Cc1nc(CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)nc2ccccc12	726610731	KMIZLKCGQFJVDS-UHFFFAOYSA-N	427.490	1.376	50	20	IDGD	
O=C(NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)C(=O)c1ccc(Cl)cc1	727099477	WZDLZYMBWWAUSH-UHFFFAOYSA-N	435.889	1.768	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNS(=O)(=O)c1ccc(-n2cnnn2)cc1	728171059	PORQYGSQXFIABV-CQSZACIVSA-N	438.469	1.593	50	20	IDGD	
COc1cccc(N2CC[C@H](NC(=O)NNc3ccc(S(=O)(=O)NC(C)C)cn3)C2)c1	728220772	JULORJWRGOSTFP-HNNXBMFYSA-N	448.549	1.682	50	20	IDGD	
COc1ccc(C(=O)CCC(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1	728339121	JGKVZVOGZBNUOD-LJQANCHMSA-N	442.424	1.189	50	20	IDGD	
CCOc1ccc(C(=O)NCC(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)cc1	728974713	ZJPZONXSMXEMNI-UHFFFAOYSA-N	427.429	1.955	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)Cc2c(C)nc(-c3ncccn3)nc2O)cc1OC	729282366	UEOYUWRHVXRZTD-UHFFFAOYSA-N	438.444	1.359	50	20	IDGD	
C[C@@]12CCC(=O)N1c1ccccc1C(=O)N2CC(=O)NNC(=O)Cn1ccc2ccccc21	729541106	CJWIQTSZZLWMMN-DEOSSOPVSA-N	445.479	1.788	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc2ccccc2c1)NNC(=O)CCc1ccccc1O	730034240	DVHVTAHKGGMOKO-UHFFFAOYSA-N	441.509	1.994	50	20	IDGD	
Cn1cc(S(=O)(=O)N2CCCCC2)cc1C(=O)NNC(=O)C(C)(C)c1ccccc1	731172964	DZPWYZNGCOUGPL-UHFFFAOYSA-N	432.546	1.939	50	20	IDGD	
Cc1ccc(S(=O)(=O)NC[C@H]2CCCN([C@@H](C)C(=O)NNC(=O)CC(C)C)C2)cc1	731850181	PZNVVOABHZTUMI-ZWKOTPCHSA-N	438.594	1.567	50	20	IDGD	
O=C(CCN1CCN(C(=O)[C@@H]2CCCO2)CC1)NNC(=O)c1cc2c(s1)CCCCC2	732051826	BYFCHOLNBLQCEK-KRWDZBQOSA-N	448.589	1.491	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)N[C@@H]2CCN(c3ccccc3C(N)=O)C2)cc1OC	732576561	ZVBBAJLPQKTTIQ-OAHLLOKOSA-N	441.488	1.416	50	20	IDGD	
CCOc1cc(C(=O)NNc2nc3ccccc3c(=O)n2C)ccc1OCC(=O)OC	733261088	JJZYUSVPCFLYSF-UHFFFAOYSA-N	426.429	1.641	50	20	IDGD	
N#Cc1ccc(N2C(=O)N[C@@H](CCC(=O)NNC(=O)c3ccc(Cl)nc3)C2=O)cc1	733776300	OREPAYNOWBRJMV-AWEZNQCLSA-N	426.820	1.273	50	20	IDGD	
COc1ccc([C@@H]2[C@H](C(=O)OCC(=O)NNC(=O)c3cccs3)CCC(=O)N2C)cc1	734617638	KONCKMRVVUXXAX-DNVCBOLYSA-N	445.497	1.671	50	20	IDGD	
O=C1CCc2cc(Br)c(S(=O)(=O)NNC(=O)NCc3ccco3)cc2N1	734806716	GDPPLCLSFZZYSR-UHFFFAOYSA-N	443.279	1.620	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)[C@H]2CCCN2C(=O)C(C)(C)C)CC1	734826000	SFLPZRJPQIHXGP-OAHLLOKOSA-N	439.557	1.753	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2cnc(C(C)(C)C)s2)CC1	735117092	AZQGNZIWMVFIOT-UHFFFAOYSA-N	438.579	1.529	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)N[C@H](CN2CCCC2=O)c2cccc(C(F)(F)F)c2)cn1	735578960	CKMAYSGBWJKCBO-OAHLLOKOSA-N	438.410	1.747	50	20	IDGD	
COc1ccccc1[C@@H](CNC(=O)NNC(=O)c1cnn(C)c1)NC(=O)OC(C)(C)C	735582881	SSGWGOOCMOYEGO-OAHLLOKOSA-N	432.481	1.639	50	20	IDGD	
O=C(NC[C@H](O)c1c(F)cccc1Cl)NNC(=O)C1CCN(c2ncccn2)CC1	741280218	XOMYBBFHESGYGF-HNNXBMFYSA-N	436.875	1.550	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)c1ccc(OC)c(N2CCNC2=O)c1	742033837	CKRKCDJKZDCWPQ-UHFFFAOYSA-N	436.472	1.598	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCN(c2cccc(Cl)c2)C1=O)c1ccc(-n2cnnn2)cc1	742035462	MMUVUVDHMSETME-INIZCTEOSA-N	425.836	1.130	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cc(=O)n(-c3ccc(C)cc3)[nH]2)cc(OC)c1OC	742240729	AEHZKOVKMUBGCB-UHFFFAOYSA-N	426.429	1.575	50	20	IDGD	
O=C(CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@H]12)NNC(=O)c1cccc(Br)c1	742768257	AGJQZTQARKTMJX-YDHLFZDLSA-N	441.351	1.936	50	20	IDGD	
Cn1ccc(N2CCC[C@H](NC(=O)NNC(=O)c3cccc(Br)c3)C2=O)n1	743687256	LUYOBXXBEZWACZ-ZDUSSCGKSA-N	435.282	1.322	50	20	IDGD	
C[C@@]1(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)Cc2ccccc2C(=O)O1	744620312	IRECHSPDLSYAEC-NRFANRHFSA-N	445.497	1.322	50	20	IDGD	
O=C1CCCc2cc(C(=O)NNc3ccccc3S(=O)(=O)N3CCOCC3)ccc2N1	744622039	MRPZHLWUVGAGFF-UHFFFAOYSA-N	444.513	1.739	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)N[C@@H]1CC(=O)N([C@@H]2C[C@@H]2c2ccccc2)C1	745913775	CPHBVWTWGZYVFY-FRFSOERESA-N	439.428	1.401	50	20	IDGD	
COC(=O)[C@H]1CCC[C@@H](C(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)C1	746272516	UFPXNJYOURKITR-KGLIPLIRSA-N	426.514	1.696	50	20	IDGD	
COc1cc(C)nc(NNC(=O)[C@@H](CCSC)NC(=O)c2cccc([N+](=O)[O-])c2)n1	746634699	NNPZPBOMLWUSAM-CQSZACIVSA-N	434.478	1.697	50	20	IDGD	
O=C(CN1CCN(C(=O)OCc2ccccc2)CC1)NNC(=O)c1ccc(Cl)nc1	747357011	DPNSBOWEOKGFTC-UHFFFAOYSA-N	431.880	1.450	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(-n2cnnn2)cc1)c1ccc(F)cc1Br	747407440	XUCAACRNNJOFQZ-UHFFFAOYSA-N	441.242	1.187	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NCc2csc(N(C)C)n2)c2ccccc2c1=O	747588013	BGMIDYRQBRLRKT-UHFFFAOYSA-N	443.533	1.863	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)CNS(=O)(=O)CCOC(C)C)c(C)n1-c1ccccc1	747889821	DFNYJNVQXSGSAY-UHFFFAOYSA-N	436.534	1.200	50	20	IDGD	
COc1ccc(C(=O)NNc2nccn(C)c2=O)cc1S(=O)(=O)N[C@H]1CCCC[C@@H]1C	747941472	GMQDDGJJBCHAII-ZFWWWQNUSA-N	449.533	1.403	50	20	IDGD	
CCN(c1ccccc1)S(=O)(=O)c1cccc(C(=O)NNc2nccn(C)c2=O)c1	747942313	BXWDYCWPDMLDSK-UHFFFAOYSA-N	427.486	1.752	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCc2cccc(N(C)C)c2)cc1	748465655	AKOXYDYWTMRESV-UHFFFAOYSA-N	433.534	1.212	50	20	IDGD	
N#Cc1ccccc1Sc1ccc(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)cc1	748530727	ZSCBPXSDTOQXNO-OAHLLOKOSA-N	430.511	1.841	50	20	IDGD	
Cc1ccc(OCC(=O)N2CCN(CC(=O)NNC(=O)c3ccc(F)cc3)CC2)cc1	748807301	KCWGCMLRIOABEQ-UHFFFAOYSA-N	428.464	1.118	50	20	IDGD	
COC(=O)c1ccc(S(=O)(=O)NNC(=O)c2nnc(-c3ccccc3)o2)cc1Cl	749767744	DKIRFQSTGIDQPH-UHFFFAOYSA-N	436.833	1.800	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)CNS(=O)(=O)c1ccc(Cl)s1	749839239	XXUFDUUHFJWJJQ-UHFFFAOYSA-N	427.895	1.097	50	20	IDGD	
COc1ccc([C@H](C)CC(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1	749867125	ZPJIEEMJZALQSC-LLVKDONJSA-N	425.894	1.951	50	20	IDGD	
C[C@H]1CCCCN1C(=O)CN1CCN(C(=O)NNC(=O)c2cc3ccccc3o2)CC1	750289286	QYPXRTXQUFKJTG-INIZCTEOSA-N	427.505	1.806	50	20	IDGD	
Cc1ccc(NC(=O)CS[C@H](C)C(=O)NNC(=O)CNC(=O)c2cccs2)cc1	751208574	FZQSHLKNTRGJEK-CYBMUJFWSA-N	434.543	1.694	50	20	IDGD	
O=C(O)COc1ccc(S(=O)(=O)NNC(=O)c2cc(Br)c[nH]2)cc1F	751268191	VTVNJMACCOAKOL-UHFFFAOYSA-N	436.215	1.003	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)c1nc(C2CCCCC2)no1	753000787	IUPUNOBRPWBDPV-GFCCVEGCSA-N	425.453	1.798	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)N[C@@H]3CCC[C@H]4CN(Cc5ccccc5)C[C@H]43)nc21	753317639	XAHDRTYCKQDGBH-CGTJXYLNSA-N	436.520	1.996	50	20	IDGD	
O=C(COC(=O)c1cc2cc(F)ccc2oc1=O)NNC(=O)[C@@H]1COc2ccccc2O1	754592821	DFOQMDPSAGAKFY-KRWDZBQOSA-N	442.355	1.076	50	20	IDGD	
CCc1nnc(O)c(CNC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)c1CC	754667395	AZZFLOCUUUMNFF-UHFFFAOYSA-N	425.449	1.343	50	20	IDGD	
O=C(NNc1ccc(C(F)(F)F)nn1)c1ccccc1S(=O)(=O)N1CCOCC1	755182908	FVCAXNMEAYUHMU-UHFFFAOYSA-N	431.396	1.273	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2cccc(S(=O)(=O)NC3CC3)c2)cc1OC	755586451	WXLFQFKNBFKZNR-UHFFFAOYSA-N	434.474	1.611	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)Nc2cc(N3CCCS3(=O)=O)ccc2F)c1	756154488	IBRSHQXMJDHAKE-UHFFFAOYSA-N	435.481	1.898	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)Nc2ccccc2C(=O)NC(C)(C)C)c2ccccc2c1=O	756517931	QRYHMBPGLXIZOM-UHFFFAOYSA-N	436.472	1.928	50	20	IDGD	
COCCS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2ccc(Cl)cc2O)cc1	756550645	JJIBQJUDQJMTLK-UHFFFAOYSA-N	427.866	1.932	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)NNC(=O)C3CCN(c4ncccn4)CC3)cc2)CCO1	756673219	XMEIDHNZDGHVJP-INIZCTEOSA-N	439.520	1.771	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)Nc1ccc(C)c(S(=O)(=O)NC(C)(C)C)c1	756682873	QHBJUXFDMMNGKG-ZDUSSCGKSA-N	430.527	1.276	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)[C@@](C)(O)CN2Cc3ccccc3C2=O)cc1	756797864	SXGDHXDCYQWAKS-WNSKOXEYSA-N	441.484	1.407	50	20	IDGD	
O=C(COc1ccc(Cl)cc1)NNC(=O)Nc1ccc(C[C@H]2CC(=O)NC2=O)cc1	756815636	OCSWIRIBGIIMTO-ZDUSSCGKSA-N	430.848	1.777	50	20	IDGD	
Cc1nn([C@H]2CCS(=O)(=O)C2)c(C)c1NC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	757871799	MUZOGDNARVCKMO-AWEZNQCLSA-N	436.450	1.234	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)NCc2ccc(S(C)(=O)=O)c(Cl)c2)nc2ccccc21	759387111	FQUKQJOGVFXQQH-UHFFFAOYSA-N	449.920	1.703	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3nc(Cl)ccc3F)cc2)CC1	759661656	VVLIDQXAFMVKQS-UHFFFAOYSA-N	427.889	1.567	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)Cn2cc(Br)c(=O)c([N+](=O)[O-])c2)cc1C	763275484	ZDACHXIAPBXKKD-UHFFFAOYSA-N	443.279	1.913	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)CC(C)(C)O3)cc(OC)c1OC	763540006	PDNQJFHEDPUYDQ-UHFFFAOYSA-N	443.456	1.826	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(NC(=O)C3CC3)c2)cc1OC	763550329	KHIGKELCILEZAQ-UHFFFAOYSA-N	426.429	1.452	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)Nc1ccc(N2CCCC2)c(Cl)c1	763572652	TZZJVDYEKPCJNS-GOSISDBHSA-N	444.875	1.866	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2ccc3scnc3c2)c2ccccc2c1=O	763786479	OJSNDUHOTJTVLP-UHFFFAOYSA-N	436.453	1.426	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2ccc(F)cc2Cl)c2ccccc2c1=O	763786941	RPLCNIWJLMBCNT-UHFFFAOYSA-N	431.811	1.609	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc([S@](=O)C(F)(F)F)cc2)cc1	763820325	FQDBWXITBTWLLW-PMERELPUSA-N	443.403	1.787	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)C(=O)Nc1cnn(CC(F)F)c1	763851522	DEHWWNVCWNMYQH-LBPRGKRZSA-N	431.399	1.855	50	20	IDGD	
CCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(C(C)=O)cc2)cc1	763878559	RHYKCCFCHUSJEU-AWEZNQCLSA-N	440.456	1.192	50	20	IDGD	
CCOCCCNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2ccccc2C)c1	763962932	VKBVNHRTANNWEQ-UHFFFAOYSA-N	426.473	1.551	50	20	IDGD	
CC(=O)Nc1ccc(Cl)c(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)c1	764005218	WHTOALMBSRMOAA-UHFFFAOYSA-N	432.820	1.469	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)C2CCCC2)c(OCC(F)(F)F)c1	764068354	KFDOVFRTJSTHRL-UHFFFAOYSA-N	431.367	1.690	50	20	IDGD	
N#Cc1cccnc1Oc1ccccc1NC(=O)C(=O)NNC(=O)[C@H]1Cc2ccccc2O1	764153083	IJUHQIZPLOQJFI-LJQANCHMSA-N	443.419	1.835	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccoc2)cc1S(=O)(=O)N1CCCCCC1	764162616	FFIIHTHXJQBVLL-UHFFFAOYSA-N	448.501	1.552	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)CC(C)(C)C)cccc1S(=O)(=O)NC(C)(C)C	764201838	GGZAVBPLFBHNAA-UHFFFAOYSA-N	426.539	1.594	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)C(=O)Nc1ccc(Oc2ccc(Cl)nn2)cc1	764264392	RQMRLMFIZXKNRC-UHFFFAOYSA-N	426.820	1.646	50	20	IDGD	
CCOC(=O)c1cc(Br)ccc1NC(=O)C(=O)NNC(=O)c1c[nH]nc1C	764297303	NQPHAUIXFFRYNM-UHFFFAOYSA-N	438.238	1.057	50	20	IDGD	
Cn1ccnc1-c1cccc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c1	764350817	LYKJVGPWPQMQTI-UHFFFAOYSA-N	429.440	1.673	50	20	IDGD	
COc1ccc(NC(=O)c2ccc(NC(=O)C(=O)NNC(=O)Cc3ccncc3)cc2)cc1	764355573	DQRHRMQXCDVCNW-UHFFFAOYSA-N	447.451	1.671	50	20	IDGD	
C[C@@H]1CN(c2ccccc2NC(=O)C(=O)NNC(=O)COCc2ccccc2)C[C@@H](C)O1	764366150	KHJCXHGCPFAFNT-IAGOWNOFSA-N	440.500	1.603	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(Oc2ncccc2C#N)cc1C	764399680	LFNVULRWDIXSQX-CQSZACIVSA-N	441.444	1.191	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNS(=O)(=O)c3cc(C)ccc3F)CC2)cc1	765124947	COJUVRKKKKYNMB-UHFFFAOYSA-N	434.537	1.570	50	20	IDGD	
CNc1c(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cccc1[N+](=O)[O-]	765369484	WIUYJWCZBLKEQW-UHFFFAOYSA-N	447.473	1.496	50	20	IDGD	
O=C(NN=C1CCN2CCC[C@@H]12)c1cc(S(=O)(=O)NCc2ccccc2)ccc1O	765563023	IJIUPCXRCYLGEO-IBGZPJMESA-N	428.514	1.825	50	20	IDGD	
COc1ccc(C(=O)N2CCCCCC2)cc1NC(=O)C(=O)NNc1nccnc1OC	766261319	SWUKJJLKKQUVBQ-UHFFFAOYSA-N	442.476	1.592	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2C[C@@H]2c2cc(F)c(F)c(F)c2)c1	766631486	MJLYEPQYRRVXIV-ZIAGYGMSSA-N	441.431	1.919	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)[C@@H]1CSCCS1	766664151	OKHIFEQZRGZCAM-INIZCTEOSA-N	429.011	1.454	50	20	IDGD	
CC(C)(C)[C@H](Br)C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	766751947	YNWXHOISAGFMQM-GXTWGEPZSA-N	429.267	1.327	50	20	IDGD	
CC(=NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)c1cc(C(N)=O)n(C)c1	767038038	WAXXFPRSHFEVQY-UHFFFAOYSA-N	431.518	1.453	50	20	IDGD	
CC(C)(O)C(=O)NNC(=O)C1CCN(S(=O)(=O)c2ccc(C(C)(C)C)cc2)CC1	768259614	MWDKJPYMJOLZRL-UHFFFAOYSA-N	425.551	1.303	50	20	IDGD	
CSCCNC(=S)NNC(=O)c1ccc(Br)c(S(C)(=O)=O)c1	769769310	RYIHFLBQGMWCTC-UHFFFAOYSA-N	426.383	1.325	50	20	IDGD	
CSCCNC(=S)NNC(=O)CCc1ccc(S(=O)(=O)N2CCCC2)cc1	769777934	KLDAAKVQLQZIMS-UHFFFAOYSA-N	430.621	1.262	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)NC3CCN(C[C@@H]4CCCO4)CC3)nc21	770395036	GWTKYAXPOTUKOO-AWEZNQCLSA-N	432.529	1.556	50	20	IDGD	
CN(C)C(=O)c1cccc(CCNC(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)c1	770403177	YUAOBVVECCMXMT-UHFFFAOYSA-N	440.508	1.858	50	20	IDGD	
COc1ccc(S(N)(=O)=O)c(OC)c1C(=O)NNc1ccnc(Br)c1	771547899	VYTJYZPILTZEPH-UHFFFAOYSA-N	431.268	1.266	50	20	IDGD	
O=C(NNc1cnc2ccccc2n1)C(=O)Nc1ccc(N2CCCS2(=O)=O)cc1	773716987	UPHDXNZETKXNQA-UHFFFAOYSA-N	426.458	1.252	50	20	IDGD	
C[C@@H](NCC(=O)NNC(=O)c1ccccc1Cl)c1ccc(S(=O)(=O)N(C)C)cc1	775194498	YMMUYCFFYKKQAW-CYBMUJFWSA-N	438.937	1.702	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCc2ccc(OC(F)F)cn2)nc1	775213331	GWCUHRQRVDNQPP-UHFFFAOYSA-N	444.464	1.935	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(N2CCCCC2)c(C(=O)NNC(=O)CC(F)(F)F)c1	776119612	ISTWQCPNSRSEFW-UHFFFAOYSA-N	436.456	1.641	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)[C@H]2CC(=O)N(c3ccc4c(c3)OCCO4)C2)c1	776534718	RADUPRNIKSVSIR-ZDUSSCGKSA-N	431.470	1.358	50	20	IDGD	
CCOC(=O)N1CCC[C@H]([C@H](C)NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)C1	776874561	LNDNBRBUWZQUMG-RDJZCZTQSA-N	447.540	1.280	50	20	IDGD	
C[C@@H](NC(=O)OC(C)(C)C)[C@H]1CCN(C(=O)NNC(=O)CNC(=O)c2cccs2)C1	778639800	GWKXNLGBVMNNBA-OLZOCXBDSA-N	439.538	1.454	50	20	IDGD	
C[C@H]1CCN(C(=O)OC(C)(C)C)[C@@H](C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)C1	778725537	SZOBUWMWIWVFQW-DOTOQJQBSA-N	446.552	1.876	50	20	IDGD	
O=C(NNc1ccc([N+](=O)[O-])cc1Br)C(=O)Nc1cccc(-n2cnnn2)c1	778750645	BVQVDUOLBPZHPY-UHFFFAOYSA-N	447.209	1.415	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)[C@@H](O)[C@@H](O)c1nc2ccccc2s1	779539218	BZKGTAJSVCXWKY-LSDHHAIUSA-N	438.506	1.143	50	20	IDGD	
Cn1cc(-c2nn(C)cc2C(=O)NNC(=O)COc2ccc(Br)cc2)cn1	780156389	NUAAREOUDDGCLW-UHFFFAOYSA-N	433.266	1.423	50	20	IDGD	
Cc1cc(Br)cc(S(=O)(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c1	780367003	UHIQSNLFFLDLSS-UHFFFAOYSA-N	437.279	1.357	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](NC(=O)NNC(=O)CNC(=O)c2cccs2)CC1	780682506	RXFHREQNHSPUIF-CYBMUJFWSA-N	439.538	1.598	50	20	IDGD	
COC[C@H](CNC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1)OC	781396309	LNFWXWZZUZRGJV-LBPRGKRZSA-N	442.519	1.154	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)c1cccc(NS(=O)(=O)C(F)(F)F)c1	782553481	QTAWNLQORZQIRC-UHFFFAOYSA-N	441.391	1.600	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2ccc(C)c(NC(=O)CN3CCCCC3)c2)nc(C)n1	783326473	WMQKFZLQAVPFKL-UHFFFAOYSA-N	439.520	1.908	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2ccc(CN3CCN(c4ccccn4)CC3)cc2)ncn1	783945235	VNBVVZQSMMRGFD-UHFFFAOYSA-N	446.515	1.584	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)C(=O)Nc1cccc(-c2ncco2)c1	784210609	YACQJOJBRKIMPN-UHFFFAOYSA-N	441.469	1.864	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)cc1[N+](=O)[O-]	784213930	RMVUMJLJLIAHJJ-UHFFFAOYSA-N	433.446	1.426	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)C(=O)N1CCc2c(Cl)cccc21	784215488	JPGAKNVZYHAULE-UHFFFAOYSA-N	434.905	1.813	50	20	IDGD	
Cc1nc2ccc(NC(=O)C(=O)NNc3ccc(S(=O)(=O)NC4CC4)cc3)cc2o1	784216756	PIRSYRUPZGDCEK-UHFFFAOYSA-N	429.458	1.659	50	20	IDGD	
CN(C)c1nnc(-c2ccc(NC(=O)C(=O)NNc3ccc(C(F)(F)F)nn3)cc2)o1	784885791	BJUJLDHEIVNNFE-UHFFFAOYSA-N	436.354	1.693	50	20	IDGD	
C[C@@H]1CCCN(Cc2ccc(NC(=O)C(=O)NNC(=O)Cc3cn4ccccc4n3)cc2)C1	785067864	QKCSZYGVFRYWLK-QGZVFWFLSA-N	448.527	1.895	50	20	IDGD	
COc1cccc(COc2cccc(NC(=O)C(=O)NNc3nccn(C)c3=O)c2C)c1	785090394	QZQCMGRUZDWQQL-UHFFFAOYSA-N	437.456	1.758	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2ccccc2C(=O)N2CCCC2)n1	785226118	PMQMHBLUARRCTB-UHFFFAOYSA-N	425.493	1.641	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1ccc(Br)nc1	785330087	DOFIKGKYRJXYFK-UHFFFAOYSA-N	443.279	1.338	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1cccc(C#N)c1)C(=O)NNC(=O)NCc1ccc(Cl)cc1	787436355	YAKBJAMJMYSRTN-GFCCVEGCSA-N	435.893	1.409	50	20	IDGD	
CS(=O)(=O)[C@H]1CCCC(=NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)C1	788406954	BUOFRMSUPARMSQ-KRWDZBQOSA-N	441.575	1.934	50	20	IDGD	
Cc1nnnn1[C@H](Cc1cccc(F)c1)C(=O)NNc1nnc(-c2ccccn2)s1	788560440	OJKNUFCVGNFODQ-OAHLLOKOSA-N	425.453	1.961	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1cc([C@H]2CCCO2)nn1C	789783643	WNZFZBIBPZJIFY-IAQYHMDHSA-N	435.868	1.478	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)CN1CCc2ccccc2C1=O	790000903	MPMBRTCULDFNTL-UHFFFAOYSA-N	430.530	1.905	50	20	IDGD	
Cc1cccnc1NNC(=O)[C@@H](NS(=O)(=O)c1ccc2c(c1)OCCCO2)C(C)C	791216046	YZKQLOBSCYGOIE-SFHVURJKSA-N	434.518	1.998	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)OCc2ncccn2)cc1	791287078	DGYBZTSYQHJOSI-WJDWOHSUSA-N	432.440	1.874	50	20	IDGD	
C[C@@](O)(Cn1cc(C(F)(F)F)ccc1=O)C(=O)NNC(=O)c1cccc(OC(F)F)c1	792135999	IOFXAKLXJSBCOA-QGZVFWFLSA-N	449.332	1.681	50	20	IDGD	
Cc1nc2ccc(Br)cn2c1C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	792821838	FQJOELBGUSPSLB-UHFFFAOYSA-N	441.249	1.456	50	20	IDGD	
Cc1ccc(S(=O)(=O)n2ccc(C(=O)N([C@@H]3CCS(=O)(=O)C3)N(C)C)c2)cc1	792850800	QSRUVXNGKUNLSQ-MRXNPFEDSA-N	425.532	1.139	50	20	IDGD	
Cc1ccn(-c2ccc(NC(=O)C(=O)NNC(=O)c3cc(Br)c[nH]3)cc2)n1	793021401	DKXJXEMXZFHTCO-UHFFFAOYSA-N	431.250	1.671	50	20	IDGD	
COc1c(NC(=O)C(=O)NNc2ccc(Br)cn2)cc(Cl)cc1C(N)=O	793037131	VBRVQSMWVHBJTP-UHFFFAOYSA-N	442.657	1.687	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C(=O)Nc1ccc(OCC(=O)NC)cc1C)c1ccccc1	797005209	APCAYANHIBENDU-KRWDZBQOSA-N	426.473	1.400	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cc3ccccc3c(=O)o2)cc1	797701202	FYDQUEOIGPOGFB-UHFFFAOYSA-N	429.454	1.183	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(OC(F)(F)F)c(C#N)c2)cc1	799833920	GRZFGJAKHLHLFX-UHFFFAOYSA-N	447.329	1.493	50	20	IDGD	
N#Cc1cc(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)ccc1OC(F)(F)F	799836050	UKZPXDWOUIKFDA-UHFFFAOYSA-N	446.345	1.433	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2O1)C(=O)Nc1ccc(OCC(F)(F)F)c(F)c1	800623611	SFTQBEAQBNIRTO-OAHLLOKOSA-N	441.337	1.856	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@@]1(C)CCN(CC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)C1	801572963	JWIYWCWTIVVFRW-HXUWFJFHSA-N	435.481	1.593	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)Nc2ccc3c(c2)OCO3)cc(S(=O)(=O)N(C)C)c1C	802106527	JDYAKWRAWCLNJX-UHFFFAOYSA-N	434.474	1.749	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)Nc1ccc(OC(F)F)cc1F	802565694	GIFSKQRPINHPMP-CQSZACIVSA-N	425.319	1.353	50	20	IDGD	
C[C@@H]1CCCN(c2cc(C(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)ccn2)C1	812446122	NUNSIIVXBOYLDH-OAHLLOKOSA-N	445.545	1.643	50	20	IDGD	
CCc1nc(C(C)C)ccc1C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	815353244	VRDOPSXXZPLKGG-IBGZPJMESA-N	427.457	1.912	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1)[C@H]1C[C@H]1C	815564008	UXNMPQFKFWXPFK-XIKOKIGWSA-N	439.428	1.756	50	20	IDGD	
CN(C)c1nc(Cl)c(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)s1	857431285	HKBAMSXECYDXAS-UHFFFAOYSA-N	436.969	1.836	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCCNC(=O)c1ccco1	914537237	OUAXNOYOMDYTCQ-LLVKDONJSA-N	439.266	1.570	50	20	IDGD	
CCc1ccc(C(=O)NNS(=O)(=O)c2ccc(N3C[C@H](C(=O)O)CC3=O)cc2)cc1	914746514	KHYRGDFPNCRNBI-OAHLLOKOSA-N	431.470	1.310	50	20	IDGD	
COc1ccnc(NNC(=O)c2ccc(OC)c(S(=O)(=O)N3C[C@@H](C)C[C@H](C)C3)c2)n1	914763132	QISCISFLNQPQMB-KBPBESRZSA-N	449.533	1.917	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NCCNC(=O)c2ccco2)c2ccccc2c1=O	916259303	CXQJOXFBGJIYTC-UHFFFAOYSA-N	440.460	1.164	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)NCc2ccc(N3CCO[C@@H](C)C3)nc2)c1	916392687	HZKSLIZISKJWNE-KRWDZBQOSA-N	427.505	1.833	50	20	IDGD	
N#Cc1ccc(CNC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc1	916410955	KAECMZZVDSLXJK-UHFFFAOYSA-N	427.486	1.487	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCCCNc2ccc(C)cn2)nc1	916521374	CWUCNSOXROCBCV-UHFFFAOYSA-N	435.554	1.944	50	20	IDGD	
COc1cc(CNC(=O)NNC(=O)c2c[nH]c3ccccc23)ccc1OCC(=O)N(C)C	916641496	MRHXLVZSVNVROV-UHFFFAOYSA-N	439.472	1.788	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CCNS(=O)(=O)c2cc(C)ccc2C)cc1	916830624	LFYMCBMVACKFOU-UHFFFAOYSA-N	432.502	1.066	50	20	IDGD	
O=S(=O)(NNc1ccc(S(=O)(=O)N2CCCC2)cn1)c1ccc(CCCl)cc1	917737266	RJCVFPLEJTXMGN-UHFFFAOYSA-N	444.966	1.953	50	20	IDGD	
Cc1ccc2nc(CNC(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)cn2c1	918129476	HEQGSPUCKOYYRT-UHFFFAOYSA-N	430.490	1.037	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)[C@H]2CCCN2S(=O)(=O)c2ccc(C)s2)c1O	919756160	YWYPRIWIFCDIHB-CYBMUJFWSA-N	439.515	1.385	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)NCc2ccc(C(=O)N3CCOCC3)cc2)cc1	919901501	OZFNCLDNHKBCAC-UHFFFAOYSA-N	440.500	1.631	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)CCCOc2ccc(F)cc2F)c1	921302207	UWWIXNDTRIBOLR-UHFFFAOYSA-N	441.456	1.835	50	20	IDGD	
CC(C)CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)NNC(=O)c1ccc(Br)cc1	1117668647	NFTPVPFCFISBNQ-OAHLLOKOSA-N	436.310	1.707	50	20	IDGD	
Cc1nn([C@@H]2CCS(=O)(=O)C2)c2nc(C3CC3)cc(C(=O)NNC(=O)NC3CC3)c12	1317992432	BGIVLEUBSDYYLG-CYBMUJFWSA-N	432.506	1.083	50	20	IDGD	
Cn1c(C(=O)O)cc(Br)c1C=NNC(=O)c1cccc(S(C)(=O)=O)c1	1322943907	IXHLAFMXJMEUFD-UHFFFAOYSA-N	428.264	1.653	50	20	IDGD	
Cc1cc(C)cc(C(=O)NCC(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)c1	1322968469	FBCCUIVXZHBZDM-UHFFFAOYSA-N	432.521	1.828	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)CCS(=O)(=O)c1ccc(OC)cc1	1324990718	PDBQEVAWAIHNNI-UHFFFAOYSA-N	444.513	1.619	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)[C@H]1CC(=O)N(c2ccc(C#N)cc2)C1	1337953383	XXGUUJRRSJNQAE-INIZCTEOSA-N	430.468	1.671	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccncn2)C1	1778157359	BZTBHQNDQHSLBK-JCKWVBRZSA-N	425.327	1.778	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccn3ccnc3c2)C1	1779045664	WDCSNCWTZKTUKD-CSODHUTKSA-N	434.924	1.716	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@H]1C(=O)N1CCO[C@@]2(CCN(C(=O)CO[Si](C)(C)C)C2)C1	1779301098	KNZASLCRFZBWRV-CBGDNZLLSA-N	438.597	1.423	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)c1ccco1)C2	1781995849	XITPSZHXHWFKOR-WLLUSJSYSA-N	429.311	1.610	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(C)(C)NCCC#N)C2	1782170700	TYYJFVKLWBORMS-RZQQEMMASA-N	428.961	1.036	50	20	IDGD	
C[C@H](Cn1ccnc1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Br)C2	1782548369	HPOIOFZZMYCVRF-ATNYBXOESA-N	445.333	1.724	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(C(N)=O)cc3)C2)C1	1784925707	WAEVMXJTVGUHBM-BFUOFWGJSA-N	438.322	1.260	50	20	IDGD	
C[C@H](Cn1cccn1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21	1785442564	UEEMVVAHKSYKKM-QTVXIADOSA-N	431.306	1.189	50	20	IDGD	
C[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)n1cccc1C=O	1786996300	DPHYTLKXTSSRED-ZLTXHLNPSA-N	444.301	1.532	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C#CC3(O)CCCCC3)[C@H]2C1	1788637754	WUKHWCKRZBMCMT-BOSXTWCSSA-N	445.387	1.901	50	20	IDGD	
CCOC(=O)N1CCC(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](Cl)CC)[C@H]3C2)CC1	1789864183	NMCUYRPABWEFHG-XSLAGTTESA-N	443.972	1.852	50	20	IDGD	
CCOc1ncccc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)Br)[C@H]2C1	1791054353	CEQZBTURCMPPKJ-SDADXPQNSA-N	440.338	1.857	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)COc3ccc(O)cc3)C[C@@H]21	1791249586	MJXTXYSFRRXUFM-RUGDWHBFSA-N	426.897	1.005	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]3C2)c1	1791292374	OMDUUYBKRXMMDW-QEJZJMRPSA-N	449.356	1.487	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C=C/c3cnc(C)s3)[C@H]2C1	1791736952	ZLPRYEQAOLASEI-KOJYPYIBSA-N	427.954	1.698	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=N/O[C@@H]1CCCCO1)C2	1792870280	BECAOWXPMHYXPQ-SYQRYTFTSA-N	446.342	1.136	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(OCC3CC3)cc1F)C2)[C@H](O)CCl	1792981055	YVQYNAOVGINNQH-GTYSZEQSSA-N	440.899	1.417	50	20	IDGD	
CC[C@H](CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCl)NC(=O)OC(C)(C)C	1793115272	GSJGHTGRPGPBCF-LJIZCISZSA-N	431.961	1.918	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCNC(=O)OC(C)(C)C)C2	1793456048	WMAOAHKBZVUXCD-IVSAIRAKSA-N	431.961	1.898	50	20	IDGD	
Cc1ccc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Br)C3)cn1	1794049318	VOJOFTNPPRHAHU-FSDCSDTHSA-N	428.302	1.603	50	20	IDGD	
COc1cccc(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)c1C	1796190433	XGEJAAYYEHZCOB-WKCHPHFGSA-N	436.317	1.178	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnc2sc(C)cn2c1=O	1797063401	JHZLUTHFKWWFSG-AYRXBEOTSA-N	438.937	1.285	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(C(F)(F)F)ccn1	1798195366	YEIXFBNGWXXMNS-WJNVRWDZSA-N	435.830	1.557	50	20	IDGD	
CC(=O)O[C@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2)C(C)C	1798273541	GUDQUFYKRYUCKK-SHYMGOFDSA-N	445.520	1.346	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c(O)cc(O)cc1O)C2	1799275682	AMPSZLHZGDBYKB-DKUFLPSKSA-N	433.288	1.243	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1Cc3ccccc3O1)C2	1799275931	DNKGTDNVCHFXMT-ACSCVQKFSA-N	427.328	1.816	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1O	1799985087	GIDQUJNKCOVZCL-FQMQPWHVSA-N	443.972	1.870	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnn2cccc(F)c12	1800123659	ICCIPWBXHUSMHD-CVGJEZRXSA-N	443.306	1.913	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=N/N1CCCCC1)C2	1800641681	HAWBAFWFPCSDQD-IIZDTNSWSA-N	429.359	1.221	50	20	IDGD	
O=C(Cn1cnc2ccccc21)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2	1800889785	LWVSLYHJIUFCLJ-CZAMWMTLSA-N	439.285	1.316	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/c1ccc(F)cc1F)C2	1800971105	PYLNKFLDMTWNQT-PXSURDLUSA-N	428.863	1.821	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnc2c(c1)CCNCC2	1801311222	SUKCWOAVMSSOCT-REPLKXPHSA-N	430.625	1.873	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cc(O)cc([N+](=O)[O-])c2)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803141273	NWBNZZOKTOAQSC-DOPJRALCSA-N	448.863	1.615	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2cccn(C)c2=O)[C@@H]1c1cccnc1	1803835119	HYTRYAZLMZANEZ-NJAFHUGGSA-N	432.908	1.354	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cn1cc(C)c(O)nc1=O	1804097579	UKWXRYPUZBVYPT-XJFOESAGSA-N	441.326	1.069	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC2(CCN(C(=O)[C@@H]3CCCS3(=O)=O)CC2)C1	1805388907	IRAGCUMFPLSYDD-CABCVRRESA-N	449.411	1.826	50	20	IDGD	
COC(=O)CCC(=O)N1CC[C@H](CNC(=O)CCBr)[C@@H]1c1cccnc1	1806339490	MWGSTDSGAGKKSG-KDOFPFPSSA-N	426.311	1.826	50	20	IDGD	
CC1(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)CCCC1	1807360166	OSDVEUMMVMBSLX-FPOVZHCZSA-N	435.333	1.661	50	20	IDGD	
CCC1(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)CCC1	1807360764	CANXWCLGVCCKTG-PZJWPPBQSA-N	435.333	1.661	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)Cn2ccncc2=O)[C@H]1c1cccnc1	1812340671	MEEWQFDSCZLUFH-FUHIMQAGSA-N	431.924	1.752	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)[C@@H]2CCc3nc[nH]c3C2)[C@@H]1c1cccnc1	1813327441	VQOLZAYPIWCPRX-PYQAKABTSA-N	445.951	1.869	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)[C@H](C)Cn2ccnc2)[C@H]1c1cccnc1	1813416858	JCCCFJRJYDIVST-OQIJWPOYSA-N	433.940	1.874	50	20	IDGD	
O=C(CC(F)(F)F)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(B(O)O)cc1)CC2	1814446660	TXGCYWMCRSLOKG-NSHDSACASA-N	427.213	1.001	50	20	IDGD	
Cc1ccc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)s1	1815355007	LEHYYBCUGONRBQ-AWEZNQCLSA-N	441.343	1.732	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCN2CCOCC2)n[nH]1	1817179915	OQTVPGWRIXQFJJ-QGZVFWFLSA-N	437.617	1.976	50	20	IDGD	
Cc1ncccc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1	1817473169	JLVRBPMBITZAFA-LJQANCHMSA-N	433.277	1.413	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)C2=CCCS2)[nH]n1)c1cccc(B(O)O)c1	1817474582	VILMLMPHMGVEKR-MRXNPFEDSA-N	426.307	1.416	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2nccnc2C(N)=O)n[nH]1	1820024146	XVPHDORXMIHSGW-CYBMUJFWSA-N	445.556	1.456	50	20	IDGD	
CN[C@H](CC(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](F)Br)n[nH]1)C(=O)O	1820932861	RUPJJPZQNGOBEH-NRUUGDAUSA-N	434.266	1.155	50	20	IDGD	
CC(C)c1cc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)CCC(=O)NN(C)C)CC3)on1	1821665086	OMWDKUGHAKKLRY-GFCCVEGCSA-N	448.549	1.853	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CN2CCCC2=O)[nH]n1	1822184212	QEQDQPHQVYYXOQ-DGCLKSJQSA-N	426.315	1.808	50	20	IDGD	
CNC(=S)NCCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](C)Br)n[nH]1	1822188941	LVVVAVYYWXUSDH-CMPLNLGQSA-N	445.387	1.669	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@H](C(=O)Nc2cc([C@@H]3CCCCN3C(=O)[C@H](O)CCl)[nH]n2)C1	1822361412	QNZVWWYWHNQART-LQKXBSAESA-N	440.928	1.981	50	20	IDGD	
C[C@H](CS(C)(=O)=O)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)C(Cl)Cl)n[nH]1	1822419399	XLNPBIPQYHICTN-MWLCHTKSSA-N	425.338	1.886	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCc2ncc[nH]2)n[nH]1	1822632567	JHTYWCMTPXBYQN-OAHLLOKOSA-N	430.513	1.131	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)C2CC(F)(F)C2)CC1	1823853559	FTBXLLPAJNWGJW-IBGZPJMESA-N	434.292	1.645	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccnc(F)c2)CC1	1824724087	AWHPFZUEQLWEMX-SFHVURJKSA-N	433.528	1.827	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)Cc3ccccc3O)sc2C1	1825303319	HSFKMEZFPBNXFF-CQSZACIVSA-N	445.545	1.376	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)c2coc(Cl)n2)CC1	1825535603	PBZFYALEYWWZLW-GOSISDBHSA-N	445.712	1.555	50	20	IDGD	
O=C(c1cnccc1F)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827054970	QSARPTKWHQGESQ-NRFANRHFSA-N	439.296	1.448	50	20	IDGD	
O=C([C@H](O)CCl)N1CCC([C@@H]2CCCCN2C(=O)/C=N/O[C@H]2CCCCO2)CC1	1828971007	AGEMTEBFWGLUBT-OYHFHMSSSA-N	429.945	1.735	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@H](C)N2CCN(C)CC2)CC1	1830242892	UHZDNFWJALHNQB-YSIASYRMSA-N	443.032	1.496	50	20	IDGD	
O=C([C@H](F)Cl)N1CCOC[C@@]2(C1)CN(C(=O)C1(c3ccc(O)cc3)CC1)CCO2	1830811725	YPDCALPTUYATKY-QFBILLFUSA-N	426.872	1.415	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc(OC)c(F)c3)C2)C1	1831644220	RNXCNPVJWYLWLZ-YWZLYKJASA-N	443.903	1.707	50	20	IDGD	
CC(C)[C@H](O)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)CBr)CC2)CC1	1833344045	RWHGJKIFUSUJFR-YOEHRIQHSA-N	432.403	1.606	50	20	IDGD	
CCS(=O)(=O)CC(=O)NC1CCN(C2CCN(C(=O)C(C)(C)CCl)CC2)CC1	1833451573	ZALOFEDDNRTSSD-UHFFFAOYSA-N	436.018	1.258	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnc(C)cn3)CCO2)C1	1834087131	BYTKNYYEWOHWPB-KDOFPFPSSA-N	441.326	1.029	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)nc1	1834379010	MOQHKPPPWCZDDY-OALUTQOASA-N	430.332	1.696	50	20	IDGD	
N[C@@H](CC(=O)NC1CCN(C2CCN(C(=O)[C@@H](F)Cl)CC2)CC1)c1cccnc1	1834762172	BLISBNWUJXRBBW-PKOBYXMFSA-N	425.936	1.578	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)Cn3cc(C)cn3)CC2)CC1	1834894659	KDUZPUZPJHOMJU-GOSISDBHSA-N	425.961	1.017	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CSc3ccccc3)CCO2)C1	1835094260	OLAKENPGJFTWOK-FXAWDEMLSA-N	442.965	1.489	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CCC(F)(F)F)CCO2)C1	1835329016	KIXOYUWSWCQNBW-FZMZJTMJSA-N	431.249	1.569	50	20	IDGD	
O=C(c1cc(-c2ccccc2)no1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1837996602	KTWQJGLRMQJHOG-PXNSSMCTSA-N	437.855	1.946	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)c(O)n1	1838667745	SVLFWTPRPZOXBE-FQEVSTJZSA-N	425.913	1.431	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(C)c(OC)c3)CCO2)C1	1838988889	UITBCHLLOQSXTJ-LAUBAEHRSA-N	440.924	1.327	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccnc(OC)c3F)C2)C1	1839144375	WOHLTTSJQGBMEW-LIRRHRJNSA-N	429.876	1.317	50	20	IDGD	
CC(C)O[C@H](C)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2	1839153168	CQFVQQLFGSMCBG-FHLIZLRMSA-N	425.353	1.493	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)c(F)c1	1839260814	HJXHVJSRUOJWGX-KUHUBIRLSA-N	443.313	1.988	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3n[nH]c4ccc(C#N)cc34)CCO2)C1	1839489229	TZJGILFKXMBJSY-IERDGZPVSA-N	445.907	1.522	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCO[C@]2(COCCN(C(=O)C3CC3)C2)C1	1839743631	GVLHSOJPNJOALJ-IXNCKXOBSA-N	431.439	1.738	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccsc3)C2)C1	1840031899	GJPGKDOZJRVLSZ-GUYCJALGSA-N	431.352	1.530	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(O)cc3F)C2)C1	1840035127	GWMXSRARJPMKNW-KPZWWZAWSA-N	445.285	1.385	50	20	IDGD	
O=C(c1ccc2[nH]ccc2n1)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840188370	FZZAKFMHWRUHSI-SFHVURJKSA-N	427.288	1.437	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)C2CCN(c3cc(OC)ncn3)CC2)C1	1841460340	JYQGLULSDXGGJD-INIZCTEOSA-N	435.956	1.922	50	20	IDGD	
Cc1cc(NC(=O)CC(=O)N2CCCC23CN(C(=O)[C@H](C)CBr)C3)no1	1843399539	RUKGWQAZZDAGFZ-LLVKDONJSA-N	427.299	1.546	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)[C@H]2C[C@H]2c2ccc(Cl)cc2)C1	1843873124	OSQSIWKCCNCXIM-PMACEKPBSA-N	438.720	1.641	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1cc(C(F)(F)F)ccn1)C2	1844264565	IQBCXEGNJUBHGH-UHFFFAOYSA-N	448.405	1.230	50	20	IDGD	
CC(C)(C)OC(=O)NCCOCC(=O)N1CCCC12CN(C(=O)C(C)(C)CCl)C2	1845153699	YJGOWTDXZNMBQR-UHFFFAOYSA-N	431.961	1.996	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](CC(=O)N2CCCC23CN(C(=O)[C@@H](O)CCl)C3)C1	1846940443	MRPZEXBMAMHEEF-CVEARBPZSA-N	443.972	1.827	50	20	IDGD	
CCn1c(NNC(=O)CNC(=O)c2cc(OC)cc(OC)c2)nc2ccccc2c1=O	9857411	WISMIOCOEXMNGW-UHFFFAOYSA-N	425.445	1.307	50	20	IDGD	
CCc1cccc(C)c1NC(=S)NNC(=O)CCn1[nH]c(=O)c2ccccc2c1=O	16782859	ONTVJPXLWOEJBW-UHFFFAOYSA-N	425.514	1.969	50	20	IDGD	
COc1ccc(N2C[C@H](C(=O)NNC(=O)COc3ccc(C)c(C)c3)CC2=O)c(OC)c1	17203648	DOZGPALTTLMPMJ-MRXNPFEDSA-N	441.484	1.900	50	20	IDGD	
CCn1c(S)nc2cc(C(=O)NNC(=O)Cc3nc4ccccc4n3C)ccc2c1=O	17411538	RWXVDVNHZNJJOR-UHFFFAOYSA-N	436.497	1.596	50	20	IDGD	
Cc1ccc(-n2cnnc2SCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1	24766729	VTJSDMWMHOSIQP-KRWDZBQOSA-N	425.470	1.655	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)Cc1ccc2c(c1)OCCO2	28630212	XXJNNCHJBMCUPI-UHFFFAOYSA-N	434.832	1.667	50	20	IDGD	
O=C(CCCNC(=O)NC1CCCCC1)NNc1ccc(S(=O)(=O)NC2CC2)cc1	60368993	AVIYTSSCKOBYQV-UHFFFAOYSA-N	437.566	1.983	50	20	IDGD	
O=C(Cn1nc(-c2ccccc2)ccc1=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	110883378	PMDMCNXGTJBPCU-UHFFFAOYSA-N	439.497	1.494	50	20	IDGD	
COc1ccc(CN2C[C@H](C(=O)NNC(=O)c3nn(-c4ccccc4)cc3O)CC2=O)cc1	726619818	PJBGQDRCPIUUMQ-MRXNPFEDSA-N	449.467	1.396	50	20	IDGD	
C[C@@]1(NNC(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)CCS(=O)(=O)C1	726720212	VIJGCHUFDSXXJE-GOSISDBHSA-N	432.493	1.638	50	20	IDGD	
O=C(CSc1nncn1CCc1ccccn1)NNC(=O)c1cccc([N+](=O)[O-])c1	727745128	LMQXXTSEYLDCIZ-UHFFFAOYSA-N	427.446	1.377	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)N[C@@H](CN1CCN(C)CC1)c1ccccc1	727843490	MJLXSSLNQDAPJN-IBGZPJMESA-N	435.532	1.575	50	20	IDGD	
O=C(NNC(=S)NCC1CCC1)c1ccc(S(=O)(=O)NC[C@@H]2CCCO2)cc1	727867229	WZWRNKBFJVSSRK-HNNXBMFYSA-N	426.564	1.053	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@@H](C(=O)NNc3nc(-c4cccnc4)no3)C2)cc1	728074691	HUTMZAHTBWRSQN-MRXNPFEDSA-N	442.501	1.984	50	20	IDGD	
Cc1ccc2c(O)c(C(=O)NNC(=O)c3ccc(Cl)c(S(N)(=O)=O)c3)cnc2n1	728204180	WZWKWNQBYRRTEJ-UHFFFAOYSA-N	435.849	1.019	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)c2cc(S(C)(=O)=O)ccc2Br)c1	728801403	YNLWFSDQDATEOY-UHFFFAOYSA-N	440.319	1.993	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCN([C@@H](C)c3ccc(F)cc3F)CC2)n1	728932014	IKSRIFBDLQEHOV-AWEZNQCLSA-N	437.516	1.798	50	20	IDGD	
CCc1ccc([C@@H](CNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)N(C)C)cc1	729044533	LJQSPWUJBFWUGE-HXUWFJFHSA-N	439.564	1.889	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)[C@H]2CSCN2C(=O)C(C)(C)C)c2ccccc2c1=O	730074128	USFSRSYKIFJMHM-OAHLLOKOSA-N	445.545	1.686	50	20	IDGD	
CN(CCCC(=O)NNC(=O)COc1ccccc1O)S(=O)(=O)c1ccc(F)cc1	730781897	BZDDRXCIJMNOIN-UHFFFAOYSA-N	439.465	1.158	50	20	IDGD	
Cc1c(C(=O)NNC(=O)NCCc2cccs2)nnn1-c1cccc2c1CCN(C)C2	731473060	PIHXMHYIKUXQJM-UHFFFAOYSA-N	439.545	1.812	50	20	IDGD	
COc1ccccc1C(=O)NN=C(C)c1cccc(N(S(C)(=O)=O)S(C)(=O)=O)c1	731487465	WPMNDKKUMLFSPB-UHFFFAOYSA-N	439.515	1.575	50	20	IDGD	
COc1cc2ncn(CCCC(=O)NNC(=O)c3ccccc3OC)c(=O)c2cc1OC	731491680	YXAOEICQTDHXFT-UHFFFAOYSA-N	440.456	1.664	50	20	IDGD	
COc1ccccc1C(=O)NNS(=O)(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	733122948	JTUVEJGMAAAQJA-UHFFFAOYSA-N	439.515	1.103	50	20	IDGD	
CCOCCCn1c(NNC(=O)[C@H](C)NC(=O)c2ccco2)nc2ccccc2c1=O	733268877	SZLQHFNNGOQNCW-AWEZNQCLSA-N	427.461	1.678	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)CC[C@H]2NC(=O)N(c3ccc(C#N)cc3)C2=O)cc1	733774690	PXVHYTOOEZFIMH-GOSISDBHSA-N	435.440	1.298	50	20	IDGD	
Cc1cc(C)n(-c2ccc(CC(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)cc2)n1	734242069	QQWNTRKQRMAJST-UHFFFAOYSA-N	430.509	1.887	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)CN1C(=O)[C@H]2CCCC[C@H]2C1=O	734251111	ZIDLWKRVQNINOK-OKILXGFUSA-N	436.534	1.382	50	20	IDGD	
CC(=O)N(c1nc(C=NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cs1)C1CC1	734295588	ZWYZRQMBZBSXJE-UHFFFAOYSA-N	441.922	1.723	50	20	IDGD	
CC(=NNC(=O)c1cc(S(=O)(=O)NCc2ccccc2)ccc1O)c1cnccn1	734746761	REGKHTUWGHUENT-UHFFFAOYSA-N	425.470	1.815	50	20	IDGD	
CC(=O)NC1(C(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)CCCCC1	734825812	OBUSORPUQQGPJA-UHFFFAOYSA-N	425.530	1.555	50	20	IDGD	
Cc1ccc(S(=O)(=O)n2ccc(C(=O)OCC(=O)NNC(=O)c3ccccc3)c2)cc1	735539416	MPFCKQRIGNMTCW-UHFFFAOYSA-N	441.465	1.652	50	20	IDGD	
CC(C)(C)OC(=O)Nc1ccc(C(=O)NNC(=O)CNC(=O)c2cccs2)c(O)c1	740924998	DUIAAOPOJQPCEA-UHFFFAOYSA-N	434.474	1.992	50	20	IDGD	
CS(=O)(=O)NCCNC(=S)NNC(=O)Nc1c(Cl)cc(Cl)cc1Cl	741869623	DUDWSPPLFQGAJS-UHFFFAOYSA-N	434.758	1.697	50	20	IDGD	
O=C(NNc1c(F)cc(F)cc1Br)C1=CC=CN2CCS(=O)(=O)N=C12	741980630	NKBJWIZTIBHPIZ-UHFFFAOYSA-N	433.234	1.668	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)[C@@H]2SCCc3ccccc32)ccc1Cl	742479104	ZASRPQLXPPJUQQ-OAHLLOKOSA-N	425.919	1.779	50	20	IDGD	
CCO[C@@H](C)c1ncc(C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)s1	742479236	XWERSAQHHARLAK-NSHDSACASA-N	425.536	1.917	50	20	IDGD	
COc1ccc(N2C[C@H](C(=O)NNC(=O)Nc3ccc(N(C)C)cc3)CC2=O)c(OC)c1	743827786	QMJGGJANTZFTKO-CQSZACIVSA-N	441.488	1.976	50	20	IDGD	
CCS(=O)(=O)c1ccc(Cl)c(C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)c1	745000068	WDWYJLHILAQNHU-UHFFFAOYSA-N	449.872	1.623	50	20	IDGD	
CN(C)[C@@H](CNC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)Cc1ccccc1	745294009	WXZINTSJEFFATL-QGZVFWFLSA-N	433.534	1.599	50	20	IDGD	
Cc1nc(SCC(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)n[nH]1	746095725	YJUAQKBQVQGQBC-UHFFFAOYSA-N	449.496	1.425	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2cccc3ccccc23)cc(S(N)(=O)=O)cc1[N+](=O)[O-]	746295861	MJBOJDDXLFQKLG-UHFFFAOYSA-N	428.426	1.779	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccccc1	746553682	PAGNIRMXGNEGBW-GOSISDBHSA-N	441.513	1.268	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)NC[C@@H](c1cccc(F)c1)N1CCOCC1	746755592	GKYOJYXOJVRAGB-IBGZPJMESA-N	440.479	1.420	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@H](C)CN(C)C(=O)OC(C)(C)C)c2ccccc2c1=O	746821027	FJNCHYKFRIGQPH-CYBMUJFWSA-N	431.493	1.680	50	20	IDGD	
Cc1nc(C(=O)NNC(=O)c2ccc3ccccc3c2)nn1-c1n[nH]c(C(F)(F)F)n1	747359469	JCVSWRDZXFDPIZ-UHFFFAOYSA-N	430.350	1.941	50	20	IDGD	
COCCN(CCOC)S(=O)(=O)c1ccc(C(=O)NNc2cccc(F)c2)cc1	748088917	UMPZFTMBXXGLRS-UHFFFAOYSA-N	425.482	1.866	50	20	IDGD	
O=C(CCc1ccco1)NNC(=O)[C@H]1CCC[C@@H](C(=O)NNC(=O)CCc2ccco2)C1	748260974	CBIXKRVBJPIYHF-IYBDPMFKSA-N	444.488	1.539	50	20	IDGD	
COCCN1C(=O)c2ccc(C(=O)NNc3cccc4cnccc34)cc2S1(=O)=O	748766788	FEFFIMGRCGZSJJ-UHFFFAOYSA-N	426.454	1.783	50	20	IDGD	
CCN(CC)C(=O)[C@H](NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1)c1ccccc1	750227739	JKPHXMYEVBIKSP-OAQYLSRUSA-N	446.573	1.846	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)N[C@@H]2CCN(CCCc3ccccc3)C2=O)cc1	750661411	QXAFTDPDXCGSAM-HXUWFJFHSA-N	435.484	1.501	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)Nc2cc(C)nn2-c2nc(C)cc(C)n2)cc1	755516889	UJFBVXLNVBVUHK-UHFFFAOYSA-N	425.449	1.828	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)N[C@H]1CCN(c2c(F)cccc2F)C1=O	756210375	DGYYDKCWGIHLDL-HNNXBMFYSA-N	429.383	1.351	50	20	IDGD	
CN(CC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)C(=O)OCc1ccccc1	756693204	QYNSWIAUJNTTEN-UHFFFAOYSA-N	426.477	1.109	50	20	IDGD	
CCOc1cccc(CNC(=O)NNC(=O)CNC(=O)c2ccco2)c1OC(F)F	756930213	LRYVPLYLLBJKCS-UHFFFAOYSA-N	426.376	1.540	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)N[C@@H]2CCN(C(=O)CCc3ccccc3)C2)cc1	757273331	KKIIQIKCUGOVDT-GOSISDBHSA-N	440.500	1.638	50	20	IDGD	
NC(=O)c1ccc(NNC(=O)c2cc(S(=O)(=O)N3CCCCC3)ccc2Cl)nn1	757408336	RPPOMFSSUDWYAL-UHFFFAOYSA-N	438.897	1.160	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)Nc2cccc(C(N)=O)n2)cc(OCC)c1OCC	757738563	PQRPWSNPTRXOIT-UHFFFAOYSA-N	431.449	1.843	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)COc2ccc(C#N)cc2)ccc1S(=O)(=O)N(C)C	757775903	MGSISNRVVDPFOT-UHFFFAOYSA-N	447.473	1.049	50	20	IDGD	
CN(NC(=O)CCc1nc(-c2ccco2)no1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758781870	IVHSRWGGCWJBAW-UHFFFAOYSA-N	448.480	1.898	50	20	IDGD	
C[C@H](Oc1ccc(Cl)cc1)C(=O)N1CCN(S(=O)(=O)CBr)CC1	760488777	AKNKPZZBYDGUKR-NSHDSACASA-N	425.732	1.934	50	20	IDGD	
COc1ccc2c(c1)OC[C@@H]2CC(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	760649911	XPMUEPXRUUIEBS-HNNXBMFYSA-N	447.513	1.726	50	20	IDGD	
O=C(NCCOc1ncc(Cl)cc1Cl)NNC(=O)[C@@H]1COc2ccccc2O1	762055242	CADBDWCBZWFRED-AWEZNQCLSA-N	427.244	1.938	50	20	IDGD	
CC(C)C[C@H](C(=O)NNc1nccc(N2CCOCC2)n1)N1C(=O)[C@H]2CC=CC[C@H]2C1=O	762869312	VMBPPUKDVZWBQL-IXDOHACOSA-N	442.520	1.122	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NN[C@H](C(N)=O)c2cccc(Br)c2)c1	763377546	RHFMKMDMBMDVAH-AWEZNQCLSA-N	426.292	1.314	50	20	IDGD	
C[C@@H]1CN(Cc2cccc(NC(=O)C(=O)NNC(=O)c3ccccc3O)c2)C[C@@H](C)O1	763527167	NJQUHTTTXSNVDR-HUUCEWRRSA-N	426.473	1.401	50	20	IDGD	
O=C(NNC(=O)c1ccccc1F)C(=O)Nc1ccc(S(=O)(=O)C2CCCC2)cc1	763561956	PXBKMDZPQKBISN-UHFFFAOYSA-N	433.461	1.942	50	20	IDGD	
CCCCNS(=O)(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2cc(C)oc2C)c1	763576493	LYMBIKJVFYDWMI-UHFFFAOYSA-N	436.490	1.375	50	20	IDGD	
Cc1cc(N2CCOCC2)ccc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccccc2)[nH]n1	763606348	YSDXJQYDFPOKEV-UHFFFAOYSA-N	448.483	1.621	50	20	IDGD	
CCNC(=O)c1ccc(C)c(NC(=O)C(=O)NNC(=O)COc2cc(C)cc(C)c2)c1	763645113	QHYIXMPJABUEDS-UHFFFAOYSA-N	426.473	1.526	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(-n2cc(C)cn2)c(F)c1	763661905	FCNMFTOWFFPQOW-UHFFFAOYSA-N	441.419	1.493	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(NC(=O)[C@H]3CCCO3)cc2)cc1	763813311	KXXXJJLOTBMCLX-GOSISDBHSA-N	440.456	1.277	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)c1nn(-c2ccc(F)c(F)c2)c2c1CCC2	763818320	HHAJFJBZWNUVEV-UHFFFAOYSA-N	440.410	1.225	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)C(=O)Nc1ccc(-n2ccnn2)cc1	763855452	WVMIWMPCSWQIJT-HNNXBMFYSA-N	444.451	1.974	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccn(-c3ccncc3)n2)cc1OC	763912576	XTUOWFVABYWEAP-UHFFFAOYSA-N	438.444	1.464	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)C(=O)Nc1cc(F)ccc1OC(F)F	763997334	JUUGQUGGPSNLTD-UHFFFAOYSA-N	435.156	1.917	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)C(=O)Nc1cccc(C[S@@](=O)Cc2ccccc2)c1	763998482	KTAVOWQGNVPOKI-HKBQPEDESA-N	438.509	1.874	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1ccc(CC(=O)N(C)C)cc1	764011370	GJNKQKJPUIKZQF-UHFFFAOYSA-N	432.864	1.379	50	20	IDGD	
O=C(Cc1ccsc1)NNC(=O)C(=O)Nc1ccc(I)cc1	764036185	ZTYHXCZXFIXCDZ-UHFFFAOYSA-N	429.239	1.681	50	20	IDGD	
NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cccc(C(F)(F)F)c2)cc1Cl	764037162	JIOFFEJAFZAETQ-UHFFFAOYSA-N	428.754	1.857	50	20	IDGD	
O=C(Cc1cccc2ccccc12)NNC(=O)C(=O)Nc1ccccc1Cn1cncn1	764037384	VCMRCBUMBBIPGM-UHFFFAOYSA-N	428.452	1.808	50	20	IDGD	
CC(C)n1ncc2ccc(NC(=O)C(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)cc21	764077823	OCGKITBLYFJZHJ-UHFFFAOYSA-N	443.485	1.420	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2cccc(C(=O)NC(C)(C)C)c2)cc1	764125706	AAHRIWFYHUPQEY-UHFFFAOYSA-N	440.500	1.942	50	20	IDGD	
C[C@H]1CN(Cc2cccc(NC(=O)C(=O)NNC(=O)Cc3cccnc3)c2)C[C@@H](C)O1	764268365	JQVPHKUKLFMGHG-IYBDPMFKSA-N	425.489	1.019	50	20	IDGD	
Cc1csc(Sc2ccc(NC(=O)C(=O)NNC(=O)Cc3cc[nH]n3)c(C)c2)n1	764293016	KERKHLPPTINLJK-UHFFFAOYSA-N	430.515	1.963	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)C(=O)Nc1ccc(OC[C@H]2CCCO2)cc1	764342578	GDEZLDPZOLPFPQ-HXUWFJFHSA-N	449.467	1.830	50	20	IDGD	
Cc1nc(Br)ccc1NC(=O)C(=O)NNC(=O)c1ccc(O)c(Cl)c1	764349713	TYNVDDPMVXSGBG-UHFFFAOYSA-N	427.642	1.911	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc2c3c(c1)CC(=O)N3CCC2)c1cc(Br)c[nH]1	764932033	NBXQKHIQQLADMF-UHFFFAOYSA-N	439.291	1.236	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)C1=NN(Cc2ccccc2)C(=O)CC1	765318452	HCZJVRMBGLAYEK-UHFFFAOYSA-N	431.493	1.617	50	20	IDGD	
O=C(CCc1cc(F)ccc1F)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765732635	JKVWCEGRBBCLRV-UHFFFAOYSA-N	430.455	1.503	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cccc(NC(=O)C4CC4)c3)CC2)cc1	765747076	BJIWBWGFBOWLNO-UHFFFAOYSA-N	449.555	1.922	50	20	IDGD	
O=C(COC(=O)Cc1ccc(Br)cc1)NNC(=O)[C@H]1COc2ccccc2O1	767059588	UAZDRKIWERETCG-MRXNPFEDSA-N	449.257	1.522	50	20	IDGD	
COc1cc2c(cc1NC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)NC(=O)CC2	767954017	CUULFXIELYDBRC-UHFFFAOYSA-N	432.458	1.450	50	20	IDGD	
COc1ccc(C(=O)NNC(=S)NCCSC)cc1I	769765639	NDEVBNIEUVLEQN-UHFFFAOYSA-N	425.317	1.772	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)c2cccc([S@](C)=O)c2)cc1	770210165	UQDSCXAQYCFDDU-LJAQVGFWSA-N	429.527	1.920	50	20	IDGD	
COC(=O)C1(O)CCN(C(=O)CCC(=O)C(C#N)=C2N(C)c3ccccc3N2C)CC1	770250872	RJXACYAFFNVXNS-UHFFFAOYSA-N	426.473	1.184	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNc2c(C)cccc2F)cc1S(=O)(=O)N(C)C	770814682	AAHFSXUDLNLJQF-UHFFFAOYSA-N	438.481	1.865	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)COc3cccc(N4CCCC4=O)c3)nc21	770955168	MKSCNRBGVJCNHB-UHFFFAOYSA-N	439.476	1.936	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1cccc(S(=O)(=O)N2CCc3ccccc32)c1	771886225	BNFZSRSWUXVHTJ-CQSZACIVSA-N	445.497	1.541	50	20	IDGD	
Cc1cccc(S(=O)(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1Br	771898035	NJLSKCFLVWDWFD-ZDUSSCGKSA-N	427.276	1.907	50	20	IDGD	
CC(=O)NCCc1ccc(S(=O)(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)cc1	773265914	QIWLBNWZNWNRIL-CYBMUJFWSA-N	439.921	1.796	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2nccnc2C(C)C)cc1NC(=O)CCN(C)C	773996772	AEKXIIPSHOSKQC-UHFFFAOYSA-N	427.509	1.880	50	20	IDGD	
COc1ccc(SC)c(OC)c1C(=O)OCC(=O)NNC(=O)c1ccc(C#N)cc1	775959141	NYROMLZJZYBGFX-UHFFFAOYSA-N	429.454	1.915	50	20	IDGD	
CC(C)N(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)CNC(=O)OC(C)(C)C)c1	778438789	ZDWYENJDADNDQY-UHFFFAOYSA-N	428.511	1.001	50	20	IDGD	
COc1ccc(Cn2ccc(NC(=O)C(=O)NNC(=O)c3ccc4c(c3)OCO4)n2)cc1	778706847	ZKXVQVFDUXDCNX-UHFFFAOYSA-N	437.412	1.068	50	20	IDGD	
C[C@H](NC(=O)OC(C)(C)C)[C@H]1CCN(CC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)C1	778980960	ZPLXDMFWFGYRCE-ZFWWWQNUSA-N	435.481	1.591	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@@H](C(=O)NNc2ccc(Cl)cc2[N+](=O)[O-])[C@@H](C)O)cc1	779501923	TXCWXMBONCGXMK-BDJLRTHQSA-N	442.881	1.728	50	20	IDGD	
COc1ccc(NC(=O)NNc2ncncc2Cl)cc1S(=O)(=O)N1CCOCC1	782006438	HLXGTXIBYLDCKC-UHFFFAOYSA-N	442.885	1.308	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2cc(OC)c(OC)cc2C(=O)N2CCCC2)nc1	782145574	VDHHLTZRXJGGRF-UHFFFAOYSA-N	443.460	1.425	50	20	IDGD	
CCN(CC)Cc1cccc(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)c1	782883763	BUPCRCRODRKQSA-UHFFFAOYSA-N	436.516	1.744	50	20	IDGD	
CNC(=O)CCOc1ccc(NC(=O)C(=O)NNc2ccc(Cl)cc2[N+](=O)[O-])cc1	783291659	NXZPIDIVXIJPDV-UHFFFAOYSA-N	435.824	1.845	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNc2ccc(-n3cccn3)nn2)sc(C)c1CC	783432831	FMVYTVHCFJOVQG-UHFFFAOYSA-N	443.489	1.853	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)c1cccc2nn[nH]c12	783676275	RQNROODECVUZCB-UHFFFAOYSA-N	427.896	1.190	50	20	IDGD	
O=C(NNC(=O)C(=O)N1CCCC1)C(=O)Nc1ccc2nc(-c3ccc(F)cc3)oc2c1	783997326	SFVUTVPYXGPRNV-UHFFFAOYSA-N	439.403	1.342	50	20	IDGD	
C[C@@H](C#N)CSc1ccccc1NC(=O)C(=O)NNC(=O)CNC(=O)c1ccco1	784003026	ZQODSMMOXJRRSY-LBPRGKRZSA-N	429.458	1.047	50	20	IDGD	
COC(=O)c1cc(C(C)C)ccc1NC(=O)C(=O)NNC(=O)Cc1cn2ccccc2n1	785060039	GFFOYTAIKRZIJE-UHFFFAOYSA-N	437.456	1.573	50	20	IDGD	
CCS(=O)(=O)CCn1cc(C)c(NC(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)n1	786732933	OEUWOVDWCLELBP-ZDUSSCGKSA-N	441.485	1.386	50	20	IDGD	
O=C1CN(c2ccnc(C(=O)NNc3ccc([N+](=O)[O-])cc3Br)c2)CCN1	787301200	DVKAQJCUDDYRLY-UHFFFAOYSA-N	435.238	1.445	50	20	IDGD	
COC(=O)[C@](C)(CNC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)c1ccccc1	787306313	MIUQDJBVFGMDLC-HXUWFJFHSA-N	448.501	1.557	50	20	IDGD	
Cc1nn(C)c(N2CCN(C(=O)NNC(=O)c3cccc(OC(F)F)c3)CC2)c1C#N	788103469	WNBSHDZTXCGLFF-UHFFFAOYSA-N	433.419	1.378	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2O1)C(=O)Nc1ccc(Cl)cc1-n1cccn1	788334555	XMZKWSYYECTVAH-KRWDZBQOSA-N	425.832	1.615	50	20	IDGD	
COc1ccc([C@H](CNC(=O)NNc2nc3ccccn3n2)N2CCOCC2)cc1OC	790110464	FZIBKXYKZKVDRF-INIZCTEOSA-N	441.492	1.446	50	20	IDGD	
C[C@@H](Cn1ncc2ccccc21)C(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	792853801	POACAQBAQYDRQL-ZDUSSCGKSA-N	425.401	1.585	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(C)c(Br)n1	793022801	COWSXHNFPVOHDJ-UHFFFAOYSA-N	437.250	1.326	50	20	IDGD	
Cn1cc(-c2cc(F)ccc2NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)cn1	797001056	XCYGDPZIOXCPAP-UHFFFAOYSA-N	449.240	1.717	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(N3CCOCC3)ccc2C)cc1OC	797535976	USIKJLXLFJAHGW-UHFFFAOYSA-N	442.472	1.249	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)CCc2ncc(C(C)(C)C)o2)cc1	801600371	PFLTXQJNGNESEF-UHFFFAOYSA-N	436.534	1.681	50	20	IDGD	
Cc1nn(C)c(C)c1S(=O)(=O)N[C@H](C)C(=O)NNC(=O)Nc1ccc(Cl)cc1	802014766	WQQXFSPSUHGZSU-SNVBAGLBSA-N	428.902	1.210	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN1S(=O)(=O)c1cccs1)Nc1ccc2c(c1)OCO2	802096914	JOKSBUFDDKQWKL-GFCCVEGCSA-N	438.487	1.483	50	20	IDGD	
COc1ccc(Cl)c(NC(=O)NNC(=O)CN2C(=O)N[C@](C)(c3ccccc3)C2=O)c1	802108336	UUBZCDKWLZDQPW-HXUWFJFHSA-N	445.863	1.969	50	20	IDGD	
Cc1ccc(Cc2ccccn2)cc1NC(=O)C(=O)NNC(=O)c1cc([N+](=O)[O-])ccc1O	802571729	CQCCUSMLVFGCSU-UHFFFAOYSA-N	449.423	1.994	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)NC[C@@H]2CCCS(=O)(=O)C2)cc1OC	806041982	NNGPEADKAKYNQK-AWEZNQCLSA-N	427.523	1.643	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)C(=O)Nc1cc(C(F)(F)F)cc(Br)n1	806978898	IXWYSRINRZQZIB-UHFFFAOYSA-N	446.183	1.587	50	20	IDGD	
COCCNC(=O)c1cccc(NC(=O)C(=O)NNc2ccc(Br)cc2)c1	806996077	VNGNNSMYAMMGAP-UHFFFAOYSA-N	435.278	1.907	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)NCCC(=O)NNc2ccc3c(=O)[nH]ccc3c2)cc1	807505499	ZBDWBIBDFJGEKL-UHFFFAOYSA-N	443.485	1.298	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cccc3c2COC3=O)cc1	808934332	AHGQUZJRMHAFKV-LBPRGKRZSA-N	427.413	1.309	50	20	IDGD	
COc1cc(Cl)c(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)cc1C	808936854	XUTVNSRQJCEVLQ-UHFFFAOYSA-N	429.864	1.872	50	20	IDGD	
O=C(CNS(=O)(=O)c1c[nH]c2ncccc12)NNC(=O)Cc1ccc2ccccc2c1	810151507	BHMORGACSFMQKQ-UHFFFAOYSA-N	437.481	1.385	50	20	IDGD	
COC[C@]1(C(=O)NNc2nc3ccccc3c(=O)n2C)CCN(C(=O)OC(C)(C)C)C1	810398323	ATINBXLJSQGVCL-NRFANRHFSA-N	431.493	1.650	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)NCC(=O)NNc2ccccc2Br)cc1	810680222	IQIBAPTXRSLURT-UHFFFAOYSA-N	441.307	1.829	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NN=Cc1cc(I)cc([N+](=O)[O-])c1	811640123	NZKWCKFVKSOJNZ-UHFFFAOYSA-N	442.169	1.673	50	20	IDGD	
COCCOc1cccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)c1	813033533	YAXJDVDWYJRSQZ-UHFFFAOYSA-N	436.490	1.044	50	20	IDGD	
NS(=O)(=O)c1ccc(NC(=O)NN=Cc2cn(-c3ccc(F)cc3Cl)nn2)cc1	814967390	IRIFOSHROSDDGN-UHFFFAOYSA-N	437.844	1.863	50	20	IDGD	
CN1CCN(c2ncc(C=NNC(=O)[C@H]3CCCN(C(=O)OC(C)(C)C)C3)cn2)CC1	814973202	DTJCEYFUWCQVRO-KRWDZBQOSA-N	431.541	1.326	50	20	IDGD	
COC(=O)N1CCN(c2ccc(NC(=O)C(=O)NNc3cc(F)cc(OC)c3)cn2)CC1	815611721	QYUBCLYZKKWTIZ-UHFFFAOYSA-N	446.439	1.200	50	20	IDGD	
CCOc1ccc(NNC(=O)C(=O)Nc2ccc(F)c(S(=O)(=O)NC3CC3)c2)cc1	815817504	WCGLLUMNDMIKND-UHFFFAOYSA-N	436.465	1.747	50	20	IDGD	
CC[C@@H](Nc1c([N+](=O)[O-])c(C)nn1C)C(=O)NNc1ccccc1S(=O)(=O)N(C)C	817054580	OXIMSYLHSVHPLP-GFCCVEGCSA-N	439.498	1.221	50	20	IDGD	
O=C(CN1CCC(C(=O)c2ccc(O)cc2)CC1)NNC(=O)c1cccc([N+](=O)[O-])c1	857836149	LWSUYYNTLIUBKY-UHFFFAOYSA-N	426.429	1.656	50	20	IDGD	
CC(C)n1ncc2cc(/C=C(/C#N)C(=O)c3c(N)n(C)c(=O)n(C)c3=O)c(Cl)nc21	873937468	AULSOZMIIYQEIU-WZUFQYTHSA-N	427.852	1.435	50	20	IDGD	
O=C(NNC(=O)[C@H]1CS[C@H](Cc2ccccc2F)C(=O)N1)c1ccc2c(c1)OCCO2	900255574	LJQQNTJGCFSHTJ-CRAIPNDOSA-N	445.472	1.201	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)Cc1cnn(-c2ccccc2)n1	915688175	GAIXMRNBYGPIRZ-UHFFFAOYSA-N	430.262	1.799	50	20	IDGD	
O=C(NCc1ccc(O)cc1)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	916258927	PDGVPWYHXZWXIQ-UHFFFAOYSA-N	432.502	1.711	50	20	IDGD	
CCOc1cccc(CNC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)c1	916392130	GZAZYFWOGHYAAB-UHFFFAOYSA-N	434.518	1.545	50	20	IDGD	
Cc1cccc([C@@H](CNC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)N2CCOCC2)c1	916435367	AESRMOURPHCJKL-NQIIRXRSSA-N	440.500	1.539	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2ccc(S(C)(=O)=O)c([N+](=O)[O-])c2)c2ccccc2n1	917365331	CJCWTSWZYRCWLA-UHFFFAOYSA-N	428.426	1.930	50	20	IDGD	
CCCn1nc(C(=O)NNS(=O)(=O)c2cc(F)ccc2[N+](=O)[O-])c2ccccc2c1=O	917721894	LRIFPOKJRLAYSM-UHFFFAOYSA-N	449.420	1.477	50	20	IDGD	
CCCCS(=O)(=O)N1CCC[C@@H]1C(=O)NNC(=O)[C@@H](C)Oc1cccc(C)c1C	918690695	ONLPLWTVRDCGHK-IAGOWNOFSA-N	425.551	1.812	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1cccc(CN2CCCC2)c1	918759279	RRUUSUOXYPDGPJ-UHFFFAOYSA-N	429.546	1.959	50	20	IDGD	
O=C(COC(=O)[C@@H]1CCCN(C(=O)N2CCCC2)C1)NNC(=O)c1ccc(Cl)cc1	919131550	YFIMGXVBVJTHSM-OAHLLOKOSA-N	436.896	1.572	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)NCCN1CCN(c2ccc(F)cc2)CC1	919906396	ZAIKSGUUDPLMNX-UHFFFAOYSA-N	429.496	1.529	50	20	IDGD	
C=CCCOCC(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2OC)c1	920431902	XEDUVMHUQWWBDA-UHFFFAOYSA-N	433.486	1.850	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)c1cccc(N2CCOC2=O)c1	920967088	CNZYGCYRZFOFGQ-ZDUSSCGKSA-N	446.485	1.752	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1nnc(O)c2ccccc12)c1cccc(N2CCOC2=O)c1	920984479	UYQZGBXLFXENEV-LBPRGKRZSA-N	436.428	1.997	50	20	IDGD	
CC(C)[C@H](C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)N1C[C@H](C)O[C@H](C)C1	921203194	TXDWDWUCEKFBTQ-ZRCGQRJVSA-N	445.608	1.480	50	20	IDGD	
C[C@H](NS(=O)(=O)c1cccc(C(F)(F)F)c1)C(=O)NNc1nncc(N)c1Cl	1116319127	XZPTWXIEFXEQQD-ZETCQYMHSA-N	438.819	1.541	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2cncn2-c2ccccc2)cnn1CCO[C@@H]1CCCCO1	1116388310	GPGMJHBQDUACOE-HXUWFJFHSA-N	438.488	1.995	50	20	IDGD	
CC(=O)Nc1cc(C)c(S(=O)(=O)NNC(=O)c2cnccn2)cc1Br	1116466020	SMNYDOCNLWAMGA-UHFFFAOYSA-N	428.268	1.129	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCc2ccc(CS(=O)(=O)NC(C)C)cc2)cc1	1318005794	PAWDEOXVDPYRNI-UHFFFAOYSA-N	434.518	1.667	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)c1ccc(N2CCC[C@@H](C(N)=O)C2)cc1	1318532148	RAGUSFOTMRWJBU-MRXNPFEDSA-N	426.473	1.237	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)c1ccc(N2CCC[C@@H](C(N)=O)C2)cc1	1347723162	DKACHKJOYMDQSC-MRXNPFEDSA-N	445.545	1.396	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4occc4c3)C2)C1	1777948494	DYMSZZFEGHNTOY-JOCHJYFZSA-N	428.489	1.249	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](C)Nc3ccccn3)C2)C1	1779332350	VGHUPXJMVBCXNN-YZVOILCLSA-N	439.354	1.885	50	20	IDGD	
CCCC(=O)N[C@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)Br)C2	1779520505	SDWQGEOSKRVKGM-NRTGNBEESA-N	446.386	1.589	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ncccc3C(F)(F)F)C2)C1	1779717664	NSDMEWDGKJJIND-DYVFJYSZSA-N	435.830	1.798	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(C1)CN(C(=O)C1(C#N)CC1)CCO2	1780096823	HKKPBONUHQLDHN-NRFANRHFSA-N	442.428	1.267	50	20	IDGD	
CCOc1ccc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)nn1	1780425230	HXOQDEMPLMGRBN-ACJLOTCBSA-N	441.326	1.350	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(O)c([N+](=O)[O-])c3)C2)C1	1781543947	VYAMKKJRGCTXOT-PIGZYNQJSA-N	442.266	1.527	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](CC)NC(N)=O)C2	1781899865	BISYNYZIJDHHFR-HNSFDTNUSA-N	447.374	1.121	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cccc4ccnn34)C2)C1	1782221125	YRVYOYSWXAVJFG-AUUYWEPGSA-N	435.322	1.809	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C=C/c2cnc[nH]2)C1	1782433468	YCTAOZNTVLQEIS-MBTYCKMQSA-N	425.327	1.720	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)Cc3cc(Cl)ccc3OC)C2)C1	1782978132	CSJQYBPUNSCYLP-JXFKEZNVSA-N	445.343	1.975	50	20	IDGD	
CC(=O)NCCC(=O)N1CC[C@@]2(C1)CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)CCO2	1783192045	XQBJLEUDEXFJRQ-IHSQGBLNSA-N	446.454	1.228	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](C)Br)C3)C2)cc1	1783536908	HXWJTZXPSXQNQW-YJYMSZOUSA-N	438.322	1.872	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H]1CCN1C(=O)OC(C)(C)C)CCO2	1783871950	XAMSFKFQBAAPHL-AUSJPIAWSA-N	445.944	1.080	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)/C=C/C(=O)c3cccs3)CCO2)C1	1783874713	GUXOVLRUUQLUKA-CQJDLURNSA-N	426.922	1.571	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cccc3cccnc13)CCO2	1783934974	NXZWNPQUJJOHBG-HSZRJFAPSA-N	439.516	1.051	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(-c4ccccc4)n3)C[C@@H]21)[C@@H](O)CCl	1784090456	HAEAMDFQXILXMQ-USNOLKROSA-N	443.931	1.942	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](CC(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](F)Cl)CCO3)C1	1784149232	NXATUEUOHJUAEU-KKVAFCGZSA-N	447.935	1.998	50	20	IDGD	
Cc1cc(C)c(C(=O)N2CC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)c(C)c1	1784986073	MNLYPBYTLIBTIF-DEOSSOPVSA-N	436.317	1.049	50	20	IDGD	
CCC[C@H](NC(C)=O)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2	1785441038	YZVUISHVQGKVHR-DHSIGJKJSA-N	432.359	1.152	50	20	IDGD	
Cc1ccn2c(=O)c(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]4C3)cnc2c1	1787447117	MAASKAFQNDWHPT-NZUILWFCSA-N	436.871	1.131	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CCC[C@H]3C)C[C@@H]21	1787508381	HJFBPIZKGFCFNN-MKZDJKJRSA-N	443.548	1.536	50	20	IDGD	
C[C@@H](Nc1nccs1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]2C1	1789923001	PWBDJTQZQBSYTI-QNWJLWSRSA-N	449.346	1.614	50	20	IDGD	
CCN(CC)C[C@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]2C1	1789924885	FVAZEXFCMFPGBC-QXKUPLGCSA-N	436.366	1.635	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)Oc3ccccn3)C[C@@H]21	1791065124	RIBQGGIIHJYDMQ-QXKUPLGCSA-N	440.338	1.612	50	20	IDGD	
COc1ccc([C@@H](O)C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Br)C3)cc1	1792716385	UJLMSFRLXVOCFJ-UDUPFKKZSA-N	445.285	1.009	50	20	IDGD	
CC(C)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc3c1NC(=O)C3=O)C2	1792782977	KVARFEWXPWYLLE-JJLQDPRZSA-N	433.892	1.290	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1C[C@H]1c1ccc(F)cc1	1792907889	ABWNMPZFEPKYIG-WPVAHCMFSA-N	430.524	1.940	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cc3cccnc3cc1F)C2)[C@@H](O)CCl	1792978451	CQYVIZKGKAZNKT-ZDUSMZPESA-N	435.883	1.106	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cc([N+](=O)[O-])ccc1F	1793811977	XXKDIRFBTLZKSH-HRJSJKBJSA-N	443.859	1.120	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CS(=O)(=O)c1ccc(C)cc1	1795323786	UWKZLCKPQVKTOC-HIRMHNASSA-N	442.965	1.376	50	20	IDGD	
C[C@@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@](C)(Cl)CCl)C2)n1cccc1C=O	1795750259	JISGUJBOGXUQSL-MABMQTIPSA-N	430.332	1.688	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCN1CCN(C)CC1	1795882151	HYBYECNKOIABLA-WCXIOVBPSA-N	429.403	1.293	50	20	IDGD	
C[C@@H](CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)Oc1ccccc1	1796193053	KIVTZMPJOKNNJU-DVWBAYGPSA-N	436.317	1.476	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccn2c(O)nnc12)[C@@H](F)Br	1796726288	QZXMGZHAGREOGU-DTHBNOIPSA-N	426.246	1.377	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc2ncsc12)c1ccc(B(O)O)cc1	1798164465	HEKMBFWQDISAII-BJWYYQGGSA-N	435.314	1.542	50	20	IDGD	
COc1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](O)CCl)C3)nc1Br	1799071261	OLJVHJABVHNPOY-LSCVPOLPSA-N	446.729	1.704	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)COCCNC(=O)OC(C)(C)C	1800058118	ZOXKEZOUSDLVCO-FZKCQIBNSA-N	447.960	1.420	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(-n3cnnc3)cc1)C2	1800756399	MDGOFTOUURAZMH-FAYQHZLMSA-N	448.321	1.254	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C=C/C(C)C	1801626092	CDSKEZTXCPEDOJ-CPVVTZALSA-N	445.472	1.936	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(-n3cccn3)cc1)C2	1802338884	ZCRCALSXONVITD-FNLKRUPLSA-N	438.532	1.497	50	20	IDGD	
C[C@@H](O)[C@H](NC(=O)c1ccccc1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C(Cl)Cl	1802342561	FHFSIALUXLSACK-JZYAIQKZSA-N	442.343	1.608	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)[C@@H]2C[C@@H]2C2CC2)[C@@H]1c1cccnc1	1802992084	HGHXENAHGCFAOI-YXTQBTIXSA-N	427.549	1.507	50	20	IDGD	
NC(=O)c1ccc(C(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)cc1	1803145606	FFMYVUQEYZJVPB-KURKYZTESA-N	430.892	1.100	50	20	IDGD	
CSCC(C)(C)C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1803631079	JXNIDLLDQFNXHR-PXNSSMCTSA-N	449.621	1.850	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)CCc2nc(N)n[nH]2)[C@H]1c1cccnc1	1803691695	IXLFCILREBNOJY-MPGHIAIKSA-N	433.944	1.828	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)CSC1=S	1804335955	NXWJONZOJKQLLL-BBKSZCTCSA-N	438.402	1.721	50	20	IDGD	
N=C(N)SCC(=O)N1CC[C@@H](CNC(=O)CCBr)[C@H]1c1cccnc1	1806341181	ZRNQWUUTVNWFCD-SWLSCSKDSA-N	428.356	1.499	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@@H](CNC(=O)CCBr)[C@@H]2c2cccnc2)nn1	1806343346	PPJBUIQMAGXEPM-KSSFIOAISA-N	448.321	1.985	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)Cc2ccsc2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807362779	JGRHCVQVXIULGR-SIKLNZKXSA-N	449.341	1.385	50	20	IDGD	
Cc1cc(NC(=O)CC(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)no1	1808391340	FXMNBPGSBOJNII-YZVOILCLSA-N	449.895	1.012	50	20	IDGD	
O=C(CS(=O)(=O)N1CCCC1)NC[C@@H]1CCN(C(=O)[C@@H](F)Cl)[C@H]1c1cccnc1	1808414929	VWCWDKBAJNXOMA-BHYGNILZSA-N	446.932	1.047	50	20	IDGD	
CN1C(=O)CC[C@H]1C(=O)NC[C@@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1	1808757466	KQILIFLWKPHGQF-MPGHIAIKSA-N	437.338	1.493	50	20	IDGD	
CNc1ccc(C(=O)N2CCC3(CCCN(C(=O)c4cccc(B(O)O)c4)C3)CC2)cc1	1809976537	BNEHFEVLKZTDNE-UHFFFAOYSA-N	435.333	1.567	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)[C@H](C)Cn2cncn2)[C@H]1c1cccnc1	1810479871	HQUZIUZCEHRENY-NRSFXHEJSA-N	434.928	1.269	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2ccc(O)cc2)[C@H]1c1cccnc1	1811934728	IGBAWJXNJLGBEV-XMSQKQJNSA-N	439.516	1.480	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cnc3c(c2)CCNCC3)[nH]n1)[C@@H](O)CCl	1814874751	CUWYXBCEAJOLAA-ROUUACIJSA-N	446.939	1.399	50	20	IDGD	
CC1=C(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2cnccc2C(=O)NN)CC3)CCO1	1815882041	YIAVRDRVGPDWGB-LLVKDONJSA-N	442.501	1.062	50	20	IDGD	
C=C(Oc1ccccc1O)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](O)CCl)CC2	1817258160	RRLXOYCHKOPDGK-SMDDNHRTSA-N	437.905	1.953	50	20	IDGD	
Cn1cc(F)cc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1	1817475631	WTSHAKVRZIZZMI-QGZVFWFLSA-N	439.256	1.187	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1	1817476384	DHPPIZDOESUJNH-QGZVFWFLSA-N	444.373	1.247	50	20	IDGD	
Cc1oncc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819402106	NFVDAFKYPHRXCX-MRXNPFEDSA-N	438.448	1.324	50	20	IDGD	
COc1ccc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@H](O)CCl)CC3)c(OC)c1	1821931462	LNEVGHZQFBCSHX-QMTHXVAHSA-N	439.921	1.986	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccccc2O)[nH]n1	1822413443	WKPUAUKSRNYOQK-MRXNPFEDSA-N	428.493	1.794	50	20	IDGD	
CN1C(=O)CC[C@H]1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](F)Br)CC2	1823051226	GSSYQHAILQDLTO-QOSJWCAFSA-N	433.303	1.366	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)C[C@H]2CCCCO2)CC1	1824912396	BJBRFUXLYKCFNL-WOJBJXKFSA-N	436.597	1.938	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC([C@H]2CCCCN2C(=O)CC(C)(C)O)CC1	1826634147	XYJCHFYAMRDQMN-DUYBAWCLSA-N	445.564	1.901	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)Cc2cccs2)CC1	1827155195	ZLAUGCBGBGPNIV-NRFANRHFSA-N	440.374	1.904	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(Cl)cnc3O)CCO2)C1	1829557881	SXJLXNBZMQDJKG-KXBFYZLASA-N	446.331	1.918	50	20	IDGD	
O=C([C@H](F)Cl)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1C[C@@H]1c1ccc(F)cc1)CCO2	1830423048	YTGMZGBTQLGBCM-PDOICOKGSA-N	428.863	1.920	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccsc3)C2)C1	1830538904	UTIYYIJECGNVRQ-KDOFPFPSSA-N	445.379	1.778	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3CCC=CO3)C2)C1	1830540809	SROOXLBYQXHVQY-IIDMSEBBSA-N	431.327	1.167	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)Cc3ccccc3F)CC2)CC1)[C@@H](O)CCl	1833308992	HUOZSRIDUQRLDQ-IBGZPJMESA-N	425.932	1.540	50	20	IDGD	
Cc1nc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)ccc1F	1833467363	WGFMFKZNFKGTEO-XIKOKIGWSA-N	444.301	1.383	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccnc3)CCO2)C1	1834001115	LLZXGNQZAZPXHF-RDTXWAMCSA-N	426.311	1.183	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccnc3)CCO2)C1	1834009898	NQQLDSARTJRDMJ-CRAIPNDOSA-N	426.311	1.325	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)c(C)o1	1834096719	RDBUDJCZOCUFNI-FZKQIMNGSA-N	429.311	1.750	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)CN3CCCCC3)CC2)CC1	1834613754	SHGYWFUGRAVJLM-IBGZPJMESA-N	429.005	1.298	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cc4cccn4cn3)CC2)CC1	1835423889	PWDATWNARYLVKE-IBGZPJMESA-N	447.967	1.773	50	20	IDGD	
COc1ccsc1C(=O)NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836037410	GQXIGXBIZKRQHF-OAHLLOKOSA-N	429.970	1.542	50	20	IDGD	
C[C@@H](Nc1ccccc1)C(=O)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1837341236	CFGOGGAAUMMZDD-AUUYWEPGSA-N	430.332	1.747	50	20	IDGD	
CCc1cc(C(=O)N2CCC(OC3CCN(C(=O)[C@H](Cl)COC)CC3)CC2)n[nH]1	1837997580	KDPOQOVBQKFKQT-QGZVFWFLSA-N	426.945	1.838	50	20	IDGD	
Cc1nc(C)c(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)o1	1838006003	HRWDEGBJLPCVNG-XJKSGUPXSA-N	434.262	1.052	50	20	IDGD	
CCc1noc(C)c1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1838058601	NGGBCNRWHRKJPA-RHSMWYFYSA-N	448.289	1.306	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)C3=NNC(=O)C3)CC2)CC1	1838381822	OKEOTAKOKYSKKW-CQSZACIVSA-N	443.342	1.034	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3c(C)ccn3C)CCO2)C1	1838822462	KVIDEZJFHUTGBP-KXBFYZLASA-N	442.354	1.577	50	20	IDGD	
CCOc1ncccc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](Cl)CC)CCO2	1839141306	DPHZQPUYUDTQQX-OXQOHEQNSA-N	425.913	1.568	50	20	IDGD	
COc1ccccc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839201951	OMXMHDFGXBAUPD-MAUKXSAKSA-N	445.285	1.456	50	20	IDGD	
O=C(c1cccc2ccnn12)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1839500599	MHUXZPGLNYVHOV-GOSISDBHSA-N	427.288	1.208	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3noc(C)c3C)C2)C1	1839962637	MJLSVRZDMLOFBI-KBXCAEBGSA-N	444.326	1.535	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc(C)cn3)C2)C1	1839963433	KAAIXLXGCIMSLV-KSSFIOAISA-N	441.326	1.029	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccnc(F)c3)C2)C1	1840030114	ANBIABKJNQXUAG-SJCJKPOMSA-N	430.274	1.074	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(Cl)cn3)C2)C1	1840033920	UWUNNTAQKSUNCW-SJCJKPOMSA-N	446.729	1.588	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3[nH]cc4c3CCC4)C2)C1	1840034225	FEQHVPVKTZCNMA-ORAYPTAESA-N	440.338	1.357	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccccc3F)C2)C1	1840034502	NUONUKNSAIFJBH-UGSOOPFHSA-N	429.286	1.679	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)C(Cl)Cl)CCO2)C1	1840189866	QANOULNYBWITPI-YGRLFVJLSA-N	432.142	1.420	50	20	IDGD	
Cc1cccc(F)c1C(=O)N1CCO[C@]2(COCCN(C(=O)CCBr)C2)C1	1840650284	HHWMTQAMQSGMBA-IBGZPJMESA-N	443.313	1.989	50	20	IDGD	
COc1cccc(Cl)c1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1840736992	OVXJVVSAGZYRQG-QAPCUYQASA-N	435.279	1.953	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H]1CCC[C@@H](C(=O)N2CC3(CCCN3C(=O)[C@@H](O)CCl)C2)C1	1841354525	FQJSNULDDAFWOP-PMPSAXMXSA-N	443.972	1.873	50	20	IDGD	
Cc1cccc2cc(C(=O)N3CCCC34CN(C(=O)c3cnccc3C(=O)NN)C4)[nH]c12	1844031063	ZYOBBSHFORCOJO-UHFFFAOYSA-N	432.484	1.606	50	20	IDGD	
Cc1cc2nnc(C(=O)N3CC4(CCCN4C(=O)[C@@](C)(Cl)CCl)C3)c(C)n2n1	1845170671	IUYZUDLPOGPCAK-KRWDZBQOSA-N	425.320	1.794	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCCC12CN(C(=O)c1cc(=O)nc3sccn13)C2	1845171810	XRTZFIHNODZFHO-MRXNPFEDSA-N	429.329	1.809	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)CC(C)(C)C(=O)OC(C)(C)C)C2	1846385597	XTGCFIJGRCAIMK-UHFFFAOYSA-N	438.569	1.321	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cn(C)c3ccccc23)cc(Cl)c1OCC(N)=O	12734308	QDVDZFCBAOYZJI-UHFFFAOYSA-N	430.848	1.779	50	20	IDGD	
COC(=O)c1sccc1S(=O)(=O)NNC(=O)c1cc(OC)c(OC)c(OC)c1	15423710	NZJVQDGGPXHBTN-UHFFFAOYSA-N	430.460	1.184	50	20	IDGD	
Cc1cc(OCC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)ccc1Cl	16593929	FEMRDBXRMWYXHT-UHFFFAOYSA-N	425.894	1.739	50	20	IDGD	
C[C@H](NS(=O)(=O)c1ccc(Cl)cc1)C(=O)NNC(=O)c1cc(-c2ccccc2)n[nH]1	17519276	GGCMYSINUOOHTO-LBPRGKRZSA-N	447.904	1.858	50	20	IDGD	
Cc1nn(CC(C)C)c(C)c1CC(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	18384225	YIFZQWNRKHAFAN-UHFFFAOYSA-N	431.449	1.611	50	20	IDGD	
CN(CC(=O)NNC(=O)C12CC3CC(CC(C3)C1)C2)C1=NS(=O)(=O)c2ccccc21	21201137	KXWYEYLWOOANAM-UHFFFAOYSA-N	430.530	1.431	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCN(C(=O)c3ccc(Cl)cc3)CC2)n1	23005266	FVYGMBNWWJDZDK-UHFFFAOYSA-N	435.937	1.253	50	20	IDGD	
Cc1ccc(S(=O)(=O)Nc2cccc(C(=O)NNc3nnc(C)c(O)n3)c2)cc1F	23311534	NHOHILCVKHRIPY-UHFFFAOYSA-N	432.437	1.891	50	20	IDGD	
O=C(Cn1c(SC(F)F)nc2ccccc21)NNC(=O)c1ccc(-n2cnnn2)cc1	23787634	CHIAMEITEFMCLX-UHFFFAOYSA-N	444.427	1.788	50	20	IDGD	
COc1cccc(CCC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1	27063821	LKCSFUOFURELOR-UHFFFAOYSA-N	431.514	1.874	50	20	IDGD	
CCCCCn1nc(C(=O)NNS(=O)(=O)c2cn(C)c(C)n2)c2ccccc2c1=O	110018985	KADAQDHAWJOPFX-UHFFFAOYSA-N	432.506	1.252	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)CNC(=O)CCC(C)C)c1	110570630	RBLKAWYERFIWDR-UHFFFAOYSA-N	426.539	1.031	50	20	IDGD	
Cc1nn(C)c(C)c1C(=O)C(=O)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1	215857389	SGQFDPSNOJOZQS-NRFANRHFSA-N	445.523	1.994	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)N2CCN(CC(=O)NC3CC3)CC2)c(C)n1C[C@H]1CCCO1	302646810	DYPZWRPTHYTZFC-VLOXRPPESA-N	439.560	1.614	50	20	IDGD	
N#Cc1ccccc1N1CCN(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)CC1	725860791	XQOYRGPIJBHAFT-UHFFFAOYSA-N	441.517	1.028	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NCCCC(=O)Nc1ccc(Cl)cc1	725872139	BBLWMRJLLQKDBI-UHFFFAOYSA-N	437.909	1.881	50	20	IDGD	
O=C(COC(=O)Cc1ccc(-n2cccc2)cc1)NNC(=O)[C@@H]1COc2ccccc2O1	728323945	NMDGAWUMBSRRPZ-FQEVSTJZSA-N	435.436	1.550	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)c1	728976202	KIRRBBIDHILWHN-UHFFFAOYSA-N	433.458	1.690	50	20	IDGD	
COc1ccc2c(C)c(CCC(=O)NNC(=O)COc3ccccc3O)c(=O)oc2c1	730780040	IUOGLLQYJSKJPC-UHFFFAOYSA-N	426.425	1.975	50	20	IDGD	
NC(=O)[C@H]1CCCN(Cc2cccc(CNC(=O)NNC(=O)Cc3ccccc3F)c2)C1	731405760	MVMABQCRASDNSL-IBGZPJMESA-N	441.507	1.596	50	20	IDGD	
Cc1c(C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)nnn1-c1ccc2c(c1)OCCO2	731454018	YRMSQSCGBFJUNJ-CYBMUJFWSA-N	441.419	1.715	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2cnc3c(cnn3Cc3ccccc3)c2)C[C@@H](C)O1	732261467	CUECQWWYEVAUPQ-CALCHBBNSA-N	436.516	1.740	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)N[C@@H]3CCN(c4ccccc4C(N)=O)C3)n[nH]2)cc1	732595728	WIVSPKXSHWFTPH-MRXNPFEDSA-N	447.499	1.707	50	20	IDGD	
Cc1c(/C=C(\C#N)C(=O)NCCN2CCN(C(=O)C3CCCCC3)CC2)cc(C#N)n1C	733177936	MYYIKBLZSTZVGZ-KGENOOAVSA-N	436.560	1.953	50	20	IDGD	
O=C(NCCS(=O)(=O)c1ccc(Cl)cc1)NNC(=O)c1cnn(-c2ccccc2)c1	733349511	ADMREMOXKXYEQY-UHFFFAOYSA-N	447.904	1.944	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NN=C1C(=O)Nc2cc(Br)ccc21	734303695	CZIDWOGZDHXXTE-UHFFFAOYSA-N	426.271	1.929	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)[C@H]1CS[C@H](Cc2ccccc2F)C(=O)N1	737923138	LZBXJCYVEITYNC-QZTJIDSGSA-N	431.489	1.333	50	20	IDGD	
Cc1ccc(O[C@H](C)C(=O)N2CCN(CC(=O)NNC(=O)c3cccs3)CC2)c(C)c1	738333262	UEUAUEBRTDGLSB-QGZVFWFLSA-N	444.557	1.738	50	20	IDGD	
CC(=NNC(=O)Cn1cnc2ccccc21)c1cccc(S(=O)(=O)N2CCOCC2)c1	739399645	HHXBFFFBGWNVPT-UHFFFAOYSA-N	441.513	1.598	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)CCN2CCN(c3ccccn3)CC2)cc1	741144428	RQNGPLPMSAVKCK-GOSISDBHSA-N	441.532	1.607	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)C[C@H]2CCCN2C(=O)OC(C)(C)C)c2ccccc2c1=O	742474247	PIJDVFSOIILOIY-CYBMUJFWSA-N	429.477	1.484	50	20	IDGD	
COc1ccc(N2CCN(CCNC(=O)NNC(=O)c3cccc(N(C)C)c3)CC2)cc1	742940036	PVXWQZQHEQQDDK-UHFFFAOYSA-N	440.548	1.527	50	20	IDGD	
COc1ccc(C(=O)NCCCC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)cc1	743829282	KGTHUUGJZOQZFK-UHFFFAOYSA-N	448.501	1.462	50	20	IDGD	
COC(=O)CCc1c(C)nn(-c2ccc(C(=O)NNC(=O)N3CCOCC3)cc2)c1C	745992884	LJLQIZOLXQQDDA-UHFFFAOYSA-N	429.477	1.281	50	20	IDGD	
CSCC[C@H](C(=O)NNC(=O)c1cccc(N(C)C)c1)N1C(=O)[C@H]2CCCC[C@H]2C1=O	746102674	GFHJVWFWRMBNNN-FGTMMUONSA-N	446.573	1.811	50	20	IDGD	
Cc1cccn2cc(CCNC(=O)NNc3ccc(S(=O)(=O)NC(C)C)cn3)nc12	746776765	XIQFIPGCEVBQJV-UHFFFAOYSA-N	431.522	1.593	50	20	IDGD	
COc1cc(I)c(C(=O)NNC(=O)Cc2ccncc2)cc1OC	747322859	QUEAYSQIZBDERN-UHFFFAOYSA-N	441.225	1.707	50	20	IDGD	
COCCOCCNC(=O)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1	747979056	BTHLQCRYBPXAHF-NRFANRHFSA-N	426.517	1.607	50	20	IDGD	
CCn1c(=O)nc(O)c2c(C(=O)NNc3ccc(S(C)(=O)=O)cc3)cc(C3CC3)nc21	748139035	RTWKTJQXVCKPOL-UHFFFAOYSA-N	443.485	1.555	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)NCCC(=O)Nc1cc(Br)ccc1C	748623640	KNRCPRGFZRGZCU-GFCCVEGCSA-N	445.314	1.468	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)NCCCNC(=O)C1CCC1	749115201	ISGRECPKDOHCPH-UHFFFAOYSA-N	427.299	1.465	50	20	IDGD	
Cc1nccn1C[C@@H](C)CNC(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12	749195967	HPQSRXHTECRMBF-AWEZNQCLSA-N	425.493	1.763	50	20	IDGD	
C[C@H](Cc1ccncc1)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	749618334	CVNBJZVXVKLDME-MRXNPFEDSA-N	445.545	1.831	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)N[C@@H]2CCCN(Cc3ccccn3)C2=O)cc1	753300189	UQCZXRVKBYSPAE-LJQANCHMSA-N	425.489	1.544	50	20	IDGD	
Cc1oncc1C(=O)Nc1ccc(O)c(C(=O)NNC(=O)COc2ccccc2O)c1	755294155	INQCQSMDIGJAKW-UHFFFAOYSA-N	426.385	1.487	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)Nc2ccc(NC(=O)[C@@H]3CCCO3)cc2)c1	755642501	ZUEZHISGHSPGOX-KRWDZBQOSA-N	426.433	1.624	50	20	IDGD	
COC(=O)CNC(=O)Cc1ccc(NC(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)cc1	755863842	WAJXQUFESCLCQN-CYBMUJFWSA-N	446.435	1.278	50	20	IDGD	
CC(C)Cn1cnc2c1c(=O)n(CC(=O)NN=C[C@H]1C[C@H]1C)c(=O)n2Cc1ccccc1	758366651	SBHSZHJINJXKSX-SJLPKXTDSA-N	436.516	1.822	50	20	IDGD	
CC1(C)C(=O)N(C[C@@](C)(O)C(=O)NNC(=O)COc2ccc(F)cc2)c2ccccc21	760065505	GWWCGNPXWWWFPA-JOCHJYFZSA-N	429.448	1.427	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)C(C)(C)NC(=O)C(F)(F)F)c2ccccc2c1=O	760068031	XSIVJTFODYIVFS-UHFFFAOYSA-N	427.383	1.196	50	20	IDGD	
O=C(NNc1ncc(F)cn1)c1ccc(NS(=O)(=O)c2ccc3c(c2)OCCO3)cc1	760920621	LNDNCTRCWMACDP-UHFFFAOYSA-N	445.432	1.945	50	20	IDGD	
COc1ccc(C=NNC(=O)CSc2nnc(O)nc2O)c(Br)c1O	761016738	YTALHAAWPMKBGR-UHFFFAOYSA-N	430.240	1.002	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)C(C)(C)C)cc(OC)c(OC)c1OC	761063043	AVUFMGXTOCOBMN-UHFFFAOYSA-N	425.438	1.021	50	20	IDGD	
C[C@@H]1CN(Cc2ccccc2)C[C@@H](C)C1NC(=O)NNC(=O)CNC(=O)c1cccs1	761789332	GFAUHNDUDPRLSX-HZPDHXFCSA-N	443.573	1.965	50	20	IDGD	
CCOc1ccc(-c2noc(CCC(=O)NNc3nccc(N4CCOCC4)n3)n2)cc1	762852817	ZXMITWZSGOEARH-UHFFFAOYSA-N	439.476	1.838	50	20	IDGD	
O=C(NNC(=O)c1cccnc1)C(=O)Nc1ccc(Cl)cc1I	763491791	OMKNMZPHYBUGBA-UHFFFAOYSA-N	444.616	1.739	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccnc(OCC(F)(F)F)c2)cc1	763661293	MJOFLJHFFBEJIX-UHFFFAOYSA-N	442.350	1.196	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(Cl)cc1OC(F)F	763809355	VORBHLVRRRVJGT-UHFFFAOYSA-N	438.774	1.978	50	20	IDGD	
CCOC(=O)/C=C\c1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C)cc2)cc1	763820398	GTABGAIHMJCMPU-JYRVWZFOSA-N	425.441	1.736	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)c1cc(I)ccc1F	763824370	ODPQNBIQCHRQSH-UHFFFAOYSA-N	442.188	1.016	50	20	IDGD	
CC(=O)Nc1c(C)ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)c1C	763864688	FVPJPUDSKZPJBS-ZDUSSCGKSA-N	430.436	1.954	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1cc2c(cc1F)CCC(=O)N2	763871194	FCECJRIOFZBYOY-SNVBAGLBSA-N	432.383	1.403	50	20	IDGD	
COc1cc(Cl)c(C)cc1NC(=O)C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	763917049	OGMYEONCNFWEIH-UHFFFAOYSA-N	429.824	1.032	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl	764004658	KVXUTMUSFGRSTM-UHFFFAOYSA-N	444.629	1.749	50	20	IDGD	
COc1ccc(NC(=O)c2ccc(NC(=O)C(=O)NNC(=O)c3cc(C)[nH]n3)cc2)cc1	764098386	MLLTVRCFRFZLDV-UHFFFAOYSA-N	436.428	1.379	50	20	IDGD	
COCCn1ncc2ccc(NC(=O)C(=O)NNC(=O)c3cccc4ncccc34)cc21	764257887	PYAYXVXSHDIMAM-UHFFFAOYSA-N	432.440	1.631	50	20	IDGD	
C[C@@H](C(=O)NNc1c(F)cc(C(=O)NC2CC2)cc1F)N1C(=O)[C@H]2CCCC[C@H]2C1=O	764335379	UTIUEVRRWHDWQC-LEWSCRJBSA-N	434.443	1.864	50	20	IDGD	
Cc1cccc(Cn2nccc2NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)c1	764349402	MXJMZHJZBZDRAQ-UHFFFAOYSA-N	427.848	1.999	50	20	IDGD	
CCOC(=O)c1cc2cc(NC(=O)C(=O)NNC(=O)Cc3ccncc3)ccc2s1	764353511	JCUOFDAPAFZQAW-UHFFFAOYSA-N	426.454	1.802	50	20	IDGD	
O=C(NNC(=O)C(F)(F)Oc1ccccc1)C(=O)Nc1ccn(-c2ncccc2F)n1	764377945	FGUMNCWBBOTGCU-UHFFFAOYSA-N	434.334	1.164	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)C(=O)Nc1ccc(N2CCN(C)CC2)c(Cl)c1	764385558	BKFNBCFJLBOWBF-UHFFFAOYSA-N	430.896	1.195	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)C(=O)Nc1ccc(-n2nccn2)cc1C(F)(F)F	764389763	XXLRPTOCJCDYND-UHFFFAOYSA-N	433.350	1.389	50	20	IDGD	
COc1ccc(C(=O)NNc2nccnc2OC)cc1S(=O)(=O)N1CCCCCC1	764469734	NBUYJIYRBYOBIK-UHFFFAOYSA-N	435.506	1.815	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCOCC2)cc1NC(=O)NNC(=O)OC(C)(C)C	765114739	VIDFTZRTUZQTSW-UHFFFAOYSA-N	430.483	1.277	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)CCN3C(=O)[C@@H]4CCCC[C@H]4C3=O)n[nH]2)cc1	765576964	WEVFYVJUAVLPFB-IAGOWNOFSA-N	437.500	1.965	50	20	IDGD	
O=C(NCCc1nc2c(s1)CCCC2)NNC(=O)C1CCN(c2ncccn2)CC1	765678117	RHNKYEPEFCQQLF-UHFFFAOYSA-N	429.550	1.601	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1ccc(C(=O)N2CCSCC2)cc1C	766265028	VIHORXKTEHSTRC-UHFFFAOYSA-N	430.490	1.064	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)c3ccc([C@@]4(C)NC(=O)NC4=O)cc3)n[nH]2)c1	768269042	GHJSVDIEUDSRLW-HSZRJFAPSA-N	446.467	1.823	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2n[nH]c(C3CC3)c2Br)n1	768635759	WMIDMBUUYWYOEB-UHFFFAOYSA-N	442.295	1.361	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)c1nccn2c(Br)cnc12	769606189	BWNUTRMYXZFRPW-UHFFFAOYSA-N	434.250	1.731	50	20	IDGD	
CSCCNC(=S)NNC(=O)CS(=O)(=O)Cc1ccc(Br)cc1	769768467	LFLUOVAFXYAMIT-UHFFFAOYSA-N	440.410	1.222	50	20	IDGD	
Cc1ccc(C(=O)NCCNC(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)cc1	770394702	CPSMTDIAASFAPH-UHFFFAOYSA-N	426.481	1.651	50	20	IDGD	
C[C@H](CNC(=O)NNc1nc(O)c2cnn(C)c2n1)Oc1cccc(Br)c1	770397334	AHWUKIFMWZQMAV-SECBINFHSA-N	436.270	1.925	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)N[C@H]1CC(=O)N(c2c(F)cccc2F)C1	770753740	LGZQLZDEQOBQJJ-LBPRGKRZSA-N	428.399	1.670	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(OCC(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)C1	770966779	BDNXOBDJNNWQHL-UHFFFAOYSA-N	435.485	1.366	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)c3ccc(F)cc3I)nc21	770968735	LYUVGNGTBCQWSC-UHFFFAOYSA-N	428.165	1.570	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)c1cnn(CC(=O)NC2CCCC2)c1	772046801	MWQJXOQJPQNMMT-UHFFFAOYSA-N	429.477	1.181	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)c2cnc3sc(C)cn3c2=O)c1	772646177	XAQQRGAQCXZGAX-UHFFFAOYSA-N	437.275	1.910	50	20	IDGD	
O=C(NNC(=O)N1CCO[C@@H](c2ccc(F)cc2Cl)C1)c1ccc(-n2cnnn2)cc1	773131225	IZEZJKXUTLBSGG-QGZVFWFLSA-N	445.842	1.883	50	20	IDGD	
O=C(NNc1ccc2ccccc2n1)C(=O)Nc1ccc(N2CCCS2(=O)=O)cc1	773662497	WQCMMUQUOVAZCS-UHFFFAOYSA-N	425.470	1.857	50	20	IDGD	
COC(=O)NCc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)cc1	774010052	VCEQCFRIGABTEL-LBPRGKRZSA-N	448.863	1.749	50	20	IDGD	
CON=CC(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2cccc(C(F)(F)F)c2)c1	774331728	XRUMUVOAVJLJOE-UHFFFAOYSA-N	444.391	1.899	50	20	IDGD	
CCO[C@@H]1C[C@H](NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)[C@@H]1Oc1ccccc1	776530987	JPUYAUSCPAJVFN-OTWHNJEPSA-N	447.513	1.659	50	20	IDGD	
O=C(NNC(=O)N1CC[C@H](C(=O)NCC(F)(F)F)C1)c1ccc(Br)s1	777411269	JLXFTCMEDPQWGI-ZETCQYMHSA-N	443.245	1.865	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)N1CCN(S(=O)(=O)CBr)CC1	777832665	QGAOMEQZLXYGAQ-UHFFFAOYSA-N	428.349	1.118	50	20	IDGD	
C[C@H](NC(=O)OC(C)(C)C)[C@H]1CCN(CC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)C1	778973907	BMASWZGYBKGGAT-ZFWWWQNUSA-N	435.481	1.591	50	20	IDGD	
O=C(CCCOc1ccc2c(c1)NC(=O)CC2)NNC(=O)c1ccc2c(c1)OCCO2	782088630	UZDWXKCSONTUQI-UHFFFAOYSA-N	425.441	1.963	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2ccnn2[C@@H]2CCN(Cc3ccccc3)C2)nc1	782145190	MEEXUDACOAADPE-QGZVFWFLSA-N	435.488	1.816	50	20	IDGD	
O=C(CN[C@H](CN1CCOCC1)c1ccccc1)NNC(=O)c1ccc([N+](=O)[O-])cc1	782448210	KLDYRBPNUGVGCY-LJQANCHMSA-N	427.461	1.019	50	20	IDGD	
CSCc1cccc(NC(=O)C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)c1	782896089	BMFQTHUBLYZRFF-UHFFFAOYSA-N	449.558	1.551	50	20	IDGD	
CSc1cccc(C)c1NC(=O)C(=O)NNC(=O)c1csc(N2CCOCC2)n1	782897192	MFJCAXXBKLTYOL-UHFFFAOYSA-N	435.531	1.410	50	20	IDGD	
CC(C)OCc1ccc(NC(=O)C(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1	782897370	NXYHSXRDZPOBFS-UHFFFAOYSA-N	447.517	1.304	50	20	IDGD	
CC(C)Cn1cc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)cn1	783409014	OUIHRZDSMREDAQ-UHFFFAOYSA-N	433.412	1.914	50	20	IDGD	
CCN1CCN(C(=O)Cc2ccc(NC(=O)C(=O)NNc3ccc(F)cc3C)cc2)CC1	783444026	BGKTVHFMXSOBLN-UHFFFAOYSA-N	441.507	1.923	50	20	IDGD	
O=C(NNS(=O)(=O)Cc1cc(-c2ccc(F)cc2)no1)c1cc([N+](=O)[O-])ccc1O	783833221	LITOLQMHIVNHOA-UHFFFAOYSA-N	436.377	1.859	50	20	IDGD	
CS(=O)(=O)c1cc(Br)ccc1NC(=O)C(=O)NNc1ncccc1Cl	784819018	HGMMDBQANSIAOT-UHFFFAOYSA-N	447.698	1.983	50	20	IDGD	
COC(=O)c1cc(Cl)cc(NC(=O)C(=O)NNc2cccc(S(C)(=O)=O)c2)c1	784844567	MTQBTBVGBJUBSH-UHFFFAOYSA-N	425.850	1.612	50	20	IDGD	
O=C(NNc1c(F)cc(C(=O)NC2CC2)cc1F)C(=O)Nc1ccn(-c2ccncc2)n1	785099448	GBVLNHLTUHIRHM-UHFFFAOYSA-N	441.398	1.520	50	20	IDGD	
O=C(NNc1c(F)cc(C(=O)NC2CC2)cc1F)C(=O)Nc1ccn(CC(F)F)n1	785107364	QSCVYPSBJXQWLL-UHFFFAOYSA-N	428.346	1.400	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1cc(C2CCCCC2)nn1C	785331375	UCIGQUBGUIZPQV-UHFFFAOYSA-N	449.533	1.962	50	20	IDGD	
O=C1CN(c2ccnc(C(=O)NNC(=O)COc3ccccc3-c3ccccc3)c2)CCN1	786686678	GICSWNNOEVUEGC-UHFFFAOYSA-N	445.479	1.525	50	20	IDGD	
CCOC[C@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)C(C)C	788875030	CMZHZERUOWTMJP-KRWDZBQOSA-N	426.539	1.476	50	20	IDGD	
Cc1nc(Cl)ccc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)NC(C)C)cn1	789746990	PUNFHEHVWZILBW-UHFFFAOYSA-N	426.886	1.207	50	20	IDGD	
Cc1ccc(-c2nnco2)cc1NC(=O)C(=O)NNC(=O)[C@H]1OCC[C@H]1c1ccccc1	789816917	GPYWOXATHCXZJW-WMZOPIPTSA-N	435.440	1.704	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)[C@H]2CCS(=O)(=O)c3ccccc32)cc1	790126829	MDSINVZMENGQNJ-KDOFPFPSSA-N	432.498	1.961	50	20	IDGD	
CC(=O)N1CCc2ccc(S(=O)(=O)NNC(=O)CSc3ccccc3O)cc2CC1	790245899	FYQWBOWAWFGSTJ-UHFFFAOYSA-N	449.554	1.441	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2cc(Cl)cc(Cl)c2)n([C@H]2CCS(=O)(=O)C2)n1	792440604	AEBIEBXHJDUMHU-ZDUSSCGKSA-N	446.316	1.940	50	20	IDGD	
CCOC(=O)c1csc([C@H]2CCCN2CC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)n1	792471174	PKKPWLWTLRZKRM-OAHLLOKOSA-N	447.473	1.826	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)C2(S(C)(=O)=O)CCC2)cc(OCC)c1OCC	792790630	ZGXPULOLYYUKHH-UHFFFAOYSA-N	428.507	1.611	50	20	IDGD	
Cn1ccc2ccc(NC(=O)C(=O)NNC(=O)c3cc(Br)c[nH]3)cc2c1=O	793022415	XIBZINSLTUDPTE-UHFFFAOYSA-N	432.234	1.029	50	20	IDGD	
COc1c(NC(=O)C(=O)NNC(=O)COc2cc(C)cc(C)c2)cc(Cl)cc1C(N)=O	793023911	XWUQTWAOMXMHMO-UHFFFAOYSA-N	448.863	1.229	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c(Br)c1	794576949	LVZYLQNHLVUGDG-UHFFFAOYSA-N	430.236	1.989	50	20	IDGD	
Cc1nnc(COCC(=O)NNC(=O)[C@@H](C)Oc2cccc(Br)c2)s1	794785800	FQRSYWFWRFIYJQ-SECBINFHSA-N	429.296	1.741	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)CNC(=O)c1ccc(C(F)(F)F)cc1	795161499	OUZSFMFDVSCPRV-UHFFFAOYSA-N	444.435	1.829	50	20	IDGD	
C[C@H](C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1)c1ccc2c(c1)OCO2	795922696	PAFRZQJFFKPEQN-KPZWWZAWSA-N	428.397	1.049	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)c2ccnc(NC(=O)C3CC3)c2)CC1	796515588	XHRUOXQUDDOZOQ-UHFFFAOYSA-N	446.508	1.774	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)CN(C)c1cc(Br)ccc1[N+](=O)[O-]	796601636	VCXRZCVPNRQTEN-UHFFFAOYSA-N	444.286	1.246	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)c1cn(-c2ccc(Cl)c(Cl)c2)cn1	798111987	VGIOUBHDDDQLER-UHFFFAOYSA-N	433.255	1.765	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)Nc2ccc(O[C@@H]3CCN(C)C3=O)cc2C)c1	799239192	ULBNYHTYULHPAD-GOSISDBHSA-N	440.460	1.424	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(OC)cc(OC)c2C)o1	800623779	WHLJIAGPTQEQJM-UHFFFAOYSA-N	432.477	1.847	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)N[C@@H](Cn1ccccc1=O)c1ccccc1	800762357	HHCSXVAGPFFVQS-KRWDZBQOSA-N	437.412	1.848	50	20	IDGD	
COc1cccc(C[C@@H](C(=O)NNC(=O)Nc2cc(F)cc(F)c2)n2nnnc2C)c1	801999449	AXGFGVFSNLRFKF-KRWDZBQOSA-N	431.403	1.905	50	20	IDGD	
O=C(NNC(=O)c1sccc1S(=O)(=O)N1CCOCC1)Nc1ccc(Cl)cc1	802019137	XIIIELGZAWVKJC-UHFFFAOYSA-N	444.922	1.889	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@@H]2CCCCN2C(=O)c2ccccc2)cc1	802065861	DKWAKFPRNNQSLH-SFHVURJKSA-N	444.513	1.938	50	20	IDGD	
O=C(NNC(=O)c1cc(F)ccc1Br)C(=O)Nc1ccc(OC(F)F)nc1	802566710	CKGSLZJTODNBNP-UHFFFAOYSA-N	447.167	1.984	50	20	IDGD	
NC(=O)c1ncn2c(C(=O)NNc3ccc4c(=O)[nH]ccc4c3)cc(-c3ccco3)nc12	803429009	UGJVLBXSLCNIOD-UHFFFAOYSA-N	429.396	1.687	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)NCCn2cc(Br)cn2)cc1OC	805838613	ZGWKUIMLKBNTKI-UHFFFAOYSA-N	426.271	1.697	50	20	IDGD	
COc1ccc(CS(C)(=O)=O)cc1NC(=O)NNC(=O)[C@H]1COc2ccccc2O1	806637823	WWUORECNSKYBIA-QGZVFWFLSA-N	435.458	1.233	50	20	IDGD	
O=C(CCCc1ccccc1)NNC(=O)C(=O)Nc1ccc(F)c(N2CCCNC2=O)c1	806978120	NHORTKSZWCOVMF-UHFFFAOYSA-N	441.463	1.854	50	20	IDGD	
O=C(NC[C@@H](c1ccco1)N1CCCCC1)NNC(=O)c1csc(N2CCOCC2)n1	806996982	YDFXEQVCKICZGT-INIZCTEOSA-N	448.549	1.744	50	20	IDGD	
CN1CCN(C(=O)NNC(=O)c2sc(N3CCOCC3)nc2-c2ccccc2)CC1	807383485	XCWZXLCHUYQBIG-UHFFFAOYSA-N	430.534	1.249	50	20	IDGD	
O=C(NCC1=CCCOC1)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	807593631	ORFBWSCTHPEOAS-UHFFFAOYSA-N	444.513	1.456	50	20	IDGD	
COC[C@H](NC(=O)NNC(=O)c1csc(N2CCOCC2)n1)c1cccc(Cl)c1	808187017	WQSNKHCQDCDELS-AWEZNQCLSA-N	439.925	1.965	50	20	IDGD	
COc1ccc(C)cc1N1C[C@H](C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)CC1=O	812727176	OVORZOSKLBZLKO-OAHLLOKOSA-N	446.529	1.750	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1cc(C2CCCC2)nn1C	815751672	JHZGBQOKTXCRFZ-UHFFFAOYSA-N	434.522	1.410	50	20	IDGD	
CCCS(=O)(=O)Nc1ccccc1C(=O)NNc1ccccc1S(=O)(=O)N(C)C	817052928	WSQGGAGKCXLLEU-UHFFFAOYSA-N	440.547	1.846	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@H](C(=O)Nc2cccc(NC(=O)NN(C)C)c2)[C@H](C)O)cc1	819552594	YTUYEEHFBGIFSB-KSSFIOAISA-N	449.533	1.260	50	20	IDGD	
CCOCc1nc(C)c(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)s1	857431451	KAQLRRYAVAVHJG-UHFFFAOYSA-N	431.562	1.961	50	20	IDGD	
CC(C)C[C@H](C(=O)NNC(=O)[C@@H]1COc2ccccc2O1)N1C(=O)[C@H]2CC=CC[C@@H]2C1=O	859449029	XTWQPNSWBYHTOS-GGXPGOJBSA-N	441.484	1.340	50	20	IDGD	
Cc1cc(C(=O)NCC(=O)NNC(=O)c2ccc(Br)s2)ccc1[N+](=O)[O-]	913161166	DPIBZMSAHIRVPD-UHFFFAOYSA-N	441.263	1.918	50	20	IDGD	
O=C(CCn1ccccc1=O)NNC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1	915045914	MZUSFNFBGGLTMV-UHFFFAOYSA-N	428.452	1.947	50	20	IDGD	
COc1cccc(C[C@@H](C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)n2nnnc2C)c1	916091498	SPSRBUBXHLJWAF-KRWDZBQOSA-N	425.405	1.143	50	20	IDGD	
COCc1ccc(CNC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc1	916425823	XPIZNKKHHAWISR-UHFFFAOYSA-N	446.529	1.762	50	20	IDGD	
CC1CCN(CCCCNC(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)CC1	916501882	CPLIHFHUGYITES-UHFFFAOYSA-N	426.587	1.907	50	20	IDGD	
CC(C)(CNC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)N1CCc2ccccc2C1	916591794	LFCXBSSJKNGGKI-UHFFFAOYSA-N	444.557	1.871	50	20	IDGD	
C=CCNS(=O)(=O)c1cc(C(=O)NNc2nc3ccccc3c(=O)n2CC)ccc1F	918016247	GLRMTMRWFNOMFM-UHFFFAOYSA-N	445.476	1.777	50	20	IDGD	
CNS(=O)(=O)c1ccc([C@H](C)NC(=O)NNC(=O)Cc2nc3ccccc3n2C)cc1	919779795	ZUZOSELBEZAYMF-ZDUSSCGKSA-N	444.517	1.116	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NN=Cc2cc3c(cc2[N+](=O)[O-])OCCO3)cc1	920364527	FBFGAOWZWYAFRF-UHFFFAOYSA-N	448.457	1.445	50	20	IDGD	
C[C@@H](C(=O)N(C)CC(=O)OCC(=O)C(C#N)=C1N(C)c2ccccc2N1C)n1cccn1	920542317	CAWCALKCAFSEIU-HNNXBMFYSA-N	436.472	1.336	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)C1=CC=CN2CCS(=O)(=O)N=C12	921236560	XZNFDPHFGUDVRJ-AWEZNQCLSA-N	440.481	1.252	50	20	IDGD	
CN1C(=O)Cc2cc(S(=O)(=O)NNC(=O)NCc3cccc(C(F)(F)F)c3)ccc21	921298064	NGBOTKUVLRGABB-UHFFFAOYSA-N	442.419	1.917	50	20	IDGD	
O=C(NCCCN1C(=O)c2ccccc2C1=O)NNC(=O)c1cncn1-c1ccccc1	1117423164	MBGABMBLOOCEMP-UHFFFAOYSA-N	432.440	1.503	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NC2CCN(Cc3ccccn3)CC2)c1	1248696537	WUMPQWMUUVOHMI-UHFFFAOYSA-N	431.518	1.094	50	20	IDGD	
Cn1cc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c(C(F)(F)F)c1	1254676779	YREXTNUFSXGACI-CQSZACIVSA-N	427.335	1.188	50	20	IDGD	
CS(=O)(=O)c1cccc(S(=O)(=O)NNC(=O)c2ccc(Br)cc2)c1	1317767386	BVEZKNPJRRHCBK-UHFFFAOYSA-N	433.305	1.476	50	20	IDGD	
CCOC(=O)C1(CNC(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)CCC1	1318800723	MZUPNJILHPPOKT-UHFFFAOYSA-N	426.514	1.697	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)c2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)nc1C	1319895068	QCMODTPXIRSZOP-OAHLLOKOSA-N	426.477	1.420	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2[nH]nc3ncccc23)C1	1777914232	KMHPOYIVPJJLNL-BXTJHSDWSA-N	435.912	1.339	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@H]1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Cl)C1	1778030489	UGTHDMYZFRYUHF-PEJGYKSESA-N	430.904	1.790	50	20	IDGD	
O=C(CCN1Cc2ccccc2C1=O)N1CC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1778187624	XRUFHILTEUCJHD-FQEVSTJZSA-N	440.327	1.666	50	20	IDGD	
CC(C)(NCCC#N)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CO[Si](C)(C)C)C1	1779543596	KCKLKMQHPCPVAO-DYESRHJHSA-N	438.645	1.634	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Br)C2)c1cc[n+]([O-])cc1	1779945446	QTWAJTNFEKSGQA-CKEIUWERSA-N	430.274	1.138	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cccc(C#N)c3Cl)C2)C1	1780192119	GGPUJSGUJCDAOQ-BEFAXECRSA-N	426.300	1.909	50	20	IDGD	
CSCC[C@H](O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Br)C1	1780777468	SQEMDZYGBZXYCF-VPWBDBDCSA-N	441.363	1.305	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3nc(OC)ccc3[N+](=O)[O-])CCO2)C1	1781218563	NUFNNZGKVJLUEG-KZULUSFZSA-N	426.857	1.459	50	20	IDGD	
Cc1cc(NC(=O)CC(=O)N2CCO[C@@]3(CCN(C(=O)[C@](C)(Cl)CCl)C3)C2)no1	1781229524	IJDKZUBWUJBJID-MSOLQXFVSA-N	447.319	1.378	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)Br)C1	1782002594	RTXSCXGQHIACBU-UHQDVWGKSA-N	449.342	1.845	50	20	IDGD	
O=C(c1ncon1)N1CCO[C@@]2(CCN(C(=O)[C@H](Br)Cc3ccccc3)C2)C1	1783022269	JSGFDCVQHNAKGI-DNVCBOLYSA-N	449.305	1.519	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3c4c(nn3C)CCC4)CCO2)C1	1783353497	PCNZHCQXCAIZJB-AUUYWEPGSA-N	439.354	1.526	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)COc3cc(Cl)ccn3)CCO2)C1	1783533689	FOIMWZXRQJOKLN-YVEFUNNKSA-N	446.729	1.727	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3n[nH]c4ccc(C#N)cc34)CCO2)C1	1783536251	ILBOUROGHIQHAQ-BLVKFPJESA-N	446.305	1.661	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cc(OC)cc(OC)c3)CCO2)C1	1783882125	OCTRMACACZYCTH-YLJYHZDGSA-N	426.897	1.401	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)C1(c3ccccc3F)CC1)CCO2	1783939979	PQFFSRDNRRXKAS-JOCHJYFZSA-N	446.523	1.060	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](O)c3ccccc3Cl)C2)C1	1784250563	HHAIEALTIIQGMT-FCEWJHQRSA-N	431.316	1.457	50	20	IDGD	
CC(C)(C)n1ncc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](O)CCl)C[C@@H]32)c1Cl	1785712118	CMYNMFRIOLQUIF-MXAVVETBSA-N	447.363	1.485	50	20	IDGD	
C[C@@H](CNC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]2C1	1787443753	SEYZEUXHSAUVTM-YTFOTSKYSA-N	435.924	1.661	50	20	IDGD	
CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]2C1	1787451578	WWSRYJQKBJVOLO-YTFOTSKYSA-N	435.924	1.804	50	20	IDGD	
CN[C@@H](CC(=O)NC1(c2ccc(NC(=O)CCBr)cc2)CCC1)C(=O)O	1787672825	DJQJDVORIDKGDS-AWEZNQCLSA-N	426.311	1.968	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC1(c2ccc(NC(=O)C(C)(C)NCCC#N)cc2)CCC1	1788031526	FKYSWCSFXIMLDE-UHFFFAOYSA-N	442.564	1.775	50	20	IDGD	
Cc1nccc(C(=O)NC2(c3ccc(NC(=O)c4ccc(B(O)O)cc4)cc3)CCC2)n1	1788141026	CPAZJTQDESMFRQ-UHFFFAOYSA-N	430.273	1.526	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)C1=NO[C@@H](c2ccccc2)C1	1788141521	KORFJGMLYGQIPN-JAQSECSASA-N	435.908	1.083	50	20	IDGD	
Cc1ncc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]3C2)s1	1788766134	PVYQOSLZKJDCSZ-XIRDDKMYSA-N	425.627	1.825	50	20	IDGD	
CC(C)n1cnc(C(=O)Nc2ccc(C3(NC(=O)CCC(=O)NN(C)C)CCC3)cc2)n1	1788794503	FHMLUHVJPGPOID-UHFFFAOYSA-N	441.536	1.980	50	20	IDGD	
CCOC(=O)c1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Cl)C[C@@H]32)ccn1	1789335170	SHFUWPNTZJLIFY-SDADXPQNSA-N	427.860	1.386	50	20	IDGD	
CC(=O)OC[C@H](OC(C)=O)C(=O)Nc1ccc(C2(NC(=O)[C@@H](O)CCl)CCC2)cc1	1789542231	GZZZIQJNRUPEHJ-IRXDYDNUSA-N	440.880	1.215	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CC[C@@H]4CCC(=O)N4C3)C[C@@H]21	1789867068	WSCLHUNIDPPLEV-UFYUIRFASA-N	425.957	1.385	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nc4ccccn4n3)C[C@@H]21)[C@H](F)Br	1789922880	NMRFJJMRLKYQQU-MNXVOIDGSA-N	440.273	1.013	50	20	IDGD	
CC(C)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(-c3cccnc3)[nH]n1)C2	1792784076	NABGEUBHRZUUIM-JLVBRIDZSA-N	431.924	1.940	50	20	IDGD	
CC(=O)O[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)CBr)C(C)C	1792870290	BFECNWZPQUDHAG-JZYAIQKZSA-N	433.343	1.195	50	20	IDGD	
Cc1cccc(-c2cnccc2C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](O)CCl)c1	1792976712	KRDQTGPJRZXXGY-HRQSHJORSA-N	443.931	1.860	50	20	IDGD	
CN(C)[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](O)CCl)c1ccc(Cl)cc1	1792983170	BRFVHFITCUDEBU-PEZLKRJXSA-N	444.359	1.132	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1c(F)ccc(F)c1F	1793646536	LFEGIROFKMLHKN-IMEWIIRVSA-N	434.842	1.490	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCBr)C3)n1	1794278867	KRRNNMJDBUETBX-FVCICTRLSA-N	439.310	1.028	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnc(OCF)cn1	1794406472	QMCYZDLDCYUSKT-OHTBPHCPSA-N	445.289	1.017	50	20	IDGD	
O=C1CC[C@H](C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](Br)Cc2ccccc2)C3)N1	1795826889	QYOSNKSZLZHRAI-FLXSYLCISA-N	448.361	1.909	50	20	IDGD	
C[C@H](Nc1nccs1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CO[Si](C)(C)C)C2	1796412667	CJKBDQVKDBAQLH-AYDFFVQHSA-N	426.615	1.385	50	20	IDGD	
COc1ccccc1C(=O)N1CC(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](F)Cl)C1	1796803986	FZQKNKAZIZTZHV-KRXQYRFLSA-N	437.899	1.940	50	20	IDGD	
CC(C)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(-c2ccccn2)[nH]n1	1798169502	WAJQFTRYTCCEST-ZSBFGKGUSA-N	431.924	1.940	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc3cccnc3n1)C2	1798440242	HAPWDMBVIYYXST-MUJYYYPQSA-N	445.483	1.194	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cc1cccc(F)c1F)C2	1798443001	LQFGKCLHDIEXHC-QDMKHBRRSA-N	443.454	1.458	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CO[Si](C)(C)C	1798625856	ODQOVJSFXQDXQV-RUNXZISMSA-N	433.585	1.610	50	20	IDGD	
C[C@@H](NC(=O)c1ccc(F)cc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2	1799049775	BNUPNUAULDAWQN-IKVITTDRSA-N	446.306	1.337	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2)c1cc(O)c(O)c(Cl)c1	1799770895	STJAXPHHBLUAGC-QHBPRCKVSA-N	447.713	1.739	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2sc(C)cc2[nH]1	1799948770	DYUQFNOQSQJCOF-LKQDWFRTSA-N	425.938	1.995	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)N1C[C@H]3C[C@H]3C1)C2	1800641985	PIHFAEHZYRDNPK-ZXPKRNLXSA-N	428.371	1.090	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@]1(F)CCCCC1(F)F)C2	1800978074	LDKZAPDVQIDCOF-QFRSUPTLSA-N	426.863	1.747	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c(Cl)cccc1OC)C2	1800983255	UFTLGWXSKDYHFD-DMVWFOPNSA-N	431.316	1.806	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)C(C)(C)C#N)[C@@H]1c1cccnc1	1802686489	LCNNFRKTFYOFSG-UKVGILNFSA-N	449.515	1.771	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)C(C)(C)CCl)[C@H]1c1cccnc1	1802902633	RQBNVHFLFCZIKH-QFBILLFUSA-N	437.972	1.725	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)/C=C/c2ccc([N+](=O)[O-])o2)[C@H]1c1cccnc1)[C@H](O)CCl	1803136087	NCNQCMKCVUACNM-NYGUZRMVSA-N	448.863	1.902	50	20	IDGD	
Cc1cc[nH]c1C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1805005157	SIVOGPXJWVBPIX-RXVVDRJESA-N	432.289	1.031	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)c2ncc[nH]2)[C@@H]1c1cccnc1	1805156669	VTGKRQYDCCNMNJ-ISOPGZDOSA-N	448.487	1.258	50	20	IDGD	
CNC(=S)NCCC(=O)N1CCC2(CCCN(C(=O)[C@H](C)CBr)C2)CC1	1805384012	JVAWHAQBESACIZ-CQSZACIVSA-N	447.443	1.733	50	20	IDGD	
Cc1ccnc(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)c1	1808533360	NJAJJIXZDBWGJX-SIKLNZKXSA-N	444.300	1.098	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)c1cccn2ccnc12	1809888169	WLQMIOANSICWJS-JQHSSLGASA-N	427.892	1.649	50	20	IDGD	
CN(C)c1cccc(C(=O)N2CCC3(CCCN(C(=O)c4ccc(B(O)O)cc4)C3)CC2)c1	1809969695	MZZDXYSPWOOSFU-UHFFFAOYSA-N	449.360	1.591	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)c3ccc4[nH]ccc4n3)CC2)C1	1809972615	SYGMFJHBBXKJPW-UHFFFAOYSA-N	446.316	1.401	50	20	IDGD	
CCC[C@H](NC(C)=O)C(=O)N1CC[C@H](CNC(=O)[C@H](Cl)COC)[C@H]1c1cccnc1	1813037357	FSFLTTZXUFUNEI-AKHDSKFASA-N	438.956	1.646	50	20	IDGD	
C=CC[C@@H](C(=C)C)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1	1815356536	IWXIZZJPCIOZPG-SJORKVTESA-N	439.346	1.817	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCN2CCOCC2)n[nH]1	1817180583	AIUJWZXAPBDSLB-UKRRQHHQSA-N	442.358	1.908	50	20	IDGD	
C[C@@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1)n1cccc1	1817480040	ZSWSRWZAIYOXMJ-HNAYVOBHSA-N	435.293	1.458	50	20	IDGD	
Cc1ccnc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)c1	1818194117	YKDSQFSUCKSMFK-QGZVFWFLSA-N	427.509	1.792	50	20	IDGD	
CN1CCN(CC(=O)Nc2nc3c(s2)C[C@@H](NC(=O)C(C)(C)CCl)CC3)CC1	1818794227	DIGXHCOMNWUZCT-ZDUSSCGKSA-N	428.002	1.568	50	20	IDGD	
CN1CCN(CC(=O)Nc2cc([C@@H]3CCCCN3C(=O)[C@@H](F)Br)[nH]n2)CC1	1818913889	SZTHEPOBUJKXJH-XJKSGUPXSA-N	445.337	1.340	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)/C=C\C(=O)NC3CC3)sc2C1	1819532599	DBQPNFUHSMZSRR-UXFRKABBSA-N	426.926	1.144	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(Cl)ncn2)[nH]n1	1822414381	DCKPPXGBFQCFOH-CQSZACIVSA-N	448.915	1.532	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(O)nc(O)c1)CC2	1825641054	GNGQRANQQNZNSJ-IONNQARKSA-N	441.307	1.959	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc3nncn3c1)CC2	1826000322	RXHOFDNBLCDWOZ-VXGBXAGGSA-N	434.909	1.665	50	20	IDGD	
CC[C@H](O)C(=O)N1CCC([C@H]2CCCCN2C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)CC1	1827677068	FDMBUVJVYGKWHL-OADZIARCSA-N	431.537	1.511	50	20	IDGD	
COCCC(=O)N1CCC([C@H]2CCCCN2C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)CC1	1827680696	DSNVAHAECQJCNC-GXDFBKAQSA-N	431.537	1.777	50	20	IDGD	
Cc1ccnc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)c1	1827759835	BMZSSVUIWIBKJD-FQEVSTJZSA-N	429.565	1.996	50	20	IDGD	
Cc1cnoc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1	1829549660	WDOVWTHJBOGEFQ-LJQANCHMSA-N	425.294	1.210	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnn4cc(C)cnc34)C2)C1	1831651426	PJNKCRZVNVTOPL-UWJYYQICSA-N	449.939	1.515	50	20	IDGD	
O=C([C@H](F)Br)N1CCOC[C@]2(C1)CN(C(=O)C(F)(F)C(F)F)CCO2	1832190376	VYFIATIQDPSREL-UFBFGSQYSA-N	439.175	1.034	50	20	IDGD	
O=C(CCCC(F)(F)F)N1CCOC[C@]2(C1)CN(C(=O)CCBr)CCO2	1834819398	NYRBCUPVXRWUNA-HNNXBMFYSA-N	445.276	1.960	50	20	IDGD	
Cc1cccn2ncc(C(=O)N3CCC(OC4CCN(C(=O)[C@@H](O)CCl)CC4)CC3)c12	1836719525	VTOFNIBAWQPMPT-IBGZPJMESA-N	448.951	1.855	50	20	IDGD	
O=C([C@H](O)CCl)N1CCC(OC2CCN(C(=O)C(Cl)(Cl)Cl)CC2)CC1	1836719589	ZTYIBDASMBCKNW-GFCCVEGCSA-N	436.163	1.955	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3CCc4ccccc4O3)C2)C1	1839149027	QJZPJWKPCFFAAC-LRXVAGHRSA-N	436.936	1.854	50	20	IDGD	
Cc1nc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)ccc1F	1839151385	PNLMPVZRXKCHRG-OALUTQOASA-N	448.322	1.835	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)c1ccc(O)cc1)CCO2	1839171330	SDTWOLAILRBRDI-XERREHJYSA-N	440.924	1.206	50	20	IDGD	
C=C(CC(=O)OCC)C(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1839173173	CSHBPWRGHBOXCQ-HXUWFJFHSA-N	430.929	1.217	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)/C=C/c3ccoc3)C2)C1	1840031127	GILRIOLRQHJXJR-IMBDGTDHSA-N	427.295	1.533	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccc(F)cc3)C2)C1	1840151898	QOQZMCIGFCXVIA-YLJYHZDGSA-N	428.888	1.078	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc4ccoc4c3)C2)C1	1840152327	FPJLTXDQLZGWCZ-FOIQADDNSA-N	437.880	1.152	50	20	IDGD	
O=C(c1noc2c1CCCC2)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840187657	PEJJWPLWXOUDGF-GOSISDBHSA-N	432.304	1.427	50	20	IDGD	
COc1cccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)c1C	1840190802	NVZDEEGEEIBSOL-LJQANCHMSA-N	431.316	1.877	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(F)cc(Cl)c3)CCO2)C1	1840711001	BYLFLKBLRZJQHW-APWZRJJASA-N	449.306	1.803	50	20	IDGD	
Cc1ccc2nc(C(=O)N3CC4(CCCN4C(=O)c4cccc(B(O)O)c4)C3)ccc2c1	1843013941	GYGDUKFSTRQNHN-UHFFFAOYSA-N	429.285	1.354	50	20	IDGD	
O=C([C@@H](O)CCl)N1CC2(CCCN2C(=O)c2ccoc2I)C1	1843135849	FPGIVHKIESYXHA-JTQLQIEISA-N	438.649	1.301	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)c1cn(C)cn1)C2	1844692142	MGYKREFKSLUFJQ-UHFFFAOYSA-N	427.417	1.384	50	20	IDGD	
CN(CC(=O)N1CCCC12CN(C(=O)[C@@H]1C[C@H]1C1CC1)C2)NC(=O)NCc1ccccc1	1845038212	FFWYCIROJRBULO-VQTJNVASSA-N	439.560	1.582	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@H](O)CCNC(=O)OC(C)(C)C)C1	1845221393	SWZKBVYBBDXMRH-HUUCEWRRSA-N	431.961	1.873	50	20	IDGD	
O=C1C[C@H](C(=O)N2CC3(CCCN3C(=O)[C@@H](Br)Cc3ccccc3)C2)CCN1	1845942637	RWXMFQBNCNHKLD-SJORKVTESA-N	448.361	1.722	50	20	IDGD	
COc1cc(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](O)CCl)nn1-c1ccccc1F	1847560490	UCXAIRWIKJLTSQ-YESZJQIVSA-N	436.871	1.435	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](O)CCl)C1	1847565174	KQCMWFXLFCPTRO-VGWMRTNUSA-N	429.945	1.435	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2cnccc2C(=O)NN)c1	1848058968	WYSYUBUZIPEOEH-OALUTQOASA-N	437.500	1.196	50	20	IDGD	
O=C(NCc1ccc(N2CCCC2=O)cc1)NNC(=O)c1csc(N2CCOCC2)n1	9790470	NRJVVZZICMHMHY-UHFFFAOYSA-N	444.517	1.251	50	20	IDGD	
O=C(NCCCCOc1ccc(F)cc1)NNC(=O)c1csc(N2CCOCC2)n1	11417809	XOEMSVHAJGXPKE-UHFFFAOYSA-N	437.497	1.922	50	20	IDGD	
COc1ccc2c(=O)c(C(=O)NNC(=O)c3sc(N4CCOCC4)nc3C)c[nH]c2c1	46763043	YGFIFSQZKHYMOB-UHFFFAOYSA-N	443.485	1.213	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)CN2C(=O)c3ccccc3N3C(=O)CC[C@]23C)c2ccccc21	105858170	MKMIWPBVLVBHMT-XMMPIXPASA-N	445.479	1.938	50	20	IDGD	
COc1cc(C=NNC(=O)Cc2nc(C)cs2)ccc1OCC(=O)N1CCOCC1	725857700	RHKGXJJCOHTFLI-UHFFFAOYSA-N	432.502	1.391	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)NCc1cccc(NC(=O)c2ccccn2)c1	726102979	OAZWIGWZJRSDHR-UHFFFAOYSA-N	436.428	1.187	50	20	IDGD	
O=C(NNc1nc(-c2ccncc2)no1)c1ccc(S(=O)(=O)NC[C@H]2CCCO2)cc1	726376828	FXFQATJXQJCZFO-OAHLLOKOSA-N	444.473	1.346	50	20	IDGD	
CCOC(=O)C1=NN(c2ccccc2)[C@H](C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)C1	727766185	JBUFTSNFKLMTBL-KSSFIOAISA-N	442.447	1.938	50	20	IDGD	
CC(=O)NCC(=O)N1CCC[C@H]1C(=O)NNC(=O)c1cc2c(s1)CC[C@@H](C(C)(C)C)C2	728512751	JAYBCADHAOUDRL-CVEARBPZSA-N	448.589	1.787	50	20	IDGD	
CN1CCc2nc3ccccc3c(C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)c2C1	728844999	DYUMUSGOVOZVPC-UHFFFAOYSA-N	445.527	1.690	50	20	IDGD	
CC(=NNC(=O)Cn1ccc2ccccc21)c1ccc(S(=O)(=O)NCC(=O)O)cc1	729638380	IXDRFDCUIULKBX-UHFFFAOYSA-N	428.470	1.545	50	20	IDGD	
CC[C@@H]1Nc2ccc(C(=O)OCC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)cc2NC1=O	729717917	JXOWVWPPBQXMTD-AWEZNQCLSA-N	441.400	1.355	50	20	IDGD	
O=C(NCc1ccc(Br)cc1)NNC(=O)c1csc(N2CCOCC2)n1	730133005	ZDJXSTJHSZYVAG-UHFFFAOYSA-N	440.323	1.886	50	20	IDGD	
Cc1nc(N2CCOCC2)nc(O)c1CCC(=O)NNC(=O)c1cccc2ncccc12	730226772	XWIFDPVMYPTZCH-UHFFFAOYSA-N	436.472	1.269	50	20	IDGD	
CC(C)(C)[C@@H]1CCc2sc(C(=O)NNC(=O)Cn3[nH]cc4c(=O)ncnc3-4)cc2C1	730514576	AUNPKYCVDLXHKL-GFCCVEGCSA-N	428.518	1.745	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(Oc2cccc(Cl)c2)cc1)[C@@H]1CCS(=O)(=O)C1	731177002	ARLWTPDQLVKMTL-GFCCVEGCSA-N	444.918	1.877	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCc2cn3c(C)cccc3n2)nc1	731762737	JFUTZQFKVQDORH-UHFFFAOYSA-N	431.522	1.895	50	20	IDGD	
CCS(=O)(=O)N1CCC[C@@H](C(=O)NNC(=O)c2ccc(OC)c(Br)c2)C1	732033658	UELBCTKNEPRLEE-GFCCVEGCSA-N	448.339	1.280	50	20	IDGD	
C[C@@H](Oc1ccc2c(c1)CCC2)C(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	732324168	FJKNVMZJRQQNOJ-CYBMUJFWSA-N	427.413	1.855	50	20	IDGD	
C[C@H](CC(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1)C(=O)c1ccccc1	732861807	QMDIOKKANQPMML-RDTXWAMCSA-N	426.425	1.426	50	20	IDGD	
C#CCNC(=O)CN1CCCN(C(=O)/C(C#N)=C\c2cc(C)n([C@H](C)COC)c2C)CC1	733150503	LMCVYJSOZQSPQH-HBEGMLAUSA-N	439.560	1.503	50	20	IDGD	
CCOc1ccccc1N1C[C@H](C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)CC1=O	734242224	XSFSMTPSYLPASD-CQSZACIVSA-N	449.508	1.293	50	20	IDGD	
O=C(NNc1cnccn1)c1ccc(NS(=O)(=O)c2ccc3nc(O)[nH]c3c2)cc1	734242446	GZBQDFPRIQKSMO-UHFFFAOYSA-N	425.430	1.616	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3OC)CC2)cc1C	736307791	CKWABDUWHGBTEK-UHFFFAOYSA-N	444.557	1.847	50	20	IDGD	
COC(=O)Nc1ccc(CCNC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1	738494863	XBIMDGOAIAGWDG-UHFFFAOYSA-N	434.474	1.455	50	20	IDGD	
CCc1cc(NNC(=O)CNC(=O)c2cc(OC)cc(OC)c2)nc(-c2ccccn2)n1	738538510	LBHFYHYUWAQYJO-UHFFFAOYSA-N	436.472	1.991	50	20	IDGD	
Cc1[nH]c(-c2ccncc2)nc(=O)c1CC(=O)NNC(=O)c1cccc(Br)c1	742770176	VXEHNJYZCBDIBF-UHFFFAOYSA-N	442.273	1.907	50	20	IDGD	
CCOc1cc(C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)c([N+](=O)[O-])cc1OC	744518760	YJWQCGYLISYLKG-UHFFFAOYSA-N	442.384	1.492	50	20	IDGD	
O=C(CCNC(=O)c1cccs1)NNc1ccccc1S(=O)(=O)N1CCOCC1	744619676	VIAPJSVJEQCLLJ-UHFFFAOYSA-N	438.531	1.032	50	20	IDGD	
COc1ccc(S(=O)(=O)C[C@@H](C)C(=O)OCC(=O)NNC(=O)c2cccc(C)c2)cc1	745054312	XMLINWAQESFWAF-OAHLLOKOSA-N	448.497	1.418	50	20	IDGD	
Cn1cc(-c2cccc(C(=O)OCC(=O)NNC(=O)[C@H]3COc4ccccc4O3)c2)cn1	745222960	QMGQWENAALOIIX-LJQANCHMSA-N	436.424	1.231	50	20	IDGD	
CC(C)(C)c1ncc(/C=C\C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)s1	745682668	YOOKLBXRIHUJRS-HLRDLLSLSA-N	445.497	1.984	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1)c1cnn(C)c1	745838652	LPZLOINHBRGXLI-GFCCVEGCSA-N	448.530	1.988	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)C[C@@H]2C=CS(=O)(=O)C2)cc(OCC)c1OCC	746076662	ZCKWUGGEXXLQSO-ZDUSSCGKSA-N	426.491	1.592	50	20	IDGD	
Cc1nnc(-c2cccc(C(=O)NNc3ccccc3S(=O)(=O)N3CCOCC3)c2)o1	746332882	QXUPSNVGQGFUBI-UHFFFAOYSA-N	443.485	1.823	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)C1CCN(S(=O)(=O)c2ccc3c(c2)CCCC3)CC1	747598605	DUBHCHPZDZUFBV-UHFFFAOYSA-N	444.557	1.766	50	20	IDGD	
CC(C)OCCS(=O)(=O)NCC(=O)NNc1c(F)cc(F)cc1Br	747907471	MIZKHTJMCFDWOB-UHFFFAOYSA-N	430.271	1.515	50	20	IDGD	
COc1cc(OC)cc(N2CC[C@H](NC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)C2=O)c1	747955303	PGFRAZOZQORJQZ-KRWDZBQOSA-N	443.416	1.362	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)NC[C@H](c1ccc(Cl)cc1)N1CCOCC1	748624826	OXBKVXHFEYSCOK-WMLDXEAASA-N	428.917	1.095	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)NCCNC(=O)Cc2cccc(F)c2)c1C	749015459	YOESGEZIZSVYEQ-MRXNPFEDSA-N	430.480	1.899	50	20	IDGD	
NC(=O)c1cc(C(=O)NNc2nc(Br)cn3ccnc23)nn1-c1ccccc1	750243481	JJHZGZNMICIRIU-UHFFFAOYSA-N	441.249	1.533	50	20	IDGD	
CC(C)c1nc(C(=O)NNC(=O)CNC(=O)c2ccco2)nn1-c1ccccc1Cl	751200786	XYQLZWHJEGJTGG-UHFFFAOYSA-N	430.852	1.828	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)NCCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)c2ccccc21	754133796	LHSYAYCGNQNBRZ-UHFFFAOYSA-N	445.457	1.504	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N[C@H]2CCN(c3c(F)cccc3F)C2=O)cc1OC	755091155	YNAZCHLYQRYWNL-AWEZNQCLSA-N	434.399	1.732	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cc(F)c(F)c(O)c3F)CC2)cc1	755516377	GCRNPALWSLUDDW-UHFFFAOYSA-N	436.434	1.697	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)Nc1ccc(CC(=O)N2CCOCC2)cc1	755862104	MTDZLKNDXOJVRP-OAHLLOKOSA-N	444.463	1.847	50	20	IDGD	
C[C@@H](c1cccc(NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c1)N1CCOCC1	756418494	CONLMWYIAHJDCV-HNNXBMFYSA-N	436.476	1.522	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1cccc(C(=O)OCc2ccccc2)c1	756449105	IKFGDGQHYPCMCC-ZDUSSCGKSA-N	434.474	1.134	50	20	IDGD	
CCN(CC)C(=O)C1(NCC(=O)NNC(=O)c2ccc(OC)c(OC)c2)CCCCC1	756593033	FYWGZEKTIRESNT-UHFFFAOYSA-N	434.537	1.626	50	20	IDGD	
COCC[S@@](=O)Cc1cccc(NC(=O)NNC(=O)c2nnc(O)c3ccccc23)c1	756608471	CFMIKNAODHQWCL-WJOKGBTCSA-N	443.485	1.697	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)Nc1ccc(F)cc1I	756873182	ZDSIEULVGNILKP-MRVPVSSYSA-N	425.198	1.635	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)Nc1ccc(F)cc1I	756873183	ZDSIEULVGNILKP-QMMMGPOBSA-N	425.198	1.635	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)N[C@H]1CCN(C(=O)CCc2ccccc2)C1	756913603	JCOJRUUIILPEBI-HNNXBMFYSA-N	448.321	1.955	50	20	IDGD	
Cc1ccc(C)c(S(=O)(=O)Nc2ccc(C(=O)NNc3ccc(C(N)=O)nn3)cc2)c1	757406468	BOJAWIAIOQKMAJ-UHFFFAOYSA-N	440.485	1.750	50	20	IDGD	
CCO[C@@H]1C[C@H](NC(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)[C@]12CCCO2	760140946	DXBRYUABVDDGKC-HDMKZQKVSA-N	427.527	1.121	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)[C@@H]3CN(C(=O)OC(C)(C)C)CCC3(F)F)nc21	760330064	QZTMJJHSGBNDQW-JTQLQIEISA-N	427.412	1.404	50	20	IDGD	
C[C@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(NC(=O)C(=O)NNC(=O)C(C)(C)C)cc2)C1	761073653	VQGIDKLAXRPTQV-OKILXGFUSA-N	438.550	1.485	50	20	IDGD	
CCN1CCC[C@H]1CN1C[C@H](C(=O)NNC(=O)CSc2ccccc2OC)CC1=O	762361597	PHURTORJYDDFRF-CVEARBPZSA-N	434.562	1.268	50	20	IDGD	
O=C(O)COc1ccc(Br)cc1C=NNC(=O)CNC(=O)c1cccnc1	763195976	PXRNUOYLZDDEPI-UHFFFAOYSA-N	435.234	1.188	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccccc1OC[C@@H]1CCCCO1	763444013	PTTOIMXZGBHYFU-INIZCTEOSA-N	442.428	1.942	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)NCc1cccc(C(=O)N2CCOCC2)c1	763486484	OBEYRHUVYQUXBC-UHFFFAOYSA-N	444.513	1.487	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)ccc1Cl	763548490	LRHHZJRYFCYVLO-UHFFFAOYSA-N	433.804	1.645	50	20	IDGD	
COC(=O)c1cc(C(C)C)ccc1NC(=O)C(=O)NNC(=O)c1ccc2c(c1)OCO2	763550537	CTIFZQPWDWCRAK-UHFFFAOYSA-N	427.413	1.725	50	20	IDGD	
COc1cc2nc(C)sc2cc1NC(=O)C(=O)NNC(=O)[C@@H]1COc2ccccc2O1	763572980	OYCACPKTZCEFDV-INIZCTEOSA-N	442.453	1.539	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cc(F)ccc2OC(F)F)cc1	763660495	ANBXERQQAGLJNW-UHFFFAOYSA-N	427.335	1.601	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(N2CCOCC2)cc1C	763711915	JNGIQGVOJBOLCH-UHFFFAOYSA-N	440.500	1.559	50	20	IDGD	
COc1ncncc1NC(=O)C(=O)NNC(=O)COc1ccccc1Cc1ccccc1	763718899	RHXJXWVQOKSVJQ-UHFFFAOYSA-N	435.440	1.241	50	20	IDGD	
O=C(NNC(=O)C12CC3CC(CC(C3)C1)C2)C(=O)Nc1ccc2nc3n(c(=O)c2c1)CCC3	763728290	QOSKJDSTTFHORW-UHFFFAOYSA-N	449.511	1.645	50	20	IDGD	
CC(C)OCc1ccc(NC(=O)C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1	763790729	NTTMPDOTLJJIDK-UHFFFAOYSA-N	437.456	1.258	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccn(-c3ncccc3F)n2)c1C	763853439	KVZUXNOVOABKKS-AWEZNQCLSA-N	440.435	1.577	50	20	IDGD	
CN1CCCN(c2ccc(NC(=O)C(=O)NNC(=O)Cc3ccc(F)cc3)cc2)CC1	763933401	XCBNTAKNPWNBRT-UHFFFAOYSA-N	427.480	1.296	50	20	IDGD	
CC(C)Oc1ccc(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)cc1C#N	763995919	SDQZZPZAXCKENE-UHFFFAOYSA-N	434.250	1.836	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1ccc(N2CCCC2)c(F)c1	764006017	IEFVHHHYUKLNSB-UHFFFAOYSA-N	428.420	1.597	50	20	IDGD	
Cn1cc(NC(=O)C(=O)NNC(=O)c2cccc3ccccc23)cc(Br)c1=O	764051654	NUMRSFSUMPZMTN-UHFFFAOYSA-N	443.257	1.701	50	20	IDGD	
COC(=O)c1ccc(F)c(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(C)cc3)[nH]n2)c1	764111668	RHIJAKVWUPSWQK-UHFFFAOYSA-N	439.403	1.711	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)ccc1OC1CCOCC1	764166838	FOYICDLVOVJVAX-FQEVSTJZSA-N	439.468	1.642	50	20	IDGD	
CCOC(=O)COc1cccc(NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)c1	764243796	ZVKJCSKLVVTFHU-UHFFFAOYSA-N	438.440	1.369	50	20	IDGD	
CC(C)OC(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)COc2ccccc2O)c1	764278101	QZGXAIJWDLDREL-UHFFFAOYSA-N	449.847	1.776	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)C(=O)Nc1ccc(OCC2CCOCC2)cc1	764318139	BGXYGKCCLIZUMW-UHFFFAOYSA-N	429.448	1.960	50	20	IDGD	
C[C@H]1COCCN1c1ccc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)cc1	764369575	IGEIIKNQLTYPBJ-AWEZNQCLSA-N	448.426	1.669	50	20	IDGD	
COC(=O)CCc1ccc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)cc1	764378700	MDQGHCBFANRGFJ-UHFFFAOYSA-N	435.383	1.550	50	20	IDGD	
COc1nccnc1NNC(=O)C1CCN(c2ccc3nnc(C(F)(F)F)n3n2)CC1	764482540	WKRRUOPCGYLDEK-UHFFFAOYSA-N	437.386	1.301	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)c1cc2c(nc1O)CCC2	766664759	SEIZQMMJLJUTMB-UHFFFAOYSA-N	443.935	1.508	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)c1cc(S(=O)(=O)N(C)C)ccc1O	767011917	HETOWUXILVNCGJ-UHFFFAOYSA-N	427.866	1.379	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2O1)C(=O)Nc1cnc(Cl)c(Br)c1	768239888	QKSMKSJNQKMGIS-LBPRGKRZSA-N	439.653	1.587	50	20	IDGD	
Cc1nc2nc(N)nn2c(C)c1CCC(=O)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	768276977	QRAFDGGPUYBAMO-UHFFFAOYSA-N	437.439	1.246	50	20	IDGD	
O=C(O)c1ccc(S(=O)(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c(Cl)c1	768498621	ASWURKDZJHZRPT-UHFFFAOYSA-N	439.881	1.054	50	20	IDGD	
CON(C)S(=O)(=O)c1cc(C(=O)NNC(=S)Nc2ccccn2)ccc1Cl	768578273	FWQZBEXIGBHEIS-UHFFFAOYSA-N	429.911	1.548	50	20	IDGD	
Nc1c(C(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)ccnc1Br	768595174	FWXYCCPRUBKXHD-UHFFFAOYSA-N	427.642	1.698	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3cccc([S@@](C)=O)c3)n[nH]2)cc1OC	770245912	NDHHNFVYZKTZAC-SSEXGKCCSA-N	428.470	1.906	50	20	IDGD	
COc1cc(C(=O)NNc2nc(O)c3cnn(C)c3n2)ccc1OCc1cscn1	770970451	YZOBOVDPKQOYEQ-UHFFFAOYSA-N	427.446	1.870	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCCNC(=O)NNC(=O)Cn2ccc3ccccc32)s1	771974641	BYJQQKSPUYGTMW-UHFFFAOYSA-N	435.531	1.320	50	20	IDGD	
CC(C)(C)OC(=O)N1CCSC[C@@H]1CC(=O)OCC(=O)NNC(=O)c1ccccc1	772283768	CSKUYUSEEUJXFV-HNNXBMFYSA-N	437.518	1.733	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NC[C@H]1CCCN(CC(C)C)C1	772973835	ZROOBJPCZAJRAF-MRXNPFEDSA-N	438.598	1.600	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@@H]1CN(C(=O)NNC(=O)c2cc(Br)c[nH]2)CCO1	773135445	MRMCJHFMJQQGOF-LLVKDONJSA-N	446.302	1.357	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCN(C(=O)/C(C#N)=C\c3ccc(O)cc3)CC2)cc1	776595742	FPGPPEAUYREDME-VKAVYKQESA-N	427.482	1.841	50	20	IDGD	
CCOC(=O)N1CCC[C@H]([C@H](C)NCC(=O)NNC(=O)c2cc(Cl)ccc2OC)C1	776826400	GUCMBQYNVLLVNL-KBPBESRZSA-N	440.928	1.956	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cc(C)n([C@@H](C)C3CC3)n2)cc1OC	777189602	AXYZLSQMGIDNKI-ZDUSSCGKSA-N	430.461	1.798	50	20	IDGD	
O=C(/C=C/C(=O)Nc1ccc2n[nH]cc2c1)NNc1ccc(S(=O)(=O)NC2CC2)cc1	778689177	FYSMMZIVMJWSQL-MDZDMXLPSA-N	440.485	1.642	50	20	IDGD	
COCC(=O)N1CCc2cc(NC(=O)C(=O)NNC(=O)c3cccc(Cl)c3)ccc21	778706876	GMLBSWGJWSJSQZ-UHFFFAOYSA-N	430.848	1.275	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)C(=O)Nc1cc(Cl)ccc1OC[C@H]1CCOC1	778713930	OFQIANVHWWIRAE-AWEZNQCLSA-N	432.864	1.479	50	20	IDGD	
COc1cccc(NNC(=O)C2CCN(S(=O)(=O)c3cccnc3Cl)CC2)n1	780772035	QEPGTQVUQAYDHB-UHFFFAOYSA-N	425.898	1.683	50	20	IDGD	
C[C@@H]1C(=O)CC[C@@H](C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)C1(C)C	780951595	ZTRCOHOURCOFOL-QAPCUYQASA-N	436.578	1.707	50	20	IDGD	
COc1ccc(NNC(=O)[C@@H]2CCCN(S(=O)(=O)c3ccc([N+](=O)[O-])cc3)C2)nc1	781526736	ZZLUXKWZIHRJNX-CYBMUJFWSA-N	435.462	1.542	50	20	IDGD	
COc1ccc(C(=O)OCC(=O)C(C#N)=C2N(C)c3ccccc3N2C)cc1-n1cnnn1	781772415	JEGIUQIICDCJAI-UHFFFAOYSA-N	445.439	1.718	50	20	IDGD	
CC(C)(C)Cc1cc(NC(=O)C(=O)NN[C@]2(C)CCS(=O)(=O)C2)n(-c2ccccc2)n1	783428908	YRFCQLUHGDEAPD-OAQYLSRUSA-N	447.561	1.597	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C)c(C)c(NC(=O)C(=O)NNc2ccc(C)nn2)c1	783952786	RPQMPLGUDDKFOA-UHFFFAOYSA-N	434.522	1.514	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1ccc(Br)cc1F	784003800	AXZHWYLAJAGFJV-UHFFFAOYSA-N	443.254	1.166	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1cc(C(F)(F)F)ccc1Cl	784004290	VRJHCZADRSDUHX-UHFFFAOYSA-N	448.810	1.936	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)C(=O)Nc2cccc(C(=O)N3CCOCC3)c2C)c1	784854279	VAMOXHNKTJJSKA-UHFFFAOYSA-N	440.456	1.336	50	20	IDGD	
Cn1nccc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)NC2CCCCCCC2)cn1	784933293	MGQWRBFXKGLJDT-UHFFFAOYSA-N	449.537	1.288	50	20	IDGD	
O=C(NNc1cccc(C(F)(F)F)n1)C(=O)Nc1cccc(S(=O)(=O)NC2CC2)c1	784951616	PQEWCRYSQPWSHK-UHFFFAOYSA-N	443.407	1.623	50	20	IDGD	
CC(C)(C)N1C(=O)C[C@@H](C(=O)NNC(=O)C(=O)NC2CC2)[C@@H]1c1ccc(Cl)c(F)c1	785066395	OIIZQTHYRVJCRE-WBMJQRKESA-N	438.887	1.593	50	20	IDGD	
CC(C)CC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)cc1	785067833	PSGAOMACSYKMQI-UHFFFAOYSA-N	436.472	1.648	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)Cn2c(S)nc3ccccc3c2=O)c1C	785288063	WCIAVDLYSGPXRQ-AWEZNQCLSA-N	426.498	1.917	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1cccnc1Br	785331622	XFCJJDVMMHDVMV-UHFFFAOYSA-N	443.279	1.338	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1cc2c(cc1Cl)OCO2	785331775	ZTEHDFBBYCMLGU-UHFFFAOYSA-N	441.849	1.563	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2cc(-c3ccco3)nn2C(C)C)c1O	789733870	WBWRIJSFNNMCLO-UHFFFAOYSA-N	427.417	1.838	50	20	IDGD	
Cc1c(C(=O)OCC(=O)NNC(=O)c2cccs2)nnn1Cc1ccc(F)cc1F	791657535	GYPSPGJYQDOZSL-UHFFFAOYSA-N	435.412	1.593	50	20	IDGD	
O=C(NNC(=O)N1C[C@@H]2CN(Cc3ccccc3)C[C@@H]2C1)c1ccc(-n2cnnn2)cc1	792773760	XCBFQHRLNQDVNJ-KDURUIRLSA-N	432.488	1.081	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2ccncc2)c(C)n1Cc1ccc(S(N)(=O)=O)cc1	792780827	SOPCMAAMGYPUEO-UHFFFAOYSA-N	427.486	1.270	50	20	IDGD	
CC(=O)N1CCC[C@@H](CNC(=O)NNC(=O)[C@@H](C)Oc2cccc(Br)c2)C1	792781589	XKZSTMJUDMTUTO-OCCSQVGLSA-N	441.326	1.805	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)NCCc1cccc(OCC(F)(F)F)c1	792883304	OYRZQIMRKQUEQQ-UHFFFAOYSA-N	428.367	1.524	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)N[C@H]2CCN(c3cccc(Br)c3)C2=O)n1	793197653	AYODRSGYQPUAPS-HNNXBMFYSA-N	432.278	1.902	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNS(=O)(=O)c1ccc(S(C)(=O)=O)nc1	794577140	REWUWQRRVGRXHK-CYBMUJFWSA-N	449.510	1.415	50	20	IDGD	
CC(C)(C(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)c1ccc2c(c1)OCO2	796537898	UPNGJUWPSSZOMM-UHFFFAOYSA-N	429.385	1.606	50	20	IDGD	
Cc1nc(-c2ccccc2NC(=O)C(=O)NNC(=O)COc2ccccc2O)cs1	797009383	RHEPIDGJMBFJAN-UHFFFAOYSA-N	426.454	1.989	50	20	IDGD	
CCCc1c(NC(=O)C(=O)NNc2cccnn2)cnn1-c1cc(F)c(OC)cc1F	797085023	XWYJFJRJNPZJCG-UHFFFAOYSA-N	431.403	1.983	50	20	IDGD	
CC(C)Oc1ccc(NC(=O)C(=O)NNC(=O)CNC(=O)OCc2ccccc2)c(F)c1	797369474	YYJGLGWVTGOTKS-UHFFFAOYSA-N	446.435	1.625	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)Cc2ccc(C(=O)NNC(=O)c3n[nH]cc3C)cc2)cc1	799408442	VKYPKOKIKGYXSL-UHFFFAOYSA-N	441.513	1.922	50	20	IDGD	
Cc1ccccc1NS(=O)(=O)c1ccc(C)c(C(=O)NNC(=O)C(=O)NC(C)C)c1	799778738	DCZFZCQYHHRMPC-UHFFFAOYSA-N	432.502	1.390	50	20	IDGD	
NS(=O)(=O)Cc1cccc(CNC(=O)NNC(=O)c2c(Cl)cccc2Cl)c1	799915550	HAUJSUYBJYZZTD-UHFFFAOYSA-N	431.301	1.926	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)c2nn(-c3ccc(F)cc3C)cc2O)cc1	801427318	NPRYQRMWKWNZKO-UHFFFAOYSA-N	426.404	1.952	50	20	IDGD	
COc1cc(N2C[C@@H](C(=O)NNC(=O)Nc3ccccc3)CC2=O)cc(OC)c1OC	801991901	ZWUUJYYIZYFTJI-ZDUSSCGKSA-N	428.445	1.918	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)c1cccc(NN2C(=O)[C@H]3CC=CC[C@H]3C2=O)c1	804955974	YULAJEWLQZKCDP-CALCHBBNSA-N	444.455	1.697	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(CCNC(=O)NNc2ccc3c(=O)[nH]ccc3c2)CC1	806622252	GOGRZMUCVVRKMO-UHFFFAOYSA-N	430.509	1.707	50	20	IDGD	
CC(C)(C)NC(=O)CN1CCC(CNC(=O)NNc2ccc3c(=O)[nH]ccc3c2)CC1	806932390	ZACTXDLBVXIQLC-UHFFFAOYSA-N	428.537	1.781	50	20	IDGD	
CCN(CC)CC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)Cc2ccccc2C)c1	806980225	LQROFZKCPHHAQM-UHFFFAOYSA-N	439.516	1.604	50	20	IDGD	
CCN(CC)CC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)Cc2ccccc2F)c1	806980509	XPUNNMJLTGFKEF-UHFFFAOYSA-N	443.479	1.435	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)c1ccnc2ccncc12	807093671	OPWXKITXVBQXOJ-UHFFFAOYSA-N	438.919	1.862	50	20	IDGD	
CC(C)(O)c1ccc(C=NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1	807944282	VZJLCDYWKXPCLC-UHFFFAOYSA-N	431.514	1.699	50	20	IDGD	
CCc1cc(NNC(=O)CNS(=O)(=O)c2c(F)cccc2F)nc(-c2ccccn2)n1	810384286	BXWRFBXMQFFMHF-UHFFFAOYSA-N	448.455	1.801	50	20	IDGD	
CCOC(=O)NNC(=O)C(=O)Nc1cccc(C(=O)Nc2cccc(C(=O)OCC)c2)c1	810389978	PPVFCQWNNJYWES-UHFFFAOYSA-N	442.428	1.831	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)OCc2cnnn2C)cc1	811048906	HBZOYEXOKBYJSL-OQLLNIDSSA-N	435.444	1.213	50	20	IDGD	
CCOC(=O)c1ccc(NNC(=O)[C@H](C)NS(=O)(=O)c2ccc(OC)cc2)cc1C	812720707	BQOSKQLYBCBAPW-AWEZNQCLSA-N	435.502	1.990	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)c2ccc(-n3cncn3)c([N+](=O)[O-])c2)cc1	812732249	YAHGLPJPCVBDCF-UHFFFAOYSA-N	431.434	1.183	50	20	IDGD	
CC1(C)NC(=O)N(c2cccc(NC(=O)NNC(=O)COc3ccccc3C#N)c2)C1=O	812975725	OVUDRMKXMMMQMM-UHFFFAOYSA-N	436.428	1.625	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)Nc1cccc(-n2cc(C(=O)OC)nn2)c1	812978767	BYRJOSNSFGXOBE-UHFFFAOYSA-N	438.444	1.848	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2CCCN2C(=O)Nc2ccccc2)c1	813411385	ORDFZZRVYPZVKX-KRWDZBQOSA-N	430.486	1.548	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)c1cc(Cl)ncc1Br	813453729	MYMBQPLQAFECDF-UHFFFAOYSA-N	436.694	1.966	50	20	IDGD	
O=C(Cc1c(F)cc([N+](=O)[O-])cc1F)NNC(=O)C(=O)NCc1ccc(Cl)cc1	813509026	OSZXZQXVZTYJCA-UHFFFAOYSA-N	426.763	1.533	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)c1ccc2c(c1)NC(=O)CNC2=O	814248613	YASLNVJXUGYGPG-UHFFFAOYSA-N	435.465	1.875	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)Nc1ccc(C[C@@H]2CC(=O)NC2=O)cc1	814653024	POMTWAMPNZHCLR-CQSZACIVSA-N	445.501	1.291	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)C(=O)Nc1sccc1C#N	815566172	KYKRSDJRAADERV-VIFPVBQESA-N	437.275	1.936	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)cc1)C(=O)Nc1ccn(-c2ccc(Br)cc2)n1	815583105	XIELZNLTKYYOCY-UHFFFAOYSA-N	444.245	1.740	50	20	IDGD	
Cc1ccc(-c2ccc(Cl)cc2NC(=O)C(=O)NNC(=O)[C@@H]2CCc3nncn3C2)o1	815691712	YXFWCXKFKBNSDV-GFCCVEGCSA-N	442.863	1.848	50	20	IDGD	
CC(C)(C)OC(=O)N1CCc2ccc(NC(=O)C(=O)NNC(=O)[C@H]3CCCO3)cc2C1	815779605	NEEOINNYDBFOJK-MRXNPFEDSA-N	432.477	1.245	50	20	IDGD	
O=C(Cc1cncc(O)c1)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	816829900	JBPNATMJKMOJHV-UHFFFAOYSA-N	440.481	1.269	50	20	IDGD	
CC(C)S(=O)(=O)c1ccc(C(=O)NNc2ccccc2S(=O)(=O)N(C)C)cc1	817052215	XDBNVOZWGVYFIL-UHFFFAOYSA-N	425.532	1.876	50	20	IDGD	
O=C(CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@H]12)NNC(=S)NCCc1cccs1	819427715	RCVAUUGPFDTKBG-YDHLFZDLSA-N	427.621	1.512	50	20	IDGD	
COc1ccccc1NC(=S)NNC(=O)CCc1c(C)nc(N2CCOCC2)nc1O	836495654	ZRFMPYLXYRXYCV-UHFFFAOYSA-N	446.533	1.286	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@@H]2C(=O)NNC(=O)COc2ccccc2F)s1	887982442	GBKXXYCXRQSYMM-CQSZACIVSA-N	441.506	1.575	50	20	IDGD	
CCCOc1ccc(C(=O)NNS(=O)(=O)c2cccc(S(C)(=O)=O)c2)cc1OC	903951099	ADHLWPGWQXCIRT-UHFFFAOYSA-N	442.515	1.511	50	20	IDGD	
O=C(NNC(=O)c1ccc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1)c1ccncc1	912768902	NXYTYIRNVNWGJH-UHFFFAOYSA-N	441.425	1.865	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)CNS(=O)(=O)c2cc(C)ccc2C)cc1	912843500	KQHXRCUFDKBZGR-INIZCTEOSA-N	449.529	1.595	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CCN2C(=O)[C@@H]3CCCC[C@H]3C2=O)ccc1OC(C)C	913154139	KWZQATYKNAUGQB-HZPDHXFCSA-N	431.489	1.809	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCN(c2ccccc2Br)C1=O)c1ccc2c(c1)OCO2	916093148	AAJTWJLIGQDRAE-GFCCVEGCSA-N	446.257	1.992	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NN=C2C(=O)N(C(C)C)c3ccccc32)cc1	916276980	VUTYGCDKROAVKW-UHFFFAOYSA-N	428.514	1.891	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)NCCN1CCN(c2ccccc2)CC1	916514829	OZANIPPEBXUQMM-UHFFFAOYSA-N	441.532	1.617	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)N[C@@H]3C[C@H]4C[C@H]3[C@@H]3CCC[C@@H]43)nc2)CC1	916585146	QCFNSNLFOFCMEG-LZBKUMLDSA-N	448.593	1.469	50	20	IDGD	
O=C(NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)N[C@H]1CCN2CCCC[C@@H]12	916638382	FFFTUYGAXKJYER-ROUUACIJSA-N	435.550	1.042	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NN=Cc1c(C)nn([C@@H]2CCS(=O)(=O)C2)c1C	917027755	MNLNTPSPYYZVIY-MRXNPFEDSA-N	442.545	1.922	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCN(C(=O)c2ccsc2)CC1	917167255	XPNVHWXVVAJJHG-UHFFFAOYSA-N	436.921	1.629	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2cccc(F)c2[N+](=O)[O-])cc(OC)c1OC	918399947	VGRSYZKHZOYIIA-UHFFFAOYSA-N	429.382	1.383	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)OCC(=O)N[C@@H](C)C(=O)N2CCCCC2)c1C	918810326	NWIDHRHBECNJDG-IZQLPPHKSA-N	444.532	1.719	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc(C)cc1	919820250	QTSNVXFKPKZOCN-SFHVURJKSA-N	431.514	1.547	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)[C@H](CC(C)C)N1C(=O)[C@H]2CC=CC[C@@H]2C1=O	919822776	IYKSFNFOKQSZOY-BZSNNMDCSA-N	427.501	1.751	50	20	IDGD	
CCCn1nc(C(=O)NNS(=O)(=O)c2c(F)cccc2[N+](=O)[O-])c2ccccc2c1=O	920244964	JKGXVVSYJYWXMI-UHFFFAOYSA-N	449.420	1.477	50	20	IDGD	
O=C(CN1CCCC1=O)NNC(=O)[C@@H]1CC(=O)N(c2ccc3c(c2)Cc2ccccc2-3)C1	920432916	JRTHOVIBSGIXEP-QGZVFWFLSA-N	432.480	1.381	50	20	IDGD	
Cn1cnnc1CNC(=O)/C(C#N)=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	920853639	REHGCYNKDQIRAB-RIYZIHGNSA-N	438.879	1.431	50	20	IDGD	
CS(=O)(=O)C[C@@H](NC(=O)NNC(=O)c1cncn1-c1ccccc1)c1ccccc1	1254128809	BSSKBYRVXWAQJV-QGZVFWFLSA-N	427.486	1.602	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc3c(cnn3C)c2)C1	1778707306	NTXJTUBAFQGJOK-SFGWALBWSA-N	448.951	1.955	50	20	IDGD	
C[C@H](C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CO[Si](C)(C)C)C2)N1C[C@H]2C[C@H]2C1	1779249920	ILCLUICHKUIAFM-NFSXTHTRSA-N	437.657	1.692	50	20	IDGD	
Cc1ncncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)Br)C2	1779800371	GASHWEIPWYLJHG-WBHUJUFNSA-N	425.327	1.696	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cccc(SC)c3O)C2)C1	1780154643	UCFJHRDVZWPKPA-LIRRHRJNSA-N	428.938	1.811	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C1(N3CCN(C)CC3)CC1)C2	1780708570	UQTIPFUIYYEDKO-DBXWQHBBSA-N	441.016	1.298	50	20	IDGD	
CO[C@@H](C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1)c1ccccc1	1781328593	TVXHLHHTTUHZTN-RVKKMQEKSA-N	429.286	1.895	50	20	IDGD	
CN(C)c1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)cc1	1781334937	RMMXSYLEVHWZQM-CRAIPNDOSA-N	428.302	1.887	50	20	IDGD	
CC(=O)N/C(=C\c1ccco1)C(=O)N1CC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1781866169	ARZOBCLWLDKZOX-GIIHOQTISA-N	430.288	1.390	50	20	IDGD	
COC(=O)c1ccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](F)Cl)CCO3)c([N+](=O)[O-])c1	1782090119	NOXUSAYFLNELQW-KBXCAEBGSA-N	443.815	1.359	50	20	IDGD	
C#CCCCCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnccc1C(=O)NN)C2	1782358448	FJXDBMVRQIJEDG-AUSIDOKSSA-N	441.532	1.006	50	20	IDGD	
Cc1nccn1CCCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2	1782489733	PQEFSMYGRJVAGZ-SQGPQFPESA-N	426.945	1.085	50	20	IDGD	
CCC[C@H](NC(C)=O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](Cl)COC)C2	1783191007	PPEFVPQKKHAPDT-MIALQEHNSA-N	431.961	1.059	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)C(C)(C)NC(=O)OC(C)(C)C)CCO2	1783871821	WBCZIRHYPRKTMX-XOBRGWDASA-N	447.960	1.373	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)/C=C/c3ccc(OC)cc3F)CCO2)C1	1783879350	QOHRSOCJPPVCNP-JEYNVIPUSA-N	440.899	1.931	50	20	IDGD	
CCCc1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc1	1783935440	UGXNSZYDWGGKSW-HSZRJFAPSA-N	430.549	1.456	50	20	IDGD	
Cc1oc(C(C)(C)C)cc1C(=O)N1CCO[C@@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1	1783936893	WZXNKILFFGFIJO-HSZRJFAPSA-N	448.564	1.702	50	20	IDGD	
C[C@@H](Sc1ccccc1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]2C1	1784083955	IHFRKFSNSSXETH-SRIISGBFSA-N	426.966	1.747	50	20	IDGD	
COc1ccc2c(CC(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)[C@H](O)CCl)C[C@@H]43)c[nH]c2c1	1784145027	CMEKZRYTHKBLPA-KGUHOSCRSA-N	449.935	1.298	50	20	IDGD	
CCOC(CC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](Br)CC)CCO2)OCC	1784166491	HIJGUSSMGYKUBN-KBXCAEBGSA-N	435.359	1.779	50	20	IDGD	
CC(=O)N[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(C)(C)CCl)C[C@@H]21)C(C)(C)C	1784312600	QEQAQYPKFGLRSD-QAETUUGQSA-N	429.989	1.782	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3COc4ccccc4O3)[C@H]2C1	1785043587	MOGDNMHDKXXITD-MXJLVENISA-N	438.908	1.060	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3CCC3)C[C@@H]21	1785075367	IMZBGUAGAHHMKZ-QAETUUGQSA-N	443.972	1.898	50	20	IDGD	
C[C@H](CBr)C(=O)Nc1ccc(C2(NC(=O)CC[C@@H](N)C(N)=O)CCC2)cc1	1786069141	MAVXEAKPPRXOMG-IUODEOHRSA-N	439.354	1.744	50	20	IDGD	
COc1ccc(F)c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]3C2)c1OC	1787449248	DQCMVWKMAQTPDF-PMOCNGQXSA-N	432.851	1.971	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC1(c2ccc(NC(=O)CNCP(=O)(O)O)cc2)CCC1	1787971053	ZIVYUVSVXAEONN-CQSZACIVSA-N	433.829	1.099	50	20	IDGD	
Cn1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]3C2)c(C(F)F)n1	1788762468	ASFMGGHUXHLWAR-YDHLFZDLSA-N	444.555	1.803	50	20	IDGD	
COC[C@H](Cl)C(=O)NC1(c2ccc(NC(=O)c3nccnc3C(N)=O)cc2)CCC1	1789948705	LDVNROIZHMJJCD-AWEZNQCLSA-N	431.880	1.577	50	20	IDGD	
NC(=O)c1ccccc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21	1790128698	VKCIMHGBKWCDLB-FBUXBERBSA-N	442.285	1.069	50	20	IDGD	
COc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)C(Cl)Cl)C[C@@H]32)c(O)c1OC	1790163776	SUTXQNRUYOIECM-JKOKRWQUSA-N	447.315	1.806	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3cccc(OC)c3C)[C@H]2C1	1791122434	UIWCXYLGRUMBIO-GNBUJSLZSA-N	438.952	1.780	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CSc3ccncc3)C[C@@H]21	1791252312	GBGILPCFBPAPSR-LLLHUVSDSA-N	427.954	1.407	50	20	IDGD	
CCOC(=O)N[C@@H](O)C(=O)NC1(c2ccc(NC(=O)[C@H](Cl)COC)cc2)CCC1	1791568848	KAPYRVLMVWJXCX-ZBFHGGJFSA-N	427.885	1.439	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2)c1cc(Cl)cnc1O	1792386594	GIEUBMFCNYZJMQ-WDAIWFPHSA-N	432.702	1.429	50	20	IDGD	
C[C@H](CBr)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](C)[C@@H]1SC(=N)NC1=O)C2	1792988323	VPUQIYGWZZFLAN-PDWLFKFUSA-N	445.383	1.458	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1CN(C(=O)OC(C)(C)C)C1)C2	1793449879	PPMWFGCCGBMUOZ-YVSFHVDLSA-N	443.972	1.850	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1CCN1C(=O)OC(C)(C)C	1793865616	AVSUZZHUZFEPTP-XFIYOXNOSA-N	429.945	1.888	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnnn1C	1794520454	XMGJNQTVGXPQIX-BTTYYORXSA-N	442.432	1.214	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnn(C)c1	1795112256	ZVDFXIRTHUWELP-MUJYYYPQSA-N	441.444	1.819	50	20	IDGD	
COc1ccc(CCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)cc1	1796187048	JFEJTZMZMGALBL-WKCHPHFGSA-N	436.317	1.260	50	20	IDGD	
CSc1ccc(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)cc1	1796190499	GBBZDXQRTMJQNV-ACDBMABISA-N	438.358	1.583	50	20	IDGD	
Cc1cc(NC(=O)CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)C(C)(C)CCl)C3)no1	1796417696	DGNBQIJXBBYYTG-FVCICTRLSA-N	426.901	1.166	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2cc(O)ccc2n1	1796864783	HGFRINBMORDLHY-GNTLTTKYSA-N	448.317	1.927	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2)[C@@H]1CN(Cc2ccccc2)CCO1	1797245413	JSDMLONLDFXPQE-PJVZLEMVSA-N	439.915	1.011	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CS[C@H]1CCCCO1)C2	1797956878	IZEQFAKUZXMTIU-QXGSTGNESA-N	430.643	1.687	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(C)n(C(F)F)n1	1798677290	RMXYEALTCMWDCV-GFQSEFKGSA-N	449.296	1.963	50	20	IDGD	
CCOc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)CBr)C3)nn1	1798753385	QVYMCFGOASHIAO-NFFDBFGFSA-N	441.326	1.110	50	20	IDGD	
C[C@@H](Cc1ccncc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)CBr)C2	1800191047	QJRTZAHRDUWYFX-CENPHQPOSA-N	438.366	1.881	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](OC(C)=O)C(C)C)C2	1800642134	YGRHFQXNCBPXOF-JKJDWNRSSA-N	433.343	1.337	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(Cl)c(O)cc1O)C2	1800760017	XTSFOGZPVQRNHH-AMDHYVTDSA-N	447.713	1.738	50	20	IDGD	
Cc1cc2nnc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)[C@H](C)Br)c(C)n2n1	1801961766	RHWNLGKWLJKEKI-DEQVHRJGSA-N	435.326	1.776	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CC1CN(C(=O)OC(C)(C)C)C1	1802062114	PTFRANUOFSAYSR-DFGXFYAUSA-N	443.972	1.850	50	20	IDGD	
CC(C)(CCl)C(=O)NC[C@@H]1CCN(C(=O)CNCP(=O)(O)O)[C@@H]1c1cccnc1	1802900322	VDBPCMLWWRRQLS-GOEBONIOSA-N	446.872	1.077	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1CCN(C(=O)c2ccc(O)nn2)[C@H]1c1cccnc1	1803009500	RFCQUPOGRBETEQ-IFIJOSMWSA-N	448.321	1.928	50	20	IDGD	
CC(C)c1nc(CC(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)no1	1804404643	AJAQOXVBQWVVJE-RLFYNMQTSA-N	435.912	1.436	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCCC2(CCN(C(=O)c3cc4n(n3)CCNC4=O)CC2)C1	1805259181	KIPBHBMEYFTUCF-UHFFFAOYSA-N	435.956	1.736	50	20	IDGD	
O=C(CCc1ccc[nH]1)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1807458611	BMFSJFKQDQVGTP-CVDCTZTESA-N	446.316	1.042	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)c1cnn2ncccc12	1808167151	NDJHDAYPLIUIIF-QGTPRVQTSA-N	428.880	1.044	50	20	IDGD	
Cc1ncc(C(=O)NC[C@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)s1	1808907073	HPHJXIBRPGQQEQ-UZLBHIALSA-N	444.561	1.539	50	20	IDGD	
O=C(c1ccc2ccnn2c1)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1	1809973390	JLKRJPBJTRVTHS-UHFFFAOYSA-N	446.316	1.173	50	20	IDGD	
Cc1cc[nH]c1C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1	1810298057	GDBSXYAZZOZSJS-OXJNMPFZSA-N	447.499	1.350	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1CCN(C(=O)CSc2nc[nH]n2)[C@@H]1c1cccnc1	1810548425	QXVFEZGAKKQOEH-MAUKXSAKSA-N	448.625	1.849	50	20	IDGD	
Cn1cc2cc(C(=O)NC[C@@H]3CCN(C(=O)[C@@H](O)CCl)[C@H]3c3cccnc3)ccc2n1	1812095432	SICVIJARSMWEHU-VDGAXYAQSA-N	441.919	1.888	50	20	IDGD	
CCOC(=O)C1(C(=O)NC[C@@H]2CCN(C(=O)[C@H](Cl)COC)[C@@H]2c2cccnc2)CC1	1812468058	MYYILLGJQHUMSB-GVDBMIGSSA-N	437.924	1.685	50	20	IDGD	
CCOc1cnc(C(=O)N2CC[C@H](CNC(=O)[C@@H](Cl)COC)[C@@H]2c2cccnc2)cn1	1813029739	VNTUEXHGORQORI-GJYPPUQNSA-N	447.923	1.844	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2cnc3ncccn23)[C@H]1c1cccnc1	1813030192	HSQNIBLKTUNAMU-BQFCYCMXSA-N	442.907	1.698	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)CSc2nc[nH]n2)[C@@H]1c1cccnc1	1813032791	GLHALPJVFUOSJA-OFQRWUPVSA-N	438.941	1.252	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2ccc3nn[nH]c3c2)[C@H]1c1cccnc1	1813034198	DSDJQFXLUWGPCJ-GJYPPUQNSA-N	442.907	1.926	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)[C@H](O)c1ccccc1	1817079059	LRTDFUAJWXTGRK-PZJWPPBQSA-N	448.288	1.129	50	20	IDGD	
Cc1cc(NC(=O)CC(=O)N[C@H]2CCc3nc(NC(=O)[C@H](F)Cl)sc3C2)no1	1817121463	KARGSKJIJZZCEQ-RTHLEPHNSA-N	429.861	1.915	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccccc2F)[nH]n1)c1ccc(B(O)O)cc1	1817472732	URVUOJHJEQBROG-IBGZPJMESA-N	436.252	1.848	50	20	IDGD	
Cc1cnc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cnccc3C(=O)NN)n[nH]2)cn1	1819402095	MRJJJEBNALBQBS-KRWDZBQOSA-N	449.475	1.126	50	20	IDGD	
C[C@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](F)Br)n[nH]1)n1cncn1	1820936935	INZSMWQXIZZPPX-IRUJWGPZSA-N	428.266	1.945	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](F)Br)[nH]n1	1822415535	LHYANGKTRAYTBK-XHDPSFHLSA-N	447.309	1.465	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](Cc2cnc[nH]2)NC(C)=O)n[nH]1	1822704522	ZGRGSIQRHVXXQK-OIISXLGYSA-N	449.943	1.890	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1	1824010532	DVPXYACCCWVHOO-IBGZPJMESA-N	434.773	1.865	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)CCl)CC2	1825501577	GKTNBZHRAQKCPS-KOLCDFICSA-N	432.930	1.180	50	20	IDGD	
COc1cccc(C(=O)N[C@@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)c1	1826088323	DJBSQZPVSSQBHE-CQSZACIVSA-N	445.545	1.751	50	20	IDGD	
O=C(Cc1cccs1)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827052833	IUGXHGHRFPOOIR-OAQYLSRUSA-N	440.374	1.904	50	20	IDGD	
Cc1ocnc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827057492	GGIIIOSZYLKFKZ-IBGZPJMESA-N	425.294	1.210	50	20	IDGD	
N#Cc1ccccc1OCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](O)CCl)CC2	1828025774	STQRKWROECHSLI-TZMCWYRMSA-N	434.905	1.605	50	20	IDGD	
Cc1nc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)cs1	1830357688	DQZTXWRPRSEYFZ-IBGZPJMESA-N	429.970	1.715	50	20	IDGD	
CS(=O)(=O)CC(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H](F)Br)CC1	1830374635	KOMDRFTYTOULFA-JSGCOSHPSA-N	427.336	1.341	50	20	IDGD	
O=C(c1cccc2ccccc12)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1830728132	PTRCGTMGMRRHBW-SIKLNZKXSA-N	432.904	1.510	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCN2CCCC2)CC1	1831876521	IFXWFOAQJCAQET-HXUWFJFHSA-N	435.613	1.465	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)Cn2cc(C)c(O)nc2=O)CC1	1832776693	XENWYKGOZLHDHS-SJORKVTESA-N	438.956	1.894	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccnc(C(F)F)c3)CCO2)C1	1833324058	MFUCFWSHNCEVPD-KUHUBIRLSA-N	447.866	1.343	50	20	IDGD	
CC(C)c1nc(C(=O)N2CCO[C@]3(COCCN(C(=O)CCBr)C3)C2)co1	1833343028	KIEYWRXHCFLBSZ-SFHVURJKSA-N	444.326	1.653	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)Cn3cncn3)CC2)CC1	1833534066	ZYJVAGNVYUWWIV-QFBILLFUSA-N	439.004	1.893	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)c3ccnn3C)CC2)CC1	1834210714	NEYGWXLBTPQJOV-AWEZNQCLSA-N	440.386	1.636	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)C3CCCCC3)CC2)CC1)c1ccc(B(O)O)cc1	1834797995	UOHFCYAFTBJYAG-UHFFFAOYSA-N	441.381	1.132	50	20	IDGD	
CCc1ncccc1C(=O)N1CCOC[C@]2(CN(C(=O)CCBr)CCO2)C1	1834819251	LYFLPHOYVPTCIT-IBGZPJMESA-N	440.338	1.499	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)c1cc2sccn2c1	1834973881	PLBFCWKUIVIVCV-KRWDZBQOSA-N	438.981	1.786	50	20	IDGD	
Cc1nc[nH]c1C(=O)NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1	1835193005	QYPIMNJHIKCRDJ-UHFFFAOYSA-N	426.359	1.688	50	20	IDGD	
O=C(CNc1ccc(F)cc1)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836716796	QSNAQYYPWIOQFJ-IBGZPJMESA-N	441.931	1.836	50	20	IDGD	
O=C(c1ccc(O)c(F)c1)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836717878	LIKUZJJUQXRWJJ-SFHVURJKSA-N	428.888	1.743	50	20	IDGD	
O=C(c1cncc(C(F)(F)F)c1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1838181093	IBVCNDXOIIWGJN-XJKSGUPXSA-N	439.793	1.705	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cnn4cccnc34)CC2)CC1	1838309732	PDNRGWHPPUOBAK-GOSISDBHSA-N	449.939	1.595	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)Cc3cc(C)on3)CC2)CC1	1838787560	YRFIELYPUWXOPD-GOSISDBHSA-N	427.929	1.778	50	20	IDGD	
C[C@@H](C(=O)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1)c1ccc(O)cc1	1839171392	UKBIOEFRXBBEND-BFUOFWGJSA-N	431.316	1.756	50	20	IDGD	
O=C(c1ccc(-c2cc[nH]n2)cc1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1839396098	WXTJWIALMMIEET-FXAWDEMLSA-N	436.871	1.681	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3csnc3C)C2)C1	1839962807	RGMXUVZBKGWUTM-WMLDXEAASA-N	446.367	1.695	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ncc(F)cc3F)C2)C1	1840030545	PAIZBZZFVZSKAI-APPDUMDISA-N	448.264	1.213	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CSC3CCCC3)C2)C1	1840030683	SUJKPZBRBGEMCE-KSSFIOAISA-N	449.411	1.902	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccnc(C(F)F)c3)C2)C1	1840150821	QXWVHZWCOMFUDM-KUHUBIRLSA-N	447.866	1.343	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(F)cc3OC)C2)C1	1840155634	BUIBTIFACXLYSA-UZLBHIALSA-N	444.887	1.158	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCCn3cccc3)CCO2)C1	1840461824	UXQRPKKWVDINOT-WOJBJXKFSA-N	446.375	1.961	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C1(C#N)CCC1)CCO2	1840815679	DPKLERTWNCXWIU-KSSFIOAISA-N	428.327	1.310	50	20	IDGD	
COc1cc(Cl)ccc1CC(=O)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843014918	PPHOXKWOUDLNAW-UHFFFAOYSA-N	442.708	1.088	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)Cc1nc(C)no1)C2	1844692422	WALWENSSNBQZIA-UHFFFAOYSA-N	443.416	1.271	50	20	IDGD	
CC(=O)N[C@H](C(=O)N1CCCC12CN(C(=O)[C@@H](C)Br)C2)c1ccc(F)cc1	1845006921	SBPBTHDUMFNFEJ-WBMJQRKESA-N	440.313	1.990	50	20	IDGD	
O=C(OCCO)c1ccccc1C(=O)N1CC2(CCCN2C(=O)[C@H](F)Br)C1	1845218695	WTSYRXZLHSVCIE-AWEZNQCLSA-N	443.269	1.343	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)c1ccco1	1847276619	QPXSTPJBUUVZRK-TXPKVOOTSA-N	443.412	1.662	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@]1(C)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl	1847555859	AGQCQCKHGNKMHR-CJXDPKRBSA-N	429.945	1.578	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H]1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CCBr	1847954690	BENSABNLRFGJAE-IHRRRGAJSA-N	430.343	1.983	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)/C=C\c1c[nH]c2ccccc12	1848139695	CGOGUHYKMAUATA-HEQLHIRUSA-N	444.495	1.695	50	20	IDGD	
CC(=O)N[C@@H](CC(=O)NNC(=O)c1sc(N2CCOCC2)nc1C)c1cccs1	10291984	NAEDOVFOWWFVPC-ZDUSSCGKSA-N	437.547	1.378	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)c1ccc2c(c1)C[C@H](c1ccccc1)OC2=O	10302011	RAQVLJPAWBLRTE-MAUKXSAKSA-N	428.466	1.337	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)c1	17060670	UTZCBERTBORPES-UHFFFAOYSA-N	444.400	1.761	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Cn2c(C)cc3ccccc32)cc1	17406974	TZSWMLAFJIWOGK-UHFFFAOYSA-N	428.514	1.726	50	20	IDGD	
O=C(NNC(=O)C1CCN(S(=O)(=O)c2cccnc2Cl)CC1)c1ccccc1F	23685091	MKBNXDOTUHRYEW-UHFFFAOYSA-N	440.884	1.736	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)CNC(=O)Nc2ccccc2)c1	24870427	LVSNIFIYIKPLIT-UHFFFAOYSA-N	447.517	1.300	50	20	IDGD	
CS(=O)(=O)Cc1c(C(=O)OCC(=O)NNC(=O)c2cccs2)oc2ccccc12	726658692	KXOWCZNTTPGOIP-UHFFFAOYSA-N	436.467	1.657	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CS(=O)(=O)NC2CCC(C)CC2)ccc1OC(C)C	726869546	SKPFMZLWSUDONK-UHFFFAOYSA-N	441.550	1.742	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cn1	726894793	LRIQEEPTWDRUMH-UHFFFAOYSA-N	435.531	1.506	50	20	IDGD	
O=C(NNC(=S)NCC1CCC1)C1CCN(S(=O)(=O)c2ccc(F)c(F)c2)CC1	727865820	ANCYHXUUDRMEJS-UHFFFAOYSA-N	446.545	1.661	50	20	IDGD	
CC[C@H](Cc1ccccc1)NC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	727943940	KMQJCPDKMWEEJX-GOSISDBHSA-N	446.577	1.665	50	20	IDGD	
CN1CCN(C[C@H](NC(=O)NNC(=O)c2nnc(O)c3ccccc23)c2ccccc2)CC1	727945775	MNRBTHAXDUJUPZ-IBGZPJMESA-N	449.515	1.268	50	20	IDGD	
O=C(CCC/N=C1/NS(=O)(=O)c2ccccc21)NNc1nc(-c2cccnc2)no1	728075480	DSDQHDDOPVSWHQ-UHFFFAOYSA-N	427.446	1.094	50	20	IDGD	
O=C(Cn1c(=O)ccn(Cc2ccccc2)c1=O)NNC(=O)c1cccc(OC(F)F)c1	728488228	QGFMFYBCHQAGSK-UHFFFAOYSA-N	444.394	1.121	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)c1occc1CN1C(=O)Cc2ccccc21	728511390	LZLWBXOIHUUMAN-IBGZPJMESA-N	433.420	1.970	50	20	IDGD	
CCOc1cccc2c1OCC(C(=O)OCC(=O)NNC(=O)Cc1nc(C)cs1)=C2	728728544	WTHCEQQTZCZSLZ-UHFFFAOYSA-N	431.470	1.559	50	20	IDGD	
CC(=O)Nc1ccc(CCNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1	728944975	QHCBHJSSFGYDNY-UHFFFAOYSA-N	432.506	1.125	50	20	IDGD	
O=C(NCCNc1ccccc1[N+](=O)[O-])NNC(=O)C1CCN(c2ncccn2)CC1	728962123	ZLGNAZLSVIQKTM-UHFFFAOYSA-N	428.453	1.044	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)F)cc1)c1ccc(CN2C(=O)CNC2=O)cc1	728974708	ZGYCWWNANRKLAC-UHFFFAOYSA-N	438.412	1.492	50	20	IDGD	
CCNC(=O)CCCC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	729283358	GMLOTBCFMAUJIX-UHFFFAOYSA-N	438.531	1.616	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)[C@@H]2CCCN(S(=O)(=O)Cc3ccccc3)C2)c1	730495335	CBQVQOSLZLIAIS-LJQANCHMSA-N	426.498	1.561	50	20	IDGD	
Cn1nc(SCC(=O)NN=Cc2cccc(OCc3ccccc3)c2)c(=O)n(C)c1=O	730569125	OPZRLUGOCZZKQL-UHFFFAOYSA-N	439.497	1.300	50	20	IDGD	
O=C(CNS(=O)(=O)c1cccc(C(F)(F)F)c1)NNC(=O)Cc1ccccc1F	731344517	OHCPPCODURLRAE-UHFFFAOYSA-N	433.383	1.513	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)Cn1cnc2ccc(Br)cc2c1=O	731491808	ZLLQKSYOOQFDIP-UHFFFAOYSA-N	431.246	1.629	50	20	IDGD	
CCS(=O)(=O)c1ccc(Cl)c(C(=O)OCC(=O)NNC(=O)c2cccs2)c1	731522673	HUKHLIHSHXFVLY-UHFFFAOYSA-N	430.891	1.813	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CCS(=O)(=O)C2CCCC2)cc1Br	732033587	LCFVWPJOURKMMG-UHFFFAOYSA-N	433.324	1.966	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)c2sccc2S(=O)(=O)N(C)C)c1C	732053399	AKBLLUSIZLKFMK-CYBMUJFWSA-N	425.532	1.844	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCCCC2)cc1S(=O)(=O)NNC(=O)c1ccccc1	733249595	MRLZTLRWDNFPFZ-UHFFFAOYSA-N	437.543	1.793	50	20	IDGD	
COc1cc(C(=O)NNC(=O)N[C@H]2CCN(C3CCN(C)CC3)C2)ccc1OC(C)C	734284152	TUOHMPJZFMMLJA-KRWDZBQOSA-N	433.553	1.595	50	20	IDGD	
CC(C)Oc1cccc([C@@H](O)CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)c1	735088779	KOOZGOZHRWTYHZ-KRWDZBQOSA-N	449.533	1.445	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)c1ccccc1F)C(=O)NNc1ncnc2[nH]cnc12	740746468	GLKFBWUERONEMG-NSHDSACASA-N	439.498	1.035	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)C1=NN(c2ccccc2)[C@H](C(=O)OC(C)(C)C)C1	740851956	DFSZHISFMHFUPH-KRWDZBQOSA-N	445.520	1.415	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)[C@H]1CN(Cc2ccccc2)CCO1	741424275	BMOQLKPEJCVFEI-DNVCBOLYSA-N	427.461	1.828	50	20	IDGD	
CC(C)c1nn([C@H]2CCS(=O)(=O)C2)cc1C(=O)NNC(=O)COc1ccccc1F	742471958	VROPPUSKQJOFMB-ZDUSSCGKSA-N	438.481	1.345	50	20	IDGD	
CS(=O)(=O)c1nc(C(=O)NNC(=O)c2cccc(Br)c2)c2ccccn12	742771263	LERLACCRLHGAAH-UHFFFAOYSA-N	437.275	1.575	50	20	IDGD	
O=C(CCn1cnc2sccc2c1=O)NNC(=O)c1cc(Br)ccc1O	743733133	CKYCQGXPLFQVLU-UHFFFAOYSA-N	437.275	1.777	50	20	IDGD	
O=C(CCNC(=O)C1CCCCC1)NNc1ccccc1S(=O)(=O)N1CCOCC1	744619179	JOEZKDKOOHYDPT-UHFFFAOYSA-N	438.550	1.237	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1cc2cccc([N+](=O)[O-])c2[nH]1	744621507	ZOTMEXJNCYIHCD-UHFFFAOYSA-N	445.457	1.854	50	20	IDGD	
C[C@H](CC(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1)NC(=O)C1CCCC1	744622323	RTKAJYWXKJOVBQ-OAHLLOKOSA-N	438.550	1.236	50	20	IDGD	
C[C@H]1CN(C(C)(C)CNC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)C[C@H](C)O1	745408886	NMKGSWUCPVYMNJ-KBPBESRZSA-N	441.554	1.314	50	20	IDGD	
NC(=O)[C@@H]1CCCN(CCCNC(=O)NNC(=O)CSc2ccc(Cl)cc2)C1	745833616	ZBQOYHFZXDWCFV-CYBMUJFWSA-N	427.958	1.350	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCc2cccc(OCC(N)=O)c2)ccc1OC(C)C	745900425	XEGWIZDNHYGLLU-UHFFFAOYSA-N	430.461	1.491	50	20	IDGD	
Cc1nc(-c2ccc(C(=O)NNC(=O)c3sc(N4CCOCC4)nc3C)cc2)n[nH]1	746097393	HVXJKGQYPYCCLC-UHFFFAOYSA-N	427.490	1.456	50	20	IDGD	
Cc1cc(C)nc(SCc2ccc(C(=O)NNC(=O)CN3C(=O)CN(C)C3=O)cc2)n1	747458132	MBEMNSDWEKKMDE-UHFFFAOYSA-N	442.501	1.041	50	20	IDGD	
CCC[C@H](C)NC(=O)[C@H]1CCCN(CC(=O)NNC(=O)c2ccc(OC)c(OC)c2)C1	747835324	NOVXRPOSZUXAIR-RDJZCZTQSA-N	434.537	1.482	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NNc2ccc(C#N)cc2)o1	748100823	AGHCHRZFEJJIEK-HNNXBMFYSA-N	432.458	1.624	50	20	IDGD	
O=C(CNC(=O)NCc1ccc([N+](=O)[O-])cc1)NNC(=O)C12CC3CC(CC(C3)C1)C2	748214693	VQNBZUJKQPBKNG-UHFFFAOYSA-N	429.477	1.758	50	20	IDGD	
Cc1nc(Cl)cc(NNC(=O)C2CCN(S(=O)(=O)c3ccc(C#N)cc3)CC2)n1	748339109	PDCDUFULFXIZIK-UHFFFAOYSA-N	434.909	1.854	50	20	IDGD	
O=C(CN1C(=O)NC2(CCCCC2)C1=O)NNc1nc(-c2ccccn2)nc2c1CCC2	748340768	IKJCUNHXCYUSEH-UHFFFAOYSA-N	435.488	1.725	50	20	IDGD	
C[C@@H](Cn1cncn1)NC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	749211346	MTMIDSAIMBWHLK-LBPRGKRZSA-N	449.518	1.173	50	20	IDGD	
CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	749322941	HPSQJHJBHUHISL-SFHVURJKSA-N	427.392	1.724	50	20	IDGD	
NC(=O)CC[C@H](C(=O)NNC(=O)c1cc2ccccc2o1)N1C(=O)c2ccccc2C1=O	749480735	IXNCBUULWUNESE-OAHLLOKOSA-N	434.408	1.124	50	20	IDGD	
CCC[C@@H](O)CC(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccc(OC)cc2)c1	750057514	KHVBKYHQNXJPAJ-MRXNPFEDSA-N	435.502	1.808	50	20	IDGD	
COc1ccc(-c2nc(C(=O)NNC(=O)CNC(=O)c3ccco3)cs2)cc1OC	751203961	AZGYZBHQLOXQDR-UHFFFAOYSA-N	430.442	1.611	50	20	IDGD	
O=C(O)CCCOc1ccc(S(=O)(=O)NNC(=O)NCc2ccco2)cc1Cl	751271675	KMUNQUNFQYQFGD-UHFFFAOYSA-N	431.854	1.869	50	20	IDGD	
CCC(=O)NCc1cc(S(=O)(=O)NNC(=O)COCc2ccccc2)ccc1OC	751546751	CZTVNXJGHRZMQA-UHFFFAOYSA-N	435.502	1.248	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)c3cc(S(N)(=O)=O)cc(C)c3C)n[nH]2)cc1	752627245	ZVLFKGQDYSODTE-UHFFFAOYSA-N	441.513	1.978	50	20	IDGD	
COc1cc(Br)ccc1CCCNC(=O)NN[C@@]1(C)CCS(=O)(=O)C1	753386357	UBOQMDDVDZAZHK-INIZCTEOSA-N	434.356	1.771	50	20	IDGD	
CCc1c(C(=O)NNc2ccc(Cl)cc2[N+](=O)[O-])cnc2c1c(=O)n(C)c(=O)n2C	753943530	KCZXMSHWSDLPOB-UHFFFAOYSA-N	432.824	1.513	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)CCCOc1ccc(Cl)cc1Cl)S(C)(=O)=O	754677185	XOQHMIPWWFDZQS-JTQLQIEISA-N	426.322	1.916	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)CN2C(=O)COc3ccc([N+](=O)[O-])cc32)c2ccccc2n1	754777396	IBLWMTJFSVNGGR-UHFFFAOYSA-N	435.396	1.638	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(NC(=O)NNC(=O)c2cc(Br)c[nH]2)c1	755366284	GXGAXDUYVVPUPC-UHFFFAOYSA-N	430.284	1.494	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(Oc2ccccc2)c(NC(=O)NNC(=O)CO)c1	755435730	XJZIHSBDBVWNBK-UHFFFAOYSA-N	436.490	1.654	50	20	IDGD	
O=C(NNc1nc(C(F)(F)F)cs1)c1cc(S(=O)(=O)N2CCSCC2)c[nH]1	755859993	RXNIYNMMOQIVOR-UHFFFAOYSA-N	441.482	1.984	50	20	IDGD	
COC(=O)[C@H]1Cc2ccccc2CN1CC(=O)NNC(=O)c1ccc(OC)c(OC)c1	755863780	LMHPBOSJYHDLCC-QGZVFWFLSA-N	427.457	1.065	50	20	IDGD	
NC(=O)CCNC(=O)c1cccc(NC(=O)NNC(=O)Cc2cccc3ccccc23)c1	756390520	ILASRWNJVNZUFG-UHFFFAOYSA-N	433.468	1.840	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)Nc2ccc(C)c(N3CCCS3(=O)=O)c2)c1	756704246	IXNNZIBIOQKKIW-UHFFFAOYSA-N	446.489	1.355	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccn(CCc3ccncc3)n2)c1	756729717	GUUYGMWFMDTUES-UHFFFAOYSA-N	428.474	1.391	50	20	IDGD	
C[C@@H]1CN(c2nccnc2C#N)CCN1C(=O)NNC(=O)c1cnn(-c2ccccc2)c1	756941835	DZJYSWXJGYFBTN-OAHLLOKOSA-N	431.460	1.099	50	20	IDGD	
CNC(=O)Cn1nc(NC(=O)NNC(=O)[C@H](C)Oc2c(C)cc(Cl)cc2C)cc1C	757824007	VWYKRPHXCAJMID-ZDUSSCGKSA-N	436.900	1.828	50	20	IDGD	
C[C@@H]1CCCN(S(=O)(=O)c2cc(C(=O)NNc3nc(O)c4ccccc4n3)n(C)c2)C1	758298920	OJJVPCMJQJOXNK-CYBMUJFWSA-N	444.517	1.851	50	20	IDGD	
O=C(CCN1C(=O)CCc2ccccc21)N1CCN(S(=O)(=O)CBr)CC1	758524977	ZXMBQRHYSOMVRT-UHFFFAOYSA-N	444.351	1.182	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1cn(Cc2cccc(F)c2)nn1	759112433	QHZCCFBVSHUVDX-UHFFFAOYSA-N	445.480	1.142	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)[C@H]2CC(=O)N(c3cccc(C)c3C)C2)n1	759922645	XQDTYSWRULNXGA-HNNXBMFYSA-N	444.513	1.355	50	20	IDGD	
CC(C)[C@H](NS(=O)(=O)c1ccc(Br)cc1)C(=O)NNc1ncc(F)cn1	760907436	SMNPLPNNHCEPNN-ZDUSSCGKSA-N	446.302	1.824	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)CCNC(=O)[C@H]2CCCN2C(=O)OC(C)(C)C)cc1	761040803	LVCAYJAUPQTOSN-QGZVFWFLSA-N	447.536	1.460	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3ccc(OCC(F)F)nc3)CC2)cc1	761486673	FXNHMTKPURSALX-UHFFFAOYSA-N	447.486	1.613	50	20	IDGD	
CCC(C)(C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1	763443323	IKOHJNSFRTVXJO-UHFFFAOYSA-N	441.444	1.913	50	20	IDGD	
COc1ccc2c(c1)[C@H](C(=O)OCC(=O)NNC(=O)[C@@H]1COc3ccccc3O1)CC2	763450848	KUCQOCFWGNBRRL-BEFAXECRSA-N	426.425	1.256	50	20	IDGD	
CS(=O)(=O)c1ccc(F)c(NC(=O)C(=O)NNC(=O)c2cc3ccccc3cc2O)c1	763518785	YNCDAZDNBAFUPU-UHFFFAOYSA-N	445.428	1.488	50	20	IDGD	
CN(CCNC(=O)NNC(=O)CSc1ccccc1O)S(=O)(=O)c1cccs1	763532627	VBHBSYFAWGONDQ-UHFFFAOYSA-N	444.560	1.197	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2OC)c(C(F)(F)F)c1	763664344	VHQKZHLOUDXTIH-UHFFFAOYSA-N	441.362	1.888	50	20	IDGD	
COC(=O)c1c(NC(=O)C(=O)NNC(=O)COc2ccc(C)c(C)c2)sc(C)c1C	763666498	GSRFTRABSJNBDJ-UHFFFAOYSA-N	433.486	1.933	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(Cl)cc1C(=O)OC	763717521	XVLYHSGHSXOORG-UHFFFAOYSA-N	433.848	1.854	50	20	IDGD	
Cc1cc(S(N)(=O)=O)cc(NC(=O)C(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)c1C	763726835	BGAALXDTHIOWSS-UHFFFAOYSA-N	448.545	1.253	50	20	IDGD	
CCCCn1ncc(NC(=O)C(=O)NNC(=O)c2nn(CC)c(=O)c3ccccc23)c1C	763786978	TVXINZLBNCBNAF-UHFFFAOYSA-N	439.476	1.121	50	20	IDGD	
CCCCn1nccc1NC(=O)C(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12	763790413	JDSJZFIYIVLLAK-UHFFFAOYSA-N	439.476	1.374	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)c(Br)c1	763838221	QIQMXHAXFPCFSW-UHFFFAOYSA-N	440.225	1.762	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(Cl)c(C#N)c2)cc1	763872519	NWPMXOYVZKPCPP-LBPRGKRZSA-N	428.832	1.968	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCCCC3)cn1	763968611	SFJZXIXAOIAVKH-UHFFFAOYSA-N	436.515	1.215	50	20	IDGD	
Cc1nn(C)c(NC(=O)C(=O)NNC(=O)c2ccc[nH]2)c1-c1ccc(Br)cc1	763980486	JHJQMJLPLCHPRA-UHFFFAOYSA-N	445.277	1.886	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc(-n2cnc3ccccc32)nc1	764042344	HFVBJWCWEYZJCH-UHFFFAOYSA-N	430.424	1.829	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1O)C(=O)Nc1cccc(Cl)c1-n1cncn1	764124685	NWUISYYOXQKVJG-UHFFFAOYSA-N	435.227	1.679	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2ccc(C)c(C(=O)N(C)C)c2)cc1	764124695	OCPANIXOFVZKTB-UHFFFAOYSA-N	426.473	1.424	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1cccc2c1CN(c1ccccn1)C2	764139742	ZIQRJWDEKMTMCX-UHFFFAOYSA-N	445.479	1.939	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)CCc2ccccc2)cc1	764191798	GDSBHDHZMVJJAO-UHFFFAOYSA-N	446.529	1.436	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)C(=O)Nc1ccc(C(=O)NCc2ccccc2F)cc1	764298144	OPILPNOXFMWVNX-UHFFFAOYSA-N	438.419	1.187	50	20	IDGD	
CC(C)C(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c1	764350252	BYULATPXZPNGNN-UHFFFAOYSA-N	434.456	1.867	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)C(=O)Nc1ccccc1OCC(F)F	764352047	YCTXWMYOQIKFEA-UHFFFAOYSA-N	429.383	1.916	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)C(=O)Nc1ccc(C(=O)N2CCCCC2)c(Cl)c1	764355125	ZWFCIBMLQBQBDK-UHFFFAOYSA-N	443.891	1.690	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(S(=O)(=O)N3CCC[C@H](C)C3)cc2)o1	764371719	KEKFELCZUJAFCB-ZDUSSCGKSA-N	448.501	1.408	50	20	IDGD	
Cc1nnc(-c2ccc(NC(=O)C(=O)NNC(=O)c3cc(-c4cccs4)[nH]n3)cc2)o1	764382143	FTXLXPFYSBLXNK-UHFFFAOYSA-N	437.441	1.896	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)C(=O)Nc1ccc(Br)nc1	764393265	FHLATJMWCODEHF-UHFFFAOYSA-N	425.264	1.428	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1ccn(CC(F)(F)F)n1	764393544	QDHAIPYCMGSKSA-UHFFFAOYSA-N	431.396	1.332	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1cc(Cl)ccc1N1CCSCC1	764401480	XAZBISASDRWUOA-GFCCVEGCSA-N	444.941	1.031	50	20	IDGD	
C[C@H]1CN(c2ccc(C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)cn2)C[C@H](C)O1	765322048	GJHFZPFUEOBNND-GJZGRUSLSA-N	435.525	1.761	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCCS(=O)(=O)CC1CC1	765643941	KSUOUASKISFSGU-NSHDSACASA-N	448.339	1.372	50	20	IDGD	
O=C(CNC(=O)C1CCCCC1)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	765756115	LMSRHWRBWVUFLU-UHFFFAOYSA-N	449.983	1.302	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)C3C[C@@H]4CCC[C@H](C3)C4=O)CC2)cc1	766641033	IMQWHQIEUXQURE-WCRBZPEASA-N	426.561	1.655	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)NCc1ccccc1CN1CCC(O)CC1	767068028	HOSMRQFLHQUOGG-UHFFFAOYSA-N	432.546	1.873	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)c1ncccc1OCC(F)(F)F	767366281	BLGQOGKRJRTUQT-UHFFFAOYSA-N	425.363	1.878	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NN=Cc1cncs1)N(S(C)(=O)=O)CC2	767766876	YRQDFKRLOQVZIY-HNNXBMFYSA-N	438.531	1.560	50	20	IDGD	
O=C(NNc1ccc(OC(F)(F)F)cc1)Nc1cnn(CC(=O)N2CCOCC2)c1	770050509	CLBTWPCRJLZXQC-UHFFFAOYSA-N	428.371	1.789	50	20	IDGD	
CNS(=O)(=O)c1ccc(C(=O)NNC(=O)CCCOc2ccc(Cl)cc2C)cn1	770210441	XNZBRAFXTXSWSU-UHFFFAOYSA-N	440.909	1.572	50	20	IDGD	
O=C(NCC1(CCOCc2ccccc2)CC1)NNC(=O)c1ccc(-n2cnnn2)cc1	770305859	HFWPZYQIZZPPKB-UHFFFAOYSA-N	435.488	1.993	50	20	IDGD	
CCOC(=O)N1CC[C@@H](NC(=O)NNC(=O)c2ccc(OC)c(Br)c2)C1	770402967	HEWPEBYQSNECRQ-LLVKDONJSA-N	429.271	1.633	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)c2ncccc12	770773882	LWQMRZLQBKSEDB-UHFFFAOYSA-N	433.468	1.782	50	20	IDGD	
O=C(COC(=O)CCN1C(=O)c2ccccc2C1=O)NNC(=O)c1cccc(Cl)c1	771453469	ZTFGVLBAMOKERV-UHFFFAOYSA-N	429.816	1.331	50	20	IDGD	
C[C@@H](CO)NC(=O)/C(C#N)=C\c1cn(CCC(N)=O)nc1-c1ccc(Br)cc1	771779060	LOMUULVLRCGNJU-QENILXLESA-N	446.305	1.592	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1ccc(S(=O)(=O)NCc2cccs2)cc1	772052943	CZXQRLPATKDJKX-GFCCVEGCSA-N	439.515	1.329	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)CCCNC(=O)c2cccnc2)CC1	772225775	HECQFIHULCIWPP-UHFFFAOYSA-N	448.524	1.322	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@H](C(C)C)N2CCCS2(=O)=O)cc1Br	772691678	BTNUKHPBZUUJAR-AWEZNQCLSA-N	448.339	1.279	50	20	IDGD	
CC(C)CCNS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccc(C#N)cc2)cc1	773697302	OCDDOXNDPNTDCL-UHFFFAOYSA-N	429.502	1.964	50	20	IDGD	
CS(=O)(=O)Nc1ccc(OCCNC(=O)NNC(=O)c2cccc(Cl)c2)cc1	773778043	BNRSDOLPKLQQGX-UHFFFAOYSA-N	426.882	1.735	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(N3C[C@@H](C)O[C@H](C)C3)nc2)cc1F	773886443	WNGZJPMHTPMDGL-ZIAGYGMSSA-N	429.452	1.542	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccc(N2CCOC2=O)cc1	774003550	XGWNHCGEQJQRAN-LBPRGKRZSA-N	446.847	1.850	50	20	IDGD	
CCCn1nc(C(=O)NNS(=O)(=O)c2c(OC)cccc2OC)c2ccccc2c1=O	775252756	UKGWYVQQXGVNGQ-UHFFFAOYSA-N	446.485	1.447	50	20	IDGD	
CCC(CC)n1nc(C)cc1C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	775947828	NEVOPNQVVRZGKJ-GOSISDBHSA-N	430.461	1.697	50	20	IDGD	
O=C(NNC(=O)C12CC3CC(CC(C3)C1)C2)N[C@H]1CCO[C@]2(CCS(=O)(=O)C2)C1	776073052	JCQJTXVMWUYNLP-MFEJBYCUSA-N	425.551	1.270	50	20	IDGD	
CN(NC(=O)C[C@@H]1C(=O)Nc2ccccc21)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776201681	KWDUWCIVFXCNSY-HNNXBMFYSA-N	431.493	1.748	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@@H]2C(=O)NNc2cccc(S(C)(=O)=O)c2)c(OC)c1	776534371	KFZNPIIOFIYLLE-GOSISDBHSA-N	447.513	1.855	50	20	IDGD	
COc1ccc(Cl)cc1CC(=O)N1CCN(S(=O)(=O)CBr)CC1	777779029	BYNHLEIVCQFKTM-UHFFFAOYSA-N	425.732	1.718	50	20	IDGD	
CC[C@H](C)n1nc(C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)cc1C	778506744	RALYSDZFFYMWGX-AWEZNQCLSA-N	435.554	1.251	50	20	IDGD	
C[C@H](C1CC1)n1cc(NC(=O)C(=O)NNC(=O)c2cc(Br)ccc2O)cn1	778709946	LEYGLPFNNNROJL-SECBINFHSA-N	436.266	1.722	50	20	IDGD	
O=C(CN1CCC[C@H]1c1ccc2c(c1)OCCO2)NNC(=O)c1ccc([N+](=O)[O-])cc1	779326020	PRSXSSJKHVQNJY-KRWDZBQOSA-N	426.429	1.964	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCOC[C@@H]1c1noc(C(C)C)n1	779632803	VMXHZJFSQBAEJN-CQSZACIVSA-N	437.884	1.690	50	20	IDGD	
O=C(NNc1ncncc1Cl)[C@@H]1CCCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1	781830171	QVOVJQPHKKHJCV-LLVKDONJSA-N	440.869	1.582	50	20	IDGD	
CCC(CC)NC(=O)[C@@H]1CN(C(=O)C(=O)NNc2ccc(OC)cn2)c2ccccc2O1	782145403	HXKBHFZVKDKAEL-SFHVURJKSA-N	441.488	1.632	50	20	IDGD	
CNC(=O)c1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)cc1	783407349	ARKJGCFTQOHNAM-UHFFFAOYSA-N	444.391	1.422	50	20	IDGD	
COC(=O)C1(CNC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)CCCCC1	784173742	YTOQVQHDQYYMNI-UHFFFAOYSA-N	439.538	1.356	50	20	IDGD	
O=C(CCSc1ccc(F)cc1)NNC(=O)[C@@H]1CC=CC[C@H]1C(=O)N1CCOCC1	784297221	VJTLXBBDOKDNJF-QZTJIDSGSA-N	435.521	1.897	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)c(OCc2ccccc2)c1	784462732	IEHDBPUNPMGXKD-CYBMUJFWSA-N	436.490	1.365	50	20	IDGD	
CN(C)c1ccc(S(=O)(=O)N(C)C)cc1NC(=O)C(=O)NNc1ccc(Cl)nc1	784871609	RBNPKLPABQBACQ-UHFFFAOYSA-N	440.913	1.133	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNc2ccnc(N(C)C)n2)c2ccccc12	784970710	LYCKSZSESPWXPN-UHFFFAOYSA-N	438.444	1.329	50	20	IDGD	
CCS(=O)(=O)CCn1cc(C)c(NC(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)n1	786731822	HTXMOQAOIZDCGL-CYBMUJFWSA-N	441.485	1.386	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)COc2ccc(OC)cc2)c(C)cc1C	788331885	UVVHPAVWROHYSK-UHFFFAOYSA-N	429.429	1.264	50	20	IDGD	
NC(=O)N[C@H](CC(=O)NNC(=O)CN1CCCC1=O)c1cccc(Oc2ccccc2)c1	789857243	QQXHKJZSELGYIW-GOSISDBHSA-N	439.472	1.348	50	20	IDGD	
CCC[C@H](CCCS(C)(=O)=O)C(=O)NNC(=O)c1nn(CC)c(=O)c2ccccc12	789869010	PYVSFBKZGIFDGR-CQSZACIVSA-N	436.534	1.419	50	20	IDGD	
CC(C)NC(=O)NC1(C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)CCCCC1	792123952	NDEWEYVRRSIEIQ-UHFFFAOYSA-N	437.566	1.981	50	20	IDGD	
O=C(NCCCCn1cc(Br)cn1)NNC(=O)[C@@H]1COc2ccccc2O1	792220685	LDRIMOPRLKFXHZ-HNNXBMFYSA-N	438.282	1.596	50	20	IDGD	
COCC1(C(=O)NNC(=O)c2ccc3c(c2)OCO3)CCN(C(=O)OC(C)(C)C)CC1	792790081	QQMMHJGMIWAJSM-UHFFFAOYSA-N	435.477	1.840	50	20	IDGD	
CSSCCNC(=O)C(=O)Nc1cccc(S(=O)(=O)N2CCCN(C)CC2)c1	793077943	JXTMVWPTOADYNN-UHFFFAOYSA-N	446.620	1.079	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N2CCn3cncc3C2)cc1	793504341	MLTHVLVDGYGDPK-LICLKQGHSA-N	445.483	1.580	50	20	IDGD	
CCCS(=O)(=O)Nc1ccccc1C(=O)NNC(=O)CNC(=O)OCc1ccccc1	794065941	ROOLIMQQPHVEMB-UHFFFAOYSA-N	448.501	1.526	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)[C@H]2CC[C@H](C(=O)NNC(=O)c3cccc(C)n3)CC2)n1	794089614	HUKBYISGQQDJHD-WKILWMFISA-N	438.488	1.122	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)NCCN2CC=CCC2)cc1	794116372	WCAABEVBYKLMMC-CYVLTUHYSA-N	448.527	1.719	50	20	IDGD	
Cc1nc([C@@H]2CCCOC2)sc1C(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	796246390	LYJBADVGNKFWDI-CYBMUJFWSA-N	448.457	1.872	50	20	IDGD	
O=C(Cc1ccccn1)NNC(=O)Nc1ccc(NS(=O)(=O)Cc2ccccc2)cn1	797653843	MRZZPZWNYLMEOQ-UHFFFAOYSA-N	440.485	1.814	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2nnn(-c3cccc([N+](=O)[O-])c3)c2C)cc1C	798308958	RQLXWQWXJBMABZ-UHFFFAOYSA-N	437.416	1.500	50	20	IDGD	
Cc1nn(Cc2ccccc2)c(N)c1C(=O)NNC(=O)CNC(=O)OCc1ccccc1	803282728	JAORKUMDJKEQNO-UHFFFAOYSA-N	436.472	1.509	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(/C#N)C(=O)NC2CCC3(CC2)NC(=O)NC3=O)c1C	804732787	ZBLKDLJJZLMMPY-NDGGOMQJSA-N	427.505	1.856	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)N3CCC[C@H](CN(C)S(C)(=O)=O)C3)cc2C1	804868377	GDGAWMSQQXNSSD-UONOGXRCSA-N	442.607	1.831	50	20	IDGD	
COCCn1cc(C(=O)NNC(=O)c2ccc(F)cc2Br)c(=O)cc1C	806527957	SRROGUZJBXZSQG-UHFFFAOYSA-N	426.242	1.780	50	20	IDGD	
COCCc1ccnc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1	806661119	XWNUGHHCOAZDQE-UHFFFAOYSA-N	447.517	1.522	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(F)cc2OC2CCOCC2)c(O)c1	806976850	YFIUJZZYGUNPOT-UHFFFAOYSA-N	431.420	1.797	50	20	IDGD	
O=C(CC(F)(F)F)NNC(=O)NCC(=O)Nc1ccc(I)cc1	807240455	MLJSPEOJVYIOGD-UHFFFAOYSA-N	444.151	1.513	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2cccc3c2COC3=O)c1	808912787	AJHRRCXTPQIQLQ-UHFFFAOYSA-N	446.485	1.854	50	20	IDGD	
CO[C@@H](C)c1nsc(NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)n1	809924630	RBYCRKRCULYHHS-AWEZNQCLSA-N	433.538	1.611	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2CCn3c(cnc3C)C2)c1	809956711	DADGIQLQUTURHM-MRXNPFEDSA-N	433.534	1.246	50	20	IDGD	
O=C(CNS(=O)(=O)c1cccc(F)c1)NNC(=O)c1ccc(F)cc1Br	810172597	LIRFBMCYWOMZRU-UHFFFAOYSA-N	448.245	1.467	50	20	IDGD	
CC(C)CCn1nc(C(=O)NNC(=O)Nc2cc(N(C)C)ncn2)c2ccccc2c1=O	810224799	YAQIJDLNPIVPNU-UHFFFAOYSA-N	438.492	1.765	50	20	IDGD	
O=C(CC12CC3CC(CC(C3)C1)C2)NNC(=O)C(=O)Nc1cccc2c1OCC(=O)N2	810386240	RFXCZNYERRALEB-UHFFFAOYSA-N	426.473	1.710	50	20	IDGD	
NC(=O)c1ccc(OCC(F)F)c(NC(=O)C(=O)NNc2ncnc3ccsc23)c1	810392345	SEDAWSVYYGFGTM-UHFFFAOYSA-N	436.400	1.516	50	20	IDGD	
COc1nccnc1NNC(=O)CNS(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1	811074586	RCWWPGGBWVVVOP-UHFFFAOYSA-N	439.803	1.579	50	20	IDGD	
Cc1cc2ccccc2nc1NNC(=O)C(=O)Nc1cccc(CN2CCNC(=O)C2)c1	812988300	WACYXVWSSANTPY-UHFFFAOYSA-N	432.484	1.557	50	20	IDGD	
CCCCS(=O)(=O)Nc1ccc(NC(=O)NNC(=O)[C@@H]2CCc3nncn3C2)cc1	814646566	JZYULFLWGBGQLI-CYBMUJFWSA-N	435.510	1.235	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2cnc(C(F)(F)F)c(C#N)c2)c2ccccc2c1=O	814729195	FUGWUZRRGXNAQE-UHFFFAOYSA-N	430.346	1.777	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NN=Cc2ccc(Cl)cc2-n2cncn2)cc1	814729922	GIUNUCPQOFXVSZ-UHFFFAOYSA-N	446.920	2.000	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(C(C)=NNC(=O)Nc2ccc(S(N)(=O)=O)cc2)cc1	814964572	YSYUWNUKHDCGRH-UHFFFAOYSA-N	439.519	1.641	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)C(=O)Nc1cccc(C2CC2)n1	815563519	FZNWTTTZSJWFBJ-UHFFFAOYSA-N	436.516	1.257	50	20	IDGD	
COC(=O)N1CCN(c2ccc(NC(=O)C(=O)NNc3cc(C)ccc3C)cn2)CC1	815588518	RCFLIINBFQHVGX-UHFFFAOYSA-N	426.477	1.669	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCO1)C(=O)Nc1ccc(OCC(F)(F)F)c(C(F)(F)F)c1	815779556	KVCSJFNRILAZPZ-LLVKDONJSA-N	443.300	1.911	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)c1ccc(Br)cc1)C(=O)NNc1nc[nH]n1	816634121	ZCWNFBYCMYESJY-LLVKDONJSA-N	449.356	1.111	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@@H](C(=O)Nc2cccc(NC(=O)NN(C)C)c2)[C@H](C)O)cc1	819552592	YTUYEEHFBGIFSB-KBXCAEBGSA-N	449.533	1.260	50	20	IDGD	
Cc1nc(COc2ccccc2C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)no1	821882281	VGONDWQZWXSXHJ-UHFFFAOYSA-N	434.412	1.279	50	20	IDGD	
C[C@H]1CN(Cc2ccc(C(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)cc2)C[C@@H](C)O1	914781877	UFAYBSZUGPXKOD-IYBDPMFKSA-N	449.511	1.618	50	20	IDGD	
CC(=NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)c1scnc1C	915110364	SWIQMRKGPCWOPZ-UHFFFAOYSA-N	436.559	1.945	50	20	IDGD	
CCOc1ccc(/C=C(\C#N)C(=O)N2CCN(c3ccc(S(N)(=O)=O)cc3)CC2)cc1	915290777	QZCDSWHAOAJMOL-OBGWFSINSA-N	440.525	1.988	50	20	IDGD	
C[C@H](CCc1ccccc1)NC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	915884248	VNPYHUBDFRASNE-QGZVFWFLSA-N	446.577	1.665	50	20	IDGD	
COc1cc(CNC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])cc(OC)c1OC	915931466	LQEXSQOZJYCIJX-UHFFFAOYSA-N	434.405	1.530	50	20	IDGD	
O=C(NNC(=O)c1csc([N+](=O)[O-])c1)c1cccc(S(=O)(=O)N2CCCCC2)c1	916096066	FQPZMDCEUZQIDX-UHFFFAOYSA-N	438.487	1.906	50	20	IDGD	
O=C(NCc1ccccc1CS(=O)(=O)N1CCOCC1)NNc1ccc(Cl)nn1	916229565	QOGDTADTAJDAAT-UHFFFAOYSA-N	440.913	1.118	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)NCc1ccccc1S(=O)(=O)N(C)C	916237889	SUVSDWURIZHEKC-UHFFFAOYSA-N	434.518	1.409	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)NCc2ccc(C(=O)N3CCOCC3)cc2)c1	916248423	FFNYGQFQSJHMBJ-UHFFFAOYSA-N	440.500	1.685	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CCNC(=O)c2ccc([N+](=O)[O-])cc2)cc1C	916563155	ZYPXFCSINHCCKE-UHFFFAOYSA-N	427.417	1.118	50	20	IDGD	
O=C(NCC(F)(F)F)c1cccc(S(=O)(=O)NNC(=O)c2ccc(Cl)nc2)c1	917747741	WBYSOYBLKMVHDL-UHFFFAOYSA-N	436.799	1.650	50	20	IDGD	
COc1cccc(CNC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)c1OC	918017128	ZRKHUJPEEJJDJP-UHFFFAOYSA-N	435.506	1.450	50	20	IDGD	
O=C(CN1C(=O)N[C@@]2(CCc3ccccc32)C1=O)NNC(=O)c1ccc2ccccc2c1	918109068	ZNXJFALATIULGS-XMMPIXPASA-N	428.448	1.994	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)N[C@@H](c1ccc2c(c1)OCCO2)C1CC1	918139948	NKAUORNQMUIODT-LJQANCHMSA-N	435.444	1.529	50	20	IDGD	
Cc1ccc(NC(=O)C2CCN(CC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)CC2)nc1	918187716	NMIKECJRKCEBIJ-UHFFFAOYSA-N	440.460	1.410	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)NCc1ccc(N2CCOCC2)c(F)c1	918217552	FZBCWXPUPFLXNC-UHFFFAOYSA-N	447.423	1.480	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CCNS(=O)(=O)c2ccc3c(c2)CCCC3)c(O)c1	918337339	IJSNTXVGAMQBDT-UHFFFAOYSA-N	431.514	1.709	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc(C)s1	919822553	VUSIRZPMBZELJO-HNNXBMFYSA-N	437.543	1.608	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=O)Cc2ccccc2OC)ccc1F	920006354	IPWWKBGOOPSPSW-UHFFFAOYSA-N	437.493	1.869	50	20	IDGD	
CC(C)(C)OC(=O)NNC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1	920403137	VLVWYFORPFDDCB-LBPRGKRZSA-N	428.467	1.551	50	20	IDGD	
Cc1cc(C)n(-c2ccc(NC(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)cn2)n1	920928438	AEBVQGLOVRGZGN-UHFFFAOYSA-N	432.444	1.598	50	20	IDGD	
O=C(NNC(=O)c1cccc2c1OCCO2)c1cccc(S(=O)(=O)N2CCCC2)c1	921276903	LAUBQDWPSKOHSO-UHFFFAOYSA-N	431.470	1.317	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)NCCNC(=O)c1ccccc1C(F)(F)F	1116181589	BGMJPCYJDGSEME-UHFFFAOYSA-N	448.405	1.656	50	20	IDGD	
Cn1c(C(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)cc(Br)c1C=O	1318643552	GYYBVABSHPZIDN-UHFFFAOYSA-N	442.653	1.872	50	20	IDGD	
O=C(NNC(=O)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(F)cc1)c1ccccc1Cl	1324265273	JTSXGXDKLWKRBD-WBMJQRKESA-N	441.868	1.064	50	20	IDGD	
CC[S@](=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Br)C2	1779219952	FQLOYANWPHIEPG-KKJFCJBYSA-N	441.363	1.350	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cnc3snnc3c1)CCO2	1779299251	VOZVEQLNESKFLX-GOSISDBHSA-N	435.582	1.381	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCNC(=O)c1ccc[nH]1)C2	1780700579	UHJKEWGUGKMVLZ-LUQKVYGDSA-N	438.956	1.666	50	20	IDGD	
O=C(Cc1n[nH]c2cc(Cl)ccc12)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1780942430	SYVPBGXEUBSTDC-APWZRJJASA-N	441.315	1.188	50	20	IDGD	
COc1ccc(OCC(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)cc1	1781324614	BAMXOXOPMLBTLC-AEFFLSMTSA-N	445.285	1.594	50	20	IDGD	
O=C(c1cnc2ccoc2c1)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781332054	YRQZYPSYZURWFM-RHSMWYFYSA-N	426.242	1.962	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(OC)c(OC)c3O)C2)C1	1781826962	OCHLBCYAFUCEAX-JLTOFOAXSA-N	426.897	1.870	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCc1cnccn1)C2	1782002924	XPRILLCJZWFUCM-ZSZQSSIHSA-N	439.354	1.707	50	20	IDGD	
Cn1cc2cc(C(=O)N3CC[C@]4(CN(C(=O)CO[Si](C)(C)C)CCO4)C3)ccc2n1	1782243232	KIAANNNALBVRIA-NRFANRHFSA-N	430.581	1.868	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccnc4c(O)cccc34)C2)C1	1782510885	DKTTXJIAMKPYBZ-IIBYNOLFSA-N	433.892	1.638	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)C3(c4ccccc4)CCC3)C2)C1	1783797023	FYBRUXHFIGUAAM-HSZRJFAPSA-N	442.560	1.311	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3CCC(CO)CC3)[C@H]2C1	1785058185	LLAHAUSQTZGIBG-NLLISWIWSA-N	445.398	1.938	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3n[nH]c(C4CC4)c3F)[C@H]2C1	1785768387	WHBUPWQZWDFXGX-XUXIUFHCSA-N	428.892	1.273	50	20	IDGD	
Cc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](O)CCl)C[C@@H]32)c(C(F)(F)F)o1	1786063411	ZQCRKQFMYQSDJL-PYJNHQTQSA-N	438.830	1.800	50	20	IDGD	
O=C(/C=C/C(=O)c1cccs1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21	1787509974	WYHFLIISMPDRDN-HGHKQEFQSA-N	426.922	1.066	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]2C1	1789925835	WEUSSOZZMKATKO-SVNGYHJRSA-N	444.139	1.830	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4nn[nH]c4c3)[C@H]2C1	1790536163	ZTURXKAMOKMQGJ-DYIBVVGTSA-N	440.331	1.788	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cn3cnc4ccccc43)[C@H]2C1	1791179579	ZLKYCUIMKAQFPP-FPXQBCRKSA-N	434.924	1.270	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc(OC)c(C)c3)C[C@@H]21	1791249704	OTBPVUFBECZNRU-GNBUJSLZSA-N	438.952	1.780	50	20	IDGD	
C[C@@H](NC(=O)c1ccccc1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]2C1	1791297970	UKGIRSIRRUQVRQ-OEAJRASXSA-N	442.343	1.588	50	20	IDGD	
C[C@@H](Cn1ccnc1)C(=O)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1	1791869320	WJNTVGOTVRFRAV-KRWDZBQOSA-N	446.316	1.647	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ncc(F)cc1F)C2	1792868860	STWDEDGRNQQVLX-DYNIEEOBSA-N	432.265	1.594	50	20	IDGD	
COc1cc2c(O)cccc2cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](O)CCl	1792983502	KVPWOZOUVBWCQL-VLBMKZOESA-N	448.903	1.357	50	20	IDGD	
C=C[C@@H]1C[C@]1(NC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCl	1793117467	NLJOXVFBIVFMTR-VUSYMWPTSA-N	441.956	1.694	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCc1cc(F)ccn1	1794026483	ICFPORIMDMGFDY-JBYDNAENSA-N	432.323	1.979	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cn1cccn1	1795870332	IWKPXFNKVRGIGS-RNCDSHHQSA-N	441.438	1.358	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1ccc2c(c1)OCO2	1796786907	MQOUNUKTTDOCNC-JLUCKKNBSA-N	429.242	1.309	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc3cccnn3n1)C2	1796891714	HILVVGPSQMRYTI-MVRRYPJTSA-N	448.487	1.115	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cn3cccnc3n1)C2	1796892568	QXWZPICYKRJBKL-LCFLCXBCSA-N	448.487	1.115	50	20	IDGD	
COc1ccc([C@@H](O)C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CO[Si](C)(C)C)cc1	1797953892	OZQPNGBQFULXPR-WOUAJJJCSA-N	436.581	1.170	50	20	IDGD	
CCOc1cccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CO[Si](C)(C)C)c1O	1797956118	AXJZRNUSOWTHJU-CCWDJLKJSA-N	436.581	1.846	50	20	IDGD	
COc1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C3)ccn1	1798800646	LUIKNKDHKGISKR-FWKYCFCSSA-N	438.488	1.476	50	20	IDGD	
CC(=O)N/C(=C\c1ccco1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CO[Si](C)(C)C)C2	1799685650	JLIPCAYRKLOERI-ZDLRXWDGSA-N	449.580	1.198	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(-n2cncn2)c1	1799775965	UBCWQNXFUNTWNG-JJAZEVLHSA-N	448.321	1.254	50	20	IDGD	
CO[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)Br)c1ccccc1	1800757104	ULPUGVVVZWFVJU-USACIQFYSA-N	425.323	1.747	50	20	IDGD	
CCOC(=O)c1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](Cl)COC)cc1	1800979570	PQICMJSGRDFJOB-MHORFTMASA-N	438.908	1.320	50	20	IDGD	
Cc1nccn1[C@@H](C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)CBr)C2	1801453597	WVOAWTBUTPCBOU-XHXGSEDSSA-N	427.343	1.373	50	20	IDGD	
COC[C@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN1CCc3sccc3C1)C2	1802274661	WSJVOXTYOOHATE-YVSFHVDLSA-N	425.982	1.998	50	20	IDGD	
Cc1cc[nH]c1C(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1805012662	QJRJKKPUXYAICU-UTKZUKDTSA-N	426.521	1.411	50	20	IDGD	
O=C(c1ncn(-c2cccc(F)c2)n1)N1CCC2(CCCN(C(=O)[C@H](O)CCl)C2)CC1	1805519131	XBVWWEOSZSBSBD-QGZVFWFLSA-N	449.914	1.851	50	20	IDGD	
O=C([C@H](O)CCl)N1CCCC2(CCN(C(=O)[C@H]3CC(c4ccccc4)=NN3)CC2)C1	1805525854	HDTJHWNEBHIKHF-RTBURBONSA-N	432.952	1.584	50	20	IDGD	
COC(=O)CSCC(=O)N1CCCC2(CCN(C(=O)[C@H](F)Br)CC2)C1	1806036509	DKAPOIPDBYOBPA-AWEZNQCLSA-N	439.347	1.814	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC2(CCCN(C(=O)CCNC(=O)c3ccc[nH]3)C2)CC1	1806978634	BXWIPZYDNDDFNW-INIZCTEOSA-N	438.956	1.620	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)CCc2ccc[nH]2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807366257	YDXVOWUTSJGUKR-AUSIDOKSSA-N	446.316	1.042	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)cn1	1807369710	SEUAQVGMXRDZDG-DENIHFKCSA-N	444.300	1.098	50	20	IDGD	
Cn1ccc(CC(=O)NC[C@@H]2CCN(C(=O)CO[Si](C)(C)C)[C@H]2c2cccnc2)n1	1807511099	AERDQBXDODZYOP-UWJYYQICSA-N	429.597	1.915	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1CCN(C(=O)[C@@H]2CCNC(=O)C2)[C@@H]1c1cccnc1	1808317981	PNLGHUPQKBLPKW-WNJKXWAASA-N	441.359	1.850	50	20	IDGD	
CO[C@H](C)C(=O)N1CC[C@@H](CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@@H]1c1cccnc1	1808416137	FHLNZNOLLGQKFV-YKIPVZCFSA-N	440.504	1.256	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cc[n+]([O-])cc2)[C@H]1c1cccnc1)[C@H](F)Br	1808676344	PKIXJLUIRGQTNR-JYJNAYRXSA-N	437.269	1.725	50	20	IDGD	
O=C(C#Cc1ccccc1)N1CCCC2(CCN(C(=O)c3cccc(B(O)O)c3)CC2)C1	1809296710	BSPAUBARXVEOLD-UHFFFAOYSA-N	430.313	1.263	50	20	IDGD	
CCc1nc(C(=O)NC[C@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)co1	1811013118	HCTWTUZFGJFHHF-IERDGZPVSA-N	442.520	1.325	50	20	IDGD	
CCS(=O)(=O)CC(=O)N1CC[C@H](CNC(=O)[C@@H](C)Br)[C@H]1c1cccnc1	1812863942	FCKOBMIJGFAYEE-XNRPHZJLSA-N	446.367	1.306	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2nc[nH]c2[N+](=O)[O-])[C@@H]1c1cccnc1	1813030205	FDYXRFBMKVPVGY-VNHYZAJKSA-N	436.856	1.286	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1CCc2nc(NC(=O)CN3CCCC3=O)sc2C1	1814598225	ZTJLCHBZCWGVIB-BMLIUANNSA-N	433.361	1.914	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@H](O)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](F)Cl)[nH]n1	1814795635	GTQDSGYUQMVHHQ-DYEKYZERSA-N	447.895	1.822	50	20	IDGD	
CC(C)NC(=O)OC(C)(C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](O)CCl)n[nH]1	1814872553	LPNBLIONCPQUSA-KBPBESRZSA-N	443.932	1.915	50	20	IDGD	
CCC[C@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CNCP(=O)(O)O)[nH]n1	1815317556	AHTGCMBUSHSERP-AAEUAGOBSA-N	435.849	1.534	50	20	IDGD	
COc1ccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)cn1	1815441339	UYDZHOAPHUQFBZ-GOSISDBHSA-N	449.276	1.113	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)C2CCCC2)n[nH]1	1816676597	UHAIOJOVXOJRTM-QGZVFWFLSA-N	425.493	1.904	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)C23CC(C(=O)OC)(C2)C3)n[nH]1	1822148997	XXUYAHCHYGCXHF-DQSKEURASA-N	438.912	1.999	50	20	IDGD	
Cc1onc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)c1C	1824750113	NMJQKXLMKREYCD-HXUWFJFHSA-N	439.321	1.518	50	20	IDGD	
Cc1nscc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1	1825657446	OOCICANCLGTPSA-HXUWFJFHSA-N	441.362	1.678	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)Cc1cccs1)CC2	1826085458	VBALSFBNGZUMET-LBPRGKRZSA-N	435.575	1.732	50	20	IDGD	
O=C1NCCn2nc(C(=O)N3CCCC[C@H]3C3CCN(C(=O)[C@@H](F)Cl)CC3)cc21	1826197048	IRTGFANCGRWXLG-GOEBONIOSA-N	425.892	1.394	50	20	IDGD	
O=C(CN1CCOC1=O)N1CCC([C@H]2CCCCN2C(=O)CCBr)CC1	1826353365	XJUVLOIBEWVYRN-OAHLLOKOSA-N	430.343	1.843	50	20	IDGD	
Cc1cc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)ccn1	1827052101	OUVYWOQUHGVFQD-QFIPXVFZSA-N	435.333	1.617	50	20	IDGD	
Cc1nc(C)c(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)o1	1827057909	MYDQSWSBBNGYLJ-FQEVSTJZSA-N	439.321	1.518	50	20	IDGD	
C[C@@H]1C[C@@]1(C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1	1828924010	IBUAIHAAZFMGQQ-BIFSNJIPSA-N	427.549	1.965	50	20	IDGD	
C[C@@H](Nc1ccccn1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830364297	FIYFKOPPRSFSNR-IERDGZPVSA-N	438.956	1.603	50	20	IDGD	
CC(C)(C)c1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)s1	1830727837	HQVAJDHUQUCNRF-XOBRGWDASA-N	444.981	1.715	50	20	IDGD	
O=C([C@@H](F)Cl)N1CCOC[C@@]2(C1)CN(C(=O)C1(c3ccc(O)cc3)CC1)CCO2	1830811727	YPDCALPTUYATKY-VQIMIIECSA-N	426.872	1.415	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)OC(=O)OCC)C2)C1	1831658601	XZLLVKHOXYKSQP-DOXZYTNZSA-N	434.917	1.412	50	20	IDGD	
O=C(/C=C\c1c[nH]c2ccccc12)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1	1832732702	VTBLRBWIDCDDCG-RFWKKBFOSA-N	447.919	1.237	50	20	IDGD	
COC(=O)[C@@H]1CC[C@H](C(=O)NC2CCN(C3CCN(C(=O)[C@@H](F)Cl)CC3)CC2)C1	1833309745	JDLGIOWTZUGIRF-JJRVBVJISA-N	431.936	1.682	50	20	IDGD	
Cc1ccccc1NCC(=O)N1CCC(N2CCC(NC(=O)[C@H](O)CCl)CC2)CC1	1833310860	WFQXYXNPLSHLBT-HXUWFJFHSA-N	436.984	1.578	50	20	IDGD	
O=C(Cn1ccnc1)NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1	1834266627	UGVJWBYKKGGQIV-UHFFFAOYSA-N	426.359	1.240	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)CCN3CCOC3=O)CC2)CC1	1835451263	NHNIFJKJNCYDLF-GOSISDBHSA-N	442.988	1.808	50	20	IDGD	
CC(=O)N/C(C)=C/C(=O)N1CCC(N2CCC(NC(=O)CO[Si](C)(C)C)CC2)CC1	1835837980	XMSAHUYFPWEJPG-JQIJEIRASA-N	438.645	1.449	50	20	IDGD	
Cc1cc(C(=O)N2CCC(OC3CCN(C(=O)[C@H](O)CCl)CC3)CC2)nn1C(F)F	1836718620	WWFVTVVOCPYCMQ-MRXNPFEDSA-N	448.898	1.799	50	20	IDGD	
Cc1c(F)cccc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839197270	OIJINGFHSHMOPW-CRAIPNDOSA-N	447.276	1.895	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3Cl)C2)C1	1840033743	OQUIBSDWKHRNKL-PXAZEXFGSA-N	446.729	1.588	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3Cl)C2)C1	1840033746	OQUIBSDWKHRNKL-YVEFUNNKSA-N	446.729	1.588	50	20	IDGD	
COc1ccc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)cc1O	1840186597	BGTCVSJVUREXOR-IBGZPJMESA-N	447.315	1.203	50	20	IDGD	
COc1cccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)c1F	1840190177	IUEOWOQNBHXPCE-GOSISDBHSA-N	435.279	1.708	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3ncc[nH]3)CCO2)C1	1840325785	SKASLRXQEDSDNX-ZWKOTPCHSA-N	433.336	1.035	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC12CN(C(=O)[C@H](O)CNC(=O)OC(C)(C)C)C2	1841285076	BBZNUBWFEWZUAI-CHWSQXEVSA-N	448.358	1.106	50	20	IDGD	
Cn1cc(-n2cc(C(=O)N3CC4(CCCN4C(=O)[C@H](O)CCl)C3)c3ccccc32)cn1	1841351316	RUJATAGDUUIYHA-LJQANCHMSA-N	441.919	1.781	50	20	IDGD	
Cc1cnn(CC(=O)N2CCCC23CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C3)c1	1843098139	SCEOKHQYMUGBEQ-HNNXBMFYSA-N	439.944	1.527	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1cccn3cncc13)C2	1843416162	HIAWOCBKYDUFMJ-MFKUBSTISA-N	433.472	1.285	50	20	IDGD	
Cn1ncc(Br)c1C(=O)N1CC2(CCCN2C(=O)[C@@H](F)Br)C1	1845217738	RXUVLFHRSMBHON-SNVBAGLBSA-N	438.095	1.690	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)CCc1c[nH]c3ccccc13)C2	1846384522	CNBWAJWVWXQHRV-UHFFFAOYSA-N	425.533	1.677	50	20	IDGD	
N#Cc1cc(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](O)CCl)ccc1Br	1847562260	ROLPWZLSWULSGD-KKUMJFAQSA-N	426.698	1.736	50	20	IDGD	
O=C([C@@H](O)c1cccc(Br)c1)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl	1847564837	DPGGTSJIBKLBEM-AJNGGQMLSA-N	431.714	1.284	50	20	IDGD	
N#C/C(=C\c1cn(CCC(N)=O)nc1-c1ccc(Br)cc1)C(=O)OCC(N)=O	9415978	HMPZEUSGEDIRKF-KPKJPENVSA-N	446.261	1.123	50	20	IDGD	
C=C1c2ccccc2C(=O)N1[C@H](C)C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	10414584	SNXNQVJQZHFINF-LLVKDONJSA-N	448.888	1.264	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cccc(N3CCCC3=O)c2)c1	16594157	VNBAGIHITOOGBT-UHFFFAOYSA-N	430.486	1.139	50	20	IDGD	
O=C1CC(=O)Nc2cc(S(=O)(=O)NNC(=O)C34CC5CC(CC(C5)C3)C4)ccc2N1	28686754	UOUCMVAAJKKIFV-UHFFFAOYSA-N	432.502	1.493	50	20	IDGD	
C[C@@H]1CN(Cc2ccc(CNC(=O)NNC(=O)CNC(=O)c3ccco3)cc2)C[C@@H](C)O1	725870579	KWEZQHRBPHLLHO-HZPDHXFCSA-N	443.504	1.149	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)c2ncccc2O)c1	725879192	DJRSORIMUHOFPJ-UHFFFAOYSA-N	442.453	1.671	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NCc1ccnc(OCc2ccccc2)c1	726091590	KLEWBEPJQPXZQQ-UHFFFAOYSA-N	439.497	1.983	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2cnccn2)c(Br)cc1Cl	728260434	ORBJSBQTASNFFL-UHFFFAOYSA-N	449.670	1.302	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CN2CCN(CC(=O)NC3CCC(C)CC3)CC2)cc1	728293515	ASKLANJSSXJYTA-UHFFFAOYSA-N	429.565	1.069	50	20	IDGD	
NS(=O)(=O)c1ccc(CNC(=S)NNC(=O)c2cccc(OC(F)F)c2)cc1	728448816	MXDZHOPYMZLNSG-UHFFFAOYSA-N	430.458	1.245	50	20	IDGD	
Cc1nc(CSc2ccc(C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)cc2)cs1	729276023	VQUFZTGQFITJQD-JTQLQIEISA-N	428.561	1.443	50	20	IDGD	
CC[C@@H](NC(=O)NNC(=O)COc1ccc(C#N)cc1)c1cccc(S(N)(=O)=O)c1	729613863	WVVPHGFCSACNSR-QGZVFWFLSA-N	431.474	1.066	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](CCNC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)C1	730141220	SBVXKMFLJDOVMC-AWEZNQCLSA-N	444.496	1.253	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2ccc(C(=O)NNC(=O)Cc3ccccc3F)cc2)C[C@@H](C)O1	731328719	DGKXNBIEHPOPRP-GASCZTMLSA-N	449.504	1.627	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)N1CCN(CC(=O)N2CCCc3ccccc32)CC1	731358121	DYGOAVVSKQCRDN-UHFFFAOYSA-N	435.528	1.946	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)[C@@H]1CCCN1C(=O)/C=C/c1ccc(C(N)=O)cc1	731492501	KRLBODFWTUMCMI-HGZMWJMZSA-N	436.468	1.260	50	20	IDGD	
O=C(NNc1nc(-c2cccnc2)no1)c1c(F)ccc(S(=O)(=O)NC2CC2)c1F	732110641	HPXHFUXNELEICS-UHFFFAOYSA-N	436.400	1.607	50	20	IDGD	
O=C(NCCS(=O)(=O)NC[C@H]1CCCCO1)NNC(=O)c1ccc2ccccc2c1	732240237	QICFBXWZNWTXGC-GOSISDBHSA-N	434.518	1.272	50	20	IDGD	
Cc1ccccc1-n1ccnc1SCC(=O)NNC(=O)CCN1C[C@H](C)O[C@@H](C)C1	732265149	ZVQKAKWTEVJUGA-IRXDYDNUSA-N	431.562	1.920	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)N[C@@H](Cc2ccccc2)CN2CCOCC2)c1	732476835	YQUSKSZNGVAUAM-NRFANRHFSA-N	440.544	1.956	50	20	IDGD	
Cn1c(=NNC(=O)CC[C@H]2NC(=O)N(c3ccc(C#N)cc3)C2=O)sc2ccccc21	733754726	MDDFOXBZLNNOSG-OAHLLOKOSA-N	434.481	1.949	50	20	IDGD	
CCCCCS(=O)(=O)CC(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	734822459	WXISEHHQLYVFDH-UHFFFAOYSA-N	434.559	1.321	50	20	IDGD	
O=C(NNc1ccc(Cl)nn1)[C@H]1CCCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1	735689035	KBEITEKEGOMPEH-NSHDSACASA-N	440.869	1.582	50	20	IDGD	
CCCNC(=O)c1cccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1	741206671	CEAWTKOFIWFZOO-UHFFFAOYSA-N	432.502	1.152	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)N[C@@H](CNC(=O)OC(C)(C)C)C2CC2)cc1C	741425926	NDSVXUGFFAZWFL-INIZCTEOSA-N	433.509	1.876	50	20	IDGD	
O=C(CCN1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O)NNC(=O)c1ccc(Cl)cc1Cl	742482394	JZOVQSHHKSISPI-GBOPCIDUSA-N	426.256	1.307	50	20	IDGD	
O=C(Cn1cc(Br)ccc1=O)NNC(=O)c1cc(Br)ccc1O	743732172	NJRWRDFUNMBWTL-UHFFFAOYSA-N	445.067	1.540	50	20	IDGD	
COc1ccc([C@@H](CC(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)NC(C)=O)cc1	744512640	SLNWLRUXJTVHOQ-LJQANCHMSA-N	438.440	1.139	50	20	IDGD	
C[C@H](Oc1ccc(F)c(F)c1)C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	744620604	IPRKWLDRMICJMM-ZDUSSCGKSA-N	441.456	1.896	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)c2cc(Cl)nc(N3CCCC3)c2)c1	745014958	YKJBPZYYRQSKQL-UHFFFAOYSA-N	427.848	1.825	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1cc([N+](=O)[O-])ccc1O)[C@H]1CN(Cc2ccccc2)CCO1	745836587	UAJWEIVKSBNZFZ-IFXJQAMLSA-N	443.460	1.534	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)N[C@@H]2CC(=O)N([C@@H]3C[C@H]3c3ccccc3)C2)nc2ccccc21	745914122	IZYUBECAFITKOA-FUHIMQAGSA-N	446.511	1.603	50	20	IDGD	
CCSCC[C@@H](C)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	745922183	AXCLDKKYKLADAJ-CQSZACIVSA-N	444.579	1.183	50	20	IDGD	
O=C(CC[S@@](=O)c1ccc2c(c1)OCCO2)NNC(=O)c1cnn(-c2ccccc2)c1	746259257	MRDKIBPSIQQASB-WJOKGBTCSA-N	440.481	1.602	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCCC[C@H]2CNC(=O)c2ccccc2)n1	746678845	ZKYQDXVBCLITCS-KRWDZBQOSA-N	429.546	1.426	50	20	IDGD	
CSc1nc(O)nc(C)c1C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	747348826	SGMDLAHHLWZTPM-UHFFFAOYSA-N	430.534	1.186	50	20	IDGD	
COc1cc(CN2CCN(CC(=O)NNC(=O)c3ccc(C#N)cc3)CC2)cc(OC)c1	747843212	NTLUOCLROUDHCW-UHFFFAOYSA-N	437.500	1.154	50	20	IDGD	
Cc1c(CC(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cccc1[N+](=O)[O-]	747975891	RTEFLMFRUAAALD-UHFFFAOYSA-N	439.472	1.051	50	20	IDGD	
CN(C)C(=O)CN1C(=O)C(=NNC(=O)c2cccnc2)c2cc(Br)ccc21	750911526	FUGFKWDPSDBVOM-UHFFFAOYSA-N	430.262	1.413	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(N(C)C)cc2F)c1	751538717	MHPVDXRVQBUAOC-UHFFFAOYSA-N	436.509	1.997	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N[C@@H](C)c2nc[nH]n2)cc1	752640354	VHGIKQSNEILAGY-GRRFOWRYSA-N	434.460	1.337	50	20	IDGD	
CCNC(=O)C1(CNC(=O)NNC(=O)[C@@H](C)Oc2cccc(Br)c2)CCC1	753030781	VNUFGTDUWBBTBA-GFCCVEGCSA-N	441.326	1.853	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)N(C)CC(=O)NNc2ccc(C(F)(F)F)nn2)cc1	755198468	RDQJILXWXARNEA-UHFFFAOYSA-N	446.411	1.218	50	20	IDGD	
CN1CCN(C(=O)c2ccccc2NC(=O)NNC(=O)COCc2ccccc2)CC1	755622931	KHKSAQCDDHLXMV-UHFFFAOYSA-N	425.489	1.444	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)Nc2ccc(N3CCNC(=O)C3)c(Cl)c2)c1	755938293	PUEMVURZCHOLQS-UHFFFAOYSA-N	447.879	1.760	50	20	IDGD	
COc1ccc(C)cc1NC(=O)[C@H]1CCCN1CC(=O)NNC(=O)c1cccc(C#N)c1	756599229	RRTYNOWVALDXSL-LJQANCHMSA-N	435.484	1.739	50	20	IDGD	
C#Cc1cccc(NC(=S)NNC(=O)CN2C(=O)N[C@]3(C[C@@H](C)C[C@@H](C)C3)C2=O)c1	757642562	UBBOYDOQXVSASV-GFENJXEQSA-N	427.530	1.732	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(F)(F)[C@H](C(=O)OCC(=O)NNC(=O)c2cccs2)C1	759291170	PCDANBHWXFXELT-NSHDSACASA-N	447.460	1.945	50	20	IDGD	
CO[C@@](C)(C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1)c1ccccc1F	759294926	QLQMLOXNJWNJMU-DYESRHJHSA-N	432.404	1.218	50	20	IDGD	
C[C@H](C1CC1)n1nccc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	760289881	HDOVLKDXIJIWED-LLVKDONJSA-N	425.424	1.783	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCC2CN(C(=O)OC(C)(C)C)C2)c2ccccc2c1=O	763055558	NLOHWNIOIQRZJJ-UHFFFAOYSA-N	444.492	1.227	50	20	IDGD	
O=C(CC[S@@](=O)c1ccc2c(c1)OCCO2)NNC(=O)c1cc(-c2cccs2)[nH]n1	763159739	YISAZOWFESCVJZ-SSEXGKCCSA-N	446.510	1.868	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1OC(C)C	763573606	UBERAJKCQYNFEU-SFHVURJKSA-N	429.429	1.408	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)Nc1cccc(-c2n[nH]c(C3CC3)n2)c1	763575103	PZTLJKRDTVSFIQ-QGZVFWFLSA-N	448.439	1.275	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cc(C)oc2C)ccc1Br	763575971	CCKYOOPOZDQBRJ-UHFFFAOYSA-N	438.234	1.845	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1ccc(C(=O)NC(C)(C)C)cc1	763630208	XPTUDZDSEPSDOW-UHFFFAOYSA-N	436.472	1.571	50	20	IDGD	
CCC(=O)Nc1ccc(C)c(NC(=O)C(=O)NNC(=O)COc2ccc(OC)cc2)c1	763660597	CNKBZWSRXRCPIP-UHFFFAOYSA-N	428.445	1.517	50	20	IDGD	
CCCc1ccc(NC(=O)C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1	763734276	JCXLLLTWXIMWEM-UHFFFAOYSA-N	446.529	1.354	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)C(=O)Nc2cc(C)ccc2C)cc1	763738731	XCLQOUACDQGMGT-UHFFFAOYSA-N	432.502	1.018	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)cccc1C(=O)N1CCCC1	763814153	QMMOXFXZMMYFKY-UHFFFAOYSA-N	449.467	1.268	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)c(OC)c1OC	763841017	NFTZLLDCPAMCBX-AWEZNQCLSA-N	445.472	1.883	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)C(=O)Nc1cccn(Cc2ccccc2)c1=O	763841894	UYDSCEYPPCDUAI-UHFFFAOYSA-N	438.415	1.201	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)NC(=O)CS2	763864062	FMPQTSRDBMFGQI-SNVBAGLBSA-N	432.433	1.423	50	20	IDGD	
C[C@@H]1CN(Cc2cccc(NC(=O)C(=O)NNC(=O)Cc3ccc(F)cc3)c2)C[C@@H](C)O1	763919795	VOIICZBDMBKKMF-HZPDHXFCSA-N	442.491	1.764	50	20	IDGD	
COc1cc(F)c(NC(=O)C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc1F	763947961	HOGNJNVTUKWLGF-UHFFFAOYSA-N	431.355	1.264	50	20	IDGD	
Cc1ccc(Cn2nccc2NC(=O)C(=O)NNC(=O)C2=S=C3CCCCCC3=C2)o1	763960880	ACEFOTXPXXCFRI-UHFFFAOYSA-N	441.513	1.901	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)C(=O)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1	763996254	NMJANWODAWDZIZ-KRWDZBQOSA-N	435.488	1.068	50	20	IDGD	
CC(C)Cc1cc(NC(=O)C(=O)NNC(=O)c2cc(Br)cn2C)n(C)n1	764004364	FGRRDLVLIIFKAS-UHFFFAOYSA-N	425.287	1.119	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cnccn2)nn1-c1ccc(Cl)c(Cl)c1	764025693	YSYZQEGJAUBVKU-UHFFFAOYSA-N	434.243	1.677	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cc(C)n(-c3ccc(Cl)cc3Cl)n2)n[nH]1	764106778	SDPHEMPVQLRJPV-UHFFFAOYSA-N	436.259	1.919	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2cc3c(cc2F)CCC(=O)N3)cc1	764128094	ZEDYKJFYOHTBMA-UHFFFAOYSA-N	428.420	1.438	50	20	IDGD	
N#Cc1cccc(Oc2ccc(NC(=O)C(=O)NNC(=O)[C@H]3Cc4ccccc4O3)cn2)c1	764154734	UGYCBYLMGFJEMO-LJQANCHMSA-N	443.419	1.835	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)sc2c1CCC2	764164489	QNKJMKGHKQDKGH-AWEZNQCLSA-N	443.481	1.503	50	20	IDGD	
CCOC(=O)c1ccn(-c2ccccc2NC(=O)C(=O)NNC(=O)c2ccc(C#N)cc2)n1	764181233	ABTNISXWPKUOKL-UHFFFAOYSA-N	446.423	1.320	50	20	IDGD	
CN(C1CC1)S(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)CCc2ccccc2)cc1	764184664	CBSGDTTWRFQTFQ-UHFFFAOYSA-N	444.513	1.188	50	20	IDGD	
CC(C)(C)CC(=O)NNC(=O)C(=O)Nc1ccc(Cl)c(S(=O)(=O)N2CCCC2)c1	764198206	DVFBBQQDIXSYCS-UHFFFAOYSA-N	444.941	1.647	50	20	IDGD	
NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cccc(OC(F)F)c2)cc1Cl	764250853	PDPPCGASFBXMEP-UHFFFAOYSA-N	426.763	1.440	50	20	IDGD	
CCCNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2cccc(OC(F)F)c2)c1	764259026	BAIKFRWQKYZDER-UHFFFAOYSA-N	434.399	1.828	50	20	IDGD	
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC(=O)C(=O)NNC(=O)Cc2cccnc2)cc1	764268378	KXTHSVNKUHOSHR-AWEZNQCLSA-N	441.488	1.996	50	20	IDGD	
CCN1CCN(c2ccc(Cl)cc2NC(=O)C(=O)NNC(=O)Cc2cccnc2)CC1	764269169	YXYHDPMGSIXWHJ-UHFFFAOYSA-N	444.923	1.206	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)C(=O)Nc1cc(F)ccc1OC[C@H]1CCCO1	764314003	QDRWSOIFDVGJFF-OAHLLOKOSA-N	433.411	1.851	50	20	IDGD	
Cc1ccc(Cn2cccc(NC(=O)C(=O)NNC(=O)COCc3ccccc3)c2=O)cc1	764368507	XKQODKJOTYGGQY-UHFFFAOYSA-N	448.479	1.508	50	20	IDGD	
COC(=O)c1ccsc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccc(C)c(C)c2)[nH]n1	764386405	HXHZJTNSDAUZFX-UHFFFAOYSA-N	441.469	1.941	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)cn1C	764389133	XKTXVBYXVMQXOC-UHFFFAOYSA-N	442.407	1.131	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2F)ccc1N1C(=O)CCC1=O	764413162	NVWPRCQNVVEQMJ-UHFFFAOYSA-N	446.822	1.841	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2ccc(C(=O)NC(C)C)cc2)cc1	767192384	ZKWPZPUUSUPCPA-UHFFFAOYSA-N	446.529	1.215	50	20	IDGD	
CC(=NNC(=O)Cc1cc(C)[nH]n1)c1ccc(S(=O)(=O)N2CCCC[C@@H]2C(=O)O)cc1	767402715	DZWDPJKKXXVHKF-GOSISDBHSA-N	447.517	1.429	50	20	IDGD	
N#Cc1ccc(N2CCN(C(=O)NNC(=O)CNC(=O)c3cccs3)CC2)c(Cl)c1	767797662	GUPBVYDEXRZCRM-UHFFFAOYSA-N	446.920	1.566	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)CO[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1	767852253	FFJUIHBEMQKCFF-QGZVFWFLSA-N	436.509	1.671	50	20	IDGD	
CCNC(=O)NNS(=O)(=O)c1ccc(F)c2ncc(I)cc12	768273550	KIUFBQFJUIJDQB-UHFFFAOYSA-N	438.222	1.491	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)[C@@H](Cc1ccc(F)cc1)n1nnnc1C	768635512	CWTMFMFKVIAPJT-OAHLLOKOSA-N	448.480	1.460	50	20	IDGD	
COC[C@@H](C)NC(=O)NNC(=O)c1ccc(CN(C)S(=O)(=O)c2ccc(C)cc2)cc1	770327013	KVCFRDMHEQPFOC-MRXNPFEDSA-N	448.545	1.795	50	20	IDGD	
O=C(NNc1c(F)cccc1Cl)C(=O)Nc1cccc(N2CCS(=O)(=O)CC2)c1	770805912	HWRIRESYXJSSKL-UHFFFAOYSA-N	440.884	1.796	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1cccc(S(=O)(=O)Nc2ccc(OC)cc2)c1	771882483	PRYNISFAFBESLT-CYBMUJFWSA-N	449.485	1.599	50	20	IDGD	
Cc1cc(C(=O)N2CCC[C@H]2C(=O)O[C@H](C)C(=O)NNC(=O)CC(C)C)ccc1[N+](=O)[O-]	772076647	RPKIHHUKPYMLAU-PBHICJAKSA-N	448.476	1.633	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCCNC(=O)NNC(=O)Cc2ccc(Cl)cc2)s1	772631206	RZGZPSZYGCGPHI-UHFFFAOYSA-N	430.939	1.561	50	20	IDGD	
CON(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)cc1	772964157	QEDYIFKPDIORPE-LBPRGKRZSA-N	441.893	1.750	50	20	IDGD	
Cc1ncsc1C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)CCC(=O)N2CC1CC1	773495891	GTOJIHCDRCDXMU-UHFFFAOYSA-N	427.486	1.540	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cn(C)nc2C(F)(F)F)c1C	773528681	PTFXNUUTHNDMHR-NSHDSACASA-N	427.383	1.609	50	20	IDGD	
Cc1cc(C(=O)N2CCOCC2)ccc1NC(=O)C(=O)NNc1ccc([N+](=O)[O-])cc1	773645745	PJDFGLVJDQBSGP-UHFFFAOYSA-N	427.417	1.457	50	20	IDGD	
COc1ccc(Cn2nccc2NC(=O)C(=O)NNc2nccnc2C(C)C)c(OC)c1	773992279	HQTPKPMXQSLAAA-UHFFFAOYSA-N	439.476	1.944	50	20	IDGD	
CCCCNS(=O)(=O)c1cccc(NC(=O)C(=O)NNc2nccnc2C(C)C)c1	774000145	PDKZOJQXZLYCSW-UHFFFAOYSA-N	434.522	1.760	50	20	IDGD	
CCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)cc1	774011391	YPOBHDVCOUQNDW-GFCCVEGCSA-N	432.864	1.643	50	20	IDGD	
COc1cccc(/C=C(\C(=O)NNc2cccc(S(C)(=O)=O)c2)n2nnnc2C)c1	776714447	DLQSNIMXAVHWBI-WOJGMQOQSA-N	428.474	1.535	50	20	IDGD	
COC(=O)C1(CNC(=O)NNC(=O)[C@@H]2Cc3ccccc3CN2Cc2ccccc2)CC1	776865389	FRPYHFAMQNWRSJ-FQEVSTJZSA-N	436.512	1.897	50	20	IDGD	
CC(=O)N1CCc2cc(C(=O)N3CCN(S(=O)(=O)CBr)CC3)ccc21	777777651	NXEUKMBEJMUEPX-UHFFFAOYSA-N	430.324	1.036	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)NNC(=O)CNC(=O)c2ccco2)c2ccccc12	777933052	LBVNBSCQYMHRFF-UHFFFAOYSA-N	430.442	1.131	50	20	IDGD	
Cc1ccc(Cl)c(OCC(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1	778221876	LNBRITWWDWTAEC-QGZVFWFLSA-N	434.832	1.558	50	20	IDGD	
CC(=O)N1CCN(c2cccc(NC(=O)NNc3cccc(S(C)(=O)=O)c3)c2)CC1	782080566	ASRUZBSMYFBYMP-UHFFFAOYSA-N	431.518	1.907	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cccc(C(F)(F)F)c2)c(OC)c1	782120206	HIMXKSDEGXYIIV-UHFFFAOYSA-N	439.346	1.900	50	20	IDGD	
O=S(=O)(CBr)NC[C@@H]1CCC[C@@H](NS(=O)(=O)CBr)C1	782437530	NFINHOUFEHCWDE-RKDXNWHRSA-N	442.195	1.089	50	20	IDGD	
COc1ccc(Cl)cc1S(=O)(=O)NNC(=O)C1CCN(c2ncccn2)CC1	782463016	MXJDUESJYCXILX-UHFFFAOYSA-N	425.898	1.365	50	20	IDGD	
O=C(NNc1ccc(Cl)cc1)C(=O)Nc1ccc(N2CCN(C(=O)C3CC3)CC2)nc1	783340117	MTNPSGONQUTCHS-UHFFFAOYSA-N	442.907	1.875	50	20	IDGD	
CCCc1c(NC(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)cnn1-c1cccc(C#N)c1	784469007	LXUSEEZLTBUESW-CQSZACIVSA-N	430.490	1.284	50	20	IDGD	
CCOc1cc2c(cc1NC(=O)C(=O)NNC(=O)c1cc([N+](=O)[O-])ccc1O)O[C@H](C)C2	785023285	MNCIEYTVFMLKFO-SNVBAGLBSA-N	444.400	1.422	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)Nc1cnn(-c2ccccc2Cl)c1	785024656	WWAZKYGVDBYNLV-UHFFFAOYSA-N	444.791	1.539	50	20	IDGD	
CC(C)(C)C(=O)NCc1ccc(Cl)c(C(=O)NNC(=O)C(=O)Nc2ccccn2)c1	786323200	DJTGIGGZEIQHNZ-UHFFFAOYSA-N	431.880	1.797	50	20	IDGD	
C[C@@H]1[C@H](C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)CCN1C(=O)OC(C)(C)C	786368512	LYIZIPRSMAOVFR-CZUORRHYSA-N	430.461	1.508	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)N[C@@H]1CCN(c2cccc(Br)c2)C1	787369611	LHKNUFFNMGKXRM-GXTWGEPZSA-N	429.315	1.410	50	20	IDGD	
CN1CCC(n2ccc(NC(=O)C(=O)NNC(=O)c3cccc(Br)c3)n2)CC1	787543755	NDWXHDYDOFBFIW-UHFFFAOYSA-N	449.309	1.312	50	20	IDGD	
O=C(NNC(=O)c1[nH]nnc1-c1ccccc1)c1ccc(S(=O)(=O)N2CCCC2)cc1	788623862	HFWZREPXZLHEOV-UHFFFAOYSA-N	440.485	1.331	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2cccc3c2OCC[C@@H]3N(C)C)c1O	789734066	ZZAQXGQAZKSWMD-HNNXBMFYSA-N	428.445	1.186	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)N3CCC[C@@H](N4CCCS4(=O)=O)C3)cc2C1	789829460	OYOGLOIEADNWLV-UKRRQHHQSA-N	440.591	1.727	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCc2nnc3n2CCOC3)ccc1OCCC(C)C	790675023	UJPDBKKGHBCRGI-UHFFFAOYSA-N	432.481	1.386	50	20	IDGD	
CNS(=O)(=O)c1cccc2c1CCN(C(=O)NNC(=O)CCCc1ccccc1)C2	790692289	CJCFKNHMNWNNPS-UHFFFAOYSA-N	430.530	1.717	50	20	IDGD	
C[C@@H]1CCC2=S=C(C(=O)NNC(=O)C(=O)Nc3cc([C@H]4CCCOC4)nn3C)C=C2C1	790951575	JHZOWXGYNDBZCG-OLZOCXBDSA-N	445.545	1.238	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)Nc1ccccc1N1C[C@H]2CC[C@H]1C2	790956861	MWEQETDOCWOISP-AUSJPIAWSA-N	436.468	1.601	50	20	IDGD	
CN(C)c1cccc(CCC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1	792011998	KTLXKBGJVDTIAM-UHFFFAOYSA-N	444.557	1.931	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)c3cccc(C)n3)CC2)cc1	794083458	IRYZZLFIGXXFLI-UHFFFAOYSA-N	444.513	1.455	50	20	IDGD	
C[C@H]1[C@@H](NCC(=O)NNC(=O)c2cccc(C#N)c2)[C@H](C)CCN1C(=O)OC(C)(C)C	796646382	AYBRUKDKAZBUHK-VCBZYWHSSA-N	429.521	1.943	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)Nc2ccc(S(=O)(=O)N3C[C@H](C)O[C@@H](C)C3)cc2)n1	797607830	BWYORIPTIFLETE-GJZGRUSLSA-N	447.517	1.654	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(S(=O)(=O)NNC(=O)c2cccc(C#N)c2)c1	800836324	QOQNZZLRTWCYLK-UHFFFAOYSA-N	436.515	1.212	50	20	IDGD	
O=C(N=c1cc[nH]cc1)NNC(=O)c1ccc(NC2=NS(=O)(=O)c3ccccc32)cc1	802030659	MLEALBUIIHKQPC-UHFFFAOYSA-N	436.453	1.531	50	20	IDGD	
C[C@H]1[C@H](NC(=O)NNC(=O)c2csc(N3CCOCC3)n2)CCN1Cc1ccccc1	807619969	CWDFWZGMUPNUTD-DOTOQJQBSA-N	444.561	1.587	50	20	IDGD	
O=C(CN1CC[C@](CO)(Cc2ccc(F)cc2)C1)NNC(=O)c1ccc([N+](=O)[O-])cc1	808795291	SQCBZMXSSQXMTF-NRFANRHFSA-N	430.436	1.422	50	20	IDGD	
O=C(NNC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1)c1cnc2[nH]c(O)nc2c1	809555647	DFPNWTIDOXRTPY-UHFFFAOYSA-N	440.423	1.986	50	20	IDGD	
C#Cc1ccccc1CC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	809957685	UIGQYWYPGVHKRJ-UHFFFAOYSA-N	425.510	1.846	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)[C@H](Cc2cnc[nH]2)NC(=O)CC(C)C)c1C	809961304	DAEPOKKJIOJURO-WMZOPIPTSA-N	429.521	1.715	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccnn2-c2ccccc2)cc1	813033147	GYLQHQVPFITVNR-UHFFFAOYSA-N	428.474	1.204	50	20	IDGD	
COC(=O)[C@@H](CF)NC(=O)/C(C#N)=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	813690741	NRTUHMFZDASUCN-LPDYGMJQSA-N	447.854	1.613	50	20	IDGD	
CN(NS(=O)(=O)CCC1CCOCC1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	814273851	FBNKDTDGZANMHM-UHFFFAOYSA-N	434.559	1.242	50	20	IDGD	
CN(c1ccccc1NC(=O)C(=O)NNC(=O)[C@@H]1CCc2nncn2C1)C1CCCC1	815692554	ULJNQYQBVNGZBA-CQSZACIVSA-N	425.493	1.005	50	20	IDGD	
CCn1cnc2c1c(=O)n(CC(=O)NN=C1CCn3cccc31)c(=O)n2Cc1ccccc1	818244305	ZKOJKESSXFQWKV-UHFFFAOYSA-N	445.483	1.154	50	20	IDGD	
O=C(COC(=O)CN1c2cccc3cccc(c23)S1(=O)=O)NNC(=O)c1cccs1	842770963	FXAPZRSONOSQFD-UHFFFAOYSA-N	445.478	1.414	50	20	IDGD	
CSC[C@H](C(=O)NNC(=O)COc1ccc(C)c(C)c1)N1C(=O)[C@H]2CCCC[C@H]2C1=O	864002565	LQPPFRXMXFDSJX-FGTMMUONSA-N	447.557	1.736	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)CN2C(=O)[C@H]3CCCC[C@@H]3C2=O)cc1OC	913069656	ZPLAKEJWCSKJCA-HOTGVXAUSA-N	431.489	1.810	50	20	IDGD	
Cc1cc(C)c(N2C[C@H](C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)CC2=O)c(C)c1	914752299	LULMBXQZMHLPPX-QGZVFWFLSA-N	433.472	1.402	50	20	IDGD	
COC(=O)c1ccccc1S(=O)(=O)N1CCC(C(=O)NNC(=O)C2CCCC2)CC1	914842820	QGPDGRWPXCACQR-UHFFFAOYSA-N	437.518	1.212	50	20	IDGD	
O=C(COC(=O)[C@@H]1CC(=O)N(C2CCCCC2)C1)NNC(=O)c1ccc([N+](=O)[O-])cc1	914928612	IYIWCPDEBOAWSH-CQSZACIVSA-N	432.433	1.080	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)c2sc(-c3c(C)c(C)nn(C)c3=O)nc2C)cc1	915190520	ATEAGZDGYROFRM-UHFFFAOYSA-N	441.513	1.977	50	20	IDGD	
C[C@]1(NNC(=O)NCc2nnc3c(Cl)cc(C(F)(F)F)cn23)CCS(=O)(=O)C1	916221809	YKJGUJCYVWHASH-ZDUSSCGKSA-N	440.835	1.283	50	20	IDGD	
C=CCN1C(=O)C(=NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)c2ccccc21	916278496	MBAOWFUUDCSAKB-UHFFFAOYSA-N	426.498	1.669	50	20	IDGD	
COc1cc(C=NNC(=O)[C@@H](C)CN2CCCCC2)ccc1OCC(=O)N1CCOCC1	916361252	UNBMGYSPPJFCPS-SFHVURJKSA-N	446.548	1.505	50	20	IDGD	
CCN1CCN(Cc2ccc(CNC(=O)NNC(=O)Cn3nc(C)cc3C)cc2)CC1	916418582	LYLABGWVYMJMPS-UHFFFAOYSA-N	427.553	1.168	50	20	IDGD	
C[C@@H]1CCCN(CCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)C1	916452330	JQAZWEFCLWRZLG-MRXNPFEDSA-N	437.566	1.147	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)sc(C)c1C	916562794	FQQAAVUXSBJFLQ-UHFFFAOYSA-N	447.469	1.713	50	20	IDGD	
CC(C)N1C(=O)c2ccc(C(=O)NNC(=O)c3c[nH]c4ccccc34)cc2S1(=O)=O	916745882	SLEATJGHTCDCKP-UHFFFAOYSA-N	426.454	1.796	50	20	IDGD	
O=C(NCc1cccc(NC(=O)[C@@H]2CCCO2)c1)NNC(=O)c1cccc([N+](=O)[O-])c1	920238575	YIXYZXXNJJKOGU-KRWDZBQOSA-N	427.417	1.857	50	20	IDGD	
O=C(NCCc1cccs1)NNC(=O)[C@@H]1CC(=O)N(c2ccc3c(c2)OCCO3)C1	920861308	RQIRONHLKVFHJU-CYBMUJFWSA-N	430.486	1.445	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1CNC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	920919099	DEVPLRMREJAVOE-UHFFFAOYSA-N	449.489	1.816	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)c1n[nH]cc1I	1116649786	YPSOFUICJMISBM-UHFFFAOYSA-N	432.243	1.576	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)(F)F)cc1)[C@H]1CC12CCS(=O)(=O)CC2	1323279682	REYGHDNYXUGZCQ-GFCCVEGCSA-N	426.438	1.638	50	20	IDGD	
Cc1ccc2[nH]c(C(=O)N3CC[C@@]4(CN(C(=O)CCC(=O)NN(C)C)CCO4)C3)cc2c1	1777743974	KCPLTTHUFXSAMG-HSZRJFAPSA-N	441.532	1.293	50	20	IDGD	
Cn1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)c(C(F)F)n1	1779295496	PJUBAXWYBJLGOP-GOSISDBHSA-N	430.528	1.653	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccnc3c1OCO3)C2	1779545511	UZCQWJHZJMBIER-IIBYNOLFSA-N	449.580	1.789	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(C1)CN(C(=O)C(F)F)CCO2	1780096857	JDIRWDNLLCLUOB-GOSISDBHSA-N	427.360	1.229	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cn1ccccc1=O)C2)[C@H](F)Br	1780771928	UMFYMXFQNYUNSG-RPVQJOFSSA-N	444.301	1.053	50	20	IDGD	
CC(C)=NO[C@@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Br)C1	1780776747	KYXXJUCQFRUSKV-QDEZUTFSSA-N	436.322	1.992	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3nc(OC)ccc3[N+](=O)[O-])CCO2)C1	1781218570	NUFNNZGKVJLUEG-XIKOKIGWSA-N	426.857	1.459	50	20	IDGD	
O=C(c1ccc2c[nH]nc2c1)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781332131	ZXJAPVZSMDQMIZ-WMLDXEAASA-N	425.258	1.697	50	20	IDGD	
CC(=O)N/C(=C\c1ccco1)C(=O)N1CC[C@@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1781865437	IMQOTKTUKCJBKZ-SARUNTBLSA-N	449.580	1.438	50	20	IDGD	
CCOc1cnc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](Cl)COC)C2)cn1	1782170836	ARNJPKUYGAVRKF-YYFZDKIDSA-N	440.928	1.257	50	20	IDGD	
Cc1cccc(F)c1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCC(=O)NN(C)C)C1	1782214278	NGLZRSDTISZYHH-WZONZLPQSA-N	448.539	1.635	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc4n(n3)CCCN(C)C4)C2)C1	1782559015	MDKXEEHDQDEFRR-DYESRHJHSA-N	437.972	1.570	50	20	IDGD	
O=C(/C=C/c1cccc(O)c1)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1783272948	FRKANNPTPMUYTI-HRMTXBTBSA-N	427.270	1.926	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(-n4cnnc4)cc3)CCO2)C1	1783533384	UASPLNSKGGWYLO-KUHUBIRLSA-N	448.321	1.494	50	20	IDGD	
Cc1nccn1CCCC(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](C)Br)C2)C1	1783539818	OCODWOIVEKZACH-KSSFIOAISA-N	427.343	1.585	50	20	IDGD	
COc1ccccc1OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21	1783779123	UGGNOBWDBGXMHR-XEZPLFJOSA-N	431.316	1.857	50	20	IDGD	
Cc1c(C(=O)N2CCO[C@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)ccc(F)c1F	1783936985	BWYVBFDJRYEDGB-NRFANRHFSA-N	438.475	1.090	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3csc(N)n3)C[C@@H]21	1783968526	WOVKWJFXBHYSST-ZPFDUUQYSA-N	431.356	1.350	50	20	IDGD	
COC(=O)CCCCCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2	1784047697	DGLGPUCSQXZQRJ-KDOFPFPSSA-N	433.343	1.723	50	20	IDGD	
Cc1nn(C)c(C)c1CC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2	1784509874	VOPINUYLAHKKOQ-DJJJIMSYSA-N	441.370	1.440	50	20	IDGD	
COc1cncc(CCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CO[Si](C)(C)C)C[C@@H]32)c1	1785267044	UWLAWIRWXOKNMN-IHPCNDPISA-N	449.624	1.854	50	20	IDGD	
CCOC(=O)O[C@@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCBr)[C@H]2C1	1786407284	NCRGIWVYLATAPT-XUXIUFHCSA-N	435.315	1.313	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc(N)s3)[C@H]2C1	1786935577	GJPTYZXJNYEJRA-BJDJZHNGSA-N	431.356	1.492	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3noc4ccccc34)[C@H]2C1	1787007900	NJDMDACORGDVBE-FJXLLPKBSA-N	435.908	1.604	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc4sccn4c3)[C@H]2C1	1787275048	BFKOGENMUUJKQO-HNKHHVNMSA-N	425.938	1.848	50	20	IDGD	
Cc1cccc(C)c1NC(=O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]2C1	1787449783	XNSISSDSGGRLJL-JKQORVJESA-N	425.888	1.756	50	20	IDGD	
N[C@@H](C(=O)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1)c1ccccn1	1788039992	AMKPOXKPJNPYCY-OAQYLSRUSA-N	444.300	1.209	50	20	IDGD	
Cc1nccc(C(=O)Nc2ccc(C3(NC(=O)c4cnccc4C(=O)NN)CCC3)cc2)n1	1788810657	UWIIAKBVDWXOPI-UHFFFAOYSA-N	445.483	1.845	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4n(n3)CCC4)C[C@@H]21)[C@@H](F)Br	1789926143	OQJAHFWUVHHNAV-HQRZJTNHSA-N	429.290	1.113	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cn3ccccc3=O)C[C@@H]21	1790961043	FSBUUBHSFLUTNJ-VGWMRTNUSA-N	440.338	1.002	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3Cc4ccccc4O3)C[C@@H]21	1791055951	KXVFEVLFTXTPSN-YOQCSXPPSA-N	437.334	1.753	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3c(F)ccc(F)c3F)C[C@@H]21	1791249710	PEAAWJTWJGPCGJ-DPYKFYPSSA-N	448.869	1.880	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CC(c4ccccc4)=NO3)C[C@@H]21	1791249815	QJROEWDLJSDWEE-TXTPUJOMSA-N	449.935	1.413	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cn3cnc4ccccc43)C[C@@H]21	1791257681	OCWCBEYMHDPOSG-FPXQBCRKSA-N	434.924	1.270	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cccc(F)c3F)C[C@@H]21	1791258076	YWBRZEBZXUTOQU-JKQORVJESA-N	430.879	1.741	50	20	IDGD	
C[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)CBr)C[C@@H]21)n1cccn1	1791640558	VQZNVMOMOOJIML-QXKUPLGCSA-N	427.343	1.455	50	20	IDGD	
CCC[C@@H](NC(C)=O)C(=O)Nc1ccc(C2(NC(=O)CCC(=O)NN(C)C)CCC2)cc1	1792277890	VCPHBJXAAKGSMW-LJQANCHMSA-N	445.564	1.798	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1cccc2ncccc12	1793548010	LKALTWVHUGQGPM-REPLKXPHSA-N	437.544	1.789	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc([N+](=O)[O-])c3c1OCO3)C2)[C@@H](F)Cl	1796366460	VXVOIEYRVXIQLO-KTBFAXTASA-N	429.788	1.061	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1C=CCN1	1796749846	GZOQYBJQDGOQIZ-QRJUGERDSA-N	426.945	1.285	50	20	IDGD	
Cc1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](F)Cl)n(-c2cccc(=O)n2C)n1	1796806102	RPJJXIUFPNLMKE-KYZVSKTDSA-N	435.887	1.666	50	20	IDGD	
Cc1cc(C)n2ncc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)C(Cl)Cl)C4)c2n1	1796921616	CKGOIGHJVBWOSE-DABQJJPHSA-N	426.304	1.353	50	20	IDGD	
COc1ccc2c(/C=C/C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@@H](O)CCl)C4)c[nH]c2c1	1797142436	XJWSKYYEPAXQQM-HLUXNRJXSA-N	447.919	1.379	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccnnc1)C2	1800332733	XGMDHIJHFFAXPU-GKEMIQDWSA-N	439.422	1.565	50	20	IDGD	
C=CC[C@H](C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2	1800492084	WVUJMENWWBYZJO-NTNQKNOYSA-N	445.472	1.936	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1Cc3ccccc3O1)C2	1800640740	GBEBNFGPJBYWEF-CRCOGDFISA-N	437.334	1.753	50	20	IDGD	
O=C(Cc1ccc2c(c1)CCO2)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2	1800689944	MQIMGSMNZVWOQQ-LTCOOKNTSA-N	441.297	1.444	50	20	IDGD	
C[C@@H](Cc1ccc(F)cc1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc(B(O)O)c1)C2	1801490718	BJRGZQCHTFHVSD-RWXMBLCBSA-N	438.308	1.636	50	20	IDGD	
Cc1cc(C)n(CCC(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)n1	1803145815	INDROFRUUSRWAW-GGPKGHCWSA-N	433.940	1.591	50	20	IDGD	
C[C@H](CC(N)=O)C(=O)NC[C@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1	1803663379	FLMZJTDXXHLJPR-MRRJBJDNSA-N	425.327	1.384	50	20	IDGD	
COc1ccc(CCC(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@H]2c2cccnc2)cn1	1804261078	SFFSOOBPAZQQEN-UEXGIBASSA-N	446.935	1.724	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1ccccc1O	1805195561	CPWRBRXWJUYXMJ-GCJKJVERSA-N	445.284	1.100	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCC2(CCCN(C(=O)C[C@@H]3NC(=O)NC3=O)C2)CC1	1806849908	YZQAZKNNPJXKRJ-YVEFUNNKSA-N	433.336	1.052	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1807366914	VXEJFXIYJTXDHB-MJGOQNOKSA-N	443.740	1.346	50	20	IDGD	
CN1C(=O)CC[C@H]1C(=O)NC[C@@H]1CCN(C(=O)[C@@](C)(Cl)CCl)[C@@H]1c1cccnc1	1808772957	HXAWCOMWXIDWRO-COCVIAQXSA-N	441.359	1.945	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC2(CCCN(C(=O)CN3CCCCC3)C2)CC1	1809527912	DAQWKWHBMSMSCF-UHFFFAOYSA-N	442.564	1.016	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)c1cnn2cccnc12	1809736323	CUUBPFOOPNGTLT-UAGQMJEPSA-N	428.880	1.044	50	20	IDGD	
Cc1cc(C(=O)N2CCC3(CCCN(C(=O)c4ccc(B(O)O)cc4)C3)CC2)ccc1O	1809969791	SSAYYVNUIQAEMN-UHFFFAOYSA-N	436.317	1.539	50	20	IDGD	
O=C(c1ccn2cncc2c1)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1	1809972012	IKIKFWYFMABOSQ-UHFFFAOYSA-N	446.316	1.173	50	20	IDGD	
CC(=O)O[C@H](C(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)C(C)C	1810098241	GXPXCJVABKOHNX-XSLAGTTESA-N	425.913	1.275	50	20	IDGD	
Cn1ccc(=O)cc1C(=O)N1CC[C@H](CNC(=O)CO[Si](C)(C)C)[C@@H]1c1cccnc1	1810543634	DEPZKTLUOITZST-UTKZUKDTSA-N	442.592	1.951	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](F)Cl)[C@H]1c1cccnc1)c1cc(=O)nc2cccnn12	1811336178	PKVWTYRDEUXXLQ-DOPJRALCSA-N	444.854	1.339	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2cc(F)cn2C)[C@H]1c1cccnc1	1813069822	DACIPULMSXSYKP-KKSFZXQISA-N	444.511	1.252	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)[C@H]2CCCSC2)[C@H]1c1cccnc1	1814142981	YRRSPVSTFSXIRM-LVCYWYKZSA-N	447.605	1.604	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1CCc2nc(NC(=O)Cn3cncn3)sc2C1	1815657537	XGXMKVAXTGHFLY-VHSXEESVSA-N	427.328	1.378	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cnccc2F)[nH]n1)c1ccc(B(O)O)cc1	1817471649	UQLMLKVMIMODJP-GOSISDBHSA-N	437.240	1.243	50	20	IDGD	
Cc1cn(CC(=O)N2CCCC[C@H]2c2cc(NC(=O)[C@H](F)Cl)n[nH]2)c(=O)nc1O	1818045375	UIRRJKLPAVVFPJ-FZMZJTMJSA-N	426.836	1.207	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](C)Br)n[nH]1	1822186759	IWKKTMYJNSGWLK-JBLDHEPKSA-N	429.319	1.632	50	20	IDGD	
CCCC(=O)N[C@H](C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](Cl)COC)n[nH]1	1822372206	DYBWQZJKJDLMJT-VNHYZAJKSA-N	427.933	1.960	50	20	IDGD	
O=C1CC[C@@H](C(=O)N2CCCC[C@H]2C2CCN(C(=O)CCBr)CC2)CN1	1823834645	NHQJSBAFBJMCME-CVEARBPZSA-N	428.371	1.917	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)C[C@H](N)c1cccnc1)CC2	1825998669	HPCPLRLUFKLPDE-IHRRRGAJSA-N	437.953	1.794	50	20	IDGD	
Cc1cncc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)c1	1826009975	XFXJLDRQLLXNMQ-HXUWFJFHSA-N	429.565	1.996	50	20	IDGD	
NC(=O)c1ncccc1C(=O)N[C@H]1CCc2nc(NC(=O)C(Cl)Cl)sc2C1	1826093768	XVRUTQXHDPYHFU-ZETCQYMHSA-N	428.301	1.667	50	20	IDGD	
Cc1cc(C(=O)NCC(=O)N[C@H]2CCc3nc(NC(=O)C(Cl)Cl)sc3C2)no1	1826099730	NIRWIBAWTBYLCC-QMMMGPOBSA-N	446.316	1.585	50	20	IDGD	
O=C(c1ccc(F)cn1)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827055238	VOYYIEFEXXTTGJ-NRFANRHFSA-N	439.296	1.448	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC([C@@H]2CCCCN2C(=O)Cn2cnnn2)CC1	1827193217	QWOFMFAENDWQKB-HIFRSBDPSA-N	427.347	1.324	50	20	IDGD	
O=C(CCBr)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](O)N2CCOCC2)CC1	1828967089	UEAAAELXOZVNFM-FUHWJXTLSA-N	446.386	1.042	50	20	IDGD	
COc1ccccc1OCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1830230401	CAYUNUGAECPOJW-IEBWSBKVSA-N	430.860	1.065	50	20	IDGD	
O=C(c1c[nH]c(=O)cn1)N1CCC([C@H]2CCCCN2C(=O)[C@H](F)Br)CC1	1830380520	PPYWKUANAKPMPV-HIFRSBDPSA-N	429.290	1.694	50	20	IDGD	
O=C(C[C@@H]1COc2ccccc2O1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1831236127	WSRQAPGUDSGHEB-DJKXOVBDSA-N	442.871	1.207	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)Br)C2)C1	1831656374	DRFWMONOPQRQDR-HEHGZKQESA-N	425.751	1.634	50	20	IDGD	
C[C@@]1(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1(F)F	1832803877	PMQKQPIAOONKAC-UWJYYQICSA-N	449.502	1.964	50	20	IDGD	
O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(F)s1)CCO2	1833213365	OQABKRLCFZLMBR-INIZCTEOSA-N	435.315	1.742	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3coc(Cl)n3)CC2)CC1	1833987099	OIQGRVAYWMHIJZ-AWEZNQCLSA-N	433.336	1.767	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(O)cn3)CCO2)C1	1834589195	KUPZCWFQEZNZNL-KDOFPFPSSA-N	442.310	1.031	50	20	IDGD	
CNc1ccc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCBr)CCO3)C2)cc1	1834822458	OIRMYKDOYLPJAG-LJQANCHMSA-N	440.338	1.583	50	20	IDGD	
CC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)CNC(=O)c3ccco3)CC2)CC1	1836396098	SFHMRHQIKJHCQI-KRWDZBQOSA-N	438.956	1.598	50	20	IDGD	
CO[C@@H](C(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)c1ccccc1	1836716876	VZUZNQYHZPABDZ-VQTJNVASSA-N	438.952	1.972	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnc4[nH]ncc4c3)CCO2)C1	1836809232	XAPZGWVSEBLORO-HXUWFJFHSA-N	435.912	1.293	50	20	IDGD	
O=C(CCN1C(=O)C=CC1=O)N1CCC(OC2CCN(C(=O)C(Cl)Cl)CC2)CC1	1836996212	WAHOBAAHWWHHFP-UHFFFAOYSA-N	446.331	1.104	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(F)nc3)CCO2)C1	1837840081	DUPGDUCFDLSCGZ-FZKQIMNGSA-N	444.301	1.322	50	20	IDGD	
COC1(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)CCC1	1839156499	RIHRQLMUPWEPIJ-MJGOQNOKSA-N	437.364	1.638	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1[C@H]3C=CS[C@@H]31)CCO2	1839694898	VPULATLGUMYYEB-LSPIHWNJSA-N	445.379	1.349	50	20	IDGD	
Cc1cscc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)Br)CCO2	1840033002	QFRIYVFIBZHKRO-SUMWQHHRSA-N	431.352	1.910	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3sc(C)nc3C)C2)C1	1840150237	IDQZOGXNJJNHTN-KSSFIOAISA-N	431.942	1.084	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC2(CCCN2C(=O)[C@H](C)[C@@H]2SC(=N)NC2=O)C1	1843409391	WZWBVFPTMVRLAW-VWYCJHECSA-N	431.356	1.166	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1ccn(C(C)C)n1)C2	1843416514	SOGSHFMKDLETTE-HZHRSRAPSA-N	425.493	1.415	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](O)[C@@H](C(=O)N2CCCC23CN(C(=O)[C@H](F)Cl)C3)C1	1843822622	DSNBWBPIUGFXNW-IHRRRGAJSA-N	433.908	1.342	50	20	IDGD	
Cn1ccc2c(O)ncc(C(=O)N3CCCC34CN(C(=O)[C@@H](F)Br)C4)c21	1844637889	FLTKENOXUGIMLM-CYBMUJFWSA-N	425.258	1.786	50	20	IDGD	
C[C@H](Br)C(=O)N1CC2(CCCN2C(=O)[C@H](C)NC(=O)c2ccc(F)cc2)C1	1845004505	POWXTESTGCCKTK-STQMWFEESA-N	440.313	1.931	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCCC12CN(C(=O)c1cc(O)nc(O)n1)C2	1845871129	RTDQAOGZEJJYMZ-AWNIVKPZSA-N	441.394	1.590	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCCC12CN(C(=O)CC(=O)Nc1cc(C)on1)C2	1846069970	HQKFZKHHSPVPFK-GFCCVEGCSA-N	427.299	1.689	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC12CN(C(=O)[C@@H]1CC[C@@H]3CCC(=O)N3C1)C2	1846071973	ZKSYQOSYROIORM-KFWWJZLASA-N	426.355	1.764	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc2ccc(Cl)cc2[nH]1	1847205771	JMKXFRRJGCGWQA-PMACEKPBSA-N	437.692	1.630	50	20	IDGD	
CNC(=O)CC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)/C(C#N)=C/c1ccc(Br)cc1	1847765938	FBPNLWYXZXXIFN-ONPHEMOESA-N	445.317	1.694	50	20	IDGD	
C=C1c2ccccc2C(=O)N1[C@H](C)C(=O)NNC(=O)c1sc(N2CCOCC2)nc1C	10291807	RBCXYPCWEBEXCQ-CQSZACIVSA-N	441.513	1.564	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C2CCN(S(=O)(=O)c3ccccc3)CC2)c1	15878853	SOUZSJBVUZOOIJ-UHFFFAOYSA-N	445.541	1.931	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Cn2cnc3c(C)cccc3c2=O)cc(OC)c1OC	16230029	ANKLZQJMRONPJT-UHFFFAOYSA-N	426.429	1.192	50	20	IDGD	
COc1ccc(-c2nnc(S)n2CC(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)cc1	24298084	YMKGGTFVNXHXDD-LBPRGKRZSA-N	445.476	1.996	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)CC1CCCCC1	25166485	KCVLMVBDQKBEFD-UHFFFAOYSA-N	437.562	1.758	50	20	IDGD	
Cc1cc(C(=O)NNS(=O)(=O)c2ccc3c(c2)C(=O)NC3=O)c(C)n1-c1ccccc1	111136237	GXSVGRLRHTYJRH-UHFFFAOYSA-N	438.465	1.601	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)[C@H]1CCN(c2cc(Cl)ccc2Cl)C1=O	725740346	DNLKXIVQDKRUML-LLVKDONJSA-N	439.255	1.517	50	20	IDGD	
Cc1ccc([C@@H](CNC(=O)NNC(=O)CNC(=O)c2cccs2)N2CCCC2)cc1	726249777	LQLDPIINWHVLGQ-QGZVFWFLSA-N	429.546	1.954	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCc2ccc(F)c(Cl)c2)cc1	726276303	QEHKAXNZTLDZLA-UHFFFAOYSA-N	442.900	1.939	50	20	IDGD	
CC(C)CCC(=O)NCC(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	727483178	KGYWCHCZTXWYCX-UHFFFAOYSA-N	449.515	1.702	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CNC(=O)NCc2ccc(Cl)cc2)cc1C	727493348	NCRUFBBNGYMBOB-UHFFFAOYSA-N	431.880	1.542	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)CN2C(=O)c3ccccc3N3C(=O)CC[C@@]23C)cc1	728203240	QBFQWKSOUPANTA-QHCPKHFHSA-N	435.484	1.553	50	20	IDGD	
O=C(COC(=O)Cc1cc2ccccc2nc1O)NNC(=O)[C@H]1COc2ccccc2O1	728327508	BZOWBOPMOMVUHB-GOSISDBHSA-N	437.408	1.014	50	20	IDGD	
O=C(COC(=O)Cc1c[nH]c2cc(F)ccc12)NNC(=O)[C@@H]1COc2ccccc2O1	728344862	RBLMKHPZCXAUNU-SFHVURJKSA-N	427.388	1.380	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CN2C(=O)c3ccc(Br)cc3C2=O)c1	728828654	UVOLAYWUROXAAP-UHFFFAOYSA-N	427.214	1.378	50	20	IDGD	
C[C@H](c1ccccc1)N1CC[C@H](NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)C1	728949842	VSJBPBKOROAGTG-XLIONFOSSA-N	437.548	1.859	50	20	IDGD	
CNS(=O)(=O)c1ccc(CCC(=O)NNC(=S)Nc2ccc(N(C)C)cc2)cc1	729690060	ZRZGTPVJNBQUCS-UHFFFAOYSA-N	435.575	1.611	50	20	IDGD	
C[C@@H]1CCCN(S(=O)(=O)c2cc(C(=O)NNC(=O)c3cccc(C#N)c3)n(C)c2)C1	730182312	YZLYEPKVZQUIEB-CQSZACIVSA-N	429.502	1.392	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)CNC(=O)c1ccco1)c1cc(F)ccc1N1CCC(O)CC1	730677933	NHSNRLYPUJTAAE-ZDUSSCGKSA-N	447.467	1.201	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2nc(NCc3ccco3)ncc2Cl)C[C@@H](C)O1	732263492	NJKYCOLUENFXDQ-BETUJISGSA-N	436.900	1.595	50	20	IDGD	
C[C@@H](CSc1ccccc1)C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	732390764	GNEPUVRQGRFTMO-KSSFIOAISA-N	430.482	1.945	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)C[C@@H]2CCc3ccccc3C2)cc1	732548648	JEEZSYRFTFOTSC-QGZVFWFLSA-N	429.542	1.958	50	20	IDGD	
CCC[C@H](NC(=O)Cc1ccccc1)C(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	732653605	CUYAMNZVRSZZND-SFHVURJKSA-N	435.484	1.222	50	20	IDGD	
Cc1cc(OC(F)F)c(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)s1	733947763	GWARSBWOABNGLB-UHFFFAOYSA-N	433.458	1.983	50	20	IDGD	
CC1(C)CC(=O)c2cc(C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)c(O)nc2C1	734241328	MYNSXKIORBCHAW-UHFFFAOYSA-N	435.481	1.411	50	20	IDGD	
Cc1cc(NNC(=O)C2=NN([C@@H]3CCS(=O)(=O)C3)C(=O)CC2)ccc1Br	734252905	LRJVFSCOHBPUMG-GFCCVEGCSA-N	443.323	1.366	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)NCc1cccc(-n2cncn2)c1	735584055	DSCBRGNTCFBNOU-UHFFFAOYSA-N	448.531	1.310	50	20	IDGD	
COc1ccc(COCCC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)cc1	736065801	SRTCNFHLMRQGFM-UHFFFAOYSA-N	434.518	1.665	50	20	IDGD	
C[C@@H]1CN(S(=O)(=O)c2cc(C(=O)NNc3cccnn3)ccc2Cl)C[C@@H](C)O1	736701763	DEPVJRJNKYATRX-VXGBXAGGSA-N	425.898	1.685	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)c2cc(S(C)(=O)=O)ccc2C)cc1C	736753881	SKUPKFGQYVDUNI-UHFFFAOYSA-N	438.527	1.949	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Cc2ccn(-c3ccc(F)cc3)n2)c2ccccc2c1=O	742034642	SDVCWQHOAAMLHE-UHFFFAOYSA-N	434.431	1.745	50	20	IDGD	
NC(=O)Cn1cc(C(=O)NNC(=O)c2cc(-c3ccccc3Cl)nc3ccccc23)nn1	743289173	OKTFGOPPGIHVQB-UHFFFAOYSA-N	449.858	1.707	50	20	IDGD	
CCO[C@@H]1C[C@H](NC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)C12CCCC2	743510360	VRPAWUSVDBYBRL-LSDHHAIUSA-N	437.566	1.970	50	20	IDGD	
CCO[C@H](C)c1nc(CN2CCN(C(=O)NNC(=O)Cc3cccnc3)CC2)cs1	743588686	FOLFWNIMOMYIGM-OAHLLOKOSA-N	432.550	1.737	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)CN2C(=O)COc3ccccc32)cc1Cl	743805502	GQSMTEGPRGFSQW-UHFFFAOYSA-N	434.836	1.936	50	20	IDGD	
C[C@H](CC(=O)c1cccc(F)c1)C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	745398260	BARLAVWGCXJPBC-YJYMSZOUSA-N	444.415	1.565	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)c1sccc1S(=O)(=O)N1CCC(CO)CC1	745490984	BWFCTIBNRDGVNE-UHFFFAOYSA-N	437.543	1.524	50	20	IDGD	
CCc1ccc([C@H](COC)NC(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)o1	745847113	LCWRFFTYWXSHPP-HNNXBMFYSA-N	425.511	1.938	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@@H]2CCN(c3ccc(C)cc3)C2=O)c2ccccc2c1=O	745852858	ZJOCGGOPXCTVSM-GOSISDBHSA-N	448.483	1.474	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)[C@@H](CC)Nc1c([N+](=O)[O-])c(C)nn1C	746096384	TVONENYQFHALQB-CYBMUJFWSA-N	442.480	1.587	50	20	IDGD	
N#Cc1ccc(NNC(=O)[C@H]2CC(=O)N([C@H]3CCS(=O)(=O)C3)C2)cc1C(F)(F)F	746894706	ODBXZAZDWZMCMR-AAEUAGOBSA-N	430.408	1.056	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(-n2cnnn2)cc1)c1ccc(Br)s1	747407580	RNENPBKCIIZNSO-UHFFFAOYSA-N	429.281	1.110	50	20	IDGD	
CN1CC(=O)N(CC(=O)NNC(=O)c2cn(-c3ccccc3)nc2-c2ccccc2)C1=O	747452694	LUZHHEPXCLVSQV-UHFFFAOYSA-N	432.440	1.194	50	20	IDGD	
COc1cc(OC)cc(N2CC[C@@H](NC(=O)NNC(=O)Cc3ccc(F)cc3)C2=O)c1	747957305	YUUWQBOKSTWJGH-GOSISDBHSA-N	430.436	1.521	50	20	IDGD	
COCCN(CCOC)S(=O)(=O)c1ccc(C(=O)NNc2ccccc2F)cc1	748049340	RSAJOQSCIVXEKY-UHFFFAOYSA-N	425.482	1.866	50	20	IDGD	
COc1ccccc1C(=O)N[C@@H](CCS(C)(=O)=O)C(=O)NNc1c(F)cccc1F	748175278	FOVKJVYUAPTKAL-HNNXBMFYSA-N	441.456	1.650	50	20	IDGD	
Cc1nc(Cl)cc(NNC(=O)[C@H]2CCCN2S(=O)(=O)c2cccc([N+](=O)[O-])c2)n1	748336582	XPJXUHCZVYRPRT-CYBMUJFWSA-N	440.869	1.643	50	20	IDGD	
COc1ccc(-c2nn(CCC#N)cc2/C=C(/C#N)C(=O)N[C@@H](C)CC(N)=O)cc1OC	748715995	JCNFPSCBUUBOND-FBKCMUNRSA-N	436.472	1.768	50	20	IDGD	
Nc1ncnc2c1ncn2CC(=O)OCC(=O)NN=C(c1ccccc1)c1ccccc1	750500711	CSXYLINASRTYBT-UHFFFAOYSA-N	429.440	1.521	50	20	IDGD	
CCOCCCn1c(NNC(=O)[C@@H]2CCc3nnc(C)n3C2)nc2ccccc2c1=O	750776147	LVSUSLJPTTYXKM-OAHLLOKOSA-N	425.493	1.429	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)[C@@H]1CCCCN1C(=O)OCc1ccccc1	751204286	ZNCRATWRNGGNJI-INIZCTEOSA-N	428.445	1.348	50	20	IDGD	
COc1ccc(-c2nc(CC(=O)NNC(=O)CNC(=O)c3ccco3)cs2)cc1OC	751207321	VORPQHUCZAGNSW-UHFFFAOYSA-N	444.469	1.540	50	20	IDGD	
Cn1c(=NNC(=O)c2cccc(CN3CCS(=O)(=O)CC3)c2)sc2ccccc21	751314685	GDCZPMVOCYSXPR-UHFFFAOYSA-N	430.555	1.716	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNS(=O)(=O)c2cnn([C@H]3CCOC3)c2)c1	751547535	KVAMYHQTBPDPFJ-JTQLQIEISA-N	445.295	1.239	50	20	IDGD	
COc1ccc(N2C(=O)CC[C@@H](C(=O)NNC(=O)CO)[C@H]2c2ccccc2OC)cc1	753452802	SYUPTMLJWZXSSF-DYESRHJHSA-N	427.457	1.328	50	20	IDGD	
C[C@@H](CC(=O)NNc1ccc(C(F)(F)F)nn1)/N=C1/NS(=O)(=O)c2ccccc21	755191782	RDNLGRPAGUPKJI-VIFPVBQESA-N	428.396	1.456	50	20	IDGD	
CC(C)(C)S(=O)(=O)N1CCC(NC(=O)NNC(=O)NCc2ccc(Cl)cc2)CC1	755901416	RLGOQYTTWVRGBN-UHFFFAOYSA-N	445.973	1.946	50	20	IDGD	
O=C(COC(=O)c1c[nH]nc1-c1ccccc1F)NNC(=O)c1cccc([N+](=O)[O-])c1	756608585	TYNGACRHKLPBIC-UHFFFAOYSA-N	427.348	1.742	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)c2coc(S(N)(=O)=O)c2)cc(OCC)c1OCC	757629001	OQLHEVRLGLEGHH-UHFFFAOYSA-N	441.462	1.198	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)Nc1cccn(Cc2ccccc2)c1=O	757658026	OTGGTPMETJDEDU-UHFFFAOYSA-N	447.499	1.756	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2c(C)nn(CCOC)c2C)c2ccccc2c1=O	757871129	DPDRMFLPQPVYDR-UHFFFAOYSA-N	427.465	1.343	50	20	IDGD	
O=C(NNC(=O)c1cccnc1I)c1cnn(-c2ccccc2)c1	758151610	SPAHSUNJOOEYFC-UHFFFAOYSA-N	433.209	1.947	50	20	IDGD	
COc1ccc2c(c1)OC[C@@H]2CC(=O)N1CCN(S(=O)(=O)CBr)CC1	758514018	XUOGLCJGCIFXGE-LBPRGKRZSA-N	433.324	1.388	50	20	IDGD	
COC(=O)c1cn(C2CCN(C(=O)NNC(=O)Cn3ccc4ccccc43)CC2)nn1	759268264	VENAZZXUTCICNK-UHFFFAOYSA-N	425.449	1.097	50	20	IDGD	
COc1ccc(-c2nn(CCC#N)cc2/C=C(\C#N)C(=O)N(C)C[C@H](O)CO)cc1OC	760012867	AKGVCHWYUHMEEV-WBNHJWIASA-N	439.472	1.200	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)[C@H]3CN(C(=O)OC(C)(C)C)CCC3(F)F)nc21	760330065	QZTMJJHSGBNDQW-SNVBAGLBSA-N	427.412	1.404	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)C2=Cc3cc(F)ccc3OC2)cc1OC	761624935	MLVVVJPRGYNJDL-UHFFFAOYSA-N	430.388	1.623	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N1CCS(=O)(=O)CC[C@H]1C	763129876	WKRLFCIGMRJIBE-NEPJUHHUSA-N	448.339	1.466	50	20	IDGD	
CCN(CC)C(=O)c1ccccc1NC(=O)C(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	763446896	YCGZFSUJARXQHG-UHFFFAOYSA-N	427.417	1.477	50	20	IDGD	
COC(=O)Cc1ccccc1NC(=O)C(=O)NNC(=O)c1ccccc1Br	763483094	MPDYDVHUQAIJQH-UHFFFAOYSA-N	434.246	1.564	50	20	IDGD	
COc1ccc(NC(=O)c2ccc(NC(=O)C(=O)NNC(=O)c3cccnc3)cc2)cc1	763491827	POSJIDPXXFLIOI-UHFFFAOYSA-N	433.424	1.742	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	763593296	ZBRCRIQZKMKPDO-UHFFFAOYSA-N	442.541	1.393	50	20	IDGD	
COCCn1ncc2ccc(NC(=O)C(=O)NNC(=O)c3cc(-c4ccccc4)[nH]n3)cc21	763606341	YOSHHULMSONBSW-UHFFFAOYSA-N	447.455	1.473	50	20	IDGD	
Cc1ccc(-n2nc(NC(=O)C(=O)NNC(=O)c3c(C)nc4ccccn34)cc2C)cc1	763629409	ITNWCJPLIUUIOS-UHFFFAOYSA-N	431.456	1.845	50	20	IDGD	
COC(=O)[C@H](C)Cc1ccc(NC(=O)C(=O)NNC(=O)COc2cccc(C)c2)cc1	763630406	KVFRHHUSUFAMCT-OAHLLOKOSA-N	427.457	1.512	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccccc1CC(F)(F)F	763656889	ITFFTQASQWTNED-UHFFFAOYSA-N	425.363	1.965	50	20	IDGD	
Cc1ccc(N2CCOC2=O)cc1NC(=O)C(=O)NNC(=O)c1cc2c(s1)CCC2	763783953	RSDORRBGIPSNNK-UHFFFAOYSA-N	428.470	1.902	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2cccc(Cl)c2F)c2ccccc2c1=O	763787028	UUHRSIDUTFHBQK-UHFFFAOYSA-N	431.811	1.609	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)C(=O)Nc1ccc(F)cc1C(F)(F)F	763789746	BVLIEELADQYTPT-UHFFFAOYSA-N	437.309	1.893	50	20	IDGD	
COC(=O)c1cc2cc(NC(=O)C(=O)NNC(=O)COc3ccc(C)cc3)ccc2o1	763809230	LOEKTBJBCTZPSR-UHFFFAOYSA-N	425.397	1.693	50	20	IDGD	
COc1cc(Br)cc(NC(=O)C(=O)NNC(=O)COc2ccc(C)cc2)c1	763811689	KMMBBLKMVVSPGM-UHFFFAOYSA-N	436.262	1.931	50	20	IDGD	
CNC(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)cc1	763839449	HAEYYJOEXZSHGA-OAHLLOKOSA-N	426.473	1.145	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)ccc1NC(C)=O	763842223	XKNOKUNZZPBGMW-CQSZACIVSA-N	442.472	1.824	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)NNC(=O)C(=O)Nc1ccc(NC(=O)[C@H]2CCCO2)cc1	763857659	NYBRTOVQOOZNSU-LJQANCHMSA-N	449.467	1.614	50	20	IDGD	
N#Cc1ccc(OC(F)F)c(NC(=O)C(=O)NNC(=O)Cc2c[nH]c3ccccc23)c1	763861198	PLOQEHUGCZGMSK-UHFFFAOYSA-N	427.367	1.970	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccnn1Cc1ccccc1	763871084	CXDXPRDDJKDQDM-AWEZNQCLSA-N	425.420	1.624	50	20	IDGD	
COc1cc(F)c(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(C(C)=O)cc2)cc1OC	763871494	FXFCWUUAERPZRC-LBPRGKRZSA-N	447.419	1.599	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1cccc(Cl)c1-n1cncn1	763872210	MBGAUVRYTJHCMZ-NSHDSACASA-N	446.826	1.613	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cnn(CC(F)(F)F)c2)cc1OC	763912408	ZMXKSLLEIOLOSQ-UHFFFAOYSA-N	443.382	1.643	50	20	IDGD	
COC(=O)c1cc(F)ccc1NC(=O)C(=O)NNC(=O)c1ccc(OC(C)C)c(OC)c1	763915633	BNXFJPOHBKRTRF-UHFFFAOYSA-N	447.419	1.808	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)C(=O)Nc1cccc(C(=O)N2CCSCC2)c1	763958237	SPGPHZHHKMAWOQ-UHFFFAOYSA-N	426.498	1.584	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)C(=O)Nc1cccc(OCC(=O)Nc2ccccc2)c1	763994934	AXVBXMXRNQWPPY-UHFFFAOYSA-N	435.440	1.442	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)C(=O)Nc1cnn(-c2ccccc2F)c1	763995133	MVOLVOAEALESOR-UHFFFAOYSA-N	435.213	1.502	50	20	IDGD	
CC[C@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(CN2CCN(c3ccccn3)CC2)cc1	764083369	QYLLWTSJPSOBRZ-KRWDZBQOSA-N	438.532	1.536	50	20	IDGD	
CCc1cc(O)nc(-c2cccc(NC(=O)C(=O)NNC(=O)c3ccc(Cl)nc3)c2)n1	764099449	ADSHHLDHBMQQIC-UHFFFAOYSA-N	440.847	1.860	50	20	IDGD	
COC(=O)CCSc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)nc2)c1	764101427	QSJBFWXFXAWBAB-UHFFFAOYSA-N	436.877	1.790	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cccc(-n4nnnc4C)c3)n[nH]2)cc1	764110214	HOUFSHFEVPJILU-UHFFFAOYSA-N	445.443	1.069	50	20	IDGD	
CN(c1ccccc1)S(=O)(=O)c1cccc(NC(=O)C(=O)NNC(=O)CC2CC2)c1	764142752	JYZXQJBROGKNRB-UHFFFAOYSA-N	430.486	1.398	50	20	IDGD	
CNC(=O)Cn1ccc2ccc(NC(=O)C(=O)NNC(=O)CCCc3ccccc3)cc21	764224083	PGLBNPWZTMFVDZ-UHFFFAOYSA-N	435.484	1.496	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2O)c(OC[C@@H]2CCCO2)c1	764275746	SYBLYRRREBRNCH-HNNXBMFYSA-N	443.456	1.423	50	20	IDGD	
CCc1nnc(-c2ccc(NC(=O)C(=O)NNC(=O)c3ccc(OC)cc3OC)cc2)o1	764286238	HZJBPHKADHNOMS-UHFFFAOYSA-N	439.428	1.716	50	20	IDGD	
COCCOc1cc(NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)ccc1OC	764349404	NAKNBXVKEVEYDK-UHFFFAOYSA-N	437.836	1.479	50	20	IDGD	
O=C(NNC(=O)C(F)(F)Oc1ccccc1)C(=O)Nc1cccc(N2CCCCC2=O)c1	764379407	DQKYHJDSFANXNH-UHFFFAOYSA-N	446.410	1.961	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1ccc2c(c1)N(C)CCO2	764394235	QDFMNPSPUDYYBB-UHFFFAOYSA-N	430.486	1.402	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1F)C(=O)Nc1ccc2nc3n(c(=O)c2c1)CCC3	764412068	DYXIDEBAJDEFKV-UHFFFAOYSA-N	443.822	1.535	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C[C@H]1CN(C(=O)OC(C)(C)C)CCO1	764523147	LNTISAKIHWOYJO-HNNXBMFYSA-N	437.493	1.638	50	20	IDGD	
CCCc1c(NC(=O)C(=O)NNC(=O)Cn2nc(C)cc2C)cnn1-c1ccccc1C	764662940	NGQAIRKDUDEIRP-UHFFFAOYSA-N	437.504	1.733	50	20	IDGD	
Cc1cc(C)n(CCC(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)n1	765755291	FEVLLRPCLPSLIP-UHFFFAOYSA-N	432.956	1.509	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)[C@@H](C)c1ccc(S(C)(=O)=O)cc1	767366613	SHKNLTANUDPVHW-HNNXBMFYSA-N	432.498	1.435	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)c1n[nH]c(C2CC2)c1Br	768633492	WGEIYRILVJUVDB-UHFFFAOYSA-N	435.278	1.905	50	20	IDGD	
CCN(C1CCN(C(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)CC1)S(C)(=O)=O	770659334	QXDQNPBPWZBROY-ZDUSSCGKSA-N	446.957	1.594	50	20	IDGD	
COc1ccc([C@@H](OC)[C@@H](C)NC(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1	771904475	KNTXDHPKXZAWGW-DYVFJYSZSA-N	449.533	1.709	50	20	IDGD	
CCOC(=O)CON=C(C(=O)NNc1c(F)cc(F)cc1Br)c1cc[nH]n1	772302076	ORXRTBKDYKIFMR-UHFFFAOYSA-N	446.208	1.878	50	20	IDGD	
O=C(Cn1cc(C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)cn1)NC1CCCC1	772478394	XSCLWRHGNAMFKY-UHFFFAOYSA-N	427.490	1.468	50	20	IDGD	
CN1CCN(C(=O)c2ccc(NC(=O)C(=O)NNc3ccc([N+](=O)[O-])cc3)cc2)CC1	773656521	NBOYBXATWFLBMT-UHFFFAOYSA-N	426.433	1.064	50	20	IDGD	
CCNC(=O)c1ccc(C)c(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)c1	774009696	SGTLWEMQVHNTFL-ZDUSSCGKSA-N	446.891	1.952	50	20	IDGD	
COC(=O)[C@H](C)n1cccc1C=NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	774576400	VMWFBCRALUHYRM-HNNXBMFYSA-N	432.502	1.771	50	20	IDGD	
CS(=O)(=O)N1CCN(c2ccc(NC(=O)NNc3c(F)cccc3F)cn2)CC1	775617272	LDIXCHIYMXVCOJ-UHFFFAOYSA-N	426.449	1.590	50	20	IDGD	
CN(Cc1cc(F)c(F)c(F)c1)C(=O)NNC(=O)c1csc(N2CCOCC2)n1	776885010	BVDYHVNDXHKOKA-UHFFFAOYSA-N	429.424	1.883	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@@H]2CCO[C@@H](CC(C)C)C2)cc1	777751128	CXJHARXTEPWYLO-SJORKVTESA-N	440.566	1.540	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)CNC(=O)c2ccc(C(F)(F)F)cc2)nc1C	778427502	ZWCLKMHSWAFECK-UHFFFAOYSA-N	425.367	1.854	50	20	IDGD	
NS(=O)(=O)c1ccc(C(=O)NNc2ccc([N+](=O)[O-])cc2Br)c(F)c1	779144332	IJUFMRVICLZQAQ-UHFFFAOYSA-N	433.215	1.901	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2cccc(C(=O)NNc3ncncc3Cl)c2)C[C@@H](C)O1	781813770	LSWANCYXLPGCJZ-TXEJJXNPSA-N	425.898	1.685	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)NCc1ccccc1CN1CC[C@H](O)C1	781954204	LOJUUIQKQWQYKZ-YJBOKZPZSA-N	430.480	1.690	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2cc(C)ccc2C)c(OC)c1	782121150	LKKXKOVRSXTCBH-UHFFFAOYSA-N	429.429	1.264	50	20	IDGD	
N#C/C(=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)NCCn1ccnn1	782829303	JGIWBFGVQPNGTD-RVDMUPIBSA-N	438.879	1.394	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)C(=O)Nc1cccc(-n2cccc2)c1	782897651	RNEGBUUROWNPHI-UHFFFAOYSA-N	440.485	1.170	50	20	IDGD	
COc1ccc(C(=O)N2CCN(C)CC2)cc1NC(=O)C(=O)NNc1cc(C)cc(C)c1	783359683	XGGQYYIMZAAIFS-UHFFFAOYSA-N	439.516	1.781	50	20	IDGD	
COCCOC(=O)c1c(NC(=O)C(=O)NNc2cc(C)ccc2C)sc(C(N)=O)c1C	783361498	AFUMPVXMKWFFHP-UHFFFAOYSA-N	448.501	1.657	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ccc(-n3cccn3)nn2)cc1Br	783432827	FHDJXKMMDCHTEP-UHFFFAOYSA-N	432.238	1.515	50	20	IDGD	
CCOc1cc(F)ccc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	784214061	UGIYBGMKXNEXOU-UHFFFAOYSA-N	436.465	1.747	50	20	IDGD	
O=C(NNc1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1	784833475	KWCVAHFLYMFFQW-UHFFFAOYSA-N	447.473	1.851	50	20	IDGD	
CS(=O)(=O)c1ccccc1-n1cc(NC(=O)C(=O)NNc2ccc(Cl)nc2)cn1	784871683	UNYGRMDVAHSMIY-UHFFFAOYSA-N	434.865	1.406	50	20	IDGD	
O=C(NNc1ncc(F)cn1)C(=O)Nc1cc(Br)ccc1N1CCOCC1	784957183	OAZQMHXBPFGERN-UHFFFAOYSA-N	439.245	1.297	50	20	IDGD	
CC(C)NC(=O)C(=O)NNC(=O)[C@H]1CC(=O)N(C(C)(C)C)[C@H]1c1ccc(Cl)c(F)c1	785064143	CRVISJWCIMBDTO-LRDDRELGSA-N	440.903	1.839	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCN2C(=O)N(CC(C)C)C[C@@H]2C1	785879498	ZRBLUROORBSIEL-HNNXBMFYSA-N	437.928	1.187	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)[C@H]1CCCN(C(=O)NC2CCCC2)C1	786817249	FBDWXRVMKDMBHA-SFHVURJKSA-N	444.532	1.592	50	20	IDGD	
COC(=O)c1cncc(S(=O)(=O)NNC(=O)c2cc(F)ccc2Br)c1	788492488	OCEPSSSLAKPJHI-UHFFFAOYSA-N	432.227	1.393	50	20	IDGD	
CN(C)[C@@H]1CCOc2c(NC(=O)C(=O)NNC(=O)c3ccc(Cl)cc3O)cccc21	789733634	QRXWXYMPYLOUHD-OAHLLOKOSA-N	432.864	1.831	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1nc2c(s1)C[C@@H](C(C)(C)C)CC2	789739487	OWKJCXKDRAVUBE-NEPJUHHUSA-N	426.539	1.432	50	20	IDGD	
O=C(NNC(=O)c1ccnn1CC(F)F)c1cccc(S(=O)(=O)N2CCCC2)c1	789866855	HULVSBJVGOQSDC-UHFFFAOYSA-N	427.433	1.008	50	20	IDGD	
Cc1nn(C)c(C=NNC(=O)Cc2csc(N3CCOCC3)n2)c1Br	790287309	LLRGEMAYLZQNON-UHFFFAOYSA-N	427.328	1.477	50	20	IDGD	
O=C(NC[C@H]1CCSC1)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	790877279	LPZFDCWBUHEWFN-CQSZACIVSA-N	426.564	1.558	50	20	IDGD	
CNC(=O)c1cc2cc(NC(=O)C(=O)NNC(=O)COc3ccc(Cl)cc3)ccc2[nH]1	792354993	NLOAHNQOEROTMI-UHFFFAOYSA-N	443.847	1.346	50	20	IDGD	
Cc1ccc(S(=O)(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)cn1	795279989	JTUXSPYRLYBSIH-UHFFFAOYSA-N	449.492	1.772	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CN2CCC[C@H](CNC(=O)OCc3ccccc3)C2)c1	796466657	NUSLTKOZKHJPEN-HXUWFJFHSA-N	449.511	1.958	50	20	IDGD	
CC(C)(C)OC(=O)C1=NO[C@H](C(=O)NNC(=O)c2ccc(F)cc2Br)C1	798281032	DGXHAQLXRCQUPO-LBPRGKRZSA-N	430.230	1.836	50	20	IDGD	
Cc1cc(O[C@@H]2CCN(C)C2=O)ccc1NC(=O)C(=O)NNC(=O)c1cccc(Cl)c1	799256945	BTPAZCSEOYBXHF-QGZVFWFLSA-N	444.875	1.658	50	20	IDGD	
CC[C@@](O)(C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1)c1cccc(Cl)c1	800320191	SZKMKZFSOSFMLL-UWJYYQICSA-N	448.859	1.468	50	20	IDGD	
Cc1c(I)cc([N+](=O)[O-])cc1C(=O)NNC(=O)c1ccccn1	801102044	YMIJGVLEYYZTFN-UHFFFAOYSA-N	426.170	1.978	50	20	IDGD	
C[C@H](CCNS(=O)(=O)c1ccccc1)NC(=O)NNC(=O)c1ccc2c(c1)OCCO2	801797346	YYSPEYNDBZQSMQ-CQSZACIVSA-N	448.501	1.159	50	20	IDGD	
O=C(CSCC(=O)N1CCOCC1)NNC(=O)Nc1ccc(Br)cc1	801998021	KLFYTNIYGUFJBP-UHFFFAOYSA-N	431.312	1.194	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)CCNS(=O)(=O)c2cccc(Cl)c2)cc1	802062624	PCULCOFYLJLGHO-UHFFFAOYSA-N	426.882	1.870	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NC[C@H]2CC(c3ccc4c(c3)CCO4)=NO2)cc1	802333669	ZNJPDHONJYDVNU-GOSISDBHSA-N	440.456	1.533	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)N[C@@H]1CCN(C(=O)Nc2ccccc2)C1	802499989	JIDQYRYQYKCVAE-OAHLLOKOSA-N	442.432	1.610	50	20	IDGD	
O=C(NC[C@@H](N1CCOCC1)C(F)(F)F)NNC(=O)c1cccc(OC(F)F)c1	805065931	RXBZLHWEUPEYHE-GFCCVEGCSA-N	426.342	1.495	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)Nc1ccccc1OCC(=O)N1CCOCC1	806329617	CHZOTQMFQSMKLN-UHFFFAOYSA-N	438.448	1.049	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(F)c(N3CCCNC3=O)c2)c(O)c1	806976088	CZZDTBBPPQRCHQ-UHFFFAOYSA-N	429.408	1.159	50	20	IDGD	
CN(NC(=O)c1ccc2c(c1)N(C)CCO2)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	807243361	QYCIQESHQGFTAS-UHFFFAOYSA-N	433.509	1.765	50	20	IDGD	
CC(C)Nc1ccc(S(=O)(=O)NCC(=O)NNc2cccc(F)c2)cc1[N+](=O)[O-]	810681982	QGAQHZMNQLNPAE-UHFFFAOYSA-N	425.442	1.976	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)CCCN2C(=O)c3ccccc3C2=O)cc1	812729984	XZWIBBWSKVLPHQ-UHFFFAOYSA-N	430.486	1.456	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)c2c(Br)nnn2C)c(OC)cc1Cl	813574748	FHRLPVDVKSDCRZ-UHFFFAOYSA-N	433.650	1.715	50	20	IDGD	
COC(=O)CCCc1nnc(NC(=O)NNc2ccccc2S(=O)(=O)N(C)C)s1	814647403	ZBPAEBXODVHVJU-UHFFFAOYSA-N	442.523	1.433	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCc2nncn2C1)C(=O)Nc1cccc(OCCc2ccccc2)c1	815691528	SQNGSSIFJIVQNJ-QGZVFWFLSA-N	448.483	1.248	50	20	IDGD	
CCOc1ccc(NNC(=O)C(=O)Nc2cc(S(=O)(=O)N(C)C)ccc2N(C)C)cc1	815817325	MWRZGWYLZAEBIK-UHFFFAOYSA-N	449.533	1.483	50	20	IDGD	
Cc1nnc(NNC(=O)c2ccc(Cl)c(S(=O)(=O)N3CCC[C@H](C)C3)c2)nc1O	817276898	SSBSCUXPKPGAGT-JTQLQIEISA-N	440.913	1.717	50	20	IDGD	
O=C(CNc1ccccc1)NNC(=O)c1cc(S(=O)(=O)N2CCCC2)ccc1Cl	823328903	ZXCIVWJULGMSQO-UHFFFAOYSA-N	436.921	1.998	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)[C@@H]2CC(=O)N(c3ccc(F)c([N+](=O)[O-])c3)C2)c1	913120340	HCVCYUVSUAVFRP-CYBMUJFWSA-N	429.408	1.614	50	20	IDGD	
O=C1CC[C@H](C(=O)NNC(=O)c2cccc(S(=O)(=O)Nc3ccc(Cl)cc3)c2)N1	913138166	WWODOYTVSFCCIQ-OAHLLOKOSA-N	436.877	1.180	50	20	IDGD	
Cc1nn([C@@H]2CCS(=O)(=O)C2)c(Cl)c1C=NNC(=O)c1c(C)nc2ccccn12	915931468	LUDBWAQWDRQMMN-CYBMUJFWSA-N	434.909	1.925	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@H]1CC(c2cccc(F)c2)=NO1	916134372	KYEXMUAKNCVWAB-OAHLLOKOSA-N	433.465	1.381	50	20	IDGD	
CCN(CC(=O)NCc1ccc(F)cc1)CC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	916145321	AGZVDYZPTXEAFJ-UHFFFAOYSA-N	431.424	1.133	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)N[C@@H]2CCc3nc(C)ncc3C2)nc1	916317550	AVBIMSBWOPPNCI-OAHLLOKOSA-N	433.538	1.394	50	20	IDGD	
O=C(CCNC(=O)c1ccc([N+](=O)[O-])cc1)NNC(=O)c1nn(-c2ccccc2)cc1O	917362646	KIQYOTLGRPNRFK-UHFFFAOYSA-N	438.400	1.067	50	20	IDGD	
CN(CC(=O)NNC(=O)c1cc(-c2ccccc2)[nH]n1)C(=O)c1ccc(Br)o1	917393203	AXTBDUSBQCYMGQ-UHFFFAOYSA-N	446.261	1.965	50	20	IDGD	
COCCOc1ccccc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	919677788	DYPFWJQZZLUYJX-UHFFFAOYSA-N	447.513	1.571	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNS(=O)(=O)c1cc(CC(=O)O)ccc1OC	919957472	MOWQXVZOYIKFSY-UHFFFAOYSA-N	428.850	1.608	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)NCc2ccccc2S(=O)(=O)NC(C)(C)C)c1	920838524	QKYQLJAYYVRPPL-UHFFFAOYSA-N	447.561	1.974	50	20	IDGD	
Nc1cnnc(NNC(=O)c2cccn3c(I)cnc23)c1Cl	1116304407	KADRTHGJRCZDQM-UHFFFAOYSA-N	429.609	1.721	50	20	IDGD	
O=C(NNC(=O)[C@H](O)[C@@H](O)c1nc2ccccc2s1)c1ccc(Br)cc1	1320031271	OTVPOWSWNMPWCL-ZIAGYGMSSA-N	436.287	1.914	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)N[C@@H]1CCCN(C(=O)c2ccccc2)C1	1321400446	MQARNQXVNXGBFN-QGZVFWFLSA-N	426.473	1.709	50	20	IDGD	
C[C@H]1CN(Cc2csc(NC(=O)NNC(=O)c3n[nH]c4c3CCCC4)n2)C[C@@H](C)O1	1337767394	SBOGFTNDAQPAJH-TXEJJXNPSA-N	433.538	1.821	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4nc(CO)[nH]c4c3)C2)C1	1777702391	FEWYHVFATKEWJQ-BTYIYWSLSA-N	434.924	1.906	50	20	IDGD	
CN1CCc2cc(C(=O)N3CC[C@]4(CN(C(=O)CO[Si](C)(C)C)CCO4)C3)ccc21	1777918681	DMKHCXHUIWKDHB-QFIPXVFZSA-N	431.609	1.974	50	20	IDGD	
CC(C)CNC(=O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)CBr)C2	1778111774	CXEFYAIVJGOLBS-QMTMVMCOSA-N	446.386	1.304	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3coc([Si](C)(C)C)c3)C2)C1	1778999370	AILGSZPDFSPECX-DNVCBOLYSA-N	428.989	1.522	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(CN(C(=O)c3cnoc3)CCO2)C1	1780097837	NXDXZQIYJFFURH-HXUWFJFHSA-N	444.400	1.265	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@](C)(Cl)CCl)C1	1780714787	IQRLLODNWOZOLT-BQGCOEIASA-N	429.772	1.990	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(C)cc3)C2)C1	1780769983	LDVKRULLKOUYGD-QADUPLGGSA-N	437.500	1.573	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(O)n1)C2)[C@H](F)Br	1780771589	MQZUMZLXNUJRDI-HACGYAERSA-N	430.274	1.605	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2)c1cn2c(F)cccc2n1	1781318947	PYKSLOKUMMKESZ-STXHMFSFSA-N	438.887	1.201	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3c(O)cc(O)cc3O)C2)C1	1781810074	XPUHEEIHYOVOQB-BBATYDOGSA-N	443.294	1.278	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)n1ccnn1)C2	1781905232	KZMJZLCANJSXDL-OIPACUDHSA-N	442.358	1.527	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1c(C)nn(C)c1C)C2	1782178606	PPBPXCYJAAWVLU-DBXWQHBBSA-N	440.972	1.347	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnn4c3CCC4)C2)C1	1782313903	FUSZAIFPLXPFSK-ACJLOTCBSA-N	425.327	1.304	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(F)nc3F)CCO2)C1	1783340463	YMLHPEWJINFETG-PXAZEXFGSA-N	432.265	1.977	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](C)CBr)CCO2	1783529645	WDMHELQBLDWATC-SUNKGSAMSA-N	426.149	1.631	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)Cc3cc(Cl)ccc3OC)CCO2)C1	1783880858	HUNDDBUNVKIDQM-UZLBHIALSA-N	445.343	1.975	50	20	IDGD	
CCC[C@H](NC(C)=O)C(=O)N1CC[C@@]2(CN(C(=O)[C@@H](Br)CC)CCO2)C1	1785446372	GCPCQYHJIBDLMS-MPGHIAIKSA-N	432.359	1.295	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)C(C)(C)CCl)C[C@@H]32)n1	1785530293	GDIKKLPDHADBEQ-ZOBUZTSGSA-N	436.940	1.898	50	20	IDGD	
C[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Cl)C[C@@H]21)N1CSCSC1	1788682938	MXEYAQBUZADWDS-IKOXMDCHSA-N	425.979	1.544	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3n[nH]c(C4CC4)c3F)C[C@@H]21	1788760993	HZXIOYLXMVIUSK-KKUMJFAQSA-N	438.576	1.871	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]3C2)c(O)c1	1789927044	OKDZYOCNQRERSL-DLKVLKDVSA-N	429.286	1.984	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CSCC(=O)O)[C@H]2C1	1791301247	XSXNCUKUGKNHJE-YWDSYVAPSA-N	427.350	1.020	50	20	IDGD	
CNC(=S)NCCC(=O)NC1(c2ccc(NC(=O)[C@H](Cl)COC)cc2)CCC1	1791569457	UYZAHPGPDPWIGA-OAHLLOKOSA-N	426.970	1.858	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC1(c2ccc(NC(=O)CSc3nc[nH]n3)cc2)CCC1	1791822673	JKNKFKCNQGHVKS-UHFFFAOYSA-N	445.549	1.404	50	20	IDGD	
COc1cccc(Cl)c1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21	1792018216	MDIREMVXMRHSRU-DUPGQFARSA-N	431.316	1.542	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cccc([N+](=O)[O-])c1	1792421092	OIJHZXZYHROQNI-CSHUHZATSA-N	444.315	1.963	50	20	IDGD	
CC(C)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/C(=O)NCc1ccccc1)C2	1792782785	DNRHGULPQQAXIP-RJNPGBPASA-N	447.963	1.714	50	20	IDGD	
COCc1c[nH]c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)CBr)c1	1792872588	PTMMRDAIFHUEEO-ZIEJDFEHSA-N	428.327	1.395	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CC[C@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Cl)C3)C1	1793155451	RUISROSLPVKJHD-DERJNBNXSA-N	447.935	1.804	50	20	IDGD	
Cc1cnc(Cl)c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)c1	1795343882	HYAPHCVHYGOBDM-BJWYYQGGSA-N	427.697	1.289	50	20	IDGD	
C[C@@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CO[Si](C)(C)C)C2)[C@H]1SC(=N)NC1=O	1796878552	HNAURSNUHBKNQS-ZHZXCYKASA-N	426.615	1.279	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](C)C1(O)CCC1)C2	1796889559	CNQFGSDMSRCLIK-NJSXQYKGSA-N	429.521	1.310	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(-n2cncn2)c1	1799775964	UBCWQNXFUNTWNG-FAYQHZLMSA-N	448.321	1.254	50	20	IDGD	
O=C(Cn1cccc([N+](=O)[O-])c1=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](F)Br	1800161343	FKTFQRANFRPAGT-FBKDDSFISA-N	445.245	1.085	50	20	IDGD	
C[C@H](Cc1ccncc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2	1800192816	FBITWZAVPOTKFE-YMILTQATSA-N	428.302	1.540	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CCc2nc[nH]c2C1	1801270779	SGKDLZSENGYFTJ-LHLGERLTSA-N	439.354	1.278	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(C(=O)O)n(C(C)C)n1)C2	1802273457	LYIBKKRJDBQZRX-XJFOESAGSA-N	426.901	1.668	50	20	IDGD	
C[C@H](CC(N)=O)C(=O)NC[C@@H]1CCN(C(=O)[C@](C)(Cl)CCl)[C@@H]1c1cccnc1	1803672417	XHQJLLHOBJYBMW-MGPHVCOZSA-N	429.348	1.835	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(S(C)(=O)=O)c(F)c1	1803894950	WDHLMWAUBJMAFN-XGUBFFRZSA-N	446.928	1.735	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)CSC1=S	1804335972	IRQIFDCAKIHFGD-MMWGEVLESA-N	434.381	1.268	50	20	IDGD	
Cc1occc1C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1805614874	IMIHHZAETVKDRI-WIYYLYMNSA-N	433.273	1.296	50	20	IDGD	
COCCOCC(=O)N1CC[C@H](CNC(=O)CCBr)[C@H]1c1cccnc1	1806340648	ITFDOAAVNKXTGE-CRAIPNDOSA-N	428.327	1.535	50	20	IDGD	
CC(=O)NC[C@@H]1CCN(C(=O)CN(C)NC(=O)NCc2ccccc2)[C@@H]1c1cccnc1	1806718590	HNGHDAXCFUNELC-RBBKRZOGSA-N	438.532	1.454	50	20	IDGD	
O=C(NCC(=O)N1CC[C@H](CNC(=O)[C@H](F)Cl)[C@H]1c1cccnc1)c1cccnc1	1808308330	JCQVUIHVAJRLFD-OLMNPRSZSA-N	433.871	1.447	50	20	IDGD	
CCC1(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)CCC1	1809644609	GSAVHRMPRKOBAB-TZIWHRDSSA-N	435.333	1.661	50	20	IDGD	
Nc1ccccc1/C=C/C(=O)N1CCCC2(CCN(C(=O)c3ccc(B(O)O)cc3)CC2)C1	1809848381	FYLRPHMQRLUDJK-DHZHZOJOSA-N	447.344	1.507	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC2(CCCN(C(=O)c3cc(C(F)F)no3)C2)CC1	1810235960	YBXDBMGGYOLQQX-UHFFFAOYSA-N	447.247	1.451	50	20	IDGD	
Cn1ncc(C(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)c1Cl	1811165397	RSQLZFDMJADUPT-NWANDNLSSA-N	426.304	1.388	50	20	IDGD	
C[C@H](NC(=O)c1ccccn1)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Cl)[C@H]1c1cccnc1	1812347688	PFWXHCWBWZYYGG-QXRTWZOPSA-N	447.898	1.835	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)Cn2ccccc2=O)[C@@H]1c1cccnc1	1813030508	IVGZNUYFRQSNQF-FUHIMQAGSA-N	432.908	1.203	50	20	IDGD	
C=CCO[C@@H](C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1815214488	VWTSONDUSNXJFR-GUYCJALGSA-N	441.492	1.305	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1coc(Cl)n1	1816174242	CEMAGCJNRCWGFR-OAHLLOKOSA-N	443.656	1.351	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)C(Cl)Cl)[nH]n1)c1cc2n(n1)CCNC2=O	1816626337	LHTMXWJYMJXQNB-NSHDSACASA-N	440.291	1.459	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)Cc2ccccc2)[nH]n1)c1cccc(B(O)O)c1	1817473242	NHGVOJISQYNHMZ-HXUWFJFHSA-N	432.289	1.638	50	20	IDGD	
O=C(Cc1ccccc1O)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1822011418	KWWXWEBPMRFPNJ-LJQANCHMSA-N	448.288	1.344	50	20	IDGD	
Cc1noc(C)c1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1	1822412650	BCPRVRAEBMSPLW-OAHLLOKOSA-N	431.497	1.693	50	20	IDGD	
O=C(CN1C(=O)C=CC1=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](F)Br)[nH]n1	1822529555	CIAUBILLNSTHKK-MEBBXXQBSA-N	442.245	1.017	50	20	IDGD	
O=C(N[C@H]1CCc2nc(NC(=O)[C@H]3CCCS3(=O)=O)sc2C1)C(Cl)Cl	1824940568	XYFPKESZZHIDIJ-OIBJUYFYSA-N	426.347	1.436	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@](C)(O)C(F)(F)F)CC2	1825993922	FVZZMSSNNVZMNM-CYVIZDSUSA-N	429.848	1.622	50	20	IDGD	
CC(C)[C@H](S)C(=O)N[C@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1	1826083947	VTHSBFDPVRQHCR-ZBEGNZNMSA-N	427.596	1.383	50	20	IDGD	
C[C@H](CS(C)(=O)=O)C(=O)N[C@H]1CCc2nc(NC(=O)C(Cl)Cl)sc2C1	1826093415	ZQGUHVFYDHGVRB-SFYZADRCSA-N	428.363	1.540	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CCN2CCOCC2)CC1	1826749091	FWHPXEFRTDNUBA-OALUTQOASA-N	429.989	1.582	50	20	IDGD	
O=C(Cc1ccccc1)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827054812	LFQCCOCNJWTQQN-QHCPKHFHSA-N	434.345	1.842	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(Cl)c3C)CCO2)C1	1830140200	UMQUKBBANYESFB-PXNSSMCTSA-N	445.343	1.972	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CSc3ccncc3)C2)C1	1830359307	ZDMBCSVKACPSLE-HXUWFJFHSA-N	441.981	1.895	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](C)CBr)CCO2)C1	1830535246	KENVCYPCZKXIKZ-KEYYUXOJSA-N	439.778	1.881	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3[nH]nc4ccncc34)C2)C1	1831647143	RAWGFFQGQUXAFN-QRWLVFNGSA-N	435.912	1.435	50	20	IDGD	
CC(C)N1CCC[C@H]1C(=O)N1CCC([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1	1831876260	BWAUNOPOECRSDE-SFTDATJTSA-N	449.640	1.852	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3cccnc3Cl)CCO2)C1	1832716511	MOBHOMHGSURBJI-FQEVSTJZSA-N	444.359	1.999	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)[C@H]2CCCSC2)CC1	1832857003	UHHVKJQAYJDUIH-PZJWPPBQSA-N	444.406	1.743	50	20	IDGD	
C[C@@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)c3cnccn3)CC2)CC1	1833262175	ISVLAZDTMZUKIA-AWEZNQCLSA-N	438.370	1.693	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1)C(=O)c1ccco1	1833754343	NOWPQYIPMCRQTB-UHFFFAOYSA-N	440.338	1.819	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccnc(Cl)c3)CCO2)C1	1834185432	IADKWNJZYCBMMM-KBXCAEBGSA-N	432.304	1.059	50	20	IDGD	
C[C@H](C(=O)N1CCC(N2CCC(NC(=O)CCBr)CC2)CC1)n1ccnc1	1834422486	PADHYAPDGCEYPV-OAHLLOKOSA-N	440.386	1.801	50	20	IDGD	
Cc1ccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)cc1	1835084398	CSVZRMDVAISYDO-PKOBYXMFSA-N	443.313	1.684	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)N1CCC(OC2CCN(C(=O)C(C)(C)CCl)CC2)CC1	1836623776	PSTZTGSNXWGCDS-OAHLLOKOSA-N	427.973	1.941	50	20	IDGD	
O=C(c1cncc2cnccc12)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836717884	DZGKZOLXUCYFDP-FQEVSTJZSA-N	446.935	1.842	50	20	IDGD	
CCCOc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)cc1	1839011074	JMGCQYYSQFVSEC-WIYYLYMNSA-N	440.924	1.145	50	20	IDGD	
O=C(c1cccnc1S)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839197079	HPDYVZFAYFLAGJ-LRDDRELGSA-N	448.314	1.131	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(O)c(C)c3)CCO2)C1	1839309771	SGUOYYSDBPZDST-JXFKEZNVSA-N	426.897	1.024	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(CC#N)cc3)CCO2)C1	1839364318	YGYCKQDDBDGXQD-WIYYLYMNSA-N	435.908	1.076	50	20	IDGD	
N#Cc1ccc2[nH]nc(C(=O)N3CCO[C@]4(COCCN(C(=O)[C@H](F)Cl)C4)C3)c2c1	1839487869	JSKPARRUTUVKFM-QFBILLFUSA-N	435.843	1.039	50	20	IDGD	
O=C1Cc2cccc(C(=O)N3CCO[C@]4(COCCN(C(=O)C(Cl)Cl)C4)C3)c2N1	1839574629	UMXJQQTTYBLIBN-LJQANCHMSA-N	442.299	1.055	50	20	IDGD	
C=CCO[C@H](C)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H](Br)CC)CCO2)C1	1839962472	GHZISLSWTDWBSN-VKJFTORMSA-N	433.343	1.207	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(F)cc(F)c3)C2)C1	1840034355	ISGWOWJGTJRMAV-KPZWWZAWSA-N	447.276	1.818	50	20	IDGD	
CCOc1cccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](Cl)COC)CCO3)c1	1840154122	LWXBVZKXWYTDSW-NQIIRXRSSA-N	440.924	1.409	50	20	IDGD	
COc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)ccc1F	1840190826	PMDRNOIPMBQWHZ-SFHVURJKSA-N	435.279	1.708	50	20	IDGD	
C[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)CCBr)C2)C1)c1ccccn1	1840500540	JCDAUNYJLCZKDK-KXBFYZLASA-N	440.338	1.427	50	20	IDGD	
COc1nccc(C(=O)N2CCCC23CN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C3)c1F	1843113713	HEPXMLQQAZQVNJ-DHRITJCHSA-N	442.451	1.180	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)C2(c3cccc(Cl)c3)CC2)C1	1843815764	AJJOJHOFZLVYNN-UHFFFAOYSA-N	438.720	1.569	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@H]2CCN(C(=O)OC(C)(C)C)C2)C1	1843904122	RFPIPEQTIYYNAA-CABCVRRESA-N	429.945	1.701	50	20	IDGD	
CN1CCN(CC(=O)N2CC3(CCCN3C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)CC1	1845871161	VTOPEPFRXNCDID-WOJGMQOQSA-N	443.498	1.323	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)C(C)(C)CCl)[C@@H](O)C1	1847437872	APEPJRVALFLYFL-VGWMRTNUSA-N	443.972	1.681	50	20	IDGD	
O=C(CSc1nnc(NC[C@H]2CCCO2)s1)NNC(=O)c1ccc([N+](=O)[O-])cc1	16330859	LGPBZTJENGBRPR-GFCCVEGCSA-N	438.491	1.591	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=O)COc2ccc(C#N)cc2)ccc1F	26693322	FWXNVKMALAVBAT-UHFFFAOYSA-N	448.476	1.568	50	20	IDGD	
O=C(CCn1c(=O)[nH]c(=O)c2ccccc21)NNC(=O)c1cc2c(s1)CCCCC2	27103798	ZVMKOXPJAOGFHP-UHFFFAOYSA-N	426.498	1.872	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1)c1csc(N2CCOCC2)n1	109339983	XQPLWHWJKWLHOW-INIZCTEOSA-N	447.536	1.792	50	20	IDGD	
COc1cc(/C=C(/C#N)C(=O)Nc2nccs2)ccc1OCC(=O)N1CCOCC1	207897094	GMIMFNZLXXUMRI-GDNBJRDFSA-N	428.470	1.935	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)N2CCCN(CC(=O)N3CCCC3)CC2)c1C	725882335	BFJMSPYBRIDRDR-CJLVFECKSA-N	441.576	1.815	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)c2cccc(OC(F)F)c2)cc1	728510352	HJOHMAYSTSWUCP-UHFFFAOYSA-N	449.457	1.162	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CC(=O)N(c2ccc(F)cc2F)C1)C1CCN(c2ncccn2)CC1	728847390	CQXAVVPMYKSIJQ-CQSZACIVSA-N	444.442	1.172	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N(CC(N)=O)C(C)C)cc1	728856929	NPBBWJNMEDVBLI-MHWRWJLKSA-N	438.488	1.063	50	20	IDGD	
C[C@@H]1CCCN(C(=O)C2CCN(C(=O)NNC(=O)CNC(=O)c3cccs3)CC2)C1	728951168	DEMPVHSOYSBDAE-CQSZACIVSA-N	435.550	1.189	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CSc2ccc(C(N)=O)cc2[N+](=O)[O-])c(OC)c1	729951746	SEDZJEZKFXRHAS-UHFFFAOYSA-N	434.430	1.264	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@H](C)N2CCc3ccccc3C2)cc1	732260785	YYYBOTYATHVCSE-KRWDZBQOSA-N	444.557	1.210	50	20	IDGD	
CC(C)[C@H](NC(=O)OCc1ccccc1)C(=O)NNC(=O)CCN1C[C@H](C)O[C@H](C)C1	732261412	MTOTXPSCGVAKRQ-QKLQHJQFSA-N	434.537	1.584	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)[C@H]2CC(=O)N(c3ccc4c(c3)CCC4)C2)C[C@@H](C)O1	732262039	HYXVAYHEVHXZNL-MDZRGWNJSA-N	428.533	1.175	50	20	IDGD	
C[C@]1(NNC(=O)N[C@@H]2CCN(c3ccc(C(F)(F)F)cc3)C2=O)CCS(=O)(=O)C1	733851462	ZNUBBGQESIDRNW-CJNGLKHVSA-N	434.440	1.192	50	20	IDGD	
C[C@@]1(NNC(=O)N[C@H]2CCN(Cc3ccc(C(F)(F)F)cc3)C2)CCS(=O)(=O)C1	734071414	JTXFVEUNKJGEDS-DOTOQJQBSA-N	434.484	1.661	50	20	IDGD	
CN1CCC[C@H](CNC(=O)NNC(=O)C(=O)NC2CC2)[C@H]1c1ccc(C(F)(F)F)cc1	735587034	QQTXWSAJIKKKCL-CZUORRHYSA-N	441.454	1.697	50	20	IDGD	
O=C1CCC(=O)N(c2ccc(C(=O)NNC(=O)c3cccc(Br)c3)cc2)N1	742769826	UPUPMVCQXJQRBN-UHFFFAOYSA-N	431.246	1.682	50	20	IDGD	
C[C@@H](CN1CCN(c2ccccc2)CC1)NC(=O)NNC(=O)COc1ccccc1O	743633406	NWOIBPPQBTVXSQ-KRWDZBQOSA-N	427.505	1.312	50	20	IDGD	
O=C(NNC(=O)c1cc2c(s1)CCC2)N[C@@H]1CC(=O)N(CCOc2ccccc2)C1	743639578	WJQZKWOOHAOWSF-OAHLLOKOSA-N	428.514	1.861	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CN2CCN(C(=O)c3cc4ccccc4[nH]3)CC2)c1	744392470	ONGCBSNHBGBDDJ-UHFFFAOYSA-N	430.468	1.259	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)[C@@H]2CC(=O)N(c3ccc4c(c3)CCC4)C2)c1	744681808	DZKCTSGAYMUYJN-LJQANCHMSA-N	435.480	1.841	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)c2cccc(S(=O)(=O)NCC3CC3)c2)c1	744693136	WKMVFBLEWQCMDI-UHFFFAOYSA-N	445.497	1.301	50	20	IDGD	
O=C(COC(=O)[C@H]1C[C@@H]1c1ccc2c(c1)OCCO2)NNC(=O)c1cccc([N+](=O)[O-])c1	745285682	XZUSULWOCJNZSM-CVEARBPZSA-N	441.396	1.474	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)NCCC(=O)NNc2cc(F)c(F)c(F)c2)cc1	746706819	JRAULMXGYSTYAE-UHFFFAOYSA-N	430.408	1.874	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H]2CCCN2Cc2ccc(F)cc2)c1	747344370	DFPRIAWHVQDYGU-LJQANCHMSA-N	448.520	1.502	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(C(=O)NCC(=O)NNC(=O)CC2CCCC2)cc1	749951570	ZDFBTDCFULLKBM-UHFFFAOYSA-N	438.550	1.175	50	20	IDGD	
CO[C@H](C)c1nc(CN2CCCN(CC(=O)NNC(=O)c3ccccc3)CC2)cs1	752354464	FPTCJIOTYNHBPD-MRXNPFEDSA-N	431.562	1.819	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCOc2ccccc2Cl)c1	752700295	BHTYUYDEZUZTFB-UHFFFAOYSA-N	440.909	1.613	50	20	IDGD	
CN(C)N(C(=O)[C@@H]1CC(=O)N(CCOc2ccccc2Cl)C1)[C@@H]1CCS(=O)(=O)C1	752761894	CFDCBYWSVCDCFT-HUUCEWRRSA-N	443.953	1.060	50	20	IDGD	
COc1cccc(C[C@@H](C(=O)NNC(=S)NCCc2cccs2)n2nnnc2C)c1	753076844	HLVHSWRIZCQDIV-KRWDZBQOSA-N	445.574	1.573	50	20	IDGD	
CC(C)N1CC(=NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)[C@H](C)C1	754256664	YHPWIDURCTUKHJ-QGZVFWFLSA-N	436.578	1.472	50	20	IDGD	
COc1cc(C(=O)NNC(=O)N[C@@H](C)CNC(=O)OC(C)(C)C)cc(OC)c1OC	755227757	VOQWAYRFIMYUSN-NSHDSACASA-N	426.470	1.570	50	20	IDGD	
C[C@H](CS(=O)(=O)c1ccc(F)cc1)C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C	755377865	WTBAHISSDVMITM-GFCCVEGCSA-N	446.501	1.091	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCCCC2)cc1NC(=O)NNC(=O)Cc1ccncc1	755391658	DOUFQOCHVSKRNB-UHFFFAOYSA-N	431.518	1.960	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)Nc1ccc(C)c(S(=O)(=O)N2CCCCC2)c1	755394166	SLJPBZDOXPHANR-OAHLLOKOSA-N	442.538	1.374	50	20	IDGD	
CCOCC(=O)NNC(=O)Nc1cc(S(=O)(=O)N2CCCCCC2)ccc1OC	755421073	RKMXAMMFAMZPLF-UHFFFAOYSA-N	428.511	1.449	50	20	IDGD	
CC(C)N(C)S(=O)(=O)c1ccc(NC(=O)NNC(=O)c2ccc3c(c2)OCO3)cc1	755451126	JBFOGNXPGLZGPE-UHFFFAOYSA-N	434.474	1.911	50	20	IDGD	
COC(=O)CCNC(=O)c1ccc(NC(=O)NNC(=O)c2ccc(OC)c(OC)c2)cc1	755605046	XUSCEBUHRGLXEN-UHFFFAOYSA-N	444.444	1.463	50	20	IDGD	
CNC(=O)c1ccc(C)c(NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c1	755665823	UOPLOOMHJVQAHJ-UHFFFAOYSA-N	438.532	1.720	50	20	IDGD	
Cc1c(C(C)(C)C)nn(-c2ccccc2)c1NC(=O)NNC(=O)[C@H](C)NS(C)(=O)=O	756603550	HVMTUVKDZSCBCH-ZDUSSCGKSA-N	436.538	1.569	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)cc1OCC1CCOCC1	756714030	XSEYRENPNZRBHQ-OAHLLOKOSA-N	425.507	1.388	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)Nc1cc(C2CC2)nn1[C@H]1CCS(=O)(=O)C1	756857973	ZIQCFLZFAIOKMM-HNNXBMFYSA-N	435.481	1.655	50	20	IDGD	
COc1ccccc1N1CC[C@H](NC(=O)NNC(=O)COc2ccc(C)c(C)c2)C1=O	757285530	KDGOLOKCGDMXKA-KRWDZBQOSA-N	426.473	1.827	50	20	IDGD	
Cc1ccc(-c2csc3ncn(CCC(=O)NNc4ccc(C(N)=O)nn4)c(=O)c23)cc1	757402695	OIFOSBIHDUPBCP-UHFFFAOYSA-N	449.496	1.856	50	20	IDGD	
C[C@H]1C[C@H](C)CC2(C1)NC(=O)N(CC(=O)NNC(=O)NCc1ccc(Cl)cc1)C2=O	757648351	QPYXOYARCQDYKJ-STQMWFEESA-N	435.912	1.917	50	20	IDGD	
Cc1c(C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cnn1CCO[C@H]1CCCCO1	758053176	FLWWEPXOURKPCB-OALUTQOASA-N	430.461	1.336	50	20	IDGD	
O=C(NNc1nc(O)c2ccccc2n1)[C@@H]1CCCN(S(=O)(=O)c2ccccc2)C1	758310420	CGUJSTTYPLDPAF-CQSZACIVSA-N	427.486	1.879	50	20	IDGD	
COC(=O)[C@@H](C)Oc1ccc(/C=C(\C#N)C(=O)Nc2ccc(S(N)(=O)=O)cc2)cc1	758415516	ISQUVSLLOXNMLG-WDGDVPDHSA-N	429.454	1.820	50	20	IDGD	
O=C(NCCOc1cccc(C(F)(F)F)n1)NNC(=O)[C@H]1COc2ccccc2O1	758949977	XFFUFWJRGNYTPS-CYBMUJFWSA-N	426.351	1.650	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2ccc3c(c2)OCO3)nc1I	761135646	MMGXEUVNXVOQFQ-UHFFFAOYSA-N	441.181	1.498	50	20	IDGD	
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)NNC(=O)CCCNC(=O)OC(C)(C)C	763439803	UGJNCLRBOWHTAC-UHFFFAOYSA-N	432.455	1.218	50	20	IDGD	
COc1cccc(-c2nsc(NC(=O)C(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)n2)c1	763468966	ZGFVHFGQAXHZCL-UHFFFAOYSA-N	442.413	1.522	50	20	IDGD	
COC(=O)COc1cccc(NC(=O)C(=O)NNC(=O)c2cc3ccccc3cc2O)c1	763521863	JXTIAAVDBNAMRO-UHFFFAOYSA-N	437.408	1.497	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(F)cc(N3CCOCC3)c2)cc1OC	763551287	NYDFKQOSQVOIQM-UHFFFAOYSA-N	446.435	1.079	50	20	IDGD	
O=C(NNC(=O)c1ccccc1F)C(=O)Nc1cccc(C(=O)N2CCSCC2)c1	763560463	BCZZPYKFAJAXIX-UHFFFAOYSA-N	430.461	1.414	50	20	IDGD	
CC(C)C(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1	763569800	CCQXVAXIFFAFDS-KRWDZBQOSA-N	426.429	1.207	50	20	IDGD	
CC[C@H](C)NS(=O)(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2cc(C)oc2C)c1	763585433	AOKOJPSCJOWENN-NSHDSACASA-N	436.490	1.373	50	20	IDGD	
CCn1cnnc1-c1ccccc1NC(=O)C(=O)NNC(=O)COc1cc(C)cc(C)c1	763648670	VVNPLBABFJVWNF-UHFFFAOYSA-N	436.472	1.747	50	20	IDGD	
CC1CCN(Cc2ccc(NC(=O)C(=O)NNC(=O)COc3ccccc3C#N)cc2)CC1	763806928	JBWNTXARWKPSOX-UHFFFAOYSA-N	449.511	1.955	50	20	IDGD	
CCNC(=O)c1ccc(C)c(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)c1	763840250	JUSFXZRCWIKYAW-MRXNPFEDSA-N	440.500	1.915	50	20	IDGD	
Cc1ncccc1NC(=O)C(=O)NNC(=O)c1nn(CCC(C)C)c(=O)c2ccccc12	763843037	MOKPQPJQNQNGQU-UHFFFAOYSA-N	436.472	1.546	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)n1	763892194	ATLQZSHGWTUGEJ-HUUCEWRRSA-N	446.483	1.039	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)C(=O)Nc1ccc(-c2csnn2)cc1	763943324	FPFFCWINORWLJG-UHFFFAOYSA-N	449.452	1.496	50	20	IDGD	
COC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)c1	763947774	CPVFRFGVYIICMX-UHFFFAOYSA-N	438.400	1.156	50	20	IDGD	
CCOc1cc(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)ccc1OC	763995004	CBULHIHKSXLFNH-UHFFFAOYSA-N	425.239	1.584	50	20	IDGD	
CN(C)C(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)ccc1Cl	764004704	RLLOPNGIJHOGJF-UHFFFAOYSA-N	446.847	1.213	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)C2CCCC2)c(C(=O)N2CCCC2)cc1OC	764064650	MKJVOLZMOLBYJH-UHFFFAOYSA-N	432.477	1.216	50	20	IDGD	
CC[C@@H](C)C(=O)NNC(=O)C(=O)Nc1cc(I)cc(C(=O)OC)c1	764081461	HJHINZKFELBSBC-MRVPVSSYSA-N	447.229	1.210	50	20	IDGD	
CCOC(=O)c1cc(C)sc1NC(=O)C(=O)NNC(=O)CCc1ccc(OC)cc1	764124463	HUVCGSMCASZEMY-UHFFFAOYSA-N	433.486	1.961	50	20	IDGD	
CCOc1cc2c(cc1NC(=O)C(=O)NNC(=O)[C@H]1Cc3ccccc3O1)O[C@H](C)C2	764151412	IMLKLFQYQYOPKC-CWTRNNRKSA-N	425.441	1.498	50	20	IDGD	
CCOCCOCc1cccc(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)c1	764153972	NPXJKIMSBSNMAS-IBGZPJMESA-N	427.457	1.329	50	20	IDGD	
CC(C)(C)OC(=O)N1CCc2c(cccc2NC(=O)C(=O)NNC(=O)c2ccoc2)C1	764164175	RFONQZJBOZKCAB-UHFFFAOYSA-N	428.445	1.973	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)c2scnc2C)c2ccccc12	764245726	AGVPBXCTVJWHRU-UHFFFAOYSA-N	442.453	1.556	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)C(=O)Nc1ccnn1-c1ccc(Cl)cc1	764279230	ZKWXLZGPCJOLQB-UHFFFAOYSA-N	427.848	1.950	50	20	IDGD	
CC(C)(C(=O)NNC(=O)C(=O)Nc1cccc(OCCS(C)(=O)=O)c1)c1ccccc1	764309074	KSALVNYTGRXWQO-UHFFFAOYSA-N	447.513	1.174	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)c1ccc(N2CCc3ccccc3C2)cc1	764345874	ZQPBHYHWAVJEGE-UHFFFAOYSA-N	429.480	1.835	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)C(=O)Nc1ccc(-c2noc(C(F)(F)F)n2)cc1	764354682	UVBQAXNUYSFDPK-UHFFFAOYSA-N	434.334	1.479	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cnn(C)c2)n(-c2ccccc2C(F)(F)F)n1	764358443	DHIBAWNMPVAGAR-UHFFFAOYSA-N	435.366	1.333	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)CCN3C(=O)OC(C)(C)C)cn1	764359465	TXMSUTFMILIYIJ-UHFFFAOYSA-N	428.449	1.117	50	20	IDGD	
Cc1cc(C(=O)NC2CCCCC2)ccc1NC(=O)C(=O)NNC(=O)c1cnn(C)c1	764359931	QTZQXONFHUSZPZ-UHFFFAOYSA-N	426.477	1.191	50	20	IDGD	
Cc1cc(N2CCSCC2)ccc1NC(=O)C(=O)NNC(=O)COCc1ccccc1	764365982	IQTCBPCBIYLFIW-UHFFFAOYSA-N	442.541	1.851	50	20	IDGD	
Cc1cccc(C(=O)N2CCCC2)c1NC(=O)C(=O)NNC(=O)COCc1ccccc1	764367792	ZSNZJRKKIHNCHO-UHFFFAOYSA-N	438.484	1.534	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)C(=O)Nc1c(F)cccc1-n1cccn1	764401674	QFJAUYAUMFBAEP-UHFFFAOYSA-N	429.433	1.595	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccccc2C)cc1-n1nnnc1C1CC1	764407301	LRMGSYMSEOJXIV-UHFFFAOYSA-N	449.471	1.185	50	20	IDGD	
COc1cc(OC)c(OC)cc1NC(=O)C(=O)NNC(=O)c1ccc(Cl)cc1F	764410403	OHKOADIOEUXDAC-UHFFFAOYSA-N	425.800	1.905	50	20	IDGD	
O=C(NNC(=O)[C@]1(O)CCSC1)c1ccccc1NS(=O)(=O)c1cccs1	765543790	OCRIZVZKNDBDKE-INIZCTEOSA-N	427.529	1.178	50	20	IDGD	
CC(C)CCn1cc(C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)nn1	765759948	YRMRMGKFKKGBFR-UHFFFAOYSA-N	447.971	1.556	50	20	IDGD	
O=C(/C=C/c1ccc2[nH]ccc2c1)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765804948	PTILWUXGQRXAKL-VQHVLOKHSA-N	431.496	1.787	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)[C@H]1CCCN(C(=O)N2CCCC2)C1	767283528	LOQWXNZOEHPYDL-SFHVURJKSA-N	430.505	1.156	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)[C@H]1CCCN1C(=O)Cc1ccccc1	767308129	OXIZYNDVDPGVGH-HXUWFJFHSA-N	437.496	1.462	50	20	IDGD	
O=C(Cc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1cc(C2CC2)nn1-c1ncccn1	768237499	LVMPJSDWUCEXGA-UHFFFAOYSA-N	439.863	1.522	50	20	IDGD	
COc1cc2c(cc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccc(F)cc1)NC(=O)CC2	768239395	YXVCTOSKYYEQMX-LLVKDONJSA-N	444.419	1.272	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccsc2)cc1NC(=O)CCN(C)C	768240510	XKZOSFNBHAQROX-UHFFFAOYSA-N	431.518	1.275	50	20	IDGD	
O=C(CCNC(=O)C12CC3CC(CC(C3)C1)C2)NNC(=O)c1ccc2c(c1)OCCO2	770417987	PJDJNGIZZJGDKO-UHFFFAOYSA-N	427.501	1.942	50	20	IDGD	
Cc1ccc(C)c(S(=O)(=O)C2(C(=O)NNc3nc(O)c4cnn(C)c4n3)CCCC2)c1	770966868	AMOWVCZADPRPJO-UHFFFAOYSA-N	444.517	1.916	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)[C@H]1CCCN(C(=O)c2ccc3n[nH]cc3c2)C1	772068680	NFMBFCGYWLYDLZ-ZBFHGGJFSA-N	443.504	1.540	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NN=C1CCO[C@H](C)C1)N(S(C)(=O)=O)CC2	773189534	HWIJPVGSXBGVSJ-CXAGYDPISA-N	439.534	1.624	50	20	IDGD	
COC(=O)c1cc(OC)c(S(=O)(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)s1	773251808	OMGDBLSXYTVWFP-SECBINFHSA-N	448.906	1.974	50	20	IDGD	
COCc1nnc(-c2cccc(C(=O)NNC(=O)C(=O)NCc3ccc(Cl)cc3)c2)o1	776714889	VOBROMMXYVBHAK-UHFFFAOYSA-N	443.847	1.614	50	20	IDGD	
COCc1ccccc1S(=O)(=O)NNC(=O)c1sc(N2CCOCC2)nc1C	778556817	QARWZDLDMOXIFB-UHFFFAOYSA-N	426.520	1.058	50	20	IDGD	
COCCN1C(=O)CCc2cc(NC(=O)C(=O)NNc3ccc([N+](=O)[O-])cc3)ccc21	778723884	LTKHOFBTXSJSIX-UHFFFAOYSA-N	427.417	1.602	50	20	IDGD	
COc1cccc2[nH]cc(CC(=O)OCC(=O)NNC(=O)[C@H]3COc4ccccc4O3)c12	778868533	LRBUZQFVLUHKDG-GOSISDBHSA-N	439.424	1.250	50	20	IDGD	
O=C(Cn1nc2ccccn2c1=O)NNc1cc(C(F)(F)F)nc(-c2ccccn2)n1	779205356	MZNKPWHSNHSESD-UHFFFAOYSA-N	430.350	1.510	50	20	IDGD	
N#Cc1ccc(S(=O)(=O)NNC(=O)c2csc(N3CCOCC3)n2)c(Cl)c1	779830521	XACOKFOUFGWXLB-UHFFFAOYSA-N	427.895	1.128	50	20	IDGD	
O=C(NNc1ccccc1F)C(=O)Nc1ccc(F)c(S(=O)(=O)N2CCOCC2)c1	782702789	NFNFMFPLADNKNF-UHFFFAOYSA-N	440.428	1.068	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ccc(O)cc2)ccc1C	782829940	AAYFJDGFRTZTLB-UHFFFAOYSA-N	448.501	1.131	50	20	IDGD	
CCOC(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)c1	782883979	DCSPHNBUZJQRML-UHFFFAOYSA-N	437.456	1.008	50	20	IDGD	
O=C1C[C@@H](Cc2ccc(NC(=O)C(=O)NNc3ncccc3C(F)(F)F)cc2)C(=O)N1	783125587	KSHZEAGWXSHMSR-LLVKDONJSA-N	435.362	1.387	50	20	IDGD	
COCC(=O)N1CCc2cc(NC(=O)C(=O)NN=c3sc4ccccc4n3C)ccc21	783352061	VRHKEIUEYZODBF-UHFFFAOYSA-N	439.497	1.346	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1cnc(-c2ccccc2)s1	784004686	JDEYIOXTKHRCCO-UHFFFAOYSA-N	429.483	1.388	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNc2ccccn2)cc1S(=O)(=O)N1CCCCC1	784796168	GOEIQHZBPFZECE-UHFFFAOYSA-N	447.517	1.737	50	20	IDGD	
CC[C@@H](C)NS(=O)(=O)c1cccc(NC(=O)C(=O)NNc2cccnc2Cl)c1	784838807	DTXRKQXXOOGFRI-LLVKDONJSA-N	425.898	1.894	50	20	IDGD	
COC[C@H](C)NS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2cccnc2Cl)cc1	784843263	GWOQABPDOMTYRD-NSHDSACASA-N	441.897	1.130	50	20	IDGD	
O=C(NNc1cc(F)c(F)cc1F)C(=O)Nc1ccc(F)c(N2CCCS2(=O)=O)c1	784891937	NMHKUBKWCVWCRX-UHFFFAOYSA-N	446.382	1.865	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNc2ccnc(N(C)C)n2)cccc1S(=O)(=O)NC(C)(C)C	784969502	NAMCBUBSIMRQAW-UHFFFAOYSA-N	449.537	1.010	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2cccc(Cl)c2S(C)(=O)=O)n1	785226032	CUFQRVMMARAMGQ-UHFFFAOYSA-N	440.913	1.462	50	20	IDGD	
O=C(Cc1cccc(N2CCCC2=O)c1)NNc1ccc(S(=O)(=O)NC2CC2)cc1	787296791	VRCYSFLCNDJZSQ-UHFFFAOYSA-N	428.514	1.940	50	20	IDGD	
O=C(NNC(=O)C(=O)N1CCCC1)N[C@@H]1CCCN(c2ccc(Cl)cc2Cl)C1=O	788918384	UOPCRGIYLUAVAZ-CYBMUJFWSA-N	442.303	1.442	50	20	IDGD	
Nc1nc(Cl)cc(NNC(=O)Nc2ccc(F)c(S(=O)(=O)N3CCOCC3)c2)n1	789046253	SIJHTMJYORWDEL-UHFFFAOYSA-N	445.864	1.021	50	20	IDGD	
Cn1nc([C@@H]2CCCO2)cc1NC(=O)C(=O)NNC(=O)c1ccc(Cl)cc1Cl	789749514	QTGIUAFCFLFXHE-ZDUSSCGKSA-N	426.260	1.978	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(CC(=O)NNC(=O)c2cc(Br)c[nH]2)cc1	792854715	NAKNPGYFSULZHK-UHFFFAOYSA-N	429.296	1.031	50	20	IDGD	
CC(C)[C@@H](O)C(=O)NNC(=O)CCN1CCN(C(c2ccccc2)c2ccccc2)CC1	794764837	XSUXHNXLZRWROQ-XMMPIXPASA-N	438.572	1.948	50	20	IDGD	
Cc1nsc(NC2CC2)c1C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	796645410	QUWOPUPKFLBSOY-AWEZNQCLSA-N	432.458	1.170	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2cccc(N(C)C)c2)c(OC)c(C)c1OC	796990623	UIFJJBKHNBQHPB-UHFFFAOYSA-N	430.461	1.487	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2nnn(CCOc3ccc(F)cc3)c2C)cc1OC	799856324	ANJIKWIPRGGWMG-UHFFFAOYSA-N	443.435	1.897	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(CN3CCCC3)cc2)cc1OC	801869332	BEJLYMZBBCNZOZ-UHFFFAOYSA-N	441.484	1.918	50	20	IDGD	
CCc1nnc(NC(=O)[C@H](C)[C@@H](C)NC(=O)NNc2ccc(-n3ccnc3)nn2)s1	805881172	XNJOCIDSXATJFQ-GHMZBOCLSA-N	430.498	1.366	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN1C(=O)C(F)(F)F)c1cc(F)ccc1Br	806786956	ATYPZQGFAHDVIG-JTQLQIEISA-N	426.164	1.903	50	20	IDGD	
Cc1nn(Cc2ccccc2)c(C)c1CNC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	807134588	CTFYVXAQPDADCC-UHFFFAOYSA-N	445.487	1.668	50	20	IDGD	
CCN(C)C(=O)c1cccc(S(=O)(=O)NNC(=O)c2nnc(-c3ccccc3)o2)c1	808080834	IGMHGTVVRCYMRP-UHFFFAOYSA-N	429.458	1.452	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)COc2cc(F)cc(F)c2)cc1	809983656	MPUJUGAXDVNJJK-UHFFFAOYSA-N	427.429	1.120	50	20	IDGD	
COc1ccc(CNC(=O)NNC(=O)COc2ccc(Br)cc2)c(OC)n1	811972262	MPBDPMJTTIWWJL-UHFFFAOYSA-N	439.266	1.771	50	20	IDGD	
CCOC(=O)c1ccc(NNC(=O)c2ccc3c(c2)CCN3C(=O)CNC(C)=O)cc1C	812721017	UOFGAGFMAVOOQD-UHFFFAOYSA-N	438.484	1.954	50	20	IDGD	
O=C(COC(=O)c1nn(-c2ccccc2)c2c1CCC2)NNC(=O)c1cccc([N+](=O)[O-])c1	812846277	VAGFPDGKRKMHRU-UHFFFAOYSA-N	449.423	1.887	50	20	IDGD	
COC(=O)c1cn(-c2cccc(NC(=O)NNC(=O)[C@@H](C)Oc3ccc(F)cc3)c2)nn1	812979222	CKVOOXJTSDNIOD-GFCCVEGCSA-N	442.407	1.813	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)COc2cc(C)ccc2C)cc1)C1CC1	815565099	CMTARHFAZSEQSU-UHFFFAOYSA-N	438.484	1.984	50	20	IDGD	
COC(=O)c1cnn(C)c1NC(=O)C(=O)NNc1c(F)cc(F)cc1Br	815606380	VSEDRCHTPIFVLJ-UHFFFAOYSA-N	432.181	1.329	50	20	IDGD	
CC(=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O)c1sc2nc(C)nc(C)c2c1C	863968080	BLGCUKOAAUFVTN-UHFFFAOYSA-N	447.546	1.041	50	20	IDGD	
COc1ccc(Cl)cc1NS(=O)(=O)c1cccc(C(=O)N2CC[C@H](B(O)O)C2)c1	864234300	OYGXUGGJMHZYTG-ZDUSSCGKSA-N	438.698	1.838	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=S)Nc1cccc(S(=O)(=O)N(C)C)c1	913445836	WXZXPVQNCXDYGY-GFCCVEGCSA-N	440.522	1.861	50	20	IDGD	
COc1ccnc(NNC(=O)C2CCN(S(=O)(=O)c3ccc(C(C)=O)cc3)CC2)n1	914762950	FQEPCECTFRORKH-UHFFFAOYSA-N	433.490	1.232	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)Cn2cnc3ccc(Br)cc3c2=O)c1	915595437	JWYOXTSLNXQAKG-UHFFFAOYSA-N	444.289	1.686	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)NC[C@H]1CN(Cc2ccccc2)CCO1	915894802	PWFKBCJMCVQMMN-AEFFLSMTSA-N	430.480	1.824	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)NC[C@@H]1CN(Cc2ccccc2)CCO1	915894805	PWFKBCJMCVQMMN-FUHWJXTLSA-N	430.480	1.824	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCc2ccccc2OC)c1	915904334	UZOKFIGZVOPZCH-UHFFFAOYSA-N	448.545	1.912	50	20	IDGD	
CNS(=O)(=O)Cc1ccc(CNC(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)cc1	916229144	RTOHOTWNWIMBQP-CYBMUJFWSA-N	438.481	1.173	50	20	IDGD	
CCNC(=O)COc1ccc(C=NNC(=O)[C@H](C)CN2C[C@H](C)O[C@@H](C)C2)cc1OC	916365859	LYRPASFLNXAPTK-IKGGRYGDSA-N	434.537	1.406	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)c3cc(C)[nH]n3)c2)cc1	917391577	AGYKZTJHZCCFHH-UHFFFAOYSA-N	429.458	1.602	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2ccc(CCNC(C)=O)cc2)ccc1OC(C)C	917727312	DKMUGZQJNACVTB-UHFFFAOYSA-N	449.529	1.784	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNS(=O)(=O)c2cccc(C(=O)NC3CC3)c2)cc1C	917728689	GUWZVSRXZIZXAJ-UHFFFAOYSA-N	430.486	1.144	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NC[C@@H](c2ccc(OC)cc2)N2CCOCC2)cc1	1317898981	JFQZXQBXWJSUKU-FQEVSTJZSA-N	428.489	1.721	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnc4ncccn34)C2)C1	1777930972	BHZAKHYCQWPETG-ZWKOTPCHSA-N	426.304	1.409	50	20	IDGD	
CC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C1	1778091176	KBUDXGSYRILXPX-UPRBLEQPSA-N	445.520	1.004	50	20	IDGD	
O=C(c1cnc2[nH]ncc2c1)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1778416547	OBGBQSRFWLCYKZ-BLLLJJGKSA-N	426.246	1.092	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(CCN(C(=O)c3cn4cc(F)ccc4n3)C2)C1	1778541252	KYZBIYALHBFBEI-HXUWFJFHSA-N	434.544	1.768	50	20	IDGD	
Cn1nc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)C(Cl)Cl)C3)c2c1CCC2	1778675292	ZKALWFYBHIHYJI-AUUYWEPGSA-N	429.348	1.840	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc([N+](=O)[O-])[nH]3)C2)C1	1780414864	VBCABVXYCIGGOK-BDJLRTHQSA-N	429.271	1.397	50	20	IDGD	
CC[C@H](NC(C)=O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@](C)(Cl)CCl)C1	1780706229	UEELFENGFWUFMF-OSGQAZFXSA-N	436.380	1.651	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(O)cn1)C2)[C@@H](F)Br	1780771101	CNLTUTRTPDSMKU-CKEIUWERSA-N	430.274	1.605	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](F)Br)C3)C2)cc1	1781333971	IXSTWWBRKGBZSP-YJBOKZPZSA-N	442.285	1.779	50	20	IDGD	
CCCNC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)Br)C1	1781997526	ZTKMBXVXKMWTKK-QMTMVMCOSA-N	446.386	1.590	50	20	IDGD	
CCc1cc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](C)Br)C2)nn1C	1781998398	ZVDMKSFDMUUBDQ-URKNILKWSA-N	441.370	1.893	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Cl)C2	1782160682	QMEIZWMXXITDJU-BBNZOYGDSA-N	430.904	1.790	50	20	IDGD	
Cc1cc(C)cc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CCC(=O)NN(C)C)C2)c1	1782212325	SJOBXHDKVIFEHE-HYBUGGRVSA-N	444.576	1.804	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)C(Cl)Cl)C2)n1	1782216522	WYCHIMQIAKTLST-AUUYWEPGSA-N	443.331	1.971	50	20	IDGD	
Cc1nc2ncccn2c1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C(Cl)Cl)C1	1782217676	XCOYMUCSRXYMBI-BFUOFWGJSA-N	440.331	1.969	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3nc4ccccn4n3)CCO2)C1	1783344162	ZLISHYCMBVQWFA-UGSOOPFHSA-N	436.310	1.346	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](C)n1ccnc1C)CCO2	1783352917	JJYYXZIMEXESRO-XUWXXGDYSA-N	427.343	1.756	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(-n4cnnc4)cc3)CCO2)C1	1783533383	UASPLNSKGGWYLO-IFXJQAMLSA-N	448.321	1.494	50	20	IDGD	
Cc1cccn2ncc(C(=O)N3CCO[C@@]4(CCN(C(=O)[C@@H](C)Br)C4)C3)c12	1783536212	IBAJDLDDJZZODS-AUUYWEPGSA-N	435.322	1.870	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cc4ncsc4[nH]3)CCO2)C1	1783538643	VHHOTYITSSCPJI-HWPZZCPQSA-N	427.324	1.851	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3(C)CCCC3)[C@H]2C1	1783637213	PQROINPUMRDPJL-BODMQJBDSA-N	443.548	1.680	50	20	IDGD	
COC(=O)c1ccc(CC(=O)N2CCO[C@@]3(CCN(C(=O)C(Cl)Cl)C3)C2)s1	1783948273	HKBDMMDEITUTGD-KRWDZBQOSA-N	435.329	1.711	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]3C2)c2cc(O)ccc2n1	1784092123	HINXWKDEEGIHOR-SIXJUCDHSA-N	447.919	1.442	50	20	IDGD	
O=C(Cn1nnc2ccccc21)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21	1784900839	UYDQXECEZFFRRH-HUBLWGQQSA-N	426.304	1.215	50	20	IDGD	
COc1cc(F)ccc1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1784917198	MWZNWCIKMZPTAM-WMLDXEAASA-N	433.249	1.968	50	20	IDGD	
CC(C)c1nc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]32)no1	1785211545	ZKXOGCQMKHMAHS-MNUAXYBXSA-N	447.363	1.952	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)c1cccc2[nH]ncc12	1787309477	IFVGTYLEUKFNDH-NZBMOFRJSA-N	439.285	1.847	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnn4ncccc34)[C@H]2C1	1787378897	XEHJGVJPQCXXJP-BCRCDCHUSA-N	440.331	1.559	50	20	IDGD	
CC(C)(C)OC(=O)NCC1(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]3C2)CC1	1787444649	DZPOEUNFNOXXFK-AJNGGQMLSA-N	447.935	1.805	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)c1ccncc1C(F)(F)F	1787659719	LXCPUTZZIDYSFU-LVGORTOPSA-N	435.830	1.293	50	20	IDGD	
C[C@@](O)(C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]2C1)C(F)(F)F	1788764920	CTYRVLLGZVLGJS-WFGGJUAMSA-N	426.508	1.131	50	20	IDGD	
COc1ccccc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21	1789464536	UOGJYJQGUFHXER-DLKVLKDVSA-N	429.286	1.979	50	20	IDGD	
O=C(NC1(c2ccc(NC(=O)c3ncccc3F)cc2)CCC1)c1cccc(B(O)O)c1	1789909296	ZFXZGCQAQGJIPI-UHFFFAOYSA-N	433.248	1.962	50	20	IDGD	
CCc1ncsc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]2C1	1789924568	MJOUNBNGZPALIS-JYYRZZBQSA-N	434.331	1.989	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(O)ccc3O)[C@H]2C1	1790265002	GEASZLIAWNJPIJ-SIUGBPQLSA-N	441.322	1.865	50	20	IDGD	
Cn1nc2c(c1C(=O)NC[C@@H]1OC[C@@H]3CCN(C(=O)[C@@H](F)Br)C[C@@H]31)CCC2	1790463043	ZUSDBLRMMMRRBF-YLUJIRGKSA-N	443.317	1.193	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3(F)CC3)[C@H]2C1	1790714002	KIEDJMKZQHWDTN-AJNGGQMLSA-N	447.935	1.600	50	20	IDGD	
C[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]2C1)N1CSCSC1	1791298132	CYBBVXHBOGFJGX-CYDGBPFRSA-N	442.434	1.813	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1[C@@H]3CCC[C@H]1c1ccccc1N3)C2)[C@H](O)CCl	1792976313	CCVIDQFGBAZKHV-LNDBJABFSA-N	447.963	1.554	50	20	IDGD	
Cc1ncccc1CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2	1793918760	JBBSIKWXCTVZPP-FSDCSDTHSA-N	428.302	1.603	50	20	IDGD	
Cc1nc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)CBr)C3)cs1	1794079904	MEXKBZPNDPOMHU-YGSHXTJESA-N	430.368	1.615	50	20	IDGD	
Cc1ccncc1CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)CBr)C2	1794100297	VCNRFDLSQIWTEI-RMRDIRSESA-N	438.366	1.943	50	20	IDGD	
C=CCCc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CO[Si](C)(C)C)C3)c(O)n1	1794490662	GWGJNEAFFOHDRF-CWPLJXCYSA-N	447.608	1.961	50	20	IDGD	
COc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCBr)c(C)c1	1795114877	HQSQNPCHAWZUGO-ZSBFGKGUSA-N	425.323	1.992	50	20	IDGD	
COc1cccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCBr)c1C	1795116397	FYGBMAHDYDPCCD-CWPLJXCYSA-N	439.350	1.921	50	20	IDGD	
CCC[C@H]1CC[C@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cccc(B(O)O)c2)CC1	1795741224	NSJRORNGTMGISX-IIHZSMLWSA-N	442.365	1.176	50	20	IDGD	
CSc1cccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)c1O	1796188483	MQNRECLCAMKFKU-BJWYYQGGSA-N	440.330	1.360	50	20	IDGD	
CC(C)c1ccc(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)cc1	1796190370	RXZBVNWAWTYACX-NUNAXRQHSA-N	434.345	1.984	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2cnccc2nc1C	1797362761	XUHDIKVHQPNFGO-HIRMHNASSA-N	432.908	1.395	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CS[C@@H]1CCCCO1	1797794134	XJHGEXSHZKJOTR-WTLGNFPFSA-N	430.643	1.687	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1(C#N)CC1)C2	1798522343	PVQRWTVKLKJPOP-ZSBFGKGUSA-N	442.428	1.027	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccn3nccc13)C2	1799279861	VJXNMBJNNNJEOX-UESRRSCYSA-N	425.316	1.774	50	20	IDGD	
COc1ccc(C)c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Br)c1	1799348663	LRUICOWEGMFVCM-NOXHYTERSA-N	429.286	1.897	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccc([N+](=O)[O-])cc1F	1800403270	VERQTIMPSRWNEC-HRJSJKBJSA-N	443.859	1.120	50	20	IDGD	
Cc1c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)Br)nc2ccccn12	1800757213	JTJZBORJZXUSHI-DPYKFYPSSA-N	435.322	1.629	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnnc3ccccc13)C2	1800757701	OTAZYUJAROHWGS-KOFHJDLBSA-N	433.306	1.616	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cn1cnc2ccccc21	1800888881	HPHSWDYREMTYAS-YGTYGHESSA-N	449.349	1.799	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(Cl)nc3n[nH]cc13)C2	1800975024	IHFRQWABFVBVQK-YJKIEOBBSA-N	442.303	1.068	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CCc2nc[nH]c2C1	1801270784	SGKDLZSENGYFTJ-REVBEMBVSA-N	439.354	1.278	50	20	IDGD	
C=C[C@@H]1C[C@]1(NC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2	1802139646	JYVZCCILZAFOKH-RNCJLBHCSA-N	445.919	1.580	50	20	IDGD	
Cc1ccc(C(=O)C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)cc1	1802153656	PNGVBIFDXBJLEN-BJWYYQGGSA-N	435.484	1.128	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H]1C[C@@H]1c1ccc(F)cc1)C2	1802334857	QPXXGELPQVMMDO-IVDHNXQLSA-N	430.524	1.940	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@@H](O)CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C(Cl)Cl	1802346616	QOQSHKIPZXFCJH-RNJOBUHISA-N	438.352	1.704	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2sccc2F)[C@@H]1c1cccnc1	1803858784	XPFQUXHCFLCSNH-KXBFYZLASA-N	447.536	1.975	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC2(CCCN(C(=O)c3ccc(Cl)nc3)C2)CC1	1804663643	VZIVFZGLRGUUJD-UHFFFAOYSA-N	441.724	1.573	50	20	IDGD	
Cn1nc(C(=O)NC[C@H]2CCN(C(=O)CCBr)[C@H]2c2cccnc2)cc1O	1804895000	RMAQVFZAAGEIRC-DYVFJYSZSA-N	436.310	1.625	50	20	IDGD	
C[C@@H](CNC(=O)OC(C)(C)C)C(=O)N1CCCC2(CCN(C(=O)[C@@H](O)CCl)CC2)C1	1805528982	DJXLLROWKICBNJ-HOTGVXAUSA-N	445.988	1.978	50	20	IDGD	
CC[C@H](NC(C)=O)C(=O)N1CC[C@@H](CNC(=O)CCBr)[C@@H]1c1cccnc1	1806337425	HUVITGLUMAZQNB-BQFCYCMXSA-N	439.354	1.787	50	20	IDGD	
CC(C)[C@H](S)C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1807365341	NZSWICPULXZMHU-IHPCNDPISA-N	441.362	1.035	50	20	IDGD	
C[C@H](NC(=O)c1cnccn1)C(=O)N1CC[C@H](CNC(=O)[C@@H](F)Cl)[C@H]1c1cccnc1	1808313220	BRVROWUTEOCUFE-LBRJOISOSA-N	448.886	1.230	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)Cn2ccnn2)[C@@H]1c1cccnc1)[C@@H](F)Br	1808663224	YRWIHCYOYXYZRS-NWANDNLSSA-N	425.262	1.070	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)c2c[nH]c(=O)cn2)[C@@H]1c1cccnc1	1812777229	NVLQQOKZALPLEP-JKIFEVAISA-N	448.321	1.658	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2cc3cn[nH]c3cn2)[C@H]1c1cccnc1	1813031382	MBEVCHKJVPGCAC-ALKREAHSSA-N	442.907	1.926	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)cn1	1813069793	BWOZHIAHYPODNA-XMSQKQJNSA-N	438.532	1.478	50	20	IDGD	
CS(=O)(=O)CCC(=O)NC[C@@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1	1813574014	KGHSSCOZZSATPN-YOEHRIQHSA-N	446.367	1.307	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCN2C(=O)C=CC2=O)n[nH]1	1815472394	YRRPNSNBXCDMLG-OAHLLOKOSA-N	447.568	1.568	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc3n(n2)CCNC3=O)n[nH]1	1816622940	VAIYHJQNXNAKTH-AWEZNQCLSA-N	447.927	1.921	50	20	IDGD	
O=C(CC1CCOCC1)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1817164414	LIWKAKQWGFVVOJ-IBGZPJMESA-N	440.309	1.212	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@H](O)CCl)CC2)c1cn2ccsc2n1	1819214864	WOHZYSYEGODAIP-LDYMZIIASA-N	425.923	1.678	50	20	IDGD	
Cc1cc(C(=O)NCC(=O)Nc2cc([C@@H]3CCCCN3C(=O)C(Cl)Cl)[nH]n2)no1	1819468566	NSWUEAOELSGFTI-LBPRGKRZSA-N	443.291	1.932	50	20	IDGD	
CC(C)CNC(=O)C(=O)N[C@H]1CCc2nc(NC(=O)CO[Si](C)(C)C)sc2C1	1820164680	CIQACIYQYVXCFQ-LBPRGKRZSA-N	426.615	1.679	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)N[C@H]1CCc2nc(NC(=O)CO[Si](C)(C)C)sc2C1	1820166036	YZABROSOYRJBBY-NEPJUHHUSA-N	441.630	1.614	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)COc2ccc(O)nn2)n[nH]1	1821667476	AEZOEOHHZYQVEE-WCQYABFASA-N	438.872	1.230	50	20	IDGD	
CNc1nsnc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](Cl)COC)n[nH]1	1822366897	MXLPZDFJVCNJAL-MWLCHTKSSA-N	427.918	1.863	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](C)S)n[nH]1	1822382159	ZMURHFZKWWHSSZ-AHSDNHKASA-N	431.522	1.854	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H]2C[C@H]3CC[C@@H]2O3)[nH]n1	1822416675	KIBJPEQVIZTPJI-SRABZTEZSA-N	432.525	1.342	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)CCN2CCCC2)[nH]n1	1822417791	OPBGLFFREVSUIJ-QGZVFWFLSA-N	433.557	1.261	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccoc2)CC1	1825052136	MVBZNZMOLBWZOF-DORXLWPQSA-N	436.317	1.906	50	20	IDGD	
O=C([C@H](O)CCl)N1CCC([C@H]2CCCCN2C(=O)Cn2cc([N+](=O)[O-])cn2)CC1	1825125824	XVQNGZVWEVYMDX-HZPDHXFCSA-N	427.889	1.011	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](C)CC(N)=O)CC2	1825441374	UMIPUFHUNHTTKQ-AEJSXWLSSA-N	431.356	1.740	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)Cc1cccc(OC)n1)CC2	1825993617	LXMDZOFBDINBEV-QWHCGFSZSA-N	438.937	1.955	50	20	IDGD	
CCc1ncccc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827050046	FRXXFKIIGJZEPN-HSZRJFAPSA-N	449.360	1.871	50	20	IDGD	
Cc1cc[nH]c1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1	1828925048	CLETWOWJNLQKLO-IBGZPJMESA-N	438.532	1.869	50	20	IDGD	
CCOc1ncccc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830352189	GZOGGTNNRYIACM-OAQYLSRUSA-N	439.940	1.815	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ncc(Cl)cn3)C2)C1	1830357597	AWHVBQUQUDFASA-SFHVURJKSA-N	431.320	1.465	50	20	IDGD	
C[C@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H](F)Br)CC1)n1cnnn1	1830381042	DZEIOTBDJODGGQ-XBFCOCLRSA-N	431.310	1.544	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](CC)N(CC)CC)C2)C1	1831640119	IYVNYYFXLKOEMN-WFXMLNOXSA-N	432.005	1.971	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)COc3ccccc3C#N)C2)C1	1831658748	HNUZOFOEEUYXBM-PGRDOPGGSA-N	449.935	1.801	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2C[C@H]3CC[C@@H]2O3)CC1	1831680466	KBKIAZZUYHRTBH-CZYKHXBRSA-N	440.349	1.167	50	20	IDGD	
Cc1c(C(=O)N2CCC([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)cnn1C	1831871358	BCABURVHJWFVPJ-IBGZPJMESA-N	432.569	1.335	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccnc(F)c3)CCO2)C1	1831894959	HNBILDFVVVQREY-UGSOOPFHSA-N	444.301	1.322	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)C3(C(F)(F)F)CC3)CC2)CC1)[C@@H](O)CCl	1833310727	ZCPUBIOKAALXRA-AWEZNQCLSA-N	425.879	1.500	50	20	IDGD	
COc1cc(C(=O)N2CCC(N3CCC(NC(=O)[C@@H](O)CCl)CC3)CC2)ccc1O	1833313726	PKODFCFICVZVHY-SFHVURJKSA-N	439.940	1.186	50	20	IDGD	
C[C@H](C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)CCl)CC2)CC1)c1ccc(O)cc1	1833313811	ROPVINDOTMJHRK-MGPUTAFESA-N	437.968	1.667	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)NC(=O)NCC)CC2)CC1	1833534036	YGOOCAOGXPHVFK-QAPCUYQASA-N	444.020	1.673	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccn(C(C)(C)C)n3)CCO2)C1	1833588751	NYQJVIHZHUPTHF-FOIQADDNSA-N	426.945	1.726	50	20	IDGD	
COCc1oncc1C(=O)NC1CCN(C2CCN(C(=O)[C@@H](Cl)COC)CC2)CC1	1835236835	UBAJMWOETAZPKA-KRWDZBQOSA-N	442.944	1.260	50	20	IDGD	
CN(C)c1cccc(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)c1	1836269515	JUAZHTLQWZAPPB-FQEVSTJZSA-N	436.984	1.538	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)c3cc4n(n3)CCCO4)CC2)CC1	1836396659	FZJBBMHMSTUAHA-QGZVFWFLSA-N	437.972	1.868	50	20	IDGD	
O=C(c1n[nH]c2ccc(F)cc12)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1837041236	ADZWVTIGHDSPIS-CRAIPNDOSA-N	428.823	1.306	50	20	IDGD	
Cc1ccc(C(=O)C(=O)N2CCOC[C@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)cc1	1837715890	QHOOPJMAWOWZFJ-QFIPXVFZSA-N	448.592	1.486	50	20	IDGD	
C[C@@H](C(=O)N1CCOC[C@@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1)c1ccccn1	1837717953	SQFPMMXNTKHDEC-DYESRHJHSA-N	435.597	1.493	50	20	IDGD	
O=C(c1cc(-c2ccccn2)[nH]n1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1838050631	VAFGZFDWSSAWFA-QFBILLFUSA-N	437.859	1.076	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)c(C)o1	1839197569	BFQRLAVQRNJVOD-RHSMWYFYSA-N	433.274	1.657	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)Oc1ccccc1)CCO2	1839952276	XIGSHMMXYYPVKI-MDKPJZGXSA-N	440.924	1.164	50	20	IDGD	
Cc1nc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)cs1	1840031090	FLXMJJKRXQHYOT-BZNIZROVSA-N	432.340	1.305	50	20	IDGD	
CC[C@H]1CC[C@H](C(=O)N2CCOC[C@]3(CN(C(=O)[C@H](Cl)COC)CCO3)C2)CC1	1840156502	TZUGTTBCXOSHAQ-NEYJZJCJSA-N	430.973	1.913	50	20	IDGD	
O=C(c1cccc2c1OCCO2)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840188512	NUSKNBFIUQVZCO-LJQANCHMSA-N	445.299	1.332	50	20	IDGD	
N#Cc1ccc(F)c(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)c1	1840189205	CPMZMSMYDPTZHV-GOSISDBHSA-N	430.263	1.571	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CC[C@H](O)CC1)CCO2	1840268941	GWKWGZUMURFQSP-FPXQBCRKSA-N	447.370	1.025	50	20	IDGD	
CCC[C@H](NC(C)=O)C(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1840851899	WMBQDUWZTMOAES-OXJNMPFZSA-N	431.961	1.013	50	20	IDGD	
CC(C)(C)Oc1ccc(C(=O)N2CC3(CCCN3C(=O)c3ccc(B(O)O)cc3)C2)cc1	1843012007	UPMLJVYZJWFIQO-UHFFFAOYSA-N	436.317	1.675	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC2(CCCN2C(=O)c2ccc(N3C(=O)C=CC3=O)cc2)C1	1846891774	WXXVAPRBEWLYIW-UHFFFAOYSA-N	441.560	1.785	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)C(C)(C)CCl)n(-c2cccc(=O)n2C)n1	1847435702	OUZUJMQGZQYXGR-HOTGVXAUSA-N	445.951	1.960	50	20	IDGD	
O=C(/C=C/C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CCBr)NCc1ccccc1	1847541921	ZYAILYNSPTUMBJ-SGUAIBKKSA-N	434.334	1.846	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H]1CC(=O)CN1C(=O)OC(C)(C)C	1847644374	DIJIHQHQLBYVOR-UGUYLWEFSA-N	443.928	1.021	50	20	IDGD	
COc1ccc([C@@H]2C[C@@H]2C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2cnccc2C(=O)NN)cc1	1847780125	LWRIHEKHGJMOAP-QIJZPMMNSA-N	449.511	1.313	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)c1ccc(N2CCOCC2)nc1	14322605	QQJDTEKPBXTFND-UHFFFAOYSA-N	435.278	1.521	50	20	IDGD	
COc1ccc(C(=O)C2CCN(CC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)CC2)cc1	14325531	ZAMMEQKAZNYAHF-UHFFFAOYSA-N	440.456	1.959	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)Nc3ccccc3Cl)c2)cn1	17397321	PHGCITRNURTPAG-UHFFFAOYSA-N	433.877	1.949	50	20	IDGD	
CCOc1ccc(CC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc1	17455889	MGBYFKTWSSHLIN-UHFFFAOYSA-N	431.514	1.874	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)c1ccc(OCC(N)=O)cc1	24312757	OUAAYEYUUCPEQS-NSHDSACASA-N	436.262	1.542	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)c1ccc2c(c1)S(=O)(=O)N(C(C)C)C2=O	108104935	WKKNNBGBOWCYRG-UHFFFAOYSA-N	446.485	1.121	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)c1cccc([N+](=O)[O-])c1	301509011	RJFAISXZGZPMJO-UHFFFAOYSA-N	431.880	1.827	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)[C@H](C)N2C(=O)NC3(CCCC3)C2=O)cc1	726498718	ZBOAWJSVPHQOHS-KBPBESRZSA-N	432.477	1.253	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCCc1cccc(C(N)=O)c1	726609848	GZXRMUJHQVNMDL-GFCCVEGCSA-N	449.305	1.888	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)C)c2ccccc2c1=O	727114713	YLQWKRWTJWRYQC-HNNXBMFYSA-N	431.493	1.727	50	20	IDGD	
CC(C)[C@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)c1csc(N2CCOCC2)n1	727115688	NSSQRXBOBBXFJW-ZDUSSCGKSA-N	427.527	1.290	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)COc1ccc(F)cc1)c1cccc(S(=O)(=O)N(C)C)c1	727611226	XMEATCKHAPSJAX-CYBMUJFWSA-N	438.481	1.546	50	20	IDGD	
O=C(NNC(=S)NCC1CCC1)C1CCN(S(=O)(=O)/C=C/c2ccccc2)CC1	727866040	LMXPJKFLOGJBRH-SDNWHVSQSA-N	436.603	1.995	50	20	IDGD	
Cc1noc(C)c1S(=O)(=O)N1CCC[C@@H](C(=O)NNc2nc(-c3ccccc3)no2)C1	728081345	SFBLQLWHRZFCFU-OAHLLOKOSA-N	446.489	1.885	50	20	IDGD	
COc1ccc(Cl)cc1N1C[C@@H](C(=O)N([C@H]2CCS(=O)(=O)C2)N(C)C)CC1=O	728178138	CDESOZOUDXMZCZ-JSGCOSHPSA-N	429.926	1.194	50	20	IDGD	
O=C(NNC(=S)NCCCN1CCOCC1)c1ccc(Br)cc1Cl	728793868	OHCSYKRHRQGLIP-UHFFFAOYSA-N	435.775	1.934	50	20	IDGD	
C[C@@H](CCC(=O)NNC(=O)c1cccc(C#N)c1)CC(=O)NNC(=O)c1cccc(C#N)c1	728826459	JCQDIWPTNUDCOP-HNNXBMFYSA-N	446.467	1.459	50	20	IDGD	
Cc1nc(SCC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c(C#N)c(C)c1C	728848106	VHWNYIGZVGOZMD-UHFFFAOYSA-N	439.545	1.825	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NCC2(N3CCC(OC)CC3)CCCC2)cc1	730915093	WZMQNIUNYJHXEQ-UHFFFAOYSA-N	434.537	1.828	50	20	IDGD	
CCS(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)c1	732532592	PVERSATXGSSQCH-UHFFFAOYSA-N	440.449	1.720	50	20	IDGD	
Cc1nn(CCCl)c(C)c1C(=O)NCCNS(=O)(=O)c1cccc([N+](=O)[O-])c1	733925834	UDILBMFFBBLKLS-UHFFFAOYSA-N	429.886	1.355	50	20	IDGD	
O=C(NNc1cnccn1)[C@H]1CCCN(S(=O)(=O)c2ccc(Br)s2)C1	734242412	DSQMKGCCCHWZCS-JTQLQIEISA-N	446.352	1.845	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc(OC(F)(F)F)cc1)NNc1nccnc1Cl	734260900	ZFABXMTZRSYTJZ-UHFFFAOYSA-N	439.803	1.840	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)NC2CCN(C[C@@H]3CCCO3)CC2)cc1	734280077	DINAMSSOTUMSHN-UZLBHIALSA-N	434.537	1.826	50	20	IDGD	
CN(C)[C@@H](CNC(=O)NNC(=O)CNC(=O)c1cccs1)c1c(F)cccc1F	734676428	WIIQNMLNYZTSQV-ZDUSSCGKSA-N	425.461	1.389	50	20	IDGD	
Cc1cc(NNC(=O)[C@@H]2CCCN(S(=O)(=O)c3ccc([N+](=O)[O-])cc3)C2)nc(C)n1	736710838	WVJQOVBZFLEKNM-CQSZACIVSA-N	434.478	1.546	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2ccc(N3CC=CC3)cc2)c1	741090149	CWBYKPVUHWCBOV-UHFFFAOYSA-N	443.529	1.457	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)COCc1ccccc1)[C@H]1CN(Cc2ccccc2)CCO1	741276924	BZGHQYYHPMLVMU-WIYYLYMNSA-N	426.517	1.823	50	20	IDGD	
Cc1cc(Br)ccc1C(=O)N1CCC[C@@H](C(=O)NNc2nnc(C)c(O)n2)C1	743295230	IFVYBKFFGVMYOI-GFCCVEGCSA-N	449.309	1.952	50	20	IDGD	
CC1(C)C(=NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)[C@@H]2CCCO[C@H]21	743423828	XTISLISJEZOZBW-GHTZIAJQSA-N	449.573	1.947	50	20	IDGD	
CS(=O)(=O)c1ccc(OCCCC(=O)NNC(=O)Cn2cnc3ccccc32)cc1	743737899	IFAWHVSGWLEQDK-UHFFFAOYSA-N	430.486	1.446	50	20	IDGD	
CCO[C@H](C)c1nc(CN2CCN(CC(=O)NNC(=O)c3ccccc3)CC2)cs1	744411605	QBBUJVWTFYZMNB-MRXNPFEDSA-N	431.562	1.819	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)C[C@@H]2CN(Cc3ccccc3)CCO2)c1	745100357	BARGHORPDCEDCL-HXUWFJFHSA-N	436.468	1.154	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCc2ccccc2[N+](=O)[O-])c1	745881997	STUSNGZKHAEIMH-UHFFFAOYSA-N	435.462	1.032	50	20	IDGD	
COc1cc(C)c(Br)cc1S(=O)(=O)NNC(=O)COc1ccccc1O	747271413	YTMJVGZGKOCGOC-UHFFFAOYSA-N	445.291	1.860	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Cc2cccc(OC(F)(F)F)c2)c1	747719634	WAVZGHIXIXRFBQ-UHFFFAOYSA-N	445.419	1.839	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2ccc(C(=O)NNC(=O)C(=O)N3CCCC3)cc2)cc1C	748246385	JLZJLDRVLADUOG-UHFFFAOYSA-N	444.513	1.488	50	20	IDGD	
C[C@H]1NC(C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)=NN(c2ccccc2)C1=O	748611158	GGHXERFEYLUFSX-LLVKDONJSA-N	437.428	1.464	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)NCCC(=O)Nc1ccc(Br)cc1C	748627115	GTTFFMCRUUFRQT-GFCCVEGCSA-N	445.314	1.468	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)NCc2ccccc2CN2CCC(O)CC2)c1	749593141	ZNEMXWFQXGDGRA-UHFFFAOYSA-N	426.517	1.861	50	20	IDGD	
CC(C)C[C@H](CNC(=O)OC(C)(C)C)NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	751812609	GCTYDSCZLXHPIM-OAHLLOKOSA-N	446.512	1.546	50	20	IDGD	
CN(C)c1ccc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)c(F)c1	752127720	QUWKFUZOLPLTQR-UHFFFAOYSA-N	427.480	1.111	50	20	IDGD	
O=C(NCCNS(=O)(=O)c1ccc(Cl)s1)NNC(=O)c1cc2c(s1)CCC2	752689820	YSSHPDDBTXHQDD-UHFFFAOYSA-N	448.979	1.874	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)NC[C@@H]3CCC[C@]34NC(=O)N(C)C4=O)n[nH]2)cc1	753021978	KYERSBJZTOQPKF-QKKBWIMNSA-N	439.476	1.050	50	20	IDGD	
CCN(CC)S(=O)(=O)CC(=O)NNC(=O)c1cc2c(C)nn(-c3ccccc3)c2s1	753375845	ALBHMZNIWUJAJS-UHFFFAOYSA-N	449.558	1.828	50	20	IDGD	
CCS(=O)(=O)N1CCC(CNC(=O)NNC(=O)c2cc3c(s2)CC[C@H](C)C3)CC1	754135958	SCVHSTKKZKGCRY-ZDUSSCGKSA-N	442.607	1.879	50	20	IDGD	
C[C@@H](CS(=O)(=O)c1ccc(F)cc1)C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C	755377866	WTBAHISSDVMITM-LBPRGKRZSA-N	446.501	1.091	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)Nc1ccc(S(=O)(=O)NC(C)C)cc1	755517447	PATJVRSRURNKMZ-UHFFFAOYSA-N	430.490	1.796	50	20	IDGD	
C[C@@]1(CNC(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)CCCO1	756077606	GOJMBQHIXXHZMF-QFIPXVFZSA-N	435.488	1.902	50	20	IDGD	
COc1ccc(C(=O)N2CCOCC2)cc1NC(=O)NNC(=O)c1ccc(O)c(Cl)c1	756257951	OQRHYISQYSGSDR-UHFFFAOYSA-N	448.863	1.993	50	20	IDGD	
COC(=O)c1n[nH]c2ccc(NC(=O)NNC(=O)c3cc(OC)c(OC)c(OC)c3)cc12	756573066	LNIYDTYTTPWNAF-UHFFFAOYSA-N	443.416	1.842	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)NNC(=O)Cc1ccccc1F	756674252	NVNRWIJQMJVIII-UHFFFAOYSA-N	438.481	1.870	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)Nc2ccc(C)c(S(=O)(=O)NC3CC3)c2C)c1O	756710781	DSLXGEKVKFTZOU-UHFFFAOYSA-N	448.501	1.925	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)Nc1ccc(S(=O)(=O)NC2CC2)cc1	756775861	MFNRFXYQLBMEPF-UHFFFAOYSA-N	428.474	1.550	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)CC12C[C@H]3C[C@@H](CC(Br)(C3)C1)C2	758044926	NDUSVONCNBKCDL-YPSBDKLCSA-N	436.372	1.196	50	20	IDGD	
COc1cc(F)c(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1F	758158548	JCLHNCPTBFOBSE-UHFFFAOYSA-N	428.417	1.690	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)[C@@H]1COc2ccc(Br)cc21	760437055	AOUPXNAXFUOJJO-GFCCVEGCSA-N	428.283	1.987	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)c2ccc(=O)n(-c3cnn(C)c3)c2)cc1C	760840640	KUWDLKLZUHHXID-UHFFFAOYSA-N	443.485	1.121	50	20	IDGD	
O=C(COC(=O)COc1ccc2ccc(=O)oc2c1)NNC(=O)c1cccc(Cl)c1	761841169	CPALDUPBXWACFV-UHFFFAOYSA-N	430.800	1.830	50	20	IDGD	
Cc1csc([C@@](O)(CC(=O)NNc2nccc(N3CCOCC3)n2)C(F)(F)F)n1	762855997	KXSKCVSLBWCFCU-HNNXBMFYSA-N	432.428	1.361	50	20	IDGD	
O=C(NNC(=O)C(F)(F)C1(O)CCC1)c1cccc(S(=O)(=O)N2CCCCC2)c1	763385378	BWYRDLREDHALNY-UHFFFAOYSA-N	431.461	1.173	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2)cc1S(=O)(=O)NC(C)(C)C	763420656	VHJBTTOTQXULCO-UHFFFAOYSA-N	432.502	1.472	50	20	IDGD	
C[C@H](c1ccc(NC(=O)C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1)N1CCOCC1	763441423	DFERUMWKMZTBHD-CQSZACIVSA-N	441.444	1.388	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)Nc1cccc(N2CCCCC2=O)c1	763574499	ZYGHLXJVFOSLSG-SFHVURJKSA-N	438.440	1.129	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(Cn3cccnc3=O)c2)cc1C	763666233	DKVGDQCQZVYNIK-UHFFFAOYSA-N	449.467	1.073	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(Br)cc2F)cc1	763675372	VLJPCHHLZJEUEO-UHFFFAOYSA-N	435.209	1.625	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2cc(Cl)c(OC)cc2OC)c1	763771973	JINFHIGPPSLWSH-UHFFFAOYSA-N	437.836	1.774	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2cccc(CCN3CCCC3)c2)c1	763774920	KDAPJFLBRXLYRX-UHFFFAOYSA-N	440.500	1.742	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2ccc(Br)nc2C)c1	763775137	LNKYIFDHBIIHKQ-UHFFFAOYSA-N	437.250	1.569	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccnc(Sc2ccccn2)c1	763812128	CXOCWXQMEQEZCQ-UHFFFAOYSA-N	448.464	1.664	50	20	IDGD	
CCOC(=O)/C=C/c1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)cc1	763855654	AASKWGNCHWWPIO-UELRPHRMSA-N	443.431	1.955	50	20	IDGD	
Cc1cc(N2CCOCC2)ccc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccc(F)cc1	763865526	LEWXWYMBVNUXAD-HNNXBMFYSA-N	444.463	1.524	50	20	IDGD	
COC(=O)c1cc(Cl)ccc1NC(=O)C(=O)NNC(=O)Cc1c[nH]c2ccccc12	763865768	VSMLNUNKILCTMA-UHFFFAOYSA-N	428.832	1.937	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)Cn2nc(C)cc2C)sc(C)c1CC	763893402	URKZQBPJTXGNST-UHFFFAOYSA-N	435.506	1.395	50	20	IDGD	
COC(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)CCSc2ccc(F)cc2)c1	763894578	CYUQSTXLAUASBD-UHFFFAOYSA-N	433.461	1.810	50	20	IDGD	
C[C@@H]1CCCCN1CC(=O)Nc1ccc(F)c(NC(=O)C(=O)NNC(=O)c2ccc[nH]2)c1	763981133	VHTDAGIXXSCQJY-CYBMUJFWSA-N	444.467	1.366	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1ccccc1OCC(F)(F)F	764006292	OCWRVSOZHKXPNF-UHFFFAOYSA-N	439.346	1.799	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1O)C(=O)Nc1ccc(N2CCSCC2)cc1	764117753	QYQFOTULMYWXLB-UHFFFAOYSA-N	434.905	1.999	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(Br)nc2)o1	764139262	QJUPZKWHMIGPSC-UHFFFAOYSA-N	438.282	1.679	50	20	IDGD	
CC(C)COc1cccc(NC(=O)C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1	764259422	GZAKPUQZKACPFO-UHFFFAOYSA-N	440.504	1.514	50	20	IDGD	
CN(C(=O)c1ccc(NC(=O)C(=O)NNC(=O)Cc2ccccn2)cc1)C1CCCCC1	764266611	GYMFXXTUOBOLPH-UHFFFAOYSA-N	437.500	1.815	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)c1cc2ccccc2cc1NC(=O)C1CC1	764343681	XXBOKEKXZQDLIM-UHFFFAOYSA-N	431.452	1.774	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)C(=O)Nc1ccn(-c2ncccc2C(F)(F)F)n1	764354512	UZQAOAVWSIUOEB-UHFFFAOYSA-N	433.350	1.010	50	20	IDGD	
Cc1nnc(-c2ccc(NC(=O)C(=O)NNC(=O)c3cc(-c4ccc(F)cc4)[nH]n3)cc2)o1	764386366	AHYTWVRUNGKPCZ-UHFFFAOYSA-N	449.402	1.974	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1)C(=O)Nc1cnn(Cc2ccncc2)c1	764386982	GFUKTHAFDXCJFQ-UHFFFAOYSA-N	448.418	1.255	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)Cc1nc(-c2ccccc2)cs1)S(=O)(=O)C1CCOCC1	764706896	GSDOFIGYXQGLBY-ZDUSSCGKSA-N	437.543	1.482	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)CSc1nnc(-c2ccncc2)n1Cc1ccco1	765442924	XDZBULGBEXTZJX-UHFFFAOYSA-N	438.473	1.566	50	20	IDGD	
C[C@@H](Cc1ccc(F)c(Br)c1)C(=O)NNC(=O)CNC(=O)c1cccnc1	765507262	BTIHZPIJBCMYCZ-NSHDSACASA-N	437.269	1.739	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NN=Cc2n[nH]c3cc(C(=O)O)ccc23)cc1	765559440	IMCDJPOEVXOXFW-UHFFFAOYSA-N	429.458	1.340	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3ccc(CS(C)(=O)=O)o3)n[nH]2)cc1OC	765600055	QXLKLEQICDCBRK-UHFFFAOYSA-N	448.457	1.306	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3nc4ccccc4s3)cc2)CC1	767084718	VFUOAHHPDFQOBC-UHFFFAOYSA-N	431.543	1.989	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@H]2[C@H]3c4ccccc4C[C@H]32)c1	769151305	PTZWLZREVKPFRE-OTWHNJEPSA-N	428.514	1.467	50	20	IDGD	
O=C(COC(=O)c1ccc(S(=O)(=O)C(F)F)cc1)NNC(=O)c1cccc(Cl)c1	769668897	VUXMUICMZDLECF-UHFFFAOYSA-N	446.815	1.954	50	20	IDGD	
CC(C)(C)OCc1cc(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)no1	769727105	KOZPVWZBKRGPPO-UHFFFAOYSA-N	429.521	1.963	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCN(C(=O)OCc2ccccc2)C1)c1nnc(O)c2ccccc12	770073975	QWHHAKLZXYDDMJ-HNNXBMFYSA-N	435.440	1.755	50	20	IDGD	
CC(C)[C@@H](CNC(=O)NNC(=O)[C@@H](C)Oc1cccc(Cl)c1)N1CCN(C)CC1	770127236	CRXJJDOWSWVMEY-CRAIPNDOSA-N	425.961	1.710	50	20	IDGD	
CCSCc1cc(C(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)no1	770247328	TUILKVIHDFRQCA-UHFFFAOYSA-N	431.562	1.815	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)N[C@H]2CCO[C@@]3(CCOC3)C2)c1	771444595	YDGHWZOHLGBJKX-GTNSWQLSSA-N	428.283	1.740	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)C(=O)N2CCC[C@H](C)C2)c2ccccc2c1=O	771606312	OFFPMJSCQWXYSX-HNNXBMFYSA-N	427.505	1.606	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1ccc(Cl)c(S(=O)(=O)N2CCCC2)c1	771880673	IKPYNPQJGSKRJT-LLVKDONJSA-N	431.898	1.227	50	20	IDGD	
Cc1ccc(S(=O)(=O)C[C@H](C)NC(=O)NNC(=O)c2c(C)nc3ccccn23)cc1	773131750	MKOIPCPQDNQRNX-AWEZNQCLSA-N	429.502	1.758	50	20	IDGD	
COc1ccc(C(=O)N2CCOCC2)cc1NC(=O)C(=O)NNc1c(F)cccc1F	773706106	VFPUCHBKDPETIF-UHFFFAOYSA-N	434.399	1.528	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3nc(N4CCOCC4)oc3c2)cc1F	773885854	RRFFFTPPHODVEM-UHFFFAOYSA-N	441.419	1.512	50	20	IDGD	
CN(C)CCNC(=O)c1cccc(CNC(=O)NNc2cccc(S(C)(=O)=O)c2)c1	776619781	SDHBAJSXSTXULC-UHFFFAOYSA-N	433.534	1.208	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccccc2CNC(=O)NNc2cc(Cl)ccn2)CC1	778672533	TZDVSTFWHPETAQ-UHFFFAOYSA-N	438.941	1.497	50	20	IDGD	
COc1cc(Cl)c(C)cc1NC(=O)C(=O)NNC(=O)Cc1nc2ccccc2n1C	782895055	XEAKTRKKODFBFU-UHFFFAOYSA-N	429.864	1.872	50	20	IDGD	
Cn1cnn(-c2ccc(NC(=O)C(=O)NNc3ccccc3Br)cc2)c1=O	782984406	ORDBZDLYHREQRF-UHFFFAOYSA-N	431.250	1.415	50	20	IDGD	
Cn1c(=NNC(=O)C(=O)Nc2cc(F)c(S(C)(=O)=O)c(F)c2)sc2ccccc21	783349982	SYGUFQMXZSQPNA-UHFFFAOYSA-N	440.453	1.492	50	20	IDGD	
Cc1ccc(Oc2ccc(NC(=O)C(=O)NNC(=O)CNC(=O)c3ccco3)cn2)cc1	784001715	CDNNCIWJLZYLQI-UHFFFAOYSA-N	437.412	1.291	50	20	IDGD	
C[C@H](C#N)CSc1ccccc1NC(=O)C(=O)NNC(=O)CNC(=O)c1cccs1	784005336	WEMDMXCRERNBBT-GFCCVEGCSA-N	445.526	1.516	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)ccc1N(C)C	784210674	ZAORTRRFNCDIFF-UHFFFAOYSA-N	431.518	1.584	50	20	IDGD	
COc1cc2c(cc1NC(=O)C(=O)NNc1ccnc(Br)c1)NC(=O)CC2	784837404	QUJBSVLMEPEFAC-UHFFFAOYSA-N	434.250	1.819	50	20	IDGD	
Cc1cccc(C(=O)N2CCCC2)c1NC(=O)C(=O)NNc1cccc(S(C)(=O)=O)c1	784846235	MHFDIAAXPHJDDA-UHFFFAOYSA-N	444.513	1.716	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)Nc1c(F)cccc1-n1cccn1	785022933	CABBGJJWZIKOQA-UHFFFAOYSA-N	428.336	1.025	50	20	IDGD	
CCNS(=O)(=O)c1ccc2c(c1)N(C(=O)C(=O)NNc1ccc(Cl)c(F)c1)CC2	785179143	STCILXGMAYXBIT-UHFFFAOYSA-N	440.884	1.810	50	20	IDGD	
O=C(NNC(=O)[C@]1(O)CCc2ccccc2C1)c1cccc(S(=O)(=O)N2CCCC2)c1	785671218	ZQISTNDKFMRHIB-QFIPXVFZSA-N	443.525	1.152	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)N[C@H]1CCCN(C2CCCCC2)C1=O	785923737	MIJBFYKVFIPJEL-KRWDZBQOSA-N	440.504	1.846	50	20	IDGD	
C[C@H]1CCC[C@@H](C)N1C(=O)COc1ccc(C(=O)NNC(=O)N2CCN(C)CC2)cc1	788165550	CPWJBBJGVHWCMK-CALCHBBNSA-N	431.537	1.457	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)c(OCC2CC2)c1	788492519	NDYOABHKVRAZLW-UHFFFAOYSA-N	432.502	1.852	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@@H](C(=O)NNc2nnc(-c3ccccn3)s2)[C@H](C)O)cc1	788558641	SBHFZPYELMXHLT-SWLSCSKDSA-N	448.530	1.080	50	20	IDGD	
Cc1cc(-n2cccn2)ccc1NC(=O)C(=O)NNC(=O)CSc1ccccc1O	789585840	IHNBPVQUTOZKIR-UHFFFAOYSA-N	425.470	1.765	50	20	IDGD	
CS(=O)(=O)CC[C@@H](C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)c1ccccc1	789895785	GDBCKOWURKERNK-QGZVFWFLSA-N	438.527	1.070	50	20	IDGD	
O=C(COc1ccccc1Cc1ccccc1)NNC(=O)NCc1nnc2n1CCOC2	790675886	GZWROYFTCDAVAH-UHFFFAOYSA-N	436.472	1.309	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCOc3c(Br)cccc3C2)n1	791563672	PHCIXTJMVNTYJZ-UHFFFAOYSA-N	439.335	1.799	50	20	IDGD	
N#Cc1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)ccn1	792789960	MTYFJFKANJHRCP-UHFFFAOYSA-N	435.465	1.507	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(OC(C)C)nn2)ccc1OC(C)C	793021329	CEVOSRRDBBPHEZ-UHFFFAOYSA-N	431.449	1.459	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)N2CCC(C(=O)Nc3ccc4c(c3)OCO4)CC2)n1	793228179	ZLMIKVASMUVVLW-UHFFFAOYSA-N	425.445	1.824	50	20	IDGD	
C[C@@H](C(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1)N(C)CC(F)(F)F	793814314	OWWSIRYVOHBHBI-LBPRGKRZSA-N	425.452	1.505	50	20	IDGD	
COc1ccc(C)cc1N1C[C@H](C(=O)NNc2ccccc2S(=O)(=O)N(C)C)CC1=O	795181528	MYVYRJQZJCPFTL-OAHLLOKOSA-N	446.529	1.750	50	20	IDGD	
CCOC(=O)c1cc(S(=O)(=O)NNC(=O)c2ccccn2)c(F)cc1Br	795278172	UQKGBMXJFHRTPI-UHFFFAOYSA-N	446.254	1.783	50	20	IDGD	
Cc1onc(-c2cccnc2)c1C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	796837638	PSQPDGGKLONQBV-UHFFFAOYSA-N	443.485	1.823	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)Nc3nccc(N(C)C)n3)n[nH]2)cc1OC	797641302	QOFBZKLQJCMFSY-UHFFFAOYSA-N	426.437	1.416	50	20	IDGD	
O=C(CNc1ccccc1)NNC(=O)c1ccc2c(c1)S(=O)(=O)c1ccccc1C2=O	799380783	KTZUVPUTJQZVJF-UHFFFAOYSA-N	435.461	1.937	50	20	IDGD	
O=C(CN1C(=O)c2cccc([N+](=O)[O-])c2C1=O)NNC(=O)Nc1ccc(OC(F)F)cc1	802046290	IKGRHPPDDGMCOT-UHFFFAOYSA-N	449.326	1.645	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)c2cccc(CS(N)(=O)=O)c2)c(OC)cc1Cl	802079906	GKALGLHTSATXGW-UHFFFAOYSA-N	442.881	1.612	50	20	IDGD	
COC(=O)Cc1c(C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)[nH]c2ccccc12	803712178	BQSUATJEAHXWPK-UHFFFAOYSA-N	434.408	1.373	50	20	IDGD	
Cc1noc(C)c1S(=O)(=O)NC1(C(=O)NNc2ccc(-n3ccnc3)nn2)CCCC1	804956884	ZGGMOBROAQWGBC-UHFFFAOYSA-N	446.493	1.002	50	20	IDGD	
Cc1ccc(NC(=O)NNc2ccc(-n3ccnc3)nn2)cc1N1CCCS1(=O)=O	806297715	UKIOWOOTGGSULR-UHFFFAOYSA-N	428.478	1.659	50	20	IDGD	
CS(=O)(=O)C1(CNC(=O)NNC(=O)c2ccc(F)cc2Br)CCCC1	807536113	PLNDPRQZHNRCLF-UHFFFAOYSA-N	436.303	1.890	50	20	IDGD	
CC[C@@]1(CNC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)OCCc2ccccc21	811926100	LYPIZBWSHGUSHQ-NRFANRHFSA-N	431.514	1.912	50	20	IDGD	
O=C1CNC(=O)c2ccc(C(=O)NNC(=O)NCc3cccc(C(F)(F)F)c3)cc2N1	814641966	GZPWZBYXSJCKLA-UHFFFAOYSA-N	435.362	1.532	50	20	IDGD	
CCOC(=O)Cc1nnc(NC(=O)NNc2ccccc2S(=O)(=O)N(C)C)s1	814678770	GCKPWUMAVFSFFD-UHFFFAOYSA-N	428.496	1.043	50	20	IDGD	
CC(C)(C)c1nc2ccc(NC(=O)C(=O)NNC(=O)[C@H]3CCc4nncn4C3)cc2s1	815693212	PCPOTSCXOIELSZ-NSHDSACASA-N	441.517	1.534	50	20	IDGD	
C[C@@H](C#N)Oc1ccccc1NC(=O)C(=O)NNc1ccccc1S(=O)(=O)N(C)C	815751707	KWOIIPFPQJJNED-ZDUSSCGKSA-N	431.474	1.310	50	20	IDGD	
C[C@@H](CC(=O)NNC(=O)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1)NC(=O)c1ccccc1	816510427	VZEKNNHOABADAU-DOTOQJQBSA-N	432.521	1.990	50	20	IDGD	
O=C(Cc1ccc(Br)cc1)N[C@H](C(=O)N1CC[C@H](B(O)O)C1)c1ccccc1	864233828	KNFNEHISZWXBIS-LPHOPBHVSA-N	445.122	1.924	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)CNS(=O)(=O)c1ccc(Cl)cc1	912861352	VLEHQIXTWBIUOO-NSHDSACASA-N	429.857	1.372	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCc2ccccc2S(=O)(=O)N(C)C)cc1OC	913632385	DKAHSNFBHHKDEG-UHFFFAOYSA-N	436.490	1.098	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2sccc2Br)c1	916093985	HJXZALPLHKUUGP-UHFFFAOYSA-N	432.321	1.836	50	20	IDGD	
CSc1nccn1-c1ccc(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1	916136716	XVUCPZCQHIOTKR-UHFFFAOYSA-N	444.542	1.962	50	20	IDGD	
CC1CCN(CCCNC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)CC1	916194994	KFZOSLPYLUIJJN-UHFFFAOYSA-N	430.597	1.651	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCCCN2CCC(C)CC2)nc1	916195686	XJPUMVJBCOEKIB-UHFFFAOYSA-N	426.587	1.860	50	20	IDGD	
COc1cc(CCNC(=O)NNC(=O)c2cccc(N(C)C)c2)c([N+](=O)[O-])cc1OC	916219604	HLFMJUFOVXDPIF-UHFFFAOYSA-N	431.449	1.865	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCC(C)(C)N2C[C@H](C)O[C@@H](C)C2)c2ccccc2c1=O	916234460	GKEZAJUBLNMROP-GJZGRUSLSA-N	444.536	1.248	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNS(=O)(=O)c1ccc2c(c1)CCCC(=O)N2	917721101	QRXYWRTWCSRHHH-UHFFFAOYSA-N	433.486	1.749	50	20	IDGD	
Cc1[nH]c(-c2ccncc2)nc(=O)c1CC(=O)NNC(=O)[C@H](C)Oc1ccccc1F	917919007	LNEKSLUWCJLBSQ-ZDUSSCGKSA-N	425.420	1.437	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)NNC(=O)c3ccc4c(c3)OCCO4)cc2C1	918779081	ACZZOCIEPCQBMD-LLVKDONJSA-N	430.486	1.933	50	20	IDGD	
Cc1ccc(Cn2nc(C)c(C(=O)NNC(=O)N[C@@H]3CCS(=O)(=O)C3)c2Cl)cc1	919884418	ITXAYSJNKYMVIS-CQSZACIVSA-N	439.925	1.333	50	20	IDGD	
Cc1cc(Br)ccc1SCC(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1	919885172	KPLHYYKMYUSDNN-LLVKDONJSA-N	436.353	1.367	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NC[C@H]2CCN(c3ccc(F)cc3)C2)c2ccccc2c1=O	920047091	FTRNFRCAXADZTE-CQSZACIVSA-N	438.463	1.543	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Cc2ccc(S(=O)(=O)N3CCCCC3)cc2)cc1	1317690642	UQJGCWLBMYHVES-UHFFFAOYSA-N	431.514	1.874	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)c1n[nH]cc1I	1320323456	GGJMMNXMNWNILK-UHFFFAOYSA-N	437.238	1.080	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)NCC2(S(C)(=O)=O)CCCC2)CC1	1322742293	QTVFCSAEWNMWCR-UHFFFAOYSA-N	446.570	1.321	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC(C(=O)NNc3nncc(N)c3Cl)CC2)cc1C	1324008219	ADAKMGUEZRRAGI-UHFFFAOYSA-N	438.941	1.873	50	20	IDGD	
O=C(CCNC(=O)N1CCc2ccccc2C1)NNC(=O)c1cncn1-c1ccccc1	1328713766	JDJIEVYQDLHVGJ-UHFFFAOYSA-N	432.484	1.791	50	20	IDGD	
CC(C)[C@H](NC(=O)NC(C)(C)C)C(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1	1339222268	ZNIXTGYWQCSMHT-HNNXBMFYSA-N	441.573	1.903	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4c(c3)CCCC4=O)C2)C1	1777927322	GHAKLYASFXXVCG-AVRDEDQJSA-N	434.920	1.903	50	20	IDGD	
CC(=O)N/C(=C\c1ccco1)C(=O)N1CCO[C@@]2(CCN(C(=O)CO[Si](C)(C)C)C2)C1	1779299024	MBLSTVQWOLHTPF-SARUNTBLSA-N	449.580	1.438	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ncon3)C2)C1	1779870049	SPCMAFSCLFGLEE-CDXDBMBRSA-N	429.383	1.398	50	20	IDGD	
Cc1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](O)CCl)C3)n(C(F)F)n1	1780164280	ZVGASCVTGGEPLT-PMUMKWKESA-N	434.871	1.314	50	20	IDGD	
O=C(c1ccc2nccn2c1)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781330173	SANOBCBEJJCIIW-YOEHRIQHSA-N	425.258	1.468	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](C)Cn1cccn1)CCO2	1783342618	CLBRZAFODYDQOR-VKJFTORMSA-N	427.343	1.523	50	20	IDGD	
CCc1nn(C)c(C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](C)Br)C3)C2)c1Cl	1783532991	VTQJCDGUFWVPGE-GTNSWQLSSA-N	447.761	1.863	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H]1C[C@@H]1c1ccc(OC)cc1)CCO2	1783870512	CSUCJDUWOFLXRF-GHDARCQNSA-N	436.936	1.882	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccn4nccc34)C[C@@H]21	1783973227	VHNGDHULAYUSRY-DNUAJFIVSA-N	449.349	1.959	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3cnc4ccccc4c3)C[C@@H]21)[C@@H](O)CCl	1784083714	GIECLMLIAIVBEQ-QIJZPMMNSA-N	445.947	1.747	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](N)Cc3cscn3)C[C@@H]21	1784617965	GIGXMQWAPJUNRT-SRQBIAJPSA-N	428.986	1.400	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3CNc4ccccc43)[C@H]2C1	1786879326	PLZOTZFOCQMAMP-NWCAJXEZSA-N	436.350	1.959	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC1(c2ccc(NC(=O)CC[C@H](N)C(N)=O)cc2)CCC1	1788059918	BPIZHHJSLHESBD-KBXCAEBGSA-N	429.348	1.950	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cn4ccsc4n3)[C@H]2C1	1788392821	OHBMDCKBHIMBIX-UHXUPSOCSA-N	441.351	1.773	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3c(C)nc4sccn34)[C@H]2C1	1788441370	JVTJEDKKJHVNON-XQLPTFJDSA-N	440.953	1.551	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cn4nc(C)sc4n3)C[C@@H]21	1789858325	WCUVJBAERKYWSA-TUUVXOQKSA-N	439.969	1.639	50	20	IDGD	
C[C@@H](Cc1ccncc1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]2C1	1789925060	MEVKICMDYUGNQT-SRQBIAJPSA-N	442.329	1.930	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)c1ccc(N2CCCCC2)cc1	1790105832	XTPOSNXFAIJOHZ-VMXMFDLUSA-N	449.979	1.870	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc(N(C)C)o3)C[C@@H]21	1790961826	UWORMQVIHROLBV-XUXIUFHCSA-N	443.342	1.507	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3C[C@@]34C(=O)Nc3ccccc34)[C@H]2C1	1791039194	SGVMJIGSJSXTLE-TUKDEAEVSA-N	445.947	1.894	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)Cn3ccnc3)[C@H]2C1	1791630413	PBELBQSQTMTZPY-OWYFMNJBSA-N	427.343	1.282	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)Cn3ccnc3)[C@H]2C1	1791631273	ZTOVGPOZQHBMMF-XAJHFOFHSA-N	441.370	1.672	50	20	IDGD	
CCOC(=O)N1CCC(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Cl)C[C@@H]32)CC1	1792144150	VPVPAUBWVHULSP-VGWMRTNUSA-N	433.908	1.369	50	20	IDGD	
CCOc1cnc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@](C)(Cl)CCl)C3)cn1	1794340268	INGMQQGDGBWVQB-ABXQLRGKSA-N	431.320	1.315	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1noc(-c3ccccc3)n1)C2)[C@H](F)Cl	1796367661	MENUQGXGXBEODA-DACLVMHWSA-N	436.871	1.793	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H]1Cc3ccccc3N1)C2	1796893545	GDRINFVTGRWOCZ-ZCHQYYIMSA-N	448.527	1.795	50	20	IDGD	
Cn1ncc2c(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@@H](F)Br)C4)cccc21	1797090424	RMXIABZEGNBVTM-OXUXUCFPSA-N	439.285	1.467	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2)c1cnn(Cc2ccccc2)c1	1798150737	SXYIXSHIWUSPGN-BJWYYQGGSA-N	437.327	1.938	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cn(C(C)(C)C)nn1	1798705757	JIMFCCWERDULNC-XPCVCDNBSA-N	442.358	1.267	50	20	IDGD	
CCc1ncsc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)CBr)C2	1798760450	HHZBQOMPKGRADO-NRWUCQMLSA-N	430.368	1.940	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc([N+](=O)[O-])c(OC)c1)C2	1799268183	MFJFYIJAYPMUJX-NXEZDXNNSA-N	439.896	1.753	50	20	IDGD	
C[C@@H](Cc1ccncc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)CBr)C2	1800191052	QJRTZAHRDUWYFX-XWJBARJFSA-N	438.366	1.881	50	20	IDGD	
C[C@@H](Oc1ccccn1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@](C)(Cl)CCl)C2	1801366209	CLKQABOIRVJBDV-HUYPOWGKSA-N	430.332	1.675	50	20	IDGD	
Cc1ccc(C(=O)NCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)C(C)(C)CCl)C3)cc1	1802116003	WECVCUWTSQIDQQ-IZZQQSIFSA-N	435.952	1.579	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccnc(C(F)(F)F)c1)C2	1802333001	JXCKXBOAQJELEY-QDMKHBRRSA-N	441.454	1.725	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]1c1cccnc1	1803138156	XVHWNTZYPMAXEY-NMFUWQPSSA-N	432.746	1.718	50	20	IDGD	
Cc1cn(CC(=O)N2CCC3(CCCN(C(=O)C(C)(C)CCl)C3)CC2)c(=O)nc1O	1805264869	UBLRSOBQIZLLGA-UHFFFAOYSA-N	438.956	1.754	50	20	IDGD	
O=C(c1cncn1-c1ccncc1)N1CCC2(CCCN(C(=O)[C@@H](O)CCl)C2)CC1	1805517512	HFBSBGOFHWNPHM-SFHVURJKSA-N	431.924	1.712	50	20	IDGD	
Cc1cccnc1C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1807364675	TUFMTMSFFWTHGD-UGKGYDQZSA-N	444.300	1.098	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)NC(C)=O)[C@@H]1c1cccnc1	1812779012	NZKCTTKHHVRTSO-ISWURRPUSA-N	439.354	1.786	50	20	IDGD	
CSCC[C@H](O)C(=O)NC[C@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1	1813092512	WGXMJNNRYMABEN-VYDXJSESSA-N	444.395	1.986	50	20	IDGD	
CCC[C@H](NC(C)=O)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](Cl)COC)[C@@H]1c1cccnc1	1814132141	SZUBTGAODXXZER-CADBVGFASA-N	438.956	1.646	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H]2CCC(=O)NC2)n[nH]1	1814524770	ADEQFJALNSRTDV-DMDPSCGWSA-N	426.315	1.711	50	20	IDGD	
C[C@@H](CBr)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](N)CCC(N)=O)[nH]n1	1814780870	UAFRAVQXKGFLTK-GVXVVHGQSA-N	443.346	1.026	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2Cc3ccccc3CN2)[nH]n1)[C@H](O)CCl	1814870358	PWLSOWCHDCQQOQ-OKZBNKHCSA-N	431.924	1.716	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](O)N2CCOCC2)n[nH]1	1819448347	OAUAVAXGNDTKBU-QBIMZIAESA-N	448.351	1.289	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1[nH]cc2c1CCC2	1820104538	LBWZJOZIEVLHRN-IBGZPJMESA-N	447.304	1.526	50	20	IDGD	
C[Si](C)(C)OCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCS(C)(=O)=O)CC2	1820169002	OJVUHBVIDSBXPB-NSHDSACASA-N	433.628	1.341	50	20	IDGD	
CO[C@H](C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[nH]n1	1822450313	OPIZYLSPDKQTEE-QHOZVMDTSA-N	429.481	1.571	50	20	IDGD	
COc1ccc(C(=O)N[C@H]2CCc3nc(NC(=O)[C@H](F)Br)sc3C2)nn1	1823006492	GIJVZJSXINWBAD-MADCSZMMSA-N	444.286	1.858	50	20	IDGD	
CSCC[C@H](O)C(=O)N[C@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1	1823013521	CMYZEJOLEBSHPM-ARENWVFISA-N	440.360	1.860	50	20	IDGD	
O=C1NCc2cc(C(=O)N3CCC([C@H]4CCCCN4C(=O)[C@H](O)CCl)CC3)ccc21	1824186302	MRCSYLQCYBPZPN-RTBURBONSA-N	433.936	1.763	50	20	IDGD	
C[C@H](C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCBr)CC2)n1ccnn1	1824683194	MZZDOYHDMOWVKT-ZJUUUORDSA-N	427.328	1.693	50	20	IDGD	
C#CC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CN(C)NC(=O)NCc1ccccc1)CC2	1825022839	UQMXJDYTDVZPHW-HNNXBMFYSA-N	440.529	1.035	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)c2ccns2)CC1	1825676455	ONCRNFSQHBGVKW-SFHVURJKSA-N	427.335	1.370	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ncccn2)CC1	1826014174	KETOZOVMOIQBOP-GOSISDBHSA-N	437.504	1.022	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(C=O)s1)CC2	1826085496	XHYNTWYUMAUMKN-NSHDSACASA-N	449.558	1.616	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(=O)n3[nH]nnc3n2)CC1	1827400215	IOJHGVRMAMUHLI-ZFWWWQNUSA-N	435.916	1.063	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H](N)Cc2cccnc2)CC1	1827642961	DSEXCOSGRURYCY-SLFFLAALSA-N	436.984	1.825	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)c[nH]1	1827893093	KZWIZHIIAPVYON-HXUWFJFHSA-N	438.532	1.869	50	20	IDGD	
O=C1NCc2cc(C(=O)N3CCCC[C@@H]3C3CCN(C(=O)[C@H](O)CCl)CC3)ccc21	1828722820	FZMPNYPZOBGLHA-RTBURBONSA-N	433.936	1.763	50	20	IDGD	
C[C@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1)N1C[C@H]2C[C@@H]2C1	1828817191	NSFWHWJXYLTAEN-CWJKEVGVSA-N	447.624	1.319	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(F)n2)CC1	1829225032	LANLYUWBRKPVEQ-FQEVSTJZSA-N	439.296	1.448	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccc(OC)c(O)c3)CCO2)C1	1830246101	CMMGNVXDQVZEFU-IIBYNOLFSA-N	440.924	1.417	50	20	IDGD	
CC(C)(Cc1ccccc1)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1	1830547245	IMPLDTNHBNAWMU-PGRDOPGGSA-N	438.952	1.311	50	20	IDGD	
Cc1cc(Cl)ccc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1830719803	KSTLKLMYASJJOY-VQIMIIECSA-N	431.316	1.318	50	20	IDGD	
CCS(=O)(=O)N[C@@H](C)C(=O)N1CCC([C@H]2CCCCN2C(=O)C(Cl)Cl)CC1	1831875185	UXJAONXUFIAIED-GXTWGEPZSA-N	442.409	1.738	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H]3CCc4ccccc4C3)CC2)CC1)[C@H](O)CCl	1833312596	ZCXDFQLIZZWVHR-SIKLNZKXSA-N	448.007	1.963	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3ccc(O)nn3)CC2)CC1	1834071980	WNHNRCMVKGBDPV-GFCCVEGCSA-N	440.342	1.151	50	20	IDGD	
Cc1cnc(C(=O)NC2CCN(C3CCN(C(=O)CO[Si](C)(C)C)CC3)CC2)cn1	1834161371	SUWPFPKQHOAJMG-UHFFFAOYSA-N	433.629	1.822	50	20	IDGD	
O=C(CCc1ccsc1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1836007689	XOZVYBBHSLYLID-NVXWUHKLSA-N	449.342	1.828	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3nnc(C)s3)CCO2)C1	1836076635	MJQBTYLQABMUIN-KSSFIOAISA-N	430.958	1.253	50	20	IDGD	
O=C(C(=O)N1CCC(N2CCC(NC(=O)[C@H](F)Br)CC2)CC1)c1ccco1	1836413312	APTWPDGPNDZDHM-INIZCTEOSA-N	444.301	1.724	50	20	IDGD	
CN1C(=O)CC[C@H]1C(=O)NC1CCN(C2CCN(C(=O)[C@](C)(Cl)CCl)CC2)CC1	1836416949	GTZGQEPRCRPBSH-OXJNMPFZSA-N	447.407	1.415	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC(OC2CCN(C(=O)C3CC(=O)C3)CC2)CC1	1836674419	OPXTYYVWYMBBDW-CYBMUJFWSA-N	429.355	1.995	50	20	IDGD	
O=C(c1cn2ccccc2n1)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836718324	VLSXXFVNKRGZKZ-GOSISDBHSA-N	434.924	1.546	50	20	IDGD	
C[C@@H](CS(C)(=O)=O)C(=O)N1CCC(OC2CCN(C(=O)C(Cl)Cl)CC2)CC1	1836876452	RWQBGBYZFMKKJS-LBPRGKRZSA-N	443.393	1.469	50	20	IDGD	
O=C(CCC(=O)N1CCC(OC2CCN(C(=O)[C@H](F)Cl)CC2)CC1)N1CCCC1	1837065571	YDOLBEPHFUUYKF-IBGZPJMESA-N	431.936	1.922	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC(OC2CCN(C(=O)Cc3cncnc3)CC2)CC1	1837197987	DQHLFUQTVKDWTJ-UHFFFAOYSA-N	434.613	1.869	50	20	IDGD	
C[C@]1(C(=O)N2CCC(OC3CCN(C(=O)CCBr)CC3)CC2)CCCN1	1837654491	RYVVUCWUEVNCEC-LJQANCHMSA-N	430.387	1.912	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(C(C)(C)C)n[nH]3)CCO2)C1	1837993924	MDJYTNMNFIDKOZ-XOBRGWDASA-N	442.944	1.031	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3nc[nH]c3[N+](=O)[O-])CC2)CC1	1838093117	ABELGUGLNZSZLT-AWEZNQCLSA-N	443.888	1.184	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ncccc3F)CCO2)C1	1838251659	GBOLFZPZEVRNBZ-UGSOOPFHSA-N	444.301	1.464	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)CN3CCN(C)CC3)CC2)CC1	1838286570	HSEJPSNBTLKLAC-LJQANCHMSA-N	429.005	1.250	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3n[nH]c4c(C)cccc34)C2)C1	1839148354	WLWCOZCBISWFEJ-HRAATJIYSA-N	434.924	1.959	50	20	IDGD	
Cc1cccc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)n1	1839198581	JJRZXNHRHQIQOM-FUHWJXTLSA-N	444.301	1.079	50	20	IDGD	
O=C(Cc1ccc(F)cc1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839198719	APEDKLWMZBKZRS-FUHWJXTLSA-N	447.276	1.515	50	20	IDGD	
O=C(c1cccc(F)c1Cl)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1	1839322691	VHHLAAFBJUZJAW-KDOFPFPSSA-N	435.279	1.149	50	20	IDGD	
O=C(c1ccccc1OC(F)F)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1840744741	VDTBGDHVLNJLCZ-KBXCAEBGSA-N	436.814	1.892	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)C3CCSCC3)CCO2)C1	1840926336	JJZQTBMROVLDIW-SUMWQHHRSA-N	435.384	1.369	50	20	IDGD	
O=C(c1ccc(-c2cccnc2)cc1)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843012066	ZPLVPJLWPCCJSU-UHFFFAOYSA-N	441.296	1.559	50	20	IDGD	
COc1c(Cl)cccc1C(=O)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843012657	LPWHUWQAVXFNAK-UHFFFAOYSA-N	428.681	1.159	50	20	IDGD	
Cn1c(=O)c(C(=O)N2CCCC23CN(C(=O)CO[Si](C)(C)C)C3)nc2ccccc21	1843743774	NUVMHVDSFISILL-UHFFFAOYSA-N	428.565	1.602	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)c1c(Cl)cncc1Cl)C2	1846383498	GSRYDEBKYYGAKD-UHFFFAOYSA-N	428.320	1.578	50	20	IDGD	
O=C(c1cc(Br)cc2cn[nH]c12)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl	1847564095	STCSJJODJGLBRF-IHRRRGAJSA-N	441.713	1.741	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H]1CCC[C@@H]1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl	1847568797	MNXFFBOUYNDFGK-UVPYHEFZSA-N	429.945	1.481	50	20	IDGD	
CC(C)n1cnnc1SCC(=O)NNC(=O)COc1ccc(Br)cc1	9212693	ZVDIZQGFMGAOLX-UHFFFAOYSA-N	428.312	1.940	50	20	IDGD	
CSCC[C@H](C(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)N1C(=O)c2ccccc2C1=O	17329896	MONKJIXVRPTMPH-MRXNPFEDSA-N	442.453	1.774	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cc3c(s2)CCC3)cc1S(=O)(=O)NC1CC1	17446516	ILKXZYOPHOUTPL-UHFFFAOYSA-N	435.527	1.761	50	20	IDGD	
O=C(NNC(=O)c1cc2c(s1)CCC2)c1cccc(S(=O)(=O)NC[C@H]2CCCO2)c1	21782129	BVEABRGZJIGHIB-OAHLLOKOSA-N	449.554	1.769	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)cc1	23566898	NMOPEGQDKUCCSA-QAPCUYQASA-N	449.504	1.902	50	20	IDGD	
CS(=O)(=O)N1CCCc2cc(C(=O)NNC(=O)c3cc(Br)c[nH]3)ccc21	28717869	AORMMIGCPPQELD-UHFFFAOYSA-N	441.307	1.564	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc(C)cc1	108517438	XMRYQAGGMMAMIN-SFHVURJKSA-N	446.529	1.416	50	20	IDGD	
Cn1c(=O)n(C)c2cc(S(=O)(=O)NNC(=O)CC34CC5CC(CC(C5)C3)C4)ccc21	109594464	JYNCLRVUARDIHM-UHFFFAOYSA-N	432.546	1.793	50	20	IDGD	
Cc1c(/C=C(\C#N)C(=O)N2CCN(S(=O)(=O)c3ccc(F)cc3)CC2)cc(C#N)n1C	301148562	TVGSTQSWGUYWBE-GZTJUZNOSA-N	441.488	1.784	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NCCCNc1ccc(C(F)(F)F)cn1	725873921	STHKZSVLIMZLMB-UHFFFAOYSA-N	444.439	1.724	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CN2CCC(C(=O)Nc3ccc4c(c3)OCO4)CC2)cc1	727325691	SYCPDMITYDRHQO-UHFFFAOYSA-N	438.484	1.835	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)CNC(=O)c1ccc(O)cc1	727483032	CPCSUBLCARAJDI-LLVKDONJSA-N	436.262	1.499	50	20	IDGD	
CN(C)CCNC(=O)c1cccc(CNC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c1	727603770	FRQKLDGIGZONTN-UHFFFAOYSA-N	428.449	1.030	50	20	IDGD	
CNS(=O)(=O)c1cccc([C@H](C)NC(=O)NNC(=O)c2ccc(OC)c(OC)c2)c1	727611212	XEHRDEKZJFCNHD-LBPRGKRZSA-N	436.490	1.317	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3ccc(N4CCCC4)nc3)cc2)CC1	728214685	SDSRZQYXUNHTHC-UHFFFAOYSA-N	444.561	1.375	50	20	IDGD	
C[C@@H](C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1)N1CCc2ccccc21	728216026	NLCUMNAFBFIJCY-KRWDZBQOSA-N	443.573	1.517	50	20	IDGD	
Cc1sc(-c2ccco2)nc1C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	728323858	SXJHLVGGQCLDGA-HNNXBMFYSA-N	443.437	1.856	50	20	IDGD	
COc1ccc(OC)c([C@H](O)CNC(=O)NNC(=O)c2cccc(OC(F)F)c2)c1	728598912	QUCGHRRQTSCYMS-OAHLLOKOSA-N	425.388	1.983	50	20	IDGD	
CSCC[C@@H](C(=O)NNC(=O)c1cccc(C#N)c1)N1C(=O)[C@H]2CCCC[C@H]2C1=O	728828188	KMWGUUSYVSPLCK-BBWFWOEESA-N	428.514	1.616	50	20	IDGD	
O=C(NCc1nnnn1-c1ccccc1)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1	730672708	KGENYCHCEOHCIQ-UHFFFAOYSA-N	441.395	1.782	50	20	IDGD	
O=C(Cc1csc(N2CCOCC2)n1)NN=Cc1ccc(OC(F)(F)C(=O)O)cc1	730728073	JCRIXPQUAAWJAC-UHFFFAOYSA-N	440.428	1.729	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)c(OC)c1	731991215	UZOYUUKLISDAAE-ZDUSSCGKSA-N	448.457	1.739	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2ccc(OC)c(OCCO)c2)cc1Br	732307771	XAXOPDQXHOYMDB-UHFFFAOYSA-N	439.262	1.912	50	20	IDGD	
COc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NNc2ccc(Br)nc2)cc1	732837584	MGNPVEGLCGVVOT-JTQLQIEISA-N	429.296	1.663	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)Cc2c[nH]c3ccc(F)cc23)cc1OC	734600545	QGQMOWLCRSLMHO-UHFFFAOYSA-N	429.404	1.871	50	20	IDGD	
COc1ccc([C@@H]2[C@H](C(=O)OCC(=O)NNC(=O)c3ccccc3)CCC(=O)N2C)cc1	734618262	TYYVSNYKBAGTIC-WIYYLYMNSA-N	439.468	1.609	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)cc1	734807340	LPBCXYIBYFENQP-UHFFFAOYSA-N	440.522	1.781	50	20	IDGD	
COc1cccc(C[C@@]2(C(=O)NNC(=O)N[C@@H]3CCS(=O)(=O)C3)C[C@H]3CC[C@H]2C3)c1	735468087	CYVHZJXINIGKQY-ZGPJWRFFSA-N	435.546	1.562	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=O)COCc2ccccc2)ccc1F	737629803	ZONKRFHVMKJVHT-UHFFFAOYSA-N	437.493	1.834	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)Nc2cnn(CC(=O)N3C[C@H](C)O[C@@H](C)C3)c2)cc(C#N)n1C	741726060	JUMNFPNFWMZWEJ-BHNCBKDISA-N	435.488	1.583	50	20	IDGD	
Nn1c(COc2c(Cl)cccc2Cl)nnc1SCC(=O)NNC(=O)C1CC1	742451697	XSJBBJBSGKQEIW-UHFFFAOYSA-N	431.305	1.527	50	20	IDGD	
C[C@@H]1CCCC[C@]12NC(=O)N(CC(=O)NNC(=O)c1cccc(Br)c1)C2=O	742768799	AGJONRXHFBMQFG-ZMZPIMSZSA-N	437.294	1.711	50	20	IDGD	
COC[C@@H]1CN(C(=O)NNC(=O)[C@@H]2Cc3ccccc3CN2Cc2ccccc2)CCO1	743573806	IUCWWBUBPKIDQA-VXKWHMMOSA-N	438.528	1.702	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc([C@H](C)NC(=O)NNC(=O)Cc2ccncc2)cc1	747490013	GJOLBPHZJRQLRB-HNNXBMFYSA-N	433.534	1.746	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCOC[C@H]2C[C@@H](O)c2ccccc2)cc1OC	747656387	IRCYNTVKYPGDAH-RTBURBONSA-N	443.500	1.289	50	20	IDGD	
O=C(CCn1nnc2ccccc2c1=O)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1	748523057	MOXKCFXVVHRYFL-UHFFFAOYSA-N	441.391	1.618	50	20	IDGD	
CN1CCC[C@H](NC(=O)NNC(=O)COc2ccc(OCc3ccccc3)cc2)C1=O	748664404	JPQKGXXAJDEECH-IBGZPJMESA-N	426.473	1.596	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)NCC(=O)N2CCN(c3ccccc3)CC2)c1	749222398	WVUUZPWOVDYJOT-UHFFFAOYSA-N	425.489	1.053	50	20	IDGD	
COC[C@@H](C)n1c(C)cc(/C=C(/C#N)C(=O)NCCNS(=O)(=O)Cc2ccon2)c1C	750075219	AXTZLXROWKZYIR-YQYFLZKSSA-N	449.533	1.443	50	20	IDGD	
COc1ccc(OC)c(CC(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)c1	751391487	HYIIBXVAQJWNJA-UHFFFAOYSA-N	427.866	1.008	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)C[C@H]2CSCCS2)c1	751539700	WUIKXRSQPFKOQZ-AWEZNQCLSA-N	431.605	1.717	50	20	IDGD	
CC[C@H](NC(=O)CCC(=O)C(C#N)=C1N(C)c2ccccc2N1C)C(=O)N1CCOCC1	752767398	HFSUFLHZHVPNSI-KRWDZBQOSA-N	439.516	1.411	50	20	IDGD	
CN1C(=O)N[C@]2(CCC[C@H]2CNC(=O)NNC(=O)c2ccc(Cl)cc2Cl)C1=O	753020273	PWCJMWMAYQJQOJ-XYZCENFISA-N	428.276	1.658	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)c2cc(S(=O)(=O)N(C)C)oc2C)cc1	753179512	TXXNBYOTHMZVIM-ZDUSSCGKSA-N	439.490	1.466	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@@H](C)C(=O)NNC(=O)CN1C(=O)N[C@](C)(C2CC2)C1=O	754822160	BGAGPGBZMJJSOP-FKIZINRSSA-N	436.896	1.592	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)N[C@H]1CCN(c2c(F)cccc2F)C1=O	755084704	GZYSBSBEEKEMLW-AWEZNQCLSA-N	428.399	1.670	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NCc2cccc(N(C)C)n2)c2ccccc2c1=O	755097638	IVDUGSXSMXVXNM-UHFFFAOYSA-N	437.504	1.802	50	20	IDGD	
Cc1ccc(C(=O)NNc2ccc(C(F)(F)F)nn2)cc1S(=O)(=O)N1CCOCC1	755197362	HIAABBBWUVUODI-UHFFFAOYSA-N	445.423	1.582	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)Nc1cccc(N2C(=O)CN(C)C2=O)c1	755994669	ZQRIOXPPWXCQEN-GFCCVEGCSA-N	429.408	1.844	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)Nc1nnc(C23CC4CC(CC(C4)C2)C3)s1	756022532	SIRYMVQUOMNITG-FIVXQRBNSA-N	439.563	1.593	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN(CCO)[C@@H]2CCCc3ccccc32)cc1OC	756593981	JSHANCDZIWJBRP-LJQANCHMSA-N	427.501	1.837	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCC2Cc3ccccc3C2)c1	756731007	QMTPAHXHCJUAEH-UHFFFAOYSA-N	430.530	1.686	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)COc2ccccc2OC)cc1NS(C)(=O)=O	756781344	ARFWXJIOOKBFKC-UHFFFAOYSA-N	438.462	1.307	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2nnc(O)c3ccccc23)cc1NS(C)(=O)=O	756782312	PFCGLEWATLHQPB-UHFFFAOYSA-N	446.445	1.182	50	20	IDGD	
O=C(NCc1cc([N+](=O)[O-])ccc1Cl)NNC(=O)c1csc(N2CCOCC2)n1	756914029	LRDJSFXBURBJRC-UHFFFAOYSA-N	440.869	1.686	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1cccc(OCc2ccc(Cl)cc2)c1	758041374	YNXXLIGVWIKIJM-LBPRGKRZSA-N	425.894	1.618	50	20	IDGD	
CN(NC(=O)[C@H]1CCCN(C(=O)C2CC2)C1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758787741	VLGGQDZNMKLIOX-INIZCTEOSA-N	437.541	1.271	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)[C@@H]2CC(=O)N(CCc3ccc(OC)c(OC)c3)C2)nc1	759725400	ODWADBPEXWFVEY-MRXNPFEDSA-N	442.472	1.420	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccnc(O)c2)c1	760224910	QLGKQRVHBJBOJP-UHFFFAOYSA-N	442.453	1.671	50	20	IDGD	
COc1cccc(-c2nc(C(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)no2)c1	760264790	MZMSPXTUVUQRAM-UHFFFAOYSA-N	445.457	1.070	50	20	IDGD	
CCC(=O)NNC(=O)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C)[C@H]2C[C@H]3CC[C@H]2C3)cc1	763441568	XJXSLPBLWZTQGG-XJIUQZFPSA-N	436.534	1.286	50	20	IDGD	
O=C(NNC(=O)c1ccc2ccccc2n1)C(=O)Nc1ccc(S(=O)(=O)C(F)F)cc1	763466243	IPEVUNGQIQAWFK-UHFFFAOYSA-N	448.407	1.631	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(N2CCCC2=O)c(Cl)c1	763471872	OIWUDXSEMRQEMQ-UHFFFAOYSA-N	445.819	1.775	50	20	IDGD	
O=C(NNC(=O)c1ccccc1Br)C(=O)Nc1cnn(C[C@@H]2CCCO2)c1	763481951	AGGFHGBIODSGLN-LBPRGKRZSA-N	436.266	1.224	50	20	IDGD	
CCOCCOCc1cccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)c1	763547596	GDINHJQIMYHEAN-UHFFFAOYSA-N	429.429	1.368	50	20	IDGD	
CC(C)(C)OC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)cn1	763547962	GUUYDNQFTGEEMJ-UHFFFAOYSA-N	443.416	1.557	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)n(-c2ccc(Cl)cc2)n1	763550516	BPPGIXYPXBZNGM-UHFFFAOYSA-N	441.831	1.963	50	20	IDGD	
CCCC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1C	763572172	MARBHIVRCFCDFC-GOSISDBHSA-N	440.456	1.660	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)Nc1cc(F)ccc1N1CCCCC1	763572367	QVIMXDOVHJRYGF-IBGZPJMESA-N	442.447	1.742	50	20	IDGD	
COCCOc1ccc(C#N)cc1NC(=O)C(=O)NNC(=O)c1cc(C)nc2ccccc12	763615879	IRIJNUNFQRYJMU-UHFFFAOYSA-N	447.451	1.840	50	20	IDGD	
COC(=O)c1c(NC(=O)C(=O)NNC(=O)COc2ccc(OC)cc2)sc(C)c1C	763661932	QXEDTTDWWDEQCK-UHFFFAOYSA-N	435.458	1.325	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(Br)ccc1C	763662877	BUZAVJLDVFHTHR-UHFFFAOYSA-N	436.262	1.931	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(CC(=O)N(C)C)cc2)cc1C	763667636	UJWUDBQJFAMAEQ-UHFFFAOYSA-N	426.473	1.099	50	20	IDGD	
N#Cc1cc(F)ccc1NC(=O)C(=O)NNC(=O)COc1ccc(Br)cc1	763694636	KFDINUCPGIQCBV-UHFFFAOYSA-N	435.209	1.625	50	20	IDGD	
CCNC(=O)N1CCc2ccc(NC(=O)C(=O)NNC(=O)c3cccc(N(C)C)c3)cc21	763760181	GKAQWSOYBXAARB-UHFFFAOYSA-N	438.488	1.244	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2cccc(OC[C@@H]3CCCO3)c2)c1	763773501	YNLVXOYDRMKVPT-KRWDZBQOSA-N	443.456	1.661	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2ccc(-c3csnn3)cc2)c1	763774317	BSJFOHBWYMYYDT-UHFFFAOYSA-N	427.442	1.622	50	20	IDGD	
Cc1nn(-c2ccccc2)c(C)c1NC(=O)C(=O)NNC(=O)COc1ccc(F)cc1	763841848	URDHEZBEOLCJNR-UHFFFAOYSA-N	425.420	1.793	50	20	IDGD	
CC(=O)NCc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)cc1	763852117	VBJXITLTAQOJTG-OAHLLOKOSA-N	426.473	1.493	50	20	IDGD	
CC(C)(C)c1nnc(NC(=O)C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)s1	763943950	HDWGZIYCHHRZKE-UHFFFAOYSA-N	429.462	1.127	50	20	IDGD	
CCN(Cc1ccccc1NC(=O)C(=O)NNC(=O)c1cc(Cl)ccc1O)C(C)=O	763974813	XTCABDSAKYRJQH-UHFFFAOYSA-N	432.864	1.814	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc(-c3ccc(F)cc3)s2)c(=O)n(C)c1	763975355	GDUWQFPIUWWHSI-UHFFFAOYSA-N	428.445	1.961	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)ccc1N1CCOCC1	763977489	SUBPKACQSMVLIS-UHFFFAOYSA-N	432.864	1.590	50	20	IDGD	
CC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)CSc1ccccc1O	764049415	YYCOKTKOHOHSOQ-QGZVFWFLSA-N	426.498	1.860	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)CC)cc1S(=O)(=O)N(CC)CC	764083279	QBNNQQAQXXCHBV-ZDUSSCGKSA-N	442.538	1.248	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(C)n([C@@H](C)C3CC3)n2)o1	764139537	XJUDNLBWUCMBML-AWEZNQCLSA-N	430.509	1.997	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)ccc1OC1CCOCC1	764166842	FOYICDLVOVJVAX-HXUWFJFHSA-N	439.468	1.642	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)Cn3ccc4ccccc43)cc2)CCO1	764239291	KGSAHLBVKYGERG-INIZCTEOSA-N	435.484	1.653	50	20	IDGD	
C[S@](=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cccc(OC(F)F)c2)cc1F	764259179	FDTVSRCCYSDAAF-LJAQVGFWSA-N	429.376	1.564	50	20	IDGD	
CC(C)CC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2O)cc1	764274654	ACRUPUDTCJKMKO-UHFFFAOYSA-N	428.445	1.542	50	20	IDGD	
O=C(CCCc1cccs1)NNC(=O)C(=O)Nc1ccccc1CN1CCOCC1	764340284	YWTKPJYDHCPTRY-UHFFFAOYSA-N	430.530	1.689	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)ccc1C(=O)NC(C)C	764350139	YTCSTGULIKZPQL-UHFFFAOYSA-N	432.864	1.892	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)C(=O)Nc1ccc(C(=O)NCCc2ccccc2)cc1	764352924	FHBSNKWWCUBPSS-UHFFFAOYSA-N	445.479	1.383	50	20	IDGD	
CCOc1cc2c(cc1NC(=O)C(=O)NNC(=O)COCc1ccccc1)O[C@@H](C)C2	764363509	QTFGXBXQJUXETQ-AWEZNQCLSA-N	427.457	1.711	50	20	IDGD	
CN(C)CCOc1cccc(NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)c1	764376325	BPUIPDCMFYEKJJ-UHFFFAOYSA-N	442.501	1.478	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)ncn3C)n[nH]1	764376526	FHEMWDSUDUUQID-UHFFFAOYSA-N	433.428	1.372	50	20	IDGD	
COC(=O)CCc1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)cc1	764382172	GJWCNHMOGSBWKD-UHFFFAOYSA-N	441.469	1.644	50	20	IDGD	
COc1ccc(NC(C)=O)cc1NC(=O)C(=O)NNC(=O)c1cc(-c2cccs2)[nH]n1	764382373	IQMYBIMJUCHFHM-UHFFFAOYSA-N	442.457	1.505	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc4c(c3)OCC(=O)N4)n[nH]2)cc1	764384543	COUFZYUCVGMXJP-UHFFFAOYSA-N	448.439	1.370	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1ccc(C(F)(F)F)nc1	764394205	PMAHKKPIFYXHLS-UHFFFAOYSA-N	428.392	1.987	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3ccc([N+](=O)[O-])c(C)c3)CC2)cc1	765749254	KWCLURHPVKJOTP-UHFFFAOYSA-N	425.489	1.790	50	20	IDGD	
Cc1nnc(-c2cccc(C(=O)NNC(=O)CN3CCN(C(=O)c4ccccc4)CC3)c2)o1	766642310	LXBMZRXFEOLSIY-UHFFFAOYSA-N	448.483	1.264	50	20	IDGD	
CCOCCC1(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)CCCC1	766644360	UYWBGTLDFXJQAF-UHFFFAOYSA-N	430.549	1.579	50	20	IDGD	
Cc1noc(CCCC(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)n1	766660365	LALSAPSPHLMJPG-UHFFFAOYSA-N	434.928	1.319	50	20	IDGD	
Cc1nnc(NNC(=O)CSc2nnc(-c3ccncc3)n2-c2ccccc2)nc1O	767852825	UWBGPKHUYJLLPP-UHFFFAOYSA-N	435.473	1.764	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2cnc(Cl)c(Br)c2)c1O	768239867	PTRLXBOWXUFTLC-UHFFFAOYSA-N	443.641	1.611	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCC[C@H]2Cn2cnc3ccccc32)cc1OC	769921768	XDBDVCQKPFMQSV-KRWDZBQOSA-N	437.500	1.979	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(O)nc(C3CC3)c2)c1	770210109	SMSJJKPGRZKTBE-UHFFFAOYSA-N	432.502	1.770	50	20	IDGD	
CCN1CCN(c2cccc(NC(=O)C(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)c2)CC1	770773845	KGXBZNRKNIVRCK-UHFFFAOYSA-N	440.460	1.136	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)CN2CCN(CCOc3ccccc3Cl)CC2)cc1	771088989	BCAWYFAFXJPJIC-UHFFFAOYSA-N	441.919	1.669	50	20	IDGD	
COCCNC(=O)Cn1cc(NC(=O)NNc2ccc(Br)c(F)c2)cn1	771167045	BVIIGBMKRQCYIJ-UHFFFAOYSA-N	429.250	1.696	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1)[C@@H]1CCCCS1(=O)=O	772614896	PJLHUXLHTLEJQK-RTWAWAEBSA-N	441.553	1.728	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)[C@@H]1CN(C(=O)OC(C)(C)C)CCO1	772967569	OHXAKOCGTFNZKC-DOMZBBRYSA-N	427.885	1.891	50	20	IDGD	
Cc1ccc(I)cc1NC(=O)C(=O)NNC(=O)c1ccccc1O	773493219	XAOFDUXQRNWPDI-UHFFFAOYSA-N	439.209	1.705	50	20	IDGD	
O=C(NNc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(CC(=O)N2CCOCC2)cc1	773639422	PONQGXGJWDEYBB-UHFFFAOYSA-N	427.417	1.078	50	20	IDGD	
COC(=O)[C@H]1CCCCN1C(=O)c1cccc(NC(=O)C(=O)NNc2ccc(C#N)cc2)c1	773692277	BYAUBUABVYDFOJ-LJQANCHMSA-N	449.467	1.808	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)N[C@@H](CS(C)(=O)=O)c1ccccc1	774281065	BIQRFMKCQFPXLA-HNNXBMFYSA-N	437.543	1.904	50	20	IDGD	
CN(CC(=O)NNc1cccc(S(C)(=O)=O)c1)C(=O)c1ccc(Br)o1	776527069	KDSOURQRZSORFM-UHFFFAOYSA-N	430.280	1.661	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2c[nH]nc2-c2cnn(CC)c2)c2ccccc2c1=O	778296684	ZZHUZIZYZSGSPL-UHFFFAOYSA-N	434.460	1.488	50	20	IDGD	
CC(C)(C)OC(=O)N1CCCc2c(C(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)cccc21	778318630	QVJLQOSDLCSCQW-CYBMUJFWSA-N	437.518	1.570	50	20	IDGD	
CCNC(=O)CC(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2Cl)c1	780849128	JZLIVFKOCAKWJI-UHFFFAOYSA-N	438.893	1.428	50	20	IDGD	
COc1ccc(NNC(=O)c2ccc(Cl)c(S(=O)(=O)NC[C@H]3CCCO3)c2)nc1	781526946	KWDNUWYUVAFFEQ-CQSZACIVSA-N	440.909	1.958	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccccc2N2CCCC2)nc1	783263091	HGHNCFUKSMEXOZ-UHFFFAOYSA-N	446.533	1.450	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2ccc(C)c(S(=O)(=O)NC(C)(C)C)c2)nc(C)n1	783326527	IDSBMVJBAOPUFY-UHFFFAOYSA-N	434.522	1.560	50	20	IDGD	
CCCCn1ccnc1-c1cccc(NC(=O)C(=O)NN[C@@]2(C)CCS(=O)(=O)C2)c1	783424414	DNAAKJVUQCNNKB-FQEVSTJZSA-N	433.534	1.487	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2cccc(OCc3cccc(C#N)c3)c2)CCS(=O)(=O)C1	783424879	GFVAXOIEPIBBGP-OAQYLSRUSA-N	442.497	1.274	50	20	IDGD	
Cc1ccc(-n2nc(C(C)C)cc2NC(=O)C(=O)NNC(=O)C(=O)N2CCCC2)cc1	783999290	DBKBSHWCNIWGKU-UHFFFAOYSA-N	426.477	1.012	50	20	IDGD	
O=C(NNC(=O)C(=O)N1CCCC1)C(=O)Nc1cccc(Cl)c1Oc1cccnc1	783999291	DFDHHCWCCYWGGB-UHFFFAOYSA-N	431.836	1.236	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)C(=O)Nc2cccc(Oc3cnccn3)c2)c1	784841375	GPNGDTKEOVLAEI-UHFFFAOYSA-N	427.442	1.754	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)C(=O)Nc1cccc(Oc2ccncc2)c1	785061239	VBKUBOKBAUYFAU-UHFFFAOYSA-N	430.424	1.850	50	20	IDGD	
Cc1cc2c(Br)ccc(C(=O)NNC(=O)N[C@H]3CCS(=O)(=O)C3)c2o1	785537779	BVANHTJYGIVULK-VIFPVBQESA-N	430.280	1.635	50	20	IDGD	
CC(C)CN(C(=O)COC(=O)/C(C#N)=C/C1CC1)c1c(O)nc(=O)n(CC(C)C)c1N	786681393	USIPBHXUJAUTBI-VIZOYTHASA-N	431.493	1.579	50	20	IDGD	
Cc1ccc(CNC(=O)NNC(=O)C(=O)Nc2ccccn2)c(-n2cc(Cl)cn2)n1	786832704	ZEGSUUYVWNIMNV-UHFFFAOYSA-N	428.840	1.093	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)NCc1nc(-c2cccc(F)c2)no1	787408009	NKSQMOSLIPTAFM-UHFFFAOYSA-N	430.352	1.693	50	20	IDGD	
Cc1nc(Cn2nnc(C(=O)NNc3nc(-c4ccccn4)nc4c3CCC4)c2C)no1	787899178	QPCVJFIWRAGERM-UHFFFAOYSA-N	432.448	1.424	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2nc(C3CCC3)cs2)nc1	789747010	PYCBMHKOFBJUGC-UHFFFAOYSA-N	438.535	1.574	50	20	IDGD	
CCOC(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)c1	789819649	PXXGCEVEASDHPC-ICSRJNTNSA-N	439.468	1.451	50	20	IDGD	
O=C(CCSCc1nc(O)c2c3c(sc2n1)CCC3)NNC(=O)CN1CCCC1=O	789856529	HYZKGXCGXDOUMX-UHFFFAOYSA-N	449.558	1.279	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(C)c(C(=O)NNc2cccc(F)c2[N+](=O)[O-])c1	790588089	BAKNIFCPEMDGMY-UHFFFAOYSA-N	426.426	1.724	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cc([C@H]3CCCOC3)nn2C)c1C	790951853	MIXOURWUEBELLH-CVEARBPZSA-N	443.504	1.484	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)[C@](C)(O)Cn2cc(C(F)(F)F)ccc2=O)cc1C	792014538	JPWYZYLADXODJS-LJQANCHMSA-N	441.406	1.461	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@@H]3CCN(CC(F)(F)F)C3)CC2)cc1	792236974	DTQSBMOPIVCWBH-GOSISDBHSA-N	441.498	1.144	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2cccc(CCC(=O)OC(C)(C)C)c2)n1	792354896	MHWXSNANEUXCLQ-UHFFFAOYSA-N	443.504	1.560	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2ccc(Br)s2)cnc1C	793351442	COYZGHYRIJRBOK-UHFFFAOYSA-N	434.293	1.624	50	20	IDGD	
O=C(CCCS(=O)(=O)c1ccc(Cl)cc1)NNC(=O)[C@@H]1COc2ccccc2O1	794759218	HBSRVUAWYSBSRA-KRWDZBQOSA-N	438.889	1.881	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H](C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)C[C@H]2C[C@H]21	796033399	KJFGBZGFHLFIHV-OAGGEKHMSA-N	428.445	1.260	50	20	IDGD	
CCNC(=O)N(C)c1cccc(NC(=O)C(=O)NNC(=O)CCc2ccc(OC)cc2)c1	797002209	NUJFCOYUUIDEAS-UHFFFAOYSA-N	441.488	1.580	50	20	IDGD	
Cn1cc(-c2cc(F)ccc2NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)cn1	797003037	VCTCOGBDWBWTGC-UHFFFAOYSA-N	431.811	1.985	50	20	IDGD	
CC(=O)N[C@@](C)(C(=O)NNC(=O)c1cccc(Cl)c1)c1ccc(S(C)(=O)=O)cc1	797409756	MGRZJPXXRUPKQT-LJQANCHMSA-N	437.905	1.556	50	20	IDGD	
COCN1C(=O)CCc2cc(NC(=O)NNC(=O)COc3ccccc3[N+](=O)[O-])ccc21	801788343	SXDQNJAAPIEBOJ-UHFFFAOYSA-N	443.416	1.710	50	20	IDGD	
O=C1CN(c2ccnc(C(=O)NNC(=O)Nc3ccc(Br)cc3)c2)CCN1	801996878	PUOSVJPHQFNLQJ-UHFFFAOYSA-N	433.266	1.247	50	20	IDGD	
Cc1nn(C)c(C)c1S(=O)(=O)N[C@@H](C)C(=O)NNC(=O)Nc1ccc(Cl)cc1	802014764	WQQXFSPSUHGZSU-JTQLQIEISA-N	428.902	1.210	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@@H]2CCCC[C@H]2C(=O)N2CCCC2)cc1	802063862	RIQSZXDLNHGPNE-IAGOWNOFSA-N	436.534	1.672	50	20	IDGD	
CC(C)CNC(=O)N1CCC[C@H](C(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)C1	802068195	DUUMCGKXPJPCRC-AWEZNQCLSA-N	439.538	1.320	50	20	IDGD	
COc1ccc(-c2ccc(C)c(NC(=O)C(=O)NN[C@@]3(C)CCS(=O)(=O)C3)c2)cn1	802569598	VAODTXFPMRTKRZ-FQEVSTJZSA-N	432.502	1.202	50	20	IDGD	
O=C(NNC(=O)[C@H]1OCC[C@H]1c1ccccc1)C(=O)Nc1nc2c(s1)CSCC2	807067915	BURMFPKWAWRGKX-WFASDCNBSA-N	432.527	1.591	50	20	IDGD	
CN(C(=O)OC(C)(C)C)[C@@H](C(=O)NNc1nccc(N2CCOCC2)n1)c1cnn(C)c1	807076230	YMVRJRIRPVMFMB-MRXNPFEDSA-N	446.512	1.098	50	20	IDGD	
O=C(NC[C@@H]1CCCS(=O)(=O)C1)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1	807581290	UMAUGQQMGSQMJT-JTQLQIEISA-N	429.442	1.431	50	20	IDGD	
Cn1nnc2c1C[C@@H](C(=O)NNC(=O)[C@@H]1Cc3ccccc3CN1Cc1ccccc1)CC2	810273105	IMLSALPYZDSSMU-CVDCTZTESA-N	444.539	1.695	50	20	IDGD	
CC(C)CC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	810585739	GQHHKYQPVNJWTQ-KRWDZBQOSA-N	441.467	1.474	50	20	IDGD	
CNS(=O)(=O)c1ccc(Cl)c(C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)c1	812731478	MDRRMLPTQJGFON-UHFFFAOYSA-N	446.938	1.255	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)[C@H](CC(F)F)NC(=O)OC(C)(C)C)cc1	812732058	QLWGPDLKVDSLQA-ZDUSSCGKSA-N	436.481	1.929	50	20	IDGD	
CO[C@H]1C[C@@H](c2ccccc2)CCC1=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O	814785233	OCFKFPKSZJOTAO-HOCLYGCPSA-N	431.518	1.026	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2nc(CC(F)(F)F)cs2)cc1	815565391	MUHPZUFEEZJWRH-UHFFFAOYSA-N	432.380	1.421	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)[C@@H]2CCCN2c2ncnc3ccccc23)c2ccccc2c1=O	832810476	DFTQSHWFKAMQPK-SFHVURJKSA-N	443.467	1.307	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)c1csc(N2CCOCC2)n1	892846086	USMXQVCICOZZTP-AWEZNQCLSA-N	449.558	1.497	50	20	IDGD	
C[C@@H](Oc1ccc(Cl)cc1Br)C(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1	893188155	OUYSHLVKISLCFZ-RKDXNWHRSA-N	439.715	1.452	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)c2ccc(-n3ccnc3)nc2)cc1	899879904	LAKCOEONITZYKF-UHFFFAOYSA-N	434.485	1.763	50	20	IDGD	
COC(=O)NNC(=O)[C@@H](CCSC)NS(=O)(=O)c1ccc(Cl)c(Cl)c1	913176841	AJZYQJDNPRWIPO-LLVKDONJSA-N	430.335	1.781	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)CNS(=O)(=O)c1ccc(Cl)cc1	913462946	JTLYLBYGCDJBJN-UHFFFAOYSA-N	425.894	1.407	50	20	IDGD	
Cc1ccc([C@@H](CN2CCOCC2)NC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1	916216191	RELVAKJOXNPSAF-LJQANCHMSA-N	427.461	1.921	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NN=Cc1ccccc1O)N(S(C)(=O)=O)CC2	916355054	JBACRRMDOQEUIH-KRWDZBQOSA-N	447.513	1.809	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NCc2ccnc(OC3CCCC3)c2)c2ccccc2c1=O	916396415	PLFHYUQHWUMYOE-UHFFFAOYSA-N	436.472	1.794	50	20	IDGD	
COCCOc1ccc(CNC(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)cc1	916514154	AEKCMIWPYLSQEL-UHFFFAOYSA-N	437.522	1.620	50	20	IDGD	
COc1ccc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1O	916642212	SMSGXARAIOVHKA-UHFFFAOYSA-N	448.501	1.330	50	20	IDGD	
O=C(CN1CCOCC1)N1CCN(CCP(=O)(c2ccccc2)c2ccccc2)CC1	917085677	ZYIWXFQBXLDYRW-UHFFFAOYSA-N	441.512	1.477	50	20	IDGD	
O=C(CNC(=O)c1ccc(F)c(F)c1)NNC(=O)COc1ccc(Br)cc1	918278351	ZSJNVMFLRAEPDE-UHFFFAOYSA-N	442.216	1.684	50	20	IDGD	
N#CCOc1ccccc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	919807558	XBYBZEHUIFBZFI-UHFFFAOYSA-N	442.497	1.838	50	20	IDGD	
COc1cccc(C(=O)NNS(=O)(=O)c2ccc(C(=O)NCC(F)(F)F)cc2)c1O	919958403	IZUOFZRFENWGII-UHFFFAOYSA-N	447.391	1.316	50	20	IDGD	
O=C(NCc1cccc(C(=O)N2CCOCC2)c1)NNC(=O)c1cccc([N+](=O)[O-])c1	920812235	VXGRNHKIGBNMNU-UHFFFAOYSA-N	427.417	1.211	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C2=NN(c3ccc(F)cc3)[C@H](C(N)=O)C2)c1	935068560	GKESLFCQCUMAME-KRWDZBQOSA-N	427.436	1.089	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@@H](C)C(=O)NNC(=O)[C@@H]1CCCCN1S(C)(=O)=O	1337223246	RRFBRPIUGFTECQ-ZFWWWQNUSA-N	431.942	1.686	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3c(Cl)ccc4c3OCO4)C2)C1	1777802830	BYNAYMVYWCQQBY-YJYMSZOUSA-N	445.299	1.766	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H]1CC[C@@H]3CCC(=O)N3C1)C2)[C@@H](F)Cl	1778025203	NKZXGFNEGSTPOK-MGCCTARWSA-N	429.920	1.436	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(Cl)Cl)C2)c1nc2ncccn2n1	1778590151	PXOZXXLOYBCZFL-PIGZYNQJSA-N	427.292	1.056	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4nncn4c3)C2)C1	1778593200	FVNGDJFIAQSQJJ-FZKQIMNGSA-N	436.310	1.204	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3n[nH]c4ccc(F)cc34)C2)C1	1778623190	UQNJYWBBKFXYJU-ADLMAVQZSA-N	439.285	1.929	50	20	IDGD	
C=C[C@@H](O)C(C)(C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Br)C2	1779337861	DVJDOMLSBCPBRW-ZUMXRPEOSA-N	435.334	1.764	50	20	IDGD	
C=C(CC(=O)OCC)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](Br)CC)CCO2	1781271559	DSTNYOIRNAKGPS-RDTXWAMCSA-N	431.327	1.499	50	20	IDGD	
CC(=O)Nc1ccccc1C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781333934	ICAPTCPVEJDALW-YJBOKZPZSA-N	442.285	1.779	50	20	IDGD	
O=C(c1nc2ccc(F)cn2n1)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781335323	XNRAJCSDQAGNRR-WBMJQRKESA-N	444.236	1.002	50	20	IDGD	
CCCNC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)Br)C1	1781997527	ZTKMBXVXKMWTKK-SPYBWZPUSA-N	446.386	1.590	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1	1782004265	ARWOCGNLXYGTRE-QGZVFWFLSA-N	447.713	1.980	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnc(OCF)cn1)C2	1782170977	LQRTYWKUIZCOCD-ZBQZNYHESA-N	444.891	1.164	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)n1ccccc1=O)C2	1782175694	PCRMBHKFRNETGW-ZGPJWRFFSA-N	439.940	1.177	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CC2(O)CCC2)C1	1782783143	YFDRVBKPSRFKSS-HDMKZQKVSA-N	431.371	1.979	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccnc(C(F)(F)F)c3)CCO2)C1	1783873051	JCWLSKPGZKGROP-SUMWQHHRSA-N	435.830	1.798	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cc(-c4cccnc4)[nH]n3)CCO2)C1	1783877474	JEVOTKCOMOKNCM-MGPUTAFESA-N	433.896	1.169	50	20	IDGD	
Cc1ccc(SCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]3C2)cc1	1784091848	DWKJPHCPKKRRHL-OWLYRPNTSA-N	426.966	1.667	50	20	IDGD	
O=C([C@H](O)CCl)N1CCO[C@]2(CCN(C(=O)[C@@H]3CCCN3Cc3ccccc3)C2)C1	1784239053	PBVGIMSELLVQPM-JQVVWYNYSA-N	435.952	1.081	50	20	IDGD	
CC(C)(C(=O)N1CC[C@]2(CN(C(=O)[C@H](F)Br)CCO2)C1)c1ccccn1	1784276109	LTGBARCNNVIZDZ-KSSFIOAISA-N	428.302	1.880	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3(F)CC3)C[C@@H]21	1785078877	CPICWIAGBWTANH-AJNGGQMLSA-N	447.935	1.600	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(S(C)(=O)=O)c(F)c3)C2)C1	1785227334	JOGVLDFJVSXJTO-AUUYWEPGSA-N	446.928	1.690	50	20	IDGD	
CC(C)(C)n1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Br)C[C@@H]32)cn1	1785620987	YCZVXDLTOSWIFW-CYUUQNCZSA-N	445.333	1.922	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc(N(C)C)o3)[C@H]2C1	1785886941	VARCVJFOUYEZCF-XUXIUFHCSA-N	443.342	1.507	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cn3cc(C)cn3)[C@H]2C1	1787116991	BGCCNGOFFVHGHT-VGWMRTNUSA-N	427.343	1.345	50	20	IDGD	
C[C@H](NC(=O)c1ccccc1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]2C1	1787451474	SMGIDMITROEFPY-SRQBIAJPSA-N	425.888	1.319	50	20	IDGD	
C[C@@H](Nc1nccs1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CO[Si](C)(C)C)C[C@@H]21	1787487106	QYAYIDVWYUTUMT-UGUYLWEFSA-N	440.642	1.775	50	20	IDGD	
CN(C)c1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Br)C[C@@H]32)cn1	1789027414	SEOJNLNWWFPMLA-RZLSGREXSA-N	443.317	1.431	50	20	IDGD	
CC[S@](=O)CCC(=O)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1	1789420302	RNLYAVQXGFQCBA-HKBQPEDESA-N	442.346	1.273	50	20	IDGD	
C=C(CC(=O)OCC)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]2C1	1789871973	KJBXPKDTWILGTA-XLPNERPQSA-N	435.348	1.712	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/c3cnccn3)C[C@@H]21)[C@H](F)Br	1789927302	UHHGUBNOQOQOJC-OTNOIYACSA-N	427.274	1.160	50	20	IDGD	
Cn1nc2c(c1C(=O)NC[C@@H]1OC[C@@H]3CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]31)CCC2	1790462905	IHRPTHAICXIWAV-VOOFSGFHSA-N	443.375	1.738	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](O)C(=O)Nc1ccc(C2(NC(=O)[C@H](O)CCl)CCC2)cc1	1790729016	CPOZOJCSHOGFLI-RHSMWYFYSA-N	441.912	1.563	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc(N(C)C)o3)C[C@@H]21	1791057375	UDDXDZADZRKVMT-CYDGBPFRSA-N	429.315	1.117	50	20	IDGD	
Cc1ccc(CCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]3C2)cc1	1791293072	IBXWONPXGOKAMS-ACRUOGEOSA-N	444.576	1.280	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1ccc(C2(NC(=O)C[C@](C)(O)CC(=O)O)CCC2)cc1	1791573028	XAHXIHOJOOMGQL-KXBFYZLASA-N	426.897	1.990	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)c1ccccc1OC(F)F	1792029193	YDKCXBVZCPOYMC-ZIEJDFEHSA-N	432.851	1.481	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)NC(=O)c1ccccn1)C2	1793453699	RTJBHGAMJUGGIR-RPUYLAQPSA-N	436.940	1.197	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ncccn1	1795187650	MDJCQFJBGGHSHA-QDMKHBRRSA-N	439.428	1.876	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1ccc2cccnc2n1	1797358973	QDSLZZVDUXAIOF-AYRXBEOTSA-N	437.269	1.524	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C1\C(=O)Nc3ccccc31)C2	1797956931	PDZFMRKMWUJCKK-WFCLCVJDSA-N	443.576	1.463	50	20	IDGD	
CC(C)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(=O)nc2sccn12	1798412253	PNFVRNWVJGRUNJ-JJLQDPRZSA-N	438.937	1.224	50	20	IDGD	
CCc1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C3)nn1C	1799006300	HCAVXPHGAQJMQQ-YVLAOCGESA-N	439.520	1.368	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](C)CC(N)=O)C2	1799219216	BENHBSLVCHVTES-REBRKWNGSA-N	446.460	1.283	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(OC)c(NC(C)=O)c1)C2	1799268702	FOODSKMEJLVVNC-RCJHGTSTSA-N	437.924	1.874	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CC13CCCN1CCC3)C2	1799277091	SRNOMOGBMYRTAM-HIRMHNASSA-N	432.392	1.831	50	20	IDGD	
C[C@@H](Nc1nccs1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Br	1799347577	QFSMBMAQIVJKLM-ZIQFBCGOSA-N	435.319	1.224	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c(F)ccc(O)c1F)C2)[C@H](F)Br	1799348691	MYCIDXUXJUFPKS-NVIQENEESA-N	437.212	1.564	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3n(n1)CCCC3)C2)[C@@H](F)Br	1799349852	MBSXDBCPCAWWAR-BAESOJJISA-N	429.290	1.113	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(-n2cccn2)cc1	1800488810	OWCVCIQYAXOAQI-FNLKRUPLSA-N	438.532	1.497	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](N)c1cccc(Cl)c1)C2	1800757065	UETQQYFAZIIMJH-APDPGRRMSA-N	444.757	1.713	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1occc1Br)C2	1800978153	MLJYRHNKCLVURZ-LYIQGSDWSA-N	435.702	1.499	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccnc1CS(C)(=O)=O)C2	1802272536	ABFRTTRNUXXCJN-HLPPOEQASA-N	443.953	1.132	50	20	IDGD	
CN(C)C(=O)NCC(=O)NC[C@@H]1CCN(C(=O)CO[Si](C)(C)C)[C@@H]1c1cccnc1	1802679264	HHNYQZRVAZPYGO-QFBILLFUSA-N	435.601	1.210	50	20	IDGD	
CN(CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1(F)CCC1)NC(=O)NCc1ccccc1	1803431128	GWYMADKKCIZLCK-REPLKXPHSA-N	445.539	1.863	50	20	IDGD	
CC(=O)N(C)CCC(=O)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@H]1c1cccnc1	1804073523	QJPQVBXMNVZRJX-XIRDDKMYSA-N	443.317	1.646	50	20	IDGD	
CN(C)c1cncc(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)c1	1804848835	VEMGQQMAVBZKGV-SNRMKQJTSA-N	431.924	1.462	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2ccc(F)cn2)[C@@H]1c1cccnc1	1805985668	DKSXSEVWSSBPRL-IERDGZPVSA-N	442.495	1.308	50	20	IDGD	
CCOC(=O)/C=C/C(=O)N1CC[C@H](CNC(=O)CCBr)[C@H]1c1cccnc1	1806339472	MPVADAMOTIIAEX-XWMIQMMGSA-N	438.322	1.992	50	20	IDGD	
CC(=O)N(C)CCC(=O)N1CC[C@@H](CNC(=O)CCBr)[C@H]1c1cccnc1	1806343276	TZBINBGCLREYAZ-QFBILLFUSA-N	439.354	1.741	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H](CNC(=O)CNCP(=O)(O)O)[C@H]1c1cccnc1	1807018784	QKCVTIYWBHKFQC-GDBMZVCRSA-N	446.872	1.077	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1807359003	CFYJIGBDXUUTHT-PKOBYXMFSA-N	443.740	1.346	50	20	IDGD	
O=C(c1ccc2c(c1)COC2)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1	1809978795	RKKAEJBIPKKFJR-UHFFFAOYSA-N	448.328	1.555	50	20	IDGD	
Cc1cc(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)ccn1	1810788230	VKIBWBVFHLFSFQ-IFMALSPDSA-N	444.300	1.098	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2ccnc(F)c2)[C@H]1c1cccnc1	1813069219	WDZBSUVIDHOZBE-UTKZUKDTSA-N	442.495	1.308	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)C#Cc2ccccc2)[C@H]1c1cccnc1	1813071391	PGZRZQDRHYEZMK-BWKNWUBXSA-N	447.539	1.512	50	20	IDGD	
Cc1nc(C(=O)N2CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)co1	1813071795	XRSCNFVUIOBHAM-JXFKEZNVSA-N	428.493	1.071	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)CN3CCNC3=N)sc2C1	1814927974	QDFXBFCWHYNPJS-NXEZZACHSA-N	443.371	1.069	50	20	IDGD	
CC[C@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1)N(CC)CC	1815333417	MJKYAXYVROMLDP-MSOLQXFVSA-N	449.600	1.895	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)C2CCC(CO)CC2)n[nH]1	1815688406	JARVFQDVNLDENI-LEOMRAHMSA-N	448.568	1.574	50	20	IDGD	
CN1C(=O)CC[C@H]1C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCBr)n[nH]1	1816783098	DGVRSGDGFSJWDU-STQMWFEESA-N	426.315	1.808	50	20	IDGD	
CCc1nc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)co1	1817472580	XKUJUYNQHPLBGT-QGZVFWFLSA-N	437.265	1.260	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CS(=O)(=O)N2CCCC2)n[nH]1	1818108969	HVUPDICOEYUPJS-DZGCQCFKSA-N	445.973	1.845	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@H](F)Cl)[nH]n1)c1cc2n(n1)CCCNC2=O	1818975312	JMEKOEYLRCQKSN-WFASDCNBSA-N	437.863	1.580	50	20	IDGD	
CCNC(=O)N[C@@H](C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CO[Si](C)(C)C)n[nH]1	1819595327	HSPSWGJHAYAWPF-ZFWWWQNUSA-N	438.605	1.961	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CNC(=O)N(C)C)CC1	1824090281	ZYEXKAMXMACLPK-GOEBONIOSA-N	445.402	1.908	50	20	IDGD	
N[C@@H](Cc1cscn1)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)CC1	1824183163	PVMORODGGDBECS-ULQDDVLXSA-N	428.986	1.232	50	20	IDGD	
CCC(C)(C)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnccc1C(=O)NN)CC2	1825153573	NPMCMICCBZQMTK-NSHDSACASA-N	430.534	1.804	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)CN3CCCCC3=O)sc2C1	1825868010	NCIWRIJBLKVLNF-WDEREUQCSA-N	443.367	1.851	50	20	IDGD	
CSCC[C@H](O)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](F)Br)CC2	1826134309	ZKGGVHZGPDUCIV-POZPLHJXSA-N	440.360	1.860	50	20	IDGD	
COC(=O)CCCCCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)CCl)CC2	1826232192	SZFVGOFEFKGKOI-YPMHNXCESA-N	431.942	1.778	50	20	IDGD	
CC(=O)N1CCC([C@@H]2CCCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)CC1	1830165918	NWGMDIHCKQONSO-NRFANRHFSA-N	429.565	1.972	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(Cl)cnc3O)C2)C1	1830352333	LBRFXOPEGZHZMQ-LJQANCHMSA-N	446.331	1.776	50	20	IDGD	
CN1CCCC[C@H]1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1	1830773027	OTYCXUOYVHFNDX-KFKAGJAMSA-N	436.380	1.163	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3sccc3F)CCO2)C1	1831922823	OZYYFKZPIKYUGT-MEDUHNTESA-N	435.315	1.741	50	20	IDGD	
O=C(C(=O)N1CCOC[C@]2(CN(C(=O)CCBr)CCO2)C1)c1ccccc1	1834818927	FYZOHVUEKKAALT-IBGZPJMESA-N	439.306	1.111	50	20	IDGD	
Cc1nnsc1C(=O)NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1	1835183150	SESQWPMSNUJKKU-UHFFFAOYSA-N	444.399	1.817	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CNc3ccccc3C)CCO2)C1	1835866914	MVDPKSCXCQTOKU-UWJYYQICSA-N	439.940	1.117	50	20	IDGD	
Cc1cccc(CC(=O)N2CCOC[C@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)n1	1837708331	DFKLCECPZGNXOS-OAQYLSRUSA-N	435.597	1.240	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3[C@H]4C=CS[C@H]43)C2)C1	1837715793	JUKVOPLRBOMWAC-KLICCBINSA-N	426.611	1.169	50	20	IDGD	
C[C@@H]1CCC[C@@H]1C(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1	1837920176	GCYNFIHHIBCFKT-VGSWGCGISA-N	442.365	1.415	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(C)ccc3O)CCO2)C1	1838894426	SIYCHQDHQOTTCJ-OXJNMPFZSA-N	426.897	1.024	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3nc(C)sc3C)C2)C1	1839142255	LAVVLGZLOPIZFD-DNVCBOLYSA-N	429.970	1.776	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccnc3S)C2)C1	1839149512	JJMKJNWPTCQYFV-ZWKOTPCHSA-N	448.372	1.677	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4n(n3)CCC4)C2)C1	1839152496	AZBBWWRXXXYCHW-RBUKOAKNSA-N	445.347	1.136	50	20	IDGD	
Cc1cc(F)cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)c1	1839284656	FMAMCISKJMVCTJ-MAUKXSAKSA-N	447.276	1.895	50	20	IDGD	
O=C(c1cccc(-c2cnco2)c1)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1	1839365032	WMPFNBYKSRAIIO-DYESRHJHSA-N	449.891	1.011	50	20	IDGD	
O=C(C(Cl)Cl)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CCc3ccccc3O1)CCO2	1840139289	NVMLGXVNRUHTJL-OXJNMPFZSA-N	443.327	1.640	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CC=CC[C@@H]1C(=O)OC)CCO2	1840143562	YAQGACDLIHOUKI-MXTNKPTQSA-N	442.940	1.216	50	20	IDGD	
CCc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](Cl)COC)CCO3)cc(C)n1	1840152770	SLTBNBVYNYOJNI-NQIIRXRSSA-N	439.940	1.276	50	20	IDGD	
O=C(c1cc2n(n1)CCCC2)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840188672	WPNZQFRONKOZKS-SFHVURJKSA-N	431.320	1.093	50	20	IDGD	
CC(C)N1CCC[C@H]1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)Br)C2)C1	1840584946	OHXINJRQBBOANK-TXPKVOOTSA-N	446.386	1.099	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCCC12CN(C(=O)c1csnn1)C2	1841924118	WSOQRBZDZYYGJT-NSHDSACASA-N	429.930	1.487	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H]2OC[C@@H](C(=O)N3CC4(CCCN4C(=O)[C@H](F)Cl)C3)[C@H]2C1	1843366537	DHLKDQUZQLZYBT-TUVASFSCSA-N	445.919	1.606	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)[C@@H]1[C@H]3Sc4ccccc4[C@H]31)C2	1844264483	XSXFLEIFSGAOBJ-FHWLQOOXSA-N	449.536	1.390	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)[C@H]2CCc3cccc(Cl)c32)C1	1845865532	PAIRHPPRFMESOG-SFHVURJKSA-N	438.720	1.567	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@H](C)NC(=O)c1ccc(F)cc1)C2	1846363372	FNKKHWHLWCPTIJ-CJNGLKHVSA-N	425.888	1.401	50	20	IDGD	
CCc1nc2ccc(Cl)cn2c1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl	1847560332	QOTKDFLYAQZRIF-KKUMJFAQSA-N	425.316	1.965	50	20	IDGD	
CCn1c(NNC(=O)CCNS(=O)(=O)/C=C/c2ccccc2)nc2ccccc2c1=O	9857517	WCDCSTZHFUCOAI-FYWRMAATSA-N	441.513	1.840	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)CCn2cnc3sccc3c2=O)c2ccccc2c1=O	14044417	KOVZBSCLJYGAEV-UHFFFAOYSA-N	438.469	1.039	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)c1ccc2c(=O)n(-c3ccccc3)c(=O)[nH]c2c1	16225203	JGOLWZAVKGPLNG-UHFFFAOYSA-N	448.410	1.658	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CSc2nnnn2C2CCCC2)cc(OC)c1OC	16371739	OYTJVFHSRBVZPI-UHFFFAOYSA-N	436.494	1.367	50	20	IDGD	
O=C(CSc1nnnn1-c1ccc(Cl)cc1)NNC(=O)c1cccc([N+](=O)[O-])c1	20817969	RMHYBANPICCJOJ-UHFFFAOYSA-N	433.837	1.777	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2ccc(COc3ccccc3)o2)cnn1-c1ccc(O)nn1	29926376	CSQQLCMNLUPYLV-UHFFFAOYSA-N	434.412	1.923	50	20	IDGD	
Cc1noc(C)c1CSCC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	36321746	BLDGGRSNGGCLRJ-UHFFFAOYSA-N	426.520	1.236	50	20	IDGD	
CC(C)NC(=O)C(=O)NNC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)c1ccc(Cl)cc1	726155801	BONFXNDLKIICPW-XIRDDKMYSA-N	434.924	1.785	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1F	726437445	GJMSGPKEYOJQFQ-UHFFFAOYSA-N	440.522	1.781	50	20	IDGD	
CC(=O)N1CCN(CCOc2ccc(CCNC(=O)NNC(=O)OC(C)(C)C)cc2)CC1	728134048	GUNRUYWNPPZUFH-UHFFFAOYSA-N	449.552	1.511	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@H]2COc3c(cccc3OC)C2)c2ccccc2c1=O	728398866	KNMLRZLLULWZPX-CQSZACIVSA-N	437.456	1.373	50	20	IDGD	
N#Cc1ccc(SCC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1	728455561	KWZZATFXUGMJMG-UHFFFAOYSA-N	444.538	1.896	50	20	IDGD	
CNC(=O)c1ccc(C(=O)NNc2ccc(S(=O)(=O)Nc3ccccc3)cc2)cn1	728607036	VPKTUTIQNZBXRN-UHFFFAOYSA-N	425.470	1.999	50	20	IDGD	
C[C@@H](NC(=O)c1ccc(Cl)cc1)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	728889761	PHBJNVMMZZCRHT-CYBMUJFWSA-N	430.896	1.312	50	20	IDGD	
COc1ccccc1N1CCN(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)CC1	728958063	QKCNCLPJNAUNHH-UHFFFAOYSA-N	439.520	1.265	50	20	IDGD	
CC(=NNC(=O)c1ccccc1O)c1cccc(N(S(C)(=O)=O)S(C)(=O)=O)c1	729818552	XMVATGLGBZCUFP-UHFFFAOYSA-N	425.488	1.272	50	20	IDGD	
N#C/C(=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)N1CCO[C@@H](C#N)C1	729979280	DDWIRQOERWIVNH-YHTSIIMFSA-N	438.875	1.737	50	20	IDGD	
COc1ccccc1C/C(C)=C/C(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1	730206211	WEYKTRIROALQBC-SAPNQHFASA-N	445.541	1.961	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2ccc(N3CCOCC3)c(F)c2)c2ccccc2c1=O	730206343	XWFAZPUERQKKDZ-UHFFFAOYSA-N	439.447	1.467	50	20	IDGD	
CC(=NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1ccc(S(=O)(=O)N2CCCCC2)cc1	730576393	QOPRVAKDNARMPF-MRXNPFEDSA-N	427.548	1.136	50	20	IDGD	
CN(CCN1CCN(CC(=O)NNC(=O)c2ccccc2Cl)CC1)Cc1ccccc1	731212697	CIURJIHFTKBRPK-UHFFFAOYSA-N	443.979	1.851	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)c(F)cc1F	732045345	ILFOEUJNBJRFFW-UHFFFAOYSA-N	441.412	1.316	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2nn(-c3ccc(F)cc3)c3c2CCC3)C[C@H](C)O1	732261655	OECKOHFXYYIMOG-GJZGRUSLSA-N	429.496	1.760	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2ccc(N3CCC(O)CC3)cc2)c2ccccc2c1=O	733884664	FYDNMUQFZNENRC-UHFFFAOYSA-N	449.511	1.842	50	20	IDGD	
CCc1ccccc1OCC(=O)NNS(=O)(=O)c1ccc(OC)c(C(=O)N(C)C)c1	734419334	PCWMOSLUUDEQCD-UHFFFAOYSA-N	435.502	1.348	50	20	IDGD	
Cc1cc(C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)nn1C(C)(C)C	735117947	JVMSCKNQQJULNX-UHFFFAOYSA-N	435.554	1.035	50	20	IDGD	
Cc1cccc(NS(=O)(=O)c2cc(C(=O)NNC(=O)c3cnn(C)c3)ccc2C)c1	735473501	YKEXFKQTGRGVFW-UHFFFAOYSA-N	427.486	1.913	50	20	IDGD	
O=C(NCCNc1nccc(C(F)(F)F)n1)NNC(=O)c1ccc2c(c1)OCCO2	739045367	KHKJLHWVIKIKDX-UHFFFAOYSA-N	426.355	1.323	50	20	IDGD	
O=C(NC[C@H](O)c1c(F)cccc1Cl)NNC(=O)c1csc(N2CCOCC2)n1	741267048	PYJLSNTXIZXDJN-ZDUSSCGKSA-N	443.888	1.450	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)c1cc(NC(C)=O)c(OC)c(OC)c1	742470449	FNTLXLJKUQMGMS-UHFFFAOYSA-N	431.445	1.901	50	20	IDGD	
O=C(CCc1nc2cc(Br)ccc2s1)NNC(=O)[C@@H]1CCS(=O)(=O)C1	742491300	RXUHIMNHYJRUFK-SECBINFHSA-N	446.348	1.574	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@H](C(=O)NNC(=O)CNC(=O)c1cccs1)c1ccccc1	742613198	PPCYPGDDEMPFCN-HNNXBMFYSA-N	446.529	1.934	50	20	IDGD	
C[C@@H](CN1CCN(c2ccccc2)CC1)NC(=O)NNC(=O)COCc1ccccc1	743624613	MMGIPKPYMWQJMX-IBGZPJMESA-N	425.533	1.744	50	20	IDGD	
CCc1ccc(N2C[C@H](C(=O)OCC(=O)NNC(=O)c3cccc(C#N)c3)CC2=O)cc1	744499561	XVSHIAQTXLFIJV-GOSISDBHSA-N	434.452	1.478	50	20	IDGD	
CC(C)(C)OC(=O)N1CCCC[C@@H]1C(=O)OCC(=O)NNC(=O)c1cccc(C#N)c1	744885120	ZZBFJDXWEFDXSL-MRXNPFEDSA-N	430.461	1.652	50	20	IDGD	
Cc1cc(N2CC[C@@H](NC(=O)NNC(=O)CC34CC5CC(CC(C5)C3)C4)C2=O)n(C)n1	745907103	YLUFXQSQQUVRMT-GOWZHPGHSA-N	428.537	1.771	50	20	IDGD	
CCSCC[C@@H](C)NC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	745922263	COKUNQAAYGZEOQ-CQSZACIVSA-N	428.580	1.947	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@@H](C)c2cccc(C#N)c2)cc1	745922851	BPDQHUAGZAKOID-HNNXBMFYSA-N	429.502	1.579	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2c(C)cc(=O)n(CC(=O)NC(C)C)c2C)cc1OC	746092280	IIMJCPJBXRGASD-UHFFFAOYSA-N	444.488	1.082	50	20	IDGD	
C[C@H](C(=O)NNC(=O)c1cc2c(s1)CCCCC2)N1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O	746099515	ABXBNQDBUVRVPY-MXNCWBMWSA-N	431.514	1.329	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)CSCc3cscn3)cc2)CC1	747591591	BQHPJSJVIJHVKI-UHFFFAOYSA-N	441.604	1.456	50	20	IDGD	
COc1ccc(Br)c(S(=O)(=O)NNC(=O)c2ccc3c(c2)OCCO3)c1	747601208	JTOOVCKFRZPTIF-UHFFFAOYSA-N	443.275	1.852	50	20	IDGD	
CC(=O)N1CCCc2cc(S(=O)(=O)NNC(=O)c3c(C)nc4ccccn34)ccc21	747846243	KHZRUWVJOYGNLW-UHFFFAOYSA-N	427.486	1.565	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(OCC(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)C1	748038629	LBMZQQYGSDRGKT-UHFFFAOYSA-N	440.522	1.206	50	20	IDGD	
O=C(NNC(=O)C(=O)N1CCCC1)NC1CCN(c2ccc(C(F)(F)F)cn2)CC1	748444638	LDMCXXGEVIFPRN-UHFFFAOYSA-N	428.415	1.022	50	20	IDGD	
C[C@@H](CC(N)=O)NC(=O)/C(C#N)=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	748719522	PEVLSKRPKBRAOJ-CJAAZZPWSA-N	428.880	1.366	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)[C@@H]1CCN(C2CCCCC2)C1	748855649	AJXAILMHUHMBKX-QGZVFWFLSA-N	436.578	1.805	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cnc(-c3ncccn3)s2)cc1OC	750193826	HSIADDWZJWKDJF-UHFFFAOYSA-N	443.441	1.235	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)N[C@@H]2CC(=O)N(C(C)(C)C)C2)c2ccccc2c1=O	750659623	IVKCTOYUEARLAF-CYBMUJFWSA-N	428.493	1.321	50	20	IDGD	
O=C(NN=Cc1cc(O)ccc1[N+](=O)[O-])c1cccc(S(=O)(=O)N2CCOCC2)c1	751131207	MSRMGQOLWYZFSO-UHFFFAOYSA-N	434.430	1.085	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)c2c3c(cc([N+](=O)[O-])c2[N+](=O)[O-])OCCO3)c1	751213111	QRRCTNFWNVKUMY-UHFFFAOYSA-N	431.361	1.415	50	20	IDGD	
Cc1oc(C(=O)NNC(=O)CCSc2ccc(F)cc2)cc1S(=O)(=O)N(C)C	753563793	CGAUBKDVZFJMNM-UHFFFAOYSA-N	429.495	1.921	50	20	IDGD	
COC(=O)c1cc2c(cc1NC(=O)C(=O)NNC(=O)C13CC4CC(CC(C4)C1)C3)OCO2	753840155	HFOMVJDOSPAYJT-UHFFFAOYSA-N	443.456	1.504	50	20	IDGD	
Cc1cc(S(N)(=O)=O)cc(NC(=O)COC(=O)/C(C#N)=C\c2ccc(O)cc2)c1C	754549757	NKSDBNHRSGOCJY-NVNXTCNLSA-N	429.454	1.745	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2cc(OC)ccc2Br)c(C)o1	754749630	VGKONHNGSSOLDL-UHFFFAOYSA-N	447.263	1.769	50	20	IDGD	
C[C@H](CS(=O)(=O)c1ccc(F)cc1)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	755285164	IEYVVGOKCOMPTK-CQSZACIVSA-N	449.508	1.090	50	20	IDGD	
COc1ccc(S(=O)(=O)NC2CC2)cc1NC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	755615744	UWYWSROLTRBUHL-UHFFFAOYSA-N	449.445	1.511	50	20	IDGD	
Cc1nn(C)c(OCC(F)(F)F)c1C=NNC(=O)C1CCN(c2ncccn2)CC1	756826376	HWRNPUCOWVVIOD-UHFFFAOYSA-N	425.415	1.826	50	20	IDGD	
CCCCN1C(=O)CC[C@H](C(=O)NNc2ccc(C(N)=O)nn2)[C@H]1c1ccc(OC)cc1	757408040	PAFVFFRCOKJWGE-OXJNMPFZSA-N	440.504	1.807	50	20	IDGD	
CC(C)n1c(C(F)(F)F)nc2cc(C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)ccc21	758045139	BMQVWORKFZABLA-VIFPVBQESA-N	435.428	1.335	50	20	IDGD	
O=C(c1cnc(S)n1-c1ccccc1)N1CCN(S(=O)(=O)CBr)CC1	758535804	SHARKVUDRLCYFC-UHFFFAOYSA-N	445.364	1.601	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)NC[C@@H]3CSCCN3Cc3ccccc3)nc21	759321599	MXYZLJPVWRCCAK-CQSZACIVSA-N	428.522	1.313	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc2c(c1)COC2)NNC(=O)c1ccc2ccccc2c1	759720040	VIUOCWBUMUSNFQ-UHFFFAOYSA-N	425.466	1.610	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)CSc2ccc3c(c2)OCCO3)n1	760098575	WZKXXDDLBSCTRC-UHFFFAOYSA-N	437.499	1.248	50	20	IDGD	
CCCCS(=O)(=O)NCC(=O)NNC(=O)c1cc(-c2ccco2)nc2ccccc12	761135318	HKAYQYIPUXLOHH-UHFFFAOYSA-N	430.486	1.975	50	20	IDGD	
O=C(NNc1nccc(N2CCOCC2)n1)C1CCN(c2ccc3cccc(O)c3n2)CC1	762859387	AFHBNHCWWNPVMU-UHFFFAOYSA-N	449.515	1.927	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C2=NOC3(CCN(C(=O)OC(C)(C)C)CC3)C2)n1	763283433	JURUDSZYIAEPKN-UHFFFAOYSA-N	434.497	1.193	50	20	IDGD	
COC(=O)c1cc(C(C)C)ccc1NC(=O)C(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	763446890	XYSQAFQUBQPLIR-UHFFFAOYSA-N	428.401	1.905	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cnc3c(cnn3C(C)C)c2)cc1OC	763543753	OLJHYJRITFGGDQ-UHFFFAOYSA-N	426.433	1.429	50	20	IDGD	
CCCS(=O)(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2ccccc2F)c1C	763574630	HDMFHYCPEVMBOJ-UHFFFAOYSA-N	436.465	1.686	50	20	IDGD	
CCOCCCNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2ccccc2F)c1	763575080	PRGNYKQZSOBWMN-UHFFFAOYSA-N	430.436	1.382	50	20	IDGD	
CCCCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2cc(C)oc2C)cc1	763587527	YDADVGJVZQDDNP-UHFFFAOYSA-N	436.490	1.838	50	20	IDGD	
CN1CCc2ccc(NC(=O)C(=O)NNC(=O)c3cc(-c4ccccc4)[nH]n3)cc2C1=O	763604213	IKYPOGFEHWITPN-UHFFFAOYSA-N	432.440	1.105	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2Cc2ccccc2)ncn1	763718853	OWPSNIJTSJGNLD-UHFFFAOYSA-N	435.440	1.241	50	20	IDGD	
COCCOc1ncccc1NC(=O)C(=O)NNC(=O)CSc1ccc(Cl)cc1	763732338	BXLLFYLRAIWJBM-UHFFFAOYSA-N	438.893	1.638	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2cccc3ccccc23)c2ccccc2c1=O	763785102	DTLRXSTUIARULF-UHFFFAOYSA-N	429.436	1.969	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)cnn1-c1ccccc1	763865191	JINYYWVVAKFBJY-CQSZACIVSA-N	425.420	1.873	50	20	IDGD	
CCS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)cc1	763865241	NZIDCTPDKRVDND-GFCCVEGCSA-N	437.449	1.173	50	20	IDGD	
CC(C)(C)n1cnc(NC(=O)C(=O)NNC(=O)c2ccc(COc3ccccc3)o2)n1	763955156	IIGOPNNGDGQNBX-UHFFFAOYSA-N	426.433	1.605	50	20	IDGD	
Cc1cccc(Oc2ccccc2NC(=O)C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)c1	763996965	HJYVSWNTRPLXRP-CQSZACIVSA-N	431.470	1.308	50	20	IDGD	
CCN(CC)C(=O)c1ccccc1NC(=O)C(=O)NNC(=O)c1ccc2c(c1)OCCO2	764004214	MTVPSLVECDACAY-UHFFFAOYSA-N	440.456	1.340	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cnccn2)n(-c2cccc(Br)c2)n1	764024488	KWIFMLLAMYMTGK-UHFFFAOYSA-N	444.249	1.133	50	20	IDGD	
O=C(Cc1cccc2ccccc12)NNC(=O)C(=O)Nc1cccnc1N1CCOCC1	764037429	WQJGGCKTKNCFPZ-UHFFFAOYSA-N	433.468	1.400	50	20	IDGD	
CC[C@H](C)C(=O)NNC(=O)C(=O)Nc1cnc2c(c1)C[C@H](NC(=O)OC(C)(C)C)CC2	764082480	NQIQOCAUAZKXAN-GXTWGEPZSA-N	433.509	1.596	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2ccc(C)cc2O)ccc1N1CCCC1=O	764105400	QZVGSKHCSSZGIS-UHFFFAOYSA-N	426.429	1.236	50	20	IDGD	
Cc1cc(C(=O)N2CCCC2)ccc1NC(=O)C(=O)NNC(=O)c1ccc(Cl)cc1O	764126004	DIQILLAUPKHEIL-UHFFFAOYSA-N	444.875	1.990	50	20	IDGD	
CCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(CN(CC)CC)o2)c(C)c1	764139327	SDOVHQGSRCWKRU-UHFFFAOYSA-N	443.504	1.579	50	20	IDGD	
CN1CCN(C(=O)c2ccc(NC(=O)C(=O)NNC(=O)CCC3CCCCC3)cc2)CC1	764217975	KLVYMVSMQSJDPA-UHFFFAOYSA-N	443.548	1.521	50	20	IDGD	
CCc1cc(O)nc(-c2cccc(NC(=O)C(=O)NNC(=O)c3cccc(C#N)c3)c2)n1	764234832	KZNFLHAGFPXWJD-UHFFFAOYSA-N	430.424	1.683	50	20	IDGD	
Cc1cc(C)c(NC(=O)C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c(Cl)c1	764265888	GPDSGXQPLYGLQA-UHFFFAOYSA-N	430.896	1.749	50	20	IDGD	
O=C(NNC(=O)c1cc(F)ccc1Br)C(=O)Nc1cnn(-c2ccncc2)c1	764278676	VXILERIKGPLOCN-UHFFFAOYSA-N	447.224	1.569	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2cc(Br)ccc2O)cc1F	764280226	KURAYYNIUJVKPI-UHFFFAOYSA-N	426.198	1.702	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C(=O)Nc1ccc(OC)c(-n2nnnc2C)c1)c1ccccc1	764329906	QQGMDHFSJSHHRG-INIZCTEOSA-N	437.460	1.259	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)cc1F	764349309	IPOUWSCOWRTDSB-UHFFFAOYSA-N	425.800	1.610	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2cccs2)[nH]n1)C(=O)Nc1ccnn1CCc1ccccc1	764382981	TYXUPWOQWSVFHA-UHFFFAOYSA-N	449.496	1.977	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)[C@@H](C)NS(=O)(=O)c2ccc(C#N)cc2)cc1OC	764576099	ZAZPVWWLMISCHY-CYBMUJFWSA-N	446.485	1.094	50	20	IDGD	
O=C(CCC(=O)N1CCN(c2ccccn2)CC1)NNC(=O)c1cc(-c2ccccc2)on1	764636932	VMDRSADGTYIPJY-UHFFFAOYSA-N	448.483	1.627	50	20	IDGD	
C[C@H](C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1)N1CCc2ccccc2C1	766643345	KZDWWBVMYACBDY-LJQANCHMSA-N	449.555	1.039	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1)N1CCc2ccccc21	766653246	RWWRNALLAZBELM-SFHVURJKSA-N	435.528	1.043	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)[C@H](NC(=O)c1cccs1)C(C)C	767275216	FQTVZCQXCZCEFM-LJQANCHMSA-N	431.514	1.744	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)C[C@@H]3C(=O)Nc4ccccc43)n[nH]2)cc1OC	768276199	IMCXCTFOOXFBPD-AWEZNQCLSA-N	435.440	1.981	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2cc(C(C)C)nc3c2c(O)nc(=O)n3CC(C)C)n[nH]1	768276694	MCLBVBFLSGWEKG-UHFFFAOYSA-N	427.465	1.383	50	20	IDGD	
Cn1cnnc1Sc1ccc(C(=O)NNC(=S)Nc2ccccn2)cc1[N+](=O)[O-]	768585976	YZAYXEMUGACZCZ-UHFFFAOYSA-N	430.475	1.901	50	20	IDGD	
NS(=O)(=O)c1ccc(C(=O)NNC(=O)CCCOc2ccc(Cl)cc2Cl)nc1	769738696	MEEOYWBYFRGGDL-UHFFFAOYSA-N	447.300	1.656	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(C)c(C(=O)NNc2cccc(F)c2C(=O)OC)c1	773641167	MQWZZSKWPWUBRL-UHFFFAOYSA-N	439.465	1.602	50	20	IDGD	
CCC(CC)NC(=O)[C@H]1CN(C(=O)C(=O)NNc2nccc(OC)n2)c2ccccc2O1	773724395	PETQQPJIBYKXDL-MRXNPFEDSA-N	442.476	1.027	50	20	IDGD	
CCN(CC)c1ccc(S(=O)(=O)N(CC)CC)cc1NC(=O)NNC(=O)CN(C)C	775435884	ZNRPGHHIQORXTL-UHFFFAOYSA-N	442.586	1.278	50	20	IDGD	
CCOC(=O)N1CCC[C@H]([C@H](C)NC(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)C1	777263865	BPHHTVKDXZQBTH-HOTGVXAUSA-N	433.509	1.829	50	20	IDGD	
COc1ccc(Cn2cc(C(=O)NNC(=O)c3cccc(OC)c3O)cn2)cc1OC	779377838	DLFLSCHDVUZCBZ-UHFFFAOYSA-N	426.429	1.738	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@]2(C[C@H]2C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)C1	781285901	NUCKSPINOXMMLX-AOMKIAJQSA-N	442.472	1.510	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2cccc(N3CCN(C(C)=O)CC3)c2)cc1OC	782081024	XNZHELPBBXDSGR-UHFFFAOYSA-N	441.488	1.839	50	20	IDGD	
CCCCNS(=O)(=O)c1cccc(NC(=O)C(=O)NNc2ncnc3ccsc23)c1	783255358	SVRNWASQIXUDQD-UHFFFAOYSA-N	448.530	1.852	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2cccc(-c3ccc4c(c3)CCO4)c2)CCS(=O)(=O)C1	783425013	HFYHWVQLFVQOKX-OAQYLSRUSA-N	429.498	1.425	50	20	IDGD	
Cc1ccccc1-n1nc(C(C)(C)C)cc1NC(=O)C(=O)NN[C@]1(C)CCS(=O)(=O)C1	783426600	HRNSUSPIDKHTPO-OAQYLSRUSA-N	447.561	1.615	50	20	IDGD	
CC(=NNC(=O)c1ccc(-n2cnnn2)cc1)[C@H]1CN(C(=O)OCc2ccccc2)CCO1	783809929	HWZMXFIRJWOPAX-HXUWFJFHSA-N	449.471	1.806	50	20	IDGD	
CCn1nc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)cc1C1CC1	784210529	SVHNQKXOXIWXQC-UHFFFAOYSA-N	432.506	1.303	50	20	IDGD	
C[S@@](=O)c1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)cc1F	784832693	DHAQCXZVXZJSNV-MUUNZHRXSA-N	449.432	1.641	50	20	IDGD	
O=C(NNc1ncc(F)cn1)C(=O)Nc1ccc(Cl)cc1I	784958512	ZYOJMIHMDLIMDN-UHFFFAOYSA-N	435.584	1.956	50	20	IDGD	
Cn1ccnc(NNC(=O)C(=O)Nc2cccc3c2CCN(C(=O)OC(C)(C)C)C3)c1=O	785089748	FMWSIVKFCRODRL-UHFFFAOYSA-N	442.476	1.155	50	20	IDGD	
CCCc1nc(C)c(NC(=O)C(=O)NNc2c(OC)cccc2S(C)(=O)=O)s1	785331549	VVNDJVJORNDCLF-UHFFFAOYSA-N	426.520	1.898	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cccc(C(F)(F)F)n2)cc(OC)c1OC	786414668	PWRTWHTYLOEKOP-UHFFFAOYSA-N	442.350	1.526	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)cccc1N1CCNC1=O	787544595	WTDYTXOFAXOOOP-UHFFFAOYSA-N	449.265	1.015	50	20	IDGD	
O=C(COC(=O)c1cccnc1C(F)(F)F)NNC(=O)[C@H]1COc2ccccc2O1	788129230	CXKYLMQFVOHWLM-CYBMUJFWSA-N	425.319	1.245	50	20	IDGD	
Cc1nc2cc(C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)ccc2n1Cc1ccsc1	788588718	WUWDZLHNCZJLBC-NSHDSACASA-N	435.531	1.153	50	20	IDGD	
O=C(CC1OCCCO1)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	788625018	OXGYREJHOFQJCN-UHFFFAOYSA-N	425.488	1.463	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)CN2CCc3ccccc3C2=O)cc1C	789270627	HQAJAJKFYMUZIU-UHFFFAOYSA-N	429.498	1.622	50	20	IDGD	
COc1c(C(=O)N(C)C)cc(Cl)cc1S(=O)(=O)NNC(=O)c1ccc(C)cc1O	790054381	MKYVBVYAPBZROP-UHFFFAOYSA-N	441.893	1.688	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Nc2cc([C@@H]3CCCOC3)nn2C)cc(OC)c1OC	790546053	KJXHNRFSPBPPRH-GFCCVEGCSA-N	433.465	1.806	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2cc(Cl)cc(Cl)c2)n([C@@H]2CCS(=O)(=O)C2)n1	792440602	AEBIEBXHJDUMHU-CYBMUJFWSA-N	446.316	1.940	50	20	IDGD	
CC[C@@H](C)n1ncc(NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)c1C	792483228	UVFPGEGQVFHGPA-CQSZACIVSA-N	436.538	1.944	50	20	IDGD	
COc1cc(C)cnc1C(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	792607508	VFMZYIZYXNHXJQ-UHFFFAOYSA-N	431.924	1.631	50	20	IDGD	
O=C(NNC(=O)c1ccc(F)cc1Br)C(=O)Nc1cnc(CC2CC2)nc1	793026061	OPACDDNHCFILGP-UHFFFAOYSA-N	436.241	1.730	50	20	IDGD	
O=C(NNc1ccc2c(=O)[nH]ccc2c1)C(=O)Nc1cc(F)cc(N2CCOCC2)c1	793069176	HRIMTLGHGJUDDP-UHFFFAOYSA-N	425.420	1.586	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)NCc2cccc(C(F)(F)F)c2)cnc1C	793386202	WGEZFRPUSKJNIQ-UHFFFAOYSA-N	446.407	1.888	50	20	IDGD	
CC(=O)N1CCc2ccccc2[C@H]1CC(=O)NNc1ccccc1S(=O)(=O)N(C)C	795169432	PTZZQBIPKPJDFZ-LJQANCHMSA-N	430.530	1.916	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCN(c3cccc(F)c3)C[C@@H]2C)cc1OC	795189433	QWRDMQGYFUNOBQ-HNNXBMFYSA-N	430.480	1.815	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2cc(C(=O)N(C)C(C)C)ccc2Cl)n1	797370221	WKFJIHYZMDJFMX-UHFFFAOYSA-N	431.880	1.924	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2cc(F)c(C(=O)OC)c(F)c2)c2ccccc2c1=O	801834479	XAWMYWXIHXAGJZ-UHFFFAOYSA-N	445.382	1.948	50	20	IDGD	
Cc1nn(Cc2ccccc2)c(N)c1C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C	802946242	UQEBFYIULABMNV-UHFFFAOYSA-N	430.509	1.888	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(C(=O)CCC(=O)NNc3ncccc3F)CC2)cc1	804211090	FEFCCFTZOKIYDQ-UHFFFAOYSA-N	449.508	1.286	50	20	IDGD	
C[C@@H]1CCc2c(sc3nc(CCC(=O)NNC(=O)N4CCN(C)CC4)nc(O)c23)C1	807382042	VBCZHNQUWMLMMI-GFCCVEGCSA-N	432.550	1.443	50	20	IDGD	
CCN1CCN(C(=O)Cc2ccc(NC(=O)C(=O)NNc3cccc(F)n3)cc2)CC1	807393069	VGTNIVAJSCEMJX-UHFFFAOYSA-N	428.468	1.009	50	20	IDGD	
CCCNS(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)c2ccc(CC)cc2)cc1	808070560	YLWBXNQKYSXKTN-UHFFFAOYSA-N	425.532	1.561	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CN2CCN([C@H]3CCN(C(=O)OC(C)(C)C)C3)CC2)cc1	808774375	URUUFYURYICZCO-IBGZPJMESA-N	445.564	1.383	50	20	IDGD	
CCc1c(C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)ccn1C	809933380	DWDCHKIBQRLLRT-UHFFFAOYSA-N	448.545	1.002	50	20	IDGD	
COc1cc(F)c(F)cc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccc(C(C)=O)cc1	810386207	QCLSXPATADGKLY-NSHDSACASA-N	435.383	1.729	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NN=C1CCCc2ccc(S(N)(=O)=O)cc21	811633810	UDNYTASBENJVOB-UHFFFAOYSA-N	449.558	1.406	50	20	IDGD	
NS(=O)(=O)c1ccc2c(c1)C(=NNC(=O)c1csc(N3CCOCC3)n1)CCC2	811634065	BEZXUGZUHAZPSB-UHFFFAOYSA-N	435.531	1.098	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(=NNC(=O)N[C@@H]2CCS(=O)(=O)C2)[C@@H]([C@@H]2CCOC2)C1	812227165	SVOBWYFUGIUVJT-RBSFLKMASA-N	444.554	1.122	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc3c(C)nn(C)c3c2)cc1	812979568	XDYXMYFUOSCYAM-CQSZACIVSA-N	439.472	1.834	50	20	IDGD	
O=C(NNC(=O)N1CCc2c(nnn2-c2ccccc2)C1)c1cnn(-c2ccccc2)c1	814300045	GFLCEYPGFITNBA-UHFFFAOYSA-N	428.456	1.866	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)c2cnn(C)c2I)c1	814720072	IHKVWUCPJAJPRB-UHFFFAOYSA-N	428.230	1.482	50	20	IDGD	
CCc1cnc(C=NNC(=O)CN2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)s1	814877609	SJPDOVRQGHSSGX-UHFFFAOYSA-N	435.575	1.471	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)c2cn3c(Br)cnc3s2)c1	815000961	RUELMFRYXJYEBK-UHFFFAOYSA-N	443.304	1.637	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1)[C@@H]1CCc2nncn2C1	815157089	IFKRAQDMTZKRDK-NHCUHLMSSA-N	430.512	1.615	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)c1	815267057	VDMFHYYZGGWWMZ-UHFFFAOYSA-N	425.445	1.122	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)C2CCC(OC[C@@H]3CCCO3)CC2)cc1	815346116	ZPTADFHOZLMLEC-ACBHZAAOSA-N	429.473	1.617	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)N(C)C)ccc1C(=O)N(C)C	815752420	RATVUDOANKZTJW-UHFFFAOYSA-N	447.517	1.029	50	20	IDGD	
Cn1nncc1NNC(=O)c1cccc(NS(=O)(=O)c2ccc3c(c2)OCCO3)c1	816770340	STHUIDFFTFFXRH-UHFFFAOYSA-N	430.446	1.144	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)CC3CC3)CC2)cc1	819136465	YCEIHIIBNIPIMY-UHFFFAOYSA-N	437.518	1.212	50	20	IDGD	
NC(=O)N[C@@H](CC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)c1cccs1	821892730	PHPZYYWDIQTEII-KRWDZBQOSA-N	444.561	1.207	50	20	IDGD	
O=C(Cn1cncn1)NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2Cl)c1	849200896	RXUGMRSLNWEAOE-UHFFFAOYSA-N	434.865	1.194	50	20	IDGD	
CSC[C@H](C(=O)NNC(=O)COc1ccc(C)cc1)N1C(=O)[C@H]2CCCC[C@@H]2C1=O	901472740	HMFZWVFZYCSHQM-YESZJQIVSA-N	433.530	1.428	50	20	IDGD	
CS(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)c1	912852172	MWWZKSRMPKKXFC-UHFFFAOYSA-N	444.922	1.111	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@@H]2C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c(OC)c1	915059190	GCWUKNCKJDCUNO-QGZVFWFLSA-N	442.428	1.678	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)N2CCN(c3ccc(S(N)(=O)=O)cc3)CC2)cc(C#N)n1C	915290840	YIWKKFYJMSSFMT-BOPFTXTBSA-N	438.513	1.108	50	20	IDGD	
O=C(NCc1cn(Cc2ccccc2)nc1-c1ccccc1)NNC(=O)C(=O)NC1CC1	916232869	NCWHCEPPHHAGBH-UHFFFAOYSA-N	432.484	1.707	50	20	IDGD	
C[C@@H](NC(=O)NNc1ccc(-n2cccn2)nn1)c1ccc(OCC(=O)NC2CC2)cc1	916489384	KSJSJZBVVLWPHH-CQSZACIVSA-N	436.476	1.707	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCCOc2cccc(F)c2)nc1	916635120	ZRIDXBFCXHUSDQ-UHFFFAOYSA-N	425.486	1.956	50	20	IDGD	
Cc1ccc(C(=O)NNS(=O)(=O)c2ccc(I)cc2)c(O)c1	917753648	KUGCITLZRGJYPP-UHFFFAOYSA-N	432.239	1.929	50	20	IDGD	
CNS(=O)(=O)c1ccc([C@@H](C)NC(=O)NNC(=O)c2cc(OC)cc(OC)c2)cc1	919778437	BFAWSDIRIMZCDL-GFCCVEGCSA-N	436.490	1.317	50	20	IDGD	
C[C@@H]1CCC[C@@H](CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)C1	919916154	PLJGJVPEJYVRSM-HZPDHXFCSA-N	438.550	1.478	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2ccccc2N2CCCC2)c1	919922507	PYOXWLYCVLKOPH-UHFFFAOYSA-N	445.545	1.681	50	20	IDGD	
COc1cccc(/C=C(/C(=O)NNC(=O)c2c(C)nc3ccccn23)n2nnnc2C)c1	920431706	NTFKGUFGNXIKEQ-ATVHPVEESA-N	432.444	1.406	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)c1ccc(N2CCC[C@H](C(N)=O)C2)cc1	1321238916	DKDQYDKIBAXFCI-HNNXBMFYSA-N	446.529	1.557	50	20	IDGD	
C[S@@](=O)c1ccc(NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1	1323829694	LMOQAIYIVQKYKL-SSEXGKCCSA-N	429.546	1.789	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)c1ccc(N2CCC[C@@H](C(N)=O)C2)cc1	1324037997	VTQWZLGBHDEOQS-QGZVFWFLSA-N	440.500	1.627	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2ccc(S(=O)(=O)NC[C@H](C)O)cc2)c2ccccc2n1	1353754863	YYUHWIAJSVEZDB-AWEZNQCLSA-N	442.497	1.277	50	20	IDGD	
O=C(c1cnnc2ccccc12)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1777728586	YDMZBXLEWCZJNQ-YJBOKZPZSA-N	437.269	1.764	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4cccnc4n3)C2)C1	1778433724	JRNKVRPIPIHAFY-YJYMSZOUSA-N	433.306	1.857	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)cc1OC	1780658151	GCWDVHGYJJYYPM-BFUOFWGJSA-N	441.322	1.931	50	20	IDGD	
Cc1cnn([C@@H](C)C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](F)Br)C2)c1	1780777456	SORMQEASMYLSGF-JTOWHCCKSA-N	445.333	1.957	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C=C(/C)C(=O)O)C2	1781904442	WODXRDBIQYZGIG-ZDBYUICRSA-N	431.327	1.705	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cnc(OCF)cn3)CCO2)C1	1783533247	YIXNRRKNLVMVLZ-MEDUHNTESA-N	431.262	1.009	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@H](C(=O)N2CC[C@]3(CN(C(=O)[C@H](C)Br)CCO3)C2)C1	1783866372	FOBUEDOIHFADAF-XTDOFWJNSA-N	445.354	1.579	50	20	IDGD	
CCn1nccc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]2C1	1783967101	BJOJOVGFIJAQPQ-HOSILWTGSA-N	427.343	1.527	50	20	IDGD	
C=CCC(CC=C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21	1784031587	SIFHWVXBWSYLFR-VDGAXYAQSA-N	441.532	1.047	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cccc(C(F)(F)F)n3)C[C@@H]21)[C@H](O)CCl	1784086023	ROFNDLJYHZAWOC-MHEUCROKSA-N	449.857	1.222	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4cc(F)c(F)cc4[nH]3)C[C@@H]21)[C@@H](O)CCl	1784092060	GNEISISOLYMUPN-MQJTVAOZSA-N	441.862	1.639	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](C)Oc3ccccn3)C2)C1	1784490685	BMGZQLBLBNSCED-YZVOILCLSA-N	440.338	1.852	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc[n+]([O-])cc3)[C@H]2C1	1789098463	XIAAGSDOLHREMS-VGWMRTNUSA-N	426.311	1.087	50	20	IDGD	
C[Si](C)(C)OCC(=O)Nc1ccc(C2(NC(=O)CNCP(=O)(O)O)CCC2)cc1	1789648961	UYEXSNVFAMVPNK-UHFFFAOYSA-N	443.513	1.697	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CCC[C@H](C(=O)OC)C3)C[C@@H]21	1789864421	BTUWBMOUGOWDAW-PXOUGSPUSA-N	428.957	1.963	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1ccc(C2(NC(=O)CN3C(=O)CNC3=O)CCC2)cc1	1791432337	VWDJWBURYCUFAR-LLVKDONJSA-N	437.294	1.456	50	20	IDGD	
COc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)CBr)ccc1O	1792872402	FDNUKVSNLADRPA-MBMVNNNZSA-N	441.322	1.635	50	20	IDGD	
Cc1noc(C)c1CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)CBr)C2	1794136140	NIRLSEZKAISQPW-ZKRNXSKHSA-N	442.354	1.845	50	20	IDGD	
Cn1cnc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)n1	1794141153	MLGGGJNRTGUYHL-CRWXNKLISA-N	440.932	1.199	50	20	IDGD	
CC(C)(C)n1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)cn1	1794657182	AGGQWXCUGYZMQD-MUJYYYPQSA-N	439.520	1.202	50	20	IDGD	
C[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCBr)n1cccc1C=O	1795112863	RCHFNTKGOGMTFL-ZJOBFFGXSA-N	426.311	1.236	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1nc(C)oc1C(F)(F)F	1796409346	PIJIZXBAVOLWMX-USZNOCQGSA-N	439.818	1.459	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1nc2ccc(C(F)(F)F)cn2n1)[C@H](O)CCl	1796432674	YPSXYLUBZUWZRD-YVECIDJPSA-N	445.829	1.600	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnn3cccnc13)C2	1799275701	AOSJHHMPUSNIDA-JPVZDGGYSA-N	426.304	1.169	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1ccc(Br)nc1)[C@H](O)CCl	1799787649	XDFSBKVTUXIWOU-XJFOESAGSA-N	430.730	1.625	50	20	IDGD	
CCC[C@H]1CC[C@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cccc(B(O)O)c2)C3)CC1	1800649397	GSWHHLUFKZVJDI-IIHZSMLWSA-N	442.365	1.176	50	20	IDGD	
CC(=O)N/C(=C\c1ccco1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(Cl)Cl	1801017246	DZWRBSZPYHIIAZ-MIPSWPEPSA-N	430.288	1.150	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CCc2nc[nH]c2C1	1801266213	XZPYOUPADKXALK-XKSGDERDSA-N	439.354	1.135	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CCc2nc[nH]c2C1	1801268921	OONWOPIWWCCHDQ-OVFJVZGRSA-N	429.348	1.341	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(Cl)nc3n[nH]cc13)C2	1802332739	HBLQSARRQMEIIO-CLLJXQQHSA-N	447.927	1.236	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(OC(F)F)cc1)C2	1802338770	RFVILWWWCBMNDJ-MUJYYYPQSA-N	438.475	1.913	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)CCS(C)(=O)=O)[C@H]1c1cccnc1	1803693860	AFHUFMLTYWIPNL-BQFCYCMXSA-N	429.970	1.930	50	20	IDGD	
CCC1(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)CCC1	1807374710	HVOLBDCHSFFUKH-TZIWHRDSSA-N	435.333	1.661	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2[nH]nc3ncccc23)[C@@H]1c1cccnc1	1808116039	BCWHOIWDGYQLIY-HFTRVMKXSA-N	442.907	1.926	50	20	IDGD	
CCOC(=O)N[C@@H](O)C(=O)N1CCC2(CCCN(C(=O)CCBr)C2)CC1	1809067227	SAFBNMPJUNZZIC-AWEZNQCLSA-N	434.331	1.067	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)NC[C@H]1CCN(C(=O)CO[Si](C)(C)C)[C@@H]1c1cccnc1	1810237555	ZVFXGFNPIWORHV-SZVBFZGTSA-N	449.628	1.647	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)c(C)o1	1813070113	FGLTUMVVLJLRAX-PGRDOPGGSA-N	441.532	1.984	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)CSCC(=O)O)[C@H]1c1cccnc1	1813088364	BCHAZFZDEOIVRM-GRDNDAEWSA-N	429.926	1.159	50	20	IDGD	
C[C@]1(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)CC=CCC1	1813579099	JMIRAXMMDCQPEO-KJWPAHLWSA-N	447.344	1.827	50	20	IDGD	
O=C(CNc1ccc(F)cc1)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](O)CCl)CC2	1814832084	RJDCNBKGNIEQJT-TZMCWYRMSA-N	426.901	1.906	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cscn2)n[nH]1	1816487998	DRYPBZXLCCNIRX-OAHLLOKOSA-N	440.489	1.484	50	20	IDGD	
CC(C)=NO[C@H](C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1	1817472520	NJBQCZPIJBNVSW-RDTXWAMCSA-N	441.297	1.196	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc(F)cc2)[nH]n1)c1cccc(B(O)O)c1	1817476582	KXOQRMDZZNCPMM-LJQANCHMSA-N	436.252	1.848	50	20	IDGD	
Cc1cn(CC(=O)N2CCCC[C@@H]2c2cc(NC(=O)[C@@H](F)Cl)n[nH]2)c(=O)nc1O	1818045374	UIRRJKLPAVVFPJ-BXUZGUMPSA-N	426.836	1.207	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](C)Nc2cnccn2)[nH]n1	1822370154	LFCMNIQZGSWPKN-YDHLFZDLSA-N	435.916	1.946	50	20	IDGD	
COC(=O)c1ccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)[C@@H](O)CCl)CC2)cn1	1824182515	FFYNRVCEIYLAIR-MSOLQXFVSA-N	437.924	1.701	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CN2C(=O)CNC2=O)CC1	1824899289	QBIMIHCSJMVKME-HNNXBMFYSA-N	426.945	1.423	50	20	IDGD	
COc1cc(C(=O)N[C@@H]2CCc3nc(NC(=O)[C@H](C)Br)sc3C2)nn1C	1825645940	LWHMVRVXLVCKFX-DTWKUNHWSA-N	442.339	1.894	50	20	IDGD	
CCc1ccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)cn1	1825749062	KCNUPVCLMJZWKS-QHCPKHFHSA-N	449.360	1.871	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)C[C@@H]1CCCCO1)CC2	1826082738	CBRCMVWWQCFEAM-KBPBESRZSA-N	437.566	1.387	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C1(c3ccccc3)CC1)CCO2	1829843060	DWTCTSDQSNPYJR-WIYYLYMNSA-N	436.936	1.428	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cn3cnc4ccccc43)C2)C1	1831657322	MYNRJDBUNXTGQD-JTSKRJEESA-N	448.951	1.900	50	20	IDGD	
CC[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)Br)C2)C1)N(CC)CC	1831674129	CTHXDJJMMGMQLN-MDZRGWNJSA-N	448.402	1.347	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccncc2F)CC1	1831873205	MWOVAOZVKMJCAN-LJQANCHMSA-N	433.528	1.827	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(OC)s3)CCO2)C1	1833426233	YULPVYFZZDWEQU-ACJLOTCBSA-N	432.926	1.081	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)c1cc2sccn2c1	1834973882	PLBFCWKUIVIVCV-QGZVFWFLSA-N	438.981	1.786	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)Cc3ccc4ncnn4c3)CC2)CC1)[C@@H](F)Cl	1835082062	NCBULQVAOGRXBE-LJQANCHMSA-N	436.919	1.378	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccc4c(c3)OCO4)CCO2)C1	1835171292	WIFJRFFQHQOMHE-IERDGZPVSA-N	438.908	1.432	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCC(OC2CCN(C(=O)CCn3ccnn3)CC2)CC1	1836625472	XFCPCXIKPCDTNK-UHFFFAOYSA-N	425.961	1.932	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC(OC2CCN(C(=O)Cn3ccnc3)CC2)CC1	1836669745	CMDZZXGCSQKCST-OAHLLOKOSA-N	441.370	1.913	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)C1(C(F)(F)F)CC1)CCO2	1836720923	SKYBJESOVCAVSA-MRXNPFEDSA-N	438.519	1.637	50	20	IDGD	
Cn1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)c2cccnc21	1837186474	DPSNDNBOZTYDEL-QFIPXVFZSA-N	448.951	1.908	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)Cn3cc(Cl)cn3)CC2)CC1	1837930122	XCAKDWVWGPDEEI-QGZVFWFLSA-N	447.363	1.789	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(OC)cc(OC)c3)CCO2)C1	1838934602	ZPVPOOCUDYIHIK-WIYYLYMNSA-N	440.924	1.791	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(-n4ccnc4)ccn3)C2)C1	1839146392	NXOHUJLARHAFIF-UWJYYQICSA-N	447.923	1.355	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)ccc1F	1839201574	BDYPVHQDYICASK-CRAIPNDOSA-N	447.276	1.895	50	20	IDGD	
O=C(c1ccc2c[nH]nc2c1)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840187599	MQYLTYKNRWJDFX-GOSISDBHSA-N	427.288	1.437	50	20	IDGD	
O=C(c1cc2ccoc2cn1)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840189789	LWHHHUJVPGOOCE-GOSISDBHSA-N	428.272	1.702	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CCCSC1)CCO2	1840867879	SCLRRVNORFBLSZ-RLFYNMQTSA-N	449.411	1.760	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCCC12CN(C(=O)c1cccc(N3CCCNC(=O)C3)n1)C2	1841225580	IENSWVLZEFVMPD-UHFFFAOYSA-N	447.967	1.490	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)/C=C/c2ccc(F)cc2F)C1	1841796026	RPNZKRULLOMDOA-WEVVVXLNSA-N	426.228	1.175	50	20	IDGD	
CCOc1ccc(Cl)cc1C(=O)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843014644	KADSFIMBVICUFK-UHFFFAOYSA-N	442.708	1.549	50	20	IDGD	
O=C([C@@H](F)Br)N1CC2(CCCN2C(=O)[C@H]2ON=C(c3ccccc3)O2)C1	1844198663	WVPJPYUGYGMFRR-MLGOLLRUSA-N	426.242	1.615	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC12CN(C(=O)[C@H]1CCN1C(=O)OC(C)(C)C)C2	1846175827	UTJOMZKZMLVVQY-QWHCGFSZSA-N	430.343	1.983	50	20	IDGD	
C[C@@H](NC(=O)c1ccccc1)C(=O)N1CCCC12CN(C(=O)[C@@H](F)Br)C2	1847063315	QIRXKVVZJMUEPN-TZMCWYRMSA-N	426.286	1.699	50	20	IDGD	
CC1(CC(=O)N2CCCC23CN(C(=O)[C@H](O)CCl)C3)CN(C(=O)OC(C)(C)C)C1	1847142254	VRLMHVSOUHILDS-CQSZACIVSA-N	429.945	1.437	50	20	IDGD	
Cc1nn(Cc2ccc(F)cc2)c(Cl)c1C(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1	12799370	AWPKMWMPBHYEAU-GFCCVEGCSA-N	428.873	1.228	50	20	IDGD	
CCOc1ccccc1C(=O)NCCCC(=O)NNC(=O)C(=O)Nc1ccc(C)cc1	16493795	ODDVHUUNYKSEJH-UHFFFAOYSA-N	426.473	1.690	50	20	IDGD	
CON(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)c1	24297478	VTKAEIFVOKFNGI-GFCCVEGCSA-N	425.438	1.236	50	20	IDGD	
COCCCNC(=S)N(C)NC(=O)CNS(=O)(=O)c1ccc(Cl)c(Cl)c1	726076239	UOIXXMPMWMDZCU-UHFFFAOYSA-N	443.378	1.146	50	20	IDGD	
CS(=O)(=O)Cc1c(C(=O)NNC(=O)Cn2cnc3ccccc32)oc2ccccc12	726523687	UHWKXARKNUFGJU-UHFFFAOYSA-N	426.454	1.788	50	20	IDGD	
C=CCCC(=O)NNC(=O)C[C@@H]1c2cc(OC)c(OC)cc2CCN1S(C)(=O)=O	726619987	RDYHWJZUVGGNAR-OAHLLOKOSA-N	425.507	1.066	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=S)NCCc2ccc3c(c2)OCCO3)c1	726747307	SFYROJPOXCIEMR-UHFFFAOYSA-N	435.527	1.213	50	20	IDGD	
CCc1ccc(C(=O)NNC(=S)NCC2CCC2)cc1S(=O)(=O)N1CCOCC1	727866261	WQNPVRDHKQEVHP-UHFFFAOYSA-N	440.591	1.179	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CNC(=O)c2ccco2)cc1I	727995869	TVBACZGFURQBQA-UHFFFAOYSA-N	427.198	1.384	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc2c(c1)OCCCO2)NNc1nc(-c2ccccc2)no1	728081225	JNIOLYCRUULKCG-UHFFFAOYSA-N	445.457	1.320	50	20	IDGD	
CN(C)N(C(=O)[C@@H]1CS[C@@]2(c3ccc(F)cc3)CCC(=O)N12)[C@H]1CCS(=O)(=O)C1	728179665	NPSRBDHVQQXGRY-TXPKVOOTSA-N	441.550	1.209	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCCN1C(=O)c1ccco1)C1CCN(c2ncccn2)CC1	728844780	BLCQNWUNQRTLPC-INIZCTEOSA-N	426.477	1.128	50	20	IDGD	
CC(=O)N1CCN(CCNC(=O)/C(C#N)=C\c2cn(CCC#N)nc2-c2ccccc2)CC1	729317229	XKRFTESWEWFUCW-PGMHBOJBSA-N	445.527	1.651	50	20	IDGD	
O=C(CCc1ccccc1O)NNS(=O)(=O)c1ccc(Br)c(C(=O)O)c1	729965293	UCJMXONMAYKXIE-UHFFFAOYSA-N	443.275	1.795	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)N[C@@H](C)CN2CCN(C)CC2)c1	730131087	OAPBFPZLLCZPNX-LBPRGKRZSA-N	428.331	1.038	50	20	IDGD	
Cn1nc(Br)c2c(=O)n(CC(=O)NN=c3cc[nH]c4ccccc34)cnc21	730291024	WFWVALUXILJFNJ-UHFFFAOYSA-N	428.250	1.006	50	20	IDGD	
COc1cc(C=NNC(=O)Cn2c(C)nc3ccccc32)cc(OC)c1OCC(N)=O	730546634	GARZUYJTPRTGQF-UHFFFAOYSA-N	425.445	1.376	50	20	IDGD	
O=C(NNc1nc(-c2ccncc2)no1)[C@H]1CCCN(S(=O)(=O)Cc2ccccc2)C1	730589981	SFTRDLXHYZGKCV-KRWDZBQOSA-N	442.501	1.817	50	20	IDGD	
COC[C@@H](C)n1c(C)cc(/C=C(\C#N)C(=O)NCCC(=O)N2CCN(C(C)=O)CC2)c1C	730783434	NVXNIGBASAZERL-VYVDHXHBSA-N	443.548	1.416	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1)c1ccc2c(c1)OCO2	732051273	DLZXAFUBHRIRKT-NSHDSACASA-N	432.414	1.451	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N2CCC(NC(=O)C3CC3)CC2)cc1Br	732255329	CYBWXIJUUQYZCJ-UHFFFAOYSA-N	439.310	1.803	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)c1ccc(S(=O)(=O)N=c2cc[nH]cc2)cc1	732304392	LSXJXTGKAWASBZ-UHFFFAOYSA-N	446.510	1.465	50	20	IDGD	
Cc1cc(C)n(-c2ccc(C(=O)OCC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)cn2)n1	732326981	DBVANKPKKKELTI-UHFFFAOYSA-N	438.400	1.410	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNC(=O)NCCN/C(O)=C2/N=CC=CC2=O)cc1	732466136	LWSRQDHPECXLFS-ZZEZOPTASA-N	429.477	1.582	50	20	IDGD	
COC(=O)c1ccc(S(=O)(=O)NNC(=O)CCCc2cccs2)c([N+](=O)[O-])c1	732548649	MOKOBPLGXIWXSX-UHFFFAOYSA-N	427.460	1.775	50	20	IDGD	
O=C(NCCn1cccn1)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	734279572	XROUHZDCXCQVMA-UHFFFAOYSA-N	431.456	1.286	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)N[C@H]1CCN(c2ccc(Cl)cc2)C1=O	740043346	FQOLCPUDRONDMS-ZDUSSCGKSA-N	435.893	1.267	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCCc2cc3ccccc3o2)cc1	740481579	AMPISBMGOJXJDI-UHFFFAOYSA-N	444.513	1.935	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(N2CCOC2=O)cc1)c1nnc(-c2ccccc2)o1	740811723	WIEIZPZEOUKDFF-UHFFFAOYSA-N	429.414	1.317	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)[C@@H]2CCCN(C(=O)COc3ccccc3)C2)c1	741283662	JRNVYSYZOXMCBR-QGZVFWFLSA-N	440.500	1.572	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H]1CC(=O)NNC(=O)c1csc(N2CCOCC2)n1	742478866	SXQPENAEBYJQMH-CYBMUJFWSA-N	439.538	1.530	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N[C@@H]2CC(=O)N([C@H]3C[C@H]3c3ccccc3)C2)cc1OC	743521335	PRAXUQVHOCWDSA-SQNIBIBYSA-N	438.484	1.805	50	20	IDGD	
Cc1cc(NC(=O)CN2CCN(C(=O)NNC(=O)c3cccc4ccccc34)CC2)no1	743627388	CSNCNUIDVAYDFO-UHFFFAOYSA-N	436.472	1.747	50	20	IDGD	
C[C@@H](CC(=O)c1ccccc1F)C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	745488031	HDLZCIOBACIAJZ-DJJJIMSYSA-N	444.415	1.565	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)NCCNC(=O)c2cccnc2)cc1Cl	745490628	CWEVBRMJNZMZPO-UHFFFAOYSA-N	436.856	1.518	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@H](C)CN(C)C(=O)OC(C)(C)C)cc(OC)c1OC	746816557	SEVIDAYNZVEQSE-GFCCVEGCSA-N	425.482	1.976	50	20	IDGD	
O=C(O)c1ccc(S(=O)(=O)NNC(=O)c2ccc(Cl)nc2)c(Br)c1	747606216	KOHOLOWGFNQKDI-UHFFFAOYSA-N	434.655	1.819	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)[C@H](C)C1CC1)N(S(C)(=O)=O)CC2	747934100	BXUSPVSBYQYOEQ-WBMJQRKESA-N	439.534	1.146	50	20	IDGD	
O=C(COC(=O)[C@@H]1CCCN1C(=O)c1ccc2c(c1)OCO2)NNC(=O)c1ccccc1	750175199	CKJASJWKFGGNJK-INIZCTEOSA-N	439.424	1.024	50	20	IDGD	
CCn1c(SCC(=O)NNC(=O)CNC(=O)c2ccco2)nnc1-c1cccc(C)c1	751205221	ZNHAWXYMSDAUPF-UHFFFAOYSA-N	442.501	1.536	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)C1CN(C(=O)OC(C)(C)C)C1	752234168	WETAPZYMINIHHR-UHFFFAOYSA-N	441.868	1.520	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCN(c3nc(C)c(C)s3)CC2)cc1OC	754349571	QLLGNICULNMDHB-UHFFFAOYSA-N	433.534	1.360	50	20	IDGD	
O=C(CCS(=O)(=O)c1ccc2c(c1)OCCO2)NNc1ccc(C(F)(F)F)nn1	755197171	GSUUHKMHIJRCHG-UHFFFAOYSA-N	432.380	1.574	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2cccn2C)cc1S(=O)(=O)N1CCCCC1	755414597	ZIWNJPRLXQMSND-UHFFFAOYSA-N	435.506	1.675	50	20	IDGD	
CCOc1ccc(NC(=O)NNC(=O)c2cc(C)[nH]n2)cc1S(=O)(=O)N1CCCC1	755468730	BCQLWMSMOLRSTH-UHFFFAOYSA-N	436.494	1.368	50	20	IDGD	
CON(C)S(=O)(=O)c1ccc(NC(=O)NNC(=O)c2ccc(Cl)cc2O)cc1	755537108	WUWYGLCYTANKKT-UHFFFAOYSA-N	428.854	1.694	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)Nc1cccc(CN2CCOC2=O)c1	755826821	GGNAEQPIQNXVSQ-UHFFFAOYSA-N	436.428	1.997	50	20	IDGD	
CN(C)C(=O)Cn1ccc(NC(=O)NNC(=O)c2ccc(Br)cc2Cl)n1	756310715	HAGZYBDANCSPMU-UHFFFAOYSA-N	443.689	1.854	50	20	IDGD	
CS(=O)(=O)c1ccccc1-n1cc(NC(=O)NNC(=O)CCc2ccccc2O)cn1	756703893	BSNXJFVIRXERTN-UHFFFAOYSA-N	443.485	1.767	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)NCc3ccc4c(c3)CCS4(=O)=O)n[nH]2)cc1	757751791	SDZOLJQKTKGYMH-UHFFFAOYSA-N	439.497	1.859	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)N[C@@H]2CN(C(=O)OC(C)(C)C)C[C@@H]2C#N)cc1	758761960	RZBWLCFLXGRWQI-XJKSGUPXSA-N	433.465	1.163	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)C[C@H](c1ccccc1)OC2=O)C(=O)Nc1ccccn1	758837720	DWILCMHQYBJMQL-GOSISDBHSA-N	430.420	1.936	50	20	IDGD	
Cc1cc(S(=O)(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc(C(=O)O)c1Cl	759094012	GMURWCHMCOWLGI-UHFFFAOYSA-N	426.834	1.741	50	20	IDGD	
Cc1c(C(=O)NNC(=O)CCNC(=O)OC(C)(C)C)nnn1-c1ccc2ncccc2c1	760438256	SLDLUGHESNVEBH-UHFFFAOYSA-N	439.476	1.800	50	20	IDGD	
Cc1cc(F)c(S(=O)(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)cc1F	762603260	NGYGGWICXYRJHJ-UHFFFAOYSA-N	432.474	1.498	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)N[C@@H]1CC[C@H]2SCCS[C@H]12	763064399	SFUADBXDDVQDTE-QWFCFKBJSA-N	449.646	1.909	50	20	IDGD	
COC(=O)c1[nH]c(C)c(C(=O)NNC(=O)c2cc(-c3ccc(OC)c(OC)c3)[nH]n2)c1C	763150075	QLCKGZRVKHZTEG-UHFFFAOYSA-N	441.444	1.900	50	20	IDGD	
CCN(CC)C(=O)c1ccccc1NC(=O)C(=O)NNC(=O)c1ccc(OC)c(OC)c1	763542563	GQFHETOXSGHHOE-UHFFFAOYSA-N	442.472	1.586	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)Nc1ccc(OC[C@H]2CCCO2)cc1	763569830	CHPJNQFIRUBICG-VQIMIIECSA-N	441.440	1.170	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)Nc1cc(F)ccc1N1CCCCC1	763572369	QVIMXDOVHJRYGF-LJQANCHMSA-N	442.447	1.742	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)c(OCCN(C)C)c1	763693863	BYABMVVEHQPIES-UHFFFAOYSA-N	448.907	1.754	50	20	IDGD	
CCc1noc(-c2ccc(C)c(NC(=O)C(=O)NNC(=O)COc3ccccc3C#N)c2)n1	763813419	LZOFEFHRWPZUAR-UHFFFAOYSA-N	448.439	1.644	50	20	IDGD	
COc1ccc(-c2nc(C)c(C(=O)NNC(=O)CNC(=O)c3cccnc3)s2)cc1	763819480	BTUOZMAXIWOSMU-UHFFFAOYSA-N	425.470	1.713	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(-n3nccn3)cc2)cc1	763864391	CQSVZKJSDLPROF-CQSZACIVSA-N	438.444	1.219	50	20	IDGD	
CC(C)CC(=O)NNC(=O)C(=O)Nc1ccc(Cl)c(S(=O)(=O)N2CCCCC2)c1	763884297	UVCHBXRCGFPFDL-UHFFFAOYSA-N	444.941	1.647	50	20	IDGD	
COC(=O)[C@H]1CN(C(=O)C(=O)NNC(=O)CSc2ccc(C)cc2)c2ccccc2O1	763891927	SKMHXGWLYCBSOO-QGZVFWFLSA-N	443.481	1.202	50	20	IDGD	
COCCn1ncc2ccc(NC(=O)C(=O)NNC(=O)CSc3ccc(C)cc3)cc21	763897741	FBILKBNGSXTQHS-UHFFFAOYSA-N	441.513	1.869	50	20	IDGD	
COC(=O)c1ccc(C(F)(F)F)cc1NC(=O)C(=O)NNC(=O)Cc1ccc(F)cc1	763918256	DOCJHAQIBITMAD-UHFFFAOYSA-N	441.337	1.960	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3cccc(S(C)(=O)=O)c3)cc2C1	763942020	LNIGCTMIMKDXJZ-NSHDSACASA-N	435.527	1.676	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)Nc1cncc(Br)c1	764004692	LIIARQZEVSSKSZ-UHFFFAOYSA-N	445.071	1.345	50	20	IDGD	
CCCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2OC)cc1	764041128	RNSZUNWYXKIXJR-UHFFFAOYSA-N	434.474	1.247	50	20	IDGD	
CNC(=O)CCOc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3c2)cc1	764066280	FAUFHZUAKXOLBN-UHFFFAOYSA-N	434.452	1.754	50	20	IDGD	
COc1c(NC(=O)C(=O)NNC(=O)c2c(Cl)cccc2Cl)cccc1C(N)=O	764221770	ZKFUHNPHGDQDPD-UHFFFAOYSA-N	425.228	1.501	50	20	IDGD	
O=C(NNC(=O)c1cccc(OC(F)F)c1)C(=O)Nc1ccc(NC(=O)C2CC2)nc1	764249858	FQTXMNXZEYNYNT-UHFFFAOYSA-N	433.371	1.431	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)C(=O)Nc1cccc(C(=O)NCc2ccccc2)c1	764268691	OXWPGENDIRGHMA-UHFFFAOYSA-N	431.452	1.340	50	20	IDGD	
CCN1CCN(c2ccc(NC(=O)C(=O)NNC(=O)CCc3ccccc3O)cc2)CC1	764280998	JHTVHDIHNFCKFI-UHFFFAOYSA-N	439.516	1.253	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)C(=O)Nc1cccc(OCC(=O)N(C)C)c1)c1ccccc1	764326867	PSAJTKSDJCAOLI-GOSISDBHSA-N	426.473	1.433	50	20	IDGD	
O=C1CCCc2cc(NC(=O)C(=O)NNC(=O)c3cc(-c4cccs4)[nH]n3)ccc2N1	764381948	CSZZJDLGSFKILX-UHFFFAOYSA-N	438.469	1.813	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(-c2cn3ccccc3n2)cc1	764398815	XELAHHOQFFMIDU-CQSZACIVSA-N	425.445	1.139	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@H]2CCO[C@@H](C(C)(C)C)C2)cc1	764509531	AEIYHELDNWZMCI-DOTOQJQBSA-N	440.566	1.540	50	20	IDGD	
COCCSc1ccc([N+](=O)[O-])cc1C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	764607707	UMSCIBIGZMQJNA-UHFFFAOYSA-N	443.445	1.384	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNS(=O)(=O)c3ccccc3Cl)CC2)cc1	765124308	AGQQKYKTILYMKK-UHFFFAOYSA-N	436.965	1.776	50	20	IDGD	
CCCCS(=O)(=O)c1ccc(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1	765191817	DMQIAXPQESYRIJ-UHFFFAOYSA-N	428.474	1.311	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)[C@H]1CCC[C@H](C(F)(F)F)C1	765731814	BYEMPLJTOGFGGR-IRXDYDNUSA-N	440.466	1.961	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1cnc(Br)c(Br)c1	766264898	SHLXHLPMTXDAQL-UHFFFAOYSA-N	446.059	1.487	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3ccnc(-n4ccnc4)c3)CC2)cc1	766643365	LHDWZZHANZOMPX-UHFFFAOYSA-N	433.516	1.155	50	20	IDGD	
COc1ccc(NNC(=O)c2ccc(S(=O)(=O)N=c3cc[nH]cc3)cc2)c([N+](=O)[O-])c1	768339201	UOVDGXWCDPBGIC-UHFFFAOYSA-N	443.441	1.978	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)c1ccc2c(c1)CCN2S(C)(=O)=O	768635565	GCFVQCRPAUSITC-UHFFFAOYSA-N	439.515	1.178	50	20	IDGD	
CS(=O)(=O)c1ccc(C(=O)NNC(=O)c2ccc3c(c2)OCO3)cc1Br	769603124	VEEFZXFDNUJYOV-UHFFFAOYSA-N	441.259	1.656	50	20	IDGD	
CC(C)N(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc3c(c2)OCCO3)c1	770407001	XVDUYCXUAIWIGU-UHFFFAOYSA-N	433.486	1.562	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)c2ccc3nc(C(F)(F)F)cn3c2)cc1	770422647	HRXAETJXBJIZFJ-UHFFFAOYSA-N	431.330	1.843	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)c3ccccc3NS(=O)(=O)C(F)(F)F)nc21	770971120	HNJNGSUNJZJQLH-UHFFFAOYSA-N	431.356	1.087	50	20	IDGD	
CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)NNc2nc(O)c3cnn(C)c3n2)CC1	770981710	BFDDQWFLFYRTPX-UHFFFAOYSA-N	426.437	1.970	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCCC(=O)O[C@H](C)C(=O)NNC(=O)CC(C)C)cc1C	771844993	GIULYHKHDAHAKC-OAHLLOKOSA-N	427.523	1.097	50	20	IDGD	
CNC(=O)C(C)(C)CNC(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1	772996116	COXZVLDENIRDLZ-HXUWFJFHSA-N	437.544	1.716	50	20	IDGD	
Cn1c(CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)nc2cccc(Cl)c21	773133509	ZOLOSMFZWLWOMN-UHFFFAOYSA-N	449.924	1.664	50	20	IDGD	
CS(=O)(=O)CCOc1ccc(Cl)cc1NC(=O)C(=O)NNc1ccc(C#N)cc1	773693016	SXDXZMBOQCHHMY-UHFFFAOYSA-N	436.877	1.717	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1cccc(-c2nnco2)c1	774008947	MUMCVCFBDOPOFS-NSHDSACASA-N	429.820	1.943	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)c2ccc3nc(O)[nH]c3n2)c2ccccc2c1=O	774326495	JZZVAFOZRYMSFH-UHFFFAOYSA-N	435.444	1.638	50	20	IDGD	
COC(=O)Cc1occc1C(=O)NNC(=O)[C@@H](C)Oc1cccc(Br)c1	774327465	PKKJABQYJCCNEL-SNVBAGLBSA-N	425.235	1.986	50	20	IDGD	
CCc1cnccc1[C@H](C)NC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1	774327916	FHXAIOQYXYQITQ-HNNXBMFYSA-N	433.534	1.665	50	20	IDGD	
O=C(CN1CCN(Cc2nc3ccccc3[nH]2)CC1)NNC(=O)c1ccc([N+](=O)[O-])cc1	774734069	WJRLHITUJVNVHP-UHFFFAOYSA-N	437.460	1.050	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)Nc2cccc(CN3CCC[C@H]3C(N)=O)c2)c1	776301233	CRNAASZRAWIAOX-SFHVURJKSA-N	431.518	1.688	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(F)c(NC(=O)NNc2cccc(S(C)(=O)=O)c2)c1	776474321	ZSADFZJELAXMFK-UHFFFAOYSA-N	430.483	1.628	50	20	IDGD	
Cn1c(=O)nc(O)c2c(C(=O)NNc3cccc(S(C)(=O)=O)c3)cc(C3CC3)nc21	776721713	WAWQLKZFFNRPFN-UHFFFAOYSA-N	429.458	1.072	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)[C@@H](C(C)C)N2C(=O)c3ccccc3C2=O)nc1C	778424923	GYRZKVPWKICHSK-MRXNPFEDSA-N	425.445	1.726	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)c2ccc(F)c(S(=O)(=O)Cc3ncon3)c2)c1	781037696	OBCZZFZFYQWEPE-UHFFFAOYSA-N	434.405	1.726	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2csc(N3CCOCC3)n2)c2cccnc12	782896940	KYVKNQGOVQYUBE-UHFFFAOYSA-N	440.485	1.236	50	20	IDGD	
COC(=O)[C@H]1CN(C(=O)C(=O)NNc2ccc(Cl)cc2[N+](=O)[O-])c2ccccc2O1	783291290	ODBRCFOOUVFWAS-OAHLLOKOSA-N	434.792	1.659	50	20	IDGD	
O=C(NN=c1cc[nH]cc1)C(=O)Nc1ccc(NC(=O)[C@H]2CCCO2)cc1C(F)(F)F	783370481	WCUIRGGJTLOATD-OAHLLOKOSA-N	437.378	1.722	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)C(=O)Nc1cc(Cl)c(Cl)cc1Cl	784004162	JNYUVFKIOXGFSN-UHFFFAOYSA-N	433.635	1.756	50	20	IDGD	
O=C(NCC(=O)OCc1ccc(Cl)cc1)NNC(=O)c1ccc(-n2cnnn2)cc1	784171708	MYJMDWSAQUQOGK-UHFFFAOYSA-N	429.824	1.003	50	20	IDGD	
O=C(NNc1ccc(Cl)nn1)C(=O)Nc1ccc(F)cc1I	784791829	BYFDKXMDUASVLW-UHFFFAOYSA-N	435.584	1.956	50	20	IDGD	
C[C@H]1CN(Cc2ccccc2NC(=O)C(=O)NNc2ccnc(N(C)C)n2)C[C@@H](C)O1	784969875	RSGRSAKYQDAJMS-GASCZTMLSA-N	427.509	1.234	50	20	IDGD	
Cc1cc(C(=O)NC2CCCC2)ccc1NC(=O)C(=O)NNc1ccnc(N(C)C)n1	784970477	HZUXOAJXKZJFJG-UHFFFAOYSA-N	425.493	1.605	50	20	IDGD	
NS(=O)(=O)c1ccccc1NNC(=O)C1CCN(C(=O)OCc2ccccc2)CC1	788224488	UTIDHPBYXKQALC-UHFFFAOYSA-N	432.502	1.826	50	20	IDGD	
O=C1COc2ccc(C=NNC(=O)c3cccc(S(=O)(=O)N4CCCC4)c3)cc2N1	788698990	PLHZUGXAGZTPDO-UHFFFAOYSA-N	428.470	1.566	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)Nc1ccnc(Oc2ccc(F)cc2F)c1	788740054	VITWCYYKFLLJBB-SNVBAGLBSA-N	426.401	1.740	50	20	IDGD	
O=C(NNC(=O)C(=O)NC1CC1)N[C@H]1CCCN(c2ccc(Cl)cc2Cl)C1=O	788916507	LRPFFAWIADKNOU-LBPRGKRZSA-N	428.276	1.098	50	20	IDGD	
COc1cc(NNC(=O)CNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)ccc1Cl	790179831	AWUSQZUCOUKNAV-UHFFFAOYSA-N	440.909	1.472	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(N3CCC3=O)c2)cc1OC	790951583	JQEHAGGBUFPPIL-UHFFFAOYSA-N	426.429	1.230	50	20	IDGD	
O=C(NNc1cccc(F)c1[N+](=O)[O-])C(=O)Nc1ccc(CCN2CCOCC2)cc1	790993866	LGMLWYFJKQWYLJ-UHFFFAOYSA-N	431.424	1.690	50	20	IDGD	
O=C(NNC(=O)c1ccnn1-c1ccccc1)c1cccc(S(=O)(=O)N2CCCC2)c1	791445283	JPWQUJIXINZNDR-UHFFFAOYSA-N	439.497	1.732	50	20	IDGD	
O=C(O)c1ccc(S(=O)(=O)NNC(=O)c2ccc3c(c2)OCO3)c(OC(F)(F)F)c1	792700025	XCWRZZNXXRELAY-UHFFFAOYSA-N	448.331	1.635	50	20	IDGD	
N#Cc1cc(C(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)ccn1	792854400	XNISABVLEVMLDR-UHFFFAOYSA-N	427.467	1.890	50	20	IDGD	
COc1c(NC(=O)C(=O)NNC(=O)c2cccc3cccnc23)cc(Cl)cc1C(N)=O	793026293	PTRKBJGPRHXMLM-UHFFFAOYSA-N	441.831	1.395	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNS(=O)(=O)c2cnc(C)c(C(=O)OC)c2)cc1	793350251	KERFDNFMWHVZEI-CYBMUJFWSA-N	437.474	1.352	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)c1ccc(S(C)(=O)=O)c([N+](=O)[O-])c1	794704386	PELREWVXCSSSOZ-UHFFFAOYSA-N	427.822	1.735	50	20	IDGD	
CCc1ccc(N2C[C@@H](C(=O)NNc3ccccc3S(=O)(=O)N(C)C)CC2=O)cc1	795180707	AIJRQOFZFCRUGO-INIZCTEOSA-N	430.530	1.996	50	20	IDGD	
CCNC(=O)N(C)c1cccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)c1	796990682	VHDVRDIAWKUDCV-ZDUSSCGKSA-N	445.451	1.545	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNC(=O)C(=O)Nc1cccc(Br)c1	797369356	SZWSIWCJXVUTCE-UHFFFAOYSA-N	449.261	1.461	50	20	IDGD	
Cn1ncc2c1C[C@@H](C(=O)NNC(=O)CN1CCN(Cc3ccc(Cl)cc3)CC1)CC2	798980346	MNRBVBCHRYDDSM-KRWDZBQOSA-N	444.967	1.144	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2c(C(F)(F)F)nn(CCO)c2C(F)F)cc1	801105289	CETFREMXXUMFKL-UHFFFAOYSA-N	449.336	1.540	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H](Cc2ccccc2)NC(=O)c2cccnc2)cc1	801109304	JMZOSROGDQSJNI-FQEVSTJZSA-N	445.479	1.517	50	20	IDGD	
NS(=O)(=O)c1ccc(Br)c(C(=O)NNC(=O)Nc2cc(F)cc(F)c2)c1	802004602	IMFIRSNEKMOYSH-UHFFFAOYSA-N	449.233	1.841	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(O)c(C(=O)NNC(=O)Nc2ccc(OC(F)F)cc2)c1	802043652	LFGBRSDKOKWHGT-UHFFFAOYSA-N	444.416	1.710	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)c2cnc3c(c2)c(O)nc(=O)n3C)cc1Cl	802076871	ZMPGPYXTUTWSDV-UHFFFAOYSA-N	448.823	1.171	50	20	IDGD	
O=C(CCS(=O)(=O)c1ccc2c(c1)OCCO2)NNC(=O)Nc1ccc2c(c1)OCO2	802102155	FMTUXBASJCJWTF-UHFFFAOYSA-N	449.441	1.203	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2ccc(-n3ccnc3)nn2)n(-c2cccc(Cl)c2)n1	807429883	ZXMXZYPFIBRZAV-UHFFFAOYSA-N	437.851	1.892	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)NC2CCC3(CC2)NC(=O)NC3=O)c(C)n1-c1ccccc1	807546119	PTWMNJGXAUBJBX-UHFFFAOYSA-N	438.488	1.559	50	20	IDGD	
CCCn1nc(C(=O)NN=Cc2ccc(S(N)(=O)=O)c(Cl)c2)c2ccccc2c1=O	807953065	QEOSCIPZVXGKEM-UHFFFAOYSA-N	447.904	1.871	50	20	IDGD	
COc1cc(C(=O)NNC(=O)N[C@@H]2CCC[C@@H]3CN(C(C)=O)C[C@H]32)cc(OC)c1OC	808185628	BMIGYRQMIBIMBT-FVQBIDKESA-N	434.493	1.303	50	20	IDGD	
O=C(NNC(=O)c1ccnc(C(F)(F)F)c1)c1ccc(S(=O)(=O)N2CCCC2)cc1	808372362	NNGWIVCIXRBPJP-UHFFFAOYSA-N	442.419	1.960	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@H]2CCN(c3ccccc3F)C2)cc1	809983642	MJYWGDKEDUUVNG-INIZCTEOSA-N	448.520	1.429	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCN(c2snc(C)c2C#N)CC1	810065235	NDOSNZRQCZFEPA-UHFFFAOYSA-N	448.936	1.568	50	20	IDGD	
Cc1onc(N)c1S(=O)(=O)NC(=O)/C(C#N)=C\c1cc(C)n(C[C@H]2CCCO2)c1C	810828355	QBJYLGOYPRUJON-MVMZHWFQSA-N	433.490	1.575	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)[C@H](O)c2ccc(Cl)cc2F)cc1OC	811368295	ZYYSQEQEIGYSKU-QGZVFWFLSA-N	440.811	1.534	50	20	IDGD	
COC[C@]1(CNC(=O)NNC(=O)CSc2ccccc2O)OCCc2ccccc21	811919854	CETXWPYJVXGAQW-NRFANRHFSA-N	431.514	1.929	50	20	IDGD	
COC(=O)c1cc(Br)cc(C(=O)NNC(=O)c2nnc(O)c3ccccc23)c1	812444598	CISOJCDYFRGZNI-UHFFFAOYSA-N	445.229	1.959	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2nc(-c3ccco3)cs2)cc1	813033621	CANJHEDZLKMQDS-UHFFFAOYSA-N	435.487	1.735	50	20	IDGD	
C[C@@H](NC(=O)NNc1nc(O)c2cnn(C)c2n1)c1ccc(N2CCCNC2=O)cc1	813241599	IINJAYTUOGAGOH-LLVKDONJSA-N	425.453	1.376	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1ccc(Br)s1)c1cccc(S(N)(=O)=O)c1	813539812	ALCQAMDOFGCGBO-MRVPVSSYSA-N	447.336	1.863	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)c2c(Br)nnn2C)cc1Cl	813575672	ZXMVAPXEISNJNJ-UHFFFAOYSA-N	433.650	1.715	50	20	IDGD	
CC(C)CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)NNC(=O)Nc1ccc(OC(F)F)cc1	813575942	HVFVPUOKCIQAFB-OAHLLOKOSA-N	438.435	1.937	50	20	IDGD	
COC(=O)c1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)[nH]1	814194281	RGSSRWMFCKRALY-UHFFFAOYSA-N	434.474	1.051	50	20	IDGD	
C[C@H](C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1)[C@@H]1OCCc2sccc21	814222703	RRRXSBPOCDDVKH-VFZGTOFNSA-N	443.934	1.760	50	20	IDGD	
N#C[C@@H]1CCCC(=NNC(=O)C[C@H](C(=O)NN=C2CCC[C@@H](C#N)C2)N2CCOCC2)C1	814854996	COSKCZKSQYOZEC-MBOZVWFJSA-N	441.536	1.449	50	20	IDGD	
CCOC(=O)c1cc(COC)cc(NC(=O)C(=O)NNC(=O)Cc2ccccc2C)c1	815570385	AWFGWBCDQIWTDM-UHFFFAOYSA-N	427.457	1.647	50	20	IDGD	
COC(=O)N1CCN(c2ccc(NC(=O)C(=O)NNc3c(C)cccc3F)cn2)CC1	815573720	RJNXTGSJYUVLDU-UHFFFAOYSA-N	430.440	1.499	50	20	IDGD	
CCOc1ccc(NNC(=O)C(=O)Nc2ccccc2N2CCC(C(N)=O)CC2)cc1	815815943	ZVGOTQJPUAOUAG-UHFFFAOYSA-N	425.489	1.869	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)c1sccc1S(=O)(=O)N(C)C	817054422	IWRNROMJKYWAQG-UHFFFAOYSA-N	432.549	1.006	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)c1ccc(F)c(S(=O)(=O)N2CCCC2)c1	819728377	XFOLBFYOFHSTDI-UHFFFAOYSA-N	431.486	1.160	50	20	IDGD	
CCCC[C@H](/N=C1/NS(=O)(=O)c2ccccc21)C(=O)NNC(=O)NC1CCCCC1	836541660	IHZDTYVWYOYUIG-INIZCTEOSA-N	435.550	1.947	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNS(=O)(=O)c2ccc3c(c2)C(=O)N(C)C3=O)cc1	861630558	SQVAKABFGARFAS-LBPRGKRZSA-N	447.469	1.088	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)c1cnc2c(c1)c(O)nc(=O)n2C1CC1	879609793	IAOXIRZTAFXRED-SNVBAGLBSA-N	427.392	1.200	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(Br)cc1)NNC(=O)c1ccc(Cl)cc1	913108918	XZOBKOOBBHSZOU-UHFFFAOYSA-N	446.710	1.842	50	20	IDGD	
COc1cc(C(=O)N([C@@H]2CCS(=O)(=O)C2)N(C)C)ccc1OCc1cscn1	914437432	LFWQVITVWBMBLW-OAHLLOKOSA-N	425.532	1.837	50	20	IDGD	
O=C(NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)o1)c1cc(Br)c[nH]1	914751145	IOBAYOBEFSXPRT-UHFFFAOYSA-N	431.268	1.230	50	20	IDGD	
COc1cc2cc(C(=O)NNC(=O)[C@@H]3COc4ccccc4O3)[nH]c2c(OC)c1OC	914780503	NCOJSAJOSXNIHM-INIZCTEOSA-N	427.413	1.795	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)CCc1c(C)c2c(C)nn(C)c2[nH]c1=O	914857597	JACOYGYZVCZNRQ-UHFFFAOYSA-N	425.489	1.600	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)[C@@H](C)N1C(=O)[C@H]2CCCC[C@H]2C1=O	915775733	NWXYBBZXCSKOPJ-KFWWJZLASA-N	425.489	1.310	50	20	IDGD	
CCCCOCCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	915887992	ITZJMBWSFRBDFN-UHFFFAOYSA-N	426.539	1.622	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)NCc1ccc(CN2CCN(C)CC2)cc1	916388147	WICHOWGVUQUOFL-UHFFFAOYSA-N	439.560	1.906	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)COc1ccccc1C#N)N1CCN(c2ccccc2)CC1	916514441	DZCVUFMDIKDUHH-SFHVURJKSA-N	436.516	1.478	50	20	IDGD	
CC(=NNC(=O)c1cccc([N+](=O)[O-])c1)c1ccc(S(=O)(=O)NCCCN(C)C)cc1	917530703	WTQJMBVOOYHEJD-UHFFFAOYSA-N	447.517	1.979	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)NCc2ccc(C(=O)NCC(N)=O)cc2)c1C	918598219	UECKEOHCTWTTQI-JAIQZWGSSA-N	437.500	1.190	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)[C@@H](C)NC(=O)c2ccc(Br)s2)c1O	919756461	KGIKPIKVWDQBGP-MRVPVSSYSA-N	442.291	1.804	50	20	IDGD	
Cc1ccc(-n2cnnn2)cc1NC(=O)NNc1ccc(S(=O)(=O)NC(C)C)cn1	919896835	WQNAPWBSJFRUPQ-UHFFFAOYSA-N	431.482	1.201	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@H](CCSC)N2C(=O)[C@H]3CCCC[C@H]3C2=O)cc1	1115817503	IPQHTQRMGGTREL-BBWFWOEESA-N	433.530	1.753	50	20	IDGD	
CCn1c(NNC(=O)c2ccc(N3CCC[C@H](C(N)=O)C3)cc2)nc2ccccc2c1=O	1115884068	FQWUTNRGZKNXHS-INIZCTEOSA-N	434.500	1.875	50	20	IDGD	
O=C(CNC(=O)c1ccccc1OC(F)F)NNC(=O)c1cncn1-c1ccccc1	1317711738	HFGXBBGJXKKORP-UHFFFAOYSA-N	429.383	1.665	50	20	IDGD	
Cn1ncc(C(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)c1Br	1320533573	WOKQWHYKWVKHHF-UHFFFAOYSA-N	430.303	1.591	50	20	IDGD	
O=C(NCCNS(=O)(=O)c1ccccc1)NNC(=O)c1ccc(Br)cc1	1322064066	PXMFKSVMYNUYEC-UHFFFAOYSA-N	441.307	1.372	50	20	IDGD	
Cc1cc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c(C)n1CC1CC1	1338575910	UZKSLKUCUAYDGX-IBGZPJMESA-N	427.457	1.659	50	20	IDGD	
Nc1cnnc(NNC(=O)N[C@H]2CCCN(Cc3ccc(F)cc3F)C2=O)c1Cl	1343421742	MXHZXIPOIJLLMK-ZDUSSCGKSA-N	425.827	1.808	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc4cccnn4n3)C2)C1	1779963747	SUSIOSIWJNKBTE-SCLBCKFNSA-N	436.310	1.204	50	20	IDGD	
Cc1ccc(O)c(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C3)c1	1780329032	PYESDFKLRCZAAI-AUSIDOKSSA-N	446.548	1.201	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H]2CCCN(C)C2)C1	1780569012	XRYQCJBIKUQBAI-MIALQEHNSA-N	444.414	1.873	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)Cc3ccc(C)c([N+](=O)[O-])c3)C2)C1	1781306063	ACZPKMIPGZRTJO-UZLBHIALSA-N	439.896	1.529	50	20	IDGD	
O=C(c1n[nH]c2ccccc12)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781331360	IYVWZOSMWCHKKQ-WMLDXEAASA-N	425.258	1.697	50	20	IDGD	
O=C(CNc1ccc(F)cc1)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781331820	XWIFIWUBLREBDU-RDJZCZTQSA-N	432.265	1.758	50	20	IDGD	
Cc1cccn2ncc(C(=O)N3CCO[C@@]4(CCN(C(=O)[C@@H](F)Br)C4)C3)c12	1781332282	FUUPLRXHNYZBLI-CRAIPNDOSA-N	439.285	1.777	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)CNC(=O)OC(C)(C)C)C2)C1	1783395204	ZKTGAAOTHABBQA-UGSOOPFHSA-N	448.358	1.372	50	20	IDGD	
O=C(C[C@H]1CNc2ccccc2O1)N1CCO[C@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783946174	JIUIEDUJCIMCFH-ORAYPTAESA-N	428.316	1.883	50	20	IDGD	
Cc1ccn(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]3C2)n1	1783969266	KBBOTUPMIOYWDV-OEAJRASXSA-N	427.343	1.202	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)COc3ccc(Cl)c(F)c3)C[C@@H]21)[C@@H](O)CCl	1784086020	RLKAINBCMYJVPI-SCTFDZSOSA-N	449.306	1.437	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)cc1	1785107893	RYHLBHBUCCRJHY-BFUOFWGJSA-N	438.322	1.872	50	20	IDGD	
CN(C)C(=O)c1cccc(C(=O)N2CC[C@@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)c1	1785283347	JRSALNBPYDDKJB-JOCHJYFZSA-N	447.608	1.683	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H]1C[C@H](C(=O)N2CC[C@]3(CN(C(=O)[C@@H](F)Cl)CCO3)C2)C1	1785512661	ASMOGDICSFSKNW-QGDIXAPHSA-N	433.908	1.654	50	20	IDGD	
CCOC(=O)C(C)(C)C(=O)N1CC[C@@]2(CN(C(=O)[C@H](Br)CC)CCO2)C1	1785525156	KRHRZAVQFMZPSA-FZKQIMNGSA-N	433.343	1.579	50	20	IDGD	
Cc1nc(O)c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCBr)C[C@@H]32)nc1C	1785570937	AFAMKVRXXLVMDX-IHRRRGAJSA-N	441.326	1.177	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cn3cc(Cl)cn3)[C@H]2C1	1787004644	GSZHYRBTUDUGIP-IMIFBBOLSA-N	433.734	1.300	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C[C@@H]3CNc4ccccc4O3)C[C@@H]21)[C@H](F)Cl	1787446653	VDRCLOCQHIWJDR-XYKJDMJCSA-N	425.888	1.764	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3C[C@@H]3C3CC3)C[C@@H]21	1787506821	OPYRYSIGHDMBPD-BJQHLOBUSA-N	441.532	1.146	50	20	IDGD	
CC[C@H](NC(C)=O)C(=O)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1	1788140035	BPAYVNLPYFMSIE-FQEVSTJZSA-N	437.305	1.029	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4c(c3)CNC4=O)[C@H]2C1	1788441171	MZOFABNFGAQZEW-FZDIXFNVSA-N	433.936	1.931	50	20	IDGD	
CCc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)Br)C[C@@H]32)nn1C	1789069293	VJCQGWODHFELIZ-DUPGQFARSA-N	427.343	1.359	50	20	IDGD	
COc1cc(F)c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](O)CCl)C[C@@H]32)c(F)c1	1790102062	RQIRLHCZWGDHKH-SPGJAERMSA-N	432.851	1.166	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(=O)cco3)C[C@@H]21	1790961648	SYFZCBVSRSBECV-PCBIJLKTSA-N	427.295	1.407	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4c(cnn4C)c3)C[C@@H]21	1791056441	YVWCZBXTHZKMMP-GKEYINFOSA-N	449.349	1.950	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)Br)C[C@@H]21	1791063586	MCIPYGBPJQSTQI-OSUNSFLBSA-N	426.149	1.533	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3cccc(OC)n3)C[C@@H]21	1791252113	CIBKEGTYMQDWSX-DKIMLUQUSA-N	439.940	1.256	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3nnc(C)s3)C[C@@H]21	1791252210	DOYLZHWLYXYYQU-XQLPTFJDSA-N	430.958	1.013	50	20	IDGD	
COc1ccccc1OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CO[Si](C)(C)C)C2	1792721224	QHYWLHAQCSELMW-VPTLXERWSA-N	436.581	1.515	50	20	IDGD	
C[C@@H](O)[C@H](NC(=O)c1ccccc1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](F)Cl)C2	1792879479	PJHKMEDPZMBSEO-NSCXZMNLSA-N	425.888	1.338	50	20	IDGD	
C[C@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)n1cccc1C=O	1795750715	WDRQEUNOKXUFPB-GGUBGCTKSA-N	430.274	1.142	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccnc(OCC(C)C)c1	1796462366	VOGSFQMGDSVEBC-SFNKJDCFSA-N	439.940	1.573	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ncc(F)cc1F)C2	1796890868	NQFSSMJVPZUOLV-JGJQQFHASA-N	444.442	1.746	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnn2cccnc12	1797367568	REEVIFISIMRDNK-NEBZKDRISA-N	436.310	1.106	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccn2ccnc12	1798115302	RDFOOLCCVPGOAI-CKFWPPNZSA-N	447.499	1.720	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc3ccoc3cn1)C2	1798442785	DSKLEOPAYNZZMS-QDMKHBRRSA-N	434.456	1.392	50	20	IDGD	
COc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Cl)C3)cc(C(F)(F)F)n1	1798513688	LZBCDBCQYYRBRU-RDBQEKCUSA-N	439.793	1.847	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnn2c1CCC2	1799963100	YIDVEQQGSPUUFS-NFFDBFGFSA-N	425.327	1.064	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2nn[nH]c2c1	1800143775	BSEAIWRFSUUHQM-ABXQLRGKSA-N	426.304	1.397	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c[nH]c3cnccc13)C2	1800642066	UZCXCLRVVHPXIV-DJZPMSPPSA-N	435.322	1.940	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3cccnn3c1)C2	1800642991	IABCENRBPULDJM-FSDCSDTHSA-N	435.322	1.711	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1ccc(C)c(F)c1)C2	1800970879	LVXHIRFJQWAPHW-CLWJZODNSA-N	426.916	1.910	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c(C(C)C)nn3ccccc13)C2	1800975110	JESCVSLHUPCKKC-UIVXKWKOSA-N	448.951	1.915	50	20	IDGD	
CC[C@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](C)N1CCN(C)CC1)C2	1801804167	UFNVGJAGZRXTPO-UUAJXVIYSA-N	429.403	1.434	50	20	IDGD	
O=C(Cc1cc(F)ccc1F)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2	1801975856	LTZLOYUKHHPWRX-OJXGSEEGSA-N	435.240	1.787	50	20	IDGD	
Cn1ncc2c(C(=O)N3CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]3c3cccnc3)cccc21	1803142792	JINLZUVRFVNDIL-CDHQVMDDSA-N	441.919	1.888	50	20	IDGD	
Cc1nn(C)c(C)c1CC(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1	1803145742	IADQWHDJEUGXMU-KPFFTGBYSA-N	433.940	1.280	50	20	IDGD	
O=C(CSc1ccncc1)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1	1804351023	NGFPTDZYXBRZPQ-IEZWGBDMSA-N	434.949	1.874	50	20	IDGD	
O=C(c1cccc(-n2cncn2)c1)N1CCC2(CCCN(C(=O)[C@H](O)CCl)C2)CC1	1805525917	BEIGZADESJKEIJ-GOSISDBHSA-N	431.924	1.712	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@@H](CNC(=O)CS(C)(=O)=O)[C@@H]1c1cccnc1	1806763384	DAUQSMBHWDUVSY-INWMFGNUSA-N	446.367	1.163	50	20	IDGD	
CC[C@H](C(=O)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1)N(CC)CC	1809968910	HHRNHFAFQXHWRV-OAQYLSRUSA-N	443.397	1.332	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)c2ccco2)[C@@H]1c1cccnc1	1810297761	DLPLOYVHLVCIEY-DNVCBOLYSA-N	434.456	1.307	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)C(Cl)Cl)[C@H]1c1cccnc1)C(=O)Nc1cccnc1	1810465605	ORWLSMZSFFQKAU-ZFWWWQNUSA-N	436.299	1.925	50	20	IDGD	
CCC(C)(C)C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1	1812611538	VDDLGFDAJKKGTG-APWZRJJASA-N	438.532	1.836	50	20	IDGD	
Cc1noc(C)c1C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1813070143	GLKPVVRZXCELSR-DYESRHJHSA-N	442.520	1.379	50	20	IDGD	
C/C(=C/C(=O)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@H]1c1cccnc1)C(=O)O	1814097017	ZLHNVHSECUBOCV-DGWYVEKVSA-N	428.258	1.809	50	20	IDGD	
CN1N=C(C(=O)Nc2cc([C@H]3CCCCN3C(=O)[C@H](F)Br)[nH]n2)CCC1=O	1815622619	NKIVDMRIYMLMMH-RISCZKNCSA-N	443.277	1.701	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)CCc2cnc[nH]2)n[nH]1	1815827455	YUVJAAVSKUBSKH-INIZCTEOSA-N	430.513	1.131	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)C/N=C/c2ccco2)[nH]n1)c1cccc(B(O)O)c1	1817476148	HLWFPXLSIVUHSK-NZYROCMPSA-N	449.276	1.108	50	20	IDGD	
Cc1cc2nnc(C(=O)Nc3cc([C@@H]4CCCCN4C(=O)[C@@H](O)CCl)[nH]n3)c(C)n2n1	1818587933	LWKDOGXHXZVGST-KBPBESRZSA-N	446.899	1.370	50	20	IDGD	
CNC(=S)NCCC(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](C)Br)[nH]n1	1819409047	QIDWTTFMMWHERL-CMPLNLGQSA-N	445.387	1.669	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](O)CCl)CC2)c1cccn(C(F)F)c1=O	1820249535	CAMCKBJSTDCJTI-GZMMTYOYSA-N	446.863	1.525	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2CNC(=O)C2)[nH]n1	1822090678	NDXVWIRFROLMEN-GVXVVHGQSA-N	426.315	1.711	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3c4c(nn3C)CCC4)sc2C1	1824245690	YEDLDEWRSMYUDH-JQWIXIFHSA-N	437.953	1.845	50	20	IDGD	
Cc1cc[nH]c1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1	1825530528	OYHPTPDCAJZORR-LJQANCHMSA-N	438.532	1.869	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](C)O)sc2C1	1825623964	KCZLSSHEGJHIBH-KOLCDFICSA-N	448.457	1.583	50	20	IDGD	
N[C@@H](Cc1cccnc1)C(=O)N[C@@H]1CCc2nc(NC(=O)C(Cl)Cl)sc2C1	1826099365	YJERYEOQERRMLK-MNOVXSKESA-N	428.345	1.824	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(O)cn2)CC1	1826217948	MIXFUNXALMDCQR-IBGZPJMESA-N	431.537	1.394	50	20	IDGD	
CC(=O)OC[C@H](OC(C)=O)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H](F)Cl)CC1	1827609615	VTLPSJHCYHYONZ-IXDOHACOSA-N	434.892	1.635	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC([C@H]2CCCCN2C(=O)C2=NNC(=O)C2)CC1	1828863081	HLCNIUUZKQJLNV-DZGCQCFKSA-N	427.343	1.656	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4c(c3)CNC4=O)C2)C1	1830361778	CLDKWBIEIUQDCW-QFIPXVFZSA-N	449.935	1.265	50	20	IDGD	
COc1nc(C)ccc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830364264	DRTMETPXMFINTJ-NRFANRHFSA-N	439.940	1.734	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CSC3CCCC3)CCO2)C1	1831365112	ZXBFUCXDTUHFDJ-LPHOPBHVSA-N	434.986	1.372	50	20	IDGD	
CC[C@@H](C(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1)N(CC)CC	1831662166	NLTOGXNYFZXMHZ-LAUBAEHRSA-N	432.005	1.828	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)Cc2cccnc2)CC1	1831871208	NGLQQEAMHSFMCD-HXUWFJFHSA-N	429.565	1.617	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)c1	1832436905	DIOCOCQBHNWARG-QUCCMNQESA-N	428.888	1.673	50	20	IDGD	
C=CCSCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)CBr)C2)C1	1832446963	NMVYJASWLUCZTH-PBHICJAKSA-N	435.384	1.393	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cnc4ccccc4n3)CC2)CC1)[C@H](O)CCl	1833310223	LVWVMWMYZAMARZ-HXUWFJFHSA-N	445.951	1.415	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)Cn3cncn3)CC2)CC1	1833534065	ZYJVAGNVYUWWIV-LPHOPBHVSA-N	439.004	1.893	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)Cn3nc(C)cc3C)CC2)CC1	1833838654	FPXXLDHZGYOOOH-IBGZPJMESA-N	439.988	1.325	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnoc3C3CC3)CCO2)C1	1834616855	YDWZJZGSSVMFML-XIKOKIGWSA-N	442.310	1.405	50	20	IDGD	
CC1(C(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)CCCC1	1834798077	RJMVWDXRHKGCIA-UHFFFAOYSA-N	441.381	1.132	50	20	IDGD	
O=C(Cn1cccn1)NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1	1834884215	PFXSKPBFGJMLAF-INIZCTEOSA-N	430.322	1.145	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)/C=C/c3cccs3)CCO2)C1	1835968401	IIEKEFUHYROODZ-CHYGHELMSA-N	428.938	1.472	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3cccnc3)CCO2)C1	1836181257	GOISBCSDRZWYQP-DNVCBOLYSA-N	440.338	1.254	50	20	IDGD	
O=C(c1ccn2nccc2c1)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836717286	RYVUXZPUSUWWLF-LJQANCHMSA-N	434.924	1.546	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)C3(Br)CC3)C2)C1	1837715070	UHCJUCZAGBAPIB-INIZCTEOSA-N	449.418	1.222	50	20	IDGD	
CCn1nc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)cc1C	1838152620	OVRVDIIQOQSOHG-RDTXWAMCSA-N	443.342	1.065	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(N(C)C)nc3)CCO2)C1	1838192487	LENKLJSWIFRNKC-UTKZUKDTSA-N	438.956	1.625	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@H](C)N3CCN(C)CC3)CC2)CC1	1838627086	ISXHWOKVOLKHQZ-FXAWDEMLSA-N	443.032	1.638	50	20	IDGD	
O=C(c1ccc(F)cc1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1838956733	UPKRDFWOQWXDHD-WMLDXEAASA-N	433.249	1.586	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)cc1	1838984942	CHJAJYZRTPTOHF-HNAYVOBHSA-N	425.323	1.848	50	20	IDGD	
O=C(Cc1cccc(F)c1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839199207	KFXWLGXGHKMXQM-FUHWJXTLSA-N	447.276	1.515	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)ccn1	1839201130	WULCHWZBLFWILD-PBHICJAKSA-N	430.274	1.151	50	20	IDGD	
CCN(CC)C[C@@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1	1839678455	XZVHIIYJMLVCOT-NQIIRXRSSA-N	443.661	1.272	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3csnc3C)C2)C1	1839962808	RGMXUVZBKGWUTM-YOEHRIQHSA-N	446.367	1.695	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)COc3ccc(C)cc3)C2)C1	1840151575	GRCSLFUVXNVJQT-RXVVDRJESA-N	440.924	1.084	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cc(F)cc(F)c3)C2)C1	1840152134	XYWURGVGKXFCBD-YLJYHZDGSA-N	446.878	1.218	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3ccc(F)cc3)C2)C1	1840155501	DMYVKUIPBXHLNX-RXVVDRJESA-N	442.915	1.469	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(F)c(F)c3C)C2)C1	1840156871	XCSGETACDOLBSV-MGPUTAFESA-N	446.878	1.597	50	20	IDGD	
O=C(c1ccc2cnccc2n1)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840187520	GRMNTDAUDXSUBE-LJQANCHMSA-N	439.299	1.504	50	20	IDGD	
CC1(C)C=C(C(=O)N2CC3(CCCN3C(=O)[C@H](O)CCl)C2)CN1C(=O)c1ccccc1	1841353806	QPGVEHSSMNMSCD-GOSISDBHSA-N	445.947	1.651	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1ccc(F)c(C)c1N)C2	1843415738	HBXGLHUTBNCQFU-VULFUBBASA-N	440.479	1.667	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)[C@@H](C)Nc1ccccc1)C2	1843416196	JSQQTDFQZBANHX-MSZQUAHTSA-N	436.516	1.824	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H]2C[C@H](C(=O)N3CCCC34CN(C(=O)[C@@H](F)Cl)C4)O[C@H]2C1	1846149270	KUBHLINDFVZXMY-APIJFGDWSA-N	445.919	1.749	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2cccc3c2CCCC3)C1	1846837760	RGVPYTZNZUYASP-UHFFFAOYSA-N	433.512	1.695	50	20	IDGD	
NC(=O)c1ccc(SCC(=O)NNC(=S)NCCc2cccs2)c([N+](=O)[O-])c1	11513708	ASBSHCFPUCUDNE-UHFFFAOYSA-N	439.544	1.585	50	20	IDGD	
Nc1c(Cl)c(Cl)nc(C(=O)NNC(=S)NCCCN2CCOCC2)c1Cl	16273799	HJWPYSQRIJYSDO-UHFFFAOYSA-N	441.772	1.455	50	20	IDGD	
C[C@@H]1CC(C)(C)C[C@@]2(C1)NC(=O)N(CC(=O)OCC(=O)NNC(=O)c1ccccc1)C2=O	22208575	NHMASVQBISNZDC-JLCFBVMHSA-N	444.488	1.128	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)CCn2cnc3sc(C)c(C)c3c2=O)c1	23399019	SNQJNFBCJOHANZ-UHFFFAOYSA-N	430.486	1.943	50	20	IDGD	
NS(=O)(=O)c1ccc(Br)c(C(=O)NNc2nc(-c3ccncc3)no2)c1	726370739	LLKUNMRMPMCOET-UHFFFAOYSA-N	439.251	1.298	50	20	IDGD	
CCN(CCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(CC)CC)c1)C(C)C	726713575	ICQAJNZOCRXQER-UHFFFAOYSA-N	427.571	1.391	50	20	IDGD	
Cc1noc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)n1	727229551	BVJVRVBQRWWJGH-UHFFFAOYSA-N	444.473	1.001	50	20	IDGD	
CCOc1ccc(S(=O)(=O)Nc2ccc(C(=O)NNS(=O)(=O)C3CC3)cc2)cc1	727350218	UQUBSEYUDXYISL-UHFFFAOYSA-N	439.515	1.613	50	20	IDGD	
COc1ccc(C(=O)NNc2nc(-c3ccncc3)no2)cc1S(=O)(=O)NC(C)(C)C	728073988	WBSMPTOIMPHRRP-UHFFFAOYSA-N	446.489	1.974	50	20	IDGD	
CNC(=O)c1cccc(CNC(=O)NNC(=O)c2cc(OC)ccc2Br)c1	728744662	BKKXDBOZPOYLJV-UHFFFAOYSA-N	435.278	1.962	50	20	IDGD	
O=C(CS[C@H]1CCS(=O)(=O)C1)NNC(=O)c1ccc(Br)cc1Cl	728870406	HZUIFNWGXFAQJR-VIFPVBQESA-N	441.756	1.784	50	20	IDGD	
O=C(NNC(=O)N1CCO[C@@H](c2ccc(F)c(F)c2)C1)C1CCN(c2ncccn2)CC1	728961949	SJLWQFAKZRIOKO-GOSISDBHSA-N	446.458	1.786	50	20	IDGD	
CC(C)[C@@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)N1CCCCC1	729295117	BRRNUZCJPRRETB-IBGZPJMESA-N	436.578	1.743	50	20	IDGD	
CCOc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)Cc3cc[nH]n3)c2)cc1	730103078	WJJYPJQXZOQOLX-UHFFFAOYSA-N	443.485	1.613	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)Cc2c(C)nc3[nH]n(C)c(=O)c3c2C)c1C	730103503	FYKSLWSKSNWGJX-HNNXBMFYSA-N	425.489	1.653	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)CC1(CC(=O)Nc2nccs2)CCCCC1	730282713	NKACXERPJXMDAO-UHFFFAOYSA-N	447.517	1.983	50	20	IDGD	
Cc1nc2c(s1)C(=NNC(=O)c1cccc(S(=O)(=O)N3CCOCC3)c1)CCC2	730945249	CSQDFNRWTCOLEA-UHFFFAOYSA-N	434.543	1.943	50	20	IDGD	
C[C@H]1C[C@@H](C)CN(C(=O)CN2CCN(C(=O)NNC(=O)C(C)(C)c3ccccc3)CC2)C1	731220991	CDRXVHQMRUBFAN-KDURUIRLSA-N	443.592	1.827	50	20	IDGD	
CC[C@H](N=c1nn[nH]n1-c1ccccc1)C(=O)NNC(=O)Cc1cccc2ccccc12	731471539	YBVYQXXLRVBLSS-FQEVSTJZSA-N	429.484	1.818	50	20	IDGD	
O=C(CN1CCS(=O)(=O)CC1)NNc1ccc(Br)cc1C(F)(F)F	731477446	HKBXIUAVAUVRBG-UHFFFAOYSA-N	430.246	1.641	50	20	IDGD	
CS(=O)(=O)CCN1CCC(NC(=O)NNC(=O)CC23CC4CC(CC(C4)C2)C3)CC1	731686963	SORQPEZTPKGILC-UHFFFAOYSA-N	440.610	1.432	50	20	IDGD	
O=C(Cc1ccc(S(=O)(=O)N2CCCCC2)cc1)NNc1nc(-c2cccnc2)no1	732111049	YNKMCMNMEHFOKS-UHFFFAOYSA-N	442.501	1.992	50	20	IDGD	
CCN(C)C(=O)c1cccc(C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c1	732339830	RSIPVNALIUEOFN-UHFFFAOYSA-N	428.401	1.305	50	20	IDGD	
O=Cc1ccc(OC(F)(F)C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1	732342309	SHFWQXXUQQUZRY-UHFFFAOYSA-N	437.311	1.383	50	20	IDGD	
O=C(C/N=C1/NS(=O)(=O)c2ccccc21)NNc1nc(-c2ccc(Cl)cc2)no1	732977204	FPXUJLNRBLATSH-UHFFFAOYSA-N	432.849	1.572	50	20	IDGD	
CNS(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c1	733170485	ZEFOILQWFJSVFI-UHFFFAOYSA-N	433.877	1.509	50	20	IDGD	
CC(=NNC(=O)c1ccc(O)c(Cl)c1)c1ccc(S(=O)(=O)N2CCNCC2)cc1	734093410	FJGSTHSTKABCMI-UHFFFAOYSA-N	436.921	1.794	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCC(C(=O)N3CCC(C)CC3)CC2)cc1OC	734153035	ZEBYQZZYJOLLIP-UHFFFAOYSA-N	446.548	1.435	50	20	IDGD	
CN(C)C(=O)[C@H]1CCC[C@@H](NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)C1	734220755	JKTGDJHZRMCNSG-RBUKOAKNSA-N	444.580	1.176	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)N[C@H]2CCC[C@H](C(=O)N(C)C)C2)nc1	734223121	YFENSWVWNGHIJE-KBPBESRZSA-N	426.543	1.041	50	20	IDGD	
CC(C)NC(=O)C(=O)NNC(=O)[C@@H]1CCC(=O)N(C)[C@@H]1c1ccc(C(F)(F)F)cc1	734418785	NKYLBDUOCIUCOU-UKRRQHHQSA-N	428.411	1.287	50	20	IDGD	
O=C(NCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNc1cc(F)c(F)cc1F	734653564	HTSPNDTZFUBVFE-UHFFFAOYSA-N	444.435	1.951	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2ccc(Br)o2)CC1	735117300	PNYSCEXONVZMGP-UHFFFAOYSA-N	444.311	1.130	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)NCc1cccc(S(=O)(=O)NCCOC)c1)c1ccccc1	735518421	JLFBZAHVRYYMDK-IBGZPJMESA-N	448.545	1.636	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@@H]2CN(Cc3ccccc3)CCO2)cc(OC)c1OC	741172263	PTDUOFFHWDHOMN-IBGZPJMESA-N	429.473	1.374	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1ccc(Oc2cccc(Cl)c2Cl)nn1	741895327	RPUXJHXJRHUQOH-SECBINFHSA-N	445.284	1.771	50	20	IDGD	
O=C(NNS(=O)(=O)N1CCCCC1)[C@H]1Cc2ccccc2CN1Cc1ccccc1	742029507	GAGFOJLSFWXRPX-OAQYLSRUSA-N	428.558	1.965	50	20	IDGD	
Cc1nn(C)c2sc(C(=O)N[C@H](C)C(=O)NNc3nc4ccccc4c(=O)n3C)cc12	742075570	CVBIWLDAAKUOJT-LLVKDONJSA-N	439.501	1.452	50	20	IDGD	
Cc1c(Br)cc(S(=O)(=O)NNC(=O)Cc2cccnc2)cc1[N+](=O)[O-]	743257365	LMEGWOOWQSPSTK-UHFFFAOYSA-N	429.252	1.613	50	20	IDGD	
CC1(C)C(=NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)[C@H]2CCCO[C@@H]21	743423829	XTISLISJEZOZBW-NQIIRXRSSA-N	449.573	1.947	50	20	IDGD	
COc1ccccc1O[C@H](C)CNC(=O)NNC(=O)c1sc(N2CCOCC2)nc1C	743510181	RBMNVOLTLNYNQV-CYBMUJFWSA-N	449.533	1.708	50	20	IDGD	
COc1ccccc1-c1noc([C@H](C)NC(=O)NNC(=O)[C@H]2COc3ccccc3O2)n1	743705734	UYUQJPWMKRLBBA-YVEFUNNKSA-N	439.428	1.977	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)[C@@H]2CCCN(C(=O)Nc3ccccc3)C2)cc1	744595070	WYWKEXBSUZGPIE-GOSISDBHSA-N	449.467	1.807	50	20	IDGD	
C[C@@H](CC(=O)c1cccc(F)c1)C(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	745399156	RUGPKZPJNDSAQM-LBPRGKRZSA-N	431.376	1.947	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CN2CCN(c3ccccc3OCCN(C)C)CC2)cc1	746463837	WZPPZKWIMKJHSV-UHFFFAOYSA-N	439.560	1.519	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)[C@@H]1CC(=O)N(c2ccc(F)c([N+](=O)[O-])c2)C1	746553506	LZXSIGWPJDXQGE-GFCCVEGCSA-N	440.391	1.125	50	20	IDGD	
COC(=O)c1ccsc1N1CC[C@H](NC(=O)NNC(=O)CCc2ccccc2)C1=O	746783096	ZZUKAYGYUYSGQM-HNNXBMFYSA-N	430.486	1.603	50	20	IDGD	
Cc1csc([C@](O)(CC(=O)NNC(=O)Cc2nc3ccccc3n2C)C(F)(F)F)n1	746818049	MLDHEODCMKNCNK-QGZVFWFLSA-N	441.435	1.868	50	20	IDGD	
CCS(=O)(=O)N1CCC(C(=O)NNC(=O)COc2ccc(Br)cc2)CC1	747473465	DXDLPZURWJSDBK-UHFFFAOYSA-N	448.339	1.037	50	20	IDGD	
COc1ccccc1C(=O)N[C@@H](CCS(C)(=O)=O)C(=O)NNc1ccc(C#N)cc1	748104882	LOTBJQZWUPCFJB-KRWDZBQOSA-N	430.486	1.243	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CC12CCOCC2)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	748527034	AOPRRCRRYPAVCQ-IBGZPJMESA-N	432.484	1.966	50	20	IDGD	
CCc1cc(N2CCC(NC(=O)NNC(=O)[C@@H](C)Oc3ccccc3F)CC2)ncn1	748663250	ITRKLFLLKJNOAQ-CQSZACIVSA-N	430.484	1.945	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN1C(=O)c1ccc2c(c1)OCO2)c1ccc2c(c1)OCCO2	749476777	HGYJJHPKNUTSRT-OAHLLOKOSA-N	439.424	1.252	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)c1cnn(-c2ccccn2)c1C(F)(F)F	751208963	JRWDSLXLHYXOEY-UHFFFAOYSA-N	438.391	1.539	50	20	IDGD	
COc1c(F)ccc(F)c1C(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1	755039796	GPRDAOLQVSZAKN-UHFFFAOYSA-N	427.429	1.364	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)Nc2cc(C)nn2[C@@H]2CCS(=O)(=O)C2)c1	755532825	MJILVFSEEQGRBN-OAHLLOKOSA-N	435.506	1.400	50	20	IDGD	
CON(C)S(=O)(=O)c1ccc(NC(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1	755535643	HFZHAQAYVLCKJK-UHFFFAOYSA-N	436.446	1.106	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)NCCN3C(=O)[C@H]4[C@H]5C=C[C@@H](C5)[C@H]4C3=O)n[nH]2)cc1	756104101	XNRGEOGGWFRRIL-STEAMIEHSA-N	448.483	1.136	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NC2CCN(S(=O)(=O)C(F)(F)F)CC2)cc1	756144823	BWRXDUFEFLNEFZ-UHFFFAOYSA-N	438.428	1.018	50	20	IDGD	
CCOC(=O)Cc1cccc(NC(=O)NNC(=O)c2nn(CC)c(=O)c3ccccc23)c1	756672433	OGZMRLADRNHJBH-UHFFFAOYSA-N	437.456	1.989	50	20	IDGD	
COc1cccc(OC)c1CC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	756901987	YKULOEOPEXHZDT-UHFFFAOYSA-N	426.517	1.606	50	20	IDGD	
CCS(=O)(=O)c1ccc(CCC(=O)NNC(=O)CCN2C[C@@H](C)O[C@H](C)C2)cc1	757720120	FXJZTCGCFRQSRO-HZPDHXFCSA-N	425.551	1.060	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Nc2ccc(-n3ncn(C)c3=O)cc2)ccc1OC(C)C	757862473	ITCGZDMUDQSMBO-UHFFFAOYSA-N	440.460	1.833	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)c1cc([N+](=O)[O-])ccc1SC1CCCC1	758030373	QBCGAERXBZAKLW-SNVBAGLBSA-N	430.508	1.328	50	20	IDGD	
CN(NC(=O)c1cccc(-n2ccnn2)c1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758782625	UOSBMNXRXIZPMU-UHFFFAOYSA-N	429.481	1.517	50	20	IDGD	
CC(C)Oc1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)ccn1	759677097	CPKOCSSCJMXPIC-UHFFFAOYSA-N	432.502	1.728	50	20	IDGD	
CC[C@H](C)n1ncc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1C1CC1	760627913	SSBWYMDJMKERSD-UGSOOPFHSA-N	442.472	1.876	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1c(C)nn(CC(F)F)c1C	760798459	QRRBRZPMRYEPSI-UHFFFAOYSA-N	428.465	1.441	50	20	IDGD	
O=C(NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12)c1cc2n(n1)CCCO2	761398794	DGPSMXPQZPMLEK-UHFFFAOYSA-N	444.451	1.499	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NN=C1C(=O)N(C)c2cc(N(C)C)ccc21	761769558	PRAAMALVDHMPRQ-UHFFFAOYSA-N	428.518	1.465	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)N[C@@H]2CCN(C(=O)C3CCCC3)C2)nc1	762386167	JKYSEGPCORYUNN-OAHLLOKOSA-N	438.554	1.186	50	20	IDGD	
Cc1n[nH]c(C)c1[C@H](C)CC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	763272398	JGFPQLSVMIMMSL-CYBMUJFWSA-N	433.534	1.766	50	20	IDGD	
Cn1ccnc1C(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2c[nH]c3ccccc23)cc1	763534507	HJABPNPORGJDRC-UHFFFAOYSA-N	430.424	1.532	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)cc1OC	763539591	NUWXRRHEVSDZFQ-UHFFFAOYSA-N	433.417	1.129	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(-n3cnnn3)c(C)c2)c2ccccc2n1	763613845	CUCLKSAHKCFZLD-UHFFFAOYSA-N	430.428	1.227	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cccc(Cn3cncn3)c2)c2ccccc2n1	763619284	QINJTBNILOFLRZ-UHFFFAOYSA-N	429.440	1.583	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(C(=O)N(C)C)c(C)c1	763682910	RLGREGGOGHEMBX-UHFFFAOYSA-N	442.472	1.260	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)N2CCCc3ccc(F)cc32)c2ccccc2c1=O	763785010	AJINVAPHSOVGIW-UHFFFAOYSA-N	437.431	1.296	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)C(=O)Nc1cccc(OC(F)(F)F)c1	763791465	SDESTBHYCNGOJG-UHFFFAOYSA-N	435.318	1.634	50	20	IDGD	
Cc1nc(COc2cccc(C(=O)NNC(=O)CNC(=O)c3cccnc3)c2)cs1	763819447	BCRLVCHKFXJECZ-UHFFFAOYSA-N	425.470	1.617	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)C(=O)Nc2ccnn2CC)c2ccccc2c1=O	763821583	UMSUUFGMEQBJMQ-UHFFFAOYSA-N	439.476	1.203	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccc(Oc2cccnc2)nc1	763866862	YHHJEAGRGBNFNW-CYBMUJFWSA-N	439.403	1.961	50	20	IDGD	
C[C@H]1CN(c2ccccc2NC(=O)C(=O)NNC(=O)Cc2ccc(F)cc2)C[C@H](C)O1	763919975	XEVXEBMLGFCHJD-GJZGRUSLSA-N	428.464	1.768	50	20	IDGD	
Cc1ccnc(Oc2cc(NC(=O)C(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)ccc2C)c1	764002671	PRPGPFVKLMUPTJ-CQSZACIVSA-N	446.485	1.011	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1cccc(CN2CCCCC2)c1	764005692	FLNUPZKRWNKQDM-UHFFFAOYSA-N	438.484	1.843	50	20	IDGD	
C[C@H]1C[C@H](C)CC2(C1)NC(=O)N(CC(=O)NNC(=O)CSc1ccccc1O)C2=O	764045263	HJXNTEYSTKNAOA-STQMWFEESA-N	434.518	1.378	50	20	IDGD	
Cc1cc(C(=O)N2CCSCC2)ccc1NC(=O)C(=O)NNC(=O)CC(F)(F)F	764117302	RGSQHMKLRJSMMS-UHFFFAOYSA-N	432.424	1.222	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccccc2OC)c(Br)c1	764139757	ZTHMDEJSYXYTCX-UHFFFAOYSA-N	436.262	1.795	50	20	IDGD	
CC(C)Oc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)C(=O)NNC(=O)CC(C)(C)C	764202207	PKGQSXUEPUTMAW-UHFFFAOYSA-N	442.538	1.246	50	20	IDGD	
C[C@H]1CN(Cc2cccc(NC(=O)C(=O)NNC(=O)c3cccc(C#N)c3)c2)C[C@H](C)O1	764238107	PHJLRNYKRQAUKL-HOTGVXAUSA-N	435.484	1.567	50	20	IDGD	
Cc1ccc(-n2c(NNC(=O)[C@@H]3CN4CCCN3CC4)nc3ccccc3c2=O)c(C)c1	764238144	SVCFXEWTQXAKKZ-NRFANRHFSA-N	432.528	1.836	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)C(=O)Nc1ccccc1CN1C(=O)CCC1=O	764246186	XJWUMIWRWSAZRW-UHFFFAOYSA-N	447.451	1.076	50	20	IDGD	
Cc1ccc(Cn2cccc(NC(=O)C(=O)NNC(=O)CCc3ccccc3O)c2=O)cc1	764288500	IMOXCYCALJYGEE-UHFFFAOYSA-N	448.479	1.629	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)C(=O)Nc1ccc2ccn(CC(=O)NC)c2c1)c1ccccc1	764329667	XXFANTVVOFYVET-GOSISDBHSA-N	435.484	1.667	50	20	IDGD	
CCOc1cc2c(cc1NC(=O)C(=O)NNC(=O)c1cnn(-c3ccccc3)c1)O[C@H](C)C2	764342253	FQUMIQXVPZFVEW-CQSZACIVSA-N	449.467	1.994	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)C(=O)Nc1ccnn1Cc1c(Cl)cccc1Cl	764352700	BHTUOEODRIQKEG-UHFFFAOYSA-N	447.282	1.962	50	20	IDGD	
CC(C)OC(=O)c1c(NC(=O)C(=O)NNC(=O)c2cnn(C)c2)sc2c1CC[C@H](C)C2	764358453	DWMOYHRJLQDURH-NSHDSACASA-N	447.517	1.571	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)C(=O)Nc1cccc(CNC(=O)OC(C)(C)C)c1	764386270	DBOKUTKMYVJSRD-UHFFFAOYSA-N	427.461	1.814	50	20	IDGD	
CCn1ncc2ccc(NC(=O)C(=O)NNC(=O)c3cc(-c4ccc(F)cc4)[nH]n3)cc21	764388100	PVFIXRBEUQWVKV-UHFFFAOYSA-N	435.419	1.985	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NN=C3C(=O)Nc4cc5c(cc43)OCCO5)CC2)cc1	764831809	UJEANTPIZMLDEU-UHFFFAOYSA-N	449.511	1.356	50	20	IDGD	
O=C(NNS(=O)(=O)N1CCOCC1)c1ccc(COc2ccc(Cl)cc2)cc1	765031316	RWXSOBIBLNFFEA-UHFFFAOYSA-N	425.894	1.730	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@]2(CCN(CC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)C2)C1	765032803	NHRCKSDILPTQOZ-NRFANRHFSA-N	447.492	1.689	50	20	IDGD	
CS(=O)(=O)Cc1noc(NC(=O)NNC(=O)c2cc3c(s2)CCCCCC3)n1	765256128	QFHDVEPVZCJZEN-UHFFFAOYSA-N	427.508	1.801	50	20	IDGD	
CCOC(=O)NNC(=O)C(=O)Nc1cc(OC)c(NC(=O)c2ccccc2)cc1OC	765407932	PAVZAPGGVKPVIP-UHFFFAOYSA-N	430.417	1.672	50	20	IDGD	
COc1ccc([C@@]2(C)NC(=O)N(CC(=O)NNc3ccc(OC)cc3[N+](=O)[O-])C2=O)cc1	768329055	NGMQAUFOIZBCHF-HXUWFJFHSA-N	443.416	1.522	50	20	IDGD	
CC(=O)N1CCc2c(NC(=O)C(=O)NNC(=O)c3cc(C)nc4ccccc34)cccc21	769256552	TYIIBUGCMZMJDU-UHFFFAOYSA-N	431.452	1.852	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2ccoc2Br)cc1	770111506	UWRGEEJHFUXICR-UHFFFAOYSA-N	430.280	1.432	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)NCc1ccnc(N2CCOCC2)c1	770147989	YDNYNWQVNOZILW-CQSZACIVSA-N	433.896	1.870	50	20	IDGD	
C[S@](=O)c1cccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1	770210016	XWCNUQLJEMRPRO-NDEPHWFRSA-N	435.527	1.283	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)NC[C@H](c3cccc(Cl)c3)N3CCOCC3)nc21	770373130	SMSLVCPETZXUQS-OAHLLOKOSA-N	446.899	1.422	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)NCCCN1CCC[C@H](C(N)=O)C1	770513365	SWAQDIWHTNNDLY-KGLIPLIRSA-N	425.917	1.025	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCN(C[C@@H](C)CBr)CC2)cc1[N+](=O)[O-]	770645600	JPBYLMYOCIQBRJ-LBPRGKRZSA-N	436.328	1.941	50	20	IDGD	
CCN1CCC[C@H]1CN1C[C@@H](C(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)CC1=O	770958112	IPPDWKKYYDRDEX-KBPBESRZSA-N	444.540	1.063	50	20	IDGD	
COc1ccccc1[C@@]1(C)NC(=O)N(CC(=O)NNc2nc(-c3cccnc3)no2)C1=O	771481654	AMNMZIIBFBIUPY-HXUWFJFHSA-N	437.416	1.051	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)c1ccc(F)c(S(=O)(=O)NC(C)(C)C)c1	771992057	HNAPRXPAOLTWBA-GFCCVEGCSA-N	445.513	1.641	50	20	IDGD	
C#CCOc1ccccc1NC(=O)C(=O)NNC(=O)c1ccc(F)cc1Br	773497661	ZVOAMLYOBFCKLD-UHFFFAOYSA-N	434.221	2.000	50	20	IDGD	
COCCC1(CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)CCCCC1	773723679	DPKAZCQDQQUKKI-UHFFFAOYSA-N	425.555	1.911	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)[C@]1(F)CCN(C(=O)OCc2ccccc2)C1	776968527	XOKNXZXQPGTABA-QFIPXVFZSA-N	445.447	1.972	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)cc(O)n1	777273924	FTSRVFNOYXYJLX-UHFFFAOYSA-N	440.481	1.649	50	20	IDGD	
CCNS(=O)(=O)c1ccccc1S(=O)(=O)NNC(=O)c1cccc(OC(F)F)c1	777623804	LXUTZMZBHGKIAU-UHFFFAOYSA-N	449.457	1.210	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cnc(C(F)(F)F)nc3)CC2)cc1	777811966	APIYDUYOWADQPE-UHFFFAOYSA-N	436.438	1.383	50	20	IDGD	
CCN1CCN(Cc2ccc(CNC(=O)NNC(=O)CNC(=O)OC(C)(C)C)cc2)CC1	778616106	UQMHEAHYCATMPH-UHFFFAOYSA-N	448.568	1.179	50	20	IDGD	
Cn1cc([C@H](CO)NC(=O)NNC(=O)[C@H]2Cc3ccccc3CN2Cc2ccccc2)cn1	778643075	YFGMKOPDNZFNNY-FCHUYYIVSA-N	448.527	1.411	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2cnn([C@@H](C)C3CC3)c2)n[nH]1	778712730	HCVVOMNTIYBLDJ-LBPRGKRZSA-N	437.460	1.653	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2ccc(C)c(S(=O)(=O)N3CCCCC3)c2)nc1	782145136	DHNNKFHOXMDPAC-UHFFFAOYSA-N	447.517	1.655	50	20	IDGD	
O=C(NNC(=O)C(=O)NC1CC1)C(=O)Nc1cnccc1-c1ccc(C(F)(F)F)cc1	782965961	KLAXTRVKNPRJDN-UHFFFAOYSA-N	435.362	1.132	50	20	IDGD	
C[C@@H](C(=O)Nc1ccc(NC(=O)C(=O)NNc2ccc(F)cc2F)cc1)n1cncn1	783340114	MICSMYPIWWFDAL-NSHDSACASA-N	429.387	1.838	50	20	IDGD	
CC(C)(C)c1cc(NC(=O)C(=O)NNC(=O)C(=O)N2CCCC2)n(-c2ccc(F)cc2)n1	784000354	YNIISHVVSOXLFO-UHFFFAOYSA-N	444.467	1.017	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)C(=O)Nc1ccc(OC2CCCC2)c(F)c1	784004429	NAKKOSIYIPQDGG-UHFFFAOYSA-N	432.408	1.256	50	20	IDGD	
COC(=O)N(C)Cc1ccc(NC(=O)C(=O)NNc2cccc(S(C)(=O)=O)c2)cc1	784839020	FJVSZMPGLHINMM-UHFFFAOYSA-N	434.474	1.370	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNc3cccc(S(C)(=O)=O)c3)cn2)C[C@@H](C)O1	784841412	IRGIZYPRVWVOJY-OKILXGFUSA-N	447.517	1.181	50	20	IDGD	
C=CCNC(=O)Nc1ccc(NC(=O)C(=O)NNc2cccc(S(C)(=O)=O)c2)cc1	784844500	KDDJKRKADBLCDY-UHFFFAOYSA-N	431.474	1.479	50	20	IDGD	
CCNC(=O)N(C)NC(=O)C(=O)Nc1cc(Br)cnc1OCC(F)(F)F	784915924	JQSXXWRQBKPWFJ-UHFFFAOYSA-N	442.192	1.416	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)C(=O)Nc1cc(Br)ccc1F	785061154	UETHSGNZGZZQIU-UHFFFAOYSA-N	434.225	1.565	50	20	IDGD	
CNC(=O)[C@H]1CN(C(=O)C(=O)NNc2nc3ccc(OC)cc3cc2C)c2ccccc2O1	785164882	ZVGAMAGAQGBBLL-LJQANCHMSA-N	449.467	1.535	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2ccc(F)c(S(C)(=O)=O)c2)c2ccccc2c1=O	785688436	BSPXTDRRYGORIO-UHFFFAOYSA-N	446.460	1.424	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)CCC(C)(C)O)c1	786611788	TWUUADNXNSUNHZ-UHFFFAOYSA-N	435.502	1.808	50	20	IDGD	
CCOC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)NNC(=O)Nc1ccc(OC(F)F)cc1	787880194	FJMFZBMMMODITE-UWVGGRQHSA-N	431.396	1.080	50	20	IDGD	
CS(=O)(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCC3)ccc1Cl	788330587	JMZAPCWRJRGIAY-UHFFFAOYSA-N	441.918	1.693	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)N2CCN(c3c(C#N)c(C)nn3C)CC2)c1C	788475953	JPSUGCPBAKCSIW-DEDYPNTBSA-N	435.532	1.921	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)CCCCC(N)=O)c2)cc1	788630664	NBPWBGJLNFZEGM-UHFFFAOYSA-N	448.501	1.303	50	20	IDGD	
CN(CC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)[C@@H]1CCN(Cc2ccccc2)C1=O	789520260	GTSSDPVTUHGOGO-GOSISDBHSA-N	425.445	1.089	50	20	IDGD	
CC(=O)N1CCc2ccc(S(=O)(=O)NNC(=O)c3ccc4c(c3)OCCO4)cc2CC1	790046350	ZRBDMUZQHRNZQO-UHFFFAOYSA-N	445.497	1.028	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2ncsc2C(F)(F)F)ccc1Cl	792021804	LPVLAOLLMGXMDO-UHFFFAOYSA-N	428.801	1.538	50	20	IDGD	
O=C(NC[C@@H]1CCN(Cc2ccccc2)C1)NNC(=O)C1CCN(c2ncccn2)CC1	792224543	FRRRABWXQYVCDP-IBGZPJMESA-N	437.548	1.546	50	20	IDGD	
COCCCNC(=S)N(C)NC(=O)[C@H]1CS[C@]2(c3ccc(F)cc3)CCC(=O)N12	793274193	VAIADSPUJKWSOS-BEFAXECRSA-N	440.566	1.590	50	20	IDGD	
CCNC(=O)N(C)c1cccc(NC(=O)C(=O)NNC(=O)CCCc2ccccc2)c1	797003666	FBUIZIMFRSCJKA-UHFFFAOYSA-N	425.489	1.961	50	20	IDGD	
COC(=O)c1cc(F)cc(NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)c1F	797006753	MQVKUMSJLSYKKS-UHFFFAOYSA-N	449.395	1.603	50	20	IDGD	
Cc1cc(OC(C)C)ccc1NC(=O)C(=O)NNC(=O)CNC(=O)OCc1ccccc1	797369480	ZDYYHMOATAXLRJ-UHFFFAOYSA-N	442.472	1.795	50	20	IDGD	
O=C(NCC(F)(F)F)NNC(=O)c1cccc(NN2C(=O)[C@@H]3CC=CC[C@H]3C2=O)c1	798315124	ATYDVHBPLGIMJI-CHWSQXEVSA-N	425.367	1.471	50	20	IDGD	
COc1ccccc1CONC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1	798537549	FLSKVQOUTDLSFX-UHFFFAOYSA-N	436.490	1.086	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)N(C)[C@H](C)c1cccc(S(N)(=O)=O)c1	799857985	YJWCREABHYGNGV-CYBMUJFWSA-N	430.490	1.338	50	20	IDGD	
COC(=O)c1cc(C=NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)n(C)c1C	800813928	DUAJNDXQNYHFOQ-UHFFFAOYSA-N	425.489	1.028	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)CN2C(=O)N[C@@]3(C[C@@H](C)CC(C)(C)C3)C2=O)cc1	802058677	LJWYJJOVDHYPBV-YEJXKQKISA-N	431.493	1.985	50	20	IDGD	
C[C@@H](CNC(=O)OC(C)(C)C)C(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	803103338	XBZXMFPIVMSOMV-AWEZNQCLSA-N	443.545	1.783	50	20	IDGD	
COC(=O)N(C)NC(=O)c1ccc(CNS(=O)(=O)c2ccc(NC(C)=O)cc2)cc1	804123580	CONFDMNRPFLBIS-UHFFFAOYSA-N	434.474	1.467	50	20	IDGD	
COC[C@]1(CNC(=O)NNc2ccc(-n3ccnc3)nn2)CCCN1C(=O)OC(C)(C)C	805860221	CWVWCOCMQXJNNO-HXUWFJFHSA-N	446.512	1.705	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CC(c2cc(F)ccc2F)=NO1)c1nn(-c2ccccc2)cc1O	806346015	FNXNRRLKGFJLSR-KRWDZBQOSA-N	427.367	1.810	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1nc2c(Br)cccc2s1	806741191	RSNAWXKVVVNDDF-ZCFIWIBFSA-N	436.313	1.149	50	20	IDGD	
O=C1COC[C@H](C[C@@H]2CN(C(=O)C(=O)NNc3cccc([N+](=O)[O-])c3)c3ccccc32)N1	806968181	ALVLPTFVYXTNAT-HIFRSBDPSA-N	439.428	1.073	50	20	IDGD	
C[C@@H]1CN(c2ccc(NC(=O)C(=O)NNc3ccc(-n4ccnc4)nn3)cc2)C[C@@H](C)O1	807429863	ZIXIWSDMFNKPPN-HUUCEWRRSA-N	436.476	1.358	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NC[C@@H]2CCCS(=O)(=O)C2)ccc1OCCC(C)C	807581475	DOMZWAHUXLCGRH-HNNXBMFYSA-N	441.550	1.889	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)N2CCN(c3ccccc3)CC2)n[nH]1	812534181	JJVTVLWBOXPCHV-UHFFFAOYSA-N	448.483	1.195	50	20	IDGD	
O=C(CNC(=O)NNC(=O)c1c(Cl)cccc1Cl)NCCN1CCCCCC1	814296521	DATHRSKDNJMMLW-UHFFFAOYSA-N	430.336	1.930	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)Nc1ccc(C[C@H]2CC(=O)NC2=O)cc1	814653023	POMTWAMPNZHCLR-AWEZNQCLSA-N	445.501	1.291	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2cn(C)c3ccccc23)nnn1Cc1ccccc1F	815566809	GFTMCVOTVXJPAT-UHFFFAOYSA-N	449.446	1.665	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1ccc([C@@H]2CCOC2)cc1	815751840	QQBYGOQCPAFUCF-OAHLLOKOSA-N	432.502	1.523	50	20	IDGD	
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(Br)cc2)C1	819123109	PULMECKCHUKDIK-CYBMUJFWSA-N	444.351	1.797	50	20	IDGD	
O=C(CNc1ccccc1)NNC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(F)cc2)C1	823328215	ROBFFKCOLMUBLD-OAHLLOKOSA-N	434.493	1.486	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)[C@@H](CC(C)C)N2C(=O)[C@H]3CC=CC[C@H]3C2=O)cc1	901473411	XRIFBKZLNGROIR-CEXWTWQISA-N	427.501	1.887	50	20	IDGD	
CC(C)n1cnnc1SCC(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12	912988511	ZRRUGJBWYBTLEW-UHFFFAOYSA-N	429.506	1.703	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)[C@@H]2CCCN(S(=O)(=O)c3ccccc3)C2)c1	915133027	ICIKUEHOUIMDPM-GOSISDBHSA-N	445.541	1.931	50	20	IDGD	
NS(=O)(=O)c1cccc(NC(=O)NNC(=O)COc2ccc(Br)cc2)c1	915256952	DPGKTOIDUVRTPC-UHFFFAOYSA-N	443.279	1.328	50	20	IDGD	
COc1cc(OC)c(OC)cc1CNC(=O)NNC(=O)C(=O)Nc1ccc(C)c(C)c1	915919135	LTFQCOMNBKBHBH-UHFFFAOYSA-N	430.461	1.798	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCCC(=O)N2CCN(C)CC2)ccc1OCCC(C)C	916433185	FQZCMXUPQCSYDF-UHFFFAOYSA-N	449.552	1.228	50	20	IDGD	
CCS(=O)(=O)NCCNC(=O)NNC(=O)c1cc2c(s1)CC[C@H](C(C)(C)C)C2	916516698	OOKPYSSOLCDXOF-ZDUSSCGKSA-N	430.596	1.782	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCc2cccc(N3CCCC3=O)c2)c2ccccc2c1=O	916517714	MYDRKRIWVVEKGG-UHFFFAOYSA-N	448.483	1.687	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)CCNC(=O)c3ccc([N+](=O)[O-])cc3)n[nH]2)cc1	917175732	JVLBGKXIMQPDOL-UHFFFAOYSA-N	436.428	1.874	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)[C@H](C)NC(=O)c2ccc(Br)s2)n1	917391667	CSOHEEPHCGQQPC-JTQLQIEISA-N	428.312	1.290	50	20	IDGD	
CN(CC(=O)NNC(=O)c1ccc2c(c1)OCCO2)C(=O)c1ccc(Br)o1	917392754	QQHUXOPSTAQSMS-UHFFFAOYSA-N	438.234	1.347	50	20	IDGD	
O=C(O)c1cc2c(c(S(=O)(=O)NNC(=O)c3cc(Br)c[nH]3)c1)CCC2	917732959	QICFIMHVYNPXMW-UHFFFAOYSA-N	428.264	1.587	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)CCn3cccn3)c2)cc1	918186765	KASNJFLNTLEVDB-UHFFFAOYSA-N	443.485	1.544	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2ccc(F)cc2Br)cnn1-c1ccc(O)nn1	918641919	QYNJGOQLHDAUIC-UHFFFAOYSA-N	435.213	1.653	50	20	IDGD	
CCOc1ccccc1CNC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1	919778624	FBNHGFZLMYWHOJ-UHFFFAOYSA-N	434.518	1.545	50	20	IDGD	
CN(CCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)Cc1ccccc1	919790445	NVLOFLIQRATZRD-UHFFFAOYSA-N	433.534	1.013	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)NNC(=O)CN1C(=O)Cn2c(cc3ccccc32)C1=O	920274973	LIGVKDLQEJVDJE-UHFFFAOYSA-N	429.436	1.495	50	20	IDGD	
CC(=O)c1cccc(S(=O)(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)c1	1318667499	HRYTWNBGTNFDTB-UHFFFAOYSA-N	425.507	1.846	50	20	IDGD	
COc1ccc(Cl)cc1CCNC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	1318756382	CUKBBJILQSKYGH-UHFFFAOYSA-N	429.864	1.782	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)N1CCC[C@@H](C=NNC(=O)c2n[nH]c3c2CCCC3)C1	1321237552	XATGMSDOWGLLHZ-AWEZNQCLSA-N	432.525	1.767	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NC2CCN(C3CCN(C)CC3)CC2)cc(OC)c1OC	1324980079	QVUHFVUJFQLQEE-UHFFFAOYSA-N	449.552	1.215	50	20	IDGD	
C[C@@H](CNC(=O)OC(C)(C)C)C(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1	1327889472	IISCKJVROHPZMZ-ZDUSSCGKSA-N	428.530	1.942	50	20	IDGD	
Nc1cnnc(NNC(=O)CCCNS(=O)(=O)c2ccc3c(c2)CCCC3)c1Cl	1333509687	TXKGSAVKYZINRO-UHFFFAOYSA-N	438.941	1.793	50	20	IDGD	
O=C(c1ccc(-n2cccn2)c(F)c1)N1CCN(S(=O)(=O)CBr)CC1	1337813730	KQZKPGKCJWTEEN-UHFFFAOYSA-N	431.287	1.451	50	20	IDGD	
CC(C)(C)OC(=O)N1CCc2ccc(C(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)cc2C1	1343178130	IGQDUBWXGYJVPG-OAHLLOKOSA-N	437.518	1.176	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cn4ncccc4n3)C2)C1	1777953489	QQDIFNIHCOHEMU-MSOLQXFVSA-N	426.304	1.409	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnn(-c3cccnc3)c1)C2)[C@@H](F)Cl	1778023638	AEHJHTXDUPEFEI-MBOZVWFJSA-N	435.887	1.929	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnn4cccnc34)C2)C1	1778445723	JEPNEPBFEZCPDB-ROUUACIJSA-N	426.304	1.409	50	20	IDGD	
CCC1(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cccc(B(O)O)c2)C3)CCC1	1778889324	KCQLNGFZKLFVSD-AUSIDOKSSA-N	428.338	1.074	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cn3cccnc3n2)C1	1778989163	LURNVRIPCGGSDK-AKCHCHLHSA-N	435.912	1.111	50	20	IDGD	
CCCC(=O)N[C@H](C)C(=O)N1CC[C@@]2(CN(C(=O)[C@@H](C)CBr)CCO2)C1	1779250225	QLWAYXXMTJGOMN-IYOUNJFTSA-N	432.359	1.152	50	20	IDGD	
COc1cc(C#N)cc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)c1	1780172916	KWOMPJQIYBIFOG-QAPCUYQASA-N	440.269	1.701	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccn(C(C)C)n2)C1	1780210515	XWOWNBPYACYQQC-WRWLIDTKSA-N	426.945	1.845	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)cc1NC(C)=O	1780214177	BDISAIFKLCSEAJ-IBGZPJMESA-N	444.315	1.901	50	20	IDGD	
CN1CCC[C@H](C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](F)Br)C3)C1	1780576128	ZRPAWZKUXSOLKC-LUXYFRNMSA-N	434.350	1.533	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CN1CCOC1=O)C2	1780707999	ZQYNTFMIVXQVPV-FSPWUOQZSA-N	436.336	1.189	50	20	IDGD	
CN1C(=O)CC[C@H]1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@](C)(Cl)CCl)C1	1780715416	RVQSJFWYWFLVCH-WTVLQJKYSA-N	434.364	1.357	50	20	IDGD	
O=C(c1ccnc2ncccc12)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781331957	BRWFSOPELUQERO-KDOFPFPSSA-N	437.269	1.764	50	20	IDGD	
O=C(c1ccc2nn[nH]c2c1)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781335219	WGYJYRYKYOMRLF-CJNGLKHVSA-N	426.246	1.092	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnn4c3OCCC4)C2)C1	1782279436	KZFOUDQPHYMTCN-QZTJIDSGSA-N	431.320	1.345	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCc2ncc[nH]2)C1	1782412124	AHCFSQNVQBEDTB-HBUWYVDXSA-N	427.343	1.640	50	20	IDGD	
CN1CCCn2nc(C(=O)N3CC[C@@]4(CN(C(=O)CO[Si](C)(C)C)CCO4)C3)cc2C1	1782560682	KTTKTBNEMNMSDE-OAQYLSRUSA-N	449.628	1.014	50	20	IDGD	
CC[C@H](NC)C(=O)N1CCO[C@@]2(CCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1	1782864491	NAZJYPKJDYSXAA-ODXUAPNFSA-N	432.471	1.700	50	20	IDGD	
O=C(COc1ccccc1F)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1783361876	WSLQAADUHVXOFN-RDJZCZTQSA-N	433.249	1.725	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H]2C[C@@]2(C(=O)N2CC[C@@]3(CN(C(=O)[C@@H](F)Cl)CCO3)C2)C1	1783460293	XOGSMHWYXNIUKR-UYVJDWJCSA-N	445.919	1.608	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)C[C@@H]21	1783965890	WLDVZWSVKKCICG-XWUBHJNHSA-N	442.310	1.117	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc4ccnn34)C[C@@H]21	1783972285	KDRGBZIBIKVXKQ-DNUAJFIVSA-N	449.349	1.959	50	20	IDGD	
COC(=O)c1ccccc1CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21	1784201264	ONVUCDIEZKRWHL-XPYUAMARSA-N	440.899	1.920	50	20	IDGD	
Cc1c(C(=O)N2CC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)ccc(F)c1F	1785060854	JEMZHOMARKPOTE-OAQYLSRUSA-N	438.475	1.090	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc(N)s3)[C@H]2C1	1786931789	VZUYPLNHDHWGEE-RHYQMDGZSA-N	431.356	1.350	50	20	IDGD	
COc1cnc(C(=O)Nc2ccc(C3(NC(=O)c4ccc(B(O)O)cc4)CCC3)cc2)cn1	1787559242	FGOQJIDLKLCPLO-UHFFFAOYSA-N	446.272	1.227	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(OC)cn3)[C@H]2C1	1787761313	PVFWRGMCLQBWHP-FAYQHZLMSA-N	440.338	1.857	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1ccc(C2(NC(=O)Cc3cnc[nH]3)CCC2)cc1	1789522822	QBVZPFFENPEVQV-UHFFFAOYSA-N	433.472	1.399	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=N/N3CCCCC3)C[C@@H]21	1789870808	XKXBMHJAUJNAIO-HDVOYPAYSA-N	433.380	1.674	50	20	IDGD	
O=C(C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]2C1)c1ccccc1	1789922179	FVFVVEBWOMOQSN-YXWQFLTLSA-N	427.270	1.540	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cnc4ccccn34)C[C@@H]21	1791055451	VUXGIVWDUYWIAB-OHFALNGGSA-N	449.349	1.640	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(-n4cnnc4)cc3)C[C@@H]21	1791251234	AZVKKGWSYCBBNM-KANFNMMFSA-N	447.923	1.114	50	20	IDGD	
COc1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)cc1F	1792750148	VWPMOCMOZXBPOT-BCDXTJNWSA-N	426.253	1.080	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3cccc(F)c3s1)C2)[C@@H](O)CCl	1792978435	VOVJJFMFCYHSKN-LMWOUKEDSA-N	426.897	1.843	50	20	IDGD	
CCN(CC)[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](O)CCl)c1ccccc1	1792984409	ZVELZWCGDVILQG-USYVTKNRSA-N	437.968	1.259	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CCN1C(=O)OC(C)(C)C)C2	1793447837	NKUQDZNHINNJAQ-BPKGMFCQSA-N	443.972	1.993	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cncnc1)C2	1794141003	BUMIMNJFMZHUTQ-FZKCQIBNSA-N	437.928	1.861	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)c1cc(-c2ccccc2)no1	1796188831	SPWOOYSAMMBBGG-ACDBMABISA-N	445.284	1.587	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(-c3ccc(O)nn3)cc1)C2)[C@@H](F)Cl	1796366888	LCNIFKJEHCHQSO-LTCOOKNTSA-N	434.855	1.587	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1cnn2ccccc12	1796841559	LVQLUVYIQANSRA-BAESOJJISA-N	425.258	1.228	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1ON=C(c2ccccc2)O1	1797639507	CRRVVKQAMAOEDD-JUEKAOKDSA-N	435.908	1.718	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@](C)(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](O)CCl)C3)C1	1797757897	NICAUCCHCJSSDU-QKQGURCUSA-N	443.972	1.871	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](Br)Cc1ccccc1)C2)[C@H]1C[C@H]1F	1799181511	WAWOTSUDZBSREV-MULDDASSSA-N	439.325	1.940	50	20	IDGD	
COc1cccc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@](C)(Cl)CCl)n1	1799274254	UBEQXFYHVCCPRM-ZZXMYQEDSA-N	444.359	1.849	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnn3ccccc13)C2	1799275030	INBPOQUFMOGWEI-AODNKKSCSA-N	425.316	1.774	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3cnccc3n1)C2)[C@H](F)Br	1799346769	AGHKVXRQCLAEQR-VZAMPYOESA-N	437.269	1.524	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(NC(=O)OC)c1	1799429849	KZVKIKQGQLSZIF-YALNPMBYSA-N	439.896	1.322	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cn2c(F)cccc2n1	1799998964	GQRXCYBJKFVMAB-HBCWATKFSA-N	434.544	1.528	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)[C@H]1CCc2cccc(Cl)c21	1800325461	CDBYIWFAPYPTBU-JGTMWYTQSA-N	427.328	1.559	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCCCCC(=O)OC)C2	1800644042	FRFYNQFCLBHGKY-BASYENTBSA-N	447.370	1.873	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1snnc1C1CC1)C2	1800756631	BRCUIWXMZZPAOZ-IXLVHKGHSA-N	429.340	1.402	50	20	IDGD	
C=CCCc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C(Cl)Cl)c(O)n1	1801015544	GTELHZWZWNBXNQ-JJLQDPRZSA-N	428.316	1.913	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(C)(C)c1ccccn1	1801210916	LKSFEAQQAOYOSM-PNBKFKSVSA-N	438.366	1.980	50	20	IDGD	
CN[C@@H](CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C(C#N)=C/c1ccc(F)cc1F)C(=O)O	1801437101	HKHAPDLZCXUZST-OSCSVHATSA-N	446.454	1.573	50	20	IDGD	
CC(=O)NCC(=O)N1CC[C@H](CNC(=O)[C@H](C)CBr)[C@@H]1c1cccnc1	1803014546	FXAUYSWBXGSMNV-VMGRFDJRSA-N	425.327	1.255	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H]2Cc3ccccc3N2)[C@H]1c1cccnc1)[C@@H](O)CCl	1803148649	VUMSNSTYJYCXDN-LEAZDLGRSA-N	428.920	1.724	50	20	IDGD	
O=C(c1ncn(-c2cccc(F)c2)n1)N1CCC2(CCCN(C(=O)[C@@H](O)CCl)C2)CC1	1805519129	XBVWWEOSZSBSBD-KRWDZBQOSA-N	449.914	1.851	50	20	IDGD	
COc1cnc(C(=O)NC[C@H]2CCN(C(=O)CCBr)[C@@H]2c2cccnc2)cn1	1806038606	IYJPHKLWNCOSFN-RDTXWAMCSA-N	448.321	1.985	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC2(CCCN(C(=O)Cn3nnc4ccccc43)C2)CC1	1806513979	ZOMLFVNGYKPBAL-INIZCTEOSA-N	433.940	1.916	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)/C=C/c2ccoc2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1	1807369287	FBJBXFFFGOHTSG-RMHGUEDNSA-N	445.284	1.387	50	20	IDGD	
CN(C)C(=O)NCC(=O)N1CC[C@H](CNC(=O)[C@H](F)Br)[C@H]1c1cccnc1	1808649264	LYLTWHMPHZLFSH-YUELXQCFSA-N	444.305	1.049	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)c1cnn2ccncc12	1809381211	MXGRCRZSYKJCOG-BMGDILEWSA-N	428.880	1.044	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)c1ccc2nc[nH]c2c1	1809815733	FVDOHDGNRHNTIY-ZYSHUDEJSA-N	427.892	1.877	50	20	IDGD	
Cc1cccc(CC(=O)N2CCC3(CCCN(C(=O)c4cccc(B(O)O)c4)C3)CC2)c1	1809976860	UCFUWAQCONOSFH-UHFFFAOYSA-N	434.345	1.762	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)[C@H]2CC=CCC2)[C@@H]1c1cccnc1	1810305367	KNUMLXOKZKGGIZ-DJPFJPOOSA-N	448.527	1.756	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC2(CCCN(C(=O)c3cnccc3F)C2)CC1	1810334912	RZSVPCSKVOMYKC-UHFFFAOYSA-N	440.479	1.378	50	20	IDGD	
C[C@H](Cn1cncn1)C(=O)N1CC[C@@H](CNC(=O)C(Cl)Cl)[C@@H]1c1cccnc1	1813077424	INTAJYASEHCQSL-SNPRPXQTSA-N	425.320	1.819	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@](C)(Cl)CCl)CC2	1817020628	BKPQYKHOEOYTAR-YNEJBJPTSA-N	436.365	1.738	50	20	IDGD	
CS(=O)(=O)c1ccc(C(=O)N[C@@H]2CCc3nc(NC(=O)[C@H](F)Cl)sc3C2)nc1	1817117945	QIOQCVKJVFYMDL-OQPBUACISA-N	446.913	1.702	50	20	IDGD	
Cc1ccnc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)c1	1817471601	JXYPSWNMEZLEQM-LJQANCHMSA-N	433.277	1.413	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2[C@H]3C=CS[C@@H]32)[nH]n1)c1cccc(B(O)O)c1	1817476841	FDJOGIIDTGGBFN-HYEGPXJVSA-N	438.318	1.271	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2CCCO2)[nH]n1	1818113538	PIDJPMDAXGALMY-SWORYUBOSA-N	441.492	1.715	50	20	IDGD	
CC1=CC[C@H](C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2cccc(B(O)O)c2)CC3)CC1	1818622624	RLLPMVLFHVOBOP-WMLDXEAASA-N	439.346	1.795	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](O)CCl)CC2)c1n[nH]c2ccc(F)cc12	1819205594	DYYBIDPDRIJGLC-ZANVPECISA-N	437.884	1.984	50	20	IDGD	
CC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819402228	VPZHKGPAYBMUFY-MRXNPFEDSA-N	427.465	1.083	50	20	IDGD	
COC[C@H](NC(C)=O)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](C)Br)[nH]n1	1819612825	DZTJIMYTXOYJME-BPNCWPANSA-N	444.330	1.336	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)CCn2ccnn2)[nH]n1)[C@@H](F)Br	1820937114	KWIAHETZJQLNFN-BXUZGUMPSA-N	428.266	1.774	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2nc3ncccn3n2)[nH]n1	1822371438	WKAKZSPAECXGDN-WCQYABFASA-N	432.872	1.407	50	20	IDGD	
CC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCN1CCN(C)CC1)CC2	1822844110	URGOGYJTKNSGSN-ZIAGYGMSSA-N	428.002	1.710	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)C(F)(F)C(F)F)CC1	1824843517	PMEXYCLITVUOQN-INIZCTEOSA-N	444.234	1.500	50	20	IDGD	
C#CCCCCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2	1826420574	JIURMLRGKRZGBP-MRXNPFEDSA-N	425.319	1.242	50	20	IDGD	
CC1=C(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CCO1	1827281134	LZESDCNVXVXRCZ-NRFANRHFSA-N	426.322	1.294	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)C3CC(F)(F)C3)CCO2)C1	1829983513	QZFYUMZOPIXXAC-WBMJQRKESA-N	439.297	1.519	50	20	IDGD	
Cc1cncc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)c1	1830537435	IHACDEBWDZBWTA-DNVCBOLYSA-N	440.338	1.491	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CCC[C@@H]3C)C2)C1	1830539422	GQDSOJUZEBQXGU-WFXMFSGNSA-N	431.371	1.910	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](NC(C)=O)C(C)(C)C)C2)C1	1831639915	GWUSNOGDKLTFIN-FIKGOQFSSA-N	445.988	1.401	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc4ccccn34)C2)C1	1831647157	RHCCQPVKFVQGTR-IERDGZPVSA-N	434.924	1.812	50	20	IDGD	
Cc1onc(C(=O)N2CCO[C@]3(COCCN(C(=O)CCBr)C3)C2)c1C	1831975977	WVGUTJKSFAGPIT-KRWDZBQOSA-N	430.299	1.146	50	20	IDGD	
C=CCSCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1832458704	WRNYXFFHSFSRGW-ZFWWWQNUSA-N	425.320	1.053	50	20	IDGD	
COc1cncc(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)c1	1832919878	UOILKVRDKDWZLV-IBGZPJMESA-N	446.331	1.283	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)c1ccc2c(c1)COC2	1835378607	MDZRLYGJBPSSDQ-FQEVSTJZSA-N	435.952	1.502	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)c1cnccc1Cl	1835857712	NVNVPYHYGGJWLE-QGZVFWFLSA-N	429.348	1.520	50	20	IDGD	
O=Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)s1	1835946084	FAKQDVDEUXHLJM-BBRMVZONSA-N	449.298	1.321	50	20	IDGD	
COc1nccc(C(=O)N2CCO[C@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)c1F	1836240022	YOTJZELJAJCOSI-QGZVFWFLSA-N	436.267	1.103	50	20	IDGD	
Cn1nccc1C(=O)N1CCC(OC2CCN(C(=O)[C@H](F)Br)CC2)CC1	1837488487	XSSXRHDAHVWECC-HNNXBMFYSA-N	431.306	1.723	50	20	IDGD	
COc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)ccn1	1837977539	KPBAWMKEQHOPGL-HXUWFJFHSA-N	437.569	1.012	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cnn4c3CCC4)CC2)CC1	1838702951	YVIODUHXKHDXEF-SFHVURJKSA-N	438.956	1.695	50	20	IDGD	
COc1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)c1	1838929397	LOFCQVRXZZVBML-IFXJQAMLSA-N	441.322	1.549	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(O)c(OC)c3)C2)C1	1839146733	UNIUKQXNGNKHAY-MGPUTAFESA-N	426.897	1.488	50	20	IDGD	
Cn1cc(CCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)cn1	1839152267	TWJJMXVRBSXQJZ-RTBURBONSA-N	447.363	1.045	50	20	IDGD	
CCc1nc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)co1	1839153750	QUZBTWUAYMZOCF-MSOLQXFVSA-N	434.320	1.543	50	20	IDGD	
Cc1nccn1[C@H](C)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2	1839156525	RYQWXBKEYMBCFY-CCKFTAQKSA-N	447.363	1.445	50	20	IDGD	
Cc1ccnc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)c1	1839200173	CXYMGLSZRCAYFI-WMLDXEAASA-N	430.274	1.151	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)cc1O	1839267959	OKFPHDFPOSKRQN-LIRRHRJNSA-N	441.322	1.554	50	20	IDGD	
O=C(c1cc2ncccc2[nH]1)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1839493662	PQKPFOPNQUROEX-SFHVURJKSA-N	427.288	1.437	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3cccs3)C2)C1	1840030905	AJOIRGYKEAUNQU-KBXCAEBGSA-N	445.379	1.921	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(F)c(C)c3N)C2)C1	1840152146	YKGZJUHFOIKSHA-YWZLYKJASA-N	443.903	1.040	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(C)cc3F)C2)C1	1840155278	VVQCBJHUIWWXPW-UZLBHIALSA-N	428.888	1.458	50	20	IDGD	
COc1nc(C)ccc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840188931	LYQBELVXBRKLRF-GOSISDBHSA-N	432.304	1.272	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)/C=C/c3cnc[nH]3)CCO2)C1	1840344300	DEAJLCOJOPWTKZ-UIXCXIJASA-N	441.326	1.053	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)[C@H]2C[C@H]2c2ccc(F)c(F)c2)C1	1841400966	QRWRFBFFNQTOPL-HOTGVXAUSA-N	434.487	1.645	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)C2CCN(Cc3ccccn3)CC2)C1	1842094906	GTQKQNHNAGOSDK-LJQANCHMSA-N	434.968	1.751	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1onc3ccccc13)C2	1843416615	GNOPPHDSEXRIIE-ZVHZXABRSA-N	434.456	1.779	50	20	IDGD	
Cc1cc(C(=O)N2CCCC23CN(C(=O)CCC(=O)NN(C)C)C3)n(-c2ccccc2)n1	1843438624	BNTRKKPGTDAGAW-UHFFFAOYSA-N	438.532	1.371	50	20	IDGD	
C[C@H](Cc1ccc(F)cc1)C(=O)N1CCCC12CN(C(=O)c1cnccc1C(=O)NN)C2	1845900082	BYBGIMHPVRJTDD-OAHLLOKOSA-N	439.491	1.520	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@H]1CC(=O)N(c3cccc(OC)c3)C1)C2	1846359661	FDKFNQGSRZTMEQ-MAUKXSAKSA-N	449.935	1.505	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)C1=CCN(C(=O)OC(C)(C)C)C1	1847728398	UVJZHXWRGXGCIG-JYJNAYRXSA-N	427.929	1.619	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)OCC(=O)NNC(=O)c2ccc(C)cc2)c1	10927790	JKRMSOUDMLQTEQ-UHFFFAOYSA-N	447.513	1.644	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)c1	14841829	ISENDMXSDKWRBT-UHFFFAOYSA-N	428.401	1.818	50	20	IDGD	
O=C(CCNC1=NS(=O)(=O)c2ccccc21)NNC(=O)c1cc2c(s1)CCCCC2	15743668	LWAMIWNTFWZCHV-UHFFFAOYSA-N	446.554	1.907	50	20	IDGD	
COC[C@@H](C)n1c(SCC(=O)NNC(=O)C(=O)N2CCCC2)nnc1-c1ccccc1	725713745	UPCDISSXEDNFEK-CQSZACIVSA-N	446.533	1.014	50	20	IDGD	
O=C(C/N=C1/NS(=O)(=O)c2ccccc21)NNC(=O)c1c(Cl)cccc1Cl	727794820	RPWHAUPRKMBJSV-UHFFFAOYSA-N	427.269	1.493	50	20	IDGD	
CCn1c(SCC(=O)N([C@@H]2CCS(=O)(=O)C2)N(C)C)nnc1-c1cccs1	728180737	XDGGRKNAGWFECU-GFCCVEGCSA-N	429.593	1.611	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN1c1ncnc2sccc12)c1ccc(-n2cnnn2)cc1	728513258	VBMMCVNGWCZBIR-HNNXBMFYSA-N	435.473	1.097	50	20	IDGD	
CC(C)NS(=O)(=O)Cc1ccccc1CNC(=O)NNC(=O)c1cccc(C#N)c1	728941875	DFAXOKLZQJZPSL-UHFFFAOYSA-N	429.502	1.530	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)CCc1c(-c2ccccc2)[nH]c2ccc(F)cc12	729274869	GFHHXFVPIWVDFK-ZDUSSCGKSA-N	446.504	1.992	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1cc(-c2ccc(F)cc2)nc2ccccc12	729275612	QBOYYCBRLGSXLE-LBPRGKRZSA-N	430.461	1.740	50	20	IDGD	
O=C(CCc1ccccc1)NNC(=O)CNS(=O)(=O)c1cccc(C(F)(F)F)c1	729354842	NVBLRYBIZLURIB-UHFFFAOYSA-N	429.420	1.764	50	20	IDGD	
O=C(NNC(=O)c1cnn[nH]1)c1ccc(NS(=O)(=O)c2ccc(F)c(Cl)c2)cc1	729456173	UVMISZCEAQSGPJ-UHFFFAOYSA-N	438.828	1.473	50	20	IDGD	
CCN1CCC[C@H]1CN1C[C@H](C(=O)NNC(=O)CSc2ccc(Cl)cc2)CC1=O	729626332	CBPOSYSLUFOULP-ZBFHGGJFSA-N	438.981	1.912	50	20	IDGD	
Cc1noc(C)c1CCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	730677170	KRFUTVJSZJQMLD-UHFFFAOYSA-N	449.533	1.653	50	20	IDGD	
Cc1cc(C(=O)N2CCC[C@@H]2C(=O)NNC(=O)COc2ccccc2O)ccc1[N+](=O)[O-]	730782587	PYWNIEKCHZWLRQ-MRXNPFEDSA-N	442.428	1.440	50	20	IDGD	
COC(=O)c1sc(S(=O)(=O)NNC(=O)c2ccccc2OC)c(C(=O)OC)c1C	731494303	UJCFCVLYMKERMB-UHFFFAOYSA-N	442.471	1.262	50	20	IDGD	
Cc1csc([C@](O)(CC(=O)NNC(=O)CCN2C[C@H](C)O[C@@H](C)C2)C(F)(F)F)n1	732260593	VRMZRSCYRRBXCF-MQIPJXDCSA-N	438.472	1.238	50	20	IDGD	
C[C@@]1(c2ccc(CNC(=O)NNC(=O)c3cnn(-c4ccccc4)c3)cc2)NC(=O)NC1=O	733648193	USGJXFYBTZRILZ-QFIPXVFZSA-N	447.455	1.071	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)Cn1ncc2ccccc2c1=O	734251879	RFCIEUIVMZUREK-UHFFFAOYSA-N	429.502	1.617	50	20	IDGD	
CCC(=O)N1CCCC[C@@H]1C(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	734821524	MREFLQYCNWTNKO-OAHLLOKOSA-N	425.530	1.507	50	20	IDGD	
Cc1cc(C)cc(C2(C(=O)NNc3ncccc3S(=O)(=O)N3CCN(C)CC3)CC2)c1	735117046	MGGWYGKAFORRFH-UHFFFAOYSA-N	443.573	1.809	50	20	IDGD	
Cc1cc(S(=O)(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)cnc1Cl	735267985	SLJUCCDFZCTYQP-UHFFFAOYSA-N	447.945	1.935	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)Cn2ncc3ccccc3c2=O)cc1C	736787858	VXUQIIDXHQDYGK-UHFFFAOYSA-N	428.470	1.333	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)[C@H]2CCC[C@H]2NC(=O)OC(C)(C)C)c2ccccc2c1=O	739678923	NHOJWBDRJXFKKZ-LSDHHAIUSA-N	429.477	1.388	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)C(C)C	740851437	FGNUREGBUDJUQR-GOSISDBHSA-N	429.521	1.303	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)c1cc(S(=O)(=O)N(CC)CC)ccc1C	740853109	KWHYLAKWJJHDLD-UHFFFAOYSA-N	426.539	1.091	50	20	IDGD	
CC(C)CCn1cc(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)nn1	740925720	SHMLJTXXXLVHBK-UHFFFAOYSA-N	435.554	1.017	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)CSc2nc(O)c3cnn(-c4ccccc4)c3n2)cc1	742444558	GSIPYYDBTWXDMI-UHFFFAOYSA-N	445.464	1.946	50	20	IDGD	
COc1cc(C(=O)NNC(=O)N[C@@H]2CCCN(c3ccn(C)n3)C2=O)ccc1OC(C)C	745883922	QUMUSXUMUMGIGG-OAHLLOKOSA-N	444.492	1.356	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCC(OCCN2CCCC2)CC1	745991525	WYCGYOCNDJOBFL-UHFFFAOYSA-N	438.956	1.686	50	20	IDGD	
C[C@H](CC(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)C(=O)c1cccc(F)c1	746086905	MMITWXROXXWNND-GFCCVEGCSA-N	431.376	1.947	50	20	IDGD	
CCS(=O)(=O)c1ccc(N2CCC(NC(=O)NNc3nccc(OC)n3)CC2)cc1	746971475	BWBOILPOJMGLJG-UHFFFAOYSA-N	434.522	1.574	50	20	IDGD	
CSCC[C@@H](NC(=O)c1ccc([N+](=O)[O-])o1)C(=O)NNC(=O)c1ccc(C#N)cc1	747173175	UTBGIWDPVZLQCR-CYBMUJFWSA-N	431.430	1.372	50	20	IDGD	
CC(C)c1ncc(S(=O)(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)[nH]1	747618015	KXHRMDCMLZHNEW-UHFFFAOYSA-N	430.531	1.425	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)NCCN2CCC(N(C)C)CC2)N(C)c2ccccc21	748750243	ILDUOWZIOCRRMA-UHFFFAOYSA-N	438.576	1.799	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)[C@@H]3CCN(C)c4ccccc43)cc2)CC1	750786933	DRKIDJLXQDIMDO-HXUWFJFHSA-N	443.573	1.690	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)Cc1cc[nH]n1	755280761	ZSZSOXBITCOOPV-KRWDZBQOSA-N	426.477	1.717	50	20	IDGD	
COc1ccc(NC(C)=O)cc1NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1	755503008	ZIAWUIMURBUADK-UHFFFAOYSA-N	427.465	1.513	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)Nc2ccccc2S(=O)(=O)NC(C)(C)C)c1O	756526938	UWIDIUGPPPZEKZ-UHFFFAOYSA-N	436.490	1.944	50	20	IDGD	
O=C(NNC(=O)C12CC3CC(CC(C3)C1)C2)Nc1ccn(CC(=O)N2CCOCC2)n1	756659159	NXLCOLFYAJIKGD-UHFFFAOYSA-N	430.509	1.111	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)CN2C(=O)NC3(C[C@@H](C)C[C@H](C)C3)C2=O)cc1OC	756868481	USODPEZXFFPQGH-KBPBESRZSA-N	446.504	1.602	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)c1cnc(OCc2ccccc2)cn1	759051974	AIENKWLJHPCRPL-UHFFFAOYSA-N	434.452	1.911	50	20	IDGD	
N#C/C(=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)NCCc1nc[nH]n1	759227093	OFTLSBZRZXICEP-ZROIWOOFSA-N	438.879	1.463	50	20	IDGD	
COc1ccc2c(c1)OC[C@@H]2CC(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	760262079	AEHJYIHTWRAWSO-NSHDSACASA-N	439.877	1.323	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)c1ccc(CN2C(=O)CCC2=O)cc1	761622327	SIFSUXKMXONLPH-UHFFFAOYSA-N	427.482	1.898	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)on2)ccc1Cl	761805710	WLAWOQKYANURAQ-UHFFFAOYSA-N	438.824	1.856	50	20	IDGD	
C[C@@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3ccc4ccccc4n3)cc2)CCO1	763448974	AGAJIVCKFNIYFH-OAHLLOKOSA-N	433.468	1.860	50	20	IDGD	
O=C(Cc1ccccc1)Nc1cc(NC(=O)C(=O)NNC(=O)c2ccncc2)ccc1F	763462021	HUMKXFMUVQAEMS-UHFFFAOYSA-N	435.415	1.802	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)[nH]n1)C(=O)Nc1ccc(C(=O)NC2CC2)cc1	763600179	FCLJFVDHKYSLRS-UHFFFAOYSA-N	432.440	1.369	50	20	IDGD	
Cc1nnc(-c2cccc(NC(=O)C(=O)NNC(=O)c3cc(-c4ccccc4)[nH]n3)c2)n1C	763604821	MEXVPWFRTNADFE-UHFFFAOYSA-N	444.455	1.580	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(Br)nc2C)cc1	763662180	VLXKNDADGLXVIQ-UHFFFAOYSA-N	437.250	1.326	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(C(=O)NC)c(Cl)c1	763682664	SQNKCQGLWIQBKE-UHFFFAOYSA-N	448.863	1.263	50	20	IDGD	
O=C(COc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1ccc(Br)nc1	763684868	PMYKJFIDNBEXGW-UHFFFAOYSA-N	427.642	1.662	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)C(=O)Nc2cncc(C)c2)c2ccccc2c1=O	763821680	WAFQUJBGMLYTKR-UHFFFAOYSA-N	436.472	1.690	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1Br)C(=O)NNC(=O)CNC(=O)c1cccnc1	763825484	YNSNFZJLTQGMIA-JTQLQIEISA-N	439.241	1.328	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccc(CC(=O)N(C)C)cc1	763867299	ZLPLDHNJVHIOPW-ZDUSSCGKSA-N	430.436	1.010	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccnn2C2CCCC2)cc1	763873799	YWHZBWOAEQKWNC-AWEZNQCLSA-N	427.461	1.754	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)Cn2nc(C)cc2C)c(-c2nc(C3CC3)no2)c1	763884150	AZBDBWKQUHILGR-UHFFFAOYSA-N	437.460	1.522	50	20	IDGD	
O=C(CCSc1ccc(F)cc1)NNC(=O)C(=O)Nc1cnn(-c2ccccc2)n1	763901543	HYBWMGGZETUWSK-UHFFFAOYSA-N	428.449	1.675	50	20	IDGD	
COCCOc1ccc(F)cc1NC(=O)C(=O)NNC(=O)c1cc(Cl)ccc1O	763979575	YJFKHCZJDHMPHU-UHFFFAOYSA-N	425.800	1.610	50	20	IDGD	
CCS(=O)(=O)c1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)c1ccccc1OC	764040340	FUNAYOZUADRBCT-UHFFFAOYSA-N	439.877	1.542	50	20	IDGD	
CCN1CCN(Cc2ccc(NC(=O)C(=O)NNC(=O)c3ccc(Cl)nc3)cc2)CC1	764101610	RUPMKQJUVGNBSP-UHFFFAOYSA-N	444.923	1.272	50	20	IDGD	
O=C(NNC(=O)c1cccc2ncccc12)C(=O)Nc1ccc(NC(=O)[C@@H]2CCCO2)cc1	764253295	OVDIYBQJNCWAAH-IBGZPJMESA-N	447.451	1.752	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(Oc3cccnc3)nc2)c(OC)c1	764287192	WQWZLBLANUZQID-UHFFFAOYSA-N	437.412	1.686	50	20	IDGD	
O=C(NNC(=O)c1cc2ccccc2o1)C(=O)Nc1ccc(N2CCCS2(=O)=O)cc1	764331302	AXNIGEMCSQOPAY-UHFFFAOYSA-N	442.453	1.372	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CCCc2cccs2)cc1NS(C)(=O)=O	764340430	CDPBKKCXHMIELD-UHFFFAOYSA-N	438.531	1.537	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CN2CCC(C(=O)NCCCN3CCCCC3)CC2)c1	764382999	FUUUQRFHALXCKU-UHFFFAOYSA-N	443.592	1.460	50	20	IDGD	
CS(=O)(=O)c1ccccc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	764387280	IIPKMKKBOGSQAX-UHFFFAOYSA-N	445.432	1.019	50	20	IDGD	
COC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)CSc2ccccc2OC)c1	764398643	VPZADJRXWBCDQF-UHFFFAOYSA-N	432.458	1.752	50	20	IDGD	
COc1cc(C)c(Br)cc1NC(=O)C(=O)NNC(=O)c1scnc1C	765387557	VQAIMHCAODUZFU-UHFFFAOYSA-N	427.280	1.931	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)Cn2cc(Br)ccc2=O)n[nH]1	765595596	NOCNBOPEPWOXJM-UHFFFAOYSA-N	446.261	1.471	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3F)CC2)cc1	765753969	HHZIGKKHTJXBET-UHFFFAOYSA-N	429.452	1.621	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)[C@H]1CSCCS1	766664152	OKHIFEQZRGZCAM-MRXNPFEDSA-N	429.011	1.454	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCC[C@@H]1C[C@H](O)c1cnn(C)c1	766945453	KNDGPDGJPLJVKS-WBVHZDCISA-N	435.912	1.431	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)[C@@H]1CCCN(C(=O)N2CCCC2)C1	767283527	LOQWXNZOEHPYDL-GOSISDBHSA-N	430.505	1.156	50	20	IDGD	
CCc1nc(C(=O)OCC(=O)NNC(=O)Cc2ccccc2C)nn1-c1ccccc1F	767348667	RTNFZAZVAAFWET-UHFFFAOYSA-N	439.447	1.824	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)c2ccc(-n3cnc4ccccc43)nc2)c2ccccc2c1=O	768268657	MPSQMQQZPMAHBY-UHFFFAOYSA-N	439.435	1.742	50	20	IDGD	
COc1ccc(C)cc1N1C[C@H](C(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)CC1=O	769694912	RTDKTENGDUJHCJ-MRXNPFEDSA-N	438.484	1.759	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@](C)(O)C(C)C)c1	770210227	UYMRHYDRXICYSK-FQEVSTJZSA-N	435.502	1.664	50	20	IDGD	
CC(C)[C@H](NC(=O)COc1ccccc1)C(=O)NNC(=O)c1ccc2c(c1)OCCO2	770393081	LPJBSSQVTLLZCE-FQEVSTJZSA-N	427.457	1.439	50	20	IDGD	
Cc1cccc(F)c1NNC(=O)C(=O)Nc1ccc(C(=O)NCC(=O)N(C)C)c(Cl)c1	770822082	RLEYSSZTEMIOHL-UHFFFAOYSA-N	449.870	1.687	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNS(=O)(=O)c1ccccc1Br	771605840	RXLNSNKOXXXZIB-UHFFFAOYSA-N	446.710	1.728	50	20	IDGD	
CSc1nc(C)c(CCC(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)c(O)n1	772188746	VLIYSRAXBJEVCA-UHFFFAOYSA-N	437.909	1.262	50	20	IDGD	
CS[C@H](C)CCC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	773208062	QDNRHVMHTVKLTQ-OAHLLOKOSA-N	443.591	1.319	50	20	IDGD	
O=C(NNc1ncc(Cl)cc1Cl)C(=O)Nc1ccc(CN2C(=O)CNC2=O)cc1	773677994	QGFBGMVTBWFHIF-UHFFFAOYSA-N	437.243	1.522	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2cccc(-c3cn(Cc4ccccc4)nn3)c2)n1	773726639	OUWRSTQWBBFCOK-UHFFFAOYSA-N	444.455	1.874	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCC(c2nnc3n2CCCC3)CC1	775824234	NIPXBSVHVZVDIN-UHFFFAOYSA-N	446.939	1.917	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)c2ccc(N3CCCS3(=O)=O)cc2C)nc1C	778425388	SLDGDBXNDJRUEE-UHFFFAOYSA-N	433.490	1.567	50	20	IDGD	
CCc1c(C(=O)NNC(=O)CNC(=O)OC(C)(C)C)nnn1-c1ccc(OC(C)C)cc1	778438430	RUHWXFQGFCXJRD-UHFFFAOYSA-N	446.508	1.903	50	20	IDGD	
CCn1c(CCC(=O)NNc2ccnc(F)c2)nc2cc(S(=O)(=O)N(C)C)ccc21	781362467	IPLCKJQKRMLZJI-UHFFFAOYSA-N	434.497	1.917	50	20	IDGD	
CC(C)Cn1cc(C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)cn1	782013374	IIAAHWAWTFDTIG-UHFFFAOYSA-N	432.956	1.771	50	20	IDGD	
O=C(NNc1ccc([N+](=O)[O-])cc1)[C@@H]1C[C@H](O)CN1S(=O)(=O)c1ccc(Cl)cc1	782016396	DEEDORDJBSZNRW-HOCLYGCPSA-N	440.865	1.515	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)Nc2cccc(N3CCN(C(C)=O)CC3)c2)c1	782080688	DHMGERYZPAQKGD-UHFFFAOYSA-N	441.488	1.839	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)N1CCC[C@H](n2ccc(C(F)(F)F)n2)C1	782503860	LJSFVVLKUDNMRK-NSHDSACASA-N	428.371	1.303	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)c1cccc(NS(=O)(=O)C(F)(F)F)c1	782539888	ILTOSQDZLJKNOX-UHFFFAOYSA-N	441.391	1.979	50	20	IDGD	
Cc1cc(Br)c2oc(C(=O)NNC(=O)N[C@@H]3CCS(=O)(=O)C3)cc2c1	782550429	NHQOWWKCVIKEGT-SNVBAGLBSA-N	430.280	1.635	50	20	IDGD	
CC(C)OC(=O)c1ccc(Cl)c(NC(=O)C(=O)NNc2ccc(-n3cccn3)nn2)c1	783432617	BDHNKIPOWRFYGW-UHFFFAOYSA-N	443.851	1.963	50	20	IDGD	
C[C@H](CC#N)Sc1ccccc1NC(=O)C(=O)NNC(=O)CNC(=O)c1cccs1	784005164	RSNYOPXXCRTCPN-GFCCVEGCSA-N	445.526	1.658	50	20	IDGD	
Cc1cccc(F)c1NC(=O)C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	784231049	UHXDQMDKJLGFAK-UHFFFAOYSA-N	449.508	1.152	50	20	IDGD	
O=C(NNc1ccc(Cl)nn1)C(=O)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1	784786119	DZPBGNHPJPPBNE-OAHLLOKOSA-N	440.895	1.855	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNc2ccc(F)cc2Br)cccc1-n1cnnn1	784803858	XBLRQNYJUOCXQM-UHFFFAOYSA-N	434.229	1.954	50	20	IDGD	
COCCCS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ncccc2Cl)cc1	784818460	XQOSRRRXTJILDY-UHFFFAOYSA-N	426.882	1.627	50	20	IDGD	
O=C(COC(=O)c1nc(Cl)ccc1Cl)NNC(=O)[C@@H]1COc2ccccc2O1	785188736	CEEYTXVWCGDECM-LBPRGKRZSA-N	426.212	1.533	50	20	IDGD	
COc1cc(F)cc(NNC(=O)C(=O)Nc2ccc(C)c(N3CCCS3(=O)=O)c2)c1	785242363	YVGMHRUGVBEBCL-UHFFFAOYSA-N	436.465	1.764	50	20	IDGD	
COC(=O)CCc1cccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)c1	786414156	KDVDMEKUJGMNKR-ZDUSSCGKSA-N	431.420	1.485	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCc2nccn2C1)c1nn(Cc2ccccc2)c(=O)c2ccccc12	786687937	PWDWGABBYZQFIQ-QGZVFWFLSA-N	442.479	1.665	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)[C@H](C)C1CN(C(=O)OC(C)(C)C)C1	786988774	JNPZOCRBDFWQAS-OAHLLOKOSA-N	433.505	1.731	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)c3cc(N4CCNC(=O)C4)ccn3)n[nH]2)cc1	787176561	COXFEZLCAYZYEA-UHFFFAOYSA-N	433.472	1.045	50	20	IDGD	
CCNC(=O)Nc1ccc(C)c(NC(=O)C(=O)NNC(=O)c2c(C)nc3ccccn23)c1	787541506	UDZJLQGDBCSINN-UHFFFAOYSA-N	437.460	1.492	50	20	IDGD	
COC(=O)c1cncc(S(=O)(=O)NNC(=O)[C@H](C)Oc2ccc3ccccc3c2)c1	788478692	UJLNTOCHCVDACH-ZDUSSCGKSA-N	429.454	1.798	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2ccc(O[C@H]3CCOC3)cc2)ccc1Cl	788719634	JYLMYIYXKGGFGY-AWEZNQCLSA-N	439.877	1.230	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NN=Cc1ccc2c(c1)NC(=O)CO2	788720570	OAGZRZWPFVYIHQ-UHFFFAOYSA-N	441.919	1.939	50	20	IDGD	
CC(C)(C)c1cc(CS(=O)(=O)N2CCN(S(=O)(=O)CBr)CC2)no1	790264559	MAKXIZXNEYSYMO-UHFFFAOYSA-N	444.373	1.102	50	20	IDGD	
Cn1nc([C@H]2CCCOC2)cc1NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1	790551141	JPGXYQSURDMRBN-HNNXBMFYSA-N	428.497	1.173	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)[C@](C)(O)Cn2cc(C(F)(F)F)ccc2=O)cc1	792629137	OEIHHLPVMIXWBC-GOSISDBHSA-N	426.395	1.186	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C2CCC(NC(=O)C3CC3)CC2)c2ccccc2c1=O	792809862	DMCLCNUPBYRKJS-UHFFFAOYSA-N	425.489	1.262	50	20	IDGD	
COc1ccc(C(=O)N2CCCC2)cc1NC(=O)C(=O)NNc1ccc2c(=O)[nH]ccc2c1	793070712	TVFZONYRHDKDHZ-UHFFFAOYSA-N	449.467	1.855	50	20	IDGD	
COC1(CNC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)CCC(C)CC1	793319438	OPGHEAKICRWNDE-UHFFFAOYSA-N	440.566	1.541	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNS(=O)(=O)c2cncc(Br)c2)cc1C	795286095	FOJDGGRCJULNPV-UHFFFAOYSA-N	427.280	1.409	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@@H](C(=O)NN=c2sc3ccccc3n2C)[C@H](C)O)cc1	798304110	JTXIZUMCGUXKMC-SUMWQHHRSA-N	434.543	1.208	50	20	IDGD	
O=C(CCc1ccccc1)NNC(=O)NCCCNS(=O)(=O)c1ccccc1Cl	798492518	DYEFKQSALXNDCW-UHFFFAOYSA-N	438.937	1.972	50	20	IDGD	
CC(C)NC(=O)C(=O)NNS(=O)(=O)c1cc(C(F)(F)F)ccc1Br	799119738	GRJPIEGEALCOLU-UHFFFAOYSA-N	432.218	1.302	50	20	IDGD	
CCOC(=O)C1(S(C)(=O)=O)CCN(C(=O)NNC(=O)c2cccc3ccccc23)CC1	805148408	AVAQSVRACHBQHN-UHFFFAOYSA-N	447.513	1.637	50	20	IDGD	
CNS(=O)(=O)c1cc(NC(=O)NNC(=O)c2cc(-c3ccccc3)on2)ccc1F	806546025	MFYCIMOPLHIODO-UHFFFAOYSA-N	433.421	1.855	50	20	IDGD	
CNS(=O)(=O)c1cc(NC(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)ccc1F	806546343	LVDNAYBLPDJGQQ-SNVBAGLBSA-N	428.417	1.493	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2cccc3c2CNC3=O)c1	806753384	NOVOZHBQMLSPGD-UHFFFAOYSA-N	445.501	1.427	50	20	IDGD	
Cc1cc(I)cc(NC(=O)C(=O)NNC(=O)c2ccccc2O)c1	806972909	RHQYIFZXEQRGBE-UHFFFAOYSA-N	439.209	1.705	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)C(=O)Nc1nc(C2CCOCC2)cs1	806974684	RHZQWKAHUDDGNC-UHFFFAOYSA-N	449.445	1.110	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)C(=O)Nc1ccc2nccnc2c1Br	806978803	KTEBTOOMPLJBAM-UHFFFAOYSA-N	429.234	1.116	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)C(=O)Nc1ccc(N2CCCC2)c(Cl)c1	807429038	OHQZFCLJLLBWJZ-UHFFFAOYSA-N	426.868	1.998	50	20	IDGD	
CN(CC(Cl)Cl)C(=O)CCC(=O)N1CCN(S(=O)(=O)c2ccccc2)CC1	808248211	DXFWBHKKCYZVIL-UHFFFAOYSA-N	436.361	1.562	50	20	IDGD	
NC(=O)c1ccc(OCC(F)F)c(NC(=O)NNC(=O)c2ccc3c(c2)OCCO3)c1	810343387	VYBHSOODETWTCZ-UHFFFAOYSA-N	436.371	1.667	50	20	IDGD	
COc1cc(F)c(F)cc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccc(C(C)=O)cc1	810386206	QCLSXPATADGKLY-LLVKDONJSA-N	435.383	1.729	50	20	IDGD	
N#Cc1cncc(S(=O)(=O)NNC(=O)[C@H]2Cc3ccccc3CN2Cc2ccccc2)c1	811683866	KDKHRVDZKHRBOM-JOCHJYFZSA-N	447.520	1.890	50	20	IDGD	
COC(=O)c1cn(-c2cccc(NC(=O)NNC(=O)COc3ccc(Cl)cc3)c2)nn1	812979173	BMYAPPFQTLHLAV-UHFFFAOYSA-N	444.835	1.939	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1cc([N+](=O)[O-])ccc1O)c1ccc(N2CCCNC2=O)cc1	813241288	BMYFHVLSTOMAAH-GFCCVEGCSA-N	442.432	1.925	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)c1cnn(C)c1I	814737980	PSMJBGLTBLBWNR-MRVPVSSYSA-N	432.193	1.392	50	20	IDGD	
Cc1ccc(-n2c(NNC(=O)CCn3ncn(C)c3=O)nc3ccccc3c2=O)c(C)c1	815603901	XTAFPEIBJZJKOQ-UHFFFAOYSA-N	433.472	1.431	50	20	IDGD	
Cc1ccc(C(=O)N2C[C@@H](C)C[C@H](C)C2)cc1NC(=O)C(=O)NNC(=O)[C@H]1CCCO1	815778947	KTLDWQHQKUDIOK-SUNYJGFJSA-N	430.505	1.378	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@@H](CS(C)(=O)=O)c2ccccc2)cc(OC)c1OC	816814582	WKJLFCUBTKYKOT-HNNXBMFYSA-N	436.486	1.302	50	20	IDGD	
N#CCCNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cc3ccccc3cc2O)cc1	849208366	MTBOFYXQEKPOCD-UHFFFAOYSA-N	438.465	1.812	50	20	IDGD	
N#Cc1cccc(S(=O)(=O)NCC(=O)NNC(=O)CCSc2ccc(F)cc2)c1	913035132	DIKKKYPLQPAJPR-UHFFFAOYSA-N	436.490	1.305	50	20	IDGD	
CC(C)NS(=O)(=O)Cc1ccc(CNC(=O)NNC(=O)c2cccc(N(C)C)c2)cc1	916227410	BQPDWQYUJTZTPZ-UHFFFAOYSA-N	447.561	1.725	50	20	IDGD	
CN1CCN(C(=O)c2ccc(CNC(=O)NNC(=O)c3cn(C)c4ccccc34)cc2)CC1	916390797	QYTRFVVBHDKEAA-UHFFFAOYSA-N	448.527	1.710	50	20	IDGD	
COC(=O)CCOc1ccc(S(=O)(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)cc1	917728947	YHZLMHBMPLBTGZ-UHFFFAOYSA-N	449.485	1.194	50	20	IDGD	
C[C@@]1(NNC(=O)NCc2cccc(NC(=O)c3ccc(F)cc3)c2)CCS(=O)(=O)C1	918102826	HYGXGSXSJWIJNZ-HXUWFJFHSA-N	434.493	1.959	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2ccc([C@@H](C)NC(C)=O)s2)cc1OC	918399644	ROGLWLMJYOONOE-SNVBAGLBSA-N	427.504	1.586	50	20	IDGD	
CCCS(=O)(=O)N1CCCC[C@H]1C(=O)NNC(=O)c1ccc(OCC)c(OC)c1	919682652	IFXVVLFKCSFYQB-HNNXBMFYSA-N	427.523	1.449	50	20	IDGD	
COc1ccc(OCCCNC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)cc1	919922317	JUMTYBUFWLNYHT-UHFFFAOYSA-N	449.533	1.710	50	20	IDGD	
Cc1cc(N2CCN(C)CC2)ccc1NC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	920932575	QCNMXVSXNBLUJY-FQEVSTJZSA-N	425.489	1.740	50	20	IDGD	
CS(=O)(=O)c1nc(C(=O)NNC(=O)CCSc2ccc(F)cc2)c2ccccn12	921166702	LZCDGEJJDQABBO-UHFFFAOYSA-N	436.490	1.820	50	20	IDGD	
Cc1ccc([C@]2(C)NC(=O)N(CC(=O)NNC(=O)c3cncn3-c3ccccc3)C2=O)cc1	1317870945	WAXBRIKJMMLVAP-QHCPKHFHSA-N	446.467	1.409	50	20	IDGD	
CS(=O)(=O)Nc1cccc(CNC(=O)NNC(=O)c2ccc(Br)cc2)c1	1317878932	RHVBCSSKIRWVPZ-UHFFFAOYSA-N	441.307	1.965	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)N[C@H]1CCCN(C(=O)c2ccccc2)C1	1321400445	MQARNQXVNXGBFN-KRWDZBQOSA-N	426.473	1.709	50	20	IDGD	
CCC[C@@H](C)C(=O)NCCNC(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1	1324442747	BLDCVPSSBJYEPB-CQSZACIVSA-N	427.546	1.516	50	20	IDGD	
O=C(COCc1ccncc1)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	1330126449	FFDFLSKJVMXJBW-UHFFFAOYSA-N	431.924	1.217	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNC(=O)NCCCN2C(=O)NC(C)(C)C2=O)cc1	1351536982	VKPFUYFKSBBTRL-UHFFFAOYSA-N	433.509	1.776	50	20	IDGD	
COc1ccc([C@@H](O)C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](F)Cl)C2)cc1	1778022657	NOGDLTQGMBCXTA-WOCWXWTJSA-N	428.888	1.777	50	20	IDGD	
C[Si](C)(C)c1cc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)co1	1779004008	VFGFFLTVCXHRLK-RHSMWYFYSA-N	447.377	1.959	50	20	IDGD	
CCc1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](F)Br)C3)nn1C	1779909981	FYBHOYZRHSFTDX-RVKKMQEKSA-N	445.333	1.801	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Br)C2)c1ccc([N+](=O)[O-])[nH]1	1780234388	KNNUSCLSRDUFEB-PVXIVEMSSA-N	447.261	1.741	50	20	IDGD	
CC[C@@H](NC(C)=O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Br)C1	1780770241	JUKHQQWEYXMFKC-VMUDFCTBSA-N	436.322	1.106	50	20	IDGD	
O=C(Cc1n[nH]c2cc(Cl)ccc12)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1780942433	SYVPBGXEUBSTDC-VQIMIIECSA-N	441.315	1.188	50	20	IDGD	
CCOc1ncccc1C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781327248	XSZBNKBWPCRNLT-CXAGYDPISA-N	430.274	1.614	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc3c[nH]nc3c1)C2	1782173085	WKIPNAICZPWVPF-HGHGUNKESA-N	434.924	1.944	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)N1C[C@H]3C[C@H]3C1)C2	1782175067	BOMUHBFZPSTSHL-IGYPPAOUSA-N	427.973	1.094	50	20	IDGD	
CC(C)C1(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CCC(=O)NN(C)C)C2)CCC1	1782214623	XKXFHIFXWJUVRL-XMSQKQJNSA-N	436.597	1.700	50	20	IDGD	
Cc1nn(C)c(C)c1CC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C(Cl)Cl)C1	1782220005	RFCBHJIWKSOWBU-DNVCBOLYSA-N	431.364	1.897	50	20	IDGD	
C[C@H](CC(=O)N1CC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1)c1ccccc1	1783287422	VNGDAEJELJJXKL-WZONZLPQSA-N	430.549	1.383	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccnc(OC)c3)CCO2)C1	1783350094	ZYIVCYMPNRCQQT-KSSFIOAISA-N	426.311	1.707	50	20	IDGD	
CC(=O)N[C@H](C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](C)Br)C2)C1)C(C)(C)C	1783530504	ZVHMJDCQMCWSDQ-DFHBCGBQSA-N	432.359	1.151	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccnc4c3OCO4)CCO2)C1	1783537999	RVSBPVKNZYVTJN-DIFFPNOSSA-N	426.267	1.037	50	20	IDGD	
CC(C)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CC(c4ccccc4)=NN3)C[C@@H]21	1783853114	ZJPRLBKGCHHTMG-XEYPJELSSA-N	446.979	1.997	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cc(C)nn3-c3ccccc3)CCO2)C1	1783875507	MXHJYXGUFYIYPO-XMSQKQJNSA-N	446.935	1.878	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](C)N1CSCSC1)CCO2	1783877558	KMXSLOPIPPIHNO-KEYYUXOJSA-N	438.015	1.113	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cn(C)nc3C(F)(F)F)CCO2)C1	1783877897	RKLFMPANGGWJFE-BLLLJJGKSA-N	438.834	1.136	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(OCCCO)cc3)CCO2)C1	1783883153	VILHJBBRKDAAAO-WIYYLYMNSA-N	440.924	1.145	50	20	IDGD	
COC(=O)[C@@H]1CC[C@H](C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Br)C[C@@H]32)C1	1784088528	WTPYFPMVICNPBG-JLZCTACVSA-N	449.317	1.246	50	20	IDGD	
CC(C)N1CCC(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCBr)[C@H]3C2)CC1	1786400957	IQABRAXGROFTME-BZSNNMDCSA-N	444.414	1.872	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3[nH]nc4ccncc34)C[C@@H]21	1788764086	JTHJMLBBDXQUDD-QRTARXTBSA-N	431.569	1.403	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC1(c2ccc(NC(=O)[C@@H](COC)NC(C)=O)cc2)CCC1	1789661203	IAKLUEBJIOXKSH-IAGOWNOFSA-N	425.913	1.525	50	20	IDGD	
CCc1cc(C(=O)Nc2ccc(C3(NC(=O)c4cccc(B(O)O)c4)CCC3)cc2)no1	1789844047	QHBXXKNKUUBWBA-UHFFFAOYSA-N	433.273	1.978	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CC[C@H](C(=O)OC)CC3)C[C@@H]21	1789858092	RLMCVMIEDZQAKQ-QQCJEOGWSA-N	428.957	1.963	50	20	IDGD	
O=C(/C=C/C1CCCCC1)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21	1789900681	SWPTUUOEDHBBGY-LPCYXGDASA-N	440.349	1.096	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3C[C@@H](O)C3)C[C@@H]21	1790694271	KXBBVEJUHGRBQL-MWGRTOOISA-N	445.466	1.622	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc([N+](=O)[O-])[nH]3)C[C@@H]21	1790962988	IFIWZHYSAQJDSI-MNXVOIDGSA-N	443.298	1.690	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/c3cccc(OC)c3)C[C@@H]21	1791257807	ULMQALSNNVUWFI-FSIFMMIXSA-N	436.936	1.942	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3ccc(O)cn3)[C@H]2C1	1791710537	FAVDDWCDJWGBCJ-BMYCAMMWSA-N	430.332	1.546	50	20	IDGD	
COc1cccc(N2C[C@@H](C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)[C@H](O)CCl)C4)CC2=O)c1	1792483465	HJIBKVCCIIEZMD-SELXPKCUSA-N	449.935	1.286	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3n[nH]cc3c1)C2	1792868226	UPZHCYKOBVRNJN-FIUQPQMISA-N	435.322	1.797	50	20	IDGD	
Cc1cccn2ncc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@@H](C)CBr)c12	1792874467	PVZYUVFWTDUVMB-MPTYRVRUSA-N	449.349	1.877	50	20	IDGD	
O=C(Cc1ccc(Br)cn1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCl	1793110911	RPKBWYSXVFWMFN-LXTVHRRPSA-N	430.730	1.625	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1[nH]cnc1-c1cccnc1)C2	1795114925	MWPWRDWQFAXUST-MIFYACCESA-N	448.321	1.460	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1CNc2ccccc21	1796067451	MPKKGLGTZGKRFQ-YGTYGHESSA-N	434.500	1.146	50	20	IDGD	
C[Si](C)(C)c1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)co1	1796191476	PQOURBJAUBUATH-REPLKXPHSA-N	440.381	1.070	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1[nH]nc3c(Cl)cccc13)C2)[C@H](F)Cl	1796367241	BXPZZRJHRMLULB-BPKTZYHTSA-N	429.279	1.883	50	20	IDGD	
CCCNC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C(C)=N/NC(=O)c1ccc[nH]1	1796890702	GDOQSIFPMJPLIG-OSSGZSMMSA-N	444.536	1.065	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1snnc1C)C2	1796892561	QBWICNDGEPWECH-ZVMOGAGKSA-N	429.506	1.232	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1ccn2nccc2c1	1797555845	QFKGTEUOXLNVHY-AYRXBEOTSA-N	425.258	1.228	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(Cl)nc1F)C2	1797952802	LZWQONHZLDKBBP-DRXBFXEBSA-N	429.952	1.929	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(Br)cn1	1798032590	HFFVTONJCSBKRW-NDPMZMCLSA-N	446.729	1.301	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnc(Cl)c(Cl)c1	1798077442	JJPPBUDCQRBHCB-XCCSTKFXSA-N	436.723	1.845	50	20	IDGD	
CN(C)c1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Br)C3)cn1	1798262405	OJLJFXFVSWTLKT-AYRXBEOTSA-N	429.290	1.041	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cc2cccnc2cc1F	1799243123	YWXTVQRWZYCNBH-DLRJPAPCSA-N	449.910	1.760	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(C#N)c1	1799601418	UDUXRMYKFYGLQB-OLGCSEPZSA-N	432.484	1.944	50	20	IDGD	
COc1c(C)cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)cc1C	1800607679	ZBDUTWAWFUZSPE-WKCHPHFGSA-N	436.317	1.557	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1CCC(CO)CC1)C2	1800640333	SBUZKGUJUJQFQI-VONXPYPISA-N	431.371	1.548	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)c1ccc(O)cc1)C2	1800759948	SSDUAKFAJABAHQ-YTHJTJSOSA-N	425.323	1.869	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CCc2ccccc2O1	1800955022	NRMMFBJLHREVRF-UIVXMWCNSA-N	437.334	1.753	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nnc(-c3ccccc3)o1)C2	1800976691	CIAGZUPNYQSDLW-FZKCQIBNSA-N	434.880	1.194	50	20	IDGD	
CC[C@@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](C)N1CCN(C)CC1)C2	1801804169	UFNVGJAGZRXTPO-ZOFXXKQRSA-N	429.403	1.434	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1CCN(C(=O)[C@H]2CCC(=O)N2)[C@H]1c1cccnc1	1803010017	ZKDIHNKFAMIWTN-JWDQPFGJSA-N	437.338	1.397	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cnn3ccccc23)[C@H]1c1cccnc1)[C@@H](O)CCl	1803138671	CZICHEKKNUVUCA-SNRMKQJTSA-N	427.892	1.649	50	20	IDGD	
CCCNC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)[C@H](Cl)COC)[C@@H]1c1cccnc1	1803449221	ZGEHMGQTXNFDPS-SQGPQFPESA-N	438.956	1.648	50	20	IDGD	
C[C@@H]1[C@H](C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](O)CCl)C3)CCN1C(=O)OC(C)(C)C	1804630019	CJJBSWCOZHZTBA-XJTKPRQNSA-N	443.972	1.870	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H](CNC(=O)Cc2ncccn2)[C@@H]1c1cccnc1	1804693765	XCHPRTZIMRGUDU-UTKZUKDTSA-N	427.581	1.972	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)Cc2ccccn2)[C@@H]1c1cccnc1	1807655672	LCVGHHAGAGIFDQ-JPYJTQIMSA-N	438.532	1.098	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)c1cc[nH]c2nccc1-2	1808068061	YAENGZHELIGVNZ-QGTPRVQTSA-N	427.892	1.829	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)[C@@H](C)N2CCN(C)CC2)[C@@H]1c1cccnc1	1808273593	DKFBCSYVUCFNNY-RSPOEFSDSA-N	436.000	1.741	50	20	IDGD	
CC(C)N[C@H](C(=O)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1)C(C)C	1809967133	XVPXWHSLOFRULD-NRFANRHFSA-N	443.397	1.234	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)c1cc2cn[nH]c2cn1	1810082607	KJFADWXBQFKIIV-MORSLUCNSA-N	428.880	1.272	50	20	IDGD	
CC(=O)N(C)CCC(=O)N1CC[C@H](CNC(=O)CO[Si](C)(C)C)[C@H]1c1cccnc1	1810539837	JJMCMIWSIXMOIG-WIYYLYMNSA-N	434.613	1.807	50	20	IDGD	
CC[C@@H](NC(N)=O)C(=O)N1CCCC2(CCN(C(=O)[C@H](C)CBr)CC2)C1	1810811828	LMOVFPDGHODOGF-ZIAGYGMSSA-N	431.375	1.696	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2cc(F)c[nH]2)[C@H]1c1cccnc1	1812922366	WJVFATSIMIBXHT-FOIQADDNSA-N	430.484	1.241	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@H](CNC(=O)COc2cccnn2)[C@@H]1c1cccnc1	1813387058	JDMUSNRWBKQCKJ-UWJYYQICSA-N	443.580	1.808	50	20	IDGD	
CC(C)C1(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)CCC1	1813665735	XXPRWXRMPMZDIV-IFMALSPDSA-N	449.360	1.907	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)c3cnccc3F)sc2C1	1815972024	BVIPZJOZDWYPID-NSHDSACASA-N	434.497	1.276	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccnc2C(N)=O)n[nH]1	1816077001	APTSUHNRXZKJMT-GXTWGEPZSA-N	434.884	1.463	50	20	IDGD	
Cc1cccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)n1	1816394254	TXNOURGPXKJDQI-LJQANCHMSA-N	433.277	1.413	50	20	IDGD	
Cc1cc(NC(=O)CC(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@@H](F)Cl)CC3)no1	1817240321	IGBIHELQUZDAMJ-XLKFXECMSA-N	429.861	1.915	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)Cc2ccsc2)[nH]n1)c1cccc(B(O)O)c1	1817474281	CBRNWNZXABCYCQ-GOSISDBHSA-N	438.318	1.700	50	20	IDGD	
C=CCO[C@@H](C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819401619	LCAYALLYDUHBJZ-GUYCJALGSA-N	441.492	1.305	50	20	IDGD	
CCCC(=O)N[C@H](C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1	1819565507	MTUQIXFXRRIOAD-GDBMZVCRSA-N	449.556	1.080	50	20	IDGD	
CN1N=C(C(=O)N2CCCC[C@H]2c2cc(NC(=O)CO[Si](C)(C)C)n[nH]2)CCC1=O	1819592138	YNSLYCIIZJGOQE-HNNXBMFYSA-N	434.573	1.862	50	20	IDGD	
C[C@H](C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](F)Br)n[nH]1)n1cnnn1	1820936924	HYSFIJGTPBDHQD-UBHAPETDSA-N	429.254	1.340	50	20	IDGD	
C[C@H](Br)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(=O)n2O)[nH]n1	1822186698	PPXSAPQDGDIUEG-CMPLNLGQSA-N	438.282	1.898	50	20	IDGD	
Cc1ccnc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)c1	1822414825	ZNSGVNGNWCKZSC-QGZVFWFLSA-N	427.509	1.792	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CN1C(=O)C=CC1=O)CC2	1822868975	DHTHJGKGJIHUHB-XYZCENFISA-N	445.328	1.216	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)Cn2ccnn2)CC1	1824092954	JRXVSHFYMQSOLI-GOEBONIOSA-N	426.359	1.929	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)Cn2nccn2)CC1	1824093793	DEYHBMQSPVDKHH-GOEBONIOSA-N	426.359	1.929	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)[C@H](O)Cc3ccccc3)sc2C1	1825440412	ZJGHYKWASNBBTO-OFQRWUPVSA-N	437.949	1.913	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc[n+]([O-])cc1)CC2	1825641024	HKTBBXAGVFJBSW-GXSJLCMTSA-N	425.308	1.786	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](F)Br)CC2	1826005946	BRBKZBKORCOFPC-BYULHYEWSA-N	428.711	1.999	50	20	IDGD	
CSCC[C@H](O)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](C)Br)CC2	1826136148	VPOLQBSAOUPSNP-QXEWZRGKSA-N	436.397	1.953	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](COC)NC(C)=O)CC1	1829117354	GVZFCKCXKRRRPX-KSZLIROESA-N	431.961	1.011	50	20	IDGD	
C/C=C/C(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)[C@@H](O)CCl)C2)C1	1829269484	VDQIFRWXEPUMRF-NXZIYRRWSA-N	449.935	1.614	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(F)c3C)CCO2)C1	1830164168	XTABBCZNPUOSNU-UZLBHIALSA-N	428.888	1.458	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CCC=CO3)C2)C1	1830540813	SROOXLBYQXHVQY-RVKKMQEKSA-N	431.327	1.167	50	20	IDGD	
Cc1cc2cc(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)[C@@H](O)CCl)CCO4)ccc2[nH]1	1830735337	HHVMPQGFNDVFFY-GHTZIAJQSA-N	435.908	1.146	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)NCCC#N)C2)C1	1831646480	LWTXINSKQRCGCY-JXFKEZNVSA-N	428.961	1.132	50	20	IDGD	
O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)C1CCC(CO)CC1)CCO2	1832518512	ZHBXRJQCNAYPAJ-RJYAGPCLSA-N	447.370	1.027	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)Cc3ccc(F)c(F)c3)CC2)CC1)[C@H](O)CCl	1833309193	RIWKERAUNJKBPG-LJQANCHMSA-N	443.922	1.679	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3ccc4ncncc4c3)CC2)CC1)[C@@H](O)CCl	1833310105	IQQUHYWMSVBQCU-FQEVSTJZSA-N	445.951	1.415	50	20	IDGD	
C[C@@H](Oc1ccccc1)C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)CCl)CC2)CC1	1833312044	JEOQQVAPMWOVJN-OXQOHEQNSA-N	437.968	1.625	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](C)CS(C)(=O)=O)CC2)CC1	1833483869	AGYLPXDUPLLZJO-WMLDXEAASA-N	436.018	1.256	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ncc(Cl)cn3)CCO2)C1	1833783081	LOXXABIURWMONN-GOSISDBHSA-N	431.320	1.465	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)CCc3ccccn3)CC2)CC1	1833887189	KYMSGNVJHJTUOE-HXUWFJFHSA-N	436.984	1.840	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)[C@@H]3CCC(=O)N3)CC2)CC1	1834526658	OCSZNDSAGZLYHL-CVEARBPZSA-N	443.386	1.010	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(CN(C(=O)CCc3ccsc3)CCO2)C1	1836005750	KTZNGCDTWMDLBJ-HXUWFJFHSA-N	440.638	1.989	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3ccc[nH]3)CCO2)C1	1836018098	VENSNQLTRWTSDC-QFBILLFUSA-N	442.354	1.577	50	20	IDGD	
O=C(c1cn2ccsc2n1)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836717394	WEFRGFFVDILIEF-INIZCTEOSA-N	440.953	1.608	50	20	IDGD	
Cc1cc(C(N)=O)cc(C)c1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1837435831	DTKXXADZCXQGDV-OXQOHEQNSA-N	441.887	1.007	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3nccc4occc34)C2)C1	1837711885	VWBMZZDKHJLINW-NRFANRHFSA-N	447.564	1.749	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)C[C@](C)(O)CC(=O)O)CC2)CC1	1838637342	SUJMDARYEOZEAP-UZLBHIALSA-N	432.945	1.618	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)CBr)C2)C1	1839141350	GBFASUPYKPBMBR-WWGRRREGSA-N	425.751	1.491	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2	1839150152	ZXMFZMBHBCLVHD-IAGOWNOFSA-N	429.772	1.944	50	20	IDGD	
COc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)ccn1	1839153690	ONZWMGPNRFRYQZ-MOPGFXCFSA-N	446.331	1.397	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(O)nc3)C2)C1	1839153833	SWLTYLABVWPYAE-ZWKOTPCHSA-N	432.304	1.094	50	20	IDGD	
Cc1cnc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)s1	1839198068	RPACUJIYJOJXLC-ABAIWWIYSA-N	436.303	1.212	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C1(C(=O)OCC)CC1)CCO2	1839760037	ZESSHGFHBBGQNL-KXBFYZLASA-N	430.929	1.194	50	20	IDGD	
C=C(C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](Br)CC)CCO2)C(F)(F)F	1839966937	UUXLMONBHVMBKF-DOMZBBRYSA-N	443.260	1.735	50	20	IDGD	
O=C(Cc1cccc(F)c1F)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1839983226	WPEGSNAYDPSZRW-GOSISDBHSA-N	437.270	1.767	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CCBr)C2)C1	1840031738	AZKIBFPFOXAOPU-FZMZJTMJSA-N	442.148	1.011	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)/C(C)=C/c3cccnc3)C2)C1	1840156122	OFTFOGWKWJKWOG-IGFQPDJCSA-N	437.924	1.195	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC12CN(C(=O)c1ccc3c(n1)NC(=O)CC3)C2	1841286662	RIGGAOUUEXABMX-GFCCVEGCSA-N	435.322	1.814	50	20	IDGD	
CCC(=O)N[C@@H](C)C(=O)N1CC2(CCCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C1	1841924113	WHHLSRHGFQRTGM-KBPBESRZSA-N	444.960	1.237	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1ncc(Cl)cn1)C2	1843415415	GIGFFJHWUKHJBM-WYMPLXKRSA-N	429.868	1.081	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1cc(F)ccc1F)C2	1843416431	JVOUAVTUZYDNEW-DHRITJCHSA-N	429.427	1.916	50	20	IDGD	
COc1ccc([C@H]2C[C@@H]2C(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)cc1	1844263522	NHUFGHAGUMPHNY-MOPGFXCFSA-N	449.511	1.314	50	20	IDGD	
CC[C@@H](C)[C@@H](N)C(=O)N1CC2(CCCN2C(=O)c2cc([N+](=O)[O-])ccc2OC(C)=O)C1	1844692302	JLHWPHMVXMOAKY-FZKQIMNGSA-N	432.477	1.711	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@H]2Cc3[nH]nc(C(F)(F)F)c3C2)C1	1845858690	KDYXPMFHTMVFON-PWSUYJOCSA-N	434.846	1.601	50	20	IDGD	
Cc1cc(C)c(OCC(=O)N2CC3(CCCN3C(=O)CCC(=O)NN(C)C)C2)c(C)c1	1846383923	IUQVGQSDLZJULY-UHFFFAOYSA-N	430.549	1.567	50	20	IDGD	
CC(C)(C)OC(=O)N1CCOC[C@H]1C(=O)N1CC2(CCCN2C(=O)C(Cl)Cl)C1	1846387475	BPUZXGYDJLMCHS-LBPRGKRZSA-N	436.336	1.629	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CCc1cccc(C)n1	1848113412	WRHNEPFHTMQFAV-FMEPYYHXSA-N	436.516	1.658	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CCN2C(=O)[C@@H]3CCCC[C@H]3C2=O)cc(OC)c1OC	3517889	ZNVWRQACVLSRBA-ZIAGYGMSSA-N	433.461	1.039	50	20	IDGD	
C#CCNS(=O)(=O)c1ccc(C(=O)NNC(=O)COc2cc(C)ccc2C(C)C)cc1	26068911	ULJVSKRAMLTVIV-UHFFFAOYSA-N	443.525	1.870	50	20	IDGD	
CS(=O)(=O)c1nc(C(=O)NNC(=O)c2ccc(Br)s2)c2ccccn12	109251386	VAPTZSRKCCFIFA-UHFFFAOYSA-N	443.304	1.637	50	20	IDGD	
CS(=O)(=O)Nc1cc(C(=O)NNC(=O)c2ccc3c(c2)OCCO3)ccc1Cl	109494247	YERJNGJRKUAMBK-UHFFFAOYSA-N	425.850	1.558	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)CS(=O)(=O)Cc1cccc(Br)c1	303307398	DXYFDNCXJGINSJ-UHFFFAOYSA-N	443.294	1.893	50	20	IDGD	
COc1cccc([C@@H](CNC(=O)NNC(=O)CNC(=O)c2cccs2)N2CCCC2)c1	726085825	LOIWNOOAVGHZDJ-QGZVFWFLSA-N	445.545	1.654	50	20	IDGD	
CC(=O)N[C@H](CC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)c1c(F)cccc1F	727364668	BFBCWBSGRJESDI-MRXNPFEDSA-N	443.410	1.240	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNS(=O)(=O)c1ccc(-n2cnnn2)cc1	728171142	RLNZINTWUQVBNG-UHFFFAOYSA-N	441.498	1.718	50	20	IDGD	
O=C(NCCc1ccc(OC(F)F)cc1)NNC(=O)C1CCN(c2ncccn2)CC1	728942271	NTTIBGXIQWAAQH-UHFFFAOYSA-N	434.447	1.868	50	20	IDGD	
Cc1ccc(S(=O)(=O)Nc2cccc(C(=O)NNC(=O)Cc3cc[nH]n3)c2)cc1F	730102395	AKLIQIKBWKGWHU-UHFFFAOYSA-N	431.449	1.662	50	20	IDGD	
COc1ccccc1C/C(C)=C/C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	730343098	CXFSLFOICRZGSH-IURSYISVSA-N	440.452	1.715	50	20	IDGD	
Cc1nc2c(C(N)=O)cnn2c(C)c1CCC(=O)NNc1ccc(Br)nc1	732838040	GQWIYCLSOLUUSY-UHFFFAOYSA-N	432.282	1.678	50	20	IDGD	
COc1ccc(NC(C)=O)cc1S(=O)(=O)NNC(=O)c1cnn(-c2ccccc2)c1	733123055	OVDWDYDGEVVHID-UHFFFAOYSA-N	429.458	1.463	50	20	IDGD	
CC(C)[C@@H](C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)n1nnc(-c2ccccc2)n1	734239586	SUULPVMRJORPQR-HNNXBMFYSA-N	446.512	1.392	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)CN1C(=O)[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O	734251881	RHMKLOQNIRSQLC-DSIZOQBWSA-N	446.529	1.014	50	20	IDGD	
COc1cc(C(=O)NNC(=O)N[C@@H]2CCN(C3CCN(C)CC3)C2)ccc1OC(C)C	734284153	TUOHMPJZFMMLJA-QGZVFWFLSA-N	433.553	1.595	50	20	IDGD	
COc1ccc([C@@H]2[C@@H](C(=O)NNC(=O)[C@H]3COc4ccccc4O3)CCC(=O)N2C)cc1	734313348	IFELFCNVSANBMQ-LDQXTDLNSA-N	439.468	1.592	50	20	IDGD	
COc1ccc(S(=O)(=O)C[C@@H](C)C(=O)NNC(=S)NCCc2cccs2)cc1	735123878	PQEWBZKPTHLXGY-CYBMUJFWSA-N	441.600	1.905	50	20	IDGD	
COc1cc(OC)cc(C(=O)Nc2ccc(C(=O)NNC(=O)c3c[nH]nc3C)c(O)c2)c1	735515920	DQDMBMVWOHYHQR-UHFFFAOYSA-N	439.428	1.768	50	20	IDGD	
O=C(NNC(=O)c1ccn(-c2cccc(C(F)(F)F)c2)n1)N[C@H]1CCS(=O)(=O)C1	737808731	SRGHBNGOUJKZSG-NSHDSACASA-N	431.396	1.022	50	20	IDGD	
CC1(C)[C@H](NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)[C@@H]2CCO[C@H]21	741427097	WIOYIPUBIPHRMN-GVDBMIGSSA-N	436.534	1.229	50	20	IDGD	
Cc1nn(C)c2sc(C(=O)N[C@H](C)C(=O)NNc3nc(-c4ccncc4)no3)cc12	742062152	KPVFXVLCQFIJJY-SNVBAGLBSA-N	426.462	1.650	50	20	IDGD	
COCCOc1ccc(CNC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)cc1	743551126	KCFKXARRGMNIFT-UHFFFAOYSA-N	436.490	1.651	50	20	IDGD	
COc1cc(C(=O)NNC(=O)N[C@H]2CCN(Cc3ccccc3)C2=O)cc(OC)c1OC	744877914	KWDJDMWTXASJJK-INIZCTEOSA-N	442.472	1.458	50	20	IDGD	
O=C(COC(=O)[C@@H]1C[C@]12CCCc1ccccc12)NNC(=O)[C@@H]1COc2ccccc2O1	745713161	AVMKBRAMBLXLDP-REIDKSKDSA-N	436.464	1.811	50	20	IDGD	
C[C@@H](O)CC(C)(C)CNC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	745845395	NZUHFGUODRMERC-CQSZACIVSA-N	426.539	1.212	50	20	IDGD	
NC(=O)COc1cccc(CNC(=O)NNC(=O)c2ccc(Br)s2)c1	745898910	FJVVYBRFKUFRTM-UHFFFAOYSA-N	427.280	1.519	50	20	IDGD	
NC(=O)COc1ccc(C=NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc1	745985781	WLINFQZBIDKJJK-UHFFFAOYSA-N	430.486	1.099	50	20	IDGD	
O=C(NNC(=O)N1CCOCC1)c1cccc(S(=O)(=O)N2CCc3ccccc32)c1	745992908	MVOSKMCUZAWRTQ-UHFFFAOYSA-N	430.486	1.125	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)[C@@H]3CN(C)CCO3)c2)c(C)c1	746092556	WMRLFZMBEXERPH-IBGZPJMESA-N	446.529	1.196	50	20	IDGD	
C[C@H](NC(=O)OC(C)(C)C)C(Cc1ccccc1)=NNC(=O)N[C@@H]1CCS(=O)(=O)C1	746563990	FPNZWURYYUSVNI-GOEBONIOSA-N	438.550	1.985	50	20	IDGD	
COc1cc(C)nc(NNC(=O)C2CCN(S(=O)(=O)c3cccnc3Cl)CC2)n1	746630737	NKZGMIASSZLSKS-UHFFFAOYSA-N	440.913	1.386	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)NCc1cn(-c2ccccc2)nc1-c1ccncc1	748622090	CJFSCDDHNQRIGC-MRXNPFEDSA-N	438.488	1.816	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	749345104	UDYOJRVELVSMDM-UHFFFAOYSA-N	434.541	1.054	50	20	IDGD	
O=C(NNc1nc(Br)cn2ccnc12)c1ccc(=O)n(-c2ccccc2)n1	750248682	SBIMRVUSWXKQSN-UHFFFAOYSA-N	426.234	1.795	50	20	IDGD	
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCC(=O)NNC(=O)c1cccs1	750301792	SWXYYUBVZIBSSI-INIZCTEOSA-N	428.470	1.281	50	20	IDGD	
COc1cc(OC)cc(N2C[C@@H](C(=O)NNC(=O)Cc3cn4ccccc4n3)CC2=O)c1	752354639	OXQIVCKDYCFBJE-AWEZNQCLSA-N	437.456	1.095	50	20	IDGD	
COc1cc(OC)cc(N2C[C@H](C(=O)NNC(=O)COc3ccc(C#N)cc3)CC2=O)c1	752401094	XKMRWEQDWHAWOO-OAHLLOKOSA-N	438.440	1.155	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cc(F)cc(C)c2[N+](=O)[O-])cc1OC	752556748	GOHHMRDJTLHHDS-UHFFFAOYSA-N	435.364	1.678	50	20	IDGD	
Cc1ccccc1OCc1nnc(SCC(=O)NNC(=O)CO)n1-c1ccccc1	753442805	PJARQQDCHAMSLZ-UHFFFAOYSA-N	427.486	1.387	50	20	IDGD	
Cc1noc(C)c1[C@@H](C)CC(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	754468922	XAPPXRCDCHXYON-ZDUSSCGKSA-N	436.538	1.259	50	20	IDGD	
C[C@@H]1CN(c2ccc(NC(=O)NNC(=O)COc3ccccc3[N+](=O)[O-])cn2)C[C@@H](C)O1	755864242	GSTVMHLJJGVCGM-ZIAGYGMSSA-N	444.448	1.835	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)Nc1cccc(N2CCCS2(=O)=O)c1	755885104	NDOPQXIMJZAWIE-UHFFFAOYSA-N	448.501	1.857	50	20	IDGD	
O=C(NCCN1C(=O)[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)NNC(=O)c1ccc(Cl)cc1Cl	756092709	DBNLIHFXYVPCRP-NBLIUIFLSA-N	437.283	1.745	50	20	IDGD	
CCN(CC)C(=O)Cn1ccc2cc(NC(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)ccc21	756395130	HKEGHIOARGQRAJ-HNNXBMFYSA-N	449.533	1.097	50	20	IDGD	
CN(C)C(=O)CNC(=O)c1ccc(NC(=O)NNC(=O)Cc2ccc(F)cc2)cc1Cl	757724370	FYPDMLUBKHPTIW-UHFFFAOYSA-N	449.870	1.693	50	20	IDGD	
CCOC(=O)Cn1cccc(NC(=O)NNC(=O)CSc2ccccc2OC)c1=O	757764789	SAPYWOPXAVHULB-UHFFFAOYSA-N	434.474	1.365	50	20	IDGD	
CN(C)N(C(=O)c1cc(I)ccc1F)[C@@H]1CCS(=O)(=O)C1	762270821	VCCSGJFHHYLHCK-SNVBAGLBSA-N	426.251	1.536	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)CCNS(=O)(=O)c2cccc(C(C)=O)c2)n1	762898876	NRCAAGBQFDULNR-UHFFFAOYSA-N	434.522	1.337	50	20	IDGD	
O=C(NNC(=O)c1ccccc1)C(=O)Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1	763423293	MQJBXLSWVIVXSV-UHFFFAOYSA-N	444.513	1.651	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNS(=O)(=O)c1cc2c(cc1Cl)NC(=O)C2	763439818	VAXDSDCSSAWSHM-UHFFFAOYSA-N	446.913	1.449	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)sc2c1CCC2	763453820	BBQMWSSTZZVCPS-UHFFFAOYSA-N	446.441	1.721	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1ccnc(Sc2ccccn2)c1	763467349	CKPUQTZRVBAUOB-UHFFFAOYSA-N	438.425	1.936	50	20	IDGD	
Cc1cc(N2CCOCC2)ccc1NC(=O)C(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	763472604	ZYMMKOLSMHLVCL-UHFFFAOYSA-N	427.417	1.140	50	20	IDGD	
CNC(=O)c1ccc(OC)c(NC(=O)C(=O)NNC(=O)c2ccccc2Br)c1	763482966	PUGKOVDVUXFRTF-UHFFFAOYSA-N	449.261	1.217	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cccc3c2ccn3C)cc(OC)c1OC	763540427	UVYIIZXBCRDDBM-UHFFFAOYSA-N	426.429	1.604	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)COc2ccc(C)c(C)c2)ccc1NC(C)=O	763665250	QDTJKZAMMRICPF-UHFFFAOYSA-N	428.445	1.435	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)cccc1N1CCOC1=O	763685894	ZAECDDPCUYXMAC-UHFFFAOYSA-N	446.847	1.770	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(N2CCSCC2)cc1	763713210	LZVLWESYUXRQGL-UHFFFAOYSA-N	442.541	1.967	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2ccc(N3CCOCC3)c(C)c2)c1	763775380	QCYINPKMROIJPD-UHFFFAOYSA-N	442.472	1.249	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cnn(-c2ccccc2Cl)c1	763812067	BTFYKCPELCXZHS-UHFFFAOYSA-N	438.831	1.562	50	20	IDGD	
Cc1csc(NC(=O)C(=O)NNC(=O)c2nn(CCC(C)C)c(=O)c3ccccc23)n1	763843660	STMHUXWROTTWPS-UHFFFAOYSA-N	442.501	1.607	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)NC(=O)[C@@H](C)O3)c1C	763850533	OONOEDBTATZCTD-ZIAGYGMSSA-N	440.456	1.576	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)cc1C(=O)N(C)C	763851001	SEOBHTHPVLBLSO-ZDUSSCGKSA-N	430.436	1.389	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccccc2O[C@H](C)C#N)cc1	763862444	XMAUCUNIMNBDEQ-CABCVRRESA-N	440.456	1.930	50	20	IDGD	
CO[C@H](C)C(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)CSc2ccc(C)cc2)c1	763898646	ZXYYKRWNAOOBGH-CQSZACIVSA-N	444.513	1.847	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)Cc2ccc(F)cc2)sc2c1CCC2	763931244	DOEUPBAEURWOQG-UHFFFAOYSA-N	433.461	1.881	50	20	IDGD	
Cc1ccc(Cn2nccc2NC(=O)C(=O)NNC(=O)C2=S=C3CC[C@H](C)CC3=C2)o1	763938149	ASNMLKJPOPGJSP-LBPRGKRZSA-N	441.513	1.757	50	20	IDGD	
CCNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2ccc(Br)s2)c1	763942087	TWSICXIQIMEBBR-UHFFFAOYSA-N	439.291	1.660	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)C(=O)Nc1cccc(S(=O)(=O)N2CCCCC2)c1	763961126	YSHKKJJOCTXYTO-UHFFFAOYSA-N	444.513	1.569	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccc(C(=O)NC(C)(C)C)cc1	764136825	UKWIMDXEYGFCAD-UHFFFAOYSA-N	426.473	1.552	50	20	IDGD	
CN(C)CC(=O)NNC(=O)C(=O)Nc1cc(C(F)(F)F)ccc1SCC(F)F	764213555	ZNEFAJSOOJTLAP-UHFFFAOYSA-N	428.383	1.710	50	20	IDGD	
CCN(CC)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2scnc2C)cc1Cl	764246371	HAANEPGDPQTXQB-UHFFFAOYSA-N	437.909	1.987	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1)C(=O)Nc1cccc(Cn2cccn2)c1	764389200	ZRRQPBABANEJCA-UHFFFAOYSA-N	447.430	1.860	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@]2(CCN(CC(=O)NNC(=O)c3ccc(C#N)cc3)C2)C1	765028982	ZIDOGMZAAUGNHC-QFIPXVFZSA-N	427.505	1.652	50	20	IDGD	
O=C(CSc1nnc(-c2cccnc2)n1Cc1ccco1)NNC(=O)Cc1cccnc1	765421514	VNSKTOWFLJSLJO-UHFFFAOYSA-N	449.496	1.859	50	20	IDGD	
CC(=O)Nc1ccccc1CC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	768090542	NKRZPGPWOATWQL-UHFFFAOYSA-N	445.545	1.267	50	20	IDGD	
COc1cc2c(cc1NC(=O)C(=O)NNC(=O)CCCc1cccs1)NC(=O)CC2	768241713	HWMNUIWPGNWAPJ-UHFFFAOYSA-N	430.486	1.750	50	20	IDGD	
O=C(NNC(=O)c1ccc(=O)n(-c2ccc(F)cc2)n1)c1cc(-c2ccc(F)cc2)[nH]n1	768289160	PIGSODINTJVGJH-UHFFFAOYSA-N	436.378	1.976	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=S)Nc2ccccn2)ccc1F	768581429	QFKJSWMGUFLFMT-UHFFFAOYSA-N	425.511	1.883	50	20	IDGD	
C[C@]1(c2cccc(C(=O)NNC(=O)c3cc(Br)ccc3O)c2)NC(=O)NC1=O	769147184	NXBBYXIHWJVICN-GOSISDBHSA-N	447.245	1.284	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1cccc2c1CCN2C(C)=O	769264870	HLDKVFXONQYRPJ-UHFFFAOYSA-N	442.497	1.482	50	20	IDGD	
COc1ccc(NC(=O)NNc2nc(C)cc(C)n2)cc1S(=O)(=O)N1CCOCC1	769925394	IMLBTTFXJWJHGQ-UHFFFAOYSA-N	436.494	1.272	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)NCCNC(=O)c3c(F)cccc3F)nc21	770394990	NDVVAILWWJCZGO-UHFFFAOYSA-N	448.434	1.621	50	20	IDGD	
Cc1oncc1C(=O)Nc1ccc(O)c(C(=O)NNC(=O)c2ccc3c(c2)OCCO3)c1	770468655	KHLGQJAKAXSNHM-UHFFFAOYSA-N	438.396	1.787	50	20	IDGD	
COc1ccc(-n2nc(C(=O)OCC(=O)NNC(=O)c3ccc(C#N)cc3)cc2C)cc1	771174227	WUONDYYXHNWVHF-UHFFFAOYSA-N	433.424	1.679	50	20	IDGD	
CCSCc1cc(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)no1	771432343	RXZPDEZNVXXWCE-UHFFFAOYSA-N	439.563	1.621	50	20	IDGD	
C[C@H]1NC(C(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)=NN(c2ccccc2)C1=O	772963966	MSONKTFETDDOCF-CHWSQXEVSA-N	429.864	1.593	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H]2CCc3cc(O)ccc3C2)c1	775086397	SUFQHTLDWGOQJE-MRXNPFEDSA-N	432.502	1.144	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(Br)cc1F)[C@@H]1COc2ccccc2O1	775251520	UTJPKPZBXWOGAX-ZDUSSCGKSA-N	431.239	1.738	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN[C@H](C)c2cccc(N3CCOC3=O)c2)cc1OC	775259609	CGOUGWWRRPNROY-CQSZACIVSA-N	442.472	1.772	50	20	IDGD	
O=C(NNC(=O)c1cccc(OC(F)F)c1)Nc1ccnn1[C@H]1CCS(=O)(=O)C1	776060377	WVWPCWFYBLJIQD-NSHDSACASA-N	429.405	1.311	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2cc(-c3ccco3)nc3ccccc23)ccn1	776597337	QUJOWMMVYMXDAK-UHFFFAOYSA-N	437.437	1.612	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNS(=O)(=O)c1cccc(S(F)(F)(F)(F)F)c1	777623377	DPLSYUNSUKZCCD-SSDOTTSWSA-N	447.429	1.591	50	20	IDGD	
CCS(=O)(=O)c1ccc(CNC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])cc1	777748865	IEROOBKRRKNSRM-UHFFFAOYSA-N	436.446	1.298	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cnn([C@H](C)C3CC3)c2)cc1	778708346	YXRXDRHVKFJUJA-ZIAGYGMSSA-N	429.477	1.806	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H]1CC(=NNC(=O)CSc2nnc(O)nc2O)c2ccccc21	779767558	GGLFXVVBDRSVTD-LBPRGKRZSA-N	446.489	1.865	50	20	IDGD	
N#Cc1ccc(N2CCC[C@H](NC(=O)NNC(=O)COc3ccc(F)cc3)C2=O)cc1	780902515	MLXYGESOGZWWRC-SFHVURJKSA-N	425.420	1.602	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NCc2ccccc2CN2CC[C@H](O)C2)cc1	781951034	GDQVMKJVJYTVFJ-SFHVURJKSA-N	428.489	1.171	50	20	IDGD	
CNC(=O)[C@H]1CN(C(=O)C(=O)Nc2ccccc2S[C@H](Cl)C(F)(F)F)CCO1	782005820	YADYUTQKEKNZPE-BMIGLBTASA-N	439.843	1.818	50	20	IDGD	
CC(=O)N1CCN(CCOc2ccc(CCNS(=O)(=O)CBr)cc2)CC1	782434620	LJEDKSDWUZNMTE-UHFFFAOYSA-N	448.383	1.044	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc(C(=O)O)c(Cl)cc1Br)c1cnccn1	782463880	WHEICPHXOCMZNG-UHFFFAOYSA-N	435.643	1.214	50	20	IDGD	
CN1CCC/C1=N/S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccccc2F)cc1	782707421	NILGVDZAGZZIAS-ULJHMMPZSA-N	433.465	1.720	50	20	IDGD	
CCOC(=O)[C@@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNc2ccccc2F)cc1F	782708475	OQGIREDSIDMAJC-LLVKDONJSA-N	434.399	1.728	50	20	IDGD	
CCCn1nc(C(=O)NNS(=O)(=O)c2ccc(OC)c(F)c2C)c2ccccc2c1=O	782910791	PIEYYSINQLHMSV-UHFFFAOYSA-N	448.476	1.886	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2ccc3c(c2)ncn3-c2ccccc2)CCS(=O)(=O)C1	783426662	IZNLJNBHVRFNLZ-HXUWFJFHSA-N	427.486	1.162	50	20	IDGD	
CN(C)c1ccc(S(=O)(=O)N(C)C)cc1NC(=O)C(=O)NNc1ccccc1Cl	784771003	SUUCWQGNPMKMRA-UHFFFAOYSA-N	439.925	1.738	50	20	IDGD	
CNS(=O)(=O)c1cc(NC(=O)C(=O)NNc2ccc(Br)nc2)ccc1C	784807123	LDDBMACZEVIMFE-UHFFFAOYSA-N	442.295	1.142	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)C(=O)Nc2ccc(OCC(F)(F)F)nc2)c1	784839287	IGXPFNZTKZQXCX-UHFFFAOYSA-N	432.380	1.508	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cccc(C(F)(F)F)n2)cc1	786414096	JPUHZSHPXXUMAQ-NSHDSACASA-N	438.362	1.856	50	20	IDGD	
Cc1occc1C(=O)Nc1nc(CC(=O)NNc2ccccc2S(N)(=O)=O)cs1	788230318	MPRNOMNFDUOIKJ-UHFFFAOYSA-N	435.487	1.630	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2ccc(OC)cc2OCCOC)c2ccccc2c1=O	788493464	VNIQLFPSNJNBCK-UHFFFAOYSA-N	440.456	1.525	50	20	IDGD	
COc1c(CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)oc2ccccc12	788860748	IIVVAOYWNMBUAE-UHFFFAOYSA-N	431.474	1.879	50	20	IDGD	
CN1CCC/C1=N/S(=O)(=O)c1cccc(NC(=O)NNc2cc(Cl)nc(N)n2)c1	789043442	IBUGNOHRKSUKIF-OYKKKHCWSA-N	438.901	1.674	50	20	IDGD	
O=C(NNC(=O)[C@H]1OCC[C@H]1c1ccccc1)C(=O)Nc1cnn(Cc2ccccc2)c1	789809932	HKPXINHUPHDJCO-PMACEKPBSA-N	433.468	1.590	50	20	IDGD	
Cc1nn(-c2ccccc2)cc1NC(=O)C(=O)NNC(=O)[C@H]1OCC[C@H]1c1ccccc1	789812333	LKOBNRSRWPYVIU-ICSRJNTNSA-N	433.468	1.839	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)Nc2cn(C)nc2OC)cc1	789861810	FHQBEAZHWYIYPQ-GDNBJRDFSA-N	449.471	1.722	50	20	IDGD	
COC(=O)c1cc(Cl)cc(S(=O)(=O)NNC(=O)CCc2ccccc2O)c1OC	790053291	PCQZZRGUIXEAPK-UHFFFAOYSA-N	442.877	1.783	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN(CCO)Cc2ccc(Br)s2)n1	792484955	NQXDAAPVVIOFTM-UHFFFAOYSA-N	447.380	1.460	50	20	IDGD	
COc1cc(C(=O)CCC(=O)N([C@@H]2CCS(=O)(=O)C2)N(C)C)cc(OC)c1OC	792855801	TYPQLJOJKKWFOR-CQSZACIVSA-N	428.507	1.168	50	20	IDGD	
CCOC(=O)c1cc(COC)cc(S(=O)(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c1	793348764	DPCWDRXGMIHIPD-UHFFFAOYSA-N	437.430	1.541	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)c2cccc(NN3C(=O)[C@H]4CC=CC[C@H]4C3=O)c2)nc1	793735687	PCBFNYKDWFUWCM-CALCHBBNSA-N	435.440	1.903	50	20	IDGD	
O=C(NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12)c1cc([N+](=O)[O-])n[nH]1	794768995	ZDLAWDDCJPMCTR-UHFFFAOYSA-N	433.384	1.151	50	20	IDGD	
CC(=O)c1cc(Br)ccc1OCC(=O)NNC(=O)CNC(=O)c1ccco1	795955481	POVINIDCHSBNBS-UHFFFAOYSA-N	438.234	1.201	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)c2cccc(S(=O)(=O)NCc3ccco3)c2)c1	798337143	BGSYGLVRSSEFBG-UHFFFAOYSA-N	449.510	1.919	50	20	IDGD	
Cc1ccc(-n2cc(O)c(C(=O)OCC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)n2)cc1	801367369	QKZSFESJFBGCDN-UHFFFAOYSA-N	439.384	1.413	50	20	IDGD	
O=C(NNC(=O)c1sccc1S(=O)(=O)N1CCSCC1)Nc1ccccc1	801987267	ZEYDFWOIXYXXPG-UHFFFAOYSA-N	426.545	1.952	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)[C@@](C)(O)CN2C(=O)C(C)(C)c3ccccc32)cc1	802055675	QNHGMYVCMPCRPB-QFIPXVFZSA-N	426.473	1.923	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)[C@](C)(O)Cn2cc(C(F)(F)F)ccc2=O)cc1	802060196	BCINOOUHZCWTFK-QGZVFWFLSA-N	428.367	1.480	50	20	IDGD	
CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)NNC(=O)Nc1ccc2c(c1)OCO2	802095857	ROGDNFAXRBXHFG-QGZVFWFLSA-N	441.419	1.936	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)Nc1ccc(F)c(N2CCCNC2=O)c1	806804960	OVOYKLWMQYPXLK-QGZVFWFLSA-N	429.408	1.738	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1scc(C)c1C(=O)OC	806973845	LTRHMUQXBJVZFB-UHFFFAOYSA-N	435.458	1.407	50	20	IDGD	
CON(C)S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2C)cc1	807456953	YDRKKTCDKSBYRT-UHFFFAOYSA-N	437.434	1.167	50	20	IDGD	
COc1ccc([C@H](C)NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c(C)c1OC	807599454	MSRJEMQSFJXGPM-ZDUSSCGKSA-N	439.472	1.964	50	20	IDGD	
CC(C)S(=O)(=O)CCNC(=O)NNC(=O)[C@@H](C)Oc1cccc(Br)c1	808193120	SJKFPJDMIFFSOK-LLVKDONJSA-N	436.328	1.370	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2ccc(S(C)(=O)=O)cc2)nn1-c1ccc(F)cc1F	808937484	ZBMCLRLTKAMLNM-UHFFFAOYSA-N	449.439	1.944	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cnc(C(F)(F)F)cc1C	810384942	LQDUHESVOALFTB-UHFFFAOYSA-N	440.378	1.972	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)C(=O)Nc2ccc3nc(C)nn3c2)c1	810386495	CLGUELJKOKORRC-UHFFFAOYSA-N	447.249	1.209	50	20	IDGD	
COC[C@]1(C(=O)NNC(=O)COc2ccc(C#N)cc2)CCN(C(=O)OC(C)(C)C)C1	811870128	BWSLARMCSLNCCJ-NRFANRHFSA-N	432.477	1.358	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)[C@@H](c2ccccc2F)N2CCOCC2)cc1	812731517	KHVYDVFIDBVJAO-LJQANCHMSA-N	436.509	1.593	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)Nc2ccccc2C(=O)N2CCOCC2)cc1	812918191	OWEPPLNVZSZALE-UHFFFAOYSA-N	447.517	1.558	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)Cc2c[nH]c3ccccc23)nnn1Cc1ccccc1F	815566421	SWZXMSUGQQCREP-UHFFFAOYSA-N	449.446	1.584	50	20	IDGD	
N#Cc1cc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)ccc1Br	815570588	HHGDFOURUPSMJN-UHFFFAOYSA-N	449.286	1.905	50	20	IDGD	
N#C/C(=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)N1C[C@@H]2[C@@H](CO)[C@@H]2C1	816860898	CNKZIKXHNFWFAM-YIPIMWKKSA-N	439.903	1.683	50	20	IDGD	
CCOc1ccc(NNC(=O)CN2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)cc1	817882618	VVFJWDISKQRWBG-UHFFFAOYSA-N	432.546	1.843	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)CCCN2C(=O)NC(C)(C)C2=O)c1	818756730	JTGGJFRSVFLMLE-UHFFFAOYSA-N	441.282	1.789	50	20	IDGD	
CC(C)C[C@@H](C(=O)NNC(=O)COc1ccc(C#N)cc1)N1C(=O)[C@H]2CC=CC[C@H]2C1=O	864018080	QOAXGVSECGCQSN-OTWHNJEPSA-N	438.484	1.450	50	20	IDGD	
O=C(COC(=O)c1cccc(NC(=O)C2CC2)c1)NNC(=O)c1ccc([N+](=O)[O-])cc1	899147587	GNYDSLPIXJKJHQ-UHFFFAOYSA-N	426.385	1.561	50	20	IDGD	
COc1ccc(C(=O)N2CCN(CC(=O)NNC(=O)c3cccc(Cl)c3)CC2)cc1	912888005	CWNUGAUQILVFTF-UHFFFAOYSA-N	430.892	1.568	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)CN2C(=O)N[C@@](C)(c3ccc4ccccc4c3)C2=O)n1	913025924	WPCHOHWUGVWWGW-QHCPKHFHSA-N	448.483	1.268	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)NC1CCN(C(=O)C2CC2)CC1	914536733	AKEBKFIXRXUOIB-UHFFFAOYSA-N	439.310	1.559	50	20	IDGD	
CCN1C[C@@H](C(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)CC1=O	914754573	CERHUWCJNZHBDB-SFHVURJKSA-N	433.472	1.018	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccc(C(N)=O)cc2)c1	915880179	UNADWOGWWMXSJC-UHFFFAOYSA-N	433.490	1.283	50	20	IDGD	
N#Cc1cccc(OCC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)c1	916096338	OBWOLWGNBORWEF-UHFFFAOYSA-N	442.497	1.573	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)NCc2cccc(S(=O)(=O)NC(C)C)c2)c1	916486474	UNAREZIDOOKTBG-UHFFFAOYSA-N	448.545	1.900	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1	918118534	UCKVACMVQJJRBL-GOSISDBHSA-N	439.516	1.606	50	20	IDGD	
COc1ccc(/C=C(/C#N)C(=O)OCc2nnnn2-c2ccc(S(C)(=O)=O)cc2)cc1	918864242	OANATOFSPKEAKW-PTNGSMBKSA-N	439.453	1.725	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)OCC(=O)N[C@H](C)C(=O)N(C)C)c(C)n1C[C@@H]1CCCO1	918952513	IGMTUNIVIGDTLP-NUJRJDIVSA-N	430.505	1.327	50	20	IDGD	
CNS(=O)(=O)c1ccc([C@H](C)NC(=O)NNC(=O)CCc2ccc(OC)cc2)cc1	919909869	DPXKPBJKQTUMGM-AWEZNQCLSA-N	434.518	1.628	50	20	IDGD	
COc1ccc(C2(CNC(=O)NNC(=O)[C@@H]3COc4ccccc4O3)CCOCC2)cc1	919925398	VFSVWTSPWHQZLF-FQEVSTJZSA-N	441.484	1.914	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)c1ccc(Cl)c(S(=O)(=O)N(C)C)c1	920006340	HVLCUINJVGQVET-UHFFFAOYSA-N	425.894	1.603	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NCc2cccc(C(=O)N3CCOCC3)c2)cc1C	920811618	JVOMXITXYUJIAT-UHFFFAOYSA-N	440.500	1.685	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)NC[C@@H](c1cccc(F)c1)N1CCOCC1	921247432	FAPHGSZDYXIXHX-SFHVURJKSA-N	446.479	1.617	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCN(c2cccc(Br)c2)C1=O)c1n[nH]c2c1CCCC2	1115858435	QQLXJCGUPHVISM-CQSZACIVSA-N	446.305	1.865	50	20	IDGD	
Cc1nc(N(C)C)sc1C(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	1116436570	VWYJPHNJTNQRTI-UHFFFAOYSA-N	426.543	1.861	50	20	IDGD	
C=CC(=O)NCc1ccc(C(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1	1318558357	PISSOURPAPGKQM-UHFFFAOYSA-N	430.505	1.897	50	20	IDGD	
O=C(CCc1ccc2c(c1)CCO2)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	1323990536	IXAQJSLUYKWKHT-UHFFFAOYSA-N	436.512	1.160	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)c1cc(C(=O)OC)nn1-c1ccccc1	1326269646	KOCGAQLNCXCQSW-UHFFFAOYSA-N	438.440	1.898	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)C1CCC3(CC1)OCCO3)C2)[C@H](F)Cl	1778030315	WEQKYVUWKNOBIE-JTDSTZFVSA-N	432.920	1.968	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cccn3ccnc23)C1	1779057444	LPWJRBAWNXQXIR-CBGDNZLLSA-N	434.924	1.716	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H]1Cc3ccccc3CN1)CCO2	1779295259	CLKCPEWSZMKHMB-KNQAVFIVSA-N	431.609	1.382	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cncn1-c1ccncc1)CCO2	1779296376	ONIDBYOGCZOPLP-OAQYLSRUSA-N	443.580	1.562	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@]2(C1)CN(C(=O)C[C@@H]1CNc3ccccc3O1)CCO2	1779297039	PEMVOIYCSLBDRA-VGSWGCGISA-N	447.608	1.931	50	20	IDGD	
CCNC(=O)N[C@@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(C)(C)CCl)C2	1779315774	SDDZIPDXIOIGFE-BXTJHSDWSA-N	430.977	1.473	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(C)cc3-n3nccn3)C2)C1	1780245559	RILSFOSBEJLCAY-UTKZUKDTSA-N	447.923	1.273	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)cc1OC	1780655739	LCBLVWIQSIDFFN-CRAIPNDOSA-N	445.285	1.838	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)c1ccco1)C2)[C@H](F)Br	1780770731	XZIQISBMHXLHTG-VWPFQQQWSA-N	433.274	1.517	50	20	IDGD	
O=C([C@H](F)Cl)N1CCO[C@]2(CCN(C(=O)[C@H](O)c3cccc(Br)c3)C2)C1	1780972820	XJVIWPUQLVHZOZ-KEYYUXOJSA-N	449.704	1.847	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2)c1cc(F)cc([N+](=O)[O-])c1	1780994305	UKGRNTQJXJNFAI-FRQCXROJSA-N	443.859	1.461	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)N(C)C(C)=O)C2	1781899923	DGEPLDULCCYHRC-NVQRDWNXSA-N	446.386	1.541	50	20	IDGD	
COc1cc(C)c(C(=O)N2CC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c(C)c1	1781925108	IHHBHEHYOXXUHB-QHCPKHFHSA-N	446.548	1.129	50	20	IDGD	
O=C(c1ccc(-c2ccc(O)nn2)cc1)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Cl)CCO2	1782115826	ODEHMXBFXMWSKV-FXAWDEMLSA-N	434.855	1.827	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(C(C)=O)[nH]n3)CCO2)C1	1783343435	IYTXZRSGTHVFSR-PXAZEXFGSA-N	427.299	1.229	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cnc4ccccn34)CCO2)C1	1783348092	UZVMRXNRWBERFY-IFXJQAMLSA-N	435.322	1.951	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3nnsc3C3CC3)CCO2)C1	1783534951	SOQXCQPMCPMWAO-QLJPJBMISA-N	429.340	1.642	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@H](C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)C1	1783866783	XAKOHGNAKVXQEK-MOROJQBDSA-N	449.317	1.486	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)/C=C/c3ccc([N+](=O)[O-])o3)CCO2)C1	1783870678	FLRMBEIEBKPBOU-FPASBZTISA-N	427.841	1.285	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)C1(c3ccccc3)CCC1)CCO2	1783937761	OIAQPYGRSCBABZ-HSZRJFAPSA-N	442.560	1.311	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(F)c(F)c(Cl)c3)C[C@@H]21)[C@@H](O)CCl	1784096484	XQTAEEWHAFUQMM-YIVQXAGMSA-N	437.270	1.811	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(CO)c(F)c3)C2)C1	1785263107	LSXBMYIHYZKVQH-BFUOFWGJSA-N	443.313	1.793	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4n[nH]cc4c3)C[C@@H]21	1786406222	YYRRPLFOHUPECR-QRTARXTBSA-N	435.322	1.941	50	20	IDGD	
CC(C)(C)OC(=O)N1CC=C(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]3C2)C1	1787443619	OXJKMFSTJGHJLC-VGWMRTNUSA-N	445.919	1.678	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)c3ccncc3O)CCC2)cc1)c1cccc(B(O)O)c1	1788147980	SJFCWLFVOXDITD-UHFFFAOYSA-N	431.257	1.529	50	20	IDGD	
Cc1nnc(CCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]3C2)s1	1788764928	CUYSVIKRCKPJIX-JYJNAYRXSA-N	440.642	1.610	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CNc3ccc(F)cc3)C[C@@H]21)[C@@H](F)Br	1789922087	BZYTVSJILQRZLR-JIRONKKISA-N	446.292	1.908	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/c3cccnc3)C[C@@H]21)[C@@H](F)Br	1789922486	NMZBYTGYHUSRGS-FFWQDODQSA-N	426.286	1.765	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(OC)nc3)C[C@@H]21	1790958087	HFPVIMGHRLXQNC-JONQDZQNSA-N	440.338	1.857	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(C(C)=O)[nH]n3)C[C@@H]21	1790961945	ZARLLYMJBQCZKK-QCQGSNGOSA-N	441.326	1.379	50	20	IDGD	
CSCC[C@H](O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)CBr)C[C@@H]21	1791303995	RDHQRJJKLNMJKM-YTFOTSKYSA-N	437.400	1.111	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1ccc(C2(NC(=O)[C@@H](O)N3CCOCC3)CCC2)cc1	1791568870	LCXBIVJGZBTGNZ-VQIMIIECSA-N	425.913	1.025	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1csnn1	1793732230	VFJNMWHVRDYFPB-CLLJXQQHSA-N	445.457	1.937	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccnc1C(=O)OC(C)C	1794314522	ALWDVRYWXOPTEG-FSDCSDTHSA-N	437.924	1.867	50	20	IDGD	
COc1cccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCBr)C3)c1	1795241650	JZNAUJZVHZUGRS-CCWDJLKJSA-N	425.323	1.612	50	20	IDGD	
COc1ccc(CCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CCC(=O)NN(C)C)C3)cc1	1795515422	RKESFTZBBORVCQ-REPLKXPHSA-N	430.549	1.639	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](CN)c1ccccc1	1795676007	XDVJOKSQYYJWMA-JZBZHOAESA-N	428.360	1.555	50	20	IDGD	
N#Cc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Cl)c(C(F)(F)F)n1	1796363641	VDIFIKIYQSUNTE-NVVZYBJKSA-N	434.777	1.710	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnc2cc(Cl)ccn12	1796525033	HXWLMZFHTUITDU-MUJYYYPQSA-N	446.939	1.613	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnc2ccccc2n1	1796776104	GIPDESMNSGUNAG-FLTUCWPJSA-N	447.333	1.864	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc2ccccc12	1797429197	XQSSJWLOAPLGJW-MUJYYYPQSA-N	439.516	1.565	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)c1n[nH]c2cc(Cl)ccc12	1797507671	XQUPMIUUHVTWOG-OWLDWWDNSA-N	427.288	1.019	50	20	IDGD	
O=C(CS[C@H]1CCCCO1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2	1797799846	TVBLRNPXZPUDSP-HZZBMVKVSA-N	439.347	1.526	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2)c1cc(Cl)cc2nn[nH]c12	1798620216	XSUFVIMVTIGODX-IJBDUVHLSA-N	432.695	1.618	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(C)cc1-n1nccn1	1798631501	ZSTFNXNKGUTXRU-LORHWOILSA-N	447.923	1.033	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ncn(-c3cccc(F)c3)n1)C2	1799264347	KMFQSOUIRHCQST-DLTLXFJOSA-N	435.887	1.627	50	20	IDGD	
C[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@](C)(Cl)CCl)n1cccc1C=O	1799274666	DIHCOBXSXOBLEZ-WXZWTWHISA-N	430.332	1.688	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Br	1799343534	ZRXGCFJDKAZQKL-NZFPMDFQSA-N	430.112	1.298	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cn3cc(F)ccc3n1)C2	1800759165	IZUBFGFNLOKDFC-LSSIXWDNSA-N	439.285	1.460	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc3n[nH]cc3c2)[C@H]1c1cccnc1)[C@@H](O)CCl	1803138452	AXSADDVUZQYXLV-SNRMKQJTSA-N	427.892	1.877	50	20	IDGD	
Cc1noc(N)c1C(=O)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@@H]1c1cccnc1	1807108300	VTXVSAVKKGEXGJ-YUTCNCBUSA-N	440.273	1.970	50	20	IDGD	
O=C(Cn1cncn1)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@H]1c1cccnc1	1807602739	HNEDZBXEYMCNMU-QEJZJMRPSA-N	425.262	1.070	50	20	IDGD	
CC(=O)N[C@H](C)C(=O)N1CC[C@H](CNC(=O)[C@@H](F)Br)[C@H]1c1cccnc1	1808678903	PFWHOAJBLFCQQC-JUDXGUMMSA-N	429.290	1.303	50	20	IDGD	
CC(C)N[C@@H](C(=O)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1)C(C)C	1809967147	XVPXWHSLOFRULD-OAQYLSRUSA-N	443.397	1.234	50	20	IDGD	
CC(=O)NCCC(=O)N1CC[C@H](CNC(=O)[C@H](C)Br)[C@H]1c1cccnc1	1812868176	TVWPYWYWSMNYJQ-XGWLTEMNSA-N	425.327	1.397	50	20	IDGD	
Cc1ocnc1C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1813074743	WMXAARBFKQTADM-OXQOHEQNSA-N	428.493	1.071	50	20	IDGD	
C[C@H](Nc1nccs1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](O)CCl)n[nH]1	1814871519	RJSNJTLLZUZHAX-WCFLWFBJSA-N	426.930	1.959	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccnnc2)n[nH]1	1816386321	ZQQOHCZQTDZFFW-ROCQKPIASA-N	449.475	1.640	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](F)Br)CC2)c1cc(O)nc(O)n1	1817103276	DWVAOEIFMVDWDS-RRAGMBSWSA-N	446.258	1.261	50	20	IDGD	
N#Cc1cccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)c1	1817472815	ZBQGQYGPPMONQG-HXUWFJFHSA-N	443.272	1.581	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)C2CC3(CCC3)C2)[nH]n1)c1cccc(B(O)O)c1	1817478863	CMZXPFSHDZDJHE-LJQANCHMSA-N	436.321	1.976	50	20	IDGD	
COCCn1nccc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](Cl)COC)CC2	1817594542	GASFLSKNGNFCOO-VXGBXAGGSA-N	441.941	1.466	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@](C)(Cl)CCl)sc2C1	1822868128	SDRZHMHJKYJROW-VHCOLVSPSA-N	433.361	1.982	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1	1823013767	JEKBVKCWIUBFMA-BYULHYEWSA-N	428.711	1.999	50	20	IDGD	
O=C(N[C@H]1CCc2nc(NC(=O)[C@@H]3CCCS3(=O)=O)sc2C1)C(Cl)Cl	1824940572	XYFPKESZZHIDIJ-XVKPBYJWSA-N	426.347	1.436	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CN1CCOC1=O)CC2	1825441015	ISKNUJLFZQGCRO-UWVGGRQHSA-N	445.339	1.681	50	20	IDGD	
Cc1nscc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827050239	JZKYONHPCXNEIJ-HXUWFJFHSA-N	441.362	1.678	50	20	IDGD	
C#CC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](Cl)COC)CCN2C(=O)OCc1ccccc1	1829341110	XADVSUTXZKKWPM-XMSQKQJNSA-N	447.919	1.326	50	20	IDGD	
Cc1c(F)cccc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)Br)C2)C1	1830164045	UNWDDQLSBDVZEW-KUHUBIRLSA-N	443.313	1.988	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4n[nH]cc4c3)C2)C1	1830357869	NJPRFEOOJPWMML-OAQYLSRUSA-N	434.924	1.898	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4[nH]ccc4n3)C2)C1	1830362417	WGJDGNWZBOWVGK-OAQYLSRUSA-N	434.924	1.898	50	20	IDGD	
O=C(Cc1cnc2ccccn12)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1830668248	YJVUFZFUXRVEES-LJQANCHMSA-N	441.315	1.137	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3Cc4ccccc4CN3)C2)C1	1831647682	YBHBPFWUXWHXEK-MIZPHKNDSA-N	449.979	1.565	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CNC(=O)C(F)(F)F)CC1	1831834366	COPHBCOEEWGEOT-KBPBESRZSA-N	441.878	1.538	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3cccc(OC)n3)CCO2)C1	1832769204	LRDDNIWQOLOGON-JXFKEZNVSA-N	425.913	1.107	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnnc(Cl)c3)CCO2)C1	1833204820	HPDBYQIDAVXRHS-KDOFPFPSSA-N	431.320	1.608	50	20	IDGD	
CC(C)(CCl)C(=O)NC1CCN(C2CCN(C(=O)C[C@](C)(O)CC(=O)O)CC2)CC1	1833216075	SOEVGWOVMDFKLD-NRFANRHFSA-N	445.988	1.439	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)C(=O)C3CC3)CC2)CC1	1833280342	SUNHQJZXOLLXBY-INIZCTEOSA-N	428.371	1.711	50	20	IDGD	
C[C@@H](Cc1ccco1)C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)CCl)CC2)CC1	1833313150	XTSCALFSGZDTJI-HNAYVOBHSA-N	425.957	1.630	50	20	IDGD	
COc1nccnc1C(=O)N1CCC(N2CCC(NC(=O)CO[Si](C)(C)C)CC2)CC1	1835835296	RPJKLELPLRAKAM-UHFFFAOYSA-N	449.628	1.522	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC1CCN(C2CCN(C(=O)c3c[nH]c(=O)cn3)CC2)CC1	1836399717	JTZZPHTZUHPQQT-LJQANCHMSA-N	444.363	1.191	50	20	IDGD	
O=C(c1ccc2nonc2c1)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836717769	JFSBQXZCXCZROV-SFHVURJKSA-N	436.896	1.435	50	20	IDGD	
Cc1cnn(CC(=O)N2CCC(OC3CCN(C(=O)CCBr)CC3)CC2)c1	1837653501	IAAXEVFCJQRMLZ-UHFFFAOYSA-N	441.370	1.975	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)CCN3CCOC3=O)CC2)CC1	1838272515	CVASUNNLCPQFLE-QGZVFWFLSA-N	445.944	1.081	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3noc4c3CCCC4)C2)C1	1839143577	AUCWQFRXECAFKC-YWZLYKJASA-N	425.913	1.641	50	20	IDGD	
COC1(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)CCC1	1839203532	NVXYEGYOZWRXAM-RHSMWYFYSA-N	437.306	1.093	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccsc3)C2)C1	1839964017	CRULYWXZMATNND-CRAIPNDOSA-N	445.379	1.921	50	20	IDGD	
O=C(c1cc(F)cnc1Cl)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840188974	OORICZXEELQNLQ-MRXNPFEDSA-N	440.686	1.748	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)/C(C)=C/c3cccnc3)CCO2)C1	1840414487	NTUCJDUDOLCAQC-IGFQPDJCSA-N	437.924	1.195	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCCn3cccc3)CCO2)C1	1840461822	UXQRPKKWVDINOT-VQTJNVASSA-N	446.375	1.961	50	20	IDGD	
CC(C)(C)OC(=O)NCCOCC(=O)N1CC2(CCCN2C(=O)C(C)(C)CCl)C1	1841226777	CRWNVUGLCTYWHW-UHFFFAOYSA-N	431.961	1.996	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)c2cc(O)n(C)n2)C1	1842191889	QDTSEHRHRJASOD-UHFFFAOYSA-N	443.416	1.090	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)c2ccc(O)nn2)C1	1842339573	HVEGMNCIUGPWQI-UHFFFAOYSA-N	441.400	1.147	50	20	IDGD	
CC(C)(C)OC(=O)NCC[C@H](O)C(=O)N1CC2(CCCN2C(=O)CCBr)C1	1842638945	PCADMUCCBWVXME-ZDUSSCGKSA-N	448.358	1.251	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(C(=O)N2CCCC23CN(C(=O)CO[Si](C)(C)C)C3)C1	1843842061	SAHCRGZNMQQDAN-UHFFFAOYSA-N	425.602	1.908	50	20	IDGD	
CN(CC(=O)N1CCCC12CN(C(=O)[C@H]1CCCS1)C2)NC(=O)NCc1ccccc1	1845039292	BLMZVLZWUGRYFO-GOSISDBHSA-N	445.589	1.432	50	20	IDGD	
CC[C@@H](NC(C)=O)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O	1847295237	CWFWESUQSHFDGH-SQNIBIBYSA-N	446.460	1.250	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](O)CCl)[C@@H](F)C1	1847556283	GWIUQTOZCBVKIW-YXMSTPNBSA-N	447.935	1.383	50	20	IDGD	
CS(=O)(=O)N1CCC(C(=O)NNC(=O)c2ccccc2OCc2ccc(F)cc2)CC1	14222995	GHVMVFUPQVTASN-UHFFFAOYSA-N	449.504	1.837	50	20	IDGD	
CC[C@@H](C(=O)OCC(=O)NNC(=O)c1ccccc1)n1nnc(-c2ccc(Cl)cc2)n1	16288796	XPBJLGBHGUHBME-INIZCTEOSA-N	442.863	1.949	50	20	IDGD	
COc1ccc(Cl)cc1N1C[C@@H](C(=O)NNC(=O)Cn2cnc3ccccc32)CC1=O	17403761	UZQQZIDGMZJYCT-ZDUSSCGKSA-N	441.875	1.899	50	20	IDGD	
Cc1nn(C)c2ncc(C(=O)NNC(=O)c3ccc(CSc4nncn4C)cc3)cc12	23737247	FNIVVTGUGBZJJF-UHFFFAOYSA-N	436.501	1.772	50	20	IDGD	
CC[C@H](C)NS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cc(Br)c[nH]2)cc1	23914927	GMXDWSNYUZUHRY-JTQLQIEISA-N	443.323	1.929	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	28196834	JJHQBDCLUCOEAF-UHFFFAOYSA-N	431.514	1.961	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@@H](c1ccccc1)n1cccn1	109764147	PFHWCIYMAUSVMK-MRXNPFEDSA-N	426.502	1.535	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1F	115343760	WUKUDMMUWKYVNI-UHFFFAOYSA-N	429.857	1.529	50	20	IDGD	
C=CCNS(=O)(=O)c1ccc(C(=O)NNC(=S)Nc2ccc(OC)c(F)c2)cc1	727500046	RNIPJFWFFKZRMK-UHFFFAOYSA-N	438.506	1.930	50	20	IDGD	
COc1ccc(CCNC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c(OC)c1OC	727845830	BCSZENVPTFSGBW-KRWDZBQOSA-N	431.445	1.425	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2cnn(-c3ccc(F)cc3F)c2C)n1	728722804	VVWUIKIVXCQWFC-UHFFFAOYSA-N	449.439	1.771	50	20	IDGD	
CSCC[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)NNC(=O)Cc1cccnc1	728892711	DPFRZTJUYQOUEH-INIZCTEOSA-N	431.474	1.231	50	20	IDGD	
O=C(CSc1nnc(O)nc1O)NN=Cc1ccc(N2CCCCC2)c([N+](=O)[O-])c1	730557980	CEOCUEUYHVUNHH-UHFFFAOYSA-N	433.450	1.424	50	20	IDGD	
COc1cc(OC)c(CCNC(=O)NNC(=O)CNC(=O)c2cccs2)c(OC)c1	731043607	IFXJHGMTINTTON-UHFFFAOYSA-N	436.490	1.077	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)Sc1nnc(N2CCOCC2)n1Cc1ccccc1	731906314	XWGCBKHARGZYDC-INIZCTEOSA-N	446.577	1.837	50	20	IDGD	
O=C(CCCC[C@@H]1SC[C@H]2NC(=O)N[C@H]21)NNC(=O)c1cnn(-c2ccccc2)c1	733170265	VUBULSFOSLWSFP-SOLBZPMBSA-N	428.518	1.359	50	20	IDGD	
CC(=O)Nc1ccc(S[C@@H](C)C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)cc1	734241191	HCPLXPGKALWWQY-LBPRGKRZSA-N	439.538	1.981	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)N(C)CCCC(=O)NNc2nccnc2Cl)cc1	734261904	RFTAKQABSKQJFB-UHFFFAOYSA-N	425.898	1.877	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NN[C@@H](C(N)=O)c2ccc(C#N)cc2)c1	734506678	BXSFMNWSBYJBMD-GOSISDBHSA-N	429.502	1.050	50	20	IDGD	
O=C(NNC(=O)c1c(Cl)cccc1Cl)N[C@H]1CCN(CCN2CCOCC2)C1	734686962	ZCJRMFQYHHYMMU-ZDUSSCGKSA-N	430.336	1.344	50	20	IDGD	
Cc1ccccc1C1(C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)CC1	735117609	ZFKONYHGYXTXPN-UHFFFAOYSA-N	429.546	1.501	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)N[C@H]2CCN(c3cnn(C)c3)C2=O)c(C)n1-c1ccccc1	735584341	SZBRIXQNYNXBIK-IBGZPJMESA-N	435.488	1.577	50	20	IDGD	
CN(C)c1nccc(NNC(=O)CN(C)S(=O)(=O)c2ccc(Br)cc2)n1	740103136	NARNYQIONUUXAY-UHFFFAOYSA-N	443.327	1.069	50	20	IDGD	
CCc1nc(C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)nn1-c1ccccc1F	741661811	YYYGBBCJDCJXSI-UHFFFAOYSA-N	435.419	1.291	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)Nc2ncn(CC(=O)N(C)C)n2)c(C)n1C[C@@H]1CCCO1	741971889	XDKQDCASEMIKKQ-XUKORKDYSA-N	425.493	1.509	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2CCN(c3cccc(Cl)c3)C2=O)c1	742046583	WDFQETIPLZVJJO-INIZCTEOSA-N	435.889	1.558	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)Cn2nnc(C3(NC(=O)c4ccccc4)CCCC3)n2)c1	742453245	CQIYDWIOIFUUIW-UHFFFAOYSA-N	447.499	1.642	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NN[C@H](C(N)=O)c2ccc(Br)cc2F)c1	743468417	KILBQMQCIHGQTI-AWEZNQCLSA-N	444.282	1.453	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)Cc2ccn(-c3ccc(F)cc3)n2)cc1	743829261	JEKWMNMRMHVCJQ-UHFFFAOYSA-N	431.449	1.810	50	20	IDGD	
CC(C)Cn1cnc2c1c(=O)n(CC(=O)NN=Cc1cc[nH]c1)c(=O)n2Cc1ccccc1	745193986	NAROWRCRIULLNN-UHFFFAOYSA-N	447.499	1.542	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)Oc1ccc(Cl)cc1	745912757	WXTZFBIAJYPTMU-LBPRGKRZSA-N	429.864	1.998	50	20	IDGD	
O=C(Cc1ccc(Cl)cc1)NNC(=O)c1cc(S(=O)(=O)N2CCCC2)ccc1O	745990367	CSCXFPWSDJSSMV-UHFFFAOYSA-N	437.905	1.834	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)c2ccc(CCNS(C)(=O)=O)cc2)o1	746393013	UXFGDOIRWJWAMD-UHFFFAOYSA-N	436.534	1.288	50	20	IDGD	
COc1cc(C)nc(NNC(=O)C2CCN(S(=O)(=O)/C=C\c3ccccc3)CC2)n1	746623153	DQBCLWCAHJIJFJ-RAXLEYEMSA-N	431.518	1.949	50	20	IDGD	
O=C(NCc1cccc(C(=O)N2CCOCC2)c1)NNC(=O)c1cccc2cccnc12	747538113	OMYLYVXWQGQXEV-UHFFFAOYSA-N	433.468	1.851	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(S(=O)(=O)NC2CC2)cc1)c1ccc(Cl)cc1F	747618866	ZPBGALJOIVNWEL-UHFFFAOYSA-N	447.897	1.543	50	20	IDGD	
O=C(CN1C(=O)[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)NNc1nc(-c2ccccn2)nc2c1CCC2	748338757	HOIGDDIYUZTMDN-BIPCEHGGSA-N	430.468	1.278	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2c(F)c(F)cc(F)c2F)ccc1Cl	748516721	JZCJVVQCCPAYOC-UHFFFAOYSA-N	425.747	1.619	50	20	IDGD	
C[C@H](CC(=O)NNC(=O)c1cc2ccccc2o1)/N=C1/NS(=O)(=O)c2ccccc21	749473014	ZXXINXXVLXUINB-GFCCVEGCSA-N	426.454	1.711	50	20	IDGD	
NC(=O)c1cc(CNC(=O)NNC(=O)c2cn(-c3ccccc3)nc2-c2ccccc2)on1	752683835	DQXNTAGNWWTGAK-UHFFFAOYSA-N	445.439	1.770	50	20	IDGD	
CC(C)C[C@H](C(=O)NNc1nc2ccccc2c(=O)n1C)N1C(=O)[C@H]2CC=CC[C@H]2C1=O	752907919	PARXJDXYGGXNEF-RVKKMQEKSA-N	437.500	1.743	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2cc(C(=O)OC)cc([N+](=O)[O-])c2C)n1	753850780	KHJALGKMUVPJPI-UHFFFAOYSA-N	445.436	1.408	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1	755953013	XUGFSTOAUSKNFV-AWEZNQCLSA-N	445.501	1.422	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)Nc1cccc(S(=O)(=O)/N=C2/CCCCCN2C)c1	756164957	IKOTXNLHVVSVKG-UQQQWYQISA-N	447.521	1.778	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)Nc1ccccc1CN1C(=O)CCC1=O	756221053	NLBHUVHOPXTKQK-UHFFFAOYSA-N	434.250	1.893	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)Nc2ccc(-n3ncn(C)c3=O)cc2)cc1	757864487	ZEQHZKPVOXWWPJ-AWEZNQCLSA-N	440.460	1.590	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)CNC(=O)c2ccc(C(C)(C)C)cc2)n1	758035037	SMSPVXPIEJCEKL-UHFFFAOYSA-N	446.529	1.412	50	20	IDGD	
Cc1nc2ccccc2c(=O)n1-c1ccc(C(=O)NNC(=O)C(=O)Nc2ccccn2)cc1	758833784	IRSIPAITNRFXSQ-UHFFFAOYSA-N	442.435	1.489	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)NC[C@@H]1CSCCN1Cc1ccccc1	759199284	MONBAWJXECFAEZ-QGZVFWFLSA-N	430.530	1.719	50	20	IDGD	
Cc1cc(C)c(C=NNC(=O)C[C@H](C(=O)NN=Cc2[nH]c(C)cc2C)N2CCOCC2)[nH]1	760260169	LCSOQIRTZSFYSJ-HXUWFJFHSA-N	441.536	1.268	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)Nc1ccc(CN2C(=O)CCCC2=O)cc1	760960963	ZCCVFTADLXJHJJ-UHFFFAOYSA-N	435.440	1.829	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)c1ccc(CCNS(C)(=O)=O)cc1	761626374	WEUYCCYZGWTZDX-UHFFFAOYSA-N	437.543	1.340	50	20	IDGD	
O=C(NNC(=O)c1ccccc1)C(=O)Nc1c(C(=O)N2CCOCC2)oc2ccccc12	763426180	QLXHCXVSUBOOFA-UHFFFAOYSA-N	436.424	1.305	50	20	IDGD	
O=C(NNC(=O)c1ccc2ccccc2n1)C(=O)Nc1cccc(Cl)c1-n1cncn1	763467649	VIGQISKGDQCCIF-UHFFFAOYSA-N	435.831	1.869	50	20	IDGD	
CCN(Cc1ccccc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccccc2)[nH]n1)C(C)=O	763605344	RIWFHIZIJGLHQX-UHFFFAOYSA-N	448.483	1.845	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)nc(C1CC1)n2C	763624129	JLWAHSKPHCFAES-UHFFFAOYSA-N	431.456	1.807	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccccc2CC(F)(F)F)cc1	763660935	IUFCIWJWAFBKMW-UHFFFAOYSA-N	425.363	1.965	50	20	IDGD	
Cc1nc(C)n(-c2ccccc2NC(=O)C(=O)NNC(=O)COc2ccc(C)c(C)c2)n1	763668169	ZOQITHICLCWPSC-UHFFFAOYSA-N	436.472	1.666	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(N2CCOCC2)c(C)c1	763716786	MNSMZFRCNLQAOQ-UHFFFAOYSA-N	440.500	1.559	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(N3CCCC3=O)c(Cl)c2)c1	763758785	ULTVWQWSASCUHX-UHFFFAOYSA-N	443.891	1.933	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)ccc1OC(C)C	763790510	JPGMOBIZYNFMNU-UHFFFAOYSA-N	437.456	1.429	50	20	IDGD	
COC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)cc1F	763812087	CCRXXSQSFRXMOY-UHFFFAOYSA-N	429.364	1.041	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)c1ccc(-n2ccc(C(F)(F)F)n2)cc1	763819209	UVVLFDLNWMJMTC-UHFFFAOYSA-N	432.362	1.477	50	20	IDGD	
Cc1nn(C(C)(C)C)c2nc(C3CC3)cc(C(=O)NNC(=O)CNC(=O)c3cccnc3)c12	763821677	WBSFHTRGTJHNSD-UHFFFAOYSA-N	449.515	1.958	50	20	IDGD	
Cc1cc(C)cc(C(=O)N2CCC[C@H](C(=O)NNC(=O)CNC(=O)c3cccnc3)C2)c1	763825081	VBUPWXCIZNLYKE-SFHVURJKSA-N	437.500	1.128	50	20	IDGD	
COC(=O)c1cccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)c1C	763838551	AISLPJRSIQALEN-OAHLLOKOSA-N	427.457	1.952	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cc(F)c(OC)cc2F)cc1	763860518	IGQASVJBNPTKCV-NSHDSACASA-N	437.399	1.926	50	20	IDGD	
CC(=O)Nc1cc(NC(=O)C(=O)NNC(=O)Cc2c[nH]c3ccccc23)c(F)cc1F	763861775	UXROZHHREXZFGR-UHFFFAOYSA-N	429.383	1.733	50	20	IDGD	
CCNC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)c1	763865841	RMEFUCRUJRQZMH-GFCCVEGCSA-N	431.424	1.521	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)c2cccn2C)sc2c1CC[C@H](C)C2	763998462	JNXVFNUQNIXTJJ-NSHDSACASA-N	432.502	1.788	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2OC)c(F)cc1F	764012041	LSKZHCVIABFTRF-UHFFFAOYSA-N	441.774	1.813	50	20	IDGD	
CCOC(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2OC)c1	764012617	TXRAQMBMQMJSAM-UHFFFAOYSA-N	433.848	1.854	50	20	IDGD	
CC[C@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(S(=O)(=O)N2C[C@@H](C)C[C@@H](C)C2)cc1	764084774	WGHFSCQSFUNIDP-ZNMIVQPWSA-N	438.550	1.485	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc(-n4cccn4)nc3)n[nH]2)cc1	764110445	JSTOJVKIWVYOED-UHFFFAOYSA-N	430.428	1.366	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cc(C(=O)N(C)C)ccc3C)n[nH]2)cc1	764111758	SQKCLQZYIRRCNE-UHFFFAOYSA-N	448.483	1.795	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2O1)C(=O)Nc1ccc([S@](=O)C(F)(F)F)cc1	764168254	PAANSEZGRXRILU-KJEZJMDVSA-N	441.387	1.404	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2ccc(C#N)cc2)c1	764178098	WQESUGIDZGBENA-UHFFFAOYSA-N	443.485	1.035	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2cc(F)ccc2Br)c(C)n1	764270441	NDHGJUPBUXOHII-UHFFFAOYSA-N	425.214	1.700	50	20	IDGD	
Cn1cnc2cc(NC(=O)C(=O)NNC(=O)c3cc(F)ccc3Br)ccc21	764271137	WIIQYXHAUMQQLA-UHFFFAOYSA-N	434.225	1.875	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)C(=O)Nc1c(F)cccc1-n1cccn1	764351540	SQRMOCBHIHQBDI-UHFFFAOYSA-N	433.403	1.597	50	20	IDGD	
C[C@H](NS(=O)(=O)c1cccc(C#N)c1)C(=O)NNC(=O)CC12CC3CC(CC(C3)C1)C2	764533938	PRAUVFCOHVWDSD-DFLMZXFUSA-N	444.557	1.979	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CNC(=O)Cc2ccc(O)cc2)cc1Br	765512625	HSNXSGFIINXXMI-UHFFFAOYSA-N	436.262	1.283	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)Cn2c(C)nc3ccccc3c2=O)n[nH]1	765594982	APVQCHCYNVLTKW-UHFFFAOYSA-N	432.440	1.565	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)N[C@@H]1CCO[C@@H](C2CC2)C1	765905954	RATFQEWVXIRGDP-SJLPKXTDSA-N	436.534	1.373	50	20	IDGD	
O=C(CCCC(=O)c1ccc2c(c1)OCCO2)NNC(=O)[C@@H]1COc2ccccc2O1	766631529	NDXQELXQLYFCFV-FQEVSTJZSA-N	426.425	1.798	50	20	IDGD	
CCOC(=O)N[C@@H](C(=O)NNC(=O)CN1CCN(Cc2ccc(C)cc2)CC1)C(C)C	766641860	FTZBTAXADDPKAK-HXUWFJFHSA-N	433.553	1.031	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cc(O)nc4ccccc34)CC2)cc1	766648701	KGIZPIBWNPFALS-UHFFFAOYSA-N	433.512	1.828	50	20	IDGD	
O=C(CNc1ccccc1Cl)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	766648920	YOPILXOKSVWUCC-UHFFFAOYSA-N	429.908	1.357	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)CN(C)C(=O)c3cccs3)CC2)cc1	766650957	YCJRDVYQIOFRHI-UHFFFAOYSA-N	443.573	1.094	50	20	IDGD	
C=CCNS(=O)(=O)c1ccc(C(=O)OCC(=O)NNC(=O)Cc2ccccc2C)cc1	767269797	GEHHTGUGZWMMCI-UHFFFAOYSA-N	445.497	1.006	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)CN3CCN(c4ccccn4)CC3)n[nH]2)cc1	768267849	FLNXDOXFTUGUQR-UHFFFAOYSA-N	433.516	1.617	50	20	IDGD	
CC(C)n1ncc2cc(S(=O)(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)ccc21	768497468	PKRCPMFBKJTABY-UHFFFAOYSA-N	426.462	1.216	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)c1cc(S(=O)(=O)Nc2ccc(Cl)cc2)ccc1O	769783263	WJANIAGFQBJPNP-UHFFFAOYSA-N	449.876	1.953	50	20	IDGD	
CCCCS(=O)(=O)N1CCC[C@@H]1C(=O)NNc1nc(O)c2cnn(C(C)(C)C)c2n1	770965814	NUXBXGZWZZMJLS-CYBMUJFWSA-N	439.542	1.324	50	20	IDGD	
COC(=O)c1c(CC(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)[nH]c(C(C)=O)c1C	770969816	WUNIEEUCDLYUNE-UHFFFAOYSA-N	443.464	1.598	50	20	IDGD	
COc1ccc(C)cc1[C@]1(C)NC(=O)N(CC(=O)NNc2ccc([N+](=O)[O-])cc2)C1=O	771649764	OBCYDHKLZYUYIK-FQEVSTJZSA-N	427.417	1.822	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)Cc1ccccc1I	772207375	NEXWWTSCBHRXAD-NSHDSACASA-N	432.258	1.959	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C[C@](O)(c1nccn1C)C(F)(F)F	772994961	MKVTZPZRPVKPDI-QFYYESIMSA-N	434.802	1.828	50	20	IDGD	
CN(C1CC1)S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2)cc1	773657161	YXMHKZQXXCDHKR-UHFFFAOYSA-N	433.446	1.460	50	20	IDGD	
CS(=O)(=O)CCn1cccc(NC(=O)C(=O)NNc2c(Cl)cccc2Cl)c1=O	773693884	CKNLKWXLGISNFS-UHFFFAOYSA-N	447.300	1.282	50	20	IDGD	
CC(=O)N1CCN(c2cccc(NC(=O)C(=O)NNc3nccnc3C(C)C)c2)CC1	773997726	MAQUFVOTOGFNJO-UHFFFAOYSA-N	425.493	1.350	50	20	IDGD	
CC(C)c1cc(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)cc(O)n1	775544926	LXNAFYSIYILQNZ-UHFFFAOYSA-N	433.534	1.604	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)[C@@H]2CS[C@H](Cc3ccccc3F)C(=O)N2)c1	776714484	GWQGMWKSYSCEKH-DLBZAZTESA-N	437.518	1.515	50	20	IDGD	
COC(=O)c1cc(Br)c(S(=O)(=O)NNC(=O)Cc2cccnc2)s1	777623476	HPGOWOAFFCMJSF-UHFFFAOYSA-N	434.293	1.244	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCC(O)(c3c(F)cccc3F)CC2)cc1OC	778239821	QVYAWPMIFVYSBQ-UHFFFAOYSA-N	449.454	1.727	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)c1cc(Cl)ccc1Cl)C(=O)NN(C)C(N)=O	778415123	QPFYPBMPEQFMES-SNVBAGLBSA-N	429.351	1.435	50	20	IDGD	
CS(=O)(=O)N1CC(CNC(=O)/C(C#N)=C/c2cn(CCC#N)nc2-c2ccccc2)C1	779332147	OXKYKVIMRSRLQG-VCHYOVAHSA-N	438.513	1.378	50	20	IDGD	
O=C(NNC(=O)[C@H](O)[C@@H](O)c1nc2ccccc2s1)c1ccc(Br)s1	779488144	CUGWDESRWKDWKX-VXGBXAGGSA-N	442.316	1.976	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2ccc3c(c2)CCN3C(=O)c2cccnc2)nc1	782141058	JLYJZQTZLPYHMR-UHFFFAOYSA-N	432.440	1.770	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)cc1OC	782893418	HXNLALGMESHELH-UHFFFAOYSA-N	425.445	1.309	50	20	IDGD	
O=C1C[C@@H](Cc2ccc(NC(=O)C(=O)NNc3ccc(Cl)cc3[N+](=O)[O-])cc2)C(=O)N1	783291255	KORJGEUKMFVHIZ-LLVKDONJSA-N	445.819	1.535	50	20	IDGD	
Cc1nc2ccnn2c(C)c1C(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	783703800	FEGLJUCUHDMHIQ-UHFFFAOYSA-N	431.497	1.595	50	20	IDGD	
COC(=O)Nc1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)cc1	784835256	KLJYQGLHOPVLHO-UHFFFAOYSA-N	442.400	1.943	50	20	IDGD	
O=C(NNc1c(F)cc(C(=O)NC2CC2)cc1F)C(=O)Nc1c[nH]nc1-c1ccccn1	785099209	APQWNZBPYMFFCV-UHFFFAOYSA-N	441.398	1.724	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)C1(Cc2ccccc2F)CC1	785612338	GZHHAMOULBGAMB-UHFFFAOYSA-N	438.503	1.754	50	20	IDGD	
CN(NC(=O)Nc1cccc(-n2ccnn2)c1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	785859847	COZQVHAXCBMFOV-UHFFFAOYSA-N	444.496	1.908	50	20	IDGD	
Cc1cc(S(=O)(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)sc1Cl	788742454	BFJKMTWKFASCDG-UHFFFAOYSA-N	444.343	1.634	50	20	IDGD	
O=C(NNC(=O)[C@H]1OCC[C@H]1c1ccccc1)C(=O)Nc1ccc(N2CCOC2=O)cc1	789813372	RNOZVHAKPIUAKF-ROUUACIJSA-N	438.440	1.302	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2cc([C@H]3CCCOC3)nn2C)cc1	790952571	RRSMGTLVMAIOPS-HNNXBMFYSA-N	429.477	1.041	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1cc([C@H]2CCCOC2)nn1C	790952818	WAVGRRSVDUJSJA-OLZOCXBDSA-N	433.440	1.007	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2cccc(F)c2[N+](=O)[O-])c(OCC(=O)N(C)C)c1	790997666	COOGWOBMGGBSRK-UHFFFAOYSA-N	433.396	1.591	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)c1nnn(Cc2ccc(F)cc2F)c1C	792215972	NQBMXTSALGOJCQ-UHFFFAOYSA-N	430.415	1.795	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)N1CCN(C(=O)OC(C)(C)C)C[C@@H]1c1nccn1C	792903972	FSACZXDWFUFPSK-HZPDHXFCSA-N	436.557	1.596	50	20	IDGD	
CCCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNc2ccc3c(=O)[nH]ccc3c2)cc1	793069211	JBZZSILKTBPWLO-UHFFFAOYSA-N	443.485	1.762	50	20	IDGD	
CC(C)(C(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)c1ccc2c(c1)OCO2	796537852	UHKADUQWFUJRHK-UHFFFAOYSA-N	429.385	1.606	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cc(N3CCOCC3)ccc2C)cc1	797534928	HAELKMVRIRLFSJ-UHFFFAOYSA-N	426.473	1.305	50	20	IDGD	
Cc1ccc([C@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)CNC(=O)c2ccco2)cc1	797717817	GHGXDNOFQZJFKO-KRWDZBQOSA-N	430.461	1.731	50	20	IDGD	
O=C(NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1)C(=O)c1ccc(O)cc1	798154243	BYPFPWHPRITXDH-UHFFFAOYSA-N	445.478	1.898	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2ccc(N3CCC3=O)cc2)n[nH]1	799258490	BCJPWRRCTPYACR-UHFFFAOYSA-N	448.439	1.222	50	20	IDGD	
CSC[C@@H](C)C(=O)N1CCC(C(=O)OCC(=O)NNC(=O)c2ccc(C)cc2)CC1	799542860	QJYQFSNYQGDMIP-OAHLLOKOSA-N	435.546	1.537	50	20	IDGD	
N#Cc1cc(Cl)nc(NNC(=O)c2ccc(F)c(S(=O)(=O)N3CCOCC3)c2)c1	801181447	PWXSHFJGASQSHJ-UHFFFAOYSA-N	439.856	1.524	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CC[C@](C)(CNC(=O)OC(C)(C)C)C2)n1	801572520	JIUXDAMPJYKURF-LJQANCHMSA-N	425.555	1.378	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@H]2CCCCN2C(=O)c2ccco2)cc1	802066842	BHSYNGUAPBNJQM-OAHLLOKOSA-N	434.474	1.531	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1)NNc1ccc2c(=O)[nH]ccc2c1	803429849	LLGFPWFMPJDYLY-UHFFFAOYSA-N	431.430	1.248	50	20	IDGD	
COc1cc(C(=O)NCC(=O)NNc2ccc3c(=O)[nH]ccc3c2)cc(OC)c1OC	803438287	KWDQJCAFEYDXHN-UHFFFAOYSA-N	426.429	1.427	50	20	IDGD	
O=C(CN1CCCc2ccccc21)NNC(=O)C(=O)Nc1nc(C2CCOCC2)cs1	806974075	SMQDYPVASZZRIC-UHFFFAOYSA-N	443.529	1.576	50	20	IDGD	
Cc1cc(O[C@@H]2CCN(C)C2=O)ccc1NC(=O)C(=O)NNc1nccnc1C1CCC1	807462027	GSXLPISHDGIKJV-QGZVFWFLSA-N	438.488	1.744	50	20	IDGD	
Cc1c(Cl)c(C(F)(F)F)nn1CC(=O)NNC(=O)C1CCN(c2ncccn2)CC1	810347949	FFQDDHREJKAETD-UHFFFAOYSA-N	445.833	1.718	50	20	IDGD	
CCCN(NC(=O)CNS(=O)(=O)c1ccc(NC(C)=O)cc1)C(=O)OC(C)(C)C	811523281	NLWKVOGLSHRUIV-UHFFFAOYSA-N	428.511	1.602	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1nc(CC(F)(F)F)cs1	815565870	BZUQCFYLOWFRHT-MRVPVSSYSA-N	434.371	1.940	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2ccc3c(c2)N(C(=O)Cc2ccccc2)CC3)n1	815574033	BGLGDWDPIWDBII-UHFFFAOYSA-N	446.467	1.699	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)[C@H]2CCCO2)sc2c1CC[C@@H](CC)C2	815779143	SPQGKACHOCZZJY-DGCLKSJQSA-N	437.518	1.705	50	20	IDGD	
Cn1ncc(C(=O)NNC(=O)NCc2ccc(Cl)cc2)c1I	816396609	QFXYJWYNEREGHY-UHFFFAOYSA-N	433.637	1.822	50	20	IDGD	
CC(C)[C@H](NC(=O)C(F)(F)F)C(=O)NNC(=O)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	816509837	DGJKWPLGSQCFFY-NEPJUHHUSA-N	438.447	1.484	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)N(C)[C@@H]2CCN(S(C)(=O)=O)C2)c(C)n1C[C@@H]1CCCO1	816816670	DQJSQOOEHBTDHP-INQFTJRBSA-N	434.562	1.683	50	20	IDGD	
CCCCS(=O)(=O)N1CCC(C(=O)NNc2ccccc2S(=O)(=O)N(C)C)CC1	817054005	PQVYJURCKCJWDF-UHFFFAOYSA-N	446.595	1.222	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)[C@](C)(O)Cn2c(C)cccc2=O)c1	818750975	TXUJVYRNPDVHJC-GOSISDBHSA-N	438.278	1.600	50	20	IDGD	
CC(C)[C@H]1CC[C@@H](C)C[C@H]1OCC(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	839163470	VEAIKKZBWSHIIN-XNFNUYLZSA-N	448.516	1.994	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(C=NOC)cc2)c1	912643080	QQNRQJQETPVKFL-UHFFFAOYSA-N	432.502	1.772	50	20	IDGD	
COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)cc1	915141156	HKYPKZJFCVTACX-LBPRGKRZSA-N	449.441	1.591	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)NC[C@@H]3CCCO3)c2)cc1	915879552	UUYWMQCNXAKWEU-KRWDZBQOSA-N	448.501	1.619	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NCCN2CCC(C)CC2)c2ccccc2c1=O	916451768	PWSKZHQCWJRWIH-UHFFFAOYSA-N	428.537	1.873	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NCCN1CCN(c2ccc(F)cc2)CC1	916513977	YLAYWDIZHIFZCJ-INIZCTEOSA-N	447.486	1.885	50	20	IDGD	
Cn1c(N)c(C(=O)/C(C#N)=C\c2cccc(OCc3cccc(C#N)c3)c2)c(=O)n(C)c1=O	917623380	MJGFZDGQLPVTFE-ZDLGFXPLSA-N	441.447	1.907	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1O)c1ccc(S(=O)(=O)N2CCOCC2)cc1	918358282	ODSAAKXFPVOUQO-UHFFFAOYSA-N	439.877	1.141	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)N[C@@H](C)CN2CCC[C@H](C)C2)nc1	919914341	GRGDKYBZDZCVMF-HOTGVXAUSA-N	426.587	1.859	50	20	IDGD	
C=CC(=O)NCc1ccc(C(=O)NNC(=O)c2nn(CCC)c(=O)c3ccccc23)cc1	919972604	REIIUEQSXQNONM-UHFFFAOYSA-N	433.468	1.684	50	20	IDGD	
C[C@H](Sc1ccccc1C(=O)NNC(=O)C1CCN(c2ncccn2)CC1)C(N)=O	1116938635	RNRONWYBZHZQMT-ZDUSSCGKSA-N	428.518	1.120	50	20	IDGD	
O=C(NNC(=O)c1ccc(OCC2CC2)nc1)c1ccc(S(=O)(=O)N2CCCC2)cc1	1251543219	GLZSOYIMUOSFPR-UHFFFAOYSA-N	444.513	1.730	50	20	IDGD	
NC(=O)[C@@H]1CC(C(=O)NNC(=O)c2ccc(Br)cc2)=NN1c1ccc(F)cc1	1317775426	CSAZXJCZXZRDFN-HNNXBMFYSA-N	448.252	1.469	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCC(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)cc1	1317863114	SIKCBBXPZVAKDW-CYBMUJFWSA-N	439.465	1.118	50	20	IDGD	
COC(=O)c1cc(C(=O)OCC(=O)NNC(=O)c2cccc(C)c2)n(-c2ccccc2)n1	1322190994	SIUZQZIWSZZBAM-UHFFFAOYSA-N	436.424	1.585	50	20	IDGD	
Cc1ccc(C(=O)NCCC(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)c(O)c1	1337767065	QXRPDRZNZXANGR-UHFFFAOYSA-N	448.520	1.615	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4c(cnn4C)c3)C2)C1	1778025395	ZGBXZDPRDJORDT-ORAYPTAESA-N	435.322	1.800	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)C3=NO[C@@H](c4ccccc4)C3)C2)C1	1778173314	CMPRZOKHSHMKDZ-YRISNDGFSA-N	435.908	1.588	50	20	IDGD	
O=C(CS[C@H]1CCCCO1)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2	1779403824	MEFIMLBFGXWZGW-JHDROBOHSA-N	434.986	1.360	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)Cc3ccc4ncnn4c3)CCO2)C1	1781232859	ZATICAHHZXUMGG-RTBURBONSA-N	440.331	1.338	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C1CCN(C(C)C)CC1)C2	1782171982	IQVQKWQQZNTAME-WOIUINJBSA-N	444.016	1.875	50	20	IDGD	
Cc1ccn2c(C(=O)N3CC[C@@]4(C3)CN(C(=O)[C@H](F)Br)CCO4)cnc2c1	1782487462	FONJJHQNBOJLSB-MAUKXSAKSA-N	439.285	1.777	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](O)Cc3ccccc3)C2)C1	1783335821	CTPFGXYTPKCKMR-MDYRTPRTSA-N	439.350	1.451	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](C)CN(CC)CC)CCO2	1783355248	MVHQSIDJACBRDN-JTDSTZFVSA-N	432.403	1.968	50	20	IDGD	
CCOc1ncccc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)Br)C[C@@H]21	1783390677	KYQPJMQZFHLDGP-SDADXPQNSA-N	440.338	1.857	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](C)Br)C3)C2)cc1OC	1783537311	NKWNKBANFYUZIZ-ORAYPTAESA-N	441.322	1.931	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cc(O)nc4ccccc34)CCO2)C1	1783875159	OIISYECQWLQRMK-HRAATJIYSA-N	433.892	1.638	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3c(F)cccc3Cl)C[C@@H]21)[C@@H](O)CCl	1784084525	WOCIJYMDULTXMG-SCTFDZSOSA-N	433.307	1.601	50	20	IDGD	
Cc1cc(C)cc(CCC(=O)N2CC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c1	1784221684	FBLRADSRWAUKEC-XMMPIXPASA-N	444.576	1.439	50	20	IDGD	
C[C@H](Cc1ccccn1)C(=O)N1CC[C@@]2(CN(C(=O)[C@H](F)Br)CCO2)C1	1784287623	XNLUJFLBVLNAEC-XUWXXGDYSA-N	428.302	1.781	50	20	IDGD	
N#Cc1ccccc1OCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1785379823	VFAGXZWWQZCIED-FUHWJXTLSA-N	440.269	1.457	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(F)nc3)[C@H]2C1	1788838140	JLYRDRXMTPOQLN-MXAVVETBSA-N	428.302	1.845	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4cn[nH]c4cn3)C[C@@H]21	1789867699	DABCWQIFGULQCM-HMSCVONGSA-N	440.331	1.788	50	20	IDGD	
CCCCC[C@@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21	1790893331	IMBOTPDDQONINO-LPWQTFTOSA-N	445.564	1.495	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3c(O)cc(O)cc3O)C[C@@H]21	1791061057	PNQHITVDJOPCKY-YOLKCXPHSA-N	443.294	1.180	50	20	IDGD	
CC#C[C@H](CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)c1ccc(O)cc1	1791335063	QHYQZYLVZGGAFI-OHNKGQGDSA-N	448.947	1.469	50	20	IDGD	
Cc1nccn1[C@@H](C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)CBr	1792873279	RLJFZXFPMNBSJP-XHXGSEDSSA-N	427.343	1.373	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2	1792873985	IGIVCPJDMBINED-QUARPLMYSA-N	430.112	1.298	50	20	IDGD	
Cn1c(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)cc2ccccc21	1792923469	MDTMSFCGFCRSDH-WKCHPHFGSA-N	445.328	1.353	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)c1ccoc1C(F)(F)F	1796190926	CLEHHNRYMGAVIW-QDMKHBRRSA-N	436.195	1.544	50	20	IDGD	
CCOc1c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](O)CCl)C3)cnc2c1cnn2C	1796534184	GBIOCZMUJUWPOZ-ZWUHOBOKSA-N	435.912	1.219	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc[nH]1	1798004304	RJCZDCZLBHSUPE-HBCWATKFSA-N	442.428	1.365	50	20	IDGD	
CN(C)c1cncc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@](C)(Cl)CCl)c1	1799277039	NUCPARWKYWVSRY-MVWRLGRASA-N	429.348	1.587	50	20	IDGD	
C[C@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Br)C2)c1ccc(O)cc1	1799301637	VYVUOKSFJOYWQY-FJSLXNCJSA-N	425.323	1.869	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(-n2c(O)nnc2O)cc1	1799313445	LBUNSPWHNFKORE-SLBVQIDZSA-N	449.895	1.184	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COCc1ccc(C)c(C)c1)C2	1800975418	NPUCRZIRBNELOS-RCLSDMTESA-N	438.952	1.663	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnn(Cc3ccccc3)c1)C2	1800976671	BLMBHKFYUFFSQM-IYWMVGAKSA-N	446.935	1.388	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cc(F)ccc1[N+](=O)[O-])C2	1800982688	JDABGCXFAMTQJF-HRJSJKBJSA-N	443.859	1.120	50	20	IDGD	
Cc1cc(F)cc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Br)C3)c1	1801082856	GFBPKWCHSSZDPO-RMHZUWNSSA-N	431.277	1.957	50	20	IDGD	
N#Cc1ccccc1OCC(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]1c1cccnc1	1803147285	FGWGQIYCEYYXRS-LVCYWYKZSA-N	442.903	1.638	50	20	IDGD	
COc1cccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)c1C	1803481887	XCGQBLHPACMMBT-MUJYYYPQSA-N	437.500	1.568	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC2(CCCN(C(=O)CNC(=O)c3cccs3)C2)CC1	1807098884	MQVJTOMOPAGBPB-HNNXBMFYSA-N	441.981	1.963	50	20	IDGD	
Cc1cc(C(=O)N2CCCC3(CCN(C(=O)CCC(=O)NN(C)C)CC3)C2)cnc1C	1807370881	UOWFSWJQYNSOKV-UHFFFAOYSA-N	429.565	1.916	50	20	IDGD	
CC(C)C1(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)CCC1	1807373726	FFCMUKIZHFMOJG-RBBKRZOGSA-N	449.360	1.907	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)[C@@H](C)N2CCN(C)CC2)[C@H]1c1cccnc1	1808273587	DKFBCSYVUCFNNY-LMCOJAPRSA-N	436.000	1.741	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)[C@@H]3Cc4ccccc4O3)CC2)C1	1809972633	VVRJUJXTTWVVIB-QFIPXVFZSA-N	448.328	1.215	50	20	IDGD	
CCc1cc(C(=O)N2CCC3(CCCN(C(=O)c4cccc(B(O)O)c4)C3)CC2)cc(C)n1	1809978137	NKCKTLRIKBAQAR-UHFFFAOYSA-N	449.360	1.791	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1ccc(O)cc1	1811933389	ZBSMVICZBCJANC-UGKGYDQZSA-N	445.284	1.100	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)CNC(=O)c2ccco2)[C@H]1c1cccnc1	1813031335	QOENBOKVIAQOLW-BXWFABGCSA-N	448.907	1.364	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnc(Cl)nc2)n[nH]1	1814330404	RHZLNYMJANOLIS-CQSZACIVSA-N	448.915	1.532	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2nc3ccc(F)cn3n2)[nH]n1)[C@H](O)CCl	1814875045	MSNSECWPSZSMBJ-QWHCGFSZSA-N	435.847	1.497	50	20	IDGD	
O=C(C[C@@H]1CCCCO1)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1815603295	NUUSJEPCLQHECC-PKOBYXMFSA-N	440.309	1.355	50	20	IDGD	
NC(=O)c1ncccc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCBr)n[nH]1	1816782037	YMIDHYVSVSILLS-CYBMUJFWSA-N	449.309	1.995	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)C1(C)COC1)CC2	1817275825	DVEARHDKBAXLRA-BTQGWNRHSA-N	444.517	1.226	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)C(C)C)CC2	1817276574	VIFNDWRQZFIFJU-KRKRZFJASA-N	446.533	1.206	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnc(O)nc2O)n[nH]1	1818022089	FTUUUSOHJZWQIB-LDYMZIIASA-N	439.270	1.700	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)[C@H](O)NC(=O)OCC)sc2C1	1819458121	IBOFLJSTFKPTIN-YHAQOWFVSA-N	432.930	1.527	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)Cc2ccc3ncnn3c2)[nH]n1	1822374665	ZFUUAWVXQNZUPH-GDBMZVCRSA-N	445.911	1.941	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnc(O)nc1O)CC2	1822863561	OBUYICLSZBAPBL-VGDKGRGNSA-N	446.316	1.806	50	20	IDGD	
C[C@@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1ccccn1	1822899367	SZFIJQOXUNNHIY-QRWLVFNGSA-N	447.304	1.594	50	20	IDGD	
N#CC1(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)[nH]n2)CCC1	1823379163	ZFHWLSCZYBJOFF-INIZCTEOSA-N	436.476	1.408	50	20	IDGD	
O=C1COc2ccc(C(=O)N3CCC([C@H]4CCCCN4C(=O)[C@H](O)CCl)CC3)cc2N1	1824184868	AGOILMNNGVRZPQ-QZTJIDSGSA-N	449.935	1.851	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)CC1	1824185994	NLZPQRQBRCGYKI-RDGPPVDQSA-N	440.968	1.961	50	20	IDGD	
CCNC(=S)NCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](C)Br)CC2	1824509384	MDOONBDDRBQYOB-RKDXNWHRSA-N	448.412	1.323	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H]3CCNC(=O)C3)sc2C1	1826228455	LVZXTMMIPIDIQS-IVZWLZJFSA-N	429.340	1.365	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC([C@H]2CCCCN2C(=O)CNCP(=O)(O)O)CC1	1826804134	ZFGRTFBMGJECLG-MRXNPFEDSA-N	449.561	1.182	50	20	IDGD	
Cc1ccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)c(C)n1	1827057547	IESNKDHVIIYKGF-HSZRJFAPSA-N	449.360	1.925	50	20	IDGD	
Cc1ncc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)s1	1827964587	OFWJEXDANOUCGE-IBGZPJMESA-N	441.362	1.678	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CC[C@H](C(=O)OC)C1)CCO2	1830706553	ILHJGJALYUBQBY-NWZZKEMCSA-N	444.956	1.440	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3cnn(C)c3)C2)C1	1831646285	KLJZOFPTINHIHD-FXAWDEMLSA-N	426.945	1.217	50	20	IDGD	
O=C(CCc1cccs1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1833158897	KTJBABZCLXMROW-WBVHZDCISA-N	449.342	1.828	50	20	IDGD	
C[C@@](O)(C(=O)NC1CCN(C2CCN(C(=O)C(Cl)Cl)CC2)CC1)C(F)(F)F	1833641346	HLUMPEVQFUSVDX-OAHLLOKOSA-N	434.286	1.675	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccccn3)CCO2)C1	1833989888	VBBYZJXPEPXHMU-KSSFIOAISA-N	426.311	1.325	50	20	IDGD	
CC(C)(C)n1ccc(C(=O)NC2CCN(C3CCN(C(=O)[C@H](O)CCl)CC3)CC2)n1	1833996104	YXWFYJLOCALYGL-GOSISDBHSA-N	439.988	1.423	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)c3ccc(O)c(F)c3)C2)C1	1834823714	DYJTZAQAPHMNDY-SFHVURJKSA-N	445.285	1.386	50	20	IDGD	
Cc1nnc(CC(=O)N2CCC(N3CCC(NC(=O)CO[Si](C)(C)C)CC3)CC2)o1	1835837571	NPYHFYQUNNNJRG-UHFFFAOYSA-N	437.617	1.344	50	20	IDGD	
COc1nc(C)ccc1C(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836718671	YXCXTPBJDOIKHR-GOSISDBHSA-N	439.940	1.611	50	20	IDGD	
CCc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)no1	1838129340	PYIKDYJJRCSZGS-YVEFUNNKSA-N	430.299	1.090	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(C)n(CC)n3)CCO2)C1	1838147216	WRDBUYXJRCTORH-JXFKEZNVSA-N	426.945	1.689	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccnc4c3OCO4)CCO2)C1	1838474684	OZGJITBAFOCHPR-FOIQADDNSA-N	439.896	1.288	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(C#N)cc3)CCO2)C1	1838953208	RQULWHCYKYWKBO-IFXJQAMLSA-N	436.306	1.412	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4n(n3)CCC4)C2)C1	1839152495	AZBBWWRXXXYCHW-OALUTQOASA-N	445.347	1.136	50	20	IDGD	
CC(C)c1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)on1	1839202071	UGXNGJJYDGZDJS-RHSMWYFYSA-N	448.289	1.559	50	20	IDGD	
Cc1ccccc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839202131	VPDCIOOGTQHRJI-MAUKXSAKSA-N	429.286	1.756	50	20	IDGD	
CC1(C)CCC(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)CC1	1839229899	WJAVHCCYRNFSFY-DYESRHJHSA-N	430.973	1.649	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cc3ccoc3cn1)CCO2	1839485315	KOLAQIKRTWVWKX-NRFANRHFSA-N	447.564	1.749	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)C3CC(F)(F)C3)C2)C1	1839961631	CXLHYZFXRZSVGJ-BBRMVZONSA-N	439.297	1.662	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3cccs3)C2)C1	1840151216	XUFMSGIWZYWAST-LPHOPBHVSA-N	430.954	1.391	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](CC(=O)N2CC3(CCCN3C(=O)[C@@H](O)CCl)C2)C1	1841354540	GLWNQFOQEASXBC-CVEARBPZSA-N	443.972	1.827	50	20	IDGD	
C=C[C@@H]1C[C@]1(NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1	1841354635	LYLZPJIOCLGUGK-LAPQFRIASA-N	427.929	1.259	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)Cc1ccc(Cl)cc1)C2	1844264013	UKBRBMWGJNSKSD-UHFFFAOYSA-N	427.892	1.398	50	20	IDGD	
Cn1ccc2cccc(C(=O)N3CC4(CCCN4C(=O)c4cnccc4C(=O)NN)C3)c21	1844264335	HJTIQNZCHIPZAR-UHFFFAOYSA-N	432.484	1.308	50	20	IDGD	
COc1ccc(C(=O)N2CCCC23CN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C3)c(O)c1	1844879563	XQRLWNXYXCCXLS-ZVHZXABRSA-N	439.472	1.352	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2ccc(C(=O)NNC(=O)C(=O)NC3CC3)cc2)cc1C	9890005	WQINLKJMQVZUOZ-UHFFFAOYSA-N	430.486	1.144	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)[C@H]2CC(=O)Nc3cc(F)ccc32)c2ccccc2c1=O	14347671	PDUGJNGBBUABBE-INIZCTEOSA-N	437.431	1.833	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1C	105722539	BDYVJMCBHXNCDE-UHFFFAOYSA-N	433.486	1.156	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2ccn(-c3ccccc3F)n2)cc1	106125346	NKRRRTDPQTYTTE-UHFFFAOYSA-N	445.476	1.402	50	20	IDGD	
COc1cc(NC(=O)[C@@H]2C[C@@H]2C)c(C(=O)NNC(=O)CNC(=O)c2ccco2)cc1OC	725740234	CWMWZVJEXIVBDJ-NWDGAFQWSA-N	444.444	1.082	50	20	IDGD	
COC(=O)c1c(CC(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)[nH]c(C(C)=O)c1C	725905825	IDGZGLUDPMEJCL-UHFFFAOYSA-N	447.444	1.342	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@H](C)NC(=O)c2n[nH]c3ccccc23)cc(OC)c1OC	726373269	WNPAZAXOFCDGNJ-NSHDSACASA-N	441.444	1.168	50	20	IDGD	
COc1ccc(OC)c(-n2nnnc2SCC(=O)NNC(=O)c2ccccc2Cl)c1	726432285	HEUJTIXRUCAQAY-UHFFFAOYSA-N	448.892	1.886	50	20	IDGD	
CS(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)CCCc2ccccc2)c(F)c1	727720046	PXXITKSPRYFBSX-UHFFFAOYSA-N	429.495	1.530	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNS(=O)(=O)c1cc2c(cc1Cl)NC(=O)C2	728016045	UVZCNEDJGBXNPD-UHFFFAOYSA-N	439.877	1.622	50	20	IDGD	
COc1ccc(-c2nnc(S)n2CCC(=O)N([C@@H]2CCS(=O)(=O)C2)N(C)C)cc1	728178368	WDLBTUGBJZRNTE-CQSZACIVSA-N	439.563	1.125	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)OCC(=O)NNC(=O)[C@H]3COc4ccccc4O3)n[nH]2)o1	728329666	SFUNERUZYFQSHS-QGZVFWFLSA-N	426.385	1.122	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)[C@H]1CCCN1c1ncnc2sccc12	728473754	QKBPXNUWEJCBEV-GFCCVEGCSA-N	430.515	1.299	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNS(=O)(=O)c2cc(F)ccc2Cl)cc1	728502868	SDDBEYNAPUXSOE-UHFFFAOYSA-N	449.913	1.418	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN(C)Cc2nccn2CC(F)(F)F)cc1OC	728570324	JBLDTMSPUQFPSW-UHFFFAOYSA-N	429.399	1.356	50	20	IDGD	
O=C(NC[C@H]1CN2CCC[C@H]2CO1)NNC(=O)c1ccc(Br)cc1Cl	729500630	VAHUQJPPOLYUFJ-RYUDHWBXSA-N	431.718	1.910	50	20	IDGD	
O=C(CCc1ccccc1O)NNS(=O)(=O)c1cc(C(=O)O)sc1Br	729965240	RPLQEABFCRTDIW-UHFFFAOYSA-N	449.304	1.857	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)c1ccccc1S(=O)(=O)N1CCOCC1)c1ccccc1	731996351	KYOOLPMIDPKDNQ-QGZVFWFLSA-N	431.514	1.662	50	20	IDGD	
O=C(COC(=O)c1ccc(N2CCOC2=O)cc1)NNC(=O)c1cccc([N+](=O)[O-])c1	732324281	GRVRUVAJHYHGIV-UHFFFAOYSA-N	428.357	1.169	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)NCCC(=O)N1CCN(c2ncccn2)CC1)c1ccccc1	732458830	LVHQQTFNBUZUJK-GOSISDBHSA-N	439.520	1.040	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CC(=O)N(c2ccc(F)cc2F)C1)c1cnn(-c2ccccc2)c1	733108104	GBEBAPCHRSQAJP-CYBMUJFWSA-N	425.395	1.965	50	20	IDGD	
C[C@H]1CN(CC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)C[C@H](C)N1C(=O)OC(C)(C)C	733199586	HZEAINLYJYYYMD-KBPBESRZSA-N	435.481	1.686	50	20	IDGD	
CCOc1ccc(C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)cc1OC	735117369	SWTHRQPYXVCCHG-UHFFFAOYSA-N	449.533	1.182	50	20	IDGD	
O=C(NN=Cc1cnc2ccc(Cl)cn12)c1cccc(S(=O)(=O)N2CCOCC2)c1	737417007	WAJCVGCGXLZXRO-UHFFFAOYSA-N	447.904	1.773	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2Br)C[C@H](C)O1	740075406	HDJVTILVABFEKA-QWRGUYRKSA-N	429.271	1.618	50	20	IDGD	
CCC(CC)[C@@H](C(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12)N1CCOCC1	742034767	PGUCJRIYJAMCJK-FQEVSTJZSA-N	443.548	1.875	50	20	IDGD	
CC(C)c1nn([C@@H]2CCS(=O)(=O)C2)cc1C(=O)NNC(=O)COc1ccc(C#N)cc1	742471081	NLYSWYIEQSGJLZ-OAHLLOKOSA-N	445.501	1.078	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)c1nn(-c2ccccc2C(F)(F)F)cc1O	742782119	CHQJNJSXLYZIRN-UHFFFAOYSA-N	443.382	1.882	50	20	IDGD	
NC(=O)N[C@@H](CC(=O)NNC(=O)C(=O)NC1CC1)c1cccc(Oc2ccccc2)c1	744463847	YYQZAEZJKYLQPS-KRWDZBQOSA-N	425.445	1.004	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)c2cnn3c(-c4ccccc4)ccnc23)cc1	744733090	WCZSOJWDBBRQBK-UHFFFAOYSA-N	440.419	1.886	50	20	IDGD	
CC/C=C(\C)C(=O)N1CSC[C@H]1C(=O)OCC(=O)NNC(=O)c1ccc(C#N)cc1	744972268	LFZNRAUEZNNBER-DQNFTHGOSA-N	430.486	1.120	50	20	IDGD	
O=C(COC(=O)[C@H]1CCSc2ccccc21)NNC(=O)[C@H]1COc2ccccc2O1	745427546	MHGQLPUDIODANH-WMLDXEAASA-N	428.466	1.797	50	20	IDGD	
O=C(CC[S@@](=O)c1ccc2c(c1)OCCO2)NNC(=O)c1cccc2ncccc12	746229474	QNHOWZDRGWYTOQ-SSEXGKCCSA-N	425.466	1.965	50	20	IDGD	
CC(C)(C(=O)NNC(=O)[C@H](CCC(N)=O)N1C(=O)c2ccccc2C1=O)c1ccccc1	746239726	QEJIXKKEMJBTFK-KRWDZBQOSA-N	436.468	1.042	50	20	IDGD	
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)Cc1cn2ccccc2n1	746636621	DOATXZJDGZYVKX-FQEVSTJZSA-N	446.511	1.889	50	20	IDGD	
CC1CCC(NS(=O)(=O)CC(=O)NNc2nc(-c3ccccn3)nc3c2CCC3)CC1	748337654	KPQDAMDRQVFULM-UHFFFAOYSA-N	444.561	1.969	50	20	IDGD	
NS(=O)(=O)c1ccc2c(c1)oc(=O)n2CC(=O)NNc1cc(Cl)ccc1Cl	748511645	KVVRRQVKPMLLOO-UHFFFAOYSA-N	431.257	1.692	50	20	IDGD	
O=C(NCCNS(=O)(=O)Cc1ccon1)NNc1ncc(C(F)(F)F)cc1Cl	750289659	WDLUBSDFKIZYGA-UHFFFAOYSA-N	442.807	1.488	50	20	IDGD	
COC(=O)c1ccc(Cl)cc1S(=O)(=O)NNC(=O)C(=O)Nc1ccc(C)c(C)c1	751267691	LFPQHTJTOBGUKN-UHFFFAOYSA-N	439.877	1.692	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2occc2Br)CC1	751392494	QKFVDGYUDWVXIK-UHFFFAOYSA-N	444.311	1.130	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)Cc1ccc2c(c1)NC(=O)C2	752040244	CLNUITNOYOAYNH-UHFFFAOYSA-N	431.832	1.390	50	20	IDGD	
COc1cc(OC)cc(N2C[C@@H](C(=O)NNC(=O)[C@@H](C)Oc3ccc(F)cc3)CC2=O)c1	752400863	WEOXGOVQMBTBIA-KGLIPLIRSA-N	445.447	1.811	50	20	IDGD	
CC(C)Oc1cccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)n1	755160503	FNGUGGGBBHOJQY-UHFFFAOYSA-N	432.502	1.728	50	20	IDGD	
O=C(NCCN1C(=O)[C@@H]2[C@@H](C1=O)[C@H]1C=C[C@H]2C1)NNC(=O)C12CC3CC(CC(C3)C1)C2	755248877	XDNYNESZILESPF-GVQBEWSUSA-N	426.517	1.340	50	20	IDGD	
CS(=O)(=O)c1ccc(Sc2ccccc2C(=O)NNC(=O)Cc2cc[nH]n2)cc1	755259781	AOPPNJMJMSMAPY-UHFFFAOYSA-N	430.511	1.968	50	20	IDGD	
O=C(NN=Cc1cn(-c2ccccc2)nn1)c1cccc(S(=O)(=O)N2CCOCC2)c1	755473479	WRQWJMSGWDZIOC-UHFFFAOYSA-N	440.485	1.052	50	20	IDGD	
CNC(=O)c1cccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1	755516079	WBIDVWDTFBMHLE-UHFFFAOYSA-N	445.501	1.297	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)Nc2cccc(S(=O)(=O)NC(C)(C)C)c2)c1O	755516635	VCCBPSXKKFACSI-UHFFFAOYSA-N	436.490	1.944	50	20	IDGD	
CN1CCN(C(=O)c2ccccc2NC(=O)NNC(=O)c2ccc3c(c2)OCO3)CC1	755622781	KNJITCJWQUXYFJ-UHFFFAOYSA-N	425.445	1.269	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2cccc(CS(C)(=O)=O)c2)c2ccccc2c1=O	756269869	UTMPJJJHSQSJLA-UHFFFAOYSA-N	443.485	1.428	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)Nc1ccccc1OCC(=O)N1CCOCC1	756874533	QPRBUKWMSDWEFI-UHFFFAOYSA-N	428.445	1.399	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2cc(Br)nn2C)c2ccccc2c1=O	757812629	BESNJIUPXRJISI-UHFFFAOYSA-N	433.266	1.377	50	20	IDGD	
COC1CCC(CCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)CC1	758716441	WHQIDEQSQPJUAN-UHFFFAOYSA-N	426.539	1.476	50	20	IDGD	
C[C@H]1C[C@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)CC[C@H]1C	758717663	GRFCKRQKXOWOII-HLLBOEOZSA-N	438.550	1.476	50	20	IDGD	
CN(NC(=O)[C@@H]1CS[C@]2(C)CCC(=O)N12)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758786770	NVIXTLHMQPIUTP-ORAYPTAESA-N	441.554	1.076	50	20	IDGD	
C[C@H](CC(=O)NNC(=O)Cc1c[nH]c2ccccc12)NS(=O)(=O)c1cccnc1Cl	760282626	QSQHQAWYTCMNIO-GFCCVEGCSA-N	449.920	1.663	50	20	IDGD	
CS(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)CSc2ccccc2O)cc1F	763414411	YYUCSDJHVYKIAF-UHFFFAOYSA-N	434.492	1.037	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)C(=O)Nc1ccc(F)c(F)c1	763531385	NGJHGSYJYDGJRU-UHFFFAOYSA-N	431.443	1.263	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)Nc1cccnc1Oc1ccccc1	763574263	YBTMPDXZUNZHIE-SFHVURJKSA-N	434.408	1.800	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)C(=O)Nc2cnc3c(c2)COCC3)c1	763595679	BFRUESKHZNJBEO-UHFFFAOYSA-N	426.473	1.751	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(-n3cncn3)nc2)c(C)n1-c1ccccc1	763601813	IJNXXQAUWBXYCI-UHFFFAOYSA-N	444.455	1.470	50	20	IDGD	
COc1cc(OC)cc(OCCNC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c1	763612620	LDAKNCLGERRVDD-UHFFFAOYSA-N	425.445	1.913	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2ccc3c(c2)NC(=O)[C@@H](C)O3)c1	763649523	YLOZGSVHZBGNPQ-CYBMUJFWSA-N	426.429	1.188	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2cc(F)cc(N3CCOCC3)c2)c1	763650883	RWNJIIBULYKSOU-UHFFFAOYSA-N	444.463	1.444	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(F)cc2Cl)c1	763718851	OSRGITHJNNYEJB-UHFFFAOYSA-N	442.856	1.129	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)N(C)C)c(C)c2)c1	763771103	FSKMNENRNOOFEA-UHFFFAOYSA-N	428.445	1.114	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(Cl)c2S(C)(=O)=O)cc1	763820620	LRXJQCPCBLTQKU-UHFFFAOYSA-N	439.877	1.217	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cc(C)nn2-c2ccc(F)cc2)cc1	763820734	NWNCRAZUGUSVGF-UHFFFAOYSA-N	425.420	1.793	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(N3C[C@H](C)O[C@H](C)C3)nc2)cc1	763832560	XYVWQGJMWMSSSJ-GASCZTMLSA-N	425.489	1.657	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1cc(N2CCCC2=O)ccc1F	763851530	UEHKNAXDAXIIHQ-GFCCVEGCSA-N	446.410	1.645	50	20	IDGD	
Cn1ccnc1C(=O)c1ccc(NC(=O)C(=O)NNC(=O)Cc2c[nH]c3ccccc23)cc1	763859239	ZRYWLKYBMROPOU-UHFFFAOYSA-N	444.451	1.461	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@@H](C)C(=O)NNC(=O)C(=O)Nc1c(C)ccn(C)c1=O	763877500	KYNYCMBTTOUGSX-ZDUSSCGKSA-N	434.880	1.517	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cnc(C3CC3)nc2)cc1OC	763911488	GCVIKPXSMFATIZ-UHFFFAOYSA-N	427.461	1.941	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc3c2OCCC3=O)cc1OC	763913041	XAZQVFRWTZOABR-UHFFFAOYSA-N	441.440	1.849	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(=O)n(C)c2)ccc1OCCC(C)C	763914778	QSXTXYUJQLWNQX-UHFFFAOYSA-N	430.461	1.219	50	20	IDGD	
Cc1ccc(-n2nc(C(C)(C)C)cc2NC(=O)C(=O)NNC(=O)c2cnccn2)c(C)c1	764024237	JKXJHOVDIJCYHN-UHFFFAOYSA-N	435.488	1.976	50	20	IDGD	
CC(C)(C)OC(=O)NCCOc1cccc(NC(=O)C(=O)NNC(=O)C2CCCC2)c1	764067008	VUBVYMIXNPEZIQ-UHFFFAOYSA-N	434.493	1.866	50	20	IDGD	
COC(=O)c1csc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(C)cc3)[nH]n2)c1C	764111826	ULOQAXVNUWVIDJ-UHFFFAOYSA-N	441.469	1.941	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccc(C)c(C(=O)NC(C)C)c1	764139067	NDDFNWFGQDHMSK-UHFFFAOYSA-N	426.473	1.470	50	20	IDGD	
CN(C)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)cc1Cl	764165489	ZNFAAXVJZFILNX-MRXNPFEDSA-N	430.848	1.131	50	20	IDGD	
Cc1ccc(Br)c(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1	764199275	WHNLYHVIHVSUBP-INIZCTEOSA-N	449.257	1.902	50	20	IDGD	
O=C(NNC(=O)c1c(Cl)cccc1Cl)C(=O)Nc1cccc(N2CCNC2=O)c1	764221739	XTDNDVGWGDYSEM-UHFFFAOYSA-N	436.255	1.923	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)C(=O)Nc1ccc(=O)n(Cc2ccccc2Cl)c1	764263847	MKXDDQIFWSAJMZ-UHFFFAOYSA-N	439.859	1.274	50	20	IDGD	
Cn1ccnc1Sc1ccc(NC(=O)C(=O)NNC(=O)CCc2ccccc2O)cc1	764279234	ZOEFWQVQBIOXPB-UHFFFAOYSA-N	439.497	1.996	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)C(=O)Nc1cc(C(=O)N(C)C)ccc1OC)c1ccccc1	764330395	VXDISCFMPFMXIC-MRXNPFEDSA-N	426.473	1.677	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)C(=O)Nc1nn(-c2ccc(C#N)cn2)cc1C)c1ccccc1	764331419	CTZWXTJWARLJIM-QGZVFWFLSA-N	431.456	1.727	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(n2cc(NC(=O)C(=O)NNC(=O)C3CCC3)cn2)CC1	764335088	LAXKYAAIVPNKOI-UHFFFAOYSA-N	434.497	1.341	50	20	IDGD	
CCn1cnnc1-c1ccccc1NC(=O)C(=O)NNC(=O)CSc1ccccc1O	764405975	ZPDIFIPMBXBPNN-UHFFFAOYSA-N	440.485	1.549	50	20	IDGD	
CS(=O)(=O)N1CCN(CC(=O)NNC(=O)c2cccc(Cl)c2)Cc2ccccc21	764459654	SIGGZHXHTXIRBK-UHFFFAOYSA-N	436.921	1.383	50	20	IDGD	
COc1cccc([C@@H](O)C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)c1	765176993	QWWVOFQZFDDNSP-OAQYLSRUSA-N	446.935	1.347	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)Cn1nnc(-c2ccc(Cl)cc2)n1	765321178	WLFDMXADWBEZJL-UHFFFAOYSA-N	437.888	1.446	50	20	IDGD	
C[C@@H]1Oc2ccccc2N(CCC(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)C1=O	765323475	QSKIFUKMHXZIDI-AWEZNQCLSA-N	434.493	1.643	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)Cn2cnc3c(C)cccc3c2=O)n[nH]1	765600934	QFKXUHAEDRXSEK-UHFFFAOYSA-N	432.440	1.565	50	20	IDGD	
COc1cc(OCC(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)ccc1[N+](=O)[O-]	765616933	BWRAHVLEGYZEFR-UHFFFAOYSA-N	429.364	1.973	50	20	IDGD	
COc1cc(C=NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c([N+](=O)[O-])cc1O	767037112	LNVZIDWITSELJB-UHFFFAOYSA-N	448.457	1.857	50	20	IDGD	
COc1cccc(OCCN2CCN(CC(=O)NNC(=O)c3ccccc3Cl)CC2)c1	767047575	JTJLNSQQMOKDLY-UHFFFAOYSA-N	446.935	1.806	50	20	IDGD	
NC(=O)c1ccc(NNC(=O)CSc2nnc(-c3ccco3)n2Cc2ccco2)nn1	768230101	GLWLVYWXTCMWQC-UHFFFAOYSA-N	440.445	1.304	50	20	IDGD	
CCCCCCn1cc(S(=O)(=O)NNC(=O)c2cc3ccccc3o2)c(O)nc1=O	769632291	DCAGSSUWDWSMNY-UHFFFAOYSA-N	434.474	1.899	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)NCCNC(=O)c3ccccc3Cl)nc21	770339166	BKHFOEFLCACRGQ-UHFFFAOYSA-N	446.899	1.996	50	20	IDGD	
CCc1nc(-c2ccc(C(=O)NNC(=O)c3sc(N4CCOCC4)nc3C)cc2)n[nH]1	770750637	VHEKJQLGXCVMHV-UHFFFAOYSA-N	441.517	1.710	50	20	IDGD	
CCc1cc(NNC(=O)[C@@H](C)NS(=O)(=O)c2cccs2)nc(-c2ccccn2)n1	771007783	FSQDXSGUAAABHG-GFCCVEGCSA-N	432.531	1.973	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)Cc1ccc(NS(=O)(=O)c2cccs2)cc1	771985775	RTRMDSUWFZKZSA-GFCCVEGCSA-N	439.515	1.581	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)[C@H]1CCCCN1C(=O)c1ccco1	772889694	SEKJKMBEWSVOJD-OAHLLOKOSA-N	432.864	1.392	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C1CCN(c2ccc3nncn3n2)CC1	772954749	RIGJUZPQLDVWBK-CYBMUJFWSA-N	443.895	1.609	50	20	IDGD	
Cc1nc(COc2ccc(NC(=O)C(=O)NNC(=O)c3ccc(C)c(F)c3)cc2)no1	773891010	YGYOAHZRKZSVDF-UHFFFAOYSA-N	427.392	1.804	50	20	IDGD	
COC(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)c1	774001002	CEPPDEZYQSKHSE-LBPRGKRZSA-N	433.848	1.609	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)NC[C@H]1CC[C@H](C(=O)N(C)C)O1	775460336	INSZFVXJOZOCKI-GDIGMMSISA-N	428.489	1.573	50	20	IDGD	
CC(C)CS(=O)(=O)CCC(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776201165	GKHDFGXVVRJLGM-UHFFFAOYSA-N	434.559	1.083	50	20	IDGD	
C[C@H]1OC(C)(C)N(C(=O)OC(C)(C)C)[C@@H]1C(=O)OCC(=O)NNC(=O)c1cccs1	776481124	VKKFPPQQYJQJFC-RISCZKNCSA-N	441.506	1.813	50	20	IDGD	
C[C@@]12CCC(=O)N1c1ccccc1C(=O)N2CC(=O)NNc1cccc(S(C)(=O)=O)c1	776533528	FEBYKYNHOQZTST-NRFANRHFSA-N	442.497	1.532	50	20	IDGD	
CC[C@@H](C)NS(=O)(=O)c1ccc(C(=O)NNC(=O)CNC(=O)OC(C)(C)C)cc1	778442992	KTAQCVDTOADDAV-GFCCVEGCSA-N	428.511	1.049	50	20	IDGD	
O=C(NCC1CCN(CC(F)(F)F)CC1)NNC(=O)c1cc(Br)c[nH]1	780627482	IZEXYDYAHVECIX-UHFFFAOYSA-N	426.237	1.996	50	20	IDGD	
CCNC(=O)N(C)NC(=O)c1cc(S(=O)(=O)NC(C)(C)C)ccc1Br	780705707	FDJQERWAHVWTFP-UHFFFAOYSA-N	435.344	1.832	50	20	IDGD	
CC(=O)N1CCN(Cc2cccc(NC(=O)C(=O)NNc3cccc([N+](=O)[O-])c3)c2)CC1	782118762	WTYSKLGGXUKTLV-UHFFFAOYSA-N	440.460	1.341	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)cc1)C(=O)Nc1ccc(-n2nccn2)cc1C(F)(F)F	782834394	UQHQRNZOVPOGCJ-UHFFFAOYSA-N	434.334	1.391	50	20	IDGD	
CCCCN(C)S(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(O)cc2)cc1	782834609	ZMUDINOQMLKSKB-UHFFFAOYSA-N	448.501	1.213	50	20	IDGD	
COc1cc(OC)c(NC(=O)C(=O)NNc2cncc(Cl)n2)cc1Br	783265031	APZZYDZYPLDHRV-UHFFFAOYSA-N	430.646	1.992	50	20	IDGD	
Cn1cc(Br)cc(NC(=O)C(=O)NNc2ccc(Cl)cc2[N+](=O)[O-])c1=O	783290746	FAPFKQVHQGPTDK-UHFFFAOYSA-N	444.629	1.791	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2cccc(NC(=O)C3CCCCC3)c2)CCS(=O)(=O)C1	783424995	HDIRXXSIBZFARK-FQEVSTJZSA-N	436.534	1.342	50	20	IDGD	
N#C/C(=C/c1cn(Cc2cccnc2)nn1)C(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1	783700508	SAHDCIFVPUOHPR-PDGQHHTCSA-N	444.455	1.885	50	20	IDGD	
C[C@@H]1CCC[C@H](OCc2cccc(NC(=O)C(=O)NNC(=O)C(=O)N3CCCC3)c2)C1	784003261	SJPXKHICYCKCCX-QAPCUYQASA-N	430.505	1.490	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)C(=O)Nc1ccc(-c2cn3ccccc3n2)cc1	784003550	ZUEYBPFRYMASFA-UHFFFAOYSA-N	446.423	1.110	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)[C@@H]2CC=CC[C@H]2C(=O)N2CCOCC2)cc1OC	784296202	LJPDMTXQCGYCDM-QZTJIDSGSA-N	445.516	1.686	50	20	IDGD	
CNC(=O)CCOc1ccc(NC(=O)C(=O)NNc2ccc(Br)cn2)cc1	784340790	FQLHKEMGDBPFDE-UHFFFAOYSA-N	436.266	1.441	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)C(=O)Nc2ccc([S@](=O)C(F)(F)F)cc2)c1	784844203	IZBGYUCYUCJYME-NDEPHWFRSA-N	449.432	1.799	50	20	IDGD	
Cc1ccc(F)c(NNC(=O)C(=O)Nc2cnn(CC(=O)N3C[C@@H](C)O[C@H](C)C3)c2)c1	784885367	SIFCYKBRDVNFPA-ZIAGYGMSSA-N	432.456	1.048	50	20	IDGD	
CCOc1cc(N2CCOC(C)(C)C2)ccc1NC(=O)C(=O)NNc1ncc(F)cn1	784956579	LYABMPFUXXUAGM-UHFFFAOYSA-N	432.456	1.711	50	20	IDGD	
O=C(NNc1cc(F)c(F)c(F)c1)C(=O)Nc1ccc(F)c(S(=O)(=O)NC2CC2)c1	785088565	RUJDILZKJBEUPG-UHFFFAOYSA-N	446.382	1.766	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccn(CC(F)F)n3)n[nH]2)c1	785127244	YTIMAXFDROJPJN-UHFFFAOYSA-N	431.403	1.555	50	20	IDGD	
O=C(COC(=O)c1ccc(CN2CCC(CO)CC2)cc1)NNC(=O)c1ccccc1	785710251	IJGOLHZPCLLNKI-UHFFFAOYSA-N	425.485	1.509	50	20	IDGD	
O=C(NC[C@@H]1CCCN(c2ccccc2)C1)NNC(=O)c1csc(N2CCOCC2)n1	789319613	XSOAQDWTGDVRLN-INIZCTEOSA-N	444.561	1.840	50	20	IDGD	
CC[C@@H](Nc1c([N+](=O)[O-])c(C)nn1C)C(=O)NNC(=O)[C@H]1OCC[C@H]1c1ccccc1	790315599	RHLQSNOMBNZMPO-UXLLHSPISA-N	430.465	1.547	50	20	IDGD	
O=C(NNc1nc2ccccn2n1)C(=O)Nc1cnn(-c2ccccc2Br)c1	792395081	ORJBBAFMMVDXOT-UHFFFAOYSA-N	441.249	1.759	50	20	IDGD	
COc1c(NC(=O)C(=O)NNC(=O)COc2cc(C)ccc2C)cc(Cl)cc1C(N)=O	793023710	UFJYNMPUJZPLHJ-UHFFFAOYSA-N	448.863	1.229	50	20	IDGD	
Cn1cc(C(=O)CCC(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)cn1	793680702	GKWSGGWQXNCYFQ-UHFFFAOYSA-N	446.939	1.002	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CCCNS(=O)(=O)c2ccc3c(c2)CCCC3)n1	794075630	KHIXWFSLGRWWRO-UHFFFAOYSA-N	430.530	1.789	50	20	IDGD	
CCC(=NNC(=O)[C@@H](C)CN1C[C@H](C)O[C@H](C)C1)c1ccc(Cl)c(S(N)(=O)=O)c1	794477611	DCPXGKWRXDDKDR-MELADBBJSA-N	444.985	1.963	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNS(=O)(=O)c1cc(Cl)ccc1C(F)(F)F	795311933	NAAFSYRHGHHZKY-UHFFFAOYSA-N	425.772	1.691	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNS(=O)(=O)c1c(F)c(F)cc(F)c1F	795342695	AQPHUBFHHZGXMN-UHFFFAOYSA-N	439.774	1.522	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CN2CCNC(=O)[C@@H]2c2ccc(Br)cc2)cc1	796577009	WEDPGEZWQKEQQU-SFHVURJKSA-N	445.317	1.692	50	20	IDGD	
CC(C)Oc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)cc1C(N)=O	796990377	RJUZLHMANKNEGR-LBPRGKRZSA-N	446.435	1.265	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)[C@H]3CC[C@H](C(=O)OC)CC3)n[nH]2)cc1OC	797964051	CXPZDEXJARRTFK-JOCQHMNTSA-N	430.461	1.834	50	20	IDGD	
Cc1onc(-c2cccnc2)c1C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	802762676	KYNZTHGRCYFSGI-UHFFFAOYSA-N	448.483	1.264	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3ccc4oc(O)nc4c3)cc2)CC1	806781315	BHNMAZFJTKWCJU-UHFFFAOYSA-N	431.474	1.226	50	20	IDGD	
Cc1cccn(Cc2c(F)cccc2NC(=O)C(=O)NNc2ccc(Cl)nn2)c1=O	806968137	YRPCPTMWLJRAKS-UHFFFAOYSA-N	430.827	1.869	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)C(=O)Nc2ccc(C#N)c(Br)c2)c1	806969106	YQMLRTOWLIFSGU-UHFFFAOYSA-N	437.275	1.806	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1nc2c(s1)CSCC2	806980365	NIUHOFGHJWGXLH-UHFFFAOYSA-N	438.556	1.819	50	20	IDGD	
O=C(NNc1ncnc2ccsc12)C(=O)Nc1cc(F)c(N2CCOCC2)cc1F	806998072	PTYLJTCHXSKPAJ-UHFFFAOYSA-N	434.428	1.888	50	20	IDGD	
O=C1COC[C@H](C[C@H]2CN(C(=O)C(=O)NNc3cccc(F)c3F)c3ccccc32)N1	807017888	QOFXUVPLDORNTB-STQMWFEESA-N	430.411	1.443	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1)NNC(=O)C1CCCC1	810097605	JYEROQQBDRWKOT-UHFFFAOYSA-N	427.832	1.975	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)NCC(=O)NNc2nccc3sccc23)cc1	810406232	YVUWWDFFBZOGNE-UHFFFAOYSA-N	434.499	1.895	50	20	IDGD	
CCc1ccc(C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)cc1S(C)(=O)=O	812728169	IJKJAMFYNQTRIM-UHFFFAOYSA-N	425.532	1.660	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)Nc1cccc(N2C(=O)N[C@](C)(C3CC3)C2=O)c1	812988394	DBBCYKBEVPWIRG-HXUWFJFHSA-N	447.492	1.853	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)C2(Cc3cccc(F)c3)CCOCC2)n1	814596397	WMERGYBOMJBLPT-UHFFFAOYSA-N	449.504	1.863	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)C1(N2C(=O)c3ccccc3C2=O)CCCC1	815440082	SNUSOWOGHZMQNR-AWEZNQCLSA-N	429.473	1.721	50	20	IDGD	
O=C(NNC(=O)c1ccccc1O)C(=O)Nc1cccc(S(=O)(=O)C2CCCCC2)c1	815563523	GAOGPLOPFKPWJB-UHFFFAOYSA-N	445.497	1.898	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2cc(Cl)ccc2I)n1	815574290	LBIJGNNEMYUGCG-UHFFFAOYSA-N	447.620	1.825	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)C1CCC(OC[C@@H]2CCCO2)CC1	815622305	RFJSMHMQENHKIH-GPANFISMSA-N	428.530	1.596	50	20	IDGD	
COc1cccc(/C=C(\C(=O)NNC(=O)COc2ccc(C#N)cc2)n2nnnc2C)c1	818023303	FIEVMSMMSKRMAX-YBFXNURJSA-N	433.428	1.086	50	20	IDGD	
Cc1ccccc1NNC(=O)CCC(=O)N1CCN(S(=O)(=O)c2ccccc2)CC1	832625015	NVUXVCUEDQMZQP-UHFFFAOYSA-N	430.530	1.751	50	20	IDGD	
COc1cc(Cl)ccc1S(=O)(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	844253551	AHVLXDLLZNDFFA-UHFFFAOYSA-N	447.922	1.222	50	20	IDGD	
CC(C)n1ncc2cc(/C=C/C(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)c(=O)[nH]c21	891625303	PAOXFJVEHMVKKO-CMDGGOBGSA-N	447.455	1.027	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CNS(=O)(=O)c2ccc(C)c(C)c2)ccc1OC(C)C	913154125	HBRRCNSXGPDGTP-UHFFFAOYSA-N	449.529	1.839	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CCNS(=O)(=O)/C=C\c2ccccc2)cc1OC	913415708	RMSVWUWHNKNOAP-QBFSEMIESA-N	433.486	1.445	50	20	IDGD	
COC(=O)c1ccc(CCNC(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)cc1	913638245	BDNJBJCKHJBGKB-UHFFFAOYSA-N	431.445	1.686	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2CC(=O)N(c3ccc4c(c3)CCC4)C2)cc1C	913898017	LKYQASNHUWAMGA-SFHVURJKSA-N	434.496	1.931	50	20	IDGD	
N#C/C(=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)OC[C@H]1CNC(=O)O1	914005701	UTKWRMCKVMICJI-VXXVJXPCSA-N	443.847	1.637	50	20	IDGD	
CCn1nc(C(=O)NN=C2C(=O)Nc3cc(N4CCOCC4)ccc32)c2ccccc2c1=O	915947369	RHGBICRPZDYQRT-UHFFFAOYSA-N	446.467	1.339	50	20	IDGD	
CC(C)C(=O)Nc1nc(CC(=O)NNC(=O)c2csc(N3CCOCC3)n2)cs1	916136069	GFXPNOOHFUBRCG-UHFFFAOYSA-N	438.535	1.034	50	20	IDGD	
COc1cc(OC)cc(C(=O)N2CCC(C(=O)NNC(=O)Cn3nc(C)cc3C)CC2)c1	916139989	MJZGHHJDVOOBOI-UHFFFAOYSA-N	443.504	1.217	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)NC2CCN(S(C)(=O)=O)CC2)c(C)n1-c1ccccc1	916238126	XNWSKRSPVXLQAD-UHFFFAOYSA-N	433.534	1.462	50	20	IDGD	
O=C(Cc1ccc(Cl)cc1)NNC(=O)NCCCN1CCN(c2ncccn2)CC1	916267118	CJFLAGMTRIYTRY-UHFFFAOYSA-N	431.928	1.215	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2cc(Br)ccc2O)ccc1Cl	917362570	RCENZOVEFJGLIC-UHFFFAOYSA-N	448.682	1.530	50	20	IDGD	
O=C(O)CNC(=O)c1ccc(S(=O)(=O)NNC(=O)c2ccc3ccccc3c2)cc1	917749103	HTVOTROYFVSLNO-UHFFFAOYSA-N	427.438	1.278	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=O)c2ccc(C)cc2O)c1	918337134	CZNZQFDVSUATAB-UHFFFAOYSA-N	441.893	1.354	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(N3CCC(C)=N3)cc2)cc1OC	919142919	KBXPZQVMYPYPHQ-UHFFFAOYSA-N	440.456	1.908	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc([N+](=O)[O-])c1	920849868	LYHDEXPYICTLKN-UHFFFAOYSA-N	432.458	1.763	50	20	IDGD	
CN(C(=O)CSCC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)C1CCCCC1	933560994	KYINACYPNXWTJW-UHFFFAOYSA-N	445.545	1.219	50	20	IDGD	
COc1cc(C(=O)NCC(=O)NNc2cncc(Br)c2)cc(OC)c1OC	1116403392	OJUQPIYHMYIJGH-UHFFFAOYSA-N	439.266	1.743	50	20	IDGD	
CC(=O)N1CCN(c2cccc(NC(=O)NNC(=O)c3n[nH]c4c3CCCC4)c2)CC1	1255411321	DGPKKRVEDSNPJR-UHFFFAOYSA-N	425.493	1.424	50	20	IDGD	
CN1/C(=C(\C#N)C(=O)CSc2nnc([C@@H]3CCS(=O)(=O)C3)n2C)Nc2ccccc21	1317716942	DBFCIRVJGAZSEU-SLDGYZHNSA-N	444.542	1.675	50	20	IDGD	
O=C(NCc1cccnc1N1CCOCC1)NNC(=O)c1ccc(Br)cc1	1317888432	CKBDVLMOHIMTGO-UHFFFAOYSA-N	434.294	1.825	50	20	IDGD	
O=C(NNc1cncc(Br)c1)c1ccccc1S(=O)(=O)N1CCOCC1	1319761725	MRERULWFXLYPEX-UHFFFAOYSA-N	441.307	1.622	50	20	IDGD	
COc1cccc(C[C@H](O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(Br)c2)c1	1320740176	RGXKZEKKWRQIGW-PXAZEXFGSA-N	437.290	1.976	50	20	IDGD	
CNC(=O)c1ccc(OC)c(NC(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)c1	1337783924	VHXNMORQGLRKPO-UHFFFAOYSA-N	449.508	1.855	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cn3ncccc3n2)C1	1778668297	ZUUINIASNPUKNJ-DYESRHJHSA-N	445.596	1.708	50	20	IDGD	
O=C(c1cc2ncsc2[nH]1)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1779338469	OBAKQJLZGCVKPY-XHDPSFHLSA-N	431.287	1.758	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc4cccnn4n3)C2)C1	1779961175	NJQCEJRYEDHJIQ-ZWKOTPCHSA-N	426.304	1.409	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(Cl)Cl)C2)c1ccnc2c1OCO2	1780025668	RQTKYDMVPZLWQA-KZULUSFZSA-N	430.288	1.742	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccn(-c4ccccc4)n3)C2)C1	1780344387	VDRUGAQKWPURTG-UWJYYQICSA-N	432.908	1.570	50	20	IDGD	
O=C(c1cccc2ccnn12)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781333641	PHSGMRLRZKVXNI-YOEHRIQHSA-N	425.258	1.468	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cccc3c2NC(=O)C3)C1	1781353810	MPRIUTPTMCMCDZ-GSHUGGBRSA-N	449.935	1.563	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccccc3C(N)=O)C2)C1	1781761183	YZAKYCMTSYEBBR-RTBURBONSA-N	428.316	1.465	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](O)Cc2ccccc2)C1	1781895870	JUSJFVMQCDMPTN-JPAWQOSXSA-N	438.952	1.358	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)Br)C1	1782002939	XUNRMXOPVUKCEC-VPWBDBDCSA-N	425.751	1.538	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(NC(C)=O)c(O)c3)C2)C1	1782135906	OJGXAZJDDHPJOG-FOIQADDNSA-N	439.896	1.048	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(OC)ccn1)C2	1782175107	FCPXAJXUCWVAIG-WRWLIDTKSA-N	425.913	1.472	50	20	IDGD	
O=C(c1cc2ncccc2[nH]1)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1782211640	XHYQFMHUADJOAH-PBHICJAKSA-N	425.258	1.697	50	20	IDGD	
Cc1cc(F)cc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CCC(=O)NN(C)C)C2)c1	1782213363	MKMMSTUZYYQFGC-AUSIDOKSSA-N	448.539	1.635	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cn1nnc3ccccc31)C2)C(Cl)Cl	1782214417	FPJTVIXXXVLTKZ-DNVCBOLYSA-N	440.331	1.749	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)Cn2ccnc2)C1	1782547343	NFVVGYRQFXTXQE-YKTARERQSA-N	441.370	1.817	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)Cc3ccccc3O)C2)C1	1783239493	FUFOQEQWJDAMOM-HNAYVOBHSA-N	425.323	1.938	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)[C@@H](C)CN(CC)CC)CCO2)C1	1783355244	MVHQSIDJACBRDN-BXWFABGCSA-N	432.403	1.968	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(N(C)C)cn3)CCO2)C1	1783532302	LROHLLPWDAXCQM-UGSOOPFHSA-N	425.327	1.375	50	20	IDGD	
CC[C@H]1CC[C@H](C(=O)N2CC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)CC1	1783606009	VTDBFRSOPCZOQK-BSRJHKFKSA-N	428.338	1.026	50	20	IDGD	
CCc1nn(C)c(C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](Cl)COC)C3)C2)c1Cl	1783873667	RYNYTVUGDHWHCH-XIKOKIGWSA-N	433.336	1.333	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](O)c1ccccc1Cl)CCO2	1783878197	BSBSAMNDNVCNNJ-MDZRGWNJSA-N	431.316	1.457	50	20	IDGD	
CCSc1cccnc1C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](Cl)COC)C2)C1	1783880404	BNQHTSILTMKKPQ-IFXJQAMLSA-N	427.954	1.891	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3n[nH]c4c(Cl)cccc34)CCO2)C1	1783882014	PAEFREIGUNFYPF-IFXJQAMLSA-N	441.315	1.914	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21	1783972802	QDEZUFFQFITXFZ-UHFZAUJKSA-N	444.139	1.688	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C\c3c[nH]c4ccccc34)C[C@@H]21)[C@@H](O)CCl	1784086160	VRCHLLIEPLQFEJ-PFJARCFTSA-N	431.920	1.761	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cncn3-c3ccncc3)[C@H]2C1	1785754518	KVFGZTUHXNKCDD-RMRDIRSESA-N	447.923	1.114	50	20	IDGD	
Cc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)CBr)C[C@@H]32)nn1C	1786005225	MUSRSDHSIFNZLQ-DSRCVFDASA-N	427.343	1.353	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3ccc(OC)cc3)[C@H]2C1	1786421584	BMRLHFIKBKBHOD-LEAZDLGRSA-N	438.952	1.861	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](N)c3cccc(Cl)c3)[C@H]2C1	1786886390	WDLSLUAIIHLFCA-JFMONLCZSA-N	444.359	1.573	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3nccc4nc[nH]c34)[C@H]2C1	1787357441	LCBMHKQOCHCMDH-MNXVOIDGSA-N	436.310	1.335	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc4cccnc4nc3O)[C@H]2C1	1790366756	VLGMTRRNAPXEOT-LLLHUVSDSA-N	448.907	1.183	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(F)n3)C[C@@H]21	1790960585	MTHHGNPCUIYSKD-ABHRYQDASA-N	428.302	1.988	50	20	IDGD	
COc1ccc(Cl)cc1CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](O)CCl	1792984382	ZLGYMKIGAHMFTM-ZFHGCVPZSA-N	431.316	1.080	50	20	IDGD	
Cc1oc(C(C)(C)C)cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCC(=O)NN(C)C)C2	1794766531	ILWSDPVFFJFAIK-VPTLXERWSA-N	448.564	1.462	50	20	IDGD	
COc1ccc2cc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3cccc(B(O)O)c3)[nH]c2c1	1796191070	VLGJWLXCFKLBLF-REPLKXPHSA-N	447.300	1.422	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)c1c(F)cccc1Cl	1796191635	HWSFBMHNYHGYAB-MUJYYYPQSA-N	430.672	1.725	50	20	IDGD	
CC1=CC[C@@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)CC1	1796441902	FLBMQJGFGLIIKN-ZRPKMVPDSA-N	441.532	1.456	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1c(C)n[nH]c1C)C2	1796891880	MIQKRXYBNFVKLD-MVRRYPJTSA-N	425.493	1.412	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnc(Cl)c(Cl)c1	1798077443	JJPPBUDCQRBHCB-ZMJPVWNMSA-N	436.723	1.845	50	20	IDGD	
Cc1scc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)c1C	1798439403	YJVLPKOCLIDOFD-QDMKHBRRSA-N	427.530	1.929	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccn(-c2ccccc2)n1	1798699172	GLQMHJFSACSIOF-UPHUGPLXSA-N	442.592	1.927	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)c1ccccc1N1CCCCC1	1799783076	HVBVCZYLVYGAJI-WOUAJJJCSA-N	435.952	1.480	50	20	IDGD	
Cc1cc(C)n2ccc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@H](C)Br)C4)c2n1	1800138469	VDGDLCHBYVTKOV-MPTYRVRUSA-N	449.349	1.938	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CNc1ccc(F)cc1)C2	1800756708	REFWNPLKYCILRX-KOFHJDLBSA-N	428.302	1.611	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(C)(C)NC(=O)OC(C)(C)C)C2	1800971095	PUDMVGSFNBTPGQ-LXTVHRRPSA-N	447.960	1.133	50	20	IDGD	
COc1cccc(CCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CCC(=O)NN(C)C)n1	1802333248	PHZNRFLWJDGUOK-BCDXTJNWSA-N	431.537	1.034	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cccn3nccc23)[C@@H]1c1cccnc1)[C@H](O)CCl	1803148661	WCDFWBVQHCMTHM-KFKAGJAMSA-N	427.892	1.649	50	20	IDGD	
CC(=O)N(C)CCC(=O)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@@H]1c1cccnc1	1804073163	QJPQVBXMNVZRJX-UAGQMJEPSA-N	443.317	1.646	50	20	IDGD	
O=C(CSC1CCCC1)N1CCCC2(CCN(C(=O)c3cccc(B(O)O)c3)CC2)C1	1805983572	JXZFJBMCRQDMFW-UHFFFAOYSA-N	444.406	1.887	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H]2CC=CCC2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807363949	DJPRWNIGCOMOBW-RCZSKKKRSA-N	433.317	1.437	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1CCN(C(=O)CN2CCNC2=N)[C@@H]1c1cccnc1	1808295854	MTFOMMLMLLDWFJ-GMBSWORKSA-N	441.363	1.164	50	20	IDGD	
C[C@@H](C(=O)N1CC[C@H](CNC(=O)[C@H](F)Cl)[C@@H]1c1cccnc1)N1CCN(C)CC1	1808316244	WWGWHPPDBHXFIH-RANZSIQMSA-N	425.936	1.258	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)c3cc4ncccc4[nH]3)CC2)C1	1809974665	ZCPHEYHEGRMHOR-UHFFFAOYSA-N	446.316	1.401	50	20	IDGD	
Cc1onc(C(=O)N2CCC3(CCCN(C(=O)c4cccc(B(O)O)c4)C3)CC2)c1C	1809977372	FXKOWJRLCBRSCW-UHFFFAOYSA-N	425.294	1.130	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)c3[nH]cc4c3CCC4)CC2)C1	1809977616	KTAZACZLHDIBEF-UHFFFAOYSA-N	435.333	1.342	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H](CNC(=O)CO[Si](C)(C)C)[C@H]1c1cccnc1)n1cnnn1	1810548652	RWWIAQKMJMMGEB-QGPMSJSTSA-N	431.573	1.187	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC2(CCCN(C(=O)c3ccc4c[nH]nc4c3)C2)CC1	1810604549	GBKPICVRYBOELB-UHFFFAOYSA-N	446.316	1.401	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)c2cc(CO)on2)[C@H]1c1cccnc1	1811590944	CWYVCFXZRKUUKM-NORZTCDRSA-N	437.294	1.665	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2cccc(F)n2)[C@@H]1c1cccnc1	1813074236	RKZVYYWIGBIHMB-IIBYNOLFSA-N	442.495	1.308	50	20	IDGD	
Cc1ccc(CC(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)o1	1813509466	KOXTVCZACMMGRU-WMZHIEFXSA-N	447.300	1.225	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)C2(F)CCC2)[C@@H]1c1cccnc1	1813684225	NRCMXQVSXOZBJV-YJBOKZPZSA-N	440.479	1.292	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CNC(=O)N(C)C)n[nH]1	1814566640	KLULVCVRUHWULT-DGCLKSJQSA-N	443.346	1.847	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CNC(=O)N(C)C)n[nH]1	1814566643	KLULVCVRUHWULT-YPMHNXCESA-N	443.346	1.847	50	20	IDGD	
COC(=O)c1ccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)[C@@H](O)CCl)n[nH]2)cn1	1814870889	DTOFZZNHXVTBLK-GJZGRUSLSA-N	435.868	1.497	50	20	IDGD	
CC(C)[C@@H](S)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1815240152	KPAIWGGBSXNDTL-FUHWJXTLSA-N	430.339	1.350	50	20	IDGD	
Cc1ncccc1C(=O)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1	1815354956	JCGHEWACOMNRNN-OAHLLOKOSA-N	436.302	1.066	50	20	IDGD	
O=C(CCc1ccccc1)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1	1815355155	PJZDEEYQSZMEFJ-SFHVURJKSA-N	449.341	1.682	50	20	IDGD	
Cc1noc(CC(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@@H](F)Br)CC3)n1	1815565909	RODONVRLVPSWCC-JVXZTZIISA-N	432.275	1.680	50	20	IDGD	
Cc1cc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)[nH]n2)n[nH]1	1820260290	UGNXFNVXNGBTGT-INIZCTEOSA-N	437.464	1.059	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc([N+](=O)[O-])[nH]3)sc2C1	1821746597	BXDOMQCQVLFUAL-BDAKNGLRSA-N	427.870	1.859	50	20	IDGD	
CCN(CC)C[C@H](C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1	1822416534	GVYXVKUDFDUZGK-WMZOPIPTSA-N	449.600	1.753	50	20	IDGD	
C[C@H](C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1)c1ccccn1	1822417102	ZTTJACAILHAEKY-YJBOKZPZSA-N	441.536	1.974	50	20	IDGD	
CC(C)(C#N)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1	1823885730	IEFAKTNZHGWMKT-SFHVURJKSA-N	426.521	1.468	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC([C@@H]2CCCCN2C(=O)C2=NN(C)C(=O)CC2)CC1	1824927259	APFIKVDGPJJHBG-BBRMVZONSA-N	441.370	1.998	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnn3c1OCCC3)CC2	1826004947	VSIPMSDZQMMBNY-ZYHUDNBSSA-N	439.925	1.602	50	20	IDGD	
Cc1ncccc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827050619	ALZSHMUZPAYMPD-JOCHJYFZSA-N	435.333	1.617	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)Cc2ccccn2)CC1	1827219806	DLUFKINFAFXSRZ-QFIPXVFZSA-N	435.333	1.237	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)[C@@H]3CCCS3)sc2C1	1827297825	NCTQFYFYCXEXIL-AAEUAGOBSA-N	425.580	1.324	50	20	IDGD	
C/C(=C\c1cccs1)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1	1829696732	IDQKPQITKCRYHT-JERBSLHSSA-N	428.938	1.208	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3Cc4ccccc4CN3)C2)C1	1831647687	YBHBPFWUXWHXEK-QTEQDKRBSA-N	449.979	1.565	50	20	IDGD	
COCCOCCOCCC(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@H](O)CCl)CC1	1831722013	NWYIRBRUIXPADY-RBUKOAKNSA-N	448.988	1.276	50	20	IDGD	
Cc1[nH]nc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)c1F	1831872419	VRQIJTPLJMRGCO-INIZCTEOSA-N	436.532	1.464	50	20	IDGD	
O=C(CCc1cccc([N+](=O)[O-])c1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1832173525	QIFJECVJZZWVBM-PKOBYXMFSA-N	443.859	1.518	50	20	IDGD	
O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)C(F)(F)C(F)F)CCO2	1832184730	WMZFRZDOAONKFP-CYBMUJFWSA-N	435.212	1.128	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CCS(C)(=O)=O)CC1	1832399041	HBRXPZJSQFCLEJ-HIFRSBDPSA-N	437.400	1.824	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)c1ccc(Cl)nc1	1833012014	KTRVHLSSIOLJSQ-MRXNPFEDSA-N	429.348	1.520	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](F)c3ccccc3)CC2)CC1)[C@H](O)CCl	1833307972	FPUAFGPYXXOCIS-RTBURBONSA-N	425.932	1.869	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnc(OC)c(F)c3)CCO2)C1	1833480473	JUBZSOKNZRBTNJ-YWZLYKJASA-N	443.903	1.707	50	20	IDGD	
Cc1nc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](C)CBr)C3)C2)co1	1834203792	NQZWQDKQYIVZRG-YVEFUNNKSA-N	430.299	1.084	50	20	IDGD	
O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(F)cn1)CCO2	1834475442	QSJJNWFESCRQEV-QGZVFWFLSA-N	430.274	1.076	50	20	IDGD	
O=C(CNc1ccc(F)cc1)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1835584493	FMRYMOIMWGCSEC-SFHVURJKSA-N	434.295	1.498	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCC(OC2CCN(C(=O)c3cccc(=O)n3O)CC2)CC1	1836621761	WTHPZTOZWUMNHB-UHFFFAOYSA-N	439.940	1.963	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4[nH]ccc4n3)C2)C1	1837713183	MGOWUKPQIDUMME-OAQYLSRUSA-N	446.580	1.484	50	20	IDGD	
Cc1nn(C)cc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2	1839150175	DEUPYWHZRIVOTP-ZWKOTPCHSA-N	433.336	1.035	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)cn1C	1839200110	BYDUMWZMRYONIM-RHSMWYFYSA-N	432.290	1.094	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)c(F)c1	1839293053	NWHOWOKJKALLNL-SFHVURJKSA-N	435.279	1.708	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(F)c(C)c3)CCO2)C1	1839321750	SBCJIPYEYVWGRS-JXFKEZNVSA-N	428.888	1.458	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccn3C)C2)C1	1839963691	SDOQTZKUKNUIKJ-KBXCAEBGSA-N	428.327	1.269	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3ccc(C)nc3)C2)C1	1840149938	CDINNEUEUKLCNP-WIYYLYMNSA-N	439.940	1.033	50	20	IDGD	
Cc1c(F)ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)c1N	1840188112	OYEAHKVQVDLKJX-SFHVURJKSA-N	434.295	1.590	50	20	IDGD	
C[C@]1(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)CC=CCC1	1840557189	SBBKMJODTNLZBU-JLSDUUJJSA-N	433.318	1.880	50	20	IDGD	
O=C([C@H](O)CCl)N1CC2(CCCN2C(=O)[C@@H]2CCCN2C(=O)c2ccc(F)cc2)C1	1841307482	MGBLFQJYHVSHNY-DLBZAZTESA-N	437.899	1.233	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)c2ccc(CCN3CCCC3)nc2)C1	1843458394	XNJJOWSZEZTEDS-LJQANCHMSA-N	434.968	1.791	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@H]1C[C@H](O)CN1C(=O)OC(C)(C)C)C2	1845164738	YAVDDTRRANHLGI-KKUMJFAQSA-N	429.945	1.578	50	20	IDGD	
COc1ccc(F)c(C(=O)N2CC3(CCCN3C(=O)CCC(=O)NN(C)C)C2)c1OC	1846385745	QMSHLVQNNXLMGK-UHFFFAOYSA-N	436.484	1.033	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1nc2c(=O)[nH]c3ccccc3n2n1	1847871107	YQNLYHBYMIRSIG-KCXAZCMYSA-N	442.907	1.794	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)[C@H](C)NS(=O)(=O)c1ccc(OC)cc1	16592721	SOWURNPESPJKHV-AWEZNQCLSA-N	435.502	1.151	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)CCNS(=O)(=O)/C=C/c2ccccc2)cc1	28625897	AUGXMBKWBVGDMB-WYMLVPIESA-N	445.497	1.280	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)C1CCN(S(=O)(=O)c2cccnc2Cl)CC1	105548955	JSLFUAZZWXODEZ-UHFFFAOYSA-N	436.921	1.905	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NCCc1ccc(OC(F)(F)F)cc1	725874252	XLHQYKAIYVPLCQ-UHFFFAOYSA-N	430.408	1.950	50	20	IDGD	
CC1(C)CN(CCNC(=O)NNC(=O)COc2ccc(Br)cc2)CCO1	726262573	JRQUSELTWNABDY-UHFFFAOYSA-N	429.315	1.269	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2c(Cl)cccc2Cl)cc(OC)c1OCC(N)=O	727792398	BRCKTEHSHXBLTL-UHFFFAOYSA-N	442.255	1.950	50	20	IDGD	
CCn1c(SCC(=O)N([C@H]2CCS(=O)(=O)C2)N(C)C)nnc1-c1ccccc1C	728179999	PJFZNHKLUFNWHE-HNNXBMFYSA-N	437.591	1.858	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)NCCCOC[C@@H]2CCCO2)c1	728740801	HXSYDUHZNOVWFG-ZDUSSCGKSA-N	430.299	1.987	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1ccn(-c2cccc([N+](=O)[O-])c2)n1	728845913	PPRZXMBDRXHENE-UHFFFAOYSA-N	436.432	1.248	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(C(C)=NNC(=O)c2csc(N3CCOCC3)n2)cc1	729636348	IKDUSACQZUKXPW-UHFFFAOYSA-N	437.547	1.895	50	20	IDGD	
COCC(CC(C)C)=NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	730722180	OJCQGGTWDYOVDR-UHFFFAOYSA-N	425.551	1.805	50	20	IDGD	
Cc1cccc(N2C(=O)N[C@@H](CCC(=O)NNC(=O)[C@H](C)Oc3ccccc3F)C2=O)c1	730739274	BSXZCFYIVIXZAV-YOEHRIQHSA-N	442.447	1.954	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CN2CCN(CC(=O)N[C@H]3CCC[C@@H](C)C3)CC2)cc1	731214092	ARPGEHYOOWTAFA-QUCCMNQESA-N	429.565	1.069	50	20	IDGD	
N#CCOc1ccc(CC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1	731956057	ISONJQGQNFASNI-UHFFFAOYSA-N	442.497	1.377	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@H]2CCCCN2S(C)(=O)=O)cc1Br	732036153	YQLSTYLLOMUFQN-GFCCVEGCSA-N	434.312	1.033	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCCCNC(=O)c2ccc(F)cc2)cc(OC)c1OC	732236206	ORIBFYPWKFFGCK-UHFFFAOYSA-N	448.451	1.616	50	20	IDGD	
CC[C@@H](NC(=O)NNC(=O)c1cnn(-c2ccccc2)c1)c1cccc(S(N)(=O)=O)c1	733347261	RPTBEYFTNOUWBT-GOSISDBHSA-N	442.501	1.615	50	20	IDGD	
CCCS(=O)(=O)NC1CCN(C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)CC1	733349939	LJLWIEUUSPHAKT-UHFFFAOYSA-N	434.522	1.021	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)NCCC(=O)NNc2oc(C(C)C)nc2C#N)cc1	733359997	KEJJQQPAQBQCCS-UHFFFAOYSA-N	434.478	1.440	50	20	IDGD	
Cc1nc(N2CCOCC2)nc(O)c1CCC(=O)NNc1ncccc1C(F)(F)F	740097658	OEWAFCAVLDXRPE-UHFFFAOYSA-N	426.399	1.817	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNS(=O)(=O)c2ccc(C(=O)OC)c(C)c2)cc1	741646134	GCETXAMMKJKIEQ-CQSZACIVSA-N	436.486	1.957	50	20	IDGD	
CCS(=O)(=O)NCc1ccc(C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)cc1	743288638	FXCMSNCVCXXKKR-UHFFFAOYSA-N	427.486	1.591	50	20	IDGD	
NS(=O)(=O)c1ccc(CCC(=O)NNC(=O)c2cc(Br)ccc2O)cc1	743730906	HYVXQVREDAYOCC-UHFFFAOYSA-N	442.291	1.196	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)CN2C(=O)N[C@](C)(c3ccc(F)cc3)C2=O)cc1	743826645	LECAEGXWSUOIPG-OAQYLSRUSA-N	442.451	1.512	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)Nc2ccnn2[C@@H]2CCS(=O)(=O)C2)c1C	744378183	JWQIGIUMNXODQR-UWKDKTGGSA-N	431.518	1.853	50	20	IDGD	
COC(=O)c1c(CC(=O)OCC(=O)NNC(=O)c2cccc(C)c2)[nH]c(C(C)=O)c1C	744521579	QLCBLCNSCCRBIG-UHFFFAOYSA-N	429.429	1.168	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1ccc(Cn2cccn2)cc1	744618826	DRNGSTBGGBRDFH-UHFFFAOYSA-N	441.513	1.709	50	20	IDGD	
O=C1CCc2cc(C(=O)NNc3ccccc3S(=O)(=O)N3CCOCC3)ccc2N1	744620837	PBTXAJOJGKMZCL-UHFFFAOYSA-N	430.486	1.349	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(CN3CCCCC3=O)cc2)cc1	744726637	TUYICZDHYGCKEQ-UHFFFAOYSA-N	434.452	1.689	50	20	IDGD	
Cn1ccnc1[C@H](NC(=O)NNC(=O)c1cc([N+](=O)[O-])ccc1O)c1ccc(F)cc1	745387909	DBPQTEUKYIYPHS-MRXNPFEDSA-N	428.380	1.907	50	20	IDGD	
COc1ccnc(NNC(=O)CNC(=O)[C@H]2c3ccccc3C(=O)N2Cc2ccccc2)n1	745843804	UUKAROAVHKWCEH-HXUWFJFHSA-N	446.467	1.442	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)Oc1ccccc1Cl	745886576	HEQAQBIQIBULEJ-LBPRGKRZSA-N	429.864	1.998	50	20	IDGD	
C[C@@H]1C[C@H](NC(=O)NNC(=O)c2ccc(Cl)cc2Cl)C(=O)N1c1cnn(C)c1	745916556	CSFJBVKLRBIZBN-OTYXRUKQSA-N	425.276	1.865	50	20	IDGD	
Cc1nc(C(=O)NNC(=O)c2cc(-c3ccccc3)on2)nn1-c1n[nH]c(C(F)(F)F)n1	747354010	PAQJTSJZWAWRDG-UHFFFAOYSA-N	447.337	1.442	50	20	IDGD	
C[C@@H](CN1CCCC1=O)NC(=O)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1	747979962	OCSWRCXLFQJWMF-AVRDEDQJSA-N	449.555	1.955	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)c2ccc(S(=O)(=O)CCCC#N)cc2)c1	748167000	QRTOUKULWKVHBO-UHFFFAOYSA-N	431.470	1.856	50	20	IDGD	
CN1CCC[C@@H](NC(=O)NNC(=O)COc2ccc(OCc3ccccc3)cc2)C1=O	748664405	JPQKGXXAJDEECH-LJQANCHMSA-N	426.473	1.596	50	20	IDGD	
O=C(NNc1ccc([N+](=O)[O-])cc1Cl)c1ccc(S(=O)(=O)N2CCOCC2)o1	748732147	ARBKGYRKLFYQIT-UHFFFAOYSA-N	430.826	1.619	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(C(=O)NCC(=O)NNc2ccc(C#N)cc2)cc1	749267765	MNXGIWLDFODFDO-UHFFFAOYSA-N	429.502	1.462	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)c1	749400862	OGSSZZMXBQYOGN-UHFFFAOYSA-N	431.430	1.401	50	20	IDGD	
Cc1cc(S(N)(=O)=O)cc(C(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)c1C	751834971	HDYAKBZRHNEHDL-UHFFFAOYSA-N	439.877	1.222	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCCn2c(O)nc3ccccc32)nc1	753036107	AMMAVWJATGHKJD-UHFFFAOYSA-N	447.521	1.494	50	20	IDGD	
COC1(C(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)CCCC1	754174716	WCVFVKMMZDOARY-UHFFFAOYSA-N	431.514	1.885	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)c1cccc(I)c1O	754846765	UACFLQCFHDITSJ-UHFFFAOYSA-N	430.173	1.976	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc(OC)c1	755374377	NPIUPLLNDPBQKE-UHFFFAOYSA-N	448.501	1.955	50	20	IDGD	
C[C@@H]1CN(S(=O)(=O)c2ccc(NC(=O)NNC(=O)c3ccccc3O)cc2)C[C@@H](C)O1	755423054	NOSTVJLJXYDGSG-ZIAGYGMSSA-N	448.501	1.657	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)Nc2ccc(NC(=O)CN3CCOCC3)cc2)cc1	755598620	IPKGXHBPDAZQJL-UHFFFAOYSA-N	425.489	1.986	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)Nc2ccc(CN3C(=O)CCC3=O)cc2)c2ccccc2c1=O	755661460	IAKYTHPAWOGQLA-UHFFFAOYSA-N	448.439	1.049	50	20	IDGD	
CC(C)(C)S(=O)(=O)N1CCC(NC(=O)NNC(=O)COc2ccc(F)cc2)CC1	755897588	XKNRXNLCMYRMKC-UHFFFAOYSA-N	430.502	1.128	50	20	IDGD	
CCc1c(NC(=O)C(=O)NNC(=O)CNC(=O)c2cccs2)cnn1CCC(C)C	756188265	BRZZPTMXZOOURO-UHFFFAOYSA-N	434.522	1.069	50	20	IDGD	
CCN1CCN(C(=O)c2ccc(NC(=O)NNC(=O)COc3ccc(F)cc3)cc2)CC1	756254005	YSBDCUFKRAJMBJ-UHFFFAOYSA-N	443.479	1.835	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccccc2SCCC(N)=O)c1	756365541	XQFUWYHCZJYZJI-UHFFFAOYSA-N	436.515	1.524	50	20	IDGD	
COC(=O)c1ccc(NC(=O)NNC(=O)c2cc(Br)c[nH]2)cc1C(=O)OC	756819959	YYTXIDOXUOAGCY-UHFFFAOYSA-N	439.222	1.817	50	20	IDGD	
CC1CCN(c2ccc(C(=O)NNC(=O)C(=O)Nc3ccccn3)cc2[N+](=O)[O-])CC1	758838308	HNKZJMTULXUREN-UHFFFAOYSA-N	426.433	1.626	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)[C@@H]1CCCN(C(=O)Cc2ccccc2)C1	760438932	AMUSNBRHWBIEQD-QGZVFWFLSA-N	432.521	1.530	50	20	IDGD	
CCn1c(=O)n(CC)c2nc(NC(=O)CCC(=O)NNC(=O)c3scnc3C)ccc21	761155987	MFZWZFLRJKMUIF-UHFFFAOYSA-N	445.505	1.183	50	20	IDGD	
COCCOc1cc(NC(=O)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)ccc1OC	763468669	QMOUCVHBNZKFOA-UHFFFAOYSA-N	432.389	1.028	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(NC(=O)[C@@H](C)OC)c2)cc1OC	763550641	ORIZOFRYHXEBBO-GFCCVEGCSA-N	444.444	1.077	50	20	IDGD	
O=C(COc1cccc(C(F)(F)F)c1)NNC(=O)C(=O)Nc1ccc(-c2ncon2)cc1	763639585	OZAKVCLRZHLMHS-UHFFFAOYSA-N	449.345	1.920	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1c(C)nn(-c2ccccc2)c1C	763662816	AIAKLEUOTOOFIT-UHFFFAOYSA-N	437.456	1.663	50	20	IDGD	
Cc1ccc(Cn2nccc2NC(=O)C(=O)NNC(=O)COc2ccccc2F)s1	763683212	XLHJATJIINOXME-UHFFFAOYSA-N	431.449	1.605	50	20	IDGD	
Cn1cnnc1-c1cccc(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)c1	763728357	LOKPPVNFVOWEIN-UHFFFAOYSA-N	433.472	1.021	50	20	IDGD	
Cc1ccccc1-n1nccc1NC(=O)C(=O)NNC(=O)COc1ccccc1[N+](=O)[O-]	763803865	OORNDFPFNMRHJL-UHFFFAOYSA-N	438.400	1.254	50	20	IDGD	
CCc1nc2cc(NC(=O)C(=O)NNC(=O)COc3ccccc3[N+](=O)[O-])ccc2o1	763804474	UJVRTXWMLWNECX-UHFFFAOYSA-N	427.373	1.463	50	20	IDGD	
CNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Br)s2)cc1	763941242	WZJMQYAOMYYGLU-UHFFFAOYSA-N	425.264	1.270	50	20	IDGD	
Cc1nc(-c2cccc(NC(=O)C(=O)NNC(=O)c3cc(Br)cn3C)c2)n[nH]1	764002393	LZIBFKLTAGKDIO-UHFFFAOYSA-N	446.265	1.281	50	20	IDGD	
C[C@@H](c1cc(Cl)ccc1Cl)n1nccc1NC(=O)C(=O)NNC(=O)c1cnccn1	764033929	ZSLIMUBOATZOGW-JTQLQIEISA-N	448.270	1.989	50	20	IDGD	
Cc1nc(N2CCOCC2)ccc1NC(=O)C(=O)NNC(=O)Cc1cccc2ccccc12	764036858	QSIIPCXCOYDRQI-UHFFFAOYSA-N	447.495	1.708	50	20	IDGD	
Cc1cc(Br)ncc1NC(=O)C(=O)NNC(=O)c1ccc(Cl)cc1O	764124170	DTLZSCSNZYFOPG-UHFFFAOYSA-N	427.642	1.911	50	20	IDGD	
O=C(CC1CC1)NNC(=O)C(=O)Nc1cccc(Oc2ncc(Br)cn2)c1	764144002	SOIWOKLJWNYHFM-UHFFFAOYSA-N	434.250	1.917	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccoc2)n([C@H]2CCN(Cc3ccccc3)C2)n1	764164660	XNPAOTKDVYZANL-SFHVURJKSA-N	436.472	1.631	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(CCC(=O)N3CCCC3)cc2)c1	764241853	MDNZQCRDINMVSK-UHFFFAOYSA-N	433.468	1.513	50	20	IDGD	
N#CCc1ccc(OCc2ccccc2NC(=O)C(=O)NNC(=O)Cc2cc[nH]n2)cc1	764292440	ASYPDFUCLRABKK-UHFFFAOYSA-N	432.440	1.383	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C(=O)Nc1ccc(C(=O)N(C)C)cc1OC)c1ccccc1	764327602	CLKNWNIYJSWHSJ-INIZCTEOSA-N	426.473	1.677	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cc([N+](=O)[O-])ccc3C)CC2)cc1	765754409	KAWROMPHXXFZTI-UHFFFAOYSA-N	425.489	1.790	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@]1(C)CCCC[C@H]1C(=O)NNC(=O)CNC(=O)c1cccnc1	766229959	ZCFMQKKVRJZNIY-BTYIYWSLSA-N	433.509	1.432	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCC[C@H](c3n[nH]c(C4CC4)n3)C2)cc1OC	766255415	AGKHABUFYKQPJR-HNNXBMFYSA-N	428.493	1.340	50	20	IDGD	
Cc1nc(-c2ccccc2)ncc1C(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	767638985	ZREMZLBXUYDOSB-UHFFFAOYSA-N	435.396	1.978	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)NC1CCN([C@@H]2CCCC[C@H]2O)CC1	767946910	HQISUCYLOFZSIV-WOJBJXKFSA-N	426.521	1.584	50	20	IDGD	
Cc1cccc(N2CCN(S(=O)(=O)CC(=O)NNc3ccc([N+](=O)[O-])cc3)CC2)c1	768243566	HUJSGUSVSQGSII-UHFFFAOYSA-N	433.490	1.498	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNS(=O)(=O)c2ccc(C(=O)O)c(F)c2)cc1	768496080	JXJLQDJIDZIVSH-NSHDSACASA-N	426.422	1.700	50	20	IDGD	
CC(C)CC(=O)NCCc1ccc(S(=O)(=O)NNC(=O)CCc2ccco2)s1	769624977	OXJZFNBMNMFODR-UHFFFAOYSA-N	427.548	1.988	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)NC3CCN(Cc4ccncc4)CC3)nc21	770351437	RCRDDYAKTVIOOK-UHFFFAOYSA-N	439.524	1.973	50	20	IDGD	
CCN1CCN(c2cccc(NC(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)c2)CC1	771271804	IPFRAVQEIVKTCW-UHFFFAOYSA-N	445.545	1.699	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)/C=C\c2ccc(OC)c(O)c2)c1	771845513	MCPIELRPPCLRHS-BENRWUELSA-N	447.513	1.906	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)c1cc(I)ccc1O	771868062	NNRRLKCPWDHMKS-SECBINFHSA-N	434.230	1.736	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)CSCC(=O)Nc1cccc(Br)c1	772041994	OJBQDFURBLWJIY-JTQLQIEISA-N	446.323	1.610	50	20	IDGD	
COc1cccc(-c2nc(C)c(C(=O)OCC(=O)NNC(=O)c3ccc(C#N)cc3)[nH]2)c1	772080999	IDAPWSGOWNXTAR-UHFFFAOYSA-N	433.424	1.883	50	20	IDGD	
CCn1c(=O)c(=O)[nH]c2cc(C(=O)NNC(=O)[C@@H](C)Oc3cccc(Cl)c3)ccc21	772964040	OESZLFWSACDREV-LLVKDONJSA-N	430.848	1.592	50	20	IDGD	
Cc1oc(C(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)cc1S(=O)(=O)N(C)C	772972317	UCZUVHDNLZPJAR-NSHDSACASA-N	429.882	1.720	50	20	IDGD	
C[C@H](NC(=O)c1n[nH]c2ccccc12)C(=O)NNC(=O)[C@H](C)Oc1cccc(Cl)c1	772991625	WPDGOWDKJUJICZ-RYUDHWBXSA-N	429.864	1.950	50	20	IDGD	
Cc1ccc(-n2nccc2NC(=O)C(=O)NNC(=O)c2cc3ccccc3cc2O)nn1	773493342	ZYZMWLILWBZHKR-UHFFFAOYSA-N	431.412	1.229	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)ncc1Br	773529006	QIRZQMCPBKRVMY-SNVBAGLBSA-N	439.241	1.845	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)C(=O)Nc1ccc(OCC(F)F)c(C(F)(F)F)c1	773549401	HHAYSLKEYPIBEL-UHFFFAOYSA-N	435.309	1.781	50	20	IDGD	
CCCc1nc(C)c(NC(=O)C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)s1	777141455	LMZLDUXMTYDDOO-UHFFFAOYSA-N	428.474	1.051	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Cc2n[nH]c3c2CCCC3)c1	777177868	KQBSMWWUHDJXCY-UHFFFAOYSA-N	433.534	1.323	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cccc(CC(=O)OC)c2)c1	777766453	LPCRQJSZWDOPDB-UHFFFAOYSA-N	447.513	1.507	50	20	IDGD	
CC(C)NC(=O)Nc1cccc(C(=O)N2CCN(S(=O)(=O)CBr)CC2)c1	777777615	NFPVUWJYOLJNAV-UHFFFAOYSA-N	447.355	1.657	50	20	IDGD	
O=C(NNC(=O)[C@@H](F)Cc1ccccc1)c1cccc(S(=O)(=O)N2CCOCC2)c1	777880666	HAGUGBUMCPIEEX-SFHVURJKSA-N	435.477	1.049	50	20	IDGD	
CC[C@H](C)n1nc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1C	777882024	WCQPBIWOUVSLRI-AWEZNQCLSA-N	449.533	1.258	50	20	IDGD	
CCOC(=O)N1CCC([C@@H](C)NCC(=O)NNC(=O)c2cc(Cl)ccc2OC)CC1	778226113	JJZMCJCGMYYHBE-CYBMUJFWSA-N	440.928	1.956	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@H](O)[C@@H](O)c2nc3ccccc3s2)ccc1OC(C)C	779488688	ICBCZCCFVYODNT-QZTJIDSGSA-N	445.497	1.948	50	20	IDGD	
COc1cccc(NNC(=O)[C@@H]2CCCCN2S(=O)(=O)c2ccc([N+](=O)[O-])cc2)n1	780771861	FKVFYFQCHKGGDX-HNNXBMFYSA-N	435.462	1.685	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)NCc2ccccc2CN2CC[C@H](O)C2)c1	781836438	YFTZHWUAYOXYKI-SFHVURJKSA-N	428.489	1.415	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)Cc2ccc(C(=O)NNC(=O)NC[C@@H](C)C#N)cc2)cc1	781952543	WBAJTAWBHOEZCU-INIZCTEOSA-N	443.529	1.919	50	20	IDGD	
C[C@H]1CCCN(S(=O)(=O)c2ccc(CNS(=O)(=O)CBr)cc2)C1	782421609	SBUDKBMNDQWWGO-LBPRGKRZSA-N	425.370	1.879	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)ccc1OC(C)C	782892326	BXHQVSMPJWDFSX-UHFFFAOYSA-N	439.472	1.698	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)(F)F)cc1)C(=O)Nc1cnn(C(F)F)c1	783408948	OKOOIFJFSMQMHO-UHFFFAOYSA-N	427.311	1.654	50	20	IDGD	
COC(=O)CCSCc1cccc(NC(=O)C(=O)NNc2ccnc(N(C)C)n2)c1	784971211	VXXIVTMXDDHYMR-UHFFFAOYSA-N	432.506	1.421	50	20	IDGD	
COc1ccc(Cl)cc1NC(=O)C(=O)NNc1c(OC)cccc1S(C)(=O)=O	785331276	RSYNJSFSQUQWNG-UHFFFAOYSA-N	427.866	1.843	50	20	IDGD	
COc1ccc(S(=O)(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)c(C)c1	788915411	KROWDZZJABLKGS-UHFFFAOYSA-N	442.538	1.801	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)CNS(=O)(=O)c1ccc(Cl)cc1	789908291	MKKRXYQXMYHWIP-UHFFFAOYSA-N	432.285	1.742	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)c2cnn3c2C[C@H](CNC(C)=O)CC3)cc1	792736837	RPGDXXNHBGVDRO-GOEBONIOSA-N	443.504	1.209	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)Cc2ccc(S(=O)(=O)N(C)C)cc2)cc1	792809733	OTBKKWMJRMHXCR-HNNXBMFYSA-N	449.529	1.493	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)[C@@H]1CCS(=O)(=O)c2ccccc21	792815328	BDKWLMYZLVPMDF-QGZVFWFLSA-N	430.482	1.189	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)nc1Br	793024970	IPSSVYLIXXAOFA-UHFFFAOYSA-N	443.261	1.738	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)c2nnn(Cc3cc(C)no3)c2C)cc1	794201063	RDNFWZRPXQHDGH-CQSZACIVSA-N	428.449	1.558	50	20	IDGD	
Cc1nn(CC(F)(F)F)c(C)c1CC(=O)NNc1ccccc1S(=O)(=O)N(C)C	795160611	FVWJHNCQFUBOMB-UHFFFAOYSA-N	433.456	1.998	50	20	IDGD	
COC(=O)c1cc(F)cc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)on2)c1F	796999084	NLBJQAZONOHZOI-UHFFFAOYSA-N	444.350	1.806	50	20	IDGD	
O=C(CN1CCC(O)(c2scnc2Br)CC1)NNC(=O)c1ccccc1	797523596	PVVLQCHIOWRSSI-UHFFFAOYSA-N	439.335	1.650	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C2=C(C)N(C)c3ncnn3[C@H]2C)cc1Br	798962669	OTSPYPZVIFNSPW-JTQLQIEISA-N	435.282	1.795	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2NS(=O)(=O)C(F)(F)F)cc1	801109355	KOSAYIJIBVAEON-UHFFFAOYSA-N	444.391	1.656	50	20	IDGD	
COC(=O)c1ccccc1NNC(=O)c1ccc(F)c(S(=O)(=O)N2CCOCC2)c1	801181576	AGICIHMZUNYFFZ-UHFFFAOYSA-N	437.449	1.390	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2nccn2-c2ccccc2)cc1	801757485	SFEPZPMPTLKLRL-UHFFFAOYSA-N	442.501	1.654	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)c2cnc3nc(O)nc(O)c3c2)cc1Cl	802073653	NTDVHABMZQQJEK-UHFFFAOYSA-N	434.796	1.573	50	20	IDGD	
CCOC(=O)C(C)(C)CC(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	805191791	QWGDPWGPIYMVQR-UHFFFAOYSA-N	438.956	1.584	50	20	IDGD	
COc1ccc(-c2nn(CCC#N)cc2/C=C(/C#N)C(=O)NCc2cnn(C)n2)cc1OC	805207762	YLRPFATVODJPMG-SXGWCWSVSA-N	446.471	1.833	50	20	IDGD	
COc1ccc(CN2CC[C@@H](NC(=O)NNc3nc(C)cc(OC)n3)C2=O)c(OC)c1	806029483	LAXQXCQXDLDPBH-OAHLLOKOSA-N	430.465	1.238	50	20	IDGD	
Cc1ccccc1N1CCN(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)CC1	807130098	PGHNRGLDTFYXPL-UHFFFAOYSA-N	430.534	1.465	50	20	IDGD	
CCOc1cc2c(cc1CNC(=O)NNC(=O)c1ccc(-n3cnnn3)cc1)O[C@H](C)C2	807137398	KVKCHGKSGRSTLK-CYBMUJFWSA-N	437.460	1.529	50	20	IDGD	
COc1ccnc(NNC(=O)NCc2cccc(N3C(=O)N[C@](C)(C4CC4)C3=O)c2)n1	807236399	LEQLHPQTWRABOE-HXUWFJFHSA-N	425.449	1.536	50	20	IDGD	
Cc1cc([N+](=O)[O-])ccc1NNC(=O)C(=O)Nc1ccc(N2C[C@H](C)O[C@@H](C)C2)nc1	807455129	FWAVHGWXCJXUFG-KBPBESRZSA-N	428.449	1.994	50	20	IDGD	
CC(=NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1)c1cccc(-n2ccnn2)c1	807977017	XNHVJJNAHRFVIG-UHFFFAOYSA-N	431.500	1.566	50	20	IDGD	
COC(=O)c1cn(-c2cccc(NC(=O)NNC(=O)COc3ccc(C#N)cc3)c2)nn1	812979270	DCLBZGQUDGZVEE-UHFFFAOYSA-N	435.400	1.157	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccc(OCC(F)F)cc2)cc1	813033542	YLSYZWBDWQWMBS-UHFFFAOYSA-N	442.444	1.663	50	20	IDGD	
CCn1nncc1C(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2Cl)c1	814697877	GQAZUYYINFWCSD-UHFFFAOYSA-N	448.892	1.827	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1)NNC(=O)c1cccc(Cl)c1	815268949	WSZHLRJPLVDMMC-UHFFFAOYSA-N	445.863	1.467	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2cccc3cccnc23)nnn1Cc1ccccc1F	815568616	OPWMDDGGFZCPEP-UHFFFAOYSA-N	447.430	1.722	50	20	IDGD	
O=C(NNc1ncncc1F)C(=O)Nc1cc(Br)ccc1N1CCOCC1	815763944	JJCAKYRISMNHCX-UHFFFAOYSA-N	439.245	1.297	50	20	IDGD	
O=C(NNc1ncncc1F)C(=O)Nc1cc(F)c(F)cc1I	815764546	LLMOFXRINHVOCO-UHFFFAOYSA-N	437.119	1.580	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)c2ccc(N3C(=O)CCC3=O)cc2)c2ccccc2c1=O	824473928	BXIIYCMULDKYRS-UHFFFAOYSA-N	447.451	1.706	50	20	IDGD	
COC(=O)c1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)cn1	871046212	VXFCTQTVUXAFLU-UHFFFAOYSA-N	446.485	1.118	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)CN1C(=O)[C@@H]2[C@@H](C1=O)[C@H]1C=C[C@H]2C1	912601342	ZIIDAQLYYMHCQD-BKRLDNPDSA-N	433.464	1.562	50	20	IDGD	
O=C(NNC(=O)[C@H]1CSCCS1)c1cccc(S(=O)(=O)N2CCCCC2)c1	912643223	JTXVIWQLIVHBEU-OAHLLOKOSA-N	429.589	1.471	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NCc3ccccc3Cl)nc2)CC1	915884133	NCYNIRNEVHBWHZ-UHFFFAOYSA-N	438.941	1.497	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)NCCN1CCN(Cc2ccccc2)CC1	915901359	HQGCEVRRIBVMEG-UHFFFAOYSA-N	436.516	1.085	50	20	IDGD	
C#CCOc1ccccc1C=NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	916258492	BYCYYFBGAXOFPG-UHFFFAOYSA-N	427.482	1.483	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCCOc2ccc3c(c2)OCO3)nc1	916647232	UYVJHTAYMMYPQM-UHFFFAOYSA-N	437.478	1.202	50	20	IDGD	
CCOc1ccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1OC	916970237	NEJCEIMMWWUYIZ-UHFFFAOYSA-N	436.490	1.811	50	20	IDGD	
COc1cccc(NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1OC	916971786	BONRXBGXAOYFSU-UHFFFAOYSA-N	448.501	1.955	50	20	IDGD	
Cc1cc(C)c(S(=O)(=O)NNC(=O)NC2CCCCC2)c(C)c1NS(C)(=O)=O	917720818	NXNAMJORMQKPHV-UHFFFAOYSA-N	432.568	1.809	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNS(=O)(=O)c2ccc(Cl)cc2C)cc1	917721054	OLZBFGFVUCHEIC-UHFFFAOYSA-N	445.950	1.587	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCC(=O)Nc2ccc(Cl)cc2)cc(OC)c1OC	919783530	RNNHAYQJEHZMJT-UHFFFAOYSA-N	436.852	1.949	50	20	IDGD	
CCN(Cc1ccccc1)C(=O)CNC(=O)NNC(=O)COc1ccccc1[N+](=O)[O-]	920052154	ZXGAILIFQBGKAZ-UHFFFAOYSA-N	429.433	1.353	50	20	IDGD	
Cn1cc(C=NNC(=O)Cn2nnc(-c3ccccc3)n2)c(-c2ccc([N+](=O)[O-])cc2)n1	920362092	KVDLHSSGCQZHOS-UHFFFAOYSA-N	431.416	1.799	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)Nc2ccc3c(c2)C(=O)NC3=O)nc1	920929947	WOKGROUIDIZVSZ-UHFFFAOYSA-N	432.462	1.144	50	20	IDGD	
Cc1cccc(NC(=S)NNC(=O)c2cc(S(=O)(=O)N3CCSCC3)c[nH]2)c1	921091472	JLMXJEWVLBHRQB-UHFFFAOYSA-N	439.588	1.692	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(OC)c(C(=O)NNC(=O)c2n[nH]c3c2CCCC3)c1	1115842028	WSBQATPLDBBYGT-UHFFFAOYSA-N	449.533	1.402	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@H]2CCCCN2Cc2cccnc2)cc(OC)c1OC	1116024954	GGJZMJXFOSIURJ-QGZVFWFLSA-N	428.489	1.923	50	20	IDGD	
O=C(NNC(=O)c1cccc(Br)c1)N[C@H]1CCO[C@@]2(CCS(=O)(=O)C2)C1	1319833401	WFUUHPFYFFUKDZ-BBRMVZONSA-N	446.323	1.129	50	20	IDGD	
CCOC(=O)c1ccc(NNC(=O)c2ccc(S(=O)(=O)N(C)CCO)cc2)cc1C	1330202997	RQUHTBUWBFNSGI-UHFFFAOYSA-N	435.502	1.541	50	20	IDGD	
Cn1nc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)c2c1CCC2	1777963643	TZVSNJSSKRWRMA-PBHICJAKSA-N	429.290	1.043	50	20	IDGD	
COc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](F)Cl)C2)n1	1778025807	GIOSJAAHCDWUKC-CDHAZOANSA-N	444.847	1.660	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)[C@H]2SC(=N)NC2=O)C1	1778085134	RHGNYYYDRWTAJM-QEAYJNAZSA-N	444.985	1.320	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2)c1cccc2cnccc12	1779078538	QPBQCLAHQZCSNX-NNMXDRDESA-N	431.920	1.962	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccc3nc(CO)[nH]c3c1)CCO2	1779295972	YQSFDSXJKAMDEU-OAQYLSRUSA-N	446.580	1.350	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1ccc(O)cn1)C2	1779545762	IUGVKIKYZLXVLQ-WIYYLYMNSA-N	435.597	1.695	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc3nn[nH]c3c1)C2	1779546451	YZJUOFRHKDSSSI-WIYYLYMNSA-N	445.596	1.937	50	20	IDGD	
COc1cc(C#N)cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](O)CCl)C3)c1	1780086069	BWEQOMQNTAGMRB-WAOWUJCRSA-N	435.908	1.294	50	20	IDGD	
C[Si](C)(C)c1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](F)Br)C3)C2)co1	1781331676	PCSXVKMPVQDLCA-WMLDXEAASA-N	447.377	1.959	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)n2ccnn2)C1	1781545976	BEUSFIRFEDQHFW-ATNYBXOESA-N	442.358	1.384	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)c3cccc4ccncc34)C2)C1	1782254011	PMWULMWPLJFWEO-QHCPKHFHSA-N	439.516	1.051	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H]3CC(c4ccccc4)=NN3)C2)C1	1782606600	WXMXNFGTBDQKNZ-GCJKJVERSA-N	432.952	1.848	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Cl)C2	1783104258	JGXPRRQOZSIBHT-FRIZHTMISA-N	435.924	1.950	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)CCCn3ccnc3C)CCO2)C1	1783354722	VBEMFQUIFRCEGA-VQIMIIECSA-N	441.370	1.975	50	20	IDGD	
Cc1ccc(CCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Br)C[C@@H]32)nc1	1785304709	AHQXKCYXZFNBML-MBGYTDRXSA-N	442.329	1.993	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)c1occc1Br	1787586503	DQSQDQNPAJDKAS-DJIHRAIXSA-N	435.702	1.235	50	20	IDGD	
Cc1cc(C(N)=O)cc(C)c1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Cl)C[C@@H]21	1788596299	DNJVEPVSDGDZIN-NZUILWFCSA-N	425.888	1.530	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCC(=O)N3CCCC3)C[C@@H]21)[C@H](F)Br	1789921606	RQBGSIWIHSUIOY-WSMBLCCSSA-N	448.333	1.059	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(O)ccc3O)[C@H]2C1	1790265148	MMPJAQPAOBPPEL-KHJVZFFJSA-N	427.295	1.475	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CC(c2ccccc2)=NO1	1793281248	OWLMZHDTNVCCOK-LMCLKVLCSA-N	435.908	1.023	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cn1cncn1)C2	1794142487	CWDLUNQJTWQVAB-XGUBFFRZSA-N	440.932	1.048	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2c(n1)NC(=O)CC2	1796106427	VIYUNGLGHZJXSJ-CCWDJLKJSA-N	446.580	1.021	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2n[nH]cc2c1	1796146999	KTMZXEPKIWXSPW-FIUQPQMISA-N	435.322	1.797	50	20	IDGD	
COc1ccc(Cl)c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)c1	1796190617	RABYRMMEKBELJL-BJWYYQGGSA-N	442.708	1.594	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CC(=O)N(Cc3cccs3)C1)C2)[C@@H](F)Cl	1796361499	GZLAMYRLGFAXJA-LVSLPLRBSA-N	443.928	1.221	50	20	IDGD	
Cc1cnc2c(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@H](C)Br)C4)cnn2c1	1797419814	VOYJHVQARHKSMC-XPCVCDNBSA-N	436.310	1.024	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1nnc(-c2ccccc2)o1	1797821511	CJPJMMZAVJFMNY-MHEUCROKSA-N	449.305	1.723	50	20	IDGD	
O=C(Cc1ccc(Br)nc1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2	1799031216	JHQBPLUPOQEVPJ-BAESOJJISA-N	434.693	1.511	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3cccnn3n1)C2	1799276745	KYIMSPMCXWAIQM-ABXQLRGKSA-N	426.304	1.169	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccn3nccc3c1)C2)[C@H](F)Br	1799350179	UKKFYAKQMSOGLV-NEBZKDRISA-N	425.258	1.228	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C#CC1CC1)C2)[C@H](Br)Cc1ccccc1	1800433438	LNAVLBXCYOCWBS-RCLSDMTESA-N	445.357	1.996	50	20	IDGD	
CC(C)(C)OC(=O)N1CC2(C[C@@H]2C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Cl)C3)C1	1800707610	GQUMJAPYQJHYFT-KHMAMNHCSA-N	445.919	1.367	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(Cl)cnc1O)C2	1800754073	DMEJRTWZKGCWPR-ORXSELOVSA-N	432.702	1.427	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN(C)C(=O)OC(C)(C)C)C2	1800757201	WLLLNHMDHNASQE-GUIRCDHDSA-N	448.358	1.226	50	20	IDGD	
Cc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)CBr)C3)c(O)c1	1801688969	ZPHZXUCPVVYCNN-ZJOBFFGXSA-N	425.323	1.935	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](CCN)NC(=O)OC(C)(C)C)C2	1802273965	TUWVRZMHXRFCBT-YIDVYQOGSA-N	446.976	1.121	50	20	IDGD	
CN(C)c1ccc(C(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)nc1	1803140063	ALRFNTVSUVNHGO-LZQZEXGQSA-N	431.924	1.462	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)c2cnco2)[C@H]1c1cccnc1	1803858020	CNRLBZSIERHGOB-RUVVGEKZSA-N	449.471	1.523	50	20	IDGD	
Cn1c(C(=O)NC[C@H]2CCN(C(=O)CCBr)[C@H]2c2cccnc2)cccc1=O	1805311256	VEDCOGIYFOXSIW-BEFAXECRSA-N	447.333	1.885	50	20	IDGD	
O=C(CCBr)NC[C@H]1CCN(C(=O)CCn2ccnn2)[C@H]1c1cccnc1	1806346236	CRMPPPLDFSUIHQ-QAPCUYQASA-N	435.326	1.554	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC2(CCCN(C(=O)/C=C/c3ccco3)C2)CC1	1807139657	OTDGDGKDXZKGCN-SNAWJCMRSA-N	437.500	1.836	50	20	IDGD	
N[C@H](CC(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)c1cccnc1	1807260444	OPHPYCQBEJUZQP-XFKSJGNHSA-N	431.924	1.172	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)cn1	1807361210	FHXKRDUETYCYGD-DENIHFKCSA-N	444.300	1.098	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)Cc2cnccn2)[C@@H]1c1cccnc1)[C@H](F)Br	1808649485	SEPCDANUXATQDC-XKQJLSEDSA-N	436.285	1.811	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H](CNC(=O)[C@H](F)Br)[C@@H]1c1cccnc1)n1ccnn1	1808679350	WKSSZMJLMKZYSZ-RZFFKMDDSA-N	439.289	1.631	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC2(CCCN(C(=O)CC(C)(C)O)C2)CC1	1809426901	UTFDYDQORGMQOU-LFVJCYFKSA-N	431.537	1.513	50	20	IDGD	
C#CCCCCC(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1	1810304208	ASPQOOSWXHXGEK-AVRDEDQJSA-N	448.527	1.593	50	20	IDGD	
CCC(C)(C)C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1	1810304522	DRQGZSVLDOQTPO-VQIMIIECSA-N	438.532	1.836	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)c1ccnc2ncccc12	1812156685	MKSCYUGCKXZPQC-IPELMVKDSA-N	439.903	1.944	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)CC(=O)NC)[C@H]1c1cccnc1	1812773557	HCINBMCFWIXQAB-KEYYUXOJSA-N	425.327	1.397	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)C23CC(C(=O)OC)(C2)C3)[C@@H]1c1cccnc1	1812837919	NHNJVEXMYULUOL-PCIKLCOZSA-N	449.935	1.685	50	20	IDGD	
Cc1nnc(CC(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@H](C)Br)CC3)o1	1815494886	GTBGSPHCALCVTG-IONNQARKSA-N	428.312	1.773	50	20	IDGD	
O=C(CC(F)(F)C(=O)O)Nc1nc2c(s1)C[C@H](NC(=O)CCBr)CC2	1817091236	OPMSYVUGUINFLW-SSDOTTSWSA-N	440.266	1.950	50	20	IDGD	
C=CCOCCCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1	1817470246	NBVVQQLRSWCRIW-LJQANCHMSA-N	440.309	1.378	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@H](F)Br)[nH]n1)c1cnc(O)nc1O	1818021534	YUPXPJFBTLLTJF-KOLCDFICSA-N	443.233	1.607	50	20	IDGD	
COC[C@@H](NC(C)=O)C(=O)Nc1cc([C@H]2CCCCN2C(=O)C(C)(C)CCl)[nH]n1	1819605653	FKAXDQHRZMGDOP-HUUCEWRRSA-N	427.933	1.818	50	20	IDGD	
COc1cc(C(=O)N[C@@H]2CCc3nc(NC(=O)CO[Si](C)(C)C)sc3C2)n(C)n1	1820160890	JAFQPKQTFKIELV-LLVKDONJSA-N	437.598	1.963	50	20	IDGD	
CC(=O)N/C(=C\c1ccco1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1	1821223525	WQEZMHFPSURPRU-DNQJIUQOSA-N	449.895	1.772	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](C)N2CCN(C)CC2)[nH]n1	1822374644	YLGZGVCMSNDDGA-ZOBUZTSGSA-N	440.976	1.292	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)/C=C/c2cnccn2)n[nH]1	1822875530	XCPGUYOGCXAQDV-LXXRFIIISA-N	440.508	1.278	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CN(C)C(=O)C(=O)O)CC1	1824615301	NRJLZTHVNDDJCL-HOTGVXAUSA-N	429.945	1.557	50	20	IDGD	
CC(C)n1nccc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830364672	OLMRCHJWQREOQN-HXUWFJFHSA-N	426.945	1.799	50	20	IDGD	
CC(C)[C@H](S)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1831492901	OKGINIFPCPYJTI-YWPYICTPSA-N	427.336	1.088	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)C(F)(F)C(F)F)CC1	1831871954	XKTQTFHUGXGSGP-CQSZACIVSA-N	438.466	1.880	50	20	IDGD	
Cc1cc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)n(C)n1	1831872004	KECZWLSRZSMADE-SFHVURJKSA-N	432.569	1.335	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)CNC(=O)C(F)(F)F)CC1	1831900662	TWGPFBWUBFDTAL-UONOGXRCSA-N	441.878	1.538	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)CCc2ccoc2)CC1	1832343655	SJKFAQQYVBPRRT-JOCHJYFZSA-N	438.333	1.826	50	20	IDGD	
O=C(/C=C/c1ccsc1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1833141858	QYYZLWUBPDWEPH-PHQDNCEWSA-N	447.326	1.908	50	20	IDGD	
Cc1nn[nH]c1C(=O)N1CCC(N2CCC(NC(=O)[C@H](C)CBr)CC2)CC1	1833263696	REKOFPZTLZRQMG-GFCCVEGCSA-N	441.374	1.329	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnc(OC)c(F)c3)CCO2)C1	1833485772	SFEKRFMUHHGGIY-LIRRHRJNSA-N	429.876	1.317	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccnc3)CCO2)C1	1834001109	LLZXGNQZAZPXHF-KBXCAEBGSA-N	426.311	1.183	50	20	IDGD	
C[C@@]1(C(=O)N2CCOC[C@@]3(CN(C(=O)CCBr)CCO3)C2)CC1(F)F	1834826370	MUTNLIMQULPIOG-LSDHHAIUSA-N	425.270	1.273	50	20	IDGD	
CC(=O)N(C)CCC(=O)N1CCC(N2CCC(NC(=O)CO[Si](C)(C)C)CC2)CC1	1835834993	KKMFIRUIKYEPEX-UHFFFAOYSA-N	440.661	1.278	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3cccnc3)CCO2)C1	1836158544	OTTKWSWVGRSUQJ-MOPGFXCFSA-N	430.332	1.317	50	20	IDGD	
C[C@@H](C(=O)N1CCC(N2CCC(NC(=O)[C@@H](F)Br)CC2)CC1)n1ccnc1	1836414078	VXNQNPPXVVBCMB-XJKSGUPXSA-N	444.349	1.706	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCC(OC2CCN(C(=O)CN3CCOCC3)CC2)CC1	1836623594	VBXNDZJHSHRUHQ-UHFFFAOYSA-N	429.989	1.582	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](C)CC(N)=O)CC2)CC1	1836670861	VLWLIGLPYQXXEU-UONOGXRCSA-N	446.386	1.528	50	20	IDGD	
CC(C)n1cnc(C(=O)N2CCC(OC3CCN(C(=O)[C@H](O)CCl)CC3)CC2)n1	1836718110	SDSPBNXKHIRVPG-MRXNPFEDSA-N	427.933	1.071	50	20	IDGD	
C[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1)N1C[C@@H]2C[C@H]2C1	1837287269	PPXWQTSHBLFIRH-OPOMMLRYSA-N	448.391	1.019	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(-c4ccccn4)[nH]n3)CCO2)C1	1838051213	DSHUVPFMPBEUIZ-BTYIYWSLSA-N	447.923	1.559	50	20	IDGD	
CC[S@@](=O)CCC(=O)N1CCC(OC2CCN(C(=O)C(Cl)Cl)CC2)CC1	1838362984	PSNLXSKWZDMCPD-AREMUKBSSA-N	427.394	1.947	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc4cccnn4n3)CCO2)C1	1838423223	JPVVDNUWYSINMS-OXJNMPFZSA-N	435.912	1.207	50	20	IDGD	
CC(=O)N/C(C)=C/C(=O)N1CCC(OC2CCN(C(=O)[C@H](F)Br)CC2)CC1	1838649084	WVZGMURQEHKSKL-FLVLSHQESA-N	448.333	1.715	50	20	IDGD	
O=C(CC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1)Nc1ccc(F)cc1	1839029543	RXVCELZROAPRRZ-PKOBYXMFSA-N	445.850	1.145	50	20	IDGD	
CC(C)[C@H](S)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2	1839150639	RVKPOBPLKJXIIP-XKQJLSEDSA-N	427.394	1.634	50	20	IDGD	
CC1(C)CCC(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)CC1	1839229905	WJAVHCCYRNFSFY-UWJYYQICSA-N	430.973	1.649	50	20	IDGD	
O=C(c1n[nH]c2c(Cl)cccc12)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1839495755	WFHMZTLDUOQULS-MAUKXSAKSA-N	445.278	1.821	50	20	IDGD	
Cc1nc2ccc(F)cn2c1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1839526784	XPDGQGHOGZQOEL-APWZRJJASA-N	442.850	1.386	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3oncc3C)C2)C1	1839966072	TZPMQAWEEPIKIE-SUMWQHHRSA-N	430.299	1.227	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)Cc3ccco3)C2)C1	1840036835	RNMQRIRQIFPOEN-DOXZYTNZSA-N	443.338	1.698	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)Cc3ccco3)C2)C1	1840036838	RNMQRIRQIFPOEN-VCBZYWHSSA-N	443.338	1.698	50	20	IDGD	
O=C(c1cnc2ccccc2n1)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840187710	RKCFQLHTQJKQNS-LJQANCHMSA-N	439.299	1.504	50	20	IDGD	
CN(CC(=O)N1CC2(CCCN2C(=O)C23CC(F)(C2)C3)C1)NC(=O)NCc1ccccc1	1841652826	HUDVVQRICZQYBU-UHFFFAOYSA-N	443.523	1.428	50	20	IDGD	
O=C(c1cc(Cl)c(F)cc1F)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843011892	HHAQYYCLXDWTEB-UHFFFAOYSA-N	434.635	1.429	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@](C)(C(=O)N2CC3(CCCN3C(=O)[C@@H](F)Cl)C2)[C@H](O)C1	1843363893	FGMFTDDSMSLONH-LPMFXHHGSA-N	447.935	1.732	50	20	IDGD	
CCc1cnc(C(=O)N2CCCC23CN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C3)s1	1844380870	IKKBRNCDFFTBSI-YDZHTSKRSA-N	428.518	1.657	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)Cc2cc3cccnc3cc2F)C1	1845141025	HNRWBZYJHAKPML-UHFFFAOYSA-N	447.275	1.113	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@H](CC(=O)OC)NC(=O)OC(C)(C)C)C1	1846213102	OYSLUFITJIMWSI-ZIAGYGMSSA-N	445.944	1.664	50	20	IDGD	
C#CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)[C@@H](F)Br)C2	1847071983	SBNJACREHGIGEF-CHWSQXEVSA-N	446.317	1.797	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C1(O)CCC1	1847253505	KLTOFOPWWRNUIW-UGUYLWEFSA-N	443.972	1.871	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H]1CN(C(=O)OC(C)(C)C)CCO1	1847640013	VNTWFTKFPTXZQO-UGUYLWEFSA-N	445.944	1.078	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NC[C@H](c1cccs1)N(C)C	9755643	FIYKNCKUFOHZOI-CYBMUJFWSA-N	438.579	1.597	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=S)NC(C)(C)C)CC2)cc1	14895370	HPJAMEJNDWDZGP-UHFFFAOYSA-N	440.591	1.584	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)COc2ccccc2C#N)c1	15978450	SXJMDTAZOGEGLB-UHFFFAOYSA-N	430.486	1.429	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCC(c3nc(-c4ccccn4)no3)CC2)n1	110728998	VDEKATJRPVCFSJ-UHFFFAOYSA-N	441.517	1.466	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Cn2cc(C)c3ccccc32)cc1	116237167	XLLCKILBPDSGHY-UHFFFAOYSA-N	428.514	1.726	50	20	IDGD	
COc1ccc(F)cc1CN1CCN(C(=O)NNC(=O)CNC(=O)c2cccs2)CC1	725872436	OWIAEZHAUDZNCB-UHFFFAOYSA-N	449.508	1.184	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)[C@H](C)NS(=O)(=O)c1ccc(C)cc1	726097788	PHLOGKGSHQMIQA-HNNXBMFYSA-N	443.529	1.422	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@H](C(=O)NNc3nc(-c4ccncc4)no3)C2)cc1	728072078	RVYWABFNDNXWMW-INIZCTEOSA-N	442.501	1.984	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)[C@H]1CCN(c2ccc(F)cc2)C1=O	728211287	QAGDABPQGNMHPY-GOSISDBHSA-N	432.477	1.763	50	20	IDGD	
O=C(CNc1ccccc1)NNC(=O)CN1C(=O)COc2cc(Br)ccc21	729513596	AUHICTBIUHEKKE-UHFFFAOYSA-N	433.262	1.434	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)c1ccc(S(=O)(=O)N2CCCCC2)cc1	730034075	QINWCGPWUPXXFG-UHFFFAOYSA-N	431.514	1.961	50	20	IDGD	
C[C@@H]1CCCN(S(=O)(=O)c2cc(C(=O)NNC(=O)Cc3cc[nH]n3)ccc2Cl)C1	730091501	CJTCQLRJBUJLFH-GFCCVEGCSA-N	439.925	1.487	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)NCc2ccc(C(=O)NNC(=O)C3CCC3)cc2)cc1	732143097	RGHBULPLQCMXHS-UHFFFAOYSA-N	444.513	1.685	50	20	IDGD	
CCCC(=O)N1CSC[C@H]1C(=O)NNc1ccccc1S(=O)(=O)NC(C)(C)C	734252295	MVBZVIJARHVSQR-AWEZNQCLSA-N	428.580	1.908	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)N[C@H]3CCN(C4CCN(C)CC4)C3)n[nH]2)cc1	734282729	CGSZZAJADRMEFE-KRWDZBQOSA-N	425.537	1.498	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)[C@@H]2CC(=O)N(C3CCCC3)C2)CC1	734824674	HJMOBMFVIAWGAK-CQSZACIVSA-N	437.541	1.507	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)C23CC4CC(CC(C4)C2)C3)CC1	735117663	FKDRUVYJVBXUGX-UHFFFAOYSA-N	433.578	1.677	50	20	IDGD	
O=C(COC1CCOCC1)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	735270616	UHCNSHBVYOMRKG-UHFFFAOYSA-N	439.515	1.506	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)N[C@@H]1CCN(c2cnn(C)c2)C1=O	735584524	WGFOFTBCHOEXFJ-IFXJQAMLSA-N	436.472	1.477	50	20	IDGD	
O=C(NNc1ccc(Cl)nn1)c1ccc2c(c1)S(=O)(=O)N(C[C@H]1CCCO1)C2=O	735686809	IASWHENCQSUAKU-LLVKDONJSA-N	437.865	1.210	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)c1ccccc1F)C(=O)NNc1ccc(Cl)nn1	735689110	KRTWQKXUIWOGTN-LLVKDONJSA-N	433.918	1.812	50	20	IDGD	
O=C(NNC(=O)c1ccn(-c2c(Cl)cc([N+](=O)[O-])cc2Cl)n1)C(=O)NC1CC1	736067295	KUUMQCBKLPNRPR-UHFFFAOYSA-N	427.204	1.127	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)NCc2ccc(N(C)C(=O)c3ccncc3)cc2)n1	737057606	SITVHWGMWUOVLG-UHFFFAOYSA-N	435.488	1.702	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)N[C@H](C)[C@@H]1CN(Cc2ccccc2)CCO1	741266676	LXEKYSRWYOLMMQ-APWZRJJASA-N	436.516	1.876	50	20	IDGD	
CS(=O)(=O)[C@H]1CCCCC1=NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	741458915	YZZWPVWVRVOSNS-KRWDZBQOSA-N	427.548	1.544	50	20	IDGD	
C[C@@H](CC(=O)c1cccc(Br)c1)C(=O)NNC(=O)CNC(=O)c1ccco1	741685146	PVLFVRMIRQMUJV-NSHDSACASA-N	436.262	1.828	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1cc(N2CCNC2=O)ccc1Cl	742066814	JAIYVJFSOXVFJS-UHFFFAOYSA-N	443.895	1.337	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2nccnc2NC(=O)C(C)(C)C)cc(OC)c1OC	742471771	HWUIYZYJXBHYDA-UHFFFAOYSA-N	431.449	1.562	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)[C@@H](C)NC(=O)c2cc3c(C)nn(C)c3s2)c(C)c1	743295898	SHVFPSAIAFSZHT-CQSZACIVSA-N	442.545	1.938	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2C(=O)Cn3c(cc4ccccc43)C2=O)cc1OC	743841864	AXEJXKGOCTUZGD-UHFFFAOYSA-N	436.424	1.102	50	20	IDGD	
Cc1ccc(N2CC[C@H](NC(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)C2=O)cc1	745857773	JPBHHUHHQQFEDY-KRWDZBQOSA-N	430.486	1.148	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)Oc1ccccc1F	745889833	KXIPHOQGDJEZBF-CYBMUJFWSA-N	438.481	1.488	50	20	IDGD	
CC(C)(C(=O)NNC(=O)[C@@H]1CN(Cc2nc(O)c3ccccc3n2)CCO1)c1ccccc1	746239164	FVPWPYKGOUWPLS-IBGZPJMESA-N	449.511	1.661	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)N[C@H]2CCCN(CC(F)(F)F)C2=O)cc1	746340140	VVVDOKMJQQBAKM-WFASDCNBSA-N	446.426	1.736	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)c2nc(C)n(-c3n[nH]c(C(F)(F)F)n3)n2)cc1	747348165	LHSFPZJIYHDDTP-UHFFFAOYSA-N	440.411	1.574	50	20	IDGD	
O=C(NNC(=O)c1ccccc1CSC1=NCCS1)N[C@H]1CCS(=O)(=O)C1	747366126	UOGFXYCPGGAXCJ-LBPRGKRZSA-N	428.561	1.154	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@](F)(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)C1	748310537	PMCXWFBENMFQOG-HXUWFJFHSA-N	436.488	1.190	50	20	IDGD	
COCCOc1ccc(Cl)cc1C(=O)NNC(=O)c1csc(N2CCOCC2)n1	748689389	MYCBSOXQVHZISC-UHFFFAOYSA-N	440.909	1.733	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)c1ccc(Br)c(S(C)(=O)=O)c1	749127197	WGJQEVTXPCKSLT-UHFFFAOYSA-N	441.303	1.865	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNS(=O)(=O)c2cc(F)cc(C(=O)O)c2)cc1	749143438	UXRUVZAQDNBRSR-NSHDSACASA-N	426.422	1.700	50	20	IDGD	
CC[C@H](C(=O)N1CCC(NC(=O)NN[C@@]2(C)CCS(=O)(=O)C2)CC1)c1ccccc1	749191543	SULPIUXUVIGUQJ-RXVVDRJESA-N	436.578	1.552	50	20	IDGD	
Cc1nccn1CCNC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	749214853	HLBOHPQGQARLKW-UHFFFAOYSA-N	448.530	1.698	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)cc1OC	749317776	VWRVVGUYTXNBJM-UHFFFAOYSA-N	442.384	1.711	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)Cc1csc(-c2ccc3c(c2)OCO3)n1	751199740	RPLSNAZOAHTRFQ-UHFFFAOYSA-N	428.426	1.252	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)N1CCC[C@H]1C(=O)NNC(=O)CNC(=O)c1ccco1	751202060	OZHUYWSENUIYTI-AWEZNQCLSA-N	448.863	1.124	50	20	IDGD	
COCCCOc1cccc(CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)c1	752127849	WTXQHOTWSWLQSH-UHFFFAOYSA-N	449.533	1.539	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)N[C@@H]1[C@@H]2CCO[C@H]2C12CCC2	754672447	CBQLZTLSYZSFAM-CEWLAPEOSA-N	427.549	1.487	50	20	IDGD	
Cc1cc(S(=O)(=O)Nc2ccccc2C(=O)NNC(=O)Cc2cc[nH]n2)ccc1F	755284538	SMHNBGCFSJAOBN-UHFFFAOYSA-N	431.449	1.662	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)c1c(C)c2cc(Br)ccc2oc1=O	755399375	GGTCEWGMZDYEAJ-UHFFFAOYSA-N	438.278	1.930	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)NNC(=O)Nc1ccc(CC(=O)N2CCOCC2)cc1	755861130	BDUFEQLKSNDQAX-UHFFFAOYSA-N	435.484	1.965	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)N[C@@H](C)CNC(=O)OC(C)(C)C)nc1	755976263	WALVZAGCBRCJCM-LBPRGKRZSA-N	430.531	1.308	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)CN2CCC[C@@H](NC(=O)c3cc4ccccc4o3)C2)cc1	756039162	JAKTXEPASLEDJH-LJQANCHMSA-N	445.479	1.960	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)Nc1cccc(N2CCS(=O)(=O)CC2)c1	756207558	RVACGSYKOCOYLH-UHFFFAOYSA-N	442.501	1.344	50	20	IDGD	
Cc1ccc(C(N)=O)cc1NC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	756259492	LMQAAZWWMXYCAV-UHFFFAOYSA-N	445.501	1.345	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)Nc1ccc2[nH]ccc2c1	756298555	ZKMWYWOPRKINKP-UHFFFAOYSA-N	443.485	1.655	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)c1ccc(Oc2ccc(Cl)cc2)c(F)c1	758046500	SUPUDHSDCAVTIQ-SNVBAGLBSA-N	429.857	1.970	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H](C#N)[C@H](NC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)C1	758768034	HRKWHEHTSCUPON-WMLDXEAASA-N	439.476	1.575	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)/C=C/c3ccc(Cl)nc3)cc2)CC1	759660801	NCFYTJYOVIVRGC-YCRREMRBSA-N	435.937	1.828	50	20	IDGD	
Cc1c(C(=O)NNc2nccc(N3CCOCC3)n2)cnn1CCO[C@@H]1CCCCO1	760173434	PPIFURREZFKIOZ-GOSISDBHSA-N	431.497	1.118	50	20	IDGD	
Cc1ccnc(-n2nccc2NC(=O)C(=O)NNC(=O)c2cc(C)nc3ccccc23)c1	760278905	IGOXBDZEHMFWNE-UHFFFAOYSA-N	429.440	1.832	50	20	IDGD	
COc1c(C)c2c(c(O)c1C/C=C(/C)CCC(=O)NNC(=O)C(=O)NC1CC1)C(=O)OC2	760786838	FECJEXNVZPXTEM-WCIBSUBMSA-N	445.472	1.075	50	20	IDGD	
COC(=O)c1ccccc1NNC(=O)CCNC(=O)[C@@H]1CCCN1C(=O)OC(C)(C)C	760931676	RUAREZCEJMSNAD-INIZCTEOSA-N	434.493	1.822	50	20	IDGD	
COCc1nc(OC)c2c(C)c(C(=O)NNC(=O)COc3ccc(C#N)cc3)sc2n1	761524193	XNPJDZNQIQZALP-UHFFFAOYSA-N	441.469	1.866	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)CC(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)cc1F	762937295	IHLNWZIJVWGAHU-UHFFFAOYSA-N	444.444	1.653	50	20	IDGD	
CS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2c[nH]c3ccccc23)cc1Cl	763534488	GUXIUNKLABQYJY-UHFFFAOYSA-N	449.876	1.593	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCc1cnn(CC(F)(F)F)c1	763536791	DYIYIRDUXYVJJE-UHFFFAOYSA-N	447.443	1.191	50	20	IDGD	
COC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)c1	763539418	LUFUAULUUHJEPJ-UHFFFAOYSA-N	446.416	1.290	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cc(CC(C)C)nn2C)cc(OC)c1OC	763539500	MKPNNERIDXZVBT-UHFFFAOYSA-N	433.465	1.044	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2cc(S(C)(=O)=O)ccc2C)c1	763647798	PLTJPEWWUDHODS-UHFFFAOYSA-N	433.486	1.180	50	20	IDGD	
O=C(NNC(=O)C12CC3CC(CC(C3)C1)C2)C(=O)Nc1cccnc1N1CCOCC1	763727018	DHFXUOWYOBOUNQ-UHFFFAOYSA-N	427.505	1.221	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(-n3cncn3)c(Cl)c2)c1	763760393	LZQAVWUIHYGHRX-UHFFFAOYSA-N	427.852	1.386	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2cnc3c(cnn3C(C)C)c2)c1	763771740	KXUNJCBHUZJZSR-UHFFFAOYSA-N	426.433	1.429	50	20	IDGD	
CCOC(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)c1	763849887	LVIGQPAXYWGLJY-ZDUSSCGKSA-N	431.420	1.485	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(OC)nc2Cl)cc1	763861226	NAERQGXCRAWNCS-NSHDSACASA-N	436.852	1.696	50	20	IDGD	
CCOC(=O)c1c(C(C)C)csc1NC(=O)C(=O)NNC(=O)Cn1nc(C)cc1C	763882367	SWEIUJJEMNWZFA-UHFFFAOYSA-N	435.506	1.648	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3cnn(CC)c3c2)cc1OC	763901267	JNUCZYZUANVXJD-UHFFFAOYSA-N	425.445	1.863	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cccc(S(C)(=O)=O)c2)ccc1OC(C)C	763916070	HKIIGOIRILYOQK-UHFFFAOYSA-N	449.485	1.286	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)C(=O)Nc1ccc2oc3ccccc3c2c1	763921657	NHNRODOEJLFABO-UHFFFAOYSA-N	441.407	1.961	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)C(=O)Nc1cccc(Cn2nc3ccccn3c2=O)c1	763957849	MMOKXTOXGXBICA-UHFFFAOYSA-N	444.451	1.252	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1ccnn1Cc1ccccc1	764011560	JAMSXEFDVACZSO-UHFFFAOYSA-N	427.848	1.993	50	20	IDGD	
CCCN(CCC)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)Cc2cccnc2)cc1	764264698	XHBKCCZVVRSGNL-UHFFFAOYSA-N	425.489	1.672	50	20	IDGD	
CN(C)CCC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)CCc2ccccc2O)cc1	764278244	OPFCRRMGKVMKEG-UHFFFAOYSA-N	441.488	1.001	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)C(=O)Nc1cccc(Cl)c1N1CCOCC1	764289274	QMXHWZMIBFYETB-UHFFFAOYSA-N	446.891	1.601	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)C(=O)Nc1ncn(Cc2ccc(C#N)cc2)n1)c1ccccc1	764330810	YILBLMSNXAHSHT-GOSISDBHSA-N	431.456	1.478	50	20	IDGD	
Cc1nc2c(c(C)nn2C)c(C)c1CC(=O)NNC(=O)CCCNC(=O)OC(C)(C)C	765324503	XKWXOUNFZBKQOY-UHFFFAOYSA-N	432.525	1.888	50	20	IDGD	
O=C(CSc1nc2ccccc2nc1N1CCCC1)NNC(=O)C(=O)N1CCCC1	765351218	PMVHTTKKQLDMDT-UHFFFAOYSA-N	428.518	1.092	50	20	IDGD	
CC(C)CC(=O)NCCC(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	765751021	GHOFQGYGAVJVNG-UHFFFAOYSA-N	437.972	1.157	50	20	IDGD	
C[C@@H](NC(=O)c1ccoc1)C(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	765755630	IZXLQXLFHHTXIU-OAHLLOKOSA-N	447.923	1.017	50	20	IDGD	
CCCn1ncc(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)c1C1CC1	765874665	WITZUZZTHBSJHJ-UHFFFAOYSA-N	446.577	1.864	50	20	IDGD	
CCC(CC)NC(=O)[C@@H]1CN(C(=O)C(=O)NNc2nccnc2OC)c2ccccc2O1	766260451	FQSKXMWVYFTWEW-INIZCTEOSA-N	442.476	1.027	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@H]3Oc4ccccc4O[C@@H]3C)CC2)cc1	766647451	FEXLABPPGKKDKT-JPYJTQIMSA-N	438.528	1.489	50	20	IDGD	
Cc1nn(C)c(C)c1[C@H](C)C(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	766659517	BVCBGXZHSPFLSM-HNNXBMFYSA-N	446.983	1.759	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)c1cccc2c1OCO2	766663345	KDXMQGHJKJYPFN-UHFFFAOYSA-N	430.892	1.648	50	20	IDGD	
CO[C@@H](CNC(=O)OC(C)(C)C)CC(=O)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	768133104	RLEKCUKINNBLQC-CQSZACIVSA-N	435.456	1.907	50	20	IDGD	
NC(=O)c1ccc(NNC(=O)CSc2nnc(-c3ccncc3)n2-c2ccccc2)nn1	768233565	WJRFYLYDVLTLQP-UHFFFAOYSA-N	447.484	1.454	50	20	IDGD	
COc1ccc(C)cc1N1C[C@@H](C(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)CC1=O	769694909	RTDKTENGDUJHCJ-INIZCTEOSA-N	438.484	1.759	50	20	IDGD	
CN(C)C(=O)CNC(=O)c1ccc(NC(=O)NNc2ccc(Cl)nn2)cc1Cl	770073018	DWUATVIPKZJXQB-UHFFFAOYSA-N	426.264	1.750	50	20	IDGD	
C[C@@H]1CN(Cc2cccc(CNC(=O)NNc3nc(O)c4cnn(C)c4n3)c2)CCO1	770355284	KNIBNZLXNAPWFE-CYBMUJFWSA-N	426.481	1.116	50	20	IDGD	
CN(NC(=O)c1cccc(NS(=O)(=O)c2ccc(Br)cc2)c1)C(N)=O	770533232	LCWRFHNXFISPAG-UHFFFAOYSA-N	427.280	1.905	50	20	IDGD	
CCNC(=O)N(C)NC(=O)COc1ccc(N(C)S(=O)(=O)c2cccs2)cc1	770549146	MABIOUYXPNWDOU-UHFFFAOYSA-N	426.520	1.645	50	20	IDGD	
O=C(NNC(=O)c1cncc(-c2ccc3c(c2)CCO3)c1)c1ccc(-n2cnnn2)cc1	770748237	KKMCRUPYSWFOFM-UHFFFAOYSA-N	427.424	1.734	50	20	IDGD	
CC(C)[C@@H](C(=O)NNC(=O)Cc1nc(-c2ccccc2)cs1)N1CCCS1(=O)=O	772632417	ZDBVPJWRBKTZKS-SFHVURJKSA-N	436.559	1.560	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNS(=O)(=O)c1ccc2c(c1)n(C)c(=O)n2C	773263206	FHBJRPXWKWQVEH-NSHDSACASA-N	438.893	1.307	50	20	IDGD	
Cc1nc(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)ccc1Br	773521424	DBXNNLSBKFHOLO-UHFFFAOYSA-N	446.305	1.691	50	20	IDGD	
Cn1nc(Br)c2c(=O)n(CC(=O)NNc3ccc(C(F)(F)F)cn3)cnc21	775257507	PACMSKGUCJLOLB-UHFFFAOYSA-N	446.187	1.450	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN[C@H](c2ccc(F)cc2)c2cnn(C)c2)cc1OC	775751852	OVJOGYKBYBTYBU-OAQYLSRUSA-N	441.463	1.717	50	20	IDGD	
CC(C)(O)CCNC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	776262428	CKGNTRGYZRPSGK-UHFFFAOYSA-N	426.520	1.654	50	20	IDGD	
O=C(COC(=O)c1cc(O)c2ccccc2c1O)NNC(=O)[C@H]1COc2ccccc2O1	776524937	QLBPIGBECQEAIA-GOSISDBHSA-N	438.392	1.395	50	20	IDGD	
CC(=O)c1cc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c(C)nc1C	777111733	GGLDESIMSNUYET-SFHVURJKSA-N	427.413	1.045	50	20	IDGD	
COc1cc(C(=O)NNc2ccc([N+](=O)[O-])cc2Br)ccc1OCC(N)=O	779136995	UDKXOSMJEFGFHB-UHFFFAOYSA-N	439.222	1.987	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@H](C(=O)NNc3cc(Cl)nc(N)n3)C2)s1	779374848	HNUGBDVQEUDUAK-JTQLQIEISA-N	430.943	1.626	50	20	IDGD	
COc1cccc(NNC(=O)CCCNS(=O)(=O)c2ccc3c(c2)OCCCO3)n1	780768603	BHNHSOKEKPPOMM-UHFFFAOYSA-N	436.490	1.453	50	20	IDGD	
O=C(CN1CCc2c(ncn2-c2ccc(F)cc2)C1)NNC(=O)c1ccc([N+](=O)[O-])cc1	781350020	CPWJUMQEHYHEAL-UHFFFAOYSA-N	438.419	1.739	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(OC3COC3)cc2)c1C	782121326	URNLVRQTZNBYLG-OAHLLOKOSA-N	427.457	1.634	50	20	IDGD	
COc1ccccc1[C@@](N)(C(=O)NNC(=O)[C@@H]1COc2ccccc2O1)C(F)(F)F	782161551	BHRZPCGYGIFIGS-MAUKXSAKSA-N	425.363	1.399	50	20	IDGD	
CCOc1ccc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)C3(C)COC3)cc2)cc1	782550275	YVWIEBJJPANLSC-UHFFFAOYSA-N	433.486	1.684	50	20	IDGD	
COC(=O)c1ccc(-n2cc(C)cn2)c(NC(=O)C(=O)NNC(=O)c2ccc(O)cc2)c1	782833864	MKLZUYHCQKFUBR-UHFFFAOYSA-N	437.412	1.073	50	20	IDGD	
O=C(Cn1cc(NC(=O)C(=O)NNc2ccc(Cl)cc2[N+](=O)[O-])cn1)NC1CCCC1	783289689	RFAIQWMTLGYKAL-UHFFFAOYSA-N	449.855	1.585	50	20	IDGD	
O=C(NNc1cccc(C(F)(F)F)n1)C(=O)Nc1ccccc1CN1C(=O)CCC1=O	784951326	KBVMUABNOKIXKE-UHFFFAOYSA-N	435.362	1.831	50	20	IDGD	
O=C(NNc1c(F)cc(C(=O)NC2CC2)cc1F)C(=O)Nc1cccc2c1OCCO2	785100166	SIJCOGRIBICSAD-UHFFFAOYSA-N	432.383	1.710	50	20	IDGD	
O=C(Cc1ccccn1)NNC(=O)C(=O)Nc1ccc(Oc2cccc(F)c2F)nc1	787543205	UXXJBNPBQSKLBM-UHFFFAOYSA-N	427.367	1.876	50	20	IDGD	
CCN(CC)Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1	787893081	FZGINDJWTDAYOL-LJQANCHMSA-N	426.473	1.454	50	20	IDGD	
CN(NS(=O)(=O)N(C)C1CCCCC1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	788917756	UXERGODARYFTQA-UHFFFAOYSA-N	433.575	1.605	50	20	IDGD	
CC(C)(C)OC(=O)N1CC2(C[C@@H]2C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)C1	789907553	JVMWWQDAMBQZCV-CQSZACIVSA-N	427.461	1.596	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2ccc(C(=O)NNc3nc4ccccn4n3)cc2)C[C@H](C)O1	791259883	YTKAAIXHJKJAGW-KBPBESRZSA-N	430.490	1.284	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2nc3ccccn3n2)cc1S(=O)(=O)NC(C)(C)C	792392207	VCHFPKWYSJSJOV-UHFFFAOYSA-N	445.505	1.196	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H]2C[C@]2(C=NNC(=O)Cc2csc(N3CCOCC3)n2)C1	792939075	DEMVPMTXCQCYLB-VLIAUNLRSA-N	435.550	1.881	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNC(=O)Cc2ccccc2OC)c(F)cc1C	793025130	IHQNRIONYRGTSF-UHFFFAOYSA-N	431.420	1.648	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNc2ccc(-n3cccn3)nn2)c(F)cc1C	793044018	XRNVHSSHQNPXMS-UHFFFAOYSA-N	427.396	1.368	50	20	IDGD	
O=C(CCc1ccccc1O)NNS(=O)(=O)c1ccccc1S(=O)(=O)C(F)F	794588066	VXWSXNKIPJPVQS-UHFFFAOYSA-N	434.442	1.331	50	20	IDGD	
CCNC(=O)N(C)c1cccc(NC(=O)C(=O)NNC(=O)c2cccc(N(C)C)c2)c1	796990646	UXZRFMMXPJYZJC-UHFFFAOYSA-N	426.477	1.318	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(N2CCOCC2)ccc1C	797535641	PGJLYZJHELEEKJ-UHFFFAOYSA-N	442.472	1.005	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)COC2CCN(C(=O)OC(C)(C)C)CC2)cc1C	798310881	XMUHQNDIQRFDAM-UHFFFAOYSA-N	448.520	1.805	50	20	IDGD	
COc1ccc(-c2nn(CCC#N)cc2/C=C(/C#N)C(=O)OCc2nnn(C)n2)cc1OC	799453200	DRLPBHJKQZRBJS-DHDCSXOGSA-N	448.443	1.655	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)NCCNS(=O)(=O)c1ccc(F)cc1F)c1ccccc1	799669427	QXWJRPTYNLBBHD-OAHLLOKOSA-N	440.472	1.767	50	20	IDGD	
O=C(CN1C(=O)c2ccc(Cl)cc2S1(=O)=O)NNC(=O)c1cccc(Cl)c1	800842210	JYDCDGAGXBNNQY-UHFFFAOYSA-N	428.253	1.599	50	20	IDGD	
Cc1ccc(-n2cc(O)c(C(=O)OCC(=O)NNC(=O)Cc3nc(C)cs3)n2)cc1	801369876	YOQKXKHNHICZKM-UHFFFAOYSA-N	429.458	1.198	50	20	IDGD	
C[C@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)NNC(=O)Nc2cc(F)cc(F)c2)C1=O	802005487	JVTFYSFMIGIFDN-LJQANCHMSA-N	435.362	1.724	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)CS[C@@H]2CCS(=O)(=O)C2)c(OC)cc1Cl	802081747	AJJRGNAYRILTLZ-SECBINFHSA-N	437.927	1.430	50	20	IDGD	
O=C(CNC(=O)c1ccc(Br)cc1)NNC(=O)c1cc(Cl)ccc1O	802593972	ZFNXSURWALQTNM-UHFFFAOYSA-N	426.654	1.999	50	20	IDGD	
CN(Cc1ccc(OCC(F)(F)F)cc1)C(=O)NNC(=O)CNC(=O)c1ccco1	805043003	DCMNUEBQLIKDEA-UHFFFAOYSA-N	428.367	1.823	50	20	IDGD	
CN(C)S(=O)(=O)C[C@@H](NC(=O)NNC(=O)c1cc2c(s1)CCC2)C(F)(F)F	805767280	HNDZZCNEHGLQFJ-LLVKDONJSA-N	428.458	1.003	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1cccc2cc(Br)cnc12	806561887	CKKZZLXTAQHKFJ-QMMMGPOBSA-N	430.284	1.088	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)Nc1cc(F)c(N2CCOCC2)cc1F	806739300	DQZGUCFBXDMPMQ-GOSISDBHSA-N	434.399	1.794	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@@H]2CCCN2C(=O)C(F)(F)F)cc1Br	806840127	LLQGAASTTJBPQW-JTQLQIEISA-N	438.200	1.772	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNc2cccc(F)n2)c(C(=O)N2CCCCC2)cc1OC	807390416	BWQOJOPVUMHWLD-UHFFFAOYSA-N	445.451	1.946	50	20	IDGD	
Cc1cc([N+](=O)[O-])ccc1NNC(=O)C(=O)Nc1ccc(N2CCC(C(N)=O)CC2)cc1	807457125	RABYYXLHKDXPKS-UHFFFAOYSA-N	440.460	1.687	50	20	IDGD	
Cc1nc(Cl)ccc1S(=O)(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	808093765	TUEFTMBGEMHBAK-UHFFFAOYSA-N	447.945	1.935	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N2C[C@H](C)S(=O)(=O)[C@H](C)C2)cc1Br	811878766	NVVAPHICCOTREX-AOOOYVTPSA-N	434.312	1.320	50	20	IDGD	
CC1=CC(NC(=O)c2ccco2)=S=C1C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	812729270	MQDUIXNMVVNXRK-UHFFFAOYSA-N	448.526	1.398	50	20	IDGD	
Cc1cnc(Br)c(NC(=O)C(=O)NNC(=O)COc2ccccc2F)c1	812980451	VOLMNRCKMFKMHK-UHFFFAOYSA-N	425.214	1.457	50	20	IDGD	
CN(C)C(=O)NNC(=O)[C@@H]1C[C@@H](O)CN1C(=O)OCC1c2ccccc2-c2ccccc21	813427386	GQPLHAWQRAMGFT-VLIAUNLRSA-N	438.484	1.673	50	20	IDGD	
CNC(=O)Oc1cccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)c1	815565942	FJOZWSWQWWRCFB-AWEZNQCLSA-N	428.445	1.575	50	20	IDGD	
CNC(=O)c1cc(Oc2cccc(NC(=O)C(=O)NNc3nc4ccccn4n3)c2)ccn1	815619422	MWLKSXDDDPKBEI-UHFFFAOYSA-N	446.427	1.358	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCc2nncn2C1)C(=O)Nc1cccc(Cl)c1Br	815691602	VMCUHBATVHGDNN-QMMMGPOBSA-N	441.673	1.043	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(C)c(C(=O)NNc2ccc(C)c(C(=O)OC)c2)c1	816689804	YHXCSCYVRWDOOU-UHFFFAOYSA-N	435.502	1.772	50	20	IDGD	
CCCS(=O)(=O)c1ccccc1C(=O)NNc1ccccc1S(=O)(=O)N(C)C	817053661	BEUXTFMUXVFQIC-UHFFFAOYSA-N	425.532	1.878	50	20	IDGD	
CS(=O)(=O)CC[C@@H](NS(=O)(=O)/C=C\c1ccccc1)C(=O)NNc1ccccc1	821694142	XCLQENQKLMISJZ-WTQUMQLASA-N	437.543	1.523	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)CNS(=O)(=O)c2c(C)c(C)cc(C)c2C)c1	913445756	XGOKGCZVESCOQX-UHFFFAOYSA-N	433.530	1.733	50	20	IDGD	
COc1ccc(-c2nn(CCC#N)cc2/C=C(/C#N)C(=O)NCc2nncn2C)cc1OC	915193638	KBDGPPOGTYMUBB-SXGWCWSVSA-N	446.471	1.833	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)ccc1=O	915671455	SQVWZTOVALEPFP-UHFFFAOYSA-N	432.483	1.322	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2cccc(N3CCOC3=O)c2)c2ccccc2c1=O	915813269	ZYKVPRCKIJHBEA-UHFFFAOYSA-N	435.440	1.838	50	20	IDGD	
COC[C@H](C)NC(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2OC)c1	915888017	KYEVXKRRJFZEFU-ZDUSSCGKSA-N	436.490	1.475	50	20	IDGD	
C[C@]1(C2CC2)NC(=O)N(CC(=O)OCC(=O)NN=C(c2ccccc2)c2ccccc2)C1=O	916523761	IZUCMTGBRQDWNR-XMMPIXPASA-N	448.479	1.819	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCC2(N3CCSCC3)CCCC2)c1	916616501	NZSNBLKAIBNZLC-UHFFFAOYSA-N	440.591	1.396	50	20	IDGD	
O=C(Cc1ccc2ccccc2c1)NNC(=O)NC[C@]1(N2CCOCC2)CCSC1	916636646	HUBCUWKMSLMBJP-JOCHJYFZSA-N	428.558	1.921	50	20	IDGD	
COc1ccc(CNC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1O	916642400	YBBOFVHXSQJFRT-UHFFFAOYSA-N	427.505	1.444	50	20	IDGD	
O=C(COC(=O)c1cc(Cl)c2c(c1)OCCO2)NNC(=O)[C@H]1COc2ccccc2O1	917246467	ZYHUTQZPVUBWOO-MRXNPFEDSA-N	448.815	1.255	50	20	IDGD	
CN(C)N(C(=O)[C@@H]1CCN(c2cccc(Br)c2)C1=O)[C@H]1CCS(=O)(=O)C1	917621317	AIWHQBNSBFGCEP-LSDHHAIUSA-N	444.351	1.294	50	20	IDGD	
O=C1Nc2ccc(S(=O)(=O)NNC(=O)[C@H]3COc4ccccc4O3)c3cccc1c23	917716960	GQXGQPXVWGQDKF-MRXNPFEDSA-N	425.422	1.555	50	20	IDGD	
COC(=O)COc1ccc(S(=O)(=O)NNC(=O)c2ccc(Cl)cc2OC)cc1	917731878	OLACXBSFOMDXLB-UHFFFAOYSA-N	428.850	1.524	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@@H](C)NS(=O)(=O)c2cccs2)ccc1OC(C)C	917924370	OWZGGACPSRPROK-GFCCVEGCSA-N	441.531	1.672	50	20	IDGD	
CCCCS(=O)(=O)N1CCC[C@@H]1C(=O)NNC(=O)c1ccc(OC(C)C)c(OC)c1	918689547	XAHWZRMSICBBCC-MRXNPFEDSA-N	441.550	1.838	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)OCC(=O)N2CCC(C(=O)N(C)C(C)C)CC2)cc(C#N)n1C	919045717	IZVQABYKDSPGFI-GRSHGNNSSA-N	439.516	1.761	50	20	IDGD	
Cc1nn(C(C)(C)C)c2nc(C3CC3)cc(C(=O)NNC(=O)N[C@@H]3CCS(=O)(=O)C3)c12	919886901	WDVDHQZGPZMRML-CYBMUJFWSA-N	448.549	1.503	50	20	IDGD	
Cc1noc2nc(-c3ccc(F)cc3)cc(C(=O)NNC(=O)N[C@H]3CCS(=O)(=O)C3)c12	919889558	ODWVNIRELYAOPW-ZDUSSCGKSA-N	447.448	1.468	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)NCc2ccc(N3CCO[C@@H](C)C3)nc2)cc1	919903029	KKEBRDZSCNXXGG-INIZCTEOSA-N	427.505	1.779	50	20	IDGD	
C[C@@H]1CCCN(C[C@@H](C)NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)C1	919914737	LFFBIROXJPGBHL-WOJBJXKFSA-N	430.597	1.650	50	20	IDGD	
O=C(NCc1cccc(C(=O)NC[C@H]2CCCO2)c1)NNC(=O)c1cccc([N+](=O)[O-])c1	920347270	HFNFFVKNHCMHPI-GOSISDBHSA-N	441.444	1.648	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@@H]2C(=O)NNC(=O)OC(C)(C)C)cc1	920402464	YUZRHYMESQNGDJ-MRXNPFEDSA-N	425.507	1.988	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCc2cccc(C(=O)N3CCOCC3)c2)cc1OC	920419833	LNPNDRXGTSXKEI-UHFFFAOYSA-N	442.472	1.320	50	20	IDGD	
Cc1cccc(NS(=O)(=O)c2ccc(C)c(C(=O)NNC(=O)CN3CCCC3=O)c2)c1	920826575	MSMDTWYQMMJDHM-UHFFFAOYSA-N	444.513	1.488	50	20	IDGD	
NC(=O)[C@H]1CCCN1Cc1cccc(NC(=O)NNC(=O)COc2ccc(F)cc2)c1	920930427	MVQQHYKVOQCDRE-GOSISDBHSA-N	429.452	1.507	50	20	IDGD	
O=C(NCc1ccnc(N2CCOCC2)c1)NNC(=O)c1ccc(Br)cc1	1317878925	REFCYBNYEWMKEG-UHFFFAOYSA-N	434.294	1.825	50	20	IDGD	
Cc1ccn(-c2cccc(C(=O)NNC(=O)c3sc(N4CCOCC4)nc3C)c2)n1	1318085143	IKLINWYWLQAGFU-UHFFFAOYSA-N	426.502	1.857	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3cn(C)cc3C(F)(F)F)cc2)CC1	1320263452	KQZCORGWQZVJHL-UHFFFAOYSA-N	445.467	1.737	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)C1(O)Cc2ccccc2C1	1322644585	CZQCVNHGKMDCDE-UHFFFAOYSA-N	442.947	1.135	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)o1	1779024585	UUPBAQJBDSHCNH-SGTLLEGYSA-N	442.310	1.713	50	20	IDGD	
C[C@H](Nc1ccccn1)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2	1779330216	TXUWNDBCBUJBQG-ZOCIIQOWSA-N	429.348	1.948	50	20	IDGD	
C[Si](C)(C)c1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](O)CCl)C3)co1	1779347764	HFYDHEKALNNEAJ-RZQQEMMASA-N	443.016	1.552	50	20	IDGD	
CCCC(=O)N[C@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](Cl)COC)C2	1779519706	HSIPSXBVDLYUHH-AXHMDWHKSA-N	431.961	1.059	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccn(C(F)F)n3)CCO2)C1	1781230764	ZPAUXTCCWPRXGZ-JKSUJKDBSA-N	425.263	1.958	50	20	IDGD	
Cc1nc2ncccn2c1C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781329980	OZFKPLOCRAGJSL-GUYCJALGSA-N	440.273	1.172	50	20	IDGD	
O=C(c1n[nH]c2ccccc12)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781331357	IYVWZOSMWCHKKQ-RHSMWYFYSA-N	425.258	1.697	50	20	IDGD	
O=C(c1ccnc2ncccc12)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781331961	BRWFSOPELUQERO-RDTXWAMCSA-N	437.269	1.764	50	20	IDGD	
O=C(c1cncc2cnccc12)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781334158	MNUKKXZCZKSFFP-YJBOKZPZSA-N	437.269	1.764	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3c(C)nc4ccc(F)cn34)C2)C1	1782305196	XGBPVFWMJKDJIO-QRWLVFNGSA-N	438.887	1.479	50	20	IDGD	
Cc1ccc([C@H](C)C(=O)N2CC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)cc1	1783315797	HXMXTLXVMZLOBY-FDDCHVKYSA-N	430.549	1.301	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3nnsc3C3CC3)CCO2)C1	1783534949	SOQXCQPMCPMWAO-MGPLVRAMSA-N	429.340	1.642	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cc(=O)c4ccccc4o3)CCO2)C1	1783870158	VFSLSLOIMVXSCM-QVKFZJNVSA-N	434.876	1.490	50	20	IDGD	
O=C(c1cnc(-c2ccccn2)nc1)N1CCO[C@@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783943031	DRGKCAMJDXOTBH-LJQANCHMSA-N	436.299	1.786	50	20	IDGD	
COc1cccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]3C2)n1	1783970369	YAZLPDYLSMUQOI-HOSILWTGSA-N	440.338	1.715	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3cn[nH]c3)C[C@@H]21	1783970387	YPEMUHSZTFIFGA-OEAJRASXSA-N	427.343	1.353	50	20	IDGD	
CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@@]2(CN(C(=O)[C@@H](Cl)COC)CCO2)C1	1785347617	AFKQRSXOYRQBHQ-AVYPCKFXSA-N	447.960	1.373	50	20	IDGD	
CC[S@](=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)CBr)C[C@@H]21	1788485291	UGTSBUVPHOIQFI-DHFVLPRBSA-N	437.400	1.156	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccn(C(F)F)n3)[C@H]2C1	1788941638	XBBZVMZAFZUKJM-BLFANLJRSA-N	435.269	1.655	50	20	IDGD	
CN(C)c1cncc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]3C2)c1	1789868855	OKBVSLNMFKMKMJ-VZYKRBATSA-N	443.375	1.977	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)NC(=O)OC(C)(C)C)[C@H]2C1	1790173595	DSWATPQEWDNCCW-KSXIZUIISA-N	447.960	1.217	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(Cl)ncn3)C[C@@H]21	1790960401	FRJROYMRTYRPNS-MNXVOIDGSA-N	445.745	1.897	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3c[nH]c4cnccc34)C[C@@H]21	1791055650	BGAUDCXPABEJFQ-HJXMPXNTSA-N	435.322	1.940	50	20	IDGD	
C[C@H](Oc1cccnc1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]2C1	1791065488	YJZOWYSVPDXCQD-HZRXROBNSA-N	440.338	1.612	50	20	IDGD	
O=C1Cc2cccc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]4C3)c2N1	1791296554	XTPTUQJMSLYIOV-UBHSHLNASA-N	426.300	1.578	50	20	IDGD	
N#Cc1ccc2[nH]nc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]4C3)c2c1	1791296759	JDRWMEYIYXPULP-WHOFXGATSA-N	436.299	1.832	50	20	IDGD	
CC(C)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1=NN(c3ccccc3)C(=O)C1)C2	1792782250	ZAKIDEOIKXAMBS-CCWDJLKJSA-N	446.935	1.634	50	20	IDGD	
C[C@@H]1C[C@]1(C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1793879055	CWUASWKSYAVJMF-ZLXUVUDQSA-N	443.972	1.754	50	20	IDGD	
Cc1ccc(-c2ncccc2C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](O)CCl)C3)cc1	1796006157	OIQWZPNLYOOXBY-PIKOESSRSA-N	443.931	1.860	50	20	IDGD	
O=C(C#Cc1ccc(Cl)cc1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1	1796189630	JOGOAUHWQDPFRG-WKCHPHFGSA-N	436.704	1.323	50	20	IDGD	
CCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Cl	1796370708	LCUIHWZIYRMKHT-AICCOOGYSA-N	435.924	1.804	50	20	IDGD	
CCn1nc(C(C)C)cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](Cl)COC)C2	1798737891	BBOKNQHKLNLQTD-BASYENTBSA-N	426.945	1.483	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cn1cccn1)C2	1799218017	SPDMEGLJGJZIQT-MUJYYYPQSA-N	441.444	1.669	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccccc1C(=O)OCCO	1799270866	YCQPSXDGDPBWEH-KRXQYRFLSA-N	438.908	1.341	50	20	IDGD	
CC(C)Cc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Br)n(C)n1	1799346113	CNHQDLZZTGZDMX-VZAMPYOESA-N	445.333	1.512	50	20	IDGD	
COc1ccc(C)c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Br)C3)c1	1799638102	HAHQIDRYSYTGNH-VZAMPYOESA-N	429.286	1.897	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccnc2c(O)cccc12	1800096084	YBZHZWPJPTVUMS-YVWYUNDQSA-N	443.576	1.995	50	20	IDGD	
Cc1cc2cc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)c3cccc(B(O)O)c3)C4)ccc2[nH]1	1801164708	XGWAVZKSMHIXDF-WKCHPHFGSA-N	431.301	1.722	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C[C@@H]1C[C@@H]2CC[C@H]1C2	1801727039	GNDYADBKXTZECD-CMURFVSUSA-N	425.533	1.763	50	20	IDGD	
CNC(=S)NCCC(=O)N1CC[C@@H](CNC(=O)C(C)(C)CCl)[C@H]1c1cccnc1	1802900709	DVQYLRSAOSTXQT-DOTOQJQBSA-N	440.013	1.836	50	20	IDGD	
Cn1ncc(C(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]2c2cccnc2)c1Cl	1803140372	FBQLKIXVRPHPOC-BPLDGKMQSA-N	426.304	1.388	50	20	IDGD	
Cc1cccn2ncc(C(=O)N3CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]3c3cccnc3)c12	1803147354	HCUWTZCJGQCFBO-YVWKXTFCSA-N	441.919	1.957	50	20	IDGD	
CCS(=O)(=O)CC(=O)NC[C@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1	1803511433	BAUFERRYSRRPHE-RHSMWYFYSA-N	446.367	1.307	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)[C@H]2CC=CCC2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1	1807374077	XGUFMDRFYGLXLO-WEYGHZABSA-N	433.317	1.437	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1	1808263937	RHHGJSFMGNGJOD-JLSDUUJJSA-N	444.923	1.417	50	20	IDGD	
O=C(Cc1cccc(F)c1)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1	1809967681	DSYSCSFWXVMZNC-UHFFFAOYSA-N	438.308	1.593	50	20	IDGD	
CNC(=S)NCCC(=O)NC[C@H]1CCN(C(=O)C(C)(C)CCl)[C@@H]1c1cccnc1	1810308098	IZKSLKWHWCRIMT-NVXWUHKLSA-N	440.013	1.836	50	20	IDGD	
C[C@H](Cc1ccccn1)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1	1813287805	XFWSYKOJRWKVQE-LQJIQPLVSA-N	430.936	1.961	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cnc(OCF)cn2)[nH]n1)[C@H](O)CCl	1814869595	USQOEKKVPNNXJW-CHWSQXEVSA-N	426.836	1.411	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1cncc(F)c1	1816530465	DVSKGVJPHRFBGO-GOSISDBHSA-N	437.240	1.243	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)C(=O)C2CC2)[nH]n1	1818110356	BXQMOFBSCNCOKC-UPVZUOOXSA-N	439.476	1.515	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnncc2C(=O)O)n[nH]1	1819763170	GRQDRJFSKAINDE-GXTWGEPZSA-N	436.856	1.458	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)CCNC(=S)NC)sc2C1	1819802367	MMQOKPKBOCSPIN-GHMZBOCLSA-N	432.015	1.947	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H]2CNC(=O)C2)[nH]n1	1822090681	NDXVWIRFROLMEN-NTZNESFSSA-N	426.315	1.711	50	20	IDGD	
C[C@@H](Cn1cccn1)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1	1825342322	UQJFDBLIXWTBKP-AZUAARDMSA-N	446.596	1.512	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccnc2C(N)=O)CC1	1825400756	DXUOOKBYLABEIK-IRXDYDNUSA-N	436.940	1.668	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](N)Cc1cccnc1)CC2	1825999268	SNRSSEGJNMGPNR-RDBSUJKOSA-N	437.953	1.274	50	20	IDGD	
CNC(=S)NCCC(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@H](C)Br)CC1	1828931600	SFYLWGAGCZMXGA-ZFWWWQNUSA-N	447.443	1.874	50	20	IDGD	
O=C([C@H](O)CCl)N1CCC([C@H]2CCCCN2C(=O)c2nc(O)n3c2CCCC3)CC1	1829134124	BLZMQBDQWZTIMO-NVXWUHKLSA-N	438.956	1.758	50	20	IDGD	
Cc1ncsc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2	1830537804	PAUKERKNWJOZJB-SJCJKPOMSA-N	446.367	1.553	50	20	IDGD	
Cc1nc(C)c(C(=O)N2CCC([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)o1	1831873371	IHWUJHREJPVKNR-GOSISDBHSA-N	433.553	1.898	50	20	IDGD	
C[C@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1)n1cccn1	1831876919	MHLVEZNQWDIJHC-IEBWSBKVSA-N	432.569	1.437	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3nc(C)sc3C)CCO2)C1	1833149706	DTQZERILJYTQIN-KXBFYZLASA-N	445.969	1.013	50	20	IDGD	
CCCNC(=O)CCC(=O)NC1CCN(C2CCN(C(=O)[C@@H](Cl)CC)CC2)CC1	1833424380	PXGHHALONXJUJC-SFHVURJKSA-N	429.005	1.882	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)C3(C(=O)OC)CC3)CC2)CC1	1833534973	PXRCKTZTLAOIOF-QGZVFWFLSA-N	427.973	1.919	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)C(=O)c3ccco3)CC2)CC1	1833757125	HRYBPIXHNLOGBP-INIZCTEOSA-N	425.913	1.288	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1)c1cc(=O)cco1	1834344764	BXCQPXVPYWDERY-MRXNPFEDSA-N	444.301	1.516	50	20	IDGD	
Cc1oncc1C(=O)N1CCC(N2CCC(NC(=O)CCBr)CC2)CC1	1834421152	LSLWGFXLNDIDPK-UHFFFAOYSA-N	427.343	1.953	50	20	IDGD	
CC[C@@H](C)[C@H](N)C(=O)NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1	1834684784	SEMLZSPUAANUPT-KDOFPFPSSA-N	431.419	1.716	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)c3cc(O)ccc3F)C2)C1	1834824229	YNYLILXCYLAHPR-SFHVURJKSA-N	445.285	1.386	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)[C@H](C)CC(N)=O)CC2)CC1	1836911891	DGNPGIAQVOOUHD-CHWSQXEVSA-N	432.359	1.280	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@@H]3CCNC(=O)C3)CC2)CC1	1836922749	POHMMRRCGSIULL-CRAIPNDOSA-N	427.973	1.919	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(F)cn3)C2)C1	1837712395	OUXLOLRINKFTGW-IBGZPJMESA-N	425.533	1.142	50	20	IDGD	
Cc1cc(/C=C/C(=O)N2CCOC[C@@]3(C2)CN(C(=O)CO[Si](C)(C)C)CCO3)no1	1837715259	FVNUHGBVGFOYMI-RRFGBZISSA-N	437.569	1.304	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)CCCc3cccnc3)C2)C1	1837717421	FHJUJRBKIQIPSY-QFIPXVFZSA-N	449.624	1.712	50	20	IDGD	
CCc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)nn1C	1838271772	XYQHAQSNFCFKDS-HXUWFJFHSA-N	426.945	1.318	50	20	IDGD	
N#Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)cc1	1838953322	YPYFEGKBRLUBDI-MAUKXSAKSA-N	440.269	1.319	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cncc4cnccc34)C2)C1	1839146215	LQZADEPWCUJJFS-GHTZIAJQSA-N	432.908	1.717	50	20	IDGD	
Cc1ccc(F)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)c1	1839314158	TUZMLMYTFPABLW-AUUYWEPGSA-N	443.313	1.988	50	20	IDGD	
C[C@@H](Cc1ccncc1)C(=O)N1CCO[C@@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1	1839659611	QNGLOUSQUFRLLR-PGRDOPGGSA-N	449.624	1.568	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cncc(F)c3)C2)C1	1839963369	IWPFQDWGHWXAOW-CRAIPNDOSA-N	444.301	1.464	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)OC(C)C)C2)C1	1839965145	OCYZMWCNFCQUQJ-MPGHIAIKSA-N	435.359	1.430	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4ccccc4o3)C2)C1	1840152694	PWUMMYBWTUMVRZ-IERDGZPVSA-N	436.892	1.757	50	20	IDGD	
COc1ccc(CCC(=O)N2CCOC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)cn1	1840186302	GCFFFDKFZGJSNF-IBGZPJMESA-N	446.331	1.283	50	20	IDGD	
Cc1ccccc1NCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840188210	WNGKMDHHUATSLB-LJQANCHMSA-N	430.332	1.667	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)[C@@H]2CCCN2C)C1	1841770911	ZQYUGRZQBWOFTM-KRWDZBQOSA-N	430.461	1.431	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1cccc(C(F)(F)F)c1)C2	1844264927	YXCIEZXDDUZCKI-UHFFFAOYSA-N	447.417	1.835	50	20	IDGD	
C=CC(=O)N[C@@H](C)C(=O)N1CCCC12CN(C(=O)[C@@H](Br)Cc1ccccc1)C2	1844372629	UDEHPRAHPNTGGS-RDJZCZTQSA-N	448.361	1.887	50	20	IDGD	
C=CC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCCC12CN(C(=O)[C@@H](O)CCl)C2	1845209557	ROYWEHMUGLECNV-MSOLQXFVSA-N	449.935	1.661	50	20	IDGD	
CCOC(=O)c1ccc(C(=O)N2CCCC23CN(C(=O)CCC(=O)NN(C)C)C3)cc1	1845516213	UPAZRIGZMFUJPR-UHFFFAOYSA-N	430.505	1.053	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2cc(O)ccc2O)C1	1845517551	OYSHZJAFCMAHSR-YDZHTSKRSA-N	425.445	1.049	50	20	IDGD	
Cc1cc(C(=O)N2CC3(CCCN3C(=O)CCC(=O)NN(C)C)C2)cc(C)c1C(=O)O	1846385773	UKIMNAKECYKCAJ-UHFFFAOYSA-N	430.505	1.192	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](C)CBr	1847499926	RIXPVTBWUGIAOV-LEOABGAYSA-N	427.339	1.975	50	20	IDGD	
O=C(NNC(=O)c1n[nH]c2c1CCCC2)c1ccc(S(=O)(=O)N2CCCCCC2)cc1	13230432	SMTCCNKFHGSOCK-UHFFFAOYSA-N	445.545	1.928	50	20	IDGD	
C=CCNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cc(Br)c[nH]2)cc1	24124340	FHAHLSMOJPWUEC-UHFFFAOYSA-N	427.280	1.316	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)[C@H]2CC(=O)N(Cc3ccco3)C2)c2ccccc2c1=O	28409161	JRGWSHPKHXZUBO-AWEZNQCLSA-N	437.456	1.209	50	20	IDGD	
CC(C)(C)OC(=O)NNC(=O)[C@H](CCS(C)(=O)=O)NC(=O)c1ccccc1Cl	725897484	CNDMNTIILRMOGV-ZDUSSCGKSA-N	433.914	1.429	50	20	IDGD	
COc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NNC(=S)Nc2ccc(C)c(C)c2)cc1	725906387	IEPPXKCFOVKFSG-AWEZNQCLSA-N	436.559	1.997	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCCN1CCOC(C)(C)C1	726262799	RJJSHQHIYJAPCZ-CYBMUJFWSA-N	443.342	1.658	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)c1cccc(S(=O)(=O)N(C)C)c1	727609721	NNRZXNSHOHRKGB-GFCCVEGCSA-N	435.462	1.550	50	20	IDGD	
Cc1nn(C)c(C)c1[C@@H](C)C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	728214011	IJEMKGBCSWAYOD-CQSZACIVSA-N	434.566	1.220	50	20	IDGD	
C[C@@H]1Oc2ccccc2O[C@@H]1C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	728214927	UXIAHMYJCLBADU-YWZLYKJASA-N	446.529	1.294	50	20	IDGD	
C[C@H]1C[C@H](C)CN(S(=O)(=O)c2ccc(S(=O)(=O)NNC(=O)C3CCCC3)cc2)C1	728259939	MJTWKUORVTWYGJ-GJZGRUSLSA-N	443.591	1.853	50	20	IDGD	
NS(=O)(=O)c1ccc(CCNC(=O)NNC(=O)c2cccc(OC(F)F)c2)cc1	728600000	VNVFMJYDPUZWBO-UHFFFAOYSA-N	428.417	1.122	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)CNC(=O)c2cc(F)cc(F)c2)c1	728608761	AKQUDSZOTNTKJK-UHFFFAOYSA-N	442.216	1.927	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1cccc(NC(=O)c2ccco2)c1	728846222	VGRWUDIKDMIKTL-UHFFFAOYSA-N	434.456	2.000	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccccc1OC(F)(F)F)C1CCN(c2ncccn2)CC1	728853826	CDSMSVFKPHNKQP-UHFFFAOYSA-N	445.423	1.601	50	20	IDGD	
CCC[C@@](C)(NC(=O)OC(C)(C)C)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	728889782	FDUHWLAKKYQGQU-OAQYLSRUSA-N	434.541	1.924	50	20	IDGD	
O=C(NCCc1cccs1)NNC(=O)c1c(F)ccc(S(=O)(=O)NC2CC2)c1F	729845373	YGSJYIRLSWLKNU-UHFFFAOYSA-N	444.485	1.654	50	20	IDGD	
O=C(CCc1ccccc1O)NNS(=O)(=O)c1cc(C(=O)O)ccc1Br	729965411	YQQVJABCYFYGQE-UHFFFAOYSA-N	443.275	1.795	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Cc2cccc(NS(C)(=O)=O)c2)ccc1OC(C)C	730204871	LFTOZWJKQMXQPK-UHFFFAOYSA-N	435.502	1.858	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)c2sccc2S(=O)(=O)C(F)F)cc1	731093936	MQBVEGMEFFQMRY-UHFFFAOYSA-N	432.426	1.671	50	20	IDGD	
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC[C@H](C(=O)NNC(=O)C(C)(C)c2ccccc2)C1	731200953	CRGXQTJRVWUXPH-INIZCTEOSA-N	447.561	1.552	50	20	IDGD	
CCCn1c(C)cc(/C=C(\C#N)C(=O)OCCN(C)S(=O)(=O)N2CCOCC2)c1C	731290969	HJUCGXQAWSENGD-XMHGGMMESA-N	438.550	1.474	50	20	IDGD	
CC[C@@H](N=c1nn[nH]n1-c1ccccc1)C(=O)NNC(=O)Cc1cccc2ccccc12	731471543	YBVYQXXLRVBLSS-HXUWFJFHSA-N	429.484	1.818	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NN=C1CCN(CCN2CCOCC2)CC1	731559104	ASJFSYHDOLLUJN-UHFFFAOYSA-N	442.608	1.099	50	20	IDGD	
O=C(CCN1CCN(C(=O)[C@H]2CCCO2)CC1)NNC(=O)Cc1cccc2ccccc12	731843167	YNXDRQVQVIMORM-OAQYLSRUSA-N	438.528	1.243	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)cc1Br	732035677	LDEXZAHHMLZYHF-UHFFFAOYSA-N	426.227	1.759	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2ccc3nc(O)[nH]c3c2)cc1Br	732048562	OFZXKWPDXNYSMM-UHFFFAOYSA-N	441.263	1.663	50	20	IDGD	
CCc1nc([C@@H](C)NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cs1	732476254	BUOOUYVXPJVZBX-CYBMUJFWSA-N	439.563	1.726	50	20	IDGD	
CN(CCNC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)CC(F)(F)F	732703417	FNRWHPAFXKKTHO-UHFFFAOYSA-N	430.475	1.023	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)N[C@H]2CCN(c3ccccc3F)C2=O)cc1OC	732892888	IQEVLWKFGVPWMX-HNNXBMFYSA-N	430.436	1.983	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cc(I)c[nH]2)cc(OC)c1OC	734417342	ALOHPJFLMULZEA-UHFFFAOYSA-N	445.213	1.720	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)cc1F	734806922	ATMLXBBTZXVUES-UHFFFAOYSA-N	446.501	1.726	50	20	IDGD	
O=C(NCc1ccccc1CS(=O)(=O)N1CCOCC1)NNc1c(F)cccc1F	735756314	RSEIOMOLTJPIHO-UHFFFAOYSA-N	440.472	1.953	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN2CCN(c3oc(C4CC4)nc3C#N)CC2)cc1C	736308499	OHOXPDGOZSOKET-UHFFFAOYSA-N	442.545	1.939	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2cnn(-c3ccccc3)c2)ccc1OC	739672274	TYGQSDBRUBZRNJ-UHFFFAOYSA-N	430.442	1.291	50	20	IDGD	
O=C(CCN1C(=O)[C@H]2[C@H](C1=O)[C@H]1CC[C@H]2O1)NNC(=O)CSc1ccc(Cl)cc1	742470946	CMYTTYKIZHCPFW-BQGCOEIASA-N	437.905	1.132	50	20	IDGD	
CC(C)n1nc(C(=O)NNS(=O)(=O)c2ccc(C(=O)O)cc2F)c2ccccc2c1=O	743250476	ZLSGUIPQPFLSCK-UHFFFAOYSA-N	448.432	1.438	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	743805479	FTDUCXMYGMTBDN-UHFFFAOYSA-N	439.519	1.158	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CN(C)CC(=O)Nc2ccc(Br)cn2)c1	744396676	PJDRWLAOZAHJRB-UHFFFAOYSA-N	434.294	1.484	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1c[nH]nc1-c1ccccc1	744621545	SIZPUQMTXVDTCK-UHFFFAOYSA-N	427.486	1.855	50	20	IDGD	
COc1cc(-n2cnnn2)c(Cl)cc1C(=O)OCC(=O)NNC(=O)c1cccc(C)c1	744799319	XOMDBXREMGLBRK-UHFFFAOYSA-N	444.835	1.251	50	20	IDGD	
O=C(NCCNS(=O)(=O)c1ccccc1)NNC(=O)Nc1ccc(OC(F)F)cc1	745436420	PIXIPVNJRZIMBA-UHFFFAOYSA-N	443.432	1.602	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)NCCNS(=O)(=O)c2ccccc2)c(Cl)c1	745436727	STILJSKOJYHXJU-UHFFFAOYSA-N	425.898	1.963	50	20	IDGD	
Cc1ccc(C)c(S(=O)(=O)Nc2cccc(C(=O)NNc3nccn(C)c3=O)c2)c1	747942098	VLDRRYKTIKXPRF-UHFFFAOYSA-N	427.486	1.955	50	20	IDGD	
O=C(CCc1ccco1)NNC(=O)c1cccc(C(=O)NNC(=O)CCc2ccco2)n1	748353868	FDRCPFVHMCBWQU-UHFFFAOYSA-N	439.428	1.055	50	20	IDGD	
CS(=O)(=O)NCc1ccc(C(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)o1	748518329	JVZCDYQWOBGXSM-UHFFFAOYSA-N	441.409	1.379	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)c2ccc(Br)cc2[N+](=O)[O-])c2ccccc2c1=O	750985488	ZPVMWGXWRNLDNS-UHFFFAOYSA-N	446.217	1.679	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NN[C@H](C(=O)OC)c2cccc(C#N)c2)c1	751445486	FGAAAFUXGGHSRJ-IBGZPJMESA-N	444.513	1.737	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)c1ccc(CS(=O)(=O)C(F)F)cc1	751458953	VFCIETULUUOWRD-HNNXBMFYSA-N	426.397	1.425	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN([C@@H]2CCCN(C(=O)NNC(=O)C3CCCC3)C2)C(=O)C1	753356368	XUOQJSASNLEAPO-MRXNPFEDSA-N	437.541	1.461	50	20	IDGD	
CS(=O)(=O)NCc1ccc(C(=O)NNC(=O)c2ccc(F)cc2Br)o1	753583955	PVCSHTDFYJMNOK-UHFFFAOYSA-N	434.243	1.305	50	20	IDGD	
CCOc1ccc(NC(=S)NNC(=O)c2cnn3c2C[C@H](CNC(C)=O)CC3)cc1	754174653	SGWDDNWPIPZHKK-CQSZACIVSA-N	430.534	1.612	50	20	IDGD	
CCOc1ccc(/C=C(/C#N)C(=O)N2CCC[C@@H](S(=O)(=O)N(C)CCOC)C2)cc1	754707761	FWADIJWNSVZMFP-BKHFDQEPSA-N	435.546	1.891	50	20	IDGD	
C[C@@H](C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1)c1ccc([N+](=O)[O-])cc1F	755068741	SNGPHSZOHVYLKA-DIFFPNOSSA-N	447.375	1.368	50	20	IDGD	
O=C(NCCN1C(=O)[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)NNC(=O)c1cccc(Br)c1	755175722	HKXLZZGFRCGPCZ-UOVKNHIHSA-N	447.289	1.200	50	20	IDGD	
CC(=O)Nc1ccc(O)c(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)c1	755180154	QRIOSMDDLKRLBZ-UHFFFAOYSA-N	434.474	1.128	50	20	IDGD	
CON(C)S(=O)(=O)c1ccc(NC(=O)NNC(=O)c2cccc(OC(F)F)c2)cc1	755532459	APMMMTDUZSRBDS-UHFFFAOYSA-N	444.416	1.936	50	20	IDGD	
CN1CCN(C(=O)c2ccccc2NC(=O)NNC(=O)CCc2ccccc2O)CC1	755622809	LDEFQPDUXMRCIX-UHFFFAOYSA-N	425.489	1.565	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)cc1OC	756208564	ZNPJIZGKVPQDFW-UHFFFAOYSA-N	448.501	1.405	50	20	IDGD	
COc1ccc(COCc2cccc(NC(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)c2)cc1	756247226	ZQZQHVXTLPDTKJ-KRWDZBQOSA-N	447.513	1.999	50	20	IDGD	
Cc1c(C(C)(C)C)nn(-c2ccccc2)c1NC(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O	756603548	HVMTUVKDZSCBCH-CYBMUJFWSA-N	436.538	1.569	50	20	IDGD	
COC(=O)CCCc1nnc(NC(=O)NNC(=O)[C@H](C)Oc2ccccc2F)s1	756683222	GSOSCPSCRHLXJT-JTQLQIEISA-N	425.442	1.793	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)Nc2cccc(N3CCCNC3=O)c2)c2ccccc2c1=O	756790705	RRJKJWYOMDEUKV-UHFFFAOYSA-N	435.444	1.320	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2cnn(CC3CC3)c2)c1	756813243	MBKHIQZAWLPBTL-UHFFFAOYSA-N	434.522	1.790	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])o2)c(OC)c1	757177046	MKVYGAYLVJFSQY-ZDUSSCGKSA-N	432.389	1.731	50	20	IDGD	
COC(=O)CCc1csc(NC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)n1	757733628	CQKVEFDXOYYZSJ-UHFFFAOYSA-N	430.446	1.607	50	20	IDGD	
C[C@@H](NC(=O)OC(C)(C)C)C(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758782777	YPFKCSKMJWDYLN-CYBMUJFWSA-N	429.518	1.535	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)NC2CCN(c3cccnn3)CC2)cc1OC	759598772	OCOUEWBNWLXFLW-UHFFFAOYSA-N	428.493	1.887	50	20	IDGD	
CCCOc1cccnc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N(CC)CC)c1	760050640	KCBLRFVUXRGNGI-UHFFFAOYSA-N	434.518	1.976	50	20	IDGD	
Cc1c(C(=O)NNc2nccc(N3CCOCC3)n2)cnn1CCO[C@H]1CCCCO1	760173436	PPIFURREZFKIOZ-SFHVURJKSA-N	431.497	1.118	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@@H](C)C(=O)NNC(=O)c1ccnc2c(C(N)=O)cnn12	763457443	AQLQOJFDXKEBMW-NSHDSACASA-N	430.852	1.327	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)C(=O)Nc2cnccc2C)cc(OCC)c1OCC	763544579	ZGQHWVBPQDYRNR-UHFFFAOYSA-N	430.461	1.986	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)Nc1ccc(OC(F)F)c(Cl)c1	763575615	ZHYMCFCWZSGWSA-AWEZNQCLSA-N	441.774	1.867	50	20	IDGD	
CC[C@@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2cccc(C)c2)cc1	763624627	XLUQVNPLBJVIJY-OAHLLOKOSA-N	426.473	1.688	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1c(F)cccc1Br	763628303	IOCUHQRRXUSDRE-UHFFFAOYSA-N	434.225	1.944	50	20	IDGD	
O=C(COc1cccc(C(F)(F)F)c1)NNC(=O)C(=O)Nc1cccc(-c2nnco2)c1	763639029	JDTZJIVGEXQKMF-UHFFFAOYSA-N	449.345	1.920	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2ccccc2CS(C)(=O)=O)c1	763646682	HUWNDTRJZTYAQD-UHFFFAOYSA-N	433.486	1.013	50	20	IDGD	
COC(=O)Nc1cc(NC(=O)C(=O)NNC(=O)COc2cc(C)ccc2C)ccc1F	763668069	HNSPWPQWJOTNLU-UHFFFAOYSA-N	432.408	1.786	50	20	IDGD	
C#CCOc1cccc(NC(=O)C(=O)NNC(=O)COc2ccc(Br)cc2)c1	763694441	IZDDXENPNLITKH-UHFFFAOYSA-N	446.257	1.626	50	20	IDGD	
Cc1cc(OC(C)C)ccc1NC(=O)C(=O)NNC(=O)COc1ccccc1[N+](=O)[O-]	763805049	RJCQOMYWPHJRCJ-UHFFFAOYSA-N	430.417	1.855	50	20	IDGD	
Cc1nn(-c2ccccc2)cc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccccc1F	763858111	QJWIYMYHUPHOTC-CQSZACIVSA-N	425.420	1.873	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(C)c([N+](=O)[O-])c2)cc1	763861320	NZLQCJIMIZQZRT-ZDUSSCGKSA-N	430.417	1.855	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccccc1SCCC(N)=O	763874136	ZVPMLLMISOMMAJ-GFCCVEGCSA-N	448.476	1.347	50	20	IDGD	
CCNC(=O)COc1cccc(NC(=O)C(=O)NNC(=O)Cc2ccc(Cl)cc2)c1	763937110	WUHJFNKDDVZELU-UHFFFAOYSA-N	432.864	1.184	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1ccc(CS(C)(=O)=O)cc1	764012450	QMLVERIUFRIBOH-UHFFFAOYSA-N	439.877	1.293	50	20	IDGD	
O=C(NNC(=O)[C@H]1CN2CCCN1CC2)[C@@H]1Cc2ccccc2CN1Cc1ccccc1	764074179	DRSKCSCBIKVKEO-XZOQPEGZSA-N	433.556	1.151	50	20	IDGD	
CC[C@H](C)C(=O)NNC(=O)C(=O)Nc1cnn(C2CCN(C(=O)OC(C)(C)C)CC2)c1	764085439	QIJCKYMDTWUQRL-ZDUSSCGKSA-N	436.513	1.587	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccccc3-n3cncn3)n[nH]2)cc1	764111678	OTJPLOIHLJDPQD-UHFFFAOYSA-N	430.428	1.366	50	20	IDGD	
CCN(CC)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cccc(OC)c2O)cc1	764132319	NAHQXDWKTICOQV-UHFFFAOYSA-N	428.445	1.283	50	20	IDGD	
CC(C)Oc1cc(F)ccc1NC(=O)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	764260889	SPONGVFWIVBGBH-UHFFFAOYSA-N	444.467	1.405	50	20	IDGD	
N#Cc1cccc(COc2cccc(NC(=O)C(=O)NNC(=O)Cc3ccccn3)c2)c1	764268428	SFHLCEFBDUOBKH-UHFFFAOYSA-N	429.436	1.861	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)C(=O)Nc1cccc(COCCOc2ccccc2)c1	764296165	VSBHJDZAJLKGCG-UHFFFAOYSA-N	437.456	1.713	50	20	IDGD	
O=C(CCNC(=O)c1n[nH]c2ccccc12)NNc1c(F)cc(C(=O)NC2CC2)cc1F	764330240	YOPRWMLAZXAPGT-UHFFFAOYSA-N	442.426	1.997	50	20	IDGD	
C[C@@H](c1cccc(NC(=O)C(=O)NNC(=O)COCc2ccccc2)c1)N1CCOCC1	764362300	DAJNIDXWZBHLSR-KRWDZBQOSA-N	440.500	1.383	50	20	IDGD	
O=C(NNC(=O)C(F)(F)Oc1ccccc1)C(=O)Nc1cnn(-c2ccccc2F)c1	764369306	CGHDAPBZSJPPBC-UHFFFAOYSA-N	433.346	1.769	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CNC(=O)NNC(=O)c1nnc(O)c2ccccc12)C1CC1	764543430	GBEMITAWUKQBTJ-AWEZNQCLSA-N	430.465	1.583	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)CCC(=O)N1CCN(c2ncccn2)CC1	764637251	XOJPCIOKALCRHM-UHFFFAOYSA-N	446.895	1.029	50	20	IDGD	
COC(=O)c1c(CC(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)[nH]c(C(C)=O)c1C	765572240	WAURSRLYMXDMIB-UHFFFAOYSA-N	429.458	1.768	50	20	IDGD	
O=C(/C=C\c1ccc2ccccc2n1)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765739511	WKVKIQUJCWERTM-SEYXRHQNSA-N	443.507	1.853	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)N[C@@H]1CC(=O)N([C@@H]2C[C@@H]2c2ccccc2)C1	765799322	GWAKHXJLRUWPIH-JFIYKMOQSA-N	428.514	1.873	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)OCC(=O)CCN2C(=O)c3ccccc3C2=O)cc(C#N)n1C	767276880	JWXFYXIOYAQJRE-SXGWCWSVSA-N	430.420	1.911	50	20	IDGD	
O=C(COC(=O)c1c[nH]nc1-c1c(F)cccc1F)NNC(=O)c1cccc([N+](=O)[O-])c1	768136580	FPHOPGHLXBNHJX-UHFFFAOYSA-N	445.338	1.881	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)[C@H]3CC(=O)N(Cc4ccccn4)C3)n[nH]2)c1	768278857	OSFJTKCPPFQAMS-INIZCTEOSA-N	432.484	1.898	50	20	IDGD	
CCCC(=O)N1CSC[C@H]1C(=O)NNC(=O)c1cc(-c2ccc(OC)c(OC)c2)[nH]n1	768280279	XWNBCUIMZYCKDJ-HNNXBMFYSA-N	447.517	1.557	50	20	IDGD	
Cc1cc(C)n2nc(C(=O)NNC(=O)[C@H](C)Oc3cccc(Br)c3)nc2n1	769421534	VZJJWRRAHCQIIK-NSHDSACASA-N	433.266	1.732	50	20	IDGD	
COC(=O)c1cc(F)c(Br)c(S(=O)(=O)NNC(=O)NC2CCCC2)c1	769864028	BXBMBRFTGISMOJ-UHFFFAOYSA-N	438.275	1.810	50	20	IDGD	
Cc1ccn(CC(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)c(=O)c1	770822407	SGLNXCORVSANKC-UHFFFAOYSA-N	443.467	1.320	50	20	IDGD	
O=C(CCc1nnc(-c2ccccc2)o1)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772187788	FGESJTCYSVBYKH-UHFFFAOYSA-N	427.848	1.786	50	20	IDGD	
CC(C)c1nccnc1NNC(=O)CCc1nc2cc(S(=O)(=O)N(C)C)ccc2n1C	772865780	AHNROSZQXLIHET-UHFFFAOYSA-N	445.549	1.813	50	20	IDGD	
CC(C)(C(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1)c1ccc2c(c1)OCCO2	772898929	XJZBBWKSVYVGJH-UHFFFAOYSA-N	431.876	1.853	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(C)c(Br)cn1	773521519	DHBDRVNUMBLZGU-UHFFFAOYSA-N	435.278	1.880	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNc2cccc(C#N)c2)cc(OC)c(OC)c1OC	773680842	HXCBJYOJZPBQER-UHFFFAOYSA-N	442.428	1.843	50	20	IDGD	
CN(C)C(=O)[C@@H]1CC[C@@H](CNC(=O)CCC(=O)C(C#N)=C2N(C)c3ccccc3N2C)O1	775576729	NDPIEPZHRBDLHS-YWZLYKJASA-N	439.516	1.409	50	20	IDGD	
O=C(CN1CCC(c2nnc3n2CCCC3)CC1)NNC(=O)c1cccc([N+](=O)[O-])c1	775823110	FARCXYCLFRYPRP-UHFFFAOYSA-N	427.465	1.163	50	20	IDGD	
CN(C)c1ccncc1C=NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	776182592	BFADSLGFDYPKIL-UHFFFAOYSA-N	445.545	1.251	50	20	IDGD	
COC(=O)c1[nH]c(C)c(C(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)c1C	776205650	NLQNJEMJLYYYHH-UHFFFAOYSA-N	437.497	1.667	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1C[C@H](SC)[C@H](N2CCCC2)C1	776487143	VYUHDLOMBIJFCS-WBVHZDCISA-N	426.970	1.621	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)NCc1ncn(Cc2cccc(F)c2)n1	780850596	ANOCKLHZPAUSBF-UHFFFAOYSA-N	443.395	1.283	50	20	IDGD	
COc1ccc(NNC(=O)[C@H](CCS(C)(=O)=O)NC(=O)c2ccccc2Cl)nc1	781518604	HKHFSJJTMSNLRJ-HNNXBMFYSA-N	440.909	1.420	50	20	IDGD	
O=C(NNc1ncncc1Cl)C1CCN(S(=O)(=O)c2ccc(F)c(F)c2)CC1	781823652	LQIOPGRZIGQCLT-UHFFFAOYSA-N	431.852	1.952	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@]2(C[C@H]2C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)C1	781886763	RPMCBNULLVTCQU-OYHNWAKOSA-N	441.488	1.986	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCC[C@H](n3ccc(C(F)(F)F)n3)C2)n1	782533235	RYOYSHVCSWXABS-LBPRGKRZSA-N	430.456	1.694	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2cc(F)c(F)cc2Cl)nc1	783265831	YHZSNMGUNXMFMF-UHFFFAOYSA-N	447.851	1.782	50	20	IDGD	
CC(C)CCn1nc(C(=O)NN/C=C2\C(=O)NC(=O)c3ccccc32)c2ccccc2c1=O	783678759	LYOXSVDTBKVOOW-UYRXBGFRSA-N	445.479	1.988	50	20	IDGD	
Cc1nn(CC(C)C)c(C)c1S(=O)(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	783809719	FKQRRAONBFASIZ-UHFFFAOYSA-N	428.536	1.183	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2ccc(S(=O)(=O)N3CCC[C@H](C)C3)cc2)ncn1	783948048	QDJBTAFELKIFSG-ZDUSSCGKSA-N	432.506	1.287	50	20	IDGD	
CN(C)c1nccc(NNC(=O)C(=O)Nc2ccnc(OCC(F)(F)C(F)F)c2)n1	784971183	VHWOGVPPBUDLTQ-UHFFFAOYSA-N	431.350	1.299	50	20	IDGD	
CNS(=O)(=O)c1cccc(NC(=O)C(=O)NNc2ccc(OC)c(Cl)c2)c1C	785117632	MGOHOSMNXMXQAS-UHFFFAOYSA-N	426.882	1.647	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3cc(C)ccc3C)[nH]n2)cc1	785126952	VPMUJAFVGFUYOQ-UHFFFAOYSA-N	435.440	1.880	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2ccnn2Cc2ccccc2F)n1	785227021	YXWOYQDMUKFCGK-UHFFFAOYSA-N	426.456	1.789	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1c(F)cccc1-n1cccn1	785330118	FBRQWVLTSRLBPB-UHFFFAOYSA-N	447.448	1.505	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1cnn(-c2ccccc2F)c1	785331082	NYWRXHXFAJSGBL-UHFFFAOYSA-N	447.448	1.505	50	20	IDGD	
Cc1cc2c(Br)ccc(C(=O)NNC(=O)N[C@@H]3CCS(=O)(=O)C3)c2o1	785537778	BVANHTJYGIVULK-SECBINFHSA-N	430.280	1.635	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cccnc2-c2cnn(C)c2)c1C	786415194	ZXSLZAHUMRPTCR-HNNXBMFYSA-N	436.472	1.652	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)[C@@H]2CCCN(C(=O)NC3CCCC3)C2)cc1	786810545	GCUNTDUDOXKZIV-QGZVFWFLSA-N	430.505	1.663	50	20	IDGD	
C[C@@H](CN1CCOCC1)C(=O)NN=C1C(=O)Nc2ccc(Br)c(Cl)c21	788016777	XXVYZXFYOJFEOF-VIFPVBQESA-N	429.702	1.843	50	20	IDGD	
COc1ccc(OC)c([C@@H]2C[C@@H]2C(=O)OCC(=O)NNC(=O)Cc2nc(C)cs2)c1	788201919	RIPWLOKCQZVVCA-ZFWWWQNUSA-N	433.486	1.506	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2cn(-c3cc(C)cc(F)c3)nn2)c2ccccc2c1=O	789869316	UCUZGNKTOJWWCB-UHFFFAOYSA-N	449.446	1.910	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1)C(=O)Nc1cccc(N2CCC2=O)c1	790951446	FDTWQYHKIMIQMO-UHFFFAOYSA-N	436.403	1.352	50	20	IDGD	
CC(C)(C)C(=O)NNC(=O)c1cc(Br)c(C(=O)NNC(=O)C(C)(C)C)o1	792058321	SUAKFTWBQIFCSA-UHFFFAOYSA-N	431.287	1.656	50	20	IDGD	
COc1cc(C(F)(F)F)ncc1NC(=O)C(=O)NNC(=O)Cc1c[nH]c2ccccc12	792269864	WYYBDPFCZQHOKY-UHFFFAOYSA-N	435.362	1.919	50	20	IDGD	
O=C(NNc1ncnc2ccsc12)C(=O)Nc1ccc(Cc2nnc3n2CCC3)cc1	792281408	LYZVTWYAVGCMGH-UHFFFAOYSA-N	434.485	1.902	50	20	IDGD	
COc1cc(C(=O)CCC(=O)N([C@H]2CCS(=O)(=O)C2)N(C)C)cc(OC)c1OC	792855799	TYPQLJOJKKWFOR-AWEZNQCLSA-N	428.507	1.168	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(C)c(Br)n2)cc1C	793023310	MCGKPCXJRBMFNS-UHFFFAOYSA-N	435.278	1.934	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)[C@@H]2CCCN2c2ncnc3ccccc23)cc1	794732085	UUGMXYIKIQUMOX-IBGZPJMESA-N	440.529	1.992	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)NNc2ccc(-n3ccnc3)nn2)cc1OC	796655450	OIRNCPFEGOKWGF-UHFFFAOYSA-N	432.466	1.581	50	20	IDGD	
COC(=O)c1cc(F)cc(NC(=O)C(=O)NNC(=O)Cc2ccc(Cl)cc2)c1F	796999941	PSIOPIVYGGOQEM-UHFFFAOYSA-N	425.775	1.733	50	20	IDGD	
O=C(NCC(F)(F)F)NNC(=O)[C@@]12CCC(=O)N1c1ccccc1C(=O)N2C1CC1	798314240	CNMGMPGMWXBOCZ-QGZVFWFLSA-N	425.367	1.021	50	20	IDGD	
CCCCNS(=O)(=O)c1ccc(C)c(NC(=O)C(=O)NNc2ccnc(N(C)C)n2)c1	799834952	BXTFFDRFPUIZGV-UHFFFAOYSA-N	449.537	1.011	50	20	IDGD	
C[C@@H](c1cccc(S(N)(=O)=O)c1)N(C)C(=O)NNC(=O)Cn1ccc2ccccc21	799920336	DHJQKCISUKQMTK-AWEZNQCLSA-N	429.502	1.723	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)c(C)c1OC	804156596	JFEGGKARUINNDM-UHFFFAOYSA-N	435.502	1.402	50	20	IDGD	
CCN(C)C(=O)c1cccc(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)c1	806973471	CPFODBHAEJYFFQ-UHFFFAOYSA-N	432.864	1.597	50	20	IDGD	
Cc1cccc(NS(=O)(=O)c2ccc(C(=O)NNC(=O)N3CCN(C)CC3)cc2)c1C	807379796	DXAJDFGMLADIMN-UHFFFAOYSA-N	445.545	1.706	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NCCCN1C(=O)c2ccccc2C1=O	807495114	UYEFLZHLDZHWIF-CYBMUJFWSA-N	428.420	1.610	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@H]1CCN(c2ccccc2F)C1	809980609	RJUGGPAYMBNNMV-AWEZNQCLSA-N	433.509	1.715	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1cnnc(-c2ccccc2)c1	810593748	HUJOZOVQNBWNCX-UHFFFAOYSA-N	444.495	1.363	50	20	IDGD	
O=C(NNC(=O)c1ccc(Br)s1)C(=O)N1CCN(c2ccccc2)CC1	812451193	CQHFBJQGIUVNAF-UHFFFAOYSA-N	437.319	1.620	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCc2ccc(OC)nc2OC)nc1	812616829	QWIQZAYEYVIUSD-UHFFFAOYSA-N	438.510	1.351	50	20	IDGD	
CCOC(=O)c1ccc(NNC(=O)[C@@H](C)NS(=O)(=O)c2ccc(C#N)cc2)cc1C	812722505	SPFBYUVYKAFTHF-CQSZACIVSA-N	430.486	1.854	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)c2cc(F)cc(Br)c2N)c1	815248532	BXDFPVBTSBXDIP-UHFFFAOYSA-N	435.209	1.660	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)CCNS(=O)(=O)/C=C\c2ccccc2)cc1	834592631	AUGXMBKWBVGDMB-OWBHPGMISA-N	445.497	1.280	50	20	IDGD	
COc1ccc(NCC(=O)NN=Cc2c(N3CCOCC3)nc3ccccn3c2=O)cc1	864237129	KSQHWENHBFJJRK-UHFFFAOYSA-N	436.472	1.102	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)c1ccccc1)N(S(C)(=O)=O)CC2	913161535	NEGYRCFYHNVYNF-QGZVFWFLSA-N	447.513	1.414	50	20	IDGD	
CCCOc1ccc(C(=O)NNS(=O)(=O)c2cc(C(=O)O)c(O)cc2C)cc1OC	914688985	UTAJCBUTMSWRJH-UHFFFAOYSA-N	438.458	1.820	50	20	IDGD	
COc1ccnc(NNC(=O)CCCNS(=O)(=O)c2cccc(C(F)(F)F)c2)n1	914763201	YNCDQBBMKSBMAP-UHFFFAOYSA-N	433.412	1.706	50	20	IDGD	
CN(C)[C@H](CNC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)c1cccs1	915897765	KCTHSQBGUBRUHO-LJQANCHMSA-N	444.605	1.894	50	20	IDGD	
Cc1nn([C@H]2CCS(=O)(=O)C2)c(Cl)c1C=NNC(=O)CNc1ccccc1F	915919610	CQIQPXVDSALAIZ-LBPRGKRZSA-N	427.889	1.906	50	20	IDGD	
CCCOc1ccc(CNC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1OC	916393778	JRISQFHZOMKKEH-UHFFFAOYSA-N	425.449	1.604	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NC[C@@H](C)N2CCC[C@@H](C)C2)cc1	916450561	SNPMUPVOYHQEHQ-IAGOWNOFSA-N	439.582	1.066	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2cccc(Cl)c2)cc1	916649723	QUNJITMSKPTYOI-UHFFFAOYSA-N	440.909	1.409	50	20	IDGD	
CC(C)N1C(=O)c2ccc(C(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)cc2S1(=O)=O	916740710	GFSSYPLOMOORDT-UHFFFAOYSA-N	432.414	1.223	50	20	IDGD	
Cc1nn([C@H]2CCS(=O)(=O)C2)c(C)c1C=NNC(=O)Cn1c(C)nc2ccccc21	917026743	RDDYRRDITOCXSW-INIZCTEOSA-N	428.518	1.668	50	20	IDGD	
O=C(CC(F)(F)F)NNC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1	918365644	AJTSRKHSLSSOGA-GFCCVEGCSA-N	438.384	1.238	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1cccc(N2CCOC2=O)c1	919197739	GCZLGWKCVORGMM-UHFFFAOYSA-N	447.831	1.923	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)n(-c2cccc(C(F)(F)F)c2)n1	920932818	HQXXFGJDPZVYIC-NSHDSACASA-N	445.423	1.787	50	20	IDGD	
Cc1ncc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)c(C2CC2)n1	1116913125	BSBDQZPSLMXSNP-UHFFFAOYSA-N	443.529	1.912	50	20	IDGD	
COc1ccc(Cl)c(NC(=O)NNC(=O)Cc2ccc(S(=O)(=O)CCO)cc2)c1	1116939552	FWLJFRMTPVYKRP-UHFFFAOYSA-N	441.893	1.510	50	20	IDGD	
CNS(=O)(=O)c1ccc(Br)c(C(=O)NNC(=S)NCC2CCC2)c1	1261740555	GLLZEONTTKFJCX-UHFFFAOYSA-N	435.369	1.266	50	20	IDGD	
Cn1c(=O)cc(C(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)c2ccccc21	1318667823	MKFHAENSIASOJH-UHFFFAOYSA-N	428.489	1.947	50	20	IDGD	
O=C(NCc1cccc(OCC(F)(F)F)n1)NNC(=O)c1ccc2c(c1)OCCO2	1320915676	HRPOILBLDBJCTA-UHFFFAOYSA-N	426.351	1.938	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)CC1(CC(=O)N2CCOCC2)CCCC1	1322237187	ILWRCLOHWWHMBD-UHFFFAOYSA-N	427.505	1.224	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N[C@@H]2CCN(c3cnn(C)c3)C2)cc1Br	1322968387	CXRUEOMLPYYULO-GFCCVEGCSA-N	437.298	1.414	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnc3c(c1)CCNCC3)C2)[C@@H](F)Cl	1778028380	JAUMKDCFWHDEBA-DBXWQHBBSA-N	438.931	1.432	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cn4ccsc4n3)C2)C1	1778632143	UPHUKVGJFJHLDM-BDJLRTHQSA-N	427.324	1.623	50	20	IDGD	
C[Si](C)(C)c1cc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)co1	1779004011	VFGFFLTVCXHRLK-WMLDXEAASA-N	447.377	1.959	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1n[nH]cc1[N+](=O)[O-])C2	1779545552	WZLQMHQYUZWZOC-RDTXWAMCSA-N	439.545	1.297	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)CN3CCc4sccc4C3)CCO2)C1	1781215430	PSFCHDWFJFPHBG-OXQOHEQNSA-N	425.982	1.954	50	20	IDGD	
O=C(c1nc(O)n2c1CCCC2)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781331246	HEHTWIUALIDSJO-SUMWQHHRSA-N	445.289	1.059	50	20	IDGD	
O=C(c1ccc2ccnn2c1)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781333432	OJEOZETXQBYMKD-YOEHRIQHSA-N	425.258	1.468	50	20	IDGD	
O=C(/C=C/c1cccc(O)c1)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781335036	UYOGNWOHHGIOQQ-FPZRGXOSSA-N	427.270	1.926	50	20	IDGD	
Cc1cc(O)c([N+](=O)[O-])cc1C(=O)N1CC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1782104788	NZJHQJKKAAAASA-KRWDZBQOSA-N	432.260	1.856	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1c(O)cc(O)cc1O)C2	1782179891	WYUOFCRPIFUGHT-GQWAEJPESA-N	442.896	1.185	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4ccnn4c3)C2)C1	1782405823	GUSPOTXFCBMAAA-AUUYWEPGSA-N	435.322	1.809	50	20	IDGD	
COc1cccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](O)CCl)C3)c1F	1783088641	ARQCXFREGDUIMO-AKCHCHLHSA-N	428.888	1.562	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](C)Oc1ccccn1)CCO2	1783540334	UFQNSOPCKPQGOK-PMUMKWKESA-N	426.311	1.462	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3CC[C@H](C(=O)OC)CC3)[C@H]2C1	1784797063	CMZHRHCBDWTRQV-FRMKIJSPSA-N	428.957	1.963	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)c1occc1Br	1787586504	DQSQDQNPAJDKAS-UKJIMTQDSA-N	435.702	1.235	50	20	IDGD	
C[C@@H](Br)C(=O)NC1(c2ccc(NC(=O)CNCP(=O)(O)O)cc2)CCC1	1787970091	FYVUBCVDQZEEOK-LLVKDONJSA-N	448.254	1.629	50	20	IDGD	
O=C(CCc1cnc[nH]1)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1	1788140473	ZIJXMTYHMDXDHD-UHFFFAOYSA-N	432.289	1.470	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnn4cccnc34)[C@H]2C1	1788292562	HMIYDDBBZRVHQJ-DHMWGJHJSA-N	436.310	1.106	50	20	IDGD	
COc1nn(C)cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]2C1	1789865838	GKVFGIZWJMYFJT-MMNXLFCMSA-N	433.336	1.258	50	20	IDGD	
C[C@H](Nc1cnccn1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]2C1	1789870779	VOAVUEFOJSEQTD-OXMIBSBGSA-N	444.363	1.493	50	20	IDGD	
CN1CCC(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]3C2)CC1	1789920919	HPDCBTYITMCJLQ-QBYUYEEZSA-N	434.350	1.389	50	20	IDGD	
COc1ncc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]3C2)cc1C	1789922230	GKUDJEDWTOBQQZ-MXAVVETBSA-N	444.301	1.682	50	20	IDGD	
Cc1nc(F)ccc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]2C1	1789924810	XEWKYOHYBZTHGE-NHULGOKLSA-N	432.265	1.813	50	20	IDGD	
O=C(/C=C/c1ccc(O)cc1Cl)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21	1791188314	NGKDZFQGLITGGD-WVSAELBTSA-N	443.327	1.638	50	20	IDGD	
Cc1cccc(F)c1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2C1	1791293349	XYMARPUVEGYWAM-BQFCYCMXSA-N	434.512	1.100	50	20	IDGD	
COC[C@H](Cl)C(=O)NC1(c2ccc(NC(=O)C[C@@](C)(O)CC(=O)O)cc2)CCC1	1791596636	UBSKPFCPSVFBFN-HNAYVOBHSA-N	426.897	1.990	50	20	IDGD	
CCOC(=O)C(C)(C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](Br)CC)C[C@@H]21	1792228691	SUHGTZKSJZTZKD-XQLPTFJDSA-N	447.370	1.729	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(S(C)(=O)=O)c1	1792695762	FKOUVJQLVPUMPC-YALNPMBYSA-N	428.938	1.311	50	20	IDGD	
C[C@H](CBr)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cc1ccc3ncnn3c1)C2	1792991658	RBGZVDVCFBYFAZ-DMRZNYOFSA-N	434.338	1.941	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/c1ccco1)C2	1796439491	HTFYNRVBTRUGPP-NNBMIFGRSA-N	439.472	1.016	50	20	IDGD	
CCC[C@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnccc1C(=O)NN)C2)n1cccc1	1796828277	WRMXFOPXMYYVNU-AXVVYFOYSA-N	438.532	1.780	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccn3ccnc13)C2	1796892548	OHCRNBXXMJQJCL-CKFWPPNZSA-N	447.499	1.720	50	20	IDGD	
Cn1c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)ccc1C(F)(F)F	1797200714	WRAYINYSAYKWQG-MUJYYYPQSA-N	449.238	1.289	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(C)c(NC(C)=O)c1	1799716496	XFWBQOZGRKYBBH-ZMMAXQRCSA-N	437.924	1.410	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCc1cnc2[nH]ccc2c1	1800846493	WRVKKHJOHRDBJV-RMFSNUHRSA-N	444.608	1.937	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CCC[C@@H](C(=O)OC)C1	1800964488	OOAFFUUKIATICE-RFSXOUPVSA-N	428.957	1.963	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(OCC3CC3)cc1)C2	1800983207	RGGBDXPPONCNGX-HNJRGHQBSA-N	436.936	1.932	50	20	IDGD	
CC[C@@H](NC(C)=O)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@@H]1c1cccnc1	1802882303	NOGGUPSJMVHILA-ZJIFWQFVSA-N	443.317	1.693	50	20	IDGD	
Cn1c(C(=O)N2CC[C@@H](CNC(=O)CCBr)[C@@H]2c2cccnc2)cccc1=O	1806338604	CGNVAHDQCDVVSW-KXBFYZLASA-N	447.333	1.885	50	20	IDGD	
Cc1cnc(C(=O)N2CCCC3(CCN(C(=O)c4cnccc4C(=O)NN)CC3)C2)s1	1807915581	APPCRYJYVPBCGJ-UHFFFAOYSA-N	442.545	1.609	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)c3ccc(O)cc3F)CC2)C1	1809980902	ZCPYDWMMDJFDKB-UHFFFAOYSA-N	440.280	1.370	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)[C@@H](C)Nc2cnccn2)[C@H]1c1cccnc1	1810325458	NTAHOFGEAGBVIF-VYCZESIESA-N	446.939	1.632	50	20	IDGD	
CCC(=O)N[C@H](C)C(=O)N1CC[C@@H](CNC(=O)CO[Si](C)(C)C)[C@@H]1c1cccnc1	1810537394	FFOQZWKKDWAUKV-SYNHAJSKSA-N	434.613	1.854	50	20	IDGD	
CNC(=S)NCCC(=O)N1CC[C@@H](CNC(=O)C(Cl)Cl)[C@H]1c1cccnc1	1813078067	NJPAALOOGRROEX-GXTWGEPZSA-N	432.377	1.375	50	20	IDGD	
CCC[C@@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(=O)n3[nH]nnc3n2)[nH]n1	1815318945	QGQKWQZEEJAAGX-ZWNOBZJWSA-N	447.887	1.249	50	20	IDGD	
O=C(Cc1ccsc1)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1	1815354589	KFVATQLKNFFBBJ-HNNXBMFYSA-N	441.343	1.353	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc[nH]n2)n[nH]1	1815372274	VSJJQXFLIOVRSZ-SOAGAIGUSA-N	437.464	1.573	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(=O)n3[nH]cnc3n2)n[nH]1	1817467307	MYXNBHXNTGBCRV-GWCFXTLKSA-N	432.872	1.464	50	20	IDGD	
CCc1ccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)cn1	1817470896	LEYQPVUSMVNIJD-FQEVSTJZSA-N	447.304	1.667	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2n[nH]cc2[N+](=O)[O-])n[nH]1	1819659748	BEKSNOHYLMDROG-KOLCDFICSA-N	425.833	1.601	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)Cc2ccc3ncnn3c2)n[nH]1	1820703272	XMQNBDAMFRHFNO-ZBFHGGJFSA-N	445.911	1.941	50	20	IDGD	
Cc1ccc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)CCC(=O)NN(C)C)CC3)c(C)n1	1821090536	OFROSCJWOLSTQX-AWEZNQCLSA-N	444.561	1.754	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H]2CCCS2(=O)=O)n[nH]1	1821835353	DAJMFLQSGVYLAR-WCFLWFBJSA-N	447.355	1.762	50	20	IDGD	
CC(=O)C[C@@H](C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1822335408	JEOSXPSHJXBVHY-FZKQIMNGSA-N	426.282	1.011	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnn3c2OCCC3)[nH]n1	1822375452	DBINIHPPZXAPKK-UKRRQHHQSA-N	436.900	1.948	50	20	IDGD	
CC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CN1CCN(C(C)=O)CC1)CC2	1822848014	OLZJRIVEUMNCFB-KGLIPLIRSA-N	441.985	1.237	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@H]1CCc2nc(NC(=O)Cn3nccn3)sc2C1	1823109658	MNUIPCAPCYFLPW-UWVGGRQHSA-N	427.328	1.378	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)Cn3ccncc3=O)sc2C1	1824542213	KZBPXXHKBRONLX-NXEZZACHSA-N	440.323	1.095	50	20	IDGD	
O=C(Cn1cccc([N+](=O)[O-])c1=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](F)Cl)CC2	1824720943	GIFNBOXTLULIPV-AMIZOPFISA-N	443.844	1.360	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1c[nH]c(=O)cn1)CC2	1825645704	ILLPNCKERDKTOE-JGVFFNPUSA-N	426.296	1.236	50	20	IDGD	
C[C@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1)n1ccnc1	1827055844	LYRYZQMAZONAOH-DYESRHJHSA-N	438.337	1.057	50	20	IDGD	
CN1CCN(CC(=O)N2CCC([C@@H]3CCCCN3C(=O)CO[Si](C)(C)C)CC2)CC1	1829102998	UUMBAOPANMJHBK-FQEVSTJZSA-N	438.689	1.705	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)Cn2ccncc2=O)CC1	1829103811	OAJTUPUMSCXVLS-GOSISDBHSA-N	434.613	1.715	50	20	IDGD	
Cn1cc2cc(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)C(C)(C)CCl)CCO4)ccc2n1	1830365723	GEGISUAMFLEFQV-JOCHJYFZSA-N	448.951	1.908	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc4ccnn34)C2)C1	1831654567	VISKYSAZRMKXLX-LAUBAEHRSA-N	434.924	1.812	50	20	IDGD	
Cc1nnc(CC(=O)N2CCC(N3CCC(NC(=O)C(C)(C)CCl)CC3)CC2)o1	1833214238	NIXIMZRHLAEHNG-UHFFFAOYSA-N	425.961	1.757	50	20	IDGD	
C#CCO[C@H](C)C(=O)NC1CCN(C2CCN(C(=O)[C@@](C)(Cl)CCl)CC2)CC1	1833466820	SDNRCOZHFBJVPM-QRWLVFNGSA-N	432.392	1.833	50	20	IDGD	
CN(C)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1833665735	GCQRLWMIJNWROT-GOSISDBHSA-N	431.320	1.021	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3ncc(Cl)cn3)CC2)CC1	1834057478	HJJQUHJPSWPYLB-INIZCTEOSA-N	444.363	1.569	50	20	IDGD	
CCn1ccc(C(=O)N2CCC(N3CCC(NC(=O)CCBr)CC3)CC2)n1	1834421119	HVWJJRQFZXVRNH-UHFFFAOYSA-N	440.386	1.873	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)C)CCO2	1834734300	SBWDJAWKFYZVBC-OAQYLSRUSA-N	449.460	1.246	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC1CCN(C2CCN(C(=O)Cn3ccnn3)CC2)CC1	1836398579	OBWRKVHTCPWMTK-GOSISDBHSA-N	431.368	1.086	50	20	IDGD	
C[C@@H](CS(C)(=O)=O)C(=O)N1CCC(OC2CCN(C(=O)[C@H](F)Cl)CC2)CC1	1836873897	JOBNMKBLYGEHGH-WFASDCNBSA-N	426.938	1.200	50	20	IDGD	
O=C(c1cc(-c2cccnc2)[nH]n1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1838027858	RKEABFCUUJGDLQ-LPHOPBHVSA-N	437.859	1.076	50	20	IDGD	
COc1ccsc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)Br)C2)C1	1838299198	GAIZLHGKVQHLRK-YVEFUNNKSA-N	447.351	1.610	50	20	IDGD	
O=C1C[C@@H](C(=O)N2CCC(OC3CCN(C(=O)[C@H](F)Br)CC3)CC2)CCN1	1838648231	NIRKGFOCUIWOPB-LRDDRELGSA-N	448.333	1.202	50	20	IDGD	
CN(C)c1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)c1	1838925471	VSBVEIQUQGLDSU-IBGZPJMESA-N	430.332	1.626	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)cc1OC	1838931184	NLDKZPLEHSAUNH-VQIMIIECSA-N	430.860	1.308	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(C#N)cc1)CCO2	1838951239	FXYXFLZZGGWMRZ-OAQYLSRUSA-N	431.565	1.480	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccn(C(F)F)c3=O)C2)C1	1839145530	LCCWFVKWPWWROL-AUUYWEPGSA-N	447.866	1.331	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3n[nH]c4cccc(F)c34)C2)C1	1839147878	FVUYVTHZXZKVRZ-XCLFUZPHSA-N	438.887	1.789	50	20	IDGD	
O=C(c1cc(O)cc([N+](=O)[O-])c1)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1839414774	AUWQUYRPWFLPBE-KRWDZBQOSA-N	448.259	1.174	50	20	IDGD	
CC(C)c1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)no1	1840031421	PNEAQYWWDBXOEI-ACJLOTCBSA-N	444.326	1.651	50	20	IDGD	
CCOc1ccsc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](Cl)COC)CCO2	1840149359	MPJSKQNVKJXBIB-AUUYWEPGSA-N	446.953	1.471	50	20	IDGD	
COC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)C(C)(C)CCl)C1	1841226066	JTSUYGFYBFEDHE-CQSZACIVSA-N	431.961	1.995	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H]1C=C[C@@H](C(=O)N2CCCC23CN(C(=O)[C@H](O)CCl)C3)C1	1841920783	LYGCTQKZFAUIPS-QLFBSQMISA-N	427.929	1.259	50	20	IDGD	
Cc1onc(-c2ccccc2)c1C(=O)N1CCCC12CN(C(=O)CCC(=O)NN(C)C)C2	1842366336	KGZLVTOQANZHKX-UHFFFAOYSA-N	439.516	1.840	50	20	IDGD	
Cc1cc(C(=O)N2CC3(CCCN3C(=O)c3cccc(B(O)O)c3)C2)c(C(F)(F)F)o1	1843013612	OZAQXOWBAWGQDU-UHFFFAOYSA-N	436.195	1.417	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)c2cnc3c(Cl)cccn23)C1	1843210271	HFTOOOUYLZVJFX-UHFFFAOYSA-N	432.912	1.178	50	20	IDGD	
CS(=O)(=O)N1CCc2cc(C(=O)NNC(=O)c3ccc(Br)s3)ccc21	14936934	IVBSCKXXTVEICT-UHFFFAOYSA-N	444.332	1.908	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=O)CNc2ccc(OC)cc2)ccc1C	68976141	GTGPLOHCWYZZQG-UHFFFAOYSA-N	448.545	1.907	50	20	IDGD	
COC[C@@H](C)n1c(C)cc(/C=C(/C#N)C(=O)N2CCN(CC(=O)N3CCCC3)CC2)c1C	105338578	PIMKSZIDODSFJS-HBEGMLAUSA-N	441.576	1.986	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)NCc1cccc(Cn2cnc3ccccc32)c1	726253243	RLHOQIDNEDMIQF-UHFFFAOYSA-N	446.467	1.938	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CCNC(=O)c2n[nH]c3ccccc23)ccc1OC(C)C	726883737	GZEMOURLLFCLKI-UHFFFAOYSA-N	439.472	1.940	50	20	IDGD	
CC(C)N(CCC(=O)NNC(=O)c1csc(N2CCOCC2)n1)C(=O)OC(C)(C)C	727115892	RADOQUHXMGSRGR-UHFFFAOYSA-N	441.554	1.776	50	20	IDGD	
COc1ccc(C(=O)NNc2ccc(F)c(F)c2F)cc1S(=O)(=O)N1CCOCC1	727759703	RNRUIBVEAPTIOA-UHFFFAOYSA-N	445.419	1.890	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CCNC(=O)c2ccc(C)cc2O)cc(OC)c1OC	728064483	IUKTVRXSAFLMEU-UHFFFAOYSA-N	431.445	1.308	50	20	IDGD	
CCCCNC(=O)NNS(=O)(=O)c1cc(S(=O)(=O)N(CC)CC)ccc1Cl	728263172	SYHTYDMQYKIFGI-UHFFFAOYSA-N	440.975	1.663	50	20	IDGD	
CC(=O)Nc1cc(Cl)ccc1C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	728342405	DKSLTGOAKKMNEZ-QGZVFWFLSA-N	447.831	1.443	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)[C@@H]2CCCN2c2ccc(C#N)cc2)n1	728732888	TZTJQGXWGZEQBI-INIZCTEOSA-N	427.486	1.225	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1nn(-c2ccc(F)cc2)c2c1CCC2	728847783	PAEGBMPYEVDSPS-UHFFFAOYSA-N	449.490	1.968	50	20	IDGD	
N#Cc1ccccc1N1CCCN(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)CC1	728944662	IQKHVWSOSXZPRU-UHFFFAOYSA-N	431.460	1.101	50	20	IDGD	
CC[C@@H](NC(=O)NNC(=O)CCc1ccc(OC)cc1)c1cccc(S(N)(=O)=O)c1	729231352	UPTKGKOHVIZCOV-GOSISDBHSA-N	434.518	1.757	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)[C@H]2Nc3ccccc3S(=O)(=O)N2)c(C)n1-c1ccccc1	729258371	RKMDZHTVQANLGK-IBGZPJMESA-N	439.497	1.585	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)c1sccc1S(=O)(=O)N1CCCC1	729451474	XCGYUAANTSLIBA-UHFFFAOYSA-N	432.527	1.949	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)[C@@H]2CC(=O)N(c3cc(C)ccc3OC)C2)cn1	729692192	AFORRKGMGJVCLT-CYBMUJFWSA-N	429.502	1.778	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1cnn(-c2ncccc2Cl)c1C(F)F	730743353	MWJPCHSCSWQTOX-MRVPVSSYSA-N	433.824	1.054	50	20	IDGD	
Cc1c(C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)nnn1-c1ccc2c(c1)OCCO2	731453547	KNHWSYWPQXRTSN-ZDUSSCGKSA-N	441.419	1.715	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)C3(C(N)=O)CC3)c2)c(C)c1	731596164	WZMBAAOVMXIKKZ-UHFFFAOYSA-N	430.486	1.131	50	20	IDGD	
CCc1cc(N2CCC[C@@H](NC(=O)NNC(=O)C(=O)Nc3ccc(C)c(C)c3)C2)ncn1	732915016	YCOHKBGVCJPACI-GOSISDBHSA-N	439.520	1.594	50	20	IDGD	
C=CCn1c(=O)c2ccccc2n2c(SCC(=O)NNc3nccnc3Cl)nnc12	734260770	MYUDKAFLJZPBBL-UHFFFAOYSA-N	442.892	1.909	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)CC(=O)NNC(=O)[C@H](C)Oc2ccccc2F)cc1F	734808831	GIWIDVYKGGOMGJ-LBPRGKRZSA-N	440.424	1.556	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)CCC(=O)c2cccs2)CC1	735117930	JMELKWWJABPBJC-UHFFFAOYSA-N	437.547	1.185	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cnn(C)c2)cc1S(=O)(=O)Nc1ccc(C)cc1	735471153	RDYCLXABDHPQKR-UHFFFAOYSA-N	443.485	1.613	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CC(c2c(F)cccc2F)=NO1)C1CCN(c2ncccn2)CC1	736013885	ZLKODFLCKCRMRH-INIZCTEOSA-N	430.415	1.312	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)c2cccc(-n3cccn3)n2)cc1	736543333	HTOKYJNJCLEESD-UHFFFAOYSA-N	434.485	1.763	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)N2CCC(C(=O)NNc3ccnc(N(C)C)n3)CC2)cc1	740104553	NLLGUMCPGZAOCA-UHFFFAOYSA-N	446.533	1.289	50	20	IDGD	
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC[C@@H](C(=O)NNc2cccc(C(F)(F)F)n2)C1	740141623	KXLOYSVWKQDMTQ-GFCCVEGCSA-N	446.455	1.984	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)N2CCSC[C@H]2S(C)(=O)=O)N(C)c2ccccc21	742179924	RYPHVXDDSOILRC-LJQANCHMSA-N	448.570	1.603	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C[C@@H](C)/N=C2/NS(=O)(=O)c3ccccc32)cc1C	742472630	UCWIGADFSRFDHQ-OAHLLOKOSA-N	444.513	1.347	50	20	IDGD	
CN(C)CCOc1cccc(CNC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)c1	743549300	AOIWYRIXUMNWQM-UHFFFAOYSA-N	449.533	1.566	50	20	IDGD	
CN(Cc1ccccc1)C(=O)N1CCN(CC(=O)NNC(=O)c2ccc(C#N)cc2)CC1	744387200	QAAKXFYDHACNCG-UHFFFAOYSA-N	434.500	1.189	50	20	IDGD	
C[C@@H](CCOc1ccccc1)C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	745765081	NRSCYAPFYUQTPG-KXBFYZLASA-N	428.441	1.622	50	20	IDGD	
COCCN1CCC(NC(=O)NNC(=O)Nc2cc(Cl)c(OC)cc2OC)CC1	745780710	LYYUMNGUBGSORL-UHFFFAOYSA-N	429.905	1.804	50	20	IDGD	
Cn1ncnc1COc1ccc(S(=O)(=O)NNC(=O)Cn2ccc3ccccc32)cc1	746591691	PCMRHNRXPJTHJN-UHFFFAOYSA-N	440.485	1.359	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)c1c(F)ccc(S(=O)(=O)NC2CC2)c1F	746641767	UEWCZVQNVMMMMT-UHFFFAOYSA-N	449.439	1.057	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)CSCC(=O)c1ccc(Cl)cc1	747372886	QYSREXUABSIJSZ-UHFFFAOYSA-N	425.919	1.895	50	20	IDGD	
CCOc1c(OC)cc(CNC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1OC	747470803	BQZPGPUBOZJUSC-GOSISDBHSA-N	431.445	1.773	50	20	IDGD	
O=C(NNC(=O)C1CCN(S(=O)(=O)c2ccc3c(c2)CCCC3)CC1)c1ccc[nH]1	747663892	RUKJUKGVXSVSSV-UHFFFAOYSA-N	430.530	1.755	50	20	IDGD	
NS(=O)(=O)c1ccc(C(=O)NNC(=O)c2ccc3ccccc3n2)cc1Br	748050428	LOLVLESGGZZGKE-UHFFFAOYSA-N	449.286	1.720	50	20	IDGD	
CC[S@](=O)[C@H]1CCC[C@H](NC(=O)NNC(=O)c2csc(N3CCOCC3)n2)C1	750265229	AHLUFHGODXLSAU-RTPGUIODSA-N	429.568	1.004	50	20	IDGD	
O=C(NNC(=O)C1(c2ccc(Br)cc2)CCOCC1)[C@H]1CCS(=O)(=O)C1	751064882	ZVDUEWDCAWHFOF-LBPRGKRZSA-N	445.335	1.079	50	20	IDGD	
CCCCOc1ccc(C(=O)NNS(=O)(=O)c2cc(C(=O)O)ccc2O)cc1OC	751207768	RHRLPAJESGTXKM-UHFFFAOYSA-N	438.458	1.901	50	20	IDGD	
C[C@H]1C[C@@H](CCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)CCO1	753333683	DKKDMPVCINEQCM-HOTGVXAUSA-N	438.550	1.620	50	20	IDGD	
Nc1nc(Cl)cc(NNC(=O)CCNS(=O)(=O)c2cccc(Br)c2)n1	753451098	FNNUMTDBOHMDRI-UHFFFAOYSA-N	449.718	1.286	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)N3CCN([C@@H](C)C(=O)N4CCCC4)CC3)cc2C1	755086046	JVTYTSUBKBNWAS-HOTGVXAUSA-N	447.605	1.856	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)Nc2c(C)n(C)n(-c3ccccc3)c2=O)cc1	755319503	GIJYSZCBZWKIAS-UHFFFAOYSA-N	425.445	1.725	50	20	IDGD	
COc1cc(C=NNC(=O)Cn2c(C)nc3ccccc32)c([N+](=O)[O-])cc1OCC(=O)O	755524126	GFJUSYKYAYHFPL-UHFFFAOYSA-N	441.400	1.875	50	20	IDGD	
COc1ccc(S(=O)(=O)NC2CC2)cc1NC(=O)NNC(=O)c1ccc(C)cc1O	755615878	VNFFSAOWJMNFED-UHFFFAOYSA-N	434.474	1.616	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2ccc(CC(=O)N3CCOCC3)cc2)cc1OC	755861354	DGNLTBDKLWSGFB-UHFFFAOYSA-N	442.472	1.572	50	20	IDGD	
CC1(C)C(=O)Nc2ccc(S(=O)(=O)NNC(=O)c3cc(Br)c[nH]3)cc21	755954840	OSHQNCGDOIVIFK-UHFFFAOYSA-N	427.280	1.630	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2cccc([S@@](C)=O)c2)cc1	756527451	SHYYTAITLVRGTK-MUUNZHRXSA-N	438.531	1.206	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCN(C(=O)OC(C)(C)C)C[C@H]2C)cc1OC	756528469	MGUYPAXTMLWPNO-CQSZACIVSA-N	436.509	1.406	50	20	IDGD	
C[C@@H]1CN(C(=O)Cn2cc(NC(=O)NNC(=O)CCc3ccccc3O)cn2)C[C@@H](C)O1	756839412	RRCMKCKFQLKMLT-HUUCEWRRSA-N	444.492	1.010	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)Nc2ccc(F)c(S(=O)(=O)NC3CC3)c2)cc1	757874459	OZVBPHUBDMUYBI-UHFFFAOYSA-N	447.448	1.370	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)NCCc1cn2cc(Br)cc(C)c2n1	758694259	DZIYFPMIMAEAAG-GFCCVEGCSA-N	442.314	1.330	50	20	IDGD	
Cc1ccccc1-n1ncc(C(=O)NNC(=O)C(=O)Nc2ccccn2)c1C(F)(F)F	758832857	AFRMFRWWXFMUKB-UHFFFAOYSA-N	432.362	1.994	50	20	IDGD	
O=C(COc1ccc(Cl)cc1)NNC(=O)N=c1cc[nH]cc1I	760035648	ZXBCIZIRQAPTIG-UHFFFAOYSA-N	446.632	1.993	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)c2ccc(-n3ccnn3)cc2)cc1	760294008	CGYVIYCNDRKPKI-UHFFFAOYSA-N	434.485	1.763	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)n1	760850984	KJMVHPBRGLZSCI-UHFFFAOYSA-N	433.446	1.481	50	20	IDGD	
CC(=O)c1ccc(Oc2ccc(C(=O)NNC(=O)N[C@H]3CCS(=O)(=O)C3)cc2)cc1	761145929	KLGROSDSJRRKBN-INIZCTEOSA-N	431.470	1.813	50	20	IDGD	
O=C(CCC(=O)Nc1nnc(C2CC2)o1)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	763173542	OYXMSCCYOMIPKO-UHFFFAOYSA-N	427.396	1.656	50	20	IDGD	
COCCOc1ncccc1NC(=O)C(=O)NNC(=O)c1ccccc1Br	763482148	FNIXNFNBQLTBFZ-UHFFFAOYSA-N	437.250	1.269	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2ccc([S@@](=O)C(F)(F)F)cc2)c1	763629782	HYJMCIWCCLVHIN-SSEXGKCCSA-N	443.403	1.787	50	20	IDGD	
CCCCc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1	763717815	ACVGHKOWFAJZPF-UHFFFAOYSA-N	446.529	1.679	50	20	IDGD	
O=C(CN1CCCc2ccccc21)NNC(=O)C(=O)Nc1cccc(NC(=O)C2CC2)c1	763728224	JZZWFHMNEOOPIN-UHFFFAOYSA-N	435.484	1.574	50	20	IDGD	
O=C(CN1CCCc2ccccc21)NNC(=O)C(=O)Nc1ccc(O[C@H]2CCOC2)cc1	763728429	PXEOLSHMJQLLEH-IBGZPJMESA-N	438.484	1.393	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2ccc(SC(F)F)nc2)c1	763771688	DVTSPMHGHAZJIJ-UHFFFAOYSA-N	426.401	1.813	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)CCCC(=O)N3)c1	763772977	RJFBJFBISDCTPK-UHFFFAOYSA-N	426.429	1.378	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)C(=O)Nc2cccc3c2ccn3C)c2ccccc2c1=O	763791967	ZDQOGJOIKBPWQC-UHFFFAOYSA-N	446.467	1.869	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c(F)c1	763796752	GHMHFSPKUDOEGP-UHFFFAOYSA-N	448.476	1.318	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)C(=O)N2CCc3ccc(C)cc32)c2ccccc2c1=O	763801320	OCCZYNDCAUCSDM-UHFFFAOYSA-N	447.495	1.855	50	20	IDGD	
C[C@@H](c1ccccc1)n1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)n1	764004030	KQKIXTQZIYTLII-AWEZNQCLSA-N	435.440	1.663	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc(N2C[C@H](C)O[C@H](C)C2)nc1	764039962	AEHFJGHNDXDTEX-OKILXGFUSA-N	427.461	1.104	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(CN(C(C)=O)C(C)C)cc2)c1O	764130852	KJODWCSUZLFZSV-UHFFFAOYSA-N	442.472	1.557	50	20	IDGD	
Cc1noc(COc2ccc(NC(=O)C(=O)NNC(=O)[C@H]3Cc4ccccc4O3)cc2)n1	764168462	PERWBVFAPKSWHZ-QGZVFWFLSA-N	437.412	1.047	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)c(Cl)n1	764203080	JGAMUWRSTGKCHO-UHFFFAOYSA-N	429.861	1.134	50	20	IDGD	
O=C(Cc1ccccn1)NNC(=O)C(=O)Nc1ccnn1Cc1ccc(C(F)(F)F)cc1	764263296	DWDZWMVNSWLHBY-UHFFFAOYSA-N	446.389	1.674	50	20	IDGD	
CCCCn1nccc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccccc2OC)[nH]n1	764376266	ARFDVNAFKOZXCW-UHFFFAOYSA-N	425.449	1.482	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)c(N(C)C)n1	764387334	JYTQYOQVSFNDAF-UHFFFAOYSA-N	425.424	1.385	50	20	IDGD	
O=C(NNC(=O)[C@H]1COCCO1)C(=O)Nc1ccc(C23CC4CC(CC(C4)C2)C3)cc1	764428451	IAXDFFNPKNPALJ-VYBOSXCSSA-N	427.501	1.656	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@H](C)C(=O)NNC(=O)[C@@H](C)S(=O)(=O)C1CCOCC1	764561874	ACTOUBOUXUAHED-ZIAGYGMSSA-N	446.953	1.854	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)NCCCN2CCCO[C@H](C)C2)c2ccccc2c1=O	764571303	AYFZPVIMFTVFDM-MRXNPFEDSA-N	444.536	1.422	50	20	IDGD	
CCS(=O)(=O)c1cccc(CC(=O)OCC(=O)NNC(=O)Cc2ccccc2C)c1	764622608	QQBDEKQQFNPSRX-UHFFFAOYSA-N	432.498	1.264	50	20	IDGD	
CCC(=NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C)c1cc(Cl)ccc1OC	764812756	RFTIXFDUPYPIPY-UHFFFAOYSA-N	432.868	1.026	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNS(=O)(=O)c2cnn(-c3ccccn3)c2C)cc1C	765031535	COXFCDITNLQHEA-UHFFFAOYSA-N	428.474	1.141	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C2CCN(C(=O)c3ccc(Br)cc3)CC2)n[nH]1	765586459	WIXAEIFEQNYDEZ-UHFFFAOYSA-N	434.294	1.794	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2ccc(S(=O)(=O)NCCc3cccs3)cc2)n[nH]1	765586483	XEVHBQTZGAFONX-UHFFFAOYSA-N	433.515	1.375	50	20	IDGD	
CC[C@H](NC(=O)NNc1ccccc1S(C)(=O)=O)c1cccc(S(N)(=O)=O)c1	765757839	GTTMZENTFXVOSH-AWEZNQCLSA-N	426.520	1.515	50	20	IDGD	
Cn1ncc([N+](=O)[O-])c1C(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	766779072	TYVDXRDQBKVLHU-UHFFFAOYSA-N	447.415	1.105	50	20	IDGD	
O=C(CCCC(=O)c1ccc2c(c1)OCCO2)NNC(=O)c1ccc(-n2cnnn2)cc1	766967663	AMNCDOSFEGDGGI-UHFFFAOYSA-N	436.428	1.248	50	20	IDGD	
CC(C)(C)[C@@H](Br)C(=O)N1CCN(S(=O)(=O)c2ccc(C(N)=O)o2)CC1	767032437	MBQVILPSWJOMBJ-LBPRGKRZSA-N	436.328	1.021	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)CCCN1C(=O)c2ccccc2C1=O	767238176	FBRQUUMAAKJSOJ-UHFFFAOYSA-N	437.452	1.305	50	20	IDGD	
CCNS(=O)(=O)c1ccc(C)c(C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)c1	768267754	BRWUHLRWMAMDLD-UHFFFAOYSA-N	433.515	1.820	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NNc2ccc(OC)cc2[N+](=O)[O-])n(C)c1	768331463	DCHNNRONFMSYLQ-UHFFFAOYSA-N	425.467	1.729	50	20	IDGD	
COc1ccccc1NC(=S)NNC(=O)CN1C(=O)N[C@@]2(CCCC(C)(C)C2)C1=O	768559562	CZQNLLZCPJHXOO-HXUWFJFHSA-N	433.534	1.904	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H]2CCOC3(CCCCC3)C2)c1	769174110	DCIGKBZHIANZFO-INIZCTEOSA-N	438.550	1.763	50	20	IDGD	
CSCCNC(=S)NNC(=O)[C@@H]1CCCN1C(=O)c1ccccc1OC(F)F	770240118	MUDROCKFUYTADY-LBPRGKRZSA-N	432.518	1.751	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1	772131821	IYDOTJBJSDUXLM-RYUDHWBXSA-N	440.478	1.386	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)[C@@H]1C[C@H]1c1ccc2c(c1)OCCO2	772194772	DJEUTTUVOHMOJU-JKSUJKDBSA-N	429.860	1.679	50	20	IDGD	
COc1ccc([C@H](CC(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)NC(C)=O)cc1	772195622	BBLOYULMCUMNSX-SFHVURJKSA-N	446.891	1.380	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)c1	773081555	FSPBXAXFYKVQTB-UHFFFAOYSA-N	433.490	1.049	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)[C@@H]2CSCN2C(=O)C(C)(C)C)C1	773418359	TYAJXJMQOUIJEX-KBPBESRZSA-N	442.582	1.729	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NNC(=O)[C@@H]2CC(=O)N(Cc3ccccc3)C2)C1	773422679	XNNNVLNHGKLEKN-QZTJIDSGSA-N	444.532	1.830	50	20	IDGD	
Cc1ccc(-n2nc(C)cc2NC(=O)C(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)nn1	773493573	DCKPNSITRBXBQU-UHFFFAOYSA-N	437.504	1.581	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccc(CC(=O)N(C)C)cc1	774007570	BXQNXICWLRROQB-ZDUSSCGKSA-N	446.891	1.524	50	20	IDGD	
CC1(C)OCC(C)(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)CO1	775137047	RGFLPYXBYQBUSQ-UHFFFAOYSA-N	425.507	1.021	50	20	IDGD	
C[C@H](NS(=O)(=O)c1ccc(NC(=O)NNC(=O)CN(C)C)cc1)[C@H]1C[C@H]2CC[C@H]1C2	775460101	PCQHJEOGGCXDDC-YRBFXIGRSA-N	437.566	1.504	50	20	IDGD	
COCCO[C@H]1COCC[C@H]1NC(=O)NNC(=O)c1cc(F)ccc1Br	777276527	XMXVQKARZSNAPZ-KGLIPLIRSA-N	434.262	1.353	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CC[C@H](C(=O)NCC(F)(F)F)C1	778234821	NNTZEVVZXXXHDK-JTQLQIEISA-N	436.818	1.110	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-]	778441382	UCIBYGTXBCNYHT-UHFFFAOYSA-N	436.343	1.822	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)c1nnn(-c2ccc(F)cc2)c1C(F)(F)F	778442699	ZCXFGOSTEJYZHR-UHFFFAOYSA-N	446.361	1.711	50	20	IDGD	
C[C@@H]1OC(C)(C)N(C(=O)OC(C)(C)C)[C@H]1C(=O)NNC(=O)CNC(=O)OC(C)(C)C	778445935	XDUCAYCSAFAQKV-WCQYABFASA-N	430.502	1.419	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2	778527376	IWFFEVMCCCYJGC-UHFFFAOYSA-N	441.444	1.297	50	20	IDGD	
COc1cc([C@H](C)NC(=O)NNC(=O)CNC(=O)OC(C)(C)C)cc(OC)c1OC	778606407	OCNHYAILZFTTMO-NSHDSACASA-N	426.470	1.629	50	20	IDGD	
Cc1nc(CN2CCC(CNC(=O)NNC(=O)CNC(=O)OC(C)(C)C)CC2)oc1C	778666398	OTILWXVYYMUMTO-UHFFFAOYSA-N	438.529	1.359	50	20	IDGD	
O=C(/C=C/c1ccc(O)c(O)c1)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	779533303	IMVYXIVTNODHHV-XBXARRHUSA-N	444.919	1.730	50	20	IDGD	
O=C(NNC(=O)c1cc2nn[nH]c2cc1F)c1cccc(S(=O)(=O)N2CCCCC2)c1	781883824	QTIIDBYKZNKIET-UHFFFAOYSA-N	446.464	1.346	50	20	IDGD	
CC(=O)N1CCN(Cc2cccc(NC(=O)C(=O)NNC(=O)CC3CCCC3)c2)CC1	782117500	PSIDPADJDONZHB-UHFFFAOYSA-N	429.521	1.017	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)cc1)C(=O)Nc1ccc(Cl)c(-n2nnnc2C2CC2)c1	782831490	RXIXMFICGCGLEF-UHFFFAOYSA-N	441.835	1.298	50	20	IDGD	
Cc1cc2cc(NC(=O)C(=O)NNC(=O)c3csc(N4CCOCC4)n3)ccc2[nH]1	782897380	OFFVWMHUKLAZEZ-UHFFFAOYSA-N	428.474	1.169	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2Cl)cn1C	782926459	URXCLVSOAGITEP-UHFFFAOYSA-N	427.244	1.908	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccnn2C2CCCC2)nc1	783263850	LTZVSZJJUNJFCD-UHFFFAOYSA-N	435.510	1.162	50	20	IDGD	
CCOC(=O)c1cnn(-c2cccc(NC(=O)C(=O)NNc3cncc(Cl)n3)c2)c1C	783268923	XXSXEGUVNYTLEC-UHFFFAOYSA-N	443.851	1.883	50	20	IDGD	
COC(=O)c1cc(OC)c(OC)c(OC)c1NC(=O)C(=O)NNc1ccc(F)cc1F	783347142	GYZQBJLGKODASU-UHFFFAOYSA-N	439.371	1.859	50	20	IDGD	
COC(=O)[C@H]1CCCCN1C(=O)c1cccc(NC(=O)C(=O)NNc2cc(C)ccn2)c1	783934787	ZIZJOTLGOQDGBW-QGZVFWFLSA-N	439.472	1.640	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)cccc1[N+](=O)[O-]	784216141	NXLNBBSKSHKJFT-UHFFFAOYSA-N	433.446	1.426	50	20	IDGD	
Cc1c(NNC(=O)C(=O)N2CCc3cc(S(=O)(=O)N(C)C)ccc32)cccc1[N+](=O)[O-]	784354909	OWCJLVYEFFHGLW-UHFFFAOYSA-N	447.473	1.186	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCOCC2)cc1NC(=O)C(=O)NNc1ccc(F)cc1	784782049	NLAKNFTXLZVFIY-UHFFFAOYSA-N	436.465	1.237	50	20	IDGD	
O=C(NNc1ccc(F)cc1)C(=O)Nc1ccc(F)c(S(=O)(=O)N2CCOCC2)c1	784782403	DHMFDCJLBQSOKT-UHFFFAOYSA-N	440.428	1.068	50	20	IDGD	
CS(=O)(=O)c1ccccc1-n1cc(NC(=O)C(=O)NNc2cc(Cl)ccn2)cn1	784862066	WCYDKGUYHJQSJT-UHFFFAOYSA-N	434.865	1.406	50	20	IDGD	
C[C@H](C(=O)Nc1ccc(NC(=O)C(=O)NNc2cc(F)c(F)c(F)c2)cc1)n1cncn1	785083870	YNAUGGVMACZLRR-SNVBAGLBSA-N	447.377	1.977	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)[C@@H]1CCN(C(=O)OC(C)(C)C)[C@@H]1C	786378915	SCVOPAABNNDCFE-NVXWUHKLSA-N	433.505	1.874	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@]3(O)CCc4ccccc4C3)CC2)cc1	786390847	JRMVDWUPFLXNBB-VWLOTQADSA-N	436.556	1.180	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)[C@H]1CC(c2c(F)cccc2F)=NO1	786496759	KRQOHUVCGWLCKO-CQSZACIVSA-N	426.420	1.910	50	20	IDGD	
Cc1cc2c(cc1C)[C@@H](C(=O)OCC(=O)NNC(=O)[C@H]1COc3ccccc3O1)CO2	786955498	FCYREFRJBGKKDX-HNAYVOBHSA-N	426.425	1.310	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2cc(N3CCNC3=O)ccc2C)c1	787540562	ACEYZVABYCYVSS-UHFFFAOYSA-N	439.472	1.306	50	20	IDGD	
COc1ccc(OC)c([C@@H]2C[C@H]2C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)c1	788084965	DGINVGMKKZOFHF-GOEBONIOSA-N	446.529	1.870	50	20	IDGD	
CN(CCCC(=O)NNc1ccccc1S(N)(=O)=O)S(=O)(=O)c1ccc(F)cc1	788228065	IKMFETAINLOIHA-UHFFFAOYSA-N	444.510	1.017	50	20	IDGD	
O=C(O)c1cc(S(=O)(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)cc2c1OCCO2	788496751	YTHPAMRSHZAXFR-KSSFIOAISA-N	448.453	1.038	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(O[C@H]3CCOC3)cc2)c1	788720703	OGCSJAKLEZULCS-KRWDZBQOSA-N	433.486	1.179	50	20	IDGD	
CC(=O)Nc1ccc(CNC(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)cn1	789298573	FEKGJCALLUUQID-UHFFFAOYSA-N	437.460	1.475	50	20	IDGD	
Cc1c(CNC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cccc1[N+](=O)[O-]	790558325	IEPQZXHXCASGMF-UHFFFAOYSA-N	440.504	1.946	50	20	IDGD	
Cc1ccc(CN2CC[C@H](NC(=O)NNC(=O)c3cc(Br)c[nH]3)C2=O)cc1	790694752	JQJNOHQHOYJSOA-AWEZNQCLSA-N	434.294	1.831	50	20	IDGD	
CCN1CCN(c2cccc(NC(=O)C(=O)NNc3ccc4c(=O)[nH]ccc4c3)c2)CC1	793064578	CJBXWRRRULNIAD-UHFFFAOYSA-N	434.500	1.752	50	20	IDGD	
Cc1cc(C)c(C(=O)NNC(=O)C(=O)Nc2ccccn2)cc1I	793651603	WAYRNZSHDVACNE-UHFFFAOYSA-N	438.225	1.703	50	20	IDGD	
COCCNC(=O)c1cccc(S(=O)(=O)NNC(=O)c2ccc(Cl)cc2OC)c1	795289853	JJMDIUZMMORLPG-UHFFFAOYSA-N	441.893	1.348	50	20	IDGD	
COc1ccccc1-n1nccc1C=NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	797400200	QZYPBRVHHJMLRD-UHFFFAOYSA-N	427.486	1.895	50	20	IDGD	
CNC(=O)C[C@@H](NC(=O)NNc1ccc(S(=O)(=O)NC(C)C)cn1)c1ccccc1	797546250	VZNLCCIUGFNDAK-MRXNPFEDSA-N	434.522	1.272	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)c2ccccc2c1=O	797701388	NJPMOJCHRBLDMU-GOSISDBHSA-N	449.467	1.496	50	20	IDGD	
CC(C)(C)OC(=O)NCC[C@H]1CCCN(CC(=O)NNC(=O)c2cccc(C#N)c2)C1	799358943	OXVYDYBNFIBKLA-MRXNPFEDSA-N	429.521	1.946	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1nc2c(s1)C[C@@H](c1ccccc1)CC2	799437613	QQFFDIXEDYKTON-AAEUAGOBSA-N	437.547	1.506	50	20	IDGD	
NC(=O)c1cc(Br)cc(S(=O)(=O)NNC(=O)c2cc3ccccc3o2)c1	799536730	WBSJKCPSBCSPMK-UHFFFAOYSA-N	438.259	1.918	50	20	IDGD	
NS(=O)(=O)Cc1cccc(CNC(=O)NNC(=O)c2cc3c(s2)CCCCC3)c1	800718265	DWJBTQSZAXJBQN-UHFFFAOYSA-N	436.559	1.950	50	20	IDGD	
O=C(CCNS(=O)(=O)c1cccc(Cl)c1)NNC(=O)Nc1ccc2c(c1)OCO2	802105253	UFJDPIDVGAURFK-UHFFFAOYSA-N	440.865	1.590	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NC[C@H]2CC(c3ccc4c(c3)CCO4)=NO2)cc1OC	802334843	PMJVWPNSWIXLRX-MRXNPFEDSA-N	440.456	1.776	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)NC2C[C@@H]3CC[C@H](C2)N3CC(=O)N(C)C)c1C	804643927	TVCWMUKMUZJZRG-YGRVRWFCSA-N	441.576	1.858	50	20	IDGD	
Cc1cc(I)cc(NC(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)c1	806683856	NLBYXECLKYAEKE-VIFPVBQESA-N	437.259	1.187	50	20	IDGD	
CCC(C)(C)[C@H]1CCc2nc(NC(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)sc2C1	806753106	OQLVVSNAWZOGFW-QWRGUYRKSA-N	431.584	1.775	50	20	IDGD	
CCc1cc(NC(=O)C(=O)NNC(=O)c2nn(CC)c(=O)c3ccccc23)ccc1F	806974858	WPMZJNPQHBTDLL-UHFFFAOYSA-N	425.420	1.518	50	20	IDGD	
COc1ccc(I)c(NC(=O)C(=O)NNc2ncccc2F)c1	807300676	ICFXSFCJKSSISC-UHFFFAOYSA-N	430.177	1.916	50	20	IDGD	
Cn1nc(-c2ccc(F)cc2F)cc1NC(=O)C(=O)NNc1ccc(-n2ccnc2)nn1	807428229	AFINOWNCOVCTHB-UHFFFAOYSA-N	439.386	1.423	50	20	IDGD	
Cc1cc([N+](=O)[O-])ccc1NNC(=O)C(=O)Nc1cccc(S(=O)(=O)NC2CC2)c1C	807456230	BYNKTJVIRUHAJR-UHFFFAOYSA-N	447.473	1.734	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)CNS(=O)(=O)c3ccccc3F)n[nH]2)cc1	810147296	HXMAKECIEGEXHD-UHFFFAOYSA-N	431.449	1.264	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCc2nncn2C1)C(=O)Nc1cc(Cl)c(Cl)cc1Cl	815692085	IWOXALDULWIMNI-ZETCQYMHSA-N	431.667	1.587	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)C2CCN(S(=O)(=O)c3ccccc3)CC2)c1	825777482	WDOOGPGEJUAVLW-UHFFFAOYSA-N	446.529	1.355	50	20	IDGD	
CC(=O)N1Cc2ccccc2C[C@H]1C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	856531752	DTMILOUBICFHKX-QHCPKHFHSA-N	449.555	1.320	50	20	IDGD	
O=C(/C=C\c1cccs1)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	863950081	ROMQSWCCKOQQKG-POHAHGRESA-N	449.554	1.562	50	20	IDGD	
CCOc1ccc(C(=O)NNS(=O)(=O)c2ccc(S(C)(=O)=O)cc2)cc1OC	874073858	NRJWMWIZCIDMHA-UHFFFAOYSA-N	428.488	1.121	50	20	IDGD	
CS(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)c2ccc(Br)s2)cc1	874076698	XELAADOZXPFCDN-UHFFFAOYSA-N	439.334	1.537	50	20	IDGD	
Cc1ccccc1OCCCC(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	875623952	YFYMPFWTHLALLH-IBGZPJMESA-N	428.441	1.685	50	20	IDGD	
O=C(CCc1nnc(-c2ccsc2)o1)NNC(=O)c1csc(N2CCOCC2)n1	879699711	BCTSPNPVMXKJHP-UHFFFAOYSA-N	434.503	1.485	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)c2ccc(Br)s2)cc1C(N)=O	914746656	SKRSRIKVFUGSGX-UHFFFAOYSA-N	434.293	1.241	50	20	IDGD	
CCc1c(C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cnn1Cc1ccccc1	915282944	ZEWSKZSRVNGAFG-UHFFFAOYSA-N	426.498	1.972	50	20	IDGD	
CCC(CC)[C@@H](CNC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)N1CCOCC1	916255684	DEWQOZSXKWQSSC-GOSISDBHSA-N	444.536	1.015	50	20	IDGD	
Cc1nn(C(C)(C)C)c(C)c1C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	917291958	FMIUWMABFITFLB-INIZCTEOSA-N	430.461	1.399	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2nnn(-c3cccc(C)c3)c2C)c2ccccc2c1=O	917387289	LIBMPUSVCLFJHX-UHFFFAOYSA-N	431.456	1.689	50	20	IDGD	
Cc1ccc(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1Cl	917719418	HMNFRIVDEWCVHC-UHFFFAOYSA-N	431.923	1.522	50	20	IDGD	
O=C(NCc1ccc(N2CCOCC2)c(F)c1)NNC(=O)[C@@H]1COc2ccccc2O1	918217458	DTEMBCIPACRHLU-IBGZPJMESA-N	430.436	1.333	50	20	IDGD	
CCCCn1c(C)cc(/C=C(/C#N)C(=O)NCCC(=O)N[C@@H]2CCS(=O)(=O)C2)c1C	918569843	LFKZVGQKXOOQNI-XLXASQRYSA-N	434.562	1.622	50	20	IDGD	
O=C(NNC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1)N[C@H]1CCS(=O)(=O)C1	919883149	BCWMXBILECNNBH-HNNXBMFYSA-N	440.485	1.065	50	20	IDGD	
Cc1cc(C)nc(SCc2ccc(C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)cc2)n1	920297534	BCYDIAGHXXFGPF-ZDUSSCGKSA-N	437.547	1.084	50	20	IDGD	
COc1cc(C(=O)NNC(=O)N[C@@H]2CC(=O)N(c3ccccc3)C2)cc(OC)c1OC	921077087	MVWVAWYLHGCEEC-CQSZACIVSA-N	428.445	1.462	50	20	IDGD	
NC(=O)[C@H]1CCCN(c2ccc(C(=O)NNC(=O)c3cc(Br)c[nH]3)cc2)C1	1115885118	QBTLKVCVHQKORG-LBPRGKRZSA-N	434.294	1.554	50	20	IDGD	
O=C(CSc1nnc(C[C@@H]2CCS(=O)(=O)C2)o1)NNC(=O)c1cccc(Cl)c1	1317732598	WTLYXSBPQMNILY-JTQLQIEISA-N	444.922	1.254	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)Nc2ccc(N3CCN(C)CC3)c(C)c2)cc1	1320112338	GZZIVXSKFKFOAO-UHFFFAOYSA-N	427.505	1.987	50	20	IDGD	
O=C(NNC(=O)c1cncn1-c1ccccc1)Nc1cnn(Cc2nnc3n2CCCC3)c1	1322141777	SZKQXPNQFAXLPR-UHFFFAOYSA-N	446.475	1.511	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c(C(F)(F)F)c1	1325157321	MEBDCEGVBCOKKR-UHFFFAOYSA-N	444.435	1.903	50	20	IDGD	
COc1ccc(-c2cc(NC(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)ccc2OC)cc1	1325338672	JOOIAZVCRWIUOZ-CQSZACIVSA-N	433.486	1.958	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3cnn4c(C)cc(C)nc34)n[nH]2)cc1OC	1340601691	OJMKMHNCZZNJTA-UHFFFAOYSA-N	435.444	1.828	50	20	IDGD	
Cn1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](O)CCl)C3)c2cccnc21	1779185233	DURXXUNOMNOZGC-CSODHUTKSA-N	434.924	1.301	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc[n+]([O-])cc2)C1	1779939851	OLAWZGCCLUDGOJ-ZSZQSSIHSA-N	440.338	1.479	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cccc(SC)c3O)C2)C1	1780154639	UCFJHRDVZWPKPA-IFXJQAMLSA-N	428.938	1.811	50	20	IDGD	
COc1ccc(F)cc1C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781335631	XYCJOHWZLCSXNU-PBHICJAKSA-N	433.249	1.968	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)Cc3c(C)n[nH]c3C)C2)C1	1781433620	PKSSWXPYSCBFIT-YJBOKZPZSA-N	427.343	1.572	50	20	IDGD	
Cc1c(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)cc(Cl)cc1[N+](=O)[O-]	1781999401	PKBPZJWSUIBOHF-QAPCUYQASA-N	446.287	1.600	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)n1ccnc1C)C2	1782179307	WYQMANREIRRGJZ-CNVJLJKISA-N	426.945	1.520	50	20	IDGD	
CCN(CC)[C@H](C(=O)N1CC[C@@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1)c1ccccc1	1782813117	PCGWWHJCBYUNGH-DXIQSLLYSA-N	437.968	1.499	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cc4n(n3)CCC4)CCO2)C1	1783349344	KSBGJJRWFUYEOF-KBXCAEBGSA-N	425.327	1.446	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(CCN(C(=O)Cc3ccc4c(c3)CCO4)C2)C1	1783419257	GDJYKBNFSUEMDP-QFIPXVFZSA-N	432.593	1.845	50	20	IDGD	
O=C(Cc1ccc2c(c1)CCO2)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1783423401	ZSRRNZYEVRNSKX-HKUYNNGSSA-N	441.297	1.684	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cc(-n4ccnc4)ccn3)CCO2)C1	1783537547	OMTNUJNWRUWYJK-AUUYWEPGSA-N	448.321	1.494	50	20	IDGD	
O=C(/C=C/C(=O)N1CCO[C@@]2(CCN(C(=O)C(Cl)Cl)C2)C1)NCc1ccco1	1783945945	FZKJXZLVVZPBHK-WHLIDYPQSA-N	430.288	1.086	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3CC3)C[C@@H]21	1785079535	OZXWSRODRPFLMV-VGWMRTNUSA-N	429.945	1.508	50	20	IDGD	
O=C(c1cc(F)ccc1C(F)(F)F)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1785211665	QXXAEWZOVHAUQZ-PBHICJAKSA-N	438.805	1.888	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)Cn3cccn3)[C@H]2C1	1785445212	WUEIVLJFFIRYLE-OWYFMNJBSA-N	427.343	1.282	50	20	IDGD	
CC[C@H](C)[C@@H](N)C(=O)Nc1ccc(C2(NC(=O)c3cnccc3C(=O)NN)CCC2)cc1	1787990302	PESPAKAMJOMDDX-IFXJQAMLSA-N	438.532	1.806	50	20	IDGD	
O=C([C@H](O)CCl)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@]3(F)CCCCC3(F)F)[C@H]2C1	1788172113	SPXLVHNRQWSKDA-LHLGERLTSA-N	426.863	1.483	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](CN)c3ccccc3)C[C@@H]21	1788765303	ZMQSHPDKIQGIAL-MUGJNUQGSA-N	433.625	1.560	50	20	IDGD	
COCc1oncc1C(=O)Nc1ccc(C2(NC(=O)CCC(=O)NN(C)C)CCC2)cc1	1788832139	LTRPBIRIWDCZHY-UHFFFAOYSA-N	443.504	1.942	50	20	IDGD	
CCc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](Br)CC)C[C@@H]32)nn1C	1789068919	CWZSIJYKKJLPPF-FAYQHZLMSA-N	441.370	1.749	50	20	IDGD	
O=C(CCBr)NC1(c2ccc(NC(=O)[C@@H](O)N3CCOCC3)cc2)CCC1	1789555018	YICQCXRBIGFZLD-GOSISDBHSA-N	440.338	1.556	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)NC(=O)c3ccccc3)C[C@@H]21	1789864358	RGCZACSGHHZXDX-GBBGEASQSA-N	435.952	1.802	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CCc4nc[nH]c4C3)C[C@@H]21)[C@@H](F)Br	1789926939	LRKJZYUSXZJXQJ-PVIIJVKYSA-N	443.317	1.185	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3cnn(C)c3)C[C@@H]21	1790961963	SJPZCWWLOVJRSS-QAETUUGQSA-N	441.370	1.506	50	20	IDGD	
O=C(/C=C/c1ccc(O)cc1Cl)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21	1791188313	NGKDZFQGLITGGD-FSIDXWPRSA-N	443.327	1.638	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)COc3ccccc3F)C[C@@H]21	1791257494	KAFRWSKZCXERRE-XSWJXKHESA-N	428.888	1.438	50	20	IDGD	
CC(=O)N[C@@H](Cc1cccc(F)c1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCl	1793117779	DIYZHBXJCVKXMM-XCDZQEORSA-N	439.915	1.111	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](CC)N(CC)CC	1793461603	GISIYNOSSZRKPZ-QEOTZNIISA-N	432.403	1.870	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCc1cc(F)ccn1	1794023431	DEDHPFLUJIJWFF-FLTUCWPJSA-N	442.329	1.774	50	20	IDGD	
NC[C@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1ccccc1	1795675589	MGLXJXHEPOVPTD-XFIYOXNOSA-N	428.302	1.009	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1cnnc2ccccc12	1796890087	VUKBZJLDNPEIKU-OXUXUCFPSA-N	437.269	1.524	50	20	IDGD	
CC(C)(C)n1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCBr)C3)nn1	1798704586	GPALRCWHPOHJHQ-JJLQDPRZSA-N	428.331	1.021	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(-n2ccnc2)ccn1	1798728622	CZAJHXXEMSHTEM-ZJOBFFGXSA-N	448.321	1.254	50	20	IDGD	
CC[C@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1O)C2	1800073584	SYZKQXMNYUXXLK-IZKTWJBDSA-N	443.972	1.870	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C[C@@H](O)CNC(=O)OC(C)(C)C	1800182842	UUGAGHBKQXGDGU-YIDVYQOGSA-N	447.960	1.154	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](Br)CC)C2	1800644154	KUUQRXJMTRCXRD-NZEXEKPDSA-N	440.176	1.923	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c(c1)C(=O)CC3)C2	1800761555	AQZZLFXGMUFWEJ-MKXCTONWSA-N	435.318	1.802	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1(F)CN(C(=O)OC(C)(C)C)C1)C2	1802283353	SFHHACZJSFVSBE-LXTVHRRPSA-N	447.935	1.837	50	20	IDGD	
COC(OC)C(=O)N1CC[C@H](CNC(=O)[C@@H](C)CBr)[C@@H]1c1cccnc1	1803010670	IQGBRBZLBIOSJD-CFVMTHIKSA-N	428.327	1.737	50	20	IDGD	
Cn1cccc(C(=O)NC[C@@H]2CCN(C(=O)CCBr)[C@@H]2c2cccnc2)c1=O	1803829049	DPSJTLKSVDTURC-MAUKXSAKSA-N	447.333	1.885	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccccc1[N+](=O)[O-])c1ccc(B(O)O)cc1	1804338877	ZCDYSFAWOIKVSG-NBWRFPAISA-N	449.272	1.240	50	20	IDGD	
Cc1nc(CC(=O)NC[C@@H]2CCN(C(=O)[C@@H](C)Br)[C@@H]2c2cccnc2)no1	1804496585	QIDJGANLZQWEMC-HYSWKAIVSA-N	436.310	1.805	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@H]1c1cccnc1)c1ccc[n+]([O-])c1	1804783587	HRMNPJACVHLVJC-CWRNSKLLSA-N	437.269	1.725	50	20	IDGD	
Cc1ccc(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)nc1	1805867759	HTYIAPDTKVMOBE-UGKGYDQZSA-N	444.300	1.098	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@H](CNC(=O)[C@@H]2CCC(=O)N2)[C@@H]1c1cccnc1	1806639887	FQRVGPKBTWEIPF-PWDMQXDWSA-N	427.332	1.602	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)[C@H]2CC=CCC2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807363945	DJPRWNIGCOMOBW-DWLFOUALSA-N	433.317	1.437	50	20	IDGD	
Cc1csc(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)c1	1807366664	VHAPMXKZBHXENY-NQIIRXRSSA-N	449.341	1.765	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@H]1c1cccnc1	1808232221	LPIRRNSTKDAABI-XDQVBPFNSA-N	444.305	1.225	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)N1CC[C@H](CNC(=O)[C@@H](F)Br)[C@H]1c1cccnc1	1808668956	TXSYSRNWLMFYFQ-UIBBOPPKSA-N	441.301	1.469	50	20	IDGD	
CCOC(=O)C1(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](Cl)COC)[C@@H]2c2cccnc2)CC1	1812468060	MYYILLGJQHUMSB-YESZJQIVSA-N	437.924	1.685	50	20	IDGD	
CCOC(=O)/C=C/C(=O)N1CC[C@H](CNC(=O)[C@H](C)Br)[C@@H]1c1cccnc1	1812864019	JLUIOMGBKOLGOM-KIIDXJDUSA-N	438.322	1.990	50	20	IDGD	
O=C(CC1CCCC1)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1	1815354743	CCRMWSYNHHKOIH-INIZCTEOSA-N	427.335	1.629	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)/C=C/c2cccnc2)n[nH]1	1815963153	WPSQYLUXMYWFHQ-GFOMBABLSA-N	439.520	1.883	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)C(F)(F)C(F)(F)C(=O)O)CC2)[C@@H](F)Cl	1817116380	XHBOHGGKWUGCOV-MHTLYPKNSA-N	435.758	1.945	50	20	IDGD	
O=C(N[C@@H]1CCc2nc(NC(=O)[C@@H](F)Cl)sc2C1)c1cc(=O)nc2sccn12	1817125441	OJZIMZGABNYHDL-JMCQJSRRSA-N	441.897	1.973	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(=O)n3[nH]cnc3n2)n[nH]1	1817465241	VVIPJEJWIMRTJV-CYBMUJFWSA-N	446.899	1.712	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)Cc2cccs2)[nH]n1)c1ccc(B(O)O)cc1	1817471617	TXCXIMBPMDQCON-SFHVURJKSA-N	438.318	1.700	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H]1CC1(F)F)CC2	1819797329	SQHRBSSAMPWZPX-GZMMTYOYSA-N	436.444	1.023	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](F)Br)[nH]n1)c1ccnnc1O	1820054204	VWYKTCHDWWVUIK-CMPLNLGQSA-N	427.234	1.902	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@H](F)Br)CC2)c1n[nH]cc1[N+](=O)[O-]	1820304150	MJHHPTCQMBVLSY-FWOIEVBISA-N	447.246	1.691	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](C)NC(C)=O)CC2	1825451397	JWWHNZKGJCYICT-GDPRMGEGSA-N	431.356	1.753	50	20	IDGD	
CNC(=S)NCCC(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](C)Br)sc2C1	1825640606	DEBOPWNLXAPUQB-DTWKUNHWSA-N	448.412	1.323	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](C)Br)sc2C1	1825642344	PRIJMAKBFCEZHU-OPRDCNLKSA-N	429.340	1.529	50	20	IDGD	
O=C(c1ccc(O)nc1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827052506	LZIBJDGUODFYTL-FQEVSTJZSA-N	437.305	1.014	50	20	IDGD	
O=C([C@H](O)CCl)N1CCC([C@@H]2CCCCN2C(=O)c2cccn3c(O)nnc23)CC1	1827535584	NFVDSSKDZBCOLG-JKSUJKDBSA-N	435.912	1.268	50	20	IDGD	
Cc1ccc(C)c(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2cccc(B(O)O)c2)CC3)c1	1827551112	GYBVNMBYACNGMM-QGZVFWFLSA-N	449.341	1.979	50	20	IDGD	
Cc1ncc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)s1	1827965034	UJLDBPNBJSJYNP-IBGZPJMESA-N	441.362	1.678	50	20	IDGD	
CC[C@H](C)[C@@H](O)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1	1828923694	UOERVOQHSCUHDS-RYGJVYDSSA-N	445.564	1.325	50	20	IDGD	
N#CC1(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)CC2)CCC1	1828925864	RBFSLQIXGKISNK-IBGZPJMESA-N	438.532	1.612	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4c(c3)CC(=O)N4)C2)C1	1831652125	WLOLOSQDFMZLIM-VGSWGCGISA-N	449.935	1.659	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(OCC)nn3)C2)C1	1831654967	PEKPCASWGUFMKN-QRWLVFNGSA-N	440.928	1.353	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ncc(F)cc3F)CCO2)C1	1831968544	WUHOZEDJJXTLIK-GTNSWQLSSA-N	448.264	1.213	50	20	IDGD	
Cc1cc(CC(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)no1	1832129458	DZZDNQXAERBXDA-NRFANRHFSA-N	439.321	1.139	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCC(N2CCC(NC(=O)[C@H]3CCC(=O)NC3)CC2)CC1	1833122172	ZNBWPDFZDYGKEA-XOBRGWDASA-N	447.407	1.321	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)C3(c4ccc(O)cc4)CC3)CC2)CC1)[C@H](O)CCl	1833305863	AQOMXWPBZCIBGH-HXUWFJFHSA-N	449.979	1.595	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(OC)n3)CCO2)C1	1833762449	TVSRTEQXRGNYLB-MGPUTAFESA-N	425.913	1.568	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(N2CCC(NC(=O)C(C)C)CC2)CC1	1834390240	GAWOKVGNDJFBKU-PCLIKHOPSA-N	430.553	1.348	50	20	IDGD	
Cn1cc(C(=O)N2CCC(N3CCC(NC(=O)CCBr)CC3)CC2)cn1	1834421056	BBNBJNQOGFHRNZ-UHFFFAOYSA-N	426.359	1.390	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)Cc3ccccc3)C2)C1	1834822635	ZSZMCZMHUWKEML-IBGZPJMESA-N	425.323	1.471	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3cccs3)CCO2)C1	1836091560	PMNAWAUDQMSAEK-ROUUACIJSA-N	435.373	1.983	50	20	IDGD	
CC(=O)N[C@H](C)C(=O)N1CCC(OC2CCN(C(=O)CCBr)CC2)CC1	1837655047	NNEDUTRPAZBDBI-CYBMUJFWSA-N	432.359	1.295	50	20	IDGD	
Cc1noc(N)c1C(=O)N1CCC(OC2CCN(C(=O)[C@H](C)Br)CC2)CC1	1837861138	YDYLOJAFEAIRKD-NSHDSACASA-N	443.342	1.961	50	20	IDGD	
Cn1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)c(C(F)(F)F)n1	1837960769	TXVYOMXJFIAVPY-DOMZBBRYSA-N	442.797	1.043	50	20	IDGD	
COCCn1ccc(C(=O)N2CCC(OC3CCN(C(=O)C(Cl)Cl)CC3)CC2)n1	1838140166	MPLRTTQBIKCIIA-UHFFFAOYSA-N	447.363	1.945	50	20	IDGD	
O=C(c1cnc(Cl)s1)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1838160864	BDFCQGJAROYENM-AWEZNQCLSA-N	428.725	1.670	50	20	IDGD	
Cc1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)c1	1838941507	NPIWLNUEQCNGRZ-DNVCBOLYSA-N	425.323	1.848	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)cn1	1839151324	NVSOXJSBHTZBBP-MOPGFXCFSA-N	430.332	1.696	50	20	IDGD	
CC(C)n1cnc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)n1	1839152584	DYIWDOXYGIIINK-ROUUACIJSA-N	448.351	1.165	50	20	IDGD	
COCc1c[nH]c(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)c1	1839153649	MXAKPPXOVGGMCA-RTBURBONSA-N	448.347	1.467	50	20	IDGD	
Cc1nc(C)c(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)o1	1839200570	MMLVYZPSFXPYMJ-BBRMVZONSA-N	434.262	1.052	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)Cc1ccccc1)CCO2	1839956603	VUJCFXARIZMHGO-NNMXDRDESA-N	438.952	1.454	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccns3)C2)C1	1839962357	BRHJUYNHLYZWRB-BLLLJJGKSA-N	432.340	1.387	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)C(F)(F)C(F)F)C2)C1	1839962922	VKEIQRABLGVZEW-IINYFYTJSA-N	449.239	1.517	50	20	IDGD	
COc1cc(CCC(=O)N2CCOC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)ccn1	1840186959	RXLYFTCUTBIZML-IBGZPJMESA-N	446.331	1.283	50	20	IDGD	
COc1cccc(/C=C/C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)c1	1840189828	NOQSOJUGCURSHB-XJDXJNMNSA-N	443.327	1.969	50	20	IDGD	
O=C(C(Cl)Cl)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3CCc4ccccc43)C2)C1	1840190847	QJJICZFLIOPHSU-OXQOHEQNSA-N	427.328	1.977	50	20	IDGD	
CC(C)(C(=O)N1CCOC[C@]2(CN(C(=O)C(Cl)Cl)CCO2)C1)c1ccccn1	1840190979	YOOAKXMCCRBRHI-IBGZPJMESA-N	430.332	1.619	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCn3nc(C)cc3C)CCO2)C1	1840347825	ZDJWIAQLUHEFPM-YLJYHZDGSA-N	426.945	1.364	50	20	IDGD	
C[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1)n1cccn1	1840442959	SZIXCZJNKFGFSH-JLSDUUJJSA-N	433.336	1.137	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(F)cc3OC)CCO2)C1	1840641109	OOZOVMRPGYQNOE-JXFKEZNVSA-N	428.888	1.922	50	20	IDGD	
COc1cccc(CC(=O)N2CCCC23CN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C3)c1	1842709121	IRLWSCFZYJZWLJ-PCLIKHOPSA-N	437.500	1.575	50	20	IDGD	
C[C@H](Sc1cccs1)C(=O)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843011591	UCQZJINRXJXJPK-AWEZNQCLSA-N	430.360	1.426	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@H](NC(=O)OC(C)(C)C)C2CC2)C1	1843360632	FRIWRLJLKPALEY-CABCVRRESA-N	429.945	1.747	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)[C@H]1CCc3ccccc3O1)C2	1843416841	HEOITFWGWIIOEE-RHKYMZEHSA-N	449.511	1.718	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@H]2CN(C(=O)OC(C)(C)C)CC[C@H]2O)C1	1843824742	DDSLUFLGNXKDHW-OWCLPIDISA-N	443.972	1.825	50	20	IDGD	
NC(=O)NCC(=O)N1CC2(CCCN2C(=O)CCCCCCCCBr)C1	1847121356	FWYUEWODWQQONC-UHFFFAOYSA-N	431.375	1.984	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)c2ccc3c(c2)C[C@@H](C)N3S(C)(=O)=O)cc1	17161384	ZZDSBJJKVFUYIQ-CQSZACIVSA-N	445.497	1.324	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)CCNC(=O)c2ccc([N+](=O)[O-])cc2)cc1OC	23710320	PPQHKEUNOOCMQR-UHFFFAOYSA-N	430.417	1.583	50	20	IDGD	
N#CCCNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cc(Br)c[nH]2)cc1	23914971	DYVWOQGHLRBTQL-UHFFFAOYSA-N	440.279	1.044	50	20	IDGD	
C#CCNS(=O)(=O)c1ccc(C(=O)NNC(=O)[C@H](C)Oc2ccc(OCC)cc2)cc1	28318851	KWFHVIBAKIKDIH-HNNXBMFYSA-N	445.497	1.225	50	20	IDGD	
COc1ccc(COCC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)cc1	728215886	KXMBLKZJBNWRCL-UHFFFAOYSA-N	448.545	1.291	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNc2nc(-c3ccccc3)no2)sc1Br	729534238	LVXCCGZIMGYOCE-UHFFFAOYSA-N	444.292	1.965	50	20	IDGD	
NC(=O)[C@@H]1CCCN1Cc1cccc(NC(=O)NNC(=O)CCc2ccccc2O)c1	730020529	MAKPEOFLXWXKAO-SFHVURJKSA-N	425.489	1.627	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2ccc(N3CCOCC3)c(F)c2)cc(OC)c1OC	730160842	UFHPUANOBWASCF-UHFFFAOYSA-N	433.436	1.763	50	20	IDGD	
COC(=O)NCCC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	730770022	YIFASAPNKKATEA-UHFFFAOYSA-N	426.476	1.056	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)c2sc(-c3c(C)c(C)nn(C)c3=O)nc2C)c(O)c1	731224928	NNQBCVFCJGCDKB-UHFFFAOYSA-N	427.486	1.918	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)NCCCN(C(=O)C2CCC2)C2CC2)cc1C	731405895	QZPSGFFEUWWYOT-UHFFFAOYSA-N	429.521	1.754	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2ccccc2OC)cc1	731496593	IDXODVDAJOGAHQ-UHFFFAOYSA-N	434.518	1.870	50	20	IDGD	
CCCc1c(C(=O)NNC(=O)CNC(=O)c2ccco2)nnn1-c1cccc(Cl)c1	731576437	AQLAJXFJEMWPDO-UHFFFAOYSA-N	430.852	1.657	50	20	IDGD	
CS(=O)(=O)CCN1CCC(NC(=O)NNc2ncc(C(F)(F)F)cc2Cl)CC1	731686041	KNTRTIVXBOWAQQ-UHFFFAOYSA-N	443.879	1.889	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)N1CCN(S(=O)(=O)c2cccc(Cl)c2Cl)CC1	731848261	DORRLIQMSGGJGL-LLVKDONJSA-N	437.349	1.246	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2ccccc2S(C)(=O)=O)cc1Br	732037148	IIIHYYUEUCWJHS-UHFFFAOYSA-N	427.276	1.936	50	20	IDGD	
Cc1ccc(-n2nc(C(=O)NNC(=O)CCN3C[C@@H](C)O[C@H](C)C3)c3c2CCC3)cc1	732261426	MUZIGOPBZLCGJU-IAGOWNOFSA-N	425.533	1.930	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)N[C@@H](Cc1ccccc1)CN1CCOCC1	732476684	SDAQKSGTZPQWCF-SFHVURJKSA-N	428.489	1.045	50	20	IDGD	
C[C@@H](CS(C)(=O)=O)N(C)C(=O)NNC(=O)[C@@H](C)Oc1cccc(Br)c1	732677046	RFABYPFZEPANFT-WDEREUQCSA-N	436.328	1.322	50	20	IDGD	
Cc1cccc(-n2c(NNC(=O)[C@@H]3CCS(=O)(=O)C3)nc3ccccc3c2=O)c1C	733264389	KLXICFCJPCYJLU-OAHLLOKOSA-N	426.498	1.880	50	20	IDGD	
CCC[C@H](C)C(=O)NNC(=O)C[C@H]1c2cc(OC)c(OC)cc2CCN1S(C)(=O)=O	733358189	QDQASAKTUYKPHI-BBRMVZONSA-N	441.550	1.536	50	20	IDGD	
O=C(NNc1cnccn1)[C@@H]1CCCCN1S(=O)(=O)c1ccc(Br)s1	734242719	XEDJXBYWBHGSAW-JTQLQIEISA-N	446.352	1.987	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)C[C@H]3OCCc4ccccc43)cc2)CC1	734548310	CRIIFRPEWJSRIE-OAQYLSRUSA-N	444.557	1.770	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)[C@@H]2CC(=O)Nc3cc(F)ccc32)CC1	734825260	XNCRZONGTOLJCD-OAHLLOKOSA-N	449.483	1.981	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)c2ccccc2-n2cnnn2)CC1	734825516	IVMRVSKDAVANKI-UHFFFAOYSA-N	430.469	1.006	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cccc(-n3cccn3)c2)c1	735028262	HQISIXNZVKRSGB-UHFFFAOYSA-N	441.513	1.978	50	20	IDGD	
COC[C@H](C)n1c(SCC(=O)NNC(=O)c2cnn(C)c2)nnc1-c1ccccc1	735446239	GRKMMMSEUKFQBU-ZDUSSCGKSA-N	429.506	1.439	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)N[C@@H](C)C(=O)N2CCCC[C@H]2C)c2ccccc2c1=O	737053930	FXZKETLQCZIPKU-CABCVRRESA-N	442.520	1.711	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)C1CCN(C(=O)c2ccc(Cl)s2)CC1	740852568	CPOHZFQVYJQWBJ-UHFFFAOYSA-N	428.942	1.706	50	20	IDGD	
Cc1nn(C)c2sc(C(=O)N[C@H](C)C(=O)NNC(=O)c3ccc4c(c3)OCO4)cc12	742033269	MBLGQISCLWMDBV-SNVBAGLBSA-N	429.458	1.251	50	20	IDGD	
COc1ccccc1-n1cc(S(=O)(=O)NNC(=O)c2ccc3c(c2)OCCO3)cn1	743250619	FZSLPUSMLKTVOO-UHFFFAOYSA-N	430.442	1.275	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CC(=O)N(Cc2ccccn2)C1)c1cc(Br)ccc1O	743733958	WCMRJKZXHBDLQT-LLVKDONJSA-N	433.262	1.359	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccc(Cl)cc3)CC2)c1	744386236	HVNJJVHUAYBWJS-UHFFFAOYSA-N	425.876	1.431	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCCN2Cc3ccccc3C2)nc1	744886252	YWUQUIOFUVNJIZ-UHFFFAOYSA-N	432.550	1.754	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CSc2nnc(N3CCOCC3)n2CC(C)C)cc1	746221870	IXNMSJYEJIMSCB-UHFFFAOYSA-N	432.550	1.632	50	20	IDGD	
O=C(COC[C@H]1CCCO1)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	746386284	NVXJXDRDVGYGRH-GOSISDBHSA-N	447.513	1.122	50	20	IDGD	
C[C@@H]1OC(C)(C)N(C(=O)OC(C)(C)C)[C@@H]1C(=O)NNC(=O)Cc1cn2ccccc2n1	746637365	MJDHDTGHOCNIEF-GUYCJALGSA-N	431.493	1.785	50	20	IDGD	
COC[C@H](NC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)c1ccc(C)o1	746778558	WTKIYNAEGNJOFV-IBGZPJMESA-N	429.521	1.818	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNS(=O)(=O)c1ccc(F)c(C(=O)OC)c1	747596356	MKGDDXAYWBAPLJ-UHFFFAOYSA-N	426.422	1.400	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)Cc2c(C)[nH]c(-c3ccncc3)nc2=O)o1	747713402	VMRLUBKSGZYZJQ-UHFFFAOYSA-N	438.488	1.579	50	20	IDGD	
O=C(NNC(=O)c1ccc(COc2ccc(Cl)cc2)cc1)C1=NN2CCCN=C2N1	748013769	OUGKRAVELBJHCI-UHFFFAOYSA-N	426.864	1.658	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccnn2C)c1	748830866	IAGDQWIGYXRLER-UHFFFAOYSA-N	429.458	1.304	50	20	IDGD	
Cc1nc(C)c(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)s1	751201921	HKWPYHDLIFZQDU-UHFFFAOYSA-N	444.560	1.168	50	20	IDGD	
CCN1C(=O)[C@@H]2CN(C(=O)/C(C#N)=C\c3cc(C)n(C[C@@H]4CCCO4)c3C)CCN2C1=O	752507433	IUFMYEOJYZDZFP-CKMYNJMQSA-N	439.516	1.686	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)c1cnn2c1C[C@H](CNC(C)=O)CC2	753259137	QAMYEECWWAPHMS-CQSZACIVSA-N	431.518	1.144	50	20	IDGD	
Cc1ccc(CNC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c(N2CCOCC2)c1	753923006	CFPFJNBERGTTSZ-HXUWFJFHSA-N	426.473	1.502	50	20	IDGD	
Cc1cc(C)c(S(=O)(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1[N+](=O)[O-]	755027166	PKPHAGURRKRJRU-UHFFFAOYSA-N	434.478	1.228	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)Nc1ccc(N2CCCS2(=O)=O)cc1	755591262	BBRAWLXBUWOKIB-UHFFFAOYSA-N	432.458	1.464	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)Nc1ccccc1C(=O)N1CCOCC1	755622907	JRWXXPCSPIMDAP-AWEZNQCLSA-N	430.436	1.918	50	20	IDGD	
Cc1nnnn1-c1cccc(NC(=O)NNC(=O)c2cc(Br)ccc2O)c1	755757458	VOWBLGVZZJDQAQ-UHFFFAOYSA-N	432.238	1.905	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)Nc2cc(F)cc(N3CCOCC3)c2)c2ccccc2c1=O	756281186	VJNSWZZMRCTNQF-UHFFFAOYSA-N	440.435	1.376	50	20	IDGD	
CCOC(=O)[C@H](C)NC(=O)c1ccc(NC(=O)NNC(=O)c2cccc(OC)c2O)cc1	756790102	LSEZKXNGQIYSOK-LBPRGKRZSA-N	444.444	1.549	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNS(=O)(=O)c2ccc(-n3cc(C)cn3)c(F)c2)c1	757645781	PRHHBBBPOBVUKB-UHFFFAOYSA-N	434.449	1.960	50	20	IDGD	
Cc1nn([C@@H]2CCS(=O)(=O)C2)c(C)c1NC(=O)NNC(=O)C(C)(C)c1ccccc1	757871118	DKAUINVVAPAGKU-MRXNPFEDSA-N	433.534	1.990	50	20	IDGD	
Cc1noc(C)c1S(=O)(=O)N1CCC(C(=O)NNc2nc(O)c3ccccc3n2)CC1	758296048	RAHOBUCOXLADPQ-UHFFFAOYSA-N	446.489	1.484	50	20	IDGD	
Cc1nnc(-c2ccc(C(=O)OCC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)cc2)o1	758974048	XGAJIVLZMPBWRH-UHFFFAOYSA-N	425.357	1.571	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)c2ccc(S(=O)(=O)NCc3ccco3)cc2)nc1	759729227	QKTRQFABVJKLHX-UHFFFAOYSA-N	430.442	1.697	50	20	IDGD	
CCOCCCn1c(NNC(=O)[C@@H]2CCCN2C(=O)NC(C)C)nc2ccccc2c1=O	760588576	QBKPGPFIUMABKW-SFHVURJKSA-N	444.536	1.849	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)CN2C(=O)N[C@@]3(C[C@@H](C)CC(C)(C)C3)C2=O)n1	762899329	BHNXVUDTMUMRMX-LHSJRXKWSA-N	431.541	1.903	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCc2nc(C(C)(C)NS(C)(=O)=O)no2)N(C)c2ccccc21	763358409	OBFKFJFSJNBEBQ-UHFFFAOYSA-N	444.517	1.677	50	20	IDGD	
O=C(NNC(=O)c1ccc2ccccc2n1)C(=O)Nc1ccccc1C(=O)N1CCCC1	763451342	VBVRCWJOWPQFCH-UHFFFAOYSA-N	431.452	1.871	50	20	IDGD	
CCOC(=O)/C=C/c1ccc(NC(=O)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1	763468509	LOOJFAXZUVLBCF-DHZHZOJOSA-N	426.385	1.571	50	20	IDGD	
CCn1cc(NC(=O)C(=O)NNC(=O)CCCOc2ccc(Cl)cc2C)ccc1=O	763508817	DZURDNSYHJENIR-UHFFFAOYSA-N	434.880	1.775	50	20	IDGD	
CCCC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)COc2ccc(OC)cc2)c1C	763659838	SDKQOZCAAXDIMW-UHFFFAOYSA-N	442.472	1.907	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C)c(C)c2)cc1NC(C)=O	763664897	MLZOXTMVYXJWFL-UHFFFAOYSA-N	428.445	1.435	50	20	IDGD	
COC(=O)c1cc(Cl)cc(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)c1	763685317	AJAVEUXZHDFGRJ-UHFFFAOYSA-N	440.239	1.945	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)C(=O)Nc1cnn(CC(F)F)c1	763692424	BKXIZYLLWVLOGF-UHFFFAOYSA-N	446.208	1.076	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(NC(=O)[C@H]3CCCO3)cc2)c1	763754499	SXSGVXPKXUPAOL-GOSISDBHSA-N	439.472	1.270	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccc(NC(=O)C2CC2)cc1	763867357	UZDNOHYVFTWQSG-GFCCVEGCSA-N	428.420	1.728	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)C(=O)Nc1ccc(F)nc1	763883504	PNURFFYEKOOOPG-VIFPVBQESA-N	425.214	1.537	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2cc(CC3CC3)nn2-c2ccccc2)n1	763892759	KDJWJWZHPGRXSQ-UHFFFAOYSA-N	435.488	1.424	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)C(=O)Nc1ccc(Oc2cccc(F)c2)cc1	763996977	HPAXPJZLKHVNRC-LBPRGKRZSA-N	435.433	1.139	50	20	IDGD	
C[S@](=O)Cc1ccccc1NC(=O)C(=O)NNC(=O)c1cccc(C(F)(F)F)c1	764037093	HYWHYWGGONPJCO-LJAQVGFWSA-N	427.404	1.984	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)nc(C)n3C)o1	764139697	YWELVACELGZXFV-UHFFFAOYSA-N	426.477	1.716	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(n2cc(NC(=O)C(=O)NNC(=O)CC3CC3)cn2)CC1	764144046	SYRNFDGIELIDFI-UHFFFAOYSA-N	434.497	1.341	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNC(=O)CC2CCCC2)cc1S(=O)(=O)N(C)C	764185801	WELAHZVXXRLDIP-UHFFFAOYSA-N	440.522	1.002	50	20	IDGD	
CC(C)CCC(=O)NNC(=O)C(=O)Nc1cc(Br)ccc1N1CCOCC1	764203812	XLAKBHFXHQXYQQ-UHFFFAOYSA-N	441.326	1.808	50	20	IDGD	
O=C1C[C@@H](c2cccc(NC(=O)C(=O)NNC(=O)c3c(Cl)cccc3Cl)c2)CN1	764221378	OUPRKVJJHVJSOV-LLVKDONJSA-N	435.267	1.997	50	20	IDGD	
CSc1cc2c(cc1NC(=O)C(=O)NNC(=O)Cn1ccc3ccccc31)OCCO2	764242598	JCNRYPKNKSJUNA-UHFFFAOYSA-N	440.481	1.921	50	20	IDGD	
O=C(NNC(=O)c1cccc2ncccc12)C(=O)Nc1cccc(Cl)c1-n1cncn1	764261131	ZKBSQCVJNQCZNC-UHFFFAOYSA-N	435.831	1.869	50	20	IDGD	
CSc1nc2ccc(NC(=O)C(=O)NNC(=O)COc3ccccc3O)cc2s1	764278185	UPNHOCCJLZNTLG-UHFFFAOYSA-N	432.483	1.889	50	20	IDGD	
O=C(Cc1cc[nH]n1)NNC(=O)C(=O)Nc1ccc(F)c(NC(=O)C2CCCCC2)c1	764296897	IIFNOKUODNQSHI-UHFFFAOYSA-N	430.440	1.396	50	20	IDGD	
Cc1cccc(-n2ccnc2SCC(=O)NNC(=O)CNC(=O)c2cccnc2)c1C	764342017	BVMNAFALZLCEMB-UHFFFAOYSA-N	438.513	1.554	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)C(=O)Nc1cc(Br)ccc1-n1cccn1	764386152	ROYXNDWMGWTMBI-UHFFFAOYSA-N	443.261	1.738	50	20	IDGD	
C[C@H](NC(=O)c1ccc(Cl)cc1)C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C	765310120	ADHKQYHPKNBSPJ-LBPRGKRZSA-N	426.901	1.911	50	20	IDGD	
COc1ccc([C@@H](C)CC(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cc1	765735272	JDBPBABPIVXIPW-SFHVURJKSA-N	438.528	1.794	50	20	IDGD	
CC(C)OC(=O)C[C@@H]1CCCN(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)C1	766083850	CCHFEXHRCLHUGT-AWEZNQCLSA-N	439.538	1.388	50	20	IDGD	
CCCC(=O)N1CCC[C@H]1C(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	766664764	SIMALLPOVWCVAR-IBGZPJMESA-N	449.983	1.396	50	20	IDGD	
COC(=O)c1nccc2c(S(=O)(=O)NNC(=O)CSc3ccccc3O)cccc12	766850921	SWJVUWFUUMLJLD-UHFFFAOYSA-N	447.494	1.829	50	20	IDGD	
CC(C)(C)OC(=O)N1CCc2ccccc2[C@H]1C(=O)NNC(=O)CNC(=O)c1ccco1	769163523	BGQAOKQLFRDKKA-SFHVURJKSA-N	442.472	1.691	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(C)(C)N2C(=O)c3ccccc3C2=O)cc(OC)c1OC	769729155	SDIXGFAYDCZCJV-UHFFFAOYSA-N	441.440	1.548	50	20	IDGD	
CCCn1c(=O)nc(O)c2c(C(=O)NNC(=S)NCCSC)cc(C(C)C)nc21	770248885	WJBTXIKFXXUTPS-UHFFFAOYSA-N	438.579	1.502	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN[C@H](C(=O)OC)c2ccc(OC)c(O)c2)cc1C	770685602	AIRCVJRHQQUVAF-SFHVURJKSA-N	435.502	1.598	50	20	IDGD	
COc1ccccc1[C@]1(C)NC(=O)N(CC(=O)NNC(=O)Cc2ccc(Cl)cc2)C1=O	771232186	RETYOGGEVNSWFZ-NRFANRHFSA-N	444.875	1.506	50	20	IDGD	
COc1ccccc1[C@]1(C)NC(=O)N(CC(=O)NNc2ccccc2S(C)(=O)=O)C1=O	771571855	QWCUNOSZHUUBDY-FQEVSTJZSA-N	446.485	1.009	50	20	IDGD	
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	771608214	SMPUSXQJLQDFKD-UHFFFAOYSA-N	426.838	1.183	50	20	IDGD	
C[C@@H]1CN(c2ccnc(C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)c2)C[C@@H](C)O1	772224503	PCVQFDOHMSISAR-HZPDHXFCSA-N	439.520	1.163	50	20	IDGD	
CCc1nn(C)c(OC)c1CNC(=O)NNc1ccc(S(=O)(=O)N(CC)CC)cn1	772610211	SRLXKDLMXOKYBE-UHFFFAOYSA-N	439.542	1.243	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNS(=O)(=O)c1ccc2c(c1)oc(=O)n2C	773253096	XKMGCGYIRJULGL-SNVBAGLBSA-N	425.850	1.562	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(NC(=O)C(=O)NNc2nc(C)cc(C)n2)ccc1C	773478881	UIBHBISGFMBMNM-UHFFFAOYSA-N	434.522	1.514	50	20	IDGD	
C[C@H](CN(C)Cc1ccccc1)NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1	775772940	DNXSPJIEUMEDDK-QGZVFWFLSA-N	425.537	1.544	50	20	IDGD	
CC[C@H](C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1)c1ccc(OC)cc1	776232680	URYNHVSGBFIABY-SFHVURJKSA-N	447.561	1.663	50	20	IDGD	
CN(C(=O)OC(C)(C)C)[C@@H](C(=O)NNC(=O)[C@@H]1COc2ccccc2O1)c1cnn(C)c1	776318251	RXBZFTOAHZGHID-DLBZAZTESA-N	445.476	1.316	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)/C(=C\c1ccccc1)NC(C)=O	776718217	QAUBAQFDZDGFTL-LICLKQGHSA-N	445.859	1.830	50	20	IDGD	
COc1ccc(S(=O)(=O)C[C@H](C)C(=O)NNc2cccc(S(C)(=O)=O)c2)cc1	776720577	DMVLEJMHFIGPEH-ZDUSSCGKSA-N	426.516	1.652	50	20	IDGD	
Cc1cccc(NC(=O)N2CCC[C@@H](C(=O)NNC(=O)CNC(=O)OC(C)(C)C)C2)c1	778440182	BSUOUONCZZVHCP-OAHLLOKOSA-N	433.509	1.911	50	20	IDGD	
Cc1cc(Br)cc(S(=O)(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c1	780376199	CCMSVLPWOSKLJS-UHFFFAOYSA-N	447.332	1.784	50	20	IDGD	
NS(=O)(=O)c1cccc(NC(=O)C(=O)NNc2ccc(Br)cc2F)c1	783085521	JMXIVCIOVSEOTF-UHFFFAOYSA-N	431.243	1.317	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2cc(S(=O)(=O)N3CCCCC3)ccc2C)ncn1	783948914	VWGZVDXPKWRQRZ-UHFFFAOYSA-N	432.506	1.350	50	20	IDGD	
O=C(NNc1cc(F)c(F)cc1F)C(=O)Nc1ccc(F)c(S(=O)(=O)NC2CC2)c1	784892959	FGXBGNUZVATXQK-UHFFFAOYSA-N	446.382	1.766	50	20	IDGD	
CN(C)c1nccc(NNC(=O)C(=O)Nc2ccc(N3CCSCC3)c(Cl)c2)n1	784969825	AJSQHGUZHUFQJS-UHFFFAOYSA-N	435.941	1.831	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)Cc2ccccc2S(C)(=O)=O)c2ccccc2c1=O	785689949	VQXWBRRRJWMKNY-UHFFFAOYSA-N	442.497	1.385	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2nc(-c3cccc(F)c3)no2)c1	787406677	DNYHHEBRZCLDGM-UHFFFAOYSA-N	433.421	1.423	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cccc3c2OC(C)(C)C3)cc(OC)c1OC	789585658	BGFBDXCCQIFKAC-UHFFFAOYSA-N	443.456	1.826	50	20	IDGD	
COc1nc(Br)ccc1NC(=O)C(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	789586297	KADWBMNVKBHOSW-UHFFFAOYSA-N	438.194	1.161	50	20	IDGD	
COc1cc(OC2CC2)ccc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	790115234	ZOUFUFVKCWHHHO-UHFFFAOYSA-N	433.486	1.562	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)N2CCC[C@H](N3CCCS3(=O)=O)C2)c1C	790222345	PMZJUPQRDMODRX-ACSPXDACSA-N	434.562	1.685	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2ccc(OC(F)F)c(F)c2)c1	790340311	YQLPESOXBUSYBK-UHFFFAOYSA-N	438.405	1.454	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])c2ccccc2c1=O	790462840	OYPAYGRXKXHHNA-UHFFFAOYSA-N	433.783	1.638	50	20	IDGD	
COc1cc(N2C[C@@H](C(=O)NNc3nc4ccccn4n3)CC2=O)cc(OC)c1OC	791260712	QIRXNXSLCRMXPR-LBPRGKRZSA-N	426.433	1.251	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2cnc(CC(C)C)nc2)cc1	791949355	DASDUVZUQSLIDJ-UHFFFAOYSA-N	434.522	1.457	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccc2ccn(C)c(=O)c2c1	793022606	YRDPZVQKDWBAEQ-LBPRGKRZSA-N	426.404	1.231	50	20	IDGD	
O=C(NN=Cc1c(F)ccc(I)c1F)[C@@H]1CCS(=O)(=O)C1	794488422	NLBGJQVHWISKFV-SSDOTTSWSA-N	428.198	1.454	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cc(F)ccc2-n2cccn2)cc1OC	796086247	XCTJSDZKWXNLJO-UHFFFAOYSA-N	442.403	1.647	50	20	IDGD	
CC(C)(C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1)c1ccc2c(c1)OCO2	796536791	OHRBQAFASUCONH-SFHVURJKSA-N	442.424	1.224	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNC(=O)Nc1cccc(N2CCCNC2=O)c1	797630514	ZDZVOKPRTQXURE-UHFFFAOYSA-N	440.460	1.685	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)c1sc(N2CCOCC2)nc1-c1ccccc1	799637677	SAABRVNWQWBDMA-UHFFFAOYSA-N	445.545	1.713	50	20	IDGD	
CCCCNS(=O)(=O)c1ccc(C)c(NC(=O)C(=O)NNc2cccc(OC)n2)c1	799833760	CAZLGISNBMBFRS-UHFFFAOYSA-N	435.506	1.559	50	20	IDGD	
O=C(CSc1nnc(-c2ccco2)n1Cc1ccco1)NNC(=O)N=c1cc[nH]cc1	802026960	MJHRYLBAVNSDRD-UHFFFAOYSA-N	439.457	1.941	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)CN2C(=O)[C@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2=O)c(OC)cc1Cl	802086530	XHGSZJDTSMWJLP-CVSRONHPSA-N	448.863	1.317	50	20	IDGD	
COCCCOc1ccc(CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1	804867930	OUIIVAAZZBJQME-UHFFFAOYSA-N	449.533	1.539	50	20	IDGD	
CN(C)S(=O)(=O)C[C@@H](NC(=O)NNC(=O)c1cccc2ccccc12)C(F)(F)F	805148819	NJLQZHLCIPDIBV-CQSZACIVSA-N	432.424	1.606	50	20	IDGD	
O=C(NC[C@@H](N1CCOCC1)C(F)(F)F)NNC(=O)Nc1ccc(OC(F)F)cc1	805846444	LIRMCDSVXJAKJS-GFCCVEGCSA-N	441.357	1.887	50	20	IDGD	
CN(C)S(=O)(=O)C[C@H](NC(=O)NNC(=O)c1cc(-c2ccccc2)on1)C(F)(F)F	806565586	PENDFNUNCJDLLD-ZDUSSCGKSA-N	449.411	1.108	50	20	IDGD	
CC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cc(Br)ccc2O)ccc1F	806978512	DWHJOHMURBIWHJ-UHFFFAOYSA-N	438.209	1.896	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)C(=O)CC(C)(C)O3)c(OC)c1	806978572	GMGVNAVVQRNJIU-UHFFFAOYSA-N	441.440	1.847	50	20	IDGD	
COc1cc(OC)c(OC)cc1CNC(=O)NNC(=O)c1cc(Br)c[nH]1	807150436	OWXWATFJCVUNCW-UHFFFAOYSA-N	427.255	1.947	50	20	IDGD	
CCc1ccc(N2C[C@H](C(=O)NNc3ccc(S(=O)(=O)N(C)C)cc3)CC2=O)cc1	812726677	JLMHWANWDIOFIC-MRXNPFEDSA-N	430.530	1.996	50	20	IDGD	
CCOc1ccc([C@H](O)C2CCN(CC(=O)NNC(=O)Cc3nc(C)cs3)CC2)cc1	812863818	LTBJMSVXIHLNBR-QFIPXVFZSA-N	446.573	1.986	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)[C@@H]1COc2ccccc2O1)c1ccc(N2CCCNC2=O)cc1	812944294	LFIIWOADCUIKTF-KUHUBIRLSA-N	439.472	1.838	50	20	IDGD	
Cc1cnc(Br)c(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)c1	812979218	LFONPGBVVVKODH-UHFFFAOYSA-N	427.642	1.911	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCO1)C(=O)Nc1ccnn1Cc1cccc(Cl)c1Cl	815780127	KBTFHOXHULQQDV-GFCCVEGCSA-N	426.260	1.503	50	20	IDGD	
O=C([C@@H]1CCCN(c2ccccc2)C1=O)N1CCN(S(=O)(=O)CBr)CC1	815964338	FLUYNONITUSOBG-HNNXBMFYSA-N	444.351	1.256	50	20	IDGD	
NS(=O)(=O)C1(C(=O)NNC(=O)c2cn(-c3ccccc3)nc2-c2ccccc2)CC1	816815542	XOVSRPZQUZTPFY-UHFFFAOYSA-N	425.470	1.121	50	20	IDGD	
COc1ccc(CCC(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1Cl	818375967	WYUHKURZUHZCGK-GOSISDBHSA-N	448.859	1.812	50	20	IDGD	
Cc1cc(C)c(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)c(O)n1	821699849	PSRZHSPULUVPJM-UHFFFAOYSA-N	432.502	1.653	50	20	IDGD	
CN(C)N(C(=O)Cc1cc2c(cc1Br)OCCO2)[C@H]1CCS(=O)(=O)C1	849193258	AFEBWKJWCLLZTD-LBPRGKRZSA-N	433.324	1.255	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)C2(NC(=O)NCc3ccccc3)CCCC2)cc1	887910336	WTYLCZMEYNFALD-UHFFFAOYSA-N	435.484	1.897	50	20	IDGD	
CC(C)CNS(=O)(=O)c1ccc(C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)cc1	914749080	ADKPBECXMQVRPP-AWEZNQCLSA-N	437.493	1.989	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(N3C[C@@H](C)O[C@H](C)C3)nc2)cc1	915037494	PYPQTDYFTLNUGS-HZPDHXFCSA-N	426.473	1.622	50	20	IDGD	
COc1cccc(C[C@H](C(=O)NNC(=O)c2c(C)nc3ccccn23)n2nnnc2C)c1	916162068	DSAOWPPWNMYZFH-QGZVFWFLSA-N	434.460	1.191	50	20	IDGD	
CC(=NNC(=O)c1cccc([N+](=O)[O-])c1)c1ccc(S(=O)(=O)N2CCNCC2)cc1	916245610	MBMQOSSXUIOHKG-UHFFFAOYSA-N	431.474	1.343	50	20	IDGD	
O=C(NCCCN1CCN(c2ncccn2)CC1)NNC(=O)C12CC3CC(CC(C3)C1)C2	916266982	RSVTXKNXBXVJKN-UHFFFAOYSA-N	441.580	1.536	50	20	IDGD	
CCNC(=O)COc1ccc(C=NNC(=O)C(=O)Nc2ccc(C)c(C)c2)cc1OC	916544210	SVZKYUWFYUOWKP-UHFFFAOYSA-N	426.473	1.916	50	20	IDGD	
CC(C)CS(=O)(=O)CCC(=O)NNC(=O)[C@@H](C)Oc1cccc(Br)c1	916735395	RUHCKGBMRDZSFJ-GFCCVEGCSA-N	435.340	1.825	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)c3ccccc3C)CC2)cc1	916735978	UAFVUBZXIWTGRM-UHFFFAOYSA-N	430.530	1.071	50	20	IDGD	
O=C(COC(=O)CCc1ccc2ccccc2n1)NNC(=O)[C@H]1COc2ccccc2O1	917236630	REFYHLQVFWHADG-HXUWFJFHSA-N	435.436	1.698	50	20	IDGD	
CC(C)(C)NC(=S)NNC(=O)c1cc(S(=O)(=O)NCc2ccccc2)ccc1O	917573381	SFMZUCUOQWBKGM-UHFFFAOYSA-N	436.559	1.778	50	20	IDGD	
C[C@H](CN1CCCC1=O)NC(=O)NNC(=O)[C@@H](C)Oc1cccc(Br)c1	918099847	BZBCKURQXFLOKX-VXGBXAGGSA-N	427.299	1.558	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1	918219648	MKSGDIABXSAEOI-UHFFFAOYSA-N	446.479	1.948	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)NNC(=O)c1cc2c(s1)CCCCC2	918779102	AOTGRRXMKSVKHA-UHFFFAOYSA-N	440.489	1.282	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)cc1NC(=O)c1ccccc1F	919884890	IAPQODGKPYRORB-CQSZACIVSA-N	448.476	1.518	50	20	IDGD	
Cc1ccc(-n2cnnn2)cc1NC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	919897092	ZLRAPEXXDBTALF-UHFFFAOYSA-N	449.519	1.336	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)NC[C@@H](c1cccc(C)c1)N1CCOCC1	919903667	FISXHKHLWXJHRL-FQEVSTJZSA-N	426.517	1.950	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2ccccc2-n2ccnc2)c1	919920617	FMVKBNTWFUDGQR-UHFFFAOYSA-N	442.501	1.267	50	20	IDGD	
COc1ccc(OCCCNC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1	919922436	MKILESAUJCMNEH-UHFFFAOYSA-N	425.445	1.355	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(Cn3cccc3)cc2)c1	1318282881	ZKRVXZHXWPFMNK-UHFFFAOYSA-N	426.498	1.862	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)N[C@@H]2CCN(c3cnn(C)c3)C2)N(C)c2ccccc21	1318620778	KAQQPCXINJIQQC-MRXNPFEDSA-N	433.516	1.786	50	20	IDGD	
CC(C)n1ncc2c1[C@@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)CCC2	1325552952	KYZOTFBTVRRBJB-KRWDZBQOSA-N	448.549	1.736	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)Nc2ccnn2C[C@@H]2CCOC2)CC1	1325803646	OHLFEICNJYJVTG-AWEZNQCLSA-N	436.513	1.719	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)c2cccnc2N2CCOCC2)CC1	1328627418	SWRJOKHVRJDFPW-UHFFFAOYSA-N	433.509	1.326	50	20	IDGD	
O=C(CCc1nc(O)c2c3c(sc2n1)CCC3)NNC(=O)c1n[nH]c2c1CCCC2	1337140167	PBIKHTOIKLIQEH-UHFFFAOYSA-N	426.502	1.881	50	20	IDGD	
C[C@H](Nc1cnccn1)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2	1779059269	RLKQDZDVMRMAPM-KKXDTOCCSA-N	430.336	1.343	50	20	IDGD	
CN1CCCC[C@H]1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCBr)C2	1780588491	AKFFQDYIWIUIKY-FRQCXROJSA-N	430.387	1.770	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@](C)(Cl)CCl)C2)nn1	1780715408	RSSGWTDBWXNVPU-MDASCCDHSA-N	445.347	1.849	50	20	IDGD	
CC(=O)N[C@H](C(=O)N1CC[C@]2(CN(C(=O)C(Cl)Cl)CCO2)C1)c1ccc(F)cc1	1780911163	YNFWSXJXKWYOQU-HNAYVOBHSA-N	446.306	1.637	50	20	IDGD	
O=C(c1cnc2ccccn12)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781330463	XOUGSYKGGHPVJT-WMLDXEAASA-N	425.258	1.468	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)Cc2cc[nH]n2)C1	1781568698	URRFYLBLYTWDCY-HDMKZQKVSA-N	427.343	1.640	50	20	IDGD	
Cc1nnc(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](C)Br)C2)s1	1781998510	ZZBOZNXNJZTTAM-CJBNDPTMSA-N	445.383	1.686	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@]2(CN(C(=O)Cn3ccnc3)CCO2)C1	1782863459	BPKISEOKJQPIOS-IXNCKXOBSA-N	441.438	1.598	50	20	IDGD	
C[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@]2(CN(C(=O)CCBr)CCO2)C1	1783709386	YYEIAMYVNQOYFU-ACJLOTCBSA-N	448.358	1.515	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3cnccn3)[C@H]2C1	1784249956	QAQHUYCSWGJTEK-TUUVXOQKSA-N	425.327	1.172	50	20	IDGD	
O=C(CCCc1cccnc1)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1784674548	RMMBMGSPWBGEDX-FUHWJXTLSA-N	428.302	1.925	50	20	IDGD	
COc1cc(C(=O)N2CC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)ccc1[N+](=O)[O-]	1785182097	DDLVSJAMAMJGHP-KRWDZBQOSA-N	432.260	1.851	50	20	IDGD	
O=C(CCc1cc(F)ccn1)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21	1785236522	XAWJZOOGURPSDP-JQFCIGGWSA-N	442.329	1.918	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(C(=O)OC)cc3C)C2)C1	1785279203	OWCKQRJLSGCMPH-LAUBAEHRSA-N	438.908	1.479	50	20	IDGD	
C#CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@]2(CN(C(=O)C(Cl)Cl)CCO2)C1	1785575757	CMRJNKNYKZDGBR-BFUOFWGJSA-N	448.347	1.537	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(C(C)=O)[nH]n3)[C@H]2C1	1785840622	IGKSFSUUVQNZIO-JFILPPLUSA-N	441.326	1.379	50	20	IDGD	
CC(C)N[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)C(C)C	1786962150	HYPDIDWKGLEMLB-UVPYHEFZSA-N	436.366	1.679	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC1(c2ccc(NC(=O)c3cnn4ncccc34)cc2)CCC1	1788508513	VLQSLKNTNDNFMP-UHFFFAOYSA-N	449.515	1.850	50	20	IDGD	
CN(C)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]2C1	1788760975	HTYLBVHWZMDTHR-IEZWGBDMSA-N	434.613	1.592	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cncnc3C)[C@H]2C1	1788972024	XIZPVTXRCSZQBG-TUUVXOQKSA-N	425.327	1.552	50	20	IDGD	
Cc1cc(CCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]3C2)ccn1	1789922263	JJRGPESWLOWDCD-OVWQWFNUSA-N	442.329	1.993	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3cncnc3)C[C@@H]21)[C@H](F)Br	1789922924	UMGWKODCTDBJEG-YXWQFLTLSA-N	429.290	1.079	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4n(n3)CCCC4)C[C@@H]21	1791055712	GIAZGGHKRXTCKK-RMRKRWHISA-N	439.354	1.596	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3(Br)CC3)C[C@@H]21	1791060916	MLBUAEYTXVWJPT-BJDJZHNGSA-N	438.160	1.677	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(C)nc3OC)C[C@@H]21	1791255123	FZYMQQKOJPLRAI-LLLHUVSDSA-N	425.913	1.246	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1CCCC1	1792624371	CPULJQFCNHCYKX-BJWYYQGGSA-N	444.488	1.868	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(Cl)cc1F	1792648923	HACLOAFCSPZPEZ-DBWKPXFBSA-N	440.903	1.055	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nccc3[nH]ccc13)C2	1792868428	ZEPIOVGXHXGNGD-NFFDBFGFSA-N	435.322	1.797	50	20	IDGD	
Cc1cc(C(=O)NCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](C)CBr)no1	1792987165	KRDYTTUDEFWBQF-DEQVHRJGSA-N	441.326	1.382	50	20	IDGD	
C[C@H](CBr)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN1C(=O)CSC1=S)C2	1792992367	VGHJCXYYLVRRBX-WISYIIOYSA-N	448.408	1.516	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCl)c1nn(-c2ccccc2)c2c1COC2	1793110344	LVPLCPIPNHYDRO-YBKUAAOGSA-N	444.919	1.754	50	20	IDGD	
CS(=O)(=O)c1ccc(Cl)c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](O)CCl)c1	1793117775	DHLXNAJTZYURJO-AZKPJATDSA-N	449.356	1.595	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C[C@H]1CCCCO1	1794020952	GCLNWBRLBVLKQM-NDEFNWATSA-N	429.521	1.718	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnc2cc(Cl)ccn12	1796059076	CDLXLQXBVUMFMF-DMVWFOPNSA-N	441.315	1.445	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1snnc1C1CC1	1796706533	FIHZPWMJGBXIEI-BSTOTGJRSA-N	433.303	1.309	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1csc(C(F)(F)F)n1	1798258862	VABRKFWBKUMSLM-WYFGTUCQSA-N	441.859	1.619	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc([N+](=O)[O-])cc2c1OCC2	1798520554	YWRNNAAVEIHMEU-DLTLXFJOSA-N	437.880	1.750	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/C(C)C)C2	1798522911	DKEANQQWWGJUGU-CPVVTZALSA-N	445.472	1.936	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnnn1C)C2	1799220130	SKYLBTUWQZKIBL-BTTYYORXSA-N	442.432	1.214	50	20	IDGD	
C[C@@H](Nc1ccccc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Br	1799348956	DZWJNBBCYHYHJO-CNRIWFPOSA-N	428.302	1.767	50	20	IDGD	
COc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Cl)C3)c(F)c(OC)c1F	1799738558	BSODSGVFONFFTE-XOZCIVSQSA-N	436.814	1.720	50	20	IDGD	
CN(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C(C)(C)C#N)C2)NC(=O)NCc1ccccc1	1799866203	ZKPDBLLWTJTJNY-REPLKXPHSA-N	440.548	1.521	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc2nccn12	1799992523	XTUYSFUGGJUNFW-ZJOBFFGXSA-N	435.322	1.569	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc(F)cc1OC)C2	1800983158	PXKJIIWIYWJZNY-QHHYFVSCSA-N	428.888	1.220	50	20	IDGD	
O=C1CC(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C(Cl)Cl)=Cc2ccccc2N1	1801016426	KKNZHXZJWHVSKV-XOIINTDNSA-N	438.311	1.806	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)C#CC2(O)CCCCC2)[C@H]1c1cccnc1)[C@@H](O)CCl	1803142076	ABBHBXDPJPWARF-BJLQDIEVSA-N	433.936	1.386	50	20	IDGD	
Cn1ncc2cc(C(=O)N3CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]3c3cccnc3)ccc21	1803142865	LICGQBXRXRQMGO-LSTHTHJFSA-N	441.919	1.888	50	20	IDGD	
Cc1ccc(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)s1	1805409017	MRNGKFGODPDHKG-GHTZIAJQSA-N	449.341	1.765	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC2(CCCN(C(=O)[C@@H](C)CS(C)(=O)=O)C2)CC1	1806047661	NWFIFZMLRSUPBW-UONOGXRCSA-N	437.400	1.682	50	20	IDGD	
O=C(CC(F)(F)F)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1806835655	IQSDHFWWGULXDM-YJBOKZPZSA-N	435.211	1.033	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)C2=CCCS2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807358997	BXEOSUKJEMVYKY-PXNSSMCTSA-N	437.330	1.102	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]1c1cccnc1	1810548661	RZGBMBUFNQTIPP-LAUBAEHRSA-N	449.628	1.312	50	20	IDGD	
CCc1cc(C(=O)NC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)no1	1811002625	UVYNKKPFWIQUOK-KKSFZXQISA-N	442.520	1.325	50	20	IDGD	
CC(=O)N/C(C)=C/C(=O)NC[C@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1	1812317768	YYMIIBOZYSVBRX-LILOBXFESA-N	437.338	1.912	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)[C@H](C)n2ccnn2)[C@H]1c1cccnc1	1812400182	YLZVXZHNDLRJBV-WMHQRMGPSA-N	435.326	1.724	50	20	IDGD	
CCCC(=O)N[C@H](C)C(=O)N1CC[C@H](CNC(=O)[C@H](Cl)COC)[C@@H]1c1cccnc1	1813031094	JIBPYHLBRDULQR-MYZZLAAOSA-N	438.956	1.646	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2cc(OC)n(C)n2)[C@H]1c1cccnc1	1813033800	ZZNXHMPHGSUBDI-MPGHIAIKSA-N	435.912	1.397	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H](CNC(=O)[C@H]2CCNC(=O)C2)[C@@H]1c1cccnc1	1813139211	WVYURUSGJAPWDW-VPWXQRGCSA-N	432.597	1.465	50	20	IDGD	
C[C@]1(C(=O)N[C@@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)CC1(F)F	1815347881	VJKXOCZWLKXXKK-KZULUSFZSA-N	435.261	1.094	50	20	IDGD	
COC(C)(C)C(=O)N[C@@H]1CCc2nc(NC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)sc2C1	1817276869	ZNBPOAHXIHZLNN-BTQGWNRHSA-N	446.533	1.614	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC[C@H]1c1cc(NC(=O)C2=NNC(=O)C2)n[nH]1	1819338573	RMZAKSHHMVKCQZ-SKDRFNHKSA-N	425.287	1.309	50	20	IDGD	
CC(=O)N[C@H](C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](C)CBr)[nH]n1	1821967885	ZWBXRHJJGAECFJ-JTNHKYCSSA-N	428.331	1.957	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)C2CCC(CO)CC2)[nH]n1	1822410294	DIPXNLRXKKVBOE-HTWSVDAQSA-N	448.568	1.574	50	20	IDGD	
Cc1cc(CC(=O)N2CCCC[C@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)n[nH]1	1822415405	ZEOVZLXWPAPJLM-INIZCTEOSA-N	430.513	1.049	50	20	IDGD	
CN1CCN(C2(C(=O)N3CCCC[C@H]3c3cc(NC(=O)C(Cl)Cl)n[nH]3)CC2)CC1	1822420971	GXSJUXWYIAFMPF-AWEZNQCLSA-N	443.379	1.986	50	20	IDGD	
O=C(N[C@H]1CCc2nc(NC(=O)[C@H]3CC=CCC3)sc2C1)c1ccc(B(O)O)cc1	1822786280	DFBIJMYBAKJINY-BBRMVZONSA-N	425.319	1.405	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](O)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H](O)CCl)CC1	1824188193	OCPPAUJCVJQFQT-OWCLPIDISA-N	447.960	1.049	50	20	IDGD	
CN1CCCC[C@H]1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1	1824203723	HLNZYFCHIXTHPP-VXKWHMMOSA-N	441.381	1.084	50	20	IDGD	
O=C([C@H](O)CCl)N1CCC([C@@H]2CCCCN2C(=O)C(F)(F)C(F)(F)C(=O)O)CC1	1824865609	GUHKOWDNCGTWKU-NWDGAFQWSA-N	446.825	1.561	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)nn1C	1825899166	YGZZUHCTSZKUKG-LJQANCHMSA-N	432.569	1.335	50	20	IDGD	
O=C(Cc1cccnc1)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827054821	MACZRCDDPSNQAS-JOCHJYFZSA-N	435.333	1.237	50	20	IDGD	
C[C@@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1)n1cccc1	1827060453	JDVFCELMFQNGCW-PGRDOPGGSA-N	437.349	1.662	50	20	IDGD	
O=C([C@@H](F)Br)N1CCC([C@H]2CCCCN2C(=O)c2cnc(O)nc2O)CC1	1827590768	SIERAMRINWBZMU-CHWSQXEVSA-N	445.289	1.812	50	20	IDGD	
N#CC1(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)CC2)CCC1	1828925865	RBFSLQIXGKISNK-LJQANCHMSA-N	438.532	1.612	50	20	IDGD	
CCn1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)n1	1830538235	ZEHCWSVAZHVUKD-KBXCAEBGSA-N	443.342	1.004	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)CNC(C)=O)C2)C1	1831640566	NRKABEKCIVLTST-OXQOHEQNSA-N	431.961	1.013	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(C(C)=O)[nH]n3)C2)C1	1831644400	WZYHEILSENZLDZ-AUUYWEPGSA-N	426.901	1.090	50	20	IDGD	
COC(=O)NCC(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H](C)CBr)CC1	1832062290	AYXCCTVYNZXHQX-ZFWWWQNUSA-N	432.359	1.993	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCC(=O)N3CCCC3)CCO2)C1	1832418898	QUOPFKKMSMDLSA-DYESRHJHSA-N	443.972	1.253	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cn3nc(C)cc3C)CCO2)C1	1833035356	BWCDHIRVZCVUPT-XLIONFOSSA-N	426.945	1.364	50	20	IDGD	
Cc1ccc(C(=O)N2CCC(N3CCC(NC(=O)[C@H](O)CCl)CC3)CC2)c(F)c1	1833313227	AJTRBJBUCUVXKW-LJQANCHMSA-N	425.932	1.919	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCBr)C3)C2)s1	1833418959	UVHIBKUBHFLHAT-QGZVFWFLSA-N	447.351	1.612	50	20	IDGD	
Cc1nc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)ccc1F	1833461918	DUFOYUZGRSAXHD-HXUWFJFHSA-N	439.560	1.451	50	20	IDGD	
CCc1ncccc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)Br)C2)C1	1833517813	HQSXSSSXADDLIH-KUHUBIRLSA-N	440.338	1.497	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)COc3ccc(F)cc3)CCO2)C1	1834964217	QFWCHVUZRFUCJY-PXNSSMCTSA-N	428.888	1.678	50	20	IDGD	
Cc1cccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)c1	1835042271	DUVLAHNEHIPIFY-JXFKEZNVSA-N	439.350	1.777	50	20	IDGD	
N[C@@H](Cc1cscn1)C(=O)N1CCC(N2CCC(NC(=O)[C@H](F)Cl)CC2)CC1	1835079875	YYMCCNUVFKSXHZ-HOTGVXAUSA-N	431.965	1.119	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3ncon3)CC2)CC1	1836046755	JNAHPLLKKYCZRP-CQSZACIVSA-N	428.331	1.428	50	20	IDGD	
O=C(c1cc(C(F)F)no1)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836718297	UQHRZXYYLHINPL-CQSZACIVSA-N	435.855	1.824	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@H](C)n3cnnn3)CC2)CC1	1836921858	AZWQVVQDHXRSOT-WMLDXEAASA-N	426.949	1.640	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@@H]3CCCS3(=O)=O)CC2)CC1	1836922669	OVSJJWASPSTLCE-ROUUACIJSA-N	449.013	1.970	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc4cncn4c3)CCO2)C1	1837118201	MKBZZIYVEZENDY-NRFANRHFSA-N	434.924	1.669	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccncc3Cl)C2)C1	1837715339	LLCTVWSLTYUDMT-IBGZPJMESA-N	441.988	1.657	50	20	IDGD	
Cc1nc(F)ccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1838261647	IBUXAVNFACMPFX-FQEVSTJZSA-N	427.904	1.864	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)n(C(F)F)n1	1838710311	VLPAHJOZNULXFM-IBGZPJMESA-N	448.898	1.922	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(C#N)c[nH]3)CCO2)C1	1838738919	GDNFPJVKDKXSTJ-ZWKOTPCHSA-N	429.304	1.193	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(C(C)C)no3)CCO2)C1	1838779009	OEGIZIZSYZWCKN-AUUYWEPGSA-N	429.901	1.122	50	20	IDGD	
O=C(C1CC2(CCC2)C1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839203514	NKCIYTIUUMLPES-RDTXWAMCSA-N	433.318	1.714	50	20	IDGD	
C[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1)[S@@](=O)c1ccccc1	1839672451	KLNUIWJGCHKHFW-WQNWTMBQSA-N	446.928	1.174	50	20	IDGD	
CCc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](Br)CC)CCO3)no1	1839966283	ZUYBSKMAHGCBRQ-KSSFIOAISA-N	444.326	1.481	50	20	IDGD	
COc1cccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)c1	1840034515	OBBJJNWTWJVFIS-AUUYWEPGSA-N	441.322	1.549	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3CCCCC3(F)F)C2)C1	1840150124	FRRBJHWNNVNDTJ-RLFYNMQTSA-N	438.899	1.522	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc4ccn(C)c34)C2)C1	1840152756	RZROHTDFVNSGHN-XMSQKQJNSA-N	449.935	1.502	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3c(F)cccc3F)C2)C1	1840154244	QIRPUYFRRITPFG-YJYMSZOUSA-N	432.851	1.289	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(OC)ccc3F)CCO2)C1	1840687089	VWQZEYODORXZCE-OXQOHEQNSA-N	444.887	1.158	50	20	IDGD	
COc1ccc([N+](=O)[O-])c(C(=O)N2CCCC23CN(C(=O)[C@@H](F)Br)C3)n1	1843586537	MFUWVFYIMJRWGU-GFCCVEGCSA-N	431.218	1.506	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)Cc1cccc(F)c1F)C2	1844265225	HHQJUAAFUISXJI-UHFFFAOYSA-N	429.427	1.023	50	20	IDGD	
CC#CC[C@@H](C(=O)N1CCCC12CN(C(=O)c1ccc(B(O)O)cc1)C2)c1ccccc1	1844334996	GYFHXRNUDBXPKD-JOCHJYFZSA-N	430.313	1.381	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)C1	1845039111	FSQRQWIWICRZAN-KRWDZBQOSA-N	435.956	1.553	50	20	IDGD	
CC(C)/C=C/C(=O)N1CC2(CCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)C1	1845039426	OSNMPVXLYIKEIP-ZHACJKMWSA-N	427.549	1.748	50	20	IDGD	
CC(C)(C)OC(=O)N1CCCC[C@@H](C(=O)N2CCCC23CN(C(=O)[C@@H](O)CCl)C3)C1	1847159595	KAEYHEANMKFHSP-CVEARBPZSA-N	443.972	1.827	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](O)CCl)nc1Br	1847566042	DPYBSRHENALDGR-SRVKXCTJSA-N	432.702	1.268	50	20	IDGD	
O=C(COC(=O)c1ccc(S(=O)(=O)N2CCCCC2)cc1)NNC(=O)c1ccccc1	3437039	LYQDIHDWPFRABI-UHFFFAOYSA-N	445.497	1.479	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1cc(F)cc(F)c1	15524776	ORKVAJNMAMJWEX-UHFFFAOYSA-N	425.413	1.061	50	20	IDGD	
CCn1c(=O)c(=O)[nH]c2cc(C(=O)NNC(=O)COc3cc(C)ccc3C(C)C)ccc21	15835837	PNVWGKAHCGOPQN-UHFFFAOYSA-N	438.484	1.982	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CN2C(=O)N[C@](C)(C3CC3)C2=O)ccc1OCCC(C)C	22739508	RBZCBJUMCPHQNE-JOCHJYFZSA-N	446.504	1.602	50	20	IDGD	
COc1cc([C@H](C)NC(=O)NNC(=O)CNC(=O)c2cccs2)cc(OC)c1OC	725873583	NYSPSOCIVSKARX-NSHDSACASA-N	436.490	1.595	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)N1CCCN(C(=O)c2ccccc2F)CC1	725874211	WTBJIZXTFGEZGH-UHFFFAOYSA-N	447.492	1.206	50	20	IDGD	
Cc1ccc(NC(=S)NNC(=O)CN(C)C2=NS(=O)(=O)c3ccccc32)cc1C	725906488	PPJYTQDVYHGFEP-UHFFFAOYSA-N	431.543	1.702	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2ccc3c(c2)CCO3)c1	726272846	SSJTXRKLSQOFIE-UHFFFAOYSA-N	446.529	1.796	50	20	IDGD	
CN(C)N(C(=O)CN1C(=O)c2cc(Cl)c(Cl)cc2C1=O)[C@@H]1CCS(=O)(=O)C1	728179108	FHXYOKIEJHNMPN-SECBINFHSA-N	434.301	1.082	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)c1	728205724	BSBCNKFLRFVXJD-UHFFFAOYSA-N	434.518	1.503	50	20	IDGD	
O=C(CCC(=O)N1CC(=O)Nc2ccccc21)NNC(=O)c1cccc(OC(F)F)c1	728487792	CKKVNCLCQURIKK-UHFFFAOYSA-N	432.383	1.815	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)c2ccc(C(=O)NC)nc2)c2ccccc2c1=O	728511993	IUCMGHVJPCOOCG-UHFFFAOYSA-N	436.472	1.416	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCCN1C(=O)c1cccs1)C1CCN(c2ncccn2)CC1	728847668	KHNSTWQZMYLFFV-MRXNPFEDSA-N	442.545	1.597	50	20	IDGD	
O=C(NCCNc1ccc([N+](=O)[O-])cc1)NNC(=O)C1CCN(c2ncccn2)CC1	728959938	SOBJPLJYSDQNDT-UHFFFAOYSA-N	428.453	1.044	50	20	IDGD	
COC(=O)c1c(CC(=O)NNC(=S)Nc2ccc(N(C)C)cc2)[nH]c(C(C)=O)c1C	729690042	ZKLOQAPRLKZWJC-UHFFFAOYSA-N	431.518	1.939	50	20	IDGD	
COc1cc(C=O)c([N+](=O)[O-])cc1OCC(=O)NNC(=O)c1ccc2c(c1)OCCO2	731601463	YGSBIZHJJHQYEW-UHFFFAOYSA-N	431.357	1.027	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Cc2ccc(OCC#N)cc2)c1	732049498	OPMNHSNHFVQRSG-UHFFFAOYSA-N	444.513	1.623	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)NCCNC(=O)c1c(F)cccc1F	733042663	NKARRNRYRLIABY-UHFFFAOYSA-N	436.415	1.503	50	20	IDGD	
CNC(=O)c1ccc(C(=O)NNc2nc3ccccc3c(=O)n2CCCOC(C)C)cn1	733266273	UCEBXSLTMQQORZ-UHFFFAOYSA-N	438.488	1.723	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)C1=NN(Cc2ccccc2)C(=O)CC1	734239666	VPHHXVDEBIVGCP-UHFFFAOYSA-N	432.481	1.020	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)c1cccc(NS(C)(=O)=O)c1	734252701	CHQIXZXYGHOZGR-UHFFFAOYSA-N	440.547	1.892	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc2c(c1)nc(CCC(=O)NNc1cccnn1)n2CC	736711143	WMITYKLUCDGYGO-UHFFFAOYSA-N	445.549	1.953	50	20	IDGD	
Cn1nnc2cc(C=NNC(=O)c3cccc(S(=O)(=O)N4CCCCC4)c3)ccc21	737416017	KJUOLBQLFKQAHE-UHFFFAOYSA-N	426.502	1.907	50	20	IDGD	
CCc1nc(CN2CCN(CC(=O)NNC(=O)c3ccc(OC)c(OC)c3)CC2)cs1	738308937	IPVHCZFFRNNZPD-UHFFFAOYSA-N	447.561	1.302	50	20	IDGD	
CC1CCC(NC(=O)CN2CCN(C(=O)NNC(=O)COCc3ccccc3)CC2)CC1	738497516	XJSPDTKCOMQWLG-UHFFFAOYSA-N	445.564	1.257	50	20	IDGD	
CS(=O)(=O)[C@H]1CCC[C@H](NC(=O)NNC(=O)c2ccc(F)cc2Br)C1	741093351	PQBASXXQTXALAR-QWRGUYRKSA-N	436.303	1.888	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)[C@@H]2CCCN(C(=O)COc3ccccc3)C2)c1	741207080	OZMHESMHWOFYNU-GOSISDBHSA-N	425.485	1.839	50	20	IDGD	
Cc1ccc(-c2ocnc2C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1	742034021	UMXKNQIFJXAOTN-UHFFFAOYSA-N	428.470	1.975	50	20	IDGD	
CC(C)c1nn([C@H]2CCS(=O)(=O)C2)cc1C(=O)NNC(=O)Cc1c[nH]c2ccccc12	742477430	HDUVNUYXIXVFLX-HNNXBMFYSA-N	443.529	1.851	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3ccc([S@](C)=O)cc3)cc2)CC1	743335562	ZQIKXIUTXHHWJW-NDEPHWFRSA-N	436.559	1.117	50	20	IDGD	
C[C@@H](CC(=O)NNc1ccc(Br)nc1)/N=C1/NS(=O)(=O)c2ccccc21	743405987	JOPWSSPMHJLXTC-JTQLQIEISA-N	438.307	1.805	50	20	IDGD	
CS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cccc(Br)c2)cc1[N+](=O)[O-]	744372265	VQTLETFWUPCSJT-UHFFFAOYSA-N	442.247	1.836	50	20	IDGD	
CC(C)CN(CC(=O)NNC(=O)C(C)(C)C)c1c(O)nc(=O)n(Cc2ccccc2)c1N	744386692	OSZFUSJFTLVGNP-UHFFFAOYSA-N	444.536	1.235	50	20	IDGD	
CCc1nsc(N2CCCN(CC(=O)NNC(=O)c3ccc(OC)c(OC)c3)CC2)n1	744426144	FBFMPZCKKBPAPB-UHFFFAOYSA-N	448.549	1.091	50	20	IDGD	
CC(=O)N[C@H](CC(=O)OCC(=O)NNC(=O)c1cccc(C)c1)c1c(F)cccc1F	744942139	QGRJDXSASZSHPC-QGZVFWFLSA-N	433.411	1.845	50	20	IDGD	
O=C(NC[C@H]1CN(Cc2ccccc2)CCO1)NNC(=O)c1cc([N+](=O)[O-])ccc1O	745289437	KUZRVGFDERMVQP-INIZCTEOSA-N	429.433	1.145	50	20	IDGD	
Cc1cccc(N2CCN(CCC(=O)NNC(=O)CNC(=O)c3cccs3)CC2)c1	746197297	MEQVZHDWSBWFBF-UHFFFAOYSA-N	429.546	1.146	50	20	IDGD	
CNS(=O)(=O)c1cccc(S(=O)(=O)NNC(=O)c2cc3c(s2)CC[C@H](C)C3)c1	747406843	KLBALDYJSRGEBS-NSHDSACASA-N	443.572	1.404	50	20	IDGD	
COC(=O)c1cc(C)c(C)c(S(=O)(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)c1	747597443	WTTRWUOVDDQMCE-UHFFFAOYSA-N	433.486	1.655	50	20	IDGD	
Cc1nc(Cl)cc(NNC(=O)CCNS(=O)(=O)c2ccc3c(c2)OCCCO3)n1	748340661	YNAOIHAQGAKNLS-UHFFFAOYSA-N	441.897	1.411	50	20	IDGD	
COC(=O)c1c(C)nc(O)nc1SCC(=O)NNC(=O)c1cc(Cl)ccc1OC	750492524	OKCQOFFFIOIHEC-UHFFFAOYSA-N	440.865	1.493	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)[C@@H]1CC(=O)N(CCOc2ccccc2Cl)C1	751540431	BWXHQAAFYQYZIS-CQSZACIVSA-N	449.866	1.933	50	20	IDGD	
COC(=O)[C@@H]1c2ccccc2CCN1CC(=O)NNC(=O)c1cc(Cl)ccc1OC	752302335	OALPPHMNTZUFTD-IBGZPJMESA-N	431.876	1.882	50	20	IDGD	
Cc1cc(C(=O)NNc2nc3ccccc3c(=O)n2C)cc(S(=O)(=O)N(C)C)c1C	752901989	HMENKDFZNYRNLB-UHFFFAOYSA-N	429.502	1.558	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)NC[C@H]2CCC[C@]23NC(=O)N(C)C3=O)c1	753023305	MWSWDNFYNNGJFD-QRQCRPRQSA-N	445.520	1.548	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)N[C@@H](C)CO[C@@H]2CCOC2)c2ccccc2c1=O	753948802	RMGGGTXHYACPGD-LSDHHAIUSA-N	431.493	1.335	50	20	IDGD	
C[C@@H](NCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)[C@H]1CCCN(C(=O)OC(C)(C)C)C1	754310247	BVSKBMQVDXLOOS-ZBFHGGJFSA-N	449.508	1.981	50	20	IDGD	
Cc1ccc(C)c(S(=O)(=O)Nc2ccccc2C(=O)NNC(=O)Cc2cc[nH]n2)c1	755270040	VQISLAZNIYFGFT-UHFFFAOYSA-N	427.486	1.831	50	20	IDGD	
C[C@H]1C[C@@H](C)CN(C(=O)c2ccccc2NC(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)C1	755669451	ZVTKZSSBCBNGIZ-ZNMIVQPWSA-N	436.534	1.392	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)Nc1cccc(N2CCS(=O)(=O)CC2)c1	756204662	DLTYGIQYXMEBKJ-UHFFFAOYSA-N	432.502	1.325	50	20	IDGD	
CN1CCN(CC(=O)N(C)c2ccc(NC(=O)NNC(=O)CC(F)(F)F)cc2)CC1	756357550	DFWABPXMMLDNNP-UHFFFAOYSA-N	430.431	1.002	50	20	IDGD	
CC[C@H](c1ccccc1)c1nnc(NC(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)s1	756461845	WLKAGKYAUOZSJG-CMPLNLGQSA-N	426.524	1.170	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2ncccc2OCC(F)(F)F)n1	756468904	VQBAHMLPRAZPRP-UHFFFAOYSA-N	432.380	1.335	50	20	IDGD	
CCOC(=O)[C@@H](C)NC(=O)c1ccc(NC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1	756791045	SUPLDVLXEDTINX-GFCCVEGCSA-N	443.416	1.743	50	20	IDGD	
CN(C)C(=O)Cn1cc(NC(=O)NNC(=O)c2ccc(Br)cc2Cl)cn1	756803091	WVMAWBYSYIJZSQ-UHFFFAOYSA-N	443.689	1.854	50	20	IDGD	
C[C@@H]1C[C@@H](C)CC2(C1)NC(=O)N(CC(=O)NNC(=O)Cc1c[nH]c3ccccc13)C2=O	756868767	XVDYJVMJOGLGRO-ZIAGYGMSSA-N	425.489	1.605	50	20	IDGD	
Cc1ccn(C)c(=O)c1NC(=O)NNC(=O)c1nn(CCC(C)C)c(=O)c2ccccc12	757631886	CZPHYJJAJUDFQY-UHFFFAOYSA-N	438.488	1.916	50	20	IDGD	
COc1cc(C)ccc1CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	757745862	LSXVYNKUKGSDHS-UHFFFAOYSA-N	446.529	1.932	50	20	IDGD	
CN(C)c1ccc(N2CCC(NC(=O)NNC(=O)C(=O)Nc3ccccn3)CC2)cc1	758810515	CSSAPWSBUOPJPS-UHFFFAOYSA-N	425.493	1.086	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NC[C@H]2CN(Cc3ccccc3)CCCO2)cc1	759350384	COHIDIOCZCVJSH-NRFANRHFSA-N	426.517	1.995	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1cc2ccccc2nc1Br	760152970	MTZZRWPIGXJREO-QMMMGPOBSA-N	430.284	1.088	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N2CCS(=O)(=O)CC[C@@H]2C)cc1Br	763271929	OXOOCXLRHQNGFR-JTQLQIEISA-N	434.312	1.321	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1cnn(Cc2ccc(Cl)cc2)c1	763471831	MRIXEGNLSMSZCH-UHFFFAOYSA-N	442.819	1.893	50	20	IDGD	
CCn1nnnc1-c1cccc(NC(=O)C(=O)NNC(=O)c2cc3ccccc3cc2O)c1	763528485	UDSCGKPDARZDCV-UHFFFAOYSA-N	445.439	1.619	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1ccc(-c2nnc(N(C)C)o2)cc1	763627484	ANNKNYWKUFHBNY-UHFFFAOYSA-N	448.443	1.158	50	20	IDGD	
CCOc1cc2c(cc1NC(=O)C(=O)NNC(=O)COc1ccc(OC)cc1)O[C@@H](C)C2	763663720	NAYKAHJHQRBESH-ZDUSSCGKSA-N	443.456	1.582	50	20	IDGD	
CCc1nn(C)cc1NC(=O)C(=O)NNC(=O)COc1ccccc1Cc1ccccc1	763719048	UGIHALMTFYJVPL-UHFFFAOYSA-N	435.484	1.738	50	20	IDGD	
CC[C@H](C)n1nc(NC(=O)C(=O)NNC(=O)c2nn(CC)c(=O)c3ccccc23)cc1C	763785512	GXIFGISLRSMORI-LBPRGKRZSA-N	439.476	1.292	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)c1ccn(-c2cccc(C(F)(F)F)c2)n1	763812969	DPXUPZJDLIOBKT-UHFFFAOYSA-N	432.362	1.477	50	20	IDGD	
CC(C)C(=O)NNC(=O)C(=O)Nc1ccc(=O)n(Cc2ccc(Cl)c(Cl)c2)c1	763816786	PLBUEKXVCMUGDN-UHFFFAOYSA-N	425.272	1.945	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2cc(C(F)(F)F)ccc2-n2cccn2)n1	763880487	GJRRVAJZAIULKR-UHFFFAOYSA-N	449.393	1.491	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2c(C)ccn(C)c2=O)ccc1OCCC(C)C	763913988	ILGRAIQOXOPIQI-UHFFFAOYSA-N	444.488	1.527	50	20	IDGD	
COC(=O)NCc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2OC)cc1	764012888	UHNJQJLMSXQPES-UHFFFAOYSA-N	434.836	1.604	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(C)cc2O)cc1N1CCOC1=O	764109832	CBMRBTOZWABPIZ-UHFFFAOYSA-N	428.401	1.066	50	20	IDGD	
O=C(NNC(=O)c1cccc2cccnc12)C(=O)Nc1cccc(-c2nnnn2C2CC2)c1	764152203	PVRKEPXCGRJQOB-UHFFFAOYSA-N	442.439	1.623	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(CCN3CCSCC3)cc2)cc1	764177448	ODMLDXUKVQTMCI-UHFFFAOYSA-N	437.525	1.549	50	20	IDGD	
COCC[S@](=O)Cc1cccc(NC(=O)C(=O)NNC(=O)C(C)(C)c2ccccc2)c1	764314854	ZFOLQHDUFGLLER-HKBQPEDESA-N	445.541	1.645	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2cc3ccccc3o2)ccc1N1CCCC1=O	764330535	GJXJVKISDVCCPB-UHFFFAOYSA-N	436.424	1.968	50	20	IDGD	
CCNS(=O)(=O)c1ccc(CNC(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)cc1	764372104	DYPKRBBGDYPINN-CYBMUJFWSA-N	438.481	1.422	50	20	IDGD	
Cc1ccc2c(c1)[C@H](NC(=O)NNC(=O)c1ccc(S(=O)(=O)N3CCCC3)cc1)CO2	764377134	XQYFHAKHNOWTDW-GOSISDBHSA-N	444.513	1.857	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)c1cc(F)ccc1NS(C)(=O)=O	765314169	WDEQLJZJVQZSET-UHFFFAOYSA-N	432.474	1.263	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)CN(C)S(=O)(=O)c3ccccc3)n[nH]2)cc1	765571395	KTTZNEXNMGETEB-UHFFFAOYSA-N	441.513	1.721	50	20	IDGD	
CCn1c(=O)oc2cc(S(=O)(=O)NNC(=O)c3nnc(-c4ccccc4)o3)ccc21	767449584	FXJYOMVSQSJYTG-UHFFFAOYSA-N	429.414	1.288	50	20	IDGD	
Cc1cc(S(=O)(=O)N2CCN(S(=O)(=O)CBr)CC2)c2ncccc2c1	767850868	NGNCHXJWALRGCJ-UHFFFAOYSA-N	448.364	1.532	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)Nc3ccc4c(c3)OCO4)c2)n[nH]1	768278160	IMOXMGUZHLCBRB-UHFFFAOYSA-N	443.441	1.322	50	20	IDGD	
C[C@H](C(=O)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1)S(=O)(=O)c1ccc(F)cc1	768288696	AEHLTWOUROXFBM-LLVKDONJSA-N	434.424	1.978	50	20	IDGD	
O=C(NNc1nc2ccccc2[nH]1)c1ccc2c(c1)S(=O)(=O)N(C[C@H]1CCCO1)C2=O	768503756	IRCMGDFCUNOEGN-CYBMUJFWSA-N	441.469	1.643	50	20	IDGD	
CC(=O)N1C[C@@H](C(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)Oc2ccccc21	770965615	FBUHIXRCKCGNKU-HNNXBMFYSA-N	425.449	1.544	50	20	IDGD	
Cc1cc(S(=O)(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)cc(C(=O)O)c1C	771608123	SCGRIMBHSVNHSP-UHFFFAOYSA-N	439.877	1.281	50	20	IDGD	
N#Cc1ccc(-c2ccc(OCC(=O)NNC(=O)[C@@H]3CCCCS3(=O)=O)cc2)cc1	771866841	FZOPCWCPSHLXLL-IBGZPJMESA-N	427.482	1.719	50	20	IDGD	
O=C(Cn1cc(C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)cn1)NC1CCCC1	772452350	GVJFGWVFJBYGLI-UHFFFAOYSA-N	441.460	1.695	50	20	IDGD	
COc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)C(=O)NNc1c(F)cccc1F	773709230	MZOPZVWOSDDAQR-UHFFFAOYSA-N	428.417	1.306	50	20	IDGD	
CC(C)c1nccnc1NNC(=O)C(=O)Nc1cccc(S(=O)(=O)N2CCCC2)c1	773997484	IJMHIXRJXXAQEW-UHFFFAOYSA-N	432.506	1.466	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN[C@H](CC(=O)N(C)C)c1ccccc1	775216802	IXXINKNNXLDRJI-QGZVFWFLSA-N	432.908	1.919	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCC(c3nnc4n3CCCC4)CC2)cc1OC	775822937	AUEIKJKTTZKNQW-UHFFFAOYSA-N	442.520	1.272	50	20	IDGD	
C#CCOc1ccccc1NC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	776098372	AFOJLYDPXXITOJ-UHFFFAOYSA-N	442.497	1.950	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)NC[C@@H]1COC2(CCOCC2)O1	776887153	QIBQBQOBPJOPKI-OAHLLOKOSA-N	432.502	1.985	50	20	IDGD	
CCCc1nc(C)c(NC(=O)C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)s1	777144463	UTOQCOQXEQKXKA-UHFFFAOYSA-N	431.522	1.197	50	20	IDGD	
CC(C)Cc1cc(C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)cc(O)n1	777523996	RGDFUTAHRRNIMT-UHFFFAOYSA-N	448.549	1.074	50	20	IDGD	
COc1ccc(OCCCC(=O)N2CCN(S(=O)(=O)CBr)CC2)cc1	777780223	YQHPEXSAXCXAFV-UHFFFAOYSA-N	435.340	1.681	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)Cc1csc(-c2ccc3c(c2)OCO3)n1	778433262	HZPNFFXWBMCEDJ-UHFFFAOYSA-N	434.474	1.753	50	20	IDGD	
O=C(CNC(=O)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1)NCC1CC1	778642424	NCCMBZXVUQJFTQ-NRFANRHFSA-N	435.528	1.470	50	20	IDGD	
COCCCNC(=O)NNC(=O)c1cc(Br)c(O)c(Br)c1	780907129	GMAOQJXHOBNPAD-UHFFFAOYSA-N	425.077	1.898	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)C(=O)Nc1ccc(C(F)(F)F)cc1	782897365	NOWCBSNPKZOUDO-UHFFFAOYSA-N	443.407	1.398	50	20	IDGD	
Cc1nc(N2CCOCC2)ccc1NC(=O)C(=O)NN=c1sc2ccccc2n1C	783352113	YBYBVRRPDYSNCE-UHFFFAOYSA-N	426.502	1.350	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)C(=O)Nc1cccc(C2SCCS2)c1	784004491	ORDWGGPKEVNWLL-UHFFFAOYSA-N	434.499	1.274	50	20	IDGD	
O=C(CCc1cc(F)ccc1Br)NNC(=O)c1ccc(-n2cnnn2)cc1	785031998	IFCQJHWIENJANF-UHFFFAOYSA-N	433.241	1.958	50	20	IDGD	
C[C@@H](Cc1ccccc1)NC(=S)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	786080913	HOPFKJRABIRMSG-SFHVURJKSA-N	439.585	1.571	50	20	IDGD	
CCN(CC)Cc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1	787889324	LFLKVORAYPKKCF-UHFFFAOYSA-N	446.529	1.332	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCC(=O)c2cccn21)c1cccc(S(=O)(=O)N2CCCC2)c1	788725902	SNVDOOALPYZCRH-KRWDZBQOSA-N	430.486	1.251	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)C(=O)Nc2cc([C@@H]3CCCO3)nn2C)c1	789731568	FMQMLRABMNMOKV-KRWDZBQOSA-N	443.504	1.868	50	20	IDGD	
O=C(NNC(=O)c1sccc1S(=O)(=O)N1CCOCC1)c1cccc(Cl)c1	790039234	YKJBDFNLQOOCRW-UHFFFAOYSA-N	429.907	1.497	50	20	IDGD	
COCC1(CNC(=O)NNC(=O)c2cccc(C)n2)CCN(C(=O)OC(C)(C)C)CC1	790846203	JCVWHULMOZIHPS-UHFFFAOYSA-N	435.525	1.998	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)N(C)CCCC(=O)NNc2nc3ccccn3n2)cc1	791243452	AFBIZVHSFQMOPE-UHFFFAOYSA-N	430.490	1.476	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc(O)cc2)cc(N2CCN(C(C)C)CC2)c1	792273408	WCWHJXBPZJAQAH-UHFFFAOYSA-N	439.516	1.631	50	20	IDGD	
C[C@H](C(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1)N(C)CC(F)(F)F	793683809	VEXKJDUHRKKEPD-CQSZACIVSA-N	449.905	1.488	50	20	IDGD	
CCC(=NNC(=O)[C@H](C)CN1C[C@H](C)O[C@H](C)C1)c1ccc(Cl)c(S(N)(=O)=O)c1	794477610	DCPXGKWRXDDKDR-MCIONIFRSA-N	444.985	1.963	50	20	IDGD	
COC(=O)c1ccc(NC(=O)NNC(=O)CNC(=O)OCc2ccccc2)c(OC)c1	797649250	SCHPWHXMAWOOTM-UHFFFAOYSA-N	430.417	1.561	50	20	IDGD	
C=CCNC(=S)NNC(=O)c1sccc1S(=O)(=O)N1CCc2ccccc2C1	798305493	RYAIEDZMHQWWSN-UHFFFAOYSA-N	436.584	1.790	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cccc(N)c2OC(C)C)cc1OC	798700231	VLMJTVOTZIAVOA-UHFFFAOYSA-N	431.445	1.691	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)NCCN1CCN(C)C(C)(C)C1	799686346	SSBLUNAOZXBTMV-KRWDZBQOSA-N	427.549	1.964	50	20	IDGD	
O=C(/C=C\c1ccccc1)NCCCNC(=O)NNC(=O)CNC(=O)c1cccs1	799911396	DGKASLWCWVIDQG-KTKRTIGZSA-N	429.502	1.028	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)c2cnc3n(c2=O)CCS3)c(OC)cc1Cl	802078342	MGPVRUABDHBSOV-UHFFFAOYSA-N	425.854	1.486	50	20	IDGD	
COCc1ncc(C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)s1	802763618	YCYPXKZEXMPNRE-UHFFFAOYSA-N	437.953	1.522	50	20	IDGD	
O=C(COC(=O)c1cc(O)ccc1C(F)(F)F)NNC(=O)c1cccc([N+](=O)[O-])c1	803527819	CPLAQNZOKMQWAE-UHFFFAOYSA-N	427.291	1.937	50	20	IDGD	
COC(=O)N(C)NC(=O)[C@H](CCS(C)(=O)=O)NC(=O)c1ccc(C(C)(C)C)cc1	804125017	XFXUOBXBOXUHBK-HNNXBMFYSA-N	427.523	1.247	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ncc(COC)s3)n[nH]2)cc1	806978769	GVSYGWLACIJWRM-UHFFFAOYSA-N	428.474	1.642	50	20	IDGD	
COC(=O)[C@H]1CCCCN1C(=O)c1cccc(NC(=O)C(=O)NNc2cccc(F)n2)c1	807392865	LXJJPGOIVLATEH-OAHLLOKOSA-N	443.435	1.470	50	20	IDGD	
CN(NS(=O)(=O)Cc1ccc(C#N)cc1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	808309730	QFZFNHPSJSXTMB-UHFFFAOYSA-N	437.522	1.497	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)cc2[nH]ccc12	808934932	YAUUZTVMCFLXRS-UHFFFAOYSA-N	444.831	1.773	50	20	IDGD	
CC[C@@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(Oc2ccnc(C(=O)NC)c2)c(F)c1	810384936	RTLLMFIIWAMOLT-LLVKDONJSA-N	431.424	1.505	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)OC(C)(C)C)c(C(=O)NCC(F)(F)F)cc1F	810389415	GQZBUICXRCZVAX-UHFFFAOYSA-N	436.362	1.921	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)Cc3cc(C)[nH]n3)c2)cc1	811472118	WTKJAZQGMYNXJY-UHFFFAOYSA-N	443.485	1.531	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NN=C[C@@H]1CCOC1)N(S(C)(=O)=O)CC2	812438775	PVTJOSOTXLSYOQ-BBRMVZONSA-N	425.507	1.091	50	20	IDGD	
CCCCN(C)C[C@H](C)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	812455006	UNINZIOVGKOACW-INIZCTEOSA-N	439.582	1.536	50	20	IDGD	
COc1ccc(OC)c(C2=NO[C@H](C(=O)NNc3ccc(S(=O)(=O)N(C)C)cc3)C2)c1	812726563	HYSNPKVNTZZPPP-IBGZPJMESA-N	448.501	1.590	50	20	IDGD	
CCn1nc(C)c(C(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)n1	814718080	HBQHBZRBKAWKEC-UHFFFAOYSA-N	442.501	1.160	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)c2cccc(N(C)C)c2)cc1)[C@H]1C[C@H]1C	815565363	LROIWXDFRRZFIT-VLIAUNLRSA-N	437.500	1.914	50	20	IDGD	
CNC(=O)Oc1cccc(NC(=O)C(=O)NNC(=O)CCSc2ccc(F)cc2)c1	815567363	VWQZXYBRLPEYNE-UHFFFAOYSA-N	434.449	1.812	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNc2c(OC)cccc2S(C)(=O)=O)cc(OC)c1C	815613043	DWRXLMOFENPIKR-UHFFFAOYSA-N	437.474	1.506	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCc2cncn2C1)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	816830972	ANTOWLROVVJCBR-IBGZPJMESA-N	442.483	1.609	50	20	IDGD	
COc1cccc(/C=C(/C(=O)NNC(=O)COc2ccc(C#N)cc2)n2nnnc2C)c1	818023294	FIEVMSMMSKRMAX-ODLFYWEKSA-N	433.428	1.086	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2ccc(=O)n(-c3ccc(F)cc3)n2)cc(OC)c1OC	914837471	DVWOMJUICZGTFN-UHFFFAOYSA-N	442.403	1.472	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)CCOc2ccc(F)c(Cl)c2)c1	915594342	LYGMTNBJPIDDTL-UHFFFAOYSA-N	443.884	1.960	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)CS[C@@H](C)C(=O)Nc1cc(C)on1	915775854	RMLWVBLXWZJQQP-ZDUSSCGKSA-N	444.517	1.803	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)CCCn2cnc3ccccc32)ccc1Cl	916133515	VCFYZCZIAGKGOX-UHFFFAOYSA-N	435.893	1.579	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@H]2COc3ccccc3C2)c1	916199868	LIFLQKCYOSTLLN-AWEZNQCLSA-N	432.502	1.132	50	20	IDGD	
O=C(NCCNS(=O)(=O)c1cccc(Cl)c1)NNC(=O)c1cccc([N+](=O)[O-])c1	916295804	UZVTYPCBJUCJOS-UHFFFAOYSA-N	441.853	1.171	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl)c1csc(N2CCOCC2)n1	917723733	KWVIXCWXWJECGC-UHFFFAOYSA-N	447.882	1.165	50	20	IDGD	
COc1ccc(-n2ccc(C(=O)NNC(=O)CCN3CCN(c4ccccc4)CC3)n2)cc1	919824563	BYMHBVVZUVEKNF-UHFFFAOYSA-N	448.527	1.854	50	20	IDGD	
Cc1ccc(Sc2ncccc2C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)c(C)c1	919889208	KDRCNRIADVAEJD-AWEZNQCLSA-N	434.543	1.981	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)N1CCC(NC(=O)c2ccsc2)CC1	920050426	ZGRBJGQEEXXEED-UHFFFAOYSA-N	426.502	1.953	50	20	IDGD	
CCn1c(NNC(=O)c2nc(S(C)(=O)=O)n3ccccc23)nc2ccccc2c1=O	920255920	ZKQOCAMOOAXGKS-UHFFFAOYSA-N	426.458	1.225	50	20	IDGD	
CC[C@H]1CN(C(=O)/C(C#N)=C/c2cn(CCC(N)=O)nc2-c2ccc(OC)cc2)CCO1	920854212	WKKRASAJGYDUKU-WPNIOXTASA-N	437.500	1.978	50	20	IDGD	
CCNC(=O)NNC(=O)[C@@H](CCSC)NS(=O)(=O)c1ccc(Cl)c(Cl)c1	920858704	JAONCAUPKQCGIQ-GFCCVEGCSA-N	443.378	1.744	50	20	IDGD	
O=C(NCCc1cccs1)NNC(=O)[C@H]1CCCCN1S(=O)(=O)c1cccs1	920859845	LKUZMVVFXKDHOF-CQSZACIVSA-N	442.588	1.926	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NNc2nncc(N)c2Cl)ccc1OC	1319303600	SNNJZXKJKUJWSQ-UHFFFAOYSA-N	428.902	1.508	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)C2(O)Cc3ccccc3C2)c1	1323382246	IEQBVRILCRYOSW-UHFFFAOYSA-N	431.514	1.008	50	20	IDGD	
Cn1c(=O)cc(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)c2ccccc21	1330140732	NYXRWBYJHVNFJN-UHFFFAOYSA-N	442.497	1.316	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnc4ncccn34)C2)C1	1777935873	GPCAKHWBBJPWKJ-FZKQIMNGSA-N	436.310	1.346	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)/C=N/O[C@H]3CCCCO3)C2)C1	1779106311	OAGYJWONUPQRRW-KBGIYDCGSA-N	432.315	1.129	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3nnc(-c4ccccc4)o3)C2)C1	1779113683	AQBLJDUITKBLAA-YJYMSZOUSA-N	449.305	1.964	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)cc1OC	1781332896	CHUUXCSTLXPUPH-CRAIPNDOSA-N	445.285	1.838	50	20	IDGD	
O=C(c1c(F)ccc(O)c1F)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781334194	WFBFKVRUVSKCFW-BBRMVZONSA-N	437.212	1.804	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCBr)C2)c1cncc(O)c1	1782038780	KQPWSDCDPWKPSW-CRAIPNDOSA-N	426.311	1.700	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1nnsc1C1CC1)C2	1782173095	WXCPGNIEASEWGP-IQUTYRLHSA-N	442.969	1.797	50	20	IDGD	
Cc1ccc(F)cc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCC(=O)NN(C)C)C1	1782210112	FPPFNVHOBYQRSV-AUSIDOKSSA-N	448.539	1.635	50	20	IDGD	
O=C(c1cnn2cccc(F)c12)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1782554244	UMHRNDZBGXCUIO-RHSMWYFYSA-N	443.248	1.607	50	20	IDGD	
COc1cccnc1CCC(=O)N1CCO[C@]2(CCN(C(=O)[C@H](C)Br)C2)C1	1783530226	VDNZCPMYPARSHU-IFXJQAMLSA-N	440.338	1.636	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](C)Nc1cccnc1)CCO2	1783532489	IUVPLJYAYGLQFN-SUNYJGFJSA-N	425.327	1.495	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)Cc1ccccc1Cl)CCO2	1783933808	HMCMJRNYMVNQQB-OAQYLSRUSA-N	436.940	1.085	50	20	IDGD	
O=C(c1cc2cccnc2nc1O)N1CCO[C@@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783949846	MDOSIBHRHQEMER-GOSISDBHSA-N	425.272	1.583	50	20	IDGD	
CC(=O)N(C)CCC(=O)Nc1ccc(C2(NC(=O)CCC(=O)NN(C)C)CCC2)cc1	1786630866	VRQJHEYBTSHEJI-UHFFFAOYSA-N	431.537	1.362	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1	1788143492	JGDPWAIAVUVKFS-GOSISDBHSA-N	430.697	1.368	50	20	IDGD	
COc1ncc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]3C2)cc1C	1788761314	PDVFRVUVEKNHSZ-SZMVWBNQSA-N	435.597	1.843	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(F)nc3)[C@H]2C1	1788842779	IDDSYHRMXAVUPH-AJNGGQMLSA-N	428.302	1.988	50	20	IDGD	
Cc1cc(CC(=O)NC2(c3ccc(NC(=O)c4cnccc4C(=O)NN)cc3)CCC2)on1	1789521139	KTUBRXWEUDVYME-UHFFFAOYSA-N	448.483	1.972	50	20	IDGD	
Cc1n[nH]c(C)c1C(=O)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1	1789691936	CACRLQUDSBHWDT-UHFFFAOYSA-N	432.289	1.768	50	20	IDGD	
COC[C@H](Cl)C(=O)NC1(c2ccc(NC(=O)[C@H]3CCCS3(=O)=O)cc2)CCC1	1791177371	CDNYZPMWKBUFQL-JKSUJKDBSA-N	428.938	1.952	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](N)c3cccc(Cl)c3)C[C@@H]21	1791251770	VMMYJJOEKBDUOT-HILJTLORSA-N	444.359	1.573	50	20	IDGD	
COc1ccc(Cl)c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](O)CCl)C[C@@H]32)c1	1791900984	SUPKGVDAABWNOR-WPUCRFQZSA-N	431.316	1.542	50	20	IDGD	
O=C(Cc1cc(Br)ccc1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCl	1793115226	DZKAPYDMWXUJHZ-FQLMCAECSA-N	445.741	1.935	50	20	IDGD	
COc1ccc(C)c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCBr)c1	1795115065	DVBXJCMNBONODJ-ZSBFGKGUSA-N	425.323	1.992	50	20	IDGD	
NC[C@@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1ccccc1	1795675591	MGLXJXHEPOVPTD-YIDVYQOGSA-N	428.302	1.009	50	20	IDGD	
Cc1ccc2oc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3ccc(B(O)O)cc3)cc2n1	1796189207	LBTDWOXYSVHNSJ-BCDXTJNWSA-N	433.273	1.382	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)c1cc2cc(F)ccc2[nH]1	1796191460	OIYZQGHCIPMJQA-REPLKXPHSA-N	435.264	1.552	50	20	IDGD	
Cc1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)c(F)c1F	1796192608	LWYXIIWMPUUWAM-BJWYYQGGSA-N	428.244	1.519	50	20	IDGD	
COC(=O)N[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Cl)c1ccccc1	1796361974	ZIEWIHDHMXZMQR-YIDVYQOGSA-N	427.860	1.208	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1snnc1C1CC1	1796706534	FIHZPWMJGBXIEI-WJZNIJOASA-N	433.303	1.309	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1cn2ccccc2n1	1796830864	BXFNBPRJKYPBSC-JLUCKKNBSA-N	425.258	1.228	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnn2ccccc12	1796842043	UGFSFZUBHVXZRW-AODNKKSCSA-N	425.316	1.774	50	20	IDGD	
COC(=O)[C@H]1CC[C@@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CO[Si](C)(C)C)C1	1797953676	CCVGMNNKYBIUNY-RIUYPTKQSA-N	426.586	1.017	50	20	IDGD	
COc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Br)C3)c(O)c1	1798835842	CZAFGECSKTVXFX-OWLDWWDNSA-N	431.258	1.295	50	20	IDGD	
COc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@](C)(Cl)CCl)C3)ccc1O	1798952763	GAZNFEMRFPYOPZ-UESRRSCYSA-N	431.316	1.840	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CC[C@H]2CCC(=O)N2C1	1799149885	QVLBJWOOZQPWGF-JEEGOSIGSA-N	446.375	1.213	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2cc[nH]c2cc1F)c1ccc(B(O)O)cc1	1799272518	OPZSNWXHCYUQGV-BCDXTJNWSA-N	435.264	1.552	50	20	IDGD	
Cc1c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](O)CCl)C3)nc2ccc(Cl)cn12	1800086916	IBUDDCMNOBDCBU-IFOZYUSPSA-N	441.315	1.099	50	20	IDGD	
CC[C@@H](C)[C@@H](O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C#N)=C/c1ccc(F)cc1F	1800332509	RUROZUMXNSFVRK-UAPBNUCKSA-N	447.482	1.868	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(O)c([N+](=O)[O-])c1)C2	1800759987	VZVKDLCRNZSOET-ADGXKJENSA-N	442.266	1.287	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c(C)nc3ccc(F)cn13)C2	1800979630	SDVAVWWXGLLYGM-IARIHHJXSA-N	438.887	1.239	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C[C@H]1C[C@@H]2CC[C@H]1C2	1801727042	GNDYADBKXTZECD-NWCWSAAOSA-N	425.533	1.763	50	20	IDGD	
COC[C@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc3c(c1)NC(=O)[C@@H](C)O3)C2	1802279643	YTQIAXGPMUHWNZ-JZYAIQKZSA-N	435.908	1.912	50	20	IDGD	
COC[C@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnc3c(c1)NC(=O)CS3)C2	1802280380	NTSBZJKECJBWKC-CRWXNKLISA-N	438.937	1.631	50	20	IDGD	
C[C@@H](Cc1ccccn1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnccc1C(=O)NN)C2	1802735418	ODDRPNPCNMPHDR-OWLYRPNTSA-N	436.516	1.211	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)C1=CCCS1	1803631933	BOYLYKNZVUBGTK-FXAWDEMLSA-N	437.330	1.102	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC2(CCN(C(=O)[C@H]3CCC(=O)NC3)CC2)C1	1805382408	FMHGEPSSJSUAQV-GJZGRUSLSA-N	428.371	1.775	50	20	IDGD	
Cc1oncc1C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1	1805799565	SMUBMOHVVFHPIT-KXBFYZLASA-N	449.471	1.010	50	20	IDGD	
O=C(CCC(F)(F)F)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1806826179	SZHPOGUFSZPLHT-QFBILLFUSA-N	449.238	1.424	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)Cn2cncn2)[C@H]1c1cccnc1	1807604835	WYSAOXFWMAQIJU-YQQAZPJKSA-N	435.326	1.553	50	20	IDGD	
Cc1ccoc1C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1808494432	PMBCMZKAYYHYOP-UYAOXDASSA-N	433.273	1.296	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)c1nc2ccccc2[nH]1	1809035647	HJECMFFFXXHQLW-BMGDILEWSA-N	427.892	1.877	50	20	IDGD	
O=C(Cn1cc([N+](=O)[O-])cn1)N1CCC2(CCCN(C(=O)CCBr)C2)CC1	1809066263	LGPTYODFMVSJQP-UHFFFAOYSA-N	442.314	1.808	50	20	IDGD	
Cc1nc(N)sc1C(=O)N1CCCC2(CCN(C(=O)CCC(=O)NN(C)C)CC2)C1	1809874636	AAINIIVSMJVMDC-UHFFFAOYSA-N	436.582	1.252	50	20	IDGD	
C=CC[C@H](C)C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1	1810306398	YFHAUYAQMSXJHT-XAUMDUMWSA-N	436.516	1.612	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)CC2CCC2)[C@H]1c1cccnc1	1810307677	FXKPFBKKRYTPMY-UTKZUKDTSA-N	436.516	1.590	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2ncccc2F)[C@@H]1c1cccnc1	1813074151	QWUQJOPXBOCVDR-HRAATJIYSA-N	442.495	1.308	50	20	IDGD	
C[C@H]1CC[C@H](C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)CC1	1813546000	JYISFVPPAUJAHM-PGCKSFNISA-N	449.360	1.907	50	20	IDGD	
N[C@@H](Cc1cscn1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](O)CCl)n[nH]1	1814869828	CPWKTDWQRSTWTL-IACUBPJLSA-N	426.930	1.028	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)[C@@H](O)CCl)n[nH]2)cc1O	1814874739	CCTQZCVJYQPEOX-RDJZCZTQSA-N	449.895	1.979	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](O)CCl)n[nH]1	1814877753	KHDHNQCIJGKYIN-XNISGKROSA-N	438.912	1.757	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H]1C[C@@H]1C1CC1)CC2)c1cccc(B(O)O)c1	1815350426	VQCBRSWKIDFBRI-BZUAXINKSA-N	425.319	1.095	50	20	IDGD	
CC(C)(C)OCC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1815591700	XLCVAPVGXDFJBE-QGZVFWFLSA-N	428.298	1.211	50	20	IDGD	
CN1C(=O)CC[C@H]1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCBr)n[nH]1	1816783081	DGVRSGDGFSJWDU-OLZOCXBDSA-N	426.315	1.808	50	20	IDGD	
O=C(CCBr)Nc1cc([C@H]2CCCCN2C(=O)[C@H]2CCCS2(=O)=O)[nH]n1	1816784188	DBNOCDLVKBCDHN-CHWSQXEVSA-N	447.355	1.764	50	20	IDGD	
COCCOCCOCCC(=O)N[C@H]1CCc2nc(NC(=O)[C@H](F)Cl)sc2C1	1817133432	FRXBLYWENBSSRD-NHYWBVRUSA-N	437.921	1.659	50	20	IDGD	
O=C(CCN1CCOCC1)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](F)Br)[nH]n1	1817181126	MALRQBIIMZXTSQ-XJKSGUPXSA-N	446.321	1.815	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)CCc2cccnc2)[nH]n1)c1cccc(B(O)O)c1	1817475387	PNFFCAMTXWKRHM-FQEVSTJZSA-N	447.304	1.423	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@H](F)Br)[nH]n1)c1ccnnc1O	1820054211	VWYKTCHDWWVUIK-PWSUYJOCSA-N	427.234	1.902	50	20	IDGD	
Cc1cc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2ccc(B(O)O)cc2)CC3)ccn1	1820482403	HXBFQDWLMRNYRY-INIZCTEOSA-N	436.302	1.066	50	20	IDGD	
C[C@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](F)Br)n[nH]1)n1cncn1	1820936937	INZSMWQXIZZPPX-XWIASGKRSA-N	428.266	1.945	50	20	IDGD	
COCc1c[nH]c(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)CCC(=O)NN(C)C)CC3)c1	1821292294	KSORDOBMAPJWMH-CYBMUJFWSA-N	448.549	1.216	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)Cc2ncccn2)CC1	1825322069	XVGJNCNPKFZJLR-SFHVURJKSA-N	430.553	1.012	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(O)nc(O)c1)CC2	1825998867	NOKKCZKBDBUOEU-ZJUUUORDSA-N	426.882	1.429	50	20	IDGD	
Cc1n[nH]c(C)c1C(=O)N[C@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1	1826088624	YWRRGHYNMUETSJ-LBPRGKRZSA-N	433.538	1.082	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H](N)c2ccccn2)CC1	1826917977	VKPCNJDXILBRGF-KNQAVFIVSA-N	444.580	1.074	50	20	IDGD	
O=C(/C=C/c1cnccn1)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827055075	OUYSDNZPXHKFIP-HYGBKTPJSA-N	448.332	1.103	50	20	IDGD	
CC(=O)Nc1cc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)[C@@H](O)CCl)CC2)ccn1	1827975553	SJCLPLZTNSNHOB-MSOLQXFVSA-N	436.940	1.873	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(OC)c(F)c3)CCO2)C1	1830151704	NPZHENVOTOOWOO-MGPUTAFESA-N	444.887	1.158	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3n[nH]c(C4CC4)c3F)C2)C1	1830357615	BKXGFEFTPLVPAD-FQEVSTJZSA-N	442.919	1.761	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)C(C)(C)C)CCO2	1830631832	IGCMAZYZBHXUFR-DEYYWGMASA-N	435.359	1.023	50	20	IDGD	
C[C@H](C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2)c1ccc(Cl)cc1	1830719872	NCOFDMGDMDNAMH-GZRFBZBPSA-N	445.343	1.500	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3n[nH]c(CC)c3F)C2)C1	1831644116	OPSOOIAZBBRFPX-YJYMSZOUSA-N	430.908	1.589	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCCCCC(=O)OC)C2)C1	1831656350	DGVKWCLTAYDGGS-UTKZUKDTSA-N	446.972	1.974	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(O)nc(O)n2)CC1	1831833904	QIMBBWBIEJMQOG-UKRRQHHQSA-N	426.901	1.375	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)CCN2CCCCC2)CC1	1831871618	VPVOUTHCWBPYDL-NRFANRHFSA-N	449.640	1.855	50	20	IDGD	
Cc1cnc(C(=O)N2CCC([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)cn1	1831872117	OTXBFUOZXCXBJQ-LJQANCHMSA-N	430.553	1.391	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ncc(F)cc3F)CCO2)C1	1831968541	WUHOZEDJJXTLIK-DIFFPNOSSA-N	448.264	1.213	50	20	IDGD	
COCCOCC(=O)NC1CCN(C2CCN(C(=O)[C@H](C)Br)CC2)CC1	1834566690	GVGUUWYDIXDYJC-AWEZNQCLSA-N	434.375	1.004	50	20	IDGD	
COC1(CC(=O)N2CCOC[C@]3(CN(C(=O)CCBr)CCO3)C2)CCC1	1834826096	BBKJVANQGYZUDE-SFHVURJKSA-N	433.343	1.187	50	20	IDGD	
CCN(C)[C@@H](C)C(=O)N1CCC(N2CCC(NC(=O)CO[Si](C)(C)C)CC2)CC1	1835837563	MSTXBERITZQHPU-KRWDZBQOSA-N	426.678	1.750	50	20	IDGD	
O=C([C@H](F)Cl)N1CCOC[C@]2(C1)CN(C(=O)[C@@]1(F)CCCCC1(F)F)CCO2	1836627711	MZCMQWGGGVGOKE-RCBQFDQVSA-N	430.826	1.895	50	20	IDGD	
COc1cc(C#N)cc(C(=O)N2CCC(OC3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)c1	1836717972	GTJFRSLDDDPSSR-FQEVSTJZSA-N	449.935	1.779	50	20	IDGD	
Cc1cc(/C=C/C(=O)N2CCO[C@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)no1	1837552308	JLFSDFJCQUCFDM-DPZZJQGRSA-N	425.913	1.718	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc4c3OCC4)C2)C1	1837713325	WDGAWCMQSOYCII-QFIPXVFZSA-N	448.592	1.543	50	20	IDGD	
O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(F)ccc1F)CCO2	1838858919	XICZSXCZNZNMHP-GOSISDBHSA-N	447.276	1.820	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3noc4ccccc34)C2)C1	1839143654	CYONKMJOPQQASR-HRAATJIYSA-N	435.908	1.844	50	20	IDGD	
Cc1ccn(C)c1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839201721	HKRIOUBEXRIHDI-YOEHRIQHSA-N	432.290	1.094	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C[C@H]3C[C@@H]4CC[C@H]3C4)C2)C1	1840155409	BCDBOXWKNKITPD-OHHNFCFSSA-N	428.957	1.523	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)C3CC(C)(C)C3)CCO2)C1	1840222731	NEFUFQZSDFQWHI-AUUYWEPGSA-N	431.371	1.910	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CC(OCC)OCC)CCO2)C1	1840279761	AOSYMRGJXVNUNU-JXFKEZNVSA-N	434.961	1.640	50	20	IDGD	
Cc1cnn([C@H](C)C(=O)N2CCO[C@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)c1	1840400725	DOMDLYARZCHFPG-OXQOHEQNSA-N	426.945	1.474	50	20	IDGD	
CN(CC(=O)N1CC2(CCCN2C(=O)[C@@H]2CCCCO2)C1)NC(=O)NCc1ccccc1	1841104368	PMAKDCJNKMPPFE-IBGZPJMESA-N	443.548	1.105	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@H](CCN)NC(=O)OC(C)(C)C)C2	1841667441	KXLKASFQWYDWAB-LSDHHAIUSA-N	430.977	1.839	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@H]2CC(=O)N(Cc3cccs3)C2)C1	1841980551	XUVRNJOKBLXTAQ-ZBFHGGJFSA-N	439.965	1.554	50	20	IDGD	
O=C([C@H]1C[C@H]1c1ccc(F)c(F)c1)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843012747	LDDWCDYJFDNNAN-ROUUACIJSA-N	440.255	1.265	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC2(CCCN2C(=O)[C@H](CO)NC(=O)OC(C)(C)C)C1	1843324754	YOMONMUKQUWULG-OLZOCXBDSA-N	448.358	1.106	50	20	IDGD	
C[C@@H](NC(=O)c1ccc(F)cc1)C(=O)N1CCCC12CN(C(=O)CO[Si](C)(C)C)C2	1845003805	YQSJDIWSNBYTDI-OAHLLOKOSA-N	435.572	1.999	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)[C@@H](C)n2ccnc2C)C1	1846657043	VXEMHCAZUXQFJF-LZCVXGSNSA-N	425.493	1.090	50	20	IDGD	
Cc1nn(-c2ccccc2)c2sc(C(=O)NNC(=O)C[C@@H]3CCS(=O)(=O)C3)cc12	10105052	APRIFWRKFYUPLC-ZDUSSCGKSA-N	432.527	1.981	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@H]2CC(=O)N(Cc3ccco3)C2)cc1Br	13629298	FHJGBLSTTYEHAS-LBPRGKRZSA-N	436.262	1.860	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(C(=O)CCC(=O)NN(C)c3ccccc3)CC2)cc1	15133647	MDBHLUHFWIIGAT-UHFFFAOYSA-N	444.557	1.776	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)c2nn(-c3cccc(C(F)(F)F)c3)c(C)cc2=O)n1	16056908	MVAINRKSIRQBPD-UHFFFAOYSA-N	448.405	1.834	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)CCN2C(=O)COc3ccccc32)cc1	18071520	UJZVDQAUFLFEBB-OAHLLOKOSA-N	427.457	1.816	50	20	IDGD	
O=C(COC(=O)CN1C(=O)CCOc2ccccc21)NNC(=O)c1ccc(Cl)cc1	27785532	GALWSIDEKDNOPI-UHFFFAOYSA-N	431.832	1.460	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)C[C@@](O)(c2nccn2C)C(F)(F)F)c1C	105569941	FMGVDCGCYWSLKP-FZKQIMNGSA-N	428.411	1.792	50	20	IDGD	
COCc1nc(OC)c2c(C)c(C(=O)NNC(=O)CNC(=O)c3cccs3)sc2n1	725740622	FWLNSFGLNAHLFH-UHFFFAOYSA-N	449.514	1.407	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCCC[C@@H]2[C@H](C)NC(=O)OC(C)(C)C)n1	726598215	BPGZHFGLNFEXRL-LSDHHAIUSA-N	439.582	1.909	50	20	IDGD	
O=C(CNC(=O)[C@@H]1c2ccccc2C(=O)N1C1CC1)NNc1nc(-c2cccnc2)no1	728075136	YNHLRPRLZRGZIV-KRWDZBQOSA-N	433.428	1.050	50	20	IDGD	
Cc1nn(-c2ccccc2)cc1C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	728341123	FJHAVNCNPWTKAP-LJQANCHMSA-N	436.424	1.325	50	20	IDGD	
COc1ccc(C(C)=NNC(=O)[C@H](C)NS(C)(=O)=O)cc1CSc1ncccn1	728435982	BMAXHYBOAFFXPD-ZDUSSCGKSA-N	437.547	1.555	50	20	IDGD	
Cc1ccc([C@@]2(C)NC(=O)N(CC(=O)NNC(=O)c3cccc(OC(F)F)c3)C2=O)cc1	728488047	FWGXYHPDCKNKRE-OAQYLSRUSA-N	446.410	1.825	50	20	IDGD	
O=C(CNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)Nc1cccc2ccccc12	728961639	JNEGFVIVNABWMH-UHFFFAOYSA-N	447.499	1.815	50	20	IDGD	
CCOc1ccc(S(=O)(=O)Nc2cccc(C(=O)NNC(=O)Cc3cc[nH]n3)c2)cc1	730102596	HBSKASAQWPFCFL-UHFFFAOYSA-N	443.485	1.613	50	20	IDGD	
C[C@@H]1CCCN(S(=O)(=O)c2cc(C(=O)NNC(=O)NC3CCCCC3)n(C)c2)C1	730205711	CMWRMULEORRSRL-CQSZACIVSA-N	425.555	1.722	50	20	IDGD	
CS(=O)(=O)Nc1cccc(CC(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)c1	730342566	RCWAHPJWEYREGU-UHFFFAOYSA-N	439.877	1.258	50	20	IDGD	
Cc1c(NC(=O)NNC(=O)COc2ccccc2O)cccc1C(=O)N1CCOCC1	730898682	JBHUUFUWCQVZEZ-UHFFFAOYSA-N	428.445	1.405	50	20	IDGD	
CC[C@@H](NC(=O)NNC(=O)COc1ccccc1O)c1ccccc1OCC(=O)N(C)C	730902290	GXVIZAYDOPKBDG-MRXNPFEDSA-N	444.488	1.720	50	20	IDGD	
CCOCC(=O)NNC(=O)NCCCN1CCN(c2cccc(C(F)(F)F)c2)CC1	731281147	WGXJTOXVOSFYOG-UHFFFAOYSA-N	431.459	1.584	50	20	IDGD	
O=C(NNc1nc(-c2cccnc2)no1)[C@H]1CS[C@@H](Cc2ccccc2F)C(=O)N1	732111062	ZBYAVCJKZOJEJZ-CABCVRRESA-N	428.449	1.557	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1	732302648	MCJGLKIOTZDSPI-LBPRGKRZSA-N	438.487	1.808	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNc1cnnc2ccccc12	733808886	LXCNGRLXDQYBJF-UHFFFAOYSA-N	441.513	1.727	50	20	IDGD	
C/C=C\C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCN(Cc3ccccc3)CC2)cc1	737771651	CWEWEEOJHVRUKR-KXFIGUGUSA-N	442.541	1.530	50	20	IDGD	
CC(C)C(=O)Nc1ccc(Cl)c(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c1	741659928	RRHVONFCESSHKD-UHFFFAOYSA-N	427.852	1.985	50	20	IDGD	
CN(CC(=O)NNC(=O)c1cccs1)C[C@H](O)COc1ccccc1C(F)(F)F	741797897	BQXLGJPKJJKJOB-LBPRGKRZSA-N	431.436	1.900	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)[C@]1(C)CCCN(C(=O)c2ccccc2)C1	742077532	WOPLSNFWBHLPHZ-JOCHJYFZSA-N	447.536	1.784	50	20	IDGD	
CN(CCCNC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)Cc1ccccc1	743523411	NPCAJCOKWGJSHK-UHFFFAOYSA-N	433.534	1.948	50	20	IDGD	
CCOC(=O)C1CCN(C(=O)[C@H](C)OC(=O)/C(C#N)=C/c2cc(C#N)n(C)c2C)CC1	744630593	ARLVDLFWCPEZQH-ZNBBLSJYSA-N	426.473	1.846	50	20	IDGD	
NC(=O)N[C@H](CC(=O)NNC(=O)[C@@H]1COCCO1)c1cccc(Oc2ccccc2)c1	744645630	AKFIEUAEGGTDDN-MSOLQXFVSA-N	428.445	1.141	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)c2ccc3c(=O)n(C)c(S)nc3c2)o1	746393006	USONPKVXHYWKGO-UHFFFAOYSA-N	429.502	1.732	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)N[C@@H](Cc1ccccc1)CN1CCOCC1	746764931	LRFAYZODVSVNLH-IBGZPJMESA-N	436.516	1.151	50	20	IDGD	
O=C(CCOc1ccccc1)NNC(=O)c1ccc2c(c1)C(=O)N(C[C@H]1CCCO1)C2=O	747179397	RZTJPWZAXNSWQN-QGZVFWFLSA-N	437.452	1.692	50	20	IDGD	
O=C(NNC(=O)C1CCN(S(=O)(=O)c2ccc3c(c2)OCCCO3)CC1)c1ccc[nH]1	747661779	APZNIRYZPSHQFV-UHFFFAOYSA-N	448.501	1.038	50	20	IDGD	
O=C(NNc1ccc(Br)cc1F)[C@H]1CC(=O)N([C@@H]2CCS(=O)(=O)C2)C1	748171493	RXWUZAJWTKSMCA-GXSJLCMTSA-N	434.287	1.067	50	20	IDGD	
N#CCCCS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cc(Br)c[nH]2)cc1	748211279	DAJALQDMNODCFU-UHFFFAOYSA-N	439.291	1.929	50	20	IDGD	
CCCC(O)(CCC)CC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	749176105	PNILBVILMDFSBA-UHFFFAOYSA-N	441.550	1.190	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12)c1cnn(C)c1	749865863	VPLWIUBWWHQHBB-OAHLLOKOSA-N	430.468	1.743	50	20	IDGD	
COc1cc([N+](=O)[O-])ccc1OC(=O)c1cc(S(=O)(=O)N2CCOCC2)cn1C	751167915	BDMDIOUZWVWQMQ-UHFFFAOYSA-N	425.419	1.182	50	20	IDGD	
COC[C@@H](C)n1c(SCC(=O)NNC(=O)N2CCOCC2)nnc1-c1ccccc1	751387263	PQLCIHLGAFRWBE-CQSZACIVSA-N	434.522	1.318	50	20	IDGD	
CCOCCCn1c(NNC(=O)CNC(=O)c2cccs2)nc2ccccc2c1=O	752038453	YBXOEMWRLFGJLM-UHFFFAOYSA-N	429.502	1.758	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)c3cnn4c3C[C@H](CNC(C)=O)CC4)n[nH]2)cc1	753258474	FXOGBCDBQHXPCA-MRXNPFEDSA-N	449.515	1.609	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(C(=O)O)c(C(F)(F)F)c1)c1cccc([N+](=O)[O-])c1	754739145	KIGWDOUPZNAPDX-UHFFFAOYSA-N	433.320	1.935	50	20	IDGD	
CN(C)c1ccc(S(=O)(=O)N2CCCCC2)cc1NC(=O)NNC(=O)c1cnn(C)c1	755435186	MXYPNDHROPPHNB-UHFFFAOYSA-N	449.537	1.127	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)Nc2ccc3c(c2)C(=O)NCC3)c2ccccc2c1=O	756616114	ICRDYBPQYNGYGC-UHFFFAOYSA-N	434.456	1.730	50	20	IDGD	
C[C@H]1C[C@H](C)CC2(C1)NC(=O)N(CC(=O)NNC(=O)Nc1ccc(N(C)C)cc1)C2=O	757644906	BBZYKOFQEUHRJW-KBPBESRZSA-N	430.509	1.652	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)Nc1cnn(-c2cnc3ccccc3n2)c1	757782852	JUFIROFJRUDJDM-SFHVURJKSA-N	431.412	1.808	50	20	IDGD	
N#Cc1cccc(OCCCCC(=O)N2CCN(S(=O)(=O)CBr)CC2)c1	758528854	YJPLWUWEQCOASZ-UHFFFAOYSA-N	444.351	1.934	50	20	IDGD	
CN(NC(=O)Cn1c(=O)cnc2ccccc21)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758786547	NHNKXGAUMSLTCB-UHFFFAOYSA-N	444.492	1.032	50	20	IDGD	
O=C(NNC(=O)C(=O)Nc1ccccn1)N[C@H]1CCN(c2ccccc2OC(F)F)C1	758793144	MCOQBWDWHDQDDV-LBPRGKRZSA-N	434.403	1.231	50	20	IDGD	
CN1C(=O)C[C@@H](C(=O)NNc2nccc(N3CCOCC3)n2)[C@H]1c1ccc(Cl)c(F)c1	760172206	DVEISODIBUIIIL-FZKQIMNGSA-N	448.886	1.768	50	20	IDGD	
NC(=O)[C@H]1CC[C@H](CNC(=O)NNC(=O)c2cc(-c3ccccc3)nc3ccccc23)O1	760204299	QGKFQZRXJCGQLY-FOIQADDNSA-N	433.468	1.879	50	20	IDGD	
CCS(=O)(=O)c1cccc(S(=O)(=O)NNC(=O)c2ccc(Cl)cc2OC)c1	760340813	XDSIPLOWXVJDJL-UHFFFAOYSA-N	432.907	1.766	50	20	IDGD	
CC[C@H](C)n1ncc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1C1CC1	760627912	SSBWYMDJMKERSD-SCLBCKFNSA-N	442.472	1.876	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NC2CCC(O)(c3ccccc3)CC2)c1	761035948	UXYFXIJEYFGRIH-UHFFFAOYSA-N	431.514	1.865	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(CNC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)C1	762610523	BSWROGDNZGWMJQ-UHFFFAOYSA-N	430.465	1.389	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)c3cc(S(=O)(=O)NC(C)C)c[nH]3)n[nH]2)cc1	762956681	SVQCVSCWGJFSSM-UHFFFAOYSA-N	430.490	1.475	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cccnc2)n(-c2cccc(C(F)(F)F)c2)n1	763489229	XLYMZGVJFMXSCA-UHFFFAOYSA-N	432.362	1.994	50	20	IDGD	
CN(C)C(=O)C[C@@H]1CN(C(=O)C(=O)NNC(=O)c2ccccc2O)c2ccc(Cl)cc21	763525329	AEGMYSACQISVRU-GFCCVEGCSA-N	444.875	1.415	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2ccc(CN3CCOC3=O)cc2)c1	763664849	JZXWCHXDNFUQBE-UHFFFAOYSA-N	440.456	1.421	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2c(F)cccc2-n2cccn2)c1	763773422	XKEJERKHFYCDCG-UHFFFAOYSA-N	427.392	1.428	50	20	IDGD	
N#CCCSc1ccccc1NC(=O)C(=O)NNC(=O)COc1ccccc1[N+](=O)[O-]	763804136	KXHVVVABHJSOIB-UHFFFAOYSA-N	443.441	1.765	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(N3C[C@H](C)O[C@H](C)C3)nc2)cc1	763820498	IIZHFHYAKZVLTE-IYBDPMFKSA-N	441.488	1.169	50	20	IDGD	
COc1ccc2cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc3ccccc3F)ccc2n1	763851555	UFTNCWVOEDKNEH-LBPRGKRZSA-N	426.404	1.936	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)NNC(=O)C(=O)Nc1ccccc1CN1C(=O)CCC1=O	763865163	LFPOWXNBYHFKHF-UHFFFAOYSA-N	447.451	1.146	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccc(OCC(F)(F)F)nc1	763865496	KRKLPKBGZVOGLU-JTQLQIEISA-N	444.341	1.715	50	20	IDGD	
CCNC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)c1	763871504	HCBPVIQBKBUCRC-LBPRGKRZSA-N	431.424	1.521	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(OC)c(OC)c2)cc1OC	763910284	BJKFSPVUQVWITR-UHFFFAOYSA-N	431.445	1.901	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)C[C@@H](OC)C3)ccc1OC(C)C	763916925	YXFMTSZAZZGFPZ-SFHVURJKSA-N	441.484	1.996	50	20	IDGD	
CN(C)c1nnc(-c2ccc(NC(=O)C(=O)NNC(=O)Cc3ccc(Cl)cc3)cc2)o1	763936120	DXTSHDJVJRCBBY-UHFFFAOYSA-N	442.863	1.785	50	20	IDGD	
O=C(Cc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1cc(F)cc(N2CCOCC2)c1	763936684	OUKLGCYSGQJDJH-UHFFFAOYSA-N	434.855	1.644	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)C(=O)Nc1ccnn1Cc1ccccc1	763995999	SXHDFZVXAJMRNN-UHFFFAOYSA-N	431.250	1.422	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1cccc(OC[C@H]2CCCO2)c1	764004152	LIGDMRBSBOEQCL-QGZVFWFLSA-N	441.440	1.415	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2cc(Cl)ccc2Cl)c1	764076764	FSTLOTGYWMPZPB-UHFFFAOYSA-N	430.269	1.797	50	20	IDGD	
CC(C)(C)OCc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1	764077135	HRXRWWXATOPJPV-UHFFFAOYSA-N	447.513	1.805	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccccc2SC(F)F)c1	764078315	QLRQVNGIHUEBFE-UHFFFAOYSA-N	443.453	1.805	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3ccc(Cl)nc3)cc2F)C[C@@H](C)O1	764099982	FNXNXJWSSPYZQU-TXEJJXNPSA-N	449.870	1.887	50	20	IDGD	
CC(C)(C)n1cc(NC(=O)C(=O)NNC(=O)c2cc(F)ccc2Br)cn1	764270472	NTFSOUQQDUQVOV-UHFFFAOYSA-N	426.246	1.939	50	20	IDGD	
O=C(NNC(=O)C1CCC1)C(=O)Nc1cc(Br)cnc1OCC(F)(F)F	764338883	MSEGAZVATKHLQF-UHFFFAOYSA-N	439.188	1.671	50	20	IDGD	
O=C(CCCc1cccs1)NNC(=O)C(=O)Nc1ccc(C[C@@H]2CC(=O)NC2=O)cc1	764340427	CAVVJMYRTFITLA-CQSZACIVSA-N	442.497	1.062	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)C(=O)Nc1cccc(C(=O)NC2CC2)c1	764346397	ZUHIIZMFZNOOTC-UHFFFAOYSA-N	432.440	1.164	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)C(=O)Nc2ccc(C(F)(F)F)cc2Br)cn1	764359201	MENJHOYTIDIDDT-UHFFFAOYSA-N	434.172	1.601	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1cccc([C@H]2CNC(=O)C2)c1	764394313	YXDZGQYUXSEDMB-CQSZACIVSA-N	442.497	1.177	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)C(=O)Nc2ccc(Oc3ccc(C)cc3)nc2)c1	764431442	XGKOIIWFOMTPJA-UHFFFAOYSA-N	448.439	1.935	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@H]2CN(C(=O)OC(C)(C)C)CCO2)ccc1OC(C)C	764569873	CNSFZSGVTGQULG-QGZVFWFLSA-N	437.493	1.879	50	20	IDGD	
COc1nccnc1NNC(=O)Nc1ccc(N2CCOCC2)cc1N1CCOCC1	764602110	WTVKBEPWXQRRGK-UHFFFAOYSA-N	429.481	1.307	50	20	IDGD	
COC(=O)NNC(=O)C(=O)Nc1cc(OCC(F)(F)F)cc(OCC(F)(F)F)c1	765375685	GXSWPVVNFSAKCY-UHFFFAOYSA-N	433.261	1.895	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@@H](C)Oc3ccc(F)cc3)CC2)cc1	765748071	JGLGANPOGKAKBU-GOSISDBHSA-N	428.508	1.867	50	20	IDGD	
O=C(NNc1cnccn1)C(=O)Nc1cc(Br)cnc1OCC(F)(F)F	766259902	HDECYVORYXFNEM-UHFFFAOYSA-N	435.160	1.657	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1ccc(N2CCC(CN(C)C)CC2)cc1	766268188	ATUAPNZMVSJZAP-UHFFFAOYSA-N	427.509	1.345	50	20	IDGD	
O=C(O)CC1(CC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)CCCC1	767140413	NHWIJDIWTABFQI-UHFFFAOYSA-N	437.518	1.657	50	20	IDGD	
CN1CCN([C@@H](C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)c2ccccc2)CC1	768277107	RSECBRAAJLPCLH-OAQYLSRUSA-N	436.491	1.966	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCCc2cn3c(n2)SCC3)nc1	768524256	MUVWWEMFOJWOIQ-UHFFFAOYSA-N	439.567	1.283	50	20	IDGD	
CC(=O)N1CCc2c(NC(=O)C(=O)NNC(=O)c3cc4ccccc4cc3O)cccc21	769251078	DDRRKLOUUHNSLJ-UHFFFAOYSA-N	432.436	1.854	50	20	IDGD	
Cc1cnn(Cc2ccccc2F)c1NC(=O)C(=O)NNC(=O)COc1ccccc1F	769256042	NKFIJIQSZKVTLP-UHFFFAOYSA-N	443.410	1.683	50	20	IDGD	
CN(CCNC(=O)NNC(=O)Cn1ccc2ccccc21)S(=O)(=O)c1cccs1	771974631	BQLUMUXKRGDJMD-UHFFFAOYSA-N	435.531	1.354	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1cc(S(=O)(=O)NC(C)(C)C)ccc1Cl	772183487	YGTHCDYYJCWOMT-SNVBAGLBSA-N	433.914	1.520	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1cc(-n2cnnn2)ccc1F	774008118	FUOQPSHXRRILPV-JTQLQIEISA-N	447.814	1.008	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)cc1C(=O)N(C)C	774009452	PVZREVVFIHRIFE-CYBMUJFWSA-N	446.891	1.904	50	20	IDGD	
Cc1cccc(S(=O)(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)c1Cl	775669774	OQJULFUZAHXFMR-UHFFFAOYSA-N	438.314	1.573	50	20	IDGD	
CS(=O)(=O)c1cccc(Cl)c1C(=O)OCC(=O)NNC(=O)c1cccc(C#N)c1	775915066	GEDKBKHTCVGYSR-UHFFFAOYSA-N	435.845	1.233	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)NC[C@H]1COC2(CCOCC2)O1	777761577	VPBHVCNYAYSTMT-BEFAXECRSA-N	429.473	1.860	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c2ccccc12	777906521	BSBYMRBKLFFPJN-IBGZPJMESA-N	441.465	1.948	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1)N[C@H]1CCC[C@H]1CCO	779710321	CKZDIKCJDLIDKG-PXNSSMCTSA-N	449.515	1.884	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C(=O)Nc2cccnc2Br)nc2ccccc21	782895284	ZHPZUUXYGUEEHY-UHFFFAOYSA-N	431.250	1.059	50	20	IDGD	
CCCOc1ccccc1NC(=O)C(=O)NNC(=O)c1csc(N2CCOCC2)n1	782898339	ZNQDSUFEFJOMOW-UHFFFAOYSA-N	433.490	1.168	50	20	IDGD	
O=C(NNc1ncccc1C(F)(F)F)C(=O)Nc1cccc(C(=O)N2CCOCC2)c1	783118702	UTAUXUVCISGTDY-UHFFFAOYSA-N	437.378	1.655	50	20	IDGD	
Cn1cc(Br)cc(NC(=O)C(=O)NN=c2sc3ccccc3n2C)c1=O	783352109	XWMGNYZPIJKGSW-UHFFFAOYSA-N	436.291	1.272	50	20	IDGD	
Cc1ccccc1NC(=O)NNC(=O)C(=O)Nc1ccc(NC(=O)[C@H]2CCCO2)cc1	783415512	FEDWWKDYKYRKIO-QGZVFWFLSA-N	425.445	1.904	50	20	IDGD	
O=C(NNC(=O)N1CC[C@H](Oc2cccc(F)c2)C1)c1csc(N2CCOCC2)n1	784170169	BTMYSPNBBZIOJG-HNNXBMFYSA-N	435.481	1.627	50	20	IDGD	
CC[C@@H](C)n1nc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)cc1C	784215002	APNDUUAUAOOMDI-GFCCVEGCSA-N	434.522	1.685	50	20	IDGD	
COc1cccc(NNC(=O)C(=O)Nc2cc(C(=O)NCC(F)(F)F)ccc2C)n1	784843264	JVXLHEOFBXOCDF-UHFFFAOYSA-N	425.367	1.773	50	20	IDGD	
CCOC(=O)[C@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNc2ccnc(F)c2)cc1F	784848606	HIMKDPFHANFJLH-JTQLQIEISA-N	435.387	1.123	50	20	IDGD	
C[C@H]1CCCCN1CC(=O)Nc1ccc(F)c(NC(=O)C(=O)NNc2cccnn2)c1	784858451	MVYUNVGVLBYTKL-ZDUSSCGKSA-N	429.456	1.510	50	20	IDGD	
CC(C)CNC(=O)c1ccc(NC(=O)C(=O)NNc2ccnc(N(C)C)n2)cc1Cl	784970695	YPPZFMJQQDSAFF-UHFFFAOYSA-N	433.900	1.664	50	20	IDGD	
COC(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)c2cc(-c3cc(C)ccc3C)[nH]n2)c1	785126881	SUEYKCIHKRMTCW-UHFFFAOYSA-N	449.467	1.809	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1ccccc1Br	785338676	NHYAYACLPHRROX-UHFFFAOYSA-N	442.291	1.943	50	20	IDGD	
COC(=O)c1ccc(S(=O)(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)c(OC)c1	785480493	HWDKHSUZKBMGMB-UHFFFAOYSA-N	435.458	1.047	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2cccc(F)c2)cc1O)c1csc(N2CCOCC2)n1	785699857	GADRSWDQJYDVLG-UHFFFAOYSA-N	432.437	1.085	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)N[C@@H]2CCCN(Cc3ccc(F)cc3F)C2=O)c1	786972237	JJUPRYTVKBUKIA-GOSISDBHSA-N	427.411	1.972	50	20	IDGD	
CN1C(=O)Cc2cc(NC(=O)C(=O)NNc3nc(-c4ccc(Cl)cc4)no3)ccc21	789763140	FFWIXTFFTGKFCP-UHFFFAOYSA-N	426.820	1.991	50	20	IDGD	
C[C@H](C(=O)NNC(=O)Cc1ccccc1F)[C@H](C)C(=O)NNC(=O)Cc1ccccc1F	790607226	STZQEVLWWGOFGY-KBPBESRZSA-N	446.454	1.317	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)N1CCNC(=O)[C@@H]1c1ccc(OC(F)(F)F)cc1	792361199	XGJIFGQNQHICHE-LRDDRELGSA-N	430.427	1.640	50	20	IDGD	
Cc1cccnc1NNC(=O)C(=O)Nc1ccc2c(ccn2CC(=O)N2CCOCC2)c1	792379714	MJYWXJUMICMPRF-UHFFFAOYSA-N	436.472	1.285	50	20	IDGD	
CCS(=O)(=O)c1ccc(CNC(=O)NNC(=O)CNC(=O)OCc2ccccc2)cc1	793042190	QJUSWXQBJILOCK-UHFFFAOYSA-N	448.501	1.237	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@@H]2C(=O)NNc2ccccc2S(=O)(=O)N(C)C)cc1	795152574	TVKQYFKJBDRQAW-GOSISDBHSA-N	446.529	1.693	50	20	IDGD	
O=C(COC(=O)c1cnc2c(F)cccc2c1)NNC(=O)[C@@H]1COc2ccccc2O1	795839691	NAWPDPXSZHMKFM-KRWDZBQOSA-N	425.372	1.518	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H]2[C@@H](C1)[C@@H]2C(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	796083149	XZXGVCWHJFZBGY-FOLVSLTJSA-N	448.432	1.012	50	20	IDGD	
CN(CCN1CCN(Cc2ccccc2)CC1)CC(=O)NNC(=O)c1ccccc1Cl	796276494	NQEPVOSVMLXWHJ-UHFFFAOYSA-N	443.979	1.851	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)COc2cc(C)cc(C)c2)c(OC)c(C)c1OC	796992770	XDMCCQNCRRJMPR-UHFFFAOYSA-N	445.472	1.803	50	20	IDGD	
CSc1c(F)cccc1C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	798110982	UKUNGSAZULUHOV-UHFFFAOYSA-N	439.538	1.636	50	20	IDGD	
COc1cc(C)nc(NNC(=O)NCCCNS(=O)(=O)c2ccccc2Cl)n1	798495357	YCDMQLCWJHYZGB-UHFFFAOYSA-N	428.902	1.442	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1ccc(NCC2CC2)nc1	800692368	PEWOTZAVYHDXCR-UHFFFAOYSA-N	431.518	1.681	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2ccc(S(=O)(=O)N=c3cc[nH]cc3)cc2)cc1	802056847	DBCOQTTVYKUZKJ-UHFFFAOYSA-N	441.469	1.779	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)N[C@@H]2CCN(C(=O)Nc3ccccc3)C2)nc2ccccc21	802499619	DZNHNPGYVAHIJF-MRXNPFEDSA-N	435.488	1.753	50	20	IDGD	
COCCN(CCOC)C1CCN(C(=O)NNC(=O)c2cc(Br)c[nH]2)CC1	804869116	KUGCVAULLAHZOE-UHFFFAOYSA-N	446.346	1.191	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN1C(=O)C(F)(F)F)c1ccc(F)cc1Br	806527240	JSYNYDMVRCRELE-SNVBAGLBSA-N	426.164	1.903	50	20	IDGD	
O=C1COC[C@@H](C[C@H]2CN(C(=O)C(=O)NNc3ccc(F)c(F)c3F)c3ccccc32)N1	806968037	VDHLHWOJACPDKY-NWDGAFQWSA-N	448.401	1.583	50	20	IDGD	
Cn1[nH]cc2c(=NC(=O)C(=O)NNC(=O)c3ccc(-c4ccc(F)cc4)s3)ccnc1-2	806975640	IQWVRCOLSOKPOQ-UHFFFAOYSA-N	438.444	1.609	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)C(=O)CC(C)(C)O3)c1	806980253	MXHKCMJDNCCGNK-UHFFFAOYSA-N	439.428	1.184	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)NC2C[C@@H]3CC[C@H](C2)N3CC(=O)N(C)C)cc1	807515087	WMVFQVVBVLNGFZ-ALOPSCKCSA-N	433.578	1.501	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1c[nH]nc1-c1ccccn1	810462455	QZBJEANUVSKYAU-UHFFFAOYSA-N	428.474	1.250	50	20	IDGD	
O=C(COC(=O)[C@@H]1CCN(c2ccccc2F)C1)NNC(=O)c1cccc([N+](=O)[O-])c1	811374642	FXUCPFNGHMXKPU-CQSZACIVSA-N	430.392	1.565	50	20	IDGD	
CS(=O)(=O)C1(C(=O)NNC(=O)c2ccc(-c3ccc(F)cc3)s2)CCOCC1	814252885	NUQBLWSXDYMJIK-UHFFFAOYSA-N	426.491	1.909	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2O)cc1S(=O)(=O)C1CCCC1	815563875	QMLVXICSPCXHRK-UHFFFAOYSA-N	445.497	1.817	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)COc2ccccc2F)nnn1Cc1ccccc1F	815565055	AZTGONDPMAGUEA-UHFFFAOYSA-N	444.398	1.078	50	20	IDGD	
CCOC(=O)CN1C(=O)C(F)(F)c2cc(NC(=O)C(=O)NNc3cc(C)ccn3)ccc21	815592300	FAKBQFRIPAZJSL-UHFFFAOYSA-N	447.398	1.473	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1ccc(OCC2CC2)cc1	815752391	QAJADXMTWXYDMD-UHFFFAOYSA-N	432.502	1.808	50	20	IDGD	
CCOC(=O)[C@H](CC(=O)NNC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1)C(C)=O	816829015	XTHKCRHQZINSDL-GOSISDBHSA-N	449.467	1.854	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)c2cc(S(N)(=O)=O)c(C)o2)c1	818767832	QYCSPPZMKDFHKG-UHFFFAOYSA-N	432.252	1.541	50	20	IDGD	
CCN1CCC[C@@H]1CNC(=S)NNC(=O)c1ccc(CSc2nncn2C)cc1	884065108	DOQILEROPRGXKP-MRXNPFEDSA-N	433.607	1.701	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(S(=O)(=O)N2CCCCC2)cc1)c1ccccc1F	906369909	YTJVCSYDZGAMTK-UHFFFAOYSA-N	441.506	1.624	50	20	IDGD	
CC(=O)Nc1cc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)ccc1C	915638261	BSJLGXRPHJTACQ-UHFFFAOYSA-N	444.513	1.813	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)NCc1ccnc(N2CCN(C)CC2)c1	916390402	OXPVJZNDSLPRIV-UHFFFAOYSA-N	432.912	1.640	50	20	IDGD	
CN(CCCNC(=O)NNC(=O)c1csc(N2CCOCC2)n1)C(=O)OC(C)(C)C	916579788	MFOXYBRDFIITSL-UHFFFAOYSA-N	442.542	1.181	50	20	IDGD	
CCCCS(=O)(=O)N1CCC(C(=O)NNC(=O)c2cc(-c3ccc(C)cc3)[nH]n2)CC1	917177140	OUZVOGHCHIXAFQ-UHFFFAOYSA-N	447.561	1.988	50	20	IDGD	
Cc1cccc(NC(=O)[C@@H]2CCCN(CC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)C2)n1	917400212	JKYDLQKEUGVNKN-MRXNPFEDSA-N	440.460	1.410	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)C[C@H](c1ccccc1)OC2=O)N[C@@H]1CCS(=O)(=O)C1	919886347	VSTQHXXTBNQREI-SJLPKXTDSA-N	443.481	1.272	50	20	IDGD	
COc1ccc(C(=O)Nc2ccccc2C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)cc1	920433510	VWQXJYRTTLTEAU-AWEZNQCLSA-N	431.470	1.143	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)CC2(N3CCOCC3)CCCC2)CC1	1116173410	AWCVCBFTZISBMP-UHFFFAOYSA-N	438.569	1.816	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(/C#N)C(=O)OCC(=O)N[C@@H]2CCS(=O)(=O)C2)c1C	1317697047	HYEZMUZDCRIXKK-QRLCYMJDSA-N	437.518	1.066	50	20	IDGD	
Cn1cc(-c2nn(C)cc2C(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)cn1	1320517152	XMTMNDFJVRIHRR-UHFFFAOYSA-N	431.497	1.229	50	20	IDGD	
C[C@H]1CC[C@@H](C)N1[C@H](C)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	1320622457	IWGOFLGBICORIM-IXDOHACOSA-N	436.578	1.884	50	20	IDGD	
CSCC[C@@H](C(=O)NNC(=O)c1n[nH]c2c1CCCC2)N1C(=O)[C@H]2CCCC[C@H]2C1=O	1337223332	UIBIIMYKOKISSG-ZENOOKHLSA-N	447.561	1.346	50	20	IDGD	
COc1ccc(C[C@@H](C)N(C)C(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1	1338142024	PBICBKRLIUFBGF-CQSZACIVSA-N	433.534	1.906	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cccnn2)C1	1779657256	JOYXNMOHGBAFTR-JCKWVBRZSA-N	425.327	1.778	50	20	IDGD	
O=C(c1cnc(Cl)s1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1779727798	HQCYZWIBDVOISC-NOZJJQNGSA-N	426.695	1.931	50	20	IDGD	
CC(C)NC(=O)OC(C)(C)C(=O)N1CC[C@]2(CN(C(=O)C(C)(C)CCl)CCO2)C1	1781017134	FORIJXKFFHNRTR-HXUWFJFHSA-N	431.961	1.995	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)c3cn4ncccc4n3)CCO2)C1	1781229288	FWOKAMLILSBJGY-ROUUACIJSA-N	426.304	1.409	50	20	IDGD	
Cc1nn(C)c(C)c1CC(=O)N1CCO[C@@]2(CCN(C(=O)[C@@](C)(Cl)CCl)C2)C1	1781231958	BZVUFOQJVNPTBY-OALUTQOASA-N	431.364	1.646	50	20	IDGD	
C[C@H](Oc1cccnc1)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@](C)(Cl)CCl)C2)C1	1781233218	KDJZIZCAELSIKI-KYNGSXCRSA-N	430.332	1.915	50	20	IDGD	
CC(C)c1nc(CC(=O)N2CCO[C@]3(CCN(C(=O)[C@H](F)Br)C3)C2)no1	1781325578	FUDGKZLGJIRRKC-XJKSGUPXSA-N	433.278	1.256	50	20	IDGD	
CC(C)(C)c1cnc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](F)Br)C3)C2)cn1	1781329629	ICFDZFFIASNEEK-KBXCAEBGSA-N	443.317	1.908	50	20	IDGD	
O=C([C@@H](F)Br)N1CC[C@@]2(C1)CN(C(=O)[C@@H]1Cc3ccccc3N1)CCO2	1781332634	CFYPLHPMSJTXEN-HDMKZQKVSA-N	426.286	1.544	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cncnc1)C2	1781900881	XACSJGDAOBKYAX-IIDMSEBBSA-N	425.327	1.778	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cnn(C)c3Cl)CCO2)C1	1783350740	BLXUEIOUVCHHST-BLLLJJGKSA-N	433.734	1.691	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cccc4nccn34)CCO2)C1	1783354257	XBJPIOOPJCPYFK-LIRRHRJNSA-N	435.322	1.951	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](C)Br)C3)C2)o1	1783533746	GVPHXNMSNAPOPK-APPDUMDISA-N	428.283	1.465	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)CCCC(=O)OC(C)(C)C)CCO2)C1	1783872073	ZYPAGOQECFDKDM-YWZLYKJASA-N	432.945	1.582	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(-c4cccnc4)[nH]n3)CCO2)C1	1783877475	JEVOTKCOMOKNCM-QRWLVFNGSA-N	433.896	1.169	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccccc3OC(F)F)C2)C1	1785149174	YDKWANNVJCXNAE-LIRRHRJNSA-N	432.851	1.985	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3nccnc3C)[C@H]2C1	1789037130	VLJMCBHTEKZKFB-XQLPTFJDSA-N	425.327	1.552	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC1(c2ccc(NC(=O)/C=N/N3CCCCC3)cc2)CCC1	1789516081	BKYBAKMWAZQBKG-JJIBRWJFSA-N	442.564	1.965	50	20	IDGD	
Cc1cc(C(=O)NC2(c3ccc(NC(=O)c4cnccc4C(=O)NN)cc3)CCC2)n(C)n1	1789521348	YSLIPEPSPJEYRW-UHFFFAOYSA-N	447.499	1.789	50	20	IDGD	
CCOCCC(=O)NC1(c2ccc(NC(=O)c3cnccc3C(=O)NN)cc2)CCC1	1789523877	ZCZDKILXOOTHGN-UHFFFAOYSA-N	425.489	1.859	50	20	IDGD	
COC(=O)[C@@H]1CC[C@@H](C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]3C2)C1	1791055197	NMZRHUMLJXYEAQ-ODICJLLRSA-N	445.354	1.339	50	20	IDGD	
COC(=O)[C@H]1CC=CC[C@@H]1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21	1791239451	VAQIRIDKLCBYBA-YTFOTSKYSA-N	433.332	1.525	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCOc3ccc(F)cc3)C[C@@H]21	1791249176	FNFFEGYQKHLVFL-QZHFEQFPSA-N	442.915	1.828	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1ccc(C2(NC(=O)c3cc[n+]([O-])cc3)CCC2)cc1	1791601137	OEGVRHNMIVXZBP-UHFFFAOYSA-N	425.489	1.441	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC1(c2ccc(NC(=O)[C@@H]3[C@H]4COC[C@H]43)cc2)CCC1	1792044676	SXFFPEZTJFDFGS-BWTSREIZSA-N	435.484	1.325	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(Cl)nc1	1792410053	NHEIBQSWJCNAEB-BTTYYORXSA-N	428.880	1.299	50	20	IDGD	
CC(C)(C)OC(=O)NCC1(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](O)CCl)C3)CC1	1792626902	JELUNGUUWQMZCS-XGUBFFRZSA-N	429.945	1.529	50	20	IDGD	
Cc1ccncc1CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)CBr	1792870799	VCUPBQJZMMZVEF-VYCZESIESA-N	438.366	1.943	50	20	IDGD	
COCc1c[nH]c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)CBr)c1	1792872587	PTMMRDAIFHUEEO-OEYIWLLWSA-N	428.327	1.395	50	20	IDGD	
CCOC(=O)C(C)(C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)CBr	1792872840	AGYKFOOSCQGDIJ-YIYPIFLZSA-N	433.343	1.196	50	20	IDGD	
O=C(/C=C/C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCBr)NCc1ccco1	1795493377	JUEMICZZMZKQDV-ISFILERXSA-N	438.322	1.875	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/C(=O)c1cccs1)c1ccc(B(O)O)cc1	1796894510	DJUKRLFFHAIYRQ-UUUZMKTPSA-N	438.314	1.119	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CS[C@H]1CCCCO1	1797800182	ODLXZXJDIKNNKP-IGNRKKQASA-N	435.384	1.619	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccnn1C(C)C	1798155711	PRFQRHZVMZPEEL-FQLMCAECSA-N	427.343	1.841	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(-c2cccnc2)[nH]n1	1798840427	XXOSZBFRCWKCSC-BJWYYQGGSA-N	439.520	1.097	50	20	IDGD	
CC[C@H](NC)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O	1799218022	SPTVEZCEUAJZNH-KRXQYRFLSA-N	432.477	1.770	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CN(Cc3ccccc3)CCO1)C2	1799267913	HXTRQPLNYQRORN-VIYGXFRKSA-N	449.979	1.494	50	20	IDGD	
CCS(=O)(=O)N[C@H](C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@](C)(Cl)CCl	1800076153	BQEDJWUAEIQJQH-VBTGVMJWSA-N	428.382	1.189	50	20	IDGD	
Cc1c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@](C)(Cl)CCl)cn2[nH]cnc(=O)c12	1800081786	NDHVVDYPAYCXHI-RJAOAUJVSA-N	440.331	1.819	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](O)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@](C)(Cl)CCl)C2	1800600516	UVKBDHPZBFZAKX-WMYYOOOSSA-N	438.352	1.704	50	20	IDGD	
COc1cc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)Br)ccn1	1800756740	HLDJJDDDEQQSGM-LJGDNWOOSA-N	440.338	1.396	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cn1cnc3ccccc31)C2	1800763039	MVAZTQPQRPXOTL-ZUMXRPEOSA-N	435.322	1.409	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(OC)c(O)cc1[N+](=O)[O-])C2	1802279050	KNMRHHYEUTWVER-GFQSEFKGSA-N	441.868	1.815	50	20	IDGD	
CC[C@@H](NC(C)=O)C(=O)NC[C@H]1CCN(C(=O)CO[Si](C)(C)C)[C@@H]1c1cccnc1	1802879262	HHSXBRODLKQMMF-QWFCFKBJSA-N	434.613	1.854	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H](CNC(=O)[C@@H]2CNC(=O)O2)[C@H]1c1cccnc1	1803647959	JDKBDAMBEVEONT-NPSOMJIGSA-N	429.304	1.432	50	20	IDGD	
Cc1nc(CC(=O)NC[C@H]2CCN(C(=O)CCBr)[C@@H]2c2cccnc2)no1	1804489353	LTNXKLOXWJXYOH-RDTXWAMCSA-N	436.310	1.807	50	20	IDGD	
Cc1nscc1C(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1805192986	MYAUIRVOZQJZRK-UZLBHIALSA-N	444.561	1.539	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)[C@H]1CC=CCC1	1808125555	QLIVTIMXWSBZGO-XJABCFGWSA-N	433.317	1.437	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)COc2ccc(O)nn2)[C@H]1c1cccnc1	1808277337	COKJRGBYZDBYII-DOXZYTNZSA-N	433.896	1.679	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2ccncc2F)[C@@H]1c1cccnc1	1808887104	UMMOXWPIUCJTNW-IERDGZPVSA-N	442.495	1.308	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2cnn3ccncc23)[C@H]1c1cccnc1	1809390159	WVHRTSHJNSMKFJ-HHXXYDBFSA-N	442.907	1.698	50	20	IDGD	
C[C@H](Cn1cncn1)C(=O)N1CC[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]1c1cccnc1	1810545908	HMFSBKPXYOSDMT-IMFGXOCKSA-N	444.612	1.867	50	20	IDGD	
CS(=O)(=O)N1CCC(C(=O)N2CCC3(CCCN(C(=O)[C@H](F)Cl)C3)CC2)CC1	1810906533	UOIGYMMEGBMCOI-HNNXBMFYSA-N	437.965	1.424	50	20	IDGD	
Cc1cccc(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)c1	1811863458	VWBWAAZERSRVIA-GGAORHGYSA-N	443.312	1.703	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)COc2cccnc2)[C@H]1c1cccnc1	1813028840	WUUDMKXPNVXAOR-KPFFTGBYSA-N	432.908	1.815	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H](CNC(=O)[C@H]2CCNC(=O)C2)[C@H]1c1cccnc1	1813135908	MTHGAUMNWJADFT-XEQBAVFLSA-N	441.359	1.850	50	20	IDGD	
Cc1ncccc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1	1816391856	FBIIBQWXIMQWGN-QGZVFWFLSA-N	427.509	1.792	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3cnc(O)nc3O)sc2C1	1817079119	LHPQLIJRQFPTAO-WCBMZHEXSA-N	425.898	1.978	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1CCc2nc(NC(=O)c3cnc(O)nc3O)sc2C1	1817083303	QDJQOKBNMZACKU-SECBINFHSA-N	437.554	1.422	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H]2CCC=CO2)n[nH]1	1819375547	WESSIAZYWUUOHY-IRXDYDNUSA-N	439.476	1.407	50	20	IDGD	
CCC1(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cnccc3C(=O)NN)n[nH]2)COC1	1819403736	CJQBVOCKPRTTHK-INIZCTEOSA-N	441.492	1.141	50	20	IDGD	
C[Si](C)(C)OCC(=O)Nc1cc([C@H]2CCCCN2C(=O)CCc2nc(N)n[nH]2)[nH]n1	1819595282	FXLUOUMUCOJYCA-CYBMUJFWSA-N	434.577	1.586	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ncccc2F)n[nH]1	1819975883	QDWAXUPNDWKPJC-HNNXBMFYSA-N	431.472	1.623	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](C)N2CCN(C)CC2)n[nH]1	1820792640	SLEWRZOYISJLBR-ZMSDIMECSA-N	440.976	1.292	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@H](O)CCl)CC2)c1cc(-n2ccnc2)ccn1	1821683924	ORKZTGSWXGQLKG-IAQYHMDHSA-N	446.920	1.549	50	20	IDGD	
C[C@@H](Cn1cccn1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1	1822410219	BZADUPVFBOCCHR-DOTOQJQBSA-N	444.540	1.308	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(C3CC3)on2)[nH]n1	1822412185	LYOMBWAEEDUDML-INIZCTEOSA-N	443.508	1.954	50	20	IDGD	
O=C1C[C@H](C(=O)Nc2cc([C@H]3CCCCN3C(=O)[C@H](F)Br)[nH]n2)CCN1	1822486277	VGGWEBYTHXJELP-UDZFHETQSA-N	430.278	1.619	50	20	IDGD	
Cc1cc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@@H](O)CCl)CC3)nc2nccn12	1824111358	RCTHSMNAHYKLEF-GWCFXTLKSA-N	434.909	1.320	50	20	IDGD	
O=C(Cn1cc([N+](=O)[O-])cn1)N1CCC([C@H]2CCCCN2C(=O)[C@@H](O)CCl)CC1	1824179417	RLITUYLCGMBACD-CVEARBPZSA-N	427.889	1.011	50	20	IDGD	
CCOC(=O)C(C)(C)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](Cl)COC)CC2	1828215411	VHFOGNPXGQAQFV-WDEREUQCSA-N	431.942	1.898	50	20	IDGD	
CC[C@H](C)[C@H](N)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1	1828925348	JWHLEAZSLJDQSU-YSSFQJQWSA-N	444.580	1.292	50	20	IDGD	
CCc1cc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)no1	1829380604	BUOQWFKTMAUTBE-LJQANCHMSA-N	433.553	1.843	50	20	IDGD	
COc1ccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)nn1	1829525888	CUSBLHCYPQIFQR-GOSISDBHSA-N	446.552	1.092	50	20	IDGD	
O=C(Cc1cccc([N+](=O)[O-])c1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1829622356	UGRSPKASNJMKKM-FUHWJXTLSA-N	429.832	1.128	50	20	IDGD	
O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CCC(F)(F)C1)CCO2	1829645632	DURAWQWQXLDPAD-XJKSGUPXSA-N	439.297	1.663	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(OC)c(F)c3)CCO2)C1	1830151118	JGPSGPSZZVPKTL-YWZLYKJASA-N	428.888	1.922	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(O)ccc3F)C2)C1	1830363657	HEHOVMFFANLYKY-FQEVSTJZSA-N	428.888	1.866	50	20	IDGD	
C=C(C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1)C(F)(F)F	1831451543	WZXDLKNDFDAFTQ-SFHVURJKSA-N	438.255	1.718	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H]2CNC(=O)O2)CC1	1831546066	CJWZXODFGJWKGC-KFWWJZLASA-N	430.343	1.888	50	20	IDGD	
C[C@@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1)c1ccccn1	1832328139	KXIOGUDENWHSMV-WZONZLPQSA-N	449.360	1.798	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3cncc(C)c3)CCO2)C1	1832962055	DNRUZYUMYUOJMU-WIYYLYMNSA-N	439.940	1.033	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)CCl)CC2)CC1	1833306680	WZNAMHUVZJSJNW-WFASDCNBSA-N	438.794	1.189	50	20	IDGD	
COc1cc(F)ccc1C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)CCl)CC2)CC1	1833312850	ICQGDEHKBAEDSE-GOSISDBHSA-N	441.931	1.619	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)[C@@H]3CCCCN3C)CC2)CC1	1833323568	RLLVBDIIIQFMOZ-YJBOKZPZSA-N	443.430	1.826	50	20	IDGD	
Cc1ncsc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1	1834267865	KKVKRXJZZNUYOB-DLBZAZTESA-N	436.361	1.758	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)c3nccn3C)CC2)CC1	1834268975	PYDAZLDSCIIVMZ-AWEZNQCLSA-N	440.386	1.636	50	20	IDGD	
CC[C@@H](NC)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)CBr)CC2)CC1	1834790412	FQUQIJUVUHWIQH-WMLDXEAASA-N	431.419	1.587	50	20	IDGD	
O=C(CCCC(F)(F)F)N1CCOC[C@@]2(C1)CN(C(=O)CCBr)CCO2	1834819405	NYRBCUPVXRWUNA-OAHLLOKOSA-N	445.276	1.960	50	20	IDGD	
N#Cc1ccc(F)c(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)c1	1836464145	BHEPAQNVZZAROW-IBGZPJMESA-N	436.915	1.482	50	20	IDGD	
O=C(C(Cl)Cl)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1Cc3ccccc3O1)CCO2	1836654024	LXXYNTWEIPSGOE-BEFAXECRSA-N	429.300	1.250	50	20	IDGD	
O=C(Cn1ccnc1)N1CCC(OC2CCN(C(=O)[C@H](F)Br)CC2)CC1	1837534494	YJRKBXRODGTLIG-INIZCTEOSA-N	431.306	1.572	50	20	IDGD	
Cc1nc(C)c(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)o1	1838007435	BLZIFXVJLCSJBQ-GTNSWQLSSA-N	430.299	1.145	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ncccc3F)CCO2)C1	1838252642	ZWGUWXFCSDZSEQ-SJCJKPOMSA-N	430.274	1.074	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cncc4cnccc34)CCO2)C1	1838460752	LYYUJHPDUWMVGJ-JOCHJYFZSA-N	446.935	1.965	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)[C@H](C)n3cncn3)CC2)CC1	1838773546	NQUIDVCNXJRLAM-KBPBESRZSA-N	442.358	1.621	50	20	IDGD	
COc1ccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)c(C#N)c1	1839132951	URYYWWNKFJBZNM-QUCCMNQESA-N	439.871	1.100	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)C3(O)CCC3)C2)C1	1839961769	ICDALWUSBIEILW-RVKKMQEKSA-N	447.370	1.167	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cccnc3)C2)C1	1839964131	HOZYFCQBNAFWDI-QFBILLFUSA-N	440.338	1.254	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3=COCCC3)C2)C1	1839966494	HFHPOLKINCUPCP-MAUKXSAKSA-N	431.327	1.311	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)C3CC(F)(F)C3)C2)C1	1840030856	YSKNLLLFYRMARG-XHDPSFHLSA-N	425.270	1.272	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(C)c(F)c3F)C2)C1	1840156868	WWZXISPRVDYFRH-QRWLVFNGSA-N	446.878	1.597	50	20	IDGD	
COc1ccc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)cc1C	1840186636	MDFFXKBNESQUGS-FQEVSTJZSA-N	445.343	1.806	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)Oc1ccccn1)CCO2	1840426991	RBGCGHUWRCYDSN-GQIGUUNPSA-N	425.913	1.323	50	20	IDGD	
CC(C)(C)OC(=O)NCC[C@H](O)C(=O)N1CC2(CCCN2C(=O)C(C)(C)CCl)C1	1841226975	PQVXLVLVOQIQEA-AWEZNQCLSA-N	431.961	1.731	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2	1841669771	UYVDBNSMXBGWPW-SFHVURJKSA-N	449.983	1.944	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)C2Cc3ccccc3C2)C1	1847129578	SJKDIJFPPVIQER-WGOQTCKBSA-N	433.512	1.739	50	20	IDGD	
CS(=O)(=O)Nc1ccc(C(=O)NNC(=O)COc2ccc(Br)cc2)cc1	11593501	QSESRHWIEQYLBK-UHFFFAOYSA-N	442.291	1.661	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)COc3ccc(F)cc3)CC2)cc1	16069152	XBFJUXBJPSTNPM-UHFFFAOYSA-N	449.504	1.761	50	20	IDGD	
O=C(CCNS(=O)(=O)/C=C/c1ccccc1)NNC(=O)c1cc(Br)c[nH]1	24124397	IPKQPDISYOBNMM-VQHVLOKHSA-N	441.307	1.519	50	20	IDGD	
CCC1(CC)NC(=O)N(CC(=O)NNC(=O)c2cc(C)n(-c3ccccc3)c2C)C1=O	115100092	DYYYQUHALVFVCP-UHFFFAOYSA-N	425.489	1.966	50	20	IDGD	
CCOC(=O)[C@@H]1CCCN(C(=O)CN(C)C(=O)/C(C#N)=C\c2cc(C#N)n(C)c2C)C1	726174549	BTYOXPQZAPJWKB-BZMUBCNJSA-N	425.489	1.372	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)COc2ccc(C=O)cc2)c1	727364788	VBKLVSCLDFKEQM-UHFFFAOYSA-N	433.486	1.370	50	20	IDGD	
CNS(=O)(=O)c1cccc([C@H](C)NC(=O)NNC(=O)COc2ccccc2OC)c1	727609381	KHHSBJNOGFKXHW-ZDUSSCGKSA-N	436.490	1.074	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@H](c2ccccc2)N2CCN(C)CC2)cc(OC)c1OC	727753171	UEKYAECSLHVOGT-FQEVSTJZSA-N	442.516	1.462	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)NCCCN2CCC[C@@H]2C(=O)N(C)C)c1C	728072883	LCSGISNGKJHYGI-LSSXRZCCSA-N	429.565	1.717	50	20	IDGD	
Cc1sc2ncn(CC(=O)NNc3ccc(S(=O)(=O)NC4CC4)cc3)c(=O)c2c1C	728209451	BKRPMDBVHBDFGK-UHFFFAOYSA-N	447.542	1.659	50	20	IDGD	
COc1ccc(C(=O)CCC(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1	728339119	JGKVZVOGZBNUOD-IBGZPJMESA-N	442.424	1.189	50	20	IDGD	
O=C(COC(=O)c1oc2ccccc2c1CO)NNC(=O)[C@H]1COc2ccccc2O1	728344995	VLTCIDKDVKDFJW-QGZVFWFLSA-N	426.381	1.069	50	20	IDGD	
O=C(CCN1C(=O)[C@H]2CCCC[C@@H]2C1=O)NNC(=O)c1cc(F)ccc1Br	728549276	BPZFQKBYMVXEBA-RYUDHWBXSA-N	440.269	1.915	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)C1CCN(S(=O)(=O)c2ccc3c(c2)CCC3)CC1	728852185	RDRXDJPLZPWBPL-UHFFFAOYSA-N	442.541	1.361	50	20	IDGD	
C[C@H]1C[C@H](C)CN(C(C)(C)CNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)C1	728949875	WMSRWXFSRNLXFO-IRXDYDNUSA-N	431.585	1.780	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NN=Cc1ccc(OCC(=O)O)c([N+](=O)[O-])c1	731557626	UJBCOWZGSZNTIC-UHFFFAOYSA-N	449.445	1.424	50	20	IDGD	
CN(CCO)S(=O)(=O)c1ccccc1CNC(=O)NNc1ccc(OC(F)F)cc1	733041129	QNEMASXOUQLTGV-UHFFFAOYSA-N	444.460	1.727	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1CNC(=O)NNC(=O)c1cnn(-c2ccccc2)c1	733338636	GHRIZAVTMKJZON-UHFFFAOYSA-N	442.501	1.267	50	20	IDGD	
CCCCN(C)S(=O)(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	733876537	XOZVEWHOTCDTEC-UHFFFAOYSA-N	446.576	1.760	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)Cn1cc(Br)cn1	734252442	UFTGFKQMJOCGMT-UHFFFAOYSA-N	430.328	1.866	50	20	IDGD	
O=C(COC(=O)[C@H]1CCCCN1Cc1ccccc1)NNC(=O)c1cccc([N+](=O)[O-])c1	741354680	SPKSCBLYGMGYEE-LJQANCHMSA-N	440.456	1.954	50	20	IDGD	
CN1CCN(C)[C@@H](CNC(=O)NNC(=O)Nc2ccc(Br)cc2Cl)C1	743606293	XNJWUQKXEADZKN-NSHDSACASA-N	433.738	1.684	50	20	IDGD	
Cn1ccnc1[C@H](NC(=O)NNC(=O)c1cc([N+](=O)[O-])ccc1O)c1cccc(F)c1	745397080	XMFMZXQVTHCOQA-MRXNPFEDSA-N	428.380	1.907	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)c1cc(S(=O)(=O)N2CCCC2)ccc1O	745996175	OZPSYWPPSWEREV-UHFFFAOYSA-N	439.515	1.337	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2ccnc(C(=O)NNC(=O)c3cc(C)oc3C)c2)c(C)o1	746093442	RFTKGXUKKKJDTQ-UHFFFAOYSA-N	439.428	1.651	50	20	IDGD	
COc1ccc([C@H](C)NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1	746961627	ARZUZBONROXUME-HNNXBMFYSA-N	434.518	1.716	50	20	IDGD	
CCOC(=O)c1cc(S(=O)(=O)NNC(=O)c2ccc(Cl)nc2)cc([N+](=O)[O-])c1C	747607041	ZSJUQWSPXHZKOD-UHFFFAOYSA-N	442.837	1.752	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)c2ccc(S(N)(=O)=O)c(Br)c2)c1	748049080	PUEHNVHUTCAWIK-UHFFFAOYSA-N	441.307	1.237	50	20	IDGD	
CC(=O)NCc1ccc(S(=O)(=O)NCC(=O)NNc2ccc(Cl)c(F)c2)s1	748874686	DLBNRRDPPOJDBO-UHFFFAOYSA-N	434.902	1.598	50	20	IDGD	
Cn1c(N)c(C=NNC(=O)Nc2ccc(Br)cc2Cl)c(=O)n(C)c1=O	749813685	AESWKTJUYMJXLQ-UHFFFAOYSA-N	429.662	1.238	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)c1cnn2c1C[C@@H](CNC(C)=O)CC2	753259136	QAMYEECWWAPHMS-AWEZNQCLSA-N	431.518	1.144	50	20	IDGD	
C[C@@H]1CC/C(=C\C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)C1	753573663	QOZXZFXAQMZYTR-YWJBVVMDSA-N	435.546	1.534	50	20	IDGD	
C[C@]1(c2ccc(C(=O)OCC(=O)NNC(=O)c3ccc(Cl)cc3)cc2)NC(=O)NC1=O	754527922	RIWFSVQIJOVGIV-HXUWFJFHSA-N	444.831	1.013	50	20	IDGD	
CCc1nnc(O)c(CNC(=O)NNC(=O)c2nn(CC)c(=O)c3ccccc23)c1CC	754653911	LMAHBRRGFNAOAB-UHFFFAOYSA-N	439.476	1.181	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2csc([C@H]3CCCO3)n2)cc1	755397158	FWBDWSGBJXZWQK-OAHLLOKOSA-N	438.531	1.385	50	20	IDGD	
Cc1nn(C)cc1C=NNC(=O)c1cc(S(=O)(=O)NCc2ccccc2)ccc1O	755609341	UZMAYKBNSBPRJX-UHFFFAOYSA-N	427.486	1.677	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)ccc1-n1cnnn1	755679938	PAXOVIGQYSJISV-UHFFFAOYSA-N	449.519	1.336	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)Nc1ccc(N2C[C@@H](C)O[C@H](C)C2)nc1	755864360	HYSSQKBYZPWGOS-HUUCEWRRSA-N	429.477	1.936	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(F)c(NC(=O)NNC(=O)Cc2c[nH]c3ccccc23)c1	756682000	FGTIMVAOWSNGCS-UHFFFAOYSA-N	433.465	1.953	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)Cc1cccc(I)c1	760493882	SUSQPKHADAHHJR-UHFFFAOYSA-N	443.266	1.473	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)CSCC(F)(F)F)cc2)CC1	762003735	QPYINEIIZRSJDH-UHFFFAOYSA-N	426.486	1.361	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)cc1NC(C)=O	763438559	BTQFVPIGCPGHOZ-UHFFFAOYSA-N	444.510	1.268	50	20	IDGD	
Cc1ccc(Cn2nccc2NC(=O)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)s1	763471024	QMJDNVKPGCVTHB-UHFFFAOYSA-N	428.430	1.609	50	20	IDGD	
CNS(=O)(=O)c1ccc([C@H](C)NC(=O)NNC(=O)CSc2ccccc2O)cc1	763476710	AYGPWWOFHLRMTL-LBPRGKRZSA-N	438.531	1.484	50	20	IDGD	
Cc1ccc(C(=O)N2CCSCC2)cc1NC(=O)C(=O)NNC(=O)c1ccccc1F	763562328	UFFMNNHEUPTXBV-UHFFFAOYSA-N	444.488	1.723	50	20	IDGD	
CC(C)(C)NC(=O)c1cccc(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1	763571260	KXZKMFQPDVBPFW-KRWDZBQOSA-N	440.456	1.141	50	20	IDGD	
COC(=O)c1cccc(NC(=O)C(=O)NNC(=O)COc2ccc(C(C)(C)C)cc2)c1	763601235	WEVSHEZDTUJUCG-UHFFFAOYSA-N	427.457	1.936	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(CCN3CCCC3)c2)cc1	763660629	DLQPWIMOMOIJIY-UHFFFAOYSA-N	440.500	1.498	50	20	IDGD	
CON(C)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C)c(C)c2)cc1	763680072	OQIONJOFHOXLMJ-UHFFFAOYSA-N	428.445	1.102	50	20	IDGD	
CC(=O)N1CCc2cc(NC(=O)C(=O)NNC(=O)COc3ccc(Cl)cc3)ccc21	763686885	WQFGWRKSONARSO-UHFFFAOYSA-N	430.848	1.414	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(Cl)c(C(=O)NC3CC3)c2)c1	763752995	CKGKTNIVYDBTJG-UHFFFAOYSA-N	443.891	1.698	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2cccc(C#Cc3ccccn3)c2)c1	763773585	ZCRYJLSDLWDEBD-UHFFFAOYSA-N	444.447	1.898	50	20	IDGD	
Cc1cc(F)ccc1NC(=O)C(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12	763789859	DHBDVQBMCRAQHK-UHFFFAOYSA-N	425.420	1.825	50	20	IDGD	
COc1ccc2cc(NC(=O)C(=O)NNC(=O)c3nnc(O)c4ccccc34)ccc2n1	763790378	ICKPXVUFWPPAKD-UHFFFAOYSA-N	432.396	1.292	50	20	IDGD	
C[C@@H](c1ccccc1)n1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)n1	763807530	DCNNSBGGHDGODN-HNNXBMFYSA-N	432.440	1.529	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccccc2CS(C)(=O)=O)c1C	763838588	ALOWPFZZTSWXLI-OAHLLOKOSA-N	447.513	1.401	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)C(=O)Nc1ccc(-n2cncn2)nc1	763850956	CGAOOWIEUYDAIS-AWEZNQCLSA-N	445.439	1.369	50	20	IDGD	
COCCn1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc3ccccc3c2)n1	763852278	HASFZABFXFBXEY-CQSZACIVSA-N	425.445	1.236	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cccc(N(C)C(C)=O)c2)cc1	763859725	FLYNWOINLCTQOW-CQSZACIVSA-N	442.472	1.621	50	20	IDGD	
CCN(CC)C(=O)c1ccccc1NC(=O)C(=O)NNC(=O)Cc1c[nH]c2ccccc12	763861578	SQYBHPBCKCXWTP-UHFFFAOYSA-N	435.484	1.979	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cnn(-c3ccccn3)c2)cc1OC	763910282	BHRODZWQCJIZBY-UHFFFAOYSA-N	438.444	1.464	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)C(=O)Nc1cccc(Cl)c1N1CCOCC1	763919479	UHWHZWGILVAKNV-UHFFFAOYSA-N	434.855	1.644	50	20	IDGD	
CC(=O)N(C)c1ccccc1NC(=O)C(=O)NNC(=O)c1ccc(Br)s1	763940961	NGMMNDXSHLRMQA-UHFFFAOYSA-N	439.291	1.893	50	20	IDGD	
CC[C@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(S(=O)(=O)N(C)C2CCCCC2)cc1	764083976	LEBJVSZIBLSKGO-AWEZNQCLSA-N	438.550	1.772	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2cc(C(=O)NC3CC3)ccc2C)c1O	764132644	OTMIWHBWCVXWMI-UHFFFAOYSA-N	426.429	1.001	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(C(=O)N3CCSCC3)c2)cc1	764177561	QVWAVXFIRGNEFV-UHFFFAOYSA-N	437.481	1.147	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)C(=O)Nc1ccccc1N1CCOC1=O	764203086	JLQSXXTXLZWIAU-UHFFFAOYSA-N	449.464	1.034	50	20	IDGD	
Cc1nn(C)c2ncc(NC(=O)C(=O)NNC(=O)c3cc(Br)ccc3O)cc12	764278549	SVRBCQBFZATGSZ-UHFFFAOYSA-N	447.249	1.145	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)c(Cl)c1)C(=O)Nc1ccc(S(=O)(=O)C(F)F)cc1	764349376	LTJUZYJWAUOHHJ-UHFFFAOYSA-N	447.803	1.442	50	20	IDGD	
O=C(NCc1ccc(N2CCCS2(=O)=O)cc1)NNC(=O)c1cccc([N+](=O)[O-])c1	764777521	KCLAOFMVUMWFEK-UHFFFAOYSA-N	433.446	1.279	50	20	IDGD	
COc1cc2c(cc1C=NNC(=O)CN1CCN(C(=O)c3ccccc3)CC1)O[C@H](C)C2	764829371	WAYZKJCSAZNRLV-QGZVFWFLSA-N	436.512	1.927	50	20	IDGD	
O=C(c1ccc(OCC(F)(F)F)cn1)N1CCN(S(=O)(=O)CBr)CC1	765478751	FMNHHIKNWZYSHE-UHFFFAOYSA-N	446.245	1.463	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)cc1	765755239	QBOHINLQNRYTGX-UHFFFAOYSA-N	441.919	1.556	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)CO[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)c1	767853209	NZCLFNSMQJFDAX-QGZVFWFLSA-N	436.509	1.671	50	20	IDGD	
CCCCCn1nc(C(=O)NNS(=O)(=O)c2cn(CC)c(C)n2)c2ccccc2c1=O	768035744	HUMUVMIYMLGZHT-UHFFFAOYSA-N	446.533	1.735	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)[C@@H](F)c3ccccc3)CC2)cc1	769003837	LUOXGSVTKPFPFT-FQEVSTJZSA-N	448.520	1.160	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)c2ccc(-c3nc[nH]n3)cc2)cc1	770208064	GDDMZYVMULVCLU-UHFFFAOYSA-N	434.485	1.967	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)NCc3ccccc3N3CCOCC3)nc21	770367157	VQBWZIDTRXXOKQ-UHFFFAOYSA-N	440.508	1.950	50	20	IDGD	
COc1cc(C(=O)NCC(=O)NNc2ccnc(Br)c2)cc(OC)c1OC	771534793	KQVHCRQLVUWSTP-UHFFFAOYSA-N	439.266	1.743	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1cccc(S(=O)(=O)N2CCc3ccccc32)c1	771886219	BNFZSRSWUXVHTJ-AWEZNQCLSA-N	445.497	1.541	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(F)(F)F)cn2)o1	773540341	LPEWIZQBCSUBMQ-UHFFFAOYSA-N	427.383	1.935	50	20	IDGD	
O=C([C@H](O)Cc1ccccc1Cl)N1CCN(S(=O)(=O)CBr)CC1	773613476	RLZXKTODEQAXBY-CYBMUJFWSA-N	425.732	1.070	50	20	IDGD	
O=C(NNc1ccc(-n2cccn2)nn1)C(=O)Nc1cccc(-c2ncc3n2CCCC3)c1	773646772	YVYRRPQRVBGKNL-UHFFFAOYSA-N	443.471	1.944	50	20	IDGD	
CN1CCN(C(=O)Cc2ccc(NC(=O)C(=O)NNc3c(F)cccc3F)cc2)CC1	773707415	HAYANHGLDZIDRD-UHFFFAOYSA-N	431.443	1.363	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNc2cnc3ccccc3n2)c(OC)c(OC)c1	773718069	IYKVHPUDWAQRCI-UHFFFAOYSA-N	425.401	1.515	50	20	IDGD	
CS(=O)(=O)c1cccc(Oc2ccc(NC(=O)C(=O)NNc3ncccn3)cc2)c1	773720873	IXENOBDJXKCULF-UHFFFAOYSA-N	427.442	1.754	50	20	IDGD	
COC(=O)c1ccsc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1cccc(Cl)c1	774007988	DHHKSPGQROZVKV-SECBINFHSA-N	425.850	1.742	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN[C@@H]2CCN(Cc3ccccc3)C[C@@H]2C)cc1OC	775689890	NBWGZQAJDRRAOB-FXAWDEMLSA-N	440.544	1.965	50	20	IDGD	
CN1CCc2cc(C(=O)NNC(=O)c3cccc(S(=O)(=O)N4CCCCC4)c3)ccc21	778282641	JFPUFLOGXUSNTP-UHFFFAOYSA-N	442.541	1.928	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)c2cc(S(=O)(=O)N(CC)CC)cn2C)nc1C	778426615	PMJMKMUJNXARRJ-UHFFFAOYSA-N	438.510	1.088	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)[C@@H](O)[C@@H](O)c1nc2ccccc2s1	779511853	SVSLOLQKWBRELA-DLBZAZTESA-N	448.526	1.275	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)N[C@@H]1CCCN(c2ccc(C#N)cc2)C1=O	779963624	BFSWQWYKEOULNF-QGZVFWFLSA-N	437.456	1.472	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)CCC(=O)N1CCC(c2ccccc2)=N1	780974072	NMIXXCCGTKAOQI-UHFFFAOYSA-N	431.493	1.465	50	20	IDGD	
CCC1(C(=O)NNC(=O)CNC(=O)c2cccs2)CCN(C(=O)c2ccccc2)CC1	781154550	QWFIZNKZMRWBJI-UHFFFAOYSA-N	442.541	1.958	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)c2ccc(OC)c(-n3cnnn3)c2)cc1OC	781586444	LXEMOWHSQDTDEK-UHFFFAOYSA-N	440.460	1.933	50	20	IDGD	
CC(C)(C)n1nc(-c2ccccc2)cc1NC(=O)C(=O)NN[C@]1(C)CCS(=O)(=O)C1	783427894	SYMBZNYNXQEJGB-HXUWFJFHSA-N	433.534	1.442	50	20	IDGD	
Cc1ccc(-c2ccncc2)cc1NC(=O)C(=O)NNC(=O)CNC(=O)c1cccs1	784004816	KOPVEZFJYSNVSV-UHFFFAOYSA-N	437.481	1.634	50	20	IDGD	
Cc1ccc(F)c(NNC(=O)C(=O)Nc2cnn(CC(=O)N3C[C@H](C)O[C@H](C)C3)c2)c1	784885366	SIFCYKBRDVNFPA-OKILXGFUSA-N	432.456	1.048	50	20	IDGD	
O=C(NNc1ccc(C(F)(F)F)nn1)C(=O)Nc1cc(N2CCNC2=O)ccc1Cl	784891232	JYBFHIKBGRTFRF-UHFFFAOYSA-N	443.773	1.760	50	20	IDGD	
COCCS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2cccc(C(F)(F)F)n2)cc1	784951654	QYUWWKJZNDWVJJ-UHFFFAOYSA-N	446.407	1.602	50	20	IDGD	
Cc1ccc(Br)nc1C(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	786387930	BBDUHWQGHWYPGC-UHFFFAOYSA-N	437.206	1.679	50	20	IDGD	
CC[C@@H](Oc1ccccc1F)C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	786535414	QUICPIQXENCJHD-KDOFPFPSSA-N	432.404	1.514	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2cc(N3CCNC3=O)ccc2C)cc1	787543548	YHXAKHFMLJCOSU-UHFFFAOYSA-N	439.472	1.252	50	20	IDGD	
O=C(COC(=O)COc1cccc(C(F)(F)F)c1)NNC(=O)c1ccc([N+](=O)[O-])cc1	787978870	SOZYRSFDOYDMMP-UHFFFAOYSA-N	441.318	1.997	50	20	IDGD	
Cc1nc2cc(C(=O)NNC(=O)N[C@H]3CCS(=O)(=O)C3)ccc2n1Cc1ccsc1	788500896	CWYXVUQCEDIZGG-HNNXBMFYSA-N	447.542	1.586	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCCC(=O)NNc2nnc(-c3ccccn3)s2)cc1	788560975	ULQLXIBKFCNTOA-UHFFFAOYSA-N	448.530	1.811	50	20	IDGD	
CC(C)(C)OC(=O)N1CC2(C[C@@H]2C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)C1	789284812	JGXDTRFGQCWZMM-OAHLLOKOSA-N	428.445	1.119	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)NCCc2ccc(S(N)(=O)=O)cc2)c1C	789960559	BJWVBBYUSLVPEQ-UYRXBGFRSA-N	430.530	1.665	50	20	IDGD	
O=C(NNc1nc2ccccn2n1)C(=O)Nc1cccc(N2C(=O)c3ccccc3C2=O)c1	792395931	WBUILGCHNQBOOU-UHFFFAOYSA-N	441.407	1.612	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)c2nc(C)n(-c3n[nH]c(C(F)(F)F)n3)n2)cc1	792799441	ZDLSLRVOSXZVMK-UHFFFAOYSA-N	438.370	1.115	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNC(=O)NNC(=O)c1cc2ccccc2o1	792975194	UBBLLHSLBSPSTE-UHFFFAOYSA-N	425.401	1.334	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C(=O)Nc1cc(Cl)cc(C(N)=O)c1OC)c1ccccc1	793026104	PSOZEEDWAAUUBK-ZDUSSCGKSA-N	432.864	1.727	50	20	IDGD	
COC(=O)Nc1ccc(S(=O)(=O)NNC(=O)CNC(=O)OCc2ccccc2)cc1	794599045	TYUJJMCCWGYURN-UHFFFAOYSA-N	436.446	1.101	50	20	IDGD	
COC(=O)[C@@]1(c2ccccc2)CCN(CC(=O)NNC(=O)c2ccc(OC)c(OC)c2)C1	794809812	YTZWHHYROUZOGG-QHCPKHFHSA-N	441.484	1.282	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NN=C1CSC[C@H]1C)N(S(C)(=O)=O)CC2	794881590	LNFCNJNUXYTQOO-WBMJQRKESA-N	441.575	1.808	50	20	IDGD	
Cc1nc([C@@H]2CCCOC2)sc1C(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	796234930	STOJFPSGYXVKMQ-CYBMUJFWSA-N	448.457	1.872	50	20	IDGD	
COC(=O)c1cc(F)cc(NC(=O)C(=O)NNC(=O)COc2ccc(C)c(C)c2)c1F	796992743	XAIYAPCMHLGSJR-UHFFFAOYSA-N	435.383	1.533	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)Nc1cc(S(=O)(=O)N2CCCC2)ccn1	797674065	PHQYEMNTDDWSBN-UHFFFAOYSA-N	437.453	1.237	50	20	IDGD	
COC(=O)c1ccc(NC(=O)NNC(=O)[C@@H](C)Oc2cccc(Br)c2)nn1	799232009	YAOGGROKDKVORD-SECBINFHSA-N	438.238	1.646	50	20	IDGD	
N#Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2O)ccc1OC(F)(F)F	799835318	OZOBVADLXJPUII-UHFFFAOYSA-N	438.318	1.327	50	20	IDGD	
NS(=O)(=O)Cc1ccc(C(=O)NNc2cc([N+](=O)[O-])ccc2Br)cc1	800616366	LIPJYSBDBIRHTB-UHFFFAOYSA-N	429.252	1.903	50	20	IDGD	
O=C(N=c1cc[nH]cc1)NNC(=O)C1CCN(S(=O)(=O)c2ccc(F)c(F)c2)CC1	802030425	DONCRKXNCNHFCR-UHFFFAOYSA-N	439.444	1.035	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)N[C@@H](C)CCNS(=O)(=O)c2ccccc2)cc1	802528127	QJPAKMSMIODALM-INIZCTEOSA-N	434.518	1.461	50	20	IDGD	
COC(=O)c1c(F)cc(NC(=O)C(=O)NNC(=O)Cc2ccc(Cl)cc2)cc1F	802566269	GYQWIAMKTMWFGE-UHFFFAOYSA-N	425.775	1.733	50	20	IDGD	
CS(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)C2CCCC2)c(Br)c1	802722068	PCDKKBZMGXAGSJ-UHFFFAOYSA-N	425.326	1.352	50	20	IDGD	
Cc1onc(-c2cccnc2)c1C(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	803824004	JSYCSWYTFRLSSV-UHFFFAOYSA-N	425.357	1.571	50	20	IDGD	
COc1ccc2cc(NC(=O)C(=O)NNC(=O)COc3ccccc3[N+](=O)[O-])ccc2c1	806974253	BOFBZELJJVXDMT-UHFFFAOYSA-N	438.396	1.922	50	20	IDGD	
O=C(NC[C@H]1CCCS(=O)(=O)C1)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1	807581291	UMAUGQQMGSQMJT-SNVBAGLBSA-N	429.442	1.431	50	20	IDGD	
COC(=O)Cc1occ(C)c1C(=O)NNC(=O)COc1ccc(Br)cc1	809940839	NVRPRWWTDAUYCB-UHFFFAOYSA-N	425.235	1.906	50	20	IDGD	
CC(C)Nc1ccc(S(=O)(=O)NCC(=O)NNc2cccnc2Cl)cc1[N+](=O)[O-]	810494216	OSDDHABZIFMKEY-UHFFFAOYSA-N	442.885	1.885	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)N1CCC[C@@H](CNC(=O)C(F)(F)F)C1	811850598	AHUPLBDRALUXKT-LBPRGKRZSA-N	426.399	1.388	50	20	IDGD	
C[C@@]1(NNC(=O)NCc2cccc(-c3nc(CC(F)(F)F)no3)c2)CCS(=O)(=O)C1	812478854	BGXRSRKDAHGPNS-MRXNPFEDSA-N	447.439	1.722	50	20	IDGD	
COC(=O)c1cc(Br)cc(C(=O)NNC(=O)CNC(=O)OC(C)(C)C)c1	812545655	XQEMKFVSLUCZOZ-UHFFFAOYSA-N	430.255	1.521	50	20	IDGD	
O=C(NC[C@H]1CCN(c2ccccc2F)C1)NNC(=O)C1CCN(c2ncccn2)CC1	812883080	OTMZNIVBQLFQOU-MRXNPFEDSA-N	441.511	1.689	50	20	IDGD	
Cc1cnc(Br)c(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)c1	812978946	FZRLPXASJQHBTK-UHFFFAOYSA-N	425.214	1.457	50	20	IDGD	
COC(=O)c1cn(-c2cccc(NC(=O)C(=O)NNC(=O)c3cc4ccccc4o3)c2)nn1	812980773	ZGXFOEHUWZFJGJ-UHFFFAOYSA-N	448.395	1.200	50	20	IDGD	
CNS(=O)(=O)c1cc(NC(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)ccc1F	812983821	IPFBLRQCUDNPHV-UHFFFAOYSA-N	445.498	1.133	50	20	IDGD	
COc1cc(SC)ccc1NC(=O)C(=O)NNc1ccccc1S(=O)(=O)N(C)C	815752002	XXPVQOQTNFGFIE-UHFFFAOYSA-N	438.531	1.749	50	20	IDGD	
CN(C)NC(=O)Nc1cccc(NC(=O)c2cccc(CN3CCS(=O)(=O)CC3)c2)c1	816403662	HFZQHOKBHLYZMH-UHFFFAOYSA-N	445.545	1.767	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)[C@@H](CC(F)F)NC(=O)OC(C)(C)C	817053418	QLCQILJPDZNGOW-GFCCVEGCSA-N	436.481	1.929	50	20	IDGD	
Cc1ccc(C(=O)NCCC(=O)NNC(=O)[C@H]2CCCN(C(=O)OC(C)(C)C)C2)c(O)c1	819657672	FVKNIWXFYWUKKV-HNNXBMFYSA-N	448.520	1.615	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)cc(C#N)n1C	823933467	UBEYTPUBXNMDFV-SXGWCWSVSA-N	443.467	1.864	50	20	IDGD	
O=C1Nc2cc(OC(F)(F)F)ccc2C1=NNC(=O)c1csc(N2CCOCC2)n1	915049284	MLICHCLWNZUIHZ-UHFFFAOYSA-N	441.391	1.965	50	20	IDGD	
COCCS(=O)(=O)CC(=O)NNC(=O)c1cn(-c2ccccc2)nc1-c1ccccc1	915634888	RBWWSHWJKXIDEY-UHFFFAOYSA-N	442.497	1.362	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)c2cccc(S(=O)(=O)NC[C@H]3CCCO3)c2)cc1	915774470	SYRAAPNPRBLMCO-GOSISDBHSA-N	447.513	1.292	50	20	IDGD	
N#Cc1cccc(COc2cccc(C=NNC(=O)CSc3nnc(O)nc3O)c2)c1	915957815	WSTDURNXBVOCRL-UHFFFAOYSA-N	436.453	1.976	50	20	IDGD	
C[C@@H]1CN(CCCNC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)C[C@@H](C)O1	916249888	QJLQKNNAKYTTLW-WOJBJXKFSA-N	446.596	1.028	50	20	IDGD	
CCN(CC)[C@H](CNC(=O)NNC(=O)c1sc(N2CCOCC2)nc1C)CC(C)C	916258587	GMQPHONHGOFELA-INIZCTEOSA-N	440.614	1.989	50	20	IDGD	
CCOCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccc(OC)cc2)c1	916374516	ITZDZTURNANECP-UHFFFAOYSA-N	436.490	1.477	50	20	IDGD	
CN1CCN(Cc2ccc(CNC(=O)NNC(=O)COc3ccccc3C#N)cc2)CC1	916388167	XGOUXRXLUSZRGQ-UHFFFAOYSA-N	436.516	1.215	50	20	IDGD	
CC(C)NS(=O)(=O)c1cccc(CNC(=O)NNC(=O)c2ccc3c(c2)OCCO3)c1	916486457	SZDNWLKLIQVYDT-UHFFFAOYSA-N	448.501	1.289	50	20	IDGD	
COc1cccc(CO[C@H](C)C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)c1	918204136	SSKBUQFMOKKWEI-LLVKDONJSA-N	441.893	1.362	50	20	IDGD	
CNS(=O)(=O)c1ccc([C@@H](C)NC(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)cc1	919779125	NSWQMEUXRNKCRM-CHWSQXEVSA-N	438.481	1.593	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)NC[C@H]2CCCOC2)cc1	920855266	ZWDTUAWRSFQARL-CJMVGXJBSA-N	437.500	1.884	50	20	IDGD	
Cc1nc2c(C(N)=O)cnn2c(C)c1CCC(=O)NNc1cncc(Br)c1	1319543739	CZFCLRKMNRXRLC-UHFFFAOYSA-N	432.282	1.678	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H]2CCCC[C@@H]2N(C)C)c1	1322740631	OBSHKAPNEIXPRP-MSOLQXFVSA-N	439.582	1.534	50	20	IDGD	
COc1ccc(C(=O)NNC(=S)NC(C)C)cc1S(=O)(=O)Cc1cc(C)no1	1337757026	JLSNCCQHJBRTED-UHFFFAOYSA-N	426.520	1.483	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3n[nH]c4c3CC[C@@H]4C)C2)C1	1777854018	HIJVTQBUISEGIY-OAVHHTNSSA-N	425.327	1.686	50	20	IDGD	
CCOC(=O)c1cc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](F)Cl)C2)ccn1	1778025520	RMAKHYFIBWNPQN-GQIGUUNPSA-N	441.887	1.920	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cn(C)nc2C(F)F)C1	1778361565	ZIOGLSLUZLCUCO-IQUTYRLHSA-N	448.898	1.739	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3nnc(-c4ccccc4)o3)C2)C1	1779113682	AQBLJDUITKBLAA-ORAYPTAESA-N	449.305	1.964	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)N2C[C@H]3C[C@@H]3C2)C1	1779264715	OTXOGQWGPGBKEE-ATVBHHLPSA-N	427.973	1.094	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@]2(C1)CN(C(=O)CS[C@@H]1CCCCO1)CCO2	1779296831	HKGKOMZXTBUYAH-RTBURBONSA-N	430.643	1.928	50	20	IDGD	
CC[C@@H](NC(N)=O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@](C)(Cl)CCl)C1	1780711617	KAKTWHXQLZNZLP-XHSVMWQWSA-N	437.368	1.184	50	20	IDGD	
Cc1nc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)c(=O)[nH]c1C	1781225433	WVAOJDLUJNJZLS-ROUUACIJSA-N	431.320	1.067	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2)c1ccnc2ncccc12	1781295973	IICMHJDDLPPGSJ-CBGDNZLLSA-N	432.908	1.357	50	20	IDGD	
O=C(c1ccn(C(F)F)n1)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781330961	BIKMGJAGWUPIOA-YGRLFVJLSA-N	425.205	1.412	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H]2CCCS2(=O)=O)C1	1781650002	KZYVWZXTHKVCPL-QMTMVMCOSA-N	434.986	1.343	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)N1CC[C@@]2(CN(C(=O)[C@H](Br)CC)CCO2)C1	1782711396	FUBICEAVBIUYJO-XNJGSVPQSA-N	435.315	1.551	50	20	IDGD	
C=C(CC(=O)OCC)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](Br)CC)C2)C1	1783353266	NZCADPALZQGFPJ-KBXCAEBGSA-N	431.327	1.499	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)COCc3ccccc3)CCO2)C1	1783533429	VKUVRSNZTJLSRZ-KXBFYZLASA-N	425.323	1.817	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)Cc3ccc(C(=O)OC)s3)CCO2)C1	1783881113	JAFHUVMQJQFPPW-IFXJQAMLSA-N	444.937	1.161	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)c1	1785111970	VJFDSVYEEHTAQF-MAUKXSAKSA-N	442.285	1.779	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3ccc(F)c(F)c3)[C@H]2C1	1786582322	ALSXFTQQBAAIIL-AFIMGQEJSA-N	430.879	1.741	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCSC(=N)N)[C@H]2C1	1786848536	LAXGOZZCFLFCJG-YWDSYVAPSA-N	425.382	1.219	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)[C@H]2C1	1787507597	HSMKZLZJYVUKSE-WFHGCUKPSA-N	437.928	1.118	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21)c1ccc(-n2cccn2)nc1	1788985248	DAJNGZUSVCIVTO-KKUMJFAQSA-N	438.315	1.664	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc(F)cn3)C[C@@H]21	1790962058	VGGFGCTWOYOGFX-SJWGOKEGSA-N	442.329	1.916	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](Cl)COC)C[C@@H]21	1790963558	IJFZJUPXZGWDID-QNSTZXKLSA-N	425.751	1.393	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc(Cl)nc3)C[C@@H]21	1791054822	SUFQYFVTRLPXJT-URBCHYCLSA-N	431.718	1.507	50	20	IDGD	
COc1ccccc1OCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCC(=O)NN(C)C)C2	1792798787	XCLBKYMFQBQPLZ-BJWYYQGGSA-N	432.521	1.085	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc3c(c1)CCNCC3)C2	1793453888	YTKAQTXEYNSVJX-AJYBTWMASA-N	434.968	1.381	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@](C)(Cl)CCl)C3)n1	1794280402	KBIHSOWTMRRMNS-UESRRSCYSA-N	443.331	1.480	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)COc1ccccc1	1795188836	ZYHLNQSHAINANA-AFIMGQEJSA-N	425.323	1.686	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CNc2ccccc21	1795624070	BDTFTMXNJRDBRI-HYUSYPKPSA-N	436.350	1.959	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)n1cccc1C=O	1795752598	SJGMSYCPWZGJCH-BIYBGRMPSA-N	440.338	1.625	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1nccc2occc12	1796438736	DBWFVRAULUWOFH-BTTYYORXSA-N	434.456	1.392	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1cnc2ccccc2n1	1796777167	MAELOWBBNVTRQU-OXUXUCFPSA-N	437.269	1.524	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c(c1)C(=O)CC3)C2	1797957455	PRILPMDYXVXEFW-UPHUGPLXSA-N	430.577	1.870	50	20	IDGD	
Cc1ccc(F)cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnccc1C(=O)NN	1798439850	JUNPTDVJWPWESE-MUJYYYPQSA-N	425.464	1.698	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCCCn1cccc1)C2	1798440341	IIROUXYVPPKICE-BCDXTJNWSA-N	438.532	1.609	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1Cc3[nH]nc(C(F)(F)F)c3C1)C2	1799272451	ROJGHGKFTFLBPN-JUFVYRIHSA-N	448.873	1.750	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nc3ccccn3n1)C2	1799275336	TXZXJCJNSAQHCG-JPVZDGGYSA-N	426.304	1.169	50	20	IDGD	
C[C@H](Nc1nccs1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@](C)(Cl)CCl	1799275366	QKRYYPUPUCTRIV-QHRNJGFCSA-N	435.377	1.769	50	20	IDGD	
CCn1nc(C(C)C)cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc(B(O)O)c1)C2	1799470486	YHGNTGVIFMOZAV-REPLKXPHSA-N	438.337	1.272	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc(N(C)C)o1)C2	1800639322	OSDDJNWFIRIZHH-OPDFLTKYSA-N	429.315	1.117	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)[C@H]1CCc2ccccc21	1801114881	ZSORLXVERPTSGA-KUHBDSFDSA-N	425.298	1.997	50	20	IDGD	
COC[C@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](C)NC(=O)c1ccc(F)cc1)C2	1802284054	VZDKDKUIBLBFAR-RPCVNMKUSA-N	439.915	1.836	50	20	IDGD	
CC(C)(CCl)C(=O)NC[C@H]1CCN(C(=O)c2cc(O)nc(O)n2)[C@@H]1c1cccnc1	1802899003	HRVPKJBDCXEAMO-CZUORRHYSA-N	433.896	1.867	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CCC(=O)N2CCCC2)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803136317	PAKCBNGHXLUGIN-ABSDTBQOSA-N	436.940	1.090	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cnc(OCF)cn2)[C@@H]1c1cccnc1)[C@H](O)CCl	1803142015	VAOMDLJCDKOYDF-YSVLISHTSA-N	437.859	1.097	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)CN2CCOC2=O)[C@@H]1c1cccnc1	1803338282	BMCOJCXGANOYFY-BJJXKVORSA-N	439.310	1.323	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)C[C@H]2NC(=O)NC2=O)[C@@H]1c1cccnc1	1804341644	LBDSDXCYOPJJPT-DLTWYDFYSA-N	435.912	1.093	50	20	IDGD	
O=C([C@H](O)CCl)N1CCCC2(CCN(C(=O)[C@@H]3ON=C(c4ccccc4)O3)CC2)C1	1805522153	FXPWVCCSFIZPMI-UZLBHIALSA-N	435.908	1.552	50	20	IDGD	
O=C(c1cc2cccnn2c1)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1	1809973401	JWGABMZBDWIGCD-UHFFFAOYSA-N	446.316	1.173	50	20	IDGD	
C=CCNC(=O)/C=C\C(=O)N1CC[C@H](CNC(=O)CO[Si](C)(C)C)[C@@H]1c1cccnc1	1810537558	KZLMDTBXPVAAJG-LKWHPCHFSA-N	444.608	1.797	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)Cn2ccccc2=O)[C@@H]1c1cccnc1	1812865415	YBCQQMJEGFFVDN-URLQWDBASA-N	447.333	1.733	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(-n3cccn3)nc2)[nH]n1)[C@H](O)CCl	1814873051	JLUIQEITSNUAFS-JKSUJKDBSA-N	443.895	1.896	50	20	IDGD	
CC1(C(=O)N[C@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)CCCC1	1815335583	GMBDAJCXUIJAGL-HNNXBMFYSA-N	427.335	1.629	50	20	IDGD	
Cc1cccc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)n1	1815339926	UZTHOLXBGSZVHM-OAHLLOKOSA-N	436.302	1.066	50	20	IDGD	
CC1=CC[C@@H](C(=O)N[C@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)CC1	1815356856	UQOZROZIJCGSJR-PBHICJAKSA-N	439.346	1.795	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1CCc2nc(NC(=O)Cn3ccnn3)sc2C1	1815764675	YZIKWCHAACUOKS-NXEZZACHSA-N	427.328	1.378	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)COC(=O)C(F)(F)F)sc2C1	1819616483	QYFVIHHSLUKXME-YUMQZZPRSA-N	443.831	1.414	50	20	IDGD	
CCC(=O)N[C@@H](C)C(=O)N[C@@H]1CCc2nc(NC(=O)CO[Si](C)(C)C)sc2C1	1820160481	NHZOMAKMQOWXBD-NWDGAFQWSA-N	426.615	1.821	50	20	IDGD	
CN(CC(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@](C)(Cl)CCl)[nH]n1)C(=O)C(=O)O	1821716068	XECNVSPSEQWXLW-APPDUMDISA-N	448.307	1.181	50	20	IDGD	
CCc1cc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)n(C)n1	1822414935	OGNHNYIRKGBALY-MRXNPFEDSA-N	444.540	1.385	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CS(C)(=O)=O)CC2	1822863080	FVVSEDBDMYTDAO-CLAHSXSESA-N	428.363	1.336	50	20	IDGD	
CN(C)C(=O)NCC(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1	1822999790	XTZOZRCSUVZUTK-WRWORJQWSA-N	436.307	1.017	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](O)CCl)CC2)c1nc2ccc(F)cn2n1	1824387726	GUXIFKSKKKJFLP-GXSJLCMTSA-N	438.872	1.150	50	20	IDGD	
Cc1noc(C)c1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1	1825858719	MMAPEVMYZAVYCJ-FQEVSTJZSA-N	439.321	1.518	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CCN(C)C)CC1	1827680702	FJRYJVSBJHUZEU-SVVBGHPLSA-N	444.580	1.692	50	20	IDGD	
Cc1nc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)CC2)co1	1828925379	KHFUFVKNVMCYGS-IBGZPJMESA-N	440.504	1.529	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CN2CCN(C(C)=O)CC2)CC1	1830308656	UCTNIYFKYFZDCT-VQTJNVASSA-N	441.016	1.788	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3[nH]nc4ccncc34)C2)C1	1830358777	ZKWAYLKIMSMMHN-HXUWFJFHSA-N	435.912	1.293	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(CO)c(F)c3)C2)C1	1831658413	FHKXGVXWYADEHX-LAUBAEHRSA-N	442.915	1.796	50	20	IDGD	
Cc1ccc(C(=O)NCC(=O)N2CCCC[C@@H]2C2CCN(C(=O)[C@@H](O)CCl)CC2)cc1	1832911292	ZHUHQXCCPHYLOS-UXHICEINSA-N	449.979	1.944	50	20	IDGD	
O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)CCc1ccco1)CCO2	1833045965	ATXNNCCMDARCTF-GOSISDBHSA-N	429.311	1.454	50	20	IDGD	
Cc1ccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@](C)(Cl)CCl)C3)C2)cn1	1833132382	BFRRGFIYWQEXOQ-WOJBJXKFSA-N	444.359	1.625	50	20	IDGD	
C[C@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)c3ncccn3)CC2)CC1	1833261910	BWSBREWMFIZNRR-CQSZACIVSA-N	438.370	1.693	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cc(F)cc(F)c3F)CC2)CC1)[C@@H](O)CCl	1833313028	QZKPQFLTXKYSTB-KRWDZBQOSA-N	447.885	1.889	50	20	IDGD	
CCC(=O)N[C@H](C)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1833421948	PUKCJCWULOBRKZ-MLGOLLRUSA-N	449.365	1.163	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)c3cc(CO)on3)CC2)CC1	1833533607	ZUCJYGKRIPABLP-QGZVFWFLSA-N	426.945	1.760	50	20	IDGD	
O=C(Cc1cccc(Cl)n1)NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1833880992	MVXJVWPGHCNKRB-QGZVFWFLSA-N	443.375	1.449	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3cccc(F)c3)CCO2)C1	1835028882	XZLWIUSPBIWBRU-PXNSSMCTSA-N	428.888	1.078	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)NC1CCN(C2CCN(C(=O)CO[Si](C)(C)C)CC2)CC1	1835122827	RKYQYHNOQWILHK-MRXNPFEDSA-N	440.661	1.276	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)[C@H]3C[C@@H](O)C3)CC2)CC1	1835444530	BJUNXIBLFCIBIX-XKQJLSEDSA-N	430.387	1.502	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)c3ccc4ncnn4c3)CC2)CC1	1836397237	VHADHDIHEMKJQP-GOSISDBHSA-N	432.956	1.932	50	20	IDGD	
CC[C@@H](NC(C)=O)C(=O)N1CCC(OC2CCN(C(=O)CO[Si](C)(C)C)CC2)CC1	1836578123	KGBXRAZEUUSEFU-LJQANCHMSA-N	441.645	1.751	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc4n(n3)CCCO4)CCO2)C1	1836966548	DBTJOJVZQQEWHO-QRWLVFNGSA-N	440.928	1.143	50	20	IDGD	
Cn1ccc(C(=O)N2CCC(OC3CCN(C(=O)[C@H](F)Br)CC3)CC2)n1	1837490053	DPUJQTSOADVABY-HNNXBMFYSA-N	431.306	1.723	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)CN3CCCCC3)CC2)CC1	1837801317	UVVKUVLFPZPXEU-IBGZPJMESA-N	429.989	1.725	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)CCc3cncnc3)CC2)CC1	1837947355	FYNDTAXLWBLQDO-IBGZPJMESA-N	438.956	1.662	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@H](C)n3cccn3)CC2)CC1	1838786817	QWRCDRZKFYSZQT-MAUKXSAKSA-N	426.945	1.697	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cn(C)nc3C(F)F)C2)C1	1839144825	LKAZZQMKTBIKHO-FZKQIMNGSA-N	434.871	1.445	50	20	IDGD	
O=C(c1coc(Cl)n1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839198062	RNGLOGFAWHMFQC-QMTHXVAHSA-N	440.653	1.089	50	20	IDGD	
COc1ccc(F)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)c1OC	1839374933	QDNPTKNGVGIAQW-APWZRJJASA-N	448.850	1.447	50	20	IDGD	
CC(C)c1nc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)co1	1840030945	AXRVHRMGTBVKCC-ACJLOTCBSA-N	444.326	1.651	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3ccccc3)C2)C1	1840032144	OLTAPPOWRQTHCA-UZLBHIALSA-N	439.350	1.859	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cc(C)cc(F)c3)C2)C1	1840156378	RLBAZPLKWMAEPH-GHTZIAJQSA-N	442.915	1.387	50	20	IDGD	
COc1ccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)cc1F	1840526500	IXWMLVMELKMASA-IEBWSBKVSA-N	432.851	1.368	50	20	IDGD	
C[C@@]1(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCBr)C3)C2)CC=CCC1	1840553136	GUTJDXZEBMZLAH-RTBURBONSA-N	429.355	1.974	50	20	IDGD	
CC(=O)N/C(=C\c1ccco1)C(=O)N1CC2(CCCN2C(=O)[C@H](C)CBr)C1	1841288765	NVVVPQIDUSTUCQ-WPBJZHHJSA-N	438.322	1.991	50	20	IDGD	
CCS(=O)(=O)CC(=O)N1CCCC12CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)C2	1841586176	HJWIJRHLOHSLBK-OVCLIPMQSA-N	437.468	1.510	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)CCc2cc(F)ccn2)C1	1842010273	FMGXDPQDKCOCCV-CVKSISIWSA-N	440.479	1.491	50	20	IDGD	
O=C(c1cccc(C(F)(F)F)c1)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843011729	LLOAUHXMRGBIHJ-UHFFFAOYSA-N	432.207	1.516	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H]2OC[C@@H](C(=O)N3CC4(CCCN4C(=O)[C@@H](F)Cl)C3)[C@H]2C1	1843366535	DHLKDQUZQLZYBT-KBUPBQIOSA-N	445.919	1.606	50	20	IDGD	
C[Si](C)(C)C#CCCCC(=O)N1CCCC12CN(C(=O)c1cnccc1C(=O)NN)C2	1844253161	ZSBUNSUYRKRBSX-UHFFFAOYSA-N	441.608	1.553	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)Cc1ncccn1)C2	1844692123	JMIAVBSDUIGHIY-UHFFFAOYSA-N	439.428	1.370	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1846360811	GUTGRADBCPSQIQ-STQMWFEESA-N	438.352	1.576	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)c1cnc3c(Cl)cccn13)C2	1846384649	QSXJQNSJLPBHHC-UHFFFAOYSA-N	432.912	1.178	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CNC(=O)c1cccs1	1847495453	HQBPHRKYLGEIED-AVGNSLFASA-N	428.352	1.711	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H]1CC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl	1847556097	CQOKGFKWEZFHAA-YHUYYLMFSA-N	429.945	1.578	50	20	IDGD	
O=C(c1cccc([N+](=O)[O-])c1Br)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl	1847562035	PUUWTZOIJJXQKI-GVXVVHGQSA-N	446.685	1.772	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CCOCCNC(=O)OC(C)(C)C	1847723036	GSPYBLJZMRFQES-PMPSAXMXSA-N	447.960	1.373	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cncc(O)c1	1848098495	GENVOMKUUKYEHF-JYJNAYRXSA-N	438.912	1.735	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)ccc1[N+](=O)[O-]	3554535	CBBBRDXQSQULHL-UHFFFAOYSA-N	432.458	1.763	50	20	IDGD	
COc1ccc(CNC(=S)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1	7517593	OJBLAZTXLHYXRI-UHFFFAOYSA-N	427.574	1.903	50	20	IDGD	
CCCn1c(=O)n(CCC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c2ccccc21	31673737	BIBBMFALDPSRBX-UHFFFAOYSA-N	444.513	1.468	50	20	IDGD	
CC(=O)N1CCC[C@@H](C(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)C1	726075696	DNQDDVCKQDKDJN-GOSISDBHSA-N	447.495	1.464	50	20	IDGD	
O=C(NNC(=O)[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)c1cccc(Cl)c1)C(=O)N1CCCC1	726161931	YNRJPOVTQNUIMB-QGTPRVQTSA-N	446.935	1.883	50	20	IDGD	
COc1ccc(C(=O)NCC(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)cc1OC	726867955	XQKXITSBBANERK-UHFFFAOYSA-N	448.501	1.018	50	20	IDGD	
CCCOc1ccc(C(=O)NNS(=O)(=O)c2sc(NC(C)=O)nc2C)cc1OC	727351281	HRLIPFPJODXZKD-UHFFFAOYSA-N	442.519	1.831	50	20	IDGD	
CC/C=C(\C)C(=O)N1CSC[C@@H]1C(=O)NNC(=O)c1nn(CC)c(=O)c2ccccc12	728018983	ZBKDGDMQMDHBNO-WDBUWWRISA-N	443.529	1.435	50	20	IDGD	
O=C(COC(=O)CCNC(=O)c1n[nH]c2ccccc12)NNC(=O)c1cccc(Cl)c1	728100059	BLAKUMDNNOTBMD-UHFFFAOYSA-N	443.847	1.341	50	20	IDGD	
CN(C)N(C(=O)Cn1c(S)nnc1-c1ccc(Cl)cc1)[C@@H]1CCS(=O)(=O)C1	728178893	MFKKYBMGMPQKFJ-CYBMUJFWSA-N	429.955	1.380	50	20	IDGD	
CN(C)N(C(=O)COc1ccc(I)cc1)[C@@H]1CCS(=O)(=O)C1	728180661	VUMMJIIUSBKLAJ-GFCCVEGCSA-N	438.287	1.162	50	20	IDGD	
COCCCNC(=O)[C@H](C)N1CCN(S(=O)(=O)c2ccc(CCCCl)cc2)CC1	728935809	FUEHGYYBAWPRTK-KRWDZBQOSA-N	446.013	1.706	50	20	IDGD	
O=C(Cc1ccc2ccccc2c1)NNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1	728958812	FMUOGFJPTZFGKP-UHFFFAOYSA-N	447.499	1.451	50	20	IDGD	
COC(=O)NC(C)(C)C(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	729297757	VYYAKHGWWKIANJ-UHFFFAOYSA-N	448.501	1.061	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@@H](C(=O)NNC(=O)CNc3ccccc3)C2)cc1	729513355	LNZBNDJSXHKVMT-QGZVFWFLSA-N	430.530	1.655	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)C[C@@H](C)S(=O)(=O)c2ccc(F)cc2)cc1C	729688064	SAISKUPVUFTYSN-CQSZACIVSA-N	435.477	1.781	50	20	IDGD	
Cc1cc(S(C)(=O)=O)c(C)c(S(=O)(=O)NNC(=O)c2cc3c(s2)CCC3)c1	730203225	JTGSBOAYNBROPP-UHFFFAOYSA-N	428.557	1.880	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)NCc2nnnn2-c2ccccc2)cc1OC	730582092	FPGUDKBDDRUMQN-UHFFFAOYSA-N	439.476	1.994	50	20	IDGD	
Cc1c(C(=O)NNC(=O)COc2ccc(C#N)cc2)nnn1-c1ccc2ncccc2c1	731341318	ANNHEMDHDYVRJA-UHFFFAOYSA-N	427.424	1.836	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2ccc3c(c2)OCCO3)nnn1-c1ccc2c(c1)OCCO2	731453095	BHEXDCMHNNRGCD-UHFFFAOYSA-N	437.412	1.193	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)N1CCN(S(=O)(=O)c2c(Cl)cccc2Cl)CC1	731849110	VBOBJJCEGQWGIJ-LLVKDONJSA-N	437.349	1.246	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)CCCNS(=O)(=O)c1ccc(F)cc1	732303811	MCLAXPOIORLPMA-UHFFFAOYSA-N	429.495	1.431	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COc2nc(Cc3ccc(F)cc3)no2)cc1OC	732926535	IDGCBQHTLABPPM-UHFFFAOYSA-N	430.392	1.657	50	20	IDGD	
Cc1sc(=O)n(CCC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c1C	734313597	VNVZQHUGCMJFDQ-UHFFFAOYSA-N	431.562	1.276	50	20	IDGD	
Cn1c(=O)n(CC(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)c2ccccc21	734822544	ZWYDFGSIWJOWKO-UHFFFAOYSA-N	446.508	1.070	50	20	IDGD	
CC(C)c1nn([C@H]2CCS(=O)(=O)C2)cc1C(=O)NNC(=O)Cn1ccc2ccccc21	742642725	LXIPBVPIXNWJLT-INIZCTEOSA-N	443.529	1.782	50	20	IDGD	
NC(=O)[C@H]1CC(C(=O)NNC(=O)c2cccc(Br)c2)=NN1c1ccc(F)cc1	742773106	MYHRJCWYEILGMF-OAHLLOKOSA-N	448.252	1.469	50	20	IDGD	
N#Cc1cc(C(F)(F)F)ccc1S(=O)(=O)NNC(=O)c1cc([N+](=O)[O-])ccc1O	743269102	VMYAVLAYUUDBMQ-UHFFFAOYSA-N	430.320	1.814	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)N[C@H]2CC(=O)N(CCOc3ccccc3)C2)c1	743508380	OYHRJMQHPYMFTI-KRWDZBQOSA-N	426.473	1.384	50	20	IDGD	
CN(C)C(=O)COc1ccccc1C(=O)NNC(=O)c1cc(Br)ccc1O	743729725	FPOCZIJEKCBZAM-UHFFFAOYSA-N	436.262	1.697	50	20	IDGD	
O=C(CNc1ccccc1[N+](=O)[O-])NNc1ccccc1S(=O)(=O)N1CCOCC1	744619858	AYRUUBBCLYHLNV-UHFFFAOYSA-N	435.462	1.171	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	744621384	RAQJLGJTAZLFQB-UHFFFAOYSA-N	443.323	1.565	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)c2cc(Br)c3c(c2)OCO3)c1	744848422	QJJXQCWPPOFOBS-UHFFFAOYSA-N	446.213	1.667	50	20	IDGD	
C[C@@H](CN1CCN(c2ccccc2)CC1)NC(=O)NNC(=O)COc1ccc(C#N)cc1	745836594	BVTHRDFIMIAMKI-SFHVURJKSA-N	436.516	1.478	50	20	IDGD	
CSCC[C@@H](NC(=O)c1ccc(Cl)cc1Cl)C(=O)NNC(=O)N1CCOCC1	745996067	LDRLDPVBJIZPGW-CQSZACIVSA-N	449.360	1.918	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)NNC(=O)COc2ccc(Br)cc2)cc1	747102295	NDLWBXUFHFHIKF-UHFFFAOYSA-N	432.234	1.375	50	20	IDGD	
CSCC[C@@H](C(=O)NNC(=O)c1ccc(C#N)cc1)N1C(=O)[C@H]2CCCC[C@H]2C1=O	747176061	HSSYKFIIPMSFQW-BBWFWOEESA-N	428.514	1.616	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)N[C@@H]1CCN(c2ccccc2Br)C1	748629003	CLNULRLAEZAADD-CHWSQXEVSA-N	429.315	1.410	50	20	IDGD	
O=C(NNC(=O)c1nnn(-c2cccc(C(F)(F)F)c2)c1C1CC1)C(=O)N1CCCC1	748731837	CYVMZXYLZAXIKT-UHFFFAOYSA-N	436.394	1.547	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(/C#N)C(=O)OCC(=O)N2CCCC[C@H]2C(N)=O)c1C	749010253	JSVHFVMACDKXBU-QCTOKRQISA-N	430.505	1.629	50	20	IDGD	
COc1cc(CN2CCN([C@@H](C)C(=O)NNC(=O)CC(C)C)CC2)cc(OC)c1OC	749853159	VFHVREDACYGAIJ-INIZCTEOSA-N	436.553	1.412	50	20	IDGD	
COc1ccccc1N1CC[C@@H](CNC(=O)NNC(=O)Cc2nc3ccccc3n2C)C1	750330476	FJLCENYFFDFDTM-INIZCTEOSA-N	436.516	1.981	50	20	IDGD	
CC(C)(C)NC(=O)CN1CCC(CNC(=O)NNC(=O)Cc2c[nH]c3ccccc23)CC1	751111454	MARUGMBNIKLYAS-UHFFFAOYSA-N	442.564	1.668	50	20	IDGD	
CCc1nc(C(=O)NNC(=O)CNC(=O)c2cccs2)nn1-c1ccccc1Cl	751212422	RJWWDKAMMRLSES-UHFFFAOYSA-N	432.893	1.736	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)c2cc(S(=O)(=O)NC)oc2C)cc1OC	751298844	BYGLHSDLUOIDPO-UHFFFAOYSA-N	439.490	1.758	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)[C@@H]1CC(=O)N(CCOc2ccccc2Cl)C1	751927808	QDCWTZDOXILGER-CQSZACIVSA-N	447.875	1.499	50	20	IDGD	
O=C(NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12)N[C@H]1CC[C@H](O)CC1	753718671	GIQYICNZBSBZIV-QAQDUYKDSA-N	435.484	1.692	50	20	IDGD	
COc1ccc(C2(C(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)CCC2)cc1OC	754107894	KGYDQMIBGHZSQJ-UHFFFAOYSA-N	432.498	1.990	50	20	IDGD	
O=C(COCc1ccccc1)NNS(=O)(=O)c1ccc(C(=O)O)c(C(F)(F)F)c1	754754563	KLCKTUVROLAWGT-UHFFFAOYSA-N	432.376	1.930	50	20	IDGD	
CCCCCc1ccc(NC(=O)NNC(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)cc1	755464816	ZARVJWZZURFKTK-UHFFFAOYSA-N	441.492	1.019	50	20	IDGD	
CCN1CCN(c2ccc(NC(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)cc2)CC1	755470813	BCMZDIAWPRKANZ-UHFFFAOYSA-N	435.492	1.271	50	20	IDGD	
COC(=O)c1cc(Cl)cc(NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c1	756677123	PEPIMEGAFIXGEJ-UHFFFAOYSA-N	425.850	1.997	50	20	IDGD	
COC(=O)CCCc1nnc(NC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)s1	756684052	JYTFDYPLFIQPPH-UHFFFAOYSA-N	429.462	1.686	50	20	IDGD	
Cc1nc(Br)ccc1NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	757887521	MUPKENXLGUPWBP-UHFFFAOYSA-N	431.250	1.866	50	20	IDGD	
Cc1cc(C)c2c(-n3cccc3)c(C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)sc2n1	758044964	AYVMOZZOCPDQFG-GFCCVEGCSA-N	435.531	1.403	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)c1oc2ccccc2c1COc1ccccc1	758045569	COGSKXNDOANAND-CYBMUJFWSA-N	431.470	1.711	50	20	IDGD	
CN(N=Cc1cnc(N2CCOCC2)s1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758139402	UAZJZVXRPOXMDS-UHFFFAOYSA-N	438.554	1.918	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)c1ccnc(Br)c1	758151304	SQSRGPZXKHVUPN-UHFFFAOYSA-N	432.322	1.817	50	20	IDGD	
CN1C(=O)CCc2cc(C(=O)OCC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)ccc21	758592987	ZZERVDGZCBSYLA-UHFFFAOYSA-N	426.385	1.122	50	20	IDGD	
O=C(NNC(=O)C(=O)Nc1ccccn1)N[C@H]1CCCN(Cc2c(F)cccc2F)C1	758753252	GAKITQXRPKLAAV-ZDUSSCGKSA-N	432.431	1.293	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H](C#N)[C@@H](NC(=O)NNC(=O)c2cccc(OC(F)F)c2)C1	758774864	VHGSLOJEVJHPOZ-JSGCOSHPSA-N	439.419	1.991	50	20	IDGD	
O=C(N[C@H](C(=O)NNC(=O)C(=O)Nc1ccccn1)c1ccccc1)OCc1ccccc1	758834710	QHWVNAOHXGMLER-IBGZPJMESA-N	447.451	1.835	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCCC(=O)NNC(=O)CCNC(=O)OC(C)(C)C)cc1C	760440044	VZTPCUYFAOMMLB-UHFFFAOYSA-N	442.538	1.034	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccccc2CN2C[C@H](C)O[C@H](C)C2)c(C)o1	763587609	ZWUGMKNAUZXKBV-GASCZTMLSA-N	428.489	1.905	50	20	IDGD	
COCCOCc1cccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)c1	763601189	PWRVXBUFRLYLKD-UHFFFAOYSA-N	437.456	1.639	50	20	IDGD	
CNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)cc1Cl	763603840	AZGSHIBJWICQDP-UHFFFAOYSA-N	440.847	1.489	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F	763627601	BYPZBIQZYSPVDT-UHFFFAOYSA-N	448.342	1.552	50	20	IDGD	
CCOC(=O)c1c(C)csc1NC(=O)C(=O)NNC(=O)COc1ccccc1OC	763663588	KNHBXBSAMJDMPJ-UHFFFAOYSA-N	435.458	1.407	50	20	IDGD	
O=C(NNC(=O)[C@@H]1C[C@@]12CCOC2)c1cccc(S(=O)(=O)NCc2ccccc2)c1	763728734	QYSWHLGYFDJLMC-GHTZIAJQSA-N	429.498	1.353	50	20	IDGD	
C#CCOc1ccc(NC(=O)C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)cc1	763791884	YGWVFUYGUDBTFW-UHFFFAOYSA-N	447.451	1.389	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)COC3)c2ccccc2c1=O	763801324	OFMZTTAQQWKSNR-UHFFFAOYSA-N	449.467	1.627	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)C(=O)Nc1cccc(-c2nccs2)c1	763805011	ZVPFQEGSRDRSBN-UHFFFAOYSA-N	441.425	1.883	50	20	IDGD	
CC(C)CC(=O)Nc1ccc(Cl)c(C(=O)NNC(=O)CNC(=O)c2cccnc2)c1	763818953	RJIGPKVKQAUFSX-UHFFFAOYSA-N	431.880	1.911	50	20	IDGD	
CC(C)S(=O)(=O)c1ccccc1NC(=O)C(=O)NNC(=O)Cc1c[nH]c2ccccc12	763856188	DITSZEVLQLOTID-UHFFFAOYSA-N	442.497	1.679	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(OC)nc2OC)cc1	763860668	JXDBFWALIKVZRI-GFCCVEGCSA-N	432.433	1.051	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1cccc(NC(=O)C2CC2)c1	763865947	MMLLWLSQHHCCKZ-GFCCVEGCSA-N	428.420	1.728	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccc(NC(=O)C2CC2)nc1	763866563	VYRSHTBPWDWXQL-NSHDSACASA-N	429.408	1.123	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2cnn(Cc3ccc(Cl)cc3)c2)n1	763880475	GHVHRQUYYWLAFE-UHFFFAOYSA-N	429.868	1.184	50	20	IDGD	
COc1ncccc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1cccc(Br)c1	763882763	LPQUJUCZHPMIGQ-JTQLQIEISA-N	437.250	1.406	50	20	IDGD	
CC(C)CC(=O)NNC(=O)C(=O)Nc1ccc(S(=O)(=O)N2C[C@H](C)C[C@@H](C)C2)cc1	763883917	SHHLISDRYYGVJA-HUUCEWRRSA-N	438.550	1.485	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccccc1CN1CCSCC1	763919104	QNXCWVPPSHTAGW-UHFFFAOYSA-N	430.505	1.703	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2ccc(C)cc2O)nc1I	763946485	UKQIXUBRJSUQSG-UHFFFAOYSA-N	427.198	1.784	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)C(=O)Nc1cccc(Sc2ccccc2)c1	764001733	DOOMGRDRHBWYMU-ZDUSSCGKSA-N	433.511	1.358	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)Nc1ccccc1-n1cccn1	764004588	IDKRMBXVESRKFY-UHFFFAOYSA-N	431.250	1.373	50	20	IDGD	
O=C(NNC(=O)C1CCCC1)C(=O)Nc1cc(F)c(I)c(F)c1	764069831	FBGFXNJXXVHTGS-UHFFFAOYSA-N	437.184	1.846	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1O)C(=O)Nc1ccc(N2CCOCC2)c(F)c1	764125389	WREDAVUKYBJOMO-UHFFFAOYSA-N	436.827	1.421	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccc(OCc2cccnc2)cc1	764139317	RVNRPKVUOOAGGI-UHFFFAOYSA-N	434.452	1.998	50	20	IDGD	
CC[C@H](C)NS(=O)(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)CC(C)(C)C)c1	764197884	ICHDCKHFAFSFMK-ZDUSSCGKSA-N	426.539	1.427	50	20	IDGD	
C[C@@H](c1cc(Cl)ccc1Cl)n1nccc1NC(=O)C(=O)NNC(=O)CN(C)C	764204233	PHSWVELCEGUSDD-JTQLQIEISA-N	427.292	1.447	50	20	IDGD	
CNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)cc1Cl	764240037	YETZJBFDLCSTOZ-UHFFFAOYSA-N	427.848	1.440	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)ccc1F	764346137	UKHZNAFNEUXFIM-UHFFFAOYSA-N	425.376	1.198	50	20	IDGD	
CCN(CC)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)COCc2ccccc2)cc1	764366523	MYJPQNTWNPWOPV-UHFFFAOYSA-N	426.473	1.471	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cccc([S@@](C)=O)c3)n[nH]2)cc1	764384945	NWAYIHVZTXYWOJ-WJOKGBTCSA-N	439.497	1.776	50	20	IDGD	
Cc1ccc(Cn2nccc2NC(=O)C(=O)NNC(=O)CSc2ccccc2O)o1	764394167	PAAWSZJFYKVECF-UHFFFAOYSA-N	429.458	1.417	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)[C@H]3CN(C(=O)OC(C)(C)C)CCO3)n[nH]2)cc1	765411024	WSYTXLMDJMZNLT-QGZVFWFLSA-N	429.477	1.782	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)CCc3nc(-c4ncccn4)no3)n[nH]2)cc1C	765564658	AJJOFZAIWMKWSO-UHFFFAOYSA-N	432.444	1.927	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)CNC(=O)c2ccc(F)c(F)c2)n[nH]1	765601692	SBHCDYDGVFBOSQ-UHFFFAOYSA-N	429.383	1.555	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3c(-c4ccccn4)noc3C)CC2)cc1	766647223	BKJVZKODOYBRGS-UHFFFAOYSA-N	448.527	1.932	50	20	IDGD	
Cc1c(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cnn1C1CCOCC1	766754003	LSBPICXDEFOYHI-UHFFFAOYSA-N	440.548	1.516	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@@H]2COc3cc(OC)ccc3C2)c2ccccc2c1=O	768108241	WLGKNUNDLGVQLH-AWEZNQCLSA-N	437.456	1.373	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(n2cc(C(=O)NNC(=S)Nc3ccccn3)nn2)CC1	768577139	BNOOQDSQXHIYPS-UHFFFAOYSA-N	446.537	1.877	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2ccc([N+](=O)[O-])c(Cl)c2)ccc1Cl	768686439	JVYWGGDFYJKORU-UHFFFAOYSA-N	433.229	1.624	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1ncn(-c2ccccc2)n1	768693387	UJTACZHKYSCQAX-UHFFFAOYSA-N	429.820	1.547	50	20	IDGD	
CC(C)OC(=O)N1CCC(NC(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)CC1	770393176	BUADOQCFNYOPKE-UHFFFAOYSA-N	434.501	1.922	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1ccc(OC(F)F)cn1	773232700	UZLPFYBUJXLPKL-UHFFFAOYSA-N	428.417	1.461	50	20	IDGD	
CC(C)[C@@H](C(=O)NNC(=O)[C@H]1CCCN(C(=O)OC(C)(C)C)C1)N1C[C@@H](C)O[C@H](C)C1	773417819	IHKDGZMVEGBKSJ-BDXSIMOUSA-N	440.585	1.915	50	20	IDGD	
CCN(CC)CCNC(=O)c1cccc(NC(=O)C(=O)NNc2cnc3ccccc3n2)c1	773718209	JVBZCBCQPBAXAV-UHFFFAOYSA-N	449.515	1.783	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(Br)cc1F)c1ccc2c(c1)OCCO2	775257270	FDBPFXXGOVFMNI-UHFFFAOYSA-N	431.239	1.983	50	20	IDGD	
Cc1cc(C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)nc(C(F)(F)F)n1	778388390	RCHVUBGYYSCMKG-UHFFFAOYSA-N	427.295	1.330	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)NCc1cccc(NC(=O)c2ccncc2)c1	778612500	CUFCMBPVIQQJDS-UHFFFAOYSA-N	442.476	1.689	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)[C@H](O)[C@@H](O)c3nc4ccccc4s3)nc21	779518343	WYWYBFIIOLFUMC-CHWSQXEVSA-N	443.489	1.434	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C[C@@H](NC(=O)c2ccc(O)cc2)c2ccccc2)n1	780326277	XIULOYYRZUZHLY-HXUWFJFHSA-N	435.484	1.914	50	20	IDGD	
O=S(=O)(CBr)NCCCCCCCNS(=O)(=O)CBr	782473094	SJFMCQWUFINUBQ-UHFFFAOYSA-N	444.211	1.481	50	20	IDGD	
CSc1cccc(C)c1NC(=O)C(=O)NNC(=O)c1sc(N2CCOCC2)nc1C	782897976	UEUFMLRIUOSRMN-UHFFFAOYSA-N	449.558	1.718	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2cccc(N3CCCC3)c2)nc1	783264404	OWUYMIVLHSYQQH-UHFFFAOYSA-N	446.533	1.450	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)NC[C@H]2COC(C)(C)O2)cc(OCC)c1OCC	783273462	YTYBPJCVDKXUPS-AWEZNQCLSA-N	425.482	1.978	50	20	IDGD	
CS(=O)(=O)N1CCc2c(NC(=O)C(=O)NNc3cccc4c3CCCC4)cccc21	783452697	HUQIHCXXKWDGRQ-UHFFFAOYSA-N	428.514	1.969	50	20	IDGD	
O=C(NCCc1ccc(F)c(F)c1F)NNC(=O)c1csc(N2CCOCC2)n1	784171366	KDAFVOYZKDPWTE-UHFFFAOYSA-N	429.424	1.584	50	20	IDGD	
O=C(NCCCc1nc(-c2ccc(F)cc2)no1)NNC(=O)[C@H]1COc2ccccc2O1	784450904	BBNIAQWGRYLZMB-QGZVFWFLSA-N	441.419	1.979	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1ccc2c(c1)COC2	784832677	CTPBFCOZZJIEDO-UHFFFAOYSA-N	432.502	1.875	50	20	IDGD	
COc1cccc(NNC(=O)C(=O)Nc2ccc(C)c(S(=O)(=O)NC3CC3)c2C)n1	784846716	UGDJJOGMLNHNJC-UHFFFAOYSA-N	433.490	1.230	50	20	IDGD	
CN1CCOc2ccc(NC(=O)C(=O)NNc3c(F)cc(C(=O)NC4CC4)cc3F)cc21	785099817	LAUCSAGBGYLPSW-UHFFFAOYSA-N	445.426	1.767	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2ccc(N3CCO[C@@H](C)C3)cc2)n1	785227492	UKGSIKOZDZCSME-HNNXBMFYSA-N	427.509	1.630	50	20	IDGD	
Cc1c(NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cccc1N1CCNC1=O	786303192	DXGSRTGIPMXXRI-UHFFFAOYSA-N	431.474	1.395	50	20	IDGD	
Cc1ccc(-n2cc(NC(=O)C(=O)NNC(=O)COc3ccc(F)cc3)cn2)c(C)c1	786414428	PGWDPVHCBQRXNT-UHFFFAOYSA-N	425.420	1.793	50	20	IDGD	
CCS(=O)(=O)CCn1cc(C)c(NC(=O)NNC(=O)CSc2ccccc2O)n1	786733475	ZBJLWVSFHHMOHH-UHFFFAOYSA-N	441.535	1.277	50	20	IDGD	
C[C@H](NS(=O)(=O)c1ccc(C#N)cc1)C(=O)NNC(=O)NCc1ccc(Cl)cc1	787422555	FYXKPVBRPIOFTB-LBPRGKRZSA-N	435.893	1.409	50	20	IDGD	
CC(C)Oc1cc(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3n2)ccc1C(N)=O	789729692	FQIPXQRZDMGTIV-UHFFFAOYSA-N	435.440	1.521	50	20	IDGD	
CC(C)n1nc(-c2ccco2)cc1NC(=O)C(=O)NNC(=O)[C@H]1COc2ccccc2O1	789732756	UXOPTZQRZIHBCQ-QGZVFWFLSA-N	439.428	1.650	50	20	IDGD	
O=C(CCC(=O)N1CC(=O)Nc2ccccc21)NNC(=O)c1nn(-c2ccccc2)cc1O	789852613	MCXULWDWJIZPNJ-UHFFFAOYSA-N	448.439	1.104	50	20	IDGD	
COC(=O)c1ccc(S(=O)(=O)NNC(=O)c2ccc3c(c2)OCO3)cc1C(F)(F)F	790050167	MYUMGEDXPZZPJZ-UHFFFAOYSA-N	446.359	1.844	50	20	IDGD	
Cc1ccn(C[C@](C)(O)C(=O)NNC(=O)c2cc(F)ccc2Br)c(=O)c1	790643696	OSKLJWZLHSEYIX-KRWDZBQOSA-N	426.242	1.271	50	20	IDGD	
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC[C@@H](C(=O)NNc2cccc(F)c2[N+](=O)[O-])C1	791066402	HQRBEKQYYNFPOF-GFCCVEGCSA-N	440.457	1.618	50	20	IDGD	
O=C(NNc1nc2ccccn2n1)C(=O)Nc1ccccc1-n1cc(Br)cn1	792393369	FLZZAXKGOHYMQO-UHFFFAOYSA-N	441.249	1.759	50	20	IDGD	
CC(=NNC(=O)C1CCN(c2ncccn2)CC1)c1cc(S(N)(=O)=O)c(C)cc1C	794508922	URKXRKQLZIESMN-UHFFFAOYSA-N	430.534	1.498	50	20	IDGD	
CCOC(=O)c1ccc(NNC(=O)c2c(OC)ccc(S(N)(=O)=O)c2OC)cc1C	794647155	PGCJHGCUNFKHBL-UHFFFAOYSA-N	437.474	1.593	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NN=Cc1c(C)cnn1C)N(S(C)(=O)=O)CC2	794882570	OZJLNCBAACAYHC-MRXNPFEDSA-N	449.533	1.145	50	20	IDGD	
CCNC(=O)N(C)c1cccc(NC(=O)C(=O)NNC(=O)C(C)(C)c2ccccc2)c1	797009860	XEDCOOXALPFAAX-UHFFFAOYSA-N	425.489	1.916	50	20	IDGD	
O=C(NNC(=O)c1cn2c(n1)CCCC2)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	799538565	IEUCUDCACKPXKP-UHFFFAOYSA-N	442.483	1.996	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCOCC2)cc1C(=O)NNC(=O)Nc1ccccc1	801990016	ROXAOPYATJBIBN-UHFFFAOYSA-N	434.474	1.183	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)CN2C(=O)N[C@@]3(C[C@H](C)CC(C)(C)C3)C2=O)cc1	802058676	LJWYJJOVDHYPBV-LRTDBIEQSA-N	431.493	1.985	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)[C@H]2CC(=O)N(c3cc(OC)cc(OC)c3)C2)cc1	802059040	UECYUBMARGPVGQ-ZDUSSCGKSA-N	428.445	1.918	50	20	IDGD	
CC(=O)N1Cc2ccccc2C[C@@H]1C(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	802066367	MHUFAHVPQGZYPW-GOSISDBHSA-N	430.486	1.216	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)CCCCC(N)=O)c2)c(C)c1	802425978	GGPLSWMXGZIKMC-UHFFFAOYSA-N	446.529	1.911	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)[C@@H](C)Oc1ccc(C=O)cc1	803965405	NRVBNNSAGZMSNC-GFCCVEGCSA-N	434.832	1.933	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(OCC(=O)NNc2cccc(F)n2)c([N+](=O)[O-])c1	804766544	QLQJVRNMWWEGJZ-UHFFFAOYSA-N	441.441	1.682	50	20	IDGD	
COCC[C@@H](Cc1cccc(Br)c1)C(=O)NNC(=O)N1CCN(C)CC1	807380843	SMIVKPIJMOESBR-HNNXBMFYSA-N	427.343	1.633	50	20	IDGD	
O=C(NNC(=O)N1CCC[C@H](CNS(=O)(=O)C2CC2)C1)c1ccc2ccccc2c1	808229155	PUOBNDKTQCZWAA-OAHLLOKOSA-N	430.530	1.988	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccccc1F)NNc1nc(-c2ccc(Cl)cc2)no1	810397518	QTYWWUDLADAEDK-UHFFFAOYSA-N	425.829	1.951	50	20	IDGD	
CC(C)CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)NNC(=O)c1cccc(Br)c1	810448947	AJIMSFDLLQIDDV-OAHLLOKOSA-N	436.310	1.707	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCC2(SC)CCN(C)CC2)cc(OC)c1OC	811851215	SJMUNFIIQRGWJE-UHFFFAOYSA-N	426.539	1.484	50	20	IDGD	
CC[C@]1(CNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)OCCc2ccccc21	811874799	PNFDSTKBDVTRAZ-HSZRJFAPSA-N	438.532	1.902	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1cc(C#N)cc(N(C)C)c1	814574506	ZSPKADYQJVRZLS-UHFFFAOYSA-N	430.848	1.904	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)[C@@](C)(O)c2ccc(Cl)cc2)cc1OC	815500416	XIFXCFMEUFBPEV-FQEVSTJZSA-N	436.848	1.569	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)cc2cccnc12	815565268	ILCJGJNEWVJTDJ-UHFFFAOYSA-N	433.468	1.782	50	20	IDGD	
CCOC(=O)c1cc(COC)cc(NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)c1	815570126	RZSOLOCMELDYRA-UHFFFAOYSA-N	449.847	1.768	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2ccc(N(C(C)=O)C3CC3)cc2)n1	815611869	VUKNDKSKEXIOKX-UHFFFAOYSA-N	425.493	1.920	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCc2nncn2C1)C(=O)Nc1ccc(C(F)(F)C(F)(F)F)cc1	815691053	DJIBCPDPGDDEGQ-VIFPVBQESA-N	446.336	1.281	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)N2CCC(CS(C)(=O)=O)CC2)N(C)c2ccccc21	817040407	AZMUAOIFNSYDPC-UHFFFAOYSA-N	444.557	1.940	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@H]12	817052838	SFUDWIYCUOUDIQ-ZQIUZPCESA-N	441.579	1.106	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)NC2CCN([C@@H]3CCN(C)C3=O)CC2)c1C	819805336	XSCCNUPSKBDRTG-LUDQZLGDSA-N	427.549	1.470	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)o1	914749674	JLPLZKYVOLIMSJ-GFCCVEGCSA-N	425.438	1.432	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNC(=O)Cc2ccc(S(N)(=O)=O)s2)cc1	915190609	OAJHHHRCJQJPMJ-UHFFFAOYSA-N	425.532	1.824	50	20	IDGD	
O=C(NCCNS(=O)(=O)c1cccc(Cl)c1)NNC(=O)c1ccc([N+](=O)[O-])cc1	916295615	PLEMNPBMKBWKAR-UHFFFAOYSA-N	441.853	1.171	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NN=Cc1cccc(O)c1)N(S(C)(=O)=O)CC2	916356425	VAZIUQZGVWBNRO-SFHVURJKSA-N	447.513	1.809	50	20	IDGD	
CN1CCN(c2cc(CNC(=O)NNC(=O)C34CC5CC(CC(C5)C3)C4)ccn2)CC1	916390120	LLEQROJKHHNSNQ-UHFFFAOYSA-N	426.565	1.880	50	20	IDGD	
C[C@H]1CN(c2ccc(CNC(=O)NNC(=O)c3ccc4c(c3)OCCO4)cn2)CCO1	916393050	RGKWXXSYSIMVKH-AWEZNQCLSA-N	427.461	1.222	50	20	IDGD	
O=C(NCc1cc(Cl)c2c(c1)OCCO2)NNC(=O)c1ccc(-n2cnnn2)cc1	916628154	BDIHNKPIRKZSPN-UHFFFAOYSA-N	429.824	1.231	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)c1ccccc1S(=O)(=O)N1CCCCC1	917360346	HJBLMKFKEYCEAD-UHFFFAOYSA-N	441.513	1.892	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)NCCCCN2CCN(Cc3ccccc3)CC2)n1	918228386	JEDYYBBHXHEMAW-UHFFFAOYSA-N	441.580	1.428	50	20	IDGD	
Cc1cc([N+](=O)[O-])c(S(=O)(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1C	918725156	CBHYSYYKDUTFJW-UHFFFAOYSA-N	427.460	1.238	50	20	IDGD	
COc1ccc(S(=O)(=O)CCC(=O)NNC(=O)c2cc(Br)c[nH]2)cc1	1115816803	FIDKXYPMPUMHKW-UHFFFAOYSA-N	430.280	1.411	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@H]2C(=O)NNC(=O)c2cncn2-c2ccccc2)cc1	1116900958	UDNXBHDFKRQFRQ-IBGZPJMESA-N	433.468	1.947	50	20	IDGD	
C[S@@](=O)CCCNC(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1	1121903526	SGTGQBAJHVYRKX-PRAQEBQASA-N	428.558	1.713	50	20	IDGD	
Cc1ccc2c(c1)S[C@H](C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1)C2	1251902547	QNBQDBDIHDFQCG-KRWDZBQOSA-N	447.586	1.486	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)N[C@H]1CCCN(C(=O)c2ccccc2)C1	1318177849	XTSLMURVVYCRIC-KRWDZBQOSA-N	448.483	1.827	50	20	IDGD	
O=C(Cn1cc(C(F)(F)F)ccc1=O)NNc1nc(Br)cn2ccnc12	1319105379	WHQDZMUHJILSGC-UHFFFAOYSA-N	431.172	1.816	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CSc2ccc(C(=O)N3CCCC3)cn2)cc1OC	1322156644	ARKMDEYXYMSBTM-UHFFFAOYSA-N	444.513	1.888	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NN=C2CCC3(CC2)NC(=O)NC3=O)cc1	1335896303	BVSCRYAAUKECDJ-UHFFFAOYSA-N	427.490	1.345	50	20	IDGD	
CC(=O)N/C(=C\c1ccccc1)C(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1	1339229776	BITQJKMSKSLFDJ-JXAWBTAJSA-N	430.505	1.958	50	20	IDGD	
Cc1cc2nnc(C(=O)N3CC[C@]4(CN(C(=O)CO[Si](C)(C)C)CCO4)C3)c(C)n2n1	1777783077	VORQXQIUIKGXMT-FQEVSTJZSA-N	446.584	1.036	50	20	IDGD	
O=C(c1cccc2c1OCCO2)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1777835197	DOHBVKSWMMPZFK-QAPCUYQASA-N	443.269	1.592	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](CC)NC(N)=O)C1	1777982206	WUWMQQPDCJKTCH-UYAYXHRUSA-N	447.374	1.121	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)Cc3ccc(NC(C)=O)cc3)C2)C1	1778257242	TWAWTOXUFVXEAG-GHTZIAJQSA-N	437.924	1.271	50	20	IDGD	
CSc1ncccc1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1779838709	FAYBTLQEYMREOK-BLLLJJGKSA-N	432.315	1.938	50	20	IDGD	
CCOc1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@](C)(Cl)CCl)C3)C2)nn1	1781230925	BEMCTCFHOMNWMW-MSOLQXFVSA-N	431.320	1.555	50	20	IDGD	
CS(=O)(=O)c1ccc(F)c(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](F)Cl)CCO3)c1	1782152409	RXZXSNFXHNVKPM-YOEHRIQHSA-N	436.864	1.207	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H]2CCCN2C(C)C)C1	1782766952	FKPSPNPVLOCDIE-BMQTXXJKSA-N	429.989	1.627	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cn4ccccc4n3)CCO2)C1	1783347828	POJQVPQHSAACAU-IFXJQAMLSA-N	435.322	1.951	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](OC(C)=O)C(C)C)CCO2	1783349849	UENLFARBPAUHTG-HDMKZQKVSA-N	433.343	1.578	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(Cl)cnc3O)[C@H]2C1	1783403331	VFAIDQFYUMKECJ-NUZBWSBOSA-N	446.729	1.817	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)COc3ccc(Cl)c(F)c3)CCO2)C1	1783871780	VNKAZACHCFFBKS-BEFAXECRSA-N	449.306	1.942	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(OC)cc(OC)c3)CCO2)C1	1783882122	OCTRMACACZYCTH-XLIONFOSSA-N	426.897	1.401	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3n[nH]c4ccc(C#N)cc34)CCO2)C1	1783882854	QZOWFCBNECRLIN-YWZLYKJASA-N	431.880	1.132	50	20	IDGD	
Cc1ccc(S(=O)(=O)CC(=O)N2CCO[C@@]3(CCN(C(=O)C(Cl)Cl)C3)C2)cc1	1783946452	AVCRXAKMIBWYFG-SFHVURJKSA-N	449.356	1.402	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](C)Cn3ccnc3)C2)C1	1784506036	LSCAHGCTNXJJKT-RLFYNMQTSA-N	427.343	1.523	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3cc(C)no3)[C@H]2C1	1785092299	YNBAPRHGNQRNER-HNKHHVNMSA-N	428.327	1.679	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cccc(C(=O)N(C)C)c3)C2)C1	1785285194	NLTORKOKZCIQKC-UWJYYQICSA-N	437.924	1.086	50	20	IDGD	
C[C@@H]1Oc2ccc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]4C3)cc2NC1=O	1787447883	IJDZSJNVWRUJKY-CFXSOUKZSA-N	439.871	1.534	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3ON=C(c4ccccc4)O3)[C@H]2C1	1788520013	DTQGVTKQLCMHMZ-BWRRFVNYSA-N	435.908	1.718	50	20	IDGD	
C[C@H](C(=O)Nc1ccc(C2(NC(=O)[C@@H](O)CCl)CCC2)cc1)[C@H]1SC(=N)NC1=O	1788633829	YVNRFJBIDWBJLF-LEWSCRJBSA-N	438.937	1.523	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)c1c(F)cncc1F	1789007188	LNAIIOMQHFYOLN-XYDQJSOLSA-N	436.228	1.644	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(C)nc3OC)[C@H]2C1	1789016412	VLAPIDHVPYDLIK-LLLHUVSDSA-N	425.913	1.246	50	20	IDGD	
CCOc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCBr)C[C@@H]32)nn1	1789395829	JSYICHFATIBVPX-YDHLFZDLSA-N	441.326	1.254	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cn4ncccc4n3)C[C@@H]21	1789868021	LIRUQXWFSVSHRW-NGOJXBLDSA-N	440.331	1.559	50	20	IDGD	
Cc1nn(C)c(C)c1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]2C1	1789921431	IRPNUHMCWDHVTH-ABHRYQDASA-N	431.306	1.321	50	20	IDGD	
N#Cc1ccc(F)c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]3C2)c1	1789923255	AUBWRRQMNIEDJD-MZGVZZPPSA-N	442.260	1.981	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(OC)ccn3)C[C@@H]21	1790960470	JZXUOOWGSFRYKM-FAYQHZLMSA-N	440.338	1.857	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)Br)C[C@@H]21	1791063585	MCIPYGBPJQSTQI-HTFCKZLJSA-N	426.149	1.533	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C[C@@H]3C[C@@H]4CC[C@H]3C4)C[C@@H]21	1791293290	SHFYEPJPCJTGRP-HLXURNFRSA-N	434.581	1.165	50	20	IDGD	
CO[C@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C[C@@H]21	1791318371	VXIOJDPXXSFBEC-YXMSTPNBSA-N	447.960	1.133	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cn(C)c3ncccc13)C2	1792871005	OJXUGTBHYGTAMT-VWPFQQQWSA-N	449.349	1.808	50	20	IDGD	
CC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2	1795141645	GIDCPPWJLCGSNI-YVWYUNDQSA-N	447.444	1.093	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(Cl)nc(OC)c1	1798291615	ROWVJWAHMPTKLG-OQMKEHIESA-N	432.304	1.201	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnccc1Cl)C2	1798439983	RGYUVKUBJKXCER-CLLJXQQHSA-N	428.880	1.299	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CCOC1)C2	1800334113	JMLMOQVKTXSUNU-ULNPWSCNSA-N	431.439	1.498	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(C)n(C(F)F)n1)C2	1800642536	NQYVIKDICMGZPP-GFQSEFKGSA-N	449.296	1.963	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1cnccn1)C2	1800644396	RWTDPQFZTDVKHA-IARIHHJXSA-N	425.327	1.172	50	20	IDGD	
CC(C)(CCl)C(=O)NC[C@@H]1CCN(C(=O)CNCP(=O)(O)O)[C@H]1c1cccnc1	1802900323	VDBPCMLWWRRQLS-HOCLYGCPSA-N	446.872	1.077	50	20	IDGD	
Cc1cnc(C(=O)NC[C@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)s1	1805245112	RNWDGJZNQHMSAL-VQIMIIECSA-N	444.561	1.539	50	20	IDGD	
Cn1ccc2c(O)ncc(C(=O)N3CCC4(CCCN(C(=O)[C@H](O)CCl)C4)CC3)c21	1805523473	WDGKVCHUBVPZGM-MRXNPFEDSA-N	434.924	1.723	50	20	IDGD	
Cc1cc(C(=O)NC[C@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)no1	1805840059	YRPVDDWQDIBQMK-OXQOHEQNSA-N	428.493	1.071	50	20	IDGD	
C[C@]1(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)CC1(F)F	1807375609	UGFOQZARIAAKLX-HGHGUNKESA-N	443.259	1.126	50	20	IDGD	
O=C(Cn1ccnn1)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@@H]1c1cccnc1	1807683309	ZZKXREURMUVNGJ-NWANDNLSSA-N	425.262	1.070	50	20	IDGD	
CC(C)=CCCC(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1807971918	BXNMPMRSSJZWPG-NFBKMPQASA-N	435.333	1.827	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)c1ccc2n[nH]cc2c1	1808013148	XTQGKMHYFYWBPU-SNRMKQJTSA-N	427.892	1.877	50	20	IDGD	
O=C(CCBr)N1CCCC2(CCN(C(=O)[C@@H]3CCCS3(=O)=O)CC2)C1	1809070370	MNDSCXYGGIVXJZ-AWEZNQCLSA-N	435.384	1.580	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC2(CCCN(C(=O)COc3ccccc3)C2)CC1	1809177689	UPLMILJCFNIEHL-UHFFFAOYSA-N	430.549	1.670	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)c1ccc2nncn2c1	1809911956	WIRZOBHNMIBFNJ-ZVZYQTTQSA-N	428.880	1.044	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)[C@H](C)n2cnnn2)[C@@H]1c1cccnc1	1812867940	PGEXJCWWNZREOY-NZBPQXDJSA-N	436.314	1.119	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2ccc(O)cc2)[C@H]1c1cccnc1	1813072766	KFUPRXRLVQSAMU-AVRDEDQJSA-N	439.516	1.480	50	20	IDGD	
O=C(Cc1ccccc1)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(B(O)O)cc1)CC2	1813805411	UFMLASCXCXVYNE-KRWDZBQOSA-N	435.314	1.291	50	20	IDGD	
CN1CCC(CC(=O)Nc2cc([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)CC1	1814545746	ZUWCBZUJQTUPAY-GOSISDBHSA-N	447.584	1.507	50	20	IDGD	
C[C@H](CBr)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](C)CC(N)=O)[nH]n1	1814779706	VJMCJPLIXPVBGO-WZRBSPASSA-N	428.331	1.944	50	20	IDGD	
Cc1cc(C)n2ncc(C(=O)Nc3nc4c(s3)C[C@H](NC(=O)[C@H](O)CCl)CC4)c2n1	1818237277	WKRICVKYDHRVQF-BXUZGUMPSA-N	448.936	1.628	50	20	IDGD	
Cc1nc[nH]c1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1818272377	NXHUGTYXSYRYBG-HNNXBMFYSA-N	437.464	1.059	50	20	IDGD	
CC1=CC[C@H](C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cccc(B(O)O)c2)CC3)CC1	1818622626	RLLPMVLFHVOBOP-YOEHRIQHSA-N	439.346	1.795	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)c3c[nH]c(=O)cn3)sc2C1	1821474063	IBOHYBUSCFBMNH-IUCAKERBSA-N	440.323	1.626	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)n(C)n1	1822412664	CBZNLKLVDYQJJC-OAHLLOKOSA-N	430.513	1.131	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H]2CCNC(=O)C2)n[nH]1	1822476506	CPBCUVQSSHIGLS-BZPMIXESSA-N	440.342	1.959	50	20	IDGD	
C=CCNC(=O)/C=C\C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1	1822998450	DICRASAPZYDOJE-VYOAUYJHSA-N	445.314	1.604	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)C1CC2(CCC2)C1	1823052971	APWFWASBPRCBRK-LJQANCHMSA-N	436.321	1.976	50	20	IDGD	
O=C(CCBr)N1CCC([C@@H]2CCCCN2C(=O)CN2CCOC2=O)CC1	1824331558	PKPKQOWCRWAWTD-HNNXBMFYSA-N	430.343	1.843	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)Cc1cccc(OC)n1)CC2	1825993615	LXMDZOFBDINBEV-CHWSQXEVSA-N	438.937	1.955	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2C=CCN2)CC1	1827552321	QNQSJPPGJMKKEZ-FMEPYYHXSA-N	440.548	1.268	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc(Cl)nc3)C2)C1	1830352548	PUZMSHHTFKXMPO-GOSISDBHSA-N	431.320	1.465	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(C#N)c[nH]2)CC1	1831873236	FENSNRXIRPQLKG-LJQANCHMSA-N	428.537	1.493	50	20	IDGD	
Cc1ccc(C(=O)N2CCC(N3CCC(NC(=O)[C@H](O)CCl)CC3)CC2)cc1F	1833313450	GWOWRLJOUWVZCT-LJQANCHMSA-N	425.932	1.919	50	20	IDGD	
Cc1cncc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)c1	1834285126	IRIHOYRKTYMOBP-RBUKOAKNSA-N	430.332	1.696	50	20	IDGD	
C[C@@H](C(=O)NC1CCN(C2CCN(C(=O)[C@H](F)Cl)CC2)CC1)n1cccc1C=O	1834806935	VGKQYWFETAMBFI-KSSFIOAISA-N	426.920	1.968	50	20	IDGD	
CC(F)(F)C(C)(C)C(=O)N1CCOC[C@]2(CN(C(=O)CCBr)CCO2)C1	1834819827	YHOVQJJVCNWPRH-KRWDZBQOSA-N	441.313	1.909	50	20	IDGD	
C[C@@H](C(=O)N1CCOC[C@]2(CN(C(=O)CCBr)CCO2)C1)n1cccc1	1834826836	YDGIGTZXASTIFK-YJBOKZPZSA-N	428.327	1.291	50	20	IDGD	
C[C@H](Oc1ccccn1)C(=O)N1CCC(N2CCC(NC(=O)[C@H](F)Cl)CC2)CC1	1835082768	DYJORTSVKYGIEH-KSSFIOAISA-N	426.920	1.955	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H]3C[C@H]4CC[C@@H]3O4)CC2)CC1)[C@@H](F)Br	1836414557	QPFOALGZYIDOJD-WCXIOVBPSA-N	446.361	1.816	50	20	IDGD	
O=C(c1n[nH]c2cc(Cl)ccc12)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1837085291	LNVLIMXNBQFAKA-MAUKXSAKSA-N	445.278	1.821	50	20	IDGD	
O=C(CCCCCCCCCCCl)N1CCO[C@]2(COCCN(C(=O)C(O)O)C2)C1	1839124192	SIHNJCGUJKKDKF-OAQYLSRUSA-N	448.988	1.503	50	20	IDGD	
O=C(CCc1ccccc1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839198216	XDLOPYOCMWXLIJ-PKOBYXMFSA-N	443.313	1.766	50	20	IDGD	
O=C(C[C@@H]1C[C@@H]2CC[C@H]1C2)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839202972	VHMOIBQXLYGDFT-LEVYEWFFSA-N	447.345	1.960	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccnc(C)n3)C2)C1	1839964016	CORLMJUJDLIHJJ-RDTXWAMCSA-N	441.326	1.029	50	20	IDGD	
Cc1ccsc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2	1840031662	YXXCRFBUROJJPF-DYVFJYSZSA-N	431.352	1.910	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CCC[C@@H](C(=O)OC)C1)CCO2	1840147010	GASXJQZJHLEJRM-GRXQJBFDSA-N	444.956	1.440	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2n[nH]c(C3CC3)c2F)C1	1842290953	LCHBGIJSVFOSNN-WYMPLXKRSA-N	441.467	1.377	50	20	IDGD	
COc1cccc(Cl)c1C(=O)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843015610	QPLSIBICZZQNMV-UHFFFAOYSA-N	428.681	1.159	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)[C@H](CN)c1ccccc1)C2	1843415834	SDIMRAONBSWUTO-CVLFLDGLSA-N	436.516	1.066	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H]2C[C@H]2C[C@@H]1C(=O)N1CCCC12CN(C(=O)[C@@H](O)CCl)C2	1847077856	VTWFTRZPIVGCKY-XQLPTFJDSA-N	427.929	1.187	50	20	IDGD	
O=C(CCC(=O)N1CCC(c2ccccc2)=N1)NNC(=O)c1nn(-c2ccccc2)cc1O	10159963	LQYYXLJECFWJCA-UHFFFAOYSA-N	446.467	1.756	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)c1ccc2c(c1)C[C@@H](c1ccccc1)OC2=O	10302008	RAQVLJPAWBLRTE-YJBOKZPZSA-N	428.466	1.337	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	14379241	UUPFKEHMZYHZMT-UHFFFAOYSA-N	431.514	1.874	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)CCn2c(=O)oc3cc(Cl)ccc32)cc1	19160943	BPDFLQBLSMBUDW-UHFFFAOYSA-N	431.832	1.951	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCCC(=O)NNC(=O)c2ccc3ccccc3n2)cc1	21007655	RTDRUEWIVZAIJG-UHFFFAOYSA-N	442.497	1.763	50	20	IDGD	
CNS(=O)(=O)c1ccc(CCC(=O)NNC(=O)c2ccc(Cl)cc2OC)cc1	21027355	DLYRDIIFDCZPDH-UHFFFAOYSA-N	425.894	1.651	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)Cn1c(=O)oc2ccccc21	26633904	HZOXFLNBTNTPOY-LLVKDONJSA-N	434.246	1.972	50	20	IDGD	
CON(C)S(=O)(=O)c1cc(C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)ccc1Cl	27743163	CDELUAKQJDLUGH-UHFFFAOYSA-N	442.837	1.505	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccccc2)ccc1OC(C)C	46643028	ASFUNQWGGKQQIM-UHFFFAOYSA-N	435.502	1.564	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cccc(N(C)C)c2)ccc1OCC(=O)NC(C)C	107840296	AXMBNDXPAPMLKQ-UHFFFAOYSA-N	428.489	1.739	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)CNS(=O)(=O)c1ccc(Cl)s1	116461607	ZWMCXOVATMDHHD-SECBINFHSA-N	435.886	1.434	50	20	IDGD	
CC(C)(C)OC(=O)N1CCCC[C@@H]1CNC(=O)NNC(=O)CNC(=O)c1cccs1	725872332	CJUDISUJICFZRA-CYBMUJFWSA-N	439.538	1.598	50	20	IDGD	
C[C@H]1CCC[C@@H](C)N1C(=O)COc1ccc(C(=O)NNC(=O)CN2CCCC2=O)cc1	726088271	VZZHWSXRHAXRPM-IYBDPMFKSA-N	430.505	1.238	50	20	IDGD	
CC(C)[C@@H](C(=O)NNC(=O)C1CCN(c2ncccn2)CC1)n1nnc(-c2ccccc2)n1	728846854	UASSBLUTWVEKDH-SFHVURJKSA-N	449.519	1.391	50	20	IDGD	
CCn1c(S)nnc1CNC(=O)CCC(=O)C(C#N)=C1N(C)c2ccccc2N1C	729252821	AFHLBAFAWGMAFW-UHFFFAOYSA-N	425.518	1.874	50	20	IDGD	
O=C(CCc1ccccc1O)NNS(=O)(=O)c1cccc(C(=O)NCC(F)(F)F)c1	729962983	QNQINWCEXGRRCS-UHFFFAOYSA-N	445.419	1.627	50	20	IDGD	
O=C(COC(=O)CCc1nc(-c2cccs2)no1)NNC(=O)c1cccc([N+](=O)[O-])c1	730002511	HZMFSAMQOSUOBM-UHFFFAOYSA-N	445.413	1.643	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)COc1ccccc1O)c1ccc(S(=O)(=O)N(C)C)cc1	730903716	PLGAZVGGVXDTTC-ZDUSSCGKSA-N	436.490	1.113	50	20	IDGD	
COc1ccc(C(=O)N2CCN(C(=O)NNC(=O)c3ccccc3OC)CC2)c(OC)c1	731499873	MOZRCZXFTFTFFU-UHFFFAOYSA-N	442.472	1.525	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)c1	732050278	QMRNCGPQZLCIMH-AWEZNQCLSA-N	432.458	1.796	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN1C(=O)OCC(F)(F)F)c1cnn(-c2ccccc2)c1	733106824	MEDKOIVAAJDTDD-AWEZNQCLSA-N	425.367	1.797	50	20	IDGD	
O=C(NNC(=O)N1CCN(C(=O)Cc2ccccc2)CC1)c1cnn(-c2ccccc2)c1	733350264	TWSYICOVELAAQH-UHFFFAOYSA-N	432.484	1.614	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)NCc3cc(S(N)(=O)=O)ccc3F)n[nH]2)cc1	734673904	PDFNYLYVPVFBKT-UHFFFAOYSA-N	446.464	1.316	50	20	IDGD	
Cc1ccccc1[C@H](C)CC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	734767696	BKMZCKACAJKDLP-QGZVFWFLSA-N	445.541	1.971	50	20	IDGD	
COCCN(CCOC)S(=O)(=O)c1ccc(C(=O)NNc2ccc(Cl)nn2)cc1	735688916	GGEWOVOKNBMGPR-UHFFFAOYSA-N	443.913	1.170	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)CCc2cc(Cl)cs2)CC1	736682957	KISVTJAKOOMOAM-UHFFFAOYSA-N	443.982	1.809	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)nn1	737767027	ONOJMNWKTZTMHR-UHFFFAOYSA-N	430.424	1.318	50	20	IDGD	
CS(=O)(=O)[C@H]1CCC[C@H](NC(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)C1	741093541	SZFYPNSMUACULD-AAEUAGOBSA-N	443.469	1.962	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@H]2CCCN(C(=O)NCC(C)C)C2)cc(OC)c1OC	741171937	CKXKOZOHCOKWRP-AWEZNQCLSA-N	436.509	1.551	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)C[C@H]2CN(Cc3ccccc3)CCO2)cc1	741346870	MXNBNRUBKVIBTR-FQEVSTJZSA-N	425.485	1.590	50	20	IDGD	
NS(=O)(=O)c1ccc(CCC(=O)NNC(=O)NCc2cccc(C(F)(F)F)c2)cc1	742458148	VGZQGAFILGIECT-UHFFFAOYSA-N	444.435	1.816	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc2c(c1)nc(CCC(=O)NNc1ccc(Cl)nc1)n2C	743819141	CCUXZJYAZDGTEC-UHFFFAOYSA-N	436.925	1.948	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)CN2C(=O)N[C@@](C)(c3ccc(F)cc3)C2=O)cc1	743826644	LECAEGXWSUOIPG-NRFANRHFSA-N	442.451	1.512	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)CSc2nnc(C3CCCCC3)n2N)c1	744515653	HZHJPHLFUQYGBF-UHFFFAOYSA-N	446.533	1.445	50	20	IDGD	
N#Cc1ccc(F)c(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1	745892860	HKOVSMBSGQHNHL-UHFFFAOYSA-N	445.476	1.626	50	20	IDGD	
CN(C)CCN1C[C@H](C(=O)NNC(=O)c2ccc(Br)cc2Cl)CC1=O	746218308	VZDMVTFRYAEOON-SNVBAGLBSA-N	431.718	1.274	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)[C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)c1	746306354	CIHGDBUFWWASII-CYBMUJFWSA-N	446.445	1.076	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN2CCCc3ccc(S(N)(=O)=O)cc32)cc1C	746462271	SRODIYGPBMWMSR-UHFFFAOYSA-N	436.559	1.480	50	20	IDGD	
CCNC(=O)NNC(=O)c1cc(S(=O)(=O)NCc2ccccn2)c(Cl)cc1Cl	747162479	WOHQDYLREVGRJI-UHFFFAOYSA-N	446.316	1.831	50	20	IDGD	
C[C@H](c1ccccc1)[C@@](C)(O)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	747348551	MWCPKFVWZUXSHT-OPAMFIHVSA-N	445.541	1.787	50	20	IDGD	
COc1cc(S(=O)(=O)NNC(=O)CNC(=O)c2cccs2)ccc1Br	747612725	UHAOWVCLZISLDR-UHFFFAOYSA-N	448.320	1.259	50	20	IDGD	
O=C(C[C@H]1CCS(=O)(=O)C1)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1	747787307	NCYAJFIGUDBTOW-NQIIRXRSSA-N	441.553	1.586	50	20	IDGD	
COc1cc(OC)cc(N2CC[C@@H](NC(=O)NNC(=O)CNC(=O)c3cccs3)C2)c1	748659485	AAYUUHIDWMLTTN-CYBMUJFWSA-N	447.517	1.104	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCC(=O)N(C)C1CCCCC1	748667308	VWGWNAGGZPBKRU-UHFFFAOYSA-N	438.554	1.023	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)c2cc3ccccc3o2)cc1S(=O)(=O)N1CCOCC1	749476752	CYCDAYBEHJMBDK-UHFFFAOYSA-N	443.481	1.837	50	20	IDGD	
O=C(CNC(=O)c1cccc([N+](=O)[O-])c1)NNc1nc(Br)cn2ccnc12	750248830	WMLLHQKXLWUQLB-UHFFFAOYSA-N	434.210	1.273	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)c1ccc(-n2ccnc2)nn1	750663936	RJZGYPULMSUECS-NSHDSACASA-N	431.250	1.653	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)c1cnn(-c2ccccc2F)c1C(F)(F)F	751201188	GJLZISJHKJYXHZ-UHFFFAOYSA-N	439.325	1.814	50	20	IDGD	
C[C@@H]1CCCCN1S(=O)(=O)c1cccc(C(=O)NNC(=O)CNC(=O)c2ccco2)c1	751206888	NXMISINNEVNXJW-CQSZACIVSA-N	448.501	1.034	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1occc1Br	751391393	IXNRGKFQXFQYOO-UHFFFAOYSA-N	430.280	1.820	50	20	IDGD	
C[C@H](NC(=S)NNC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(F)cc2)C1)C1CC1	751620694	XSFNAPVKMPEZNK-JSGCOSHPSA-N	428.555	1.520	50	20	IDGD	
Cn1c(NNC(=O)CCNS(=O)(=O)/C=C/c2ccccc2)nc2ccccc2c1=O	752905814	AUZWOKZYJXOAGO-WYMLVPIESA-N	427.486	1.357	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)[C@]23CCC(=O)N2c2ccccc2S3)c2ccccc2c1=O	754717085	KNFOMALFTLBJII-OAQYLSRUSA-N	435.465	1.324	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)NC2CCN(S(=O)(=O)C(C)(C)C)CC2)c1	755900274	PICWTWLBBNWDTL-UHFFFAOYSA-N	440.566	1.605	50	20	IDGD	
CC(C)c1cnc(NC(=O)C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)s1	756163558	JJSZSYWYUDUCRJ-UHFFFAOYSA-N	444.561	1.565	50	20	IDGD	
CCCS(=O)(=O)Nc1cccc(NC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1	756683695	GVEQXDAAYIWXGG-QGZVFWFLSA-N	434.474	1.831	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)Nc1ccc(S(=O)(=O)NCC2CC2)cc1	756785961	VXDVLXUPQLQTGS-UHFFFAOYSA-N	436.465	1.746	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)CN2C(=O)NC3(C[C@H](C)C[C@@H](C)C3)C2=O)c(C)c1	757732168	GYVKICDMKQJRDD-HUUCEWRRSA-N	429.521	1.609	50	20	IDGD	
CCN(CC)CCNC(=O)c1cc(NC(=O)NNC(=O)c2cc(C)[nH]n2)ccc1Cl	757757908	LDDVNBGAOQUAAR-UHFFFAOYSA-N	435.916	1.910	50	20	IDGD	
O=C(NCc1cccc(C(=O)OCc2ccccc2)c1)NNC(=O)C(=O)Nc1ccccn1	758748005	VCAQQGYZGKXXJE-UHFFFAOYSA-N	447.451	1.908	50	20	IDGD	
C[C@H]1CN(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)C[C@H](c2ccsc2)O1	759718210	KCPHMCQAKMERLL-SWLSCSKDSA-N	437.547	1.858	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)[C@@H]1CCCN(C(=O)COc2ccccc2)C1	760439759	KORZNUVYIAZIKX-MRXNPFEDSA-N	448.520	1.366	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)CCc1nc(O)c2c3c(sc2n1)CCC3	760449529	FURDHDYRWRRSDU-UHFFFAOYSA-N	449.533	1.880	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)CCNC(=O)[C@@H]2CCCN2C(=O)OC(C)(C)C)cc1	760793846	SAFQQXYNNRDKEE-KRWDZBQOSA-N	432.521	1.916	50	20	IDGD	
Cc1nn(CC(F)F)c(C)c1C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	760898100	RDAWLMXZXWOZNB-UHFFFAOYSA-N	443.476	1.543	50	20	IDGD	
Cn1c(=O)c2c(ncn2CCC(=O)NNc2ccnc3cc(Cl)ccc23)n(C)c1=O	761487904	DONZJNWHXLBSJB-UHFFFAOYSA-N	427.852	1.169	50	20	IDGD	
O=C(N[C@@H](Cc1ccccc1)C(=O)NNc1nccc(N2CCOCC2)n1)c1ccccc1	762869594	YTTHQJOFYKHXSW-FQEVSTJZSA-N	446.511	1.798	50	20	IDGD	
CCn1cnnc1-c1ccccc1NC(=O)C(=O)NNC(=O)c1ccc2ccccc2n1	763448998	BDXQNEXQKRVEKC-UHFFFAOYSA-N	429.440	1.913	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1C(=O)NC(C)C	763455431	SBBCKFQWRLHNFR-UHFFFAOYSA-N	427.417	1.441	50	20	IDGD	
Cc1nccn1-c1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)cn1	763603352	AMISNVVOCGTQAK-UHFFFAOYSA-N	430.428	1.366	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc([S@](C)=O)c(F)c2)c2ccccc2n1	763616024	SMGZSHRMUNVVQE-PMERELPUSA-N	428.445	1.819	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(F)cc2OCC2CC2)cc1	763660549	BLORWHVMAWHMFF-UHFFFAOYSA-N	431.420	1.788	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2ccc(O[C@H]3CCOC3)cc2)c1	763665090	DLUIQNAJFWLZLN-SFHVURJKSA-N	427.457	1.636	50	20	IDGD	
N#Cc1c(F)cccc1-n1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2F)n1	763678634	FRIXRUAFBRCKPX-UHFFFAOYSA-N	440.366	1.187	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)C(=O)Nc2c(F)cccc2F)c2ccccc2c1=O	763801414	RFUBKCHUMXRBKB-UHFFFAOYSA-N	443.410	1.875	50	20	IDGD	
CC(=O)Nc1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)ccc1Cl	763808105	VAECOUDYKOKNDG-UHFFFAOYSA-N	429.820	1.335	50	20	IDGD	
CC1CCN(c2ccc(C(=O)NNC(=O)CNC(=O)c3cccnc3)cc2[N+](=O)[O-])CC1	763814261	MFNWGBYTUCQRNL-UHFFFAOYSA-N	440.460	1.417	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1cc2c(cc1Cl)OCCO2	763864637	DSCUGGRIJILEIT-JTQLQIEISA-N	437.811	1.804	50	20	IDGD	
Cc1ccccc1-n1nccc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccccc1F	763864878	LSUCRKKWFIEJBH-CQSZACIVSA-N	425.420	1.873	50	20	IDGD	
COCCc1cc(NC(=O)C(=O)NNC(=O)c2ccc(-c3ccc(F)cc3)s2)n(C)n1	763975725	MMIDNELDZGQZKY-UHFFFAOYSA-N	445.476	1.876	50	20	IDGD	
CCNC(=O)c1ccc(C)c(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)on2)c1	764003176	BLNXZXAZDVFERA-UHFFFAOYSA-N	435.440	1.799	50	20	IDGD	
CC(C)C(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1	764004172	MAKHAZGOTZJPNO-UHFFFAOYSA-N	426.429	1.452	50	20	IDGD	
COc1ccc(S(=O)(=O)NC(C)(C)C)cc1NC(=O)C(=O)NNC(=O)C1CCCC1	764068634	MTZJYIAIVPWIDG-UHFFFAOYSA-N	440.522	1.048	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccc3ccccc3c2)cc1-n1cnnn1	764090608	DBBIAEXWGPEZSX-UHFFFAOYSA-N	445.439	1.153	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)N2CCc3cc(Br)cc(F)c32)c(O)c1	764111314	VRJCKHVUCOKBCY-UHFFFAOYSA-N	436.237	1.953	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cnn(-c3ccccc3)n2)o1	764138725	IRYLMUSZFHDUIS-UHFFFAOYSA-N	425.449	1.102	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(NC(=O)NCc3ccco3)cc2)cc1	764177116	JPIBLAQCDNSTKP-UHFFFAOYSA-N	446.423	1.873	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)C(=O)Nc2c3c(nn2C)CCC3)c1	764232505	PVBREILEYPPTDN-UHFFFAOYSA-N	436.266	1.080	50	20	IDGD	
Cc1cc(C(=O)NC(C)C)ccc1NC(=O)C(=O)NNC(=O)Cn1ccc2ccccc21	764243288	QWGJFHITUSCWSV-UHFFFAOYSA-N	435.484	1.874	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(OC(F)F)c2)cc1NC(C)=O	764259435	HOWPNQBCTFVRRO-UHFFFAOYSA-N	436.371	1.655	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)Cc3ccccn3)cc2F)C[C@@H](C)O1	764266792	LLLPAJBRYGPLCI-OKILXGFUSA-N	429.452	1.163	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)C(C)(C)c2ccccc2)cc1	764320499	IFVZCNJGLZAATL-UHFFFAOYSA-N	432.502	1.512	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C(=O)Nc1ccccc1S(=O)(=O)C(F)F)c1ccccc1	764331858	IUUFYEZPEIANCH-ZDUSSCGKSA-N	439.440	1.963	50	20	IDGD	
COC(=O)c1cc(C)ccc1NC(=O)C(=O)NNC(=O)c1cc(-c2cccs2)[nH]n1	764381885	BJCDSOIDOHPMPG-UHFFFAOYSA-N	427.442	1.633	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)cc1F	764382363	HYMNHQOVMYSGBS-UHFFFAOYSA-N	431.405	1.464	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)C(=O)Nc1ccc(Cl)cc1C(=O)N1CCCC1	764385824	LOGNHTCXEBHJNJ-UHFFFAOYSA-N	429.864	1.679	50	20	IDGD	
COc1cc(OC)c(NC(=O)C(=O)NNC(=O)CSc2ccccc2OC)cc1F	764394884	WIOYCUIUUWQICV-UHFFFAOYSA-N	437.449	1.730	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(OCC(F)(F)F)cn2)c1	765185163	KBGDUCUZIJYDHJ-UHFFFAOYSA-N	446.407	1.348	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3cccc(C(=O)N(C)C)c3)n[nH]2)cc1OC	765596203	GWRUZIVUOWCDNT-UHFFFAOYSA-N	437.456	1.871	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2cccnc2)c(I)c1	765699492	SZZBLKJYPRAPFU-UHFFFAOYSA-N	440.197	1.095	50	20	IDGD	
CN(C)CCS(=O)(=O)c1ccccc1C(=O)NNC(=O)c1cc(-c2ccccc2)[nH]n1	767163067	BJAUPGVXAAXHGU-UHFFFAOYSA-N	441.513	1.487	50	20	IDGD	
CCCCS(=O)(=O)c1ccc(C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)cc1	768906975	GLQLDLGSARAGMB-UHFFFAOYSA-N	443.481	1.750	50	20	IDGD	
CO[C@H](c1ccc(F)cc1)[C@@H](C)NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1	770768816	ALOVAWJDVBFVNG-KDOFPFPSSA-N	430.484	1.939	50	20	IDGD	
CNS(=O)(=O)c1ccc2c(c1)N(C(=O)C(=O)NNc1c(F)cccc1Cl)CC2	770810812	CPBCAVWEBCVPBX-UHFFFAOYSA-N	426.857	1.420	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)c2ccc(-c3nc[nH]n3)cc2)CC1	771367546	FLCZBXZSGWUDAJ-UHFFFAOYSA-N	429.481	1.815	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3ccc(-c4nc[nH]n4)cc3)CC2)cc1	771416998	VQNRAFHHFKBZMA-UHFFFAOYSA-N	433.516	1.359	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)[C@@H](CC(C)C)N1C(=O)[C@H]2CC=CC[C@H]2C1=O	771851708	CJMJQHVOSRDNNX-MWDXBVQZSA-N	435.521	1.478	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)[C@@H](O)Cc2ccccc2Cl)c2ccccc2c1=O	771881383	HWGNOZWTZIXGHG-KRWDZBQOSA-N	428.876	1.825	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)[C@@]12CCC(=O)N1c1ccccc1C(=O)N2CC(C)C	771970007	QQHISKWBYNKYTM-RCDICMHDSA-N	444.488	1.111	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)N1CCc2sc(Br)cc2C1	771980587	PJBMLWRQDOEEDD-UHFFFAOYSA-N	427.280	1.633	50	20	IDGD	
CCOC[C@@H](C(=O)OC)N(C)C(=O)CCC(=O)C(C#N)=C1N(C)c2ccccc2N1C	772709222	TWHUDRJYKKQFSB-SFHVURJKSA-N	428.489	1.694	50	20	IDGD	
CCc1ccc(C(=O)NNS(=O)(=O)c2ccc(CCNS(=O)(=O)CC)s2)cc1	773234501	QDDMVXZYPXAEMY-UHFFFAOYSA-N	445.588	1.416	50	20	IDGD	
C#CCOc1ccccc1NC(=O)C(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12	773495317	ZPQHLUXIDDKAAH-UHFFFAOYSA-N	447.451	1.389	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cccc4cc[nH]c34)n[nH]2)cc1OC	773496016	JBDNRGWZCQVKNL-UHFFFAOYSA-N	448.439	1.975	50	20	IDGD	
O=C(NNc1cnc2ccccc2n1)C(=O)Nc1ccc(S(=O)(=O)NC2CC2)cc1	773717604	BQNAMWTZFFYXCF-UHFFFAOYSA-N	426.458	1.152	50	20	IDGD	
CC(=O)N(C)c1ccccc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1cccc(Cl)c1	774007530	BHIGBTLJPLVRPE-LBPRGKRZSA-N	432.864	1.876	50	20	IDGD	
O=C(CCSc1ccc(F)cc1)NNC(=O)N[C@@H]1CCO[C@@]2(CCS(=O)(=O)C2)C1	776077185	SFRRRJJNBHMPII-KDOFPFPSSA-N	445.538	1.375	50	20	IDGD	
Cc1ccc(S(=O)(=O)C[C@H](C)NC(=O)NNc2ccccc2S(C)(=O)=O)cc1	776190437	ASNUQGMZYNPPDJ-AWEZNQCLSA-N	425.532	1.887	50	20	IDGD	
CCOc1ccccc1[C@](N)(C(=O)NNC(=O)[C@H]1COc2ccccc2O1)C(F)(F)F	776318189	QNFKSJLOHNKFQL-APWZRJJASA-N	439.390	1.789	50	20	IDGD	
COCCO[C@@H]1COCC[C@@H]1NC(=O)NNC(=O)[C@H](C)Oc1ccc2ccccc2c1	777278933	LJOIARRHZTZEAX-RYGJVYDSSA-N	431.489	1.758	50	20	IDGD	
COc1ccc2nc(NNC(=O)CCN3CCN(C(=O)[C@@H]4CCCO4)CC3)c(C)cc2c1	778478327	CRSJSMFWPGTADN-FQEVSTJZSA-N	441.532	1.708	50	20	IDGD	
O=C(NNC(=O)[C@@H](O)Cc1cccc(C(F)(F)F)c1)C1CCN(c2ncccn2)CC1	778723915	HCDGVOQTXUKNTL-INIZCTEOSA-N	437.422	1.463	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)nc1Br	781971475	ALKIGEGHSYBRRW-UHFFFAOYSA-N	432.275	1.321	50	20	IDGD	
CN(C)C(=O)COc1cccc(NC(=O)C(=O)NNc2ccc(Br)cc2)c1	783008877	ACFZJOIPJZXVGC-UHFFFAOYSA-N	435.278	1.998	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NCc2ccc(N3CCOC3=O)cc2)cc1	783022806	YPEWOBFFPMQNMJ-UHFFFAOYSA-N	447.473	1.583	50	20	IDGD	
O=C(NNc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1ccccc1CN1C(=O)CCC1=O	783291658	NXONMRGDWJIBHY-UHFFFAOYSA-N	445.819	1.979	50	20	IDGD	
Cc1ccc(-n2nc(C)cc2NC(=O)C(=O)NNc2ccc(Cl)cc2[N+](=O)[O-])nn1	783291858	RDVBROIZJOFVOY-UHFFFAOYSA-N	430.812	1.923	50	20	IDGD	
CCN1CCN(C(=O)c2ccc(NC(=O)C(=O)NNc3ccc(F)cc3F)cc2)CC1	783340809	WVHLGOIARLLCMY-UHFFFAOYSA-N	431.443	1.824	50	20	IDGD	
O=C(NNc1ccc(F)cc1F)C(=O)Nc1cccc(Cn2nc3ccccn3c2=O)c1	783343021	SPVPNTFKCFFLQB-UHFFFAOYSA-N	438.394	1.904	50	20	IDGD	
CCCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NN=c2sc3ccccc3n2C)cc1	783350054	VBWRBDUYXPXSDD-UHFFFAOYSA-N	447.542	1.962	50	20	IDGD	
Cn1c(=NNC(=O)C(=O)Nc2ccc(N3CCOCC3)c(F)c2)sc2ccccc21	783352506	WRMMAJKTSHINJI-UHFFFAOYSA-N	429.477	1.786	50	20	IDGD	
Cc1ccc(C)c(NNC(=O)C(=O)Nc2ccc(C(=O)NCCN3CCOCC3)cc2)c1	783361280	CHROFUWZFUTJAQ-UHFFFAOYSA-N	439.516	1.447	50	20	IDGD	
COCCn1ncc2ccc(NC(=O)C(=O)NNc3ccc(Br)cn3)cc21	784339944	PKXLYLCIXMBYET-UHFFFAOYSA-N	433.266	1.922	50	20	IDGD	
C[S@](=O)c1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)cc1F	784832696	DHAQCXZVXZJSNV-NDEPHWFRSA-N	449.432	1.641	50	20	IDGD	
O=C(NNc1ccnc(F)c1)C(=O)Nc1ncn(Cc2cccc(Br)c2)n1	784848155	DGFZYRLJMBNCJK-UHFFFAOYSA-N	434.229	1.705	50	20	IDGD	
Cc1ccc(CNC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c(-n2cc(Cl)cn2)n1	786835081	YJQOCKFGLMFZIW-KRWDZBQOSA-N	442.863	1.900	50	20	IDGD	
Cc1ccc(NC(=O)NNc2cc(Cl)nc(N)n2)c(C)c1S(=O)(=O)NC1CC1	789106739	LFZXVHMKWNCWSH-UHFFFAOYSA-N	425.902	1.918	50	20	IDGD	
O=C(NNc1nc2ccccn2n1)Nc1ccc(N2CCOCC2)cc1N1CCOCC1	792210275	KOLVILVTZGBNEU-UHFFFAOYSA-N	438.492	1.551	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc(Cl)c1F	792263897	DUXSZRAWYQUFCH-UHFFFAOYSA-N	438.755	1.574	50	20	IDGD	
CCn1c(=O)nc(O)c2c(C(=O)NNC(=O)Cc3ccccc3OC)cc(C(C)C)nc21	792799188	XJOBYQSVEDRTQY-UHFFFAOYSA-N	439.472	1.653	50	20	IDGD	
O=C(CC(F)(F)F)NNC(=O)C(=O)Nc1ccc2c(c1)N(CC(F)F)CCS2	793024584	DPVVNNYFGACFOW-UHFFFAOYSA-N	426.367	1.902	50	20	IDGD	
CCOc1ccc(C(=O)NNS(=O)(=O)c2cc(C(=O)O)c(F)cc2C)cc1OC	793350156	FOJUGEBKPDFOHO-UHFFFAOYSA-N	426.422	1.863	50	20	IDGD	
Cc1nn(C(C)C)c(C)c1CC(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	794392901	JWXGSUAXXIPUMD-UHFFFAOYSA-N	440.548	1.229	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)CCN(C)C(=O)OC(C)(C)C	794779166	DYKNVDGWAZPDKS-UHFFFAOYSA-N	427.527	1.306	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(C(=O)NNc2ccccc2S(=O)(=O)N(C)C)cc1	795182321	SXLVASUPTIEWKR-UHFFFAOYSA-N	440.547	1.381	50	20	IDGD	
COC(=O)c1cc(F)cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)c1F	796991023	YRFOCBJJDLINRK-VIFPVBQESA-N	439.346	1.444	50	20	IDGD	
O=C(CCCc1ccccc1)NNC(=O)C(=O)Nc1ccc(F)c(N2CCOC2=O)c1	797004852	NWNIEKLDGUOMOG-UHFFFAOYSA-N	428.420	1.891	50	20	IDGD	
CNC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)c2cccc3ncccc23)c(C)c1	797006257	IZQZMAHAFHVJLE-UHFFFAOYSA-N	435.440	1.068	50	20	IDGD	
Cc1ccc([C@H](NCC(=O)NNC(=O)c2cccc(C#N)c2)[C@H](C)S(C)(=O)=O)cc1	797997552	NAPKIRFEPSBBTG-MGPUTAFESA-N	428.514	1.392	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)/C(=C\c2ccc(F)cc2)n2nnnc2C)cc1C	798307606	AOPQLROGEORJJH-WOJGMQOQSA-N	437.435	1.522	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)[C@@H](C)NC(=O)CCc2ccccc2)n[nH]1	799422870	KYBRBFDEFVYWND-OAHLLOKOSA-N	435.484	1.984	50	20	IDGD	
O=C(N=c1cc[nH]cc1)NNC(=O)c1ccc(S(=O)(=O)NCc2cccs2)cc1	802034043	YEPHDMOBWGBOOI-UHFFFAOYSA-N	431.499	1.510	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@@H](c2ccccc2)N2CCCCC2=O)cc1	802068024	WVMLJKJDUXDUJG-LJQANCHMSA-N	444.513	1.997	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(F)c(N3CCCNC3=O)c2)c1	806974108	UYOKGRIJJFIXPJ-UHFFFAOYSA-N	442.451	1.211	50	20	IDGD	
Cn1c(=NNC(=O)C(=O)Nc2ccc(F)c(N3C(=O)CCC3=O)c2)sc2ccccc21	806997099	DPAFCNLJDSKAFT-UHFFFAOYSA-N	441.444	1.603	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)c1cccc(-c2cnc3nc(O)n(C)c3c2)c1	807370364	FRIVMVIKGOJCOL-UHFFFAOYSA-N	427.461	1.891	50	20	IDGD	
Cn1c(COC(=O)/C(C#N)=C\c2cn(CCC#N)nc2-c2ccccc2)cc(=O)n(C)c1=O	808433514	KMLWIFITNNNXMU-BOPFTXTBSA-N	444.451	1.512	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc4c(c3)C(=O)OC4)n[nH]2)c1	808938908	HDBVMYXLZVFGJY-UHFFFAOYSA-N	433.424	1.764	50	20	IDGD	
O=C(CN1CCC(NS(=O)(=O)c2cccs2)CC1)NNC(=O)c1cccs1	809931503	LWHWZKKYWAFFLK-UHFFFAOYSA-N	428.561	1.014	50	20	IDGD	
CC(=O)N1C[C@@H]2CCC[C@H](NC(=O)NNc3ccc(S(=O)(=O)NC(C)C)cn3)[C@H]2C1	812432102	BLVZPBKQJCMOTD-XIRDDKMYSA-N	438.554	1.041	50	20	IDGD	
Cc1noc2nc(C3CC3)cc(C(=O)OCC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)c12	812875918	YPQDUSHRGYWSBQ-UHFFFAOYSA-N	439.384	1.935	50	20	IDGD	
O=C(CCc1ccc2ccccc2n1)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	813487394	HUYSOBAHGMGHLZ-UHFFFAOYSA-N	445.523	1.773	50	20	IDGD	
CNC(=O)c1cc(Oc2cccc(NC(=O)C(=O)NNc3cc(C)nc(C)n3)c2)ccn1	815587920	XJMAEMKUKPQUDE-UHFFFAOYSA-N	435.444	1.722	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CCN2C(=O)CCNC2=S)ccc1OCCC(C)C	816828497	HJJHLHJAQZVYQP-UHFFFAOYSA-N	436.534	1.378	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)CN2C(=O)N[C@@](C)(c3ccc(C)cc3)C2=O)c1	825781372	BMEUGQHIFXUERT-QFIPXVFZSA-N	439.472	1.030	50	20	IDGD	
Cc1ccc([C@@]2(C)NC(=O)N(CC(=O)NNC(=O)COc3cc(C)ccc3C)C2=O)cc1	864002246	VBEXEVRIDLSLMK-HSZRJFAPSA-N	438.484	1.605	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(OC)c(C(=O)NNC(=O)COc2ccc(C)cc2)c1	915060423	CNCDGJSJRHYZAO-UHFFFAOYSA-N	449.529	1.874	50	20	IDGD	
COC(=O)Cc1cc(=O)n(-c2ccc(C(=O)NNC(=O)COc3ccc(C)cc3)cc2)[nH]1	915190577	JCVRWQGULDNAQB-UHFFFAOYSA-N	438.440	1.030	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)NC[C@@H](c2ccc(C)o2)N2CCOCC2)c1	916229683	UVZPREMXQASILL-SFHVURJKSA-N	430.505	1.988	50	20	IDGD	
CC(C)CN1CCC(NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)CC1	916250414	CLLMXFQGWPSQCU-UHFFFAOYSA-N	430.597	1.650	50	20	IDGD	
CN1CCN(C(C)(C)CNC(=O)NNC(=O)COc2ccc(Br)cc2)CC1	916258836	JFQGYISRNQJWPN-UHFFFAOYSA-N	442.358	1.184	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NN=Cc2cc(Cl)cc([N+](=O)[O-])c2O)c1	916305762	SFBZDKFRJZMLIR-UHFFFAOYSA-N	426.838	1.968	50	20	IDGD	
CCN1CCN(Cc2ccccc2CNC(=O)NNC(=O)COc2ccccc2F)CC1	916420156	RITJKDFNNDKSFQ-UHFFFAOYSA-N	443.523	1.873	50	20	IDGD	
COc1ccc(CNC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1F	916594766	SOIVVPJPWCFADT-UHFFFAOYSA-N	429.496	1.877	50	20	IDGD	
O=C(CCCNS(=O)(=O)c1cccc(C(F)(F)F)c1)NNC(=O)CC(F)(F)F	918363817	DFWJGIODBPGFFU-UHFFFAOYSA-N	435.346	1.864	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)NCCN2CCN(C(=O)OC(C)(C)C)CC2)cc(C#N)n1C	918649229	YVKIWCMFFOBFBV-PDGQHHTCSA-N	426.521	1.781	50	20	IDGD	
O=C(NCc1ccc(N2CCOCC2)cc1)NNC(=O)c1nn(-c2ccccc2)cc1O	919790170	OEIDIHLSMGGNCZ-UHFFFAOYSA-N	436.472	1.559	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)NCCCN1CCN(C(=O)OC(C)(C)C)CC1	919908367	GPEHATRSMIWHDB-UHFFFAOYSA-N	449.552	1.511	50	20	IDGD	
O=C(CCOc1ccc(Cl)cc1Br)NNC(=O)[C@@H]1CCS(=O)(=O)C1	921275338	BZECZWIPHGHTNI-SECBINFHSA-N	439.715	1.454	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(OC[C@H]2CCOC2)c(F)c1)c1n[nH]c2c1CCCC2	1116610593	XFMJWKJLFHZPDL-LBPRGKRZSA-N	438.481	1.466	50	20	IDGD	
C[S@](=O)Cc1ccc(CNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1	1117359329	IPXKJYVHNVBVQJ-PMERELPUSA-N	430.534	1.102	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(\C#N)C(=O)N2CCN(C(=O)N3CCOCC3)CC2)c1C	1317982400	UAMLIFWSZCAMIN-SXZORUHJSA-N	443.548	1.816	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2ccc(C(=O)O)cc2OC(F)(F)F)cc1	1321880428	RXAQAWJEWUXKSW-UHFFFAOYSA-N	434.348	1.915	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](C(=O)NNc1c(F)cc(C(=O)NC2CC2)cc1F)C(C)(C)O	1330138841	YJBSCWZRHFUOQL-OAHLLOKOSA-N	442.463	1.964	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)NNC(=O)[C@H]1CS[C@@H](Cc2ccccc2F)C(=O)N1	1337242076	IJUMSJXHKKQIDN-MOPGFXCFSA-N	440.500	1.840	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc4n(n3)CCCO4)C2)C1	1778555526	CXVZOQNXYCPUPS-ROUUACIJSA-N	431.320	1.345	50	20	IDGD	
O=C(CCN1CCOC1=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCBr)C2	1778778981	CFCPTDYPBMAHSX-RDTXWAMCSA-N	446.342	1.128	50	20	IDGD	
COc1ccc(CC(=O)N2CCO[C@@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)cc1O	1779294441	GDBZPLLUTRCXKK-OAQYLSRUSA-N	436.581	1.625	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccc3c(c1)NC(=O)CC3)CCO2	1779299396	SBBMBQSQCYBGRX-JOCHJYFZSA-N	445.592	1.866	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(CO)on1)C2	1779546879	VTHHFQLVPFWXGB-VQIMIIECSA-N	425.558	1.146	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccnnc2O)C1	1779966561	OVIYCSKIHJSYJE-CJBNDPTMSA-N	427.299	1.093	50	20	IDGD	
CN(C)c1cccc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](F)Br)C3)C2)c1	1781334173	MNXZIMDRNSZNDX-YJBOKZPZSA-N	428.302	1.887	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)Cc3c(C)n[nH]c3C)C2)C1	1781433618	PKSSWXPYSCBFIT-MAUKXSAKSA-N	427.343	1.572	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1ccn(C)n1)C2	1781900765	SEGZXGIDRFGPLE-FRQCXROJSA-N	441.370	1.650	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(CCN(C(=O)[C@H]3CC(c4ccccc4)=NN3)C2)C1	1782602020	YHOZQDADKGXLND-XLIONFOSSA-N	449.349	1.368	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc4nncn4c3)CCO2)C1	1783349525	MXQLPAWFAXLAEL-KDOFPFPSSA-N	436.310	1.346	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)CCCn3ccnc3C)CCO2)C1	1783354717	VBEMFQUIFRCEGA-LPHOPBHVSA-N	441.370	1.975	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H]1CCc3ccoc3C1)CCO2	1783530168	UIBZTHADXUYHII-ZBQZNYHESA-N	425.323	1.998	50	20	IDGD	
CSCC[C@H](O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]2C1	1783973462	AYFXYGJHUQDYFR-YTFOTSKYSA-N	437.400	1.111	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C3=NO[C@H](c4ccccc4)C3)C[C@@H]21)[C@@H](O)CCl	1784092200	JLYSDFNZEVOMSM-FQQAFBJJSA-N	435.908	1.083	50	20	IDGD	
C[C@@H](Cn1cccn1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21	1785437731	OUOVTNPXMJKVRU-VGWMRTNUSA-N	427.343	1.284	50	20	IDGD	
Cc1ccn2c(=O)c(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)[C@H](F)Cl)C[C@@H]43)cnc2c1	1788040226	SXXWPSQFEMCVEV-QEWYBTABSA-N	436.871	1.131	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccnc4c3OCO4)[C@H]2C1	1789182277	WEYANYHWSZLHIH-BPUTZDHNSA-N	435.553	1.255	50	20	IDGD	
CCc1ncsc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21	1789408965	RZTYDRKFHUBXLQ-JYYRZZBQSA-N	434.331	1.989	50	20	IDGD	
CC(=O)O[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]2C1)C(C)C	1789925709	HQFFTDKZJIUIAJ-LXFSFDBISA-N	437.306	1.244	50	20	IDGD	
O=C(NC1(c2ccc(NC(=O)[C@H](F)Br)cc2)CCC1)c1ccc(B(O)O)cc1	1790534156	ASCNDHJQNIEDOQ-INIZCTEOSA-N	449.085	1.805	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21)[C@@H]1CC(c2ccccc2)=NN1	1790546763	IIEIBQLUPWAJII-OTRWWLKZSA-N	439.343	1.536	50	20	IDGD	
C[C@@H](Cc1ccc(F)cc1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21	1790722418	BMXZPIKHXWKOCA-SKMQDVENSA-N	426.916	1.584	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc([N+](=O)[O-])o3)C[C@@H]21	1790961283	KCTFMZHKNDIBPT-FMSGJZPZSA-N	444.282	1.955	50	20	IDGD	
COc1cc(F)cc(/C=C/C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](O)CCl)C[C@@H]32)c1	1791147915	DHAOZOIQYXMFRG-KQOGDJKHSA-N	440.899	1.427	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(-n4cccn4)cc3)C[C@@H]21	1791256900	LGARMEMEXKNNDY-LEAZDLGRSA-N	446.935	1.719	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnn(-c4cccnc4)c3)C[C@@H]21)C(Cl)Cl	1791294274	SKIBPRPQLGKNOR-RCBQFDQVSA-N	438.315	1.664	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)CBr	1792867671	FUPLCGVWBRVONY-FAYQHZLMSA-N	449.349	1.877	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc3ccccc3n1)C2	1792868376	WCEWTSOPEYEZFP-ZUMXRPEOSA-N	447.333	1.864	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc3cccc(Cl)c3c1)C2)[C@H](O)CCl	1792984127	TYDHOJOYNSBNEF-JGTCGTHISA-N	438.311	1.691	50	20	IDGD	
C[C@H](CBr)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(C(=O)O)ncn1)C2	1792988929	IYDQZLLWAQTLRP-WISYIIOYSA-N	425.283	1.458	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3sccn3c1)C2	1795112828	QPEKWHKZEUHAOM-YWVIFJGQSA-N	426.336	1.989	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)c1cc2c(s1)CCCC2	1796191382	FVJITEODPPJHJA-REPLKXPHSA-N	438.358	1.872	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1ON=C(c3ccccc3)O1)C2	1797956844	GIDRASDBNSVWCZ-VWFIUDSGSA-N	447.564	1.162	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2cc(F)ccc2[nH]1	1797997117	UJLLILOETHMZNZ-BJWYYQGGSA-N	429.496	1.932	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccnn1	1798056712	MDZKDFSXDAITKP-AOWDBCOTSA-N	439.422	1.565	50	20	IDGD	
C[C@H](Sc1ccccn1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2	1801318147	FOAKQAIQSKFKQK-ZZVJUGKHSA-N	446.342	1.842	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C(Cl)Cl)[C@@H]1CCc2nc(O)nc(O)c2C1	1802341428	FHZMCDODKRKTHC-CHWFTXMASA-N	429.304	1.435	50	20	IDGD	
CC(C)c1nc(CC(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)no1	1804404639	AJAQOXVBQWVVJE-MPGHIAIKSA-N	435.912	1.436	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@H](CNC(=O)Cc2cncnc2)[C@H]1c1cccnc1	1804649266	QJIOGLHIRFXRDV-GHTZIAJQSA-N	427.581	1.972	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC2(CCCN(C(=O)[C@@H]3CCCCO3)C2)CC1	1804951806	RKCLAMAJFUCMLB-HLNOYYKJSA-N	443.548	1.921	50	20	IDGD	
O=C(Cc1ccsc1)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1807559769	PNFSQNLNCZUSJF-KNQAVFIVSA-N	449.341	1.385	50	20	IDGD	
C[C@H](CN)C(=O)N1CCCC2(CCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CC2)C1	1809643697	JTYCZQLGLMSHAM-CVEARBPZSA-N	445.004	1.945	50	20	IDGD	
Cc1ccc(C(=O)N2CCC3(CCCN(C(=O)c4cccc(B(O)O)c4)C3)CC2)nc1C	1809975015	NSYXQRHUCWENPG-UHFFFAOYSA-N	435.333	1.537	50	20	IDGD	
Cc1cc(C#N)cc(C(=O)N2CCC3(CCCN(C(=O)c4cccc(B(O)O)c4)C3)CC2)c1	1809980931	ZTARNLYYFDWRLV-UHFFFAOYSA-N	445.328	1.705	50	20	IDGD	
Cc1nocc1C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1	1810297416	CBDDMJDZIVLWCE-BEFAXECRSA-N	449.471	1.010	50	20	IDGD	
Cc1cc(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)ccn1	1810786058	ANAQYJOCHGVBNA-RBBKRZOGSA-N	444.300	1.098	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2c(O)cc(O)cc2O)[C@H]1c1cccnc1	1813034499	NXKZISLCDGVYHC-RFUYNDQBSA-N	449.891	1.772	50	20	IDGD	
Cc1cccc(CC(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2cccc(B(O)O)c2)CC3)c1	1813906625	AALCFHZVKVYICP-GOSISDBHSA-N	449.341	1.600	50	20	IDGD	
CCS(=O)(=O)N[C@@H](C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)C(C)(C)CCl)n[nH]1	1814695611	ZDTZSMVCWMJODJ-GXTWGEPZSA-N	447.989	1.995	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cncn2-c2ccncc2)[nH]n1)[C@@H](O)CCl	1814869220	LVUWRZZBYQHMMA-WBVHZDCISA-N	443.895	1.896	50	20	IDGD	
O=C1NCc2cc(C(=O)N3CCCC[C@@H]3c3cc(NC(=O)[C@@H](O)CCl)n[nH]3)ccc21	1814872369	HINBJRRQMHFOMC-CVEARBPZSA-N	431.880	1.559	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(F)s1)CC2)c1ccc(B(O)O)cc1	1815336833	FSMAQQFNZSKPJV-LBPRGKRZSA-N	445.306	1.563	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)Cn3ccnn3)sc2C1	1815783023	NTQIVQKXSTWABN-VHSXEESVSA-N	427.328	1.520	50	20	IDGD	
Cc1cnc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)s1	1816285821	VXGUFTIISJUNSP-AWEZNQCLSA-N	433.538	1.854	50	20	IDGD	
C[C@H](CS(C)(=O)=O)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCBr)n[nH]1	1816781183	FXOQELDWFOMJBZ-YPMHNXCESA-N	449.371	1.868	50	20	IDGD	
CS(=O)(=O)CC(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](F)Br)[nH]n1	1817057430	VUCUHJLJYRPREJ-CABZTGNLSA-N	425.280	1.137	50	20	IDGD	
O=C(CS[C@@H]1CCCCO1)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](O)CCl)CC2	1819860241	DXNYYJXKRQOPHQ-JVLSTEMRSA-N	433.983	1.915	50	20	IDGD	
O=C(Cc1cncnc1)N[C@@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1	1823001762	LQMFQRVFRYVLEV-RNCFNFMXSA-N	428.287	1.778	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)CN(C)C(=O)C(=O)O)sc2C1	1824668712	ZUGPKOWRFQLZHH-UWVGGRQHSA-N	430.914	1.006	50	20	IDGD	
CC(=O)N(C)CCC(=O)N[C@H]1CCc2nc(NC(=O)[C@H](C)Br)sc2C1	1825635774	KLAXYUSFWUJKKC-ONGXEEELSA-N	431.356	1.707	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC([C@H]2CCCCN2C(=O)CCc2nc(N)n[nH]2)CC1	1828807149	MSWXSHVJNMHPLH-MRXNPFEDSA-N	436.633	1.791	50	20	IDGD	
C[C@H](C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2)N1C[C@H]2C[C@H]2C1	1830362002	IFIGXRPKEICFIP-VWXURSGXSA-N	427.973	1.048	50	20	IDGD	
Cc1oc(C(C)(C)C)cc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1830725919	SPYDTIXEZLWTTA-IIBYNOLFSA-N	442.940	1.555	50	20	IDGD	
Cc1nccn1CC(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1	1831185934	NRTJXEFEPSJZPB-LJQANCHMSA-N	432.569	1.184	50	20	IDGD	
CCO/C=C/C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1	1832049266	KVUKPNICQZVDKP-CECLQJIQSA-N	429.521	1.469	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@H](C)n2cnnn2)CC1	1832287916	SYNFMGYZVDWUSF-IJEWVQPXSA-N	441.374	1.885	50	20	IDGD	
C[C@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)CC3(O)CCC3)CC2)CC1	1833266210	UZVSCBKKCDAPBF-OAHLLOKOSA-N	444.414	1.894	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)Cc3cnc4ccccn34)CC2)CC1)[C@H](O)CCl	1833306003	IQOYQLFAAJDOHQ-LJQANCHMSA-N	447.967	1.048	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cccn4ccnc34)CC2)CC1)[C@H](O)CCl	1833310723	ZAIQAZGEDMFGOW-GOSISDBHSA-N	433.940	1.119	50	20	IDGD	
CCc1nn(C)c(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)c1Cl	1833593555	SOYOLOWPMVTZDO-RHSMWYFYSA-N	437.299	1.240	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3cn(C)cn3)CC2)CC1	1834287762	UDCIJZDMWDHXMK-INIZCTEOSA-N	440.386	1.779	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(F)cn3)CCO2)C1	1834480914	VCZPBNUFMCAPAM-YVEFUNNKSA-N	430.274	1.074	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)[C@@H]3C=CCN3)CC2)CC1	1835048322	IBJTYSNCIGSUAC-PBHICJAKSA-N	427.387	1.117	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)C#Cc3ccccc3)CCO2)C1	1835096909	NXBASIIXJORIKV-UTKZUKDTSA-N	449.345	1.526	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cccn4cncc34)CC2)CC1	1835615871	OJJOGDOGEGJAET-IBGZPJMESA-N	447.967	1.773	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cc4cccnn4n3)CC2)CC1	1836079584	NQCWVBKEHMDYHK-SFHVURJKSA-N	448.955	1.168	50	20	IDGD	
CC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)[C@@H]3CCCS3(=O)=O)CC2)CC1	1836397157	AUBMDZDXXHMKKO-IRXDYDNUSA-N	434.002	1.153	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H]3Cc4ccccc4CN3)CCO2)C1	1836485008	KZQAJQYQAUZTCK-DXIQSLLYSA-N	435.952	1.175	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1Cc3ccccc3O1)CCO2	1836643782	KXFJFDWJWLWZPB-LRXVAGHRSA-N	436.936	1.854	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc4cn[nH]c4cn3)CCO2)C1	1837193563	SOOWMFCVGSCNRL-MGPUTAFESA-N	435.912	1.435	50	20	IDGD	
CC(C)(F)C(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1	1837823910	YRIPPJHUEYGGRM-UHFFFAOYSA-N	435.500	1.045	50	20	IDGD	
COC(=O)NCC(=O)N1CCC(OC2CCN(C(=O)[C@H](F)Br)CC2)CC1	1838648038	HJFZXNIPPCGOKR-AWEZNQCLSA-N	438.294	1.032	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)CNC(=O)OC)CC2)CC1	1838765885	PVFRWSUEQYRHKE-HNNXBMFYSA-N	448.358	1.515	50	20	IDGD	
COc1ccccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)CCBr)C2)C1	1838875365	LQDXPWONHPPBSZ-LJQANCHMSA-N	441.322	1.550	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccn(C(C)(C)C)n3)C2)C1	1839143143	MMLMVCAWOLNNOV-MGPUTAFESA-N	426.945	1.726	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccc(F)c(F)c3)C2)C1	1839143214	OTUUCVCNSMQVEG-FOIQADDNSA-N	430.879	1.981	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(-n4ccnc4)ccn3)C2)C1	1839146391	NXOHUJLARHAFIF-UTKZUKDTSA-N	447.923	1.355	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccncc3F)C2)C1	1839152465	ABFAWKHMRBUQCX-ZWKOTPCHSA-N	434.295	1.527	50	20	IDGD	
COc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)ccn1	1839153692	ONZWMGPNRFRYQZ-RBUKOAKNSA-N	446.331	1.397	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3C[C@H]3F)C2)C1	1839743851	AFMHVGHURQAUDR-BWXQDXLFSA-N	449.429	1.686	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1C[C@H]3CC[C@@H]1O3)CCO2	1840048175	SKDUTZRTVQFZHT-RMWBKXBUSA-N	445.354	1.041	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cc(C)ccc3C)C2)C1	1840155423	BKXUWMFQDLLZTO-SIKLNZKXSA-N	438.952	1.556	50	20	IDGD	
COc1ccccc1CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840187133	XMGUJAYBAMXYHP-FQEVSTJZSA-N	445.343	1.888	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)CC[C@H]3CCOC3)CCO2)C1	1840589854	VPUHULIXPIJHAO-SNRMKQJTSA-N	437.364	1.496	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(C)cc3Cl)CCO2)C1	1840697391	VDMBUZVZLAJHTA-XLIONFOSSA-N	445.343	1.972	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H]1C=C[C@@H](C(=O)N2CC3(CCCN3C(=O)[C@H](O)CCl)C2)C1	1841350158	KTGZWPSSQMULAG-QLFBSQMISA-N	427.929	1.259	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)/C=C\c2c[nH]c3ccccc23)C1	1841971628	OFIWYNQQSIIHPW-FLIBITNWSA-N	429.285	1.378	50	20	IDGD	
C#CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)CCBr)C1	1842639347	FCVJIIBZCTZPLA-AWEZNQCLSA-N	442.354	1.891	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1ccoc1C(F)(F)F)C2	1844264166	NYDNEPSASKLABP-UHFFFAOYSA-N	437.378	1.428	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)c1ccnnc1)C2	1844692092	FRFRTMIPEFMKEY-UHFFFAOYSA-N	425.401	1.441	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)c1ccn(C)n1)C2	1844692205	UTFGLELFRMNEIG-UHFFFAOYSA-N	427.417	1.384	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCCC12CN(C(=O)c1cc3n(n1)CCCNC3=O)C2	1845171391	WZCUJUIVOGZYBK-KRWDZBQOSA-N	428.320	1.070	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2ccc(Cl)c(F)c2)C1	1845308584	SNBADELDEHFWDO-UHFFFAOYSA-N	431.855	1.608	50	20	IDGD	
Cc1cc(C)n2ccc(C(=O)N3CCCC34CN(C(=O)c3cnccc3C(=O)NN)C4)c2n1	1845731538	DSOBGYCZZCGMCP-UHFFFAOYSA-N	447.499	1.080	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1c(Cl)cncc1Cl	1847201418	RBNXDGPHCYXYPF-KBPBESRZSA-N	428.320	1.577	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)C(C)(C)C	1847525169	GFWNSYWVACJMDD-ZQDZILKHSA-N	431.961	1.727	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H]1CCCOC1	1848098871	IRUJMRJEKMISCE-UGUYLWEFSA-N	429.945	1.747	50	20	IDGD	
COCCOc1cc([N+](=O)[O-])c(C(=O)NNC(=O)c2cccc(N(C)C)c2)cc1OC	28663974	AHVODCZGARZMHJ-UHFFFAOYSA-N	432.433	1.769	50	20	IDGD	
O=C(Cc1ccc(F)c(Br)c1)NNC(=O)c1csc(N2CCOCC2)n1	71964602	OAKIORZPECJDDH-UHFFFAOYSA-N	443.298	1.885	50	20	IDGD	
COc1ccc(CN2C[C@@H](C(=O)NNC(=O)[C@H](C)Oc3ccc(F)cc3)CC2=O)cc1	726522862	YXHVGLXQLVUUAX-HOCLYGCPSA-N	429.448	1.798	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(Cl)c(S(=O)(=O)NNC(=O)c2ccccn2)c1	728261314	PXNRORVESVIDPD-UHFFFAOYSA-N	446.938	1.389	50	20	IDGD	
Cn1cc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c(C2CCCCC2)n1	728341878	JRXSCGMAAQNYOW-SFHVURJKSA-N	442.472	1.612	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2cc(F)ccc2Br)ccc1O	728509558	HZNSNMSSDQLHRC-UHFFFAOYSA-N	447.238	1.704	50	20	IDGD	
O=C(NNS(=O)(=O)c1cccc2c1COC2=O)c1cc(F)ccc1Br	728509789	NQAUNAWRXLDBDA-UHFFFAOYSA-N	429.223	1.882	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2cnnn2-c2ccccc2Cl)n1	728730512	CMFMOSPMVJHKIT-UHFFFAOYSA-N	434.865	1.233	50	20	IDGD	
COC(=O)N1CCC[C@H](NC(=O)NNC(=O)c2cc(OC)ccc2Br)C1	728751136	JLDMZJAHKYPNGQ-JTQLQIEISA-N	429.271	1.633	50	20	IDGD	
C[C@@]1(NNC(=O)N[C@H]2CCN(c3ccc(Br)cc3)C2)CCS(=O)(=O)C1	728755392	LWWZAGYSLAVUIM-XJKSGUPXSA-N	431.356	1.409	50	20	IDGD	
NC(=O)[C@@H]1CCCN(CCCNC(=O)NNC(=O)c2ccc(Br)s2)C1	729494845	GOMXEGXBCFSYHY-SNVBAGLBSA-N	432.344	1.042	50	20	IDGD	
CCN1CCC[C@H]1CN1C[C@@H](C(=O)NNC(=O)c2cc(-c3ccccc3)on2)CC1=O	729625676	AYWWJVRIYBMINQ-IRXDYDNUSA-N	425.489	1.435	50	20	IDGD	
O=C1CC[C@H](C(=O)NNC(=O)c2cccc(S(=O)(=O)Nc3ccccc3Cl)c2)N1	729833964	SDPZLWIDYDWPEO-OAHLLOKOSA-N	436.877	1.180	50	20	IDGD	
CC(=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O)c1ccc(OCCC(C)C)cc1	730568944	HIINZLRKGUHAJZ-UHFFFAOYSA-N	433.534	1.536	50	20	IDGD	
O=C(Cc1cc(O)nc(S)n1)NN=C1C(=O)Nc2c(Br)cc(F)cc21	730586425	IHJMJTBXHTUZMJ-UHFFFAOYSA-N	426.227	1.388	50	20	IDGD	
O=C(NC[C@H](O)c1cccc(C(F)(F)F)c1)NNC(=O)c1ccc(-n2cnnn2)cc1	730820434	DPKVBSIAVBEKJH-HNNXBMFYSA-N	435.366	1.359	50	20	IDGD	
CS(=O)(=O)c1ccc(Br)c(C(=O)NNC(=O)Cc2ccccc2F)c1	731330230	FKJOJPIUVLTLJL-UHFFFAOYSA-N	429.267	1.995	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)[C@@H]2CCCN(C(=O)c3ccc(F)cc3)C2)C[C@@H](C)O1	732264813	XAICHVKMPJODRM-SOLBZPMBSA-N	434.512	1.325	50	20	IDGD	
CC(C)C[C@H](C(=O)NNc1ccccc1S(C)(=O)=O)N1C(=O)[C@H]2CC=CC[C@@H]2C1=O	732305272	GHKCKKCVYVMXQM-YQQAZPJKSA-N	433.530	1.899	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCCCOC[C@H]2CCCO2)cc1Br	732441416	HPXSDUORXAKXEW-CYBMUJFWSA-N	430.299	1.987	50	20	IDGD	
O=C(CCNS(=O)(=O)/C=C\c1ccccc1)NNC(=O)c1cnn(-c2ccccc2)c1	733364776	RJYAGAAJRIENPV-OWBHPGMISA-N	439.497	1.614	50	20	IDGD	
C[C@@H](NC(=O)NN[C@@]1(C)CCS(=O)(=O)C1)c1ccc(NC(=O)c2ccncc2)cc1	733848756	SBFLMQLYACFTJV-VLIAUNLRSA-N	431.518	1.776	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)c1ccc(S(C)(=O)=O)cc1	734251797	NKWTZTPMYWCWPO-UHFFFAOYSA-N	425.532	1.924	50	20	IDGD	
COc1ccc([C@@H]2[C@H](C(=O)NNC(=O)[C@@H]3COc4ccccc4O3)CCC(=O)N2C)cc1	734313349	IFELFCNVSANBMQ-LKUPVBHCSA-N	439.468	1.592	50	20	IDGD	
CCCS(=O)(=O)NC1CCN(CC(=O)NNC(=O)c2cc(C)c(CC)s2)CC1	736309089	YLCGHLJVAYSEKR-UHFFFAOYSA-N	430.596	1.174	50	20	IDGD	
Cc1ccc(O[C@H](C)C(=O)N2CCN([C@@H](C)C(=O)NNC(=O)CC(C)C)CC2)c(C)c1	738333435	VUXOZMAAYQZOJL-RBUKOAKNSA-N	432.565	1.797	50	20	IDGD	
Cc1ccc(NC(=O)C2CCN(C(=O)NNC(=O)COCc3ccccc3)CC2)nc1	738496483	QPLXOTIFRLJSPL-UHFFFAOYSA-N	425.489	1.998	50	20	IDGD	
COc1ccc(S(=O)(=O)CCC(=O)NNC(=O)c2ccc(Cl)nc2)cc1OC	740818559	YMIIIFPYTRIHHP-UHFFFAOYSA-N	427.866	1.377	50	20	IDGD	
COc1cc(C(=O)NNC(=O)N[C@H]2CCC[C@@H](S(C)(=O)=O)C2)ccc1OC(C)C	741093755	VBPMJFSPFZNAMF-LSDHHAIUSA-N	427.523	1.782	50	20	IDGD	
CC(=NNC(=O)Cn1nnc(-c2ccccc2)n1)c1cccc(N2CCCS2(=O)=O)c1	741160612	VOLYGNUYFLMJTF-UHFFFAOYSA-N	439.501	1.420	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCc2nc(-c3ccccc3)n[nH]2)c2ccccc2c1=O	741416566	QCEXVICIMVUCQM-UHFFFAOYSA-N	432.444	1.346	50	20	IDGD	
Cc1ccc([C@@H](C)C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)o1	742486956	GFBTZUGNFYMFAW-MRXNPFEDSA-N	449.529	1.493	50	20	IDGD	
NS(=O)(=O)c1ccc(F)c(CNC(=O)NNC(=O)c2cccc(Br)c2)c1	743686503	JGYAANDXZLLQEJ-UHFFFAOYSA-N	445.270	1.380	50	20	IDGD	
CSC[C@H](C(=O)NNC(=O)Nc1ccc(N(C)C)cc1)N1C(=O)[C@@H]2CCCC[C@H]2C1=O	743826390	BVMDGZSFAWNKHV-BRWVUGGUSA-N	447.561	1.812	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)OCc2nc(CS(C)(=O)=O)no2)c(C)n1C[C@@H]1CCCO1	744553006	XVMOMQZQGIZBPF-KZRVJCNKSA-N	448.501	1.862	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)[C@@H]1CC(c2cccc(F)c2)=NO1	744620752	NEANOPBLCAFYCR-SFHVURJKSA-N	448.476	1.483	50	20	IDGD	
CNC(=O)C1CCC(NC(=O)NNC(=O)[C@H](C)Oc2cccc(Br)c2)CC1	745188040	MZFZASFLPCTQJU-DCBWTQNWSA-N	441.326	1.852	50	20	IDGD	
COc1cc(C(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)cc(NC(C)=O)c1OC	745437895	RFJCGAUBORHDIA-UHFFFAOYSA-N	449.847	1.934	50	20	IDGD	
Cc1nn(-c2ccc(F)cc2)nc1C(=O)OCC(=O)NNC(=O)c1cccc(Cl)c1	745469758	XXOAZCMMLJEVNY-UHFFFAOYSA-N	431.811	1.986	50	20	IDGD	
O=C(COC(=O)c1nnn(C2CC2)c1C(F)(F)F)NNC(=O)c1cccc([N+](=O)[O-])c1	745776421	QKHGRWXGJMUALV-UHFFFAOYSA-N	442.310	1.158	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1)[C@@H]1CCOC1	745861336	KHQDYTTVZBHVAT-CHWSQXEVSA-N	438.531	1.918	50	20	IDGD	
O=C(CN1CCn2c(CCc3ccccc3)nnc2C1)NNC(=O)c1cccc([N+](=O)[O-])c1	746473663	PWAMAYCCAMQMOK-UHFFFAOYSA-N	449.471	1.248	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)NCCc1ccc(I)s1	747503605	VYOWVRXIRDFGDV-UHFFFAOYSA-N	430.271	1.863	50	20	IDGD	
COc1cc(C(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)ccc1OCC(N)=O	748519242	XXGKPOXHDKPWPH-UHFFFAOYSA-N	447.391	1.610	50	20	IDGD	
O=C1NC(=O)C2(CCC(C(=O)NNc3ccc(S(=O)(=O)C(F)(F)F)cc3)CC2)N1	748522514	DJQHNZOGQRJXBB-UHFFFAOYSA-N	434.396	1.192	50	20	IDGD	
COC[C@](C)(CC(=O)OC)NC(=O)CCC(=O)C(C#N)=C1N(C)c2ccccc2N1C	749429488	TXFWHGJVILQVTB-QFIPXVFZSA-N	428.489	1.741	50	20	IDGD	
O=C1C[C@H](Cc2ccc(C(=O)NNc3nc(Br)cn4ccnc34)cc2)C(=O)N1	750243956	RBUJXHLLTVHGAV-LBPRGKRZSA-N	443.261	1.454	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)c1cccc(I)c1	751214717	DLRMRVKREZKOFK-UHFFFAOYSA-N	429.239	1.544	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)[C@@H]2CC(=O)N(CCOc3ccccc3Cl)C2)cc1	751787443	YCUUYYBQHPVJRU-MRXNPFEDSA-N	426.860	1.900	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@@H](C)c2ccc(S(C)(=O)=O)cc2)cc(OC)c1OC	753182200	ZTFWCGSNUBNARK-LBPRGKRZSA-N	436.486	1.681	50	20	IDGD	
C[C@@H](C[S@](C)=O)NC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	753356145	BPCXDQLVLCFSRQ-RNUGCUGFSA-N	444.560	1.260	50	20	IDGD	
C[C@](O)(C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)c1cccc(C(F)(F)F)c1	754838040	QQKKPQUARDWVTI-QGZVFWFLSA-N	430.404	1.778	50	20	IDGD	
Cn1cc(NS(=O)(=O)c2ccsc2C(=O)NNc2ccc(C(F)(F)F)nn2)cn1	755187038	APJINGNESASAAG-UHFFFAOYSA-N	447.424	1.848	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2csc([C@H]3CCCO3)n2)ccc1Cl	755411317	PLAKBYWSHYQHSS-LLVKDONJSA-N	430.895	1.370	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)Nc1cc(C)nn1[C@H]1CCS(=O)(=O)C1	755528954	AGASICPOMNOASH-LBPRGKRZSA-N	441.897	1.680	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)Nc1ncn(Cc2ccccc2)n1	756237779	LBJUCOUSXSKKKY-UHFFFAOYSA-N	448.531	1.691	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)Nc2cccc(S(=O)(=O)N3CCCN(C)CC3)c2)o1	756360397	STMOMTIQUUBNME-UHFFFAOYSA-N	435.506	1.381	50	20	IDGD	
COCCS(=O)(=O)c1ccc(NC(=O)NNC(=O)COc2ccc(F)cc2)cc1	756557061	ZPZYUOKMACEMJU-UHFFFAOYSA-N	425.438	1.478	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)Nc2cnn(CC(=O)N3C[C@H](C)O[C@H](C)C3)c2)cc1	756836677	CTRWUBDYAWBIPP-GASCZTMLSA-N	428.493	1.548	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)Nc1cc(C2CC2)nn1[C@@H]1CCS(=O)(=O)C1	756854170	CKGVBAQBGMWUHQ-CQSZACIVSA-N	448.461	1.495	50	20	IDGD	
Cc1nn(Cc2ccccc2)c2sc(C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)cc12	758034630	HTPHBYWVRCMWBI-GFCCVEGCSA-N	435.531	1.153	50	20	IDGD	
Cc1cc(F)c(C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)cc1F	758297213	YWSFUFXPGVFTCL-UHFFFAOYSA-N	425.461	1.361	50	20	IDGD	
COC(=O)[C@@H](C)Oc1ccc(C=NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1	758366580	HTNXVNNXHKGTTH-MRXNPFEDSA-N	447.513	1.706	50	20	IDGD	
CN(C(=O)/C(C#N)=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)[C@H]1CCNC1=O	760118870	MPUGXAHNDZGKNK-SHRNQRGKSA-N	440.891	1.333	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)C[C@H]1CN(C(=O)OC(C)(C)C)CCO1	760437066	BEHHSHQGARFDPU-ZDUSSCGKSA-N	430.502	1.075	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)c1nccn2c(Br)cnc12	760438050	OFWORFCQFIZSRN-UHFFFAOYSA-N	427.259	1.168	50	20	IDGD	
O=C(NNC(=O)c1cccc(-n2ccc(C(F)(F)F)n2)c1)N[C@H]1CCS(=O)(=O)C1	760446376	NYSQMCNXDHXQIY-NSHDSACASA-N	431.396	1.022	50	20	IDGD	
O=C(NNC(=O)C1SCCS1)c1cccc(S(=O)(=O)NCc2ccccc2)c1	761136711	UXJCKDNLIHMLMF-UHFFFAOYSA-N	437.568	1.732	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)OC)c1	761624809	IBEPUYPEHFHDRV-UHFFFAOYSA-N	439.515	1.430	50	20	IDGD	
C[C@]1(NNC(=O)NCc2ccc(C(=O)Nc3ccc(F)cc3)cc2)CCS(=O)(=O)C1	761780588	TWOCWAXYRNCWBJ-FQEVSTJZSA-N	434.493	1.959	50	20	IDGD	
CC(C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)cc1	763601130	OUUWMCGKDHSKDK-UHFFFAOYSA-N	434.456	1.615	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2ccnc(OCC(F)(F)F)c2)c1	763668812	QIRLEWNUPJYZIW-UHFFFAOYSA-N	440.378	1.804	50	20	IDGD	
CCc1cc(NC(=O)C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)ccc1C	763717877	BNHMRGIZDWNDMA-UHFFFAOYSA-N	432.502	1.207	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)cnc1Br	763858024	QFICYEQABQOTCG-JTQLQIEISA-N	439.241	1.845	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccn(CC(F)(F)F)n2)cc1	763860691	KKEVESDGUPDRFT-LLVKDONJSA-N	443.382	1.398	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cccc3c2oc(=O)n3C)cc1	763861379	OXHLFQDFGMKUMR-GFCCVEGCSA-N	442.428	1.084	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)c2cccnc12	763866672	XMUIOIAIORYQBJ-GFCCVEGCSA-N	426.404	1.936	50	20	IDGD	
CO[C@H](C)C(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)c1	763866866	YHXYVJMXYXMLFE-OLZOCXBDSA-N	446.435	1.353	50	20	IDGD	
CCn1nc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(C(C)=O)cc2)cc1C1CC1	763872000	IPUHJTFQOYAJGU-ZDUSSCGKSA-N	427.461	1.536	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccc(N3CCCC[C@H]3C)cc2C)n1	763885391	KUEQHEYUQWFQHJ-MRXNPFEDSA-N	426.521	1.973	50	20	IDGD	
O=C(Cc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1cccc(Cl)c1-n1cncn1	763939006	ARDGNNLVNJVCRH-UHFFFAOYSA-N	433.255	1.903	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)Nc1ccc(OCC(F)F)cc1	764004526	GEKTXBRGGYBXCU-UHFFFAOYSA-N	445.220	1.831	50	20	IDGD	
CC(C)(C)OC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)nc2)cn1	764092758	MMPXSXXDRWMFKC-UHFFFAOYSA-N	434.840	1.877	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2cc(C)nn2-c2ccc(F)cc2)c1O	764130547	KCYGHSHMXZDGNO-UHFFFAOYSA-N	427.392	1.434	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2O1)C(=O)Nc1ccccc1OCc1cscn1	764154693	SXSXTPZVJHBGRU-SFHVURJKSA-N	438.465	1.812	50	20	IDGD	
C[C@@H]1C[C@@H](C)CN(C(=O)c2ccccc2NC(=O)C(=O)NNC(=O)Cc2cccnc2)C1	764268638	OBMZJLWXFIJECC-HZPDHXFCSA-N	437.500	1.528	50	20	IDGD	
CCOC(=O)/C=C\c1ccc(NC(=O)C(=O)NNC(=O)CCc2ccccc2O)cc1	764289844	YYZZIARUSZRNEM-ZROIWOOFSA-N	425.441	1.687	50	20	IDGD	
Cc1cccc(NC(=O)C(=O)NNC(=O)COCc2ccccc2)c1C(=O)N1CCCC1	764367511	XJYIKNCODFFFEO-UHFFFAOYSA-N	438.484	1.534	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)C(=O)Nc1ccc([S@@](=O)C(F)(F)F)cc1	764368632	ZKNHKZFKNINKNY-SSEXGKCCSA-N	443.403	1.617	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cnc4c(c3)c(C)nn4C)n[nH]2)cc1	764384931	NESDWFHJFKVJGN-UHFFFAOYSA-N	446.471	1.629	50	20	IDGD	
C[C@H](C#N)Oc1ccccc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	764388445	SDPRXCLCVNIVQO-GFCCVEGCSA-N	436.403	1.906	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1ccn(-c2ncccc2F)n1	764394608	TXUXHSOKGIGZJO-UHFFFAOYSA-N	444.448	1.293	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)c2c(C)c(C)nn(C)c2=O)cc(OCC)c1OCC	764589684	XPJBOYSNQWDOMD-UHFFFAOYSA-N	432.477	1.668	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)NC[C@@]2(OC)CCOC2)c2ccccc2c1=O	764808723	GXWIGTHRIKEVRO-NRFANRHFSA-N	431.493	1.336	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)[C@@H]1COc2ccccc2C1	765755982	JQWCVXKSZHKIHD-IBGZPJMESA-N	442.947	1.856	50	20	IDGD	
Cc1nc(-c2ccccc2)oc1C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	766643254	AHEXMEAGYHQGDA-UHFFFAOYSA-N	447.495	1.869	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)CNc3ccccc3[N+](=O)[O-])CC2)cc1	766649403	OPJSHXASVZWALK-UHFFFAOYSA-N	440.504	1.280	50	20	IDGD	
O=C(COCc1ccccc1)NNS(=O)(=O)c1ccc(OC[C@@H]2CCOC2)c(F)c1	767461337	UOXGFROVEHXMKB-MRXNPFEDSA-N	438.477	1.767	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)c1ccc(=O)n(-c2ccccc2F)n1	768636142	NZMZYYYHXRLMFK-UHFFFAOYSA-N	432.433	1.541	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)[C@H](c1ccccc1)N1CCC(O)CC1	768637108	CUOCUZAVZJELGU-FQEVSTJZSA-N	433.530	1.740	50	20	IDGD	
CSCCNC(=S)NNC(=O)c1ccccc1S(=O)(=O)N(C)c1ccccc1	770245324	MOUDTDHEYUDDGB-UHFFFAOYSA-N	438.600	1.984	50	20	IDGD	
Cc1cc2c(N3CCC[C@@H]3C(=O)NNC(=O)[C@H]3COc4ccccc4O3)ncnc2s1	770446077	FJOASENRBHMUBQ-RHSMWYFYSA-N	439.497	1.956	50	20	IDGD	
CCCS(=O)(=O)NC1CCN(C(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)CC1	770646745	GYEFKCFNIUWVSC-ZDUSSCGKSA-N	446.957	1.642	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)[C@@H]1CCCN1C(=O)c1ccccc1OC(F)F	772017778	XMJGMGMVBRLGNE-AAEUAGOBSA-N	427.404	1.382	50	20	IDGD	
Cc1ccc(N2C[C@H](C(=O)NNC(=O)C(=O)NCc3ccc(Cl)cc3)CC2=O)cc1F	772200153	OANHCDHYJPSILW-CQSZACIVSA-N	446.866	1.604	50	20	IDGD	
C[C@@H]1NC(C(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)=NN(c2ccccc2)C1=O	772963969	MSONKTFETDDOCF-STQMWFEESA-N	429.864	1.593	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)c2oc3ccccc3c2CS(C)(=O)=O)c1	773075982	XNLGFOCSCBOBBU-UHFFFAOYSA-N	430.442	1.406	50	20	IDGD	
N#Cc1ccc(NNC(=O)C(=O)Nc2ccccc2S(=O)(=O)N2CCCCC2)cc1	773700521	MGJCLHNYXDPWLZ-UHFFFAOYSA-N	427.486	1.815	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2ccc(NC(=O)NCc3ccco3)cc2)n1	773730647	JCUZKFGBZGUDHN-UHFFFAOYSA-N	425.405	1.482	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccccc2-c2nnnn2C(C)C)cc1F	773888387	GKJCFIQZWOTFDR-UHFFFAOYSA-N	425.424	1.768	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)NC[C@@H]2CC[C@H](C(=O)N(C)C)O2)cc1Cl	774773220	WLHFAGDSYIBSLE-GXFFZTMASA-N	443.888	1.329	50	20	IDGD	
Cn1ncc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1-c1ccccc1	775123391	FHVWQTXWKWOIFY-SFHVURJKSA-N	436.424	1.231	50	20	IDGD	
CN(NC(=O)c1cccc(C2OCCO2)c1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776215128	ZQLCYLLPLHCEPL-UHFFFAOYSA-N	434.493	1.981	50	20	IDGD	
CCOc1ccc2c(c1)[C@@H](NC(=O)NNC(=O)c1nn(C)c(=O)c3ccccc13)CCO2	776247118	IQQUNCGICNVRJV-KRWDZBQOSA-N	437.456	1.800	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)NNC(=O)CNC(=O)c2cccs2)c2ccccc12	777933611	QHUREHSYJGGCCP-UHFFFAOYSA-N	446.510	1.599	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)C1CCN(C(=O)CCc2ccccc2)CC1	778433659	OVWATJGVWQLRLO-UHFFFAOYSA-N	432.521	1.530	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCCCC(=O)NNC(=O)CNC(=O)OC(C)(C)C)cc1C	778437157	UWJYAJSRKKHAOA-UHFFFAOYSA-N	442.538	1.034	50	20	IDGD	
COc1ccc(Cn2ccc(NC(=O)C(=O)NNC(=O)Cc3ccccc3OC)n2)cc1	778715138	ZGNLUQGSJXIXPO-UHFFFAOYSA-N	437.456	1.277	50	20	IDGD	
N#CC1=CCN(CC(=O)N2CCN(CC(=O)Nc3ccccc3C(F)(F)F)CC2)CC1	779590686	SDHNQWZWEPIQBC-UHFFFAOYSA-N	435.450	1.944	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](NC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)CC1	780668601	CKFVGFDHDDNNSQ-YOEHRIQHSA-N	434.493	1.946	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)NCCCCN2CCN(c3ncccn3)CC2)c1	780830274	BIAXXXADFJGDDD-UHFFFAOYSA-N	427.509	1.492	50	20	IDGD	
CCOc1cc(/C=C\C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)ccc1O	780957308	SBMPBHDDULEHSF-NTMALXAHSA-N	447.513	1.968	50	20	IDGD	
O=C(NNc1ncncc1Cl)[C@@H]1CCC[C@@H](C(=O)NNc2ncncc2Cl)C1	781824677	GCSFDQRQEGWBLI-NXEZZACHSA-N	425.280	1.966	50	20	IDGD	
CCOC(=O)c1ccn(-c2ccccc2NC(=O)C(=O)NNc2ncncc2Cl)n1	782160715	UTYHIMHEOGICSI-UHFFFAOYSA-N	429.824	1.574	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N[C@H](CO)C1CCOCC1	782494577	WBJDOWLSQAMFSB-IAQYHMDHSA-N	430.299	1.334	50	20	IDGD	
O=C1C[C@H](Cc2ccc(NC(=O)C(=O)NNc3ncccc3C(F)(F)F)cc2)C(=O)N1	783125588	KSHZEAGWXSHMSR-NSHDSACASA-N	435.362	1.387	50	20	IDGD	
CCOC(=O)c1cnn(-c2cccc(NC(=O)C(=O)NNc3cc(C)nc(C)n3)c2)c1C	783326430	FKUPKTKSUUVSIO-UHFFFAOYSA-N	437.460	1.846	50	20	IDGD	
CN(NC(=O)C(=O)Nc1ccc(N2CCOCC2)cc1N1CCOCC1)c1ccccc1	783428863	DKJSNDQODBKOJR-UHFFFAOYSA-N	439.516	1.466	50	20	IDGD	
COCc1c(Br)cccc1NC(=O)C(=O)NNc1ccc(-n2cccn2)nn1	783433199	NXEDKGWEQYIVNW-UHFFFAOYSA-N	446.265	1.653	50	20	IDGD	
O=C(NNc1ccc(-n2cccn2)nn1)C(=O)Nc1ccc(C(=O)N2CCCCCC2)cc1	783433699	ZKGPQZSSHFUMRQ-UHFFFAOYSA-N	448.487	1.760	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNc2ccc(Br)cn2)cc(OC)c1OC	784340398	AYZFVPOCSXVPKW-UHFFFAOYSA-N	425.239	1.952	50	20	IDGD	
O=C(NNc1nccnc1Cl)C(=O)Nc1ccc2c(ccn2CCN2CCOCC2)c1	784777657	DBRGTJFIEKYARR-UHFFFAOYSA-N	443.895	1.499	50	20	IDGD	
CCCCNS(=O)(=O)c1cccc(NC(=O)C(=O)NNc2ncccc2Cl)c1	784817529	ZGXNLAFBIXEKTO-UHFFFAOYSA-N	425.898	1.895	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)F)cc1)C(=O)Nc1ccc(-n2cccn2)nc1	784835411	ODJCYSRPTAJHBN-UHFFFAOYSA-N	436.400	1.345	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)Nc1cccc(C(=O)c2ccccc2)c1	785023359	GIASTIMJIZNSBO-UHFFFAOYSA-N	448.391	1.931	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)Nc1cccc(-c2nccs2)c1	785024022	QMKNJRQWQUBPOZ-UHFFFAOYSA-N	427.398	1.824	50	20	IDGD	
C[S@@](=O)c1cccc(NC(=O)C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)c1	785109749	XMSFGPOJZRONTE-SSEXGKCCSA-N	436.440	1.676	50	20	IDGD	
CCOC(=O)c1ccccc1NC(=O)C(=O)NNc1c(OC)cccc1S(C)(=O)=O	785330687	KGOALBHQUBACIS-UHFFFAOYSA-N	435.458	1.357	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)[C@H]2[C@H](C(F)(F)F)[C@H]3CC[C@H]2O3)c2ccccc2c1=O	785442932	GPVUEYXBZWUFMO-KBUPBQIOSA-N	438.406	1.923	50	20	IDGD	
CC[C@@]1(C)Oc2ccc(NC(=O)C(=O)NNC(=O)[C@H]3COc4ccccc4O3)cc2O1	785987707	GTBYEPKKPMBXPG-UTKZUKDTSA-N	427.413	1.510	50	20	IDGD	
C[C@H]1[C@@H](C(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)CCN1C(=O)OC(C)(C)C	786249900	LQZDKZDLKBAOBG-WFASDCNBSA-N	438.912	1.749	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNS(=O)(=O)c2ccc(C#N)c(Br)c2)c1	788476141	BGFHCTHYROSBBP-UHFFFAOYSA-N	440.275	1.961	50	20	IDGD	
CNC(=O)CCCCC(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	788625932	VEWCDOAJNKTQQZ-UHFFFAOYSA-N	435.488	1.456	50	20	IDGD	
COCCONC(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccc(OC)cc2)c1	789349314	NWVBZYBOPDJNAF-UHFFFAOYSA-N	438.462	1.018	50	20	IDGD	
CC[C@H](C)CC(=O)NNC(=O)C[C@H]1c2cc(OC)c(OC)cc2CCN1S(C)(=O)=O	791092500	WOVMEBDVOCDBCF-BBRMVZONSA-N	441.550	1.536	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)[C@@](C)(O)Cn2cc(C(F)(F)F)ccc2=O)cc1	792022406	NPWRHPNZRDPMAV-SFHVURJKSA-N	443.447	1.866	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1c2c(nn1-c1ccc(Cl)cc1)CCC2	792265806	JICDGNVOZXGMRS-LBPRGKRZSA-N	449.895	1.152	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)CN2C(=O)N[C@@](C)(c3ccc(C)cc3)C2=O)cc1	792946701	HXKMLUSTODSBGD-QFIPXVFZSA-N	439.472	1.030	50	20	IDGD	
C[C@](O)(CN1C(=O)NC2(CCCC2)C1=O)C(=O)NNc1cccc(Br)c1	793704525	INALEOMMFUTENO-INIZCTEOSA-N	425.283	1.508	50	20	IDGD	
CCc1noc2ncc(S(=O)(=O)NNC(=O)CNC(=O)OCc3ccccc3)cc12	794599400	YTGKMTVIPOTZMF-UHFFFAOYSA-N	433.446	1.021	50	20	IDGD	
COc1cc(C(=O)NNc2ccccc2S(=O)(=O)N(C)C)cc(NC(C)=O)c1OC	795161848	RCJKJMWSMWWWOF-UHFFFAOYSA-N	436.490	1.669	50	20	IDGD	
CCOc1ccc(N2C[C@H](C(=O)NNc3ccccc3S(=O)(=O)N(C)C)CC2=O)cc1	795169868	ZPHHCZOBTZGGOE-OAHLLOKOSA-N	446.529	1.832	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)[C@@H]2CCCN2C(=O)c2ccc(OC)cc2)cc1	799098729	XGVJFNROMKZPSO-IBGZPJMESA-N	426.473	1.568	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)NCCNS(=O)(=O)c2ccc(F)cc2Cl)cc1	801003898	QWBVRKVVTWDTCU-UHFFFAOYSA-N	439.856	1.273	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)Cn2nnc(-c3ccccc3)n2)c(OC)cc1Cl	802077118	IYEDCFKKMSKFGX-UHFFFAOYSA-N	431.840	1.864	50	20	IDGD	
O=C(COC(=O)c1ncsc1Br)NNC(=O)c1ccc([N+](=O)[O-])cc1	805709480	LQTLIRVVFJFHDH-UHFFFAOYSA-N	429.208	1.432	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)Nc1ccc(F)c(S(=O)(=O)N(C)C)c1	806544187	XDLLPDQZWXMWRI-LLVKDONJSA-N	442.444	1.835	50	20	IDGD	
COC(=O)c1c(C)csc1NC(=O)C(=O)NNC(=O)c1ccc(Cl)cc1OC	806976940	OWKOSARMQJMXLY-UHFFFAOYSA-N	425.850	1.905	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)C(=O)Nc1cc(F)c(N2CCOCC2)cc1F	806979383	SFYCYODJSIAXKZ-UHFFFAOYSA-N	448.426	1.104	50	20	IDGD	
CC1CCN(c2ccc(NC(=O)CCC(=O)NNC(=O)N3CCN(C)CC3)cc2)CC1	807378438	CXRYNIQLVLJUQH-UHFFFAOYSA-N	430.553	1.630	50	20	IDGD	
CC[C@@H](C)N[C@H](CNC(=O)NNC(=O)c1csc(N2CCOCC2)n1)c1ccco1	807442300	YEMRSDPQAXTUPQ-ZIAGYGMSSA-N	436.538	1.646	50	20	IDGD	
O=C(COC(=O)[C@H]1C[C@@H](c2ccccc2)OC1=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	808588918	LJEDXMLDNNLCTE-CVEARBPZSA-N	427.369	1.203	50	20	IDGD	
Cn1cc(Br)c(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)n1	814362224	UTKIPFIZFCMYFC-UHFFFAOYSA-N	435.326	1.156	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCc2c(nnn2-c2ccccc2)C1	814638345	MZXNTWHFFMHQHJ-UHFFFAOYSA-N	440.891	1.749	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)N(C(=O)Cc2ccccc2)CC3)n[nH]1	815568133	WDAFJFRMMAIZQD-UHFFFAOYSA-N	446.467	1.250	50	20	IDGD	
CNC(=O)Oc1cccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(C)cc3)[nH]n2)c1	815568942	ZJXWAGGNBZGDBI-UHFFFAOYSA-N	436.428	1.503	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1ccc([C@H]2CCOC2)cc1	815751839	QQBYGOQCPAFUCF-HNNXBMFYSA-N	432.502	1.523	50	20	IDGD	
O=C(NNc1ncncc1F)C(=O)Nc1ccc(N2CCOCC2)cc1C(F)(F)F	815764145	UDIMBHDDOXZXPU-UHFFFAOYSA-N	428.346	1.553	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@H]2CCCO2)n(-c2cccc(C(F)(F)F)c2)n1	815779543	JTVKPXVDYPPMMU-CYBMUJFWSA-N	425.367	1.464	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3c(C)nsc3NC3CC3)CC2)cc1	815827192	PKBBXJGVOSEWHQ-UHFFFAOYSA-N	442.589	1.913	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)C(=O)Nc2cc(C)n(CCC#N)n2)c1	815866234	UTSIUFKOZGWNBD-UHFFFAOYSA-N	449.265	1.736	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)N(C)[C@@H]2CCN(S(C)(=O)=O)C2)c(C)n1C[C@H]1CCCO1	816816671	DQJSQOOEHBTDHP-LDWJFSKOSA-N	434.562	1.683	50	20	IDGD	
CC(=O)[C@H]1CC(C(=O)NNc2ccccc2S(=O)(=O)N(C)C)=NN1c1ccccc1	817052809	QYZOZUAEWMOUOP-GOSISDBHSA-N	429.502	1.604	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)CCNS(=O)(=O)c1c(C)cc(C)cc1C	825649422	RSHOFDBCKQQMPJ-UHFFFAOYSA-N	448.545	1.548	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)CCc1c(C)nc(SC)nc1O	836818623	BJTICTHOWXQEKF-UHFFFAOYSA-N	428.518	1.905	50	20	IDGD	
Cn1ccnc1[C@H](NC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)c1ccccc1F	916223614	BRYUTSOYSCGQOV-QGZVFWFLSA-N	445.476	1.696	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NCc1ccc(C(=O)N2CCOCC2)cc1	916249027	VBAZCIRLUIZGQG-HNNXBMFYSA-N	444.463	1.596	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1)N[C@@H]1CCS(=O)(=O)C1	919886780	UWXFPQOJPXEXSC-GFCCVEGCSA-N	434.430	1.518	50	20	IDGD	
C[C@]1(NNC(=O)NC[C@H]2CCN(c3cccc(Br)c3)C2)CCS(=O)(=O)C1	920049166	RJINZYCHOKXTLB-DYVFJYSZSA-N	445.383	1.656	50	20	IDGD	
CCN1C(=O)C(=CNNC(=O)CSc2ccc(Cl)cc2)C(=O)N(CC)C1=S	920978555	IYXIXUUITCVLQN-UHFFFAOYSA-N	426.951	1.932	50	20	IDGD	
CN(Cc1ccc([S@](C)=O)cc1)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	1319016688	SMNGZMLKEFZFAC-PMERELPUSA-N	430.534	1.303	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)[C@H]2Nc3ccccc3S(=O)(=O)N2)cc1OC	1319400924	PHUVJYAAKNMNIP-SFHVURJKSA-N	448.501	1.365	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1OC	1328625506	FHEJNNXCRDGTCR-UHFFFAOYSA-N	443.522	1.660	50	20	IDGD	
COc1ccc(S(=O)(=O)CCC(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)cc1	1343789576	GMCZPUJXJORSSR-UHFFFAOYSA-N	441.531	1.253	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCCC[C@H]2CCNC(=O)OC(C)(C)C)n1	1346251686	IBKYHHBPSCPJSE-HNNXBMFYSA-N	439.582	1.911	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4nc(CO)[nH]c4c3)C2)C1	1777702393	FEWYHVFATKEWJQ-VFNWGFHPSA-N	434.924	1.906	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3c(Cl)ccc4c3OCO4)C2)C1	1777802827	BYNAYMVYWCQQBY-BFUOFWGJSA-N	445.299	1.766	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)N2C[C@H]3C[C@@H]3C2)C1	1779262889	JOVYVBJCRISDHU-NRFDFHEYSA-N	442.398	1.624	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C[C@H](N)c1cccnc1)C2	1779543546	GJRCDVVPGYKHDB-NNMXDRDESA-N	448.640	1.837	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H]1CCOC1)CCO2	1780099137	UMNGPANGIXDCNU-YCRPNKLZSA-N	447.444	1.000	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)COc1cccnn1)C2)[C@H](F)Br	1780777008	KFJKPFWXJLGDTQ-ISTRZQFTSA-N	445.289	1.060	50	20	IDGD	
CSc1ncccc1C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781331248	HENYYVXAMUWEAW-LRDDRELGSA-N	432.315	1.938	50	20	IDGD	
O=C(c1ccc2c[nH]nc2c1)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781332134	ZXJAPVZSMDQMIZ-YOEHRIQHSA-N	425.258	1.697	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1	1782009588	WZTYHYYYHYLGPQ-BTDLBPIBSA-N	447.713	1.978	50	20	IDGD	
CSCC[C@@H](O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]2C1	1783973452	AYFXYGJHUQDYFR-LXFSFDBISA-N	437.400	1.111	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C3=NO[C@@H](c4ccccc4)C3)C[C@@H]21)[C@@H](O)CCl	1784092202	JLYSDFNZEVOMSM-JAQSECSASA-N	435.908	1.083	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H]3CCc4nc[nH]c4C3)C2)C1	1784353702	ZHIKGMDBRVYURB-LXIYXOSZSA-N	425.327	1.128	50	20	IDGD	
O=C(C[C@@H]1COc2ccccc2O1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Cl)C[C@@H]21	1784391347	CTVNITCUWOFZLX-HIQFYHPCSA-N	426.872	1.731	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3sc(N)nc3C)[C@H]2C1	1786919156	LZQIDSPEKRKIIJ-RVMXOQNASA-N	445.383	1.801	50	20	IDGD	
Cc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](O)CCl)C[C@@H]32)c2cc(O)ccc2n1	1788279329	SSYXHYLIZXNKPU-SIXJUCDHSA-N	447.919	1.442	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3(C)CC3)C[C@@H]21	1789222308	QVCIQQIJWUFZHT-FNHZYXHNSA-N	445.472	1.914	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(S(C)(=O)=O)c3)C[C@@H]21	1789859572	VCDWEWQMZCUPDK-DKIMLUQUSA-N	442.965	1.701	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnn4ncccc34)C[C@@H]21	1789866551	REDRCYCLRXUGQK-HAHWVIBASA-N	440.331	1.559	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc4cccnn4c3)[C@H]2C1	1790430319	LNUUJBOUYASPBY-USJZOSNVSA-N	449.349	1.959	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1(c2ccc(NC(=O)[C@@H](C)NC=O)cc2)CCC1	1790499316	DMIFNZRFNQDLEO-DIODKFOQSA-N	438.488	1.389	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3n[nH]c4c3CC[C@H]4C)C[C@@H]21	1791055968	LBSBZOCQANBECN-MUGBGTHKSA-N	439.354	1.836	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(F)c(OC)c3)C[C@@H]21	1791255971	ABVUVWHIWGNNMU-XSWJXKHESA-N	428.888	1.681	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]3C2)cc1C	1791290673	JFHQHFBSXZNVFA-UFYCRDLUSA-N	430.549	1.270	50	20	IDGD	
Cc1c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](O)CCl)cc(Cl)cc1[N+](=O)[O-]	1792979988	IPRKJLOIPVVEMK-OJXGSEEGSA-N	446.287	1.360	50	20	IDGD	
COc1cc(Cl)ccc1CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](O)CCl	1792983847	QOZRNPIQDXEUAY-ZFHGCVPZSA-N	431.316	1.080	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN(C)C(=O)OC(C)(C)C)C2	1793447260	KHIZHQAFKWNWAR-IVSAIRAKSA-N	431.961	1.850	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCNC(=O)c1ccccc1)C2	1793455336	IBQVNAFUNDMPGY-AJYBTWMASA-N	435.952	1.804	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](O)CNC(=O)OC(C)(C)C)C2	1793677543	PFZHOMSLKDIERQ-QRJUGERDSA-N	431.961	1.918	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnc(OCF)cn1	1794410742	YHXRBDJWIPLHIJ-KOZDUTSQSA-N	435.283	1.222	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cncn1-c1ccncc1	1794467285	DHWVVGUSIXUYEZ-ZJOBFFGXSA-N	448.321	1.254	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cn1cncn1	1796288615	IRZYOBONBJRIGY-XGUBFFRZSA-N	440.932	1.048	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1(C)CCCC1)C2	1796440275	PLXJMDZNOKLADM-XLYDMXJNSA-N	429.521	1.290	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(C3CC3)on1)C2	1796889711	NOQFJUYNDVBBAU-XMOXNHLCSA-N	438.488	1.938	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnc3ccccn13)C2	1796892628	ZBJVIPIDKXXQNV-CKFWPPNZSA-N	447.499	1.720	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2c(cnn2C)c1	1797081855	UKIRZGRCZGYGOL-PTOXDTDZSA-N	449.349	1.808	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1=NO[C@@H](c3ccccc3)C1)C2	1797955842	IUOYXEUEQHATOX-SHJAMOMRSA-N	445.592	1.945	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(F)cnc1Cl	1798047533	NKNHGWZBICLJJT-ORXSELOVSA-N	434.693	1.861	50	20	IDGD	
Cc1ccn2c(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3cnccc3C(=O)NN)cnc2c1	1798442840	JGCFLWQHVGKGNU-MUJYYYPQSA-N	447.499	1.207	50	20	IDGD	
COc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)C(Cl)Cl)C3)cc1NC(C)=O	1798610783	JWTRLUUTVOCDLF-YWVIFJGQSA-N	444.315	1.661	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc(Br)nc1)C2	1799269096	SROJPLLPVNLTAT-LOUJCGABSA-N	444.757	1.994	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(Cl)nc3n[nH]cc13)C2	1799270256	VQHRFLSQXODDQF-FJHTZYQYSA-N	426.304	1.832	50	20	IDGD	
Cc1ccn2c(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@@H](F)Br)cnc2c1	1799347558	RYVMBJSERYFBDK-NOXHYTERSA-N	439.285	1.536	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccn3ccnc3c1)C2)[C@@H](F)Br	1799349785	LANZNMIYCQBARC-AYRXBEOTSA-N	425.258	1.228	50	20	IDGD	
COc1ccc2[nH]cc(/C=C/C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@H](O)CCl)C4)c2c1	1799387052	QURDTVATIFHCOL-KWHUGRLPSA-N	447.919	1.379	50	20	IDGD	
COc1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)ccc1C	1799720974	ZHLASFCORVETLX-BJWYYQGGSA-N	437.500	1.568	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccncn1)C2	1800333233	WWYZNSHOVJRYLI-AHHPBITISA-N	439.422	1.565	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COc1ccccc1F)C2	1800644457	URARAPTZUIIEAZ-AHXJXLJNSA-N	443.313	1.968	50	20	IDGD	
C=C(Oc1ccccc1O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)Br	1800757595	MPAIUPDDUSYCOZ-MBMVNNNZSA-N	439.306	1.658	50	20	IDGD	
CC(C)N1CCC(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)Br)CC1	1800757968	YNNVYFXROHJEOL-MXASKKJJSA-N	430.387	1.480	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCOc1ccccc1)C2	1800758105	PBDOJFOELPUDBR-ZXFNITATSA-N	425.323	1.829	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1c(F)cccc1Cl)C2	1800971372	WRIGSWWPXONSLJ-ABXQLRGKSA-N	433.307	1.865	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](N)c1cccc(Cl)c1)C2	1802332472	CLVHTFJNLBVCQA-CLWJZODNSA-N	435.956	1.351	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2nc(C)c(C)nc2O)[C@@H]1c1cccnc1	1804875816	WTXVMKXBDISXHE-RYRKJORJSA-N	447.923	1.767	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCCC2(CCN(C(=O)[C@H](C)NS(=O)(=O)CC)CC2)C1	1806154016	QWONPCZRWAXZIE-HOTGVXAUSA-N	436.018	1.953	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@@H](CNC(=O)CSC(=N)N)[C@@H]1c1cccnc1	1806996867	DUCHSRKZUXJPPP-ZLDLUXBVSA-N	442.383	1.745	50	20	IDGD	
C[C@@H]1CCC[C@@H]1C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1807377098	XOQUVLSYLWSIHZ-MWRLGJARSA-N	435.333	1.517	50	20	IDGD	
Cc1cnn(CC(=O)NC[C@@H]2CCN(C(=O)[C@@H](F)Br)[C@H]2c2cccnc2)c1	1807668581	NJTNLGSTQMGBBD-BHYGNILZSA-N	438.301	1.983	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)c1[nH]nc2ncccc12	1808104596	KJLYQURZJYSACY-YSVLISHTSA-N	428.880	1.272	50	20	IDGD	
CN1CCN(CC(=O)NC[C@@H]2CCN(C(=O)C(Cl)Cl)[C@@H]2c2cccnc2)CC1	1809607236	XDSUDZFEJHLYIQ-DOTOQJQBSA-N	428.364	1.139	50	20	IDGD	
CCS(=O)(=O)CC(=O)N1CC[C@H](CNC(=O)CO[Si](C)(C)C)[C@@H]1c1cccnc1	1810537923	QLJVDGZBMBFIIM-APWZRJJASA-N	441.626	1.374	50	20	IDGD	
Cn1ccc(=O)cc1C(=O)NC[C@H]1CCN(C(=O)CO[Si](C)(C)C)[C@@H]1c1cccnc1	1811369067	KDWOGFBHRUECET-DYESRHJHSA-N	442.592	1.951	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)c1cc2ncccc2[nH]1	1812074175	SLHHXGREUWEAGD-KYNGSXCRSA-N	427.892	1.877	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)Cc2cnccn2)[C@H]1c1cccnc1	1812864968	YWQRYWSUFXJSIX-JOQOYGCGSA-N	432.322	1.904	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)no1	1813070426	IWZOTNTURTZXSK-OXJNMPFZSA-N	428.493	1.071	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@H]2Cc3ccccc3CN2)[nH]n1)[C@@H](O)CCl	1814871477	PWLSOWCHDCQQOQ-KURKYZTESA-N	431.924	1.716	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1)[C@H]1COc2ccccc2O1	1815672127	JTTRUVONIVNYAK-GRDNDAEWSA-N	434.880	1.842	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnn4ncccc34)sc2C1	1816950235	PHQWEQYVJGHGNA-ZYHUDNBSSA-N	434.909	1.665	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CN2CCOCC2)n[nH]1	1817144187	GBOVUGGGVHLRBZ-DZGCQCFKSA-N	442.358	1.765	50	20	IDGD	
CCS(=O)(=O)CC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](F)Br)n[nH]1	1820931389	OKJUNEHTDVORCG-MFKMUULPSA-N	439.307	1.527	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](F)Br)n[nH]1	1820932769	PGYKXCRYLGXAHX-XRNSZHNASA-N	433.282	1.539	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2nc3ncccn3n2)[nH]n1	1822371434	WKAKZSPAECXGDN-AAEUAGOBSA-N	432.872	1.407	50	20	IDGD	
O=C1C[C@@H](C(=O)Nc2cc([C@H]3CCCCN3C(=O)CCBr)[nH]n2)CCN1	1822478027	FJWFJLKNZUBRJZ-WCQYABFASA-N	426.315	1.713	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)COc1cccnn1)CC2	1825648081	XVMAPKZKNPBBBJ-VHSXEESVSA-N	440.323	1.708	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@](C)(O)C(F)(F)F)CC2	1825993945	FVZZMSSNNVZMNM-RDOZXCAGSA-N	429.848	1.622	50	20	IDGD	
CC(C)(C)[C@H](O)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827055507	AHMTZEIAFHIFJQ-WOJBJXKFSA-N	430.354	1.007	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(F)nc3F)CCO2)C1	1829533723	OIIYEPNERYKPHL-APPDUMDISA-N	448.264	1.213	50	20	IDGD	
COc1ncc(Cl)cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1829584012	AWFIGNMTBDFLSA-GUYCJALGSA-N	436.267	1.348	50	20	IDGD	
O=C([C@H](F)Br)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1CCC(F)(F)C1)CCO2	1829654821	AIPSCNBUSDCWID-XUJVJEKNSA-N	443.260	1.569	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4cccnc4[nH]3)C2)C1	1830361698	AQODZIZJWZQMIE-NRFANRHFSA-N	434.924	1.898	50	20	IDGD	
CC(C)[C@H](C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1)c1ccccc1	1830719351	CCEBJYLCKCCYMV-DXIQSLLYSA-N	438.952	1.482	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC([C@H]2CCCCN2C(=O)Cn2ccncc2=O)CC1	1831107310	IUCYFCRDYCNUBK-GDBMZVCRSA-N	439.354	1.646	50	20	IDGD	
CC(C)[C@H](S)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)CBr)C2)C1	1831483000	JEHFRYOAYJYZBQ-KEYYUXOJSA-N	437.400	1.428	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc([N+](=O)[O-])o3)C2)C1	1831639141	MMHOHQPNVYAVJR-ACJLOTCBSA-N	429.857	1.665	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ncc(OC)cc3F)C2)C1	1831644208	RKFDVQHJLNKPSW-YWZLYKJASA-N	443.903	1.707	50	20	IDGD	
O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)c1ccccc1)CCO2	1832215055	AOTFNFHBBMZCTN-HKUYNNGSSA-N	443.313	1.939	50	20	IDGD	
C[C@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)[C@@H]3CCCN3C)CC2)CC1	1833265495	YXEKJQLDFUHTCK-QAPCUYQASA-N	443.430	1.683	50	20	IDGD	
O=C(Cc1cccnc1Cl)NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1833767479	YBILDLLCAABKBA-KRWDZBQOSA-N	443.375	1.449	50	20	IDGD	
COC(=O)CCC(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)CBr)CC2)CC1	1834431519	JKLOERLUKWUKHT-AWEZNQCLSA-N	446.386	1.542	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)c3cccc(F)c3)C2)C1	1834823991	PUCVRBWYJVIYCG-SFHVURJKSA-N	429.286	1.681	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)CCN3CCOC3=O)CC2)CC1	1835455162	PRSXTXLJVFRTHK-QGZVFWFLSA-N	428.961	1.418	50	20	IDGD	
CCc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](Br)CC)C3)C2)n[nH]1	1836281846	HLSBZOFQIQGFFJ-KSSFIOAISA-N	443.342	1.216	50	20	IDGD	
O=C(c1cc2cc(F)ccc2[nH]1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1836803281	AVDVQXMGTFUPAW-LPHOPBHVSA-N	427.835	1.911	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](C)CC(N)=O)CC2)CC1	1836911938	FFKNIICMSPOJCX-XJKSGUPXSA-N	446.386	1.670	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc4[nH]ncc34)C2)C1	1837711389	GGHJVXQAWKNUNB-OAQYLSRUSA-N	446.580	1.484	50	20	IDGD	
Cc1cc(C)nc(C(=O)N2CCOC[C@@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)c1	1837711872	UUNCHGBEGHCWGO-OAQYLSRUSA-N	435.597	1.620	50	20	IDGD	
Cc1ccc(C(=O)C(=O)N2CCOC[C@@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)cc1	1837715889	QHOOPJMAWOWZFJ-JOCHJYFZSA-N	448.592	1.486	50	20	IDGD	
C[C@@H](C(=O)N1CCC(OC2CCN(C(=O)[C@@H](F)Cl)CC2)CC1)n1ccccc1=O	1838082933	UWERUZFLZFMCOR-KBXCAEBGSA-N	427.904	1.942	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)cc1	1838984941	CHJAJYZRTPTOHF-DNVCBOLYSA-N	425.323	1.848	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3[nH]cnc3-c3cccnc3)C2)C1	1839145853	FRCJNVIJNKQBFR-KKSFZXQISA-N	447.923	1.559	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3nccc(Cl)c3OC)C2)C1	1839146387	NXMJOBIOVAXOSZ-YJYMSZOUSA-N	446.331	1.831	50	20	IDGD	
Cc1ccc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)cc1	1839199303	MKGXORQREYEMTI-PKOBYXMFSA-N	443.313	1.684	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cc(C)no3)C2)C1	1839962568	KSJJMGIWQGNHSO-YJBOKZPZSA-N	444.326	1.155	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3(C(F)(F)F)CC3)C2)C1	1840153320	KCYUWTIQGMSISR-WFASDCNBSA-N	428.835	1.039	50	20	IDGD	
O=C(c1cnc2ccoc2c1)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840187659	PFTKGKCKLYPJBH-GOSISDBHSA-N	428.272	1.702	50	20	IDGD	
O=C(c1cccc2ccnn12)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840189878	QYQDKZJONLJEJN-SFHVURJKSA-N	427.288	1.208	50	20	IDGD	
COc1ccc(COCC(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)cc1	1840253898	NWSLUNLFJGUYPT-AZUAARDMSA-N	444.887	1.203	50	20	IDGD	
O=C(c1c(Cl)cncc1Cl)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843009868	QKLJIHIUCVSMJB-UHFFFAOYSA-N	434.088	1.199	50	20	IDGD	
Cc1cn2c(=O)c(C(=O)N3CC4(CCCN4C(=O)CO[Si](C)(C)C)C3)cnc2s1	1844378084	CHFDVWBGVQZUAS-UHFFFAOYSA-N	434.594	1.733	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)CCCn2c(O)nc3ccccc32)C1	1845013442	WRPOKQNGTZJXLV-HNNXBMFYSA-N	434.924	1.979	50	20	IDGD	
CC(=O)N/C(=C\c1ccco1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](C)CBr	1847499980	BYMWVZOHJOPJAR-LMJRCUOOSA-N	438.322	1.989	50	20	IDGD	
C/C(=C/C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C(=O)O	1848099068	VIAPKHIDDLEBIO-SOQBPEJJSA-N	429.901	1.351	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)Nc2ccc(Cl)cc2)c1)C(=O)NC1CC1	10214433	PLPBPVAMUNYKCF-UHFFFAOYSA-N	436.877	1.180	50	20	IDGD	
CCn1c(NNC(=O)CN2C(=O)N[C@@](C)(c3ccc(C)cc3)C2=O)nc2ccccc2c1=O	10681809	ZXXYFZCJFASNPB-QHCPKHFHSA-N	448.483	1.635	50	20	IDGD	
CCn1c(NNC(=O)c2ccc(S(=O)(=O)NC(C)C)cc2)nc2ccccc2c1=O	11164009	FUYIVEHYSKNHBX-UHFFFAOYSA-N	429.502	1.860	50	20	IDGD	
CCOc1ccc(N2C[C@H](C(=O)NNC(=O)COc3ccccc3OC)CC2=O)cc1	15884722	NGOJXDQCISWIHB-OAHLLOKOSA-N	427.457	1.673	50	20	IDGD	
CCOc1ccc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1OCC	104557955	JYHLZLGCHIMOLT-IBGZPJMESA-N	444.440	1.628	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)c1sccc1S(=O)(=O)N1CCCC1	105562910	ULHBYWNUOXSJMJ-UHFFFAOYSA-N	437.543	1.935	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)N[C@@H]2CCc3nc(C)nn3C2)c2ccccc2c1=O	727229760	VJYOFJPXILWWNA-CQSZACIVSA-N	438.492	1.056	50	20	IDGD	
N#C/C(=C/c1ccc(N2CCOCC2)c(F)c1)C(=O)Nc1ccc(S(N)(=O)=O)cc1	727263541	CVFVOLWMMPSKIO-PTNGSMBKSA-N	430.461	1.855	50	20	IDGD	
CN1CCN([C@H](C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)c2ccccc2)CC1	727765756	QHKWVOJCTNAUJE-NRFANRHFSA-N	434.500	1.328	50	20	IDGD	
CN(C)N(C(=O)c1cccc(S(=O)(=O)N2CCCCCC2)c1)[C@H]1CCS(=O)(=O)C1	728178078	BFCKDTNRCGDSMV-KRWDZBQOSA-N	443.591	1.357	50	20	IDGD	
Cc1ccc(C(=O)NNS(=O)(=O)c2cc(Br)cc(C(=O)O)c2F)c(O)c1	728504646	TYCMWDFHBBISHI-UHFFFAOYSA-N	447.238	1.924	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)c2cc(F)ccc2Br)cc1C(N)=O	728514379	JUZXRWHPIOTVRB-UHFFFAOYSA-N	446.254	1.319	50	20	IDGD	
CCOC(=O)C1=NN(c2ccccc2)[C@@H](C(=O)NNC(=O)c2nnc(O)c3ccccc23)C1	728712855	HDPPDJPAGAOYPP-QGZVFWFLSA-N	448.439	1.294	50	20	IDGD	
COc1cc(C(C)=NNC(=O)C2CCN(c3ncccn3)CC2)ccc1S(C)(=O)=O	728782074	CLBMDOBTDTYTRI-UHFFFAOYSA-N	431.518	1.646	50	20	IDGD	
O=C1Nc2cc(Br)ccc2C1=NNC(=O)C1CCN(c2ncccn2)CC1	728783896	MCOHWCLJTISKLL-UHFFFAOYSA-N	429.278	1.928	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)C(=O)NCCCc2ccccc2)c2ccccc2c1=O	729281870	QVQAZSFCTVQWAW-UHFFFAOYSA-N	435.484	1.487	50	20	IDGD	
CCc1c(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)nnn1-c1cccc(Cl)c1	731471088	NUALTUGVIUMURL-UHFFFAOYSA-N	437.851	1.534	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2cc(C(=O)NNC(=O)C3CCC3)ccc2Cl)C[C@@H](C)O1	732141412	KSLBKXKZFVIVSO-TXEJJXNPSA-N	429.926	1.699	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cnc3cc(C)ccn3c2=O)cc1Br	732175745	PFRPXLSVHDKQCE-UHFFFAOYSA-N	431.246	1.849	50	20	IDGD	
O=C(COC(=O)C[C@H]1OCCc2ccccc21)NNC(=O)[C@H]1COc2ccccc2O1	734604899	CZDMIBPVNLUVRQ-RTBURBONSA-N	426.425	1.221	50	20	IDGD	
CCc1nc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)nn1-c1ccccc1	735462265	VKOXBJBKMFYWBG-UHFFFAOYSA-N	442.501	1.155	50	20	IDGD	
CCOc1ccc(-c2nnc(S)n2CCC(=O)NNc2ncnc3[nH]cnc23)cc1	740746646	ZBRGJBNDSUZUHY-UHFFFAOYSA-N	425.478	1.832	50	20	IDGD	
CN(CC(=O)NNC(=O)NCc1cccc(C(F)(F)F)c1)S(=O)(=O)c1ccccc1	742452615	AMZSAPBHNOKGHF-UHFFFAOYSA-N	444.435	1.857	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2ccc(C(=O)O)c(Cl)c2)cc(OC)c1OC	743252263	SZDDWFNQSDKZTI-UHFFFAOYSA-N	444.849	1.687	50	20	IDGD	
C[C@H]1Cc2cc(S(=O)(=O)NNC(=O)c3cc([N+](=O)[O-])ccc3O)cc(Cl)c2O1	743268043	BASHOAJLXNHBCQ-QMMMGPOBSA-N	427.822	1.901	50	20	IDGD	
C[C@H](CC(=O)NNC(=O)c1ccc(Cl)cc1O)/N=C1/NS(=O)(=O)c2ccccc21	743317094	DQZBOVCWDDBERY-SNVBAGLBSA-N	436.877	1.324	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1cccc(Br)c1)c1cccc(S(N)(=O)=O)c1	743506347	PBAYTSYYNIOIST-SNVBAGLBSA-N	441.307	1.802	50	20	IDGD	
CS(=O)(=O)Nc1cccc(C(=O)NNC(=O)c2cc(Br)ccc2O)c1	743731556	RTTSEFLFXAEXQR-UHFFFAOYSA-N	428.264	1.601	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)NCC2(O)CCS(=O)(=O)CC2)c(C)n1C[C@H]1CCCO1	743756748	QTVHOWGJBALNDQ-ZYNFKGNASA-N	435.546	1.247	50	20	IDGD	
Cc1cc(C)nc(SCC(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)n1	744621675	XZOSTCVLGLFAEG-UHFFFAOYSA-N	437.547	1.350	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)NCCCN1CCN(c2ccncc2)CC1	748344093	TVQKOBMKLHXICG-UHFFFAOYSA-N	446.939	1.900	50	20	IDGD	
CNS(=O)(=O)c1ccc(C(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)o1	748523315	PFFJZDZAMOLZTD-UHFFFAOYSA-N	427.382	1.238	50	20	IDGD	
NS(=O)(=O)c1ccc(NCCC(=O)NNc2cc(F)c(F)c(F)c2)c([N+](=O)[O-])c1	748813200	XIJOGSUXHZEOKE-UHFFFAOYSA-N	433.368	1.605	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNS(=O)(=O)c1cc(C(=O)O)cc(C)c1F	749142060	OEBQITLJFXCLQF-UHFFFAOYSA-N	426.422	1.620	50	20	IDGD	
CCNS(=O)(=O)c1ccc(C(=O)NNc2nc(Br)cn3ccnc23)cc1	750247552	DQBABSHFYONSLZ-UHFFFAOYSA-N	439.295	1.547	50	20	IDGD	
CO[C@H](C)c1nc(CN2CCCN(CC(=O)NNC(=O)c3ccc(F)cc3)CC2)cs1	752354162	COZRXTTVFFBGNE-OAHLLOKOSA-N	449.552	1.959	50	20	IDGD	
O=C(NNc1cccnc1Cl)c1ccc2c(c1)S(=O)(=O)N(C[C@H]1CCCO1)C2=O	754488102	RRIMNLLORDSRQU-GFCCVEGCSA-N	436.877	1.815	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCC(=O)NNc1nc(-c2cccnc2)no1	755308362	OPUGNBXTIJJNPE-CYBMUJFWSA-N	431.453	1.090	50	20	IDGD	
C#CCOCCC(=O)NNc1ccc(S(=O)(=O)Nc2ccc(OC)cc2)cc1[N+](=O)[O-]	755376869	SLCNLSZKLRPHOM-UHFFFAOYSA-N	448.457	1.887	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1ccc([N+](=O)[O-])cc1OC	755675158	TWZIMVKAEFJOCZ-UHFFFAOYSA-N	437.792	1.883	50	20	IDGD	
NC(=O)c1ccc(NNC(=O)[C@@H]2CCCN(C(=O)c3ccccc3OC(F)F)C2)nn1	757401771	FLFWHVJGACQOFT-LLVKDONJSA-N	434.403	1.172	50	20	IDGD	
O=C(NN=c1cc[nH]cc1Cl)c1ccc2c(c1)S(=O)(=O)N(C[C@H]1CCCO1)C2=O	757420064	LUUGCXROVIQEFG-GFCCVEGCSA-N	436.877	1.237	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)Cn2ccc3ccccc32)ccc1S(=O)(=O)N(C)C	757775084	DEWLKULUQBUVDF-UHFFFAOYSA-N	445.501	1.753	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1ccc(N2CCCCCCC2)c(F)c1	757994893	IUQSPKDGGHEUHM-CYBMUJFWSA-N	429.518	1.687	50	20	IDGD	
CN1C(=O)CCc2cc(C(=O)NNc3ccccc3S(=O)(=O)N3CCOCC3)ccc21	759230159	YHKAUKLRHACCKE-UHFFFAOYSA-N	444.513	1.373	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)N=c2cc[nH]cc2I)cc1	760024839	PDMMCDAWFNGCQS-UHFFFAOYSA-N	437.197	1.211	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)Cn2cnc(-c3ccccc3)n2)c2ccccc2c1=O	761198044	FSVMQDSWUAFCOU-UHFFFAOYSA-N	431.456	1.526	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C1CCN(C(=O)c2cccnc2)CC1	762372770	IQEOYOYZLKZXJA-UHFFFAOYSA-N	428.514	1.882	50	20	IDGD	
Cc1ccc(NC(=O)C2CC2)cc1NC(=O)C(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	763468913	XXCSFBQXDCXXDZ-UHFFFAOYSA-N	425.401	1.651	50	20	IDGD	
CCCOC(=O)c1cc(Br)ccc1NC(=O)C(=O)NNC(=O)c1cccnc1	763490872	DKKCSJUTXBYVTD-UHFFFAOYSA-N	449.261	1.811	50	20	IDGD	
CN(C)CCOc1cccc(NC(=O)C(=O)NNC(=O)c2cc3ccccc3cc2O)c1	763517397	JRVLFHLIQBYRQR-UHFFFAOYSA-N	436.468	1.886	50	20	IDGD	
CCc1nnc(-c2ccc(NC(=O)C(=O)NNC(=O)c3ccc(OC)c(OC)c3)cc2)o1	763551093	LGBBRWNJCGCNEK-UHFFFAOYSA-N	439.428	1.716	50	20	IDGD	
CCS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2cc(C)ccc2C)cc1	763669385	WZPGDVXBLKPGNM-UHFFFAOYSA-N	433.486	1.262	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccc(-c2nnnn2C2CC2)c1	763717248	SYELOBUASGGGCD-UHFFFAOYSA-N	449.471	1.402	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccnn1Cc1cccc(C)c1	763717546	ZOSSVOGHWCGXIS-UHFFFAOYSA-N	435.484	1.967	50	20	IDGD	
C=C(C)COc1cccc(NC(=O)C(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])c1	763802378	DCZDGNFKFONKRY-UHFFFAOYSA-N	428.401	1.715	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)cc1C(=O)NC(C)C	763841532	SJZSBBHKNAEOJR-UHFFFAOYSA-N	430.436	1.437	50	20	IDGD	
CN(C)c1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)c1cc(Br)c[nH]1	763998253	NWVCXDRLVYDZNK-UHFFFAOYSA-N	428.674	1.896	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)on2)ccc1F	764010801	DLHKAJJFNPLTNM-UHFFFAOYSA-N	426.360	1.667	50	20	IDGD	
C[S@@](=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cccc(Br)c2)cc1F	764059654	WAHIHDBCHDTUOE-AREMUKBSSA-N	442.266	1.725	50	20	IDGD	
COC(=O)c1c(C2CC2)csc1NC(=O)C(=O)NNC(=O)c1cccc(OC)c1O	764133094	ZZMHFGDNVGEZAU-UHFFFAOYSA-N	433.442	1.526	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2O1)C(=O)Nc1cnn(Cc2ccc(Cl)cc2)c1	764154716	UCTPRZOQVPTGGJ-GOSISDBHSA-N	439.859	1.674	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)c2c[nH]nc2C)sc2c1CC[C@H](CC)C2	764298545	WDUVTYOXITYOGR-NSHDSACASA-N	447.517	1.871	50	20	IDGD	
Cc1ccc([C@@H](CNC(=O)NNC(=O)CSc2ccccc2O)N2CCOCC2)o1	764321280	CQMFBCJXRVGRPR-OAHLLOKOSA-N	434.518	1.790	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)[C@H]1CCCN(c2nc3ccccc3s2)C1	764345845	YUKZAEAFDDPNOH-HNNXBMFYSA-N	438.513	1.485	50	20	IDGD	
CC(=O)NCc1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)cc1	764382667	OSEICWLEGZGTHW-UHFFFAOYSA-N	426.458	1.174	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)C(=O)Nc1cccc(N2CCCNC2=O)c1	764400610	FSHFZGLONOHPHC-UHFFFAOYSA-N	443.485	1.190	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)C(=O)Nc2ccn([C@@H](C)c3ccccc3)n2)c1	764433724	QWZFHQLCAAUZBO-ZDUSSCGKSA-N	435.444	1.246	50	20	IDGD	
COc1nccnc1NNC(=O)CCCS(=O)(=O)c1ccc(Br)cc1	764483826	HXVIPTYWNUHHIH-UHFFFAOYSA-N	429.296	1.945	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNS(=O)(=O)c3cc(C)c(F)c(C)c3)CC2)cc1	765125185	CSWBQCVMRIGFEE-UHFFFAOYSA-N	448.564	1.878	50	20	IDGD	
Cc1cc(S(N)(=O)=O)cc(C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)c1C	765317754	SKFBFVJFECYMDR-UHFFFAOYSA-N	428.511	1.017	50	20	IDGD	
CON(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)cc1	765566054	QZGQGLGFNKVTJW-UHFFFAOYSA-N	435.487	1.395	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NN=CC[C@H]1CCOC1)N(S(C)(=O)=O)CC2	765569563	KKTRCHKPOJBKFP-YOEHRIQHSA-N	439.534	1.481	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)c3cc(S(=O)(=O)NC)cs3)n[nH]2)cc1	765577811	ZONMDOZUOYPXQK-UHFFFAOYSA-N	433.515	1.684	50	20	IDGD	
COc1cccc(SCC(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)c1	765735355	KLLWDMGTBOPUDA-UHFFFAOYSA-N	442.541	1.393	50	20	IDGD	
CCCn1ncc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1C1CC1	766177658	PUVHUDMQKBHPBT-QGZVFWFLSA-N	428.445	1.315	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cc(C)[nH]n2)c([N+](=O)[O-])cc1OCc1cscn1	768276043	IIUYWORKJQOPRT-UHFFFAOYSA-N	432.418	1.745	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3ccc(-n4cnnc4)cc3)n[nH]2)cc1OC	768278709	JOCVMZQLHAWUGB-UHFFFAOYSA-N	433.428	1.749	50	20	IDGD	
COc1cccc(-c2nnc(SCC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)n2N)c1	768435445	VCAJZBZWMOHFHE-UHFFFAOYSA-N	443.445	1.129	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)c1cc(S(=O)(=O)N(C)C)c(C)o1	768628964	CPHGVHSMRSBVSS-UHFFFAOYSA-N	431.492	1.007	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c(C(C)(C)C)n1	768938707	PLBGHICQXCYTJF-UHFFFAOYSA-N	433.534	1.577	50	20	IDGD	
CC1(C)C(=O)Nc2ccc(C(=O)NNC(=O)CN3CCN(C(=O)c4ccccc4)CC3)cc21	769303054	YRRVDIADZFBEQX-UHFFFAOYSA-N	449.511	1.135	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCOCC2)cc1NC(=O)NNc1ccc(Cl)nn1	769925190	ICNGJMAUOHGPSE-UHFFFAOYSA-N	442.885	1.308	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)[C@H](CNC(=O)OC(C)(C)C)c3ccccc3)nc21	770979832	LMKQWCOBFHGERZ-CYBMUJFWSA-N	427.465	1.821	50	20	IDGD	
COc1ccccc1[C@]1(C)NC(=O)N(CC(=O)NNc2nc(-c3ccncc3)no2)C1=O	771424208	KADJTYJGBCUZGM-FQEVSTJZSA-N	437.416	1.051	50	20	IDGD	
O=C(NNc1ccnc(Br)c1)c1ccc(S(=O)(=O)N2CCOCC2)o1	771547260	NCUROWHWMCDRMF-UHFFFAOYSA-N	431.268	1.215	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNS(=O)(=O)c1c(F)cccc1[N+](=O)[O-]	771606915	KHXCYYOVKYYRDD-UHFFFAOYSA-N	430.801	1.013	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)C(=O)N2C[C@@H](CC(=O)N(C)C)c3cc(Cl)ccc32)n1	773479587	ARSWQHGMTRFLRL-CYBMUJFWSA-N	430.896	1.799	50	20	IDGD	
C[C@H]1C[C@H](C(=O)NNC(=O)CCc2ccco2)[C@H](C(=O)NNC(=O)CCc2ccco2)C1	775823927	KYOQKXVGNDDMMV-GJWQZFMSSA-N	444.488	1.395	50	20	IDGD	
CN(NC(=O)C[C@H](NC(N)=O)c1ccccc1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776205847	OYPVZGWFAQDXSY-INIZCTEOSA-N	448.524	1.422	50	20	IDGD	
CS(=O)(=O)c1ccc(OCCNC(=O)NNc2cccc(S(C)(=O)=O)c2)cc1	776619988	GEMIQIRYJZBWEI-UHFFFAOYSA-N	427.504	1.199	50	20	IDGD	
COc1cc(C(=O)N2CCN(S(=O)(=O)CBr)CC2)ccc1OC(C)C	777777029	CHVQFQZGIYRNCA-UHFFFAOYSA-N	435.340	1.922	50	20	IDGD	
Cc1ccc(Br)c(NS(=O)(=O)c2cccc(C(=O)NNC(=O)CO)c2)c1	777781936	ITPYWRHXZHMFIA-UHFFFAOYSA-N	442.291	1.312	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)N[C@@H]1CCn2ccnc2C1	779664783	BWDSZVCWQAQVBC-MRXNPFEDSA-N	446.533	1.017	50	20	IDGD	
CC[C@@H](C)NS(=O)(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(O)cc2)c1	782834384	UKDAPEPUCYUVMR-CYBMUJFWSA-N	448.501	1.010	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2ccccc2SCC(F)(F)F)CCS(=O)(=O)C1	783427271	NYBDFAYBQIHEBQ-CQSZACIVSA-N	425.454	1.478	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)C(=O)Nc2ccc(N3C[C@@H](C)O[C@H](C)C3)nc2)c1	784850698	ADRGNRSJRAZKEN-ZIAGYGMSSA-N	427.461	1.564	50	20	IDGD	
C[C@@H]1CN(S(=O)(=O)N2CCN(C(=O)/C(C#N)=C/c3ccc(F)cc3)CC2)C[C@@H](C)O1	785193958	USYRHTRZVRKHFP-JDPRVQSZSA-N	436.509	1.231	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)[C@@H]2CCN(C(=O)OC(C)(C)C)[C@H]2C)n1	786374749	ATNJCILRRJMOKN-QWHCGFSZSA-N	440.522	1.330	50	20	IDGD	
CSCC[C@@H](NC(=O)c1ccc([N+](=O)[O-])o1)C(=O)NNC(=O)NCc1ccccc1	787374955	UFJSBOFCQUTYRU-CYBMUJFWSA-N	435.462	1.570	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1N1CCNC1=O	787549624	OHCZXABNBCWSQI-UHFFFAOYSA-N	447.455	1.110	50	20	IDGD	
COc1cc2c(cc1S(=O)(=O)Nc1cccc(NC(=O)NN(C)C)c1)OCC(=O)N2	788205323	JNIYYFIWUMAEIU-UHFFFAOYSA-N	435.462	1.425	50	20	IDGD	
CC(C)[C@H](CNC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)c1ccnn1C	788322191	VCYOGDNEMXHJBK-FQEVSTJZSA-N	441.580	1.702	50	20	IDGD	
Cn1c(=NNC(=O)C(=O)Nc2ccc(Cl)c(S(C)(=O)=O)c2)sc2ccccc21	788338747	ZKUFGHHDBZPBGC-UHFFFAOYSA-N	438.918	1.867	50	20	IDGD	
CCOCCC=NNC(=O)C[C@H]1c2cc(OC)c(OC)cc2CCN1S(C)(=O)=O	788419819	BMEOXMIONRQVOH-INIZCTEOSA-N	427.523	1.481	50	20	IDGD	
C[C@@]1(C2CC2)NC(=O)N(c2ccc(CNC(=O)NNC(=O)Cc3cccnc3)cc2)C1=O	790709344	OJUTXNSQDCIPES-QFIPXVFZSA-N	436.472	1.380	50	20	IDGD	
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC[C@H](C(=O)NNc2cccc(F)c2[N+](=O)[O-])C1	791066403	HQRBEKQYYNFPOF-LBPRGKRZSA-N	440.457	1.618	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)CCc2cnc3ccccc3c2)c1	792017616	KPISGVKWLNRBPQ-UHFFFAOYSA-N	426.498	1.879	50	20	IDGD	
C[C@@H]1CN(S(=O)(=O)c2ccc(NC(=O)NNc3nc4ccccn4n3)cc2)C[C@@H](C)O1	792204780	CJBMEBVXABGBBP-ZIAGYGMSSA-N	445.505	1.676	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)cc(-n2cccn2)c1	792352729	HWPNPEKGYFCQKK-UHFFFAOYSA-N	429.820	1.640	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)cccc1NC(=O)N(C)C	792354824	CDJNWHDNTVTDFL-UHFFFAOYSA-N	433.852	1.847	50	20	IDGD	
Cc1cccnc1NNC(=O)C(=O)Nc1ccc(S(=O)(=O)N2C[C@H](C)O[C@H](C)C2)cc1	792375312	IEIJAUHXBVXOJP-GASCZTMLSA-N	447.517	1.270	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)nc1Br	793021396	DJPUFBAOCGRMML-SNVBAGLBSA-N	439.241	1.845	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)CCCCN1C(=O)c2ccccc2C1=O	795168730	SVJLGGWZVSVSTD-UHFFFAOYSA-N	444.513	1.847	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1cccc([N+](=O)[O-])c1OC	796309233	IMNUEAGMUCFOLA-UHFFFAOYSA-N	437.792	1.883	50	20	IDGD	
CSCc1ccccc1NC(=O)C(=O)NNC(=O)CNC(=O)OCc1ccccc1	797369411	VKSYKCCTMUIAJI-UHFFFAOYSA-N	430.486	1.562	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNC(=O)C(=O)Nc1cccc(-c2ncco2)c1	797369449	XPHOIZGQYXLIDM-UHFFFAOYSA-N	437.412	1.354	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNC(=O)Nc1ccc2c(c1)S(=O)(=O)CC2	797635320	JTHJTFBOCSRMNW-UHFFFAOYSA-N	432.458	1.096	50	20	IDGD	
CCn1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c(C(F)(F)F)n1	797789936	USBYILOMWBULSV-UHFFFAOYSA-N	433.412	1.247	50	20	IDGD	
O=C(CCCCC(=O)NN=C1CC(=O)N2CCCC[C@H]12)NN=C1CC(=O)N2CCCC[C@@H]12	799467258	IZVCVYKXRTWCIT-HDICACEKSA-N	444.536	1.061	50	20	IDGD	
CCOc1cc(/C=C(/C#N)S(N)(=O)=O)cc(Br)c1OCC(=O)N(C)C	799893486	HLIIUEZXPDSDJB-WZUFQYTHSA-N	432.296	1.468	50	20	IDGD	
O=C(N=c1cc[nH]cc1)NNC(=O)c1ccc(=O)n(CCOc2ccccc2Cl)c1	802028875	DKGKLFIJNYQNDV-UHFFFAOYSA-N	427.848	1.864	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2ccc3c(c2)C(=O)N(C[C@H]2CCCO2)C3=O)cc1	802056752	AHKGRWXLZRGJOJ-MRXNPFEDSA-N	438.440	1.937	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)[C@H]2CCN(c3ccc4c(c3)OCCO4)C2=O)cc1	802063029	QVDJHVJBGLWTLK-MRXNPFEDSA-N	426.429	1.672	50	20	IDGD	
COc1ccc(C2=NO[C@H](CNC(=O)NNC(=O)COc3ccccc3O)C2)cc1C	802349234	OOUNYLBFHQJXMU-HNNXBMFYSA-N	428.445	1.612	50	20	IDGD	
C#Cc1cc(F)c(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(OCC)cc2)c(F)c1	802566236	FNHNOZXARNFAEQ-LBPRGKRZSA-N	431.395	1.898	50	20	IDGD	
COC(=O)c1c(F)cc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)cc1F	802576551	VUSSCTPTQDMNPY-GUYCJALGSA-N	447.394	1.410	50	20	IDGD	
Cc1c(C(F)(F)F)nn(C)c1NC(=O)C(=O)NNC(=O)CN1CCCc2ccccc21	806974082	SVRRKXTYXOTNNP-UHFFFAOYSA-N	438.410	1.286	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c(Cl)cc1F	806978435	BEJVRSVTDVXSEH-UHFFFAOYSA-N	434.859	1.580	50	20	IDGD	
CCC(C)(C)[C@H]1CCc2nc(NC(=O)C(=O)NN[C@]3(C)CCS(=O)(=O)C3)sc2C1	807001176	RTALZCIMVLHHJF-HXPMCKFVSA-N	442.607	1.821	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCCC2)cc1	807371213	GUMJGQQOYDTLRI-UHFFFAOYSA-N	441.550	1.340	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)NCc2ccncc2OC[C@H]2CCOC2)c1	807615497	HVEWFZNZUUVBFT-AWEZNQCLSA-N	430.461	1.658	50	20	IDGD	
CCCNS(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)CCOc2ccccc2)cc1	808086241	VTHTULPVOUQWLJ-UHFFFAOYSA-N	441.531	1.154	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)CCCNC(=O)NC2CCCCC2)cc1	812726923	MLQUFWACDXGYEZ-UHFFFAOYSA-N	425.555	1.792	50	20	IDGD	
O=C(NNC(=O)c1cccnc1)C(=O)Nc1cc(Cl)ccc1I	815563679	KUWXSVWDJAQUIP-UHFFFAOYSA-N	444.616	1.739	50	20	IDGD	
COc1ccc2cc(NC(=O)C(=O)NNc3ccccc3S(=O)(=O)N(C)C)ccc2n1	815751547	DJBPJWVKHCAWJB-UHFFFAOYSA-N	443.485	1.576	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)CSc2nnnn2C2CC2)c1	818767464	JHJGNUOJEKAUCL-UHFFFAOYSA-N	427.284	1.793	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNC(=O)CNS(=O)(=O)c2ccc(C#N)cc2)cc1	913524858	YLHGZWRBMMIYGA-UHFFFAOYSA-N	444.513	1.723	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C[C@@H](NC(N)=O)c2cccc(C)c2)c2ccccc2c1=O	913632681	OFAIPUAWYTXWFI-QGZVFWFLSA-N	436.472	1.286	50	20	IDGD	
CNC(=O)c1ccc(CNC(=O)NNC(=O)COc2ccc(Br)cc2)cc1	914544849	LTSFPWOYYTVEFL-UHFFFAOYSA-N	435.278	1.718	50	20	IDGD	
C[C@@H]1CN(Cc2ccc(C(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)cc2)C[C@@H](C)O1	914781876	UFAYBSZUGPXKOD-HZPDHXFCSA-N	449.511	1.618	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)[C@H]2CCCCN2S(=O)(=O)c2cccs2)c1	915695490	JLZXQVKPJJUHDF-MRXNPFEDSA-N	437.543	1.826	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NC[C@@H]2CN(Cc3ccccc3)CCO2)cc1OC	915895260	YYDFBOCAJWMEJP-GOSISDBHSA-N	428.489	1.549	50	20	IDGD	
CCCCS(=O)(=O)N1CCC[C@@H]1C(=O)NNC(=O)[C@@H](C)Oc1ccc(OCC)cc1	916036898	GUOBOJFZIXACQJ-CRAIPNDOSA-N	441.550	1.594	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)NCc2ccccc2S(=O)(=O)N(C)C)cc1C	916237606	FZARAYWXDMFIEF-UHFFFAOYSA-N	447.517	1.023	50	20	IDGD	
CC(=NNC(=O)c1cccc([N+](=O)[O-])c1)c1ccc(S(=O)(=O)NCCC(=O)O)cc1	916245780	ZCEUXZYZJVLFDH-UHFFFAOYSA-N	434.430	1.502	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)NCCc1cn2ccccc2n1	916247172	FKSKEMUQHNIYQB-UHFFFAOYSA-N	435.532	1.420	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NCCCN2CCc3ccccc3C2)c2ccccc2c1=O	916459267	PXSVCWNVWOYWCZ-UHFFFAOYSA-N	434.500	1.326	50	20	IDGD	
O=C(NCc1ccc(S(=O)(=O)NC[C@H]2CCCO2)cc1)NNc1cccc([N+](=O)[O-])c1	916649711	QDMZIMHPXICTRA-QGZVFWFLSA-N	449.489	1.878	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1F)c1ccc(S(=O)(=O)N2CCCC2)cc1	917393235	GEQDUSPBAZTGKQ-UHFFFAOYSA-N	436.421	1.593	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cc(F)cc3nccnc23)cc1	917522779	QOXHSEPORKPHTF-UHFFFAOYSA-N	431.449	1.159	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNS(=O)(=O)c2cccc(Cl)c2F)ccc1Cl	917725032	FXBAYKXZDGKALJ-UHFFFAOYSA-N	442.277	1.403	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)c2cc(Br)c[nH]2)c2cccnc12	917733562	VMLZWKRUZVCIHN-UHFFFAOYSA-N	425.264	1.957	50	20	IDGD	
CNC(=O)COc1cccc(CNC(=O)NNC(=O)c2ccc(OC(C)C)c(OC)c2)c1	918019392	QGXFZPMMWVYDID-UHFFFAOYSA-N	444.488	1.751	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@H]2CCCCN2C(=O)c2ccco2)cc(OC)c1OC	918399741	UVTJXFGBMHECHH-CQSZACIVSA-N	431.445	1.761	50	20	IDGD	
CCCC[C@H](NC(N)=O)C(=O)NNC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1	920884927	UCUUNBQPDBMCST-KRWDZBQOSA-N	435.488	1.922	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)[C@H](CSC)N2C(=O)[C@@H]3CCCC[C@H]3C2=O)c1	929085884	RBZCPXIXOBGLPO-ZACQAIPSSA-N	449.529	1.372	50	20	IDGD	
O=C(NNC(=O)c1cncn1-c1ccccc1)N[C@@H](CN1CCOCC1)c1ccccc1	1248696295	OEEPLPDTJAHHQR-FQEVSTJZSA-N	434.500	1.890	50	20	IDGD	
COc1cc(C=NNC(=O)C[n+]2ccccc2)cc(I)c1OC	1318033023	OQWMTPKOOOPKJF-UHFFFAOYSA-O	426.234	1.746	50	20	IDGD	
CNS(=O)(=O)c1ccc(Br)c(C(=O)NNC(=O)c2ccc(C#N)cc2)c1	1318068556	SYDWLJYCIPXSPD-UHFFFAOYSA-N	437.275	1.304	50	20	IDGD	
O=C(NCc1cc(OCC(F)F)ccn1)NNC(=O)c1csc(N2CCOCC2)n1	1320005054	HFKKWACYJMIKFS-UHFFFAOYSA-N	442.448	1.163	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(-n3cncn3)c1)C2)[C@H](F)Cl	1778028468	KCQCJJPWMCVPGZ-FUHIMQAGSA-N	435.887	1.929	50	20	IDGD	
CC(C)n1cnc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)CCBr)C3)n1	1778283004	PDYAFBAZEOIPHQ-RDTXWAMCSA-N	442.358	1.772	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccn4nccc4c3)C2)C1	1778727134	CAPLHWIHXVUPJI-KUHUBIRLSA-N	435.322	1.809	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@]2(C1)CN(C(=O)C13CCC(CC1)CC3)CCO2	1779035012	ZSMXVYCNNPCDFV-AWYJXPRZSA-N	441.532	1.099	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnc(O)[nH]2)C1	1779780847	HHRQRPJWPFJOST-XTQGRXLLSA-N	429.315	1.416	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@]3(CN(C(=O)CCBr)CCO3)C2)nn1C(F)F	1780301149	BRFVUENZZKKKEX-INIZCTEOSA-N	435.269	1.815	50	20	IDGD	
O=C(C(Cl)Cl)N1CCO[C@@]2(CCN(C(=O)C3CCN(c4ccccn4)CC3)C2)C1	1780963062	YMDKKXNFUVGHBJ-HXUWFJFHSA-N	441.359	1.932	50	20	IDGD	
CN(C)c1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)nc1	1781228610	VRXOMFVXGIQUIO-RBUKOAKNSA-N	429.348	1.827	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Cl)C2)[C@H]1C[C@@]12C(=O)Nc1ccccc12	1781980679	XKXNRKDUPSYWBQ-NKFCYASASA-N	449.910	1.945	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCc1ncc[nH]1)C2	1782002597	RYPGEWCFAVBMTL-HBUWYVDXSA-N	427.343	1.640	50	20	IDGD	
CSCC[C@H](O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@](C)(Cl)CCl)C2	1782232283	FHXYEPMHJUFZDX-MJSCVDMRSA-N	441.421	1.851	50	20	IDGD	
CCSc1ncccc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21	1783410532	GEZJFFKPEFWTSI-TUUVXOQKSA-N	427.954	1.387	50	20	IDGD	
COC(=O)[C@H]1CC[C@H](C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](C)Br)C3)C2)CC1	1783529200	GEHJOQVAEAZSEA-XMDUPGNXSA-N	445.354	1.579	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H]1CCc3nc[nH]c3C1)CCO2	1783540427	WKFIIAYSCINTFH-ZJNRKIDTSA-N	425.327	1.128	50	20	IDGD	
O=C(CCc1ccc(F)c(F)c1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21	1783799456	HCHOPOGKFSLWGC-ZZCKCESHSA-N	430.879	1.477	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1CCc3ccccc3[C@H]1O)CCO2	1783870524	CSWPBVXDYMNELM-MOXWOTFGSA-N	436.936	1.366	50	20	IDGD	
CC(C)[C@@H](C(=O)N1CCO[C@@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1)c1ccccc1	1783933207	RUTFULQCEVAROR-ISKFKSNPSA-N	444.576	1.629	50	20	IDGD	
CCc1[nH]nc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]3C2)c1F	1783969348	LJXUJOSCERIKAJ-UHXUPSOCSA-N	445.333	1.736	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/c3ccc(O)cc3Cl)C[C@@H]21)[C@@H](O)CCl	1784094911	VATDLPDZMINGEF-FSIDXWPRSA-N	443.327	1.638	50	20	IDGD	
COC(=O)CSCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]21	1784512012	PVXBZMHUILJOFK-MRHIQRDNSA-N	441.377	1.109	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3n[nH]c(C)c3F)[C@H]2C1	1785764793	AFWZWTKBWFCBAH-RVMXOQNASA-N	431.306	1.624	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)c3ccccc3)[C@H]2C1	1786669273	XDLYWPSBEHKVHX-VFTHGPRRSA-N	425.323	1.483	50	20	IDGD	
C[C@H](Br)C(=O)NC1(c2ccc(NC(=O)CN3CC(=O)NC3=O)cc2)CCC1	1786686914	OGRRUYLHXQDBTM-NSHDSACASA-N	437.294	1.456	50	20	IDGD	
O=C(NC1(c2ccc(NC(=O)[C@H](O)c3ccccc3)cc2)CCC1)c1cccc(B(O)O)c1	1787857518	DJKPVDMMASCKFT-JOCHJYFZSA-N	444.296	1.848	50	20	IDGD	
Cc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)Br)C[C@@H]32)nn1C(F)F	1789330019	HQDXBCAEARNFMR-UHXUPSOCSA-N	449.296	1.963	50	20	IDGD	
COc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]3C2)ccn1	1789870439	HARJFWXLWAJSFS-XLPNERPQSA-N	430.332	1.920	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CCC[C@@H](C(=O)OC)C1)C2	1793453432	ZPUWINAAODZQJE-RFSXOUPVSA-N	428.957	1.963	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cc(F)ccc1Cl	1793738843	FIEIAAZDAITAEA-ZDFLXESQSA-N	433.307	1.865	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccnc(F)c1	1793790066	OGOMPERLOVQVOU-TWXBYECESA-N	426.452	1.607	50	20	IDGD	
O=C(CCc1cc(F)ccn1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2	1794026495	IZPWUNOVVUYUET-OJXGSEEGSA-N	432.265	1.433	50	20	IDGD	
Cc1nnc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@](C)(Cl)CCl)C3)s1	1794107754	PRUOZDAVNNKWHO-DJZPMSPPSA-N	435.377	1.605	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(-n3cccn3)cc1)C2	1795115113	JXMBLKYPGKXLAH-HGKCTWBKSA-N	447.333	1.861	50	20	IDGD	
COc1cc(F)ccc1CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1	1796192348	BZRUUGFRSURJEB-ACDBMABISA-N	440.280	1.009	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1cn2ccsc2n1	1797485886	MCCIGRJXNQZNAN-RBLKWDMZSA-N	431.287	1.290	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1C[C@@]13C(=O)Nc1ccccc13)C2	1799269763	FABVMPSXWMICKI-LPYJRYEISA-N	431.920	1.503	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)nc(Cl)c1)C2	1800639228	LYHSCSMZIVTPLY-NWJSVONSSA-N	446.729	1.817	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CCc3ccoc3C1)C2	1800754512	QEURBBHWWKOILC-MSJOGUNTSA-N	425.323	1.758	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1coc([Si](C)(C)C)c1)C2	1800759093	HDWWFGAPBIRKPM-OEYIWLLWSA-N	443.414	1.811	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc3ncccc3c1)C2	1800971057	OXUSBUGVJQKENQ-BMQTXXJKSA-N	431.920	1.621	50	20	IDGD	
COCCOCCOCCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@](C)(Cl)CCl)C2	1802086187	SNDXMNCLIYULHY-RCJHGTSTSA-N	439.380	1.931	50	20	IDGD	
COC[C@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H]1CC(=O)N(Cc3ccccc3)C1)C2	1802269473	GQPMPWRZJABMAA-OBKDMQGPSA-N	447.963	1.927	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CNC(=O)C(F)(F)F	1802376386	WSCKLUUSSDVOEO-CHWFTXMASA-N	428.249	1.334	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccn3cncc3c2)[C@H]1c1cccnc1)[C@@H](O)CCl	1803142778	IZGXAUMNKKEIKC-WDSOQIARSA-N	427.892	1.649	50	20	IDGD	
Cc1cc(F)c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)cc1F	1803658593	ISMBSEAGEFYOIZ-BTTYYORXSA-N	443.454	1.837	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC2(CCN(C(=O)CN3CCN(C)CC3)CC2)C1	1805384214	LSESVEVSSJGKOA-QGZVFWFLSA-N	443.430	1.496	50	20	IDGD	
CC(=O)N1CC[C@@H](CNC(=O)CN(C)NC(=O)NCc2ccccc2)[C@@H]1c1cccnc1	1807453116	NCQFBNFLVHKMIK-UNMCSNQZSA-N	438.532	1.454	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@H]1CCN(C(=O)C2=NNC(=O)C2)[C@H]1c1cccnc1	1808305757	AFHAUSWOLFYLPZ-MRAWALMUSA-N	426.304	1.200	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)c3cccn4cncc34)CC2)C1	1809978774	QFLCADSJDNNJNY-UHFFFAOYSA-N	446.316	1.173	50	20	IDGD	
O=C(CS[C@@H]1CCCCO1)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1	1810343421	VSWAVTRVIOEPKA-ISARSNTHSA-N	441.981	1.947	50	20	IDGD	
Cn1ccc(=O)cc1C(=O)N1CC[C@@H](CNC(=O)CO[Si](C)(C)C)[C@@H]1c1cccnc1	1810543636	DEPZKTLUOITZST-UWJYYQICSA-N	442.592	1.951	50	20	IDGD	
C#CC(=O)NC[C@@H]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2OC(C)=O)[C@H]1c1cccnc1	1812530405	AXXPRWHMUODRBV-KKSFZXQISA-N	436.424	1.868	50	20	IDGD	
Cc1ncc(C(=O)N2CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)s1	1813070219	HFWBZESMRJWAKS-OXJNMPFZSA-N	444.561	1.539	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)COC(=O)C(F)(F)F)[C@@H]1c1cccnc1)C(Cl)Cl	1813077402	ICMGGZBDJOBGCF-ZYHUDNBSSA-N	442.221	1.997	50	20	IDGD	
O=C(/C=C/c1ccco1)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1	1815350568	YBSRKWPFGIAJHZ-HEWZJLJBSA-N	437.286	1.355	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)Cn3cc(Cl)cn3)sc2C1	1815413881	LRHPKQXOXWAXBF-QWRGUYRKSA-N	432.333	1.859	50	20	IDGD	
O=C(CCC(=O)N1CCCC1)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1	1815639330	XLZCGDWUXHOTSU-LSDHHAIUSA-N	425.917	1.404	50	20	IDGD	
CCC(=O)C(=O)N[C@@H]1CCc2nc(NC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)sc2C1	1817282788	MEGXCPQLYNTGTB-BPDROILWSA-N	430.490	1.168	50	20	IDGD	
CC[C@@H](NC)C(=O)Nc1cc([C@H]2CCCCN2C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[nH]n1	1817462580	FRICTEQCTYHBBD-VBANEENCSA-N	442.524	1.534	50	20	IDGD	
Cc1ncc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cnccc3C(=O)NN)n[nH]2)[nH]1	1819401827	UNXPLFIBDSMETP-INIZCTEOSA-N	437.464	1.059	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)/C=C/c2cccnc2)[nH]n1	1822410590	MEFFRBYFGZOJMB-MZEUMTGBSA-N	439.520	1.883	50	20	IDGD	
Cc1n[nH]c(C)c1CC(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1	1822415507	KATOPLJVYWAUGP-QGZVFWFLSA-N	444.540	1.357	50	20	IDGD	
C[C@@H](C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1)n1cccn1	1822416736	MMVGLVJZLDBCPU-HOCLYGCPSA-N	430.513	1.233	50	20	IDGD	
C[C@H](C(=O)N[C@H]1CCc2nc(NC(=O)[C@](C)(Cl)CCl)sc2C1)n1cnnn1	1822869928	PAJLWAIZJTZCPR-CEFVDNRUSA-N	432.337	1.539	50	20	IDGD	
C=CCO[C@H](C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1	1824504506	PZNYLQLKXZNMFZ-DYESRHJHSA-N	428.338	1.191	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)C[C@@H]2NC(=O)NC2=O)CC1	1824610130	WVLVZGNITDYPRV-HRCADAONSA-N	426.945	1.612	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CN1CCCC1=O)CC2	1825640634	BULGDDMZICDHLJ-NXEZZACHSA-N	429.340	1.461	50	20	IDGD	
COCCn1nccc1C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](Cl)COC)sc2C1	1825999305	UPNDYEWRCZRVPI-RYUDHWBXSA-N	441.941	1.466	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H]2CCC(=O)N2)CC1	1826536909	JVHWTKPPYGRNNX-CWRNSKLLSA-N	428.371	1.916	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCC([C@H]2CCCCN2C(=O)CN)CC1	1826809446	SYMDTHDTTKZRSJ-JKSUJKDBSA-N	430.977	1.697	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)COc3ccccc3OC)CCO2)C1	1830229621	XZUNYFUGIUWLFK-KKSFZXQISA-N	440.924	1.548	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cn4ccccc4n3)C2)C1	1830362289	QBLSWZHDUWBOFD-NRFANRHFSA-N	434.924	1.669	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(O)c(F)c3)C2)C1	1830363644	GHSLQGCLGFDPFQ-HXUWFJFHSA-N	428.888	1.866	50	20	IDGD	
Cc1cc(Cl)cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)c1	1830738601	QMYPWJHDCVLXJZ-LPHOPBHVSA-N	431.316	1.318	50	20	IDGD	
CC(F)(F)C(C)(C)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCBr)C2)C1	1831678417	DPGJAXPLQOOQJB-QGZVFWFLSA-N	441.313	1.909	50	20	IDGD	
C[C@@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1)C1(O)CCC1	1831870179	SDSSEOJFEHGLRY-PKOBYXMFSA-N	436.597	1.530	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(CN(C(=O)CCc3cccs3)CCO2)C1	1833157774	SVAZADKESLZGBJ-FQEVSTJZSA-N	440.638	1.989	50	20	IDGD	
CC(C)c1cc(C(=O)N2CCC(N3CCC(NC(=O)[C@H](O)CCl)CC3)CC2)on1	1833311944	GLKBLDVSHXVOKS-QGZVFWFLSA-N	426.945	1.583	50	20	IDGD	
Cc1cnc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)s1	1833804446	VWHQTDXKGDYLBL-NHYWBVRUSA-N	436.303	1.212	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)c3ccno3)CC2)CC1	1834183365	KINRYHZSUISSRJ-ZDUSSCGKSA-N	427.343	1.891	50	20	IDGD	
CC(C)NCCC(=O)NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1	1834782469	HABMWTBCWVCICP-KRWDZBQOSA-N	435.382	1.637	50	20	IDGD	
C[C@H](C(=O)N1CCC(N2CCC(NC(=O)[C@H](F)Cl)CC2)CC1)n1ccccc1=O	1835083978	DIWYQLLGFVQPKB-KDOFPFPSSA-N	426.920	1.515	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCC(N2CCC(NC(=O)/C=C\C(=O)NC3CC3)CC2)CC1	1835657766	IDOUKONTXPGLEF-WAYWQWQTSA-N	439.000	1.658	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3ccc(F)nc3C)CC2)CC1	1836030536	LBSSVXWIJCYKSG-SFHVURJKSA-N	440.947	1.968	50	20	IDGD	
O=C(CCc1c[nH]c2ccccc12)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1	1836104864	WQJUMABYFXTBBB-KNQAVFIVSA-N	449.935	1.157	50	20	IDGD	
O=C([C@@H](O)CCl)N1CCC(OC2CCN(C(=O)[C@@H]3CCc4ccoc4C3)CC2)CC1	1836713599	HXFKHXSFZDFFED-APWZRJJASA-N	438.952	1.983	50	20	IDGD	
CCC(=O)N[C@H](C)C(=O)N1CCC(OC2CCN(C(=O)[C@H](Cl)COC)CC2)CC1	1836818606	QRNYIGBQTGIKDL-RHSMWYFYSA-N	431.961	1.154	50	20	IDGD	
COc1ccc2[nH]cc(C(=O)N3CCO[C@]4(COCCN(C(=O)[C@@H](F)Cl)C4)C3)c2c1	1836923812	VKWPNRYGKNOQOZ-YLJYHZDGSA-N	439.871	1.781	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3c(C)nn(C)c3C)CC2)CC1	1836958715	GFNFFCYWJPGZQO-GOSISDBHSA-N	440.972	1.903	50	20	IDGD	
CC(C)O[C@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1	1837601909	HGVJPNKMOMZGMI-JLSDUUJJSA-N	425.353	1.493	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)ccn1	1837940673	LTJVUUYFVYVQIG-PBHICJAKSA-N	430.274	1.151	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3c(F)cccc3F)CCO2)C1	1838995865	WKWNSIGURANALM-FOIQADDNSA-N	430.879	1.981	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccc(F)c(F)c3)C2)C1	1839143215	OTUUCVCNSMQVEG-MGPUTAFESA-N	430.879	1.981	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3CCC=CO3)C2)C1	1839964983	KGLLOZHONLMQNX-MPGHIAIKSA-N	431.327	1.309	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3cccc(F)c3F)CCO2)C1	1839982753	ZEGNLEFBVUVGPC-QRWLVFNGSA-N	430.879	1.981	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3(c4ccccc4)CC3)C2)C1	1840149412	ONHPVWNTCJQAIF-NQIIRXRSSA-N	436.936	1.428	50	20	IDGD	
CCc1cnc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](Cl)COC)CCO3)s1	1840153192	GZHAQKPEBYNTHW-RDTXWAMCSA-N	431.942	1.029	50	20	IDGD	
CCOc1cccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](Cl)COC)CCO3)c1	1840154124	LWXBVZKXWYTDSW-WIYYLYMNSA-N	440.924	1.409	50	20	IDGD	
Cn1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)c(C(F)F)n1	1840187554	JAKVTPJWGAKVPB-MRXNPFEDSA-N	441.262	1.231	50	20	IDGD	
Cc1ccc(CCC(=O)N2CCO[C@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)c(C)n1	1840338940	GOIYVDSAHOIISU-HXUWFJFHSA-N	444.359	1.891	50	20	IDGD	
CC(C)(C)OC(=O)NC12CC(C(=O)N3CC4(CCCN4C(=O)[C@@H](O)CCl)C3)(C1)C2	1841353614	HDSDZGWAASPMRA-MDAWKPQNSA-N	427.929	1.237	50	20	IDGD	
CCOC(=O)c1c(CCC(=O)N2CCCC23CN(C(=O)[C@@H](O)CCl)C3)c[nH]c1C	1841454950	KWCHIHWOWVMBKN-HNNXBMFYSA-N	425.913	1.236	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC12CN(C(=O)C1(c3ccc(Cl)cc3)CC1)C2	1843012122	FXNCGJHSFILNMC-UHFFFAOYSA-N	438.720	1.569	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)c1nccn1C)C2	1844692189	RSCCHAMTBAQPIM-UHFFFAOYSA-N	427.417	1.384	50	20	IDGD	
Cc1onc(-c2ccncn2)c1C(=O)N1CC2(CCCN2C(=O)[C@@H](F)Br)C1	1845218670	UETZAKCPZQTFQU-CQSZACIVSA-N	438.257	1.948	50	20	IDGD	
CCOC(=O)c1cccc(C(=O)N2CC3(CCCN3C(=O)CCC(=O)NN(C)C)C2)c1F	1846385223	GEJRGNNRILIYNU-UHFFFAOYSA-N	448.495	1.192	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H]1CCCCO1	1847309780	FNIKKBHZGKLEFC-LNLFQRSKSA-N	431.445	1.905	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cc(C)nc3onc(C)c23)cc1	14335585	PMFOXEJMGHWDGL-UHFFFAOYSA-N	431.474	1.230	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)OCC(=O)NC(=O)NCC(F)(F)F)c1C	16905146	OAINQXFHQPNFBR-VGOFMYFVSA-N	430.383	1.590	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)NCCC(=O)NNC(=O)COc2cc(C)ccc2C)cc1	17202883	BUNFTJMCHFHAJY-UHFFFAOYSA-N	447.513	1.401	50	20	IDGD	
COc1ccc(N2C(=O)/C(=C\NNC(=O)c3cnccn3)c3ccccc3C2=O)cc1OC	23608008	NWEADIHVLILWTL-ATVHPVEESA-N	445.435	1.956	50	20	IDGD	
O=C(CCNS(=O)(=O)c1cccc(Cl)c1)NNC(=O)c1cc(Br)c[nH]1	24124267	CVFYKAMIRFDIIP-UHFFFAOYSA-N	449.714	1.560	50	20	IDGD	
O=C(COC(=O)CCn1cnc2ccccc2c1=O)NNC(=O)c1ccc(Cl)cc1	26124469	QJQGYBOHBRBGCE-UHFFFAOYSA-N	428.832	1.444	50	20	IDGD	
O=C(CNC(=O)c1cccc([N+](=O)[O-])c1)NNC(=O)c1ccc(COc2ccccc2)o1	26632131	HPXBDBOYWKHDIW-UHFFFAOYSA-N	438.396	1.958	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc(Br)cc1)NNC(=O)c1ccccc1F	26691483	HLCJYFLBRZERNH-UHFFFAOYSA-N	444.282	1.718	50	20	IDGD	
C[C@H](NC(=O)c1ccccc1)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	27228895	DQDXJDJQUBMPRN-HNNXBMFYSA-N	444.513	1.051	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(F)cc2)C1)NC1CCCCC1	725988358	CIUXWXBIVUUKNE-AWEZNQCLSA-N	426.514	1.890	50	20	IDGD	
CNS(=O)(=O)c1cccc([C@@H](C)NC(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)c1	727608612	BHUVWCYTAFLUHJ-OLZOCXBDSA-N	438.481	1.593	50	20	IDGD	
O=C(NNc1nc(-c2ccccc2)no1)c1cccc(S(=O)(=O)N2CCOCC2)c1	728081328	QYGBVERYTOBHSM-UHFFFAOYSA-N	429.458	1.514	50	20	IDGD	
CN(C)N(C(=O)c1ccc2c(c1)S(=O)(=O)c1ccccc1C2=O)[C@H]1CCS(=O)(=O)C1	728178963	NEFRYBOPUQPQFV-AWEZNQCLSA-N	448.522	1.170	50	20	IDGD	
COc1cccc(N2CC[C@H](NC(=O)NNC(=O)COc3ccccc3[N+](=O)[O-])C2)c1	728221560	ZUAZECDANRKMMG-AWEZNQCLSA-N	429.433	1.592	50	20	IDGD	
CC(C)(C)n1nc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1C1CC1	728329894	XKYSDNBDMLSUNO-SFHVURJKSA-N	442.472	1.660	50	20	IDGD	
COc1cccc2c1OC[C@@H](NC(=O)NNc1ccc(S(=O)(=O)NC(C)C)cn1)C2	728398245	CKVXFQXURHBHHU-AWEZNQCLSA-N	435.506	1.407	50	20	IDGD	
COc1cc([N+](=O)[O-])c(C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1SC	728463965	KTEBISMPRABXBL-UHFFFAOYSA-N	439.471	1.804	50	20	IDGD	
O=C(NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12)c1ccc([N+](=O)[O-])[nH]1	729298309	ASDFIXLJSCYBEZ-UHFFFAOYSA-N	432.396	1.756	50	20	IDGD	
C[C@H]1CC(C)(C)C[C@]2(C1)NC(=O)N(CC(=O)NNC(=O)Cn1ccc3ccccc31)C2=O	729450441	VFRZQPJKQDAAFC-WNSKOXEYSA-N	439.516	1.926	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)NCCCN1C(=O)NC2(CCCCC2)C1=O	729495188	RDKPLYVZLITZGC-UHFFFAOYSA-N	440.504	1.617	50	20	IDGD	
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC(=NNC(=O)Cn2ccc3ccccc32)CC1	729638289	YVKXGKJLANYTLU-UHFFFAOYSA-N	428.518	1.938	50	20	IDGD	
CCOc1cc(C(=O)NNC(=S)Nc2ccc(OC)nc2)ccc1OCC(=O)OC	729691689	NDTDVNIYDLVRDQ-UHFFFAOYSA-N	434.474	1.672	50	20	IDGD	
COc1cc(C(=O)NN=Cc2ccc(OCC(=O)O)c([N+](=O)[O-])c2)cc(OC)c1OC	731560721	YKBUVEIQGZOCDY-UHFFFAOYSA-N	433.373	1.848	50	20	IDGD	
CNS(=O)(=O)C1CCN(C(=O)/C(C#N)=C\c2cc(C)n(C[C@H]3CCCO3)c2C)CC1	732126149	CAJOEQPFVPBULL-XLXASQRYSA-N	434.562	1.731	50	20	IDGD	
Cc1cc(C)c(N2C[C@H](C(=O)NNC(=O)CCN3C[C@H](C)O[C@@H](C)C3)CC2=O)c(C)c1	732261984	PYSIHTXDOUUQLM-GBESFXJTSA-N	430.549	1.611	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)N[C@@H](Cc2ccccc2)CN2CCOCC2)cc1	732476461	KHDGNUFBIORMIL-FQEVSTJZSA-N	437.500	1.211	50	20	IDGD	
CSCC[C@@H](NC(=O)Cc1ccccc1)C(=O)NNC(=O)c1cccc(N(C)C)c1	732751049	IZPHYIODBLTYBA-LJQANCHMSA-N	428.558	1.994	50	20	IDGD	
Cc1nc(S(=O)(=O)N2CCN(C(=O)c3c(C)nn(CCCl)c3C)CC2)cs1	733930939	IIXRNJKCLZLDSA-UHFFFAOYSA-N	431.971	1.650	50	20	IDGD	
Cc1cc(NNC(=O)CCCCCNS(=O)(=O)c2ccc3c(c2)OCCO3)ncn1	734255490	JCWDRNXKFMYQPG-UHFFFAOYSA-N	435.506	1.538	50	20	IDGD	
O=C(NNc1ncc(C(F)(F)F)cc1Cl)N[C@@H]1CCN(CCN2CCOCC2)C1	734685790	HQWPTPUOFNCOQP-CYBMUJFWSA-N	436.866	1.786	50	20	IDGD	
Cc1cc(CN2C(=O)c3ccccc3C2=O)cc(C(=O)NNC(=O)c2cnn(C)c2)c1O	735443905	JGXPJAALXLXLSW-UHFFFAOYSA-N	433.424	1.305	50	20	IDGD	
O=C(NNc1ccc(Cl)nn1)C1CCN(S(=O)(=O)c2cccnc2Cl)CC1	735686760	DCEVSDYQNCWCMP-UHFFFAOYSA-N	431.305	1.722	50	20	IDGD	
CCCC(=O)N1CSC[C@@H]1C(=O)OCC(=O)NNC(=O)c1cc(C)c(CC)s1	736819972	XPNYTXFKODWPQI-GFCCVEGCSA-N	427.548	1.625	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNS(=O)(=O)c1ccc(Br)cc1Cl	740812637	SBPSGXUMUVMTAU-UHFFFAOYSA-N	426.720	1.717	50	20	IDGD	
COCC[C@@H](Cc1cccc(Br)c1)C(=O)NNC(=O)C(=O)N1CCCC1	741209003	BLZMKFACQVZGDZ-AWEZNQCLSA-N	426.311	1.414	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)N2CCCC2)cc(C)c1OCC(=O)N1CCCCC1	741684014	UOKZLPIRXDHLBE-UHFFFAOYSA-N	430.505	1.078	50	20	IDGD	
O=C(C[C@H](C(=O)NN=C/C=C/c1ccco1)N1CCOCC1)NN=C/C=C\c1ccco1	741767192	RPYGMPFOANMKKB-ZTQZDPDTSA-N	439.472	1.894	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CSc2nnc(-c3cccc(Cl)c3)n2N)c1	741842161	JVIRCXODWXPLBA-UHFFFAOYSA-N	427.877	1.737	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)[C@@H](C)NC(=O)c1cc2c(C)nn(C)c2s1	742032863	CVKRJKNHNYLVOA-GFCCVEGCSA-N	445.501	1.297	50	20	IDGD	
O=C(NNC(=O)c1sccc1S(=O)(=O)N1CCSCC1)c1ccc(Cl)nc1	742331776	ACJYFOQSHYMPHL-UHFFFAOYSA-N	446.963	1.609	50	20	IDGD	
C[C@H](CC(=O)NNC(=O)[C@@H](C)Oc1ccc(F)cc1)/N=C1/NS(=O)(=O)c2ccccc21	742478391	NPGBFJNIFFKARM-CHWSQXEVSA-N	448.476	1.258	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNS(=O)(=O)c1c(Cl)cc(Cl)cc1[N+](=O)[O-]	743260324	AQQIYIRNGSINQQ-UHFFFAOYSA-N	427.266	1.516	50	20	IDGD	
COc1ccc([C@@H](Cc2ccccc2C)NC(=O)NNC(=O)C(=O)NC2CC2)cc1OC	743341993	YEWXGRDOTWDKOW-GOSISDBHSA-N	440.500	1.905	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CN2CCN(c3ncc(Cl)cc3Cl)CC2)c1	744387777	XVOXYXKABQAPDB-UHFFFAOYSA-N	433.299	1.843	50	20	IDGD	
CC(=O)N1c2ccccc2C[C@H]1C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	744621736	FRBPBARZLHGTIZ-IBGZPJMESA-N	444.513	1.128	50	20	IDGD	
O=C(NC[C@H]1CCN(CCc2ccccc2)C1)NNC(=O)c1cc([N+](=O)[O-])ccc1O	745802253	DNBUZBLNFLYRJC-MRXNPFEDSA-N	427.461	1.809	50	20	IDGD	
CC[C@@H](NC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)c1ccncc1	745835798	DCPHXNBGHAQTPR-QGZVFWFLSA-N	433.538	1.190	50	20	IDGD	
COc1ccc(Cn2ncc3cc(C(=O)NNC(=O)N4CCOCC4)cnc32)c(OC)c1	745988289	XFIZGZFUPKYWAQ-UHFFFAOYSA-N	440.460	1.183	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)NCc1ccc(-n2ccc(C(F)(F)F)n2)cc1	748624708	JHHGJHIRDKMDDC-LBPRGKRZSA-N	429.399	1.773	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)o1	748639549	JBEOKSBZEVPMCI-UHFFFAOYSA-N	448.457	1.370	50	20	IDGD	
Cc1nccn1C[C@H](C)CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	749196034	JTJKCXJFSJFZQY-OAHLLOKOSA-N	448.549	1.256	50	20	IDGD	
Cc1nnc2ccc(C(=O)NNC(=O)c3cccc(S(=O)(=O)N4CCCCC4)c3)cn12	749715433	IPCNSWHTXGOSGD-UHFFFAOYSA-N	442.501	1.287	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)CNS(=O)(=O)c2ccc(Br)s2)cc1	749850342	SCLHHQKWEDSXRA-UHFFFAOYSA-N	443.304	1.122	50	20	IDGD	
CCN1CCN(CCC(=O)NNC(=O)c2nc(-c3ccccc3)n(-c3ccccc3)n2)CC1	750662182	AXWYBIAJHBCWAG-UHFFFAOYSA-N	447.543	1.723	50	20	IDGD	
Cc1ccc(C(=O)N[C@H](C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)C(C)C)cc1	750668105	BAXYMMQOXAGYHU-SFHVURJKSA-N	435.484	1.458	50	20	IDGD	
O=C(NN=C1C(=O)N(Cc2ncon2)c2ccc(Br)cc21)N1CCOCC1	750935522	BUKMRWSLTWKRHO-UHFFFAOYSA-N	435.238	1.125	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)[C@H]1CCCN(C(=O)c2ccc(Cl)cc2)C1	751206288	CCHQLGAINBIXSE-AWEZNQCLSA-N	432.864	1.363	50	20	IDGD	
CCOc1ccc(C(=O)NNS(=O)(=O)c2cnn(Cc3ccccc3)c2)cc1OC	751264596	WFUQZFUYJBHBFM-UHFFFAOYSA-N	430.486	1.962	50	20	IDGD	
N#Cc1ccc(S(=O)(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1C(F)(F)F	751518228	SOPLXJGSQRMYDH-UHFFFAOYSA-N	427.360	1.972	50	20	IDGD	
O=C(NCc1nccn1CCCc1ccccc1)NNC(=O)c1ccc(-n2cnnn2)cc1	751607208	QDQMJEGZLVTHSS-UHFFFAOYSA-N	445.487	1.636	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)[C@@H]2CC(=O)N(c3cc(OC)cc(OC)c3)C2)cc1	752294477	OIBLTCCXAGBSDB-MRXNPFEDSA-N	441.484	1.846	50	20	IDGD	
O=C(NNC(=O)C(=O)Nc1ccccn1)N[C@@H]1CCC[C@H]2CN(Cc3ccccc3)C[C@@H]21	753314976	CUKAZVKKKTZVNX-GBESFXJTSA-N	436.516	1.651	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)c3cc(S(=O)(=O)N(C)C)c(C)o3)n[nH]2)cc1	754013393	CYVVSBXTZQNMKX-UHFFFAOYSA-N	431.474	1.612	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)c2cc(S(N)(=O)=O)oc2C)c1	754199097	CRVMRNZUFBEWJP-UHFFFAOYSA-N	432.252	1.081	50	20	IDGD	
CS(=O)(=O)c1ccc(-n2nnnc2COC(=O)/C(C#N)=C/c2ccc(O)cc2)cc1	754546452	NTPYCOHQXDXNNT-GXDHUFHOSA-N	425.426	1.422	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)Cn2nc(-c3ccc([N+](=O)[O-])cc3)oc2=O)cc1C	755249219	UJWSUCFIAMAHIC-UHFFFAOYSA-N	431.430	1.805	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1	755434112	JKMDTINAUFROHT-OAHLLOKOSA-N	442.538	1.456	50	20	IDGD	
CN(C)c1ccc(S(=O)(=O)N2CCCCC2)cc1NC(=O)NNC(=O)c1ccc[nH]1	755435862	PKIBJOJBNDBOJP-UHFFFAOYSA-N	434.522	1.722	50	20	IDGD	
COc1cc(OC)cc(C(=O)NN=Cc2cc(OC)c(OCC(=O)O)cc2[N+](=O)[O-])c1	755536984	RVOYIBNMTPAVDM-UHFFFAOYSA-N	433.373	1.848	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)Nc1cccc(OCC(=O)N2CCCC2)c1	755657123	NCPDICIPSMAGPP-UHFFFAOYSA-N	442.472	1.928	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2coc(S(=O)(=O)N(C)C)c2)cc1Br	755883912	WZTYYMCRJOKOPY-UHFFFAOYSA-N	446.279	1.376	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)N1CCC[C@H]1Cn1cnc2ccccc21	756063199	NSEDXLIVLPPDDA-AWEZNQCLSA-N	426.502	1.733	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)Nc2ccc(S(=O)(=O)NC3CC3)cc2)c1	756776810	RPKMVZANXZSYHH-UHFFFAOYSA-N	432.502	1.976	50	20	IDGD	
CCOC(=O)[C@@H](C)NC(=O)c1ccc(NC(=O)NNC(=O)c2ccc3c(c2)OCO3)cc1	756790613	PJWNHVZJVOODHM-GFCCVEGCSA-N	442.428	1.563	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)CN1C(=O)NC2(C[C@H](C)C[C@@H](C)C2)C1=O	756871197	QPJCNNQRXZIVLS-CHWSQXEVSA-N	426.477	1.150	50	20	IDGD	
NC(=O)c1ccc(NNC(=O)[C@H]2CCCN2C(=O)c2ccc(Br)cc2)nn1	757403833	GNRGXRQYVLMEHS-CYBMUJFWSA-N	433.266	1.086	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)[C@@H](Sc1ccc(F)c(F)c1)c1ccccc1	758035872	ODEGYRWZVFXURB-BZNIZROVSA-N	443.497	1.883	50	20	IDGD	
CN(NC(=O)c1cnn(-c2ccc(F)cc2)n1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758788568	ZMNWBMOJUYZDQH-UHFFFAOYSA-N	447.471	1.656	50	20	IDGD	
C[C@H](c1ccccc1)[C@@](C)(O)C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	759555586	HGKGCRMVFVVESO-JPEVHGAISA-N	428.441	1.072	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2ccnn2[C@H](C)C2CC2)n[nH]1	760289023	AUICVQANAYKXJC-GFCCVEGCSA-N	437.460	1.653	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2c(C)nn(CC(F)F)c2C)c2ccccc2c1=O	760618580	FCWOWITZSWFGSE-UHFFFAOYSA-N	432.431	1.960	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)N[C@H]1CCCN(c2ccn(C)n2)C1=O	761717610	MFVOMVDPBUZEFW-ZDUSSCGKSA-N	432.506	1.047	50	20	IDGD	
O=C(NNC(=O)c1ccccc1O)C(=O)Nc1cc(Cl)ccc1C(=O)N1CCCC1	763527917	LTQYEBVAGGQTHT-UHFFFAOYSA-N	430.848	1.681	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)NC(C)C)cc2C)cc1OC	763543190	MJTKXLOELRKZSY-UHFFFAOYSA-N	442.472	1.550	50	20	IDGD	
COC(=O)C(C)(C)c1ccc(NC(=O)C(=O)NNC(=O)c2c(C)nc3ccccn23)cc1	763628141	GAHGZZQHSDTLRQ-UHFFFAOYSA-N	437.456	1.493	50	20	IDGD	
O=C(COc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1ccccc1O[C@@H]1CCOC1	763686717	QNWOUTJEISKAHU-OAHLLOKOSA-N	433.848	1.673	50	20	IDGD	
Cc1ccc(-c2nnco2)cc1NC(=O)C(=O)NNC(=O)CN1CCCc2ccccc21	763745784	KRUKDPUJMLPWMT-UHFFFAOYSA-N	434.456	1.584	50	20	IDGD	
C[C@H]1COCCN1c1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)cc1	763839864	NCAAIOUFFHINQZ-AWEZNQCLSA-N	430.436	1.216	50	20	IDGD	
CCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)cc1	763847498	CIHSSMZETHQKFM-HNNXBMFYSA-N	426.473	1.607	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccccc1O[C@H]1CCOC1	763866624	XBJRFUFOKRHXPR-KGLIPLIRSA-N	431.420	1.547	50	20	IDGD	
COC(=O)c1c(F)cccc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccc(C(C)=O)cc1	763878688	SPWPSYBFEPWIDJ-LBPRGKRZSA-N	445.403	1.368	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)C(=O)Nc1ccc(C(=O)N2CCCCC2)c(Cl)c1	763992701	HHJVDZSSIDMWSW-UHFFFAOYSA-N	431.880	1.704	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)C(=O)Nc1cccc(OCCNC(=O)OC(C)(C)C)c1	763998026	CWSYRYVIHUOJBZ-UHFFFAOYSA-N	445.476	1.328	50	20	IDGD	
Cc1cnc(O)n1-c1ccccc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccccc2)on1	764016248	KFVFROBSTZLPSL-UHFFFAOYSA-N	446.423	1.941	50	20	IDGD	
O=C(NNC(=O)c1cccc(Br)c1)C(=O)Nc1ccccc1Cn1cncn1	764062751	CNWZPZUOXKGORP-UHFFFAOYSA-N	443.261	1.489	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(-c3noc(C)n3)c2)o1	764139531	XCLAPACHRJHROR-UHFFFAOYSA-N	440.460	1.880	50	20	IDGD	
CC(=O)N(C)c1cccc(NC(=O)C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)c1	764203383	LTZBWPQEKPSXNX-UHFFFAOYSA-N	435.481	1.060	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)C(=O)Nc1ccc2nc(N3CCOCC3)oc2c1	764320463	YHRJQPQRVWLBAO-UHFFFAOYSA-N	441.419	1.132	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)c1cc(-c2ccco2)nn1-c1ccccc1	764343137	LMUOCVXOPJTAPL-UHFFFAOYSA-N	430.424	1.718	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)c(Cl)c1)C(=O)Nc1ccc(C(=O)N2CCCC2)cc1	764349142	FJRKAAFALIYRJT-UHFFFAOYSA-N	430.848	1.681	50	20	IDGD	
C[C@@H]1Oc2ccc(NC(=O)C(=O)NNC(=O)c3cc(-c4cccs4)[nH]n3)cc2NC1=O	764383222	YPVFVSJLQZRBJP-VIFPVBQESA-N	440.441	1.257	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)C(=O)Nc1cccc(OC[C@@H]2CCCO2)c1	764400812	IBTCCVMNLMXIPX-INIZCTEOSA-N	445.497	1.828	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)[C@@H](C)S(=O)(=O)C1CCOCC1	764566249	KTMBXXJPUCFNNR-CYBMUJFWSA-N	437.543	1.862	50	20	IDGD	
C=C(C)Cn1c(SCC(=O)NNC(=O)Cn2nc(C)cc2C)nnc1-c1ccco1	764567549	ZSHVEZKDQDLESI-UHFFFAOYSA-N	429.506	1.867	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)N[C@@H]2CCc3n[nH]cc3C2)c2ccccc2c1=O	767109436	SWELRPIABYENBP-OAHLLOKOSA-N	437.504	1.811	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)CCC(=O)N1CCc2sccc2C1	767301322	ZSHHQQUQHKVOLP-UHFFFAOYSA-N	443.525	1.655	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)Cn3c(O)nc4ccccc4c3=O)n[nH]2)cc1C	768264258	WLEGAANXTHYBMU-UHFFFAOYSA-N	432.440	1.570	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)[C@H](CCSC)NC(=O)c1ccco1	768634264	HMNWBZSKBOZWCE-LBPRGKRZSA-N	441.531	1.687	50	20	IDGD	
CCCn1c(CCC(=O)NN(C)C(N)=O)nc2cc(S(=O)(=O)N(CC)CC)ccc21	770531998	IBGFFEMZDKVGOI-UHFFFAOYSA-N	438.554	1.451	50	20	IDGD	
Cn1cc([C@H](NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c2ccc(F)cc2)cn1	773133265	XRWUBGKWJHTBMX-GOSISDBHSA-N	435.423	1.269	50	20	IDGD	
O=C(CCN1C(=O)CNC1=O)Nc1ccc(NC(=O)NNc2cnc3ccccc3n2)cc1	775763938	XHOBPPYHTIBNGQ-UHFFFAOYSA-N	448.443	1.659	50	20	IDGD	
CC[C@H](C)C(=O)N1CCC[C@@H](C(=O)N2CCN(S(=O)(=O)CBr)CC2)C1	777836304	IKBIONTZSWWJIM-UONOGXRCSA-N	438.388	1.098	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2ccnc(OC(C)C)c2)n[nH]1	778714543	RYKCISZZCNHJAT-UHFFFAOYSA-N	438.444	1.667	50	20	IDGD	
CC[C@H](C)NS(=O)(=O)c1ccc(C(=O)NNC(=O)CCNC(=O)OC(C)(C)C)cc1	780971270	MNUSKHOWGVKFOC-ZDUSSCGKSA-N	442.538	1.439	50	20	IDGD	
CCC1(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)CCN(C(=O)c2ccccc2)CC1	781238362	IUXYOZWSUDJOJM-UHFFFAOYSA-N	447.499	1.756	50	20	IDGD	
Cc1cc(C(=O)N2CCC[C@@H](C)C2)ccc1NC(=O)C(=O)NNC(=O)c1ccc(O)cc1	782830054	CYZNPGWAAZZHNR-CQSZACIVSA-N	438.484	1.972	50	20	IDGD	
Cc1ccc(I)cc1NC(=O)C(=O)NNC(=O)c1ccc(O)cc1	782832136	MLUDMTFODBVUKP-UHFFFAOYSA-N	439.209	1.705	50	20	IDGD	
COc1cc2c(cc1NC(=O)C(=O)NN=c1sc3ccccc3n1C)NC(=O)CC2	783350167	WJJWSXYAXFFKLN-UHFFFAOYSA-N	425.470	1.704	50	20	IDGD	
CNS(=O)(=O)c1cc(NC(=O)C(=O)NN=c2sc3ccccc3n2C)ccc1C	783351406	FKNPRWXYQIFLLF-UHFFFAOYSA-N	433.515	1.027	50	20	IDGD	
COCCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)Nc2ccccc2C)cc1Cl	783410791	JPHMHJCZYGUIDX-UHFFFAOYSA-N	447.879	1.816	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1ccc2c(c1)OC1(CCCC1)O2	784005315	VFCJUXHXSMGDMC-UHFFFAOYSA-N	444.469	1.306	50	20	IDGD	
CCc1c(C(=O)NNC(=O)c2nnc(O)c3ccccc23)nnn1Cc1ccc(F)cc1	784771374	KUDAYAHEOXXJRD-UHFFFAOYSA-N	435.419	1.752	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)C2(Cc3ccccc3F)CC2)CC1	785977943	QETBRKCSQCAHJV-UHFFFAOYSA-N	447.536	1.623	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2ccc(C)cc2O)cc1S(=O)(=O)N1CCCC1	786128859	LKCOXHDUARASMM-UHFFFAOYSA-N	448.501	1.960	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1ccnc(Cl)c1I	786891060	PRMIZGDABTWRTC-LURJTMIESA-N	425.610	1.442	50	20	IDGD	
COc1cccc(C[C@@H](C(=O)NNC(=O)NCc2ccc(Cl)cc2)n2nnnc2C)c1	787436136	NDTOFQKPMNFKPQ-SFHVURJKSA-N	443.895	1.958	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2cccnc2C(F)(F)F)CC1	788588846	WVVVNMHPNNYGHU-UHFFFAOYSA-N	444.439	1.188	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)CCn1c(=O)nc(O)c2ccccc21	789333565	BNQKUBYOWCJAJK-UHFFFAOYSA-N	434.456	1.252	50	20	IDGD	
CCOc1ccc(NC(=O)NNc2ncccc2C)cc1S(=O)(=O)N1CCOCC1	792217430	DVURPBMSPWQJKW-UHFFFAOYSA-N	435.506	1.958	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1)c1ccc2c(c1)OCO2	794181142	SLCPENLYBFHBLH-SECBINFHSA-N	425.850	1.281	50	20	IDGD	
COc1cccc(CCC(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)c1F	794779047	CRFAGSURZYSGGL-UHFFFAOYSA-N	429.857	1.529	50	20	IDGD	
O=C(O)Cn1cc(C=NNC(=O)Cc2csc(N3CCOCC3)n2)c2ccccc21	799872704	XHRUVUXBGAWETD-UHFFFAOYSA-N	427.486	1.712	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@]1(C)CCN(CC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)C1	801573767	OKJMJPPJXGFMAK-FQEVSTJZSA-N	435.481	1.593	50	20	IDGD	
Cc1nc(-c2ncccn2)sc1C(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	802067062	JUDVAQZSONHGRJ-UHFFFAOYSA-N	432.487	1.779	50	20	IDGD	
COc1ccc(Cl)c(NC(=O)NNC(=O)c2nc(S(C)(=O)=O)n3ccccc23)c1	802115162	UEYREZJSYOFBNX-UHFFFAOYSA-N	437.865	1.866	50	20	IDGD	
CC1(C)CC(=O)c2cc(NC(=O)C(=O)NNc3cccc(S(C)(=O)=O)c3)ccc2O1	806968638	MONOXAURMXDEDU-UHFFFAOYSA-N	431.470	1.916	50	20	IDGD	
N#Cc1ccc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)cc1Br	806980929	ZMRRFWXMFYXPFX-UHFFFAOYSA-N	449.286	1.905	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)c1cc([C@H]2CCN(C(=O)OC(C)(C)C)C2)[nH]n1	807371143	CJZVYOCMVLXLDL-ZDUSSCGKSA-N	439.513	1.684	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)C(=O)Nc1ccc(Oc2cccnc2)cc1	808939060	MDNCJVIFQSKOCP-UHFFFAOYSA-N	430.424	1.850	50	20	IDGD	
CC(=O)N1C[C@H]2[C@@H](NC(=O)NNc3nc(O)c4cnn(C(C)(C)C)c4n3)CCC[C@H]2C1	812434768	UCVZCSWMBBZDKL-CFVMTHIKSA-N	430.513	1.560	50	20	IDGD	
COC(=O)c1cc(Br)cc(C(=O)NNC(=O)CCN2C[C@H](C)O[C@@H](C)C2)c1	812451590	IOYAAKHICJOFKT-RYUDHWBXSA-N	442.310	1.496	50	20	IDGD	
C[C@H]1C[C@H](NC(=O)NNC(=O)COc2ccccc2F)c2ccsc2S1(=O)=O	812655933	DRBDNNNKIUYFQN-GWCFXTLKSA-N	427.479	1.904	50	20	IDGD	
CCNC(=O)COc1ccc(NC(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)cc1	812918055	ATQIOSJENMVJEE-UHFFFAOYSA-N	435.506	1.600	50	20	IDGD	
Cc1cccc(C(C)C)c1NNC(=O)C(=O)Nc1cccc(C(=O)N(C)CC(N)=O)c1	813049843	NZNVNQUHYRZFLR-UHFFFAOYSA-N	425.489	1.758	50	20	IDGD	
CC(C)(C)OC(=O)N1CC([C@H](F)C(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)C1	813508324	GAYFWHSLFMVUNG-AWEZNQCLSA-N	442.875	1.309	50	20	IDGD	
CN(C)c1ncc(C=NNC(=O)c2ccc(NN=Cc3cnc(N(C)C)nc3)cc2)cn1	814701865	HYPRZYACSQJKCK-UHFFFAOYSA-N	432.492	1.609	50	20	IDGD	
Cn1cnn(CCC(=O)NNC(=O)c2ccc(COc3ccc(Cl)cc3)cc2)c1=O	814722660	JWDZPDIMJQTFIU-UHFFFAOYSA-N	429.864	1.666	50	20	IDGD	
Cc1ccc(-c2csc(NC(=O)C(=O)NNC(=O)[C@@H]3CCc4nncn4C3)n2)cc1C	815692917	FRCSGMPYKKFQCJ-CQSZACIVSA-N	439.501	1.367	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1cccnc1-c1cnn(C)c1	816828868	SFVJUTIDDCWSCK-UHFFFAOYSA-N	427.490	1.158	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc2nc(O)cc(C(=O)NNc3ncncc3F)c2c1	817079914	BRKBQJLVMFCMTK-UHFFFAOYSA-N	434.453	1.657	50	20	IDGD	
CC(C)(C)C(=O)NCCC(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	877232747	SOFUHYGRIHZVFE-UHFFFAOYSA-N	449.515	1.702	50	20	IDGD	
NC(=O)[C@H]1CC(C(=O)NNC(=O)CCSc2ccc(F)cc2)=NN1c1ccc(F)cc1	913082145	NZGQEXHIEFMISK-QGZVFWFLSA-N	447.467	1.715	50	20	IDGD	
C[C@H]1CN(c2ccc(C(=O)NNC(=O)c3nn(-c4ccccc4)cc3O)cn2)C[C@H](C)O1	914865278	LVWCMEGOBIBIJN-GJZGRUSLSA-N	436.472	1.661	50	20	IDGD	
CN(C)[C@@H](CNC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)c1cccc(F)c1	915901077	MXZHGVSDQPZVLN-KRWDZBQOSA-N	426.452	1.320	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)c2cn(-c3ccccc3)nc2-c2ccccc2)c(O)nc1=O	916101654	XKPGXGUGUTXUFW-UHFFFAOYSA-N	430.424	1.413	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)c1nnc2ccccn12	916221981	NEJWSVQJYIRNSJ-KRWDZBQOSA-N	436.520	1.333	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccc(C)cc3)CC2)cc1OC	917108697	QKVSVGTUMZRILH-UHFFFAOYSA-N	440.500	1.231	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)COc1ccccc1C#N)c1cccc(NS(C)(=O)=O)c1	918086797	PUSVZYMWZBAVFE-CYBMUJFWSA-N	431.474	1.400	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCCOC2CCCCC2)cc1	918135631	RQCAYADBNAZATH-UHFFFAOYSA-N	426.539	1.295	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)NCCS(=O)(=O)c2ccccc2)cc1	918229566	IYDYUERWBLVXEQ-OAHLLOKOSA-N	435.502	1.657	50	20	IDGD	
O=C(CC(F)(F)F)NNC(=O)C1CCN(c2ccc3nnc(C(F)(F)F)n3n2)CC1	918364598	PMQKLRRMICBJBC-UHFFFAOYSA-N	439.320	1.459	50	20	IDGD	
O=C(COC(=O)c1cnn(-c2ccccn2)c1C(F)(F)F)NNC(=O)c1cccs1	919124282	QEQVOTYCTGVCGR-UHFFFAOYSA-N	439.375	1.966	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)c1ccc2c(c1)C(=O)N(C[C@@H]1CCCO1)C2=O	919819942	AHQUEBHFJRLGQZ-INIZCTEOSA-N	437.452	1.474	50	20	IDGD	
Nc1cnnc(NNC(=O)NCCCCN2CCN(Cc3ccccc3)CC2)c1Cl	1253131562	LFNHYTVAKNSXPR-UHFFFAOYSA-N	432.960	1.936	50	20	IDGD	
CS(=O)(=O)Nc1cc(C(=O)NNC(=O)c2cncn2-c2ccccc2)ccc1Cl	1318062455	VHCGHGRVKFOFFX-UHFFFAOYSA-N	433.877	1.972	50	20	IDGD	
Cc1nn(C)c(-n2ccnc2C)c1C(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1	1321079941	NAMQFIPTJUYHID-UHFFFAOYSA-N	445.524	1.631	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3nnc4cc(C)nn4c3C)C2)C1	1777778979	GSYQJTBVBAURGP-YWZLYKJASA-N	434.928	1.592	50	20	IDGD	
Cn1ncc2c(C(=O)N3CC[C@@]4(CN(C(=O)CCBr)CCO4)C3)cccc21	1778027403	ISSOQGHWRYJPMD-LJQANCHMSA-N	435.322	1.802	50	20	IDGD	
CCCc1onc(C)c1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2	1778262532	SJGCBRIJKDFQJR-AKCHCHLHSA-N	427.929	1.663	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2)c1ccc2ncccc2c1	1778455353	FSAFPBVUCJTOJM-WOIUINJBSA-N	431.920	1.962	50	20	IDGD	
O=C(c1cn2ccsc2n1)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1778628501	HNDUZAOEROVTNW-NHYWBVRUSA-N	431.287	1.530	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](C)N3C[C@H]4C[C@H]4C3)C2)C1	1778867001	YNVIIWQAGINHPQ-CLLBMXBRSA-N	428.371	1.330	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cn(C(C)(C)C)nn3)C2)C1	1780357557	NBPHYCCKRODGBN-UGSOOPFHSA-N	442.358	1.650	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](NC(C)=O)c3ccc(F)cc3)C2)C1	1780910712	LVVHZYLMBYRFCS-WFXMLNOXSA-N	439.915	1.850	50	20	IDGD	
C/C=C(\C)C(=O)N1CCO[C@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1	1780968222	GYFQOMVMTLADOS-BWQBYBMGSA-N	443.548	1.129	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc3nn(C)cc3c2)C1	1781240560	POXXZUCYYRUENK-SFGWALBWSA-N	448.951	1.955	50	20	IDGD	
CC(=O)N[C@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C(Cl)Cl)C1)C(C)(C)C	1782214172	MMMDTJVFFNLUEY-PJIJBLCYSA-N	436.380	1.855	50	20	IDGD	
CC(C)/C=C/C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnccc1C(=O)NN)C2	1782828005	HDYJUMVTYUOCIB-WREJSRDGSA-N	429.521	1.025	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@]2(C1)CN(C(=O)c1cccnn1)CCO2	1782867077	INABXYPVAMUBMJ-VROYLXGSSA-N	439.422	1.805	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CN2C(=O)CSC2=S)C1	1783245895	LEIURCPRUUZFJM-SNUQEOBHSA-N	448.010	1.378	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3nccnc3OC)CCO2)C1	1783342527	AWPYVNKQSKUTFP-SJCJKPOMSA-N	427.299	1.102	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)CC(C)(C)C(=O)OC(C)(C)C)CCO2)C1	1783881317	KTIZQOVCOXYXFF-VFNWGFHPSA-N	446.972	1.828	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cc3cc[nH]c3cc1F)CCO2	1783935926	YGABKYQPEGVICP-QFIPXVFZSA-N	445.495	1.124	50	20	IDGD	
Cc1noc(C)c1CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21	1785083430	JEISYIFXNYIEIU-PCBIJLKTSA-N	432.290	1.504	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cn(C)nc3OC)[C@H]2C1	1785867249	SJHIEJGACHBBKD-VIRABCJISA-N	443.342	1.196	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc(N(C)C)o3)[C@H]2C1	1785881874	MIDSOBOZTCZMJA-XUXIUFHCSA-N	443.342	1.365	50	20	IDGD	
C[C@@H](Nc1nccs1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCBr)[C@H]2C1	1786405822	CZKBEQKYIIJJJR-RFGFWPKPSA-N	445.383	1.708	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4ccccn4n3)C[C@@H]21	1786406833	JLHXFHXZINNXQU-QRTARXTBSA-N	435.322	1.713	50	20	IDGD	
O=C(CCN1CCCCC1)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21	1786576133	LWBHFVDACHIHET-ULQDDVLXSA-N	430.387	1.627	50	20	IDGD	
O=C(Cc1ncccn1)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1	1788140448	YDZMXKLJODHFDC-UHFFFAOYSA-N	430.273	1.147	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(C(F)(F)F)n3)[C@H]2C1	1788879570	KRLNFDVFVOQLLG-ABHRYQDASA-N	449.857	1.948	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1ccc(C2(NC(=O)Cn3ccnc3)CCC2)cc1	1789521136	KJHZJNNOLOJLBL-UHFFFAOYSA-N	433.472	1.330	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC1(c2ccc(NC(=O)[C@H](O)N3CCOCC3)cc2)CCC1	1789557120	PWTHQTTXBSPYQY-APWZRJJASA-N	425.913	1.025	50	20	IDGD	
CC(C)N(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2)C(=O)OC(C)(C)C	1792595114	QIAKYYKBPMLFAQ-XRGAULLZSA-N	435.924	1.756	50	20	IDGD	
CCc1[nH]nc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)CBr)c1Cl	1792867941	OGNFFBYQWFIOOB-DYNIEEOBSA-N	447.761	1.860	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1cnccn1)C2	1792873150	MTXRPULWLOXNIX-VWPFQQQWSA-N	425.327	1.030	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(N3CCCC3)c(F)c1)C2)[C@H](O)CCl	1792980209	FVIAZRSFLMZXNQ-WTLGNFPFSA-N	439.915	1.229	50	20	IDGD	
COc1ccccc1CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2	1793149241	LARXZNAYSZJIHL-LTCOOKNTSA-N	443.313	1.908	50	20	IDGD	
Cc1cccc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)CBr)C3)n1	1793907626	JXVPMIMDFVTPQA-JNNRSPCRSA-N	438.366	1.943	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnn(-c2cccnc2)c1	1794445326	OCMQYGSGRZAYCQ-XEMDLRDOSA-N	443.580	1.322	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2cccnc2[nH]1	1797457545	OJJBEJZKZNMKEU-ZIEJDFEHSA-N	435.322	1.797	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1ccn2cncc2c1	1797506372	QJCIGYMGMDOIII-AYRXBEOTSA-N	425.258	1.228	50	20	IDGD	
C[Si](C)(C)c1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Br)C3)co1	1797726027	ITZLSRFZUCQHAJ-NEBZKDRISA-N	447.377	1.719	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(Cl)ccn1)C2	1798439972	QNZJXIMSNWXUIQ-BTTYYORXSA-N	428.880	1.299	50	20	IDGD	
Cc1cc(C(=O)NCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](C)Br)C3)no1	1798511060	APOYTZOXCJMVEW-RVMXOQNASA-N	427.299	1.134	50	20	IDGD	
CC(C)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(OCCCO)cc1	1798540270	MGCKZZGDASSEDF-IZZQQSIFSA-N	438.952	1.916	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cncc(S(C)(=O)=O)c1)C2	1798625648	OKCHTMODDISWTR-MUJYYYPQSA-N	439.610	1.588	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)[S@](=O)c1ccccc1)C2	1799272416	QHTFOIHCJSFEOA-QFURWZGWSA-N	426.966	1.790	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(F)cc(F)c1F)C2)[C@H](F)Br	1799352199	LHZIHPUYDOWHKZ-NVIQENEESA-N	439.203	1.998	50	20	IDGD	
COCC1(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)/C(C#N)=C/c2ccc(F)cc2F)CC1	1800332476	OYYHEAXQVMIJOW-UGROSQSRSA-N	445.466	1.888	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](O)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@](C)(Cl)CCl)C2	1800600514	UVKBDHPZBFZAKX-APPZKNGHSA-N	438.352	1.704	50	20	IDGD	
C[C@@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc3c1NC(=O)C3=O)C2	1801962367	HPLZSDSBJSDMSW-WISYIIOYSA-N	434.290	1.857	50	20	IDGD	
CC(C)(C)n1cc(C(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]2c2cccnc2)cn1	1803142194	WPQHLCYNDDKJLV-KBAYOESNSA-N	433.940	1.952	50	20	IDGD	
O=C(CN1CCOC1=O)NC[C@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1	1803340878	ZZKUFMJLVMCCFT-RHSMWYFYSA-N	439.310	1.325	50	20	IDGD	
Cc1ccc(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)s1	1805409021	MRNGKFGODPDHKG-RXVVDRJESA-N	449.341	1.765	50	20	IDGD	
Cc1cccc(CCC(=O)N2CCCC3(CCN(C(=O)c4ccc(B(O)O)cc4)CC3)C2)n1	1806803579	FGKODDABBUAABJ-UHFFFAOYSA-N	449.360	1.547	50	20	IDGD	
C[C@H]1CC[C@H](C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)CC1	1807376392	YSGXPWWICKGNJD-CFFRYYMNSA-N	449.360	1.907	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NC[C@@H]1CCN(C(=O)C(Cl)Cl)[C@@H]1c1cccnc1	1807595982	NMBWCZBKHLEXQI-XJKSGUPXSA-N	439.299	1.914	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H](CNC(=O)[C@H](F)Br)[C@H]1c1cccnc1)n1cncn1	1808679664	AGECKNIONFDVEM-NGFQHRJXSA-N	439.289	1.631	50	20	IDGD	
CC[S@](=O)CCC(=O)NC[C@@H]1CCN(C(=O)[C@@H](Cl)COC)[C@@H]1c1cccnc1	1810119979	BXRBGPDLPCUFCA-LIXQUKQMSA-N	429.970	1.500	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)Cn2cncn2)[C@H]1c1cccnc1	1813030512	CWWAEQGEVPJESM-DKIMLUQUSA-N	434.928	1.269	50	20	IDGD	
O=C1Cc2cccc(C(=O)N3CCCC[C@@H]3c3cc(NC(=O)[C@H](O)CCl)n[nH]3)c2N1	1814874803	FJSKCEPERNAEIH-HUUCEWRRSA-N	431.880	1.810	50	20	IDGD	
C[C@@H]1CCC[C@H]1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2	1818876487	MAMABNWNXHBPEY-UHOFOFEASA-N	427.335	1.485	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H]2CCCS2)[nH]n1	1819404423	KEIDTDYONKNHGU-CVEARBPZSA-N	443.533	1.610	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)CNC(=O)C(F)(F)F)[nH]n1)C(Cl)Cl	1822421350	JEHBGWHNGRMVTE-QMMMGPOBSA-N	430.214	1.884	50	20	IDGD	
CCCNC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](Cl)COC)sc2C1	1825994685	NETZZNDOAXDRBE-VXGBXAGGSA-N	430.958	1.615	50	20	IDGD	
O=C(Cc1ccsc1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827052736	CCCDSNLIXMPKHU-NRFANRHFSA-N	440.374	1.904	50	20	IDGD	
Cc1nocc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827056224	RUYGRGXHIZICRE-HXUWFJFHSA-N	425.294	1.210	50	20	IDGD	
COC(C)(C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1	1828922078	LDSNOXMEICSTMF-SFHVURJKSA-N	431.537	1.343	50	20	IDGD	
CCS(=O)(=O)CC(=O)N1CCC([C@H]2CCCCN2C(=O)CO[Si](C)(C)C)CC1	1829100299	YTQBWZHHMYCAGY-QGZVFWFLSA-N	432.659	1.892	50	20	IDGD	
Cc1nc(F)ccc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830364174	ATLXXUZQLJUOLW-FQEVSTJZSA-N	427.904	1.864	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3CC(C)(C)C3)C2)C1	1830543871	GSELPNDQDVIVFO-LIRRHRJNSA-N	431.371	1.910	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)c1ccccc1)CCO2	1832231997	LQOFGGHTOSVHEF-ZWOKBUDYSA-N	428.888	1.407	50	20	IDGD	
CN1CCC(C(=O)NC2CCN(C3CCN(C(=O)CCBr)CC3)CC2)CC1	1833103120	AITQRAKRJOAYKO-UHFFFAOYSA-N	443.430	1.685	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cc(C4CC4)on3)CC2)CC1	1833179455	YDPKRDVCDFEZDR-QGZVFWFLSA-N	438.956	1.991	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cc(C(=O)O)ncn3)CC2)CC1	1833969597	UEQLBPSITBWBLY-OAHLLOKOSA-N	437.928	1.377	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3ccc(=O)oc3)CC2)CC1	1834341037	WQKFEXRIUVWKAT-ZDUSSCGKSA-N	440.338	1.608	50	20	IDGD	
Cc1cncc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCBr)CCO3)C2)c1	1834819577	WHLIJJCOCUPLPO-GOSISDBHSA-N	426.311	1.245	50	20	IDGD	
Cc1nnc(CC(=O)NC2CCN(C3CCN(C(=O)[C@](C)(Cl)CCl)CC3)CC2)o1	1834834787	MTMLCCYMXYCWOW-LJQANCHMSA-N	446.379	1.728	50	20	IDGD	
N[C@@H](Cc1cscn1)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](F)Cl)CC2)CC1	1835049253	PUCMWOUNNZOFEM-JKSUJKDBSA-N	431.965	1.119	50	20	IDGD	
CCCC(=O)N[C@@H](C)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](Cl)COC)CC2)CC1	1835820666	DMNSPHLQFKPUQD-YJBOKZPZSA-N	445.004	1.117	50	20	IDGD	
Cc1ocnc1C(=O)NC1CCN(C2CCN(C(=O)[C@H](C)Br)CC2)CC1	1836011789	KSUBJOROXIPYGM-LBPRGKRZSA-N	427.343	1.952	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)CCc3cnc[nH]3)CC2)CC1	1837138786	NYROJZWVUHSFDR-GOSISDBHSA-N	426.945	1.595	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3CCCSC3)C2)C1	1837717825	OXKWSWQQMKVLLA-APWZRJJASA-N	430.643	1.438	50	20	IDGD	
CC(C)n1nccc1C(=O)N1CCO[C@]2(COCCN(C(=O)CCBr)C2)C1	1838020374	CYCJDVPGBIBKAB-SFHVURJKSA-N	443.342	1.319	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(C)nn3C(F)F)CCO2)C1	1838714570	MIEZOPCWZJJEPM-SCLBCKFNSA-N	434.871	1.674	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCn3nc(C)cc3C)C2)C1	1839149080	SSXZAFVUKHJMHE-XLIONFOSSA-N	426.945	1.364	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)/C=C/c3cnc[nH]3)C2)C1	1839154977	FBRUXLLKAQGDHW-RFLFSSTKSA-N	431.320	1.116	50	20	IDGD	
Cc1cc2[nH]c(C(=O)N3CCO[C@]4(COCCN(C(=O)[C@@H](O)CCl)C4)C3)cc2s1	1839523575	PPNSSTLRAMXWPC-HNAYVOBHSA-N	441.937	1.208	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(NC(C)=O)c3)CCO2)C1	1840730119	CKQDCCDAHFWPBK-WIYYLYMNSA-N	437.924	1.732	50	20	IDGD	
O=C(CCBr)N1CC2(CCCN2C(=O)CCN2C(=O)c3ccccc3C2=O)C1	1841909871	KLZLXWOANVMNCI-UHFFFAOYSA-N	448.317	1.661	50	20	IDGD	
Cc1ccn(CC(=O)N2CC3(CCCN3C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)n1	1841924252	OYXOCUQGYKOEAX-HNNXBMFYSA-N	439.944	1.527	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)COc1ccc(F)cc1)C2	1843415734	GLZYFYJIYRPMSQ-MFKUBSTISA-N	441.463	1.542	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)Cn1ccnc1)C2	1844692208	UZLXSSMUQHELBM-UHFFFAOYSA-N	427.417	1.234	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(C(=O)N2CC3(CCCN3C(=O)[C@@H](F)Br)C2)C1	1845218351	ZCWUYMPOMQTXHO-GFCCVEGCSA-N	434.306	1.747	50	20	IDGD	
O=C(c1cnc2c(c1)CCNCC2)N1CC2(CCCN2C(=O)[C@@H](F)Br)C1	1845219886	OZDNKKPKSUITAL-OAHLLOKOSA-N	425.302	1.277	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)c2cccc(N3CCCS3(=O)=O)c2)cc1	11238247	UUBFXUZUTJJARG-OAHLLOKOSA-N	447.513	1.854	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)CCc2c(C)nc3nc(N)nn3c2C)cc1OC	12696960	CMFBPALJBDXVJA-UHFFFAOYSA-N	441.492	1.515	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=O)COc2cccc(C)c2)ccc1OC	15877075	MWQXNFLXFVHTOD-UHFFFAOYSA-N	449.529	1.874	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)[C@@H]2CN(C(C)=O)c3ccccc3O2)cc1	18071422	USAFVYCJXRDNIL-VLIAUNLRSA-N	427.457	1.814	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CSc2nnc(-c3ccc(F)cc3)n2N)cc1OC	21165712	PSWRUYWCFDZGAN-UHFFFAOYSA-N	446.464	1.369	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@@H]2CC(=O)N(Cc3ccc(C)cc3)C2)cc(OC)c1OC	28700519	KRINMLNRHFOONG-QGZVFWFLSA-N	441.484	1.831	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2sc(-c3ncccn3)nc2C)c2ccccc2c1=O	108047517	RYRARMBCOWQQNK-UHFFFAOYSA-N	435.469	1.713	50	20	IDGD	
CC(C)c1ccccc1NC(=S)NNC(=O)C/N=C1/NS(=O)(=O)c2ccccc21	727173958	AOHKVTXAKBGIAC-UHFFFAOYSA-N	431.543	1.866	50	20	IDGD	
Cn1nccc1S(=O)(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1	727360199	ZOXWYPDOBYIONN-LJQANCHMSA-N	425.514	1.357	50	20	IDGD	
O=C(CCCc1ccccc1)NNC(=O)c1ccc(S(=O)(=O)N2CCOCC2)cc1	727716958	NCDLJRDKFCUBDQ-UHFFFAOYSA-N	431.514	1.491	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)[C@@H]2CCCN(S(=O)(=O)c3ccccc3)C2)c1	728206004	PPCPKIODBBGNQI-MRXNPFEDSA-N	446.529	1.355	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)c2cc(F)ccc2Br)o1	728548920	VSKDBCLOLOTGTI-UHFFFAOYSA-N	434.243	1.506	50	20	IDGD	
O=C(Cn1c(S)nnc1-c1cccs1)NNC(=O)C1CCN(c2ncccn2)CC1	728889930	TXRIFIZQQRCVHC-UHFFFAOYSA-N	444.546	1.149	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NC[C@H]2CN3CCC[C@@H]3CO2)ccc1OCCC(C)C	729619386	PPMKKGPNZLLPJX-MSOLQXFVSA-N	434.537	1.927	50	20	IDGD	
CCN1CCC[C@@H]1CN1C[C@H](C(=O)NNC(=O)c2ccc(OC(C)C)c(OC)c2)CC1=O	729627171	PNQZPEBSBVQAOB-QZTJIDSGSA-N	446.548	1.576	50	20	IDGD	
CS(=O)(=O)c1ccc(Cl)c(S(=O)(=O)NNC(=O)Cn2ccc3ccccc32)c1	729667436	PSVZJIFGXZZMCI-UHFFFAOYSA-N	441.918	1.708	50	20	IDGD	
O=C(CCc1ccccc1O)NNS(=O)(=O)c1ccc(I)cc1	729965040	MOKSKLJRNMBVEV-UHFFFAOYSA-N	446.266	1.939	50	20	IDGD	
CC1CCC(N2C[C@@H](C(=O)NNC(=O)c3nn(-c4ccccc4)cc3O)CC2=O)CC1	731366044	UKBJDYTXJJIAFQ-PCKAHOCUSA-N	425.489	1.766	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@@H](C)C(=O)NNC(=O)C1CCC2(CC1)NC(=O)NC2=O	731470511	FHXZTTWOOVDDGB-MEVBUXLWSA-N	436.896	1.640	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)N1CCN(S(=O)(=O)c2cccc(Cl)c2Cl)CC1	731848262	DORRLIQMSGGJGL-NSHDSACASA-N	437.349	1.246	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2ccc(S(N)(=O)=O)s2)cc1Br	732173878	KTXVVKWQNZFBGT-UHFFFAOYSA-N	434.293	1.241	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@@H]2CC[C@H](C(F)(F)F)NC2=O)cc1Br	732175252	IFMSKRAHBIGAHK-LDYMZIIASA-N	438.200	1.676	50	20	IDGD	
CC(C)S(=O)(=O)c1ccc(C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1	732325424	KFYQCNTYEZJCHI-UHFFFAOYSA-N	449.441	1.395	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC1)NNC(=O)C1CC1	733194303	HTUDFRYVUJZNCK-UHFFFAOYSA-N	443.529	1.998	50	20	IDGD	
COc1ncnc(OC)c1C(=O)NNc1nc2ccccc2c(=O)n1CCCOC(C)C	733265729	JHGPSODNSBRPLU-UHFFFAOYSA-N	442.476	1.776	50	20	IDGD	
CCS(=O)(=O)C[C@H](C)NC(=O)NNC(=O)c1ccc(Br)cc1Cl	733660856	XSEXWEWPIJQJHG-QMMMGPOBSA-N	426.720	1.870	50	20	IDGD	
Cc1noc(C)c1S(=O)(=O)N1CCC(C(=O)NNc2cnnc3ccccc23)CC1	733808742	HHOSTUWXUGSQFD-UHFFFAOYSA-N	430.490	1.779	50	20	IDGD	
CN1C(=O)C[C@H](C(=O)NNC(=O)c2nnc(O)c3ccccc23)[C@@H]1c1cccc(Cl)c1	734417783	UJEPLWPBBYBDNW-YJBOKZPZSA-N	439.859	1.969	50	20	IDGD	
COc1ccc(CN2CC[C@@H](NC(=O)NNC(=O)COc3ccc(C)cc3)C2=O)cc1	734683157	FZROOVIOWWAPPB-LJQANCHMSA-N	426.473	1.514	50	20	IDGD	
O=C(Cc1ccc2ccccc2c1)NNC(=O)N[C@H]1CCN(CCN2CCOCC2)C1	734685796	HYJVLFPWUZAYPR-NRFANRHFSA-N	425.533	1.119	50	20	IDGD	
CC(C)Oc1ccccc1CC(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	735116791	FXWOFSCEIVIRJX-UHFFFAOYSA-N	447.561	1.491	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1ccnc(-n2cccn2)c1	740352388	ZNSAPWIUNNDZRI-UHFFFAOYSA-N	429.820	1.547	50	20	IDGD	
O=C(CCN1C(=O)[C@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O)NNC(=O)c1cc2c(s1)CCCCCC2	742480969	OULSJFVHWJSXQY-QZCPTFHJSA-N	445.541	1.721	50	20	IDGD	
Cc1cc(C)nc(-n2cc(C(=O)NNC(=O)CNC(=O)c3ccco3)c(C(C)C)n2)n1	742613275	RSVBDZWUMFLMOM-UHFFFAOYSA-N	425.449	1.187	50	20	IDGD	
C[C@@H](CC(=O)NNc1nc(-c2cccnc2)no1)/N=C1/NS(=O)(=O)c2ccccc21	742657426	BXQVNPIUVXEJMJ-NSHDSACASA-N	427.446	1.092	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@@H]2C[C@@]23CCc2ccccc23)cc1	743288320	AZELBVVAUNEZFO-SIKLNZKXSA-N	427.526	1.667	50	20	IDGD	
O=C(NNC(=O)N1CCn2c(Cc3ccccc3)nnc2C1)c1cc(Br)c[nH]1	743508480	NNAVZXOGFYBADC-UHFFFAOYSA-N	444.293	1.830	50	20	IDGD	
CCO[C@H](C)c1noc(CN2CCN(C(=O)NNC(=O)c3ccccc3OC)CC2)n1	743602500	JRJAAFFLYWYYLD-CQSZACIVSA-N	432.481	1.348	50	20	IDGD	
O=C(NNC(=O)N1CCN(C(=O)c2cccc(O)c2)CC1)c1cccc(Br)c1	743685867	HFCIYCXJJDQHAR-UHFFFAOYSA-N	447.289	1.967	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCc2noc(-c3cccs3)n2)nc1	745281506	QUKDVBCZBKUXOY-UHFFFAOYSA-N	437.507	1.706	50	20	IDGD	
COc1cccc([C@@H](CNC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)N(C)C)c1	745295203	CUCYEOWQMRLBEL-GOSISDBHSA-N	449.533	1.737	50	20	IDGD	
COc1cc(/C=C/C(=O)OCC(=O)NNC(=O)Cc2nc(C)cs2)cc(OC)c1O	745514489	ZSZULKCPQIXZSR-SNAWJCMRSA-N	435.458	1.121	50	20	IDGD	
CC(C)(C)c1ncc(/C=C\C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)s1	745682669	YOOKLBXRIHUJRS-QWGSZXSUSA-N	445.497	1.984	50	20	IDGD	
COC(C)(C)C[C@H](C)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	745866913	BONIRWCIMOANLH-AWEZNQCLSA-N	426.539	1.619	50	20	IDGD	
CC(=NNC(=O)CSc1nnc(O)nc1O)c1cc(Br)c(F)cc1O	746564918	NBGDZXPYMDQZJU-UHFFFAOYSA-N	432.231	1.523	50	20	IDGD	
COCCCn1c(S)nc2cc(C(=O)NNc3nc(C)cc(OC)n3)ccc2c1=O	746625522	ODZYVQKFTIEQJB-UHFFFAOYSA-N	430.490	1.586	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)Nc2nccs2)cc1)c1ccc2c(c1)C(=O)NC2=O	747942714	CJVYNGFNHLTTFN-UHFFFAOYSA-N	443.466	1.584	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)NC2CCN(C3CCN(C)CC3)CC2)cc1C	747990175	CKSGIZOWORSCRV-UHFFFAOYSA-N	430.553	1.131	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)NC2CCN(C3CCN(C)CC3)CC2)cc1OC	747990531	SCHYEFOBUMNHRX-UHFFFAOYSA-N	447.580	1.987	50	20	IDGD	
O=C(CCc1ccco1)NNC(=O)c1ccc(C(=O)NNC(=O)CCc2ccco2)s1	748354295	JDDIIBAPNKJDGC-UHFFFAOYSA-N	444.469	1.722	50	20	IDGD	
O=C(NCC1(c2cccc(C(F)(F)F)c2)CCOCC1)NNC(=O)C(=O)N1CCCC1	748456590	KQRFSRJCBCPNAM-UHFFFAOYSA-N	442.438	1.706	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)NC[C@@H](c1cccc(Cl)c1)N1CCOCC1	748627817	LUTDRCYHITXIBL-YOEHRIQHSA-N	428.917	1.095	50	20	IDGD	
CCS[C@@H]1CCC[C@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)C1	748964768	CSPDNCCZZSJVOK-LSDHHAIUSA-N	428.580	1.945	50	20	IDGD	
COc1ccc([C@@]2(C)NC(=O)N(CC(=O)NNC(=O)c3cc4ccccc4o3)C2=O)cc1	749468520	YRDZPTMPPHPULM-JOCHJYFZSA-N	436.424	1.670	50	20	IDGD	
CC[C@H](NC(=O)NNC(=O)COc1ccccc1[N+](=O)[O-])c1nnc2n1CCCCC2	749583712	ZMPZWNHJBSPXMH-ZDUSSCGKSA-N	431.453	1.773	50	20	IDGD	
O=C(NCc1cccc(C(F)(F)F)c1)NNC(=O)[C@@H]1Nc2ccccc2S(=O)(=O)N1	749931745	VWLCHCXNAROSHK-CQSZACIVSA-N	443.407	1.266	50	20	IDGD	
CCOCCCn1c(NNC(=O)CNC(=O)c2cccc(F)c2)nc2ccccc2c1=O	752038406	XGFSNUFUNCVGNL-UHFFFAOYSA-N	441.463	1.835	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)NCC2(CS(C)(=O)=O)CC2)c1	753017702	BETKDQIXSVCDME-UHFFFAOYSA-N	434.312	1.227	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cc(OC)c(S(N)(=O)=O)s2)ccc1OC(C)C	754179964	JHZKOGSNIMEMJO-UHFFFAOYSA-N	443.503	1.275	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)Nc2cccc(-n3cnnn3)c2C)cc1	755444160	MIEMAWTUHQOJGQ-CQSZACIVSA-N	425.449	1.990	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2cc(C)nn2[C@@H]2CCS(=O)(=O)C2)c(OC)c1	755534022	NQRJAXYZRDBXBJ-GFCCVEGCSA-N	437.478	1.035	50	20	IDGD	
CCNC(=O)NN=Cc1c(Sc2nnnn2-c2ccccc2)nc2ccccn2c1=O	755668186	IUCBPSSTFFDAEL-UHFFFAOYSA-N	435.473	1.474	50	20	IDGD	
COC(=O)CNC(=O)Cc1ccc(NC(=O)NNC(=O)[C@H](C)Oc2ccccc2F)cc1	755863517	MTDAWSJAXZGQEJ-ZDUSSCGKSA-N	446.435	1.278	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)Nc3ccc(C(N)=O)c(C)c3)n[nH]2)cc1OC	756400441	KPBAMSNOFPGJFR-UHFFFAOYSA-N	438.444	1.968	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)Nc1cc(Br)ccc1-n1cccn1	756489647	QLSCSKIRSHSBSM-JTQLQIEISA-N	442.295	1.222	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN(C)[C@@H](C)c2ccc([S@@](C)=O)cc2)cc1OC	756550722	MBFFKYMZJFJKEO-NGFNCXNUSA-N	433.530	1.895	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)Nc1ccc(C)c(N2CCCS2(=O)=O)c1	756705772	POPGZCNMWAMEKQ-UHFFFAOYSA-N	432.502	1.939	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)Nc1ccc(S(=O)(=O)NCC2CC2)cc1	756785049	RVHVQFIHXFOSLY-UHFFFAOYSA-N	446.485	1.613	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)Nc2ccc(C[C@@H]3CC(=O)NC3=O)cc2)c1	756816713	UDGRSCBCOYGAOJ-CYBMUJFWSA-N	426.429	1.376	50	20	IDGD	
COCCNC(=O)Cn1cc(NC(=O)NNC(=O)c2cc3c(s2)CCCCC3)cn1	756845824	VRQYBLWYYFZSLL-UHFFFAOYSA-N	434.522	1.443	50	20	IDGD	
CN(CC(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1)C(=O)OCc1ccccc1	756890887	AVYQKBLXFZYRPE-UHFFFAOYSA-N	432.864	1.372	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)Nc2c(OC)ncnc2N(C)C)n[nH]1	757708234	FGASENAHOVKGGC-UHFFFAOYSA-N	426.437	1.416	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)N[C@H]2CN(C(=O)OC(C)(C)C)C[C@@H]2C#N)nc2ccccc21	758771023	MXJYINFNNGEXBX-ZFWWWQNUSA-N	441.492	1.205	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)CCCN(C)C2=NS(=O)(=O)c3ccccc32)nc1	759724708	DLACCRAAQOAHRU-UHFFFAOYSA-N	431.474	1.172	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)CCCn2c(=O)oc3ccccc32)n1	763223381	OHIOBMRGJPSFGV-UHFFFAOYSA-N	432.458	1.073	50	20	IDGD	
Cc1ccccc1NC(=O)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	763509889	VIFYWBFWPVYXMJ-UHFFFAOYSA-N	430.486	1.179	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cc3c(cc2Cl)OCCO3)cc1C	763665513	XHIIZQHEQMZEOK-UHFFFAOYSA-N	433.848	1.893	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2cccc(CS(C)(=O)=O)c2)c1	763666015	UOXGELLLVCVLJD-UHFFFAOYSA-N	433.486	1.013	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(OCc3ccccc3)nc2)cc1	763681704	MJSMGJICKJAFCY-UHFFFAOYSA-N	445.435	1.697	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cnn(CC(F)(F)F)c2)c1C	763853399	YTIWIDVFLWSLRB-GFCCVEGCSA-N	427.383	1.616	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)C(=O)Nc1ccc(CC(=O)Nc2ccccc2F)cc1	763994139	XBIOAVOHBVKAHV-UHFFFAOYSA-N	437.431	1.745	50	20	IDGD	
CCc1nnc(-c2cccc(NC(=O)C(=O)NNC(=O)c3ccc4c(c3)OCCO4)c2)o1	764004119	RXIQULWTDUVHCP-UHFFFAOYSA-N	437.412	1.470	50	20	IDGD	
C[C@@H](C#N)Oc1ccccc1NC(=O)C(=O)NNC(=O)c1cc(Br)cn1C	764004626	JHXLDYXFCGYPKN-JTQLQIEISA-N	434.250	1.478	50	20	IDGD	
COc1ncccc1NC(=O)C(=O)NNC(=O)c1ccc(Br)cc1Cl	764057517	FVYKUXKWRNZGGN-UHFFFAOYSA-N	427.642	1.906	50	20	IDGD	
Cc1cnc(O)n1-c1ccccc1NC(=O)C(=O)NNC(=O)c1cccc(OC(F)F)c1	764250839	OTBUDTHYUOJMBC-UHFFFAOYSA-N	445.382	1.887	50	20	IDGD	
C#CCOc1ccc(NC(=O)C(=O)NNC(=O)c2cc(Br)ccc2O)cc1	764279100	YMJCPZCINATLCV-UHFFFAOYSA-N	432.230	1.566	50	20	IDGD	
COc1cc(Br)cc(NC(=O)C(=O)NNC(=O)CCc2ccccc2O)c1	764280918	HXTPZCLXGOHENV-UHFFFAOYSA-N	436.262	1.882	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C(=O)Nc1ncn(Cc2ccc(C#N)cc2)n1)c1ccccc1	764330812	YILBLMSNXAHSHT-SFHVURJKSA-N	431.456	1.478	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1)C(=O)Nc1ccccc1-n1cncn1	764386578	BALPOAWZKOTUGT-UHFFFAOYSA-N	434.391	1.196	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)C(=O)Nc1ccc(SC(F)F)nc1	764400031	FKQKFWXVLVLSSL-UHFFFAOYSA-N	428.442	1.980	50	20	IDGD	
CC(C)(C)OC(=O)N1CCO[C@H](CC(=O)NNC(=O)c2cc(Br)c[nH]2)C1	764605526	COAYWTVQNQTYAN-LLVKDONJSA-N	431.287	1.564	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1cc(C(F)(F)F)ccc1N1CCOCC1	766261366	VYXZQGSSOPHNMA-UHFFFAOYSA-N	440.382	1.422	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cc(F)cc(C)c3[N+](=O)[O-])CC2)cc1	766647213	BGYQNDZINNYDNS-UHFFFAOYSA-N	443.479	1.930	50	20	IDGD	
CN(C)CCOc1cc(C(=O)NNC(=O)COc2ccc(Br)cc2)ccn1	767161182	CMSUZJBNMTWXQN-UHFFFAOYSA-N	437.294	1.625	50	20	IDGD	
Cc1ccc(CN2C[C@H](C(=O)OCC(=O)NNC(=O)Cc3ccccc3C)CC2=O)cc1	767241191	RNTGEKAIGSCWIO-HXUWFJFHSA-N	437.496	1.585	50	20	IDGD	
N#Cc1cc(Cl)nc(NNC(=O)c2ccc(S(=O)(=O)NC[C@H]3CCCO3)cc2)c1	768708690	ZXUKMPKMAIQFHH-CQSZACIVSA-N	435.893	1.821	50	20	IDGD	
N#Cc1ccc(OC2CCC(NC(=O)NNC(=O)CNC(=O)c3cccs3)CC2)nc1	769021000	KXOKQTFMKIMPSL-UHFFFAOYSA-N	442.501	1.465	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)CCc2cccc3c2OCO3)cc1OC	770439759	ZANANXFCVNHCGX-UHFFFAOYSA-N	430.413	1.370	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)NCCN1C(=O)[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O	770545098	KRXRIEVYEWUQDY-HVCLXXKLSA-N	446.891	1.245	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCc2nc(-c3cn(C)c(=O)nc3O)no2)N(C)c2ccccc21	771189090	XZCLGRVNLQYYDX-UHFFFAOYSA-N	433.428	1.359	50	20	IDGD	
Cc1cc(S(=O)(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)c2ncccc2c1	771605904	DSFKFJXRLWXOQW-UHFFFAOYSA-N	432.889	1.823	50	20	IDGD	
O=C(COc1cccc(N2CCCC2=O)c1)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772194580	ADEGDPDMDDBRDA-UHFFFAOYSA-N	444.875	1.309	50	20	IDGD	
CCOC(=O)N1CCC[C@@H](C(=O)NNC(=O)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)C1	773413077	ZTDADIACLFSAAR-HUUCEWRRSA-N	426.514	1.649	50	20	IDGD	
CN1CCC/C1=N\S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2cccc(C#N)c2)cc1	773688310	IIZIOZSWTPRWNF-XIEYBQDHSA-N	440.485	1.453	50	20	IDGD	
CCN1CCN(c2ccc(NC(=O)C(=O)NNC(=O)c3ccc(C)c(F)c3)cc2)CC1	773890188	XVYWNZQQWUDZCS-UHFFFAOYSA-N	427.480	1.676	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)ccc1NC(C)=O	774008107	IUDVPCLBGAPKFV-NSHDSACASA-N	448.863	1.860	50	20	IDGD	
NC(=O)CC[C@H](C(=O)NNc1ncc(Cl)cc1Cl)N1C(=O)c2ccccc2C1=O	775275471	ITOOCNWBIOODMD-CYBMUJFWSA-N	436.255	1.762	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)N[C@H]2CCO[C@]3(CCS(=O)(=O)C3)C2)cc1	776075732	DIWCYGJMHUCRQA-KBXCAEBGSA-N	427.548	1.154	50	20	IDGD	
CCCCn1c(N)c(N(CC(=O)NNC(=O)c2ccccc2)CC(C)C)c(O)nc1=O	777606376	OSOHRTQEPNYDJB-UHFFFAOYSA-N	430.509	1.255	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)c2cnc(C(F)(F)F)nc2)CC1	777797391	NUWKXUWEUZQITQ-UHFFFAOYSA-N	432.403	1.839	50	20	IDGD	
C[C@@H](c1cccc(N2CCCS2(=O)=O)c1)N(C)CC(=O)NNC(=O)c1cccs1	778228235	YHGIANYASNMTMY-AWEZNQCLSA-N	436.559	1.742	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)C(=O)Nc1cc(Cl)ccc1OC1CCCC1	778711270	XJXLPMQOVLBZCA-LLVKDONJSA-N	443.909	1.182	50	20	IDGD	
O=C(NNc1ncncc1Cl)[C@H]1CCCN1S(=O)(=O)c1cccc([N+](=O)[O-])c1	781830213	RBIKZZOANBKUPL-CYBMUJFWSA-N	426.842	1.335	50	20	IDGD	
COc1ccc(NNC(=O)Nc2ccc(N(C)C(=O)CN3CCN(C)CC3)cc2)nc1	782032889	FADXTDDMUAUDNH-UHFFFAOYSA-N	427.509	1.449	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ncc(Cc3ccccc3Cl)s2)n1	782119981	CQSFYZSLCNMZHM-UHFFFAOYSA-N	446.920	1.987	50	20	IDGD	
C[C@H]1CN(C(=O)c2ccc(NC(=O)C(=O)NNC(=O)c3ccc(O)cc3)cc2)C[C@@H](C)O1	782832759	SKBTUAIFFRQLBW-OKILXGFUSA-N	440.456	1.041	50	20	IDGD	
COC(=O)c1c(NC(=O)C(=O)NNC(=O)c2ccc(O)cc2)sc2c1CCCCC2	782832990	WGTUPFYFIKWPFR-UHFFFAOYSA-N	431.470	1.909	50	20	IDGD	
Cn1nc(CC(C)(C)C)cc1NC(=O)C(=O)NNC(=O)Cc1nc2ccccc2n1C	782886524	PAKKQMAPXPBZCO-UHFFFAOYSA-N	425.493	1.224	50	20	IDGD	
O=C1CN(c2ccc(NC(=O)C(=O)NNc3ncnc4ccsc34)cc2Cl)CCN1	783252770	CFZKJAILTWUHDK-UHFFFAOYSA-N	445.892	1.363	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccc3ccn(C)c3c2)nc1	783263099	HKZFJZVHNGOKTJ-UHFFFAOYSA-N	430.490	1.342	50	20	IDGD	
Cn1c(=NNC(=O)C(=O)Nc2ccc(CCS(C)(=O)=O)cc2)sc2ccccc21	783351993	RTLQAYYGGMDQOR-UHFFFAOYSA-N	432.527	1.398	50	20	IDGD	
O=C(NNc1ccc(-n2cccn2)nn1)C(=O)Nc1ccccc1CN1CCSCC1	783433320	OYVNCIGJNISSFV-UHFFFAOYSA-N	438.517	1.293	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Cc2cc(F)cc3c2OCOC3)c2ccccc2c1=O	783518722	REBUYHQOPRWDNI-UHFFFAOYSA-N	426.404	1.426	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)C(=O)Nc1cccnc1-c1ccc(Cl)s1	784002608	SSDPJRAJEOPXGN-UHFFFAOYSA-N	447.860	1.572	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)C(=O)Nc1ccc(-c2ncco2)cc1	784210257	KRIXMEMJCBRWIH-UHFFFAOYSA-N	441.469	1.864	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNc2cccc([N+](=O)[O-])c2C)cc1C(=O)OC	784351829	GEJKPLZTVQSCGJ-UHFFFAOYSA-N	430.373	1.558	50	20	IDGD	
CNC(=O)c1ccc(NC(=O)C(=O)NNc2ccnc(Br)c2)cc1Cl	784837535	WZDMIDUUYUILJM-UHFFFAOYSA-N	426.658	1.939	50	20	IDGD	
CCOc1ccc(OC)cc1NC(=O)C(=O)NNc1c(OC)cccc1S(C)(=O)=O	785330790	MGZYUMSFEFYILP-UHFFFAOYSA-N	437.474	1.588	50	20	IDGD	
COCCCn1ccc(NC(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)n1	785848122	DGAJNBKHCOOIEX-UHFFFAOYSA-N	439.517	1.561	50	20	IDGD	
CCCc1c(NC(=O)C(=O)NNC(=O)c2ncccc2C)cnn1-c1cccc(C#N)c1	785992254	YBMXYDUVSHZHIU-UHFFFAOYSA-N	431.456	1.800	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)C(=O)Nc1ccc(C2CCC2)cc1	787556237	DGDDPGXZIABFDI-UHFFFAOYSA-N	443.529	1.955	50	20	IDGD	
CCOc1ccccc1[C@@](N)(C(=O)NNc1nccc(N2CCOCC2)n1)C(F)(F)F	788001942	VNWDSGXFEVYUQD-GOSISDBHSA-N	440.426	1.572	50	20	IDGD	
COc1ccc(OC)c([C@@H]2C[C@H]2C(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)c1	788102110	UTAMFZFOXDQUDV-DOTOQJQBSA-N	431.876	1.925	50	20	IDGD	
O=C(NNC(=O)c1cccnc1C(F)(F)F)c1cccc(S(=O)(=O)N2CCCC2)c1	788586056	MAWVWTGSJJEPKC-UHFFFAOYSA-N	442.419	1.960	50	20	IDGD	
CN(C)[C@H]1CCOc2c(NC(=O)C(=O)NNC(=O)c3cn(C)c4ccccc34)cccc21	789731110	CKPQCSMDZIFVOG-SFHVURJKSA-N	435.484	1.963	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)CCN(C)C3CCCCC3)cc2)CC1	791138174	FLXAURDXJFECGO-UHFFFAOYSA-N	437.610	1.720	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)COc2cc(C)cc(C)c2)cc(-n2cccn2)c1	792354998	NNLPWWYQRISVLE-UHFFFAOYSA-N	437.456	1.663	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(CC(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)cc1	792788853	GEOCECLCGBMBLI-UHFFFAOYSA-N	427.486	1.331	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)c2ccc(C)c(S(=O)(=O)NCC#N)c2)cc1	792797560	HPVMEWHUSAYROY-UHFFFAOYSA-N	430.486	1.199	50	20	IDGD	
COc1ccc(F)c2[nH]c(C(=O)NNC(=O)CN(C)S(=O)(=O)c3ccc(C)cc3)cc12	792803828	FRQLJMLSSMZTBP-UHFFFAOYSA-N	448.476	1.706	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)Cc1ccc(S(=O)(=O)N(C)C)cc1	792812834	OADDCSIBDRUGSK-UHFFFAOYSA-N	443.529	1.239	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNC(=O)COCc2ccccc2)c(F)cc1C	793025450	LBJIXBWFJLSGEY-UHFFFAOYSA-N	431.420	1.614	50	20	IDGD	
CC(C)(C)OC(=O)N1CCc2c(ccc(NC(=O)C(=O)NNc3cccnn3)c2F)C1	793051985	TZGXPBJVJUACRN-UHFFFAOYSA-N	430.440	1.991	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)cc1OC	797007242	PAZKOGOECJPCBP-UHFFFAOYSA-N	443.441	1.333	50	20	IDGD	
CC(C)(C)OC(=O)NCC[C@H]1CCCN(CC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)C1	799358721	ONJKCANATZGUGH-OAHLLOKOSA-N	449.508	1.983	50	20	IDGD	
O=C(C[C@H]1Sc2ccc(Cl)cc2NC1=O)NNC(=O)c1ccc(-n2cnnn2)cc1	799718152	QDUMIYDZKRXGMJ-OAHLLOKOSA-N	443.876	1.580	50	20	IDGD	
N#Cc1cc(S(=O)(=O)NNC(=O)CNC(=O)c2cccs2)ccc1C(F)(F)F	799921073	YXRULXWKZIXLKP-UHFFFAOYSA-N	432.405	1.378	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCc2cc(C)cc(Cl)n2)cc1	800733353	PAWDZNKVOGDPCW-UHFFFAOYSA-N	439.925	1.503	50	20	IDGD	
Cc1cc(N2C[C@H](C(=O)NNC(=O)N=c3cc[nH]cc3)CC2=O)ccc1Br	802033343	UZWXPIAPEMHFQY-GFCCVEGCSA-N	432.278	1.780	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)N[C@@H]1CCN(C(=O)Nc2ccccc2)C1	802499509	GLNLELCVUSKIOP-CYBMUJFWSA-N	428.405	1.551	50	20	IDGD	
C[C@H]1CC(CCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)C[C@H](C)O1	802510931	WWTRYSHQQRJJDL-KBPBESRZSA-N	426.539	1.475	50	20	IDGD	
CCc1nnc(NC(=O)[C@H](C)[C@@H](C)NC(=O)NNC(=O)Cc2cn3ccccc3n2)s1	805878304	IATIWQCWXYAFDF-VXGBXAGGSA-N	444.521	1.284	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)Nc2ccc(F)c(N3CCCNC3=O)c2)cc1	806805028	SFVJRCXMTWFQRH-UHFFFAOYSA-N	426.408	1.849	50	20	IDGD	
CC(C)N(C)S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2nccnc2C2CCC2)cc1	807461408	CIFWCERSMCXBBF-UHFFFAOYSA-N	446.533	1.855	50	20	IDGD	
COC[C@@]1(C(=O)OCC(=O)NNC(=O)c2ccccc2)CCN(C(=O)OC(C)(C)C)C1	811399470	NDXWKGRKUHYHDZ-OAQYLSRUSA-N	435.477	1.264	50	20	IDGD	
O=C(NNC(=O)N1CCCN2c3ccccc3C[C@H]2C1)C1CCN(c2ncccn2)CC1	811874251	JXWNEZKMXYFABQ-IBGZPJMESA-N	435.532	1.571	50	20	IDGD	
CCOC(=O)c1ccc(NNC(=O)[C@@H](C)NS(=O)(=O)c2cccc(C#N)c2)cc1C	812722446	RHICDCBVGZWWKV-CQSZACIVSA-N	430.486	1.854	50	20	IDGD	
Cc1ccc([C@@H](CN2CCOCC2)NC(=O)NNC(=O)c2c(C)nc3ccccn23)cc1	813492400	LTKMRAGMALYOSK-LJQANCHMSA-N	436.516	1.969	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)Nc1ccc(F)cc1CS(C)(=O)=O	814668631	YAKOKDNJTCDHQU-UHFFFAOYSA-N	444.510	1.769	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NN=C[C@H]1CCCOC1)N(S(C)(=O)=O)CC2	814759336	YYVWBPOPYLRUIZ-RHSMWYFYSA-N	439.534	1.481	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)cc1)[C@@H]1C[C@H]1C	815565598	USCPBCBTOJXGGW-JLTOFOAXSA-N	449.467	1.484	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1ccc(Br)nc1	815751587	FSFZHSZLIVHSLI-UHFFFAOYSA-N	442.295	1.176	50	20	IDGD	
O=C(NNc1ncncc1F)C(=O)Nc1ccc([N+](=O)[O-])c(I)c1	815764875	XWRTUJLDIZTIIA-UHFFFAOYSA-N	446.136	1.210	50	20	IDGD	
O=C(NNC(=O)c1ccc(COc2ccc(Cl)cc2)cc1)C1=C[C@@H](O)[C@@H](O)[C@H](O)C1	816812511	RHBGSVJNYVPSFM-GUDVDZBRSA-N	432.860	1.093	50	20	IDGD	
COc1cccc(/C=C(\C(=O)NNC(=O)c2nnc(O)c3ccccc23)n2nnnc2C)c1	818028356	IMYLNOYYPHUHEP-GZTJUZNOSA-N	446.427	1.098	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)N2CCC[C@@H]2C(=O)N(C)CC(Cl)Cl)o1	819842612	BRPWEMGPUNRJGL-SNVBAGLBSA-N	427.306	1.872	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)[C@@H](CC(C)C)/N=C1/NS(=O)(=O)c2ccccc21	913263217	YBEUHQVKQXZUBX-QGZVFWFLSA-N	428.514	1.909	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)c1ccc(=O)n(-c2ccc(F)cc2)n1	914838849	MTZLHNZLIUBDPA-UHFFFAOYSA-N	426.404	1.610	50	20	IDGD	
CS(=O)(=O)Nc1ccc(F)cc1C(=O)OCC(=O)NNC(=O)c1cccc(Cl)c1	915008613	XWIMBGFNSVTBMZ-UHFFFAOYSA-N	443.840	1.469	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1ccc(Cn2ccnc2)cc1	915056431	HEOYEVQPUAKVKA-UHFFFAOYSA-N	426.502	1.608	50	20	IDGD	
Cc1oc(C(=O)NNC(=O)Cc2c[nH]c3ccccc23)cc1S(=O)(=O)N1CCCC1	916133371	JRRZPZILKGINJT-UHFFFAOYSA-N	430.486	1.858	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NCc2ccnc(N3CCN(C)CC3)c2)cc1C	916390643	UQOSYEBKPQTLDW-UHFFFAOYSA-N	426.521	1.360	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)NCCCN1CCc2ccccc2C1	916459247	OHVKLKOYPMLSCZ-UHFFFAOYSA-N	427.461	1.752	50	20	IDGD	
CCN(CC)C(=O)CCCNC(=O)NNC(=O)COc1ccc(Br)cc1	916577474	BPZSPRWPFMQWNP-UHFFFAOYSA-N	429.315	1.807	50	20	IDGD	
CC(C)(C)C1CCC2(CC1)NC(=O)N(CC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)C2=O	916583590	OAPABEFTFDTWHL-UHFFFAOYSA-N	445.476	1.883	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)CSCc2ccncc2)c1	916734769	VWWQSKNPEAEIJF-UHFFFAOYSA-N	436.559	1.807	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNS(=O)(=O)c2cccc(Cl)c2F)cc1	917720160	DAMDZBDJBFZEFK-UHFFFAOYSA-N	449.913	1.418	50	20	IDGD	
O=C(CCN1CCOCC1)Nc1cccc(CNC(=O)NNc2cncc(Cl)n2)c1	918093494	DRVLROMKSVWOMB-UHFFFAOYSA-N	433.900	1.617	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)c1ccccc1F)C(=O)NNC(=O)CC(F)(F)F	918364679	SDBFTTKYZYVONS-JTQLQIEISA-N	431.433	1.326	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)NCc1cccc(NC(=O)[C@@H]2CCCO2)c1	920238220	SRPYBADAUJCXIH-IBGZPJMESA-N	437.456	1.585	50	20	IDGD	
O=C(NCC1(c2ccc3c(c2)OCO3)CCOCC1)NNc1ccc(-n2cccn2)nn1	920284891	ICAPKXXAXZXJCW-UHFFFAOYSA-N	437.460	1.766	50	20	IDGD	
CCOc1ccccc1C(=O)N1CCC[C@@H]1C(=O)NNC(=O)COc1ccccc1OC	920423890	HWASQIHLJWELHY-QGZVFWFLSA-N	441.484	1.925	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N[C@@H](C)Cn2cccn2)cc1	920853409	CHNYRDZHJUSAFH-JIHKLPAASA-N	447.499	1.742	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)NCc1cccnc1N1CCN(C)CC1	921199355	IELXTVHCYWQMJK-UHFFFAOYSA-N	432.912	1.640	50	20	IDGD	
CCOCCOc1ccc(Br)cc1C=NNC(=O)[C@H]1CCS(=O)(=O)C1	921258213	APJNNOULOMFMDE-LBPRGKRZSA-N	433.324	1.749	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)C[C@H]2Oc3ccccc3NC2=O)CC1	1116087118	IGPDAPJVCLSAQL-MRXNPFEDSA-N	432.477	1.571	50	20	IDGD	
O=C(Cc1c[nH]c2cnccc12)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	1117782960	DNURDCNCYSGRAZ-UHFFFAOYSA-N	427.486	1.351	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)c2cncn2-c2ccccc2)cc1CC(=O)O	1320602530	SVKLYEJRSNWCJX-UHFFFAOYSA-N	430.442	1.131	50	20	IDGD	
Cn1ccc(NNC(=O)c2ccc(NC(=O)C[C@@H]3SC(N4CCCC4)=NC3=O)cc2)n1	1320948480	GRQHPLNSQOSCIT-HNNXBMFYSA-N	441.517	1.599	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)C(C)(C)Oc3ccccc3)cc2)CC1	1322139989	AAXUEOQLRNAASR-UHFFFAOYSA-N	432.546	1.923	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)Cc3ccc(NC(C)=O)cc3)C2)C1	1778257246	TWAWTOXUFVXEAG-RXVVDRJESA-N	437.924	1.271	50	20	IDGD	
Cc1nccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](C)CBr)C3)n1	1778306487	FWNNQGHPRYWHAY-VVFCZOMOSA-N	439.354	1.944	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)c3cccc(F)c3)C2)C1	1780603957	IMCUYDTVCWIVAT-IBUSPFOHSA-N	441.463	1.403	50	20	IDGD	
C=C[C@@H](O)C(C)(C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Br)C1	1780774705	IVOVNMZNJUQEES-UHQDVWGKSA-N	435.334	1.764	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)[C@@H](NC(C)=O)c3ccc(F)cc3)CCO2)C1	1781218932	UHZNXOJRPOJWSH-LQWHRVPQSA-N	439.915	1.850	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)C[C@H](N)c3cccnc3)CCO2)C1	1781227335	JGOOYJZAQNAKGG-SNRMKQJTSA-N	429.348	1.538	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781330330	WITAKTNYZNIARV-YJBOKZPZSA-N	439.285	1.777	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CN2CCCCC2=O)C1	1782105824	BCJQCQPXJJUPNU-CDHQVMDDSA-N	448.391	1.749	50	20	IDGD	
O=C(c1ccc2ccnn2c1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1782404379	CDUALQXRPAMHER-RHSMWYFYSA-N	425.258	1.468	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCn2ccnn2)C1	1782566110	VMRZFYLRVFRIKZ-IIDMSEBBSA-N	442.358	1.356	50	20	IDGD	
O=C(CCc1cnccn1)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCBr)C2	1782579651	NWTVGJVYYMWJDJ-VQIMIIECSA-N	439.354	1.708	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H]3[C@@H](O)CCN3Cc3ccccc3)C2)C1	1782813031	WMQJMDJVZSLVEK-MXBUBSDBSA-N	449.979	1.469	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cnc(N(C)C)o3)CCO2)C1	1783342467	ADXSCEDBAUSCBV-SJKOYZFVSA-N	429.315	1.358	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)C13CC(C(=O)OC)(C1)C3)CCO2	1783354967	GKIWKBWXQZVVBQ-GPIZFROPSA-N	443.338	1.333	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)Cc3ccc(C)c([N+](=O)[O-])c3)CCO2)C1	1783882205	WIOUCJLHJKNLKG-OXQOHEQNSA-N	439.896	1.529	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3cccc(C#N)c3)[C@H]2C1	1783917532	NCEWLXZFPUNXRW-HAGHYFMRSA-N	433.936	1.724	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3ccc(F)c(F)c3)C[C@@H]21)[C@H](O)CCl	1784084483	UTYUNQCIUXHTNY-ZZCKCESHSA-N	430.879	1.477	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3csc(C(F)(F)F)n3)C[C@@H]21)[C@@H](O)CCl	1784091432	UGVCBTYGMGACIZ-QSFUFRPTSA-N	441.859	1.355	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc4c3NC(=O)C4=O)C[C@@H]21	1784617919	QLWWDHQLVAYPHN-SJWGOKEGSA-N	447.919	1.822	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3CCC(CO)CC3)[C@H]2C1	1785053118	NEBIYNSTAKGENX-LKIAZTKLSA-N	426.630	1.616	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cccc(C(=O)N(C)C)c3)C2)C1	1785285191	NLTORKOKZCIQKC-DYESRHJHSA-N	437.924	1.086	50	20	IDGD	
Cc1nc(O)c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)Br)C[C@@H]32)nc1C	1785575098	ZEUWPEBMFLAWRV-HYNSBDGHSA-N	441.326	1.176	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)c3ccc(O)nc3)CCC2)cc1)c1ccc(B(O)O)cc1	1788144285	FQLSCICQWDHIHW-UHFFFAOYSA-N	431.257	1.529	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cn4ncccc4n3)C[C@@H]21	1788762719	PYAXWZCSCCAVHW-ZOBUZTSGSA-N	431.569	1.174	50	20	IDGD	
Cc1nc(C)c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)CBr)C[C@@H]32)o1	1788918781	KGFVUPGENBPWHM-HJPIBITLSA-N	428.327	1.916	50	20	IDGD	
CCOC(=O)N[C@H](O)C(=O)Nc1ccc(C2(NC(=O)CCBr)CCC2)cc1	1789405524	VLBQZJOQHQLHOR-MRXNPFEDSA-N	442.310	1.970	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1ccc(C2(NC(=O)c3ccc(O)nc3)CCC2)cc1	1789520960	BPJDJPHAWUVPRT-UHFFFAOYSA-N	446.467	1.847	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnnc(Cl)c3)C[C@@H]21)[C@H](F)Br	1789922039	CSJQRVGDMDCONF-DJFWLOJKSA-N	435.681	1.414	50	20	IDGD	
COc1ccccc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]2C1	1789924589	NNFBVCGIMGWMPM-MZGVZZPPSA-N	429.286	1.979	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CCCCN3C)C[C@@H]21	1790958565	VFQYHYYOANWIBC-VIQHNZTISA-N	430.387	1.624	50	20	IDGD	
C=C(CC(=O)OCC)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]2C1	1791060860	KNPYDNPZUHVFAL-QPSCCSFWSA-N	431.327	1.259	50	20	IDGD	
C[C@@H](NC(=O)OC(C)(C)C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21	1791156478	FYLAVEYNUNDGLC-VOAKCMCISA-N	438.352	1.683	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1ccc(C2(NC(=O)Cc3ccc(O)cn3)CCC2)cc1	1791603285	OXAZIQWDXRXEEK-UHFFFAOYSA-N	439.516	1.837	50	20	IDGD	
C[C@@H](C(=O)Nc1ccc(C2(NC(=O)c3cnccc3C(=O)NN)CCC2)cc1)n1cccn1	1791880028	IBIGWNKNKFUXDC-HNNXBMFYSA-N	447.499	1.891	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](F)Cl)C3)[C@H](O)C1	1792516648	JWFNZGAILSNMQH-OHQCYIMMSA-N	447.935	1.777	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1n[nH]c(C3CC3)c1F)C2	1792870613	SUCPKHXYPFQPED-ZKCLLBTKSA-N	443.317	1.660	50	20	IDGD	
COc1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](O)CCl)c([N+](=O)[O-])cc1O	1793113275	GFBKXBYRELBATM-JNIYBQFBSA-N	427.841	1.161	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(F)(F)C(F)(F)C(=O)O)C2	1793447583	INBPGXHJEVSJAI-VLEAKVRGSA-N	432.798	1.339	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(C)(C)n1nc(C)ccc1=O)C2	1793449355	UJCXOKLVSKWIPM-DFGXFYAUSA-N	438.956	1.284	50	20	IDGD	
COc1ccc([C@@H]2C[C@H]2C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CCC(=O)NN(C)C)C3)cc1	1793523808	FBTRENSTNMZSNP-WRJHFWDFSA-N	442.560	1.810	50	20	IDGD	
N[C@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1cccc(Cl)c1	1795628573	TYNCGMUMFYMXES-FONWIUJUSA-N	448.720	1.620	50	20	IDGD	
Cc1cc(C)cc(CCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)c1	1796190569	MGTYNYAVBNCJJG-NUNAXRQHSA-N	434.345	1.868	50	20	IDGD	
CCCC(=O)N[C@H](C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2	1798597463	DCGQLXISBVTDHB-GDOUHJCFSA-N	444.536	1.063	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc3ncnn3c1)C2	1799276144	HDVGPZOQKULRAU-QOIYZWAUSA-N	440.331	1.098	50	20	IDGD	
C=C(CC(=O)OCC)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](Br)CC)C2	1799306804	MSASHMUCRIIXFP-FQLMCAECSA-N	431.327	1.259	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(C(F)(F)F)nc1)C2	1800975677	QSPSEIDMQYQYDV-QVHKTLOISA-N	435.830	1.557	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CCc3ccccc3[C@@H]1O)C2)C(Cl)Cl	1801015804	VQSQCJDBILTJIN-IEHFGQBSSA-N	427.328	1.676	50	20	IDGD	
CC(C)(CCl)C(=O)NC[C@H]1CCN(C(=O)CN2C(=O)C=CC2=O)[C@@H]1c1cccnc1	1802902501	OVVPLAVBJXUTKJ-DNVCBOLYSA-N	432.908	1.277	50	20	IDGD	
Cc1ccc(C(=O)NC[C@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)o1	1803781921	GILGIFAXDQTWHL-OXQOHEQNSA-N	448.483	1.615	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)CNC(=O)c2cccnc2)[C@H]1c1cccnc1	1804368864	HOLKBLVWDUTSBA-XKGZKEIXSA-N	443.935	1.930	50	20	IDGD	
CCNC(=O)N[C@@H](C)C(=O)N1CCC2(CCCN(C(=O)[C@@H](C)CBr)C2)CC1	1805385341	WQTDQZAQELWMEU-GJZGRUSLSA-N	445.402	1.956	50	20	IDGD	
Cc1cccc(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)n1	1805508399	VCIVTIOIYONZPZ-UGKGYDQZSA-N	444.300	1.098	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2ccc(F)cn2)[C@H]1c1cccnc1	1805985665	DKSXSEVWSSBPRL-HRAATJIYSA-N	442.495	1.308	50	20	IDGD	
CC[C@H](C(=O)N1CCCC2(CCN(C(=O)c3ccc(B(O)O)cc3)CC2)C1)N(CC)CC	1806170102	WAQQPGALFJUESC-OAQYLSRUSA-N	443.397	1.332	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2nc3ncccn3n2)[C@@H]1c1cccnc1	1808265237	LDALVLRCKMMEGQ-OWCLPIDISA-N	427.896	1.856	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)C(F)F)[C@@H]1c1cccnc1	1808414890	OLROITSBEBGKGH-KXUNFBHXSA-N	432.431	1.487	50	20	IDGD	
COc1cccc(C(=O)N2CCC3(CCCN(C(=O)c4ccc(B(O)O)cc4)C3)CC2)c1	1809969304	CFENEPPDMGADDX-UHFFFAOYSA-N	436.317	1.534	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2ccc3nncn3c2)[C@H]1c1cccnc1	1813030688	LJVWXPCHPNCQKN-IEZWGBDMSA-N	442.907	1.698	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)C23CC(C(=O)OC)(C2)C3)[C@@H]1c1cccnc1	1813032499	CPNINVYMKALYGS-JZIXJXCISA-N	449.935	1.685	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)cn1C	1813071437	SAPQCOZTSFISKN-AVRDEDQJSA-N	440.548	1.421	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2cccc(F)c2)[C@@H]1c1cccnc1	1813072841	KYLAYHKZRVAMMY-PGRDOPGGSA-N	441.507	1.913	50	20	IDGD	
N#CC1(C(=O)NC[C@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)CCC1	1814052108	NQNVYODRJQKZRG-VQIMIIECSA-N	447.499	1.094	50	20	IDGD	
CC(C)(CCl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc3n(n2)CCNC3=O)[nH]n1	1814695633	XMTKKFPTUXJPMQ-AWEZNQCLSA-N	447.927	1.921	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)C2CC(O)C2)n[nH]1	1814800661	UHANOZBSSCHUKA-ASHLQDHDSA-N	441.492	1.307	50	20	IDGD	
CC1(C(=O)N[C@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)CCCC1	1815347934	YCKARZNGTNHYLL-HNNXBMFYSA-N	427.335	1.629	50	20	IDGD	
O=C(CCC1CCC1)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1	1815350557	XTSIGVOOYINKAX-MRXNPFEDSA-N	427.335	1.629	50	20	IDGD	
Cn1ccc(CC(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@H](F)Br)CC3)n1	1815550102	SSHOPISKHVLOJA-OQPBUACISA-N	430.303	1.722	50	20	IDGD	
Cc1cc[nH]c1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1816171346	DWNOZWQZDVMMAJ-INIZCTEOSA-N	436.476	1.664	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)ccc1O	1817472175	AESIGSSLJRIJDY-IBGZPJMESA-N	448.288	1.723	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1	1817473830	BTMQLEWEPDXNEE-DOTOQJQBSA-N	432.717	1.803	50	20	IDGD	
Cc1ccncc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1	1817475186	MNDZGFKKFIUHRY-IBGZPJMESA-N	433.277	1.413	50	20	IDGD	
Cc1nc[nH]c1CSCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1	1819320927	VIWGBMCDYLCJPC-GJZGRUSLSA-N	440.957	1.966	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](C)Br)[nH]n1	1819585783	KRBFOWPGMHHKGG-DMDPSCGWSA-N	426.315	1.876	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](COC)NC(C)=O)sc2C1	1820184871	XDADYSFKDFZXSU-SGMGOOAPSA-N	430.958	1.614	50	20	IDGD	
Cc1cc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)[C@H](O)CCl)[nH]n2)nc2nccn12	1821478070	QQCUDVFNVUYULC-HUUCEWRRSA-N	431.884	1.666	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H]2CCNC(=O)C2)n[nH]1	1822476508	CPBCUVQSSHIGLS-MBNYWOFBSA-N	440.342	1.959	50	20	IDGD	
Cn1cccc(C(=O)N[C@H]2CCc3nc(NC(=O)[C@@H](F)Br)sc3C2)c1=O	1822999483	SERZLPUSXPSNKD-QPUJVOFHSA-N	443.298	1.758	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)C34CC(C(=O)OC)(C3)C4)sc2C1	1825559143	UXIVPWOAPYUSPT-IAPJOXICSA-N	441.937	1.652	50	20	IDGD	
Cc1ncncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827052551	NWOZCXIROAXFCE-OAQYLSRUSA-N	436.321	1.012	50	20	IDGD	
COC[C@@H](C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1	1828923718	VUUIPNPIXVZMIY-BEFAXECRSA-N	431.537	1.201	50	20	IDGD	
CCNC(=S)NCC(=O)N1CCC([C@@H]2CCCCN2C(=O)CO[Si](C)(C)C)CC1	1829104455	YJIJDTHOVHIHAR-KRWDZBQOSA-N	442.702	1.942	50	20	IDGD	
CC(C)n1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)n1	1830364153	AJAZHOLPISOZFQ-HXUWFJFHSA-N	426.945	1.799	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(C)nc(O)c3)C2)C1	1831647494	WMSUSBCYADLEPC-JXFKEZNVSA-N	425.913	1.573	50	20	IDGD	
Cc1ccc(C(=O)C(=O)N2CCC(N3CCC(NC(=O)[C@@H](O)CCl)CC3)CC2)cc1	1833312904	KZUOIFBKIDFMRI-IBGZPJMESA-N	435.952	1.349	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)CCl)CC2)CC1	1833313269	CTRNFNPZBJALIJ-RHSMWYFYSA-N	428.788	1.394	50	20	IDGD	
Cc1cc(F)ccc1C(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)CCl)CC2)CC1	1833313463	HMZGETQZUINYES-IBGZPJMESA-N	425.932	1.919	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)CCBr)C3)C2)cn1	1833993638	HPLACPVKRUKMOW-SFHVURJKSA-N	426.311	1.245	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)nc1	1834379012	MOQHKPPPWCZDDY-RBUKOAKNSA-N	430.332	1.696	50	20	IDGD	
CCN(C)[C@@H](C)C(=O)N1CCC(N2CCC(NC(=O)CCBr)CC2)CC1	1834424257	NQVUGJXBCWIGBP-HNNXBMFYSA-N	431.419	1.683	50	20	IDGD	
Cn1c(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)cc2ccccc21	1835271133	ZNSCBTATBSBSSJ-NRFANRHFSA-N	446.979	1.963	50	20	IDGD	
CC[C@@H](C)[C@H](O)C(=O)N1CCC(N2CCC(NC(=O)CO[Si](C)(C)C)CC2)CC1	1835834785	KGXINDTUMPNCFK-UZLBHIALSA-N	427.662	1.817	50	20	IDGD	
Cc1cc(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](C)Br)CC3)CC2)n[nH]1	1836148344	XBKNYIIRTJUAGS-CYBMUJFWSA-N	426.359	1.687	50	20	IDGD	
C=CC(=O)N[C@@H](C)C(=O)N1CCC(N2CCC(NC(=O)[C@@](C)(Cl)CCl)CC2)CC1	1836399560	DQDVBBSLKUGXBE-XOBRGWDASA-N	447.407	1.485	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc4n(n3)CCC4)CCO2)C1	1837093755	BYDRGYKRHSOOFX-RTBURBONSA-N	445.347	1.136	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(F)n3)CCO2)C1	1837910462	TWVWBVAGMAQJDV-PXAZEXFGSA-N	430.274	1.074	50	20	IDGD	
CC(C)n1nccc1C(=O)N1CCO[C@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1	1838021506	DLNRGDXFOSBGJT-FQEVSTJZSA-N	438.601	1.386	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3CC[C@@H](C(=O)OC)C3)C2)C1	1839141464	JKNMJTMSTXHJEX-QOIOWGMHSA-N	430.929	1.050	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(OC)cc3F)CCO2)C1	1839292130	SWIWYDHNDQMKKE-OXQOHEQNSA-N	428.888	1.922	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccccc3)C2)C1	1840031967	JDVUUKRWTYZFMG-HNAYVOBHSA-N	425.323	1.469	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)/C=C/c3ccc(C)s3)CCO2)C1	1840397414	ZPILLCACWQDAMA-YWMZBHJASA-N	442.965	1.780	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@H](O)C[C@H]1C(=O)N1CC2(CCCN2C(=O)C(C)(C)CCl)C1	1841225785	KHHXZHFPOXWEJJ-GJZGRUSLSA-N	443.972	1.825	50	20	IDGD	
Cc1cc(C(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)nc2ccccc12	1843739058	JTAPNMORGNUPMQ-UHFFFAOYSA-N	429.285	1.354	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1cc(F)cnc1Cl)C2	1844264617	PUAVGPHQWSUDDP-UHFFFAOYSA-N	432.843	1.003	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC2(CCCN2C(=O)c2cc(=O)nc3sccn23)C1	1844623867	NBHBQTQUZXGIBS-LLVKDONJSA-N	439.335	1.604	50	20	IDGD	
O=C(C(Cl)Cl)N1CC2(CCCN2C(=O)c2ccc(-n3c(O)nnc3O)cc2)C1	1844740167	LAQLJZHBVGKASV-UHFFFAOYSA-N	426.260	1.299	50	20	IDGD	
COc1ccc([N+](=O)[O-])c(C(=O)N2CC3(CCCN3C(=O)[C@@H](F)Br)C2)n1	1845217623	KWJVXSDSJDJAMC-GFCCVEGCSA-N	431.218	1.506	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC12CN(C(=O)C[C@H](O)CNC(=O)OC(C)(C)C)C2	1846178452	YELSNTJRFNQLGT-STQMWFEESA-N	448.358	1.249	50	20	IDGD	
COc1ccc(/C=C/C(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)c(F)c1	1846244279	AKGLRDJBHOTMLY-VQHVLOKHSA-N	438.264	1.045	50	20	IDGD	
CC(=O)C[C@@H](C)C(=O)N1CCCC12CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1846325281	BMTORNUWNUCGFC-HIFRSBDPSA-N	429.945	1.937	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@]2(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](O)CCl)C1	1847563042	LVXFRUANDKJSBM-GVZUZGFXSA-N	441.956	1.435	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)C1CCN(c2cc(OC)ncn2)CC1	1847669300	CHANAISAQBWMHK-ULQDDVLXSA-N	435.956	1.921	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CSc1ccc(F)cc1F	1847770855	WAPQEGKFRYZUDP-HOTGVXAUSA-N	440.516	1.632	50	20	IDGD	
O=C(COC(=O)c1ccc([N+](=O)[O-])cc1Cl)NNC(=O)[C@H]1COc2ccccc2O1	11028633	GYLZAQXEKZVLCY-OAHLLOKOSA-N	435.776	1.392	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)c1ccc(S(=O)(=O)N2C[C@@H](C)O[C@H](C)C2)cc1	15692585	VCBHMPSJQACACN-HZPDHXFCSA-N	431.514	1.868	50	20	IDGD	
COc1ccc(OCCCC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1	15896056	VGRJGMOHROOKDV-UHFFFAOYSA-N	435.502	1.566	50	20	IDGD	
Cc1ccc(-n2c(C)cc(/C=C(/C#N)C(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)c2C)cc1	728384414	JDQZUKQDZXMDIM-HPKGMJOESA-N	440.525	1.892	50	20	IDGD	
O=C1COc2ccc(S(=O)(=O)NNC(=O)c3cc(F)ccc3Br)cc2N1	728509307	BWGBOIMIKOUFIS-UHFFFAOYSA-N	444.238	1.542	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)COCc1ccccc1	728948274	DQGGZDBISKQZGX-QGZVFWFLSA-N	426.521	1.876	50	20	IDGD	
CN(CCCOc1ccc(F)cc1)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	728961329	GMLXYEDCJNZSIP-UHFFFAOYSA-N	430.484	1.974	50	20	IDGD	
O=C(NNC(=O)N1CCS(=O)(=O)CC1)[C@@H]1Cc2ccccc2CN1Cc1ccccc1	729228130	ZHRBNCBBYAWUOA-FQEVSTJZSA-N	442.541	1.085	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CCc2ccccc2O)cc1S(=O)(=O)N1CCCC1	730034325	LSNBHINZFROWTM-UHFFFAOYSA-N	447.513	1.579	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)NCCC(=O)NNC(=O)CCc2ccccc2O)cc1	730034353	NGQPDKBHJSLVCQ-UHFFFAOYSA-N	433.486	1.043	50	20	IDGD	
CC(=O)N1CCN(CCOc2ccc(CCNC(=O)NNc3ccc(C)nn3)cc2)CC1	730067150	ONQCZTLLYVBUBD-UHFFFAOYSA-N	441.536	1.197	50	20	IDGD	
O=C(CCCNS(=O)(=O)c1ccc(F)cc1)NNC(=O)c1cccc2ncccc12	730286050	BVAGOOBUWDVAAI-UHFFFAOYSA-N	430.461	1.894	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)c1nnn(C2CCN(C(=O)OC(C)(C)C)CC2)c1C	732084327	ZOGCRHFQJYTLFO-UHFFFAOYSA-N	432.485	1.265	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N(C)CCn2cccn2)cc1	732147950	ZONXMMUAKTYRHS-NBVRZTHBSA-N	447.499	1.696	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)c2cc(Cl)ccc2NS(=O)(=O)c2ccccc2)cn1	735471377	VIACJGZCPRFTFR-UHFFFAOYSA-N	433.877	1.949	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N[C@@H](C)CN2CCN(c3ccccn3)CC2)cc1OC	735517718	FSGDNECICBAPSR-INIZCTEOSA-N	442.520	1.254	50	20	IDGD	
Cc1cc(NNC(=O)c2ccc(Cl)c(S(=O)(=O)NC[C@H]3CCCO3)c2)nc(C)n1	736718424	IHPUQGMAJRQVKF-CQSZACIVSA-N	439.925	1.961	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(F)cc2)C1	737636732	XDILBIAMJWXXPC-KRWDZBQOSA-N	449.504	1.591	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)c1ccccc1NS(=O)(=O)C(F)(F)F	737926464	JEEYWBYCUGNACG-UHFFFAOYSA-N	431.392	1.926	50	20	IDGD	
O=C(CCc1ccccc1)NNC(=O)CCS(=O)(=O)c1ccc2c(c1)OCCCO2	741183045	AVINCJHGHPLCII-UHFFFAOYSA-N	432.498	1.792	50	20	IDGD	
CN(CC(=O)NNC(=O)c1cccc2ccccc12)S(=O)(=O)c1cccc([N+](=O)[O-])c1	741576561	VYXUXFVPMYBCOG-UHFFFAOYSA-N	442.453	1.830	50	20	IDGD	
Cc1ccc(CNC(=O)NCC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)cc1	743829882	GGHHHMTZSCYNDT-UHFFFAOYSA-N	433.490	1.051	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)CN2C(=O)Cn3c(cc4ccccc43)C2=O)cc1C	743842203	PMZBXGAYGPHMNO-UHFFFAOYSA-N	434.452	1.467	50	20	IDGD	
CC(C)(C)C(=O)NNC(=O)CN1CCN(c2cnn(-c3ccccc3)c(=O)c2Cl)CC1	744382818	BACIYLWPLQGUKV-UHFFFAOYSA-N	446.939	1.201	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)O[C@@H](C)C(=O)N2CCN(C(=O)c3ccco3)CC2)cc(C#N)n1C	744633843	ZZDNQADVNDKAGV-GYXHFJGISA-N	449.467	1.621	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)N[C@@H]2CCN(c3cc(C)nn3C)C2=O)c1	745904310	AOILEENJSHKZGZ-QGZVFWFLSA-N	442.520	1.675	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)N[C@H]2CCN(c3cc(C)nn3C)C2=O)cc1OC	745906762	UMMCKPDAGITSMH-HNNXBMFYSA-N	444.492	1.275	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12)N1CCCC1=O	746095172	JZUOEAMDVCUZQE-LJQANCHMSA-N	447.495	1.607	50	20	IDGD	
Cc1c(Br)cccc1S(=O)(=O)NNC(=O)[C@H]1COc2ccccc2O1	747595893	JJWJYAZQHBADGE-CQSZACIVSA-N	427.276	1.907	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@](F)(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)C1	748287742	RDYATNDISHZNQL-SFHVURJKSA-N	443.501	1.090	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)NCc2ccccc2CS(C)(=O)=O)nc2ccccc21	749585061	DRGWYJBLHNGYSC-UHFFFAOYSA-N	429.502	1.191	50	20	IDGD	
Cn1c(N)c(C=NNC(=O)c2cc(-c3ccc(F)cc3)nc3ccccc23)c(=O)n(C)c1=O	749812314	MOBSJDQNTHGJRI-UHFFFAOYSA-N	446.442	1.784	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2cn(CC(C)C)cn2)cc1Br	749865889	WNTCVFCQNILCOM-UHFFFAOYSA-N	431.312	1.934	50	20	IDGD	
CCOC(=O)[C@@H](NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1ccccc1	750141371	BEASPMGNDVMQBB-IBGZPJMESA-N	447.513	1.246	50	20	IDGD	
C[C@H]1C[C@@H](NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)CCN1Cc1ccccc1	751097046	BBELASOEGMSVKL-WMZOPIPTSA-N	448.527	1.931	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)c1cc(Cn2cc(Br)cn2)on1	751927593	OHBBLJXVDDOHAP-UHFFFAOYSA-N	436.222	1.228	50	20	IDGD	
COc1cc(OC)cc(N2C[C@@H](C(=O)NNC(=O)COc3cc(C)cc(C)c3)CC2=O)c1	752399031	OUMITKYVZWYMOJ-INIZCTEOSA-N	441.484	1.900	50	20	IDGD	
C[C@@H](C(=O)OCC(=O)NNC(=O)c1cccc(C#N)c1)c1ccc(S(C)(=O)=O)cc1	753480868	AKIJBIZVHOKWTC-CYBMUJFWSA-N	429.454	1.070	50	20	IDGD	
O=C(Cc1ccc2ccccc2c1)NNC(=O)NC1CCN(S(=O)(=O)C2CC2)CC1	753968292	UJXXEQOTXNMHJC-UHFFFAOYSA-N	430.530	1.669	50	20	IDGD	
Cc1oc(S(N)(=O)=O)cc1C(=O)OCC(=O)C(C#N)=C1N(C)c2ccccc2N1C	754143941	PYOFLYXETHFSJD-UHFFFAOYSA-N	430.442	1.283	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)c1ccccc1F)C(=O)NN=c1cc[nH]cc1Cl	757418917	MKJWYWJKPXIVPZ-CQSZACIVSA-N	432.930	1.839	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)Nc3cc(C)cn(C)c3=O)n[nH]2)cc1OC	757715303	JVPMSIYXXHPHJR-UHFFFAOYSA-N	426.433	1.568	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2ccccc2O[C@H](C)C#N)cc1	757979308	YLRCNTSKDLUDEY-OAHLLOKOSA-N	445.501	1.759	50	20	IDGD	
CN(NC(=O)c1cccnc1N1CCCC1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758781458	FDRYIOSPMIGLQZ-UHFFFAOYSA-N	432.525	1.931	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)c1ccc(S(=O)(=O)Nc2nccs2)cc1	763011190	DEPQFRSFGLWEQI-UHFFFAOYSA-N	447.454	1.927	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(C(=O)N2CCCC2)c(F)c1)c1cccc([N+](=O)[O-])c1	763417998	KWTZRJVMWHRYTR-UHFFFAOYSA-N	436.421	1.593	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)NNC(=O)c1ccc(Br)s1	763461014	PSIYNIMILQXLID-UHFFFAOYSA-N	445.320	1.984	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)c2cc3ccccc3cc2O)cc1	763518529	WSXYEEUBYJRDLI-UHFFFAOYSA-N	437.408	1.497	50	20	IDGD	
COC(=O)c1cc(Br)ccc1NC(=O)C(=O)NNC(=O)c1ccccc1F	763568455	KXWYTPMEBKIMDQ-UHFFFAOYSA-N	438.209	1.775	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1cccc(Cl)c1-n1cncn1	763629413	JDSFYVHSKYVCSX-UHFFFAOYSA-N	438.835	1.277	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccccc1SCCC#N	763645876	DCWLJJMUGUJDES-UHFFFAOYSA-N	428.470	1.866	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2ccc(C)c(NS(C)(=O)=O)c2)c1	763647605	OFSOHLPLARAWLP-UHFFFAOYSA-N	448.501	1.148	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(F)c(C(=O)N(C)C)c2)cc1C	763665490	WNWLHMBEEPMWNN-UHFFFAOYSA-N	430.436	1.309	50	20	IDGD	
N#Cc1ccc(OC(F)F)c(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)c1	763745400	DTUIFCNNDDGPPZ-UHFFFAOYSA-N	443.410	1.698	50	20	IDGD	
CS(=O)(=O)Cc1cc(F)ccc1NC(=O)C(=O)NNC(=O)c1cccc(Cl)c1	763747556	AVSBWMLORMUMJZ-UHFFFAOYSA-N	427.841	1.423	50	20	IDGD	
COC(=O)CCOc1ccc(NC(=O)C(=O)NNC(=O)Cc2c[nH]c3ccccc23)cc1	763860991	NGVCEHAOBGOZFW-UHFFFAOYSA-N	438.440	1.438	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1cc(C(F)(F)F)cnc1O	763872100	KCLIMKUXHMQSTH-MRVPVSSYSA-N	430.314	1.499	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)NC(=O)CC3)cc1OC	763912520	PGQXEFFDZXFDPB-UHFFFAOYSA-N	440.456	1.768	50	20	IDGD	
O=C(Cc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1ccn(CCc2ccncc2)n1	763936116	DTXGKNUKHVRIID-UHFFFAOYSA-N	426.864	1.503	50	20	IDGD	
COC(=O)c1cc(F)ccc1NC(=O)C(=O)NNC(=O)c1ccc(Br)s1	763939668	BNMLWVHKGGRJPR-UHFFFAOYSA-N	444.238	1.836	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc(S(=O)(=O)N2CCCC2)cc1	763950241	MMQKXSLXGXJEBM-UHFFFAOYSA-N	430.486	1.179	50	20	IDGD	
CCC(C)(C)OCc1cccc(NC(=O)C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)c1C	764001975	IJAAKGDOSQCBBB-HNNXBMFYSA-N	439.534	1.221	50	20	IDGD	
CN1CCCN(c2ccc(NC(=O)C(=O)NNC(=O)c3ccc(Cl)nc3)cc2)CC1	764098934	QFEJGSGMNBKICI-UHFFFAOYSA-N	430.896	1.277	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)nc1)C(=O)Nc1cccc(Cl)c1N1CCOCC1	764101414	QQCWNMNICICEQQ-UHFFFAOYSA-N	438.271	1.625	50	20	IDGD	
COC(=O)c1c(NC(=O)C(=O)NNC(=O)c2ccc(Cl)nc2)sc2c1CCCC2	764101630	SNNITIUZZBPQMV-UHFFFAOYSA-N	436.877	1.862	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2ccccc2C(=O)N2CCCC2)cc1	764126105	FJFIIJKEUGCIRI-UHFFFAOYSA-N	438.484	1.650	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(OC)c(OC)cc2F)o1	764139086	NSSGVBKSPMIZLH-UHFFFAOYSA-N	436.440	1.677	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)C(=O)Nc1cnn(-c2ccc(C(F)(F)F)cc2)c1	764268761	PTEXSDQONHRKOX-UHFFFAOYSA-N	432.362	1.615	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)ccc1O)C(=O)Nc1ccccc1-n1cncn1	764276312	BZTUOTLALJEASC-UHFFFAOYSA-N	445.233	1.135	50	20	IDGD	
CC(C)(C)OC(=O)N1CCc2c(cccc2NC(=O)C(=O)NNC(=O)Cc2cc[nH]n2)C1	764294070	UGIRCHXOXKXGCC-UHFFFAOYSA-N	442.476	1.032	50	20	IDGD	
Cc1ccc([C@@H](C)[C@H](O)C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)cc1	765129088	YJNZXQHBBXUBTI-UZLBHIALSA-N	433.530	1.624	50	20	IDGD	
CCOc1ccc(NS(=O)(=O)c2ccc(C(=O)NNC(=O)c3cc(C)[nH]n3)cc2)cc1	765583974	UAISERZIUSIJQO-UHFFFAOYSA-N	443.485	1.992	50	20	IDGD	
CCn1c(=O)c(=O)[nH]c2cc(C(=O)NNC(=O)c3cc(-c4ccccc4OC)[nH]n3)ccc21	765598702	CWTXBOTWWXFKRA-UHFFFAOYSA-N	448.439	1.183	50	20	IDGD	
CCc1ccc(C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)cc1S(C)(=O)=O	765760400	JFUJZUDFROMUPF-UHFFFAOYSA-N	437.543	1.850	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)NCc1cccc(N2CCCS2(=O)=O)c1	765891944	KTNBSJGFNBLDIS-UHFFFAOYSA-N	443.485	1.008	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CC(=O)N(c2ccc(Cl)c(F)c2)C1)c1nnc(O)c2ccccc12	766556342	RXBKTCZPIMSLHA-SNVBAGLBSA-N	443.822	1.942	50	20	IDGD	
CCOC(=O)NNS(=O)(=O)c1ccc(F)c2ncc(I)cc12	768263893	YMWVPBYTONRACC-UHFFFAOYSA-N	439.206	1.918	50	20	IDGD	
CC(C)[C@H](NC(=O)OC(C)(C)C)C(=O)NCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	768280638	UUBUTLWAERKWKK-HNNXBMFYSA-N	437.453	1.021	50	20	IDGD	
C[C@H]1CN(C(=O)NNC(=O)c2ccc3ccccc3c2)CCN1c1nccn2cnnc12	771201569	KVAMGUIEWYXBNI-HNNXBMFYSA-N	430.472	1.843	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(C)(C)N1C(=O)c2ccccc2C1=O	771477038	AUBMNVAWTQVOSA-UHFFFAOYSA-N	431.470	1.617	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)[C@@H]1CC(=O)N(c2ccc(F)c([N+](=O)[O-])c2)C1	771973280	IYMXXBJHGHTGCN-NWDGAFQWSA-N	438.412	1.212	50	20	IDGD	
CCCCn1ncc(C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)c1C	772460244	RQANBJWTGKKAGA-UHFFFAOYSA-N	435.554	1.080	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)[C@@H]1CCCN(C(=O)N2CCCC2)C1	772898411	QOFBYLBPAHSAAI-OAHLLOKOSA-N	435.912	1.031	50	20	IDGD	
CCOc1ccccc1C(=O)NCC(=O)NNC(=O)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	774270555	KBMOOAWKCFDVHI-OAHLLOKOSA-N	448.520	1.610	50	20	IDGD	
O=C(NNc1cnccn1)c1cc(S(=O)(=O)N2CCCCC2)ccc1N1CCOCC1	775277460	DBHJMQHIJQPBOY-UHFFFAOYSA-N	446.533	1.245	50	20	IDGD	
O=C(NCC(=O)N1CCOCC1)NNc1ccc(Br)cc1C(F)(F)F	776637468	ZFHCEQPWALXZCL-UHFFFAOYSA-N	425.205	1.953	50	20	IDGD	
Cc1cc(Br)cc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)c1	777140900	DOASBOBABHNCIP-UHFFFAOYSA-N	434.246	1.928	50	20	IDGD	
CC[C@@H](C)Oc1cc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)ccn1	777420623	WGQIUEWOKUKLFF-QGZVFWFLSA-N	439.516	1.478	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NC[C@@H]2COC3(CCCCCC3)O2)c2ccccc2c1=O	777764153	MAVFJZMEVKLTES-OAHLLOKOSA-N	443.504	1.826	50	20	IDGD	
O=C(c1ccc(Br)c(O)c1)N1CCN(S(=O)(=O)CBr)CC1	779544745	NPWNPJUMIQVAGJ-UHFFFAOYSA-N	442.129	1.595	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)c1nn(-c2ccc(F)cc2)cc1O	779547693	MAOMBXSEYXFHKD-UHFFFAOYSA-N	431.811	1.448	50	20	IDGD	
COC(=O)c1cc(C(=O)NNc2nc3ccccc3c(=O)n2CCCOC(C)C)on1	781426645	LICCRUBFEUMBTD-UHFFFAOYSA-N	429.433	1.743	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccc(C#N)cc2Cl)nc1	783261989	ABWATPUHMZSHCT-UHFFFAOYSA-N	436.881	1.375	50	20	IDGD	
Cc1nnnn1-c1cc(NC(=O)C(=O)NN=c2sc3ccccc3n2C)ccc1F	783352071	MFQWCXQUAVQEMK-UHFFFAOYSA-N	426.437	1.234	50	20	IDGD	
CC(C)(C)n1nc(-c2ccccc2)cc1NC(=O)C(=O)NNC(=O)C(=O)N1CCCC1	784000576	WDGMPCIFOIFSAT-UHFFFAOYSA-N	426.477	1.013	50	20	IDGD	
CCCCOc1ccc(NC(=O)C(=O)NNC(=O)CNC(=O)c2cccs2)c(C)c1	784004702	JWQBEUKMRJVHFC-UHFFFAOYSA-N	432.502	1.751	50	20	IDGD	
COc1cccc(NNC(=O)C(=O)Nc2ccc(C(=O)N3C[C@@H](C)O[C@H](C)C3)cc2)n1	784844467	ZDLMEABVVAJGAU-ZIAGYGMSSA-N	427.461	1.421	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2cccc(C(=O)OC)c2)cc1	784854288	VHWTXWVFCOFCGD-UHFFFAOYSA-N	448.501	1.586	50	20	IDGD	
Cc1cc2ccccc2nc1NNC(=O)C(=O)Nc1ccc(CNS(C)(=O)=O)cc1	785164793	JWXAHPVXWCGJBI-UHFFFAOYSA-N	427.486	1.674	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2ccc3cnn(CCOC)c3c2)n1	785226149	QSFOJERXGAZYMT-UHFFFAOYSA-N	426.481	1.401	50	20	IDGD	
COCCS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2cc(F)cc(OC)c2)cc1	785234560	NGFSXHFOLZWFSB-UHFFFAOYSA-N	425.438	1.336	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2cc3ccccc3cc2O)cccc1N1CCNC1=O	787540739	DYHJYUJCGPVURN-UHFFFAOYSA-N	447.451	1.783	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2c[nH]c3ccccc23)cc1C(=O)N1CCOCC1	787540877	GHXLVTOCERBVCB-UHFFFAOYSA-N	449.467	1.348	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2cnn(CCO)c2-c2ccccc2)c2ccccc2c1=O	788262057	IBMFXOUOQPYEQP-UHFFFAOYSA-N	446.467	1.347	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2cc(-c3cccc(C#N)c3)no2)n1	789123638	HABOBEYWTXBDAS-UHFFFAOYSA-N	425.426	1.525	50	20	IDGD	
CN(C)N(C(=O)CSc1nncn1-c1cccc(Cl)c1)[C@@H]1CCS(=O)(=O)C1	792848910	HIHBYJKQFZNOAE-CQSZACIVSA-N	429.955	1.505	50	20	IDGD	
CN(C)c1nccc(NNC(=O)C(=O)Nc2ccc3c(c2)N(CC(F)F)CCS3)n1	793046425	MCRMAKMDOHDNTK-UHFFFAOYSA-N	437.476	1.802	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CS(=O)(=O)Nc2ccc(N3CCCCC3)cc2)n1	794080404	MNLOKBILTLAWFC-UHFFFAOYSA-N	431.518	1.583	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cccc(C)n2)cc1S(=O)(=O)Cc1cc(C)no1	794090525	URPKQZWPKOKZIY-UHFFFAOYSA-N	444.469	1.744	50	20	IDGD	
C[C@H]1CCC(=NNC(=O)C(=O)NN=C2CC[C@@H](C)C[C@@H]2n2cncn2)[C@@H](n2cncn2)C1	794453074	IVGFEELHLMMELH-DACLVMHWSA-N	440.512	1.236	50	20	IDGD	
COC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)COc2ccccc2OC)c1C	798042431	RMAMIYWVFJAYQF-UHFFFAOYSA-N	430.417	1.347	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)[C@H](C)NS(=O)(=O)c2cccc(C#N)c2)c2ccccc2n1	799009442	YJXGAUYNJVSCER-AWEZNQCLSA-N	437.481	1.543	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)C(=O)Nc1cncc(F)c1	799258633	IRXQAEMNWMMMJD-SECBINFHSA-N	425.214	1.537	50	20	IDGD	
CCn1ncc2cc(C(=O)NNC(=O)CN3CCN(Cc4ccc(C)cc4)CC3)c(C)nc21	799423374	VLWZAZYTHRRBBT-UHFFFAOYSA-N	449.559	1.647	50	20	IDGD	
CCn1ncc2cc(C(=O)OCC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)c(C)nc21	799573234	JLPGAVKEIYTJPO-UHFFFAOYSA-N	426.389	1.286	50	20	IDGD	
CC[C@@](O)(C(=O)N1CCN(S(=O)(=O)CBr)CC1)c1cccc(Cl)c1	800530748	PGRANBPIVAYFTG-HNNXBMFYSA-N	439.759	1.764	50	20	IDGD	
CCCn1c(=O)nc(O)c2c(C(=O)NNC(=O)N=c3cc[nH]cc3)cc(C(C)C)nc21	802027122	SGFRZLJNPIVQEG-UHFFFAOYSA-N	425.449	1.314	50	20	IDGD	
O=C(NNC(=O)c1cc(Cn2cc(Br)cn2)on1)Nc1ccc2c(c1)OCO2	802099308	ORQHASMNCAGORM-UHFFFAOYSA-N	449.221	1.877	50	20	IDGD	
C[C@H](C#N)S(=O)(=O)c1ccc(NC(=O)NNC(=O)COc2ccc(C#N)cc2)cc1	806457931	CVLVBNLGVJVVRA-CYBMUJFWSA-N	427.442	1.476	50	20	IDGD	
O=C(NCCc1cc(Cl)c2c(c1)OCCO2)NNC(=O)[C@@H]1COc2ccccc2O1	807026247	MNRSXSNFHYRZHY-KRWDZBQOSA-N	433.848	1.824	50	20	IDGD	
CC(C)(C(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1)c1csc(-c2cc(F)ccc2F)n1	809972755	MWBIIELYQSPBSM-JTQLQIEISA-N	443.497	1.948	50	20	IDGD	
CCOC(=O)c1ccc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1	811276523	NPWGBWWSTSINSI-KRWDZBQOSA-N	428.397	1.008	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(=NNC(=O)C(=O)Nc2ccccn2)[C@@H]([C@H]2CCOC2)C1	812226322	KVBPIBFYZBDEMM-LSDHHAIUSA-N	431.493	1.786	50	20	IDGD	
COc1cc(F)c(F)cc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	813033949	SJLAUHMQRISTTH-UHFFFAOYSA-N	428.417	1.306	50	20	IDGD	
O=C(NNc1cccc(Cl)n1)C(=O)Nc1ccccc1OCC(=O)N1CCOCC1	815726034	KZJRFBHBTDTYOH-UHFFFAOYSA-N	433.852	1.054	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)c1ccc2c(c1)C[C@@H](C)N2S(C)(=O)=O	825637071	NMAZUTGHQCJMLJ-CYBMUJFWSA-N	432.502	1.279	50	20	IDGD	
O=C(COC(=O)C1(c2cccc(Cl)c2)CC1)NNC(=O)[C@@H]1COc2ccccc2O1	913392901	YXBNCMPBGWSHOF-KRWDZBQOSA-N	430.844	1.902	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)c1ccc(S(=O)(=O)NCC(C)C)cc1	914829697	MCLFRDUGPWEZMZ-UHFFFAOYSA-N	435.502	1.470	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)CN2C(=O)COc3cc(Br)ccc32)cc1	915287317	DXWGBMBGNAUKJT-UHFFFAOYSA-N	448.273	1.709	50	20	IDGD	
COC(=O)c1sc(S(=O)(=O)NNC(=O)c2cc(C)oc2C)c(C(=O)OC)c1C	916110170	PCKRWMIKKGCVOC-UHFFFAOYSA-N	430.460	1.463	50	20	IDGD	
Cn1ccnc1[C@@H](NC(=O)NNC(=O)COc1ccccc1[N+](=O)[O-])c1cccc(F)c1	916223823	DXMIEGSTJGQIFH-SFHVURJKSA-N	442.407	1.966	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)N[C@@H]3CCCc4occc43)nc2)CC1	916576230	PVSFKTZBRRHZHJ-MRXNPFEDSA-N	434.522	1.314	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(C(=O)NNC(=O)Cc2ccc3ccccc3c2)cc1	917195275	AVRZMLVSUUUDDL-UHFFFAOYSA-N	441.509	1.768	50	20	IDGD	
N#Cc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)c3ccc(Cl)nc3)CC2)cc1	917251119	RNXAADOJCREAJO-UHFFFAOYSA-N	447.904	1.469	50	20	IDGD	
CCN1C(=O)c2ccc(C(=O)NNC(=O)CSc3ccc(C)cc3)cc2S1(=O)=O	917520945	DKLNSPAVWFXOHN-UHFFFAOYSA-N	433.511	1.713	50	20	IDGD	
COc1cc(C=NNC(=O)[C@H]2CCS(=O)(=O)C2)cc(Br)c1OC(F)F	917544909	OBWPQQLMVNKFOP-VIFPVBQESA-N	441.250	1.944	50	20	IDGD	
NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NNC(=O)COc3ccccc3F)cc2)C1	918002206	UZYHBJCTWROTDA-MRXNPFEDSA-N	443.479	1.437	50	20	IDGD	
COc1ccc(CNC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc1[N+](=O)[O-]	918019206	XIMBJFYFRDYTFG-UHFFFAOYSA-N	426.389	1.639	50	20	IDGD	
O=C(COC(=O)c1c[nH]n2c1nc(=O)c1ccccc12)NNC(=O)c1ccc(Cl)cc1	919466901	QTAYFTKGMYLUSV-UHFFFAOYSA-N	439.815	1.447	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)NC[C@@H](c1ccc(F)cc1)N1CCOCC1	919897953	SXZOXDHWIDQUHF-IBGZPJMESA-N	430.480	1.781	50	20	IDGD	
CCCc1noc2nc(-c3ccco3)cc(C(=O)NNC(=O)N[C@@H]3CCS(=O)(=O)C3)c12	920291602	BNWSBEYNCGKWOM-LLVKDONJSA-N	447.473	1.566	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)NC[C@H](c1cccc(F)c1)N1CCOCC1	921247430	FAPHGSZDYXIXHX-GOSISDBHSA-N	446.479	1.617	50	20	IDGD	
COc1nn(C)c2nc(C)c(CCC(=O)NNC(=O)c3n[nH]c4c3CCCC4)c(C)c12	1318438633	AAMJCKKSQRMJMU-UHFFFAOYSA-N	425.493	1.589	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)ccc1N1CCN(C)CC1	1321010105	KVZLPDXSUFMJJU-FQEVSTJZSA-N	425.489	1.740	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@@H](C(=O)NNC(=O)c3n[nH]c4c3CCCC4)C2)cc1	1321932002	VMSZHFAXHPKZAV-OAHLLOKOSA-N	445.545	1.459	50	20	IDGD	
Cc1n[nH]c(C)c1CC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CO[Si](C)(C)C)C2	1780826995	OPKBBLAFGSELSH-WIYYLYMNSA-N	436.629	1.934	50	20	IDGD	
O=C(Cc1[nH]nc2c(Cl)cccc12)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1780937094	BEUQJVHCFBSZME-HNAYVOBHSA-N	441.315	1.188	50	20	IDGD	
Cc1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)C(Cl)Cl)C3)nc2nccn12	1781312797	WSCZFRQNFHXJMT-AUUYWEPGSA-N	440.331	1.969	50	20	IDGD	
O=C([C@@H](F)Br)N1CC[C@@]2(C1)CN(C(=O)[C@H]1Cc3ccccc3CN1)CCO2	1781332090	ZQNMNENRWADXKC-GPMSIDNRSA-N	440.313	1.221	50	20	IDGD	
O=C(c1ccc2ncncc2c1)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781332347	XQIMPSISAODGOI-MAUKXSAKSA-N	437.269	1.764	50	20	IDGD	
O=C(c1ccc([N+](=O)[O-])cc1F)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1781554068	OXSMPDIEGXFTIN-CJNGLKHVSA-N	448.220	1.868	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cn(C)cn1)C2	1781899651	BRJYXPNTMUKFTQ-JCKWVBRZSA-N	427.343	1.721	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1noc3c1CCCC3)C2	1782172931	QSQOMLKQIVQLCY-QLVMHMETSA-N	439.940	1.935	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(C3CC3)on1)C2	1782210035	BHSDBEHISVVEHT-XMSQKQJNSA-N	447.536	1.053	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cn3cccnc3n1)C2)C(Cl)Cl	1782218081	RLSPJUSELPPKBM-FZKQIMNGSA-N	426.304	1.661	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3n[nH]c4c(Cl)cccc34)C2)C1	1782219620	CEMRBPWBDFAGOQ-AUUYWEPGSA-N	441.315	1.914	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cc4cccn4cn3)CCO2)C1	1783349499	MNZZEVQPQULSJT-BEFAXECRSA-N	435.322	1.951	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccccc3-n3nccn3)CCO2)C1	1783537795	RLKAPYHHWQHWOI-LIRRHRJNSA-N	448.321	1.494	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)CC34CCCN3CCC4)CCO2)C1	1783538389	VEFNZXQKWYOLSJ-DNVCBOLYSA-N	428.371	1.618	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)COc3cccc(Cl)c3)CCO2)C1	1783869354	PBHJHNZRSVSWIU-APWZRJJASA-N	431.316	1.803	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccn(-c4ccccc4)n3)CCO2)C1	1783880627	FAOKEIJBWVXNMO-UWJYYQICSA-N	432.908	1.570	50	20	IDGD	
CC#C[C@@H](CC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](Cl)COC)CCO2)c1ccc(O)cc1	1784012803	CCPHBQRMBSJCPM-NOXFTYBFSA-N	448.947	1.973	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCOc3ccc(F)cc3)C[C@@H]21)[C@@H](O)CCl	1784084518	WBRWLDSDPZFNDK-MGHWNKPDSA-N	428.888	1.174	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@]2(CCN(C(=O)C3(F)CCC3)C2)C1	1784874776	YNBXZSPNABHWDN-IFXJQAMLSA-N	447.935	1.841	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3ccc(F)nc3)[C@H]2C1	1785233773	GXBZLFPLPWOTGB-BZSNNMDCSA-N	437.588	1.985	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3ccn(C)n3)[C@H]2C1	1787049252	ORZPRNNHZZRLPN-TUUVXOQKSA-N	427.343	1.116	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)[C@@H](O)c3ccccc3)CCC2)cc1)c1cccc(B(O)O)c1	1788143529	BRBGETSMJDXYOX-QFIPXVFZSA-N	444.296	1.848	50	20	IDGD	
C[C@H](Nc1ccccn1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21	1788781967	QGQUEOGVGBJIDL-SMSYFYOWSA-N	443.317	1.552	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1ccc(C2(NC(=O)[C@@H](O)CCl)CCC2)cc1	1789519985	XHCHZBWCPUXZFV-INIZCTEOSA-N	431.880	1.033	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3n[nH]c(C4CC4)c3F)C[C@@H]21)[C@H](F)Br	1789922785	SDBBAYXGLMFJNV-VEABSNGSSA-N	447.280	1.710	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc4c(c3)CCNCC4)[C@H]2C1	1790618182	XHHFKHFBAFPMLZ-WBKMXMRLSA-N	448.995	1.771	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21)C1CCC2(CC1)OCCO2	1790738227	LYYWBKRLCCJEJX-KKUMJFAQSA-N	435.348	1.703	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@@H](O)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CO[Si](C)(C)C)C2	1793008746	AIERUGLTRMEFRI-QKPAOTATSA-N	443.617	1.362	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1=NN(c3ccccc3)C(=O)C1)C2	1793446832	NWTCGRQTILYGRJ-MQJTVSLUSA-N	446.935	1.776	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnc(OC)c(C)c1	1794984955	AHAVIXMAVAFGLU-FZKCQIBNSA-N	440.338	1.775	50	20	IDGD	
Cc1scc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)c1C	1795332490	YVKWZESQXXEGCP-QDMKHBRRSA-N	427.530	1.929	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)c1cccc(-c2ccccc2)n1	1796536023	HIIGOOLBFGJBHB-JSJNYSNDSA-N	429.904	1.552	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc2c[nH]nc2c1	1796634177	DGWGAHUYCYMRHT-MUJYYYPQSA-N	433.472	1.127	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnn(C)c1Cl)C2	1796891978	SIUJTQIOFCOMCJ-MGGJZVGQSA-N	445.911	1.459	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CC12CCCN1CCC2	1799213765	LBFDVTIPEFXLNM-DFGXFYAUSA-N	442.398	1.768	50	20	IDGD	
CO[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)Br)c1ccccc1	1800757101	ULPUGVVVZWFVJU-RKOFLFEYSA-N	425.323	1.747	50	20	IDGD	
Cc1ccn2ncc(C(=O)N3CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]3c3cccnc3)c2c1	1803139660	SKCDJLIPFBKEGK-UXPWSPDFSA-N	441.919	1.957	50	20	IDGD	
CN(C)c1cncc(C(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]2c2cccnc2)c1	1803142052	VNWUPLQWGMNODH-ATZDWAIDSA-N	431.924	1.462	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)CCc2ccco2)[C@H]1c1cccnc1	1804590970	JGXDSEPDYFGPPJ-FDDCHVKYSA-N	441.532	1.686	50	20	IDGD	
O=C(c1ccc(N2CCOCC2)cc1)N1CCC2(CCCN(C(=O)[C@H](O)CCl)C2)CC1	1805523147	IGQGMTJMAOFEHA-HXUWFJFHSA-N	449.979	1.968	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)CCC2CCC2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807359679	KYSZQTYGTLEOAL-NFBKMPQASA-N	435.333	1.661	50	20	IDGD	
Cn1cnc(C(=O)N2CC[C@H](CNC(=O)[C@@H](F)Br)[C@H]2c2cccnc2)n1	1808652141	UFJPROGDNYAWLQ-JHJVBQTASA-N	425.262	1.220	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2cnncc2C(=O)O)[C@@H]1c1cccnc1	1813031983	STWIBAHKFNEQMR-XOKHGSTOSA-N	447.879	1.143	50	20	IDGD	
CN(CC(=O)N1CCCC[C@H]1c1cc(NC(=O)C(C)(C)CCl)n[nH]1)C(=O)C(=O)O	1814698864	FRILVSKBGIRQND-LBPRGKRZSA-N	427.889	1.210	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccccc2O)n[nH]1	1816265452	FZGHRPBIUIUNPJ-KRWDZBQOSA-N	449.471	1.734	50	20	IDGD	
Cc1ccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)[nH]n2)nc1	1816542104	MFIFOCHZJMTJFB-GOSISDBHSA-N	448.487	1.731	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)CC(F)(F)C(=O)O)sc2C1	1817095788	NWDXFCPPRANBHJ-NKWVEPMBSA-N	440.266	1.949	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1)c1ccc(-n2cnnc2)cc1	1817204032	PHKJKKHIXANGMS-SJORKVTESA-N	443.895	1.896	50	20	IDGD	
CN[C@H](CC(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](C)Br)[nH]n1)C(=O)O	1817368302	IBFPZGNRYISCBW-MVWJERBFSA-N	430.303	1.248	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](Cl)COC)CC2	1819694967	MYPYAJUXROFJDL-VWYCJHECSA-N	431.946	1.017	50	20	IDGD	
CC(C)NC(=O)OC(C)(C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1	1820739356	FXNDMHGOMAEBNV-KGLIPLIRSA-N	443.932	1.915	50	20	IDGD	
Cc1cc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)CCC(=O)NN(C)C)CC3)c(C)n1C	1821117048	UGXOEXSGYXURFF-AWEZNQCLSA-N	446.577	1.697	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3ccnc4c3OCO4)sc2C1	1821235877	VHFNRGXYWPKBTD-GXSJLCMTSA-N	438.893	1.746	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H]2[C@H]3C=CS[C@H]32)n[nH]1	1821710586	AZRRQOUWGPPNPN-NCGUTPBLSA-N	432.550	1.650	50	20	IDGD	
Cc1ccc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2ccc(B(O)O)cc2)CC3)cc1C	1822143747	RTPZPIRSBZUHLS-GOSISDBHSA-N	449.341	1.979	50	20	IDGD	
CN[C@H](CC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](C)Br)n[nH]1)C(=O)O	1822183861	NRVVNNZGDGZTLL-MVWJERBFSA-N	430.303	1.248	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCCn2ccnc2)n[nH]1	1822718691	NLIXTZNOQUBJDL-QGZVFWFLSA-N	444.540	1.452	50	20	IDGD	
Cc1cc(NC(=O)CC(=O)N2CCC([C@@H]3CCCCN3C(=O)[C@H](O)CCl)CC2)no1	1824182442	CEDSRXVGNNUUKL-JKSUJKDBSA-N	440.928	1.531	50	20	IDGD	
O=C(O)CSCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCBr)CC2	1826110595	OGYRXSGSYUCATI-MRVPVSSYSA-N	436.353	1.658	50	20	IDGD	
CNC(=S)NCCC(=O)N1CCC([C@H]2CCCCN2C(=O)CCBr)CC1	1826359050	UGCHETVYJHGGPY-OAHLLOKOSA-N	447.443	1.875	50	20	IDGD	
COc1ccccc1OCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1830230409	CAYUNUGAECPOJW-PKOBYXMFSA-N	430.860	1.065	50	20	IDGD	
C[C@H](Cc1ccc(F)cc1)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1	1830735502	HVCZTVLLBVBYPJ-FPDPHYFHSA-N	442.915	1.060	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cncc(N(C)C)c3)C2)C1	1831644340	VRKOLTCQXPYXFP-WIYYLYMNSA-N	438.956	1.625	50	20	IDGD	
O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)CCc1ccco1)CCO2	1833045967	ATXNNCCMDARCTF-SFHVURJKSA-N	429.311	1.454	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(C)nc3)CCO2)C1	1833998682	NHODFEPZIPBOFU-APWZRJJASA-N	440.338	1.634	50	20	IDGD	
COC(=O)CCC(=O)NC1CCN(C2CCN(C(=O)[C@@](C)(Cl)CCl)CC2)CC1	1834434586	LQFLREGWLZMAPZ-IBGZPJMESA-N	436.380	1.748	50	20	IDGD	
Cc1c(F)ccc(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)c1N	1834776191	ORUUDPVCPFXQFP-SFHVURJKSA-N	440.947	1.501	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)c3ccccc3)C2)C1	1834818741	DDOHTJULLAEKAU-HKUYNNGSSA-N	443.313	1.939	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCC(N2CCC(NC(=O)Cc3cnc[nH]3)CC2)CC1	1835063915	YWDZQMKDDFSRHE-LJQANCHMSA-N	430.380	1.760	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3oc(C)nc3C)CC2)CC1	1835941785	AQWIBOILLGJNTA-KRWDZBQOSA-N	426.945	1.730	50	20	IDGD	
CC(C)c1cc(C(=O)NC2CCN(C3CCN(C(=O)[C@H](O)CCl)CC3)CC2)n[nH]1	1836157835	JDZLULCTZOGABL-GOSISDBHSA-N	425.961	1.318	50	20	IDGD	
COc1ccc(C(=O)N2CCC(OC3CCN(C(=O)[C@H](O)CCl)CC3)CC2)s1	1836715126	JWAOVLCFVWVTSW-OAHLLOKOSA-N	430.954	1.969	50	20	IDGD	
O=C(c1n[nH]c2ccccc12)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836717300	SREDWZTUFJKZQY-SFHVURJKSA-N	434.924	1.775	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc4sccc4[nH]3)CCO2)C1	1837132579	FSINEEMHEMRNDO-DJJJIMSYSA-N	441.937	1.553	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4n[nH]cc4c3)C2)C1	1837711334	DSCYEMIRLXOTLI-OAQYLSRUSA-N	446.580	1.484	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(N(C)C)nc3)CCO2)C1	1838192484	LENKLJSWIFRNKC-LAUBAEHRSA-N	438.956	1.625	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3n[nH]cc3[N+](=O)[O-])CC2)CC1	1838442940	HWFNWZUVQZCWIT-AWEZNQCLSA-N	427.889	1.948	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3ccc(C#N)cc3)C2)C1	1839141773	SCGNGPALXISKGJ-UGKGYDQZSA-N	433.936	1.965	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(C)nn3C(F)F)C2)C1	1839146064	JIDPSWWHHWFYHZ-SCLBCKFNSA-N	434.871	1.674	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccn4nccc34)CCO2)C1	1839538187	XNBOCDXPEXRCNP-UTKZUKDTSA-N	434.924	1.812	50	20	IDGD	
COc1cccc2[nH]cc(C(=O)N3CCO[C@@]4(COCCN(C(=O)[C@@H](F)Cl)C4)C3)c12	1839557864	ZFPRXLYGKIYCNF-XLIONFOSSA-N	439.871	1.781	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3scnc3C)C2)C1	1839963698	SKEHIQQCESPDGN-SUMWQHHRSA-N	446.367	1.695	50	20	IDGD	
CCc1cnc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)s1	1840033490	HHNBAQSALRZORB-YVEFUNNKSA-N	446.367	1.559	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCCn3cccc3)C2)C1	1840036115	FQAAUQGRZXYKQW-QFBILLFUSA-N	442.354	1.508	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(F)ccc3C)C2)C1	1840149348	MHSTXZRLCWVNBO-PXNSSMCTSA-N	428.888	1.458	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3ccc(C)cn3)C2)C1	1840150386	KIWMGCYRXJAHPZ-WIYYLYMNSA-N	439.940	1.033	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccnc3SC)C2)C1	1840153950	GKWISSSOUTUDHH-DNVCBOLYSA-N	443.953	1.127	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4ccoc4cn3)C2)C1	1840154716	DPEHCCADKRKMAZ-MGPUTAFESA-N	437.880	1.152	50	20	IDGD	
O=C(C(Cl)Cl)N1CCO[C@@]2(COCCN(C(=O)[C@@]3(F)CCCC=C3F)C2)C1	1840190451	YHGWCKKGXMQSCT-DLBZAZTESA-N	427.275	1.992	50	20	IDGD	
O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1C[C@]1(F)Cl)CCO2	1840244140	WBEZYFZXBCXLPV-TUKIKUTGSA-N	427.698	1.152	50	20	IDGD	
O=C(c1cccc2c1CCCC2)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1	1840719603	CUDRQTHCXQJNAG-DENIHFKCSA-N	436.936	1.235	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H]2C[C@@]2(C(=O)N2CC3(CCCN3C(=O)[C@@H](O)CCl)C2)C1	1841353537	CWLHAXDAJMLPOQ-LAPQFRIASA-N	427.929	1.047	50	20	IDGD	
COc1ccc([C@H]2C[C@@H]2C(=O)N2CCCC23CN(C(=O)CCC(=O)NN(C)C)C3)cc1	1841576234	OUQLPFKCFWVTNZ-MOPGFXCFSA-N	428.533	1.375	50	20	IDGD	
CCC(=O)N[C@H](C)C(=O)N1CC2(CCCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C1	1841924114	WHHLSRHGFQRTGM-KGLIPLIRSA-N	444.960	1.237	50	20	IDGD	
O=C(Cc1c(F)cccc1Cl)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843012786	MJMDIRKLALCLEU-UHFFFAOYSA-N	430.672	1.219	50	20	IDGD	
COc1ccc2oc(C(=O)N3CCCC34CN(C(=O)c3ccc(B(O)O)cc3)C4)cc2c1	1844018485	OYJORBKDFYDHNJ-UHFFFAOYSA-N	434.257	1.252	50	20	IDGD	
CCSc1cccnc1C(=O)N1CC2(CCCN2C(=O)c2cnccc2C(=O)NN)C1	1844264724	AIEZWHYQQYCSNV-UHFFFAOYSA-N	440.529	1.323	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)c1csc(-c3cccnc3)n1)C2	1846384865	SPOBDDLNDUJQLU-UHFFFAOYSA-N	442.545	1.395	50	20	IDGD	
COc1ccc(Cl)c(C(=O)N2CCCC23CN(C(=O)c2ccc(B(O)O)cc2)C3)c1	1846776137	VEPVPNFURCZZKP-UHFFFAOYSA-N	428.681	1.159	50	20	IDGD	
CC(C)(C)OC(=O)N1CCCC[C@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](O)CCl)C1	1847568195	FJLWTEYMGITKIT-LUKYLMHMSA-N	443.972	1.825	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CCn1cncn1	1848098576	JPBXPOGOELPQJB-KKUMJFAQSA-N	440.932	1.002	50	20	IDGD	
COC(=O)c1ccccc1S(=O)(=O)N1CCC(C(=O)NNc2nc(C)cc(C)n2)CC1	22233707	IZJBEAYQVZVMJQ-UHFFFAOYSA-N	447.517	1.424	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN(C)Cc2ccccc2N2CCOCC2)cc1OC	29113831	AAGYUBWWSCIUOH-UHFFFAOYSA-N	442.516	1.433	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)COc2ccc(C(F)(F)F)cc2)c1	46897657	DFMBDDNVENZKFV-UHFFFAOYSA-N	445.419	1.796	50	20	IDGD	
CSc1nc(C)c(CCC(=O)OCC(=O)NNC(=O)Cc2nc(C)cs2)c(C)n1	57548231	XZZPXSCJMBOORO-UHFFFAOYSA-N	437.547	1.446	50	20	IDGD	
CCOC(=O)c1ccc(C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)nc1C	106251873	CJULFESACOUWEQ-UHFFFAOYSA-N	437.456	1.932	50	20	IDGD	
CS(=O)(=O)CCNC(=O)NNC(=O)c1ccc(COc2ccc(Cl)cc2)cc1	727943001	SZHKXEMDZVAHRN-UHFFFAOYSA-N	425.894	1.908	50	20	IDGD	
NC(=O)c1ccc(/C=C/C(=O)N2CCC[C@H]2C(=O)NNc2nc(-c3ccccc3)no2)cc1	728079375	GWHUTBPPGIAVFI-HGZMWJMZSA-N	446.467	1.983	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)CCc3cc(F)ccc3F)cc2)CC1	728216050	OQEHFJULEYNTAV-UHFFFAOYSA-N	438.500	1.977	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)C3=NO[C@H](c4ccccc4)C3)cc2)CC1	728216248	VWCMJYYYKSHBBO-FQEVSTJZSA-N	443.529	1.583	50	20	IDGD	
O=C(COC(=O)c1cc2ccc(Cl)cc2[nH]1)NNC(=O)[C@@H]1COc2ccccc2O1	728322482	IBIURHUXHWKYHS-KRWDZBQOSA-N	429.816	1.966	50	20	IDGD	
CS(=O)(=O)NCCc1ccc(C(=O)NNC(=O)c2cccc(OC(F)F)c2)cc1	728486885	PDEGPMLSQVDWHB-UHFFFAOYSA-N	427.429	1.455	50	20	IDGD	
CCOC(=O)c1c(S(=O)(=O)NNC(=O)c2cc(F)ccc2Br)n[nH]c1C	728509513	HBMZIKQQDBUQHX-UHFFFAOYSA-N	449.258	1.420	50	20	IDGD	
CC[C@]1(C)NC(=O)N(CC(=O)NNC(=O)c2ccc(Br)cc2Cl)C1=O	728832476	NJVYYNJVKMPSBA-HNNXBMFYSA-N	431.674	1.584	50	20	IDGD	
O=C(NNC(=O)[C@H]1CC(=O)N(c2ccccc2F)C1)C1CCN(c2ncccn2)CC1	728844687	AXTKRXQGTIPURA-HNNXBMFYSA-N	426.452	1.033	50	20	IDGD	
CC1CCN([C@H](CNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)C(C)C)CC1	728949895	VWTLMNYYGAVFPZ-LJQANCHMSA-N	431.585	1.780	50	20	IDGD	
NS(=O)(=O)Cc1ccc(C(=O)NNC(=O)c2ccc(Br)cc2Cl)cc1	728977520	RZQCFPIJQPYODR-UHFFFAOYSA-N	446.710	1.966	50	20	IDGD	
CSCC[C@H](NC(=O)c1ccc([N+](=O)[O-])o1)C(=O)NNC(=O)c1scnc1C	729455147	RMWXOHARUJTINB-VIFPVBQESA-N	427.464	1.265	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)Cc2c(C)nc3[nH]n(C)c(=O)c3c2C)cc1OC	730103627	FPDRDHFUPRZSGA-UHFFFAOYSA-N	441.488	1.680	50	20	IDGD	
CN(C)CCNC(=O)c1cccc(CNC(=O)NNC(=O)c2cccc3ncccc23)c1	730127363	QDYIDEMONVOCNH-UHFFFAOYSA-N	434.500	1.670	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2ccccc2OC)s1	731498496	VFALVZUKLABJMF-UHFFFAOYSA-N	440.547	1.931	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)C3CCC3)CC2)cc1	732141433	JHXNRIVMQKYUKB-UHFFFAOYSA-N	437.518	1.212	50	20	IDGD	
CN(c1ccc(CNC(=O)NNC(=O)c2ccc3ccccc3n2)cc1)S(C)(=O)=O	732256978	WUFNYOIIRSUSJN-UHFFFAOYSA-N	427.486	1.775	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)CCNC(=O)C23CC4CC(CC(C4)C2)C3)C[C@H](C)O1	732260584	GMISTMYQAODORN-RCRSHMOFSA-N	434.581	1.356	50	20	IDGD	
COC(=O)c1cc(OC(=O)C2=NN(c3ccc(F)cc3)[C@@H](C(N)=O)C2)ccc1[N+](=O)[O-]	732652778	PTZCPWSAZNBQDN-MRXNPFEDSA-N	430.348	1.546	50	20	IDGD	
CCc1cc(N2CCC[C@H](NC(=O)NNC(=O)[C@@H](C)Oc3ccccc3F)C2)ncn1	732914591	UIXMOBPXKORZFD-ZBFHGGJFSA-N	430.484	1.945	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCCCC2)cc1S(=O)(=O)NNC(=O)C1CCCC1	733249827	UNNLKBSLFBEPPT-UHFFFAOYSA-N	429.564	1.669	50	20	IDGD	
N#Cc1ccc(N2CCC(NC(=O)NNC(=O)c3cnn(-c4ccccc4)c3)CC2)nc1	733346642	URNXFCHHTBUZSV-UHFFFAOYSA-N	430.472	1.752	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(N2C[C@H](C(=O)NNc3cnccn3)CC2=O)cc1	734242757	YZVIJHVETGMVHN-CQSZACIVSA-N	432.506	1.003	50	20	IDGD	
Cn1nc(C(=O)NNc2ccccc2S(=O)(=O)NC(C)(C)C)c2ccccc2c1=O	734251799	NMAZWGGCXMWCLA-UHFFFAOYSA-N	429.502	1.767	50	20	IDGD	
NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NNC(=O)COCc3ccccc3)cc2)C1	738497178	NAISFNKVYDPJQT-LJQANCHMSA-N	439.516	1.436	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)c2ccnc(N3CCCCC3)n2)CC1	739734849	YMQLWCSTDISJRE-UHFFFAOYSA-N	447.540	1.810	50	20	IDGD	
COc1ccc(-c2n[nH]c(CNC(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)n2)cc1	741415437	CABFGWKXYSSZGD-UHFFFAOYSA-N	444.473	1.028	50	20	IDGD	
C#CCOc1ccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc1	741661115	SQMLVWUDIWCRAR-UHFFFAOYSA-N	427.482	1.558	50	20	IDGD	
COc1ccc(Cl)c(NC(=O)NNC(=S)NCc2ccc(S(N)(=O)=O)cc2)c1	741864793	PIZFHDOHOPIDKR-UHFFFAOYSA-N	443.938	1.697	50	20	IDGD	
COC(=O)COc1ccc(S(=O)(=O)NNC(=O)c2cccc(Br)c2)cc1	743263349	CVIQTYOPQDGORV-UHFFFAOYSA-N	443.275	1.624	50	20	IDGD	
Cc1ccc([C@@H](CNC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)N(C)C)cc1	743334232	RKVXABPJQJFLLH-QGZVFWFLSA-N	446.577	1.843	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)CNC(=O)c1cccs1)c1nc(-c2cccc(F)c2)no1	743577608	DQGOQIUBMOFZBP-SNVBAGLBSA-N	432.437	1.759	50	20	IDGD	
Cc1ccc(/C=C(/C#N)C(=O)O[C@H](C)C(=O)NCCc2ccc(S(N)(=O)=O)cc2)cc1	744502060	MQCYUBVEVOMBIQ-YZYPPFLQSA-N	441.509	1.840	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)COc2ccc(N3CCCC3=O)cc2)c1	744520393	NPJURIVDZKCWOT-UHFFFAOYSA-N	425.441	1.505	50	20	IDGD	
Cc1cc(N2CCCS2(=O)=O)ccc1C(=O)OCC(=O)NNC(=O)c1ccccc1	745213042	LJXBDYXGBIZOSQ-UHFFFAOYSA-N	431.470	1.153	50	20	IDGD	
CCOC(=O)C1CCC(NC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)CC1	745781730	QINLHXIMTLSMFE-UHFFFAOYSA-N	426.495	1.548	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(N2CCC(C)CC2)c(C(=O)NNC(=O)N(C)C)c1	746003812	SXFTVGLBNKYWDU-UHFFFAOYSA-N	439.582	1.869	50	20	IDGD	
COc1cc(C)nc(NNC(=O)c2ccc(S(=O)(=O)N3C[C@H](C)O[C@H](C)C3)cc2)n1	746630605	KLOPNUMOYZPFAL-OKILXGFUSA-N	435.506	1.348	50	20	IDGD	
COc1ccc(/C=C(\C#N)C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1	747874195	UTSABPIKSCFFBQ-JVVYVMHDSA-N	437.408	1.133	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)Nc2nccs2)cc1)c1ccc(-n2cnnn2)cc1	747943423	WMSLRPMPIPGPEB-UHFFFAOYSA-N	442.486	1.677	50	20	IDGD	
COC(=O)N(C)CCCC(=O)NNc1ccc(S(=O)(=O)Nc2nccs2)cc1	747943657	LCJQKTWJWCDXED-UHFFFAOYSA-N	427.508	1.865	50	20	IDGD	
Cc1c(C(=O)NNc2ccc(OCC(F)(F)F)cc2)cnc2c1c(=O)n(C)c(=O)n2C	748704246	FCXKDGGDOJDVPL-UHFFFAOYSA-N	437.378	1.639	50	20	IDGD	
O=C(NNS(=O)(=O)c1cncc(F)c1)c1cccc(S(=O)(=O)N2CCCCC2)c1	749150843	FWVZIBDRCLWYDM-UHFFFAOYSA-N	442.494	1.019	50	20	IDGD	
CC[C@@H](C(=O)N1CCC(NC(=O)NN[C@]2(C)CCS(=O)(=O)C2)CC1)c1ccccc1	749191545	SULPIUXUVIGUQJ-WIYYLYMNSA-N	436.578	1.552	50	20	IDGD	
O=C(NCCNc1ccc2ccccc2n1)NNC(=O)c1csc(N2CCOCC2)n1	749356292	FQWHBXAOGKQWPX-UHFFFAOYSA-N	441.517	1.584	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)NC[C@@H]3CCC[C@@]34NC(=O)N(C)C4=O)n[nH]2)cc1	753021970	KYERSBJZTOQPKF-LHSJRXKWSA-N	439.476	1.050	50	20	IDGD	
C#CCOCCNC(=O)/C(C#N)=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	753230682	JDVWOIXUDBDTTP-VBKFSLOCSA-N	425.876	1.752	50	20	IDGD	
C[C@H]1CC(=NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)CN1C1CC1	753955093	KJUNYGTXRAEEJQ-INIZCTEOSA-N	434.562	1.369	50	20	IDGD	
C[C@@H](C(=O)N1CCCC1)N1CCN(C(=O)NNC(=O)Cn2ccc3ccccc32)CC1	755154344	UMPVKMPEATUGQQ-KRWDZBQOSA-N	426.521	1.011	50	20	IDGD	
Cc1noc(C)c1S(=O)(=O)N1CCC(C(=O)NNc2ccc(C(F)(F)F)nn2)CC1	755197507	OJOKKTKGONXWOC-UHFFFAOYSA-N	448.427	1.644	50	20	IDGD	
O=C(Cc1ccc(NS(=O)(=O)c2ccc(F)cc2)cc1)NNC(=O)Cc1cc[nH]n1	755264147	UUIMHXYKIUQTQK-UHFFFAOYSA-N	431.449	1.282	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)Nc1cccc2c1OCCO2	756149711	JDTDRYWOBFHXFI-UHFFFAOYSA-N	425.489	1.823	50	20	IDGD	
CNC(=O)COc1ccc(NC(=O)NNC(=O)[C@H](C)Oc2ccc(C(C)=O)cc2)cc1	756441114	IJJGRAXMYZBLKX-AWEZNQCLSA-N	428.445	1.634	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)Nc1cc(F)cc(S(N)(=O)=O)c1	756516806	SALYQVFSEASZDX-UHFFFAOYSA-N	426.426	1.104	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)Nc2cc(S(N)(=O)=O)cc(C)c2C)cc1	756635720	SYWRJYHACRHZIL-AWEZNQCLSA-N	448.501	1.774	50	20	IDGD	
C[C@H]1CN(C(=O)Cn2cc(NC(=O)NNC(=O)CCc3ccccc3O)cn2)C[C@@H](C)O1	756839410	RRCMKCKFQLKMLT-GASCZTMLSA-N	444.492	1.010	50	20	IDGD	
C[C@H]1CN(C(=O)Cn2cc(NC(=O)NNC(=O)C(C)(C)c3ccccc3)cn2)C[C@H](C)O1	756840549	WQGRDMNKPYDVFC-HOTGVXAUSA-N	442.520	1.649	50	20	IDGD	
CC(C)(Oc1ccc(C#N)cc1)C(=O)N1CCN(S(=O)(=O)CBr)CC1	758514071	YIEPOSGFPYSIKG-UHFFFAOYSA-N	430.324	1.542	50	20	IDGD	
CCCCn1ncc(C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)c1CC	760052741	DSDUPTOONGJWMP-UHFFFAOYSA-N	435.550	1.636	50	20	IDGD	
CCO[C@@H]1C[C@H](NC(=O)NNc2ccc(S(=O)(=O)N(CC)CC)cn2)[C@@]12CCCO2	760140425	CICFFFBHWBJVDS-FCEWJHQRSA-N	441.554	1.465	50	20	IDGD	
COc1ccc(C(=O)C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)cc1Cl	760797206	GEENUYOCUAMHOH-UHFFFAOYSA-N	438.893	1.594	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)C(C)(C)C)cc1S(=O)(=O)N1CCCCC1	761071231	AIHPHJPBFWKYTG-UHFFFAOYSA-N	440.522	1.002	50	20	IDGD	
Cn1cc(-n2cc(C(=O)NNc3nc(Br)cn4ccnc34)ccc2=O)cn1	761094850	DWYUECRVKVMJAU-UHFFFAOYSA-N	429.238	1.133	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)c1ccc([C@]2(C)NC(=O)NC2=O)cc1	762350619	PPWMWOQJJDAKOU-FQEVSTJZSA-N	428.470	1.303	50	20	IDGD	
O=C(CC12CC3CC(CC(C3)C1)C2)NCC(=O)NNc1nccc(N2CCOCC2)n1	762868414	OPBWQJOKYGBCGJ-UHFFFAOYSA-N	428.537	1.479	50	20	IDGD	
C[C@H](NS(=O)(=O)c1ccc(C(N)=O)cc1)C(=O)NNC(=O)c1ccc(C(C)(C)C)cc1	763015235	XHPLGWQRRUMARC-ZDUSSCGKSA-N	446.529	1.211	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)[C@H](C)Sc3nnnn3C3CC3)n[nH]2)c1	763173731	CEDDSFPKCZPSCE-LBPRGKRZSA-N	426.506	1.957	50	20	IDGD	
CC(C)(C)OC(=O)N1CCc2c(NC(=O)C(=O)NNC(=O)c3cccnc3)cccc21	763487619	GENGECKEAIOAOS-UHFFFAOYSA-N	425.445	1.779	50	20	IDGD	
CCCNC(=O)[C@H]1CN(C(=O)C(=O)NNC(=O)c2c[nH]c3ccccc23)c2ccccc2O1	763539875	BFGKVLGWMGOYFS-LJQANCHMSA-N	449.467	1.249	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(OC)c(OC)c2)cc1F	763550652	PABFFWCXNWNDJH-UHFFFAOYSA-N	435.408	1.268	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)COc2cccc(C(F)(F)F)c2)cc1OC	763640312	XGSCFTISAIYIAL-UHFFFAOYSA-N	441.362	1.888	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2-c2ccccc2)cn(C)c1=O	763644698	WHCREKIJKOZNHN-UHFFFAOYSA-N	434.452	1.526	50	20	IDGD	
CCOC(=O)c1cc(C)sc1NC(=O)C(=O)NNC(=O)COc1ccc(OC)cc1	763659857	SRRUFPPQVIFMQE-UHFFFAOYSA-N	435.458	1.407	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)cc1C	763666112	BAESGQQINPLZSO-UHFFFAOYSA-N	438.484	1.704	50	20	IDGD	
COC(=O)c1cc2cc(NC(=O)C(=O)NNC(=O)COc3ccccc3F)ccc2o1	763678336	DAMLWEKRJDFXIV-UHFFFAOYSA-N	429.360	1.523	50	20	IDGD	
CCN(CC)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)cc1	763686856	WCXGFXGJBZLKME-UHFFFAOYSA-N	446.891	1.987	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)cc1[N+](=O)[O-]	763737137	YCXWBUBMXMVZDQ-UHFFFAOYSA-N	427.417	1.142	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])c2cccnc2c1C	763802959	DDXVCWHLTLTFAD-UHFFFAOYSA-N	437.412	1.925	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)C(=O)Nc1ccnn1C1CCCCC1	763805641	UGQVZABQDNNLJF-UHFFFAOYSA-N	430.421	1.461	50	20	IDGD	
CCn1cnnc1-c1cccc(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)c1	763808525	XUDYCIBPBZVMFH-UHFFFAOYSA-N	433.428	1.002	50	20	IDGD	
CC(C)CNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)cc1	763838973	WXKOIAWMNDUGFM-UHFFFAOYSA-N	430.436	1.376	50	20	IDGD	
COC(=O)c1cc(F)c(F)cc1NC(=O)C(=O)NNC(=O)COc1ccc(F)cc1	763839242	HDDCVBMBIKGDLE-UHFFFAOYSA-N	425.319	1.055	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccsc2C(=O)OC)cc1	763862165	VHBFCVOSHVAHIA-LLVKDONJSA-N	435.458	1.487	50	20	IDGD	
COc1cc(C(=O)N(C)C)ccc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccccc1F	763863848	DIXVFRNOBFKAME-GFCCVEGCSA-N	446.435	1.090	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1cccc(N2CCCCC2=O)c1	763864595	DGSZOYAPUXXNRV-AWEZNQCLSA-N	442.447	1.896	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)C(=O)Nc2cccnc2N2CCOCC2)cc1	763898632	ZESAYNXXXDDWIC-UHFFFAOYSA-N	429.502	1.105	50	20	IDGD	
Cc1ccc(C(=O)N2C[C@@H](C)C[C@H](C)C2)cc1NC(=O)C(=O)NNC(=O)c1ccc[nH]1	763978776	FCUGDQMBSWEPIC-KBPBESRZSA-N	425.489	1.841	50	20	IDGD	
CN(C(=O)c1ccccc1NC(=O)C(=O)NNC(=O)c1cccn1C)C1CCCCC1	763999399	ROWDVBZTKWOWDL-UHFFFAOYSA-N	425.489	1.830	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)ccc1O)C(=O)Nc1ccn(-c2ccccc2)n1	764280386	NZHMKNCIMOHIDE-UHFFFAOYSA-N	444.245	1.740	50	20	IDGD	
CCOC(=O)COc1cccc(NC(=O)C(=O)NNC(=O)C(C)(C)c2ccccc2)c1	764313574	LXCHVDLMZFAFTJ-UHFFFAOYSA-N	427.457	1.692	50	20	IDGD	
Cc1noc(COc2ccc(NC(=O)C(=O)NNC(=O)Cc3ccccc3F)cc2)n1	764319225	MUIRQOXMIYPYMZ-UHFFFAOYSA-N	427.392	1.425	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)C(=O)Nc1cc(Cl)ccc1C(=O)N1CCCCC1	764354773	WTQSQFASISFEGY-UHFFFAOYSA-N	443.891	1.690	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ccccc2)cc(Br)c1F	764661484	COOWRIRKXWBHFK-UHFFFAOYSA-N	438.209	1.775	50	20	IDGD	
C=CCNS(=O)(=O)c1cc(C(=O)NNC(=O)CSc2ccccc2O)ccc1F	765248686	HWVIHQOBGDSSNI-UHFFFAOYSA-N	439.490	1.549	50	20	IDGD	
COc1ccc(N(C)S(=O)(=O)c2cccc(C(=O)NNC(=O)c3cc(C)[nH]n3)c2)cc1	765586533	ZEDLFSYVFMCMPZ-UHFFFAOYSA-N	443.485	1.627	50	20	IDGD	
CC(C)NC(=O)CCCC(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	766660649	QSDAIWFKNSOQHN-UHFFFAOYSA-N	437.972	1.300	50	20	IDGD	
Cc1nnc2ccc(C(=O)NNC(=O)CN3CCN(Cc4ccc(Cl)cc4)CC3)cn12	766663655	LGOQIBMITCCSMU-UHFFFAOYSA-N	441.923	1.270	50	20	IDGD	
COC(=O)c1cc(C=NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)oc1C	767027579	FARRLGBGZCSZOC-UHFFFAOYSA-N	435.458	1.159	50	20	IDGD	
CCOC1CC(CNC(=O)NNC(=O)c2ccc(Cl)cc2F)(N2CCOCC2)C1	767897219	YQYWIINBRUWEST-UHFFFAOYSA-N	428.892	1.693	50	20	IDGD	
Cc1nc(NC2CC2)sc1C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	770078504	MJSDUTOIAGNELS-AWEZNQCLSA-N	432.458	1.170	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)NCCCCN3CCN(c4ccccc4)CC3)nc21	770353302	YDCABDPNQDJESP-UHFFFAOYSA-N	439.524	1.297	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)NCCN1C(=O)[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O	770545099	KRXRIEVYEWUQDY-UCQBOQSVSA-N	446.891	1.245	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)[C@@H](c3ccccc3F)N3CCOCC3)nc21	770957609	CBJXZDQSLLUBOO-MRXNPFEDSA-N	443.483	1.943	50	20	IDGD	
C[C@H](C(=O)NNc1nc(O)c2cnn(C(C)(C)C)c2n1)c1ccc(S(C)(=O)=O)cc1	770958987	UZSSWIVNGDOLFO-NSHDSACASA-N	432.506	1.937	50	20	IDGD	
O=C(Cc1ccccc1I)NNC(=O)[C@H]1COc2ccccc2O1	771219833	JXYXYDYVOXEKPY-OAHLLOKOSA-N	438.221	1.821	50	20	IDGD	
Cc1cccc(S(=O)(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c1Br	771904212	SPTUXLRBXTUSAR-UHFFFAOYSA-N	447.332	1.784	50	20	IDGD	
C[C@H]1CN(C(=O)NNC(=O)CNC(=O)c2cccs2)[C@H](C)CN1C(=O)OC(C)(C)C	771955724	BUWZPKVFEXEFEJ-OLZOCXBDSA-N	439.538	1.548	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)cc1C(N)=O	773264956	OYZUFPILFCYETQ-JTQLQIEISA-N	427.866	1.225	50	20	IDGD	
CC[C@@H](C)NS(=O)(=O)Cc1cccc(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2)c1	773643899	SISZJOWBFVONJP-CYBMUJFWSA-N	449.489	1.895	50	20	IDGD	
CCOCCCn1c(NNC(=O)c2cncc(C(=O)OC)c2)nc2ccccc2c1=O	774295039	IWJBUKXXLOBPAQ-UHFFFAOYSA-N	425.445	1.762	50	20	IDGD	
COC(=O)c1cncc(C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)c1	774335091	UGZTZNXENUATNZ-UHFFFAOYSA-N	445.907	1.100	50	20	IDGD	
CN(NC(=O)[C@H]1CCCN1C(=O)C(C)(C)C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776213052	MVKGHAFIZBVLEO-OAHLLOKOSA-N	439.557	1.659	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCN(C(=O)OC(C)(C)C)[C@H](C)[C@H]2C)n1	776607339	STQNDQZIQRFQJV-ZIAGYGMSSA-N	425.555	1.471	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)[C@@H]2CC(=O)N(c3ccc(OC)cc3OC)C2)nc1C	778420861	AVSUIACDHZKWGL-CYBMUJFWSA-N	443.460	1.475	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(C(=O)NNC(=O)c2ccc(COc3ccccc3)o2)n(C)c1	778538436	PLBDSQGGXSLQMM-UHFFFAOYSA-N	446.485	1.522	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])c2ccccc2c1=O	779381884	SCFCTLDSZNZXIP-UHFFFAOYSA-N	444.835	1.682	50	20	IDGD	
COc1cccc(-n2nc(C)c([C@H]3COCCN3CC(=O)NNC(=O)C3CC3)c2C)c1	779612344	CZGOITYSSVZXHI-LJQANCHMSA-N	427.505	1.428	50	20	IDGD	
O=C(NNC(=O)N1CCC(CCCN2CCOCC2)CC1)c1cc(Br)c[nH]1	779968449	SXVBQHRNZWALKI-UHFFFAOYSA-N	442.358	1.956	50	20	IDGD	
C[C@@H]1CC[C@@H](NC(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)C1	780788128	UGMJRXDWHIPXHQ-NVXWUHKLSA-N	438.550	1.159	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2cn(-c3cccc(Cl)c3)nn2)n1	781391101	RAEIBYXLRWZTEQ-UHFFFAOYSA-N	434.865	1.233	50	20	IDGD	
Cc1occc1C(=O)Nc1nc(CC(=O)OCC(=O)NNC(=O)c2cccs2)cs1	782362275	QRQZHNNELLJSDN-UHFFFAOYSA-N	448.482	1.905	50	20	IDGD	
Cn1c(=NNC(=O)C(=O)Nc2cnn(CC(=O)NC3CCCC3)c2)sc2ccccc21	783349757	PQLFAYQCSWJNHO-UHFFFAOYSA-N	441.517	1.066	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)C(=O)Nc1cccc(-n2ccnc2)c1	784214079	UMVHAOJTOFJNRW-UHFFFAOYSA-N	440.485	1.395	50	20	IDGD	
COC(=O)c1ccc(C)c(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)c1	784216195	OJSUNFUDCNCPFV-UHFFFAOYSA-N	446.485	1.304	50	20	IDGD	
O=C(NNC(=O)c1cccc(OC(F)F)c1)N[C@@H]1CCCN(Cc2ccccn2)C1=O	784282979	QDZOPRMEUIAZCD-MRXNPFEDSA-N	433.415	1.818	50	20	IDGD	
O=C(NNc1ccnc(Br)c1)C(=O)Nc1cc(C2CC2)nn1-c1ncccn1	784828543	JTVGAYVSFINHMC-UHFFFAOYSA-N	443.265	1.779	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)C(=O)Nc2ccccc2C(=O)N2CCCCC2)c1	784844841	QORPYSPRWGHKAP-UHFFFAOYSA-N	444.513	1.798	50	20	IDGD	
CN(C)c1nccc(NNC(=O)C(=O)Nc2cccc(C(=O)OCc3ccccc3)c2)n1	784970468	HRONWBCQTKTALC-UHFFFAOYSA-N	434.456	1.981	50	20	IDGD	
CN(C)c1nccc(NNC(=O)C(=O)Nc2ccc(I)cc2)n1	784971461	ZLPMDJUWUDRYCL-UHFFFAOYSA-N	426.218	1.229	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)C(=O)Nc1ccc2nc(C(F)F)[nH]c2c1	785068217	WCTLUESNTDZIKQ-UHFFFAOYSA-N	427.371	1.477	50	20	IDGD	
CCN(Cc1cccc(NC(=O)C(=O)NNc2nccn(C)c2=O)c1)C(=O)OC(C)(C)C	785086940	VFILSMMCMPKWEB-UHFFFAOYSA-N	444.492	1.619	50	20	IDGD	
CN(c1ccccc1NC(=O)C(=O)NNc1nc(C(F)(F)F)cs1)S(C)(=O)=O	785147653	NQFMIBHCADVOBM-UHFFFAOYSA-N	437.425	1.640	50	20	IDGD	
O=C(Cc1ccc(Cl)cn1)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	786390131	HFGISXKODSRBDI-UHFFFAOYSA-N	436.343	1.896	50	20	IDGD	
CC[C@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(N2CCN(C)CC2)c(Br)c1	787890134	VOVLWEGVRONESI-LBPRGKRZSA-N	440.342	1.333	50	20	IDGD	
CCNC(=O)Nc1cccc(NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1C	788737833	HFFYBVLNNJVGPY-UHFFFAOYSA-N	440.508	1.996	50	20	IDGD	
Cc1cc(C)nc(-n2nccc2NC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])n1	789313203	YQORUWLCQZSYLJ-UHFFFAOYSA-N	426.393	1.419	50	20	IDGD	
CC[C@@H](C)CC(=O)NNC(=O)Cn1c(=O)c2c(ncn2CC)n(Cc2ccccc2)c1=O	790255693	SJSATSQWQZWJDY-OAHLLOKOSA-N	440.504	1.012	50	20	IDGD	
COc1cc(C=O)c([N+](=O)[O-])cc1OCC(=O)NNC(=O)[C@H]1OCC[C@H]1c1ccccc1	790319613	RMXWEOCZSDBHLR-YWZLYKJASA-N	443.412	1.515	50	20	IDGD	
CNC(=O)c1cc2cc(NC(=O)C(=O)NNC(=O)c3ccc4ccccc4n3)ccc2[nH]1	792350648	MTOPKCWJBULTLJ-UHFFFAOYSA-N	430.424	1.475	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)NCc2cccc(NC(=O)CCN3CCOCC3)c2)n1	792818315	DQJAKOPIJRJQDA-UHFFFAOYSA-N	440.504	1.195	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cccc(C)n2)cc(N2CCN(C(C)C)CC2)c1	797370402	LGLZTLVTYUKNPM-UHFFFAOYSA-N	438.532	1.629	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@H]2C(=O)NNC(=O)CCNC(=O)OC(C)(C)C)cc1	799102463	DCRCZZGWWUPBEF-INIZCTEOSA-N	434.493	1.362	50	20	IDGD	
Cc1cccc(-n2cc(O)c(C(=O)OCC(=O)NNC(=O)c3ccc(C#N)cc3)n2)c1C	801417672	DBLDZRBBOOFXHZ-UHFFFAOYSA-N	433.424	1.684	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)NC[C@H]2CC(c3ccc4c(c3)CCO4)=NO2)cc1	802337258	KTMVBFWDNYYTFX-GOSISDBHSA-N	435.440	1.396	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)NC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1	802338165	UKTDBJCPJJFPHD-KRWDZBQOSA-N	428.420	1.663	50	20	IDGD	
CCc1nnc(NC(=O)[C@H](C)[C@H](C)NC(=O)NNC(=O)c2ccc3c(c2)OCCO3)s1	805878758	SBLZAMKSABBTKP-MNOVXSKESA-N	448.505	1.479	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)Nc1ccc(CC(=O)N2CCSCC2)cc1	806245322	WHHVTUIGOIINHH-UHFFFAOYSA-N	438.517	1.929	50	20	IDGD	
CN(C)S(=O)(=O)C[C@@H](NC(=O)NNC(=O)Cc1cccc2ccccc12)C(F)(F)F	806569029	IBDAJGGOYQLFOH-OAHLLOKOSA-N	446.451	1.535	50	20	IDGD	
O=C(NC[C@@H](c1ccco1)N1CCCC1)NNC(=O)c1csc(N2CCOCC2)n1	807003313	KSIHGYPYUADCDQ-HNNXBMFYSA-N	434.522	1.354	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)c1ccc2c(c1)C(=O)N(Cc1ccco1)C2=O	807371812	UQNMRBVMTGAZST-UHFFFAOYSA-N	429.429	1.626	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)C(=O)Nc2nc3c(s2)CCCC3(C)C)c1	810390136	RLELDNAFCJZDGR-UHFFFAOYSA-N	430.490	1.510	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)cc1)C(=O)Nc1ccc(-n2ccc(C(F)(F)F)n2)cc1	810391071	SVDLJXAVTRKOGW-UHFFFAOYSA-N	433.346	1.996	50	20	IDGD	
O=C(c1cnnc(-c2ccccc2)c1)N1CCN(S(=O)(=O)CBr)CC1	810911713	JLXUBOCOLUGKGM-UHFFFAOYSA-N	425.308	1.584	50	20	IDGD	
CCOC(=O)c1ccc(NNC(=O)CN2C(=O)COc3ccc([N+](=O)[O-])cc32)cc1C	812721977	HQHCZOICCCMHTO-UHFFFAOYSA-N	428.401	1.949	50	20	IDGD	
CCCNC(=O)c1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)cc1	813034086	XQGDDHYFVPTSJT-UHFFFAOYSA-N	447.517	1.159	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)N(C)C)cc1OC(F)F	815751664	IZVMHFCJOWSHEI-UHFFFAOYSA-N	442.444	1.929	50	20	IDGD	
CC(=O)N(C)c1cccc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)N(C)C)c1	815752027	YZFOGYZHLIDKLP-UHFFFAOYSA-N	433.490	1.001	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)[C@H]1CCCN1C(=O)OCC(F)(F)F	817052409	AAXSFVULRZTYOK-GFCCVEGCSA-N	438.428	1.543	50	20	IDGD	
CC[C@H](Nc1c([N+](=O)[O-])c(C)nn1C)C(=O)NNc1ccccc1S(=O)(=O)N(C)C	817054581	OXIMSYLHSVHPLP-LBPRGKRZSA-N	439.498	1.221	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)Nc2ccc(C(=O)NCCC(N)=O)cc2)c1C	817112776	ASZLUZCLSGZOQB-UYRXBGFRSA-N	437.500	1.902	50	20	IDGD	
CC(=O)N[C@@H](CC(=O)NNC(=O)N1CCN(C)CC1)c1ccc(Br)cc1	819721471	UMCDJRSOQHHDBG-HNNXBMFYSA-N	426.315	1.005	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)COCC(=O)NNC(=O)c2ccc(CC)cc2)cc1	828544584	MWMDPDSIMUIROM-UHFFFAOYSA-N	426.473	1.050	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@H](CSC)N2C(=O)[C@H]3CCCC[C@H]3C2=O)cc1OC	859323316	ZOHAWGKDMGGMAI-ZNMIVQPWSA-N	449.529	1.372	50	20	IDGD	
O=C(COc1ccccc1-c1ccccc1)NNC(=O)CN1C(=O)[C@@H]2[C@@H](C1=O)[C@H]1C=C[C@H]2C1	863995931	HNAWLDNCNJQAQF-DODAUVCRSA-N	445.475	1.687	50	20	IDGD	
COc1cc(C(=O)NNC(=O)COc2ccc3c(c2)CCC(=O)N3)cc(OC)c1OC	871122704	JSGZOKRFSJEUKK-UHFFFAOYSA-N	429.429	1.437	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc2c(c1)OCCCO2)NNC(=O)c1cccc(Cl)c1	913509845	YKTJZQLNQBDCLK-UHFFFAOYSA-N	439.877	1.241	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)Cc1c(C)nn(-c2nc(C)cc(C)n2)c1C	914595420	NXGHGJOSFVTKLZ-UHFFFAOYSA-N	438.488	1.673	50	20	IDGD	
COc1ccc(N2CCN(CCCNC(=O)NNC(=O)Cc3ccc(F)cc3)CC2)cc1	916198105	IQKKHVFOAKICOR-UHFFFAOYSA-N	443.523	1.920	50	20	IDGD	
CS(=O)(=O)NC1(CNC(=O)NNC(=O)Cc2ccc3ccccc3c2)CCCCC1	916252701	MUALHLJPGNZIST-UHFFFAOYSA-N	432.546	1.965	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)NCCN2CCN(c3ccccc3)CC2)c1	916514921	TTYAOTKRDWHFJN-UHFFFAOYSA-N	427.505	1.470	50	20	IDGD	
O=C(Cc1cccc2ccccc12)NNC(=O)NCCS(=O)(=O)NCc1ccccc1	916645082	AFWKPZXIDINRPE-UHFFFAOYSA-N	440.525	1.832	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)c3ccccc3n2)cc1	920297810	GXBAPOQUOOGVAE-AWEZNQCLSA-N	426.498	1.909	50	20	IDGD	
O=C(Cn1cnc2ccccc21)NNC(=O)c1cccc(NC(=O)CCn2ccnc2)c1	920416064	JLWMSZACIZRFGH-UHFFFAOYSA-N	431.456	1.723	50	20	IDGD	
CCn1cnnc1CNC(=O)/C(C#N)=C/c1cn(CCC(N)=O)nc1-c1ccc(OC)cc1	920852730	YWAXFUDGLKUMQZ-MHWRWJLKSA-N	448.487	1.269	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)Nc3cccc(N4C(=O)CNC4=O)c3)n[nH]2)cc1	920936342	NSPOYGMEQVACQC-UHFFFAOYSA-N	433.428	1.908	50	20	IDGD	
O=C(NC[C@@H](c1cccc(F)c1)N1CCOCC1)NNC(=O)[C@@H]1COc2ccccc2O1	921199318	GOVWLMHEMMSNRA-PXNSSMCTSA-N	444.463	1.369	50	20	IDGD	
CC(=O)N1c2ccccc2C[C@H]1C(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1	1116085025	VGQNHYVCICPUMI-SFHVURJKSA-N	430.505	1.759	50	20	IDGD	
COc1cc(C=NNC(=O)c2n[nH]c3c2CCCC3)ccc1OCC(=O)N1CCOCC1	1317740853	ALIWQJLSGJXVPM-UHFFFAOYSA-N	441.488	1.299	50	20	IDGD	
O=C(NNC(=O)[C@H]1CC(=O)N(c2cccc(Br)c2)C1)c1n[nH]c2c1CCCC2	1317825621	KJUXOCQOMLKJQU-NSHDSACASA-N	446.305	1.865	50	20	IDGD	
O=C(CCS(=O)(=O)c1ccc2c(c1)CCC2)NNC(=O)c1cncn1-c1ccccc1	1317906486	LHACCVGFQHVUIQ-UHFFFAOYSA-N	438.509	1.986	50	20	IDGD	
CCc1cc(OCC(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)ccc1Cl	1318295002	IQVKYQOBYQNWGO-SFHVURJKSA-N	448.859	1.812	50	20	IDGD	
Cc1nn(CCCl)c(C)c1C(=O)NC1CCN(S(=O)(=O)C2CCOCC2)CC1	1318916750	QTSZGLQHPPPGCD-UHFFFAOYSA-N	432.974	1.442	50	20	IDGD	
Cc1ccc(-n2c(NNC(=O)[C@@H](C)N3C(=O)CCC3=O)nc3ccccc3c2=O)c(C)c1	1322793771	GQUHIDNSAAFTID-OAHLLOKOSA-N	433.468	1.983	50	20	IDGD	
Cc1cc2cccc(C(=O)N3CC[C@]4(CN(C(=O)CCC(=O)NN(C)C)CCO4)C3)c2[nH]1	1777873656	CIVSSOCWMUJLNU-QHCPKHFHSA-N	441.532	1.293	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)N1CCO[C@@]2(CCN(C(=O)CO[Si](C)(C)C)C2)C1	1779301027	GVLUKAIUWLXEEP-LJQANCHMSA-N	429.590	1.193	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(N(C)C)nc3)C2)C1	1779764583	JWAOTESRDGOYOM-DNVCBOLYSA-N	439.354	1.765	50	20	IDGD	
Cn1cccc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@](C)(Cl)CCl)C2)c1=O	1780707136	QAIWPIBDBCGBMF-CDHQVMDDSA-N	444.359	1.749	50	20	IDGD	
CC(C)n1cnc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](F)Br)C2)n1	1780773863	ZBKWXDUBZGTKSD-IIYDPXPESA-N	446.321	1.677	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)CCc3ccc(O)nn3)CCO2)C1	1781233716	YRNULGCCOYFISH-QZTJIDSGSA-N	431.320	1.181	50	20	IDGD	
CCOC(=O)c1ccc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](Cl)COC)CCO3)cc1	1782041295	SLDGAQYUNVMXKB-UTKZUKDTSA-N	438.908	1.561	50	20	IDGD	
Cc1c(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)nc2ccc(Cl)cn12	1782493701	VHSYSLFLGUROEU-LIRRHRJNSA-N	441.315	1.339	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)Cc3cnc4ccccn34)CCO2)C1	1783341888	FFCMCBSOMQTFIM-JXFKEZNVSA-N	449.349	1.880	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(F)nc3F)[C@H]2C1	1783381166	NBZDPASWTMCYCS-XWUBHJNHSA-N	446.292	1.984	50	20	IDGD	
O=C(CSc1ccccc1[N+](=O)[O-])N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1783781438	HOSSINNTGWGNJI-KBXCAEBGSA-N	443.909	1.117	50	20	IDGD	
Cc1nn(C)c(C)c1CC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1784512599	KYBTZNOJWQDGFY-RDJZCZTQSA-N	431.306	1.100	50	20	IDGD	
Cc1ccn(CC(=O)Nc2ccc(C3(NC(=O)c4cnccc4C(=O)NN)CCC3)cc2)n1	1786918587	YBKLBPCWZRNXOT-UHFFFAOYSA-N	447.499	1.638	50	20	IDGD	
Cc1noc(-c2ccccc2)c1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21	1787535840	WGUHVBBFAYPUSB-XSLAGTTESA-N	447.919	1.843	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4c(c3)CNC4=O)C[C@@H]21	1788764172	CLTNVTSNXUDVTM-SNRMKQJTSA-N	445.592	1.375	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3C[C@H]3F)[C@H]2C1	1789789861	YCYRXAVQSFOAMP-CMXYNOPPSA-N	447.935	1.456	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CC[C@@H]4CCC(=O)N4C3)C[C@@H]21	1789867065	WSCLHUNIDPPLEV-PCCRXHMLSA-N	425.957	1.385	50	20	IDGD	
COc1nccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]3C2)c1F	1789922941	OMMGLQYRTVNAMS-QVSJOPQTSA-N	448.264	1.513	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3Cc4ccccc4N3)[C@H]2C1	1790682716	FNIATUHWCBCEAX-ADBDHWBDSA-N	436.350	1.786	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cc(C)n(C)n3)C[C@@H]21	1790957955	GDXYOUVVRHIKPU-LLLHUVSDSA-N	441.370	1.424	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3cc(F)ccn3)C[C@@H]21	1791057801	XNTFUBZSYNLGHP-OQUILHJVSA-N	442.329	1.916	50	20	IDGD	
C[C@@H](Br)C(=O)NC1(c2ccc(NC(=O)CN(CCO)CCO)cc2)CCC1	1791328804	OGTWLZRSGUZVRP-CQSZACIVSA-N	442.354	1.191	50	20	IDGD	
CC(C)(C)OC(=O)NCCCCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCl	1793107817	WTDWKTYSSFLXJJ-FZKCQIBNSA-N	431.961	1.919	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1ON=C(c3ccccc3)O1)C2	1793448312	ADEVEWRPTOTDDU-GSZDEIQRSA-N	435.908	1.718	50	20	IDGD	
CO[C@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Br)C2)c1ccccc1	1795376730	SQZDRYOQUIDCIG-CMZRPVNOSA-N	425.323	1.747	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Cl)C[C@H]2C[C@H]21	1796370685	KZFMWZDHUWULNS-GBIHRFPISA-N	445.919	1.508	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2c(c1)OCCO2	1796790797	RGIGTCKIOVEQMN-DPYKFYPSSA-N	439.306	1.444	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnn3ccccc13)C2	1796892619	XPFMZPOKVGXASE-CKFWPPNZSA-N	447.499	1.720	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1ccc2ncncc2c1	1797468278	LYLPNWQHICINKN-XRGAULLZSA-N	437.269	1.524	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/C(=O)c1cccs1)C2	1797955902	NZYLSBZWJLEDSA-OZAHNZTQSA-N	436.606	1.928	50	20	IDGD	
COc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Cl)C3)c(F)c(OC)c1F	1799738555	BSODSGVFONFFTE-HDZCRHJISA-N	436.814	1.720	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CNc3ccccc31)C2	1800639868	PNEQQFWWCPSVMI-RZXDWDHASA-N	436.350	1.959	50	20	IDGD	
C=C(Oc1ccccc1O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)Br	1800757592	MPAIUPDDUSYCOZ-DPYKFYPSSA-N	439.306	1.658	50	20	IDGD	
Cc1ccc(SCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCC(=O)NN(C)C)cc1	1801011540	NEFWRWQJXDMDBD-FAQVEIGNSA-N	448.589	1.050	50	20	IDGD	
CN1CCCn2nc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)CCBr)C4)cc2C1	1801183499	RYOIEFJIJULGNH-QDMKHBRRSA-N	438.370	1.755	50	20	IDGD	
COc1cccc(/C=C/C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)c1	1801847878	KVRAMDBEXGQWJJ-UKGLUTESSA-N	434.301	1.340	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc3ncnn3c2)[C@@H]1c1cccnc1)[C@H](O)CCl	1803142786	JDXLCVRAEGAYNU-YXJHDRRASA-N	428.880	1.044	50	20	IDGD	
Cc1cccnc1C(=O)N1CCCC2(CCN(C(=O)c3cnccc3C(=O)NN)CC2)C1	1806270013	NKABEOQFXNDMIL-UHFFFAOYSA-N	436.516	1.547	50	20	IDGD	
O=C(Cc1ccccc1)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1806515823	PVCZULXKXYNEFT-URXFXBBRSA-N	443.312	1.324	50	20	IDGD	
Cc1ccccc1C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1807360781	LXTGZNXWDMRYAS-OFNKIYASSA-N	443.312	1.703	50	20	IDGD	
C=CC[C@H](C(=C)C)C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1807362477	VQLKMMZNKOBGFP-MZYLBHOOSA-N	447.344	1.849	50	20	IDGD	
Cc1nnc(CC(=O)NC[C@@H]2CCN(C(=O)[C@H](C)Br)[C@H]2c2cccnc2)o1	1807474618	INLKHVAOLWVKET-YLVFBTJISA-N	436.310	1.805	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)c1cnc2[nH]ncc2c1	1809707868	RVDHLDGFODCTRR-XKQJLSEDSA-N	428.880	1.272	50	20	IDGD	
Cc1cncc(CCC(=O)N2CCC3(CCCN(C(=O)c4cccc(B(O)O)c4)C3)CC2)c1	1809975005	MUCUKUXGPDFKRJ-UHFFFAOYSA-N	449.360	1.547	50	20	IDGD	
O=C(CCc1ccsc1)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1	1809976775	ORGZCGXBQMKFMB-UHFFFAOYSA-N	440.374	1.906	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)/C=C\C(=O)NC2CC2)[C@@H]1c1cccnc1	1810137524	XCWYVOICPIKPRN-MXSDWFRLSA-N	449.349	1.706	50	20	IDGD	
Cc1ocnc1C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1	1810302621	LLYNFOGCTTXHEI-HNAYVOBHSA-N	449.471	1.010	50	20	IDGD	
CC[C@@H](NC(C)=O)C(=O)N1CC[C@@H](CNC(=O)CO[Si](C)(C)C)[C@@H]1c1cccnc1	1810537865	QHGUOQIJAPXYOY-NSHGMRRFSA-N	434.613	1.854	50	20	IDGD	
CC(=O)N/C(C)=C/C(=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@H]1c1cccnc1	1812320328	FQYOQHQNPVCVQV-GSARBKTLSA-N	441.301	1.818	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)CN(C)C(=O)C(=O)O)[C@H]1c1cccnc1	1812389036	WXGIXRAJOQJDNL-YQQAZPJKSA-N	438.912	1.038	50	20	IDGD	
C[C@@H]1CCC[C@@H]1C(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1813070654	LDTDWOSSEDTNAT-PGVBMLAISA-N	429.565	1.897	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)CCn2cncn2)[C@@H]1c1cccnc1	1813321000	HXBBMKCLONRQNN-LXZKKBNFSA-N	435.326	1.553	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](O)c2ccccc2)n[nH]1	1817077765	CXRGUKAZWGDIHK-UTKZUKDTSA-N	442.520	1.508	50	20	IDGD	
CC(=O)N(C)[C@@H](C)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CO[Si](C)(C)C)CC2	1817301117	BLXUUTAABFJXNH-AAEUAGOBSA-N	426.615	1.773	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccns2)[nH]n1)c1ccc(B(O)O)cc1	1817471202	STHOEWOYGGQNDS-OAHLLOKOSA-N	425.279	1.166	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cn[nH]c2)n[nH]1	1818232276	ASEFJKIFULPTFI-KWJLSGNOSA-N	437.464	1.573	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H]1CC=CCC1)CC2	1819793713	RPAXKNGHADCQJF-OLZOCXBDSA-N	440.529	1.724	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CC1CCCC1)CC2	1819794801	DPHWFIBBCHBUBW-ZDUSSCGKSA-N	442.545	1.948	50	20	IDGD	
CCc1cc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)nn1C	1819992508	TUEFERYOGVLUNN-QGZVFWFLSA-N	444.540	1.385	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)Cn2ccncc2=O)[nH]n1)[C@@H](F)Br	1820938149	ZNZODUOHPIVYQT-IAQYHMDHSA-N	441.261	1.349	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc[n+]([O-])cc3)sc2C1	1821054642	SHCIJLRHCUGATC-MWLCHTKSSA-N	425.308	1.786	50	20	IDGD	
Cc1ncsc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1	1822412689	FBGFLGKFLHGYEX-AWEZNQCLSA-N	433.538	1.854	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H]2CCNC(=O)C2)n[nH]1	1822483556	DKFNENWSDLRMHL-LOWVWBTDSA-N	426.315	1.711	50	20	IDGD	
CC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(=O)n3[nH]cnc3n1)CC2	1822843047	JTDNNPVZOGCOHL-RKDXNWHRSA-N	435.897	1.117	50	20	IDGD	
C[C@H](C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1)n1ccnn1	1823009123	JXWGBTRQUKDSIH-VHSKPIJISA-N	431.291	1.598	50	20	IDGD	
C=CCSCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1	1824957589	MGJWBPNGGNMICZ-FQEVSTJZSA-N	430.379	1.519	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CN2CCS(=O)(=O)CC2)CC1	1824977566	XWYBNIYDORAPCT-MSOLQXFVSA-N	448.029	1.354	50	20	IDGD	
NC(=O)c1nccnc1C(=O)N[C@@H]1CCc2nc(NC(=O)C(Cl)Cl)sc2C1	1826099756	OPTROIKJKUBHMY-ZCFIWIBFSA-N	429.289	1.062	50	20	IDGD	
CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](F)Cl)CC2	1826647169	KJIFKQSWLSRHLQ-BHYNMZESSA-N	442.904	1.060	50	20	IDGD	
CO[C@@H](C)C(=O)N1CCC([C@H]2CCCCN2C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)CC1	1827679885	ZJMTUDFYKRQUPM-QPSSLLGDSA-N	431.537	1.775	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@H]2CCCS2)CC1	1828926107	ZBLFCTGYVLBKGO-RBUKOAKNSA-N	445.589	1.814	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)c2ccncc2O)CC1	1829175692	BKHNYJVZEXORNS-HXUWFJFHSA-N	437.305	1.014	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3ccoc3)C2)C1	1830545685	LRPQBRNUJVVHOX-DNVCBOLYSA-N	443.338	1.700	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCCC(=O)OC(C)(C)C)CCO2)C1	1830803220	GDAKFQBSHPTMPP-KKSFZXQISA-N	446.972	1.972	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)COc3ccccc3F)CC2)CC1)[C@H](O)CCl	1833312395	SJJNHGDOWBHEBP-GOSISDBHSA-N	441.931	1.376	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3ccc4c(c3)CCCO4)CC2)CC1)[C@@H](O)CCl	1833312898	KKQNSBCWWGDZTF-FQEVSTJZSA-N	449.979	1.797	50	20	IDGD	
CC(C)(C)c1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)ccn1	1833367802	GTJPYHDDWQGECG-HRAATJIYSA-N	439.940	1.049	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3n[nH]c(C)c3F)CC2)CC1	1834020625	WXDCMDABFHRGED-HNNXBMFYSA-N	429.924	1.296	50	20	IDGD	
CCC1(C(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)CCC1	1835498361	MWICEGWZFKXOIN-UHFFFAOYSA-N	441.381	1.132	50	20	IDGD	
O=C(c1cnc2ccccn12)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836717539	XXDDACFEVIOFSU-GOSISDBHSA-N	434.924	1.546	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(F)nc3)CCO2)C1	1837851018	CMGZCJBGRKOYOC-YVEFUNNKSA-N	430.274	1.074	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ncc(OC)cc3F)C2)C1	1839143063	KLPQCKVBQWKXPX-IFXJQAMLSA-N	429.876	1.317	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3CC(F)(F)C3)C2)C1	1839150024	YDBOSFQUZAXCQC-JKSUJKDBSA-N	429.291	1.724	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)nc1	1839151081	HOHOMHGWAVXEMF-OALUTQOASA-N	430.332	1.696	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cscn3)C2)C1	1839151822	FAMDMXATXCMMPP-IRXDYDNUSA-N	436.361	1.378	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCCCCC(=O)OC)CCO2)C1	1840236830	XBZYMYQHZQEECJ-OXQOHEQNSA-N	432.945	1.584	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(CN(C(=O)CC[C@H]3CCOC3)CCO2)C1	1840588768	POYLOXYERGRJMJ-PXNSSMCTSA-N	428.602	1.111	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC2(CCCN2C(=O)c2cccc(S(C)(=O)=O)c2)C1	1841172976	HDPLTUHVZMDHSJ-GFCCVEGCSA-N	429.336	1.691	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H](F)C[C@H]1C(=O)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1	1841351133	GVBSOPFNWYLEDK-RDBSUJKOSA-N	433.908	1.137	50	20	IDGD	
COc1cc(C(=O)N2CC3(CCCN3C(=O)[C@H](O)CCl)C2)ccc1Br	1841352654	CSINQMXAFAWGNY-CYBMUJFWSA-N	431.714	1.874	50	20	IDGD	
CC(C)C[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1	1841354729	RFYFHHASUNAIBY-GJZGRUSLSA-N	431.961	1.729	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCCC12CN(C(=O)c1cc(=O)cco1)C2	1841924529	WSWYZLGDYBSRAH-AWEZNQCLSA-N	439.896	1.589	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)c2cccnc2-c2ccccc2)C1	1843498222	DZBMNYVWIMZARG-UHFFFAOYSA-N	441.296	1.559	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)C2(NC(=O)OCc3ccccc3)CC2)C1	1843928375	INZLVWLQVAZLGQ-KRWDZBQOSA-N	449.935	1.903	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2ccn3nccc3c2)C1	1844136816	NZFPIFYMQNJONK-MFKUBSTISA-N	433.472	1.285	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)c2ccc(C(F)(F)F)cc2)C1	1844948495	COTLHPAYEOUCSH-UHFFFAOYSA-N	426.439	1.895	50	20	IDGD	
C[C@@H]1C[C@@]1(C)C(=O)N1CC2(CCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)C1	1845039275	YPOABBIFPKNQDF-VGOFRKELSA-N	427.549	1.582	50	20	IDGD	
CN(CC(=O)N1CCCC12CN(C(=O)C13CC(C1)C3)C2)NC(=O)NCc1ccccc1	1845039481	SQNSPOVLEKBYSF-UHFFFAOYSA-N	425.533	1.336	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)Cc2cccc(C(F)(F)F)c2)C1	1845922968	ZJHQPGZHOXJZRY-UHFFFAOYSA-N	446.234	1.445	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCO)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)C(C)(C)CCl	1847437373	XUUGKLMZSOUCIE-KKUMJFAQSA-N	431.961	1.729	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C(C)C)c1	14842207	QQYYVUYZXIYPBY-UHFFFAOYSA-N	429.502	1.746	50	20	IDGD	
O=C(NNC(=O)[C@H]1C[C@@H]1c1ccc(Br)cc1)c1ccc(-n2cnnn2)cc1	109764431	SQXBOVWXCMISFV-CVEARBPZSA-N	427.262	1.990	50	20	IDGD	
O=C(COC(=O)c1nc(-c2ccccc2)cs1)NNC(=O)[C@@H]1COc2ccccc2O1	116786918	JDZCFMAIYCWQRD-KRWDZBQOSA-N	439.449	1.954	50	20	IDGD	
CN(C)C(=O)[C@H]1CCCN1CCCNC(=O)NNC(=O)CSc1ccc(Cl)cc1	726277969	TVYCVOHXDUKYNL-MRXNPFEDSA-N	441.985	1.705	50	20	IDGD	
O=C(Cc1ccc(S(=O)(=O)N2CCCCC2)cc1)NNc1nc(-c2ccncc2)no1	726370367	YYIKFFICKGVZMS-UHFFFAOYSA-N	442.501	1.992	50	20	IDGD	
O=C(NNC(=O)c1nccnc1C(=O)NCc1ccc(F)cc1)c1ccc([N+](=O)[O-])cc1	726520921	MODZWOVTIJJBPL-UHFFFAOYSA-N	438.375	1.529	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)cc1S(=O)(=O)NCC#N	726883861	NFPBWVMBSPONFV-INIZCTEOSA-N	444.513	1.642	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NN=Cc1ccc(OC(F)(F)[C@@H](F)C(F)(F)F)cc1	728437233	NVAMPTUBXSVXSS-PELKAZGASA-N	435.346	1.946	50	20	IDGD	
CC(=O)Nc1ccc(S[C@H](C)C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1	728845530	LGRGPQOTICRZQW-CQSZACIVSA-N	442.545	1.980	50	20	IDGD	
CC/C=C(/C)C(=O)N1CSC[C@@H]1C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	728846975	YIPAUIHTLGBFRK-ZVRDQUNJSA-N	432.550	1.098	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)[C@@H]2CSCN2C(=O)CC(C)(C)C)n1	730325921	CGFBAFDLEIGBPG-LBPRGKRZSA-N	442.563	1.022	50	20	IDGD	
O=C(O)c1cc(Cl)c(Cl)c(S(=O)(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1	731338977	MQYRPWXCKDJARE-LBPRGKRZSA-N	447.252	1.841	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NN=C(C)CS(C)(=O)=O)c2)cc1	732527533	ZFSKCHYZKPKXFR-UHFFFAOYSA-N	439.515	1.646	50	20	IDGD	
O=C(NNc1ccc(Br)nc1)c1cc(S(=O)(=O)N2CCSCC2)c[nH]1	732835250	YRIDUWZISIEMTQ-UHFFFAOYSA-N	446.352	1.667	50	20	IDGD	
O=C(CSc1nnc(O)nc1O)NN=C1CCCOc2c(Br)cccc21	733744760	PKHKDVKXZHVLGN-UHFFFAOYSA-N	440.279	1.831	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2ccc3ccccc3c2O)CC1	735116867	IXXXJIGZKNCLBH-UHFFFAOYSA-N	441.513	1.633	50	20	IDGD	
Cc1c(Cl)cccc1OCC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	736066379	FIZZULTWJQWCIC-UHFFFAOYSA-N	425.894	1.739	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)NCc2noc(C)n2)cc1	736092288	MZALYXYMXYMNIM-DHDCSXOGSA-N	435.444	1.349	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1	740918027	UXZZTCQDHZOGRJ-UHFFFAOYSA-N	441.444	1.310	50	20	IDGD	
COCCNS(=O)(=O)c1c[nH]c(C(=O)NNC(=O)c2cc3c(s2)CCCCC3)c1	741144157	HCJYAJIQOQWOBT-UHFFFAOYSA-N	440.547	1.345	50	20	IDGD	
COc1cc(CN(C)C(=O)NNC(=O)CNC(=O)c2ccco2)c(SC)cc1OC	741278098	TVDSGQIWJZCHLU-UHFFFAOYSA-N	436.490	1.621	50	20	IDGD	
O=C(NNC(=O)c1cccc2ccccc12)c1ccccc1S(=O)(=O)N1CCOCC1	741575404	MDZUMVRPQZJAMF-UHFFFAOYSA-N	439.493	1.936	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)[C@@H]1Cc2ccccc21	741882731	LMKFDSOQNVQXML-HXUWFJFHSA-N	443.525	1.127	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)c1ccc(OC)c(N2CCNC2=O)c1	742032929	CWTRDVFEQMHUEJ-UHFFFAOYSA-N	428.445	1.464	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2ccc(S(=O)(=O)C(F)F)cc2)cc1	743829980	IZMRWNCVKCDJJT-UHFFFAOYSA-N	447.441	1.553	50	20	IDGD	
O=C(NNC(=O)[C@H](Oc1ccc(Cl)cc1)c1ccccc1)N[C@@H]1CCS(=O)(=O)C1	743885374	WBCDELREZCMIHC-NVXWUHKLSA-N	437.905	1.978	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN(C)[C@@H](C)c2cccc(S(N)(=O)=O)c2)cc1C	744396317	GZFRPPCNELTRAD-ZDUSSCGKSA-N	438.575	1.720	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNc1ccccc1S(=O)(=O)N1CCOCC1	744620028	AIJMSTQNPBQLCN-UHFFFAOYSA-N	448.501	1.077	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)[C@@H](O)c2ccc(Br)cc2)cc1	745043578	DDZKHJSKUAAIJP-INIZCTEOSA-N	432.230	1.359	50	20	IDGD	
CN(C)C(=O)[C@@H]1CCCN1CCCNC(=O)NNC(=O)c1cccc(Br)c1	745796424	RVRSLGSRGBZYRG-HNNXBMFYSA-N	440.342	1.336	50	20	IDGD	
CC(C)(C)[C@@H]1CCc2sc(C(=O)NNC(=O)NCCOCCS(C)(=O)=O)cc2C1	745854741	LKEKGHOMGONTLQ-CQSZACIVSA-N	445.607	1.904	50	20	IDGD	
CSCC[C@H](C(=O)NNC(=O)c1cccc(N(C)C)c1)N1C(=O)[C@@H]2CCCC[C@H]2C1=O	746102676	GFHJVWFWRMBNNN-KZNAEPCWSA-N	446.573	1.811	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)c1nccnc1C(=O)Nc1ccc(Cl)cc1	746196675	KWPLEPOKHGULFN-UHFFFAOYSA-N	442.819	1.166	50	20	IDGD	
Cc1nc(C(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)nn1-c1n[nH]c(C(F)(F)F)n1	747199573	PUVKNSOTHFINAY-UHFFFAOYSA-N	438.414	1.690	50	20	IDGD	
COc1ccc(Cl)cc1NC(=O)CCNC(=O)NNC(=O)COc1ccc(C#N)cc1	747590306	COOLFQIRULJFOJ-UHFFFAOYSA-N	445.863	1.958	50	20	IDGD	
COc1cc(S(=O)(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)ccc1Br	747595942	RMEYJEPOKMCWCS-UHFFFAOYSA-N	430.236	1.989	50	20	IDGD	
O=C(CNC(=O)c1ccc2c(c1)OCO2)NNc1nc(-c2ccccn2)nc2c1CCC2	747988370	QKFGEHAHFUNKJX-UHFFFAOYSA-N	432.440	1.629	50	20	IDGD	
CCOc1cc(C(=O)NNS(=O)(=O)c2cn(CC)cn2)cc(OCC)c1OCC	748673884	HQWPREPZSUYDJN-UHFFFAOYSA-N	426.495	1.722	50	20	IDGD	
O=C(CCc1ccccc1)NNC(=O)NCC(=O)N1CCN(c2ccc(Cl)cc2)CC1	750334469	CBMIWRHTBCBCCV-UHFFFAOYSA-N	443.935	1.952	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)Cc2ccc(C(=O)NNC(=O)[C@H](C)N(C)C)cc2)cc1	750607191	RYZJSGKZNVCOPA-INIZCTEOSA-N	432.546	1.527	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2cnn(Cc3ccccc3)c2)cc(OC)c1OC	751266762	HIZZUDBFVLCHGL-UHFFFAOYSA-N	446.485	1.581	50	20	IDGD	
COC(=O)c1ccc(Cl)cc1S(=O)(=O)NNC(=O)c1cc(Br)c[nH]1	751268233	XVZSCBISBYDHMM-UHFFFAOYSA-N	436.671	1.841	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C(=O)Nc1cc(C(=O)OC)cc([N+](=O)[O-])c1C)c1ccccc1	753841977	WKBYNFGSQAZHEO-HNNXBMFYSA-N	442.428	1.970	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)Nc2cccc(S(=O)(=O)N3CCOCC3)c2)c1	755353495	ITIMBSXMXGQGOD-UHFFFAOYSA-N	447.517	1.240	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2nnc(C(F)(F)F)s2)c2ccccc2c1=O	755487562	RQIPBAOWQLWLOV-UHFFFAOYSA-N	427.368	1.753	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)Nc1ccc(C(=O)NCC(=O)OC)cc1	755548781	QYYIZGJFSGUKQX-UHFFFAOYSA-N	428.445	1.384	50	20	IDGD	
COc1ccc(S(=O)(=O)NC2CC2)cc1NC(=O)NNC(=O)Cc1ccc(F)cc1	755615876	VMTBDZMVMMKNLX-UHFFFAOYSA-N	436.465	1.670	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)Nc2cccc(N3C(=O)CN(C)C3=O)c2)cc1C	755993840	VQVIISHFTUZLBW-UHFFFAOYSA-N	425.445	1.934	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)Nc1cc(N2CCCS2(=O)=O)ccc1F	756154589	LKLXYHKEZBYBAT-UHFFFAOYSA-N	440.428	1.736	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2nnc(C(F)F)s2)c1	756220935	ZDSRTCPFRYVFCF-UHFFFAOYSA-N	448.477	1.973	50	20	IDGD	
COc1ccc(S(=O)(=O)C(F)(F)F)cc1NC(=O)NNC(=O)Cn1nc(C)cc1C	756297621	NGRGRVDSELHOIB-UHFFFAOYSA-N	449.411	1.655	50	20	IDGD	
CC[C@@H](c1ccccc1)c1nnc(NC(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)s1	756461848	WLKAGKYAUOZSJG-PWSUYJOCSA-N	426.524	1.170	50	20	IDGD	
COC(=O)c1ccc(NC(=O)NNC(=O)COc2ccccc2OC)cc1C(=O)OC	756819575	XMJMRTHCKRMBII-UHFFFAOYSA-N	431.401	1.500	50	20	IDGD	
CCc1nn(C)cc1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	757895888	MEEJJPWOJCDXGZ-UHFFFAOYSA-N	434.522	1.624	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc2c(c1)COC2)NNC(=O)c1ccc(Cl)cc1F	759810335	IKISVTZWWZCZAW-UHFFFAOYSA-N	427.841	1.249	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@H]12	762408142	HWFDWWOGDZMCGZ-QITLCBANSA-N	438.575	1.661	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)N[C@@H]1CCCN(c2ccccc2F)C1	762530540	YYFSSWZJDXWCJG-CQSZACIVSA-N	448.524	1.732	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c(Br)c1	763468373	JUCVHIWQYBQBNK-UHFFFAOYSA-N	437.206	1.766	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)[nH]n1)C(=O)Nc1ccnn1Cc1ccccn1	763601003	MHYQYMDCVIULQX-UHFFFAOYSA-N	430.428	1.116	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccn(-c3ncccc3F)n2)c2ccccc2n1	763619338	SZQZQERPIRPXQH-UHFFFAOYSA-N	433.403	1.663	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2c(C)nc3ccccn23)ccc1Br	763629420	JJGAMTCFAPQDSM-UHFFFAOYSA-N	446.261	1.814	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cc(C#N)ccc2OC(C)C)cc1	763659402	NMZOFESWUKSLCD-UHFFFAOYSA-N	426.429	1.519	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2ccc(N3CCSCC3)cc2)c1	763770966	CVKAYHHOPQZAFM-UHFFFAOYSA-N	444.513	1.657	50	20	IDGD	
Cc1cc(C)n(-c2cccc(NC(=O)C(=O)NNC(=O)COc3ccccc3C#N)c2)n1	763809660	YPXFBMLSSHYDGN-UHFFFAOYSA-N	432.440	1.526	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cccc(OCCN(C)C)c2)c1C	763842209	WWIRECCKQCGQQB-QGZVFWFLSA-N	442.516	1.797	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)C(=O)Nc1ccc2c(c1)OC(F)(F)O2	763949063	MWTDLZCPILESPK-UHFFFAOYSA-N	445.338	1.299	50	20	IDGD	
Cc1nnnn1-c1cc(NC(=O)C(=O)NNC(=O)c2cccc3ccccc23)ccc1F	764057463	CQCQTMYPOCTOBD-UHFFFAOYSA-N	433.403	1.663	50	20	IDGD	
COC(=O)c1sccc1NC(=O)C(=O)NNC(=O)c1cccc(Br)c1	764063287	NBRIAXAWXNTIHZ-UHFFFAOYSA-N	426.248	1.697	50	20	IDGD	
CN(C)c1c(Cl)cccc1NC(=O)C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	764078421	UHOPQYKBTBZYLL-UHFFFAOYSA-N	438.893	1.209	50	20	IDGD	
CCOC(=O)c1cc(F)c(F)cc1NC(=O)C(=O)NNC(=O)c1ccc(Cl)nc1	764101024	NNHCTELYRAWODO-UHFFFAOYSA-N	426.763	1.590	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(NC(=O)CC(C)C)cc2)c1O	764132459	XAVCYAKLCYFIJP-UHFFFAOYSA-N	428.445	1.785	50	20	IDGD	
CC(C)n1nnnc1-c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(C#N)cc2)cc1F	764177239	MRSLWBFFECSVID-UHFFFAOYSA-N	436.407	1.331	50	20	IDGD	
Cn1cc(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3CN2Cc2ccccc2)cn1	764179376	SAEHQQXZAVBYRS-FQEVSTJZSA-N	432.484	1.133	50	20	IDGD	
Cc1nn(CC(F)(F)F)cc1C(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	764181427	JBNVCEYRDFXZET-UHFFFAOYSA-N	429.311	1.280	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1ccccc1C[S@](C)=O	764393076	CFTUTMMNXBBQLN-LJAQVGFWSA-N	435.527	1.452	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(-n2cccn2)cc1C(F)(F)F	764399602	KVPXHBXJLIRZBS-LLVKDONJSA-N	443.382	1.029	50	20	IDGD	
CCS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)cc1	764401194	NVGYLWNNZPEUBM-UHFFFAOYSA-N	437.499	1.064	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NCc2cccnc2OCC(F)F)c2ccccc2c1=O	764513184	FVLMQMNFLHVPPL-UHFFFAOYSA-N	432.387	1.117	50	20	IDGD	
CCCn1cccc1C=NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1	764817771	HRNNXIRBLNTRQV-UHFFFAOYSA-N	431.562	1.663	50	20	IDGD	
CC(=NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1)c1ccc(O)cc1F	764820414	YLZAODBSRSZCGF-UHFFFAOYSA-N	448.520	1.686	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1ccc(CC(=O)N(C)c2ccccc2)cc1	766264911	TZFOSYDXMVCKRL-UHFFFAOYSA-N	434.456	1.773	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)c1ccc(CN2C(=O)CCC2=O)cc1	767275373	JUEPUMMJCXEUFT-UHFFFAOYSA-N	437.452	1.191	50	20	IDGD	
CCc1nn(C)c(Cl)c1C(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	767539751	MHPALQJTOYJDAS-UHFFFAOYSA-N	428.921	1.979	50	20	IDGD	
Cc1[nH]c(-c2ccncc2)nc(=O)c1CCC(=O)NNC(=O)c1cc(-c2cccs2)[nH]n1	768261111	QQTPMMKAIKRBCO-UHFFFAOYSA-N	449.496	1.986	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)c3ccc(CS(N)(=O)=O)cc3)n[nH]2)cc1C	768264351	ZEJDBNBCSSULED-UHFFFAOYSA-N	427.486	1.557	50	20	IDGD	
CN(C)[C@@H](CNC(=O)NNC(=O)CNC(=O)c1ccco1)c1cccc(C(F)(F)F)c1	769530447	LKSBAIYEWNFLRL-AWEZNQCLSA-N	441.410	1.662	50	20	IDGD	
C[C@H](NS(=O)(=O)c1cccc(C(F)(F)F)c1)C(=O)NNC(=O)NCc1ccco1	770889964	CPBKGTOTWSUSTB-JTQLQIEISA-N	434.396	1.496	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)[C@@H]3CCN(c4ccccc4Br)C3=O)nc21	770968758	MXJRIQDTUDZXSK-VIFPVBQESA-N	446.265	1.328	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)c3ccc(NC(=O)OCC(F)(F)F)cc3)nc21	770980733	TZQYRTNCRGKVMK-UHFFFAOYSA-N	425.327	1.937	50	20	IDGD	
CCC1(CC)NC(=O)N(CC(=O)NNC(=S)Nc2cccc(Br)c2)C1=O	770991742	JGKNQPCFBDEUBM-UHFFFAOYSA-N	442.339	1.877	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NCC2CCN(c3ccncc3)CC2)cc1	772621338	ZIRLUXYIJAKIGA-UHFFFAOYSA-N	446.533	1.737	50	20	IDGD	
Cc1cc(C[C@H](C)NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)n(-c2ccccc2)n1	772973262	JXDQSLDPNJIKBN-HNNXBMFYSA-N	445.487	1.732	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3c(F)ccc(F)c3F)cc2)CC1	773458047	AJXPJPRMAKZFDS-UHFFFAOYSA-N	428.436	1.797	50	20	IDGD	
COc1ccc(N2CCN(C(=O)/C=C/C(=O)NNc3cc(Cl)nc(N)n3)CC2)cc1	773862360	SMGQZYSDRWDNMP-VOTSOKGWSA-N	431.884	1.069	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)Nc2ccc(C[C@H]3NC(=O)NC3=O)cc2)o1	775709141	RQPQRDUTKWUEAH-MRXNPFEDSA-N	442.476	1.338	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)Cc2ccc(S(=O)(=O)N3CCCC3)s2)c1	776715339	SEMJNVLLTGSNJZ-UHFFFAOYSA-N	443.572	1.622	50	20	IDGD	
CCOc1ccc(-n2c(SCC(=O)NN(C)C(N)=O)nnc2-c2ccncc2)cc1	778415805	SNIGMPJMZJQMKJ-UHFFFAOYSA-N	427.490	1.862	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccccc1	778434307	YYOJFDOQKDBLNJ-SFHVURJKSA-N	440.500	1.700	50	20	IDGD	
Cc1cc(C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)nn1-c1cccc(C#N)c1	780194591	HOQPPJHZTDVBCQ-UHFFFAOYSA-N	448.395	1.579	50	20	IDGD	
CC(C)[C@H]1C[C@H](CC(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)CCO1	781708537	DSYLVHASKVTESJ-UYAOXDASSA-N	430.549	1.433	50	20	IDGD	
COC(=O)C1(CNC(=O)NNC(=O)Nc2cc(Cl)c(OC)cc2OC)CCOCC1	781831437	DRQUJZHJYACAIC-UHFFFAOYSA-N	444.872	1.663	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2ccc(OC)c(OCC(=O)NC3CC3)c2)cc1	783034917	LZVDXYDOGOEXTK-UHFFFAOYSA-N	428.445	1.443	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)C(=O)Nc1ccn(-c2ccccc2)n1	784210519	SBXXDDBBQCSVLY-UHFFFAOYSA-N	440.485	1.395	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@@H]2CC=CC[C@@H]2C(=O)N2CCOCC2)ccc1OC(C)C	784295296	FKLPUEXORCQFCX-MSOLQXFVSA-N	445.516	1.685	50	20	IDGD	
NC(=O)c1n[nH]c2ccc(NC(=O)C(=O)NNc3ccc(F)cc3Br)cc12	784804029	ZULRZYWJSAFOHD-UHFFFAOYSA-N	435.213	1.645	50	20	IDGD	
CCc1cc(Br)ccc1NNC(=O)C(=O)Nc1ccn(CC(=O)N(C)C)n1	785103000	CNFPOHQRDFVMSM-UHFFFAOYSA-N	437.298	1.378	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2ccc(C[C@H]3CC(=O)NC3=O)cc2)cc1Cl	785117593	LAIBUWNOJFDISD-LBPRGKRZSA-N	430.848	1.636	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1ccc(-n2cccn2)cc1	785330028	CBTQRGBVYINCLI-UHFFFAOYSA-N	429.458	1.366	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O	785408477	UJFASQRDKOXEEO-JTQLQIEISA-N	441.487	1.357	50	20	IDGD	
COc1ccc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c(OC(C)C)c1	789213884	SMXMVAVLLKBNHQ-LJQANCHMSA-N	444.440	1.627	50	20	IDGD	
CCOc1ccc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)CC(C)(C)O)cc2)cc1	792013904	ZHWOIUFXXSCKQL-UHFFFAOYSA-N	435.502	1.808	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)[C@](C)(O)Cn2c(C)cccc2=O)cc1OC	792031710	ZWKAETODQJSMPX-JOCHJYFZSA-N	431.489	1.556	50	20	IDGD	
CCN(CC)C(=O)Cn1ccc2cc(NC(=O)C(=O)NNc3nc4ccccn4n3)ccc21	792391954	MMBDIYOFXUKJMG-UHFFFAOYSA-N	448.487	1.634	50	20	IDGD	
COc1c(NC(=O)C(=O)NNC(=O)c2cn(C)c3ccccc23)cc(Cl)cc1C(N)=O	793021610	GWHATCCKWYMGNS-UHFFFAOYSA-N	443.847	1.339	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NN=Cc3ccnn3C(C)C)CC2)cc1	794524279	KAALGXUGOARBSG-UHFFFAOYSA-N	432.550	1.229	50	20	IDGD	
COc1cc2c(cc1OC)C(=NNC(=O)CN1CCN(C(=O)c3ccccc3)CC1)CC2	794524422	LANPOOIWTWHBFD-UHFFFAOYSA-N	436.512	1.928	50	20	IDGD	
CC(=NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)c1ccc2c(c1)OCC(=O)N2	794876546	GLNGHBLYYZEXOO-UHFFFAOYSA-N	442.497	1.956	50	20	IDGD	
Cn1cc(-c2cc(F)ccc2NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cn1	797005407	FEIJCSYYMOVLDJ-UHFFFAOYSA-N	447.430	1.812	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccccc2OCC(=O)Nc2cccnc2)n1	797371203	RABFWKNECHXOLI-UHFFFAOYSA-N	448.439	1.202	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@H](C(=O)NNC(=O)Nc2ccc(Cl)cc2)[C@@H](C)O)cc1	802017840	BKBQPFCIOVCZLB-WBMJQRKESA-N	440.909	1.529	50	20	IDGD	
C[C@]1(c2ccc(C(=O)NNC(=O)Nc3ccc(OC(F)F)cc3)cc2)NC(=O)NC1=O	802045256	JGPFUJCHWLFYMT-LJQANCHMSA-N	433.371	1.809	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@H](c2ccccc2)N2CCCCC2=O)cc1	802068023	WVMLJKJDUXDUJG-IBGZPJMESA-N	444.513	1.997	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)CCN/C(O)=C2\N=CC=CC2=O)cc1Cl	802074031	CKRTVRUSFMFFSP-WUKNDPDISA-N	437.840	1.426	50	20	IDGD	
O=C(NCCCOC(F)F)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	802441174	XOGZBSFXPNCHBU-UHFFFAOYSA-N	434.465	1.435	50	20	IDGD	
COC(=O)c1c(F)cc(NC(=O)C(=O)NNC(=O)c2ccc(OC)c(OC)c2)cc1F	802565987	UGTXVDNWPUKJTH-UHFFFAOYSA-N	437.355	1.168	50	20	IDGD	
N[C@](C(=O)NNC(=O)c1csc(N2CCOCC2)n1)(c1cccc(F)c1)C(F)(F)F	806338246	NXTSUDFXHHKYEC-INIZCTEOSA-N	447.414	1.296	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2cc(Cl)cc3c2OCC(=O)N3)c1	806973894	XJIZJHZTJXRSGZ-UHFFFAOYSA-N	432.820	1.144	50	20	IDGD	
Nc1nc(C2CC2)ncc1C(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	807094558	ZLXQUVXJZLQCFO-UHFFFAOYSA-N	443.939	1.168	50	20	IDGD	
O=C(NNc1cccc(F)n1)C(=O)Nc1cnc(N2CCOCC2)c(Br)c1	807390799	PLIMIEZVPZGTMS-UHFFFAOYSA-N	439.245	1.297	50	20	IDGD	
COC[C@@H](C)Oc1ccc(Cl)cc1NC(=O)C(=O)NNc1ccc(-n2ccnc2)nn1	807429318	TYDZAUIXRPXGNZ-GFCCVEGCSA-N	445.867	1.811	50	20	IDGD	
CN(C)CCn1c(=O)oc2ccc(NC(=O)C(=O)NNc3nccnc3C3CCC3)cc21	807461569	KDIHZOUJTIPRIY-UHFFFAOYSA-N	439.476	1.295	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)NCCC(=O)NNc2nccnc2C2CCC2)cc1	807780490	WSPQORSEHCOIRO-UHFFFAOYSA-N	432.506	1.514	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H]2CCn3c(cnc3C)C2)c1	809956705	DADGIQLQUTURHM-INIZCTEOSA-N	433.534	1.246	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CNS(=O)(=O)c2c(Cl)cccc2Cl)c1	810346279	JXESPQOUTNVPKH-UHFFFAOYSA-N	427.269	1.605	50	20	IDGD	
COc1cc(F)cc(NNC(=O)C(=O)Nc2ccc(C(N)=O)cc2OCC(F)F)c1	810400320	FOTSBXAUOJZDCV-UHFFFAOYSA-N	426.351	1.659	50	20	IDGD	
CCOC(=O)c1ccc(NNC(=O)[C@H](C)NS(=O)(=O)c2ccc(C(N)=O)cc2)cc1C	812719930	SJTPFHKLOGLLOL-ZDUSSCGKSA-N	448.501	1.081	50	20	IDGD	
CCOC(=O)c1cc(C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)cc([N+](=O)[O-])c1	812727903	ZRBLUZJBRAKDEG-UHFFFAOYSA-N	436.446	1.779	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)Nc1cccc(N2C(=O)NC(C)(C)C2=O)c1	812975107	ABXBRBDXBQGOHD-UHFFFAOYSA-N	425.445	1.925	50	20	IDGD	
O=C(NNC(=O)C1(S(=O)(=O)c2ccccc2)CCCCC1)C(=O)Nc1ccccn1	813480107	PXHRGBSUPSVNFX-UHFFFAOYSA-N	430.486	1.344	50	20	IDGD	
COCCC(C)=NNC(=O)C[C@H]1c2cc(OC)c(OC)cc2CCN1S(C)(=O)=O	814759258	WQVFAKOGLGEDIP-INIZCTEOSA-N	427.523	1.481	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccc([C@@H]3CCOC3)cc2)cc(OC)c1OC	815563994	UOXUHKJAOAUWGY-CQSZACIVSA-N	443.456	1.616	50	20	IDGD	
Cc1ccc(Oc2ccc(NC(=O)C(=O)NNC(=O)[C@@H]3CCc4nncn4C3)cn2)cc1C	815693392	VVKJJBVCUYUGDA-OAHLLOKOSA-N	449.471	1.431	50	20	IDGD	
CC(C)C(=O)N1CCC(C(=O)NNC(=O)COc2ccc(Br)cc2)CC1	887336877	JWNBSCDRKZIJBD-UHFFFAOYSA-N	426.311	1.870	50	20	IDGD	
NC(=O)[C@@H]1CC(C(=O)NNC(=O)CCSc2ccc(F)cc2)=NN1c1ccccc1	913082125	NHMCQPCPIRKZBT-KRWDZBQOSA-N	429.477	1.576	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)NC3CCCC3)c2)cc1OC	913465238	NEESAAVCQKVCRN-UHFFFAOYSA-N	447.513	2.000	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)C2=NN(Cc3ccc(F)cc3)C(=O)CC2)c1	916048906	WQTUOOBSGWKEGR-UHFFFAOYSA-N	446.460	1.169	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2nc(-c3ccccc3)n(-c3ccccc3)n2)no1	916128284	UNAKAWLSWGWDCB-UHFFFAOYSA-N	431.412	1.630	50	20	IDGD	
Cn1ccnc1[C@@H](NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)c1cccc(F)c1	916224156	JBWUZUHBKPEIGP-KRWDZBQOSA-N	449.446	1.540	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)NCCNC(=O)c2ccc(Cl)cc2)nc2ccccc21	916262858	RNROFBKMKKSNCQ-UHFFFAOYSA-N	428.880	1.530	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCCNC(=O)NNC(=O)c2cc(C)nc3ccccc23)cc1	916278539	SMUBQFKDISQFLK-UHFFFAOYSA-N	441.513	1.774	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)CC1	916520012	XGBKGMNTKFQDGI-UHFFFAOYSA-N	444.492	1.921	50	20	IDGD	
CC(C)OCc1ccc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1	916535567	VGKYLGCRFOIVAO-LJQANCHMSA-N	428.441	1.756	50	20	IDGD	
CCc1noc(CCCC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)n1	916726138	DKLGAGCIHYULBJ-UHFFFAOYSA-N	449.533	1.591	50	20	IDGD	
Cc1nc2c(C(N)=O)cnn2c(C)c1CCC(=O)NNC(=O)Cc1ccc(Cl)cc1	916735167	IVAOHYGTJYYRRD-UHFFFAOYSA-N	428.880	1.421	50	20	IDGD	
N#Cc1ccccc1COc1cccc(C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)c1	919887933	IORZRLNOBTVUAJ-KRWDZBQOSA-N	428.470	1.268	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(N2CCCC2=O)cc1)c1nnc(-c2ccccc2)o1	919962095	WAERNPBTKDUDAJ-UHFFFAOYSA-N	427.442	1.487	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)c1ccccc1OCc1ccccc1Cl	920298654	QUDNBBJVINGKPW-GFCCVEGCSA-N	425.894	1.618	50	20	IDGD	
CCc1ccc(C(=O)NNc2nncc(N)c2Cl)cc1S(=O)(=O)N1CCOCC1	1116297906	FVQQVEORYNCRTC-UHFFFAOYSA-N	440.913	1.052	50	20	IDGD	
Cc1ccc(NC(=S)NNC(=O)c2ccc(S(=O)(=O)NC[C@H](C)O)cc2)c(C)c1	1120572904	ZXHQTEQLWDBTAV-AWEZNQCLSA-N	436.559	1.594	50	20	IDGD	
Cc1c(-c2ccccc2)sc(NC(=O)NNC(=O)CCO)c1C(=O)N1CCOCC1	1320566815	KITOIEXQMOPFFW-UHFFFAOYSA-N	432.502	1.731	50	20	IDGD	
Cc1noc(-c2ccc(C(=O)NNC(=O)c3sc(N4CCOCC4)nc3C)cc2)n1	1337223451	XDJHEXSDTFQJFN-UHFFFAOYSA-N	428.474	1.721	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)c1ccc(N2CCC[C@H](C(N)=O)C2)cc1	1347723161	DKACHKJOYMDQSC-INIZCTEOSA-N	445.545	1.396	50	20	IDGD	
O=C(c1c(Cl)ccc2c1OCO2)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1777798958	ZTZUJMQGFOAGQS-XIKOKIGWSA-N	431.272	1.112	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H]1COc3ccccc3O1)C2)[C@H](F)Cl	1778023176	XWFKRWLWPDJSHA-PFRQMTDMSA-N	426.872	1.875	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)Nc2nccs2)C1	1778074173	ULUOFRHHKZNKPH-XTDOFWJNSA-N	444.985	1.711	50	20	IDGD	
CC(C)CNC(=O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@](C)(Cl)CCl)C2	1778119744	BILXWAAFADSCEX-NIKGAXFTSA-N	436.380	1.509	50	20	IDGD	
C[C@H](C(=O)N1CC[C@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2)n1ccccc1=O	1779266544	AEMVAYFKMGWVTA-ZMYBRWDISA-N	430.332	1.476	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc3ncnn3c1)C2	1779545332	CXLNHAUHXBLPOR-DYESRHJHSA-N	445.596	1.708	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CO[Si](C)(C)C)C1	1779545429	LITNUWUSASYLOK-JXXFODFXSA-N	442.633	1.059	50	20	IDGD	
O=C(Cc1ccc2c(c1)CCO2)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781332590	BTCPRLIEMPVTGI-PKOBYXMFSA-N	441.297	1.684	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cnn4c(C)cc(C)nc34)CCO2)C1	1783874303	GNQFYJVFXRVSBR-OXQOHEQNSA-N	435.912	1.043	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)C[C@@H](C)NC(=O)OC(C)(C)C)CCO2)C1	1783876030	QTTPZCSEFFLGGM-STXHMFSFSA-N	447.960	1.373	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3c(C)nc4sccn34)CCO2)C1	1783878502	ZDPWFFJFESTSRZ-UGSOOPFHSA-N	426.926	1.402	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3c(Cl)cncc3Cl)C[C@@H]21)[C@H](O)CCl	1784084064	KWSGWQDEOIGATE-ZNIXKSQXSA-N	436.723	1.581	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc4c(c3)CCNCC4)C[C@@H]21	1784622808	VWOXECCAGVZEEJ-WBKMXMRLSA-N	448.995	1.771	50	20	IDGD	
Cc1noc(C)c1CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21	1785361870	JHBSZINIUMMYKT-NZUILWFCSA-N	446.317	1.894	50	20	IDGD	
O=C(CC12CCCN1CCC2)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21	1789823213	UPSUBHBXJFMESH-QBYUYEEZSA-N	446.361	1.675	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]3C2)cn1	1789868504	GYHMLHFFBGSDGG-XMDUPGNXSA-N	430.332	1.920	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cn3cc([N+](=O)[O-])cn3)C[C@@H]21	1789869200	YQZIXNJWQFBRRO-PLNCSYRRSA-N	448.307	1.007	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]2C1	1789871495	CSOADBYOAYZJOP-SQRMYFJTSA-N	430.170	1.986	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3noc4c3CCCC4)C[C@@H]21	1791058005	VDDPHMQXJHHAAH-DUPGQFARSA-N	440.338	1.930	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1ccc(C2(NC(=O)[C@@H](N)c3ccccn3)CCC2)cc1	1791599349	INDKUZQDACOMKY-NRFANRHFSA-N	438.532	1.589	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COc1ccc(Cl)c(F)c1)C2)[C@H](O)CCl	1792975487	SNNVCYQDTWKCAH-VODVUFLWSA-N	435.279	1.047	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1cc(F)ccn1)C2	1795111637	ZFXUFFZTYWEHKA-IVWMJMPLSA-N	428.302	1.528	50	20	IDGD	
Cc1cccc2cc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)CCC(=O)NN(C)C)C4)[nH]c12	1797371321	CURHVNWXPWRRMM-FAQVEIGNSA-N	441.532	1.053	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cn3c(F)cccc3n1)C2)[C@H](F)Br	1799347884	YSEPKJAPDXPXNG-OWLDWWDNSA-N	443.248	1.367	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1c(F)ccc(O)c1F	1799724946	QCLRXKZJMXKFAP-DJQAVVSRSA-N	447.276	1.905	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1c[nH]c2ccccc12)c1ccc(B(O)O)cc1	1799901189	IYPOOEKLBKEMSN-ACDBMABISA-N	431.301	1.342	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc(OC)c(F)c1)C2	1800638829	AJJVSKRREUDGAA-QVHKTLOISA-N	444.301	1.606	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)Br)c1	1800763568	DEEXEZUVJPZJKS-RMIITELYSA-N	438.322	1.632	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(SC)c1O)C2	1800979242	XYCHLCUACNKEPK-LMWOUKEDSA-N	428.938	1.571	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)COCc1ccc(OC)cc1	1801108143	MNPUYRXGTYECAE-WQDJSCAQSA-N	440.924	1.055	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1CCc2ccccc2O1)c1ccc(B(O)O)cc1	1802234595	QCNFBXZRVHSLKE-XAPVIXHLSA-N	434.301	1.012	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@H]1CCN(C(=O)c2ccc(O)nn2)[C@H]1c1cccnc1	1803009502	RFCQUPOGRBETEQ-MRRJBJDNSA-N	448.321	1.928	50	20	IDGD	
Cc1ccc(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)o1	1803778539	BYAFDVOMCUWVDA-WIYYLYMNSA-N	433.273	1.296	50	20	IDGD	
C#CCCC(=O)N1CC[C@H](CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@@H]1c1cccnc1	1808420874	ATPIYQFDQXWARO-BFZLZUEVSA-N	434.500	1.635	50	20	IDGD	
C[C@H](C(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)n1ccccc1=O	1810515709	TVIVRQBJMRNAPX-XZKMEQPCSA-N	432.908	1.110	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2ccc(F)cc2)[C@@H]1c1cccnc1	1811906205	WNPNDPLYRMBXNT-AVRDEDQJSA-N	441.507	1.913	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2ccccc2O)[C@@H]1c1cccnc1	1813071819	YBEQAXDTJHJGIX-VGOFRKELSA-N	439.516	1.480	50	20	IDGD	
CC1(C)CC(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)C1	1813126882	YDLQMIYBKGUXRA-WIYYLYMNSA-N	435.333	1.517	50	20	IDGD	
O=C(N[C@H]1CCc2nc(NC(=O)[C@H]3Cc4ccccc4CN3)sc2C1)[C@H](O)CCl	1817132317	IJGAYUNCBOMFBI-NUEKZKHPSA-N	434.949	1.369	50	20	IDGD	
O=C(Cn1cccc([N+](=O)[O-])c1=O)N[C@@H]1CCc2nc(NC(=O)[C@H](F)Cl)sc2C1	1817133854	IYFFRCBIGVIROA-OQPBUACISA-N	443.844	1.360	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])[nH]2)[nH]n1	1822414967	PEGBFTSMEDUQLR-CQSZACIVSA-N	446.468	1.325	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)/C=C/c2cnc[nH]2)[nH]n1	1822416830	QOJVLGVHDDZPQD-FSNWXROXSA-N	428.497	1.211	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCn1cncn1)CC2	1822869334	JTFKSDVCARCRIY-HWPZZCPQSA-N	431.349	1.973	50	20	IDGD	
O=C(N[C@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1)c1cccc(=O)n1O	1823002456	RBZZSKSTJUQIBH-MADCSZMMSA-N	445.270	1.458	50	20	IDGD	
O=C(C[C@H]1CCCCO1)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827055599	FGEDHIHVNXWYJG-YADHBBJMSA-N	442.365	1.559	50	20	IDGD	
Cc1ccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)c(O)n1	1829738464	PBYRIXJOOZUFJY-LJQANCHMSA-N	445.564	1.702	50	20	IDGD	
N#Cc1cccc(CCC(=O)N2CCO[C@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)c1	1830462693	HFMVHAGPUMODSM-HXUWFJFHSA-N	440.327	1.751	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccncc3F)C2)C1	1830538457	FXNPOTYASMUTFP-SCLBCKFNSA-N	444.301	1.322	50	20	IDGD	
Cc1cccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)n1	1830923207	YBPJRDSXKVOOMW-DNVCBOLYSA-N	440.338	1.172	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CC(c3ccccc3)=NO1)CCO2	1831263729	VZSFJPRBGDUWPP-JLMWRMLUSA-N	449.935	1.653	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)C[C@@H](NC)C(=O)O)CC1	1831548294	AMJMLDSNCCNPHF-ARFHVFGLSA-N	446.386	1.842	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3N(C)C)C2)C1	1831643863	JICMWNKQJGEMDN-UTKZUKDTSA-N	438.956	1.625	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCCn3ccnc3)C2)C1	1831656404	FCCIMGVQEPFRIZ-YLJYHZDGSA-N	426.945	1.527	50	20	IDGD	
CC(C)[C@@H](S)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1	1831871977	YEZCUBJDJNXWOL-FXAWDEMLSA-N	426.627	1.934	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)cnc1C	1833301398	DLEBVFBCXCGIPQ-LIRRHRJNSA-N	440.338	1.552	50	20	IDGD	
Cc1ccn2c(C(=O)N3CCC(N4CCC(NC(=O)[C@H](O)CCl)CC4)CC3)cnc2c1	1833312246	MLQNPPWDXNJWFV-LJQANCHMSA-N	447.967	1.428	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccccc3O)CCO2)C1	1833751887	HTFUXLSNJNJSNR-LIRRHRJNSA-N	441.322	1.493	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)c3ccccc3)C2)C1	1834818745	DDOHTJULLAEKAU-PKOBYXMFSA-N	443.313	1.939	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CCN3CCCCC3)CCO2)C1	1835135273	JZIORQSMNYAJOT-LPHOPBHVSA-N	446.386	1.102	50	20	IDGD	
CC(=O)N1CCO[C@]2(COCCN(C(=O)/C(C#N)=C/c3ccc(Br)cc3)C2)C1	1835205644	JDSJDAOMLOSARB-OTJDAXFFSA-N	448.317	1.832	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1)c1cncc(O)c1	1836551537	OFFWTCAGZOKUMN-UHFFFAOYSA-N	439.354	1.757	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cc3cnccc3[nH]1)CCO2	1837102454	MYHXAQZUCNQDFN-OAQYLSRUSA-N	446.580	1.484	50	20	IDGD	
O=C(c1ccn2nccc2c1)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1837161534	CXLWUEMRWIRKNX-SFHVURJKSA-N	427.288	1.208	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)C/N=C/c3ccco3)CCO2)C1	1837559911	JSDDZUCPGAEORK-ZQUFOJLJSA-N	425.913	1.562	50	20	IDGD	
O=C(c1cc(-c2ccccc2)no1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1	1837994520	QFOPLIPUXGENAC-LAUBAEHRSA-N	449.891	1.011	50	20	IDGD	
Cc1nn[nH]c1C(=O)N1CCC(OC2CCN(C(=O)[C@@](C)(Cl)CCl)CC2)CC1	1838001613	YYPWFZWTMBUMNX-SFHVURJKSA-N	432.352	1.962	50	20	IDGD	
COc1cc(C#N)cc(C(=O)N2CCO[C@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)c1	1838584567	YWLJHBDVRBWWRO-LJQANCHMSA-N	442.299	1.441	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)cc1OC	1838931181	NLDKZPLEHSAUNH-APWZRJJASA-N	430.860	1.308	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)NC(=O)OC(C)(C)C)C2)C1	1839141398	HACTWIDWFJQNAH-BXTJHSDWSA-N	447.960	1.373	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3cccnc3OC)C2)C1	1839142685	VWUPSZLSMKJZOM-UWJYYQICSA-N	439.940	1.497	50	20	IDGD	
CCn1nc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)cc1C	1839153828	SWDIKGNKCYHXLX-RBUKOAKNSA-N	447.363	1.518	50	20	IDGD	
Cc1noc(C)c1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839198088	SMTXLKBUEPPUPY-BBRMVZONSA-N	434.262	1.052	50	20	IDGD	
CCOc1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](Cl)CC)C3)C2)c1O	1839427062	FFYSMIMVRWETDN-IERDGZPVSA-N	440.924	1.878	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccsc3)C2)C1	1839964018	CRULYWXZMATNND-MAUKXSAKSA-N	445.379	1.921	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3[nH]cc4c3CCC4)C2)C1	1840034224	FEQHVPVKTZCNMA-DJJJIMSYSA-N	440.338	1.357	50	20	IDGD	
Cc1cccc(F)c1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)Br)CCO2	1840037299	YAJJJSGEDLLFEE-IFXJQAMLSA-N	443.313	1.988	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4occc4c3)C2)C1	1840152563	MIUZFYVHEOMDSQ-DYESRHJHSA-N	436.892	1.757	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccncc3Cl)C2)C1	1840153673	XLHVYQNGGDRWFR-CRAIPNDOSA-N	432.304	1.059	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)cc1Cl	1840732038	GVWSUTRWWYBNLF-CRAIPNDOSA-N	435.279	1.953	50	20	IDGD	
Cc1cnc(C(=O)N2CC3(CCCN3C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)cn1	1841924323	YBWRVJFYZLZDAA-AWEZNQCLSA-N	437.928	1.734	50	20	IDGD	
CC(C)c1nn2ccccc2c1C(=O)N1CCCC12CN(C(=O)CCC(=O)NN(C)C)C2	1843221200	DVKHNFKPGUCNIA-UHFFFAOYSA-N	440.548	1.648	50	20	IDGD	
C[C@H](Br)C(=O)N1CC2(CCCN2C(=O)c2cccc(N3CCOCC3)n2)C1	1843529065	ZQQUHQUJMSGHTR-AWEZNQCLSA-N	437.338	1.519	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)c2ccncc2-c2ccccc2)C1	1844588684	UITYXSQYPSYLAM-UHFFFAOYSA-N	435.528	1.939	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@]23C[C@@H]2CN(C(=O)OC(C)(C)C)C3)C1	1846127600	QCKIUIZOOVEFLT-LRAJWGHMSA-N	441.956	1.701	50	20	IDGD	
Cc1ccn2c(=O)c(C(=O)N3CC4(CCCN4C(=O)[C@@H](C)Br)C3)cnc2c1	1846176771	CGJWPIDUMCLDRW-CYBMUJFWSA-N	433.306	1.603	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)(C)O)C1	1847092647	VCBZXFMOQXBECO-ZIAGYGMSSA-N	447.960	1.108	50	20	IDGD	
Cn1cc(-n2cc(C(=O)N3CC[C@H]4[C@@H]3CCN4C(=O)[C@@H](O)CCl)c3ccccc32)cn1	1847559301	GZUQARZLVQRZAY-UFYCRDLUSA-N	441.919	1.779	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C2CCN(S(=O)(=O)c3ccccc3F)CC2)c1	15877024	IDLCNSZJJDJOQK-UHFFFAOYSA-N	449.504	1.761	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)CCc2nnc(-c3ccccc3)o2)c1	21869485	YYLMYZYJOXJGLW-UHFFFAOYSA-N	443.485	1.381	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2ccn(-c3ccccc3)n2)cc1	31490057	YLJWYXBYQCRTAQ-UHFFFAOYSA-N	427.486	1.262	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(N2CCOCC2)c(C(=O)NNc2ccccc2[N+](=O)[O-])c1	105009640	CHUWWOCMVBNDHF-UHFFFAOYSA-N	449.489	1.439	50	20	IDGD	
C[C@@H]1CC(C)(C)C[C@@]2(C1)NC(=O)N(CC(=O)NNC(=O)c1cc(Cl)ccc1O)C2=O	105349512	OIXGZDFXFFVWPL-BIBXISHDSA-N	436.896	1.943	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)[C@@H]1CCN(c2ccc(Cl)c(Cl)c2)C1=O	725740712	IGSMPQLHBQXJOS-NSHDSACASA-N	439.255	1.517	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2ccncc2)nnn1C1CCN(C(=O)OC(C)(C)C)CC1	726155158	HUYCSSOLWFGTPF-UHFFFAOYSA-N	429.481	1.628	50	20	IDGD	
C[C@H](NC(=S)NNC(=O)N[C@H]1CCS(=O)(=O)C1)c1ccc(Cl)cc1Cl	726476208	GXIBCPVXQULOPU-WPRPVWTQSA-N	425.363	1.920	50	20	IDGD	
COC(=O)Nc1cccc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1	728656905	NSGJMFWZZBFKTK-MRXNPFEDSA-N	429.385	1.009	50	20	IDGD	
Cc1nc2[nH]n(C)c(=O)c2c(C)c1CCC(=O)NNC(=O)c1ccc2c(c1)OCCO2	729259079	HNCFZNIMDVGYLQ-UHFFFAOYSA-N	425.445	1.043	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)Cc3c(C)nc(-c4ncccn4)nc3O)n[nH]2)cc1	729519959	DWLFVMJYUJATPP-UHFFFAOYSA-N	444.455	1.650	50	20	IDGD	
COc1ccc(Cl)cc1CC(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	730031397	NDCOZDXSRAIZHZ-QGZVFWFLSA-N	434.832	1.422	50	20	IDGD	
Cn1nc(SCC(=O)NN=Cc2ccc(-n3cnc4ccccc43)cc2)c(=O)n(C)c1=O	730571832	UPXWNTYVRUYZOQ-UHFFFAOYSA-N	449.496	1.060	50	20	IDGD	
COc1ccc([C@@H](CNC(=O)NNC(=O)COc2ccccc2O)N2CCCC2)cc1	730901091	BVISTFZXSHQSAO-GOSISDBHSA-N	428.489	1.947	50	20	IDGD	
CCc1c(C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)nnn1-c1cccc(Cl)c1	731454283	PEWFPKUQPAPTAN-UHFFFAOYSA-N	447.904	1.961	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2C[C@@H](C)O[C@H](C)C2)c1	731491218	FKQYGPJZVVQNES-HUUCEWRRSA-N	447.513	1.568	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)C(=O)N1CCCC1)Sc1ccc(Br)cc1	731762661	JFNUGQHGISZJMG-LLVKDONJSA-N	429.340	1.883	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)COc2cccc(NC(=O)c3ccco3)c2)C[C@H](C)O1	732264553	VILLUQMJTSCDCD-HOTGVXAUSA-N	444.488	1.557	50	20	IDGD	
CCC[C@@H](NC(=O)Cc1ccccc1)C(=O)NNC(=O)c1nn(CC)c(=O)c2ccccc12	732653645	FJRDJBPRTBXGFB-LJQANCHMSA-N	449.511	1.705	50	20	IDGD	
Cc1ccc(S(=O)(=O)NC2CC2)cc1C(=O)NNc1nc2ccccc2c(=O)n1C	733261154	ZZTWGNIZTBLLOS-UHFFFAOYSA-N	427.486	1.440	50	20	IDGD	
C[C@H](OC[C@@H]1CCCCO1)C(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	734824842	JYVAKZZCVDDILW-HOCLYGCPSA-N	428.530	1.691	50	20	IDGD	
Cc1cccc([C@H](CNC(=O)NNC(=O)COCc2ccccc2)N2CCOCC2)c1	738450285	HWRDFRILNVXTGG-NRFANRHFSA-N	426.517	1.916	50	20	IDGD	
O=C(NNS(=O)(=O)c1cnn(-c2ccccc2F)c1)c1nnc(-c2ccccc2)o1	742028557	SIDUOKKTSCUWKF-UHFFFAOYSA-N	428.405	1.685	50	20	IDGD	
CC(C)(NS(C)(=O)=O)C(=O)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1	742059877	OYLOBHCWPLKKST-IBGZPJMESA-N	444.557	1.089	50	20	IDGD	
CN(CCCC(=O)NNc1nc(-c2ccncc2)no1)C1=NS(=O)(=O)c2ccccc21	742062495	PSWFUEZSQGYULE-UHFFFAOYSA-N	441.473	1.436	50	20	IDGD	
CCCn1nc(C(=O)NNS(=O)(=O)c2ccc(C(=O)O)c(F)c2)c2ccccc2c1=O	742231348	ALHRHGOYELUCKB-UHFFFAOYSA-N	448.432	1.267	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)CCCOc2cccnc2)c1	742465631	ROXVZZOWHXYNGQ-UHFFFAOYSA-N	434.518	1.732	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)Cc3cccc([N+](=O)[O-])c3)cc2)CC1	743333983	BUWZOCXENDQTMI-UHFFFAOYSA-N	433.490	1.217	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)[C@@H]2CCSc3ccccc32)CC1	743419981	RJCACLKPCVSBGI-MRXNPFEDSA-N	447.586	1.740	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2ccc(-c3ccco3)nc2O)cc1	743738001	OWCLDUAYBHDRJP-UHFFFAOYSA-N	444.469	1.437	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccc(F)cc3Cl)CC2)c1	744395018	OHVKVKJWIPZOEE-UHFFFAOYSA-N	443.866	1.570	50	20	IDGD	
O=C(C[C@H]1OC(=O)c2ccccc21)NNc1ccccc1S(=O)(=O)N1CCOCC1	744621729	OSNWMTHRGROUGQ-QGZVFWFLSA-N	431.470	1.452	50	20	IDGD	
O=C(NNC(=O)c1sccc1S(=O)(=O)N1CCCC[C@H]1CCO)c1ccccc1	745475232	BFZLGCZSHZIWIL-HNNXBMFYSA-N	437.543	1.749	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@H]2C[C@]2(C)c2ccccc2)cc1	745858138	XYOAIDZFFDRZEW-GHTZIAJQSA-N	430.530	1.676	50	20	IDGD	
CSC1(CNC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)CCOCC1	745868756	QQSIPDNFIUBTQL-UHFFFAOYSA-N	435.594	1.441	50	20	IDGD	
Cc1ccc(C)n1-c1ccc(C(=O)NNC(=O)N[C@H]2CCCN(c3ccn(C)n3)C2=O)cc1	745883589	QESVCEADYSQHLJ-IBGZPJMESA-N	449.515	1.967	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1	746555883	IQERVAHYCJQVFA-ZDUSSCGKSA-N	442.457	1.299	50	20	IDGD	
CN1C(=O)C[C@H](C(=O)NNC(=O)Cc2cn3ccccc3n2)[C@H]1c1cccc(Cl)c1	746556254	OYQGLVHPVFLSLN-OXJNMPFZSA-N	425.876	1.897	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NNC(=O)c1ccc(C#N)cc1	747102254	JYWKHNOPKXSKBD-LLVKDONJSA-N	446.261	1.763	50	20	IDGD	
COc1ccc(Br)c(S(=O)(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1	747596247	LDFCPKWQKJTNAO-AWEZNQCLSA-N	443.275	1.607	50	20	IDGD	
Cc1c(C(=O)NNC(=S)Nc2ccccc2C(C)C)cnc2c1c(=O)n(C)c(=O)n2C	748077459	RUBSWDSREUTHMG-UHFFFAOYSA-N	440.529	1.695	50	20	IDGD	
O=C(CN1CCC[C@@H](CN2CCN(c3ccccn3)CC2)C1)NNC(=O)c1cccs1	748320058	YWEBOWFQMCZONF-SFHVURJKSA-N	442.589	1.438	50	20	IDGD	
N=[S@](=O)(O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Br)s2)cc1	748555311	OSAKAVCNDZCUIA-UHFFFAOYSA-N	447.292	1.789	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)[C@@H]2CCCN2C(=O)c2ccc3c(c2)OCO3)cc1	749506212	YEUVXJFPMYWZOV-SFHVURJKSA-N	439.468	1.809	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2c(C)noc2C(F)(F)F)cc1OC	750493637	YCZZQOJEZZSLML-UHFFFAOYSA-N	431.323	1.637	50	20	IDGD	
COc1cc(OC)cc(N2C[C@H](C(=O)NNC(=O)COc3ccccc3F)CC2=O)c1	752399027	DYIDGHHVDKLDQZ-CYBMUJFWSA-N	431.420	1.422	50	20	IDGD	
CN(CC(=O)NNc1nc2ccccc2c(=O)n1C)S(=O)(=O)c1ccc(Cl)cc1	752905869	BVGCLTYUUQFBBT-UHFFFAOYSA-N	435.893	1.351	50	20	IDGD	
CCOc1ccc(C(=O)NCC(=O)NNc2nc3ccccc3c(=O)n2C)cc1OCC	752906407	ISEPQUAZDSAZAG-UHFFFAOYSA-N	439.472	1.604	50	20	IDGD	
COCCOc1ccccc1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	756211621	DAIIXELBLMYWNI-UHFFFAOYSA-N	436.490	1.429	50	20	IDGD	
CS(=O)(=O)c1ccccc1-n1cc(NC(=O)NNC(=O)COc2ccc(F)cc2)cn1	756707290	UVOJSVPDSNTNSA-UHFFFAOYSA-N	447.448	1.647	50	20	IDGD	
C[C@@H](NC(=O)OC(C)(C)C)c1ccc(NC(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)cc1	756816686	TUENOQINMMFHTD-OCCSQVGLSA-N	440.522	1.860	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCCCO[C@H]1CCOC1	756915841	CKMVOJFCKJAMHW-WFASDCNBSA-N	430.299	1.742	50	20	IDGD	
CCn1nc(C)c(NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1C	757871772	MAVPPRZJDNGIEX-UHFFFAOYSA-N	434.522	1.771	50	20	IDGD	
CCOC(=O)[C@@H]1CCC(=NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)C[C@H]1C	758120202	XQZNXPVZXYWYGB-YLJYHZDGSA-N	428.533	1.916	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1cccc([N+](=O)[O-])c1Br	758287050	VFHLJSYDGSQSAB-UHFFFAOYSA-N	449.265	1.825	50	20	IDGD	
Cc1nn(Cc2ccc(F)cc2)c(Cl)c1C(=O)NNC(=O)C(=O)Nc1ccccn1	758839751	LZOSKGGSASCGJE-UHFFFAOYSA-N	430.827	1.827	50	20	IDGD	
O=C(NNC(=O)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1)C(=O)Nc1ccccn1	758841354	ZBFXPXGOLGGYBJ-IBGZPJMESA-N	435.406	1.622	50	20	IDGD	
CCOc1nc(C(F)(F)F)ccc1C(=O)OCC(=O)NNC(=O)c1ccc(C#N)cc1	759290090	LVTJEGIJJDKOKD-UHFFFAOYSA-N	436.346	1.989	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1cccc(OCC(F)F)n1	760263355	OFFIKVPLODGRAB-UHFFFAOYSA-N	427.433	1.402	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)c1ccc(Cl)c(NS(C)(=O)=O)c1	760451241	QYYIPIKYCAFEMM-UHFFFAOYSA-N	434.902	1.387	50	20	IDGD	
COC(=O)c1cn([C@@H]2CCN(C(=O)NNC(=O)c3c(Cl)cccc3Cl)C2)nn1	760671783	WVOKOTFGGGPNKX-SECBINFHSA-N	427.248	1.673	50	20	IDGD	
Cc1nn(C)c2ncc(NC(=O)C(=O)NNC(=O)COc3ccc(C(C)(C)C)cc3)cc12	763595528	SMHYRKIUXVTEMU-UHFFFAOYSA-N	438.488	1.739	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)[nH]n1)C(=O)Nc1cccnc1Br	763600198	FJORNHYUOFDOER-UHFFFAOYSA-N	429.234	1.634	50	20	IDGD	
CCNS(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2cc(OC)cc(OC)c2)cc1	763659494	TXVQAEPGFANXHU-UHFFFAOYSA-N	436.490	1.146	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)C(=O)Nc1ccc(N2CCCC2=O)c(F)c1	763682022	UVRXRQWABVRBJN-UHFFFAOYSA-N	432.383	1.257	50	20	IDGD	
CCCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2CC)cc1	763714420	VPZVETRMOBSCIM-UHFFFAOYSA-N	426.473	1.554	50	20	IDGD	
Cc1cccc(NC(=O)C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1Cl	763717818	AHAUSKLCYZQXIH-UHFFFAOYSA-N	438.893	1.298	50	20	IDGD	
CN1C(=O)COc2ccc(NC(=O)C(=O)NNC(=O)C34CC5CC(CC(C5)C3)C4)cc21	763724043	VJEIHNVVNNINDZ-UHFFFAOYSA-N	426.473	1.344	50	20	IDGD	
O=C1C[C@H](c2cccc(NC(=O)C(=O)NNC(=O)CC34CC5CC(CC(C5)C3)C4)c2)CN1	763735972	PTXUBAXXVXIJSE-XHBUVVKHSA-N	438.528	1.983	50	20	IDGD	
CC(C)Cn1ncc(NC(=O)C(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])c1C(C)C	763805642	UHZKXPJXOIJFCJ-UHFFFAOYSA-N	446.464	1.736	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(F)c(S(C)(=O)=O)c(F)c2)cc1	763831268	HZFGRYNLIYMECD-UHFFFAOYSA-N	425.413	1.330	50	20	IDGD	
Cc1nc(-c2ccccc2NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)no1	763864074	FPWXQPBPVAIAPA-NSHDSACASA-N	427.392	1.738	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccn(-c3ccncc3)n2)cc1	763876479	DYYKNRGRTLSXQS-AWEZNQCLSA-N	436.428	1.023	50	20	IDGD	
CC(C)CC(=O)NNC(=O)C(=O)Nc1ccc(CN2CCN(c3ccccn3)CC2)cc1	763882397	OEMPPSJWXBVEFY-UHFFFAOYSA-N	438.532	1.536	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccn(Cc3ccccc3)n2)cc1OC	763901156	GJRCJYFUYJKOIL-UHFFFAOYSA-N	437.456	1.738	50	20	IDGD	
CC[C@@H](C)C(=O)NNC(=O)C(=O)Nc1cnc2c(c1)C[C@@H](NC(=O)OC(C)(C)C)CC2	764082482	NQIQOCAUAZKXAN-OCCSQVGLSA-N	433.509	1.596	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc(C)c(-n4cnnn4)c3)n[nH]2)cc1	764111625	PEKOZJFJXBELIP-UHFFFAOYSA-N	445.443	1.069	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc(-n4ccnc4)nc3)n[nH]2)cc1	764111803	TYVCIICHADLOMA-UHFFFAOYSA-N	430.428	1.366	50	20	IDGD	
CCCCOC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)cc1	764152327	QWIVLCQNANOALB-SFHVURJKSA-N	425.441	1.733	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)C(=O)Nc2cccc([N+](=O)[O-])c2)c1	764231263	GIBPYKOJVSNDFW-UHFFFAOYSA-N	437.206	1.766	50	20	IDGD	
O=C(Cc1ccccn1)NNC(=O)C(=O)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1	764270740	SQLRADTYRAHVFW-IBGZPJMESA-N	447.499	1.054	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C(=O)Nc1cccc(NC(=O)[C@H](C)OC)c1)c1ccccc1	764327844	GHVMSIAXHDMOIW-KSSFIOAISA-N	426.473	1.940	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc(OC)c1OC	764352058	YLUCAYIBBZKSFF-UHFFFAOYSA-N	439.428	1.298	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccncc2)cc1OCc1ccncc1	764355761	HSSGHBSFWQULJM-UHFFFAOYSA-N	435.440	1.393	50	20	IDGD	
CCNS(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2cc(Br)c[nH]2)cc1	764373745	NEVNFPVMRKCGAO-UHFFFAOYSA-N	444.311	1.220	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)c(F)cc1F	764379591	FQXSDYOLLUJKPE-UHFFFAOYSA-N	443.309	1.509	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)C(=O)Nc1ccccc1-n1cc(Br)cn1	764386488	YTMIZBFJNUHVMK-UHFFFAOYSA-N	443.261	1.738	50	20	IDGD	
CC(C)C(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)c1	764401140	LNYRPTXQURADAT-UHFFFAOYSA-N	430.486	1.865	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1)N[C@@H]1CCS(=O)(=O)C1	764873807	IENAFJUTJWLTLO-CQSZACIVSA-N	447.473	1.338	50	20	IDGD	
CC(C)CNC(=O)N1CCC[C@@H](C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)C1	765313294	KFOAJWRFYSPYJN-OAHLLOKOSA-N	427.546	1.516	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)CSc1nnc(-c2cccnc2)n1Cc1ccco1	765441467	LFPSBBOJBKGKSZ-UHFFFAOYSA-N	438.473	1.566	50	20	IDGD	
Cc1ccc(CC(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)c(Cl)c1	765738149	IRZVKNFXQWFFEG-UHFFFAOYSA-N	428.920	1.796	50	20	IDGD	
Cn1nnc2cc(C(=O)NNC(=O)CN3CCN(Cc4ccc(Cl)cc4)CC3)ccc21	765751427	KZHFLRZBTKUMMX-UHFFFAOYSA-N	441.923	1.201	50	20	IDGD	
CCS(=O)(=O)c1ccc(F)c(C(=O)OCC(=O)NNC(=O)Cc2ccccc2C)c1	767348480	VRJMAKHQDXVNTN-UHFFFAOYSA-N	436.461	1.475	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)[C@H]3CCCN(C(=O)C4CC4)C3)n[nH]2)cc1OC	768278477	HJRHVRCXTFMMNX-HNNXBMFYSA-N	441.488	1.504	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NC2CC(OCc3ccccc3)C2)c1	768449181	PXHUKHKINQBUCZ-UHFFFAOYSA-N	446.529	1.629	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)Cc2ccccc2I)C[C@@H](C)O1	771534945	FNMVIRVCHOBVLH-CHWSQXEVSA-N	445.301	1.480	50	20	IDGD	
CC(=O)Nc1cc(S(=O)(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)ccc1F	771605110	OVULWCXUCKHMCA-UHFFFAOYSA-N	442.856	1.063	50	20	IDGD	
NC(=O)c1cc(OC2CCN(C(=O)NNC(=O)Cn3ccc4ccccc43)CC2)ccn1	771976875	IVPSRDUBRBSQBV-UHFFFAOYSA-N	436.472	1.419	50	20	IDGD	
O=C(CCCNC(=O)NC1CCCCC1)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772193535	WDLJTXDLWDUSCL-UHFFFAOYSA-N	437.928	1.516	50	20	IDGD	
Cc1ccc(-n2nccc2NC(=O)C(=O)NNC(=O)C2=S=C3CCCCCC3=C2)nn1	773498557	ASJCEDJKJGQLTJ-UHFFFAOYSA-N	439.501	1.039	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(N3C[C@H](C)O[C@@H](C)C3)nc2)cc1F	773886441	WNGZJPMHTPMDGL-KBPBESRZSA-N	429.452	1.542	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cnn(C)c2-c2ccccc2)c1	775521676	XVDIRFHCXHTHKJ-UHFFFAOYSA-N	427.486	1.412	50	20	IDGD	
CN(NC(=O)c1cncc(N2CCOCC2)c1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776201206	GSYHFQKMDMDQDE-UHFFFAOYSA-N	448.524	1.168	50	20	IDGD	
CCOC(=O)N1CCC[C@@H]([C@H](C)NC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)C1	776934444	GZJKYOYYUNWHTD-LSDHHAIUSA-N	444.492	1.779	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)CC1	777088124	OSLHTVIVICCKIX-QGZVFWFLSA-N	435.477	1.390	50	20	IDGD	
CCOc1ccccc1C(=O)N1CCC[C@H]1C(=O)NNC(=O)CNC(=O)OC(C)(C)C	778437061	UBAMLTQLVOBZCJ-HNNXBMFYSA-N	434.493	1.362	50	20	IDGD	
CC[C@H](NC(=O)NNC(=O)CNC(=O)OC(C)(C)C)[C@H]1CN(Cc2ccccc2)CCO1	778699335	FIGKFSJEMOYVHM-ZWKOTPCHSA-N	449.552	1.521	50	20	IDGD	
CN(C)C(=O)COc1ccccc1C(F)(F)C(=O)NNC(=O)COCc1ccccc1	778772659	JSOGXNYEYNFRCS-UHFFFAOYSA-N	435.427	1.610	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3c(N)cccc3[N+](=O)[O-])CC2)cc1	779535115	VSQDQNDZTSZXBA-UHFFFAOYSA-N	426.477	1.064	50	20	IDGD	
COC(=O)c1ccccc1NNC(=O)[C@H]1CN(Cc2nc(O)c3ccccc3n2)CCO1	780731419	IFOHGOLDVLTUKL-GOSISDBHSA-N	437.456	1.466	50	20	IDGD	
C[C@@]1(c2ccc(F)c(Cl)c2)NC(=O)N(CC(=O)NNc2ncncc2Cl)C1=O	781834433	ZGVXGVSHKBZAKP-INIZCTEOSA-N	427.223	1.833	50	20	IDGD	
CCOc1cc(N2CCOC(C)(C)C2)ccc1NC(=O)C(=O)NNC(=O)CC(F)(F)F	782117910	UKXHYCTUEYNGBT-UHFFFAOYSA-N	446.426	1.739	50	20	IDGD	
Cc1ccc(C(=O)NCC(F)(F)F)cc1NC(=O)C(=O)NNc1ncncc1Cl	782165695	KGPLRXAMKCYITF-UHFFFAOYSA-N	430.774	1.812	50	20	IDGD	
Cc1c(/C=C(\C#N)C(=O)O[C@H](C(=O)N[C@]2(C)CCS(=O)(=O)C2)C(C)C)cc(C#N)n1C	782628187	VUNIRPPFVOMRCZ-AFGJARKTSA-N	446.529	1.373	50	20	IDGD	
CNC(=O)CCOc1ccc(NC(=O)C(=O)NNc2ncccc2C(F)(F)F)cc1	783120853	RUFMRNZZKPTMPI-UHFFFAOYSA-N	425.367	1.697	50	20	IDGD	
CCc1cccc(CC)c1NC(=O)C(=O)NNc1ccc(S(=O)(=O)NC(C)C)cn1	783262468	DHRDNQSGRQWNOQ-UHFFFAOYSA-N	433.534	1.975	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNc2cc(C)nc(C)n2)c(Br)cc1F	783324789	BZBJHYNEHRRVSY-UHFFFAOYSA-N	440.229	1.863	50	20	IDGD	
Cc1c(NNC(=O)C(=O)Nc2ccc(CCN3CCOCC3)cc2)cccc1[N+](=O)[O-]	784355641	XCHHXIVTBTUVHR-UHFFFAOYSA-N	427.461	1.860	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc(C)nc3N(C)C)n[nH]2)c1	785125818	HSTVNJWYARQLFL-UHFFFAOYSA-N	435.488	1.863	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)C(=O)Nc3cnn(-c4ccccc4)n3)n[nH]2)c1	785131566	ZYMALTRODRAPKF-UHFFFAOYSA-N	444.455	1.674	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NCc2ncnn2-c2ccccc2)cc1	787347153	XJVGAIBXATWLLF-UHFFFAOYSA-N	429.462	1.207	50	20	IDGD	
Cc1cccnc1C(F)(F)C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	787404362	QFNYEVLYZQEEBZ-UHFFFAOYSA-N	426.445	1.646	50	20	IDGD	
CC(C)N(C)S(=O)(=O)c1cccc(C(=O)NNc2ccccc2S(N)(=O)=O)c1	788230767	WOPQZGKYLFUAPS-UHFFFAOYSA-N	426.520	1.120	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2cc(Br)c(F)cc2C)n1	789584890	UCQPCXLOBYTVMW-UHFFFAOYSA-N	426.246	1.496	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1nc2c(s1)CCCCCC2	789731672	IDWRZZKZLABBNW-UHFFFAOYSA-N	432.502	1.976	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2nc(C(C)(C)C)cs2)nc1	789746277	KDJYFJJSPBGKJR-UHFFFAOYSA-N	440.551	1.604	50	20	IDGD	
Cc1cccc(=O)n1C[C@](C)(O)C(=O)NNC(=O)c1ccc(COc2ccccc2)o1	792024539	NPFGIRACQCQPTB-QFIPXVFZSA-N	425.441	1.541	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2c3c(nn2-c2ccc(Cl)cc2)CCC3)n1	792273688	OYMRMPPKRZMVBB-UHFFFAOYSA-N	427.852	1.895	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNc2nc3ccccn3n2)cccc1C(=O)N1CCSCC1	792393042	CZCJEYXAAGYWSM-UHFFFAOYSA-N	439.501	1.309	50	20	IDGD	
Cc1ncsc1C(=O)NNC(=O)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1	793026724	UDSGZLAZLKDLKM-UHFFFAOYSA-N	428.224	1.522	50	20	IDGD	
CC(C)c1ccccc1NC(=S)NNC(=O)[C@@](C)(O)CN1C(=O)NC2(CCCC2)C1=O	793990155	WXPUWKSBMCZAPN-FQEVSTJZSA-N	447.561	1.743	50	20	IDGD	
CC(C)(C)C(=O)N1CSC[C@H]1C(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	802065601	GMXQHYZMFXCOGS-ZDUSSCGKSA-N	428.536	1.190	50	20	IDGD	
COc1cc(CCNC(=O)NNC(=O)COc2cccc(C)c2)c([N+](=O)[O-])cc1OC	806971129	URFWUXRXTYLSJX-UHFFFAOYSA-N	432.433	1.872	50	20	IDGD	
N#Cc1ccc(NC(=O)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1Br	806972639	ZZCVDPUQSZRBLN-UHFFFAOYSA-N	432.190	1.629	50	20	IDGD	
N#Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1Br	806976418	DRKOJTPBINSICC-UHFFFAOYSA-N	445.229	1.492	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)C(=O)Nc1cccc(I)c1	807429257	QJGDLNFOGNRPOB-UHFFFAOYSA-N	449.212	1.349	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)NC1CCC2(CC1)NC(=O)NC2=O	807545565	XFHSDOBEANLXKR-SGAKZGHJSA-N	439.472	1.458	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)Nc2ccc(C(N)=O)cc2OCC(F)F)cc1	810303040	ZJBBROAFGMBLIE-UHFFFAOYSA-N	438.387	1.670	50	20	IDGD	
C[C@@H]1Oc2ccccc2[C@H]1NC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	812429967	BUZGDJUDYWYAHX-LIRRHRJNSA-N	444.513	1.937	50	20	IDGD	
CN(C/C=C/C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)CC(F)(F)F	814361299	UFYBWEABNAYYDV-VMPITWQZSA-N	448.467	1.282	50	20	IDGD	
O=C(NNC(=O)c1cnc(OC2CCCCC2)c(Cl)c1)N[C@@H]1CCS(=O)(=O)C1	815103205	WNAOVZNTIJNCHD-GFCCVEGCSA-N	430.914	1.578	50	20	IDGD	
CC(C)(C)c1csc(NC(=O)C(=O)NNC(=O)CNC(=O)c2cccs2)c1C#N	815593460	MTXFZEPXDUOEKG-UHFFFAOYSA-N	433.515	1.495	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2cccc(Cl)n2)cc1	815728835	WHYNQOWNQQOZGI-UHFFFAOYSA-N	425.898	1.847	50	20	IDGD	
CCn1c(=O)n(CC(=O)NNC(=O)[C@H]2CCCN(C(=O)OC(C)(C)C)C2)c2ccccc21	816509831	DBBRANIMISKYRN-HNNXBMFYSA-N	445.520	1.617	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NNC(=O)Cn2cnc(-c3ccccc3)n2)C1	819659312	UJVXTSKRQZTMDS-MRXNPFEDSA-N	428.493	1.740	50	20	IDGD	
C=CCn1c(S)nc2cc(C(=O)NNC(=O)CNc3cccc(OC)c3)ccc2c1=O	825791534	OOXLTAIYZCBXGU-UHFFFAOYSA-N	439.497	1.753	50	20	IDGD	
Cc1c(/C=C(\C#N)C(=O)N2CCN(Cc3cc(=O)n4ccsc4n3)CC2)cc(C#N)n1C	843495560	QWOSJKVIZZMJLF-RQZCQDPDSA-N	447.524	1.526	50	20	IDGD	
O=C(CN1CCCN(C(=O)c2ccccc2F)CC1)NNC(=O)c1ccc([N+](=O)[O-])cc1	913148580	XKNRYUMVADRUFO-UHFFFAOYSA-N	443.435	1.343	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)COc2ccc(C#N)cc2)c1	914749059	YPQMMLMMDHTAOB-UHFFFAOYSA-N	434.449	1.224	50	20	IDGD	
C[C@]12CCC(=O)N1c1ccccc1C(=O)N2CC(=O)NNC(=O)c1ccc2ccccc2n1	914831982	ZDZDXRNIYOJPRN-XMMPIXPASA-N	443.463	1.995	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)[C@H]2CC(=O)N(Cc3ccccn3)C2)c2ccccc2c1=O	914879054	XQOQRXDESZGELA-HNNXBMFYSA-N	448.483	1.011	50	20	IDGD	
CN1CCN([C@H](CNC(=O)NNC(=O)COc2ccc(C#N)cc2)c2cccs2)CC1	915900980	ASRAVXJIGYELBJ-GOSISDBHSA-N	442.545	1.318	50	20	IDGD	
CN(C)c1ccc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cn1	916444234	NILMOSOTGNOZDJ-UHFFFAOYSA-N	446.533	1.076	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)N[C@@H](CN2CCCC2=O)c2ccccc2)c2ccccc2c1=O	916459974	SNHBLQXFXULXPO-SFHVURJKSA-N	448.483	1.241	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)NCCNS(=O)(=O)Cc1ccccc1	916517527	XOAWTTBALROKNY-AWEZNQCLSA-N	438.481	1.043	50	20	IDGD	
CCCCNC(=O)c1ccc(CNC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1	916639193	QOTXJNULLJUTCG-UHFFFAOYSA-N	436.476	1.336	50	20	IDGD	
Cc1nc(-c2ncccn2)sc1C(=O)NNC(=O)c1csc(N2CCOCC2)n1	917917553	CITOPVQIDSMMEU-UHFFFAOYSA-N	431.503	1.276	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)[C@H]2CCCN(S(=O)(=O)c3c(C)noc3C)C2)c(O)c1	918337854	VXMRPBHFZMAELB-AWEZNQCLSA-N	436.490	1.167	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)c2c([N+](=O)[O-])c(C)nn2C)cc(OCC)c1OCC	918758441	QCYIEAIXFYLZKV-UHFFFAOYSA-N	435.437	1.908	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)c2cc(Br)c3c(c2)OCO3)c2ccccc2c1=O	919805879	XVMBEKNHAORKIT-UHFFFAOYSA-N	445.229	1.500	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Nc2cccc(N3CCNC3=O)c2)cc(OC)c1OC	919897042	VEFITEHKMPQNCP-UHFFFAOYSA-N	429.433	1.709	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCc2nc(Cc3ccccc3)no2)cc(OC)c1OC	921124944	WJFWBFVRSRPUHC-UHFFFAOYSA-N	441.444	1.830	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1cc(=O)n(C)c2ccccc12	1115882651	GZJOGBUETIKGTR-UHFFFAOYSA-N	443.843	1.819	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN(C(=O)CCOc2ccccc2)C1)c1n[nH]c2c1CCCC2	1317953114	HWFTXNNBHYONTH-MRXNPFEDSA-N	439.516	1.757	50	20	IDGD	
Cc1c(NC(=O)CSCC(=O)N2CC=C(C#N)CC2)c(=O)n(-c2ccccc2)n1C	1319938827	FDDHHKSRKJVFIW-UHFFFAOYSA-N	425.514	1.838	50	20	IDGD	
CC(=O)N(C)[C@@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)CBr)C2	1778099825	PKNYEYVGALCJLC-QHHYFVSCSA-N	446.386	1.398	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc3ncnn3c2)C1	1779170255	UOZQRUXRWIDIMN-DYESRHJHSA-N	445.596	1.708	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](C)Nc3ccccn3)C2)C1	1779330699	MVFYNKHXOMLHPB-PMUMKWKESA-N	425.327	1.495	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)Nc2cnccn2)C1	1779393928	FMRMWZRPDZSWKX-QCBUCWTNSA-N	439.944	1.045	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccnc(Cl)n3)C2)C1	1779505568	WHOHSBWCBLUEBB-BZNIZROVSA-N	431.718	1.747	50	20	IDGD	
Cc1ccc(CCC(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)cn1	1781327020	WDZDMHBFSGJQFE-SJLPKXTDSA-N	428.302	1.843	50	20	IDGD	
O=C(c1ccc2nonc2c1)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781330070	PSVZYZIASOVPOK-BBRMVZONSA-N	427.230	1.357	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ncc(F)cc1F)C2	1782172004	JXUWHXBAYYNQAL-ZXYWRSMDSA-N	431.867	1.741	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccnc(Cl)n1)C2	1782175097	DMFUHANEHDAEKF-WPKBUWHJSA-N	431.320	1.511	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccnc(OC)c3F)CCO2)C1	1783342772	OKRIZGCCAHXQFK-FZKQIMNGSA-N	444.301	1.846	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(C)nn3CC)CCO2)C1	1783343354	UPIRFAQJWZSQHM-KDOFPFPSSA-N	427.343	1.828	50	20	IDGD	
COC(=O)C12CC(C(=O)N3CC[C@]4(CN(C(=O)[C@H](C)CBr)CCO4)C3)(C1)C2	1783440212	AFXMAKAQXFYAOP-LUPGOKSRSA-N	443.338	1.191	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3c(OC)cccc3OC)CCO2)C1	1783882624	QYTBQIBZVODCOT-VBKZILBWSA-N	426.897	1.401	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1CCC[C@H]3CCCC[C@@H]31)CCO2	1783934535	IQFWXNKTAGSYSZ-ZSTWQFLISA-N	448.608	1.796	50	20	IDGD	
Cc1nn(C)c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]3C2)c1F	1783969854	QEBYOQNNYMGGDC-SAXRGWBVSA-N	445.333	1.492	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cn3ccc4c(F)cccc43)C[C@@H]21)[C@@H](O)CCl	1784083893	HYMMKNQBVPOAMR-BMIPRAEKSA-N	437.899	1.360	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(-c4ccccc4)on3)C[C@@H]21)[C@@H](O)CCl	1784084165	MKRSRZREUIIZMN-MRHSLFKSSA-N	433.892	1.535	50	20	IDGD	
Cc1oc2cc(O)ccc2c1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]2C1	1784092155	IARSDZNSURZTTB-RPZXMPESSA-N	436.892	1.640	50	20	IDGD	
CC1CCN(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Br)C[C@@H]32)CC1	1784320092	GKLOLASSPUAXRZ-QBYUYEEZSA-N	434.350	1.389	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(CCN(C(=O)CCNC(=O)c3ccccc3)C2)C1	1785331774	BWVSRAZFWSFWFT-JOCHJYFZSA-N	447.608	1.488	50	20	IDGD	
CC(=O)N[C@H](Cc1cccc(F)c1)C(=O)N1CC[C@]2(CN(C(=O)[C@H](F)Cl)CCO2)C1	1785454264	LTWUCUYUHPCHIR-FUHIMQAGSA-N	443.878	1.237	50	20	IDGD	
CCS(=O)(=O)N[C@@H](C)C(=O)NC1(c2ccc(NC(=O)[C@H](O)CCl)cc2)CCC1	1786129460	MZHVNGMQPITWGW-SWLSCSKDSA-N	431.942	1.048	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](O)C(=O)NC1(c2ccc(NC(=O)[C@H](O)CCl)cc2)CCC1	1786135586	KDZFUNCXWPGNQW-ZBFHGGJFSA-N	441.912	1.563	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(-n4cnnc4)cc3)[C@H]2C1	1786769739	RPKVANMVNHRNST-WNHJNPCNSA-N	447.923	1.114	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc4nc[nH]c34)[C@H]2C1	1787297939	UOHFYVYCJCYBDQ-DSPQJCBJSA-N	435.322	1.940	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)C[C@@H]21)[C@@H](F)Cl	1787451243	CDWMNPSNOWBJTQ-GEMNDURDSA-N	428.844	1.331	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3nnc4cc(C)nn4c3C)[C@H]2C1	1787911144	HEOSPQHSAXOSET-NXOAAHMSSA-N	448.955	1.742	50	20	IDGD	
CN1CCC[C@@H](C(=O)NC2(c3ccc(NC(=O)c4ccc(B(O)O)cc4)cc3)CCC2)C1	1788144295	GNFUSZOKWKCRAV-GOSISDBHSA-N	435.333	1.456	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)c1ccnc(Cl)n1	1788876263	XJHZXMZARDPPCC-FSZOTQKASA-N	435.681	1.414	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)c1ccn(-c2ccccc2)n1	1789347479	IHFIYLOMIIFQLK-WQCNXYOZSA-N	432.908	1.065	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnn4cccc(C)c34)[C@H]2C1	1790507858	OCJPUKOLBYBYLG-OWLYRPNTSA-N	434.924	1.490	50	20	IDGD	
COc1ccc(COCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Cl)C[C@@H]32)cc1	1791386057	IMXRJOOQUWQDHF-PCODUJHASA-N	428.888	1.726	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccccc1N1CCCCC1)C2)[C@@H](O)CCl	1792980448	OVIYWGDGGBVOOY-JSJNYSNDSA-N	435.952	1.480	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](Br)Cc1ccccc1)C2)c1cnco1	1793566837	ISJWSFCUBVNIDB-KYHPRHEASA-N	448.317	1.884	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](O)c1ccccc1	1795377483	SSVGESPYIWSSQG-CMZRPVNOSA-N	425.323	1.341	50	20	IDGD	
Cc1cc2nc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3ccc(B(O)O)cc3)[nH]c2cc1C	1796188873	WHDZZTCOVSOTHZ-REPLKXPHSA-N	446.316	1.425	50	20	IDGD	
Cc1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)c(F)c1F	1796190519	HQBIQMFRHYPQET-BJWYYQGGSA-N	428.244	1.519	50	20	IDGD	
COc1ccc([N+](=O)[O-])c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](F)Br)C3)n1	1797211846	YZEVBNZWTZYECX-QOBXEIRBSA-N	445.245	1.941	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccn2ccnc2c1	1797446214	BBGMCKHGVLVNDC-QHHYFVSCSA-N	425.316	1.774	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccn(C(F)F)c1=O	1797994303	BCASRQJXEWRZBL-HNCHTBHHSA-N	448.264	1.230	50	20	IDGD	
Cc1nc2ccncc2cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCC(=O)NN(C)C)C2	1798018999	VFUVSSGZDANNEN-BCDXTJNWSA-N	438.532	1.563	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc2nc[nH]c2c1	1798066873	OVBVNDUPPXHBEW-FKDCUARVSA-N	447.499	1.949	50	20	IDGD	
Cc1noc(C)c1CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnccc1C(=O)NN	1798440669	HYHDIVWBMBEVPD-MUJYYYPQSA-N	440.504	1.175	50	20	IDGD	
Cc1c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CCBr)C3)cn2[nH]cnc(=O)c12	1799146896	BQYYZBZXTHKBCI-CLLJXQQHSA-N	436.310	1.368	50	20	IDGD	
COc1cccnc1CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Br	1799344415	LQOGVYZPEIRXJW-LZDSYCOUSA-N	444.301	1.303	50	20	IDGD	
Cc1ccn2ncc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@H](F)Br)c2c1	1799346745	ZVUAOXNUGSOLEQ-VZAMPYOESA-N	439.285	1.536	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)c1ccccc1Cl)C2)[C@H](F)Br	1799351896	FFIIBFDRLBIJNC-DTIWESFOSA-N	449.704	1.654	50	20	IDGD	
Cc1cc(C)n(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Br)n1	1799352297	OQTZHCHLPRIKKE-OCVGTWLNSA-N	431.306	1.170	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccn(-c2ccccc2)n1	1799427656	YMSFOQHAIJFIGU-GGPHIMKMSA-N	438.532	1.497	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cn3ccc(Cl)cc3n1)C2)C(Cl)Cl	1801014882	QELUUMBZHBVHAZ-WDAIWFPHSA-N	431.707	1.995	50	20	IDGD	
Cc1ccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C(Cl)Cl)cc1[N+](=O)[O-]	1801017296	KFICOMDBFFGNLJ-YWVIFJGQSA-N	430.288	1.839	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1c(-c3ccncn3)noc1C)C2	1802279052	KOSSENZFZPCNRV-LXTVHRRPSA-N	433.896	1.946	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)C1CC(F)(F)C1	1802632645	OOSAHMKUHPKSGR-APWZRJJASA-N	443.259	1.126	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc3nonc3c2)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803139718	UGMMSCITPVXBRK-JCGIZDLHSA-N	429.864	1.537	50	20	IDGD	
Cc1nccn1CCCC(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]1c1cccnc1	1803145531	DPCKHOLOULMANA-GGPKGHCWSA-N	433.940	1.672	50	20	IDGD	
C[C@@H](C#N)c1cccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)c1	1803679327	PMIGCHYSUGMNFU-RWXMBLCBSA-N	431.301	1.559	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)CCNC(=S)NC)[C@H]1c1cccnc1	1803692070	PFSHIOYFOCUZHE-BQFCYCMXSA-N	440.013	1.979	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)c1n[nH]c(C2CC2)c1F	1805124584	WZFNCMRKHHYFIS-SUNYJGFJSA-N	435.887	1.741	50	20	IDGD	
Cc1noc(C)c1C(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1805538579	SOVASYZDWFWNBQ-DYESRHJHSA-N	442.520	1.379	50	20	IDGD	
CC[C@H](C(=O)N1CCCC2(CCN(C(=O)CCC(=O)NN(C)C)CC2)C1)N(CC)CC	1806176324	LWHNBTNXBCBQHE-LJQANCHMSA-N	437.629	1.711	50	20	IDGD	
O=C(CC(F)(F)F)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1806835653	IQSDHFWWGULXDM-MAUKXSAKSA-N	435.211	1.033	50	20	IDGD	
N=C(N)SCCC(=O)NC[C@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1	1807122239	OBOYSYCLZUWXJM-CZUORRHYSA-N	442.383	1.889	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H](CNC(=O)[C@@H](F)Br)[C@@H]1c1cccnc1)n1cnnn1	1808681495	UNTHHFVOXYEJDQ-RUZUBIRVSA-N	440.277	1.026	50	20	IDGD	
N#Cc1ccc(F)c(C(=O)N2CCC3(CCCN(C(=O)c4ccc(B(O)O)cc4)C3)CC2)c1	1809969684	MBLYRNPHOPHIIZ-UHFFFAOYSA-N	449.291	1.536	50	20	IDGD	
Cc1ccc(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)cc1	1811960118	SVQTWKMIBNYEOU-JTHBVZDNSA-N	443.312	1.703	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2cc(F)c[nH]2)[C@@H]1c1cccnc1	1813072302	AHWZYVZVQIUTJY-FOIQADDNSA-N	430.484	1.241	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2cc(F)c[nH]2)[C@H]1c1cccnc1	1813072306	AHWZYVZVQIUTJY-QRWLVFNGSA-N	430.484	1.241	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)Cc3cccc(F)c3)sc2C1	1813881008	MHHUGDQLYQXKTR-OAHLLOKOSA-N	447.536	1.810	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1cc(C2CC2)on1	1814625382	ZXNPUAUNOQTVCQ-SFHVURJKSA-N	449.276	1.575	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](C)CC(N)=O)n[nH]1	1815291555	OOLUMCPDWHVSJZ-WZRBSPASSA-N	428.331	1.944	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)Cc3ccsc3)sc2C1	1815612527	FRQYXECJLMKRJR-ZDUSSCGKSA-N	435.575	1.732	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccnnc2)n[nH]1	1816386320	ZQQOHCZQTDZFFW-FCLYZYNOSA-N	449.475	1.640	50	20	IDGD	
C[C@]1(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)CC1(F)F	1817480054	XMPVSHFJBYZVKN-HNAYVOBHSA-N	432.236	1.441	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cn[nH]c3)sc2C1	1817554643	PBGFCVISGTZTNQ-FVXKHRDXSA-N	440.489	1.226	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](C)Nc2cnccn2)[nH]n1	1822370146	LFCMNIQZGSWPKN-KCQAQPDRSA-N	435.916	1.946	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)COc2ccccc2)[nH]n1	1822412956	LPYHSSTTXNLPTD-GOSISDBHSA-N	442.520	1.854	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)C#Cc2ccccc2)[nH]n1	1822412974	MERCYLYDZRUQRC-IBGZPJMESA-N	436.516	1.827	50	20	IDGD	
O=C(/C=N/O[C@@H]1CCCCO1)N1CCC([C@@H]2CCCCN2C(=O)[C@H](O)CCl)CC1	1824185734	GQPXJQZRXCCJGZ-MXWPQOHSSA-N	429.945	1.735	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc3cn[nH]c3cn1)CC2	1825999982	HNKJAFYWAMNWLT-GHMZBOCLSA-N	434.909	1.894	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H]3CCNC(=O)C3)sc2C1	1826228794	PRZJNUWGNUTBFC-AXFHLTTASA-N	443.367	1.755	50	20	IDGD	
CC1=C(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)CCO1	1827054981	RDDPOOFBFTVZCS-NRFANRHFSA-N	426.322	1.294	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)CC[C@@H]3CCOC3)sc2C1	1827329404	ORYPPIAOSXYITB-KGLIPLIRSA-N	437.566	1.245	50	20	IDGD	
CS(=O)(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)[C@H](F)Br)CC1	1830380905	CADFQSGMOSYFQV-HIFRSBDPSA-N	441.363	1.731	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)n1ccnc1)CCO2	1830985816	RUJKACVRVKHHPN-RLFYNMQTSA-N	443.342	1.074	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(Cl)nn3)C2)C1	1831650120	DCIWEGXJNWCUQJ-ACJLOTCBSA-N	431.320	1.608	50	20	IDGD	
C[C@@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1)n1cccc1	1832107231	DXXHSCPJULLGNB-AVRDEDQJSA-N	437.349	1.662	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3ccc4nccnc4c3)CC2)CC1)[C@H](O)CCl	1833310340	QVJLMSWYUZBSDD-HXUWFJFHSA-N	445.951	1.415	50	20	IDGD	
COc1cnc(C(=O)N2CCO[C@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)c(F)c1	1833628433	SRLDHPAEHUVSFE-HXUWFJFHSA-N	443.903	1.564	50	20	IDGD	
O=C(CC1CCCC1)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1	1834364901	SALIZPRBQMVVPS-UHFFFAOYSA-N	441.381	1.132	50	20	IDGD	
O=C(Cc1cscn1)NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1	1834841853	WOVLYDQMXNLFPX-INIZCTEOSA-N	447.374	1.948	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCC(N2CCC(NC(=O)CC(F)(F)C(=O)O)CC2)CC1	1835070634	MJZHDAJUROFLOV-UHFFFAOYSA-N	437.915	1.933	50	20	IDGD	
CN1CCC(C(=O)N2CCC(N3CCC(NC(=O)CO[Si](C)(C)C)CC3)CC2)CC1	1835834707	GFTUHRGOVDTCCH-UHFFFAOYSA-N	438.689	1.751	50	20	IDGD	
Cc1n[nH]c(C)c1C(=O)NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1835871988	GOTNLJSRCWMHGH-MRXNPFEDSA-N	444.349	1.902	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccc(F)cn3)CCO2)C1	1836035779	HOSJXKAPAKLUSL-SCLBCKFNSA-N	444.301	1.003	50	20	IDGD	
CC[C@H](Br)C(=O)NC1CCN(C2CCN(C(=O)Cn3ccnn3)CC2)CC1	1836542030	SWGWJJIUVVOLHE-INIZCTEOSA-N	441.374	1.023	50	20	IDGD	
O=C(c1n[nH]c(C2CC2)c1F)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836715312	PIHVXHNOKKLNPI-HNNXBMFYSA-N	442.919	1.638	50	20	IDGD	
O=C(CCBr)N1CCC(OC2CCN(C(=O)c3cc(O)ncn3)CC2)CC1	1836938977	RHGZYECIUYRUEX-UHFFFAOYSA-N	441.326	1.579	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)n1ccccc1=O)CCO2	1837681997	LJMGEQRNBUKDJD-XGHQBKJUSA-N	439.940	1.273	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCC(OC2CCN(C(=O)CN3CCCC3=O)CC2)CC1	1837809807	ZLKIAAFFXPCWFE-HXUWFJFHSA-N	448.391	1.844	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)NC(=O)OC(C)(C)C)C2)C1	1839141396	HACTWIDWFJQNAH-AUSJPIAWSA-N	447.960	1.373	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3(c4ccc(O)cc4)CC3)C2)C1	1839141500	KBPGNQWONDRNQL-RXVVDRJESA-N	436.936	1.898	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3nccc(Cl)c3OC)C2)C1	1839146383	NXMJOBIOVAXOSZ-DJJJIMSYSA-N	446.331	1.831	50	20	IDGD	
O=C(c1ccc(-n2cccn2)cc1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1839336981	CCTHRKHQIUUYKY-XLIONFOSSA-N	436.871	1.477	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cc(C)no3)C2)C1	1839962567	KSJJMGIWQGNHSO-QAPCUYQASA-N	444.326	1.155	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnoc3C)C2)C1	1839963892	ZQOPAGXUYDMBJX-YOEHRIQHSA-N	430.299	1.227	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)Cc3ccccc3)C2)C1	1840156010	MFWHCWBNKYPPJS-JLMWRMLUSA-N	438.952	1.575	50	20	IDGD	
O=C(C(Cl)Cl)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3Cc4ccccc4O3)C2)C1	1840188651	VYWNBCPLSWWYFP-HNAYVOBHSA-N	429.300	1.250	50	20	IDGD	
C[C@@H](O)[C@H](NC(=O)c1ccccc1)C(=O)N1CC2(CCCN2C(=O)C(C)(C)CCl)C1	1841224915	FZJDXYSWXRESLM-WBVHZDCISA-N	435.952	1.634	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC12CN(C(=O)[C@H]1ON=C(c3ccccc3)O1)C2	1841288033	VGAFOZPMMWFOAX-FZKQIMNGSA-N	436.306	1.956	50	20	IDGD	
O=C(CCc1ccccc1Cl)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843010785	CWPSGYJIWDJDET-UHFFFAOYSA-N	426.709	1.470	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)COc1ccccc1C)C2	1843415858	VMKWJGMNZRZTDD-KOEQRZSOSA-N	437.500	1.711	50	20	IDGD	
CCn1nc(C(=O)N2CC3(CCCN3C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)cc1C	1843416223	MPOFFSIOMZALCU-HZHRSRAPSA-N	425.493	1.162	50	20	IDGD	
Cc1c(Cl)cccc1C(=O)N1CC2(CCCN2C(=O)c2cnccc2C(=O)NN)C1	1844263241	JHQNHXIBUMKUPK-UHFFFAOYSA-N	427.892	1.778	50	20	IDGD	
COC(=O)C1(C(=O)N2CCCC23CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C3)CC1	1846016766	LRXPENPBGXRHPS-ZDUSSCGKSA-N	443.928	1.275	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)Cc2cccc(F)c2F)C1	1846084248	BLOXBGUAUHPWGU-UHFFFAOYSA-N	429.427	1.023	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)C1(O)CCN(C(=O)OC(C)(C)C)CC1	1847977585	DXSDEFQQEQVGAB-PMPSAXMXSA-N	443.972	1.968	50	20	IDGD	
Cc1cccc(NC(=O)CN(C)C(=O)NNC(=O)c2csc(N3CCOCC3)n2)c1C	9755818	RLIMMAWAYMBXFW-UHFFFAOYSA-N	446.533	1.521	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)[C@H]1CC(=O)Nc2cc(F)ccc21	12936231	YJCHRMGYLKKCIH-ZDUSSCGKSA-N	449.822	1.918	50	20	IDGD	
Cc1ccc(C)c(S(=O)(=O)NCCC(=O)NNC(=O)COc2ccc(C)c(C)c2)c1	17203536	OTHMBDZYEHYQHN-UHFFFAOYSA-N	433.530	1.815	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(\C#N)C(=O)NNC(=O)c2n[nH]c(=O)c3ccccc23)c1C	25351710	YJOXONYSKKSKPM-FBJMNJBLSA-N	448.483	1.917	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)c1ccc(COc2ccccc2)o1)N1C(=O)NC2(CCCC2)C1=O	726523272	MIGCWROVOXOOTO-AWEZNQCLSA-N	440.456	1.873	50	20	IDGD	
CC(C)c1ccccc1NC(=S)NNC(=O)CN1C(=O)c2ccccc2S1(=O)=O	727177927	KQHSTULUVYMJPO-UHFFFAOYSA-N	432.527	1.972	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)C[C@](O)(c2nc(C)cs2)C(F)(F)F)c1	728206546	UQGIHMQWSFOMSK-INIZCTEOSA-N	432.424	1.860	50	20	IDGD	
COc1cccc(N2CC[C@@H](NC(=O)NNC(=O)c3cc(OC)c(OC)c(OC)c3)C2)c1	728220063	AUAHVLWWRHQNME-OAHLLOKOSA-N	444.488	1.944	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)c1ccc2c(c1)CC(=O)N2C	728953604	IJDGBWHEPWOVNR-AWEZNQCLSA-N	437.504	1.304	50	20	IDGD	
C[C@H](c1ccc(-n2cncn2)cc1)N(C)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	728958610	BKHXVKPJNKYERZ-MRXNPFEDSA-N	449.519	1.708	50	20	IDGD	
COCCOc1cn(-c2ccccc2)nc1C(=O)NNC(=O)c1ccc2c(c1)OCCO2	729304772	DAJSXXSYSWLBSO-UHFFFAOYSA-N	438.440	1.744	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)NCCCN1CCC[C@H](C(N)=O)C1	729495261	SHDVKGWMADBCIR-INIZCTEOSA-N	444.561	1.650	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@@H]2CCN(c3ccc4c(c3)OCCO4)C2=O)cc1OC	730512291	LCXLDNVLGZWFIT-HNNXBMFYSA-N	441.440	1.289	50	20	IDGD	
Cc1occc1C(=O)Nc1nc(CC(=O)NNC(=O)COc2ccccc2O)cs1	730779616	APBHNYWPTGVOBF-UHFFFAOYSA-N	430.442	1.771	50	20	IDGD	
Cn1cc(/C=C\C(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)cn1	731532612	SSZQKMRHTGTYBW-HJWRWDBZSA-N	431.499	1.757	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cccnc2N2CCOCC2)cc1Br	732032815	HLVXRURQZHDUBM-UHFFFAOYSA-N	435.278	1.764	50	20	IDGD	
CCn1c(NNC(=O)[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])o2)nc2ccccc2c1=O	732055870	GCRMQZTXONIXHS-AWEZNQCLSA-N	440.416	1.666	50	20	IDGD	
CCOC(=O)c1ccc(C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)nc1C	732327361	GAYSUBYHJJHTHN-UHFFFAOYSA-N	430.373	1.093	50	20	IDGD	
COC(=O)CCCOc1ccc(CNC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1	734176372	ZRAFBQSEUJYWKR-LJQANCHMSA-N	443.456	1.689	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)c2ccc(Cl)cc2O)cc1C(=O)N(C)C	734416426	SOFINXYWWRMGAU-UHFFFAOYSA-N	427.866	1.379	50	20	IDGD	
Cc1cccnc1[C@@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)C(C)C	734676668	VMPHMDYKVRULAH-KRWDZBQOSA-N	433.534	1.982	50	20	IDGD	
COc1ccc(S(=O)(=O)C[C@H](C)C(=O)NNC(=S)Nc2ccc(OC)nc2)cc1	735122869	FFHIXEYLBXEUFK-LBPRGKRZSA-N	438.531	1.526	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2ccc(O)c(C(=O)NNC(=O)c3cnn(C)c3)c2)cc1	735445136	JIKNYJONYKEDFX-UHFFFAOYSA-N	445.457	1.010	50	20	IDGD	
CCCNC(=O)c1cccc(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)c1	741207435	MSSYDQHSNYBHJB-UHFFFAOYSA-N	438.893	1.202	50	20	IDGD	
CCOc1cc2c(cc1OCC)CN(CC(=O)NNC(=O)Cc1nc(C)cs1)CC2	741544688	DNCZBDYPAXQZJS-UHFFFAOYSA-N	432.546	1.997	50	20	IDGD	
CC(=NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1)c1ccc(S(C)(=O)=O)c(F)c1	741755438	DTWKSNXAKLAORG-UHFFFAOYSA-N	447.897	1.684	50	20	IDGD	
NS(=O)(=O)c1ccc(CCC(=O)NNC(=O)c2cccc(Br)c2)cc1	742770613	WYNKVHVAHYGANJ-UHFFFAOYSA-N	426.292	1.490	50	20	IDGD	
Cc1ccc(S(=O)(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1Br	743251346	QNTJLUBDPIFIFJ-UHFFFAOYSA-N	437.279	1.357	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NC[C@H](C)N2CCC(C)CC2)cc1	743340866	MXCRULLCPCEREJ-KRWDZBQOSA-N	439.582	1.066	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)c1cc(Br)ccc1O)N1C(=O)NC2(CCCC2)C1=O	743731275	NTEBTAKZSWWMDV-VIFPVBQESA-N	439.266	1.169	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCC[C@@H]2CN(C)C(=O)OC(C)(C)C)n1	744423191	FHGFIFBCZIRUMQ-CQSZACIVSA-N	425.555	1.473	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)N[C@@H]1CC(=O)N([C@@H]2C[C@H]2c2ccccc2)C1	745913777	CPHBVWTWGZYVFY-UKPHBRMFSA-N	439.428	1.401	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)C2=CCCCO2)c1	746092883	FLGZPVPSLVCRTG-UHFFFAOYSA-N	431.470	1.951	50	20	IDGD	
C[C@H](CN(C)C(=O)OC(C)(C)C)C(=O)NNC(=O)c1csc(N2CCOCC2)n1	746821302	HRNXLCJZXDPTTO-GFCCVEGCSA-N	427.527	1.244	50	20	IDGD	
CCc1cccc(C)c1NC(=S)NNC(=O)c1cnc2c(c1C)c(=O)n(C)c(=O)n2C	748049898	MJTCSCFFPIKWSP-UHFFFAOYSA-N	440.529	1.443	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc2c(c1)OCCCO2)NNC(=O)CCc1ccccc1	749851873	NQDBTAUGUKQPDI-UHFFFAOYSA-N	447.513	1.297	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc2c(c1)CCN2CC(=O)NNC(=O)c1ccc(F)cc1	749868703	WWBCFBJZOYHNRX-UHFFFAOYSA-N	448.520	1.680	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNS(=O)(=O)c1cnn(Cc2ccccc2)c1	751262703	QWUWZKLRBXRHAP-UHFFFAOYSA-N	430.486	1.719	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@](C)(C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)C1	751602617	RMIKCMHHSZREQA-HXUWFJFHSA-N	439.534	1.888	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)c2ccc(F)c(S(=O)(=O)NC)c2)cc1OC	752399768	WCYFFLMVGMCCSA-UHFFFAOYSA-N	439.465	1.606	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)N[C@H](CC(N)=O)C2CCOCC2)N(C)c2ccccc21	752709643	ZTNMDTLYYIICJQ-QGZVFWFLSA-N	439.516	1.444	50	20	IDGD	
CC[C@H](NC(=O)NNC(=O)c1cc(C)n(-c2ccccc2)c1C)C(=O)N1CCOCC1	753059673	VHEDKSQLMKTALK-IBGZPJMESA-N	427.505	1.676	50	20	IDGD	
CCS(=O)(=O)N1CCC(CNC(=O)/C(C#N)=C/c2cc(C)n(CCOC)c2C)CC1	754752422	LGNLWIWYXBOSCC-DEDYPNTBSA-N	436.578	1.836	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2ccc(S(=O)(=O)CC)cc2)c2ccccc2c1=O	755598712	LZFAAMBFMMDPHB-UHFFFAOYSA-N	443.485	1.677	50	20	IDGD	
COC(=O)[C@H](CO)NC(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccc(Cl)cc1	755862347	OQSSUNCZMCZRKZ-ZGUWOUCSSA-N	427.848	1.674	50	20	IDGD	
O=C1CN(c2ccc(NC(=O)NNC(=O)c3ccc4c(c3)OCO4)cc2Cl)CCN1	755938563	TZVIXFPNHBUUIZ-UHFFFAOYSA-N	431.836	1.471	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)cc(F)c1F	755955397	GMSCDJZPHMMPLQ-UHFFFAOYSA-N	441.412	1.316	50	20	IDGD	
O=C(CCSc1ccc(F)cc1)NNC(=O)NCCN1C(=O)[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O	756101987	ZTKKQQGTLQRXPF-RPLLJCPNSA-N	446.504	1.445	50	20	IDGD	
CN(C)CCCOc1ccc(NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1	756456255	NIITYYBTNAHGAZ-UHFFFAOYSA-N	438.488	1.731	50	20	IDGD	
CCc1ccc(NC(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)cc1S(N)(=O)=O	756524262	HXDXBXPCTGAQLQ-UHFFFAOYSA-N	428.474	1.753	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)(F)F)cc1)c1cncc(N2CCOCC2)c1	757140838	GXNDFOASONXJTD-UHFFFAOYSA-N	430.408	1.969	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NN=Cc1ccc(Br)c(Br)c1	757576223	UJRJHEULINQZEW-SSDOTTSWSA-N	427.118	1.599	50	20	IDGD	
COCCOc1ccc(C#N)cc1NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1	758014869	SRHDOWFQQMQZGP-UHFFFAOYSA-N	439.476	1.443	50	20	IDGD	
COC(=O)c1ccccc1CCC(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	759229981	UCEDZLKROWSKHM-UHFFFAOYSA-N	447.513	1.570	50	20	IDGD	
C[C@@H]1OC(C)(C)N(C(=O)OC(C)(C)C)[C@@H]1CNC(=O)NN[C@@]1(C)CCS(=O)(=O)C1	762323898	ARXRIWGVKGYHOO-JCGVRSQUSA-N	434.559	1.128	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)[C@H](NC(C)=O)C3CCCC3)n[nH]2)cc1OC	763151830	GMHWWBVUHIFWOZ-LJQANCHMSA-N	429.477	1.550	50	20	IDGD	
Cc1nc(N)sc1C(=O)NN=Cc1ccc(OCCn2cc(C(=O)O)nn2)c(Cl)c1	763165884	UFWCVEYUPNZVBF-UHFFFAOYSA-N	449.880	1.820	50	20	IDGD	
CC(C)(C)c1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccnc2-n2cncn2)cc1	763596290	UWJHVPUYGLVBEY-UHFFFAOYSA-N	437.460	1.125	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2c(C)nc3ccccn23)cc(OC)c1OC	763629949	UMXWTMJQSCIQEE-UHFFFAOYSA-N	427.417	1.068	50	20	IDGD	
O=C(COc1cccc(C(F)(F)F)c1)NNC(=O)C(=O)Nc1cccc2c1OCO2	763639309	LIJBABUTAWWKMG-UHFFFAOYSA-N	425.319	1.599	50	20	IDGD	
CCOC(=O)c1c(F)cccc1NC(=O)C(=O)NNC(=O)COc1cc(C)ccc1C	763664684	DXJUPTKIBBVWJW-UHFFFAOYSA-N	431.420	1.784	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(C(F)(F)F)nc1	763683851	BJQKXKTVTINFMK-UHFFFAOYSA-N	426.351	1.664	50	20	IDGD	
Cn1cnc2cc(NC(=O)C(=O)NNC(=O)COc3ccc(Br)cc3)ccc21	763694261	ITVNJVYXGZMOFE-UHFFFAOYSA-N	446.261	1.501	50	20	IDGD	
O=C(NNC(=O)c1cccc(Cl)c1)C(=O)Nc1ccc(CCN2CCOCC2)cc1	763748558	SRWWPBNEWUVHBQ-UHFFFAOYSA-N	430.892	1.614	50	20	IDGD	
CCNC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCC3)cc1	763783906	QRHOFOUTUUZQRK-UHFFFAOYSA-N	430.486	1.151	50	20	IDGD	
CC(C)CCc1ccccc1NC(=O)C(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	763790522	KAEFDLYXFBXLEN-UHFFFAOYSA-N	435.484	1.922	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)C(=O)Nc1ccc(Br)cc1F	763791860	ZMKYFABGQYMHSL-UHFFFAOYSA-N	448.208	1.637	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)c(Br)c1	763812107	CNCKWPHVOPYTRQ-UHFFFAOYSA-N	447.245	1.494	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)OC)cc2F)cc1	763860625	JIMHQFBWEWSXJT-LBPRGKRZSA-N	447.419	1.564	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)n1	763893742	YGOWEJPMEUOSRN-UHFFFAOYSA-N	432.440	1.950	50	20	IDGD	
CCc1nnc(-c2ccc(NC(=O)C(=O)NNC(=O)c3cc(Br)c[nH]3)cc2)o1	764000012	YBRPQKMQSATHJG-UHFFFAOYSA-N	447.249	1.789	50	20	IDGD	
CN(C)c1c(Cl)cccc1NC(=O)C(=O)NNC(=O)c1cc(Br)cn1C	764002641	OYRDEGMCQOXNDH-UHFFFAOYSA-N	442.701	1.907	50	20	IDGD	
CS(=O)(=O)c1ccccc1NC(=O)C(=O)NNC(=O)c1cccc(C(F)(F)F)c1	764041237	YSGZSYSJIVSRMD-UHFFFAOYSA-N	429.376	1.509	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)c1cn(-c2ccc(C(F)(F)F)cn2)nn1	764043144	PIEZJVJHWNIDGQ-UHFFFAOYSA-N	438.391	1.940	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc(CN(C(C)=O)C(C)C)cc1	764048596	PTNLMDBKGZMNNJ-UHFFFAOYSA-N	426.473	1.852	50	20	IDGD	
CC(C)Oc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1C#N	764077738	MTGTYPDWOOSDIZ-UHFFFAOYSA-N	444.469	1.149	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1cc(C)nn1-c1ccc(F)cc1	764139559	VHYPUQQNUCLWDX-UHFFFAOYSA-N	425.420	1.657	50	20	IDGD	
O=C(CCc1ccco1)NNC(=O)C(=O)Nc1ccccc1-n1cc(Br)cn1	764168856	HIXLGPKZODUSOJ-UHFFFAOYSA-N	446.261	1.947	50	20	IDGD	
CCN(CC)C(=O)COc1cccc(NC(=O)C(=O)NNC(=O)c2cccc(C#N)c2)c1	764241649	DIHWWWMMOLWXOR-UHFFFAOYSA-N	437.456	1.205	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1nc(-c2ccccc2F)cs1	764277630	LJKCMSARGHYDMK-UHFFFAOYSA-N	430.417	1.820	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)C(=O)Nc1cccc(CN2CCCCC2=O)c1	764318907	MNSKEDUZBIGIFU-UHFFFAOYSA-N	426.448	1.667	50	20	IDGD	
COCCn1ncc2ccc(NC(=O)C(=O)NNC(=O)CCCc3cccs3)cc21	764340404	BTUSWPVZERYKAS-UHFFFAOYSA-N	429.502	1.853	50	20	IDGD	
Cc1cc(C)nc(Sc2ccc(NC(=O)C(=O)NNC(=O)Cc3ccncc3)cc2)n1	764354708	VMRAUZCWVMCXAI-UHFFFAOYSA-N	436.497	1.968	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)C(=O)Nc1cccc(CN2C[C@H](C)O[C@H](C)C2)c1	764404274	JGVFGYFVYBRAEH-HDICACEKSA-N	438.528	1.933	50	20	IDGD	
C/C=C(/C=C/C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)CC	764591078	IARQRHBCTFEWSM-UOULPLKISA-N	435.546	1.700	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Nc2cnn(-c3ncccc3C#N)c2)cc(OC)c1OC	764748748	XIESBXFZRBLFFY-UHFFFAOYSA-N	437.416	1.631	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)c1ccc2c(c1)S(=O)(=O)N(C1CC1)C2=O	765248249	GXRCGIBWNPEULM-UHFFFAOYSA-N	447.494	1.252	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3cn(-c4ccccc4)nn3)n[nH]2)cc1OC	765598951	NCXCAXZDHDSUFR-UHFFFAOYSA-N	433.428	1.749	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)[C@@H]1COc2ccccc2O1	765757960	ZGMLJSSOHMORLH-FQEVSTJZSA-N	444.919	1.445	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)COc1ccc2c(c1)CCC(=O)N2	767278007	WBZHVRJZCHZDHY-UHFFFAOYSA-N	425.441	1.192	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)COc2ccc(OC)c(C)c2)c1	767804426	RFVXLQXQUQTWJC-UHFFFAOYSA-N	449.529	1.874	50	20	IDGD	
CCC[C@@H](C)NS(=O)(=O)c1cc(C(=O)NNC(=O)C(C)(C)O)c(Cl)cc1Cl	768261687	NSLHHTNKXXKRKV-SECBINFHSA-N	440.349	1.992	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C[C@@](O)(c1nccn1C)C(F)(F)F	768628938	CGKWSAHCHQDVBE-OAHLLOKOSA-N	436.412	1.116	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)N[C@H]2CCOC3(CCOCC3)C2)nc1	769199783	DTLBNXRQBXJRRZ-HNNXBMFYSA-N	441.554	1.466	50	20	IDGD	
COC(=O)c1cc(CNC(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)ccc1OC	770345518	OBQXQMLUWFENQK-UHFFFAOYSA-N	443.464	1.908	50	20	IDGD	
CCC(CC)n1nccc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	770445710	NKTHYFQVGZMLCX-UHFFFAOYSA-N	449.533	1.340	50	20	IDGD	
COc1ccc2c(c1)nc(CNC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)n2C	770563802	SMLCQJPUJPMQTM-UHFFFAOYSA-N	431.474	1.130	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)CNC(=O)c1ccc(Cl)c([N+](=O)[O-])c1	771944398	WEZNWTIDOASGIT-JTQLQIEISA-N	428.829	1.103	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)ccc1C(=O)N(C)C	774008403	HXTCAUILXZXOKE-CYBMUJFWSA-N	446.891	1.904	50	20	IDGD	
COc1ccc2nc(NNC(=O)c3ccc(S(=O)(=O)N4CCOCC4)o3)c(C)cc2c1	778482398	YTLYWOGBHGPRKW-UHFFFAOYSA-N	446.485	1.923	50	20	IDGD	
C[C@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1NC(=O)NNC(=O)c1cc([N+](=O)[O-])ccc1O	779704498	LREZQZDMZJZMCH-FZMZJTMJSA-N	437.453	1.890	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCC2CCN(CC(F)(F)F)CC2)cc(OC)c1OC	780629436	ZNRNJVFZETYHAQ-UHFFFAOYSA-N	448.442	1.931	50	20	IDGD	
CN(C)C1CCN(c2ccc(NC(=O)C(=O)NNc3ncncc3Cl)cc2F)CC1	782159447	KVGAZHSRWGFHDL-UHFFFAOYSA-N	435.891	1.881	50	20	IDGD	
Cc1nnnn1-c1cccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2Cl)c1	782927649	VVNTYHRYPHCWFG-UHFFFAOYSA-N	434.243	1.677	50	20	IDGD	
COC(=O)c1cc(OC)c(OC)c(OC)c1NC(=O)C(=O)NNc1ccc(OC)cc1	783036579	FZMDSLRHZKEAFW-UHFFFAOYSA-N	433.417	1.589	50	20	IDGD	
CCOc1ccc(Br)cc1NC(=O)C(=O)NNc1ccc(-n2cccn2)nn1	783435971	FOFBTLOPVQSQPI-UHFFFAOYSA-N	446.265	1.905	50	20	IDGD	
CCOC(=O)[C@H](Cc1ccccc1)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	783571277	KJHGVNXCHBYQLO-FQEVSTJZSA-N	445.541	1.880	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2cc(C)n(CCCOc3ccc(F)cc3)n2)ncn1	783948915	VXLXYSKKLITGCW-UHFFFAOYSA-N	427.440	1.980	50	20	IDGD	
O=C(CCOc1ccccc1I)NNC(=O)Cc1ccncc1	783963042	BDVYCLSOVMUJAC-UHFFFAOYSA-N	425.226	1.845	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)C(=O)Nc1ccnn1-c1ccccc1	784213995	SEOAZVKGMHYZIV-UHFFFAOYSA-N	440.485	1.395	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)c2cc3c(=O)n4ccccc4nc3n2C)o1	784361192	URPJQNVMZPYQNH-UHFFFAOYSA-N	436.472	1.696	50	20	IDGD	
COC(=O)c1ccc(-n2cc(C)cn2)c(NC(=O)C(=O)NNc2nccnc2Cl)c1	784777813	MDASSBOITKUBPM-UHFFFAOYSA-N	429.824	1.493	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)F)cc1)C(=O)Nc1cccc2c1OCCC2=O	784834962	DMOHXCCSZGDFLX-UHFFFAOYSA-N	439.396	1.730	50	20	IDGD	
Cc1cc(Br)c(NC(=O)C(=O)NNc2ccnc(N(C)C)n2)cc1[N+](=O)[O-]	784970809	NQVQRCIOQAQWFA-UHFFFAOYSA-N	438.242	1.604	50	20	IDGD	
NS(=O)(=O)c1cccc(NC(=O)C(=O)NNc2c(F)cc(F)cc2Br)c1	785011318	WZKLHOCZXJJRMA-UHFFFAOYSA-N	449.233	1.457	50	20	IDGD	
Cc1ccc(-n2cc(NC(=O)C(=O)NNC(=O)c3cc(Br)c[nH]3)cn2)c(C)c1	786414405	OFPMHTMLBHYZEJ-UHFFFAOYSA-N	445.277	1.979	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cccnc2-c2cnn(C)c2)c1C	786415195	ZXSLZAHUMRPTCR-OAHLLOKOSA-N	436.472	1.652	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cccnc2-c2cnn(C)c2)o1	786417911	ZOQNCHHKAUJJQD-UHFFFAOYSA-N	439.476	1.317	50	20	IDGD	
Cc1ccc(N2CCNC2=O)cc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccccc1F	787544549	UEMQVMQDSLPVNK-ZDUSSCGKSA-N	443.435	1.217	50	20	IDGD	
Cn1nc([C@H]2CCCOC2)cc1NC(=O)C(=O)NNC(=O)C1=S=C2CCCCCC2=C1	790952931	XYABHQPTGUCRHZ-AWEZNQCLSA-N	445.545	1.382	50	20	IDGD	
CS(=O)(=O)c1cc(Br)cc(C(=O)NNc2nc3ccccn3n2)c1F	791255525	FVTNHTUGICIJGR-UHFFFAOYSA-N	428.243	1.791	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2cccc(NC(=O)N(C)C)c2C)cc1	792352097	AUDGQPRYNBDYQH-UHFFFAOYSA-N	441.488	1.816	50	20	IDGD	
CC(=O)N1CCC[C@@H](CNC(=O)NNC(=O)[C@H](C)Oc2cccc(Br)c2)C1	792781588	XKZSTMJUDMTUTO-JSGCOSHPSA-N	441.326	1.805	50	20	IDGD	
O=C(COc1ccc(OCc2ccccc2)cc1)NNC(=O)C(=O)Nc1cccc(F)n1	793023855	XHIDHAAAZOSNKG-UHFFFAOYSA-N	438.415	1.965	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)C(=O)Nc1cc(Cl)cc(C(N)=O)c1OC)c1ccccc1	793026100	PSOZEEDWAAUUBK-CYBMUJFWSA-N	432.864	1.727	50	20	IDGD	
O=C(CSc1nnc(O)nc1O)NN=Cc1cnn(-c2ccc(C(F)(F)F)cc2)c1	794886193	FMMBHPAJPPVQLL-UHFFFAOYSA-N	439.379	1.730	50	20	IDGD	
COC(=O)c1ccc(N2CCCC2)c(NC(=O)C(=O)NNC(=O)c2cccc(C)n2)c1	797369649	CQSJMPORDLKGJK-UHFFFAOYSA-N	425.445	1.177	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1cc2ccccc2c(=O)o1	797734549	SVOSKFMHEXVZSW-UHFFFAOYSA-N	429.454	1.571	50	20	IDGD	
CC(C)(Cc1nc2ccccc2[nH]1)C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	798832537	OHEZPAAFPNMGJB-UHFFFAOYSA-N	449.920	1.894	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc(C(F)(F)F)ccc1Br)c1cnccn1	799120297	OJODSMBLEBXPOQ-UHFFFAOYSA-N	425.186	1.881	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)CN2C(=O)N[C@](C)(c3ccc(OC)cc3)C2=O)cc1	802062191	ZVAFGQBQGIFRRI-OAQYLSRUSA-N	441.444	1.324	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN1S(=O)(=O)c1cccs1)Nc1ccc2c(c1)OCO2	802096915	JOKSBUFDDKQWKL-LBPRGKRZSA-N	438.487	1.483	50	20	IDGD	
O=C(CN1CCCc2ccccc21)NNC(=O)C(=O)Nc1ccc(OC(F)F)cc1F	802566348	KVIHMWSTGXVSJN-UHFFFAOYSA-N	436.390	1.966	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc(F)cc1OC1CCOCC1	806976518	FNNKLCOEMUJBOW-UHFFFAOYSA-N	431.420	1.792	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCc2ccncc2OC[C@H]2CCOC2)c(OC)c1	807615241	GEKLKXVRGFHKTO-AWEZNQCLSA-N	430.461	1.658	50	20	IDGD	
NS(=O)(=O)c1ccc(C=NNC(=O)c2cc([N+](=O)[O-])ccc2O)cc1Br	807973800	JDTIRVOWJHXUON-UHFFFAOYSA-N	443.235	1.474	50	20	IDGD	
O=C(COC(=O)C1(S(=O)(=O)c2ccccc2)CCOCC1)NNC(=O)c1ccccc1	808614446	LMCXHBCZRAWNHW-UHFFFAOYSA-N	446.481	1.014	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2F)cc2[nH]ccc12	808934667	PTFIDBAJDGAYDA-UHFFFAOYSA-N	428.376	1.259	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)C(=O)Nc2ccccc2-n2cnc(C#N)n2)cc1	810385832	BEDDTIPTBVGTMX-UHFFFAOYSA-N	435.469	1.326	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(Cl)cc1)NNC(=O)c1cnn(-c2ccccc2)c1	810398736	OKBOAFQIHAYQAS-UHFFFAOYSA-N	433.877	1.265	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(C)cc2)c([N+](=O)[O-])cc1OC(F)F	810511869	RCIQKXDUJRCJNK-UHFFFAOYSA-N	438.343	1.913	50	20	IDGD	
COC[C@@]1(C(=O)NNC(=O)CSc2ccccc2O)CCN(C(=O)OC(C)(C)C)C1	810807053	FGQGKEBCXWROBM-HXUWFJFHSA-N	439.534	1.905	50	20	IDGD	
CC(C)N(C)S(=O)(=O)c1ccc(C(=O)OCC(=O)NNC(=O)c2ccccc2)cc1	811845628	COASIIUHZUMWRO-UHFFFAOYSA-N	433.486	1.334	50	20	IDGD	
CC[C@@]1(CNC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)OCCc2ccccc21	812491524	AVAZPYKZRCLBLX-QHCPKHFHSA-N	435.484	1.756	50	20	IDGD	
CCC[C@H](NC(=O)Cc1ccccc1)C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	812729724	SBMUXHLZZLAEFY-IBGZPJMESA-N	432.546	1.908	50	20	IDGD	
COc1cc(C)c(NC(=O)C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)c(C)c1C	813033249	KXLKJWQSSASHKE-UHFFFAOYSA-N	434.518	1.953	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2cc(C(C)C)nc3onc(C)c23)n1	813374904	KVBVVWOHHREKON-UHFFFAOYSA-N	431.474	1.966	50	20	IDGD	
CCCc1nc(C)c(CNC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)o1	813862469	QCCHSAREOFYAPI-UHFFFAOYSA-N	437.522	1.395	50	20	IDGD	
C[C@@H]1SCCC1=NNC(=O)C[C@@H](C(=O)NN=C1CCS[C@@H]1C)N1CCOCC1	814855816	UJWYZPPXVPEKHW-ZENOOKHLSA-N	427.596	1.073	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1)[C@H]1C[C@@H]1C	815564007	UXNMPQFKFWXPFK-SGTLLEGYSA-N	439.428	1.756	50	20	IDGD	
Cn1ncc(I)c1C(=O)NNC(=O)c1cc(-c2cccs2)[nH]n1	815887511	JDKHZLXYBPUMQD-UHFFFAOYSA-N	442.242	1.551	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2cccnc2)nc2c1cnn2Cc1ccco1)C(=O)NC1CC1	841715370	SXNYTJPNQSBQQB-UHFFFAOYSA-N	445.439	1.174	50	20	IDGD	
CC(C)NS(=O)(=O)Cc1ccccc1CNC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	916228562	GJZSGAZOSBIECZ-UHFFFAOYSA-N	449.489	1.567	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCCc2c[nH]nc2C)c1	916259425	GAYAIZAEEWBNTF-UHFFFAOYSA-N	436.538	1.325	50	20	IDGD	
COc1cc(CNC(=O)NNC(=O)c2cccc(Cl)c2)ccc1OCC(=O)N(C)C	916641441	HGEXVGOOMFGUBA-UHFFFAOYSA-N	434.880	1.960	50	20	IDGD	
C[C@H]1C[C@@H]1c1ccc(CNC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)o1	918078023	LTUADDRMDPARSL-YOEHRIQHSA-N	448.549	1.560	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)c2ccc3c(c2)SC2=NS(=O)(=O)CCN23)c(O)c1	918337955	XWIUPISAIMCYLB-UHFFFAOYSA-N	432.483	1.387	50	20	IDGD	
CNS(=O)(=O)c1ccc([C@@H](C)NC(=O)NNC(=O)c2cn(C)c3ccccc23)cc1	919779310	QDFADSAWNUHDSP-CYBMUJFWSA-N	429.502	1.792	50	20	IDGD	
CC(C)[C@H](NC(=O)Cc1ccc2ccccc2c1)C(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1	919884811	QKXFUTKNDFCIOV-QUCCMNQESA-N	445.541	1.105	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2cccc(C(=O)NNS(=O)(=O)c3cn[nH]c3)c2)c(C)c1	919954945	XINMCUSDMAFATF-UHFFFAOYSA-N	449.514	1.451	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N[C@H]2CCN(c3cc(OC)cc(OC)c3)C2=O)cc1	1252519360	WKAXYUSPUWTEND-SFHVURJKSA-N	428.445	1.462	50	20	IDGD	
COCCn1cc(NC(=O)NNC(=O)c2ccc(F)cc2Br)ccc1=O	1320408427	LQLWEEKNPXUMDR-UHFFFAOYSA-N	427.230	1.863	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccccc1S(=O)(=O)NC1CC1)c1ccccc1Cl	1321536553	IPNHTNBUXOBQEH-UHFFFAOYSA-N	429.907	1.404	50	20	IDGD	
Cc1cnc2c(C(=O)N3CC[C@@]4(CN(C(=O)CCBr)CCO4)C3)cnn2c1	1778523084	QZBPFKXKDNRNKQ-GOSISDBHSA-N	436.310	1.266	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2)c1cccc2c1OCCO2	1778589576	MJOQCZXRNWBARJ-QLVMHMETSA-N	438.908	1.185	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CC[C@@]3(CN(C(=O)CCBr)CCO3)C2)o1	1779025067	RKKDOWRFZONUPB-QGZVFWFLSA-N	428.283	1.467	50	20	IDGD	
C=C(C)CC(C)(C)C(=O)N1CC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1	1779240040	DUAIQHSERUXMNO-QFIPXVFZSA-N	429.521	1.121	50	20	IDGD	
Cc1nc2ncccn2c1C(=O)N1CCO[C@@]2(CCN(C(=O)CO[Si](C)(C)C)C2)C1	1779296865	IYUSLFLORNHIAW-HXUWFJFHSA-N	431.569	1.333	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C=C/c2cc(C)on2)C1	1779441646	YGCSEUXCGMNUEK-VFTRUVIOSA-N	425.913	1.764	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H]3CC[C@@H]4CCC(=O)N4C3)C2)C1	1781057374	OIESUHIQHDSWLU-IPZZXCBHSA-N	446.375	1.454	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)c3cccn4c(O)nnc34)CCO2)C1	1781227569	MUYOQIYCBSIQMF-QZTJIDSGSA-N	442.303	1.115	50	20	IDGD	
Cc1ccc(CCC(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](F)Br)C3)C2)cn1	1781327022	WDZDMHBFSGJQFE-WMZOPIPTSA-N	428.302	1.843	50	20	IDGD	
COc1cccc(CCC(=O)N2CCO[C@]3(CCN(C(=O)[C@H](F)Br)C3)C2)n1	1781327067	WUMLKPPPUFIKMB-FUHWJXTLSA-N	444.301	1.543	50	20	IDGD	
COc1cc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)c(F)c(OC)c1F	1781946264	FZRPRFKMTDFBFJ-CWTRNNRKSA-N	448.850	1.025	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H]2C[C@H]3CC[C@@H]2O3)C1	1782023644	JFXAPOQXCBZQHZ-ACZMQLADSA-N	429.355	1.851	50	20	IDGD	
CN(C)c1c(F)cc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)cc1F	1782104853	IESAUWHVUMYDCV-KXBFYZLASA-N	431.867	1.074	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc3nc[nH]c3c1)C2	1782175373	JWPYCZYAFUHCSK-FQELHTAISA-N	434.924	1.944	50	20	IDGD	
Cn1cccc1C(=O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CO[Si](C)(C)C)C2	1782611752	YJIUTHADGMBKHF-DYESRHJHSA-N	435.597	1.573	50	20	IDGD	
C/C=C(/C)C(=O)N1CC[C@@]2(CN(C(=O)CN(C)NC(=O)NCc3ccccc3)CCO2)C1	1783081728	PDUSJRLAENTNNC-CLHCTPIOSA-N	443.548	1.129	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cncn3-c3ccncc3)CCO2)C1	1783533221	XKIFWNTWFBROHC-LIRRHRJNSA-N	448.321	1.494	50	20	IDGD	
COc1cc(F)cc(/C=C/C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)c1	1783692768	MFNVUGFVYIVMTR-REUWKZPGSA-N	426.872	1.277	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccnc(OCC(C)C)c3)CCO2)C1	1783876984	ZCMAEBBBLMKMRB-UWJYYQICSA-N	439.940	1.814	50	20	IDGD	
Cc1cc(C)cc(CCC(=O)N2CCO[C@@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)c1	1783937394	IZFGOXWKMGILFD-XMMPIXPASA-N	444.576	1.439	50	20	IDGD	
Cc1cn2c(=O)c(C(=O)N3CCO[C@@]4(CCN(C(=O)C(Cl)Cl)C4)C3)cnc2s1	1783947459	CCYOQJQEJXCPIF-QGZVFWFLSA-N	445.328	1.312	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCSC(=N)N)C[C@@H]21	1783967711	JSXLSHOJYIMWIT-CYDGBPFRSA-N	435.388	1.014	50	20	IDGD	
Cc1ncncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]2C1	1783970176	NXLBQNFMLFDGDT-XTBFLFJDSA-N	425.327	1.409	50	20	IDGD	
NC[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCBr)[C@H]2C1)c1ccccc1	1786405904	JBUQDPHWTFHIET-XSLAGTTESA-N	438.366	1.494	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccn4cncc34)[C@H]2C1	1788423774	FDRXAMWSAPFYSJ-RMRKRWHISA-N	435.322	1.711	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21)c1ccc2c(c1)CNC2=O	1788444195	POHAQODKMIKBBR-CQDKDKBSSA-N	426.300	1.327	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)N3C[C@H]4C[C@@H]4C3)[C@H]2C1	1788516902	RVTPXIAJFOORHC-XFUVECHXSA-N	442.398	1.480	50	20	IDGD	
CC1(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)CCCCC1	1788609900	RLUSKZKQZVASED-SNRMKQJTSA-N	443.548	1.249	50	20	IDGD	
CC(C)n1nccc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]2C1	1789924622	PPLCWOGZAVYJQH-JURCDPSOSA-N	431.306	1.748	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnn4ccncc34)C[C@@H]21)[C@H](F)Br	1789926462	ZARGCMHUAGICGC-LVGORTOPSA-N	440.273	1.013	50	20	IDGD	
COC[C@@H](NC(C)=O)C(=O)NC1(c2ccc(NC(=O)[C@@H](F)Br)cc2)CCC1	1790535798	FULFYTFMIQPBIA-HUUCEWRRSA-N	444.301	1.962	50	20	IDGD	
COC[C@H](NC(C)=O)C(=O)NC1(c2ccc(NC(=O)[C@@H](F)Br)cc2)CCC1	1790535800	FULFYTFMIQPBIA-LSDHHAIUSA-N	444.301	1.962	50	20	IDGD	
CCC(=O)N[C@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](Br)CC)[C@H]2C1	1790958216	MMHLBOUPZRWANZ-QTVXIADOSA-N	432.359	1.054	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ncccc3C(F)(F)F)C[C@@H]21	1791255272	JAWHBJXMIISDCW-JURCDPSOSA-N	449.857	1.948	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@]3(F)CCCC=C3F)C[C@@H]21	1791292594	XNFJIAZMSOPJOA-OSAWLIQMSA-N	442.507	1.085	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1ccc(C2(NC(=O)[C@@H](N)CCC(N)=O)CCC2)cc1	1791433825	DXXKRQGUIWIOSE-RISCZKNCSA-N	425.327	1.497	50	20	IDGD	
CC(=O)NCC(C)(C)C(=O)NC1(c2ccc(NC(=O)CCC(=O)NN(C)C)cc2)CCC1	1791599265	BMMHTQHVNPXMPF-UHFFFAOYSA-N	445.564	1.656	50	20	IDGD	
COc1ncc(Cl)cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCC(=O)NN(C)C)C2	1792455723	XRPDKOMLCHXHCI-QDMKHBRRSA-N	437.928	1.368	50	20	IDGD	
COc1ccc([C@@H](C)C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CCC(=O)NN(C)C)C3)cc1	1792935826	YUMFJRIQNOJBKW-OQIJWPOYSA-N	430.549	1.810	50	20	IDGD	
COC(=O)c1ccccc1CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2	1793094312	LNDFBIKOKDVZQE-XOIINTDNSA-N	443.327	1.799	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CC(=O)OC(C)(C)C	1793824635	XOOQCXNIJDQMEH-BDHJUDLHSA-N	445.520	1.490	50	20	IDGD	
CN(C)c1cccc(OCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)C(Cl)Cl)C3)c1	1793858625	RBLAXZJXRAFKJZ-FVCICTRLSA-N	430.332	1.525	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1n[nH]c(C2CC2)c1F	1794483810	XWZKAIYCFIZHOZ-GMTLJSCSSA-N	429.290	1.413	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c(F)ccc(O)c1F)C2	1795115101	IRCZALQSOBMXPO-WRBXQSRGSA-N	433.249	1.659	50	20	IDGD	
Cn1c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)cc2ccccc21	1796191066	VBLJQKSMLKEKMC-ACDBMABISA-N	431.301	1.424	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1c[nH]c2ncccc12	1796871522	OPJSBJGGSMAVLS-NFFDBFGFSA-N	435.322	1.797	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1nc2ccccc2n(C)c1=O	1796995362	VZVUFPAAHAAEOM-KRXQYRFLSA-N	446.935	1.544	50	20	IDGD	
CCCc1onc(C)c1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnccc1C(=O)NN)C2	1797085272	KQSBSEAIQLRXPM-QDMKHBRRSA-N	440.504	1.500	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1n[nH]c3ccc(F)cc13)C2	1797956963	SDLXVKWIKAXCJG-IVWMJMPLSA-N	434.544	1.757	50	20	IDGD	
CCc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Br)cc(C)n1	1799347926	XTLFYZCQNFOQFM-XRGAULLZSA-N	428.302	1.846	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](F)Br)c1nn[nH]c1C(F)(F)F	1800161404	VUSBYTTZGICHNJ-XIVUIJJLSA-N	428.184	1.766	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1n[nH]c(C3CC3)c1F)C2	1800757644	HNPQOYZWARIIGO-MGAJZRQESA-N	429.290	1.413	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(-n3cccn3)cc1)C2	1800759787	HYXYPCXHYIYLBR-NYCLONFESA-N	447.333	1.859	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc2c(c1)C(=O)CC2	1800970372	CCACFEJRMDUFMU-BJWYYQGGSA-N	447.495	1.380	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3cccnc3nc1O)C2)C(Cl)Cl	1801016794	RGLNJIJEXGGIFN-PTEHBNRSSA-N	425.272	1.342	50	20	IDGD	
O=C1CC[C@@H](C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](Br)Cc2ccccc2)N1	1801568211	UOYLMKSIMLFESC-ILOCAZANSA-N	448.361	1.909	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)c1ccc(C(F)(F)F)cc1F	1801850556	CYLXCYMPWSGLNI-OWLDWWDNSA-N	438.805	1.647	50	20	IDGD	
COC[C@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc(S(C)(=O)=O)c1)C2	1802271553	UHHHKPUZFQSZEB-IVSAIRAKSA-N	428.938	1.596	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CCC(=O)NN(C)C)cc1	1802343689	IJZCDOWBPWSNJU-REPLKXPHSA-N	429.521	1.270	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cn3c(F)cccc3n2)[C@@H]1c1cccnc1)[C@H](O)CCl	1803148975	ZFCVELZPZXKVGL-ZSZQSSIHSA-N	445.882	1.788	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)c2cccs2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807364968	VJSMKQGXXSACHU-YLJYHZDGSA-N	435.314	1.456	50	20	IDGD	
Cc1cccc(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)n1	1807369094	AIRKAANEFCOHGG-UGKGYDQZSA-N	444.300	1.098	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)[C@@H](C)N2CCN(C)CC2)[C@@H]1c1cccnc1	1807928340	BSBCQNVUVLHRGH-GTAWCEEGSA-N	436.000	1.741	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)c1ccc2n[nH]cc2c1	1808013141	XTQGKMHYFYWBPU-IPELMVKDSA-N	427.892	1.877	50	20	IDGD	
CCc1ccc(C(=O)N2CCCC3(CCN(C(=O)CCC(=O)NN(C)C)CC3)C2)cn1	1808018482	NJHYAYNLGSJKBO-UHFFFAOYSA-N	429.565	1.862	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2[nH]nc3ccncc23)[C@H]1c1cccnc1	1808101547	NMXNXVFGCWVKEE-SIXWZSSISA-N	442.907	1.926	50	20	IDGD	
Cc1oncc1C(=O)N1CCCC2(CCN(C(=O)c3cnccc3C(=O)NN)CC2)C1	1808521594	RNFYZMUKVMINPX-UHFFFAOYSA-N	426.477	1.140	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)[C@@H]2C[C@@H]2C2CC2)[C@H]1c1cccnc1	1810293276	BSWJHRYRVQLMSC-SFFNPBHPSA-N	448.527	1.446	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC2(CCCN(C(=O)c3cnc(O)nc3O)C2)CC1	1810872167	AMULKVSZZPCBKM-LLVKDONJSA-N	427.299	1.516	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@H](CNC(=O)c2cc(CO)on2)[C@H]1c1cccnc1	1811592074	FUFPDUTWVZEHJO-HNAYVOBHSA-N	432.553	1.733	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)[C@H]2CCC(=O)N2)[C@@H]1c1cccnc1	1812774696	CWWLAUBMLLZFIH-LJIGWXMPSA-N	437.338	1.540	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)[C@@H]2[C@@H]3C=CS[C@@H]23)[C@@H]1c1cccnc1	1813073788	MJHBTUFHGXFYLF-BQDHWQRKSA-N	443.573	1.336	50	20	IDGD	
CCS(=O)(=O)CC(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](C)CBr)[nH]n1	1815171715	QWUIQSSBTILMPX-WCQYABFASA-N	449.371	1.868	50	20	IDGD	
Cc1ccc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)cn1	1815355125	NQHGVPOOCWTKMX-MRXNPFEDSA-N	436.302	1.066	50	20	IDGD	
Cc1onc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)c1C	1815454154	KUNVGHMSOQDTKB-OAHLLOKOSA-N	431.497	1.693	50	20	IDGD	
N#Cc1ccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)cc1	1817476934	UGPYIOFAXSFZPA-HXUWFJFHSA-N	443.272	1.581	50	20	IDGD	
CCC1(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2cnccc2C(=O)NN)CC3)CCC1	1818864243	OTDXGTBHNRDDNE-GFCCVEGCSA-N	442.545	1.948	50	20	IDGD	
Cn1ccc2c(O)ncc(C(=O)Nc3cc([C@@H]4CCCCN4C(=O)[C@H](O)CCl)[nH]n3)c21	1820090850	IHMQHSVKHOPHCC-LSDHHAIUSA-N	446.895	1.908	50	20	IDGD	
CCc1cc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@H](Cl)COC)CC3)nn1C	1820971963	OROMHABTWJKXDY-ZYHUDNBSSA-N	425.942	1.919	50	20	IDGD	
CN1CCN(CC(=O)N[C@H]2CCc3nc(NC(=O)[C@@](C)(Cl)CCl)sc3C2)CC1	1822864808	HSKXHVROGUKLRN-SGTLLEGYSA-N	448.420	1.539	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)Cc2ccc(O)cn2)n[nH]1	1822893540	YKWQOBHGJKUWNM-KRWDZBQOSA-N	443.508	1.118	50	20	IDGD	
O=C(CCn1cncn1)N[C@@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1	1823013535	CZBFDKLNUGSFJX-PELKAZGASA-N	431.291	1.427	50	20	IDGD	
Cc1ncc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)cn1	1825699999	OZXYJMOIRHFHRE-NRFANRHFSA-N	436.321	1.012	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)Cc1ccccc1)CC2	1826004412	JAGDRGBASJCVKB-YCPHGPKFSA-N	437.949	1.913	50	20	IDGD	
O=C([C@@H]1CCCOC1)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827060084	OVONOLHUZXAFSF-TZIWHRDSSA-N	428.338	1.026	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)CN3C(=O)CSC3=S)sc2C1	1828247169	NKRRDURLXKQYSC-BDAKNGLRSA-N	447.007	1.933	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3CCc4nc[nH]c4C3)C2)C1	1830370087	HVAAHSWHYCBLOS-QVKFZJNVSA-N	438.956	1.236	50	20	IDGD	
O=C(/C=C/c1ccc([N+](=O)[O-])o1)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1830912694	ZAYSXPPPEBCTSD-DUXHTMCSSA-N	448.259	1.461	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(OC)n3)C2)C1	1831644486	YPWGWUKOBIUPET-FOIQADDNSA-N	425.913	1.568	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)Cn3ccnc3)C2)C1	1831660179	ZLDZYAUXKQUARA-UWVAXJGDSA-N	426.945	1.383	50	20	IDGD	
O=C(/C=C/c1ccco1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1833078820	XXWWHADYKXMEKY-GILVVUIESA-N	431.258	1.440	50	20	IDGD	
CN1CCCC[C@@H]1C(=O)NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1	1833318550	QOYUMLKTXJETPJ-SJORKVTESA-N	447.393	1.733	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)Cc3noc(C)n3)CC2)CC1	1833530347	UPXHPBUOGFRGAQ-QGZVFWFLSA-N	425.961	1.900	50	20	IDGD	
Cc1noc(C)c1CC(=O)N1CCOC[C@@]2(CN(C(=O)CCBr)CCO2)C1	1834819809	XKAACWSFXBTDKF-GOSISDBHSA-N	444.326	1.075	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)Cn3cccn3)CC2)CC1	1834884812	PLTIZMQYGKPXNN-KRWDZBQOSA-N	440.386	1.628	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)[C@H]1Cc2ccccc2O1	1835474704	IBOYVVBPYKYGLV-UYAOXDASSA-N	435.952	1.161	50	20	IDGD	
Cn1ccc(CC(=O)N2CCC(N3CCC(NC(=O)[C@@H](F)Br)CC3)CC2)n1	1836412785	UVJIJGDDGMNFIW-QGZVFWFLSA-N	444.349	1.225	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccccc3O)C2)C1	1837715845	MTRGQQFIHOELJH-NRFANRHFSA-N	436.581	1.243	50	20	IDGD	
CCc1noc(C)c1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)Br)C2)C1	1838060318	IKSPRABFGVQDKG-SGTLLEGYSA-N	444.326	1.399	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(C#N)c3)CCO2)C1	1838908583	ILRBIPQVKMXRBF-LIRRHRJNSA-N	436.306	1.412	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3ccco3)C2)C1	1839962575	KUVCJMSABIXBIX-QFBILLFUSA-N	443.338	1.842	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cncc(F)c3)C2)C1	1839963370	IWPFQDWGHWXAOW-MAUKXSAKSA-N	444.301	1.464	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(CO)o3)C2)C1	1839964819	DPSTXDYXNQYFTH-KSSFIOAISA-N	445.310	1.015	50	20	IDGD	
Cc1ccccc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2	1840034271	GQPKAOCLWBUEHJ-BEFAXECRSA-N	425.323	1.848	50	20	IDGD	
CNc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](Cl)COC)CCO3)cc1	1840151936	RWEXATIYOZSAHA-PXNSSMCTSA-N	425.913	1.052	50	20	IDGD	
CCC[C@H](C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H](Cl)COC)CCO2)C1)n1cccc1	1840152486	JMXGROVJJWTFMV-WAOWUJCRSA-N	441.956	1.540	50	20	IDGD	
CCOc1ccccc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840188924	LFRJSZVTZJKOPI-LJQANCHMSA-N	431.316	1.959	50	20	IDGD	
C[C@@H](C(=O)N1CCO[C@]2(COCCN(C(=O)CCBr)C2)C1)n1cccc1	1840350683	PKQWEQGPYGMUDV-YJBOKZPZSA-N	428.327	1.291	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3cc(C)on3)CCO2)C1	1840369671	KJTDBOHQUZZERJ-YJBOKZPZSA-N	444.326	1.155	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@@H](O)C(=O)N1CCCC12CN(C(=O)[C@](C)(Cl)CCl)C2	1841300853	ZNSBFCHVGQOJKJ-SJKOYZFVSA-N	438.352	1.312	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@@H](C(=O)N2CC3(CCCN3C(=O)[C@H](O)CCl)C2)C[C@H]2C[C@H]21	1841348716	ZNABXKCAYSTELK-KBUPBQIOSA-N	427.929	1.187	50	20	IDGD	
CC(C)(C)OC(=O)N(CC(=O)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1)C1CCCC1	1841351642	ZIIQSOZYEQVKOC-MRXNPFEDSA-N	443.972	1.969	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@H]2CN(Cc3ccccc3)CCO2)C1	1843925291	BBXPCWVSFLZPQA-OALUTQOASA-N	435.952	1.345	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1csc3c1CCCC3)C2	1844264413	PWHTZTOMELBASE-UHFFFAOYSA-N	439.541	1.756	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)c1[nH]cnc1C)C2	1844692500	DOJHOOUCAGUJOO-UHFFFAOYSA-N	427.417	1.682	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@]13C[C@@H]1CN(C(=O)OC(C)(C)C)C3)C2	1846365036	XCBQXCYBYINAHO-LRAJWGHMSA-N	441.956	1.701	50	20	IDGD	
CC(C)(C)OC(=O)N1C(=O)CC[C@H]1C(=O)N1CC2(CCCN2C(=O)C(Cl)Cl)C1	1846389136	HHRYLXUGFBFKTM-NSHDSACASA-N	434.320	1.920	50	20	IDGD	
O=C(CCCNC(=O)NC1CCCCC1)NNC(=O)c1csc(N2CCOCC2)n1	23354347	YJOCBKMYZWWZPE-UHFFFAOYSA-N	438.554	1.153	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N(C)C(C)C)cc2)c1	26901346	FQPOBYCKSWCNQV-UHFFFAOYSA-N	435.502	1.808	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2cccc([N+](=O)[O-])c2C)cc(OC)c1OC	30529890	XNVGHRMPVDYSHA-UHFFFAOYSA-N	425.419	1.552	50	20	IDGD	
Cc1csc([C@](O)(CC(=O)NNC(=O)c2ccc3c(c2)OCCO3)C(F)(F)F)n1	109027252	NJXVKBFKAOCJIR-MRXNPFEDSA-N	431.392	1.824	50	20	IDGD	
Cc1cc(S(=O)(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)ccc1OCCCC(=O)O	726154862	BNFDPEBPPRRLNV-UHFFFAOYSA-N	437.430	1.770	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)[C@@H](C)NC(=O)c2n[nH]c3ccccc23)cc1OC	726382345	QYSHLIILZSNCCK-GFCCVEGCSA-N	425.445	1.550	50	20	IDGD	
O=C(CCCc1ccccc1)NNC(=O)NCCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1	727845780	YGTWXQVWGMQBNB-UHFFFAOYSA-N	449.489	1.226	50	20	IDGD	
NS(=O)(=O)c1ccc(Br)c(C(=O)NNc2nc(-c3ccccc3)no2)c1	728080942	RBQORGXIDAGMSW-UHFFFAOYSA-N	438.263	1.903	50	20	IDGD	
CCOC(=O)C1=NN(c2ccccc2)[C@H](C(=O)NNC(=O)c2cc(OC)cc(OC)c2)C1	728457838	RQFDYGFNGHTJSL-IBGZPJMESA-N	440.456	1.663	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1cc([N+](=O)[O-])ccc1Br	728844764	BCBDDGOUKLCUHL-UHFFFAOYSA-N	449.265	1.825	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)NCC(=O)Nc1ccc(-n2cccn2)cc1	729507638	XQJQYZZSXBKTEW-UHFFFAOYSA-N	431.456	1.796	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cc(C3CC3)nc3c2c(O)nc(=O)n3C)c(OC)c1	729969137	NLUFINSBJWXBGL-UHFFFAOYSA-N	439.428	1.004	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)c1sccc1S(=O)(=O)C(F)F	730956856	RMVWWFDHXQGRKB-UHFFFAOYSA-N	434.442	1.983	50	20	IDGD	
CS(=O)(=O)CCCC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	731183594	LBJLDIPKTDWIKS-UHFFFAOYSA-N	445.544	1.135	50	20	IDGD	
CCN(C1CCN(C(=O)NNC(=O)c2cc3c(s2)CC[C@@H](C)C3)CC1)S(C)(=O)=O	731358046	AVEVBWWVQKANJX-CYBMUJFWSA-N	442.607	1.973	50	20	IDGD	
COc1cc(C=O)c([N+](=O)[O-])cc1OCC(=O)NNC(=O)COc1cc(C)ccc1C	731597402	QMQRUSCLSQWUFK-UHFFFAOYSA-N	431.401	1.638	50	20	IDGD	
O=C(CS(=O)(=O)c1cccc(Br)c1)NNc1nc(-c2cccnc2)no1	732110786	ODTWSUXDGSMBEM-UHFFFAOYSA-N	438.263	1.811	50	20	IDGD	
CSCC[C@H](C(=O)NNc1nc(-c2cccnc2)no1)N1C(=O)[C@@H]2CCCC[C@H]2C1=O	732110808	OPLJAHMDZFDLEW-RBSFLKMASA-N	444.517	1.872	50	20	IDGD	
CCc1cc(N2CCC[C@H](NC(=O)NNC(=O)[C@H](C)Oc3ccc(F)cc3)C2)ncn1	732914497	QTHCFRPOICSWSH-YOEHRIQHSA-N	430.484	1.945	50	20	IDGD	
Cc1nn(CCCl)c(C)c1C(=O)N1CCN(c2ccc(S(N)(=O)=O)cc2)CC1	733920388	PLIVVKDRSAOMDU-UHFFFAOYSA-N	425.942	1.349	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)C[C@H](c1ccccc1)N1CCOC1=O	734240313	NSWKLNVRGRWDLU-OAHLLOKOSA-N	435.481	1.425	50	20	IDGD	
CC[C@@H](NC(=O)NNC(=O)c1cnn(C)c1)c1ccccc1OCC(=O)N1CCCC1	735582866	SKPZSJUCGGRKOZ-QGZVFWFLSA-N	428.493	1.517	50	20	IDGD	
CCn1c(SCC(=O)NNC(=O)c2cccc(C)c2)nc2cc(S(N)(=O)=O)ccc21	742449979	RSPLZYICEPAEOL-UHFFFAOYSA-N	447.542	1.565	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2ccc(Cl)c(N3CCNC3=O)c2)cc(OC)c1OC	742473243	YGMXUNOHBMSASU-UHFFFAOYSA-N	448.863	1.970	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)c2ccccc2Cn2cncn2)CC1	742681587	IEBZIYWQJXTQRV-UHFFFAOYSA-N	443.508	1.670	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccccc1)NNC(=O)c1cccc(Br)c1	742768950	CRZXVSUCTGKODL-UHFFFAOYSA-N	426.292	1.579	50	20	IDGD	
COc1ccc(CCNC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)cc1OC	743502577	DMGLEXRANVOWNR-UHFFFAOYSA-N	436.490	1.686	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NCc2cccc(Cn3cccn3)c2)cc1	743556664	DBUJRFCJRJBCTJ-UHFFFAOYSA-N	442.501	1.871	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc(F)cc1)NNC(=O)Nc1ccc(OC(F)F)cc1	743832616	XJJSZUCLOGHQFW-UHFFFAOYSA-N	446.407	1.948	50	20	IDGD	
O=C(CN1CCN(CCCOCC(F)(F)F)CC1)NNC(=O)c1cccc(Cl)c1	744201046	UXLITPKPDRIYPN-UHFFFAOYSA-N	436.862	1.688	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)c2ccc(F)c(S(=O)(=O)NC3CC3)c2)c1	744689144	NRMOJYYVEQBSRZ-UHFFFAOYSA-N	449.460	1.193	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)c1cc(S(=O)(=O)NC2CC2)c(Cl)cc1Cl	747429214	HXCFXUMNALEZOG-UHFFFAOYSA-N	443.312	1.833	50	20	IDGD	
Cn1ccnc(NNC(=O)c2ccccc2NS(=O)(=O)c2ccc(Cl)cc2)c1=O	747942136	XEVGWJWBQZVYIZ-UHFFFAOYSA-N	433.877	1.991	50	20	IDGD	
CC[C@@H](C(=O)N1CCC(NC(=O)NNC(=O)[C@@H](C)OCCOC)CC1)c1ccccc1	748623551	JRPUYGCGNKFZCG-VQIMIIECSA-N	434.537	1.553	50	20	IDGD	
O=C(NCC(=O)N1CCN(c2ccccc2)CC1)NNC(=O)c1cccc2cccnc12	749214565	BDBPUFABZLKPGW-UHFFFAOYSA-N	432.484	1.528	50	20	IDGD	
Cc1ccc(CCC(=O)NCC(=O)NNc2nc(Br)cn3ccnc23)cc1	750250196	OLRTWFVDIMXJMQ-UHFFFAOYSA-N	431.294	1.992	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)COc1cccc(NC(=O)c2ccco2)c1	751202476	DRTNJIOMABHEPD-UHFFFAOYSA-N	426.385	1.081	50	20	IDGD	
Cc1nc2c3ccccc3nn2c(C)c1CCC(=O)NNC(=O)CNC(=O)c1ccco1	751205207	YTQOXIUYJUZLHS-UHFFFAOYSA-N	434.456	1.602	50	20	IDGD	
COc1ccc2c(c1)CC[C@@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)C2	753282264	DNFKDPNHXRJJKX-QGZVFWFLSA-N	446.529	1.447	50	20	IDGD	
Nc1nc(Cl)cc(NNC(=O)CN2C(=O)c3ccc(Br)cc3C2=O)n1	753452674	UULMISLMCPJIPQ-UHFFFAOYSA-N	425.630	1.214	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)Cc1ccc(I)cc1	754298968	JSXNMWGAGHELJL-UHFFFAOYSA-N	447.273	1.896	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NN=Cc1cnc(N2CCN(C)CC2)nc1	755563610	IVKIWUQBHLAXOU-AWEZNQCLSA-N	447.337	1.909	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cc(S(N)(=O)=O)c(C)o2)cc1Br	755667506	JHGLWNIMYHDJCN-UHFFFAOYSA-N	432.252	1.081	50	20	IDGD	
CCc1c(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)cnn1CC(C)C	755936677	HMSXPWZTXBKJCA-UHFFFAOYSA-N	435.550	1.879	50	20	IDGD	
CCOc1ccc(C#N)cc1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	756213438	VRLAODZYPHPFIH-UHFFFAOYSA-N	431.474	1.674	50	20	IDGD	
C[C@](NCC(=O)NNC(=O)c1cccc(C#N)c1)(C(N)=O)c1cccc(C(F)(F)F)c1	756601486	PKZLOSKYNFDZRI-LJQANCHMSA-N	433.390	1.328	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)cc1NS(C)(=O)=O	756781584	GZTSAYRHOBRMAS-UHFFFAOYSA-N	444.473	1.923	50	20	IDGD	
CCCn1nc(C(=O)NNS(=O)(=O)c2ccc(C(=O)O)cc2C)c2ccccc2c1=O	757645469	MJTJPPOOVFCGQR-UHFFFAOYSA-N	444.469	1.436	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)Nc1ccnc(OCC(F)(F)F)c1	757925323	FZDZUCZEWOUDQZ-UHFFFAOYSA-N	439.398	1.882	50	20	IDGD	
CCOc1ccc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)c3cnco3)cc2)cc1	758041581	XNUBILBTRWYTBA-UHFFFAOYSA-N	430.442	1.949	50	20	IDGD	
O=C(c1cccc(Oc2cnccn2)c1)N1CCN(S(=O)(=O)CBr)CC1	758528289	RGOXYGXMQAWIQZ-UHFFFAOYSA-N	441.307	1.709	50	20	IDGD	
COCCOc1cc(C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)nc2ccccc12	758850567	JDWUQOLELRWJGJ-UHFFFAOYSA-N	448.435	1.750	50	20	IDGD	
Cc1ccc(CNC(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)c(O[C@@H]2CCOC2)c1	758899540	INBJNRHHDBREBO-OAHLLOKOSA-N	430.417	1.921	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N[C@@H](CCSC)C(=O)NNc2ncc(F)cn2)cc1	760920894	RNFDDSLJLCTQGD-HNNXBMFYSA-N	443.526	1.558	50	20	IDGD	
C[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@H]1NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	763132882	MOIPFOLXWJRETD-CZUORRHYSA-N	444.496	1.252	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(N2CCCC2=O)c(F)c1	763468970	ZGYNCYAJRJWDFF-UHFFFAOYSA-N	429.364	1.260	50	20	IDGD	
N#Cc1cccnc1-n1cc(NC(=O)C(=O)NNC(=O)c2cc3ccccc3cc2O)cn1	763523564	URLAOCXUBHCQLO-UHFFFAOYSA-N	441.407	1.397	50	20	IDGD	
O=C(NNC(=O)c1ccccc1O)C(=O)Nc1ccc(-c2noc(C(F)(F)F)n2)cc1	763532401	ZRZVPNUXBYJBJR-UHFFFAOYSA-N	435.318	1.861	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)C(=O)Nc2cnc(C)nc2)cc(OCC)c1OCC	763543777	PFUARRGQDHWYKI-UHFFFAOYSA-N	431.449	1.381	50	20	IDGD	
CC(C)(C)c1ccc(OCC(=O)NNC(=O)C(=O)Nc2cnn(CC(F)(F)F)c2)cc1	763594941	NZDJWZLFUKMEKO-UHFFFAOYSA-N	441.410	1.908	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(C(=O)NCC(C)C)cc1	763663312	RARCNNOSGWEWQU-UHFFFAOYSA-N	442.472	1.246	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(N3CCO[C@H](C)C3)cc2)cc1C	763666561	JISACOXLBNTOIZ-QGZVFWFLSA-N	440.500	1.693	50	20	IDGD	
CS(=O)(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)cc1	763685620	DOERIYMHHITONB-UHFFFAOYSA-N	439.877	1.050	50	20	IDGD	
Cn1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2Cc2ccccc2)ccc1=O	763718997	TUCZAWAVLFGYIJ-UHFFFAOYSA-N	434.452	1.141	50	20	IDGD	
CN(C)CCn1c(=O)oc2ccc(NC(=O)C(=O)NNC(=O)c3cccc(Cl)c3)cc21	763750484	NHEJMLODIRCJCB-UHFFFAOYSA-N	445.863	1.209	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)C(=O)Nc1ccc2c(c1)C(=O)CCC2	763803233	JYBPDGBTAUVZHY-UHFFFAOYSA-N	426.385	1.279	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccccc1	763824292	HISNPUNDWMISOX-FQEVSTJZSA-N	445.479	1.000	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccccc1OCC(F)(F)F	763837234	BGQBAXYDGQILPN-UHFFFAOYSA-N	429.326	1.932	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccnn1Cc1ccccc1F	763865987	MVWCSJRLOBJPIU-CYBMUJFWSA-N	443.410	1.763	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)NC(=O)CO3)cc1OC	763912314	WLQIDRWPIPFTET-UHFFFAOYSA-N	442.428	1.215	50	20	IDGD	
CC(=O)N(Cc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccc(F)cc2)cc1)C(C)C	763931640	JKQKVQYYPVEGQD-UHFFFAOYSA-N	428.464	1.911	50	20	IDGD	
COC(=O)c1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)c1cc(Br)c[nH]1	763994764	GCHYNTCLNGIKQG-UHFFFAOYSA-N	443.641	1.617	50	20	IDGD	
Cc1ccc(Oc2ccc(NC(=O)C(=O)NNC(=O)c3ccc4c(c3)OCCO4)cc2)nn1	764005533	ZYUHYBDVWWOBLG-UHFFFAOYSA-N	449.423	1.748	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)cnn1-c1ccccc1F	764006172	LPTBEQZTXSBBGT-UHFFFAOYSA-N	439.403	1.491	50	20	IDGD	
CS(=O)(=O)c1ccc(Oc2ccc(NC(=O)C(=O)NNC(=O)CC3CC3)cc2)cc1	764144672	ZQXYTFWTOGXZOA-UHFFFAOYSA-N	431.470	1.768	50	20	IDGD	
C[C@H]1CN(Cc2cccc(NC(=O)C(=O)NNC(=O)c3ccc(C#N)cc3)c2)C[C@@H](C)O1	764176153	AEURZOORBGQIPD-IYBDPMFKSA-N	435.484	1.567	50	20	IDGD	
CCCNS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)CCc2ccccc2)cc1	764193026	VKUTUFJFZHHYEZ-UHFFFAOYSA-N	432.502	1.094	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)C(=O)Nc2cccn(Cc3ccc(F)cc3)c2=O)c1	764235019	OTANKFLWBIOMTA-UHFFFAOYSA-N	433.399	1.307	50	20	IDGD	
CCOC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)c2cccc3ncccc23)cc1	764257458	HGKRXJAIDVXFGH-UHFFFAOYSA-N	436.424	1.576	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1ccccc1N1CCCCCC1	764275989	VNEMFSVTNCGFQT-UHFFFAOYSA-N	426.473	1.938	50	20	IDGD	
O=C(CCNS(=O)(=O)c1cccs1)NNc1c(F)cc(C(=O)NC2CC2)cc1F	764328718	IHKHKQWLNDARPQ-UHFFFAOYSA-N	444.485	1.730	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)N3CCOCC3)c(Cl)c2)o1	764369957	KGQIGLLMJZTMND-UHFFFAOYSA-N	434.836	1.114	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)N3C[C@H](C)O[C@H](C)C3)cc2)o1	764370944	JRHRWWLVLIGMSM-OKILXGFUSA-N	428.445	1.237	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)C(=O)Nc1ccc(N2CCC(N(C)C)CC2)c(F)c1	764385912	PNWRUJOUUJKQBO-UHFFFAOYSA-N	442.495	1.459	50	20	IDGD	
CC(C)(C)OC(=O)CCC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	764741041	SPHHDFGVLIGOFB-UHFFFAOYSA-N	425.507	1.354	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NN=C3[C@@H]4CCCO[C@@H]4C3(C)C)CC2)cc1	764816885	DOKXYZKEXDQGQT-RXVVDRJESA-N	448.589	1.609	50	20	IDGD	
CSc1ccc(S(=O)(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cc1	765117200	CDYOMJUUXUQPRB-UHFFFAOYSA-N	448.570	1.176	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)C1CCN(C(=O)COc2ccccc2)CC1	765248629	HFOGLJIKDRPBNL-UHFFFAOYSA-N	443.525	1.949	50	20	IDGD	
Cc1cc(C)c(S(=O)(=O)N2CCC(C(=O)NNC(=O)c3cc(C)[nH]n3)CC2)c(C)c1	765586856	KOZQOVRFPYUJLR-UHFFFAOYSA-N	433.534	1.505	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)CNC(=O)Cc2cccc(F)c2)n[nH]1	765591773	AAGBSHUUBJRNPD-UHFFFAOYSA-N	425.420	1.344	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)Cc2csc(N3CCCC3=O)n2)n[nH]1	765595053	DFNQGLDSUKFPLD-UHFFFAOYSA-N	440.485	1.672	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)C[C@@H]3CC[C@@H](C)C3)CC2)cc1	765729364	PJAJFTSQOBCALE-QZTJIDSGSA-N	436.578	1.275	50	20	IDGD	
Cc1nn2cc(S(=O)(=O)NNC(=O)c3nnc(-c4ccccc4)o3)cnc2c1Cl	766321212	UODSNESTSQVBJN-UHFFFAOYSA-N	433.837	1.364	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)CN1CCO[C@H]([C@@H](C)NC(=O)OC(C)(C)C)C1	766946064	XERJTOPNKQWIQJ-AEFFLSMTSA-N	434.537	1.299	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)NC1CCN([C@H]2CCCC[C@H]2O)CC1	767936660	AMNREUKCMRIXGK-LSDHHAIUSA-N	428.331	1.489	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(F)cc2C(=O)N(C)C)o1	768238805	FKEGACXSDJJFEC-UHFFFAOYSA-N	447.467	1.362	50	20	IDGD	
CC1(C)CCC[C@]2(C1)NC(=O)N(CC(=O)NNC(=O)Cc1c[nH]c3ccccc13)C2=O	768565233	FRNDPUUZPLBWPQ-JOCHJYFZSA-N	425.489	1.749	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)N[C@@H]3CCN(c4ncccc4F)C3)nc21	770413354	QFYMLQVMMMDWLL-LLVKDONJSA-N	429.460	1.726	50	20	IDGD	
Cc1cc2c(cc1C)[C@H](C(=O)NNc1ccc(S(=O)(=O)N3CCN(C)CC3)cc1)CO2	771432210	RBOZSAWQQMHJCA-HXUWFJFHSA-N	444.557	1.859	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)CCn2c(C)nc3ccccc32)cc1	771868133	OOZOLELZRXWXBC-UHFFFAOYSA-N	443.529	1.511	50	20	IDGD	
C[C@H]1C[C@@H](NC(=O)NNC(=O)CNC(=O)OC(C)(C)C)CCN1C(=O)OC(C)(C)C	772483559	VEUJLTHLCZUGHD-STQMWFEESA-N	429.518	1.630	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NNC(=O)[C@@H]2CC(=O)N(Cc3ccco3)C2)C1	773411785	RIJVSWLTGVEIKM-HUUCEWRRSA-N	434.493	1.423	50	20	IDGD	
N#Cc1cccc(NNC(=O)C(=O)Nc2c(C(=O)N3CCOCC3)oc3ccccc23)c1	773686333	URUQIHLKBKHSLT-UHFFFAOYSA-N	433.424	1.859	50	20	IDGD	
O=C(NNc1cccc(Cl)c1)C(=O)Nc1cc(C2CC2)nn1[C@H]1CCS(=O)(=O)C1	773736703	UAMRFXUVWDMVPI-AWEZNQCLSA-N	437.909	1.855	50	20	IDGD	
C#C[C@@H](NC(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1)[C@@H]1CCCO1	776226852	ILXFOZFJNHBBOD-UXHICEINSA-N	445.483	1.513	50	20	IDGD	
CCOC(=O)N1CCC[C@@H]([C@@H](C)NC(=O)NNC(=O)CNC(=O)c2cccs2)C1	776866333	DRWQDEWWYJHWLU-CHWSQXEVSA-N	425.511	1.065	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)[C@@H]1CCCCN1C(=O)OCc1ccccc1	778434271	XLIVPVWFHDDLBJ-INIZCTEOSA-N	434.493	1.850	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)C1CCN(c2ccc3cccc(O)c3n2)CC1	778519834	YKPZJNTVWPLMHQ-UHFFFAOYSA-N	443.504	1.829	50	20	IDGD	
Cc1cnn(-c2c(C(=O)NNC(=O)c3cc(Br)ccc3O)c(C)nn2C)c1	779381255	QSPCAUYEDNVGAM-UHFFFAOYSA-N	433.266	1.766	50	20	IDGD	
O=C(NNC(=O)[C@@H](O)[C@@H](O)c1nc2ccccc2s1)c1cc(-c2ccc(F)cc2)[nH]n1	779540566	RXOLQTCUBQGZNP-DLBZAZTESA-N	441.444	1.681	50	20	IDGD	
CC(C)[C@@H](NS(=O)(=O)c1ccc2c(c1)OCCCO2)C(=O)NNc1ccnc(F)c1	781365295	FGXSUSGFYOENGO-GOSISDBHSA-N	438.481	1.828	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2ccc(C)c(S(=O)(=O)N3CCCCCC3)c2)ncn1	783948702	QVDPFKPNDDAYQY-UHFFFAOYSA-N	446.533	1.740	50	20	IDGD	
CC(C)(C)Oc1c(F)cc(NC(=O)C(=O)NNC(=O)CNC(=O)c2ccco2)cc1F	784002040	JYBVCYGZXOCVGE-UHFFFAOYSA-N	438.387	1.251	50	20	IDGD	
Cc1cc(Br)cc(C)c1NC(=O)C(=O)NNC(=O)CNC(=O)c1ccco1	784004065	HWOPGNNZORMNRA-UHFFFAOYSA-N	437.250	1.175	50	20	IDGD	
CC(C)c1nc2ccc(NC(=O)C(=O)NNC(=O)CNC(=O)c3cccs3)cc2s1	784004328	WSNABDWJZJQOED-UHFFFAOYSA-N	445.526	1.997	50	20	IDGD	
Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	784210202	IAGQISGPGLEVJT-UHFFFAOYSA-N	447.473	1.734	50	20	IDGD	
CCOC(=O)C(C)(C)n1cc(NC(=O)C(=O)NNc2ccc(OC(F)F)cc2)cn1	784307823	IZBDHRLENHDAJW-UHFFFAOYSA-N	425.392	1.865	50	20	IDGD	
O=C1C[C@@H](Cc2ccc(NC(=O)C(=O)NNc3ccc([N+](=O)[O-])cc3Cl)cc2)C(=O)N1	784392893	PSTNRXVLBZXMMU-LLVKDONJSA-N	445.819	1.535	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)F)cc1)C(=O)Nc1ccc(-n2cccn2)cc1	784834892	BGPHKMIOHOJYRB-UHFFFAOYSA-N	435.412	1.950	50	20	IDGD	
COC(=O)c1c(C2CC2)csc1NC(=O)C(=O)NNc1cccc(S(C)(=O)=O)c1	784844894	SOXOSVZUYPOYQJ-UHFFFAOYSA-N	437.499	1.897	50	20	IDGD	
CN(NC(=O)Nc1nc2c(s1)COCC2)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	785849741	PCDXCGZPFRFQIW-UHFFFAOYSA-N	440.526	1.857	50	20	IDGD	
CCOC(=O)c1cnn(C)c1NC(=O)C(=O)NNc1ncc(C(F)(F)F)cc1Cl	786422466	KITUIOGJGUCBGM-UHFFFAOYSA-N	434.762	1.746	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCc2nccn2C1)c1nn(Cc2ccccc2)c(=O)c2ccccc12	786687936	PWDWGABBYZQFIQ-KRWDZBQOSA-N	442.479	1.665	50	20	IDGD	
Cc1ccc(-c2nnc(S)n2CCC(=O)NNc2ccccc2S(N)(=O)=O)cc1	788228239	JBBUAXNMWFZIMX-UHFFFAOYSA-N	432.531	1.723	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@@H]2C[C@H]2c2ccc(F)cc2)cc1	789309203	TVWUCDULVBETIP-ZWKOTPCHSA-N	434.493	1.641	50	20	IDGD	
Cc1nc2nc(N)nn2c(C)c1CCC(=O)NNC(=O)c1ccc(COc2ccccc2)o1	789449288	ARUQUNDKRDTDOM-UHFFFAOYSA-N	449.471	1.889	50	20	IDGD	
COC(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)c1	789811134	VHESTTSJATYIIO-HKUYNNGSSA-N	425.441	1.061	50	20	IDGD	
COc1ccc([C@]2(C)NC(=O)N(CC(=O)NNc3cccc(F)c3[N+](=O)[O-])C2=O)cc1	790589443	ZFAWGJDGELBXLY-IBGZPJMESA-N	431.380	1.653	50	20	IDGD	
O=C(CCSc1ccc(F)cc1)NNC(=O)C(=O)Nc1cccc(N2CCC2=O)c1	790951074	CEZAOASVOODXFL-UHFFFAOYSA-N	430.461	1.831	50	20	IDGD	
C=C(CBr)CN1CCN(S(=O)(=O)c2c(C)oc(C)c2C(=O)OC)CC1	791472747	HQJPYEZEJZOOHK-UHFFFAOYSA-N	435.340	1.940	50	20	IDGD	
COc1cccc(C2=NO[C@H](C(=O)NNC(=O)C(=O)NCc3ccc(Cl)cc3)C2)c1	792294226	MILIIVBRSLZCPM-KRWDZBQOSA-N	430.848	1.305	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)N2CCC(N(CC(F)(F)F)S(C)(=O)=O)CC2)n1	793229018	UIBXHFLHSBTNGQ-UHFFFAOYSA-N	437.444	1.033	50	20	IDGD	
COc1c(C(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)cccc1[N+](=O)[O-]	793519873	STURSGSWXBOVSP-UHFFFAOYSA-N	437.453	1.947	50	20	IDGD	
Cc1ccc(-c2cccnc2)cc1NC(=O)C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	797001133	XTEKPYCIIZCPSV-UHFFFAOYSA-N	442.439	1.432	50	20	IDGD	
COC(=O)c1ccc(S(=O)(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)cc1OC	799123881	JZLAONWCBGRDPT-LLVKDONJSA-N	442.877	1.912	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)C1(c2ccc(I)cc2)CC1	800318862	RJGREMPZJGRTRV-JTQLQIEISA-N	430.242	1.812	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN2C(=O)c3ccc(F)cc3S2(=O)=O)cc1C	801666075	VDIBLCBFTLEXGZ-UHFFFAOYSA-N	425.463	1.364	50	20	IDGD	
CC(=O)N1CCCC[C@H]1C(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	802762375	DNAJBJPXHWGESA-IBGZPJMESA-N	435.956	1.006	50	20	IDGD	
CCOC(=O)C(C)(C)c1csc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)n1	806972673	GDSOMUOXBZCOEA-UHFFFAOYSA-N	448.457	1.112	50	20	IDGD	
CC(=O)C(=O)COC(=O)/C(C#N)=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	808484313	AQYNTZVSTQJZEC-ZSOIEALJSA-N	428.832	1.687	50	20	IDGD	
C#CC[C@@]1(C(=O)NNc2nccc(N3CCOCC3)n2)CCCN1C(=O)OC(C)(C)C	809722476	YURZGOINJDLLPT-NRFANRHFSA-N	430.509	1.549	50	20	IDGD	
Cc1cc(C(F)(F)F)nn1CC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	809937611	CQHICRJQTCGEPE-UHFFFAOYSA-N	438.454	1.570	50	20	IDGD	
Cn1nc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1C1CC1	810278165	DDUHRGFLVQCYBU-UHFFFAOYSA-N	432.506	1.549	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2cc(Br)ccc2O)cc1	810449554	URWDLAMZCAMGEO-UHFFFAOYSA-N	442.291	1.203	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)[C@@]1(c2ccccc2)CNC(=O)C1	811239174	VMPRQAURQHAIAK-OAQYLSRUSA-N	445.859	1.111	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@@H]2CCC[C@@H]3CN(C(C)=O)C[C@@H]32)c2ccccc2c1=O	812435071	YCMQBPAPYUDAQK-FHLIZLRMSA-N	440.504	1.007	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(\C#N)C(=O)NS(=O)(=O)c2cncc(C#N)c2)c1C	813982489	LAJPNMYDTRIRKH-AVWXOPBPSA-N	427.486	1.991	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NN=C1CCS[C@@H]1C)N(S(C)(=O)=O)CC2	814759091	QISWTLXMLUQSLC-MLGOLLRUSA-N	441.575	1.950	50	20	IDGD	
COc1ccc(Cl)c(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)N(C)C)c1	815752475	UFRZILZLQXYYPV-UHFFFAOYSA-N	426.882	1.681	50	20	IDGD	
O=C1CC[C@](C(=O)NNC(=O)COc2ccc(Br)cc2)(c2ccccc2)CN1	816810357	JENAUGZBVVTOFC-HXUWFJFHSA-N	446.301	1.823	50	20	IDGD	
O=C(CC12CC3CC(CC(C3)C1)C2)NNS(=O)(=O)c1cc(C(=O)O)cc(C(=O)O)c1	831971730	UVIIOCXYPKWYTE-UHFFFAOYSA-N	436.486	1.999	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)NNC(=O)c2cc3c(s2)CC[C@H](C)C3)ccc1OC	913162434	HZBWUGMFWHNPTC-NSHDSACASA-N	437.543	1.864	50	20	IDGD	
COc1ccc(C(=O)NCC(=O)NNC(=O)CNc2ccc(C)cc2C)cc1[N+](=O)[O-]	913164902	YUTWTPOTYPMGSW-UHFFFAOYSA-N	429.433	1.210	50	20	IDGD	
CCn1c(=O)nc(O)c2c(C(=O)NNC(=O)COc3ccc(C)cc3)cc(C3CC3)nc21	914323950	FWAHFLOPTXDNLF-UHFFFAOYSA-N	437.456	1.543	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1cnn(C)c1C(F)(F)F	915572797	JEKRDXZYDUSCQI-UHFFFAOYSA-N	434.758	1.719	50	20	IDGD	
CCn1c(O)nc2cc(C(=O)NNC(=O)c3cc(-c4ccc(C)cc4)[nH]n3)ccc2c1=O	917177000	MQKLEDMVIGSNQT-UHFFFAOYSA-N	432.440	1.895	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)N[C@H](C)CN2CCCC2=O)c2ccccc2c1=O	918100018	HLAPFCORJXUNFF-OAHLLOKOSA-N	442.520	1.542	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1c[nH]nc1-c1ccncc1	919425350	PLMOWUCTZXAHOO-UHFFFAOYSA-N	429.820	1.752	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)c1ccc2c(c1)C(=O)N(C[C@H]1CCCO1)C2=O	919819943	AHQUEBHFJRLGQZ-MRXNPFEDSA-N	437.452	1.474	50	20	IDGD	
COc1cccc(/C=C(\C(=O)NNC(=O)c2ccc3ccccc3n2)n2nnnc2C)c1	920395918	POIAOFQYSLGKOW-DEDYPNTBSA-N	429.440	1.998	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)CN3CCCC3=O)c2)cc1	920827813	YPFUYBXKOLSJNN-UHFFFAOYSA-N	430.486	1.179	50	20	IDGD	
O=C(COC(=O)c1cccnc1SC(F)F)NNC(=O)[C@@H]1COc2ccccc2O1	921160331	MERSSORGODHMOZ-ZDUSSCGKSA-N	439.396	1.541	50	20	IDGD	
Cn1nc(Br)c2c(=O)n(CC(=O)NNC(=O)c3ccccc3Cl)cnc21	1115960524	VAEIULDFWPQUIT-UHFFFAOYSA-N	439.657	1.007	50	20	IDGD	
O=C(CNC(=O)c1c[nH]c2ccccc2c1=O)NNC(=O)c1ccc(Br)cc1	1317873375	KHOHLELVEHWDIF-UHFFFAOYSA-N	443.257	1.482	50	20	IDGD	
CN(NS(=O)(=O)c1ccc(CC#N)cc1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	1320793650	WOKBMNASVUUSIW-UHFFFAOYSA-N	437.522	1.550	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNS(=O)(=O)c1ccc(NC(C)=O)c(F)c1	1324901126	RTDTYJJXCDEBPH-UHFFFAOYSA-N	425.438	1.571	50	20	IDGD	
CNS(=O)(=O)c1ccc(CC(=O)NNC(=O)[C@@H](C)Oc2ccc3ccccc3c2)cc1	1325405632	OTDDHDUOAPBGBA-OAHLLOKOSA-N	441.509	1.905	50	20	IDGD	
COc1c(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)cnn1-c1ccccc1	1338191052	YDGMSFOTYIKAGG-UHFFFAOYSA-N	428.474	1.249	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1)c1nnnn1C	1348020117	WUHFDWBBWGZJHQ-HNAYVOBHSA-N	434.504	1.229	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4nonc4c3)C2)C1	1777721501	KBAXQKZHKXAWNT-UGSOOPFHSA-N	437.294	1.840	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cc(-c3ccncc3)[nH]n1)CCO2	1779299190	UXXHYIHYSDUALC-OAQYLSRUSA-N	443.580	1.767	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccnc(OC)c3)C2)C1	1779562380	LQHNDIHUZOHZTC-KDOFPFPSSA-N	426.311	1.707	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(C)cc3-n3nccn3)C2)C1	1780245548	RILSFOSBEJLCAY-DYESRHJHSA-N	447.923	1.273	50	20	IDGD	
CN(C)c1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)cn1	1781229611	GNSZBFOSHLZBOP-RBUKOAKNSA-N	429.348	1.827	50	20	IDGD	
O=C(C1Cc2ccccc2C1)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781337212	QEZPRRRBEDPQQW-APWZRJJASA-N	425.298	1.922	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(C)c(NC(C)=O)c3)C2)C1	1781913359	CGVKJSDBQKILAD-LAUBAEHRSA-N	437.924	1.651	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)Oc2cccnc2)C1	1782573670	MVVCAYZSBDQJIF-LNNXQNCSSA-N	439.940	1.617	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cn(C)c4ncccc34)CCO2)C1	1783534716	YFNFEMYREQZLDA-DJJJIMSYSA-N	435.322	1.800	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cncc4cnccc34)CCO2)C1	1783535625	AXGGHUZXZIOOEB-DJJJIMSYSA-N	433.306	1.857	50	20	IDGD	
O=C(c1ccc([N+](=O)[O-])c2c1OCO2)N1CCO[C@@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783948169	DEGLDCIWWZFOHZ-QGZVFWFLSA-N	446.243	1.571	50	20	IDGD	
CCn1nccc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)CBr)C[C@@H]21	1786177833	HKPAEGUHDJVXRI-HOSILWTGSA-N	427.343	1.527	50	20	IDGD	
CNCCCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C[C@@H]21	1786855144	ODMVKEWSOYYXJF-VWZYDEGLSA-N	446.498	1.851	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3occc3C)[C@H]2C1	1787561330	MDQSAVTYEIQJHW-SMKMMKTPSA-N	441.488	1.315	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4nn(C)cc4c3)[C@H]2C1	1790354242	SWRIHRGWNDKLQC-GKEYINFOSA-N	449.349	1.950	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)c3ccccc3)C[C@@H]21	1790961472	LRQCJJLQKCXLSL-JCECYMMASA-N	439.350	1.873	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]3C2)c(O)n1	1791058661	AOPVEBVEKKYKIJ-DHMWGJHJSA-N	426.311	1.472	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3ccc(OC)cc3)C[C@@H]21	1791251427	GQLCXFQZKUIYLL-LEAZDLGRSA-N	438.952	1.861	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1c(Cl)cncc1Cl)c1ccc(B(O)O)cc1	1792460203	AVRLOXOEZZVTEM-QDMKHBRRSA-N	448.115	1.634	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(Cl)nc1F	1794246308	CROLLOAWNQRTFS-XHSYRHOGSA-N	434.693	1.861	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCBr)cc1	1795116854	AJPMRSPQAIOXLE-JLVBRIDZSA-N	438.322	1.633	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CNC(=O)c1ccco1	1796284066	HOSLGCFMIFQSIK-YIYPIFLZSA-N	426.311	1.679	50	20	IDGD	
CC(C)N(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Cl)C(=O)OC(C)(C)C	1796361846	WAXQOGCMEAQKIC-OCVGTWLNSA-N	435.924	1.756	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1	1796935050	RGOUFPPSTSTIPT-XLNGHYISSA-N	432.908	1.671	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(Br)ncc1F)[C@H](O)CCl	1797092632	KGAYCBFXOGSAPO-BSTOTGJRSA-N	434.693	1.835	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)NC(=O)c1ccc(F)cc1	1799050060	FXRFNRNOTWCAJQ-QMQAMEMWSA-N	439.915	1.551	50	20	IDGD	
CN(C)c1cncc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Br)c1	1799348006	XNFFEIDJYAQSPR-NEBZKDRISA-N	429.290	1.041	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(=C/c1ccco1)NC(C)=O	1799685016	OZSCAUPDJVPMKP-KPNYYRNQSA-N	437.924	1.754	50	20	IDGD	
C[C@@H](NC(=O)OCc1ccccc1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](O)CCl)C2	1801942882	QVIGLRMXACWESW-LHKMKVQPSA-N	437.924	1.539	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1c[nH]c3nccc-3c1Cl)C2	1802332784	HMDIFJYLOOPMCC-BTTYYORXSA-N	446.939	1.793	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](CCN)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C(Cl)Cl	1802340538	IVPAEHUCYSONBY-YVECIDJPSA-N	437.368	1.670	50	20	IDGD	
Cc1nn[nH]c1C(=O)N1CC[C@H](CNC(=O)[C@H](C)CBr)[C@@H]1c1cccnc1	1803009810	XZRKKAULULOHRW-XFJVYGCCSA-N	435.326	1.859	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H]2COc3ccccc3O2)[C@H]1c1cccnc1)[C@H](O)CCl	1803135592	FIJFKANWAVULJM-JSJNYSNDSA-N	445.903	1.527	50	20	IDGD	
CCc1[nH]nc(C(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)c1Cl	1803139356	XMENLVGWMYGGAY-IFIJOSMWSA-N	440.331	1.940	50	20	IDGD	
CN1N=C(C(=O)NC[C@@H]2CCN(C(=O)CO[Si](C)(C)C)[C@H]2c2cccnc2)CCC1=O	1804120569	KADZJECWCMUSRZ-JXFKEZNVSA-N	445.596	1.547	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1Cc2ccccc2C1	1804543079	LMVAIMDJYLSQES-REPLKXPHSA-N	433.512	1.352	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)CCc2ccco2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807362610	LPZHLRMJPNWSRC-XXBNENTESA-N	447.300	1.307	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CS(=O)(=O)N2CCCC2)[C@H]1c1cccnc1)[C@@H](F)Cl	1808313348	WRTNUKPQDWDITE-BHYGNILZSA-N	446.932	1.047	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)[C@@H]2CCC(=O)N2C)[C@H]1c1cccnc1	1808777006	AKBAMUHTQNIESK-NZUILWFCSA-N	437.338	1.492	50	20	IDGD	
O=C(c1ccnc(Cl)c1)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1	1809968303	RCXXWJAIRMLMGE-UHFFFAOYSA-N	441.724	1.573	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2cc3cn[nH]c3cn2)[C@@H]1c1cccnc1	1813031385	MBEVCHKJVPGCAC-URLQWDBASA-N	442.907	1.926	50	20	IDGD	
O=C(CCN1CCOCC1)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](F)Br)CC2	1814643361	BVFBZWPFUOEORF-IINYFYTJSA-N	449.346	1.468	50	20	IDGD	
Nc1c(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)[C@H](O)CCl)n[nH]2)sc2nccnc12	1814870256	MSVQPFLJROCDNK-GHMZBOCLSA-N	449.924	1.902	50	20	IDGD	
CCC[C@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](O)NC(=O)OCC)[nH]n1	1815320159	VYJFYTJVCXHDJD-RBOXIYTFSA-N	429.905	1.874	50	20	IDGD	
Cc1cccnc1C(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1	1815337220	OYVCYVSKHPOKII-HNNXBMFYSA-N	436.302	1.066	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)Cn3cncn3)sc2C1	1815670319	HRKAPFCXLAIYFA-ZJUUUORDSA-N	427.328	1.520	50	20	IDGD	
C=CC[C@@H](C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819403844	ILXBJRJHOPRRNM-CXAGYDPISA-N	425.493	1.926	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)C(=O)Nc2cccnc2)n[nH]1	1819530810	FTLSUNULXBSKKQ-ZFWWWQNUSA-N	434.884	1.689	50	20	IDGD	
C[C@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@](C)(Cl)CCl)n[nH]1)n1cnnn1	1820869623	XDFQXLYNOHUWGC-SIVJFFJCSA-N	429.312	1.886	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1)c1cnc2c(c1)CCNCC2	1821698770	OIFCVEAUCSLHII-ROUUACIJSA-N	446.939	1.399	50	20	IDGD	
O=C(N[C@@H]1CCc2nc(NC(=O)c3ccccc3F)sc2C1)c1ccc(B(O)O)cc1	1821848285	ANAUARSDHISUFX-CQSZACIVSA-N	439.277	1.502	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1	1822117002	FMRRJERNRSKNFP-QWHCGFSZSA-N	429.905	1.526	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(Cl)ncn2)[nH]n1	1822414380	DCKPPXGBFQCFOH-AWEZNQCLSA-N	448.915	1.532	50	20	IDGD	
Cc1nocc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1	1826041862	IDWVNHBIZXHLFS-HXUWFJFHSA-N	425.294	1.210	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)Cc1ccncc1)CC2	1826088225	CGMSCAMOUKJOHE-CQSZACIVSA-N	430.534	1.066	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnc(O)nc2O)CC1	1827592353	SWRFMMIFAPVQLX-SMDDNHRTSA-N	441.326	1.905	50	20	IDGD	
C[C@@]1(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)CC2)CC1(F)F	1828925271	IDWXBNWTQPROSQ-UTKZUKDTSA-N	449.502	1.964	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)n3ccccc3=O)C2)C1	1831651519	QJSKNKZSHWJPPY-XGHQBKJUSA-N	439.940	1.273	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3cccc(C)c3)CCO2)C1	1832244045	YWBXWVORQKVZRL-KNQAVFIVSA-N	438.952	1.638	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3cc(F)ccn3)CCO2)C1	1832845443	WMGUQENDJUTCAI-OAQYLSRUSA-N	441.931	1.875	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(CN(C(=O)CCc3cccs3)CCO2)C1	1833157775	SVAZADKESLZGBJ-HXUWFJFHSA-N	440.638	1.989	50	20	IDGD	
C[C@H](Cn1cccn1)C(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1833191611	OZSVUKUVNKQNRP-OXQOHEQNSA-N	426.945	1.241	50	20	IDGD	
N#Cc1cccc(CCC(=O)N2CCC(N3CCC(NC(=O)[C@@H](O)CCl)CC3)CC2)c1	1833305858	AGXVZVIXBRVGLQ-NRFANRHFSA-N	446.979	1.662	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3[nH]ccc3C)CCO2)C1	1833547415	BAXJTYXHSQLVGQ-RDTXWAMCSA-N	428.327	1.567	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ncc(OC)cc3F)CCO2)C1	1833634776	ZVTQGWOHEWLMBZ-KUHUBIRLSA-N	429.876	1.317	50	20	IDGD	
O=C(CCBr)NC1CCN(C2CCN(C(=O)CCn3cncn3)CC2)CC1	1834423524	PHOOVSPWZXWNBZ-UHFFFAOYSA-N	441.374	1.025	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3ccc(OC)cn3)CC2)CC1	1835255827	OMPGSXQLEOFRLZ-GOSISDBHSA-N	438.956	1.529	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3ccnn3C(C)C)CC2)CC1	1835947879	CRGBIPLDWZILMD-GOSISDBHSA-N	439.988	1.903	50	20	IDGD	
CN1CCC[C@@H](C(=O)NC2CCN(C3CCN(C(=O)CO[Si](C)(C)C)CC3)CC2)C1	1836350200	BHOGLHMEWAHNHD-GOSISDBHSA-N	438.689	1.751	50	20	IDGD	
O=C(c1ccc([N+](=O)[O-])[nH]1)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836718579	ULMCCFHAGBJUKO-HNNXBMFYSA-N	428.873	1.135	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3c(C)nc4sccn34)CCO2)C1	1837145528	XPMHGCSVNYPWDJ-IFXJQAMLSA-N	440.953	1.792	50	20	IDGD	
Cc1nc(C(=O)N2CCC(OC3CCN(C(=O)C(Cl)Cl)CC3)CC2)c(=O)[nH]c1C	1837266785	NYSHSSFLDTWEPZ-UHFFFAOYSA-N	445.347	1.803	50	20	IDGD	
C=C[C@H](O)C(C)(C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1	1837400870	QGKPLMBSBRSMSR-KYNGSXCRSA-N	437.364	1.252	50	20	IDGD	
O=C(c1ccc(OCCCO)cc1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1838547564	FTHBXEMHJYGFHL-PXNSSMCTSA-N	444.887	1.052	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(C#N)cc3)CCO2)C1	1838953206	RQULWHCYKYWKBO-AUUYWEPGSA-N	436.306	1.412	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(OC)cc3F)C2)C1	1839147282	MDHZUGLSCGDTHM-OXQOHEQNSA-N	428.888	1.922	50	20	IDGD	
C[C@H](C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2)n1cccc1	1839154877	APMSLULRIBPVNC-MNEFBYGVSA-N	432.348	1.742	50	20	IDGD	
O=C(c1cc(O)ccc1F)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1839295949	AKNSIKROVJIGRT-PBHICJAKSA-N	449.248	1.292	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(O)ccc3F)CCO2)C1	1839296059	GLNOIQXEAAGVPU-RBUKOAKNSA-N	449.306	1.838	50	20	IDGD	
O=C(Cc1noc2ccccc12)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840188184	TWEUPEQMONYOFY-LJQANCHMSA-N	442.299	1.630	50	20	IDGD	
Cc1ccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)o1	1840508488	COWWLZGSXXSQNY-KDOFPFPSSA-N	429.311	1.370	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccc(OC)c(F)c3)CCO2)C1	1840526133	ABHFJHLQBKIHQM-KKSFZXQISA-N	442.915	1.851	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)CC[C@@H]2CNc3ccccc3C2)C1	1842955425	YWQLPIPORVSSQS-SFHVURJKSA-N	447.344	1.248	50	20	IDGD	
COC(=O)[C@@H](CC(=O)N1CC2(CCCN2C(=O)[C@@H](F)Cl)C1)NC(=O)OC(C)(C)C	1843366916	XWRZXWHZKLZGND-DGCLKSJQSA-N	435.880	1.181	50	20	IDGD	
C[C@H](C(=O)N1CC2(CCCN2C(=O)c2cnccc2C(=O)NN)C1)c1ccc(Cl)cc1	1844263343	UONFKIPSFKMGSF-AWEZNQCLSA-N	441.919	1.959	50	20	IDGD	
COc1cc(F)c(C(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)c(F)c1	1844264864	RZGSZPRYQVRAKZ-UHFFFAOYSA-N	445.426	1.103	50	20	IDGD	
Cc1c[nH]cc1C(=O)N1CC2(CCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)C1	1845038723	LQIYCWVVWACREE-UHFFFAOYSA-N	438.532	1.486	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(C(=O)N2CC3(CCCN3C(=O)[C@H](F)Br)C2)C1	1845218352	ZCWUYMPOMQTXHO-LBPRGKRZSA-N	434.306	1.747	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2ccc(CC#N)cc2)C1	1845411797	OIULWTMABRICQB-WGOQTCKBSA-N	432.484	1.704	50	20	IDGD	
O=C([C@H](F)Br)N1CC2(CCCN2C(=O)c2cnc3c(c2)CCNCC3)C1	1845797661	GVJZCLGPUWMGLM-HNNXBMFYSA-N	425.302	1.277	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC12CN(C(=O)c1ccc3c(c1)n(C)c(=O)n3C)C2	1846176927	NKGLXFXVUSAUNU-GFCCVEGCSA-N	435.322	1.477	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)Cc2cc(F)ccc2F)C1	1846970782	SFRHLCOFFWCQHJ-VULFUBBASA-N	443.454	1.845	50	20	IDGD	
CC(C)NC(=O)CSc1ccccc1C(=O)OCC(=O)NNC(=O)c1cccs1	12423114	QXANRWIQRGFUMQ-UHFFFAOYSA-N	435.527	1.983	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@@H]1COc2ccc(Cl)cc2C1	16053060	RKBXJRPNJITIGM-ZDUSSCGKSA-N	436.921	1.954	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	726249393	WTDGSFITTMENNA-KRWDZBQOSA-N	429.546	1.721	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=S)N[C@@H](C)c2cccs2)cc1	726438471	WVQOBAZRDPBWGP-ZDUSSCGKSA-N	426.589	1.934	50	20	IDGD	
O=C(NNC(=S)NCCc1cccnc1)c1ccc(S(=O)(=O)N2CCCC2)cc1	727691298	PRKSHVCRHQBQNU-UHFFFAOYSA-N	433.559	1.218	50	20	IDGD	
COc1ccc(C(=O)NNc2nc(-c3cccnc3)no2)cc1S(=O)(=O)NC(C)C	728078862	YVNDLNXQETVZHW-UHFFFAOYSA-N	432.462	1.584	50	20	IDGD	
C[C@@H]1CCCN(S(=O)(=O)c2ccc(C(=O)N([C@H]3CCS(=O)(=O)C3)N(C)C)cc2)C1	728179353	JTJWKHMQWXOAEQ-WBVHZDCISA-N	443.591	1.213	50	20	IDGD	
C[C@]1(c2ccc3ccccc3c2)NC(=O)N(CC(=O)NNC(=O)c2cccc(C#N)c2)C1=O	728827141	JQQLTUDBWOXNEM-XMMPIXPASA-N	441.447	1.940	50	20	IDGD	
CCOc1ccccc1C(=O)NCC(=O)NNc1ccc(S(=O)(=O)C(F)F)cc1	728974138	GIFMEWRRLDOZRF-UHFFFAOYSA-N	427.429	1.955	50	20	IDGD	
COC(=O)N(C)CCCC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	729295412	IAURBOYJBCJIJI-UHFFFAOYSA-N	440.522	1.101	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H](C(C)C)N2CCCCC2)c1	729295872	PISFZMILMYSMTF-IBGZPJMESA-N	438.594	1.989	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NCCOc2ccccc2C(F)(F)F)c2ccccc2c1=O	730125625	XZTVJUBWCUTXBG-UHFFFAOYSA-N	449.389	1.975	50	20	IDGD	
COc1cc(C)cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)c1O	730271571	BVFOHZYIOKPJLI-UHFFFAOYSA-N	447.513	1.959	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)[C@@H]1CCCN(S(=O)(=O)Cc2ccccc2)C1	730483634	DOKCUTIQNSXUQM-LJQANCHMSA-N	445.541	1.627	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCN(c2ccc3c(c2)OCCO3)C1=O)c1cccc(OC(F)F)c1	730545537	JDGOLQFUCXZALX-OAHLLOKOSA-N	447.394	1.873	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)c1ccc2c(=O)n(-c3ccccc3F)c(S)nc2c1	732084637	TZJYOAPEFRDPMI-UHFFFAOYSA-N	438.444	1.920	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)c1	732264457	RWXXUVJQMKKXMI-AWEZNQCLSA-N	447.473	1.529	50	20	IDGD	
COc1cc(C(=O)NNc2nc3ccccc3c(=O)n2C)cc(Cl)c1OCC(N)=O	733263449	BOOFLXMCRKMDEV-UHFFFAOYSA-N	431.836	1.217	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)N[C@H]2CCC[C@H](C(=O)N(C)C)C2)c2ccccc2c1=O	734223938	RVKDAJHVRJVELN-GJZGRUSLSA-N	442.520	1.568	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)c1ccc(-c2nc(=O)o[nH]2)cc1	734252222	JCVBSBXLCYEOBP-UHFFFAOYSA-N	431.474	1.864	50	20	IDGD	
COc1ccc(CN2CC[C@@H](NC(=O)NNC(=O)Cn3ccc4ccccc43)C2=O)cc1	734527400	SOBQDPPTETYNNT-LJQANCHMSA-N	435.484	1.781	50	20	IDGD	
CCCCN1C(=O)CC[C@@H](C(=O)NNC(=O)c2cnn(C)c2)[C@H]1c1ccccc1OC	735445954	KVIBKLDOSAGDIT-YLJYHZDGSA-N	427.505	1.970	50	20	IDGD	
COc1ccc(Cn2ncc3cc(C(=O)NNC(=O)c4cnn(C)c4)cnc32)c(OC)c1	735446065	SURCSEMVXSAOAX-UHFFFAOYSA-N	435.444	1.305	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)[C@H](C)N2CCc3ccccc3C2)cc1OC	735958712	KHPBVKYSWHEEEK-HNNXBMFYSA-N	441.484	1.455	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)C[C@H]1CCCN1C(=O)OC(C)(C)C	742676620	JXEXKICXYUAMFG-CYBMUJFWSA-N	429.518	1.631	50	20	IDGD	
COc1ccc(CC(=O)O)cc1S(=O)(=O)NNC(=O)c1cccc(Br)c1	743264178	QFKBABJEXRPPEF-UHFFFAOYSA-N	443.275	1.708	50	20	IDGD	
CCn1c(CNC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)nc2ccccc21	743505968	JTWYRKUMWYDPFE-UHFFFAOYSA-N	430.490	1.996	50	20	IDGD	
CC(C)(C)OC(=O)NCCCNC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	743589569	KFHPVPWHXYYUSS-UHFFFAOYSA-N	429.499	1.341	50	20	IDGD	
CCOc1ccccc1C(=O)N1CCN(CC(=O)NNC(=O)c2ccc(C#N)cc2)CC1	744387421	RWBNQCVFNYTCHL-UHFFFAOYSA-N	435.484	1.176	50	20	IDGD	
COc1ccc(Cl)cc1CN1CCN(CC(=O)NNC(=O)c2cccc(C#N)c2)CC1	744387772	XGCIWWTUWPBWAG-UHFFFAOYSA-N	441.919	1.799	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)O[C@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)cc(C#N)n1C	744632666	MTJLSZSAOWBBCJ-ATDKOCKZSA-N	441.469	1.330	50	20	IDGD	
CN1C(=C(C#N)C(=O)COC(=O)c2cn(Cc3ccccn3)nn2)N(C)c2ccccc21	745579289	PXHWQXCPYZDVRL-UHFFFAOYSA-N	429.440	1.769	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1cc([N+](=O)[O-])ccc1O)[C@H]1CN(Cc2ccccc2)CCO1	745836585	UAJWEIVKSBNZFZ-AUUYWEPGSA-N	443.460	1.534	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1)[C@@H]1CCOC1	745861338	KHQDYTTVZBHVAT-QWHCGFSZSA-N	438.531	1.918	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CCc2c(C)nc3c(c(O)nn3C)c2C)cc1OC	746092579	XXDBPCRAMKWSAH-UHFFFAOYSA-N	427.461	1.702	50	20	IDGD	
C[C@H](CC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)C(=O)c1cccc(F)c1	746093165	DAFVJPFHBHCVCV-CYBMUJFWSA-N	435.477	1.746	50	20	IDGD	
O=C(CCOc1ccccc1)NNC(=O)[C@@H]1CC(=O)N(c2ccc3c(c2)OCCO3)C1	747181116	LDCITINLXPUIEC-OAHLLOKOSA-N	425.441	1.427	50	20	IDGD	
O=C(Cc1ccncc1)NN=C1C(=O)N(Cc2ncon2)c2ccc(Br)cc21	747641155	XLSPKBQYKWPNQN-UHFFFAOYSA-N	441.245	1.837	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NNc2cccc(C#N)c2)o1	748031568	WMDMJYGUJDIHGU-HNNXBMFYSA-N	432.458	1.624	50	20	IDGD	
Cn1ncc2c(O)nc(CCC(=O)NNc3nc(-c4ccccn4)nc4c3CCC4)nc21	748337263	CRMXUUHCCMGQRR-UHFFFAOYSA-N	431.460	1.486	50	20	IDGD	
NS(=O)(=O)c1ccc(CC(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)s1	748828854	NFWZZXJZVWXSFS-UHFFFAOYSA-N	430.458	1.252	50	20	IDGD	
COc1ccccc1N1CC[C@@H](CNC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)C1	749932231	RQDRBMOJISCJKY-YWZLYKJASA-N	426.473	1.692	50	20	IDGD	
Cc1cc(F)ccc1-n1cc(O)c(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)n1	751189017	QZBOYNUMLOHZDS-UHFFFAOYSA-N	446.464	1.393	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)[C@@H]1CCCCN1C(=O)OCc1ccccc1	751212325	QLYUKARBIAFHQI-INIZCTEOSA-N	444.513	1.817	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2ccc(Cl)cc2Cl)n([C@H]2CCS(=O)(=O)C2)n1	751359528	WHDWHYRHCXRYRF-NSHDSACASA-N	446.316	1.940	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)c2cc(S(N)(=O)=O)cc(Cl)c2F)c1	751809560	XLEVNPODJRNGHF-UHFFFAOYSA-N	443.840	1.053	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)NCC1(CN2CCOCC2)CCCCC1	751810779	VXAFRQZWPXJCNM-UHFFFAOYSA-N	449.508	1.587	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CN2CCCC[C@H]2c2nnc(C3CCOCC3)o2)c1	752925501	MXZHENOWDQPASO-SFHVURJKSA-N	438.488	1.823	50	20	IDGD	
NC(=O)c1ccc(CNC(=O)NNC(=O)COc2ccc(OCc3ccccc3)cc2)o1	753015701	HMPVFRJZJFGMIX-UHFFFAOYSA-N	438.440	1.867	50	20	IDGD	
COC(=O)c1cc(Cl)ccc1S(=O)(=O)NNC(=O)c1cc([N+](=O)[O-])ccc1O	753780652	UCBDSQMHOJZUMH-UHFFFAOYSA-N	429.794	1.364	50	20	IDGD	
O=C(NNc1ccc(-c2ccccc2)nn1)c1ccc(S(=O)(=O)N2CCOCC2)cc1	754471078	WIZGXIITIWTVMF-UHFFFAOYSA-N	439.497	1.921	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2nnc(CC(C)C)s2)cc1	755410955	HJTIEOSLUGCVBP-UHFFFAOYSA-N	440.551	1.518	50	20	IDGD	
CCCCNS(=O)(=O)c1cccc(NC(=O)NNC(=O)c2ccc3c(c2)OCO3)c1	755537538	VKDKGHYQTZNAPG-UHFFFAOYSA-N	434.474	1.960	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1cccc(-n2ccnn2)c1	756267207	WXJCBNBWNAJJEF-UHFFFAOYSA-N	429.820	1.547	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)Nc1cnn(CC(F)F)c1	756707563	ZJEFISADIJTUFB-UHFFFAOYSA-N	442.448	1.399	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)Nc2cnn(CCN3CCOCC3)c2)cc1	756826208	CECRTGWYAHARQG-MRXNPFEDSA-N	444.492	1.038	50	20	IDGD	
CCOCCOc1ccc(Br)cc1NC(=O)NNC(=O)Cc1cc[nH]n1	757984723	HUCFLXNPGXMGCW-UHFFFAOYSA-N	426.271	1.983	50	20	IDGD	
Cc1ccc(C23C[C@H]4C[C@@H](CC(C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)(C4)C2)C3)cc1	758049210	YPFDZOUQSDSQQM-ZSVPXSECSA-N	433.574	1.918	50	20	IDGD	
Cc1noc(C[C@@H](NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c2ccccc2)n1	758852004	DGVWSEIVPJIJBC-QGZVFWFLSA-N	433.432	1.282	50	20	IDGD	
CCC(CC)(C(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1)c1ccc(OC)c(OC)c1	759573077	DMRDQAOJJOQMSY-CQSZACIVSA-N	427.523	1.279	50	20	IDGD	
NC(=O)[C@@H]1CC[C@@H](CNC(=O)NNC(=O)COc2ccccc2Cc2ccccc2)O1	760204831	UMNGBCHBVJLCLI-HKUYNNGSSA-N	426.473	1.020	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NCCOc1ncc(Cl)cc1Cl	762039839	XLBJHSNRJSOAHK-UHFFFAOYSA-N	432.289	1.589	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)NC[C@@H](O)c2ccco2)cc1	762314725	VTHMTKDEPNGDJW-KZIRBZLESA-N	449.467	1.784	50	20	IDGD	
Cc1cc(F)c(S(=O)(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)cc1C(=O)O	763439059	HRYXXGVYXWMLAQ-UHFFFAOYSA-N	433.458	1.447	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)N[C@H]1CCO[C@@H](C(C)(C)C)C1	763461015	QAZNAQLMMVBAOP-UONOGXRCSA-N	425.555	1.826	50	20	IDGD	
O=C(NNC(=O)c1ccccc1Br)C(=O)Nc1ccccc1-n1cncn1	763483045	LYPCCNILSHLGHP-UHFFFAOYSA-N	429.234	1.430	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)ccc1F	763531821	RWUGOOPNYKPOAU-UHFFFAOYSA-N	427.480	1.432	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(N3CCO[C@@H](C)C3)cc2)cc1OC	763550375	LBUPKYXBHGWOFA-AWEZNQCLSA-N	442.472	1.329	50	20	IDGD	
C=CCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)cc1	763605784	XZOJYYRSRMBVBP-UHFFFAOYSA-N	432.440	1.392	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2cccn(Cc3ccccc3)c2=O)c1	763623807	HTDSDUPRUAJSQI-UHFFFAOYSA-N	434.452	1.370	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2ccc(N3CCOC[C@@H]3C)cc2)c1	763645107	QEGUHWVFFMCHOW-KRWDZBQOSA-N	440.500	1.693	50	20	IDGD	
C[C@H]1COCCN1c1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)cc1	763684320	JNXXWEQZRXMLIM-AWEZNQCLSA-N	446.891	1.730	50	20	IDGD	
NC(=O)c1n[nH]c2ccc(NC(=O)C(=O)NNC(=O)CC34CC5CC(CC(C5)C3)C4)cc12	763752066	BURWKMGVTSBWBM-UHFFFAOYSA-N	438.488	1.354	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc(OCCC(C)C)cc2)ccc1C(N)=O	763767805	KNGJTLMLILCHRW-UHFFFAOYSA-N	426.473	1.919	50	20	IDGD	
CCCOc1ccc(NC(=O)C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c(C)c1	763790644	MGBOSOKPRPMSDQ-UHFFFAOYSA-N	437.456	1.430	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)C[C@@H]1Sc2ccc(Cl)cc2NC1=O	763821787	XOTSTCJBBLXYCH-AWEZNQCLSA-N	433.877	1.115	50	20	IDGD	
CC(C)c1nc(C(=O)NNC(=O)CNC(=O)c2cccnc2)nn1-c1ccccc1Cl	763825032	PALRKPDGUCYFCN-UHFFFAOYSA-N	441.879	1.630	50	20	IDGD	
CC(C)n1nnnc1-c1ccccc1NC(=O)C(=O)NNC(=O)COc1ccc(F)cc1	763838508	ABBDOOLRGHDVRE-UHFFFAOYSA-N	441.423	1.225	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccc(-n2cccn2)c(F)c1	763866627	QLAIPSNLWJVCAX-LBPRGKRZSA-N	429.383	1.704	50	20	IDGD	
CON(C)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)cc1	763873128	RUWPEYKCCDLVHF-LBPRGKRZSA-N	432.408	1.013	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(CNC(=O)OC)cc2)cc1OC	763902135	NMGIXTQJTVIITF-UHFFFAOYSA-N	444.444	1.350	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccccc2O[C@H]2CCOC2)cc1OC	763903521	RXZAPPHCFSAXTN-HNNXBMFYSA-N	443.456	1.661	50	20	IDGD	
O=C(CCSc1ccc(F)cc1)NNC(=O)C(=O)Nc1cccc(Cn2cncn2)c1	763903989	VJUMIHLUTXGOFR-UHFFFAOYSA-N	442.476	1.734	50	20	IDGD	
COC(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(OC(C)C)c(OC)c2)cc1	763916341	MXVYGLVPLUPOBB-UHFFFAOYSA-N	443.456	1.598	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)C(=O)Nc1ccc(-c2ccccc2)cc1F	763921247	KMCCLNFFEZOUSX-UHFFFAOYSA-N	445.414	1.868	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Br)s2)c(N(C)C)n1	763940168	FBTHSNIQXBRZBN-UHFFFAOYSA-N	426.296	1.680	50	20	IDGD	
COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NNC(=O)c1cc(Br)c[nH]1	763995270	PFGAYMVXJHLRTB-UHFFFAOYSA-N	426.183	1.094	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)Nc1ccccc1OCC(F)F	764004579	HTZDYWQJPJWVHA-UHFFFAOYSA-N	445.220	1.831	50	20	IDGD	
O=C(NNC(=O)C1CCCC1)C(=O)Nc1ccc(S(=O)(=O)NC2=NCCCCC2)cc1	764067870	AFUMWFJAZCNIKO-UHFFFAOYSA-N	449.533	1.214	50	20	IDGD	
O=C(Cc1ccc2ccccc2c1)NNC(=O)C(=O)Nc1cnn(Cc2ccncc2)c1	764091284	HXNSDDJOZDYKIS-UHFFFAOYSA-N	428.452	1.808	50	20	IDGD	
CC(C)(C)OC(=O)N1CCc2ncc(NC(=O)C(=O)NNC(=O)CC(F)(F)F)cc2C1	764115620	BGPFNORHODTCLM-UHFFFAOYSA-N	445.398	1.413	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(C)cc2OC[C@H]2CCCO2)c1O	764130114	BBDHOOJVWFIOMD-CQSZACIVSA-N	443.456	1.667	50	20	IDGD	
CCOCC(=O)NNC(=O)C(=O)Nc1ccc(N2C(=O)c3ccccc3C2=O)c(Cl)c1	764317717	OMXLIXKHFZTHTE-UHFFFAOYSA-N	444.831	1.263	50	20	IDGD	
CNS(=O)(=O)c1cccc(NC(=O)C(=O)NNC(=O)CCCc2cccs2)c1C	764340149	UZYFYSJWTPOVRB-UHFFFAOYSA-N	438.531	1.073	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)c1cc(Cl)cc(Br)c1O	764342184	DAMIAMZPLIPQDL-UHFFFAOYSA-N	427.642	1.394	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cnn(C(C)C)c3)n[nH]2)cc1OC	764379175	RMWLJPJQYAQQKM-UHFFFAOYSA-N	441.448	1.271	50	20	IDGD	
CCOC(=O)c1c(F)cccc1NC(=O)C(=O)NNC(=O)c1cc(-c2cccs2)[nH]n1	764383044	VCUDRVJROGAHLN-UHFFFAOYSA-N	445.432	1.854	50	20	IDGD	
Cc1c(Br)cc(C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)c(=O)n1C	764939639	QXVZSJGSTJGEKH-SNVBAGLBSA-N	426.242	1.824	50	20	IDGD	
O=C(NCc1cccc(N2CCCS2(=O)=O)c1)NNC(=O)c1cccc([N+](=O)[O-])c1	765891879	KDSPPRHUHDRZHR-UHFFFAOYSA-N	433.446	1.279	50	20	IDGD	
C[C@H](NC(=O)OC(C)(C)C)[C@@H]1COCCC1=NNC(=O)c1nn(C)c(=O)c2ccccc12	766007124	JYJZCIJEAIPZTN-BBRMVZONSA-N	443.504	1.969	50	20	IDGD	
CCc1ccc(C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1S(C)(=O)=O	766162304	LJNDSDSCUDYWCN-UHFFFAOYSA-N	449.441	1.179	50	20	IDGD	
CNC(=O)[C@H]1CCC[C@H]1NC(=O)NNC(=O)COc1ccc(OCc2ccccc2)cc1	766277091	CTEGAIVIZMKPLK-VQTJNVASSA-N	440.500	1.890	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1cccn1Cc1ccccc1	766644261	TVZYIMOSOKRHKG-UHFFFAOYSA-N	445.523	1.755	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)NCc1ccc(CN2CCC(O)CC2)cc1	766961361	GXQRKJACTXCVDY-UHFFFAOYSA-N	432.546	1.873	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)c2ccccc2S(=O)(=O)CCN(C)C)c1	767179997	TYHPGXUIVMODPK-UHFFFAOYSA-N	433.530	1.479	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCCc2cn3c(n2)SCC3)cc1Br	767322101	GWVINZIZIFJLBN-UHFFFAOYSA-N	440.323	1.947	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)c2coc(C3CCOCC3)n2)CC1	767922841	DGIUKVMZHYQSNX-UHFFFAOYSA-N	437.497	1.912	50	20	IDGD	
O=C(NN=Cc1ccc(OC(F)F)c(Br)c1)N[C@@H]1CCS(=O)(=O)C1	768360050	JFWDGIPCXCEZBS-SECBINFHSA-N	426.239	1.871	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)Nc1ccc(NS(C)(=O)=O)cc1	769240923	OGCSZJWAIHRHFY-UHFFFAOYSA-N	428.492	1.619	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c([N+](=O)[O-])cc1OC	769597290	PEQKVLSACQLWGC-UHFFFAOYSA-N	427.377	1.053	50	20	IDGD	
CCOC(=O)NNC(=O)Nc1ccc(S(=O)(=O)N2CCC[C@@H](C(=O)OC)C2)cc1	769942420	NDLIBDZETHCWER-GFCCVEGCSA-N	428.467	1.043	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)[C@H](OC)C(C)C)c2)cc1	770209132	MUJOVJJIGZZSOT-GOSISDBHSA-N	435.502	1.928	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)N1CCN([C@@H](C)C(=O)NC2CC2)CC1	770646224	DTMPYHMAFREKBV-KBPBESRZSA-N	437.928	1.133	50	20	IDGD	
COC(=O)CCN1CCN(C(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)[C@H](C)C1	770655597	FTZUBLCCXNVWSY-KGLIPLIRSA-N	426.901	1.417	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)CCc3cccc4c3OCO4)cc2)CC1	771432083	PEDKFEITXBRDKR-UHFFFAOYSA-N	446.529	1.427	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)c1ccc2c(c1)C[C@H](C)N2S(C)(=O)=O	771967898	ITMFHCZSZRYSSB-STQMWFEESA-N	425.507	1.136	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCCNC(=O)NNC(=O)c2cc3c(s2)CCC3)s1	772632018	VCEUTDJBKHRUQF-UHFFFAOYSA-N	428.561	1.529	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)C(=O)Nc1ccc(Cl)cn1	773526125	VSNWHFDQHZHFCI-UHFFFAOYSA-N	427.642	1.662	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2ccc(=O)n(Cc3ccccc3Cl)c2)n1	773724175	NFSAJAPWBBHRSI-UHFFFAOYSA-N	428.836	1.430	50	20	IDGD	
CC(C)[C@@]1(C)C[C@H]1C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	773771259	REBBWLMQNUOJKW-GHTZIAJQSA-N	437.562	1.470	50	20	IDGD	
CCOC(=O)N[C@@H](C(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1)C(C)C	776201362	IWRBPLFQRGDAKN-CQSZACIVSA-N	429.518	1.393	50	20	IDGD	
CN(NC(=O)c1ccc2c(c1)nc(O)n2C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776204069	BBJJALLZTJPOPS-UHFFFAOYSA-N	432.481	1.528	50	20	IDGD	
CC(C)(C)OC(=O)NCC(F)(F)CNC(=O)NNC(=O)c1ccc2c(c1)OCCO2	777677736	MXBVUFAZILQWOA-UHFFFAOYSA-N	430.408	1.562	50	20	IDGD	
COc1ccc(Cc2nnc(SCC(=O)NNC(=O)c3cccc(Cl)c3)n2N)cc1	779378380	JQKFPAWBVOGZCX-UHFFFAOYSA-N	446.920	1.798	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)[C@@H](O)[C@@H](O)c3nc4ccccc4s3)n[nH]2)cc1	779499452	HLWSDCNAALTFCU-ZWKOTPCHSA-N	437.481	1.850	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@@H](C(=O)NNc2ccc(OC(F)F)cc2)[C@H](C)O)cc1	779535332	SIPOXDCBLSFBGC-BLLLJJGKSA-N	429.445	1.767	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)C(=O)Nc1ccc2ccccc2c1	782897505	PWOBIMVRAVJLNC-UHFFFAOYSA-N	439.497	1.841	50	20	IDGD	
O=C(NNc1nccc2sccc12)C(=O)Nc1cccc(N2CCCS2(=O)=O)c1	783438292	QGOVDZCHZLLFLY-UHFFFAOYSA-N	431.499	1.918	50	20	IDGD	
CCN(CC)C(=O)COc1ccc(NC(=O)C(=O)NNc2ccc(C)nn2)cc1Cl	783949729	MWCZFIRUJGJJSZ-UHFFFAOYSA-N	434.884	1.767	50	20	IDGD	
CC(C)c1nc2ccc(NC(=O)C(=O)NNC(=O)CNC(=O)c3ccco3)cc2s1	784002649	UGCVKSCNUXFOOO-UHFFFAOYSA-N	429.458	1.529	50	20	IDGD	
Cc1ccc(N2CCNC2=O)cc1NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	786265359	OGTUCFJEUPEILM-UHFFFAOYSA-N	435.444	1.238	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cnn(-c3ccc(C)cc3C)c2)cc1OC	786415021	UPMCGMNGIYSAQL-UHFFFAOYSA-N	437.456	1.906	50	20	IDGD	
COC(=O)COc1ccc(C=NNC(=O)[C@H](C)CN2C[C@H](C)O[C@H](C)C2)cc1[N+](=O)[O-]	788702074	NUJIDKYSTXTHTR-KFWWJZLASA-N	436.465	1.342	50	20	IDGD	
CNC(=O)c1cc2cc(NC(=O)C(=O)NNC(=O)COc3ccc(C)c(C)c3)ccc2[nH]1	792356087	ZUYHNNDFWVRUFS-UHFFFAOYSA-N	437.456	1.309	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)c2ccccc2S(=O)(=O)CCN(C)C)cc1	792797605	ICBWMSVSVAKFPX-UHFFFAOYSA-N	433.530	1.424	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NN=C(C)c1ccc(S(=O)(=O)NCC(=O)O)cc1	794782277	QUOUADUGAQMFBZ-UHFFFAOYSA-N	439.877	1.866	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)OCc2n[nH]c(C)n2)cc1	795282914	ZUQVISPIFGEWGT-DHDCSXOGSA-N	435.444	1.511	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(Cl)c(CN3CCOCC3)c2)c(C)o1	797535546	NOWREGJIJNKNSB-UHFFFAOYSA-N	434.880	1.782	50	20	IDGD	
COC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)c1C	798042641	WZKGQQCHQASJDG-UHFFFAOYSA-N	438.238	1.664	50	20	IDGD	
Cn1c(Cl)cnc1C=NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	799467573	RMPVRJJHGKOSMN-UHFFFAOYSA-N	439.925	1.177	50	20	IDGD	
CCc1cccc(C)c1NNC(=O)C(=O)N1CCc2cc(S(=O)(=O)N(C)C)ccc21	799841818	PCKORGXCOBTKIW-UHFFFAOYSA-N	430.530	1.840	50	20	IDGD	
Cc1ccc(C2=NO[C@H](CNC(=O)NNC(=O)c3csc(N4CCOCC4)n3)C2)cc1	800750305	LYWGGIJVPLEFGN-HNNXBMFYSA-N	444.517	1.425	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)c2ccc(OC)c(-n3cnnn3)c2)c(OC)cc1Cl	802078492	OAKDCYOIPFFWPW-UHFFFAOYSA-N	447.839	1.808	50	20	IDGD	
O=C(CCC(=O)N1CC(=O)Nc2ccccc21)NNC(=O)Nc1ccc2c(c1)OCO2	802101963	WYIXHKQSQLKIQU-UHFFFAOYSA-N	425.401	1.334	50	20	IDGD	
O=C(NNc1nccnc1C1CCC1)c1ccc(S(=O)(=O)NC[C@@H]2CCCO2)cc1	805461428	CIOLZPKIMQLXOV-INIZCTEOSA-N	431.518	1.958	50	20	IDGD	
CCOCCCn1c(NNC(=O)c2ccc(C(N)=O)c(Cl)n2)nc2ccccc2c1=O	806852003	AKYNDMSWPUBDAG-UHFFFAOYSA-N	444.879	1.727	50	20	IDGD	
O=C(NCc1ccc(C(=O)N2CCCCC2)cc1)NNC(=O)[C@@H]1COc2ccccc2O1	807025667	XLFNDWGFCUANOK-FQEVSTJZSA-N	438.484	1.983	50	20	IDGD	
O=C(COc1ccccc1-c1ccccc1)NNC(=O)NC[C@H]1CCCS(=O)(=O)C1	807581008	JVTGPQKQAMOCFC-MRXNPFEDSA-N	431.514	1.888	50	20	IDGD	
C[C@H](Cc1cnc2ccccc2n1)C(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	815467249	TUYTYYHJHJSXTL-CYBMUJFWSA-N	437.412	1.721	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)C(=O)Nc1nc(CC(F)(F)F)cs1	815571269	ZCWUIQOXTUYOCY-UHFFFAOYSA-N	434.421	1.832	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)C2CCC3(CC2)NC(=O)NC3=O)c1	818751194	WZKWJGYQDVFIJP-UHFFFAOYSA-N	439.266	1.447	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)c2ccc3c(c2)C(=O)N(C[C@H]2CCCO2)C3=O)cc1	864017141	SYXDMKYLKHWXRB-QGZVFWFLSA-N	448.435	1.173	50	20	IDGD	
CCOC(=O)c1cnn(-c2ccc(C(=O)N3CC[C@@H](B(O)O)C3)cc2)c1C(F)(F)F	864231161	JKMITLOLGWIVJN-GFCCVEGCSA-N	425.172	1.757	50	20	IDGD	
COc1cc(C(=O)NCC(=O)NNC(=O)CNc2ccc(C)cc2C)cc(OC)c1OC	913164851	VENZWHRJRIVHTB-UHFFFAOYSA-N	444.488	1.319	50	20	IDGD	
CCCNC(=O)CN1CCC(NC(=O)NNC(=O)c2cc3c(s2)CC[C@@H](C)C3)CC1	915257940	WZIOVCYQLPPRKO-CQSZACIVSA-N	435.594	1.808	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)[C@@H](Cc2cccc(F)c2)n2nnnc2C)cc1C	915695504	KTTWGPDYBORXAE-LJQANCHMSA-N	426.452	1.748	50	20	IDGD	
CCN(CC)CCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	915888616	BIXASYWKWKMDQC-UHFFFAOYSA-N	425.555	1.147	50	20	IDGD	
CC(=NNC(=O)c1ccc2c(c1)OCO2)c1ccc(OCC(=O)N2CCOCC2)cc1	916289899	JAYXETRUKDOACH-UHFFFAOYSA-N	425.441	1.807	50	20	IDGD	
O=C(NC[C@@H](c1ccccc1)N1CCOCC1)NNC(=O)c1ccc2c(c1)OCCO2	916508969	HDUBULFACIGJFW-SFHVURJKSA-N	426.473	1.475	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@@H]2CCN(C3CC3)C2)c1	916578060	SEGDKHQLJRMDRK-HNNXBMFYSA-N	437.566	1.145	50	20	IDGD	
Cc1ccc(/C=C(/C#N)C(=O)OCC(=O)NCCc2ccc(S(N)(=O)=O)cc2)cc1	916599566	UYFMEQVCFNWJQO-PDGQHHTCSA-N	427.482	1.452	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)NCc1ccc(S(=O)(=O)NC[C@H]2CCCO2)cc1	916649087	ICHHVODHXKSOOP-QGZVFWFLSA-N	446.529	1.597	50	20	IDGD	
O=C(CN1CCN(C(=O)COc2ccc(Cl)cc2)CC1)NNC(=O)c1cccs1	917164953	SKIWPSAFSNQHCU-UHFFFAOYSA-N	436.921	1.386	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2ccc3c(c2)CCCC(=O)N3)cc(OC)c1OC	917717863	OXLAPYYKQIZIRO-UHFFFAOYSA-N	449.485	1.611	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CN(C)c2ncnc3[nH]cnc23)ccc1OCCC(C)C	917924433	SDRSCIKDRODIFG-UHFFFAOYSA-N	441.492	1.684	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NC[C@H](c2ccc(F)cc2)N(C)C)c2ccccc2c1=O	918090279	FPQBKLUCKNYAEM-GOSISDBHSA-N	440.479	1.802	50	20	IDGD	
CS(=O)(=O)c1ccc(C=NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc1	918152159	HDTXEPLYTVAWTE-UHFFFAOYSA-N	435.527	1.639	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCCN1C(=O)c1ccco1)c1csc(N2CCOCC2)n1	918420178	FSMZVVARESCNQR-CQSZACIVSA-N	433.490	1.029	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1cnc2sccn2c1=O	919265792	FIEPTYZVXYLFAW-UHFFFAOYSA-N	436.833	1.036	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NC[C@H]2CCN(CCC)C2)c2ccccc2c1=O	919797764	VJQBJGABHLWEDR-MRXNPFEDSA-N	428.537	1.873	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccccc1	919822283	JSFPHAXJJYLSIF-SFHVURJKSA-N	431.514	1.629	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)NCc1ccc(C(=O)N2CCN(C)CC2)cc1	919902839	IAPLQABSQOXGPP-UHFFFAOYSA-N	439.516	1.156	50	20	IDGD	
CCCCNC(=O)NNC(=O)[C@H](NS(=O)(=O)c1ccc2c(c1)OCCCO2)C(C)C	920823085	NISBHFCNEOULOJ-QGZVFWFLSA-N	442.538	1.281	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)c2ccc(S(=O)(=O)NCCC#N)cc2)c1	921160453	DXOYPLXSWPVTDG-UHFFFAOYSA-N	430.486	1.335	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@@H](C(=O)NNc3nncc(N)c3Cl)C2)s1	1116298066	JMKBFTZKYWNCGP-SNVBAGLBSA-N	430.943	1.626	50	20	IDGD	
CCCC(=O)N1CSC[C@@H]1C(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1	1251915187	RWHXLEPDATUSNA-CQSZACIVSA-N	428.555	1.483	50	20	IDGD	
CN1CCN(c2ccccc2CNC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])CC1	1318508934	IWGXCPWRDDQGFI-UHFFFAOYSA-N	442.476	1.256	50	20	IDGD	
O=C(O)c1cc2c(c(S(=O)(=O)NNC(=O)c3cncn3-c3ccccc3)c1)CCC2	1319187850	JLRZFLJVJRBVSA-UHFFFAOYSA-N	426.454	1.683	50	20	IDGD	
O=C(COC(=O)c1ccc(OCC2CC2)nc1)NNC(=O)[C@H]1COc2ccccc2O1	1322438006	JQTNXHDCXZUKMF-QGZVFWFLSA-N	427.413	1.015	50	20	IDGD	
CC(C)NC(=S)NNC(=O)c1c[nH]c2ccc(I)cc2c1=O	1324833028	SICNGMCSDFDTCO-UHFFFAOYSA-N	430.271	1.650	50	20	IDGD	
CC[C@]1(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)CCN(C(=O)OC(C)(C)C)C1	1340878772	WAJJMGKKCKBXHM-FQEVSTJZSA-N	429.481	1.461	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(C(=O)N2CC[C@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)C1	1778120731	IWRVNVFXJYUBIS-NRFANRHFSA-N	443.972	1.948	50	20	IDGD	
COC(=O)c1ccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](F)Cl)C3)cn1	1778205055	FQYGUNNHCIWBEP-SPYBWZPUSA-N	427.860	1.530	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnc(O)[nH]2)C1	1779776407	BZNYTJUQZWUTKR-XTQGRXLLSA-N	429.315	1.274	50	20	IDGD	
COc1nc(C)ccc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2	1779847275	MUPQXEYRENSATQ-JXXFODFXSA-N	425.913	1.126	50	20	IDGD	
CCSc1cccnc1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](Cl)COC)CCO2	1780465329	LNMJSTNEHAWYSR-IFXJQAMLSA-N	427.954	1.891	50	20	IDGD	
CC(=O)c1cc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](F)Br)C2)n[nH]1	1780771079	RZTKSNXEPDBPDJ-CKEIUWERSA-N	445.289	1.430	50	20	IDGD	
N=C(N)SCCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Br)C1	1780771741	PLRMZCDQICEZIS-IXPVHAAZSA-N	439.351	1.208	50	20	IDGD	
O=C(O)CSCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Br)C1	1780777045	KXRKZMSCNHRYPB-WDBKCZKBSA-N	441.319	1.009	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc(O)cc2F)C1	1780941033	LFMAAMZZKVXCCF-WRWLIDTKSA-N	428.888	1.913	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)CCc3ccc(O)nn3)CCO2)C1	1781233718	YRNULGCCOYFISH-ZWKOTPCHSA-N	431.320	1.181	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)no1)C2	1781900656	AQTPQRBZNQNFAA-CJBNDPTMSA-N	430.299	1.681	50	20	IDGD	
CCc1cc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](Cl)COC)C2)nn1C	1782173559	IPIGSPMKGHGFAR-WRWLIDTKSA-N	426.945	1.364	50	20	IDGD	
C[C@@H](Cn1ccnc1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)Br)C2	1782547341	NFVVGYRQFXTXQE-WFXMFSGNSA-N	441.370	1.817	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](C)[S@@](=O)c3ccccc3)C2)C1	1782688424	WYRURXSWSOKCRT-NTKIRWMFSA-N	442.965	1.266	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cc(OC)ccn3)CCO2)C1	1783349896	VMQBRGANOZAWMG-KBXCAEBGSA-N	426.311	1.707	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc4c(c3C)OCCO4)CCO2)C1	1783874983	JJYFVHYUUYNOOI-HRAATJIYSA-N	438.908	1.464	50	20	IDGD	
CCOC(CC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2)OCC	1784161275	WZHDRXOHFBNFFS-KBXCAEBGSA-N	435.359	1.637	50	20	IDGD	
O=C(CCc1ccc(F)nc1)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21	1785233029	HDQDCTNVYJFNBA-JYJNAYRXSA-N	442.329	1.918	50	20	IDGD	
CN(C)c1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Br)C[C@@H]32)nc1	1785749353	PQXJHVPASIVTOU-MZGVZZPPSA-N	443.317	1.431	50	20	IDGD	
N[C@H](CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)c1cccnc1	1786927674	XMHIDESOQKWQID-NXOAAHMSSA-N	439.354	1.236	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]3C2)c(O)c1OC	1787449934	PAOWFVKDNIIRRM-WKTARRMCSA-N	430.860	1.537	50	20	IDGD	
Cc1cnc2c(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)C(Cl)Cl)C[C@@H]43)cnn2c1	1788337724	CXZMQZPOZKSQIP-UBHSHLNASA-N	426.304	1.435	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccn4ccnc4c3)[C@H]2C1	1788361227	AGUJILQXZBLBNQ-OEAJRASXSA-N	435.322	1.711	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(-c4cccnc4)[nH]n3)[C@H]2C1	1788936248	SBBHYFALFVECLA-FPXQBCRKSA-N	447.923	1.319	50	20	IDGD	
O=C(NC1(c2ccc(NC(=O)[C@@H](O)N3CCOCC3)cc2)CCC1)[C@H](F)Br	1789554698	HAAVHAGEDVGGFS-WMLDXEAASA-N	444.301	1.462	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21	1789865832	FPBILVCYDHQPQZ-ASHKBJFXSA-N	430.170	1.987	50	20	IDGD	
Cc1nccn1CCCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]2C1	1789926999	NKEHSVIELYEHRC-JKQORVJESA-N	445.333	1.642	50	20	IDGD	
CC(C)n1cnc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]3C2)n1	1791058028	WHQWXHNYGQOXBJ-RFGFWPKPSA-N	428.331	1.236	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4ccnn4c3)C[C@@H]21	1791063707	QLCHLIWXNDKSSA-CSFVBSKPSA-N	435.322	1.711	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4ccoc4s3)C[C@@H]21	1791289189	NHKAOJMGHTTXAM-JYJNAYRXSA-N	448.545	1.461	50	20	IDGD	
COc1ncc(Cl)cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Br)C2	1792402960	USEBINFDWSVQEI-NJBDSQKTSA-N	446.729	1.730	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnn3c1CCC3)C2	1792873570	DLAFWMHNAZCCRN-JFILPPLUSA-N	425.327	1.064	50	20	IDGD	
O=C(Cc1ccc(Cl)cc1[N+](=O)[O-])N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2	1792943068	AMLHRNNNJJALEK-OJXGSEEGSA-N	434.251	1.915	50	20	IDGD	
COc1ccccc1CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(B(O)O)cc1)C2	1793326712	KNMUXUBXVQXZGH-WKCHPHFGSA-N	436.317	1.260	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)COc1cccnc1	1793937980	HGCFDXZQUNIOQP-IARIHHJXSA-N	426.311	1.224	50	20	IDGD	
Cc1cc(C)n(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)CBr)C3)n1	1794117784	GNAKQGSWLBTYJL-FIUQPQMISA-N	427.343	1.121	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)Nc1cccnc1	1795611777	ROKQWZXBNKKWMS-AQDIXCGQSA-N	425.327	1.255	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc2c[nH]nc12	1796176763	WKNNRCCWZLUPHU-ZIEJDFEHSA-N	435.322	1.797	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@]1(C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Cl	1796365569	ZGEZZHKAWVRDHB-UPYQZRRNSA-N	447.935	1.900	50	20	IDGD	
Cc1c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CCC(=O)NN(C)C)C3)ccc2c1OCCO2	1796688729	HNTYJVMEQYJBHH-BJWYYQGGSA-N	444.532	1.391	50	20	IDGD	
Cc1c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)CBr)C3)nc2ccccn12	1796844466	JMVAIIBBYATZIA-LJGDNWOOSA-N	449.349	1.877	50	20	IDGD	
COc1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C3)nc1	1797223235	VNNFZMAASGUFCF-MVRRYPJTSA-N	438.488	1.476	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2)c1cc2n(n1)CCCC2	1797440924	ZPLYVQMWDMCFOW-FVCICTRLSA-N	425.327	1.208	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2cncn2c1	1797532117	JGORTCKMCDLZDU-FSDCSDTHSA-N	435.322	1.711	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ncccc1Br	1798187928	MXWKVKLBEHPICQ-XCCSTKFXSA-N	446.729	1.301	50	20	IDGD	
COc1cccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)c1F	1798443673	UOFFGJKQGPWJGW-BTTYYORXSA-N	441.463	1.398	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc([N+](=O)[O-])c3c1OCO3)C2	1799269219	VFXCABYFNJSHPC-NDPMZMCLSA-N	439.852	1.544	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CC1CN(C(=O)OC(C)(C)C)C1)C2	1799271544	QYMNBPOLNAPYAJ-DFGXFYAUSA-N	443.972	1.850	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc3nccn13)C2)[C@H](F)Br	1799346566	CUECCBOLTQSLDF-JLUCKKNBSA-N	425.258	1.228	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cncc3cnccc13)C2)[C@@H](F)Br	1799348799	PVDQWTGYSYXSTK-NOXHYTERSA-N	437.269	1.524	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccn(C(C)(C)C)n1)C2	1800757683	IJONCTNLKGRVQQ-GUIRCDHDSA-N	427.343	1.625	50	20	IDGD	
C=C1CC(C(=O)NC[C@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)C1	1802414403	ORUCXGKKDHQMPL-UZLBHIALSA-N	434.500	1.366	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cnn3ccccc23)[C@@H]1c1cccnc1)[C@H](O)CCl	1803138669	CZICHEKKNUVUCA-KFKAGJAMSA-N	427.892	1.649	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)COc2ccc(F)cc2)[C@H]1c1cccnc1)[C@H](O)CCl	1803139321	WUEWIDAWCUNQSB-CVAIRZPRSA-N	435.883	1.905	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]2c2cccnc2)o1	1803143080	SURZAMBRSOTLBT-IIDMSEBBSA-N	434.880	1.552	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC2(CCCN(C(=O)c3cc(C4CC4)on3)C2)CC1	1805143531	TYAWELNPNBYXAQ-UHFFFAOYSA-N	437.305	1.390	50	20	IDGD	
Cc1noc(C)c1C(=O)N1CCCC2(CCN(C(=O)c3cccc(B(O)O)c3)CC2)C1	1808220325	PHVWNKRZFZSHFQ-UHFFFAOYSA-N	425.294	1.130	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@@H](CNC(=O)COCCO)[C@@H]1c1cccnc1	1808601235	IVUGZBBBROMGEL-KMFMINBZSA-N	428.327	1.127	50	20	IDGD	
O=C(c1ccc2ncoc2c1)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1	1809978803	SNIRENNDWIPVDG-UHFFFAOYSA-N	447.300	1.666	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H](CNC(=O)[C@H]2CNC(=O)C2)[C@@H]1c1cccnc1	1812643545	UZIWFMHSRNKTRR-AIANPOQGSA-N	437.338	1.397	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)[C@@H]2C[C@H]3CC[C@@H]2O3)[C@@H]1c1cccnc1	1812894537	ZOKMEQWQGIZKSO-DIGZUXTDSA-N	443.548	1.028	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2cnc3ncccn23)[C@@H]1c1cccnc1	1813030194	HSQNIBLKTUNAMU-SOLBZPMBSA-N	442.907	1.698	50	20	IDGD	
Cc1cc(C)n(CCC(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)n1	1813303121	DYOVUANLYOTOQI-CMKODMSKSA-N	433.940	1.591	50	20	IDGD	
C[C@H]1CC[C@H](C(=O)N[C@@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)CC1	1815347686	KOSPNWDXPNIQCF-CKEIUWERSA-N	441.362	1.875	50	20	IDGD	
C[C@@]1(C(=O)N[C@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)CC1(F)F	1815347882	VJKXOCZWLKXXKK-SGTLLEGYSA-N	435.261	1.094	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)[C@@H](O)c1ccccc1	1817075551	KHHXCMJERBCSAQ-CTNGQTDRSA-N	448.288	1.129	50	20	IDGD	
CC(=O)N1CCCC[C@H]1c1cc(NC(=O)CN(C)NC(=O)NCc2ccccc2)n[nH]1	1820710660	YAYCCZKLVGFBLY-SFHVURJKSA-N	427.509	1.768	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1CCc2nc(NC(=O)c3c[nH]c(=O)cn3)sc2C1	1821464134	XGZLZRXKSZUOQJ-DTWKUNHWSA-N	440.323	1.483	50	20	IDGD	
O=C1CC[C@H](C(=O)N2CCCC[C@@H]2C2CCN(C(=O)[C@H](F)Br)CC2)CN1	1823842100	XUSOVXLVJLJRFJ-LZWOXQAQSA-N	432.334	1.823	50	20	IDGD	
O=C1CCc2ccc(C(=O)Nc3nc4c(s3)C[C@@H](NC(=O)[C@@H](O)CCl)CC4)cc2N1	1824329041	FKDDHFRHKAMXRW-WFASDCNBSA-N	448.932	1.853	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](C)NS(=O)(=O)CC)CC1	1824462720	APVUABBILRPXSM-PVAVHDDUSA-N	436.018	1.951	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)c2coc(Cl)n2)CC1	1825535604	PBZFYALEYWWZLW-SFHVURJKSA-N	445.712	1.555	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)Cn1ccncc1=O)CC2	1825646506	DAXLSKRSOFOKPL-ZJUUUORDSA-N	440.323	1.095	50	20	IDGD	
CN[C@H](CC(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H](F)Br)CC1)C(=O)O	1826946779	ZFYYDGQIFQYNQB-VNHYZAJKSA-N	436.322	1.359	50	20	IDGD	
C=CCSCC(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827050180	HTWFXPPROGJISP-HXUWFJFHSA-N	430.379	1.519	50	20	IDGD	
O=C(c1ncccc1F)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827052222	FPRWJIZTMRTSLC-FQEVSTJZSA-N	439.296	1.448	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@H]1CCc2nc(NC(=O)C3(F)CCC3)sc2C1	1827421211	LGYLNAFVWJULML-JTQLQIEISA-N	432.481	1.260	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccco2)CC1	1828926026	XVSJOIYGEDUUDG-GOSISDBHSA-N	425.489	1.825	50	20	IDGD	
COCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Cl)CCN2C(=O)OCc1ccccc1	1829052238	ITMMKGFEQVYZBZ-FXAWDEMLSA-N	441.887	1.619	50	20	IDGD	
COc1nccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)c1F	1830357520	DWPFJGKGHNRXFY-FQEVSTJZSA-N	443.903	1.564	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4c(c3)CNC4=O)C2)C1	1830361777	CLDKWBIEIUQDCW-JOCHJYFZSA-N	449.935	1.265	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)Cc2cccnc2)CC1	1831871205	NGLQQEAMHSFMCD-FQEVSTJZSA-N	429.565	1.617	50	20	IDGD	
Cc1cc(C(=O)N2CCC([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)cn1C	1831872970	AGNDZZCQYWPETB-HXUWFJFHSA-N	431.581	1.940	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H]2CCNC(=O)C2)CC1	1831942384	VRPPPPSGQKGWJH-NUEKZKHPSA-N	428.371	1.916	50	20	IDGD	
CC(C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1	1832315699	HWVWVBGYEGIRLO-MSOLQXFVSA-N	425.353	1.494	50	20	IDGD	
CC(C)(C)[C@H](O)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1833287885	QCSJDOJTAKKTNE-HUUCEWRRSA-N	436.366	1.656	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H]3CCCCC3(F)F)CC2)CC1)[C@H](O)CCl	1833305889	BYPCIDFRMDYPDR-IAGOWNOFSA-N	435.943	1.983	50	20	IDGD	
Cc1ccc(CCC(=O)N2CCC(N3CCC(NC(=O)[C@@H](O)CCl)CC3)CC2)cn1	1833308152	KIWCHLKZQMGFNA-FQEVSTJZSA-N	436.984	1.494	50	20	IDGD	
Cc1nscc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1	1833746990	GHXXRAAGGXKEAF-SJORKVTESA-N	436.361	1.758	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)c3ccc([N+](=O)[O-])o3)C2)C1	1834820227	QTUIUGXHWUJGAR-MRXNPFEDSA-N	446.254	1.043	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](CC)NC(N)=O)CC2)CC1	1835054659	XDYWPBSWCDVXJX-IAGOWNOFSA-N	429.993	1.412	50	20	IDGD	
Cc1cc(C(=O)N2CCC(N3CCC(NC(=O)[C@H](F)Cl)CC3)CC2)nc2nccn12	1835080995	BTPLJTMQZUUDCO-KRWDZBQOSA-N	436.919	1.757	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)c1nnsc1C1CC1	1835209273	MZMZOIBQVLAPPM-OAHLLOKOSA-N	441.985	1.200	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)NC1CCN(C2CCN(C(=O)C(C)(C)CCl)CC2)CC1	1835827414	SKCNWIWUMHOSKO-OAHLLOKOSA-N	426.989	1.514	50	20	IDGD	
C[C@@H](Nc1cccnc1)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836716554	BLPGNPQKTVDXKO-BEFAXECRSA-N	438.956	1.480	50	20	IDGD	
Cc1nc2ccncc2cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1836837542	RYHGMZPKIQYSEL-XLIONFOSSA-N	436.871	1.543	50	20	IDGD	
O=C(/C=C\C(=O)N1CCC(OC2CCN(C(=O)C(Cl)Cl)CC2)CC1)NC1CC1	1838365004	JUITUHDBJIWKNW-ARJAWSKDSA-N	432.348	1.624	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)C3CC3)C2)C1	1838528353	SIMYCJIWTFTUKN-OAQYLSRUSA-N	447.444	1.000	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccnc(OC)c3F)C2)C1	1839144374	WOHLTTSJQGBMEW-KUHUBIRLSA-N	429.876	1.317	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3ccccn3)C2)C1	1839150800	XUZDGDPDCRJAAK-PMACEKPBSA-N	444.359	1.707	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(C)n4ccnc4n3)CCO2)C1	1839550330	CGBGHKGHCQXGSB-YWZLYKJASA-N	435.912	1.125	50	20	IDGD	
C#CCCC(=O)N1CCOC[C@]2(C1)CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)CCO2	1839743755	RPSSMYBGDBKRPO-KUDIEGTJSA-N	443.450	1.742	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc(C)nc3)C2)C1	1839963528	NJULPEQPWRHGBO-MAUKXSAKSA-N	441.326	1.029	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)n3cccn3)C2)C1	1839967501	OGIBYOLOSRKPCR-MPGHIAIKSA-N	443.342	1.074	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(F)cn3)C2)C1	1840031515	SFZZJLRMXKTMNI-SJKOYZFVSA-N	430.274	1.074	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(Cl)cc3)C2)C1	1840153776	ASKBRPHBZJOYDP-APWZRJJASA-N	431.316	1.664	50	20	IDGD	
CC(C)N1CCC[C@H]1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)Br)C2)C1	1840584943	OHXINJRQBBOANK-BXWFABGCSA-N	446.386	1.099	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)C(=O)c2ccco2)C1	1841953216	GRRYIJJBDLKTEP-UHFFFAOYSA-N	441.396	1.813	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)c2ccc(N3CCCC3)c(F)c2)C1	1844714929	QAHFNTOKLPYBLD-UHFFFAOYSA-N	445.539	1.616	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H]1CC[C@H]2CCC(=O)N2C1	1847500322	FAACWHKVKUGVQW-OWYFMNJBSA-N	426.355	1.620	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	15692769	YBCGQTOUWQCXOM-UHFFFAOYSA-N	431.514	1.410	50	20	IDGD	
COC(=O)c1c(C)[nH]c(C(=O)OCC(=O)NNC(=O)c2ccc(OC)c(OC)c2)c1C	22203651	QNOZHLUYONOQFW-UHFFFAOYSA-N	433.417	1.053	50	20	IDGD	
C[C@@H]1CC(C)(C)C[C@]2(C1)NC(=O)N(CC(=O)NNC(=O)Cc1c[nH]c3ccccc13)C2=O	45591529	UWZXYNQFZITODI-FATZIPQQSA-N	439.516	1.995	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)[C@@H](Cc1ccccc1)NC(=O)c1ccccc1	725739712	MPNURJHXKUFCHH-GOSISDBHSA-N	434.452	1.198	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NCc1cc(Cl)c2c(c1)OCCCO2	725874427	YZHXLYPVQWWPAZ-UHFFFAOYSA-N	438.893	1.823	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)[C@H]2CCCN(S(=O)(=O)c3ccccc3)C2)c(C)c1	728205352	BZSKJQAEIUNQHO-SFHVURJKSA-N	444.557	1.964	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)CNS(=O)(=O)c2ccc(Cl)s2)c(C)c1	728205671	AAAWUZODJULWJH-UHFFFAOYSA-N	430.939	1.556	50	20	IDGD	
Cc1noc(Cl)c1CCC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	728215530	FXPWSFSBNDMQKI-UHFFFAOYSA-N	441.941	1.648	50	20	IDGD	
O=C(CCN1C(=O)[C@H]2CCCC[C@H]2C1=O)NNC(=O)c1cc(F)ccc1Br	728549277	BPZFQKBYMVXEBA-TXEJJXNPSA-N	440.269	1.915	50	20	IDGD	
Cc1cc(C)c(S(=O)(=O)NNC(=O)c2cccc(C#N)c2)c(C)c1NS(C)(=O)=O	728853266	ABBXZAOIZJKQDF-UHFFFAOYSA-N	436.515	1.478	50	20	IDGD	
COc1cc(N2C[C@H](C(=O)NNC(=O)CNc3ccccc3)CC2=O)cc(OC)c1OC	729513987	DRARLFOHSDJFFL-CQSZACIVSA-N	442.472	1.325	50	20	IDGD	
COC(=O)[C@H](c1ccc(Cl)cc1)N1CCN(CC(=O)NNC(=O)c2ccccc2)CC1	730259134	RRLQXISUFRPBJI-FQEVSTJZSA-N	444.919	1.633	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCN(c2ccc3c(c2)OCCO3)C1=O)c1cccc2ncccc12	730550101	VSUFCSOWRMOQDM-KRWDZBQOSA-N	432.436	1.820	50	20	IDGD	
O=C(O)COc1ccc(C=NNC(=O)c2csc(N3CCOCC3)n2)cc1[N+](=O)[O-]	731557125	ABPRTYDUVFQSCA-UHFFFAOYSA-N	435.418	1.115	50	20	IDGD	
O=C(NNC(=O)[C@H](O)c1cccnc1)c1cccc(S(=O)(=O)NCc2ccccc2)c1	731866187	ZTOJKAITVAOCKV-LJQANCHMSA-N	440.481	1.055	50	20	IDGD	
COc1ccc(Cl)c(S(=O)(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1	732746967	IEPVHWOTOAQDLU-UHFFFAOYSA-N	425.898	1.365	50	20	IDGD	
O=C(Cn1c(Cc2ccccc2)nc2ccccc21)NNC(=O)[C@H]1CCS(=O)(=O)C1	733731153	LAJQASNONVPPQV-INIZCTEOSA-N	426.498	1.209	50	20	IDGD	
O=C(NNC(=O)C(=O)N1CCCC1)N[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	734071436	KFFGIDFSMDTDQQ-HNNXBMFYSA-N	427.427	1.233	50	20	IDGD	
CC(C)[C@@H](C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)N1C(=O)c2ccccc2C1=O	734239243	JQCLNBNCIZLGIY-HNNXBMFYSA-N	447.492	1.162	50	20	IDGD	
Cc1ccc(C)c(N2N=C(C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)CCC2=O)c1	734242009	ZWJJLDBOONIDLT-UHFFFAOYSA-N	446.508	1.641	50	20	IDGD	
COc1ccc(CN2CC[C@H](NC(=O)NNC(=O)c3ccc4c(c3)OCCO4)C2=O)cc1	734541365	HOZHFDOCJVCZNI-KRWDZBQOSA-N	440.456	1.212	50	20	IDGD	
C[C@H](Cc1ccc(F)cc1)C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	735118564	WTMZTXNDCLRZAX-OAHLLOKOSA-N	435.525	1.479	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)CN2C(=O)CCc3ccccc32)cc1C	736823556	FGRGGUPSJTWCJK-UHFFFAOYSA-N	429.498	1.903	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)[C@@H]1CC(=O)N(c2ccc(F)c([N+](=O)[O-])c2)C1	737637570	FKLWULSMNNVQRL-CQSZACIVSA-N	430.392	1.451	50	20	IDGD	
COc1ccc(C(=O)NNc2ccnc(N(C)C)n2)cc1S(=O)(=O)Cc1cc(C)no1	740112482	KVIMTSCIRXYWMM-UHFFFAOYSA-N	446.489	1.578	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)c2cc(=O)n(-c3nc(C)cc(C)n3)[nH]2)cc1	741741557	YLQBZZMEBBJRON-AWEZNQCLSA-N	440.460	1.200	50	20	IDGD	
COC(=O)c1cc(Cl)cc(S(=O)(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)c1	743268598	ZXZSCHGLUUWTRC-UHFFFAOYSA-N	429.794	1.364	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2nc(C(C)C)ncc2Cl)cc1	743738243	YEUWWLQRAWSSFI-UHFFFAOYSA-N	439.925	1.644	50	20	IDGD	
COc1ccc(CC(=O)NNc2ccc(Cl)nc2)cc1S(=O)(=O)N1CCOCC1	743814966	NVNNLZDAWCDFSR-UHFFFAOYSA-N	440.909	1.450	50	20	IDGD	
Cc1cccc(N2C[C@@H](C(=O)NNC(=O)Nc3ccc(S(C)(=O)=O)cc3)CC2=O)c1C	743829978	IXKHJNCROFFJJU-HNNXBMFYSA-N	444.513	1.913	50	20	IDGD	
Cn1nc(Br)c2c(=O)n(CC(=O)NNc3ccc(Cl)c(F)c3)cnc21	746696348	YBVUTPDDQDIQIX-UHFFFAOYSA-N	429.637	1.828	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)NCCNS(=O)(=O)c2cccs2)cc1OC	747438156	QOWBNCQUBLECNN-UHFFFAOYSA-N	442.519	1.078	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(N2CCCC2)c(C(=O)NNC(=O)c2ccc[nH]2)c1	747664195	UERMFOGXFMZMIH-UHFFFAOYSA-N	433.534	1.720	50	20	IDGD	
CCCC[C@@H](NC(N)=O)C(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1	747780951	GANKIQWMKIVOTR-NHCUHLMSSA-N	437.544	1.988	50	20	IDGD	
Cc1nn(Cc2cccc(Br)c2)c(C)c1C(=O)NNC(=O)C(=O)NC(C)C	747906341	PJAICUJGJYHDKY-UHFFFAOYSA-N	436.310	1.596	50	20	IDGD	
Cc1ccsc1CCCC(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	747974676	GVZIFTAFMOEEPI-UHFFFAOYSA-N	428.558	1.985	50	20	IDGD	
N#Cc1cccc(NNC(=O)c2ccc3c(c2)S(=O)(=O)N(C[C@H]2CCCO2)C3=O)c1	748031643	YBMDFXVMLBTWMY-MRXNPFEDSA-N	426.454	1.639	50	20	IDGD	
CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)NNC(=O)COc1ccccc1O	749381920	LLLSSIWXAVMEFC-KRWDZBQOSA-N	428.420	1.286	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNS(=O)(=O)c1cc(Cl)c(Cl)c(C(=O)O)c1	751282377	KNHVYRVNRNIWQW-UHFFFAOYSA-N	436.229	1.024	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)NNC(=O)[C@@H](C)Oc2ccc3ccccc3c2)c(C)o1	751299014	ZJGWVHAUGJRYGS-CYBMUJFWSA-N	431.470	1.878	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)ccc1F	752577672	CKOPSRUVLLLYEB-UHFFFAOYSA-N	443.840	1.005	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)N[C@H]1CC(=O)N(c2cccc(C(F)(F)F)c2)C1	753034082	CSFKBZNLTOCDMJ-AAEUAGOBSA-N	432.399	1.193	50	20	IDGD	
CNC(=O)CN1CCN(C(=O)/C(C#N)=C/c2cn(CCC#N)nc2-c2ccccc2)CC1	754390070	UPGRYRGFFHSNSX-XMHGGMMESA-N	431.500	1.261	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H]2[C@H]3CCO[C@@H]3C23CCCC3)c1	755088504	MQBXVJITVIBFBM-ZACQAIPSSA-N	436.534	1.229	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)Nc1ccc(Cl)c(S(=O)(=O)N2CCOCC2)c1	755361726	OJNWGQLKZTZSIE-UHFFFAOYSA-N	441.897	1.166	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)Nc2cccc(OCCS(C)(=O)=O)c2)c1	756298009	QMZHELGGVIWELE-UHFFFAOYSA-N	437.474	1.594	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1ccc2nc(Cc3ccccc3)oc2c1	757673381	FQNHLCIDUIIYAV-LBPRGKRZSA-N	431.474	1.509	50	20	IDGD	
CCOC(=O)C(C)(C)n1cc(NC(=O)NNC(=O)c2cc(Br)c[nH]2)cn1	757721630	WKZLORVJDVCKRI-UHFFFAOYSA-N	427.259	1.738	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)Nc1ccc(F)c(S(=O)(=O)NC2CC2)c1	757872659	DVLQJZPVHLXZGB-UHFFFAOYSA-N	440.428	1.637	50	20	IDGD	
Cc1ccc(-c2csc3ncn(CCC(=O)NNC(=O)C(=O)NC(C)C)c(=O)c23)cc1	757983921	DPTUVFXVBPTFJQ-UHFFFAOYSA-N	441.513	1.496	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)c1cccc(OCc2cccc(Cl)c2)c1	758046341	HKXGLXINGSQUSX-GFCCVEGCSA-N	425.894	1.618	50	20	IDGD	
COc1ccc(-c2cc(C(=O)N3CCN(S(=O)(=O)CBr)CC3)n[nH]2)cc1	758528079	PAGSAKFPDMZJTA-UHFFFAOYSA-N	443.323	1.525	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NNC(=O)COc2ccccc2O)cc1Br	759791293	CDQNNZXYWVEHFA-UHFFFAOYSA-N	445.291	1.942	50	20	IDGD	
O=C(N=c1cc[nH]cc1I)NNC(=O)c1cc(-c2ccccc2)[nH]n1	760034739	OPFDASVQYRAJTJ-UHFFFAOYSA-N	448.224	1.965	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@H](CCC(N)=O)C(=O)NNc2cccc(C#N)c2)cc1C	760461013	WRNJMXYKRCRCCA-GOSISDBHSA-N	429.502	1.231	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)NCc1cc(S(N)(=O)=O)ccc1F	761692169	HOXFLKHMNGWAGR-UHFFFAOYSA-N	442.494	1.104	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NN=C2C(=O)Nc3cc(N(C)C)ccc32)c1	761743635	DGHOHZQHUNHIBY-UHFFFAOYSA-N	443.529	1.869	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)c2ccc(S(=O)(=O)N3CCOCC3)cc2)n1	762906848	AJMVGIQWHUYBHJ-UHFFFAOYSA-N	434.522	1.101	50	20	IDGD	
C[C@@H](O)c1cn(CC(=O)NNC(=O)[C@H]2Cc3ccccc3CN2Cc2ccccc2)nn1	763032963	PHMNUYMNXHWUJX-IIBYNOLFSA-N	434.500	1.106	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)N[C@@H]2CC[C@@H]3SCCS[C@H]32)nc1	763059356	BFIFTMNBTIFUJO-IPYPFGDCSA-N	431.609	1.774	50	20	IDGD	
O=C(NNC(=O)C1CC1)C(=O)Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1	763561363	FQAJSAXVIVADJP-UHFFFAOYSA-N	435.528	1.547	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccccc2S(C)(=O)=O)c2ccccc2n1	763614713	IBBSPQOYTAKNLH-UHFFFAOYSA-N	426.454	1.346	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(OC[C@@H]2CCCO2)cc1	763645807	CEPJICCANORQOH-KRWDZBQOSA-N	443.456	1.418	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2ccc(C)cc2OCCN(C)C)c1	763650873	ROJZQAJJXUJWDU-UHFFFAOYSA-N	442.516	1.717	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc3oc(N(C)C)nc3c2)cc1	763660107	XOBWKUIBVJEBSO-UHFFFAOYSA-N	427.417	1.067	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2cc(C(=O)N(C)C)ccc2C)c1	763664622	DCIAWNVBOZCEAE-UHFFFAOYSA-N	426.473	1.479	50	20	IDGD	
COC(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)COc2ccc(C)c(C)c2)c1	763665307	SWHGLGSXEFXEEX-UHFFFAOYSA-N	433.848	1.908	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(Oc3ccncc3)cc2)cc1	763678578	GSAZWKHSBTZJQB-UHFFFAOYSA-N	431.408	1.910	50	20	IDGD	
CCNC(=O)COc1cccc(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)c1	763686694	PXLUTWWVMSJEHF-UHFFFAOYSA-N	448.863	1.020	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2ccc(Cl)c(NC(C)=O)c2)c1	763772314	LDCPCSMATGZCMJ-UHFFFAOYSA-N	434.836	1.715	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)C(=O)Nc2cccc(SC(F)F)c2)c2ccccc2c1=O	763790534	KEUVHRCKNIZIBU-UHFFFAOYSA-N	447.423	1.648	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)N1C[C@H]2CCCN2c2ccccc21	763865443	PWYKTKKOOZCGKU-LSDHHAIUSA-N	426.448	1.756	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)CCC(=O)N2C	763866358	OUSFPTHYYRWOMK-GFCCVEGCSA-N	428.420	1.288	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(-n3ccnc3)nc2)cc1	763866433	PMPHJLPRZAXABI-CQSZACIVSA-N	438.444	1.219	50	20	IDGD	
CN(c1ccccc1NC(=O)C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)C1CCCC1	763917081	PCMDTHVRFWWAQY-UHFFFAOYSA-N	448.487	1.441	50	20	IDGD	
Cc1cccc(Cn2nccc2NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)c1	763977482	SMIANYDUJZIFIV-UHFFFAOYSA-N	427.848	1.999	50	20	IDGD	
Cc1cn(-c2ccc(C#N)cn2)nc1NC(=O)C(=O)NNC(=O)c1cn(C)c2ccccc12	763980485	JFGGTQGRWNORPW-UHFFFAOYSA-N	442.439	1.339	50	20	IDGD	
COc1cc(F)c(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2OC)cc1OC	764012606	SVCRTAZCBFMKEG-UHFFFAOYSA-N	425.800	1.905	50	20	IDGD	
N#CCCn1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Br)cc2Cl)n1	764058124	AEPPQZRGHZCTGX-UHFFFAOYSA-N	439.657	1.612	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2O1)C(=O)Nc1ccc(OCC2CCOCC2)cc1	764166973	GMEQHVAMRJDUCM-HXUWFJFHSA-N	439.468	1.582	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)CC2CCCC2)cccc1C(=O)N1CCSCC1	764189192	YHJUVAUTIZWBAV-UHFFFAOYSA-N	432.546	1.850	50	20	IDGD	
Cc1csc(Sc2ccc(NC(=O)C(=O)NNC(=O)CN(C)C)cc2Cl)n1	764204651	XIHAVOLMBBWKMX-UHFFFAOYSA-N	427.939	1.904	50	20	IDGD	
CN(C)CC(=O)NNC(=O)C(=O)Nc1ccc(COc2ccc(Br)cc2)cc1	764213529	YSEVVYFFZFSNDF-UHFFFAOYSA-N	449.305	1.676	50	20	IDGD	
Cc1nn(-c2ccc(C#N)cc2)c(NC(=O)C(=O)NNC(=O)c2cccc(C#N)c2)c1C	764231378	HTQKQCKEQYIDLF-UHFFFAOYSA-N	427.424	1.632	50	20	IDGD	
CCc1nnc(-c2cccc(NC(=O)C(=O)NNC(=O)COc3ccccc3O)c2)o1	764278484	QHHYNOQOYSOLGC-UHFFFAOYSA-N	425.401	1.170	50	20	IDGD	
CS(=O)(=O)Nc1ccc(O)c(C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)c1	764334419	UEQQLXNGUKOXBT-UHFFFAOYSA-N	440.428	1.691	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3ccc(O)c(Cl)c3)cn2)C[C@H](C)O1	764349741	UPBRTXILBJYBTE-RYUDHWBXSA-N	447.879	1.454	50	20	IDGD	
Cc1nnc(-c2cccc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc3ccccc3)c2)n1C	764379412	FAUWPPCZNXLINZ-UHFFFAOYSA-N	444.398	1.548	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc4c(c3)CCC(=O)N4)n[nH]2)cc1C	764389070	WJYQSNGBPRLVJV-UHFFFAOYSA-N	446.467	1.978	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)C(=O)Nc1ccc(O[C@H]2CCOC2)cc1	764402056	XDMDVLHCDMHTPH-HNNXBMFYSA-N	431.470	1.438	50	20	IDGD	
COC(=O)CCCN1CCC(=NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)CC1	764829809	HNZWZBUQDSUZND-UHFFFAOYSA-N	443.592	1.634	50	20	IDGD	
CC(=NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1)c1cc(C(N)=O)n(C)c1	764831352	NDGKLKOASMWUTM-UHFFFAOYSA-N	430.940	1.435	50	20	IDGD	
C[C@@](O)(CNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)c1cccc(Cl)c1	765243457	JZGANENRVIFGMY-HXUWFJFHSA-N	432.912	1.585	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)c3cc(C)cc(F)c3)CC2)cc1	765730711	XERJUBDRFDDIFN-UHFFFAOYSA-N	448.520	1.210	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1ccc(-n2cccn2)cc1	765734062	WEWKEIZCQIJUNN-UHFFFAOYSA-N	432.484	1.091	50	20	IDGD	
CCCc1nc(C)c(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)s1	765739556	YBRYYOXBKWKOPN-UHFFFAOYSA-N	429.546	1.623	50	20	IDGD	
CCOC(=O)c1cc(Br)ccc1NC(=O)C(=O)NNc1nccnc1OC	766265024	VGZRGVBWCYITIQ-UHFFFAOYSA-N	438.238	1.506	50	20	IDGD	
Cc1cc(F)cc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)c1[N+](=O)[O-]	766642932	PBBYFIIPPOCHQK-UHFFFAOYSA-N	443.435	1.261	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1cccc(Cn2ccnc2)c1	766644824	WRDPBLCILNPLFZ-UHFFFAOYSA-N	446.511	1.150	50	20	IDGD	
CCN(C(C)=O)c1nc(C=NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cs1	767128479	ZKSLOPIWCHZPJW-UHFFFAOYSA-N	429.911	1.581	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3nnc4ccccc4c3O)n[nH]2)cc1OC	768275765	FPONIGPUBITVNR-UHFFFAOYSA-N	434.412	1.818	50	20	IDGD	
CC1(C)CCC[C@@]2(C1)NC(=O)N(CC(=O)NNC(=O)c1cc(-c3ccccc3)on1)C2=O	768570639	HGTNHLQRNXLZOO-QFIPXVFZSA-N	439.472	1.993	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)C/N=C3/NS(=O)(=O)c4ccccc43)cc2C1	769375100	ISQZQHMEIGZJOU-NSHDSACASA-N	432.527	1.373	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)C(F)(F)c2ccc(OCC(=O)N(C)C)cc2)cc1	769648897	UYSUTKJHUHHRKF-UHFFFAOYSA-N	434.443	1.813	50	20	IDGD	
NS(=O)(=O)c1ccc(C(=O)NNC(=S)Nc2cccc(Br)c2)c(F)c1	769739098	QQIUQFUYCRFUMS-UHFFFAOYSA-N	447.311	1.867	50	20	IDGD	
COC(=O)c1cc(F)c(Br)c(S(=O)(=O)NNC(=O)c2ccccc2)c1	769861437	CCCDWJAJSQPURM-UHFFFAOYSA-N	431.239	1.998	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)Nc1ccc(OCC(N)=O)cc1	769955567	YYZLMIQMLIYBRE-UHFFFAOYSA-N	435.506	1.776	50	20	IDGD	
COC(=O)c1ccc(CCNC(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)cc1	770339194	BLKMPZHPIAYIMP-UHFFFAOYSA-N	427.465	1.942	50	20	IDGD	
CC(C)n1ncc2cc(S(=O)(=O)NNC(=O)C(=O)NCc3ccc(Cl)cc3)ccc21	771603614	CAHURSKTILNKOG-UHFFFAOYSA-N	449.920	1.897	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)c1ccc(F)c(S(=O)(=O)N2CCCC2)c1	771993001	JMXDRQQAULKDFO-CYBMUJFWSA-N	443.497	1.349	50	20	IDGD	
COc1cc(OCC(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)ccc1[N+](=O)[O-]	772195033	HEVWUSJMGDMDSL-UHFFFAOYSA-N	436.808	1.099	50	20	IDGD	
COc1cccc([C@@H]2[C@@H](C(=O)O[C@H](C)C(=O)NNC(=O)CC(C)C)CC(=O)N2C2CC2)c1	772234813	FKMXGFOPESCRRO-YMTYPPQLSA-N	445.516	1.872	50	20	IDGD	
CC[C@@H](C)NS(=O)(=O)Cc1cccc(NC(=O)C(=O)NNc2ccccc2[N+](=O)[O-])c1	773653563	AQZWLZRDFKJXQJ-CYBMUJFWSA-N	449.489	1.895	50	20	IDGD	
O=C(NCC1CCN(C2CC2)CC1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	775204262	PDNQWYYNECZAGQ-UHFFFAOYSA-N	449.577	1.290	50	20	IDGD	
C[C@@H]1CN(CCOc2ccc(CCNC(=O)NNC(=O)C(=O)N3CCCC3)cc2)C[C@@H]1C	775455965	VKLRSWQBCZVMJX-HDICACEKSA-N	445.564	1.149	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)N[C@@H]2C[C@H](OCC)[C@H]2OC)c2ccccc2c1=O	776528251	XAQSOCFKWRRDPD-AOIWGVFYSA-N	445.520	1.723	50	20	IDGD	
COc1ccc([C@@H](CNC(=O)NNc2cccc(S(C)(=O)=O)c2)N2CCOCC2)cc1	776608976	VKWNGOUSZVUFQT-HXUWFJFHSA-N	448.545	1.798	50	20	IDGD	
CCOc1ccc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)NC[C@@H](C)C#N)cc2)cc1	781944141	JRCSJWFVLKZOJB-AWEZNQCLSA-N	445.501	1.990	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)N[C@H]1CCC[C@@H](NC(=O)OC(C)(C)C)C1	782647242	CQRJVWDXLJDUKK-QWHCGFSZSA-N	429.518	1.677	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2ccccc2CN2CCN(C(C)=O)CC2)cc1	783023473	YFTPAQTYMAGNOP-UHFFFAOYSA-N	425.489	1.441	50	20	IDGD	
CCOC(=O)c1cc2cc(NC(=O)C(=O)NN[C@]3(C)CCS(=O)(=O)C3)ccc2s1	783426872	PBEHRSWUNDMVCD-GOSISDBHSA-N	439.515	1.215	50	20	IDGD	
Cc1cc(Br)cc(NC(=O)C(=O)NNC(=O)CNC(=O)c2cccs2)c1	784004983	MTZNXQKBUAMLOE-UHFFFAOYSA-N	439.291	1.335	50	20	IDGD	
CNC(=O)[C@H]1CN(C(=O)C(=O)NNc2ccc(C#N)c(C(F)(F)F)c2)c2ccccc2O1	784231907	JXILQWIRAHGQAY-MRXNPFEDSA-N	447.373	1.560	50	20	IDGD	
Cc1c(NNC(=O)C(=O)Nc2cccc(N3CCCS3(=O)=O)c2)cccc1[N+](=O)[O-]	784354289	ZXJUFVGUOBDQJW-UHFFFAOYSA-N	433.446	1.525	50	20	IDGD	
O=C(NC1CC1)c1cc(F)c(NNC(=O)[C@H]2CC=CC[C@H]2C(=O)N2CCOCC2)c(F)c1	784448091	FMBABBSXOVWXPZ-JKSUJKDBSA-N	448.470	1.741	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNc2ccccc2)cc1S(=O)(=O)N1CCOCC1	784769919	SFCKAEHUINMXHV-UHFFFAOYSA-N	448.501	1.188	50	20	IDGD	
NC(=O)C1CCN(c2ccc(NC(=O)C(=O)NNc3cccc([N+](=O)[O-])c3)cc2)CC1	784832046	YBOGPZOXYCIXIG-UHFFFAOYSA-N	426.433	1.378	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)Nc1ccc(N2CCCC2)c(Cl)c1	785022948	CSRJBSPMTYFQIJ-UHFFFAOYSA-N	447.835	1.954	50	20	IDGD	
COC(=O)CCNC(=O)c1ccc(NC(=O)C(=O)NNc2cc(F)cc(OC)c2)cc1	785241736	PHEWKCNNSWJJJS-UHFFFAOYSA-N	432.408	1.209	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)[C@@H](O)Cc2cccc(C(F)(F)F)c2)cc1	785739599	OPIATBFYCDESJG-INIZCTEOSA-N	435.358	1.485	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)C(=O)Nc2cnn(-c3ccc(C)cc3C)c2)c1	786417633	UILXJHRIMLCSTH-UHFFFAOYSA-N	435.444	1.242	50	20	IDGD	
N#C/C(=C/C1CC1)C(=O)OCC(=O)NCCN1C(=O)S/C(=C/c2cccnc2)C1=O	786674969	YTOKZLQBQQFXRO-IZKYPSLPSA-N	426.454	1.637	50	20	IDGD	
COC[C@@H](C)Oc1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)c1ccc2c(c1)OCO2	787894208	NHEAOIJEXNLXGV-LLVKDONJSA-N	449.847	1.882	50	20	IDGD	
Cn1nc([C@H]2CCCO2)cc1NC(=O)C(=O)NNc1c(F)cc(C(=O)NC2CC2)cc1F	789772610	BMGYYMRJKKBLBV-OAHLLOKOSA-N	448.430	1.524	50	20	IDGD	
CC(=O)N1CCc2c(NC(=O)C(=O)NNC(=O)[C@H]3OCC[C@H]3c3ccccc3)cccc21	789811603	FTIROMPCOZECNL-JXFKEZNVSA-N	436.468	1.254	50	20	IDGD	
CCCOc1cc(OC)ccc1C(=O)N1CCN(S(=O)(=O)CBr)CC1	789844713	FULBGHVGWUARQO-UHFFFAOYSA-N	435.340	1.924	50	20	IDGD	
COc1cc(NNC(=O)CNS(=O)(=O)c2ccc(CNC(C)=O)s2)ccc1Cl	790174271	GUEKMWYHKSEYGV-UHFFFAOYSA-N	446.938	1.468	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)CNC(=O)c2cccs2)ccc1C(F)(F)F	790958129	KDMOWFNZFLSDDJ-UHFFFAOYSA-N	444.391	1.291	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)[C@@](C)(O)Cn2cc(C(F)(F)F)ccc2=O)c1	792014745	MDWOVCKIAGSEJA-IBGZPJMESA-N	441.406	1.461	50	20	IDGD	
O=C(CCCCN1C(=O)c2ccccc2C1=O)NNC(=O)c1nnc(O)c2ccccc12	792575376	LXBFOJDGXYEHEI-UHFFFAOYSA-N	433.424	1.563	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)NCc2ncccc2O)cc1	792612560	MCIBHZRSMCBWOB-LFIBNONCSA-N	446.467	1.758	50	20	IDGD	
COCC1(C(=O)NNC(=O)COc2ccc(C#N)cc2)CCN(C(=O)OC(C)(C)C)CC1	792802139	VRJJPBVSASWRIL-UHFFFAOYSA-N	446.504	1.748	50	20	IDGD	
CCOC(=O)c1cc(S(=O)(=O)NNC(=O)c2nnc(-c3ccccc3)o2)ccc1C	795304886	YCFJYGFINPOIAE-UHFFFAOYSA-N	430.442	1.845	50	20	IDGD	
CCOC(=O)c1cc(S(=O)(=O)NNC(=O)C2CCN(c3ncccn3)CC2)ccc1C	795315546	UUPAZCFLCLTOGK-UHFFFAOYSA-N	447.517	1.188	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2cc(S(=O)(=O)N(C)C(C)C)ccc2C)n1	797370195	VSSVQWBDUHFVOQ-UHFFFAOYSA-N	447.517	1.127	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)nn1)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	798154405	HBCYDOCXAPPJLN-UHFFFAOYSA-N	434.847	1.907	50	20	IDGD	
COc1ccc(-n2c(C)cc(/C=C(\C#N)C(=O)NCCC(=O)NS(C)(=O)=O)c2C)cc1	800551977	GVGGUGPJZOQDJA-SFQUDFHCSA-N	444.513	1.592	50	20	IDGD	
CC1(C)NC(=O)N(CCCC(=O)NNc2cc([N+](=O)[O-])ccc2Br)C1=O	800616678	QCGOMDLYIWAOLN-UHFFFAOYSA-N	428.243	1.911	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2CC(=O)N(c3ccc(Cl)c(F)c3)C2)cc1	801109240	XJTDLTLYFPWXRT-GFCCVEGCSA-N	432.839	1.927	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)NC(=O)c2cc3c(C)nn(C)c3s2)cc1	801109930	IZBVWWRYOOKNFQ-GFCCVEGCSA-N	442.501	1.156	50	20	IDGD	
CN(c1ccccc1)S(=O)(=O)c1ccc(C(=O)NNC(=O)N=c2cc[nH]cc2)cc1	802031344	GEVQSFLZPYTWPK-UHFFFAOYSA-N	425.470	1.795	50	20	IDGD	
CCc1nnc(NC(=O)[C@@H](C)[C@H](C)NC(=O)NNC(=O)COCc2ccccc2)s1	805141398	DKIVLWODVUJDCM-STQMWFEESA-N	434.522	1.611	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2cc(F)c(Br)c(Cl)c2)n1	806975163	PJDRPZLBDGIEJO-UHFFFAOYSA-N	446.664	1.841	50	20	IDGD	
Cc1c(I)cc([N+](=O)[O-])cc1C(=O)NNC(=O)N1CCN(C)CC1	807382828	QXQUFCXLEUFSSP-UHFFFAOYSA-N	447.233	1.110	50	20	IDGD	
O=C(NCc1ccncc1OC[C@H]1CCOC1)NNC(=O)c1cnn(-c2ccccc2)c1	807616973	ZCQHGTJNGSLDAC-INIZCTEOSA-N	436.472	1.827	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C1(S(=O)(=O)c2ccccc2)CCOCC1	808297437	MULUMVOSZSAJET-UHFFFAOYSA-N	432.498	1.408	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)C(=O)Nc3cccc4c3COC4=O)n[nH]2)c1	808938857	GHETZRNJGRDVCC-UHFFFAOYSA-N	433.424	1.764	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cccc4c3OCC(=O)N4)n[nH]2)cc1	810386909	WYDGXEJTIGWSFN-UHFFFAOYSA-N	434.412	1.116	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccccc1F)NNc1c(F)cc(C(=O)NC2CC2)cc1F	810563886	WTHUOSIKOCLCRQ-UHFFFAOYSA-N	442.419	1.418	50	20	IDGD	
C[C@@]1(CNC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)OCCc2sccc21	811945813	IGISTSNJRPMQLQ-SFHVURJKSA-N	438.531	1.975	50	20	IDGD	
COC[C@H](C)[C@@H](C)C(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	812452096	BYXWDRLPSXKUSP-JKSUJKDBSA-N	433.530	1.845	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)N[C@H]1C[C@H](C)S(=O)(=O)c2sccc21	812658663	OCZZFFQJLRRASI-AAEUAGOBSA-N	439.515	1.773	50	20	IDGD	
COCCOCc1ccc(CNC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1	813182146	FKUBRPASLUQFMB-UHFFFAOYSA-N	439.472	1.241	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)c1cnn(C)c1I	814721369	CTQNCOIUBAEGGN-UHFFFAOYSA-N	444.229	1.263	50	20	IDGD	
O=C(CNC1(Cc2ccc(F)cc2)CCOCC1)NNC(=O)c1ccc([N+](=O)[O-])cc1	815131051	MEOXARFWYYHTRR-UHFFFAOYSA-N	430.436	1.876	50	20	IDGD	
CN(Cc1ccccc1)c1ccccc1NC(=O)C(=O)NNC(=O)[C@H]1CCc2nncn2C1	815692618	WCXDYHLZZWRANP-KRWDZBQOSA-N	447.499	1.263	50	20	IDGD	
CCc1nc2cc(NC(=O)C(=O)NNc3ccccc3S(=O)(=O)N(C)C)ccc2o1	815752543	WMNIEVPDJCUVSP-UHFFFAOYSA-N	431.474	1.722	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)[C@H](O)[C@@H](O)c1nc2ccccc2s1	817054079	RWHFWERRWNAGTC-HZPDHXFCSA-N	436.515	1.084	50	20	IDGD	
CC(=O)Nc1cccc(NC(=S)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1	913140997	SVFVGKYWGKEXQX-UHFFFAOYSA-N	435.531	1.527	50	20	IDGD	
CC(=O)c1cccc(S(=O)(=O)NCC(=O)NNC(=S)Nc2ccc(C)c(C)c2)c1	913432228	KTCVHJDLQNWYEY-UHFFFAOYSA-N	434.543	1.802	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)CCc1ccc(S(=O)(=O)NC2CC2)cc1	913915174	MYZKOOFPEVUOQN-UHFFFAOYSA-N	447.513	1.295	50	20	IDGD	
C[C@]1(NNC(=O)NC[C@@H](c2c(F)cccc2Cl)N2CCCC2)CCS(=O)(=O)C1	916433859	XDRUHLUFMITQMN-YJBOKZPZSA-N	432.949	1.997	50	20	IDGD	
CCCNC(=O)CN1CCC(NC(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)CC1	916518720	IJQRDEZJLLGMSA-KRWDZBQOSA-N	433.553	1.392	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)c1ccc2c(c1)S(=O)(=O)N(C1CC1)C2=O	916746739	QQFPPTLHTQIHNM-UHFFFAOYSA-N	439.453	1.024	50	20	IDGD	
NS(=O)(=O)c1ccc(Br)c(C(=O)NNC(=O)c2ccc(Cl)nc2)c1	917253474	NRNHLEDXHQEYST-UHFFFAOYSA-N	433.671	1.220	50	20	IDGD	
Cc1cc(Br)ccc1C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	917319554	HYDZLUIROKYCLK-MRXNPFEDSA-N	449.257	1.902	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)o2)c2ccccc2n1	918691917	KREGIRLCVZCQRG-UHFFFAOYSA-N	428.470	1.996	50	20	IDGD	
NC(=O)c1ccc(/C=C/C(=O)N2CCC[C@H]2C(=O)NNC(=O)c2ccc(Cl)nc2)cc1	920037734	UHULOZHENHNSHA-YKXBDCQTSA-N	441.875	1.299	50	20	IDGD	
COCCCNC(=O)NNC(=O)c1ccc2c(=O)n(Cc3ccco3)c(S)nc2c1	920862042	JKQBUCOGDDWELW-UHFFFAOYSA-N	431.474	1.307	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1CNC(=O)NNc1ccc(-n2cccn2)nn1	920920912	QRMWFDKZVOTZMZ-UHFFFAOYSA-N	444.521	1.565	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)NCCc2nnc3n2CCCCC3)CC1	1116084480	QMBLWJBJBSZICN-UHFFFAOYSA-N	449.556	1.525	50	20	IDGD	
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)c1cncn1-c1ccccc1	1248428231	JQGCAUUCXFSIOV-FQEVSTJZSA-N	430.468	1.862	50	20	IDGD	
COc1ccc([C@]2(C)NC(=O)N(CC(=O)NNc3ccc(C(C)(C)C)nn3)C2=O)cc1	1318944579	KRJUVLADGWJHAG-NRFANRHFSA-N	426.477	1.693	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)[C@@]2(O)CCN(Cc3ccccc3)C2)CC1	1322233973	RDPAQROLAGVRGD-HSZRJFAPSA-N	446.548	1.418	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2cncn2-c2ccccc2)ccc1OC	1339375536	CBIQBKURESKRNF-UHFFFAOYSA-N	430.442	1.291	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cccc3nc[nH]c23)C1	1777860859	VYKCQWMNEZJDBH-QLVMHMETSA-N	434.924	1.944	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)Cn3c(=O)n(C)c4ccccc43)C2)C1	1778164156	BSPIXJXIZAXFRC-QVKFZJNVSA-N	434.924	1.187	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cn4ccsc4n3)C2)C1	1778632146	UPHUKVGJFJHLDM-MEDUHNTESA-N	427.324	1.623	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4ncnn4c3)C2)C1	1778742028	NDVXDPWYQJPFRN-MSOLQXFVSA-N	426.304	1.409	50	20	IDGD	
Cc1cccn2ncc(C(=O)N3CCO[C@]4(CCN(C(=O)CO[Si](C)(C)C)C4)C3)c12	1779299412	SQHFTEMNRCOQPQ-NRFANRHFSA-N	430.581	1.938	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)CCn3c(=O)oc4ccccc43)CCO2)C1	1781215584	RXYOZVWHJVNSGK-BTYIYWSLSA-N	435.908	1.832	50	20	IDGD	
CCO/C=C/C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2	1782379025	BBNPTAGSPARNFM-LCWKFOBHSA-N	445.520	1.185	50	20	IDGD	
CCOc1cnc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](Br)CC)C3)C2)cn1	1783342583	CAIKOIIOVIAJIY-FZKQIMNGSA-N	441.326	1.492	50	20	IDGD	
COc1ccc(CC(=O)N2CCO[C@]3(CCN(C(=O)[C@H](C)Br)C3)C2)cc1O	1783529320	UFWKOFCZMNFDDH-ORAYPTAESA-N	441.322	1.557	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)CNC(=O)c3cccs3)CCO2)C1	1783532627	QEGMRWLOWBKQMF-YVEFUNNKSA-N	444.351	1.091	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ncn(-c4ccccc4)n3)CCO2)C1	1783534198	GKCYTQKRIBYTSZ-IFXJQAMLSA-N	448.321	1.494	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(C)nc4ccc(O)cc34)CCO2)C1	1783875325	PVPSVHWBGAFXIK-AVRDEDQJSA-N	447.919	1.946	50	20	IDGD	
O=C(Cc1ccc2ncccc2c1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21	1784805019	KLKNJVWVEDRESR-XEYPJELSSA-N	431.920	1.357	50	20	IDGD	
C[C@@H](NC(=O)c1ccccc1)C(=O)N1CC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1785553278	RHZWMSYSLFRBEE-ZHRRBRCNSA-N	435.952	1.900	50	20	IDGD	
CC(C)(C)OC(=O)NCC(C)(C)C(=O)N1CC[C@]2(CN(C(=O)[C@@H](F)Cl)CCO2)C1	1785737317	ZEFOEMFNMSKPDU-YJYMSZOUSA-N	435.924	1.902	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(O)n3)[C@H]2C1	1786046939	XQZKNCCEZXVZKR-ABHRYQDASA-N	426.311	1.554	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(F)c(C)c3N)[C@H]2C1	1786948821	VUEPZUYTMZHMTC-FAYQHZLMSA-N	427.904	1.563	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC1(c2ccc(NC(=O)C3CCOCC3)cc2)CCC1	1787809822	LHTQZNVTQNIMEQ-UHFFFAOYSA-N	437.500	1.859	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3nc4ccccn4c3C)[C@H]2C1	1787858963	GVDMSWGQJZEDEY-NXOAAHMSSA-N	434.924	1.490	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C34CC(C(F)(F)F)(C3)C4)C[C@@H]21	1791249190	FSALRPRIQYJZMN-PBPQCTSDSA-N	438.874	1.953	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1ccc(C2(NC(=O)c3cc(O)nc(O)n3)CCC2)cc1	1791600236	VGMRGPAOLHSFSP-UHFFFAOYSA-N	442.476	1.009	50	20	IDGD	
CCC[C@H](NC(=O)c1ccccc1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCl	1793106951	LOBKUFGTBBAOGW-XCDZQEORSA-N	435.952	1.823	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1sccc1F	1793557795	REPQBNXFDHUGOL-NNGSTNBRSA-N	447.492	1.224	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCc1cccc([N+](=O)[O-])c1	1793944235	OJNRNCIDILUSOF-BCDXTJNWSA-N	445.520	1.539	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CNC(=O)c1cccnc1	1794222650	QSKRMOAPACHTFL-HNKHHVNMSA-N	437.338	1.481	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnccn1	1794645460	YQKAMKPNAVRKMZ-AHHPBITISA-N	439.422	1.565	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1(c3ccccc3)CCC1)C2	1796192091	HTAKPIAAGXBBIK-KOUNCHBCSA-N	432.329	1.740	50	20	IDGD	
C[C@@H]1Oc2ccc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@H](F)Cl)cc2NC1=O	1796366129	NMEDJUKOXMYWHS-PXLMAEHWSA-N	425.844	1.144	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CO)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C(C)(C)CCl)C2	1796738626	YUGNRWGUNDNNOP-XGUBFFRZSA-N	431.961	1.775	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](O)[C@@H](C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](F)Cl)C1	1796809435	MPMGDRAORRTJOL-KARBZBNUSA-N	447.935	1.777	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@]1(F)CCCCC1(F)F	1797212893	MCJZRMJDJCOBBI-RFJMFJJWSA-N	426.863	1.747	50	20	IDGD	
C=C[C@@H](O)C(C)(C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2	1798394703	CYYNLBPZGOUXAF-JTLQTOQASA-N	429.521	1.332	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CC(=O)N(C3CCCC3)C1)C2	1799263264	ILXTZVSHRZAVME-VVRDOHNDSA-N	425.957	1.385	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)Nc1nccs1)C2	1800639493	GCZMXFHVVRQLMB-QNSTZXKLSA-N	445.383	1.707	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1cccc(O)c1)C2	1800762858	HNNQZZDIYXMWEB-LJGDNWOOSA-N	425.323	1.698	50	20	IDGD	
COc1cc(OC)c(F)c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C(Cl)Cl)c1	1801016717	WOPUPFYTVBAJIC-KEODLESXSA-N	435.279	1.850	50	20	IDGD	
COc1ccc(F)cc1CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCC(=O)NN(C)C	1802339899	SSIKWRCZFRMLPF-BCDXTJNWSA-N	434.512	1.388	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@H]1CCN(C(=O)c2cc(O)n[nH]2)[C@@H]1c1cccnc1	1803010070	ZLPKFVRQBHUORV-AXAPSJFSSA-N	436.310	1.861	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2snnc2C2CC2)[C@@H]1c1cccnc1)[C@H](O)CCl	1803139238	MPGJZXNAOSUPIR-SQWLQELKSA-N	435.937	1.730	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cccc3nc[nH]c23)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803139860	XFVVZQKSKMSYJG-UCLAIMLFSA-N	427.892	1.877	50	20	IDGD	
O=C(c1ccc2cncn2c1)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1	1809978638	FRIBSGATYKZGTQ-UHFFFAOYSA-N	446.316	1.173	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2cccc(F)c2)[C@H]1c1cccnc1	1813072837	KYLAYHKZRVAMMY-GCJKJVERSA-N	441.507	1.913	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)C2=COCCC2)[C@H]1c1cccnc1	1813073370	IUZGUWDACDDYPE-UWJYYQICSA-N	429.521	1.155	50	20	IDGD	
CC[C@H](NC)C(=O)N[C@@H]1CCc2nc(NC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)sc2C1	1817280239	QUDBCFHQLADLJH-SSAQJZBFSA-N	445.549	1.187	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2n[nH]c3c2CS(=O)(=O)C3)[nH]n1)[C@H](F)Cl	1818037479	KCZPGUWLFURKTB-RISCZKNCSA-N	444.876	1.402	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@H](O)CCl)CC2)c1n[nH]c2ccc(F)cc12	1819205591	DYYBIDPDRIJGLC-NOZJJQNGSA-N	437.884	1.984	50	20	IDGD	
CCNC(=O)N[C@@H](C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCBr)[nH]n1	1819350196	KFDFUECZPIHIRT-WCQYABFASA-N	443.346	1.894	50	20	IDGD	
CC(C)N(C)CC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819404801	ZUDCUZRCQAWRNJ-KRWDZBQOSA-N	442.524	1.054	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H]1CCC=CO1)CC2	1819797837	MBNYZIDGICJIND-NHYWBVRUSA-N	442.501	1.060	50	20	IDGD	
Cc1cc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@@H](O)CCl)CC3)n(C(F)F)n1	1821567611	PWIIQULXPFKQMB-KCJUWKMLSA-N	433.868	1.869	50	20	IDGD	
CCS(=O)(=O)CC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](C)Br)n[nH]1	1822183972	IJEXZLNULQXHEW-ZYHUDNBSSA-N	435.344	1.620	50	20	IDGD	
COc1cc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@H](O)CCl)CC3)ccc1O	1822241464	XXACQGFMKNKHQI-GXFFZTMASA-N	425.894	1.683	50	20	IDGD	
Cc1ccc(C(=O)NCC(=O)Nc2cc([C@@H]3CCCCN3C(=O)[C@H](O)CCl)[nH]n2)cc1	1823510929	TVJHMWORMMYYJY-DLBZAZTESA-N	447.923	1.740	50	20	IDGD	
COc1ccc([C@H](O)C(=O)N2CCCC[C@H]2C2CCN(C(=O)[C@@H](O)CCl)CC2)cc1	1823948786	CSWBQYAFRRIMSR-UFYCRDLUSA-N	438.952	1.948	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H](O)N2CCOCC2)CC1	1824616943	RIXNBCMEDOOUQS-WAOWUJCRSA-N	429.989	1.664	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)C[C@H]2CCCCO2)CC1	1824904537	BXXHEFOIBKBTRU-YADHBBJMSA-N	442.365	1.559	50	20	IDGD	
CCC(=O)N[C@H](C)C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](C)Br)sc2C1	1825636230	RXTXPZXECBZWSZ-BBBLOLIVSA-N	431.356	1.753	50	20	IDGD	
COc1cccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)n1	1825673009	OJLBWILHEWXZQQ-IBGZPJMESA-N	445.564	1.697	50	20	IDGD	
Cc1ocnc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1	1829430561	DELQEFZNVDPPMV-LJQANCHMSA-N	425.294	1.210	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)c2ncccc2F)CC1	1829458999	OATDUONYJMBDJF-FQEVSTJZSA-N	439.296	1.448	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(C4CC4)on3)CCO2)C1	1830201313	YELVUOMRPWZENA-KZULUSFZSA-N	442.310	1.405	50	20	IDGD	
COc1ncc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)cc1F	1830358726	RFGUWCSTXDJPKC-FQEVSTJZSA-N	443.903	1.564	50	20	IDGD	
COC(=O)CCCCCC(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830370162	JQNHIGZKCPORGI-NRFANRHFSA-N	446.972	1.831	50	20	IDGD	
C[C@H](Cc1ccccn1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830370292	POIUASYVMXYFET-VGOFRKELSA-N	437.968	1.982	50	20	IDGD	
Cc1cccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)n1	1830920995	CLYFJTITEMXXFQ-AEFFLSMTSA-N	444.301	1.079	50	20	IDGD	
COc1ccccc1CCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1830991706	DNGWXAXXOMSLOL-ICSRJNTNSA-N	428.888	1.619	50	20	IDGD	
CSCC(C)(C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)Br)C2)C1	1831539531	RMIBGYXSVBOGLG-CXAGYDPISA-N	437.400	1.615	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccn4nccc4c3)C2)C1	1831650259	GJZRYCQFCAFQFL-WIYYLYMNSA-N	434.924	1.812	50	20	IDGD	
CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@H](F)Cl)CC1	1832139361	WLSBMIRXCBFIKT-SQNIBIBYSA-N	441.935	1.611	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)CCSC(=N)N)CC2)CC1	1833532156	FUFXLSIDTGFSTQ-MRXNPFEDSA-N	432.034	1.982	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccccn3)CCO2)C1	1833989887	VBBYZJXPEPXHMU-KDOFPFPSSA-N	426.311	1.325	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3coc(C)n3)CCO2)C1	1834213986	XQTVKCSRLZJOFO-GUYCJALGSA-N	430.299	1.227	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1)c1ccc(O)cn1	1834338099	CLWBMCUGGONPEP-INIZCTEOSA-N	443.317	1.663	50	20	IDGD	
COC(=O)CCC(=O)NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1	1834434467	CNXVHVISTGRORU-INIZCTEOSA-N	436.322	1.202	50	20	IDGD	
CO[C@H](C(=O)NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)c1ccccc1	1834577074	MCWWMLARWIJFID-UXHICEINSA-N	437.968	1.545	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnc(OC)c(C)c3)CCO2)C1	1834579528	AKPQMVKYFQWWCN-OXQOHEQNSA-N	425.913	1.486	50	20	IDGD	
O=C(Cn1cc(Cl)cn1)NC1CCN(C2CCN(C(=O)C(Cl)Cl)CC2)CC1	1834815076	PXVOMFBXXRDWFT-UHFFFAOYSA-N	436.771	1.912	50	20	IDGD	
Cn1nc2c(c1C(=O)N1CCC(N3CCC(NC(=O)[C@H](F)Cl)CC3)CC1)CCC2	1835081444	QLHOREFMIUKRBG-SFHVURJKSA-N	425.936	1.628	50	20	IDGD	
Cc1n[nH]cc1C(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)CBr)CC2)CC1	1836152146	COPLJPVLMTUHCZ-ZDUSSCGKSA-N	440.386	1.934	50	20	IDGD	
O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)c1cnccc1F)CCO2	1836313232	CZHDJCZIJKAHCS-KRWDZBQOSA-N	430.274	1.076	50	20	IDGD	
CC1CCN(CC(=O)N2CCC(OC3CCN(C(=O)[C@H](O)CCl)CC3)CC2)CC1	1836714702	ZUYNRUSGPSJENJ-LJQANCHMSA-N	429.989	1.317	50	20	IDGD	
O=C(c1n[nH]c2ccc(F)cc12)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1837041237	ADZWVTIGHDSPIS-MAUKXSAKSA-N	428.823	1.306	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)c3cnnn3C)CC2)CC1	1837232485	ALMBBGJWKXLHRB-GFCCVEGCSA-N	428.331	1.211	50	20	IDGD	
Cc1ccc(CCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)CO[Si](C)(C)C)CCO3)cn1	1837710083	HLGPDPLLLNGQOS-JOCHJYFZSA-N	449.624	1.631	50	20	IDGD	
Cc1nc(F)ccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1838268078	ZGRYEQNEHLFJKK-PBHICJAKSA-N	448.264	1.290	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccccc3Cl)C2)C1	1840154189	OWXOIXYPYBIQTC-APWZRJJASA-N	431.316	1.664	50	20	IDGD	
O=C(COc1ccccc1F)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840189609	BYVIJXQFQMYTLK-GOSISDBHSA-N	435.279	1.465	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H]1CC[C@H](C(=O)N2CC3(CCCN3C(=O)[C@H](O)CCl)C2)CC1	1841348219	PRQWERLXYINYKC-BZUAXINKSA-N	443.972	1.873	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)[C@@H]2CCCCN2C)C1	1841366986	DHRUBLXXFMHRGJ-SFHVURJKSA-N	444.488	1.821	50	20	IDGD	
O=C(c1cc(-c2ccccc2)no1)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843011548	OYNCXZXKLJGACT-UHFFFAOYSA-N	431.257	1.152	50	20	IDGD	
CCSc1cccnc1C(=O)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843011767	QNLATTHHYLYHFP-UHFFFAOYSA-N	425.319	1.004	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1noc3c1CCCC3)C2	1843415699	BQJZIQXDGJDEBD-ZVHZXABRSA-N	438.488	1.504	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1c[nH]c3cnccc13)C2	1843416160	GZSKGACDAYHVDW-VULFUBBASA-N	433.472	1.514	50	20	IDGD	
COc1ccc(/C=C/C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](O)CCl)c(OC)c1OC	1847558150	IDNOKTKLECNYBM-QHIJJQPXSA-N	438.908	1.527	50	20	IDGD	
O=C(c1c[nH]c2ncc(C(F)(F)F)cc12)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl	1847564261	WGNVHMURFSJUEP-MELADBBJSA-N	430.814	1.997	50	20	IDGD	
Cc1cnn(CC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)c1	1848099063	FPAUOEFHZLQMHQ-JYJNAYRXSA-N	439.944	1.525	50	20	IDGD	
CCOc1ccccc1C(=O)NCCCC(=O)NNC(=O)c1n[nH]c(=O)c2ccccc12	15855730	XHAWTWPPRNDTJH-UHFFFAOYSA-N	437.456	1.293	50	20	IDGD	
CS(=O)(=O)NCCc1ccc(C(=O)NNC(=O)c2ccc(Br)s2)cc1	24308034	SATAPJDQUZUHDZ-UHFFFAOYSA-N	446.348	1.677	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(C(=O)NNC(=S)Nc2cccc(Cl)c2)cc1	26858252	JQFGIXHTFSFKJE-UHFFFAOYSA-N	442.950	1.896	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)CN2C(=O)N[C@@](C)(c3ccc(F)cc3)C2=O)cc1	28028964	QNWADGDTZJTTFX-NRFANRHFSA-N	444.488	1.841	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CCCN(C(=O)NNC(=O)CNC(=O)c2cccs2)C1	725872985	IKBZHBZUTRFSNS-GFCCVEGCSA-N	425.511	1.208	50	20	IDGD	
NS(=O)(=O)c1ccc(CNC(=S)NNC(=O)c2cc3c(s2)CCCCC3)cc1	726445188	QSBZXOJECLTJPX-UHFFFAOYSA-N	438.600	1.974	50	20	IDGD	
O=C(NNC(=S)NCCc1ccc2c(c1)OCCO2)c1cc(Br)c[nH]1	726748610	ZKNZUQVNKLJPPM-UHFFFAOYSA-N	425.308	1.900	50	20	IDGD	
CC(=O)Nc1cc(Cl)ccc1C(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	727530314	XJISDAKMVHCPSG-UHFFFAOYSA-N	434.792	1.825	50	20	IDGD	
CNS(=O)(=O)c1cccc([C@@H](C)NC(=O)NNC(=O)c2cc(OC)cc(OC)c2)c1	727607299	ATJNOKDYKQTMMJ-GFCCVEGCSA-N	436.490	1.317	50	20	IDGD	
Cc1ccc(C)c(-n2c(C)nnc2SCC(=O)N([C@H]2CCS(=O)(=O)C2)N(C)C)c1	728178540	CITWFYGGRQLTIK-INIZCTEOSA-N	437.591	1.777	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)c2c(C)oc3ncn(C)c(=O)c23)c1	728529114	RWLUCBUSFACKLI-UHFFFAOYSA-N	435.234	1.681	50	20	IDGD	
COc1ccccc1[C@H](C)CC(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	728658134	GKSDHIAIQXKTEU-KUHUBIRLSA-N	428.441	1.719	50	20	IDGD	
C[C@@]1(c2ccc3ccccc3c2)NC(=O)N(CC(=O)NNC(=O)c2cccc(C#N)c2)C1=O	728827140	JQQLTUDBWOXNEM-DEOSSOPVSA-N	441.447	1.940	50	20	IDGD	
O=C(NNS(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-])C1CCN(c2ncccn2)CC1	728853860	DXFVSKZRYFMWHN-UHFFFAOYSA-N	440.869	1.264	50	20	IDGD	
CSCC[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)NNC(=O)c1cccc(C#N)c1	728871784	DRHWZPXHILQMJF-QGZVFWFLSA-N	441.469	1.779	50	20	IDGD	
Cc1ccccc1NC(=O)NNC(=O)NCc1cccnc1N1CCC(C(N)=O)CC1	729230044	ICBFHUIUAQEOEC-UHFFFAOYSA-N	425.493	1.628	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCCCN1CCCCC1=O	730129509	SDVCPYWFBUDBJW-ZDUSSCGKSA-N	441.326	1.949	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CC(=O)N(c2ccc(F)cc2)C1)C1CCN(c2ncccn2)CC1	730179506	LAOOWCRSECIZRT-OAHLLOKOSA-N	426.452	1.033	50	20	IDGD	
C[C@H]1CCCN(S(=O)(=O)c2cc(C(=O)NNC(=O)c3ccc4c(c3)OCO4)n(C)c2)C1	730206670	XPLSTURXYZESLU-ZDUSSCGKSA-N	448.501	1.249	50	20	IDGD	
CC1CCN(S(=O)(=O)c2ccc(C(=O)NNC(=O)NCc3ccco3)s2)CC1	730215471	HMICLQUXICRMJK-UHFFFAOYSA-N	426.520	1.906	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](Cc1cn(Cc2ccccc2)cn1)C(=O)NNC(=O)C1CC1	730512696	PGBMXLHJIVAYAX-SFHVURJKSA-N	427.505	1.925	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2C(=O)[C@@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2=O)cc1Br	732034112	ZCPJLRHCKBMCOP-VCXDHIOWSA-N	448.273	1.026	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCCN2C(=O)Cc3ccccc32)cc1Br	732244045	BDVXPOARFKDCQR-UHFFFAOYSA-N	447.289	1.991	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCC[C@H]1C(=O)N1CCCC1)C1CCN(c2ncccn2)CC1	732761939	QMOLWYXRDQCJLU-ZWKOTPCHSA-N	428.537	1.269	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)[C@@H]2CCCN2S(=O)(=O)c2cccc([N+](=O)[O-])c2)c(C)o1	732932738	WPFLFLMKGAFVRD-INIZCTEOSA-N	436.446	1.419	50	20	IDGD	
Cn1c(N)c(C(=O)/C(C#N)=C\c2csc(-c3cccc([N+](=O)[O-])c3)n2)c(=O)n(C)c1=O	733193298	XXNIMZQKFXKVNC-WDZFZDKYSA-N	438.425	1.488	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)[C@@H](c1ccccc1)N1CCSCC1	734241617	SBMIQLRHFHALKT-MRXNPFEDSA-N	437.566	1.632	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N[C@@H](CCSC)C(=O)NNc2cccnn2)cc1	736704367	STLNUXAUNMOZLV-HNNXBMFYSA-N	425.536	1.419	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)N[C@@H]2[C@H]3CCO[C@H]3C2(C)C)c2ccccc2c1=O	741426235	QLWPUGNSVMAZGL-KBAYOESNSA-N	427.505	1.954	50	20	IDGD	
Cc1cc(N2CCCS2(=O)=O)ccc1C(=O)NNC(=O)[C@H](C)Oc1ccc(F)cc1	741661177	BVYXVMQQLZURAY-AWEZNQCLSA-N	435.477	1.903	50	20	IDGD	
CC(C)[C@@H](C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1)c1ccccc1	743419947	QHGQXLUIMXWYRA-LJQANCHMSA-N	431.562	1.901	50	20	IDGD	
O=C(NCCCN1C(=O)CNC1=O)NNC(=O)Nc1ccc(Br)cc1Cl	743601236	VPPFGMCLSYGDBL-UHFFFAOYSA-N	447.677	1.380	50	20	IDGD	
O=C(COC(=O)[C@@H]1C[C@H]1c1ccc2c(c1)OCCO2)NNC(=O)c1cccc([N+](=O)[O-])c1	745285690	XZUSULWOCJNZSM-JKSUJKDBSA-N	441.396	1.474	50	20	IDGD	
O=C(NNc1c(F)cc(F)cc1Br)N[C@H]1CCN(CCN2CCOCC2)C1	745827513	LAXPOLRYBFRTCF-ZDUSSCGKSA-N	448.312	1.760	50	20	IDGD	
CN(C)C(=O)NNC(=O)c1ccc(NC(=O)C[C@@H]2SC(N3CCCC3)=NC2=O)cc1	746003244	CNCPTIFJEBHXLL-AWEZNQCLSA-N	432.506	1.025	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)[C@@H]2C[C@@H](O)CN2C(=O)OCc2ccccc2)c1	746092843	FYXNXPSSGIMNKU-QUCCMNQESA-N	441.484	1.602	50	20	IDGD	
COc1cccc(/C=C(\C(=O)NNC(=O)Cc2cn3ccccc3n2)n2nnnc2C)c1	746550571	PCYUNPNGLVRHFL-WOJGMQOQSA-N	432.444	1.026	50	20	IDGD	
C[C@@H]1CN(S(=O)(=O)c2ccc(C(=O)NNC(=O)c3ccc(C#N)cc3)cc2)C[C@@H](C)O1	747175678	FUQHBLLWKMVWNU-HUUCEWRRSA-N	442.497	1.431	50	20	IDGD	
O=C(NNC(=O)c1cc(S(=O)(=O)N2CCOCC2)c(Cl)cc1Cl)c1ccc[nH]1	747663154	BQGFXJSCYZVSLW-UHFFFAOYSA-N	447.300	1.417	50	20	IDGD	
CC(C)(C(N)=O)N1CCN(C(=O)/C(C#N)=C/c2cn(CCC#N)nc2-c2ccccc2)CC1	747922706	UHEUDKSXPVCEBR-XDJHFCHBSA-N	445.527	1.779	50	20	IDGD	
O=C(CSc1nnc(C2CC2)n1Cc1ccccc1)NNC(=O)C(=O)N1CCCC1	748247508	QQCKYWKFFXWUGS-UHFFFAOYSA-N	428.518	1.066	50	20	IDGD	
CC(C)(C)[C@@H](NS(C)(=O)=O)C(=O)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1	748521620	XCZWDBFDHHGURM-NSHDSACASA-N	431.458	1.387	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)[C@@H]1CCCN1S(=O)(=O)c1cccs1	749162309	XCXDCYHOEVPKNI-AWEZNQCLSA-N	427.479	1.267	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cccc(CS(N)(=O)=O)c2)ccc1OCCC(C)C	749403893	RCUTWEFDQWYYES-UHFFFAOYSA-N	449.529	1.983	50	20	IDGD	
COc1cc([N+](=O)[O-])ccc1OC(=O)CS(=O)(=O)N1CCN(c2cccc(C)c2)CC1	751165188	OHCWGFYOYQXGOO-UHFFFAOYSA-N	449.485	1.969	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)NNC(=O)CNC(=O)c2ccco2)c(C)n1C[C@H]1CCCO1	751206482	HSMTYIKEIYQIPO-WAFWZSCLSA-N	439.472	1.361	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)c1ccc(CS(C)(=O)=O)o1	751292192	DQDVSGPLOOQSKV-SNVBAGLBSA-N	445.291	1.815	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)c1ccccc1F)C(=O)NNC(=O)c1ccc(C)o1	752781150	PVOICAONVRENMD-CYBMUJFWSA-N	429.495	1.588	50	20	IDGD	
COC(=O)c1ccc(-n2cc(C)cn2)c(NC(=O)NNC(=O)COc2ccccc2O)c1	754466341	RRVISRQIQMOKOM-UHFFFAOYSA-N	439.428	1.905	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)N[C@H]1CCN(c2c(F)cccc2F)C1=O	755086211	OCIFRMJWZNQSLL-AWEZNQCLSA-N	434.399	1.488	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)Nc2ccc(C(=O)N3CCOCC3)cc2)cc1	755933398	LICUYBFJQCXTSR-UHFFFAOYSA-N	428.445	1.399	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2nnc(-c3ccco3)s2)c2ccccc2c1=O	756031054	WVBZOUZYRHYQIG-UHFFFAOYSA-N	425.430	1.994	50	20	IDGD	
O=C(CCSc1ccc(F)cc1)NNC(=O)NCCN1C(=O)[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O	756101982	ZTKKQQGTLQRXPF-DSIZOQBWSA-N	446.504	1.445	50	20	IDGD	
Cc1c(CS(C)(=O)=O)cccc1NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	756598383	SFUQOBRXDMLGJE-UHFFFAOYSA-N	443.485	1.253	50	20	IDGD	
CCOC(=O)C1(NCC(=O)NNC(=O)c2ccc(OC)c(OC)c2)Cc2ccccc2C1	756599269	SFKUKWJNXJKJTG-UHFFFAOYSA-N	441.484	1.155	50	20	IDGD	
COCC[S@@](=O)Cc1cccc(NC(=O)NNC(=O)COc2ccccc2C#N)c1	756614697	UVHRCPWATIFQSC-SSEXGKCCSA-N	430.486	1.685	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2cnn(-c3ccccc3)c2)c1	756708407	QHLRYADJJFWUCC-UHFFFAOYSA-N	428.474	1.589	50	20	IDGD	
O=C(NNC(=O)c1c(Cl)cccc1Cl)Nc1cnn(CCN2CCOCC2)c1	756826690	JENGGHVCOMGZOQ-UHFFFAOYSA-N	427.292	1.989	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)C(C)(C)CNC(=O)OC(C)(C)C	756899184	BEYXTRILAXHTHC-UHFFFAOYSA-N	441.554	1.600	50	20	IDGD	
CCCOc1ccc(C(=O)NNS(=O)(=O)c2cn(CC)nc2[N+](=O)[O-])cc1OC	756930202	SJRVMFXFTYPAHR-UHFFFAOYSA-N	427.439	1.232	50	20	IDGD	
CC1CCN([C@@H](CNC(=O)NNC(=O)C(=O)Nc2ccccn2)c2cccs2)CC1	758669246	CNPGNRZLNBIMIO-HNNXBMFYSA-N	430.534	1.885	50	20	IDGD	
CCn1cc(C(=O)C(=O)NNc2nc3ccccc3c(=O)n2CCCOC(C)C)cn1	759100399	AKILLYNGGUUWGK-UHFFFAOYSA-N	426.477	1.754	50	20	IDGD	
CS(=O)(=O)c1ccc(CNC(=O)NNC(=O)COc2ccccc2O)cc1Cl	759286050	VETKNCIOEDJWDT-UHFFFAOYSA-N	427.866	1.359	50	20	IDGD	
C[C@H](CO)CCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	759635421	SIPOMTLVXFMWTJ-INIZCTEOSA-N	448.545	1.518	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc2c(c1)COC2)NNC(=O)c1c(Cl)cccc1Cl	759776929	FXOXFJYTKBHLJP-UHFFFAOYSA-N	444.296	1.763	50	20	IDGD	
CC(C)C[C@@H](C(=O)NNc1nccc(N2CCOCC2)n1)N1C(=O)[C@H]2CC=CC[C@H]2C1=O	762869310	VMBPPUKDVZWBQL-BBWFWOEESA-N	442.520	1.122	50	20	IDGD	
CC(=O)NNC(=O)C(=O)Nc1ccc(S(=O)(=O)c2ccc(Br)cc2)cc1	763517294	WUCDEKRVXBLMHA-UHFFFAOYSA-N	440.275	1.388	50	20	IDGD	
O=C(NNC(=O)c1ccccc1F)C(=O)Nc1ccc2nc(N3CCOCC3)oc2c1	763575040	PITUELGKZFCLQF-UHFFFAOYSA-N	427.392	1.203	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(OC3CCC3)c(F)c2)cc1	763659179	KRJDGALGHNLCSK-UHFFFAOYSA-N	431.420	1.931	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)C(=O)Nc1ccnn1-c1ccc(Cl)cc1	763680781	WDGDARNDVPXVRY-UHFFFAOYSA-N	431.811	1.830	50	20	IDGD	
Cc1ccc(N2CCOC2=O)cc1NC(=O)C(=O)NNC(=O)c1cccc(N(C)C)c1	763760916	VWXDJGWBHCOFOC-UHFFFAOYSA-N	425.445	1.417	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(NC(=O)OC(C)(C)C)nc2)cc1	763809093	JTTQVKXXVAPVRF-UHFFFAOYSA-N	443.460	1.902	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccc(F)c(Br)c1	763842171	DIKPWSDMWFRTQD-UHFFFAOYSA-N	428.189	1.892	50	20	IDGD	
CC(=O)N1CCCc2cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc3ccccc3F)ccc21	763849550	KCBGQSYASGBWPV-ZDUSSCGKSA-N	442.447	1.678	50	20	IDGD	
CC[C@@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)cc1	763873777	WHFDOFFCPKSVMF-KGLIPLIRSA-N	444.463	1.907	50	20	IDGD	
COC(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)CCSc2ccc(F)cc2)cc1	763895738	RFACVHDWBGXVBD-UHFFFAOYSA-N	433.461	1.810	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)C(=O)NCC3)ccc1OC(C)C	763916747	VONLBTXTJQJWKN-UHFFFAOYSA-N	440.456	1.168	50	20	IDGD	
CC(C)OC(=O)NCc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccc(F)cc2)cc1	763920048	CNAVCTWFXOQILF-UHFFFAOYSA-N	430.436	1.789	50	20	IDGD	
COC(=O)N(C)Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1	764005572	BJJUUQFHOOYQOE-UHFFFAOYSA-N	442.428	1.056	50	20	IDGD	
Cc1nc(N2CCOCC2)ccc1NC(=O)C(=O)NNC(=O)c1ccc2ccccc2c1	764066818	KEUAOMCTULCXGK-UHFFFAOYSA-N	433.468	1.780	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)nc1)C(=O)Nc1ccccc1CN1CCSCC1	764102483	ZUNLDULXQPHZKU-UHFFFAOYSA-N	433.921	1.684	50	20	IDGD	
COc1ccc(C(=O)N2CCCC2)cc1NC(=O)C(=O)NNC(=O)c1ccc(C#N)cc1	764177578	RBELSSCQVKLDIN-UHFFFAOYSA-N	435.440	1.203	50	20	IDGD	
CCn1cc(NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3CN2Cc2ccccc2)cn1	764179308	QKVPDYQJLCJGFW-OAQYLSRUSA-N	446.511	1.616	50	20	IDGD	
COc1ccc(C(=O)N2CCCC2)cc1NC(=O)C(=O)NNC(=O)CCc1ccccc1	764191757	FCVPYPNQFLHSFY-UHFFFAOYSA-N	438.484	1.650	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)CCO3)cc1Br	764327374	YOUWOSRCIRUNAB-UHFFFAOYSA-N	434.246	1.792	50	20	IDGD	
CNS(=O)(=O)c1ccc(C)c(NC(=O)C(=O)NNC(=O)CCCc2cccs2)c1	764339417	LJXPWYCREWECKD-UHFFFAOYSA-N	438.531	1.073	50	20	IDGD	
CCOC(=O)c1ccn(-c2ccccc2NC(=O)C(=O)NNC(=O)c2ncccc2C)n1	764385866	NUOHROYGQPARGN-UHFFFAOYSA-N	436.428	1.152	50	20	IDGD	
CNC(=O)c1cc(Oc2ccccc2NC(=O)C(=O)NNC(=O)c2ncccc2C)ccn1	764386137	QXZKQXZCRAEFHG-UHFFFAOYSA-N	448.439	1.337	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccccc1F)NNC(=O)CSc1ccccc1O	765250100	BTHPCBNTGQLMCQ-UHFFFAOYSA-N	427.479	1.139	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)CCNS(=O)(=O)c3ccccc3)n[nH]2)cc1	765571854	QRQJPPSLUDWUGC-UHFFFAOYSA-N	441.513	1.769	50	20	IDGD	
Cc1ccc(OCCCC(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cc1	765733883	SBVROMNAOPZUEP-UHFFFAOYSA-N	438.528	1.759	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)CC(C)CC(=O)NNC(=O)c1ccccc1OC	766631453	NBSVLHRDTWGNBK-UHFFFAOYSA-N	442.472	1.342	50	20	IDGD	
CCOC1CC(CNC(=O)NNC(=O)c2cccc(OC(F)F)c2)(N2CCOCC2)C1	767795917	NQYIUSFANKQNCY-UHFFFAOYSA-N	442.463	1.502	50	20	IDGD	
CC(C)Oc1ccc(S(=O)(=O)N2CCN(S(=O)(=O)CBr)CC2)cc1	767848551	BLRHNAJBIBZVHZ-UHFFFAOYSA-N	441.369	1.462	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)/C(=C\c1ccc(F)cc1)n1nnnc1C	768641536	RULKWOODJXNYTP-RVDMUPIBSA-N	446.464	1.674	50	20	IDGD	
CC1(C)C(=O)Nc2ccc(C(=O)NNC(=O)CCN3CCN(c4ccccc4)CC3)cc21	768903796	KMVXZBHAXWRCSL-UHFFFAOYSA-N	435.528	1.890	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2c(C)cccc2F)cc1OCC(=O)NC1CC1	770815254	LYAHPOBCAMTFBY-UHFFFAOYSA-N	430.436	1.882	50	20	IDGD	
COc1ccccc1N1C[C@H](C(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)CC1=O	770968243	UBTIWIQMHGKVLQ-GFCCVEGCSA-N	439.476	1.792	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)Cc2cc(Br)ccc2F)c1	771248286	BTYPBSFVGCRKTH-UHFFFAOYSA-N	429.267	1.995	50	20	IDGD	
CN(CCNC(=O)NNC(=O)NCc1ccc(Cl)cc1)S(=O)(=O)c1cccs1	772014691	CGMPUOJCZWNHGF-UHFFFAOYSA-N	445.954	1.736	50	20	IDGD	
CCCc1c(NC(=O)C(=O)NNC(=O)Cn2nc(C)cc2C)cnn1-c1cccc(C)c1	773531557	ZYBUVOBZVSMXRR-UHFFFAOYSA-N	437.504	1.733	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2cccc(CS(=O)(=O)C3CCCCC3)c2)n1	773724536	ULHPUQGJJTYTKE-UHFFFAOYSA-N	447.517	1.815	50	20	IDGD	
C[C@H]1CN(CCOc2ccc(CCNC(=O)NNC(=O)c3cnn(C)c3)cc2)C[C@@H]1C	774772905	OPMMLLAVNYRWPF-IRXDYDNUSA-N	428.537	1.573	50	20	IDGD	
N#Cc1ccc(CSCC(=O)N2CCN(S(=O)(=O)CBr)CC2)cc1	777779363	JDYBRYHBXSUKDO-UHFFFAOYSA-N	432.365	1.618	50	20	IDGD	
CCOC(=O)c1cnn(-c2ccc(C(=O)NNC(=O)CNC(=O)OC(C)(C)C)cc2)c1C	778437271	WWVWKMOYJFPNOM-UHFFFAOYSA-N	445.476	1.643	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)CNC(=O)OC(C)(C)C)n1nnc(-c2ccc(Cl)cc2)n1	778438407	WDCIYAOSGUYEHJ-CYBMUJFWSA-N	437.888	1.617	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCc2ccco2)cc1C(=O)NNc1cc(Cl)nc(N)n1	779373707	XJQNJFITDSOIEA-UHFFFAOYSA-N	436.881	1.849	50	20	IDGD	
COc1ccc(Cn2nccc2NC(=O)NNC(=O)c2c[nH]nc2C)c(OC)c1OC	779459278	KLXGELRRAJZLFV-UHFFFAOYSA-N	429.437	1.455	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN1c1ccccc1)c1cccc(S(=O)(=O)N2CCCC2)c1	780850633	IMSJPXOXDORQLG-HXUWFJFHSA-N	442.541	1.901	50	20	IDGD	
Cc1ccc(C(=O)N2CCSCC2)cc1NC(=O)C(=O)NNc1ncncc1Cl	782159830	WMVNHTMGVWNVAH-UHFFFAOYSA-N	434.909	1.709	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C(=O)Nc2cccc(COCC3CC3)c2)nc2ccccc21	782894159	NJDFCHFLIXRDJW-UHFFFAOYSA-N	435.484	1.829	50	20	IDGD	
CN(C)C(=O)COc1ccc(NC(=O)C(=O)NNc2ccccc2Br)cc1	782985357	WIOGYCCKYUPOTC-UHFFFAOYSA-N	435.278	1.998	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2ccc(COCc3ccccc3)cc2)CCS(=O)(=O)C1	783424525	FFMLNMOKHNWHAT-OAQYLSRUSA-N	431.514	1.540	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)CCS(=O)(=O)C1	783428652	YAKHNLOIEWIBKY-GHTZIAJQSA-N	426.498	1.479	50	20	IDGD	
COC(=O)[C@@](C)(CNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)c1ccccc1	787261933	XOEPKFBTUKKDBI-QFIPXVFZSA-N	440.504	1.154	50	20	IDGD	
N#C/C(=C\c1cn(CCC(N)=O)nc1-c1ccc(Br)cc1)C(=O)NOCCO	787297519	WCKSTXGDSPUSAG-UKTHLTGXSA-N	448.277	1.135	50	20	IDGD	
CCC(O)(CC)CCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	788324854	ZSPDCPKIWQCNKL-UHFFFAOYSA-N	440.566	1.746	50	20	IDGD	
O=C(NNC(=O)C(=O)N1CCCC1)N[C@H]1CCCN(c2ccc(Cl)cc2Cl)C1	788923889	STHYZNIIRWWLJB-ZDUSSCGKSA-N	428.320	1.915	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2nc3c(s2)CCCC3)cc1	789740431	GRUFENXKSZKIGP-GFCCVEGCSA-N	430.486	1.778	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1ccc(C(N)=O)cc1)C(=O)NNc1cc(Cl)cc(Cl)c1	791732258	YNKVBCZETMONNW-SECBINFHSA-N	431.301	1.902	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)[C@@H]2Cc3cc(Br)ccc3O2)c2ccccc2c1=O	792015582	DELFNTYHRIZVAN-HNNXBMFYSA-N	443.257	1.461	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)NCCCCn1cc(Br)cn1	792225864	MCJUPKIZJNFOKH-UHFFFAOYSA-N	426.271	1.541	50	20	IDGD	
C[C@H]1C[C@@H](C)CN(C(=O)c2ccccc2NC(=O)C(=O)NNc2nc3ccccn3n2)C1	792387804	IOZXPOHXEOWQGQ-GASCZTMLSA-N	435.488	1.929	50	20	IDGD	
CN(C)N(C(=O)[C@@H]1CCCN(C(=O)Nc2ccccc2F)C1)[C@H]1CCS(=O)(=O)C1	792855045	NMBQPPPYTNTOPI-CABCVRRESA-N	426.514	1.562	50	20	IDGD	
CC(C)Oc1ccc(NC(=O)C(=O)NNC(=O)CCOc2ccccc2)cc1C(N)=O	797002711	RCFPWJKRDCBQRE-UHFFFAOYSA-N	428.445	1.128	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)CCN2CCN(C(=O)[C@H]3CCCO3)CC2)c2ccccc2n1	799009500	ZZIUWQFFCQHIKE-HXUWFJFHSA-N	439.516	1.018	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@H](C(=O)NNC(=O)Nc2cc(F)cc(F)c2)[C@H](C)O)cc1	802004318	MQUZXJRXQLZGPF-ZBEGNZNMSA-N	442.444	1.154	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(-c2ccc(Cl)s2)nc1	802567065	HMTLJSDNESZZDO-JTQLQIEISA-N	426.882	1.601	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)N[C@@H](CO)C(N)=O)c(C)n1-c1ccc(Br)cc1	804356710	NCVQEHRLOITRPO-AAKUMTKESA-N	431.290	1.726	50	20	IDGD	
CC(C)(C(=O)NNC(=O)COc1ccccc1O)S(=O)(=O)c1ccc(Cl)cc1	806816295	CLEPLNVNECECJK-UHFFFAOYSA-N	426.878	1.824	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C(=O)Nc1cccc(C(=O)NCCOC)c1)c1ccccc1	806980352	WAHJQOGBJZDAGB-SFHVURJKSA-N	426.473	1.343	50	20	IDGD	
Cc1ccccc1[C@H]([C@@H](C)NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)N(C)C	807406509	RWFAGJYZDOAUGX-QRWLVFNGSA-N	436.516	1.877	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)NCC2(S(C)(=O)=O)CCCC2)c1	807538042	WMJYWHLUNDAUDT-UHFFFAOYSA-N	448.339	1.759	50	20	IDGD	
COc1ccc(CN2CC[C@@H](NC(=O)NNc3nc4ccccn4n3)C2=O)c(OC)c1	807577828	KKEMOWMMPMFGOV-OAHLLOKOSA-N	425.449	1.174	50	20	IDGD	
COC(=O)c1cn(-c2cccc(NC(=O)NNC(=O)COc3ccc(F)cc3)c2)nn1	812979206	BZLQMLZHIXINQJ-UHFFFAOYSA-N	428.380	1.425	50	20	IDGD	
CCOc1cc(NC(=O)NNC(=O)[C@@H]2CCc3nncn3C2)c([N+](=O)[O-])cc1OCC	814523749	JYDSMSSVHCTULE-LLVKDONJSA-N	433.425	1.399	50	20	IDGD	
C[C@](O)(C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1)c1ccc(Cl)cc1	815498645	KHOCTSSEPQGIOP-OXQOHEQNSA-N	434.832	1.078	50	20	IDGD	
O=C(NNC(=O)c1cc2ncccn2n1)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	816830993	BAZQXDZOJPMELT-UHFFFAOYSA-N	439.439	1.506	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@@H](O)[C@@H](O)c2nc3ccccc3s2)cc(OC)c1OC	825457260	QQXABQCJUVHILM-JKSUJKDBSA-N	447.469	1.178	50	20	IDGD	
CCCS(=O)(=O)Nc1cccc(C(=O)NNC(=O)Cc2nc3ccccc3n2C)c1	829582884	SKXFTYCTIPVLCK-UHFFFAOYSA-N	429.502	1.729	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(-n3cccn3)nc2)c1	874340261	PVJPWDVAUCLLKD-UHFFFAOYSA-N	442.501	1.373	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C[C@H](NC(N)=O)c2cccc(C)c2)cc(OC)c1OC	913660843	LEUOYNFWWBAESQ-HNNXBMFYSA-N	430.461	1.582	50	20	IDGD	
CN1CCN([C@H](CNC(=O)NNC(=O)c2ccc3c(c2)OCCO3)c2cccs2)CC1	915901691	KWKGNAKWIDSHNW-MRXNPFEDSA-N	445.545	1.452	50	20	IDGD	
Cc1nn(-c2ccc(C(F)(F)F)cn2)c(C)c1CC(=O)NNC(=O)C(=O)NC(C)C	916040774	HYPHKDNNXCMPJO-UHFFFAOYSA-N	426.399	1.117	50	20	IDGD	
Cc1cccc([C@@H](CNC(=O)NNC(=O)COc2ccc(C#N)cc2)N2CCOCC2)c1	916435863	PVCGTOQXXJAGPN-OAQYLSRUSA-N	437.500	1.649	50	20	IDGD	
COCCOCCNC(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	916628434	OZQFCFFUVASLPQ-UHFFFAOYSA-N	439.472	1.052	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)NCc2ccc(S(=O)(=O)NCCOC)cc2)cc1	916648919	FCHHRKHYNCXFAS-UHFFFAOYSA-N	434.518	1.318	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)CN(C)S(=O)(=O)c3ccccc3)n[nH]2)cc1	917178655	PHYYNIFPAMRUSN-UHFFFAOYSA-N	427.486	1.467	50	20	IDGD	
Cc1nc(N2CCOCC2)nc(O)c1CCC(=O)NNC(=O)Cc1ccc2ccccc2c1	917195723	WYVOGWSNUTWXJK-UHFFFAOYSA-N	449.511	1.803	50	20	IDGD	
CCCn1nc(C(=O)NNS(=O)(=O)c2ccc3c(c2)C(=O)OC3)c2ccccc2c1=O	917721871	KNXMDSGKLHBIOG-UHFFFAOYSA-N	442.453	1.100	50	20	IDGD	
O=S(=O)(NNc1ccc(S(=O)(=O)NC2CC2)cn1)c1ccc(CCCl)cc1	917737230	PBFGYWDGIMNOJA-UHFFFAOYSA-N	430.939	1.609	50	20	IDGD	
O=C(NCCOC1CCCC1)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	918085266	XKTYGPZYPVNNIC-UHFFFAOYSA-N	438.550	1.764	50	20	IDGD	
O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)NNC(=O)c1ccc2c(c1)OCCO2	918218988	ANENQBDHQUVEDQ-UHFFFAOYSA-N	444.463	1.702	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)[C@H](CSC)N1C(=O)[C@H]2CCCC[C@H]2C1=O	919822967	XMBPJIOQAVOWLQ-XHSDSOJGSA-N	433.530	1.292	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)[C@@H]2CCCN(S(=O)(=O)c3ccccc3)C2)cc1	919834301	VYBOXECJVJPMDI-GOSISDBHSA-N	445.541	1.876	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cccn2C)cc1S(=O)(=O)Cc1cc(C)no1	919839215	CAWSBVWKSBEZOA-UHFFFAOYSA-N	432.458	1.379	50	20	IDGD	
Cc1cc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)no1	920235856	WWXJXDDDHXPQBY-UHFFFAOYSA-N	443.485	1.606	50	20	IDGD	
C[C@H](CC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1)n1ccnc1	920422607	FBCBJIGTQBASFV-MRXNPFEDSA-N	441.513	1.774	50	20	IDGD	
Cn1nc2ccccc2c1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	1116664247	AYHDDXFIZNCFGI-UHFFFAOYSA-N	441.513	1.823	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NC2CCN(C(=O)Cc3ccccc3OC)CC2)cc1	1318092114	KNIQGFXXPNNDON-UHFFFAOYSA-N	440.500	1.882	50	20	IDGD	
O=C(NNS(=O)(=O)c1c(F)cccc1Br)c1cc([N+](=O)[O-])ccc1O	1319103833	LCJVSWLCZPFVHP-UHFFFAOYSA-N	434.199	1.825	50	20	IDGD	
Nc1cnnc(NNC(=O)CCNC(=O)c2cc(F)ccc2Br)c1Cl	1319218096	DPTPVFYWDACRKK-UHFFFAOYSA-N	431.653	1.877	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)c1ccc(N2CCC[C@@H](C(N)=O)C2)cc1	1324036097	FQCMBPMMUABHBG-GDBMZVCRSA-N	428.464	1.756	50	20	IDGD	
CCC[C@@H](C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2)n1cccc1	1778041339	CRHBZEMJXGERCJ-XKGFGPFHSA-N	425.957	1.943	50	20	IDGD	
O=C(c1cc2cccnc2[nH]1)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1778590425	ABUCQPQKHFFWSO-GUYCJALGSA-N	425.258	1.697	50	20	IDGD	
Cn1nc(C(F)(F)F)cc1C(=O)N1CC[C@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1779656067	CWLIQMMZLYPQGW-KRWDZBQOSA-N	448.518	1.734	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Cl)C2)c1cc(=O)nc2sccn12	1779988428	KUCDRFVODDHPFK-RVZJWNSFSA-N	442.900	1.418	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2)c1cc(Cl)c(O)cc1O	1780843317	JUHJSEHXZQVNQJ-GPMSIDNRSA-N	447.315	1.478	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H]1CCC(=O)NC1)C2	1781897364	ISLALNODVZPVAQ-NRTGNBEESA-N	444.370	1.200	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)N1C[C@H]3C[C@H]3C1)C2	1781998138	UNGAABAUGNMIJY-SQPDSBPRSA-N	442.398	1.624	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(C)n(C(F)F)n1)C2	1782173675	MIHGZHDVINFGBL-ZBQZNYHESA-N	448.898	1.968	50	20	IDGD	
O=C([C@H](O)CCl)N1CCO[C@@]2(CCN(C(=O)C3(c4ccc(Cl)cc4)CC3)C2)C1	1782964665	MQYDBCIVDLRLPS-APWZRJJASA-N	427.328	1.801	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)CC3CCN(C)CC3)CCO2)C1	1783339558	SYBGEFRAJHUZGK-QFBILLFUSA-N	430.387	1.722	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3[nH]nc4ncccc34)CCO2)C1	1783347250	CWPYPTSUEJLYHV-SCLBCKFNSA-N	436.310	1.575	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(C(N)=O)cc3)CCO2)C1	1783354165	NRQQRENDVIMERU-BEFAXECRSA-N	438.322	1.403	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccccc3-n3nccn3)CCO2)C1	1783537792	RLKAPYHHWQHWOI-KUHUBIRLSA-N	448.321	1.494	50	20	IDGD	
CC(C)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(F)(F)C(F)(F)C(=O)O)C[C@@H]21	1783846512	XFPIICGTNGBGNJ-DCAQKATOSA-N	446.825	1.586	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)Cc3cccc([N+](=O)[O-])c3)CCO2)C1	1783868278	DXKXTZFJVYWWOI-QFBILLFUSA-N	425.869	1.221	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)/C=C/c3ccc(OC)cc3F)CCO2)C1	1783879351	QOHRSOCJPPVCNP-NWWLCNQNSA-N	440.899	1.931	50	20	IDGD	
CC[S@@](=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]2C1	1783966294	DMAVUYXXCGIYKM-CAVVLOLHSA-N	437.400	1.156	50	20	IDGD	
Cc1noc(C)c1CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21	1785078086	KMRSPHGUVJHLLN-BPUTZDHNSA-N	428.327	1.599	50	20	IDGD	
CCOC(=O)N[C@@H](O)C(=O)NC1(c2ccc(NC(=O)CCBr)cc2)CCC1	1787673291	SUCCYWZVGSAVKN-HNNXBMFYSA-N	442.310	1.970	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)[C@@H]3[C@H]4C=CS[C@@H]43)CCC2)cc1)c1cccc(B(O)O)c1	1788150331	CXRKKODKMXNPKR-AQNXPRMDSA-N	434.326	1.989	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC1(c2ccc(NC(=O)CCc3cnn(C)c3)cc2)CCC1	1788176764	BPTFIQOPOZYUDI-UHFFFAOYSA-N	440.548	1.860	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1ccc(C2(NC(=O)[C@@H](O)CCl)CCC2)cc1	1788642655	LDGPSMGYQLQSKD-ROCQKPIASA-N	445.907	1.854	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(CO)o3)[C@H]2C1	1788898268	ZXZGJRSNBPJTOF-DUPGQFARSA-N	429.311	1.396	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC1(c2ccc(NC(=O)c3cc4ncccn4n3)cc2)CCC1	1789261100	DGIQFBDXZXCTLP-UHFFFAOYSA-N	449.515	1.850	50	20	IDGD	
CC(C)(C)n1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]32)nn1	1789356573	WMIYWNZCEBUOMU-VODUFIJXSA-N	446.379	1.863	50	20	IDGD	
Cc1nnc(CCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]3C2)s1	1789868302	AQZSHRBXXNTNKO-NUXNZHGMSA-N	449.404	1.995	50	20	IDGD	
Cc1nnc(CCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]3C2)s1	1789922138	HXADUAINGULGPD-JUFZMCDQSA-N	449.346	1.449	50	20	IDGD	
CCN(CC)C[C@@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]2C1	1789924887	FVAZEXFCMFPGBC-YXMSTPNBSA-N	436.366	1.635	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(F)nc3)C[C@@H]21	1790960757	ROHSYRYZHRUPAV-XQLPTFJDSA-N	428.302	1.988	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3noc4ccccc34)C[C@@H]21	1791253672	FLBVDPUZMDQEPV-AMVTXUCVSA-N	435.908	1.604	50	20	IDGD	
O=C(Cc1ccc(O)cn1)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1	1791935282	AABFCMHJIXMEAN-UHFFFAOYSA-N	445.284	1.457	50	20	IDGD	
COC(=O)c1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Cl)C[C@@H]32)c(C)c1	1792096934	QMTHOKPJVDOYRS-QSPRXWTASA-N	426.872	1.909	50	20	IDGD	
COCCCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2	1792841542	HAUFPKYNQHDXDO-YVWYUNDQSA-N	449.460	1.150	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(C(F)(F)F)c(F)c1)C2)[C@@H](O)CCl	1792979772	GPOXFSYEPJYVPR-JLUCKKNBSA-N	438.805	1.647	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCl)C1=C2c3ccccc3C(=O)N2CC1	1793113462	KZASJWNGASIRQW-KYZVSKTDSA-N	429.904	1.495	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/C1CC1)C2	1793878363	XHZWBGGWEQCEBT-HMUZGSGMSA-N	441.956	1.674	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cccnc1Cl	1793952840	SCORKVJGVCNEOE-OEYIWLLWSA-N	444.757	1.898	50	20	IDGD	
COC(OC)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1794141589	QIWPEUNXSFMDOM-CRWXNKLISA-N	433.933	1.376	50	20	IDGD	
O=C(Cc1cc(F)ccc1Cl)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1	1796187894	JWOLGGIGVDKEQO-REPLKXPHSA-N	444.699	1.653	50	20	IDGD	
C[C@H]1Oc2ccc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@H](F)Cl)cc2NC1=O	1796366127	NMEDJUKOXMYWHS-KDDSUGKUSA-N	425.844	1.144	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc2c[nH]nc12	1796638968	VLAWDELMHKSYJQ-AUHJYUKYSA-N	447.499	1.949	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccnn1-c1ccccc1	1796739080	WMJYPTJXNGNQSU-ZXFNITATSA-N	447.333	1.859	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(-c3cccnc3)[nH]n1)C2	1797956984	VBOLGELWKCKZMQ-CWPLJXCYSA-N	443.580	1.526	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1c[nH]c3ncccc13)C2	1798440235	GYFSCHXLVPHXCM-BTTYYORXSA-N	433.472	1.127	50	20	IDGD	
C[C@@H](Nc1cccnc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Br	1799346651	UZISWZNQZHYWCZ-GGUBGCTKSA-N	429.290	1.162	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(C)(C)NCCC#N)C2	1800639003	FYJYIFVGCCTADW-LXTVHRRPSA-N	429.359	1.031	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(-c2ccc(O)nn2)cc1)[C@@H](O)CCl	1800814967	AGAUUTKVJWYWEU-DFGXFYAUSA-N	430.892	1.701	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(F)c(N(C)C)c(F)c1)C2	1800979747	YOSKCNYKBRGWAY-UMPJEAMMSA-N	445.894	1.488	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)Oc1cccnc1	1801405744	UGQJGXDOBSDKGN-CTTHAOKLSA-N	440.338	1.612	50	20	IDGD	
COc1ccccc1CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnccc1C(=O)NN)C2	1801787346	KDKHESCSROXPFO-BJWYYQGGSA-N	437.500	1.188	50	20	IDGD	
COc1ccc([C@@H]2C[C@@H]2C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CCC(=O)NN(C)C)cc1	1802334941	UTBBVPKAGYKEPO-LBFCPWMRSA-N	442.560	1.810	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cncc(C(F)(F)F)c1)C2	1802337208	KBVIJCDZINPDRP-MUJYYYPQSA-N	441.454	1.725	50	20	IDGD	
COC(OC)C(=O)N1CC[C@H](CNC(=O)[C@@H](C)CBr)[C@H]1c1cccnc1	1803010671	IQGBRBZLBIOSJD-NWANDNLSSA-N	428.327	1.737	50	20	IDGD	
Cn1nc(C(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]2c2cccnc2)c2c1CCC2	1803143223	XEYQDJJGEFRVAY-LSBZLQRGSA-N	431.924	1.223	50	20	IDGD	
CC[C@H](C)CC(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1	1803365058	JORLCCWYWOGEAB-XPIZARPCSA-N	438.532	1.836	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1(NC(=O)OC(C)(C)C)CC1	1804592762	DNWWAYWXVHXNMM-LXTVHRRPSA-N	429.945	1.936	50	20	IDGD	
NC[C@H](C(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)c1ccccc1	1807248414	QBUZOQKQZSGPKI-MUGJNUQGSA-N	430.936	1.430	50	20	IDGD	
Cc1[nH]ccc1C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1807364032	RVEJVLZJPVWTKR-NQIIRXRSSA-N	432.289	1.031	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)c2cn[nH]c2)[C@H]1c1cccnc1	1808608533	XPUMXZKVDVYISK-PAAWNMQJSA-N	448.487	1.258	50	20	IDGD	
Cc1ccccc1C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1811775551	CZPAHTXGTUAMBA-REWPJTCUSA-N	443.312	1.703	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)c1cn2c(F)cccc2n1	1812178036	OQEUWPAGXQEPFP-QOKNQOGYSA-N	445.882	1.788	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2cnc3[nH]ncc3c2)[C@H]1c1cccnc1	1813031207	RAFWDSPNYQQYTC-JLSDUUJJSA-N	442.907	1.926	50	20	IDGD	
C[C@@H]1CC[C@H](C(=O)N2CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)O1	1813070400	IXUWBNQQRRRGBU-LNNXQNCSSA-N	431.537	1.028	50	20	IDGD	
C[C@H](C(=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@@H]1c1cccnc1)n1cnnn1	1813473678	NOVYBGWVVSBFSP-YXCITZCRSA-N	440.277	1.026	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1)[C@H]1Cc2ccccc2CN1	1818045282	VCJXRMOOJWPYLG-KZNAEPCWSA-N	431.924	1.716	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cnccc3C(=O)NN)n[nH]2)no1	1819402043	KEPZKPGZOPDKTB-INIZCTEOSA-N	438.448	1.324	50	20	IDGD	
CC[C@@H](NC(C)=O)C(=O)N[C@H]1CCc2nc(NC(=O)CO[Si](C)(C)C)sc2C1	1820158422	LOPHLJXBJBKDEA-QWHCGFSZSA-N	426.615	1.821	50	20	IDGD	
CC[C@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc3n(n2)CCNC3=O)[nH]n1	1820854266	PPTDCQPTCHFTHS-SMDDNHRTSA-N	433.900	1.673	50	20	IDGD	
Cc1ccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)cc1O	1821032710	CDFLYTZZCHPCOO-LJQANCHMSA-N	448.288	1.723	50	20	IDGD	
COc1cc(OC)cc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@H](O)CCl)CC3)c1	1822110435	IKOUJVRBRCACCA-XHDPSFHLSA-N	439.921	1.986	50	20	IDGD	
O=C(c1ccc2nc(CO)[nH]c2c1)N1CCC([C@H]2CCCCN2C(=O)[C@H](O)CCl)CC1	1824182806	LEQNICCHJGEIHR-RTBURBONSA-N	448.951	1.888	50	20	IDGD	
O=C([C@@H]1CC[C@@H]2CCC(=O)N2C1)N1CCC([C@@H]2CCCCN2C(=O)[C@H](O)CCl)CC1	1824185621	YXORMCXRTSJZKF-AKHDSKFASA-N	439.984	1.607	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCN1CCOCC1)CC2	1825640997	GHOPKHWCEWVXHL-NWDGAFQWSA-N	445.383	1.561	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCCn1ccnc1)CC2	1826008714	GCRBNELMOXQTTO-CHWSQXEVSA-N	425.942	1.986	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CN2CCOCC2)CC1	1826714279	NTDQMFUHZXLGKV-WMZOPIPTSA-N	444.414	1.969	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](N)CCC(N)=O)CC1	1826823603	XKIWNTXZUJUYLW-IRXDYDNUSA-N	426.634	1.050	50	20	IDGD	
C[C@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1)n1cccn1	1827055091	PNUVLWACUBUKFC-UTKZUKDTSA-N	438.337	1.057	50	20	IDGD	
CC(C)(C)OCC(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827056099	SEDMDIKANUJDSE-HXUWFJFHSA-N	430.354	1.415	50	20	IDGD	
CCc1nc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)co1	1827057326	CIMRLSRUMWBISD-FQEVSTJZSA-N	439.321	1.464	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc4ccccc4n3)C2)C1	1830361988	IBGCTDUASMVPTE-JOCHJYFZSA-N	446.935	1.965	50	20	IDGD	
COC[C@H](NC(C)=O)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H](C)Br)CC1	1831655344	OCZPCBXKSCARGX-JQFCIGGWSA-N	446.386	1.541	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(=O)c3cccn3C)C2)C1	1831657914	CEOOLMUXVSAQRY-QRWLVFNGSA-N	425.913	1.072	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)Cn2cc([N+](=O)[O-])cn2)CC1	1831829013	XBDSUKBFVCPASO-SJORKVTESA-N	441.916	1.665	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCc2nc(N)n[nH]2)CC1	1831830977	KYFCLSDJDFNHNK-HUUCEWRRSA-N	426.949	1.193	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)Cc2cncnc2)CC1	1831871919	IBAUCFUUYMITLE-LJQANCHMSA-N	430.553	1.012	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)C[C@@H]1CCCCO1)CCO2	1832345478	YUNSOWMAXLWJDK-FXAWDEMLSA-N	428.602	1.254	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)c3cnc[nH]3)CC2)CC1	1834167731	USMXCKJXIFULDC-ZDUSSCGKSA-N	426.359	1.626	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)CCC3CCCC3)CC2)CC1	1834369143	NCPPIGCLOSKKFO-UHFFFAOYSA-N	449.640	1.901	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)Cn3ccnn3)CC2)CC1	1834898080	GGPWNUSFCBFOKI-MRXNPFEDSA-N	441.374	1.023	50	20	IDGD	
Cc1nccc(C(=O)NC2CCN(C3CCN(C(=O)CO[Si](C)(C)C)CC3)CC2)n1	1835219286	DVRQXFPPVYRBEF-UHFFFAOYSA-N	433.629	1.822	50	20	IDGD	
C[C@H](C(=O)N1CCC(N2CCC(NC(=O)CO[Si](C)(C)C)CC2)CC1)n1ccnn1	1835837346	HTKJSSMSEVZYIU-MRXNPFEDSA-N	436.633	1.262	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CSc3ncccn3)CCO2)C1	1836115609	ZKXUWNPJYVHRHP-RDTXWAMCSA-N	428.942	1.043	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)COC(=O)C(F)(F)F)CC2)CC1	1836396605	DIRKIPHAYMISAQ-CQSZACIVSA-N	441.878	1.681	50	20	IDGD	
COC(=O)[C@@H]1CC[C@H](C(=O)N2CCC(OC3CCN(C(=O)[C@H](O)CCl)CC3)CC2)C1	1836711545	RZFZWLUVZRRVJY-HDMKZQKVSA-N	444.956	1.174	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc4ncsc4[nH]3)CCO2)C1	1837747291	URAZWABLHRBXFN-IBGZPJMESA-N	440.953	1.959	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3csc(N)n3)CC2)CC1	1837893210	CYDNVVSRGVMQFB-CQSZACIVSA-N	430.958	1.591	50	20	IDGD	
Cc1nc(C)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)o1	1838006054	IFRMAPHMKAMFJW-ROUUACIJSA-N	434.320	1.598	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ncn(-c4ccccc4)n3)C2)C1	1839144635	HBNPUCZKJWLNBS-UWJYYQICSA-N	447.923	1.355	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(C)nn3C(F)F)C2)C1	1839146063	JIDPSWWHHWFYHZ-FZKQIMNGSA-N	434.871	1.674	50	20	IDGD	
CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](Br)Cc1ccccc1)CCO2	1839801793	CYGTUPFFYSNVGC-IEBWSBKVSA-N	425.323	1.469	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(C)c3F)C2)C1	1840149770	ZPIHIEFYNHTOMT-UZLBHIALSA-N	428.888	1.458	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3cnccc3C)C2)C1	1840150901	SJTUGYFYDDAXLQ-WIYYLYMNSA-N	439.940	1.033	50	20	IDGD	
Cc1nnc(CCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)s1	1840186500	NNXBPVOJGIERLK-MRXNPFEDSA-N	437.349	1.039	50	20	IDGD	
O=C(c1cnc2ccoc2c1)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840187660	PFTKGKCKLYPJBH-SFHVURJKSA-N	428.272	1.702	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)C3CCN(CC)CC3)CCO2)C1	1840927044	GALXCAAGYKYFLH-RXVVDRJESA-N	429.989	1.582	50	20	IDGD	
O=C(c1cc(-c2cc[nH]n2)n2ccccc12)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1	1841351194	IVMDJPJEOQZWQJ-GOSISDBHSA-N	427.892	1.746	50	20	IDGD	
Cn1ccc(C(=O)N2CC3(CCCN3C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)n1	1841924153	BRPUECBYPQAIJU-AWEZNQCLSA-N	425.917	1.369	50	20	IDGD	
O=C(CCBr)N1CC2(CCCN2C(=O)CCS(=O)(=O)c2ccccc2)C1	1842743767	NXSPIZWIIIXDHT-UHFFFAOYSA-N	443.363	1.839	50	20	IDGD	
C=CC(=O)N[C@@H](C)C(=O)N1CCCC12CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2	1844371004	CLZUJGOSDDIZIU-ZDUSSCGKSA-N	444.444	1.028	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc(-c2ccccc2)on1	1847199828	ZWEYNRYPUDGOSW-PMACEKPBSA-N	431.257	1.151	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CN1CCCC1	1847296943	FBWOXBRLCFALJY-JYJNAYRXSA-N	428.961	1.416	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cn(C)nc1C	1847913288	PFAGGOXATYLIRU-ROUUACIJSA-N	441.444	1.691	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1	15888958	MVBWJSQUZCDDTR-UHFFFAOYSA-N	428.470	1.183	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)CCn2c(=O)[nH]c(=O)c3ccccc32)c(C)n1-c1ccccc1	17443368	HXYWZCPABPFFKM-UHFFFAOYSA-N	445.479	1.949	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN1C(=O)c1ccc2c(c1)OCO2)c1cc(-c2ccccc2)n[nH]1	116447909	IBZWBDKMNYLFRJ-GOSISDBHSA-N	447.451	1.871	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)[C@H]1CCCN(C(=O)N2CCCC2)C1	726862782	AOOZFBNVNLYNJF-HNNXBMFYSA-N	435.550	1.498	50	20	IDGD	
CC[C@H](OC(=O)/C(C#N)=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(N)=O	726988332	OQDNNBIODSCCIL-OVHOFWQVSA-N	429.864	1.793	50	20	IDGD	
CC(C)NC(=O)C(=O)NNC(=O)c1cc(Cl)ccc1NS(=O)(=O)c1ccccc1	727367606	VUWOKQVISKNGSA-UHFFFAOYSA-N	438.893	1.426	50	20	IDGD	
CCN(C)[C@@H](C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)c1ccccc1	727765775	RIXRHYHWSORSQZ-HXUWFJFHSA-N	444.557	1.925	50	20	IDGD	
N#Cc1ccc(N2CCC[C@@H]2C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1	728170840	SEOBJOKJSUJCNP-MRXNPFEDSA-N	447.904	1.289	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)c1csc(-c2cnccn2)n1	728232423	ULNNCUDRQRSEQR-UHFFFAOYSA-N	437.529	1.573	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)[C@@H]2CC(=O)N(Cc3ccccn3)C2)c1	728528035	ZBFJODJJNTUGNW-GFCCVEGCSA-N	447.289	1.662	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)c2cccc(S(=O)(=O)NCC3CC3)c2)cn1	729692345	RENTZDRTCGGILH-UHFFFAOYSA-N	435.531	1.410	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)c3snnc3C)c2)cc1	731450046	WVYWFCQTKMJEJW-UHFFFAOYSA-N	447.498	1.731	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@@H]2Cc3ccccc3CN2Cc2ccccc2)ccc1=O	732064976	LWSHVYUXTOCFJK-NRFANRHFSA-N	431.496	1.651	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)CCNS(=O)(=O)c1ccc(OC)c(OC)c1)c1ccccc1	732132966	MCHPJCFJYDRSHA-KRWDZBQOSA-N	449.529	1.713	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN1S(=O)(=O)c1cccc([N+](=O)[O-])c1)c1ccccc1F	732931744	FNFJKRAXMVDLTH-MRXNPFEDSA-N	436.421	1.348	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)N[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)nc2ccccc21	734218423	JNNRODQPVURHEJ-CQSZACIVSA-N	430.509	1.846	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NN=C(C)c1cnccn1)N(S(C)(=O)=O)CC2	734744545	AECAPHBYFMBGGS-KRWDZBQOSA-N	447.517	1.283	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)nc3)CC2)cc1OC	734836496	KLBFGSPVXXVLPT-UHFFFAOYSA-N	447.923	1.331	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	735117514	VIFZMOWMSVYWPY-CQSZACIVSA-N	437.497	1.067	50	20	IDGD	
C[C@@H](CNC(=O)CCC(=O)C(C#N)=C1N(C)c2ccccc2N1C)CN1CCOCC1	737985878	WRGPAIYSAXXLGD-KRWDZBQOSA-N	425.533	1.742	50	20	IDGD	
CCOc1ccc(/C=C(\C#N)C(=O)NC2CCN(S(=O)(=O)c3cnn(C)c3)CC2)cc1	741231269	BHOLFLRGVDINDN-SFQUDFHCSA-N	443.529	1.695	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNS(=O)(=O)c2ccc3ncccc3c2)ccc1Cl	741646639	KELVFGPVRZIXFD-UHFFFAOYSA-N	440.890	1.159	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C[C@H](C)/N=C1/NS(=O)(=O)c2ccccc21	743283465	AYJPUEAHPJRVDI-AWEZNQCLSA-N	444.513	1.293	50	20	IDGD	
O=C(NNC(=O)c1cccc2ncccc12)N[C@H]1CC(=O)N(CCOc2ccccc2)C1	743638668	SXQROAPWXGGDEQ-INIZCTEOSA-N	433.468	1.859	50	20	IDGD	
COc1ccc(F)cc1CN1CCN(CC(=O)NNC(=O)c2cccc(C#N)c2)CC1	744385048	JUIIMBPZTVLQCL-UHFFFAOYSA-N	425.464	1.285	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCCN2c3ccccc3C[C@@H]2C)c2ccccc2c1=O	744886206	VXVCTOPSGWJEAC-HNNXBMFYSA-N	434.500	1.812	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)N[C@@H]1CCCN(c2ccccc2Cl)C1=O	745848637	UXGOOZSVZLMRSP-CQSZACIVSA-N	432.864	1.950	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(CCC(=O)NNC(=O)N2CCOCC2)c2ccccc2)cc1	745993086	WVTFDXOBUMBYAC-UHFFFAOYSA-N	446.529	1.653	50	20	IDGD	
Cc1cccc(-n2c(NNC(=O)c3nc(O)nc(O)c3N)nc3ccccc3c2=O)c1C	746257556	ASMABDOQYZZJFE-UHFFFAOYSA-N	433.428	1.543	50	20	IDGD	
Cn1nc(C(=O)NN=Cc2cnc3cnc(Br)cn23)c2ccccc2c1=O	746370172	HEYLPZUAYDVGFG-UHFFFAOYSA-N	426.234	1.503	50	20	IDGD	
CC(C)NS(=O)(=O)CCNC(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccccc1	746527018	SXDIGCPLKNIQAC-AQTBWJFISA-N	440.529	1.815	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)[C@H]1CC(=O)N(Cc2ccccc2Cl)C1	746549706	VBSRGMTUNNAGIH-HNNXBMFYSA-N	425.876	1.726	50	20	IDGD	
CC(=O)N1CC[C@](C)(C(=O)NNc2nc3ccccc3c(=O)n2CCCOC(C)C)C1	746853238	SKULJBYNVJNSPG-QFIPXVFZSA-N	429.521	1.913	50	20	IDGD	
O=C(NCc1ccc(Br)c(F)c1)NNC(=O)c1ccc(-n2cnnn2)cc1	746978390	IFIMXUREINEYEC-UHFFFAOYSA-N	434.229	1.708	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)N[C@H]1CCN(CCCc2ccccc2)C1=O	750662555	XCXWUHAPKPFEBX-IBGZPJMESA-N	435.484	1.501	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)c1ccc(N2CCCS2(=O)=O)cc1	751297481	KCGWLPSHKWVGAI-UHFFFAOYSA-N	441.513	1.600	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)CCOC2CCOCC2)c1	753273402	LGUAEXPSPVEROF-UHFFFAOYSA-N	427.523	1.064	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cc(S(N)(=O)=O)oc2C)ccc1OCCC(C)C	754181729	KMNNRMUMSRBMPD-UHFFFAOYSA-N	439.490	1.744	50	20	IDGD	
CN1CCC/C1=N\S(=O)(=O)c1ccc(NC(=O)NNC(=O)Cc2ccncc2)cc1	756074336	XWZFATMITQHPGL-JJIBRWJFSA-N	430.490	1.290	50	20	IDGD	
Cc1cccc(COc2ccc(NC(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)c(C)c2)c1	756447620	XBWCTDAAYYDYRH-OAHLLOKOSA-N	434.518	1.973	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)Nc1ccccc1CS(=O)(=O)c1ccccc1	756483727	WPESPHKHJRLATF-OAHLLOKOSA-N	435.502	1.865	50	20	IDGD	
Cc1cc(S(N)(=O)=O)cc(NC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)c1C	756635338	QSQVEUURHIDQQR-UHFFFAOYSA-N	444.473	1.309	50	20	IDGD	
CCOC(=O)[C@@H](C)NC(=O)c1ccc(NC(=O)NNC(=O)COc2ccc(C)cc2)cc1	756790647	QIPXGWCFIHDYHW-OAHLLOKOSA-N	442.472	1.908	50	20	IDGD	
CCOc1ccc(C(=O)N2CCCCC2)cc1NC(=O)NNC(=O)[C@@H](C)OCCOC	756885972	QKEXUAWKHSSPAN-OAHLLOKOSA-N	436.509	1.916	50	20	IDGD	
NC(=O)c1ccc(NNC(=O)c2ccc(Cl)c(S(=O)(=O)N3CCCCC3)c2)nn1	757404478	QDBKUHQGKYCPFX-UHFFFAOYSA-N	438.897	1.160	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCc2ccc3c(c2)CCS3(=O)=O)ccc1OC(C)C	757750148	FWNJIQOQAJQTLH-UHFFFAOYSA-N	447.513	1.956	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)Nc1ccc(F)c(S(=O)(=O)NC2CC2)c1	757872566	AHCGYZKWFUZPHF-UHFFFAOYSA-N	436.465	1.636	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)c2cn(C)cn2)c1	758042653	ASYWEYOIGBYRAX-UHFFFAOYSA-N	429.458	1.304	50	20	IDGD	
CN(NC(=O)CNC(=O)CCC1CCCC1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758786000	IGNXRNHJRGFIGH-UHFFFAOYSA-N	439.557	1.709	50	20	IDGD	
CC(C)(c1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)cc1)C(F)(F)F	760278581	ZRKGKBYQTOVKKX-SNVBAGLBSA-N	435.424	1.047	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)CSc2ncnc3sccc23)n1	760730536	PUAPMRMVFOUNQZ-UHFFFAOYSA-N	437.528	1.482	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NN=C2C(=O)N(C)c3cc(N(C)C)ccc32)cc1	761748133	AVEPTYIIENYFEK-UHFFFAOYSA-N	443.529	1.178	50	20	IDGD	
CCOc1ccc(N2C[C@H](C(=O)NNc3nccc(N4CCOCC4)n3)CC2=O)cc1	762869360	XGCKLCIAUQBBDC-OAHLLOKOSA-N	426.477	1.208	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3n2)ccc1N1CCOCC1	763465805	BNKCELIBMUCDGE-UHFFFAOYSA-N	433.468	1.780	50	20	IDGD	
CN(c1ccccc1NC(=O)C(=O)NNC(=O)[C@H]1COc2ccccc2O1)C1CCCC1	763572280	QHGMDZPEPNMQDT-HXUWFJFHSA-N	438.484	1.991	50	20	IDGD	
COc1cc(Br)cc(NC(=O)C(=O)NNC(=O)COc2cccc(C)c2)c1	763623836	OGZYCLGTTCMQBO-UHFFFAOYSA-N	436.262	1.931	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2cc3c(cc2Cl)OCCO3)c1	763644870	ODCFHUZPJSWRQU-UHFFFAOYSA-N	433.848	1.893	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(-c3ccnc(C)n3)c2)cc1	763660777	GQIXWOOAFHYNCQ-UHFFFAOYSA-N	435.440	1.626	50	20	IDGD	
Cc1cccc(Cn2nccc2NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)c1	763732155	ALECXMNVHSFXBC-UHFFFAOYSA-N	446.511	1.779	50	20	IDGD	
Cn1cc(NC(=O)C(=O)NNC(=O)c2cccc(Cl)c2)cc(Br)c1=O	763747963	KKWCZFKUBONTJU-UHFFFAOYSA-N	427.642	1.201	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2cc(C)nn2[C@H]2C[C@H]3CC[C@H]2C3)c1	763771721	FLKFJNOHQRRKIN-DEYYWGMASA-N	441.488	1.970	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])n(-c2ccccc2)n1	763807372	AXORSKVVURNFHJ-UHFFFAOYSA-N	438.400	1.254	50	20	IDGD	
CC(C)CNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)cc1	763865913	SQLBDDANUADCKN-CQSZACIVSA-N	444.463	1.765	50	20	IDGD	
COC(=O)COc1cccc(NC(=O)C(=O)NNC(=O)CSc2ccc(C)cc2)c1	763898476	WDIQARVKVHXNBO-UHFFFAOYSA-N	431.470	1.425	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)C(=O)Nc1ccc2c3c(cccc13)CC2	763921861	PXRDOIGTSXECIM-UHFFFAOYSA-N	427.424	1.314	50	20	IDGD	
CCn1c2ccccc2c2cc(NC(=O)C(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)ccc21	764001755	FBCANUFROWRTCW-ZDUSSCGKSA-N	442.497	1.335	50	20	IDGD	
O=C(NNC(=O)c1cnccn1)C(=O)Nc1cc(Br)ccc1N1CCCC1	764031204	ILNHPOXEPKMTRL-UHFFFAOYSA-N	433.266	1.239	50	20	IDGD	
CCS(=O)(=O)c1cc(F)ccc1NC(=O)C(=O)NNC(=O)c1ccc(Cl)cc1O	764117714	PUMUBGPYMGEVOB-UHFFFAOYSA-N	443.840	1.378	50	20	IDGD	
CC(C)(C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)cc1	764126425	KNGOTENYTFVAEW-UHFFFAOYSA-N	432.864	1.974	50	20	IDGD	
CCOC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)cc1	764127684	YEEINCXQLHKEAD-UHFFFAOYSA-N	435.820	1.387	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccc(N2C[C@H](C)O[C@H](C)C2)cc1	764131638	JTJSZUNOWNRSBN-IYBDPMFKSA-N	440.500	1.637	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1cc(C)nn1[C@@H]1C[C@H]2CC[C@H]1C2	764135603	JKRFPRWZIQTERL-YQQAZPJKSA-N	425.489	1.890	50	20	IDGD	
CCc1cc(O)nc(-c2cccc(NC(=O)C(=O)NNC(=O)Cc3ccccc3OC)c2)n1	764136928	WKXIKWMYKXONBV-UHFFFAOYSA-N	449.467	1.749	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)NC(=O)[C@@H](C)O3)o1	764139400	SPCDRGPCJCHHRS-GFCCVEGCSA-N	443.460	1.241	50	20	IDGD	
C[C@@H]1CN(c2ccccc2NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)C[C@@H](C)O1	764152311	CZABNOSTWZKJHZ-STXHMFSFSA-N	438.484	1.390	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)n(-c2ccc(Cl)cc2)n1	764169048	SLRJODJYVBNMBE-KRWDZBQOSA-N	439.859	1.924	50	20	IDGD	
CS(=O)(=O)c1c(Cl)cccc1NC(=O)C(=O)NNC(=O)c1cccc2ncccc12	764258896	CRCFZWPYNNQAHD-UHFFFAOYSA-N	446.872	1.691	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1ccc(-c2noc(C(F)F)n2)cc1	764274836	DSOOCMAPJCFFAM-UHFFFAOYSA-N	447.354	1.545	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2ccc(N3CCCC3)nc2)n[nH]1	764377345	NRDYCMAZQFOYHE-UHFFFAOYSA-N	449.471	1.480	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)c(C)c1	764382410	JPKSVZLVPMHGAE-UHFFFAOYSA-N	443.485	1.872	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cccc4c3oc(=O)n4C)n[nH]2)cc1C	764388114	QAPWNWABFRVFCJ-UHFFFAOYSA-N	448.439	1.538	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1)C(=O)Nc1ccnn1-c1ccccc1	764389099	YLSAOKNCHGULLS-UHFFFAOYSA-N	433.403	1.801	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)C(=O)Nc1ccc(OCC(F)F)cc1	764400851	JHLDGIIETXFDFR-UHFFFAOYSA-N	425.413	1.914	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc2nc(O)cc(C(=O)NNc3nccnc3OC)c2c1	764461313	YSANMIAUFWFZRO-UHFFFAOYSA-N	446.489	1.526	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)NC[C@H](NC(=O)OC(C)(C)C)C2CC2)cc1C	764556696	GCSPYSGONGYNIH-INIZCTEOSA-N	433.509	1.876	50	20	IDGD	
CC(Cc1ccc(-c2ccccc2)cc1)=NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C	764812434	KWHCYHBFROYLDZ-UHFFFAOYSA-N	444.495	1.836	50	20	IDGD	
CC(=NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C)c1cc2cc(Cl)ccc2o1	764817169	NYHILFZBDCHLRQ-UHFFFAOYSA-N	428.836	1.374	50	20	IDGD	
Cc1ccccc1S(=O)(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	765119454	RFLQDKCGBCWBCN-UHFFFAOYSA-N	436.965	1.776	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)CCn3c(C)c(C)sc3=O)n[nH]2)cc1OC	765596137	GHVIGTXMIWVRMO-UHFFFAOYSA-N	445.501	1.785	50	20	IDGD	
CCN(CC(=O)NNC(=O)CN1CCN(Cc2ccc(C)cc2)CC1)C(=O)OC(C)(C)C	766639491	AQCBJLCYMKGZFC-UHFFFAOYSA-N	447.580	1.517	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)nnn1Cc1ccc(F)cc1	767441771	ORVJNIXBRUPDSI-UHFFFAOYSA-N	445.480	1.142	50	20	IDGD	
CC/C=C(\C)C(=O)N1CSC[C@@H]1C(=O)NNc1c(OC)cccc1S(C)(=O)=O	768630516	SYYNEKVTHTXRJK-BWODNOAJSA-N	427.548	1.800	50	20	IDGD	
CN(CCN(C)C(=O)OC(C)(C)C)C(=O)NNC(=O)c1csc(N2CCOCC2)n1	768676837	HUYIKELCNSEXNA-UHFFFAOYSA-N	442.542	1.133	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)N[C@H](C)CNC(=O)OC(C)(C)C	768921844	BLEHGOXYGUGCLX-LLVKDONJSA-N	442.542	1.145	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)NCc1cccc(S(N)(=O)=O)c1	770245879	OKHWDSJRUVMJQQ-LLVKDONJSA-N	426.882	1.285	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)[C@@H]2CC(=O)N(c3c(F)cccc3F)C2)c2ccccc2c1=O	770577866	HPVGZVVYHDWYJO-LLVKDONJSA-N	441.394	1.026	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)N[C@@H]2CC(=O)N(c3c(F)cccc3F)C2)c1	770843582	YIGZNOGNMBXLGG-GFCCVEGCSA-N	434.399	1.732	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)CCc3ccc(S(N)(=O)=O)cc3)nc21	770956595	VDZMSEZCKNYOSE-UHFFFAOYSA-N	433.494	1.010	50	20	IDGD	
O=C(NNc1ccc(Br)c(F)c1)N[C@H]1CCN(CCN2CCOCC2)C1	771322438	CXIYYTQUEZHRTF-AWEZNQCLSA-N	430.322	1.621	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)c(OC)c1OC	772181754	BZWYBAPOORLSPQ-UHFFFAOYSA-N	449.891	1.762	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)[C@H]1CC(=O)N(c2ccc(Cl)cc2)C1	772193316	UQPGYTWQBOZMMC-ZDUSSCGKSA-N	449.294	1.810	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772196713	OWMNXVWWYFKCRN-UHFFFAOYSA-N	440.681	1.945	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)[C@@H]1CCCN(C(=O)NC2CCCC2)C1	772889540	QOLYLRORGSBXLR-OAHLLOKOSA-N	449.939	1.468	50	20	IDGD	
CCc1ccc(NC(=O)C(=O)NNc2ccc(C(F)(F)F)cn2)cc1S(N)(=O)=O	773670316	ZDCDMCQDTAZVQY-UHFFFAOYSA-N	431.396	1.392	50	20	IDGD	
COC(=O)c1csc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)c1	774009565	REPUOXKGUNULOJ-SECBINFHSA-N	425.850	1.742	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H]2CCN(c3ccc(Cl)cc3)C2)c1	776333330	SZLWULNCLAPMMH-OAHLLOKOSA-N	436.921	1.966	50	20	IDGD	
Cc1csc2ncc(C(=O)NNC(=O)c3nn(C(C)C)c(=O)c4ccccc34)c(=O)n12	776444411	NHQAFPQTYILVOC-UHFFFAOYSA-N	438.469	1.430	50	20	IDGD	
N#C/C(=C\c1ccc(O)cc1)C(=O)N1CCN(S(=O)(=O)c2ccccc2[N+](=O)[O-])CC1	776598544	SBOSCNVTGIPWQY-DTQAZKPQSA-N	442.453	1.740	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)[C@H]1CC(=O)N(C2CC2)[C@@H]1c1cccc(OC)c1	776707758	UNDIFDCSUIBNMZ-PKOBYXMFSA-N	430.505	1.199	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)[C@H](Cc2cccc(OC)c2)n2nnnc2C)nc1C	778422179	LMFQLCAKIGCKNM-KRWDZBQOSA-N	440.464	1.192	50	20	IDGD	
CCC(CC)[C@H]1C[C@@H](NC(=O)NNC(=O)c2csc(N3CCOCC3)n2)CCO1	778587666	BDGPDBJJVZTLRD-GOEBONIOSA-N	425.555	1.908	50	20	IDGD	
CN(C)[C@H](C(=O)OCC(=O)NNC(=O)c1cccc(C#N)c1)c1c(F)cccc1Cl	780114534	HIYPHHKFXBRBCA-SFHVURJKSA-N	432.839	1.958	50	20	IDGD	
COc1cccc(NNC(=O)[C@@H]2CCCN(S(=O)(=O)c3ccc([N+](=O)[O-])cc3)C2)n1	780770555	KKRMOSIQXGITBD-CYBMUJFWSA-N	435.462	1.542	50	20	IDGD	
COc1ccc(C(=O)c2ccccc2C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)cc1	781306241	QOOHOCDCFHMVJQ-AWEZNQCLSA-N	431.470	1.057	50	20	IDGD	
COc1ccc(NNC(=O)c2cc(I)ccc2-n2cnnn2)nc1	781515857	IHHHIYWNHFVNJM-UHFFFAOYSA-N	437.201	1.427	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)NCc1ccccc1CN1CC[C@H](O)C1	781950824	FDUYRZACVJIDHY-KRWDZBQOSA-N	443.460	1.071	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)cnn1-c1ccccc1F	782894151	NEZQOIBVYGJIGU-UHFFFAOYSA-N	449.446	1.535	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)C(=O)Nc1ccc2ncsc2c1	782897979	UFTXJXXMDWQGLU-UHFFFAOYSA-N	446.514	1.298	50	20	IDGD	
O=C(NNC(=O)C(=O)NC1CC1)C(=O)Nc1cccc(CSCc2ccccc2)c1	782967145	RQMANGQCVKKBPW-UHFFFAOYSA-N	426.498	1.485	50	20	IDGD	
O=C(NNc1ccccc1Br)C(=O)Nc1ccn(CCN2CCOCC2)n1	782982877	OXJGTMXHCPIVCI-UHFFFAOYSA-N	437.298	1.060	50	20	IDGD	
O=C(NNc1ccc(F)cc1F)C(=O)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1	783346921	BITQQSBIMZXFHT-UHFFFAOYSA-N	440.428	1.068	50	20	IDGD	
CCCCn1ccnc1-c1cccc(NC(=O)C(=O)NN[C@]2(C)CCS(=O)(=O)C2)c1	783424415	DNAAKJVUQCNNKB-HXUWFJFHSA-N	433.534	1.487	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2ccn(CCS(C)(=O)=O)n2)ccc1Br	783921239	ORMLMKFFZYTKGB-UHFFFAOYSA-N	444.311	1.080	50	20	IDGD	
N#C[C@H](c1ccccc1)c1ccc(NC(=O)C(=O)NNC(=O)CNC(=O)c2ccco2)cc1	784001934	GIWXVLZMKRNDSF-GOSISDBHSA-N	445.435	1.451	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1cccc(OC(F)(F)F)c1	784005125	PUVHFWGIHMCHJK-UHFFFAOYSA-N	430.364	1.163	50	20	IDGD	
O=C1CN(c2ccc(NC(=O)C(=O)NNc3ccc(OC(F)(F)F)cc3)cc2)CCN1	784801968	MBYQRVLBZBILGN-UHFFFAOYSA-N	437.378	1.603	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2nc(C(F)(F)F)cs2)cc1-n1cnnn1	785146522	WCNZCKBQIXDRLT-UHFFFAOYSA-N	428.356	1.228	50	20	IDGD	
CCN1CCN(C(=O)c2ccc(NC(=O)C(=O)NNc3cc(F)cc(OC)c3)cc2)CC1	785235250	RCMQKIWXAXFKAN-UHFFFAOYSA-N	443.479	1.694	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1cc(C#N)ccc1OC(C)C	785336820	BPCHJSUADSVMAN-UHFFFAOYSA-N	446.485	1.839	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)C(F)(F)C2(O)CCCC2)c1	785669868	KFGYSNIKLAODLZ-UHFFFAOYSA-N	433.477	1.419	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc(CN(C)C)c(Br)c1	786416155	DFOGQZULPIKAOY-UHFFFAOYSA-N	449.305	1.919	50	20	IDGD	
Cc1c(C(=O)NNc2nc(O)c3cnn(C)c3n2)nnn1Cc1ccc(C(F)(F)F)cc1	787358900	PZUKVCOPIJJZQD-UHFFFAOYSA-N	447.381	1.793	50	20	IDGD	
CCNC(=O)Nc1ccc(C)c(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)c1	787541847	XHPWEZUSOGREPU-UHFFFAOYSA-N	427.417	1.265	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)C(=O)Nc1nc2c(s1)CCCCCC2	789731764	HEWHDSBUYKUJNF-UHFFFAOYSA-N	440.485	1.851	50	20	IDGD	
Cc1ccc(CN2CC[C@H](NC(=O)NNC(=O)Cc3nc4ccccc4n3C)C2=O)cc1	790696247	MUKDECBSWMMCLU-SFHVURJKSA-N	434.500	1.556	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)Cc2c[nH]c3ccccc23)cc(-n2cccn2)c1	792355600	UUOQOLPNOUMSQZ-UHFFFAOYSA-N	432.440	1.691	50	20	IDGD	
Cn1c(=O)c2cc(NC(=O)C(=O)NNc3cc(Cl)cc(Cl)c3)cnc2n(C)c1=O	792438664	WWJAVMRUQDEWOF-UHFFFAOYSA-N	437.243	1.021	50	20	IDGD	
Cc1cccc(C(=O)NNS(=O)(=O)c2cc([N+](=O)[O-])c(Br)cc2C)n1	794599505	HKCNXWSKTAJJMB-UHFFFAOYSA-N	429.252	1.992	50	20	IDGD	
Cc1c(C(=O)NNC(=O)Cc2cn3ccccc3n2)nnn1CCOc1ccc(F)cc1	799959617	QMMWJKKKZKLKSS-UHFFFAOYSA-N	437.435	1.456	50	20	IDGD	
CCOC(=O)COc1ccc(NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1	800561146	SZSYZMGNVMTNPO-UHFFFAOYSA-N	435.458	1.499	50	20	IDGD	
Cc1nnnn1[C@@H](Cc1ccccc1)C(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	802067247	AGKXACQEVDAILA-KRWDZBQOSA-N	443.489	1.022	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)c2cc(C)ccc2S(N)(=O)=O)c(OC)cc1Cl	802083798	QULHWTFKDYYTBN-UHFFFAOYSA-N	442.881	1.780	50	20	IDGD	
C#Cc1cc(F)c(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(C(C)=O)cc2)c(F)c1	802566650	ZJVVDHGNYXCYEW-LBPRGKRZSA-N	429.379	1.702	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)Nc2ccc(F)c(N3C(=O)CCC3=O)c2)cc1	806747025	OGVNXQNQYISCHT-UHFFFAOYSA-N	430.392	1.719	50	20	IDGD	
O=C1COC[C@@H](C[C@@H]2CN(C(=O)C(=O)NNc3ccc(F)c(F)c3F)c3ccccc32)N1	806968044	VDHLHWOJACPDKY-VXGBXAGGSA-N	448.401	1.583	50	20	IDGD	
CCOC(=O)c1cc(CC)sc1NC(=O)C(=O)NNc1ccc(-n2ccnc2)nn1	807429182	NRRRQNDKLVAXPJ-UHFFFAOYSA-N	429.462	1.545	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)C(=O)Nc1ccc(C(=O)NC2CCCCC2)cc1	807429193	OIXXHNKSDHTVSA-UHFFFAOYSA-N	448.487	1.807	50	20	IDGD	
COC(=O)c1ccccc1NNC(=O)CNS(=O)(=O)c1ccc(Br)s1	810891685	UXAJFIAQTIBGCF-UHFFFAOYSA-N	448.320	1.719	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)CCOCC(F)(F)F)cc1Br	811684765	UPISADPPIPSWQM-UHFFFAOYSA-N	435.218	1.601	50	20	IDGD	
COC[C@]1(CNC(=O)NNC(=O)c2ccc3c(c2)OCCO3)OCCc2ccccc21	811922832	QUPLOYYUEMVHJY-QFIPXVFZSA-N	427.457	1.516	50	20	IDGD	
Cc1nn(C)c2[nH]c(=O)c(CCC(=O)NNc3ccc(S(=O)(=O)N(C)C)cc3)c(C)c12	812728634	TVMOUHHRCXBIDD-UHFFFAOYSA-N	446.533	1.205	50	20	IDGD	
O=C(COC(=O)c1ccccc1NC(=O)C1CC1)NNC(=O)[C@@H]1COc2ccccc2O1	815516535	SNAQACIJIWPWGR-SFHVURJKSA-N	439.424	1.179	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCc2nncn2C1)C(=O)Nc1cc(F)ccc1Oc1ccccc1	815691104	FISQKXPSIPYANW-ZDUSSCGKSA-N	438.419	1.558	50	20	IDGD	
CN1CCN(Cc2ccc(C(=O)NNc3ccccc3S(=O)(=O)N(C)C)cc2)CC1	817054024	QKYGYRWWWGOLFT-UHFFFAOYSA-N	431.562	1.441	50	20	IDGD	
O=C(NNC(=S)NCCc1cccs1)[C@@H]1CCCN1C(=O)c1ccc2c(c1)OCO2	819432160	NPLABWAUTURQKX-HNNXBMFYSA-N	446.554	1.819	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)CNS(=O)(=O)c2ccc(C)c(C)c2)cc1OC	913067874	FOWVLHCQBNHAPC-UHFFFAOYSA-N	435.502	1.450	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)NCCC(=O)NNC(=S)Nc2cccc(C)c2)cc1	913454525	IIZJIPPPFHPWFY-UHFFFAOYSA-N	434.543	1.884	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCC(C)(C)N1CCOCC1	913623769	AESLCICVLDHZTR-ZDUSSCGKSA-N	443.342	1.658	50	20	IDGD	
Cc1ccccc1-n1ncc(C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)c1C(F)(F)F	914718735	ACRKEXUKSYOTNG-LLVKDONJSA-N	430.408	1.395	50	20	IDGD	
CCNC(=O)COc1ccc(C=NNC(=O)CSc2nc(C)cc(C)n2)cc1OC	915915139	PUJRJUNCASIUTK-UHFFFAOYSA-N	431.518	1.859	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)NC[C@@H]1COc2ccccc2C1	916198623	AJXYCYMGRAKZAY-LJQANCHMSA-N	437.544	1.780	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)COc1ccc(F)cc1)c1ccc(OCC(=O)NC2CC2)cc1	916488326	BKBWTJORLOSMHG-AWEZNQCLSA-N	444.463	1.954	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)NNC(=O)NCCS(=O)(=O)NCc1ccccc1	916645459	XAODPIWMVUUMLT-UHFFFAOYSA-N	429.502	1.160	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NCc2ccc(S(=O)(=O)N3CCCC3)cc2)cc1	916647862	OTVSYXBRVYPPBW-UHFFFAOYSA-N	446.529	1.689	50	20	IDGD	
O=C(CNC(=O)c1ccc(Br)s1)NNC(=O)COc1ccccc1F	916720018	LVOMXQABZCAGGI-UHFFFAOYSA-N	430.255	1.606	50	20	IDGD	
O=C(NNC(=O)c1[nH]c2ccccc2c1Br)c1ccc(-n2cnnn2)cc1	917925292	IGZXHJUUCXKISR-UHFFFAOYSA-N	426.234	1.981	50	20	IDGD	
C[C@@]1(NNC(=O)NCCC(=O)Nc2ccc(Br)cc2)CCS(=O)(=O)C1	918127581	NXILAAGWVDREHE-OAHLLOKOSA-N	433.328	1.159	50	20	IDGD	
O=C(Cc1ccc(NC(=O)c2cc3ccccc3o2)cc1)NNC(=O)CN1CCCC1=O	919809440	ULJWXQSNQIZFAP-UHFFFAOYSA-N	434.452	1.997	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)N[C@@H](C)c1ccc(S(=O)(=O)N(C)C)cc1	919908711	JNBYZIRZBIRYBU-AWEZNQCLSA-N	434.518	1.580	50	20	IDGD	
O=C(NCc1ccccc1-c1ccc(Cn2cncn2)cc1)NNC(=O)C(=O)NC1CC1	919914209	KOIQUFBNQYSUBK-UHFFFAOYSA-N	433.472	1.102	50	20	IDGD	
O=C1CCc2cc(S(=O)(=O)NNC(=O)c3nnc(-c4ccccc4)o3)c(F)cc2N1	919961942	PZMXDWXCIXOAHU-UHFFFAOYSA-N	431.405	1.384	50	20	IDGD	
CC(=NNC(=O)Cc1csc(N2CCOCC2)n1)c1cccc(OCC(=O)N(C)C)c1	920482628	OFBICPSKCFEBGS-UHFFFAOYSA-N	445.545	1.530	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)cc2F)C[C@@H](C)O1	920933178	RMMRPWFEHCXDGS-FRRDWIJNSA-N	428.486	1.027	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NN=Cc2ccc(F)c(S(N)(=O)=O)c2)CC1	1117482936	HFSIJBPJLFZWFL-UHFFFAOYSA-N	428.486	1.570	50	20	IDGD	
N#Cc1ccc(CS(=O)(=O)CC(=O)NNC(=O)c2ccc(Br)cc2)cc1	1317904758	CYKTXLOHEYQWCF-UHFFFAOYSA-N	436.287	1.697	50	20	IDGD	
O=C(NCC(=O)N1CCCC1)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1	1318984915	HZWXMMXYOYKHKL-OAQYLSRUSA-N	435.528	1.566	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@H]2CN(Cc3nc(O)c4ccccc4n3)CCO2)cc1	1319260917	NDCVXCKNTYZKRV-GOSISDBHSA-N	437.456	1.006	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)c1cc2c(cn1)OCCC2	1320007487	JSBOWTWABXVWLE-UHFFFAOYSA-N	443.935	1.639	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)NCCN3C(=O)COc4ccccc43)n[nH]2)cc1	1338358255	IXQAIDIXXYCDEN-UHFFFAOYSA-N	434.456	1.755	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNS(=O)(=O)c2c[nH]c(C(F)(F)F)c2)CC1	1347395200	NKCFWVGJTDMDTL-UHFFFAOYSA-N	440.444	1.990	50	20	IDGD	
CCCC(=O)N[C@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CO[Si](C)(C)C)C1	1779545462	OBAIGMTZYMXFER-CBGDNZLLSA-N	441.645	1.657	50	20	IDGD	
CN(C)c1ccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)cc1	1780728134	ODQBUDVHRSRVQM-MAUKXSAKSA-N	428.302	1.887	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1n[nH]cc1[N+](=O)[O-])C2)[C@@H](F)Br	1780774978	SBKMELYJYWOYCH-IXPVHAAZSA-N	448.249	1.136	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Cl)C2)c1cc(O)cc([N+](=O)[O-])c1	1781098867	FVHXVEYXOAOACT-IIDMSEBBSA-N	429.832	1.962	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc4nncn4c3)CCO2)C1	1781229900	KPRQHCQNISULLV-ZWKOTPCHSA-N	426.304	1.409	50	20	IDGD	
O=C(c1ccnc2ncccc12)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781331955	BRWFSOPELUQERO-KBXCAEBGSA-N	437.269	1.764	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(=O)c1ccc(C)cc1)C2	1782178639	BYBMGRBEXVMSJO-NJNPRVFISA-N	436.936	1.945	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cn(C)nc3C(F)F)CCO2)C1	1783347552	LALBVWKKLICJEB-SJKOYZFVSA-N	449.296	1.975	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cccc4c3NC(=O)C4)CCO2)C1	1783538080	VUGJEPQFYFKXHN-HXPMCKFVSA-N	436.306	1.408	50	20	IDGD	
COc1ccc(CC(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](C)Br)C3)C2)cc1F	1783540111	RSWXVWITQPMSDO-YJYMSZOUSA-N	443.313	1.990	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc4c(c3)CCCC4=O)CCO2)C1	1783874069	CHOYFZQGHQYVJV-GCJKJVERSA-N	434.920	1.903	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cccc(F)c3[N+](=O)[O-])CCO2)C1	1783882452	YZYLOYBYMREKQY-FZKQIMNGSA-N	429.832	1.431	50	20	IDGD	
O=C1CSc2cc(C(=O)N3CCO[C@@]4(CCN(C(=O)C(Cl)Cl)C4)C3)ccc2N1	1783945303	GAWIYYOYEICHBL-GOSISDBHSA-N	444.340	1.978	50	20	IDGD	
O=C(CCc1ccc2c(c1)OCO2)N1CCO[C@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783947704	YAUIDNFIOTVHBO-LJQANCHMSA-N	429.300	1.982	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3C[C@]3(F)Cl)C[C@@H]21	1783974130	JHISRZYQLFIDQD-TUIVPAFXSA-N	425.726	1.922	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3CC[C@H](C(=O)OC)C3)[C@H]2C1	1784075241	FSOKFFSEGRXXGW-QQCJEOGWSA-N	428.957	1.963	50	20	IDGD	
CC(=O)Nc1ccccc1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](C)Br)CCO2	1785100826	SOADLXNBWVSWSI-DJJJIMSYSA-N	438.322	1.872	50	20	IDGD	
CN1CCCC[C@@H]1C(=O)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1	1786146601	NAVBFJDFXAZHDO-OAQYLSRUSA-N	435.333	1.598	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC1(c2ccc(NC(=O)CN3C(=O)CNC3=O)cc2)CCC1	1786641137	KNQWDFGXUARHEH-GOSISDBHSA-N	441.315	1.909	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnn4ncccc34)[C@H]2C1	1787376236	TWUGDDNQWZLDCO-ZVZYQTTQSA-N	431.569	1.174	50	20	IDGD	
COC(=O)[C@@H]1CC[C@@H](C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]3C2)C1	1788761929	HDXNITNYLPFGDL-ZBRFXRBCSA-N	440.613	1.407	50	20	IDGD	
Cc1nccnc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)CBr)C[C@@H]21	1789032057	GIVDDCSHWRHHRW-MXAVVETBSA-N	425.327	1.409	50	20	IDGD	
C[C@H](C(=O)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1)N1C[C@H]2C[C@@H]2C1	1789440430	DCFHSSQKXJCOBL-BHIYHBOVSA-N	447.344	1.454	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1ccc(C2(NC(=O)CCn3cncn3)CCC2)cc1	1789523808	WCIRQQJQNVACRL-UHFFFAOYSA-N	448.487	1.115	50	20	IDGD	
COc1ccnc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]3C2)c1	1789870588	PKMAAMCCNWZHII-HAHWVIBASA-N	430.332	1.920	50	20	IDGD	
CC(=O)O[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]2C1)C(C)C	1789925710	HQFFTDKZJIUIAJ-YTFOTSKYSA-N	437.306	1.244	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CC(c3ccccc3)=NN1)C2	1793453729	UEFGOPXIXIAOPZ-NDLGOLERSA-N	432.952	1.750	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1c(C)nn(C)c1C	1793527045	PWPLFXIOJMOACE-FQLMCAECSA-N	427.343	1.414	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnn(-c2cccnc2)c1	1794445504	LFIZUIKODRNYDF-FAYQHZLMSA-N	448.321	1.254	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2)c1n[nH]c(C2CC2)c1F	1794480479	ZGQFGOZWZPHDGX-GNXNZQSNSA-N	429.290	1.414	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(C(=O)O)n(C(C)C)n1	1794759001	ACMVMOFXLNNDPG-CRWXNKLISA-N	426.901	1.668	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ncc[nH]1	1794833032	MVYLSIIPVHEJGY-CRWXNKLISA-N	425.917	1.794	50	20	IDGD	
CN(C)c1ccc(CCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)cc1	1796190522	HRIGYMMMFLLHON-UADZTWIMSA-N	449.360	1.317	50	20	IDGD	
Cc1cccc2c(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3cccc(B(O)O)c3)n[nH]c12	1796193193	SVSLYJXGGOCSNH-BCDXTJNWSA-N	432.289	1.117	50	20	IDGD	
COc1cc(C)c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)c(C)c1	1796193225	XAVMLZOEXZBSEW-ACDBMABISA-N	436.317	1.557	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H]2[C@@H](C1)[C@@H]2C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Cl	1796369326	AIMJSNWFCZKQLC-FYFPFLJLSA-N	445.919	1.223	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)Nc1nccs1	1796411121	UBTHCJXBFWRFTB-XHJNMGKDSA-N	445.383	1.564	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2c(c1)n(C)c(=O)n2C	1796980714	HCBKODYVJJCUJN-RCJHGTSTSA-N	448.951	1.488	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2cccn2cn1	1797102323	JTYBGKMVKKSINK-YXPYIKCWSA-N	435.322	1.711	50	20	IDGD	
CN(C)C(=O)c1cccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CO[Si](C)(C)C)c1	1797959036	KIIAVSHMNYVOAF-OPVJXMOQSA-N	447.608	1.443	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c(F)ccc(O)c1F)C2)[C@@H](F)Br	1799348695	MYCIDXUXJUFPKS-QYOFDKIESA-N	437.212	1.564	50	20	IDGD	
Cn1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)/C(C#N)=C/c2ccc(F)cc2F)cn1	1800332766	ZBXYTKKIQOWYIZ-HTVRTGGUSA-N	441.438	1.509	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc(C#N)cc1)C2	1800637651	FXVTVEWOGDBGQN-SFNKJDCFSA-N	434.334	1.864	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COCc1ccccc1)C2	1800640129	VSYCTFCFPSGLRF-SFNKJDCFSA-N	439.350	1.966	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1Cc3ccccc3CN1)C2	1800758388	YGHZLLOGVKRVGA-SOGIYBJLSA-N	436.350	1.074	50	20	IDGD	
COc1cc(C)c(C)cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCC(=O)NN(C)C)C2	1800800708	IPHSFRCFIXFNAV-BCDXTJNWSA-N	430.549	1.937	50	20	IDGD	
C[C@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1(N3CCN(C)CC3)CC1)C2	1801968105	NNIOPMNYOQJTRW-JONQDZQNSA-N	427.387	1.188	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1C[C@@]12C(=O)Nc1ccccc12	1801972114	FKOLJBMYAZPZPM-HUWURKSSSA-N	431.920	1.788	50	20	IDGD	
COc1ccc(CC(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)cc1O	1802817636	HFOGVRYDRKEHJF-MDKPJZGXSA-N	447.919	1.644	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cc(C(F)F)no2)[C@@H]1c1cccnc1)[C@H](O)CCl	1803138312	JIUIMLDCJDNTJN-NJZAAPMLSA-N	428.823	1.927	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H](CNC(=O)C(OC)OC)[C@@H]1c1cccnc1	1803357709	XGPVIYQDMQUYMV-ILXRZTDVSA-N	428.327	1.880	50	20	IDGD	
Cc1onc(C(=O)NC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)c1C	1803891619	LLHAADINRDQAHN-UWJYYQICSA-N	442.520	1.379	50	20	IDGD	
O=C(CCc1cc(F)ccn1)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1	1804441755	FCSFMRBRBIVNHG-QKYXUNIQSA-N	434.899	1.854	50	20	IDGD	
Cn1cccc1C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1	1805351686	FSSZOYLURLRIND-OXJNMPFZSA-N	447.499	1.052	50	20	IDGD	
Cc1cncc(C(=O)NC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)c1	1805771511	HUBFROFOOYDTBE-PGRDOPGGSA-N	438.532	1.478	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CN2CCCC2)[C@@H]1c1cccnc1)[C@H](F)Br	1808648994	HDAIKOAOZILBAN-UAGQMJEPSA-N	427.318	1.874	50	20	IDGD	
Cn1cc(CC(=O)N2CC[C@H](CNC(=O)[C@H](F)Br)[C@@H]2c2cccnc2)cn1	1808681070	OLLKEOLGGQDYRZ-PVAVHDDUSA-N	438.301	1.754	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@H]1c1cccnc1)c1cc(O)no1	1810983495	FWWHGSDOOXXYNQ-LEWSCRJBSA-N	427.230	1.785	50	20	IDGD	
COc1cnc(C(=O)N2CC[C@H](CNC(=O)[C@@H](C)Br)[C@@H]2c2cccnc2)cn1	1812863552	FGTXWGVAXYRUSQ-MRRJBJDNSA-N	448.321	1.983	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)CCn2ccnn2)[C@H]1c1cccnc1	1812867495	IYCSAWVDPUGRNT-QRTARXTBSA-N	435.326	1.553	50	20	IDGD	
O=C(CCn1cncn1)NC[C@@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1	1813318989	ZKRZPDODQOVAPP-MAUKXSAKSA-N	435.326	1.554	50	20	IDGD	
COC(C)(C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1814513632	RDSPPPHQMNIVPA-OAHLLOKOSA-N	429.481	1.139	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CNC(=O)N(C)C)n[nH]1	1814566101	CGODFXISXOVBKH-JQWIXIFHSA-N	429.319	1.456	50	20	IDGD	
CC(=O)C(C)(C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1815077188	KRCXAELGYHKMAS-KRWDZBQOSA-N	426.282	1.011	50	20	IDGD	
C[C@@]1(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)CC1(F)F	1815362034	ZGYKWIMQORDDJY-XIKOKIGWSA-N	435.261	1.094	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CC(C)(C)O)CC2	1817280362	UCMTZBYEFBFYOU-JBBSTVMTSA-N	446.533	1.350	50	20	IDGD	
Cc1ccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)nc1	1817471079	QSBXMMMBIJARJI-IBGZPJMESA-N	433.277	1.413	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)C(Cl)Cl)[nH]n1)c1ccc(B(O)O)cc1	1817475948	WNVREVOYGKJORB-ZDUSSCGKSA-N	425.081	1.199	50	20	IDGD	
C[C@@H]1C[C@@]1(C)C(=O)N[C@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1	1819798053	SFYJZUJOPXSHIX-QZXWKGOOSA-N	428.518	1.414	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1)c1ccc(-n2cccn2)nc1	1819882181	RCFGARVOLLKNHJ-JKSUJKDBSA-N	443.895	1.896	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](C)Br)n[nH]1	1822186765	IWKKTMYJNSGWLK-SCVCMEIPSA-N	429.319	1.632	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cccn(C)c1=O)CC2	1825635486	HLHLUSLGFQTZRC-VHSXEESVSA-N	439.335	1.851	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnc(O)nc2O)CC1	1827592917	YACMGIWJCLCGCY-HUUCEWRRSA-N	426.901	1.375	50	20	IDGD	
C[C@H](NC(=O)c1cnccn1)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@H](F)Cl)CC1	1827608951	MRCQKVPTHDWFTC-XKQJLSEDSA-N	439.919	1.749	50	20	IDGD	
COCCn1ccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)[C@@H](O)CCl)CC2)n1	1827824111	OSHVNQLJHGICEX-MSOLQXFVSA-N	426.945	1.363	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)/C=C/C2CC2)CC1	1828923426	JVSPPGYKILINDE-YJJPMGAVSA-N	425.533	1.885	50	20	IDGD	
Cc1cc2cccc(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)[C@@H](O)CCl)CCO4)c2[nH]1	1830728043	NNBQHTMNTKMEAX-LAUBAEHRSA-N	435.908	1.146	50	20	IDGD	
O=C([C@@H](F)Cl)N1CCC([C@H]2CCCCN2C(=O)Cn2cccc([N+](=O)[O-])c2=O)CC1	1831186718	BXNRQCUSGYPXRV-RHSMWYFYSA-N	442.875	1.911	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4cccnn4c3)C2)C1	1831654871	YOBDWENNHWCZAQ-NQIIRXRSSA-N	434.924	1.812	50	20	IDGD	
CC(C)(CCl)C(=O)NC1CCN(C2CCN(C(=O)CN3CCSCC3)CC2)CC1	1833213775	CXENGTBGEQPDPT-UHFFFAOYSA-N	445.073	1.872	50	20	IDGD	
C#CCO[C@@H](C)C(=O)N1CCC(N2CCC(NC(=O)[C@H](C)CBr)CC2)CC1	1833265261	RQVKQAXDHCVHCF-CVEARBPZSA-N	442.398	1.627	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)C[C@H]3C[C@@H]4CC[C@H]3C4)CC2)CC1)[C@@H](O)CCl	1833311896	GRYALZLAOIPLRH-YZLZLFLDSA-N	426.001	1.984	50	20	IDGD	
Cc1cncc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)c1	1834285421	PIRPLRXPZJSUSK-RHSMWYFYSA-N	430.274	1.151	50	20	IDGD	
Cc1ccsc1C(=O)N1CCOC[C@@]2(CN(C(=O)CCBr)CCO2)C1	1834819662	XSFIZMSTHGEEIU-QGZVFWFLSA-N	431.352	1.912	50	20	IDGD	
O=C(Cc1cc(F)cc(F)c1)NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1834865493	YXBHFANTYJNKGE-IBGZPJMESA-N	443.922	1.679	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)CC3CCOCC3)CCO2)C1	1835422708	ACRKSHZXKNGPRF-RBUKOAKNSA-N	437.364	1.496	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)/C=C\C(=O)NC3CC3)CC2)CC1	1835657782	JHUDLUCKBCYJNG-LIXSYLKWSA-N	439.000	1.800	50	20	IDGD	
O=C(/C=N/N1CCCCC1)NC1CCN(C2CCN(C(=O)C(Cl)Cl)CC2)CC1	1835732485	DGLRQUVLCWBUFD-HYARGMPZSA-N	432.396	1.833	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3cscn3)CCO2)C1	1836037490	MMYDCOYNHLOMGX-SUMWQHHRSA-N	446.367	1.173	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CSc3ncccn3)CCO2)C1	1836109727	HCQBWAIWGYJODP-HNAYVOBHSA-N	442.969	1.433	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)CN3CCNC3=N)CC2)CC1	1836919075	PXYVXEYQVXHJOM-KRWDZBQOSA-N	427.977	1.232	50	20	IDGD	
CC(C)O[C@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)CBr)C2)C1	1837592558	WBPZIZYPQXLNIF-RKVPGOIHSA-N	435.359	1.287	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(Cl)nc3)C2)C1	1837708393	FQZRBHIYIJQNOE-IBGZPJMESA-N	441.988	1.657	50	20	IDGD	
CCc1cnc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)s1	1837724447	OTVJFVQDVHOTLH-SJKOYZFVSA-N	446.367	1.559	50	20	IDGD	
Cc1cc(CC(=O)N2CCC(OC3CCN(C(=O)[C@H](F)Br)CC3)CC2)n[nH]1	1838412873	UDKYOMPWNFHZQX-KRWDZBQOSA-N	445.333	1.950	50	20	IDGD	
COc1cccc(OC)c1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1838881963	DOEABAGSIFBAQU-VQIMIIECSA-N	430.860	1.308	50	20	IDGD	
COc1cc(OC)cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)c1	1838934696	HLLPDXLOGPMHAA-IBGZPJMESA-N	447.315	1.578	50	20	IDGD	
Cc1ncccc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839197650	DQQSREAGSITSKC-WMLDXEAASA-N	430.274	1.151	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3c(O)cc(O)cc3O)CCO2)C1	1839371759	NZKYOIHCMARBRQ-VBKZILBWSA-N	442.896	1.281	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CNC(C)(C)C)C2)C1	1839963274	GLKVSUWJQNFHPZ-KDOFPFPSSA-N	434.375	1.004	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3=C(C)OCC3)C2)C1	1839964170	JAFOJDCEYYFZIY-MAUKXSAKSA-N	431.327	1.311	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cncc(O)c3)C2)C1	1839966853	RNCHPFFLOLCXTP-CRAIPNDOSA-N	442.310	1.031	50	20	IDGD	
Cc1nc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)sc1C	1840034575	PYMJKZMAMCKBGE-APPDUMDISA-N	446.367	1.613	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(OC)c3C)C2)C1	1840155956	GNFVMJIUMRLCOM-LAUBAEHRSA-N	440.924	1.327	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3C[C@H]3c3ccccc3)C2)C1	1840156561	VEUQFDQICRPXDQ-OZIGNCPNSA-N	436.936	1.500	50	20	IDGD	
O=C(c1ccc2nccnc2c1)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840188670	WPIPIEHKJSDTRV-LJQANCHMSA-N	439.299	1.504	50	20	IDGD	
O=C(c1ccn(C(F)F)n1)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840188864	HQHKTLYBATVHKL-OAHLLOKOSA-N	427.235	1.152	50	20	IDGD	
COc1cc(C)cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)c1	1840189518	WEZGWSGVXMWJON-LJQANCHMSA-N	431.316	1.877	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)c2ccccc2OC(F)(F)F)C1	1841154875	IVFAHMVDYMLOAL-UHFFFAOYSA-N	448.206	1.396	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC2(CCCN2C(=O)/C=C/C(=O)NCc2ccccc2)C1	1841329408	JJKVERAANAPZFH-XVJNWHFHSA-N	434.334	1.846	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC2(CCCN2C(=O)[C@H]2CCc3nc(O)nc(O)c3C2)C1	1842058976	OHXBVJVZBIAFJD-ZDUSSCGKSA-N	434.569	1.048	50	20	IDGD	
COc1ccc(Cl)cc1CC(=O)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843012100	DHNDATQKCGTRMJ-UHFFFAOYSA-N	442.708	1.088	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)c2csc(-c3cccnc3)n2)C1	1843443742	DEPUAHMQHXBPTK-UHFFFAOYSA-N	448.313	1.016	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)Cc1nnc(C)o1)C2	1844692322	KSEAMRHMEUVQJA-UHFFFAOYSA-N	443.416	1.271	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H]1C(=O)N1CC2(CCCN2C(=O)[C@@H](F)Br)C1	1845216238	DHWWHHBXKWSDMF-NWDGAFQWSA-N	434.306	1.890	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@H]1Cc3[nH]nc(C(F)(F)F)c3C1)C2	1846364500	RTABLKYEFAZIJP-ZYHUDNBSSA-N	434.846	1.601	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)c1occc1Br)C2	1846384910	XTAYUUWFROOSBV-UHFFFAOYSA-N	427.299	1.232	50	20	IDGD	
CCOC(=O)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)[C@H](F)Cl)C2	1847043732	NNRRENOYSBXDNX-RYUDHWBXSA-N	435.880	1.181	50	20	IDGD	
C[C@@H](NC(=O)c1ccccc1)C(=O)N1CCCC12CN(C(=O)[C@H](F)Br)C2	1847063309	QIRXKVVZJMUEPN-OCCSQVGLSA-N	426.286	1.699	50	20	IDGD	
CC(C)C[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl	1847564475	XIXZVRNYPIYTJW-FXUDXRNXSA-N	431.961	1.727	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc(O)no1	1848099526	SHCQTZIIWSKNSI-SRVKXCTJSA-N	428.873	1.328	50	20	IDGD	
CC(=O)N/C(=C\c1ccccc1)C(=O)NNC(=O)c1sc(N2CCOCC2)nc1C	14890486	LVGNNWVTVJKUPT-VBKFSLOCSA-N	429.502	1.226	50	20	IDGD	
CCCc1n[nH]c(=S)n1CC(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12	17197552	HQKCETZEBPQQCO-UHFFFAOYSA-N	429.506	1.645	50	20	IDGD	
CCCS(=O)(=O)N1CCCC[C@@H]1C(=O)NNC(=O)COc1ccccc1OCC	108661251	QOIIJPUAJWYHOO-OAHLLOKOSA-N	427.523	1.206	50	20	IDGD	
CC(C)OC(=O)C[C@@H](NC(=O)NNC(=O)CNC(=O)c1cccs1)c1ccccc1	725872524	QFZJGYDYRNYNPM-OAHLLOKOSA-N	432.502	1.891	50	20	IDGD	
Cc1ccccc1CN1CCCN(C(=O)NNC(=O)CNC(=O)c2cccs2)CC1	725873462	NDSVLFZAGWOFNX-UHFFFAOYSA-N	429.546	1.735	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)c1csc(-c2ccc3c(c2)OCO3)n1	726509617	PIQKZGAZUGOEAN-UHFFFAOYSA-N	430.467	1.791	50	20	IDGD	
CNS(=O)(=O)c1cccc([C@H](C)NC(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)c1	727607753	JAPKQGWZFBEFOD-AWEZNQCLSA-N	447.517	1.242	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)[C@@H]2CC[C@H](C(F)(F)F)NC2=O)c1	728527775	RZRZVPKRPMTKPA-LDYMZIIASA-N	438.200	1.676	50	20	IDGD	
CC(=O)N[C@H](CC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)c1ccc(Cl)cc1	728847533	IYNZXMNRVNZIAS-GOSISDBHSA-N	444.923	1.761	50	20	IDGD	
CC(C)N(C)S(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2cccc(C#N)c2)cc1	728950400	MZWFZRCWXCUUBZ-UHFFFAOYSA-N	429.502	1.731	50	20	IDGD	
O=C(COc1ccccc1Cc1ccccc1)NNC(=O)NC[C@@H]1CN2CCC[C@@H]2CO1	729620138	WKYZHQWOCFPCGL-NHCUHLMSSA-N	438.528	1.850	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)CCCCC(=O)NNC(=O)c2ccc(C#N)cc2)cc1	729842112	AEHNSZISFBJSIH-UHFFFAOYSA-N	432.440	1.213	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(C(=O)N2CCOCC2)cc1)c1cccc2ncccc12	730203491	AZMRFRKSULNZCW-UHFFFAOYSA-N	440.481	1.331	50	20	IDGD	
C[C@H]1CCCN(S(=O)(=O)c2cc(C(=O)NNC(=O)CNc3ccccc3)n(C)c2)C1	730274877	QLULRTUVRLQXSZ-HNNXBMFYSA-N	433.534	1.319	50	20	IDGD	
CCS(=O)(=O)N[C@@H](CCSC)C(=O)NNC(=O)c1cc2c(s1)CCCCC2	730516948	FWFOQBLRWITVJR-ZDUSSCGKSA-N	433.621	1.839	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC(=O)NNC(=O)CNC(=O)c1cccs1	730826374	JTZHXUDYRZUAJB-GFCCVEGCSA-N	425.511	1.208	50	20	IDGD	
NC(=O)c1ccc(/C=C\C(=O)N2CCC[C@H]2C(=O)NNC(=O)Cc2ccccc2F)cc1	731329901	CLYNIBHQRPEVEO-ADYPVZHUSA-N	438.459	1.319	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)c1ccc(C)c(S(=O)(=O)N2CCOCC2)c1)c1ccccc1	731996976	IYDYJSAECCJJDO-IBGZPJMESA-N	445.541	1.971	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])o2)c1	732050595	WIMVZNRMSOBQKA-AWEZNQCLSA-N	430.417	1.636	50	20	IDGD	
CON(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c1	733110749	RZSZQINNMJEULO-UHFFFAOYSA-N	429.458	1.129	50	20	IDGD	
O=C(NN=C1C(=O)Nc2c(Cl)cc(Br)cc21)N[C@H]1CCS(=O)(=O)C1	735614395	WVDUSHDJRSRPIK-ZETCQYMHSA-N	435.687	1.245	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)N2CCN(CC(=O)NNC(=O)c3cccs3)CC2)c1	736621275	HSQGMQZNWQHGCW-INIZCTEOSA-N	430.530	1.429	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)[C@H](NC2CCOCC2)C(C)C)c2ccccc2c1=O	743284279	AEXQXIJFXILMMK-GOSISDBHSA-N	429.521	1.361	50	20	IDGD	
O=C(NNC(=O)[C@H](c1ccccc1F)N1CCOCC1)c1nn(-c2ccccc2)cc1O	743292531	DTANGDBARNFSQF-FQEVSTJZSA-N	439.447	1.552	50	20	IDGD	
CS(=O)(=O)c1ccc(OCCCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1	743606000	IMMVOHKJTVSOQQ-GOSISDBHSA-N	434.470	1.237	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)CN2CCN(C(=O)c3cc4occc4s3)CC2)cc1	744405267	OWEVPYFVNCWMCR-UHFFFAOYSA-N	437.481	1.585	50	20	IDGD	
O=C(CCc1nc(-c2ccoc2)no1)NNc1ccccc1S(=O)(=O)N1CCOCC1	744619519	RIWOPEXZWHTTLY-UHFFFAOYSA-N	447.473	1.426	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1ccc(Cn2cccn2)o1	744621075	NPBBVHLBUADVST-UHFFFAOYSA-N	431.474	1.302	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)NCCN1Cc2ccccc2C1	744885712	FDOUZPAAONIRSB-UHFFFAOYSA-N	436.560	1.545	50	20	IDGD	
C[C@@H](O)[C@@H](NC(=O)C(C)(C)C)C(=O)OCC(=O)C(C#N)=C1N(C)c2ccccc2N1C	745700939	IDGAEQITVLDXDD-FZKQIMNGSA-N	428.489	1.332	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)NCCc1cccc(C(=O)N(C)C)c1	745847386	PJOSUOIDOQBFOD-UHFFFAOYSA-N	428.489	1.739	50	20	IDGD	
CN(C)c1ccc(N2CCC(NC(=O)NNC(=O)COc3ccccc3O)CC2)cc1	745870035	XITQWPVNMSFIML-UHFFFAOYSA-N	427.505	1.836	50	20	IDGD	
COc1ccccc1O[C@@H](C)CNC(=O)NNc1ccc(S(=O)(=O)NC(C)C)cn1	745901486	KATHYGUJWWPAKY-AWEZNQCLSA-N	437.522	1.871	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@@H](C)C(=O)OC(C)C)c1	745905809	NMFGJIOXLLZMGN-CQSZACIVSA-N	442.538	1.249	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2ccc(CS(N)(=O)=O)cc2)ccc1OCCC(C)C	746347589	YNXUOZUJWVAOFX-UHFFFAOYSA-N	449.529	1.983	50	20	IDGD	
COc1cc(C)nc(NNC(=O)C2CCN(S(=O)(=O)c3ccc(C#N)cc3)CC2)n1	746623265	JCXCFUAJXOUWOY-UHFFFAOYSA-N	430.490	1.209	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)NCc2ccccc2OCCN(C)C)cc1C	746976745	FHPXVSDKMIAUAA-UHFFFAOYSA-N	427.505	1.713	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCOCc2ccccc2)c1	747588630	GOYQDKBGDYHYOP-UHFFFAOYSA-N	448.545	1.878	50	20	IDGD	
CS(=O)(=O)CC[C@H](NC(=O)c1ccc(Cl)cc1)C(=O)NNc1ccc(C#N)cc1	748106184	JOHGGZHWWJNVHW-KRWDZBQOSA-N	434.905	1.888	50	20	IDGD	
Cc1ccc(C(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)cc1S(N)(=O)=O	748520874	WRNWLZDMKVEYIT-UHFFFAOYSA-N	437.421	1.693	50	20	IDGD	
C[C@@]1(C2CC2)NC(=O)N(CC(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)C1=O	748521640	XRFXBOMRJUUKOB-HNNXBMFYSA-N	434.396	1.144	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)/C=C\c3ccc4c(c3)OCO4)cc2)CC1	748621255	ZBMWZOWWGLSXSL-OQFOIZHKSA-N	444.513	1.508	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1	748633129	HMDWJEPMRREQRV-UONOGXRCSA-N	430.452	1.639	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)N2CCN(CCn3cncn3)CC2)c(C)n1C[C@H]1CCCO1	749397656	QKYIQIJGSZCEMH-MUIAGPEESA-N	437.548	1.627	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)NCc2ccccc2CN2CCC(O)CC2)cc1	749588658	DRVVJUYERMINNP-UHFFFAOYSA-N	437.500	1.424	50	20	IDGD	
O=C(NNC(=O)[C@H]1Nc2ccccc2S(=O)(=O)N1)c1ccc(F)cc1Br	749915617	JGRCQEKFIYURQR-ZDUSSCGKSA-N	443.254	1.079	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)CCN1CCN(C(c2ccccc2)c2ccccc2)CC1)N(C)C	750607163	QOJXKKKOIRXPLC-FQEVSTJZSA-N	437.588	1.881	50	20	IDGD	
CC[C@@H](CS(=O)(=O)c1ccccc1)NC(=O)NNC(=O)COc1ccc(OC)cc1	752703768	KBCKDPGDMQAGRZ-HNNXBMFYSA-N	435.502	1.657	50	20	IDGD	
O=C(NC[C@H]1CCCCS1)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	753256427	UMPYKPAXUFKCRS-OAHLLOKOSA-N	426.564	1.701	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)NCCCC#N)c1	753268581	CUJXIBOVSZHDBJ-UHFFFAOYSA-N	431.474	1.744	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)Cc2ccccc2OC)c(C)c([N+](=O)[O-])c1	753840404	JSOIOWCJHYGTAJ-UHFFFAOYSA-N	444.400	1.027	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)CCc2cccc([N+](=O)[O-])c2)ccc1Cl	755048299	ANAFKZIRIICJBG-UHFFFAOYSA-N	426.838	1.289	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)COc2ccc(C#N)cc2)cc1S(=O)(=O)N(C)C	755393241	MFCKKGQJLBFSLT-UHFFFAOYSA-N	431.474	1.349	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3ccc(O)c([N+](=O)[O-])c3)n[nH]2)cc1OC	755647173	WECYBBKMZOKPLJ-UHFFFAOYSA-N	427.373	1.783	50	20	IDGD	
Cc1cc(N2CCOCC2)ccc1NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	755744188	ZMHBSXMCCLRQKC-UHFFFAOYSA-N	436.472	1.545	50	20	IDGD	
CN1CCC/C1=N/S(=O)(=O)c1ccc(NC(=O)NNC(=O)Cc2cccnc2)cc1	756074352	YGHSHSJTFWPKSC-ULJHMMPZSA-N	430.490	1.290	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)Nc1ccc(F)c(-n2nnnc2C2CC2)c1	756776811	DMQGIZZTZUUNBN-UHFFFAOYSA-N	439.407	1.917	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)CCc2cnn(-c3ccccc3)c2)n1	758034204	HWZLVXYPJKFXPK-UHFFFAOYSA-N	427.486	1.503	50	20	IDGD	
Cn1c(=O)c2c(ncn2CC(=O)NN=C2CCC[C@H]2c2ccccc2Cl)n(C)c1=O	758125817	YNZUIFWMVDPZCN-ZDUSSCGKSA-N	428.880	1.527	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H]2COc3ccc(Br)cc32)c1	758403227	STFACHUAWOTYCM-AWEZNQCLSA-N	439.287	1.790	50	20	IDGD	
CCOC(=O)Nc1ccc(C(=O)N2CCN(S(=O)(=O)CBr)CC2)cc1	758513869	VHFQDDLMQTUZOH-UHFFFAOYSA-N	434.312	1.695	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N2CCC(C)(O)CC2)cc1	760008467	PIFRCCFJMJXKNQ-LGMDPLHJSA-N	437.500	1.714	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)cc1	761788085	RVQRUOUNAFCQMT-IBGZPJMESA-N	426.473	1.596	50	20	IDGD	
O=C(NNC(=O)c1ccccc1)C(=O)Nc1ccc(F)cc1I	763430865	OMPBFJOJJURZPO-UHFFFAOYSA-N	427.173	1.830	50	20	IDGD	
O=C(NNC(=O)c1ccccc1Br)C(=O)Nc1ccn(CC(F)(F)F)n1	763482484	GUUSWSCKKWQDTL-UHFFFAOYSA-N	434.172	1.608	50	20	IDGD	
N#Cc1c(F)cccc1-n1ccc(NC(=O)C(=O)NNC(=O)c2c[nH]c3ccccc23)n1	763534548	JQPDQLPCARWXBP-UHFFFAOYSA-N	431.387	1.764	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)[nH]n1)C(=O)Nc1cc2c(cc1Cl)OCCO2	763600490	JUUMOOOCIBNVPX-UHFFFAOYSA-N	441.831	1.901	50	20	IDGD	
CCOC(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)COc2cc(C)cc(C)c2)c1	763645340	ULZUVVFCUOXYSW-UHFFFAOYSA-N	427.457	1.574	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2ccc3c(c2)NC(=O)CS3)c1	763646080	BBAAIBUBMDTPBT-UHFFFAOYSA-N	428.470	1.513	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cnc(Br)cc1C	763663354	HOJUGNYCKBZCOS-UHFFFAOYSA-N	437.250	1.326	50	20	IDGD	
COC(=O)c1ccc(OC)cc1NC(=O)C(=O)NNC(=O)COc1ccc(C)c(C)c1	763679186	HXBHMYKGWZOOLB-UHFFFAOYSA-N	429.429	1.264	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2cnc(Br)cc2C)c1	763775524	VECDDLZCOYRYFR-UHFFFAOYSA-N	437.250	1.569	50	20	IDGD	
CCOc1ccc(-c2nc(C(=O)NNC(=O)CNC(=O)c3cccnc3)cs2)cc1	763821967	ZWSBQFSRTARSGQ-UHFFFAOYSA-N	425.470	1.795	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(OC)c(NS(C)(=O)=O)c2)cc1	763832872	XQUJYZSKNPCUNC-UHFFFAOYSA-N	434.474	1.029	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1cnn(Cc2ccncc2)c1	763863527	ACUUFVICMOEOOW-ZDUSSCGKSA-N	426.408	1.019	50	20	IDGD	
CC(C)Oc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1Cl	763916605	HMFWFAOCXUIPPN-UHFFFAOYSA-N	443.851	1.503	50	20	IDGD	
Cn1c(=O)oc2c(NC(=O)C(=O)NNC(=O)c3ccc(Br)s3)cccc21	763942124	URPQOQUBNLBSKE-UHFFFAOYSA-N	439.247	1.355	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)C(=O)Nc1ccc(SC(F)F)nc1	763944764	PJRYUGBWFYOELB-UHFFFAOYSA-N	448.411	1.687	50	20	IDGD	
CN1CCC[C@H](N(C)C(=O)c2ccc(NC(=O)C(=O)NNC(=O)C3CCCC3)cc2)C1	764071042	PKAFPBIDWVZFJX-SFHVURJKSA-N	429.521	1.129	50	20	IDGD	
Cc1nn(-c2ccc(C#N)cc2)c(NC(=O)C(=O)NNC(=O)c2ccc(Cl)nc2)c1C	764093320	SJMAHRSUUWTOAG-UHFFFAOYSA-N	437.847	1.809	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2cccc(OCc3cscn3)c2)c1O	764130423	HLAWZXAGVYUBAJ-UHFFFAOYSA-N	442.453	1.836	50	20	IDGD	
C[C@@H]1CN(Cc2cccc(NC(=O)C(=O)NNC(=O)c3cccc(C#N)c3)c2)C[C@@H](C)O1	764238112	PHJLRNYKRQAUKL-HZPDHXFCSA-N	435.484	1.567	50	20	IDGD	
Cc1ncsc1C(=O)NNC(=O)C(=O)Nc1ccccc1-n1cc(Br)cn1	764245272	CDTGOTLFAMYHNO-UHFFFAOYSA-N	449.290	1.799	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)C(=O)Nc1cc(N2CCCC2=O)ccc1Cl	764320740	KIYIJCSRXZWDLH-UHFFFAOYSA-N	432.839	1.935	50	20	IDGD	
CO[C@@H](C)C(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2F)c1	764410885	WEWCFJFXDAFXTQ-JTQLQIEISA-N	436.827	1.852	50	20	IDGD	
Cn1cc(-c2cccc(C(=O)NNC(=O)CN3CCN(C(=O)c4ccccc4)CC3)c2)cn1	765735350	KFZXRQZLIDSLJJ-UHFFFAOYSA-N	446.511	1.306	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)c1ccc(CSc2nc[nH]n2)cc1	767339945	LNBVZLAOCFETNC-UHFFFAOYSA-N	439.497	1.952	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)C(=O)Nc1ccc(Cc2nnc3n2CCCCC3)cc1	768240435	WMWQVJJHZRCRSU-UHFFFAOYSA-N	435.488	1.334	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)CCCS(=O)(=O)N2CCCC2)n[nH]1	768273293	CDRVMXFXMGUXHV-UHFFFAOYSA-N	435.506	1.052	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)CN1C(=O)N[C@@]2(CCCC(C)(C)C2)C1=O	768566069	QNCAGPFNULZFNY-YEJXKQKISA-N	434.468	1.631	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)Cn1cc(Br)ccc1=O	768637111	CXAOBPMAQCESFO-UHFFFAOYSA-N	430.280	1.166	50	20	IDGD	
CCN1CCN(C[C@H](C)CNC(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)CC1	770531818	BCOVRAXJSHGDFX-CVEARBPZSA-N	425.961	1.711	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)N1CC[C@@H](C(=O)NCC(F)(F)F)C1	770646497	FKULJLBAMFAFQR-WDEREUQCSA-N	436.818	1.849	50	20	IDGD	
Cc1nnnn1[C@H](Cc1ccccc1)C(=O)NNc1nc(O)c2cnn(C(C)(C)C)c2n1	770965535	LBVHWGVOHIWBQA-OAHLLOKOSA-N	436.480	1.509	50	20	IDGD	
CS(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)c2cc3c(s2)CCC3)cc1F	771151052	XTFPLOJYRMTPLY-UHFFFAOYSA-N	433.508	1.371	50	20	IDGD	
CCc1nn(C)c(OC)c1CNC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	772607730	XUTUENBPSKFEDK-UHFFFAOYSA-N	443.552	1.034	50	20	IDGD	
CC(C)c1nccnc1NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	772860025	KVVGJBWIQFHREG-UHFFFAOYSA-N	433.534	1.697	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)c2ccc(C(=O)NC3CC3)cc2)C1	773415882	ASIIUTHCTFQXBI-INIZCTEOSA-N	430.505	1.987	50	20	IDGD	
COC(=O)[C@@H]1CCCCN1C(=O)c1cccc(NC(=O)C(=O)NNc2cccc(C#N)c2)c1	773689135	VPPYIQZYFIPPGH-IBGZPJMESA-N	449.467	1.808	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2ccnn2Cc2cccc(Br)c2)n1	773724464	RTIUXXIBPSDJRD-UHFFFAOYSA-N	446.265	1.574	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCC(C(=O)NCCCSC#N)CC2)cc1OC	774298528	RNPGETYYOIKCHE-UHFFFAOYSA-N	427.548	1.825	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)N1CCc2cc(Br)cc(F)c2C1	774705849	YVFMENJXSOHNLS-UHFFFAOYSA-N	439.241	1.710	50	20	IDGD	
CC(=O)N1CCC(=NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)c2ccccc2C1	778539480	CIHMYAKMWRMQRI-UHFFFAOYSA-N	442.541	1.888	50	20	IDGD	
Cc1cc(S(N)(=O)=O)cc(NC(=O)C(=O)NNc2ccccc2OC(F)(F)F)c1C	778801999	ALXZSUAWSMIBHY-UHFFFAOYSA-N	446.407	1.931	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)CCCNS(=O)(=O)c2ccc3c(c2)OCCO3)c1	781035071	YZSZPULIZZQRGU-UHFFFAOYSA-N	449.485	1.446	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NNc2ccnc(F)c2)o1	781360682	HMOYZGYJVWZUKG-LBPRGKRZSA-N	426.426	1.287	50	20	IDGD	
CC(C)(C)OC(=O)N=c1cc[nH]cc1C(=O)OCC(=O)NNC(=O)c1ccc(C#N)cc1	781389781	GSTCNSITFXFQHH-UHFFFAOYSA-N	439.428	1.340	50	20	IDGD	
Cn1cc(-c2ccc(F)c(C(=O)OCC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)c2)cn1	782411523	LXWLWQLGQHNAJX-UHFFFAOYSA-N	441.375	1.752	50	20	IDGD	
Cc1c(/C=C(\C#N)C(=O)O[C@H](C(=O)N2CCC[C@H](C(N)=O)C2)C(C)C)cc(C#N)n1C	782626764	GYFBWMGTRWHJSW-OTLYOTCNSA-N	425.489	1.404	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)cc1)C(=O)Nc1cc(Cl)ccc1OC[C@@H]1CCOC1	782838055	YQQGGBMXJGCZTP-GFCCVEGCSA-N	433.848	1.861	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ccc(C)cc2)cc1S(=O)(=O)N1CCOCC1	783348421	FNANBMBSEVJZME-UHFFFAOYSA-N	448.501	1.106	50	20	IDGD	
NC(=O)c1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)cc1F	783409018	OXRCLWLASZCKJQ-UHFFFAOYSA-N	448.354	1.300	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NN=Cc2c[nH]ccc2=NC(=O)C(C)(C)C)cc1	783805651	VDASUUXBWFPBIZ-UHFFFAOYSA-N	445.545	1.567	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)NC[C@@H]1CCCCS1(=O)=O	784444248	FYTPQHFWSVAZIQ-ZDUSSCGKSA-N	434.312	1.126	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H]2CN(CC(=O)NNC(=O)c3ccc(C#N)cc3)C[C@@H]21	784503828	FRQUIWDNWHWIHW-CEXWTWQISA-N	441.532	1.944	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1cnc2c(c1)COCC2	784833986	WSSIFORIIBEQKO-UHFFFAOYSA-N	447.517	1.313	50	20	IDGD	
CNC(=O)c1ccc(C)c(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)c1	784836469	ZFIRGBNUYJBUEV-UHFFFAOYSA-N	440.428	1.433	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(C(=O)[C@@H](C)OC(=O)/C(C#N)=C\C3CC3)CC2)cc1	786677394	HIKIXHMWQQPEOT-OKSBFYSISA-N	431.514	1.620	50	20	IDGD	
C[C@]1(NNC(=O)N[C@@H]2CCN(c3cccc(Br)c3)C2)CCS(=O)(=O)C1	787372189	YYYCQJCKSDZDPE-CJNGLKHVSA-N	431.356	1.409	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1cc(-c2ccsc2)nn1C	787570721	BQVMAEIDTBMORI-UHFFFAOYSA-N	449.514	1.643	50	20	IDGD	
CN(NS(=O)(=O)Cc1ccc(F)cc1F)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	788916534	PRVJHJXSHUBVOY-UHFFFAOYSA-N	448.492	1.904	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc3c2OCC[C@@H]3N(C)C)cc1OC	789730435	QTYZTEWNYUCWTO-INIZCTEOSA-N	442.472	1.489	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cc([C@@H]3CCCO3)nn2C)cc1OC	789741493	WOAWJAXIDGECMB-HNNXBMFYSA-N	445.476	1.469	50	20	IDGD	
Cn1c(=O)c2c(ncn2CC(=O)NN=Cc2c[nH]c3cc(Cl)cc(Cl)c23)n(C)c1=O	790166852	WFAASZKHFBLDPG-UHFFFAOYSA-N	448.270	1.372	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNc2cccc(F)c2[N+](=O)[O-])c(C(=O)N(C)C)cc1OC	790999751	YCGHGNONALBGOK-UHFFFAOYSA-N	449.395	1.535	50	20	IDGD	
CN(C)N(C(=O)c1nc(Br)ccc1Br)[C@@H]1CCS(=O)(=O)C1	792524536	GYXUQKBLRLVTJS-MRVPVSSYSA-N	441.145	1.713	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N1CCO[C@@]2(CCO[C@@H]2C)C1	792779236	DSOJNJLLAHSKKE-JCGVRSQUSA-N	442.310	1.837	50	20	IDGD	
CSCCONC(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	793422142	FGRZUGFKBDQIKX-UHFFFAOYSA-N	427.486	1.683	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C2=NN(Cc3ccccc3)C(=O)CC2)cc1	794717492	OAJNVISRJOLLIW-UHFFFAOYSA-N	429.502	1.559	50	20	IDGD	
CNC(=O)c1cc(Cl)cc(S(=O)(=O)NNC(=O)CCc2ccccc2O)c1OC	795320310	ZHFRHMJGGJXQJF-UHFFFAOYSA-N	441.893	1.356	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)C2=C(C)N(C)c3ncnn3[C@H]2C)c1	798952507	IUJAXLKVTOOXPR-JTQLQIEISA-N	435.282	1.795	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)CCCC2CCOCC2)CC1	799100062	KEDNVJMJEOEZSW-UHFFFAOYSA-N	425.555	1.058	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1ccccc1Sc1ccccc1[N+](=O)[O-]	799834457	NKERDXCUMDYVDE-NSHDSACASA-N	438.487	1.445	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)N[C@H]1CCN(C(=O)Nc2ccccc2)C1	801078004	RRFRKKPLBSXXCA-INIZCTEOSA-N	425.445	1.708	50	20	IDGD	
COC(=O)N(C)NC(=O)c1cccc(NC(=O)C[C@H]2SC(N3CCCCC3)=NC2=O)c1	804124138	AHCNLIFBBHCMHV-OAHLLOKOSA-N	447.517	1.842	50	20	IDGD	
CC(C)N(C)S(=O)(=O)c1ccc(NC(=O)NNc2ccc(-n3ccnc3)nn2)cc1	806148171	CXXMCPDZHXKJPM-UHFFFAOYSA-N	430.494	1.840	50	20	IDGD	
CCN(CC)CC(=O)Nc1cccc(NC(=O)C(=O)NNc2cccc([N+](=O)[O-])c2)c1	806968543	LCAVOHSBLAISJZ-UHFFFAOYSA-N	428.449	1.957	50	20	IDGD	
COC(=O)c1cc(C)c(NC(=O)C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c(Cl)c1	806972319	QNYSUXGKFPDGCE-UHFFFAOYSA-N	434.792	1.743	50	20	IDGD	
O=C(NCc1ccccc1Cn1cccn1)NNC(=O)c1csc(N2CCOCC2)n1	807108051	QADCNKNWLITKTM-UHFFFAOYSA-N	441.517	1.369	50	20	IDGD	
COc1ccc(S(=O)(=O)C(F)(F)F)cc1NC(=O)C(=O)NNc1cccc(F)n1	807392314	YJPCBFHJIUOITQ-UHFFFAOYSA-N	436.343	1.605	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccncc2)c(C(=O)NCC(F)(F)F)cc1F	810385148	NCRFJSQQYIQIKI-UHFFFAOYSA-N	441.341	1.221	50	20	IDGD	
Nc1nc(Cl)cc(NNC(=O)CNS(=O)(=O)c2c(Cl)cccc2Cl)n1	810956505	DUKIXNQFHVHXPV-UHFFFAOYSA-N	425.685	1.441	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@@H]2CCCN2C(=O)Nc2ccccc2)c2ccccc2c1=O	813365763	MGIKSTONTOIWIM-SFHVURJKSA-N	448.483	1.874	50	20	IDGD	
O=C(NNc1ncncc1F)Nc1ccc(Cl)c(S(=O)(=O)N2CCOCC2)c1	814485201	ZTMFQXSMZFNDAH-UHFFFAOYSA-N	430.849	1.439	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@@H](C)Cc1cnc2ccccc2n1	814736850	SXYCQULYMRERGM-ZDUSSCGKSA-N	440.529	1.871	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)CNC(=O)Cc2cccc(F)c2)C1	816510046	KXWAWUWZZXILKZ-HNNXBMFYSA-N	436.484	1.279	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)c2cc(S(C)(=O)=O)ncc2Cl)c1C	816821376	XRGPKAPFDDFTRO-LBPRGKRZSA-N	425.894	1.984	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NN=Cc2c(OC)nc(N)nc2N2CCCC2)cc1	863966647	IWNIAUVMBXJTSS-AWEZNQCLSA-N	428.493	1.984	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)CNS(=O)(=O)c2ccc3ccccc3c2)cc1	915771881	QHTITQLHRMXOKT-UHFFFAOYSA-N	427.482	1.653	50	20	IDGD	
CN(C)[C@@H](CNC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)c1ccccc1Cl	915904297	GKEDQFLVLLKBOQ-KRWDZBQOSA-N	438.937	1.990	50	20	IDGD	
Cn1c(CNC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)nc2ccccc21	915928340	OHKBMCZDXGCTNC-UHFFFAOYSA-N	435.532	1.616	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)N[C@@H](C)c2nnc3ccccn23)nc1	916222025	QBTYZRUDJHBEBE-ZDUSSCGKSA-N	432.510	1.542	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)NC[C@@H](C(C)C)N3CCN(C)CC3)n[nH]2)cc1	916257443	QVRQDUKBZABYNU-FQEVSTJZSA-N	427.553	1.601	50	20	IDGD	
CC(=NNC(=O)Cn1cnc2ccccc21)c1ccc(S(=O)(=O)NCCC(=O)O)cc1	916273788	FKBZWMREBRGESM-UHFFFAOYSA-N	443.485	1.330	50	20	IDGD	
COc1cccc(NCC(=O)NN=C(C)c2ccc(S(=O)(=O)N3CCOCC3)cc2)c1	916363957	YPCBWWPCWNPXLX-UHFFFAOYSA-N	446.529	1.668	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCCCN1C[C@H](C)C[C@@H](C)C1	916460553	KEELNCWNLCFLLF-HUUCEWRRSA-N	438.598	1.600	50	20	IDGD	
O=C(NCCS(=O)(=O)N1CCN(c2ccccn2)CC1)NNc1ccccc1Cl	916517210	YDHSPWNVZXVJKL-UHFFFAOYSA-N	438.941	1.513	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)[C@H](C)Sc1nncn1C	917921828	DOKXDWIWWDOXHM-UWVGGRQHSA-N	428.312	1.673	50	20	IDGD	
CNS(=O)(=O)c1ccc([C@H](C)NC(=O)NNC(=O)c2ccc3ccccc3n2)cc1	919779288	PSYBGWBMMSDDLT-ZDUSSCGKSA-N	427.486	1.848	50	20	IDGD	
C[C@H](Cc1ccc(O)cc1)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	919911501	PCSQQJAWUYNHNH-OAHLLOKOSA-N	446.529	1.752	50	20	IDGD	
O=C(COC(=O)CNC(=O)c1cc(Cl)ccn1)NNC(=O)c1cccc(Cl)c1	1317718029	SNEMTJQSENUEHZ-UHFFFAOYSA-N	425.228	1.123	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NCc1ccccc1N1CCN(C)CC1	1318261835	DNXYKPJXEKIPBX-MRXNPFEDSA-N	429.496	1.875	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1)c1nnc2ccccn12	1318668232	GCVJAGHXBVQRGN-ZDUSSCGKSA-N	431.497	1.768	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)Nc2ccnn2C[C@@H]2CCOC2)c2ccccc2c1=O	1324159736	QDWNQTKPSUXQJI-AWEZNQCLSA-N	439.476	1.677	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H]2COc3c(F)cc(F)cc3C2)c1	1527970050	VOXKBAMDAAFQSN-CYBMUJFWSA-N	425.413	1.316	50	20	IDGD	
C=CC[C@@H](C(=C)C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2	1779270297	ATOOFVPNUDUHGY-YZUZCNPQSA-N	440.349	1.262	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@]2(C1)CN(C(=O)c1ccc3nc(CO)[nH]c3c1)CCO2	1779295968	YQSFDSXJKAMDEU-NRFANRHFSA-N	446.580	1.350	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cn3[nH]cnc(=O)c3c2C)C1	1780018983	NHZYAACSQMUYMN-WHSLLNHNSA-N	449.939	1.476	50	20	IDGD	
CC(=O)c1cc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](F)Br)C2)n[nH]1	1780771081	RZTKSNXEPDBPDJ-JKIFEVAISA-N	445.289	1.430	50	20	IDGD	
CC(=O)N[C@H](C(=O)N1CC[C@@]2(CN(C(=O)[C@@H](F)Cl)CCO2)C1)c1ccc(F)cc1	1780908943	POZZXJHNLGDKHR-FCEWJHQRSA-N	429.851	1.367	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)Cc3ccc(S(C)(=O)=O)cc3)CCO2)C1	1781212812	HJDREVJJMJVSQK-XLIONFOSSA-N	442.965	1.480	50	20	IDGD	
O=C(c1cccc2[nH]ncc12)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781331416	QCXLNPBZZYNTRP-YOEHRIQHSA-N	425.258	1.697	50	20	IDGD	
O=C(c1cnn2cccc(F)c12)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781335061	VEWZAWKFHBIFIA-YOEHRIQHSA-N	443.248	1.607	50	20	IDGD	
O=C(CCc1ccc(O)nn1)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(Cl)Cl)C2	1781469839	OVXJEIFYXYIPCM-FZKQIMNGSA-N	431.320	1.432	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Cl)C2)c1cnc2c(c1)CCNCC2	1781525670	HWYIXOQUNOWJTR-DBXWQHBBSA-N	438.931	1.432	50	20	IDGD	
CCOC(=O)c1ccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](Cl)COC)CCO3)cc1	1782041291	SLDGAQYUNVMXKB-DYESRHJHSA-N	438.908	1.561	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H]3CC(c4ccccc4)=NN3)C2)C1	1782601679	BLPMJVKSGAFVDC-LRXVAGHRSA-N	432.952	1.990	50	20	IDGD	
COc1c(Cl)ccnc1C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](C)Br)C2)C1	1783535578	AKGUBBLSVMRVEU-PIGZYNQJSA-N	446.729	1.971	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc4cc(O)ccc4n3)CCO2)C1	1783874275	FXUWOMPJIJYOPO-IERDGZPVSA-N	433.892	1.638	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccnn3-c3ccccc3)CCO2)C1	1783874491	HXPWMUVVNBYVKN-LAUBAEHRSA-N	432.908	1.570	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ncccc3C(F)(F)F)CCO2)C1	1783876853	AYKJLBYQOWMOKE-SUMWQHHRSA-N	435.830	1.798	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(F)cn3C)C[C@@H]21	1783965384	KMJROUCADOBVIR-DUPGQFARSA-N	430.318	1.789	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cccc(C(F)(F)F)c3)C[C@@H]21)[C@H](O)CCl	1784093516	AEFYVGNSDFHMJB-LLLHUVSDSA-N	448.869	1.827	50	20	IDGD	
CC1CCN(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Br)C[C@@H]32)CC1	1784320090	GKLOLASSPUAXRZ-JKQORVJESA-N	434.350	1.389	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccnc(F)c3)[C@H]2C1	1784734657	KUSYEGVDOJSQTG-MXAVVETBSA-N	428.302	1.845	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(CO)c(F)c3)C2)C1	1785268692	UIVIOXQVQSXQEI-RBUKOAKNSA-N	433.307	1.998	50	20	IDGD	
Cc1nnc(CC(=O)Nc2ccc(C3(NC(=O)c4cccc(B(O)O)c4)CCC3)cc2)o1	1788193434	CEEFPFSDQBUTOU-UHFFFAOYSA-N	434.261	1.048	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(C(=O)O)n(C(C)C)n3)C[C@@H]21	1789858754	MOHYXESIGPCOAV-ZJOBFFGXSA-N	440.928	1.773	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccncc3O)C[C@@H]21	1790960317	AEILANZINZIGGB-ZIEJDFEHSA-N	426.311	1.554	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(C(F)(F)F)[nH]3)C[C@@H]21	1791255664	XTVBCQRWJNVHEE-MNXVOIDGSA-N	437.846	1.881	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(CS(C)(=O)=O)nc1	1796541762	ZFRSQWKHDAIOAW-YVSFHVDLSA-N	443.953	1.132	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCOCCOCCOCCOC)C2	1800074845	HJUPNAQFVGHTFR-FCGDIQPGSA-N	448.988	1.728	50	20	IDGD	
COc1c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)ccc(F)c1F	1800585338	WUFRCBINLDCNDU-MUJYYYPQSA-N	444.243	1.219	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(O)cc1F)C2	1800643568	XNDPVMKCACNPQH-VAECKANCSA-N	429.286	1.908	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(N2CCCOC2=O)cc1)[C@H](O)CCl	1800786874	YEIXOBCJOZMFRY-BZZMCLGOSA-N	435.908	1.885	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(-c3cnccn3)c1)C2	1800979047	QCKJAHSYNARREW-DMUMMCEESA-N	444.919	1.601	50	20	IDGD	
C[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(Cl)Cl)[S@](=O)c1ccccc1	1801016535	HRCSNXPNPVFFIZ-MNGJIDMDSA-N	433.357	1.576	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)o1	1803143083	SURZAMBRSOTLBT-VKJFTORMSA-N	434.880	1.552	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)C#Cc2ccccc2)[C@@H]1c1cccnc1	1806621512	ADBACZSLBQBLCO-BWKNWUBXSA-N	447.539	1.512	50	20	IDGD	
Cc1csc(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)c1	1807358939	ANSBQQOOWNBYNU-WIYYLYMNSA-N	449.341	1.765	50	20	IDGD	
O=C(CC(F)(F)C(=O)O)NC[C@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1	1808286965	FTUVIROLNMHOIO-IUODEOHRSA-N	448.264	1.982	50	20	IDGD	
N[C@@H](Cc1cscn1)C(=O)N1CC[C@H](CNC(=O)[C@@H](F)Cl)[C@@H]1c1cccnc1	1808313127	SHOXGJSCFWMYDU-SYAUCNOPSA-N	425.917	1.648	50	20	IDGD	
Cc1ccc(C(=O)N2CCCC3(CCN(C(=O)c4cnccc4C(=O)NN)CC3)C2)nc1	1808598692	RLECHFDOSBCFOB-UHFFFAOYSA-N	436.516	1.547	50	20	IDGD	
O=C(/C=C/c1ccccc1)N1CCCC2(CCN(C(=O)c3ccc(B(O)O)cc3)CC2)C1	1809304317	PREIZBMRVMFXFZ-KPKJPENVSA-N	432.329	1.925	50	20	IDGD	
CC[C@H](C)CC(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1	1810295348	SGSOIQOOANZCAH-HZUJVAHNSA-N	438.532	1.836	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1	1810305178	IYKKCLGGPCHPCR-JLSDUUJJSA-N	444.923	1.417	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)Cn2ccnn2)[C@@H]1c1cccnc1	1812777940	ZNLDFRVWROOQFD-HLLBOEOZSA-N	435.326	1.553	50	20	IDGD	
COC(=O)NCC(=O)N1CC[C@H](CNC(=O)[C@H](C)Br)[C@@H]1c1cccnc1	1812868306	YAASURNGTGIXTG-LNSITVRQSA-N	427.299	1.227	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)Cc2cccnc2)[C@H]1c1cccnc1	1813070777	JUHYMBFKXOWDLT-CVDCTZTESA-N	438.532	1.098	50	20	IDGD	
COc1ccc(CC(=O)Nc2cc([C@H]3CCCCN3C(=O)[C@@H](O)CCl)[nH]n2)cc1O	1814647623	SJFUXFITRKBAIV-ZBFHGGJFSA-N	436.896	1.958	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1cscn1	1816486020	HCKSMTBVZPEQDX-INIZCTEOSA-N	425.279	1.166	50	20	IDGD	
C[C@H](Nc1nccs1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](O)CCl)CC2	1817216994	VKYUIRQYAOZESU-IQJOONFLSA-N	429.955	1.612	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@H]2CCCSC2)[nH]n1)c1cccc(B(O)O)c1	1817479332	QGTIQZGFTVJLLS-YJBOKZPZSA-N	442.350	1.539	50	20	IDGD	
CCOC(=O)N[C@@H](O)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CO[Si](C)(C)C)n[nH]1	1819595085	AMAQRAQOUWZANI-BBRMVZONSA-N	441.561	1.318	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnncc3C(=O)O)sc2C1	1820502146	FBQRNHICBXVCOT-KCJUWKMLSA-N	439.881	1.111	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc4cccnn4n3)sc2C1	1821168474	MYSLMWCMSHGAJT-PWSUYJOCSA-N	434.909	1.665	50	20	IDGD	
C[C@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1)N1C[C@@H]2C[C@H]2C1	1822416088	NPVBAMIDDNVBNJ-MUQADHOPSA-N	445.568	1.115	50	20	IDGD	
CC(=O)N/C(C)=C/C(=O)N[C@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1	1823008829	HROUCFWFAARHNT-UNBPSNLMSA-N	433.303	1.786	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)CNC(=S)NCC)sc2C1	1824492537	OZVSIUCFJMGJKS-MNOVXSKESA-N	432.015	1.947	50	20	IDGD	
Cc1noc(C)c1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1	1825858164	COYKLOHUSHKQIM-HXUWFJFHSA-N	439.321	1.518	50	20	IDGD	
Cc1cc(C(=O)NCC(=O)N2CCC([C@@H]3CCCCN3C(=O)[C@@H](F)Cl)CC2)no1	1827608955	MUCNLQVXEXHAPO-DOTOQJQBSA-N	428.892	1.867	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)CO[Si](C)(C)C)CC1	1829104383	XPDKBKJBSYHAEV-SFHVURJKSA-N	440.661	1.831	50	20	IDGD	
Cc1ncc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)s1	1830538539	IRKZIBOFOUNTFG-PXAZEXFGSA-N	446.367	1.553	50	20	IDGD	
CC#CC[C@H](C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1)c1ccccc1	1830732464	YUTMPQXURPDBDP-MZKRTTBSSA-N	448.947	1.240	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccnc3OCC)C2)C1	1831638461	CWWMLIFAKDGNQN-DYESRHJHSA-N	439.940	1.958	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cn4ccccc4n3)C2)C1	1831647473	VTIAAMRBWAMKRM-HRAATJIYSA-N	434.924	1.812	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)c2cncc(O)c2)CC1	1831699150	LYICLDOPTNVXOW-OAQYLSRUSA-N	437.305	1.014	50	20	IDGD	
O=C(CN1CCCC1)NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1	1833100877	NVSFYBXXLXZUGC-UHFFFAOYSA-N	429.403	1.439	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3ccn(C)c3)CC2)CC1	1834079831	WMRFEDSHQAXLIT-CQSZACIVSA-N	425.371	1.994	50	20	IDGD	
O=C(CCBr)NC1CCN(C2CCN(C(=O)c3cc(O)ncn3)CC2)CC1	1834422720	ZWBVGQSSWXHVGG-UHFFFAOYSA-N	440.342	1.152	50	20	IDGD	
Cn1ccc(CC(=O)NC2CCN(C3CCN(C(=O)[C@@H](F)Br)CC3)CC2)n1	1834849239	XPWOWEILTVGAEU-QGZVFWFLSA-N	444.349	1.225	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)COc3ccccc3C)CCO2)C1	1835155415	PUQQGFHFDQYUME-UWJYYQICSA-N	440.924	1.084	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3ccncn3)CC2)CC1)[C@H](F)Br	1836412687	QCJPVAYHQFJNSS-HNNXBMFYSA-N	428.306	1.352	50	20	IDGD	
NC[C@H](C(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1)c1ccccc1	1836716820	SDEORZQUISNMJN-VQTJNVASSA-N	437.968	1.327	50	20	IDGD	
O=C(c1ccnc2ncccc12)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836718888	GPFCSCAUTNTMBD-IBGZPJMESA-N	446.935	1.842	50	20	IDGD	
CC(C)(C)CC(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1	1837642202	UCJYOCSYGXMQDH-UHFFFAOYSA-N	445.564	1.734	50	20	IDGD	
CC(C)=NO[C@@H](C)C(=O)N1CCOC[C@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1837714468	HOGGEARNIKNFAH-LPHOPBHVSA-N	429.590	1.095	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)CCCn3cccc3)C2)C1	1837718168	YSEKUWSCUCTEHG-OAQYLSRUSA-N	437.613	1.576	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccnc4c3OCO4)CCO2)C1	1838474688	OZGJITBAFOCHPR-QRWLVFNGSA-N	439.896	1.288	50	20	IDGD	
O=C(Cc1ccsc1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839199863	XHKPRZORNXRWKS-GOEBONIOSA-N	435.315	1.438	50	20	IDGD	
COc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)cc1	1839201822	KNFFOUBCESKWPW-CRAIPNDOSA-N	445.285	1.456	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cscn3)C2)C1	1839963484	LRJHINQNYGXXOH-LRDDRELGSA-N	432.340	1.387	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3cccc(F)c3F)CCO2)C1	1839982805	BMWVYIGNEYHUBS-QRWLVFNGSA-N	446.878	1.218	50	20	IDGD	
C=CCC(CC=C)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)Br)CCO2	1840030491	NYIOGMWKIMZOQG-HNAYVOBHSA-N	429.355	1.995	50	20	IDGD	
Cc1csc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)c1	1840030829	XZTHXMOKXDKHIE-CXAGYDPISA-N	431.352	1.910	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(Cl)ccn3)C2)C1	1840153322	KDYJSVBTWHNYHY-KDOFPFPSSA-N	432.304	1.059	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(N(C)C)cc3)C2)C1	1840154531	YNTAEULEQLDOCD-RXVVDRJESA-N	439.940	1.076	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3C[C@H]3c3ccccc3)C2)C1	1840156558	VEUQFDQICRPXDQ-JYLXEMOASA-N	436.936	1.500	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3cc(C)on3)CCO2)C1	1840369669	KJTDBOHQUZZERJ-MAUKXSAKSA-N	444.326	1.155	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC12CN(C(=O)c1nc3ccccc3n(C)c1=O)C2	1841287512	RRASZEDQLXZNTQ-CYBMUJFWSA-N	447.333	1.782	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCCC12CN(C(=O)[C@H]1CCCCO1)C2	1841923976	KKINCGMTALABDC-LSDHHAIUSA-N	429.945	1.891	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1ccncc1C(F)(F)F)C2	1844264081	BXTNBBYAVHXCDA-UHFFFAOYSA-N	448.405	1.230	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC2(CCCN2C(=O)C[C@H](O)CNC(=O)OC(C)(C)C)C1	1845231532	SXVAEAACEHQRIF-OLZOCXBDSA-N	448.358	1.249	50	20	IDGD	
O=C1C[C@H](C(=O)N2CCCC23CN(C(=O)[C@@H](Br)Cc2ccccc2)C3)CN1	1846000430	IVBCQDPNDWCHKB-HOTGVXAUSA-N	434.334	1.332	50	20	IDGD	
COc1ccc([C@H](O)C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](C)CBr)cc1	1847392479	SFESQSJZINKDIC-STECZYCISA-N	425.323	1.961	50	20	IDGD	
CC(C)(C)OC(=O)NNC(=O)C1CCN(c2ccc3nnc(C(F)(F)F)n3n2)CC1	10329130	JAKQKDKALKIWTO-UHFFFAOYSA-N	429.403	1.915	50	20	IDGD	
Cc1ccc(-c2csc3ncn(CCC(=O)NNc4nnc(C)c(=O)[nH]4)c(=O)c23)cc1	11548451	KPZQBKVLGXMWMR-UHFFFAOYSA-N	437.485	1.754	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C[C@@H](NC(C)=O)c2cccs2)c2ccccc2c1=O	14044402	YDSRJMCSMGVILL-OAHLLOKOSA-N	427.486	1.506	50	20	IDGD	
CCCS(=O)(=O)N1CCCC[C@H]1C(=O)NNC(=O)COc1ccccc1OCC	108661253	QOIIJPUAJWYHOO-HNNXBMFYSA-N	427.523	1.206	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)NCCCN2CCC[C@@H]2C(=O)N(C)C)c2ccccc2n1	726278853	ZWTDZFBJILFJGN-LJQANCHMSA-N	426.521	1.430	50	20	IDGD	
COc1ccc(CN2C[C@@H](C(=O)NNC(=O)c3ccc(OC)c(OC)c3)CC2=O)cc1	726496615	BXIJBWZMROEEAB-INIZCTEOSA-N	427.457	1.522	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNS(=O)(=O)c2ccc([N+](=O)[O-])cc2)c1	728508127	GHLWXPUJEJBRBP-UHFFFAOYSA-N	430.236	1.989	50	20	IDGD	
CC(C)CN1C(=O)/C(=C\NNC(=O)c2cc(F)ccc2Br)C(=O)NC1=S	728611295	YWDDDIFXDGPDLU-WDZFZDKYSA-N	443.298	1.606	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)c2ccc(OC)c(OCCO)c2)c1	728611911	FRPDRXSVYZRRMW-UHFFFAOYSA-N	439.262	1.912	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCC(CN(C)C(=O)OC(C)(C)C)CC2)n1	728931956	NSKOULPIJCIGNF-UHFFFAOYSA-N	439.582	1.720	50	20	IDGD	
O=C(NC[C@@H]1CCN(c2ccc(F)cc2)C1)NNC(=O)C1CCN(c2ncccn2)CC1	728950690	YMZALSLCPCARIR-INIZCTEOSA-N	441.511	1.689	50	20	IDGD	
CN(C)[C@@H](CNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)c1ccccc1Cl	729044652	MJCUWMGXYTVCGL-SFHVURJKSA-N	445.955	1.980	50	20	IDGD	
Cn1c(=NNC(=O)NCCCCN2CCN(c3ncccn3)CC2)sc2ccccc21	729233828	XCTPDRVVMOWUKL-UHFFFAOYSA-N	440.577	1.747	50	20	IDGD	
Cc1nc(S(=O)(=O)N2CCC(C(=O)NN=c3cc[nH]c4ccccc34)CC2)cn1C	730288963	KMVQVAVDEGFDKO-UHFFFAOYSA-N	428.518	1.243	50	20	IDGD	
COc1ccccc1C[C@H](C)CC(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	730656845	ZKEQWFWEVNDMSP-YWZLYKJASA-N	442.468	1.795	50	20	IDGD	
NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NNC(=O)COc3ccccc3O)cc2)C1	730901407	CNZKJSHBAZHTFT-INIZCTEOSA-N	441.488	1.003	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)c1ccc2c(c1)SC1=NS(=O)(=O)CCN12	731493139	QXYUGERBUOYNNN-UHFFFAOYSA-N	432.483	1.382	50	20	IDGD	
CC(C)c1nc(C#N)c(NNC(=O)[C@@H]2CCCC[C@H]2C(=O)N[C@H]2CCS(=O)(=O)C2)o1	731620822	OSCVZBHTPJADLJ-BFHYXJOUSA-N	437.522	1.222	50	20	IDGD	
CN(CC(=O)NNc1nc(-c2ccc(Cl)cc2)no1)C1=NS(=O)(=O)c2ccccc21	732976130	JBADHQWILGDLHN-UHFFFAOYSA-N	446.876	1.914	50	20	IDGD	
CS(=O)(=O)Nc1ccc(CNC(=O)NNC(=O)NCc2ccc(Cl)cc2)cc1	732991641	KWSBVBCRUWABML-UHFFFAOYSA-N	425.898	1.925	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)[C@@H]2CCCN2S(=O)(=O)c2cccc([N+](=O)[O-])c2)c(O)c1	733001239	XJNKGEFZYBBFLA-INIZCTEOSA-N	448.457	1.223	50	20	IDGD	
CCOCCCn1c(NNC(=O)c2sccc2-n2cnnn2)nc2ccccc2c1=O	733268635	QWSRWDURFZVFIL-UHFFFAOYSA-N	440.489	1.617	50	20	IDGD	
CC(C)[C@@H](CNC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)NC(=O)OC(C)(C)C	734690812	YTTXCWUGDAJKTQ-OAHLLOKOSA-N	446.508	1.427	50	20	IDGD	
C[C@@H]1CCC[C@@H](OCC(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)C1	735118227	NLFIMCXRQCNUKS-HZPDHXFCSA-N	425.555	1.056	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2cnn(-c3ccccc3OC)c2)cc1OC	743252270	TZOKQECORIMZBR-UHFFFAOYSA-N	432.458	1.521	50	20	IDGD	
CN(C)CC(=O)NNC(=O)[C@@H]1CCCN(C(=O)c2ccc(Br)c(F)c2)C1	743333602	UQJSZNBBWKTBRB-GFCCVEGCSA-N	429.290	1.149	50	20	IDGD	
O=C(Cn1ncc2ccc([N+](=O)[O-])cc21)NNC(=O)c1cc(Br)ccc1O	743733534	KWNBNWWOYBAWKH-UHFFFAOYSA-N	434.206	1.874	50	20	IDGD	
CN(CCO)S(=O)(=O)c1ccc(C(=O)NNC(=O)c2cccc3ccccc23)cc1	743824339	FMWFLDZEEPMMLR-UHFFFAOYSA-N	427.482	1.527	50	20	IDGD	
Cc1ccc(N2CCC(C(=O)NNC(=O)Nc3ccc(S(C)(=O)=O)cc3)CC2)nc1	743829823	DXOLPTZLHJLOPV-UHFFFAOYSA-N	431.518	1.863	50	20	IDGD	
CCCCn1c(N)c(N(CC(=O)NNC(=O)C(C)(C)C)Cc2ccccc2)c(O)nc1=O	744386217	GYSFNQNBCUDHFV-UHFFFAOYSA-N	444.536	1.531	50	20	IDGD	
CCc1c(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)cnn1C(C)(C)C	744619607	TWTTWJOTXCFEAG-UHFFFAOYSA-N	435.550	1.978	50	20	IDGD	
CC(=NNC(=O)N1CCOCC1)c1ccc(S(=O)(=O)N2CCCC[C@@H]2C(=O)O)cc1	745591179	RVSPVOBHANTJAE-QGZVFWFLSA-N	438.506	1.080	50	20	IDGD	
Cc1cccc(NS(=O)(=O)c2ccc(C(=O)NNC(=O)N3CCOCC3)cc2)c1C	745993177	ZHWXRKCXDDZSGV-UHFFFAOYSA-N	432.502	1.791	50	20	IDGD	
Cc1cc(=O)n(CC(=O)NC(C)C)c(C)c1C(=O)NNC(=O)C12CC3CC(CC(C3)C1)C2	746013694	KMISXTDHWHCTRS-UHFFFAOYSA-N	442.560	1.967	50	20	IDGD	
NC(=O)CC[C@@H](C(=O)NNC(=O)c1cccc2ccccc12)N1C(=O)c2ccccc2C1=O	746296702	UOXADPRMOKZYIS-IBGZPJMESA-N	444.447	1.531	50	20	IDGD	
CCO/C=C(\C#N)C(=O)N1CCN(S(=O)(=O)c2ccc(Br)cc2)CC1	746511036	XDGUOAUWJQRXBP-OUKQBFOZSA-N	428.308	1.726	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCC(C(=O)NNc3nc(C)cc(OC)n3)CC2)cc1	746625322	LLHUNJNTUHVXSA-UHFFFAOYSA-N	435.506	1.346	50	20	IDGD	
COC(=O)c1ccsc1N1CC[C@H](NC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)C1=O	746780245	NCMHSPJFNSNMTQ-ZDUSSCGKSA-N	447.429	1.192	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H]2CCCN2C(=O)CC(C)(C)C)c1	748214345	QCPUPSFFXORJOG-MRXNPFEDSA-N	438.550	1.125	50	20	IDGD	
COc1ccccc1[C@]1(C)NC(=O)N(CC(=O)NNc2cccc([N+](=O)[O-])c2C)C1=O	748673991	VPCYCJGMBSQMBI-FQEVSTJZSA-N	427.417	1.822	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)CSc1nccn1C(C)(C)C	749559703	DQGFGGOCLRHACT-UHFFFAOYSA-N	438.579	1.793	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NNC(=O)COc2ccc(C#N)cc2)cc1	750578172	SMSBRBFYPHPIPN-IBGZPJMESA-N	442.497	1.246	50	20	IDGD	
COc1nc(N2CCN(C(=O)NNC(=O)C3CCCC3)CC2)ncc1Br	753353774	BICYHLDZNUTDPA-UHFFFAOYSA-N	427.303	1.301	50	20	IDGD	
CCOC(=O)c1sc([C@H](C)NCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)nc1C	755055355	VNGVJGCNRDTBFB-NSHDSACASA-N	435.462	1.648	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(OC)c(NC(=O)NNC(=O)CC(F)(F)F)c1	755410566	VKBQRCMSEPJJAQ-UHFFFAOYSA-N	426.417	1.831	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)Nc1cccc(NC(=O)Nc2ccccc2)c1	755597982	CYYKAEQQKPMIPA-ZDUSSCGKSA-N	431.474	1.918	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)Nc1cnn(CC(F)(F)F)c1	756649261	NBXDZPFHUJTHGI-UHFFFAOYSA-N	439.442	1.810	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)N[C@H]2CCc3nc(COC)nn3C2)cc1OC	757784725	ALWKXUSIDFFMNU-AWEZNQCLSA-N	432.481	1.181	50	20	IDGD	
C[C@H](Sc1ccnc2cc(Cl)ccc12)C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O	758031657	XMEJIKRQZAAJQY-ZJUUUORDSA-N	430.939	1.454	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)N=c1cc[nH]cc1I	760030030	RJQHVFJJBVJSLO-UHFFFAOYSA-N	444.254	1.759	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccnn2[C@H](C)C2CC2)cc1	760277444	LHDNGKWJCSMEJB-OCCSQVGLSA-N	427.461	1.610	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2ccnn2-c2nc(C)cc(C)n2)cc1	760277828	TWDJRPYOKXLZNF-UHFFFAOYSA-N	437.460	1.006	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCCC(=O)NNc1ccc(C(F)(F)F)nn1	760920811	CTKSFPVTDVKSQX-LLVKDONJSA-N	446.430	1.844	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	761783301	QHCJIXNBHFSVFW-QGZVFWFLSA-N	426.473	1.596	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(CSC)cc2)cc(OC)c1OC	763539029	HQOSIOVWDRMKFE-UHFFFAOYSA-N	433.486	1.975	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)COc2cccc(C(F)(F)F)c2)c(OC)n1	763638609	CUVNCTLDKCUSGQ-UHFFFAOYSA-N	442.350	1.283	50	20	IDGD	
O=C(COc1cccc(C(F)(F)F)c1)NNC(=O)C(=O)Nc1ccccc1-n1ccnn1	763638629	DEMQNZWNRALPAY-UHFFFAOYSA-N	448.361	1.451	50	20	IDGD	
CCOC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2CC)cc1	763713306	XNJHUWRAXAVLPU-UHFFFAOYSA-N	428.445	1.982	50	20	IDGD	
O=C(NNC(=O)c1cc2c(s1)CCC2)C(=O)Nc1cccc(C(=O)N2CCOCC2)c1	763783876	QFBKZFQZCXBIFF-UHFFFAOYSA-N	442.497	1.109	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccc(OCC(F)(F)F)cc1	763840576	VABRNHFQALNTEA-UHFFFAOYSA-N	429.326	1.932	50	20	IDGD	
C[C@H](c1cccc(NC(=O)C(=O)NNC(=O)Cc2c[nH]c3ccccc23)c1)N1CCOCC1	763861396	QHLVLPMWXQTPKE-MRXNPFEDSA-N	449.511	1.890	50	20	IDGD	
CN(C)CCC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccc(Cl)cc2)cc1	763933450	XYQIMTXGXFEFKP-UHFFFAOYSA-N	445.907	1.559	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)Cc2ccc(Cl)cc2)c(F)cc1F	763936350	GRZJOAPOHZCFMH-UHFFFAOYSA-N	425.775	1.733	50	20	IDGD	
Cc1ccc(-n2cc(C)cn2)c(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)c1	763996148	CDBRVCOBZZKBQV-UHFFFAOYSA-N	445.277	1.979	50	20	IDGD	
CC[C@@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(OCC(=O)N(CC)CC)c(Cl)c1	764081576	IENPUGOSYKSVAH-GFCCVEGCSA-N	426.901	1.719	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)nc1)C(=O)Nc1cc(N2CCNC2=O)ccc1Cl	764100210	IWPYZGHVEUQHEQ-UHFFFAOYSA-N	437.243	1.318	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(-n3ccnn3)c2)o1	764138728	ITJSARFOMREKGG-UHFFFAOYSA-N	425.449	1.102	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)cc1	764245341	QMRBQJAPJRHPAV-UHFFFAOYSA-N	443.485	1.189	50	20	IDGD	
O=C(NNC(=O)c1cccc2ncccc12)C(=O)Nc1ccccc1S(=O)(=O)C(F)F	764259421	GXLVIIWPBJAYNO-UHFFFAOYSA-N	448.407	1.631	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1cccc(OC[C@@H]2CCCO2)c1	764277183	IYRGCBZNDDCEDR-INIZCTEOSA-N	429.429	1.115	50	20	IDGD	
CCC(C)(C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2O)cc1	764280401	OJUDENSQLDREOW-UHFFFAOYSA-N	442.472	1.476	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc(F)cc3)n[nH]2)cc1OC	764379358	XBYBBKFBQJFYRA-UHFFFAOYSA-N	427.392	1.633	50	20	IDGD	
COC(=O)c1cc(F)ccc1NC(=O)C(=O)NNC(=O)c1cc(-c2cccs2)[nH]n1	764383185	XSMXHHQUNKKIJY-UHFFFAOYSA-N	431.405	1.464	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)c(F)c1	764387264	HUIRIAHYJBNMKM-UHFFFAOYSA-N	443.366	1.541	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(C(=O)NC2CCCCC2)cc1C	764399597	KSKRJTQFPSSGEZ-HNNXBMFYSA-N	448.520	1.195	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CSc2ccccc2O)cc(Cl)c1OCC(N)=O	765248089	FNXJLXIJEJRTSN-UHFFFAOYSA-N	439.877	1.472	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2ccc(Cl)c(S(=O)(=O)N3CCCCC3)c2)n[nH]1	765584108	XSENTPVLMDRPMU-UHFFFAOYSA-N	425.898	1.621	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)COC/C=C/c3ccccc3)CC2)cc1	765747569	DRLANUIOTXEEJN-VMPITWQZSA-N	436.556	1.990	50	20	IDGD	
CN1CCO[C@H]([C@H](NC(=O)NN[C@@]2(C)CCS(=O)(=O)C2)c2ccc(Cl)cc2)C1	766319476	LVDVNCZDFSOVHJ-JZXOWHBKSA-N	430.958	1.093	50	20	IDGD	
NC(=O)COc1ccc(Cl)cc1S(=O)(=O)NNC(=O)c1ccc(Cl)cc1F	766324303	ZITNSLDYTARHJB-UHFFFAOYSA-N	436.248	1.620	50	20	IDGD	
COc1ccc(-c2ncc(C(=O)NNC(=O)CNC(=O)c3ccco3)s2)cc1OC	766573266	YFDWAIGWZLURSR-UHFFFAOYSA-N	430.442	1.611	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)c(C)n1C(C)C	766640664	DWRITAPYOOJNCT-UHFFFAOYSA-N	425.533	1.905	50	20	IDGD	
O=C(NNC(=O)c1cccc(Br)c1)NC1CCN([C@H]2CCC[C@@H]2O)CC1	767958917	LCLRFDXWBRKJFK-HOTGVXAUSA-N	425.327	1.771	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)CCNS(=O)(=O)c3cccnc3)n[nH]2)cc1C	768254656	CATDNAJUJIYLHY-UHFFFAOYSA-N	442.501	1.218	50	20	IDGD	
CC(C)C[C@H](C(=O)NNC(=O)c1ccc2c(c1)OCCO2)N1C(=O)[C@@H]2CC=CC[C@H]2C1=O	770417954	NTUREXYTBCLDMS-BRWVUGGUSA-N	441.484	1.585	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)N[C@@H]1CC(=O)N(c2c(F)cccc2F)C1	771435363	QZWHFFOKUWRBEO-SECBINFHSA-N	435.343	1.328	50	20	IDGD	
CC(C)[C@@H]1C[C@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)CCO1	772622062	SXWWAFYFEVGVPT-AEFFLSMTSA-N	438.550	1.619	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)C(=O)Nc2ccc(F)cn2)c2ccccc2c1=O	773526246	ZPVKACXNGFGQMV-UHFFFAOYSA-N	440.435	1.521	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)N2CCC(C(=O)NCCCSC#N)CC2)cc1	773570254	BMKUPQPXMRGZMO-UHFFFAOYSA-N	439.559	1.985	50	20	IDGD	
C[C@H]1CN(C(=O)c2ccc(NC(=O)C(=O)NNc3cnc4ccccc4n3)cc2)C[C@H](C)O1	773719724	YTBZNFUOVIPLNI-GJZGRUSLSA-N	448.483	1.961	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2ccc(C(=O)N3CCC[C@@H](C)C3)cc2C)n1	773731582	SANKTOFHFQKJSO-CYBMUJFWSA-N	426.477	1.748	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(=O)n(CC(=O)NNc2ncc(Cl)cc2Cl)c1	775264218	LEEHFFJULXZJRX-UHFFFAOYSA-N	448.332	1.724	50	20	IDGD	
Cc1cc(C(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)c2c(C)nn(C)c2n1	776206597	VUJLEEHHSLANED-UHFFFAOYSA-N	445.524	1.834	50	20	IDGD	
CC(=O)c1cccc(O[C@@H](C)C(=O)N2CCN(S(=O)(=O)CBr)CC2)c1	777778989	CEUMWFOXJLGEIY-ZDUSSCGKSA-N	433.324	1.483	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)[C@H](CSC)N2C(=O)[C@H]3CCCC[C@@H]3C2=O)nc1C	778427965	GZGCKATYQQTXOV-YDHLFZDLSA-N	449.533	1.312	50	20	IDGD	
CCOc1ccc(OCc2ccc(C(=O)NNC(=O)Cn3ncn(C)c3=O)cc2)cc1	778524581	NUSBCGJCOFMJPQ-UHFFFAOYSA-N	425.445	1.021	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)C[C@@H](NC(=O)c3ccc(O)cc3)c3ccccc3)nc21	780509321	GXJBWMQHCORDLW-QGZVFWFLSA-N	447.455	1.779	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)cc1)C(=O)Nc1cccc(N2C(=O)c3ccccc3C2=O)c1	782833867	MKQXPYOHNGYYEB-UHFFFAOYSA-N	444.403	1.593	50	20	IDGD	
Cc1cnn(-c2ccc(C(N)=O)cc2NC(=O)C(=O)NNC(=O)Nc2ccccc2C)c1	783410833	LEOBGQAMOPQWER-UHFFFAOYSA-N	435.444	1.379	50	20	IDGD	
CC(=O)N1CCN(Cc2ccccc2NC(=O)C(=O)NNc2ccc(F)cc2C)CC1	783444129	FCPRKCZUFJWJCI-UHFFFAOYSA-N	427.480	1.880	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)[C@H]3CO[C@@H](C)C3)c2)cc1	784142963	DBRYMQUNLVRONG-DZGCQCFKSA-N	433.486	1.682	50	20	IDGD	
CN1CCC[C@H](N(C)C(=O)c2ccc(NC(=O)C(=O)NNc3cccnc3Cl)cc2)C1	784848242	HZXAVVPGRLBEHU-INIZCTEOSA-N	444.923	1.983	50	20	IDGD	
COC(=O)c1cccc(NC(=O)C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)c1	785100196	STAGSNGYBAOJRO-UHFFFAOYSA-N	432.383	1.725	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2ccc(N3C[C@H](C)O[C@H](C)C3)nc2)n1	785226925	XJPKYUYRHVNGKK-GASCZTMLSA-N	442.524	1.413	50	20	IDGD	
CCNC(=O)Nc1ccc(C)c(NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c1	786404369	LLEPQRDGKMBEGS-UHFFFAOYSA-N	437.460	1.850	50	20	IDGD	
CC(C)(O)C(=O)NNC(=O)c1cc(Br)ccc1I	787947073	ISDCWBPDBRBQBQ-UHFFFAOYSA-N	427.036	1.586	50	20	IDGD	
CCOC(=O)c1cnn(-c2ccc(C(=O)NNC(=O)C(C)(C)O)cc2)c1C(F)(F)F	787947423	OBSKDPVAEHBBEB-UHFFFAOYSA-N	428.367	1.600	50	20	IDGD	
Cc1cc(C#N)ccc1S(=O)(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	788916514	PLGIMIDOILEWMJ-UHFFFAOYSA-N	437.522	1.665	50	20	IDGD	
CCCOc1cc(OC)ccc1C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	789213672	UJGCENOUJGVALY-IBGZPJMESA-N	444.440	1.628	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)c1nnn(Cc2ccc(F)cc2F)c1C	790114778	UKKDHYVNKQGGCJ-UHFFFAOYSA-N	431.399	1.762	50	20	IDGD	
COc1ccc(Cn2cc(NC(=O)C(=O)NNC(=O)c3cccc(Cl)c3)cn2)cc1	793021767	IYXQTHXOGQNEMW-UHFFFAOYSA-N	427.848	1.993	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)nc1Br	793024193	COSYGTMWHDFLKO-UHFFFAOYSA-N	430.262	1.893	50	20	IDGD	
COc1c(NC(=O)C(=O)NNc2ccc(C(F)(F)F)cn2)cc(Cl)cc1C(N)=O	793029402	OUEFDXAGBGOKOT-UHFFFAOYSA-N	431.758	1.943	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)[C@@]1(C)CCN(C(=O)OCc2ccccc2)C1	793784603	XWDSOARBTOJOCI-NRFANRHFSA-N	434.493	1.707	50	20	IDGD	
C[C@](O)(CSc1cccc(F)c1)C(=O)NNC(=O)c1csc(N2CCOCC2)n1	794782262	WUGQTIGATVQTFJ-SFHVURJKSA-N	440.522	1.423	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)OC)c(OC)c2)cc1OC	796999406	KVSRRMAUMIOASG-UHFFFAOYSA-N	445.428	1.289	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)[C@@](C)(NC(C)=O)c1ccc(S(C)(=O)=O)cc1)c1ccccc1	797449368	OAFIEZYEPFQFGV-UGKGYDQZSA-N	445.541	1.783	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2CCN(c3ccc(F)c(F)c3)C2=O)cc1C	798308201	SVUPLZQWLRVDOA-OAHLLOKOSA-N	430.411	1.721	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NC2CCN(c3nccs3)CC2)cc(OC)c1OC	798509790	XTTQQBHSOUSBIO-UHFFFAOYSA-N	435.506	1.782	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1C(=O)c2cc(F)ccc2S1(=O)=O	799907707	HYBKQQKRXVGUKR-UHFFFAOYSA-N	441.824	1.093	50	20	IDGD	
Cc1ccc(C2=NO[C@H](CNC(=O)NNc3ccc(S(=O)(=O)NC(C)C)cn3)C2)cc1	800754226	QWJXQVXTVKIFIA-INIZCTEOSA-N	446.533	1.896	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)NC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1	802330558	CALWHJGRIKTMIC-MRXNPFEDSA-N	440.456	1.533	50	20	IDGD	
CCCN(NC(=O)Cc1ccc(S(=O)(=O)N2CCOCC2)s1)C(=O)OC(C)(C)C	804594386	XYPHNEOJKFSWHI-UHFFFAOYSA-N	447.579	1.990	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)[C@@H]1CCCN(S(=O)(=O)Cc2ccccc2)C1	804956433	NCYLYKOPYSTMRX-QGZVFWFLSA-N	441.517	1.347	50	20	IDGD	
C[Si](C)(C)c1ccc(CC(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1	809982327	BSEITIMWVZQECA-UHFFFAOYSA-N	439.997	1.536	50	20	IDGD	
COc1ccc(CN2C[C@H](C(=O)NNc3ccc(S(=O)(=O)N(C)C)cc3)CC2=O)cc1	812728937	FRNGHJQMDXVSPM-MRXNPFEDSA-N	446.529	1.437	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Cn2cc([N+](=O)[O-])c(=O)c3ccccc32)cc1OC	813578829	HJFUAHDWEXCHQE-UHFFFAOYSA-N	426.385	1.388	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1nc(CC(F)(F)F)cs1	815565900	DCIWCXZDTAESON-QMMMGPOBSA-N	434.371	1.940	50	20	IDGD	
COC(=O)c1cccc(C#Cc2cccc(NC(=O)C(=O)NNC(=O)[C@H]3CCCO3)c2)c1	815779451	GOHZMYMYWXVDLY-LJQANCHMSA-N	435.436	1.138	50	20	IDGD	
Cc1nn(C)c(Br)c1C(=O)NNC(=O)[C@H]1CCCN(C(=O)OC(C)(C)C)C1	816510227	PQBUYFJBANJOHQ-NSHDSACASA-N	444.330	1.899	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)c1ccc2c(c1)C(=O)N(Cc1ccco1)C2=O	825615173	LKSNWBFFJKBFJJ-UHFFFAOYSA-N	448.435	1.958	50	20	IDGD	
O=C(Cc1cccc2ccccc12)NNC(=O)c1cnc2c(c1)c(O)nc(=O)n2C1CC1	880470907	RFFVTQGIZTVLCQ-UHFFFAOYSA-N	429.436	1.989	50	20	IDGD	
Cn1cc(/C=C(/C#N)C(=O)Nc2cc(Cl)ccc2N2CCOCC2)c(=O)n(C)c1=O	884057850	SLELOLLDOAAWTB-LCYFTJDESA-N	429.864	1.120	50	20	IDGD	
CCN(CC(=O)N[C@H]1CCS(=O)(=O)C1)C(=O)/C(C#N)=C\c1cc(C)n(CC(C)C)c1C	912663489	GSNXSYDOABMDIG-SOFZFKJRSA-N	448.589	1.820	50	20	IDGD	
O=C(CCCNS(=O)(=O)c1ccc2c(c1)OCCO2)NNC(=O)c1ccccc1F	913415803	LXFJXOFWEOGOKB-UHFFFAOYSA-N	437.449	1.117	50	20	IDGD	
COCCNS(=O)(=O)c1cccc(C(=O)NNC(=S)Nc2cc(C)ccc2C)c1	913898165	VMHSRAGPLPKYLV-UHFFFAOYSA-N	436.559	1.860	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cc(C3CC3)nc3c2c(O)nc(=O)n3C)cc1OC	914109938	SGEDENFEOVXALZ-UHFFFAOYSA-N	439.428	1.004	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)c1cccc(S(=O)(=O)NCC2CC2)c1	914595346	BSGIEYKMQUNVCQ-UHFFFAOYSA-N	433.486	1.224	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)NC[C@@H](c1cccs1)N1CCOCC1	915893708	PFITXGHAESKYOE-INIZCTEOSA-N	429.502	1.402	50	20	IDGD	
Cc1ccc(C)n1-c1ccc(C(=O)NNC(=O)NCc2ccc(S(N)(=O)=O)s2)cc1	915906065	GQFUVBDBQZIKEF-UHFFFAOYSA-N	447.542	1.947	50	20	IDGD	
COc1ccccc1C=NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	915915156	QUHUAOCTLGZPHD-UHFFFAOYSA-N	431.514	1.799	50	20	IDGD	
CNS(=O)(=O)Cc1ccc(CNC(=O)NNC(=O)Cc2ccc3ccccc3c2)cc1	916228979	KASHAIDIJKATNR-UHFFFAOYSA-N	440.525	1.962	50	20	IDGD	
CC(=O)Nc1ccc(S[C@@H](C)C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1	917108373	IRFBINAQQDPKLN-LBPRGKRZSA-N	435.527	1.990	50	20	IDGD	
CNC(=O)Cn1cc(NC(=O)/C(C#N)=C\c2cn(CCC#N)nc2-c2ccccc2)cn1	918633717	DZTGVJANVSAQIV-YVLHZVERSA-N	428.456	1.952	50	20	IDGD	
O=C(COC(=O)Cn1ccc2ccc(Cl)cc21)NNC(=O)[C@H]1COc2ccccc2O1	919736840	XWCWYIVWFXRWQU-GOSISDBHSA-N	443.843	1.825	50	20	IDGD	
Cc1cccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)CN3CCCC3=O)c2)c1	920826045	HQFJRQJAMLIYLS-UHFFFAOYSA-N	430.486	1.179	50	20	IDGD	
COc1cccc(C[C@@H](C(=O)NNC(=O)NCCc2cccs2)n2nnnc2C)c1	920859955	ZDQGCWWLXVJSDK-KRWDZBQOSA-N	429.506	1.409	50	20	IDGD	
COCCCNC(=O)NNC(=O)c1ccc2c(=O)n(-c3ccccc3F)c(S)nc2c1	920862279	WFKKQHPXGFJZEY-UHFFFAOYSA-N	445.476	1.794	50	20	IDGD	
CCCNC(=O)NNC(=O)c1cccc(NS(=O)(=O)c2ccc3c(c2)OCCO3)c1	921042798	OMXQPYUSTHVWRM-UHFFFAOYSA-N	434.474	1.613	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)CNS(=O)(=O)c1ccccc1	1317690095	FXIQCTNMOPUULM-UHFFFAOYSA-N	430.511	1.858	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)CCNC(=O)c2ccc(F)cc2)CC1	1318914678	KJTNYPOGNBKRTO-UHFFFAOYSA-N	436.484	1.740	50	20	IDGD	
Cc1c(C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)cnn1-c1ccc(O)nn1	1324279951	CTKWDSIBYIZQSW-UHFFFAOYSA-N	429.387	1.604	50	20	IDGD	
CN1CCc2cc(C(=O)N3CC[C@@]4(C3)CN(C(=O)[C@@H](F)Br)CCO4)ccc21	1777920646	NLOTUQICHROWJX-VQIMIIECSA-N	440.313	1.813	50	20	IDGD	
Cn1ncc2cc(C(=O)N3CC[C@@]4(CN(C(=O)CO[Si](C)(C)C)CCO4)C3)ccc21	1778021084	ISUMOLZYFUGIPG-OAQYLSRUSA-N	430.581	1.868	50	20	IDGD	
Cc1ccc(SCC(=O)N2CC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)cc1	1778091639	WLFWGNPULFBJQX-QFIPXVFZSA-N	448.589	1.290	50	20	IDGD	
CC[S@](=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)Br)C2	1779223843	HLJPIELZOXROJP-SXPIZGJPSA-N	437.400	1.442	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(O)nn1)C2	1780710322	PKSRCFWQPBMTDS-FSPWUOQZSA-N	431.320	1.546	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3c4c(nn3C)CCC4)C2)C1	1782434317	HAKUGICWCIMUFQ-BFUOFWGJSA-N	439.354	1.383	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H]1C[C@@H](O)C1)CCO2	1782866379	RWYMYJYOPUWBRE-GNNUVBFBSA-N	431.439	1.473	50	20	IDGD	
CN(C)CC(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](Br)Cc3ccccc3)C2)C1	1783024056	SZDRGFIOBYNVQW-XLIONFOSSA-N	438.366	1.384	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)/C=N/O[C@H]3CCCCO3)CCO2)C1	1783349551	NGOMCZOXSLOACD-YKUHDHSLSA-N	446.342	1.519	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)CCn3nc(C)cc3C)CCO2)C1	1783355430	RNPBPBKHDYRCGH-QFBILLFUSA-N	441.370	1.893	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(CO)c(F)c3)CCO2)C1	1783536867	HTBKUNAYJPFGGH-KPZWWZAWSA-N	429.286	1.545	50	20	IDGD	
Cc1c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)C(C)(C)CCl)[C@H]3C2)cn2[nH]cnc(=O)c12	1783852412	YTGUBAJLHKPYMI-BPUTZDHNSA-N	449.939	1.189	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)C(=O)c3ccc(Cl)cc3)CCO2)C1	1783870632	DCFFJBMLJKTAQO-HNAYVOBHSA-N	429.300	1.606	50	20	IDGD	
CC(C)(C)OC(=O)CCCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]2C1	1784084142	MAUMTGBGWKKVSW-JONQDZQNSA-N	432.945	1.078	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3cn[nH]c3)[C@H]2C1	1785275849	CLQGRNBRHOCXJR-TUUVXOQKSA-N	427.343	1.353	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](CN)c3ccccc3)[C@H]2C1	1786924897	UHCHYHOEHYFVJJ-ZZAJSIFASA-N	442.387	1.945	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cn3cc(Cl)cn3)[C@H]2C1	1787004981	SYFZQDVMRRUYDG-MHEUCROKSA-N	447.761	1.690	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)c1cn2ncccc2n1	1788017673	JTKNVYJFBNNQPP-UHXUCMFUSA-N	440.273	1.013	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc4n(n3)CCC4)[C@H]2C1	1788413050	RUQRMABJIPKHTO-RMRKRWHISA-N	439.354	1.454	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4nncn4c3)C[C@@H]21	1789868168	PPTNJEMNAPQPKQ-XLPNERPQSA-N	440.331	1.559	50	20	IDGD	
CCOC(=O)O[C@@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)CBr)C[C@@H]21	1790605653	SVKUYGYDVWMYSX-QTVXIADOSA-N	449.342	1.559	50	20	IDGD	
C[C@@H](CN)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C(C#N)=C/c3ccc(F)cc3F)[C@H]2C1	1790694021	BIQVPKNMTJIRJX-IJFVLIARSA-N	432.471	1.446	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc([N+](=O)[O-])o3)C[C@@H]21	1791054485	KDRYNKHVCXHBBI-BLFANLJRSA-N	430.255	1.565	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3n[nH]c4ccccc34)C[C@@H]21	1791056032	MGNMAVNOPJYFNJ-DUPGQFARSA-N	435.322	1.940	50	20	IDGD	
C[C@@H](C(=O)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1)n1cccn1	1791878488	FFEHGUNMEHMABL-INIZCTEOSA-N	432.289	1.572	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cccc([N+](=O)[O-])c1	1792418524	LWVXGDCQIHMFEK-CWPLJXCYSA-N	435.553	1.578	50	20	IDGD	
COC(=O)c1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](O)CCl)c([N+](=O)[O-])c1	1793115012	VTDOMJGZLDAGBE-OQMKEHIESA-N	439.852	1.233	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C[C@H]1OCCc2ccccc21	1793274995	VBGKHOMWIRGNPE-WWWUOXLMSA-N	436.936	1.534	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1n[nH]c3c1CS(=O)(=O)C3)C2	1793681631	YTSNQHMEJWUMFO-GFQSEFKGSA-N	428.942	1.497	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1cc2sccn2c1	1796113213	XXTVJUGYTBGQRC-ZMJPVWNMSA-N	430.299	1.895	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc2c[nH]nc12	1796639777	UJIQTNUFBGVHED-QDMKHBRRSA-N	433.472	1.127	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1snnc1C1CC1	1796707402	HQHGFXMBLBQYOV-KXGXSXBTSA-N	429.340	1.402	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc3nncn3c1)C2	1796892555	PJBWXQZFPOYTLF-FWKYCFCSSA-N	448.487	1.115	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](COC(C)=O)OC(C)=O	1798476719	IBMFTXWGANCXQX-JKJDWNRSSA-N	447.326	1.293	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc3c1NC(=O)C3)C2	1799279306	HGZJTWBTIDCBTA-XBMZAUBUSA-N	440.327	1.621	50	20	IDGD	
C[C@@H](O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C#N)=C/c1ccc(Br)cc1)C2	1800753187	DLSDTKWGEVJPGC-TVGAUJJISA-N	448.317	1.326	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1(c3ccc(O)cc3)CC1)C2	1800753860	ADHAEEIDRJKNIH-VWPFQQQWSA-N	437.334	1.797	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CS[C@@H]1CCCCO1)C2	1800759200	KSXULLXIBPQGKO-CNRIWFPOSA-N	435.384	1.619	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)Br)C2	1800960786	JIZLYELZZYYQMJ-IJOLSIAMSA-N	443.338	1.115	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCc1ccc(O)nn1	1801236470	BRUQCZBUCPGQTP-XGUBFFRZSA-N	425.327	1.927	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cn1ccnn1)C2	1801436365	KPTKMCBPKABWDA-FZBFXSHXSA-N	426.427	1.802	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H]1CCc3ccccc3C1)C2	1802338540	NFPUOLYLIVXKCH-MXEMCNAFSA-N	426.561	1.803	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1	1803139281	NGQQMDINDJBWJB-UWVAXJGDSA-N	441.919	1.957	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)CNC(=O)c2cccnc2)[C@@H]1c1cccnc1	1804368862	HOLKBLVWDUTSBA-KPFFTGBYSA-N	443.935	1.930	50	20	IDGD	
Cc1nc(CC(=O)NC[C@@H]2CCN(C(=O)[C@H](F)Br)[C@@H]2c2cccnc2)no1	1804493223	OJARGBRJSCGQCX-MAZHCROVSA-N	440.273	1.712	50	20	IDGD	
CN[C@H](CC(=O)N1CC[C@H](CNC(=O)[C@](C)(Cl)CCl)[C@@H]1c1cccnc1)C(=O)O	1808294921	CWQCWVSYANPHJD-GTACMHHNSA-N	445.347	1.386	50	20	IDGD	
Cc1[nH]ccc1C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1	1808751087	HBHFOWYMPJIOGI-UZLBHIALSA-N	447.499	1.350	50	20	IDGD	
C=CC[C@H](C(=C)C)C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1810173457	VMWCPSYRIRPZBB-WWNPGLIZSA-N	447.344	1.849	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)[C@@H]2CC=CCC2)[C@H]1c1cccnc1	1810294422	KNUMLXOKZKGGIZ-BLIXFSHQSA-N	448.527	1.756	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)[C@@H]2CC=CCC2)[C@@H]1c1cccnc1	1810294427	KNUMLXOKZKGGIZ-PLMTUMEDSA-N	448.527	1.756	50	20	IDGD	
CCc1cc(C(=O)N2CC[C@H](CNC(=O)[C@@H](Cl)COC)[C@H]2c2cccnc2)nn1C	1813030400	CTXOEULXAMIDID-HHXXYDBFSA-N	433.940	1.951	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2cc(F)cn2C)[C@@H]1c1cccnc1	1813069820	DACIPULMSXSYKP-IIBYNOLFSA-N	444.511	1.252	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@H]1CCc2nc(NC(=O)Cn3cncn3)sc2C1	1815657536	XGXMKVAXTGHFLY-UWVGGRQHSA-N	427.328	1.378	50	20	IDGD	
CN(C)C(=O)NCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCBr)n[nH]1	1816780509	WSAQKJBWTCMJAO-GFCCVEGCSA-N	429.319	1.458	50	20	IDGD	
CC(C)=NO[C@@H](C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1	1817472516	NJBQCZPIJBNVSW-KBXCAEBGSA-N	441.297	1.196	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1ccc(F)cc1	1820554536	CTTVYNUZNXNDGQ-IBGZPJMESA-N	436.252	1.848	50	20	IDGD	
CC(C)(C)n1cc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@H](O)CCl)CC3)nn1	1821631017	VXDRUVHUOKFFOS-BXKDBHETSA-N	426.930	1.315	50	20	IDGD	
CN1C(=O)CC[C@H]1C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@](C)(Cl)CCl)sc2C1	1822870543	SYPDBTMHWLRQCN-NVTQBHAOSA-N	433.361	1.912	50	20	IDGD	
C[C@@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1)C1(O)CCC1	1823737765	XJNLTAFMRMWDDV-PKOBYXMFSA-N	436.597	1.530	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(O)ccc3O)sc2C1	1823759460	DJJSLENFAOIMTH-LLVKDONJSA-N	447.517	1.153	50	20	IDGD	
COC(=O)[C@@H]1CC[C@H](C(=O)N2CCCC[C@H]2C2CCN(C(=O)[C@@H](O)CCl)CC2)C1	1824172579	QQRCYUQSZQGLQV-MHORFTMASA-N	428.957	1.795	50	20	IDGD	
CCc1ncccc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1	1825513823	VHWABGCTHIEKDZ-QHCPKHFHSA-N	449.360	1.871	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CC(F)(F)C(=O)O)CC2	1825999139	QZWWROZNDCRTDQ-JGVFFNPUSA-N	425.841	1.419	50	20	IDGD	
CCc1cc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)no1	1829378404	MJTMSFLDESDMLZ-OAQYLSRUSA-N	439.321	1.464	50	20	IDGD	
C=C[C@H](O)C(C)(C)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H](C)CBr)CCO2)C1	1830540816	TYBFJXSGRZXDJR-DOXZYTNZSA-N	447.370	1.047	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnn3c2CCC3)CC1	1830904212	FMCTYEFPLNHDDR-LJQANCHMSA-N	444.580	1.436	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)NCCC#N)C2)C1	1831646482	LWTXINSKQRCGCY-OXJNMPFZSA-N	428.961	1.132	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCCCCC(=O)OC)C2)C1	1831656351	DGVKWCLTAYDGGS-UWJYYQICSA-N	446.972	1.974	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cn3cnc4ccccc43)C2)C1	1831657326	MYNRJDBUNXTGQD-VGSWGCGISA-N	448.951	1.900	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CN2CCCCC2=O)CC1	1831832330	CFYVQXKWXLZFFR-ROUUACIJSA-N	427.973	1.872	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)[C@H]3CCCCO3)CC2)CC1	1833113621	ONVYSQCZGRTETN-WMLDXEAASA-N	430.387	1.911	50	20	IDGD	
Cc1nscc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)CBr)C2)C1	1833740506	NVBUBIHUIUUQHA-SJKOYZFVSA-N	446.367	1.553	50	20	IDGD	
Cc1cnc(Cl)c(C(=O)N2CCO[C@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)c1	1834560772	WZCCPAZQOFAGMR-QGZVFWFLSA-N	436.723	1.917	50	20	IDGD	
O=C(/C=C/c1ccco1)N1CCOC[C@@]2(C1)CN(C(=O)CCBr)CCO2	1834819225	KQXIJGGUEHGWKQ-OAJJDEHYSA-N	427.295	1.534	50	20	IDGD	
Cc1ccc(F)c(C(=O)N2CCOC[C@]3(CN(C(=O)CCBr)CCO3)C2)c1	1834823683	CJZZRTPZVVWTJF-IBGZPJMESA-N	443.313	1.989	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3[nH]nc4ccncc34)CC2)CC1	1835019138	PLLUMLAJZTXTTQ-KRWDZBQOSA-N	448.955	1.397	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)C(Cl)Cl)CC2)CC1)c1nccc2nc[nH]c12	1835029350	OYJBDQYXTZSCTI-UHFFFAOYSA-N	439.347	1.947	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cn4cccnc4n3)CC2)CC1	1835548207	JSTYQYCZWXGYBW-KRWDZBQOSA-N	432.956	1.932	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)c1ccc2[nH]ccc2n1	1835550750	MHQVNSITZIJRGI-LJQANCHMSA-N	433.940	1.348	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3ccc(CO)o3)CC2)CC1	1835928713	KRZSUARMOUJKBF-QGZVFWFLSA-N	427.929	1.211	50	20	IDGD	
CCn1nc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)c2ccccc21	1836342706	FNGAZJLUMXIVHG-XLIONFOSSA-N	438.887	1.661	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)/C=C3\C(=O)Nc4ccccc43)CCO2)C1	1837325582	WYHYKXYFXINCES-LGQHBQANSA-N	447.919	1.496	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)c3ccsc3)CC2)CC1	1837409715	RSUAKUIDGCOJEM-UHFFFAOYSA-N	436.578	1.733	50	20	IDGD	
O=C(c1[nH]cc2c1CCC2)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1838454822	UPLSFZQSKVMHOG-QAPCUYQASA-N	444.301	1.264	50	20	IDGD	
COc1ccc2[nH]cc(C(=O)N3CCO[C@@]4(COCCN(C(=O)[C@H](F)Cl)C4)C3)c2n1	1838487666	CSYNAOKDXCNMLR-LPHOPBHVSA-N	440.859	1.176	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)CNC(=O)C(F)(F)F)CC2)CC1	1838637077	MLTYOVZBFZCHSM-AWEZNQCLSA-N	441.878	1.681	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)C3(F)CCC3)CC2)CC1	1838789333	OOJITKIKUDYOHP-UHFFFAOYSA-N	426.533	1.250	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1839072097	ZYBBZMRPKCMBJY-FQEVSTJZSA-N	440.327	1.971	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4nccnc4c3)C2)C1	1839144713	JEEGSEGMNSWXLH-IERDGZPVSA-N	432.908	1.717	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3c(F)ccc(O)c3F)C2)C1	1839146905	ABCOTTLFWNFVTK-BUXKBTBVSA-N	432.851	1.758	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(C#N)c3)C2)C1	1839154698	UPOAAUWLNJLRBX-PMACEKPBSA-N	440.327	1.865	50	20	IDGD	
C[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1)c1ccc(O)cc1	1839171393	UKBIOEFRXBBEND-DJJJIMSYSA-N	431.316	1.756	50	20	IDGD	
O=C(CCc1ccco1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839197760	HWRYJCBQVYBWIZ-DOTOQJQBSA-N	433.274	1.359	50	20	IDGD	
CCOc1cccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)c1O	1839426475	XIPNSEUUKQQUFW-QFBILLFUSA-N	430.860	1.395	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc4ncccc4[nH]3)CCO2)C1	1839491416	NQMYIBLPHRIBTI-OAQYLSRUSA-N	434.924	1.898	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)/C=C/c3ccoc3)C2)C1	1840031128	GILRIOLRQHJXJR-RNYZBBNUSA-N	427.295	1.533	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(F)ccc3F)C2)C1	1840154360	VEANBQRPOATYEY-KXBFYZLASA-N	432.851	1.289	50	20	IDGD	
COc1cc(CCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)ccn1	1840186963	RXLYFTCUTBIZML-LJQANCHMSA-N	446.331	1.283	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)/C=C/c3cnc[nH]3)CCO2)C1	1840344297	DEAJLCOJOPWTKZ-AIWSSPEVSA-N	441.326	1.053	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C1(C#N)CCC1)CCO2	1840815674	DPKLERTWNCXWIU-KBXCAEBGSA-N	428.327	1.310	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC2(CCCN2C(=O)c2cncc(S(C)(=O)=O)c2)C1	1842189687	IRKLPGDZOCLEME-LLVKDONJSA-N	430.324	1.086	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2ccc(F)c(C)n2)C1	1842208508	OAHRLXZMIGKOEK-AFUMVMLFSA-N	426.452	1.480	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)c2cnoc2C)C1	1842488228	WJXVKIKYQJHABU-UHFFFAOYSA-N	428.401	1.947	50	20	IDGD	
COc1ccc(C(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)c(Cl)c1	1844265621	XANLRQFJKVUSIR-UHFFFAOYSA-N	443.891	1.478	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)c1nc(-c3ccccc3)ns1)C2	1846384508	AYLZAXGZBXCVEA-UHFFFAOYSA-N	442.545	1.395	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)c1ccc(OC(F)(F)F)cc1)C2	1846385682	IVIIXIJFXPXIIP-UHFFFAOYSA-N	442.438	1.775	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CCNS(=O)(=O)c2ccc3c(c2)CCCC3)cc1	16511319	RIYUDWKKVQPQFP-UHFFFAOYSA-N	431.514	1.704	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2cccc(C(=O)NNC(=O)c3ccccc3O)c2)C[C@H](C)O1	17573704	FPJYJNPIZWPDFP-KBPBESRZSA-N	433.486	1.265	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)CN1C(=O)N[C@@](C)(c2ccc(C)cc2)C1=O	24627076	ULUKZOWNYTVXMX-NRFANRHFSA-N	444.875	1.885	50	20	IDGD	
CCOc1ccc(/C=C(/C#N)C(=O)OCC(=O)Nc2ccccc2S(N)(=O)=O)cc1	725917389	MQEMQIIYJLAAMI-PTNGSMBKSA-N	429.454	1.822	50	20	IDGD	
CS(=O)(=O)Cc1nc2ccccc2n1CC(=O)NNc1nc(-c2ccncc2)no1	726369538	BDBXQTUBOSCVJZ-UHFFFAOYSA-N	427.446	1.169	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3ccc([N+](=O)[O-])s3)cc2)CC1	728213985	UALCSWAWJUVDJQ-UHFFFAOYSA-N	425.492	1.349	50	20	IDGD	
O=C(COC(=O)Cc1ccc(-n2cccc2)cc1)NNC(=O)[C@H]1COc2ccccc2O1	728323947	NMDGAWUMBSRRPZ-HXUWFJFHSA-N	435.436	1.550	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)c2cc(Br)c[nH]2)ccc1OCC(=O)OC	728513391	GWLBBCWJUICKBE-UHFFFAOYSA-N	440.250	1.803	50	20	IDGD	
CC(C)(C)CC(=O)NNC(=O)NCc1ccc(S(=O)(=O)NC[C@H]2CCCO2)cc1	728595727	SSNCBLGYDFKTJP-OAHLLOKOSA-N	426.539	1.411	50	20	IDGD	
CCn1cc(Br)cc1C(=O)OCC(=O)NNC(=O)Cc1nc(C)cs1	728730351	MXTWXMMQBCPPGK-UHFFFAOYSA-N	429.296	1.582	50	20	IDGD	
O=C(CCN1C(=O)[C@H]2CCCC[C@H]2C1=O)NNc1ccc(S(=O)(=O)C(F)F)cc1	728976544	VANRZSYVZDSTAO-OKILXGFUSA-N	429.445	1.691	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)c1nccnc1C(=O)NCc1ccc(F)cc1	729451965	LVRVVEZRINUZHE-UHFFFAOYSA-N	446.442	1.962	50	20	IDGD	
CC(C)NC(=O)CCCC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	729509868	LDIDSAPPPVSACM-UHFFFAOYSA-N	438.550	1.317	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN(S(=O)(=O)Cc2ccccc2)C1)c1ccc(Cl)nc1	730531135	JQCUPHHWMKXNMT-MRXNPFEDSA-N	436.921	1.738	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)c2ccccc2S(=O)(=O)CC(F)F)cc1	731271228	VNBUQLARANTWCF-UHFFFAOYSA-N	440.424	1.652	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1)[C@@H]1COc2ccccc2O1	731957683	WSZWQLISZIMUMV-RISCZKNCSA-N	446.441	1.248	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)CCCNS(=O)(=O)c1cccc(C(F)(F)F)c1	732084593	RISHMKLSULMTHU-UHFFFAOYSA-N	433.412	1.257	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)c1ccc(N2CCOCC2)nc1	734251960	VLHMKQITCLTNRL-UHFFFAOYSA-N	433.534	1.752	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)CCCOCc2ccccc2)CC1	735117291	PAWIZRRCRHWOOI-UHFFFAOYSA-N	447.561	1.458	50	20	IDGD	
CC[C@H](C)[C@H](NC(=O)N1CCCC1)C(=O)NNC(=O)c1nn(CC)c(=O)c2ccccc12	736066337	BOXKGUAWHVTLMZ-YOEHRIQHSA-N	442.520	1.398	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)[C@H]2CC[C@@H](C(F)(F)F)NC2=O)cc1C	736775040	ITEWKWOIXBGNNT-CABZTGNLSA-N	435.424	1.380	50	20	IDGD	
COc1ccc(-n2cnnc2SCC(=O)NNC(=O)COCc2ccccc2)cc1	737629409	PSIYAZGITKSWDU-UHFFFAOYSA-N	427.486	1.732	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(CC(=O)NNC(=O)c2ccc(Cl)cc2Cl)C(=O)C1	741208347	YBNCJKZFSBRAAO-UHFFFAOYSA-N	445.303	1.834	50	20	IDGD	
CCS(=O)(=O)NCCCNC(=O)NNC(=O)Nc1cc(Cl)c(OC)cc1OC	743593349	RFPDWHLUUIJTJN-UHFFFAOYSA-N	437.906	1.022	50	20	IDGD	
COC(=O)c1cc(C(=O)NNC(=O)c2cc(Br)ccc2O)cc([N+](=O)[O-])c1	743731795	ZPKUPWLHXBPONZ-UHFFFAOYSA-N	438.190	1.924	50	20	IDGD	
COc1ccc(N2C[C@@H](C(=O)NNC(=O)Nc3ccc(S(C)(=O)=O)cc3)CC2=O)cc1	743830383	TVYUHLGUVCBGDK-ZDUSSCGKSA-N	446.485	1.305	50	20	IDGD	
CC(C)[C@H](NC(=O)c1cccs1)C(=O)OCC(=O)NNC(=O)c1ccc(C#N)cc1	744612841	SESXWCXIEFUHBV-KRWDZBQOSA-N	428.470	1.379	50	20	IDGD	
NS(=O)(=O)c1ccc(C(=O)NNC(=O)COc2ccccc2-c2ccccc2)s1	745474688	MUZBFVFEECFIRG-UHFFFAOYSA-N	431.495	1.903	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)N[C@@H]1CC(=O)N(CCOc2ccccc2)C1	745847561	OWJGRYHXUMVZFF-JKSUJKDBSA-N	444.463	1.603	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)[C@H]1CCCN(C(=O)NC2CCCC2)C1	746201225	UMWFBDWQMZVBRO-HNNXBMFYSA-N	449.577	1.935	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CC(=O)NNC(=O)CNC(=O)c1cccnc1)c1ccccc1	746302155	YUNCETIIULRCKU-KRWDZBQOSA-N	441.488	1.615	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)CN1CCN(C(=O)OCc2ccccc2)CC1	747385872	GEQDFRFNNDJPNI-UHFFFAOYSA-N	426.473	1.411	50	20	IDGD	
COC(=O)[C@H](O)C1CCN(C(=O)CCC(=O)C(C#N)=C2N(C)c3ccccc3N2C)CC1	747521511	VCIZSJWIDZWZEH-OAQYLSRUSA-N	440.500	1.430	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2c(Cl)cccc2Cl)cnc2c1c(=O)n(C)c(=O)n2C	747855972	QMAGGRPKEIMAFC-UHFFFAOYSA-N	436.255	1.322	50	20	IDGD	
C[C@@H]1CCc2c(sc3nc(CCC(=O)NNC(=O)C(=O)N4CCCC4)nc(O)c23)C1	748247437	NXIJCSBVJWRUHH-LLVKDONJSA-N	431.518	1.224	50	20	IDGD	
Cc1cccc(NC(=S)NNC(=O)Cc2c(C)nn(-c3cncc4nnnn34)c2C)c1	749905153	YWJQTRGMYYBVKH-UHFFFAOYSA-N	436.505	1.191	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)c1ccc(I)c(Cl)c1	749950765	WIHKWXWKYRYZFF-UHFFFAOYSA-N	447.616	1.729	50	20	IDGD	
CNS(=O)(=O)c1ccc(CCC(=O)NNC(=O)c2cc3ccccc3cc2O)cc1	751025218	KDJDCZNZEXJJFI-UHFFFAOYSA-N	427.482	1.847	50	20	IDGD	
CC(C)(C)NC(=O)CN1CCC(CNC(=O)NNC(=O)c2cc3c(s2)CCC3)CC1	751112094	SCYSMAYLXDMUAE-UHFFFAOYSA-N	435.594	1.808	50	20	IDGD	
N#Cc1ccc(NNC(=O)[C@H]2CC(=O)N(c3cccc(S(N)(=O)=O)c3)C2)cc1Cl	753302085	FMZHVRSOFCKNKP-LBPRGKRZSA-N	433.877	1.355	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC(C(=O)NNc3cc(Cl)nc(N)n3)CC2)cc1C	753457609	NGQOZBUEBTUXDQ-UHFFFAOYSA-N	438.941	1.873	50	20	IDGD	
C[C@@H](C=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O)Cc1ccc(C(C)(C)C)cc1	754714525	UPABEXLUXIAXBO-CQSZACIVSA-N	431.562	1.849	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)CNC(=O)c2ccccc2C(F)(F)F)nc2ccccc21	755044813	AOLSCHHVSMVHSO-UHFFFAOYSA-N	433.390	1.712	50	20	IDGD	
CCc1nn(C)c(CC)c1CNC(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12	755085294	UFDJXXAPWJXDOY-UHFFFAOYSA-N	439.520	1.980	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)Nc2ccc3nc(N4CCOCC4)sc3c2)n1	755529399	BUTIGURRKPINKI-UHFFFAOYSA-N	429.506	1.799	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)Nc2cccc(Cn3nc4ccccn4c3=O)c2)c1	755938638	WOEQQJJOCUNKQB-UHFFFAOYSA-N	427.424	1.882	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)[C@](C)(O)CN2Cc3ccccc3C2=O)n[nH]1	756882645	YPDCJCLALIUYPU-HSZRJFAPSA-N	449.467	1.253	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c(C)n1	757681355	CEZNGGAAPJNOLS-UHFFFAOYSA-N	433.490	1.650	50	20	IDGD	
O=C(CC(F)(F)F)NNC(=O)NCCCN(C1CC1)S(=O)(=O)c1cccc(F)c1	757689831	SSQOKCBDXSPMDV-UHFFFAOYSA-N	440.419	1.652	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1ccc(NC(=O)CC#N)cc1	757693474	PDDUNBCJNIXYCM-UHFFFAOYSA-N	444.831	1.819	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)CC[C@H](NC(=O)OC(C)(C)C)c1ccccc1	758046508	SWYCEDDKQZKPGL-ZFWWWQNUSA-N	442.538	1.118	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)[C@H]2COc3ccc(Br)cc32)c2ccccc2c1=O	758071621	LYLMUXKSFPOEEG-AWEZNQCLSA-N	443.257	1.633	50	20	IDGD	
O=C(c1cc(Cl)cc([N+](=O)[O-])c1)N1CCN(S(=O)(=O)CBr)CC1	758534362	FYMULGXUFICWBM-UHFFFAOYSA-N	426.676	1.688	50	20	IDGD	
O=C([C@@H]1CC(=O)N(c2ccc(F)cc2)C1)N1CCN(S(=O)(=O)CBr)CC1	758536430	WDYYWYOKGCRSEQ-GFCCVEGCSA-N	448.314	1.005	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NCCSCc1ccnc(Cl)c1	758676097	QTZHAPWHOXHQAU-UHFFFAOYSA-N	427.939	1.790	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)N=c1cc[nH]cc1I	760034892	QNZHMOIHTKRWNE-UHFFFAOYSA-N	437.197	1.211	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2ccc(Cl)nc2)nc1I	761135817	NZCAOMYOSPYUEG-UHFFFAOYSA-N	432.605	1.818	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)NCCNC(=O)c1ccc(C)c(F)c1	761656082	XZPOQQYCAGGNTF-UHFFFAOYSA-N	434.493	1.995	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)N[C@@H]2CC[C@H]3SCCS[C@H]23)cc1	762636198	YKLTZPPUYCLGTB-MGPQQGTHSA-N	430.577	1.805	50	20	IDGD	
CC(C)N(C)S(=O)(=O)c1ccc(C(=O)NNc2nccc(N3CCOCC3)n2)cc1	762852794	ZTYNYHWBDGJFLA-UHFFFAOYSA-N	434.522	1.099	50	20	IDGD	
CCOc1cc2c(cc1NC(=O)C(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)O[C@@H](C)C2	763444104	RLRVSZBAIMTWJZ-NSHDSACASA-N	428.401	1.717	50	20	IDGD	
COC(=O)c1cc2cc(NC(=O)C(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)ccc2o1	763471161	DRQYBMQUNKWGRX-UHFFFAOYSA-N	426.341	1.527	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccccc2-n2c(C)cnc2O)cc1OC	763551924	UJRBFSZYHPFRCU-UHFFFAOYSA-N	439.428	1.303	50	20	IDGD	
Cc1cc(C)n(-c2cccc(NC(=O)C(=O)NNC(=O)[C@H]3COc4ccccc4O3)c2)n1	763570348	DQEIRWMMMSCYFD-LJQANCHMSA-N	435.440	1.415	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(-n3cccn3)c(F)c2)cc1	763659151	JTLDFGVKKXEZMW-UHFFFAOYSA-N	427.392	1.185	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(N3CCCCC3=O)c2)cc1C	763667673	UUYZIANQEFGELP-UHFFFAOYSA-N	438.484	1.985	50	20	IDGD	
COC(=O)COc1cccc(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)c1	763686757	TVABHBUXRGFNFB-UHFFFAOYSA-N	435.820	1.057	50	20	IDGD	
O=C(CN1CCCc2ccccc21)NNC(=O)C(=O)Nc1cccnc1Br	763729105	UNJYLGBUGCJKLE-UHFFFAOYSA-N	432.278	1.383	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2ccc3nc(C(F)F)[nH]c3c2)c1	763771120	GACGGWBAZCLGPL-UHFFFAOYSA-N	433.371	1.917	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)C(=O)Nc2ccc(OC(F)(F)F)cc2)c2ccccc2c1=O	763790182	GIGLXMYWKKBFJH-UHFFFAOYSA-N	449.345	1.232	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(C(C)(C)C)cc2)cc1-n1cnnn1	763799484	TWLZWWWXSLUHJO-UHFFFAOYSA-N	437.460	1.368	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])ccc1OC(C)C	763802796	HAGCKMLKBAIZLT-UHFFFAOYSA-N	430.417	1.855	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)c1ccc(NC(=O)Nc2ccccc2)cc1	763824746	MKORMGVYCKCGDP-UHFFFAOYSA-N	432.440	1.917	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)C(=O)N(CC2CC2)C3=O)cc1	763829139	BNWUCAKPQQRNEY-UHFFFAOYSA-N	434.452	1.655	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(NC(=O)CC)cc2)cc1	763859739	FPGJDROFEGCSRY-AWEZNQCLSA-N	442.472	1.987	50	20	IDGD	
NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(COc3ccccc3)o2)c(F)c1	763955786	RDLARRSPWLTZSB-UHFFFAOYSA-N	440.387	1.496	50	20	IDGD	
CCOC(=O)[C@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2C)cc1	763960933	BBAXIFJTKZNHAZ-AWEZNQCLSA-N	440.456	1.076	50	20	IDGD	
CC(C)Oc1ccc(C#N)cc1NC(=O)C(=O)NNC(=O)c1cc(Br)cn1C	764001895	GOYTWCSXKAHLFZ-UHFFFAOYSA-N	448.277	1.846	50	20	IDGD	
C#CCOc1ccc(F)cc1NC(=O)C(=O)NNC(=O)c1cc(Br)cn1C	764004780	LVAJGSJCZCEMIT-UHFFFAOYSA-N	437.225	1.338	50	20	IDGD	
COC(=O)[C@H]1CN(C(=O)C(=O)NNC(=O)c2ccc(Cl)cc2OC)c2ccccc2O1	764011299	GCSMYWKTJMLUQR-MRXNPFEDSA-N	447.831	1.077	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1cc(NC(C)=O)c(F)cc1F	764013566	ZWKVGIKKKUOYDG-UHFFFAOYSA-N	440.790	1.985	50	20	IDGD	
CN(C)CCOc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)nc2)cc1Cl	764101101	OIVTWCWTNCQQOD-UHFFFAOYSA-N	440.287	1.729	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc(C(=O)NC(C)C)cc3)n[nH]2)cc1	764110016	FIDHJJLQENFRJD-UHFFFAOYSA-N	448.483	1.923	50	20	IDGD	
CC(C)(C)OC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)CCOc2ccccc2)cn1	764168862	ZGFCRRRBVBHHBQ-UHFFFAOYSA-N	443.460	1.984	50	20	IDGD	
Cc1cc(C)n(-c2ccc(NC(=O)C(=O)NNC(=O)c3cccc(OC(F)F)c3)cn2)n1	764260198	SYAHORXSKLMLSB-UHFFFAOYSA-N	444.398	1.885	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)C(=O)Nc1cccc(OC[C@@H]2CCCO2)c1	764279167	YGYYQNHZBLXNBM-SFHVURJKSA-N	427.457	1.669	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)C(=O)Nc1cc(F)c(I)c(F)c1	764295095	ICHMFJJQEXQYFI-UHFFFAOYSA-N	449.155	1.001	50	20	IDGD	
CCOCC(=O)NNC(=O)C(=O)Nc1cccc(C(=O)N2CCc3sccc3C2)c1C	764317557	KOMLZFJKKBZBDI-UHFFFAOYSA-N	444.513	1.377	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C(=O)Nc1cccc(N2CCCS2(=O)=O)c1)c1ccccc1	764329535	NUPXJNPLALJOCL-SFHVURJKSA-N	444.513	1.506	50	20	IDGD	
Cc1nc(-c2cccc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc3ccccc3)c2)n[nH]1	764369698	IRGOAMVNKQKMBS-UHFFFAOYSA-N	430.371	1.538	50	20	IDGD	
CCOc1cc(N2CCN(C)CC2)ccc1NC(=O)C(=O)NNC(=O)c1ccc(C)o1	764371400	ZIWBQERIGQAWME-UHFFFAOYSA-N	429.477	1.138	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1ccnn1-c1ccccc1	764392272	DCIWTRVQZDJSMZ-UHFFFAOYSA-N	425.470	1.759	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)COc1ccccc1-c1ccccc1)S(=O)(=O)C1CCOCC1	764526593	WRTOHUXWXOTZNI-INIZCTEOSA-N	446.525	1.862	50	20	IDGD	
O=C(CCC(=O)N1CCN(c2ncccn2)CC1)NNc1ccc(Cl)cc1[N+](=O)[O-]	764888745	JFZYOKFMXNYBMC-UHFFFAOYSA-N	433.856	1.610	50	20	IDGD	
O=C(CCOc1ccccc1F)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765738885	PTEWHCMMGWNHDR-UHFFFAOYSA-N	428.464	1.200	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)[C@@H]1C[C@H]1c1cccc(F)c1F	765739100	QGAZNXLYLVWCFU-ZWKOTPCHSA-N	442.466	1.674	50	20	IDGD	
O=C(NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)N[C@H]1CCO[C@H](C2CC2)C1	765921076	WSVDNKYVUJRIES-WMZOPIPTSA-N	436.534	1.373	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1cc(C(=O)NNC(=O)C(C)(C)O)ccc1Br	768245993	HMHSVBVWKLDCJS-UHFFFAOYSA-N	436.328	1.058	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)[C@H](C)N2C(=O)[C@H]3CCCC[C@H]3C2=O)n[nH]1	768273678	ISWYKEIQUZTAOU-MELADBBJSA-N	439.472	1.410	50	20	IDGD	
CC(C)Cn1ncc(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)c1C1CC1	768277918	BEWBMERVYJFQCD-UHFFFAOYSA-N	439.925	1.792	50	20	IDGD	
CCCCS(=O)(=O)N1CCC[C@@H]1C(=O)NNc1c(OC)cccc1S(C)(=O)=O	768636637	WLDOIEADBPSSNS-CYBMUJFWSA-N	433.552	1.136	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)CCCC[C@@H]1SC[C@H]2NC(=O)N[C@H]21	768636878	YZSRCDCCQPPSHP-PVXIVEMSSA-N	442.563	1.268	50	20	IDGD	
CC(C)(C)C(=O)NCCc1ccc(S(=O)(=O)NNC(=O)c2ccccc2O)s1	770635435	PCGDDNKYWDPVQN-UHFFFAOYSA-N	425.532	1.782	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2cc(Br)cn2C)c2ncccc12	770772308	VZOIQRHVJILMHK-UHFFFAOYSA-N	446.261	1.744	50	20	IDGD	
CC(C)CC(=O)NNC(=O)CN1C(=O)N[C@@](C)(c2ccc(Br)cc2)C1=O	771243344	AQSXJWBSYWGYLL-KRWDZBQOSA-N	425.283	1.410	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NN=C1C(=O)Nc2cc(N3CCOCC3)ccc21	771561601	LDVDAFPZMHRWPF-UHFFFAOYSA-N	441.875	1.265	50	20	IDGD	
CCOC(=O)CNC(=O)C1CCN(C(=O)NNC(=O)c2c(Cl)cccc2Cl)CC1	771974236	AHEGGTJLVRADLN-UHFFFAOYSA-N	445.303	1.739	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNS(=O)(=O)c1ccc(CS(C)(=O)=O)cc1	773250333	CPRKUPHQSTWLOV-GFCCVEGCSA-N	446.934	1.662	50	20	IDGD	
CCCCNS(=O)(=O)c1cccc(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2)c1	773642812	CLIMMMNPMRWIKX-UHFFFAOYSA-N	435.462	1.755	50	20	IDGD	
Cn1cc([C@@H](NCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c2ccc(F)cc2)cn1	774341080	IRRBIYXDQBKYRV-IBGZPJMESA-N	426.408	1.608	50	20	IDGD	
O=C(CO)NNC(=O)c1cccc(NS(=O)(=O)c2ccc(Br)cc2)c1	777782216	YBAYESWAQKGBDI-UHFFFAOYSA-N	428.264	1.003	50	20	IDGD	
COc1ccc(N2CCN(C(=O)/C=C\C(=O)NNc3nc(C)cc(OC)n3)CC2)cc1	778302745	IZIBZITYXYDGOS-HJWRWDBZSA-N	426.477	1.150	50	20	IDGD	
Cc1nc(O)c(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1Br	778723730	GAUDIZYLTICFRO-UHFFFAOYSA-N	435.282	1.326	50	20	IDGD	
C[C@H]1CN(C(=O)Cn2cc(NC(=O)C(=O)NNc3ccc(Cl)cc3)cn2)C[C@@H](C)O1	783335999	DFVHSRUVTLVRCF-BETUJISGSA-N	434.884	1.254	50	20	IDGD	
CC(C)(C)OC(=O)c1ccc(NC(=O)C(=O)NNc2ccc(-n3cccn3)nn2)c(F)c1	783437124	STSCEOAKZJTKSF-UHFFFAOYSA-N	441.423	1.839	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(F)c(NC(=O)C(=O)NNc2nccc3sccc23)c1	783437299	GFIHOGUDQXMIIY-UHFFFAOYSA-N	437.478	1.768	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NC2CCN(c3cc(C)[nH]n3)CC2)cc(OC)c1OC	784060271	BNIWGRZNYMYPFW-UHFFFAOYSA-N	432.481	1.357	50	20	IDGD	
CN(C)c1ccnc(C(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)c1	784296144	UOCVSWWWGCHUEI-UHFFFAOYSA-N	442.479	1.981	50	20	IDGD	
COc1ccc(Cn2nccc2NC(=O)C(=O)NNc2ccc(C(F)(F)F)nn2)cc1	784891064	BWGBLIFDAJUDQY-UHFFFAOYSA-N	435.366	1.831	50	20	IDGD	
CN(C)c1nccc(NNC(=O)C(=O)Nc2cccc(N3CCN(CC4CC4)CC3)c2)n1	784970543	JKVXJSOOERXVSC-UHFFFAOYSA-N	438.536	1.156	50	20	IDGD	
COc1ccc(OC)c([C@H]2C[C@H]2C(=O)OCC(=O)NNC(=O)Cc2nc(C)cs2)c1	788201917	RIPWLOKCQZVVCA-UKRRQHHQSA-N	433.486	1.506	50	20	IDGD	
C=C[C@](C)(O)CC(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccc(OC)cc2)c1	788267658	NEKALUJZMRRCFD-FQEVSTJZSA-N	433.486	1.584	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2ccc(O[C@@H]3CCOC3)cc2)cc1	788719508	GHOPUPBWUAKBDE-GOSISDBHSA-N	447.513	1.244	50	20	IDGD	
CCOC(=O)C1(CC(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)CCC1	789199387	MSLAUXXLXAWIMM-UHFFFAOYSA-N	430.549	1.384	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)c1nn(-c2ccc(Cl)cc2)cc1O	789948441	SOKFFMUUWMBKEG-UHFFFAOYSA-N	438.872	1.700	50	20	IDGD	
CC(C)Cc1ncc(NC(=O)C(=O)NNC(=O)c2cc(Br)ccc2O)cn1	792354615	AJABDUNSIWYEQC-UHFFFAOYSA-N	436.266	1.543	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)c1cc([N+](=O)[O-])ccc1Sc1nnnn1C	792798902	RPPPSEVWAKYRHN-UHFFFAOYSA-N	443.445	1.282	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNc2ccc3c(=O)[nH]ccc3c2)cc1Cl	793070343	PWJFYDMSLHYRKU-UHFFFAOYSA-N	444.831	1.815	50	20	IDGD	
CCOC(=O)c1cc(S(=O)(=O)NNC(=O)c2cc(OC)cc(OC)c2)c(F)cc1C	795279886	IKGQBYJKWOPLDA-UHFFFAOYSA-N	440.449	1.951	50	20	IDGD	
CCOC(=O)c1ccc(OC)c(S(=O)(=O)NNC(=O)c2cc(Br)c[nH]2)c1	795290429	MIJOMCNZTLZAPD-UHFFFAOYSA-N	446.279	1.586	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CN2CCNC(=O)[C@@H]2c2ccc(Br)cc2)c1	796577551	XJXZZPPMSJPVGW-SFHVURJKSA-N	445.317	1.692	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNC(=O)C(=O)Nc1nc2c(s1)CCCCC2	797369437	XAHYARWOAFVHOL-UHFFFAOYSA-N	445.501	1.424	50	20	IDGD	
CNC(=O)COc1ccc(NC(=O)NNC(=O)[C@H](C)Oc2ccc(C(C)=O)cc2)c(C)c1	797680439	IFDWGYJVCNMFJB-HNNXBMFYSA-N	442.472	1.943	50	20	IDGD	
Cc1cc(O[C@@H]2CCN(C)C2=O)ccc1NC(=O)C(=O)NNc1cnc2ccccc2n1	799259590	CZHCIGAZOUDLBY-GOSISDBHSA-N	434.456	1.630	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Br)cc2-n2cncn2)cc1	801109387	LKDYJVHLIVWPFJ-UHFFFAOYSA-N	443.261	1.738	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc3ccccc3cc2NS(C)(=O)=O)cc1	801110499	AUVVLENNJHQNJK-UHFFFAOYSA-N	440.481	1.919	50	20	IDGD	
Cc1ccc([C@](O)(CC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)C(F)(F)F)o1	802068611	MFXGMWSWEOKUHK-MRXNPFEDSA-N	449.407	1.984	50	20	IDGD	
CC(C)c1nn([C@@H]2CCS(=O)(=O)C2)cc1C(=O)NNC(=O)Nc1ccc2c(c1)OCO2	802100704	YOWOMYBVXUPFPX-CYBMUJFWSA-N	449.489	1.561	50	20	IDGD	
COc1ccc(N2C[C@@H](C(=O)NNC(=O)Nc3ccc4c(c3)OCO4)CC2=O)c(OC)c1	802101487	NTHMKTSRNJVIHS-LBPRGKRZSA-N	442.428	1.638	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3ccccc3OC3CC3)cc2)CC1	806781330	BMPUAGFDQPMIII-UHFFFAOYSA-N	430.530	1.921	50	20	IDGD	
COCCn1cc(C(=O)NNC(=O)c2cc(F)ccc2Br)c(=O)cc1C	806787804	PEDMXPNBYTZUQL-UHFFFAOYSA-N	426.242	1.780	50	20	IDGD	
O=C(CCCS(=O)(=O)c1ccc(Cl)cc1)NNc1nccc(N2CCOCC2)n1	807076200	WWYFMMZSAYMUHS-UHFFFAOYSA-N	439.925	1.664	50	20	IDGD	
CN(C)CCCOc1cnccc1CNC(=O)NNC(=O)[C@H]1COc2ccccc2O1	808348890	UJNWOURDQVVYFO-LJQANCHMSA-N	429.477	1.083	50	20	IDGD	
O=C(COC(=O)[C@H]1C[C@H](c2ccccc2)OC1=O)NNC(=O)c1cccc([N+](=O)[O-])c1	808588029	HYBSFMZRHPRYSL-HZPDHXFCSA-N	427.369	1.203	50	20	IDGD	
COC(C)(C)c1nc(C)c(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)s1	809982833	PNFIWZIFLCPWLC-UHFFFAOYSA-N	446.938	1.709	50	20	IDGD	
O=C(NC[C@H]1COc2ccccc21)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	812440763	IJBGAVIHHYRODO-INIZCTEOSA-N	444.513	1.591	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)Nc1ccc(C(=O)N2CCOCC2)cc1	814598005	MLUPICYZFNVLGI-UHFFFAOYSA-N	447.517	1.558	50	20	IDGD	
Cn1ncc(C=NNC(=O)CCCCC(=O)NN=Cc2cnn(C)c2Cl)c1Cl	814705572	GHQGEPZLHDKOIG-UHFFFAOYSA-N	427.296	1.621	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)C[C@H]1CCCS(=O)(=O)C1	814739417	OJBHBEYYYOOANS-NWDGAFQWSA-N	433.324	1.579	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(N(C(C)=O)[C@H]3C[C@H]3C)cc2)c1O	815568632	OYFLCUWRQQRATM-PXAZEXFGSA-N	440.456	1.562	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCc2nncn2C1)C(=O)Nc1cc(-c2ccccc2)ccc1Cl	815692122	JRDJFQXYBCWNPV-OAHLLOKOSA-N	438.875	1.947	50	20	IDGD	
CCn1ncc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)N(C)C)c1C(F)(F)F	815751627	HTKGMBXFRSAXJK-UHFFFAOYSA-N	448.427	1.254	50	20	IDGD	
O=C(c1ccc(N2CCCCC2)c(S(=O)(=O)N2CCCCC2)c1)N1CC[C@H](B(O)O)C1	864233590	JEISPBFIHAYPIU-SFHVURJKSA-N	449.382	1.540	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)NNC(=O)c2cnccn2)c(Br)c1	912980556	PAGHWWKTGQACJG-UHFFFAOYSA-N	429.252	1.039	50	20	IDGD	
CCOc1ccccc1C(=O)N1CCC[C@H]1C(=O)NNC(=O)Cc1nc2ccccc2n1C	914781535	KEQIVDIHZDAVKN-IBGZPJMESA-N	449.511	1.967	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)NC2CCN(C(=O)c3ccco3)CC2)cc1C	916244038	HPQKNXTVYPKWTO-UHFFFAOYSA-N	427.461	1.470	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CNS(=O)(=O)c2ccc3ccccc3c2)cc1	916830512	DDLMEQOKIPMHGG-UHFFFAOYSA-N	440.481	1.213	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CCNS(=O)(=O)c2cccc(Cl)c2)cc1	916830617	KULRLUAVXYCTAD-UHFFFAOYSA-N	438.893	1.103	50	20	IDGD	
O=C(COC(=O)c1cncn1-c1ccc(F)cc1)NNC(=O)c1ccc([N+](=O)[O-])cc1	917248177	RZNUKMKSCPAZKJ-UHFFFAOYSA-N	427.348	1.538	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(OCC2CCCCC2)cc1)[C@@H]1CCS(=O)(=O)C1	917730516	BTCVNTKSPNQAHP-OAHLLOKOSA-N	430.548	1.390	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)CN1CCCCC1	918104452	OXMCSLUKLMNOIX-OAHLLOKOSA-N	425.555	1.003	50	20	IDGD	
CC[C@H](NC(=O)NNC(=O)c1cccc(N(C)C)c1)c1ccccc1OCC(=O)NC	918221530	KXNAGCOSYPZHIA-SFHVURJKSA-N	427.505	1.973	50	20	IDGD	
C/C=C\COc1ccc(CCC(C)=NNC(=O)CSc2nn(C)c(=O)n(C)c2=O)cc1	920370919	ONUGIUOWSLNWHU-NCEKSDPUSA-N	445.545	1.651	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN(S(=O)(=O)c2ccccc2)C1)c1n[nH]c2c1CCCC2	1317862280	CEJUCUOYDWCEBQ-AWEZNQCLSA-N	431.518	1.150	50	20	IDGD	
Cc1c(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cnn1-c1ccncc1	1319554780	HRYVOQFXTIBUDB-UHFFFAOYSA-N	433.516	1.549	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2c[nH]c(Br)c2)cc1OC	1320925455	HCYNDYXTXARFHA-UHFFFAOYSA-N	426.223	1.412	50	20	IDGD	
CSC[C@@H](C)C(=O)N1CCC(C(=O)NNC(=O)c2cncn2-c2ccccc2)CC1	1325157830	NPUCFRKBNSEABI-OAHLLOKOSA-N	429.546	1.871	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4nccnc4c3)C2)C1	1777980986	PADDQYABXJDIKK-BFUOFWGJSA-N	433.306	1.857	50	20	IDGD	
O=C(c1ccc2nccn2c1)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1778014404	DSOGBADOVHPPSD-WMLDXEAASA-N	425.258	1.468	50	20	IDGD	
Cn1ncc2cc(C(=O)N3CC[C@@]4(CN(C(=O)CCBr)CCO4)C3)ccc21	1778017883	IMZAYJDYAXJWHH-LJQANCHMSA-N	435.322	1.802	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccn4ccnc4c3)C2)C1	1778564637	OZQDGWZAVWJUPT-AUUYWEPGSA-N	435.322	1.809	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cccn4cncc34)C2)C1	1778688843	QMNZFFQCJMOKRX-HNAYVOBHSA-N	435.322	1.951	50	20	IDGD	
O=C(C[C@@H]1CNc2ccccc2O1)N1CC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1778931434	HYBZUXGWDUHWDS-BFUOFWGJSA-N	428.316	1.883	50	20	IDGD	
CN1Cc2ccccc2C[C@H]1C(=O)N1CCO[C@@]2(CCN(C(=O)CO[Si](C)(C)C)C2)C1	1779294326	NYWVTBQVLAQZLV-NZQKXSOJSA-N	445.636	1.725	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)CBr)C2	1779529067	XVJVUZKUXBJCCC-NRTGNBEESA-N	444.370	1.222	50	20	IDGD	
COC[C@@H](C)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1	1780095605	QUALJPDGSALHJA-SPLOXXLWSA-N	449.460	1.246	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H]1C[C@@H]1F)CCO2	1780098185	FHAINFYCAPBTHZ-UVFQYZLESA-N	435.408	1.322	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3c(OC)cccc3OC)C2)C1	1780540671	ADXUEVZQFXKHOR-JLTOFOAXSA-N	426.897	1.401	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@](C)(Cl)CCl)C1	1780712746	WYMXZPHNEPCQBO-TUFGIGEDSA-N	434.364	1.427	50	20	IDGD	
CN1CCC[C@@H](C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](F)Br)C2)C1	1780773655	KUIJYYGGRCJVFC-ATNYBXOESA-N	434.350	1.533	50	20	IDGD	
CN1C(=O)CC[C@H]1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@](C)(Cl)CCl)C2	1780794017	UWJDGKKYAUUJJD-QABNGEJJSA-N	434.364	1.357	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3n[nH]c4ccc(F)cc34)CCO2)C1	1783534268	RWFSGMVHQPYKPK-ADLMAVQZSA-N	439.285	1.929	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)N1CC[C@]2(CN(C(=O)[C@H](F)Cl)CCO2)C1	1783576439	MJWXWNUTUHPYJY-BIENJYKASA-N	433.908	1.750	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)CN3CCCCC3=O)C2)C1	1783759121	BDHJLYGIEZJGDC-RDTXWAMCSA-N	430.343	1.002	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cc4cnccc4nc3C)CCO2)C1	1783876510	YGRAWYKXRIQHGU-LAUBAEHRSA-N	432.908	1.636	50	20	IDGD	
CCOC(=O)C(C)(C)C(=O)N1CC[C@@]2(CN(C(=O)[C@@H](C)CBr)CCO2)C1	1785517314	HTQFNBBHWZOTKC-SCLBCKFNSA-N	433.343	1.437	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)C3(F)CN(C(=O)OC(C)(C)C)C3)C2)C1	1785687161	KHAODJFQRZMJHU-IFXJQAMLSA-N	447.935	1.793	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4ncccn4n3)C[C@@H]21	1786407365	ZLNVBEZGLUGWMI-YDHLFZDLSA-N	436.310	1.108	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3nc[nH]c3[N+](=O)[O-])[C@H]2C1	1787480289	OWUVIRBKNADMGY-BJDJZHNGSA-N	444.286	1.085	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ncn(-c4ccccc4)n3)[C@H]2C1	1787585080	NWYHAYRUEWCKRU-OWLYRPNTSA-N	431.924	1.878	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc4n(n3)CCCC4)[C@H]2C1	1788356474	ZAZNWGFDTUQFNU-RMRKRWHISA-N	439.354	1.596	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(F)n3)[C@H]2C1	1788865574	DSPRQYYXHGIJKW-OSFYFWSMSA-N	428.302	1.845	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(C)(C)CCl)C[C@@H]21	1790173878	QEYPGIZBYRIMQM-YXWQFLTLSA-N	447.960	1.074	50	20	IDGD	
CCN(CC)C[C@@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21	1790604391	SDIVWVCSQALKNF-OLMNGRFOSA-N	436.366	1.635	50	20	IDGD	
C[C@@H](CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]21)c1ccccc1	1790926846	SCCMQLWCVCRECU-VMXMFDLUSA-N	444.576	1.533	50	20	IDGD	
CC(C)N1CCC[C@H]1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]2C1	1791064951	NPQBIEAEEJWBEK-XAJHFOFHSA-N	430.387	1.622	50	20	IDGD	
CC[C@@H](Br)C(=O)Nc1ccc(C2(NC(=O)CC[C@@H](N)C(N)=O)CCC2)cc1	1791361096	QGGOVMJUBYYUOP-HUUCEWRRSA-N	439.354	1.887	50	20	IDGD	
Cc1cc(F)ccc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]21	1792084989	GBGGOCDNUVPYTI-SNRMKQJTSA-N	434.512	1.100	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccccc1C(F)(F)F)C2)[C@H](O)CCl	1792976518	WGDGTCSAZNWNAP-IARIHHJXSA-N	434.842	1.437	50	20	IDGD	
Cn1c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](O)CCl)cc2c1-c1ncccc1OC2	1793109856	HFPRIOPUXNCTEN-JYYAWHABSA-N	444.919	1.831	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c(c1)n(C)c(=O)n3C)C2	1793449650	GWLNCSYXPCHFRP-YYAJDYIMSA-N	448.951	1.488	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H]1CCC(=O)N1)C2	1794142759	NCFNUATZIJXKCR-AICCOOGYSA-N	442.944	1.035	50	20	IDGD	
CC(=O)N[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Cl)c1ccc(F)cc1	1796367514	KFDYRWTVTKVVDS-IMPMIVQMSA-N	429.851	1.127	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2)C1=NO[C@@H](c2ccccc2)C1	1797179369	SFJNHVJOYQPZST-OCVGTWLNSA-N	426.300	1.897	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnc2[nH]ncc2c1	1797349577	JBJODQLGHDNMAF-LXTVHRRPSA-N	436.310	1.335	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CO[Si](C)(C)C	1797955811	GBMCZJJDSQRHKK-HGKCTWBKSA-N	430.581	1.697	50	20	IDGD	
CC(=O)Nc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CO[Si](C)(C)C)ccn1	1797955988	UAUOELANZIOWSS-HGKCTWBKSA-N	434.569	1.095	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2cc(F)ccc2[nH]1)c1cccc(B(O)O)c1	1797993761	QXQLDHQOIPCLOE-REPLKXPHSA-N	435.264	1.552	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)NC(=O)c1ccc(F)cc1	1799050061	FXRFNRNOTWCAJQ-UIVXMWCNSA-N	439.915	1.551	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(-n2c(O)nnc2O)cc1	1799313446	LBUNSPWHNFKORE-UKMLZYKCSA-N	449.895	1.184	50	20	IDGD	
CN1CCCn2nc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)C(C)(C)CCl)C4)cc2C1	1800126168	SIOPNOVXRPYEJT-JLVBRIDZSA-N	437.972	1.187	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)n1cccc1C=O)C2	1800639814	NRWCQYVHYWQUHL-CTTHAOKLSA-N	440.338	1.625	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3ccnn3c1)C2	1800642894	BHFKRLFLPAXCOG-YALNPMBYSA-N	435.322	1.711	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(-c3ccccn3)[nH]n1)C2	1800760630	XFGVMVJXJUVJDL-JRATXPSKSA-N	448.321	1.458	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COc1ccccc1C#N)C2	1800763504	CCEHUQGKFKQQBH-LJGDNWOOSA-N	436.306	1.310	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2	1800977702	WCPYGFSJZCKAEN-NDPMZMCLSA-N	433.288	1.208	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc2nn[nH]c2c1	1801196310	LZROHIQVAMOUFD-XMOXNHLCSA-N	448.487	1.344	50	20	IDGD	
Cc1nccn1CCCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@](C)(Cl)CCl)C2	1801311807	ZUFCBAOGCFVVFC-LORHWOILSA-N	431.364	1.798	50	20	IDGD	
C=CCNC(=O)/C=C\C(=O)NC[C@@H]1CCN(C(=O)[C@H](Cl)COC)[C@@H]1c1cccnc1	1802499256	ROTJBJHJCXUSJW-NJUCSYBDSA-N	434.924	1.200	50	20	IDGD	
O=C1Cc2cc(C(=O)N3CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]3c3cccnc3)ccc2N1	1803143235	XMINEGIZZKLBSY-ZTNFWEORSA-N	442.903	1.496	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)c2cc(O)n(C)n2)[C@H]1c1cccnc1	1804898307	GMUCKLJGNJHJKA-DETPVDSQSA-N	436.310	1.624	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)N1CCC2(CCCN(C(=O)[C@H](C)CBr)C2)CC1	1805384571	OZRTWXLIHOKNRK-KGLIPLIRSA-N	431.375	1.696	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1cccs1	1805385722	UUDDNBIKWFEOFB-YLJYHZDGSA-N	435.314	1.456	50	20	IDGD	
Cc1cccc(CCC(=O)N2CCCC3(CCN(C(=O)CCC(=O)NN(C)C)CC3)C2)n1	1806808530	NCUXRYZWIIUTEE-UHFFFAOYSA-N	443.592	1.927	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC2(CCCN(C(=O)CCBr)C2)CC1	1809069733	IGNBPEOFXWHQNT-UHFFFAOYSA-N	431.375	1.376	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC2(CCCN(C(=O)c3ccc4n[nH]cc4c3)C2)CC1	1810570146	BIXFRYYCEQMVAU-UHFFFAOYSA-N	440.548	1.781	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H](CNC(=O)[C@@H]2CNC(=O)C2)[C@H]1c1cccnc1	1812643547	UZIWFMHSRNKTRR-WBTNSWJXSA-N	437.338	1.397	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1	1812773766	IZERXCZMQNCLTQ-ZQDZILKHSA-N	432.746	1.861	50	20	IDGD	
C[C@H](CS(C)(=O)=O)C(=O)N1CC[C@H](CNC(=O)C(Cl)Cl)[C@H]1c1cccnc1	1813075826	JSUWFHRGOVTOKV-MRVWCRGKSA-N	436.361	1.572	50	20	IDGD	
C[C@H](CS(C)(=O)=O)C(=O)N1CC[C@@H](CNC(=O)C(Cl)Cl)[C@@H]1c1cccnc1	1813075827	JSUWFHRGOVTOKV-XBFCOCLRSA-N	436.361	1.572	50	20	IDGD	
COc1ncc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)[C@@H](O)CCl)n[nH]2)cc1F	1814867472	LVMYOVSTYPUNPS-KGLIPLIRSA-N	425.848	1.858	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1nccs1	1816568956	VCKCLWWUOKRALC-HNNXBMFYSA-N	425.279	1.166	50	20	IDGD	
CC(C)CNC(=O)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](F)Br)CC2	1817332454	MEIQKPLESLONQM-KWQFWETISA-N	435.319	1.518	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@@H](O)CCl)CC3)o1	1819783473	XWCBNIUGDCGSQU-ONGXEEELSA-N	426.882	1.520	50	20	IDGD	
CCc1nc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)co1	1819897894	PENWWYQPWCYBQG-OAHLLOKOSA-N	431.497	1.639	50	20	IDGD	
C[C@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](F)Br)n[nH]1)n1cnnn1	1820936922	HYSFIJGTPBDHQD-HLUHBDAQSA-N	429.254	1.340	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(CO)on3)sc2C1	1821706431	XUIYMGHKQSTCHW-JGVFFNPUSA-N	429.296	1.633	50	20	IDGD	
Cc1cnn([C@H](C)C(=O)Nc2cc([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)c1	1822750494	CGHUZWBLMDAJDA-WBVHZDCISA-N	444.540	1.541	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC([C@H]2CCCCN2C(=O)CN2CCNC2=N)CC1	1826868939	ATQMHRRFMCGDIP-GOEBONIOSA-N	442.402	1.477	50	20	IDGD	
O=C(C1CCSCC1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827054502	GOZZVTCUYRDAMI-NRFANRHFSA-N	444.406	1.743	50	20	IDGD	
O=C(Cc1cccc([N+](=O)[O-])c1)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1829626779	NIHDRYZNDSOSPP-SFHVURJKSA-N	446.287	1.397	50	20	IDGD	
Cc1cccc2[nH]c(C(=O)N3CCOC[C@]4(C3)CN(C(=O)[C@@H](O)CCl)CCO4)cc12	1830731704	OMKKPSQCLUVXAY-RXVVDRJESA-N	435.908	1.146	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc(Cl)nc3)C2)C1	1831638844	HSDDUOAENJCMAV-KBXCAEBGSA-N	431.320	1.608	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(O)nc(O)n2)CC1	1831833905	QIMBBWBIEJMQOG-ZFWWWQNUSA-N	426.901	1.375	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)[C@H]2C[C@]2(F)Cl)CC1	1831959276	SFINUHIXZROCAE-LVCYWYKZSA-N	436.720	1.524	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3ccnc(OC)c3)CCO2)C1	1832595956	MHTSZSHXGCGWDT-DYESRHJHSA-N	439.940	1.497	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CSc3ccncc3)CCO2)C1	1832709558	LAPQYYGBZHJJOO-QFBILLFUSA-N	427.954	1.648	50	20	IDGD	
Cc1ncc(/C=C/C(=O)N2CCC(N3CCC(NC(=O)[C@@H](O)CCl)CC3)CC2)s1	1833313022	QQQGQBOKMZPMRH-DCKQQPRJSA-N	440.997	1.636	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccccn3)CCO2)C1	1833989886	VBBYZJXPEPXHMU-KBXCAEBGSA-N	426.311	1.325	50	20	IDGD	
O=C(CCBr)NC1CCN(C2CCN(C(=O)c3cc[n+]([O-])cc3)CC2)CC1	1834423434	VWELGSJDBHOYEO-UHFFFAOYSA-N	439.354	1.290	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(C=O)s1)CCO2	1835946165	JGRUPUHAYZVTKV-LJQANCHMSA-N	440.594	1.482	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc4c(C)cccc4[nH]3)CCO2)C1	1836918535	BFZOBVQMVCNZMQ-VGOFRKELSA-N	449.935	1.800	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)c(C)n1	1837715564	XVMXFGYNBODFAQ-OAQYLSRUSA-N	435.597	1.620	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC(OC2CCN(C(=O)CN3CCOCC3)CC2)CC1	1837804632	LFWYPXNMIFUJBW-UHFFFAOYSA-N	441.645	1.169	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cc4cccnn4n3)CC2)CC1	1838520460	WXMFCNKKJZWTJF-GOSISDBHSA-N	449.939	1.595	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccncc3)C2)C1	1839965834	MHDAPGJTYKBIRT-LPHOPBHVSA-N	440.338	1.254	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)COc3ccccc3F)CCO2)C1	1839969741	ZSQRRKKBRMECPJ-YWZLYKJASA-N	428.888	1.678	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3cccc(C#N)c3)C2)C1	1840149086	DKRNAMUDIZEQMH-KNQAVFIVSA-N	449.935	1.201	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(OC)c3C)C2)C1	1840155954	GNFVMJIUMRLCOM-DYESRHJHSA-N	440.924	1.327	50	20	IDGD	
CCC[C@@H](NC(C)=O)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1840851901	WMBQDUWZTMOAES-UZLBHIALSA-N	431.961	1.013	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H]1C(=O)N1CCCC12CN(C(=O)[C@H](F)Br)C2	1841766987	XZYZWFGZQXDYQT-RYUDHWBXSA-N	434.306	1.890	50	20	IDGD	
COc1ccc(/C=C(\C)C(=O)N2CC3(CCCN3C(=O)c3ccc(B(O)O)cc3)C2)cc1	1843012223	PZIJUFDIDUELBE-SAPNQHFASA-N	434.301	1.296	50	20	IDGD	
COc1ccc2oc(C(=O)N3CC4(CCCN4C(=O)c4cccc(B(O)O)c4)C3)cc2c1	1843014122	ZRCDTQUBMLOUEQ-UHFFFAOYSA-N	434.257	1.252	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)[C@@H](C)Cc2ccncc2)C1	1845762745	CTSLBLCEWDJMHQ-MQISTKKBSA-N	436.516	1.598	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2cc(F)cc(F)c2F)C1	1846832081	JBRKXFMRJMDPMQ-UHFFFAOYSA-N	433.390	1.233	50	20	IDGD	
N#Cc1cc(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](O)CCl)ccc1Br	1847562264	ROLPWZLSWULSGD-SOUVJXGZSA-N	426.698	1.736	50	20	IDGD	
C=CC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl	1847565372	MDYWREOPTNQMHK-YDZRNGNQSA-N	449.935	1.659	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CCc1ncccc1C	1848159045	PBVQWVQNQISCFR-FMEPYYHXSA-N	436.516	1.658	50	20	IDGD	
COCCOc1cc([N+](=O)[O-])c(C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1OC	22021358	AXMILUVILBAUTP-SFHVURJKSA-N	447.400	1.230	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2cc(Br)c[nH]2)nnn1-c1cccc([N+](=O)[O-])c1	24484231	MDCBAXPHZRSKCA-UHFFFAOYSA-N	434.210	1.649	50	20	IDGD	
C[C@@H]1CC(C)(C)C[C@]2(C1)NC(=O)N(CC(=O)NNC(=O)c1ccc3c(c1)OCCO3)C2=O	105279418	AHCZKRUTKLSMJK-DMZKTXOQSA-N	444.488	1.356	50	20	IDGD	
C[C@@H]1CN(CCNC(=O)NNC(=O)COc2ccc(OCc3ccccc3)cc2)CCO1	726256054	NDIAKUYKADYFSW-GOSISDBHSA-N	442.516	1.696	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2cccc(OCC(F)F)c2)c1	726616164	ZPVJGNSBZNTZOI-UHFFFAOYSA-N	427.429	1.878	50	20	IDGD	
CNS(=O)(=O)c1cccc([C@@H](C)NC(=O)NNC(=O)c2cc(Br)c[nH]2)c1	727608368	PCCNRDKCLMEHST-SECBINFHSA-N	444.311	1.391	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1)N1C(=O)CCC1=O	727733108	XJBVVJQEGMGKQS-JXFKEZNVSA-N	434.496	1.298	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)CCNC(=O)c3n[nH]c4ccccc34)n[nH]2)cc1	728069181	ZMQSSUJYJRDBKJ-UHFFFAOYSA-N	431.456	1.843	50	20	IDGD	
Cc1ccc(O[C@@H](C)C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)cc1	728212819	GPWAQASRRQOUDT-KRWDZBQOSA-N	432.546	1.842	50	20	IDGD	
CCNS(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)c2cccc(OC(F)F)c2)c1	728545003	SALQFOCCOYJMRN-UHFFFAOYSA-N	431.392	1.800	50	20	IDGD	
O=C(NCc1ccc(C(=O)N2CCOCC2)cc1)NNC(=O)c1cccc(OC(F)F)c1	728594224	JHZJNZGIHBLULA-UHFFFAOYSA-N	448.426	1.905	50	20	IDGD	
CCCS(=O)(=O)c1ccccc1C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	728846131	SESICJVFIQRSMJ-UHFFFAOYSA-N	431.518	1.338	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)COc1ccc(C2SCCCS2)cc1	729275550	PQXWRLHSUNJTQD-NSHDSACASA-N	433.577	1.019	50	20	IDGD	
CS(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)c2cccc3ncccc23)c(F)c1	730203844	DWMXWVIFORMZFC-UHFFFAOYSA-N	438.462	1.369	50	20	IDGD	
COc1c(F)cc(Br)cc1S(=O)(=O)NNC(=O)c1ccc2c(c1)OCO2	730765676	MAZNLIBJMMULIK-UHFFFAOYSA-N	447.238	1.949	50	20	IDGD	
O=C(CN1CCN(CC(=O)N2CCCc3ccccc32)CC1)NNC(=O)c1ccccc1	731355518	CUJTUCORTVRYQM-UHFFFAOYSA-N	435.528	1.045	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)c3cncc(O)c3)c2)cc1	731865415	JLEIFLAUZBGHLY-UHFFFAOYSA-N	442.453	1.671	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])o1)c1cccc(OC(F)F)c1	731988827	LSTNFNVMEDWEGS-GFCCVEGCSA-N	438.343	1.855	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2ccc(S(N)(=O)=O)cc2)cc1Br	732234966	LTNLLGCCFJMBOI-UHFFFAOYSA-N	443.279	1.572	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)CNC(=O)c1cc(OC)c(OC)c(OC)c1)c1ccccc1	732292228	SXNMYEWMPXQNHC-MRXNPFEDSA-N	429.473	1.783	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(C(=O)NNc2ccc(Br)nc2)cc1	732834188	FHZHRSUBKWZELI-UHFFFAOYSA-N	429.296	1.526	50	20	IDGD	
C[C@H]1CN(CC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)C[C@H](C)N1C(=O)OC(C)(C)C	733200303	LIZUFRACMSHKBZ-KBPBESRZSA-N	435.481	1.686	50	20	IDGD	
O=C(Cn1ccc(NS(=O)(=O)c2ccc(CCCCl)cc2)n1)N1CCOCC1	735269525	QSVBMGBPDZZHPN-UHFFFAOYSA-N	426.926	1.714	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)NNC(=O)[C@@H]2Cc3ccccc3CN2Cc2ccccc2)cn1	735513710	VCGHHWQUXCOINP-FQEVSTJZSA-N	447.499	1.022	50	20	IDGD	
O=C(CC[S@](=O)c1ccc2c(c1)OCCO2)NNC(=O)c1cc(Br)c[nH]1	740749452	ZGLFRVPTPHSXCL-SANMLTNESA-N	442.291	1.507	50	20	IDGD	
O=C(CN1CCN(c2ncnc3ccsc23)CC1)NNC(=O)c1cccc([N+](=O)[O-])c1	741794523	VYZKQAFUXUIJNC-UHFFFAOYSA-N	441.473	1.183	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)c2cccc(CN3CCN(C)CC3)c2)o1	742246865	GBPWRJWOKLBRQC-UHFFFAOYSA-N	427.549	1.944	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN(c2ncnc3sccc23)C1)c1ccc(-n2cnnn2)cc1	742481014	PUKSRWZTLZHCGW-AWEZNQCLSA-N	449.500	1.345	50	20	IDGD	
O=C1CN(C(=O)c2ccc(CNC(=O)NNC(=O)c3cccc4ccccc34)cc2)CCN1	743550209	IKSNVDFCBKYORX-UHFFFAOYSA-N	445.479	1.556	50	20	IDGD	
C[C@H]1CN(c2ccc(C(=O)NNC(=O)Nc3ccc(S(C)(=O)=O)cc3)cn2)C[C@H](C)O1	743830969	NUINUDCLMOTJEK-KBPBESRZSA-N	447.517	1.565	50	20	IDGD	
COc1ccc(CN2CCN(CC(=O)NNC(=O)c3ccc(C#N)cc3)CC2)cc1F	744385762	VSBZELCYJSTYAM-UHFFFAOYSA-N	425.464	1.285	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)CSc2ncnc3sccc23)c1	744611619	PVXPWPCFAHOCNF-UHFFFAOYSA-N	427.467	1.659	50	20	IDGD	
CC/C=C(\C)C(=O)N1CSC[C@@H]1C(=O)OCC(=O)NNC(=O)c1cccc(C#N)c1	744973905	QIVUADPVPUFOAJ-ZUFYJRLNSA-N	430.486	1.120	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NC[C@H](C)Cc2cccs2)cc1	745860251	MRVBMBYAAZRRSY-OAHLLOKOSA-N	438.575	1.886	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H](c2ccccc2)N2CCSCC2)c1	746827905	CCBRHWVSAYLRHB-GOSISDBHSA-N	433.555	1.641	50	20	IDGD	
CC(C)(CO)[C@H](CNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)c1ccccc1	747464226	SQZBIIYDXXJJAF-LJQANCHMSA-N	440.548	1.826	50	20	IDGD	
CCOc1cc(Br)c(CC(=O)NNC(=O)C(=O)N2CCCC2)cc1OCC	748247534	QYWUVBOELOLPQI-UHFFFAOYSA-N	442.310	1.559	50	20	IDGD	
O=C(CCCS(=O)(=O)N1CCCC1)NNc1nc(-c2ccccn2)nc2c1CCC2	748340422	FZAHYIIAUDBAKS-UHFFFAOYSA-N	430.534	1.676	50	20	IDGD	
O=C(NCc1cn(-c2ccccc2)nc1-c1ccncc1)NNC(=O)C(=O)N1CCCC1	748461134	GVNKGDOYWJJZBI-UHFFFAOYSA-N	433.472	1.387	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)[C@H]2CCCCN2Cc2ccc(F)cc2)n1	750499848	XZMIIOTVDOLALM-QGZVFWFLSA-N	448.520	1.878	50	20	IDGD	
COCCCN1C(=O)C(=NNC(=O)C(=O)NC(C)C)c2cc(Br)ccc21	750933417	GWYGZKASUSXXDQ-UHFFFAOYSA-N	425.283	1.177	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)c2cn(-c3ccc(C(F)(F)F)cn3)nn2)cc1	751289430	CMJAHOKKZJIODV-UHFFFAOYSA-N	431.334	1.393	50	20	IDGD	
COc1ccc(C(=O)CCC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1F	751377093	SWIXZIMAGJJXHU-UHFFFAOYSA-N	429.452	1.651	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)Cc2ccc(Br)c(F)c2)c2ccccc2c1=O	751547522	KOVRKWZLEOCDPC-UHFFFAOYSA-N	433.237	1.839	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)NC[C@@H]2CCC[C@]23NC(=O)N(C)C3=O)c1C	752726569	WFECILJKZYOGMC-BDPUGYQHSA-N	427.505	1.495	50	20	IDGD	
O=C(NNC(=O)N1CCO[C@]2(CCc3ccccc32)C1)c1csc(N2CCOCC2)n1	753000423	PPXDKITTZUBVJV-OAQYLSRUSA-N	443.529	1.508	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)Nc1ccc(C)c(S(=O)(=O)N2CCCCC2)c1	755394163	SLJPBZDOXPHANR-HNNXBMFYSA-N	442.538	1.374	50	20	IDGD	
CC(=NNC(=O)c1cc(S(=O)(=O)NCc2ccccc2)ccc1O)c1nccn1C	755608112	GQRMETPZTDEWFW-UHFFFAOYSA-N	427.486	1.758	50	20	IDGD	
COc1ccc(C(=O)N2CCOCC2)cc1NC(=O)NNC(=O)c1cccc(OC)c1O	756257714	OCBABIPOVJZTQC-UHFFFAOYSA-N	444.444	1.348	50	20	IDGD	
Cc1c(CS(C)(=O)=O)cccc1NC(=O)NNC(=O)CCCNC(=O)OC(C)(C)C	756596453	DAUPPOKAQOVVJM-UHFFFAOYSA-N	442.538	1.997	50	20	IDGD	
C[C@@H](CS(=O)(=O)c1ccc(F)cc1)C(=O)OCC(=O)NNC(=O)c1cccs1	756710996	JUMBKCPANLMGBY-NSHDSACASA-N	428.463	1.301	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)Nc1cnn(CC(=O)NC2CCCC2)c1	756794318	DHLQGYHKBGMYPG-UHFFFAOYSA-N	425.449	1.045	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)Nc2ccccc2OCC(=O)N2CCOCC2)c1	756874483	PSEXCXPZXIWCHU-UHFFFAOYSA-N	442.472	1.464	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1cc([N+](=O)[O-])c(F)cc1N	758086048	RPJABJBTYVPKIQ-UHFFFAOYSA-N	440.771	1.596	50	20	IDGD	
CC(C)Cn1ncc(C(=O)N2CCN(S(=O)(=O)CBr)CC2)c1C1CC1	758518974	UVBLWVMDHSDMKY-UHFFFAOYSA-N	433.372	1.857	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)C(=O)Nc1ccccn1)c1ccc(NC(=O)c2ccncc2)cc1	758775803	KLYSPUPXRPSSJV-AWEZNQCLSA-N	447.455	1.759	50	20	IDGD	
CSCC[C@@H](NC(=O)c1cccc(C)c1)C(=O)NNC(=O)C(=O)Nc1ccccn1	758831630	RSXQZSUGPMQJLX-OAHLLOKOSA-N	429.502	1.028	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)CCNC(=O)[C@H]2CCCN2C(=O)OC(C)(C)C)c1	760798443	HDWUZTMMLPQKQM-QGZVFWFLSA-N	448.520	1.427	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COc2cccc(C)c2)nc1I	761135603	LGDUIVHJOHDBIV-UHFFFAOYSA-N	441.225	1.843	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)N[C@@H]2CCN(C(=O)CC)C2)cc(OCC)c1OCC	762080129	DAMSRGRGBKMGQP-OAHLLOKOSA-N	436.509	1.838	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3n2)ccc1N1CCCC1=O	763449797	JCDRHTSEJXAWDS-UHFFFAOYSA-N	447.451	1.770	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccnn2[C@@H](C)CC(C)C)cc(OC)c1OC	763539489	MBSUDCPBZOJGRI-ZDUSSCGKSA-N	447.492	1.916	50	20	IDGD	
CCN(CC)Cc1cccc(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1	763572041	LBSVAULLYKMBBB-LJQANCHMSA-N	426.473	1.454	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2ccc(C(=O)NCC(C)C)cc2)c1	763647881	QUMNQBAUYAFYEQ-UHFFFAOYSA-N	440.500	1.854	50	20	IDGD	
COC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2OC)cc1F	763664613	YPIKTWIMXAVYDD-UHFFFAOYSA-N	434.380	1.178	50	20	IDGD	
CCn1cnnc1-c1ccccc1NC(=O)C(=O)NNC(=O)COc1ccccc1F	763681165	LPPRWAPAKZKITC-UHFFFAOYSA-N	426.408	1.269	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(Cl)c(C(N)=O)c1	763682755	VUALCWONRUYSRX-UHFFFAOYSA-N	434.836	1.003	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)COc3ccc(Cl)cc3)cc2)CCO1	763686894	WWGUQCUIXKJKRT-AWEZNQCLSA-N	446.891	1.730	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)C(=O)Nc1ccc2oc(C3CC3)nc2c1	763802800	ATSGDXGUHHWTHS-UHFFFAOYSA-N	439.384	1.778	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)c1csc(-c2ccc3c(c2)OCCO3)n1	763819471	BPWNNFFHLKTWKM-UHFFFAOYSA-N	439.453	1.167	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)C(=O)Nc1cccc(C(=O)N2CCCCC2)c1	763844213	XOCUHJBVWXQSLO-UHFFFAOYSA-N	442.447	1.617	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccc(-c2csnn2)cc1	763859204	YUNYMWILYNOVSD-LLVKDONJSA-N	429.433	1.898	50	20	IDGD	
CO[C@@H](C)C(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)c1	763871496	HBZBXGCUKDQVIB-QWHCGFSZSA-N	446.435	1.353	50	20	IDGD	
O=C(CCSc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccc(-n2ccnn2)cc1	763895756	RUCGMJALYDFQLB-UHFFFAOYSA-N	428.449	1.675	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)C(=O)Nc1ccccc1N1CCCCCC1	763917260	SOZASXBAFGMODI-UHFFFAOYSA-N	448.487	1.442	50	20	IDGD	
O=C1CCCc2cc(NC(=O)C(=O)NNC(=O)c3nn(-c4ccccc4)cc3O)ccc2N1	763944046	KSBJHYRWROGPHZ-UHFFFAOYSA-N	448.439	1.252	50	20	IDGD	
O=C(NNC(=O)c1cccc2ccccc12)C(=O)Nc1ccccc1C(=O)N1CCOCC1	764059101	ZNDWFGDUYUDBSN-UHFFFAOYSA-N	446.463	1.712	50	20	IDGD	
O=C(NNC(=O)C1CCCC1)C(=O)Nc1cc(C(F)(F)F)ccc1N1CCOCC1	764066710	RYGJHXBUYQWTLL-UHFFFAOYSA-N	428.411	1.818	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2cccc(OC(F)(F)F)c2)c1	764085692	NOXVHQZCFFYXDL-UHFFFAOYSA-N	445.375	1.388	50	20	IDGD	
C#CCOc1ccc(F)cc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccc(C)cc2)[nH]n1	764111650	QCRLLGMMWQMICD-UHFFFAOYSA-N	435.415	1.936	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc(C(=O)N(C)C)cc3)n[nH]2)cc1	764112409	XANCUDIKMOEKNS-UHFFFAOYSA-N	434.456	1.487	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccccc1CN1CCSCC1	764135539	IFZWDCDVVJYDAK-UHFFFAOYSA-N	442.541	1.573	50	20	IDGD	
CCN1CCN(Cc2ccc(NC(=O)C(=O)NNC(=O)CCc3ccccc3)cc2)CC1	764192851	KYJUCYHSQDJTRU-UHFFFAOYSA-N	437.544	1.543	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c2cccnc2c1C	764259427	HGDKVZYQYQDQBZ-UHFFFAOYSA-N	447.499	1.644	50	20	IDGD	
O=C(Cc1cc[nH]n1)NNC(=O)C(=O)Nc1ccc(F)c(NC(=O)Cc2ccccc2)c1	764286244	QOLOLCLLISBZCW-UHFFFAOYSA-N	438.419	1.059	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccccc2SCCC(N)=O)c(OC)c1	764286453	JVBWRDGWYQUYAR-UHFFFAOYSA-N	446.485	1.071	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc(-n4ccnn4)cc3)n[nH]2)cc1	764384970	PFBXCRYQLHUPKE-UHFFFAOYSA-N	444.455	1.620	50	20	IDGD	
COc1c(F)cc(F)cc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	764386575	AZNMWYLLGCAVIT-UHFFFAOYSA-N	433.346	1.902	50	20	IDGD	
O=C(CCC(=O)N1CCN(c2ccccc2)CC1)NNC(=O)Cc1cn2ccccc2n1	765757909	HNZFVZWFCTWVEZ-UHFFFAOYSA-N	434.500	1.153	50	20	IDGD	
CCCn1ncc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)c1C1CC1	765868460	NLCIRGMRQUSNTO-UHFFFAOYSA-N	438.532	1.390	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H]2CCO[C@@H](c3ccccc3)C2)c1	765915464	JHQBBQYRUPVDPL-IEBWSBKVSA-N	446.529	1.801	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)C(=O)Nc2ccc(C#N)cc2OC)c1	766259780	KDWSKEXEVCQQOJ-UHFFFAOYSA-N	447.245	1.738	50	20	IDGD	
CCOc1ccc(C(=O)NNS(=O)(=O)c2ccc3c(c2)oc(=O)n3CC)cc1OC	767439010	ZNNBZPDEXLFQPK-UHFFFAOYSA-N	435.458	1.645	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)[C@H](C)NS(=O)(=O)c2cccc(C#N)c2)cc1	767888939	IECXJCIXKBLIJP-AWEZNQCLSA-N	430.486	1.014	50	20	IDGD	
Cc1cccc(N2CCN(S(=O)(=O)CC(=O)NNc3nc4ccccc4[nH]3)CC2)c1	768496476	SXUGICRRENNNAM-UHFFFAOYSA-N	428.518	1.466	50	20	IDGD	
C[C@@H]1CN(C(=O)/C(C#N)=C/c2cn(CCC(N)=O)nc2-c2ccc(Cl)cc2)C[C@@H]1O	769128107	OAFWOOIGOAQZAY-DFFYWHQNSA-N	427.892	1.825	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)Nc1ccc(C[C@@H]2CC(=O)NC2=O)cc1	769241446	KLGRWMUYNIVROL-CYBMUJFWSA-N	446.485	1.453	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)Cc1ccccc1NC(C)=O	769479123	SGIJUCBVDLCGJH-UHFFFAOYSA-N	433.848	1.854	50	20	IDGD	
CC(C)c1nccnc1NNC(=O)Nc1ccc(N2CCN(S(C)(=O)=O)CC2)nc1	770457528	BEFKWTXYAFVIGV-UHFFFAOYSA-N	434.526	1.225	50	20	IDGD	
Cc1cc(S(=O)(=O)NCCNC(=O)NNC(=O)c2cccc3ncccc23)c(C)s1	772627745	XGBGMDNSVIUSBH-UHFFFAOYSA-N	447.542	1.836	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)c1cc(F)ccc1N1CCOCC1	772887797	CPRNSIWDCWFBKR-UHFFFAOYSA-N	434.855	1.393	50	20	IDGD	
CN(C)C(=O)COc1ccc(NC(=O)C(=O)NNc2ncc(Cl)cc2Cl)cc1	773682288	HVOKZUBFYARGQA-UHFFFAOYSA-N	426.260	1.937	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)cc1	774010249	WUODQZJKFFSVSF-ZDUSSCGKSA-N	435.864	1.919	50	20	IDGD	
Cc1ccc(C)n1-c1ccc(C(=O)NNC(=O)NC[C@H]2CC[C@@H](C(=O)N(C)C)O2)cc1	775460834	MJSUBTMCJDYWDL-MOPGFXCFSA-N	427.505	1.674	50	20	IDGD	
Cc1ccc(S(=O)(=O)C[C@@H](C)NC(=O)NNC(=O)CSc2ccccc2O)cc1	776196519	UBTGTMGIQAARGC-CQSZACIVSA-N	437.543	1.986	50	20	IDGD	
COc1cc(C(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)ccc1[N+](=O)[O-]	776200928	CWBZQNFHNMMCFK-UHFFFAOYSA-N	437.453	1.853	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)NCCCN2CCN(c3ccccc3)CC2)c1	776617442	UZZLXJZICPIXQG-UHFFFAOYSA-N	431.562	1.929	50	20	IDGD	
C[C@@H]1CCN(C(=O)OC(C)(C)C)[C@@H](C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)C1	778725538	SZOBUWMWIWVFQW-NVXWUHKLSA-N	446.552	1.876	50	20	IDGD	
COCCn1cc(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2Br)cn1	778759519	HDGRDPPIICNQQT-UHFFFAOYSA-N	427.215	1.282	50	20	IDGD	
CCC(CC)[C@@H]1C[C@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)CCO1	779394144	AMXMKSITJVORKR-AEFFLSMTSA-N	440.566	1.865	50	20	IDGD	
N#Cc1ccc(N2CCC[C@@H](NC(=O)NNC(=O)COc3ccc(F)cc3)C2=O)cc1	780902513	MLXYGESOGZWWRC-GOSISDBHSA-N	425.420	1.602	50	20	IDGD	
CCO[C@H]1C[C@@](NC(=O)OC(C)(C)C)(C(=O)NNC(=S)NCCSC)C1(C)C	780988189	WBWPBNHPJWLKAF-KPZWWZAWSA-N	434.628	1.943	50	20	IDGD	
Cn1cc(NC(=O)C(=O)NNc2ccccc2Br)cc(Br)c1=O	782983254	BRZMJJWXOBZXFH-UHFFFAOYSA-N	444.083	1.992	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN[C@@H](CC)c2cccc(S(N)(=O)=O)c2)cc1C	782987048	GZAIQTHWIOMGRT-HNNXBMFYSA-N	438.575	1.768	50	20	IDGD	
COc1c(F)cc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)cc1F	783265815	YDVAWSVCTHPTTB-UHFFFAOYSA-N	443.432	1.137	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)Cn1cc([N+](=O)[O-])c(C)c(Br)c1=O	783925473	YROVSQOMMPNTSD-UHFFFAOYSA-N	437.250	1.526	50	20	IDGD	
COc1ncc(NC(=O)C(=O)NNc2ccc(OCC(F)(F)F)cc2)cc1C(N)=O	784369985	BCFUAUMVCFVKPD-UHFFFAOYSA-N	427.339	1.212	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)NC[C@@H]2CCCCS2(=O)=O)cc1OC	784437857	HLBWPUSKRKAXQI-HNNXBMFYSA-N	427.523	1.785	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNc2ncccc2Cl)cc(S(C)(=O)=O)c1	784821593	WHGLRICUJZOPCX-UHFFFAOYSA-N	440.865	1.397	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1ccnn1CC1CC1	784832947	IEWWBCBLMHBVJS-UHFFFAOYSA-N	434.522	1.452	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2cccc(S(C)(=O)=O)c2)cc1Br	784839664	NNYDBBLVBVHZKA-UHFFFAOYSA-N	442.291	1.943	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)C(=O)Nc2ccc(S(=O)(=O)N(C)C3CC3)cc2)c1	784853997	TYLCDVYRNFHSOD-UHFFFAOYSA-N	446.485	1.338	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2ccc(OCC(F)(F)F)nc2)n1	785225192	GANYCNVUHDYAKQ-UHFFFAOYSA-N	427.387	1.741	50	20	IDGD	
COc1ccc(C(=O)CNC(=O)CCC(=O)NNc2nnc(-c3ccccn3)s2)cc1	788557994	DRYQTRVFYXQEOV-UHFFFAOYSA-N	440.485	1.831	50	20	IDGD	
Cc1cc(-n2cccn2)ccc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccc(F)cc1	789585019	VKNNVXLHHBETCJ-AWEZNQCLSA-N	425.420	1.873	50	20	IDGD	
CCNC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)c1C	789740991	MDZOMIRBNIVGOT-ZDUSSCGKSA-N	445.451	1.829	50	20	IDGD	
CCn1c(=O)n(CC(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)c2ccccc21	792737525	DJYUAPKGAUOAJL-UHFFFAOYSA-N	430.848	1.481	50	20	IDGD	
CN(C)N(C(=O)c1ccc(NS(=O)(=O)c2ccccc2)cc1)[C@@H]1CCS(=O)(=O)C1	792850023	NKVJIGVQCVRXPP-QGZVFWFLSA-N	437.543	1.593	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NN=Cc1c(Br)n[nH]c1Br	793038918	GZJLHKHTDWPEAV-UHFFFAOYSA-N	425.081	1.910	50	20	IDGD	
COc1ccc(-n2cc(O)c(C(=O)NNC(=O)CNC(=O)OCc3ccccc3)n2)cc1	794065089	SISNENMPMYAHKH-UHFFFAOYSA-N	439.428	1.274	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)c2ccc(Br)c(S(=O)(=O)N(C)C)c2)n1	794089390	FHECWRSBJFTGQJ-UHFFFAOYSA-N	441.307	1.478	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN([C@@H]2CCN(CC(=O)NNC(=O)c3ccccc3)C2)CC1	796621765	QHNDDHCGOHMEID-GOSISDBHSA-N	431.537	1.075	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)NNC(=O)C(=O)Nc1ccc(F)c(N2CCOC2=O)c1	796989284	DPGGSFCVEUBQSC-UHFFFAOYSA-N	439.403	1.592	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2cccc(C(=O)N3CCc4ccccc43)c2)n1	797369741	HCUJUJGHGHDCKV-UHFFFAOYSA-N	443.463	1.993	50	20	IDGD	
Cc1ccccc1NC(=O)NNC(=O)C[C@H](C)NS(=O)(=O)c1cccnc1Cl	798313820	VZTVNCJMFKQIQQ-LBPRGKRZSA-N	425.898	1.953	50	20	IDGD	
O=C(NNC(=O)N1CCC(CNC(=O)C(F)(F)F)CC1)c1cc(Br)c[nH]1	798508706	MTAFLTAVVYZDNK-UHFFFAOYSA-N	440.220	1.522	50	20	IDGD	
Cc1cc(O[C@H]2CCN(C)C2=O)ccc1NC(=O)C(=O)NNc1cccc([N+](=O)[O-])c1C	799261830	DGBYENCMXKXMGM-SFHVURJKSA-N	441.444	1.903	50	20	IDGD	
COc1cccc(C(=O)NNS(=O)(=O)c2ccc(OCCBr)cc2)c1O	799523214	CXEBPQVAMHQCIJ-UHFFFAOYSA-N	445.291	1.798	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)NCCNS(=O)(=O)c1ccc(Cl)cc1F	799668614	JQWLEXACSQWXRN-UHFFFAOYSA-N	446.863	1.470	50	20	IDGD	
O=C(CSc1nnc2c(=O)[nH]c3ccccc3n12)NNC(=O)c1ccc([N+](=O)[O-])cc1	799826414	JWSIBCSBCFMJIJ-UHFFFAOYSA-N	439.413	1.032	50	20	IDGD	
CCSCCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	800731817	VXPHNUORUZYQLX-UHFFFAOYSA-N	428.580	1.948	50	20	IDGD	
COc1cc(C(=O)NCC(=O)NNC(=O)Nc2cc(F)cc(F)c2)cc(OC)c1OC	801999492	BWNDAFMDRRPFLQ-UHFFFAOYSA-N	438.387	1.573	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)NNC(=O)Nc2cc(OC)ccc2Cl)ccc1F	802110042	QCEYBQBWXDYTHZ-UHFFFAOYSA-N	430.845	1.862	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)Cc2ccncc2)c(C)cc1Br	806978657	CMIHYCCPMVXTPZ-UHFFFAOYSA-N	449.261	1.268	50	20	IDGD	
Cc1sc2ncnc(N3CCC(C(=O)NNC(=O)N4CCN(C)CC4)CC3)c2c1C	807383486	XDWAZDBXJBDDTM-UHFFFAOYSA-N	431.566	1.513	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc3c2COC3=O)cc1OC	808934857	WMZQCAZWIXUWQU-UHFFFAOYSA-N	427.413	1.554	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)C2(c3ccccc3)CC(=O)C2)cc1	809984149	VYZHLNNONJUZRR-UHFFFAOYSA-N	429.498	1.064	50	20	IDGD	
CN1C(=C(C#N)C(=O)COC(=O)[C@@]2(c3ccccc3)CNC(=O)C2)N(C)c2ccccc21	811236162	JTLXEQAPEULMBW-XMMPIXPASA-N	430.464	1.878	50	20	IDGD	
CN1CCN(C(=O)NNC(=O)Cc2sc(N3CCOCC3)nc2-c2ccccc2)CC1	811420990	QYQFYSAOOONQFF-UHFFFAOYSA-N	444.561	1.177	50	20	IDGD	
COc1ccc(N2C[C@@H](C(=O)NNc3ccc(S(=O)(=O)N(C)C)cc3)CC2=O)cc1	812731760	TVOGQOWAEFXCJS-AWEZNQCLSA-N	432.502	1.442	50	20	IDGD	
O=C(C[C@@H]1CCCC(=O)N1)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	813366470	MSOPVSOFKWXLBV-INIZCTEOSA-N	433.468	1.265	50	20	IDGD	
CCCN1C(=O)c2ccccc2N2C(=O)CC[C@@]12C(=O)NNc1nc(-c2cccnc2)no1	815547005	CSZVXPZXBVPFTN-JOCHJYFZSA-N	447.455	1.964	50	20	IDGD	
C[C@@H](Oc1ccccc1NC(=O)C(=O)NNC(=O)[C@H]1CCc2nncn2C1)c1ccccc1	815692478	RTJPXARNOGQLHI-WBVHZDCISA-N	448.483	1.767	50	20	IDGD	
N#CCCn1cc(/C=C(/C#N)C(=O)NCCCCS(N)(=O)=O)c(-c2ccccc2)n1	818124342	CYTDOERGMLWMQP-LGMDPLHJSA-N	426.502	1.556	50	20	IDGD	
O=C(NNC(=O)c1cccnc1-n1cccn1)c1cccc(S(=O)(=O)N2CCCC2)c1	887342108	JUZPEADMDNAUCV-UHFFFAOYSA-N	440.485	1.127	50	20	IDGD	
Cn1ccnc1[C@H](NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)c1ccc(F)cc1	914598287	WPZOWLMLLLZTMM-QGZVFWFLSA-N	435.423	1.269	50	20	IDGD	
CN(C)N(C(=O)Cc1csc(NC(=O)Cc2cccs2)n1)[C@H]1CCS(=O)(=O)C1	915140513	ANPGYHRYFUNNSS-ZDUSSCGKSA-N	442.588	1.421	50	20	IDGD	
C[C@H](CCC(=O)NNC(=O)c1ccccc1F)CC(=O)NNC(=O)c1ccccc1F	915806193	IWJARNKFMJZYSX-CYBMUJFWSA-N	432.427	1.993	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)NCCc2ccc3c(c2)OCO3)c2ccccc2c1=O	915933382	IWWIDSZCKPMYAT-UHFFFAOYSA-N	437.456	1.893	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NN=C1CCS(=O)(=O)c2ccc(F)cc21	916339565	QOAYUWQHUHRZOG-UHFFFAOYSA-N	438.506	1.739	50	20	IDGD	
C[C@@H]1C[C@@H](C)CN(CCCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)C1	916460308	HIJGUXKOXMWIGK-HZPDHXFCSA-N	439.582	1.249	50	20	IDGD	
COc1cc(C)c([C@H](C)NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1OC	916485036	XORCPUQABZTANL-ZDUSSCGKSA-N	439.472	1.964	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)NC[C@@H](c1ccccc1)N1CCOCC1	916509413	OBYTYFRRQAIDMI-APWZRJJASA-N	430.480	1.997	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)NCc1nncn1-c1ccccc1	916580627	LYPRGNGZAMFJIO-UHFFFAOYSA-N	448.531	1.310	50	20	IDGD	
CN(CC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)C(=O)c1ccc(Br)s1	916740749	JJCZRLYHMRZKDN-UHFFFAOYSA-N	441.263	1.952	50	20	IDGD	
CCn1cnc2c1c(=O)n(CC(=O)NN=Cc1cc(C)[nH]c1C)c(=O)n2Cc1ccccc1	917572583	SPQYEYFKOYYCJS-UHFFFAOYSA-N	447.499	1.523	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNS(=O)(=O)c2cc(S(C)(=O)=O)ccc2C)c1	917723545	QBEFGGVBVOYKKX-UHFFFAOYSA-N	428.488	1.039	50	20	IDGD	
CCNC(=O)COc1cccc(CNC(=O)NNC(=O)COc2cc(C)ccc2C)c1	918091523	WKVVPWIVYDCOPJ-UHFFFAOYSA-N	428.489	1.728	50	20	IDGD	
Cc1nn(Cc2ccccc2Cl)c(C)c1C(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1	919886550	XMPYMMDBEPHQIH-CQSZACIVSA-N	439.925	1.333	50	20	IDGD	
COc1cccc(C[C@H](C(=O)NNC(=O)NCCc2cccs2)n2nnnc2C)c1	920859957	ZDQGCWWLXVJSDK-QGZVFWFLSA-N	429.506	1.409	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2cccc(CN3C(=O)CNC3=O)c2)cc1OC	920929330	LRUFUNPNHMUYSG-UHFFFAOYSA-N	427.417	1.222	50	20	IDGD	
NC(=O)[C@@H]1CCCN1Cc1cccc(NC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c1	920929709	KMJZEVUFAJPABI-KRWDZBQOSA-N	426.433	1.511	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)COc2ccc(Br)cc2)cn1	920931452	SFTVFAOJVOWBFA-UHFFFAOYSA-N	443.279	1.479	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)NC[C@@H](c1cccc(F)c1)N1CCOCC1	921247610	ISKFSLVPKZCTGL-SFHVURJKSA-N	434.443	1.748	50	20	IDGD	
Cn1cc(S(=O)(=O)N2CCOCC2)cc1C(=O)NNc1cccc(Br)c1	932494925	RXYCTTUXDQNRMV-UHFFFAOYSA-N	443.323	1.565	50	20	IDGD	
O=C(NNC(=O)c1ccccc1Cl)NC1CCN(S(=O)(=O)C(F)(F)F)CC1	1319564597	PCTQLILHHNIECH-UHFFFAOYSA-N	428.820	1.598	50	20	IDGD	
C=C(C)CC(C)(C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)C2	1779512616	CQNOOYWIRZDVFH-WZONZLPQSA-N	436.597	1.866	50	20	IDGD	
O=C(c1cnc(-c2ccccc2)s1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1779750282	IJHGOUDLLFAZNK-MGPUTAFESA-N	435.933	1.853	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnn(C)c2Cl)C1	1779929864	FNCWFKHTWBAMAK-HBUWYVDXSA-N	433.336	1.455	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc(C)nc2O)C1	1780141824	UUMDYZZCLJVAFI-JXXFODFXSA-N	425.913	1.477	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)C3CN(C(=O)OC(C)(C)C)C3)CCO2)C1	1781218714	JOGGIYVMVPYZPD-YWZLYKJASA-N	429.945	1.701	50	20	IDGD	
C[C@H](Nc1nccs1)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781332106	ZUYPGTSOVGWJDD-FIXISWKDSA-N	435.319	1.464	50	20	IDGD	
O=C(c1ccc2ccnn2c1)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1782404382	CDUALQXRPAMHER-WMLDXEAASA-N	425.258	1.468	50	20	IDGD	
C[C@H](CN)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](Br)Cc3ccccc3)C2)C1	1783022932	MZFVQSWFVFVPEJ-OXFYSEKESA-N	438.366	1.417	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)/C=C3\C(=O)Nc4ccccc43)CCO2)C1	1783877612	LXHFQQGBUFNJLL-ZCCVTUMWSA-N	433.892	1.106	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cc(-c4ccccc4)[nH]n3)CCO2)C1	1783882320	QEOSRAJMUJPWML-HRAATJIYSA-N	432.908	1.774	50	20	IDGD	
O=C(c1ccc(OCCCO)cc1)N1CCO[C@@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783948509	RFYAEZLYSBJHQA-LJQANCHMSA-N	431.316	1.695	50	20	IDGD	
Cc1cc(C)n(CCC(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)n1	1784319262	NDULHPYYPDQMAU-IFXJQAMLSA-N	441.370	1.751	50	20	IDGD	
CCOCCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2	1784689243	DSZDCUMMHJJSRG-YWZLYKJASA-N	447.960	1.375	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCBr)[C@H]2C1)n1ccccc1=O	1786406493	WNCUEHFFBXQIIH-UGUYLWEFSA-N	440.338	1.174	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccn(C(F)F)n3)C[C@@H]21	1786406589	YYAZEXPTAXGYLR-GVXVVHGQSA-N	435.269	1.657	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](N)c3cccc(Cl)c3)[C@H]2C1	1786886389	WDLSLUAIIHLFCA-HILJTLORSA-N	444.359	1.573	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]2C1)N(C)C(=O)OC(C)(C)C	1787448642	DHJSVUTUHLKCEJ-QTVXIADOSA-N	435.924	1.756	50	20	IDGD	
CCC[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]21)n1cccc1	1787465941	HFVDLIDGVPDSLW-HAGHYFMRSA-N	447.580	1.182	50	20	IDGD	
COc1cccnc1CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]2C1	1788765990	YWIJFMUIGUGLLI-ZWOKBUDYSA-N	449.624	1.854	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4cccnn4c3)C[C@@H]21	1791063675	PEZYTNNZABPNRP-OQUILHJVSA-N	435.322	1.711	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nc4ccccn4c3C)C[C@@H]21	1791253794	GTDAHPXBNLRFQU-QAETUUGQSA-N	434.924	1.490	50	20	IDGD	
COc1ccsc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)CBr	1792872351	AUKKAFKLZUZKNY-FMSGJZPZSA-N	431.352	1.991	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3cccc(F)c3s1)C2)[C@H](O)CCl	1792978433	VOVJJFMFCYHSKN-FAXLKDOZSA-N	426.897	1.843	50	20	IDGD	
C[C@H](CNC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2	1792994004	UCSMNCWMQPLXJD-FVCCEPFGSA-N	438.352	1.541	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)COc1cccnc1	1793937985	HGCFDXZQUNIOQP-YXPYIKCWSA-N	426.311	1.224	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCc1cc(F)ccn1	1794026484	ICFPORIMDMGFDY-OESLAJAZSA-N	432.323	1.979	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CSC(=N)N)C2	1794142834	WKOVPFPAOWGYRH-RNJOBUHISA-N	447.989	1.383	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(C(F)(F)F)nc1)c1cccc(B(O)O)c1	1795172114	LJXUZOPSYYENLS-BJWYYQGGSA-N	447.222	1.346	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1nccn1C	1795247850	WWTVVIDJDFRWPT-QDMKHBRRSA-N	441.444	1.819	50	20	IDGD	
COc1cc(OC)c(F)c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](O)CCl)C3)c1F	1795927507	NSGCRMZKSLDOFI-USZNOCQGSA-N	432.851	1.834	50	20	IDGD	
C[C@H](Nc1nccs1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2	1796412145	HSWGLSSEKLCOKB-FMSGJZPZSA-N	431.356	1.318	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2)c1n[nH]c2ccc(F)cc12	1797478817	DHEXFGVIAKKZDV-CULMDFNYSA-N	439.285	1.690	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc3[nH]ccc3s1)C2	1798440203	GHAURVBMWOQVHU-CLLJXQQHSA-N	438.513	1.794	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1(F)CC1)C2	1798523124	SDLWMFOGEHZRQU-FVCICTRLSA-N	435.408	1.225	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2)C1CCN(c2ccccn2)CC1	1799088839	KWWQQMKNNYJFON-SCAQPMJSSA-N	441.359	1.691	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCCc1cccnc1)C2)[C@H](F)Br	1799352353	RVBZQMHJLHGGNT-FSDCSDTHSA-N	428.302	1.684	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc2c1NC(=O)C2	1800031582	DZURLMQHCNTKFU-YGSHXTJESA-N	436.306	1.168	50	20	IDGD	
CC(=O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C#N)=C/c1ccc(Br)cc1	1800333723	HWYZWGXEZPVLQO-BXOWQRHZSA-N	446.301	1.535	50	20	IDGD	
CC[C@@H](O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](Br)Cc1ccccc1	1800433385	IVUPHIMRJJZLGZ-CWQOZTLDSA-N	439.350	1.353	50	20	IDGD	
COc1ccc(Cl)c(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](O)CCl)C3)c1F	1801078403	UBGXWRRCWKSEBO-WZTYKQCMSA-N	449.306	1.220	50	20	IDGD	
CCOC(=O)N(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2)Cc1ccco1	1801236411	GZHKVKRMAZXEDH-DLTLXFJOSA-N	445.875	1.362	50	20	IDGD	
C[C@H](Oc1ccccn1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2	1801361760	GQIFTXVEAIYAIJ-ZJOBFFGXSA-N	426.311	1.224	50	20	IDGD	
CC[C@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CNC(=O)c1ccco1)C2	1801798514	RCSQHXQDIKLUIM-CRWXNKLISA-N	426.311	1.821	50	20	IDGD	
Cc1nccn1CCCC(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1	1803145533	DPCKHOLOULMANA-HBFSDRIKSA-N	433.940	1.672	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cccc3ccnn23)[C@H]1c1cccnc1)[C@@H](O)CCl	1803146485	BFGSIFAGJZYQLT-SNRMKQJTSA-N	427.892	1.649	50	20	IDGD	
COc1ccc(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)cc1F	1803208425	PMGDCGZGVPFYHB-REPLKXPHSA-N	440.280	1.009	50	20	IDGD	
O=C(CCC1CCC1)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1803370123	JQMDEYHILXQWCM-NZQKXSOJSA-N	435.333	1.661	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@H]1CCN(C(=O)CN2CCCC2=O)[C@@H]1c1cccnc1	1810542018	VILSCWYMVFIBKX-DYESRHJHSA-N	432.597	1.561	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2cnn3ncccc23)[C@H]1c1cccnc1	1813031197	PDBPFBAMJPPGKP-AYBZRNKSSA-N	442.907	1.698	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2cnc3[nH]ncc3c2)[C@H]1c1cccnc1	1813031210	RAFWDSPNYQQYTC-WBAXXEDZSA-N	442.907	1.926	50	20	IDGD	
COC[C@H](NC(C)=O)C(=O)N1CC[C@@H](CNC(=O)C(Cl)Cl)[C@H]1c1cccnc1	1813078023	MUWCRROHMGZRJK-SOUVJXGZSA-N	431.320	1.042	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1CCc2nc(NC(=O)CC3CC3)sc2C1	1814255793	OSHOVELUOCXGDD-OBPDLJBASA-N	428.518	1.989	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](C)CS(C)(=O)=O)n[nH]1	1815232082	FYEGHEPSJGTUPH-GVXVVHGQSA-N	449.371	1.866	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H]2CNC(=O)O2)n[nH]1	1815276067	XNTIMKMRCXQVAY-JLLWLGSASA-N	428.287	1.541	50	20	IDGD	
Cc1nn(C)c(C)c1C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1	1815395505	ZYLKBVGUJTVWAW-MRXNPFEDSA-N	444.540	1.439	50	20	IDGD	
Cc1ccncc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1	1817471622	KEIXYZXOIZZSEK-LJQANCHMSA-N	433.277	1.413	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)C(F)(F)Cl)[nH]n1)c1cccc(B(O)O)c1	1817479805	RTUJXYOKHRGICO-CYBMUJFWSA-N	426.616	1.227	50	20	IDGD	
CC(=O)Nc1cc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@@H](O)CCl)CC3)ccn1	1817904039	AZZDPANIZOXROI-YPMHNXCESA-N	437.909	1.322	50	20	IDGD	
COCC1(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cnccc3C(=O)NN)n[nH]2)CC1	1819401535	GRICTVGMMGFRLV-INIZCTEOSA-N	441.492	1.141	50	20	IDGD	
O=C1C[C@H](C(=O)N2CCCC[C@H]2c2cc(NC(=O)[C@H](F)Br)n[nH]2)CCN1	1820936928	IFWZZGZUGQNFGG-PUYPPJJSSA-N	430.278	1.619	50	20	IDGD	
COC(=O)[C@@H]1CC[C@H](C(=O)N2CCC([C@@H]3CCCCN3C(=O)[C@H](O)CCl)CC2)C1	1824176529	OXWWIOCBADWBEJ-XWTMOSNGSA-N	428.957	1.795	50	20	IDGD	
CCOc1ccc(C(=O)N[C@H]2CCc3nc(NC(=O)[C@H](Cl)COC)sc3C2)nn1	1826003284	JVRFYUHIFALTHO-WDEREUQCSA-N	439.925	1.811	50	20	IDGD	
COCc1c[nH]c(C(=O)N[C@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)c1	1826088660	ZQFOADMZCNYVRU-ZDUSSCGKSA-N	448.549	1.216	50	20	IDGD	
Cc1cn(CC(=O)Nc2nc3c(s2)C[C@@H](NC(=O)C(Cl)Cl)CC3)c(=O)nc1O	1827994123	HSSKGTBDDWRWSM-QMMMGPOBSA-N	446.316	1.130	50	20	IDGD	
O=C(N[C@@H]1CCc2nc(NC(=O)C3CCSCC3)sc2C1)c1cccc(B(O)O)c1	1828335883	FIDMKXQLYUEOPP-OAHLLOKOSA-N	445.375	1.192	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cn3cnc4ccccc43)C2)C1	1830369905	FGNYXQPUTBYJLA-QFIPXVFZSA-N	448.951	1.758	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3CCCN3C(C)C)C2)C1	1831659789	VQLTXZALKNKXEB-WFXMLNOXSA-N	429.989	1.723	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CSc2nc[nH]n2)CC1	1831838062	YOMPYYSCBVNOLB-GJZGRUSLSA-N	429.974	1.770	50	20	IDGD	
CCc1cc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)nn1C	1831873231	FDPMTYXKSZACPU-FQEVSTJZSA-N	446.596	1.589	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3cccnc3Cl)CCO2)C1	1832720718	OSGLGWXVGCJVMQ-BEFAXECRSA-N	430.332	1.751	50	20	IDGD	
COc1cnc(C(=O)N2CCO[C@@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)c(F)c1	1833628432	SRLDHPAEHUVSFE-FQEVSTJZSA-N	443.903	1.564	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](C)CBr)C3)C2)cn1	1833991501	UPVYASMOVYNNAG-IFXJQAMLSA-N	440.338	1.491	50	20	IDGD	
Cn1ccc(C(=O)NC2CCN(C3CCN(C(=O)[C@H](F)Br)CC3)CC2)n1	1834218380	VQSIUPJSPUYLQI-HNNXBMFYSA-N	430.322	1.296	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCC(N2CCC(NC(=O)CCSC(=N)N)CC2)CC1	1834705918	MXNPYEZCDXJLDX-UHFFFAOYSA-N	432.034	1.840	50	20	IDGD	
CO[C@H](C(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)c1ccccc1	1836716874	VZUZNQYHZPABDZ-PMACEKPBSA-N	438.952	1.972	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C1(C(F)(F)F)CC1)CCO2	1836720873	WLBCUMJPVUTYIU-FZMZJTMJSA-N	443.260	1.569	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3sc(N)nc3C)CC2)CC1	1837895785	VCKUMVUVPCZDFW-HNNXBMFYSA-N	444.985	1.900	50	20	IDGD	
O=C(Cc1cnc[nH]1)N1CCC(OC2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1838072554	HNQHVQLCOWPJDZ-MRXNPFEDSA-N	431.306	1.641	50	20	IDGD	
Cc1nccnc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1	1838217010	QMEMPISCTGZQIX-QZTJIDSGSA-N	431.320	1.091	50	20	IDGD	
CCC1(C(=O)N2CCC(OC3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)CCC1	1838295152	JOZMAKCEKHWMCJ-UHFFFAOYSA-N	436.597	1.938	50	20	IDGD	
Cc1ccccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1838900169	OWCVUOCWWPQUQT-QAPCUYQASA-N	429.286	1.756	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3ccc(F)nc3)C2)C1	1839142496	QHSAGNXFRZNWHJ-OXQOHEQNSA-N	427.904	1.627	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3n[nH]c(C4CC4)c3F)C2)C1	1839143434	WEXKMLWUGCXCPX-BFUOFWGJSA-N	428.892	1.514	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H](F)Br)CCO2)C1	1839198593	KDEUMIMSMFXRGS-IAQYHMDHSA-N	429.714	1.398	50	20	IDGD	
CCc1ncccc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)Br)CCO2	1840031556	UETWXCIZSYJTGU-LIRRHRJNSA-N	440.338	1.497	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3cnc4[nH]ccc4c3)CCO2)C1	1840081502	RJZDTKMRZOGOLS-AVRDEDQJSA-N	448.951	1.969	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CNc3ccccc3C)C2)C1	1840152095	XGGGJPXPGIJBCC-DYESRHJHSA-N	439.940	1.117	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3c(C)nn(C)c3C)CCO2)C1	1840436832	AWKDTCRFGZFJOP-FXAWDEMLSA-N	426.945	1.053	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1nc3ccccc3[nH]1)C2	1843415980	KSGMFQBJUJIRMR-VULFUBBASA-N	433.472	1.514	50	20	IDGD	
COc1cc(C#N)cc(C(=O)N2CC3(CCCN3C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)c1	1843416492	QMIQOIJOGMZHBC-CVKSISIWSA-N	448.483	1.518	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)c2cc(Br)cs2)C1	1843445619	JGBJEDROTADEAL-UHFFFAOYSA-N	449.135	1.321	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)N1CCCC12CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)C2	1844372269	ALBXIBNIWLMSLS-BRYYZUPOSA-N	428.439	1.766	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)[C@H]1CCCCN1C)C2	1844692017	YIVDHPPCOQANDG-GOSISDBHSA-N	444.488	1.821	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC2(CCCN2C(=O)c2ccc([N+](=O)[O-])c3c2OCO3)C1	1844758773	WQHAENXHKWOJEG-SNVBAGLBSA-N	440.250	1.924	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@H]2CN(C(=O)OC(C)(C)C)C[C@H]2O)C1	1845104034	RQURVMHVDVGOTO-HRCADAONSA-N	443.972	1.825	50	20	IDGD	
O=C([C@@H]1C[C@@]12C(=O)Nc1ccccc12)N1CC2(CCCN2C(=O)[C@H](F)Br)C1	1845219612	AIJIEIAWCBQOKM-PJFSTRORSA-N	436.281	1.790	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@@H](O)CC(=O)N1CCCC12CN(C(=O)CO[Si](C)(C)C)C2	1845230565	NVWOCOJGEGAEDN-HNNXBMFYSA-N	443.617	1.317	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2ccc(OC(F)F)cc2)C1	1845378028	PXSLEOWWAKRBNY-UHFFFAOYSA-N	445.426	1.417	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)c2ccccc2N2CCCCC2)C1	1845511239	RZLAZQYWNPOFGR-UHFFFAOYSA-N	447.344	1.488	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cncc(S(C)(=O)=O)c1	1848329366	GBEYTCHUZCVFMZ-SWHYSGLUSA-N	430.324	1.084	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2ccc(O)c(C(=O)NNC(=O)c3ccccn3)c2)cc1	14049414	FESILYZDWMLKSZ-UHFFFAOYSA-N	442.453	1.671	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)CCn3c(=O)[nH]c(=O)c4ccccc43)cc2C1	24310280	UEPAVAVTRUTOGR-LBPRGKRZSA-N	426.498	1.727	50	20	IDGD	
C=CCn1c(S)nc2cc(C(=O)NNC(=O)[C@H]3COc4ccccc4O3)ccc2c1=O	26975642	PKCGYIOVMLUHLV-QGZVFWFLSA-N	438.465	1.472	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Cc2c(C)nc3nc(SC)nn3c2C)cc1OC	27601198	MQGSUKIVDBEUNO-UHFFFAOYSA-N	430.490	1.484	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CSc2nnnn2-c2cccc(C)c2)cc1OC	28630000	GQRXXVMCPDQPQL-UHFFFAOYSA-N	428.474	1.541	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CCNC(=O)c2[nH]nc3ccccc23)cc(OC)c1OC	116707499	WBODLMROPSXSME-UHFFFAOYSA-N	441.444	1.170	50	20	IDGD	
Cc1ccc(C(=O)NCCC(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)c(O)c1	726207810	TYNUTPLUSDEQPD-UHFFFAOYSA-N	433.848	1.478	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)NCc2ccc(C(=O)NNC(=O)c3ccc[nH]3)cc2)cc1	726630617	PNUDRCBIOBSWHC-UHFFFAOYSA-N	440.481	1.771	50	20	IDGD	
O=C(CN[C@H](CN1CCOCC1)c1ccccc1)NNC(=O)c1cccc([N+](=O)[O-])c1	727384142	LWUIVYJJZNROFI-LJQANCHMSA-N	427.461	1.019	50	20	IDGD	
CC(=NNC(=O)CSc1nnc(O)nc1O)c1ccccc1I	727776660	ARGYHPARGSXMJX-UHFFFAOYSA-N	445.242	1.520	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN1c1ncnc2sccc12)c1ccc(-n2cnnn2)cc1	728513261	VBMMCVNGWCZBIR-OAHLLOKOSA-N	435.473	1.097	50	20	IDGD	
CC(=O)Nc1cccc(OCCNC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c1	729230680	MXJYVPYZNORMCY-UHFFFAOYSA-N	434.474	1.072	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)Cc2ccccc2Br)ccc1Cl	729300017	JFKJFTNZMHROQA-UHFFFAOYSA-N	446.710	1.754	50	20	IDGD	
C[C@@H]1CC(C)(C)C[C@@]2(C1)NC(=O)N(CC(=O)NNC(=O)Cn1ccc3ccccc31)C2=O	729450439	VFRZQPJKQDAAFC-IQMFZBJNSA-N	439.516	1.926	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)Cc1ccc(S(=O)(=O)N2CCCCC2)cc1	730780747	UZCPCHPRIKAUML-UHFFFAOYSA-N	447.513	1.336	50	20	IDGD	
COc1ccc(Cl)cc1N1C[C@@H](C(=O)NNC(=O)COc2ccccc2O)CC1=O	730782231	JQNIHMCNDCSSSN-LBPRGKRZSA-N	433.848	1.634	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)NCCC(=O)NNC(=O)C(C)(C)c2ccccc2)cc1	731232000	AWMYKHBZPSYSGT-UHFFFAOYSA-N	446.529	1.439	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)CN1C(=O)N[C@](C)(c2ccc(F)cc2)C1=O)c1ccccc1	731998182	ZEFQDDFDFLXJBR-VGOFRKELSA-N	426.448	1.934	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)c1ccc(F)c(S(=O)(=O)N2CCOCC2)c1)c1ccccc1	731999434	UIWQFDAFWZQNRR-KRWDZBQOSA-N	449.504	1.801	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2ccc(COc3ccc(C#N)cc3)o2)C[C@H](C)O1	732261720	FNVHFIRWXXAVSG-HOTGVXAUSA-N	426.473	1.991	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)c1ccn(S(=O)(=O)c2ccc(C)cc2)c1	732263693	KIKCTMXXZLIXTL-UHFFFAOYSA-N	442.497	1.915	50	20	IDGD	
N#Cc1ccc(N2C(=O)N[C@H](CCC(=O)NNC(=O)c3cccc4ncccc34)C2=O)cc1	733775642	KLBHCNKWKLSOKU-LJQANCHMSA-N	442.435	1.773	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)C1CCN(c2nc3ccccc3o2)CC1	734239875	YHODSTOAMZQFKL-UHFFFAOYSA-N	446.508	1.899	50	20	IDGD	
CN(C)[C@@H](CNC(=O)NNC(=O)COc1ccccc1[N+](=O)[O-])c1c(F)cccc1F	734675957	RFQIJOGQOUSIJI-HNNXBMFYSA-N	437.403	1.885	50	20	IDGD	
Cc1c(C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)oc2ccc(F)cc12	735116703	CLDOQDOURNFHOG-UHFFFAOYSA-N	447.492	1.968	50	20	IDGD	
C[C@@H](Oc1cccc(F)c1)C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	735117754	HOOKISUYJHUUFD-CQSZACIVSA-N	437.497	1.067	50	20	IDGD	
CS[C@@H]1CCC[C@@H](NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)C1	735385454	ZMIGLOQLTSDTRD-HUUCEWRRSA-N	428.580	1.620	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)c1ccc(C)cc1)C(=O)NNc1ncnc2[nH]cnc12	740746407	ALSDHSAIOVVHPP-CYBMUJFWSA-N	435.535	1.205	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)c1cc(S(C)(=O)=O)ccc1Cl	740826086	ZNRIIRWCPKAVTF-UHFFFAOYSA-N	434.902	1.212	50	20	IDGD	
O=C(COC(=O)[C@H]1CCCN(C(=O)COc2ccccc2)C1)NNC(=O)c1cccs1	741370380	CZQFBQDLZJELRQ-HNNXBMFYSA-N	445.497	1.370	50	20	IDGD	
COc1ccc(Br)c(C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)c1	744558256	NUBDKIXSFUXXDD-UHFFFAOYSA-N	432.230	1.947	50	20	IDGD	
O=C(COC(=O)[C@@H]1C[C@]12CCCc1ccccc12)NNC(=O)[C@H]1COc2ccccc2O1	745713159	AVMKBRAMBLXLDP-IQOKHDRSSA-N	436.464	1.811	50	20	IDGD	
Cn1ncnc1COc1ccc(S(=O)(=O)NNC(=O)CCCc2ccccc2)cc1	746591580	NBWZOGQDEMLZHG-UHFFFAOYSA-N	429.502	1.727	50	20	IDGD	
Cc1nn([C@H]2CCS(=O)(=O)C2)c2nc(C3CC3)cc(C(=O)NNC(=O)c3ccc[nH]3)c12	747663219	DBOGOIAPBQGCRW-ZDUSSCGKSA-N	442.501	1.380	50	20	IDGD	
O=C(Cc1csc(N2CCCC2=O)n1)NNc1nc(Br)cn2ccnc12	750246001	HAOVNAAJGVXPRF-UHFFFAOYSA-N	436.295	1.761	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(OCC(=O)NNc2nc(Br)cn3ccnc23)C1	751071002	PBKZOKICBGMPAE-UHFFFAOYSA-N	441.286	1.571	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNS(=O)(=O)c2cnn(Cc3ccccc3)c2)cc1C	751267884	OMCKPLQZRREIAO-UHFFFAOYSA-N	427.486	1.496	50	20	IDGD	
C[C@H]1CCN(c2cc(C(=O)OCC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)ccn2)C1	752607506	ODYACXCGJNROHM-ZDUSSCGKSA-N	427.417	1.454	50	20	IDGD	
COc1ccc([C@@H](NC(=O)NNC(=O)C(=O)N2CCCC2)c2ccccc2OC)cc1	752697917	GJBGYWGOLRJEJC-LJQANCHMSA-N	426.473	1.746	50	20	IDGD	
COC(=O)c1cc2c(cc1NC(=O)C(=O)NN=c1sc3ccccc3n1C)OCO2	753842609	UIUXNLNJUMHQEZ-UHFFFAOYSA-N	428.426	1.326	50	20	IDGD	
CSCC[C@H](NC(=O)c1ccc2ccccc2n1)C(=O)NNC(=O)Cc1cc[nH]n1	755280116	UYOZVKDJRWHALN-KRWDZBQOSA-N	426.502	1.200	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Nc2ccc(C)c(-n3cnnn3)c2)cc(OC)c1OC	755687234	PHIQKCLNVOBBBD-UHFFFAOYSA-N	427.421	1.463	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)Nc1ccc(Cl)c(C(=O)NC2CC2)c1	756016000	YHAYLZSTBFVJPK-UHFFFAOYSA-N	440.851	1.674	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1C(N)=O	756325875	BGZATAXJOPZDFR-UHFFFAOYSA-N	445.501	1.345	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)Nc1cnn(CC2CC2)c1	756813215	LTUCMPNMYPKXDG-UHFFFAOYSA-N	446.533	1.934	50	20	IDGD	
COC(=O)c1ccc(NC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1C(=O)OC	756819120	QKABQAAAVMNRTA-UHFFFAOYSA-N	437.412	1.912	50	20	IDGD	
COC(=O)c1cc(NC(=O)NNC(=O)c2cccc3cccnc23)cc(S(C)(=O)=O)c1	757673781	JLODSMAGODEZHK-UHFFFAOYSA-N	442.453	1.891	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)Nc1c(C)nn([C@H]2CCS(=O)(=O)C2)c1C	757870910	BNRCSTBXJKNDCH-HNNXBMFYSA-N	435.506	1.264	50	20	IDGD	
COC(=O)C[C@H](C)C(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	758378466	NYOPWMNSSBBXRA-NSHDSACASA-N	425.488	1.509	50	20	IDGD	
COc1cc(OC)cc(N2CCCN(CC(=O)NNC(=O)c3cccc(C)c3)CC2)c1	758740909	AUCSOZVODJXKGU-UHFFFAOYSA-N	426.517	1.986	50	20	IDGD	
CCn1c(SCC(=O)NNC(=O)C(=O)Nc2ccccn2)nnc1-c1cccs1	758831433	BMMSLJDLYVQULJ-UHFFFAOYSA-N	431.503	1.300	50	20	IDGD	
C[C@@H]1Cc2ccccc2N1C(=O)[C@@H]1CCCC[C@H]1C(=O)NNC(=O)C(=O)Nc1ccccn1	758835510	WSYHCQUKQOHABP-KBAYOESNSA-N	449.511	1.952	50	20	IDGD	
COc1cc(CCC(=O)NNC(=O)C(=O)Nc2ccccn2)ccc1OCC(F)(F)F	758839206	BTWHOUQSEYUCIX-UHFFFAOYSA-N	440.378	1.750	50	20	IDGD	
Cc1[nH]c2ccc(Br)cc2c1CC(=O)NNC(=O)C(=O)Nc1ccccn1	758841778	SHLXMLPWUAJXKL-UHFFFAOYSA-N	430.262	1.962	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)c1cnn(-c2ccccc2)c1Br	760225777	HUWBZRKKIBMALF-UHFFFAOYSA-N	448.302	1.887	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)c1cnn(-c2ccccc2)c1Br	760381721	ZCFWZJKMSHMKDM-UHFFFAOYSA-N	443.261	1.221	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)c1	761790228	KCOSFVVJHHIALT-LJQANCHMSA-N	426.473	1.839	50	20	IDGD	
CCN1CCC[C@@H]1CN1C[C@@H](C(=O)NNC(=O)CSc2ccccc2OC)CC1=O	762361630	PHURTORJYDDFRF-JKSUJKDBSA-N	434.562	1.268	50	20	IDGD	
COC(=O)c1cn([C@@H]2CCCN(C(=O)NNC(=O)c3cc4c(s3)CC[C@@H](C)C4)C2)nn1	762556759	QPOICIWKTXEQSM-TZMCWYRMSA-N	446.533	1.943	50	20	IDGD	
O=C(NNc1nccc(N2CCOCC2)n1)c1ccc2c(=O)n3c(nc2c1)CCCCC3	762856857	YKBYFKZFMWEWCA-UHFFFAOYSA-N	435.488	1.506	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)c2ccc(S(=O)(=O)Nc3nccs3)cc2)n1	762964947	UFYLFCBQCITSOR-UHFFFAOYSA-N	434.503	1.218	50	20	IDGD	
CC(=O)N1CCCc2cc(NC(=O)C(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)ccc21	763444593	VLKBCSIHZRSPCJ-UHFFFAOYSA-N	425.401	1.294	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2F)cc1C(F)F	763556306	NWVHTLFPOFYAGD-UHFFFAOYSA-N	429.376	1.567	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccccc2I)c(C)o1	763583340	MVQIXXOWTXOOTL-UHFFFAOYSA-N	427.198	1.901	50	20	IDGD	
Cn1c(=O)oc2c(NC(=O)C(=O)NNC(=O)COc3ccc(C(C)(C)C)cc3)cccc21	763600730	STKZKIOQVVVIRY-UHFFFAOYSA-N	440.456	1.594	50	20	IDGD	
COC(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)c2c(C)nc3ccccn23)c1	763625457	RJKNUDCQMZZIRU-UHFFFAOYSA-N	429.820	1.482	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccccc1O[C@@H]1CCOC1	763658607	YWYZKYMGYTYGIO-CQSZACIVSA-N	429.429	1.028	50	20	IDGD	
COC(=O)NCc1ccc(NC(=O)C(=O)NNC(=O)COc2cc(C)ccc2C)cc1	763669289	WBNHUAOFCDKJDP-UHFFFAOYSA-N	428.445	1.324	50	20	IDGD	
CCS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)cc1	763686392	LQYUKWOQZORYMH-UHFFFAOYSA-N	439.877	1.299	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccccc1N1CCOC1=O	763713700	OATWEPANIUGGBN-UHFFFAOYSA-N	426.429	1.371	50	20	IDGD	
CCOC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)cc1	763745754	JUVFKJSPZFOXFE-UHFFFAOYSA-N	439.472	1.794	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)C(=O)Nc2cnn(C(C)C)c2)c2ccccc2c1=O	763801513	UPUKLMAWBSBRPV-UHFFFAOYSA-N	439.476	1.374	50	20	IDGD	
CC[C@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C)cc2)cc1	763811194	GTOMFPNQTVLCAL-HNNXBMFYSA-N	426.473	1.688	50	20	IDGD	
CC(C)C(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)c1	763865884	LXMFDOYNHNORER-CYBMUJFWSA-N	430.436	1.974	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(C)c([N+](=O)[O-])c2)cc1	763872573	ONCIZRRZMIIJSU-CYBMUJFWSA-N	428.401	1.659	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)OC(F)(F)O3)cc1	763873688	XNZHWFVSHVDDFN-LLVKDONJSA-N	449.366	1.764	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(C(N)=O)ccc2F)cc1OC	763912765	SOAIHYADJMUGEJ-UHFFFAOYSA-N	432.408	1.122	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)C(=O)Nc1ccccc1Oc1ccccc1	763917090	PGAPCIBISXXYDR-UHFFFAOYSA-N	443.423	1.854	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2ccc(Br)s2)cc(OC)c1	763942455	ZVENCXBFEJWLKG-UHFFFAOYSA-N	428.264	1.928	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)C(=O)Nc1cnn(Cc2ccccc2)c1	763994541	DVIJEKTWDJKIDW-UHFFFAOYSA-N	431.250	1.422	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)cc1	763995938	SHEYUJKFTJUAEQ-UHFFFAOYSA-N	425.239	1.202	50	20	IDGD	
O=C(NNC(=O)c1cccc2ccccc12)C(=O)Nc1cccc(C(=O)N2CCOCC2)c1	764059053	YNIXFDRIPCPYAR-UHFFFAOYSA-N	446.463	1.712	50	20	IDGD	
COCCOc1cccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(C)cc3)[nH]n2)c1	764111169	OMAXFXGAOKPQPV-UHFFFAOYSA-N	437.456	1.810	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2O1)C(=O)Nc1cccc2c1CN(c1ccccn1)C2	764164757	SUZIMVMASPFVRZ-FQEVSTJZSA-N	443.463	1.691	50	20	IDGD	
O=C(NNC(=O)c1cccc(OC(F)F)c1)C(=O)Nc1cncc(Br)c1	764249582	BMGKOIZLVYOPBJ-UHFFFAOYSA-N	429.177	1.845	50	20	IDGD	
C[C@H]1Oc2ccc(NC(=O)C(=O)NNC(=O)c3cccc(OC(F)F)c3)cc2NC1=O	764249688	COGKXQUWVHPPAT-SECBINFHSA-N	434.355	1.407	50	20	IDGD	
O=C(NNC(=O)c1cc(F)ccc1Br)C(=O)Nc1ccn(CC(F)F)n1	764278692	WDCPUMNGPBMVEJ-UHFFFAOYSA-N	434.172	1.450	50	20	IDGD	
CCN1CCc2ccc(NC(=O)C(=O)NNC(=O)c3cc(Br)ccc3O)cc21	764280374	NRIFSPDOCDBVTJ-UHFFFAOYSA-N	447.289	1.937	50	20	IDGD	
O=C(CCN1C(=O)[C@@H]2CCCC[C@H]2C1=O)NNc1c(F)cc(C(=O)NC2CC2)cc1F	764333092	DKPDPURTZONPOA-ZIAGYGMSSA-N	434.443	1.865	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)COCc3ccccc3)cc2)CCO1	764365862	FYFGRRIJVPQNLU-INIZCTEOSA-N	426.473	1.214	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)N[C@H]3CCCC[C@H]3N3CCOCC3)n[nH]2)cc1	764374938	MMXCSYUOCIQVBL-FXAWDEMLSA-N	426.521	1.973	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)cc1S(C)(=O)=O	764382698	PVZIRBYDBHEOII-UHFFFAOYSA-N	447.498	1.250	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)C(=O)Nc1ccnn1Cc1ccc(Cl)c(F)c1	764389269	QFQLARCJPTXOFZ-UHFFFAOYSA-N	430.827	1.827	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)C(=O)Nc1cccc(Cl)c1-n1cncn1	764404539	LBCLZUGJBHQRMB-UHFFFAOYSA-N	446.876	1.505	50	20	IDGD	
Cn1ncc2cc(C(=O)NNC(=O)CN3CCN(Cc4ccc(Cl)cc4)CC3)cnc21	765758726	PLYCNBNPWJQNQA-UHFFFAOYSA-N	441.923	1.201	50	20	IDGD	
CC(C)(C)OC(=O)NCC1(CC(=O)NNC(=O)CNC(=O)c2cccnc2)CCCCC1	766155012	URRQWTAWDURUKG-UHFFFAOYSA-N	447.536	1.824	50	20	IDGD	
COC(=O)c1nccc2c(S(=O)(=O)NNC(=O)c3cc(OC)cc(OC)c3)cccc12	766310737	LFOKFZZDZUTWRV-UHFFFAOYSA-N	445.453	1.662	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)NCc1cccc(C(=O)NC[C@@H]2CCCO2)c1	766893248	GEOYZOVMWYPSCC-KRWDZBQOSA-N	446.529	1.825	50	20	IDGD	
COCc1c(C(=O)OCC(=O)NNC(=O)Cc2ccccc2C)cnn1-c1ccccc1	767739460	SWGIDEGDEIFPMG-UHFFFAOYSA-N	436.468	1.874	50	20	IDGD	
CC[C@@H]1CCCC[C@H]1OCC(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	768276106	OMHSBSKINHKWOX-UYAOXDASSA-N	430.549	1.577	50	20	IDGD	
NC(=O)[C@H]1CC(C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)=NN1c1ccccc1	768277617	UMVZBYSHOZKXJW-GOSISDBHSA-N	435.419	1.097	50	20	IDGD	
COc1cccc(-c2nnc(SCC(=O)NNC(=O)c3ccc(Cl)cc3)n2N)c1	768434438	BNGNUTGQZIWAPG-UHFFFAOYSA-N	432.893	1.874	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)CNC(=O)c1c(F)cccc1Cl	768735858	AFPVQNVEEKSXGI-UHFFFAOYSA-N	429.857	1.764	50	20	IDGD	
Cc1cnn(Cc2ccccc2F)c1NC(=O)C(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	769255998	MXWFBLUBYBCZAQ-UHFFFAOYSA-N	440.391	1.687	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)[C@@H](CC)NC(=O)OC(C)(C)C)c2ccccc2c1=O	770210094	YWDXTQOQQUUVAX-OAHLLOKOSA-N	431.493	1.871	50	20	IDGD	
COC[C@H](C)NC(=O)Cc1noc(CCC(=O)C(C#N)=C2N(C)c3ccccc3N2C)n1	771058434	LHPMBYGNZUJJJU-AWEZNQCLSA-N	438.488	1.586	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)CCc1c(C)nc2nc(C(F)(F)F)nn2c1C	771917211	QBJLZTFTBMCWHO-JTQLQIEISA-N	430.387	1.182	50	20	IDGD	
CCN(CC)C(=O)c1ccc(C(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)cc1	772194623	BFJHHIHFGGRNDF-UHFFFAOYSA-N	430.892	1.899	50	20	IDGD	
CNC(=O)COc1cccc(CC(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)c1	772452128	FDEURWBGZKPFLM-UHFFFAOYSA-N	427.429	1.494	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)NCc2ccc(S(N)(=O)=O)cc2C)c1C	773362142	LFMQZHWYUOJIRN-YBFXNURJSA-N	430.530	1.931	50	20	IDGD	
COC(=O)c1c(F)cccc1NNC(=O)c1cc(S(=O)(=O)N2CCSCC2)c[nH]1	773639693	YUWPXAYCTBFXIA-UHFFFAOYSA-N	442.494	1.435	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2cccc(CN(C)C(=O)OC(C)(C)C)c2)n1	773730652	JJYSDNRNSHJDAT-UHFFFAOYSA-N	430.465	1.934	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1cccc2c1OCCC2=O	774010715	YURMNGMQRJVOMX-LLVKDONJSA-N	431.832	1.859	50	20	IDGD	
COC[C@@H](NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)c1ccc(F)c(F)c1	774363280	SQOJETIUIDLHBA-MRXNPFEDSA-N	431.399	1.543	50	20	IDGD	
CS(=O)(=O)Cc1ccc(Cl)cc1S(=O)(=O)NNC(=O)c1c[nH]c2ccccc12	774611972	WFRQMDAAKOZODB-UHFFFAOYSA-N	441.918	1.989	50	20	IDGD	
CCO[C@@H]1C[C@H](NC(=O)NNC(=O)CNC(=O)c2cccs2)[C@H]1Oc1ccccc1	776476697	KWSHAWGQVWZVOU-HDMKZQKVSA-N	432.502	1.433	50	20	IDGD	
CSc1ccccc1CC(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	777523083	GTURDPJKLIHWQR-UHFFFAOYSA-N	435.575	1.425	50	20	IDGD	
O=S(=O)(CBr)NCCOc1ccc(S(=O)(=O)C(F)(F)F)cc1	782476288	VWIKDNXIMFWIQL-UHFFFAOYSA-N	426.232	1.631	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)cc1)C(=O)Nc1cc2c(cc1Br)OCCO2	782831308	DMLACTRCLPEBIN-UHFFFAOYSA-N	436.218	1.326	50	20	IDGD	
CN(C)C(=O)Cn1cc(NC(=O)C(=O)NNc2ncc(C(F)(F)F)cc2Cl)cn1	782854192	OCPQSTXMIGVHCQ-UHFFFAOYSA-N	433.778	1.120	50	20	IDGD	
COc1cc(OC)c(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)cc1Cl	782892750	GDARATCOIUTLHH-UHFFFAOYSA-N	445.863	1.573	50	20	IDGD	
CCOC(=O)c1ccn(-c2ccccc2NC(=O)C(=O)NNc2cncc(Cl)n2)n1	783268108	NOVZCRXCYPRSRQ-UHFFFAOYSA-N	429.824	1.574	50	20	IDGD	
CCC(=O)Nc1ccc(Cl)c(NC(=O)C(=O)NNc2ccc(-n3cccn3)nn2)c1	783433495	UPADWEMMCJWGTA-UHFFFAOYSA-N	428.840	1.746	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)[C@@H](F)C(C)C)N(S(C)(=O)=O)CC2	784145099	MWEPGIZTWDXCJH-KDOFPFPSSA-N	445.513	1.094	50	20	IDGD	
NC(=O)CCSc1ccccc1NC(=O)C(=O)NNc1ccc(Br)nc1	784814096	WNOMEUKXFWFFLU-UHFFFAOYSA-N	438.307	1.893	50	20	IDGD	
COc1cc(OC)c(NC(=O)C(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)cc1Cl	785022905	AUKJAEVPXAVJLB-UHFFFAOYSA-N	438.780	1.371	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)Nc1cnc(-c2ccccc2)s1	785023737	OWNRQNLORZWHMX-UHFFFAOYSA-N	427.398	1.824	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ccc(Cl)c(F)c2)cc1NS(C)(=O)=O	785185349	GGLDQPKGAWSTQA-UHFFFAOYSA-N	430.845	1.941	50	20	IDGD	
CN(NC(=O)Nc1cnn(CC(F)F)c1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	785858228	RIIHLDMTJMPFOP-UHFFFAOYSA-N	431.444	1.789	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@H]2CCN(C(=O)OC(C)(C)C)[C@H]2C)c2ccccc2c1=O	786252565	IXMYZIYCGOYASS-KBPBESRZSA-N	443.504	1.823	50	20	IDGD	
Cc1nnc(-c2ccccc2C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)o1	786383091	VCBGVZRWWBIPOH-QGZVFWFLSA-N	438.396	1.189	50	20	IDGD	
O=C(CCC(=O)Nc1nnc(C2CCCCC2)s1)NNC(=O)C(=O)Nc1ccccn1	787433625	NPXTXNFGMCTSIS-UHFFFAOYSA-N	445.505	1.486	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)CN3CCc4ccccc4C3=O)n[nH]2)cc1OC	788762244	UNTYYDURHNRAHM-UHFFFAOYSA-N	449.467	1.553	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)N[C@H](C)C(=O)N(C)CC)c2ccccc2c1=O	788892462	LKPCIRVZZUYRLQ-CQSZACIVSA-N	430.509	1.398	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)Nc1nc2c(s1)CCCCCC2	789732650	RWZXZJIQGLCXAG-OAHLLOKOSA-N	430.486	1.728	50	20	IDGD	
COC(=O)c1cc(Cl)cc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)c1	789811427	ZZILVUZVKZOPEN-IRXDYDNUSA-N	445.859	1.785	50	20	IDGD	
Cc1cc(S(C)(=O)=O)ccc1NC(=O)C(=O)NNC(=O)[C@H]1OCC[C@H]1c1ccccc1	789824132	ZHTSMNYHHMRODP-WMZOPIPTSA-N	445.497	1.057	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NN=Cc1c(Br)c(C)nn1C	790286946	IEENGCLNTINEKT-UHFFFAOYSA-N	427.328	1.856	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc4ccn(C)c(=O)c4c3)n[nH]2)cc1	793025596	LBKLBOYHUDZOMN-UHFFFAOYSA-N	444.451	1.637	50	20	IDGD	
Cc1cccc(C(=O)NN=C2C(=O)N(CC(=O)N(C)C)c3ccc(Br)cc32)n1	794567989	UOAWVKVOTPTNBT-UHFFFAOYSA-N	444.289	1.721	50	20	IDGD	
C[S@@](=O)c1ccc(CC(=O)NNC(=O)COc2ccc(Br)cc2)cc1	797789760	NTEIZPWRJXTFOL-RUZDIDTESA-N	425.304	1.955	50	20	IDGD	
COc1cc(C(=O)NCC(=O)NN=c2sc3ccccc3n2C)cc(OC)c1OC	798304040	BYHTWRQAFFWLIL-UHFFFAOYSA-N	430.486	1.628	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2CS[C@H](Cc3ccccc3F)C(=O)N2)cc1	801105226	BTGBYRAVGTYDOF-IAGOWNOFSA-N	444.488	1.063	50	20	IDGD	
COc1ccc(-n2cc(O)c(C(=O)OCC(=O)NNC(=O)Cc3ccccc3C)n2)cc1	801366932	ZFTGYXQQYZADHW-UHFFFAOYSA-N	438.440	1.442	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N1CCOC[C@H]1[C@H]1CCCO1	804881930	ZLVIFFLOBPZZFO-VBNZEHGJSA-N	442.310	1.837	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NNC(=O)[C@H]2CC(=O)N(c3ccccc3F)C2)C1	808011055	OISCNRAIZKAGIO-CABCVRRESA-N	448.495	1.973	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cccc4c3OCC(=O)N4)n[nH]2)cc1	810387012	BMJONQJOIRPXPV-UHFFFAOYSA-N	448.439	1.370	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccccc1F)NNC(=O)c1cccc(Br)c1	810448828	WDTXCDGVJPNMDK-UHFFFAOYSA-N	430.255	1.328	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)COc2ccc([N+](=O)[O-])c3cccnc23)cc1	812733572	XJKOLROOOLLXSQ-UHFFFAOYSA-N	445.457	1.915	50	20	IDGD	
COC(=O)c1cn(-c2cccc(NC(=O)NNC(=O)COc3ccc(OC)cc3)c2)nn1	812977332	GMKDENBUHFFKJT-UHFFFAOYSA-N	440.416	1.294	50	20	IDGD	
COc1cc(F)c(NC(=O)C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)cc1OC	813033551	YYOUWHASQXCSEV-UHFFFAOYSA-N	440.453	1.175	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](NC(=O)OC(C)(C)C)C(F)(F)F)cc1C	813373853	JWUHTOWDZFNRHI-GFCCVEGCSA-N	432.399	1.845	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NN=Cc2ccc(Cl)c(S(N)(=O)=O)c2)cc1	814856566	NOEXQKKHGYNEKC-UHFFFAOYSA-N	430.895	1.547	50	20	IDGD	
CCCN1C(=O)c2ccccc2N2C(=O)CC[C@@]12C(=O)NNc1nc(-c2ccncc2)no1	815236640	BVCCSVUEBOUFPH-JOCHJYFZSA-N	447.455	1.964	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCc2nncn2C1)C(=O)Nc1ccccc1SCC(F)(F)F	815691016	CJRACHHKRMVTHC-SNVBAGLBSA-N	442.423	1.281	50	20	IDGD	
Cc1nsc(NC2CC2)c1C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	815734347	AQOPTOYDDYPKFG-UHFFFAOYSA-N	437.547	1.804	50	20	IDGD	
Cc1c(CC(=O)NNC(=O)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)nnn1-c1ccccc1	816510037	KRMCTMKMDOBWDU-MRXNPFEDSA-N	442.520	1.913	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2[nH]c3ccccc3c2CC(=O)OC)c2ccccc2c1=O	816806040	QGZWYDGVGYEGQO-UHFFFAOYSA-N	447.451	1.688	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NNC(=O)Cc2ccccc2S(C)(=O)=O)C1	819658863	PXTQSSVBVOJJFR-OAHLLOKOSA-N	439.534	1.427	50	20	IDGD	
COc1ccccc1NC(=S)NNC(=O)CN1C(=O)N[C@@](C)(c2ccc(F)cc2)C1=O	825123452	VJCNSDCOIIBNMP-FQEVSTJZSA-N	445.476	1.619	50	20	IDGD	
COC(=O)c1ccc(CCNC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)cc1	913638297	FRCOAQDOPVJVPZ-UHFFFAOYSA-N	447.517	1.261	50	20	IDGD	
O=C(NNC(=O)c1ccc(F)c(S(=O)(=O)NC2CC2)c1)c1ccc2c(c1)OCCO2	914468934	RKZXLDNFJWWUEH-UHFFFAOYSA-N	435.433	1.112	50	20	IDGD	
Cc1ccc2nc(SCC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)n(C)c(=O)c2c1	915795310	JMBZTKPKQNCWNN-UHFFFAOYSA-N	427.442	1.703	50	20	IDGD	
CC(C)N1CCC(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)CC1	915896902	OMXMCKIDIBLJSG-UHFFFAOYSA-N	437.566	1.288	50	20	IDGD	
NC(=O)c1cccc(NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1	915906457	MRBVCWYNKBIKRB-UHFFFAOYSA-N	431.474	1.037	50	20	IDGD	
O=C(Cc1cccc(F)c1)NCC(=O)NNC(=O)Cc1nc(-c2ccccc2)cs1	916157087	BGNOGOKYALCJCW-UHFFFAOYSA-N	426.473	1.998	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2ccccc2Cn2ccnc2)c1	916230500	DJZPLOQKXIEIJT-UHFFFAOYSA-N	427.486	1.479	50	20	IDGD	
CCN(CC)C(=O)c1ccc(CNC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1	916389193	HPDBEKRFGHBJBP-LJQANCHMSA-N	426.473	1.839	50	20	IDGD	
O=C(NCc1cccnc1OCC(F)(F)F)NNC(=O)c1ccc2c(c1)OCCO2	916398485	LLIDRARODSRLDN-UHFFFAOYSA-N	426.351	1.938	50	20	IDGD	
O=C(NCCOc1cccc(Cl)c1)NNC(=O)c1csc(N2CCOCC2)n1	916646524	WLNYZJINTVERLG-UHFFFAOYSA-N	425.898	1.656	50	20	IDGD	
CC(=NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1)c1ccc(-n2cncn2)cc1	917209227	YGLDNUDYTGSVDM-UHFFFAOYSA-N	426.502	1.737	50	20	IDGD	
CN(CC(=O)NNC(=O)c1cc(Br)c[nH]1)C(=O)c1ccc(Br)o1	917392416	VRIYTPLHVQQNMD-UHFFFAOYSA-N	448.071	1.666	50	20	IDGD	
CC(C)[C@H](CNC(=O)NNC(=O)c1ccc(F)cc1Br)N1CCOCC1	918202148	QZWNLXFOWWMJMX-HNNXBMFYSA-N	431.306	1.889	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)NCCCN1CCN(c2ccccc2)CC1	919904684	SMVQJYKXQLJZRR-UHFFFAOYSA-N	425.533	1.780	50	20	IDGD	
CCCNC(=O)NNC(=O)c1cc(S(=O)(=O)N2CCOCC2)c(Cl)cc1Cl	921042926	UXSJIYQHUVTDGV-UHFFFAOYSA-N	439.321	1.368	50	20	IDGD	
CN1C(=O)C[C@@H](C(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)c2ccccc21	1318615797	YLGSGNBHBMWRSQ-MRXNPFEDSA-N	430.505	1.931	50	20	IDGD	
CN(C)[C@]1(CNC(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)CCSC1	1319171777	MRGWPBNKXMLDPK-IBGZPJMESA-N	429.587	1.401	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)N[C@H](c2ccccc2)c2cnn(C)c2)nc1	1320964908	SZOBAZJZGBSATL-LJQANCHMSA-N	443.533	1.918	50	20	IDGD	
O=C(NNS(=O)(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)c1ccccc1Cl	1322778553	GRSUCOKKRSICNM-UHFFFAOYSA-N	443.934	1.748	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccccc1)NNC(=O)c1cc(F)ccc1Br	1343502620	VGTIJXXZFGOEEA-UHFFFAOYSA-N	430.255	1.328	50	20	IDGD	
Cn1ncc2c(C(=O)N3CC[C@@]4(C3)CN(C(=O)[C@H](F)Br)CCO4)cccc21	1778031659	OPOPFJFMUYIGEU-MAUKXSAKSA-N	439.285	1.707	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@]1(C)C[C@@H]1C)C2	1778092872	SVELAOYPQJNJEH-WZTJLKLKSA-N	443.548	1.680	50	20	IDGD	
CCc1cc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)n(C)n1	1779622681	XWOWYTIWLIQBIO-UGSOOPFHSA-N	427.343	1.457	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(OC)n1)C2	1782170945	IKPQCAFGCLUBNA-AKCHCHLHSA-N	425.913	1.472	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCn2cncn2)C1	1782447643	RMFSHVJSYUOGHG-IIDMSEBBSA-N	442.358	1.213	50	20	IDGD	
Cn1ccnc1C(=O)N1CCO[C@]2(CCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1	1782864417	WCKPXFZIDBORPM-VROYLXGSSA-N	441.438	1.749	50	20	IDGD	
O=C([C@@H](Br)Cc1ccccc1)N1CC[C@@]2(C1)CN(C(=O)[C@@H]1C=CCN1)CCO2	1783024163	UZSDYTKYTRHOPW-BBTUJRGHSA-N	448.361	1.351	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3nccnc3OC)CCO2)C1	1783342531	AWPYVNKQSKUTFP-YVEFUNNKSA-N	427.299	1.102	50	20	IDGD	
CO[C@H](C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](C)Br)C2)C1)c1ccccc1	1783532883	ONBHTGVEPRGRHQ-URLQWDBASA-N	425.323	1.987	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3[nH]cnc3-c3cccnc3)CCO2)C1	1783881372	LAIRCWZGYOIOKK-YWZLYKJASA-N	433.896	1.169	50	20	IDGD	
C[C@@H](C(=O)N1CCO[C@@]2(CCN(C(=O)C(Cl)Cl)C2)C1)N1CSCSC1	1783945669	AVBCZRPRONBMQP-XHDPSFHLSA-N	428.407	1.663	50	20	IDGD	
C#CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCO[C@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783952079	MLGJEDXCZRIASI-YJYMSZOUSA-N	448.347	1.537	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21)c1ncn(-c2cccc(F)c2)n1	1785544846	XSRUMWJGUHYGKL-DDWPSWQVSA-N	439.850	1.534	50	20	IDGD	
C[C@@H](NC(=O)c1ccccc1)C(=O)N1CC[C@@]2(CN(C(=O)C(Cl)Cl)CCO2)C1	1785561426	KUINSQNEAKCOEQ-YJYMSZOUSA-N	428.316	1.439	50	20	IDGD	
Cc1ncc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)CBr)C[C@@H]32)cn1	1785830914	SRNBGPIYXQHADJ-MZGVZZPPSA-N	425.327	1.409	50	20	IDGD	
COc1nccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCBr)[C@H]3C2)c1F	1786405842	FLUATUXJOWMWEA-UBHSHLNASA-N	444.301	1.608	50	20	IDGD	
C[C@@H](Cn1cncn1)C(=O)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1	1788147957	RJZIUAHDFLTUKE-INIZCTEOSA-N	447.304	1.042	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]21	1791060349	BNFSUOHBMXYFBT-SQRMYFJTSA-N	430.170	1.986	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3cnccn3)C[C@@H]21	1791065374	WRFVNFMFBATKDV-VRKREXBASA-N	425.327	1.172	50	20	IDGD	
O=C(CCc1cccc(O)c1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21	1791399892	VFDJGMNTWAMWPJ-OWIUFQIYSA-N	443.313	1.995	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)COc1ccc(O)cc1	1792777492	JFPXZYMWWRAODT-JBYDNAENSA-N	431.316	1.597	50	20	IDGD	
CC(C)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CC[C@@H]3CCC(=O)N3C1)C2	1792784316	DNAQTWXKWGKLME-UJHHCITNSA-N	425.957	1.242	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(Cl)cnc1O)C2	1792866515	BYPGNCOXSKCEAQ-NJBDSQKTSA-N	446.729	1.675	50	20	IDGD	
Cc1ccncc1CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2	1794102555	OQZBQNPUNXVBNL-FSDCSDTHSA-N	428.302	1.603	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCN(C)C	1795873327	FWRFPPFGEYZVJY-MUJYYYPQSA-N	432.477	1.724	50	20	IDGD	
CN(C)C(=O)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](Br)Cc1ccccc1)C2	1795904236	XIMZZJGKXKZKGS-YVSFHVDLSA-N	436.350	1.719	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1nccc2nc[nH]c12	1796239274	RFYYIZMJCZOQPG-ZSMOCIRGSA-N	426.304	1.397	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2)c1cc(O)nc2ccccc12	1796913262	QVRZOSJLXFABRF-DBWKPXFBSA-N	448.317	1.929	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnn(Cc2ccccc2)c1	1798150759	VILXSQUYPWWWAK-IYWMVGAKSA-N	446.935	1.388	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc([N+](=O)[O-])o1)C2	1800638260	WEIYONBWIXSTNZ-MIJXAVMKSA-N	430.255	1.565	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(CO)c(F)c1)C2	1800645366	WRXCTVSAMIKIDL-JYYAWHABSA-N	443.313	1.695	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1ccc3c(c1)OCO3)C2)C(Cl)Cl	1801016135	TVVZYTTXHICSRE-FVCICTRLSA-N	429.300	1.741	50	20	IDGD	
COc1ccc(OCC(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@H]2c2cccnc2)cc1	1802813014	XHXAXIUREYARIC-SCWSEQNSSA-N	447.919	1.775	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1CCN(C(=O)c2cnc(O)[nH]2)[C@@H]1c1cccnc1	1803013210	BDSYFSFNIKEPGY-OSAQELSMSA-N	436.310	1.861	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1CCN(C(=O)[C@H](C)n2cncn2)[C@@H]1c1cccnc1	1803017206	CBOSYVXBXDUKLP-YQFWSFKMSA-N	449.353	1.971	50	20	IDGD	
CC(=O)N[C@H](C(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)C(C)(C)C	1803136130	OCHZSRAGYAAACZ-XMTFNYHQSA-N	438.956	1.238	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)CNC(=S)NCC)[C@H]1c1cccnc1	1803693640	AJHCVDPFDVREPN-RYRKJORJSA-N	440.013	1.979	50	20	IDGD	
Cc1oncc1C(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1805803292	DMAJWWWEZUESSB-UZLBHIALSA-N	428.493	1.071	50	20	IDGD	
CN(CC(=O)N1CCCC2(CCN(C(=O)[C@H](O)CCl)CC2)C1)C(=O)c1ccccc1	1805843212	IRPXOWHORPKNJY-GOSISDBHSA-N	435.952	1.590	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)C2CC(F)(F)C2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1	1807364547	JBBJYWAKURQXOB-VQIMIIECSA-N	443.259	1.126	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)CCc2ccc[nH]2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1	1807371083	PGVZTKJWVTUSTH-AUSIDOKSSA-N	446.316	1.042	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC2(CCCN(C(=O)c3coc(Cl)n3)C2)CC1	1807631842	VURBYJFKQICDLJ-UHFFFAOYSA-N	425.917	1.546	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)[C@H](C)N2CCN(C)CC2)[C@H]1c1cccnc1	1807873846	BSBCQNVUVLHRGH-OJAHFUOMSA-N	436.000	1.741	50	20	IDGD	
O=C(CC12CCCN1CCC2)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1	1808020710	BEMKTLXTVAIEBO-NLWGTHIKSA-N	434.968	1.706	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Cl)[C@H]1c1cccnc1	1808416708	CYLJKDUSZMIFRH-PFTKTLMESA-N	448.886	1.756	50	20	IDGD	
Cc1[nH]ccc1C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1808750000	MMYLLYDCJUVNQO-NQIIRXRSSA-N	432.289	1.031	50	20	IDGD	
O=C(Cc1cccs1)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1	1809976740	MRAQQVPGZVUNMZ-UHFFFAOYSA-N	426.347	1.515	50	20	IDGD	
Cc1cccc(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)c1	1811862394	MGJQLRFOOZBHNC-GGAORHGYSA-N	443.312	1.703	50	20	IDGD	
C=CCC(F)(F)C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1812667472	DKOIDCVSEDUOLY-HKUYNNGSSA-N	443.259	1.292	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)c2c[nH]c(=O)cn2)[C@@H]1c1cccnc1	1812777227	NVLQQOKZALPLEP-GRDNDAEWSA-N	448.321	1.658	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2cn(C)nc2OC)[C@H]1c1cccnc1	1813029426	LRCRGBHKIRIULC-XIRDDKMYSA-N	435.912	1.397	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1)n1cccc1	1813074995	WPVAPTPXCOFOHY-SFGWALBWSA-N	440.548	1.523	50	20	IDGD	
CCOC(=O)C(C)(C)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](Cl)COC)[C@@H]1c1cccnc1	1814174768	YTPGWDBEHWGDLO-YESZJQIVSA-N	439.940	1.931	50	20	IDGD	
Cc1cccc(CC(=O)Nc2cc([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)n1	1814974669	QYZMDWZOAKPKDX-SFHVURJKSA-N	441.536	1.721	50	20	IDGD	
CCS(=O)(=O)CC(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](C)Br)[nH]n1	1815173919	INQCREAQADEKSG-CMPLNLGQSA-N	435.344	1.620	50	20	IDGD	
Cc1cccnc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1815397143	GPJNGCRZCILQHM-QGZVFWFLSA-N	448.487	1.731	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccc(=O)n2O)n[nH]1	1816148900	JLRLRMUIMXINHC-JQWIXIFHSA-N	438.282	1.898	50	20	IDGD	
Cn1cccc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1816332896	ZMKIBIJWEVSQEB-MRXNPFEDSA-N	436.476	1.366	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1cnoc1C1CC1	1816655656	IVXWGXBVKLYANG-GOSISDBHSA-N	449.276	1.575	50	20	IDGD	
Cc1cccc(CC(=O)Nc2cc([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)c1	1816921727	HKGIUXJIWNJCMQ-OAQYLSRUSA-N	446.316	1.947	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)C(F)(F)C(F)F)[nH]n1)c1cccc(B(O)O)c1	1817474151	NPLOYCJZKTYDQK-CYBMUJFWSA-N	442.178	1.296	50	20	IDGD	
CC(C)O[C@@H](C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1	1817476139	HHKSOKZRHHEZBI-KBXCAEBGSA-N	428.298	1.209	50	20	IDGD	
Cc1c(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@H](O)CCl)CC3)nc2ccccn12	1818103418	YGGVGNCAFQUKOK-WCQYABFASA-N	433.921	1.925	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1)[C@H]1ON=C(c2ccccc2)O1	1819296596	VISWEHQETHBJAF-BXTJHSDWSA-N	447.879	1.736	50	20	IDGD	
O=C1Nc2c(C(=O)Nc3nc4c(s3)C[C@@H](NC(=O)[C@@H](O)CCl)CC4)cccc2C1=O	1819342244	WTUWPKBRGGBGHX-UFBFGSQYSA-N	448.888	1.103	50	20	IDGD	
C[C@](O)(CC(=O)O)CC(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](F)Br)[nH]n1	1822411440	YZMAKEOVHDDDOV-DRZCJDIDSA-N	449.277	1.708	50	20	IDGD	
C[C@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1)c1ccccn1	1822897209	DWKPDIDBPWSVHC-YJBOKZPZSA-N	441.536	1.974	50	20	IDGD	
Nc1n[nH]c(CCC(=O)N[C@H]2CCc3nc(NC(=O)[C@@H](F)Br)sc3C2)n1	1823007116	JEMSCRZJRGVMLR-UPONEAKYSA-N	446.306	1.079	50	20	IDGD	
N#Cc1ccc2[nH]nc(C(=O)Nc3nc4c(s3)C[C@H](NC(=O)[C@@H](O)CCl)CC4)c2c1	1823888777	OMJOFBCBEXEGKO-YGRLFVJLSA-N	444.904	1.717	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H]1CCNC(=O)C1)CC2	1825453145	PVYQXGLTUXPBHU-AXFHLTTASA-N	443.367	1.755	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(=O)oc2)CC1	1826225415	VEKVFNYHVAYVLU-SFHVURJKSA-N	432.521	1.246	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@H]1CCc2nc(NC(=O)CCn3ccnn3)sc2C1	1826877421	FHMSRUNMHMOTOV-QFYYESIMSA-N	431.349	1.973	50	20	IDGD	
COC[C@H](C)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1	1828923720	VUUIPNPIXVZMIY-HNAYVOBHSA-N	431.537	1.201	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](O)N2CCOCC2)CC1	1828963912	KOGFVCSJSDIJLX-CMKODMSKSA-N	429.989	1.664	50	20	IDGD	
Cn1nc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)c2c1CCC2	1830362206	OACRNTVDOVXHNB-OAQYLSRUSA-N	438.956	1.244	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3sccc3F)C2)C1	1830535285	LQWOILOEYXOOSV-SJCJKPOMSA-N	449.342	1.988	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3nnsc3C3CC3)C2)C1	1831645669	CZFKNCXWFPTMNN-IFXJQAMLSA-N	442.969	1.893	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H](C)CS(C)(=O)=O)CC1	1831827738	JLHMQLITXCRJFD-HYVNUMGLSA-N	437.002	1.541	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)C2CCC(O)CC2)CC1	1831875468	WCOYIKUHEJNINY-MHJFOBGBSA-N	436.597	1.530	50	20	IDGD	
O=C(c1ccc(F)s1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1833217639	PJCSNHSWMYDSAQ-WFASDCNBSA-N	439.278	1.648	50	20	IDGD	
Cc1nscc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)CBr)C2)C1	1833740504	NVBUBIHUIUUQHA-PXAZEXFGSA-N	446.367	1.553	50	20	IDGD	
Cc1nc(CC(=O)NC2CCN(C3CCN(C(=O)[C@H](O)CCl)CC3)CC2)c(C)s1	1833868205	CGHGOBKLQCVHND-GOSISDBHSA-N	443.013	1.474	50	20	IDGD	
Cn1ccnc1C(=O)NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1	1834270381	BUVXCGPISQEYFO-AWEZNQCLSA-N	430.322	1.296	50	20	IDGD	
CCOC(=O)/C=C/C(=O)NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1	1834406855	WEKMSUKEDGPHJZ-IDOMTICXSA-N	448.333	1.368	50	20	IDGD	
C[C@@H]1CC[C@H](C(=O)N2CCC(N3CCC(NC(=O)CCBr)CC3)CC2)O1	1834424074	WHIWMPGBMSUMEI-RHSMWYFYSA-N	430.387	1.911	50	20	IDGD	
COc1nccc(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)c1F	1834906550	GJPHZEXSVFGNJL-INIZCTEOSA-N	442.919	1.014	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccccc3)CCO2)C1	1834997802	NYPJUAHCJUVCEG-PMACEKPBSA-N	429.344	1.922	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccccc3F)CCO2)C1	1835007995	KFNMGNNQTVNDOE-OXJNMPFZSA-N	428.888	1.078	50	20	IDGD	
CC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)C(C)(C)CNC(C)=O)CC2)CC1	1836395222	YUJLRNYABCLTQV-SFHVURJKSA-N	429.005	1.738	50	20	IDGD	
Cc1nnc(CC(=O)N2CCC(N3CCC(NC(=O)[C@@](C)(Cl)CCl)CC3)CC2)o1	1836398803	VXBVXOGWVRIJMO-IBGZPJMESA-N	446.379	1.728	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)C3=NO[C@H](c4ccccc4)C3)CCO2)C1	1836585757	DULAVNALOPYGDG-LQBOVUBWSA-N	449.935	1.978	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC(OC2CCN(C(=O)C#CC(=O)O)CC2)CC1	1836674675	WXPCTOUMFOCWHS-ZDUSSCGKSA-N	429.311	1.104	50	20	IDGD	
O=Cc1ccc(C(=O)N2CCC(OC3CCN(C(=O)[C@H](O)CCl)CC3)CC2)s1	1836716777	QBQGFNZFQFPRTI-MRXNPFEDSA-N	428.938	1.773	50	20	IDGD	
O=C(c1ccn2nccc2c1)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836717284	RYVUXZPUSUWWLF-IBGZPJMESA-N	434.924	1.546	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cccnc3C(N)=O)CC2)CC1	1837250922	UFBQOIZRXOSXHK-QGZVFWFLSA-N	436.940	1.810	50	20	IDGD	
O=C(O)c1cc(C(=O)N2CCC(OC3CCN(C(=O)C(Cl)Cl)CC3)CC2)ncn1	1837289952	CQSWOKRQHZKDFE-UHFFFAOYSA-N	445.303	1.591	50	20	IDGD	
O=C(COc1cc(Cl)ccn1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1837652972	NLLGYABLPCNFIP-NVXWUHKLSA-N	436.267	1.105	50	20	IDGD	
O=C(c1cc(-c2ccccc2)no1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1837996604	KTWQJGLRMQJHOG-YLJYHZDGSA-N	437.855	1.946	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)c3ncccc3F)CC2)CC1	1838500532	CTCSYBMCUDXRPS-UHFFFAOYSA-N	449.527	1.206	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(F)cc3)CCO2)C1	1838956375	HFNAEOZQFKKLML-SCLBCKFNSA-N	429.286	1.679	50	20	IDGD	
Cc1ncc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)s1	1839200241	DRNACPHTJFKIQF-WFASDCNBSA-N	436.303	1.212	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CCCCN3C)C2)C1	1839961872	LQOWFKDNTUNWQT-JTDSTZFVSA-N	446.386	1.101	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)ccn1	1840033466	GBZPTRLKLQJHLT-RDTXWAMCSA-N	426.311	1.243	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3cncc(C)c3)C2)C1	1840150729	PRQRIIYMMKIMLU-RXVVDRJESA-N	439.940	1.033	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)C(Cl)Cl)CCO2)C1	1840189865	QANOULNYBWITPI-QMTHXVAHSA-N	432.142	1.420	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CC[C@H](O)CC1)CCO2	1840270709	BYYVEAUCLLZRGR-STEAMIEHSA-N	437.364	1.230	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)N2CC3(CCCN3C(=O)[C@H](O)CCl)C2)CC1	1841351364	MKGJRKIPOBBPNJ-HZPDHXFCSA-N	443.972	1.827	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)c2ccn(C)c2)C1	1842345732	KDKNXSJGBRMONU-UHFFFAOYSA-N	426.429	1.989	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@H](C(=O)N2CCCC23CN(C(=O)[C@@H](O)CCl)C3)C[C@@H](F)C1	1843887913	NGNOIWHVZUPPPE-ZNMIVQPWSA-N	447.935	1.385	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)Cc2c[nH]c3ccccc23)C1	1845058855	WMHOTCXFSBTWPZ-UHFFFAOYSA-N	432.484	1.226	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)CN(C(=O)OC(C)(C)C)C1CC1)C2	1846359934	PASMCEDIZRDRBS-HNNXBMFYSA-N	429.945	1.843	50	20	IDGD	
COc1ccc([C@@H]2C[C@H]2C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)CCC(=O)NN(C)C)cc1	1847775260	KMZYGCMHZWGLQN-YRPNKDGESA-N	428.533	1.374	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2nn(-c3ccccc3)c(C)cc2=O)cc(OC)c1OC	15426743	IDUSIIJHJUTKQR-UHFFFAOYSA-N	438.440	1.642	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)c1ccc(S(=O)(=O)N2CCCCC2)cc1	15889852	ZJZVNCKTLBXAEC-UHFFFAOYSA-N	435.477	1.840	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)c1ccc(CS(=O)(=O)c2ccccc2)o1	26974320	NAESKOUXRXRCSA-LJQANCHMSA-N	442.449	1.855	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)c(OC)c1	27230234	BMXATDYAZNZHMW-UHFFFAOYSA-N	447.513	1.953	50	20	IDGD	
COc1ccc(CN2CCN(CC(=O)NNC(=O)Cc3nc(C)cs3)CC2)cc1F	27541818	JUQIUJIYWHRMMU-UHFFFAOYSA-N	435.525	1.107	50	20	IDGD	
Cn1ccnc1[C@](O)(CC(=O)NNC(=O)c1ccc(Br)cc1)C(F)(F)F	97037529	LCDJIRCXCBSLGI-CQSZACIVSA-N	435.200	1.784	50	20	IDGD	
O=C(CCNC(=O)c1n[nH]c2ccccc12)NNC(=O)c1nn(-c2ccccc2)cc1O	726884194	ZHHYNUHCAICKIS-UHFFFAOYSA-N	433.428	1.035	50	20	IDGD	
C[C@H](CC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)NC(=O)C1CCCCC1	727364182	NRCIHOUTTXARSZ-CQSZACIVSA-N	438.550	1.173	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)CCOc2ccc(F)cc2Cl)n1	728729502	PMFWRIFONUXLGH-UHFFFAOYSA-N	429.857	1.946	50	20	IDGD	
NC(=O)C1CCN(c2ncccc2CNC(=O)NNC(=O)Cc2c[nH]c3ccccc23)CC1	729610815	AGLBPBYQNKBOOU-UHFFFAOYSA-N	449.515	1.338	50	20	IDGD	
CC(=NNC(=O)CSc1nnc(O)nc1O)c1ccc(I)cc1	730558795	RNDNKLCJDGFHIU-UHFFFAOYSA-N	445.242	1.520	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)NCc2nnnn2-c2ccccc2)cc1	730672776	LTEDWDSDGGMGHO-AWEZNQCLSA-N	425.449	1.359	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N[C@@H]2CCN(C3CC3)C2)cc1	730773931	MKNXHROHSOJIPY-LYPXWFNGSA-N	448.527	1.694	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)[C@@H](NC(=O)OC)C(C)C)c2ccccc2c1=O	730997940	DNRSACVCZGUXEC-INIZCTEOSA-N	431.493	1.728	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])cn1	731059385	UEOZIQPUKFTITF-UHFFFAOYSA-N	438.853	1.399	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@@H](C)C(=O)NNC(=O)COCC(=O)NCc1cccnc1	731185035	BAQOFAOYMSKVOH-HNNXBMFYSA-N	448.907	1.600	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(F)cc2)C1	731491186	GUDCZXGRCLUTRW-AWEZNQCLSA-N	435.477	1.696	50	20	IDGD	
Cc1cc(C)nc(SCc2ccc(C(=O)NNC(=O)CN3CCC(=O)NC3=O)cc2)n1	731867175	YANQKYSQBVXNGN-UHFFFAOYSA-N	442.501	1.089	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN(C)C(=O)[C@H](C)n2cccn2)cc1Br	732173823	HWBHGDRDBPWMES-NSHDSACASA-N	438.282	1.135	50	20	IDGD	
CS(=O)(=O)Nc1cc(C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)ccc1Cl	733170944	HPFLJIKNHXLHSI-UHFFFAOYSA-N	433.877	1.972	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N(C)[C@@H](C)[C@@H](C)S(C)(=O)=O)cc1Br	733347704	HNQWYYAFZXWKJT-VHSXEESVSA-N	436.328	1.566	50	20	IDGD	
CCOC(=O)c1cnn(-c2ccc(C(=O)NNC(=O)CN(C)C)cc2)c1C(F)(F)F	733359253	JLSASNRCQNXPJI-UHFFFAOYSA-N	427.383	1.390	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)C(C)(C)C	734672871	CERRWVKCGGYKMQ-AWEZNQCLSA-N	426.539	1.334	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)[C@H]2CCOc3ccccc32)CC1	735116773	FECJKDSVCJKAIW-INIZCTEOSA-N	431.518	1.027	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2ccnc3ccccc23)CC1	735117969	KPPCXHDNQSYZRC-UHFFFAOYSA-N	426.502	1.323	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)Nc2ccn(CC(=O)N3CCOCC3)n2)c1C	735257333	QBYARHFRIBEZLC-UYRXBGFRSA-N	440.504	1.352	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cc(F)ccc2F)cn1	735471172	SFOBDJHPBQDQAH-UHFFFAOYSA-N	435.412	1.574	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)CNC(=O)OCc2ccccc2)CC1	735472232	RTALZDOCQQFBEG-UHFFFAOYSA-N	434.493	1.707	50	20	IDGD	
C[C@@H](CN1CCN(c2ccccn2)CC1)NC(=O)NNC(=O)c1cccc2ncccc12	735518442	JYOWFKLQVYYHBB-KRWDZBQOSA-N	433.516	1.785	50	20	IDGD	
COC(=O)Nc1ccc(CCNC(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)cc1	739031974	MIMAGKLRCWSCFR-UHFFFAOYSA-N	427.461	1.993	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)N[C@H]2CCN(CCOC)C2)c2ccccc2c1=O	739037131	ZUYXHWSXRKEXJQ-INIZCTEOSA-N	444.536	1.251	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)N2CC[C@@H](CN3CCOCC3)C2)N(C)c2ccccc21	742103670	BNSHAFBZEPBWAV-SFHVURJKSA-N	437.544	1.838	50	20	IDGD	
O=C(CCN1C(=O)[C@H]2[C@H](C1=O)[C@H]1CC[C@H]2O1)NNC(=O)c1cc2c(s1)CCCCC2	742481807	BXLVNDZWUMHISO-XHSVMWQWSA-N	431.514	1.331	50	20	IDGD	
C[C@H]1CCCC[C@@]12NC(=O)N(CC(=O)NNC(=O)c1cccc(Br)c1)C2=O	742768797	AGJONRXHFBMQFG-BBATYDOGSA-N	437.294	1.711	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)N[C@@H]3C[C@@H](C)N(c4cnn(C)c4)C3=O)cc2C1	743510746	CZZHBBWFJXUABV-LALPHHSUSA-N	430.534	1.744	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)c2ccc(F)c(S(=O)(=O)NC3CC3)c2)cc1	743828636	XDHQNVUEXKVUES-UHFFFAOYSA-N	435.481	1.799	50	20	IDGD	
CC(=O)c1cccc(S(=O)(=O)NCCC(=O)NNC(=O)Nc2ccc(N(C)C)cc2)c1	743828847	KAKDFPMRNLORRA-UHFFFAOYSA-N	447.517	1.477	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](CNC(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)C1	745798033	UQCJFGCMZAVZCR-GFCCVEGCSA-N	437.453	1.892	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)N[C@@H]1CC(=O)N([C@@H]2C[C@@H]2c2ccccc2)C1	745914060	HKSXBDWHJOVKCK-BHIYHBOVSA-N	426.448	1.692	50	20	IDGD	
CSCC[C@@H](NC(=O)c1cccc(C)c1)C(=O)NNC(=O)Cc1cn2ccccc2n1	746641277	ONGYQCRTINQXKW-GOSISDBHSA-N	439.541	1.884	50	20	IDGD	
CC(=NNC(=O)c1sc(N2CCOCC2)nc1C)c1ccc(NS(C)(=O)=O)cc1	747041194	FTICYDZJEWBKQE-UHFFFAOYSA-N	437.547	1.814	50	20	IDGD	
C[C@@H]1C[C@@H](C)CN(C(=O)CN2CCN(C(=O)NNC(=O)CCOc3ccccc3)CC2)C1	747107916	DPWQXYLGNUECCH-RTBURBONSA-N	445.564	1.318	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1c(C)nc(C(C)(C)C)nc1O	747348496	RCQISHGZNUSAJE-UHFFFAOYSA-N	434.522	1.464	50	20	IDGD	
O=C(CCCN1C(=O)CNC1=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1	747786948	FVYFSIMPDPGNDM-HXUWFJFHSA-N	449.511	1.093	50	20	IDGD	
CCOCC(=O)NNC(=O)N[C@@H](CNS(=O)(=O)c1ccc(C)cc1C)c1ccccc1	747952944	FAKIONFEJFQCRC-SFHVURJKSA-N	448.545	1.690	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN1C(=O)c1ccc2c(c1)OCO2)c1ccc2c(c1)OCO2	749563292	YYEYJTFRSPIQIS-AWEZNQCLSA-N	425.397	1.210	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1ccccc1COc1ccc(CC#N)cc1	756112449	VXDNHWRZORUKBU-AWEZNQCLSA-N	445.501	1.422	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@H](C)c2ccc([S@](C)=O)cc2)c2ccccc2c1=O	756736881	JFDXGSZNCTURBE-QJCAQRTLSA-N	441.513	1.859	50	20	IDGD	
CCOCCOCc1cccc(NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c1C	756840370	LQMOVLHWWBTXLH-UHFFFAOYSA-N	439.476	1.990	50	20	IDGD	
CCCCN1C(=O)C[C@H](C(=O)NNc2ccc(C(N)=O)nn2)[C@H]1c1ccc(OC)cc1	757399209	MYCRRIXLSUAYGV-HNAYVOBHSA-N	426.477	1.417	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N[C@@H](C)c2cn[nH]c2)cc1	757573395	DANIOWCUXCAIQU-FSEGOYHTSA-N	433.472	1.942	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NN=Cc1ccc(Br)c(Br)c1	757576240	UJRJHEULINQZEW-ZETCQYMHSA-N	427.118	1.599	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)Nc1ccc(C2CC2)nn1	757699520	HKSRMWVQRPTMQP-UHFFFAOYSA-N	444.517	1.995	50	20	IDGD	
N#Cc1cc(Cl)ccc1-n1ccc(NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)n1	757999239	RJFJUCUQYSKDAQ-UHFFFAOYSA-N	448.834	1.840	50	20	IDGD	
COCCOc1cc(C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)nc2ccccc12	758070140	ABQAPQVLNPDPTB-UHFFFAOYSA-N	447.451	1.582	50	20	IDGD	
CN(NC(=O)[C@H]1CS[C@]2(C)CCC(=O)N12)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758786599	NVIXTLHMQPIUTP-BFUOFWGJSA-N	441.554	1.076	50	20	IDGD	
CCNS(=O)(=O)c1ccc(CC(=O)NNC(=S)Nc2ccc(N(C)C)cc2)cc1	759377040	YIVSVVQDVXAYGQ-UHFFFAOYSA-N	435.575	1.611	50	20	IDGD	
CS(=O)(=O)CCn1cccc(NS(=O)(=O)c2ccc(CCCCl)cc2)c1=O	760268097	NUUQXSYSMWYVRN-UHFFFAOYSA-N	432.951	1.865	50	20	IDGD	
CCCOc1cccnc1C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	760463072	LUXWKAANNLHDAJ-UHFFFAOYSA-N	433.534	1.563	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N1CCC(S(C)(=O)=O)CC1	760718682	JOGIIURHFCPBBY-LLVKDONJSA-N	448.339	1.466	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)C2=Cc3cc(Br)ccc3OC2)C[C@H](C)O1	762188714	ANQZDAVYRSSTEF-STQMWFEESA-N	438.322	1.872	50	20	IDGD	
C[C@@H](c1cccc(NC(=O)C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c1)N1CCOCC1	763445551	JVGAKACVWQNUDL-AWEZNQCLSA-N	441.444	1.388	50	20	IDGD	
N#Cc1c(F)cccc1-n1ccc(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3n2)n1	763454337	IFKUGZHGBFAQDT-UHFFFAOYSA-N	443.398	1.831	50	20	IDGD	
CS(=O)(=O)N1CCN(C(=O)NNC(=O)Cn2ccc3ccccc32)Cc2ccccc21	763502816	RNSXCFAJPFXMQR-UHFFFAOYSA-N	441.513	1.664	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)n(Cc2ccccc2)n1	763573453	SEFIOCMWPYRGIU-GOSISDBHSA-N	435.440	1.166	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(O[C@H]3CCOC3)cc2)cc1C	763668139	YWFBZIJPKSAYBX-IBGZPJMESA-N	427.457	1.636	50	20	IDGD	
Cc1ccc(Oc2ccc(NC(=O)C(=O)NNC(=O)COc3ccc(C#N)cc3)cc2)nn1	763673281	CGUZXWIGDZZDBW-UHFFFAOYSA-N	446.423	1.614	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccnn1Cc1ccccc1F	763807275	OABWVVGLAHURKZ-UHFFFAOYSA-N	436.403	1.107	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cccc([S@@](C)=O)c2)cc1	763862713	ZIBQLPPDUOBKBH-GNDSEDMPSA-N	433.486	1.376	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1cccc(OC[C@@H]2CCCO2)c1	763866403	PADQMOSUGUAMFI-LIRRHRJNSA-N	445.447	1.937	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)c2cccnc12	763873526	VGTKUBGBZCUJAF-GFCCVEGCSA-N	426.404	1.936	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)C(=O)Nc2ccccc2N2CCN(C)CC2)cc1	763890499	APNXAAKEFVMWRU-UHFFFAOYSA-N	441.557	1.625	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)OC)c(F)c2)cc1OC	763900291	CKVVKRAIEJOTOT-UHFFFAOYSA-N	433.392	1.419	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccc(I)cc1	763918451	DEDUNTRHVJKYRM-UHFFFAOYSA-N	441.200	1.759	50	20	IDGD	
O=C(Cc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1cccn(CC(F)(F)F)c1=O	763933136	YCZPUZBRIBJAIE-UHFFFAOYSA-N	430.770	1.393	50	20	IDGD	
COc1ccc(Cn2nccc2NC(=O)C(=O)NNC(=O)Cc2ccc(Cl)cc2)cc1	763937103	WTCDOVRFSFMXMQ-UHFFFAOYSA-N	441.875	1.922	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)C(=O)Nc1ccnn1C1CCCCC1	763947724	CINZNWHWGCHMPJ-UHFFFAOYSA-N	437.460	1.679	50	20	IDGD	
Cc1cccc(Oc2ncccc2NC(=O)C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)c1C	764001592	BFFSSPIJNPFMAB-CQSZACIVSA-N	446.485	1.011	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C)c(C)c(NC(=O)C(=O)NNC(=O)C2CCCC2)c1	764077651	SZUFQGIVGMXVHS-UHFFFAOYSA-N	438.550	1.610	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)nc1)C(=O)Nc1cccc(C(=O)N2CCCCC2)c1	764091422	LHYIWPLFZYQSGX-UHFFFAOYSA-N	429.864	1.761	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc(N4CCCC4=O)cc3)n[nH]2)cc1	764110246	HEKQTQSISBMURM-UHFFFAOYSA-N	446.467	1.912	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccc(-n2cncn2)c(Cl)c1	764136346	OWLOOCYRIWTZJD-UHFFFAOYSA-N	428.836	1.258	50	20	IDGD	
O=C(NNC(=O)c1cccc(OC(F)F)c1)C(=O)Nc1ccnn1Cc1ccccn1	764260458	ZFUFQBDOXQAFQE-UHFFFAOYSA-N	430.371	1.328	50	20	IDGD	
O=C(Cc1cc[nH]n1)NNC(=O)C(=O)Nc1ccc(-c2n[nH]c(-c3ccccc3)n2)cc1	764286389	UAHNXAKMVKXGFI-UHFFFAOYSA-N	430.428	1.190	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)C(=O)Nc1ccnn1Cc1ccc(Cl)c(F)c1	764356237	RPEQUGZHRVFQTN-UHFFFAOYSA-N	430.827	1.448	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2cnn(C(C)(C)C)c2)n[nH]1	764376397	CUWARXHKHXULEJ-UHFFFAOYSA-N	425.449	1.437	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)N2C[C@@H](C)Oc3ccccc32)n[nH]1	764378002	UTVZEAKKDFFAKW-CYBMUJFWSA-N	435.440	1.660	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H]2CCO[C@@H](C(C)(C)C)C2)c1	764512258	ITKDGCYREXHQCR-GOEBONIOSA-N	426.539	1.475	50	20	IDGD	
Cc1c(Br)cc(C(=O)NNC(=O)c2cc(Br)c[nH]2)c(=O)n1C	764943241	QCDBNQTWWXXXEQ-UHFFFAOYSA-N	432.072	1.622	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc(F)cc1)NNC(=O)CSc1ccccc1O	765248984	YIKQGWZOQNEMQH-UHFFFAOYSA-N	427.479	1.139	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@H](C)S(=O)(=O)C2CCOCC2)cc1Br	765500364	DQIWPBSRLQTSMA-JTQLQIEISA-N	449.323	1.201	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2ccc(OC)cc2I)nc1	765700682	ZEIZJTHIHDOZIB-UHFFFAOYSA-N	442.213	1.785	50	20	IDGD	
COc1cccc([C@@H](C)CC(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)c1	765737658	HVRPVNJDCIZVBA-SFHVURJKSA-N	438.528	1.794	50	20	IDGD	
CCOc1ncc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cc1Cl	765737659	HVVDNWOIZBQNNF-UHFFFAOYSA-N	445.907	1.353	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1cccc(N2CCN(CC3CC3)CC2)c1	766260985	NCFYMGYDFLBHGK-UHFFFAOYSA-N	425.493	1.099	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1ccc(C(=O)N2CCC[C@H](C)C2)cc1C	766271700	OWQXIYYXWBPFAJ-ZDUSSCGKSA-N	426.477	1.748	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNS(=O)(=O)c1ccc([N+](=O)[O-])c2cccnc12	766355668	ZWTKKMBTZPLXPU-UHFFFAOYSA-N	446.441	1.930	50	20	IDGD	
COCc1c(C(=O)OCC(=O)NNC(=O)Cc2nc(C)cs2)cnn1-c1ccccc1	767729646	RIYDDRADHZFIAY-UHFFFAOYSA-N	443.485	1.331	50	20	IDGD	
CCCCCn1nc(C(=O)NNS(=O)(=O)c2cnc(C)s2)c2ccccc2c1=O	768846933	DKNTZXJBSCDOBJ-UHFFFAOYSA-N	435.531	1.975	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)N[C@@H]3CCCC[C@@H]3CNC(=O)OC(C)(C)C)nc21	770402660	UAEJEDAHZRPJTO-DGCLKSJQSA-N	434.501	1.779	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)NCC1CCN(S(C)(=O)=O)CC1	770445446	GQWGPCFQDSANGE-GFCCVEGCSA-N	432.930	1.109	50	20	IDGD	
O=C(Cc1cccnc1)NNS(=O)(=O)c1cc(C(=O)O)c(F)cc1Br	771144308	QSWXSAOGVDCGJN-UHFFFAOYSA-N	432.227	1.234	50	20	IDGD	
COc1ccccc1[C@@]1(C)NC(=O)N(CC(=O)NNC(=O)CNc2ccc(C)cc2)C1=O	771539022	CDZAMGQQZJZXJF-JOCHJYFZSA-N	439.472	1.030	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1ccccc1NS(=O)(=O)c1ccc(F)cc1	771890463	RWIYWXNAGCEAAW-LBPRGKRZSA-N	437.449	1.729	50	20	IDGD	
CCOC(=O)c1c(S(=O)(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)n[nH]c1C	773252202	ROUWKWMIUMZIKT-JTQLQIEISA-N	430.870	1.325	50	20	IDGD	
Cc1ccc([C@](O)(CC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)C(F)(F)F)o1	773334080	RWWOJLKBDSBWKG-GOSISDBHSA-N	441.410	1.582	50	20	IDGD	
CO[C@H](c1ccc(Br)cc1)[C@@H](C)NC(=O)NNC(=O)C(=O)N1CCCC1	774341372	PHASAMANLMPISE-RISCZKNCSA-N	427.299	1.478	50	20	IDGD	
Cc1nc(S(=O)(=O)N2CCC(C(=O)NNc3ncc(Cl)cc3Cl)CC2)cn1C	775269754	PGMBGTROQYBBEK-UHFFFAOYSA-N	447.348	1.974	50	20	IDGD	
CCOC(=O)c1c(NC(=O)NNC(=O)Cc2ccc(F)cc2)c(C#N)cn1CCOC	775765732	MXJIAHUBLBBXOE-UHFFFAOYSA-N	431.424	1.717	50	20	IDGD	
O=C(CN[C@H](c1ccc2c(c1)OCCO2)C1CC1)NNC(=O)c1cccc([N+](=O)[O-])c1	776014529	JEGCSHXIOSFOFX-FQEVSTJZSA-N	426.429	1.868	50	20	IDGD	
CC1C[C@H](C(=O)NNc2nccnc2Cl)[C@@H](C(=O)NNc2nccnc2Cl)C1	776148712	TWDYEMSEWGHVHA-UWVGGRQHSA-N	425.280	1.822	50	20	IDGD	
CC(C)C[C@H]1C[C@@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)CCO1	777752203	YOWYYPKZBOJOGL-HOTGVXAUSA-N	426.539	1.475	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)N[C@@H]1CCN(c2ccc(F)c(Cl)c2)C1=O	777752693	PHKJWTXWLKYQPV-CQSZACIVSA-N	436.827	1.699	50	20	IDGD	
O=C(CNC(=O)c1cccc(O)c1)NNC(=O)COc1ccccc1Cc1ccccc1	778291626	XGMCJQGWYAGZAU-UHFFFAOYSA-N	433.464	1.939	50	20	IDGD	
CCn1cc(-c2nn(C)cc2C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)cn1	778666131	DTSCHGIDCOXIFT-UHFFFAOYSA-N	429.506	1.501	50	20	IDGD	
O=C(NNc1ccc([N+](=O)[O-])cc1Br)C(=O)Nc1cccnc1-n1cncn1	778759660	LTOUSBHGEIEBIG-UHFFFAOYSA-N	447.209	1.415	50	20	IDGD	
COc1ccc(C(=O)NNc2cc(Cl)nc(N)n2)cc1S(=O)(=O)NC1CCCC1	779373758	ZDSFOYHEXNMLEM-UHFFFAOYSA-N	440.913	1.699	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)NCc2ccccc2CN2CC[C@@H](O)C2)cc1	781835995	WAHRJRQVVHFZLY-HXUWFJFHSA-N	426.517	1.725	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)Nc1ccccc1CN1CCN(C(C)=O)CC1	782077893	GXHFXVSVWGEVCX-UHFFFAOYSA-N	439.516	1.755	50	20	IDGD	
CCCCCSc1nc2ccc(NC(=O)C(=O)NNC(=O)C(=O)NC3CC3)cc2s1	782964977	DIKHAFCDGKAZOL-UHFFFAOYSA-N	449.558	1.943	50	20	IDGD	
CN(C)CC1CCN(c2ccc(NC(=O)C(=O)NNc3cncc(Cl)n3)cc2)CC1	783268181	PZUASXWQNLMMPT-UHFFFAOYSA-N	431.928	1.990	50	20	IDGD	
COC(=O)c1cc(OC)c(OC)cc1NC(=O)C(=O)NNC(=O)Nc1ccccc1C	783410806	KEHCWUSOFDVDHC-UHFFFAOYSA-N	430.417	1.590	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)Cc1cc2c(cc1Br)OCCO2	784417232	OFOCBRAMNUBAQB-UHFFFAOYSA-N	428.283	1.215	50	20	IDGD	
O=C(NNc1ccccn1)C(=O)N1CCc2cc(S(=O)(=O)N3CCCCC3)ccc21	784791459	HWBKUWHCEIXQJY-UHFFFAOYSA-N	429.502	1.289	50	20	IDGD	
O=C(NNc1nc(-c2ccc(Cl)cc2)no1)C(=O)Nc1cccnc1N1CCOCC1	784799487	HDFIVZWUUNXHHX-UHFFFAOYSA-N	443.851	1.703	50	20	IDGD	
CNC(=O)c1cccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)c1C	784835247	JWRGOZSHSQLXJL-UHFFFAOYSA-N	440.428	1.433	50	20	IDGD	
CSCCNC(=S)NNC(=O)COc1cccc(I)c1	785229918	QGFXIJUUGWGYEJ-UHFFFAOYSA-N	425.317	1.528	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1cccc(S(=O)(=O)Nc2ccc(C)cc2)c1	785437615	OASZMPKJEFOZSL-AWEZNQCLSA-N	433.486	1.899	50	20	IDGD	
CN(C)Cc1ccc(NC(=O)C(=O)NNC(=O)Cc2cccnc2)cc1Br	786417149	MQJGLEDAHYVWMT-UHFFFAOYSA-N	434.294	1.234	50	20	IDGD	
Cc1cn(C)c(CC(=O)NNC(=O)OC(C)(C)C)c1C(=O)NNC(=O)OC(C)(C)C	786615744	RFLIXPNCIMXVBI-UHFFFAOYSA-N	425.486	1.601	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)c1cc(N2CCNC(=O)C2)ccn1	786694679	XMFNRLAHZRUNGZ-UHFFFAOYSA-N	436.497	1.525	50	20	IDGD	
CC(C)(O)C(=O)NNC(=O)c1ccc(NS(=O)(=O)c2ccc(F)c(Cl)c2)cc1	787949905	QYFOCWDYPHWDQQ-UHFFFAOYSA-N	429.857	1.812	50	20	IDGD	
CS(=O)(=O)c1cc(NC(=O)C(=O)NNC(=O)c2c[nH]c3ccccc23)ccc1Cl	788330778	LEBZKQKDZQJIOU-UHFFFAOYSA-N	434.861	1.625	50	20	IDGD	
O=C(CC1CCC2(CC1)OCCO2)NNc1ccccc1S(=O)(=O)N1CCOCC1	788510914	FKNLWEXBCYNTSB-UHFFFAOYSA-N	439.534	1.474	50	20	IDGD	
Cn1nc(-c2ccc(F)cc2F)cc1NC(=O)C(=O)NNC(=O)C1=S=C2CCCC2=C1	789733296	YMQXAFUSSFJBIH-UHFFFAOYSA-N	445.451	1.653	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cc(N3C[C@H](C)O[C@@H](C)C3)ccn2)cc(OC)c1OC	789941198	GVDYDMNAINRBLR-KBPBESRZSA-N	444.488	1.796	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cn(C)c3c(cnn3C)c2=O)ccc1OCCC(C)C	791195977	MOPMQOSPYVEDME-UHFFFAOYSA-N	441.488	1.780	50	20	IDGD	
CCCCn1ncc(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)c1C(C)C	792268952	QOKCYTOJLJTKSA-UHFFFAOYSA-N	426.477	1.843	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)C(=O)Nc1cccc(N2C(=O)CCCC2=O)c1	792354680	BGJUDTKOCYOHOW-UHFFFAOYSA-N	426.404	1.198	50	20	IDGD	
O=C(NNc1nc2ccccn2n1)C(=O)Nc1ccc2nc(N3CCOCC3)sc2c1	792387922	JQFOZBMPDARANC-UHFFFAOYSA-N	438.473	1.257	50	20	IDGD	
CCOC(=O)c1csc([C@@H]2CCCN2CC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)n1	792471172	PKKPWLWTLRZKRM-HNNXBMFYSA-N	447.473	1.826	50	20	IDGD	
CCOC(=O)c1cc(C(=O)NNc2ccccc2S(=O)(=O)N(C)C)cc([N+](=O)[O-])c1	795177717	QQMWXIGWTPNEDQ-UHFFFAOYSA-N	436.446	1.779	50	20	IDGD	
CCNC(=O)N(C)c1cccc(NC(=O)C(=O)NNC(=O)c2cccc(OC(F)F)c2)c1	797004227	IAYUROQJJSYPSN-UHFFFAOYSA-N	449.414	1.853	50	20	IDGD	
CCOc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NNC(=O)CSc1ccccc1OC	799258709	HBWDWAOWCZPFQK-UHFFFAOYSA-N	448.457	1.880	50	20	IDGD	
Cc1c(NNC(=O)c2ccc(F)c(S(=O)(=O)N3CCOCC3)c2)cccc1[N+](=O)[O-]	801175673	FYPLOWJHQWVEGJ-UHFFFAOYSA-N	438.437	1.820	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)CCc2ccc(S(=O)(=O)NC3CC3)cc2)cc1	802064821	BWNPAQYHMAFFFY-UHFFFAOYSA-N	432.502	1.921	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)NC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1	802334074	SKPSOWOERIUIRN-KRWDZBQOSA-N	435.440	1.396	50	20	IDGD	
C[C@@H](CCNS(=O)(=O)c1ccccc1)NC(=O)NNc1ccc(-n2ccnc2)nn1	805468105	NNHXZLINJGKFRT-AWEZNQCLSA-N	430.494	1.046	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)Nc1cc(F)c(F)cc1N1CCOCC1	806706130	GBDFYBSAMXXDKU-UHFFFAOYSA-N	444.398	1.917	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3ccnc4ccncc34)cc2)CC1	806782777	WWVOXPMDAPAIDA-UHFFFAOYSA-N	426.502	1.323	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cccc4c3CNC4=O)n[nH]2)cc1C	806979474	WHVLUVQNYYPQDA-UHFFFAOYSA-N	432.440	1.337	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)N[C@H]2CCN(Cc3ccc(OC)cc3OC)C2=O)c1	807577778	IADKZSWYONQVPK-SFHVURJKSA-N	442.472	1.918	50	20	IDGD	
O=C(NNC(=O)c1ccc(COc2ccccc2)o1)C(=O)Nc1cccc2c1COC2=O	808934714	SCFLILHUBXJWOC-UHFFFAOYSA-N	435.392	1.929	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)OCCOc2ccc(S(=O)(=O)N(C)C)cc2)cc(C#N)n1C	809302102	AEMVNKVTCUONCT-BOPFTXTBSA-N	442.497	1.985	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)C2(COC)CCOCC2)c2ccccc2c1=O	809982315	BIDXCSZDRUVKQC-UHFFFAOYSA-N	430.505	1.791	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)Nc2cc(C(N)=O)ccc2OCC(F)F)c1	810341257	GGWAPLUEQJFBEN-UHFFFAOYSA-N	438.387	1.913	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)NCC(=O)NNc2nc(C(F)(F)F)cs2)cc1	810497319	SFJRDQJCXDDFRP-UHFFFAOYSA-N	437.425	1.542	50	20	IDGD	
O=C1CC(=O)Nc2cc(S(=O)(=O)NNC(=O)c3ccc(Cl)cc3Cl)ccc2N1	812548315	HMRFEZJPRBCOJI-UHFFFAOYSA-N	443.268	1.897	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)Nc2ccccc2CN2CCOCC2)cc1	812927082	ZOHFBTPIAQKJPZ-UHFFFAOYSA-N	433.534	1.918	50	20	IDGD	
CC(=O)Nc1c(C)ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)c1C	813034034	WBCAEXNHDLDAES-UHFFFAOYSA-N	447.517	1.594	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)c2nnn(-c3ccn(C)n3)c2C)c1	814409179	ZDKPXSOGGGUTGL-UHFFFAOYSA-N	434.254	1.155	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN2CCCNC(=O)[C@@H]2Cc2ccccc2)cc1C	815142286	QDOJPPYSWMUYCF-KRWDZBQOSA-N	428.558	1.813	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)C(=O)Nc2sccc2C#N)c2ccccc2c1=O	815566559	XYYMKXPOIJJOIL-UHFFFAOYSA-N	438.469	1.529	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1ccc(Br)cn1	815751466	AHUHSKLMSBZSNX-UHFFFAOYSA-N	442.295	1.176	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3ccnc(-c4ncc[nH]4)c3)CC2)cc1	815827258	RAVPNYCHTWKADS-UHFFFAOYSA-N	433.516	1.359	50	20	IDGD	
O=C(Cc1ccc2c(c1)CCO2)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	821999063	YIJUXQHETYTPHD-UHFFFAOYSA-N	443.525	1.800	50	20	IDGD	
CCOc1ccc(N2C[C@H](C(=O)NNC(=O)CNc3ccccc3OC)CC2=O)cc1	825649303	KSVFUJHHPUCFNU-OAHLLOKOSA-N	426.473	1.706	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2ccnc2)nc1)c1ccc(S(=O)(=O)N2CCCC2)cc1	896707869	IRKORBZYWWZXSK-UHFFFAOYSA-N	440.485	1.127	50	20	IDGD	
C[C@@H]1CN(S(=O)(=O)c2ccc(C(=O)NNC(=O)NC3CCCCC3)cc2)C[C@@H](C)O1	913450950	FFGDJEKGDPFJND-HUUCEWRRSA-N	438.550	1.761	50	20	IDGD	
CCN1C[C@@H](C(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)CC1=O	914711885	LFHHDJFSUNTBHP-INIZCTEOSA-N	433.468	1.074	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C2CCCC2)cc1S(=O)(=O)NCc1ccccn1	914868611	JQFCHJIJNHBKTM-UHFFFAOYSA-N	432.502	1.520	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2ccc(-n3ccnc3S)cc2)c2ccccc2c1=O	915675649	XQZLBUIRPUACET-UHFFFAOYSA-N	434.481	1.966	50	20	IDGD	
COc1ccc([C@@H](CNC(=O)NNc2ccc(-n3cccn3)nn2)N(C)C)cc1OC	915894665	MVKWONVWXILMPK-OAHLLOKOSA-N	426.481	1.609	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2ccc(Cl)cc2)c1	916107966	WKHVICRFJIPVPX-UHFFFAOYSA-N	445.950	1.994	50	20	IDGD	
CC(=NNC(=O)c1ccc2c(c1)OCO2)c1ccc(S(=O)(=O)NCCCC(=O)O)cc1	916289289	LUFCFXMRCOBGFQ-UHFFFAOYSA-N	447.469	1.712	50	20	IDGD	
N#Cc1cccc(NNC(=O)NCc2ccc(S(=O)(=O)NC[C@@H]3CCCO3)cc2)c1	916648827	CZAHTCISVFMNFL-SFHVURJKSA-N	429.502	1.842	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)CCc2ccc(S(N)(=O)=O)cc2)c1	916828322	WPQRRHCCPXXKRK-UHFFFAOYSA-N	433.530	1.925	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)CN3C(=O)N[C@@]4(CCCC[C@@H]4C)C3=O)n[nH]2)cc1	917175685	HSKQOCRMFOKHQZ-RCDICMHDSA-N	438.488	1.647	50	20	IDGD	
CCNS(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)Cn2c(CC)nc3ccccc32)c1	917920315	SLJRYKJUJJKBKG-UHFFFAOYSA-N	447.492	1.497	50	20	IDGD	
CCNC(=O)COc1cccc(CNC(=O)NNC(=O)COc2cc(C)cc(C)c2)c1	918090287	GDYNDRXJEMPMKS-UHFFFAOYSA-N	428.489	1.728	50	20	IDGD	
O=C(CS[C@H]1CCS(=O)(=O)C1)NNC(=O)c1ccc(F)cc1Br	918641499	CTKDEYSRBRVRRH-VIFPVBQESA-N	425.301	1.270	50	20	IDGD	
CCS(=O)(=O)NC1CCN(C(=O)NNC(=O)c2cc3c(s2)CC[C@H](C)C3)CC1	918779543	YUHJJWYFNCDUQT-LBPRGKRZSA-N	428.580	1.631	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)N[C@@H]3CCc4cc(F)ccc43)nc2)CC1	919919439	CSHBXYQJODGCOJ-GOSISDBHSA-N	448.524	1.470	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)NCc1cccc(NC(=O)[C@@H]2CCCO2)c1	920238082	PTNZUYCPSMZCGM-SFHVURJKSA-N	430.436	1.853	50	20	IDGD	
CC(C)(Oc1ccc(F)cc1)C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	920674916	ROHQCNAZFSZECM-UHFFFAOYSA-N	429.857	1.745	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)C(C)(C)NC(=O)OC(C)(C)C)c2ccccc2c1=O	921300847	DABQPVADRAJKQD-UHFFFAOYSA-N	431.493	1.871	50	20	IDGD	
COc1ccc(OC)c(C2=NO[C@@H](C(=O)NNC(=O)c3cncn3-c3ccccc3)C2)c1	1116857571	ZBPJEEDQXYQUFD-HXUWFJFHSA-N	435.440	1.844	50	20	IDGD	
O=C(NCCNC(=O)c1ccc(Cl)cc1)NNC(=O)c1cncn1-c1ccccc1	1317870723	FMECYPYMELUFIN-UHFFFAOYSA-N	426.864	1.900	50	20	IDGD	
O=C(CNC(=O)c1cc(Cl)ccn1)NNC(=O)c1cc(F)ccc1Br	1318305268	CILGBQWBAFLRCP-UHFFFAOYSA-N	429.633	1.828	50	20	IDGD	
COCCn1cc(NC(=O)NNC(=O)COc2ccc(Br)cc2)ccc1=O	1337784248	XZEGLMFWIXTCPD-UHFFFAOYSA-N	439.266	1.489	50	20	IDGD	
Cc1cccc2[nH]c(C(=O)N3CC[C@]4(CN(C(=O)CCC(=O)NN(C)C)CCO4)C3)cc12	1778502109	WSTRCJILUBUARY-QHCPKHFHSA-N	441.532	1.293	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(NC(C)=O)o3)C2)C1	1779030325	OBIKWIADDBEWOX-SCLBCKFNSA-N	442.310	1.855	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)/C=C/C(=O)NCc3ccco3)C2)C1	1779207085	UJPZUUVIWXMGNH-LYSGITKLSA-N	437.924	1.547	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3nn(C)c(C)c3Br)C2)C1	1780368304	IOARMIISXGUNPQ-PXAZEXFGSA-N	447.761	1.952	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccnnc1O)C2	1780715002	LXVHSIKVALDSSE-FSPWUOQZSA-N	431.320	1.546	50	20	IDGD	
C=C[C@H](O)C(C)(C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Br)C1	1780774703	IVOVNMZNJUQEES-HNSFDTNUSA-N	435.334	1.764	50	20	IDGD	
C[C@H](C(=O)N1CCO[C@@]2(CCN(C(=O)[C@](C)(Cl)CCl)C2)C1)n1cccc1C=O	1781226835	AUOUNAMQYWYSGU-ZMYBRWDISA-N	430.332	1.928	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)[C@H]3Cc4ccccc4CN3)CCO2)C1	1781229824	MJFFZSARQWGEQY-UIFIKXQLSA-N	440.371	1.767	50	20	IDGD	
O=C1CCc2ccc(C(=O)N3CCO[C@@]4(CCN(C(=O)[C@@H](F)Br)C4)C3)cc21	1781332547	IBQCYBDHYUHSEW-VQIMIIECSA-N	439.281	1.950	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)Cc3ccc(OC)cc3[N+](=O)[O-])C2)C1	1781412083	TWWQXRIAUJPYMD-OXQOHEQNSA-N	439.896	1.993	50	20	IDGD	
CC(=O)O[C@@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)Br)C1)C(C)C	1781997809	JEWCGUZUZYQCBZ-NVQRDWNXSA-N	447.370	1.871	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(C)(C)NCCC#N)C2	1781998011	MIZVCZTUFGURCA-QMTMVMCOSA-N	443.386	1.566	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)Cn2cnc3ccccc32)C1	1782101338	IYOZHDPYXDNDDK-DKZVUGQWSA-N	448.951	1.804	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](NC(C)=O)C(C)(C)C)CCO2	1783344774	WOKSAGGCUYJVQT-KHYOSLBOSA-N	446.386	1.541	50	20	IDGD	
Cc1c(F)ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](C)Br)C3)C2)c1N	1783532551	KCCYMMLWEDOXBT-KZULUSFZSA-N	428.302	1.943	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(O)nc4ccccc34)CCO2)C1	1783875162	OIISYECQWLQRMK-IERDGZPVSA-N	433.892	1.638	50	20	IDGD	
COc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCBr)C[C@@H]32)cn1	1784759396	HSCDNCXFIYZCIY-KKUMJFAQSA-N	426.311	1.469	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)c3ccccc3)C[C@@H]21	1786404206	KKKBRYGZWMQSOP-NBOOPKSLSA-N	425.323	1.485	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nnsc3C3CC3)C[C@@H]21	1786406806	GKIJQBPKORZXRD-AVGNSLFASA-N	443.367	1.794	50	20	IDGD	
Cc1cc(C(=O)Nc2ccc(C3(NC(=O)c4ccc(B(O)O)cc4)CCC3)cc2)n(C)n1	1787372652	BSIVFGAJNIJMDV-UHFFFAOYSA-N	432.289	1.470	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc4c3OCCO4)[C@H]2C1	1787945775	LYLWAKXFZPCOBI-SCNOPHJPSA-N	438.908	1.305	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)c1cc2cc(F)c(F)cc2[nH]1	1788265250	XRBIAOZJGNCVCU-DWMWJDLSSA-N	441.862	1.639	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4n(n3)CCC4)C[C@@H]21)[C@H](F)Br	1789926145	OQJAHFWUVHHNAV-LVGORTOPSA-N	429.290	1.113	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)Br)C[C@@H]21	1790610634	SBCLORUJEAVSFK-DGTMBMJNSA-N	435.315	1.311	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)n3ccnc3C)C[C@@H]21	1790963973	QIZLIYXYEHVNJK-SRQBIAJPSA-N	441.370	1.906	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C(C)(C)CCl)cc1O	1792784854	WTPZMWSWBJFFEI-JLVBRIDZSA-N	437.924	1.819	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)CBr	1792872295	XGWOHZWHAVHETR-CSYMLDBXSA-N	426.149	1.390	50	20	IDGD	
Cc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)CBr)ccc1O	1792874600	SGWNFGJFKSUKMP-FAYQHZLMSA-N	425.323	1.935	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CC13CCCN1CCC3)C2	1795114825	ANJSSOHTMPAYGE-JLVBRIDZSA-N	428.371	1.380	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2cnccc2nc1C	1797362762	XUHDIKVHQPNFGO-LORHWOILSA-N	432.908	1.395	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2cncn2c1	1797529909	MDCGTSZVIJZTSF-QHHYFVSCSA-N	425.316	1.774	50	20	IDGD	
Cc1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)cc1F	1798440027	UZKKBCXVIBTVMS-MUJYYYPQSA-N	425.464	1.698	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccn3cncc13)C2	1799275712	ATGDLWJJRIFHGB-AODNKKSCSA-N	425.316	1.774	50	20	IDGD	
COc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@](C)(Cl)CCl)ccc1O	1799277885	UVOWXHRPAQLFIZ-UESRRSCYSA-N	431.316	1.840	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(O)c([N+](=O)[O-])c1	1799483164	LUZNPCMECHBTGL-LOUJCGABSA-N	425.869	1.911	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1c(C)nc2ccc(F)cn12	1799953953	NYHDMIDDHKLMIO-YXPYIKCWSA-N	438.887	1.239	50	20	IDGD	
COc1ccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)Br)cc1	1800755938	AMSZVWWACYRUJK-LJGDNWOOSA-N	425.323	1.611	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COc1c(C)cc(C)cc1C)C2	1800970709	HHCDZIGQWNKRQP-DMUMMCEESA-N	438.952	1.834	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nnc(-c3ccccc3)o1)C2)C(Cl)Cl	1801017038	JXEYOZAHCVOVCR-CLLJXQQHSA-N	425.272	1.744	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)/C=C/c2ccc([N+](=O)[O-])o2)[C@@H]1c1cccnc1)[C@H](O)CCl	1803136086	NCNQCMKCVUACNM-LEHHUITDSA-N	448.863	1.902	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CCC(=O)N2CCCC2)[C@H]1c1cccnc1)[C@H](O)CCl	1803136321	PAKCBNGHXLUGIN-QKLQHJQFSA-N	436.940	1.090	50	20	IDGD	
NC(=O)c1ccccc1C(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]1c1cccnc1	1803140994	JWIZRMFRQXUWIF-FHLIZLRMSA-N	430.892	1.100	50	20	IDGD	
CNC(=O)CC(=O)NC[C@@H]1CCN(C(=O)[C@H](C)CBr)[C@@H]1c1cccnc1	1803473272	NHUCCXZSSWNEAP-HACGYAERSA-N	425.327	1.255	50	20	IDGD	
C=CC(=O)N[C@@H](C)C(=O)N1CCC2(CCCN(C(=O)[C@H](C)CBr)C2)CC1	1805385147	SWCGNYXYEBEMTA-CABCVRRESA-N	428.371	1.939	50	20	IDGD	
O=C(c1cc(=O)nc2sccn12)N1CCC2(CCCN(C(=O)[C@@H](O)CCl)C2)CC1	1805523165	QOKRLBDQSDQIQL-AWEZNQCLSA-N	438.937	1.201	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)N1CC[C@H](CNC(=O)CCBr)[C@@H]1c1cccnc1	1806343223	OAOHVKAWRRSJTO-SIIHOXLZSA-N	437.338	1.563	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC2(CCCN(C(=O)CNC(=O)c3cccs3)C2)CC1	1807098885	MQVJTOMOPAGBPB-OAHLLOKOSA-N	441.981	1.963	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1	1809980163	MIRSRMNQIMTORR-IBGZPJMESA-N	441.164	1.448	50	20	IDGD	
COC(=O)C1(C(=O)NC[C@H]2CCN(C(=O)CCBr)[C@@H]2c2cccnc2)CC1	1812685634	YNWYWKYTPYQHNK-GDBMZVCRSA-N	438.322	1.826	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1	1812864732	RGRGUNWALGRWCU-PPHDSNJXSA-N	449.305	1.991	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2cncc(F)c2)[C@H]1c1cccnc1	1813070950	MNQFHEAYIFJACQ-IERDGZPVSA-N	442.495	1.308	50	20	IDGD	
C[C@H](C(=O)N1CC[C@@H](CNC(=O)C(Cl)Cl)[C@H]1c1cccnc1)N1CCN(C)CC1	1813078793	KWRHHSJGFVUHKI-HYVNUMGLSA-N	442.391	1.527	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)C(=O)c2cccn2C)[C@H]1c1cccnc1	1813478297	GXSDSMQPLMHUHX-XYJFISCASA-N	432.908	1.563	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)[C@H](O)CCl)n[nH]2)cc1O	1814874737	CCTQZCVJYQPEOX-DOTOQJQBSA-N	449.895	1.979	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)C1(F)CC1)CC2	1817283219	XQTRJNWCZBSEEG-IVWJEFBKSA-N	432.481	1.691	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccccn1)CC2	1819795928	VWNZBVWBSOSNSK-LLVKDONJSA-N	437.485	1.076	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3nccnc3C(N)=O)sc2C1	1821032483	MJSRPAMWJNZUJX-ZJUUUORDSA-N	436.925	1.665	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CN2C(=O)C=CC2=O)[nH]n1	1822193084	ZYDXXHMTXUFUCR-ZYHUDNBSSA-N	438.282	1.110	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC[C@H]1C1CCN(C(=O)Cn2cncn2)CC1	1824094468	WTRCVKFAVHJXFN-HOCLYGCPSA-N	426.359	1.929	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)C[C@@H]2CCCCO2)CC1	1824904533	BXXHEFOIBKBTRU-FCHUYYIVSA-N	442.365	1.559	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC([C@H]2CCCCN2C(=O)CC[C@H](N)C(N)=O)CC1	1826931478	GOAAWCPZSXXSTH-VNQPRFMTSA-N	445.402	1.230	50	20	IDGD	
O=C(/C=C/c1cnccn1)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827059623	FADSSZXBWCEPAY-VQKOGROQSA-N	448.332	1.103	50	20	IDGD	
CC(C)=NO[C@H](C)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H](C)CBr)CCO2)C1	1830543274	OMRPUVYXNKZVPI-HDMKZQKVSA-N	448.358	1.275	50	20	IDGD	
Cc1ccc(CCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)s1	1830726052	NXERWZUNBWEJMT-QFBILLFUSA-N	430.954	1.045	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccnc(OC)c3F)C2)C1	1831645637	DWAQCJDBKWOZDQ-YWZLYKJASA-N	443.903	1.707	50	20	IDGD	
Cc1nccn1[C@@H](C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1	1832314742	WTABINVYSARKDJ-PXNSSMCTSA-N	446.596	1.745	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3ccc(=O)oc3)CC2)CC1	1834341036	WQKFEXRIUVWKAT-CYBMUJFWSA-N	440.338	1.608	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)c1cc2cccnc2[nH]1	1835580050	GCCHONFJVBGIJL-GOSISDBHSA-N	433.940	1.348	50	20	IDGD	
CC[S@@](=O)CCC(=O)NC1CCN(C2CCN(C(=O)CO[Si](C)(C)C)CC2)CC1	1835653839	FTJGMPXQAMVDNY-MUUNZHRXSA-N	445.702	1.568	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cn(C)c4ncccc34)CCO2)C1	1837190640	YLBFCWGUPRQKLH-UWJYYQICSA-N	434.924	1.661	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)N1CCC(OC2CCN(C(=O)CO[Si](C)(C)C)CC2)CC1	1838068086	YAGGDTXBQQNOQM-KRWDZBQOSA-N	442.633	1.283	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3Cc4ccccc4CN3C)C2)C1	1839142058	CRELMGSZPBFZDI-MZKRTTBSSA-N	449.979	1.517	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)C2)C1	1839147025	FGHQDXQDJITSFK-LPHOPBHVSA-N	441.868	1.388	50	20	IDGD	
CCc1ncccc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839197925	MTZCHBLFMHTKEF-MAUKXSAKSA-N	444.301	1.405	50	20	IDGD	
Cc1noc(C)c1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839198090	SMTXLKBUEPPUPY-CZUORRHYSA-N	434.262	1.052	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3c4c(nn3C)CCC4)CCO2)C1	1839581108	DLWAGBZYGOOKAB-KKSFZXQISA-N	438.956	1.386	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(F)(F)c1ccco1)CCO2	1839691931	UPLFVQHYBXPLEA-CXAGYDPISA-N	436.839	1.082	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccn3C)C2)C1	1839963692	SDOQTZKUKNUIKJ-KDOFPFPSSA-N	428.327	1.269	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)COC3CCCCC3)C2)C1	1840149574	SWONRQIJRRGPCE-YLJYHZDGSA-N	432.945	1.046	50	20	IDGD	
O=C(c1cc(C(F)(F)F)c[nH]1)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840187728	SLYJCOUHFXUDJO-OAHLLOKOSA-N	444.237	1.907	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CCc3ccccc31)CCO2	1840260650	WCXZBUXBMIETQR-IPJJNNNSSA-N	436.936	1.427	50	20	IDGD	
O=C(CCc1c[nH]c2ncccc12)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1840871127	TZAJCSXOASOUKQ-FXAWDEMLSA-N	438.887	1.486	50	20	IDGD	
Cn1c(CC(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)cc2ccccc21	1841250760	PYCFPRKRMAOKTE-UHFFFAOYSA-N	446.511	1.237	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC12CN(C(=O)c1cc3n(n1)CCCN(C)C3)C2	1841289054	IBUDIZVYGAXZDE-CQSZACIVSA-N	438.370	1.567	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)CCc1ccnc(C)c1)C2	1843415566	XLWMUADQRZEPPX-YZSQISJMSA-N	436.516	1.660	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1c(C)nc3ccccn13)C2	1843415927	DPXJAKVSNWAETF-WGOQTCKBSA-N	447.499	1.594	50	20	IDGD	
O=C([C@@H](O)CCl)N1CC2(CCCN2C(=O)c2cnc3ccc(C(F)(F)F)cn23)C1	1844069361	DQUYRYYHXMOGMT-ZDUSSCGKSA-N	430.814	1.770	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@](C)(NC(C)=O)c2ccccc2F)C1	1845262883	SWRUTEOMSWYGGP-OXQOHEQNSA-N	439.915	1.634	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)N2CCCC23CN(C(=O)[C@@H](O)CCl)C3)C1	1846186024	SNUFKSHXOAVUDD-CABCVRRESA-N	429.945	1.437	50	20	IDGD	
C#CCCC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl	1847565403	PHRAPTOTELSANQ-LTIDMASMSA-N	441.956	1.485	50	20	IDGD	
CN(C[C@H]1COc2ccccc2O1)C(=O)NNC(=O)c1csc(N2CCOCC2)n1	9789938	MQKSZVOUYHHVQO-ZDUSSCGKSA-N	433.490	1.106	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cc(-c3csc(C)n3)c[nH]2)cc1	21779057	NXZQQLNMJRYRLM-UHFFFAOYSA-N	447.542	1.837	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CSc2nnc(-c3ccco3)n2CCC(N)=O)cc1	25955502	CJDXQIWLZSSCID-UHFFFAOYSA-N	428.474	1.275	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)c2ccc3c(c2)CCCN3S(C)(=O)=O)c(C)c1	726102579	XANQHEZUIJTPQN-UHFFFAOYSA-N	430.530	1.889	50	20	IDGD	
O=C(NNc1nc(-c2ccncc2)no1)c1cccc(CN2CCS(=O)(=O)CC2)c1	728070786	IEYYZQPPEGXBCD-UHFFFAOYSA-N	428.474	1.119	50	20	IDGD	
O=C(NNc1nc(-c2ccccc2)no1)c1sccc1S(=O)(=O)N1CCOCC1	728080575	VCCQFBNDPLPCFB-UHFFFAOYSA-N	435.487	1.576	50	20	IDGD	
COc1ccc(-c2nnc(SCC(=O)N([C@H]3CCS(=O)(=O)C3)N(C)C)o2)cc1	728179680	NSSJNMASVRLQTH-ZDUSSCGKSA-N	426.520	1.330	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3nnc(O)c4ccccc34)cc2)CC1	728214142	YYGWALQILSWSQI-UHFFFAOYSA-N	442.501	1.028	50	20	IDGD	
CC(=O)Nc1cc(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)ccc1C	728214597	BLVWPTXRGOIDJF-UHFFFAOYSA-N	445.545	1.646	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCCN1C(=O)c1ccco1)C1CCN(c2ncccn2)CC1	728844781	BLCQNWUNQRTLPC-MRXNPFEDSA-N	426.477	1.128	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1oc2ccccc2c1CSc1ncccn1	729276862	MXQLSHBSDZUAIE-NSHDSACASA-N	449.514	1.214	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)NCCOc1ccc(S(C)(=O)=O)cc1	730066005	ATOQYWUSRNRDIK-UHFFFAOYSA-N	435.502	1.441	50	20	IDGD	
O=C(Cc1cc[nH]n1)NNC(=O)C1CCN(S(=O)(=O)c2ccc3ccccc3c2)CC1	730102444	DDEYSKIZOHKVHU-UHFFFAOYSA-N	441.513	1.354	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](CCNC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)C1	730138979	LGRKKMBVCIEOSR-YOEHRIQHSA-N	434.493	1.804	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)[C@@H]1CCN(c2ccc3c(c2)OCCO3)C1=O	730521062	OQRXPFCIAUKOAK-HNNXBMFYSA-N	445.859	1.934	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2ccc3c(c2)CC(=O)N3)cc1Br	732049025	VGRLJRYJTDXVFI-UHFFFAOYSA-N	440.275	1.576	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)C(C)(C)S(=O)(=O)c1ccc(Br)cc1	732082622	JHRAJLGGDSMORG-UHFFFAOYSA-N	429.296	1.494	50	20	IDGD	
O=C(COC(=O)c1cccc(Nc2ncccn2)c1)NNC(=O)c1cccc([N+](=O)[O-])c1	732322214	FNBZLENOKWSZER-UHFFFAOYSA-N	436.384	1.746	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)/C(=C/c1cccnc1)NC(=O)c1ccccc1	733123988	MZWTWRBRBLNGQC-UHWDDTASSA-N	444.447	1.840	50	20	IDGD	
CC(C)c1ccc(-n2c(NNC(=O)CC[C@H]3NC(=O)NC3=O)nc3ccccc3c2=O)cc1	733263904	FXVFZRBXFCYSEP-GOSISDBHSA-N	448.483	1.940	50	20	IDGD	
CCn1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)Nc3ccccc3OC)c2)cn1	733947639	BIYMHEKSUWOSHH-UHFFFAOYSA-N	443.485	1.787	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)[C@H]1CCCN1C(=O)OCC(F)(F)F	734241310	MELWEILUIYMYCP-SNVBAGLBSA-N	441.407	1.005	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)N2CCC[C@@H]2C(=O)NNc2ncccc2Cl)o1	734247652	WFFVQQRGQFLMOU-GFCCVEGCSA-N	442.881	1.801	50	20	IDGD	
CC(CS(=O)(=O)c1ccc(C)cc1)=NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	734294727	HWOYGMUENMEQGD-UHFFFAOYSA-N	443.934	1.875	50	20	IDGD	
CC(C)[C@H](CNC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)NC(=O)OC(C)(C)C	734517632	RHRFVUWMRPNKFW-HNNXBMFYSA-N	432.485	1.156	50	20	IDGD	
Cc1nn(CCCl)c(C)c1C(=O)NCCNS(=O)(=O)c1ccccc1[N+](=O)[O-]	735015469	JWDCGUNOXASPMC-UHFFFAOYSA-N	429.886	1.355	50	20	IDGD	
O=C(NNc1ccc(Cl)nn1)[C@H]1CCCN1S(=O)(=O)c1cccc([N+](=O)[O-])c1	735687157	VCRNANHGVXLVSZ-GFCCVEGCSA-N	426.842	1.335	50	20	IDGD	
Cn1c(CCC(=O)NNc2cccnn2)nc2cc(S(=O)(=O)N3CCCCC3)ccc21	736697306	FCUCZTOHUHWHQR-UHFFFAOYSA-N	443.533	1.614	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)C1CCN(S(=O)(=O)c2ccccc2F)CC1	737629405	PNQZWGCQCQBCOJ-UHFFFAOYSA-N	449.504	1.591	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCCCCC2)cc1)NNc1ncnc2[nH]cnc12	740746647	ZMNNVQDPXPOMHH-UHFFFAOYSA-N	443.533	1.994	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNS(=O)(=O)c2ccc(C#N)cc2[N+](=O)[O-])cc1	741204286	MCSHZZMMIMDXCE-GFCCVEGCSA-N	434.430	1.642	50	20	IDGD	
O=C(NNC(=O)[C@@H](c1ccccc1F)N1CCOCC1)c1nnc(O)c2ccccc12	742474504	QUXGGARPBQFMNE-GOSISDBHSA-N	425.420	1.309	50	20	IDGD	
N#Cc1ccc(S(=O)(=O)NNC(=O)c2cccc(Br)c2)c([N+](=O)[O-])c1	743263583	HHHKMRRTHOBYMV-UHFFFAOYSA-N	425.220	1.852	50	20	IDGD	
COc1ccccc1-c1noc([C@@H](C)NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)n1	743510054	PBHVGFWNANRCGZ-GFCCVEGCSA-N	449.431	1.426	50	20	IDGD	
O=C(NCCCn1nc2n(c1=O)CCCC2)NNC(=O)c1cccc(Br)c1	743556228	BAOKPYNXNURWDK-UHFFFAOYSA-N	437.298	1.178	50	20	IDGD	
COC[C@](C)(O)CNC(=O)/C(C#N)=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	743771294	FOYNXRPNMWQASC-WHIQYKQFSA-N	445.907	1.499	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2cccc(NC(=O)[C@H]3CCCO3)c2)cc1	743830375	SYGAOIRGZDAVFJ-QGZVFWFLSA-N	446.485	1.674	50	20	IDGD	
CC[C@@H](C)NS(=O)(=O)c1ccc(C(=O)OCC(=O)NNC(=O)c2cccc(C)c2)cc1	744561288	OUZWQJLFRWXNFM-OAHLLOKOSA-N	447.513	1.690	50	20	IDGD	
COC(=O)[C@@H](C)Sc1ccccc1C(=O)OCC(=O)NNC(=O)c1cccc(C#N)c1	744824042	AXPFXBMLXYUWDA-CYBMUJFWSA-N	441.465	1.830	50	20	IDGD	
CC(=O)c1cccc(O[C@H](C)C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)c1	745107568	HSQNKHWYRBEOCW-MRXNPFEDSA-N	447.513	1.433	50	20	IDGD	
CCc1cnc(CNC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)s1	745905187	WGHZJERKBCABJC-UHFFFAOYSA-N	437.547	1.634	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)[C@H]1CC12CCCC2	747296403	YNDUVUGVZWALEF-GOSISDBHSA-N	435.546	1.368	50	20	IDGD	
O=C(CSc1nnc(S)s1)NNc1ccccc1S(=O)(=O)N1CCOCC1	747413264	LRJDXHRKRIQWNF-UHFFFAOYSA-N	447.589	1.083	50	20	IDGD	
COc1cc(OC)cc(N2C[C@H](C(=O)NNC(=O)CCc3ccccc3O)CC2=O)c1	752520622	FMNUKFPLSFTTFA-OAHLLOKOSA-N	427.457	1.543	50	20	IDGD	
CC[C@@H](CS(=O)(=O)c1ccccc1)NC(=O)NNC(=O)COc1ccc(C#N)cc1	752704611	OMLJTCAMJHYWDG-INIZCTEOSA-N	430.486	1.520	50	20	IDGD	
CN(CC(=O)NNC(=O)c1cc2c(s1)CC[C@@H](C(C)(C)C)C2)[C@H]1CCS(=O)(=O)C1	753564145	OPCRQHOKMVTUIP-CABCVRRESA-N	441.619	1.779	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2cccc(OCCN(C)C)c2)c2ccccc2c1=O	755928169	ZZHKTINILKIDEE-UHFFFAOYSA-N	438.488	1.823	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)COc2ccc(F)cc2)cc1N1CCCS1(=O)=O	756705152	RXMSSSIXZJTOFF-UHFFFAOYSA-N	436.465	1.906	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)Nc3ccn(CCS(C)(=O)=O)n3)cc2C1	756758778	GOAHMGOAJZINNH-NSHDSACASA-N	425.536	1.581	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)CN1C(=O)NC2(C[C@@H](C)C[C@H](C)C2)C1=O	756871204	QPJCNNQRXZIVLS-STQMWFEESA-N	426.477	1.150	50	20	IDGD	
O=C(NCc1cc2c(cc1OC(F)F)OCO2)NNC(=O)c1nnc(O)c2ccccc12	757250571	JEMZGWPBQJBGNM-UHFFFAOYSA-N	447.354	1.810	50	20	IDGD	
Cc1nn(-c2ccccn2)c2nc(C3CC3)cc(C(=O)NNc3ccc(C(N)=O)nn3)c12	757409177	ZAVBIBCVEKKMTR-UHFFFAOYSA-N	429.444	1.647	50	20	IDGD	
CCCCn1ncc(NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)c1C	757751047	YVZGNFHALWDGHJ-UHFFFAOYSA-N	436.538	1.773	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)[C@@H](C)n2nnnc2C(C)(C)C)c1	758015695	IRJZWAXMJZRQCN-SECBINFHSA-N	425.287	1.764	50	20	IDGD	
O=C(CCN1C(=O)CNC1=O)Nc1ccc(NC(=O)NNC(=O)c2ccccc2F)cc1	758024502	HGOFTGDQSNJJKK-UHFFFAOYSA-N	442.407	1.173	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN[C@@H](Cc2nc(C)no2)c2ccccc2)cc1OC	759938121	VITHALMTKSYCHX-KRWDZBQOSA-N	439.472	1.730	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccnn2-c2cc(C)ccn2)o1	760276951	HGHCPAJBVCHIEQ-UHFFFAOYSA-N	439.476	1.410	50	20	IDGD	
COc1ccccc1[C@@H](NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)c1ccccn1	760286606	ALFIOTSYDXJUMD-HXUWFJFHSA-N	444.455	1.800	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)[C@@H]2CCCN2C(=O)NC(C)C)c1	760525516	XIWGQIRVUVVACP-AWEZNQCLSA-N	427.299	1.801	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1cnc([C@@H]2CCCO2)s1	760650556	ZZRLQMZCLNFSQR-AWEZNQCLSA-N	438.531	1.772	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(F)c(O)c(F)c2)c1	762543333	LMATYEKMGUNYET-UHFFFAOYSA-N	427.429	1.776	50	20	IDGD	
Cc1occc1C(=O)Nc1nc(CC(=O)NNc2nccc(N3CCOCC3)n2)cs1	762866863	HAYPSODJCSEQCD-UHFFFAOYSA-N	443.489	1.609	50	20	IDGD	
COc1cc(/C=C(/C#N)C(=O)Nc2ccc(S(N)(=O)=O)cc2)ccc1OCCC(=O)O	763370379	SDJGDFUHYQAQLG-UVTDQMKNSA-N	445.453	1.742	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)C(=O)Nc1cnc2ccccc2c1	763530931	KYAWLCZUILIOFN-UHFFFAOYSA-N	446.511	1.533	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)C(=O)Nc1cccc(-c2noc(C3CC3)n2)c1	763551546	PLBPICJLNHJUCT-UHFFFAOYSA-N	435.396	1.742	50	20	IDGD	
CNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(C)n(-c3ccccc3)c2C)cc1	763601226	JCGLQKRMYRDECX-UHFFFAOYSA-N	433.468	1.853	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc2c(cc1Cl)OCCO2	763682245	PTFMOKNTUIYHDY-UHFFFAOYSA-N	449.847	1.675	50	20	IDGD	
COCCOc1c(Cl)cccc1NC(=O)C(=O)NNC(=O)c1cccc(N(C)C)c1	763761023	YRJIWQDCTMYPBX-UHFFFAOYSA-N	434.880	1.831	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2nnc(O)c3ccccc23)cc1Br	763791456	SCVMGFCCNUHZDJ-UHFFFAOYSA-N	444.245	1.806	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1cnn(Cc2ccccc2)c1	763866249	NWKIPXFVOABFAV-CQSZACIVSA-N	425.420	1.624	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(C(C)=O)cc2)ccc1F	763879628	ZZRTXTUZNCTNPC-LBPRGKRZSA-N	445.403	1.368	50	20	IDGD	
CNC(=O)c1ccc(OC)c(NC(=O)C(=O)NNC(=O)CSc2ccc(C)cc2)c1	763896334	LKIQLZYJZLDHES-UHFFFAOYSA-N	430.486	1.241	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2c(C)ccn(C)c2=O)cc1OC	763911507	GLKILVRGRRLDHG-UHFFFAOYSA-N	430.461	1.281	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)Cc3ccc(F)cc3)cc2F)C[C@@H](C)O1	763918382	GCRSQRCQGYIQFM-OKILXGFUSA-N	446.454	1.907	50	20	IDGD	
O=C(NNC(=O)c1cc(Cl)ccc1O)C(=O)Nc1ccccc1CN1CCSCC1	763977443	PZEUDVFQUMMVEI-UHFFFAOYSA-N	448.932	1.994	50	20	IDGD	
CNC(=O)c1ccc(C)c(NC(=O)C(=O)NNC(=O)c2cccc(Br)c2)c1	764059293	QZQCTAGXPNKFCS-UHFFFAOYSA-N	433.262	1.517	50	20	IDGD	
CCOC(=O)Cn1ccc2cc(NC(=O)C(=O)NNC(=O)CCc3ccccc3)ccc21	764193145	QPGTYLJYUKIXOJ-UHFFFAOYSA-N	436.468	1.923	50	20	IDGD	
O=C(NNC(=O)c1cccc(OC(F)F)c1)C(=O)Nc1ccc2c(c1)S(=O)(=O)CC2	764252804	MTQXKDQDOBHDSJ-UHFFFAOYSA-N	439.396	1.018	50	20	IDGD	
Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)C(=O)NNC(=O)Cc1ccccn1	764268238	NEEYVYALAOTNKJ-UHFFFAOYSA-N	430.424	1.778	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1ccc(N2CCCC2)c(Cl)c1	764276023	WMIJDQWSRAOEHK-UHFFFAOYSA-N	432.864	1.811	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)ccc1O)C(=O)Nc1ccn(CC(F)F)n1	764281124	ZGYVRJNFOQIRRT-UHFFFAOYSA-N	432.181	1.016	50	20	IDGD	
C[C@H](c1cccc(NC(=O)C(=O)NNC(=O)Cc2ccccc2F)c1)N1CCOCC1	764320408	FWNSLZLULXXRMR-OAHLLOKOSA-N	428.464	1.548	50	20	IDGD	
COC(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)c1	764345103	AJXLRYTWGBVPBE-UHFFFAOYSA-N	426.212	1.885	50	20	IDGD	
CC[C@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)cc1	764349836	RMBKTIXOEKUEHU-NSHDSACASA-N	432.864	1.974	50	20	IDGD	
O=C(NNC(=O)[C@H]1COCCO1)C(=O)Nc1ccc(OCc2ccccc2Cl)cc1	764434607	QTYXCKHPKDTGAC-QGZVFWFLSA-N	433.848	1.420	50	20	IDGD	
CN(C)N(C(=O)c1cnn(-c2ccccc2)c1Br)[C@H]1CCS(=O)(=O)C1	764976597	FVDNJSCWGPOCFT-ZDUSSCGKSA-N	427.324	1.741	50	20	IDGD	
Cc1cc(C)c(S(=O)(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)c(C)c1	765119447	WZQVHYYXTIWJJL-UHFFFAOYSA-N	444.557	1.379	50	20	IDGD	
CNS(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)c1	765318742	OIZAHTDHPRYXRD-UHFFFAOYSA-N	448.929	1.314	50	20	IDGD	
C[C@H](OC(=O)[C@H](Br)C(C)(C)C)C(=O)NCCc1ccc(S(N)(=O)=O)cc1	766749727	OLYDYFRMNQQDLY-FZMZJTMJSA-N	449.367	1.734	50	20	IDGD	
CCc1[nH]nc(C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)c1[N+](=O)[O-]	768290157	DEKLJUDZWGEYJF-UHFFFAOYSA-N	449.899	1.113	50	20	IDGD	
COc1ccc(NNC(=O)c2cc(S(N)(=O)=O)ccc2Br)c([N+](=O)[O-])c1	768329176	QJBTWCCNIOUWME-UHFFFAOYSA-N	445.251	1.770	50	20	IDGD	
COc1ccc(-c2nn(CCC#N)cc2/C=C(/C#N)C(=O)NCc2ncn(C)n2)cc1OC	769123261	XYCOBUWBKYCPFG-SXGWCWSVSA-N	446.471	1.833	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)NC(C(N)=O)C(N)=O)c(C)n1-c1ccc(Br)cc1	769756215	LHTWDIQKZJKOCZ-JYRVWZFOSA-N	444.289	1.219	50	20	IDGD	
O=C(NCc1cccc2c1OCCCO2)NNC(=O)C1CCN(c2ncccn2)CC1	769996508	IHESXQWDEXNVKN-UHFFFAOYSA-N	426.477	1.385	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)N[C@@H]1CC(=O)N(c2c(F)cccc2F)C1	770845601	ZJTIQMDINKLQGX-BZNIZROVSA-N	432.383	1.241	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)COc3ccc(I)cc3)nc21	770983600	NHKVNWNQQUCIMT-UHFFFAOYSA-N	440.201	1.196	50	20	IDGD	
CC(=NNC(=O)C(=O)NCc1ccc(Cl)cc1)c1ccc(OCC(=O)N(C)C)cc1	771569251	ZQZBNTKJQMRQKK-UHFFFAOYSA-N	430.892	1.964	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCCC(=O)NNc2ccc(F)c([N+](=O)[O-])c2)cc1	771590727	PDIPORLISLHVJF-UHFFFAOYSA-N	426.426	1.944	50	20	IDGD	
CCCCOc1ccc(NC(=O)C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cn1	773500272	SLDASXRJCDTPLD-UHFFFAOYSA-N	438.444	1.552	50	20	IDGD	
O=C(NNc1ncccn1)C(=O)Nc1ccc(Cl)c(S(=O)(=O)N2CCCCC2)c1	773718058	AOHIJEKUSBHTHF-UHFFFAOYSA-N	438.897	1.386	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2ccc(N3CCC(N(C)C)CC3)c(F)c2)n1	773723909	IMZOURVETZKXMI-UHFFFAOYSA-N	431.472	1.237	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)NCc2ccc(S(N)(=O)=O)c(C)c2)c1C	773747169	VLCQFIFYFIHXFP-ODLFYWEKSA-N	430.530	1.931	50	20	IDGD	
Cc1nccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)n1	776493298	CXORDXPJIABKML-UHFFFAOYSA-N	440.485	1.730	50	20	IDGD	
CC(C)CNS(=O)(=O)c1ccc(C(=O)NNc2cccc(S(C)(=O)=O)c2)cc1	776539948	PAGLOPPYKPWDPI-UHFFFAOYSA-N	425.532	1.781	50	20	IDGD	
C[C@@H](CC(=O)NNc1cccc(S(C)(=O)=O)c1)NS(=O)(=O)c1cccnc1Cl	776721142	MYLCLFXZXNSENW-NSHDSACASA-N	446.938	1.339	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NC2CCN(S(=O)(=O)CC(C)C)CC2)cc1C	777765143	FLWKBPVGDQBHEE-UHFFFAOYSA-N	440.566	1.463	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H](CC(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)C1	778434685	SKAWHULIQYSDTF-HNNXBMFYSA-N	430.461	1.510	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)c1cccnc1	778438006	JWFGEACGJJRJKS-KRWDZBQOSA-N	441.488	1.095	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)F)cc1)[C@@H](O)[C@@H](O)c1nc2ccccc2s1	779535996	GOENUZZAZWXKDM-UONOGXRCSA-N	443.453	1.830	50	20	IDGD	
O=C(O)c1cc(S(=O)(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c(F)c(Cl)c1F	779830503	WKIAVEVBUAHNJZ-JTQLQIEISA-N	448.787	1.466	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)[C@H]1CCCN1c1ncnc2sccc12	780973663	FDNFWDMKXKMMSL-CYBMUJFWSA-N	434.522	1.722	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)Nc1ccccc1CN1CCN(C(C)=O)CC1	782079335	ZKNIEOXTROBWIT-UHFFFAOYSA-N	425.489	1.826	50	20	IDGD	
O=C(NNC(=O)c1cccc(NS(=O)(=O)C(F)(F)F)c1)c1ccc([N+](=O)[O-])cc1	782540799	WSCKDHFGWYZIOV-UHFFFAOYSA-N	432.336	1.931	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)c(C)c1F	782911328	XDMIRQLUPHECHN-UHFFFAOYSA-N	428.438	1.792	50	20	IDGD	
CN(Cc1ccccc1)c1ccccc1NC(=O)C(=O)NN[C@]1(C)CCS(=O)(=O)C1	783425877	JIHGDJTVHJSEHQ-OAQYLSRUSA-N	430.530	1.460	50	20	IDGD	
CCc1csc(NC(=O)C(=O)NNC(=O)c2cc(OC)ccc2Br)n1	789735149	LLTFOZBCEOONGD-UHFFFAOYSA-N	427.280	1.876	50	20	IDGD	
O=C(NNc1nc2ccccn2n1)c1cc(I)ccc1-n1cnnn1	791241778	AWFJAAFQCQVEML-UHFFFAOYSA-N	447.200	1.067	50	20	IDGD	
COC(=O)[C@H]1CCCCN1C(=O)c1cccc(NC(=O)C(=O)NNc2ncccc2C)c1	792378258	LVNAPZXSFGDAJT-QGZVFWFLSA-N	439.472	1.640	50	20	IDGD	
Cc1cccnc1NNC(=O)C(=O)Nc1ccc(N2CCN(C)CC2)c(Br)c1	792379357	FJQOUPRJDVFFDJ-UHFFFAOYSA-N	447.337	1.986	50	20	IDGD	
Cc1cc(C(=O)N([C@H]2CCS(=O)(=O)C2)N(C)C)ccc1NS(=O)(=O)C(F)(F)F	792847903	BNFJCBMJIFJMEB-LBPRGKRZSA-N	443.469	1.362	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2nnn(Cc3ccncc3)c2C)c2ccccc2c1=O	794774869	IBSHGGPYYQUXAQ-UHFFFAOYSA-N	446.471	1.225	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)[C@@H](C#N)Cc1ccc(C#N)cc1	795827603	ZWBURQNNIQCXRJ-OAHLLOKOSA-N	440.843	1.907	50	20	IDGD	
CNC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3n2)c(C)c1	796990841	GSIJWFYDLBFNKK-UHFFFAOYSA-N	435.440	1.068	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@H]2C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1	798391451	HBPCFNQKBGQVGQ-SFHVURJKSA-N	445.497	1.165	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)CCN/C(O)=C2/N=CC=CC2=O)c(OC)cc1Cl	802081336	LEQXVQGYXGHFDV-MSUUIHNZSA-N	437.840	1.426	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)NC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1	802338346	VTIHNUSIVAHMRN-INIZCTEOSA-N	434.456	1.715	50	20	IDGD	
N#Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)cc1Br	806977327	DVKYXBZBZNUHJX-OAHLLOKOSA-N	429.230	1.410	50	20	IDGD	
COC(=O)c1cc(C)c(NC(=O)C(=O)NNC(=O)c2cccc(OC)c2O)c(Cl)c1	806977571	PBKJOWPVORLKEU-UHFFFAOYSA-N	435.820	1.549	50	20	IDGD	
COc1ccc(CS(C)(=O)=O)cc1NC(=O)C(=O)NNc1ccc2ccccc2n1	806984887	ZCDLLOPSXJXTRB-UHFFFAOYSA-N	428.470	1.870	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)NCc2cc(C(F)(F)F)cc(S(C)(=O)=O)c2)n1	807221592	DSAUXFUVVMWGFU-UHFFFAOYSA-N	447.439	1.453	50	20	IDGD	
Cn1nc(-c2cc(F)cc(F)c2)cc1NC(=O)C(=O)NNc1ccc(-n2ccnc2)nn1	807428883	JFZFVSDFNCXVQE-UHFFFAOYSA-N	439.386	1.423	50	20	IDGD	
NC(=O)c1ccc(OCC(F)F)c(NC(=O)NNC(=O)c2cc(Br)c[nH]2)c1	810342675	ATAIQTFRIZSZJG-UHFFFAOYSA-N	446.208	1.987	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)[C@@H]1C[C@H]1C1CCN(C(=O)OC(C)(C)C)CC1	810943842	DRMNFPJYNWSWMR-LSDHHAIUSA-N	440.541	1.942	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)Nc1cccc(N2C(=O)N[C@](C)(C3CC3)C2=O)c1	812985938	KSINGFRBOLKUFP-MPBGBICISA-N	433.465	1.116	50	20	IDGD	
CCOC(=O)c1cc(COC)cc(NC(=O)C(=O)NNc2ccc(S(C)(=O)=O)cc2)c1	815585600	MMNMWSLTMTUDGY-UHFFFAOYSA-N	449.485	1.495	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)Cn2nnc3c2CCCC3)c2ccccc2c1=O	816828744	NTULEZDJSZFJHP-UHFFFAOYSA-N	437.504	1.518	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)NC[C@H](CO)Cc2cnn(C)c2)c(C)n1C[C@H]1CCCO1	819666444	RLFYCQVMEFFQRS-CPMWORGRSA-N	425.533	1.892	50	20	IDGD	
CCn1c(NNC(=O)CN2C(=O)N[C@@](C)(c3ccccc3)C2=O)nc2ccccc2c1=O	823892817	JPKQBWQNFJLKCC-QFIPXVFZSA-N	434.456	1.327	50	20	IDGD	
CS(=O)(=O)CC[C@@H](Cc1cccc(Br)c1)C(=O)N1CC[C@@H](B(O)O)C1	864234880	XUGOGIJTAPQHMK-UONOGXRCSA-N	432.145	1.118	50	20	IDGD	
CSC[C@@H](C(=O)NNC(=O)c1cccc(N(C)C)c1)N1C(=O)[C@H]2CCCC[C@H]2C1=O	904225084	SUTHOSAMEMXFDJ-BBWFWOEESA-N	432.546	1.420	50	20	IDGD	
COc1ccc([C@]2(C)NC(=O)N(NC(=O)/C(C#N)=C\c3cc(C#N)n(C)c3C)C2=O)cc1	906491536	JYXXNNBLSOLJLE-BQEXRTDESA-N	432.440	1.619	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)O[C@H](C)C(=O)N2CCC(C(N)=O)CC2)c1C	913026859	ARULAEZITAAACC-PUMYGXPMSA-N	430.505	1.314	50	20	IDGD	
Cc1nn([C@@H]2CCS(=O)(=O)C2)c2nc(C3CC3)cc(C(=O)NNC(=O)C3CCCC3)c12	914843740	WYWYSKVZBXDEAF-OAHLLOKOSA-N	445.545	1.928	50	20	IDGD	
O=C(NNC(=O)C1CCCC1)c1cc(S(=O)(=O)NC2CC2)ccc1Br	914848838	CSFVVXJQXYKCIH-UHFFFAOYSA-N	430.324	1.841	50	20	IDGD	
COc1ccnc(NNC(=O)[C@H](CCSC)NS(=O)(=O)c2ccccc2F)n1	914861595	ZQKSJZBJSVVETF-LBPRGKRZSA-N	429.499	1.168	50	20	IDGD	
CSC[C@H](C(=O)NNC(=O)Cc1c[nH]c2ccccc12)N1C(=O)[C@H]2CCCC[C@H]2C1=O	915787684	OEIMQFQBOOIGSY-SOLBZPMBSA-N	442.541	1.765	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NC[C@H](c2ccco2)N2CCCC2)nc1	915896189	DFZKIGVBXOHPEY-MRXNPFEDSA-N	436.538	1.825	50	20	IDGD	
CO[C@@H](CNC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)c1ccccc1	916271644	WSMDKQQKTAOSCT-SFHVURJKSA-N	448.549	1.032	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)NCc2ccc(CN3CCN(C)CC3)cc2)c1	916387423	BCEGNMYOWMDSGK-UHFFFAOYSA-N	439.560	1.960	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H](C)CN2CCCCC2)c1	916461752	JEWXOHDLTSKZEE-MRXNPFEDSA-N	439.582	1.536	50	20	IDGD	
O=C(CS(=O)(=O)Cc1ccc(Br)cc1)NNC(=O)c1ccc(Cl)nc1	917252643	SAEQZSSJVLSXAP-UHFFFAOYSA-N	446.710	1.874	50	20	IDGD	
CCOC(=O)c1c(S(=O)(=O)NNC(=O)c2ccc(OC(C)C)c(OC)c2)n[nH]c1C	917728292	VIWRMHJMBYMIPD-UHFFFAOYSA-N	440.478	1.314	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(C(=O)NNC(=O)NCC(F)(F)F)ccc1Br	918707240	KIWRXDAWDKOLAF-UHFFFAOYSA-N	447.233	1.206	50	20	IDGD	
O=C(NC[C@@H]1Cc2ccccc21)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	919658002	IJDDASNSMXKCCL-KRWDZBQOSA-N	428.514	1.755	50	20	IDGD	
CCCn1c(CCC(=O)NNC(=O)NC)nc2cc(S(=O)(=O)N(CC)CC)ccc21	919877863	DKWNKJIIUBSWRC-UHFFFAOYSA-N	438.554	1.370	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CNS(=O)(=O)c2ccc(Br)cc2)cc1	1317696238	AZBJKHPXHNJRBW-UHFFFAOYSA-N	442.291	1.197	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)[C@H]1COc2ccc(F)cc2C1	1323092458	LODUVALRYRFYFR-GOSISDBHSA-N	426.492	1.737	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C1CCCC1)C2	1778091150	IFIPFWFBXYXMGX-LVGVVDSRSA-N	443.548	1.825	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(CCN(C(=O)COc3cc(Cl)ccn3)C2)C1	1779229003	HYGYYEILHAJDQE-KRWDZBQOSA-N	446.729	1.729	50	20	IDGD	
CC(C)NC(=O)OC(C)(C)C(=O)N1CCO[C@@]2(CCN(C(=O)CO[Si](C)(C)C)C2)C1	1779300064	MGJMYIKHDNBAHP-HXUWFJFHSA-N	443.617	1.581	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Br)C2)c1ccncc1O	1779623082	VHVDSTWITNUHRU-CKEIUWERSA-N	430.274	1.605	50	20	IDGD	
COc1ccnc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)c1OC	1780452699	KNVIQEZKAIHJEI-MOPGFXCFSA-N	446.331	1.779	50	20	IDGD	
CN(C)c1cccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)c1	1780643936	RENCJTNCCCWSEX-MAUKXSAKSA-N	428.302	1.887	50	20	IDGD	
N#Cc1c[nH]c(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](F)Br)C2)c1	1780773329	AEDJYHFJIZZXTN-CKEIUWERSA-N	427.274	1.704	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H]3CC[C@@H]4CCC(=O)N4C3)C2)C1	1781050314	HUZPPFRARWWHGI-ZOCZFRKYSA-N	425.957	1.482	50	20	IDGD	
Cc1c(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)nc2ccccn12	1781330482	YAFRKOAMXJIQRW-CRAIPNDOSA-N	439.285	1.777	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCc1ccc(F)nc1)C2	1782172088	OAMPSMAAHXFWHX-CSODHUTKSA-N	441.931	1.921	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cncn3-c3ccncc3)CCO2)C1	1783533219	XKIFWNTWFBROHC-KUHUBIRLSA-N	448.321	1.494	50	20	IDGD	
CC(C)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3ON=C(c4ccccc4)O3)C[C@@H]21	1783852213	UQDLYVAHUBNCGG-OGNFBWPZSA-N	449.935	1.966	50	20	IDGD	
CS(=O)(=O)c1ccc(CC(=O)N2CCO[C@@]3(CCN(C(=O)C(Cl)Cl)C3)C2)cc1	1783947291	RLHSYDSKVTUWAX-SFHVURJKSA-N	449.356	1.266	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=N/O[C@H]3CCCCO3)C[C@@H]21	1786406457	UAIUQXVYRZDVBS-PEDMVSAGSA-N	446.342	1.280	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCBr)[C@H]2C1	1786407738	QCTFGHHBSUYESX-BJDJZHNGSA-N	426.149	1.535	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)n3cccc3C=O)[C@H]2C1	1786995917	ZGEHNCNUFXQVQV-KSIDHJATSA-N	425.913	1.095	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)c1cc[nH]c2nccc1-2	1787328388	QDCVAGQSKNOXQQ-FBUXBERBSA-N	439.285	1.798	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnn4ccc(C)cc34)[C@H]2C1	1787373600	FESULIBGIVIPHD-RMRDIRSESA-N	434.924	1.490	50	20	IDGD	
Cc1nccn1[C@H](C)C(=O)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1	1788145057	BQIBKURZJGZKOU-MRXNPFEDSA-N	446.316	1.880	50	20	IDGD	
COc1nc(C)ccc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]2C1	1788764158	BKOMUMQDEHQREW-SZMVWBNQSA-N	435.597	1.843	50	20	IDGD	
O=C(/C=N/N1CCCCC1)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1	1789514979	WIDDTYUVOBXTFD-YZSQISJMSA-N	448.332	1.586	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnn(C(C)(C)C)c3)C[C@@H]21	1791252327	HACSIXRYLZJDOR-LLLHUVSDSA-N	426.945	1.485	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc4c3OCCO4)C[C@@H]21	1791253498	BWEIRSXOLALHGA-SCNOPHJPSA-N	438.908	1.305	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cncc4cnccc34)C[C@@H]21	1791255711	ZGDYOHWEXZSWOH-YFYLHZKVSA-N	432.908	1.477	50	20	IDGD	
Cc1ccc(F)cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2C1	1791287166	RHUUWBPKAHUMQH-SNRMKQJTSA-N	434.512	1.100	50	20	IDGD	
O=C(/C=C/C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]2C1)NCc1ccco1	1791298343	QUUFPHCUUCYNGK-BHZQXVQBSA-N	444.315	1.235	50	20	IDGD	
CC(C)Oc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](O)CCl)C[C@@H]32)cc1C#N	1792055995	SHHGGABMKLHIDL-CAIZAGQASA-N	449.935	1.538	50	20	IDGD	
COc1ccccc1OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@](C)(Cl)CCl)C2	1792721099	DZTSUTBDVXXBDF-ZZXMYQEDSA-N	445.343	1.900	50	20	IDGD	
COc1ncccc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)CBr	1792870456	PBBOUIWMEJHJDT-GUIRCDHDSA-N	426.311	1.324	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C[C@H]1COc2ccccc2O1	1793269138	JGSCTOSQOBAUSI-OYFMXXACSA-N	438.908	1.060	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ncn(-c3ccccc3)n1)C2	1793449692	JVNULVOXXIDXHJ-MVJTYMMSSA-N	431.924	1.878	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1n[nH]c2c1CCCC2	1796166164	FLYSHUAFXPNLCH-OHTBPHCPSA-N	425.327	1.275	50	20	IDGD	
CSc1ncccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1	1796188802	RQFRKISUSMFIKN-BJWYYQGGSA-N	425.319	1.049	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCc1c[nH]c2ccccc12)c1cccc(B(O)O)c1	1796270383	MDZWJRDNZLCIMQ-WKCHPHFGSA-N	445.328	1.732	50	20	IDGD	
CC1=NN(c2ccc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@H](F)Cl)cc2)C(=O)C1	1796367432	IPAJLLPWPUEYNI-DACLVMHWSA-N	436.871	1.537	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN1CCCCC1)C2	1796892020	AZNFZOGBWMPOBY-DPEPCVEMSA-N	428.537	1.245	50	20	IDGD	
COCc1oncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C(C)=N/NC(=O)c1ccc[nH]1	1796892489	HSACPQGPFNRMHN-JWBKOJIWSA-N	442.476	1.207	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccncc1F	1797219746	UBEWQUBMHREHTG-SSJPOKSSSA-N	426.452	1.607	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2)c1cc(F)cnc1Cl	1798044216	XJDOFKKSLFNWKB-WDAIWFPHSA-N	434.693	1.862	50	20	IDGD	
C[C@@H](Nc1ccccc1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnccc1C(=O)NN	1798440554	QABUQYYLWBCVBJ-NRSFXHEJSA-N	436.516	1.438	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1c(-c2ccncn2)noc1C	1798488848	DDWWJDIOHCHYDB-LOUJCGABSA-N	433.896	1.661	50	20	IDGD	
CCOc1cccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Br)C3)c1	1799017028	NZHPRPUKFZJDDV-XRGAULLZSA-N	429.286	1.979	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1c2c(nn1C)CCC2	1800045139	ZDNIOBKFMRETHO-NFFDBFGFSA-N	439.354	1.143	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCCn1ccnc1)C2	1800644050	FZCCSGWFQNBLKN-IVSAIRAKSA-N	427.343	1.426	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Sc1ccccn1)C2	1800763126	PCQYIRBXPVAJSM-AQDIXCGQSA-N	442.379	1.935	50	20	IDGD	
C[C@@H](Cc1ccccn1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2	1801226956	XFUKTOVLBDFWKL-IGNRKKQASA-N	428.302	1.540	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc3c(c1)n(C)c(=O)n3C)C2	1802274372	WQSZMSQSGFOLKD-QKPAOTATSA-N	434.924	1.383	50	20	IDGD	
COc1c(C)cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CCC(=O)NN(C)C)cc1C	1802337865	CKVIHWZJHZMQDI-REPLKXPHSA-N	430.549	1.937	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)Cc2cccc([N+](=O)[O-])c2)[C@H]1c1cccnc1)[C@@H](O)CCl	1803137857	UGZQICCCTUTDPP-QRFRQXIXSA-N	446.891	1.838	50	20	IDGD	
CC(=O)N[C@H](C(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)C(C)(C)C	1803377696	JTKKUSRDCIERAU-BSDSXHPESA-N	438.956	1.238	50	20	IDGD	
CC(=O)C(C)(C)C(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1803405167	CRFLATARLIBISU-YLJYHZDGSA-N	431.537	1.076	50	20	IDGD	
COc1cccc(Cl)c1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCC(=O)NN(C)C)C2	1803751893	PVNAQXPFQPACKA-QDMKHBRRSA-N	436.940	1.973	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2sccc2F)[C@@H]1c1cccnc1	1803858776	XPFQUXHCFLCSNH-BEFAXECRSA-N	447.536	1.975	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1cc(F)ccc1F)c1cccc(B(O)O)c1	1804098392	BZEOBSKMLOWOBU-REPLKXPHSA-N	428.244	1.139	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)c3cccnc3S)CC2)C1	1809968261	UKXPGSFYKRJFCI-UHFFFAOYSA-N	439.346	1.209	50	20	IDGD	
CN(C)c1ccc(C(=O)N2CCC3(CCCN(C(=O)c4ccc(B(O)O)cc4)C3)CC2)cc1	1809970026	ZBEXCSJSBDULID-UHFFFAOYSA-N	449.360	1.591	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC2(CCCN(C(=O)c3ccc4c(n3)OCCO4)C2)CC1	1810762107	ANTOLUYIKJCXCN-OAHLLOKOSA-N	437.924	1.951	50	20	IDGD	
Cn1ncc(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)c1Cl	1811165395	RSQLZFDMJADUPT-AEGPPILISA-N	426.304	1.388	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)c1cncc2cnccc12	1811295758	TYFARWKHEOCIBP-YSSFQJQWSA-N	439.903	1.944	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)CC(=O)NC)[C@H]1c1cccnc1	1812773558	HCINBMCFWIXQAB-ZQIUZPCESA-N	425.327	1.397	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)CN2CCCCC2=O)[C@H]1c1cccnc1	1812976011	APVGYXTXFHKZRN-FUHIMQAGSA-N	436.940	1.354	50	20	IDGD	
CCOC(=O)C1(C(=O)N2CC[C@H](CNC(=O)[C@@H](Cl)COC)[C@@H]2c2cccnc2)CC1	1813034669	UMELTEVFCSVGBO-IKGGRYGDSA-N	437.924	1.685	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)[C@@H]2CCC=CO2)[C@@H]1c1cccnc1	1813074514	UCYZOAOZNHWQCT-BBTUJRGHSA-N	429.521	1.153	50	20	IDGD	
C[C@@H](C(=O)N1CC[C@@H](CNC(=O)C(Cl)Cl)[C@@H]1c1cccnc1)N1CCN(C)CC1	1813078804	KWRHHSJGFVUHKI-XIRDDKMYSA-N	442.391	1.527	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ncn(-c3ccccc3)n2)[nH]n1)[C@@H](O)CCl	1814871565	SFBMLBURDABGHV-HOTGVXAUSA-N	443.895	1.896	50	20	IDGD	
O=C1Nc2c(cccc2C(=O)N2CCCC[C@H]2c2cc(NC(=O)[C@H](O)CCl)n[nH]2)C1=O	1814872308	GWJGTASMOFAKGC-UONOGXRCSA-N	445.863	1.450	50	20	IDGD	
O=C1Nc2c(cccc2C(=O)N2CCCC[C@@H]2c2cc(NC(=O)[C@H](O)CCl)n[nH]2)C1=O	1814872311	GWJGTASMOFAKGC-ZIAGYGMSSA-N	445.863	1.450	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccn(C(F)F)c2=O)[nH]n1)[C@H](O)CCl	1814873365	QCIMCSJCJFSOKJ-QWHCGFSZSA-N	443.838	1.872	50	20	IDGD	
Cc1ccc(C(=O)N[C@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)cn1	1815339393	CQFVFNCKGADXKQ-INIZCTEOSA-N	436.302	1.066	50	20	IDGD	
O=C(CCc1ccco1)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1	1815350055	FLCDQFMTQIJOJB-HNNXBMFYSA-N	439.302	1.275	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](N)CN)sc2C1	1817075046	RNPIWFMBLYTVGJ-SBAYRHLTSA-N	446.483	1.226	50	20	IDGD	
Cc1nnc(CC(=O)Nc2cc([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)s1	1817576431	GCXVOIQCRYGIOX-AWEZNQCLSA-N	448.553	1.177	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ncon2)[nH]n1	1818112909	VACWNQWSLOVOMW-BMYBCIMUSA-N	439.436	1.233	50	20	IDGD	
Cc1nc2ncccn2c1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](O)CCl)CC2	1818389248	QVPNCGVLMHOYDF-CMPLNLGQSA-N	434.909	1.320	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)Cn2ccccc2=O)[nH]n1)[C@@H](F)Br	1820932912	VDDWYPJWEJCYSI-MLGOLLRUSA-N	440.273	1.954	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](F)Br)CC2)c1ccnnc1O	1821102319	TWJCFGBAPOBFDP-WKEGUHRASA-N	430.259	1.555	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2c(F)cncc2F)[nH]n1	1822414407	FABNHVKINTUHPK-OAHLLOKOSA-N	449.462	1.762	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)C[C@H]2NC(=O)NC2=O)CC1	1824011675	ZKPSVXGLZRLWGR-CABCVRRESA-N	426.945	1.469	50	20	IDGD	
COCCOCCOCCC(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H](O)CCl)CC1	1824185614	JRRXLTKQYDRRAZ-RBUKOAKNSA-N	448.988	1.276	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)Cc2cnccn2)CC1	1824311297	XRAOEAUJQVXLJR-IBGZPJMESA-N	430.553	1.012	50	20	IDGD	
C[C@@H](C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCBr)CC2)n1ccnn1	1824683190	MZZDOYHDMOWVKT-UWVGGRQHSA-N	427.328	1.693	50	20	IDGD	
C=CCNC(=O)/C=C\C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](C)Br)sc2C1	1825631704	KPYBPBHCUJUMIW-QIAMSNJGSA-N	441.351	1.697	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](O)CCl)CC2	1825958921	OKVIHSWMBKKDRL-CIQGVGRVSA-N	441.937	1.410	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](C)n3cnnn3)sc2C1	1826984457	GCZCNLSKMAYLHI-AEJSXWLSSA-N	442.343	1.476	50	20	IDGD	
Cn1cc(F)cc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1	1827943150	AHVRXNWJBCHROM-FQEVSTJZSA-N	441.312	1.391	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)Cc3cc(C)n(C)n3)CC2)CC1	1833370099	WGWVQBABKFVHCC-LJQANCHMSA-N	439.988	1.096	50	20	IDGD	
COCC1(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](C)Br)CC3)CC2)CC1	1833463153	LOFKCLDBVQCIQF-CQSZACIVSA-N	430.387	1.768	50	20	IDGD	
CCc1nn(C)c(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](Cl)CC)C3)C2)c1Cl	1833595926	KOHFOOIYEGMLNC-DJJJIMSYSA-N	447.363	1.723	50	20	IDGD	
CC(C)(C)n1cc(C(=O)NC2CCN(C3CCN(C(=O)[C@H](O)CCl)CC3)CC2)cn1	1833955778	RISPKZOJYLSNAA-GOSISDBHSA-N	439.988	1.423	50	20	IDGD	
CCc1oncc1C(=O)NC1CCN(C2CCN(C(=O)[C@H](Cl)COC)CC2)CC1	1834313581	LPRHSGGWDLMYSO-QGZVFWFLSA-N	426.945	1.676	50	20	IDGD	
O=C(CS[C@@H]1CCCCO1)NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1835757076	NMLONGMTOBAICM-IEBWSBKVSA-N	448.029	1.418	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)c1ccc(Cl)cn1	1835900200	GNVCHEUAHXJSPS-KRWDZBQOSA-N	429.348	1.520	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1)c1ccc(O)nc1	1836143797	GPBJVPSWWWISNB-MRXNPFEDSA-N	443.317	1.663	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(CC(C)C)nn3C)CCO2)C1	1836338213	PSNMIWRFKHULFZ-UTKZUKDTSA-N	440.972	1.706	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC1CCN(C2CCN(C(=O)c3cc(O)n[nH]3)CC2)CC1	1836398477	KWGXYZSFNRPBOF-GOSISDBHSA-N	432.352	1.537	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cn4ccsc4n3)CCO2)C1	1837045506	YUVAYYZYYNOELR-KUHUBIRLSA-N	440.953	1.873	50	20	IDGD	
CC(C)O[C@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)CBr)C2)C1	1837592555	WBPZIZYPQXLNIF-DAYGRLMNSA-N	435.359	1.287	50	20	IDGD	
Cc1cccnc1CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)CO[Si](C)(C)C)CCO2	1837710249	QTJXXWSQOYCHJU-JOCHJYFZSA-N	449.624	1.631	50	20	IDGD	
Cc1ncccc1CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)CO[Si](C)(C)C)CCO2	1837710286	SQDXVFNTCCEWJG-QFIPXVFZSA-N	449.624	1.631	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cccs3)C2)C1	1837711883	VJPTYNQPSLLDNC-IBGZPJMESA-N	426.611	1.599	50	20	IDGD	
Cc1noc(C)c1C(=O)N1CCOC[C@@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1837712221	KAGUSBFOPRLOMV-LJQANCHMSA-N	425.558	1.213	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(Cl)ccn3)CCO2)C1	1837867294	MODPYHALGCVXML-YVEFUNNKSA-N	446.729	1.588	50	20	IDGD	
Cc1ocnc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)CBr)C2)C1	1838199631	LUQQQQLQTZLNEM-SJKOYZFVSA-N	430.299	1.084	50	20	IDGD	
O=C(/C=C/c1ccccc1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839198826	CDZAVIBCMIBRPK-WAQVGJNASA-N	441.297	1.847	50	20	IDGD	
O=C(Cc1ccccc1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839199898	ZARVQMXXJNSNIE-AEFFLSMTSA-N	429.286	1.376	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(O)cc3F)CCO2)C1	1839314951	MFZQDKJMOIBETC-HXUWFJFHSA-N	428.888	1.866	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(C)no3)C2)C1	1839963848	YGKMJNKYVSPYGR-SUMWQHHRSA-N	430.299	1.227	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCNC(C)C)C2)C1	1839963930	AMHIOCNYPKXPHZ-MAUKXSAKSA-N	434.375	1.004	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(F)s3)C2)C1	1840031491	RRGXMZVKTCPHHV-MEDUHNTESA-N	435.315	1.741	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C=C/C3CCCCC3)C2)C1	1840154890	JFFVSBLFOAHSGV-SSPLKJMRSA-N	428.957	1.833	50	20	IDGD	
Cc1cc(CCC(=O)N2CCOC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)ccn1	1840186619	LPUVWKFDEZAXTJ-IBGZPJMESA-N	430.332	1.583	50	20	IDGD	
Cc1ccc(CCC(=O)N2CCOC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)nc1	1840186681	SEDMTSNOTOEWHM-IBGZPJMESA-N	430.332	1.583	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CC[C@H](O)CC1)CCO2	1840270708	BYYVEAUCLLZRGR-RGCFKVTRSA-N	437.364	1.230	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)c2ccnnc2)C1	1842399323	WLTZBGZMXYJLJC-UHFFFAOYSA-N	425.401	1.441	50	20	IDGD	
O=C(c1cc(-c2cccs2)on1)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843011538	NVQSRKOZVDVPJU-UHFFFAOYSA-N	437.286	1.214	50	20	IDGD	
CS(=O)(=O)Cc1ccc(C(=O)N2CCCC23CN(C(=O)CCBr)C3)cn1	1843215791	JYHOHTCEEKSAGQ-UHFFFAOYSA-N	444.351	1.228	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2cccc3cnccc23)C1	1844093240	UVSFQWZWQVTSRN-UHFFFAOYSA-N	430.468	1.364	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCCC12CN(C(=O)c1cccnc1CS(C)(=O)=O)C2	1844377566	SSNASUPXYXWALK-UHFFFAOYSA-N	439.610	1.295	50	20	IDGD	
Cc1onc(-c2ccccc2)c1C(=O)N1CC2(CCCN2C(=O)CCC(=O)NN(C)C)C1	1846384487	YTUZWJLBHUZWCS-UHFFFAOYSA-N	439.516	1.840	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@](C)(C(=O)N2CCCC23CN(C(=O)[C@@H](O)CCl)C3)C1	1847015930	ABGTVLOJUFYTNC-MGPUTAFESA-N	443.972	1.827	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H]1C[C@H]1c1ccc(F)c(F)c1	1847608206	VGYWJMIGAAOYBP-USNOLKROSA-N	440.255	1.264	50	20	IDGD	
COc1ccc(CC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)CCC(=O)NN(C)C)c(Cl)c1	1848088328	MGJNYLKFLNAEAA-ROUUACIJSA-N	436.940	1.466	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CN2CCCN(S(=O)(=O)c3ccc(F)cc3)CC2)cc1	15102238	LGCRDFLOLCZPQY-UHFFFAOYSA-N	448.520	1.292	50	20	IDGD	
CC(=O)c1c[nH]c(C(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)c1	17633743	AIZJCODZAANKPW-UHFFFAOYSA-N	429.440	1.994	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)CSc2nc3ccccc3o2)cc1OC	22204574	GPVXXAVWNGFCIJ-UHFFFAOYSA-N	445.453	1.942	50	20	IDGD	
COc1cc(C(=O)NNC(=O)COc2ccc(N3CCCC3=O)cc2)cc(OC)c1OC	26687689	WXRWYSDXSHGOBF-UHFFFAOYSA-N	443.456	1.679	50	20	IDGD	
O=C(NNC(=O)[C@H]1CC(=O)N(c2ccc3c(c2)OCCO3)C1)c1cc(-c2ccccc2)on1	27259909	BJSVRGPTAHRPHO-HNNXBMFYSA-N	448.435	1.927	50	20	IDGD	
CC(=O)N[C@@H](C)C(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2Cl)c1	28619899	VFJZSWGTTMASDH-NSHDSACASA-N	438.893	1.426	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2cc(C(N)=O)n(C)c2)ccc1OCCC(C)C	105833207	BXWAEKOGFBQFHY-UHFFFAOYSA-N	438.506	1.181	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)c1cc(S(=O)(=O)N2CCCC2)c(C)o1	107910380	HSYMNEZAZSNWDG-UHFFFAOYSA-N	435.502	1.775	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)N2CCN(C[C@H]3CCCO3)CC2)N(C)c2ccccc21	109110387	NNOINEZGNWYDML-GOSISDBHSA-N	437.544	1.980	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)c1oc2ccccc2c1CS(C)(=O)=O	726618945	FSGZGXXUATYFQI-UHFFFAOYSA-N	431.470	1.859	50	20	IDGD	
CC(=O)Nc1nc(C)c(S(=O)(=O)NNC(=O)c2ccc(Br)s2)s1	727352433	XJXUYUNZAHRCSB-UHFFFAOYSA-N	439.338	1.857	50	20	IDGD	
C[C@@H](Oc1ccc(C#N)cc1)C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	728213000	QFJHEXFHWHVZIW-MRXNPFEDSA-N	443.529	1.405	50	20	IDGD	
CC(C)C[C@H](/N=C1/NS(=O)(=O)c2ccccc21)C(=O)NNC(=O)c1cccc(C#N)c1	728872869	REINVWCWPXAKMS-KRWDZBQOSA-N	439.497	1.473	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1	728960095	UIVIFQIDWRUYLC-UHFFFAOYSA-N	447.883	1.030	50	20	IDGD	
CCN(C)C(=O)c1cccc(C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)c1	729300725	SKUKWCNEHALLHF-UHFFFAOYSA-N	431.518	1.455	50	20	IDGD	
Cn1nc(SCC(=O)NN=Cc2ccccc2OCc2ccccc2)c(=O)n(C)c1=O	730569107	NORQYRKGPBXBGW-UHFFFAOYSA-N	439.497	1.300	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)N2CCN(CC(=O)N[C@@H]3CCC[C@H](C)C3)CC2)cc(C#N)n1C	731198683	JOKWQPYMNZVOKA-YTORKTKBSA-N	436.560	1.951	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)c1nnn(-c2ccc3ncccc3c2)c1C	731341676	OSWXAEPPLFTWHO-UHFFFAOYSA-N	432.440	1.973	50	20	IDGD	
O=C(CCN1CCN(C(=O)[C@H]2CCCO2)CC1)NNC(=O)C12CC3CC(CC(C3)C1)C2	731960045	XHCWFMYZFPMMSC-GYVBGXKYSA-N	432.565	1.064	50	20	IDGD	
O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)NNC(=O)C1CCC1	732242590	NXDPZZOWQGDHSA-UHFFFAOYSA-N	427.484	1.573	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2c[nH]nc2-c2ccc3c(c2)OCCO3)C[C@@H](C)O1	732263984	QMNAEHSHJFBJIB-OKILXGFUSA-N	429.477	1.108	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)N[C@@H](Cc1ccccc1)CN1CCOCC1	732476334	FORYQXQHCLMZRB-FQEVSTJZSA-N	426.517	1.512	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2sc(-c3cnn(C)c3)nc2C)cc(OC)c1OC	734313634	XSQQYKPNGCDSAS-UHFFFAOYSA-N	431.474	1.953	50	20	IDGD	
O=C(NNC(=S)NC(C1CC1)C1CC1)c1cccc(S(=O)(=O)N2CCOCC2)c1	734754127	MQIQNPPJUMDBHW-UHFFFAOYSA-N	438.575	1.005	50	20	IDGD	
CC(=O)N1CCc2cc(C(=O)NNC(=O)NC3CCN(C(=O)OC(C)(C)C)CC3)ccc21	734824638	GRSYKXCTKFCAJD-UHFFFAOYSA-N	445.520	1.939	50	20	IDGD	
CCOCCCN1CCC(=NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)[C@@H](C)C1	735227663	FMJRVQCJZCGGQD-ZDUSSCGKSA-N	430.958	1.842	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)N[C@H]1CCN(CC2CC2)C1	739034889	KUCFUIKLCOEYSR-SFHVURJKSA-N	449.577	1.290	50	20	IDGD	
CS(=O)(=O)CC[C@H](Cc1cccc(Br)c1)C(=O)NNc1cccnn1	741286660	BXAKJILPFGLDDN-CYBMUJFWSA-N	427.324	1.976	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)N[C@H](CNC(=O)OC(C)(C)C)C2CC2)c2ccccc2c1=O	741436717	VUMNEUMMNDPCSI-OAHLLOKOSA-N	444.492	1.181	50	20	IDGD	
O=C(Cn1c(=O)ccn(Cc2ccccc2)c1=O)NNC(=O)c1cccc2ccccc12	741573728	GNMRPBLTODZEHR-UHFFFAOYSA-N	428.448	1.673	50	20	IDGD	
CS(=O)(=O)c1cc(C(=O)NNC(=O)C(F)(F)Oc2ccccc2)cc([N+](=O)[O-])c1	741595840	FSWKMUDSNJFVMO-UHFFFAOYSA-N	429.357	1.431	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H]2CCN(c3cccc(Cl)c3)C2=O)c1	742046584	WDFQETIPLZVJJO-MRXNPFEDSA-N	435.889	1.558	50	20	IDGD	
O=C(NCc1nnnn1C1CC1)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1	743574758	XNTANHOGDGJKLB-HXUWFJFHSA-N	446.515	1.466	50	20	IDGD	
Cc1cc(NC(=O)CSCC(=O)NNC(=O)c2cc(Br)ccc2O)no1	743730203	RRIRTBFDSLWDHW-UHFFFAOYSA-N	443.279	1.584	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccccc1)NNC(=O)Nc1ccc(OC(F)F)cc1	743831978	BNUFRZRBFOLDJC-UHFFFAOYSA-N	428.417	1.809	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)N[C@H]2C[C@@H](C)N(c3cnn(C)c3)C2=O)c(C)n1-c1ccccc1	745916662	FGSQYHCZKFQPGN-QRWLVFNGSA-N	449.515	1.966	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)N[C@H]2CCN(c3sccc3C(=O)OC)C2=O)cc1	746781745	UQPVEFIXPMPPSD-HNNXBMFYSA-N	430.486	1.847	50	20	IDGD	
C[C@]1(NNC(=O)NCc2cn(-c3ccccc3)nc2-c2ccncc2)CCS(=O)(=O)C1	747309926	VXZMJGRNWHJBRK-NRFANRHFSA-N	440.529	1.815	50	20	IDGD	
CCCCS(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)c2ccc(Cl)nc2)cc1	747605697	JASOFIWIWIMXSP-UHFFFAOYSA-N	446.938	1.900	50	20	IDGD	
CC[C@@](C)(CNC(=O)OC(C)(C)C)C(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	747727219	JVJABYDIQLWGPE-NRFANRHFSA-N	431.493	1.636	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1Cl	748640162	SXSCWVFGTICEIT-INIZCTEOSA-N	425.850	1.448	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)N[C@@H]2CCN(c3cc(OC)cc(OC)c3)C2)c1	748661625	MHRTZPJJMRPOKJ-OAHLLOKOSA-N	444.488	1.944	50	20	IDGD	
COCCCNC(=O)NNC(=O)[C@H]1CCCN1C(=O)c1ccc(Br)cc1	749585608	NRDLVXLNZNNBHH-CQSZACIVSA-N	427.299	1.421	50	20	IDGD	
O=C(NN=Cc1cc(F)c(O)c(F)c1)c1cccc(S(=O)(=O)N2CCOCC2)c1	749853190	DUBXGCPQRHVHCB-UHFFFAOYSA-N	425.413	1.455	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)NCCNS(=O)(=O)Cc2ccon2)c(Cl)c1	750289606	VCHDGHMFYYTBNQ-UHFFFAOYSA-N	430.874	1.092	50	20	IDGD	
O=C(COCCNC(=O)c1ccccc1)NNc1ccc(S(=O)(=O)NC2CC2)cc1	751891497	FSVWVZKZKGIDIH-UHFFFAOYSA-N	432.502	1.017	50	20	IDGD	
C[C@@H]1CN(S(=O)(=O)c2ccc(NC(=O)NNC(=O)c3ccccn3)cc2)C[C@@H](C)O1	755424477	UQZKRVPPBPWZQX-ZIAGYGMSSA-N	433.490	1.346	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)Nc1cccc(S(=O)(=O)N2CCCN(C)CC2)c1	756358019	HFWAVCHBLSIMLD-UHFFFAOYSA-N	445.545	1.788	50	20	IDGD	
CS(=O)(=O)NCc1ccc(NC(=O)NNC(=O)c2cccc(OC(F)F)c2)cc1	756631074	YSIZAZZHXBZSJJ-UHFFFAOYSA-N	428.417	1.804	50	20	IDGD	
COC(=O)CCCc1nnc(NC(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)s1	756683224	GSOSCPSCRHLXJT-SNVBAGLBSA-N	425.442	1.793	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1ccc(C(=O)NC2CC2)cc1	756867570	PLJZBAZIXHGZSS-UHFFFAOYSA-N	429.502	1.255	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNS(=O)(=O)c1cc(F)c(Br)cc1F	756935526	FDRLGCFZNMWLPF-UHFFFAOYSA-N	438.206	1.060	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)NCc2cc3c(cc2OC(F)F)OCO3)nc2ccccc21	757253497	ZTRQTEYTNADBNA-UHFFFAOYSA-N	447.398	1.977	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)C2(CNC(=O)OC(C)(C)C)CCCC2)C[C@@H](C)O1	757371206	MTIZBGJFPXLREO-IYBDPMFKSA-N	426.558	1.718	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)N[C@H]1CCc2c[nH]nc2C1	758905344	DVHMESJHESMOEA-INIZCTEOSA-N	446.533	1.086	50	20	IDGD	
C[C@H](O)C[C@@H](CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)c1ccccc1	759608864	FHZDEZGZPYIVSQ-YJBOKZPZSA-N	448.545	1.436	50	20	IDGD	
COC(=O)c1cn([C@@H]2CCN(C(=O)NNC(=O)c3cc4c(s3)CC[C@@H](C)C4)C2)nn1	760656130	LQJKDQZJNRIEJQ-DGCLKSJQSA-N	432.506	1.552	50	20	IDGD	
O=C(NCCC[C@@H]1CCCCO1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	761037026	KRQQJCUOHCOMFP-KRWDZBQOSA-N	438.550	1.764	50	20	IDGD	
CS(=O)(=O)CCOc1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)c1ccccc1	763430887	OWWPJOIRJVBBMC-UHFFFAOYSA-N	439.877	1.163	50	20	IDGD	
O=C(NNC(=O)c1ccncc1)C(=O)Nc1ccc(F)cc1I	763463213	BFXWCWDNAVLRSH-UHFFFAOYSA-N	428.161	1.225	50	20	IDGD	
CC(C)(C)OC(=O)N1CCc2c(cccc2NC(=O)C(=O)NNC(=O)c2cccnc2)C1	763490984	JFQWXCGPZYHRPW-UHFFFAOYSA-N	439.472	1.775	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)Nc1cccc(Oc2cnccn2)c1	763578954	RVWXLXSXWPHDGO-QGZVFWFLSA-N	435.396	1.195	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccn([C@@H](C)c2ccccc2)n1	763647123	NRCLAQQUEJWWHQ-HNNXBMFYSA-N	437.456	1.666	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)c(C(F)(F)F)c1	763677994	AUXFCBOZLVGVKD-UHFFFAOYSA-N	436.346	1.751	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNC(=O)CSc2ccc(Cl)cc2)cn1C	763732423	CKMLCMWISQXCTJ-UHFFFAOYSA-N	438.893	1.733	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)CC23CC4CC(CC(C4)C2)C3)cn1	763735249	MDRGILIAHSSQPN-UHFFFAOYSA-N	434.518	1.178	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)C(=O)Nc2ccc(N3CCCCC3)cc2)c2ccccc2c1=O	763791712	XYCSJZPKGOGZRI-UHFFFAOYSA-N	448.483	1.324	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCCCCC2)cc1NC(=O)C(=O)NNC(=O)C(C)C	763817047	XIIGGROSMDGIDH-UHFFFAOYSA-N	440.522	1.002	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1cccc(NC(=O)C2CC2)c1	763848999	GVFYWCFOICGEED-GFCCVEGCSA-N	428.420	1.728	50	20	IDGD	
Cc1cccc(Cn2nccc2NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)c1	763858461	SJUPHPPOGRRVOT-OAHLLOKOSA-N	439.447	1.932	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccccc2C[S@@](C)=O)ccc1OC(C)C	763922177	TXKYNJUXPLTJHO-WJOKGBTCSA-N	447.513	1.761	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc(C)c(S(=O)(=O)NC2CC2)c1	763961060	YACKLMWZPWYADC-UHFFFAOYSA-N	430.486	1.144	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)C(=O)Nc1ccc(N2CCOCC2)cc1C(F)(F)F	763996192	MYZXBQUMDGJZKO-UHFFFAOYSA-N	439.394	1.280	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1ccc2c(cnn2C(F)F)c1	764004143	LDIDPNVZKOCOFQ-UHFFFAOYSA-N	431.355	1.602	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1ccc(OC(F)F)c(F)c1	764006347	PGKWMNRPURPVCE-UHFFFAOYSA-N	425.319	1.598	50	20	IDGD	
CC[C@@H](C)C(=O)NNC(=O)C(=O)Nc1cnn(C2CCN(C(=O)OC(C)(C)C)CC2)c1	764085435	QIJCKYMDTWUQRL-CYBMUJFWSA-N	436.513	1.587	50	20	IDGD	
Cc1cc(N2CCSCC2)ccc1NC(=O)C(=O)NNC(=O)[C@@H]1Cc2ccccc2O1	764167428	JWZNJDLNXGHGFY-IBGZPJMESA-N	440.525	1.638	50	20	IDGD	
Cn1ccnc1C(=O)c1ccc(NC(=O)C(=O)NNC(=O)CCCc2ccccc2)cc1	764226940	UXAJYMDGXRIGIS-UHFFFAOYSA-N	433.468	1.760	50	20	IDGD	
O=C(NNC(=O)c1cccc(OC(F)F)c1)C(=O)Nc1ccc(N2CCOC2=O)cc1	764259518	JWUOJGRHOWUWRH-UHFFFAOYSA-N	434.355	1.644	50	20	IDGD	
CCOC(=O)c1cc(CC)sc1NC(=O)C(=O)NNC(=O)COc1ccccc1O	764277594	KLVNDPHPDHHEHS-UHFFFAOYSA-N	435.458	1.358	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2F)c(OC)c1OC	764412576	IMRNYTRPJRBXBD-UHFFFAOYSA-N	425.800	1.905	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1cccc(C#N)c1)C(=O)NNC(=O)c1cccc(OC(F)F)c1	765406550	QZDYNKYMFGBQFS-LLVKDONJSA-N	438.412	1.288	50	20	IDGD	
Cn1c(NNC(=O)CCC(=O)N2CCN(c3ccccc3)CC2)nc2ccccc2c1=O	765538945	LJPWHZPESWNZJO-UHFFFAOYSA-N	434.500	1.506	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)[C@@H]1C[C@]12CCCc1ccccc12	765738809	OMKOZKXVNSFSIX-NVQXNPDNSA-N	446.551	1.886	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)N1CCNC(=O)[C@H]1c1ccccc1Br	767731924	KOCNMCUQRFNTNB-BLLLJJGKSA-N	425.327	1.504	50	20	IDGD	
COC(=O)[C@@H](NCC(=O)NNC(=O)c1ccc(OC)c(OC)c1)c1ccc(F)c(C)c1	767885761	UWLAPJNCDYYBQF-IBGZPJMESA-N	433.436	1.416	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)c2ncccc12	768229512	CHNVUXIYLKEDJK-UHFFFAOYSA-N	433.424	1.670	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)C(=O)Nc2ccc(F)cc2C(=O)N(C)C)cc1	768237005	JBBKHBOCUDNYOL-UHFFFAOYSA-N	432.477	1.714	50	20	IDGD	
CC(C)(C)C(=O)NNC(=O)CSc1nnc(-c2cc(-c3ccc(Cl)cc3)[nH]n2)n1N	768441075	RYJZRVUNONLXPM-UHFFFAOYSA-N	448.940	1.988	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)C[C@@H]3CCC[C@H]3C)CC2)cc1	769008837	XLOLZQYCNCOROB-MSOLQXFVSA-N	436.578	1.275	50	20	IDGD	
O=C(COc1ccccc1Cc1ccccc1)NNC(=O)NCCn1cc([N+](=O)[O-])cn1	769226182	QRTJEDZLSXUGRZ-UHFFFAOYSA-N	438.444	1.792	50	20	IDGD	
CCN1CCN(c2cccc(NC(=O)C(=O)NNC(=O)COc3ccccc3F)c2)CC1	770773871	LHNVBOCWLHSIHN-UHFFFAOYSA-N	443.479	1.133	50	20	IDGD	
Cc1cc(NC(=O)[C@H](C)SCC(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)no1	770966022	JFGMNMLPDFWZHI-JTQLQIEISA-N	448.509	1.787	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)c1ccc(F)c(S(=O)(=O)NC(C)(C)C)c1	771992058	HNAPRXPAOLTWBA-LBPRGKRZSA-N	445.513	1.641	50	20	IDGD	
C[C@H](NC(=O)OCc1ccccc1)C(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772187785	FDLPBDGDZAKPNM-ZDUSSCGKSA-N	432.864	1.419	50	20	IDGD	
CSc1cc(CNC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)ccn1	772604660	VVUSBUFGECNWNL-UHFFFAOYSA-N	449.558	1.732	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(NC(=O)[C@H]3CCCO3)cc2)cc1F	773890653	YIBIRLZRBJEGAF-QGZVFWFLSA-N	428.420	1.651	50	20	IDGD	
COc1cc(OC)c(Cn2nccc2NC(=O)NNC(=O)c2ccncc2)c(OC)c1	779481787	ACUPDLHLYHBYNC-UHFFFAOYSA-N	426.433	1.819	50	20	IDGD	
COc1cc(OC)c(Cn2nccc2NC(=O)NNC(=O)c2cnn(C)c2)c(OC)c1	779481872	FGGQYJNYHQQFRB-UHFFFAOYSA-N	429.437	1.157	50	20	IDGD	
O=C(NNc1ncnc2ccsc12)C(=O)Nc1cccc(S(=O)(=O)N2CCCC2)c1	783253533	IQJWOOKLABJKOF-UHFFFAOYSA-N	446.514	1.558	50	20	IDGD	
Cc1ccc(NNC(=O)C(=O)Nc2cccc(S(=O)(=O)NC3=NCCCCC3)c2)nc1	783484840	HLSBUVZRJLOIJG-UHFFFAOYSA-N	444.517	1.723	50	20	IDGD	
C[C@@H](CC#N)Sc1ccccc1NC(=O)C(=O)NNC(=O)CNC(=O)c1ccco1	784001686	BHZNMFYLXLZHKP-LBPRGKRZSA-N	429.458	1.190	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)[C@H]2CC=CC[C@@H]2C(=O)N2CCOCC2)cc1OC	784296206	LJPDMTXQCGYCDM-ROUUACIJSA-N	445.516	1.686	50	20	IDGD	
COc1ccc(/C=C(\C#N)C(=O)OCC(=O)N2CCc3cc(S(N)(=O)=O)ccc32)cc1	784444839	VMTQALKXGFPEHF-MHWRWJLKSA-N	441.465	1.382	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2ccc(-n3cncn3)c(Cl)c2)n1	785226167	RHXYMCMYSKEBNC-UHFFFAOYSA-N	429.872	1.639	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1ccc(S(=O)(=O)Nc2ccccc2C)cc1	785510640	UQAUOAGZVGXRRH-CQSZACIVSA-N	433.486	1.899	50	20	IDGD	
Cc1cnc(Cl)c(NC(=O)C(=O)NNC(=O)c2cc(Br)ccc2O)c1	787889416	NAMNSCGBRKMBQC-UHFFFAOYSA-N	427.642	1.911	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12)c1ncnn1C	788886729	QESKFLVMIPAUJY-AWEZNQCLSA-N	446.471	1.279	50	20	IDGD	
O=C(NNC(=O)C(=O)N1CCCC1)N[C@@H]1CCCN(c2ccc(Cl)cc2Cl)C1	788923886	STHYZNIIRWWLJB-CYBMUJFWSA-N	428.320	1.915	50	20	IDGD	
Cc1cc(-n2cccn2)ccc1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	789341386	IBJFQIQTFNDNPC-UHFFFAOYSA-N	442.501	1.898	50	20	IDGD	
CCC[C@H](CCCS(C)(=O)=O)C(=O)N1CCN(S(=O)(=O)CBr)CC1	790013572	FNPOWLIQZOOPBM-CYBMUJFWSA-N	447.417	1.054	50	20	IDGD	
COC(=O)c1cccc(Cl)c1S(=O)(=O)NNC(=O)CCCNC(=O)OC(C)(C)C	790068128	MPVCGGQJOUCWEE-UHFFFAOYSA-N	449.913	1.741	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNS(=O)(=O)c2cc(OC)c(OC)cc2Cl)c1	790342014	RLDSYERAGWBXJZ-UHFFFAOYSA-N	430.866	1.998	50	20	IDGD	
C=CCn1c(=O)c2ccccc2n2c(SCC(=O)NNc3nc4ccccn4n3)nnc12	791258197	OPEICDWZHHQKTA-UHFFFAOYSA-N	447.484	1.508	50	20	IDGD	
COc1ccc(OC)c(C2=NO[C@H](C(=O)NNC(=O)[C@H]3COc4ccccc4O3)C2)c1	791450965	ZOJWGNLJLSJYGB-RBUKOAKNSA-N	427.413	1.184	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(C)(C)[C@@H]1C(=O)OCC(=O)NNC(=O)c1ccc(C#N)cc1	796219876	RZQDNKPXLSUPMK-INIZCTEOSA-N	430.461	1.508	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)on2)cc1OC	796998171	GJBAAZPLDHHDND-UHFFFAOYSA-N	438.396	1.537	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN1C(=O)OCc1ccccc1)[C@@H]1COc2ccccc2O1	797407006	IXVAJGBURJKEKY-APWZRJJASA-N	425.441	1.775	50	20	IDGD	
Cc1ccc(N2CCOCC2)cc1NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1	797694770	WFHHKECGTWVACA-UHFFFAOYSA-N	439.520	1.691	50	20	IDGD	
O=C(NNC(=O)N1CCC(S(=O)(=O)N2CCCC2)CC1)c1cnn(-c2ccccc2)c1	799927047	NDKKQLGLNSUUCO-UHFFFAOYSA-N	446.533	1.117	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)N[C@H]3CCC[C@H]3CNS(C)(=O)=O)n[nH]2)cc1	800749094	RZDXYHBINFVXNR-GJZGRUSLSA-N	434.522	1.047	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)Nc2ccc(Br)cc2)nc2nc(O)nc(O)c12	801996120	FRWJCEWOPXNBKO-UHFFFAOYSA-N	433.222	1.973	50	20	IDGD	
COc1ccc(C2=NO[C@@H](CNC(=O)NNC(=O)COc3ccccc3[N+](=O)[O-])C2)cc1	802366988	GJMFKONIVGKBPM-OAHLLOKOSA-N	443.416	1.506	50	20	IDGD	
CC(=O)N1CCCC[C@H]1C(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	802762558	IRFBYDQVKVSYPH-IBGZPJMESA-N	435.956	1.006	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)c2ccnc(NC(=O)C3CC3)c2)cc1C	803907014	WEELIVPUPJQVGS-UHFFFAOYSA-N	430.486	1.980	50	20	IDGD	
CCS(=O)(=O)N1CCN(C(=O)NNC(=O)c2cc3c(s2)CC[C@H](C)C3)[C@H](C)C1	804868674	NIVOKRKSVSXYBN-QWHCGFSZSA-N	428.580	1.583	50	20	IDGD	
COC(=O)CC[C@@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)c1ccc(Cl)cc1O	806536029	FPHJLZZQCSNKMN-GFCCVEGCSA-N	429.857	1.653	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)C(=O)Nc1cc(C(F)(F)F)cc(Br)n1	806976642	JMRBTTQKPBPZCF-UHFFFAOYSA-N	434.172	1.601	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2cc(C)n(-c3ccc(F)cc3F)n2)n1	808934654	PFHHNZSVSOYACT-UHFFFAOYSA-N	431.403	1.058	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)[C@@H]2C[C@H](c3ccccc3)OC2=O)ccc1Cl	809555605	BNEGWYCQZTUPSE-GXTWGEPZSA-N	437.861	1.053	50	20	IDGD	
CC(=O)c1cccc(S(=O)(=O)NCC(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)c1	810585469	VOVMBKMKLSOYSN-UHFFFAOYSA-N	447.498	1.080	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)c1ccn(-c2ccc(Br)cc2)n1	814312812	HFZDGWGXFWTYNP-UHFFFAOYSA-N	432.234	1.419	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)cc1)C(=O)Nc1cccc(S(=O)(=O)C2CCCCC2)c1	815582709	NOJTURUQTTXWRH-UHFFFAOYSA-N	445.497	1.898	50	20	IDGD	
Cc1nn(Cc2ccc(C(=O)NNC(=O)[C@H]3CCc4nncn4C3)cc2)c(C)c1[N+](=O)[O-]	816875514	BPDHCZKQTNUGHP-INIZCTEOSA-N	438.448	1.072	50	20	IDGD	
Cc1nnnn1[C@H](Cc1cccc(F)c1)C(=O)NNc1ccccc1S(=O)(=O)N(C)C	817054848	AXYMGJMZNDGSCD-QGZVFWFLSA-N	447.496	1.298	50	20	IDGD	
CCOc1ccc(NNC(=O)c2cc(S(=O)(=O)N3CCOCC3)ccc2OC)cc1	817915584	OYFLOTNCFWGHAI-UHFFFAOYSA-N	435.502	1.872	50	20	IDGD	
CN1C(=C(C#N)C(=O)COC(=O)CCc2nc(O)c3cnn(C)c3n2)N(C)c2ccccc21	900703966	VLFKPZHLTURHQZ-UHFFFAOYSA-N	447.455	1.435	50	20	IDGD	
CCOc1ccc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)[C@@H](C)NC(C)=O)cc2)cc1	913392086	VYFRKDYUEGBRLM-CYBMUJFWSA-N	448.501	1.172	50	20	IDGD	
Cn1ccnc1[C@@H](NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)c1cccc(F)c1	914598238	RCXRVOUZPBRLOG-KRWDZBQOSA-N	435.423	1.269	50	20	IDGD	
CN(C)C1(CNC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)CCCC1	915895360	LOGSCQJCJKKOEQ-UHFFFAOYSA-N	437.566	1.290	50	20	IDGD	
CC(C)NS(=O)(=O)Cc1ccc(CNC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1	916227649	HXCFUIHBSCHQNF-UHFFFAOYSA-N	449.489	1.567	50	20	IDGD	
CCCS(=O)(=O)N1CCC(NC(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)CC1	916383287	AYLVUSWCRKAHBA-MRXNPFEDSA-N	440.566	1.605	50	20	IDGD	
CCOc1ccc(C(=O)NNS(=O)(=O)c2ccc(OCC(=O)OC)cc2)cc1OC	917727739	OFYPMBCFVQFIEH-UHFFFAOYSA-N	438.458	1.269	50	20	IDGD	
CN(C)C(=O)c1cccc(S(=O)(=O)NNC(=O)c2ccc(F)cc2Br)c1	917753319	GKIXPNOEFHAHEW-UHFFFAOYSA-N	444.282	1.913	50	20	IDGD	
NS(=O)(=O)c1ccc(C(=O)NNC(=O)c2ccccc2OCc2ccc(F)cc2)o1	917906851	LPMUGBKDFCBMGP-UHFFFAOYSA-N	433.417	1.720	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)C1CCN(C(=O)N(CC)CC)CC1	917919341	BSBQKFFCWSKKRJ-UHFFFAOYSA-N	428.537	1.920	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)c2ccc(F)cc2Br)cc1	918340213	GMBUQVKHTUUZIT-UHFFFAOYSA-N	444.282	1.913	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@H]2CCN(c3ccc(F)cc3)C2=O)c2ccccc2c1=O	919692856	YDICFVZLQIMDEM-QGZVFWFLSA-N	437.431	1.370	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)c2ccc(N3NC(=O)CCC3=O)cc2)cc1OC	920287651	HLLDGZHUAUBXRN-UHFFFAOYSA-N	426.429	1.327	50	20	IDGD	
CCc1cc(OCC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)ccc1Cl	1317883886	UWRGMKQAKFZZHU-UHFFFAOYSA-N	439.921	1.993	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCCN2CCN(C(=O)C3CCCCC3)CC2)cc1	1318462907	UVDOAOHXBFKMGF-UHFFFAOYSA-N	431.537	1.364	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@H](CCC(N)=O)C(=O)NNc2ccc(F)cc2C)cc1C	1321128732	SNOMLVNEAMEXPP-GOSISDBHSA-N	436.509	1.807	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)[C@H]2CCN(c3ccc(F)cc3)C2=O)CC1	1339205098	RTZFFRMXYQTEEZ-QGZVFWFLSA-N	448.495	1.973	50	20	IDGD	
C[C@H](NC(=O)c1ccccc1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Cl)C1	1778027239	GSLCYPAQFKYBBN-YHXHNGJMSA-N	439.915	1.853	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(-n3cccn3)nc1)C2)[C@@H](F)Cl	1778029612	DAUPKERLSNHNME-WRWLIDTKSA-N	435.887	1.929	50	20	IDGD	
C[C@@H](Cn1ccnc1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CO[Si](C)(C)C)C1	1779545902	QBYGLACFUSVHKU-WAOWUJCRSA-N	436.629	1.885	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)nn1C(F)F	1780305771	BTBWRJVVBZDIDH-XHDPSFHLSA-N	439.232	1.721	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccn(-c4ccccc4)n3)C2)C1	1780344385	VDRUGAQKWPURTG-LAUBAEHRSA-N	432.908	1.570	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)CNC(=O)c3ccco3)CCO2)C1	1781226847	BASXCGVSBUKXIU-ROUUACIJSA-N	432.304	1.076	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cc4cccnc4nc3O)CCO2)C1	1783538519	XSKIIOOXAFQPSJ-HXPMCKFVSA-N	449.305	1.562	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(OC(F)F)cc3)CCO2)C1	1783880947	NSIVZFOHVGDWBX-HNAYVOBHSA-N	432.851	1.985	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3nccc(Cl)c3OC)CCO2)C1	1783881253	JYUJEDLKIMUEJN-SCLBCKFNSA-N	432.304	1.441	50	20	IDGD	
COC(=O)N[C@@H](C(=O)N1CCO[C@]2(CCN(C(=O)C(Cl)Cl)C2)C1)c1ccccc1	1783939144	AMHBFYGBJPGQBB-KUHUBIRLSA-N	444.315	1.717	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(F)(F)F)C[C@@H]21)[C@@H](O)CCl	1784086327	KFXDOKMNYLDYAM-LVGORTOPSA-N	435.830	1.293	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H]3CCCN3Cc3ccccc3)C2)C1	1784241179	AAWOQKVRXDNINQ-QTEQDKRBSA-N	449.979	1.735	50	20	IDGD	
Cc1nc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)Br)C[C@@H]32)cs1	1785295182	CWLLMKJWUDYRHU-LVGORTOPSA-N	430.368	1.757	50	20	IDGD	
C#CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@@]2(CN(C(=O)[C@@H](F)Cl)CCO2)C1	1785574417	JFZPLGKQDNLIBL-KSMMKXTCSA-N	431.892	1.267	50	20	IDGD	
CC(=O)c1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]32)n[nH]1	1785840084	FYVXXTPFGCGHRD-NZRMSGFPSA-N	431.320	1.442	50	20	IDGD	
O=C(CN1C(=O)CSC1=S)NC1(c2ccc(NC(=O)[C@H](O)CCl)cc2)CCC1	1786137643	VNZMZCJTVRDMCK-CYBMUJFWSA-N	441.962	1.581	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1cc2ccccc2o1	1787944243	DSKDFVMRDWNLMH-JLMWRMLUSA-N	448.284	1.020	50	20	IDGD	
N#Cc1c[nH]c(C(=O)NC2(c3ccc(NC(=O)c4cccc(B(O)O)c4)cc3)CCC2)c1	1788148023	WYXIIAAZJYAVJK-UHFFFAOYSA-N	428.257	1.628	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(Cl)nn3)[C@H]2C1	1788837875	NTPXDGKMICTAOB-FMSGJZPZSA-N	445.745	1.897	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)c1cccn2nccc12	1790399856	NOZDJQPYOSORSS-DLKVLKDVSA-N	439.285	1.618	50	20	IDGD	
O=C(NC1(c2ccc(NC(=O)[C@@H](F)Br)cc2)CCC1)c1ccc(B(O)O)cc1	1790534157	ASCNDHJQNIEDOQ-MRXNPFEDSA-N	449.085	1.805	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCN(C)C(C)=O)C[C@@H]21	1790958708	ZWYZUDPYXYLWMM-JONQDZQNSA-N	432.359	1.008	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(C(N)=O)cc3)C[C@@H]21	1791064703	DYPZEVGWRJADEB-MEYUZBJRSA-N	438.322	1.162	50	20	IDGD	
COc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCBr)cc1OC	1795114983	UKTSMIWTDWOVSV-ZSBFGKGUSA-N	441.322	1.692	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(C=O)s1	1795742309	IWBUGRYHZRLNIT-OHTBPHCPSA-N	429.336	1.795	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccc2c(c1)CCCO2	1797243497	NOLPWXSLCZMJKV-BBIADKPPSA-N	446.620	1.995	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cncc(C(F)(F)F)c1	1798253151	VLXOCOQJNDVCTO-AYRXBEOTSA-N	435.830	1.557	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnc(Cl)c(Cl)c1)c1ccc(B(O)O)cc1	1798759225	BNTPXWGAKTWOJD-MUJYYYPQSA-N	448.115	1.634	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1c(F)cccc1F)c1ccc(B(O)O)cc1	1799732377	SSALQXTWWJGQLY-BJWYYQGGSA-N	428.244	1.139	50	20	IDGD	
CC(=O)OC[C@@H](OC(C)=O)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@](C)(Cl)CCl	1800080993	YXFIFKAAPZRJJA-KQVLKZGSSA-N	437.320	1.356	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)n1cccc1C=O)C2	1800756500	NJLBYBAFHYEAKB-IPVBOJNNSA-N	426.311	1.235	50	20	IDGD	
Cn1cc2cc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)c3cnccc3C(=O)NN)C4)ccc2n1	1800907433	BWPLLUDVPFLWHZ-BJWYYQGGSA-N	447.499	1.137	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@](C)(Cl)CCl)C3)C1	1800968618	GUPLIAFEBYNRLB-HLROQWKMSA-N	449.375	1.792	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(OC)c(N(C)C)c1)C2	1800976858	ALCVUEOFHBHBBZ-YYAJDYIMSA-N	439.940	1.218	50	20	IDGD	
O=C(Cc1cnccn1)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@H]1c1cccnc1	1803301010	BDIPSONZOHJQQX-RRQGHBQHSA-N	436.285	1.811	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)C(F)(F)C(F)F)[C@@H]1c1cccnc1	1804012369	ARIMAZVRNPGIIH-CJNGLKHVSA-N	447.433	1.361	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)COC(C)(C)C)[C@H]1c1cccnc1	1804085324	SRQKPHHSCLTFMV-LAUBAEHRSA-N	433.553	1.276	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2cc(OC)nn2C)[C@H]1c1cccnc1	1804929090	PGOCRKRXYAKJFM-RLFYNMQTSA-N	435.912	1.397	50	20	IDGD	
CCOC(=O)N[C@@H](O)C(=O)N1CCC2(CCCN(C(=O)[C@@H](C)CBr)C2)CC1	1805385457	ZJXCKYLWAFPRAR-KBPBESRZSA-N	448.358	1.313	50	20	IDGD	
CCOC(=O)/C=C/C(=O)NC[C@@H]1CCN(C(=O)[C@H](C)Br)[C@H]1c1cccnc1	1806299303	LCIBZGCNKSTPKJ-IRFINAKCSA-N	438.322	1.990	50	20	IDGD	
Cc1cccnc1C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1807366964	WJBMRLJFXPNMAG-KNQAVFIVSA-N	444.300	1.098	50	20	IDGD	
CN1CCC[C@H]1C(=O)N1CC[C@H](CNC(=O)[C@@H](F)Br)[C@H]1c1cccnc1	1808652642	YWHQOSJVPHOMEL-QKPAOTATSA-N	427.318	1.872	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)C23CC(C2)C3)[C@@H]1c1cccnc1	1810309092	OZEQGTZHLCVMIS-VJCUWHJYSA-N	434.500	1.200	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)Cc2c(C)n[nH]c2C)[C@@H]1c1cccnc1	1810414772	UQYLMTWRCGPEMY-QRFRQXIXSA-N	433.940	1.924	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](O)C(=O)NC[C@@H]1CCN(C(=O)[C@H](F)Cl)[C@@H]1c1cccnc1	1811507557	RGIGZBAKHUWZQN-KNCOVGOOSA-N	444.891	1.465	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)c2cccc(=O)n2O)[C@H]1c1cccnc1	1812865687	RUAMJZOIEVFJAE-QEORTHHSSA-N	449.305	1.584	50	20	IDGD	
COCCOCCOCCC(=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Cl)[C@@H]1c1cccnc1	1812932389	XURSEBGHFQGNEK-QXAKKESOSA-N	445.919	1.692	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)CCc2cnccn2)[C@@H]1c1cccnc1	1813032882	GYSRMRRRZOEKRX-IMFGXOCKSA-N	431.924	1.764	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1	1815337206	OPAOERWCWNDNLO-KGLIPLIRSA-N	435.742	1.456	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC[C@H]1c1cc(NC(=O)C(F)(F)C(F)F)n[nH]1	1815542396	DZMJFQAQGFDROA-ZDUSSCGKSA-N	442.178	1.296	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCc2nc(N)n[nH]2)n[nH]1	1819286027	WTQRWTUDPGDFIK-ONGXEEELSA-N	439.318	1.518	50	20	IDGD	
CC(C)O[C@H](C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1819504051	MKZULOJIVYVXBH-KDOFPFPSSA-N	428.298	1.209	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)[C@@H]1[C@@H]2C=CS[C@@H]12	1821707112	KIJXAQXVOAPUKZ-IAAVTCLWSA-N	438.318	1.271	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)n2)[nH]n1	1822187650	YLKVMANNRUUECI-KCJUWKMLSA-N	439.270	1.700	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2csc(N)n2)[nH]n1	1822414103	LSBVNHUKTCIEHR-CYBMUJFWSA-N	434.526	1.127	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)Cc2ccncc2)[nH]n1	1822415105	BLAKWFXROOMNPA-QGZVFWFLSA-N	427.509	1.413	50	20	IDGD	
CCC[C@H](NC(C)=O)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1	1822418165	VUXCGTIOORKLPP-DOTOQJQBSA-N	449.556	1.080	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CN2CCSCC2)CC1	1823725029	XVWONAYJCZMGFK-MSOLQXFVSA-N	432.030	1.909	50	20	IDGD	
COc1ccnc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)[C@H](O)CCl)CC2)c1OC	1824184842	RYWHYVBGXCNBJM-JKSUJKDBSA-N	439.940	1.932	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)C2=NN(C)C(=O)CC2)CC1	1824928440	UCTFEMFFEHWUGT-RDJZCZTQSA-N	426.945	1.468	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(CO)on1)CC2	1825645752	JETBXAMJZKBFTQ-JGVFFNPUSA-N	429.296	1.633	50	20	IDGD	
CCc1ncccc1C(=O)N[C@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1	1826080371	GGGFMXUWFIMPIT-ZDUSSCGKSA-N	444.561	1.699	50	20	IDGD	
Cc1ccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)nc1C	1827050302	MADYXQIMCMIBFT-HSZRJFAPSA-N	449.360	1.925	50	20	IDGD	
CCn1nccc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827056016	ODBUFNXIFKHRHV-FQEVSTJZSA-N	438.337	1.130	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cnc(O)nc2O)CC1	1827592900	YACMGIWJCLCGCY-CABCVRRESA-N	426.901	1.375	50	20	IDGD	
Cc1cc2nnc(C(=O)N3CCCC[C@H]3C3CCN(C(=O)[C@@H](O)CCl)CC3)c(C)n2n1	1828144805	OEWYXYCYDGDQLY-IRXDYDNUSA-N	448.955	1.574	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnccn2)CC1	1828925754	QVWIJJFPIKOLSI-IBGZPJMESA-N	437.504	1.022	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CCCCO3)C2)C1	1830534240	YPUFTNNIMBAVHB-RVKKMQEKSA-N	433.343	1.043	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc[nH]c4nccc3-4)C2)C1	1831646366	KTFGXZRFPUSGDN-DYESRHJHSA-N	434.924	1.992	50	20	IDGD	
COc1cc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)n(C)n1	1831871370	BOPDCKLYOFKBPQ-KRWDZBQOSA-N	448.568	1.035	50	20	IDGD	
O=C([C@H](F)Br)N1CCC([C@H]2CCCCN2C(=O)CCn2ccnn2)CC1	1832246472	HEQAOFNCVPAKFM-ZBFHGGJFSA-N	430.322	1.978	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H]2CCOC2)CC1	1832376553	KHACKFHMCXMAEO-GLGQMAOFSA-N	443.548	1.777	50	20	IDGD	
CN1CCC(C(=O)NC2CCN(C3CCN(C(=O)[C@H](F)Br)CC3)CC2)CC1	1833104754	AUVQVJIWNGTHIB-KRWDZBQOSA-N	447.393	1.590	50	20	IDGD	
CC(=O)N[C@H](C)C(=O)N1CCC(N2CCC(NC(=O)[C@H](C)CBr)CC2)CC1	1833265003	UWNXXUJEGXPEOG-ZIAGYGMSSA-N	445.402	1.114	50	20	IDGD	
C#CCO[C@@H](C)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1833466515	GXZCUVYMERDGLX-XJKSGUPXSA-N	432.334	1.287	50	20	IDGD	
CN(C)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1833658752	PPAHERQXPCADAW-OAQYLSRUSA-N	438.956	1.483	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)/C=N/O[C@H]3CCCCO3)CC2)CC1)[C@@H](F)Cl	1835083936	AAVKHMZCDHUHFD-VTLOZCKBSA-N	432.924	1.621	50	20	IDGD	
C[C@@H]1CC[C@H](C(=O)NC2CCN(C3CCN(C(=O)[C@@H](F)Br)CC3)CC2)O1	1835464853	XCTGAYHFVBFFNI-DAXOMENPSA-N	434.350	1.816	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)[C@H]3CNc4ccccc43)CCO2)C1	1835705350	GXWHQQYHRIORMG-JTSKRJEESA-N	435.952	1.917	50	20	IDGD	
O=C(Cc1c(F)cccc1F)NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836313534	QDYGOUHVLYDQFJ-LJQANCHMSA-N	443.922	1.679	50	20	IDGD	
Cc1nn[nH]c1C(=O)N1CCC(N2CCC(NC(=O)[C@@](C)(Cl)CCl)CC2)CC1	1836398316	GALQKCHDKACBIX-SFHVURJKSA-N	431.368	1.535	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)c3cc(O)n(C)n3)CC2)CC1	1837271020	LEXSZTDGEJNGHL-GFCCVEGCSA-N	443.342	1.521	50	20	IDGD	
Cc1cccc(C(=O)N2CCC(OC3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)n1	1837434537	CSGZZHYMARFHPS-UHFFFAOYSA-N	445.564	1.375	50	20	IDGD	
O=C(c1cccc(-c2cnco2)c1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1839365299	CVFHPUZRGPXJBR-FXAWDEMLSA-N	437.855	1.946	50	20	IDGD	
CCOc1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](Cl)CC)C3)C2)c1O	1839427064	FFYSMIMVRWETDN-KKSFZXQISA-N	440.924	1.878	50	20	IDGD	
Cc1onc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)c1C	1840030117	AOHMHCHCWQIZRM-PXAZEXFGSA-N	430.299	1.145	50	20	IDGD	
Cc1cccc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)n1	1840030458	MZYBFNVVWVGCHW-DNVCBOLYSA-N	440.338	1.172	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H]3C[C@H]4CC[C@@H]3O4)CCO2)C1	1840050334	FYJGGQQQYKYTDK-QGRWZNMESA-N	435.348	1.247	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@]3(F)CCCC=C3F)C2)C1	1840156857	WGHZXGHUVSLOOP-ZOCIIQOWSA-N	436.883	1.442	50	20	IDGD	
COc1cc(C)ccc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840190807	OIXLHVGMHOREKS-IBGZPJMESA-N	431.316	1.877	50	20	IDGD	
Cc1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)c1Cl	1840690053	LXQNRVZZKFPGPG-KXBFYZLASA-N	431.316	1.318	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCCC12CN(C(=O)c1ccc(S(C)(=O)=O)cn1)C2	1844377536	PODOGZNUYFFNOX-UHFFFAOYSA-N	425.583	1.154	50	20	IDGD	
Cc1ocnc1C(=O)N1CCCC12CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2	1844555188	UPBQNQZASWUBGA-UHFFFAOYSA-N	440.504	1.146	50	20	IDGD	
CC(=O)N/C(C)=C/C(=O)N1CC2(CCCN2C(=O)c2cc([N+](=O)[O-])ccc2OC(C)=O)C1	1844693380	XKNOFFKHHQZUCI-UKTHLTGXSA-N	444.444	1.377	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCCC12CN(C(=O)C1CCN(S(C)(=O)=O)CC1)C2	1845170840	RBLJLNQRMYHRQV-MRXNPFEDSA-N	440.393	1.098	50	20	IDGD	
CC(C)(C)OC(=O)N1CC2(C[C@@H](C(=O)N3CCCC34CN(C(=O)[C@H](F)Cl)C4)CO2)C1	1846120172	GQTMYCLAFAOCMW-KGLIPLIRSA-N	445.919	1.750	50	20	IDGD	
C[C@@H](O)[C@H](NC(=O)c1ccccc1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)C(C)(C)CCl	1847434931	KHKRPMACABFWLB-UBDQQSCGSA-N	435.952	1.633	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H]1CC[C@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](O)CCl)CC1	1847557441	YVJGFBGKJZRLGX-QUSNUVHPSA-N	443.972	1.871	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCNC(=O)OC(C)(C)C	1847870135	MYPUWIOZKYGGKI-FXUDXRNXSA-N	431.961	1.871	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)c2cccc(N3CCCS3(=O)=O)c2)nc2ccccc21	10123641	MBIPNLYERNQUJD-UHFFFAOYSA-N	427.486	1.117	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1	17329833	ITJSFMNSNWGWNE-KRWDZBQOSA-N	432.458	1.518	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)c([N+](=O)[O-])c1	23391469	ASHSKNCHMDRAPZ-UHFFFAOYSA-N	441.418	1.253	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)CN2C(=O)N[C@]3(C[C@@H](C)CC(C)(C)C3)C2=O)c1	104669867	QCHMNGCZXGKSCP-NYHFZMIOSA-N	430.505	1.658	50	20	IDGD	
Cc1nc(S(=O)(=O)N2CCC(C(=O)NNC(=O)c3c[nH]c4ccccc34)CC2)cn1C	109591111	UNLJHBDBIKFBMX-UHFFFAOYSA-N	444.517	1.072	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)N1CCC(C(=O)Nc2cccc(F)c2)CC1	725871031	FITMNOSNTHWQIX-UHFFFAOYSA-N	431.424	1.240	50	20	IDGD	
O=C(CN1CCCC1=O)NNC(=O)c1ccccc1OCC(=O)Nc1ccccc1F	726067339	LSGPSLLMQALIDE-UHFFFAOYSA-N	428.420	1.227	50	20	IDGD	
NS(=O)(=O)c1ccc(CNC(=S)NNC(=O)CC23CC4CC(CC(C4)C2)C3)cc1	726438579	YPWYNRGMYVCOHM-UHFFFAOYSA-N	436.603	1.936	50	20	IDGD	
CNS(=O)(=O)c1cccc([C@H](C)NC(=O)NNC(=O)c2ccc3ccccc3n2)c1	727608896	ZXXKAWVAVKTDDY-ZDUSSCGKSA-N	427.486	1.848	50	20	IDGD	
Cc1nn(Cc2ccc(Cl)cc2)c(Cl)c1C=NNC(=O)[C@@H](C)NS(C)(=O)=O	728436463	GJNYBIBGQOTLIH-LLVKDONJSA-N	432.333	1.934	50	20	IDGD	
N#Cc1ccccc1N1CCCN(C(=O)NNC(=O)CNC(=O)c2cccs2)CC1	728951088	ADLYBYMCXBAYLM-UHFFFAOYSA-N	426.502	1.303	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)[C@@H](NC(=O)NC(C)(C)C)C(C)C)c2ccccc2c1=O	729258102	BAUGWCPSQGIMOQ-INIZCTEOSA-N	444.536	1.690	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)c2cccnc2)cc1Br	729296173	JZCCMPFEGSFWEM-UHFFFAOYSA-N	427.280	1.169	50	20	IDGD	
COC(=O)NC(C)(C)C(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	729298343	CFJKBRZYEMBHFH-UHFFFAOYSA-N	437.456	1.340	50	20	IDGD	
CC(=NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)c1cccc(NS(C)(=O)=O)c1	729816162	FCCZLLUXXUQKBA-UHFFFAOYSA-N	438.531	1.462	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2nnn(-c3cccc([N+](=O)[O-])c3)c2C)c(OC)c1	729950443	UUTZQKCXRBJBFZ-UHFFFAOYSA-N	426.389	1.576	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)N[C@H]2CCN(c3ccc(F)cc3F)C2)c2ccccc2c1=O	730137555	VQWNHMMQOBIOCG-ZDUSSCGKSA-N	442.426	1.435	50	20	IDGD	
C[C@H](NC(=O)OC(C)(C)C)C1CCN(C(=O)NNC(=O)CNC(=O)c2ccco2)CC1	730273836	ZWUGDMFIHIXNRX-ZDUSSCGKSA-N	437.497	1.375	50	20	IDGD	
O=C(NCCOc1ccc([N+](=O)[O-])cc1)NNC(=O)C1CCN(c2ncccn2)CC1	731684508	XODJWQIWEUQXOT-UHFFFAOYSA-N	429.437	1.011	50	20	IDGD	
N#CCc1ccc(Oc2ccc(C(=O)NNC(=O)N[C@@H]3CCS(=O)(=O)C3)cc2)cc1	732061235	FFFDXQKPJXRTMA-MRXNPFEDSA-N	428.470	1.676	50	20	IDGD	
CS(=O)(=O)c1ccc(F)c(S(=O)(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c1	733123190	WWIZNBCDOFAMLJ-UHFFFAOYSA-N	438.462	1.038	50	20	IDGD	
Cn1c(NNC(=O)CCc2ccc(S(=O)(=O)NC3CC3)cc2)nc2ccccc2c1=O	733261488	CLOMNCHQAADVSV-UHFFFAOYSA-N	441.513	1.450	50	20	IDGD	
O=C1CCc2cc(Br)c(S(=O)(=O)NNC(=O)c3ccccc3O)cc2N1	734806814	KLGGKGLDFLETHI-UHFFFAOYSA-N	440.275	1.663	50	20	IDGD	
COc1cccc(S(=O)(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)c1	734807377	MRZROUSHKBBZAE-UHFFFAOYSA-N	428.511	1.587	50	20	IDGD	
O=C(COCc1ccccc1)NNS(=O)(=O)c1cc(Br)ccc1[N+](=O)[O-]	737756522	QENUJOIWPHJGRT-UHFFFAOYSA-N	444.263	1.884	50	20	IDGD	
Cc1cccc(C=NNC(=O)C[C@H](C(=O)NN=Cc2cccc(C)c2)N2CCOCC2)c1	741767439	VRLUWOBFIQHMHQ-JOCHJYFZSA-N	435.528	1.995	50	20	IDGD	
CC(C)(C)OC(=O)N(CC(=O)NNC(=O)c1ccc2c(c1)OCCO2)C[C@@H]1CCCO1	741891836	OZDWPHVFCRAQST-HNNXBMFYSA-N	435.477	1.635	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)[C@@H](c1ccccc1F)N1CCOCC1	742476860	KBOWEHVVBYBIDT-JOCHJYFZSA-N	439.491	1.959	50	20	IDGD	
CCCNC(=O)CN1CCC(NC(=O)NNC(=O)Nc2ccc(OC(F)F)cc2)CC1	743535584	PSXVJMQPBSIDLL-UHFFFAOYSA-N	442.467	1.614	50	20	IDGD	
Cc1c(/C=C(\C#N)C(=O)O[C@@H](C)C(=O)N2CCN(C(=O)c3ccco3)CC2)cc(C#N)n1C	744633842	ZZDNQADVNDKAGV-GYKGCMEESA-N	449.467	1.621	50	20	IDGD	
O=C(NCc1ccc(Cn2ccccc2=O)cc1)NNC(=O)c1cc([N+](=O)[O-])ccc1O	745768473	YQGDNCXZHDPJRU-UHFFFAOYSA-N	437.412	1.655	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12)N1CCCC1=O	746095171	JZUOEAMDVCUZQE-IBGZPJMESA-N	447.495	1.607	50	20	IDGD	
CC(C)C[C@H](C(=O)NNC(=O)Cc1cn2ccccc2n1)N1C(=O)[C@@H]2CC=CC[C@H]2C1=O	746553090	GBHMVCXDHSFTIU-KZNAEPCWSA-N	437.500	1.390	50	20	IDGD	
CN(CC(=O)NNC(=O)COc1ccccc1O)c1ccc(C(F)(F)F)cc1C=O	746600552	CDTYCTAFMRMKPA-UHFFFAOYSA-N	425.363	1.886	50	20	IDGD	
COc1cc(C)nc(NNC(=O)NCC2CCN(S(=O)(=O)c3ccccc3)CC2)n1	746756477	XAVMJPNGTGFGLT-UHFFFAOYSA-N	434.522	1.521	50	20	IDGD	
O=C(NCCOCc1ccccc1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	747588614	GAZBNQSRKVMITM-UHFFFAOYSA-N	446.529	1.632	50	20	IDGD	
CS(=O)(=O)c1ccc(NNC(=O)c2cc(-c3ccco3)nc3c(C(N)=O)ncn23)cc1	748161654	SHSCIQRZIXVDAE-UHFFFAOYSA-N	440.441	1.249	50	20	IDGD	
CCOc1ccccc1Oc1ccc(CNC(=O)NNC(=O)C(=O)N2CCCC2)cn1	748462031	SIEISJWUNNBDKF-UHFFFAOYSA-N	427.461	1.725	50	20	IDGD	
O=C(NNc1ccc(OCC(F)(F)F)cc1)[C@H]1CC(=O)N([C@H]2CCS(=O)(=O)C2)C1	748694904	HEYKEGPPJFGQEB-AAEUAGOBSA-N	435.424	1.106	50	20	IDGD	
C[C@H](NC(=O)CC1CCCCC1)C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	749838720	UVRDPMGZXDYRAE-NSHDSACASA-N	444.941	1.224	50	20	IDGD	
CCOC(Cn1cc(C(=O)NNc2nc(Br)cn3ccnc23)nn1)OCC	750243715	NICQXIWAGDRPIN-UHFFFAOYSA-N	439.274	1.239	50	20	IDGD	
C[C@@H](C(=O)OCC(=O)NNC(=O)c1cccc(Cl)c1)N1C(=O)[C@H]2CCCC[C@H]2C1=O	750280526	QAVGQAXFBZZVCM-TUKIKUTGSA-N	435.864	1.208	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)NC[C@@H]2CCCCS2(=O)=O)N(C)c2ccccc21	752844787	YIUGSNLYQZBQOY-HNNXBMFYSA-N	430.530	1.741	50	20	IDGD	
Nc1nc(Cl)cc(NNC(=O)c2ccc([N+](=O)[O-])cc2I)n1	753449335	FFEITCVLWXXYMG-UHFFFAOYSA-N	434.581	1.982	50	20	IDGD	
CCOc1ccc(NC(=S)NNC(=O)c2cc(OC)c(S(N)(=O)=O)s2)cc1	754183600	SWXUXOJPXJNPHH-UHFFFAOYSA-N	430.533	1.434	50	20	IDGD	
CCc1c(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cnn1CC(C)C	755407914	SUDDTVIWRIZXJH-UHFFFAOYSA-N	447.561	1.961	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)Nc2ccc(C(=O)NCC(=O)OC)cc2)cc1OC	755544193	DVVPLEBVQTTZIJ-UHFFFAOYSA-N	444.444	1.463	50	20	IDGD	
C[C@H]1C[C@@H](C)C[C@]2(C1)NC(=O)N(CC(=O)NNC(=O)c1cc(Br)c[nH]1)C2=O	756871034	NVNADIGXZXFKKM-PCCFMPIBSA-N	440.298	1.285	50	20	IDGD	
CNS(=O)(=O)c1cccc(NC(=O)NNC(=O)c2cc(Br)c[nH]2)c1C	757721871	ROTILEBXDFFOQO-UHFFFAOYSA-N	430.284	1.460	50	20	IDGD	
COC(=O)C[C@@H](C)C(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	758363301	WSZPVCCVGSZSJO-CQSZACIVSA-N	433.486	1.125	50	20	IDGD	
CC(C)(C)OC(=O)N(CCNC(=O)NNC(=O)C(=O)N1CCCC1)C1CCCCCC1	758906776	VQRSRDMHRVUDSE-UHFFFAOYSA-N	439.557	1.899	50	20	IDGD	
CN1C(=O)C[C@H](C(=O)NNC(=O)C(=O)Nc2ccccn2)[C@H]1c1ccc(Cl)c(F)c1	759364852	PKBKTHGDIOVZQS-MEDUHNTESA-N	433.827	1.180	50	20	IDGD	
CC1(C)C(=O)N(C[C@@](C)(O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)c2ccccc21	760054827	WXUQTSMMWKWCEH-XMMPIXPASA-N	447.495	1.913	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)CCNC(=O)c1ccc([N+](=O)[O-])cc1	761622674	VCLZIMQUHWTFTN-UHFFFAOYSA-N	432.458	1.663	50	20	IDGD	
CC(C)(C)OC(=O)NCc1nnc(SCC(=O)NNC(=O)c2ccc(F)cc2)o1	763171883	NYLHFDQFNKRCAD-UHFFFAOYSA-N	425.442	1.787	50	20	IDGD	
Cc1ccc(NC(=O)C2CC2)cc1NC(=O)C(=O)NNC(=O)[C@@H]1COc2ccccc2O1	763570593	GQRDAZFUHHLCAO-SFHVURJKSA-N	438.440	1.269	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)C(=O)Nc2cccc(C(=O)N(C)C)c2)c1	763597222	KTJCZTADYMORSI-UHFFFAOYSA-N	440.500	1.985	50	20	IDGD	
CCN(CC)C(=O)c1ccccc1NC(=O)C(=O)NNC(=O)COc1cccc(C)c1	763618606	CXLFCHBUXLPOFT-UHFFFAOYSA-N	426.473	1.642	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)COc2cccc(C)c2)sc2c1CCC2	763624227	LCMDIZOJZJDUBB-UHFFFAOYSA-N	445.497	1.887	50	20	IDGD	
COC(=O)c1ccc(OC)cc1NC(=O)C(=O)NNC(=O)COc1cc(C)cc(C)c1	763651260	ZMJAZGQTVSMWKJ-UHFFFAOYSA-N	429.429	1.264	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNC(=O)C(C)C)cc1S(=O)(=O)N1CCCCC1	763816744	NUBOGTBECXJNJY-UHFFFAOYSA-N	440.522	1.002	50	20	IDGD	
CNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)c1C	763839430	GUYJVZGAUPXTMG-OAHLLOKOSA-N	426.473	1.525	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)cn1	763849305	KWCSRXHECNGDSX-HNNXBMFYSA-N	430.461	1.277	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccnn2-c2ccncc2)cc1	763862149	UXAHFMANGXHHQZ-CQSZACIVSA-N	438.444	1.219	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)CSc2ccccc2O)cc1S(=O)(=O)N(C)C	763906032	OYCASGMFABVUEE-UHFFFAOYSA-N	438.531	1.896	50	20	IDGD	
Cc1cc(OCc2ccccc2)ccc1NC(=O)C(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1	764002191	JVZOQSGUPUXYND-MRXNPFEDSA-N	445.497	1.095	50	20	IDGD	
Cc1nnc(-c2ccc(NC(=O)C(=O)NNC(=O)c3cc(Br)cn3C)cc2)o1	764004290	CAJRYALZTMTKLY-UHFFFAOYSA-N	447.249	1.546	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1ccc(C(=O)N2CCCC2)cc1	764005164	WBCCLKPTIISPGN-UHFFFAOYSA-N	438.440	1.094	50	20	IDGD	
N#Cc1cccc(-c2csc(NC(=O)C(=O)NNC(=O)c3ccc4c(c3)OCCO4)n2)c1	764005451	YLDXDQSYJNAOEE-UHFFFAOYSA-N	449.448	1.853	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccccc3O[C@@H]3CCOC3)n[nH]2)cc1	764109775	BMFIFTJXCYCNKP-MRXNPFEDSA-N	449.467	1.953	50	20	IDGD	
COC(=O)c1c(C2CC2)csc1NC(=O)C(=O)NNC(=O)[C@@H]1Cc2ccccc2O1	764155292	XMZFXDQWHMVUOQ-AWEZNQCLSA-N	429.454	1.502	50	20	IDGD	
CC(C)(C)CC(=O)NNC(=O)C(=O)N1C[C@@H](C(=O)N2CCCCC2)Oc2ccccc21	764198588	HSFNRYJANHCRRY-KRWDZBQOSA-N	430.505	1.377	50	20	IDGD	
CS(=O)(=O)c1c(Cl)cccc1NC(=O)C(=O)NNC(=O)Cn1ccc2ccccc21	764244847	KOIFXNGKVPNZKV-UHFFFAOYSA-N	448.888	1.484	50	20	IDGD	
CCCc1c(NC(=O)C(=O)NNC(=O)Cc2ccccc2F)cnn1-c1cc(C)ccn1	764319710	SIAFBPJDRACJAM-UHFFFAOYSA-N	438.463	1.996	50	20	IDGD	
C[S@](=O)Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)ccc1Cl	764348875	AIGSLTCWJUXJFW-NDEPHWFRSA-N	444.296	1.977	50	20	IDGD	
CCOc1c(Br)cc(Cl)cc1NC(=O)C(=O)NNC(=O)c1cnn(C)c1	764358820	OKHQHOVONALTJZ-UHFFFAOYSA-N	444.673	1.634	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COCc2ccccc2)n([C@@H]2C[C@H]3CC[C@H]2C3)n1	764366567	NJHJKMORGBHRCE-OKZBNKHCSA-N	425.489	1.855	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)N[C@H]2CCCC[C@@H]2N2CCOCC2)cc1	764373982	ILEUVTJITVHZJG-UXPWSPDFSA-N	434.537	1.826	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2cc3c(cc2C)OCO3)n[nH]1	764377926	SRUYBSDMNFRZRE-UHFFFAOYSA-N	437.412	1.522	50	20	IDGD	
COCCn1ccc2ccc(NC(=O)C(=O)NNC(=O)c3cncc(NC(C)=O)c3)cc21	764434796	YQPZVXRGULSUQS-UHFFFAOYSA-N	438.444	1.041	50	20	IDGD	
O=C(COc1cccc(Cl)c1)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765737137	WTROJEHSESVNQM-UHFFFAOYSA-N	430.892	1.324	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)NC1CCN(S(=O)(=O)C(F)(F)F)CC1	765826946	JVYPRPQNTIPUGP-UHFFFAOYSA-N	444.457	1.030	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)[C@H]1CCCN(C(=O)c2ccc(F)cc2)C1	766000254	JDBANQXTDXIGBY-KXBFYZLASA-N	427.432	1.665	50	20	IDGD	
Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C	766261002	XSLDWGGGSPJZMH-UHFFFAOYSA-N	437.453	1.602	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)C(=O)Nc3ccc(Cl)cc3)CC2)cc1	766642211	OMUACKKCGSPRAH-UHFFFAOYSA-N	443.935	1.552	50	20	IDGD	
CS(=O)(=O)NCC(=NNC(=O)c1cc(Br)ccc1O)c1ccccc1	766703549	ADBKVIIFDNIFEM-UHFFFAOYSA-N	426.292	1.838	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)N2CCN(C(=O)[C@@H](Br)C(C)(C)C)CC2)C[C@@H](C)O1	767028356	CNPXUDPOIZGLFX-HZSPNIEDSA-N	440.404	1.294	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)c1cn(-c2ccc(F)cc2C)nn1	767813142	GOXIHJBFRXTICE-UHFFFAOYSA-N	425.420	1.570	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)NCCc2cn3c(n2)SCC3)c2ccccc2c1=O	768529102	LKWQICUGRJXXKP-UHFFFAOYSA-N	441.517	1.466	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2ccnc(CNC(=O)OC(C)(C)C)c2)C[C@H](C)O1	768687989	NVUFKKCDBIJZLT-GJZGRUSLSA-N	435.525	1.367	50	20	IDGD	
COc1ccccc1[C@H](NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)c1ccco1	769201525	FJFMYCWHTNKHDL-IBGZPJMESA-N	433.428	1.998	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)[C@H]3CCCN3C(=O)OCC(F)(F)F)nc21	770965720	KRLJALVQFXDXFQ-SNVBAGLBSA-N	445.402	1.893	50	20	IDGD	
CCN1CCN(c2cccc(NC(=O)NNC(=O)[C@H]3COc4ccccc4O3)c2)CC1	771272529	LIVZPMLCHDPKMG-HXUWFJFHSA-N	425.489	1.821	50	20	IDGD	
CN1C(=O)N[C@]2(CCC[C@H]2CNC(=O)NNc2ccc(Br)c(F)c2)C1=O	771335281	SVDJZJQJLGKMIV-FVMDXXJSSA-N	428.262	1.935	50	20	IDGD	
Cc1cc(NNC(=O)CN2C(=O)N[C@@](C)(c3ccc(Br)cc3)C2=O)ncn1	771578485	PFDVTBYZXCYOBE-KRWDZBQOSA-N	433.266	1.458	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1ccc(C)c(S(=O)(=O)NCc2ccccc2)c1	771903495	TURYJVTWGIMGIK-HNNXBMFYSA-N	447.513	1.576	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)[C@@H]1CCCN(C(=O)COc2ccccc2)C1	772147616	YJAPHRFHKFXACQ-IAGOWNOFSA-N	433.505	1.429	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)NCCN(C)S(=O)(=O)c1cccs1	772626318	QZLZZINMFXGTSY-LBPRGKRZSA-N	444.510	1.306	50	20	IDGD	
CC(C)[C@H](C(=O)NNC(=O)[C@H](C)Oc1ccc2ccccc2c1)N1CCCS1(=O)=O	772630783	MJGTZLOXCDPZFM-HNAYVOBHSA-N	433.530	1.815	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)NCc2ccc(N3CCCS3(=O)=O)c(F)c2)c1	773271781	FCJOOQKKLASUHX-UHFFFAOYSA-N	431.449	1.381	50	20	IDGD	
CNS(=O)(=O)c1cccc(NC(=O)C(=O)NNc2ncc(Cl)cc2Cl)c1C	773677921	KDMYDQYYMQIWOH-UHFFFAOYSA-N	432.289	1.687	50	20	IDGD	
COCCc1noc(-c2cc(Cl)ccc2NC(=O)C(=O)NNc2nccc(OC)n2)n1	773724480	RZDIKKMKEODTGA-UHFFFAOYSA-N	447.839	1.459	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ncn(C2CCCCC2)n1	774002566	RQQPWEFZFAVAAL-GFCCVEGCSA-N	434.884	1.990	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)NCCc2cnccn2)cc1	775588880	KZOFYNFKPOHZCQ-SFQUDFHCSA-N	445.483	1.490	50	20	IDGD	
CSc1ccccc1CC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	776731179	VGYFZXLRKCNZDU-UHFFFAOYSA-N	449.554	1.433	50	20	IDGD	
CC(C)N1CC[C@H](NC(=O)NNC(=O)C(=O)Nc2ccccn2)[C@H]1c1ccc(F)c(F)c1	779416947	JEBFSAJMNWJTSN-FUHWJXTLSA-N	446.458	1.853	50	20	IDGD	
COc1ccc(C=NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)cn1	780188857	PRHKMVPCPGTVQU-UHFFFAOYSA-N	432.502	1.194	50	20	IDGD	
CCNC(=O)N(C)NC(=O)c1cccc(NS(=O)(=O)c2ccc3c(c2)OCCO3)c1	780708281	DBNDQWYMISNZGF-UHFFFAOYSA-N	434.474	1.565	50	20	IDGD	
COc1cc(F)cc(NNC(=O)[C@@H]2C[C@@H](O)CN2S(=O)(=O)c2ccc(F)cc2)c1	780955506	PLFBACLVNSFCIW-PBHICJAKSA-N	427.429	1.241	50	20	IDGD	
COC[C@@H](CNC(=O)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1)OC	781395004	RUYWNKLXDVATMW-RTWAWAEBSA-N	426.517	1.605	50	20	IDGD	
CC(C)[C@@H]1C[C@H](CC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)CCO1	782017455	ZARVOHAJEYZWMI-XLIONFOSSA-N	438.594	1.907	50	20	IDGD	
CCn1cnnc1-c1ccccc1NC(=O)C(=O)NNC(=O)Cc1nc2ccccc2n1C	782894405	UETHXQFXWAPIGU-UHFFFAOYSA-N	446.471	1.180	50	20	IDGD	
CO[C@H](C)c1cccc(NC(=O)C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)c1	782898023	WNNXMOQCEDUNIR-CYBMUJFWSA-N	447.517	1.395	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2ccc3c(c2)CCN3C(=O)c2cccnc2)nc(C)n1	783325262	YFYHTCDRIXVXFV-UHFFFAOYSA-N	431.456	1.773	50	20	IDGD	
Cc1cc(F)ccc1NNC(=O)C(=O)Nc1cccc(CN2CCC(C(N)=O)CC2)c1	783447978	QQMUVTFLXVYLSK-UHFFFAOYSA-N	427.480	1.913	50	20	IDGD	
CN1Cc2ccc(NC(=O)C(=O)NNc3ccc(S(=O)(=O)NC4CC4)cc3)cc2C1	784213605	PPYHSQRYVLYUHY-UHFFFAOYSA-N	429.502	1.155	50	20	IDGD	
COCCn1ccc(C(=O)NNC(=O)c2nc(-c3ccccc3)n(-c3ccccc3)n2)n1	784292201	MMLHZWSXEVXWAQ-UHFFFAOYSA-N	431.456	1.852	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)c1cnc(OCC2CC2)c(Cl)c1	784616370	FMXVHANOSSDFAG-UHFFFAOYSA-N	437.909	1.892	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ccc(Cl)nn2)c(C)c1S(=O)(=O)NC1CC1	784789660	LSSUNDYEBVGNBW-UHFFFAOYSA-N	438.897	1.269	50	20	IDGD	
CC[C@H](C)NS(=O)(=O)c1cccc(NC(=O)C(=O)NNc2ncccc2Cl)c1	784818475	YGTBUQXYZMWVNQ-NSHDSACASA-N	425.898	1.894	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)C(=O)Nc2ccc(OC[C@@H]3CCCO3)cc2)c1	784839262	HNLGUUVFMJTQCS-KRWDZBQOSA-N	433.486	1.730	50	20	IDGD	
Cc1ccc(C(=O)N2CCOCC2)cc1NC(=O)C(=O)NNc1cc(F)c(F)c(F)c1	785088727	XNLKMGRYUIXWFW-UHFFFAOYSA-N	436.390	1.967	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc4c(c3)oc(=O)n4C)n[nH]2)c1	785126649	AYDBWCJJUVMXEI-UHFFFAOYSA-N	448.439	1.538	50	20	IDGD	
COC1(C(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)CCOCC1	785684057	IKYMXEFENUOFKK-UHFFFAOYSA-N	447.513	1.122	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)cc1N1CCNC1=O	786340235	INMNCEIXOVOLNU-UHFFFAOYSA-N	434.497	1.982	50	20	IDGD	
Cn1nc(-c2ccsc2)cc1NC(=O)C(=O)NNC(=O)COc1ccccc1[N+](=O)[O-]	787541038	JLRSPRGGALBLJF-UHFFFAOYSA-N	444.429	1.222	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2cccc3c2OCC[C@H]3OC)cc1	790952322	QXWYJMUDHDIOMO-GOSISDBHSA-N	427.457	1.884	50	20	IDGD	
C=C(CBr)CN1CCN(S(=O)(=O)c2ccc(OC)c([N+](=O)[O-])c2)CC1	791441389	NORRFGROWMAVCN-UHFFFAOYSA-N	434.312	1.861	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2cnc(C(F)(F)F)cc2OC)n1	792292739	PBQUHWXOXGHIMM-UHFFFAOYSA-N	427.387	1.827	50	20	IDGD	
CN(C)N(C(=O)CCNS(=O)(=O)c1ccc(C(C)(C)C)cc1)[C@H]1CCS(=O)(=O)C1	792854342	JIYSTCJSNZZYLO-INIZCTEOSA-N	445.607	1.145	50	20	IDGD	
CC(C)(C)c1cc(NC(=O)C(=O)NNC(=O)Cc2cc[nH]n2)n(-c2ccc(C#N)cc2)n1	793025134	KAAFWAJWDBDZGZ-UHFFFAOYSA-N	434.460	1.093	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)N1CCC[C@@H](C=NNC(=O)Cn2cnc3ccccc32)C1	794472439	WWHTVLOICLNDEG-INIZCTEOSA-N	442.520	1.902	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C[C@H]1COCCN1C(=O)OC(C)(C)C	794779927	IGFSQJDGTUFLKQ-KBPBESRZSA-N	425.457	1.766	50	20	IDGD	
CCC(=NNC(=O)CNC(=O)c1ccco1)c1ccc(Cl)c(S(=O)(=O)NC)c1	794857504	RRULVEPRPAVSKA-UHFFFAOYSA-N	426.882	1.501	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)c1cccc(S(=O)(=O)NC2CC2)c1	795160618	GETZLSKDRQKXMV-UHFFFAOYSA-N	438.531	1.135	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNS(=O)(=O)c1ccsc1	795336388	RYHCGRQRINULAF-UHFFFAOYSA-N	428.967	1.529	50	20	IDGD	
Cn1cc(-c2cc(F)ccc2NC(=O)C(=O)NNc2ccc(S(C)(=O)=O)cc2)cn1	797038237	FKRSEKKTBHFBKO-UHFFFAOYSA-N	431.449	1.712	50	20	IDGD	
CC(C)[C@H](C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1)c1cccnc1	798110636	NNGCBXMDESWWDH-SFHVURJKSA-N	432.550	1.296	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1ccc(F)cc1OCCC(F)(F)F	800592407	QWNWJNQXCUDISO-MRVPVSSYSA-N	430.380	1.247	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)c2nnn(CCOc3ccc(F)cc3)c2C)cc1	800687841	HNFKOOMKHFFAQK-UHFFFAOYSA-N	426.452	1.986	50	20	IDGD	
C[C@@H](CC(=O)NNc1ccc2c(=O)[nH]ccc2c1)NS(=O)(=O)c1cccnc1Cl	803436004	RJFSQSMEBMATDC-NSHDSACASA-N	435.893	1.777	50	20	IDGD	
CN(C)S(=O)(=O)C[C@H](NC(=O)NNC(=O)c1cccc2ccccc12)C(F)(F)F	805148818	NJLQZHLCIPDIBV-AWEZNQCLSA-N	432.424	1.606	50	20	IDGD	
CC(=O)N[C@@](C)(C(=O)NNc1ccc([N+](=O)[O-])cc1C)c1ccc(S(C)(=O)=O)cc1	805379106	YDSWEXHSVLNCRI-LJQANCHMSA-N	434.474	1.801	50	20	IDGD	
O=C(Cc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1cc(Cl)cc2c1OCC(=O)N2	806975727	MHYGRUYBQYMIJC-UHFFFAOYSA-N	437.239	1.653	50	20	IDGD	
Cc1cccn(Cc2c(F)cccc2NC(=O)C(=O)NNC(=O)Cc2ccncc2)c1=O	806979423	UKCNEMIXRRBKHX-UHFFFAOYSA-N	437.431	1.068	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)C1(S(=O)(=O)c2ccccc2)CCOCC1	808372553	SIDFRDODMVSYBZ-UHFFFAOYSA-N	441.509	1.812	50	20	IDGD	
O=C(C[C@@H]1CCCC(=O)N1)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	809560872	SCTCKRCZCQLCSR-SFHVURJKSA-N	433.472	1.208	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(C3CC3)n(C)n2)cc1OC	810385815	AJSPGYSMSRVFQM-UHFFFAOYSA-N	429.477	1.885	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@H]1CC[C@H](CNC(=O)NN[C@]2(C)CCS(=O)(=O)C2)CC1	812437733	HAVQVOQCYVUCDO-SPYBWZPUSA-N	432.587	1.699	50	20	IDGD	
COC[C@@]1(CNC(=O)NNC(=O)c2nnc(O)c3ccccc23)OCCc2ccccc21	812476999	FROGIQKWPHMLDF-JOCHJYFZSA-N	437.456	1.394	50	20	IDGD	
N#Cc1csc(C=NNC(=O)c2cc(S(=O)(=O)NCc3ccccc3)ccc2O)n1	814778370	BQYKKFUMWCCXMM-UHFFFAOYSA-N	441.494	1.963	50	20	IDGD	
COc1cc(C=NNC(=O)Nc2ccc(S(N)(=O)=O)cc2)ccc1OCCC(=O)O	814965013	FDDHYTAIGQQXPM-UHFFFAOYSA-N	436.446	1.352	50	20	IDGD	
CCC(C)(C)OCc1ccccc1NC(=O)C(=O)NNC(=O)[C@H]1CCc2nncn2C1	815692005	HNFXYELYZKFKOY-AWEZNQCLSA-N	428.493	1.332	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCO1)C(=O)Nc1cccc(C[S@@](=O)Cc2ccccc2)c1	815779856	ZCPBFGFEOIASCG-JJCDCTGGSA-N	429.498	1.400	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@@](C)(O)c3ccc(Cl)cc3)CC2)cc1	815827018	JDAKRUQTCGNWAQ-QHCPKHFHSA-N	444.963	1.821	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)[C@@H]1C[C@H]2C[C@H]2N1C(=O)OC(C)(C)C	816134589	GUMFZJIJNBLILR-UPJWGTAASA-N	425.507	1.940	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NNC(=O)CN2CCc3ccccc3C2=O)C1	816510785	GELZDCFHKHYJAX-MRXNPFEDSA-N	430.505	1.479	50	20	IDGD	
CCNS(=O)(=O)c1ccc(C(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)cc1	834764517	MRDSBPOVUVXBOP-UHFFFAOYSA-N	439.877	1.256	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)c(C)n1C	863950055	NYAQKNIYIDKVRB-UHFFFAOYSA-N	448.545	1.057	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)[C@H](CC(C)C)N2C(=O)[C@H]3CC=CC[C@H]3C2=O)cc1	901473412	XRIFBKZLNGROIR-OTWHNJEPSA-N	427.501	1.887	50	20	IDGD	
CCCCS(=O)(=O)N1CCC[C@@H]1C(=O)NNC(=O)c1cc(OC)c(OC)c(OC)c1	915874382	DZXOYNNUVHQTSI-CQSZACIVSA-N	443.522	1.068	50	20	IDGD	
O=C(NCCCn1ccnc1)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	915880604	RIQXCXBSJOOZKX-UHFFFAOYSA-N	448.530	1.780	50	20	IDGD	
CCN(CCO)c1ccc(C=NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c(C)c1	916305422	JFXCAGLAZXXBSS-UHFFFAOYSA-N	432.546	1.828	50	20	IDGD	
C[C@H]1CN(c2ccc(CNC(=O)NNC(=O)[C@@H](C)Oc3ccc(F)cc3)cn2)CCO1	916392946	QCBRYMLLGUOVFT-LSDHHAIUSA-N	431.468	1.744	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)N[C@@H](CN1CCCC1=O)c1ccccc1	916460025	WWBXDBCONOXBNA-KRWDZBQOSA-N	434.456	1.643	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCCCCN1CCC(C)CC1	916502949	DNHOFWMVDPZEAT-UHFFFAOYSA-N	438.598	1.744	50	20	IDGD	
O=C(NNc1ccccc1)c1cc(S(=O)(=O)N2CCOCC2)ccc1N1CCOCC1	916551085	RGTDZPAASAEFTA-UHFFFAOYSA-N	446.529	1.301	50	20	IDGD	
CC(C)N1C(=O)c2ccc(C(=O)NNC(=O)Cc3ccc(Cl)cc3)cc2S1(=O)=O	916746192	BDDHJRIVDQUKLV-UHFFFAOYSA-N	435.889	1.897	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CCNS(=O)(=O)c2ccccc2Cl)cc1	916830664	NZIMQHCEKDLCIZ-UHFFFAOYSA-N	438.893	1.103	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)c2ccccc2c1=O	917511520	PMKGFNONRSBHKC-UHFFFAOYSA-N	439.384	1.689	50	20	IDGD	
CC(C)Oc1ncc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1Cl	917975199	LJOYPNUOYBWUHI-INIZCTEOSA-N	449.847	1.666	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NCc2ccc(CN3CCCC3=O)cc2)cc1	918124797	GKUCJKYRSDKACS-UHFFFAOYSA-N	426.473	1.727	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCC(=O)NCC(F)(F)F	918235219	OUZBLQZPNVVKTI-QMMMGPOBSA-N	441.204	1.225	50	20	IDGD	
CCOC(=O)c1cnn2c(O)cc(COC(=O)/C(C#N)=C/c3cc(C#N)n(C)c3C)nc12	919046740	QTBVLKDVTXKRSS-LHHJGKSTSA-N	434.412	1.781	50	20	IDGD	
O=C(NC[C@@H]1CCN(c2ccc(F)c(F)c2)C1)NNC(=O)[C@@H]1COc2ccccc2O1	921076716	IXMRMBMDIGUSHF-DJJJIMSYSA-N	432.427	1.962	50	20	IDGD	
O=C(CSc1nc2ccccc2[nH]1)NNc1ccccc1S(=O)(=O)N1CCOCC1	1116394920	SOLJMXZBVJGWLK-UHFFFAOYSA-N	447.542	1.819	50	20	IDGD	
O=C(NCc1ccc(C(=O)N2CCOCC2)cc1)NNC(=O)c1cncn1-c1ccccc1	1320275478	FKEPGJGLRIDMPB-UHFFFAOYSA-N	448.483	1.489	50	20	IDGD	
O=C(NNC(=O)c1n[nH]c2c1CCCC2)c1cc(=O)c2cc(Br)ccc2[nH]1	1322770016	AOLQICJPORRAMV-UHFFFAOYSA-N	430.262	1.967	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)c2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1	1347440253	AIEQRKJAEQWJCG-INIZCTEOSA-N	445.545	1.396	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(-n3cnnc3)cc1)C2)[C@@H](F)Cl	1778022384	GMSVSCQVSNUOBA-MBOZVWFJSA-N	435.887	1.929	50	20	IDGD	
Cc1nc[nH]c1CSCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Cl)C1	1778030001	JXOVWBHBGHPYEE-UWWQBHOKSA-N	432.949	2.000	50	20	IDGD	
COc1cc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)ccn1	1779555063	CGMQMPIMNZKROX-UGSOOPFHSA-N	426.311	1.565	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(C(C)(C)C)n[nH]3)C2)C1	1779574448	FLTQTBYADXFTGU-SGTLLEGYSA-N	427.343	1.934	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3[nH]cnc3-c3cccnc3)C2)C1	1780057074	KVZSUIMRKKUFBR-BFUOFWGJSA-N	448.321	1.699	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1n[nH]cc1[N+](=O)[O-])C2)[C@H](F)Br	1780774977	SBKMELYJYWOYCH-IFUGULHKSA-N	448.249	1.136	50	20	IDGD	
NCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](Br)Cc2ccccc2)C1	1781684652	XVAIDNFGFPLGHZ-SQGPQFPESA-N	438.366	1.465	50	20	IDGD	
Cc1cc(CC(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](F)Br)C3)no1	1782464373	RUJYUZOKYJZIMP-UKPHBRMFSA-N	432.290	1.730	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@]2(C1)CN(C(=O)c1cnc[nH]1)CCO2	1782864409	VQHFJXRAUPQZDR-LFEYGZQNSA-N	427.411	1.739	50	20	IDGD	
CCOC(=O)C1(C(=O)N2CC[C@]3(CN(C(=O)[C@H](C)CBr)CCO3)C2)CC1	1782913120	QWWIWPDFFOQDOY-DYVFJYSZSA-N	431.327	1.191	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)Cc3ccccc3O)C2)C1	1783239491	FUFOQEQWJDAMOM-BEFAXECRSA-N	425.323	1.938	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](C)Nc1ccccn1)CCO2	1783349227	KEJWSLFNAZEUKK-ZRGWGRIASA-N	439.354	1.885	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)CNC(=O)OC(C)(C)C)CCO2)C1	1783538424	CQXZNOFDKFYMMK-PXAZEXFGSA-N	434.331	1.124	50	20	IDGD	
CC(C)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=N/O[C@@H]3CCCCO3)C[C@@H]21	1783851545	CNPXOXSYSMTTGH-GONAQHPDSA-N	429.945	1.760	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3C[C@]3(F)Cl)C[C@@H]21	1783974131	JHISRZYQLFIDQD-WUMBASQESA-N	425.726	1.922	50	20	IDGD	
Cc1ccc2nc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]4C3)sc2c1	1784087030	VNPYGDGSQQAQIG-SDADXPQNSA-N	437.949	1.798	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(CCN(C(=O)[C@H](O)c3ccccc3Cl)C2)C1	1784252555	IEHTZKHJCZGBIB-SJLPKXTDSA-N	445.741	1.988	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCN3CCCCC3)[C@H]2C1	1786577365	LYZYGQWFBKMWMY-FHWLQOOXSA-N	425.646	1.694	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)c1[nH]nc2ncccc12	1787342988	DHTCRXLOOCTGQE-UBHSHLNASA-N	436.310	1.336	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4c(n3)OCCO4)[C@H]2C1	1787380870	WGZRHMKKNJKGNM-ZQIUZPCESA-N	437.924	1.711	50	20	IDGD	
COC(=O)Nc1cccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]3C2)c1	1787448594	AWSBMKKGRPEVPI-QCEMKRCNSA-N	427.860	1.993	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC1(c2ccc(NC(=O)CC[C@@H](N)C(N)=O)cc2)CCC1	1788059920	BPIZHHJSLHESBD-KDOFPFPSSA-N	429.348	1.950	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccn4cncc34)[C@H]2C1	1788423772	FDRXAMWSAPFYSJ-HPZZRFSDSA-N	435.322	1.711	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(Cl)ncn3)[C@H]2C1	1789059459	HTPCEPDLTCIQHS-ZPFDUUQYSA-N	431.718	1.507	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3ccc(OC)cc3C#N)[C@H]2C1	1789843440	KYDLTPFVTTXNEY-KNTRFNDTSA-N	449.935	1.343	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4n(n3)CCC4)C[C@@H]21	1789868172	PRMULJQXSSVGRB-BCRCDCHUSA-N	429.348	1.659	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3[nH]cc4c3CCC4)C[C@@H]21)[C@@H](F)Br	1789924795	WWSKCZBRKJJIEX-ATVPRXPUSA-N	428.302	1.787	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4[nH]ccc4n3)C[C@@H]21	1791056345	UXAUGRAJWFMJLY-XREXNNHRSA-N	435.322	1.940	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1cncnc1)C2	1792867615	HYUJQXNPUAOLIM-JJAZEVLHSA-N	425.327	1.030	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(Cl)ccn1)C2	1792871349	VWINRHFLZUPGNY-OHTBPHCPSA-N	430.730	1.969	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CNC(=O)OC(C)(C)C	1793006086	CAMXNPNESFPAOC-XFIYOXNOSA-N	431.961	1.918	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](CO)NC(=O)OC(C)(C)C)C2	1793681231	ILAHTWSMZMBQRM-QRJUGERDSA-N	431.961	1.918	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CC1CC1	1795340070	FJYMLGKEELTUQL-IVSAIRAKSA-N	429.945	1.508	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1cccc2c1OCC2	1796796391	XXFSHQXABILVBX-LMWOUKEDSA-N	427.270	1.515	50	20	IDGD	
O=C([C@@H](O)CCl)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1(c2cccc(Cl)c2)CC1	1797113904	XAFKULHAMHOBLO-RMHZUWNSSA-N	427.328	1.561	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCNc1ccc(C)cc1C	1797827718	XXODQWJJXGFYBT-BMQTXXJKSA-N	437.968	1.949	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)Cn1cccn1)C2	1800640302	QEKKCHCJOBSLJO-IBEHDNSVSA-N	427.343	1.282	50	20	IDGD	
COc1cccc(/C=C/C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Br)C3)c1	1800685291	BPLNHJLZRIXVCT-KLHHMNKOSA-N	441.297	1.989	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COCc1ccccc1)C2	1800755992	CULJTYAWOTWWNF-SCNOPHJPSA-N	425.323	1.576	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(Cl)nc3n[nH]cc13)C2	1800975021	IHFRQWABFVBVQK-FJHTZYQYSA-N	442.303	1.068	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc2nscc12)c1cccc(B(O)O)c1	1801071427	YCDDHOGJRCTREN-BJWYYQGGSA-N	435.314	1.542	50	20	IDGD	
CC(C)(CCl)C(=O)NC[C@@H]1CCN(C(=O)[C@H](O)N2CCOCC2)[C@@H]1c1cccnc1	1802901521	SVOZJNYRQCCKJE-KSZLIROESA-N	438.956	1.003	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@H]1CCN(C(=O)CCC(N)=O)[C@@H]1c1cccnc1	1803014895	HIYNIJPHFIDHLE-SUYBPPKGSA-N	425.327	1.384	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)[C@@H]2CNC(=O)O2)[C@H]1c1cccnc1	1803649592	DCGMZGOJESMSCL-ZQDZILKHSA-N	439.310	1.369	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)[C@@H]1COc2ccccc2O1	1804195873	JGMZWRQOGPYNJG-JSJNYSNDSA-N	445.903	1.527	50	20	IDGD	
O=C(Cc1cccc(Cl)n1)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1	1804698250	DTIFMKLLTXZFIB-GMBSWORKSA-N	437.327	1.978	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC2(CCN(C(=O)[C@H]3CCCS3(=O)=O)CC2)C1	1805388910	IRAGCUMFPLSYDD-LSDHHAIUSA-N	449.411	1.826	50	20	IDGD	
Cc1cc(C(=O)NC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)no1	1805837405	NXGGJFJFPXKZRZ-HNAYVOBHSA-N	449.471	1.010	50	20	IDGD	
Cc1ccc(C(=O)NC[C@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)nc1	1805874094	YVKLLXSJJZGMTA-GCJKJVERSA-N	438.532	1.478	50	20	IDGD	
COc1nccnc1C(=O)N1CC[C@@H](CNC(=O)CCBr)[C@H]1c1cccnc1	1806339451	LZLIUMUPUBZPEO-WMLDXEAASA-N	448.321	1.985	50	20	IDGD	
Cc1cc(C(=O)NCC(=O)N2CC[C@H](CNC(=O)[C@H](F)Cl)[C@H]2c2cccnc2)no1	1808313631	IZNMNRXMDPUFFC-XYPHTWIQSA-N	437.859	1.348	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)[C@H]3CNc4ccccc43)CC2)C1	1809976542	CEAZPAMPUHLXFK-NRFANRHFSA-N	447.344	1.421	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)NC[C@H]1CCN(C(=O)C(O)O)[C@H]1c1cccnc1	1812440584	LZJQFIGHRXOPHR-YAEMXKGMSA-N	442.422	1.283	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)N1CC[C@H](CNC(=O)[C@H](Cl)COC)[C@H]1c1cccnc1	1813034785	XSSSAWICLCJYKK-MWQQHZPXSA-N	441.912	1.903	50	20	IDGD	
O=C1C[C@H](C(=O)NC[C@H]2CCN(C(=O)CCBr)[C@H]2c2cccnc2)CCN1	1813133737	OAOWDRSXEJJGBC-SIIHOXLZSA-N	437.338	1.399	50	20	IDGD	
Cc1ccnc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)c1	1815354603	LIRTUNMPTWNWHE-HNNXBMFYSA-N	436.302	1.066	50	20	IDGD	
Cc1ccc(C)c(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)c1	1815361966	WMPSZYLJAQSVEN-QGZVFWFLSA-N	449.341	1.979	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CN2CCOCC2)n[nH]1	1817144193	GBOVUGGGVHLRBZ-ZFWWWQNUSA-N	442.358	1.765	50	20	IDGD	
O=C(CCN1CCOCC1)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](F)Br)[nH]n1	1817181121	MALRQBIIMZXTSQ-BBRMVZONSA-N	446.321	1.815	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CO[Si](C)(C)C)[nH]n1	1819353162	MDMZARDOQVLJED-HIFRSBDPSA-N	438.605	1.961	50	20	IDGD	
CC(C)(C)OCC(=O)N[C@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1	1819793541	PPRFQDLQSZBNHH-NSHDSACASA-N	446.533	1.183	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1ccc(F)cc1	1820555241	UHDDSMALHTUFEX-IBGZPJMESA-N	436.252	1.848	50	20	IDGD	
Cc1cnn([C@H](C)C(=O)N2CCCC[C@@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)c1	1822416557	HSFSGRZWBNMBJT-NVXWUHKLSA-N	444.540	1.541	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)C2CC(F)(F)C2)CC1	1823853525	FMPXZWYBZDUOTK-IBGZPJMESA-N	434.292	1.645	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H](O)CCl)CC1	1824186035	NTIALDLKPFQDLM-CVEARBPZSA-N	431.961	1.731	50	20	IDGD	
Cc1cccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)n1	1825849742	YSLQXXMJVPYCBG-JOCHJYFZSA-N	435.333	1.617	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](OC(C)=O)C(C)C)CC2	1825999662	BTTOPAVSDNMFGT-XUJVJEKNSA-N	431.942	1.897	50	20	IDGD	
Cc1cncc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)c1	1826002952	HFNDVUIILOERQP-QFIPXVFZSA-N	435.333	1.617	50	20	IDGD	
CSCC[C@H](O)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](C)Br)CC2	1826136151	VPOLQBSAOUPSNP-YWVKMMECSA-N	436.397	1.953	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)c2ccncc2F)CC1	1827953123	ZVMFXNIAZMKBGH-OAQYLSRUSA-N	439.296	1.448	50	20	IDGD	
COCC(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)[C@@H](F)Cl)C2)C1	1828860712	AFDWOCYGZUZPRL-YLJYHZDGSA-N	441.887	1.619	50	20	IDGD	
C#CC(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1829267543	UBRJAJJUVADDIL-HXUWFJFHSA-N	438.311	1.875	50	20	IDGD	
O=C(COc1cccc(Cl)c1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1830278522	DCTCHLYRORNXRR-FUHWJXTLSA-N	435.279	1.710	50	20	IDGD	
CN1CCN(CC(=O)N2CCC([C@@H]3CCCCN3C(=O)[C@H](F)Br)CC2)CC1	1830378437	NMYQDOVSIHKUDI-WMZOPIPTSA-N	447.393	1.544	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(O)c(OC)c3)C2)C1	1831654038	HWNHUSIFKPTRRH-HRAATJIYSA-N	440.924	1.878	50	20	IDGD	
O=C([C@@H](F)c1ccccc1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1832224586	AKDRNMHIWZDZJJ-MPGHIAIKSA-N	447.276	1.844	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3cc(F)ccn3)CCO2)C1	1832845439	WMGUQENDJUTCAI-NRFANRHFSA-N	441.931	1.875	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cnc4ccccn34)CC2)CC1)[C@@H](O)CCl	1833310231	MJWLCYKQLFTRKT-SFHVURJKSA-N	433.940	1.119	50	20	IDGD	
Cc1c(C(=O)NC2CCN(C3CCN(C(=O)[C@H](C)Br)CC3)CC2)cnn1C	1834281233	ZMHBLHUZQWEHQW-ZDUSSCGKSA-N	440.386	1.697	50	20	IDGD	
O=C(CCBr)NC1CCN(C2CCN(C(=O)Cc3ncccn3)CC2)CC1	1834422294	CTIMDLWSHIVPEV-UHFFFAOYSA-N	438.370	1.376	50	20	IDGD	
C[C@@H](Nc1cccnc1)C(=O)NC1CCN(C2CCN(C(=O)[C@H](F)Cl)CC2)CC1	1834719279	HTTXSIFRJWRZSM-KDOFPFPSSA-N	425.936	1.988	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)CC3CCOCC3)C2)C1	1834822544	ULSCRYJKOGNMMB-SFHVURJKSA-N	433.343	1.045	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)c3ccc(O)cc3)C2)C1	1834823675	BQYFDFMREOXXTR-GOSISDBHSA-N	427.295	1.247	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)CCBr)CCO2)C1	1834823970	OZSZMBGJMTYQIS-CABCVRRESA-N	446.169	1.464	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)C#Cc3ccccc3)CCO2)C1	1835096900	NXBASIIXJORIKV-DYESRHJHSA-N	449.345	1.526	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)[C@H]3C[C@@H](O)C3)CC2)CC1	1835441875	UZRNBIUUCSPRIA-CPUCHLNUSA-N	430.387	1.360	50	20	IDGD	
Nc1ccccc1/C=C/C(=O)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1835781545	QTYUYTOENSTWEQ-ZMBJWTFHSA-N	428.316	1.542	50	20	IDGD	
CN1CCC[C@H](C(=O)NC2CCN(C3CCN(C(=O)CCBr)CC3)CC2)C1	1836351990	XIZQZKDBPNOPEB-INIZCTEOSA-N	443.430	1.685	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)CCC3CCC3)CC2)CC1	1836798499	IESNDANZNFMTHG-UHFFFAOYSA-N	436.597	1.938	50	20	IDGD	
CCC(=O)N[C@@H](C)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](Cl)COC)CC2)CC1	1836818610	QRNYIGBQTGIKDL-YOEHRIQHSA-N	431.961	1.154	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)Cn3ccnn3)CC2)CC1	1837981808	WTGLBGMWILXLLG-ZDUSSCGKSA-N	428.331	1.060	50	20	IDGD	
O=C(c1ccncn1)N1CCC(OC2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1838116919	QODLTCOTNYMZMX-OAHLLOKOSA-N	429.290	1.779	50	20	IDGD	
COc1cccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)c1	1838929080	XPVTYNUMCCBGGP-CRAIPNDOSA-N	445.285	1.456	50	20	IDGD	
Cc1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCBr)C3)C2)c1	1838939061	ZDFYFYBEFQVCMJ-LJQANCHMSA-N	425.323	1.850	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3c(F)cccc3F)CCO2)C1	1838996604	VUDHESUZYPCTEE-YWZLYKJASA-N	446.878	1.218	50	20	IDGD	
O=C(Cc1ccccc1O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839202874	RVHUUYZCVLEVKB-WMZOPIPTSA-N	445.285	1.082	50	20	IDGD	
CC(C)=NO[C@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1	1839226336	LTGCUUZVVOKZOH-FHLIZLRMSA-N	438.352	1.480	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc4ccoc4c3)CCO2)C1	1839536813	ADODQIFIJGOELC-LAUBAEHRSA-N	436.892	1.757	50	20	IDGD	
C[C@@H](Cc1ccncc1)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1839661484	ZBQOPKHCNDMWPL-LIRRHRJNSA-N	430.332	1.520	50	20	IDGD	
C/C=C/C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)C1	1839812608	JBICQYJAGVCWOU-KJDRQLFNSA-N	445.944	1.151	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)COC(C)(C)C)C2)C1	1839962464	FYNFWGPQPBCWMX-RDTXWAMCSA-N	435.359	1.431	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3C[C@@]3(F)Cl)C2)C1	1839966542	IKKWXRFWMNQUFZ-KNPMLCFXSA-N	441.725	1.541	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)/C=C/C3CCCC3)C2)C1	1840034343	INJDLYRLXKDASL-PTNUPGPXSA-N	429.355	1.973	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)Nc3ccccc3)C2)C1	1840153682	XRAXPORQZBUKAQ-HGHGUNKESA-N	439.940	1.197	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CC[C@H](O)CC1)CCO2	1840268945	GWKWGZUMURFQSP-NNFUDEMPSA-N	447.370	1.025	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@]1(C)CC=CCC1)CCO2	1840557873	GEUITGROEGDJKI-SNRMKQJTSA-N	429.355	1.973	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CCCN1C(C)C)CCO2	1840581497	DFIONFCQQGEHID-WFXMLNOXSA-N	429.989	1.723	50	20	IDGD	
O=C(c1cn2ccc(C(F)(F)F)cc2n1)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1	1841353113	DEVVKFZXFQDVFZ-ZDUSSCGKSA-N	430.814	1.770	50	20	IDGD	
C[C@@H]1[C@H](C(=O)N2CC3(CCCN3C(=O)[C@H](O)CCl)C2)CCN1C(=O)OC(C)(C)C	1841354502	FBJHAIQTBUGLIJ-RBSFLKMASA-N	429.945	1.435	50	20	IDGD	
COc1ccccc1CCC(=O)N1CCCC12CN(C(=O)c1cnccc1C(=O)NN)C2	1841472882	UBWTUHLFAFTDIQ-UHFFFAOYSA-N	437.500	1.144	50	20	IDGD	
CC(=O)C(C)(C)C(=O)N1CC2(CCCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C1	1841923959	ILBLAQZZGYELRJ-AWEZNQCLSA-N	429.945	1.937	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)Cc1nc(C)sc1C)C2	1843415655	XAWIEZARWOOVJE-ZMOGYAJESA-N	442.545	1.640	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1scnc1C1CC1)C2	1843415663	YBUIKVGSDSRZOR-ZMOGYAJESA-N	440.529	1.972	50	20	IDGD	
COc1cc(C#N)cc(C(=O)N2CCCC23CN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C3)c1	1844726047	MIIADYRALAPADT-CVKSISIWSA-N	448.483	1.518	50	20	IDGD	
CC/C=C(\C)C(=O)N1CC2(CCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)C1	1845039480	SLFIVAJZKZRVCU-GIJQJNRQSA-N	427.549	1.892	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@](F)(C(=O)N2CCCC23CN(C(=O)[C@H](O)CCl)C3)C1	1846124181	WBEYGWMDUBNONI-VLIAUNLRSA-N	447.935	1.529	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)c1cc(OC)c(O)cc1[N+](=O)[O-])C2	1846362949	GPVCTIGHLGRNEW-GFCCVEGCSA-N	427.841	1.380	50	20	IDGD	
CCOC(=O)N(CC(=O)N1CC2(CCCN2C(=O)[C@H](Cl)COC)C1)Cc1ccco1	1846365180	DJIXPLNYZBGFDU-MRXNPFEDSA-N	441.912	1.695	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC2(CCCN2C(=O)CCn2ccnn2)C1	1846623893	KEXDJDQJCBRBDU-MHWRWJLKSA-N	426.427	1.757	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H]1CCC[C@@H](C(=O)N2CCCC23CN(C(=O)[C@H](O)CCl)C3)C1	1846931741	GWBYXPKVHKHQHA-OWCLPIDISA-N	443.972	1.873	50	20	IDGD	
CC(C)(C)OC(=O)N1CCCC[C@H](C(=O)N2CCCC23CN(C(=O)[C@@H](O)CCl)C3)C1	1847159599	KAEYHEANMKFHSP-HOTGVXAUSA-N	443.972	1.827	50	20	IDGD	
COc1ccc([C@H](C)C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2cnccc2C(=O)NN)cc1	1847466115	DJAGLRSDAAOLOZ-GKCIPKSASA-N	437.500	1.313	50	20	IDGD	
C[C@H](SCC(=O)Nc1ccc(F)cc1)C(=O)NNC(=O)COc1ccc(C#N)cc1	15888765	ORNTVUULGKMURD-ZDUSSCGKSA-N	430.461	1.984	50	20	IDGD	
Cc1c([C@H](C)NC(=O)NNC(=O)CNC(=O)c2ccco2)cnn1-c1ccc(F)cc1	725871836	HLIPNDUWNTXXPZ-LBPRGKRZSA-N	428.424	1.734	50	20	IDGD	
CCOc1cc2c(cc1CNC(=O)NNC(=O)CNC(=O)c1cccs1)O[C@@H](C)C2	725873229	VBNCUSUGLPYJKP-LBPRGKRZSA-N	432.502	1.731	50	20	IDGD	
O=C(CCCCCc1ccc(I)cc1)NNC(=O)C(=O)NC1CC1	726768107	LFYMSVHIGCDOHZ-UHFFFAOYSA-N	443.285	1.820	50	20	IDGD	
Cc1nn(C)c2ncc(S(=O)(=O)NNC(=O)c3cc(F)ccc3Br)cc12	728509823	PBQSUILPGHHOKB-UHFFFAOYSA-N	442.270	1.802	50	20	IDGD	
CC(=NNC(=O)Cc1cccnc1)c1ccc(S(=O)(=O)N(C)CCCC(=O)O)cc1	728785249	AXBJDMJYVAHVEW-UHFFFAOYSA-N	432.502	1.650	50	20	IDGD	
C[C@@H](CC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)S(=O)(=O)c1ccc(F)cc1	729299746	FPZPQGSAUHATNK-LBPRGKRZSA-N	446.460	1.086	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CCCCC(=O)NNC(=O)c2cccc(C#N)c2)c1	729831165	VLFKTUPWKDHPCY-UHFFFAOYSA-N	432.440	1.213	50	20	IDGD	
CS(=O)(=O)c1cc(C(=O)NNC(=O)CCc2ccccc2O)ccc1Br	730033252	XRALFNVKDGXELD-UHFFFAOYSA-N	441.303	1.952	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)N1CCN(S(=O)(=O)c2ccc(C(C)C)cc2)CC1	731849293	ZLLRQRWVUVJQFT-KRWDZBQOSA-N	438.594	1.698	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)CCNC(=O)N1CCc2ccccc2C1	731865243	LUUQELLZZNRCAD-HNNXBMFYSA-N	428.464	1.898	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1)NNC(=O)C1CCC1	732144277	QVVJWDWVOSJXAT-UHFFFAOYSA-N	427.832	1.975	50	20	IDGD	
Cn1c(NNC(=O)CSCc2cc(=O)n3ccsc3n2)nc2ccccc2c1=O	733263469	CYYMSPYWFGXMFU-UHFFFAOYSA-N	428.499	1.379	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)c1n[nH]c(C2CC2)c1Br	734241268	LPPDWDNUTQNKRE-UHFFFAOYSA-N	431.291	1.518	50	20	IDGD	
CC[C@H](Nc1ccccc1)C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	735117466	UMYBIMUBOPEJEQ-KRWDZBQOSA-N	432.550	1.352	50	20	IDGD	
Cc1cccc([C@H](C)C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c1	739471718	MCVYHXOSRDBIAZ-INIZCTEOSA-N	431.514	1.581	50	20	IDGD	
O=C(NNC(=O)c1cn(-c2cccc(C(F)(F)F)c2)nn1)c1ccc(-n2cnnn2)cc1	739680554	PITGTAINBMEWPO-UHFFFAOYSA-N	443.349	1.337	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NC(=O)NNC(=O)COc1ccccc1O	740454155	OSDRDHMCGRBRAZ-UHFFFAOYSA-N	436.490	1.701	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)N[C@@H](C)[C@H]1CN(Cc2ccccc2)CCO1	741266395	JWURUGIQZWIPNP-LAUBAEHRSA-N	442.516	1.694	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)COc1ccc(C#N)cc1)[C@@H]1CN(Cc2ccccc2)CCO1	741431584	HNUQMQUZSAMPQI-UTKZUKDTSA-N	437.500	1.557	50	20	IDGD	
CC(=O)Nc1cc(F)c(S(=O)(=O)NNC(=O)c2ccc3c(c2)OCO3)c(F)c1Cl	741645811	CQOHBHOLILAQKM-UHFFFAOYSA-N	447.803	1.929	50	20	IDGD	
C[C@H](CC(=O)NNC(=O)C(C)(C)c1ccccc1)/N=C1/NS(=O)(=O)c2ccccc21	742656638	DAOQXSKRVKYHFP-CQSZACIVSA-N	428.514	1.629	50	20	IDGD	
COc1cc(C(=O)NNc2ccccc2S(C)(=O)=O)cc(NS(C)(=O)=O)c1OC	743368812	RTFCORUBROPQKG-UHFFFAOYSA-N	443.503	1.236	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(C(=O)NNc2ncnc3[nH]cnc23)cc1Br	743471570	OXQCXPODNNCMLM-UHFFFAOYSA-N	440.283	1.123	50	20	IDGD	
C[C@]12CCC(=O)N1c1ccccc1C(=O)N2CC(=O)NNC(=O)NCCc1cccs1	746591647	JGDMFANDGAMVNB-OAQYLSRUSA-N	441.513	1.620	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@@H]2C(=O)NNC(=O)CCOc2ccccc2)s1	747179487	ZFTSUAOWZRXOMG-MRXNPFEDSA-N	437.543	1.826	50	20	IDGD	
COC(=O)/C=C\c1ccc(S(=O)(=O)NNC(=O)c2nnc(-c3ccccc3)o2)cc1	747607761	CUZFGOJHUUGWGQ-XFXZXTDPSA-N	428.426	1.546	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)NCC2CCN(S(C)(=O)=O)CC2)c1C	749016690	BODCCUBKRNFGFY-OAHLLOKOSA-N	426.539	1.073	50	20	IDGD	
Cc1nn(-c2ccccc2)c2sc(C(=O)NN=Cc3c(N)n(C)c(=O)n(C)c3=O)cc12	749807927	QOSUXXJHYSRVFG-UHFFFAOYSA-N	437.485	1.139	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCCOc1ccccc1Cl	752126860	LXBDLRZLCYLCNP-UHFFFAOYSA-N	439.925	1.965	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)[C@H]1CCC[C@H](C(=O)NNC(=O)c2ncccc2C)C1	752241253	ALBVSKSRJRFBNN-HOTGVXAUSA-N	438.488	1.122	50	20	IDGD	
CON(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(C)nc3ccccc23)c1	753114849	IDYSJXMJSKMIFP-UHFFFAOYSA-N	428.470	1.800	50	20	IDGD	
C[C@@H]1C[C@@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)CN1C1CC1	753942868	IDFNUQCJHGMNNF-NVXWUHKLSA-N	449.577	1.430	50	20	IDGD	
C[C@H](C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1)c1ccc([N+](=O)[O-])cc1F	754846797	ULQCHEZMYNTNJI-QMMMGPOBSA-N	444.828	1.599	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2cccs2)n(-c2ccccc2)n1)N[C@H]1CCS(=O)(=O)C1	755229272	BCBICHVGMXCMFQ-ZDUSSCGKSA-N	445.526	1.732	50	20	IDGD	
COc1ccc([N+](=O)[O-])cc1NC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	755320111	BWNREDGHPZASLT-UHFFFAOYSA-N	442.476	1.968	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc(OC)c1OC	755347490	FNCIEEBICSDMEK-UHFFFAOYSA-N	427.417	1.426	50	20	IDGD	
COC(=O)CCNC(=O)c1ccc(NC(=O)NNC(=O)c2ccc3ccccc3n2)cc1	755603148	IMSFDPGOOQYVHT-UHFFFAOYSA-N	435.440	1.994	50	20	IDGD	
CCOC(=O)Nc1ccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1	755831229	YXZQQTOLWHVXSM-UHFFFAOYSA-N	449.489	1.972	50	20	IDGD	
O=C(COC(=O)[C@@H](O)c1cc(Cl)cc(Cl)c1)NNC(=O)c1cccc([N+](=O)[O-])c1	756744028	AMBUXHBTYBIINU-HNNXBMFYSA-N	442.211	1.939	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2ccc3c(c2)N(C)CCO3)cc1	756851281	SFMUQKCQJFLBQY-UHFFFAOYSA-N	447.517	1.297	50	20	IDGD	
O=C(Cc1c[nH]c2ncccc12)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	756900998	FULVUFPNDCWSED-UHFFFAOYSA-N	427.486	1.351	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)Nc2ccc(C(=O)NC3CCOCC3)cc2)c1O	757622585	XJVJQMYJRQBMOV-UHFFFAOYSA-N	428.445	1.776	50	20	IDGD	
Cc1nn(C)c(C)c1OCC(=O)NNC(=O)[C@H](C)Oc1cccc(Br)c1	758372831	VAQDTHATDIMUDJ-LBPRGKRZSA-N	425.283	1.793	50	20	IDGD	
O=C(c1ccc(OC2CCOCC2)cc1)N1CCN(S(=O)(=O)CBr)CC1	758526359	CETAKRSZDOCISP-UHFFFAOYSA-N	447.351	1.684	50	20	IDGD	
CS(=O)(=O)c1ccc(CNC(=O)NNC(=O)CNC(=O)c2cccs2)cc1Cl	758958193	SOVYBILZWMUJHR-UHFFFAOYSA-N	444.922	1.065	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2ccc(C(=O)NNc3ncccc3[N+](=O)[O-])cc2)C[C@@H](C)O1	759298316	WXBBTECBIDZAHZ-BETUJISGSA-N	435.462	1.545	50	20	IDGD	
Cc1cc(O)cc(=O)n1CC(=O)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1	759770428	YEXBEDILAXEASS-QFIPXVFZSA-N	446.507	1.637	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)c2cnn(CCO[C@@H]3CCCCO3)c2C)cn1	759781857	MHTCAQMSDMCDHI-QGZVFWFLSA-N	434.522	1.770	50	20	IDGD	
O=C(N=c1cc[nH]cc1I)NNC(=O)[C@@H]1COc2ccccc2O1	760028379	HZIOYAMOOJZHPK-ZDUSSCGKSA-N	440.197	1.101	50	20	IDGD	
COc1ccc2c(c1)OC[C@H]2CC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	760222727	BBGAGHPBAHBMSP-GOSISDBHSA-N	438.528	1.921	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)N(C)CC3)cc(OC)c1OC	763539577	NNLIPZIQJQWWHN-UHFFFAOYSA-N	428.445	1.104	50	20	IDGD	
CCOC(=O)c1cc(C)sc1NC(=O)C(=O)NNC(=O)[C@H]1COc2ccccc2O1	763573590	TWGYDGAVMNEQAK-CQSZACIVSA-N	433.442	1.159	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(N3CCN(C)CC3)c(Cl)c2)c(C)o1	763587355	VMAZQCGEOJAFIC-UHFFFAOYSA-N	433.896	1.701	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(C)c(OCC(F)F)c2)cc1	763662375	YATRUYIXCXBRRK-UHFFFAOYSA-N	437.399	1.812	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccccc1O[C@@H](C)C#N	763679588	AOYGBFMFCDXWJV-AWEZNQCLSA-N	426.429	1.541	50	20	IDGD	
CC(=O)Nc1cc(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)ccc1Cl	763682301	USVWGHFIJPXVBS-UHFFFAOYSA-N	429.820	1.335	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(C)c(C(=O)N(C)C)c1	763683161	VCELSTCXWGNOOF-UHFFFAOYSA-N	442.472	1.260	50	20	IDGD	
O=C(CSc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1ccc(NC(=O)C2CC2)nc1	763732991	GCDJXPZJZFRAOM-UHFFFAOYSA-N	447.904	1.962	50	20	IDGD	
CCn1nnnc1-c1cccc(NC(=O)C(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)c1	763733879	HMZXDRFZGASKJG-UHFFFAOYSA-N	437.504	1.662	50	20	IDGD	
CCOC(=O)c1cn(C)nc1NC(=O)C(=O)NNC(=O)CC12CC3CC(CC(C3)C1)C2	763739105	ZOQASKKGLZXDDQ-UHFFFAOYSA-N	431.493	1.289	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(NC(=O)[C@@H]3CCCO3)cc2)c1	763754501	SXSGVXPKXUPAOL-SFHVURJKSA-N	439.472	1.270	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)COc1ccc(C(=O)c2ccccc2)cc1	763813351	HEJGAFOMIXSRPX-UHFFFAOYSA-N	432.436	1.269	50	20	IDGD	
Cc1cc(-c2noc(CCC(=O)NNC(=O)CNC(=O)c3cccnc3)n2)ccc1F	763814307	NHRKODHDGAGOLY-UHFFFAOYSA-N	426.408	1.089	50	20	IDGD	
CCc1nc(C(=O)NNC(=O)CNC(=O)c2cccnc2)nn1-c1ccccc1Cl	763823276	FFAIBWDOIVEPQY-UHFFFAOYSA-N	427.852	1.069	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)cc1	763877791	VIIGGSMCJOJPNI-UHFFFAOYSA-N	434.368	1.270	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3cnn(Cc4ccccn4)c3)cc2C1	763942577	NXZJPSQJNRRLHO-CYBMUJFWSA-N	438.513	1.912	50	20	IDGD	
Cc1nnc(-c2ccc(NC(=O)C(=O)NNC(=O)C3=S=C4CC[C@@H](C)CC4=C3)cc2)o1	763947303	AYLQAJHQUZJVJP-LLVKDONJSA-N	439.497	1.969	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)C(C)C)cc1NC(=O)C(=O)NNC(=O)c1ccccc1C	763961377	FJTHDFDRBINAEL-UHFFFAOYSA-N	446.529	1.732	50	20	IDGD	
CCCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)cc1	763997247	ZQUBVXFVRMZCRV-UHFFFAOYSA-N	436.266	1.317	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2c(F)cc(Br)cc2F)c1O	764132420	VWCIFYOOBRXDSM-UHFFFAOYSA-N	444.188	1.841	50	20	IDGD	
C[C@H]1C[C@H](C)CN(S(=O)(=O)c2ccc(NC(=O)C(=O)NNC(=O)CC3CC3)cc2)C1	764141562	BSZRQCXLEYBZKT-KBPBESRZSA-N	436.534	1.239	50	20	IDGD	
C[C@H](c1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)cc1)N1CCOCC1	764170140	ZKVMHRNXRKMWJN-QRWLVFNGSA-N	438.484	1.169	50	20	IDGD	
CS(=O)(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)c1	764244196	CZUXGSYIPFFXBW-UHFFFAOYSA-N	448.888	1.484	50	20	IDGD	
O=C(NNC(=O)c1cccc2ncccc12)C(=O)Nc1ccccc1CN1CCOCC1	764252024	ABPOVFGDWIBXRI-UHFFFAOYSA-N	433.468	1.467	50	20	IDGD	
O=C(C/N=C1/NS(=O)(=O)c2ccccc21)NNc1c(F)cc(C(=O)NC2CC2)cc1F	764328313	AATAZJBPUMGMFX-UHFFFAOYSA-N	449.439	1.039	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)c1cc(O)nc2c(Br)cccc12	764345848	YYAIKVPYROGWRN-UHFFFAOYSA-N	444.245	1.289	50	20	IDGD	
COC(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)c1	764376800	HZFIMKLCGWRJLH-UHFFFAOYSA-N	447.860	1.978	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2cc(F)c(F)cc2F)n[nH]1	764378001	USKJUXUULXFSAO-UHFFFAOYSA-N	433.346	1.902	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2ccc(C(C)=O)c(C)c2)n[nH]1	764378283	XVGZLGQTLJRZML-UHFFFAOYSA-N	435.440	1.996	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cc(C#N)ccc3C)n[nH]2)cc1OC	764379077	PZWCJHPSAPTATC-UHFFFAOYSA-N	448.439	1.674	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cc(F)cc(F)c3)n[nH]2)cc1OC	764379495	ZNDZAHCCMGAGNS-UHFFFAOYSA-N	445.382	1.772	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)C(C)(C)Oc1ccc(C#N)cc1	764559493	RFPSKIIBJGBPPX-UHFFFAOYSA-N	429.502	1.778	50	20	IDGD	
CCCc1c(NC(=O)C(=O)NNC(=O)Cn2nc(C)cc2C)cnn1-c1ccc(C)cc1	764662789	LHOSJJDMJLONCG-UHFFFAOYSA-N	437.504	1.733	50	20	IDGD	
COC(=O)NNC(=O)C(=O)Nc1ccc(Br)c(I)c1	765374722	WYQLHLBFOKVOEJ-UHFFFAOYSA-N	442.007	1.379	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1S(C)(=O)=O	765533031	YYSXLUGJAYFTGR-UHFFFAOYSA-N	438.531	1.020	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1ccc2nc(N3CCOCC3)sc2c1	766272867	YHHOMJWBOFTOCF-UHFFFAOYSA-N	429.462	1.013	50	20	IDGD	
Cn1c(=O)nc(O)c2c(C(=O)NNc3ccccc3S(C)(=O)=O)cc(C3CC3)nc21	766670607	SLYJPDFHRARMEO-UHFFFAOYSA-N	429.458	1.072	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCOCC2)cc1C(=O)NNc1ncnc2ccsc12	766677027	VRVVLIFDIUURJD-UHFFFAOYSA-N	449.514	1.478	50	20	IDGD	
O=C(NCCNS(=O)(=O)Cc1ccon1)NNc1c(Cl)cc(F)cc1Cl	768090023	MDUBNKDKMXSRTE-UHFFFAOYSA-N	426.257	1.866	50	20	IDGD	
CC(C)n1ncc2c(C(=O)NNC(=O)C(C)(C)O)cc(-c3ccc4c(c3)OCCO4)nc21	768261817	PCDKSJUSUBVPNS-UHFFFAOYSA-N	439.472	1.982	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)[C@@H]3CC(=O)N(C4CCCC4)C3)n[nH]2)cc1OC	768275314	ALXMFGTZWCVITF-CQSZACIVSA-N	441.488	1.646	50	20	IDGD	
CCOc1ccc(NC(=S)NNC(=O)C/N=C2/NS(=O)(=O)c3ccccc32)cc1	768278626	IPPKKJIXJNQJHL-UHFFFAOYSA-N	433.515	1.142	50	20	IDGD	
COC(=O)c1[nH]c(C)c(C(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)c1C	769302491	PUWQPWKJNYHKJH-UHFFFAOYSA-N	441.532	1.305	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1cc(F)cc(Cl)c1O	769302597	PFYRTTAHRYBEPZ-UHFFFAOYSA-N	434.855	1.404	50	20	IDGD	
CCC[C@@](C)(O)C(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccc(OC)cc2)c1	770745668	FZDDYWZKVYLYHH-HXUWFJFHSA-N	435.502	1.808	50	20	IDGD	
COc1ccccc1[C@@]1(C)NC(=O)N(CC(=O)NNC(=O)NCCc2cccs2)C1=O	771249063	CYCVZUZOYVDZJK-HXUWFJFHSA-N	445.501	1.097	50	20	IDGD	
O=C(CCN1CCN(C(=O)[C@@H]2CCCO2)CC1)NNc1ccnc(Br)c1	771542551	YXKNAEBNQUKVPR-AWEZNQCLSA-N	426.315	1.001	50	20	IDGD	
O=C(C/N=C1/NS(=O)(=O)c2ccccc21)NNc1ccc(Br)c(F)c1	771688425	DPGXRSNOCMSHOO-UHFFFAOYSA-N	427.255	1.770	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)CCNS(=O)(=O)c1c(Cl)cccc1Cl	771940058	NDNVQYUIMOZTOY-SECBINFHSA-N	440.305	1.151	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2	772195078	IPJHDKBDDNJARV-UHFFFAOYSA-N	434.792	1.097	50	20	IDGD	
COC(=O)Cn1cc(C(C)=NNC(=O)Cc2nn3c(C4CCCCC4)nnc3s2)nn1	772836651	CFOGAZPWFRMXNN-UHFFFAOYSA-N	445.509	1.081	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)[C@H]1CCN(c2ccc(F)cc2)C1=O	772897774	LWVSMUKFJHCKPW-MRXNPFEDSA-N	432.839	1.296	50	20	IDGD	
CCN(CC)CCNC(=O)c1cccc(NC(=O)C(=O)NNc2nc(C)cc(C)n2)c1	773483979	YNCSADPGHHZNKJ-UHFFFAOYSA-N	427.509	1.247	50	20	IDGD	
CS(=O)(=O)Nc1ccc(OCCNC(=O)NNC(=O)c2c[nH]c3ccccc23)cc1	773778152	FJPRUYMRQPTIHW-UHFFFAOYSA-N	431.474	1.562	50	20	IDGD	
CCOC1CC(CNC(=O)NNC(=O)CSc2ccc(C)cc2)(N2CCOCC2)C1	775145736	JNPFQXUOEXQLPW-UHFFFAOYSA-N	436.578	1.687	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)[C@@](N)(c2ccccc2OC)C(F)(F)F)c1	776102432	LZTMMKKKWJBDIQ-SFHVURJKSA-N	427.379	1.890	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)N[C@H](C)CS(=O)(=O)c2ccc(C)cc2)c1	776191887	FGWGRAXLUBRABO-CQSZACIVSA-N	435.502	1.819	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)NCCS(=O)(=O)c2ccc(Cl)cc2)c1	776467413	WHQJJFPBOMOHOC-UHFFFAOYSA-N	431.923	1.844	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)NCc1cc(F)ccc1N1CCOCC1	778675108	VQANZMCBMJRGNO-UHFFFAOYSA-N	425.461	1.017	50	20	IDGD	
CCOc1ccc(/C=C(\C#N)C(=O)N2CCC[C@H](S(=O)(=O)N3CCOCC3)C2)cc1	779581871	CIEAIKBCYIOETO-GJPUVDBCSA-N	433.530	1.645	50	20	IDGD	
COc1cc(Br)c(F)cc1S(=O)(=O)NNC(=O)COc1ccccc1O	779891882	CRECFRAPHMFVPB-UHFFFAOYSA-N	449.254	1.691	50	20	IDGD	
CN(C)C(=O)CNC(=O)C(=O)NNC(=O)c1ccc(CSc2ccc(Cl)cc2)cc1	782701265	BJBMPQJPKKTKET-UHFFFAOYSA-N	448.932	1.598	50	20	IDGD	
Cc1ccnc(-c2ccc(NC(=O)C(=O)NNC(=O)Cc3nc4ccccc4n3C)cc2)n1	782888643	XNYPBNKPMKQKDX-UHFFFAOYSA-N	443.467	1.667	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)C(=O)Nc1cc(F)ccc1Cl	782897727	SRIGNBGJJAVUHA-UHFFFAOYSA-N	427.845	1.172	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)c(C)c1	782898032	XAHKBBDZVPZQLR-UHFFFAOYSA-N	433.490	1.005	50	20	IDGD	
Cc1cc(S(N)(=O)=O)cc(NC(=O)C(=O)NNc2ccc(Br)cc2)c1C	783009360	LTFORTQHZYERPB-UHFFFAOYSA-N	441.307	1.795	50	20	IDGD	
COC(=O)[C@@H](Cc1ccc(F)cc1)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1	783575225	VQTCBYDHUDQDAZ-GOSISDBHSA-N	437.493	1.160	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)cc(OC)c1	784210089	BUDSAAPEGCBFRY-UHFFFAOYSA-N	434.474	1.226	50	20	IDGD	
COC(=O)c1cc(Br)c(F)cc1NC(=O)C(=O)NNc1nccnc1Cl	784780938	UOZADCFKQMHVDF-UHFFFAOYSA-N	446.620	1.900	50	20	IDGD	
COc1ccc(S(=O)(=O)NC2CC2)cc1NC(=O)C(=O)NNc1ccc(Cl)nc1	784869808	MXFOXZSMZLTGGL-UHFFFAOYSA-N	439.881	1.266	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)COc2cccc(I)c2)c1O	784878411	GVSYFOJPENYBER-UHFFFAOYSA-N	442.209	1.845	50	20	IDGD	
CC(C)N(C)c1ccc(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)cc1F	785060293	HPVVDPIRHRJPMG-UHFFFAOYSA-N	426.452	1.647	50	20	IDGD	
N#C/C(=C/c1ccccc1)C(=O)OCC(=O)N1CCN(S(=O)(=O)c2ccccc2)CC1	785347831	HTAMVQDJOAJTGO-CYVLTUHYSA-N	439.493	1.670	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)N[C@@H]1CCCN(C2CCCCC2)C1=O	785569566	HADFRTUXUSRXRL-GOSISDBHSA-N	443.552	1.347	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCc2ccc(S(C)(=O)=O)s2)nc1	786882957	XQVYOHXSVXHUJJ-UHFFFAOYSA-N	447.564	1.060	50	20	IDGD	
CCOc1ccccc1[C@](N)(C(=O)NNc1nccc(N2CCOCC2)n1)C(F)(F)F	788001943	VNWDSGXFEVYUQD-SFHVURJKSA-N	440.426	1.572	50	20	IDGD	
COC(=O)c1ccc(S(=O)(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)c([N+](=O)[O-])c1	788496288	KSIVMXJYDIZUNS-YOEHRIQHSA-N	449.441	1.264	50	20	IDGD	
CCCCn1nc(C(=O)NN=C2CCCc3nc(O)c(C(N)=O)cc32)c2ccccc2c1=O	788976663	AGZACZAPMBHIOY-UHFFFAOYSA-N	448.483	1.867	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)[C@@H]1CC(c2cc(OC)ccc2OC)=NO1	791445835	SPVUYNVAGMFBCZ-FQEVSTJZSA-N	443.456	1.822	50	20	IDGD	
COc1ccc(OC)c(C2=NO[C@H](C(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)C2)c1	791512631	LKBNPXDGDZTCOE-SFHVURJKSA-N	447.469	1.062	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2cc(Cl)c(F)c(C(=O)OC)c2)n1	792293426	VVWHBQTWJUBAGH-UHFFFAOYSA-N	438.847	1.984	50	20	IDGD	
Cc1cccc(C(=O)NNS(=O)(=O)c2cc(S(C)(=O)=O)ccc2Br)n1	794600947	KCOGANSYHGTKSJ-UHFFFAOYSA-N	448.320	1.179	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccc(C(F)(F)F)cc2)c1)c1ccc(-n2cnnn2)cc1	794783000	AYVRBWQLYXUKJG-UHFFFAOYSA-N	442.361	1.942	50	20	IDGD	
CC(C)(C)OC(=O)N1CCOC[C@@H]1CC(=O)NNC(=O)c1cc(Br)c[nH]1	794823312	JBBBQJYHYPSUIU-NSHDSACASA-N	431.287	1.564	50	20	IDGD	
O=S(=O)(CBr)NCCNS(=O)(=O)c1cccc(Cl)c1Cl	796064771	YVTSHIGLDACUAR-UHFFFAOYSA-N	426.141	1.544	50	20	IDGD	
COc1ccccc1CCNC(=O)CNC(=O)NNC(=O)c1cc(Br)c[nH]1	798048942	ZFFCDZYFEGTKTR-UHFFFAOYSA-N	438.282	1.089	50	20	IDGD	
COc1ccccc1-n1ncc(C(=O)OCC(=O)NNC(=O)Cc2nc(C)cs2)c1C	798794161	OQDDKQQAHVWPNW-UHFFFAOYSA-N	443.485	1.501	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@@H](C)NC(=O)CCc1ccccc1	799408209	OTKHYBDPFSRNJI-OAHLLOKOSA-N	445.545	1.187	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NN=C(C)COC(C)C)N(S(C)(=O)=O)CC2	799872735	WNTHALKWTWKERD-QGZVFWFLSA-N	441.550	1.870	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)C(=O)Nc1ccc(F)cc1OCCC(F)(F)F	800623647	UBLKVKZIXYQXJL-UHFFFAOYSA-N	428.342	1.881	50	20	IDGD	
COc1ccc(Cn2cc(C(=O)NNC(=O)Nc3ccc(S(C)(=O)=O)cc3)cn2)cc1	802063952	ULWKJRCHSKMGJF-UHFFFAOYSA-N	443.485	1.810	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc2ccccc2c1)NNc1ccc(-n2ccnc2)nn1	804953952	DBPZJULXPQTXGE-UHFFFAOYSA-N	437.485	1.627	50	20	IDGD	
COC[C@@]1(C(=O)NNC(=O)c2c(C)nc3ccccn23)CCN(C(=O)OC(C)(C)C)C1	809984499	MCZMIXDNXRYVDT-OAQYLSRUSA-N	431.493	1.677	50	20	IDGD	
N#Cc1ncn(-c2ccccc2NC(=O)C(=O)NNC(=O)Cc2cccc3ccccc23)n1	810385009	UKOZBBOCHMMYDC-UHFFFAOYSA-N	439.435	1.621	50	20	IDGD	
C[C@@H]1Oc2ccccc2[C@@H]1NC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	812430049	FAWMKIHFBALFGC-IFXJQAMLSA-N	446.533	1.166	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)c2c[nH]n3c2nc(=O)c2ccccc23)cc1	812727289	POCXRTVUGSRPNL-UHFFFAOYSA-N	426.458	1.183	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)c2c[nH]nc2-c2ccccn2)CC1	813454862	DBCAFIGDCOHJOP-UHFFFAOYSA-N	429.481	1.815	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(NC(=S)NNC(=O)Nc2ccc3c(c2)OCO3)c1	813455508	RINSZXXOGUYPSV-UHFFFAOYSA-N	437.503	1.689	50	20	IDGD	
COC(=O)C(C)(C)c1csc(NC(=O)C(=O)NNC(=O)c2cn(C)c3ccccc23)n1	815567323	UMLVLGUZKQWODQ-UHFFFAOYSA-N	443.485	1.485	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2ccc(C)c(S(=O)(=O)C3CCCC3)c2)n1	815574650	YJFFZCSVBHCVDS-UHFFFAOYSA-N	433.490	1.592	50	20	IDGD	
CC[C@H](C)NS(=O)(=O)c1ccc(C(=O)NNC(=O)CNc2ccccc2OC)cc1	825649404	QAFMBZFGVPBSAI-AWEZNQCLSA-N	434.518	1.645	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@@H]2Cc3ccccc3CN2C(C)=O)cc(OC)c1OC	859242002	VLQIDRPNUORZEN-KRWDZBQOSA-N	427.457	1.447	50	20	IDGD	
C[C@@]12CCC(=O)N1c1ccccc1C(=O)N2CC(=O)NNC(=O)c1ccc2ccccc2n1	914831981	ZDZDXRNIYOJPRN-DEOSSOPVSA-N	443.463	1.995	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)CS(=O)(=O)c1cccc(Br)c1	915594410	ODOHBLIKQHIMPY-UHFFFAOYSA-N	445.266	1.588	50	20	IDGD	
COc1cc(-n2cnnn2)c(Cl)cc1C(=O)NNC(=O)c1cc(Br)c[nH]1	916133381	KDJHOUSMQOOHEO-UHFFFAOYSA-N	440.645	1.490	50	20	IDGD	
O=C(COc1ccc(C(F)(F)F)cc1)NNC(=O)c1csc(N2CCOCC2)n1	916136076	GMKMHKIIUHNPNZ-UHFFFAOYSA-N	430.408	1.839	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCC#Cc2ccccc2)c1	916246231	MNJMKYHXZWKLSV-UHFFFAOYSA-N	428.514	1.713	50	20	IDGD	
O=C(NCc1ccnc(N2CCCCC2)c1)NNC(=O)c1csc(N2CCOCC2)n1	916254629	KLHWGWHIGCQPMD-UHFFFAOYSA-N	445.549	1.509	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCc2ccc(-n3cccn3)cc2)c2ccccc2c1=O	916519282	MEXVHVAICWSXCE-UHFFFAOYSA-N	431.456	1.746	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)N[C@@H](C)c1ccc(S(=O)(=O)N(C)C)cc1	918103935	FSDCAQZYLFZIAA-ZDUSSCGKSA-N	444.517	1.598	50	20	IDGD	
C[C@@H]1CN(c2ccc(CNC(=O)NN[C@]3(C)CCS(=O)(=O)C3)cc2F)C[C@@H](C)O1	918219034	CACYKQBPVJITGK-PJIJBLCYSA-N	428.530	1.320	50	20	IDGD	
C[C@H]1C[C@H](C)CN(C(C)(C)CNC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)C1	919788597	PUGBVSIMIGFKGD-GJZGRUSLSA-N	428.537	1.634	50	20	IDGD	
Cc1ccc(-n2cnnn2)cc1NC(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12	919897095	ZTURATCVEFMHPA-UHFFFAOYSA-N	447.459	1.728	50	20	IDGD	
CCC(=O)N[C@@H](C)C(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccc(C)cc2C)c1	920401024	PZPUCUJVEXSRLM-HNNXBMFYSA-N	446.529	1.780	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)NCc2ccnn2C)cc1	920852853	AEEXJBLCCCFAGS-WJDWOHSUSA-N	433.472	1.391	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)c1cccc(N2CCCC2=O)c1	920979830	YEFBDEJMNIMDEI-AWEZNQCLSA-N	434.460	1.494	50	20	IDGD	
Cc1cc(COc2ccc(C(=O)NNC(=O)C(=O)NC3CC3)cc2Br)on1	921304591	XNLPLADOTUZLJP-UHFFFAOYSA-N	437.250	1.364	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)NCc2cccc(CN3CCN(C)CC3)c2)cc1	1321506694	PULXGJYHXUTFRG-UHFFFAOYSA-N	439.560	1.906	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc4n(n3)CCC4)C2)C1	1778664555	GBTGHMROTGNQJX-SCLBCKFNSA-N	425.327	1.304	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(Cl)cc4nn[nH]c34)C2)C1	1780224488	NDGLDKRYGKVKDR-SCLBCKFNSA-N	442.303	1.309	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)COc3ccc(O)cc3)CCO2)C1	1781225311	IDQPIVXKLPMTGU-RTBURBONSA-N	431.316	1.837	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)[C@@H](CN)c3ccccc3)CCO2)C1	1781227409	LDAAUXIGZJMEKV-FFZOFVMBSA-N	428.360	1.795	50	20	IDGD	
CCOc1cnc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)cn1	1781227896	FVHKRLFVRUDWTR-ROUUACIJSA-N	431.320	1.555	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnn3c2OCCC3)C1	1781265240	KJSQBQJKBOXXOM-JXXFODFXSA-N	440.928	1.047	50	20	IDGD	
O=C(c1onc2ccccc12)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781334759	ZUTLHVKOUGQEKE-RHSMWYFYSA-N	426.242	1.962	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cccc3c2NC(=O)C3)C1	1781353809	MPRIUTPTMCMCDZ-DRSNIGMVSA-N	449.935	1.563	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnn3c1CCC3)C2	1782001680	HUDIDUYSODHQHM-VVFCZOMOSA-N	439.354	1.740	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(CO)on1)C2	1782003912	XYQADXFUIBQYHV-FABXCBLPSA-N	430.299	1.078	50	20	IDGD	
CSCC[C@@H](O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCBr)C2	1782227356	HCCYBJNMMOVOHH-CKEIUWERSA-N	437.400	1.399	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3c(F)c(C)nn3C)CCO2)C1	1783343107	FNAZPYPJYISEFV-SJCJKPOMSA-N	431.306	1.485	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3c4c(nn3C)CCC4)CCO2)C1	1783353504	PCNZHCQXCAIZJB-LIRRHRJNSA-N	439.354	1.526	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](Br)CC)C2)C1	1783354636	DHJQLDVIFBEKTI-PBFPGSCMSA-N	435.315	1.551	50	20	IDGD	
O=C(Cc1cccc([N+](=O)[O-])c1)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21	1783439201	NLZJSGCPQZDRJS-QEJZJMRPSA-N	430.288	1.921	50	20	IDGD	
O=C(/C=C/c1ccc(O)cc1Cl)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1783775084	PMLSESHFKUVIJL-BYBDKAPBSA-N	429.300	1.488	50	20	IDGD	
CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](Cl)COC)C2)C1	1783885313	YPHWFNTZRUIARY-AVYPCKFXSA-N	447.960	1.373	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CNC(=O)c3cccnc3)[C@H]2C1	1785167632	JFNAKJPULGXRLT-ULQDDVLXSA-N	436.940	1.056	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3ccc(F)cn3)[C@H]2C1	1787035492	GDVVAMWJICWLDR-KNPMLCFXSA-N	428.302	1.526	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)c1[nH]nc2ncccc12	1787344750	QCDJXQXMQFIETO-HVTMNAMFSA-N	440.273	1.242	50	20	IDGD	
O=C(C[C@H]1CNc2ccccc2O1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21	1788552039	OEPCXWHGXYZBRU-SVZGUOJNSA-N	425.888	1.764	50	20	IDGD	
O=C(CS(=O)(=O)N1CCCC1)Nc1ccc(C2(NC(=O)[C@@H](O)CCl)CCC2)cc1	1788641530	ZNJVYGZJQWCHKK-INIZCTEOSA-N	443.953	1.146	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1ccc(C2(NC(=O)c3ncn(C)n3)CCC2)cc1	1788643807	CVTGNJUULZTLRA-MZJWZYIUSA-N	448.487	1.697	50	20	IDGD	
Cc1cc(CC(=O)Nc2ccc(C3(NC(=O)c4cnccc4C(=O)NN)CCC3)cc2)n[nH]1	1789589822	FLYXGXRBBHZXBW-UHFFFAOYSA-N	447.499	1.707	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc4cccnn4c3)[C@H]2C1	1790432912	GSJGMXZZZQBGSL-OQUILHJVSA-N	435.322	1.711	50	20	IDGD	
COc1ncccc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]2C1	1791057047	MQQBZGUIXLAYJD-DHMWGJHJSA-N	426.311	1.467	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CCc4ccccc4O3)C[C@@H]21	1791257822	VCQXBULVGHNHAB-GCLMUHHRSA-N	436.936	1.614	50	20	IDGD	
CCC[C@H](NC(C)=O)C(=O)NC1(c2ccc(NC(=O)CCC(=O)NN(C)C)cc2)CCC1	1791603256	MOCXYBDZJLVQSL-IBGZPJMESA-N	445.564	1.798	50	20	IDGD	
CCOCCC(=O)Nc1ccc(C2(NC(=O)c3cnccc3C(=O)NN)CCC2)cc1	1791963687	BCEVDTKQFIXBRR-UHFFFAOYSA-N	425.489	1.859	50	20	IDGD	
CC(C)[C@H](O)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1793229577	JOOXUMODRUENAP-QRJUGERDSA-N	431.961	1.774	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](CCO)NC(=O)OC(C)(C)C	1793250021	NZPJIXJUGOVLFR-YIDVYQOGSA-N	447.960	1.154	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(OC(F)F)cn1	1794459033	CRYKDQAWIORUID-WJNVRWDZSA-N	433.839	1.140	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(C(F)F)no1	1796358327	NQWUJABRGJACJY-JGPRNRPPSA-N	434.403	1.176	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ncn(-c2ccccc2)n1	1796541370	JQUBTSFXPWLNBY-AYDFFVQHSA-N	448.321	1.254	50	20	IDGD	
Cc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@](C)(Cl)CCl)C3)ncc1[N+](=O)[O-]	1796602161	VLTZMXWFTLZBLI-ABXQLRGKSA-N	445.303	1.738	50	20	IDGD	
CCc1noc(C)c1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C(C)=N/NC(=O)c1ccc[nH]1	1796892049	XGLWABGIKQKQQW-XMOXNHLCSA-N	440.504	1.931	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2cnccc2[nH]1	1797518798	MHEQBHMECHGGDM-UMPJEAMMSA-N	435.322	1.940	50	20	IDGD	
COc1ccc(CCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CCC(=O)NN(C)C)C3)c(F)c1	1797866856	WSOXGMWOQVMCMG-BCDXTJNWSA-N	448.539	1.778	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cn2cc(F)ccc2n1	1798091618	UFGXBFZNBWWAJU-MUJYYYPQSA-N	430.484	1.098	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1coc([Si](C)(C)C)c1	1798416236	VXHSVAGJLNREMG-BJWYYQGGSA-N	434.613	1.450	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CSc1ccncc1)C2	1799274042	PEUUOMGMNSGECX-ZDFLXESQSA-N	432.373	2.000	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3ccccn3n1)C2)[C@@H](F)Br	1799347510	OPSHBASRHWBLLU-BAESOJJISA-N	425.258	1.228	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@]2(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)[C@H](F)Cl)C4)C[C@H]1CO2	1799936772	QXYZONSMDTUSJE-HKQPUQOZSA-N	445.919	1.937	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2n(n1)CCCN(C)C2	1800128531	RNSOIHPFSDOSRA-LORHWOILSA-N	437.972	1.329	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c(F)cncc1F)C2	1800642087	VSBXJYNLWHJJKZ-JNIYBQFBSA-N	432.265	1.737	50	20	IDGD	
Nc1nc2cc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)C(Cl)Cl)ccc2s1	1801016224	ZTJAURIKLCRDBE-DDFAGTSDSA-N	429.329	1.885	50	20	IDGD	
COC[C@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)COCCNC(=O)OC(C)(C)C)C2	1802283859	QUSSCLSSIQXLJR-FZKCQIBNSA-N	447.960	1.420	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)n2cncn2)[C@@H]1c1cccnc1	1803017205	CBOSYVXBXDUKLP-TXCZRRACSA-N	449.353	1.971	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2c(F)c(C)nn2C)[C@H]1c1cccnc1	1805150559	QLKYYOXUGZVITN-HLLBOEOZSA-N	437.903	1.836	50	20	IDGD	
CN(C)C(=O)NCC(=O)N1CC[C@@H](CNC(=O)CCBr)[C@H]1c1cccnc1	1806339195	ZRBSSPOGOLDLRF-WMLDXEAASA-N	440.342	1.144	50	20	IDGD	
O=C(CNc1ccc(F)cc1)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1	1807060952	FFNHYLAQJJPBOS-CVAIRZPRSA-N	434.899	1.938	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H](CNC(=O)Cn2cncn2)[C@@H]1c1cccnc1	1807603953	ZKUQHTFUAPKXGZ-HFTRVMKXSA-N	425.320	1.615	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)Br)[C@@H]1c1cccnc1	1808233340	LJMGUOCCIURCJF-UQOMUDLDSA-N	440.342	1.318	50	20	IDGD	
C=CCNC(=O)/C=C\C(=O)N1CC[C@H](CNC(=O)[C@H](C)Br)[C@@H]1c1cccnc1	1812864509	UNPOZIRDGSUEQV-VLFXMJMZSA-N	449.349	1.729	50	20	IDGD	
Cc1nccn1CCCC(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1	1813356320	UNJJCZAYVITUCS-NLWGTHIKSA-N	433.940	1.672	50	20	IDGD	
C[C@H](CBr)C(=O)Nc1cc([C@H]2CCCCN2C(=O)C2=NNC(=O)C2)[nH]n1	1814782493	VOHTZOHPCUPNBU-BXKDBHETSA-N	425.287	1.309	50	20	IDGD	
O=C1CCc2ccc(C(=O)N3CCCC[C@H]3c3cc(NC(=O)[C@@H](O)CCl)n[nH]3)nc2N1	1814870497	USDZQMGYNLEBJO-GJZGRUSLSA-N	446.895	1.595	50	20	IDGD	
COC1(CC(=O)N[C@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)CCC1	1815347848	SKQYYUPECGWJPR-HNNXBMFYSA-N	443.334	1.008	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)Cn2cc([N+](=O)[O-])cn2)n[nH]1	1815823827	WFURRDKOIJUYKD-OCCSQVGLSA-N	439.860	1.461	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)C(F)(F)C(F)F)[nH]n1)c1cccc(B(O)O)c1	1817474152	NPLOYCJZKTYDQK-ZDUSSCGKSA-N	442.178	1.296	50	20	IDGD	
CC[C@@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN2CCN(C(C)=O)CC2)[nH]n1	1820855628	ZDVKXVFIANBHDK-WBVHZDCISA-N	438.960	1.583	50	20	IDGD	
O=C(O)CSCC(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](F)Br)[nH]n1	1822428027	YXVMRBPIDGHCGN-RNCFNFMXSA-N	437.291	1.910	50	20	IDGD	
O=C(CSc1ncccn1)N1CCC([C@H]2CCCCN2C(=O)[C@H](O)CCl)CC1	1824182325	XXXYHYCVXXEGTH-HZPDHXFCSA-N	426.970	1.788	50	20	IDGD	
O=C(O)c1cc(C(=O)N[C@H]2CCc3nc(NC(=O)C(Cl)Cl)sc3C2)ncn1	1826093563	QRANKIFFPCRXNF-LURJTMIESA-N	430.273	1.661	50	20	IDGD	
Cc1nocc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2	1830537185	CKWSKVWQKQCRPE-YVEFUNNKSA-N	430.299	1.084	50	20	IDGD	
O=C(C[C@@H]1OCCc2ccccc21)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1831246756	YYZKPJDZSNUFSE-HFSMHLIXSA-N	440.899	1.681	50	20	IDGD	
C=C(C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1)C(F)(F)F	1831451540	WZXDLKNDFDAFTQ-GOSISDBHSA-N	438.255	1.718	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4nncn4c3)C2)C1	1831652302	YJYACENKIMVCGP-JXFKEZNVSA-N	435.912	1.207	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ncccc2F)CC1	1831873815	ZFJFMEZLMCZYDT-GOSISDBHSA-N	433.528	1.827	50	20	IDGD	
CO[C@@H](C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)CC1	1831906232	PBFLGSTVQKGSSQ-VFGZWROSSA-N	431.537	1.775	50	20	IDGD	
COC(=O)CSCC(=O)NC1CCN(C2CCN(C(=O)C(C)(C)CCl)CC2)CC1	1833476319	PJKRNZLIYMFVGO-UHFFFAOYSA-N	448.029	1.729	50	20	IDGD	
O=C(c1coc(Cl)n1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1833557109	DKRHJHAAWBVHJX-IINYFYTJSA-N	440.653	1.089	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1)c1cncnc1	1834237260	XVVCMPLIDCZFNC-HNNXBMFYSA-N	428.306	1.352	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(F)cn3)CCO2)C1	1834473801	OVABFRQVTRZJHD-FZKQIMNGSA-N	444.301	1.322	50	20	IDGD	
COc1cccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)c1	1835035327	PIPISSLKYNMVCD-LJQANCHMSA-N	431.316	1.498	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3cscn3)CCO2)C1	1836044384	WTJIAALDXBTDOT-IAGOWNOFSA-N	436.361	1.378	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](F)Br)CC2)CC1	1836412306	DCWKEDQEAJHQDI-MLGOLLRUSA-N	449.365	1.115	50	20	IDGD	
O=C1Cc2cc(C(=O)N3CCC(OC4CCN(C(=O)[C@H](O)CCl)CC4)CC3)ccc2N1	1836717161	KYZKQFLSCOOWFN-LJQANCHMSA-N	449.935	1.393	50	20	IDGD	
O=C(c1n[nH]c2ccccc12)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1836944620	MWWRHXKFIOZXHN-SFHVURJKSA-N	427.288	1.437	50	20	IDGD	
Cn1cccc(C(=O)N2CCC(OC3CCN(C(=O)CO[Si](C)(C)C)CC3)CC2)c1=O	1836970502	YAESWWZCXLVRNM-UHFFFAOYSA-N	449.624	1.849	50	20	IDGD	
C=CC[C@H](C(=C)C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)Br)C2)C1	1837312144	VALNWGQEGPYOCY-FRQCXROJSA-N	429.355	1.995	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)c(C)n1	1838364235	KQWFXNVGLCWHKJ-IFXJQAMLSA-N	440.338	1.552	50	20	IDGD	
CCc1ncsc1C(=O)N1CCO[C@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1	1838837617	GDQPDOYEPNQTQW-IBGZPJMESA-N	441.626	1.627	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnn(C(C)(C)C)c3)C2)C1	1839143251	PYACOZZQBYMUGA-OXJNMPFZSA-N	426.945	1.726	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(O)ccc3F)CCO2)C1	1839296821	YJPXRHADTQVDQZ-SGTLLEGYSA-N	445.285	1.385	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccnc3Cl)C2)C1	1840029712	NEXANHYUGNMUQE-SJKOYZFVSA-N	446.729	1.588	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3ccccn3)C2)C1	1840031658	YUAQRPGMKBCRNY-DNVCBOLYSA-N	440.338	1.254	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3nccc4occc34)C2)C1	1840151994	TVADFSJBLYMWEF-YWZLYKJASA-N	437.880	1.152	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@]3(F)CCCC=C3F)C2)C1	1840156854	WGHZXGHUVSLOOP-GDIGMMSISA-N	436.883	1.442	50	20	IDGD	
Cc1ccccc1OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840188178	SPKVKSQWBJRXPI-LJQANCHMSA-N	431.316	1.634	50	20	IDGD	
CC(=O)C(C)(C)C(=O)N1CCCC12CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2	1841512858	YGYJSKAWJUWGLF-UHFFFAOYSA-N	443.548	1.151	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCCC12CN(C(=O)c1cc[n+]([O-])cc1)C2	1841924742	XBCJHIXUURTGCE-HNNXBMFYSA-N	438.912	1.269	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1cccc3c1OCC3)C2	1843415898	AAIJKQJRQQGQGW-MFKUBSTISA-N	435.484	1.573	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1ccc3ncoc3c1)C2	1843415900	AHDBCGCWOKFBGN-AFUMVMLFSA-N	434.456	1.779	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1ccc3cncn3c1)C2	1843416292	TUNRUYYQKKUYOG-MFKUBSTISA-N	433.472	1.285	50	20	IDGD	
CC(C)(C)OC(=O)NCC[C@@H](O)C(=O)N1CCCC12CN(C(=O)CO[Si](C)(C)C)C2	1845222996	NBYHZPAFBRPEGJ-OAHLLOKOSA-N	443.617	1.317	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)c2ccc(N3CCCCC3)cc2)C1	1845383173	MAJKBZOPZIXNIA-UHFFFAOYSA-N	441.576	1.867	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CCc1cnc[nH]1	1848095783	ORATUASCYSOJAQ-JYJNAYRXSA-N	439.944	1.676	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1ccc(OC)c([N+](=O)[O-])c1	11341937	ZNJYKRYEJYTJFB-UHFFFAOYSA-N	437.792	1.883	50	20	IDGD	
CCCOc1ccc(C(=O)NNS(=O)(=O)c2ccc(F)c(C(=O)O)c2)cc1OC	13262160	FVGNIGRZKYFJJI-UHFFFAOYSA-N	426.422	1.945	50	20	IDGD	
CS(=O)(=O)Cc1ccc(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1	15737575	KSQUNXPTWSOORW-UHFFFAOYSA-N	444.557	1.205	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)OCC(=O)NNC(=O)c2cccs2)c1C	22620472	GIIOKNFKLBCCPA-MHWRWJLKSA-N	430.486	1.724	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CCNS(=O)(=O)c2cc(C)ccc2C)cc1OC	25404564	KXMKPLFYDAZSGZ-UHFFFAOYSA-N	435.502	1.450	50	20	IDGD	
Cc1nnnn1[C@@H](Cc1ccc(F)cc1)C(=O)NNC(=O)c1cc(Br)c[nH]1	71913186	PCMPJHSJBVPRCI-AWEZNQCLSA-N	436.245	1.456	50	20	IDGD	
CCN1CCN(c2ccc(F)cc2[C@@H](C)NC(=O)NNC(=O)Cn2nc(C)cc2C)CC1	726278574	JBQZPROZOFVQND-QGZVFWFLSA-N	445.543	1.873	50	20	IDGD	
NC(=O)[C@@H]1CCCN1Cc1cccc(NC(=O)NNC(=O)c2cc(Cl)ccc2O)c1	726874485	WTXSMRIVKFIVSO-INIZCTEOSA-N	431.880	1.962	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)NC[C@@H](c1cccc(Cl)c1)N1CCOCC1	726980178	PEIPCGIBDUAPLG-INIZCTEOSA-N	449.895	1.067	50	20	IDGD	
N#CCOc1ccc(CNC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1	727942434	KNKVDBVUTSDZNR-UHFFFAOYSA-N	436.516	1.632	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CN2CCN(CC(=O)N(C)C3CCCCC3)CC2)cc1	728577299	YOIHQNYOTUWXIO-UHFFFAOYSA-N	429.565	1.165	50	20	IDGD	
Cc1cc(-c2cc(C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)c3c(C)noc3n2)c(C)o1	729275679	QFXZWGNYNULSRI-JTQLQIEISA-N	435.462	1.107	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)[C@H]2CC(=O)N(C[C@@H]3CCCN3CC)C2)cc1OC	729628457	UVUVGOQYTIKOLP-IRXDYDNUSA-N	432.521	1.188	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)COc2ccc(Br)cc2)ccc1S(N)(=O)=O	730841509	CPJDHBDAYZJWRX-UHFFFAOYSA-N	442.291	1.245	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COc2ccc(Br)cc2)cc1S(N)(=O)=O	731606406	QBOFHFIMDMRPHO-UHFFFAOYSA-N	442.291	1.245	50	20	IDGD	
O=C(NN=C1CCS(=O)(=O)c2cc(F)c(F)cc21)C1CCN(c2ncccn2)CC1	731927995	ZNUGBTQPEBUFCP-UHFFFAOYSA-N	435.456	1.669	50	20	IDGD	
COC(=O)c1csc(S(=O)(=O)NNC(=O)c2ccc(OC)c(Br)c2)c1	732048411	IMVZTAUJNXUKKS-UHFFFAOYSA-N	449.304	1.929	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCCNC(=O)c2cccs2)cc1Br	732240569	FURADYRLXJLWGJ-UHFFFAOYSA-N	441.307	1.893	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)NC[C@@H]2CN(C)CCN2C)cc(OCC)c1OCC	732253670	LUSCFZKJVAFSDN-MRXNPFEDSA-N	437.541	1.073	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCCCOC[C@@H]2CCCO2)cc1Br	732441419	HPXSDUORXAKXEW-ZDUSSCGKSA-N	430.299	1.987	50	20	IDGD	
Cc1nn(-c2ccccc2)c2sc(C(=O)NNC(=O)Cn3ncn4nccc4c3=O)cc12	732727261	HKMFTWWZSVCKTG-UHFFFAOYSA-N	448.468	1.061	50	20	IDGD	
Cc1nn(CCCl)c(C)c1C(=O)N[C@@H]1CCCN(c2cc(N3CCOCC3)ncn2)C1	733937082	HRBDHNVOACUIOU-QGZVFWFLSA-N	447.971	1.764	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)N[C@@H]2CCCN(c3cccc(F)c3)C2)c2ccccc2c1=O	734949633	DAVOZLHBMPDDRG-OAHLLOKOSA-N	438.463	1.686	50	20	IDGD	
COc1ccc(S(=O)(=O)C[C@H](C)C(=O)NNC(=S)NCCc2cccs2)cc1	735123879	PQEWBZKPTHLXGY-ZDUSSCGKSA-N	441.600	1.905	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)c2cnn(C)c2)ccc1OCC(=O)N1CCCCC1	735445354	QXZCDVLMDQYOHT-UHFFFAOYSA-N	429.477	1.285	50	20	IDGD	
COC(=O)c1cc(Br)cc(S(=O)(=O)NNC(=O)c2ccccc2F)c1	736064609	VZNNIMMRRIHOGF-UHFFFAOYSA-N	431.239	1.998	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)[C@@H]1CCCN(C(=O)COc2ccccc2)C1	741190869	GVCILBDPOUEQLW-LJQANCHMSA-N	425.485	1.668	50	20	IDGD	
Cn1c(=O)n(C)c2cc(S(=O)(=O)NNC(=O)c3ccccc3)c(Br)cc21	741648878	PNYMLAOLKTXLLM-UHFFFAOYSA-N	439.291	1.263	50	20	IDGD	
O=C(C[C@H]1CN(Cc2ccccc2)CCO1)NNc1ccc(S(=O)(=O)NC2CC2)cc1	743327631	GZXXCJXBOZERHE-FQEVSTJZSA-N	444.557	1.862	50	20	IDGD	
CC(C)CCOCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	743352633	VYSFBILHLJBNRY-UHFFFAOYSA-N	440.566	1.868	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)[C@@H]2C[C@]23CCc2ccccc23)CC1	743420068	UNRQPGWYTFTCDK-AVRDEDQJSA-N	441.557	1.365	50	20	IDGD	
CSc1nc(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)c2ccccn12	744622055	VAZIJIBLXDQDOM-UHFFFAOYSA-N	447.542	1.834	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)NC[C@@H](C)CN2CCN(C)CC2)c1	745860153	LDIMBEYREJAOHK-CYBMUJFWSA-N	442.358	1.285	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)[C@@H](C)Oc1ccc2ccccc2c1)CN1CCN(C)CC1	745861189	AAWNIKIIEICMOX-ZWKOTPCHSA-N	427.549	1.821	50	20	IDGD	
COC1CCN(C2(CNC(=O)NNC(=O)Cc3cn4ccccc4n3)CCCC2)CC1	746759572	HXDHABUAIBAUTN-UHFFFAOYSA-N	428.537	1.631	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)CCOc1ccccc1)N1CCN(c2ccccc2)CC1	747104538	BNOKYFKHWDOETN-IBGZPJMESA-N	425.533	1.997	50	20	IDGD	
O=C(CCOc1ccccc1)NNC(=O)N1CCN(C(=O)COc2ccc(F)cc2)CC1	747105040	XDIJHSFTJXZLOA-UHFFFAOYSA-N	444.463	1.559	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)NCc1ccc(NC(=O)c2ccc(F)cc2)cc1	748626963	ZOJGRYCYZBUTHW-AWEZNQCLSA-N	432.452	1.960	50	20	IDGD	
O=C(CCc1ccccc1)NNC(=O)c1cc(S(=O)(=O)N2CCOCC2)ccc1F	749803874	IQRXGUJTERHBFF-UHFFFAOYSA-N	435.477	1.240	50	20	IDGD	
O=C(CNC(=O)c1ccc(F)c(F)c1)NNc1nc(Br)cn2ccnc12	750248185	YCVUKZWWZSZDOE-UHFFFAOYSA-N	425.193	1.643	50	20	IDGD	
COC(=O)COc1c(C)cc(C(=O)OCC(=O)NNC(=O)c2ccc(C)cc2)cc1C	752567085	DEQXUKZQKPFBPS-UHFFFAOYSA-N	428.441	1.782	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)COCCNC(=O)c1ccccc1	752633817	BAZHRARCWCDGNG-UHFFFAOYSA-N	448.545	1.653	50	20	IDGD	
O=C1c2ccccc2C(=O)N1CCCS(=O)(=O)NNC(=O)C12CC3CC(CC(C3)C1)C2	753016332	JEMJFLZWELVFDG-UHFFFAOYSA-N	445.541	1.840	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@H](C)c2ccc(S(C)(=O)=O)cc2)c2ccccc2c1=O	753276979	RWXIMUOELBIRCU-CYBMUJFWSA-N	442.497	1.385	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN([C@H]2CCCN(C(=O)NNC(=O)C3CCCC3)C2)C(=O)C1	753356365	XUOQJSASNLEAPO-INIZCTEOSA-N	437.541	1.461	50	20	IDGD	
O=C(COC(=O)c1scnc1Br)NNC(=O)c1ccc([N+](=O)[O-])cc1	754964133	ISEJWZIEFGJCIA-UHFFFAOYSA-N	429.208	1.432	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)CNC(=O)c2ccccc2C(F)(F)F)c2ccccc2c1=O	755044844	BEQSOLDVUKTSSE-UHFFFAOYSA-N	447.373	1.143	50	20	IDGD	
CN1CC[C@@H](NC(=O)NNC(=O)C(=O)Nc2ccccn2)[C@H]1c1ccc(Cl)c(F)c1	755100872	VOQLPVIFSOCCCL-GDBMZVCRSA-N	434.859	1.588	50	20	IDGD	
O=C(NNC(=O)c1cc2ccccc2o1)Nc1cccc(S(=O)(=O)N2CCOCC2)c1	755354210	OHMKMVWLLNHETK-UHFFFAOYSA-N	444.469	1.920	50	20	IDGD	
COCCOc1cc(C)ccc1CNC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	756099192	GWNJWFDMOCCZNF-UHFFFAOYSA-N	439.472	1.411	50	20	IDGD	
O=C(COC(=O)[C@@H](O)c1cc(Cl)cc(Cl)c1)NNC(=O)c1ccc([N+](=O)[O-])cc1	756750174	AYQGKAVBPBALQB-HNNXBMFYSA-N	442.211	1.939	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)Nc1ccc(C)c(S(=O)(=O)NC2CC2)c1	757872564	AENIYCBFWAQJAJ-UHFFFAOYSA-N	432.502	1.840	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2cccc(C(=O)NNc3ncccc3[N+](=O)[O-])c2)C[C@H](C)O1	759300342	BTWUZNHUFURNSP-STQMWFEESA-N	435.462	1.545	50	20	IDGD	
O=C(/C=C\c1ccc(Cl)nc1)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	759611738	ZUBKVDOFARXGRU-CLFYSBASSA-N	427.892	1.354	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccnn2[C@H](C)C2CC2)cc1	760276816	DDOGBXGPAPCOBH-ZIAGYGMSSA-N	429.477	1.806	50	20	IDGD	
CCn1c(=O)c2ccccc2n(CC(=O)NNC(=O)CSc2ccccc2OC)c1=O	761637817	VAYFBMAIJMDUFL-UHFFFAOYSA-N	442.497	1.131	50	20	IDGD	
C[C@H](O)c1cn(CC(=O)NNC(=O)[C@@H]2Cc3ccccc3CN2Cc2ccccc2)nn1	763032966	PHMNUYMNXHWUJX-KKSFZXQISA-N	434.500	1.106	50	20	IDGD	
COCCOc1cccc(NC(=O)C(=O)NNC(=O)c2ccccc2Br)c1	763481997	CEIUOAZWBITSMH-UHFFFAOYSA-N	436.262	1.874	50	20	IDGD	
COc1ccccc1OC[C@H](C)CNC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	763544150	MZZCTMXGFYCCFV-CQSZACIVSA-N	435.502	1.758	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cccc(S(=O)(=O)NC(C)(C)C)c2)c(C)o1	763579689	QSQNCLCHMHALIO-UHFFFAOYSA-N	436.490	1.373	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1ccc(C(=O)c2nccn2C)cc1	763625834	YIJYFKAAPMAUJG-UHFFFAOYSA-N	445.439	1.007	50	20	IDGD	
COC(=O)c1cc(C(C)C)ccc1NC(=O)C(=O)NNC(=O)COc1ccc(OC)cc1	763660776	HEPIHNBJACQNDA-UHFFFAOYSA-N	443.456	1.770	50	20	IDGD	
O=C(COc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1ccnn1Cc1ccccc1F	763686124	JZMPNVYOIVYSDE-UHFFFAOYSA-N	445.838	1.889	50	20	IDGD	
COC(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)CSc2ccc(Cl)cc2)c1	763735709	QNVMBFJQFRZQFA-UHFFFAOYSA-N	435.889	1.934	50	20	IDGD	
Cc1ccc(Br)c(NC(=O)C(=O)NNC(=O)c2nnc(O)c3ccccc23)c1	763790760	NZBZTAPFENDEKS-UHFFFAOYSA-N	444.245	1.806	50	20	IDGD	
Cc1ccc(NC(=O)CS[C@H](C)C(=O)NNC(=O)CNC(=O)c2cccnc2)cc1	763815119	VCLMTUCDCXLFLK-CQSZACIVSA-N	429.502	1.028	50	20	IDGD	
CCCc1c(C(=O)NNC(=O)CNC(=O)c2cccnc2)nnn1-c1cccc(Cl)c1	763818271	DQEFNGPSKBQESS-UHFFFAOYSA-N	441.879	1.459	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)C(=O)Nc2ccc(C#N)cc2)c2ccccc2c1=O	763821700	WNSCQPGJKPATAW-UHFFFAOYSA-N	446.467	1.858	50	20	IDGD	
COC(=O)C(C)(C)c1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)cc1	763865081	IAFFJNXSRCFFSP-CYBMUJFWSA-N	445.447	1.830	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccc([S@](C)=O)c(F)c1	763865558	LJVZNUSTYXSPCB-WIONRGSFSA-N	425.413	1.256	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccc([S@](=O)C(F)(F)F)cc1	763919802	YPZOABQQPQCUJE-LJAQVGFWSA-N	431.367	1.782	50	20	IDGD	
C[C@@H]1COCCN1c1ccc(NC(=O)C(=O)NNC(=O)Cc2ccc(Cl)cc2)cc1	763930450	ANPUJQMFPBVLLG-CQSZACIVSA-N	430.892	1.894	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ccc(Br)s2)cn1C	763938354	DIZQSBLIFFTMNS-UHFFFAOYSA-N	443.279	1.426	50	20	IDGD	
C[C@@H]1CN(Cc2cccc(NC(=O)C(=O)NNC(=O)Cc3ccsc3)c2)C[C@@H](C)O1	764035297	RCFLIBNUXOTQEH-HUUCEWRRSA-N	430.530	1.686	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)nc1)C(=O)Nc1ccc(-n2cnc3ccccc32)nc1	764092532	KNRFIKASYNZJRO-UHFFFAOYSA-N	435.831	1.869	50	20	IDGD	
CCCS(=O)(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)CCc2ccccc2)c1C	764201781	CJQIBCJJYCPOMM-UHFFFAOYSA-N	446.529	1.865	50	20	IDGD	
C[C@@H]1CCC[C@@H](C)N1C(=O)c1cc(Cl)ccc1NC(=O)C(=O)NNC(=O)CN(C)C	764203051	FFPBCBQMZSAIAC-CHWSQXEVSA-N	437.928	1.391	50	20	IDGD	
COC(=O)[C@H]1CN(C(=O)C(=O)NNC(=O)CCCc2ccccc2)c2ccccc2O1	764226525	NPNPHZQXRROHML-GOSISDBHSA-N	425.441	1.124	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)C(=O)Nc1cccc(C(=O)N2CCc3ccccc32)c1	764298143	OPHFIXHMOUAHNP-UHFFFAOYSA-N	432.440	1.321	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)COCc2ccccc2)sc2c1CCC2	764368068	UQZHZBYHBQSBPI-UHFFFAOYSA-N	445.497	1.716	50	20	IDGD	
COc1nccnc1NNC(=O)c1sccc1S(=O)(=O)NCc1cccs1	764481790	KHAFUDMHBQKIMW-UHFFFAOYSA-N	425.517	1.844	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NN=Cc3cccc(F)c3F)CC2)cc1	764818914	XQXZAMGEJYZWBI-UHFFFAOYSA-N	436.484	1.730	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)Cc3ccccc3[N+](=O)[O-])CC2)cc1	765754556	MCYAYMJGGDASSL-UHFFFAOYSA-N	425.489	1.411	50	20	IDGD	
COc1ccc(CN2CC[C@@H](NC(=O)NNc3ccccc3S(C)(=O)=O)C2=O)cc1	765783785	NNQPSCZLTHBMPB-QGZVFWFLSA-N	432.502	1.526	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)N[C@H]1CC(=O)N(CCOc2ccccc2)C1	765802662	DRNNPYGLVFNHSP-HNNXBMFYSA-N	432.502	1.396	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)c1cc(I)cc([N+](=O)[O-])c1	765806092	UIIRLSNKFQEBLI-UHFFFAOYSA-N	448.217	1.265	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)N2CCN(C(=O)[C@H]3CCCN3C)CC2)c1C	766345252	HXQYBRYXWRATJF-WOHXKIKESA-N	427.549	1.423	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1ccc(-n2ccnc2)cc1	766640629	DRTNTUYNZUJKEV-UHFFFAOYSA-N	432.484	1.091	50	20	IDGD	
O=C(CCCNS(=O)(=O)c1ccc2c(c1)OCCO2)NNc1ncnc2ccsc12	766678584	HRSDSVQZSKBBLB-UHFFFAOYSA-N	449.514	1.664	50	20	IDGD	
CCn1c(NNC(=O)c2ccccc2S(=O)(=O)CCN(C)C)nc2ccccc2c1=O	767178982	JDQBPBVAXQPYFP-UHFFFAOYSA-N	443.529	1.509	50	20	IDGD	
COc1ccc(-c2cc(C(=O)OCC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)n[nH]2)cc1	767572921	OCXRKRQLDOIMPJ-UHFFFAOYSA-N	439.384	1.612	50	20	IDGD	
O=S(=O)(CBr)N1CCN(S(=O)(=O)c2cccc3c2CCCC3)CC1	767850338	JIERKQYBGPTGTF-UHFFFAOYSA-N	437.381	1.554	50	20	IDGD	
CC(C)c1cc(NC(=O)C(=O)NNC(=O)c2cccc(Cl)c2)n(-c2ncccn2)n1	768236548	DMDPQNUBDLCLCI-UHFFFAOYSA-N	427.852	1.839	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cn(C)nc3C(C)(C)C)CC2)cc1	768948502	KRTMBOOPPLBPMQ-UHFFFAOYSA-N	426.565	1.605	50	20	IDGD	
CSCCNC(=S)NNC(=O)c1ccc(NC2=NS(=O)(=O)c3ccccc32)cc1	770245083	CSJXOAXCASUTEZ-UHFFFAOYSA-N	449.583	1.720	50	20	IDGD	
O=C(NNc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cccc(S(=O)(=O)N2CCCC2)c1	773656552	OMPFCWJKCYDETR-UHFFFAOYSA-N	433.446	1.461	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(C)c(F)c2)cc1N1CCOC1=O	773888350	GEGHDAMFFSSMMU-UHFFFAOYSA-N	430.392	1.499	50	20	IDGD	
O=C(NNC(=O)c1ccccc1O)N[C@H]1CCN(c2cccc(Br)c2)C1=O	775219954	LAYVWKQSJZXEDK-AWEZNQCLSA-N	433.262	1.904	50	20	IDGD	
CCCc1nc(C)c(NC(=O)C(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)s1	777142120	YSJKXYPYWWHYAG-UHFFFAOYSA-N	436.490	1.830	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)CN(C)S(=O)(=O)c2ccc(Cl)cc2)nc1C	778430764	ZYTZDKIYJIZRKX-UHFFFAOYSA-N	441.897	1.379	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)C[C@@H]1CSCCN1C(=O)OC(C)(C)C	778436373	IRDCQKVUGASGGD-GFCCVEGCSA-N	432.543	1.401	50	20	IDGD	
O=C(CN1CCC[C@@H](S(=O)(=O)N2CCc3ccccc32)C1)NNC(=O)c1cccs1	779625018	SQUKTSRYYBZXSA-MRXNPFEDSA-N	448.570	1.366	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2Cl)cc1S(N)(=O)=O	782927635	VSPQTSCFBZSLSZ-UHFFFAOYSA-N	445.284	1.349	50	20	IDGD	
O=C(NNc1ccc(Br)cc1)C(=O)Nc1ccc(CN2C(=O)CNC2=O)cc1	783006121	NTPRUXMPBBZCBY-UHFFFAOYSA-N	446.261	1.583	50	20	IDGD	
CCCNC(=O)[C@H]1CN(C(=O)C(=O)NNc2ncnc3ccsc23)c2ccccc2O1	783252858	DKMYGDWOXDYUIE-OAHLLOKOSA-N	440.485	1.455	50	20	IDGD	
CC(C)Oc1ccc(Br)cc1NC(=O)C(=O)NN[C@@]1(C)CCS(=O)(=O)C1	783429074	ZOHQGKXGUBQUQT-INIZCTEOSA-N	448.339	1.373	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ccc(OC(F)(F)F)cc2)cc1-n1cnnn1	784802021	NTHYWTGAUMDVCW-UHFFFAOYSA-N	437.338	1.651	50	20	IDGD	
O=C(COC(=O)Cc1cccc(N2CCCC2=O)c1)NNC(=O)c1ccc([N+](=O)[O-])cc1	785214241	XYSKFYRWCYABSP-UHFFFAOYSA-N	440.412	1.269	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@@H]1[C@H](C(F)(F)F)[C@H]2CC[C@H]1O2	785443937	MJQSJECYBCEZRP-WISYIIOYSA-N	434.440	1.405	50	20	IDGD	
CN1C(=C(C#N)C(=O)COC(=O)[C@H]2CCCN2C(=O)C(F)(F)F)N(C)c2ccccc21	786580634	HRMBLDLNPHFJHY-OAHLLOKOSA-N	436.390	1.973	50	20	IDGD	
CCNC(=O)Nc1ccc(C)c(NC(=O)C(=O)NNC(=O)COc2cccc(C)c2)c1	787541220	OJIOBGFQBCPLOI-UHFFFAOYSA-N	427.461	1.610	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cc(N3C[C@@H](C)O[C@H](C)C3)ccn2)cc(OC)c1OC	789941203	GVDYDMNAINRBLR-ZIAGYGMSSA-N	444.488	1.796	50	20	IDGD	
CCc1nn(C)c(CC)c1CC(=O)NNC(=O)c1ccc(CSc2nncn2C)cc1	790112058	UOSCGKWPCQLWOI-UHFFFAOYSA-N	441.561	1.969	50	20	IDGD	
Cc1cccnc1NNC(=O)CCn1c(=O)oc2cc(S(=O)(=O)N3CCCC3)ccc21	791224224	RMHMIOPAOKTIDW-UHFFFAOYSA-N	445.501	1.616	50	20	IDGD	
Cc1c(CC(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)cnn1C	794201337	SXPYDFGIUCXBLR-UHFFFAOYSA-N	441.513	1.211	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)[C@@H](C)CNC(=O)OC(C)(C)C)c2ccccc2c1=O	794774950	KHGGCBSVPPOYGL-ZDUSSCGKSA-N	431.493	1.728	50	20	IDGD	
COC(=O)c1cc(F)cc(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)c1F	797000102	RCKHLBFPJNKVRS-UHFFFAOYSA-N	445.176	1.242	50	20	IDGD	
N#CCCn1cc(C(=O)NNC(=O)NCC(F)(F)F)c(-c2ccc([N+](=O)[O-])cc2)n1	798315258	DPXHGBSMJFQPPQ-UHFFFAOYSA-N	425.327	1.878	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)c3cnnn3C)c2)c(C)c1	798823101	HCPNSRFVGAKRDW-UHFFFAOYSA-N	428.474	1.308	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1cc(F)c(Br)cc1Cl	799259419	WEEIDCFJWOONNF-SSDOTTSWSA-N	440.653	1.379	50	20	IDGD	
CN(C)Cc1cc(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)ccc1Cl	799261412	CCKGZEVCAVIUGN-UHFFFAOYSA-N	428.880	1.378	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2CC(=O)N(C)[C@H]2c2cccc(Cl)c2)cc1	801108373	MJWAMOWYQNBXFU-WMZOPIPTSA-N	428.876	1.954	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)N1CCC(C(=O)NNC(=O)N=c2cc[nH]cc2)CC1	802029025	KCRJSPKHRWEYRF-UHFFFAOYSA-N	431.880	1.871	50	20	IDGD	
COc1ccc(Cl)c(NC(=O)NNC(=O)CN2C(=O)c3cccc([N+](=O)[O-])c3C2=O)c1	802115347	YLVVSWGIOJGMMB-UHFFFAOYSA-N	447.791	1.706	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)N[C@H]1CCc2ccccc2OC1	802403842	MOUXHOPVKPSRDH-FQEVSTJZSA-N	437.544	1.923	50	20	IDGD	
CCOC(=O)C1(S(C)(=O)=O)CCN(C(=O)NNC(=O)c2ccc3ccccc3c2)CC1	804924788	ALPPGSIITLUJKA-UHFFFAOYSA-N	447.513	1.637	50	20	IDGD	
O=C(NCc1ccc(C(=O)N2CCCCC2)cc1)NNC(=O)c1ccc(-n2cnnn2)cc1	807019445	BCPLTUPNEQZZDB-UHFFFAOYSA-N	448.487	1.433	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)N2CCN(C)CC2)cc1S(=O)(=O)Nc1ccc(F)cc1	807381886	NGHGBNUVXRCQND-UHFFFAOYSA-N	449.508	1.537	50	20	IDGD	
C=CCN(C)S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2C)cc1	807455765	SXGDHPUYRNMIDZ-UHFFFAOYSA-N	447.473	1.792	50	20	IDGD	
Cc1cc([N+](=O)[O-])ccc1NNC(=O)C(=O)Nc1ccccc1C(=O)N1CCOCC1	807456343	IBSMNZBPUIQUID-UHFFFAOYSA-N	427.417	1.457	50	20	IDGD	
COC(=O)c1cc(NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc2[nH]ccc12	808876241	NEKWZMMZSPJAFP-UHFFFAOYSA-N	430.442	1.825	50	20	IDGD	
Cc1nn(C)cc1S(=O)(=O)NC(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccccc1	809032551	CQVYIAXLNPPRGM-GZTJUZNOSA-N	449.496	1.918	50	20	IDGD	
COc1ccc(CNC(=O)NNC(=O)Cc2ccc(Cl)cc2)cc1S(N)(=O)=O	812431432	IMQKJCQAWYWVTI-UHFFFAOYSA-N	426.882	1.069	50	20	IDGD	
CC(=NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)c1cccc(O[C@H](C)C(=O)O)c1	814725555	IZKRULKIECLBMH-CQSZACIVSA-N	433.486	1.943	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCc2nncn2C1)C(=O)Nc1ccc(Cl)c(C(F)(F)F)c1	815692359	PFFMPGJEXBJFQY-QMMMGPOBSA-N	430.774	1.299	50	20	IDGD	
Cc1cc(Br)cc(C)c1NC(=O)C(=O)NNC(=O)[C@H]1CCc2nncn2C1	815692624	WFVHLRPXFRXTPE-NSHDSACASA-N	435.282	1.006	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)N2CCC3(CC2)NC(=O)NC3=O)c(C)n1C[C@@H]1CCCO1	904158830	ANFNCASSMNQDFF-PNDHZVEESA-N	425.489	1.392	50	20	IDGD	
CCCCS(=O)(=O)N1CCC[C@@H]1C(=O)NNC(=O)[C@H](C)Oc1ccc(OCC)cc1	916036899	GUOBOJFZIXACQJ-MAUKXSAKSA-N	441.550	1.594	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)nn1C(C)(C)C	916096668	UNONOPMVFQGJHV-UHFFFAOYSA-N	449.533	1.042	50	20	IDGD	
Cc1nn([C@H]2CCS(=O)(=O)C2)c(Cl)c1C=NNC(=O)[C@H](C)CN1CCCCC1	916364548	PDHCSPLWUSIKNW-HIFRSBDPSA-N	429.974	1.777	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)NCc2cccc(CN3CCCC3=O)c2)c1	916415568	WOORDGQNEZMPOG-UHFFFAOYSA-N	426.473	1.970	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H](CN2CCCC2)c2ccccc2)c1	916469566	KPHFMTORLRLKDA-LJQANCHMSA-N	430.530	1.871	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCC(=O)NCc1ccccc1	916636031	NSWWROAGSBCSAO-ZDUSSCGKSA-N	449.305	1.863	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C3CCN(c4ccc5nncn5n4)CC3)n[nH]2)cc1	917178387	KCOHIYWGRLJVOZ-UHFFFAOYSA-N	445.487	1.500	50	20	IDGD	
Cc1cc(C)c(S(=O)(=O)NNC(=O)c2ccccc2F)c(C)c1NS(C)(=O)=O	917717435	QVYXCCKPLSSINU-UHFFFAOYSA-N	429.495	1.746	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)NCc2ccc(S(=O)(=O)N(C)C(C)C)cc2)n1	920235844	WSUYQAGJXRGILV-UHFFFAOYSA-N	436.538	1.059	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)[C@H]1COc2ccccc2O1)c1cccc(N2CCOC2=O)c1	920966280	JMRFHLNVCHJDFR-FZKQIMNGSA-N	426.429	1.875	50	20	IDGD	
COc1ccc(SCC(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1	921175528	HPJGWWABFNYTKA-QGZVFWFLSA-N	432.454	1.318	50	20	IDGD	
CC(=O)O[C@@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CO[Si](C)(C)C)C1)C(C)C	1779545287	AQWSVVVOKBDLLU-YFVAEKQCSA-N	442.629	1.940	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccnc(Cl)n2)C1	1779681535	FLIMSVVWNARLPK-WPKBUWHJSA-N	431.320	1.511	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3nccc(Cl)c3OC)C2)C1	1780328439	NNAQFLZCPVEKLV-ACJLOTCBSA-N	432.304	1.441	50	20	IDGD	
C[C@H](Cn1cncn1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Br)C1	1780774478	BFYATOPDQYZIJO-VMUDFCTBSA-N	446.321	1.119	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(O)ccc2F)C1	1780909684	JRQJFEPXSSIOEG-XAUMDUMWSA-N	428.888	1.913	50	20	IDGD	
O=C(CCCn1c(O)nc2ccccc21)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Cl)CCO2	1780919493	DSFTXNLBWSAKAC-FXAWDEMLSA-N	438.887	1.886	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(O)cc1F)C2	1782179076	NLTVBPYCEVTCHL-XAUMDUMWSA-N	428.888	1.913	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)N1CC[C@@]2(CN(C(=O)[C@H](F)Br)CCO2)C1	1782706249	HIBGOJXBHWNJFP-ZETOZRRWSA-N	425.251	1.068	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(OC)nn3)CCO2)C1	1783353693	ZFZPTKNIRVNIKT-SJCJKPOMSA-N	427.299	1.102	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CC[C@@]2(CN(C(=O)CCBr)CCO2)C1	1783849266	AMGXXJJUMMOSGQ-QMTMVMCOSA-N	443.338	1.357	50	20	IDGD	
COC(=O)[C@@H]1CC[C@@H](C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)Br)C[C@@H]32)C1	1784081720	BOLNZZWPABTNCT-ODICJLLRSA-N	445.354	1.339	50	20	IDGD	
CC(=O)N[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)C(C)(C)C	1784315489	UOHNWMDJECDNME-QBYUYEEZSA-N	446.386	1.302	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](C)n3cc(C)cn3)C2)C1	1784451828	NRNYQZAGOIVRQJ-VKJFTORMSA-N	427.343	1.756	50	20	IDGD	
CC(C)c1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCBr)[C@H]3C2)n[nH]1	1786406023	CQWQCIAQLCHCNI-XEZPLFJOSA-N	427.343	1.911	50	20	IDGD	
CC(=O)N/C(=C\c1ccco1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]2C1	1787450397	XDXOUAPJLSJNIW-ABBAMVGSSA-N	427.860	1.271	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)c1ccc2nccn2c1	1788052281	PQUWIQGXWNSVAA-JYJNAYRXSA-N	435.322	1.713	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc4[nH]ncc4c3)C[C@@H]21	1788764252	HDLCSIAIMMYASE-JQFCIGGWSA-N	431.569	1.403	50	20	IDGD	
COc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]3C2)n(C)n1	1789868930	SRPUDUNFTUSGEQ-MMNXLFCMSA-N	433.336	1.258	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(Cl)ncn3)C[C@@H]21)[C@@H](F)Br	1789924666	SCPYWCZQIWCNJR-LKAMGYQZSA-N	435.681	1.414	50	20	IDGD	
CCC[C@@H](NC(C)=O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](Br)CC)[C@H]2C1	1790963258	ARRUPZVZMLKXLP-VIQHNZTISA-N	446.386	1.444	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(Cl)cnc1O	1792436848	XUAAILQWFMXKRX-CLLJXQQHSA-N	444.879	1.005	50	20	IDGD	
CC(C)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1sc3nccnc3c1N)C2	1792782917	DTZAPCZWHYNPKV-PTEHBNRSSA-N	437.953	1.742	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CC(=O)OC(C)(C)C)C2	1792869034	YYFRZMOVKDPXIY-JFILPPLUSA-N	433.343	1.339	50	20	IDGD	
Cc1noc(C)c1CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2	1794134030	WLOKPDVMFIWHCV-ZSBFGKGUSA-N	428.327	1.599	50	20	IDGD	
Cc1c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)Br)C3)nc2ccccn12	1796847729	DBRWFEZWFMVUPB-MBMVNNNZSA-N	435.322	1.629	50	20	IDGD	
Cc1ccc(=O)n(C(C)(C)C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CO[Si](C)(C)C)C3)n1	1798587259	NTEZOHTYYFUWDS-BJWYYQGGSA-N	434.613	1.777	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cc([N+](=O)[O-])ccc1F)C2	1799263134	GNTVBHVIYVKZNP-ZFHGCVPZSA-N	427.860	1.883	50	20	IDGD	
CC[C@@H](CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2)NC(=O)OC(C)(C)C	1799368195	ZDBWKYNUDYINRN-KUCCMMOJSA-N	435.924	1.804	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)CBr)C2	1800637619	FLMGRFIAWATAOE-NAWOPXAZSA-N	440.176	1.781	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)n1ccnc1C)C2	1800644447	UKCIJJJHBUDLOY-GZFHQYITSA-N	427.343	1.516	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H]2[C@@H](C1)[C@@H]2C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2	1800738183	IJBYHZBQEJNCGQ-FYFPFLJLSA-N	445.919	1.223	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)c1ccccc1Cl)C2	1800762591	DUKAYRQPMDSDQZ-RWNPNPFLSA-N	445.741	1.746	50	20	IDGD	
CCOC(=O)[C@@H]1CCC[C@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](Cl)COC)C1	1800970737	ILIZIHMJOHBBAL-RFSXOUPVSA-N	444.956	1.199	50	20	IDGD	
C[C@@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCC(=O)NN(C)C)C2)[S@@](=O)c1ccccc1	1801274589	BYSQYGMHLGEHLT-UXJCKXGJSA-N	448.589	1.194	50	20	IDGD	
COC[C@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1nc(OC)ccc1[N+](=O)[O-])C2	1802274421	XNBDWAJVMMWBLF-RNJOBUHISA-N	426.857	1.504	50	20	IDGD	
COc1ccc(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CCC(=O)NN(C)C)cc1F	1802339686	JMFUPXZCQQQJEU-BJWYYQGGSA-N	434.512	1.388	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)n1cccc1C=O	1803139342	XGNDVBURQFULEW-SKWUIDRYSA-N	432.908	1.562	50	20	IDGD	
C[C@H](CC(N)=O)C(=O)N1CC[C@@H](CNC(=O)CCBr)[C@@H]1c1cccnc1	1806341710	FKRLJPOEWLYBIH-IFIJOSMWSA-N	425.327	1.384	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)C2=CCCS2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807358996	BXEOSUKJEMVYKY-FXAWDEMLSA-N	437.330	1.102	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)c3cc(O)ccc3F)CC2)C1	1809969928	VTUYNUZHAZCBRR-UHFFFAOYSA-N	440.280	1.370	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)[C@H](O)NC(=O)OCC)[C@@H]1c1cccnc1	1810089502	JOFPTUBGMOPZJW-CVYDXHPNSA-N	440.928	1.559	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H](CNC(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)c[nH]1	1810303023	OKAVKSLAJISBJY-UZLBHIALSA-N	447.499	1.350	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2cnncc2C(=O)O)[C@@H]1c1cccnc1	1810806481	SKRIKXCLJCCBTQ-JQFCIGGWSA-N	431.880	1.907	50	20	IDGD	
O=C(Cn1ccncc1=O)NC[C@@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1	1812342642	YGCGVRQHQHBFRK-HNAYVOBHSA-N	448.321	1.129	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)[C@@H]2CCCSC2)[C@H]1c1cccnc1	1814142979	YRRSPVSTFSXIRM-DBXWQHBBSA-N	447.605	1.604	50	20	IDGD	
O=C(C#Cc1ccccc1)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1	1815355203	RBMZEWIHGPEGPX-SFHVURJKSA-N	445.309	1.100	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](C)CN)n[nH]1	1817223732	OJQOCVVSKWNMBG-CKOWOVDISA-N	428.497	1.131	50	20	IDGD	
COCCn1ccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)[C@@H](Cl)COC)[nH]n2)n1	1818261678	CHTBEZMTLIYIEF-BBRMVZONSA-N	438.916	1.812	50	20	IDGD	
Cc1[nH]ccc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1818315823	CPIGOYVMRASILY-KRWDZBQOSA-N	436.476	1.664	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc(Cl)nn2)n[nH]1	1819689450	LAKLYCLFYOIOAP-CQSZACIVSA-N	448.915	1.532	50	20	IDGD	
C=C1CC(C(=O)N[C@H]2CCc3nc(NC(=O)c4cnccc4C(=O)NN)sc3C2)C1	1819791154	MKQLOKLYWSWEIS-LBPRGKRZSA-N	426.502	1.334	50	20	IDGD	
COc1ccnc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)[C@H](O)CCl)[nH]n2)c1OC	1820385934	HCNHCKYSCIOXBH-QWHCGFSZSA-N	437.884	1.728	50	20	IDGD	
CS(=O)(=O)CC(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](F)Br)n[nH]1	1820932956	WHTYQOSMYDTWLI-JOYOIKCWSA-N	425.280	1.137	50	20	IDGD	
C[C@](O)(CC(=O)O)CC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](F)Br)n[nH]1	1820937986	XLUZDBSNCMMRNV-QSGSBWRWSA-N	449.277	1.708	50	20	IDGD	
CC(C)=NO[C@@H](C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1	1820977507	ZSPISJJYWNKNQP-HOCLYGCPSA-N	435.529	1.576	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@H](O)CCl)CC2)c1nn[nH]c1C(F)(F)F	1821639614	UOGWQGFTRAVVCM-IYSWYEEDSA-N	438.819	1.106	50	20	IDGD	
C[C@@](O)(CC(=O)O)CC(=O)Nc1cc([C@H]2CCCCN2C(=O)CO[Si](C)(C)C)[nH]n1	1822410443	PQVYFTUPVLFTAF-KUHUBIRLSA-N	440.573	1.869	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC([C@@H]2CCCCN2C(=O)C2(C)COC2)CC1	1823872455	DYPBLNDCRWCGFA-PTFSYIGCSA-N	443.548	1.777	50	20	IDGD	
COC(=O)[C@@H]1CC[C@H](C(=O)N2CCC([C@H]3CCCCN3C(=O)[C@@H](O)CCl)CC2)C1	1824176526	OXWWIOCBADWBEJ-MLHJIOFPSA-N	428.957	1.795	50	20	IDGD	
C[C@H](NC(=O)c1ccccn1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](F)Cl)CC2	1824548734	KDWBDTCAFNUFMG-IMSIIYSGSA-N	439.900	1.803	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CNC(=O)c1ccco1)CC2	1825999009	LKAAJCVLWKHKFE-QWRGUYRKSA-N	440.909	1.332	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCN1CCOCC1)CC2	1825999985	ZIWDIRFSVDBABI-OLZOCXBDSA-N	430.958	1.031	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnncc1C(=O)O)CC2	1826002668	ACXSQRZXFGHHOP-GZMMTYOYSA-N	439.881	1.111	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(OC)nn1)CC2	1826003783	SUXXGAWTSKZGGE-NXEZZACHSA-N	425.898	1.421	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)CCS(C)(=O)=O)sc2C1	1827215494	ZWTQLBLXDNDFBY-DTWKUNHWSA-N	438.369	1.273	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(=O)n3[nH]nnc3n2)CC1	1827398438	BQFPPPZWXWXFHI-OAHLLOKOSA-N	449.943	1.311	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccnc3S)CCO2)C1	1829800439	YJLAZGZAKVYIQF-PXAZEXFGSA-N	444.351	1.224	50	20	IDGD	
COc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)ccc1O	1830363787	LBRYSNQLQMFJBI-OAQYLSRUSA-N	440.924	1.736	50	20	IDGD	
C[C@@H](C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2)n1ccccc1=O	1830364721	RHHYLGOHVFWHCN-HRAATJIYSA-N	439.940	1.131	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CN2CCNC2=N)CC1	1831549176	MLKAVLCJLQUASM-JKSUJKDBSA-N	442.402	1.620	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccnc(OC)c3)C2)C1	1831652074	WAEJAFAIHLZFSV-OXQOHEQNSA-N	425.913	1.568	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(CC)n(C)n3)C2)C1	1831653711	CXNVYJCKEMYQQD-OXQOHEQNSA-N	426.945	1.460	50	20	IDGD	
C[C@@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1)C1(O)CCC1	1831870170	SDSSEOJFEHGLRY-HKUYNNGSSA-N	436.597	1.530	50	20	IDGD	
O=C(/C=C/c1ccc(F)cc1F)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1	1832132460	UARKCOLOVBEAEC-VGCZDJJCSA-N	444.862	1.034	50	20	IDGD	
Cc1ccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)cn1	1833132876	OCFGVJFYCXPTMY-WMZOPIPTSA-N	444.301	1.079	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3csc(C)n3)CCO2)C1	1834459857	QZSROONGISDXMK-CXAGYDPISA-N	446.367	1.695	50	20	IDGD	
C[C@@H]1CCC[C@H]1C(=O)NC1CCN(C2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1	1835511412	RRJLVGSPHYWDPB-YLJYHZDGSA-N	435.613	1.367	50	20	IDGD	
CCc1noc(C)c1C(=O)NC1CCN(C2CCN(C(=O)[C@H](Cl)COC)CC2)CC1	1835963388	NUKDGXPLRPDRGZ-QGZVFWFLSA-N	440.972	1.984	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC(OC2CCN(C(=O)C#CC(=O)O)CC2)CC1	1836674674	WXPCTOUMFOCWHS-CYBMUJFWSA-N	429.311	1.104	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)CN3CCN(C)CC3)CC2)CC1	1836922770	PBASQZAVZWKWNB-HXUWFJFHSA-N	443.032	1.640	50	20	IDGD	
Cc1ncsc1C(=O)N1CCOC[C@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1837712038	BYQXQMZRAVPMOQ-SFHVURJKSA-N	427.599	1.373	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](NC(C)=O)C(C)(C)C)C2)C1	1839141704	QJZHIXJFJJBESK-FTRWYGJKSA-N	431.961	1.011	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3[nH]cnc3-c3cccnc3)C2)C1	1839145850	FRCJNVIJNKQBFR-HRAATJIYSA-N	447.923	1.559	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(O)c(F)c3)CCO2)C1	1839305931	NEMNVVOLAKYAPE-SGTLLEGYSA-N	445.285	1.385	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3ccc[nH]3)C2)C1	1839963946	AXEJWOHWXMGJGE-LPHOPBHVSA-N	442.354	1.577	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ncoc3C)C2)C1	1839966245	ZBJSOPPTVWIZOY-CXAGYDPISA-N	430.299	1.227	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C=C/c3cccc(C)n3)C2)C1	1840149720	YWIDHBXYFCDGMX-KGMRQTNPSA-N	437.924	1.113	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)[C@H](C)Oc1ccccc1)C2	1843417071	SOVVFEOCKCGITO-XUANBZSPSA-N	437.500	1.791	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@H]1COCCN1C(=O)OC(C)(C)C)C2	1845164509	IOMVLVJHUUACAK-GJZGRUSLSA-N	429.945	1.843	50	20	IDGD	
Cn1cnc(C(=O)N2CC3(CCCN3C(=O)[C@@H](F)Br)C2)c1C(F)(F)F	1845217552	GMXWXWZPZCIRAE-SNVBAGLBSA-N	427.196	1.946	50	20	IDGD	
C#CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)[C@@H](F)Br)C1	1845220807	OVXHOVSKKOFCPS-QWHCGFSZSA-N	446.317	1.797	50	20	IDGD	
COc1ccc(Cl)cc1CC(=O)N1CCCC12CN(C(=O)CCC(=O)NN(C)C)C2	1845921999	RUPGHMXPHJGENM-UHFFFAOYSA-N	436.940	1.468	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC2(CCCN2C(=O)[C@H]2CCCOC2)C1	1847030659	FJSHNRPBWIONJV-GJZGRUSLSA-N	429.945	1.749	50	20	IDGD	
O=C(NNC(=O)N1CCN(c2ccccc2F)CC1)c1csc(N2CCOCC2)n1	9755845	IQQAVVGNIDKRQN-UHFFFAOYSA-N	434.497	1.295	50	20	IDGD	
NS(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2ccc(COc3ccccc3)o2)cc1	9796233	LDSVKFHRRFZMDP-UHFFFAOYSA-N	444.469	1.650	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)cc1OC	11025249	KGYFDEWIENRYEG-UHFFFAOYSA-N	437.792	1.883	50	20	IDGD	
CCn1c(=O)c2ccccc2n(CC(=O)NNC(=O)CCSc2ccc(F)cc2)c1=O	12683056	QUYQGJFOPMUTSE-UHFFFAOYSA-N	444.488	1.652	50	20	IDGD	
O=C(COC(=O)[C@@H]1CC(=O)Nc2cc(F)ccc21)NNC(=O)c1ccc([N+](=O)[O-])cc1	12935418	XWBADGUNBBAFCI-CQSZACIVSA-N	430.348	1.164	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)c1ccc(N2CCOCC2)nc1	14372632	DOYKKNXPOSEPKL-ZDUSSCGKSA-N	449.305	1.909	50	20	IDGD	
CS(=O)(=O)N1CCCc2cc(C(=O)NNC(=O)Cn3cnc4ccccc43)ccc21	17404970	CZUBHSMRFQELJL-UHFFFAOYSA-N	427.486	1.210	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)c1cccc(N2CCCS2(=O)=O)c1	21302364	YYUSDILPRKYYMG-UHFFFAOYSA-N	433.486	1.465	50	20	IDGD	
CC[C@H](C)N(C)CCNC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	727230138	UCQVXJYZWXFQFH-HNNXBMFYSA-N	425.555	1.145	50	20	IDGD	
O=C(CCCc1ccccc1)NNC(=O)N1CCN(S(=O)(=O)c2ccc(F)cc2)CC1	727845966	CPKYAHCQAHYZGD-UHFFFAOYSA-N	448.520	1.896	50	20	IDGD	
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC[C@H](C(=O)NNc2nc(-c3ccccc3)no2)C1	728216599	CKDFTUMVSIZHSV-HNNXBMFYSA-N	445.505	1.621	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2ccc(F)cc2C(F)(F)F)c1	728505301	YWYQMFOAIKARCI-UHFFFAOYSA-N	440.396	1.871	50	20	IDGD	
O=C(CSCc1nc(O)c2c3c(sc2n1)CCC3)NNC(=O)Cc1cccnc1	728893098	GAPCBVMRPGDDQR-UHFFFAOYSA-N	429.527	1.904	50	20	IDGD	
COc1ccc(C(=O)N2CCN(C(=O)NNC(=O)Cn3ccc4ccccc43)CC2)cc1	729506445	CBFJJHSRPXUKSA-UHFFFAOYSA-N	435.484	1.849	50	20	IDGD	
CN1CCN([C@H](C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)c2ccccc2)CC1	729532192	UDUMEGWFAQLWIM-NRFANRHFSA-N	443.573	1.559	50	20	IDGD	
CC(C)C[C@H](C(=O)NNC(=O)COc1ccccc1O)N1C(=O)[C@@H]2CC=CC[C@H]2C1=O	730778490	IYGLNETWKHDVHH-BZUAXINKSA-N	429.473	1.284	50	20	IDGD	
CCn1c(NNC(=O)c2nnn(-c3ccc4c(c3)OCCO4)c2C)nc2ccccc2c1=O	731453535	JYNLPZNMSYGDMF-UHFFFAOYSA-N	447.455	1.834	50	20	IDGD	
C[C@@H](NC(=O)CCC(=O)NNC(=O)NC1CC1)C(=O)c1ccc(Br)cc1	732062650	HAKWKZQFOJPMFK-SNVBAGLBSA-N	425.283	1.410	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)N1CCN(C(=O)c2ccccc2OC(F)F)CC1	732196362	FOYYIPODHRSHJE-CQSZACIVSA-N	426.464	1.628	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCc2ccc(-n3cncn3)nc2)cc1Br	732241143	VLZAYYCZXQIOSJ-UHFFFAOYSA-N	446.265	1.578	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NC[C@@H]2CN3CCC[C@H]3CO2)cc1Br	732246289	PLKMITCGRBKPPM-QWHCGFSZSA-N	427.299	1.265	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@@H]2C(=O)NNc2ccccc2S(C)(=O)=O)c(OC)c1	732303524	ASJWEEDPSDDHKW-QGZVFWFLSA-N	447.513	1.855	50	20	IDGD	
O=C(CSc1nnnn1-c1ccc2c(c1)OCCO2)NNC(=O)c1ccccc1Cl	734982626	TZRPBBKOXSRUNR-UHFFFAOYSA-N	446.876	1.640	50	20	IDGD	
COc1cc2cc(C(=O)OCC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)[nH]c2cc1OC	735727343	GOSQURWZBBHDRD-UHFFFAOYSA-N	442.384	1.711	50	20	IDGD	
CN(CC(=O)NNC(=O)Cc1ccc(Cl)cc1)S(=O)(=O)c1cccc([N+](=O)[O-])c1	737767500	CUIYWXDPGDHRMG-UHFFFAOYSA-N	440.865	1.259	50	20	IDGD	
CC(=NNC(=O)COc1cccc(C)c1)c1cccc(S(=O)(=O)N2CCOCC2)c1	739399274	AXABPDCCHWGIMR-UHFFFAOYSA-N	431.514	1.935	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)N2CCN(c3nccn3C)CC2)N(C)c2ccccc21	740707077	YJVKXQSENNYJSM-UHFFFAOYSA-N	433.516	1.739	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCc2nc(-c3ccc(F)cc3)n[nH]2)cc(OC)c1OC	741412323	BBKMAMWWFUMQRO-UHFFFAOYSA-N	444.423	1.781	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=S)NCCCN2CCOCC2)cc1Cl	741867900	UMXJMNAPPFKJAW-UHFFFAOYSA-N	431.946	1.580	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)NC(C)(C)CCS(C)(=O)=O)N(C)c2ccccc21	742846754	APIBTVIBZTXVNY-UHFFFAOYSA-N	432.546	1.987	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCCN(C)CC(=O)NNC(=O)c2cccc(Cl)c2)cc1	744424293	PZLSNXJNMSGRIL-UHFFFAOYSA-N	438.937	1.320	50	20	IDGD	
O=C(COC(=O)c1ccnc(OCC(F)(F)F)c1)NNC(=O)c1ccc([N+](=O)[O-])cc1	745113725	VFVWCSTVFLKQGC-UHFFFAOYSA-N	442.306	1.549	50	20	IDGD	
O=C(NC[C@@H](c1ccccc1)N1CCOCC1)NNC(=O)c1cc([N+](=O)[O-])ccc1O	745512973	NPRRIAPBPBXWDZ-KRWDZBQOSA-N	429.433	1.318	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)O[C@@H](C)C(=O)N(C)C)cc1	746159815	MQXSMRHXVODJDT-HNDQUVLASA-N	439.472	1.361	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)CC[C@H]2NC(=O)N(c3cccc(C)c3)C2=O)c1	746307216	PBSUVZMROQEONB-QGZVFWFLSA-N	438.444	1.015	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)N[C@H]1CCCN(CC(F)(F)F)C1=O	746340127	VJYHWGDPRQPVAO-LBPRGKRZSA-N	440.382	1.075	50	20	IDGD	
CCCC[C@@H](/N=C1/NS(=O)(=O)c2ccccc21)C(=O)NNC(=O)c1ccc(C#N)cc1	747174311	HMANVBKIHWWDTK-QGZVFWFLSA-N	439.497	1.617	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)c2cc3c(N(C)C)ncnc3n2C)cc1	747199703	UQZFKOIBTSTUBM-ZDUSSCGKSA-N	426.477	1.662	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)c2ccc(Cl)c(NS(C)(=O)=O)c2)cc1	747207277	ZXWVBMKQDNKXFK-UHFFFAOYSA-N	426.882	1.593	50	20	IDGD	
Cc1nc(C(=O)NNC(=O)c2cccc3ccccc23)nn1-c1n[nH]c(C(F)(F)F)n1	747405668	QKUXBLLTDQPYIC-UHFFFAOYSA-N	430.350	1.941	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)CSCC(=O)c1ccccc1	748552021	APKPPLXPSCSUSU-UHFFFAOYSA-N	440.569	1.962	50	20	IDGD	
NS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2Cl)cc1	748554715	FCUFEJFTDPLIMK-UHFFFAOYSA-N	431.257	1.041	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)N[C@H](c1ccccc1)c1cccc(S(C)(=O)=O)c1	748636068	IRJGDBOEFPCBNP-HNAYVOBHSA-N	449.529	1.561	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)NCc2ncc(C)o2)cc1	750071421	AXCRNDYQNQPBEP-SXGWCWSVSA-N	434.456	1.954	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)N[C@H]2CC(=O)N(C(C)C)C2)c2ccccc2c1=O	750644960	HAJDMHVGKDXUSU-HNNXBMFYSA-N	442.520	1.540	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N[C@@H]1CC(=O)N(C(C)(C)C)C1	750660172	PGCQRRRAVIJXHQ-DGCLKSJQSA-N	441.326	1.946	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCC1(CS(C)(=O)=O)CC1	752001549	DLTHERZFIOPEGN-NSHDSACASA-N	448.339	1.372	50	20	IDGD	
COc1cc(OC)cc(N2C[C@@H](C(=O)NNC(=O)Cn3ccc4ccccc43)CC2=O)c1	752309620	HWJHBMVAEPKKJZ-INIZCTEOSA-N	436.468	1.859	50	20	IDGD	
CO[C@H](C)c1nc(CN2CCCN(CC(=O)NNC(=O)c3cccs3)CC2)cs1	752356134	USDGPHLJJOMYSQ-CQSZACIVSA-N	437.591	1.881	50	20	IDGD	
COc1ccc(N(CCC(=O)NNC(=O)CO)S(=O)(=O)c2ccc(C)c(C)c2)cc1	753437725	AGTCCOIMXGTFCA-UHFFFAOYSA-N	435.502	1.037	50	20	IDGD	
CN1C(=O)c2cccc3c(S(=O)(=O)NNC(=O)COc4ccccc4O)ccc1c23	753831254	LGABKNXNGUKVHG-UHFFFAOYSA-N	427.438	1.524	50	20	IDGD	
Cc1ccc(N(C)S(=O)(=O)c2cccc(C(=O)NNC(=O)Cc3cc[nH]n3)c2)cc1	755278825	FIGFOYAGAAUXRW-UHFFFAOYSA-N	427.486	1.547	50	20	IDGD	
COc1ccc(C(F)(F)C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)cc1	755936703	IRZZMBBDDWJSQO-UHFFFAOYSA-N	441.456	1.951	50	20	IDGD	
O=C(NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)Nc1cccc2c1OCCO2	756149691	IBSZXBDYBAFBMA-UHFFFAOYSA-N	446.485	1.709	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)Nc1cccc(CSC2CCOCC2)c1	756594242	QEAAVEHLXAMZKZ-AWEZNQCLSA-N	427.548	1.686	50	20	IDGD	
Cn1cc(-c2nc3ccccn3c2NC(=O)NNC(=O)c2ccc3c(c2)OCCO3)cn1	757667761	YNCBPWJCFVFUAT-UHFFFAOYSA-N	433.428	1.973	50	20	IDGD	
COC(=O)c1cnc(C(=O)NNc2ccc(S(=O)(=O)Nc3ccccc3)cc2)cn1	758016438	GEXGRFRFHHHRKX-UHFFFAOYSA-N	427.442	1.821	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)Nc2cccc3c2CCN3S(C)(=O)=O)o1	758295761	IOSVMAIMWCFOFB-UHFFFAOYSA-N	449.533	1.910	50	20	IDGD	
O=C(c1cnc(-c2ccccn2)s1)N1CCN(S(=O)(=O)CBr)CC1	758522363	HAASWVWKVKRASX-UHFFFAOYSA-N	431.337	1.645	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)N[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1C#N	758772104	PLKBUTVGCPMQBC-KBPBESRZSA-N	433.465	1.163	50	20	IDGD	
COCCS(=O)(=O)c1ccc(CNC(=O)NNC(=O)COc2cc(C)ccc2C)cc1	759384813	WWFTWCLPSLPSKE-UHFFFAOYSA-N	449.529	1.633	50	20	IDGD	
CN(C)C1CCN(CCNC(=O)NNC(=O)c2ccc(COc3ccccc3)o2)CC1	759587160	HCLSZDDTIHYYPZ-UHFFFAOYSA-N	429.521	1.829	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(N2CCOCC2)c(C(=O)N2CC=C(C#N)CC2)c1	760003593	LZDZFWSYYMELRT-UHFFFAOYSA-N	432.546	1.850	50	20	IDGD	
CCC(=NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1ccc(C(=O)O)cc1	760216658	SFLOXZBUXQSIKS-UHFFFAOYSA-N	445.497	1.950	50	20	IDGD	
CS(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)cc1F	760333820	ADHXKZREXQWHHO-UHFFFAOYSA-N	430.523	1.755	50	20	IDGD	
CCOC(=O)c1cc(S(=O)(=O)NNC(=O)NCc2cccc(C(F)(F)F)c2)cn1C	760512795	WPUUKOGBJBYVEY-UHFFFAOYSA-N	448.423	1.913	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2ccn3ccnc3c2)c1	762396414	DJOOYHBGTPOFGG-UHFFFAOYSA-N	444.517	1.509	50	20	IDGD	
CN(C)C(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)ccc1F	763602233	XNLWSDILMSBTHL-UHFFFAOYSA-N	438.419	1.317	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2c(C)nc3ccccn23)cc1OCC(F)F	763629481	LWFAGNKLVRYSNL-UHFFFAOYSA-N	431.399	1.995	50	20	IDGD	
CCc1nnc(-c2ccc(NC(=O)C(=O)NNC(=O)CN3CCCc4ccccc43)cc2)o1	763734718	NGWIYVQWWYENLF-UHFFFAOYSA-N	448.483	1.838	50	20	IDGD	
CC(C)Oc1ccc(NC(=O)C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c(F)c1	763789798	DKFOXCMQLCRDQB-UHFFFAOYSA-N	441.419	1.260	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2c[nH]nc2-c2ccccn2)cc1	763876523	GKCZQZPUZPAAKQ-CYBMUJFWSA-N	436.428	1.228	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)cccc1N1CCOC1=O	763977924	BGIWPMPBPZVCTE-UHFFFAOYSA-N	432.820	1.710	50	20	IDGD	
CN(C)CCCOc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1	764005955	GVRJQRKWMLIYOB-UHFFFAOYSA-N	442.472	1.188	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc(N2C[C@H](C)O[C@@H](C)C2)nc1	764039961	AEHFJGHNDXDTEX-KBPBESRZSA-N	427.461	1.104	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(F)cc2C(F)(F)F)c1	764076601	CMPQXDQBMXRYKU-UHFFFAOYSA-N	447.366	1.648	50	20	IDGD	
CCN(C(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc(C)[nH]n2)cc1)c1ccccc1	764106618	NKLAGSAAPHSZHH-UHFFFAOYSA-N	448.483	1.713	50	20	IDGD	
COC(=O)Nc1cc(NC(=O)C(=O)NNC(=O)CCc2ccc(OC)cc2)ccc1F	764126794	JCDRQYMSXKULQR-UHFFFAOYSA-N	432.408	1.731	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(OC[C@@H]3CCCO3)cc2)c1O	764133937	ZFYVYDDGXUCYCU-HNNXBMFYSA-N	429.429	1.358	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(C(=O)OC)ccc2F)o1	764139540	XNXDDCMROIBDNF-UHFFFAOYSA-N	434.424	1.447	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)cc(OC)c1C(C)C	764153164	JPIUXQPOUDYPHW-GOSISDBHSA-N	427.457	1.917	50	20	IDGD	
Cc1ncsc1C(=O)NNC(=O)C(=O)Nc1cnn(-c2ccccc2Br)c1	764245378	FYRRMWCOOCXJRP-UHFFFAOYSA-N	449.290	1.799	50	20	IDGD	
COC(=O)CCc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(OC(F)F)c2)cc1	764250650	LELFWBBQOSXHOB-UHFFFAOYSA-N	435.383	1.793	50	20	IDGD	
O=C(Cc1ccccn1)NNC(=O)C(=O)Nc1cccc(C[S@](=O)c2ccccc2)c1	764267979	XSTKKBQZJSBZHR-HKBQPEDESA-N	436.493	1.718	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)COC/C=C\c3ccccc3)cc2)CC1	764322920	YTLGWDZTZKFUIO-YVMONPNESA-N	444.557	1.796	50	20	IDGD	
O=C(CCn1nnc2ccccc2c1=O)NNc1c(F)cc(C(=O)NC2CC2)cc1F	764328795	MOGLAQWNYFNBFD-UHFFFAOYSA-N	428.399	1.495	50	20	IDGD	
C[C@H]1CCCCN1C(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cnn(C)c2)cc1Cl	764362719	HHYYPLCRQQWYNX-LBPRGKRZSA-N	446.895	1.488	50	20	IDGD	
CO[C@@H](CNC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)c1ccccc1Cl	764374990	PEGFIZZENDOYJK-INIZCTEOSA-N	429.864	1.919	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)N[C@@H]1CCC(F)(F)C1	764379707	VDOZVYXJJJFQLH-CQSZACIVSA-N	430.477	1.993	50	20	IDGD	
CCN1CCC(=NNC(=O)CN2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)[C@H](C)C1	764818388	KVMBWATXWWXKQO-GOSISDBHSA-N	435.594	1.135	50	20	IDGD	
CCCCN(C)S(=O)(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	765118883	HUBGHJDTRUTOHK-UHFFFAOYSA-N	431.990	1.055	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc(F)cc1)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	765606573	BSOHAGINILEYMN-UHFFFAOYSA-N	449.439	1.485	50	20	IDGD	
COc1ccc(CN2CCCN(C(=O)NNC(=O)c3ccccc3OC)CC2=O)cc1	767319002	DELRSZUTHNWXJS-UHFFFAOYSA-N	426.473	1.793	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)CNC(=O)NCc1ccc(Cl)cc1	767328215	DHHQMIRTRIJMKJ-UHFFFAOYSA-N	446.891	1.381	50	20	IDGD	
COCCOCCS(=O)(=O)NC(=O)/C(C#N)=C/c1cc(C)n(C[C@H]2CCCO2)c1C	768220444	RAYSFMSRQQUWMY-TVNWYLLRSA-N	439.534	1.300	50	20	IDGD	
CC(C)(O)C(=O)NNC(=O)c1cccc(NS(=O)(=O)c2ccc3c(c2)OCCCO3)c1	768243110	DTPPPPCPUIMGPA-UHFFFAOYSA-N	449.485	1.181	50	20	IDGD	
C[C@]1(NNC(=O)N[C@H]2CC(=O)N(Cc3ccccc3C(F)(F)F)C2)CCS(=O)(=O)C1	768519195	LUVMHOAOGFAJQJ-GUYCJALGSA-N	448.467	1.187	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)c3ccc(S(=O)(=O)N(C)C)nc3)n[nH]2)cc1	770244298	JDOKWTVGOUVJNH-UHFFFAOYSA-N	442.501	1.359	50	20	IDGD	
CNC(=O)COc1cccc(CNC(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)c1	770293881	VZLKLFNUJPZYFS-ZDUSSCGKSA-N	434.880	1.763	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)c3cccc(NS(=O)(=O)c4cccs4)c3)nc21	770972858	JUXRLGKPKUBSDU-UHFFFAOYSA-N	445.486	1.688	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)c1ccc(I)c(O)c1	772322702	XGIHOIJUZHRPPF-SECBINFHSA-N	434.230	1.736	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1)C(=O)Nc1ccc(F)cn1	773544163	YEFXTJFZCGZAHO-HXUWFJFHSA-N	447.470	1.934	50	20	IDGD	
O=C(NNC(=O)C(F)(F)Oc1ccccc1)C(=O)Nc1ccc(Br)cn1	773544393	DGEZGEKWXPWPCH-UHFFFAOYSA-N	429.177	1.602	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C2=NN(c3ccc(F)cc3)C(=O)CC2=O)c1	773709657	MMMVZTSKSXFYHK-UHFFFAOYSA-N	426.404	1.331	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)[C@@](N)(c1ccccc1OC)C(F)(F)F	776107682	PSBNCFRTKWZEKD-SFHVURJKSA-N	426.395	1.680	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)[C@@H]2CCCN2C(=O)c2ccc3c(c2)OCO3)c1	776533421	NIMUXJYFIKNAFI-INIZCTEOSA-N	431.470	1.567	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)[C@@H]2CS[C@@H](Cc3ccccc3F)C(=O)N2)c1	776714486	GWQGMWKSYSCEKH-IRXDYDNUSA-N	437.518	1.515	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)[C@@H]2CCCN(C(=O)COc3ccccc3)C2)nc1C	778421448	ATVZXWWQWCSYJD-MRXNPFEDSA-N	441.488	1.722	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)NCCc1cc(Cl)c2c(c1)OCCO2	778585558	RQDGVVMNIGKOGA-UHFFFAOYSA-N	428.873	1.509	50	20	IDGD	
CC(=O)N1CCN(c2ccc(C(=O)NNc3cc(Cl)nc(N)n3)cc2[N+](=O)[O-])CC1	779373351	HLBYAJUBIIRPGE-UHFFFAOYSA-N	434.844	1.046	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)[C@@H](NS(=O)(=O)c1ccc(C)cc1)[C@H](C)O)c1ccccc1	779515778	BKQMRXYBGOHGJU-SNRMKQJTSA-N	433.530	1.364	50	20	IDGD	
Cc1ccc(C(F)(F)C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)cc1	780519486	CGKKRAIXVDALTB-UHFFFAOYSA-N	439.488	1.561	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)N1CCC[C@@H](n2ccc(C(F)(F)F)n2)C1	782503856	LJSFVVLKUDNMRK-LLVKDONJSA-N	428.371	1.303	50	20	IDGD	
CCOc1cccc2[nH]cc(CC(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)c12	782653949	JZNZXDHKDJCMNJ-UHFFFAOYSA-N	444.513	1.821	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)CNC(=O)c1ccc([N+](=O)[O-])c(C)c1	782759038	WHQVVLPXRUBJJI-UHFFFAOYSA-N	432.458	1.581	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)c(C)c1F	782911457	ZUHRZWDYKYTIEG-UHFFFAOYSA-N	444.510	1.368	50	20	IDGD	
COC(=O)CNC(=O)Cc1ccc(NC(=O)C(=O)NNc2cccc3c2CCCC3)cc1	783451087	RYXFXBLPPXXUPF-UHFFFAOYSA-N	438.484	1.479	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2cnc3c(c2)CN(C(=O)OC(C)(C)C)CC3)ncn1	783948014	PROIRFLXINRCIZ-UHFFFAOYSA-N	427.465	1.555	50	20	IDGD	
CC(C)Oc1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)cn1	784210297	MHUURYPTSUYCQH-UHFFFAOYSA-N	433.490	1.391	50	20	IDGD	
N#Cc1ccc(NNC(=O)C(=O)Nc2ccc3[nH]nc(C(N)=O)c3c2)cc1C(F)(F)F	784237929	ZVGCXIOPAJSRQE-UHFFFAOYSA-N	431.334	1.634	50	20	IDGD	
O=C(COC(=O)c1cccc(C(=O)NC2CC2)c1)NNC(=O)c1ccc([N+](=O)[O-])cc1	784260975	HUHIHZIJLIWIJE-UHFFFAOYSA-N	426.385	1.105	50	20	IDGD	
COCCn1ccc(C(=O)NNC(=O)[C@@H]2Cc3ccccc3CN2Cc2ccccc2)n1	784377661	GVYPNENSPNTOBZ-QFIPXVFZSA-N	433.512	1.918	50	20	IDGD	
CN(Cc1cccc(NC(=O)C(=O)NNc2ccc(Cl)nn2)c1)C(=O)C(F)(F)F	784788978	BQKQUCSWSGZZFI-UHFFFAOYSA-N	430.774	1.733	50	20	IDGD	
CNS(=O)(=O)c1ccc(C)c(NC(=O)C(=O)NNc2cccc(C(F)(F)F)n2)c1	784952018	DYJCPDPNKMPYKU-UHFFFAOYSA-N	431.396	1.399	50	20	IDGD	
O=C(NNc1c(F)cc(F)cc1Br)C(=O)Nc1ccc(-n2cncn2)nc1	785011202	VCLUKRGYSMSIAN-UHFFFAOYSA-N	438.192	1.785	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1cccc(S(=O)(=O)Nc2ccccc2F)c1	785417057	LGEMTLQZERGXRP-GFCCVEGCSA-N	437.449	1.729	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)C(C)(C)S(=O)(=O)C2CC2)cc1	785682319	NNRCMAGPGUJBQZ-UHFFFAOYSA-N	437.547	1.224	50	20	IDGD	
O=C(COC(=O)CNS(=O)(=O)c1ccc2ccccc2c1)NNC(=O)c1cccs1	785866718	UINNNKLMOKQSJP-UHFFFAOYSA-N	447.494	1.184	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1cc(Br)c(F)cc1F	786417101	KMIRVBNTQCODGQ-UHFFFAOYSA-N	444.188	1.598	50	20	IDGD	
CCN1CCCN(C(=O)NNC(=O)[C@@H]2Cc3ccccc3CN2Cc2ccccc2)CC1=O	787263904	YMKDNECQIVKMGU-QFIPXVFZSA-N	449.555	1.909	50	20	IDGD	
CS(=O)(=O)c1cc(NC(=O)C(=O)NNC(=O)COCc2ccccc2)ccc1Cl	788333334	LQNQNOFBTKOFOF-UHFFFAOYSA-N	439.877	1.046	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NN=Cc1ccc(Br)cc1N1CCOCC1	788713430	YJKWIZGORMXPSJ-UHFFFAOYSA-N	435.278	1.759	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)N1CCC[C@H](N2CCCS2(=O)=O)C1	789842011	SQWZBFWMCXKCAM-HIFRSBDPSA-N	444.941	1.348	50	20	IDGD	
Cc1ccn(C[C@](C)(O)C(=O)NNC(=O)c2sc(-c3ccccc3)nc2C)c(=O)c1	790484011	CBUNZDVMPOAHFC-NRFANRHFSA-N	426.498	1.801	50	20	IDGD	
CO[C@H]1CCOc2c(NC(=O)C(=O)NNC(=O)CSc3ccccc3O)cccc21	790952520	NNCHGHNNYIOSDH-HNNXBMFYSA-N	431.470	1.740	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N2CCOCC2)cc1NC(=O)NNc1ncccc1C	792207572	CQBMHIFUNFIHOF-UHFFFAOYSA-N	435.506	1.958	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)[C@H]2CC(c3cc(OC)ccc3OC)=NO2)cc1	792630269	UOBFRXPMIDJEMH-LJQANCHMSA-N	428.445	1.465	50	20	IDGD	
CN(C)N(C(=O)c1c(O)cnc2c(Br)cccc12)[C@H]1CCS(=O)(=O)C1	792855739	SNMVAFNSGRXQNR-JTQLQIEISA-N	428.308	1.809	50	20	IDGD	
COc1ccc(C(=O)N2CCN(C)CC2)cc1NC(=O)C(=O)NCCSSC	793079144	VLODNAIEBCTTLA-UHFFFAOYSA-N	426.564	1.149	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)[C@H](O)[C@@H](O)c2nc3ccccc3s2)cc1	794717602	QPEJRUWHVKRDAI-HZPDHXFCSA-N	436.515	1.084	50	20	IDGD	
CN(C)Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)ccc1Cl	799256966	CLFKJDUHOFKXIF-UHFFFAOYSA-N	429.864	1.438	50	20	IDGD	
CCn1ncc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)c1C(F)(F)F	799258649	JIKMYXCWRRKZIA-SECBINFHSA-N	431.346	1.614	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CCCC(=O)c2ccc3c(c2)OCCO3)cc1	801109020	YLGZSLDLGWBTMW-UHFFFAOYSA-N	425.441	1.905	50	20	IDGD	
O=C(N=c1cc[nH]cc1)NNC(=O)[C@H]1CCCN1C(=O)c1ccc(Br)cc1	802024849	WWUZCEJVTMMFIR-OAHLLOKOSA-N	432.278	1.724	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Nc2ccc3c(c2)OCO3)cc(Cl)c1OCC(N)=O	802106321	AOMVMKTWPCUMBO-UHFFFAOYSA-N	436.808	1.408	50	20	IDGD	
N#CCCn1cc(/C=C(\C#N)C(=O)N2CC[C@](O)(C(N)=O)C2)c(-c2ccc(Cl)cc2)n1	803163897	DTBWWBAKDDBXGH-XISXUPMFSA-N	438.875	1.473	50	20	IDGD	
CN(C)CCn1ncc(C(=O)NNC(=O)c2nnc(O)c3ccccc23)c1-c1ccccc1	806273129	QYQLISQOEXYDGI-UHFFFAOYSA-N	445.483	1.835	50	20	IDGD	
O=C1COC[C@H](C[C@H]2CN(C(=O)C(=O)NNc3cccnc3Cl)c3ccccc32)N1	807013439	RSNPNOJKMJOVMY-STQMWFEESA-N	429.864	1.214	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)(F)F)cc1)[C@H]1CCCN1C(=O)C(F)(F)F	807120206	CVPMQWHDTSHPBV-SNVBAGLBSA-N	433.330	1.977	50	20	IDGD	
CS(=O)(=O)CCOc1ccc(Cl)cc1NC(=O)C(=O)NNc1ncccc1F	807300182	CFOLJWQYXCGLKE-UHFFFAOYSA-N	430.845	1.379	50	20	IDGD	
CCCS(=O)(=O)c1ccccc1S[C@H](C)C(=O)NNC(=O)N1CCN(C)CC1	807380132	PRQNMQXZVFXXPM-CQSZACIVSA-N	428.580	1.339	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2nccnc2C2CCC2)cc1C(=O)N1CCOCC1	807459863	HHXZLCDAWIMLRL-UHFFFAOYSA-N	438.488	1.607	50	20	IDGD	
CCc1nnc(NC(=O)[C@@H](C)[C@H](C)NC(=O)NNC(=O)COc2ccccc2C#N)s1	807566113	SFSOZBROQIOKTK-RYUDHWBXSA-N	445.505	1.345	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNc2ccc(-n3ccnc3)nn2)cnn1-c1ccc(Cl)cc1	808944256	HTOZIHQXJHRLFW-UHFFFAOYSA-N	437.851	1.892	50	20	IDGD	
Cc1cc(C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c2cnn(C(C)C)c2n1	809109524	VAKVFWNKSOJKIQ-UHFFFAOYSA-N	440.416	1.847	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)NCC(=O)NNc2ccnc(Br)c2)cc1	811124138	XUPICZBARMNNQX-UHFFFAOYSA-N	442.295	1.224	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)c2ccc(Cl)c(N3CCNC3=O)c2)cc1	812729568	RDEPGDSBLPEISD-UHFFFAOYSA-N	437.909	1.877	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2nn(-c3ccccc3)c3c2CCC3)n1	812860055	UWXZJJOMVPPSAE-UHFFFAOYSA-N	439.497	1.673	50	20	IDGD	
Cn1ncc(C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c1I	815600648	ZTNFDNHFVAICTN-UHFFFAOYSA-N	436.213	1.285	50	20	IDGD	
C[C@@H]1Cc2c[nH]nc2[C@@H](C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)C1	816829933	JYNITXFPNPLPQO-DYVFJYSZSA-N	431.518	1.321	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCCc2nnc3n2CCCCC3)cc(OC)c1OC	914534637	CMCQMFOEMYMANS-UHFFFAOYSA-N	432.481	1.217	50	20	IDGD	
CC(C)Cc1ccc(S(=O)(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1	914746695	VSQFKJCQCNXOPS-UHFFFAOYSA-N	445.950	1.809	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C2CCN(CC(F)(F)F)CC2)c2ccccc2c1=O	915657972	BCWKZCKSIIHNLE-UHFFFAOYSA-N	425.411	1.452	50	20	IDGD	
O=C(NNC(=O)c1cc2c(nc1O)CCC2)c1cccc(S(=O)(=O)N2CCCCC2)c1	916096086	GFLXBOQWSSCSPH-UHFFFAOYSA-N	444.513	1.525	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1cccc(N2CCOC2=O)c1	916134236	IPVIXABSXUADDP-UHFFFAOYSA-N	431.474	1.320	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NC[C@@H](C(C)C)N2CCOCC2)nc1	916254052	FPZRQVQBANRZDQ-KRWDZBQOSA-N	442.586	1.095	50	20	IDGD	
CCNC(=O)COc1ccc(CNC(=O)NNC(=O)c2cccc(N(C)C)c2)cc1OC	916389078	NMTILABDOHONEC-UHFFFAOYSA-N	443.504	1.420	50	20	IDGD	
O=C(COc1ccccc1CNC(=O)NNC(=O)c1ccccc1)NC[C@H]1CCCO1	918217090	ZCPKNWSZRQVPJU-GOSISDBHSA-N	426.473	1.505	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)c1ccccc1)C(=O)NNC(=O)c1ccc(C)cc1O	918338643	JSCJWEZRFLZFGM-MRXNPFEDSA-N	437.543	1.562	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)CCc2c(C)nc3c(c(OC)nn3C)c2C)c1O	919755794	GRGFFSFXVDCVPE-UHFFFAOYSA-N	427.461	1.702	50	20	IDGD	
CO[C@H](C)c1nc(CNC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)cs1	1252692334	WULGJMFHIUUEIX-SNVBAGLBSA-N	427.508	1.790	50	20	IDGD	
O=C(NNC(=O)c1c[nH]c(Br)c1)c1ccc(S(=O)(=O)N2CCCC2)cc1	1318499086	ORGBJENWRGVBAV-UHFFFAOYSA-N	441.307	1.637	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NC2CCC3(CCOCC3)CC2)c1	1319014958	BZPOXIASTOYDSD-UHFFFAOYSA-N	438.550	1.620	50	20	IDGD	
CC[C@@]1(C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)CCN(C(=O)OC(C)(C)C)C1	1319364880	CUODAKVUTGLYNY-HXUWFJFHSA-N	443.545	1.879	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnc4ncccn34)C2)C1	1777930966	BHZAKHYCQWPETG-QZTJIDSGSA-N	426.304	1.409	50	20	IDGD	
Cn1ncc2cc(C(=O)N3CC[C@@]4(C3)CN(C(=O)[C@H](F)Br)CCO4)ccc21	1778021554	UFFPGBGEMPPBIY-MAUKXSAKSA-N	439.285	1.707	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3n[nH]c4ccc(F)cc34)C2)C1	1778623192	UQNJYWBBKFXYJU-BBATYDOGSA-N	439.285	1.929	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](C)n3ccccc3=O)C2)C1	1779267623	AKVOMYPAFRLDHH-DEYYWGMASA-N	426.311	1.023	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](N)c1ccccn1)C2	1779543477	CWHVPKKIRSLEBI-YFVAEKQCSA-N	434.613	1.447	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CN1CCCCC1)C2	1779544026	WEPXGKQHVYWYQO-WIYYLYMNSA-N	425.646	1.838	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cccc(C#N)c3Cl)C2)C1	1780192122	GGPUJSGUJCDAOQ-KXBFYZLASA-N	426.300	1.909	50	20	IDGD	
CC(C)(C)n1cc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)nn1	1780354217	FELHCDWECHCRIO-ROUUACIJSA-N	432.352	1.713	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccnc(Cl)n1)C2)[C@@H](F)Br	1780775082	XZBLDYJDMYBBFD-XHBSWPGZSA-N	449.708	1.948	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3nc(OC)ccc3[N+](=O)[O-])CCO2)C1	1781218559	NUFNNZGKVJLUEG-KPZWWZAWSA-N	426.857	1.459	50	20	IDGD	
O=C(Cc1noc2ccccc12)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781331592	SNFKQOJUVALFKV-SJLPKXTDSA-N	440.269	1.891	50	20	IDGD	
Cc1cccn2ncc(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)[C@H](O)CCl)C4)c12	1781413309	MNWISSXNGXGZFT-CBGDNZLLSA-N	434.924	1.370	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1ncccn1)C2	1781996850	VPFKTHBOYCYUNM-HBUWYVDXSA-N	425.327	1.316	50	20	IDGD	
CC(C)CNC(=O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)Br)C1	1781998536	AYXACBZKOCLCJL-HBUWYVDXSA-N	432.359	1.056	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc3nonc3c1)C2	1782172937	QZFPIRXFLCFLPI-WIBUTAKZSA-N	436.896	1.604	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H]2CCNC(=O)C2)C1	1782273633	IWYVBRINUZGFFA-DEXNDLTESA-N	444.370	1.200	50	20	IDGD	
CCOC(=O)N1CCC(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](F)Cl)C3)CC1	1783130337	IEEFPOGLIHNVCN-JXXFODFXSA-N	447.935	1.903	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cn(C)nc3C(F)F)CCO2)C1	1783347553	LALBVWKKLICJEB-YVEFUNNKSA-N	449.296	1.975	50	20	IDGD	
C=C(Oc1ccccc1O)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](C)Br)C2)C1	1783533897	BBGJOKXIGYSGSY-BFUOFWGJSA-N	439.306	1.898	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3snnc3C3CC3)CCO2)C1	1783534358	ICRMKDAAQZGGIJ-QFYYESIMSA-N	429.340	1.642	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(-c4cc[nH]n4)cc3)CCO2)C1	1783882083	VBYHGKFNDVBFER-UWJYYQICSA-N	432.908	1.774	50	20	IDGD	
CC[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)N(CC)CC	1784623234	JODMPGORBXVTFJ-NXOAAHMSSA-N	432.403	1.872	50	20	IDGD	
COc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)CBr)C[C@@H]32)n(C)n1	1785614119	PIMLITIKPPEDIY-OSFYFWSMSA-N	443.342	1.053	50	20	IDGD	
COc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]32)n(C)n1	1785615453	LYBVXAWZVRUFSK-XBPIAWKYSA-N	433.336	1.258	50	20	IDGD	
CN1CCCC[C@H]1C(=O)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1	1786151317	NDTJJVJDWQRKDZ-NRFANRHFSA-N	435.333	1.598	50	20	IDGD	
C[C@@H](CNC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]2C1	1787443754	SEYZEUXHSAUVTM-YYFQZIEXSA-N	435.924	1.661	50	20	IDGD	
O=C1COc2ccc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]4C3)cc2N1	1787446285	ABJIXQYCDGIRDZ-WXRXAMBDSA-N	425.844	1.145	50	20	IDGD	
COc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)CBr)C[C@@H]32)nc1	1787757559	MCQWVBSTHPLQOH-HPZZRFSDSA-N	440.338	1.715	50	20	IDGD	
COCc1oncc1C(=O)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1	1788141016	BQXDEDNPCBTSMG-UHFFFAOYSA-N	449.272	1.562	50	20	IDGD	
Cc1cccc(C)c1SCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21	1788760112	YVQSFFXTMBNSDH-FJIDUMEYSA-N	440.993	1.975	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)COc3ccccc3F)[C@H]2C1	1790968142	QQIMGPTVLUDGTI-AFIMGQEJSA-N	428.888	1.438	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CCc4ccccc4O3)C[C@@H]21	1791257823	VCQXBULVGHNHAB-OIGVQNGMSA-N	436.936	1.614	50	20	IDGD	
Cc1cc(C)n2ncc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]4C3)c2n1	1791294757	HVLMTPWOVIEMGB-QEJZJMRPSA-N	440.331	1.743	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3ccc(F)cc3OC)[C@H]2C1	1792305725	RKLRKICELLBULR-RMRDIRSESA-N	442.915	1.610	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(N2CCN(C)CC2)cc1	1792531539	XIXCRQPWWLNMGP-GFOJFJKKSA-N	448.995	1.944	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cn3ccsc3n1)C2	1792870703	IYHBTGHPSBEICE-FMSGJZPZSA-N	441.351	1.630	50	20	IDGD	
COc1cc(C#N)cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCBr)c1	1795114888	IREKDSLYLUTQBW-JLVBRIDZSA-N	436.306	1.555	50	20	IDGD	
Cn1c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Cl)C3)cc2c1-c1ncccc1OC2	1795936184	LMRGGYLWPDNKOR-AODNKKSCSA-N	448.882	1.717	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C[C@@H](C)NC(=O)OC(C)(C)C	1796390701	WAUJJWSOOUTGSR-LFYQSXPISA-N	447.960	1.133	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)c1cccnc1-c1ccc(F)cc1	1798703456	SEDBMAODZIOWCS-WTLGNFPFSA-N	447.894	1.691	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)[S@](=O)c1ccccc1)C2	1799272414	QHTFOIHCJSFEOA-HGRCCOKLSA-N	426.966	1.790	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(F)c(F)cc1F)C2)[C@@H](F)Br	1799348452	HEKMFMYANTVWCQ-QYOFDKIESA-N	439.203	1.998	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1c(F)cccc1Cl)c1cccc(B(O)O)c1	1799540385	WZBCBJSVRPZYCQ-MUJYYYPQSA-N	430.672	1.725	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cccnc1Cl)C2	1800756459	DCPDRZFAILLUGS-IKVITTDRSA-N	430.730	1.651	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@]1(F)CCCCC1(F)F)C2	1800978075	LDKZAPDVQIDCOF-RFJMFJJWSA-N	426.863	1.747	50	20	IDGD	
COc1cc(F)ccc1CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)Br)C2	1802181339	CGEBAGNECVMGFU-NASWQRNTSA-N	443.313	1.750	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2c(F)ccc(O)c2F)[C@@H]1c1cccnc1)[C@H](O)CCl	1803141795	UJEQUEIJKNUMQM-WBHUJUFNSA-N	439.846	1.985	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1CCOC1	1803235803	VHUDFIPOZVFGSW-JONQDZQNSA-N	431.445	1.808	50	20	IDGD	
CC(=O)N(C)CCC(=O)NC[C@H]1CCN(C(=O)CO[Si](C)(C)C)[C@@H]1c1cccnc1	1804069735	KVCYKQNDJJSMCY-WIYYLYMNSA-N	434.613	1.807	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@H](CNC(=O)CN2CCOCC2)[C@@H]1c1cccnc1	1806909890	ZMVJVPBIJZRKBS-QRFRQXIXSA-N	443.375	1.656	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)C(=O)N(C)C)[C@@H]1c1cccnc1	1806946725	PYMQQZQZNFXXSG-KKUMJFAQSA-N	425.327	1.349	50	20	IDGD	
CC1(C)CC(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)C1	1807363775	BPIKKJJQZQBVKS-GHTZIAJQSA-N	435.333	1.517	50	20	IDGD	
CC1(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)CCCC1	1807365800	PFYDUSYAPCJMQW-TZIWHRDSSA-N	435.333	1.661	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)Cc2nnc(C)s2)[C@@H]1c1cccnc1	1807538478	GLVDPBROMTYCHK-MPGHIAIKSA-N	437.953	1.744	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)c1ccc2c(n1)OCCO2	1808180297	BPBBPQXQOQLIFU-LESCRADOSA-N	446.891	1.167	50	20	IDGD	
COC[C@H](NC(C)=O)C(=O)NC[C@@H]1CCN(C(=O)C(C)(C)CCl)[C@H]1c1cccnc1	1810558567	GKDPIXLTDBKLLR-BZSNNMDCSA-N	438.956	1.504	50	20	IDGD	
C[C@H](C(=O)NC[C@H]1CCN(C(=O)CO[Si](C)(C)C)[C@H]1c1cccnc1)n1ccnn1	1812398364	CYDATXPHCBVLOL-SUMDDJOVSA-N	430.585	1.792	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H](CNC(=O)[C@H]2CNC(=O)C2)[C@H]1c1cccnc1	1812643546	UZIWFMHSRNKTRR-PNBKFKSVSA-N	437.338	1.397	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)CCN2CCOCC2)[C@H]1c1cccnc1)C(Cl)Cl	1813076399	PSCSUIAWAGKLNA-WBVHZDCISA-N	429.348	1.613	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)CCc2cnccn2)[C@H]1c1cccnc1	1813447812	YSTRLGUWRNLVOR-IMFGXOCKSA-N	431.924	1.764	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H](CNC(=O)CCS(C)(=O)=O)[C@@H]1c1cccnc1	1813574762	FFPULZTVVHCLBQ-APWZRJJASA-N	441.626	1.374	50	20	IDGD	
Cc1cnc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)s1	1816283290	MTTRZUACMKSZAI-INIZCTEOSA-N	439.306	1.474	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CC(C)(C)O)n[nH]1	1817061239	KBMGLZDGBVSDIZ-ANDSAHIGSA-N	443.508	1.697	50	20	IDGD	
O=C(N[C@@H]1CCc2nc(NC(=O)[C@@H](F)Cl)sc2C1)c1cnc2c(c1)CCNCC2	1817134471	NVJDYAZYURJXPR-MLGOLLRUSA-N	437.928	1.987	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnccc2F)n[nH]1	1817736198	SXKOAVHWCUBVLB-INIZCTEOSA-N	431.472	1.623	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CNC(=O)N(C)C)[nH]n1	1822084377	KRMMTEOGOKZUDI-AAEUAGOBSA-N	443.346	1.847	50	20	IDGD	
C[C@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)C(Cl)Cl)n[nH]1)N1CCN(C)CC1	1822420951	GPUTWFPZHQAKSK-TZMCWYRMSA-N	431.368	1.841	50	20	IDGD	
CC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)Cn1cc([N+](=O)[O-])cn1)CC2	1822840707	BUSMBXUVFZDFLB-MWLCHTKSSA-N	426.886	1.877	50	20	IDGD	
Cc1nc2ncccn2c1C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)CC1	1824186241	LOOVDLACZGLDBY-IRXDYDNUSA-N	433.940	1.871	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(=O)n3[nH]nnc3n2)CC1	1824614245	JUFFPOSIUZDSSN-ZBFHGGJFSA-N	449.943	1.453	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)COc3cccnn3)sc2C1	1826764887	AZCPOMKWGWNSIX-MNOVXSKESA-N	425.898	1.178	50	20	IDGD	
COC(=O)c1ccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)[C@@H](O)CCl)CC2)cn1	1827789339	WARCVTKBHGGMQL-MSOLQXFVSA-N	437.924	1.701	50	20	IDGD	
COc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)cn1	1830353935	MXGPJEVKNCYBMQ-HXUWFJFHSA-N	425.913	1.425	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)COC(C)(C)C)CCO2)C1	1832317245	JQEREDKTWHIGLM-KBXCAEBGSA-N	435.359	1.431	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)C3(c4ccccc4)CC3)CC2)CC1)[C@H](O)CCl	1833306413	QGUOZZZTIYIFNX-HXUWFJFHSA-N	433.980	1.890	50	20	IDGD	
CCC(=O)N[C@H](C)C(=O)NC1CCN(C2CCN(C(=O)[C@H](C)Br)CC2)CC1	1833423131	ZGLQTUYVKQEISG-UONOGXRCSA-N	445.402	1.256	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)COCCOC)CC2)CC1	1834566647	AYBWIODFDDXCBE-QGZVFWFLSA-N	448.402	1.395	50	20	IDGD	
CC[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](Cl)COC)C2)C1)c1ccccc1	1834754323	MNJBFEUFPXNZRV-JQVVWYNYSA-N	438.952	1.890	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)c3cnoc3C3CC3)C2)C1	1834818807	BEPCUMFDVMHQRX-GOSISDBHSA-N	442.310	1.407	50	20	IDGD	
O=C(/C=C/c1ccco1)N1CCOC[C@]2(C1)CN(C(=O)CCBr)CCO2	1834819226	KQXIJGGUEHGWKQ-WHLIDYPQSA-N	427.295	1.534	50	20	IDGD	
O=C(CCc1ccccc1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1834840625	RSCGRNIKBXLQQZ-HKUYNNGSSA-N	443.313	1.766	50	20	IDGD	
O=C(CCc1cncnc1)NC1CCN(C2CCN(C(=O)C(Cl)Cl)CC2)CC1	1834845030	BWIJARLOUJJUGF-UHFFFAOYSA-N	428.364	1.785	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccccc3F)CCO2)C1	1835008007	KONKYFDYNZYQNX-LIRRHRJNSA-N	443.313	1.608	50	20	IDGD	
O=C(CC(F)(F)C(=O)O)NC1CCN(C2CCN(C(=O)C(Cl)Cl)CC2)CC1	1835073034	RKAOYLLCJVYFMM-UHFFFAOYSA-N	430.279	1.472	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CC(F)(F)F)CCO2)C1	1835336215	BLUFUVAYZYAATF-RISCZKNCSA-N	431.249	1.569	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC1CCN(C2CCN(C(=O)C(=O)c3ccco3)CC2)CC1	1835834921	HMRUVDKXFCGRLW-UHFFFAOYSA-N	435.597	1.885	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3cccs3)CCO2)C1	1836091972	JZAOYCGWBKYJDT-CXAGYDPISA-N	431.352	1.530	50	20	IDGD	
CC[C@H](Br)C(=O)NC1CCN(C2CCN(C(=O)c3nc[nH]n3)CC2)CC1	1836541978	PSZHUFLQLSZMSL-AWEZNQCLSA-N	427.347	1.163	50	20	IDGD	
CCc1[nH]nc(C(=O)N2CCC(OC3CCN(C(=O)[C@H](O)CCl)CC3)CC2)c1Cl	1836717732	HYVUBXAIKWKEQO-OAHLLOKOSA-N	447.363	1.837	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)CCc3nc(N)n[nH]3)CC2)CC1	1836922250	GBNHERQZWQAWEF-INIZCTEOSA-N	440.976	1.726	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3coc([Si](C)(C)C)c3)CCO2)C1	1837425170	GPEAKANZQOFYQT-UZLBHIALSA-N	443.016	1.912	50	20	IDGD	
CCc1cc(C(=O)N2CCOC[C@@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)no1	1837715398	NZPGTYUDUNEEDL-LJQANCHMSA-N	425.558	1.159	50	20	IDGD	
Cc1nccn1[C@@H](C)C(=O)N1CCOC[C@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1837718080	XIWYHGDKUKUMOL-JXFKEZNVSA-N	438.601	1.060	50	20	IDGD	
COc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@](C)(Cl)CCl)C3)C2)ccn1	1837979305	JJBSTRUYWVQZKL-MOPGFXCFSA-N	446.331	1.397	50	20	IDGD	
COc1cccc2[nH]cc(C(=O)N3CCO[C@]4(COCCN(C(=O)[C@@H](F)Cl)C4)C3)c12	1839557865	ZFPRXLYGKIYCNF-YLJYHZDGSA-N	439.871	1.781	50	20	IDGD	
O=C(c1cccc2nscc12)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1839576259	USVFFAPPUVJYFB-MAUKXSAKSA-N	427.885	1.901	50	20	IDGD	
C=C(C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](Br)CC)C2)C1)C(F)(F)F	1839894914	YRVSDQCKGPKGRZ-DOMZBBRYSA-N	443.260	1.735	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)n3ccnc3)C2)C1	1839961851	KVHSVFHHSMEHBM-MPGHIAIKSA-N	443.342	1.074	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)C3=CCCS3)C2)C1	1839963044	YEJGEXYXGGBJTH-SUMWQHHRSA-N	433.368	1.637	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cncs3)C2)C1	1839963615	QGJNFMKKFJDXMW-BLLLJJGKSA-N	432.340	1.387	50	20	IDGD	
Cc1cccc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)n1	1840030460	MZYBFNVVWVGCHW-KXBFYZLASA-N	440.338	1.172	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3ccco3)C2)C1	1840031357	NKSAKQJTZUFKFS-KBXCAEBGSA-N	429.311	1.452	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc(C)c(C)c3)C2)C1	1840149831	BEFPCCMMXNHGDH-FXAWDEMLSA-N	425.913	1.022	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(CO)c(F)c3)CCO2)C1	1840783726	YKNDMOQNIFUFSX-UZLBHIALSA-N	428.888	1.405	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)c2cncnc2)C1	1842484728	UDFQXAIRBIVJEK-UHFFFAOYSA-N	425.401	1.441	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)c2ocnc2C)C1	1842503418	SQVSKCHCPBPWMK-UHFFFAOYSA-N	428.401	1.947	50	20	IDGD	
COc1ncc(C(=O)N2CCCC23CN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C3)cc1C	1842570261	NIHVOWIVOVXCIN-MFKUBSTISA-N	438.488	1.350	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)N3CC4(CCCN4C(=O)c4ccc(B(O)O)cc4)C3)c[nH]2)cc1	1843010759	ZZFDTKQKDFZGSE-UHFFFAOYSA-N	443.312	1.801	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(O)(C(=O)N2CC3(CCCN3C(=O)[C@@H](F)Cl)C2)CC1	1843362468	WKVPZIRMWSDYBX-CYBMUJFWSA-N	433.908	1.486	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)Cc1ccc(F)cn1)C2	1843415729	GEWXWWMEYMWZIC-AFUMVMLFSA-N	426.452	1.101	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)[C@@]1(F)CCCCC1(F)F)C2	1844264488	YDIRLSFMDXUHPI-IBGZPJMESA-N	439.438	1.420	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CSc2nnc(-c3cccs3)n2N)cc1OC	11591862	GZYGLMBIVFNLDA-UHFFFAOYSA-N	434.503	1.291	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])c(O)c1)c1ccc(S(=O)(=O)N2CCCC2)cc1	17517740	VIKMSTLBWRJICN-UHFFFAOYSA-N	434.430	1.160	50	20	IDGD	
CCS(=O)(=O)N1CCC(C(=O)NNC(=O)[C@H](C)Oc2ccc3ccccc3c2)CC1	18053037	MKLBTZPQOXERMM-HNNXBMFYSA-N	433.530	1.816	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNS(=O)(=O)c1ccc(S(N)(=O)=O)cc1	18995575	CENKANGGTYGCAH-CYBMUJFWSA-N	449.510	1.264	50	20	IDGD	
C[C@H]1CC(C)(C)C[C@@]2(C1)NC(=O)N(CC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)C2=O	21001359	HDLBCNWSBADETQ-FKIZINRSSA-N	431.449	1.493	50	20	IDGD	
O=C(CN1CCN(CC(=O)Nc2ccccc2Cl)CC1)NNC(=O)c1cccs1	23301418	CUHOOMHHIAOKGK-UHFFFAOYSA-N	435.937	1.419	50	20	IDGD	
Cc1ccc(S(=O)(=O)NC2CC2)cc1C(=O)NNC(=O)Cc1nc2ccccc2n1C	26539690	IEABTQWILVNQHX-UHFFFAOYSA-N	441.513	1.326	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(-n3nccc3C)cc2)cc1OC	27953290	JGLHXPLMWTZKDN-UHFFFAOYSA-N	438.440	1.816	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(N)nc(Cl)c2)c1	726765609	VETLTNFYJSKRBG-UHFFFAOYSA-N	425.898	1.423	50	20	IDGD	
CN(C)CC(C)(C)CNC(=S)NNC(=O)CN1c2cccc3cccc(c23)S1(=O)=O	727069458	ZYKSRRSBRNUBOK-UHFFFAOYSA-N	449.602	1.432	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1cc([N+](=O)[O-])cc2c1OCCO2	727365542	HOTPOEJSRPIVPR-UHFFFAOYSA-N	449.445	1.042	50	20	IDGD	
CNS(=O)(=O)c1ccc(CCC(=O)NNC(=S)Nc2ccc(OC)c(F)c2)cc1	727498995	HKFHOBQTDMBTGJ-UHFFFAOYSA-N	440.522	1.693	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)CCc2nc(-c3ncccn3)no2)cc1	727706027	IBFAGAMKYHZBDA-CYBMUJFWSA-N	426.433	1.473	50	20	IDGD	
CS(=O)(=O)Cc1nc2ccccc2n1CC(=O)NNC(=O)Cn1ccc2ccccc21	729449787	FRDWYXHNJMVMEL-UHFFFAOYSA-N	439.497	1.383	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)N2CCN([C@H]3CCC[C@H]3O)CC2)N(C)c2ccccc21	730083401	KPRQJVAHJAUNEK-RBBKRZOGSA-N	437.544	1.715	50	20	IDGD	
O=C(NNC(=O)c1cccc2ncccc12)c1cc(S(=O)(=O)N2CCSCC2)c[nH]1	730226944	VUHUUEDUQFMINU-UHFFFAOYSA-N	445.526	1.375	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)N[C@H](C)c2cc(F)ccc2N2CCC(O)CC2)n1	730683443	YBWILTMWEQNVGW-OAHLLOKOSA-N	432.500	1.692	50	20	IDGD	
COCCCNC(=O)NNC(=O)C1(NS(=O)(=O)c2cccc(F)c2)CCCCC1	732063468	SRKCIDOKOXPEES-UHFFFAOYSA-N	430.502	1.174	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)/C=C\c1ccccc1)C(=O)NNC(=O)c1c[nH]nc1C	732084204	QUFWASFNHJWAGW-SLWQEBJJSA-N	437.547	1.191	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NCCOC)c(C(=O)NNC(=O)C2CCC2)c1	732140924	AYBRYGQGRVNUBU-UHFFFAOYSA-N	426.539	1.337	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2cc(Br)c3c(c2)OCO3)C[C@H](C)O1	732263161	LDBTZXVKCKBRMT-QWRGUYRKSA-N	428.283	1.438	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)NCCCC(=O)N2Cc3ccccc3C2)nc2ccccc21	732474199	JSQOHTNMDLBCOY-UHFFFAOYSA-N	434.500	1.769	50	20	IDGD	
CNS(=O)(=O)c1ccc(CNC(=O)NNC(=O)NCc2ccc(Cl)cc2)s1	733037452	ZKLXWULNWVLXCF-UHFFFAOYSA-N	431.927	1.523	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)CCS(=O)(=O)C2CCCC2)CC1	734821481	LGVIRHOVBRDBES-UHFFFAOYSA-N	446.570	1.464	50	20	IDGD	
CC(C)COc1ncccc1C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	735116667	BJTLEVXSGJEIRA-UHFFFAOYSA-N	448.549	1.204	50	20	IDGD	
COc1ccccc1[C@@H](C)CC(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	735117089	AVFIBPCWJYDLJA-INIZCTEOSA-N	447.561	1.663	50	20	IDGD	
O=C(NCCNS(=O)(=O)c1ccccc1[N+](=O)[O-])NNc1cc(F)c(F)cc1F	735190128	KQJQFAYSQMILCX-UHFFFAOYSA-N	433.368	1.617	50	20	IDGD	
CCc1ccc(CCNC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)cc1	737055731	GQESBQDPLKIBNN-UHFFFAOYSA-N	446.577	1.449	50	20	IDGD	
CCCC[C@@H](/N=C1/NS(=O)(=O)c2ccccc21)C(=O)NNc1ncnc2[nH]cnc12	740746116	KGOLXLKANONWKP-GFCCVEGCSA-N	428.478	1.094	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1cccc(N(C)C)c1)[C@@H]1CN(Cc2ccccc2)CCO1	741282481	PSPUHWCHBOIVKL-UTKZUKDTSA-N	425.533	1.986	50	20	IDGD	
Cc1ccc(NC(=S)NNC(=O)CN2CCN(C(=O)OC(C)(C)C)CC2=O)cc1C	741302655	TVKWYOAVGIRRQP-UHFFFAOYSA-N	435.550	1.700	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)[C@H]2CCCN(C(=O)COc3ccccc3)C2)cn1	741305928	UCGBPSDZJQNTNE-HNNXBMFYSA-N	443.529	1.725	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)NCc1nc(-c2ccccc2)n[nH]1	741419829	ZPIQEVOGQYEUTA-UHFFFAOYSA-N	448.531	1.514	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)[C@H]2CCCN(C(=O)c3ccncc3)C2)cc1	741886720	ARIYBFBKHJXOOA-WMZOPIPTSA-N	440.500	1.947	50	20	IDGD	
O=C(NNC(=O)c1ccc(-c2cc(F)c(F)c(F)c2)cc1)N[C@@H]1CCS(=O)(=O)C1	742054348	DENDLKPJRLGSAR-CYBMUJFWSA-N	427.404	1.902	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)CCn2nnc3ccccc3c2=O)cc1Cl	743834894	XYZHANCMQCCBHE-UHFFFAOYSA-N	446.851	1.705	50	20	IDGD	
CCOC(=O)c1ccc(N2CCN(CC(=O)NNC(=O)c3cccc(C)c3)CC2)nc1	744387350	YIYIABPHJYXHOB-UHFFFAOYSA-N	425.489	1.150	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1cc(F)cc2nccnc12	744620109	DHKGQWPRDCJZDD-UHFFFAOYSA-N	431.449	1.547	50	20	IDGD	
C[C@@](O)(C(=O)OCC(=O)NNC(=O)c1ccc(C#N)cc1)c1cccc(C(F)(F)F)c1	745101856	AXEVPXOWVGKSCJ-IBGZPJMESA-N	435.358	1.789	50	20	IDGD	
COc1ccc(N2C[C@@H](C(=O)NNC(=O)Cc3cn4ccccc4n3)CC2=O)c(OC)c1	746548555	JTEAAVTXMBLFBQ-AWEZNQCLSA-N	437.456	1.095	50	20	IDGD	
COc1cc(C)nc(NNC(=O)NCc2cccc(NC(=O)CCN3CCOCC3)c2)n1	746755489	GDMYTGCQIZYNJN-UHFFFAOYSA-N	443.508	1.281	50	20	IDGD	
O=C(CN1CCN(C(=O)CCCc2ccccc2)CC1)NNC(=O)c1ccc(F)cc1	748810403	PBYYXMPBIJQXMW-UHFFFAOYSA-N	426.492	1.754	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NN=Cc1c(N2CCCCC2)nc2ccccn2c1=O	750947373	BNZIUISSYFBWQV-UHFFFAOYSA-N	438.513	1.626	50	20	IDGD	
O=C(CSc1ccc(Cl)cc1)NNC(=O)Cn1cc(Br)c(O)nc1=O	751199920	CBMRYGYZMZMJIV-UHFFFAOYSA-N	447.698	1.305	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)NCCNS(=O)(=O)c2ccc(Cl)s2)cc1	752154946	LUHFHZMTOYFNRK-UHFFFAOYSA-N	427.895	1.196	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)c1ccc(F)c(S(=O)(=O)NC)c1	752503040	JWUZCTMJYVEDIF-UHFFFAOYSA-N	433.465	1.107	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)Nc1ccc(S(=O)(=O)N2CCC(C)CC2)cc1	755422439	KHGUDXIWYGSPSZ-OAHLLOKOSA-N	442.538	1.311	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2O)cc(C)c1Br	756155987	YINLWJXHYVTAQE-UHFFFAOYSA-N	436.262	1.936	50	20	IDGD	
C[C@H](c1ccc(NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1)N1CCOCC1	756508391	JHJNDFHYFTYAJJ-OAHLLOKOSA-N	446.529	1.950	50	20	IDGD	
O=C(COC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12)NNC(=O)[C@H]1COc2ccccc2O1	756765295	GXUSAOOQYOYHRF-QGZVFWFLSA-N	440.368	1.220	50	20	IDGD	
Cc1cc(Cl)ccc1OCCCC(=O)NNC(=O)Nc1ncn(CC(=O)N(C)C)n1	756770886	PGNOQPCLQSRRHZ-UHFFFAOYSA-N	437.888	1.340	50	20	IDGD	
CCOC(=O)[C@H](C)NC(=O)c1ccc(NC(=O)NNC(=O)Cc2ccccc2OC)cc1	756789990	KPYCRVPFOSVIBA-AWEZNQCLSA-N	442.472	1.772	50	20	IDGD	
O=C(Cc1ccccn1)NNC(=O)Nc1cccc(S(=O)(=O)Nc2nccs2)c1	756875208	TWGDFZSXZVTERP-UHFFFAOYSA-N	432.487	1.734	50	20	IDGD	
COCCN(C)S(=O)(=O)NC(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccccc1	757334013	UQDHPIDUGLGVCI-LGMDPLHJSA-N	442.501	1.310	50	20	IDGD	
CCOC(=O)Nc1ccc(NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1C#N	757760711	HGBFSHLTEZEFDI-UHFFFAOYSA-N	449.427	1.840	50	20	IDGD	
Cc1ccc(NC(=O)OC(C)(C)C)cc1NC(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O	757770277	HQZKSUSUIKZMCK-LLVKDONJSA-N	429.499	1.432	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)c1ccc(Oc2ccccc2C#N)c(Cl)c1	758046650	HWZZSQNEHPBRCY-LLVKDONJSA-N	436.877	1.703	50	20	IDGD	
O=C(NNC(=O)c1nc(C2CC2)n(-c2ccccc2Cl)n1)C(=O)Nc1ccccn1	758832794	ZGIWPERYZDXBIX-UHFFFAOYSA-N	425.836	1.593	50	20	IDGD	
COCCS(=O)(=O)c1ccc(CNC(=O)NNC(=O)COc2cc(C)cc(C)c2)cc1	759382579	AIWFGUGUEYYXGS-UHFFFAOYSA-N	449.529	1.633	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3ccc(-n4ccnn4)cc3)CC2)cc1	760406327	VZWXCZDAKFFRLO-UHFFFAOYSA-N	433.516	1.155	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COc2ccc(C)cc2)nc1I	761134852	DGKYRXZDCFASAD-UHFFFAOYSA-N	441.225	1.843	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)c1ccc(CN2C(=O)CNC2=O)cc1	761622680	VJAQSRWZZWXSBP-UHFFFAOYSA-N	428.470	1.300	50	20	IDGD	
CN1CCC(=O)Nc2cc(C(=O)OCC(=O)NNC(=O)c3cccc(Cl)c3)ccc21	762911234	IVFSYYFWGZKFCK-UHFFFAOYSA-N	430.848	1.736	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)[C@@H]3CS[C@]4(C)CCC(=O)N34)n[nH]2)cc1OC	763149028	NTQQSCVFMNGMRV-VBKZILBWSA-N	445.501	1.309	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(N3CCOCC3)c(C)c2)cc1OC	763550226	ARRHDSAQVNDWDA-UHFFFAOYSA-N	442.472	1.249	50	20	IDGD	
Cc1ccc(Oc2ccc(NC(=O)C(=O)NNC(=O)c3c(C)nc4ccccn34)cc2)nn1	763623121	CJXPRYWGQAMWDL-UHFFFAOYSA-N	445.439	1.933	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(OCCN(C)C)c2)cc1C	763664863	KQGHMMNPZSFKEA-UHFFFAOYSA-N	428.489	1.409	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cccc(N(C)C)c2)ccc1N1CCOCC1	763759811	CAESNZSPJGMROC-UHFFFAOYSA-N	425.489	1.297	50	20	IDGD	
O=C(NNC(=O)c1cc2c(s1)CCC2)C(=O)Nc1ccccc1CN1C(=O)CCC1=O	763783986	SFKHRPOYZZLBIK-UHFFFAOYSA-N	440.481	1.286	50	20	IDGD	
CC[C@H](C)Oc1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])cc1	763803341	GRNOLHFIDDAAFX-ZDUSSCGKSA-N	430.417	1.937	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)C(=O)N1CCc2c1cccc2C(F)(F)F	763808520	XNJWVXJPEWCUEA-UHFFFAOYSA-N	432.358	1.693	50	20	IDGD	
CCCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C)cc2)cc1Cl	763808608	DCXGNCJBLTVKAY-UHFFFAOYSA-N	446.891	1.953	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccc(CN2CCCC2=O)cc1	763839028	DJPVQJWEUNNUMD-UHFFFAOYSA-N	428.420	1.113	50	20	IDGD	
CC(=O)Nc1cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(C(C)=O)cc2)ccc1C	763877302	JDQKPPCUGOGOSX-AWEZNQCLSA-N	440.456	1.709	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)NC)c(Cl)c2)cc1OC	763902627	NQJCXXRRRNCPCC-UHFFFAOYSA-N	448.863	1.507	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)Nc1ccccc1C(=O)N1CCOCC1	763914674	LQHAYLBJEDHQSS-UHFFFAOYSA-N	430.486	1.810	50	20	IDGD	
O=C(NNC(=O)c1cccc2ccccc12)C(=O)Nc1ccc2nc3n(c(=O)c2c1)CCC3	764049830	ZHLBOTIIJDMKGJ-UHFFFAOYSA-N	441.447	1.896	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(-c3nnnn3C(C)C)c(F)c2)c(O)c1	764110525	QECPVQGIVNHFHL-UHFFFAOYSA-N	441.423	1.474	50	20	IDGD	
O=C(NNC(=O)c1cccc(OC(F)F)c1)C(=O)Nc1cccc(CN2CCOC2=O)c1	764259720	NDVVFVWVVHNPKA-UHFFFAOYSA-N	448.382	1.640	50	20	IDGD	
O=C(NNC(=O)c1cc(F)ccc1Br)C(=O)Nc1cccnc1-n1cccn1	764278600	UBNXIFDRCOBIRZ-UHFFFAOYSA-N	447.224	1.569	50	20	IDGD	
Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)C(=O)NNC(=O)c1c[nH]nc1C	764298119	NUSXWWVORNDVKF-UHFFFAOYSA-N	432.440	1.877	50	20	IDGD	
O=C(NNC(=O)c1cc2ccccc2o1)C(=O)Nc1cccc(Cn2cccnc2=O)c1	764331221	RGZDMCCESJVEBZ-UHFFFAOYSA-N	431.408	1.438	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccccc2S(=O)(=O)N2CCCCC2)o1	764367098	FTLVDEVARWGPRM-UHFFFAOYSA-N	434.474	1.162	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(NC(=O)C(=O)NNC(=O)OC(C)(C)C)ccc1Cl	765387272	SGNIUWWIPXVYRI-UHFFFAOYSA-N	448.929	1.865	50	20	IDGD	
C[C@H](NS(=O)(=O)c1cccc(C#N)c1)C(=O)NNC(=O)Cn1ccc2ccccc21	765429236	ZHLRDKPFZPPMRZ-AWEZNQCLSA-N	425.470	1.027	50	20	IDGD	
O=C(/C=C\c1ccc([N+](=O)[O-])cc1)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765736153	PBZQZUKTHBNXNJ-FLIBITNWSA-N	437.456	1.213	50	20	IDGD	
COc1ccc([C@]2(C)NC(=O)N(CC(=O)NNc3ncnc4ccsc34)C2=O)cc1	766669024	DKWSODCBPNFQFN-IBGZPJMESA-N	426.458	1.610	50	20	IDGD	
Cc1cccc(N2CCN(S(=O)(=O)CC(=O)NNc3ncnc4ccsc34)CC2)c1	766674065	MSJVKYBUMCSMRL-UHFFFAOYSA-N	446.558	1.595	50	20	IDGD	
O=C(COC(=O)[C@H]1CC(=O)N(Cc2ccccn2)C1)NNC(=O)c1cccc(Cl)c1	766925205	HPZVXQRRLUVDKQ-AWEZNQCLSA-N	430.848	1.088	50	20	IDGD	
Cc1noc(C2CC2)c1NC(=O)C(=O)NNC(=O)COc1ccc(Br)cc1	768233928	PGGHOVWKGPUJEG-UHFFFAOYSA-N	437.250	1.788	50	20	IDGD	
O=C(NNC(=O)c1cccnc1)C(=O)Nc1ccc(Cc2nnc3n2CCCCC3)cc1	768234315	SNOUXRHURFJYQO-UHFFFAOYSA-N	433.472	1.390	50	20	IDGD	
CCOc1cccc(-c2nnc(SCC(=O)NNC(=O)Cc3ccccc3C)n2N)c1	768433339	LIBAAAZRFHHPOV-UHFFFAOYSA-N	440.529	1.848	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)c1ccc(CN2C(=O)CCC2=O)cc1	768641776	WKNPEVUCTSVOBY-UHFFFAOYSA-N	431.470	1.505	50	20	IDGD	
CCOC(=O)Cn1cccc(NC(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)c1=O	770073170	DHZGVTZAASINHE-UHFFFAOYSA-N	444.416	1.556	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)NC3CCN(c4ccc(OC(F)F)cc4)CC3)nc21	770374623	YMWYMGANEHDQQO-UHFFFAOYSA-N	448.434	1.965	50	20	IDGD	
Cc1cc2c(N3CCC[C@H]3C(=O)NNC(=O)CNC(=O)c3ccco3)ncnc2s1	770529639	BTFFEQSVWBRLEU-ZDUSSCGKSA-N	428.474	1.139	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)N[C@H]2CC(=O)N(c3c(F)cccc3F)C2)c1	770843583	YIGZNOGNMBXLGG-LBPRGKRZSA-N	434.399	1.732	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NNC(=O)c2ccc(=O)n(-c3ccccc3)n2)C1	773413164	HGNLEXOSBJIVTR-OAHLLOKOSA-N	441.488	1.641	50	20	IDGD	
CC(=O)NCc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)cc1	774007550	BQFWKYYNBXWXLH-LBPRGKRZSA-N	432.864	1.530	50	20	IDGD	
CC(=O)Nc1cc(C)c(S(=O)(=O)NNC(=O)c2cccn2C)cc1Br	774605443	SAQZBAABXJHUHT-UHFFFAOYSA-N	429.296	1.678	50	20	IDGD	
COc1cc(C(=O)CCC(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc(OC)c1OC	776964765	PGWQEEFVBNYVBS-UHFFFAOYSA-N	444.440	1.908	50	20	IDGD	
CC(C)CN(CC(=O)NNC(=O)c1ccccc1)c1c(O)nc(=O)n(CC(C)C)c1N	777606207	MRLPFKQUZDIUIR-UHFFFAOYSA-N	430.509	1.111	50	20	IDGD	
Cc1cc(C)n(-c2ccc(C(=O)N3CCN(S(=O)(=O)CBr)CC3)cn2)n1	777777714	OQDNJBWRGMYCTN-UHFFFAOYSA-N	442.339	1.324	50	20	IDGD	
O=C(CCN1CCN(C(=O)[C@H]2CCCO2)CC1)NNc1ccccc1OC(F)(F)F	779200865	JKTKTWJZKPFZTE-MRXNPFEDSA-N	430.427	1.742	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@]2(C[C@@H]2C(=O)NNC(=O)c2nnc(O)c3ccccc23)C1	780171287	KCOANTNUJBABLN-SZNDQCEHSA-N	427.461	1.744	50	20	IDGD	
N#CC1=CCN(C(=O)CCn2c(=O)oc3cc(S(=O)(=O)N4CCCC4)ccc32)CC1	780687194	NSJPDRROXSRAHN-UHFFFAOYSA-N	430.486	1.451	50	20	IDGD	
COc1ccc(C[C@H](C)C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)cc1OC	781315432	HUCFCTLUPLWIFL-AWEZNQCLSA-N	425.441	1.758	50	20	IDGD	
CC(=O)N1CCN(c2cccc(NC(=O)C(=O)NNc3cccc([N+](=O)[O-])c3)c2)CC1	782118778	XCFGADJBQCROAD-UHFFFAOYSA-N	426.433	1.345	50	20	IDGD	
O=S(=O)(CBr)N1CCCN(S(=O)(=O)c2cccc3cnccc23)CC1	782436094	YLKWOLICMWIYCX-UHFFFAOYSA-N	448.364	1.613	50	20	IDGD	
CCCNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)c1	782884645	HFCFHOYYDWKDJU-UHFFFAOYSA-N	436.472	1.042	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccccc2OC(F)F)nc1	783263755	KXPJLNRHCNKBOL-UHFFFAOYSA-N	443.432	1.452	50	20	IDGD	
N#Cc1ccc(Cn2cnc(NC(=O)C(=O)NNc3ccc(Cl)cc3[N+](=O)[O-])n2)cc1	783292128	XKAGLUPCOCYZJU-UHFFFAOYSA-N	440.807	1.841	50	20	IDGD	
O=C(NN=c1cc[nH]cc1)C(=O)Nc1ccc(CCn2cc(Br)cn2)cc1	783376074	DTQISMSTXSSTHK-UHFFFAOYSA-N	429.278	1.787	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2cccc([N+](=O)[O-])c2)cc1-n1nnnc1C1CC1	784833743	MTBNXQLKOODYFO-UHFFFAOYSA-N	438.404	1.538	50	20	IDGD	
CC(C)N(C)c1ccc(NC(=O)C(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)cc1F	785024350	XTJXDOMGCUOQBL-UHFFFAOYSA-N	433.396	1.684	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)[C@H]3CCC(=O)c4ccccc43)cc2)CC1	786426074	HLJQBCLEKLIAQV-FQEVSTJZSA-N	442.541	1.826	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccccc2CNC(=O)/C(C#N)=C/c2ccc(O)cc2)CC1	787373782	KLSDABCYAISFHV-XMHGGMMESA-N	440.525	1.552	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)[C@H]1CCCN1c1ccccc1	787404847	ZETKQLAGXJUJOV-LJQANCHMSA-N	430.530	1.820	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)c(C)cc1C	788330094	DFKIZBACOGSUPY-ZDUSSCGKSA-N	431.420	1.783	50	20	IDGD	
O=C(CN1C(=O)N[C@@]2(CCc3ccccc32)C1=O)NNc1nnc(-c2ccccn2)s1	788564712	BQDKDEQHNSUVSJ-HXUWFJFHSA-N	435.469	1.437	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cn(-c3cc(C)cc(F)c3)nn2)cc(OC)c1OC	788722110	ZVYNXNLFKXWTCM-UHFFFAOYSA-N	429.408	1.815	50	20	IDGD	
CN1C(=O)Cc2cc(NC(=O)C(=O)NNC(=O)CCSc3ccc(F)cc3)ccc21	789741051	OPZHKAXXTWLJJW-UHFFFAOYSA-N	430.461	1.613	50	20	IDGD	
CCOc1ccc(-c2nc(CC)c(C(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)s2)cc1	791476609	HFCQMLROZYSCTL-ZDUSSCGKSA-N	437.543	1.967	50	20	IDGD	
O=C(NNc1nc2ccccn2n1)C(=O)Nc1cc(Cl)ccc1C(=O)N1CCCC1	792391513	CYNRSENKNSIBIE-UHFFFAOYSA-N	427.852	1.701	50	20	IDGD	
CON(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)c2cc3ccccc3cc2O)cc1	792516182	GIPWFKGWGFUZSI-UHFFFAOYSA-N	429.454	1.802	50	20	IDGD	
Cn1ccc2ccc(NC(=O)C(=O)NNC(=O)c3cc(-c4cccs4)[nH]n3)cc2c1=O	793025644	NETWTWGHSOWTNX-UHFFFAOYSA-N	436.453	1.390	50	20	IDGD	
O=C(NNc1ccc2c(=O)[nH]ccc2c1)C(=O)Nc1ccc(F)c(-n2nnnc2C2CC2)c1	793070727	TYRZQNICFQHCKF-UHFFFAOYSA-N	448.418	1.602	50	20	IDGD	
CC[C@H](C)[C@H](NC(=O)N1CCCC1)C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	794710365	IKFRNUOLKNZKFO-YOEHRIQHSA-N	425.555	1.600	50	20	IDGD	
O=C(NNS(=O)(=O)CCc1cccc(Cl)c1)c1csc(N2CCOCC2)n1	795283123	IZOLFPLJTXWBQW-UHFFFAOYSA-N	430.939	1.440	50	20	IDGD	
CNC(=O)C[C@@H](NC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)c1ccccc1	797545585	HDHCVCOXENBXEB-MRXNPFEDSA-N	433.490	1.303	50	20	IDGD	
COc1ccc(CCNC(=O)/C(C#N)=C\c2ccc(F)c(S(N)(=O)=O)c2)cc1OC	806565934	UICMGUABFOMMMT-DHDCSXOGSA-N	433.461	1.756	50	20	IDGD	
CCCNS(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)c2cc3ccccc3o2)cc1	808096670	TVCJFQIXPKLFPL-UHFFFAOYSA-N	437.499	1.744	50	20	IDGD	
O=C(NNC(=O)c1c[nH]nc1-c1ccccn1)c1ccc(S(=O)(=O)N2CCCC2)cc1	809983700	QIWGMVYOLUKFHK-UHFFFAOYSA-N	440.485	1.331	50	20	IDGD	
CC(C)OCCCn1c(NNC(=O)[C@@H]2CCc3nnn(C)c3C2)nc2ccccc2c1=O	810350520	QAVJFASXPDHJHE-OAHLLOKOSA-N	439.520	1.588	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1)NNc1ncnc2[nH]cnc12	810424903	VIHJRZPLIVFEPG-UHFFFAOYSA-N	449.802	1.447	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)c2cc(N3CCNC3=O)ccc2Cl)cc1	812731198	CPFYYBTZZZXGAY-UHFFFAOYSA-N	437.909	1.877	50	20	IDGD	
CC(C)(C)OC(=O)N1CCOc2ccc(NC(=O)NNC(=O)Cc3cc[nH]n3)cc2C1	813023689	AWPAJXBLZPNJHI-UHFFFAOYSA-N	430.465	1.935	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H](O)c2ccc(Cl)cc2F)c1	813367193	VCISLBOBXPLEAP-HNNXBMFYSA-N	429.857	1.224	50	20	IDGD	
Cc1nn(C)c(N2CCOCC2)c1C=NNC(=O)[C@H]1CCCN(C(=O)OC(C)(C)C)C1	814971902	SUBPRKUKJOMFGT-INIZCTEOSA-N	434.541	1.662	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)cc1	815265275	TYGXROZTABGWHD-UHFFFAOYSA-N	425.445	1.122	50	20	IDGD	
CC(C)Sc1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)[C@@H]1CCc2nncn2C1	815692274	NLPDHIGBRADCPA-LLVKDONJSA-N	436.925	1.781	50	20	IDGD	
CC1CCN(S(=O)(=O)c2ccc(C(=O)NNC(=O)CNc3ccccc3)cc2)CC1	823327327	FBZXOIUPISZQOF-UHFFFAOYSA-N	430.530	1.980	50	20	IDGD	
CC(=O)Nc1cccc(-n2nnnc2SCC(=O)NNC(=O)c2ccc(F)cc2)c1	913123330	JEUIWPKXADERRN-UHFFFAOYSA-N	429.437	1.313	50	20	IDGD	
CCC1(CC)NC(=O)N(CC(=O)NNC(=O)c2ccc(COc3ccccc3)o2)C1=O	913228887	QHQBTKPICAGPKM-UHFFFAOYSA-N	428.445	1.730	50	20	IDGD	
Cc1cccc(OCCC(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1C	914592187	VVAUPTRAQKUFFY-IBGZPJMESA-N	428.441	1.603	50	20	IDGD	
CCS(=O)(=O)N(C)CCCNC(=O)/C(C#N)=C/c1cc(C)n(C[C@H]2CCCO2)c1C	915729567	OXKYAEPCNDWRBZ-UMSHPIDHSA-N	436.578	1.979	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)NCc1nnc2ccc(C(F)(F)F)cn12	916222619	IAVIJZCDHRHTDZ-UHFFFAOYSA-N	426.330	1.797	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)NCc1cccc(C(=O)NC2CC2)c1	916649271	VPGNLDLHVNYSLF-UHFFFAOYSA-N	426.473	1.887	50	20	IDGD	
CC(C)[C@@H](NS(=O)(=O)c1ccc2c(c1)OCCCO2)C(=O)NNC(=O)C(C)(C)C	917180324	RUWBIQAPDFEODI-MRXNPFEDSA-N	427.523	1.344	50	20	IDGD	
O=C(NNS(=O)(=O)c1sccc1Br)c1ccc(-n2cnnn2)cc1	917728379	ZRYOILWTCZUXTQ-UHFFFAOYSA-N	429.281	1.110	50	20	IDGD	
COC(=O)CCOc1ccc(S(=O)(=O)NNC(=O)c2cn(C)c3ccccc23)cc1	917730677	NNVYUEPLIBAJRC-UHFFFAOYSA-N	431.470	1.744	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)Nc2cnn(CCOC)c2)c2ccccc2c1=O	918542870	NVORXQCDSBOAIG-UHFFFAOYSA-N	427.465	1.506	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)OCC(=O)N[C@@H](C)C(=O)N2CCCCC2)c1C	918810327	NWIDHRHBECNJDG-NNIWKIFQSA-N	444.532	1.719	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)CCNS(=O)(=O)c1ccc(F)c(F)c1	919820263	RKWJBSUDBQAZPX-UHFFFAOYSA-N	427.429	1.032	50	20	IDGD	
CCS(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)c2nnc(-c3ccccc3)o2)cc1	919961580	DLJQLXWLXXLKRD-UHFFFAOYSA-N	436.471	1.154	50	20	IDGD	
CC(C)N(C)S(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2cccc(N(C)C)c2)cc1	920235045	DJXVTQZIEUUZKL-UHFFFAOYSA-N	447.561	1.926	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)NNC(=O)c2ccc[nH]2)cc1	920849380	PIXURNNYUAJQHX-RVDMUPIBSA-N	447.455	1.130	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)NC[C@H](c1cccc(F)c1)N1CCOCC1	921247550	HDJDFROTRJVNMX-LJQANCHMSA-N	441.463	1.480	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)N[C@H]2CCOC3(CCOCC3)C2)CC1	1261443597	WFGGPOKSBFIDLI-INIZCTEOSA-N	440.541	1.692	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(Cl)cc1)NNC(=O)c1cncn1-c1ccccc1	1317717791	SMWULSMHOZUPTI-UHFFFAOYSA-N	433.877	1.265	50	20	IDGD	
O=C(NNC(=S)NC[C@@H]1CCOC1)c1cccc(NC(=S)NC[C@@H]2CCOC2)c1	1319380809	MJPNCDFTLTXLSZ-KBPBESRZSA-N	437.591	1.155	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)c1cc2c(c(S(N)(=O)=O)c1)CCC2	1320849622	TUDRFKZBNRANCK-NSHDSACASA-N	437.905	1.705	50	20	IDGD	
C[S@@](=O)Cc1ccc(CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1	1322802718	PKYASVXEZMLNRK-GDLZYMKVSA-N	437.547	1.002	50	20	IDGD	
O=C(CN1CCC(CO)CC1)NNC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1	1336957597	VYVUEOXNIDSPEP-UHFFFAOYSA-N	434.500	1.400	50	20	IDGD	
Cc1cc(C)n2ncc(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)[C@H](O)CCl)C4)c2n1	1778555276	IWAVUBHWVGIJHE-CBGDNZLLSA-N	449.939	1.073	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc3n(n2)CCCC3)C1	1779038503	BYBJBAAQWSMFAF-HGHGUNKESA-N	438.956	1.601	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccn3nccc3c2)C1	1779166943	NFFLYLPDYKZVJL-DBXWQHBBSA-N	434.924	1.716	50	20	IDGD	
Cc1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](O)CCl)C3)nn1C(F)F	1780157531	HPRQGACFHZALDG-HBUWYVDXSA-N	434.871	1.314	50	20	IDGD	
C=C(CC(=O)OCC)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](Cl)COC)C2	1780741059	JODMYLWCPZORRX-JXXFODFXSA-N	430.929	1.264	50	20	IDGD	
CC[S@@](=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Br)C1	1780774730	JUHOIMFMAHOLCA-ZLHYLOAGSA-N	441.363	1.350	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C[C@H]2C[C@@H]3CC[C@H]2C3)C1	1781836509	WBJWUQFEGTZGNM-YBZAYSDLSA-N	448.608	1.700	50	20	IDGD	
O=C(c1c(Cl)ccc(Cl)c1O)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1781943786	IHAZAIBAXSJVGW-PXAZEXFGSA-N	437.707	1.742	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1c(F)cncc1F)C2	1782173458	CBOMMVDDLHJQBA-KPAZRMRSSA-N	431.867	1.741	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3sc(N)nc3C)CCO2)C1	1783342654	MTVMBLBGNBRVFK-BDJLRTHQSA-N	431.356	1.651	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)Cn3nnc4ccccc43)CCO2)C1	1783529745	MHPIKERXRAUKTF-ACJLOTCBSA-N	436.310	1.045	50	20	IDGD	
O=C(C(Cl)Cl)N1CCO[C@@]2(CCN(C(=O)[C@@H]3C[C@@]34C(=O)Nc3ccccc34)C2)C1	1783545217	GLOIBTYAPYUGCL-SVIJTADQSA-N	438.311	1.530	50	20	IDGD	
CCSc1cccnc1C(=O)N1CCO[C@@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1	1783935776	WPNAJUCGMKBHMU-OAQYLSRUSA-N	449.577	1.010	50	20	IDGD	
COC(=O)CCCCCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](C)Br)CCO2	1784047696	DGLGPUCSQXZQRJ-KBXCAEBGSA-N	433.343	1.723	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc(C)cn3)[C@H]2C1	1785990773	CMQVUIAJAHTRJP-YXWQFLTLSA-N	425.327	1.552	50	20	IDGD	
CC(C)n1nccc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCBr)[C@H]2C1	1786405978	BERXQFLKEUNVPL-DZKIICNBSA-N	427.343	1.842	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4ccnn4c3)C[C@@H]21	1786407312	PHBGWUOTACAIIT-XIRDDKMYSA-N	435.322	1.713	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4ccoc4c3)C[C@@H]21)c1ccc(B(O)O)cc1	1786981961	SGTRRUBRTGEITK-VCOUNFBDSA-N	448.284	1.020	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cn3ccccc3=O)[C@H]2C1	1787018208	PUSMXANDLTURHC-VGWMRTNUSA-N	440.338	1.002	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc(C(C)(C)C)cn3)[C@H]2C1	1787788048	KTQPWMNOQBRYDZ-JKQORVJESA-N	438.956	1.621	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)c1cn2ccsc2n1	1788390958	WTCKDXHAXIYVLN-OBJOEFQTSA-N	441.351	1.774	50	20	IDGD	
C=C(CC(=O)OCC)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]2C1	1788763520	KZPQDSUVKLERCY-ULQDDVLXSA-N	426.586	1.327	50	20	IDGD	
O=C(Cc1cc2cccnc2cc1F)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21	1789844641	UQHSCBMMYJGSLV-UQOODKLHSA-N	449.910	1.496	50	20	IDGD	
CC(C)n1cnc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]3C2)n1	1789922917	NVXQQQGECYYENF-ZDEQEGDKSA-N	432.294	1.143	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4cncn4c3)C[C@@H]21)[C@H](F)Br	1789926403	WPNVNHABFVTUSH-TUUVXOQKSA-N	439.285	1.618	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc(OC)c(C)c3)C[C@@H]21	1791249705	OTBPVUFBECZNRU-JPLJXNOCSA-N	438.952	1.780	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](C)C1(O)CCC1	1792550087	DQZAKIVVXOLTMF-LFKSASQSSA-N	429.521	1.310	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c[nH]c3ncccc13)C2	1792867461	CDHWBMQOXBLTIE-JFILPPLUSA-N	435.322	1.797	50	20	IDGD	
CCc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)CBr)nn1C	1792872626	RVUTWVMYKUEWCX-NFFDBFGFSA-N	427.343	1.217	50	20	IDGD	
COc1ccc2[nH]cc(/C=C/C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@@H](O)CCl)c2c1	1792979700	BHHGAXHXOQPIRS-HLUXNRJXSA-N	447.919	1.379	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3ncncc3c1)C2	1795115669	FQDQWQULOTUEBD-JLVBRIDZSA-N	433.306	1.618	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CNc2ccccc21	1795624075	BDTFTMXNJRDBRI-XIZOUUALSA-N	436.350	1.959	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1cc(-c2ccco2)no1	1796126252	DFYAXCUHVXPZGL-OWLDWWDNSA-N	442.241	1.828	50	20	IDGD	
O=C(CCc1ccc(F)c(F)c1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1	1796185828	TYOFDHWKKVNRLB-REPLKXPHSA-N	442.271	1.529	50	20	IDGD	
CCOC(=O)c1ncn2c1CC[C@@H](C(=O)N[C@@H]1C[C@@H]3CC[C@H](C1)N3C(=O)[C@H](F)Cl)C2	1796811269	MOJVBLUBSDCEKR-MPZWGZMNSA-N	440.903	1.795	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1CCC(CO)CC1)C2	1796890973	RBIQMYNQCVOUKM-PLKZFXCCSA-N	443.548	1.557	50	20	IDGD	
Cc1ccc2nc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)c3ccc(B(O)O)cc3)C4)ccc2c1	1797375825	XSTZZQNXKPGTGR-WKCHPHFGSA-N	443.312	1.789	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnccc1Cl	1797994266	WDLUTSOWEPZUJC-MCYUEQNJSA-N	430.730	1.969	50	20	IDGD	
COc1ccnc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)Br)C3)c1OC	1798769027	NIFAGUVOPXOLJE-FMSGJZPZSA-N	442.310	1.085	50	20	IDGD	
O=C(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2)Nc1ccc(F)cc1	1799034676	MXTSBCLDBVDHPV-CULMDFNYSA-N	432.279	1.548	50	20	IDGD	
CCS(=O)(=O)c1ccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Cl)C3)cc1	1800431655	WURFTTZRVJSXRW-LTCOOKNTSA-N	446.928	1.147	50	20	IDGD	
CC(=O)Nc1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CCC(=O)NN(C)C)C3)ccc1C	1800643817	MEDAMVNIJALWCV-REPLKXPHSA-N	443.548	1.578	50	20	IDGD	
COC(=O)[C@H]1CC=CC[C@@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CO[Si](C)(C)C)C2	1800955808	UHUDLTWPFRIYMU-OREBXVKISA-N	438.597	1.183	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CSc1ccc(C)cc1)C2	1800978167	NDLXUSIDCAXNJG-HIRMHNASSA-N	426.966	1.931	50	20	IDGD	
Cc1nccn1CCCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2	1801308509	QSHZTVLBTYHLSI-JLVBRIDZSA-N	427.343	1.346	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)Cn1ccnc1	1801369058	SJDZLKOTKZZSLD-DGXTUMSLSA-N	427.343	1.140	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CC[C@H](C)CC1	1801505168	YQFUMABSURVSGI-WQNYWJIOSA-N	443.548	1.536	50	20	IDGD	
CC(C)(C)OC(=O)NC12CC(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)[C@H](O)CCl)C4)(C1)C2	1801866932	CIVUKCUYLFVISC-COZCDLTHSA-N	441.956	1.672	50	20	IDGD	
COc1ncccc1CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCC(=O)NN(C)C	1802333195	MJOCCPVREPQGBI-BCDXTJNWSA-N	431.537	1.034	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H](CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](O)CCl)C3)C1	1802578498	QOEUWVCXRHRMHS-KSWRQPAISA-N	443.972	1.871	50	20	IDGD	
CC(C)(CCl)C(=O)NC[C@H]1CCN(C(=O)C[C@@](C)(O)CC(=O)O)[C@@H]1c1cccnc1	1802901249	APUDBLXXDAQNCR-FQELHTAISA-N	439.940	1.968	50	20	IDGD	
COc1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)ccc1F	1803594507	SGSUVVKEKWYISF-QDMKHBRRSA-N	441.463	1.398	50	20	IDGD	
CC(C)(C)OCC(=O)N1CCCC2(CCN(C(=O)c3cnccc3C(=O)NN)CC2)C1	1806580395	AKNQYDSNPZYHBV-UHFFFAOYSA-N	431.537	1.345	50	20	IDGD	
Cc1ccnc(C(=O)NC[C@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)c1	1808540471	YKFOIXWCUNGGLU-XMSQKQJNSA-N	438.532	1.478	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cc(CO)on2)[C@H]1c1cccnc1)[C@H](F)Br	1808675442	ABHCRNIQCYHDPS-CQDKDKBSSA-N	441.257	1.572	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2cnc3ncccn23)[C@H]1c1cccnc1	1809333153	HJYCQOKRWAOGSE-SOLBZPMBSA-N	442.907	1.698	50	20	IDGD	
CC1=CC[C@H](C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)CC1	1809478523	OCDXFXCRRKHKEQ-ZEYPLWLESA-N	447.344	1.827	50	20	IDGD	
O=C(CCc1cccnc1)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1	1809977754	FWCOJDNMNHFIIU-UHFFFAOYSA-N	435.333	1.239	50	20	IDGD	
CCS(=O)(=O)CC(=O)N1CC[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]1c1cccnc1	1810537930	QLJVDGZBMBFIIM-QFBILLFUSA-N	441.626	1.374	50	20	IDGD	
C[C@H](C(=O)NC[C@@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1)n1cnnn1	1813467852	JWZMGVYJRHBDNS-IVMMDQJWSA-N	436.314	1.120	50	20	IDGD	
CC(C)C1(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)CCC1	1813664592	JRRCAXITLGJPTD-UNMCSNQZSA-N	449.360	1.907	50	20	IDGD	
CNc1nsnc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](Cl)COC)[nH]n1	1814434632	JLLKWCBLRDUVGT-KOLCDFICSA-N	427.918	1.863	50	20	IDGD	
CCC[C@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1815318304	SCENXCCZYGJLNT-DOTOQJQBSA-N	432.717	1.803	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1ccc(F)s1	1816027277	VURIBWZLERZUCT-HNNXBMFYSA-N	442.281	1.910	50	20	IDGD	
Cc1ncc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cccc(B(O)O)c2)CC3)s1	1817889839	TYJNKCFDGPIUNA-ZDUSSCGKSA-N	442.331	1.127	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1CCc2nc(NC(=O)CCc3nc(N)n[nH]3)sc2C1	1819558174	QRIHAFUBNPMOPW-SNVBAGLBSA-N	437.602	1.240	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)Cn2ccncc2=O)[nH]n1)[C@@H](F)Br	1820938152	ZNZODUOHPIVYQT-XHDPSFHLSA-N	441.261	1.349	50	20	IDGD	
COc1cc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@H](F)Br)CC3)nn1C	1821771851	DWKCNUASEYMGES-MADCSZMMSA-N	446.302	1.802	50	20	IDGD	
Cc1cc(CC(=O)N2CCCC[C@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)on1	1822410365	ICQFARFVOHOZAU-INIZCTEOSA-N	431.497	1.314	50	20	IDGD	
Cc1nccn1[C@@H](C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1	1822416587	IWJRVOJADQOZJD-YOEHRIQHSA-N	444.540	1.541	50	20	IDGD	
CCS(=O)(=O)CC(=O)N1CCCC[C@H]1C1CCN(C(=O)CO[Si](C)(C)C)CC1	1824468354	MYDHXPMMQRICEJ-KRWDZBQOSA-N	432.659	1.892	50	20	IDGD	
C=CC[C@@H](C)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnccc1C(=O)NN)CC2	1825125951	AWWSGQXEZWJOIL-VXGBXAGGSA-N	428.518	1.580	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnc(OC)cn1)CC2	1825999933	YCHAQPGSRAUTGV-VHSXEESVSA-N	425.898	1.421	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CNCP(=O)(O)O)CC1	1826800743	IOQWWYXUZSMWAL-CVEARBPZSA-N	437.905	1.738	50	20	IDGD	
C=C(C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1)C(F)(F)F	1827060270	FAQAECLWOTWSNL-SFHVURJKSA-N	438.255	1.718	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cn[nH]c2)CC1	1827800347	XHWNBIVIPDAAAD-CRXVIZHGSA-N	439.520	1.777	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2n[nH]cc2[N+](=O)[O-])CC1	1829163788	NMGQIVYQZATDMW-UONOGXRCSA-N	427.889	1.805	50	20	IDGD	
CCc1nc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)co1	1829383902	MWLBLBQGCBYICN-FQEVSTJZSA-N	439.321	1.464	50	20	IDGD	
Cc1cc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)on1	1830535650	RPQITNWKGJDDDY-UGSOOPFHSA-N	444.326	1.013	50	20	IDGD	
CC(C)O[C@H](C)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H](C)CBr)CCO2)C1	1830539434	GRYZZJKABZALIV-DAYGRLMNSA-N	435.359	1.287	50	20	IDGD	
COC1(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)CCC1	1830545731	MGGZBZYSCFPHTM-DNVCBOLYSA-N	447.370	1.433	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3cnc4ccccn34)CCO2)C1	1830655484	SJAVZKXTZLEYSQ-QFIPXVFZSA-N	448.951	1.598	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cnc4ccccn34)C2)C1	1831639345	QPGSIODWARSYFR-GCJKJVERSA-N	448.951	1.741	50	20	IDGD	
CNC(=S)NCCC(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H](C)Br)CC1	1831654715	GRJWDRWAPFDIFC-UKRRQHHQSA-N	447.443	1.874	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)[C@@H]2CCCSC2)CC1	1832856366	NAUSIVFBHDYXHQ-TZIWHRDSSA-N	444.406	1.743	50	20	IDGD	
C[C@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)c3csnn3)CC2)CC1	1833265331	UCDBYAFADYKODA-GFCCVEGCSA-N	444.399	1.754	50	20	IDGD	
Cc1ccc(OCC(=O)N2CCC(N3CCC(NC(=O)[C@@H](O)CCl)CC3)CC2)cc1	1833308912	DJCBBPCMXHNSCQ-FQEVSTJZSA-N	437.968	1.545	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3ccc4c(c3)COC4)CC2)CC1)[C@H](O)CCl	1833310032	GJLGHAQPDBQEFO-HXUWFJFHSA-N	435.952	1.502	50	20	IDGD	
Cc1nc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)ccc1F	1833465511	DHJYMSHNDMPOJW-YOEHRIQHSA-N	448.264	1.290	50	20	IDGD	
CCc1ncccc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1833519346	PYVVNQMHPLXGIR-MAUKXSAKSA-N	444.301	1.405	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)c3ncn(C)n3)CC2)CC1	1834085000	NESOCWWBDXWYJK-CYBMUJFWSA-N	441.374	1.031	50	20	IDGD	
Cc1c(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](F)Br)CC3)CC2)cnn1C	1834280947	OFVNZDCDNJCUHU-MRXNPFEDSA-N	444.349	1.604	50	20	IDGD	
Cc1cc(C(=O)N2CCC(N3CCC(NC(=O)CCBr)CC3)CC2)n(C)n1	1834421264	YPCKPEILRJFHKI-UHFFFAOYSA-N	440.386	1.699	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(F)cn3)CCO2)C1	1834473803	OVABFRQVTRZJHD-SCLBCKFNSA-N	444.301	1.322	50	20	IDGD	
CCn1nc(C)cc1C(=O)NC1CCN(C2CCN(C(=O)[C@H](Cl)COC)CC2)CC1	1834985155	FMANFHOVLUKHQS-GOSISDBHSA-N	439.988	1.650	50	20	IDGD	
CC[S@](=O)CCC(=O)NC1CCN(C2CCN(C(=O)CO[Si](C)(C)C)CC2)CC1	1835653850	FTJGMPXQAMVDNY-NDEPHWFRSA-N	445.702	1.568	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccccn3)CCO2)C1	1836190783	GVDQOMGPLWSYKI-QFBILLFUSA-N	440.338	1.254	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccccn3)CCO2)C1	1836191836	YASPQRSWTQLPRI-RBUKOAKNSA-N	430.332	1.317	50	20	IDGD	
N#CC1(C(=O)N2CCC(N3CCC(NC(=O)[C@@H](F)Br)CC3)CC2)CCC1	1836414699	YWDLPSNPACDHJZ-OAHLLOKOSA-N	429.334	1.942	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(O)c(F)c3)C2)C1	1837714925	RKQYRLDTGVTSSN-FQEVSTJZSA-N	440.544	1.453	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C#N)c[nH]3)C2)C1	1839153873	UJWLDPWZBQKMKF-ZWKOTPCHSA-N	429.304	1.193	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)cc1O	1839266551	IONDVEHMACIQEC-NRFANRHFSA-N	436.581	1.622	50	20	IDGD	
COc1ccc(F)c(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)c1OC	1839374935	QDNPTKNGVGIAQW-QFBILLFUSA-N	448.850	1.447	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(C)cc(C#N)c3)CCO2)C1	1839454192	ZSGHNBBNUNMQBL-GHTZIAJQSA-N	435.908	1.191	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc[nH]c3C)C2)C1	1839963979	BMLKQGHCOXOXOF-QAPCUYQASA-N	428.327	1.567	50	20	IDGD	
Cc1cccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)c1F	1840030755	VSYTVGGIZLSYKZ-KUHUBIRLSA-N	443.313	1.988	50	20	IDGD	
CCc1oncc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2	1840032157	PBIGTHRBCAPZPK-PXAZEXFGSA-N	430.299	1.090	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CCCSC3)C2)C1	1840035846	HYDJGTRYFASZAQ-JJRVBVJISA-N	435.384	1.369	50	20	IDGD	
Cc1ncc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)s1	1840036493	LPIXXBFBCGPKBJ-PXAZEXFGSA-N	446.367	1.234	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(OC)cc3)C2)C1	1840153809	AXKWCRXHQZTNQZ-YLJYHZDGSA-N	426.897	1.019	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(OC)ccc3C)C2)C1	1840154818	HJONSBULBYHCBI-WIYYLYMNSA-N	440.924	1.327	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC12CN(C(=O)[C@H](CO)NC(=O)OC(C)(C)C)C2	1841286392	BPQCJAMDVLSVMW-OLZOCXBDSA-N	448.358	1.106	50	20	IDGD	
CO[C@H](C)[C@@H](C(=O)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1)N(C)C(=O)OC(C)(C)C	1841352216	BQQSPXZQVLEIRO-KFWWJZLASA-N	447.960	1.060	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC2(CCCN2C(=O)CCc2cn[nH]c2)C1	1842031124	GVWNYNKFWXNMRZ-HNNXBMFYSA-N	439.944	1.678	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](CCN)C(=O)N1CCCC12CN(C(=O)CO[Si](C)(C)C)C2	1842911666	KCFIWZIDTKYYOJ-OAHLLOKOSA-N	442.633	1.283	50	20	IDGD	
COc1ccc(C(=O)N2CC3(CCCN3C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)cc1F	1843415032	CMJOZEZSNMZCJR-AFUMVMLFSA-N	441.463	1.785	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1c[nH]c3ncccc13)C2	1843415921	CZWSZFCTSRXFAT-VULFUBBASA-N	433.472	1.514	50	20	IDGD	
COc1cc(C(=O)N2CC3(CCCN3C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)ccc1C	1843416518	TVZRLERYHZGXGI-PCLIKHOPSA-N	437.500	1.955	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC2(CCCN2C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C1	1843416871	JRXGTIQWDINXLA-LNOXHEFASA-N	438.326	1.497	50	20	IDGD	
COc1cscc1C(=O)N1CCCC12CN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2	1843563495	DEBYPGKNTAXZLJ-LPYMAVHISA-N	429.502	1.708	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC2(CCCN2C(=O)c2cc(=O)nc3sccn23)C1	1844623868	NBHBQTQUZXGIBS-NSHDSACASA-N	439.335	1.604	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@H](CC(=O)OC)NC(=O)OC(C)(C)C)C2	1845167445	COBIIULMOBSGSU-UONOGXRCSA-N	445.944	1.664	50	20	IDGD	
O=C(Cn1cncn1)N1CC2(CCCN2C(=O)[C@@H](Br)Cc2ccccc2)C1	1845941210	MDNWELVFNOVTBS-INIZCTEOSA-N	432.322	1.488	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)cc2Cl)C1	1846299374	BSAVZFHWGLTMFG-SOFGYWHQSA-N	440.692	1.256	50	20	IDGD	
COc1ccc(F)c(C(=O)N2CCCC23CN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C3)c1	1846803067	JJOWKCMKXBDRGG-AFUMVMLFSA-N	441.463	1.785	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)CCc2c[nH]c3ncccc23)C1	1847027627	OPTLJSPYKNMFPU-UHFFFAOYSA-N	426.521	1.072	50	20	IDGD	
Cc1ccc(OCCC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2cnccc2C(=O)NN)cc1	1847393494	BKRGYYSXDWTLGJ-PMACEKPBSA-N	437.500	1.278	50	20	IDGD	
Cc1nn2cc(CC(=O)N3CC[C@H]4[C@@H]3CCN4C(=O)[C@H](C)CBr)nc2s1	1847493891	JUNLTVKVXCMBLE-SWHYSGLUSA-N	440.367	1.875	50	20	IDGD	
CO[C@H](C)[C@@H](C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl)N(C)C(=O)OC(C)(C)C	1847565680	WXPLXVGAKJACPM-YXMSTPNBSA-N	447.960	1.058	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)c1ccc(S(=O)(=O)NC2CC2)cc1	10160059	GPGVCOUZPYZBJS-UHFFFAOYSA-N	441.469	1.093	50	20	IDGD	
CC[C@H](C(=O)OCC(=O)NNC(=O)c1ccccc1)n1nnc(-c2ccc(Cl)cc2)n1	16288797	XPBJLGBHGUHBME-MRXNPFEDSA-N	442.863	1.949	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)[C@H]1CC(=O)N(Cc2ccco2)C1	21637862	FHOZOVDPTPFZDQ-LBPRGKRZSA-N	449.847	1.295	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)c1ccccc1)C(=O)NNc1nc(-c2ccncc2)no1	110327626	CTOCYHPKAUTFKX-HNNXBMFYSA-N	448.530	1.675	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)c2ccc(S(N)(=O)=O)c(Cl)c2)c1C	725907519	LAPNXODYMKIJOM-GFCCVEGCSA-N	425.894	1.833	50	20	IDGD	
O=C(COC(=O)c1cn(-c2ccc(C(F)(F)F)cn2)nn1)NNC(=O)c1ccccc1	726060178	QQCMGFJAJRPBCE-UHFFFAOYSA-N	434.334	1.299	50	20	IDGD	
COc1ccc(CNC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c(C(F)(F)F)c1	726711504	OLRFRTSRWHJLQA-UHFFFAOYSA-N	435.366	1.834	50	20	IDGD	
Cn1nc(Br)c2c(=O)n(CC(=O)NNC(=O)c3cccc(Cl)c3)cnc21	727063274	PUUAEFQKYSUNJH-UHFFFAOYSA-N	439.657	1.007	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CC(=O)N(c2ccc3c(c2)OCCO3)C1)c1cccc(OC(F)F)c1	728487780	ANHVRAONOMTUIN-CYBMUJFWSA-N	447.394	1.873	50	20	IDGD	
COC(=O)CCOc1ccc(S(=O)(=O)NNC(=O)c2cccc(OC(F)F)c2)cc1	728510565	OFAHHPAGSYKGSB-UHFFFAOYSA-N	444.412	1.853	50	20	IDGD	
COc1ccc(OCCCS(=O)(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1	728854546	XNBHNMSKZCDYSF-UHFFFAOYSA-N	449.533	1.121	50	20	IDGD	
CN(C)C(=O)N1CCN(C(=O)NNC(=O)c2ccc(Br)cc2Cl)CC1	728955989	IKVHCTWBWWYILQ-UHFFFAOYSA-N	432.706	1.756	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)N[C@@H](C)[C@H](C)N2CCOCC2)c2ccccc2c1=O	729624308	RTSHUNAVXJJYDM-HOTGVXAUSA-N	444.536	1.250	50	20	IDGD	
CN(C)c1ccc(NC(=S)NNC(=O)c2cc([N+](=O)[O-])cc(S(C)(=O)=O)c2)cc1	729690100	RBPNBOHRJCFDAE-UHFFFAOYSA-N	437.503	1.696	50	20	IDGD	
COC(=O)c1ccc(OCCNC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc1	731284200	SOVBWOZCEJPTKZ-UHFFFAOYSA-N	439.428	1.388	50	20	IDGD	
O=C(NNS(=O)(=O)C[C@@H]1CCCO1)c1ccccc1NS(=O)(=O)c1cccs1	731902362	NSPDHKGRCYMOQY-LBPRGKRZSA-N	445.544	1.292	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)c1cc(S(=O)(=O)N2CCOCC2)ccc1F)c1ccccc1	732001086	MSMJOGWYIUHRDQ-KRWDZBQOSA-N	449.504	1.801	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N(C)Cc2ncc[nH]2)cc1	732092397	DMOFQISJFHWNHA-LFIBNONCSA-N	433.472	1.723	50	20	IDGD	
CCCOc1c(Cl)cc(/C=C(/C#N)C(=O)c2c(N)n(C)c(=O)n(C)c2=O)cc1OC	732578703	VGKKTODOABOLIE-GHXNOFRVSA-N	432.864	1.907	50	20	IDGD	
CC(C)OCCCn1c(NNC(=O)[C@H](C)N2CCN(C)CC2)nc2ccccc2c1=O	733266265	TYPAPZHEEPTIFC-KRWDZBQOSA-N	430.553	1.291	50	20	IDGD	
C#CCOc1ccccc1CNC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	734217425	JSQWWRYIUGBJBD-UHFFFAOYSA-N	435.528	1.741	50	20	IDGD	
Cc1[nH]c(C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)c(C)c1C(=O)OC(C)C	734241304	AWUMJTGCPPMOCO-UHFFFAOYSA-N	425.486	1.665	50	20	IDGD	
CCCC(=O)N1CSC[C@@H]1C(=O)NNc1ccccc1S(=O)(=O)NC(C)(C)C	734252296	MVBZVIJARHVSQR-CQSZACIVSA-N	428.580	1.908	50	20	IDGD	
CC(=NNC(=O)NCCNC(=O)OC(C)(C)C)c1ccc(O)c(CN2CCOCC2)c1	734303921	MIDAHTHHCOJWIU-UHFFFAOYSA-N	435.525	1.772	50	20	IDGD	
Cc1sc(=O)n(CCC(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)c1C	734417461	RMKRQXZVIFPYLM-UHFFFAOYSA-N	429.502	1.669	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)CSCc2nc(O)c3c4c(sc3n2)CCCC4)cn1	735445437	VGHCGCCZLKVLFY-UHFFFAOYSA-N	432.531	1.704	50	20	IDGD	
O=C(NNc1c(F)cccc1F)N[C@@H]1CCCN(c2cc(N3CCOCC3)ncn2)C1	735757781	JKCRKDIFIVOQJV-CQSZACIVSA-N	433.463	1.887	50	20	IDGD	
CC(C)(C)OC(=O)NC1CCC(NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)CC1	740024826	APNASWOLYKFCBY-UHFFFAOYSA-N	444.496	1.442	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)C1CC=CC1)N(S(C)(=O)=O)CC2	740921951	LBWMDLKINUAHMN-MRXNPFEDSA-N	437.518	1.066	50	20	IDGD	
CN1C(=C(C#N)C(=O)COC(=O)CN2CCN(c3ccccn3)CC2)N(C)c2ccccc21	741037865	QSHKAUKAVPZDLW-UHFFFAOYSA-N	446.511	1.637	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@@H](NC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)C1CC1	741281421	MNQUBSXASRKLEG-OAHLLOKOSA-N	440.522	1.337	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2ccc(-n3cncn3)cc2C)c2ccccc2c1=O	742034672	NBDAPOPIVWYUSA-UHFFFAOYSA-N	431.456	1.770	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)ccc1-n1cncn1	742034851	QZWKOWRIVLFANN-UHFFFAOYSA-N	431.456	1.941	50	20	IDGD	
O=C(CCCOc1cccnc1)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	742475189	YDNKWRWUKCMNMP-UHFFFAOYSA-N	432.502	1.486	50	20	IDGD	
COC(=O)N1CCC[C@@H](NC(=O)NNC(=O)Nc2cc(Cl)c(OC)cc2OC)C1	743583943	RNDQYZRLJOCRSK-SNVBAGLBSA-N	429.861	1.924	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN(C(=O)N2CCCC2)C1)c1cc(Br)ccc1O	743733092	BMOBUGUKPLIDQG-GFCCVEGCSA-N	439.310	1.844	50	20	IDGD	
CCCN(CCC)C(=O)CCC(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	744621403	WJZSHGFYLRHVNZ-UHFFFAOYSA-N	440.566	1.579	50	20	IDGD	
CCOC(=O)C1CCN(C(=O)[C@H](C)OC(=O)/C(C#N)=C\c2cc(C#N)n(C)c2C)CC1	744630587	ARLVDLFWCPEZQH-PACYTGELSA-N	426.473	1.846	50	20	IDGD	
CCOc1cn(-c2ccccc2)nc1C(=O)OCC(=O)NNC(=O)c1cccc(C#N)c1	744954926	YYLBDIAKXJJQMR-UHFFFAOYSA-N	433.424	1.761	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)CCSc2ccc3c(c2)OCCO3)cc1	745068965	QTPJFEVMIAYTAY-UHFFFAOYSA-N	441.465	1.816	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)C[C@H]2CN(Cc3ccccc3)CCO2)c1	745100356	BARGHORPDCEDCL-FQEVSTJZSA-N	436.468	1.154	50	20	IDGD	
CC(C)(C)C(=O)NCc1ccc(C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)cc1	745139234	UNPBOZKGEQFFDE-UHFFFAOYSA-N	436.468	1.839	50	20	IDGD	
Cc1nn(CCCl)c(C)c1C(=O)NCc1ccccc1S(=O)(=O)N(C)CCO	746261246	HGZIZYBDEMPIJR-UHFFFAOYSA-N	428.942	1.282	50	20	IDGD	
COC(=O)c1ccsc1N1CC[C@@H](NC(=O)NNC(=O)CCCc2ccccc2)C1=O	746781578	SDMIOCWAJYLTAY-MRXNPFEDSA-N	444.513	1.993	50	20	IDGD	
C[C@@H](CS(C)(=O)=O)C(=O)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1	746840993	BVLOXGCCXGQTDC-JXFKEZNVSA-N	429.542	1.442	50	20	IDGD	
COc1ccc(C(=O)CCC(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1	747148307	VAOJZXBZTXUDCU-UHFFFAOYSA-N	439.877	1.420	50	20	IDGD	
COC(=O)c1ccc(C(=O)OC)c(S(=O)(=O)NNC(=O)c2ccc(Cl)cc2F)c1	747618159	OAACAAQXKDWHFR-UHFFFAOYSA-N	444.824	1.676	50	20	IDGD	
NS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1Br	748050339	BYHCXGLZLPFFIX-UHFFFAOYSA-N	443.235	1.080	50	20	IDGD	
O=C(NNC(=O)c1nnn(-c2ccc(Br)cc2)c1C1CC1)C(=O)N1CCCC1	748733931	YCOCFCNXYUKTNA-UHFFFAOYSA-N	447.293	1.291	50	20	IDGD	
O=C(CNC(=O)c1cc(-c2ccccc2)on1)NNC(=O)c1nn(-c2ccccc2)cc1O	749403887	QYWYZXKCTGYNIB-UHFFFAOYSA-N	446.423	1.424	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN1C(=O)c1ccc2c(c1)OCO2)c1ccc2c(c1)OCCO2	749476774	HGYJJHPKNUTSRT-HNNXBMFYSA-N	439.424	1.252	50	20	IDGD	
CC[C@@H](Oc1ccccc1C)C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	749536753	VSYKIFIEKMKNTC-QGZVFWFLSA-N	447.561	1.627	50	20	IDGD	
O=C(NNc1nc(Br)cn2ccnc12)[C@H]1CN(Cc2ccccc2)CCO1	750248783	VLIYDIRUWPTCCL-CQSZACIVSA-N	431.294	1.836	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)c(=O)oc2ccccc12	750605384	DAMLBHRIIJKSGO-UHFFFAOYSA-N	435.845	1.477	50	20	IDGD	
Cc1n[nH]c(C)c1[C@@H](C)C(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	752576738	AOEJIXPHKQFWGJ-CQSZACIVSA-N	432.956	1.749	50	20	IDGD	
COc1ccc2c(c1)CC(=NNC(=O)c1cccc(S(=O)(=O)N3CCOCC3)c1)CC2	752717113	BHWCZPZELCRMEA-UHFFFAOYSA-N	443.525	1.991	50	20	IDGD	
Cc1nn(C(C)(C)C)cc1C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	753415318	CXGWJYWBEWQHOK-UHFFFAOYSA-N	435.554	1.035	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2ccc3c(c2)NC(=O)[C@H](C)O3)c2ccccc2c1=O	755556572	HDQFMMJBSKXZEC-NSHDSACASA-N	436.428	1.602	50	20	IDGD	
COC(=O)c1cc(Cl)cc(NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c1	756678629	WYHUXZZHYWFREU-UHFFFAOYSA-N	429.820	1.840	50	20	IDGD	
CN(C)Cc1ccc(C(N)=O)cc1NC(=O)NNC(=O)c1cc(-c2cccs2)[nH]n1	756827082	OEPMAOVNPQGPCK-UHFFFAOYSA-N	427.490	1.765	50	20	IDGD	
COc1ccc(-c2ccc(C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)c(F)c2)c(F)c1	758047341	MNBDWEFNQBLXSO-SNVBAGLBSA-N	427.429	1.339	50	20	IDGD	
O=C(NCCSCc1ccnc(Cl)c1)NNC(=O)c1ccc(-n2cnnn2)cc1	758676735	ZCEVGESPMIUZOM-UHFFFAOYSA-N	432.897	1.588	50	20	IDGD	
COc1cc(N2CCN(C(=O)NNC(=O)c3ccc(C#N)cc3)CC2)cc(OC)c1OC	759243648	DILNSXYMJBWWFV-UHFFFAOYSA-N	439.472	1.761	50	20	IDGD	
O=C(NNC(=O)C1=S=C2CCCC2=C1)C(=O)Nc1ccnn1Cc1ccc(F)cc1	760278475	DKUXKSVXYAJALF-UHFFFAOYSA-N	427.461	1.358	50	20	IDGD	
COC(=O)C12CCC(C(=O)NNC(=O)CN3CCN(Cc4ccc(C)cc4)CC3)(CC1)C2	760448859	NZNIYXOZMJTOHM-UHFFFAOYSA-N	442.560	1.384	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)N[C@@H]1CCCN(Cc2ccccc2)C1=O	761797365	GXAOXSDERZTGQE-CQSZACIVSA-N	434.294	1.912	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(CCN2CCCC2)cc1	763442756	BQOPRNRGCHPFLG-UHFFFAOYSA-N	425.445	1.633	50	20	IDGD	
O=C(NNC(=O)c1ccccc1Br)C(=O)Nc1ccc(N2CCCC2=O)cc1	763483380	QRWQBERRNLJOMO-UHFFFAOYSA-N	445.273	1.976	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)c2cccnc2)sc2c1CC[C@@H](C)C2	763489172	VPXJWBPJQNBKOD-LLVKDONJSA-N	430.486	1.844	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2cc(C)oc2C)cc1N1CCCCC1=O	763586575	ORVRNUHGLFPWNK-UHFFFAOYSA-N	428.445	1.822	50	20	IDGD	
Cc1ccc(Cn2nccc2NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)o1	763602253	YCAQSHKOPVDNMQ-UHFFFAOYSA-N	433.428	1.623	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(-n3cccn3)c(Cl)c2)cc1	763680910	RPVXHXFXILXSDK-UHFFFAOYSA-N	438.831	1.562	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc2c(c1)CCCC(=O)N2	763682149	OTQVFCNJPWXORO-UHFFFAOYSA-N	440.456	1.525	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(C#N)ccc1OC(F)F	763682670	SXIXWJRTOZDDSK-UHFFFAOYSA-N	448.382	1.723	50	20	IDGD	
CCOc1cc2c(cc1NC(=O)C(=O)NNC(=O)COc1ccc(F)cc1)O[C@H](C)C2	763842691	IXYPLHSZSHODNE-GFCCVEGCSA-N	431.420	1.713	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)C(=O)Nc1ccc(F)c(C(N)=O)c1	763855430	WLWLNSHJNYNQGH-GFCCVEGCSA-N	438.415	1.631	50	20	IDGD	
COC(=O)c1cc2cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc3ccc(F)cc3)ccc2o1	763865135	IVWSDBSWHIOBKF-NSHDSACASA-N	443.387	1.912	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccc(NC(=O)C2CC2)nc1	763866562	VYRSHTBPWDWXQL-LLVKDONJSA-N	429.408	1.123	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(F)c(C(=O)OC)c2)cc1OC	763911387	KAWLDASKEBFSCF-UHFFFAOYSA-N	447.419	1.809	50	20	IDGD	
CC(C)OCc1cccc(NC(=O)C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)c1	763947320	BAQAJKJBETVNOZ-UHFFFAOYSA-N	437.456	1.903	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)C(=O)Nc1cccc(S(=O)(=O)NC(C)(C)C)c1C	763960367	NGVMNILZFMHXJN-UHFFFAOYSA-N	446.529	1.780	50	20	IDGD	
CN(C)CCC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)CCc2ccccc2)cc1	764189237	ZYEPDTNDIUMZSN-UHFFFAOYSA-N	425.489	1.296	50	20	IDGD	
CC(C)CCNS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)CC(C)(C)C)cc1	764198113	BWBUROLVJIUPIT-UHFFFAOYSA-N	426.539	1.533	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)CCC2CCCCC2)cc1NS(C)(=O)=O	764210546	JGGVRWSRRJGVPG-UHFFFAOYSA-N	440.522	1.513	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)C(=O)Nc1ccccc1CN(C)C(=O)OC(C)(C)C	764294795	CIFHENHQHLDNAN-UHFFFAOYSA-N	430.465	1.485	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)C(=O)Nc1ccc(-c2csnn2)cc1	764345184	CBCLTJJZCATHOE-UHFFFAOYSA-N	433.453	1.791	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)C(=O)Nc1ccc(N2CCSCC2)cc1	764393519	GUOJONYKLMSLCB-UHFFFAOYSA-N	446.554	1.824	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)Cn1c(S)nnc1-c1cccs1	765322984	MVNGVABXQVEAPX-UHFFFAOYSA-N	440.551	1.748	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)NC[C@@H](c1cccc(F)c1)N1CCOCC1	765702744	FQILEFAVSUMWPK-SFHVURJKSA-N	436.509	1.929	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)CNC(=O)CNC(=O)OC(C)(C)C	766327181	PZCCHIJPDQLIME-AWEZNQCLSA-N	444.488	1.395	50	20	IDGD	
CC(C)(C)[C@@H](Br)C(=O)OCC(=O)NCCc1ccc(S(N)(=O)=O)cc1	766749651	DCBDRPZGERWGFV-AWEZNQCLSA-N	435.340	1.346	50	20	IDGD	
CCOC(=O)Cc1csc(NC(=O)NNc2c(OC)cccc2S(C)(=O)=O)n1	767222750	ZRXSJEFGBHWQFM-UHFFFAOYSA-N	428.492	1.809	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)[C@@H]3CCCc4cccnc43)cc2)CC1	768089806	DISBVTHBELSDIH-LJQANCHMSA-N	429.546	1.581	50	20	IDGD	
CC(=O)Nc1ccc(Cl)c(C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c1	768098056	UUOHCYPKGLBAMY-UHFFFAOYSA-N	434.792	1.825	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)C(=O)Nc2cc(C)nn2-c2ncccn2)cc1	768237344	JPCZFHFUKULBIT-UHFFFAOYSA-N	425.474	1.157	50	20	IDGD	
CC(C)(C)c1nnc2ccc(C(=O)NNC(=O)C(=O)NCc3ccc(Cl)cc3)cn12	769617265	QUODWAAFQRDNHS-UHFFFAOYSA-N	428.880	1.758	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)[C@H]3CCCCN3C(=O)OCc3ccccc3)nc21	770973110	YKZANBGBUWTZPJ-OAHLLOKOSA-N	425.449	1.703	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1cc(S(=O)(=O)NCc2ccccc2)ccc1C	771937734	GPNNEMFKAYITLO-HNNXBMFYSA-N	447.513	1.576	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)c1cn([C@H]2CCS(=O)(=O)C2)nc1C(C)C	772160808	FPOBVGMSOBOPEK-KGLIPLIRSA-N	442.538	1.105	50	20	IDGD	
Cc1cnc(N)c(S(=O)(=O)NNC(=O)c2nn(CCC(C)C)c(=O)c3ccccc23)c1	773235079	UTQMTXSTURPZNR-UHFFFAOYSA-N	444.517	1.352	50	20	IDGD	
Cc1coc2ccc(NC(=O)C(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)cc12	773494943	YCIPMPYRNUTZKW-UHFFFAOYSA-N	444.469	1.391	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2cc(Br)ccc2-n2cccn2)n1	773726557	MZYFZGSNCXPJAZ-UHFFFAOYSA-N	432.238	1.515	50	20	IDGD	
O=C(NNc1ccc(C(F)(F)F)cn1)c1sccc1S(=O)(=O)N1CCOCC1	775256897	YALQWPGJTQBKPO-UHFFFAOYSA-N	436.437	1.940	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)N[C@H](c1ccc(OC(F)F)cc1)C(F)(F)F	776012846	KEUYFBVLAHWCRF-MWLCHTKSSA-N	445.366	1.657	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)N[C@H]2CCN(c3ccccc3C(F)(F)F)C2=O)n1	776184000	XNJXVENYRBCRBW-AWEZNQCLSA-N	438.410	1.655	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)NNc1cc(Cl)nc(N)n1	776299276	GPFXERMEIXGHOH-UHFFFAOYSA-N	429.890	1.510	50	20	IDGD	
CCOC(=O)N1CCC([C@@H](C)NC(=O)NNC(=O)c2cc(Br)c[nH]2)CC1	777411777	FOSNWESCOHCKDW-SNVBAGLBSA-N	430.303	1.978	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)cc1	778886730	JJFXUJLOJKYLDG-UHFFFAOYSA-N	434.311	1.686	50	20	IDGD	
CC(C)N1CC[C@H](NC(=O)NNC(=O)C(=O)Nc2ccccn2)[C@@H]1c1ccc(F)c(F)c1	779416949	JEBFSAJMNWJTSN-WMZOPIPTSA-N	446.458	1.853	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@@H](C(=O)NNc2ccc([N+](=O)[O-])cc2Cl)[C@H](C)O)cc1	779533363	FANCMSXQALNZMS-MEDUHNTESA-N	442.881	1.728	50	20	IDGD	
CC(C)(C)OC(=O)NCc1cc(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)co1	780173069	CNJCHXIMBZVCGS-UHFFFAOYSA-N	427.421	1.355	50	20	IDGD	
Cn1ncc(NC(=O)C(=O)NNC(=O)CCSc2ccc(F)cc2)c1C(F)(F)F	782121463	ZTAOBDMIEPVCJZ-UHFFFAOYSA-N	433.387	1.846	50	20	IDGD	
Cc1ccccc1NC(=O)NNC(=O)C(=O)Nc1ccc(S(=O)(=O)C(F)F)cc1	783415964	MMNAKBVVUHFYFT-UHFFFAOYSA-N	426.401	1.783	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@](C)(CNC(=O)NNC(=O)CNC(=O)c2ccco2)C1	784263896	SLAGGYHTHLQWQD-HXUWFJFHSA-N	437.497	1.377	50	20	IDGD	
NC(=O)Cn1cc(NC(=O)C(=O)NNc2ccc(Br)cc2C(F)(F)F)cn1	784770247	KRVKVAZPYKSNNC-UHFFFAOYSA-N	449.187	1.232	50	20	IDGD	
COc1ccc(NC(=O)c2cccc(NC(=O)C(=O)NNc3nccnc3Cl)c2)cn1	784778312	UHIJLQJUUAWNDY-UHFFFAOYSA-N	441.835	1.868	50	20	IDGD	
O=C(NNc1ncc(F)cn1)C(=O)Nc1cccc(C(=O)Nc2ccc(Cl)cn2)c1	784950194	PIQYWVOEZBJISW-UHFFFAOYSA-N	429.799	1.998	50	20	IDGD	
CN(C)C(=O)c1cccc(NC(=O)C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)c1	785100343	WHLBHLOFZMLIPG-UHFFFAOYSA-N	445.426	1.641	50	20	IDGD	
NC(=O)C[C@H](NC(=O)c1ccccc1Cl)C(=O)NNC(=O)C12CC3CC(CC(C3)C1)C2	786143534	JXHKLMCFBRMGJK-OPCFLAAUSA-N	446.935	1.678	50	20	IDGD	
CC[C@H](Oc1ccccc1F)C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	786535413	QUICPIQXENCJHD-KBXCAEBGSA-N	432.404	1.514	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)[C@@H](C)[C@H](C)S(C)(=O)=O)c2ccccc2c1=O	788266537	XERBFJVUBLDQHO-KBPBESRZSA-N	436.534	1.417	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2ccc3[nH]c(=O)c(=O)[nH]c3c2)ccc1OCCC(C)C	788998041	NBMIQQSRWLOJIG-UHFFFAOYSA-N	440.456	1.725	50	20	IDGD	
O=C(NNc1cccc(F)c1[N+](=O)[O-])[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(F)cc1	791148145	QVKGFSMPSONUPE-ABAIWWIYSA-N	442.400	1.140	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)[C@@H](CNC(=O)OC(C)(C)C)c3ccc(F)cc3)nc21	792181068	WISOJDDWPJBGFM-ZDUSSCGKSA-N	445.455	1.960	50	20	IDGD	
Cn1cc(C(=O)CCC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)cn1	792774434	TYSVVZTWBJDORH-UHFFFAOYSA-N	447.517	1.019	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNC(=O)CCc2ccccc2O)c(F)cc1C	793025784	OKZPGKNKZZAHQO-UHFFFAOYSA-N	431.420	1.735	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)N2CCN(S(=O)(=O)c3ccccc3Cl)CC2)n1	793220855	SETUJXKMTUJDPH-UHFFFAOYSA-N	437.909	1.404	50	20	IDGD	
Cc1ccc2c(c1)CC[C@@H](C(=O)NNc1ccc(S(=O)(=O)N3CCN(C)CC3)cc1)O2	793711207	YEIHPLVCFKJYIX-NRFANRHFSA-N	444.557	1.768	50	20	IDGD	
CCn1nc(C)c(CC(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)c1C	794392903	KCGQVLLRZRNFHH-UHFFFAOYSA-N	446.983	1.681	50	20	IDGD	
NC(=O)Cc1occc1C(=O)NNC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1	794778572	RKWWHASFZVHIME-UHFFFAOYSA-N	430.424	1.630	50	20	IDGD	
CC(=NNC(=O)c1ccc(O)c(O)c1)c1ccc(Br)c(S(N)(=O)=O)c1	797403325	IPFXUMIWPVYVMT-UHFFFAOYSA-N	428.264	1.662	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)Cc2ccc(S(N)(=O)=O)s2)c(OC)cc1Cl	802077865	AUFSPFAUAHXIFR-UHFFFAOYSA-N	448.910	1.462	50	20	IDGD	
COC(=O)c1cc(C)c(NC(=O)C(=O)NNC(=O)COc2ccccc2OC)c(Cl)c1	806973333	LSTYZPUOYHWADN-UHFFFAOYSA-N	449.847	1.609	50	20	IDGD	
CCC(C)(C)[C@@H]1CCc2nc(NC(=O)C(=O)NNC(=O)C(=O)N3CCCC3)sc2C1	807004989	ZTWJXVIYRSXSIZ-GFCCVEGCSA-N	435.550	1.393	50	20	IDGD	
CN(C)C(=O)COc1c(Cl)cc(S(=O)(=O)NNC(=O)C(C)(C)C)cc1Cl	808078513	VGIWCSCCXISVPW-UHFFFAOYSA-N	426.322	1.816	50	20	IDGD	
CCCN(CC)C[C@H](C)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	812699399	FVRFWYJURJZKSY-INIZCTEOSA-N	439.582	1.536	50	20	IDGD	
COC(=O)c1cc(Br)cc(C(=O)O[C@H](C)C(=O)NNC(=O)CC(C)C)c1	812699963	ZVIYFYYCUIJPIT-SNVBAGLBSA-N	429.267	1.975	50	20	IDGD	
Cc1ccc(-c2nnc(S)n2CC(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)cc1	812728886	CXZLPDLALKPDJL-UHFFFAOYSA-N	446.558	1.936	50	20	IDGD	
CSC[C@H](C)C(=O)N1CCC(C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)CC1	812729660	QQJSRESMDWPIBM-AWEZNQCLSA-N	442.607	1.618	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)CCCCN2C(=O)c3ccccc3C2=O)cc1	812730520	LTBIHIAXIZHYFI-UHFFFAOYSA-N	444.513	1.847	50	20	IDGD	
COC(=O)c1cn(-c2cccc(NC(=O)NNC(=O)[C@H]3COc4ccccc4O3)c2)nn1	812981126	MTGSPEUFRRVSTE-QGZVFWFLSA-N	438.400	1.047	50	20	IDGD	
CC(=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O)c1sc(-c2ccccc2)nc1C	814785389	ROXHUUVYEGFDFS-UHFFFAOYSA-N	444.542	1.543	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)c2cnn(C)c2I)o1	815105407	DWVLHDSGILRTHP-UHFFFAOYSA-N	445.261	1.534	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2sccc2C#N)c1	815563868	QGNRDCCNJPOZJG-UHFFFAOYSA-N	449.514	1.050	50	20	IDGD	
CNC(=O)c1cc(Oc2cccc(NC(=O)C(=O)NNC(=O)c3ccc(C)o3)c2)ccn1	815569668	BZOFVNPDBCOUSN-UHFFFAOYSA-N	437.412	1.535	50	20	IDGD	
CN(C/C=C/C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1)CC(F)(F)F	815734710	WCDRORQJBAWXEL-QPJJXVBHSA-N	436.456	1.201	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NNC(=O)[C@@H]2CN(Cc3ccccc3)CCO2)C1	816510027	KQOATOOZBXXBMW-MOPGFXCFSA-N	446.548	1.682	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)NC2CCCCC2)cc1S(=O)(=O)N1CCOCC1	913900969	HVNHLALECYWKDD-UHFFFAOYSA-N	438.550	1.547	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNS(=O)(=O)c2ccc(OCC(=O)O)cc2)cc1	915185016	QZJRCJDOXYWYTF-CYBMUJFWSA-N	438.458	1.326	50	20	IDGD	
CN(CCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)c1ccccc1	915901970	ORIIGMMPKYPDQU-UHFFFAOYSA-N	433.534	1.407	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)NCc1ccc(CN2CCN(C)CC2)cc1	916387574	FOWAGJPPBOXJSS-KRWDZBQOSA-N	443.523	1.871	50	20	IDGD	
Cc1cc(C)n(-c2ccc(CNC(=O)NNC(=O)COc3ccccc3[N+](=O)[O-])cn2)n1	916420032	ZUWHAVNJMIDGTF-UHFFFAOYSA-N	439.432	1.702	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCCCCN2CCC[C@H](C)C2)c2ccccc2c1=O	916503935	KKHNRLJAFSLDHV-INIZCTEOSA-N	428.537	1.873	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)NC[C@@H](c1ccccc1)N1CCOCC1	916511197	MNCVNOACQFOCQD-SFHVURJKSA-N	443.460	1.378	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1)c1nncn1C	916580448	AHOGDDBZZYOZOE-CQSZACIVSA-N	446.475	1.222	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)NCc2ccc(S(=O)(=O)N3CCCC3)cc2)c1	916648083	WEVFKCQBUNCHLT-UHFFFAOYSA-N	445.545	1.681	50	20	IDGD	
O=C(COC(=O)COc1ccc(F)cc1Cl)NNC(=O)[C@H]1COc2ccccc2O1	917240347	HUUSZIZCTRPGIG-MRXNPFEDSA-N	438.795	1.389	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2Cl)ccc1Cl	917362513	LWPFHVHVDXIDEJ-UHFFFAOYSA-N	433.229	1.624	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)[C@H]2CCCCN2C(=O)C(C)C)c2ccccc2c1=O	917565092	JMDBRDZZFKBCHV-QGZVFWFLSA-N	427.505	1.605	50	20	IDGD	
CC(C)NC(=O)C(=O)NNC(=O)[C@H]1CCC(=O)N(Cc2ccccc2)[C@H]1c1ccccc1	917622078	IZMXHMMSTSGMRP-FPOVZHCZSA-N	436.512	1.839	50	20	IDGD	
CC[C@H](NC(=O)NNC(=O)COc1ccccc1F)c1ccccc1OCC(=O)NC	918221884	PUCWECQABIBTPC-INIZCTEOSA-N	432.452	1.811	50	20	IDGD	
Cc1ccc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c(C)c1	918226932	FMOGNKGGDUDOCJ-UHFFFAOYSA-N	446.529	1.469	50	20	IDGD	
C[S@@](=O)c1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)cc1	919352532	SIFGYXPXGMZXKR-GDLZYMKVSA-N	449.554	1.673	50	20	IDGD	
O=C(CCCN1C(=O)CNC1=O)NNC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1	920265987	UPUJGARFGGJZLF-UHFFFAOYSA-N	447.455	1.027	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)NCc2cccc(C(=O)NC[C@@H]3CCCO3)c2)c1	920346815	DZXYJHWAOQMHGV-FQEVSTJZSA-N	439.516	1.806	50	20	IDGD	
Cc1ccc(C)c(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)CN3CCCC3=O)cc2)c1	920827535	UDIGJPNCEFBZRX-UHFFFAOYSA-N	444.513	1.488	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)Nc1ncc(Cc2ccccc2Cl)s1	920933052	LVBWGRUKWPJILU-NSHDSACASA-N	428.923	1.975	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)[C@H]2CC23CCS(=O)(=O)CC3)cc1C	1320941353	QHUBUZRWBYNDJG-GFCCVEGCSA-N	428.532	1.138	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@@H]2C(=O)NNC(=O)c2n[nH]c3c2CCCC3)c(OC)c1	1321629245	GAIFYHYMPDAAOJ-QGZVFWFLSA-N	441.488	1.372	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2n[nH]c3c2CCCC3)C1	1777879395	BFDDUAOQQFMKRT-QLVMHMETSA-N	438.956	1.670	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H]1CC(c3ccccc3)=NN1)C2)[C@@H](F)Cl	1778027933	CZMCNRHNCFTRCL-XKGFGPFHSA-N	436.915	1.801	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cccc3c2NC(=O)C3=O)C1	1779151743	RXJRWNLCTAIBHN-XCGNWRKASA-N	447.919	1.966	50	20	IDGD	
C[C@H](C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Br)C2)N1C[C@@H]2C[C@H]2C1	1779252736	GWDGZBONZBFREA-DRVLGICASA-N	446.361	1.531	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccnc(Cl)n3)C2)C1	1779505570	WHOHSBWCBLUEBB-ZBEGNZNMSA-N	431.718	1.747	50	20	IDGD	
COc1ccccc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)C2	1780304664	LYRWCOMUKOOGLH-AUSIDOKSSA-N	446.548	1.196	50	20	IDGD	
CCOC(=O)O[C@@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CO[Si](C)(C)C)C2	1781515298	RUADKPYVAJSBSR-RZQQEMMASA-N	444.601	1.913	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)n1cncn1)C2	1781904503	YLHUJKAPRMSEMU-OIPACUDHSA-N	442.358	1.527	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](Cl)COC)C2	1781904682	AAHFJVKLNGKTEU-VMUDFCTBSA-N	439.778	1.928	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1ccc(F)cn1)C2	1782170229	CNBZGXWZFNDFCR-MBOZVWFJSA-N	427.904	1.531	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H]3Cc4[nH]nc(C(F)(F)F)c4C3)C2)C1	1782847624	AYULPLBHLBHQOB-RRUGBERISA-N	448.873	1.991	50	20	IDGD	
COc1ccccc1CC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2	1783330763	SNUFMEZSRAPQCI-AUUYWEPGSA-N	425.323	1.851	50	20	IDGD	
O=C([C@@H](O)Cc1ccccc1)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1783339778	NCLHJVVPARZIQN-MPGHIAIKSA-N	429.286	1.110	50	20	IDGD	
Cc1ccc(-n2ccnn2)c(C(=O)N2CCO[C@]3(CCN(C(=O)C(Cl)Cl)C3)C2)c1	1783949986	QUGISOFZAVMJKU-IBGZPJMESA-N	438.315	1.823	50	20	IDGD	
COc1ccc(COCC(=O)N2CC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)cc1	1784099066	ZOZNYJFXTJUATC-LJQANCHMSA-N	431.316	1.845	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)c1	1785112412	HPZFCGWCCNJXRU-YJYMSZOUSA-N	438.322	1.872	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)C3CCN(CC)CC3)C2)C1	1785647530	IWSGYQPVXFVGGY-APWZRJJASA-N	430.387	1.722	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)c1c[nH]c2nccc-2c1	1787331327	XJGVPEKNTKOULL-MXAVVETBSA-N	439.285	1.798	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3nccc4nc[nH]c34)[C@H]2C1	1787354834	JHZKUTCMRDPJPL-VIOOABJFSA-N	440.331	1.788	50	20	IDGD	
CC(C)(C)OC(=O)N(CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]2C1)C1CC1	1787444599	AQDJDUVFPVTYQX-NZUILWFCSA-N	447.935	1.900	50	20	IDGD	
COc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]3C2)n1	1787447441	WXYIJVLEMAUKGF-PCVQNBPASA-N	430.820	1.126	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCC3CCC3)C[C@@H]21	1787506486	ABCAKTZTKVPGJE-QXDWZXEQSA-N	443.548	1.680	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4nn[nH]c4c3)C[C@@H]21	1788764653	WVWDQXNZHYQXEN-MPGHIAIKSA-N	431.569	1.403	50	20	IDGD	
COCC1(C(=O)NC2(c3ccc(NC(=O)c4cnccc4C(=O)NN)cc3)CCC2)CC1	1789519982	XBPLFSGEHSSZPR-UHFFFAOYSA-N	437.500	1.859	50	20	IDGD	
C[C@H](Cn1cncn1)C(=O)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1	1789615161	YGQJEOGITOMYFN-MRXNPFEDSA-N	447.304	1.042	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(S(C)(=O)=O)c3)C[C@@H]21	1789859573	VCDWEWQMZCUPDK-OWLYRPNTSA-N	442.965	1.701	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(C4CC4)on3)C[C@@H]21)[C@H](F)Br	1789921583	QSAHGWFHTJOTJF-GVARAGBVSA-N	430.274	1.836	50	20	IDGD	
Cc1nc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]3C2)ccc1F	1789922249	IZHAYLNCOOYHAM-GVARAGBVSA-N	432.265	1.813	50	20	IDGD	
CC[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)Br)[C@H]2C1)N(CC)CC	1791054980	COZRHKZHHNUBJO-VIQHNZTISA-N	432.403	1.870	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cn4ncccc4n3)C[C@@H]21	1791055798	IHGIDGLIKZMSNP-ABHRYQDASA-N	436.310	1.106	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccn4nccc34)C[C@@H]21	1791063692	QEPIZEJJMXOIAC-RMRKRWHISA-N	435.322	1.711	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3n(n1)CCC3)C2	1792870835	LQPNWBLNQYDLAK-JFILPPLUSA-N	425.327	1.064	50	20	IDGD	
C#CCO[C@@H](C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1794141359	GTDFKYCATJRGGL-KSWRQPAISA-N	441.956	1.795	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CNC(=O)c1cccs1	1794394692	GCLOHLXFGKSBEZ-FVCCEPFGSA-N	428.352	1.900	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1c(F)ccnc1Cl)c1cccc(B(O)O)c1	1794528080	HTFDFIBYPYMTBI-QDMKHBRRSA-N	431.660	1.120	50	20	IDGD	
O=C(Cc1ccc(Cl)c(F)c1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1	1796185826	SZDPPJFOOFDTLC-BCDXTJNWSA-N	444.699	1.653	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)Nc1nccs1	1796418250	ZMGTUENPSSQXHQ-NJMOYASZSA-N	431.356	1.317	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cn2cc(Cl)ccc2n1	1796850236	AUBXLGARVLBJPQ-IFOZYUSPSA-N	441.315	1.445	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1n[nH]c2c(F)cccc12	1797489911	ILPYXEOQIRDNKV-FVCICTRLSA-N	434.544	1.757	50	20	IDGD	
Cc1nc[nH]c1CSCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CO[Si](C)(C)C)C2	1797663098	KNMUTLRZBXAKGT-CCWDJLKJSA-N	440.642	1.392	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1CCC(F)(F)CC1)C2	1798439689	XAYDEFULVJTGRP-QDMKHBRRSA-N	435.475	1.762	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccccc1Cl	1799539020	ZJOIPQJIWLNDIH-BTTYYORXSA-N	427.892	1.904	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1noc3c1CCCC3)C2	1800757407	YGMBEWSUUIUDPI-OHTBPHCPSA-N	426.311	1.540	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3cccnc3n1)C2	1800759323	LQGHDNOMWWSPBM-OEYIWLLWSA-N	433.306	1.616	50	20	IDGD	
Cc1cc(C)n(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCBr)C3)n1	1801246502	CTDHXLQRFLRCDW-JLVBRIDZSA-N	427.343	1.265	50	20	IDGD	
COc1cc(CCC(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)ccn1	1803135720	GESVPCVQIOHMTL-LVCYWYKZSA-N	446.935	1.724	50	20	IDGD	
COc1nccc(C(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)c1F	1803139084	SLEPOVSRXLVVOO-KMFMINBZSA-N	436.871	1.544	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CCc2cc(F)ccn2)[C@H]1c1cccnc1)[C@@H](O)CCl	1803140276	CAJFAPGDGQAXRC-QSFXBCCZSA-N	434.899	1.854	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC2(CCN(C(=O)[C@H]3CCNC(=O)C3)CC2)C1	1805390055	ZMQXLLPCXVNTTO-CABCVRRESA-N	428.371	1.775	50	20	IDGD	
CC(C)CNC(=O)C(=O)N1CC[C@H](CNC(=O)CCBr)[C@@H]1c1cccnc1	1806340603	HLJDOPRDSOICLG-WBVHZDCISA-N	439.354	1.645	50	20	IDGD	
C=C(C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)C(F)(F)F	1807374054	WWKDTXWILDMVKI-SJLPKXTDSA-N	447.222	1.200	50	20	IDGD	
Cc1ccoc1C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1808494413	OZEPQQWGRBIIFM-AZUAARDMSA-N	433.273	1.296	50	20	IDGD	
CC(C)N1CCC[C@H]1C(=O)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1	1809972361	HMWUKOSHYBKVHD-NRFANRHFSA-N	441.381	1.084	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2cnc(N(C)C)o2)[C@@H]1c1cccnc1	1813029509	ODVCXTRRGFPNOQ-YQQAZPJKSA-N	435.912	1.709	50	20	IDGD	
C[C@]1(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)CC1(F)F	1814073308	AZEMHVZLWCLIOW-HGHGUNKESA-N	443.259	1.126	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@@H]2Cc3ccccc3CN2)[nH]n1)[C@@H](O)CCl	1814870357	PWLSOWCHDCQQOQ-KSZLIROESA-N	431.924	1.716	50	20	IDGD	
Cc1ccc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)o1	1815350197	JUJFSEGTZLMVDL-AWEZNQCLSA-N	425.275	1.264	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cscn1)CC2	1819795282	LRLOZLFGDQISGE-SECBINFHSA-N	443.514	1.138	50	20	IDGD	
COC(=O)C1(C(=O)N[C@@H]2CCc3nc(NC(=O)[C@H](F)Br)sc3C2)CC1	1823009020	JGDMTTODKIDWBJ-XCBNKYQSSA-N	434.287	1.699	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](N)Cc1cscn1)CC2	1825998875	OEDGYKUPASJWSV-WCQGTBRESA-N	443.982	1.335	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)no1	1826052648	VCKNZBBQZLJDQV-IBGZPJMESA-N	440.504	1.529	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccncc1F)CC2	1826086496	WZORZNPRYWKGKR-NSHDSACASA-N	434.497	1.276	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CN2CCNC2=N)CC1	1826873922	PCVWBANAJOHOJT-HIFRSBDPSA-N	428.375	1.229	50	20	IDGD	
CC(C)n1cnc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)n1	1830358541	XGQLSBRAXBFPNX-IBGZPJMESA-N	427.933	1.194	50	20	IDGD	
O=C(CN1CCOCC1)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](F)Br)CC1	1830375450	UMCZRLGVMSEMDX-DOTOQJQBSA-N	434.350	1.629	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cccc(F)c3F)CC2)CC1)[C@H](O)CCl	1833313949	VVSOZPKZGMEIHT-QGZVFWFLSA-N	429.895	1.750	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)CN3CCN(C)CC3)CC2)CC1	1833532638	AKVNPRFWLWHWLK-HXUWFJFHSA-N	442.048	1.213	50	20	IDGD	
CCC(=O)N[C@@H](C)C(=O)N1CCC(N2CCC(NC(=O)CCBr)CC2)CC1	1834422663	XGFKOWPQWXJTBZ-AWEZNQCLSA-N	445.402	1.258	50	20	IDGD	
C[C@@]1(C(=O)N2CCOC[C@]3(CN(C(=O)CCBr)CCO3)C2)CC1(F)F	1834826368	MUTNLIMQULPIOG-GJZGRUSLSA-N	425.270	1.273	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3nccc4nc[nH]c34)CC2)CC1	1835029050	JKODWYMZMNJBRC-INIZCTEOSA-N	448.955	1.397	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)c1ccc2ncoc2c1	1835409174	JIGQYGWUKATTTB-GOSISDBHSA-N	434.924	1.613	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC(OC2CCN(C(=O)C(=O)N(C)C)CC2)CC1	1836670215	BYDZIDITVRUBOO-ZDUSSCGKSA-N	432.359	1.104	50	20	IDGD	
Cc1nc(C)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)o1	1838005997	HRWDEGBJLPCVNG-CJNGLKHVSA-N	434.262	1.052	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)COc3ccc(O)cc3)C2)C1	1839141854	VHGNISAKESLPOM-FXAWDEMLSA-N	426.897	1.245	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4c(c3)OCCO4)C2)C1	1839144602	FWRHNCADNSAKQB-IIBYNOLFSA-N	438.908	1.545	50	20	IDGD	
C=C(C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1)C(F)(F)F	1839893993	CJUNHQBPRMFLGV-GXFFZTMASA-N	433.196	1.252	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3nccnc3C)C2)C1	1839966138	VSGMPRQONVXAIY-KDOFPFPSSA-N	441.326	1.029	50	20	IDGD	
O=C(Cn1cnc2ccccc21)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1840103032	IYFQFISZCXWYMZ-IBGZPJMESA-N	441.315	1.296	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](CC(=O)N2CCCC23CN(C(=O)[C@@H](O)CCl)C3)C1	1841412824	MRPZEXBMAMHEEF-HOTGVXAUSA-N	443.972	1.827	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)c1	1841879410	VZEKSIDGUBTEDU-UHFFFAOYSA-N	437.500	1.198	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](O)[C@@](C)(C(=O)N2CC3(CCCN3C(=O)[C@@H](F)Cl)C2)C1	1843361703	IMAVYWZANMRNEF-KSMMKXTCSA-N	447.935	1.732	50	20	IDGD	
COC(=O)C[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)[C@@H](F)Cl)C1	1843366823	SBVMGVJGCBVVOV-DGCLKSJQSA-N	435.880	1.181	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)c2nc3c(=O)[nH]c4ccccc4n3n2)C1	1843809581	ZKBJBGRLFHUGQJ-GFCCVEGCSA-N	428.880	1.405	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)Cc2ccc(Br)nc2)C1	1844990202	HEVLCALHYFNOAC-CYBMUJFWSA-N	430.730	1.844	50	20	IDGD	
O=C1COc2ccc(C(=O)N3CC4(CCCN4C(=O)[C@@H](F)Br)C3)cc2N1	1845217988	GUFKJNWHVJZESQ-CQSZACIVSA-N	426.242	1.525	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)C1CN(C(=O)c3ccccc3OC)C1)C2	1846360520	RHRZNTNHURXUSL-KRWDZBQOSA-N	449.935	1.224	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N1CCCC12CN(C(=O)[C@H](F)Cl)C2	1846534976	YJOYRMUFTVLPDT-KBPBESRZSA-N	443.907	1.583	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CC(=O)OC(C)(C)C	1847937715	XCXSUZSINGBHIC-BTWVVVFHSA-N	431.493	1.054	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)C1CCOCC1	1848099302	IVIXYYYXHFRABY-JYJNAYRXSA-N	429.945	1.747	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)Cc1ccc(Cl)s1	1848109558	HQBAEBAYISRISA-GJZGRUSLSA-N	433.921	1.458	50	20	IDGD	
CC(=O)N1CCCc2cc(S(=O)(=O)NNC(=O)[C@@H]3COc4ccccc4O3)ccc21	15243866	JCKMYVIUDWPXDQ-IBGZPJMESA-N	431.470	1.135	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)C1CCN(S(=O)(=O)c2ccccc2)CC1	15889523	SKXYKAAZIYRNRV-UHFFFAOYSA-N	435.477	1.453	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)CCN1C(=O)[C@@H](C)Oc2ccccc21	16205311	TYYKMDPFHDVMOC-OAHLLOKOSA-N	435.484	1.950	50	20	IDGD	
N#Cc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)c3ccccc3O)CC2)cc1	22259318	BISCJQUZHQDREO-UHFFFAOYSA-N	428.470	1.126	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Cn2cc(C(F)(F)F)cc(Cl)c2=O)cc1OC	25404671	IPMFQOVLLZWSFY-UHFFFAOYSA-N	433.770	1.999	50	20	IDGD	
C[C@@H]1CCCCN1Cc1ccc(CNC(=O)NNC(=O)CNC(=O)c2ccco2)cc1	725872273	MHERPNQJORXLRY-MRXNPFEDSA-N	427.505	1.914	50	20	IDGD	
CCn1cc(NC(=S)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)cn1	726120683	RWRAEAMJQVVEQL-UHFFFAOYSA-N	436.563	1.709	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)N[C@@H](C)C(=O)N1CCCC[C@@H]1C	726610892	MPOZUCGXULXHHJ-JSGCOSHPSA-N	438.554	1.022	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)c1c[nH]n2c1nc(=O)c1ccccc12	726863382	RLVONSFZIILRBN-UHFFFAOYSA-N	438.469	1.373	50	20	IDGD	
CC(=O)N[C@H](CC(=O)NNC(=O)c1nnc(O)c2ccccc12)c1c(F)cccc1F	727364847	FOUVSRGXUPWMOZ-OAHLLOKOSA-N	429.383	1.642	50	20	IDGD	
CNS(=O)(=O)c1cccc([C@@H](C)NC(=O)NNC(=O)COc2ccccc2OC)c1	727609379	KHHSBJNOGFKXHW-CYBMUJFWSA-N	436.490	1.074	50	20	IDGD	
COCCN1C(=O)c2ccc(C(=O)NNC(=O)CCCc3ccccc3)cc2S1(=O)=O	727718150	YLLUQFPDFRXOLQ-UHFFFAOYSA-N	445.497	1.261	50	20	IDGD	
O=C(CCC(=O)N1CCc2sccc2C1)NNc1ccc(S(=O)(=O)NC2CC2)cc1	728211649	ZYKSGEXDDMWHDM-UHFFFAOYSA-N	448.570	1.997	50	20	IDGD	
O=C(CSc1ccc2c(c1)OCCO2)NNC(=O)C1CCN(c2ncccn2)CC1	728845963	QWZAAOPYKSKFOE-UHFFFAOYSA-N	429.502	1.404	50	20	IDGD	
C[C@@H]1CN(C(=O)c2ccc(CNC(=O)NNC(=O)Cc3cccnc3)cc2)C[C@@H](C)O1	728958255	YXLSTMMNESXEDC-HZPDHXFCSA-N	425.489	1.404	50	20	IDGD	
CN(C(=O)c1cccc(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)c1)c1ccccc1	729342032	UYDLFVYGDYJAAV-MRXNPFEDSA-N	430.486	1.094	50	20	IDGD	
O=C(CC(F)(F)F)NNC(=O)CC1(CC(=O)NNC(=O)CC(F)(F)F)CCCCC1	729861273	NLDGYOUEUYFMJB-UHFFFAOYSA-N	448.364	1.917	50	20	IDGD	
CNS(=O)(=O)Cc1ccc(CNC(=O)NNC(=O)c2cccc3ncccc23)cc1	730114721	CKVHOWKMBZUKGE-UHFFFAOYSA-N	427.486	1.428	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)[C@@H]1CC(=O)N(c2ccc(F)cc2)C1	730218580	MFTJMGBMAOBITO-CYBMUJFWSA-N	432.477	1.763	50	20	IDGD	
COc1ccc(Cn2ncc3cc(C(=O)NNC(=O)c4c[nH]nc4C)cnc32)c(OC)c1	732082251	BDLZAPAGUHBGFL-UHFFFAOYSA-N	435.444	1.603	50	20	IDGD	
O=C(COC(=O)c1ccc(N2CCOCC2)c(F)c1)NNC(=O)c1cccc([N+](=O)[O-])c1	732342934	ZNWAZWSOCQXTBN-UHFFFAOYSA-N	446.391	1.189	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)N[C@@H]2CCN(CC(F)(F)F)C2=O)cc1OC	732589541	CYKNGQBTVXJTSD-CYBMUJFWSA-N	446.426	1.981	50	20	IDGD	
O=C(CNc1ccccc1)NNC(=O)[C@H]1CCCN1S(=O)(=O)c1cccc([N+](=O)[O-])c1	732996931	PTPKRWCLOPTYQI-QGZVFWFLSA-N	447.473	1.007	50	20	IDGD	
COc1ccccc1CC(C)(C)C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	733026184	GTJKMHXYUUEHEZ-IBGZPJMESA-N	442.468	1.795	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)NC[C@@]2(C)CCOC2)cc1	733181121	QWRUJUZLCIRDIB-XHAORJAKSA-N	437.500	1.884	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1	733339926	SVDDMRRWVYANPP-UHFFFAOYSA-N	442.501	1.267	50	20	IDGD	
CSCc1nc2ccccc2n1CC(=O)NNC(=O)NCCNC(=O)OC(C)(C)C	734241133	DXDZVFJTKLYUOS-UHFFFAOYSA-N	436.538	1.754	50	20	IDGD	
CN1C(=O)C[C@H](C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)[C@H]1c1cccc(Cl)c1	734387232	NJKOYXLIGUQXCU-UCLAIMLFSA-N	429.860	1.847	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)NC2CCN(S(=O)(=O)C3CCOCC3)CC2)cc1	736405881	QXSHMGNJXZOKPP-UHFFFAOYSA-N	438.550	1.166	50	20	IDGD	
O=C(COC(=O)Cc1ccc(S(=O)(=O)CC(F)F)cc1)NNC(=O)c1ccccc1	736915376	HUXQFKRZHVAVLF-UHFFFAOYSA-N	440.424	1.272	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)CN(C[C@@H]1CCCO1)C(=O)OC(C)(C)C	742036050	BMGVDLXIXODYEI-HNNXBMFYSA-N	431.493	1.820	50	20	IDGD	
O=Cc1ccc(OCC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c(Br)c1	742481440	WVPCFCHIUYAHNY-UHFFFAOYSA-N	445.233	1.077	50	20	IDGD	
C[C@H](C(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)n1nnc(-c2ccccc2)n1	743829873	GECWHGHPIAJKEX-GFCCVEGCSA-N	429.462	1.158	50	20	IDGD	
C[C@@H]1Oc2ccc(C(=O)C3CCN(CC(=O)NNC(=O)C(C)(C)C)CC3)cc2NC1=O	744396858	UDAIGVVMUXJICL-ZDUSSCGKSA-N	430.505	1.494	50	20	IDGD	
CCO[C@H](C)c1nc(CN2CCN([C@@H](C)C(=O)NNC(=O)CC(C)C)CC2)cs1	744412987	LOYXHCRVQYUQQX-JKSUJKDBSA-N	425.599	1.940	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)sc1Br	744464171	WNIWATVUKAIJBY-UHFFFAOYSA-N	449.264	1.141	50	20	IDGD	
CC(=O)N[C@@H](CC(=O)OCC(=O)NNC(=O)c1ccc(C#N)cc1)c1ccc(Cl)cc1	744513363	RHSRLTKMFOUWER-SFHVURJKSA-N	442.859	1.783	50	20	IDGD	
Cc1ccc([C@](O)(CC(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)C(F)(F)F)o1	744657749	JAVIZBGNXCDYRR-GOSISDBHSA-N	439.346	1.604	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)CCCc2nc(-c3cccs3)no2)c1	744740580	JVKZWRABXOUBOT-UHFFFAOYSA-N	439.453	1.997	50	20	IDGD	
Cc1cccc2c(CCC(=O)OCC(=O)NNC(=O)[C@H]3COc4ccccc4O3)c[nH]c12	745135593	OTLSCGIRVWFYPY-LJQANCHMSA-N	437.452	1.940	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1)[C@@H]1CCOC1	745860857	FGKJHGYFIWZORS-HNAYVOBHSA-N	435.488	1.757	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)[C@@H]1COc2ccccc2O1)n1nnc(-c2ccc(Cl)cc2)n1	746080722	ZNUCAWSTEIOTDV-YOEHRIQHSA-N	442.863	1.932	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)/C=C/c1ccccc1)C(=O)NNC(=O)Cc1ccncc1	747428734	UUHXARHXBCIXMG-MDNBWPLSSA-N	448.570	1.484	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2CN1S(=O)(=O)c1ccc(F)cc1)c1ccc[nH]1	747663790	YPJUQHYQSDSNQX-IBGZPJMESA-N	442.472	1.731	50	20	IDGD	
O=C(Cc1nc2ncccn2n1)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1	747778323	FOSQYYCXGBYJEK-FQEVSTJZSA-N	441.495	1.441	50	20	IDGD	
NS(=O)(=O)c1ccc(N2CCOCC2)c(C(=O)NNc2cccc(C(F)(F)F)c2)c1	747995303	MDHMKDLKXQWOFT-UHFFFAOYSA-N	444.435	1.946	50	20	IDGD	
CN(CC(=O)NNc1ccc(OC(F)F)cc1)S(=O)(=O)c1cccc([N+](=O)[O-])c1	748654639	YJJIWQSGIZVVPG-UHFFFAOYSA-N	430.389	1.960	50	20	IDGD	
CCCCO[C@@H]1C[C@H](NC(=O)NNC(=O)c2csc(N3CCOCC3)n2)C1(C)C	748968904	JBBBCKOTFDAMHD-LSDHHAIUSA-N	425.555	1.908	50	20	IDGD	
COc1ccc2c(c1)OCC2=NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	749157577	JPLGGDIEXXASRU-UHFFFAOYSA-N	431.470	1.243	50	20	IDGD	
Cc1nn(CCO)c2ncc(C(=O)OCC(=O)C(C#N)=C3N(C)c4ccccc4N3C)cc12	749410662	WSZPCLZKJVGFAU-UHFFFAOYSA-N	446.467	1.779	50	20	IDGD	
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)NNC(=O)c1cc2ccccc2o1	749472859	USZSJQZTMMHMGX-INIZCTEOSA-N	438.440	1.754	50	20	IDGD	
O=C(NNc1nc(Br)cn2ccnc12)[C@@H]1CCCN(C(=O)N2CCCC2)C1	750247219	MTYPZMXNRRVVAD-GFCCVEGCSA-N	436.314	1.863	50	20	IDGD	
CCCCN1C(=O)CC[C@H](C(=O)NNC(=O)C(=O)NC2CC2)[C@@H]1c1ccccc1OC	750873363	NXXZUDNAKREQRC-LPHOPBHVSA-N	430.505	1.201	50	20	IDGD	
CCc1cccc(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1	751202536	NDISCVUAONEWTP-UHFFFAOYSA-N	437.543	1.657	50	20	IDGD	
COCCOc1ccccc1C=NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	751517096	PIFRAMGLYNWXFA-UHFFFAOYSA-N	447.513	1.497	50	20	IDGD	
Cc1noc(C)c1[C@H](C)CC(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	754468913	XAPPXRCDCHXYON-CYBMUJFWSA-N	436.538	1.259	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NCC(=O)NNc2cccnc2Cl)c1	754470031	AMLSKLLFLXPNGN-UHFFFAOYSA-N	439.925	1.639	50	20	IDGD	
COCCN(C)S(=O)(=O)[C@@H]1CCCN(C(=O)/C(C#N)=C\c2cc(C#N)n(C)c2C)C1	754708558	IFGBIVNNYYEUOJ-WSDUQJHMSA-N	433.534	1.011	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)Cc3cc[nH]n3)cc2)cc1	755284162	NJKCCFOTPGUWLT-UHFFFAOYSA-N	441.469	1.417	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccc3c(c2)OCCCO3)c1	755451604	DWPXMILVZQUIGR-UHFFFAOYSA-N	434.474	1.565	50	20	IDGD	
COC(=O)c1nc(Cl)ccc1S(=O)(=O)NNC(=O)c1cc(OC)cc(OC)c1	755959134	VNHYSEQRLNFVLQ-UHFFFAOYSA-N	429.838	1.162	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc(C)c1Br	756163842	JRGRTSOPKJLNSN-HNNXBMFYSA-N	448.273	1.992	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)Nc2ccc(C)c(S(=O)(=O)NC3CC3)c2C)n1	756711213	KBBUXSXLZGOHPR-UHFFFAOYSA-N	434.522	1.410	50	20	IDGD	
Cc1c(NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cccc1N1CCOC1=O	756819225	UJRWRQXISGCJBG-UHFFFAOYSA-N	432.458	1.822	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)c1cncc(I)c1	756870875	NNDMPLGKFZRGQS-UHFFFAOYSA-N	435.019	1.852	50	20	IDGD	
C[C@H]1C[C@H](C)CC2(C1)NC(=O)N(CC(=O)NNC(=S)NCCc1cccs1)C2=O	757634627	WFMPPEZTJAFUBM-STQMWFEESA-N	437.591	1.533	50	20	IDGD	
Cc1cnn(-c2ccc(S(=O)(=O)NNC(=O)c3c(C)nc4ccccn34)cc2F)c1	757645621	NVCDTBJPQMCCHB-UHFFFAOYSA-N	428.449	1.899	50	20	IDGD	
Cc1cc(C(=O)N2CCN(S(=O)(=O)CBr)CC2)c2c(C)nn(C)c2n1	758514022	XXAITTHFSGDDSV-UHFFFAOYSA-N	430.328	1.025	50	20	IDGD	
C[C@H](Oc1ccc(F)c(F)c1)C(=O)N1CCN(S(=O)(=O)CBr)CC1	758522405	HKXVUSPQAXAXHH-JTQLQIEISA-N	427.267	1.559	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NCCCc2ccc3c(c2)OCCO3)cc1	758895427	ZWWDXRGOMLLEJB-UHFFFAOYSA-N	448.501	1.830	50	20	IDGD	
O=C(NC[C@@H]1CSCCN1Cc1ccccc1)NNC(=O)[C@@H]1COc2ccccc2O1	759199904	HBJJOCGYCOIGHD-XLIONFOSSA-N	442.541	1.774	50	20	IDGD	
O=C(NNC(=O)c1ccccc1Br)C(=O)Nc1cc(C(F)(F)F)cnc1O	763484392	ZKCORWHFEGCWPN-UHFFFAOYSA-N	447.167	1.968	50	20	IDGD	
CCOc1cc(NC(=O)c2ccccc2)c(OCC)cc1NC(=O)C(=O)NNC(C)=O	763515912	XCILMXGTGPJFQG-UHFFFAOYSA-N	428.445	1.842	50	20	IDGD	
CC(=O)NNC(=O)C(=O)Nc1ccc(C(=O)OC[C@@H]2CCCN2C(=O)OC(C)(C)C)cc1	763516494	JRKJPNVMVCBJFB-INIZCTEOSA-N	448.476	1.349	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(F)cc2OCC(F)F)cc1OC	763549841	AOYBLHQMYNCQBZ-UHFFFAOYSA-N	441.362	1.887	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)[nH]n1)C(=O)Nc1ncn(Cc2ccccc2)n1	763605634	WONNBJLWTZDZQO-UHFFFAOYSA-N	430.428	1.116	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1ccc(N2CCOC[C@@H]2C)cc1	763628725	LVOBFMZJFIWPIF-AWEZNQCLSA-N	436.472	1.268	50	20	IDGD	
CCNC(=O)c1ccc(C)c(NC(=O)C(=O)NNC(=O)COc2cc(C)ccc2C)c1	763665867	PXWZLLRUOAMNNC-UHFFFAOYSA-N	426.473	1.526	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)C(=O)Nc1ccc(OCC2CCOCC2)cc1	763679342	LEZMQGJLRJNCKE-UHFFFAOYSA-N	445.447	1.796	50	20	IDGD	
COC(=O)c1cc(Cl)cc(NC(=O)C(=O)NNC(=O)c2cc(OC)cc(OC)c2)c1	763773065	UFFOTMHMUJHGNN-UHFFFAOYSA-N	435.820	1.544	50	20	IDGD	
C[C@@H]1CCCN(Cc2ccc(NC(=O)C(=O)NNC(=O)COc3ccccc3C#N)cc2)C1	763807860	HLKTYIBZUKJVFP-QGZVFWFLSA-N	449.511	1.955	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccc(CN2CCOC2=O)cc1	763856217	FNAKWZRVYFOATO-CYBMUJFWSA-N	444.419	1.331	50	20	IDGD	
Cc1nc(COc2ccc(NC(=O)C(=O)NNC(=O)Cc3c[nH]c4ccccc34)cc2)no1	763860595	JYEAGAGLIFPGGB-UHFFFAOYSA-N	448.439	1.767	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(CCN(C)C)cc2)cc1OC	763912461	ORFVMYOFMDOMDI-UHFFFAOYSA-N	428.489	1.598	50	20	IDGD	
CCn1ncc2ccc(NC(=O)C(=O)NNC(=O)c3nn(-c4ccccc4)cc3O)cc21	763943980	ITOZGZCTLCCUAW-UHFFFAOYSA-N	433.428	1.347	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cccc(Br)c2)c(F)c1	764059059	OELXVIFDYHPFOC-UHFFFAOYSA-N	438.209	1.775	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(CS(=O)(=O)C(C)(C)C)c2)c(O)c1	764109667	APHYGMQTLFOMJQ-UHFFFAOYSA-N	447.513	1.814	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(Oc3cccc(C#N)c3)nc2)c1O	764130722	DEPKTOPEFUROOU-UHFFFAOYSA-N	447.407	1.859	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2O1)C(=O)Nc1ccc(-n2cnc3ccccc32)nc1	764154088	OBDSWQSVBASOOO-LJQANCHMSA-N	442.435	1.510	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(OC(F)F)c2)c(OC)c1OC	764260540	ZWFVRXOYLMRGDR-UHFFFAOYSA-N	439.371	1.714	50	20	IDGD	
C[S@](=O)c1cccc(NC(=O)C(=O)NNC(=O)c2cc(Br)ccc2O)c1	764276878	HPTVSQVHPSLUAA-SANMLTNESA-N	440.275	1.292	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)Cc2cc[nH]n2)n(-c2cccc(C(F)(F)F)c2)n1	764285417	FFRJVWAYFLAUMD-UHFFFAOYSA-N	435.366	1.251	50	20	IDGD	
CC(C)(C(=O)NNC(=O)C(=O)Nc1ccc(CCS(C)(=O)=O)cc1)c1ccccc1	764320932	ONCGMOKOVDCQEE-UHFFFAOYSA-N	431.514	1.337	50	20	IDGD	
O=C(NNC(=O)C(F)(F)Oc1ccccc1)C(=O)Nc1ccccc1N1CCOC1=O	764370615	SRJDQOGKDISVJK-UHFFFAOYSA-N	434.355	1.401	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)cc1OC	765749569	YXNSYBHJTYFACS-UHFFFAOYSA-N	426.517	1.591	50	20	IDGD	
CCN(CC)C(=O)CCC(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	765757809	GMEUUHXLAOSABG-UHFFFAOYSA-N	437.972	1.254	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)[C@@H]1CCCN1Cc1ccccc1	766635690	CRLJCNLPILCSCC-QFIPXVFZSA-N	449.555	1.256	50	20	IDGD	
CC(C)(C)N1C[C@@H](C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)CC1=O	766663349	KFGYNIQZCMTLIY-KRWDZBQOSA-N	449.983	1.252	50	20	IDGD	
O=C(NNc1ncnc2ccsc12)[C@H]1CCCN1S(=O)(=O)c1cccc([N+](=O)[O-])c1	766674374	SDURNHYAHGTKBI-CQSZACIVSA-N	448.486	1.896	50	20	IDGD	
CS(=O)(=O)Nc1ccc(N2CCN(C(=O)NNC(=O)c3ccc(C#N)cc3)CC2)cc1	767204539	NFCGEUAJCNVXHC-UHFFFAOYSA-N	442.501	1.106	50	20	IDGD	
CCn1cc(C(=O)OCC(=O)NNC(=O)Cc2ccccc2C)c(=O)c2ccc(C)nc21	767244330	QIFAOWINGOUUIT-UHFFFAOYSA-N	436.468	1.580	50	20	IDGD	
O=C(Cc1cc(F)c(F)cc1F)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	767825787	SGIBFZLRWKZXMT-UHFFFAOYSA-N	441.431	1.892	50	20	IDGD	
CCC(CC)[C@H](C(=O)NNC(=O)c1cc(-c2ccccc2OC)[nH]n1)N1CCOCC1	768274664	VNTANIAISPJJNA-HXUWFJFHSA-N	429.521	1.983	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)NC2CCN([C@@H]3CCCC[C@H]3O)CC2)cc1C	769165508	FARWAWANTRSPGI-RTBURBONSA-N	431.537	1.340	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cnn(C)c2Cc2ccccc2)c1	770075720	JCJAXIGUZWYRFK-UHFFFAOYSA-N	441.513	1.336	50	20	IDGD	
CCNS(=O)(=O)[C@@H]1CCN(C(=O)/C(C#N)=C/c2cc(C)n(C[C@H]3CCCO3)c2C)C1	771402391	FEGSYTBUHBBMAZ-XFVDGSDISA-N	434.562	1.731	50	20	IDGD	
CNC(=O)COc1cccc(CC(=O)NNC(=O)c2ccc(COc3ccccc3)o2)c1	772048669	YPIDFEDJNAVXQA-UHFFFAOYSA-N	437.452	1.987	50	20	IDGD	
COc1ccc(Cn2cc(C(=O)NNC(=O)C(=O)NCc3ccc(Cl)cc3)cn2)cc1	772890604	ZRVBWBOZYNGBDU-UHFFFAOYSA-N	441.875	1.671	50	20	IDGD	
COC(=O)c1c(F)cccc1NNC(=O)[C@H]1CC(=O)N(c2ccc3c(c2)OCCO3)C1	773625303	HLRHEAPTXNMGRK-LBPRGKRZSA-N	429.404	1.880	50	20	IDGD	
O=C(NNc1ncccn1)C(=O)Nc1ccc(CN2CCN(Cc3ccccc3)CC2)cc1	773718167	BEMBGOCURCQDSS-UHFFFAOYSA-N	445.527	1.876	50	20	IDGD	
O=C(NNc1cccc(Cl)c1)C(=O)Nc1ccccc1OCC(=O)N1CCOCC1	773736622	OUQFLTPKMGMCCX-UHFFFAOYSA-N	432.864	1.659	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1cccc([C@H]2CNC(=O)C2)c1	774010032	UOAWTOCZDRQWMN-TZMCWYRMSA-N	444.875	1.497	50	20	IDGD	
COC[C@H](NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)c1ccc(F)c(F)c1	774363278	SQOJETIUIDLHBA-INIZCTEOSA-N	431.399	1.543	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(=O)n(CC(=O)NNc2ccc(C(F)(F)F)cn2)c1	775245385	FQOBOOWBZMRRNF-UHFFFAOYSA-N	447.439	1.436	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(N(C)C)c(NC(=O)NNc2nccc(OC)n2)c1	775449618	GINIYHXJGBELNS-UHFFFAOYSA-N	437.526	1.730	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)[C@H]1[C@H](C)OC(C)(C)N1C(=O)OC(C)(C)C	776476343	HIPXBLAKSXBUJU-KCQAQPDRSA-N	429.514	1.872	50	20	IDGD	
CC(C)NC(=O)C(=O)NNC(=O)[C@@H]1CC(=O)N(C(C)C)[C@@H]1c1ccc(Cl)c(F)c1	776703497	XGJKAVMWURRPGP-MLGOLLRUSA-N	426.876	1.449	50	20	IDGD	
O=C(c1cc(-c2ccc(F)cc2)[nH]n1)N1CCN(S(=O)(=O)CBr)CC1	777777977	VLZDTIBMVKLBKC-UHFFFAOYSA-N	431.287	1.656	50	20	IDGD	
COc1ccc(Cn2cc(C(=O)NNC(=O)Cn3cnc4ccccc43)cn2)cc1OC	778292696	LNOHNIMAWDTLBK-UHFFFAOYSA-N	434.456	1.760	50	20	IDGD	
COC(=O)c1ccccc1NNC(=O)/C=C\C(=O)N1CCN(c2ccc(OC)cc2)CC1	778419558	MBZBMRBXUDCJKN-QXMHVHEDSA-N	438.484	1.830	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)CCn1cnc2sc3c(c2c1=O)CCCC3	778436201	FLBWGCYCQDMBPS-UHFFFAOYSA-N	449.533	1.399	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N[C@@H]2C[C@@H](O)C2(C)C)cc1	779228363	AGCGIZUGCVQZHC-PDQLOIDKSA-N	437.500	1.617	50	20	IDGD	
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	779389407	ZASLLHYVGKPJJU-GFCCVEGCSA-N	432.481	1.181	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNc2ncnc3ccsc23)cc1C	783255332	RWUORROLQXWFAH-UHFFFAOYSA-N	434.503	1.843	50	20	IDGD	
CC(C)(C)c1cc(NC(=O)C(=O)NNc2ccc(-n3cccn3)nn2)n(-c2ccccn2)n1	783432879	GRMUUSSTLKXSKN-UHFFFAOYSA-N	446.475	1.622	50	20	IDGD	
COC(=O)[C@@H]1CCCCN1C(=O)c1cccc(NC(=O)C(=O)NN(C)c2ccccc2)c1	783434580	RNPRRYKUPYFCJA-IBGZPJMESA-N	438.484	1.960	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)cc1OC	784210513	RSSLORBLGGDHLP-UHFFFAOYSA-N	434.474	1.226	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)[C@H]1CC=CC[C@H]1C(=O)N1CCOCC1	784290375	NKCSFKQPLJTPPA-DLBZAZTESA-N	431.489	1.053	50	20	IDGD	
COC[C@@H](C)NS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ncccc2Cl)cc1	784815965	HSGMYDRORQAFFK-LLVKDONJSA-N	441.897	1.130	50	20	IDGD	
CCc1cc(Br)ccc1NNC(=O)C(=O)Nc1cccc(OCC(N)=O)c1	785098794	GHJQLMVPWZYILU-UHFFFAOYSA-N	435.278	1.957	50	20	IDGD	
CCS(=O)(=O)CCn1cc(C)c(NC(=O)C(=O)NNc2ccc(OC)c(Cl)c2)n1	787570509	LKUBHYCIPFWZJM-UHFFFAOYSA-N	443.913	1.370	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2cc(C#N)cn2C(C)(C)C)n[nH]1	789740663	YDKKATKDBFUPBX-UHFFFAOYSA-N	449.471	1.913	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)Cc2cc(OC)c(O)c(OC)c2)n[nH]1	790004467	ZCZCOESIWULCCN-UHFFFAOYSA-N	426.429	1.812	50	20	IDGD	
CO[C@H]1CCOc2c(NC(=O)C(=O)NNC(=O)COc3ccc(C)c(C)c3)cccc21	790951134	DANUMZCJAUWKQA-SFHVURJKSA-N	427.457	1.938	50	20	IDGD	
O=C(NNc1cccc(F)c1[N+](=O)[O-])C(=O)Nc1ccc(C(=O)N2CCOCC2)cc1	790998338	KCLDXPRKWXGTIM-UHFFFAOYSA-N	431.380	1.288	50	20	IDGD	
CNC(=O)c1cc2cc(NC(=O)C(=O)NNC(=O)CCCc3cccs3)ccc2[nH]1	792356462	RGBNTPBVPVQNFA-UHFFFAOYSA-N	427.486	1.698	50	20	IDGD	
Cc1cc(O[C@@H]2CCN(C)C2=O)ccc1NC(=O)C(=O)NNC(=O)c1ccc(Cl)nc1	799259399	ZVRXBKZYDNWTIO-OAHLLOKOSA-N	445.863	1.053	50	20	IDGD	
Cc1ccccc1NS(=O)(=O)c1ccc(C)c(C(=O)NNC(=O)CN2CCCC2=O)c1	800695057	OCEVVCZSBZBKSP-UHFFFAOYSA-N	444.513	1.488	50	20	IDGD	
CNS(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=O)Nc2ccc3c(c2)OCO3)c1	802095661	AGFAEWOODXYQHX-UHFFFAOYSA-N	426.838	1.443	50	20	IDGD	
COCCCn1nccc1C=NNC(=O)CN1c2cccc3cccc(c23)S1(=O)=O	802708004	FCWOVMTWPGAPQU-UHFFFAOYSA-N	427.486	1.732	50	20	IDGD	
CN(CCc1ccccc1[N+](=O)[O-])C(=O)NNC(=O)CNC(=O)OCc1ccccc1	805405702	NEIHOYCRQZKPQU-UHFFFAOYSA-N	429.433	1.736	50	20	IDGD	
COc1cc(C)c(NC(=O)C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c(C)c1C	806974221	ADLYNFHPZZKHRA-UHFFFAOYSA-N	437.456	1.267	50	20	IDGD	
Cc1cc(I)cc(NC(=O)C(=O)NNC(=O)Cc2ccsc2)c1	806976656	JYFLPHLMJTXIKG-UHFFFAOYSA-N	443.266	1.990	50	20	IDGD	
CC(C)(C(=O)NNC(=O)C(=O)Nc1ccc(F)c(N2C(=O)CCC2=O)c1)c1ccccc1	806980056	MOXCJZDSUMBXIW-UHFFFAOYSA-N	440.431	1.543	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNS(=O)(=O)c1c(F)cccc1OC(F)(F)F	808086971	LKWJOZXDTKSYKF-UHFFFAOYSA-N	441.384	1.525	50	20	IDGD	
O=C(COC(=O)Cc1c[nH]c2cccc(Cl)c12)NNC(=O)[C@@H]1COc2ccccc2O1	814526253	JJJJITMACBUCLC-KRWDZBQOSA-N	443.843	1.894	50	20	IDGD	
CC(C)(C)[C@H]1CCC2=S=C(C(=O)NNC(=O)C(=O)Nc3ccc(C#N)cn3)C=C2C1	815567374	WFABENDTSDGOJB-AWEZNQCLSA-N	425.514	1.903	50	20	IDGD	
O=C(NCc1ccc(Cn2cccn2)cc1)NNC(=O)c1nn(-c2ccccc2)cc1O	838554350	QHPGGBBAYPTAAL-UHFFFAOYSA-N	431.456	1.967	50	20	IDGD	
N#Cc1cccc(C=NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1	839387492	RIORHJHGZKGZAS-UHFFFAOYSA-N	426.498	1.662	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@@H]2C(=O)NNC(=O)COc2ccc(C#N)cc2)s1	887923938	SGUSKCHXDNTQIV-MRXNPFEDSA-N	448.526	1.308	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CNS(=O)(=O)c2cccc(C#N)c2)ccc1OC(C)C	913153645	PTBOGMNSUKUWJO-UHFFFAOYSA-N	446.485	1.094	50	20	IDGD	
Cc1ccc(C(=O)N2CCC[C@@H](C(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)C2)cc1	914781559	KUEQLCJLHKKYNU-QGZVFWFLSA-N	447.495	1.555	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NN=Cc1ccc(O)cc1O	915915250	WEAGEDUGRAUMMD-UHFFFAOYSA-N	433.486	1.202	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)NC2CCN(C(C)=O)CC2)c2ccccc2c1=O	915931176	IZSHTTLIGADNQT-UHFFFAOYSA-N	442.520	1.542	50	20	IDGD	
C[C@@]1(NNC(=O)NCc2nnc3c(Cl)cc(C(F)(F)F)cn23)CCS(=O)(=O)C1	916221808	YKJGUJCYVWHASH-CYBMUJFWSA-N	440.835	1.283	50	20	IDGD	
O=C(COc1ccccc1Cc1ccccc1)NNC(=O)NCCC(=O)N1CCOCC1	916251307	CNTCZIDHBJBFQF-UHFFFAOYSA-N	440.500	1.236	50	20	IDGD	
Cc1ccc(C(=O)NCCNC(=O)NNC(=O)Cc2nc3ccccc3n2C)cc1F	916272506	YUWODFNDUMZWGW-UHFFFAOYSA-N	426.452	1.324	50	20	IDGD	
CC1CCN([C@H](CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)C(C)C)CC1	916440072	YKUSSSHROJNUMF-QGZVFWFLSA-N	438.598	1.680	50	20	IDGD	
C[C@H]1CCCN(C(=O)C2CCN(CC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)CC2)C1	917106506	XALOBCJCAZBSDG-HNNXBMFYSA-N	431.493	1.326	50	20	IDGD	
CC[C@H](NC(=O)NNC(=O)c1csc(N2CCOCC2)n1)c1ccc2c(c1)OCCO2	918133167	UMNICKFBPYKNKE-AWEZNQCLSA-N	447.517	1.846	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1	918219321	ILNXIJGOXQYXNO-UHFFFAOYSA-N	440.479	1.887	50	20	IDGD	
CCCS(=O)(=O)N1CCCC[C@H]1C(=O)NNC(=S)Nc1ccc(OCC)cc1	919811542	YLNXDEGKMIDBHY-INIZCTEOSA-N	428.580	1.997	50	20	IDGD	
CCN(CC)c1nc2sc(C(=O)NNC(=O)N[C@@H]3CCS(=O)(=O)C3)cc2s1	919885467	LNDNBGRXLUIMQR-SECBINFHSA-N	431.565	1.335	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)[C@@H](CSC)N2C(=O)[C@H]3CCCC[C@H]3C2=O)c1	929085882	RBZCPXIXOBGLPO-IXDOHACOSA-N	449.529	1.372	50	20	IDGD	
C[C@H](CC(=O)NNc1cncc(Br)c1)/N=C1/NS(=O)(=O)c2ccccc21	1323072618	VXZFFRCZHBIDQC-SNVBAGLBSA-N	438.307	1.805	50	20	IDGD	
CN1CCN(Cc2cccc(CNC(=O)NNC(=O)COc3ccc(C#N)cc3)c2)CC1	1326141157	QWCBVCKYRQGDLR-UHFFFAOYSA-N	436.516	1.215	50	20	IDGD	
COCc1nocc1C(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	1343671877	UQCOJOJRPWFRTM-UHFFFAOYSA-N	444.469	1.374	50	20	IDGD	
CSC[C@H](C)C(=O)N1CCC(C(=O)NNC(=O)c2nnc(O)c3ccccc23)CC1	1344573400	BHSBUZLSNUVGQJ-LBPRGKRZSA-N	431.518	1.334	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3nn(C)c4c3CCC4)C2)C1	1777959796	ZDOPYQLAFOYOJR-BFUOFWGJSA-N	439.354	1.383	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(CCN(C(=O)c3cc4n(n3)CCCC4)C2)C1	1778558825	WHTGLWLOODJJDL-SFHVURJKSA-N	425.327	1.448	50	20	IDGD	
COC(=O)c1ccc(CC(=O)N2CCO[C@@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)cc1	1779301713	UPGNXKFXMYQMGA-JOCHJYFZSA-N	448.592	1.697	50	20	IDGD	
Cc1nn(C)c(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CO[Si](C)(C)C)C2)c1F	1779540780	OVRJISWJEWHLQV-FOIQADDNSA-N	440.592	1.847	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(CCN(C(=O)c3[nH]cnc3-c3cccnc3)C2)C1	1780051770	FFDILHCMRYAWDP-NRFANRHFSA-N	443.580	1.767	50	20	IDGD	
Cc1nn(C)c(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](F)Br)C2)c1F	1780771368	ZYVDKVQLALZCJL-JDSLSITLSA-N	449.296	1.686	50	20	IDGD	
C[C@H](Nc1cccnc1)C(=O)N1CCO[C@]2(CCN(C(=O)[C@](C)(Cl)CCl)C2)C1	1781227185	IBBHIULKMGCCMD-GDIGMMSISA-N	429.348	1.948	50	20	IDGD	
O=C(c1cccc(N2CCOCC2)c1)N1CC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1781737359	OEWAYZBQQWJPAX-FQEVSTJZSA-N	442.343	1.770	50	20	IDGD	
O=C(c1cc2cccnc2nc1O)N1CC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1782267779	NHAXGQXZDLYWJH-GOSISDBHSA-N	425.272	1.583	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H]1Cc3ccccc3O1)CCO2	1783349649	QESBCKLUOLGXHC-RIFZZMRRSA-N	437.334	1.994	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)CNC(=O)OC(C)(C)C)C2)C1	1783395201	ZKTGAAOTHABBQA-FZKQIMNGSA-N	448.358	1.372	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H]1CC(c3ccccc3)=NO1)CCO2	1783871040	MDVAWQMEZQAFOU-CDXJDZJCSA-N	435.908	1.263	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)C(C)(C)Cc1ccccc1)CCO2	1783933361	VVIMZPBPQSYGQV-XMMPIXPASA-N	444.576	1.458	50	20	IDGD	
CCOC(CC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](C)CBr)CCO2)OCC	1784161281	WZHDRXOHFBNFFS-KDOFPFPSSA-N	435.359	1.637	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(CCN(C(=O)[C@@H]3CCc4nc[nH]c4C3)C2)C1	1784346405	WYKRFMIGBPDZEX-ACJLOTCBSA-N	425.327	1.130	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H]3CC[C@H](C)CC3)C2)C1	1784707057	WOXRBYYZSXFWSE-FBJODBAKSA-N	443.548	1.777	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(CO)c(F)c3)C2)C1	1785263109	LSXBMYIHYZKVQH-DJJJIMSYSA-N	443.313	1.793	50	20	IDGD	
CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@]2(CN(C(=O)[C@@H](Cl)COC)CCO2)C1	1785347616	AFKQRSXOYRQBHQ-AUSJPIAWSA-N	447.960	1.373	50	20	IDGD	
C[C@H]1[C@@H](C(=O)N2CC[C@]3(CN(C(=O)[C@@H](F)Cl)CCO3)C2)CCN1C(=O)OC(C)(C)C	1785739424	WOLIQFUCQKOMKV-UJKGCTCZSA-N	447.935	1.996	50	20	IDGD	
C[C@@H](Nc1cccnc1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21	1786866117	GHEATAMWBFEAJM-ZLTXHLNPSA-N	443.317	1.552	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21	1788763837	WLTBWMNFYFOVBY-MNXVOIDGSA-N	425.371	1.508	50	20	IDGD	
C[C@@H](Br)C(=O)NC1(c2ccc(NC(=O)[C@@H](O)N3CCOCC3)cc2)CCC1	1789557036	OFIUFTGVQVUJQJ-FZKQIMNGSA-N	440.338	1.555	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](N)Cc3cscn3)C[C@@H]21	1789865896	INKLIXCFCMPZQT-VZUYIZPNSA-N	449.404	1.229	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C\C(=O)NC3CC3)C[C@@H]21	1789867605	AWBWNXCSEMPEMJ-LAXCSOLKSA-N	432.348	1.037	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)Cc3ccccc3)[C@H]2C1	1790957040	PIJCXLWMRVXZLY-HUTLKBDOSA-N	443.371	1.806	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccncc3F)C[C@@H]21	1790962202	WUKOCYWEUHRUJS-ZIEJDFEHSA-N	428.302	1.988	50	20	IDGD	
CCOC(=O)C(C)(C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](Br)CC)[C@H]2C1	1790962529	FURGHSQTOQYKKH-XQLPTFJDSA-N	447.370	1.729	50	20	IDGD	
CC(=O)N[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]2C1)C(C)(C)C	1791055066	HXHDQBGEPDAJIT-DGVSKKNDSA-N	446.386	1.300	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnoc3C3CC3)C[C@@H]21	1791058308	WADRUJYZPGONBF-LVGORTOPSA-N	426.311	1.929	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Cl)C[C@@H]21	1791082148	FFYSHMONWSNONN-UVPYHEFZSA-N	447.935	1.900	50	20	IDGD	
CC(C)[C@@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCC(=O)NN(C)C)C2)c1ccccc1	1793057858	AWXFIFVYIQIYOQ-IYRWYFENSA-N	444.576	1.389	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(F)(F)C(F)(F)C(=O)O	1793728482	SJTYWFPZCROOQS-VLEAKVRGSA-N	432.798	1.339	50	20	IDGD	
Cc1nc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Br)C3)c(C)s1	1794181533	BITYVHZYXDQFTP-JLUCKKNBSA-N	434.331	1.583	50	20	IDGD	
CC(C)n1nc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)C(Cl)Cl)C3)cc1C(=O)O	1794435761	LWLXHBYFKAPCKP-DDFAGTSDSA-N	433.292	1.169	50	20	IDGD	
COc1cc(C)ccc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCBr	1795116890	DCHNOCKWDBFEOZ-ZSBFGKGUSA-N	425.323	1.992	50	20	IDGD	
CO[C@@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2)c1ccccc1	1795167950	RCFDKGOBHILUKD-CYGHRXIMSA-N	425.323	1.749	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)c1csc2c1CCCO2	1796189324	YAVGYDFKYCBRHF-BJWYYQGGSA-N	440.330	1.319	50	20	IDGD	
C[C@H](C#N)c1cccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)c1	1796192325	AGQVXGCACIMQPH-ZHHJKBAOSA-N	431.301	1.559	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1nccc2[nH]ccc12	1796202446	KBRDJRVKCGFSSD-NFFDBFGFSA-N	435.322	1.797	50	20	IDGD	
C[C@@H]1[C@@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Cl)CCN1C(=O)OC(C)(C)C	1796370885	OJHLHBAXVJXANQ-OWDFPOFWSA-N	447.935	1.756	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](O)CCl)C2)C1CC1	1796798519	YCZWOVCTIMSFGZ-JKJDWNRSSA-N	429.945	1.528	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@](C)(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Cl)C3)C1	1797181401	YYZCZJPDGBSQKO-UPYQZRRNSA-N	447.935	1.758	50	20	IDGD	
Cc1cc(C(N)=O)cc(C)c1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(C)(C)CCl)C2	1797731096	JTYRGABLZAHSNV-ALXJQNPVSA-N	435.952	1.871	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccn3nccc13)C2)[C@@H](F)Br	1799346569	CXIKRUGFOYXQPA-BAESOJJISA-N	425.258	1.228	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCNC(=O)OC(C)(C)C	1800170566	SUIKZHKLCFJPEY-XFIYOXNOSA-N	431.961	1.918	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(F)cc(Cl)c1)C2	1801012108	DKEMJLAOKCOYSR-HBCWATKFSA-N	440.903	1.055	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN1CCOC1=O)C2	1801432785	SUMVVWLIGLSEPN-FZBFXSHXSA-N	444.438	1.962	50	20	IDGD	
CSc1cccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CCC(=O)NN(C)C)c1O	1802337246	SZPKASZUPFWYAL-QDMKHBRRSA-N	434.562	1.739	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@@H](CNC(=O)C(O)O)[C@H]1c1cccnc1	1802927918	OYVYUJMTVFTXRM-XKSXBQJNSA-N	442.422	1.283	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)CN2CC(=O)NC2=O)[C@@H]1c1cccnc1	1803686634	RGQVXRMGAVYFRD-RLFYNMQTSA-N	435.912	1.047	50	20	IDGD	
COc1cnc(C(=O)N2CC[C@H](CNC(=O)CCBr)[C@@H]2c2cccnc2)cn1	1806339687	QKGFJSDKDQDGAS-KDOFPFPSSA-N	448.321	1.985	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)CN2CCCC2=O)[C@H]1c1cccnc1	1806926347	QOJCQXGGOIIWMN-DHSIGJKJSA-N	437.338	1.493	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccccc2O)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807360342	AGLFXEDXDXTSLF-PGRDOPGGSA-N	445.284	1.100	50	20	IDGD	
Cc1cccnc1C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1807366967	WJBMRLJFXPNMAG-UGKGYDQZSA-N	444.300	1.098	50	20	IDGD	
C[C@H](C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)n1cccc1	1807367495	LMPMTIPVYGRKAG-PIPMEXSNSA-N	446.316	1.144	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)c1cccc2nc[nH]c12	1808002256	TVGFUIANRILYRT-POZUXBRTSA-N	427.892	1.877	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H](CNC(=O)[C@H](F)Cl)[C@H]1c1cccnc1)[C@H]1SC(=N)NC1=O	1808313558	ZWEIQGZARGRXRO-RBQFQAMWSA-N	441.916	1.424	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)c2cn[nH]c2)[C@@H]1c1cccnc1	1808416477	AFPFUTZLWCXAES-XJYZCQQUSA-N	448.487	1.258	50	20	IDGD	
C[C@H](C(=O)N1CC[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]1c1cccnc1)n1cnnn1	1810548655	RWWIAQKMJMMGEB-UWWQBHOKSA-N	431.573	1.187	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2ncn(C(C)C)n2)[C@@H]1c1cccnc1	1813030704	LNGQERYJZGYKLI-IXDOHACOSA-N	434.928	1.827	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)C(F)(F)C(F)F)[C@@H]1c1cccnc1	1813068428	MLGMWZPAXFDFDJ-CZUORRHYSA-N	447.433	1.361	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)C2CCSCC2)[C@H]1c1cccnc1	1813074515	SOMBKJAMFGPYGO-NQIIRXRSSA-N	447.605	1.604	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)C(Cl)Cl)[C@H]1c1cccnc1	1813081780	APVXUAGWZGGKRV-CZUORRHYSA-N	430.336	1.264	50	20	IDGD	
C[C@](O)(CC(=O)O)CC(=O)N1CC[C@@H](CNC(=O)C(Cl)Cl)[C@@H]1c1cccnc1	1813081951	HSROTBFHUWDHIH-XLWVJDPXSA-N	432.304	1.507	50	20	IDGD	
O=C1C[C@H](C(=O)NC[C@@H]2CCN(C(=O)[C@H](F)Br)[C@H]2c2cccnc2)CCN1	1813136426	UZVKDTZEJZISRD-XTBFLFJDSA-N	441.301	1.304	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)C/N=C/c2ccco2)[nH]n1)c1ccc(B(O)O)cc1	1817472470	UAUXDQBPGUXFLX-BBMHEYIBSA-N	449.276	1.108	50	20	IDGD	
CNc1ccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)cc1	1817474372	DYEJPAUEDXYJND-HXUWFJFHSA-N	447.304	1.751	50	20	IDGD	
Cc1ccn(C)c1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1	1817477054	XLSKLIAVLBMMFV-SFHVURJKSA-N	435.293	1.356	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)CC[C@H]2CCOC2)[nH]n1)c1cccc(B(O)O)c1	1817479527	PATWJZGHWHYVLT-HNAYVOBHSA-N	440.309	1.212	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@H](F)Br)[nH]n1)c1cc(O)nc(O)n1	1818031476	HBDSUPXJFAVYCY-SKDRFNHKSA-N	443.233	1.607	50	20	IDGD	
CC(C)NCCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819402984	QTIKTAWCQUKQNY-QGZVFWFLSA-N	442.524	1.102	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)CN2CCOC2=O)[nH]n1)[C@H](F)Br	1820932200	YWRMDMYUTCIKEC-MFKMUULPSA-N	432.250	1.545	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(C3CC3)on2)[nH]n1	1822412186	LYOMBWAEEDUDML-MRXNPFEDSA-N	443.508	1.954	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](O)CCl)CC2)c1cnc2c(c1)CCNCC2	1824635409	JWVUGFYGUHHUII-XJKSGUPXSA-N	449.964	1.052	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CC(F)(F)C(=O)O)CC2	1825999138	QZWWROZNDCRTDQ-HTQZYQBOSA-N	425.841	1.419	50	20	IDGD	
Cc1ncoc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827050945	HGKWZXYZCOINNF-LJQANCHMSA-N	425.294	1.210	50	20	IDGD	
CC(=O)N1CCN(CC(=O)N2CCC([C@H]3CCCCN3C(=O)[C@H](F)Cl)CC2)CC1	1827607914	BOPMUZGTCBNKAZ-MJGOQNOKSA-N	430.952	1.305	50	20	IDGD	
Cc1nnsc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1	1827816483	IOQTYCUJUPDDJD-GOSISDBHSA-N	442.350	1.073	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(Cl)cnc3OC)CCO2)C1	1829586203	DLDDUYLVTGQNHX-BEFAXECRSA-N	446.331	1.831	50	20	IDGD	
Cc1nc(C)c(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)o1	1830540830	TZKANPCUUVUTHZ-KPZWWZAWSA-N	444.326	1.392	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4n(n3)CCCC4)C2)C1	1831650214	FQCMRZNRRQGONE-DYESRHJHSA-N	438.956	1.697	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1sccc1F)CCO2	1831918860	XLTOSHBCYIRXNC-SFHVURJKSA-N	430.574	1.809	50	20	IDGD	
O=C(CCc1cccc([N+](=O)[O-])c1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1832173523	QIFJECVJZZWVBM-IEBWSBKVSA-N	443.859	1.518	50	20	IDGD	
Cc1cccc(C(=O)N2CCC(N3CCC(NC(=O)[C@H](O)CCl)CC3)CC2)c1F	1833306681	XHKQCSBWUHJTSV-GOSISDBHSA-N	425.932	1.919	50	20	IDGD	
CC(=O)NC(C)(C)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)Br)CC2)CC1	1833486860	CHNTXOFMSSWKGY-CYBMUJFWSA-N	445.402	1.256	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)c(C)o1	1834094568	BTRJIPAXJGOFNC-RHSMWYFYSA-N	433.274	1.657	50	20	IDGD	
Cc1oncc1C(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)Br)CC2)CC1	1834242735	UZOGWHYHSQFXEL-GFCCVEGCSA-N	427.343	1.952	50	20	IDGD	
CC(C)c1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)CCBr)C3)C2)no1	1834495881	XOKIMGHBEVIZFN-SFHVURJKSA-N	444.326	1.653	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](F)Cl)CC2)CC1)[C@@H]1Cc2ccccc2CN1	1835058842	ZSVGVDQVXQFNNS-VQTJNVASSA-N	436.959	1.807	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cnc(O)nc3O)CC2)CC1	1836919015	CORZJMPXYGICLL-MRXNPFEDSA-N	440.928	1.908	50	20	IDGD	
C#CC(=O)N1CCC(OC2CCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CC2)CC1	1837089226	BEKCLQSVTQENRZ-KRWDZBQOSA-N	441.956	1.750	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccncc3O)CCO2)C1	1837819530	ORUGXKBOPNPKJF-ROUUACIJSA-N	432.304	1.094	50	20	IDGD	
Cc1nc(C)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@](C)(Cl)CCl)C3)C2)o1	1838006052	IFRMAPHMKAMFJW-MSOLQXFVSA-N	434.320	1.598	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1839021436	JTMIEFZNRWHCEL-CRAIPNDOSA-N	435.279	1.953	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccccn3)C2)C1	1839964623	XMUPDGDFBMORTE-QFBILLFUSA-N	440.338	1.254	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc(Cl)s3)C2)C1	1840153038	BGPOMQLXBXAVOG-BZNIZROVSA-N	438.333	1.120	50	20	IDGD	
COc1cccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)c1F	1840190178	IUEOWOQNBHXPCE-SFHVURJKSA-N	435.279	1.708	50	20	IDGD	
O=C(CCc1ccoc1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1840516452	RGTCXYCONRSEAA-WBVHZDCISA-N	433.274	1.359	50	20	IDGD	
O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)C1CCSCC1)CCO2	1840924116	RNKPOYXZHVHHQJ-KRWDZBQOSA-N	435.384	1.371	50	20	IDGD	
Cc1cc(CC(=O)N2CC3(CCCN3C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)on1	1841924240	NLQGPDAPXOSJAF-HNNXBMFYSA-N	440.928	1.861	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCCC12CN(C(=O)Cc1ccccn1)C2	1841924448	NAYFTBAFXMZTII-INIZCTEOSA-N	436.940	1.960	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCCC12CN(C(=O)[C@H]1C[C@@]13C(=O)Nc1ccccc13)C2	1844379274	LKSKAQVZVMHCPH-ZHRRBRCNSA-N	427.577	1.951	50	20	IDGD	
CN(CC(=O)N1CCCC12CN(C(=O)[C@H](F)Cl)C2)NC(=O)NCc1ccccc1	1845038628	ANDMBKJJSXMKPY-INIZCTEOSA-N	425.892	1.070	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@H]1C(=O)N1CCCC12CN(C(=O)[C@@H](C)CBr)C2	1846337995	LRYLYOLEJYDQAN-RRFJBIMHSA-N	427.339	1.976	50	20	IDGD	
CCS(=O)(=O)c1ccc(CC(=O)N2CC3(CCCN3C(=O)[C@H](Cl)COC)C2)cc1	1846364294	ILEKFGPRGBJERC-QGZVFWFLSA-N	442.965	1.480	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1	1847037419	PHSBFTPHOZXYGD-DUMNWFOQSA-N	425.279	1.803	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)Cc1c(C)noc1C	1848098380	ZWWDLUMIIXJGPU-SGASUCAWSA-N	426.477	1.170	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)C[C@H](NC(N)=O)c2cccs2)c2ccccc2c1=O	14044654	LMRAYKHLZGSZGQ-AWEZNQCLSA-N	442.501	1.600	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)CCCN(C)S(=O)(=O)c1ccc(F)cc1	14842130	KVKTZPXUNBSODJ-UHFFFAOYSA-N	447.492	1.644	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc2c(c1)CCCC2)NNC(=O)c1cccc([N+](=O)[O-])c1	17330415	VSNASLUXTSHVLR-UHFFFAOYSA-N	446.485	1.603	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cc(Br)c[nH]2)cc1	23914646	JAZCXEVVTOKVBA-UHFFFAOYSA-N	429.296	1.539	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCc2ccnc(N3CCOCC3)c2)ccc1OC(C)C	26382692	IHVXWTCEEKWAKS-UHFFFAOYSA-N	443.504	1.858	50	20	IDGD	
COCCCNC(=S)N(C)NC(=O)COc1ccc(I)cc1	726076306	YLJFFJWIFLRBDU-UHFFFAOYSA-N	437.303	1.544	50	20	IDGD	
C[C@@]1(c2ccc(CNC(=O)NNC(=O)Cc3ccc(Cl)cc3)cc2)NC(=O)NC1=O	726282122	JFWCONDQGDQMKD-FQEVSTJZSA-N	429.864	1.468	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=S)Nc2ccc(C(N)=O)cc2)c1	726434900	VHRIUYJSXUAGLC-UHFFFAOYSA-N	449.558	1.447	50	20	IDGD	
CC1(C)Cc2ccc(C(=O)OCC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)c(O)c2O1	727025144	FQVGAWDYNBBYEU-UHFFFAOYSA-N	429.385	1.632	50	20	IDGD	
CN(C)CCNC(=O)c1cccc(CNC(=O)NNC(=O)COc2ccc(F)cc2)c1	727604319	VKYXDBZPXBPQQJ-UHFFFAOYSA-N	431.468	1.027	50	20	IDGD	
COC(=O)c1cc(CNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)ccc1OC	728959497	MUDBDFRLDHVXBC-UHFFFAOYSA-N	442.476	1.019	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)c1cc(-c2ccc(F)cc2)nc2ccccc12	729275611	QBOYYCBRLGSXLE-GFCCVEGCSA-N	430.461	1.740	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2ccc(O)c([N+](=O)[O-])c2)cc1Br	732049289	ZWKBEMONVUHSGO-UHFFFAOYSA-N	446.235	1.695	50	20	IDGD	
COCCN(Cc1ccc2c(c1)OCO2)C(=O)NNC(=O)CNC(=O)c1cccs1	732245056	NQXVQLHQPNYJKP-UHFFFAOYSA-N	434.474	1.096	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)[C@H]1CCCN1C(=O)c1ccc2c(c1)OCO2	732302932	ATBQNOKMCYDEBJ-OAHLLOKOSA-N	431.470	1.567	50	20	IDGD	
O=C(NCCN1CCN(c2ccccc2)CC1)NNC(=O)c1cnn(-c2ccccc2)c1	733340602	GIRQAEAUURRNQC-UHFFFAOYSA-N	433.516	1.639	50	20	IDGD	
O=C(COC(=O)c1cc(Cl)nc(Cl)c1)NNC(=O)[C@H]1COc2ccccc2O1	733512392	DSHODEJXTJWCKE-GFCCVEGCSA-N	426.212	1.533	50	20	IDGD	
COC(=O)COc1cccc(CNC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)c1	734531555	MHALGEAHXYWZAG-UHFFFAOYSA-N	439.428	1.274	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)N[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)cc1	734539755	AINABFMXMJISCI-FQEVSTJZSA-N	440.500	1.768	50	20	IDGD	
CN1C(=O)C[C@H](C(=O)OCC(=O)NNC(=O)c2ccccc2)[C@H]1c1cccc(Cl)c1	734637502	RYYFNLITGMNAAG-QFBILLFUSA-N	429.860	1.864	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)N[C@H]2CC(=O)N(CCN3CCOCC3)C2)c(C)n1CC(C)C	736153574	RFYXDEPRUCABDF-ATEMXAKRSA-N	441.576	1.717	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)c1ccc2c(c1)C(=O)N(Cc1ccccc1)C2=O	740851091	PGOBQQLKWORLIU-UHFFFAOYSA-N	436.468	1.549	50	20	IDGD	
Cn1c(NNC(=O)[C@@H]2CCCN(C(=O)COc3ccccc3)C2)nc2ccccc2c1=O	741216348	RWLRVTVBNJCHLK-MRXNPFEDSA-N	435.484	1.694	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)c2ccc(CNC(=O)OC(C)(C)C)o2)c2ccccc2c1=O	742473682	DYUWXNLMGGCKDB-UHFFFAOYSA-N	441.444	1.626	50	20	IDGD	
C[C@@H](CC(=O)NNC(=O)c1cc2c(s1)CCC2)/N=C1/NS(=O)(=O)c2ccccc21	742473928	KHXRNWFWPHIWJC-NSHDSACASA-N	432.527	1.515	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNC(=O)CN2C(=O)[C@H]3[C@H]4CC[C@@H](O4)[C@@H]3C2=O)cc1	742474371	WUXROGWJADCOSS-FPAYPSAMSA-N	429.473	1.035	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNS(=O)(=O)c2cc(C)cc(C(=O)O)c2O)cc1	743836439	PSPSELNBWUXDPU-LBPRGKRZSA-N	438.458	1.575	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)c2ccc(CSc3nncn3C)cc2)c(-c2cccnc2)n1	743841878	BZNIXWPFUWPADE-UHFFFAOYSA-N	448.512	1.978	50	20	IDGD	
Cc1c(/C=C(\C#N)C(=O)O[C@@H](C)C(=O)Nc2cccc(S(N)(=O)=O)c2)cc(C#N)n1C	744633650	YMQLLHFEIBVBJQ-FEZXJWFHSA-N	441.469	1.330	50	20	IDGD	
CC(C)(C)C(=O)Nc1nccnc1C(=O)OCC(=O)NNC(=O)c1ccc(Cl)cc1	745561154	BECHBWDMFNZJRK-UHFFFAOYSA-N	433.852	1.733	50	20	IDGD	
O=C(C[C@H](NC(=O)c1ccccc1Cl)c1ccccc1)NNC(=O)C(=O)N1CCCC1	748246775	PIVRFGBNEPNPCW-SFHVURJKSA-N	442.903	1.971	50	20	IDGD	
CC(C)CCn1nc(C(=O)NNS(=O)(=O)c2cnn(C(C)C)c2)c2ccccc2c1=O	748790541	JLTMPXHVLJNTEM-UHFFFAOYSA-N	446.533	1.843	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)[C@H]1CCCN(C(=O)C2CC2)C1	750123238	YLVMSEDKPKZNRF-ZDUSSCGKSA-N	437.880	1.301	50	20	IDGD	
CC(C)N1C[C@@H](NC(=O)NNC(=O)[C@@H]2Cc3ccccc3CN2Cc2ccccc2)CC1=O	750646411	XREYIFTYYYUHQX-VXKWHMMOSA-N	449.555	1.953	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN(Cc2ccccc2)C[C@@H](O)c2ccco2)n1	752352573	APLNVNPOYBOUPX-QGZVFWFLSA-N	428.514	1.970	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)c(C(F)F)n1	754827188	SYRJUIBLGLVZFA-UHFFFAOYSA-N	441.460	1.607	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2c[nH]nc2-c2ccccc2F)cc1	755041214	OTFFIWVBGGRSJX-UHFFFAOYSA-N	445.476	1.606	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)Nc1ccccc1C(=O)N1CCN(C)CC1	755621781	CRDFBBNOFNKSLG-HNNXBMFYSA-N	443.479	1.834	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)Nc1ccccc1CN1C(=O)CCC1=O	756221040	NCRFSPHUEAKFLT-UHFFFAOYSA-N	426.429	1.576	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2ccc(C)c3cn[nH]c23)cc1	756523245	COPHNOJOXTVYER-UHFFFAOYSA-N	430.490	1.653	50	20	IDGD	
CC(C)(C)c1ccc(OCC(=O)NNC(=O)Nc2cnn(CCN3CCOCC3)c2)cc1	756827120	OWXBQNUHWWFRNU-UHFFFAOYSA-N	444.536	1.745	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)N[C@H]2CN(C(=O)OC(C)(C)C)C[C@@H]2C#N)c1	758755075	SKNSTDZISOXBFI-BBRMVZONSA-N	433.465	1.407	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2F)c1C(F)(F)F)C(=O)Nc1ccccn1	758840728	XTCOAFDZYDPAHM-UHFFFAOYSA-N	436.325	1.825	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)CN2C(=O)c3ccccc3N3C(=O)CC[C@@]23C)n1	762902042	MBWNUIISTFXSDH-QFIPXVFZSA-N	437.504	1.765	50	20	IDGD	
Cc1nnnn1[C@@H](Cc1ccc(F)cc1)C(=O)NNC(=O)c1cc(-c2ccccc2)[nH]n1	762937312	IXXLVCYGFYIHJX-IBGZPJMESA-N	434.435	1.756	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)c2cccnc12	763439004	GOXUSNOMCZSRBK-UHFFFAOYSA-N	438.506	1.858	50	20	IDGD	
CCC(=O)NNC(=O)C(=O)Nc1cc(I)ccc1Br	763443732	OKICENRNQWKZOY-UHFFFAOYSA-N	440.035	1.550	50	20	IDGD	
CCOC(=O)c1c(F)cccc1NC(=O)C(=O)NNC(=O)CN1CCCc2ccccc21	763732691	DLEOIPSBPJULEQ-UHFFFAOYSA-N	442.447	1.541	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)C(=O)Nc1ccc2nc(C(F)F)[nH]c2c1	763802933	CSSUPORLSZFRHR-UHFFFAOYSA-N	448.342	1.574	50	20	IDGD	
C#Cc1cccc(NC(=O)C(=O)NNC(=O)c2nn(CCC(C)C)c(=O)c3ccccc23)c1	763843632	SLUMDXOHVFSRCU-UHFFFAOYSA-N	445.479	1.824	50	20	IDGD	
CON(C)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)cc1	763847318	ANFJLJJQAYLQMS-OAHLLOKOSA-N	442.472	1.490	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)cc1-n1cnnn1	763852238	GHAQIGNRQMDPPR-HNNXBMFYSA-N	437.460	1.141	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccc(F)c(C(=O)N(C)C)c1	763864342	AZVOGDGLRSXHHA-LLVKDONJSA-N	434.399	1.220	50	20	IDGD	
COC(=O)c1csc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(C(C)=O)cc2)c1	763878218	OGSQQZGICMCJHG-LLVKDONJSA-N	433.442	1.291	50	20	IDGD	
CCOC(=O)c1cc2cc(NC(=O)C(=O)NNC(=O)Cn3nc(C)cc3C)ccc2s1	763892629	GJFXBGLZXULVCG-UHFFFAOYSA-N	443.485	1.677	50	20	IDGD	
O=C(NNC(=O)C1=S=C2CCCCCC2=C1)C(=O)Nc1ccc(-c2ncon2)cc1	763968366	NMGYFCLLIDJTCG-UHFFFAOYSA-N	425.470	1.805	50	20	IDGD	
Cc1cc(C(=O)N2CCCC2)ccc1NC(=O)C(=O)NNC(=O)c1cc(Cl)ccc1O	763973680	FNHFHKLTOJGHAE-UHFFFAOYSA-N	444.875	1.990	50	20	IDGD	
COC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2cc(Br)cn2C)c1C	764002657	PGDBFPDGEXRQET-UHFFFAOYSA-N	437.250	1.282	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2OC)cc1NC(C)=O	764011995	MFEOLUARLVSJOX-UHFFFAOYSA-N	434.836	1.715	50	20	IDGD	
NS(=O)(=O)c1cc(F)cc(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3c2)c1	764067854	ZLVJDRQFHMXZRD-UHFFFAOYSA-N	430.417	1.026	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(C)cc2O)cc1C	764108580	BJILHNYHICHFIN-UHFFFAOYSA-N	434.474	1.170	50	20	IDGD	
O=C(CC(F)(F)F)NNC(=O)C(=O)Nc1ccc(S(=O)(=O)c2ccc(F)cc2)cc1	764113466	ZSFKXDJYNHDMGV-UHFFFAOYSA-N	447.366	1.697	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)ccc1NC(=O)c1ccco1	764164492	QNMBLGWDYUESNE-LJQANCHMSA-N	448.435	1.930	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2O1)C(=O)Nc1c(F)cc(Br)cc1F	764166641	FOGLJWCVSUOBDX-CYBMUJFWSA-N	440.200	1.817	50	20	IDGD	
Cc1ncsc1C(=O)NNC(=O)C(=O)Nc1ccc(N2CCc3sccc3C2)nc1	764247489	YKYUKDFHFFFFCU-UHFFFAOYSA-N	442.526	1.870	50	20	IDGD	
COc1cc(C)ccc1Oc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccccn2)cn1	764264998	WURGBUFCWWZYGA-UHFFFAOYSA-N	435.440	1.915	50	20	IDGD	
CCCOc1cc(C)ccc1NC(=O)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	764265654	DLKTXYAKTDQWHB-UHFFFAOYSA-N	440.504	1.576	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)C(=O)Nc1ccc(C(=O)NC2CC2)cc1	764343166	OQFMLZLDXMFJRP-UHFFFAOYSA-N	432.440	1.164	50	20	IDGD	
COc1ccc(CN(C)C)cc1NC(=O)C(=O)NNC(=O)CSc1ccccc1O	764402039	WWVOBDNDPBBHJM-UHFFFAOYSA-N	432.502	1.341	50	20	IDGD	
Cc1ccc([C@@H](C)[C@H](O)C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cc1	765178587	YLWSWBHOIPAHBA-GCJKJVERSA-N	438.528	1.065	50	20	IDGD	
CN1CCN([C@H](C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)c2ccccc2)CC1	765321533	CIERKVNDDYWADO-IBGZPJMESA-N	433.553	1.427	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)c1ccc(=O)n(Cc2ccccc2)n1	765323374	NRFRPHZCRJFWIQ-UHFFFAOYSA-N	429.477	1.358	50	20	IDGD	
O=C(CNC(=O)c1ccc2c(c1)OCO2)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	765619802	NLSPDQOUVVTPLP-UHFFFAOYSA-N	425.376	1.136	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1cccc(-c2cn(Cc3ccccc3)nn2)c1	766261245	QIKINEUUCFQSEF-UHFFFAOYSA-N	444.455	1.874	50	20	IDGD	
O=C(CCCn1ccccc1=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	766664351	PTQSPBOGPKKTQS-UHFFFAOYSA-N	445.951	1.247	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@H](C(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)[C@@H](C)O)cc1	767302052	RMNZAMCRJFOAJG-SNHMRICDSA-N	449.573	1.387	50	20	IDGD	
COc1ccc2c(c1)OC[C@@H](NC(=O)NNc1nc(O)c3cnn(C(C)(C)C)c3n1)C2	768105512	MWKHRKYMFYMCPZ-LBPRGKRZSA-N	427.465	1.925	50	20	IDGD	
NC(=O)c1ccc(NNC(=O)CSc2nnc(-c3ccco3)n2-c2ccccc2)nn1	768231326	NISSIYXONNKXPF-UHFFFAOYSA-N	436.457	1.652	50	20	IDGD	
COc1ccc(NNC(=O)c2ccc3c(c2)S(=O)(=O)N(C2CC2)C3=O)c([N+](=O)[O-])c1	768329122	PPRIWCREFPBUEE-UHFFFAOYSA-N	432.414	1.667	50	20	IDGD	
Cc1nc(-c2cccnc2)nc(NNC(=O)c2cc(S(=O)(=O)N(C)C)ccc2O)c1C	768711988	MEHBCNFOAYWQLD-UHFFFAOYSA-N	442.501	1.868	50	20	IDGD	
C[C@@]1(c2ccc(F)c(Cl)c2)NC(=O)N(CC(=O)NNC(=O)NC2CCCCC2)C1=O	770212446	PIEAXSOYQLVKDL-IBGZPJMESA-N	439.875	1.909	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)N[C@H]1CC(=O)N(c2c(F)cccc2F)C1	770753787	MAHTZTIJBBJTQP-LBPRGKRZSA-N	434.399	1.488	50	20	IDGD	
COc1ccccc1[C@]1(C)NC(=O)N(CC(=O)NNc2ccc(Br)nc2)C1=O	771582812	OHJYQVKFKDFUJS-SFHVURJKSA-N	448.277	1.763	50	20	IDGD	
O=C(CCCC(=O)c1ccc(Br)cc1)NNC(=O)N[C@H]1CCS(=O)(=O)C1	772145045	HNRZZBRPXLZLJJ-ZDUSSCGKSA-N	446.323	1.320	50	20	IDGD	
O=C(NNC(=O)c1ccnc2[nH]nnc12)c1nc(-c2ccccc2)n(-c2ccccc2)n1	773710967	DYOKAVUXFVAVLX-UHFFFAOYSA-N	425.412	1.675	50	20	IDGD	
C[C@H](NCC(=O)NNC(=O)c1cccc(C#N)c1)c1ccc(OCC(=O)NC2CC2)cc1	774967050	IDMKBTOLAOQYGQ-HNNXBMFYSA-N	435.484	1.327	50	20	IDGD	
O=C(NNc1nc2ccccn2n1)N[C@H]1CCN(c2cccc(Br)c2)C1=O	775220090	AQGVKVSLOOJHEZ-ZDUSSCGKSA-N	430.266	1.923	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)/C=C\C(=O)N2CCN(c3ccc(OC)cc3)CC2)cc1	778225770	OJJCHFWACHGNGC-SEYXRHQNSA-N	436.512	1.924	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)c2cnn(CCO[C@H]3CCCCO3)c2C)nc1C	778422450	PERNIXFRPHCCHP-KRWDZBQOSA-N	432.481	1.767	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)[C@H](C)NC(=O)CC(C)(C)C	778494853	PUMZMXSYRLPLCF-NSHDSACASA-N	427.885	1.594	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)CCn1c(S)nnc1-c1cccs1	778519258	VEJDZLREHLIPGF-UHFFFAOYSA-N	426.524	1.358	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc(C(=O)O)c(F)c(Cl)c1F)c1ccc2c(c1)OCO2	779829999	OJYRSYSTHXFXQI-UHFFFAOYSA-N	434.760	1.668	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)NCC(=O)N2CCN(C(=O)OC(C)(C)C)CC2)c1	780823908	QVDORUTWHKNBJT-UHFFFAOYSA-N	435.481	1.179	50	20	IDGD	
CC(=O)N1CCN(Cc2ccccc2NC(=O)NNC(=O)Cn2nc(C)cc2C)CC1	782079303	YCRVXWBQGWIDRP-UHFFFAOYSA-N	427.509	1.017	50	20	IDGD	
CCN1CCN(c2ccc(Cl)cc2NC(=O)C(=O)NNC(=O)c2ccc(O)cc2)CC1	782833256	ZZWKSUZIBZFUFU-UHFFFAOYSA-N	445.907	1.587	50	20	IDGD	
Cc1ccc(-c2ncccc2NC(=O)C(=O)NNC(=O)CNC(=O)c2cccs2)s1	784004989	NCEOTFXSUHZZMW-UHFFFAOYSA-N	443.510	1.696	50	20	IDGD	
COCCc1ccc(Oc2ccc(NC(=O)C(=O)NNc3nccn(C)c3=O)cc2)cc1	785086385	NDXHLQJMMLWXSR-UHFFFAOYSA-N	437.456	1.843	50	20	IDGD	
COCc1ncsc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	785670485	PBCPWKKUUROGHK-UHFFFAOYSA-N	438.531	1.539	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCC(=O)c2ccccc21)c1ccc(S(=O)(=O)N2CCCC2)cc1	785689968	WQNGHRLUHBEBPE-IBGZPJMESA-N	441.509	1.992	50	20	IDGD	
CN(C)Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(C#N)cc2)cc1Br	786417643	UUZBAHVNKVYPAH-UHFFFAOYSA-N	444.289	1.782	50	20	IDGD	
CS(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)s1	786879153	GSJXRORIHDTDDC-UHFFFAOYSA-N	435.487	1.187	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)CCC(=O)Nc1nnc(C2CCCCC2)s1	787388378	XNMPAJDIBMBWAL-UHFFFAOYSA-N	438.554	1.757	50	20	IDGD	
CCS(=O)(=O)CCn1cc(C)c(NC(=O)C(=O)NNc2ccc(Cl)c(F)c2)n1	787575005	GRDLGRRJIWZAHQ-UHFFFAOYSA-N	431.877	1.501	50	20	IDGD	
CN(CC(=O)NNc1nnc(-c2ccccn2)s1)C1=NS(=O)(=O)c2ccccc21	788561820	PPMSSGGZXOTFPO-UHFFFAOYSA-N	429.487	1.124	50	20	IDGD	
CC(=O)NCC(=O)N1CCc2cc(C(=O)NNc3nnc(-c4ccccn4)s3)ccc21	788566448	AQMNRTBGMUPXMP-UHFFFAOYSA-N	437.485	1.382	50	20	IDGD	
O=C(NC[C@H]1CCCN(c2ccccc2)C1)NNC(=O)c1csc(N2CCOCC2)n1	789319616	XSOAQDWTGDVRLN-MRXNPFEDSA-N	444.561	1.840	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)C(=O)Nc2nc(CC(C)(C)C)cs2)c2ccccc2c1=O	789732009	KKQQCUSYMUXKGS-UHFFFAOYSA-N	442.501	1.378	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)Cc1cc(F)c(Cl)cc1[N+](=O)[O-]	790557767	CZNYUXYCMSZZHI-UHFFFAOYSA-N	433.824	1.785	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)cccc1NC(=O)N(C)C	792352031	AFWDFEVVOJIZMU-UHFFFAOYSA-N	438.444	1.125	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N2CC([C@@H]3CCOC3)C2)cc1	792608763	TXZUQUSBSVNHGP-HJSBDDGSSA-N	449.511	1.836	50	20	IDGD	
CCC(=NNC(=O)CNC(=O)c1cccs1)c1ccc(Cl)c(S(N)(=O)=O)c1	794501725	KSMWVFHTBHSTGW-UHFFFAOYSA-N	428.923	1.709	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)CNC(=O)Cc1cccc2ccccc12	795176490	BGHGXBNMLZLCCT-UHFFFAOYSA-N	440.525	1.892	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)Cc1ccc(S(=O)(=O)C(F)F)cc1	795181838	PQVYHLVSNMHYPG-UHFFFAOYSA-N	447.485	1.619	50	20	IDGD	
CCOC(=O)Cc1cccc(S(=O)(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c1	795325834	OXSGNNRTEVTRSD-UHFFFAOYSA-N	428.470	1.601	50	20	IDGD	
CCOc1cccc([N+](=O)[O-])c1C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	795711949	QXIGYSILPANJKY-MRXNPFEDSA-N	445.384	1.138	50	20	IDGD	
O=C(COC(=O)c1cc(C2CC2)cnc1Cl)NNC(=O)[C@@H]1COc2ccccc2O1	796174573	XKVZPQIOKWEPOI-INIZCTEOSA-N	431.832	1.757	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)N1CC[C@@H](N2CCN(C(=O)OC(C)(C)C)CC2)C1	796616143	UFGUCRCCJCLUQS-DLBZAZTESA-N	425.574	1.195	50	20	IDGD	
COC(=O)Cn1ncc(NC(=O)C(=O)NNC(=O)c2sc3ccccc3c2Cl)c1C	796991656	GGWZMXVXUUYODR-UHFFFAOYSA-N	449.876	1.632	50	20	IDGD	
O=C(NNc1cc(F)c(F)c(F)c1)C(=O)Nc1cc(S(=O)(=O)N2CCCC2)ccn1	797093857	VWYFGGHXPROKBP-UHFFFAOYSA-N	443.407	1.365	50	20	IDGD	
CN(C(=O)[C@@H]1CCN(CC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)C1)c1ccccc1	797529810	HLCXJBSXPBUYRB-MRXNPFEDSA-N	425.445	1.341	50	20	IDGD	
Cn1ncc2c1C[C@H](C(=O)NNc1ccc(S(=O)(=O)Nc3nccs3)cc1)CC2	799101526	NQLWYDFXZWKUMN-GFCCVEGCSA-N	432.531	1.926	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CN(C[C@H]2CCCO2)C(=O)OC(C)(C)C)cc1	801111508	RFYVFRXDTBUKED-MRXNPFEDSA-N	434.493	1.497	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)c2c(C)nn(C)c2Br)n[nH]1	801180934	WDTLXFLFCYFDKC-UHFFFAOYSA-N	433.266	1.965	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc2c(c1)nc(CCC(=O)NNC(=O)Nc1ccccc1)n2C	801986891	WQXKKELHYVDQIN-UHFFFAOYSA-N	444.517	1.609	50	20	IDGD	
NC(=O)[C@@H]1CC(C(=O)NNC(=O)Nc2ccc(OC(F)F)cc2)=NN1c1ccccc1	802045818	YITIGWCVHMWAKA-HNNXBMFYSA-N	432.387	1.561	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2ccc(Br)c3cccnc23)CCS(=O)(=O)C1	802569268	GMAZCPNYFDDQDJ-MRXNPFEDSA-N	441.307	1.134	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)NC2CCC3(CC2)NC(=O)NC3=O)c(C)n1C[C@@H]1CCCO1	804730829	DOTOBHOHPCJZDM-GNVZOXPGSA-N	439.516	1.828	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccc(F)c(N2CCCNC2=O)c1	806979682	AVOLSZUWYUNLDJ-UHFFFAOYSA-N	427.436	1.382	50	20	IDGD	
CN(NC(=O)c1cnc(C2CCCC2)nc1N)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	807243438	VBCQNPLCASMXHP-UHFFFAOYSA-N	447.540	1.966	50	20	IDGD	
COc1nn(C)cc1NC(=O)C(=O)NNc1ccc(-c2cccc(C(F)(F)F)c2)nn1	807299289	RPDDXBNSWMUJKL-UHFFFAOYSA-N	435.366	1.986	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CNS(=O)(=O)c2cccc(C(F)(F)F)c2)c(O)c1	810172226	CZMOJPKLKHCMFA-UHFFFAOYSA-N	431.392	1.459	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)NCc1cccc(N2C(=O)NC3(CCCC3)C2=O)c1	811873981	DXGAZEPINWNSKW-UHFFFAOYSA-N	436.472	1.524	50	20	IDGD	
COc1cccc(C2(CNC(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)CC2)c1	812475829	CMYQDWNFGPOZGI-UHFFFAOYSA-N	446.529	1.621	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)N[C@@H]1CCN(c2ccccc2F)C1	813854359	ZPFHTWSLVTUIBB-CYBMUJFWSA-N	434.497	1.342	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NN=Cc2cnn(C)c2N)c1	814689082	TWXXKKLPZNAVDV-UHFFFAOYSA-N	428.474	1.576	50	20	IDGD	
COC(=O)Cn1cc(C=NNC(=O)Nc2ccc(S(N)(=O)=O)cc2)c2ccccc21	814966318	XFOQUNKOOCSQLF-UHFFFAOYSA-N	429.458	1.617	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc2cccnc12	815567207	RFAIWSLDQXEBAW-UHFFFAOYSA-N	446.423	1.534	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1nc(-c2ccco2)cs1	815752533	WENUETAACSYEKS-UHFFFAOYSA-N	435.487	1.735	50	20	IDGD	
Cc1nnnn1/C(=C/c1ccccc1)C(=O)NNc1ccccc1S(=O)(=O)N(C)C	817054918	DQDULSRVNGMOPP-GHRIWEEISA-N	427.490	1.373	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)CCN/C(O)=C2/N=CC=CC2=O)c1	818757171	QUPKYTRGFUPRGQ-NXVVXOECSA-N	437.250	1.595	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)c2cnc3nc(O)nc(O)c3c2)c1	818767463	JGECCMDRALGIEF-UHFFFAOYSA-N	434.206	1.742	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)[C@H]2CC(=O)N(c3cc(Cl)ccc3OC)C2)cc1	825529989	PMEXWVRKFMBGRQ-ZDUSSCGKSA-N	446.891	1.970	50	20	IDGD	
CCCCn1c(C)cc(/C=C(/C#N)C(=O)N(CC)CC(=O)N[C@@H]2CCS(=O)(=O)C2)c1C	912663451	FHRMXEHTOWMOBV-NURJGKTBSA-N	448.589	1.964	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1ccc(Cl)cc1)C(=O)NNC(=O)COc1ccc(C#N)cc1	913455029	CAEOWHJDMDPMIB-GFCCVEGCSA-N	436.877	1.105	50	20	IDGD	
CCc1c(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cnn1-c1ccccc1	913465450	AGXKQUSBWRMAPL-UHFFFAOYSA-N	441.513	1.760	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)o1	914749675	JLPLZKYVOLIMSJ-LBPRGKRZSA-N	425.438	1.432	50	20	IDGD	
CN(C)[C@H](CNC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)c1ccco1	915896794	LANBSAMAONRUPA-QGZVFWFLSA-N	449.533	1.311	50	20	IDGD	
O=C(NC[C@@H]1CC1(Cl)Cl)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	915907935	KBFSYKOZYOFUFZ-LBPRGKRZSA-N	435.333	1.609	50	20	IDGD	
Cc1nn([C@@H]2CCS(=O)(=O)C2)c(Cl)c1C=NNC(=O)COc1ccccc1F	916300550	LBNAVQSNWMDNQA-GFCCVEGCSA-N	428.873	1.873	50	20	IDGD	
CN(C)N(C(=O)c1cccc(NC(=O)[C@H]2Cc3ccccc3O2)c1)[C@@H]1CCS(=O)(=O)C1	916373912	RZGGOGQOPAZPRG-UYAOXDASSA-N	443.525	1.735	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H]2CCN3CCCC[C@@H]23)c1	916638597	JADUGHLEIHJXOW-MSOLQXFVSA-N	437.566	1.288	50	20	IDGD	
CCn1c(O)nc2cc(C(=O)NNC(=O)c3cc(OC)c(OC)c(OC)c3)ccc2c1=O	916743583	GPJPFGKHLLTMDC-UHFFFAOYSA-N	442.428	1.223	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2cc(F)ccc2C)c1	917718343	UFJQTVWLQDAPKM-UHFFFAOYSA-N	443.522	1.788	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CCCCC/N=C2/NS(=O)(=O)c3ccccc32)c(O)c1	918341008	IRSNTGUGDVWEKG-UHFFFAOYSA-N	444.513	1.761	50	20	IDGD	
CCCN1CC[C@H](CNC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)C1	919797990	ZZUKLHVVCPSYNY-MRXNPFEDSA-N	437.566	1.147	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)N[C@H](C)CN2CCC[C@@H](C)C2)nc1	919914344	GRGDKYBZDZCVMF-HZPDHXFCSA-N	426.587	1.859	50	20	IDGD	
CCCS(=O)(=O)CC(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	919977503	NGNYMYDIJYPOMW-UHFFFAOYSA-N	442.497	1.031	50	20	IDGD	
CC(C)(C)OC(=O)NNC(=O)c1ccc2c(c1)S(=O)(=O)N(C[C@H]1CCCO1)C2=O	920402602	GUIATRXDKQLHJL-GFCCVEGCSA-N	425.463	1.180	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)NNC(=O)COc2ccccc2F)cc1OC	920931412	ONLLJYWYQNIDKJ-UHFFFAOYSA-N	440.453	1.828	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3ncoc3[C@H]3CCCO3)cc2)CC1	1116073559	CDOKOTIXVLRWKY-MRXNPFEDSA-N	435.506	1.219	50	20	IDGD	
Cc1nc(S(=O)(=O)N2CCC(C(=O)NNc3ccc(C(C)(C)C)nn3)CC2)cn1C	1318590118	XRNSKEJJVNYVGR-UHFFFAOYSA-N	435.554	1.360	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3ccccc3N3CCCC3=O)CC2)cc1	1319401012	MGOAQNDIGJTOAG-UHFFFAOYSA-N	449.555	1.701	50	20	IDGD	
CCOc1ccc(/C=C(/C#N)C(=O)N2CCN(c3nnc(C)c(C)c3C(N)=O)CC2)cc1	1326709106	CQKYHZGUNJDKHZ-AQTBWJFISA-N	434.500	1.847	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](C)N3C[C@@H]4C[C@H]4C3)C2)C1	1778853222	HQHHRCHTNNLQBC-CUGJGTHOSA-N	428.371	1.188	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(Cl)c4nncn4c3)C2)C1	1778948327	UKHXJYXOPPTCJN-KDOFPFPSSA-N	442.303	1.080	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2)c1nnc(-c2ccccc2)o1	1779424003	ZEWLHLBOVRVSBU-GCKMJXCFSA-N	448.907	1.464	50	20	IDGD	
O=C(c1nccc2nc[nH]c12)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781331487	QWCHQCOIAYRHNJ-XJKSGUPXSA-N	426.246	1.092	50	20	IDGD	
Cc1nccn1CCCC(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781334387	MXJHOVRJQDIFQS-RDJZCZTQSA-N	431.306	1.492	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2)C1CCC2(CC1)OCCO2	1781638133	IKZGNWWUYDEUFM-SQGPQFPESA-N	444.956	1.033	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](O)NC(=O)OC(C)(C)C)C2)C1	1781853820	QITBHWFVVMUWKK-IQUTYRLHSA-N	433.933	1.067	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(C)c(NC(C)=O)c3)C2)C1	1781913358	CGVKJSDBQKILAD-DYESRHJHSA-N	437.924	1.651	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)C2)C1	1781938093	BQYRUXZJHIRBLX-IBGZPJMESA-N	437.525	1.595	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1cncnc1)C2	1781996398	HIHJATYKKHQINI-DDUZABMNSA-N	425.327	1.316	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(C=O)s1)C2	1782170327	IKQTWHLUTKACSE-IDHHARJASA-N	428.938	1.942	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1n[nH]c3ccccc13)C2	1782175642	OFQITOBVXSCFRN-LUQKVYGDSA-N	434.924	1.944	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)Cn2ccnc2)C1	1782549991	ZXDOQGMFNHMIEE-WOCWXWTJSA-N	426.945	1.287	50	20	IDGD	
O=C(/C=C/c1cnccn1)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Br)C2	1782619238	FFPBVWMNTMOCLJ-UVHFPMRFSA-N	441.301	1.694	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)Cc3ccc(C(=O)OC)s3)CCO2)C1	1783881110	JAFHUVMQJQFPPW-AUUYWEPGSA-N	444.937	1.161	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cc(O)c(O)c(Cl)c3)CCO2)C1	1783882227	WTXMLJCVGWNNGN-SCLBCKFNSA-N	433.288	1.449	50	20	IDGD	
CC(=O)N/C(C)=C/C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]2C1	1783972394	KNHJNDLVTQYUMB-NMJMFXAJSA-N	430.343	1.037	50	20	IDGD	
Cc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)CBr)C[C@@H]32)cc(O)n1	1787455967	SBOACPPMSWUTET-MZGVZZPPSA-N	440.338	1.720	50	20	IDGD	
Cc1ccc2cc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)[C@@H](O)CCl)C[C@@H]43)ccc2n1	1787984386	DRSQGGVLQAGHTR-ZULIPRJHSA-N	431.920	1.736	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3noc4c3CCCC4)C[C@@H]21)[C@H](F)Br	1789922209	ANXPFUQJPZTGKR-ZAJUMQRFSA-N	444.301	1.837	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc4ccnn34)[C@H]2C1	1790345624	ZZSZCNBWSHNCTR-IEZWGBDMSA-N	430.581	1.779	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)Nc1ccc(C2(NC(=O)CN(CCO)CCO)CCC2)cc1	1790493692	GADVIPLFIDPEKH-IBGZPJMESA-N	446.375	1.643	50	20	IDGD	
COc1ccc(Cl)cc1CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21	1790756587	HGWGNYLNEFDWTG-PTOXDTDZSA-N	445.343	1.471	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cc(C)no3)C[C@@H]21	1790958513	SECMVTSOJNIQRR-HNKHHVNMSA-N	428.327	1.679	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cn3cnc4ccccc43)C[C@@H]21	1791063227	DJZSPNMTVMXCGI-LLDVTBCESA-N	449.349	1.799	50	20	IDGD	
Cc1[nH]nc(C(=O)NC2(c3ccc(NC(=O)CCC(=O)NN(C)C)cc3)CCC2)c1F	1791599303	GNMQMSDAIJGXIZ-UHFFFAOYSA-N	430.484	1.978	50	20	IDGD	
CC(C)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c(c1)NC(=O)CO3)C2	1792782959	KQRLRQJIQRQLRR-ZSBFGKGUSA-N	435.908	1.486	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)ccc1O)C2	1792874447	PKNRYEDGHHHQGN-OVZMXSCWSA-N	427.295	1.332	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c(F)cc(Cl)cc1Cl)C2)[C@@H](O)CCl	1792980696	UJNYLAAMSFHZFF-YPSFTXJRSA-N	439.698	1.935	50	20	IDGD	
C[C@@H](CBr)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnn3c1OCCC3)C2	1792990868	OQEBPIBQZNFUIE-FQUUOJAGSA-N	425.327	1.948	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H]2C[C@]21C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCl	1793115936	BOSKTJMOJZJKCJ-ATCDCCBLSA-N	441.956	1.624	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCc1cc(F)ccn1	1794027253	ZRWIRGQRWBEHFK-VLWCASSMSA-N	442.329	1.916	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(S(C)(=O)=O)cn1	1794749201	HRPYQYIAXKISBR-RVMXOQNASA-N	444.351	1.520	50	20	IDGD	
Cc1ccc2nc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3ccc(B(O)O)cc3)ccc2c1	1796188963	GPMRVISXNLRIRZ-WKCHPHFGSA-N	443.312	1.789	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccn2nccc2c1	1797557025	AAMWKOGDZWTHRN-FSDCSDTHSA-N	435.322	1.711	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H]1CCCN1C)C2	1799220092	NRDJYRKGSOJUTG-RCJHGTSTSA-N	444.488	1.866	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(C)cc1-n1nccn1)C2	1799268727	HSDDOLLVWLZJCZ-LORHWOILSA-N	431.924	1.796	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc([N+](=O)[O-])ccc1N(C)C	1799798064	LRDVCDAXMPTDGI-ZDFLXESQSA-N	438.912	1.881	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@]1(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](F)Cl)C3)CCOC1	1800139866	DKNNLAVJNRJSJP-ZRKYPZEGSA-N	433.908	1.843	50	20	IDGD	
C[C@@H](S)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](Br)Cc1ccccc1	1800437425	YAKFQJXYNDPKLL-USACIQFYSA-N	441.391	1.901	50	20	IDGD	
O=C(O)C#CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](Br)Cc1ccccc1	1801572890	YRCYTLJAZBYPLM-YYIAUSFCSA-N	433.302	1.719	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H]1CN(Cc3ccccc3)CCO1)C2	1802274386	WUNUPIOHXYJECV-XNTOXWQXSA-N	449.979	1.779	50	20	IDGD	
COC[C@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C[C@@H](O)CNC(=O)OC(C)(C)C)C2	1802282826	IMUQVBQIIMFPRS-JKJDWNRSSA-N	447.960	1.154	50	20	IDGD	
COc1cccc(/C=C/C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CCC(=O)NN(C)C)c1	1802337945	FPTCMTUZHIHESH-AZQHWYKZSA-N	428.533	1.720	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CCc2ccccc21	1802528309	XNFOCXJAGOLFHB-AXVVYFOYSA-N	433.512	1.667	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)[C@@H]2C[C@@H]2C2CC2)[C@H]1c1cccnc1	1802992078	HGHXENAHGCFAOI-JPAWQOSXSA-N	427.549	1.507	50	20	IDGD	
CC(C)(C)OC(=O)CC(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1	1803896760	RVSZJUATMQJJSZ-HDMKZQKVSA-N	425.913	1.419	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)Cc2cccc(OC)n2)[C@@H]1c1cccnc1	1804395366	HRLZBBYOFYKWTQ-MDKPJZGXSA-N	446.935	1.988	50	20	IDGD	
O=C(c1cc(-n2ccnc2)ccn1)N1CCC2(CCCN(C(=O)[C@H](O)CCl)C2)CC1	1805525525	WXCJMCSATOVFPR-GOSISDBHSA-N	431.924	1.712	50	20	IDGD	
Cc1ccc(C(=O)NC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)nc1	1805874090	YVKLLXSJJZGMTA-AVRDEDQJSA-N	438.532	1.478	50	20	IDGD	
Cc1ccccc1C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1807360785	LXTGZNXWDMRYAS-REWPJTCUSA-N	443.312	1.703	50	20	IDGD	
Cc1[nH]nc(C(=O)N2CCCC3(CCN(C(=O)c4cnccc4C(=O)NN)CC3)C2)c1F	1807769146	BGYMXPPOWMQEPD-UHFFFAOYSA-N	443.483	1.014	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H](CNC(=O)[C@](C)(Cl)CCl)[C@@H]1c1cccnc1)n1cnnn1	1808317710	ZJYPNPWXURRPOU-LJGDNWOOSA-N	440.335	1.571	50	20	IDGD	
O=C(O)CSCC(=O)N1CC[C@H](CNC(=O)[C@H](F)Br)[C@H]1c1cccnc1	1808677970	DZKRDOKEEKVPDG-DFBGVHRSSA-N	448.314	1.596	50	20	IDGD	
Cc1ccncc1C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1808784670	NHLVKSBKEAQKEJ-DENIHFKCSA-N	444.300	1.098	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC2(CCCN(C(=O)c3cc4n(n3)CCNC4=O)C2)CC1	1808816394	PRBBVPLLCZVASG-HNNXBMFYSA-N	435.956	1.879	50	20	IDGD	
O=C1Cc2cc(C(=O)NC[C@@H]3CCN(C(=O)[C@@H](O)CCl)[C@@H]3c3cccnc3)ccc2N1	1809683447	IKJVGWWKDLJUAA-ZAAXVRCTSA-N	442.903	1.496	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)C[C@H]2CCCCO2)[C@H]1c1cccnc1	1813068195	JQCJZKSVIHMRIU-YYDVJCTNSA-N	445.564	1.420	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3[nH]nc4ccncc34)sc2C1	1816866429	WZSWNSKGHAGMLB-GXSJLCMTSA-N	434.909	1.894	50	20	IDGD	
Cc1occc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819402061	LFQZXXBQDYOYJE-KRWDZBQOSA-N	437.460	1.929	50	20	IDGD	
CC(C)O[C@@H](C)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCC(=O)NN(C)C)CC2	1820015249	FXMSKGQVTJQRDU-STQMWFEESA-N	425.555	1.242	50	20	IDGD	
CC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](C)NS(=O)(=O)CC)CC2	1822840336	YUABUCNCZKOGLC-DCAQKATOSA-N	436.987	1.400	50	20	IDGD	
CC[C@H](C)[C@H](O)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1	1824547945	DGTWTQBADMMERC-YSSFQJQWSA-N	445.564	1.325	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCN1CCOCC1)CC2	1825641000	GHOPKHWCEWVXHL-RYUDHWBXSA-N	445.383	1.561	50	20	IDGD	
CC(C)c1cc(C(=O)N[C@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)n[nH]1	1826088728	LGTAMYYRTWQKEZ-LBPRGKRZSA-N	447.565	1.588	50	20	IDGD	
COC[C@H](NC(C)=O)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H](C)Br)CC1	1829119501	XNAFYYVWECBQOK-COXVUDFISA-N	446.386	1.541	50	20	IDGD	
O=C(c1ncc(Cl)cc1Cl)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1829606798	MVEVDXPIIYDJCA-XJKSGUPXSA-N	440.686	1.993	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCC(=O)N3CCCC3)C2)C1	1830357926	HYVGZDAFZBKHMG-NRFANRHFSA-N	443.972	1.110	50	20	IDGD	
Cn1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)c(C(F)F)n1	1830357984	OADFXNFPIINNKJ-IBGZPJMESA-N	448.898	1.693	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](CN)c3ccccc3)C2)C1	1830359321	MTKWSFFFGQSDNR-XMSQKQJNSA-N	437.968	1.450	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc([N+](=O)[O-])[nH]3)C2)C1	1830364647	NHUXHAXUOVGAIT-GOSISDBHSA-N	428.873	1.258	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)Cc3ccccc3)C2)C1	1830366238	LRPCZNDEQLDCTH-AVRDEDQJSA-N	438.952	1.311	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)nc2nccn12	1830366751	VPYCEFWHQAVVBO-OAQYLSRUSA-N	449.939	1.373	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(F)s3)C2)C1	1830535819	UAAZFYQHZRHTJZ-SJKOYZFVSA-N	449.342	1.988	50	20	IDGD	
O=C(c1cccc(F)c1Cl)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1830733879	WTZQZBASVYGJDZ-KDOFPFPSSA-N	435.279	1.149	50	20	IDGD	
CCS(=O)(=O)CC(=O)N1CCC([C@H]2CCCCN2C(=O)[C@H](C)Br)CC1	1831648423	FFOHEDAMMDGKSA-DZGCQCFKSA-N	437.400	1.824	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(F)s3)CCO2)C1	1833218267	ASECJRZBVPZKJJ-MEDUHNTESA-N	435.315	1.741	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)[C@H](CC)NC(N)=O)CC2)CC1	1833532615	ZGTCBTHLVCLWIA-IRXDYDNUSA-N	429.993	1.412	50	20	IDGD	
COc1ccc(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)s1	1833946596	KRTRSYPPFRMTJN-HNNXBMFYSA-N	429.970	1.542	50	20	IDGD	
Cc1nc(C(=O)NC2CCN(C3CCN(C(=O)CCBr)CC3)CC2)co1	1834202843	CFQHWRZQSNMCNV-UHFFFAOYSA-N	427.343	1.953	50	20	IDGD	
O=C(CCc1ccc[nH]1)N1CCOC[C@@]2(C1)CN(C(=O)CCBr)CCO2	1834822629	ZCTAVTURFATLFI-GOSISDBHSA-N	428.327	1.189	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)cnc1C	1837710065	GPZQDBQZZBFFOB-NRFANRHFSA-N	435.597	1.620	50	20	IDGD	
CCCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)CCO2	1838528259	MYMMGIDTAFSCRA-OAQYLSRUSA-N	449.460	1.390	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(C#N)c3)CCO2)C1	1838907893	UUODPTFYAAHRLG-VQTJNVASSA-N	440.327	1.865	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(OC)c(OC)c3)CCO2)C1	1838932167	SLUOVCSDJXQQTF-HRAATJIYSA-N	440.924	1.791	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cncc4cnccc34)C2)C1	1839146217	LQZADEPWCUJJFS-NQIIRXRSSA-N	432.908	1.717	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(C#N)cc(OC)c3)C2)C1	1839146675	RZXDLSQUALIPCE-NQIIRXRSSA-N	435.908	1.654	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)C/N=C/c3ccco3)C2)C1	1839153653	NHJXQHJYNCMMRY-NJIURKFCSA-N	446.331	1.391	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(O)cc3F)C2)C1	1839154062	AAGLVEQGABIUKZ-MOPGFXCFSA-N	449.306	1.838	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccccc3O)C2)C1	1839155402	SHHQFIZQVJDIBG-WOJBJXKFSA-N	445.343	1.627	50	20	IDGD	
O=C(CCc1ccc[nH]1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839198972	GXTSHNUEPBUGCA-DOTOQJQBSA-N	432.290	1.094	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3C[C@@H]3F)C2)C1	1839741769	AFMHVGHURQAUDR-DVRJMELHSA-N	449.429	1.686	50	20	IDGD	
C=CCC(F)(F)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1839889645	HBMIICYWPWWSOT-FZMZJTMJSA-N	429.233	1.345	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3c(C)n[nH]c3C)C2)C1	1839965228	QZNZXFSPNDQEIQ-RDTXWAMCSA-N	443.342	1.270	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)C3(C(F)(F)F)CC3)C2)C1	1840033891	UKZUQSJEFVPMDL-BXUZGUMPSA-N	443.260	1.569	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)c3ccccn3)C2)C1	1840036005	CFNMOLGHPWEXGU-VCBZYWHSSA-N	440.338	1.425	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3coc(C(C)C)n3)C2)C1	1840151274	ZIZDDTKDWZCISK-IFXJQAMLSA-N	429.901	1.122	50	20	IDGD	
C=CCO[C@H](C)C(=O)N1CCCC12CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2	1841609954	FYVODSYFXYPFJP-CQSZACIVSA-N	431.445	1.928	50	20	IDGD	
O=C([C@H]1CC(=O)N(C2CCCC2)C1)N1CC2(CCCN2C(=O)CCBr)C1	1842637355	FOQKTYBIKXXTQM-AWEZNQCLSA-N	426.355	1.766	50	20	IDGD	
O=C([C@@H]1C[C@@H]1c1ccc(Cl)cc1)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843011344	UCUJPIZIDVRGGM-WOJBJXKFSA-N	438.720	1.641	50	20	IDGD	
O=C(c1cc(Br)cs1)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843013877	YSNZJDCTTJOBIM-UHFFFAOYSA-N	449.135	1.321	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1cnn3cccc(C)c13)C2	1843416700	QGMLYPOHTDZCPO-WGOQTCKBSA-N	447.499	1.594	50	20	IDGD	
Cc1cc(CC(=O)N2CCCC23CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C3)n[nH]1	1844323205	OGYLKTYLOAEJOX-HNNXBMFYSA-N	439.944	1.596	50	20	IDGD	
C=CCOc1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1OC	16594239	PHFVVMPWRFPOAS-UHFFFAOYSA-N	433.486	1.585	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNS(=O)(=O)c1ccc(S(N)(=O)=O)cc1	18995578	CENKANGGTYGCAH-ZDUSSCGKSA-N	449.510	1.264	50	20	IDGD	
CC(C)C(=O)NNC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(Br)s2)C1	26796826	HPEYJJQEVJYZOV-JTQLQIEISA-N	438.369	1.715	50	20	IDGD	
CC(C)(C)NC(=S)NNC(=O)CCNS(=O)(=O)c1ccc(OC(F)(F)F)cc1	28716672	LOWDPUXCSWIFKY-UHFFFAOYSA-N	442.485	1.547	50	20	IDGD	
COc1ccc([C@]2(C)NC(=O)N(CC(=O)NNc3nc(-c4ccncc4)no3)C2=O)cc1	726376425	KUSSPUQETJJAAE-FQEVSTJZSA-N	437.416	1.051	50	20	IDGD	
COc1cccc(/C=C(/C#N)C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1	728320736	YMXQWFZXSNBQDN-QLTJYVKOSA-N	437.408	1.133	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)c2ccc(S(N)(=O)=O)cc2)c1	728612072	JYWUFRSEYJOHKD-UHFFFAOYSA-N	428.264	1.180	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)COc1ccc2ccccc2c1Br	729276059	WIXLKHBJZCKKGC-JTQLQIEISA-N	444.307	1.066	50	20	IDGD	
CC(=NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1ccc(S(=O)(=O)NCc2ccccc2)cc1	730576235	MVOWNLRQTLDDFO-GOSISDBHSA-N	449.554	1.440	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)NCc1ccc(NC(=O)c2cccnc2)cc1	730907355	IQVSLBLAWMHILT-UHFFFAOYSA-N	435.440	1.949	50	20	IDGD	
CCOC(=O)C1=NN(c2ccccc2)[C@@H](C(=O)NNC(=O)Cn2cnc3ccccc32)C1	731185754	DXKNLMBIQJGBBB-LJQANCHMSA-N	434.456	1.382	50	20	IDGD	
Cc1ccc(S(=O)(=O)n2ccc(C(=O)NNC(=O)[C@@H]3COc4ccccc4O3)c2)cc1	731865366	CMRLKYDXGFVYJA-IBGZPJMESA-N	441.465	1.635	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cc(O)nc3ccc([N+](=O)[O-])cc23)cc(OC)c1OC	731875273	YRRPJWWADYAFMA-UHFFFAOYSA-N	442.384	1.949	50	20	IDGD	
CCn1c(S[C@H](C)C(=O)NNC(=O)CC(C)C)nc2cc(S(N)(=O)=O)ccc21	731904001	BPHXQBARENPOIF-LLVKDONJSA-N	427.552	1.378	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1)[C@@H]1COc2ccccc2O1	731957682	WSZWQLISZIMUMV-FZMZJTMJSA-N	446.441	1.248	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)[C@@H](C)N2CCN(c3ccc(F)cc3)CC2)c1	732264353	QQIQCFLLSFDBDQ-MRXNPFEDSA-N	429.496	1.604	50	20	IDGD	
O=C(NNC(=O)c1ccccc1NS(=O)(=O)C(F)(F)F)c1cccc([N+](=O)[O-])c1	732749798	FSPUOPMHCMIHSY-UHFFFAOYSA-N	432.336	1.931	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@@H](C)c2cnn(C(C)C)c2)cc1	732892721	GHTNGWCMJPESKQ-HNNXBMFYSA-N	436.538	1.485	50	20	IDGD	
COC(=O)c1ccc(CNC(=O)NNC(=O)c2ccc(OC)c(Br)c2)o1	734170209	FXFHZAVMTACDHY-UHFFFAOYSA-N	426.223	1.982	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)[C@@H]1CC(=O)N(CC(F)(F)F)C1	734251787	MYDZNQQLEOWUOV-LLVKDONJSA-N	436.456	1.617	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)N[C@@H]2CCN(C3CCN(C)CC3)C2)c1	734282732	CJOZAMDOARYXBE-GOSISDBHSA-N	431.581	1.996	50	20	IDGD	
CN(C)[C@@H](CNC(=O)NNC(=O)c1nnc(O)c2ccccc12)c1c(F)cccc1F	734676127	SHTNPAZWORFYDM-HNNXBMFYSA-N	430.415	1.861	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)[C@@H]2C[C@H]2c2ccc(F)cc2)CC1	735117330	RFCPBHWZWOVPLZ-DLBZAZTESA-N	433.509	1.404	50	20	IDGD	
Cc1cc(NNC(=O)C2CCN(S(=O)(=O)c3cc(F)ccc3F)CC2)nc(C)n1	736716543	JGHGHXWDUYNIBU-UHFFFAOYSA-N	425.461	1.916	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)N[C@H](C)[C@H]1CN(Cc2ccccc2)CCO1	741266393	JWURUGIQZWIPNP-DYESRHJHSA-N	442.516	1.694	50	20	IDGD	
CC(=O)N[C@@H](Cc1c[nH]c2ccc(Br)cc12)C(=O)NNC(=O)c1ccncc1	742031565	LCIYEIKJEFFWEZ-KRWDZBQOSA-N	444.289	1.834	50	20	IDGD	
CC(C)(C)CC(=O)Nc1ccc(Cl)c(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)c1	742055219	MBICVNMVPZBNQC-GFCCVEGCSA-N	444.941	1.846	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)[C@H](NC(=O)c2ccco2)c2ccccc2)c1	744545402	KYPVGHPBZZQFBI-HXUWFJFHSA-N	446.419	1.627	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)c2ccc(Cl)c(NS(C)(=O)=O)c2)c1	744890294	RQZNUXOPGKKAHX-UHFFFAOYSA-N	439.877	1.638	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2ccc(F)cc2Br)nc2nc(O)nc(O)c12	746136308	MHXVLAFHYNHPNU-UHFFFAOYSA-N	436.197	1.721	50	20	IDGD	
CC(=O)c1cccc(S(=O)(=O)NCCC(=O)NNC(=O)c2cccc3cccnc23)c1	747471970	HNJCJUUQOKRWET-UHFFFAOYSA-N	440.481	1.567	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2ccon2)c1	747597136	UJRZBDHMSOIVJE-UHFFFAOYSA-N	445.457	1.628	50	20	IDGD	
O=C(Cc1ccc(S(=O)(=O)N2CCOCC2)s1)NNc1cc(F)c(F)c(F)c1	748811232	ZMMNMVRRTYIASX-UHFFFAOYSA-N	435.449	1.872	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NC2CCC(N3CCCCC3)CC2)c2ccccc2c1=O	751107598	XEGKBRVVPWDZLD-UHFFFAOYSA-N	426.521	1.675	50	20	IDGD	
CCCCc1ccc(N2C[C@@H](C(=O)NNC(=O)CNC(=O)c3ccco3)CC2=O)cc1	751201056	FLAKWHINXWTFAC-INIZCTEOSA-N	426.473	1.553	50	20	IDGD	
CCOc1cc(C(=O)NNS(=O)(=O)c2ccc(C#N)nc2)cc(OCC)c1OCC	751267328	QILMIIMNZRMIQJ-UHFFFAOYSA-N	434.474	1.773	50	20	IDGD	
CNC(=O)NNC(=O)c1cc(S(=O)(=O)Nc2cc([N+](=O)[O-])ccc2OC)ccc1F	751460475	KQMFDDLRRMAARI-UHFFFAOYSA-N	441.397	1.117	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)[C@@H]2CC(=O)N(c3cc(OC)cc(OC)c3)C2)cc1	752792742	QBCAWBHALDKWFP-CQSZACIVSA-N	442.472	1.325	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)c1ccc(CNS(C)(=O)=O)o1	754015384	TUIGRRRRQFDVGT-UHFFFAOYSA-N	444.535	1.163	50	20	IDGD	
C[C@H](OC(=O)/C(C#N)=C/c1ccc(O)cc1)C(=O)N[C@@H](C)c1ccc(S(N)(=O)=O)cc1	754543154	SRPANFOXROQCMQ-MSUZTGCTSA-N	443.481	1.756	50	20	IDGD	
CCC(=O)NNC(=O)Nc1cc(S(=O)(=O)N2CCOCC2)ccc1N(CC)CC	755390695	CISXCQHUKMXFHH-UHFFFAOYSA-N	427.527	1.116	50	20	IDGD	
CCOc1ccc(NC(=O)NNC(=O)c2c[nH]nc2C)cc1S(=O)(=O)N1CCCC1	755472711	WIFDCYOXZBSTRW-UHFFFAOYSA-N	436.494	1.368	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)Nc2ccc(CNS(C)(=O)=O)cc2)cc1	756627983	JYCWJMBYIRCPJX-CQSZACIVSA-N	448.501	1.559	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)CN1C(=O)NC2(C[C@H](C)C[C@@H](C)C2)C1=O	756862090	ABCYJFZKXOIKJB-HUUCEWRRSA-N	446.504	1.358	50	20	IDGD	
CSCC[C@H](NC(=O)c1ccc2ccccc2n1)C(=O)NNc1ccc(C(N)=O)nn1	757405983	PPHBTRRHYWUANG-INIZCTEOSA-N	439.501	1.119	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2ccc3c(c2)S(=O)(=O)CC3)c2ccccc2c1=O	757709189	LTZRUBMQZYHYNX-UHFFFAOYSA-N	441.469	1.213	50	20	IDGD	
COCCS(=O)(=O)c1ccc(CNC(=O)NNC(=O)C(C)(C)c2ccccc2)cc1	758991782	BJDGHRRTPGAULG-UHFFFAOYSA-N	433.530	1.915	50	20	IDGD	
O=C(NNS(=O)(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)NC1CCCCC1	760336071	WOLVMIPLUHSDAB-UHFFFAOYSA-N	444.579	1.686	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCCC(=O)NNC(=O)c1ccc(Cl)nc1	760799241	MIXUYHWSCCBBFM-CYBMUJFWSA-N	439.900	1.402	50	20	IDGD	
CC[C@H](N=c1nn[nH]n1-c1ccccc1)C(=O)NNC(=O)CSc1ccccc1OC	762374907	ZCNQBPYYKOJEDR-HNNXBMFYSA-N	441.517	1.223	50	20	IDGD	
CSc1ccc(C(C)=NNC(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)c(Cl)c1	763357675	JKGLYCZSJBDBGY-UHFFFAOYSA-N	434.909	1.349	50	20	IDGD	
CCCCOC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)cc1	763551305	OCZXFIKPLNCOCO-UHFFFAOYSA-N	427.413	1.772	50	20	IDGD	
C=CCNC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(OC)cc2)cc1	763658783	BUZQBQWENCXBFE-UHFFFAOYSA-N	441.444	1.168	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccc(Br)cc2)ccc1C(N)=O	763692775	CGVGPACCTDJOMN-UHFFFAOYSA-N	449.261	1.021	50	20	IDGD	
CNS(=O)(=O)c1cccc(NC(=O)C(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)c1C	763727649	LGQIHMTVEBGFDZ-UHFFFAOYSA-N	448.545	1.205	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCC3)cc1	763782422	CPBIWLIQWMYBSZ-UHFFFAOYSA-N	436.515	1.398	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)C(=O)Nc1cc(F)ccc1Br	763791493	SWOGISYDLSMLJD-UHFFFAOYSA-N	448.208	1.637	50	20	IDGD	
COC(=O)c1cc(F)c(F)cc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccccc1F	763864869	LLWGPXROPCGSPG-VIFPVBQESA-N	439.346	1.444	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccn(Cc2ccccc2)n1	763873920	YHAZVDPCLAXIHL-AWEZNQCLSA-N	425.420	1.624	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@@H](C)C(=O)NNC(=O)C(=O)Nc1cccc(C(N)=O)c1	763883479	OQCSFJYUMQNZMU-LBPRGKRZSA-N	432.864	1.609	50	20	IDGD	
COCCc1cc(NC(=O)C(=O)NNC(=O)c2sc(-c3ccccc3)nc2C)n(C)n1	763902689	WJNZZSXZJFHCBX-UHFFFAOYSA-N	442.501	1.441	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)C(=O)Nc1cccn(Cc2ccc(F)cc2)c1=O	763918371	BMCYBORHGNRKNP-UHFFFAOYSA-N	440.406	1.503	50	20	IDGD	
COC(=O)c1[nH]c(C)cc1NC(=O)C(=O)NNC(=O)c1ccc(COc2ccccc2)o1	763948936	HCYPNNCGWDJWOV-UHFFFAOYSA-N	440.412	1.681	50	20	IDGD	
COC(=O)[C@H](C)Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1	764005644	DPSPOEIPOBTBBL-CYBMUJFWSA-N	441.440	1.209	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)ccc1Br	764006354	PPQZHSUEWFSYQS-UHFFFAOYSA-N	434.246	1.928	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)c2cnccn2)sc2c1CCCCC2	764030765	GQJWAKDADKCQRI-UHFFFAOYSA-N	431.474	1.383	50	20	IDGD	
NC(=O)CCOc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(C(F)(F)F)c2)cc1	764040610	NOJWPOPKAFOUTN-UHFFFAOYSA-N	438.362	1.359	50	20	IDGD	
CC[C@H](C)C(=O)NNC(=O)C(=O)Nc1cc(F)c(I)c(F)c1	764080884	CAIWMMLSZKDRCY-LURJTMIESA-N	425.173	1.701	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)nc1)C(=O)Nc1cccc(NC(=O)c2ccncc2)c1	764100239	KDFXABIZRREHOA-UHFFFAOYSA-N	438.831	1.782	50	20	IDGD	
CCOC(=O)Cn1ccc2cc(NC(=O)C(=O)NNC(=O)c3ccc(C)cc3O)ccc21	764108666	CWJHNIXLYCCTJM-UHFFFAOYSA-N	438.440	1.618	50	20	IDGD	
C#CCOc1cccc(NC(=O)C(=O)NNC(=O)c2cc(OC)ccc2Br)c1	764232145	RSQLWKBZBOMTRV-UHFFFAOYSA-N	446.257	1.869	50	20	IDGD	
CC(C)N(C)C(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)Cc2ccccn2)c1	764264300	PFMSFMFPFDXJAW-UHFFFAOYSA-N	431.880	1.544	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccnn2Cc2ccccc2Br)o1	764370562	FFSDMHXSHIEDJM-UHFFFAOYSA-N	446.261	1.995	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1ccccc1N1CCOC1=O	764397420	JGVBMIQSEHSCRN-UHFFFAOYSA-N	444.469	1.530	50	20	IDGD	
Cc1nn(C)c2[nH]c(=O)c(CCC(=O)NNC(=O)CSc3ccccc3O)c(C)c12	765249146	OVTHPNWTEHUVDL-UHFFFAOYSA-N	429.502	1.456	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)NCCN1CCN(Cc2ccccc2)CC1	765664076	BNXHDFLBNNEHAO-UHFFFAOYSA-N	431.562	1.534	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ccnc(F)c2)c(I)c1	765711356	WGTMWIJCDGUSDO-UHFFFAOYSA-N	430.177	1.916	50	20	IDGD	
C[C@@H](Cc1ccc(F)c(Br)c1)NC(=O)NNC(=O)CNC(=O)c1ccco1	765733060	MEMAEENHGFKDHW-JTQLQIEISA-N	441.257	1.873	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)c(OC)c1	765750100	ZMUCTQVWRVIGMD-UHFFFAOYSA-N	426.517	1.591	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)NCCN1CCN(c2cccc(Cl)c2)CC1	765918448	VPOALJFUQBCLNE-UHFFFAOYSA-N	447.923	1.577	50	20	IDGD	
O=C(NNc1ncnc2ccsc12)[C@H]1CN(Cc2nc(O)c3ccccc3n2)CCO1	766679127	QMCVVSJDXWCEJN-OAHLLOKOSA-N	437.485	1.684	50	20	IDGD	
CCn1c(SCC(=O)NNC(=O)c2ccc(OC)c(OC)c2)nnc1-c1cccnc1	768407694	UFSHOSISFCBHOV-UHFFFAOYSA-N	442.501	1.931	50	20	IDGD	
CCc1nn(C)cc1C(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	770571836	JSIXNWZTWQIIEC-UHFFFAOYSA-N	441.513	1.536	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)C(=O)Nc1ccnn1-c1cccc(F)c1	770771707	NFFVUBABYUTPSL-UHFFFAOYSA-N	449.402	1.302	50	20	IDGD	
Cc1cc(NC(=O)CSCC(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)no1	770967443	PNOHUKWSAYEFCH-UHFFFAOYSA-N	434.482	1.398	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)Cc1ccccc1I	771253053	CPUJDLVUPKJROX-UHFFFAOYSA-N	443.266	1.473	50	20	IDGD	
C=Cn1cc(C=NNC(=O)c2cc(S(=O)(=O)NCc3ccccc3)ccc2O)cn1	773031988	GMIDVVRIIVBWRB-UHFFFAOYSA-N	425.470	1.932	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)c2cccc(S(=O)(=O)NC3CCCC3)c2)c1	773072679	LSCIFZXUTISFBX-UHFFFAOYSA-N	445.501	1.336	50	20	IDGD	
CCOC(=O)c1cc(S(=O)(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)cn1C	773266928	UJOKHJBWAMGUNI-NSHDSACASA-N	429.882	1.632	50	20	IDGD	
COCCNS(=O)(=O)c1cccc(C(=O)NNc2cccc(F)c2C(=O)OC)c1	773625734	KSCHNMVHVRKIFT-UHFFFAOYSA-N	425.438	1.294	50	20	IDGD	
CC(C)(C)c1ccc(C(=O)N[C@H](CCS(C)(=O)=O)C(=O)NNc2cnccn2)cc1	775281834	YBJUSJGOMVHJMW-MRXNPFEDSA-N	433.534	1.451	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(OCC(=O)NNC(=O)COc2ccc(C#N)cc2)CC1	777229995	RTAASTUXGYNNHP-UHFFFAOYSA-N	432.477	1.501	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@H]2CCO[C@@H](CC(C)C)C2)cc1	777751127	CXJHARXTEPWYLO-IRXDYDNUSA-N	440.566	1.540	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)[C@H]2CC(=O)N(Cc3ccc(OC)cc3)C2)nc1C	778427757	FKMSRRBRHOPZCL-HNNXBMFYSA-N	427.461	1.462	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CN[C@H](CCO)c2ccccc2Br)c1	782103706	SUZSXAVDNIKUCV-QGZVFWFLSA-N	431.290	1.795	50	20	IDGD	
CN1CCCN(S(=O)(=O)c2cccc(NC(=O)C(=O)NNc3cccc(F)c3)c2)CC1	783037086	HVPMFZJARWLFJE-UHFFFAOYSA-N	449.508	1.234	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2ccn(-c3ccc(Cl)cc3Cl)n2)CCS(=O)(=O)C1	783424894	GINORCVGMIUEOO-INIZCTEOSA-N	446.316	1.316	50	20	IDGD	
CCn1c2ccccc2c2cc(NC(=O)C(=O)NNC(=O)CNC(=O)c3ccco3)ccc21	784004010	GOPJNNONNLTFKI-UHFFFAOYSA-N	447.451	1.923	50	20	IDGD	
Cc1c(NNC(=O)C(=O)Nc2ccccc2C(=O)N2CCN(C)CC2)cccc1[N+](=O)[O-]	784353027	VSIPCFSQGHXSBC-UHFFFAOYSA-N	440.460	1.373	50	20	IDGD	
COc1cc(F)cc(NNC(=O)C(=O)Nc2cccc(S(=O)(=O)N3CCCC3)c2)c1	785237852	YNVYNGFOYAMIAM-UHFFFAOYSA-N	436.465	1.701	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2cccc(C#N)c2)cc1S(=O)(=O)N1CCCC1	787556672	VRWWYTBSRLFBSL-UHFFFAOYSA-N	443.485	1.433	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1ncc(C(C)(C)C)s1	789776339	NVYLPOFMRZJCJM-UHFFFAOYSA-N	426.520	1.935	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2ccc(C(F)(F)F)c(F)c2)c1	790339389	SMCXHRAGZLWNLW-UHFFFAOYSA-N	440.396	1.871	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)ccc1C(F)(F)F	790957563	UOYUTGOWTSKKHA-UHFFFAOYSA-N	425.319	1.842	50	20	IDGD	
O=C(CCn1cnc2ccc(Br)cc2c1=O)NNc1nc2ccccn2n1	791256756	VZWQFZXPQKVTMA-UHFFFAOYSA-N	428.250	1.735	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)C(=O)Nc1c2c(nn1-c1ccc(Cl)cc1)CCC2	792268957	MXJPAVRQBDZZDH-UHFFFAOYSA-N	426.864	1.753	50	20	IDGD	
Cc1cccc(CC(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)c1Cl	792607787	YWWXTNGHNBMNOY-UHFFFAOYSA-N	428.920	1.796	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)C(=O)Nc2cnc(CC3CC3)nc2)c1	793025806	OQYVKADVVRDBPY-UHFFFAOYSA-N	448.277	1.600	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1)N(C)CC(F)(F)F	793683749	UQBCVMKVVKDBRU-AWEZNQCLSA-N	449.905	1.488	50	20	IDGD	
CC(C)C(CS(=O)(=O)N(C)C)=NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	794910307	ZNTCYDPUMVREPX-UHFFFAOYSA-N	433.575	1.589	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)Nc2ccc(S(=O)(=O)N(C)C)cn2)c1C	797652667	NTOOGGSDGFMOGK-AWEZNQCLSA-N	435.506	1.569	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2N2CCOCC2)cc1C	798308402	YJBAUUWTVBJIEP-UHFFFAOYSA-N	441.444	1.448	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)C(=O)Nc2ccccc2NC(C)(C)C)c2ccccc2c1=O	799258093	ZTLYLSOZQUORKH-UHFFFAOYSA-N	436.472	1.544	50	20	IDGD	
COc1ccc(CN(CC2CC2)C(=O)NNC(=O)CNC(=O)c2ccco2)c(OC)c1	799911546	GLFFIAKZEHRILO-UHFFFAOYSA-N	430.461	1.680	50	20	IDGD	
CNC(=O)CNC(=O)c1cccc(NC(=O)C(=O)NNc2ccccc2Br)c1	800627347	MMRWDSWUXXVVNS-UHFFFAOYSA-N	448.277	1.007	50	20	IDGD	
COc1ccc(Cl)c(NC(=O)NNC(=O)c2ccc(N3NC(=O)CCC3=O)cc2)c1	802108468	PEAZUWZDLWENML-UHFFFAOYSA-N	431.836	1.973	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)N[C@@H]2CCCN(C(=O)Cc3ccccc3)C2)c1	802476780	GBMUNGGZACRVNE-GOSISDBHSA-N	440.500	1.882	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1ccc(OC(F)F)nc1	802573233	VVYZOYXMIQWKQS-UHFFFAOYSA-N	430.389	1.177	50	20	IDGD	
COC(=O)c1cn(CCNC(=O)/C(C#N)=C\c2cn(CCC#N)nc2-c2ccccc2)nn1	803643507	KMJGFPYGPXMDFO-ATVHPVEESA-N	444.455	1.565	50	20	IDGD	
CCc1nnc(NC(=O)[C@@H](C)[C@H](C)NC(=O)NNC(=O)COc2ccccc2O)s1	805880623	ICHHMJVRQVLDSA-QWRGUYRKSA-N	436.494	1.179	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)C1CN(C(=O)OC(C)(C)C)C1	806444876	HEZVKWOGJRHHFP-GFCCVEGCSA-N	425.507	1.354	50	20	IDGD	
COC(=O)c1cn(CCNC(=O)NNC(=O)c2ccc(-n3c(C)ccc3C)cc2)nn1	807250707	FCIJYWDAGHEFMF-UHFFFAOYSA-N	425.449	1.116	50	20	IDGD	
COC(=O)c1cn(CCNC(=O)NNC(=O)COc2ccccc2-c2ccccc2)nn1	807250928	OUURJEMSPXEYNQ-UHFFFAOYSA-N	438.444	1.141	50	20	IDGD	
COC[C@@]1(CNC(=O)NNC(=O)Cn2nc(C)cc2C)CCCN1C(=O)OC(C)(C)C	807553222	HAWZGTLJEWAXCS-FQEVSTJZSA-N	438.529	1.246	50	20	IDGD	
COCC1(CNC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)CCCCC1	811851767	QWYGUFGUNHUEEL-UHFFFAOYSA-N	425.555	1.829	50	20	IDGD	
O=C(NNC(=O)c1sccc1S(=O)(=O)N1CCc2ccccc2C1)c1ccc[nH]1	812201609	JBBZRGLNDZRFSB-UHFFFAOYSA-N	430.511	1.898	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)c1cnn(C)c1I	814737982	PSMJBGLTBLBWNR-QMMMGPOBSA-N	432.193	1.392	50	20	IDGD	
CCOC(=O)c1cc(COC)cc(NC(=O)C(=O)NNC(=O)c2cccc(OC)c2O)c1	815568442	HQRUSCFJYAWPEH-UHFFFAOYSA-N	445.428	1.124	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCc2nncn2C1)C(=O)Nc1ccccc1SC(F)(F)F	815692547	UGIHDXSZVIIEMM-VIFPVBQESA-N	428.396	1.239	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)c1c(I)cnn1C	816505185	PCWDQRKYPAKKCA-QMMMGPOBSA-N	448.648	1.907	50	20	IDGD	
COC(=O)c1cc(NNC(=O)CN2C(=O)N[C@](C)(c3ccc(OC)cc3)C2=O)ccc1C	816686728	CEGCTJNINIGBQM-JOCHJYFZSA-N	440.456	1.701	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)COc1ccc([N+](=O)[O-])c2cccnc12	817050722	AEXBBZVVZTVPRW-UHFFFAOYSA-N	445.457	1.915	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)c1nc(-c2cccs2)n(-c2cccc(F)c2)n1	818854154	XCVCTQHFYXXGKY-NSHDSACASA-N	449.489	1.331	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)[C@@H]1CC(=O)N(c2cc(C)ccc2OC)C1	869780082	NSYIKSQZHPVUHV-MRXNPFEDSA-N	441.484	1.982	50	20	IDGD	
CCn1nc(C(=O)NN=Cc2c(C)n(C)n(-c3ccccc3)c2=O)c2ccccc2c1=O	912794761	YYLNNTYRXNNDSC-UHFFFAOYSA-N	430.468	1.978	50	20	IDGD	
O=C(COC(=O)CSCc1cc(=O)n2ccsc2n1)NNC(=O)c1cccs1	913252986	UBGDEZODDPKFKB-UHFFFAOYSA-N	438.512	1.055	50	20	IDGD	
CCCCN(C(=O)COC(=O)/C(C#N)=C/c1cc(C#N)n(C)c1C)[C@H]1CCS(=O)(=O)C1	913286902	MWGVQRPXNSZXKK-GONKEYIRSA-N	446.529	1.471	50	20	IDGD	
CN1CCN([C@@H](CNC(=O)NNc2ccc(-n3cccn3)nn2)c2cccs2)CC1	915901023	CGMZKFHZBRBVPP-HNNXBMFYSA-N	427.538	1.339	50	20	IDGD	
CCC(CC)[C@H](CNC(=O)NNC(=O)C(=O)Nc1ccc(C)c(C)c1)N1CCOCC1	916256478	YCOQFZSUXDMDPM-IBGZPJMESA-N	433.553	1.709	50	20	IDGD	
Cc1nn([C@H]2CCS(=O)(=O)C2)c(Cl)c1C=NNC(=O)Cn1cnc2ccccc21	916273147	TYEUJECIIDTAEF-ZDUSSCGKSA-N	434.909	1.705	50	20	IDGD	
CC(=NNC(=O)[C@@H](C)CN1CCCCCC1)c1ccc(S(=O)(=O)NCC(=O)O)cc1	916366656	KJQOUJPXHWRGDA-HNNXBMFYSA-N	438.550	1.402	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)NCc2ccccc2CN2CCCC2=O)c1	916413441	DDNUODKTONZPLU-UHFFFAOYSA-N	426.473	1.970	50	20	IDGD	
CN1CCN(CCCNC(=O)NNC(=O)COc2ccccc2F)[C@H](c2ccccc2)C1	916484660	FCVWTKKYWMOGJY-FQEVSTJZSA-N	443.523	1.914	50	20	IDGD	
C[C@H]1CCCCN1CCCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	916504410	VUURVYNQUVIHML-INIZCTEOSA-N	439.582	1.536	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NCc2cc(Cl)c3c(c2)OCCO3)c2ccccc2c1=O	916628352	KHBAIQXVGRPNON-UHFFFAOYSA-N	443.847	1.502	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)NCCCN2CCN(C(=O)OC(C)(C)C)CC2)c1	916640615	GTBOTULZFSVXKH-UHFFFAOYSA-N	448.568	1.639	50	20	IDGD	
COc1ccc(CCN2C[C@H](C(=O)NNC(=O)c3ccc(Cl)nc3)CC2=O)cc1OC	917248770	DILBWONMXVOFSR-OAHLLOKOSA-N	446.891	1.604	50	20	IDGD	
O=C(CCCNS(=O)(=O)c1ccc2c(c1)OCCCO2)NNC(=O)CC(F)(F)F	918364930	UEPZSEKRAJFJOA-UHFFFAOYSA-N	439.412	1.006	50	20	IDGD	
Cc1ccc(-n2ncc(C(=O)NNC(=O)N[C@@H]3CCS(=O)(=O)C3)c2C(F)(F)F)cc1	919889959	XNEYKCCXNFHZHW-LLVKDONJSA-N	445.423	1.331	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCc2ccc(-n3ccnc3)cc2)c2ccccc2c1=O	921244380	BQRCNEQZJBWSIZ-UHFFFAOYSA-N	431.456	1.746	50	20	IDGD	
O=C(NNC(=O)c1n[nH]c2c1CCCC2)c1ccc2c(c1)C(=O)N(Cc1ccncc1)C2=O	1115823562	ISXQDGFDAVGKGE-UHFFFAOYSA-N	444.451	1.555	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(OCC(F)(F)F)nc1)c1cncn1-c1ccccc1	1320690426	FPKMTHVFJJLBEV-UHFFFAOYSA-N	441.391	1.832	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCBr)C2)c1cc(O)nc(O)c1	1777847755	NFOFYJUYSQFTGO-FZKQIMNGSA-N	442.310	1.405	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)CCN3Cc4ccccc4C3=O)C2)C1	1778184088	XRADAGYEBVFMFZ-XMSQKQJNSA-N	433.936	1.880	50	20	IDGD	
O=C(c1cccn2ccnc12)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1778580918	HRZRDSGEPNMEKV-GUYCJALGSA-N	425.258	1.468	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCN2CCOC2=O)C1	1778777491	PNNXLYRZTCYSGF-FOIQADDNSA-N	429.945	1.608	50	20	IDGD	
O=C(c1cnc(Cl)s1)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1779727800	HQCYZWIBDVOISC-TVQRCGJNSA-N	426.695	1.931	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2c(F)cncc2F)C1	1779843242	MSILCWYXCKCARR-KPAZRMRSSA-N	431.867	1.741	50	20	IDGD	
CCSc1cccnc1C(=O)N1CC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1	1780466288	YCJHXTSYEKYUAN-OAQYLSRUSA-N	449.577	1.010	50	20	IDGD	
O=C([C@H](F)Br)N1CC[C@]2(C1)CN(C(=O)[C@H]1COc3ccccc3O1)CCO2	1781326575	QHAOSCNGIBCBLA-VKJFTORMSA-N	443.269	1.347	50	20	IDGD	
O=C(CCc1cc(F)ccn1)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781326811	UWLLMOTYQOHMJI-RDJZCZTQSA-N	432.265	1.674	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ncn(C)n1)C2	1781901874	ZMRYHOVUBJNKQR-PBFPGSCMSA-N	428.331	1.116	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)CBr)C2	1782171948	HJTJDMHCAUKUQX-SZOQZIPDSA-N	439.778	1.785	50	20	IDGD	
Cn1nc2c(c1C(=O)N1CC[C@]3(C1)CN(C(=O)[C@H](F)Br)CCO3)CCC2	1782439781	MCFYGRUJJXYOLY-YOEHRIQHSA-N	429.290	1.043	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)c1ncc(Cl)cc1Cl	1783427359	VDMLCPQXGLQAAE-VMXABPDPSA-N	436.723	1.581	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccccc3OC(F)F)CCO2)C1	1783883894	MTYYVTDEIXXHQW-KUHUBIRLSA-N	432.851	1.985	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cccnc1C(C)(C)C)CCO2	1783933545	AAXCDRIZKGASDU-HSZRJFAPSA-N	445.564	1.196	50	20	IDGD	
CC(C)(C)OC(=O)C(C)(C)CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]2C1	1784092046	DPQIAIXJHWYTPN-VGWMRTNUSA-N	446.972	1.324	50	20	IDGD	
COc1ccc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](O)CCl)C[C@@H]32)c(Cl)c1	1785065051	AWOIBCUSOICGPT-PLYYQAHHSA-N	445.343	1.471	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC1(c2ccc(NC(=O)[C@H](O)c3ccco3)cc2)CCC1	1785859882	KXEMIJXDJBAEEP-HXUWFJFHSA-N	428.489	1.820	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1)c1ccc[n+]([O-])c1	1786999401	LWQOPSAYTZKCCS-UHFFFAOYSA-N	431.257	1.061	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CC3CCC3)C[C@@H]21	1787508188	NXWLMLMUOSCJLB-QECDCCOMSA-N	429.521	1.290	50	20	IDGD	
CN[C@H](CC(=O)Nc1ccc(C2(NC(=O)[C@H](C)Br)CCC2)cc1)C(=O)O	1788065395	QIZDOFUITMRMDB-SMDDNHRTSA-N	426.311	1.967	50	20	IDGD	
CC[S@](=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]21	1788492593	ZRXKTJNRQQTVSX-NWDBNUKMSA-N	427.394	1.361	50	20	IDGD	
C[C@@H](Cn1cncn1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]21	1788725983	DIQIUIYNDGVVRF-QHLBIMPKSA-N	432.352	1.130	50	20	IDGD	
CCc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]32)nn1C	1789067639	OEILPLUELADYQM-BCRCDCHUSA-N	431.364	1.812	50	20	IDGD	
CC(C)=CCCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21	1789815311	RDVQHSFCOQGJIO-SNRMKQJTSA-N	429.521	1.025	50	20	IDGD	
CN(C)c1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]3C2)cn1	1789870258	BFORUJMRMTUUGF-ZKNHNOBHSA-N	443.375	1.977	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cn3cnc4ccccc43)[C@H]2C1	1791179580	ZLKYCUIMKAQFPP-GGXPGOJBSA-N	434.924	1.270	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc4c(c3)CCC4)C[C@@H]21	1791252442	MENDOQAPFHXSQY-TUFLPTIASA-N	434.964	1.951	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(-c4ncc[nH]4)cc3)[C@H]2C1	1792036374	SAMDSZRZSLIEHC-VJANTYMQSA-N	446.935	1.924	50	20	IDGD	
C[C@H](NC(=O)c1ccccc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(C)(C)CCl	1792786831	XHOKNLBUCOLKSR-OWLYRPNTSA-N	435.952	1.660	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)ccc1F)C2	1792874639	VIZCIYMEGVNYEC-OVZMXSCWSA-N	429.286	1.766	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1CCN(c3ccccc3)CC1)C2)[C@H](O)CCl	1792975775	YCADAGQIITVIPU-PIKOESSRSA-N	435.952	1.092	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c(n1)NC(=O)CC3)C2	1793446684	ITFVKRROOSMTIE-BASYENTBSA-N	434.924	1.577	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C12CC(C(F)(F)F)(C1)C2	1793711238	IDLWFFXYGUAHTI-JQTNIVROSA-N	430.471	1.730	50	20	IDGD	
COc1cc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@](C)(Cl)CCl)C3)ccn1	1793901751	UBHAHDACVQHODQ-BAAGSCJXSA-N	444.359	1.849	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1ccc2c(c1)CCC2	1794100737	DUIJTAWTOUFTDA-ACDBMABISA-N	447.539	1.668	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2)c1cc(O)nc(Cl)c1	1794413311	SQUMZDPRUCFLHJ-QHBPRCKVSA-N	432.702	1.429	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccsc1	1794461971	DNACVILRVDJLFX-OAIVMCAHSA-N	425.514	1.712	50	20	IDGD	
Cn1ncnc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C(C#N)=C/c1ccc(F)cc1F)C2	1794913298	MKMWMHDOJNNNTC-RMWXTBGQSA-N	426.427	1.952	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1csc2c1CCCO2	1796094600	KWGRXFSYBDYUFM-RDBQEKCUSA-N	447.326	1.967	50	20	IDGD	
Cc1nc2cccc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3cccc(B(O)O)c3)c2s1	1796190993	MKOVOEKMWGPWQF-BCDXTJNWSA-N	449.341	1.850	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)c1ncccc1C(F)(F)F	1796191860	HMYSAYADFDJAJB-MUJYYYPQSA-N	447.222	1.346	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(C)c(C(=O)O)c(C)c1	1799874231	ULARHDVQXYZWNG-KYHPRHEASA-N	438.908	1.459	50	20	IDGD	
COC(OC)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C#N)=C/c1ccc(F)cc1F	1800332473	ONNNHGLQEZCQBE-INHOUBOVSA-N	435.427	1.080	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(O)c(F)c1	1800420306	KDHYGRZAMDEAOT-TWXBYECESA-N	441.463	1.917	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1nnc(C)s1)C2	1800640341	SIFYJTBFYPCNQQ-ZWUHOBOKSA-N	445.383	1.542	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cn3cc(F)ccc3n1)C2	1802337166	HSSFBFINAGCGDK-MUJYYYPQSA-N	430.484	1.098	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)C2CC(F)(F)C2)[C@H]1c1cccnc1	1802639551	DSQQYZAAHNGBLJ-DNVCBOLYSA-N	437.491	1.506	50	20	IDGD	
CN1N=C(C(=O)N2CC[C@@H](CNC(=O)C(C)(C)CCl)[C@@H]2c2cccnc2)CCC1=O	1802898768	ZHOYXMGCGMLFQT-YJBOKZPZSA-N	433.940	1.961	50	20	IDGD	
CC(C)(CCl)C(=O)NC[C@H]1CCN(C(=O)CCS(C)(=O)=O)[C@@H]1c1cccnc1	1802904027	HTSCTMQOJINNGL-NVXWUHKLSA-N	429.970	1.787	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1CCN(C(=O)c2ncnn2C)[C@@H]1c1cccnc1	1803007419	AHEAWHZDIHGNSK-VHDGCEQUSA-N	435.326	1.561	50	20	IDGD	
Nc1ccccc1/C=C/C(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]1c1cccnc1	1803138907	PJPCSMUSBBXNEI-NUAZOGNZSA-N	428.920	1.983	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC2(CCN(C(=O)CCS(C)(=O)=O)CC2)C1	1805389786	USZCZQLRRXWTQI-AWEZNQCLSA-N	437.400	1.683	50	20	IDGD	
Cc1ccsc1C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1805395758	DXUNNQYFFGRCGB-ICSRJNTNSA-N	449.341	1.765	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)c2ccno2)[C@H]1c1cccnc1	1805626482	YSSVZBBPWPGHJI-CPJWQURSSA-N	449.471	1.523	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@H](CNC(=O)CN2CCCC2=O)[C@@H]1c1cccnc1	1806924097	PWYJQHUJODYDIP-UWJYYQICSA-N	432.597	1.561	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)C(C)(C)F)[C@@H]1c1cccnc1	1806980583	JLCNNVFJMOCFFG-QRTPEGJISA-N	442.495	1.970	50	20	IDGD	
Cc1noc(N)c1C(=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@H]1c1cccnc1	1807108283	VTXVSAVKKGEXGJ-FPMFFAJLSA-N	440.273	1.970	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)[C@@H]2CCC(=O)N2C)[C@@H]1c1cccnc1	1808777010	AKBAMUHTQNIESK-QEWYBTABSA-N	437.338	1.492	50	20	IDGD	
O=C(c1cc(=O)n2[nH]cnc2n1)N1CCCC2(CCN(C(=O)C(Cl)Cl)CC2)C1	1809967647	UPUGHERJXKBWPZ-UHFFFAOYSA-N	427.292	1.066	50	20	IDGD	
Cc1oncc1C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1	1810299570	SMXTVCFYQACSGA-DNVCBOLYSA-N	449.471	1.010	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)c2cc(CO)on2)[C@@H]1c1cccnc1	1811590947	CWYVCFXZRKUUKM-RBOXIYTFSA-N	437.294	1.665	50	20	IDGD	
C=CCC(F)(F)C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1812667538	FLIFRCKQNMRFMW-HKUYNNGSSA-N	443.259	1.292	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)[C@H](C)n2ccnn2)[C@H]1c1cccnc1	1812868803	MRMVZUVQLYMKTF-SDADXPQNSA-N	435.326	1.724	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2ccncc2F)[C@H]1c1cccnc1	1813069831	DCYPFZIZWCUWNP-IERDGZPVSA-N	442.495	1.308	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)[C@H]2CCc3nc[nH]c3C2)[C@H]1c1cccnc1	1813327439	VQOLZAYPIWCPRX-DZIWXPPMSA-N	445.951	1.869	50	20	IDGD	
CN(C)C(=O)NCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@](C)(Cl)CCl)[nH]n1	1814564195	XBGMMWXVWWAWKP-SJCJKPOMSA-N	433.340	1.909	50	20	IDGD	
Cc1ccc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)c(C)c1	1815360627	KOGNDPKKVDKZLX-QGZVFWFLSA-N	449.341	1.979	50	20	IDGD	
COCc1oncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](Cl)COC)CC2	1817805370	YPDOIDZIKAIHNJ-GXSJLCMTSA-N	428.898	1.757	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc3n(n2)CCC3)n[nH]1	1819169764	NHLDBTPXELOVAR-QGZVFWFLSA-N	442.524	1.231	50	20	IDGD	
O=C1Nc2c(C(=O)Nc3nc4c(s3)C[C@H](NC(=O)[C@@H](O)CCl)CC4)cccc2C1=O	1819342241	WTUWPKBRGGBGHX-PELKAZGASA-N	448.888	1.103	50	20	IDGD	
COC[C@H](NC(C)=O)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCBr)[nH]n1	1819607709	KBZPQVNUZICWBI-KBPBESRZSA-N	444.330	1.338	50	20	IDGD	
C[C@H](NC(=O)c1cnccn1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](F)Cl)CC2	1820023197	SCVXONFPEQKIIF-MWODSPESSA-N	440.888	1.198	50	20	IDGD	
COc1ccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)nc1	1822416272	ZHGOLLIGOIWHFZ-QGZVFWFLSA-N	443.508	1.492	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCS(C)(=O)=O)n[nH]1	1822971947	CSMTYOWBOUKGEP-ZYHUDNBSSA-N	435.344	1.620	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H]3CCC(=O)N3C)sc2C1	1823053910	DMNJPWCAXLTTLF-NGZCFLSTSA-N	429.340	1.459	50	20	IDGD	
Cc1nnc(CCC(=O)N2CCC([C@@H]3CCCCN3C(=O)[C@@H](O)CCl)CC2)s1	1824180737	MQDFEDVEOFRYDZ-HOTGVXAUSA-N	428.986	1.999	50	20	IDGD	
O=C(/C=N/O[C@@H]1CCCCO1)N1CCC([C@H]2CCCCN2C(=O)[C@H](O)CCl)CC1	1824185729	GQPXJQZRXCCJGZ-GDDMNMOSSA-N	429.945	1.735	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)[C@H](C)NC(C)=O)sc2C1	1825226677	LHZKHDWRWYAHEL-LSJOCFKGSA-N	431.356	1.753	50	20	IDGD	
COc1nn(C)cc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1	1825734116	BOYKUYDGVKHAEQ-GOSISDBHSA-N	448.568	1.035	50	20	IDGD	
CCc1cc(C(=O)N[C@H]2CCc3nc(NC(=O)[C@H](Cl)COC)sc3C2)nn1C	1826003601	OECYWQWIDJXTCE-CMPLNLGQSA-N	425.942	1.919	50	20	IDGD	
Cc1ccc(C(=O)N[C@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)c(C)n1	1826087981	MQRVNMYIAOUGFT-AWEZNQCLSA-N	444.561	1.754	50	20	IDGD	
O=C([C@H](O)CCl)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2ON=C(c3ccccc3)O2)CC1	1828816295	FYOMKLULDNTKAA-SVMVAKDDSA-N	449.935	1.941	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)CN2C(=O)CNC2=O)CC1	1829099778	NHRWYRAWEGNGPW-MRXNPFEDSA-N	438.601	1.009	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccnc3Cl)CCO2)C1	1829500719	GAROCVRXUZWMNP-KBXCAEBGSA-N	432.304	1.059	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(O)nc2)CC1	1829724926	BSYPXMJDAFAXNN-SFHVURJKSA-N	431.537	1.394	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3=CCCS3)C2)C1	1830536080	XUZZEKCMMJLGEK-GUYCJALGSA-N	433.368	1.495	50	20	IDGD	
O=C(/C=C/c1ccc([N+](=O)[O-])o1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1830908661	RLEVVBSVKGCJFB-WESCVMAASA-N	431.804	1.192	50	20	IDGD	
C=CCC(F)(F)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1	1831443851	BPXCRUPJHCYUSQ-LJQANCHMSA-N	434.292	1.811	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)COc3ccccc3C#N)C2)C1	1831658745	HNUZOFOEEUYXBM-GCJKJVERSA-N	449.935	1.801	50	20	IDGD	
O=C([C@H](F)Br)N1CCC([C@H]2CCCCN2C(=O)CCn2cncn2)CC1	1832119363	ICDLITPEMGUFAZ-ZBFHGGJFSA-N	430.322	1.978	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(O)nc(Cl)c3)CCO2)C1	1833581390	RQHZKTOLPXXEHW-UGSOOPFHSA-N	432.304	1.528	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)CCc3cn[nH]c3)CC2)CC1	1833813619	BWEKGIIAIKBGIT-AWEZNQCLSA-N	440.386	1.697	50	20	IDGD	
Cc1nc(C)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)s1	1834079723	RXRQLRDSTCXPEX-APPDUMDISA-N	446.367	1.613	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cncc(C)c3)CCO2)C1	1834288113	LDYFQUVQZRLGTE-QFBILLFUSA-N	440.338	1.634	50	20	IDGD	
N[C@H](CC(=O)NC1CCN(C2CCN(C(=O)C(Cl)Cl)CC2)CC1)c1cccnc1	1834765301	XZTAXVVDHGVZPK-QGZVFWFLSA-N	442.391	1.847	50	20	IDGD	
COc1ccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)cc1	1835063608	FQHFTASTICZPQL-JOCHJYFZSA-N	438.952	1.959	50	20	IDGD	
COCCn1ccc(C(=O)N2CCC(N3CCC(NC(=O)[C@@H](F)Cl)CC3)CC2)n1	1835079680	NABDXHLDAMWRGD-QGZVFWFLSA-N	429.924	1.249	50	20	IDGD	
Cc1cc(CC(=O)NC2CCN(C3CCN(C(=O)[C@H](C)Br)CC3)CC2)n[nH]1	1835788756	ZTFIQFNQWBYDDI-AWEZNQCLSA-N	440.386	1.616	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](F)Cl)CC2)CC1)c1nn[nH]c1C(F)(F)F	1836176045	DLWGJSDITSBBNN-ZDUSSCGKSA-N	440.829	1.543	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC1CCN(C2CCN(C(=O)CSC(=N)N)CC2)CC1	1836398634	PKGVTPGWSYLLMU-KRWDZBQOSA-N	438.425	1.421	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccn4cncc34)CCO2)C1	1837107559	IQWHLTXUIHYNDD-DYESRHJHSA-N	434.924	1.812	50	20	IDGD	
CCc1nc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)co1	1838138774	IRCJUTBHJUMTFR-SJCJKPOMSA-N	430.299	1.090	50	20	IDGD	
C[C@H]1C[C@]1(C)C(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1	1838394798	YHYSRJOOVSJGLZ-WNSKOXEYSA-N	443.548	1.343	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(C#N)cc(OC)c3)CCO2)C1	1838584799	HCHJGOODLQZXQC-WIYYLYMNSA-N	435.908	1.654	50	20	IDGD	
C#CCCCCC(=O)N1CCC(OC2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1	1838789219	MDLXTCDKXARKSW-UHFFFAOYSA-N	434.581	1.552	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc([N+](=O)[O-])[nH]3)CCO2)C1	1838825352	QHKVGSRBXUEDAC-UGSOOPFHSA-N	428.873	1.400	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3cnc[nH]3)C2)C1	1839150060	AYZDCIYCVDMNER-MSOLQXFVSA-N	433.336	1.035	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCCn3cccc3)C2)C1	1839154949	DFDQALMGNNAUIF-WOJBJXKFSA-N	446.375	1.961	50	20	IDGD	
Cc1ccsc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839198042	RCHFCRAIQFNIEA-CZUORRHYSA-N	435.315	1.817	50	20	IDGD	
CC(C)=NO[C@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)CBr)C2)C1	1839222545	QVTOSTHPWZCBLU-RKVPGOIHSA-N	448.358	1.275	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(F)nc3F)C2)C1	1840029866	SWCLGZPRXUVRQS-DIFFPNOSSA-N	448.264	1.213	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(F)c[nH]3)CCO2)C1	1840068343	ZBRFXWOLMHAZMH-CXAGYDPISA-N	432.290	1.397	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3nc(C(C)C)cs3)C2)C1	1840150245	IICYRHHIZPGDFX-IFXJQAMLSA-N	445.969	1.590	50	20	IDGD	
C[C@@H](C(=O)N1CCOC[C@@]2(CN(C(=O)C(Cl)Cl)CCO2)C1)n1cccc1C=O	1840188018	JZWYQPVQDSITFB-UGSOOPFHSA-N	432.304	1.122	50	20	IDGD	
CC[C@@H](C(=O)N1CCCC12CN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2)N(CC)CC	1841673522	FLIMOZIRWYMVSX-MRSJDWDVSA-N	430.553	1.444	50	20	IDGD	
CN1CCN(CC(=O)N2CCCC23CN(C(=O)/C(C#N)=C/c2ccc(F)cc2F)C3)CC1	1843915497	BHFOOUIXESNTJX-WOJGMQOQSA-N	443.498	1.323	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)c2ccncc2O)C1	1844420093	OGNYBDZGRIBLOX-UHFFFAOYSA-N	440.412	1.752	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@H]1CC(=O)N(Cc3cccs3)C1)C2	1846360986	RBTWFZZYFJOWKD-HOCLYGCPSA-N	439.965	1.554	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CNC(=O)OC(C)(C)C	1847494366	HFAZFXBFTHKXPO-XDQVBPFNSA-N	448.358	1.105	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](CCO)NC(=O)OC(C)(C)C	1847639140	NQQHTDMVJOPNRV-VGWMRTNUSA-N	431.961	1.871	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cncc(S(C)(=O)=O)c1	1848329708	QNOUIHIUJMXSND-ZQIUZPCESA-N	434.345	1.537	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)Nc1cccc([N+](=O)[O-])c1	24238306	JTZKBYVOPUMEBM-UHFFFAOYSA-N	433.446	1.846	50	20	IDGD	
O=C(COC(=O)c1cc(F)c(F)cc1Cl)NNC(=O)[C@H]1COc2ccccc2O1	104556373	KTIYLAGZZNZYGL-OAHLLOKOSA-N	426.759	1.762	50	20	IDGD	
COc1ccc(CCC(=O)N2CCCN(CC(=O)NNC(=O)c3ccccc3)CC2)cc1	725802598	SYLSRNKNFCEQTB-UHFFFAOYSA-N	438.528	1.623	50	20	IDGD	
COCCCNC(=S)N(C)NC(=O)c1ccc(Sc2nncn2C)c([N+](=O)[O-])c1	726076503	UTGCDAAQOHWZPJ-UHFFFAOYSA-N	439.523	1.362	50	20	IDGD	
O=C(NNc1nc(-c2ccncc2)no1)[C@H]1CCCCN1S(=O)(=O)c1ccccc1	726377318	VQLNHTQBTFYMBL-MRXNPFEDSA-N	428.474	1.818	50	20	IDGD	
O=C(CN1CCN(Cc2ccc3c(c2)OCCO3)CC1)NNC(=O)c1ccc(F)cc1	727239046	XGPFHZMIYYZXBJ-UHFFFAOYSA-N	428.464	1.176	50	20	IDGD	
COc1cc(C(=O)NCC(=O)NNc2nc(-c3cccnc3)no2)ccc1OC(F)F	728078951	CSSCRVFKHXICIT-UHFFFAOYSA-N	434.359	1.615	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)[C@H]2CCCN2S(=O)(=O)c2cccs2)c1	728208334	RCUJMHAOHOBJMR-OAHLLOKOSA-N	438.531	1.169	50	20	IDGD	
O=C(NNC(=O)N1CCN(C(=O)CN2CCCC2)CC1)c1ccc(Br)s1	728715312	WCZUEVAWLDCAHS-UHFFFAOYSA-N	444.355	1.105	50	20	IDGD	
O=C(NCc1ccccc1N1CCOCC1)NNC(=O)C1CCN(c2ncccn2)CC1	729050297	GFWULNDDZOVDQO-UHFFFAOYSA-N	439.520	1.060	50	20	IDGD	
CC(C)N1CCC[C@@H](CNC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)C1	729619162	OHWZLYAJDGTYOB-FQEVSTJZSA-N	430.597	1.650	50	20	IDGD	
CCOc1ccc(NS(=O)(=O)c2ccc(C(=O)NNC(=O)Cc3cc[nH]n3)cc2)cc1	730091624	PWKQPLIXDHXPJG-UHFFFAOYSA-N	443.485	1.613	50	20	IDGD	
CCOC(=O)C1=NN(c2ccccc2)[C@H](C(=O)NNc2ccccc2S(C)(=O)=O)C1	732302608	KJYYNJCKISDWHB-KRWDZBQOSA-N	430.486	1.731	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)N[C@H]2CCN(CC(F)(F)F)C2=O)cc1OC	732589542	CYKNGQBTVXJTSD-ZDUSSCGKSA-N	446.426	1.981	50	20	IDGD	
CCc1cccc2c1NC(=O)C2=NNC(=O)C(=O)NN=C1C(=O)Nc2c(CC)cccc21	733078055	SAYOJXWEEOYEAP-UHFFFAOYSA-N	432.440	1.056	50	20	IDGD	
Cn1c(NNC(=O)[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])o2)nc2ccccc2c1=O	733263349	XMWKCYKAOHSVIU-ZDUSSCGKSA-N	426.389	1.183	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@H](OC)C(F)(F)F)c1	733662065	XZGOVXJDRNZLGE-ZDUSSCGKSA-N	440.444	1.238	50	20	IDGD	
O=C(NNc1cnccn1)[C@H]1CCCN(S(=O)(=O)c2ccc(Br)cc2)C1	734245547	OBGJNSWGWMEEOZ-LBPRGKRZSA-N	440.323	1.783	50	20	IDGD	
CC(C)[C@H](C(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1)N1CCCC1=O	734825008	QFTCUPHJHVPKST-MRXNPFEDSA-N	425.530	1.363	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2nc(Cl)ccc2Cl)CC1	735117975	LEVFTXRQURLXBO-UHFFFAOYSA-N	445.332	1.476	50	20	IDGD	
O=C(NNc1c(F)cccc1F)N[C@H]1CCCN(c2cc(N3CCOCC3)ncn2)C1	735757780	JKCRKDIFIVOQJV-AWEZNQCLSA-N	433.463	1.887	50	20	IDGD	
C[C@H]1C[C@@H](C)CN(S(=O)(=O)c2cccc(C(=O)NNc3ccnc(N(C)C)n3)c2)C1	740112361	FVRPQHSKKGWHLN-GASCZTMLSA-N	432.550	1.966	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2ccc(-n3cncn3)c(C)c2)c2ccccc2c1=O	742035084	YBLFGFSUTWCVPZ-UHFFFAOYSA-N	431.456	1.770	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)c2ccc(F)c(S(=O)(=O)Cc3ncon3)c2)c1	742240550	PPYYLIWXYIXIQA-UHFFFAOYSA-N	447.448	1.323	50	20	IDGD	
CC(C)Oc1ccc(NC(=S)NNC(=O)CCN2C(=O)[C@H]3[C@H]4CC[C@@H](O4)[C@@H]3C2=O)cc1	743820064	FXOUATXNTZGGRP-LMSBXDPUSA-N	446.529	1.344	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(C)=O)cn1	743823660	TXOCTJCPVZCVGJ-QGZVFWFLSA-N	426.502	1.637	50	20	IDGD	
CCC(=O)Nc1cccc(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)c1	744619120	IRJFRJSVNYOXAG-UHFFFAOYSA-N	432.502	1.813	50	20	IDGD	
C[C@H](CC(=O)c1ccccc1F)C(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	745489274	YJCRRXCIJMSIRG-GFCCVEGCSA-N	431.376	1.947	50	20	IDGD	
COc1cc(/C=C/C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc(OC)c1O	745510265	DRQOYVHOCFYWMO-FPYGCLRLSA-N	445.384	1.335	50	20	IDGD	
Cc1cc(=O)n(CC(=O)NC(C)C)c(C)c1C(=O)NNC(=O)Cn1ccc2ccccc21	746225098	TWODSUUVLWBULT-UHFFFAOYSA-N	437.500	1.406	50	20	IDGD	
COc1cc(C)nc(NNC(=O)c2cccc(S(=O)(=O)N3C[C@@H](C)O[C@H](C)C3)c2)n1	746622998	IBCOXWJMKGQQMH-ZIAGYGMSSA-N	435.506	1.348	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2ccc(C)c(C(=O)NNc3nccn(C)c3=O)c2)cc1	747938181	RARBAVURHUSPLG-UHFFFAOYSA-N	427.486	1.955	50	20	IDGD	
Cn1cc(S(=O)(=O)N2CCOCC2)cc1C(=O)NNc1ccccc1Br	748070445	PLGQMUFGFZKAFE-UHFFFAOYSA-N	443.323	1.565	50	20	IDGD	
C[C@@]1(c2ccc(C(=O)NNC(=O)CCSc3ccc(F)cc3)cc2)NC(=O)NC1=O	748517350	WBGVTVSAAVCDSX-FQEVSTJZSA-N	430.461	1.824	50	20	IDGD	
CCN=c1nc(NCC)n2c(SCC(=O)NNc3cccc4c3CCCC4)n[nH]c2n1	748577751	NYESNVXSMWGDOE-UHFFFAOYSA-N	441.565	1.919	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)N(C)CC(=O)NNc2cccc3cnccc23)cc1	748773198	BVKIFDBMZFKXRK-UHFFFAOYSA-N	427.486	1.957	50	20	IDGD	
CC(C)S(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)c2cccc(C#N)c2)cc1F	749773129	WWCVCCBAGHEUOA-UHFFFAOYSA-N	440.478	1.471	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)Cc1csc(NC(=O)c2ccccc2)n1	751209397	PJLNLGHFLQQHFO-UHFFFAOYSA-N	443.510	1.577	50	20	IDGD	
CCn1c(NNC(=O)CN2C(=O)c3cccc([N+](=O)[O-])c3C2=O)nc2ccccc2c1=O	751883568	IQJOMCNJKUYKMC-UHFFFAOYSA-N	436.384	1.064	50	20	IDGD	
CC(C)C[C@H](CCO)CNC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	754373658	FSUNHKHXGQYBMZ-INIZCTEOSA-N	440.566	1.460	50	20	IDGD	
CNS(=O)(=O)c1ccc(Sc2ccccc2C(=O)NNC(=O)Cc2cc[nH]n2)cc1	755287019	TYGPHPKWBCUENZ-UHFFFAOYSA-N	445.526	1.473	50	20	IDGD	
O=C(CCSc1ccc(F)cc1)NNC(=O)NCCN1C(=O)[C@@H]2[C@@H](C1=O)[C@H]1C=C[C@H]2C1	756101984	ZTKKQQGTLQRXPF-LUVWLHFXSA-N	446.504	1.445	50	20	IDGD	
COc1c(F)cc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1F	756149467	YRPYQPDQVBRHEB-UHFFFAOYSA-N	428.417	1.690	50	20	IDGD	
COC(=O)Cn1ccc(NC(=O)NNC(=O)[C@H](C)Oc2cccc(Br)c2)n1	756648308	VSPHCRFQGSMQPO-JTQLQIEISA-N	440.254	1.439	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)c2cccnc2I)c1	757737221	UCJXVLXAXUDALQ-UHFFFAOYSA-N	426.214	1.568	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1cnc(OCc2ccccc2)cn1	757920237	CHHOGKSMCVKQSU-UHFFFAOYSA-N	433.472	1.523	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1cc(NCc2ccccc2)nc2ccccc12	758051118	FEBFTBFKICWVCD-AWEZNQCLSA-N	441.513	1.546	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)Nc1cnn(C2CCN(C(=O)OC(C)(C)C)CC2)c1	758198428	VYCHTUVIACHXIJ-UHFFFAOYSA-N	432.485	1.953	50	20	IDGD	
COc1cc(OC)cc(N2CCCN(CC(=O)NNC(=O)Cc3nc(C)cs3)CC2)c1	758742582	HBEISVRCSFHRQL-UHFFFAOYSA-N	447.561	1.371	50	20	IDGD	
Cc1ccc(OCc2nc(CC(=O)NNC(=O)C(=O)Nc3ccccn3)cs2)cc1	758831425	GESZPRCCFQOMAF-UHFFFAOYSA-N	425.470	1.754	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)C1=Cc2cc(F)ccc2OC1	761191593	FGHCXBWAADNCBC-UHFFFAOYSA-N	445.472	1.847	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)c2nccnc2NC(=O)C(C)(C)C)n[nH]1	763154599	PKWCKMKVRKEKSI-UHFFFAOYSA-N	437.460	1.935	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNS(=O)(=O)c1ccc2c(c1)OCCCO2	763439265	KFOIOCXDTOCVOS-UHFFFAOYSA-N	429.495	1.462	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)NC[C@]1(N2CCOCC2)CCSC1	763476769	OTQWGUZQDZOGDW-GOSISDBHSA-N	426.564	1.023	50	20	IDGD	
CCCNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2ccccc2Br)c1	763482560	HHAOVBBUSVEDER-UHFFFAOYSA-N	447.289	1.989	50	20	IDGD	
Cc1cc(Oc2ncccn2)ccc1NC(=O)C(=O)NNC(=O)c1ccc2c(c1)OCO2	763552204	XTOATUPDDNEEKJ-UHFFFAOYSA-N	435.396	1.706	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)ccc1Br	763559862	XKYHFTXGQHLVST-UHFFFAOYSA-N	436.218	1.586	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)Nc1cccc(N2CCCCC2=O)c1	763574496	ZYGHLXJVFOSLSG-GOSISDBHSA-N	438.440	1.129	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1ccc(Sc2nccn2C)cc1	763629645	PYTYPEDZWDUIBO-UHFFFAOYSA-N	449.496	1.927	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1ccc(N2CCO[C@H](C)C2)cc1	763629659	QFUPHBBYFFDKBR-CQSZACIVSA-N	436.472	1.268	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2ccc(N3CCOC3=O)cc2)c1	763665554	JTYIVFVFKWTZKX-UHFFFAOYSA-N	426.429	1.425	50	20	IDGD	
O=C(COc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1ccc(NC(=O)C2CC2)cc1	763684246	HUHCEMYCCRCMNC-UHFFFAOYSA-N	430.848	1.853	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(Cc2ccncc2)cc1	763809668	YZQHCVFXPQGSCV-UHFFFAOYSA-N	429.436	1.709	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2nc3c(s2)COCC3)cc1	763862216	VWVQTFMFORENBU-LLVKDONJSA-N	434.474	1.168	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1cccnc1OCC(F)F	763867492	VSLIZQGCRAOCNE-SNVBAGLBSA-N	426.351	1.418	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccccc2-n2nccc2C)cc1	763871442	FRCPKZSWNUEKSP-INIZCTEOSA-N	449.467	1.937	50	20	IDGD	
CNC(=O)Cn1nc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCCCCC3)cc1C	763912570	XNMNBTAIITVNBG-UHFFFAOYSA-N	446.533	1.058	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3ccc4c(c3)oc(=O)n4C)cc2C1	763938124	AMYAJPRSFCWRTH-SNVBAGLBSA-N	428.470	1.718	50	20	IDGD	
CNC(=O)c1ccc(C)c(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CC[C@H](C)C3)c1	763941974	ZTVNHRRVLHXUNO-NSHDSACASA-N	428.514	1.941	50	20	IDGD	
CCOC(=O)c1ccsc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccccc2)on1	764004091	QSDGWPJWZALDMC-UHFFFAOYSA-N	428.426	1.980	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)NC(=O)[C@H](C)O2	764012484	QXWJCYFLKKYDOH-VIFPVBQESA-N	432.820	1.468	50	20	IDGD	
O=C(CCc1ccco1)NNC(=O)C(=O)Nc1ccc(Cl)cc1C(=O)N1CCCC1	764169122	KPVSIQANVZWNIK-UHFFFAOYSA-N	432.864	1.888	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)CCc3ccccc3)cn2)C[C@H](C)O1	764193363	VHVWNKUGCCVHMH-HOTGVXAUSA-N	425.489	1.414	50	20	IDGD	
CC(C)CCNS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)CCC(C)C)cc1	764203814	XOGBVLCSUTWWBG-UHFFFAOYSA-N	426.539	1.533	50	20	IDGD	
COC(=O)[C@H](C)Cc1ccc(NC(=O)C(=O)NNC(=O)c2cccc3ncccc23)cc1	764257708	MBGJSZNBHASODT-CQSZACIVSA-N	434.452	1.986	50	20	IDGD	
O=C(Cc1ccccn1)NNC(=O)C(=O)Nc1cccc(C[S@@](=O)C2CCCCC2)c1	764266721	JROBBPDCIFSCBL-WJOKGBTCSA-N	442.541	1.992	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(NC(=O)[C@@H](C)OC)c2)c(OC)c1	764283773	FYYKXCBKIMPOIX-GFCCVEGCSA-N	444.444	1.077	50	20	IDGD	
COC(=O)c1c(NC(=O)C(=O)NNC(=O)Cc2ccncc2)sc2c1CCCCC2	764354051	LDDVQHVOUMAKHE-UHFFFAOYSA-N	430.486	1.527	50	20	IDGD	
COc1ccc(NC(=O)c2cccc(NC(=O)C(=O)NNC(=O)c3ccc(C)o3)c2)cn1	764367572	JMLMKMDEGDZUNV-UHFFFAOYSA-N	437.412	1.644	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1cc(Br)cc(OC(C)C)c1	764398090	CQPPIPFRPUJUQF-NSHDSACASA-N	446.298	1.374	50	20	IDGD	
COc1cccc(COc2cccc(NC(=O)C(=O)NNC(=O)[C@@H]3COCCO3)c2C)c1	764430667	YOOJXLBBDQJOSQ-IBGZPJMESA-N	443.456	1.084	50	20	IDGD	
CC(=O)Nc1cc(S(=O)(=O)NNC(=O)c2cccc(Br)c2)ccc1O	765097538	ITBNDCIULDNRID-UHFFFAOYSA-N	428.264	1.736	50	20	IDGD	
CC(=O)N/C(=C\c1ccccc1)C(=O)NNC(=O)CN1CCN(Cc2ccc(C)cc2)CC1	765748718	PRHUCSJTRCYMTG-KQWNVCNZSA-N	449.555	1.437	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3ccccc3Cn3cncn3)CC2)cc1	765749218	VIUCRSXJZPBNQR-UHFFFAOYSA-N	447.543	1.214	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)CCc3c(C)nc(C)nc3O)CC2)cc1	765756276	SOIUEOOFOOMHCL-UHFFFAOYSA-N	440.548	1.005	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)N[C@@H]1CCN(CCCc2ccccc2)C1=O	765815700	BQIAKQYLCOLPFG-GOSISDBHSA-N	430.530	1.950	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@H](C)NC(=O)OC(C)(C)C)CC2)cc1	766650585	WYUNSCHYMBCZGW-KRWDZBQOSA-N	433.553	1.173	50	20	IDGD	
COCc1c(C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cnn1-c1ccccc1	767072636	ONJUXQXIYWDLHW-UHFFFAOYSA-N	428.470	1.497	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)[C@@H](C)S(=O)(=O)c1ccc(F)cc1	767290381	GXYBZDCNDKHWBN-CQSZACIVSA-N	436.461	1.230	50	20	IDGD	
CC(C)(C)[C@H](Br)C(=O)NC1CCN(S(=O)(=O)C2CCOCC2)CC1	768167853	XJCHZHUQYAYNBM-CQSZACIVSA-N	425.389	1.885	50	20	IDGD	
CCC1CCC2(CC1)NC(=O)N(CC(=O)NNC(=O)c1cc(-c3cccs3)[nH]n1)C2=O	768263659	XUTJHDZWLCGVDE-UHFFFAOYSA-N	444.517	1.790	50	20	IDGD	
Cc1cccc(F)c1NNC(=O)C(=O)Nc1ccc(NC(=O)CN2CCOCC2)cc1	770819178	OYLFCOLSPGQXQD-UHFFFAOYSA-N	429.452	1.487	50	20	IDGD	
COc1ccc([C@H](OC)[C@@H](C)NC(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1	771904472	KNTXDHPKXZAWGW-CXAGYDPISA-N	449.533	1.709	50	20	IDGD	
COc1cc2cc(C(=O)NNC(=O)C(=O)NCc3ccc(Cl)cc3)[nH]c2cc1OC	772907557	XNAUDZYWQSYYII-UHFFFAOYSA-N	430.848	1.916	50	20	IDGD	
CC(C)(C)c1sc(C(=O)O)cc1S(=O)(=O)NNC(=O)CNC(=O)c1cccs1	773248428	AIHSZPCTATTYDU-UHFFFAOYSA-N	445.544	1.545	50	20	IDGD	
Cc1ccc(-n2nc(C)cc2NC(=O)C(=O)NNC(=O)c2cccc3ccccc23)nn1	773500663	VJQNMUCPSJFZJW-UHFFFAOYSA-N	429.440	1.832	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cc(-c3cc(F)cc(F)c3)nn2C)cc1	773525160	NKAHBMOKDSJZSX-UHFFFAOYSA-N	443.410	1.839	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)NC[C@@H]2CC[C@H](C(=O)N(C)C)O2)c(C)n1C[C@@H]1CCCO1	775213558	VKLNAOOHMQIJRZ-RIMRZPJMSA-N	428.533	1.943	50	20	IDGD	
CN(NC(=O)c1ccc(-c2ncn(C)n2)cc1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776201811	MCRIYYJGMAFCMM-UHFFFAOYSA-N	443.508	1.731	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NC(=O)NNc2cccc(S(C)(=O)=O)c2)cc1	776466864	YDTQOFPDMGPAOJ-UHFFFAOYSA-N	426.520	1.925	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)Cc2ccc(F)cc2Br)c2ccccc2c1=O	777086390	PGPPFILABNOICP-UHFFFAOYSA-N	433.237	1.839	50	20	IDGD	
COc1ccc2nc(NNC(=O)[C@@H]3CC(=O)N([C@@H]4CCS(=O)(=O)C4)C3)c(C)cc2c1	778482363	XQSPWQVERNTCQB-HUUCEWRRSA-N	432.502	1.031	50	20	IDGD	
O=C(NCC1CC1)NNC(=O)c1cc(I)ccc1N1CCOCC1	778590970	WZCWLXQUMQZAJV-UHFFFAOYSA-N	444.273	1.482	50	20	IDGD	
Cc1nc(O)c(C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)cc1Br	778838035	VEEMSDBKZQUFTE-UHFFFAOYSA-N	432.275	1.327	50	20	IDGD	
Nc1cccc([N+](=O)[O-])c1C(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	779533309	IRUZHFYUBHINMR-UHFFFAOYSA-N	446.895	1.409	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)[C@H]2CCCN(S(=O)(=O)c3c(C)n[nH]c3C)C2)c1	780800551	LNLKIOXJNFJYEH-HNNXBMFYSA-N	435.506	1.357	50	20	IDGD	
CCNC(=O)N(C)NS(=O)(=O)c1ccc(OS(=O)(=O)c2ccc(C)cc2)cc1	782477357	OQDPEHDWUVPHDC-UHFFFAOYSA-N	427.504	1.617	50	20	IDGD	
CSc1ccccc1NC(=O)C(=O)NNC(=O)c1sc(N2CCOCC2)nc1C	782897226	MJWIORZJNOWMJE-UHFFFAOYSA-N	435.531	1.410	50	20	IDGD	
Cn1nc2c(c1NC(=O)C(=O)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1)CCC2	783408702	MPEHLGHXWGLSST-UHFFFAOYSA-N	431.396	1.284	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1ccc(OCC(F)(F)F)cc1	784005114	OZGIOFBEUADLHP-UHFFFAOYSA-N	444.391	1.205	50	20	IDGD	
O=C(NNc1ccc(Br)cn1)C(=O)Nc1cc(F)cc(N2CCOCC2)c1	784339853	MLKFIKHTDNJXAB-UHFFFAOYSA-N	438.257	1.902	50	20	IDGD	
CS(=O)(=O)CCc1ccc(NC(=O)C(=O)NNc2ccnc(Br)c2)cc1	784828892	PNRKASFRNXWVQN-UHFFFAOYSA-N	441.307	1.513	50	20	IDGD	
CN(C)CCCOc1ccc(NC(=O)C(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)cc1	785022912	BAFHMBIPRCHZGP-UHFFFAOYSA-N	445.432	1.031	50	20	IDGD	
C[C@@H](c1ccccc1)n1ccc(NC(=O)C(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)n1	785023443	IRYVXBRCBJKMED-LBPRGKRZSA-N	438.400	1.506	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)c2ncccc12	785060866	QCLMCPZHAHNFRO-UHFFFAOYSA-N	432.440	1.610	50	20	IDGD	
COc1ccc2nc(NNC(=O)C(=O)Nc3ccc(-n4cnnn4)c(C)c3)c(C)cc2c1	785164053	MOXATZQXAKVEDW-UHFFFAOYSA-N	432.444	1.918	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)[C@H](O)Cc2cccc(C(F)(F)F)c2)cc1	785739616	OPIATBFYCDESJG-MRXNPFEDSA-N	435.358	1.485	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2O1)C(=O)Nc1cc(Br)c(F)cc1F	786417297	OTCSIPZWYIDBHS-CQSZACIVSA-N	440.200	1.817	50	20	IDGD	
CS(=O)(=O)Cc1nc2ccccc2n1CC(=O)NNC(=O)NCc1ccc(Cl)cc1	787433926	LZCJHENMEJXNIT-UHFFFAOYSA-N	449.920	1.765	50	20	IDGD	
CC[C@@H]1CCc2nc(NC(=O)C(=O)NNC(=O)COc3ccccc3C#N)sc2C1	789731300	AVXVNBFOENXOTQ-GFCCVEGCSA-N	427.486	1.695	50	20	IDGD	
Cc1ccc(CN2CC[C@H](NC(=O)NNC(=O)c3nn(-c4ccccc4)cc3O)C2=O)cc1	790697574	QQQSMOVVFDPCNH-SFHVURJKSA-N	448.483	1.631	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@H](C(=O)NNC(=O)c2cccc(Cl)c2)[C@H](C)O)cc1	792120455	RTZLAVSLWJZCQN-LRDDRELGSA-N	425.894	1.137	50	20	IDGD	
CC(C)Cc1ncc(NC(=O)C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)cn1	792367097	IIFGPBGXXOBJMC-UHFFFAOYSA-N	432.431	1.927	50	20	IDGD	
C[C@H](CCc1ccc(I)cc1)NC(=O)NNC(=O)c1cnn(C)c1	793233928	WMVUNBXIDHEJBF-LLVKDONJSA-N	441.273	1.990	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)[C@@H]2CCCCN2S(=O)(=O)c2ccc([N+](=O)[O-])cc2)n1	794078070	VFZPVYMIABLLHS-KRWDZBQOSA-N	447.473	1.303	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNC(=O)C(=O)Nc1ccnn1C1CCCCC1	797369107	NYEHPHIDDPQROO-UHFFFAOYSA-N	442.476	1.401	50	20	IDGD	
Cc1ccc([C@@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)cc1	797703445	WPCIEKUMBMEEHR-HUUCEWRRSA-N	425.507	1.143	50	20	IDGD	
CC(=O)N[C@@](C)(C(=O)NNc1cccc([N+](=O)[O-])c1C)c1ccc(S(C)(=O)=O)cc1	797746285	TUBCBYCJCKDOIW-LJQANCHMSA-N	434.474	1.801	50	20	IDGD	
Cc1ccc(-c2ccnn2C)cc1NC(=O)C(=O)NNC(=O)COc1ccc(F)cc1	799259357	ZIBGWSKRHMHBEO-UHFFFAOYSA-N	425.420	1.700	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@H]2CCCC23CCOCC3)cc1	800741604	YAVQZNABCMXNTQ-KRWDZBQOSA-N	438.550	1.295	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2[C@@H](C)OC(C)(C)N2C(=O)OC(C)(C)C)cc1	801106332	UUDDHLGINCHDBS-UKRRQHHQSA-N	434.493	1.841	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H]1CCC[C@H]1C(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	802067681	KABIPEXKVBMGBM-CABCVRRESA-N	440.522	1.936	50	20	IDGD	
CC1(C)CCC[C@@]2(C1)NC(=O)N(CC(=O)NNC(=O)Nc1ccc3c(c1)OCO3)C2=O	802096765	DUHINDGXLCNIDT-FQEVSTJZSA-N	431.449	1.459	50	20	IDGD	
O=C(NCc1c(F)cccc1N1CCCC1)NNC(=O)c1csc(N2CCOCC2)n1	804867951	PPMNOMHGLOBUET-UHFFFAOYSA-N	448.524	1.863	50	20	IDGD	
NS(=O)(=O)c1ccc(Br)c(C(=O)NNc2nccnc2C2CCC2)c1	805461493	FMWBZVISUVIERZ-UHFFFAOYSA-N	426.296	1.911	50	20	IDGD	
CNS(=O)(=O)c1cc(NC(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)ccc1F	806544412	DTJHYKMBTWDSRZ-CYBMUJFWSA-N	438.481	1.971	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2nn(CCC(C)C)c(=O)c3ccccc23)sn1	806974673	RDEFWCMRNMHKJT-UHFFFAOYSA-N	442.501	1.607	50	20	IDGD	
CNS(=O)(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cccc3ccccc23)ccc1F	806977144	XNLFDMNZOIULPE-UHFFFAOYSA-N	444.444	1.287	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(NC(=O)C(=O)NNc2ncccc2F)ccc1Cl	807300404	LSYMSJAIEUZBJN-UHFFFAOYSA-N	443.888	1.986	50	20	IDGD	
Cc1c(NNC(=O)C(=O)Nc2ccc(C(N)=O)cc2OCC(F)F)cccc1[N+](=O)[O-]	810394937	JHGSKLCFXNSRPS-UHFFFAOYSA-N	437.359	1.728	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)COc3cc(F)cc(F)c3)CC2)cc1	810593906	MSOOOEIIJDYGMX-UHFFFAOYSA-N	432.471	1.617	50	20	IDGD	
COc1ccc(CNC(=O)NNC(=O)Cc2ccc3ccccc3c2)cc1S(N)(=O)=O	812431630	NLCPNVSAKFACDZ-UHFFFAOYSA-N	442.497	1.569	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NCC2(COC)CCOCC2)c2ccccc2c1=O	813771771	GILJAHRKPPXJBX-UHFFFAOYSA-N	445.520	1.584	50	20	IDGD	
Cn1c(=O)c(CNC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)cc2ccccc21	813835352	OZWUJAPNODESGL-UHFFFAOYSA-N	443.485	1.478	50	20	IDGD	
Cc1cc(CNC(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)nc(N2CCCC2)n1	813856570	JKWNOGJLGDHUGU-UHFFFAOYSA-N	425.493	1.471	50	20	IDGD	
Cc1ccc(NC(=O)NNc2ccccc2S(=O)(=O)N(C)C)c(OCC(=O)N(C)C)c1	814621234	UUDBZKVLFFCIQM-UHFFFAOYSA-N	449.533	1.861	50	20	IDGD	
CC(C)(C)c1ncc(C=NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cn1	814689151	VTWRZERSUFAZJY-UHFFFAOYSA-N	431.518	1.559	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(Br)c(C#N)c2)cc1	815566364	RLMAIRZIFZYWPA-UHFFFAOYSA-N	431.246	1.794	50	20	IDGD	
CS(=O)(=O)c1ccc(-c2csc(CC(=O)NNc3cc(Cl)nc(N)n3)n2)cc1	816046493	BKTJKZBDBULRBT-UHFFFAOYSA-N	438.922	1.925	50	20	IDGD	
Cc1ccc(C(=O)NNc2ccccc2S(=O)(=O)N(C)C)cc1NS(C)(=O)=O	817053927	LXRAXAYVEOFHIP-UHFFFAOYSA-N	426.520	1.374	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@H]2C(=O)NNc2nc(C)cc(C)n2)cc1	877465393	SVEXIFUSUCBVFT-SFHVURJKSA-N	431.518	1.983	50	20	IDGD	
CCCCn1c(C)cc(/C=C(\C#N)C(=O)N(CC)CC(=O)N[C@@H]2CCS(=O)(=O)C2)c1C	912663452	FHRMXEHTOWMOBV-QDDTUJKSSA-N	448.589	1.964	50	20	IDGD	
COCCNS(=O)(=O)c1cccc(C(=O)NNC(=O)COc2cc(C)cc(C)c2)c1	913055455	YVYXEMPMMXIHAH-UHFFFAOYSA-N	435.502	1.068	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCCc1ccc2c(c1)OCO2	913635730	FEFHSBFAJCJYIU-UHFFFAOYSA-N	433.490	1.204	50	20	IDGD	
Cc1cc(C)n(CCCNC(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)n1	915889929	RPQZLTBFVKVAEK-UHFFFAOYSA-N	425.493	1.825	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)NCc2ccc3c(c2)OCCO3)c2ccccc2c1=O	915894534	KRJVEAXRBPPNBS-UHFFFAOYSA-N	437.456	1.893	50	20	IDGD	
CCN1CCN(CC(=O)NNC(=O)c2cc3c(s2)CC[C@@H](C(C)(C)C)C3)C(=O)C1=O	916144989	DVIZKFLBPLIRAA-CQSZACIVSA-N	434.562	1.351	50	20	IDGD	
CCn1cnc2c1c(=O)n(CC(=O)NN=C(C)c1ccco1)c(=O)n2Cc1ccccc1	916332455	WZALGYLKDWDJTA-UHFFFAOYSA-N	434.456	1.561	50	20	IDGD	
O=C(NNC(=O)[C@H]1CC(=O)N(C2CC2)C1)c1nn(Cc2ccccc2)c(=O)c2ccccc12	916834058	SHOVDKSJNYSCHK-INIZCTEOSA-N	445.479	1.217	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(C)c(C(=O)NNC(=O)c2ccc(Cl)nc2)c1	917253386	HYZBNZDPILHGCF-UHFFFAOYSA-N	426.882	1.043	50	20	IDGD	
CCC[C@H](C)N1C[C@H](C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)CC1=O	917515359	COQUEUBWRFLDMT-LSDHHAIUSA-N	427.505	1.776	50	20	IDGD	
COc1cc(S(=O)(=O)NNC(=O)c2ccc3ccccc3n2)cc(C(=O)O)c1OC	917712980	BKTQGCZWZJIMAR-UHFFFAOYSA-N	431.426	1.574	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(CNS(=O)(=O)c2ccc(CCCl)cc2)cc1	917908268	QVTGGAIGGBHMGX-UHFFFAOYSA-N	446.978	1.871	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1ccc2c(c1)OCCO2)c1ccc(S(=O)(=O)N(C)C)cc1	918106102	YPMXEQUGVJYUDD-CYBMUJFWSA-N	448.501	1.413	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2ccc(Cl)cc2O)cc(S(=O)(=O)N(C)C)c1C	918358730	YGRGDKKMCVURCW-UHFFFAOYSA-N	425.894	1.988	50	20	IDGD	
Cc1nn(C)c(C(=O)NNC(=O)c2ccc(CSc3nncn3C)cc2)c1[N+](=O)[O-]	919972276	OYDOWGUWMAAVSY-UHFFFAOYSA-N	430.450	1.132	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)c2cccc(NC(=O)CCn3ccnc3)c2)cc1	920092970	KQSLAGSGEYEGLY-UHFFFAOYSA-N	436.472	1.794	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)NCCCS(=O)(=O)c2ccccc2)cc1C	921247870	MKNHXYHFCFQZQA-UHFFFAOYSA-N	432.502	1.436	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@@H]2Cc3ccccc3CN2C(C)=O)c2ccccc2c1=O	933437303	LVKVDFOMKHTKBF-IBGZPJMESA-N	433.468	1.151	50	20	IDGD	
CC(C)[C@H](CNC(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1)N1CCOCC1	1116091457	GBILWZJRZAQTNH-KRWDZBQOSA-N	441.573	1.321	50	20	IDGD	
O=C(NNC(=O)c1cncn1-c1ccccc1)N[C@@H]1CCCN(Cc2ccccn2)C1=O	1325282837	HCKSICFSUOTVEU-GOSISDBHSA-N	433.472	1.403	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cncc3cnccc13)CCO2	1779297918	CAOPMNHFRCTJSW-NRFANRHFSA-N	428.565	1.925	50	20	IDGD	
Cn1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)c(C(F)(F)F)n1	1779298782	NVTRZHWVBZFSEG-QGZVFWFLSA-N	448.518	1.734	50	20	IDGD	
CCc1cc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)n(C)n1	1779622676	XWOWYTIWLIQBIO-ACJLOTCBSA-N	427.343	1.457	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CSCC(=O)O)C2	1780715581	RXXNVXXZQIIFKA-OAUYIBNBSA-N	441.377	1.554	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)/C=C/C(=O)NCc3ccccc3)CCO2)C1	1781211514	WUWCMOSEXNFHDR-HWOYEPTDSA-N	433.936	1.706	50	20	IDGD	
N#Cc1cc(CC(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)ccc1F	1781299128	DKAMHHKSDJVCHR-SJLPKXTDSA-N	442.260	1.760	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)n2ccnn2)C1	1781552139	JFWRVJVAFGFMLB-VMUDFCTBSA-N	428.331	1.136	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H]2CCCS2(=O)=O)C1	1781649712	ITYRROCVYHZQSM-YIOZNXECSA-N	434.986	1.485	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)CSc1ncccn1)C2)C(Cl)Cl	1782215383	VXEWTWNEHYESST-SJKOYZFVSA-N	433.361	1.886	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)N1CC[C@]2(CN(C(=O)[C@H](F)Br)CCO2)C1	1782706246	HIBGOJXBHWNJFP-JRPNMDOOSA-N	425.251	1.068	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3cc4ccccc4n3C)[C@H]2C1	1783901455	ACTMVAQLSDHGFD-WBKMXMRLSA-N	447.963	1.954	50	20	IDGD	
Cc1onc(-c2ccccc2)c1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]2C1	1784086853	QEWCYUDUFZSFHV-XSLAGTTESA-N	447.919	1.843	50	20	IDGD	
COc1ccc(/C=C(\C)C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]3C2)cc1	1784093759	FVSHHYJSORQULG-GJSUTMHOSA-N	436.936	1.678	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nc(O)n4c3CCCC4)C[C@@H]21	1784617329	FHWCFCBYLBJILV-JKQORVJESA-N	438.956	1.926	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3c(O)cc(O)cc3O)C[C@@H]21	1784620104	KKBWHOGGCGQPGP-MJFSBKNWSA-N	426.897	1.804	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)CCc3ccoc3)C2)C1	1784677636	GITGTJJBNYTRTD-OLCUMFGGSA-N	441.488	1.176	50	20	IDGD	
CC(C)N1CCC[C@H]1C(=O)N1CC[C@@]2(CN(C(=O)[C@H](C)CBr)CCO2)C1	1784801841	ZKUHKKASGDBEIX-GJYPPUQNSA-N	430.387	1.720	50	20	IDGD	
CCc1[nH]nc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CO[Si](C)(C)C)C[C@@H]32)c1F	1785793345	GEKOYJCCFVSLRC-YDHLFZDLSA-N	426.565	1.556	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN(C)C(=O)OC(C)(C)C)[C@H]2C1	1786625828	ULGRUSRIOVTCBX-VGWMRTNUSA-N	431.961	1.850	50	20	IDGD	
C[C@@H](CBr)C(=O)NC1(c2ccc(NC(=O)CN3CCNC3=N)cc2)CCC1	1788013081	UPIOVSQILVXTJM-ZDUSSCGKSA-N	436.354	1.991	50	20	IDGD	
Cc1nnc(CC(=O)Nc2ccc(C3(NC(=O)CCC(=O)NN(C)C)CCC3)cc2)o1	1788197166	VKZIIACVHHAREI-UHFFFAOYSA-N	428.493	1.428	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc4cccnc4[nH]3)[C@H]2C1	1788371675	PTNKACYRMWKTRY-PCBIJLKTSA-N	435.322	1.940	50	20	IDGD	
C[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]2C1)n1ccccc1=O	1788764695	RXJJLGKQMGMOPL-XSLAGTTESA-N	435.597	1.241	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCC#N)C[C@@H]21	1789222204	GGVNARMYFWZTPG-FNHZYXHNSA-N	444.444	1.417	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nc[nH]c3[N+](=O)[O-])C[C@@H]21	1789866735	YPIXCZGNDUTZGA-YPIXOSSWSA-N	434.280	1.148	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc4ncccn34)C[C@@H]21	1789868231	QXWMGPULCATFHR-NGOJXBLDSA-N	440.331	1.559	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3C[C@@]34C(=O)Nc3ccccc34)[C@H]2C1	1791039192	SGVMJIGSJSXTLE-FNQLGUPJSA-N	445.947	1.894	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1ccc(C2(NC(=O)CCN3C(=O)C=CC3=O)CCC2)cc1	1791564958	GFLUGUFCVRRJHW-INIZCTEOSA-N	433.892	1.689	50	20	IDGD	
COc1ccc([C@H](O)C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Br)C3)cc1	1792716386	UJLMSFRLXVOCFJ-URLPEUOOSA-N	445.285	1.009	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C(C)(C)CCl)C1	1792782726	AHVANXLLKOQRQD-MUJYYYPQSA-N	443.972	1.708	50	20	IDGD	
COc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)CBr)ccn1	1792870701	IXTONCITICDBFT-ZIEJDFEHSA-N	426.311	1.324	50	20	IDGD	
COc1cccc(-c2cc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@@H](O)CCl)c[nH]2)c1	1792975667	UIGLBVLWLBJBFA-JSJNYSNDSA-N	447.919	1.493	50	20	IDGD	
N#Cc1cccc(CCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)c1	1796187945	OKSICQCAVPFNBL-KOUNCHBCSA-N	431.301	1.123	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Cl	1796365167	VADGSIWJHCSETC-XBORSJSESA-N	447.935	1.804	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@H]2[C@H](C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@H](F)Cl)[C@@H]2C1	1796369333	AIMJSNWFCZKQLC-LABKCIJJSA-N	445.919	1.223	50	20	IDGD	
C[C@@H](Nc1nccs1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2	1796414725	DTXSFBIZWVPQAW-RMPHRYRLSA-N	435.319	1.224	50	20	IDGD	
COc1cscc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)CBr)C2	1796679594	JEMAJFMEYWXVOW-MCYUEQNJSA-N	431.352	1.991	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C#CC1(O)CCCCC1	1797781278	SPURFOPVGZYRBQ-XLMAVXFVSA-N	441.366	1.306	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@](F)(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](O)CCl)C3)C1	1797898772	XOJMEUHLOQYVAD-UPYQZRRNSA-N	447.935	1.573	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CO[Si](C)(C)C)cc1	1797959542	XNSNBBVZNOQGCX-XEMDLRDOSA-N	433.581	1.700	50	20	IDGD	
Cc1nc2ncccn2c1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@](C)(Cl)CCl	1799275584	YYIOGCHAWSEEKD-LJPSSGMGSA-N	440.331	1.477	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(O)c([N+](=O)[O-])c1)C2	1799275993	FZHFXFFCPBORLV-TYYYEBLRSA-N	446.287	1.740	50	20	IDGD	
CCOc1cccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Br)c1	1799349387	YWDFNHBUKMWCQT-OCVGTWLNSA-N	429.286	1.979	50	20	IDGD	
COc1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](O)CCl)C3)c(F)c(OC)c1F	1800671163	ARXJJSSPDIQNEG-LSCVPOLPSA-N	432.851	1.834	50	20	IDGD	
CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](Cl)COC	1800983322	YIZUVPJBBUMJEC-YIDVYQOGSA-N	447.960	1.133	50	20	IDGD	
CCOC(=O)N(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](O)CCl)C2)Cc1ccco1	1802754037	PVRKTJKSNCSCKR-JYYAWHABSA-N	441.912	1.476	50	20	IDGD	
CC(C)(CCl)C(=O)NC[C@@H]1CCN(C(=O)CCc2nc(N)n[nH]2)[C@@H]1c1cccnc1	1802901070	LZZLHQVDZPMFJV-WMLDXEAASA-N	433.944	1.686	50	20	IDGD	
CC(C)(CCl)C(=O)NC[C@@H]1CCN(C(=O)C[C@@](C)(O)CC(=O)O)[C@@H]1c1cccnc1	1802901254	APUDBLXXDAQNCR-RRMPHLOHSA-N	439.940	1.968	50	20	IDGD	
O=C1NCc2cc(C(=O)N3CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]3c3cccnc3)ccc21	1803143020	RAKBVASSGPSCLH-ATZDWAIDSA-N	442.903	1.244	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H](CNC(=O)Cc2cnccn2)[C@H]1c1cccnc1	1803300226	IUNISJKBVNZPRR-DYESRHJHSA-N	427.581	1.972	50	20	IDGD	
CC(C)[C@H](S)C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1803599282	WLFKABWXWKWJQP-HOJAQTOUSA-N	441.362	1.035	50	20	IDGD	
CCc1oncc1C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1806033300	QZFQRUSLVBRWPS-HRAATJIYSA-N	442.520	1.325	50	20	IDGD	
C[C@@H](CS(C)(=O)=O)C(=O)N1CCCC2(CCN(C(=O)CO[Si](C)(C)C)CC2)C1	1806042587	LRPDYRWPOYPKDU-INIZCTEOSA-N	432.659	1.750	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC2(CCCN(C(=O)c3cnco3)C2)CC1	1806323527	LQBJDCPADPEBDH-BUVRLJJBSA-N	426.477	1.653	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)c2ccccc2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807360201	IEEJNJYXIHGKNQ-IRLDBZIGSA-N	429.285	1.395	50	20	IDGD	
C[C@]1(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)CC1(F)F	1807368222	QOZALESFYCOMTE-DJPFJPOOSA-N	443.259	1.126	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)Cn2ccnn2)[C@H]1c1cccnc1	1807694257	YWXGQOYGRTWHEB-YQQAZPJKSA-N	435.326	1.553	50	20	IDGD	
C[C@H](Nc1nccs1)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1	1808381830	VHDCIUHKQHVICB-TUUVXOQKSA-N	437.953	1.644	50	20	IDGD	
O=C(CCN1CCOC1=O)N1CCC2(CCCN(C(=O)CCBr)C2)CC1	1809065355	DGGGIWYQPCIETQ-UHFFFAOYSA-N	430.343	1.845	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)c1ccc2cnccc2n1	1809140799	MWNDWIFHVWKVHX-FFZOFVMBSA-N	439.903	1.944	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC2(CCCN(C(=O)c3ccc4n[nH]cc4c3)C2)CC1	1810570069	HLDBCNYZADTPHA-UHFFFAOYSA-N	446.316	1.401	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)N1CC[C@H](CNC(=O)[C@@H](Cl)COC)[C@H]1c1cccnc1	1813034786	XSSSAWICLCJYKK-MXASKKJJSA-N	441.912	1.903	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)CCC(F)(F)F)[C@@H]1c1cccnc1	1813071129	NMJDJZIOVOMEHP-HNAYVOBHSA-N	443.470	1.803	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CN2CCCCC2=O)[C@H]1c1cccnc1)C(Cl)Cl	1813081769	ZZXHTNYUKCNGOX-YOEHRIQHSA-N	427.332	1.904	50	20	IDGD	
Cc1ccc(C(=O)NCC(=O)N2CCCC[C@@H]2c2cc(NC(=O)[C@H](O)CCl)n[nH]2)cc1	1814876176	QIPIYXNTJUVKQJ-IAGOWNOFSA-N	447.923	1.740	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)Cn3ccccc3=O)sc2C1	1815451780	PKQXNGZSEQOWCI-MNOVXSKESA-N	439.335	1.700	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCBr)n[nH]1	1816782472	QNBOWYXEVDVAEU-YPMHNXCESA-N	443.346	1.894	50	20	IDGD	
Cc1cccc(CC(=O)N2CCCC[C@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)n1	1817470285	OANNJGYPNHKOOG-FQEVSTJZSA-N	447.304	1.342	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)CCc3nc(N)n[nH]3)sc2C1	1819561982	VAXWRNUYCNLWBQ-HTQZYQBOSA-N	442.343	1.172	50	20	IDGD	
Cc1nccnc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1	1819955564	LVYJYYXRJCJNSU-OAHLLOKOSA-N	428.497	1.187	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@H](F)Br)[nH]n1)c1c[nH]c(=O)cn1	1820247456	FKYOCVNEZFPGLK-GWCFXTLKSA-N	427.234	1.489	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](O)CCl)CC2)c1cc(-c2ccncc2)[nH]n1	1820586118	ITEOYNGRMRFQCT-NHYWBVRUSA-N	446.920	1.754	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnc(O)[nH]3)sc2C1	1820658759	OMCKUPQRQPIZFN-HTQZYQBOSA-N	428.312	1.829	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H]2C[C@H]3CC[C@@H]2O3)n[nH]1	1822218782	XSQIXRABMUWTHW-SRABZTEZSA-N	432.525	1.342	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](N)Cc2cscn2)[nH]n1	1822368499	GBSXFEVUIJSOTH-YDHLFZDLSA-N	440.957	1.682	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)cc(O)n1	1822414001	KAGKSCKSCIJUND-MRXNPFEDSA-N	443.508	1.498	50	20	IDGD	
CC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](C)N1CCN(C)CC1)CC2	1822849039	FPSYFAQXXJMBAC-IHRRRGAJSA-N	428.002	1.708	50	20	IDGD	
CN[C@H](CC(=O)N[C@H]1CCc2nc(NC(=O)[C@@](C)(Cl)CCl)sc2C1)C(=O)O	1822863643	QFSPTZADENKTPW-XDBGJTNISA-N	437.349	1.354	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)cn1	1830538102	VXILWQAHNONWQG-LIRRHRJNSA-N	440.338	1.491	50	20	IDGD	
CCc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)n[nH]1	1830538983	XELLUCMGBKIYKH-ACJLOTCBSA-N	443.342	1.073	50	20	IDGD	
O=C(c1cccc(F)c1Cl)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1830733881	WTZQZBASVYGJDZ-RDTXWAMCSA-N	435.279	1.149	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H](C)Cn2cncn2)CC1	1831830788	ILAMAGBEIDQZKL-BPQIPLTHSA-N	425.961	1.788	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@H](O)c2ccco2)CC1	1831869686	LWWDWUCEAZNXNK-LAUBAEHRSA-N	434.537	1.306	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3cncc(C)c3)CCO2)C1	1832962049	DNRUZYUMYUOJMU-NQIIRXRSSA-N	439.940	1.033	50	20	IDGD	
COC(=O)CSCC(=O)N1CCC(N2CCC(NC(=O)C(C)(C)CCl)CC2)CC1	1833213645	XDDQSNGUPDQVHP-UHFFFAOYSA-N	448.029	1.729	50	20	IDGD	
C[C@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)[C@H]3CCOC3)CC2)CC1	1833266255	XCFPMNFBJWYFTN-CABCVRRESA-N	430.387	1.626	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3nc(C(C)C)cs3)CCO2)C1	1833287717	BDHNAEDXEVGVDX-KUHUBIRLSA-N	445.969	1.590	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3nc4ccccc4o3)CC2)CC1)[C@H](O)CCl	1833311677	CJVZHAARDNUYLN-QGZVFWFLSA-N	434.924	1.613	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)C[C@](C)(O)CC(=O)O)CC2)CC1	1833534683	GIXLKECUKYNZBQ-UWJYYQICSA-N	445.988	1.581	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCC(N2CCC(NC(=O)Cc3ncccn3)CC2)CC1	1833876798	RAFKYGYGHAXBLW-FQEVSTJZSA-N	442.391	1.827	50	20	IDGD	
Cc1oc(C(C)(C)C)cc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1	1834195640	OMWYAGHREXFBKN-IIBYNOLFSA-N	442.940	1.555	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)c3cnoc3)CC2)CC1	1835148445	VUDHIEJYRLSFGE-CYBMUJFWSA-N	427.343	1.891	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cnc(C)s3)CC2)CC1	1835259611	OKJCNZRGBPXXSN-MRXNPFEDSA-N	428.986	1.891	50	20	IDGD	
O=C(Cn1cc(Cl)cn1)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836716669	IBHYNQZTIKTHAO-MRXNPFEDSA-N	433.336	1.135	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CCC(OC3CCN(C(=O)[C@H](O)CCl)CC3)CC2)o1	1836716957	AGFWRWKZCRLEPK-MRXNPFEDSA-N	441.912	1.450	50	20	IDGD	
Cc1ccc(C(=O)N2CCC(OC3CCN(C(=O)[C@H](O)CCl)CC3)CC2)c(O)n1	1836717814	CWFWFYHDGYMICD-QGZVFWFLSA-N	425.913	1.308	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@H](C)n3cnnn3)CC2)CC1	1836921861	AZWQVVQDHXRSOT-YOEHRIQHSA-N	426.949	1.640	50	20	IDGD	
O=C(c1n[nH]c2ccccc12)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1836944619	MWWRHXKFIOZXHN-GOSISDBHSA-N	427.288	1.437	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)C/N=C/c3ccco3)CCO2)C1	1837559998	GXVLPSLBZBQSCZ-OJJSKHJLSA-N	425.913	1.420	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc4c[nH]nc34)C2)C1	1837711678	NOMRAITYJJHNJM-NRFANRHFSA-N	446.580	1.484	50	20	IDGD	
O=C(c1ccn(C(F)F)n1)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1838039761	WWCXWYZBGDIQHG-OAHLLOKOSA-N	427.235	1.152	50	20	IDGD	
O=C(c1cc(-c2ccccn2)[nH]n1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1838050632	VAFGZFDWSSAWFA-VQIMIIECSA-N	437.859	1.076	50	20	IDGD	
COc1ccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)c(C#N)c1	1839132949	URYYWWNKFJBZNM-AZUAARDMSA-N	439.871	1.100	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CSc3ncccn3)C2)C1	1839143673	DTOGPWNMWQDGKM-RDTXWAMCSA-N	428.942	1.043	50	20	IDGD	
C=CCSCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2	1839150420	MFZAMYJTAVUBDZ-DLBZAZTESA-N	425.378	1.598	50	20	IDGD	
C[C@H](C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H](F)Br)CCO2)C1)c1cccs1	1839203113	AIRDUYPLLLFTEM-QEORTHHSSA-N	449.342	1.999	50	20	IDGD	
O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)Cc1ccccc1O)CCO2	1839907611	IBGWCGSZPWRQDF-LJQANCHMSA-N	441.322	1.176	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(F)c(F)c3)C2)C1	1840034336	IHJCIBZABIHWQL-KZULUSFZSA-N	447.276	1.818	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(F)cc3F)C2)C1	1840034809	XUYXNCIWAKQFOJ-KPZWWZAWSA-N	447.276	1.818	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3CCc4ccoc4C3)C2)C1	1840150488	LTQGBIVQORDQIG-LLGFUMIMSA-N	440.924	1.095	50	20	IDGD	
C=C(Oc1ccccc1O)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840187538	HZBQNIJHYQDAQX-LJQANCHMSA-N	445.299	1.545	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CC(OCC)OCC)CCO2)C1	1840279764	AOSYMRGJXVNUNU-UZLBHIALSA-N	434.961	1.640	50	20	IDGD	
O=C(c1cc(Br)ccc1[N+](=O)[O-])N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1	1841352769	MFDPYIYJEVKVBJ-ZDUSSCGKSA-N	446.685	1.774	50	20	IDGD	
CC(C)(C(=O)N1CCCC12CN(C(=O)[C@H](O)CCl)C2)c1ncc(Br)cn1	1841452720	CCVFURYEYFQWAN-GFCCVEGCSA-N	445.745	1.320	50	20	IDGD	
CC(C)(C)OC(=O)N1CC2(C[C@@H](C(=O)N3CC4(CCCN4C(=O)[C@@H](F)Cl)C3)CO2)C1	1843366829	SIHPYMFFIVAHPZ-ZIAGYGMSSA-N	445.919	1.750	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)[C@@H](C)Nc2ccccn2)C1	1844389822	SHYMLTOMZXUMSG-SXJXFNOXSA-N	437.504	1.219	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2ccc(N(C)C)cc2)C1	1844936780	PCVUXJZJYBKKNL-PCLIKHOPSA-N	436.516	1.704	50	20	IDGD	
O=C(CCn1c(=O)oc2ccccc21)N1CC2(CCCN2C(=O)[C@@H](F)Br)C1	1845216220	CHEHLMASYPPTQS-OAHLLOKOSA-N	440.269	1.879	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC2(CCCN2C(=O)[C@H](O)NC(=O)OC(C)(C)C)C1	1845440049	NCBDFMTVUMJWDM-NEPJUHHUSA-N	434.331	1.206	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H]1CCCCO1	1847309778	FNIKKBHZGKLEFC-JENIJYKNSA-N	431.445	1.905	50	20	IDGD	
Cc1ccc(S(C)(=O)=O)cc1C(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12	15945556	NRLWSIDJCMCOIA-UHFFFAOYSA-N	442.497	1.764	50	20	IDGD	
COc1cc(CCC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc(OC)c1	17407007	XVKXGKYQEYBLDS-UHFFFAOYSA-N	449.529	1.413	50	20	IDGD	
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)c1cc(Br)c[nH]1	24123415	IAGWLWUQKZICDU-INIZCTEOSA-N	432.278	1.767	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)c(C)n1-c1ccccn1	106076020	OTTSDAGMNWBIPL-UHFFFAOYSA-N	426.502	1.857	50	20	IDGD	
CCN1C[C@@H](CN(C)C(=O)NNC(=O)CNC(=O)c2cccs2)Oc2ccccc21	725872547	QNFPQMVSFDNDNW-CQSZACIVSA-N	431.518	1.438	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NCc1ccc(N2CCCCCC2)nc1	725872978	IHAIOQDSSCWCLS-UHFFFAOYSA-N	430.534	1.784	50	20	IDGD	
C[C@H](C(=O)NNC(=O)c1cn(-c2ccccc2)nc1-c1ccccc1)N1CCN(C)CC1	725877681	FOHOFUOPUGYXFG-GOSISDBHSA-N	432.528	1.936	50	20	IDGD	
Cc1[nH]c(-c2ccncc2)nc(=O)c1CCC(=O)NNC(=O)c1cc(-c2ccccc2)[nH]n1	725879597	LITXXFCKIQZMKW-UHFFFAOYSA-N	443.467	1.924	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)CCn2nc(C)c([N+](=O)[O-])c2C)c2ccccc2c1=O	726499057	RWCCSRWUHGFEHT-UHFFFAOYSA-N	441.448	1.379	50	20	IDGD	
O=C(CCCc1ccccc1)NNC(=O)c1ccc2c(c1)S(=O)(=O)N(C1CC1)C2=O	727717924	QWUNWTSULOUMAF-UHFFFAOYSA-N	427.482	1.777	50	20	IDGD	
Cc1ccc(-n2c(C)cc(/C=C(/C#N)C(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)c2C)cc1	728384412	JDQZUKQDZXMDIM-BEWREHSGSA-N	440.525	1.892	50	20	IDGD	
CCN(CC)CC(=O)N1CCN(C(=O)/C(C#N)=C\c2cc(C)n(CCOC)c2C)CC1	728880806	GTTYJPPWEHWMAU-QNGOZBTKSA-N	429.565	1.671	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(CC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)CC1	728890546	VLBQQXFUTFTDRV-UHFFFAOYSA-N	446.552	1.878	50	20	IDGD	
O=C(NNC(=O)N1CCO[C@@H](c2ccccc2Cl)C1)c1ccc(-n2cnnn2)cc1	728944622	HRBFHIVUNQPQBN-QGZVFWFLSA-N	427.852	1.744	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)c2ccc(F)c(S(=O)(=O)N(C)C)c2)cn1	729692569	WBOMHQZTDJMTNY-UHFFFAOYSA-N	427.483	1.111	50	20	IDGD	
CS(=O)(=O)c1ccc(OCCNC(=O)NNC(=O)c2cc(Br)c[nH]2)cc1	730066540	LKDHKDAROKJJSM-UHFFFAOYSA-N	445.295	1.204	50	20	IDGD	
CCCCCn1nc(C(=O)NNS(=O)(=O)C[C@H]2CCCCO2)c2ccccc2c1=O	731902993	SZWLPKMGQDPRSJ-OAHLLOKOSA-N	436.534	1.720	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CS[C@H]2CCS(=O)(=O)C2)cc1Br	732173879	KUWHYTZILRMPLQ-JTQLQIEISA-N	437.337	1.139	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)NCCCCN1C(=O)c2ccccc2C1=O	732235732	IHJMNSPLOWACQV-UHFFFAOYSA-N	440.456	1.481	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NNC(=O)Cc2ccc(F)cc2)cc1Br	732255756	LOZKTFMCJBWANH-UHFFFAOYSA-N	439.241	1.815	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)N[C@H]2CCN(c3ccccc3C(N)=O)C2)c2ccccc2n1	732595090	MHVUFEFBPDMREI-HNNXBMFYSA-N	432.484	1.865	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)N[C@H]1CCN(c2ccccc2F)C1=O	732892575	DYQXMSLALPLKDX-HNNXBMFYSA-N	438.419	1.467	50	20	IDGD	
Cn1c(NNC(=O)c2sccc2S(=O)(=O)N2CCCCC2)nc2ccccc2c1=O	733260786	RJFZVABQOZGIAS-UHFFFAOYSA-N	447.542	1.927	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)c2cccc3ncccc23)cc1C(=O)N(C)C	734416250	RICFMGJZTPTPSZ-UHFFFAOYSA-N	428.470	1.569	50	20	IDGD	
Cc1ccc(C)c(S(=O)(=O)Oc2ccc(C(=O)NNC(=O)c3cnn(C)c3)cc2)c1	735444274	JKIBKDFUANOWQC-UHFFFAOYSA-N	428.470	1.879	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)c2cc(C(=O)OC)cc([N+](=O)[O-])c2)cc1C	736742400	FLECCOKZWIXIJL-UHFFFAOYSA-N	449.441	1.932	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)c2ccc(Cn3cncn3)cc2)cc1C	736756109	ZNZUGEBJKOXDPE-UHFFFAOYSA-N	427.486	1.877	50	20	IDGD	
C[C@@H]1CN(Cc2cccc(CNC(=O)NNC(=O)COCc3ccccc3)c2)CCO1	738460038	KPPKZSUSEREKHT-GOSISDBHSA-N	426.517	1.955	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cc(O)nc3cc(F)ccc23)cc1	739679129	PJWOYEABWMHHHW-UHFFFAOYSA-N	446.460	1.470	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)[C@H]1CCCN1C(=O)c1ccccc1OC(F)F	740853054	SOFKUJYAZVVFID-CQSZACIVSA-N	440.447	1.345	50	20	IDGD	
O=C(COC(=O)c1ccc(N2CCC(O)CC2)cc1)NNC(=O)c1cccc(Cl)c1	740962782	UMGKSCWEBZTKTR-UHFFFAOYSA-N	431.876	1.919	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)CN(CC2CC2)C(=O)OC(C)(C)C)c2ccccc2c1=O	742473909	JRAGYCKGROCHOO-UHFFFAOYSA-N	429.477	1.342	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=S)N[C@H]2CCc3ccccc3C2)c1	742975718	NGEYEOVQMRQLOK-KRWDZBQOSA-N	432.571	1.603	50	20	IDGD	
O=C(NCCS(=O)(=O)N1CCOCC1)NNC(=O)Nc1ccc(-c2ccccc2)cc1	743575888	LXYKFOHTXKSDDD-UHFFFAOYSA-N	447.517	1.351	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)[C@]23CCC(=O)N2c2ccccc2S3)c1	744617753	ICTVFUCLNJNUKM-OAQYLSRUSA-N	436.449	1.491	50	20	IDGD	
COc1ccc(C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)c(Br)c1	744912944	GMHXIRLFAAGRMQ-UHFFFAOYSA-N	432.230	1.947	50	20	IDGD	
Cc1noc(-c2ccccc2C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)n1	745259903	YOOYNJGECGFPIE-UHFFFAOYSA-N	425.357	1.571	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)[C@@H]2CCN(c3cccc(Cl)c3)C2=O)c1	745433390	RJPXUDVDHVAKBB-QGZVFWFLSA-N	440.843	1.569	50	20	IDGD	
COc1cc(C(=O)NNC(=O)N[C@@H]2C[C@H](C)N(c3cnn(C)c3)C2=O)ccc1OC(C)C	745916139	BACARLQJOCWSGE-XJKSGUPXSA-N	444.492	1.354	50	20	IDGD	
O=C(NNC(=O)N1CCC(OCCN2CCCC2)CC1)c1cc(Br)c[nH]1	745999233	UIWQLGBMLMLRMI-UHFFFAOYSA-N	428.331	1.708	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)NCCCCN1C(=O)c2ccccc2C1=O	746764623	DZQBXMDONITNNH-UHFFFAOYSA-N	434.456	1.284	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N1CCC[C@@H](CC(N)=O)C1	747491183	QJBNQPIRSBVPBG-NEPJUHHUSA-N	427.299	1.545	50	20	IDGD	
O=C(NNc1ccc(Br)cc1F)[C@@H]1CC(=O)N([C@@H]2CCS(=O)(=O)C2)C1	748171495	RXWUZAJWTKSMCA-MWLCHTKSSA-N	434.287	1.067	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H](C(C)C)N2CCCC2=O)c1	748558015	UNVFTMGDVWCNKK-GOSISDBHSA-N	438.550	1.125	50	20	IDGD	
Cc1ccc(C(=O)NNc2cccc([N+](=O)[O-])c2C)cc1S(=O)(=O)N1CCOCC1	748683405	VBUZZHPTSWXEFA-UHFFFAOYSA-N	434.474	1.989	50	20	IDGD	
CN(CC(=O)NNC(=O)CC1CCCC1)S(=O)(=O)c1ccc(Br)cc1	749945229	PGXSISNEQJNVCW-UHFFFAOYSA-N	432.340	1.797	50	20	IDGD	
CO[C@H](C)c1noc(CN2CCCN(CC(=O)NNC(=O)c3cccc(C)c3)CC2)n1	750062118	YDGCCSCMADPYQJ-MRXNPFEDSA-N	430.509	1.054	50	20	IDGD	
Cc1noc(C(F)(F)F)c1C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	750487884	NXDHFGQUSNGMIU-NSHDSACASA-N	429.307	1.146	50	20	IDGD	
COc1cccc2c1OCC(C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)=C2	751289772	FACNGMXEMQKRNG-UHFFFAOYSA-N	431.470	1.183	50	20	IDGD	
Cn1c(NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)nc2ccccc2c1=O	752914338	KHZFHWLBMQCXTD-UHFFFAOYSA-N	441.513	1.865	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)COc2ccc(C)cc2)c(C)c([N+](=O)[O-])c1	753842216	ZTQKDMHPIPCHCJ-UHFFFAOYSA-N	444.400	1.163	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)on1	753981628	POASJXIQSONHCK-UHFFFAOYSA-N	430.442	1.237	50	20	IDGD	
CC(C)(CO)CCCNC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	754916238	OYAXRZSLSDKKPZ-UHFFFAOYSA-N	426.539	1.214	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2ccc(NC(=O)NNC(=O)c3cccnc3)cc2)C[C@@H](C)O1	755423104	NZVSGHXMOHCRET-OKILXGFUSA-N	433.490	1.346	50	20	IDGD	
Cc1nn(C)c(N2CCOCC2)c1C=NNC(=O)CCN1CCN(c2ccccc2)CC1	755481694	ONSDGOXHPKHJPH-UHFFFAOYSA-N	439.564	1.228	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)Nc1ccc(C(=O)N2CCCC2)cc1	755611018	WVGBWORWGOKDIK-UHFFFAOYSA-N	437.504	1.782	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)Nc1cccc(COCC(F)(F)C(F)F)c1	755965342	YHBCWZCCAMBKLT-NSHDSACASA-N	441.403	1.691	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Nc2cccc(Cn3cncn3)c2)cc(OC)c1OC	756149630	GNSNWXCXKAPVJX-UHFFFAOYSA-N	426.433	1.819	50	20	IDGD	
CCc1c(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)cnn1CCC(C)C	756163988	LMYRHFXRKSIHCB-UHFFFAOYSA-N	426.477	1.528	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)CCc2ccccc2)cc1S(=O)(=O)NC1CC1	756682752	PIFMSXIKZLXYHZ-UHFFFAOYSA-N	432.502	1.921	50	20	IDGD	
Cc1c(NC(=O)NNC(=O)c2ccc3c(c2)OCCO3)cccc1S(=O)(=O)NC1CC1	756706009	NYNUQLUWEQOPOJ-UHFFFAOYSA-N	446.485	1.673	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Cc2c(OC)cccc2OC)c1	756901421	LUDVESFWBCVHIZ-UHFFFAOYSA-N	449.529	1.738	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)Nc2ccc(CS(C)(=O)=O)c(F)c2)c2ccccc2c1=O	757675810	OGWYGNDFNOGOON-UHFFFAOYSA-N	447.448	1.084	50	20	IDGD	
C[C@H]1C[C@H](NC(=O)NNC(=O)c2csc(N3CCOCC3)n2)CN1Cc1ccccc1	757722125	JPHADHFSPGWWLD-RDJZCZTQSA-N	444.561	1.587	50	20	IDGD	
COc1ccc(S(N)(=O)=O)cc1NC(=O)COC(=O)/C(C#N)=C\c1ccc(C)cc1	759860384	HTFWTSCMKYXBCY-DHDCSXOGSA-N	429.454	1.740	50	20	IDGD	
Cc1nn(C)c(C)c1S(=O)(=O)N[C@H](C)C(=O)NNc1ccc(OC(F)(F)F)cc1	761594450	BUIABCUTDIKFKU-SNVBAGLBSA-N	435.428	1.746	50	20	IDGD	
COc1ccc2c(c1)[C@H](C(=O)NNc1ccc(S(=O)(=O)N3CCN(C)CC3)cc1)CC2	762142208	KQEKHBDCHOCSSG-HXUWFJFHSA-N	444.557	1.804	50	20	IDGD	
O=C(NNc1nccc(N2CCOCC2)n1)[C@H]1CCCN(C(=O)c2ccc(Cl)cc2)C1	762855357	NFJXTKJGTPCKBW-INIZCTEOSA-N	444.923	1.962	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)[C@H]2Cc3ccccc3CN2C(C)=O)n[nH]1	763152483	HADGLUGTSGSPSY-HXUWFJFHSA-N	433.468	1.820	50	20	IDGD	
O=C(CCN1CCN(c2ccccn2)CC1)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	763172815	AOCVUBKFPKHMBA-UHFFFAOYSA-N	437.479	1.584	50	20	IDGD	
O=C(NNC(=O)c1cccnc1)C(=O)Nc1ccc(I)cc1Cl	763490877	DRVCAFSGXNGVQL-UHFFFAOYSA-N	444.616	1.739	50	20	IDGD	
O=C(NNC(=O)c1ccccc1O)C(=O)Nc1ccc(-n2cccn2)cc1C(F)(F)F	763530456	VRVJBCSZDJXCSV-UHFFFAOYSA-N	433.346	1.996	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(OC(F)F)c(F)c2)cc1OC	763550845	RZNQDQYRICAJLJ-UHFFFAOYSA-N	427.335	1.844	50	20	IDGD	
Cc1ccc(Cn2nccc2NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)s1	763677985	ASBKCAGWEFHJOZ-UHFFFAOYSA-N	438.469	1.338	50	20	IDGD	
C[C@H]1COCCN1c1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2F)cc1	763678234	BAFITIMTTFNMJI-AWEZNQCLSA-N	430.436	1.216	50	20	IDGD	
Cc1cc(Br)ccc1NC(=O)C(=O)NNC(=O)COc1ccc(C#N)cc1	763682505	VAUOKNSEVUBOOU-UHFFFAOYSA-N	431.246	1.794	50	20	IDGD	
CC(C)n1ncc2ccc(NC(=O)C(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)cc21	763790462	IVIQQDVVPODZJD-UHFFFAOYSA-N	447.455	1.264	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)C(=O)Nc1csc(-c2ccccn2)n1	763803820	OCUKQGZGNRWORV-UHFFFAOYSA-N	442.413	1.278	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)C(=O)Nc1ccc(SC(F)F)nc1	763804979	YZTVPZYKZPPNQG-UHFFFAOYSA-N	441.372	1.469	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cccc(-n3nnnc3C)c2)c1C	763841129	NUWWUKLJQGYCLE-AWEZNQCLSA-N	437.460	1.141	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccccc2C(=O)N(C)C)cc1	763860749	LIVZNWSSIHUTIJ-AWEZNQCLSA-N	442.472	1.341	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(N(C)C)cc2C)cc1	763870526	AJEILJZCWCZVFK-OAHLLOKOSA-N	426.473	1.817	50	20	IDGD	
COC(=O)c1c(F)cccc1NC(=O)C(=O)NNC(=O)c1ccc(OC(C)C)c(OC)c1	763916599	PCCNWSIHLVXVCN-UHFFFAOYSA-N	447.419	1.808	50	20	IDGD	
COC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)c1C	763947227	ACNVGDRTIGVPRE-UHFFFAOYSA-N	437.412	1.073	50	20	IDGD	
O=C(NNC(=O)C1=S=C2CCCCCC2=C1)C(=O)Nc1ccnn1Cc1ccccn1	763962882	UJSBJXCMAIOJMT-UHFFFAOYSA-N	438.513	1.394	50	20	IDGD	
COCCOc1ccc(C(F)(F)F)cc1NC(=O)C(=O)NNC(=O)c1cccn1C	763996177	MCFRLVKNVSXHAE-UHFFFAOYSA-N	428.367	1.469	50	20	IDGD	
C[C@@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3ccc(Cl)nc3)cc2F)C[C@@H](C)O1	764099984	FNXNXJWSSPYZQU-VXGBXAGGSA-N	449.870	1.887	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1c(C)cccc1C(=O)N1CCCC1	764130878	AYHMXQMAJVLJAL-UHFFFAOYSA-N	438.484	1.568	50	20	IDGD	
O=C(CCC1CCCCC1)NNC(=O)C(=O)Nc1ccc(C[C@H]2CC(=O)NC2=O)cc1	764212304	XDYLFXWQOYFKSI-INIZCTEOSA-N	428.489	1.338	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccccc2N(C)C)cc1Br	764326076	DYGKLVSKVZVNFW-UHFFFAOYSA-N	435.278	1.923	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CNC(=O)c2cccnc2)c1I	764341786	KHLTZPZRJQMXDU-UHFFFAOYSA-N	438.225	1.186	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@H](C(=O)NNC(=O)CNC(=O)c1cccnc1)c1ccccc1	764343443	UQQWGODEWYERPO-KRWDZBQOSA-N	441.488	1.267	50	20	IDGD	
COC(=O)c1ccc(-n2cc(C)cn2)c(NC(=O)C(=O)NNC(=O)c2ncccc2C)c1	764389249	OSBBCGCGYIBLKU-UHFFFAOYSA-N	436.428	1.070	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)CCC(=O)N2CCN(c3ccccn3)CC2)cc1	764567176	ROKCWJMGZNFBDY-UHFFFAOYSA-N	441.557	1.759	50	20	IDGD	
Cc1nc2c(c(O)nn2C)c(C)c1CCC(=O)NNC(=O)CSc1ccccc1O	765249634	WWZSUOLJSOUFMH-UHFFFAOYSA-N	429.502	1.869	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)[C@H](C)Sc3nncn3C)n[nH]2)cc1OC	765596684	KCISMQVVSAUSRA-JTQLQIEISA-N	431.478	1.164	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cc4c(C)nn(C)c4nc3C)CC2)cc1	765748754	QFGPHURUCSWELX-UHFFFAOYSA-N	449.559	1.472	50	20	IDGD	
NC(=O)COc1ccc(Cl)cc1S(=O)(=O)NNC(=O)c1cnn(-c2ccccc2)c1	766316149	BAGHCHPMUVXZJE-UHFFFAOYSA-N	449.876	1.013	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1cnc(Cl)c(Br)c1	768242134	OOYXJYIARJZTIH-UHFFFAOYSA-N	443.641	1.368	50	20	IDGD	
COc1ccc(NNC(=O)CN2C(=O)N[C@@]3(CCc4ccccc43)C2=O)c([N+](=O)[O-])c1	768332183	GOQYBAYLNSMLFX-HXUWFJFHSA-N	425.401	1.440	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cccc([S@@](C)=O)c3)CC2)cc1	770247944	WNFPWORZOOEEQW-SSEXGKCCSA-N	428.558	1.311	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1ccoc1Br	770568597	AFCDPUNDRSZWOO-UHFFFAOYSA-N	430.280	1.820	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)[C@@H]1CCCN(C(=O)N2CCc3sccc3C2)C1	772159332	PJVHBLZULSUEFB-UKRRQHHQSA-N	436.534	1.427	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H]2CCO[C@H](C(C)C)C2)c1	772607644	OTZOPIQFDHBINI-AEFFLSMTSA-N	440.566	1.865	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)c1cc(S(=O)(=O)N(C)C)ccc1F	772955610	SFKHALPVEBVIRG-NSHDSACASA-N	443.884	1.958	50	20	IDGD	
Cc1ccc(-n2nc(C)cc2NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)nn1	773495633	DZDIVSFCWXJYRU-UHFFFAOYSA-N	429.824	1.038	50	20	IDGD	
CCOC(=O)[C@@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2)cc1	773640409	YSJHOQUFOIXCCS-GFCCVEGCSA-N	443.416	1.358	50	20	IDGD	
Cc1c(Cl)cccc1NNC(=O)C(=O)N1CCc2cc(S(=O)(=O)N(C)C)ccc21	773769148	WRSWSEVZPAXINI-UHFFFAOYSA-N	436.921	1.931	50	20	IDGD	
COCCNC(=O)c1ccc(NC(=O)C(=O)NNc2nccnc2C(C)C)cc1Cl	773991455	BJJFGVFLZCAKEK-UHFFFAOYSA-N	434.884	1.711	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)NCCOc2ccc(NS(C)(=O)=O)cc2)cc(C#N)n1C	774009072	MAYCODIONGHICO-YBEGLDIGSA-N	427.486	1.679	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)Nc1ccnn1CC1CC1	776037100	RWZKXRMDRILLPM-UHFFFAOYSA-N	446.533	1.934	50	20	IDGD	
COC(=O)N1CCC[C@H]([C@@H](C)NC(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)C1	776241214	QGPPETGFNDQNSR-KGLIPLIRSA-N	442.542	1.261	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNS(=O)(=O)c1ccc(C2(C(=O)OC)CC2)cc1	776272699	ZZFRYYCUULPPMI-UHFFFAOYSA-N	448.497	1.678	50	20	IDGD	
COc1ccc(C(=O)N2CCN(S(=O)(=O)CBr)CC2)cc1OC(F)F	777777568	MSIIGAWPELGONQ-UHFFFAOYSA-N	443.266	1.737	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ccccc2OC(F)(F)F)cc1-n1cnnn1	778798993	IWZKTRBTQBVLNS-UHFFFAOYSA-N	437.338	1.651	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)Cc2ccc(Br)cc2C)n1	778905425	LSGPONYHLQFWNC-UHFFFAOYSA-N	440.319	1.998	50	20	IDGD	
O=C(Cn1c(=O)nc(O)c2ccccc21)NNc1ccc([N+](=O)[O-])cc1Br	779432420	BHOCTJWHMWRJSI-UHFFFAOYSA-N	434.206	1.916	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)N2CCC(C(=O)NNc3ccnc(F)c3)CC2)o1	781363470	CTKSGWLLAXKCTI-UHFFFAOYSA-N	440.453	1.534	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)C[C@H]2CCO[C@H](C(C)C)C2)cc1	781575964	BILCPTOMMNWSQY-WMZOPIPTSA-N	425.551	1.604	50	20	IDGD	
CCOc1cc(N2CCOC(C)(C)C2)ccc1NC(=O)NNC(=O)[C@@H](C)OCCOC	782105771	IYFQSMPAZUZIGW-OAHLLOKOSA-N	438.525	1.905	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2ccccc2OCC(=O)Nc2cccnc2)nc1	782148465	VVCMEWKATVKKNJ-UHFFFAOYSA-N	436.428	1.585	50	20	IDGD	
CCOc1cc(C)ccc1NC(=O)C(=O)NNC(=O)c1csc(N2CCOCC2)n1	782897028	LNLKGMWYUGGHBM-UHFFFAOYSA-N	433.490	1.087	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)[C@@H]1CCCCS1	783029412	YPIKTRFABHSXMK-KRWDZBQOSA-N	441.575	1.073	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)C(=O)NNc1ccc(OC)cc1	783036276	SOLBMZXIJIXXHN-UHFFFAOYSA-N	436.490	1.426	50	20	IDGD	
O=C(COc1ccccc1NC(=O)C(=O)NNc1cncc(Cl)n1)Nc1cccnc1	783266125	OWJWRRHFOGKRFI-UHFFFAOYSA-N	441.835	1.624	50	20	IDGD	
COc1ccc(C(=O)N2CCN(C)CC2)cc1NC(=O)C(=O)NNc1cc(C)ccc1C	783368526	BSTGEFFLNRRKDV-UHFFFAOYSA-N	439.516	1.781	50	20	IDGD	
Cc1ccc(C)c(NNC(=O)C(=O)Nc2cc(C3CC3)nn2[C@@H]2CCS(=O)(=O)C2)c1	783369019	GWEZCWVNTVPRNE-OAHLLOKOSA-N	431.518	1.819	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1ccc(C(F)(F)F)cc1Cl	784003864	QPOMPIWIZMCMJR-UHFFFAOYSA-N	448.810	1.936	50	20	IDGD	
N#Cc1ccc(NC(=O)C(=O)NNC(=O)CNC(=O)c2cccs2)cc1C(F)(F)F	784005338	WGPYKEIDHRHBNG-UHFFFAOYSA-N	439.375	1.154	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNc2cccc([N+](=O)[O-])c2)c(C(=O)N(C)C)cc1OC	784827809	JWBJTDMUUHCYBH-UHFFFAOYSA-N	431.405	1.396	50	20	IDGD	
COC(=O)c1cc(N2CCOCC2)ccc1NC(=O)C(=O)NNc1cc(C)ccc1F	784887806	LLDPUKLMRWVFSU-UHFFFAOYSA-N	430.436	1.839	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1cccc(-n2cccn2)c1	785331650	XSOGXKRWWCYOQF-UHFFFAOYSA-N	429.458	1.366	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)[C@H]1CC(c2c(F)cccc2F)=NO1	786523753	UUUBTCXBVHGJTO-OAHLLOKOSA-N	436.802	1.575	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)N[C@H]1CCCN(Cc2ccc(F)cc2F)C1=O	786967697	NRTXDIKIRCRADC-INIZCTEOSA-N	448.426	1.571	50	20	IDGD	
N#C/C(=C\c1ccc(O)cc1)C(=O)N[C@H]1CCCN(c2cc(N3CCOCC3)ncn2)C1	787352156	ZYDYFKVDCUQDEC-GQEMFKIVSA-N	434.500	1.711	50	20	IDGD	
O=C(NNC(=O)c1cccc(O)n1)c1cccc(S(=O)(=O)NCc2ccccc2)c1	788266576	XSSVDUPTODQKGM-UHFFFAOYSA-N	426.454	1.341	50	20	IDGD	
CC(C)(C)OC(=O)N1CC2(C[C@@H]2C(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)C1	789292427	ZYLSPHMUXAONTM-CQSZACIVSA-N	437.880	1.901	50	20	IDGD	
COc1cc(NNC(=O)C(=O)Nc2ccc(C(=O)N3CCN(C)CC3)cc2)ccc1Cl	789804622	HSVLQYNMGARIBQ-UHFFFAOYSA-N	445.907	1.818	50	20	IDGD	
C[C@@]12CCN(C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)C[C@H]1C2(Cl)Cl	790708965	MDFZDDZIODRVIQ-CXAGYDPISA-N	427.336	1.950	50	20	IDGD	
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC(C(=O)NNc2cccc(F)c2[N+](=O)[O-])CC1	791149671	HVAOXNZBDXHEPF-UHFFFAOYSA-N	440.457	1.618	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CN2CCN([C@@H](C#N)c3cccc(Cl)c3)CC2)c1	791622315	BNVSAKMSPQXZPM-FQEVSTJZSA-N	436.903	1.855	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)Cc2ccc(S(=O)(=O)N(C)C)cc2)c1C	792810222	USJXYIVZJFWQRK-INIZCTEOSA-N	433.530	1.711	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)NCC(=O)N2CCN(c3ccc(Cl)cc3)CC2)n1	792957457	WBMUDNULWKUIHT-UHFFFAOYSA-N	430.896	1.336	50	20	IDGD	
CS(=O)(=O)Nc1ccc(/C=C/C(=O)NNC(=O)CNC(=O)OCc2ccccc2)cc1	794061827	MUKXTTHFRKYBIV-FMIVXFBMSA-N	446.485	1.145	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)COCc2ccccc2)c(Br)c1	794589506	IXDXQRTZVRIFEP-UHFFFAOYSA-N	429.292	1.984	50	20	IDGD	
CCC(=NNC(=O)c1ccc(-n2cnnn2)cc1)c1ccc(Cl)c(S(=O)(=O)NC)c1	794851737	RMPDKBBQMWBMIN-UHFFFAOYSA-N	447.908	1.768	50	20	IDGD	
CCOc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccccc2)[nH]n1	799258045	YPFGWOGYOSSXLR-UHFFFAOYSA-N	438.400	1.783	50	20	IDGD	
CNC(=O)Cn1nc(NS(=O)(=O)c2ccc(OCCBr)cc2)cc1C	799537203	FLJBLFPMGSUFFQ-UHFFFAOYSA-N	431.312	1.512	50	20	IDGD	
CNC(=O)CNC(=O)c1cccc(NC(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)c1	800596746	PUAHBYVHBMJOIY-LBPRGKRZSA-N	447.879	1.436	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CCS(=O)(=O)c2ccc3c(c2)CCC3)cc1	801110139	PYTOHVPLWRQHSF-UHFFFAOYSA-N	429.498	1.434	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)N[C@H](C)CCNS(=O)(=O)c1ccccc1	801738549	RGHIMRRIZSGOHX-CQSZACIVSA-N	444.517	1.344	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)[C@H](CSC)N2C(=O)[C@H]3CCCC[C@@H]3C2=O)cc1	802063258	XHLRRLAVMNSFSF-JYJNAYRXSA-N	434.518	1.755	50	20	IDGD	
Cc1cc2ccc(C(=O)NNC(=O)c3cccc(S(=O)(=O)N4CCOCC4)c3)cn2c1	806306504	OYMOCFVBWCBOHI-UHFFFAOYSA-N	442.497	1.343	50	20	IDGD	
COCc1nc(Cl)cc(NNC(=O)Nc2ccc(S(=O)(=O)NC(C)(C)C)cn2)n1	806436512	VGZHEYXDHAXKPA-UHFFFAOYSA-N	443.917	1.897	50	20	IDGD	
Cc1cc([N+](=O)[O-])ccc1NNC(=O)C(=O)Nc1cnn(Cc2nnc3n2CCCC3)c1	807455503	IDRUQWZIOOXJNK-UHFFFAOYSA-N	439.436	1.158	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@@H]2c3ccccc3O[C@H]2C)cc1	812430781	RNKIEDWPOTVKID-LIRRHRJNSA-N	432.502	1.468	50	20	IDGD	
COc1cc(OC)c(NC(=O)C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)cc1F	813033258	LGMPWAXHNVHWFQ-UHFFFAOYSA-N	440.453	1.175	50	20	IDGD	
Cc1nsc(NC2CC2)c1C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	814201115	SVOMMKUWUXERMK-UHFFFAOYSA-N	428.562	1.999	50	20	IDGD	
O=C(NNc1ncccc1F)C(=O)Nc1ccc([N+](=O)[O-])c(I)c1	815646047	XXWNFBZDOGQPFD-UHFFFAOYSA-N	445.148	1.815	50	20	IDGD	
COC(=O)Nc1cccc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)N(C)C)c1C	815751500	BVVRQNCFTBZUJA-UHFFFAOYSA-N	449.489	1.505	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)N(C)C)c(Cl)n1	815751674	JMNVHOCDNOUHHB-UHFFFAOYSA-N	427.870	1.076	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)c2cnn(-c3ccc(O)nn3)c2C)c1	818756566	BBQQCJZSUBCEJY-UHFFFAOYSA-N	447.249	1.982	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2CCN(C(C)C)C[C@@H]2c2cnn(C)c2)cc1	849487541	OWNZXXWJGVZUIH-RBUKOAKNSA-N	426.521	1.329	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)[C@@H]2CS[C@@H](Cc3ccccc3F)C(=O)N2)cc1	892122177	SKIPRCAJRDGXLX-ROUUACIJSA-N	431.489	1.503	50	20	IDGD	
CC(=O)c1cccc(S(=O)(=O)NCC(=O)NNC(=O)COc2cc(C)cc(C)c2)c1	913446088	JRJHERLDEGCTDS-UHFFFAOYSA-N	433.486	1.011	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)NCc1ccc(C(=O)N2CCOCC2)cc1	913627952	IOTQGXDOIXTXBT-UHFFFAOYSA-N	436.472	1.259	50	20	IDGD	
N#CCCn1cc(/C=C(/C#N)C(=O)NCCC(=O)N2CCOCC2)c(-c2ccccc2)n1	914472237	VXUTUIMCKGMZBS-CYVLTUHYSA-N	432.484	1.736	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccccc2)C1	915270376	VHIBBFUMTWTOEN-MRXNPFEDSA-N	447.513	1.322	50	20	IDGD	
Cc1nn(-c2ccc(F)cc2)c(C)c1CC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	916144874	UFGUUJROZNBTGZ-UHFFFAOYSA-N	434.435	1.608	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCCOC2CCCCC2)c1	916201305	LTHUXOJICHTHEI-UHFFFAOYSA-N	426.539	1.620	50	20	IDGD	
O=C(NC[C@@H]1Cc2ccccc2O1)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	916516315	SPCZFJIMGIOMTN-KRWDZBQOSA-N	444.513	1.419	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(C)c(C(=O)NNC(=O)CCc2ccc(OC)cc2)c1	919836221	FMISXEYKIMFBGU-UHFFFAOYSA-N	449.529	1.322	50	20	IDGD	
CNC(=O)NNC(=O)[C@@H](CCSC)NS(=O)(=O)c1ccc(Cl)c(Cl)c1	919877975	WHPNAMVFKKRNIT-LLVKDONJSA-N	429.351	1.354	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NN=Cc2cn(C)nc2-c2cccnc2)cc1	920364293	BOGLUWFDTGIITA-UHFFFAOYSA-N	426.502	1.561	50	20	IDGD	
C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	920765878	LOMPJLANVBULLC-SNVBAGLBSA-N	441.849	1.880	50	20	IDGD	
CN1CCN(c2ncccc2CNC(=O)NNC(=O)c2cc(Br)c[nH]2)CC1	921247228	CDYQBLHMLAUYBS-UHFFFAOYSA-N	436.314	1.068	50	20	IDGD	
CN(C)C(=O)c1cccc(S(=O)(=O)NNC(=O)c2ccc(Br)cc2)c1	1115864036	SYEVTEVOOQCZCV-UHFFFAOYSA-N	426.292	1.774	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3sc(N(C)C)nc3C)CC2)cc1	1253941456	ITJOXHHGGHJBON-UHFFFAOYSA-N	430.578	1.405	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)C34C[C@H]5C[C@@H](CC(O)(C5)C3)C4)CC2)cc1	1322679300	IXRNTVODFVVGSY-AGYDLCDTSA-N	440.588	1.591	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NC2CCN(c3cccc(F)c3)CC2)c2ccccc2c1=O	1329072635	BWDUEVFKQQCMCK-UHFFFAOYSA-N	438.463	1.686	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(CCN(C(=O)c3n[nH]c4c(F)cccc34)C2)C1	1778634756	QQGONMBEDIPHBT-FQEVSTJZSA-N	434.544	1.997	50	20	IDGD	
C#CCCCC(=O)N1CCO[C@@]2(CCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1	1780098709	RALZFFQUXJRDLS-QFIPXVFZSA-N	443.456	1.767	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)Cc3cn4nc(C)sc4n3)CCO2)C1	1781214653	BALIQTVOQABNDJ-KDOFPFPSSA-N	425.942	1.489	50	20	IDGD	
CC(C)(C)n1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](F)Br)C3)C2)n1	1781325644	GMQVOGGKXVADMU-SUMWQHHRSA-N	431.306	1.772	50	20	IDGD	
O=C(COCc1ccccc1)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781327971	FUYNXEUBIVGLFK-AEFFLSMTSA-N	429.286	1.724	50	20	IDGD	
O=C(c1cc2cn[nH]c2cn1)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781331515	MBZJRNCZYRVNFY-BBRMVZONSA-N	426.246	1.092	50	20	IDGD	
CC(=O)N/C(C)=C/C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)Br)C1	1782002535	QZNPMBQLIXHEPB-OWZNBKATSA-N	430.343	1.324	50	20	IDGD	
Cc1c(F)ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](C)Br)C3)C2)c1N	1783532547	KCCYMMLWEDOXBT-KPZWWZAWSA-N	428.302	1.943	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](C)Br)C3)C2)cc1OC	1783537313	NKWNKBANFYUZIZ-YJYMSZOUSA-N	441.322	1.931	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]3C2)nn1C	1783967640	HSPAABWAADPJJW-PCBIJLKTSA-N	427.343	1.353	50	20	IDGD	
Cc1nccn1CCCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1784409893	TXQRBMUDACJEIR-WBVHZDCISA-N	431.306	1.492	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ncc(OC)cc3F)[C@H]2C1	1785738639	CULXUTXONVLONH-PCBIJLKTSA-N	429.876	1.076	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3=NO[C@H](c4ccccc4)C3)[C@H]2C1	1788143297	UVVVECIOTPBSOQ-GCLMUHHRSA-N	449.935	1.738	50	20	IDGD	
CCN(CC)C[C@@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]2C1	1788763398	BRYHRZKGHGKWNE-XWSJACJDSA-N	427.662	1.796	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/C(=O)NCc3ccccc3)C[C@@H]21	1789857973	ONQQGSJEAZLJJK-JSJLCOFSSA-N	447.963	1.856	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)COc3ccccc3)C[C@@H]21	1791058167	SIZKEESOIPUYTG-OTRWWLKZSA-N	425.323	1.829	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(-n4cccn4)cc3)C[C@@H]21	1791256898	LGARMEMEXKNNDY-FFGOWVMKSA-N	446.935	1.719	50	20	IDGD	
O=C1Nc2ccccc2/C1=C/C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]2C1	1791298338	QNXOAIYLQZQPBQ-LYMJBUCYSA-N	438.311	1.806	50	20	IDGD	
O=C(Cc1cc(F)ccc1[N+](=O)[O-])NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21	1792229385	HLUCAXLKQSGSSN-MSMFTSAESA-N	431.823	1.791	50	20	IDGD	
Cc1cccc(C)c1N1C[C@H](C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](O)CCl)CC1=O	1793110963	SYWVOZVOEMBYEK-FQBWVUSXSA-N	447.963	1.894	50	20	IDGD	
Cc1nnc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Br)C3)s1	1794107498	GNPNNKNKWBVUOU-DJBIQUGXSA-N	435.319	1.059	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(-c3cccnc3)[nH]n1)C2	1795115654	FCHLOMVQBOTYFJ-ZSBFGKGUSA-N	448.321	1.460	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCBr	1795492212	AVAFQSAZZLRVSA-ZVMOGAGKSA-N	438.326	1.544	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)c1cc(-c2ccccc2)[nH]n1	1796191835	DRJOJPGITDYNRI-ACDBMABISA-N	444.300	1.322	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCC1CCC1)C2	1796439632	TVNMMURHQBYBAG-NAMOIKSGSA-N	429.521	1.290	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ncn(-c2ccccc2)n1	1796538970	KWLWFFFXLAIMQS-CYGHRXIMSA-N	431.924	1.878	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1C=CCN1	1796753178	PBEOBPIMOXNBPR-KRXQYRFLSA-N	428.445	1.300	50	20	IDGD	
CN(CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](F)Cl)NC(=O)NCc1ccccc1	1796808587	QOYYJHZEORGXPS-KYHPRHEASA-N	439.919	1.505	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2nccn2c1	1797081253	RUCOMSQWZFSSSL-MVWRLGRASA-N	425.316	1.774	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc3c1OCC3)C2)[C@H](F)Br	1799347592	QQRFFNSSXSNXKX-LMWOUKEDSA-N	427.270	1.515	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)cc([N+](=O)[O-])c1	1799728478	SEKOYTRLFAMZFL-RMHZUWNSSA-N	425.869	1.911	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnn2cccc(F)c12	1800123660	ICCIPWBXHUSMHD-RHQBZFHZSA-N	443.306	1.913	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cn3cccnc3n1)C2	1800641128	ODPKHQDIMLJAOD-XFMPKHEZSA-N	436.310	1.106	50	20	IDGD	
COc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)Br)cc(Cl)n1	1800760507	PSVGHKYZGHDMRQ-BTABJRDXSA-N	446.729	1.730	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2	1800977704	WCPYGFSJZCKAEN-WJNVRWDZSA-N	433.288	1.208	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2)c1ccc2c(c1)CCCO2	1801676978	OYYRVEIFPINSQU-HGKCTWBKSA-N	437.334	2.000	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)Cn2nnc3ccccc32)[C@H]1c1cccnc1)[C@@H](O)CCl	1803136794	VIKLFBIGUJMLJR-QSFXBCCZSA-N	442.907	1.132	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)Cn2ccncc2=O)[C@H]1c1cccnc1	1803693654	AOVMWPHHADEFRP-ZWOKBUDYSA-N	431.924	1.752	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC2(CCN(C(=O)[C@@H]3CCNC(=O)C3)CC2)C1	1805390057	ZMQXLLPCXVNTTO-HUUCEWRRSA-N	428.371	1.775	50	20	IDGD	
O=C(NCC(=O)N1CCC2(CCCN(C(=O)[C@@H](O)CCl)C2)CC1)c1cccs1	1805517298	ATOABONSCJSHIW-AWEZNQCLSA-N	427.954	1.309	50	20	IDGD	
O=C(/C=C\C(=O)N1CC[C@@H](CNC(=O)CCBr)[C@@H]1c1cccnc1)NC1CC1	1806344479	ZVASNPGSJNSWHD-SXZZRKSZSA-N	449.349	1.707	50	20	IDGD	
COCCOCC(=O)NC[C@@H]1CCN(C(=O)[C@H](C)Br)[C@H]1c1cccnc1	1806761695	KLSKMPLAOMKYNV-QRTARXTBSA-N	428.327	1.534	50	20	IDGD	
C[C@H](Cn1cncn1)C(=O)NC[C@H]1CCN(C(=O)CO[Si](C)(C)C)[C@@H]1c1cccnc1	1810476047	BLFXWQBJTUXXLB-YVWKXTFCSA-N	444.612	1.867	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@H]1CCN(C(=O)CSc2nc[nH]n2)[C@H]1c1cccnc1	1810548428	QXVFEZGAKKQOEH-QAPCUYQASA-N	448.625	1.849	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H](CNC(=O)CO[Si](C)(C)C)[C@@H]1c1cccnc1)n1cnnn1	1810548650	RWWIAQKMJMMGEB-KYJSFNMBSA-N	431.573	1.187	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)Cn2ccncc2=O)[C@@H]1c1cccnc1	1812344930	GADDPGSMHPBREF-JOQOYGCGSA-N	448.321	1.128	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)Cc2cncnc2)[C@@H]1c1cccnc1	1812864600	JDIUNKDMNGWFKY-FDQGKXFDSA-N	432.322	1.904	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)Cc2cscn2)[C@@H]1c1cccnc1	1813071182	ODKKADIOHOODNV-IIBYNOLFSA-N	444.561	1.160	50	20	IDGD	
Cn1cc(CC(=O)NC[C@@H]2CCN(C(=O)[C@H](F)Br)[C@H]2c2cccnc2)cn1	1813458817	AEJLHVMEXSFMAK-XIRDDKMYSA-N	438.301	1.754	50	20	IDGD	
CN(C)C(=O)NCC(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@](C)(Cl)CCl)[nH]n1	1814564196	XBGMMWXVWWAWKP-SJKOYZFVSA-N	433.340	1.909	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)cc([N+](=O)[O-])c2)[nH]n1)[C@@H](O)CCl	1814873000	QFYJHFOSGOUKDG-CABCVRRESA-N	437.840	1.929	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1ccsc1)CC2)c1ccc(B(O)O)cc1	1815339751	OELBNEAIRXPVTD-AWEZNQCLSA-N	427.316	1.424	50	20	IDGD	
Cc1cnc2c(C(=O)Nc3cc([C@H]4CCCCN4C(=O)[C@@H](O)CCl)[nH]n3)cnn2c1	1819070967	JNZAYPZQRUIAEP-CABCVRRESA-N	431.884	1.666	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1)c1ccccc1-n1nccn1	1821203626	CZWYLLKLQOQJFE-SJORKVTESA-N	443.895	1.896	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnc(N)s2)[nH]n1	1822414531	WCYUSSVCQWEDGR-LBPRGKRZSA-N	434.526	1.127	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(O)cc2)[nH]n1	1822415879	SZGANKICRXYIRO-QGZVFWFLSA-N	428.493	1.794	50	20	IDGD	
O=C(N[C@@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1)c1cccc(=O)n1O	1823002455	RBZZSKSTJUQIBH-KRTXAFLBSA-N	445.270	1.458	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(O)c(F)c1)CC2	1826089035	WIQFGRRZMFGAMD-LBPRGKRZSA-N	449.508	1.587	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1CCc2nc(NC(=O)CCn3cncn3)sc2C1	1826608529	NJHXICLQHFVLIV-QLJPJBMISA-N	431.349	1.973	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC([C@H]2CCCCN2C(=O)Cn2ccnn2)CC1	1827235293	ZYYZWQIVQCLORZ-GOEBONIOSA-N	426.359	1.929	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)Cc2ccncc2)CC1	1830175940	OEVHOMRGJLRNEZ-HXUWFJFHSA-N	429.565	1.617	50	20	IDGD	
O=C(Cc1ccc(Cl)c(F)c1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1	1830291308	QUZKEGKGSJRDMU-LPHOPBHVSA-N	449.306	1.078	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)C3(O)CCC3)C2)C1	1830533452	NTMFMGLEMWAZKB-RKVPGOIHSA-N	447.370	1.025	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(O)cc3)C2)C1	1830543562	URKXRYQEFOMOSF-IFXJQAMLSA-N	441.322	1.493	50	20	IDGD	
Cc1ccc(CCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)cc1F	1830726899	VVDLNUZGCSWONI-GHTZIAJQSA-N	442.915	1.123	50	20	IDGD	
Cc1cc(Cl)cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)c1	1830738603	QMYPWJHDCVLXJZ-VQIMIIECSA-N	431.316	1.318	50	20	IDGD	
CC(C)[C@@H](S)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)CBr)C2)C1	1831482995	JEHFRYOAYJYZBQ-CKEIUWERSA-N	437.400	1.428	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CC(OCC)OCC)C2)C1	1831656559	GNCPWNVUKMGGCS-UZLBHIALSA-N	434.961	1.640	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)CO[Si](C)(C)C)CC1	1831873693	SVKZLETUOCHFOA-GOSISDBHSA-N	440.661	1.831	50	20	IDGD	
Cc1nn(C)cc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1	1831877070	SCSFVNOSTRVUNY-ZWKOTPCHSA-N	433.336	1.035	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)CCc2ccoc2)CC1	1832343519	QNNJMKQJUPOXNA-QFIPXVFZSA-N	438.333	1.826	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(OC)s3)CCO2)C1	1833426235	YULPVYFZZDWEQU-SCLBCKFNSA-N	432.926	1.081	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)C3CCC(CO)CC3)CC2)CC1	1833722919	GWQARVHPOLFXND-LBXVMSDZSA-N	444.016	1.611	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCBr)C3)C2)nc1	1834374279	NRRUAJJPONYTRF-GOSISDBHSA-N	426.311	1.245	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1834502360	CGJFJPXECGUSCI-IBGZPJMESA-N	425.932	1.540	50	20	IDGD	
O=C(Cc1ccccc1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1834997467	CPDLIXMNVIKFBJ-FUHWJXTLSA-N	429.286	1.376	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3csc(N)n3)CCO2)C1	1835796647	BDLKBABCCRGAMR-CVEARBPZSA-N	437.349	1.032	50	20	IDGD	
Cc1cc(C)nc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)c1	1836312153	ZXJXWZUKZGRTJJ-YJBOKZPZSA-N	444.301	1.459	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccn3nccc3c1)CCO2	1837160267	HZBOUJSWKZQTIK-NRFANRHFSA-N	446.580	1.256	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCBr)C3)C2)c(C)n1	1838360553	ZMNHAFCSCGUWJW-LJQANCHMSA-N	440.338	1.553	50	20	IDGD	
Cc1ccc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)cn1	1839150326	JJKIHHKTTQPFRD-VQTJNVASSA-N	444.359	1.625	50	20	IDGD	
COc1ccccc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839201950	OMXMHDFGXBAUPD-CRAIPNDOSA-N	445.285	1.456	50	20	IDGD	
O=C(c1cccc(-c2cnco2)c1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1839365300	CVFHPUZRGPXJBR-PXNSSMCTSA-N	437.855	1.946	50	20	IDGD	
O=C(c1nc2ccccc2o1)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1839503754	WMCSHFOBSODKAF-GOSISDBHSA-N	428.272	1.702	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(Cl)c3C)C2)C1	1840149781	ZXMDXLWFQVLATP-XLIONFOSSA-N	445.343	1.972	50	20	IDGD	
O=C(c1n[nH]c2ccc(F)cc12)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840188416	IILZSRJFSRGHEQ-SFHVURJKSA-N	445.278	1.576	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)C3CCSCC3)CCO2)C1	1840925682	ACYMLCGQLWFDFE-QAPCUYQASA-N	449.411	1.760	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)c1ccc(-n3c(O)nnc3O)cc1)C2	1841669557	LKKDCCKRJWFWKT-HNNXBMFYSA-N	433.896	1.903	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)c2ncccc2-c2ccccc2)C1	1843545300	HGCWSNBAQABGBI-UHFFFAOYSA-N	435.528	1.939	50	20	IDGD	
N#C/C(=C\c1ccc(Br)cc1)C(=O)N1CC2(CCCN2C(=O)COCCO)C1	1845213286	WUPVOHQGJMYHSJ-MHWRWJLKSA-N	448.317	1.568	50	20	IDGD	
CCOC(=O)c1ncn2cc(C(=O)N3CC4(CCCN4C(=O)[C@@H](Cl)COC)C3)ccc12	1846361732	MCCFHDQWHFAVQJ-HNNXBMFYSA-N	448.907	1.582	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@H]2C[C@H](NC(=O)OC(C)(C)C)C2)C1	1847041242	JBWGKPLGIHHGLX-RBSFLKMASA-N	429.945	1.747	50	20	IDGD	
C[C@@H](C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cccc(B(O)O)c1)c1ccc(Cl)cc1	1847408336	BZAKDKXFNPHMLS-UAOJZALGSA-N	426.709	1.639	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl)C1CC1	1847557513	DOBIDVZUICRGSU-YHUYYLMFSA-N	429.945	1.481	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H]1CC(=O)CN1C(=O)OC(C)(C)C	1847644376	DIJIHQHQLBYVOR-VGWMRTNUSA-N	443.928	1.021	50	20	IDGD	
CCn1c(NNC(=O)[C@@H]2CC(=O)N(c3ccc4c(c3)OCCO4)C2)nc2ccccc2c1=O	9856970	WYUHZTCKSKLRJU-CQSZACIVSA-N	449.467	1.684	50	20	IDGD	
COc1ccc(C(=O)NNc2nnc(C)c(=O)[nH]2)cc1S(=O)(=O)Nc1ccc(C)cc1	11265988	JDOGLKCYVBXOBN-UHFFFAOYSA-N	444.473	1.348	50	20	IDGD	
CCC1CCC2(CC1)NC(=O)N(CC(=O)NNC(=O)c1cc(-c3ccccc3)n[nH]1)C2=O	17519037	UYCGPWAQKWHTNE-UHFFFAOYSA-N	438.488	1.729	50	20	IDGD	
CCn1cc(Br)cc1C(=O)NNC(=O)c1sc(N2CCOCC2)nc1C	110017365	QVJKDICNKZBFFI-UHFFFAOYSA-N	442.339	1.947	50	20	IDGD	
CC(=O)[C@@H]1CC(C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)=NN1c1ccccc1	110889114	RYVJYQZRESVDKF-FQEVSTJZSA-N	441.513	1.794	50	20	IDGD	
O=C(CCN1CCN(C(c2ccccc2)c2ccccc2)CC1)NNC(=O)c1cnc[nH]1	725878846	XDEWWENRIWXOTI-UHFFFAOYSA-N	432.528	1.968	50	20	IDGD	
C[C@@H](NC(=O)NN[C@]1(C)CCS(=O)(=O)C1)c1cc(F)ccc1N1CCN(C)CC1	726280897	ZETXOSSJALRBMM-AUUYWEPGSA-N	427.546	1.020	50	20	IDGD	
CC[C@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	727114918	GENYXHJJBFVHCJ-SFHVURJKSA-N	433.553	1.649	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)NC2CCN(C(=O)C3CC3)CC2)c1	728742586	JZBQPDOKXIGUDR-UHFFFAOYSA-N	439.310	1.803	50	20	IDGD	
O=C(COc1ccc(N2CCCC2=O)cc1)NNC(=O)C1CCN(c2ncccn2)CC1	728847381	CJDZLUJXWNJZBX-UHFFFAOYSA-N	438.488	1.046	50	20	IDGD	
CC(C)NS(=O)(=O)Cc1ccc(CNC(=O)NNC(=O)c2cccc(C#N)c2)cc1	728950294	JLRQABNMLIQPDH-UHFFFAOYSA-N	429.502	1.530	50	20	IDGD	
O=C(NNC(=O)N1CCC(N2CCNC2=O)CC1)c1ccc(Br)cc1Cl	728956400	UCZZROATPWZBKE-UHFFFAOYSA-N	444.717	1.947	50	20	IDGD	
O=C(CCc1ccccc1O)NNS(=O)(=O)c1ccc(C(=O)NCC(F)(F)F)cc1	729965105	NVHFEUFQVDORRY-UHFFFAOYSA-N	445.419	1.627	50	20	IDGD	
CCCS(=O)(=O)c1ccccc1S[C@@H](C)C(=O)N([C@H]1CCS(=O)(=O)C1)N(C)C	730452058	VNXBFBVMDPLBOP-GJZGRUSLSA-N	448.632	1.843	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)NC1CCN(CC(=O)Nc2ccccc2)CC1	731358758	GKEQSOOUVXBYSO-UHFFFAOYSA-N	427.480	1.802	50	20	IDGD	
Cc1c(C(=O)NNC(=O)COc2ccc(C#N)cc2)nnn1-c1ccc2c(c1)OCCO2	731470008	IQGUHUWUUAUSKX-UHFFFAOYSA-N	434.412	1.059	50	20	IDGD	
CC(C)S(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)CNC(=O)c2cccs2)c1	731987074	OJAZGQPMVKPYGK-UHFFFAOYSA-N	427.479	1.260	50	20	IDGD	
O=C1N[C@H](C(=O)NNc2nc(-c3cccnc3)no2)CS[C@H]1Cc1ccccc1F	732111063	ZBYAVCJKZOJEJZ-GJZGRUSLSA-N	428.449	1.557	50	20	IDGD	
CC(C)S(=O)(=O)c1ccc(F)c(C(=O)OCC(=O)NNC(=O)c2cccs2)c1	732396592	QCCYBFQRWNBLHI-UHFFFAOYSA-N	428.463	1.687	50	20	IDGD	
CCOCCCn1c(NNC(=O)c2nc3nc(C)cc(C)n3n2)nc2ccccc2c1=O	733268065	IPGNPHOXHHLVMY-UHFFFAOYSA-N	436.476	1.635	50	20	IDGD	
COc1ccc([N+](=O)[O-])cc1NS(=O)(=O)c1ccc(C(=O)NNc2cnccn2)cc1	734242695	VBOZBVYRANLTJN-UHFFFAOYSA-N	444.429	1.951	50	20	IDGD	
COc1ccc(S(=O)(=O)C[C@@H](C)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)cc1	734990855	BXMJDGZGTCIXCS-KGLIPLIRSA-N	438.477	1.859	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)c1ccc2c(c1)C(=O)N(C[C@H]1CCCO1)C2=O	737636751	DNJZGRHIFOXGJF-QGZVFWFLSA-N	437.452	1.439	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)cc1NC(=O)NC(C)(C)C	740819284	ZJIDYMPOHUMNAY-ZDUSSCGKSA-N	425.511	1.046	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)[C@@H]1CSCN1C(=O)c1ccc(Cl)cc1	740852074	JKJUTXVIHRLFJK-AWEZNQCLSA-N	426.926	1.307	50	20	IDGD	
CC(=O)Nc1cc(F)c(S(=O)(=O)NNC(=O)COc2ccccc2O)c(F)c1Cl	742291641	GBTZZXIMVVHWLZ-UHFFFAOYSA-N	449.819	1.671	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)CN1CCN(c2ccccn2)CC1	743415969	HWBGUJJLXJMNIH-UHFFFAOYSA-N	446.577	1.424	50	20	IDGD	
C[C@H](C(=O)NC1CC1)N1CCN(C(=O)NNC(=O)c2cccc(Br)c2)CC1	743686453	CMUPTYYNHUEPIZ-GFCCVEGCSA-N	438.326	1.088	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1cc([N+](=O)[O-])ccc1O)c1cccc(N2CCOC2=O)c1	745781420	OEKUXSGLLFUAFW-NSHDSACASA-N	429.389	1.962	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)N[C@@H]2CC(=O)N([C@H]3C[C@@H]3c3ccccc3)C2)cc1	745914074	HQZASSXTLAQBDK-RLLQIKCJSA-N	433.468	1.424	50	20	IDGD	
C[C@H](NC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)c1cccc(C#N)c1	745923409	QGORVXJXWXGIEX-HNNXBMFYSA-N	443.533	1.277	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H]2C[C@@](C)(OC)C2(C)C)c1	745932139	KMTBMEAEEOSCAY-OXQOHEQNSA-N	440.566	1.865	50	20	IDGD	
CC[C@@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)C1CCOCC1	746427240	VDWXLJAHYZRIRU-GOSISDBHSA-N	438.550	1.620	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(=O)n(CC(=O)NNc2cc(F)c(F)c(F)c2)c1	746701711	XNMWCOZFAJCVNS-UHFFFAOYSA-N	432.424	1.439	50	20	IDGD	
COC(=O)c1ccsc1N1CC[C@@H](NC(=O)NNC(=O)C(C)(C)c2ccccc2)C1=O	746779867	LKWZESPIRDLZMD-OAHLLOKOSA-N	444.513	1.948	50	20	IDGD	
CC(C)NS(=O)(=O)CCNC(=O)NNC(=O)COc1ccccc1-c1ccccc1	746972935	NZMLCIAIOXCBMC-UHFFFAOYSA-N	434.518	1.391	50	20	IDGD	
Cn1ccc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)c1	747955515	QRIMEVMBEGOLQU-UHFFFAOYSA-N	441.513	1.648	50	20	IDGD	
CCS(=O)(=O)N[C@H](CCSC)C(=O)NNc1ccc(S(=O)(=O)C(F)F)cc1	748610377	LOQZQKUARZDORC-GFCCVEGCSA-N	445.535	1.187	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)N[C@@H]1CCCN(Cc2ccc(F)cc2Cl)C1	748631187	LNRYJFRYDGEPQO-CZUORRHYSA-N	430.908	1.825	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1	748633131	HMDWJEPMRREQRV-ZIAGYGMSSA-N	430.452	1.639	50	20	IDGD	
C[C@@H]1C(=O)Nc2cc(C(=O)NNc3ccc(S(=O)(=O)NC4CC4)cc3)ccc2N1C	749955210	FZWHSTRCTTYBBI-GFCCVEGCSA-N	429.502	1.661	50	20	IDGD	
O=C(NNC(=O)N1CCO[C@]2(CCc3ccccc32)C1)C1CCN(c2ncccn2)CC1	753058263	QEMVKQVGXKBZFY-HSZRJFAPSA-N	436.516	1.608	50	20	IDGD	
Cc1oc(C(=O)NNC(=O)Nc2ccc(OC(F)F)cc2)cc1S(=O)(=O)N(C)C	754204851	MHXJDHUENPOSOW-UHFFFAOYSA-N	432.405	1.906	50	20	IDGD	
COc1cc(C(=O)NNc2ccc(C(F)(F)F)nn2)cc(NS(C)(=O)=O)c1OC	755191338	DGGYVZJYNRWSAM-UHFFFAOYSA-N	435.384	1.641	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)Nc2ccc(S(=O)(=O)N3CCC[C@@H](C)C3)cc2)n1	755447492	OSADHHAHZJKWGC-CQSZACIVSA-N	448.549	1.773	50	20	IDGD	
CCn1nc(C)c(C=NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1C	755491199	VJTMVRFFXZTEEK-UHFFFAOYSA-N	447.561	1.624	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)Nc1ccc(NC(=O)CN2CCOCC2)cc1	755600968	XPOPLNBSFZUKFM-UHFFFAOYSA-N	441.488	1.448	50	20	IDGD	
Cn1c(=O)c2cc(NC(=O)NNC(=O)Cc3ccc4ccccc4c3)cnc2n(C)c1=O	755846743	GMVSUJUPJNLASU-UHFFFAOYSA-N	432.440	1.181	50	20	IDGD	
Cc1ccc(C#N)cc1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	756261254	BCRMITPTFOXSID-UHFFFAOYSA-N	443.485	1.354	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)Nc1ccc(S(=O)(=O)NC2CC2)cc1	756774244	BCORXSLKHSQJON-UHFFFAOYSA-N	449.445	1.267	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)Nc1ccc(C[C@@H]2CC(=O)NC2=O)cc1	756815512	LMFAEKQUGWMQKR-CQSZACIVSA-N	442.497	1.845	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N[C@H](C)[C@@H](C)CO)cc1	757090310	WSWHPAIWCHWPGT-KBQQKMGSSA-N	425.489	1.474	50	20	IDGD	
O=C(c1cccc(Br)c1O)N1CCN(S(=O)(=O)CBr)CC1	758522447	IDBICWYFWKCLEN-UHFFFAOYSA-N	442.129	1.595	50	20	IDGD	
Cc1cc(C(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)ccc1-n1cncn1	758787799	WDKKMAKZEUCOBY-UHFFFAOYSA-N	443.508	1.825	50	20	IDGD	
O=C(NNC(=O)c1ccc(S(=O)(=O)N2CCCCCC2)cc1)C(=O)Nc1ccccn1	758832569	HDLLAMWRPSLWGK-UHFFFAOYSA-N	445.501	1.046	50	20	IDGD	
Cc1nc(-c2cccnc2)nc(O)c1CC(=O)NNC(=O)c1cc(-c2ccccc2)[nH]n1	762937709	LDXGEJOKMZUJJW-UHFFFAOYSA-N	429.440	1.946	50	20	IDGD	
CC(C)C(=O)N1CCCC[C@H]1C(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	763283020	PPVMCGULTMIIKC-INIZCTEOSA-N	439.557	1.659	50	20	IDGD	
CSc1cnn(-c2ccccc2)c1NC(=O)C(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	763470037	FBUVQVWCUVFBIX-UHFFFAOYSA-N	440.441	1.902	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ccccc2Br)cn1C	763484375	YPAXDJRXLZQQOQ-UHFFFAOYSA-N	437.250	1.364	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)N3CCSCC3)cc2C)c(C)o1	763576602	OZXKAFJLBUHIFQ-UHFFFAOYSA-N	444.513	1.794	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1ccc(OC[C@H]2CCCO2)cc1	763623156	CQBWAMVKMQFBBB-QGZVFWFLSA-N	437.456	1.600	50	20	IDGD	
Cc1ccc(-n2cc(C)cn2)c(NC(=O)C(=O)NNC(=O)c2c(C)nc3ccccn23)c1	763629559	MSDMZKGAXJDTAA-UHFFFAOYSA-N	431.456	1.845	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccn([C@H](C)c2ccccc2)n1	763647128	NRCLAQQUEJWWHQ-OAHLLOKOSA-N	437.456	1.666	50	20	IDGD	
O=C(CN1CCCc2ccccc21)NNC(=O)C(=O)Nc1c(F)c(F)c(F)c(F)c1F	763746496	YTSFHPAECRIXMG-UHFFFAOYSA-N	442.344	1.921	50	20	IDGD	
CCCn1ccc2cc(NC(=O)C(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)ccc21	763790490	JCBDIPRMHAOTKF-UHFFFAOYSA-N	446.467	1.698	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(C(=O)NCC(C)C)cc2)cc1	763812112	PSXSAJNYZQUNRK-UHFFFAOYSA-N	426.473	1.546	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccn(CCc2ccncc2)n1	763865883	SHAHIUGHBWCDCG-CQSZACIVSA-N	440.435	1.213	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)N2C[C@@H](C)Oc3ccccc32)cc1	763870655	BIWOKISSPVMFJQ-UKRRQHHQSA-N	425.441	1.618	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)nn1-c1ccccc1	763870715	BTRSLHNWHUVMLS-CQSZACIVSA-N	425.420	1.873	50	20	IDGD	
O=C(CCSc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccnn1-c1ccncc1	763895970	VMVGNAZVNQDRRZ-UHFFFAOYSA-N	428.449	1.675	50	20	IDGD	
C#CCOc1cc(F)ccc1NC(=O)C(=O)NNC(=O)c1ccc(OCC)c(OC)c1	763901208	MFCFUKIZBCNZTK-UHFFFAOYSA-N	429.404	1.645	50	20	IDGD	
CNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2ccc(Br)s2)c1	763940455	HHHHIRYVQDCPPW-UHFFFAOYSA-N	425.264	1.270	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)on1)C(=O)Nc1cccnc1Br	764003816	OWNSSYYBFVVUDB-UHFFFAOYSA-N	430.218	1.899	50	20	IDGD	
CC(C)n1nnnc1-c1ccc(NC(=O)C(=O)NNC(=O)Cc2ccsc2)cc1F	764035795	SOQJKZHZUVDMQV-UHFFFAOYSA-N	431.453	1.450	50	20	IDGD	
O=C(NNC(=O)c1cccc(Br)c1)C(=O)Nc1cccc(N2CCNC2=O)c1	764058459	IRQUPNMOUDWOMV-UHFFFAOYSA-N	446.261	1.378	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CCc2ccco2)cc1I	764166476	LBSCXVUWERNSAG-UHFFFAOYSA-N	441.225	1.911	50	20	IDGD	
O=C(NNC(=O)c1cccc2ncccc12)C(=O)Nc1ccc(-n2cncn2)c(Cl)c1	764258341	ZKNSLIGGGNXKBP-UHFFFAOYSA-N	435.831	1.869	50	20	IDGD	
CC(C)(C)OC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)CCc2ccccc2O)cn1	764277429	DSCFTCNWXIXUCN-UHFFFAOYSA-N	443.460	1.853	50	20	IDGD	
CCOCC(=O)NNC(=O)C(=O)Nc1cc(I)ccc1Cl	764325890	WPJUBBLONBMETC-UHFFFAOYSA-N	425.610	1.067	50	20	IDGD	
COc1ccc(NC(C)=O)cc1NC(=O)C(=O)NNC(=O)CSc1ccccc1OC	764392885	MKSNJEFFRBEGKU-UHFFFAOYSA-N	446.485	1.540	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1cc(C(=O)Nc2ccccc2)ccc1C	764401783	XJXDPWDQCGQZRO-OAHLLOKOSA-N	442.472	1.385	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)CCC(=O)N2CCN(c3ccccn3)CC2)c1	764527010	MYGFTOZHBUMUDO-UHFFFAOYSA-N	425.489	1.045	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNS(=O)(=O)c1cnn(-c2ccccn2)c1C	765026435	CPQVSUYZEXVVGJ-UHFFFAOYSA-N	431.474	1.363	50	20	IDGD	
C[C@@H](CC(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1)C1CCN(C(=O)OC(C)(C)C)CC1	765071250	SBQLDRJAYAUFRK-ZFWWWQNUSA-N	446.570	1.177	50	20	IDGD	
Cn1c(=O)nc(O)c2c(C(=O)NNC(=O)CSc3ccccc3O)cc(C3CC3)nc21	765248624	HBXOEUHNXHJFGS-UHFFFAOYSA-N	441.469	1.170	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)c1ccc(S(C)(=O)=O)cc1	765320577	QKQGSHUQDMDFJP-CYBMUJFWSA-N	427.523	1.646	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)c2cc(C)c(C)c(S(N)(=O)=O)c2)n[nH]1	765592827	SOEZKRRYJGXEEM-UHFFFAOYSA-N	443.485	1.424	50	20	IDGD	
Cn1c(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cc(Cl)c1Cl	766644381	VFWQZXMFQIUEOX-UHFFFAOYSA-N	438.315	1.551	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)N[C@@H](Cc1ccccc1)CN1CCOCC1	766990737	NUIMOOGCKMIHRY-SFHVURJKSA-N	432.546	1.660	50	20	IDGD	
CC(C)c1cc(NC(=O)C(=O)NNC(=O)CCCc2cccs2)n(-c2ncccn2)n1	768240876	BPNKGOBIYKEXMY-UHFFFAOYSA-N	441.517	1.956	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3ccc4c(c3)C(=O)N(C)C4=O)n[nH]2)cc1OC	768276192	IISLAXRHDCKCCG-UHFFFAOYSA-N	449.423	1.395	50	20	IDGD	
CC(=O)N1CCN(S(=O)(=O)c2cccc(C(=O)NNc3nc4ccccc4[nH]3)c2)CC1	768514722	JMHFEXGAAAMWPN-UHFFFAOYSA-N	442.501	1.173	50	20	IDGD	
CSCC[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)NNC(=S)Nc1ccccn1	768585438	MDMNKITZSHCFDO-AWEZNQCLSA-N	448.530	1.859	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccc(NC(=O)NNc3cccc([N+](=O)[O-])c3)c2)CC1	769976667	DQWWZRYSQFWKOO-UHFFFAOYSA-N	434.478	1.680	50	20	IDGD	
C[C@@H]1C[C@H](NC(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)CCO1	770354500	HJTSPDFFUTXIHP-NVXWUHKLSA-N	435.484	1.956	50	20	IDGD	
Cn1c(=O)n(C)c2nc(NC(=O)CCC(=O)NNc3ccnc(Br)c3)ccc21	771549519	PIJOJXWFTGLLLT-UHFFFAOYSA-N	448.281	1.292	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1ccccc1NS(=O)(=O)c1ccc(OC)cc1	771895509	YUYBETKCAJGDHT-CYBMUJFWSA-N	449.485	1.599	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@@H]2[C@H]3CCc4ccccc4[C@H]32)cc1	772630374	OZELCJZTDZCBBC-CEWLAPEOSA-N	442.541	1.674	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)CCNS(=O)(=O)c1cccs1	772997441	VCIREYQPYUNGGF-LLVKDONJSA-N	431.923	1.685	50	20	IDGD	
Cc1ccc(-n2nccc2NC(=O)C(=O)NNC(=O)CCSc2ccc(F)cc2)nn1	773500322	SSMXXQMLRLFOEX-UHFFFAOYSA-N	443.464	1.378	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2cc(C(F)(F)F)ccn2)nc1	773641562	YCJWQECOYAPUFA-UHFFFAOYSA-N	446.411	1.264	50	20	IDGD	
CC(=O)Nc1cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)ccc1F	774007891	CLMORLAASXKMEV-SNVBAGLBSA-N	436.827	1.991	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)Nc2ccnn2[C@H]2CCS(=O)(=O)C2)c1	776060564	YSQNLRHGXVLWGE-HNNXBMFYSA-N	449.533	1.906	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)c2ccccc2c1=O	778530388	HBLMNIPDSUYKPM-UHFFFAOYSA-N	439.384	1.689	50	20	IDGD	
COc1cc(OC)c(NC(=O)C(=O)NNC(=O)CCc2ccco2)cc1Br	778714679	XMFHVKONZXIGTL-UHFFFAOYSA-N	440.250	1.778	50	20	IDGD	
O=C(/C=C/C(=O)Nc1ccc2n[nH]cc2c1)NNC(=O)C(=O)NCc1ccc(Cl)cc1	778958772	SRMACHHQRXKXCZ-BQYQJAHWSA-N	440.847	1.175	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)[C@H](NS(=O)(=O)c1ccc(C)cc1)[C@H](C)O)c1ccccc1	779515780	BKQMRXYBGOHGJU-ZYSHUDEJSA-N	433.530	1.364	50	20	IDGD	
CCCCN1C(=O)c2ccc(C(=O)NNC(=O)CCNC(=O)OC(C)(C)C)cc2C1=O	780971277	MWFNHCRKPMSBKT-UHFFFAOYSA-N	432.477	1.759	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1	781716588	ZXGNUZLOSCOZLC-UHFFFAOYSA-N	442.762	1.927	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN[C@H](CN1CCOCC1)c1ccccc1	782467862	HNDRKQUHHPXMJE-LJQANCHMSA-N	446.935	1.773	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)n(-c2ccc(F)cc2)n1	782894814	WKOPBWKNZQUQEG-UHFFFAOYSA-N	449.446	1.535	50	20	IDGD	
CN(C)Cc1cccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)c1	784210263	KUJRNFXKYJMOOF-UHFFFAOYSA-N	431.518	1.271	50	20	IDGD	
CCOC(=O)COc1ccc(NC(=O)C(=O)NNc2ccc(Br)cn2)cc1	784340400	YGAUDEAFWNSUSP-UHFFFAOYSA-N	437.250	1.868	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)F)cc1)C(=O)Nc1ccnn1-c1ccncc1	784836425	WYCDTNOIUDYEJA-UHFFFAOYSA-N	436.400	1.345	50	20	IDGD	
COc1cccc(NNC(=O)C(=O)Nc2cc(OC)c(Br)c(OC)c2)n1	784842744	XCNBRDJJAICDEH-UHFFFAOYSA-N	425.239	1.952	50	20	IDGD	
CCOc1cc(NC(=O)C(=O)NNc2ccnc(N(C)C)n2)c([N+](=O)[O-])cc1OCC	784968639	ANHDOWIUJVBFIM-UHFFFAOYSA-N	433.425	1.330	50	20	IDGD	
C[C@@H]1CCC[C@@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)CC1	785945412	BRXBZJARONKOEQ-NVXWUHKLSA-N	438.550	1.620	50	20	IDGD	
COc1ccc(OC)c([C@@H]2C[C@@H]2C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)c1	788084966	DGINVGMKKZOFHF-HOCLYGCPSA-N	446.529	1.870	50	20	IDGD	
CCOC(=O)[C@H](C)NC(=O)c1ccc(NC(=O)NNc2cc(Cl)nc(N)n2)cc1F	789118721	JOVXYTKDMKVJJF-QMMMGPOBSA-N	439.835	1.681	50	20	IDGD	
O=C(NCc1ccc(S(=O)(=O)CCO)cc1)NNC(=O)c1cccc2ccccc12	790765679	UBLOXZUAVUMJNT-UHFFFAOYSA-N	427.482	1.750	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)Cc2ccc(I)cc2)cc1	792567534	FIZYGPBPEIVEHS-UHFFFAOYSA-N	435.221	1.932	50	20	IDGD	
COc1ccc(CCC(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1F	792728229	QTLNXZDGCXZHIV-SFHVURJKSA-N	432.404	1.298	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@H]2N(C(=O)OC(C)(C)C)CC2(C)C)c2ccccc2c1=O	792810441	HMWAKUKEEYHVMM-MRXNPFEDSA-N	443.504	1.823	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1cc(C(C)(C)C)nn1-c1ccc(C#N)cc1	793031167	NQFQOXGRAXGOLY-UHFFFAOYSA-N	434.460	1.922	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NN=Cc1c(C)cnn1C)N(S(C)(=O)=O)CC2	794882567	OZJLNCBAACAYHC-INIZCTEOSA-N	449.533	1.145	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)c2nnn(Cc3cc(C)no3)c2C)cc1C	796535941	ZYDVPQONBIWRCX-UHFFFAOYSA-N	446.489	1.482	50	20	IDGD	
CC[C@H](C)NS(=O)(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)c2cccc(C)n2)c1	797370254	IXQWKZHHBCHGNX-ZDUSSCGKSA-N	447.517	1.008	50	20	IDGD	
COC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)c1C	798042233	OABIBFTYOIJUPT-UHFFFAOYSA-N	439.472	1.712	50	20	IDGD	
CCn1ncc(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)c1C(F)(F)F	799257762	RRCASFQXMQHSOH-UHFFFAOYSA-N	433.774	1.740	50	20	IDGD	
O=C(NNC(=O)C1CCN(S(=O)(=O)c2cccnc2)CC1)Nc1cc(F)cc(F)c1	802004780	VJHIZWBADQPPSN-UHFFFAOYSA-N	439.444	1.613	50	20	IDGD	
COc1ccc(Cl)c(NC(=O)NNC(=O)CN2C(=O)COc3ccc([N+](=O)[O-])cc32)c1	802110291	VJMSZFJWAVYLRO-UHFFFAOYSA-N	449.807	1.835	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NC[C@@H]2CC(c3ccc4c(c3)CCO4)=NO2)cc1	802333670	ZNJPDHONJYDVNU-SFHVURJKSA-N	440.456	1.533	50	20	IDGD	
COC(=O)c1cn(CCNC(=O)/C(C#N)=C/c2cn(CCC#N)nc2-c2ccccc2)nn1	803643508	KMJGFPYGPXMDFO-SFQUDFHCSA-N	444.455	1.565	50	20	IDGD	
CC1CCN(S(=O)(=O)c2ccc(C(=O)NNc3ccc(-n4ccnc4)nn3)s2)CC1	804957787	BBFPAKRFZHWWQM-UHFFFAOYSA-N	447.546	1.901	50	20	IDGD	
COCCNC(=O)[C@@H](C)OC(=O)c1ccc(NC(=O)NNc2nc(C)cc(C)n2)cc1	806745736	KYCCXRUTFJHBQL-CQSZACIVSA-N	430.465	1.550	50	20	IDGD	
Cn1ncc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)c1-c1ccccc1	806979029	LCXOKWXYOWVRNT-UHFFFAOYSA-N	429.383	1.845	50	20	IDGD	
CC(C)(O)c1cccc(NC(=O)C(=O)NNC(=O)c2cc(Br)ccc2O)c1	806979199	VTLGHLIMGLKLSI-UHFFFAOYSA-N	436.262	1.782	50	20	IDGD	
CS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccc(C#N)c(Br)c2)cc1	806995365	ROKNQEMVPOBNME-UHFFFAOYSA-N	437.275	1.806	50	20	IDGD	
O=C(NC[C@@H](c1ccccc1)N1CCCC1)NNC(=O)c1csc(N2CCOCC2)n1	807006466	ZAUWIFZKPJWWNR-SFHVURJKSA-N	444.561	1.761	50	20	IDGD	
CCS(=O)(=O)c1ccc([C@@H](C)NC(=O)NNC(=O)COc2ccc(C#N)cc2)cc1	807269304	GCDJKYGVTINUKZ-CQSZACIVSA-N	430.486	1.822	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCCCC2)cc1	807370996	BEFQPKJEOXULOM-UHFFFAOYSA-N	441.550	1.802	50	20	IDGD	
CCc1nnc(NC(=O)[C@@H](C)[C@@H](C)NC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)s1	807566616	YQHQOGLYTUXOLF-VHSXEESVSA-N	435.466	1.616	50	20	IDGD	
O=C(COC(=O)[C@H]1C[C@H](c2ccccc2)OC1=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	808588920	LJEDXMLDNNLCTE-HZPDHXFCSA-N	427.369	1.203	50	20	IDGD	
Cc1nn(C)cc1S(=O)(=O)NC(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccccc1	809032550	CQVYIAXLNPPRGM-BOPFTXTBSA-N	449.496	1.918	50	20	IDGD	
C/C=C(/CC)C(=O)NNC(=O)C[C@@H]1c2cc(OC)c(OC)cc2CCN1S(C)(=O)=O	809999857	TVVSJZRWTWWGGK-ORDXOSSNSA-N	439.534	1.456	50	20	IDGD	
COC(=O)c1c(F)ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)c1F	810384640	HYQCRDQVVHSOPR-UHFFFAOYSA-N	443.366	1.541	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)CNS(=O)(=O)c2ccc(Cl)c(Cl)c2)nc1	810754969	JJLUEWRLBPEOMD-UHFFFAOYSA-N	433.273	1.597	50	20	IDGD	
O=C(NN=Cc1cn(-c2ccccc2Br)nn1)c1ccc(-n2cnnn2)cc1	811634051	ATMKIJVERFBWEI-UHFFFAOYSA-N	438.249	1.769	50	20	IDGD	
CCc1nnc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(CC)CC)c2)s1	812599065	MWJMQYPBLSEGCU-UHFFFAOYSA-N	440.551	1.275	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)COc2cccc(NC(=O)C3CC3)c2)cc1	812733142	HRDACZRXBQJIOK-UHFFFAOYSA-N	432.502	1.808	50	20	IDGD	
Cn1cc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)c(C2CC2)n1	812983752	GAVIXLDLKUTXGR-UHFFFAOYSA-N	431.396	1.673	50	20	IDGD	
CN(C)C(=O)NNC(=O)c1cn(C)nc1[C@H]1CCCN(C(=O)OCc2ccccc2)C1	814669234	MYRGDAZBIPWHSA-INIZCTEOSA-N	428.493	1.852	50	20	IDGD	
COC(=O)c1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)n1C	814698401	DCHJVJLEMBZRAU-UHFFFAOYSA-N	448.501	1.061	50	20	IDGD	
COc1cc(C(C)=NNC(=O)Nc2ccc(S(N)(=O)=O)cc2)ccc1S(C)(=O)=O	814965982	SPKFRMSTIGZGRV-UHFFFAOYSA-N	440.503	1.292	50	20	IDGD	
CCNS(=O)(=O)c1ccc(F)c(C(=O)NNc2ccccc2S(=O)(=O)N(C)C)c1	817054218	YYDFEWUYBOMGCO-UHFFFAOYSA-N	444.510	1.131	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)CCC(=O)N1CC(=O)Nc2ccccc21	817055190	QJENYFIKDLSKDK-UHFFFAOYSA-N	445.501	1.146	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCCC3)cc2)cc1	825600745	RAOMMFSDXLGZFU-UHFFFAOYSA-N	444.557	1.972	50	20	IDGD	
NC(=O)c1ncn2c(C(=O)NNC(=O)COc3ccccc3F)cc(-c3ccco3)nc12	913081462	QFVFJEYMAOHXMN-UHFFFAOYSA-N	438.375	1.067	50	20	IDGD	
COc1cc(-n2cnnn2)c(Cl)cc1C(=O)NNC(=O)COc1cc(C)cc(C)c1	916033488	ZZOSDIPZOXOWAV-UHFFFAOYSA-N	430.852	1.781	50	20	IDGD	
CN(C)N(C(=O)c1cccc(CS(=O)(=O)c2ccccc2)c1)[C@H]1CCS(=O)(=O)C1	916040986	LOYHOYBGXUQPGO-SFHVURJKSA-N	436.555	1.766	50	20	IDGD	
Cc1cc(Br)oc1C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	916133545	XGEHSUKEDYFQKY-UHFFFAOYSA-N	436.671	1.726	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)N[C@@H](CN1CCOCC1)c1ccccc1	916214436	ROTNEBXQOGAYOG-PXNSSMCTSA-N	426.473	1.230	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NN=C2CCS(=O)(=O)c3ccccc32)cc1	916276425	BPNPBHLVKBUPSB-UHFFFAOYSA-N	435.527	1.313	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCc2ccc(-n3cncn3)nc2)ccc1OC(C)C	916396087	WCIFUFPIPHMOBW-UHFFFAOYSA-N	425.449	1.602	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCCCN2CCc3ccccc3C2)c2ccccc2c1=O	916459277	QYNDNVLMGOKVSQ-UHFFFAOYSA-N	448.527	1.809	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)NCCCN2CCN(c3ccccc3)CC2)nc2ccccc21	916489877	SDCJJWXYFLNXBE-UHFFFAOYSA-N	449.559	1.659	50	20	IDGD	
CCS(=O)(=O)N(C)CCCNC(=O)NNC(=O)c1ccc(COc2ccccc2)o1	916580326	NFCWNKAKJYAZSC-UHFFFAOYSA-N	438.506	1.474	50	20	IDGD	
O=C(CN1CCc2ccccc21)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	916734370	CXJALBBRKWOELD-UHFFFAOYSA-N	428.514	1.295	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)NC1CCN(Cc2ccncc2)CC1	918226442	KDQPVBFJQHXFJO-UHFFFAOYSA-N	428.449	1.364	50	20	IDGD	
O=C(NNC(=O)c1n[nH]c(O)n1)c1cccc(S(=O)(=O)Nc2ccccc2Cl)c1	918285377	JMOWARZZZKWINV-UHFFFAOYSA-N	436.837	1.039	50	20	IDGD	
O=C(CCCOc1ccc(Cl)cc1Cl)NNC(=O)CCCN1C(=O)CNC1=O	920183608	PWSXTGTYODYHPM-UHFFFAOYSA-N	431.276	1.632	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)c2cnc3c(c2)c(O)nc(=O)n3C2CC2)o1	920248638	MBPQAIYDWDVEJY-UHFFFAOYSA-N	440.460	1.342	50	20	IDGD	
CNC(=O)CN(C)C(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccc(OC)c(OC)c1	920430980	NOFFOZHPYWUTRH-MHWRWJLKSA-N	436.472	1.592	50	20	IDGD	
CCOC(=O)C[C@H](NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)c1ccc(F)cc1	920866817	LVGUCYRQTSEUJR-KRWDZBQOSA-N	441.423	1.440	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)NCc1nc(Cc2ccccc2)no1	921118622	AAJAHYIZMHGBKU-UHFFFAOYSA-N	425.445	1.969	50	20	IDGD	
Cc1nc(CSCC(=O)N2CCN(S(=O)(=O)CBr)CC2)cs1	1254753043	DPQIFEGQAHULHL-UHFFFAOYSA-N	428.399	1.511	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)CN(C)C(=O)OC(C)(C)C	1318438331	AAQDQLGQYAKNEW-OAHLLOKOSA-N	449.556	1.526	50	20	IDGD	
O=C(NNC(=O)N[C@@H]1CCO[C@]2(CCS(=O)(=O)C2)C1)Nc1ccc(OC(F)F)cc1	1319952181	YXBVCMIVWPQZLG-SJKOYZFVSA-N	448.448	1.360	50	20	IDGD	
O=C(NNC(=O)c1cnn2ccncc12)c1nn(Cc2ccccc2)c(=O)c2ccccc12	1321030568	NPHRZNWIXOUVSV-UHFFFAOYSA-N	439.435	1.562	50	20	IDGD	
Cc1nc(S(=O)(=O)NNC(=O)c2cncn2-c2ccccc2)c(Br)n1C	1323622872	ULTREPCWHFARNH-UHFFFAOYSA-N	439.295	1.300	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@]3(F)CCCCC3(F)F)C2)C1	1778222930	MQVKZNCIKNCEQE-JQFCIGGWSA-N	426.863	1.988	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@]2(C)C[C@H]2C)C1	1780617923	ITJATANZIUIZHB-WLIUMLBMSA-N	443.548	1.680	50	20	IDGD	
C[C@H](Cn1cncn1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@](C)(Cl)CCl)C1	1780712887	XKOOMOPLRPXPLI-VVWQDTPRSA-N	446.379	1.664	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc([N+](=O)[O-])c4c3OCO4)CCO2)C1	1781219374	XVCAJXJLOSHVRL-BFUOFWGJSA-N	439.852	1.784	50	20	IDGD	
O=C(c1ccc2nccnc2c1)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781329452	GCXDBGCUAREYJS-MAUKXSAKSA-N	437.269	1.764	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@](C)(O)C(F)(F)F)C2	1782172036	LQAXKEBLXCNHJT-UAXWRAGISA-N	430.851	1.067	50	20	IDGD	
CC(C)[C@H](O)C(=O)N1CCO[C@@]2(CCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1	1782862045	OCCYVDXOXCMQMM-IVXLGNKDSA-N	433.455	1.719	50	20	IDGD	
CC(C)[C@H]1CC[C@H](C(=O)N2CC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)CC1	1783375132	MLBMIKAQWLBPPT-YDHSSHFGSA-N	436.597	1.652	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H]1CCc3ccoc3C1)CCO2	1783530170	UIBZTHADXUYHII-ZUEVXXBESA-N	425.323	1.998	50	20	IDGD	
CO[C@@H](C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](C)Br)C2)C1)c1ccccc1	1783532885	ONBHTGVEPRGRHQ-ZSZQSSIHSA-N	425.323	1.987	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)CN3CCCCC3=O)C2)C1	1783759114	BDHJLYGIEZJGDC-KDOFPFPSSA-N	430.343	1.002	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)CCc3c[nH]c4ncccc34)CCO2)C1	1783883861	MDDZSKHPAZMMIX-UTKZUKDTSA-N	434.924	1.579	50	20	IDGD	
O=C(c1cccc(N2CCOCC2)c1)N1CCO[C@@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783947174	OPPAWSGNDDKCME-HXUWFJFHSA-N	442.343	1.770	50	20	IDGD	
Nc1nc2cc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]4C3)ccc2s1	1784090314	YKIKYXQQSMFVJG-JURCDPSOSA-N	438.937	1.072	50	20	IDGD	
O=C(C[C@@H]1COc2ccccc2O1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21	1784391354	CTVNITCUWOFZLX-XYKJDMJCSA-N	426.872	1.731	50	20	IDGD	
COc1cccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)CBr)C[C@@H]32)n1	1785808411	XCHJLLIJMXUFBY-HOSILWTGSA-N	440.338	1.715	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)Nc1ccc(C2(NC(=O)[C@H](O)CCl)CCC2)cc1	1786776291	YSOULUMWGWOWCE-QGZVFWFLSA-N	430.892	1.545	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C[C@@H](N)c3cccnc3)[C@H]2C1	1786932077	RAMINNYXKUHQGV-DWBZUHSKSA-N	439.354	1.235	50	20	IDGD	
C[C@H]1Oc2ccc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]4C3)cc2NC1=O	1787447885	IJDZSJNVWRUJKY-OELWXQPESA-N	439.871	1.534	50	20	IDGD	
O=C(NC1(c2ccc(NC(=O)[C@@H](O)c3ccccc3)cc2)CCC1)c1ccc(B(O)O)cc1	1787852871	HYPIWXPXCMGZIX-QFIPXVFZSA-N	444.296	1.848	50	20	IDGD	
C[C@@H]1CCc2c(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)[C@@H](F)Br)C[C@@H]43)n[nH]c21	1787952778	WNTJLMDJVBFJCZ-QCEZPJONSA-N	443.317	1.743	50	20	IDGD	
C=C[C@H](O)C(C)(C)C(=O)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1	1789492449	CHQTVABUCBMYPX-FQEVSTJZSA-N	436.317	1.687	50	20	IDGD	
Cc1cnn([C@H](C)C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]3C2)c1	1789872489	GICACCYMNHNKMK-XZLOLGPPSA-N	431.364	1.969	50	20	IDGD	
CCOC(=O)C1(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](Br)CC)[C@H]3C2)CC1	1790963598	GALVMXDAKBTQBJ-AJNGGQMLSA-N	445.354	1.483	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc(OC)cc3C#N)C[C@@H]21	1791253755	IXFDDSNZUMNTFI-KNTRFNDTSA-N	449.935	1.343	50	20	IDGD	
Cc1nccn1CCCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CO[Si](C)(C)C)C[C@@H]21	1791572976	OXNOVWYTRQTYLO-FHWLQOOXSA-N	436.629	1.803	50	20	IDGD	
Cc1cnn([C@H](C)C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)Br)C[C@@H]32)c1	1791597904	FIVSFQQQWGYSFR-QRJUGERDSA-N	427.343	1.516	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3ccnn3c1)C2	1792874696	ZOTABPMFEUHFBZ-FAYQHZLMSA-N	435.322	1.569	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cn2nc(C)sc2n1	1793660814	WQNRIUZCSGBDJL-YXPYIKCWSA-N	439.969	1.639	50	20	IDGD	
Cc1nc[nH]c1CSCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2	1797662221	HYLPPSRLRNAYDY-FVCICTRLSA-N	445.383	1.326	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c(F)ccc(O)c1F)C2	1797956287	OMSMEWTVRWHCRZ-KSPBDQMDSA-N	428.508	1.725	50	20	IDGD	
COc1ccsc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)CBr)C2	1798333901	FBQXBUASRIWHDD-FMSGJZPZSA-N	431.352	1.991	50	20	IDGD	
COc1ccc2[nH]cc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)C(Cl)Cl)C4)c2n1	1798486223	VYEUFADOTXJPRF-WDAIWFPHSA-N	427.288	1.578	50	20	IDGD	
Cc1ncc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)/C(C#N)=C/c2ccc(F)cc2F)[nH]1	1800332231	JHQJWAPYPUAMHX-QYFXKUKHSA-N	441.438	1.807	50	20	IDGD	
C[C@@H](O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C#N)=C/c1ccc(Br)cc1	1800335860	YVGBHKXXQJFRPZ-TVGAUJJISA-N	448.317	1.326	50	20	IDGD	
CC(C)[C@H]1CC[C@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCC(=O)NN(C)C)C3)CC1	1800657753	BLYFZTBSJWDJHO-UGEWPGMYSA-N	436.597	1.411	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc(F)c(C#N)c1)C2	1800759751	FZJKTTQSPYGVPT-MKXCTONWSA-N	438.297	1.613	50	20	IDGD	
CC[C@@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCN1CCN(C)CC1)C2	1801798877	RSOWXUVPKJPDIE-YYIAUSFCSA-N	429.403	1.436	50	20	IDGD	
C[C@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CNC(=O)c1cccs1)C2	1801958783	LPJBDPXJHQWMTE-RVMXOQNASA-N	428.352	1.900	50	20	IDGD	
CC(C)(C)OC(=O)NC1(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)C(Cl)Cl)C3)CC1	1802226448	IHWJAGJNPSIZMU-ZSBIGDGJSA-N	436.336	1.437	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H]2Cc3ccccc3CN2)[C@@H]1c1cccnc1)[C@H](O)CCl	1803138589	CRPRJQVFHHXKCZ-UWHLTILDSA-N	442.947	1.402	50	20	IDGD	
N=C(N)SCCC(=O)N1CC[C@H](CNC(=O)[C@H](F)Br)[C@H]1c1cccnc1	1808661883	SILMAAPSZNCEGX-BNOWGMLFSA-N	446.346	1.795	50	20	IDGD	
Cc1[nH]ccc1C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1808750319	OAPOTCWBILLWDH-GHTZIAJQSA-N	432.289	1.031	50	20	IDGD	
Cn1cc(C(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)c2cccnc21	1810081693	QCSRBAONLONNAN-KFKAGJAMSA-N	441.919	1.888	50	20	IDGD	
CC[S@](=O)CCC(=O)NC[C@@H]1CCN(C(=O)[C@H](Cl)COC)[C@H]1c1cccnc1	1810119973	BXRBGPDLPCUFCA-DMAWNGHVSA-N	429.970	1.500	50	20	IDGD	
Cn1nc(C(=O)N2CC[C@H](CNC(=O)CO[Si](C)(C)C)[C@@H]2c2cccnc2)cc1O	1810538904	AXCPBOAJVZFJLD-BEFAXECRSA-N	431.569	1.692	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@@H](CNC(=O)c2nccnc2C(N)=O)[C@@H]1c1cccnc1	1811183611	UYVKBJWZNNSXTP-YOEHRIQHSA-N	444.923	1.555	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2ccc(O)cc2)[C@@H]1c1cccnc1	1811934722	IGBAWJXNJLGBEV-AVRDEDQJSA-N	439.516	1.480	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)C(=O)Nc2cccnc2)[C@H]1c1cccnc1	1813031395	NCWWBZDLROWYMM-NJAFHUGGSA-N	445.907	1.375	50	20	IDGD	
Cc1noc(C)c1C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1813070145	GLKPVVRZXCELSR-UTKZUKDTSA-N	442.520	1.379	50	20	IDGD	
Cc1ccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)c(O)c1	1817474611	CTHOXHJPQKCTBL-LJQANCHMSA-N	448.288	1.723	50	20	IDGD	
N#Cc1cccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)c1	1817476568	KAAAPZGFAXGORJ-FQEVSTJZSA-N	443.272	1.581	50	20	IDGD	
O=C(CCN1CCOC1=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](F)Br)CC2	1818694432	JTJYCGFTRWOERZ-UFBFGSQYSA-N	449.302	1.588	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3ccc4c(c3)CNC4=O)sc2C1	1819373574	FEJMLEPIRZFGMK-JSGCOSHPSA-N	448.932	1.866	50	20	IDGD	
CC1(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cnccc3C(=O)NN)n[nH]2)CCC1	1819400420	JRRWUMGORKQMIJ-INIZCTEOSA-N	425.493	1.904	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](O)CCl)CC2)c1cnc2snnc2c1	1821273280	LTGZEDHQCNZQQF-GZMMTYOYSA-N	438.922	1.368	50	20	IDGD	
C[C@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](F)Br)[nH]n1)n1ccnn1	1821724452	DWKALMQVFKLCNZ-CDMKHQONSA-N	428.266	1.945	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](N)CN)[nH]n1	1821777782	PCBLOKOHKIDRSA-ATEOPRPQSA-N	443.458	1.573	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)/C=C/C2CC2)CC1	1824212631	KCWFROOVXUPCHN-ROUKRRSUSA-N	425.533	1.885	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H]3CNC(=O)C3)sc2C1	1825190987	GEJFWOHWOVGKHJ-UTLUCORTSA-N	429.340	1.222	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)C/N=C/c1ccco1)CC2	1826088319	WBIYVSDQIALENO-PUFAJPFRSA-N	446.533	1.140	50	20	IDGD	
CN(C)C(=O)NCC(=O)N1CCC([C@H]2CCCCN2C(=O)CCBr)CC1	1826354807	MTPWDIJLWGCJBP-OAHLLOKOSA-N	431.375	1.662	50	20	IDGD	
CC(=O)Nc1cc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)[C@H](O)CCl)CC2)ccn1	1827975555	SJCLPLZTNSNHOB-QZTJIDSGSA-N	436.940	1.873	50	20	IDGD	
Cc1oncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1	1828925700	PLEHIBDKLISBCP-IBGZPJMESA-N	440.504	1.529	50	20	IDGD	
Cc1ccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)c(O)n1	1829738462	PBYRIXJOOZUFJY-IBGZPJMESA-N	445.564	1.702	50	20	IDGD	
Cc1ccc(OCCC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)cc1	1830206145	VTFQTNDBPSZMNQ-ICSRJNTNSA-N	428.888	1.755	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830366254	MJGHEEWDCUCYDM-WBMJQRKESA-N	425.751	1.491	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1C[C@@H]1C1CC1)CCO2	1830490383	TVOOTHZKSGEBIF-ZIGSKRJUSA-N	429.355	1.520	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3C[C@H]3C3CC3)C2)C1	1830533129	GIUJBXIJZVPWQP-FVQSIRDASA-N	429.355	1.520	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CCc4nc[nH]c4C3)C2)C1	1831657968	RTVWJBSTSJZLEA-XFQAVAEZSA-N	438.956	1.379	50	20	IDGD	
COc1ccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)c(Cl)c1	1832537308	AGUFAHJNIOSIEZ-IEBWSBKVSA-N	449.306	1.882	50	20	IDGD	
Cc1ccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)CCBr)C3)C2)cn1	1833130420	YKTKQDUYLKVEHE-LJQANCHMSA-N	440.338	1.174	50	20	IDGD	
Cc1nc[nH]c1C(=O)N1CCC(N2CCC(NC(=O)[C@@H](C)CBr)CC2)CC1	1833263532	MUKLUUVXPQHNAM-ZDUSSCGKSA-N	440.386	1.934	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3onc4ccccc34)CC2)CC1)[C@H](O)CCl	1833311714	DNIREVXFUCXLQM-GOSISDBHSA-N	434.924	1.613	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCC(N2CCC(NC(=O)[C@H](N)c3ccccn3)CC2)CC1	1834720938	HJJSPFXALZGNAP-LJQANCHMSA-N	436.000	1.918	50	20	IDGD	
COC(=O)c1ccc(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](F)Cl)CC3)CC2)cn1	1835167880	PDMJXGGFIJHFQF-QGZVFWFLSA-N	440.903	1.588	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CNc3ccccc31)CCO2	1835718441	WZCKDZHGNZJNMI-AVRDEDQJSA-N	447.608	1.504	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3cccnc3)CCO2)C1	1836182548	OVPSKPRELVJTSP-PMACEKPBSA-N	444.359	1.707	50	20	IDGD	
CC1=C(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](C)CBr)C3)C2)CCO1	1836268278	OKAXVIUUBZVFOE-SCLBCKFNSA-N	431.327	1.168	50	20	IDGD	
CC[C@@H](Br)C(=O)NC1CCN(C2CCN(C(=O)Cn3cccn3)CC2)CC1	1836541883	LPEIGPLAGAIKPG-QGZVFWFLSA-N	440.386	1.628	50	20	IDGD	
N[C@@H](CC(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)c1cccnc1	1836716887	WKUPUXYIDKEGTO-OALUTQOASA-N	438.956	1.070	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cn4cc(F)ccc4n3)CCO2)C1	1836961367	BWWYIPZUCBZXRO-YWZLYKJASA-N	438.887	1.561	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCBr)C3)C2)ccn1	1837935412	FYZRBVHPGDHYAF-GOSISDBHSA-N	426.311	1.245	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)CN3CCN(C)CC3)CC2)CC1	1838286569	HSEJPSNBTLKLAC-IBGZPJMESA-N	429.005	1.250	50	20	IDGD	
C[C@@H](C(=O)N1CCC(OC2CCN(C(=O)[C@@H](C)Br)CC2)CC1)n1ccnn1	1838730505	XKEBBGFLDXNAGE-KGLIPLIRSA-N	442.358	1.621	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)C#CC3(O)CCCCC3)C2)C1	1839146343	XESTVVYVWYDLFF-UWJYYQICSA-N	426.941	1.159	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccnc4ncccc34)C2)C1	1839147904	GQEMQKWKOBJEAR-DYESRHJHSA-N	432.908	1.717	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C)c4n[nH]cc4c3)C2)C1	1839148220	RMUCDGOHGQWFGC-DYESRHJHSA-N	434.924	1.959	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(NC(C)=O)c3)C2)C1	1839148881	MNBPURZRJBWOLA-NQIIRXRSSA-N	437.924	1.732	50	20	IDGD	
O=C(c1cc2cccnn2c1)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1839562133	LIMGHCDNXAZVGA-SFHVURJKSA-N	427.288	1.208	50	20	IDGD	
CCN(CC)C[C@H](C)C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](C)Br)CCO2)C1	1840034978	CAIXFLHHQRHTSC-TXPKVOOTSA-N	448.402	1.204	50	20	IDGD	
CCCc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](Cl)COC)CCO3)cc1	1840154450	XDARZOBXGKZTAE-KNQAVFIVSA-N	438.952	1.963	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC12CN(C(=O)CCNC(=O)c1ccc[nH]1)C2	1841285686	JYKYREDSLZXGHC-CYBMUJFWSA-N	425.327	1.369	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@H]2CC(=O)CN2C(=O)OC(C)(C)C)C1	1841433425	ARTVZTDYLFRNTH-GJZGRUSLSA-N	427.929	1.786	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)[C@H](NC(C)C)C(C)C)C2	1843415824	RKRFSBWNCRSESA-OAKZWBAKSA-N	430.553	1.346	50	20	IDGD	
C[C@H](Sc1ccccn1)C(=O)N1CC2(CCCN2C(=O)c2cnccc2C(=O)NN)C1	1844265291	OIRDIMHYBWPLBQ-AWEZNQCLSA-N	440.529	1.078	50	20	IDGD	
COc1ccc(/C=C(\C)C(=O)N2CCCC23CN(C(=O)CCC(=O)NN(C)C)C3)cc1	1845835253	UOZQAXBHLFDUCH-SAPNQHFASA-N	428.533	1.675	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)C1CN(C(=O)OCc3ccccc3)C1)C2	1846364480	RIFSNBYFJNQCHB-SFHVURJKSA-N	449.935	1.712	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)c1ccc3cc(O)ccc3n1)C2	1846384734	BVIDBITXUVZLQH-UHFFFAOYSA-N	425.489	1.130	50	20	IDGD	
C=CC[C@@H](CC(=O)N1CCCC12CN(C(=O)[C@@H](O)CCl)C2)NC(=O)OC(C)(C)C	1846931439	CCQDAZGUNKVXIE-GJZGRUSLSA-N	429.945	1.649	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CCCC[C@H]1C(=O)N1CCCC12CN(C(=O)[C@@H](O)CCl)C2	1846950088	SETKIAIOKNXFAS-OAGGEKHMSA-N	443.972	1.873	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H]1COCCN1C(=O)OC(C)(C)C	1847945526	ONMNGUCJVXYHLX-FXUDXRNXSA-N	445.944	1.078	50	20	IDGD	
Cc1cc(C)c2c(-n3cccc3)c(C(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)sc2n1	16145949	UJHVACJZLZGJJS-ZDUSSCGKSA-N	432.527	1.900	50	20	IDGD	
Cc1oc2ncn(C)c(=O)c2c1C(=O)OCC(=O)C(C#N)=C1N(C)c2ccccc2N1C	37163653	CUAZPQAATBPRLP-UHFFFAOYSA-N	433.424	1.882	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cccc(C[S@](C)=O)c2)cc1OC	105487651	ZNUHYCODEMENNA-SSEXGKCCSA-N	434.470	1.200	50	20	IDGD	
C[C@H](NC(=O)c1cccc(Cl)c1Cl)C(=O)NNC(=O)CNC(=O)c1cccs1	725740632	XJTFNQLXYLRNSU-VIFPVBQESA-N	443.312	1.751	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(N2CCCS2(=O)=O)cc1)c1cc2c(s1)CCC2	726765172	XECIYGUDLCTGER-UHFFFAOYSA-N	441.556	1.400	50	20	IDGD	
CC(C)(C)OC(=O)N1CSC[C@@H]1C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	727130688	LPNJMCGTEKRWFQ-CYBMUJFWSA-N	429.520	1.161	50	20	IDGD	
N#C/C(=C\c1ccc(N2CCOCC2)c(F)c1)C(=O)Nc1ccc(S(N)(=O)=O)cc1	727263542	CVFVOLWMMPSKIO-RVDMUPIBSA-N	430.461	1.855	50	20	IDGD	
CC[C@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	727726544	DXLPRNUOYOKRGG-WFASDCNBSA-N	427.523	1.791	50	20	IDGD	
CCOC(=O)c1cc(S(=O)(=O)NNC(=O)COc2ccccc2OCC)ccc1F	728503095	ZSJMDAIERYCPBK-UHFFFAOYSA-N	440.449	1.790	50	20	IDGD	
COCCOc1cn(-c2ccccc2)nc1C(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	729296391	VQVJUSYGAUYKDR-UHFFFAOYSA-N	425.401	1.881	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@@H](C)C(=O)NNC(=O)Cc1c(C)[nH]c2ccnn2c1=O	729299663	GKHPIKWKXVFHFR-ZDUSSCGKSA-N	431.880	1.759	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cccc3c2O[C@H](C)C(=O)N3)cc1OC	729744889	KXXPWCJLXRLQPK-LLVKDONJSA-N	443.412	1.041	50	20	IDGD	
O=C(Cc1csc(-c2nc[nH]n2)n1)NNC(=O)c1ccc(F)cc1Br	729860735	GDZFHSCEVFAQLX-UHFFFAOYSA-N	425.243	1.834	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(OC)c(C(=O)NNC(=O)CCc2ccccc2O)c1	730033790	TXDUDQPEQXRTCB-UHFFFAOYSA-N	449.529	1.825	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)NCCOc2ccc(S(C)(=O)=O)cc2)c2ccccc2n1	730066728	ORSSXFXBQCDVQP-UHFFFAOYSA-N	442.497	1.970	50	20	IDGD	
COc1cc(OC)c(CCNC(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)c(OC)c1	731118393	BKIYVAOGQSHTPH-UHFFFAOYSA-N	444.488	1.841	50	20	IDGD	
CCc1c(C(=O)NNC(=O)CCN2C[C@@H](C)O[C@H](C)C2)nnn1-c1cccc(Cl)c1	732259000	JTJSIUIZYLTQOF-ZIAGYGMSSA-N	434.928	1.743	50	20	IDGD	
CNc1cc(C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc(Cl)n1	732260215	QGCMRGOIAXPCBF-UHFFFAOYSA-N	425.898	1.167	50	20	IDGD	
CC[C@H](C)C(=O)N1CCC[C@@H](C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)C1	732334838	APVWZUUMPRYCAT-DZGCQCFKSA-N	434.449	1.184	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)N[C@@H]2CCN(CC(F)(F)F)C2=O)cc1OC	732590671	VIFXNIOKNXKENC-GFCCVEGCSA-N	432.399	1.591	50	20	IDGD	
CC[C@H](C#N)Oc1cc(CNC(=O)NNC(=O)CNC(=O)c2ccco2)ccc1OC	733656741	OWBPEBJJPVQOBS-CQSZACIVSA-N	429.433	1.230	50	20	IDGD	
Cn1c(=O)n(CC(=O)NNc2ccccc2S(=O)(=O)NC(C)(C)C)c2ccccc21	734251959	VHPOBBRHPLMOAF-UHFFFAOYSA-N	431.518	1.560	50	20	IDGD	
O=C(NNS(=O)(=O)C[C@H]1CCCO1)c1nn(Cc2ccccc2)c(=O)c2ccccc12	735646852	VROBFHLZQRBHIN-MRXNPFEDSA-N	442.497	1.188	50	20	IDGD	
Cc1nc(-c2cccnc2)nc(NNC(=O)C/N=C2/NS(=O)(=O)c3ccccc32)c1C	736691213	MLQDAJPKUMSSAC-UHFFFAOYSA-N	437.485	1.337	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2ccc(C(F)(F)F)cc2C#N)c1	737756427	MZINETREKMWCNU-UHFFFAOYSA-N	447.416	1.604	50	20	IDGD	
O=C(COC(=O)C1CCN(Cc2ccccc2)CC1)NNC(=O)c1ccc([N+](=O)[O-])cc1	741331796	PPDSHCQZAGMGQA-UHFFFAOYSA-N	440.456	1.811	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1nccnc1NC(=O)C(C)(C)C	742478843	RZHSCIXNMSWRRP-UHFFFAOYSA-N	447.521	1.138	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)[C@H]2SCCc3ccccc32)ccc1Cl	742479102	ZASRPQLXPPJUQQ-HNNXBMFYSA-N	425.919	1.779	50	20	IDGD	
Cc1cc(N2CC[C@@H](NC(=O)NNC(=O)c3cc4c(s3)CC[C@H](C)C4)C2=O)n(C)n1	743511691	OKBQSSNHUXYZAK-SMDDNHRTSA-N	430.534	1.664	50	20	IDGD	
O=C(NNC(=O)c1ccc2ccccc2n1)N[C@H]1CC(=O)N(CCOc2ccccc2)C1	743636807	KNCQCGBSJPWHRQ-KRWDZBQOSA-N	433.468	1.859	50	20	IDGD	
CCn1c(=O)c(=O)[nH]c2cc(C(=O)NNC(=O)c3cc(Br)ccc3O)ccc21	743730274	VECHTJDSQJZPJX-UHFFFAOYSA-N	447.245	1.253	50	20	IDGD	
O=C(CNC(=O)c1ccc(F)cc1F)NNC(=O)c1cc(Br)ccc1O	743732539	ZSMLOUQAGARQEK-UHFFFAOYSA-N	428.189	1.624	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)COc2cccc(Br)c2)cc1	744474094	JTXYAOBZLJMEBK-UHFFFAOYSA-N	432.230	1.704	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)NC[C@@H](c1cccs1)N1CCOCC1	746742675	NEUATNADYLHTLU-INIZCTEOSA-N	428.518	1.342	50	20	IDGD	
CSCC[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)NNC(=O)Cc1ccncc1	747428700	SKKICTKUXXSAIC-MRXNPFEDSA-N	431.474	1.231	50	20	IDGD	
Cc1c(Br)cccc1S(=O)(=O)NNC(=O)[C@@H]1COc2ccccc2O1	747595892	JJWJYAZQHBADGE-AWEZNQCLSA-N	427.276	1.907	50	20	IDGD	
O=C(NNc1ccc(Br)cc1F)C1CCN(c2ccc3nnnn3n2)CC1	748201766	XIERSPMGALQYQU-UHFFFAOYSA-N	435.261	1.781	50	20	IDGD	
O=C(NNc1nc(-c2ccccn2)nc2c1CCC2)c1ccc(CN2C(=O)CNC2=O)cc1	748340093	AQWNKXBQXULILP-UHFFFAOYSA-N	443.467	1.836	50	20	IDGD	
CCCC(O)(CCC)CC(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	749242734	UXWDMOSVQSGGIF-UHFFFAOYSA-N	427.571	1.182	50	20	IDGD	
CN(C)[C@H]1CCC[C@H](NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)C1	749591701	QZNUAFHWJOCIRS-IRXDYDNUSA-N	437.566	1.288	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)NO[C@@H]2CCCCO2)cc1	749618039	VCIJVCWDYFXUTH-VMTBQTDASA-N	439.472	1.915	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)CNS(=O)(=O)c2ccc(Cl)s2)cc1C	749838669	ROFZNQOWXDZFMS-UHFFFAOYSA-N	431.923	1.523	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)N[C@H]1CCN(c2cccc(Cl)c2)C1	751101367	DXNYWNJSVBAGBD-HNNXBMFYSA-N	426.868	1.539	50	20	IDGD	
CC(C)(C)NC(=O)CN1CCC(CNC(=O)NNC(=O)C(C)(C)c2ccccc2)CC1	751111581	QFRMZQORKMKNBS-UHFFFAOYSA-N	431.581	1.921	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)COc1ccc(C(=O)c2ccccc2)cc1	751210741	ILAJYDCWBLDACH-UHFFFAOYSA-N	437.477	1.935	50	20	IDGD	
COc1ccc(CCN2C[C@@H](C(=O)NNc3cc(Cl)nc(N)n3)CC2=O)cc1OC	753680849	BOPRTXZPCFBHEW-LBPRGKRZSA-N	434.884	1.264	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)c2cc(S(=O)(=O)N(C)C)c(C)o2)cc1F	754199599	JVYCXEDOPHUXPU-UHFFFAOYSA-N	430.483	1.617	50	20	IDGD	
COC(=O)CNC(=O)c1ccc(NC(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)cc1	755544134	DLVPJYQKLCLBKA-HNNXBMFYSA-N	442.472	1.826	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2ccccc2C(=O)N2CCOCC2)cc1OC	755621775	COXUPWMAKVKOCX-UHFFFAOYSA-N	428.445	1.643	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)Nc1cccc(N2CCCS2(=O)=O)c1	755887851	DTXJOUFVCIVZBG-UHFFFAOYSA-N	432.458	1.464	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)Nc2ccc(-n3nccn3)nc2)c1	755950008	UXNYQIXXIGMPRY-UHFFFAOYSA-N	432.238	1.900	50	20	IDGD	
NC(=O)c1ccc(NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1F	756353453	ZKOFSDHKBBGCSE-UHFFFAOYSA-N	428.468	1.290	50	20	IDGD	
Cc1ncc(NC(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)cn1	756368986	AKEUETUFPDVTGB-UHFFFAOYSA-N	429.444	1.953	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccc(N3CCCC3=O)c(F)c2)c1	756541803	HBVKWBKDADDSLS-UHFFFAOYSA-N	434.449	1.823	50	20	IDGD	
CC(C)(C)c1ccc(OCC(=O)NNC(=O)Nc2ccn(CCS(C)(=O)=O)n2)cc1	756760741	NNDHQCQHIHEDDM-UHFFFAOYSA-N	437.522	1.457	50	20	IDGD	
Cc1cc(S(=O)(=O)Nc2ccc(C(=O)NNc3ccc(C(N)=O)nn3)cc2)ccc1F	757407787	KWOQTONABPQOGH-UHFFFAOYSA-N	444.448	1.581	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)CN1C(=O)N[C@]2(C[C@@H](C)C[C@@H](C)C2)C1=O	757736483	ZPKOGOUAKHNHDE-GFENJXEQSA-N	431.493	1.001	50	20	IDGD	
C[C@H]1CC(C)(C)C[C@]2(C1)NC(=O)N(CC(=O)NNc1nc(O)c3ccccc3n1)C2=O	758296288	XJGASYDWQQVWGX-QKVFXAPYSA-N	426.477	1.915	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)c1ccc2c(c1)C[C@H](C)N2S(C)(=O)=O	761635534	CETSDGYJDJMXAL-ZDUSSCGKSA-N	449.554	1.959	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(N3CCCNC3=O)c2)cc1OC	763550104	FQOKIBWEKXWPCO-UHFFFAOYSA-N	441.444	1.023	50	20	IDGD	
CCOCCCNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2cc(C)oc2C)c1	763585768	DBBUGHAVPSIZIQ-UHFFFAOYSA-N	430.461	1.453	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(OCC(F)(F)F)cc1	763657676	OVGWHMKKAAJZAL-UHFFFAOYSA-N	441.362	1.801	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2ccccc2CS(C)(=O)=O)c1	763666244	XJPITXIDOSXKAB-UHFFFAOYSA-N	433.486	1.013	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(N2CCO[C@H](C)C2)cc1	763710602	AVGDJLBWDAMWPO-MRXNPFEDSA-N	440.500	1.639	50	20	IDGD	
O=C(CN1CCCc2ccccc21)NNC(=O)C(=O)Nc1cc(F)ccc1OC(F)F	763732536	COOBWJOJGDJWKQ-UHFFFAOYSA-N	436.390	1.966	50	20	IDGD	
O=C(CSc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1cnn(Cc2ccncc2)c1	763734705	NGXHYUXXUSJZOU-UHFFFAOYSA-N	444.904	1.858	50	20	IDGD	
O=C(COC(=O)c1cc([N+](=O)[O-])ccc1SCCO)NNC(=O)c1cccs1	763744821	PCRFTLLXQXHBFN-UHFFFAOYSA-N	425.444	1.359	50	20	IDGD	
COC(=O)c1cc2cc(NC(=O)C(=O)NNC(=O)COc3ccccc3C#N)ccc2o1	763807371	ATHRLUKCIWRYJG-UHFFFAOYSA-N	436.380	1.256	50	20	IDGD	
COC(=O)N(C)Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)cc1	763858484	SYAMGPZUTWSROM-CYBMUJFWSA-N	446.435	1.577	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cccc(C(=O)OC)c2)cc1	763861837	QYUXFIAAHQROGT-ZDUSSCGKSA-N	429.429	1.425	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccc(O[C@H]2CCOC2)cc1	763868016	ZQPAKNVFXREBDS-UGSOOPFHSA-N	431.420	1.547	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccc(C(=O)OC(C)(C)C)c(C)c2)n1	763880222	DNMIJDVLMFUCFY-UHFFFAOYSA-N	429.477	1.550	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2cc(F)c(Br)cc2F)n1	763893483	VXKYIUBQKJQWQL-UHFFFAOYSA-N	430.209	1.327	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)C2=S=C3CCCCCCC3=C2)cc1	763912240	UHNRFXXAJCDTEV-UHFFFAOYSA-N	449.554	1.548	50	20	IDGD	
CCOC(=O)c1c(C)csc1NC(=O)C(=O)NNC(=O)c1cc(Cl)ccc1O	763976876	HHEVICKUULSSOP-UHFFFAOYSA-N	425.850	1.992	50	20	IDGD	
CN(C)C(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)on2)ccc1F	764003570	HQNZKLSONBWYHU-UHFFFAOYSA-N	439.403	1.582	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1ccc(F)c(Br)c1	764004243	NPLKUZMFOHCTGL-UHFFFAOYSA-N	438.209	1.759	50	20	IDGD	
CN(Cc1cccc(NC(=O)C(=O)NNC(=O)c2cnccn2)c1)C(=O)OC(C)(C)C	764031198	IIFIYJHORJVPNO-UHFFFAOYSA-N	428.449	1.243	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)Cc2ccsc2)ccc1-n1nnnc1C(C)C	764036138	XKPKDJDBJOQILW-UHFFFAOYSA-N	427.490	1.484	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)NC3CCCCC3)cc2C)n[nH]1	764106808	UOERZWZKRQXHLU-UHFFFAOYSA-N	426.477	1.489	50	20	IDGD	
O=C(CC(F)(F)F)NNC(=O)C(=O)Nc1ncn(Cc2cccc(Br)c2)n1	764115825	XMZXMSXWWMDAEO-UHFFFAOYSA-N	449.187	1.127	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccc(N2CCOC[C@@H]2C)cc1	764132212	LTWXUQJEIAIXMJ-HNNXBMFYSA-N	426.473	1.249	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(Br)cc2F)c1O	764132294	MRFGILBXOWOADY-UHFFFAOYSA-N	426.198	1.702	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2O1)C(=O)Nc1ccc(NC(=O)c2ccccc2)nc1	764167544	KSEZHYSTSZULKX-SFHVURJKSA-N	445.435	1.424	50	20	IDGD	
CC[C@H](C)Oc1ccc(NC(=O)C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1	764259329	FVGOLYXNGJCSNT-HNNXBMFYSA-N	440.504	1.656	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl	764261085	XYGSVCWRUKZUBJ-UHFFFAOYSA-N	447.839	1.041	50	20	IDGD	
COc1cccc(-c2nsc(NC(=O)C(=O)NNC(=O)COc3ccccc3O)n2)c1	764275730	SECVLRULVJXFPF-UHFFFAOYSA-N	443.441	1.084	50	20	IDGD	
Cc1cc(C(=O)NC(C)C)ccc1NC(=O)C(=O)NNC(=O)CCc1ccccc1O	764277340	CCXXMRBFJXDEKO-UHFFFAOYSA-N	426.473	1.558	50	20	IDGD	
COc1cc(F)ccc1NC(=O)C(=O)NNC(=O)c1cc(Br)ccc1O	764279671	BICRSSUDDNJYMJ-UHFFFAOYSA-N	426.198	1.702	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1cccc(-c2n[nH]c(C3CC3)n2)c1	764279851	GAKGAIMYHDRHRH-UHFFFAOYSA-N	436.428	1.220	50	20	IDGD	
O=C(Cn1cc(Br)ccc1=O)NNc1c(F)cc(C(=O)NC2CC2)cc1F	764334408	SRPCTIFNPWAVNT-UHFFFAOYSA-N	441.232	1.925	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1	764398041	CBCMNMRMBMTLTN-CYBMUJFWSA-N	444.419	1.627	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1	764398567	UFJPYMOVGSRKFQ-CQSZACIVSA-N	426.429	1.488	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1cc(C(F)(F)F)ccc1N1CCCC1	764401832	XYMNAEHGMMFRLO-GFCCVEGCSA-N	446.426	1.443	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1F)C(=O)Nc1ccccc1CN1C(=O)CCC1=O	764410680	NIVXJFRWQTYYJJ-UHFFFAOYSA-N	446.822	1.528	50	20	IDGD	
Cc1ccc(-c2n[nH]c(SCC(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)n2)cc1	764830794	MUVPJQDPOHVGBL-UHFFFAOYSA-N	445.526	1.737	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)cc1C	765126158	JEZSNMZAOCWDRU-UHFFFAOYSA-N	446.573	1.439	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)ccc1F	765620688	ZPKYJAXCPDUWEA-UHFFFAOYSA-N	435.412	1.338	50	20	IDGD	
COC(=O)Cc1cc(=O)n(-c2ccc(C(=O)NNc3ccccc3S(C)(=O)=O)cc2)[nH]1	766663867	VMFZZAHNKIQBSO-UHFFFAOYSA-N	444.469	1.042	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	767278644	HLIIOVSLVYMUSA-KRWDZBQOSA-N	443.525	1.985	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(OC[C@H]2CCOC2)c(F)c1)c1cccc([N+](=O)[O-])c1	767440518	UNOVASIRSZVWNE-LBPRGKRZSA-N	439.421	1.773	50	20	IDGD	
CC(=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O)c1ccc(Br)c(F)c1	767763255	FONVNEIGPPQOSU-UHFFFAOYSA-N	444.286	1.013	50	20	IDGD	
CC(C)(C)OC(=O)N1CCO[C@@H](C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)C1	768242925	KRAPNWJUOLEETG-OAHLLOKOSA-N	440.447	1.936	50	20	IDGD	
COc1ccc(O)c(C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)c1	768292096	UJWSHFOKTXEYFQ-UHFFFAOYSA-N	432.908	1.633	50	20	IDGD	
CSCCNC(=S)NNC(=O)c1cccn2c(I)cnc12	770242410	CFTVPWQKSOAATL-UHFFFAOYSA-N	435.316	1.411	50	20	IDGD	
COc1ccc(C(=O)N2CCN(C)CC2)cc1NC(=O)C(=O)NNc1c(C)cccc1F	770817899	CYBZYLULJAPNTB-UHFFFAOYSA-N	443.479	1.612	50	20	IDGD	
O=C(NCCS(=O)(=O)N1CCSCC1)NNc1ccc(Br)c(F)c1	771319352	FPXKCZPZNGEDDU-UHFFFAOYSA-N	441.348	1.593	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)CNC(=O)c1ccc(Br)s1	772030926	IGURDDZLOPAATG-SECBINFHSA-N	434.312	1.366	50	20	IDGD	
CNC(=O)COc1cccc(CC(=O)NNC(=O)Cc2nc(-c3ccccc3)cs2)c1	772394360	ZXLKDSKIGIKURQ-UHFFFAOYSA-N	438.509	1.868	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2cc(C)nn2-c2ccc(C)nn2)c1	773494183	PLFHIJFGLPNWQM-UHFFFAOYSA-N	437.460	1.061	50	20	IDGD	
CC[C@@H](C)NS(=O)(=O)c1cccc(NC(=O)C(=O)NNc2nccnc2C(C)C)c1	773992736	UPVBGUFOLJCIER-CYBMUJFWSA-N	434.522	1.759	50	20	IDGD	
COC(=O)NNS(=O)(=O)c1cc(C(=O)O)c(Br)cc1Br	775669762	OHYWEDGXKJADOQ-UHFFFAOYSA-N	432.046	1.459	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCC1([C@@H](C)CCO)CCC1	775713175	GYICSHKFPYZBGS-ZDUSSCGKSA-N	425.555	1.421	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)Cn1c(S)nnc1-c1ccc(Cl)cc1	778436693	OBKCQMCCWHSFSJ-UHFFFAOYSA-N	440.913	1.559	50	20	IDGD	
C[C@@H]1CN(S(=O)(=O)c2cccc(C(=O)NNc3cc(Cl)nc(N)n3)c2)C[C@@H](C)O1	779373322	FMPOIEKVLIBBEC-GHMZBOCLSA-N	440.913	1.267	50	20	IDGD	
O=C(NNC(=O)[C@H](O)[C@@H](O)c1nc2ccccc2s1)c1cc(-c2ccc(F)cc2)[nH]n1	779540567	RXOLQTCUBQGZNP-IAGOWNOFSA-N	441.444	1.681	50	20	IDGD	
CCNC(=O)N(C)NC(=O)[C@@H](CCS(C)(=O)=O)Cc1cccc(Br)c1	780709622	QWMBOJJCKLAIKV-ZDUSSCGKSA-N	434.356	1.735	50	20	IDGD	
COc1ccc(C[C@H](C)C(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1OC	781237324	TXGADQLZKIUCFC-ZDUSSCGKSA-N	434.518	1.637	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)C(=O)Nc2ncc(C)s2)c2ccccc2c1=O	782119953	CBTNNAIGGVPEKG-UHFFFAOYSA-N	442.501	1.751	50	20	IDGD	
Cc1ccc(NNC(=O)C(=O)Nc2cc(Br)ccc2N2CCOCC2)nn1	783953483	WYTSZOKNNXCIDI-UHFFFAOYSA-N	435.282	1.466	50	20	IDGD	
Cc1nnnn1-c1cccc(NC(=O)C(=O)NNc2ccc(C#N)c(C(F)(F)F)c2)c1	784237922	ZSIYAORANXOYPV-UHFFFAOYSA-N	430.350	1.943	50	20	IDGD	
O=C(NNc1ccc(Br)cn1)C(=O)Nc1ccccc1CN1CCOCC1	784339986	QZMMBYWBHQGGJG-UHFFFAOYSA-N	434.294	1.758	50	20	IDGD	
O=C(NNC(=O)c1cccc(Br)c1)N[C@@H]1CCCN(Cc2ccccn2)C1=O	784343678	KNTPXHDMVGPACF-MRXNPFEDSA-N	446.305	1.979	50	20	IDGD	
COc1cc(C(=O)OCC(=O)NNC(=O)Cc2ccccc2C)cnc1Br	786743297	BMBAZPZMPRHOPO-UHFFFAOYSA-N	436.262	1.708	50	20	IDGD	
Cn1nc(-c2ccsc2)cc1NC(=O)C(=O)NNC(=O)C(F)(F)Oc1ccccc1	787549656	OYRKRXGPGIDUDB-UHFFFAOYSA-N	435.412	1.906	50	20	IDGD	
COC[C@H](C)Oc1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)[C@@H]1Cc2ccccc2O1	787890092	UJRGHFQJNVZAQY-SGTLLEGYSA-N	447.875	1.843	50	20	IDGD	
Cc1c(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)nnn1CC1CCCC1	788718835	CJEFDTMWRSBZIW-UHFFFAOYSA-N	439.564	1.750	50	20	IDGD	
CN(C)NC(=O)Nc1cccc(NC(=O)CN2C(=O)N[C@]3(CCc4ccccc43)C2=O)c1	791278210	ZRUWHGUPNBHOAJ-QFIPXVFZSA-N	436.472	1.617	50	20	IDGD	
CCN(C(=O)OC(C)(C)C)[C@H](C)CNC(=O)NNC(=O)CNC(=O)c1cccs1	792309569	CQFXZAUAPIQQNJ-GFCCVEGCSA-N	427.527	1.454	50	20	IDGD	
CCN(C(=O)OC(C)(C)C)[C@H](C)CNC(=O)NNC(=O)c1cc([N+](=O)[O-])ccc1O	792314182	ISCXLAIQSJMBFS-LLVKDONJSA-N	425.442	1.890	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(N2CCCCC2)c2ncccc12	792356105	MEZFLXRZVGYJDO-HNNXBMFYSA-N	443.504	1.363	50	20	IDGD	
O=C(Cc1csc(N2CCOCC2)n1)NN=C1CCCc2c1cnn2-c1ncccn1	792943147	YOGAKKNYYSATOD-UHFFFAOYSA-N	438.517	1.355	50	20	IDGD	
C[C@@H](CN1CCOCC1)C(=O)NN=Cc1c(F)ccc(I)c1F	794477750	GKJAMSJQYVMEGO-JTQLQIEISA-N	437.228	1.988	50	20	IDGD	
C[C@@H](Oc1ccc(C=O)cc1)C(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	796515647	ZIMRKTWJGCIZQF-CQSZACIVSA-N	434.493	1.996	50	20	IDGD	
COC(=O)[C@H]1CN(C(=O)OC(C)(C)C)CCCN1[C@H](C)C(=O)NNC(=O)CC(C)C	796682707	KVKLZEZVAAWVDW-HUUCEWRRSA-N	428.530	1.053	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)c(C)cc1C	797033713	FEPKROWQNLYSDN-UHFFFAOYSA-N	447.517	1.313	50	20	IDGD	
COC(=O)c1ccc(S(=O)(=O)NNC(=O)c2ccc(Br)s2)cc1OC	799119561	CSIIWQIMQKLLSO-UHFFFAOYSA-N	449.304	1.929	50	20	IDGD	
O=C(NNc1nc(-c2ccncc2)no1)c1ccc(F)c(S(=O)(=O)N2CCOCC2)c1	801147535	WTEBNVQHUUFETI-UHFFFAOYSA-N	448.436	1.049	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@H]2CC(c3ccccc3[N+](=O)[O-])=NO2)cc1	802068132	BFRFTAWZVPOUAN-MRXNPFEDSA-N	447.429	1.344	50	20	IDGD	
N#Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)cc1Br	806973029	WOHSHEWNOHQEBP-UHFFFAOYSA-N	431.202	1.449	50	20	IDGD	
COC(=O)c1cc(Br)c(OC)cc1NC(=O)C(=O)NNC(=O)CCC(C)C	806978375	YKMSRHXKHVQRST-UHFFFAOYSA-N	444.282	1.766	50	20	IDGD	
O=C1COC[C@@H](C[C@@H]2CN(C(=O)C(=O)NNc3ccccc3[N+](=O)[O-])c3ccccc32)N1	806984385	JYTATZRFNSCGPP-ZIAGYGMSSA-N	439.428	1.073	50	20	IDGD	
CC(C)n1ncc2c(C(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)cc(-c3cccs3)nc21	807299829	UYGLCCAFBKANTG-LBPRGKRZSA-N	447.542	1.936	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)NCc2cnn(CC)c2)c2ccccc2c1=O	807518599	JOKHUYDBVDFMQT-UHFFFAOYSA-N	425.493	1.947	50	20	IDGD	
CCCNS(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)CCCc2cccs2)cc1	808092669	ZWWJOKSWCDHGMH-UHFFFAOYSA-N	445.588	1.769	50	20	IDGD	
C#CC[C@@]1(C(=O)NNC(=O)Cn2cnc3ccccc32)CCCN1C(=O)OC(C)(C)C	809558558	QURJIIHETHAOBL-QFIPXVFZSA-N	425.489	1.977	50	20	IDGD	
COC[C@@]1(CNC(=O)NNC(=O)c2ccc(OC)cc2OC)OCCc2ccccc21	811875925	GYMRIKCVZUUTDF-JOCHJYFZSA-N	429.473	1.762	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCc1ccc2cnn(C)c2c1	812867298	JVSAEAGTMUJEAG-UHFFFAOYSA-N	429.506	1.319	50	20	IDGD	
COC(=O)c1cn(-c2cccc(NC(=O)NNC(=O)Cn3ccc4ccccc43)c2)nn1	812978372	NDDSDSXQNCHMDH-UHFFFAOYSA-N	433.428	1.862	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)C2(S(=O)(=O)c3ccccc3)CCOCC2)cc1	813574894	JKXKLIZZANKCHB-UHFFFAOYSA-N	446.529	1.928	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@H]2CCCO2)nn1CCCOc1ccc(F)cc1	815778402	PICWMSXXSNNDSF-MRXNPFEDSA-N	433.440	1.065	50	20	IDGD	
Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)Nc1ccccc1C(=O)NNC(=O)[C@H]1CCCO1	817216335	WDEPSQYIMUOPPK-MRXNPFEDSA-N	448.457	1.644	50	20	IDGD	
Cc1ccc(/C=C(\C#N)C(=O)OCC(=O)N2CCN(c3ncnc4c3cnn4C)CC2)cc1	855350485	WLXZPQHELXPNGQ-WOJGMQOQSA-N	445.483	1.471	50	20	IDGD	
Cc1nc(C(C)(C)C)nc(O)c1C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	887545126	GNJAOXKZFUCJGV-UHFFFAOYSA-N	435.506	1.113	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1cnc2ccc(C)cn2c1=O	912876372	OXZQDGFZTBPJAZ-UHFFFAOYSA-N	444.831	1.283	50	20	IDGD	
CCOc1ccc(OCc2ccc(C(=O)NNC(=O)CC[C@H]3NC(=O)NC3=O)cc2)cc1	913422764	ZBSKSGVDZIXWIS-GOSISDBHSA-N	440.456	1.414	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)CCNS(=O)(=O)/C=C\c2ccccc2)c1	913450303	UVYDMKTTYQEJAS-QBFSEMIESA-N	431.514	1.810	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(=O)n(CC(=O)/C(C#N)=C2\Nc3ccccc3N2C)c1	913584277	WPACJHHLPUFPEI-LTGZKZEYSA-N	441.513	1.745	50	20	IDGD	
CCCCc1ccc(N2C[C@@H](C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)CC2=O)cc1	914405964	DQIOOXMJEIINKQ-SFHVURJKSA-N	447.499	1.819	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)NC[C@H]2CN(Cc3ccccc3)CCO2)c1	915893977	FUHHXZNTQGTPNN-FQEVSTJZSA-N	428.489	1.549	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)N[C@H](CN1CCOCC1)c1ccccc1	916214670	SIQFYUZBXUOIAA-QFBILLFUSA-N	430.480	1.997	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)NCc2ccccc2CS(=O)(=O)N2CCOCC2)n1	916229452	PYDBJMGMKQIFPD-UHFFFAOYSA-N	434.522	1.082	50	20	IDGD	
COc1ccc(CNC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cn1	916234590	KOCLCTHRQXBNAS-UHFFFAOYSA-N	433.490	1.019	50	20	IDGD	
CC(=O)Nc1ccc(CNC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1	916247865	MUGPLZHYJTUBEN-UHFFFAOYSA-N	438.532	1.688	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCc2ccccc2Cn2cncn2)c2ccccc2c1=O	916393807	MDVJBHLBJCQYSI-UHFFFAOYSA-N	446.471	1.200	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NCCCN2CCN(C(=O)OC(C)(C)C)CC2)cc1	916641067	VCTJNQPLDGXUEV-UHFFFAOYSA-N	449.552	1.647	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2ccc3ccccc3c2)cc1	918108322	AJKVZEOBFNEKPR-UHFFFAOYSA-N	425.466	1.782	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)NCc2cccc(OCC(=O)N(C)C)c2)cc1OC	918224122	QKLQHWCBCSITCS-UHFFFAOYSA-N	444.488	1.705	50	20	IDGD	
CCC1CCC2(CC1)NC(=O)N(CC(=O)NNC(=O)CCc1ccc(OC)cc1)C2=O	919836569	YGQNZHMGICIOOE-UHFFFAOYSA-N	430.505	1.666	50	20	IDGD	
O=C(/C=C/c1cc(C(F)(F)F)ccc1Cl)NNC(=O)N[C@H]1CCS(=O)(=O)C1	919885715	QYJPEARSVXJHST-BQTOJVEASA-N	425.816	1.890	50	20	IDGD	
CC(C)(C)OC(=O)Nc1ccc(CC(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)cc1	919889631	QJNBZBZYFUQYHQ-AWEZNQCLSA-N	426.495	1.094	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2cccc(NC(=O)C3CC3)c2)ccc1Cl	920277259	PBXJRVSSLJIQTE-UHFFFAOYSA-N	436.877	1.411	50	20	IDGD	
CCOc1ccc(NC(=O)CNC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc1	920342703	BYPGEFTVDOXIAL-UHFFFAOYSA-N	438.444	1.559	50	20	IDGD	
COCCCNC(=O)NNC(=O)CCNS(=O)(=O)c1c(C)c(C)c(C)c(C)c1C	920889278	RIQKONNQEQTXJT-UHFFFAOYSA-N	428.555	1.264	50	20	IDGD	
CCOc1ccc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)[C@H]3CCOC3)cc2)cc1	921203038	PDXOYBQVRBBNAC-HNNXBMFYSA-N	433.486	1.684	50	20	IDGD	
N#Cc1ccc(N2C(=O)N[C@@H](CCC(=O)NNC(=O)c3ccccc3Cl)C2=O)cc1	1116061004	SMZAERUCQAUSAJ-INIZCTEOSA-N	425.832	1.878	50	20	IDGD	
O=C(NNC(=O)c1n[nH]cc1I)c1cccc(Br)c1	1116650364	SZYJDDMZIJZCQB-UHFFFAOYSA-N	435.019	1.852	50	20	IDGD	
CN1C(=O)c2ccc(C(=O)NNC(=O)C3CCN(C(=O)OC(C)(C)C)CC3)cc2C1=O	1321910263	NGMOQIXOJLDAHG-UHFFFAOYSA-N	430.461	1.321	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)c1n[nH]cc1I	1339250259	IZTZCTQIDJWZMM-SSDOTTSWSA-N	434.621	1.896	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@]2(C1)CN(C(=O)c1sccc1Cl)CCO2	1779032412	JHLVLGPMJBHXNM-IBGZPJMESA-N	449.920	1.157	50	20	IDGD	
O=C(c1cnc2snnc2c1)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1780071556	KHOIKUQILQIOJN-NHYWBVRUSA-N	444.286	1.220	50	20	IDGD	
N[C@@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Br)C1)c1ccccn1	1780771521	JUGAEEAKRQUIJY-ATNYBXOESA-N	443.317	1.286	50	20	IDGD	
CC(C)(C)OC(=O)N[C@]1(C(=O)N2CC[C@@]3(CN(C(=O)[C@@H](F)Cl)CCO3)C2)CCOC1	1781308796	IRANNCQFXDRBJX-UPRAQXHNSA-N	449.907	1.035	50	20	IDGD	
O=C(c1n[nH]c2c(F)cccc12)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781332184	VHZUWPYAYIVQSN-YOEHRIQHSA-N	443.248	1.836	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc([N+](=O)[O-])c(O)cc3C)C2)C1	1782103932	DIACGCOKUQSZCL-LIRRHRJNSA-N	441.868	1.306	50	20	IDGD	
Cc1nccn1[C@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Br)C2	1782626178	IVCVIOZXMZSPDH-LJGDNWOOSA-N	445.333	1.957	50	20	IDGD	
O=C(c1ncon1)N1CCO[C@@]2(CCN(C(=O)[C@@H](Br)Cc3ccccc3)C2)C1	1783022270	JSGFDCVQHNAKGI-HNAYVOBHSA-N	449.305	1.519	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cnn(C(C)(C)C)c3)CCO2)C1	1783532086	ITYFMLPDAPAWKG-SCLBCKFNSA-N	427.343	1.865	50	20	IDGD	
COc1ccc(F)cc1CC(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](C)Br)C2)C1	1783540326	UEFIWPYBPFPEPM-DJJJIMSYSA-N	443.313	1.990	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)CCc3ccc(OC)nc3)CCO2)C1	1783872600	COOKWEUEPYMPLO-OXQOHEQNSA-N	425.913	1.107	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cc(Cl)nc(OC)c3)CCO2)C1	1783877119	GCHJSZVNPGQAKC-SCLBCKFNSA-N	432.304	1.441	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H]1C(=O)N1CCO[C@@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783941517	DUBBYPXFNLUOBE-KZULUSFZSA-N	436.336	1.629	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](N)c3ccccn3)C[C@@H]21	1783968683	YTXCBZUHWUWZNX-HZRXROBNSA-N	439.354	1.092	50	20	IDGD	
O=C(CCc1cccc(O)c1)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1784125966	ZFJZMBUGMDCPFR-AEFFLSMTSA-N	429.286	1.845	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CNC(=O)c3cccnc3)C[C@@H]21	1784616336	PKBJTCLWQRYORS-FJIDUMEYSA-N	436.940	1.199	50	20	IDGD	
C[C@H](NC(=O)c1ccccc1)C(=O)N1CC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1785553274	RHZWMSYSLFRBEE-AOMKIAJQSA-N	435.952	1.900	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)c1nccc2[nH]ccc12	1787335089	BPXNOGLYVQOAGS-NOLJZWGESA-N	435.322	1.941	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)c1cnn2ncccc12	1787378794	MUJUWUILKVQJCD-LVGORTOPSA-N	440.273	1.013	50	20	IDGD	
Cc1nccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)CBr)C[C@@H]32)n1	1787691072	WJCIDPLMCKFMMD-PCBIJLKTSA-N	425.327	1.409	50	20	IDGD	
Cc1cc(C(=O)NC2(c3ccc(NC(=O)c4cccc(B(O)O)c4)cc3)CCC2)n(C)n1	1788145926	HQDZOQZJKOBLCT-UHFFFAOYSA-N	432.289	1.470	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(C(F)(F)F)[nH]3)[C@H]2C1	1788795240	KWUHBTZBOSCDAX-MNXVOIDGSA-N	437.846	1.881	50	20	IDGD	
CN(C)c1ncc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]3C2)o1	1789865733	AQMSOAYLJNYRFW-PAKFGRKTSA-N	433.336	1.570	50	20	IDGD	
CCN(CC)C[C@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21	1790604402	SDIVWVCSQALKNF-UVPYHEFZSA-N	436.366	1.635	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(NC(C)=O)c3)C[C@@H]21	1791256040	DJEJCVOLHGIQSM-KANFNMMFSA-N	437.924	1.492	50	20	IDGD	
Cc1cc(C(=O)NC2(c3ccc(NC(=O)CCC(=O)NN(C)C)cc3)CCC2)n(C)n1	1791599326	HFYJTZYAYDRZFT-UHFFFAOYSA-N	426.521	1.849	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccnc1S)C2	1792866792	JDHXGDUMRKDGEW-FMSGJZPZSA-N	428.352	1.605	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc([N+](=O)[O-])o1)C2	1792867087	WDGJOYHMSJIXDW-DYNIEEOBSA-N	430.255	1.422	50	20	IDGD	
COC(=O)[C@@H]1CC[C@@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@](C)(Cl)CCl)C3)C1	1792974125	XLCIJZMJSXAUES-GPPYEEBYSA-N	435.348	1.402	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C[C@@H]1CCCCO1	1794020954	GCLNWBRLBVLKQM-OSVXTHCDSA-N	429.521	1.718	50	20	IDGD	
CN(C)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@](C)(Cl)CCl)C2	1794472056	CAVXJYBELOWZQE-AODNKKSCSA-N	429.348	1.587	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccnc3c(O)cccc13)C2	1795116384	FGORZJCSSMGWFW-IVWMJMPLSA-N	448.317	1.929	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc[nH]c2nccc1-2	1796186294	LTRCQRUOBBJBNE-CVGJEZRXSA-N	425.316	1.954	50	20	IDGD	
CC(C)(Cc1ccccc1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1	1796187942	NVJJTFNLGQQFAU-KOUNCHBCSA-N	434.345	1.887	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)c1cc(F)cc(Cl)c1	1796192825	SZKDDUHEBLFQJU-REPLKXPHSA-N	430.672	1.725	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccsc1)C2	1796440691	YFKJAGHYEUCXGH-KHQZIQSYSA-N	443.529	1.014	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cn(C)nc1C(F)F	1796700179	SJQLEKVVGNWLTM-KQXIARHKSA-N	449.296	1.592	50	20	IDGD	
Cc1cc2nnc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)[C@H](F)Br)C4)c(C)n2n1	1797439707	GSYSUEFUWGEZAW-OXIQGZBJSA-N	439.289	1.683	50	20	IDGD	
Cn1c(=O)n(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CO[Si](C)(C)C)C3)c2ccccc21	1797749130	NJHOYPRYBHYTIV-BJWYYQGGSA-N	444.608	1.830	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1n[nH]c3c(F)cccc13)C2	1797956952	RKBVQTSXIPRRND-FVCICTRLSA-N	434.544	1.757	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cn1nccn1	1800243683	QZPAQTDLKCHGAQ-XGUBFFRZSA-N	440.932	1.048	50	20	IDGD	
C[C@@H](Oc1ccccn1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2	1801366572	JLCGSZDWAZGCLI-GGUBGCTKSA-N	430.274	1.129	50	20	IDGD	
COc1cc(F)ccc1CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CO[Si](C)(C)C)C2	1802180397	QFQAQLHNFZQSAY-VPTLXERWSA-N	438.572	1.818	50	20	IDGD	
CCn1nc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CCC(=O)NN(C)C)c2ccccc21	1802333318	VGNINMYNQKGXPA-BJWYYQGGSA-N	440.548	1.681	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1[nH]cnc1-c1cccnc1)C2	1802336388	LPLOZDHLEDINOF-BJWYYQGGSA-N	439.520	1.097	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@]1(F)CCCCC1(F)F)C2	1802336636	RIIPWHAPBGRGCZ-YGTYGHESSA-N	432.487	1.915	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cnn3ncccc23)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803139533	QMFQBQLFJWMTGJ-JCGIZDLHSA-N	428.880	1.044	50	20	IDGD	
C#CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](O)CCl)C2	1804371170	YWSXHHZGOBLPSM-JKJDWNRSSA-N	427.929	1.141	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CCC2(CCCN(C(=O)[C@H](O)CCl)C2)CC1	1805528696	XJSIXAWPRNQIDP-GVDBMIGSSA-N	426.941	1.573	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)C2CCCC2)[C@H]1c1cccnc1	1806180575	KAXODGXHGNOQNN-FXAWDEMLSA-N	436.516	1.590	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H](CNC(=O)[C@@H]2CCC(=O)N2)[C@H]1c1cccnc1	1806639883	FQRVGPKBTWEIPF-DZASIIFFSA-N	427.332	1.602	50	20	IDGD	
Cc1nn[nH]c1C(=O)N1CC[C@H](CNC(=O)[C@H](F)Br)[C@@H]1c1cccnc1	1808662758	QYKBGFXKPJTSDX-XBFCOCLRSA-N	425.262	1.518	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@H]1CCN(C(=O)Cn2ccccc2=O)[C@H]1c1cccnc1	1810541496	KMLMRJYFVPANOI-GCJKJVERSA-N	442.592	1.801	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H](CNC(=O)[C@H]2CCCS2(=O)=O)[C@@H]1c1cccnc1	1812494330	SYZJWIZLEHFWFO-ZACQAIPSSA-N	441.981	1.930	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)C(=O)c2cccn2C)[C@H]1c1cccnc1	1813033826	SXDDVNSMIPCUMZ-RYRKJORJSA-N	432.908	1.563	50	20	IDGD	
Cc1ncsc1C(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1813070380	IGWSFPZQOXVWNT-QFBILLFUSA-N	444.561	1.539	50	20	IDGD	
COC(=O)NCC(=O)NC[C@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1	1813264295	CIQXURBOXFJVCM-CZUORRHYSA-N	427.299	1.228	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccn3c(O)nnc23)[nH]n1)[C@@H](O)CCl	1814870099	IMLHXOQFYBGRPI-STQMWFEESA-N	433.856	1.064	50	20	IDGD	
C[C@]1(C(=O)N[C@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)CC=CCC1	1815361743	QHVSWVGVLIZHEZ-AOMKIAJQSA-N	439.346	1.795	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1)c1cnn(-c2cccnc2)c1	1816206359	STCPAEGXADKLBS-IRXDYDNUSA-N	443.895	1.896	50	20	IDGD	
CC(C)=NO[C@@H](C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1	1817477159	NPFNOHWCYPSAQD-KSSFIOAISA-N	441.297	1.196	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2c[nH]c(=O)cn2)[nH]n1)[C@@H](F)Br	1820935871	WBNLWEJELCEIAD-ZWNOBZJWSA-N	427.234	1.489	50	20	IDGD	
COc1cc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)CCBr)CC3)nn1C	1821765633	FHXOSDZIYBOAGZ-VIFPVBQESA-N	442.339	1.896	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccnc(F)c2)[nH]n1	1822410470	KQIUQEYEIQWYJN-OAHLLOKOSA-N	431.472	1.623	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC[C@@H]1c1cc(NC(=O)C(F)(F)Cl)n[nH]1	1822565857	JWPGTCBYGNGSJF-CYBMUJFWSA-N	426.616	1.227	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)[C@H]2CCCCO2)CC1	1823818102	KXDHOIIGJDWXIA-LEWJYISDSA-N	428.338	1.169	50	20	IDGD	
CN1N=C(C(=O)N2CCCC[C@H]2C2CCN(C(=O)[C@H](F)Br)CC2)CCC1=O	1824925738	FMFMZSSFBTUXCA-HOCLYGCPSA-N	445.333	1.905	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1c(C)nn(C)c1C)CC2	1825994936	QUDLCMXQPIFOKM-NWDGAFQWSA-N	425.942	1.973	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1n[nH]cc1[N+](=O)[O-])CC2	1826003386	KSQHGBFOVOULCX-JGVFFNPUSA-N	428.858	1.254	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc([N+](=O)[O-])[nH]1)CC2	1826004310	ZCBJFXPDLDATLW-BDAKNGLRSA-N	427.870	1.859	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H]1CCC(F)(F)C1)CC2	1826080905	GZXJRYJOYAUTGS-VXGBXAGGSA-N	443.520	1.864	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)C#Cc2ccccc2)CC1	1826523387	PPSDOYRSXFSCEQ-DEOSSOPVSA-N	444.340	1.651	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](C)n3cnnn3)sc2C1	1826984460	GCZCNLSKMAYLHI-UTLUCORTSA-N	442.343	1.476	50	20	IDGD	
C[C@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1)n1cccn1	1827055088	PNUVLWACUBUKFC-DYESRHJHSA-N	438.337	1.057	50	20	IDGD	
CC(C)N1CCC[C@H]1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830370268	OQBRRIFZEUASOP-LAUBAEHRSA-N	429.989	1.581	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)o1	1830535850	UQHTYPSLRSHBRC-FZKQIMNGSA-N	429.311	1.689	50	20	IDGD	
Cc1noc(C)c1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2	1830537458	ITHYMJLEABZPPA-KPZWWZAWSA-N	444.326	1.392	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccccn3)C2)C1	1830537478	JPSYDVXIMVZSMU-KBXCAEBGSA-N	426.311	1.183	50	20	IDGD	
Cc1cccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)n1	1830916343	NSPLNMBFWUXJAI-NRFANRHFSA-N	435.597	1.240	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4cncn4c3)C2)C1	1831651495	PXYCLMJJFARTCD-NQIIRXRSSA-N	434.924	1.812	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CNC(=O)c2ccco2)CC1	1831830877	XZCOPDYHAZNJCK-SJORKVTESA-N	439.940	1.883	50	20	IDGD	
CC(C)N1CCC[C@H]1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1	1832445977	DGQADAYWFQZXCD-RTWAWAEBSA-N	449.640	1.852	50	20	IDGD	
Cc1ccc(CCC(=O)N2CCC(N3CCC(NC(=O)[C@H](O)CCl)CC3)CC2)nc1	1833308211	LIWBOCWQEFNOPT-HXUWFJFHSA-N	436.984	1.494	50	20	IDGD	
Cc1cc(C(=O)N2CCC(N3CCC(NC(=O)[C@@H](O)CCl)CC3)CC2)ccc1F	1833313234	AZKNHKNPRGBINO-IBGZPJMESA-N	425.932	1.919	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](O)NC(=O)OCC)CC2)CC1	1833533754	ORXBZENTNQNUHC-SJLPKXTDSA-N	446.976	1.030	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3ccc(O)nn3)CC2)CC1	1834071981	WNHNRCMVKGBDPV-LBPRGKRZSA-N	440.342	1.151	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3ncnn3C)CC2)CC1	1834076665	VPRFGSSGAMCCSK-OAHLLOKOSA-N	441.374	1.174	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)C[C@H](NC)C(=O)O)CC2)CC1	1834740680	QFFANBLOXFZEHD-IRXDYDNUSA-N	430.977	1.028	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3ccc[nH]3)CCO2)C1	1836016065	VGLJSIWKZADCGV-RTBURBONSA-N	432.348	1.640	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)Cc1cccs1)CCO2	1836089560	SYGHCHOMAXQEJF-IBGZPJMESA-N	426.611	1.599	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3cccnc3)CCO2)C1	1836158545	OTTKWSWVGRSUQJ-OALUTQOASA-N	430.332	1.317	50	20	IDGD	
Cc1noc(C)c1CC(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836714920	CRXCHFCDIVJJII-SFHVURJKSA-N	427.929	1.432	50	20	IDGD	
COc1ccccc1CC(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836718734	BTQIWXZTMXTZDI-LJQANCHMSA-N	438.952	1.836	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3c(F)cncc3F)CCO2)C1	1838168152	BXLBWTYTCAQBQW-GTNSWQLSSA-N	448.264	1.213	50	20	IDGD	
COc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)ccc1O	1838975895	XAWQCMHQOWKGCC-SFHVURJKSA-N	433.288	1.275	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccc(OC)c(O)c3)C2)C1	1839141584	MZQWPOVREAGBPC-HRAATJIYSA-N	440.924	1.417	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4cccnc4nc3O)C2)C1	1839148449	YNSXOFBBAKHRRS-IERDGZPVSA-N	448.907	1.423	50	20	IDGD	
O=C(C#Cc1ccccc1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839199521	PIWRDYACWGAUGX-IEBWSBKVSA-N	439.281	1.185	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccc(F)cc3F)C2)C1	1840155550	DZHPWVZJUQEPSP-UZLBHIALSA-N	446.878	1.218	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H]2COC[C@@]2(C(=O)N2CCCC23CN(C(=O)[C@H](F)Cl)C3)C1	1841081677	JKBZWBSAEWPEMY-YRVVQQKDSA-N	445.919	1.608	50	20	IDGD	
O=C([C@@H](F)Cl)N1CC2(CCCN2C(=O)c2nccn(Cc3ccc(F)cc3)c2=O)C1	1842242476	PCGZPKPSTQOEJE-MRXNPFEDSA-N	436.846	1.782	50	20	IDGD	
Cc1cc(C(=O)N2CCCC23CN(C(=O)C(Cl)Cl)C3)n(-c2cccc(=O)n2C)n1	1843132761	ULROVMROVKDDNX-UHFFFAOYSA-N	438.315	1.500	50	20	IDGD	
CC(C)(C)OC(=O)N1CC2(C[C@H](C(=O)N3CC4(CCCN4C(=O)[C@@H](F)Cl)C3)CO2)C1	1843366828	SIHPYMFFIVAHPZ-UONOGXRCSA-N	445.919	1.750	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2cc(O)nc3ccccc23)C1	1843691059	ONLUQVMJZWALKM-UHFFFAOYSA-N	446.467	1.070	50	20	IDGD	
C[C@H]1CCC[C@H]1C(=O)N1CCCC12CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2	1843967548	WIVCSWAVTKZPJD-AZUAARDMSA-N	441.576	1.972	50	20	IDGD	
CN(CC(=O)N1CCCC12CN(C(=O)CC1CCC1)C2)NC(=O)NCc1ccccc1	1845039799	PFTRYWMNMJDIHJ-UHFFFAOYSA-N	427.549	1.726	50	20	IDGD	
CC(C)(C)OC(=O)N1CC2(CC(C(=O)N3CCCC34CN(C(=O)[C@H](F)Cl)C4)=NO2)C1	1846123115	JHRDHTVVWIDYMB-ZDUSSCGKSA-N	444.891	1.490	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@](F)(C(=O)N2CCCC23CN(C(=O)[C@H](O)CCl)C3)C1	1846124179	WBEYGWMDUBNONI-JLTOFOAXSA-N	447.935	1.529	50	20	IDGD	
O=C(NNC(=S)NCCc1cccs1)c1ccc(S(=O)(=O)N2CCCC2)cc1	11506532	NDPJTPWVIIEIEL-UHFFFAOYSA-N	438.600	1.884	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(C(=O)NNC(=S)NC(C)(C)C)ccc1Br	14895210	APWUCBBSIBNRMJ-UHFFFAOYSA-N	437.385	1.607	50	20	IDGD	
O=C(CN1C(=O)c2ccc(Br)cc2C1=O)NNC(=O)c1c[nH]c2ccccc12	17523873	PURLIVUYSJXEHX-UHFFFAOYSA-N	441.241	1.988	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(Cl)s1)NNC(=O)c1cc2ccccc2cc1O	725880155	YAGDXFNWZIDKAW-UHFFFAOYSA-N	439.902	2.000	50	20	IDGD	
O=C(CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)NNc1nc(-c2ccncc2)no1	726370895	QSZCYOLUOZKAGA-UHFFFAOYSA-N	425.361	1.871	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)c2nccnc2C(=O)NCc2ccc(F)cc2)cc1	726523610	RXEIZAIFMIFGLW-UHFFFAOYSA-N	437.431	1.694	50	20	IDGD	
CNS(=O)(=O)c1cccc([C@@H](C)NC(=O)NNC(=O)c2ccc(Cl)cc2OC)c1	727608388	QAAFTNAXDLNGEE-LLVKDONJSA-N	440.909	1.962	50	20	IDGD	
COC(=O)c1ccc(C(=O)OC)c(S(=O)(=O)NNC(=O)CCCc2ccccc2)c1	727721341	FKWWGLYDUVOEGN-UHFFFAOYSA-N	434.470	1.592	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)Cc2c(C)nc3c(c(O)nn3C)c2C)cc1	729755620	GTLRAVDLUPTLIQ-UHFFFAOYSA-N	425.445	1.146	50	20	IDGD	
Cc1ccc(C(=O)N[C@@H](CC(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)c2ccccc2)cc1	729827840	UISSDNDDXWLLBX-OALUTQOASA-N	443.525	1.438	50	20	IDGD	
O=C(COc1ccccc1-c1ccccc1)NNC(=O)NCCCN1C(=O)CNC1=O	731118056	MJHOOJFFNRHJDV-UHFFFAOYSA-N	425.445	1.005	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)NCc1ccc(S(=O)(=O)N2CCCC2)cc1	731362997	RKYGDXLWJDBEHD-UHFFFAOYSA-N	434.493	1.683	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC(NC(=O)NNC(=O)Cc3ccccc3F)CC2)cc1	731401401	FGIJTXRFGAVBDR-UHFFFAOYSA-N	448.520	1.860	50	20	IDGD	
C=CCN1C(=O)C(=O)N(CC(=O)NNc2ccc(Br)cc2C(F)(F)F)C1=O	731478276	JGXYCWDNFMEUCX-UHFFFAOYSA-N	449.183	1.888	50	20	IDGD	
O=C(NNC(=O)C12CC3CC(CC(C3)C1)C2)c1ccc2c(c1)S(=O)(=O)N=C1N=CNN12	731496146	CPBYOMHFWNWDCT-UHFFFAOYSA-N	442.501	1.075	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)NC1CCN(CCC(=O)N(C)C)CC1	731502914	SSYIYUOBKFASJD-UHFFFAOYSA-N	425.917	1.235	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)c1cc(C(C)C)nc2c1c(O)nc(=O)n2CC(C)C	731879165	GKKQJBNXRWFBPN-UHFFFAOYSA-N	427.465	1.383	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])o2)cc1OC	731957508	OJKVDLDKPRJIMR-LBPRGKRZSA-N	432.389	1.271	50	20	IDGD	
COc1ccc(-c2noc(CCCC(=O)NNC(=O)CCN3C[C@H](C)O[C@@H](C)C3)n2)cc1	732262888	XAJZTDQMMFJJDH-HOTGVXAUSA-N	445.520	1.715	50	20	IDGD	
Cc1nn(-c2ccc(F)cc2)c(C)c1CC(=O)NNC(=O)CCN1C[C@H](C)O[C@H](C)C1	732263111	JWJATGJYNDNDSX-GASCZTMLSA-N	431.512	1.817	50	20	IDGD	
CSCC[C@H](NC(=O)Cc1ccccc1)C(=O)NNC(=O)Cn1cnc2ccccc21	732750516	SNDUEHSYHGQVMP-SFHVURJKSA-N	439.541	1.664	50	20	IDGD	
O=C(CCN1CCN(C(=O)[C@@H]2CCCO2)CC1)NNc1nc(-c2ccc(Cl)cc2)no1	732975670	SNNPSZJVUNQYBI-INIZCTEOSA-N	448.911	1.546	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)NC[C@@H]1OCCc2ccccc21	733652116	VJLOZDOVXFEJGQ-QFIPXVFZSA-N	437.544	1.843	50	20	IDGD	
O=C(NNc1cnnc2ccccc12)C1CCN(C2=NS(=O)(=O)c3ccccc32)CC1	733810612	RKVQIHHWXXBTQC-UHFFFAOYSA-N	436.497	1.934	50	20	IDGD	
Cc1cc(F)ccc1N1CCC[C@@H](NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)C1	735330268	XDOBPGIWUKJMIT-QGZVFWFLSA-N	438.467	1.723	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)c1ccc2c(c1)CCN2C(=O)CNC(C)=O	735649362	DPLYKSXUQGOJDL-UHFFFAOYSA-N	444.875	1.449	50	20	IDGD	
O=C(CN1CCN(C(=O)CCCC[C@H]2CCSS2)CC1)N[C@@H]1CCS(=O)(=O)C1	736165218	AEXYGJJQTJGYJV-CVEARBPZSA-N	449.664	1.148	50	20	IDGD	
CCOc1ccc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)c3nonc3C)cc2)cc1	736668298	VKGOGBFCEBSWIK-UHFFFAOYSA-N	445.457	1.652	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)[C@@H]2CCCN(C(=O)COc3ccccc3)C2)c1	741172674	CZBMADUJNQQFNX-MRXNPFEDSA-N	441.484	1.782	50	20	IDGD	
O=C(CN1C(=O)N[C@@]2(CCc3ccccc32)C1=O)NNC(=O)c1cccc2ccccc12	741575131	IDWSLPXAXRBPCA-XMMPIXPASA-N	428.448	1.994	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)CCCN(C)C1=NS(=O)(=O)c2ccccc21	741913094	SSMWMKNUGZAWLN-UHFFFAOYSA-N	444.513	1.246	50	20	IDGD	
Cc1cc(Cl)ccc1OCCCC(=O)NNC(=O)CN1C(=O)[C@H]2[C@H](C1=O)[C@H]1CC[C@H]2O1	742465110	DCJVMWZBKKAPHW-OHDICMOHSA-N	449.891	1.117	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(\C#N)C(=O)OCc2nc(CS(C)(=O)=O)no2)c1C	744459961	HFSDFFVAFCBHIX-HFVKVNHUSA-N	436.490	1.890	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCc2ccccc2NC(C)=O)nc1	745856823	HCUYZWYOPMKYOD-UHFFFAOYSA-N	434.522	1.897	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1)[C@H]1CCOC1	745861047	HXFJAZCNCCVHAL-QAPCUYQASA-N	446.529	1.534	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)NCCN1CCN(c2ccc(F)cc2)CC1	746749577	CZQQUWGYMXVVLA-UHFFFAOYSA-N	439.495	1.169	50	20	IDGD	
O=C(NCc1cn(-c2ccccc2)nc1-c1ccccc1)NNC(=O)C(=O)N1CCCC1	748447427	RIPKZDVTBIRTRV-UHFFFAOYSA-N	432.484	1.992	50	20	IDGD	
CC(C)[C@H](C(=O)NNc1ccc(S(=O)(=O)C(F)F)cc1)N1CCCS1(=O)=O	748611070	DZFWSWZVWDMNII-CYBMUJFWSA-N	425.479	1.186	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)NC[C@@H](c1ccccc1Cl)N1CCOCC1	748620919	LGEUITUYMYTQHV-YOEHRIQHSA-N	428.917	1.095	50	20	IDGD	
Cc1cc(N2CCC(NC(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)CC2)nc(C)n1	749614548	CJSJPFVDGWMGNH-UHFFFAOYSA-N	446.533	1.110	50	20	IDGD	
C#CCNS(=O)(=O)c1ccc(C(=O)NNc2nc(Br)cn3ccnc23)cc1	750248133	KKUQPSONQVDTDS-UHFFFAOYSA-N	449.290	1.160	50	20	IDGD	
CCN(CC)S(=O)(=O)N1CCN(S(=O)(=O)c2ccc(CCCCl)cc2)CC1	750854327	SFCBZLIWXOMHPV-UHFFFAOYSA-N	438.015	1.751	50	20	IDGD	
Cc1nc2nc(C(F)(F)F)nn2c(C)c1CCC(=O)NNC(=S)N[C@H](C)C1CC1	751618246	QHVMKZBXGQFNGJ-MRVPVSSYSA-N	429.472	1.986	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)NC2CN(C(=O)OC(C)(C)C)C2)c2ccccc2c1=O	751805668	ZHJVCNAYBIHOQQ-UHFFFAOYSA-N	444.492	1.541	50	20	IDGD	
COc1cc(OC)cc(N2C[C@H](C(=O)OCC(=O)NNC(=O)c3ccccc3)CC2=O)c1	752581246	KWJFZVVSLIHSDK-OAHLLOKOSA-N	441.440	1.061	50	20	IDGD	
COc1ccc([C@H]2[C@H](C(=O)NNC(=O)CO)CCC(=O)N2c2ccc(C)cc2)cc1OC	753442285	CVZUUCHDJYJPAN-VGSWGCGISA-N	441.484	1.636	50	20	IDGD	
Cc1oc(C(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)cc1S(=O)(=O)N(C)C	754175614	CJRYOJJSHUCLTH-UHFFFAOYSA-N	443.865	1.110	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)c(C)o1	754746178	WNUNZMVBGXUCED-UHFFFAOYSA-N	448.457	1.289	50	20	IDGD	
CC(C)CNc1nc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cs1	754822950	HWYMOKBNQLBFAH-OAHLLOKOSA-N	434.474	1.355	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1cc(C(C)(C)C)nn1-c1ccc(F)cc1	755744424	BRIQUZMHORKJLZ-NSHDSACASA-N	440.501	1.399	50	20	IDGD	
NC(=O)c1ccc(F)c(NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1	756067797	VVXWJNNVGKYOLY-UHFFFAOYSA-N	449.464	1.176	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)Nc2cc(C(N)=O)ccc2CN(C)C)cc1OC	756827333	RVEYOHDTDLSORE-UHFFFAOYSA-N	429.477	1.721	50	20	IDGD	
CNC(=O)c1cc(Oc2ccccc2NC(=O)NNC(=O)[C@H](C)OCCOC)ccn1	756866468	UVZVGYSDKSPORT-ZDUSSCGKSA-N	431.449	1.438	50	20	IDGD	
CCOC(=O)c1cc(Br)cc(S(=O)(=O)NNC(=O)c2cnccn2)c1	756930592	YONMKDWAMFIAPN-UHFFFAOYSA-N	429.252	1.039	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)NNC(=O)Cc2ccccc2F)cc(S(C)(=O)=O)c1	757609571	ZEZJZFLWIGTJCG-UHFFFAOYSA-N	437.449	1.801	50	20	IDGD	
CCCCOc1c(Cl)cc(C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)cc1OCC	758043112	FNCONDDDPNRXRR-NSHDSACASA-N	435.930	1.616	50	20	IDGD	
N#Cc1ccc(S(=O)(=O)N2CCC(C(=O)NNc3ncccc3[N+](=O)[O-])CC2)cc1	759293738	DBSSRVZXOSBFAO-UHFFFAOYSA-N	430.446	1.405	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)c2ccc(OC)c(S(=O)(=O)N3CCCC3)c2)nc1	759728313	BHMIYMCRQHGQOD-UHFFFAOYSA-N	434.474	1.418	50	20	IDGD	
Cc1nnc([C@@H](C)NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)s1	760135681	AEHFZJGNMDXJNT-LLVKDONJSA-N	438.535	1.336	50	20	IDGD	
CCO[C@@H]1C[C@@H](NC(=O)NNc2ccc(S(=O)(=O)N(CC)CC)cn2)[C@]12CCCO2	760140429	CICFFFBHWBJVDS-GPMSIDNRSA-N	441.554	1.465	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCC(OC[C@H]2CCOC2)CC1	761114982	ZBSMVVHZGLPZHZ-AWEZNQCLSA-N	425.913	1.627	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)N[C@@H]1CCCN(c2ccccc2F)C1=O	761817689	RXTWCGFPIRJVTI-OAHLLOKOSA-N	430.436	1.739	50	20	IDGD	
Cc1nn(CC(F)(F)F)cc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	763116945	SDOIPRDBWVHTRC-UHFFFAOYSA-N	433.412	1.079	50	20	IDGD	
O=S(=O)(CBr)N1CCN(S(=O)(=O)c2ccc(Cl)cc2F)CC1	763206687	VAWVMRZLJUMLHE-UHFFFAOYSA-N	435.724	1.468	50	20	IDGD	
C[C@@H]1CCS(=O)(=O)CCN1C(=O)NNC(=O)c1ccc(Br)cc1Cl	763248935	HGQLOWGMCLFWEM-SECBINFHSA-N	438.731	1.966	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)c2ccccn2)sc2c1CCCCC2	763465188	UYAXJEXVOFHEDC-UHFFFAOYSA-N	430.486	1.988	50	20	IDGD	
CCc1nn(C)cc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccncc2)nc2ccccc12	763536654	AERJLJLZLBYRHJ-UHFFFAOYSA-N	443.467	1.992	50	20	IDGD	
COC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(OC)c(OC)c2)cc1F	763551897	SUGPYUZZBXUTOC-UHFFFAOYSA-N	434.380	1.421	50	20	IDGD	
COCCCOc1ccccc1NC(=O)C(=O)NNC(=O)[C@@H]1COc2ccccc2O1	763574328	YWXDYZORGOUQRH-SFHVURJKSA-N	429.429	1.028	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c(C(F)(F)F)c1	763577740	KTPZXKMTKGLULZ-HNNXBMFYSA-N	439.346	1.640	50	20	IDGD	
O=C(NNC(=O)c1sc2ccccc2c1Cl)C(=O)Nc1ccc(-n2cnnn2)cc1	763579312	VXUQZGLPAHRHRD-UHFFFAOYSA-N	441.860	1.930	50	20	IDGD	
COC(=O)CCc1ccc(NC(=O)C(=O)NNC(=O)COc2cc(C)ccc2C)cc1	763667811	DAKBEOBGNRWTMY-UHFFFAOYSA-N	427.457	1.574	50	20	IDGD	
CC(C)(C)n1nccc1NC(=O)C(=O)NNC(=O)COc1ccc(Br)cc1	763694127	FMZMHDBYPZEPHI-UHFFFAOYSA-N	438.282	1.566	50	20	IDGD	
COC(=O)c1cc(Cl)cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)c1	763867290	ZKFHPOUYXCZTPP-SNVBAGLBSA-N	437.811	1.819	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)cc1F	763870685	BGPINGPENYUAOV-LBPRGKRZSA-N	437.399	1.543	50	20	IDGD	
Cc1nn(-c2ccccc2)cc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccc(F)cc1	763873306	VFZAJSFVDLVILN-CQSZACIVSA-N	425.420	1.873	50	20	IDGD	
CC[C@@H](C)n1nc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(C(C)=O)cc2)cc1C	763879558	YHQFXRULMNGKJQ-IUODEOHRSA-N	429.477	1.919	50	20	IDGD	
Cn1cc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CC[C@H](C(C)(C)C)C3)ccc1=O	763939851	HLHCCLIKOQHOGH-ZDUSSCGKSA-N	430.530	1.998	50	20	IDGD	
O=C(NNC(=O)c1cc(Cl)ccc1O)C(=O)Nc1ccc(NC(=O)[C@H]2CCCO2)cc1	763978184	FPDBHQRDOLUXIS-MRXNPFEDSA-N	446.847	1.563	50	20	IDGD	
Cc1ccc(-n2nc(NC(=O)C(=O)NNC(=O)c3ccc4c(c3)OCCO4)cc2C)cc1	764003908	PWSSQHIJNPFVCU-UHFFFAOYSA-N	435.440	1.660	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)on1)C(=O)Nc1ccccc1O[C@H]1CCOC1	764004611	ZENUUMUGXLXCJY-HNNXBMFYSA-N	436.424	1.909	50	20	IDGD	
N#Cc1ccc(OC(F)F)c(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)c1	764007107	ZVVUHMBXYRBVAD-UHFFFAOYSA-N	432.339	1.331	50	20	IDGD	
COCCCS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)CC2CCCC2)cc1	764178778	JKHFQTGZKGITNZ-UHFFFAOYSA-N	425.507	1.163	50	20	IDGD	
Cc1cc(N2CCCC2)ccc1NC(=O)C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C	764204514	WVBRYUBAIILRSW-UHFFFAOYSA-N	447.536	1.986	50	20	IDGD	
C[S@](=O)Cc1cc(NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)ccc1Cl	764239245	ILBZFVASHZLRLQ-PMERELPUSA-N	446.916	1.959	50	20	IDGD	
COc1ccc(COCc2cccc(NC(=O)C(=O)NNC(=O)c3c[nH]nc3C)c2)cc1	764295469	MRJGWSKFJDRCEJ-UHFFFAOYSA-N	437.456	1.843	50	20	IDGD	
CCN(CC)CCn1ccc2cc(NC(=O)C(=O)NNC(=O)c3c[nH]nc3C)ccc21	764298166	PTASZTLDKQNETG-UHFFFAOYSA-N	425.493	1.414	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C(=O)Nc1cc(Br)c(=O)n(C)c1)c1ccccc1	764327894	HAEIJKJZSWDRHB-ZDUSSCGKSA-N	435.278	1.428	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)C(=O)Nc1cnn(-c2ccccc2Br)c1	764352964	FYGBAYJFFWUXGU-UHFFFAOYSA-N	443.261	1.358	50	20	IDGD	
Cc1ccc(-n2nc(-c3ccco3)cc2NC(=O)C(=O)NNC(=O)c2cnn(C)c2)cc1	764358931	PKUIZKMTDASNFA-UHFFFAOYSA-N	433.428	1.574	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2ccn(-c3ccccc3)n2)n[nH]1	764376555	FOJFXQLTCJLCIU-UHFFFAOYSA-N	445.439	1.671	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2cnc3c(c2)CCCC3)n[nH]1	764376779	HLIPWDZIYDRXND-UHFFFAOYSA-N	434.456	1.759	50	20	IDGD	
Cc1nnc(-c2cccc(NC(=O)C(=O)NNC(=O)c3ccc(Cl)cc3F)c2)n1C	764410531	PZAXXJOQWYGDSY-UHFFFAOYSA-N	430.827	1.983	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1cccc(C#N)c1)C(=O)NNC(=O)C12CC3CC(CC(C3)C1)C2	764533141	IAVUMQBCGSOZSG-KCXBLQSVSA-N	430.530	1.589	50	20	IDGD	
C=C1c2ccccc2C(=O)N1CC(=O)NNC(=O)c1cc(-c2ccc(OC)c(OC)c2)[nH]n1	765597641	VUDQUYTYWFTUQE-UHFFFAOYSA-N	447.451	1.982	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)CN1CCO[C@@H]([C@H](C)NC(=O)OC(C)(C)C)C1	766946066	XERJTOPNKQWIQJ-FUHWJXTLSA-N	434.537	1.299	50	20	IDGD	
C[C@@H]1Cc2ccccc2N1S(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)C(C)(C)O)c1	768255673	NERDNACJOQTQQS-GFCCVEGCSA-N	435.477	1.498	50	20	IDGD	
COC[C@@H](C)n1c(C)cc(/C=C(/C#N)C(=O)OCC(=O)N2CCN(C(C)=O)CC2)c1C	768747419	LECCGYWKTCENDX-IWEBCOIVSA-N	430.505	1.453	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)N[C@H]1CCOC2(CCOCC2)C1	769201338	UVVHUWBOAPFXLD-IBGZPJMESA-N	445.564	1.257	50	20	IDGD	
C=C(C)Cn1c(SCC(=O)N([C@H]2CCS(=O)(=O)C2)N(C)C)nnc1-c1ccco1	769619493	ZAFDFQZBCUNNTJ-AWEZNQCLSA-N	439.563	1.699	50	20	IDGD	
CCN1CCN(c2cccc(NC(=O)C(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)c2)CC1	770774731	SYLFRQKIUARUAM-UHFFFAOYSA-N	440.460	1.136	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)NCc2ncoc2C)cc1	770886453	NJRYCNZKNZVHSA-SXGWCWSVSA-N	434.456	1.954	50	20	IDGD	
Cc1cccc(N2C(=O)N[C@H](CCC(=O)O[C@@H](C)C(=O)NNC(=O)CC(C)C)C2=O)c1	772095373	CFTIIZAPDLJJKT-GOEBONIOSA-N	432.477	1.325	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCCNC(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)s1	772632057	VOXLZJWZMLPYFL-GFCCVEGCSA-N	444.510	1.272	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)c1cnn(-c2ccc(Cl)cc2)n1	772898462	RHNAZZHIYCPLGZ-UHFFFAOYSA-N	433.255	1.652	50	20	IDGD	
COc1cccc(C(=O)NCC(=O)NNC(=O)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)c1	773420239	OVTLRLZCDAOMKH-OAHLLOKOSA-N	434.493	1.220	50	20	IDGD	
CNS(=O)(=O)c1ccc2c(c1)N(C(=O)C(=O)NNc1cccc(C(F)(F)F)c1)CC2	773743294	BPQGGAWUKJYXOK-UHFFFAOYSA-N	442.419	1.646	50	20	IDGD	
O=C(NNc1cccc(C(F)(F)F)c1)C(=O)Nc1ccc(CN2C(=O)CNC2=O)cc1	773749619	BINAAYBXOOUXKH-UHFFFAOYSA-N	435.362	1.839	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(-n3nnnc3C(C)C)c(C)c2)cc1F	773887579	AZQOCRUUIYSMOP-UHFFFAOYSA-N	439.451	1.941	50	20	IDGD	
COCC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)cc1	774007536	BKXGSSAMRRHYLD-LBPRGKRZSA-N	448.863	1.478	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)Nc1ccnn1[C@H]1CCS(=O)(=O)C1	776053570	DCZQUXXRSDNPDJ-AAEUAGOBSA-N	425.442	1.002	50	20	IDGD	
O=C(CSc1ccc(Cl)cc1)NNC(=O)N[C@@H]1CCO[C@@]2(CCS(=O)(=O)C2)C1	776075726	DIHNKNGNKMBKSB-DYVFJYSZSA-N	447.966	1.499	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)[C@H](c2cnn(C)c2)N(C)C(=O)OC(C)(C)C)cc1	776316813	RLRWSIUWMFPOHW-SFHVURJKSA-N	431.493	1.863	50	20	IDGD	
CN1CCN(C(=O)c2ccc(CNC(=O)NNc3cccc(S(C)(=O)=O)c3)cc2)CC1	776610469	XPWUELSJHGSRNS-UHFFFAOYSA-N	445.545	1.304	50	20	IDGD	
Cc1ccc(C)n1-c1ccc(C(=O)NNC(=O)NC[C@H]2COC3(CCOCC3)O2)cc1	777761768	VZTYNFKAEAUQSS-IBGZPJMESA-N	428.489	1.960	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)CSc1nnc(CNC(=O)OC(C)(C)C)o1	780343041	KKLWHIVRUSAFEC-UHFFFAOYSA-N	435.506	1.885	50	20	IDGD	
CC(F)(F)c1cccc(NC(=O)C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c1	782118191	WDYLNKHCNMCMOB-UHFFFAOYSA-N	425.413	1.602	50	20	IDGD	
CCOC(=O)c1ccsc1NC(=O)C(=O)NNC(=O)Cc1nc2ccccc2n1C	782885917	MHLFMGIZRKGYKV-UHFFFAOYSA-N	429.458	1.140	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccccc2-n2cccn2)nc1	783265874	ZCVTWBTVJZJNMI-UHFFFAOYSA-N	443.489	1.036	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1ccccc1Cc1ccccc1	784003482	GYVSWWWIROSATM-UHFFFAOYSA-N	436.493	1.855	50	20	IDGD	
CCCCN1CCc2ccc(NC(=O)C(=O)NNC(=O)CNC(=O)c3cccs3)cc21	784003581	JRZSGYYYUHVRCF-UHFFFAOYSA-N	443.529	1.427	50	20	IDGD	
O=C1C[C@@H](Cc2ccc(NC(=O)C(=O)NNc3ccnc(Br)c3)cc2)C(=O)N1	784836818	BXHZCPJOLNWZLX-LLVKDONJSA-N	446.261	1.131	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNc2cc(F)c(F)cc2F)cccc1S(=O)(=O)NC1CC1	784892833	BBIDDXBSPSIHFI-UHFFFAOYSA-N	442.419	1.935	50	20	IDGD	
CCNC(=O)N(C)NC(=O)C(=O)Nc1ccc(NC(=O)[C@@H]2CCCO2)cc1C(F)(F)F	784916908	DAXGDPPANOEZLN-ZDUSSCGKSA-N	445.398	1.454	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)C2(Cc3ccccc3F)CC2)ccc1Cl	785442886	DSTFVRVYCMJDDJ-UHFFFAOYSA-N	425.869	1.910	50	20	IDGD	
O=C(NNC(=O)c1cc(Cl)cc(F)c1Br)N[C@H]1CCS(=O)(=O)C1	785951413	VGEXZAATFZAXGZ-ZETCQYMHSA-N	428.667	1.373	50	20	IDGD	
Cc1c(NC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cccc1N1CCNC1=O	786315064	TVBZARHDNJJIQV-UHFFFAOYSA-N	435.444	1.882	50	20	IDGD	
O=C(CN1C(=O)COc2ccc([N+](=O)[O-])cc21)NNc1nnc(-c2ccccn2)s1	788563561	KRYSFQQNVWGUGV-UHFFFAOYSA-N	427.402	1.377	50	20	IDGD	
O=C(NC[C@@H](Cc1cccc(F)c1)C(=O)N1CCOCC1)NNc1ccc(Cl)nn1	789310520	ONBQBHBGFMVNIH-CQSZACIVSA-N	436.875	1.613	50	20	IDGD	
Cc1nc(Cl)ccc1NC(=O)C(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12	789731331	CBMPBUBWEIHCQO-UHFFFAOYSA-N	442.863	1.734	50	20	IDGD	
CCc1c(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cnn1C1CCCC1	789736111	WMQQHMOPSKWLBR-UHFFFAOYSA-N	439.925	1.936	50	20	IDGD	
Cn1ccnc1[C@@H]1CN(C(=O)OC(C)(C)C)CCN1CC(=O)NNC(=O)c1ccccc1	792913738	RYKXXHUNAHLJFF-KRWDZBQOSA-N	442.520	1.475	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N2C[C@@H](C)O[C@]3(CCOC3)C2)cc1Br	792932117	LWDACGFSGMOADH-PIGZYNQJSA-N	428.283	1.692	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=S)NCCCCC(F)(F)F)ccc1Cl	794966507	PTLGDGDYPHVUPA-UHFFFAOYSA-N	432.877	1.829	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)c2sccc2S(N)(=O)=O)cc1OC	800571970	RUAYCVYJTLBLEC-UHFFFAOYSA-N	427.504	1.658	50	20	IDGD	
C[C@](O)(CCc1ccccc1)C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	801162904	DQBCTLNOUFVYID-NRFANRHFSA-N	433.530	1.534	50	20	IDGD	
O=C(COC(=O)c1nn(-c2ccc(F)cc2)cc1O)NNC(=O)c1cccc(Cl)c1	801324629	BWVZBNSQZUSJTQ-UHFFFAOYSA-N	432.795	1.988	50	20	IDGD	
O=C(CCCNS(=O)(=O)c1cccc(C(F)(F)F)c1)NNC(=O)N=c1cc[nH]cc1	802035509	FFCJLQMPTHJURD-UHFFFAOYSA-N	445.423	1.434	50	20	IDGD	
CC(C)[C@@H](C(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)N1C[C@@H](C)O[C@H](C)C1	802067752	ZFHUGSLQAXCNGU-CPUCHLNUSA-N	426.539	1.377	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)CN2C(=O)[C@H]3CCCC[C@H]3C2=O)c(OC)cc1Cl	802084772	JIOSCHPJYKVKDR-PHIMTYICSA-N	438.868	1.685	50	20	IDGD	
COCCNC(=O)CSc1ccccc1C(=O)NNC(=O)Nc1ccc2c(c1)OCO2	802097913	VLCLGTQSMHLYEC-UHFFFAOYSA-N	446.485	1.737	50	20	IDGD	
COc1ccc(C2=NO[C@H](CNC(=O)NNC(=O)COc3ccccc3C#N)C2)cc1C	802354204	LUEPEHUAFRMFAQ-KRWDZBQOSA-N	437.456	1.778	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)N[C@@H]2CCN(C(=O)Nc3ccccc3)C2)cc1C	802501279	XJRMFXWNLHXOJT-GOSISDBHSA-N	438.488	1.879	50	20	IDGD	
CCOC(=O)C(C)(C)CC(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	805191671	NWOXMHQCLWQMPY-UHFFFAOYSA-N	438.956	1.584	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCOCC2)cc1NC(=O)NNc1cccc(F)n1	806130717	BFYROMBLZJIRQU-UHFFFAOYSA-N	425.442	1.399	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)Nc1ccc(F)c(S(=O)(=O)N(C)C)c1	806544245	ZOLNNPOKDQOBTB-UHFFFAOYSA-N	440.453	1.316	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2cc(-c3ccsc3)nn2C)cc1	813033043	BHQBQOOGAMTJPC-UHFFFAOYSA-N	448.530	1.481	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)cnn1C1CCCC1	813033815	MUBHQGYXTIMESK-UHFFFAOYSA-N	434.522	1.639	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2ccc3c(c2)NC(=O)CNC3=O)ccc1OC(C)C	814249502	LDIQGKCJCGCMGQ-UHFFFAOYSA-N	426.429	1.239	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccc(Br)cc2)cn2ccnc12	815565208	GLBDGHTWJYQQQX-UHFFFAOYSA-N	446.261	1.570	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)C(=O)Nc1nc(CC(F)(F)F)cs1	815569038	DROPZXPCOGHZIA-UHFFFAOYSA-N	425.392	1.989	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)COCc2ccccc2)cc1)[C@@H]1C[C@@H]1C	815570059	PLSROJDWJOUGHV-MGPUTAFESA-N	438.484	1.751	50	20	IDGD	
O=C(COC(=O)CSc1ccccc1[N+](=O)[O-])NNC(=O)[C@H]1COc2ccccc2O1	819006624	FKSUSKOAKXDYJB-OAHLLOKOSA-N	447.425	1.218	50	20	IDGD	
Cc1c(C(=O)NNC(=O)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)cnn1C1CCOCC1	819658746	OWWDWEDSWFMTSD-OAHLLOKOSA-N	435.525	1.951	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCCc1cn2c(n1)CCCC2	914540583	GBRJMSAAWKWXOB-UHFFFAOYSA-N	433.538	1.008	50	20	IDGD	
COc1ccnc(NNC(=O)c2cc(S(=O)(=O)N3CCCCCC3)ccc2OC)n1	914762084	PBAZPZVMOQGYNO-UHFFFAOYSA-N	435.506	1.815	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)CCc1c(C)nc2c(c(OC)nn2C)c1C	915064856	VUQRNSQCQJUSNM-UHFFFAOYSA-N	440.504	1.794	50	20	IDGD	
CS(=O)(=O)N1CCC(NC(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)CC1	916237670	AJALGCNOUDAYDO-UHFFFAOYSA-N	444.457	1.030	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NCc2ccc(N3CCCCCC3)nc2)c2ccccc2c1=O	916393348	YZMDSJBFFZDALS-UHFFFAOYSA-N	449.515	1.853	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)NCc2ccc(CN3CCCC3=O)cc2)cc1C	918124946	JZURLLZKUXMWAU-UHFFFAOYSA-N	437.500	1.895	50	20	IDGD	
CCS(=O)(=O)N(C)CCCNC(=O)NNC(=O)c1ccc(F)cc1Br	918208901	JOHVQMAMLODYIO-UHFFFAOYSA-N	439.307	1.204	50	20	IDGD	
O=C(COC(=O)[C@H]1CCCN(C(=O)N2CCCC2)C1)NNC(=O)c1cccc(Cl)c1	919129132	KKWAGYWJTXLPTE-HNNXBMFYSA-N	436.896	1.572	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H](C)Cc2cccc(O)c2)c1	919785027	XXGGIFAPTZXGGI-OAHLLOKOSA-N	448.545	1.998	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc2c(c(C(=O)O)c1)OCCO2)c1ccc2ccccc2c1	919958361	CTPVOMRLSSZFQV-UHFFFAOYSA-N	428.422	1.933	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)NC[C@H]1CCN(c2ccc(F)cc2)C1	920048822	POJBPCUFKMPNFY-CQSZACIVSA-N	431.424	1.970	50	20	IDGD	
O=C(NNC(=O)c1ccc(-c2ccccn2)nc1O)c1csc(N2CCOCC2)n1	920275406	WRFAMASIGCJXAU-UHFFFAOYSA-N	426.458	1.217	50	20	IDGD	
CSC[C@H](C(=O)NNC(=O)NCCc1cccs1)N1C(=O)[C@@H]2CCCC[C@H]2C1=O	920860467	FHCUWQVUGBGXAJ-RBSFLKMASA-N	438.575	1.528	50	20	IDGD	
O=C(NCCNS(=O)(=O)c1cccc([N+](=O)[O-])c1)NNC(=O)c1cccc(Cl)c1	921248358	WKVPTFPPUMICRT-UHFFFAOYSA-N	441.853	1.171	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)N[C@@H]2CCOC3(CCOCC3)C2)c2ccccc2c1=O	1118105300	UKEITSGXSTXMEH-OAHLLOKOSA-N	443.504	1.650	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)c2c(C)nn(C)c2n1	1318614252	ZTNXSBASRWAPMX-UHFFFAOYSA-N	430.509	1.993	50	20	IDGD	
CCn1nc(C)c(S(=O)(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)c1C	1318675610	VSEVBFDBCRILCP-UHFFFAOYSA-N	429.543	1.476	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCn2c(nnc2C2CCCC2)C1	1319584956	YEENXJBUSMANOM-UHFFFAOYSA-N	432.912	1.875	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)[C@H]1CC(=O)N(c2ccc(C#N)cc2)C1	1324347898	GBRANCANLUUQFC-HNNXBMFYSA-N	427.486	1.305	50	20	IDGD	
O=C(Cn1cc(C2CC2)nn1)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1	1332944742	KETBTDDOMAMODI-QFIPXVFZSA-N	430.512	1.930	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccccc1-n1nccn1)C2)[C@H](F)Cl	1778027950	FNYJKZAITPGLKP-FUHIMQAGSA-N	435.887	1.929	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(Cl)Cl)C2)c1cnc2ncccn12	1778654256	PZBMVSYNLOJRLM-FZKQIMNGSA-N	426.304	1.661	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc3cn[nH]c3cn2)C1	1779194643	IFTFZBRXLLFNIW-WIBUTAKZSA-N	435.912	1.339	50	20	IDGD	
COc1ccnc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)c1OC	1780452998	SNVJIOKSLILFFL-WMLDXEAASA-N	446.273	1.233	50	20	IDGD	
Cc1nc(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@](C)(Cl)CCl)C2)no1	1780710010	BJMPIERHCUNGEN-FSPWUOQZSA-N	433.336	1.671	50	20	IDGD	
CCN1CCC(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](F)Br)C2)CC1	1780778546	LTNVGXOTLRKSAB-GPMSIDNRSA-N	448.377	1.923	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3c(O)cc(O)cc3O)C2)C1	1781810072	XPUHEEIHYOVOQB-ADLMAVQZSA-N	443.294	1.278	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)c1ccco1)C2	1781995846	XITPSZHXHWFKOR-KDQZPGIASA-N	429.311	1.610	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1cnccn1)C2	1781997340	RYAHMIUAQLPFKU-DDUZABMNSA-N	425.327	1.316	50	20	IDGD	
N#Cc1cc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)cc(C(F)(F)F)c1	1782031023	QOEWCNAVVDOHRP-QAPCUYQASA-N	445.825	1.620	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)Cc3cccnc3Cl)CCO2)C1	1783530523	ZZWDVGAPKWTOBU-YVEFUNNKSA-N	430.730	1.891	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cnc(-c4ccccn4)nc3)CCO2)C1	1783873173	LWSFRTUBHZNKHE-HRAATJIYSA-N	445.907	1.236	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)Cc3ccc(OC)c(F)c3)CCO2)C1	1783879869	YYRMWSGYKMYJPK-QRWLVFNGSA-N	428.888	1.461	50	20	IDGD	
C[C@H](NC(=O)c1ccc(F)cc1)C(=O)N1CCO[C@@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783948264	GXFIARDPJKUKMZ-HXPMCKFVSA-N	446.306	1.578	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3cncnc3)C[C@@H]21	1783965268	GDRAGJIQZVFRIQ-IWCQGFGOSA-N	439.354	1.420	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)CCNC(=O)OC(C)(C)C)C2)C1	1785339099	YWTJVOUXPDDYHA-UGSOOPFHSA-N	448.358	1.515	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3scnc3C3CC3)[C@H]2C1	1785789122	OGBSMLWHAOYHAN-XQLPTFJDSA-N	427.954	1.868	50	20	IDGD	
CCOC(=O)/C=C/C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](Br)CC)C[C@@H]21	1786375888	KNPOEWAVWFXMGZ-JDENUTSSSA-N	431.327	1.259	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)c1cnn2ncccc12	1787376436	AXPADSBHKKSIFS-NOLJZWGESA-N	436.310	1.108	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(C#N)cc(OC)c3)[C@H]2C1	1789258963	BYQWBABBHANTOH-QZHFEQFPSA-N	435.908	1.414	50	20	IDGD	
O=C(NC1(c2ccc(NC(=O)c3cc4n(n3)CCC4)cc2)CCC1)c1cccc(B(O)O)c1	1789353096	QKHDVZUEIDFBPW-UHFFFAOYSA-N	444.300	1.571	50	20	IDGD	
COC[C@H](C)C(=O)NC1(c2ccc(NC(=O)c3cnccc3C(=O)NN)cc2)CCC1	1789519842	LMDMSSHXWOXIQB-AWEZNQCLSA-N	425.489	1.715	50	20	IDGD	
CCc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]3C2)nn1C	1789924633	QBDANENCEAYEQX-LVGORTOPSA-N	431.306	1.266	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)COc3ccccc3F)[C@H]2C1	1790968091	MRVRXKWXEUFJRD-WSMBLCCSSA-N	443.313	1.968	50	20	IDGD	
COc1ccc(/C=C/C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](O)CCl)C[C@@H]32)c(F)c1	1791129002	NFNCZWBZLFWFRB-UPFQJNFKSA-N	440.899	1.427	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccc(Cl)c(F)c1	1792757773	MDKAIXMKZKOTSY-ZFHGCVPZSA-N	433.307	1.865	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc3ccc(Cl)cc3c1)C2)[C@H](O)CCl	1792980406	ODYQFENYAQHUNK-LTCOOKNTSA-N	438.311	1.691	50	20	IDGD	
Cc1c[nH]c(C)c1CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)Br)C2	1793103036	YZHZCWAWDKGIIM-FRQROOTJSA-N	426.355	1.937	50	20	IDGD	
C[C@@H]1[C@H](C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](O)CCl)CCN1C(=O)OC(C)(C)C	1793117420	KACPLADROIHRRB-DBHDPKECSA-N	443.972	1.870	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1CCOC1=O	1793352346	RNMNAVPNBXUXGN-FZBFXSHXSA-N	444.438	1.962	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(C)(F)F)C2	1793880696	DEOYRVKGBYMSPU-RNJOBUHISA-N	439.887	1.363	50	20	IDGD	
Cc1cc(F)c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)cc1F	1796190484	CMJJRVMAFQMSJS-BJWYYQGGSA-N	428.244	1.519	50	20	IDGD	
C=C(Oc1ccccc1O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CO[Si](C)(C)C	1797955849	JHVLHSVILHANJD-CWPLJXCYSA-N	434.565	1.726	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(Cl)nn1	1798034340	POCIDYRCYAHEOM-NJBDSQKTSA-N	431.718	1.364	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)c1c2ccccc2n2ccsc12	1798437948	JFVKLSAXCQENKS-VLWCASSMSA-N	447.944	1.957	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1n[nH]c3c(F)cccc13)C2)[C@@H](F)Br	1799349017	FXPHWAXZGXKFEK-KTBFAXTASA-N	443.248	1.596	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](NC(C)=O)c1ccc(F)cc1	1799822826	DGSIDIBLQKXQKN-RHQZKXFESA-N	439.915	1.895	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1n[nH]c2cccc(F)c12	1800076528	CFPXBJZQCJRPLC-IVWMJMPLSA-N	434.544	1.757	50	20	IDGD	
Cc1cccn2ncc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@H](F)Br)C4)c12	1800106611	RLMPQSKRUNOBAB-LMWOUKEDSA-N	439.285	1.536	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc3c1cnn3C)C2	1800641314	YKTNUGKMDQIWKC-VLWCASSMSA-N	449.349	1.950	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Br)C2	1800644143	KBAGCEZIDCMTSH-LDMBFOFVSA-N	426.149	1.533	50	20	IDGD	
CC(C)(C)OC(=O)N1CCCC[C@@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2	1800781735	DDBGXLYLOABNIU-JKJDWNRSSA-N	447.935	1.900	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(C)(C)Oc1ccc(C)cn1)C2	1800977677	VESWNFYMCPLHNK-DFGXFYAUSA-N	439.940	1.391	50	20	IDGD	
CC(=O)Nc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C(Cl)Cl)ccc1C	1801017192	AZMOHBFFPFBCKI-MIFYACCESA-N	428.316	1.960	50	20	IDGD	
Cc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)Br)C3)cc(C)c1O	1801702299	AXWFFQLRUOMTDL-HNKHHVNMSA-N	425.323	1.996	50	20	IDGD	
CC[C@H](NC(C)=O)C(=O)NC[C@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1	1802541043	IQKDSNQHSSNKDD-RYRKJORJSA-N	439.354	1.787	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc3ncnn3c2)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803142785	JDXLCVRAEGAYNU-QILLFSRXSA-N	428.880	1.044	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2cc(C(=O)O)ncn2)[C@@H]1c1cccnc1	1804969764	ZKBURYGBZZMEOE-ZQIUZPCESA-N	431.880	1.907	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC2(CCN(C(=O)[C@@H](C)n3cnnn3)CC2)C1	1805388880	DGAFWEPWIYGHGO-ZIAGYGMSSA-N	427.347	1.496	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)c(C)o1	1807365046	WMEVQANMRGFLHS-KNQAVFIVSA-N	447.300	1.605	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)C2CC3(CCC3)C2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1	1807373294	APVBGBWEFLIGJG-UGKGYDQZSA-N	447.344	1.661	50	20	IDGD	
C=CC[C@H](C(=C)C)C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1807376238	TVBPIYAMXLBKJN-WWNPGLIZSA-N	447.344	1.849	50	20	IDGD	
CN1C(=O)CC[C@H]1C(=O)N1CC[C@H](CNC(=O)[C@@](C)(Cl)CCl)[C@@H]1c1cccnc1	1808306119	ZBCMFELKYCWCJA-RPWFAHAXSA-N	441.359	1.945	50	20	IDGD	
CC(C)CNC(=O)C(=O)NC[C@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1	1808444381	RYICCTXIXGZEKB-NVXWUHKLSA-N	439.354	1.645	50	20	IDGD	
Cc1cc(C(=O)NC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)c[nH]1	1808778278	LJWUPRBKAOWBND-UWJYYQICSA-N	426.521	1.411	50	20	IDGD	
Cn1ncc2c(C(=O)NC[C@@H]3CCN(C(=O)[C@H](O)CCl)[C@H]3c3cccnc3)cccc21	1809428943	VPXBPFUMDFEKSJ-BEVDRBHNSA-N	441.919	1.888	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC2(CCCN(C(=O)C[C@@H](NC)C(=O)O)C2)CC1	1809839110	MNTUVQUXUKBRLB-ZIAGYGMSSA-N	432.359	1.454	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)C3(c4ccccc4)CC3)CC2)C1	1809978013	SSFDPHUMWKFKNG-UHFFFAOYSA-N	446.356	1.943	50	20	IDGD	
C#CC(=O)NC[C@H]1CCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)[C@@H]1c1cccnc1	1812525348	SFDLCZREQKZKBM-SOLBZPMBSA-N	434.924	1.853	50	20	IDGD	
N[C@@H](Cc1cscn1)C(=O)N1CC[C@@H](CNC(=O)C(Cl)Cl)[C@H]1c1cccnc1	1813079004	CNUKPVBIOLIBHC-AEGPPILISA-N	442.372	1.918	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccnc(F)c2)n[nH]1	1815424998	XCUKFWODINIQMG-OAHLLOKOSA-N	431.472	1.623	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H]2C[C@@H]2F)n[nH]1	1815513647	WECNMUMNUGJOBS-NRGKRRITSA-N	429.456	1.894	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)CN3CCN(C)CC3)sc2C1	1818804754	BMCYBJNPEWRQBC-NWDGAFQWSA-N	444.399	1.086	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H]3CCC=CO3)sc2C1	1819733267	RAFKJGNGXMKTHW-IAQYHMDHSA-N	442.501	1.060	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1nccs1)CC2	1819794874	FXLGURMUVPNVLI-VIFPVBQESA-N	443.514	1.138	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2c[nH]c(=O)cn2)n[nH]1	1820248021	GKAWUWQVZBKNBV-ZWNOBZJWSA-N	437.298	1.972	50	20	IDGD	
CN1CCC[C@H](C(=O)Nc2cc([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)C1	1820727926	GSTSILRXSRULQT-DOTOQJQBSA-N	433.557	1.117	50	20	IDGD	
Cn1ccc2c(O)ncc(C(=O)Nc3nc4c(s3)C[C@@H](NC(=O)[C@@H](O)CCl)CC4)c21	1821175564	IQVZTQPSOOCCFK-ZANVPECISA-N	449.920	1.561	50	20	IDGD	
C[C@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](F)Br)[nH]n1)n1cnnn1	1822858836	AFDQWJAJXJEPRA-UBHAPETDSA-N	429.254	1.340	50	20	IDGD	
O=C(NCC(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@H](O)CCl)CC1)c1cccs1	1825235080	XAEQIBQRDLDSJE-JKSUJKDBSA-N	441.981	1.697	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@H](C(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@@H](O)CCl)CC3)C1	1825973639	AHSTTYDDYWTOAY-SFTQSGBHSA-N	443.953	1.634	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](C)N1C[C@@H]3C[C@H]3C1)CC2	1826000273	QHADCDKHQQGOII-YHQUGGNUSA-N	426.970	1.649	50	20	IDGD	
CNc1ccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)cc1	1826849832	ADJMBMGVSMVBIG-HSZRJFAPSA-N	449.360	1.955	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(C(N)=O)cc3)sc2C1	1827506887	YDTMGGVZOIYZLR-OLZOCXBDSA-N	436.921	1.722	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2nc[nH]c2[N+](=O)[O-])CC1	1827651429	XBYQNMNUXZITCH-ZIAGYGMSSA-N	427.889	1.805	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccnn3CCOC)C2)C1	1831647574	XTWZNHLFZAMJKN-OXQOHEQNSA-N	442.944	1.007	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc([N+](=O)[O-])[nH]3)C2)C1	1831653705	CWYVAORDUMWZSM-ACJLOTCBSA-N	428.873	1.400	50	20	IDGD	
Cc1cc(C(=O)N2CCC([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)ccn1	1831873258	FWIXHCAHKLOURH-HXUWFJFHSA-N	429.565	1.996	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3ccc(F)nc3F)CC2)CC1	1833017321	LTEWPYDMMTWTOT-MRXNPFEDSA-N	444.910	1.799	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cc4ccoc4cn3)CC2)CC1)[C@H](O)CCl	1833312207	LEGMFLYZZBRZKS-GOSISDBHSA-N	434.924	1.613	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)c1ccc2nccn2c1	1835413164	IFUPZOWYPVUMLI-GOSISDBHSA-N	433.940	1.119	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)c1c[nH]c2cnccc12	1835633539	QRVVVTKDDOBAJI-LJQANCHMSA-N	433.940	1.348	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3cscn3)CCO2)C1	1836044389	WTJIAALDXBTDOT-SJORKVTESA-N	436.361	1.378	50	20	IDGD	
O=C(Cc1cccs1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1836091609	RHTOPSPHWRQJDA-GDBMZVCRSA-N	435.315	1.438	50	20	IDGD	
Cc1cc(C)nc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)c1	1836312151	ZXJXWZUKZGRTJJ-MAUKXSAKSA-N	444.301	1.459	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC(OC2CCN(C(=O)c3cnnn3C)CC2)CC1	1836670212	LAOYINOBIRSRTF-CYBMUJFWSA-N	442.358	1.458	50	20	IDGD	
COc1ncc(C(=O)N2CCC(OC3CCN(C(=O)[C@H](O)CCl)CC3)CC2)cc1C	1836716768	PONLUSUNZRFWRI-GOSISDBHSA-N	439.940	1.611	50	20	IDGD	
Cc1cc(C(=O)N2CCC(OC3CCN(C(=O)[C@H](O)CCl)CC3)CC2)c(C)n1C	1836718208	KNPLLIYVDGPPIJ-LJQANCHMSA-N	425.957	1.854	50	20	IDGD	
C#CCO[C@H](C)C(=O)N1CCC(OC2CCN(C(=O)[C@H](C)Br)CC2)CC1	1836861503	BQZQBKCBBAECLY-LSDHHAIUSA-N	429.355	1.807	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3ccc(O)nn3)CC2)CC1	1837368567	FSYBOHUBMCMQIS-OAHLLOKOSA-N	426.901	1.048	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3[nH]nc4ncccc34)CC2)CC1	1838049590	BXISURWCVWXFAC-QGZVFWFLSA-N	449.939	1.824	50	20	IDGD	
O=C(O)c1cnncc1C(=O)N1CCC(OC2CCN(C(=O)[C@@H](F)Cl)CC2)CC1	1838082319	HACQILUYYAYTPR-OAHLLOKOSA-N	428.848	1.321	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](C)Cn3cncn3)CC2)CC1	1838421039	MLEUVKRZMNMGPR-MAUKXSAKSA-N	425.961	1.930	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)nn1C(F)F	1838709298	GZIWMAMTVQGCNJ-MRXNPFEDSA-N	441.262	1.460	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(O)ccc3F)C2)C1	1839154766	XKPMNTOSFJKORZ-MOPGFXCFSA-N	449.306	1.838	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(CC#N)cc3)CCO2)C1	1839364317	YGYCKQDDBDGXQD-RXVVDRJESA-N	435.908	1.076	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc4ccoc34)CCO2)C1	1839588163	POGXJLJDGRNZBC-UTKZUKDTSA-N	436.892	1.757	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C=C/c3ccoc3)C2)C1	1839962347	BMPLTEKKHAHZKO-LUODXLFYSA-N	441.322	1.923	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H]3CCc4nc[nH]c4C3)CCO2)C1	1840359963	UQWDPTXFWMPOQR-YCRPNKLZSA-N	438.956	1.236	50	20	IDGD	
O=C1CCc2ccc(C(=O)N3CCCC34CN(C(=O)[C@H](F)Br)C4)nc2N1	1843233061	YDCCWWVUNDBSHB-ZDUSSCGKSA-N	425.258	1.474	50	20	IDGD	
COc1ccc([N+](=O)[O-])c(C(=O)N2CCCC23CN(C(=O)[C@H](C)CBr)C3)n1	1843585308	XGVXVCQMEGOHDT-LLVKDONJSA-N	441.282	1.846	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)CCCc1ccccc1F)C2	1844263300	ONOCUXHNVGXRGO-UHFFFAOYSA-N	439.491	1.664	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)[C@H](C)n1ccnn1)C2	1844693230	KXWOAQSBRQRYAP-ZDUSSCGKSA-N	442.432	1.190	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC12CN(C(=O)c1cncc(S(C)(=O)=O)c1)C2	1846175618	JMSBJUQJCOTBRV-NSHDSACASA-N	430.324	1.086	50	20	IDGD	
CC(C)(C)OC(=O)N1CCO[C@@H](C(=O)N2CCCC23CN(C(=O)C(Cl)Cl)C3)C1	1847152704	QSZRUONBMIPDMR-GFCCVEGCSA-N	436.336	1.629	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@@]2(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](O)CCl)C1	1847563045	LVXFRUANDKJSBM-LNXOKNDVSA-N	441.956	1.435	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@](C)(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](O)CCl)C1	1847568493	XSFAVAMSTGVZDJ-CMBDLQSPSA-N	443.972	1.825	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](C)NS(=O)(=O)c1ccc(C)cc1	1847583505	ZWTAHISMIJNICW-RANZSIQMSA-N	441.981	1.881	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cnnc(Cl)c1	1848272304	WJAZPPLYFDCCGN-VXWPIWARSA-N	429.868	1.079	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)C(=O)N(C[C@H]1CCCO1)C2=O)c1ccc([N+](=O)[O-])cc1	9028903	BTZQHVPPISQIAG-OAHLLOKOSA-N	438.396	1.445	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)NCc1ccc(S(=O)(=O)N2CCOCC2)cc1	9797716	JMFIFKSOVMTOGE-UHFFFAOYSA-N	432.502	1.160	50	20	IDGD	
COc1cc(C(=O)NNC(=S)Nc2cccc(Cl)c2)cc(OC)c1OCC(N)=O	15756290	JHYIPNUKHAPLNY-UHFFFAOYSA-N	438.893	1.853	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)CCNC(=O)c2ccc(C(C)(C)C)cc2)c2ccccc2c1=O	15940235	RPZXROHIPNOLTM-UHFFFAOYSA-N	449.511	1.812	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)[C@@H]2CC(=O)N(c3ccc4c(c3)OCCO4)C2)c1	16005419	PDAQOFWHZSUNLG-OAHLLOKOSA-N	425.441	1.346	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)CCNC(=O)C12CC3CC(CC(C3)C1)C2	23148707	DPEKAOMSMWEKDQ-UHFFFAOYSA-N	429.517	1.944	50	20	IDGD	
NS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2ccc(COc3ccccc3)o2)cc1	29315365	RAADAQWYBJAIJO-UHFFFAOYSA-N	430.442	1.973	50	20	IDGD	
CN(C)N(C(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12)[C@@H]1CCS(=O)(=O)C1	104950226	RSKAHLCTLCILTM-QGZVFWFLSA-N	440.525	1.551	50	20	IDGD	
Cc1cc(C(=O)N2CCC[C@H]2C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)ccc1[N+](=O)[O-]	110314379	JKNOVFKSALNLNS-KRWDZBQOSA-N	441.400	1.877	50	20	IDGD	
CC[C@@H](C)NC(=O)c1cccc(CNC(=O)NNC(=O)CNC(=O)c2cccs2)c1	725872675	GKOXUIILAXNQIB-CYBMUJFWSA-N	431.518	1.537	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cc(C(=O)NNC(=O)c2cnc[nH]2)ccc1Cl	725879195	BICCEJQZPNKZNZ-UHFFFAOYSA-N	449.876	1.947	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)Cc3ccc4c(c3)OCCO4)cc2)CC1	728212929	METKMBGGHQRZLR-UHFFFAOYSA-N	446.529	1.080	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)c2cccc(C#N)c2)cc1S(=O)(=O)N1CCOCC1	728825300	TTZUTOKIVCGUBP-UHFFFAOYSA-N	442.497	1.216	50	20	IDGD	
O=C(NNC(=O)c1ccc(Br)cc1Cl)c1cnc2nc(O)nc(O)c2c1	728869868	GXYHIANMTLAVQL-UHFFFAOYSA-N	438.625	1.927	50	20	IDGD	
CCN(CC)C(=O)c1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1	729298150	UMHWEYPFOXPRGZ-UHFFFAOYSA-N	446.529	1.494	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)c1ccc(S(=O)(=O)N2CCOCC2)cc1	729448583	WHFLEJONVOOVRK-UHFFFAOYSA-N	442.497	1.123	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Cc2c(C)nc3[nH]n(C)c(=O)c3c2C)ccc1OC(C)C	730104823	ZUNYIVVFLCTHHR-UHFFFAOYSA-N	441.488	1.678	50	20	IDGD	
O=C(CSc1nnc(O)nc1O)NN=Cc1cn(-c2ccccc2)nc1-c1cccnc1	730558257	GMHRGRLYPMNLRH-UHFFFAOYSA-N	448.468	1.773	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)N2CCC(CS(N)(=O)=O)CC2)c(C)n1C[C@H]1CCCO1	732071483	HFWRYWIUZVEFIK-DEWISIQVSA-N	434.562	1.718	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cc(S(=O)(=O)N(C)C)c[nH]2)cc1Br	732175315	KGZZRUKBJCUTOX-UHFFFAOYSA-N	445.295	1.111	50	20	IDGD	
Nc1c(Br)cccc1C(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	732324703	BLTVXMANVXXZBE-UHFFFAOYSA-N	437.206	1.558	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)N[C@H](Cc1ccccc1)CN1CCOCC1	732476748	VGOZTEQEYCJZQW-LJQANCHMSA-N	436.516	1.530	50	20	IDGD	
CCOCCCn1c(NNC(=O)c2ccc3c(c2)C(=O)N(C)C3=O)nc2ccccc2c1=O	733267927	CWYBRVOHUDCOET-UHFFFAOYSA-N	449.467	1.806	50	20	IDGD	
COc1ccc2[nH]cc(CCNC(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)c2c1	733650660	VCSMPQNIUYRNEV-UHFFFAOYSA-N	434.456	1.610	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)N[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	734685591	UOPFPEBVWQEYNP-IBGZPJMESA-N	440.500	1.768	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCC(C)(C)c2cccc(F)c2)c1	735761192	KEYCVBOSNBNCNF-UHFFFAOYSA-N	436.509	1.998	50	20	IDGD	
CCc1ccc([C@H]2COCCN2C(=O)NNC(=O)c2csc(N3CCOCC3)n2)o1	736370623	NJIYNNZBVLNFIM-OAHLLOKOSA-N	435.506	1.563	50	20	IDGD	
O=C(CCn1cnc2ccc(Br)cc2c1=O)NNc1ncnc2[nH]cnc12	740746412	AUTHQQXYSIMAGX-UHFFFAOYSA-N	429.238	1.359	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)F)cc1)c1ccc(-n2cncn2)c([N+](=O)[O-])c1	740924718	BETQOUGWYPXAIG-UHFFFAOYSA-N	438.372	1.929	50	20	IDGD	
Cn1c(=O)nc(O)c2nc(CCC(=O)NNc3c(F)cc(F)cc3Br)[nH]c21	742108488	UVTMNHQKCXAMPZ-UHFFFAOYSA-N	443.208	1.479	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H]1CC(=O)NNC(=O)c1csc(N2CCOCC2)n1	742478867	SXQPENAEBYJQMH-ZDUSSCGKSA-N	439.538	1.530	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CN2CCC(C(=O)NCCc3cccs3)CC2)c1	744391118	PZGMSYGRAYSIEA-UHFFFAOYSA-N	428.558	1.888	50	20	IDGD	
C[C@H]1Oc2ccc(C(=O)C3CCN(CC(=O)NNC(=O)C(C)(C)C)CC3)cc2NC1=O	744396857	UDAIGVVMUXJICL-CYBMUJFWSA-N	430.505	1.494	50	20	IDGD	
C[C@@H](c1ccc(F)cc1F)N1CCN(CC(=O)NNC(=O)c2ccc(C#N)cc2)CC1	744398496	JEGYSCHWFAHXMK-HNNXBMFYSA-N	427.455	1.976	50	20	IDGD	
O=C(COC(=O)[C@H](c1cccc(F)c1)N1CCOCC1)NNC(=O)c1ccc(Cl)cc1	745419582	CIHWLHQUOJMLHD-IBGZPJMESA-N	449.866	1.857	50	20	IDGD	
C[C@@H](CC(=O)c1ccccc1F)C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	745488033	HDLZCIOBACIAJZ-ORAYPTAESA-N	444.415	1.565	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)N[C@H]2CC(=O)N(CCOc3ccccc3)C2)c1	745847639	PRCAUSDTSRIPEO-SFHVURJKSA-N	440.500	1.693	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)N[C@@H]3C[C@@H](C)N(c4cnn(C)c4)C3=O)n[nH]2)cc1	745919463	UEDQYANLXPWURY-FZKQIMNGSA-N	436.476	1.257	50	20	IDGD	
CCc1ccc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1[N+](=O)[O-]	747013076	QNYAPZKOPNTOAL-KRWDZBQOSA-N	429.385	1.301	50	20	IDGD	
COc1ccc([C@@]2(C)NC(=O)N(CC(=O)NNC(=O)c3ccc(Cl)cc3F)C2=O)cc1	747329037	DZVRXJXPLMPTCI-HXUWFJFHSA-N	448.838	1.716	50	20	IDGD	
CC(=O)N1CCN(c2ccc(C(=O)NNc3cc(Cl)nc(C)n3)cc2[N+](=O)[O-])CC1	747983979	VLLVSRSILQBVKA-UHFFFAOYSA-N	433.856	1.772	50	20	IDGD	
O=C(NNC(=O)C(=O)N1CCCC1)N[C@@H](Cn1cnc2ccccc21)c1ccc(F)cc1	748454413	SVHVZJCFUHWEJT-SFHVURJKSA-N	438.463	1.870	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)NCCC(=O)N1CCN(c2ccccc2)CC1	748464578	GBASKDYXADORBX-UHFFFAOYSA-N	439.516	1.307	50	20	IDGD	
O=C1CN(S(=O)(=O)c2cccc(C(=O)NNc3cccc4c3CCCC4)c2)CCN1	748577557	IUJKFIAVPKGSBY-UHFFFAOYSA-N	428.514	1.443	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cc(S(N)(=O)=O)cc(C)c2C)cc(OC)c1OC	751540327	GYZIYUVQTUWTBP-UHFFFAOYSA-N	437.474	1.051	50	20	IDGD	
CO[C@H](C)c1nc(CN2CCCN([C@@H](C)C(=O)NNC(=O)CC(C)C)CC2)cs1	752355697	RVCHXHYSEUYZOH-JKSUJKDBSA-N	425.599	1.940	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2Cl)c1)N[C@@H]1CCOC1	752699085	IURQLKRUNKHUOK-CYBMUJFWSA-N	438.893	1.874	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNS(=O)(=O)c2cc(C)c(F)cc2F)cc1	753359332	FOTOEXYQUIAPLM-UHFFFAOYSA-N	447.485	1.212	50	20	IDGD	
Cc1c(C(=O)NNc2cc(Cl)nc(N)n2)cc(Br)cc1S(N)(=O)=O	753452762	VJSRQYIXXOROPE-UHFFFAOYSA-N	435.691	1.187	50	20	IDGD	
CC(=O)Nc1ccc(NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc1	755493438	BQQQFPFSJXXTFF-UHFFFAOYSA-N	445.501	1.896	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1csc([C@@H]2CCCO2)n1	756003284	MPWCDSRSVBIRHD-KRWDZBQOSA-N	443.529	1.214	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)Nc1ccc(CN2CCOC2=O)cc1	756092547	HAGXQFYZQXOUFH-UHFFFAOYSA-N	439.476	1.498	50	20	IDGD	
Cn1cccc(NC(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)c1=O	756688231	ZFRZFLANOMPAFZ-UHFFFAOYSA-N	444.451	1.610	50	20	IDGD	
CCOC(=O)[C@@H](C)NC(=O)c1ccc(NC(=O)NNC(=O)c2cccc(N(C)C)c2)cc1	756790790	RXVXVADRAKWIAM-CQSZACIVSA-N	441.488	1.901	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)n(C2CCN(C)CC2)n1	756896538	QRSNLIQHRPXKME-UHFFFAOYSA-N	441.540	1.318	50	20	IDGD	
N#Cc1cc(C(F)(F)F)ccc1C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	758125033	GWWDEHZJLBJZHK-MRXNPFEDSA-N	449.341	1.721	50	20	IDGD	
O=C(Cn1c(S)nnc1-c1ccc(Cl)cc1)NNC(=O)C(=O)Nc1ccccn1	758840048	RSGFUOASZSGRBM-UHFFFAOYSA-N	431.865	1.068	50	20	IDGD	
CCNc1nc(C)c(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)s1	759264669	MCTVEPCSBCCCJX-UHFFFAOYSA-N	425.536	1.661	50	20	IDGD	
COc1ccc(C[C@@H](C)C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)cc1	760153830	GYLXWBGWCDQKCR-MRXNPFEDSA-N	447.561	1.348	50	20	IDGD	
C=C[C@@H](CC(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1)c1ccccc1	760154860	YZVBJKQFRNTGOH-KRWDZBQOSA-N	429.546	1.821	50	20	IDGD	
O=C(COc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1ccnn1Cc1ccc(F)cc1	760279336	MMYCCMVDOQVMBQ-UHFFFAOYSA-N	445.838	1.889	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CCNC(=O)[C@@H]2CCCN2C(=O)OC(C)(C)C)c(O)c1	760799264	MZVCBGJPXPHPKX-HNNXBMFYSA-N	434.493	1.367	50	20	IDGD	
CC(C)(C(=O)NNC(=O)C1CCN(c2ncccn2)CC1)c1ccc([N+](=O)[O-])cc1F	762446890	OKLDYMLYRLJISI-UHFFFAOYSA-N	430.440	1.866	50	20	IDGD	
Cc1cc(C(=O)O)cc(S(=O)(=O)NNC(=O)c2ccc(C#N)cc2)c1Br	762471132	BAJJMHPKQWNJSW-UHFFFAOYSA-N	438.259	1.951	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)c2ccccc2c1=O	763285656	WKPPUAJSMOTPTK-UHFFFAOYSA-N	447.411	1.585	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(Cl)c(C(=O)NC2CC2)c1	763444830	BJVVCNZTGGUJFD-UHFFFAOYSA-N	445.819	1.540	50	20	IDGD	
CC(C)CC(=O)N1CCC(NC(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)CC1	763484564	BFFZEAHMYYKSDS-UHFFFAOYSA-N	427.546	1.659	50	20	IDGD	
CCc1cccc(NC(=O)C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1	763512453	SRBFAIHYUVEMDA-UHFFFAOYSA-N	444.513	1.433	50	20	IDGD	
CN(Cc1ccccc1)S(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)C2CC2)cc1	763558705	VQJGNNBMSGPIKW-UHFFFAOYSA-N	430.486	1.003	50	20	IDGD	
CC(=O)Nc1cc(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)ccc1Cl	763570914	HANFLEHFFRHDOR-MRXNPFEDSA-N	432.820	1.224	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc2c(cnn2C(F)F)c1	763679720	CSGVTEUIPFYUDO-UHFFFAOYSA-N	447.398	1.995	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)n([C@@H]2C[C@H]3CC[C@H]2C3)n1	763680182	DAZJLUFFEGJNDL-XYJFISCASA-N	436.472	1.589	50	20	IDGD	
CC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)cc1Cl	763729427	ZJUZIQGYRIHFFN-UHFFFAOYSA-N	443.891	1.837	50	20	IDGD	
Cc1nccc(-c2cccc(NC(=O)C(=O)NNC(=O)CN3CCCc4ccccc43)c2)n1	763736356	SETBMBWRKBGXSA-UHFFFAOYSA-N	444.495	1.991	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)C(=O)Nc2cccc(Cl)c2N2CCOCC2)c1	763760183	GLCBJPLIWMILTM-UHFFFAOYSA-N	445.907	1.642	50	20	IDGD	
CSCc1ccc(NC(=O)C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1	763791477	TVWXFBREYRNGFG-UHFFFAOYSA-N	425.470	1.196	50	20	IDGD	
Cc1cc(C)cc(NC(=O)C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1	763797656	YOUPUMLRTUDCBY-UHFFFAOYSA-N	444.513	1.488	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(-n3cccn3)cc2)cc1	763873214	SOAVBIYIRXODBE-HNNXBMFYSA-N	435.440	1.628	50	20	IDGD	
COCCOc1cc(NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)ccc1OC	763973662	DSKAHVXGYIYNSA-UHFFFAOYSA-N	437.836	1.479	50	20	IDGD	
Cc1c(CS(C)(=O)=O)cccc1NC(=O)C(=O)NNC(=O)c1cc(Cl)ccc1O	763978501	KBZPBZISKLDDRV-UHFFFAOYSA-N	439.877	1.298	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)n(Cc2ccccc2)n1	763996049	UCCOZZIYCBSJML-UHFFFAOYSA-N	445.277	1.730	50	20	IDGD	
C[C@H]1CN(C(=O)c2ccc(NC(=O)C(=O)NNC(=O)Cc3ccsc3)cc2)C[C@H](C)O1	764034163	GQUXQIBZFNOKME-KBPBESRZSA-N	444.513	1.326	50	20	IDGD	
CC[C@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(Cl)c(S(=O)(=O)N2CCCC2)c1	764081999	AAQFBJVRJCRWCV-NSHDSACASA-N	430.914	1.257	50	20	IDGD	
NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(F)cc2Br)cc1F	764086886	VKZBAZFRZQFFKT-UHFFFAOYSA-N	441.188	1.226	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)nc1)C(=O)Nc1ccc(NC(=O)c2ccccc2)nc1	764100897	MEWRAWZWKPWWCB-UHFFFAOYSA-N	438.831	1.782	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)cccc1C(=O)N1CCCC1	764168479	PNQLPGKDCRXZDU-IBGZPJMESA-N	436.468	1.321	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(N3CCCC3=O)c(Cl)c2)cc1	764176706	FSQWUPYOTYXMGS-UHFFFAOYSA-N	425.832	1.738	50	20	IDGD	
COC(=O)CCSc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(C#N)cc2)c1	764177751	VAQJNRSHCLZWJG-UHFFFAOYSA-N	426.454	1.613	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)C(=O)Nc1ccc(OC(F)F)cc1OC(F)F	764269104	VYGPZFRYTXCBIT-UHFFFAOYSA-N	430.314	1.613	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1ccc(Cl)cc1Br	764276184	ZKKFMFLSBIPOJL-UHFFFAOYSA-N	442.653	1.973	50	20	IDGD	
CNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2cc(Br)ccc2O)c1C	764278091	RSXBNWARZKLKKT-UHFFFAOYSA-N	449.261	1.222	50	20	IDGD	
CCOc1cc(C(=O)N(C)C)ccc1NC(=O)C(=O)NNC(=O)c1cc2ccccc2o1	764331032	MGPABMDCOHCNOF-UHFFFAOYSA-N	438.440	1.933	50	20	IDGD	
CCNC(=O)N1CCc2ccc(NC(=O)C(=O)NNC(=O)c3ccc(O)c(Cl)c3)cc21	764349096	HNEFRNMWVLQCNF-UHFFFAOYSA-N	445.863	1.537	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1ccc(-c2cc[nH]n2)cc1	764392629	IYWWDPRPIKMDSZ-UHFFFAOYSA-N	425.470	1.964	50	20	IDGD	
Cc1cc(C=NNC(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)c(C)n1C1CCCCC1	764812291	IINQFNHZCVMIAK-UHFFFAOYSA-N	439.520	1.508	50	20	IDGD	
C[C@@H](CCC(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1)NC(=O)OC(C)(C)C	765185019	JWDLXDFXZXSPRZ-JTQLQIEISA-N	448.929	1.442	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)Nc3ccc(S(C)(=O)=O)nc3)n[nH]2)cc1C	765303371	ZJNVVWCGANSKLL-UHFFFAOYSA-N	428.474	1.959	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)CS(=O)(=O)C3CCCC3)n[nH]2)cc1OC	765596738	LCLHXPQDSJBWNL-UHFFFAOYSA-N	436.490	1.212	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	765757916	YHIYZLASPYMJKY-UHFFFAOYSA-N	430.936	1.822	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)cc1S(C)(=O)=O	765810732	VSHDUIKURXWLQY-UHFFFAOYSA-N	428.511	1.121	50	20	IDGD	
C[C@@H](OC[C@@H]1CCCO1)C(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	766670324	XMQHKSIEJDBSAI-AEFFLSMTSA-N	438.956	1.189	50	20	IDGD	
Cc1oc2ncnc(O)c2c1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	767155432	MMKBNAOACVJZJH-UHFFFAOYSA-N	445.457	1.096	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)[C@@]1(F)CCN(C(=O)OC(C)(C)C)C1	767375799	QZEAKQVAIPMRQK-OAQYLSRUSA-N	437.468	1.577	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)CCn1cnc2sc3c(c2c1=O)CCCC3	771966360	ALEDXFFQRZNROX-ZDUSSCGKSA-N	448.545	1.852	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCC2CCN(c3ccncc3)CC2)c1	772615574	FGHUDRFIIOSHHG-UHFFFAOYSA-N	431.518	1.346	50	20	IDGD	
Cc1cc(S(=O)(=O)NCCNC(=O)/C(C#N)=C/c2cc(C#N)n(C)c2C)c(C)s1	772726588	JIMOVXFBNUCKCN-LZYBPNLTSA-N	431.543	1.885	50	20	IDGD	
Cc1cccc(-n2cc(C(=O)NNC(=O)[C@@H]3CCCN(C(=O)OC(C)(C)C)C3)nn2)c1	773416613	CKNQFCDTJOVRQA-OAHLLOKOSA-N	428.493	1.984	50	20	IDGD	
CN1CC(=O)N(c2cccc(NC(=O)C(=O)NNc3ncc(Cl)cc3Cl)c2)C1=O	773676514	CCQPSXIDRWUMDM-UHFFFAOYSA-N	437.243	1.869	50	20	IDGD	
COC(=O)c1cc(OC)ccc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1cccc(Cl)c1	774009013	NVDIEDWRCDLMER-LLVKDONJSA-N	449.847	1.689	50	20	IDGD	
O=C(NNc1cnccn1)c1ccc(Br)c(S(=O)(=O)N2CCOCC2)c1	775279073	RZHOWJURNOLXMK-UHFFFAOYSA-N	442.295	1.017	50	20	IDGD	
CN(C)CC(=O)NNC(=O)Nc1cc(Br)ccc1I	775558431	MCSFITITFMGMNM-UHFFFAOYSA-N	441.067	1.768	50	20	IDGD	
CN1CC(=O)N(Cc2ccc(C(N)=O)cc2NC(=O)NNc2cccc(Cl)c2)C1=O	775665835	ABMOSYUYAGCBFZ-UHFFFAOYSA-N	430.852	1.982	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@H](C(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)C1	776204873	HCELMJVPEBGHAG-LSDHHAIUSA-N	426.514	1.602	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(CNC(=O)NNc2cccc(S(C)(=O)=O)c2)cc1	776612389	HCEWPRNIVWXQDE-UHFFFAOYSA-N	426.520	1.167	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(C(=O)NNc2nc(-c3ccccn3)nc3c2CCC3)n(C)c1	779219039	FCLYXRFROCNKKY-UHFFFAOYSA-N	441.517	1.373	50	20	IDGD	
C[C@H]1CC[C@@H](NC(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)C1	780788126	UGMJRXDWHIPXHQ-DOTOQJQBSA-N	438.550	1.159	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)c2ccc(OC)c(-n3cnnn3)c2)cc1Cl	781689917	TXFVFCVAXPUZOF-UHFFFAOYSA-N	447.839	1.808	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)[C@@H]1CC(c2ccccc2[N+](=O)[O-])=NO1	782025207	BODRKBRUVPNROV-HNNXBMFYSA-N	435.437	1.540	50	20	IDGD	
CCOC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)cc1	782892436	AEKOSVZGOHKEFI-UHFFFAOYSA-N	438.444	1.470	50	20	IDGD	
COC(=O)c1cc(OC)c(OC)cc1NC(=O)C(=O)NN=c1sc2ccccc2n1C	783351310	BTTSXQMKYLGRLN-UHFFFAOYSA-N	444.469	1.614	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CCC[C@H]2CN(C(=O)NNC(=O)CNC(=O)c3ccco3)C[C@@H]21	784263368	MHWZZYLZKYYXDU-SOUVJXGZSA-N	449.508	1.375	50	20	IDGD	
CC(C)(C)NS(=O)(=O)Cc1cccc(NC(=O)C(=O)NNc2ccc(Cl)nn2)c1	784790087	UEMGDPISRUVYLS-UHFFFAOYSA-N	440.913	1.430	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCCCC2)cc1NC(=O)C(=O)NNc1ccccn1	784794236	JWTZWDFIXGVYQH-UHFFFAOYSA-N	433.490	1.347	50	20	IDGD	
CCNC(=O)N(C)NC(=O)C(=O)Nc1ccc(CC(=O)N2CCCc3ccccc32)cc1	784916828	XBSZYPRRQXWADK-UHFFFAOYSA-N	437.500	1.840	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)Nc1ccc(F)cc1Br	785023005	KNCKCPRNLRMSON-UHFFFAOYSA-N	441.169	1.602	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2cc(F)c(F)c(F)c2)cc1S(=O)(=O)NC1CC1	785086955	LGZUDVOSMZNIRU-UHFFFAOYSA-N	442.419	1.935	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNc2ccc(Cl)c(F)c2)cc(S(C)(=O)=O)c1	785187047	UUUAWRZSXXGCLR-UHFFFAOYSA-N	443.840	1.751	50	20	IDGD	
Cc1ccc(C(=O)NCC2CC2)cc1NC(=O)C(=O)NNC(=O)[C@H]1Cc2ccccc2O1	785990083	BWPFDWSWTMKJGM-LJQANCHMSA-N	436.468	1.224	50	20	IDGD	
CNc1ccc(C(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)cn1	788264416	DVEYJEYWMUUTEB-UHFFFAOYSA-N	428.456	1.900	50	20	IDGD	
COC(=O)c1cccc(Cl)c1S(=O)(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	790054959	SKDVWAWFZPUCDP-UHFFFAOYSA-N	446.890	1.153	50	20	IDGD	
C[C@@]1(C2CC2)NC(=O)N(c2ccc(CNC(=O)NNC(=O)Cc3ccncc3)cc2)C1=O	790893799	CHKGAKBALSMDDE-QFIPXVFZSA-N	436.472	1.380	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)NCc2ccccc2OCC(=O)NC[C@@H]2CCCO2)n1	792842190	GJYAJTXPBGXQMO-KRWDZBQOSA-N	441.488	1.208	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(-n2ccc(C)n2)cc1	793023326	MWQUYGXFWSWTHV-UHFFFAOYSA-N	437.456	1.744	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(C)c(NC(=S)NNC(=O)N=c2cc[nH]cc2)c1	795003895	YBRJZQOKQIPEDP-UHFFFAOYSA-N	436.563	1.866	50	20	IDGD	
CNS(=O)(=O)c1ccc(Cl)c(C(=O)NNc2ccccc2S(=O)(=O)N(C)C)c1	795161417	ONBUYFASLCYZKM-UHFFFAOYSA-N	446.938	1.255	50	20	IDGD	
COC(=O)c1cc(F)cc(NC(=O)C(=O)NNC(=O)COc2cc(C)ccc2C)c1F	796992421	QXKDAGLHHKLOQR-UHFFFAOYSA-N	435.383	1.533	50	20	IDGD	
CC(C)Oc1ccc(NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1C(N)=O	797676887	FZSGMGSLPDWMAO-UHFFFAOYSA-N	434.474	1.443	50	20	IDGD	
O=C(NNC(=O)c1ccncc1C(F)(F)F)c1ccc(S(=O)(=O)N2CCCC2)cc1	798154009	QKGATHQBXMADKY-UHFFFAOYSA-N	442.419	1.960	50	20	IDGD	
O=C(NCC(F)(F)F)NNC(=O)c1ccc([N+](=O)[O-])cc1I	798315270	QWKAIOBSEXTPGF-UHFFFAOYSA-N	432.096	1.706	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)[C@@H](C)NS(=O)(=O)c2c(C)nn(C)c2C)c2ccccc2n1	799007788	HPHIVHJACXGBOX-CYBMUJFWSA-N	444.517	1.022	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CCCOc2ccc(S(C)(=O)=O)cc2)cc1	801107141	NAAFYKPAPYAXKC-UHFFFAOYSA-N	433.486	1.344	50	20	IDGD	
O=C([C@@H](O)c1cccc(C(F)(F)F)c1)N1CCN(S(=O)(=O)CBr)CC1	803038153	NTUHLDJSKXXUFV-LBPRGKRZSA-N	445.257	1.565	50	20	IDGD	
CC(=O)Nc1ccc(NS(C)(=O)=O)c(C(=O)NNc2ccc3c(=O)[nH]ccc3c2)c1	803438778	FUHYBMCNNDENHG-UHFFFAOYSA-N	429.458	1.615	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1nc(C2CCOCC2)cs1	806974753	GMHHTMCAQRHQPJ-LLVKDONJSA-N	436.465	1.730	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)NCc2ccncc2OC[C@H]2CCOC2)cc1	807616859	YNRJHPAPFFTYEJ-KRWDZBQOSA-N	428.489	1.969	50	20	IDGD	
COC(=O)c1ccc(Cl)c(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)c1	809982708	MZDCBUITLYWXAQ-UHFFFAOYSA-N	446.268	1.502	50	20	IDGD	
Cc1c(Cl)c(C(F)(F)F)nn1CC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	810105684	DJUWJOBHKGMITD-UHFFFAOYSA-N	438.815	1.728	50	20	IDGD	
O=C(CNS(=O)(=O)c1c(Cl)cccc1Cl)NNc1nc(-c2ccncc2)no1	810310131	JWXJAJCJVAUPQY-UHFFFAOYSA-N	443.272	1.860	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NN=C1CCCC[C@@H]1[C@H]1CCCN1C(=O)OC(C)(C)C	811642077	YGXQTDBVYQHDOH-OFQRWUPVSA-N	430.571	1.986	50	20	IDGD	
COC[C@@H](C)[C@H](C)C(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	812452091	BYXWDRLPSXKUSP-CVEARBPZSA-N	433.530	1.845	50	20	IDGD	
Nc1ncc2c(n1)CCCC2=NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	814878928	KZMZRNOGPNGZCW-UHFFFAOYSA-N	427.940	1.687	50	20	IDGD	
Cc1nn(-c2ccccc2)c2sc(C(=O)NNC(=O)C(=O)Nc3nc(C)n(C)n3)cc12	815563508	FPEPZCGRDCCTPW-UHFFFAOYSA-N	438.473	1.232	50	20	IDGD	
O=C(CC(F)(F)F)NNC(=O)C(=O)Nc1ccc2c(c1)N(C(=O)Cc1ccccc1)CC2	815568803	VDWCKSOFKVMFNH-UHFFFAOYSA-N	448.401	1.857	50	20	IDGD	
Cc1nn(-c2ccc(S(N)(=O)=O)cc2)c(C)c1CCC(=O)NNc1ncncc1F	817078193	ZNUDWLFGHTYJCJ-UHFFFAOYSA-N	433.469	1.142	50	20	IDGD	
Cc1nnc(NNC(=O)c2cccc(S(=O)(=O)N[C@@H](C)c3ccccc3)c2)nc1O	817283975	GGTQQUIYYYMNNZ-LBPRGKRZSA-N	428.474	1.682	50	20	IDGD	
CC(=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O)c1ccc(-c2cccs2)cc1	818269928	PTKVRUSJUBJMQR-UHFFFAOYSA-N	429.527	1.840	50	20	IDGD	
CCN(C(=O)/C(C#N)=C/c1cn(CCC(N)=O)nc1-c1ccc(OC)cc1)[C@@H](C)CO	818635280	XQSPDLZNAFSNLV-VUVCFOEZSA-N	425.489	1.570	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)[C@H](NS(C)(=O)=O)C(C)(C)C)c1	818750021	AWTQXYIYQNVWNA-LBPRGKRZSA-N	436.328	1.643	50	20	IDGD	
CCOC(=O)c1c[nH]nc1S(=O)(=O)NNC(=O)c1ccc(COc2ccccc2)o1	818785492	GWANXBNUBMVDPU-UHFFFAOYSA-N	434.430	1.382	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1)NNC(=O)Cc1ccc(F)cc1	913156210	WLFPQLZRJDSRIA-UHFFFAOYSA-N	449.382	1.393	50	20	IDGD	
O=C(NNC(=O)c1cn(-c2ccccc2Br)nn1)c1ccc2c(c1)OCCO2	914720513	HNILAOTUPWOMDU-UHFFFAOYSA-N	444.245	1.876	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CC(c2ccccc2)=NO1)c1cccc(S(=O)(=O)N2CCCC2)c1	915128410	ADNTWSXPRWUEML-IBGZPJMESA-N	442.497	1.425	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCCOc2ccccc2OC)nc1	915889504	DYIXOQBQSGYRKH-UHFFFAOYSA-N	437.522	1.826	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)N[C@@H](CN1CCOCC1)c1ccccc1	916214434	ROTNEBXQOGAYOG-FXAWDEMLSA-N	426.473	1.230	50	20	IDGD	
Cc1cc(C)c2c(c1)C(=NNC(=O)c1cccc(S(=O)(=O)N3CCOCC3)c1)C(=O)N2	916258530	CYEKEAUUGFYMFX-UHFFFAOYSA-N	442.497	1.411	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NC[C@H]1CCN(c2ccccc2)C1	916579716	MRFZNDKOEHQOLK-MRXNPFEDSA-N	444.561	1.759	50	20	IDGD	
COc1cccc(OC)c1OC1CCN(CC(=O)NNC(=O)Cc2nc(C)cs2)CC1	917137541	RUVUUZNTKSKHQR-UHFFFAOYSA-N	448.545	1.702	50	20	IDGD	
COCCNS(=O)(=O)c1cccc(C(=O)NNc2ccc(Cl)cc2[N+](=O)[O-])c1	917218178	YRGSNHLCAVRXNQ-UHFFFAOYSA-N	428.854	1.930	50	20	IDGD	
O=C(CCSc1ccccc1Br)NNC(=O)N[C@@H]1CCS(=O)(=O)C1	919886825	VJCWVEMMIRORGZ-SNVBAGLBSA-N	436.353	1.449	50	20	IDGD	
C[C@H]1C[C@@H](C)CN(C[C@@H](C)NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)C1	919924797	XLCBXCJMNWXGMW-OWCLPIDISA-N	439.582	1.247	50	20	IDGD	
O=C(NCc1ccco1)NNC(=O)C1CCN(S(=O)(=O)/C=C\c2ccccc2)CC1	920856633	XHFZLBXCBXXRTK-UVTDQMKNSA-N	432.502	1.823	50	20	IDGD	
O=C(NNC(=O)N1CCC(n2cc(Cl)cn2)CC1)c1csc(N2CCOCC2)n1	1116508221	FFLDYHLPZLTIQJ-UHFFFAOYSA-N	439.929	1.521	50	20	IDGD	
COC(=O)C(=O)NNC(=O)NCCOc1ccc(Br)cc1C(F)(F)F	1319717421	QXFVJJDQGBAFKT-UHFFFAOYSA-N	428.161	1.350	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)c(-c2ccncc2)n1	1321905623	MLVPGCNWVIFEDF-UHFFFAOYSA-N	428.493	1.890	50	20	IDGD	
C[C@H](CC(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1)NC(=O)c1ccccc1	1322961352	HWLPAOSXHTWDFM-OAHLLOKOSA-N	432.521	1.990	50	20	IDGD	
O=C(c1n[nH]c2cc(Cl)ccc12)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1778659913	JRSKWWUPFHZSDM-KSSFIOAISA-N	427.288	1.260	50	20	IDGD	
C[C@H](Nc1ccccn1)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2	1779330210	TXUWNDBCBUJBQG-JVPBZIDWSA-N	429.348	1.948	50	20	IDGD	
Cn1ccc(=O)cc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@](C)(Cl)CCl)C2	1780059146	PWEWRLCFLZQXDA-NSISKUIASA-N	444.359	1.749	50	20	IDGD	
CCOc1ccc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](Br)CC)CCO3)nn1	1780429096	BLAOIGRGRLXJMO-ACJLOTCBSA-N	441.326	1.492	50	20	IDGD	
C=C[C@H](O)C(C)(C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Br)C1	1780774704	IVOVNMZNJUQEES-MOROJQBDSA-N	435.334	1.764	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)c3cnn4ccncc34)CCO2)C1	1781230248	ROMMBXKGVZTZEP-ZWKOTPCHSA-N	426.304	1.409	50	20	IDGD	
O=C(c1cc2cnccc2[nH]1)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781331086	CYUBMGQHQXISQT-YOEHRIQHSA-N	425.258	1.697	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)O)C1	1781988611	HLLHQEKHVOWBOB-WMHILYHISA-N	449.460	1.028	50	20	IDGD	
O=C(c1nc2cc([N+](=O)[O-])ccc2[nH]1)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Cl)CCO2	1782181872	HCWZYEHFBCLVQL-SUMWQHHRSA-N	425.804	1.449	50	20	IDGD	
CC1(C(=O)N2CCO[C@]3(CCN(C(=O)/C(C#N)=C/c4ccc(F)cc4F)C3)C2)COC1	1782862434	USTMGPDNIAEVFO-AGBQBWRISA-N	431.439	1.738	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@]2(C1)CN(C(=O)c1cn[nH]c1)CCO2	1782866013	HECIJURKBCQPDG-LFEYGZQNSA-N	427.411	1.739	50	20	IDGD	
CNc1nsnc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]2C1	1783964055	IQRMKAGWUMWQOX-BJDJZHNGSA-N	446.371	1.204	50	20	IDGD	
CSc1cccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]3C2)c1O	1784091504	WGLFWPWGKGDRNG-MHEUCROKSA-N	428.938	1.307	50	20	IDGD	
O=C(CCc1cccc(O)c1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1784125971	ZFJZMBUGMDCPFR-SJLPKXTDSA-N	429.286	1.845	50	20	IDGD	
CCOC(CC(=O)N1CC[C@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2)OCC	1784167275	SJNQWQNCFNSGDB-MSOLQXFVSA-N	425.353	1.842	50	20	IDGD	
Cc1nn(C)c(C)c1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]21	1784702863	RPTAVIWQNGQMIA-XMDUPGNXSA-N	431.364	1.867	50	20	IDGD	
CC(C)(C)n1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Br)C[C@@H]32)n1	1785700052	SXLUPCGXXKQOGS-JURCDPSOSA-N	445.333	1.922	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCBr)[C@H]2C1	1786407166	IZPDCNRLSLXFSM-RVMXOQNASA-N	440.176	1.925	50	20	IDGD	
O=C(NC1(c2ccc(NC(=O)c3cccc(O)n3)cc2)CCC1)c1ccc(B(O)O)cc1	1787387167	JSBICFSJIDTECG-UHFFFAOYSA-N	431.257	1.529	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cn4cccnc4n3)[C@H]2C1	1788310788	DZSROVWNTCJHNS-ZOBUZTSGSA-N	431.569	1.174	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnn4cccc(F)c34)C[C@@H]21	1788764149	NHFPFRGLHMTYSC-ZVZYQTTQSA-N	448.571	1.918	50	20	IDGD	
CC(=O)Nc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](O)CCl)C[C@@H]32)ccc1C	1790199538	UNNNVHNLRKLAMG-DKKFBQAASA-N	437.924	1.146	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21)c1nc2ccc(F)cn2n1	1790527038	NPOWNUVKAVYYDE-DLOVCJGASA-N	430.267	1.265	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cc(C)no3)C[C@@H]21	1790958514	SECMVTSOJNIQRR-TUUVXOQKSA-N	428.327	1.679	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cn3cnc4ccccc43)[C@H]2C1	1791179565	ZFEJLWZBIXTHBT-LLDVTBCESA-N	449.349	1.799	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(OC)c(OC)c3)C[C@@H]21	1791254600	XHWAWAWOBIUBEE-GGXPGOJBSA-N	440.924	1.551	50	20	IDGD	
O=C(CC[C@@H]1CCOC1)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1	1792021794	VRNWLXKSLSEBBR-QGZVFWFLSA-N	436.317	1.931	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C(=O)c1ccc(Cl)cc1)c1ccc(B(O)O)cc1	1793080616	QXLIZKUQHCLLHE-REPLKXPHSA-N	440.692	1.155	50	20	IDGD	
CC(C)(C)OC(=O)N1CCCC[C@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Cl	1796366390	NNWCAHQLGYVQMV-XFIYOXNOSA-N	447.935	1.900	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccc2c(c1)CCCO2	1797242686	NINTVHQTZSDZOW-BMQTXXJKSA-N	436.936	1.398	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2ncnn2c1	1797559794	HSZUHFLSZYBOOZ-ZFHGCVPZSA-N	426.304	1.169	50	20	IDGD	
C[C@@H](Nc1ccccn1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2	1797977566	HSPLLXQYDLBWRA-AMVBZWJASA-N	429.290	1.162	50	20	IDGD	
COc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCBr)C3)ccc1O	1798950853	PGODXBMHJWPVFP-FVCICTRLSA-N	427.295	1.389	50	20	IDGD	
Cn1nc2c(c1C(=O)N[C@@H]1[C@H]3COC[C@@H]1CN(C(=O)[C@](C)(Cl)CCl)C3)CCC2	1800047741	QHRKHGSMFVNSLE-CVGJEZRXSA-N	429.348	1.348	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CCc3ccccc3[C@H]1O)C2)C(Cl)Cl	1801015806	VQSQCJDBILTJIN-IMPMIVQMSA-N	427.328	1.676	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)COCCOCCOCCOC	1802097377	HYBITFSXEOSSKK-MHORFTMASA-N	434.961	1.338	50	20	IDGD	
CS(=O)(=O)Cc1ncccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C(Cl)Cl	1802341066	HGFZRHFKCWYSHH-ZSBIGDGJSA-N	434.345	1.682	50	20	IDGD	
CC(C)N1CCC(C(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]2c2cccnc2)CC1	1803136039	MBCDSWTUIMAACV-VAMGGRTRSA-N	436.984	1.808	50	20	IDGD	
COc1ccc(OCC(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)cc1	1803136265	AUPINSOAZROFIK-BSIFCXSSSA-N	447.919	1.775	50	20	IDGD	
COC(=O)[C@@H]1CC[C@H](C(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]2c2cccnc2)C1	1803137356	MMJANFMHSOZNDW-QBBQCFRVSA-N	437.924	1.276	50	20	IDGD	
COc1ccnc(C(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)c1OC	1803140869	IOWMZMDBDUTZDD-VKJFTORMSA-N	448.907	1.413	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)n1	1803140928	JMLVZSQOLNIZTM-AYBZRNKSSA-N	445.907	1.354	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]1c1cccnc1	1803147819	MDLJRQBTZIXSPN-LXTVHRRPSA-N	432.746	1.861	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)Cn2nc(C)cc2C)[C@H]1c1cccnc1	1804579109	BVOZEYVWAIJASJ-WSTZPKSXSA-N	433.940	1.855	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)/C=C/c2ccco2)[C@@H]1c1cccnc1	1804613018	GDOCUVULDZLHMO-MPAHJKEMSA-N	439.516	1.767	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H](CNC(=O)[C@@H](F)Cl)[C@@H]1c1cccnc1)N1CCN(C)CC1	1808316240	WWGWHPPDBHXFIH-NRSFXHEJSA-N	425.936	1.258	50	20	IDGD	
Cc1ccsc1C(=O)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1	1809974894	GKZYSZZSYAZBRO-UHFFFAOYSA-N	426.347	1.895	50	20	IDGD	
CC[S@](=O)CCC(=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@@H]1c1cccnc1	1810122850	HLSBSTYLEXXMIS-NVVRBJDHSA-N	448.358	1.937	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CN2CCOC2=O)n[nH]1	1815023880	VSIDNZSZVYFABG-AAEUAGOBSA-N	442.314	1.885	50	20	IDGD	
C=CCO[C@@H](C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1815214491	VWTSONDUSNXJFR-SUMWQHHRSA-N	441.492	1.305	50	20	IDGD	
CC(C)C1(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)CCC1	1815361451	FJRBLALLXIHIAY-MRXNPFEDSA-N	441.362	1.875	50	20	IDGD	
N[C@@H](Cc1cscn1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)C(Cl)Cl)CC2	1816990040	XOZGLNMFKHDZTK-CBAPKCEASA-N	434.374	1.885	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](C)CBr)CC2	1817292630	LXHUUAKATMEBPQ-UMNHJUIQSA-N	445.383	1.953	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)Cc2cccs2)[nH]n1)c1cccc(B(O)O)c1	1817475562	UGGRIQOXGCGFHP-GOSISDBHSA-N	438.318	1.700	50	20	IDGD	
Cc1ccncc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1818335534	IGMKLPQWABYCLW-LJQANCHMSA-N	433.277	1.413	50	20	IDGD	
CCN(C)[C@H](C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1821626433	HDNGDEVWSQHCBF-DYVFJYSZSA-N	442.524	1.054	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(O)ncn1)CC2	1825636510	WJUGCMSLDFAQLL-SFYZADRCSA-N	426.296	1.648	50	20	IDGD	
COc1cnc(C(=O)N[C@H]2CCc3nc(NC(=O)[C@H](C)Br)sc3C2)cn1	1825636994	PFAVINJFDVZHJB-IUCAKERBSA-N	440.323	1.951	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1nc[nH]c1[N+](=O)[O-])CC2	1825999480	XAHVQFNLQCDGAT-SFYZADRCSA-N	428.858	1.254	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnc(O)nc2O)CC1	1827592350	SWRFMMIFAPVQLX-BXUZGUMPSA-N	441.326	1.905	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3nccc4[nH]ccc34)C2)C1	1830358162	RGXNCHZZBHBGLM-OAQYLSRUSA-N	434.924	1.898	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)CCc2cnn(C)c2)CC1	1831870700	CFYQPZKHTWFNPS-FQEVSTJZSA-N	446.596	1.345	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)CCc2cnccn2)CC1	1832263672	UZBTUTRYQXVOIB-FQEVSTJZSA-N	444.580	1.402	50	20	IDGD	
O=C(CN1CCc2sccc2C1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1832584431	BPXSETOTQKVFNB-HKUYNNGSSA-N	445.944	1.097	50	20	IDGD	
O=C(CCc1ccccn1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1833188334	LEVBEMKPGGTFQT-SJLPKXTDSA-N	444.301	1.161	50	20	IDGD	
Cc1cc(C#N)cc(C(=O)N2CCC(N3CCC(NC(=O)[C@@H](O)CCl)CC3)CC2)c1	1833312066	JLJMHIBNQMWOFA-FQEVSTJZSA-N	432.952	1.652	50	20	IDGD	
Cc1cc(C(=O)N2CCC(N3CCC(NC(=O)[C@H](O)CCl)CC3)CC2)nn1C(F)F	1833312673	WKHVVDUNXPRMQA-MRXNPFEDSA-N	447.914	1.372	50	20	IDGD	
Cc1nc(CC(=O)NC2CCN(C3CCN(C(=O)[C@@H](F)Br)CC3)CC2)no1	1833810306	AFPJPYVUVHJAGQ-MRXNPFEDSA-N	446.321	1.183	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)c3ccsc3)CC2)CC1	1834121004	AXMXOYCWZISZNI-UHFFFAOYSA-N	435.594	1.306	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CCC(F)(F)C3)C2)C1	1834818953	CAOZOZARENLRTK-BBRMVZONSA-N	439.297	1.663	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cc[nH]c4nccc3-4)CC2)CC1	1835011533	NGIWQFALVYFRMV-IBGZPJMESA-N	447.967	1.954	50	20	IDGD	
C/C=C/C(=O)N1CCC(N2CCC(NC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CC2)CC1	1835117660	JCCIKBVPGBQECY-IKNHGZTRSA-N	428.537	1.268	50	20	IDGD	
O=C(/C=N/O[C@@H]1CCCCO1)NC1CCN(C2CCN(C(=O)[C@H](F)Cl)CC2)CC1	1835767598	GJSBEWDSHIZMFG-HWPLOXAPSA-N	432.924	1.621	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccsc3)CCO2)C1	1836095005	NQWZUORPIYOQLJ-KBXCAEBGSA-N	445.379	1.778	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccnc(Cl)n1)CCO2	1837923982	CJSRKOYDUUEAFT-SFHVURJKSA-N	442.976	1.052	50	20	IDGD	
C[C@H](C(=O)N1CCC(OC2CCN(C(=O)CO[Si](C)(C)C)CC2)CC1)n1ccnn1	1838431965	GUTHTUOHEUWJCL-MRXNPFEDSA-N	437.617	1.689	50	20	IDGD	
CC(C)c1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@](C)(Cl)CCl)C3)C2)n[nH]1	1838698746	XESQPCSAEHJBPZ-RTBURBONSA-N	447.363	1.839	50	20	IDGD	
O=C(CCc1ccc(O)nn1)N1CCC(OC2CCN(C(=O)C(Cl)Cl)CC2)CC1	1838721547	XQKZOKKPUVLHBN-UHFFFAOYSA-N	445.347	1.917	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(OC)cc3OC)CCO2)C1	1838880285	LFTPUOFFKBPEJQ-UWJYYQICSA-N	440.924	1.791	50	20	IDGD	
Cc1noc(C)c1CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2	1839150654	SSVKCNULSYXGIQ-RBUKOAKNSA-N	448.347	1.527	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(C)cc(C)n3)C2)C1	1840151427	BAXCWQIMJVTRJN-OXQOHEQNSA-N	425.913	1.022	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cc(C)cc(F)c3)C2)C1	1840156385	RLBAZPLKWMAEPH-WIYYLYMNSA-N	442.915	1.387	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCCCCC(=O)OC)CCO2)C1	1840233926	CTLXNKHMOWYICD-UTKZUKDTSA-N	446.972	1.974	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCCc3cccnc3)CCO2)C1	1840513499	CLLBBGWVWVSDNA-GHTZIAJQSA-N	439.940	1.115	50	20	IDGD	
CCN1CCN(c2ccc(C(=O)N3CC4(CCCN4C(=O)[C@H](O)CCl)C3)cc2)CC1	1841354477	CUYDTSSOUQKBJB-LJQANCHMSA-N	434.968	1.245	50	20	IDGD	
O=C([C@@H](O)CCl)N1CC2(CCCN2C(=O)/C=C/c2ccc(Cn3ccnc3)cc2)C1	1841981075	CWTSRHLVCQESIS-GHOSXJJBSA-N	428.920	1.748	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1cc(C)cc(C#N)c1)C2	1843416590	CAOLVHXBLWUXRF-WGOQTCKBSA-N	432.484	1.818	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@]23C[C@@H](CO2)N(C(=O)OC(C)(C)C)C3)C1	1845078718	OANXJSAEXWMWQX-GXZWQRSESA-N	441.956	1.986	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC2(CCCN2C(=O)CSc2nc[nH]n2)C1	1846569308	MRCUAEGNKMCWMC-MKMNVTDBSA-N	444.467	1.986	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](O)[C@@](C)(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](F)Cl)C1	1847238176	VZFYSHDYIIHAGK-SLARRSDRSA-N	447.935	1.731	50	20	IDGD	
COc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](C)CBr)n1	1847498476	KVSWIJUWJJCRFY-SRVKXCTJSA-N	441.282	1.845	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H](F)C[C@@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](O)CCl)C1	1847558451	FVLVSYWKVAPUIN-OWYFMNJBSA-N	447.935	1.383	50	20	IDGD	
C[C@H]1CC[C@@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](O)CCl)CN1C(=O)OC(C)(C)C	1847568982	RXAUFWLATLPNLU-QEOTZNIISA-N	443.972	1.824	50	20	IDGD	
CC[C@H](C)CC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CN(C)NC(=O)NCc1ccccc1	1847697273	CUNNQFLNMUTSET-IHPCNDPISA-N	429.565	1.971	50	20	IDGD	
O=C(CCCNS(=O)(=O)c1ccc(F)cc1)NNC(=S)NCCc1cccs1	11517226	LIUREXQNIWRLFS-UHFFFAOYSA-N	444.579	1.684	50	20	IDGD	
Cc1nnc(NNC(=O)C2CCN(S(=O)(=O)c3ccc(C(C)(C)C)cc3)CC2)[nH]c1=O	11547957	BVOKMULMBBXFNE-UHFFFAOYSA-N	448.549	1.315	50	20	IDGD	
Cc1nn(Cc2ccc(F)cc2)c(Cl)c1C(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1	12799375	AWPKMWMPBHYEAU-LBPRGKRZSA-N	428.873	1.228	50	20	IDGD	
O=C(CNC(=O)c1ccc(Br)o1)NNC(=O)c1cc(Br)c[nH]1	28717417	RHLMPKPOBCOWJV-UHFFFAOYSA-N	434.044	1.324	50	20	IDGD	
O=C(Cc1cn(-c2ccccc2)nc1-c1ccc(F)cc1)NNC(=O)C(=O)N1CCCC1	216351517	OIIJGOKIZYSOST-UHFFFAOYSA-N	435.459	1.991	50	20	IDGD	
CCc1c(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cnn1C(C)(C)C	728329212	KUIILNNCUGPWTL-KRWDZBQOSA-N	430.461	1.345	50	20	IDGD	
Cc1nc(C(C)(C)C)sc1C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	728340457	XEGNZZSKWKTBIO-CQSZACIVSA-N	433.486	1.893	50	20	IDGD	
COCCOc1cn(-c2ccccc2)nc1C(=O)NNC(=O)[C@@H]1COc2ccccc2O1	729297153	XAXVCDGYXBCMES-IBGZPJMESA-N	438.440	1.499	50	20	IDGD	
CC(C)[C@H](NC(=O)NC(C)(C)C)C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	729531901	PHIUXSQFVBIZJP-INIZCTEOSA-N	425.555	1.693	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)NCCCN1CCN(Cc2ccccc2)CC1	730822807	JSVUHSQSDUXSCV-UHFFFAOYSA-N	441.532	1.309	50	20	IDGD	
CCOC(=O)C1=NN(c2ccccc2)[C@H](C(=O)NNC(=O)Cn2cnc3ccccc32)C1	731185751	DXKNLMBIQJGBBB-IBGZPJMESA-N	434.456	1.382	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)c1ccc(Cl)c(S(=O)(=O)N(C)OC)c1	731492426	DAXVXDXOZNQWPZ-UHFFFAOYSA-N	427.866	1.605	50	20	IDGD	
CN(C)C(=O)CN1CCC(NC(=O)NNC(=O)CSc2ccc(Cl)cc2)CC1	731761969	RNQUZZPVAMRRHG-UHFFFAOYSA-N	427.958	1.315	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(C)c(C(=O)NNc2ccc(Br)nc2)c1	732836985	UWVZQUNXCCVFAR-UHFFFAOYSA-N	443.323	1.834	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)[C@H]1CC(=O)N(c2ccccc2Cl)C1	734239877	YLNHADMGIKMIMX-LBPRGKRZSA-N	439.900	1.548	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)C[C@H]2OCCc3ccccc32)cc1OC	734604816	IENJLNGDILGVDX-GOSISDBHSA-N	428.441	1.712	50	20	IDGD	
C[C@@H]1Oc2c(cccc2C(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)NC1=O	734825871	PNEFSXFPXTXELG-LBPRGKRZSA-N	447.492	1.750	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	735116744	DGQFJBSVRSMOAM-CQSZACIVSA-N	437.497	1.067	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)c(C)c1C	735265191	AXINNYJIUDKYIZ-UHFFFAOYSA-N	447.922	1.236	50	20	IDGD	
C[C@H](CN1CCN(c2ccccn2)CC1)NC(=O)NNC(=O)c1cccc2ncccc12	735518443	JYOWFKLQVYYHBB-QGZVFWFLSA-N	433.516	1.785	50	20	IDGD	
CC(=NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)[C@H]1CN(Cc2ccccc2)CCO1	735610303	MRHOGIVUIIXCJK-OAQYLSRUSA-N	444.557	1.944	50	20	IDGD	
O=C(NCCS(=O)(=O)N1CCN(c2ccccn2)CC1)NNc1c(F)cccc1F	735758467	JTOFLXUUONZZCC-UHFFFAOYSA-N	440.476	1.138	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)c1	736066369	DYIHXLAVHWOGMA-UHFFFAOYSA-N	426.838	1.573	50	20	IDGD	
O=C(COC(=O)c1csc(Nc2ccccn2)n1)NNC(=O)c1cccc([N+](=O)[O-])c1	736902873	GIETZZQLFVMLQB-UHFFFAOYSA-N	442.413	1.808	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)COCc1ccccc1)N1CCN(c2ccccc2)CC1	738451292	PDOXWFOFVKVFSB-IBGZPJMESA-N	425.533	1.744	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)N[C@@H]1CCN(c2ccc(Cl)cc2)C1=O	740043344	FQOLCPUDRONDMS-CYBMUJFWSA-N	435.893	1.267	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2ccc(COc3ccccc3)o2)nc2nc(O)nc(O)c12	740749728	MUVDNQRVYWBEML-UHFFFAOYSA-N	435.396	1.991	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)c1ccccc1	740853080	SVLQJXAQORBAHT-UHOSZYNNSA-N	428.533	1.912	50	20	IDGD	
CS(=O)(=O)CC[C@@H](Cc1cccc(Br)c1)C(=O)NNC(=O)c1ccc[nH]1	741207526	FZHZWNQMPNWLIY-ZDUSSCGKSA-N	442.335	1.832	50	20	IDGD	
CC(=NNC(=O)CNC(=O)c1ccco1)c1ccc(S(=O)(=O)CC(F)(F)F)cc1	741761484	KRYGUUQGHCPAEK-UHFFFAOYSA-N	431.392	1.886	50	20	IDGD	
CCn1nc(C)c(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1Cl	741881024	WCEAMJPXQJNPPZ-UHFFFAOYSA-N	439.925	1.724	50	20	IDGD	
Cc1nn(C)c2sc(C(=O)N[C@@H](C)C(=O)NNC(=O)COc3ccc(C#N)cc3)cc12	742033434	OGBSDYVJGLRZQR-LBPRGKRZSA-N	440.485	1.160	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)CNC(=O)c1cc2ccccc2[nH]1	742468809	KFFUQXJNDLSOEJ-UHFFFAOYSA-N	448.527	1.257	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@H]2CCC(=O)N2Cc2ccc(C)cc2)c2ccccc2c1=O	742473534	CKEPJGNAAMNGAV-LJQANCHMSA-N	447.495	1.677	50	20	IDGD	
COC(=O)Nc1ccc(CCNC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)cc1	743625163	QNYXQLMOHKMIJH-UHFFFAOYSA-N	449.489	1.847	50	20	IDGD	
CC(C)CC(=O)N[C@@H](C(=O)OCC(=O)NNC(=O)c1ccc(C#N)cc1)c1ccccc1	744937009	SONFFCXXWHYDCR-OAQYLSRUSA-N	436.468	1.766	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)c2cc(S(=O)(=O)C(C)C)ccc2F)c1	745002450	OAQPOFUPOLEWEF-UHFFFAOYSA-N	436.461	1.934	50	20	IDGD	
O=C(NC[C@@H]1CN(Cc2ccccc2)CCO1)NNC(=O)c1cc([N+](=O)[O-])ccc1O	745289438	KUZRVGFDERMVQP-MRXNPFEDSA-N	429.433	1.145	50	20	IDGD	
C[C@H](C(=O)NNc1ccc(F)cc1Br)N1C(=O)[C@H]2[C@H](C1=O)[C@H]1CC[C@H]2O1	748074323	XZFWPYQTAFFQIP-ODTJPNJJSA-N	426.242	1.582	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1CC(CC(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1)C2	748529348	OIWBTMWXRIHWER-ILXRZTDVSA-N	444.554	1.072	50	20	IDGD	
Cn1c(=O)nc(O)c2nc(CCC(=O)NNc3ccc(OCC(F)(F)F)cc3)[nH]c21	748694959	XIADZBOSBLKCGQ-UHFFFAOYSA-N	426.355	1.379	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)CNC(=O)c1ccco1)Oc1ccccc1Br	748979454	WLCICBYAQCOXGG-LLVKDONJSA-N	439.266	1.570	50	20	IDGD	
NS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccc(OCC(F)(F)F)cc2)cc1	749289083	HBVPRWUMUWOKPR-UHFFFAOYSA-N	432.380	1.357	50	20	IDGD	
Cc1ccnn1-c1ccc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1	749957329	IFDBOHPVPMQYOO-LJQANCHMSA-N	436.424	1.325	50	20	IDGD	
CNS(=O)(=O)c1csc(C(=O)NNc2nc(Br)cn3ccnc23)c1	750247289	NWPRBOLTOWBFNF-UHFFFAOYSA-N	431.297	1.218	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNS(=O)(=O)c2cc(C(=O)OC)c(C)o2)cc1	751143261	YIYIGQFYGDQITC-GFCCVEGCSA-N	426.447	1.550	50	20	IDGD	
COc1ccc(-c2noc(CCCC(=O)NNC(=O)CNC(=O)c3ccco3)n2)cc1	751201358	IKLLDOWGNICEDN-UHFFFAOYSA-N	427.417	1.238	50	20	IDGD	
O=C(CCC(=O)N1CCC(c2ccccc2)=N1)NNC(=O)CNC(=O)c1cccs1	751209685	UMTPAMAWZDZWJO-UHFFFAOYSA-N	427.486	1.042	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)ccc1[N+](=O)[O-]	751293247	HWPIIYYXPNYUDZ-UHFFFAOYSA-N	425.401	1.969	50	20	IDGD	
COC(=O)[C@@H](NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1)c1cccc(C#N)c1	751446359	MOMFEGNFMGKPNV-IBGZPJMESA-N	430.486	1.022	50	20	IDGD	
C[C@H](NC(=S)NNC(=O)C1CCN(S(=O)(=O)c2ccc(F)c(F)c2)CC1)C1CC1	751621371	UUQXDJRPFMQEBL-NSHDSACASA-N	446.545	1.659	50	20	IDGD	
CC(C)(C(=O)NNC(=O)NC[C@@H](O)CS(=O)(=O)c1cccs1)c1ccccc1	752171313	SDYIRCWYXZJPAV-CQSZACIVSA-N	425.532	1.191	50	20	IDGD	
O=C(CNC(=O)c1ccccc1C(F)(F)F)NNC(=O)c1cc(Br)c[nH]1	755066498	XNORCIXIQJPXFA-UHFFFAOYSA-N	433.184	1.987	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)Nc1ccc(N2CCOCC2)cc1N1CCOCC1	755456782	ZSLJAWWABMXHND-UHFFFAOYSA-N	428.493	1.165	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NN=Cc3ccc(O)c(F)c3)CC2)cc1	755790948	SEEWJOVBZZITJP-UHFFFAOYSA-N	434.493	1.296	50	20	IDGD	
C[C@H]1CN(C(=O)Cn2cc(NC(=O)NNC(=O)CCc3ccccc3)cn2)C[C@@H](C)O1	756838998	OVCAJMNVFCCAGG-IYBDPMFKSA-N	428.493	1.304	50	20	IDGD	
C[C@@H]1CN(c2nccnc2C#N)CCN1C(=O)NNC(=O)c1cc(Br)c[nH]1	756913362	FKGZJWKOFMNTTL-SNVBAGLBSA-N	433.270	1.004	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc2c(c1)nc(CCC(=O)NN=c1cc[nH]cc1Cl)n2C	757422518	XQVSVQCPPVSODW-UHFFFAOYSA-N	436.925	1.370	50	20	IDGD	
O=C(NNC(=O)c1ccc(Br)cc1-n1cncn1)c1ccc2c(c1)OCCO2	758159638	MLASRJAGPJBLRH-UHFFFAOYSA-N	444.245	1.876	50	20	IDGD	
Cc1cccc(-c2nnc(S)n2CCC(=O)NNC(=O)C(=O)Nc2ccccn2)c1	758840068	SFIYXRGUGWXHMD-UHFFFAOYSA-N	425.474	1.113	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])c(C)c2)nc1	759740063	RYAXZDQEWIDNCV-INIZCTEOSA-N	427.417	1.833	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)c2cc(Br)nn2C)c2ccccc2c1=O	760066344	OBTYELNLZCEOAZ-UHFFFAOYSA-N	433.266	1.548	50	20	IDGD	
Cc1cc(Br)cn2cc(CNC(=O)NN[C@@]3(C)CCS(=O)(=O)C3)nc12	760150117	YMRFQYLDFPVNDD-HNNXBMFYSA-N	430.328	1.286	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)C(=O)Nc1cnccc1-c1ccccc1	760278407	XCBXBTMHDRXFRL-UHFFFAOYSA-N	445.483	1.541	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)Nc1ccc(CN2C(=O)CCCC2=O)cc1	760957306	CHOGTEYTIXIDSY-UHFFFAOYSA-N	448.439	1.841	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)[C@@H]1CCCC[C@H]1C(=O)NNC(=O)c1ncccc1C	762023287	LZACNICUDMZYEO-HZPDHXFCSA-N	438.488	1.122	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)CN2CCN(C(=O)OCc3ccccc3)CC2)n1	762901483	JJRQVWAPHOTFIY-UHFFFAOYSA-N	441.536	1.720	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)C3=NN(c4ccccc4)C(=O)[C@@H](C)N3)n[nH]2)c1	763176363	HFXGRRFXJHDGCE-OAHLLOKOSA-N	445.483	1.793	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)c2ccccc2)cc(OC)c(OC)c1OC	763422572	DYWMNBNNYZXSOV-UHFFFAOYSA-N	445.428	1.289	50	20	IDGD	
CCN(CC)C(=O)COc1ccc(NC(=O)C(=O)NNC(=O)c2cccnc2)cc1Cl	763490815	ALYZYVMXNFOXSM-UHFFFAOYSA-N	447.879	1.382	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccc3ncsc3c2)cc(OC)c1OC	763540114	QYRZRZNDRQXCMK-UHFFFAOYSA-N	430.442	1.722	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)c(Br)c1	763550507	BIIOHLDOOSJSIE-UHFFFAOYSA-N	436.218	1.586	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(O[C@@H]3CCOC3)cc2)cc1OC	763551529	YAOSGGSHLITPQM-MRXNPFEDSA-N	429.429	1.271	50	20	IDGD	
O=C(NNC(=O)c1ccccc1F)C(=O)Nc1ccc(-n2nccn2)cc1C(F)(F)F	763561511	LYAGWUFCUNTODT-UHFFFAOYSA-N	436.325	1.825	50	20	IDGD	
CC(C)(C)c1ccc(OCC(=O)NNC(=O)C(=O)Nc2cnn(-c3ccccn3)c2)cc1	763596286	USKBUIRMWZZFBA-UHFFFAOYSA-N	436.472	1.730	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccccc2OCCC(N)=O)c2ccccc2n1	763618897	HWWCBARXSBLPIB-UHFFFAOYSA-N	435.440	1.197	50	20	IDGD	
CC(=O)Nc1ccc(Cl)c(NC(=O)C(=O)NNC(=O)c2c(C)nc3ccccn23)c1	763623644	DWGFECYNQKGWJI-UHFFFAOYSA-N	428.836	1.654	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(Br)c(C)c2)cc1	763661883	QLNOSMQTTKWEQE-UHFFFAOYSA-N	436.262	1.931	50	20	IDGD	
CC[C@@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2cc(C)ccc2C)cc1	763669630	XQZWNCKQEZSQEQ-MRXNPFEDSA-N	440.500	1.997	50	20	IDGD	
COc1ncnc(N(C)C)c1NC(=O)C(=O)NNC(=O)c1ccc(OCCC(C)C)cc1	763767298	HLHYGSIKXNCKKM-UHFFFAOYSA-N	444.492	1.376	50	20	IDGD	
CC(C)COc1cccc(NC(=O)C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c1	763785125	FXOHUHOXBOYRPH-UHFFFAOYSA-N	437.456	1.368	50	20	IDGD	
Cc1ccc(F)c(NC(=O)C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)c1	763791519	UPYWUSRUAAZDFD-UHFFFAOYSA-N	425.420	1.825	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C)cc2OCC(=O)N(C)C)cc1	763830636	RDXQYWKKVDXPIK-UHFFFAOYSA-N	426.473	1.424	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)N3CCOCC3)cc2C)cc1	763831718	MBFGQZAPNWLVDG-UHFFFAOYSA-N	438.484	1.430	50	20	IDGD	
Cc1ccc(S(C)(=O)=O)cc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1cccc(C)c1C	763848542	IVRJIZBPXYTHRV-HNNXBMFYSA-N	447.513	1.569	50	20	IDGD	
COC(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)c1	763851007	SJJBQFCSJAYADZ-SNVBAGLBSA-N	437.811	1.819	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccc(N2CCSCC2)cc1	763864679	FLCPTXDBTOAHKG-CQSZACIVSA-N	446.504	1.932	50	20	IDGD	
CCOc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NNC(=O)Cc1ccc(Cl)cc1	763936400	JNAMTUAELPBGPH-UHFFFAOYSA-N	446.891	1.769	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)C(=O)Nc1cccnc1Br	763995177	NUJSCFGKUSXWBC-UHFFFAOYSA-N	431.044	1.334	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2cccn2C)cc(OC)c1Br	763995389	HOSQPWZXEGZQRW-UHFFFAOYSA-N	425.239	1.205	50	20	IDGD	
COC(=O)c1cc(Cl)cc(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)c1	763996052	UCZVMDOLWZURBI-UHFFFAOYSA-N	443.641	1.617	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1c(C)c(C)nn1-c1ccc(C#N)cc1	764042096	APEDAEDRBHHVSC-UHFFFAOYSA-N	432.440	1.769	50	20	IDGD	
CC[C@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(S(=O)(=O)N(C)Cc2ccccc2)cc1	764080955	ASIRNPUWHQRIDZ-HNNXBMFYSA-N	446.529	1.639	50	20	IDGD	
CC[C@@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(S(=O)(=O)NC2=NCCCCC2)cc1	764081870	KGUMXXLCBIYLDU-CYBMUJFWSA-N	437.522	1.069	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cc(F)c(F)cc2I)n[nH]1	764106782	SHJDHFXBUUIVBM-UHFFFAOYSA-N	449.155	1.001	50	20	IDGD	
O=C(CCOc1ccccc1)NNC(=O)C(=O)Nc1cc2c(cc1[N+](=O)[O-])OCCCO2	764160901	KWMZJXVQVSAXJE-UHFFFAOYSA-N	444.400	1.311	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)C(=O)Nc1ccc(NC(=O)[C@H]2CCCO2)cc1	764242520	VGLZQWDCGDTUKK-LJQANCHMSA-N	449.467	1.545	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1ccc(Br)c(Cl)c1	764275713	RKGPVEIMZZNUAB-UHFFFAOYSA-N	442.653	1.973	50	20	IDGD	
CCCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)cc1	764394576	RVYAAJOUVPGFST-UHFFFAOYSA-N	430.486	1.410	50	20	IDGD	
COCc1ccc(C=NNC(=O)CN2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)o1	764819334	RJRYDIHZFFMSMC-UHFFFAOYSA-N	434.518	1.191	50	20	IDGD	
C[C@](O)(CNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)c1cccc(Cl)c1	765243456	JZGANENRVIFGMY-FQEVSTJZSA-N	432.912	1.585	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)Nc1nc(CS(C)(=O)=O)no1	765247268	PURMGMQXPGHZBK-LLVKDONJSA-N	433.446	1.388	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)CCNC(=O)OC(C)(C)C)n[nH]2)cc1OC	765600616	SENFCJPIFASGDC-UHFFFAOYSA-N	433.465	1.770	50	20	IDGD	
CCNS(=O)(=O)c1ccc(CNC(=O)NNc2ccccc2S(C)(=O)=O)cc1	765836154	VJACBIYILDVYDK-UHFFFAOYSA-N	426.520	1.215	50	20	IDGD	
O=C(NNc1cnc2ccccc2n1)c1cc(S(=O)(=O)N2CCOCC2)ccc1F	765990987	UEXOSFODRXANBM-UHFFFAOYSA-N	431.449	1.547	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)[C@@H]2C[C@H]2c2cc(F)c(F)c(F)c2)ccc1Cl	766634549	ZHYOATVGTUWBJI-VHSXEESVSA-N	447.822	1.969	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)CN1CCN(C(=O)Cc2ccccc2F)CC1	766860785	TUBRNMPDMBZALD-UHFFFAOYSA-N	426.492	1.211	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)[C@H]1CCCN1C(=O)OCC(F)(F)F	767328496	GOJXNLHDDWRHFI-CQSZACIVSA-N	445.394	1.391	50	20	IDGD	
CCOc1ccc(NC(=S)NNC(=O)c2nccc3c(S(N)(=O)=O)cccc23)cc1	768459953	IMVXTUFKPKTAIZ-UHFFFAOYSA-N	445.526	1.912	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)c1cc(NC(=O)OCC(F)(F)F)ccc1O	769749829	ZIVMAGVCTREJKI-UHFFFAOYSA-N	444.322	1.287	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)NC(C(N)=O)C(N)=O)c(C)n1-c1cccc(Cl)c1Cl	769757365	WBPAVRKAWYCVJJ-KPKJPENVSA-N	434.283	1.763	50	20	IDGD	
O=C(NNc1ccc(Cl)nn1)Nc1ccc(Cl)c(S(=O)(=O)N2CCOCC2)c1	769922482	DIGUARCNTNOYDE-UHFFFAOYSA-N	447.304	1.953	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)[C@@H](NC(=O)c1cc(Cl)ccc1F)[C@@H](C)O	772041361	KHYIRDWGKQVKEO-GDLVEWKHSA-N	445.875	1.084	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)C1=NN(c2ccccc2)[C@H](C(=O)OC(C)(C)C)C1	772086100	ADIBSUMHCGKPEM-BBRMVZONSA-N	432.477	1.452	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCC(C)(C)CCCO)c1	772621030	XQWKSMVBYLXPLJ-UHFFFAOYSA-N	428.555	1.460	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)CCC(=O)N3CC2CC2)cc1	773495908	HAVBFRVVIKHUSQ-UHFFFAOYSA-N	431.452	1.647	50	20	IDGD	
O=C(NNC(=O)c1cnccn1)C(=O)Nc1ccc(OCC(F)F)c(C(F)(F)F)c1	773530728	CGDPHFJKXQSOHC-UHFFFAOYSA-N	433.293	1.539	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)C(=O)NNc1c(F)cccc1F	773710248	ZTKDEQTXOGEIQO-UHFFFAOYSA-N	442.444	1.696	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccc([S@@](C)=O)c(F)c1	774010418	VJMPZNBCXLBBLN-XGCHSQQGSA-N	441.868	1.770	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCc2ccc(OC(F)F)cn2)nc1	775218497	DFQOZJALFJJSPK-UHFFFAOYSA-N	430.437	1.591	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)Nc2ccc(C[C@@H]3NC(=O)NC3=O)cc2)o1	775709137	RQPQRDUTKWUEAH-INIZCTEOSA-N	442.476	1.338	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)N[C@H]3CCO[C@]4(CCS(=O)(=O)C4)C3)cc2C1	776077003	PQUUKQWCLUREND-SPKLELGKSA-N	441.575	1.553	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)NC2CCN(CC(=O)Nc3ccccc3)CC2)c1	776611345	YOAKTBDHSDCTKK-UHFFFAOYSA-N	445.545	1.819	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)[C@]12CCC(=O)N1c1cc(Cl)ccc1S2	778445909	WGKDFNYJLJQEAY-GOSISDBHSA-N	440.909	1.941	50	20	IDGD	
CCNC(=O)N(C)NC(=O)c1cc(S(=O)(=O)N(CC)CC)ccc1NCCOC	780707903	CCTYBXBJBQMWOA-UHFFFAOYSA-N	429.543	1.082	50	20	IDGD	
O=C(NN=c1cc[nH]cc1)C1CCN(S(=O)(=O)c2ccc3c(c2)OCCCO3)CC1	780761834	FQINANXGLWUTPS-UHFFFAOYSA-N	432.502	1.209	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NN=Cc1ncccc1C)N(S(C)(=O)=O)CC2	781587657	QWNDTLPUSXLRNA-GOSISDBHSA-N	446.529	1.806	50	20	IDGD	
O=C(CSc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1ccc(OC2COC2)cc1	782120188	GJZCOUVURWNLSA-UHFFFAOYSA-N	435.889	1.996	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(CNC(=O)NNC(=O)c2cccc3ncccc23)c1	782536473	QDTUAOKUDZIVFJ-UHFFFAOYSA-N	427.486	1.629	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)c2cccc(NS(=O)(=O)C(F)(F)F)c2)cn1	782549985	WORXVXPHYPLMDY-UHFFFAOYSA-N	449.436	1.983	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H](NC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)C1	782645836	AIMQPHQJFNZBAH-CPUCHLNUSA-N	434.493	1.993	50	20	IDGD	
CN1CCCN(S(=O)(=O)c2cccc(NC(=O)C(=O)NNc3ccccc3F)c2)CC1	782705576	GXAMSZHDMGFRRP-UHFFFAOYSA-N	449.508	1.234	50	20	IDGD	
CS(=O)(=O)CCn1ccc(NC(=O)C(=O)NN(Cc2ccccc2)c2ccccc2)n1	782824928	IXYWKJXPLYQNBR-UHFFFAOYSA-N	441.513	1.604	50	20	IDGD	
CC(C)(C)NS(=O)(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(O)cc2)c1	782832571	OXWDEJHQOYDAOO-UHFFFAOYSA-N	448.501	1.010	50	20	IDGD	
CNS(=O)(=O)c1ccc(C)c(NC(=O)C(=O)NNc2ccc(Cl)cc2[N+](=O)[O-])c1	783290493	AORUXTJXSQMVNM-UHFFFAOYSA-N	441.853	1.547	50	20	IDGD	
O=C(NNc1ccc(Cl)cc1)C(=O)Nc1cc(C2CC2)nn1[C@H]1CCS(=O)(=O)C1	783340396	SMFFGNZQGHVKRD-AWEZNQCLSA-N	437.909	1.855	50	20	IDGD	
COc1cc(C=NNC(=O)C2CCN(c3ncccn3)CC2)ccc1OCCC(=O)O	783844947	BZRHITKVWFFNIB-UHFFFAOYSA-N	427.461	1.705	50	20	IDGD	
CCOC(=O)c1ccn(-c2ccccc2NC(=O)C(=O)NNc2nccnc2Cl)n1	784776240	HDKKLWWINJHMLC-UHFFFAOYSA-N	429.824	1.574	50	20	IDGD	
CCCS(=O)(=O)Nc1cccc(NC(=O)C(=O)NNc2nccnc2Cl)c1C	784776383	HYUKPUMEKWWTGI-UHFFFAOYSA-N	426.886	1.672	50	20	IDGD	
O=C(NNc1ccc(Cl)nn1)C(=O)Nc1ccc(CC(=O)N2CCSCC2)cc1	784786077	DCZKKKVAQVEJHY-UHFFFAOYSA-N	434.909	1.330	50	20	IDGD	
Cc1ccc(C(=O)N2CCOCC2)cc1NC(=O)C(=O)NNc1ccc(F)c(F)c1F	784806564	IRZBQUCYCRNMLN-UHFFFAOYSA-N	436.390	1.967	50	20	IDGD	
CC[C@@H](C)NS(=O)(=O)c1cccc(NC(=O)C(=O)NNc2ncccc2Cl)c1	784818474	YGTBUQXYZMWVNQ-LLVKDONJSA-N	425.898	1.894	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ccc(C(F)(F)F)nn2)c(OCC(=O)N(C)C)c1	784886315	NZFCHXJHFZZIJY-UHFFFAOYSA-N	440.382	1.353	50	20	IDGD	
C[S@](=O)c1cccc(NC(=O)C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)c1	785109748	XMSFGPOJZRONTE-PMERELPUSA-N	436.440	1.676	50	20	IDGD	
NC(=O)CC[C@H](NS(=O)(=O)c1ccccc1C(F)(F)F)C(=O)NNc1ccccc1	785840076	KFRQZNFVIBZGST-AWEZNQCLSA-N	444.435	1.761	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)[C@H]1CCN(C(=O)OC(C)(C)C)[C@H]1C	786378917	SCVOPAABNNDCFE-RDJZCZTQSA-N	433.505	1.874	50	20	IDGD	
Cc1nn(-c2ccccc2)c(C)c1C(=O)C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	789067403	UNKOJMODGDWMAS-UHFFFAOYSA-N	430.428	1.109	50	20	IDGD	
O=C(NC[C@@H](Cc1cccc(F)c1)C(=O)N1CCOCC1)NNc1cncc(Cl)n1	789308254	BSQBLOPOVPGIIG-CQSZACIVSA-N	436.875	1.613	50	20	IDGD	
O=C(NNC(=O)c1cc2c(s1)CCC2)c1ccc2c(c1)SC1=NS(=O)(=O)CCN12	789744239	PMQDPJVSBGQCIH-UHFFFAOYSA-N	448.551	1.923	50	20	IDGD	
O=C(NNC(=O)[C@H]1OCC[C@H]1c1ccccc1)C(=O)Nc1ccc(Br)cn1	789812723	MZUWOKXSRVSGCY-ZFWWWQNUSA-N	433.262	1.503	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)c2nnn(Cc3ccc(F)cc3F)c2C)c1	791665684	URBJKXRMHUWZKO-UHFFFAOYSA-N	443.410	1.839	50	20	IDGD	
CCOC(=O)c1csc([C@H]2CCCN2CC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)n1	792470853	MGJLJBLIYMYCQK-OAHLLOKOSA-N	447.473	1.826	50	20	IDGD	
CC(C)Oc1ccc(NC(=O)C(=O)NNC(=O)COc2cccc(C(F)(F)F)c2)nn1	793023742	VNCOVGRRCPBLII-UHFFFAOYSA-N	441.366	1.448	50	20	IDGD	
O=C(Cc1ccsc1)NNC(=O)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1	793024240	CJRCQOXXHMDULW-UHFFFAOYSA-N	427.236	1.747	50	20	IDGD	
CCNC(=O)N(C)c1cccc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c1	797005197	AIGUUFRFQKMEQH-UHFFFAOYSA-N	449.471	1.438	50	20	IDGD	
NS(=O)(=O)[C@H]1CCCN(C(=O)NNC(=O)c2ccc(Br)cc2Cl)C1	799916130	IJZJMYOSHDIENC-VIFPVBQESA-N	439.719	1.210	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@](C)(O)CCc2ccccc2)c1	801102151	DLWHSMBQWGIJNM-JOCHJYFZSA-N	447.557	1.862	50	20	IDGD	
COC(=O)N(C)NC(=O)/C(C#N)=C\c1cn(CCC(N)=O)nc1-c1ccc(OC)cc1	804124302	LNYWWXYTWKOVPK-UVTDQMKNSA-N	426.433	1.070	50	20	IDGD	
O=C(NCc1csc(CNC(=O)c2ccccc2)n1)NNc1ccc(-n2ccnc2)nn1	805173421	JKROTOKCGQHAMU-UHFFFAOYSA-N	449.500	1.875	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(F)c(N3CCOCC3)cc2F)cc1	806974655	QOKRIVUYBMFYDG-UHFFFAOYSA-N	432.427	1.764	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2nc(C3CC3)cs2)n[nH]1	806978562	ANCDAGUFQWUGLN-UHFFFAOYSA-N	426.458	1.819	50	20	IDGD	
CC(=O)c1cc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)ccc1F	807005361	DMOHMUPBGQTXGW-UHFFFAOYSA-N	434.449	1.551	50	20	IDGD	
CC(C)[C@@H](NC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)c1nncn1C	807431308	DBIHRPLEAKIYBD-LJQANCHMSA-N	428.541	1.055	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NCc2cnn3ccccc23)c2ccccc2c1=O	807462891	ADAHNUZDTYDCBF-UHFFFAOYSA-N	433.472	1.989	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)CNC(=O)c1ccco1)c1ccc(N2CCCCC2=O)cc1	811872262	LPRGUSAZQIJYCR-CQSZACIVSA-N	427.461	1.618	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@H]2CCN(c3ccccc3F)C2)c1	812923261	ANYSAIRHMXRBIP-CQSZACIVSA-N	434.493	1.700	50	20	IDGD	
CC(=NNC(=O)Cc1cc(O)nc(O)n1)c1nnn(-c2cccc(Br)c2)c1C	814861108	ZJXMVAUKZBARLO-UHFFFAOYSA-N	446.265	1.622	50	20	IDGD	
Cc1c(COc2ccccc2)cccc1NC(=O)C(=O)NNC(=O)[C@@H]1CCc2nncn2C1	815692247	NBUHYXGQFDRLGP-MRXNPFEDSA-N	448.483	1.514	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCc2nncn2C1)C(=O)Nc1ccc(Cl)cc1Br	815692580	VIUGERMTAMQNEI-MRVPVSSYSA-N	441.673	1.043	50	20	IDGD	
COC(=O)c1c(Br)ccc(NC(=O)C(=O)NNc2ncncc2F)c1C	815764917	ZBGDDAKIDLHHEM-UHFFFAOYSA-N	426.202	1.555	50	20	IDGD	
Cc1ccc(C(=O)NCCC(=O)NNC(=O)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)c(O)c1	819657676	FVKNIWXFYWUKKV-OAHLLOKOSA-N	448.520	1.615	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)CN2C(=O)N[C@]3(C[C@@H](C)CC(C)(C)C3)C2=O)c1	825776106	BPDGPNWRCXRVKE-FPTDNZKUSA-N	445.520	1.391	50	20	IDGD	
C[C@H]1Cc2ccccc2N1S(=O)(=O)c1ccc(F)c(C(=O)N2CC[C@H](B(O)O)C2)c1	864231254	LIZAEPOVCVTZGC-ZFWWWQNUSA-N	432.282	1.655	50	20	IDGD	
Cc1ccc(C(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)cc1NS(C)(=O)=O	907575025	NJZQOMTXNXVIPU-UHFFFAOYSA-N	439.877	1.638	50	20	IDGD	
NS(=O)(=O)c1ccc(Br)c(C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c1	912765001	XOKJUMQCMOFQPY-UHFFFAOYSA-N	443.235	1.080	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)[C@@H]1CC(=O)N(c2ccc(F)c([N+](=O)[O-])c2)C1	913123290	GNMSVFPBOFDIRZ-VXGBXAGGSA-N	448.382	1.841	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)CNS(=O)(=O)c2ccc(Cl)cc2)c1	913534549	ZTOZRWDFAWSMSF-UHFFFAOYSA-N	427.866	1.097	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NN=C1CCOc2ccccc21	915915334	ZTWDPPFJSQUVIY-UHFFFAOYSA-N	443.525	1.943	50	20	IDGD	
CSCC[C@H](NC(=O)NNC(=O)COc1ccc(C#N)cc1)c1nnc2ccccn12	916224036	UHEYQHKUTNIEHB-INIZCTEOSA-N	439.501	1.805	50	20	IDGD	
O=C(NCc1ccccc1S(=O)(=O)N1CCCCC1)NNC(=O)c1ccccc1O	916241273	QMYSMUUVZBVPMA-UHFFFAOYSA-N	432.502	1.711	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCCc2cn3ccccc3n2)nc1	916247300	OELJLZUOGCIKDD-UHFFFAOYSA-N	431.522	1.629	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)C[C@H]2Oc3ccccc3NC2=O)c2ccccc2c1=O	916854751	NWAXFSGXUOZOTN-QGZVFWFLSA-N	435.440	1.357	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)c2ccc(Cl)nc2)cc1S(=O)(=O)N1CCOCC1	917249073	ORAULZCHORWUKL-UHFFFAOYSA-N	438.893	1.139	50	20	IDGD	
COc1cc(N2C[C@H](C(=O)NNC(=O)c3ccc(C)cc3O)CC2=O)cc(OC)c1OC	918339393	NDLAKDCRCKUYSF-CYBMUJFWSA-N	443.456	1.541	50	20	IDGD	
CC(=O)N[C@H](C)c1ccc(S(=O)(=O)NNC(=O)[C@H]2COc3ccccc3O2)s1	918399386	NCLYMILKPVVYKB-QMTHXVAHSA-N	425.488	1.095	50	20	IDGD	
C[C@H](C(=O)N(C)CC(=O)NNC(=O)COc1ccccc1-c1ccccc1)n1cccn1	918690242	RHYNPNJBAPZNTN-QGZVFWFLSA-N	435.484	1.796	50	20	IDGD	
O=C(NCC(F)(F)F)NNC(=O)[C@H]1CC(=O)N(Cc2cccc(C(F)(F)F)c2)C1	918707810	GRIQKPBSEWWCCK-JTQLQIEISA-N	426.317	1.947	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)CN1C(=O)COc2cc(Br)ccc21	919822194	FZABZMIBEDHBHT-UHFFFAOYSA-N	448.273	1.573	50	20	IDGD	
Cc1csc([C@](O)(CC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)C(F)(F)F)n1	920253352	BIYWQNNULPWPOG-BLLLJJGKSA-N	431.392	1.579	50	20	IDGD	
Cc1cc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)CN3CCCC3=O)cc2)ccc1F	920827290	SIMLLADWFIZQSP-UHFFFAOYSA-N	448.476	1.318	50	20	IDGD	
CCNC(=O)[C@H](C)NC(=O)/C(C#N)=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	920848996	KULSCEZKQJYSQZ-LERPTODRSA-N	442.907	1.627	50	20	IDGD	
CC(=NNC(=O)c1n[nH]c2c1CCCC2)c1ccc(S(=O)(=O)N2CCNCC2)cc1	1115832908	BKULPSHJFWFFNQ-UHFFFAOYSA-N	430.534	1.036	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCC(=O)NNC(=O)CSc2ccc(C)cc2)cc1	1317718219	NGHQEQNAIHJGEA-UHFFFAOYSA-N	437.543	1.612	50	20	IDGD	
CS(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2ccc(Br)cc2)cc1	1318007843	NXITVCCBSSRJLZ-UHFFFAOYSA-N	426.292	1.997	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(Cl)s1)NNC(=O)c1cncn1-c1ccccc1	1318114824	JFKZZNQCTUDSLR-UHFFFAOYSA-N	439.906	1.327	50	20	IDGD	
CC(=O)NC[C@@H]1CCn2ncc(C(=O)NNc3c(F)cc(C(=O)NC4CC4)cc3F)c2C1	1320856173	RETKCPRMQZMDLM-GFCCVEGCSA-N	446.458	1.509	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(I)cc1)c1n[nH]c2c1CCCC2	1321558604	MJLBEVQDOZYIKL-UHFFFAOYSA-N	446.270	1.516	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)NC1CCN(Cc2ccccn2)CC1	1326435156	ZXDYTLHOCUNUOH-UHFFFAOYSA-N	438.536	1.083	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)COC(C)C)C2	1778091445	FLLWOSWWYJGZRU-UPRBLEQPSA-N	447.536	1.059	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@]2(C1)CN(C(=O)C[C@@H]1COc3ccccc3O1)CCO2	1779293811	CYPIJEFPGCJKLS-VGOFRKELSA-N	448.592	1.898	50	20	IDGD	
C[C@@H](NC(=O)c1ccccc1)C(=O)N1CCO[C@@]2(CCN(C(=O)CO[Si](C)(C)C)C2)C1	1779300145	PAINNTMJMFTSQR-VGOFRKELSA-N	447.608	1.486	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1cccnc1)C2)[C@H](F)Br	1780773172	FJDPMAGYSRHYIS-UWWQBHOKSA-N	428.302	1.829	50	20	IDGD	
C[C@H](C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@](C)(Cl)CCl)C2)C1)n1cccc1C=O	1781226831	AUOUNAMQYWYSGU-CCKFTAQKSA-N	430.332	1.928	50	20	IDGD	
COc1cnc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)c(F)c1	1781227557	BGRYJPDQWPIWRY-ROUUACIJSA-N	434.295	1.909	50	20	IDGD	
COc1ncccc1CCC(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781326268	MOQRJSNQVRSGRJ-QAPCUYQASA-N	444.301	1.543	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)n1cncn1)C2	1781904501	YLHUJKAPRMSEMU-LUXYFRNMSA-N	442.358	1.527	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc[nH]c3nccc1-3)C2	1782173176	ZIZGVGHXWJLBEP-CBGDNZLLSA-N	434.924	1.896	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](Cl)COC)C1	1782179251	ITSHFACOWAGDED-SZOQZIPDSA-N	439.778	1.928	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc3nccn13)C2	1782179984	ZNAQKTFBGDSGDI-LUQKVYGDSA-N	434.924	1.716	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)nc2nccn12	1782355043	PPBLMEXXNUZODT-DYVFJYSZSA-N	440.273	1.172	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2	1783102712	CWLTVGPWKXSYJB-BXTJHSDWSA-N	447.960	1.015	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)CCN3CCCCC3)CCO2)C1	1783343640	WESLGHGQZXKRNU-APWZRJJASA-N	430.387	1.866	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cccn4nccc34)CCO2)C1	1783351815	DIAMHSHHOZOYOR-DNVCBOLYSA-N	435.322	1.951	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2	1783399946	LYZMPVTTXKCZII-ROUUACIJSA-N	438.352	1.577	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H]3CCCO3)C2)C1	1783491112	PQWLMURGAZLKDH-ZMMSGNDHSA-N	431.439	1.881	50	20	IDGD	
C[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CC[C@]2(CN(C(=O)[C@H](F)Cl)CCO2)C1	1783508693	CKGKNFPXTDAYCS-PTSWNOGYSA-N	441.887	1.666	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cnc4ccc(F)cn34)CCO2)C1	1783538127	WICAOVNFNRYZBY-SGTLLEGYSA-N	439.285	1.700	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)[C@@H]3CCCN3Cc3ccccc3)CCO2)C1	1783878622	IFYRHFSONWTVSQ-QTEQDKRBSA-N	449.979	1.735	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(-c4cc[nH]n4)cc3)CCO2)C1	1783882080	VBYHGKFNDVBFER-LAUBAEHRSA-N	432.908	1.774	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](C)Oc3cccnc3)C2)C1	1784549532	WVAZZYLVRNZGNC-URLQWDBASA-N	440.338	1.852	50	20	IDGD	
CC(C)N1CCC(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCBr)C[C@@H]32)CC1	1784993127	RWJNJAAMFKEGIV-BZSNNMDCSA-N	444.414	1.872	50	20	IDGD	
CC(C)c1nc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Br)C[C@@H]32)no1	1785210964	JLJIUVGJSZWHKH-JUFZMCDQSA-N	447.305	1.406	50	20	IDGD	
CC(=O)c1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]32)n[nH]1	1785840081	FYVXXTPFGCGHRD-LLXPTAGJSA-N	431.320	1.442	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnn4ccncc34)[C@H]2C1	1788033189	OBZJHXPRBWPZPK-BCRCDCHUSA-N	440.331	1.559	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnncc3C(=O)O)[C@H]2C1	1788889518	UMVREKCTFHEDKK-CQDXQUMASA-N	445.303	1.004	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc4c3OCC4)C[C@@H]21)[C@@H](F)Br	1789922756	MCCAMLIJAHONLA-NZUILWFCSA-N	441.297	1.905	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCSC)C[C@@H]21	1790964492	YLLBLGQSWDHSBX-YTFOTSKYSA-N	437.400	1.254	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4cccnn4n3)C[C@@H]21	1791059398	YXOJCTYYMZXKLK-DSPQJCBJSA-N	436.310	1.106	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(NC(C)=O)o3)C[C@@H]21	1791255312	LEGXZJOMYBKCMD-AYDFFVQHSA-N	427.885	1.085	50	20	IDGD	
C[C@@H](Oc1ccccn1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21	1791622100	UDWGKJCIKDFZDF-XSEXMBABSA-N	444.301	1.519	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccnc1S	1792499968	USGQKXSHACIULD-FMSGJZPZSA-N	428.352	1.605	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](F)Cl)C3)[C@@H](O)C1	1792516649	JWFNZGAILSNMQH-PLZKBRGSSA-N	447.935	1.777	50	20	IDGD	
COc1cc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Cl)C3)cc(OC)c1OC	1793659982	GGDJYNYANSFYGW-JBYDNAENSA-N	444.887	1.379	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1c(F)c(C)nn1C	1794828826	JAHAVGBOKPWUEL-JWBKOJIWSA-N	443.483	1.253	50	20	IDGD	
CN1CCCn2nc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)CCBr)cc2C1	1795494837	HRZZVYSFKPNMSG-QDMKHBRRSA-N	438.370	1.755	50	20	IDGD	
CC(C)(C)OC(=O)NC12CC(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@@H](F)Cl)(C1)C2	1796370461	KMZSDSIZPYVGKG-HOXVMPQISA-N	445.919	1.558	50	20	IDGD	
O=C1CCc2ccc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)[C@@H](F)Br)C4)nc2N1	1796568428	LKKYONQKHKEENN-NWJSVONSSA-N	439.285	1.909	50	20	IDGD	
COc1cscc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)CBr)C2	1796679595	JEMAJFMEYWXVOW-OHTBPHCPSA-N	431.352	1.991	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cc1ccc(O)cn1)C2	1796892971	CVBSPCYBSWHCPU-FWKYCFCSSA-N	438.488	1.102	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(OC)c(O)cc1[N+](=O)[O-]	1798595133	OFKTYTJYHPBLNN-QTFJUKGGSA-N	441.868	1.530	50	20	IDGD	
CC1=NN(c2ccc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)[C@H](O)CCl)C4)cc2)C(=O)C1	1799728087	ACBZHBVKNUJIOD-BZZMCLGOSA-N	432.908	1.651	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cn2c(F)cccc2n1	1800001616	SBZICIWVHNUNAM-OVZMXSCWSA-N	439.285	1.460	50	20	IDGD	
C[C@H](N[C@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)C1CC1)c1ccccc1	1800345251	NHUAUWRNDYDHOH-UYOAKOKDSA-N	449.979	1.305	50	20	IDGD	
CCOc1ncccc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](Br)CC	1800637693	GCKWFABDBGUNSR-OCVGTWLNSA-N	440.338	1.857	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cn1cnc3ccccc31)C2	1800763035	MVAZTQPQRPXOTL-FLTUCWPJSA-N	435.322	1.409	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1c[nH]c3ncccc13)C2	1800764161	XLCSWIAWNCBJOK-FRQROOTJSA-N	449.349	1.869	50	20	IDGD	
Cc1cccc2c(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)c3cccc(B(O)O)c3)C4)n[nH]c12	1801123212	MJFBBQIKEZEXDV-BCDXTJNWSA-N	432.289	1.117	50	20	IDGD	
CN[C@H](CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C(C#N)=C/c1ccc(F)cc1F)C(=O)O	1801437104	HKHAPDLZCXUZST-RWOGOPBDSA-N	446.454	1.573	50	20	IDGD	
C=CCNC(=O)/C=C\C(=O)NC[C@H]1CCN(C(=O)C(Cl)Cl)[C@@H]1c1cccnc1	1802497431	HNMTWEOMLIFMFN-DETOXJSWSA-N	425.316	1.750	50	20	IDGD	
C=CCC(CC=C)C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1803081769	HJZHPZSUJCLHPL-GGAORHGYSA-N	447.344	1.849	50	20	IDGD	
O=C(Cc1cnccn1)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@@H]1c1cccnc1	1803301012	BDIPSONZOHJQQX-XKQJLSEDSA-N	436.285	1.811	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)C[C@H]2NC(=O)NC2=O)[C@H]1c1cccnc1	1803686587	QKIZQMKYTHXWPW-MPTYRVRUSA-N	435.912	1.093	50	20	IDGD	
COCCOCC(=O)NC[C@@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1	1806757873	VYXWCLWYDNAODL-YJBOKZPZSA-N	428.327	1.535	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)[C@@H](N)c2ccccn2)[C@H]1c1cccnc1	1807166007	AELKPBNZCDAEBU-KCITZHQASA-N	431.924	1.436	50	20	IDGD	
CC(=O)N(C)CCC(=O)N1CC[C@H](CNC(=O)[C@H](F)Br)[C@H]1c1cccnc1	1808652589	YRQPMXWBLJGCBO-OIISXLGYSA-N	443.317	1.646	50	20	IDGD	
Cn1ncc2cc(C(=O)NC[C@@H]3CCN(C(=O)[C@H](O)CCl)[C@H]3c3cccnc3)ccc21	1809419063	DYDUOBLVCLBQAE-DBVUQKKJSA-N	441.919	1.888	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)c3cc4cccn4cn3)CC2)C1	1809972485	PQLAVSYUVAEDNJ-UHFFFAOYSA-N	446.316	1.173	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)on1	1810300388	YDGHUJCXMYBISS-HNAYVOBHSA-N	449.471	1.010	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)[C@H]2CC[C@H](O)CC2)[C@H]1c1cccnc1	1813189925	BKAAIJPPXKEIDI-JLEJFLCFSA-N	445.564	1.012	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](C)CS(C)(=O)=O)n[nH]1	1815232012	DCUQULVAKBSYJL-SGMGOOAPSA-N	434.946	1.336	50	20	IDGD	
C[C@H](C(=O)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1)n1cccc1	1815361998	XVJPOLXYAUPWMZ-CJNGLKHVSA-N	438.318	1.111	50	20	IDGD	
C[C@H](C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1)N1C[C@H]2C[C@H]2C1	1819294817	ATQZLTZFXGGNLT-XLMAVXFVSA-N	445.568	1.115	50	20	IDGD	
Cc1n[nH]c(C)c1C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1	1819666901	GMLCKWBEKAQUFK-OAHLLOKOSA-N	430.513	1.429	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)C#Cc2ccccc2)[nH]n1	1822412975	MERCYLYDZRUQRC-LJQANCHMSA-N	436.516	1.827	50	20	IDGD	
CC(C)c1cc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)n[nH]1	1822414978	PUFKURGJDWSVKZ-QGZVFWFLSA-N	444.540	1.935	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CSCC(=O)OC)CC1	1824518131	YUAUGSTVICPFEE-CVEARBPZSA-N	434.986	1.766	50	20	IDGD	
O=C(CN1CCCCC1=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](F)Br)CC2	1825865737	MXFZJMGTZYNKSU-XPTSAGLGSA-N	447.330	1.758	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](C)Cn3ccnc3)sc2C1	1826833523	AWHDUFZMHXVTMI-UPJWGTAASA-N	425.942	1.842	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccnnc2)CC1	1828925641	OBHQIZBAMCKIPQ-IBGZPJMESA-N	437.504	1.022	50	20	IDGD	
CC(C)(C)NCC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1	1828926967	VFLGYKIIFXNTQF-IBGZPJMESA-N	444.580	1.307	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(C)c(Cl)c3)CCO2)C1	1830114842	KUBJIJKHOLIKCO-PXNSSMCTSA-N	445.343	1.972	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(=O)n3[nH]nnc3n2)CC1	1830306472	LNPOQWDVHPQSBW-UKRRQHHQSA-N	435.916	1.063	50	20	IDGD	
CSCC(C)(C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)Br)C2)C1	1831539533	RMIBGYXSVBOGLG-DYVFJYSZSA-N	437.400	1.615	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4nncn4c3)C2)C1	1831652305	YJYACENKIMVCGP-OXJNMPFZSA-N	435.912	1.207	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CCN2C(=O)C=CC2=O)CC1	1831829060	XFBLESCABJXXRJ-SJORKVTESA-N	439.940	1.175	50	20	IDGD	
CCNC(=S)NCC(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](Cl)COC)CC1	1831834751	HMLGGPPIPFYRGB-HOTGVXAUSA-N	433.018	1.344	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(CO)o2)CC1	1831873398	IUVPBTSEDYCXLI-GOSISDBHSA-N	434.537	1.378	50	20	IDGD	
Cc1ccc(CC(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)o1	1832331797	VTRRQIHNBFWMDK-QFIPXVFZSA-N	438.333	1.744	50	20	IDGD	
CC[C@H](NC(C)=O)C(=O)NC1CCN(C2CCN(C(=O)[C@@](C)(Cl)CCl)CC2)CC1	1833096775	CVBZVVMOHVBCBC-PXNSSMCTSA-N	449.423	1.709	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3ccccn3)CCO2)C1	1833190555	NHARPXKSFMTHGG-HNAYVOBHSA-N	440.338	1.254	50	20	IDGD	
CC(C)(CCl)C(=O)NC1CCN(C2CCN(C(=O)CCN3CCOC3=O)CC2)CC1	1833214427	AITHCIVGCONYGO-UHFFFAOYSA-N	442.988	1.665	50	20	IDGD	
Cc1cc(C(=O)N2CCC(N3CCC(NC(=O)[C@H](C)CBr)CC3)CC2)n[nH]1	1833262936	BLDONYXLXASPPT-CYBMUJFWSA-N	440.386	1.934	50	20	IDGD	
CC[C@H](C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)CCl)CC2)CC1)N(CC)CC	1833306714	ZJUSSVHBCZQISA-RTBURBONSA-N	431.021	1.278	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)C1CCC(F)(F)CC1	1833381856	FNFKZHLAQGXGQA-QGZVFWFLSA-N	435.943	1.983	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)C(=O)c3ccccc3)CCO2)C1	1834708243	YECZLQSKORPZLH-IFXJQAMLSA-N	439.306	1.109	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3ccnn3CCOC)CC2)CC1	1835181473	XRMWGEIBILEUSO-SFHVURJKSA-N	439.988	1.732	50	20	IDGD	
O=C(c1ccc2cccnc2n1)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1836834350	LGCKIUSISAPTNP-LJQANCHMSA-N	439.299	1.504	50	20	IDGD	
C[C@@H](CC(N)=O)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](C)Br)CC2)CC1	1836911895	DGNPGIAQVOOUHD-QWHCGFSZSA-N	432.359	1.280	50	20	IDGD	
C=C[C@H](O)C(C)(C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](Br)CC)C2)C1	1837403396	SIFBBNPXLGWOKL-YZVOILCLSA-N	447.370	1.189	50	20	IDGD	
CC(C)n1nccc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)Br)C2)C1	1838024779	OOVMMMIFCKCYET-KDOFPFPSSA-N	443.342	1.317	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3nnc(-c4ccccc4)o3)C2)C1	1839146229	WVERXWSYUABJNF-HRAATJIYSA-N	448.907	1.824	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnn4cccc(C)c34)C2)C1	1839148515	ZOUBMLLOAURIOA-UTKZUKDTSA-N	434.924	1.730	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)C[C@@H]3CCCCO3)C2)C1	1839150190	FGZOJCTUIMEQHK-SNRMKQJTSA-N	437.364	1.638	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)cn1	1839151327	NVSOXJSBHTZBBP-RTBURBONSA-N	430.332	1.696	50	20	IDGD	
C[C@@H](Cc1ccncc1)C(=O)N1CCO[C@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1	1839659609	QNGLOUSQUFRLLR-AVRDEDQJSA-N	449.624	1.568	50	20	IDGD	
O=C(Cc1ccc2c(c1)CCO2)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1839998432	VQSKNRZAGRMOFT-QUCCMNQESA-N	426.872	1.155	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3C[C@]3(F)Cl)C2)C1	1840036002	BYYYTGGBZMHHRX-RBDSIQFVSA-N	427.698	1.151	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)C(=O)c3cccn3C)CCO2)C1	1840481137	FGUFHCUPRWHNJT-MGPUTAFESA-N	425.913	1.072	50	20	IDGD	
CCC(=O)N[C@H](C)C(=O)N1CCCC12CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2	1841534365	MLYAAYNVPSQTMS-CYBMUJFWSA-N	446.460	1.252	50	20	IDGD	
COc1ccc(C)c(C(=O)N2CC3(CCCN3C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)c1	1843416729	SXHJARCZNZUWAG-PCLIKHOPSA-N	437.500	1.955	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(N2C[C@H](C(=O)NNC(=O)CC(C)C)CC2=O)cc1	10160608	ZETHAQMKOGUECD-OAHLLOKOSA-N	438.550	1.264	50	20	IDGD	
O=C(COC(=O)c1ccc(OCC(F)(F)F)nc1)NNC(=O)c1ccc([N+](=O)[O-])cc1	14168645	BWIWIZCTBUIHTP-UHFFFAOYSA-N	442.306	1.549	50	20	IDGD	
COc1cc(C(=O)NNC(=O)COc2cc(C)ccc2C)cc(Cl)c1OCC(N)=O	14318168	PAVDMNXDVXUJED-UHFFFAOYSA-N	435.864	1.670	50	20	IDGD	
O=C(CCCc1cccs1)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	15524800	QHAGKSUXZKMJLB-UHFFFAOYSA-N	437.543	1.553	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)CCn1cnc2ccccc2c1=O	16467499	CFNHMEXIDGQDLX-UHFFFAOYSA-N	448.527	1.146	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1cn(Cc2ccccc2)nc1-c1cccs1	16786056	XIFHOVUDFFDXGR-OAHLLOKOSA-N	444.538	1.856	50	20	IDGD	
O=C(CCC(=O)c1ccccc1)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	17456560	WMJXECZQCKNCTA-UHFFFAOYSA-N	429.498	1.895	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)[C@@H](C)SCc2nc3sc(C)c(C)c3c(=O)[nH]2)n1	17639455	NSPYYKCPRNOIPZ-CYBMUJFWSA-N	448.574	1.884	50	20	IDGD	
CCOC(=O)/C(C#N)=C/Nc1cc(S(=O)(=O)N2CCOCC2)ccc1N1CCCC1	18988884	LDYMDMGQBKJNFB-FOCLMDBBSA-N	434.518	1.690	50	20	IDGD	
Cc1cc(C)n(CCC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)n1	22082422	REBJSMBAGWFZCS-UHFFFAOYSA-N	433.534	1.526	50	20	IDGD	
CC(C)(C)C(=O)NCCCC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	27229858	GLXPVBUXJJJBER-UHFFFAOYSA-N	438.550	1.175	50	20	IDGD	
O=C(CN1C(=O)N[C@@]2(CCc3ccccc32)C1=O)NNC(=O)c1cc(-c2ccccc2)on1	27260313	IRWDNDKGALEXID-HSZRJFAPSA-N	445.435	1.496	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)CCn2c(=O)n(C)c3ccccc32)cc1OC	28080605	HPRIREVHDRKRCX-UHFFFAOYSA-N	426.473	1.989	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCN(c3ccc(Cl)cn3)CC2)cc1OC	109256639	NSCDQAHHIXCTAL-UHFFFAOYSA-N	433.896	1.335	50	20	IDGD	
COc1cccc2c1OCC[C@@H]2NC(=O)NNC(=O)c1sc(N2CCOCC2)nc1C	725874043	FUMZKDKPKHHJRN-AWEZNQCLSA-N	447.517	1.765	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)NCc2cccc(CN3CCC[C@@H](C(N)=O)C3)c2)c1	731042896	AQEZMDCHSGVNQV-HXUWFJFHSA-N	434.500	1.400	50	20	IDGD	
O=C(NNc1nc(-c2cccnc2)no1)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1	732110720	LITQJWSBIVPZIL-LLVKDONJSA-N	429.418	1.849	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)[C@@H](C)NC(=O)c2cccc(Cl)c2Cl)C[C@@H](C)O1	732265077	YTLPTEYJEWDFLH-JHJVBQTASA-N	445.347	1.758	50	20	IDGD	
Cc1c(C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cnn1Cc1ccccc1	732324535	HEFPTCAIDKKCNG-UHFFFAOYSA-N	437.412	1.766	50	20	IDGD	
COc1ccc(Cl)c(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1	732747554	QOPGZETYUVXEQV-UHFFFAOYSA-N	447.922	1.222	50	20	IDGD	
CON(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)NCc2ccc(Cl)cc2)cc1	733003382	LBASUAFRBZNVOW-UHFFFAOYSA-N	426.882	1.666	50	20	IDGD	
CC[C@@H](C#N)Oc1cc(CNC(=O)NNC(=O)CNC(=O)c2cccs2)ccc1OC	733656022	GDGBUIXKMAJCRG-AWEZNQCLSA-N	445.501	1.698	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)C[C@H]2CCc3ccccc3C2)CC1	735118028	NEMPZVWPPNGRAL-KRWDZBQOSA-N	443.573	1.656	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2ccc(C(=O)NNC(=O)c3cnn(C)c3)cc2)cc1	735470620	DQZDUTWOEUSBMX-UHFFFAOYSA-N	429.458	1.304	50	20	IDGD	
CN1CCN(CCCCNC(=O)NNC(=O)c2ccc(F)cc2Br)CC1	737064966	LYJSLPAXHQVMFN-UHFFFAOYSA-N	430.322	1.560	50	20	IDGD	
CN(C)c1nccc(NNC(=O)CCc2ccc(S(=O)(=O)N3CCCCC3)cc2)n1	740112818	QLCKREULZKWTFL-UHFFFAOYSA-N	432.550	1.793	50	20	IDGD	
C[C@H]1CN(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)CC[C@H]1NC(=O)OC(C)(C)C	740903239	LHDNVVZIVCVPLP-XJKSGUPXSA-N	444.496	1.252	50	20	IDGD	
CC(C)[C@@H](C(=O)OCC(=O)NNC(=O)c1ccc(Cl)cc1)N1C[C@@H](C)O[C@H](C)C1	741027197	QTKANIYBBZWORE-LBTNJELSSA-N	425.913	1.778	50	20	IDGD	
NC(=O)[C@H](NNC(=O)c1ccc(-n2cnnn2)cc1)c1ccc(Br)cc1F	743462936	NBWYNPNXNRXNJP-CQSZACIVSA-N	434.229	1.025	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)NCCc2cccc(C(=O)N(C)C)c2)cc1OC	743637634	OOQUXPXMOWUERS-UHFFFAOYSA-N	428.489	1.982	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)c1cc(Br)ccc1O)n1nnc(-c2ccccc2)n1	743730469	ZHHJDUWTAAHQDA-JTQLQIEISA-N	431.250	1.830	50	20	IDGD	
Cc1nn(C)c(C)c1-c1cc(C(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)n[nH]1	743829283	KHOMTRIZUWADMN-UHFFFAOYSA-N	431.478	1.297	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)NCc2ccccc2OCCN2CCOCC2)c1	744292111	TWNRUEZHSPJGEE-UHFFFAOYSA-N	441.532	1.608	50	20	IDGD	
Cc1c(/C=C(\C#N)C(=O)O[C@H](C)C(=O)Nc2cccc(S(N)(=O)=O)c2)cc(C#N)n1C	744633649	YMQLLHFEIBVBJQ-BKNIFWKGSA-N	441.469	1.330	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)N[C@@H]1CCc2c(O)cccc21	745865248	LEFRARUPPRKLFA-GOSISDBHSA-N	444.513	1.808	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCCc2ccccc2[N+](=O)[O-])nc1	745879632	BOAMLCVDPWFDNP-UHFFFAOYSA-N	436.494	1.889	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@H]2CCCN(C(=O)NC3CCCC3)C2)cc(OC)c1OC	746013982	VDOIUVJLOFXITC-AWEZNQCLSA-N	448.520	1.838	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NC[C@@H]2CCCN(CC(C)C)C2)c2ccccc2c1=O	746328631	ONOUONLEQDDBBJ-INIZCTEOSA-N	428.537	1.728	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)CCOc1ccc(S(C)(=O)=O)cc1	746516121	CDEONUGEUCSFCJ-UHFFFAOYSA-N	426.878	1.982	50	20	IDGD	
COC(=O)c1ccsc1N1CC[C@H](NC(=O)NNC(=O)c2c[nH]c3ccccc23)C1=O	746780187	MWQOPULFYGXBLE-HNNXBMFYSA-N	441.469	1.766	50	20	IDGD	
CCC[C@@H](C)NC(=O)[C@@H]1CCCN(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)C1	747853538	XORZOLQIAMXSMW-GDBMZVCRSA-N	428.497	1.034	50	20	IDGD	
Cn1ccnc(NNC(=O)CCc2ccc(S(=O)(=O)N3CCCCCC3)cc2)c1=O	747941795	OSFKHYAMYJSRBT-UHFFFAOYSA-N	433.534	1.421	50	20	IDGD	
COc1ccnc(NNC(=O)c2cc(S(=O)(=O)NCc3ccccc3)ccc2O)n1	748025624	YCXZTHHCEALGCF-UHFFFAOYSA-N	429.458	1.426	50	20	IDGD	
COCCOCC(=O)NC1CCC(C(=O)NNC(=O)c2ccc(Cl)cc2O)CC1	748837602	DWDDNXWXZAZHSI-UHFFFAOYSA-N	427.885	1.145	50	20	IDGD	
COc1ccc([C@@H](C)CC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1	749864908	CABCROQJRYDZLL-INIZCTEOSA-N	433.530	1.965	50	20	IDGD	
CC(C)(C)c1ccc(C(=O)NCCC(=O)NNC(=O)CNC(=O)c2cccs2)cc1	751210642	HSIPWQNQNUGZTO-UHFFFAOYSA-N	430.530	1.743	50	20	IDGD	
CO[C@@H](C)c1nc(CN2CCCN([C@@H](C)C(=O)NNC(=O)CC(C)C)CC2)cs1	752355695	RVCHXHYSEUYZOH-HOTGVXAUSA-N	425.599	1.940	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H]2CCOC2)c1	752703305	HNTZWAKYQYYOPN-AWEZNQCLSA-N	434.474	1.229	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)NC[C@@H]2CCC[C@@]23NC(=O)N(C)C3=O)c1C	753024822	QYZBNVFICDCISC-LRAJWGHMSA-N	431.493	1.122	50	20	IDGD	
CN(C)C(=O)COc1ccc(NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1	755644667	ACRXUEQFTZGOTP-UHFFFAOYSA-N	441.492	1.013	50	20	IDGD	
COc1cc(C#N)ccc1Oc1ccc(NC(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)cc1	756297651	NRVSCRRJHPCDAP-GFCCVEGCSA-N	447.473	1.450	50	20	IDGD	
C[C@H]1CN(C(=O)Cn2cc(NC(=O)NNC(=O)CCc3ccccc3O)cn2)C[C@H](C)O1	756839411	RRCMKCKFQLKMLT-GJZGRUSLSA-N	444.492	1.010	50	20	IDGD	
COC(=O)c1cc(NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cn1C	757672246	WSMLPDHEZGIBDQ-UHFFFAOYSA-N	428.493	1.177	50	20	IDGD	
CC(C)n1nnnc1-c1ccccc1NC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	758015634	ABTZAUNDADEVCY-UHFFFAOYSA-N	443.489	1.791	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)N=c1cc[nH]cc1I	760028964	KWDCZAYZNBGNJD-UHFFFAOYSA-N	440.241	1.902	50	20	IDGD	
CN1C(=O)C[C@H](C(=O)NNc2nccc(N3CCOCC3)n2)[C@H]1c1ccc(Cl)c(F)c1	760172209	DVEISODIBUIIIL-SCLBCKFNSA-N	448.886	1.768	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3c(F)cc(F)cc3F)cc2)CC1	761543913	ZKCPZHZKAKJYDN-UHFFFAOYSA-N	428.436	1.797	50	20	IDGD	
C[C@H](Sc1ccccn1)C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	762540120	NDLOHZFIDCGUQF-AWEZNQCLSA-N	436.563	1.037	50	20	IDGD	
COC(=O)c1c(F)cccc1NC(=O)C(=O)NNC(=O)c1ccccc1Br	763481984	BSUXRZFWVVTIPW-UHFFFAOYSA-N	438.209	1.775	50	20	IDGD	
CSc1cc2c(cc1NC(=O)C(=O)NNC(=O)c1c(C)nc3ccccn13)OCCO2	763630398	ZXWKTNVCDAIWJI-UHFFFAOYSA-N	441.469	1.536	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cc(C)nn2-c2ccc(F)cc2)cc1	763662433	YHFJTHUUINLPQL-UHFFFAOYSA-N	441.419	1.493	50	20	IDGD	
CCn1cnnc1-c1cccc(NC(=O)C(=O)NNC(=O)COc2ccccc2OC)c1	763663581	WFNVFETYYXWTCP-UHFFFAOYSA-N	438.444	1.139	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2ccc(N3CCCC3=O)c(F)c2)c1	763668298	KSHFHCILUYEDJI-UHFFFAOYSA-N	442.447	1.734	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)C(=O)Nc1cc(F)ccc1OC[C@@H]1CCCO1	763681730	PZONIDBROFZIDZ-AWEZNQCLSA-N	449.410	1.688	50	20	IDGD	
CC(C)COc1ccc(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)cn1	763736203	QVCAPKUJBOVQLD-UHFFFAOYSA-N	425.489	1.655	50	20	IDGD	
CSc1cc2c(cc1NC(=O)C(=O)NNC(=O)COc1ccccc1C#N)OCCO2	763807824	GQICCVHEVMYBAZ-UHFFFAOYSA-N	442.453	1.216	50	20	IDGD	
Cc1ccc(C)c(-n2ncc(NC(=O)C(=O)NNC(=O)COc3ccccc3C#N)c2C)c1	763814473	UYGGHECQCUZHJA-UHFFFAOYSA-N	446.467	1.834	50	20	IDGD	
CC(C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)cc1	763849010	GYSCYNLLZVGETL-ZDUSSCGKSA-N	430.436	1.517	50	20	IDGD	
Cc1nc(-c2cccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc3ccccc3F)c2)n[nH]1	763852496	XYFSCPIYKKFMKB-NSHDSACASA-N	426.408	1.473	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)Cc2c[nH]c3ccccc23)c(OCCN(C)C)c1	763865335	OJPJNWUJGLBEKB-UHFFFAOYSA-N	437.500	1.745	50	20	IDGD	
Cc1ccccc1-n1nccc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccc(F)cc1	763867532	WJHZQMMALRDXHF-CQSZACIVSA-N	425.420	1.873	50	20	IDGD	
COC(=O)c1cc(C)ccc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccc(C(C)=O)cc1	763878512	QNCQBNPPXVHJPZ-CQSZACIVSA-N	441.440	1.538	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2cc(Cl)ccc2Br)n1	763880643	IXJBCDUNCOEDFH-UHFFFAOYSA-N	428.674	1.702	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)C(=O)Nc1ccc(C(N)=O)c(F)c1	763899773	BHLXVEHZARAGHO-UHFFFAOYSA-N	441.444	1.756	50	20	IDGD	
O=C(CCSc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccn(-c2ncccc2F)n1	763904094	WPLARNYZQFOMBP-UHFFFAOYSA-N	446.439	1.814	50	20	IDGD	
O=C1C[C@H](Cc2ccc(NC(=O)C(=O)NNC(=O)c3cccc4ccccc34)cc2)C(=O)N1	764050657	GNUYIGSFTHQXNP-INIZCTEOSA-N	444.447	1.445	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(N3CCSCC3)c(C)c2)c(O)c1	764105405	REEWIEJGLCFWKI-UHFFFAOYSA-N	428.514	1.962	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(N3CCOCC3)c3ccncc23)c(O)c1	764110480	PKAICLBNRBUPJN-UHFFFAOYSA-N	449.467	1.485	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2ccc(CN3CCOC3=O)cc2)cc1	764130681	BMVXEEFOLULIFH-UHFFFAOYSA-N	440.456	1.366	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2nc(-c3cccc(C#N)c3)cs2)c1O	764133420	VBRCYRBMFJLJJJ-UHFFFAOYSA-N	437.437	1.796	50	20	IDGD	
CCOC(=O)/C=C\c1ccc(NC(=O)C(=O)NNC(=O)Cc2ccccc2OC)cc1	764135493	HJUYPBNAXFPMRJ-RAXLEYEMSA-N	425.441	1.600	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2O1)C(=O)Nc1cccc(Cl)c1N1CCOCC1	764163947	NPOWUJDSJKLXEZ-KRWDZBQOSA-N	444.875	1.266	50	20	IDGD	
Cc1nnc(-c2ccc(NC(=O)C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)cc2)o1	764204741	TWPLZIRTPPQLIA-UHFFFAOYSA-N	446.464	1.436	50	20	IDGD	
CNS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2c(Cl)cccc2Cl)cc1	764221777	ZTLHYVUOHQQJHH-UHFFFAOYSA-N	445.284	1.301	50	20	IDGD	
CCCNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)c1	764376375	CDNKJTPGVCGOJZ-UHFFFAOYSA-N	440.485	1.678	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)C(=O)Nc2cnn(-c3ccccc3Cl)c2)c1	764431452	XLIMBLPKNYXKMH-UHFFFAOYSA-N	441.835	1.279	50	20	IDGD	
CCOc1ccc(NC(=O)NNc2nccnc2OC)cc1S(=O)(=O)N1CCCC1	764602461	WHVSFZXZTCMIKO-UHFFFAOYSA-N	436.494	1.817	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)C1CCN(C(=O)N2CCCC2)CC1	765319380	WPQDTDKJIPUPEX-UHFFFAOYSA-N	425.530	1.367	50	20	IDGD	
CCOC(=O)NNC(=O)C(=O)Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1	765409286	NJKBYDKISJRVHB-UHFFFAOYSA-N	439.516	1.767	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)Cn3nc(-c4ccccc4)oc3=O)n[nH]2)c1	765578574	XIRGLMMVAWNEFH-UHFFFAOYSA-N	432.440	1.971	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)CCOc3ccccc3F)CC2)cc1	765754472	LKSJSKHYXXQEHB-UHFFFAOYSA-N	428.508	1.868	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)C(F)(F)c1ccc(F)cc1	766636721	SJILPLSYCNCDOX-UHFFFAOYSA-N	434.418	1.523	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)[C@@H]1SCCc2ccccc21	766642277	LIMVXXQQRSUIGZ-OAQYLSRUSA-N	438.553	1.622	50	20	IDGD	
COc1ccc(-n2cnnc2SCC(=O)NNc2ccccc2S(C)(=O)=O)cc1	766663696	UQCKXAUPPDJJLO-UHFFFAOYSA-N	433.515	1.915	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)CN1CCN(C(=O)c2ccc(Cl)cc2F)CC1	766877959	KVRNZBAIJIDSOC-UHFFFAOYSA-N	446.910	1.935	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](OCC(=O)NNC(=O)Cn2cnc3ccccc32)C1	767825705	RSGBABKDOAVUMX-OAHLLOKOSA-N	431.493	1.600	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)[C@@H]2CC[C@H](C(F)(F)F)NC2=O)n[nH]1	768275395	BBCUSTOABVOUCY-QMTHXVAHSA-N	425.367	1.303	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)CN1C(=O)N[C@]2(CCCC(C)(C)C2)C1=O	768566067	QNCAGPFNULZFNY-ASSNKEHSSA-N	434.468	1.631	50	20	IDGD	
C[C@H](NC(=O)NNc1nc(O)c2cnn(C)c2n1)c1cc(F)ccc1N1CCC(O)CC1	770395918	NWCRGOLJTKOFQT-NSHDSACASA-N	444.471	1.556	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N[C@@H](C)CCN2CCN(C)CC2)cc1Br	770405197	YWGHPUJFNJHMDB-ZDUSSCGKSA-N	442.358	1.428	50	20	IDGD	
CCS(=O)(=O)N(C)C1CCN(C(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)CC1	770650013	SMPUHAFVUZQUQM-CYBMUJFWSA-N	446.957	1.594	50	20	IDGD	
C[C@H]1OCC[C@H]1C(=O)NNC(=O)c1ccc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1	770855425	DFFWITMZFHBLRB-SJKOYZFVSA-N	448.457	1.582	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=S)NCc1ccc(S(N)(=O)=O)cc1	773193276	NOKUOFUBJWFHLA-NSHDSACASA-N	442.950	1.450	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NNC(=O)c2cc(N3CCNC3=O)ccc2F)C1	773416668	CWHSMTQNIRAWGN-CYBMUJFWSA-N	449.483	1.763	50	20	IDGD	
CCN1CCN(C(=O)c2ccc(NC(=O)C(=O)NNc3ccc([N+](=O)[O-])cc3)cc2)CC1	773643123	KMIAPNKUHUGHNF-UHFFFAOYSA-N	440.460	1.454	50	20	IDGD	
CN1CCN(C(=O)NNC(=O)c2ccc(Cl)c(S(=O)(=O)NC(C)(C)C)c2)CC1	773660692	ZZKOTZDABLMZQX-UHFFFAOYSA-N	431.946	1.019	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ccc3ccccc3n2)cc1NS(C)(=O)=O	773662287	OZOHLMRYFNGCBG-UHFFFAOYSA-N	429.458	1.697	50	20	IDGD	
CN1C(=O)CCc2cc(C=NNC(=O)CN3CCN(C(=O)c4ccccc4)CC3)ccc21	774397060	LRIDLOCQCDEQFB-UHFFFAOYSA-N	433.512	1.504	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNS(=O)(=O)C1=Cc2ccccc2OCC1	775288543	VHWDHJGQPZIYMT-UHFFFAOYSA-N	435.889	1.730	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)NC[C@@H](c2cccc(F)c2)N2CCOCC2)c1	776619130	QDPRMXPCMIJPSN-IBGZPJMESA-N	436.509	1.929	50	20	IDGD	
COCCO[C@@H]1COCC[C@H]1NC(=O)NNC(=O)[C@@H](C)Oc1ccc2ccccc2c1	777278931	LJOIARRHZTZEAX-CDHQVMDDSA-N	431.489	1.758	50	20	IDGD	
O=C(NCCc1ccc(Cl)cc1[N+](=O)[O-])NNC(=O)c1ccc(-n2cnnn2)cc1	778588914	NFLLYTPNJJEICN-UHFFFAOYSA-N	430.812	1.411	50	20	IDGD	
O=C(NNc1ccccc1OC(F)(F)F)C(=O)Nc1ccn(CCN2CCOCC2)n1	778802502	FRMOBVKMEZZSLW-UHFFFAOYSA-N	442.398	1.196	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)N[C@H]2CCCN(c3ccc(C#N)cc3)C2=O)cc1C	780894031	JAGJHZCYEUMSLY-IBGZPJMESA-N	448.483	1.640	50	20	IDGD	
CC(C)S(=O)(=O)c1ccc(CC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1	781134531	LFASUIFVDATLAU-UHFFFAOYSA-N	438.527	1.276	50	20	IDGD	
Cc1cc(NNC(=O)CCc2c(C)nn(-c3ccc(S(N)(=O)=O)cc3)c2C)nc(C)n1	781935150	OUCWNWUXEPAIHS-UHFFFAOYSA-N	443.533	1.619	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2c(C)csc2C(=O)OC)o1	782117887	SWIHWTXONMFVCN-UHFFFAOYSA-N	436.490	1.678	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(O)cc2)c2ccccc12	782834015	OZYUXTIOPPUVNZ-UHFFFAOYSA-N	437.408	1.497	50	20	IDGD	
Cc1cc(F)ccc1-n1ccc(C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)n1	783032377	QQZNJSZMDBTMHM-UHFFFAOYSA-N	444.492	1.996	50	20	IDGD	
Cn1ccnc1C(=O)c1ccc(NC(=O)C(=O)NN=c2sc3ccccc3n2C)cc1	783349365	HHBVJPJWYKPXSM-UHFFFAOYSA-N	434.481	1.775	50	20	IDGD	
O=C(NNC(=O)C(=O)N1CCCC1)C(=O)Nc1ccc(OCc2ccccc2F)cc1	783998564	BRHJBEIVFQJONK-UHFFFAOYSA-N	428.420	1.113	50	20	IDGD	
COc1cc(C)c(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)cc1F	784213392	LQROTMGTIGWJHO-UHFFFAOYSA-N	436.465	1.665	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)F)cc1)C(=O)Nc1ccccc1-n1ccnn1	784835415	OKHGHUIMOWZBFF-UHFFFAOYSA-N	436.400	1.345	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2cc(F)c(F)cc2F)cc1S(=O)(=O)N(C)C	784893330	TTXZXLRGFWPKBA-UHFFFAOYSA-N	430.408	1.744	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)C(=O)Nc1cc2c(cc1Cl)OCCO2	785067206	IWSPYWDHMWWFEY-UHFFFAOYSA-N	429.820	1.088	50	20	IDGD	
C=CCNC(=O)Nc1ccc(NC(=O)C(=O)NNc2nccc(N(CC)CC)n2)cc1	785225073	BOBLIHZKSXVLGZ-UHFFFAOYSA-N	426.481	1.712	50	20	IDGD	
O=C(COC(=O)c1cccnc1C(F)(F)F)NNC(=O)[C@@H]1COc2ccccc2O1	788129233	CXKYLMQFVOHWLM-ZDUSSCGKSA-N	425.319	1.245	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC(C(=O)NNc3ccc(-n4ccnc4)nn3)CC2)cc1	788175111	PVSDLFHMIBGLBO-UHFFFAOYSA-N	441.517	1.515	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)Nc1ccc(C(F)(F)F)nn1	788297178	KHGQZAGTMDLQSD-UHFFFAOYSA-N	437.426	1.860	50	20	IDGD	
Cc1cc(F)c(Br)cc1NC(=O)C(=O)NNC(=O)CNC(=O)c1ccco1	789590168	RWZJEWGKGZTOAP-UHFFFAOYSA-N	441.213	1.006	50	20	IDGD	
C[S@@](=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)cc1F	789809943	HUZBMCZIHUSCIS-GQYSXLKBSA-N	433.461	1.222	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNc2cccc(F)c2[N+](=O)[O-])ccc1N1CCCC1=O	791000985	UKTMOVWBGFZQJD-UHFFFAOYSA-N	431.380	1.951	50	20	IDGD	
C[C@@H]1CC(=O)C[C@@H](C(=O)NNC(=O)c2ccccc2)[C@H]1C(=O)NNC(=O)c1ccccc1	791122374	YJEWVUFTULXBIS-ZMYBRWDISA-N	436.468	1.140	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@H](C(=O)NNc2cccc(F)c2[N+](=O)[O-])[C@H](C)O)cc1	791148252	UWUGHUXUHCRLPI-NHYWBVRUSA-N	426.426	1.213	50	20	IDGD	
COc1ccc(OC)c(C2=NO[C@@H](C(=O)NNC(=O)c3cc(Br)c[nH]3)C2)c1	792026606	YUMVVOFHQNWEQD-OAHLLOKOSA-N	437.250	1.749	50	20	IDGD	
O=C(NNc1cc(Cl)cc(Cl)c1)C(=O)Nc1ccnn1[C@H]1CCS(=O)(=O)C1	792438649	WLLVVZANNNBCAX-LBPRGKRZSA-N	432.289	1.631	50	20	IDGD	
CSSCCNC(=O)C(=O)Nc1ccc(Br)cc1S(C)(=O)=O	793080577	LHUDVVYZOMSDCP-UHFFFAOYSA-N	427.367	1.919	50	20	IDGD	
C[C@@H](O)CN1CCN(C(=O)CCC(=O)C(C#N)=C2N(C)c3ccccc3N2C)[C@H](C)C1	793873484	GZUKDZDQOMBUOQ-IAGOWNOFSA-N	425.533	1.571	50	20	IDGD	
O=C(NNC(=O)c1cc(O)ccc1[N+](=O)[O-])c1cccc(S(=O)(=O)N2CCCC2)c1	794743411	ZFUAHBOCOBNIEX-UHFFFAOYSA-N	434.430	1.160	50	20	IDGD	
CC(C)c1ncc(NC(=O)C(=O)NNC(=O)COc2cccc(C(F)(F)F)c2)cn1	796991234	BEYRBCQHFJNGLM-UHFFFAOYSA-N	425.367	1.784	50	20	IDGD	
C[C@H](NS(=O)(=O)c1cccc(C(F)(F)F)c1)C(=O)NNC(=O)NCC(F)(F)F	798316553	PBGGXYYUULSODF-ZETCQYMHSA-N	436.334	1.265	50	20	IDGD	
CN1CCN(CCNC(=O)NNC(=O)c2ccc(F)cc2Br)CC1(C)C	799686907	JNFPCFYOMNPUMF-UHFFFAOYSA-N	430.322	1.558	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)c2nn(-c3cccc(Cl)c3)cc2O)cc1	801359582	WWRXNOZARRQRDP-UHFFFAOYSA-N	439.815	1.721	50	20	IDGD	
CN(C(=O)OC(C)(C)C)[C@@H](C(=O)NNc1ccc(-n2ccnc2)nn1)c1cnn(C)c1	804954115	KTEGEPXOCGXHLD-MRXNPFEDSA-N	427.469	1.447	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cnc(C(C)(C)C)nc2)c1	806306575	PWCALOSQWIYPIZ-UHFFFAOYSA-N	433.534	1.879	50	20	IDGD	
O=C(NNC(=O)c1ccc(COc2ccccc2)o1)C(=O)Nc1cccc2c1CNC2=O	806975648	JCAZARMJGDAYPW-UHFFFAOYSA-N	434.408	1.502	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(F)cc2OC2CCOCC2)cc1	806977988	HSGOWUNIWRUJLI-UHFFFAOYSA-N	426.404	1.655	50	20	IDGD	
CC[C@H](C)N[C@H](CNC(=O)NNC(=O)c1csc(N2CCOCC2)n1)c1ccco1	807442299	YEMRSDPQAXTUPQ-UONOGXRCSA-N	436.538	1.646	50	20	IDGD	
O=C(NNc1ncccc1F)c1cccc(NS(=O)(=O)c2ccc3nnn(O)c3c2)c1	807669831	UJOQALMYUHFEBS-UHFFFAOYSA-N	443.420	1.760	50	20	IDGD	
O=C(CN1CC[C@@](CO)(Cc2ccc(F)cc2)C1)NNC(=O)c1ccc([N+](=O)[O-])cc1	808795292	SQCBZMXSSQXMTF-OAQYLSRUSA-N	430.436	1.422	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2cc(-c3cc(C)ccc3C)[nH]n2)cc1	810584341	PJBVISXJAOOURS-UHFFFAOYSA-N	441.513	1.741	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NN=C3CCN(C(N)=O)CC3)c2)cc1	812376678	ZWLUSDUDKZRHQR-UHFFFAOYSA-N	445.501	1.756	50	20	IDGD	
CC(C)OCc1nc([C@@H](C)NC(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)no1	812644070	GXHOSWSLFINPKI-SNVBAGLBSA-N	433.473	1.982	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccc(C(F)(F)F)cn2)cc1	813033809	MIAVLDBSAGABLR-UHFFFAOYSA-N	431.396	1.433	50	20	IDGD	
CCOc1ccc(C(=O)NN=C(C)c2ccc(S(=O)(=O)CC(N)=O)cc2)cc1OC	814754211	FAZIUQWWSQWUHI-UHFFFAOYSA-N	433.486	1.507	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCOc3cc(F)c(Br)cc32)n1	815304932	QISBFXDOJSCFCV-UHFFFAOYSA-N	443.298	1.942	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2cc(C)c3nccn3c2)n[nH]1	815570012	OASDEHMNQQAISJ-UHFFFAOYSA-N	433.428	1.441	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccc([C@H]3CCOC3)cc2)cc1	815657335	WGBBJZYJCZVWFO-HNNXBMFYSA-N	432.502	1.523	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1ccnn1Cc1ccccc1	815752314	NHHJLLPRCAFXCM-UHFFFAOYSA-N	442.501	1.264	50	20	IDGD	
COC(=O)c1cc(NNC(=O)c2cccc(CN3CCS(=O)(=O)CC3)c2)ccc1C	816686858	GHAXPDOOSRZYHC-UHFFFAOYSA-N	431.514	1.769	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@@H](CCC(N)=O)C(=O)NNc2ccc(F)cc2F)cc1C	825198164	DIRLWHKPLMIKIT-KRWDZBQOSA-N	440.472	1.637	50	20	IDGD	
CCn1c(NNC(=O)CCc2c(C)c3c(C)nn(C)c3[nH]c2=O)nc2ccccc2c1=O	914688500	HXFYEECUYBCBFB-UHFFFAOYSA-N	435.488	1.684	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)CCC(=O)c2ccc3c(c2)OCCO3)c1	915197426	IIOLOSHYAJORCS-UHFFFAOYSA-N	432.454	1.285	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)C[C@@H]3CCCO3)c2)cc1	915636768	UAZQNODERPOGLP-KRWDZBQOSA-N	433.486	1.826	50	20	IDGD	
C[C@H](NC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)[C@H]1C[C@H]2CC[C@H]1C2	915883185	CZOBHRWCGDVSJE-NBOOPKSLSA-N	436.582	1.469	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NC[C@@H]1CN(Cc2ccccc2)CCO1	915894110	HWMIDMIQGXZITC-OXQOHEQNSA-N	430.480	1.824	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)[C@H]1CCCCN1S(=O)(=O)c1cccs1	916148233	NCUNEHFXXJDNRL-CQSZACIVSA-N	447.542	1.709	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCc2ccc(N3CCCC3)nc2)nc1	916388943	JGZXHVJQPYSUKT-UHFFFAOYSA-N	433.538	1.590	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)CCc2c(C)nc3ccnn3c2C)c2ccccc2c1=O	916723261	XSKVYGNWKXKLSE-UHFFFAOYSA-N	433.472	1.470	50	20	IDGD	
CCN(CCCNC(=O)NNC(=O)COc1ccccc1-c1ccccc1)S(C)(=O)=O	918118840	GYKHHSHVLZZOIW-UHFFFAOYSA-N	448.545	1.734	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)n(-c2ccc(C(F)(F)F)cn2)n1	920933010	JVGVALMACCUHFI-SNVBAGLBSA-N	446.411	1.182	50	20	IDGD	
CCN(CC)C[C@@H](C)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	921121533	OOURKFDUQBLNBN-OAHLLOKOSA-N	425.555	1.145	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)N[C@H]2CC(=O)N(c3ccccc3)C2)c2ccccc2c1=O	921125839	WOJJLHCEITWGSU-HNNXBMFYSA-N	448.483	1.727	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(OCCBr)cc1)c1n[nH]c2c1CCCC2	1116909487	WKSKVTWQHRREAZ-UHFFFAOYSA-N	443.323	1.686	50	20	IDGD	
CC(C)[C@@H](C(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1)N1C[C@H](C)O[C@H](C)C1	1318667452	FMSRJHYZKWCBAL-JZXOWHBKSA-N	440.585	1.915	50	20	IDGD	
COc1cccc(C2=NO[C@@H](C(=O)NNC(=O)C3CCN(C(=O)OC(C)(C)C)CC3)C2)c1	1321027463	BTVSSZNUWKTZFV-GOSISDBHSA-N	446.504	1.983	50	20	IDGD	
O=C(NNS(=O)(=O)c1cccc(C(=O)NC2CC2)c1)c1ccc(Br)cc1	1323439880	CAFIMYAPZGVDDZ-UHFFFAOYSA-N	438.303	1.965	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCN(Cc3cccc4cccnc34)CC2)n1	1351759238	UFWWYXDAYHWDRK-UHFFFAOYSA-N	438.557	1.507	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2nc3ccccc3[nH]2)C1	1778472398	ILXUSCQBQRUCGD-SOIKWTOOSA-N	434.924	1.944	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc4n(n3)CCCC4)C2)C1	1778565362	XKCIPZZCYQVTBD-HNAYVOBHSA-N	439.354	1.836	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C=N/O[C@@H]2CCCCO2)C1	1779428533	MURYFLLOXVJZBU-KHEABUANSA-N	445.944	1.283	50	20	IDGD	
COc1ccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](O)CCl)C3)c(OC)c1	1780306080	JAKASMFGUVZWSS-YRISNDGFSA-N	440.924	1.431	50	20	IDGD	
CCc1cc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](F)Br)C2)n[nH]1	1780773049	BFNXWVBJPMIMIS-JKIFEVAISA-N	431.306	1.790	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)[C@@H](N)Cc3cccnc3)CCO2)C1	1781230622	XNJUFQPTKUYETA-IPELMVKDSA-N	429.348	1.018	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](F)Br)C3)C2)o1	1781331001	CJWWOEDPMAKBKX-XJKSGUPXSA-N	432.246	1.372	50	20	IDGD	
Cc1nn(C)c(C)c1CC(=O)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781333544	FTQXJKZGHWCXCQ-DOTOQJQBSA-N	431.306	1.100	50	20	IDGD	
COc1ccc(CC(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](F)Cl)CCO3)c([N+](=O)[O-])c1	1781412810	ODQCMRGLUXJGOV-WMZOPIPTSA-N	429.832	1.510	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccn(C(C)C)n1)C2	1782173852	SAZDGBONFCEXMW-XAUMDUMWSA-N	426.945	1.845	50	20	IDGD	
Cc1ccc(CCC(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](O)CCl)C3)c(C)n1	1782420552	MGSFGKWHHRMLDD-NNMXDRDESA-N	437.968	1.745	50	20	IDGD	
CCCCC[C@H](C)C(=O)N1CC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1	1783223265	CKWYORJDNDHKMZ-KSFYIVLOSA-N	431.537	1.345	50	20	IDGD	
CCCNC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](Br)CC)C2)C1	1783344283	SERAFESSQABEQP-KSSFIOAISA-N	432.359	1.296	50	20	IDGD	
CCc1[nH]nc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](Br)CC)C3)C2)c1F	1783345275	YRNJCRAONJFQMR-PIGZYNQJSA-N	431.306	1.728	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)Cc3c(C)n[nH]c3C)CCO2)C1	1783351432	AVNNNKNHYHRPJZ-CRAIPNDOSA-N	427.343	1.572	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc4ncncc4c3)CCO2)C1	1783534847	ZWQPYTUCZADWSI-DJJJIMSYSA-N	433.306	1.857	50	20	IDGD	
CCOc1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](C)Br)C3)C2)nn1	1783535673	BKGAGPLPTFLQNK-YVEFUNNKSA-N	427.299	1.102	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)COCc3ccc(C)c(C)c3)CCO2)C1	1783874546	DRBOULNKYWRUEV-KNQAVFIVSA-N	438.952	1.904	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cc(OC)c(OC)cc3C)CCO2)C1	1783879783	AUXYVYDSGKCRHM-IIBYNOLFSA-N	440.924	1.710	50	20	IDGD	
O=C(c1cc(=O)nc2sccn12)N1CCO[C@@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783948491	PBEWQGKVPQUTRR-MRXNPFEDSA-N	431.301	1.003	50	20	IDGD	
CCOC(CC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](Br)CC)CCO2)OCC	1784166504	HIJGUSSMGYKUBN-RDTXWAMCSA-N	435.359	1.779	50	20	IDGD	
COC(=O)c1ccc(OCC(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](F)Cl)CCO3)cc1	1785720480	YTEIOTUBSLIACQ-QFBILLFUSA-N	428.844	1.216	50	20	IDGD	
Cc1c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)CBr)C[C@@H]32)cnn1C	1786185474	JVBBSYSUCXOPDI-XTBFLFJDSA-N	427.343	1.353	50	20	IDGD	
COCCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C[C@@H]21	1786635957	XSAGDQXPCHHYEH-FNHZYXHNSA-N	449.460	1.150	50	20	IDGD	
CC[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]2C1)N(CC)CC	1789921811	XPCJOPHHIRZOGP-QXKUPLGCSA-N	436.366	1.777	50	20	IDGD	
Cc1cc2[nH]c(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)[C@@H](O)CCl)C[C@@H]43)cc2s1	1790377208	DRDKVAKWYJVENN-APYUEPQZSA-N	425.938	1.731	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4nn[nH]c4c3)[C@H]2C1	1790538482	LFFHUUQHVASNSC-LESCFKLSSA-N	436.310	1.335	50	20	IDGD	
CC(C)N[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]2C1)C(C)C	1791058104	POVSJKRNSLOZNC-JSRQGNBESA-N	432.403	1.772	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CC34CCCN3CCC4)C[C@@H]21	1791060884	LFUBQBTZXKMSDB-QAETUUGQSA-N	442.398	1.768	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1ccc(C2(NC(=O)Cc3cnn(C)c3)CCC2)cc1	1791603058	GLTNFKMDTXCCFC-UHFFFAOYSA-N	426.521	1.470	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnsn1)C2	1794141253	PKDOUSTWMQWSGH-RNJOBUHISA-N	443.957	1.922	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@H](O)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCBr	1795492817	LDUNNTDZSKBFLI-CRWXNKLISA-N	448.358	1.295	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C#CC1(O)CCCCC1	1797785395	QLWSGUYIAPHVGO-DFGXFYAUSA-N	441.366	1.448	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)[S@@](=O)c1ccccc1)C2	1799272420	QHTFOIHCJSFEOA-YQSNDBDWSA-N	426.966	1.790	50	20	IDGD	
C[C@H](Nc1ccccn1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Br	1799350160	SUUQLXITLPFLMC-QIRZIZBZSA-N	429.290	1.162	50	20	IDGD	
Cc1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)nn1C(F)F	1799400353	SUWUZICRJXTVKB-CLLJXQQHSA-N	447.446	1.151	50	20	IDGD	
COc1ccccc1CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2	1800628878	SWWPNZMTEWVMGJ-RMHZUWNSSA-N	429.286	1.518	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(N(C)C)nc1)C2	1800641992	PWWJDCKOJSZZLC-IVSAIRAKSA-N	439.354	1.524	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1cccc(C#N)c1)C2	1800754216	JFJIWEOPOQTSLS-UEILYKACSA-N	434.334	1.864	50	20	IDGD	
C[C@@H](Cn1ccnc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)CBr)C2	1801369057	SJDZLKOTKZZSLD-DGADGQDISA-N	427.343	1.140	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1C[C@H]2CC[C@@H]1O2	1802008930	SQHCOWQPZDDQGM-ASSCONEYSA-N	427.505	1.326	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cn3c(F)cccc3n1)C2	1802338082	KAMUHIAFGSVVMY-QDMKHBRRSA-N	430.484	1.098	50	20	IDGD	
Cn1nc(C(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)c2c1CCC2	1803143222	XEYQDJJGEFRVAY-LJHODMEESA-N	431.924	1.223	50	20	IDGD	
CCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](O)CCl)C2	1804378564	FLTHVZKMOIEXJF-QRJUGERDSA-N	431.961	1.918	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)c1cc(O)nc(Cl)c1	1805031702	GQTVZABBCKYAKP-JDFRZJQESA-N	439.299	1.755	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC2(CCN(C(=O)[C@@H]3CCC(=O)NC3)CC2)C1	1805382411	FMHGEPSSJSUAQV-HUUCEWRRSA-N	428.371	1.775	50	20	IDGD	
Cc1nnc(CC(=O)N2CC[C@H](CNC(=O)CCBr)[C@@H]2c2cccnc2)o1	1806340933	RHAHNPNXCDIFIQ-KDOFPFPSSA-N	436.310	1.807	50	20	IDGD	
CC(C)[C@H](S)C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1807365339	NZSWICPULXZMHU-HOJAQTOUSA-N	441.362	1.035	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)c1cn2cccnc2n1	1809776518	ZBXNODCRLWLEQW-USXIJHARSA-N	428.880	1.044	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@H](CNC(=O)c2c[nH]c(=O)cn2)[C@H]1c1cccnc1	1811450282	SHKFFRMDCDMRMF-HNAYVOBHSA-N	429.553	1.336	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)c1cccc2nccn12	1812172551	FECBUPBJBMVHTI-VDZJLULYSA-N	427.892	1.649	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)CCNC(C)=O)[C@@H]1c1cccnc1	1812779251	QMDNQKKCQFQHOI-SOLBZPMBSA-N	439.354	1.787	50	20	IDGD	
CSCC[C@H](O)C(=O)NC[C@@H]1CCN(C(=O)[C@H](C)Br)[C@H]1c1cccnc1	1813095720	OCIAUTQNNBKCBO-TUUVXOQKSA-N	444.395	1.985	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@H](CNC(=O)CCS(C)(=O)=O)[C@@H]1c1cccnc1	1813574772	FFPULZTVVHCLBQ-LPHOPBHVSA-N	441.626	1.374	50	20	IDGD	
COC(C)(C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[nH]n1	1814513898	RSOFTIDZDCSUCC-ANDSAHIGSA-N	443.508	1.961	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H]2CNC(=O)O2)n[nH]1	1815276073	XNTIMKMRCXQVAY-WCQGTBRESA-N	428.287	1.541	50	20	IDGD	
C=CCC(CC=C)C(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1	1815335489	AHYVCSATDWFJGI-KRWDZBQOSA-N	439.346	1.817	50	20	IDGD	
O=C(CCc1ccccc1)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1	1815339580	HXMZUJFKKMCIGX-SFHVURJKSA-N	449.341	1.682	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccc(=O)n2O)n[nH]1	1816148902	JLRLRMUIMXINHC-PWSUYJOCSA-N	438.282	1.898	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1cncc(F)c1	1816530474	DVSKGVJPHRFBGO-SFHVURJKSA-N	437.240	1.243	50	20	IDGD	
O=C(N[C@H]1CCc2nc(NC(=O)[C@H]3Cc4ccccc4CN3)sc2C1)[C@@H](O)CCl	1817132316	IJGAYUNCBOMFBI-IMJJTQAJSA-N	434.949	1.369	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](N)CN)n[nH]1	1818016383	MWQKEXGNQSWBPV-ATEOPRPQSA-N	443.458	1.573	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](O)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](F)Cl)n[nH]1	1818042294	XMQVCLQOUZQRLM-VHRBIJSZSA-N	433.868	1.779	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](F)Br)n[nH]1	1820932744	OKNHGMBLPWFIPJ-LJWDBELGSA-N	432.294	1.959	50	20	IDGD	
CN[C@H](CC(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](F)Br)n[nH]1)C(=O)O	1820932859	RUPJJPZQNGOBEH-GBIKHYSHSA-N	434.266	1.155	50	20	IDGD	
CN1C(=O)CC[C@H]1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCBr)[nH]n1	1820951205	DXUNDCHIOGOPLR-STQMWFEESA-N	426.315	1.808	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccnc2C(N)=O)[nH]n1	1822367336	LQKIGPMBGUXIGD-OCCSQVGLSA-N	434.884	1.463	50	20	IDGD	
C[C@@H](O)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CC2	1825613123	DMNXWZJHOUHEGD-SCVCMEIPSA-N	446.957	1.568	50	20	IDGD	
Cc1oncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1	1826027051	IXOFSDPOUDDBMR-FQEVSTJZSA-N	425.294	1.210	50	20	IDGD	
CCc1nc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)co1	1829383610	HVXVKWTZJNCPHP-HXUWFJFHSA-N	439.321	1.464	50	20	IDGD	
O=C([C@@H](O)CCl)N1CCC([C@@H]2CCCCN2C(=O)c2nn[nH]c2C(F)(F)F)CC1	1829790919	YAPSWJLDUYRGDS-RYUDHWBXSA-N	437.850	1.657	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](CN)c3ccccc3)C2)C1	1830359318	MTKWSFFFGQSDNR-AVRDEDQJSA-N	437.968	1.450	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4nccn4c3)C2)C1	1830362238	OVOWEIPJFCLHNH-NRFANRHFSA-N	434.924	1.669	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1	1830363958	UWCOPJQBEDLJFO-IAGOWNOFSA-N	429.772	1.944	50	20	IDGD	
C=C(C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2)C(F)(F)F	1830544503	ZTLPUMOVZWECMN-NHYWBVRUSA-N	443.260	1.592	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cn4cccnc4n3)C2)C1	1831650487	IDLHZOPMMJJVCC-YWZLYKJASA-N	435.912	1.207	50	20	IDGD	
NC(=O)c1nccnc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)C(Cl)Cl)CC1	1831879794	ZWDDMLSOFGCBEI-LBPRGKRZSA-N	428.320	1.613	50	20	IDGD	
CC(=O)N[C@H](C(=O)NC1CCN(C2CCN(C(=O)[C@@H](F)Cl)CC2)CC1)C(C)(C)C	1833402533	QUYRUTSJKQTMKE-IAGOWNOFSA-N	432.968	1.643	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)c3cc(CO)on3)CC2)CC1	1833533606	ZUCJYGKRIPABLP-KRWDZBQOSA-N	426.945	1.760	50	20	IDGD	
COc1cccc(CC(=O)NC2CCN(C3CCN(C(=O)[C@@H](F)Cl)CC3)CC2)n1	1833780386	VXESAYLEHJQHOA-LJQANCHMSA-N	426.920	1.739	50	20	IDGD	
O=C(CCc1cccs1)NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1833871335	DUYNZMIJKYCPFG-SFHVURJKSA-N	427.998	1.852	50	20	IDGD	
COC(=O)CCC(=O)NC1CCN(C2CCN(C(=O)[C@](C)(Cl)CCl)CC2)CC1	1834434587	LQFLREGWLZMAPZ-LJQANCHMSA-N	436.380	1.748	50	20	IDGD	
Cc1nn[nH]c1C(=O)NC1CCN(C2CCN(C(=O)[C@](C)(Cl)CCl)CC2)CC1	1834933644	WRLRJGAZZVQFOU-GOSISDBHSA-N	431.368	1.535	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)C(Cl)Cl)CC2)CC1)c1cnn2ccncc12	1835405984	CJMOIOTUQFUNNM-UHFFFAOYSA-N	439.347	1.718	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1)c1cc[n+]([O-])cc1	1836052652	PSYTZISUYKOLGH-MRXNPFEDSA-N	443.317	1.196	50	20	IDGD	
CC(=O)Nc1ccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)cc1	1836661075	CANBFCWEAJWAMY-ICSRJNTNSA-N	441.887	1.178	50	20	IDGD	
CCC(=O)N[C@@H](C)C(=O)N1CCC(OC2CCN(C(=O)[C@H](Cl)COC)CC2)CC1	1836818609	QRNYIGBQTGIKDL-WMLDXEAASA-N	431.961	1.154	50	20	IDGD	
COC(=O)C1(C(=O)N2CCC(OC3CCN(C(=O)CCBr)CC3)CC2)CC1	1837654992	HQKOBLLDGNKMAF-UHFFFAOYSA-N	445.354	1.723	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](C)Br)CC2)CC1	1838106783	LFMXAHKOVIKQRS-ZIAGYGMSSA-N	446.386	1.635	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CS[C@H]3CCCCO3)C2)C1	1839145420	HGDABOQDWFUAMF-VDZJLULYSA-N	434.986	1.720	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4n(n3)CCC4)C2)C1	1839152494	AZBBWWRXXXYCHW-MOPGFXCFSA-N	445.347	1.136	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3C[C@H]3C3CC3)C2)C1	1839962118	VBVJMWSVMVXAMT-FPXQBCRKSA-N	429.355	1.662	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)nc1	1840031593	VZQVIDPDHAFJSY-KBXCAEBGSA-N	426.311	1.243	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(Cl)cn3)C2)C1	1840033919	UWUNNTAQKSUNCW-PXAZEXFGSA-N	446.729	1.588	50	20	IDGD	
Cc1cccc(F)c1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2	1840037301	YAJJJSGEDLLFEE-KUHUBIRLSA-N	443.313	1.988	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4ccsc4[nH]3)C2)C1	1840154662	BWGYJIHTMCHAPZ-LIRRHRJNSA-N	441.937	1.553	50	20	IDGD	
CC(=O)NC(C)(C)C(=O)N1CC2(CCCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C1	1841923940	HACCOXXNHODVNM-AWEZNQCLSA-N	444.960	1.237	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCCC12CN(C(=O)CCN1CCOC1=O)C2	1845871080	LYGJBVDJPQLYPS-MHWRWJLKSA-N	444.438	1.917	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@H]1COCCN1C(=O)OC(C)(C)C)C2	1846360231	BGUHGRALANBGHW-LSDHHAIUSA-N	445.944	1.080	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)[C@H]1CCc3cccc(Cl)c31)C2	1846385925	MKEOADAVOBNWAJ-INIZCTEOSA-N	432.952	1.946	50	20	IDGD	
O=C(COC(=O)c1ccc(Cl)cc1[N+](=O)[O-])NNC(=O)[C@H]1COc2ccccc2O1	10748395	PDYSFASCRSMDMW-OAHLLOKOSA-N	435.776	1.392	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)[C@H]2CCCN(C(=O)Nc3ccccc3)C2)c2ccccc2c1=O	15856980	HTMGMCMPXAJUPV-HNNXBMFYSA-N	448.483	1.639	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1[N+](=O)[O-]	27228755	DMGOVEYLHWMZGJ-UHFFFAOYSA-N	448.457	1.463	50	20	IDGD	
COc1cc([N+](=O)[O-])ccc1OC(=O)CCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1	725730888	AQLJCBXXHCDZMT-UHFFFAOYSA-N	425.375	1.786	50	20	IDGD	
CC[C@H](C)NC(=O)c1cccc(CNC(=O)NNC(=O)CNC(=O)c2cccs2)c1	725872676	GKOXUIILAXNQIB-ZDUSSCGKSA-N	431.518	1.537	50	20	IDGD	
C[C@@H]1CN(CCNC(=O)NNC(=O)[C@@H](C)Oc2cccc(Br)c2)CCO1	726258558	XJXIZFLBIRVUHD-CHWSQXEVSA-N	429.315	1.268	50	20	IDGD	
CCc1cccc2c1OCC[C@@H]2NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	726276647	XNJIZOOEMIBIQY-SFHVURJKSA-N	446.529	1.967	50	20	IDGD	
NS(=O)(=O)c1ccc(CNC(=S)NNC(=O)c2ccc(Cl)cc2Cl)cc1	726440116	FXXBOMDRCDGFRN-UHFFFAOYSA-N	433.342	1.950	50	20	IDGD	
C#Cc1cccc(NC(=S)NNC(=O)c2ccc(F)c(S(=O)(=O)NCC=C)c2)c1	727497717	JCIXVGXSHCQONC-UHFFFAOYSA-N	432.502	1.903	50	20	IDGD	
O=C(NNC(=O)N1CCC(C(=O)N2CCOCC2)CC1)c1c(Cl)cccc1Cl	727847054	PYIVFUUETUWVDA-UHFFFAOYSA-N	429.304	1.919	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C1(S(=O)(=O)c2ccc(Cl)cc2)CC1	729297622	RWIIBNGWWONNNF-UHFFFAOYSA-N	438.889	1.881	50	20	IDGD	
O=C(Nc1sccc1C(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1)c1ccc2c(c1)CCC2	729303100	HDMFUBBEPZQVMH-HNNXBMFYSA-N	447.538	1.685	50	20	IDGD	
COCc1cc(CNC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)ccc1F	730821897	UQNSBOSLOAUPCC-UHFFFAOYSA-N	437.497	1.718	50	20	IDGD	
CC(=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O)c1cccc(OC(F)(F)F)c1	730947819	KQAZEMDVGILVPU-UHFFFAOYSA-N	431.396	1.010	50	20	IDGD	
COC(=O)c1c(S(=O)(=O)NNC(=O)c2cc(C)n(-c3ccccc3)c2C)n[nH]c1C	732046365	SMAJPFCQRTXWGZ-UHFFFAOYSA-N	431.474	1.536	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)NCCCNC(=O)c2cccc(F)c2)cc1OC	732469513	HHDFZXGWDFKFMA-UHFFFAOYSA-N	432.452	1.997	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCc2ccc(C)nc2)c1	732473104	IUJNNYGDNLIZLI-UHFFFAOYSA-N	433.534	1.607	50	20	IDGD	
C=CCNC(=O)c1cccc(S(=O)(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c1	733123120	SSEDZJNAEIRGTC-UHFFFAOYSA-N	425.470	1.411	50	20	IDGD	
C[C@@]1(C2CC2)NC(=O)N(CC(=O)NNc2cc(C(F)(F)F)nc(-c3ccccn3)n2)C1=O	734258195	FXUVEPKFFUHGLH-SFHVURJKSA-N	449.393	1.721	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2ccc(F)cc2Cl)CC1	735118438	VKRURZQFEAEMNX-UHFFFAOYSA-N	427.889	1.567	50	20	IDGD	
Cn1cc(S(=O)(=O)N2CCOCC2)cc1C(=O)NNc1ncccc1C(F)(F)F	740087941	RVTNIHBGSCCUAH-UHFFFAOYSA-N	433.412	1.217	50	20	IDGD	
Cc1nc(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)c2ccccn12	741282806	OICPAHBWEXYBQY-UHFFFAOYSA-N	428.518	1.336	50	20	IDGD	
CC(=O)N[C@@H](CC(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)c1ccc(F)cc1F	741693920	UNXUMIGXDOCVEO-HNNXBMFYSA-N	443.451	1.387	50	20	IDGD	
CC(C)(C)OC(=O)N(CC(=O)NNC(=O)COc1ccc(F)cc1)C[C@@H]1CCCO1	742035021	VSGFBZDSHKQBQF-INIZCTEOSA-N	425.457	1.768	50	20	IDGD	
CON(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)c2cccc(Br)c2)cc1	742773120	NJXOCOWOJFLJJZ-UHFFFAOYSA-N	442.291	1.706	50	20	IDGD	
C[C@H](C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1)c1cccc(Cl)c1	743419557	MHMMQXBEQQIVFB-AWEZNQCLSA-N	437.953	1.918	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)NC[C@@](C)(O)C(C)C)cc1	743773881	MPMJIRWOKIDYBX-XHAORJAKSA-N	439.516	1.864	50	20	IDGD	
CCOc1ccccc1C(=O)NCC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	743829508	SEPKQYQKCQAJMG-UHFFFAOYSA-N	434.474	1.072	50	20	IDGD	
Cc1nc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)sc1C	745923802	WZZRQSZEWJYZMF-UHFFFAOYSA-N	437.547	1.689	50	20	IDGD	
C[C@H]1OC(C)(C)N(C(=O)OC(C)(C)C)[C@H]1C(=O)NNC(=O)COc1ccc(C#N)cc1	746094986	WZNJGLNZEYZAMC-CXAGYDPISA-N	432.477	1.845	50	20	IDGD	
N#Cc1ccc(NNC(=O)[C@@H]2CC(=O)N([C@@H]3CCS(=O)(=O)C3)C2)cc1C(F)(F)F	746894710	ODBXZAZDWZMCMR-DGCLKSJQSA-N	430.408	1.056	50	20	IDGD	
Cc1ccc([C@]2(C)NC(=O)N(CC(=O)NNC(=O)c3cccc4cccnc34)C2=O)cc1	747424707	GYQAMJQTQCMHBV-QHCPKHFHSA-N	431.452	1.771	50	20	IDGD	
O=C(Cn1cc([N+](=O)[O-])ccc1=O)NNC(=S)Nc1cccc(Br)c1	748855479	OBOVRBGGDWXPDR-UHFFFAOYSA-N	426.252	1.537	50	20	IDGD	
CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)NNC(=O)COc1ccccc1O	749381922	LLLSSIWXAVMEFC-QGZVFWFLSA-N	428.420	1.286	50	20	IDGD	
O=C(NNC(=O)C1(C(=O)NC2CC2)CC1)c1nc(-c2ccccc2)n(-c2ccccc2)n1	749389180	QMLQNSNIVHUYPD-UHFFFAOYSA-N	430.468	1.754	50	20	IDGD	
COc1cc(C(=O)NCC(=O)NNC(=O)c2cc3ccccc3o2)cc(OC)c1OC	749546088	TVYYHHHRSASPFG-UHFFFAOYSA-N	427.413	1.650	50	20	IDGD	
COCCS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cc(-c3ccccc3)on2)cc1	749566007	WYRDYHNHBBHXKI-UHFFFAOYSA-N	429.454	1.837	50	20	IDGD	
CCOc1cc(C=NNC(=O)CNC(=O)c2ccco2)ccc1O[C@H](C)C(=O)N(C)C	750938988	VKHNWSXVAZHGOB-CQSZACIVSA-N	430.461	1.414	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNS(=O)(=O)c1ccc(Br)cc1Cl	751282460	LSPDGIDJJHGFAO-UHFFFAOYSA-N	436.671	1.435	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN(C)CC(=O)Nc2cc(OC)cc(OC)c2)cc1C	752330662	DAZRXVQEYITRAR-UHFFFAOYSA-N	448.545	1.968	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)COc2cccc(C)c2)c(C)c([N+](=O)[O-])c1	753840145	HEBRGCUXANBYDH-UHFFFAOYSA-N	444.400	1.163	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)NC3CCN(S(=O)(=O)C4CC4)CC3)n[nH]2)cc1	753965699	GCCMYHPPEADEMV-UHFFFAOYSA-N	446.533	1.286	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)Nc2ccccc2C(=O)N2CCN(C)CC2)c1	755621525	CYZGENYZOZWQJF-UHFFFAOYSA-N	425.489	1.614	50	20	IDGD	
CCOC(=O)COc1cccc(NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c1	755646940	SPFXBDFAYBWRQX-UHFFFAOYSA-N	439.428	1.342	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)cc1NC(=O)OC(C)(C)C	755694304	PTRMQBUJJINNCU-NSHDSACASA-N	442.494	1.630	50	20	IDGD	
COc1cc(C=NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)c2c(c1)C[C@@H](C)O2	755791876	VGGHLYYLDBZIHX-QGZVFWFLSA-N	436.512	1.927	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)Nc1ccccc1CN1CCc2ccccc21	756135057	AQTMDMSDTNHCOU-KRWDZBQOSA-N	428.514	1.837	50	20	IDGD	
N#CCCn1ccc(NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)n1	756656047	QZRSQTUVCMVDSF-UHFFFAOYSA-N	431.478	1.048	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1N1CCCS1(=O)=O	756703299	GQNOKLOHACYACN-SFHVURJKSA-N	446.485	1.528	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)COc2ccc(Cl)cc2)cc1NS(C)(=O)=O	756782911	VMTSZPBJBCJXLE-UHFFFAOYSA-N	442.881	1.952	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)N1CCN(c2ccc(F)cc2Cl)CC1	757020446	JSSPKDRCPVMBRM-UHFFFAOYSA-N	439.900	1.833	50	20	IDGD	
NC(=O)c1ccc(NNC(=O)c2nnn(-c3cccc(C(F)(F)F)c3)c2C2CC2)nn1	757408979	XQILMLGFQNAEEC-UHFFFAOYSA-N	432.366	1.809	50	20	IDGD	
COC(=O)c1cncc(NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1	757720446	DNFKTFOIZUSDRU-UHFFFAOYSA-N	447.473	1.119	50	20	IDGD	
Cc1c[nH]ccc1=NC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	757807778	MJPPSVBYASDCGS-UHFFFAOYSA-N	439.497	1.757	50	20	IDGD	
Cc1ccc(CNC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c(O[C@@H]2CCOC2)c1	758901190	OUVDHXGDNYLORC-QGZVFWFLSA-N	447.513	1.710	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCCC(=O)NNC(=O)Cc1ccc(F)cc1	760799436	NVTHZVPTEKFZMM-INIZCTEOSA-N	436.484	1.421	50	20	IDGD	
CC(C)(C)OC(=O)NCCOc1ccc(NC(=O)C(=O)NNC(=O)c2cccnc2)cc1	763491493	LJTSRUVTAXIZOR-UHFFFAOYSA-N	443.460	1.385	50	20	IDGD	
COc1c(NC(=O)C(=O)NNC(=O)COc2cc(C)ccc2C(C)C)cccc1C(N)=O	763598087	UJNKZTMHUNPATL-UHFFFAOYSA-N	442.472	1.391	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cnn(Cc3ccccn3)c2)c2ccccc2n1	763615787	QFMRLOXCRFFFMO-UHFFFAOYSA-N	429.440	1.583	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(N3CCOC3=O)c2C)cc1C	763664926	NOENCMFMOAYBBU-UHFFFAOYSA-N	440.456	1.733	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(Cl)c(C(=O)OC)c1	763716858	NZJVJXGSOZXZAY-UHFFFAOYSA-N	433.848	1.854	50	20	IDGD	
CCc1nnc(-c2ccc(NC(=O)C(=O)NNC(=O)C3=S=C4CCCC4=C3)cc2)o1	763783326	LTHGWTKFQJTFKN-UHFFFAOYSA-N	425.470	1.587	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)C(=O)Nc2cccc(CC(F)(F)F)c2)c2ccccc2c1=O	763787043	VCXRSFWJJVTDDH-UHFFFAOYSA-N	447.373	1.438	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)C(=O)Nc1cccc(OCC(F)(F)F)c1	763790713	NMYYHOUEWWJCGN-UHFFFAOYSA-N	449.345	1.676	50	20	IDGD	
Cc1nccc(-c2cccc(NC(=O)C(=O)NNC(=O)COc3ccccc3C#N)c2)n1	763812379	FVLKGQQZACPMJH-UHFFFAOYSA-N	430.424	1.489	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)C(=O)Nc1ccn(CCN(C)C)n1	763851741	VMIFIJREDLVAKV-OAHLLOKOSA-N	438.488	1.151	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccc([S@@](C)=O)c(F)c1	763863870	DRHJPBTYJUQIHC-XUQHIXODSA-N	425.413	1.256	50	20	IDGD	
NC(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCCCCC3)cc1	763912131	QTGIRSDFTYJZNV-UHFFFAOYSA-N	428.514	1.835	50	20	IDGD	
CSCCc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1	764077174	IJXXNFRXQYVUMW-UHFFFAOYSA-N	435.527	1.395	50	20	IDGD	
COc1cc(F)c(NC(=O)C(=O)NNC(=O)c2cccc(OC(F)F)c2)cc1OC	764259143	DEXXMAYQFXBWEU-UHFFFAOYSA-N	427.335	1.844	50	20	IDGD	
CCOC(=O)c1cc(-c2ccccc2)ccc1NC(=O)C(=O)NNC(=O)c1c[nH]nc1C	764295086	HOGLZEOKFMEEJH-UHFFFAOYSA-N	435.440	1.962	50	20	IDGD	
NC(=O)CCSc1ccccc1NC(=O)C(=O)NNC(=O)c1ccc(O)c(Cl)c1	764350072	WBUOASWNLCWAET-UHFFFAOYSA-N	436.877	1.413	50	20	IDGD	
Cc1cnn(Cc2cc(F)ccc2F)c1NC(=O)C(=O)NNC(=O)Cc1ccncc1	764353290	HHIOTGGSBNXRAW-UHFFFAOYSA-N	428.399	1.242	50	20	IDGD	
C=CCNC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)cc1	764371056	VYPKVSLJDGIXCU-UHFFFAOYSA-N	447.398	1.752	50	20	IDGD	
Cc1nc(Br)ccc1NC(=O)C(=O)NNC(=O)CSc1ccccc1O	764404213	GQQQPRZPWZCUCE-UHFFFAOYSA-N	439.291	1.736	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NN=C3CCc4c(O)cccc43)CC2)cc1	764818492	LWACVNXZAKRGKA-UHFFFAOYSA-N	442.541	1.474	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2c([N+](=O)[O-])ccc(C)c2C)cc(OC)c1OC	765026138	RJAJDYZUEYJISZ-UHFFFAOYSA-N	439.446	1.861	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)[C@H]1CSCN1C(=O)OC(C)(C)C	765321985	FXKCXGZLMHRCQD-GFCCVEGCSA-N	432.543	1.749	50	20	IDGD	
O=C(COc1cccc2ccccc12)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765737044	UPRZHNSZTFAUCD-UHFFFAOYSA-N	446.507	1.824	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)NCCN2CCN(c3cccc(Cl)c3)CC2)c1	765754179	OAYOGDSJJXOIKX-UHFFFAOYSA-N	426.908	1.978	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)c1cccc([N+](=O)[O-])c1	765755343	FZECJYSIOUKGAT-UHFFFAOYSA-N	431.880	1.827	50	20	IDGD	
COc1ccc(OC)c(CC(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)c1	765756399	WFHNBLWQTCJHJC-UHFFFAOYSA-N	440.544	1.520	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCCS(=O)(=O)CC2CC2)cc1Br	765775127	LQULPOGSMDFOCS-UHFFFAOYSA-N	434.312	1.227	50	20	IDGD	
COc1ccc(NC(=O)c2cccc(NC(=O)C(=O)NNc3nccnc3OC)c2)cn1	766265264	ZIXWYHNCNCNBHR-UHFFFAOYSA-N	437.416	1.223	50	20	IDGD	
CC(C)c1cc(C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)n(C)n1	766664976	ZRCAWVWCTUZGDD-UHFFFAOYSA-N	432.956	1.776	50	20	IDGD	
Cc1ccc(S(N)(=O)=O)c(C(=O)NNC(=O)c2cc(-c3ccc(C)c(C)c3)[nH]n2)c1	767886593	LMOJCMIWJHWSFG-UHFFFAOYSA-N	427.486	1.724	50	20	IDGD	
COc1cc2c(cc1NC(=O)C(=O)NNC(=O)Cc1c[nH]c3ccccc13)NC(=O)CC2	768237782	NUTRHNBVJMGRJM-UHFFFAOYSA-N	435.440	1.390	50	20	IDGD	
COc1ccc(Br)c(CC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c1	768559624	FBROFNGIEABWAY-UHFFFAOYSA-N	441.303	1.865	50	20	IDGD	
CCc1ccccc1C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	770136202	YQKBHOFNHQLUPP-UHFFFAOYSA-N	445.541	1.664	50	20	IDGD	
O=C(NNC(=O)N1CC[C@]2(C1)OCc1ccccc12)c1csc(N2CCOCC2)n1	770308022	QWRRAWOVFSEXAD-HXUWFJFHSA-N	429.502	1.466	50	20	IDGD	
CCN1CCN(c2cccc(NC(=O)C(=O)NNC(=O)COc3ccc(C)cc3)c2)CC1	770775231	XXYGITBJPBILQA-UHFFFAOYSA-N	439.516	1.302	50	20	IDGD	
Cc1ccccc1[C@H](CC(=O)NNc1nc(O)c2cnn(C(C)(C)C)c2n1)NC(N)=O	770958841	PVHJICJTQOESFY-AWEZNQCLSA-N	426.481	1.838	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1cccc(C(F)(F)F)c1)C(=O)NNC(=O)c1ccc(C#N)cc1	771004199	JTYYLMDJNQUIIS-LLVKDONJSA-N	440.403	1.705	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NC2CCC(O)(c3cccnc3)CC2)nc1	771357540	IRGVRWYUXULIPB-UHFFFAOYSA-N	448.549	1.620	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1ccc(Cl)c(S(=O)(=O)NC(C)(C)C)c1	771941741	BCFUONQRFBREPV-SNVBAGLBSA-N	433.914	1.520	50	20	IDGD	
CNC(=O)COc1cccc(CC(=O)NNC(=O)c2ccc(OC(C)C)c(OC)c2)c1	772047891	RHTSOTOOMCBSDU-UHFFFAOYSA-N	429.473	1.611	50	20	IDGD	
CC(C)(C)OC(=O)N1CCSC[C@@H]1CC(=O)NNC(=O)COc1ccccc1O	772081347	MPVDYEDSKYDVMA-ZDUSSCGKSA-N	425.507	1.661	50	20	IDGD	
Cc1nc(O)c(C#N)c(C)c1CCC(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772197726	FMGFWYARKJOXQV-UHFFFAOYSA-N	429.864	1.326	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccc(OC2COC2)cc1	774008255	KNOFTBKKJFMMTE-LBPRGKRZSA-N	433.848	1.671	50	20	IDGD	
CN(C)CC(=O)NNC(=O)Nc1ccc(Br)c(I)c1	775600001	POKDHIDGCUQANW-UHFFFAOYSA-N	441.067	1.768	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)on1)Nc1ccc(C[C@@H]2NC(=O)NC2=O)cc1	775708051	MOVMZADJCUJDPB-HNNXBMFYSA-N	434.412	1.559	50	20	IDGD	
CO[C@@H]1[C@H](C)[C@@H](NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)C1(C)C	776067644	UBHBRMLJSRREAR-KBRIMQKVSA-N	438.550	1.475	50	20	IDGD	
C[C@@H]1CCN(C(=O)OC(C)(C)C)[C@@H](C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)C1	778298900	DBJQFNPCOPKJTI-CZUORRHYSA-N	429.481	1.459	50	20	IDGD	
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	779389694	VXLIKGLLNIXPNW-LBPRGKRZSA-N	428.511	1.337	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@H]2CC(c3ccccc3[N+](=O)[O-])=NO2)cc(OC)c1OC	781555493	BYMSVYCTCXDBEG-QGZVFWFLSA-N	444.400	1.575	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)c(OC)c1	782121452	ZDTNAFYZQACVAI-NSHDSACASA-N	433.392	1.174	50	20	IDGD	
Cc1ccnc(OC2CCN(C(=O)NNC(=O)c3csc(N4CCOCC4)n3)CC2)c1	782493282	NPMQKRXXYRXDPH-UHFFFAOYSA-N	446.533	1.581	50	20	IDGD	
O=C(NNc1ccc(-n2cccn2)nn1)C(=O)Nc1c(F)cc(Br)cc1F	783436016	GQVVJHYWDLPYQU-UHFFFAOYSA-N	438.192	1.785	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1ccc2nccnc2c1	784834029	REINBWRPSBWYTF-UHFFFAOYSA-N	442.501	1.788	50	20	IDGD	
CCNC(=O)N(C)NC(=O)C(=O)Nc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(C(F)(F)F)c1	784915860	GKTYUKOQYGMADO-VXGBXAGGSA-N	445.442	1.950	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)Nc1nc(-c2cccs2)cs1	785022275	FAXLCHAZYAZDSE-UHFFFAOYSA-N	433.427	1.885	50	20	IDGD	
O=C(COC(=O)[C@H]1CCCN1c1ccccc1)NNC(=O)[C@@H]1COc2ccccc2O1	785123654	ASNBDPZTADZYNR-APWZRJJASA-N	425.441	1.186	50	20	IDGD	
COc1ccc2nc(NNC(=O)C(=O)Nc3ccc(OC)c(-n4cnnn4)c3)c(C)cc2c1	785162725	MGBCGWYIPCEABN-UHFFFAOYSA-N	448.443	1.618	50	20	IDGD	
COc1ccc2nc(NNC(=O)C(=O)Nc3ccc(-n4ncn(C)c4=O)cc3)c(C)cc2c1	785166782	RDODVJYUKFAIJU-UHFFFAOYSA-N	447.455	1.518	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2ccc(OC)c(S(=O)(=O)N3CCCC3)c2)cc1	787556559	PITUOCZMGRVYIJ-UHFFFAOYSA-N	448.501	1.570	50	20	IDGD	
Cc1cc(C(=O)N2CCC[C@H]2C(=O)NNc2ccccc2S(N)(=O)=O)ccc1[N+](=O)[O-]	788228904	QTDJCACZRAOLOU-INIZCTEOSA-N	447.473	1.299	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NNc2ccccc2S(N)(=O)=O)s1	788232221	RENUQGLGKNBWNR-ZDUSSCGKSA-N	444.560	1.000	50	20	IDGD	
COC(=O)COc1ccc(C=NNC(=O)[C@@H](C)CN2C[C@H](C)O[C@H](C)C2)cc1[N+](=O)[O-]	788702076	NUJIDKYSTXTHTR-SOUVJXGZSA-N	436.465	1.342	50	20	IDGD	
O=C(NNC(=O)[C@H]1OCC[C@H]1c1ccccc1)C(=O)Nc1cnn(CC(F)(F)F)c1	789811945	HOGOOCHBDDYBHG-KBPBESRZSA-N	425.367	1.104	50	20	IDGD	
O=Cc1ccc(OCCn2cc(C(=O)NNc3nc4ccccn4n3)nn2)c(Cl)c1	791263077	APONOTPNQJMLBH-UHFFFAOYSA-N	426.824	1.623	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2nnn(Cc3cc(C)no3)c2C)cc(OC)c1OC	794184344	FOMJSUCACJDPHV-UHFFFAOYSA-N	430.421	1.032	50	20	IDGD	
CCC(=NNC(=O)c1cccc(S(C)(=O)=O)c1)c1ccc(Cl)c(S(N)(=O)=O)c1	794493404	JATJMPDQSNLBBX-UHFFFAOYSA-N	443.934	1.935	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)cc1OC	797355143	ANNNDDRKBKCIDI-LLVKDONJSA-N	449.847	1.689	50	20	IDGD	
Cc1ccccc1NC(=O)NNC(=O)C(=O)Nc1ccc(O[C@H]2CCN(C)C2=O)cc1C	799261120	NXLARTCSPXFBQX-SFHVURJKSA-N	439.472	1.704	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@]1(C)CCN(C(=O)NNC(=O)CNC(=O)c2cccs2)C1	801005286	AJRFOPOLQJTFRO-IBGZPJMESA-N	439.538	1.455	50	20	IDGD	
COC(=O)c1cn(CC(=O)NNC(=O)Nc2ccc(Br)cc2Cl)nn1	802040068	FLSOGYFTXMUTAD-UHFFFAOYSA-N	431.634	1.334	50	20	IDGD	
Cc1nc(-c2ncccn2)nc(O)c1CC(=O)NNC(=O)Nc1ccc(OC(F)F)cc1	802045914	UDGHIFPYXOYLFH-UHFFFAOYSA-N	445.386	1.944	50	20	IDGD	
Cc1nn(C)c(Br)c1C(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	802064128	YBWXTGSMQNOTQT-UHFFFAOYSA-N	430.284	1.361	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)C2=NN(Cc3ccccc3)C(=O)CC2)cc1	802064327	MTMQTTRGGZPWAE-UHFFFAOYSA-N	443.485	1.421	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)Nc1ccc(Cl)cc1Cl)N1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O	802090930	KFVDCNIVOQNEEZ-AJVHJNHVSA-N	441.271	1.697	50	20	IDGD	
Cc1ccc([C@]2(C)NC(=O)N(CC(=O)NNC(=O)Nc3ccc4c(c3)OCO4)C2=O)cc1	802101243	ILQGPWIHYUJOOH-NRFANRHFSA-N	439.428	1.344	50	20	IDGD	
C#Cc1cc(F)c(NC(=O)C(=O)NNC(=O)c2nn(CC)c(=O)c3ccccc23)c(F)c1	802566292	HYMFUQVCYPQPQV-UHFFFAOYSA-N	439.378	1.076	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NC[C@H](O)c1ccc(C(F)(F)F)cc1	805044163	ICYXSFXOMBAQMU-LBPRGKRZSA-N	430.408	1.561	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)[C@H]1CCCN1C(=O)C(F)(F)F	806863367	HGHGPBQECJKXOG-GFCCVEGCSA-N	436.456	1.760	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cc3n(n2)CCCC3)cc1OC	806975212	QRWSMAUUFJAKIT-UHFFFAOYSA-N	429.477	1.807	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)C(=O)Nc1ccc(F)cc1OC1CCOCC1	806979545	ZOQOFJLBFHAIJN-UHFFFAOYSA-N	445.447	1.686	50	20	IDGD	
Cc1cccc(CCCNC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)n1	807429793	WHTOYDRBQBSNHR-UHFFFAOYSA-N	445.545	1.751	50	20	IDGD	
CCCNC(=O)[C@H]1CN(C(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2C)c2ccccc2O1	807455206	HIAAHLNNWZHZFU-GOSISDBHSA-N	441.444	1.667	50	20	IDGD	
CSc1nnnn1-c1cccc(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2C)c1	807455625	KDNDTBCJBODEEX-UHFFFAOYSA-N	428.434	1.683	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)NC[C@@H](N2CCOCC2)C(F)(F)F)c1C	807540556	YCBBRBZKRGTUIX-GOEBONIOSA-N	432.443	1.664	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)C(=O)Nc1cccc2c1COC2=O	808934969	ZSRYVYUTNSOONZ-UHFFFAOYSA-N	448.229	1.284	50	20	IDGD	
C[C@@H]1Oc2ccccc2[C@H]1NC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	812430051	FAWMKIHFBALFGC-LIRRHRJNSA-N	446.533	1.166	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1ccnc(N2CCC[C@@H](C)C2)c1	812450650	PNVPONQRZCNXSK-CQSZACIVSA-N	444.561	1.994	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)[C@H]2CN(C(=O)OC(C)(C)C)CCO2)cc1	812728556	PJRYIQKPPMAQQW-OAHLLOKOSA-N	428.511	1.016	50	20	IDGD	
O=C(NNc1ccc(C(F)(F)F)nn1)C1(S(=O)(=O)c2ccccc2)CCOCC1	813498482	NJANZVTYNYKOOU-UHFFFAOYSA-N	430.408	1.962	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCC(=O)NCCN2CCCCCC2)ccc1OC(C)C	814424428	YHTGTYYATFMEOL-UHFFFAOYSA-N	449.552	1.419	50	20	IDGD	
COC(=O)N1CCN(c2ccc(NC(=O)C(=O)NNc3ccc(F)cc3C)cn2)CC1	815590496	XZIAFBURRISZSK-UHFFFAOYSA-N	430.440	1.499	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCc2nncn2C1)C(=O)Nc1ccc(OC2CCCCC2)cc1	815692152	KOBZHIOOHVKICF-CQSZACIVSA-N	426.477	1.338	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1cccc2c1OC(C)(C)C2	815751463	AEHZKXUWHPCKMS-UHFFFAOYSA-N	432.502	1.732	50	20	IDGD	
Cc1cc(-c2nc3cc(F)ccc3n2C)ccc1NC(=O)C(=O)NNC(=O)[C@H]1CCCO1	815778632	ZWDQUAUFHSVBNT-GOSISDBHSA-N	439.447	1.953	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@H]2CSC(c3ccccc3O)=N2)c2ccccc2c1=O	816805579	AQQBZAGYTCQGPF-OAHLLOKOSA-N	437.481	1.445	50	20	IDGD	
COc1cccc(/C=C(/C(=O)NNC(=O)c2nnc(O)c3ccccc23)n2nnnc2C)c1	818028355	IMYLNOYYPHUHEP-BOPFTXTBSA-N	446.427	1.098	50	20	IDGD	
O=C(CNc1ccccc1)NNC(=O)c1ccc2c(c1)SC1=NS(=O)(=O)CCN12	823328601	NUYMWCVLKTXMNN-UHFFFAOYSA-N	431.499	1.171	50	20	IDGD	
CCCCN(CC(=O)NNC(=O)c1ccccc1)c1c(O)nc(=O)n(CC(C)C)c1N	841512737	RNPBSMZJMKQRQU-UHFFFAOYSA-N	430.509	1.255	50	20	IDGD	
CS(=O)(=O)CC[C@@H](NS(=O)(=O)c1ccccc1)C(=O)NNc1ccc(F)cc1	849838717	QABDYSQCTRKEOC-MRXNPFEDSA-N	429.495	1.051	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CNc2ccc(C)cc2C)cc1S(=O)(=O)NC(C)C	913164704	PWGLOCQLMZFEQX-UHFFFAOYSA-N	448.545	1.872	50	20	IDGD	
C=CCNC(=S)NNC(=O)[C@H](CCSC)NS(=O)(=O)/C=C/c1ccccc1	913435510	OFPQLNVWSUHOSK-VOMSXAGXSA-N	428.605	1.380	50	20	IDGD	
COc1ccnc(NNC(=O)c2ccc(OS(=O)(=O)c3cccc([N+](=O)[O-])c3)cc2)n1	914763142	RXTULBNIORACDV-UHFFFAOYSA-N	445.413	1.918	50	20	IDGD	
CCNC(=O)COc1ccc(C=NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1OC	915052472	LRZPOLFMUKNDCU-UHFFFAOYSA-N	433.486	1.378	50	20	IDGD	
NS(=O)(=O)c1ccc(CCNC(=O)NNC(=O)c2cc3c(s2)CCCCC3)cc1	915884258	ZXKQATXZQFAOSO-UHFFFAOYSA-N	436.559	1.851	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)COc1ccc(Br)cc1)c1nnc2ccccn12	916222320	YXSFLAWIXRSOQE-NSHDSACASA-N	433.266	1.962	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)CCC(=O)c2ccc(F)cc2F)c1	916741632	NVCXFCKDPOYUSP-UHFFFAOYSA-N	439.440	1.639	50	20	IDGD	
CC(C)(C)C(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1ccc2nc(O)[nH]c2c1	917182627	NANNDNVNWQNQRB-UHFFFAOYSA-N	431.474	1.876	50	20	IDGD	
NS(=O)(=O)c1ccc(CCC(=O)NNC(=O)c2ccc(F)cc2Br)cc1	918340571	SLEIIBPTYWBNPU-UHFFFAOYSA-N	444.282	1.629	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)c2cccc(OC)c2O)cc1Br	919958191	GJCMDHQTAATXIW-UHFFFAOYSA-N	431.264	1.795	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2n[nH]c(C3CC3)c2Br)c2ccccc2c1=O	920850586	ZWFFPXCBEXMSCL-UHFFFAOYSA-N	445.277	1.854	50	20	IDGD	
CC(C)C[C@H](C(=O)NNC(=O)NCCc1cccs1)N1C(=O)[C@H]2CC=CC[C@@H]2C1=O	920860593	PSBJLCXOQCRUGF-YESZJQIVSA-N	432.546	1.987	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)N[C@@H]1CC(=O)N(c2ccccc2)C1	921078396	WEQZTHALIUQUKK-CQSZACIVSA-N	447.289	1.964	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Cn2nc3n(c2=O)CCCCC3)cc1Br	1116033663	WWSFFOVURQFDPG-UHFFFAOYSA-N	438.282	1.004	50	20	IDGD	
COc1cccc(C[C@@H](O)C(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)c1	1255540395	XKMFDFBXTYTKHZ-QGZVFWFLSA-N	436.509	1.329	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3c(F)cncc3F)C2)C1	1779731705	FJIRPANFPRPYTP-APPDUMDISA-N	432.265	1.977	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CC23CCCN2CCC3)C1	1780665463	UGKWKUQOSNAVML-DBXWQHBBSA-N	442.000	1.773	50	20	IDGD	
CC(=O)N[C@@H](C(=O)N1CC[C@@]2(CN(C(=O)[C@@H](F)Cl)CCO2)C1)c1ccc(F)cc1	1780914850	POZZXJHNLGDKHR-MDZRGWNJSA-N	429.851	1.367	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)CCS(=O)(=O)c3ccccc3)CCO2)C1	1781213066	LAEIBKZEEQFRCA-XLIONFOSSA-N	442.965	1.698	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H]1CC(=O)N(C3CCCC3)C1)CCO2	1781214967	GPMRVXLGUQVCHK-WJPUGNRLSA-N	425.957	1.625	50	20	IDGD	
COCCn1nccc1C(=O)N1CCO[C@@]2(CCN(C(=O)[C@](C)(Cl)CCl)C2)C1	1781229951	NGBMBJJDESGDIB-MSOLQXFVSA-N	433.336	1.209	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C1CCC(CO)CC1)C2	1782171818	GVKOIURDXZEFMU-YRAPMSRFSA-N	430.973	1.553	50	20	IDGD	
CNCCCC(=O)N1CCO[C@]2(CCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1	1782863875	BGJSVTWHGICAJZ-JRVGGCGHSA-N	432.471	1.701	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc4nonc4c3)CCO2)C1	1783347152	AKIQRGWZKSNFEY-ACJLOTCBSA-N	437.294	1.840	50	20	IDGD	
O=C(C(Cl)Cl)N1CCO[C@@]2(CCN(C(=O)[C@H]3C[C@@]34C(=O)Nc3ccccc34)C2)C1	1783499343	GLOIBTYAPYUGCL-GBLZOACLSA-N	438.311	1.530	50	20	IDGD	
COc1ccc([C@@H](O)C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)C(Cl)Cl)C[C@@H]32)cc1	1783768800	KBRWWWYHHMUJKR-QCEMKRCNSA-N	431.316	1.512	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]3C2)cn1	1783970231	UCGMLALTEYDARV-TUUVXOQKSA-N	440.338	1.715	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)N1CC[C@@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1785333978	CMCOCEPLQUMPME-HXUWFJFHSA-N	431.961	1.996	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cn(C)nc3OC)[C@H]2C1	1785867248	SJHIEJGACHBBKD-JURCDPSOSA-N	443.342	1.196	50	20	IDGD	
CCC[C@@H](NC(C)=O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCBr)[C@H]2C1	1786408084	GPGKRYDWQVVTSJ-JONQDZQNSA-N	432.359	1.056	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN3CCCCC3)[C@H]2C1	1786711149	VENHPRMEWSUSFX-QZWWFDLISA-N	430.387	1.483	50	20	IDGD	
COc1nccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)Br)C[C@@H]32)c1F	1787139751	WQKYEQUSRYRVER-XWUBHJNHSA-N	444.301	1.606	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)c1n[nH]c2c1CCCC2	1787314282	CKVTYEFOTLFYTL-ZAJUMQRFSA-N	443.317	1.572	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCN3Cc4ccccc4C3=O)C[C@@H]21)[C@H](F)Cl	1787447498	ZAIHIUIXSTUVBG-XPYUAMARSA-N	437.899	1.547	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4c(c3)NC(=O)CO4)[C@H]2C1	1788362606	VDEGNASOIFIOMU-XSWJXKHESA-N	435.908	1.628	50	20	IDGD	
COc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]32)ccn1	1788906246	BLCMJRVYPKRTNO-XLPNERPQSA-N	430.332	1.920	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3c(O)cc(O)cc3O)[C@H]2C1	1790156629	IUZVWBPVHSNLEW-JCTLKHEBSA-N	447.315	1.633	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(C)(C)CNC(C)=O)C[C@@H]21	1790958516	SFHYKOFSYWCFMF-VGWMRTNUSA-N	446.386	1.302	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc(C#N)cc3)C[C@@H]21	1791054924	YRMBWODISJMWDP-QCSYZSNVSA-N	434.334	1.864	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(O)c(F)c3)C[C@@H]21	1791060971	NHKSABXRSWJAGA-SDPXSBNPSA-N	429.286	1.908	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4nc(C)ccc4o3)C[C@@H]21	1791254778	ROVHYLIWMOICSJ-ZTENYAIWSA-N	435.908	1.983	50	20	IDGD	
CN(C)c1ccc(CCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](O)CCl)C[C@@H]32)cc1	1791465898	HYXXMRQDZFQTPD-FFGOWVMKSA-N	437.968	1.265	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccnc1S	1792502156	BVDOVRGGZMXDQC-XCCSTKFXSA-N	428.352	1.747	50	20	IDGD	
COc1ccc([C@@H](O)C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)Br)C3)cc1	1792715521	JXIMSVDGMXLFOZ-MCKBVIGDSA-N	441.322	1.102	50	20	IDGD	
Cc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)CBr)n(C(F)F)n1	1792872463	JFSSKXIRPRSORA-SGESHTKJSA-N	449.296	1.821	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](NC(=O)c1ccccc1)[C@@H](C)O	1792880734	WZTZYFWDZDRMAU-FSPSIFDESA-N	435.952	1.821	50	20	IDGD	
COCCn1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](C)CBr)n1	1792987807	CCGDYYLVTMXXMY-XQLPTFJDSA-N	427.343	1.812	50	20	IDGD	
COCCOCCOCCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](C)CBr	1792993496	LDOYVIYDMDBMAL-NXOAAHMSSA-N	449.386	1.725	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cn1cccn1	1796305263	WVWAZRPZETYGRR-FZKCQIBNSA-N	439.944	1.653	50	20	IDGD	
CC[C@@H](CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Cl)NC(=O)OC(C)(C)C	1796367733	RTSZQDHUVOHZCO-AKIOZOGOSA-N	435.924	1.804	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H]1CCCN(C)C1)C2	1796892799	UGENUSYODZOMQB-DXFUESDRSA-N	428.537	1.100	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2nncn2c1	1797465573	YVHTWVWLDWHJGL-FQLMCAECSA-N	436.310	1.106	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnccc1C(=O)NN	1798443032	NLSJQJBGBONRKQ-OXIQGZBJSA-N	438.326	1.110	50	20	IDGD	
O=C(CC12CCCN1CCC2)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2	1799214684	RPHOZBZKJGKNKY-XRGAULLZSA-N	432.334	1.285	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCn1c(=O)oc3ccccc31)C2	1799263246	HTGIVJXEIJLYMW-NXEZDXNNSA-N	435.908	1.592	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)NC(=O)c1ccc(F)cc1)C2	1799268927	OFKTVCNTKIYNLT-IVFVNLKQSA-N	439.915	1.551	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(-n2cccn2)cc1	1799601077	SSULZUHFGNZSBG-NBMJBFSESA-N	432.908	1.329	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc3nc[nH]c13)C2	1800639019	GASGZFUXNLXNMC-FAXLKDOZSA-N	435.322	1.940	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CCc3ccccc3O1)C2	1800762921	KJPJHHKHOGSVKB-QMQAMEMWSA-N	437.334	1.753	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCCC#C[Si](C)(C)C)C2	1800977343	XWUHHSPWHUDKAF-ZMMAXQRCSA-N	429.033	1.881	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(N3CCCC3)ccn1)C2	1800978176	NVFMPHIYRIXBSQ-HIRMHNASSA-N	436.940	1.139	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(Cl)c(F)c1)C2	1801012386	BRRDLWKFWHIXDA-HBCWATKFSA-N	440.903	1.055	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(F)cc(F)c1F)C2	1802343296	AFQJJCHANJPNAA-BTTYYORXSA-N	426.439	1.729	50	20	IDGD	
CC(=O)NC(C)(C)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@H]1c1cccnc1	1803597173	YRZXSYLYOHVTRN-SOUVJXGZSA-N	443.317	1.693	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC2(CCCN(C(=O)CNC(=O)N(C)C)C2)CC1	1805032259	AATLAMPMDPALQE-AWEZNQCLSA-N	431.375	1.520	50	20	IDGD	
Cn1cnc(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](F)Br)[C@@H]2c2cccnc2)n1	1805327278	WIUVHRXXHNLGCG-YNEHKIRRSA-N	425.262	1.220	50	20	IDGD	
CN1CCN(CCC(=O)NC[C@H]2CCN(C(=O)C(Cl)Cl)[C@@H]2c2cccnc2)CC1	1806915741	COPPDYBVOZIUST-SJLPKXTDSA-N	442.391	1.529	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)CCN2CCOCC2)[C@@H]1c1cccnc1	1806957017	QVYLYFUIECTHRT-BJLQDIEVSA-N	438.956	1.064	50	20	IDGD	
Cc1cccc(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)n1	1807361643	GTKWAHSWCKYSKV-UGKGYDQZSA-N	444.300	1.098	50	20	IDGD	
CC(C)C1(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)CCC1	1807364220	CXEBEELAXDULAN-IFMALSPDSA-N	449.360	1.907	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)Cc2ccn(C)n2)[C@@H]1c1cccnc1	1807516774	GRKAKVBKJGGNHN-JOQOYGCGSA-N	434.338	1.847	50	20	IDGD	
CCOCC(=O)N1CC[C@@H](CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@@H]1c1cccnc1	1808413467	BBDZPDNIIYBDCL-QGJUGNDFSA-N	440.504	1.258	50	20	IDGD	
C[C@H](Cn1cncn1)C(=O)NC[C@@H]1CCN(C(=O)CO[Si](C)(C)C)[C@@H]1c1cccnc1	1810476039	BLFXWQBJTUXXLB-IMFGXOCKSA-N	444.612	1.867	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)CS(C)(=O)=O)[C@H]1c1cccnc1	1812774732	FHONKTHJKQXSGN-DZKIICNBSA-N	446.367	1.306	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)CCn2ccnn2)[C@H]1c1cccnc1	1812779353	SWQNXWHTSKTSJW-BQFCYCMXSA-N	449.353	1.943	50	20	IDGD	
CCOc1cnc(C(=O)N2CC[C@H](CNC(=O)[C@H](Cl)COC)[C@@H]2c2cccnc2)cn1	1813029742	VNTUEXHGORQORI-MDZRGWNJSA-N	447.923	1.844	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2sccc2F)[C@@H]1c1cccnc1	1813069006	RNQIWFZNKCDODZ-DNVCBOLYSA-N	447.536	1.975	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)c(C)o1	1813070112	FGLTUMVVLJLRAX-GCJKJVERSA-N	441.532	1.984	50	20	IDGD	
Cc1ncccc1C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1813070307	HBFGLRNWROGYTI-XMSQKQJNSA-N	438.532	1.478	50	20	IDGD	
C[C@@H](CBr)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)Cn2cnnn2)[nH]n1	1814780040	FDXFPGZXRQXQKF-JQWIXIFHSA-N	425.291	1.120	50	20	IDGD	
O=C(CCC1CCC1)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1	1815335631	IJBOXSWVFYMICM-INIZCTEOSA-N	427.335	1.629	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)Cc3cccs3)sc2C1	1815596133	QMAKAPNDUQPVBD-LBPRGKRZSA-N	435.575	1.732	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)CCc2cn[nH]c2)n[nH]1	1815878058	URLBVLXCSNXVGM-INIZCTEOSA-N	430.513	1.131	50	20	IDGD	
Cc1cncc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)c1	1816496489	MFLUXAXKAATIIL-IBGZPJMESA-N	433.277	1.413	50	20	IDGD	
Cc1cncc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)c1	1817470656	GDHZJVFGPWXBIL-LJQANCHMSA-N	433.277	1.413	50	20	IDGD	
Cc1nc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)cs1	1817470818	HUOJGWQARHJYKE-KRWDZBQOSA-N	439.306	1.474	50	20	IDGD	
CCOc1ccc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@@H](Cl)COC)CC3)nn1	1821760221	CGMUBMQECJWVLZ-QWRGUYRKSA-N	439.925	1.811	50	20	IDGD	
C[C@H](Br)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnc(O)nc2O)[nH]n1	1822187624	YBAYXKZPBMJINN-GZMMTYOYSA-N	439.270	1.700	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)C(=O)Nc2cccnc2)[nH]n1	1822368653	CAYHEGUNLUJEOO-DZGCQCFKSA-N	434.884	1.689	50	20	IDGD	
C[C@H](C(=O)N[C@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1)n1ccnn1	1823009121	JXWGBTRQUKDSIH-FYBVGQRMSA-N	431.291	1.598	50	20	IDGD	
CC(C)(CCl)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H]3CCCS3(=O)=O)sc2C1	1824925505	JAZLODDWBPDTDF-ZWNOBZJWSA-N	433.983	1.897	50	20	IDGD	
CC[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)COCCOC)CC2	1825444983	HNBNDANZADTWQI-WDEREUQCSA-N	434.356	1.892	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](C)n1cnnn1)CC2	1825648076	XVFKQAGYRDXCRU-DJLDLDEBSA-N	428.316	1.086	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)[C@H]3CCc4nc[nH]c4C3)sc2C1	1826626151	RQOMJGVYVZBZPT-SRVKXCTJSA-N	437.953	1.837	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)CSc3nc[nH]n3)sc2C1	1826676040	XJCJLBSTSSGKOP-RKDXNWHRSA-N	430.943	1.219	50	20	IDGD	
C[C@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1)C1(O)CCC1	1827049335	RMTLMEQYTJJTJP-DYESRHJHSA-N	442.365	1.151	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC[C@@H]1C1CCN(C(=O)[C@H]2CC[C@H](O)CC2)CC1	1827054709	KAMLDCQZNKPJGQ-STZQEDGTSA-N	442.365	1.151	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(=O)n3[nH]nnc3n2)CC1	1827400213	IOJHGVRMAMUHLI-HIFRSBDPSA-N	435.916	1.063	50	20	IDGD	
N#CCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Cl)CCN2C(=O)OCc1ccccc1	1829052618	PNBXPNGUVNIVMX-PXNSSMCTSA-N	436.871	1.887	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccn(C)c3)C2)C1	1830535082	IPUDDJLHIQCIER-KSSFIOAISA-N	428.327	1.126	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)COc3ccc(O)cc3)C2)C1	1831639117	MHWJEATVGJNZSY-GHTZIAJQSA-N	440.924	1.635	50	20	IDGD	
C[C@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)Cn3ccnc3)CC2)CC1	1833261980	GIZNNSRUGNJBRC-OAHLLOKOSA-N	440.386	1.486	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3ccc4ncncc4c3)CC2)CC1)[C@H](O)CCl	1833310106	IQQUHYWMSVBQCU-HXUWFJFHSA-N	445.951	1.415	50	20	IDGD	
O=C(Cc1cccc(F)c1)NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1834495374	SDQLPFXODSMRES-LJQANCHMSA-N	425.932	1.540	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCC(N2CCC(NC(=O)CN3CCOCC3)CC2)CC1	1834618717	ZBWDYSJOQJKVKW-UHFFFAOYSA-N	429.005	1.155	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)CSC(=N)N)CC2)CC1	1834656132	AQXXDOMWHGGNMR-CQSZACIVSA-N	448.431	1.358	50	20	IDGD	
CC[C@H](C)[C@H](N)C(=O)NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1	1834684785	SEMLZSPUAANUPT-KSSFIOAISA-N	431.419	1.716	50	20	IDGD	
Cc1ccsc1C(=O)N1CCOC[C@]2(CN(C(=O)CCBr)CCO2)C1	1834819659	XSFIZMSTHGEEIU-KRWDZBQOSA-N	431.352	1.912	50	20	IDGD	
Cn1ncc2c(C(=O)NC3CCN(C4CCN(C(=O)[C@H](O)CCl)CC4)CC3)cccc21	1835417697	ITYGUMXGUGLKNW-HXUWFJFHSA-N	447.967	1.358	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H]3CNc4ccccc43)CCO2)C1	1835705351	GXWHQQYHRIORMG-VGOFRKELSA-N	435.952	1.917	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)CCN3C(=O)C=CC3=O)CC2)CC1	1836995488	BUMXOZSCXFMPIO-QGZVFWFLSA-N	439.940	1.318	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3ccc(O)cn3)CC2)CC1	1837586576	FVGXCLFQSGPVFA-KRWDZBQOSA-N	425.913	1.653	50	20	IDGD	
CCC1(C(=O)N2CCC(OC3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)CCC1	1837920385	RJMRKMXLQZAMOQ-UHFFFAOYSA-N	442.365	1.559	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccnn3C(C)C)CCO2)C1	1838019044	VRCRCBGZZQDBAK-UZLBHIALSA-N	426.945	1.942	50	20	IDGD	
CC(=O)N[C@H](C)C(=O)N1CCC(OC2CCN(C(=O)CO[Si](C)(C)C)CC2)CC1	1838431901	BCWRWDJEPSQXAN-OAHLLOKOSA-N	427.618	1.361	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(N(C)C)c3)CCO2)C1	1838925451	UQIPEOXZDOHQSI-RXVVDRJESA-N	439.940	1.076	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(=O)c3ccc(Cl)cc3)C2)C1	1839141792	SQRUYONXRPLECI-JXFKEZNVSA-N	443.327	1.997	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3CCN(C(C)C)CC3)C2)C1	1839142000	BDAZWDWPCSSJDX-GHTZIAJQSA-N	429.989	1.581	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)OC(=O)NC(C)C)C2)C1	1839146998	DGPNGCGHQRNPQD-QRWLVFNGSA-N	447.960	1.373	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)C2)C1	1839147333	NEXRHOJHTPEMCB-LPHOPBHVSA-N	443.859	1.821	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CCC[C@H](C(=O)OC)C3)C2)C1	1839149096	SZHKPUOZWFYVEY-JJDSTIRJSA-N	444.956	1.440	50	20	IDGD	
Cn1cc(F)cc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2	1839153054	UASJGKYJIQCONZ-MSOLQXFVSA-N	436.311	1.471	50	20	IDGD	
C=C(C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1)C(F)(F)F	1839894055	GUDSHVZWNVCMAR-GJZGRUSLSA-N	433.254	1.798	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(O)cn3)C2)C1	1839963721	UBMCNQYWAZNVRG-KBXCAEBGSA-N	442.310	1.031	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ncc(C)s3)C2)C1	1839963782	VRTDSABSEGWMHC-DYVFJYSZSA-N	446.367	1.695	50	20	IDGD	
COCc1c[nH]c(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)c1	1840034821	YAPLBVBGSUFXAZ-ACJLOTCBSA-N	444.326	1.015	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3cc(C)cs3)C2)C1	1840150400	KKBWRAZKFGZDOT-XLIONFOSSA-N	444.981	1.699	50	20	IDGD	
Cc1cccc(F)c1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)Br)C2)C1	1840651982	FADMSTALXSSXSX-AUUYWEPGSA-N	443.313	1.988	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)C2(CNC(=O)OC(C)(C)C)CC2)C1	1841095292	WGCNTFKKNOVIAZ-CQSZACIVSA-N	429.945	1.749	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)c1nn(-c3ccccc3)c3c1COC3)C2	1846361897	UQRJSVNMMVVMNU-QGZVFWFLSA-N	444.919	1.973	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@H]1CCC(=O)N1C(=O)OC(C)(C)C)C2	1846365259	JKODSQJRJZDBOZ-KBPBESRZSA-N	443.928	1.370	50	20	IDGD	
C#CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)[C@H](Cl)COC)C1	1846365808	WUIIZCLWZDYEOT-HUUCEWRRSA-N	427.929	1.360	50	20	IDGD	
O=C(COC(=O)CCC(=O)c1ccc2c(c1)OCCCO2)NNC(=O)c1cccs1	10470076	JOELAIWLHCTKIK-UHFFFAOYSA-N	432.454	1.877	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)[C@H]1CC(=O)N(c2cc(C)ccc2OC)C1	15668573	YWVAKEPUXFJZFJ-HNNXBMFYSA-N	427.457	1.592	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)[C@H]2CN(C(C)=O)c3ccccc3O2)cc1	18071424	USAFVYCJXRDNIL-JLTOFOAXSA-N	427.457	1.814	50	20	IDGD	
Cc1cc(C)cc(OCc2nnc(SCC(=O)NNC(=O)c3ccccc3)n2N)c1	24197345	CPCNKCZVDLRJAE-UHFFFAOYSA-N	426.502	1.741	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)CNC(=O)c2ccc(Br)s2)c1	108108439	HMFCHDBRTIMLBJ-UHFFFAOYSA-N	426.292	1.775	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)c2ccc(S(N)(=O)=O)c(Cl)c2)cc1OC	725907742	PTYOLZOONYMJNW-UHFFFAOYSA-N	441.893	1.860	50	20	IDGD	
NS(=O)(=O)c1ccc(CNC(=S)NNC(=O)c2cc(-c3ccccc3)[nH]n2)cc1	726436193	UTZOVFYSUMWWMM-UHFFFAOYSA-N	430.515	1.033	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)[C@H]1CC(=O)N(Cc2ccc(OC)cc2)C1	726496704	GYAJVYNKEAUXRF-KRWDZBQOSA-N	441.484	1.669	50	20	IDGD	
COC(=O)c1ccc(O)c(C=NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1	726736463	KGSPGJVQIYTVKO-UHFFFAOYSA-N	431.470	1.727	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3ccccc3OCC#N)cc2)CC1	728216340	WVHXZYINYMZVGQ-UHFFFAOYSA-N	429.502	1.282	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)CCc2c(C)nc(O)nc2O)c1	728529532	BVPCXEQCXXOPGD-UHFFFAOYSA-N	425.239	1.361	50	20	IDGD	
CC(C)[C@@H](NC(=O)c1cccs1)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	728845371	INTINACTUOJFNX-MRXNPFEDSA-N	430.534	1.357	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)CCCCCC(=O)NNC(=O)c2ccc(C#N)cc2)cc1	729843124	XYWGPMMBXMRGSD-UHFFFAOYSA-N	446.467	1.603	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CCc2ccccc2O)cc1S(=O)(=O)NC(C)(C)C	730034117	TYTXRSJANLZGSF-UHFFFAOYSA-N	449.529	1.871	50	20	IDGD	
Cc1ccc(-n2nc(C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)c3c2CCC3)c(F)c1	730516414	YGRPEPGCIFSBQF-UHFFFAOYSA-N	446.446	1.859	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCN(c2ccc3c(c2)OCCO3)C1=O)c1cc2c(s1)CCC2	730516920	PDLPKCDFVBONLI-AWEZNQCLSA-N	427.482	1.822	50	20	IDGD	
O=C(CCc1nc(-c2ccsc2)no1)NNC(=O)c1csc(N2CCOCC2)n1	731689890	ZIXCRSXLKNZFFS-UHFFFAOYSA-N	434.503	1.485	50	20	IDGD	
CC(C)(C)OC(=O)NCc1nc(C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cs1	732727808	ULYBWDIHADIUOE-AWEZNQCLSA-N	434.474	1.769	50	20	IDGD	
COCCN1C[C@H](C(=O)NNc2nc3ccccc3c(=O)n2-c2cccc(C)c2C)CC1=O	733265239	YJQAXAZYYITVFB-QGZVFWFLSA-N	449.511	1.941	50	20	IDGD	
N#Cc1ccc(N2C(=O)N[C@H](CCC(=O)NNC(=O)NCCc3cccs3)C2=O)cc1	733777076	ZYGOIFGMTXURFO-MRXNPFEDSA-N	440.485	1.398	50	20	IDGD	
CN(C)C(=O)[C@H]1CCC[C@H](NC(=O)NNC(=O)COc2ccc(Br)cc2)C1	734221199	MBMOXUAWRUGQHY-JSGCOSHPSA-N	441.326	1.805	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)N[C@@H]3CSc4ccccc43)nc2)CC1	735586491	MARVRWMUOLAGMS-MRXNPFEDSA-N	448.574	1.491	50	20	IDGD	
COc1ccc(C(=O)N2CCC(NC(=O)NNC(=O)c3ccccc3O)CC2)cc1OC	735761819	YUBVLMJGGBNUFL-UHFFFAOYSA-N	442.472	1.658	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccccc1	737636679	BPCQUFNBTQNMNW-LJQANCHMSA-N	431.514	1.594	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)c1cccnc1S[C@H](C)C(=O)N1CCCC1	740852577	DEMPXGOGXUZMPR-CYBMUJFWSA-N	435.550	1.250	50	20	IDGD	
O=C(NCc1cc(F)ccc1N1CCOCC1)NNC(=O)c1nnc(O)c2ccccc12	741092300	BXCYOMOBSZKSLJ-UHFFFAOYSA-N	440.435	1.455	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)Cn2nnc(-c3ccc(Br)cc3)n2)cc1	742449037	FPACYGJHGNNEHK-UHFFFAOYSA-N	426.234	1.435	50	20	IDGD	
Cc1ccc([C@H](CNC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)N(C)C)cc1	743334229	RKVXABPJQJFLLH-KRWDZBQOSA-N	446.577	1.843	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@H]2CCCN(C(=O)c3ccccc3)C2)cc1	743829974	IWHJHPDSWRFPRD-INIZCTEOSA-N	444.513	1.795	50	20	IDGD	
COc1ccc(OC)c(CN2CCN(CC(=O)NNC(=O)c3cccc(C)c3)CC2)c1	744382898	CSWZYMOQZARTLB-UHFFFAOYSA-N	426.517	1.591	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CN2CCC(C(=O)NCc3ccc(F)cc3)CC2)c1	744387952	ZQKQPQHDILXCRO-UHFFFAOYSA-N	437.475	1.487	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)N[C@@H]1CC(=O)N(CCOc2ccccc2)C1	745845796	AIJZUVSKASOCJG-DOTOQJQBSA-N	444.463	1.603	50	20	IDGD	
COc1cc(C=NNC(=O)[C@H](C)CN2C[C@@H](C)O[C@H](C)C2)cc(Cl)c1OCC(N)=O	745986568	LHQIKEKCTVVOHU-MGPQQGTHSA-N	440.928	1.408	50	20	IDGD	
O=C(NNC(=O)[C@H]1CN(Cc2nc(O)c3ccccc3n2)CCO1)NC1CCCCC1	746094383	IGQVZVRDJNUQFP-QGZVFWFLSA-N	428.493	1.199	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NNC(=O)CCOc2ccccc2)s1	747179483	ZFTSUAOWZRXOMG-INIZCTEOSA-N	437.543	1.826	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2ccc(C(=O)NNc3nccn(C)c3=O)cc2)cc1	747938707	YFURJWALOALOAW-UHFFFAOYSA-N	429.458	1.347	50	20	IDGD	
C[C@H](C(=O)NNc1ccc(F)cc1Br)N1C(=O)[C@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O	748074325	XZFWPYQTAFFQIP-QXVRGBBPSA-N	426.242	1.582	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1CC(CC(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1)C2	748286945	DSKJIYAHNXDWFY-ILXRZTDVSA-N	429.539	1.137	50	20	IDGD	
CC[C@@H](NC(=O)NNC(=O)C(=O)N1CCCC1)c1ccccc1OCC(=O)N1CCCC1	748458477	AAJKSRWWEJUPCI-QGZVFWFLSA-N	445.520	1.092	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)cs1	748522462	BDGXKYHOSYEYDY-UHFFFAOYSA-N	429.423	1.446	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)[C@H]1CC(=O)N(c2cn[nH]c2)C1	748527236	KTBOJDBOHBTHCD-QWRGUYRKSA-N	436.266	1.140	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H]2CCCN(Cc3cccnc3)C2)c1	749160589	LUDXZLOFZYCZRS-SFHVURJKSA-N	445.545	1.005	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CCc2ccccc2)cc1S(=O)(=O)N1CCCC1	749803939	MKXLGOMCJIDELS-UHFFFAOYSA-N	431.514	1.874	50	20	IDGD	
CC(C)Cn1cnc(S(=O)(=O)NNC(=O)c2ccc(CSc3nncn3C)cc2)c1	749864509	MJRCBDSSIVJDFS-UHFFFAOYSA-N	449.562	1.583	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCC(OC[C@H]3CCCCO3)CC2)cc1OC	750062522	OKDNYEZIOZVDJS-GOSISDBHSA-N	435.521	1.515	50	20	IDGD	
CNC(=O)Cc1noc(COC(=O)/C(C#N)=C\c2cn(CCC#N)nc2-c2ccccc2)n1	750303825	HEFYZYCJTRLRDL-YBEGLDIGSA-N	445.439	1.786	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)N[C@@H]2CCN(c3ccccn3)C2)c2ccccc2c1=O	753733190	UTVNCTKDFVJFIG-OAHLLOKOSA-N	435.488	1.595	50	20	IDGD	
CN(Cc1ccc(Br)c(F)c1)C(=O)NNC(=O)CNC(=O)c1ccco1	755240901	XVBLSDXOAMCHLS-UHFFFAOYSA-N	427.230	1.784	50	20	IDGD	
O=C(CSc1nnc(-c2cccnc2)n1-c1ccccc1)NNC(=O)Cc1cc[nH]n1	755280346	VPDMJOPLTSDUBF-UHFFFAOYSA-N	434.485	1.535	50	20	IDGD	
CCOCC(=O)NNC(=O)Nc1ccc(NC(=O)c2cccc(S(C)(=O)=O)c2)c(C)c1	755622326	GPXGEEGZSYCDFF-UHFFFAOYSA-N	448.501	1.840	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)CNC(=O)c2ccccc2C(F)(F)F)cn1	755671573	YUVJTQQNAHUPTP-UHFFFAOYSA-N	427.408	1.857	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)Nc1ccc(CC(=O)N2CCSCC2)cc1	756280718	NYMRCPOEBRNKIG-UHFFFAOYSA-N	442.497	2.000	50	20	IDGD	
NS(=O)(=O)c1cc(F)cc(NC(=O)NNC(=O)c2ccc(F)cc2Br)c1	756517136	VYTQBZVOEOAFIV-UHFFFAOYSA-N	449.233	1.841	50	20	IDGD	
CCOC(=O)[C@H](C)NC(=O)c1ccc(NC(=O)NNC(=O)Cc2ccncc2)cc1F	756819160	QVQOGIZFNOVCFL-LBPRGKRZSA-N	431.424	1.298	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)Nc2ccc3nc(N4CCOCC4)oc3c2)cc1	757776516	GMSNQGSECSPBCF-UHFFFAOYSA-N	441.444	1.905	50	20	IDGD	
O=C(NNc1nc(O)c2ccccc2n1)c1ccc(S(=O)(=O)NC[C@H]2CCCO2)cc1	758298334	HRVDCLYPIKCMKM-CQSZACIVSA-N	443.485	1.550	50	20	IDGD	
O=C(NN/C=C1\C(=O)N(c2ccccn2)C(=O)c2ccccc21)C(=O)Nc1ccccn1	758414346	CTYKXCPVWNDBPQ-SSZFMOIBSA-N	428.408	1.264	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCCc2cccc([N+](=O)[O-])c2)nc1	759681648	YIHGYZXVXIRZDU-UHFFFAOYSA-N	436.494	1.889	50	20	IDGD	
CCO[C@@H]1C[C@H](NC(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)[C@]12CCCO2	760144097	UQJBRDGPZYIPLW-GSHUGGBRSA-N	443.504	1.648	50	20	IDGD	
O=C(CSCC(F)(F)F)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	761200145	NEMKJHCXQSYUDE-UHFFFAOYSA-N	425.454	1.528	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(-c2noc(C(F)F)n2)cc1	763443240	YIQOKWGGFQOFIA-UHFFFAOYSA-N	446.326	1.982	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1ccn(-c2cccc(F)c2C#N)n1	763625945	ZVXNOWLMVILIRN-UHFFFAOYSA-N	446.402	1.239	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2cccc(CN3CCCC3=O)c2)c1	763646120	BRNSTGNBNBLYJG-UHFFFAOYSA-N	438.484	1.591	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cc(C(=O)NC3CC3)ccc2C)cc1	763662610	XVRCXBCEAHLFLK-UHFFFAOYSA-N	440.456	1.061	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2C[C@@]23CCOC3)c1	763727299	BVCBBDQECSUNMA-HRAATJIYSA-N	445.497	1.684	50	20	IDGD	
O=C(CN1CCCc2ccccc21)NNC(=O)C(=O)Nc1ccc(CCN2CCCC2)cc1	763727925	HCZCETQSAHVRQH-UHFFFAOYSA-N	449.555	1.864	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)C(=O)Nc2cccc(-c3nccs3)c2)c2ccccc2c1=O	763789718	BEQVHMOKYUKTAR-UHFFFAOYSA-N	448.464	1.457	50	20	IDGD	
COC(=O)c1cc(Cl)cc(NC(=O)C(=O)NNC(=O)c2nnc(O)c3ccccc23)c1	763791582	WLQSAKWFJSSADG-UHFFFAOYSA-N	443.803	1.175	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)C(=O)Nc2nc(C)cs2)c2ccccc2c1=O	763801035	BBRUZLFHWGHVLN-UHFFFAOYSA-N	428.474	1.361	50	20	IDGD	
Cc1cccc(C(=O)N2CCCC2)c1NC(=O)C(=O)NNC(=O)COc1ccccc1C#N	763809382	VVKLKNDGLWVDEA-UHFFFAOYSA-N	449.467	1.268	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(NC(=O)[C@@H](C)n3cncn3)cc2)cc1	763831336	VJZUUTNJEKXCAI-CQSZACIVSA-N	449.471	1.440	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)ccc1N1CCCC1=O	763839066	YISIWNMLBQHVAL-UHFFFAOYSA-N	444.419	1.126	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2nnc(C(C)(C)C)s2)cc1	763861906	TVFXKIGJTUYEAI-NSHDSACASA-N	435.506	1.788	50	20	IDGD	
O=C(CCSc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccccc1-n1ccnn1	763897093	UUAMIKARSKHRDH-UHFFFAOYSA-N	428.449	1.675	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)ccc1F	763998135	MCOKBFBISFCDOR-UHFFFAOYSA-N	427.186	1.103	50	20	IDGD	
CC(C)CC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1	764004421	VOQHCEFBGRCDRN-UHFFFAOYSA-N	440.456	1.842	50	20	IDGD	
CC(=O)N(Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)nc2)cc1)C(C)C	764099758	STOXIXTVRYFNLY-UHFFFAOYSA-N	431.880	1.892	50	20	IDGD	
C[C@@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3ccc(Cl)cc3O)cn2)C[C@@H](C)O1	764126013	DQHLTYNGDVQECE-VXGBXAGGSA-N	447.879	1.454	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)c(OC(F)F)c1	764166245	AESWWHGAVCTNML-HNNXBMFYSA-N	449.366	1.164	50	20	IDGD	
O=C(CCc1ccco1)NNC(=O)C(=O)Nc1cc(Cl)ccc1C(=O)N1CCCC1	764171217	IJPCNGUEXVSKSS-UHFFFAOYSA-N	432.864	1.888	50	20	IDGD	
CCCS(=O)(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2scnc2C)c1	764247373	VRDBXPGIUKOINB-UHFFFAOYSA-N	425.492	1.003	50	20	IDGD	
CC(C)(C)OC(=O)N1CCc2c(NC(=O)C(=O)NNC(=O)Cc3cc[nH]n3)cccc21	764285682	KADMEOKWHWAWQL-UHFFFAOYSA-N	428.449	1.036	50	20	IDGD	
COCCOc1ccc(C#N)cc1NC(=O)C(=O)NNC(=O)CCc1ccccc1O	764289849	ZAMHTIURPUSFJO-UHFFFAOYSA-N	426.429	1.008	50	20	IDGD	
COCC(=O)NNC(=O)C(=O)Nc1ccc(NC(=O)OC(C)(C)C)cc1C(F)(F)F	764300310	XRAFEAQOIIAYLX-UHFFFAOYSA-N	434.371	1.785	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(F)c(F)cc2I)o1	764372288	SPEBXGPGVWMCFI-UHFFFAOYSA-N	449.151	1.871	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cccc(F)c3)n[nH]2)cc1OC	764378612	KOEZIJYWWVSHNO-UHFFFAOYSA-N	427.392	1.633	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc(F)c(C(N)=O)c3)n[nH]2)cc1C	764387279	IVYSWYBEQWRFCU-UHFFFAOYSA-N	438.419	1.331	50	20	IDGD	
COc1ccc(-c2nnc(S)n2CC(=O)NNC(=O)CSc2ccccc2O)cc1	765249168	PHBLNUCSZPHITM-UHFFFAOYSA-N	445.526	1.888	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2ccc(Cl)c(S(=O)(=O)N3CCC[C@@H](C)C3)c2)n[nH]1	765586410	SXABRVCIPGWRJR-LLVKDONJSA-N	439.925	1.867	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)NC1CCN(CC(=O)Nc2ccccc2)CC1	765648733	JYAIVGULWKXRBA-UHFFFAOYSA-N	445.545	1.819	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)c1csc([N+](=O)[O-])c1	765757333	RPFAOJOWNFDDMD-UHFFFAOYSA-N	437.909	1.889	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2c(C)cc(N(C)C)cc2C)cc(OC)c1OC	766258887	OFNBRHBIKKVPSN-UHFFFAOYSA-N	444.488	1.795	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1ccc(C(=O)N(C)C2CCCCC2)cc1	766260649	IXXKQDIWMAWWSS-UHFFFAOYSA-N	426.477	1.972	50	20	IDGD	
Cc1cc(O)c([N+](=O)[O-])cc1S(=O)(=O)NNC(=O)c1cccc(Br)c1	766321530	ODMGYCUCWNTTMA-UHFFFAOYSA-N	430.236	1.995	50	20	IDGD	
C[C@H](NS(=O)(=O)c1ccc(C#N)cc1)C(=O)NNC(=O)Cc1ccc2ccccc2c1	767882136	QMWSJHZQJNMDLA-HNNXBMFYSA-N	436.493	1.768	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)CNC(=O)NCc1ccc(Cl)cc1	768636892	ZGSIXBXVEHOHKG-UHFFFAOYSA-N	440.909	1.695	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)Nc1ccc(CN2C(=O)CCC2=O)cc1	769223663	TWXWEUAHVLGGFP-UHFFFAOYSA-N	446.485	1.896	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)[C@@H]1CC(=O)N(c2c(F)cccc2F)C1	770758463	VGQASBONEPXDMZ-LLVKDONJSA-N	441.435	1.173	50	20	IDGD	
O=C(CN1CCCc2ccccc21)NNC(=O)C(=O)Nc1ccnn1-c1cccc(F)c1	770775255	YZUFNPLHUYNSOQ-UHFFFAOYSA-N	436.447	1.550	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@H](C(=O)NNc2ccnc(Br)c2)[C@@H](C)O)cc1	771551676	HEZHTBBSXDJVJX-ABAIWWIYSA-N	443.323	1.324	50	20	IDGD	
O=C(NNC(=O)c1csc(O)n1)c1cccc(S(=O)(=O)NCc2ccccc2)c1	771608313	IWMYTKDGHFMHFN-UHFFFAOYSA-N	432.483	1.402	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@@H]2CCO[C@@H](C(C)C)C2)cc1	772616084	CAVQKGJEBAUGDQ-NVXWUHKLSA-N	426.539	1.150	50	20	IDGD	
COC(=O)c1ccc(S(=O)(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)c(OC)c1	773251869	QBMZTBADVGHMOW-LLVKDONJSA-N	442.877	1.912	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)[C@@H]2CC(=O)N(Cc3ccccc3)C2)C1	773422686	XNNNVLNHGKLEKN-ZWKOTPCHSA-N	444.532	1.830	50	20	IDGD	
Cc1ccc(-n2nc(C)cc2NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)nn1	773493729	HRNOGIAUVJKFHD-UHFFFAOYSA-N	443.851	1.097	50	20	IDGD	
CCCCOc1ccc(NC(=O)C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cn1	773496430	LTJMMMKRNVNXDO-UHFFFAOYSA-N	441.492	1.053	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ccc3ccccc3n2)cc1OCC(=O)NC1CC1	773661761	LNIQQLLRXXPDMT-UHFFFAOYSA-N	449.467	1.983	50	20	IDGD	
N#Cc1ccc(NNC(=O)C(=O)N2C[C@@H](C(=O)N3CCCCC3)Oc3ccccc32)cc1	773696402	AHCQSRRVSRUKCZ-FQEVSTJZSA-N	433.468	1.808	50	20	IDGD	
CSCC[C@H](C(=O)NNc1cc(Cl)nc(N)n1)N1C(=O)[C@@H]2CCCC[C@H]2C1=O	773860932	KBEBFYWBUIQTML-GMTAPVOTSA-N	426.930	1.452	50	20	IDGD	
COc1c(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)cccc1C(N)=O	774009619	RLICLBULZBEVTI-JTQLQIEISA-N	434.836	1.001	50	20	IDGD	
O=C(CSc1ccc(Cl)cc1)NNC(=O)Nc1ccnn1[C@H]1CCS(=O)(=O)C1	776052857	BOKWLIZFXADAKE-LBPRGKRZSA-N	443.938	1.841	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)[C@H]2CCc3c(Cl)cccc32)CC1	776232685	UZJPFELXSCGDJT-INIZCTEOSA-N	449.964	1.844	50	20	IDGD	
O=C(NNC(=O)c1cnc(S)[nH]1)c1cccc(S(=O)(=O)NCc2ccccc2)c1	776323326	LKEIEYWAIKWSIX-UHFFFAOYSA-N	431.499	1.252	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)[C@H](C(C)C)N2C(=O)c3ccccc3C2=O)nc1C	778424922	GYRZKVPWKICHSK-INIZCTEOSA-N	425.445	1.726	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)[C@H](NC(=O)c1ccccc1)c1ccccc1	778442591	XSKGNSCMYWUTFA-GOSISDBHSA-N	426.473	1.830	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)C(=O)Nc1cc(Cl)ccc1OC[C@H]1CCOC1	778709725	HXCTXTFFUDEOSH-AWEZNQCLSA-N	432.864	1.479	50	20	IDGD	
O=C(CNC(=O)c1cccc(O)c1)NNC(=O)c1ccc(Br)cc1Cl	778715628	ZAZXQPPTDZMRPY-UHFFFAOYSA-N	426.654	1.999	50	20	IDGD	
CCO[C@@H]1C[C@](NC(=O)OC(C)(C)C)(C(=O)NNC(=O)Cn2nc(C)cc2C)C1(C)C	780171234	HTYHZXQMXBVONH-VFNWGFHPSA-N	437.541	1.746	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)c2cn(C)nc2-c2cnn(C)c2)cc1C	781302777	XDEYLDGOHFNDTQ-UHFFFAOYSA-N	430.490	1.371	50	20	IDGD	
CC(C)COc1cccc(NC(=O)C(=O)NNC(=O)c2csc(N3CCOCC3)n2)c1	782897545	QPGLUYSCYNZXMW-UHFFFAOYSA-N	447.517	1.414	50	20	IDGD	
CC(C)C[C@H](C)n1nccc1NC(=O)C(=O)NNC(=O)c1csc(N2CCOCC2)n1	782898066	YJTFOQMPQFSACO-ZDUSSCGKSA-N	449.537	1.183	50	20	IDGD	
CC(=O)Nc1cccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)c1C	783264934	UBHGXZCMVZAGGV-UHFFFAOYSA-N	448.505	1.117	50	20	IDGD	
CC(C)Oc1cc(Br)cc(NC(=O)C(=O)NN[C@]2(C)CCS(=O)(=O)C2)c1	783426266	GTYWVKZRHZLARQ-MRXNPFEDSA-N	448.339	1.373	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)ccc1F	784832930	HMSSIKQUCMPRIR-UHFFFAOYSA-N	445.375	1.690	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1cnn(C(C)(C)C)c1	784833308	MVSOJOUPIVRUID-UHFFFAOYSA-N	436.538	1.797	50	20	IDGD	
CN(C)c1nccc(NNC(=O)C(=O)Nc2cccc(C(=O)NCc3ccccc3)c2)n1	784968804	FILJRUJDYIMGDU-UHFFFAOYSA-N	433.472	1.554	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)C(=O)Nc3cnn(C)c3C(F)(F)F)n[nH]2)c1	785129722	PYXJAMHBYXVTDO-UHFFFAOYSA-N	449.393	1.846	50	20	IDGD	
CC(C)NC(=O)C(=O)NNC(=O)c1ccc2c(=O)n(-c3ccccc3F)c(S)nc2c1	787858254	TZOMZMXDWRJRKQ-UHFFFAOYSA-N	443.460	1.099	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCC(c3ncc4n3CCCC4)CC2)cc1OC	789357982	RNRJAFSFKDPQTB-UHFFFAOYSA-N	441.532	1.877	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3c[nH]nc3-c3ccoc3)cc2)CC1	790000945	NXKFUMDXEQCMDO-UHFFFAOYSA-N	430.490	1.363	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc2c1CCN(C(=O)NNC(=O)c1cccc(C#N)c1)C2	790707680	CDKJXBURNISLGW-UHFFFAOYSA-N	427.486	1.221	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CNC(=O)c2cccnc2)cc(Br)c1OC	791054806	ROXOXSQOAFDDLS-UHFFFAOYSA-N	437.250	1.052	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)c1cn(C)c2c(cnn2C)c1=O	791196684	SICSBADTCXUVRU-JTQLQIEISA-N	448.277	1.263	50	20	IDGD	
CN(C)CC(=O)NNC(=O)C(=O)Nc1cccnc1Oc1ccc(Cl)cc1Cl	792355318	FWIZKIUXWFROGY-UHFFFAOYSA-N	426.260	1.828	50	20	IDGD	
CCn1cc([C@@H](O)CN(CC(=O)NNC(=O)c2cccs2)Cc2ccccc2)cn1	792365337	NECQMRBAFWVSNM-SFHVURJKSA-N	427.530	1.961	50	20	IDGD	
CS(=O)(=O)C1(C(=O)NNC(=O)c2nc(-c3ccccc3)n(-c3ccccc3)n2)CCC1	792811518	FMLDKVRPWWURTF-UHFFFAOYSA-N	439.497	1.663	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)CN2CCN(c3cccc(Br)c3)CC2)cc1	792934575	YCJGWXABQWORHE-UHFFFAOYSA-N	442.317	1.904	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3ccn(C)c(=O)c3c2)cc1OC	793022281	SXVKKEQYVZWNTJ-UHFFFAOYSA-N	438.440	1.346	50	20	IDGD	
CC1(C)CC(=O)c2cc(C(=O)NNC(=O)CNC(=O)OCc3ccccc3)c(O)nc2C1	794063118	IPCYPZUXHTVZAI-UHFFFAOYSA-N	440.456	1.630	50	20	IDGD	
C[C@@H](Oc1ccc(C=NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cc1)C(=O)O	794920840	VMMQKLMCTJAHNV-QGZVFWFLSA-N	438.484	1.447	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CN2CCC[C@@H](NC(=O)CCCc3ccccc3)C2)c1	796080835	XYJTVVQAAYREIK-JOCHJYFZSA-N	447.539	1.923	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNC(=O)C(=O)Nc1cccc(-c2cnco2)c1	797368671	FRULYIIZNFGNRN-UHFFFAOYSA-N	437.412	1.354	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2c(F)cc(F)c(F)c2F)c1	797520206	BRWVITFVBGTWTL-UHFFFAOYSA-N	448.398	1.638	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)Nc1cc(S(=O)(=O)N2CCCC2)ccn1	797674035	NRNFMCSCQBBZOI-UHFFFAOYSA-N	437.453	1.237	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)c1ccc(S(N)(=O)=O)cc1	798335069	DEEQKGJEVIMBJR-UHFFFAOYSA-N	426.520	1.168	50	20	IDGD	
COc1ccc2nc(NNC(=O)C(=O)Nc3ccc4c(c3)OCC(=O)N4C)c(C)cc2c1	799262651	HIMWMZIHLGMRDS-UHFFFAOYSA-N	435.440	1.989	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)c1nn(-c2ccc(F)cc2)cc1O	801325921	WHCWLGQQBMKEOQ-UHFFFAOYSA-N	426.404	1.572	50	20	IDGD	
O=C(CN1C(=O)[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)NNC(=O)Nc1ccc(Br)cc1	802000673	XIOZQVDJUDWUPE-FCIDVOKBSA-N	433.262	1.409	50	20	IDGD	
COCCS(=O)(=O)CC(=O)NNC(=O)Nc1ccc(Br)cc1Cl	802042122	AQQWPRFNHDRLBQ-UHFFFAOYSA-N	428.692	1.316	50	20	IDGD	
COc1ccc(NC(=O)NNc2cccc(F)n2)cc1S(=O)(=O)N1CCOCC1	806134535	ZNKFOLJHZZEGGK-UHFFFAOYSA-N	425.442	1.399	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)C1=NOC2(CCN(C(=O)OC(C)(C)C)CC2)C1	807370221	BHLNFKCASLMUIF-UHFFFAOYSA-N	442.513	1.469	50	20	IDGD	
CCc1nnc(NC(=O)[C@H](C)[C@@H](C)NC(=O)NNC(=O)COc2ccccc2C#N)s1	807566114	SFSOZBROQIOKTK-VXGBXAGGSA-N	445.505	1.345	50	20	IDGD	
Cc1nc(S(=O)(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c(Br)n1C	808092793	ZPZGXILHUJMQKV-UHFFFAOYSA-N	439.295	1.300	50	20	IDGD	
CC(C)S(=O)(=O)CCNC(=O)NNC(=O)[C@H](C)Oc1cccc(Br)c1	808193131	SJKFPJDMIFFSOK-NSHDSACASA-N	436.328	1.370	50	20	IDGD	
CCCS(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)CSc2ccccc2O)cc1	808303838	KYBQFDINIIOPHT-UHFFFAOYSA-N	444.556	1.678	50	20	IDGD	
C[C@@H](CN1CCOCC1)C(=O)NN=Cc1cc(I)cc([N+](=O)[O-])c1	811635465	YKYNPQJJTOCJML-NSHDSACASA-N	446.245	1.618	50	20	IDGD	
O=C(NCCc1cn[nH]c1)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	812520510	WLDQRNHUBKEEHY-UHFFFAOYSA-N	442.501	1.075	50	20	IDGD	
CC(=O)N1c2ccc(S(=O)(=O)NNC(=O)[C@H]3COc4ccccc4O3)cc2C[C@H]1C	812536323	XVAKLMCZLYRJCG-CWTRNNRKSA-N	431.470	1.134	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)Nc2cnn(-c3ncccc3C#N)c2)cc1	812962355	SOGFPXYXVLADOE-UHFFFAOYSA-N	426.462	1.538	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C1(S(=O)(=O)c2ccccc2)CCOCC1	813364301	MZHWDJBNRIVWFY-UHFFFAOYSA-N	448.497	1.245	50	20	IDGD	
NC(=O)c1ccccc1Oc1ccc(NC(=O)NNC(=O)[C@@H]2CCc3nncn3C2)cc1	814654241	DYHCLXIXRGSUIZ-CYBMUJFWSA-N	435.444	1.585	50	20	IDGD	
Cn1cnc(NC(=O)C(=O)NNC(=O)c2ccc(COc3ccc(Cl)cc3)cc2)n1	815565164	FEJVMSXVDKVFES-UHFFFAOYSA-N	428.836	1.447	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Cc2nc(-c3ccccc3)cs2)ccc1OCC(N)=O	823338740	RMSNUPIVRSZPPJ-UHFFFAOYSA-N	440.481	1.687	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)[C@H](O)[C@@H](O)c2nc3ccccc3s2)c1C	831083217	RZUPDGHKDDQFLO-FSPWUOQZSA-N	429.498	1.922	50	20	IDGD	
CSCC[C@@H](NC(=O)c1ccccc1)C(=O)NNC(=O)[C@@H]1COc2ccccc2O1	859439207	PKJGEFJJYRTOTG-QAPCUYQASA-N	429.498	1.526	50	20	IDGD	
O=C(c1cc(S(=O)(=O)N2CCCCC2)ccc1N1CCCCC1)N1CC[C@H](B(O)O)C1	864233436	JRPCFMACLCMIDK-KRWDZBQOSA-N	449.382	1.540	50	20	IDGD	
O=C(NNC(=O)c1cc2cc(F)ccc2[nH]1)c1cccc(S(=O)(=O)N2CCOCC2)c1	906477772	IDDBAVMVBGFWBJ-UHFFFAOYSA-N	446.460	1.403	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C2CCN(C(=O)c3cccnc3)CC2)c2ccccc2c1=O	913210958	URUVDSBEGRDSHE-UHFFFAOYSA-N	448.483	1.125	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C1CCN(C(=O)COc2ccccc2)CC1	914857490	YSPQBPWJFSJJHM-UHFFFAOYSA-N	441.484	1.539	50	20	IDGD	
CCN(CC)CCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	915888671	KNTZGHSOLPUWRI-UHFFFAOYSA-N	439.582	1.537	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)NC[C@H]1CN(Cc2ccccc2)CCO1	915894062	GKWFMGCAPZBPON-SFHVURJKSA-N	428.489	1.305	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NCc2ccnc(OCC(F)(F)F)c2)cc1	916397132	RAOOIPDUGOUQFZ-UHFFFAOYSA-N	428.367	1.941	50	20	IDGD	
Cc1cc(C)n(-c2ccc(CCNC(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)cc2)n1	916486899	CQLACJLGNGYJOJ-UHFFFAOYSA-N	445.487	1.652	50	20	IDGD	
O=C(CNC(=O)c1ccc(Br)s1)NNC(=O)c1ccc2c(c1)OCO2	916728368	DGTWNSBEEYRHLO-UHFFFAOYSA-N	426.248	1.430	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)NNC(=O)c1ccc2c(c1)S(=O)(=O)N(C1CC1)C2=O	916745655	CHBWLPUCIXSESY-UHFFFAOYSA-N	438.465	1.479	50	20	IDGD	
NC(=O)[C@H]1CC(C(=O)NNC(=O)Cc2ccc3ccccc3c2)=NN1c1ccc(F)cc1	917197861	PVROKGORODYDLP-HXUWFJFHSA-N	433.443	1.789	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)CCCS(=O)(=O)N2CCCC2)c1	917389462	GIGTUSYXSXNUQG-UHFFFAOYSA-N	425.551	1.850	50	20	IDGD	
O=C(CCCc1nc(-c2ccc(Cl)cc2)no1)NNC(=O)N[C@@H]1CCS(=O)(=O)C1	919885765	NQMOMYGMRBOPOP-CYBMUJFWSA-N	441.897	1.230	50	20	IDGD	
Cc1nn(C)c2nc(-c3cccs3)cc(C(=O)NNC(=O)N[C@H]3CCS(=O)(=O)C3)c12	919889886	WASVQIZFLOZQFS-NSHDSACASA-N	448.530	1.136	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)c1cccc(NC(=O)CCn2ccnc2)c1	920092587	BRBNRVATIXNYSL-UHFFFAOYSA-N	436.472	1.794	50	20	IDGD	
CC(=NNC(=O)N[C@H]1CCS(=O)(=O)C1)c1ccc(S(=O)(=O)N2CCCCC2)cc1	920381785	UJJDOLZDPRNROJ-INIZCTEOSA-N	442.563	1.072	50	20	IDGD	
O=C(NN=Cc1cc(Br)ccc1OC(F)F)N[C@H]1CCS(=O)(=O)C1	920384973	SPSAWBXRPAMJQT-JTQLQIEISA-N	426.239	1.871	50	20	IDGD	
CCc1ccc([C@H](NC(=O)NNC(=O)C(=O)OC)c2cccc(S(C)(=O)=O)c2)cc1	1116186815	GVNDMPRDXCRSRP-KRWDZBQOSA-N	433.486	1.245	50	20	IDGD	
N#Cc1cccc(C2(C(=O)NNc3ccccc3S(=O)(=O)N3CCOCC3)CC2)c1	1116329469	BLXHINMAICFQAP-UHFFFAOYSA-N	426.498	1.754	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2cccc(S(=O)(=O)/N=C3\CCCN3C)c2)cc1	1254715488	XKABIHHAFFGEFV-HKOYGPOVSA-N	445.501	1.975	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)c2ccccc2N2CCOCC2)CC1	1318915904	ZUXWBUSKUJAELC-UHFFFAOYSA-N	432.521	1.931	50	20	IDGD	
O=C(NNC(=O)c1n[nH]c2c1CCCC2)Nc1ccc(CC(=O)N2CCOCC2)cc1	1320239095	SKWKDGNXXGWUIT-UHFFFAOYSA-N	426.477	1.156	50	20	IDGD	
Cc1ccc(S(C)(=O)=O)cc1S(=O)(=O)NNC(=O)c1cncn1-c1ccccc1	1337568926	QZMIDKMHFZDGAG-UHFFFAOYSA-N	434.499	1.208	50	20	IDGD	
C[C@@H](NC(=O)c1ccccc1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Cl)C1	1778027235	GSLCYPAQFKYBBN-RACNMONISA-N	439.915	1.853	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc3nncn3c2)C1	1779073685	SFZRQRPQLJICSE-JXXFODFXSA-N	435.912	1.111	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc3cncn3c2)C1	1779140072	PAKNHVNILLGPBC-DBXWQHBBSA-N	434.924	1.716	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CO[Si](C)(C)C)C1	1779543493	DSEJCONKOBRRIH-WRWLIDTKSA-N	427.618	1.219	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H]1CC[C@H](O)CC1)C2	1779545625	CSUPBDZJMKSVDM-NEYJZJCJSA-N	426.630	1.903	50	20	IDGD	
C[C@@](O)(C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Br)C1)C(F)(F)F	1780771298	ZJXHFSPDFZRBHI-DMTCVQMQSA-N	449.239	1.504	50	20	IDGD	
O=C(c1n[nH]c2ccccc12)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781331362	IYVWZOSMWCHKKQ-YOEHRIQHSA-N	425.258	1.697	50	20	IDGD	
CN(C)c1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](F)Br)C3)C2)cc1	1781334945	RMMXSYLEVHWZQM-YJBOKZPZSA-N	428.302	1.887	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CC(F)(F)C(=O)O)C2	1781998390	SFEVAXNFMGTYQB-FIXISWKDSA-N	441.269	1.394	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCBr)C2)C1CCC(O)CC1	1782327885	QIQVRRPTYITHES-YBSITQRDSA-N	431.371	1.836	50	20	IDGD	
COc1ccccc1OCC(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](C)Br)C2)C1	1783527530	CPOUPMMENMCLDP-AUUYWEPGSA-N	441.322	1.687	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](C)Br)C3)C2)n1	1783532986	VLKWEESYTZKNLM-KZULUSFZSA-N	439.310	1.267	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)Cc3cc4ccccc4n3C)CCO2)C1	1783867841	BWILDVKOJATSCU-AVRDEDQJSA-N	433.936	1.805	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3coc([Si](C)(C)C)c3)CCO2)C1	1783877416	IRJNUKLMFWFCAN-HNAYVOBHSA-N	428.989	1.522	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cc(-c4ccccn4)[nH]n3)CCO2)C1	1783877797	PYFOMHPWGDTFPG-VBKZILBWSA-N	433.896	1.169	50	20	IDGD	
CCn1nc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]3C2)c2ccccc21	1784089803	JHQOSLPRRRNPQK-PLYYQAHHSA-N	434.924	1.249	50	20	IDGD	
C[C@H](NC(=O)c1ccccn1)C(=O)NC1(c2ccc(NC(=O)[C@@H](O)CCl)cc2)CCC1	1786135549	JBQIABVAVYLQNZ-KSSFIOAISA-N	444.919	1.934	50	20	IDGD	
CCc1cc(C(=O)NC2(c3ccc(NC(=O)c4cccc(B(O)O)c4)cc3)CCC2)n(C)n1	1788147948	QFLNHJKOJDMPCV-UHFFFAOYSA-N	446.316	1.724	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccnc(Cl)n3)[C@H]2C1	1788878198	ZLQXMXRANCLYFV-BLFANLJRSA-N	431.718	1.507	50	20	IDGD	
N#Cc1cccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](O)CCl)C[C@@H]32)c1Cl	1789267120	HGNCEPPDOYTJSY-HNKHHVNMSA-N	426.300	1.405	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc4c(c3)OCO4)C[C@@H]21	1791251782	VQACSCGKXTWBGV-GGXPGOJBSA-N	438.908	1.191	50	20	IDGD	
C/C(=C\c1ccc(C)o1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2C1	1791291000	HCOSCTZWGDRWPH-LWLDRSOZSA-N	446.548	1.344	50	20	IDGD	
Cc1c(F)ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)CBr)c1N	1792867799	LDDUBZTVFWZMFP-MMPOEDRJSA-N	442.329	1.951	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc3c[nH]nc13)C2	1792868378	WGSZKGKTXVOUSX-OEYIWLLWSA-N	435.322	1.797	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c3c(nn1C)CCC3)C2	1792873455	ALUORLMTDGYNOZ-NFFDBFGFSA-N	439.354	1.143	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1CCC(C(F)(F)F)CC1)C2)[C@H](O)CCl	1792975101	JAZMMYZOSULVRP-WWEJYDQOSA-N	426.863	1.544	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C[C@H]1COc2ccccc2O1	1793482811	XKBMDQHVGWHTAM-MHORFTMASA-N	444.532	1.228	50	20	IDGD	
Cn1nc(C(F)(F)F)cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2	1798191553	KBQAKIXTJOCGRC-AKZRSSKFSA-N	429.226	1.446	50	20	IDGD	
Cn1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Br)c2cccnc21	1799349688	JVMSIAQJBOZEBD-JLUCKKNBSA-N	439.285	1.467	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2)c1ccc([N+](=O)[O-])cc1F	1799489728	UCZADFHSSFIIKK-CULMDFNYSA-N	444.257	1.722	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccn3cncc3c1)C2	1800641680	GZNCHRNEDGHDEK-YALNPMBYSA-N	435.322	1.711	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cc(F)cc(F)c1)C2	1800756132	GNGLHORENZEHBT-AKENFEQQSA-N	431.277	1.880	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CC13CCCN1CCC3)C2	1800759916	QHJACMUJCLXRBC-PNBKFKSVSA-N	428.371	1.378	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc(C(F)(F)F)cn1)C2)C(Cl)Cl	1801016301	WQBIFXOCTRICBF-AKZRSSKFSA-N	427.210	1.502	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1CCN(C(=O)[C@@H]2CCC(=O)N2)[C@H]1c1cccnc1	1803009996	ZKDIHNKFAMIWTN-DYWXZXKOSA-N	437.338	1.397	50	20	IDGD	
CC(C)(C)OC(=O)NC1(C(=O)N2CCC3(CCCN(C(=O)[C@H](O)CCl)C3)CC2)CC1	1805529048	HLNISQLDMWWTOY-OAHLLOKOSA-N	443.972	1.875	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2cnccc2F)[C@H]1c1cccnc1	1807829756	ZOZUBLVFMBPYGF-IIBYNOLFSA-N	442.495	1.308	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)c2cnc[nH]2)[C@H]1c1cccnc1	1808414309	HEMIOWUCUOMDQM-ULJMSJBCSA-N	448.487	1.258	50	20	IDGD	
Cc1c[nH]cc1C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1	1808583291	FWWSTGWJPVNHJX-JXFKEZNVSA-N	447.499	1.350	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)c3ncc(F)cc3F)CC2)C1	1809969664	ZWBDDMUAJCYXRV-UHFFFAOYSA-N	443.259	1.198	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)c2cccc(=O)n2C)[C@@H]1c1cccnc1	1812865199	SWOSEYNRDRUMFQ-JCKWVBRZSA-N	447.333	1.883	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2ccncc2F)[C@H]1c1cccnc1	1813069835	DCYPFZIZWCUWNP-KKSFZXQISA-N	442.495	1.308	50	20	IDGD	
COc1ncc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)[C@@H](O)CCl)n[nH]2)cc1F	1814867471	LVMYOVSTYPUNPS-KBPBESRZSA-N	425.848	1.858	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@H](F)Br)[nH]n1)c1cc(O)ncn1	1815359174	PWODHSNZENKBMQ-MFKMUULPSA-N	427.234	1.902	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)[C@H](O)CCl)[nH]n2)n1	1816086590	OMJDUSJQHTWLKL-LSDHHAIUSA-N	434.884	1.669	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)C2CCCC2)n[nH]1	1816676595	UHAIOJOVXOJRTM-KRWDZBQOSA-N	425.493	1.904	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1ccc(Cl)o1	1818425638	YJBLYMAAOQMCNE-HNNXBMFYSA-N	442.668	1.956	50	20	IDGD	
CCC(=O)C(=O)Nc1cc([C@H]2CCCCN2C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[nH]n1	1821904442	CFGGUJDFENBNEL-AQXNZCSYSA-N	427.465	1.515	50	20	IDGD	
Cc1ccn(C)c1C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1	1822415225	XBWQFPCDCKPXCT-INIZCTEOSA-N	429.525	1.736	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1	1824011724	ZIWHNBPZWGEXQK-LJQANCHMSA-N	434.773	1.865	50	20	IDGD	
COC1(CC(=O)N[C@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)CCC1	1826092129	NBUQHVNIWYVJGL-ZDUSSCGKSA-N	437.566	1.387	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)Cc2ccsc2)CC1	1827161757	SGLVBHZCDVAJEZ-NRFANRHFSA-N	440.374	1.904	50	20	IDGD	
CC(C)OCC(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1	1828921847	CFGXZKXPQUVBIN-LJQANCHMSA-N	431.537	1.343	50	20	IDGD	
Cc1nc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)CC2)co1	1828925382	KHFUFVKNVMCYGS-LJQANCHMSA-N	440.504	1.529	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H](O)N2CCOCC2)CC1	1828963914	KOGFVCSJSDIJLX-NLWGTHIKSA-N	429.989	1.664	50	20	IDGD	
CN(C)c1cncc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)c1	1830357909	HLZBJZCBWUCSPJ-OAQYLSRUSA-N	438.956	1.483	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCBr)C2)C1	1830359552	RZFFADQIPHEJJG-INIZCTEOSA-N	425.751	1.493	50	20	IDGD	
C[C@H](C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2)N1C[C@H]2C[C@@H]2C1	1830361997	IFIGXRPKEICFIP-LHUKNYEISA-N	427.973	1.048	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)nc1	1830537373	FWNJSNDOPRGUNP-KXBFYZLASA-N	440.338	1.491	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3nnc(C)s3)C2)C1	1831641339	YEBDMNPDXXSQIK-DNVCBOLYSA-N	444.985	1.643	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2nccnc2C(N)=O)CC1	1831833145	UNWBKJYJCKYYGZ-GJZGRUSLSA-N	437.928	1.063	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H](C)N2CCN(C)CC2)CC1	1831833401	NMMXEEFPKZKOLK-YZGWKJHDSA-N	443.032	1.496	50	20	IDGD	
COc1ccc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)cn1	1831870433	CFZJHLOOEAHMHV-IBGZPJMESA-N	445.564	1.697	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)CCc2ncc[nH]2)CC1	1831875083	RCTGZXXVWOPBKF-SFHVURJKSA-N	432.569	1.335	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)[C@@H]2CCCSC2)CC1	1832857005	UHHVKJQAYJDUIH-TZIWHRDSSA-N	444.406	1.743	50	20	IDGD	
CCC(=O)N[C@@H](C)C(=O)NC1CCN(C2CCN(C(=O)[C@](C)(Cl)CCl)CC2)CC1	1833422380	XVPCRPTXRMOLRR-VBKZILBWSA-N	449.423	1.709	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccn(C)c3)CCO2)C1	1833847752	JRSAWKLSADNZSW-KBXCAEBGSA-N	428.327	1.126	50	20	IDGD	
CN(C)c1ncc(C(=O)N2CCO[C@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)o1	1833895476	ASVOWTWEVSHHJI-LJQANCHMSA-N	428.917	1.076	50	20	IDGD	
CCn1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)n1	1834409120	XOJKYRARCMDDMY-ROUUACIJSA-N	433.336	1.209	50	20	IDGD	
O=C(CCBr)NC1CCN(C2CCN(C(=O)c3cc(CO)on3)CC2)CC1	1834423448	XVSLLNDHOIRABK-UHFFFAOYSA-N	443.342	1.137	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3cnn(C)c3)CCO2)C1	1835985436	OOUHVOYUVCWFTJ-XLIONFOSSA-N	426.945	1.217	50	20	IDGD	
C[C@@H](Nc1nccs1)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836717852	LXAWOLZEAYEDNZ-CJNGLKHVSA-N	444.985	1.542	50	20	IDGD	
O=C(c1ccnc2c1OCO2)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836718442	OLXQLYDTIFXDCL-INIZCTEOSA-N	439.896	1.022	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnn4cccnc34)CCO2)C1	1836844408	KWWZYFHYUDZSEW-UZLBHIALSA-N	435.912	1.207	50	20	IDGD	
O=C(c1ccn2ccnc2c1)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1836989565	YOADIUSGVAOBJU-GOSISDBHSA-N	427.288	1.208	50	20	IDGD	
C[C@H](Sc1cccs1)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1	1837226695	JCDSQMVRDNHWKQ-SUNYJGFJSA-N	448.994	1.285	50	20	IDGD	
CCCC(=O)N[C@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1837668932	BPOHLMJVBQNQPX-QRWLVFNGSA-N	431.961	1.013	50	20	IDGD	
Cc1csc(C(=O)N2CCOC[C@@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)c1	1837710136	KLQQXIWJIZPKKS-LJQANCHMSA-N	426.611	1.978	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCC(OC2CCN(C(=O)CSC(=N)N)CC2)CC1	1837827870	OUBUCGMZQYQVLF-QGZVFWFLSA-N	439.409	1.848	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)c3cc(O)n[nH]3)CC2)CC1	1837904032	MUKHTSUTEVGQRJ-AWEZNQCLSA-N	443.342	1.901	50	20	IDGD	
CC[S@](=O)CCC(=O)N1CCC(OC2CCN(C(=O)CO[Si](C)(C)C)CC2)CC1	1838362182	MASMNMLOMKGSQL-NDEPHWFRSA-N	446.686	1.995	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCSC)CC2)CC1	1838786672	PTLWJMRRPWANGA-SJORKVTESA-N	437.002	1.353	50	20	IDGD	
Cc1ccccc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1838900168	OWCVUOCWWPQUQT-MAUKXSAKSA-N	429.286	1.756	50	20	IDGD	
Cc1cncc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)c1	1839151010	FKAGBDPZGDDAIA-RBUKOAKNSA-N	430.332	1.696	50	20	IDGD	
O=C(C1CCSCC1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839203472	LZRQVKRARGXMKI-CJNGLKHVSA-N	439.347	1.277	50	20	IDGD	
Cc1cc(F)cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)c1	1839284658	FMAMCISKJMVCTJ-QAPCUYQASA-N	447.276	1.895	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)CN(CC)CC)CCO2	1839675076	QOFPGOWAROWHDZ-LVCYWYKZSA-N	432.005	1.828	50	20	IDGD	
Cc1ccc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)cn1	1840031304	LQYFBNKRPAJZSZ-KXBFYZLASA-N	440.338	1.172	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)c(C)o1	1840031456	QPUXEBVVIPLMDN-UGSOOPFHSA-N	429.311	1.750	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(OC)s3)C2)C1	1840150593	NSWXMODLIJALDE-SCLBCKFNSA-N	432.926	1.081	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccnc4ccccc34)C2)C1	1840152188	AOTGZERJLNANOL-GCJKJVERSA-N	447.919	1.559	50	20	IDGD	
COc1ccc(Cl)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)c1	1840653074	NRDOBQWTNRASRN-APWZRJJASA-N	447.315	1.018	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)CN(C(=O)OC(C)(C)C)C2CC2)C1	1841141199	XTOBJDYTWFZIAB-HNNXBMFYSA-N	429.945	1.843	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)Cc2cccc3ncccc23)C1	1841589757	CGTKPTGBNWYILM-UHFFFAOYSA-N	444.495	1.293	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@](C)(O)C[C@H]1C(=O)N1CC2(CCCN2C(=O)[C@H](F)Cl)C1	1843366895	WPLNMZNPXUWHFL-ZJNRKIDTSA-N	433.908	1.485	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)CCc1cc(F)ccn1)C2	1843415524	VMBRIQHIJXGRBG-CVKSISIWSA-N	440.479	1.491	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)C1Cc3ccccc3C1)C2	1843417254	NWRKSJHYPNIOGP-WGOQTCKBSA-N	433.512	1.739	50	20	IDGD	
O=C([C@@H]1CC(=O)N(C2CCCC2)C1)N1CC2(CCCN2C(=O)[C@H](F)Br)C1	1845216509	UEBHZPRLQSPVMN-DOMZBBRYSA-N	430.318	1.671	50	20	IDGD	
O=C1C[C@@H](C(=O)N2CC3(CCCN3C(=O)[C@@H](Br)Cc3ccccc3)C2)CCN1	1845942636	RWXMFQBNCNHKLD-IRXDYDNUSA-N	448.361	1.722	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)c2cc(S(C)(=O)=O)ccc2Cl)C1	1846925546	SIXZJNPGIBFCIW-HNNXBMFYSA-N	449.356	1.814	50	20	IDGD	
CC[C@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl	1847568668	HQZFCXLFCXVLJI-GVRJEKJASA-N	431.961	1.727	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)C2CCN(c3nc4ccccc4o3)CC2)C[C@@H](C)O1	10889365	GRHXJRIHMGTMTC-HZPDHXFCSA-N	429.521	1.691	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCCC(=O)NNC(=O)COc2cc(C)ccc2C)cc1	17202766	LCNSNUROMFXJDT-UHFFFAOYSA-N	449.529	1.597	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNS(=O)(=O)c2ccc3c(c2)C[C@@H](C)N3C(C)=O)c1	28679311	ARUNYFPMVAXLRL-GFCCVEGCSA-N	433.486	1.625	50	20	IDGD	
CC[C@H](C)C(=O)N1CCC[C@@H](C(=O)OCC(=O)NNC(=O)c2ccc(OC)c(OC)c2)C1	726040883	ZSBBSFQMOPPHGZ-GOEBONIOSA-N	449.504	1.293	50	20	IDGD	
Cc1ccc(C(=O)N2CCC(NC(=O)NNC(=O)CNC(=O)c3cccs3)CC2)cc1	727606495	LDTPJPKFUXVJGQ-UHFFFAOYSA-N	443.529	1.422	50	20	IDGD	
C[C@H]1CC(C)(C)C[C@]2(C1)NC(=O)N(CC(=O)NNc1nc(-c3cccnc3)no1)C2=O	728078901	AHXSFXDCAVIQDT-YUNKPMOVSA-N	427.465	1.712	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3cncc4ccccc34)cc2)CC1	728216407	ZTVBEPCMILWNOE-UHFFFAOYSA-N	425.514	1.928	50	20	IDGD	
O=C(Cn1c(COc2ccccc2)nc2ccccc21)NNC(=O)[C@@H]1CCS(=O)(=O)C1	728376855	LBSMTNTYDPMMNZ-OAHLLOKOSA-N	442.497	1.197	50	20	IDGD	
CCOC(=O)c1ccc(-n2c(C)cc(C=NNC(=O)[C@H](C)NS(C)(=O)=O)c2C)cc1	728436052	KGCYGMSZEWGWAX-AWEZNQCLSA-N	434.518	1.659	50	20	IDGD	
O=C(NNC(=O)N1CCN(C(=O)c2cccc(O)c2)CC1)c1cccc(OC(F)F)c1	728598470	CBQVUYPDTWJRHG-UHFFFAOYSA-N	434.399	1.806	50	20	IDGD	
O=C(NCCN1C(=O)c2ccccc2C1=O)NNC(=O)c1cc(F)ccc1Br	728750712	QUOPAZVFKYRGHV-UHFFFAOYSA-N	449.236	1.828	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)[C@H]2CCCN2C(=O)/C=C\c2ccc(C(N)=O)cc2)c1	728825637	IPBMNPUGVPBIPS-SCEWNMGZSA-N	431.452	1.123	50	20	IDGD	
COc1cc(C(=O)NCC(=O)NNC(=O)C(C)(C)c2ccccc2)cc(OC)c1OC	731231190	IHCOMFYZPSDPAB-UHFFFAOYSA-N	429.473	1.567	50	20	IDGD	
O=Cc1ccc(OCC(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)c([N+](=O)[O-])c1	731733881	PSJLPPSGRWZUQF-UHFFFAOYSA-N	435.776	1.444	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NCc1ccc(Br)cc1F	732245537	YRMFZNQXQNMNQW-UHFFFAOYSA-N	429.271	1.910	50	20	IDGD	
CCCS(=O)(=O)c1ccccc1C(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	732325044	NMQFZKBFQOWBEH-UHFFFAOYSA-N	449.441	1.397	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)[C@@H]1CCCN1C(=O)OCC(F)(F)F	734241303	MELWEILUIYMYCP-JTQLQIEISA-N	441.407	1.005	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)c2ccc(S(=O)(=O)NCCc3cccs3)cc2)cn1	735470596	CYOHHPMYCLTADX-UHFFFAOYSA-N	433.515	1.077	50	20	IDGD	
CN(CC(=O)NNc1nc(-c2ccccc2)no1)S(=O)(=O)c1cccc([N+](=O)[O-])c1	737848053	UUAHSEMRAZALBB-UHFFFAOYSA-N	432.418	1.409	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1)N1CCCC1=O	741745898	IUMWTGLTNLOKEH-LJQANCHMSA-N	447.499	1.550	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)[C@@H](C)NC(=O)c2cc3c(C)nn(C)c3s2)c1	742033184	JSELBEIWIPJCFO-CYBMUJFWSA-N	429.502	1.596	50	20	IDGD	
Cc1nn(C)c(C)c1S(=O)(=O)N[C@H](C)C(=O)NNC(=O)Cc1cccc2ccccc12	742039208	AUGKCPZZCSBSSJ-CQSZACIVSA-N	443.529	1.247	50	20	IDGD	
Cn1c(NNC(=O)CN(C[C@@H]2CCCO2)C(=O)OC(C)(C)C)nc2ccccc2c1=O	742077505	ZUENFGACPIOGFO-AWEZNQCLSA-N	431.493	1.793	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2ccc(Br)s2)cs1	743251796	WOVJHYQKTVFLBQ-UHFFFAOYSA-N	425.307	1.982	50	20	IDGD	
COCCCNC(=O)NNS(=O)(=O)c1ccc(Br)c(C(F)(F)F)c1	743257923	ZHJPJSVYSROMHK-UHFFFAOYSA-N	434.234	1.997	50	20	IDGD	
CCOc1ncc(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)cc1Cl	744620630	JAEYOASOUSYTQG-UHFFFAOYSA-N	440.909	1.912	50	20	IDGD	
CC(C)[C@@H](C(=O)OCC(=O)NNC(=O)c1cccc(C#N)c1)n1nnc(-c2ccccc2)n1	744847653	YBUFFLYUKPSUCJ-IBGZPJMESA-N	447.455	1.413	50	20	IDGD	
C[C@@H]1C[C@H](NC(=O)NNC(=O)CC23CC4CC(CC(C4)C2)C3)C(=O)N1c1cnn(C)c1	745918337	NRTWPEMRZDINKS-YONNCOAESA-N	428.537	1.851	50	20	IDGD	
Cc1ccc(-c2csc3ncn(CCC(=O)NNC(=O)N4CCOCC4)c(=O)c23)cc1	745991689	DEDWYQOVSPZYBQ-UHFFFAOYSA-N	441.513	1.897	50	20	IDGD	
COc1cccc(C(=O)NNS(=O)(=O)c2ccc(C(=O)O)cc2Br)c1O	747608800	OUHMNFYMOMXYTH-UHFFFAOYSA-N	445.247	1.485	50	20	IDGD	
CCc1cc(N2CCC(NC(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)CC2)ncn1	748662658	BFNVCVOPVOCJPC-UHFFFAOYSA-N	446.533	1.056	50	20	IDGD	
C[C@@H](C(=O)NNc1ccc(OCC(F)(F)F)cc1)N1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O	748703802	SWPAZSUROJKSLU-XNHWVXRISA-N	427.379	1.622	50	20	IDGD	
CCCCN1C(=O)CC[C@@H](C(=O)NNC(=O)C(=O)NC(C)C)[C@@H]1c1ccccc1OC	750873381	QKKGTBFJPZJFQH-APWZRJJASA-N	432.521	1.447	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNS(=O)(=O)c2cnc3c(c2)c(C)nn3C)cc1	751263227	ITVJRKSQJZLKSD-ZDUSSCGKSA-N	433.490	1.452	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N(C)C)c(Br)c2)o1	752524321	CPRPCCBJIJPQCU-UHFFFAOYSA-N	430.280	1.676	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)NCc3ccc(COC4CCOCC4)cc3)nc21	752687202	RSNOMGYQTPQGBP-UHFFFAOYSA-N	427.465	1.591	50	20	IDGD	
C[C@@H]1C[C@@H](NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)CN1C1CC1	753942631	ATALFGZLIPCSGG-GDBMZVCRSA-N	435.550	1.040	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)c2ccnc(O[C@@H]3CCOC3)c2)CC1	755354484	MWLGBSXHCMKGAM-MRXNPFEDSA-N	449.508	1.593	50	20	IDGD	
CCCCc1nnc(NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)s1	755425106	YUJUITSLZZIHRV-UHFFFAOYSA-N	440.551	1.663	50	20	IDGD	
CS(=O)(=O)CCOc1cccc(NC(=O)NNC(=O)c2cc(Br)c[nH]2)c1	756296882	DLEWWTSAEHYWTP-UHFFFAOYSA-N	445.295	1.667	50	20	IDGD	
CC[C@@H]1CN(C(=O)NNC(=O)CNC(=O)c2ccco2)CC[C@@H]1NC(=O)OC(C)(C)C	757020614	PTDGQXBOJUJHTB-KGLIPLIRSA-N	437.497	1.375	50	20	IDGD	
CC(C)(C)c1noc(CCCC(=O)N2CCN(S(=O)(=O)CBr)CC2)n1	758534039	AEQMEFMOOXSGQW-UHFFFAOYSA-N	437.360	1.516	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)NCCc1cn2cc(Br)cc(C)c2n1	758694268	DZIYFPMIMAEAAG-LBPRGKRZSA-N	442.314	1.330	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)NCCN1CCC(N(C)C)CC1	759595468	JPMZDKGFIBDXEJ-KRWDZBQOSA-N	427.549	1.964	50	20	IDGD	
COc1ccc(Cn2nccc2NC(=O)C(=O)NNC(=O)C(C)(C)C)c(OC)c1OC	761073361	ZDCAGKQOTZSZQC-UHFFFAOYSA-N	433.465	1.089	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)NC1CCC(F)(F)CC1	761777108	BLQWQLLICPLORL-UHFFFAOYSA-N	446.476	1.229	50	20	IDGD	
COc1ccc(C(=O)NNc2ccccc2S(C)(=O)=O)nc1I	761951509	BDZNUBZOBVUAOF-UHFFFAOYSA-N	447.254	1.855	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCCCN(C)C)cc1C(=O)NNC(=O)c1cccc(C#N)c1	762193680	ZEXVXSYMWUFNTR-UHFFFAOYSA-N	443.529	1.172	50	20	IDGD	
C[C@H](CC(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1)[C@H]1CCCN(C(=O)OC(C)(C)C)C1	763184678	ACKITCJVIAKGGP-QLFBSQMISA-N	431.555	1.242	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)C(=O)Nc1cccc(OCC(F)(F)F)c1	763444663	ZBCMXHYUXXKREZ-UHFFFAOYSA-N	426.307	1.936	50	20	IDGD	
C[C@H](NS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)C2CC2)cc1)[C@@H]1C[C@H]2CC[C@H]1C2	763558130	NPIGHHJWRJMKDS-ATZCPQFDSA-N	448.545	1.286	50	20	IDGD	
O=C(NNC(=O)c1ccccc1F)C(=O)Nc1cccc(N2CCN(CC3CC3)CC2)c1	763560507	BYCQQYUFRLBTOQ-UHFFFAOYSA-N	439.491	1.757	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)Nc1cc(C(F)(F)F)ccc1F	763572729	OERGMPFSWHOAKR-CQSZACIVSA-N	427.310	1.770	50	20	IDGD	
CCN(CC)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2cccc(C)c2)cc1	763624479	WZNJWFBFPRDFJF-UHFFFAOYSA-N	426.473	1.642	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(-n2cccn2)c(Cl)c1	763664513	XKMNISSJXDPGTN-UHFFFAOYSA-N	443.847	1.699	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)cc1C(=O)NC(C)C	763680907	ROJZSCRLQOHHLC-UHFFFAOYSA-N	437.456	1.170	50	20	IDGD	
Cc1ccc(NC(=O)CS[C@@H](C)C(=O)NNC(=O)CNC(=O)c2cccnc2)cc1	763815118	VCLMTUCDCXLFLK-AWEZNQCLSA-N	429.502	1.028	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)nn1-c1ccccc1	763866651	XIGWJZDHSZYWON-CQSZACIVSA-N	425.420	1.873	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccccc2-n2ccc(C)n2)cc1	763876470	DMGNCZYVUYCYEB-MRXNPFEDSA-N	449.467	1.937	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cc(C)cn(C)c2=O)ccc1OCCC(C)C	763913893	DKUYHXRDIDVLCJ-UHFFFAOYSA-N	444.488	1.527	50	20	IDGD	
O=C(NNC(=O)c1ccc(Br)s1)C(=O)Nc1cnn(Cc2ccncc2)c1	763941478	YAZWUKIVSLCQOC-UHFFFAOYSA-N	449.290	1.550	50	20	IDGD	
COc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NNC(=O)c1cc(Cl)ccc1O	763974161	LZPJLWMFUXHIQT-UHFFFAOYSA-N	434.836	1.156	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2cn(C)c3ccccc23)c(OC)c1OC	763976679	DDSNSXDWICBHJE-UHFFFAOYSA-N	426.429	1.604	50	20	IDGD	
CN(C)CC1CCN(c2ccc(NC(=O)C(=O)NNC(=O)c3cccn3C)cc2)CC1	763998012	CMNPBZPWCMGJDI-UHFFFAOYSA-N	426.521	1.203	50	20	IDGD	
COC(=O)c1cc(Cl)cc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)c1	764004732	SPTNNJSSPCYIQU-UHFFFAOYSA-N	433.804	1.298	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc3oc(C(F)(F)F)nc3c2)c1O	764131070	FBMOFJWJMFTFEF-UHFFFAOYSA-N	438.318	1.961	50	20	IDGD	
CCN(CC)CCOc1ccccc1NC(=O)C(=O)NNC(=O)[C@@H]1Cc2ccccc2O1	764166575	COGGJUAVWALNFP-FQEVSTJZSA-N	440.500	1.497	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)C(=O)Nc1ccc(CCN2CCSCC2)cc1	764269182	ZJDLCUPYNSKBLD-UHFFFAOYSA-N	427.530	1.002	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)C(=O)Nc1cccc(-c2n[nH]c(C3CC3)n2)c1	764278696	UQCHZDUZOXXKHK-UHFFFAOYSA-N	434.456	1.773	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1cc(F)ccc1OCC(F)(F)F	764281080	WYQOSSZCFSBEBL-UHFFFAOYSA-N	445.325	1.637	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)C(C)(C)c2ccccc2)cc1-n1nnnc1C	764313523	LBHZPVHYCVPYTC-UHFFFAOYSA-N	437.460	1.043	50	20	IDGD	
C[C@H]1CN(Cc2cccc(NC(=O)C(=O)NNC(=O)Cc3ccccc3F)c2)C[C@@H](C)O1	764319415	QPUPFRLPODWUDT-IYBDPMFKSA-N	442.491	1.764	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccn(CC(F)F)n2)cc1Br	764326358	GFEYVROLJVWYPP-UHFFFAOYSA-N	446.208	1.319	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)c(Cl)c1)C(=O)Nc1ccc(-n2cncn2)c(Cl)c1	764350057	ZOKQWGCRKGRRKK-UHFFFAOYSA-N	435.227	1.679	50	20	IDGD	
COc1cc(C)c(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)cc1OC	764386876	DWRPBKHZNULONQ-UHFFFAOYSA-N	441.419	1.941	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccc(F)c(N2CCCS2(=O)=O)c1	764411871	VGKGYVPXQSXSJQ-UHFFFAOYSA-N	448.476	1.003	50	20	IDGD	
CCc1cccc(S(=O)(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)c1	765129008	ZFIXTGKXXARNAT-UHFFFAOYSA-N	430.574	1.685	50	20	IDGD	
CC(C)(C)OC(=O)N1CCO[C@H](CC(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)C1	765390102	ADIXRAGYCLTFTP-OAHLLOKOSA-N	429.477	1.864	50	20	IDGD	
CC(=O)Nc1ccc(F)c(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)c1	765736458	SPDNSCOAKUWQDT-UHFFFAOYSA-N	441.463	1.003	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)C(F)=C3CCCC3)CC2)cc1	766636726	SNLBULFPIDFJKA-UHFFFAOYSA-N	438.525	1.246	50	20	IDGD	
COc1ccc([C@@]2(C)NC(=O)N(CC(=O)NNc3cc(C#N)cc(Cl)n3)C2=O)cc1	768711931	ZPPDVZUPJLTVOV-LJQANCHMSA-N	428.836	1.526	50	20	IDGD	
O=C(NCc1ccco1)NNC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O	769731641	CQAUYLASYWIIDV-UHFFFAOYSA-N	436.471	1.992	50	20	IDGD	
COc1ccccc1[C@@]1(C)NC(=O)N(CC(=O)NNC(=O)c2ccc(Cl)cc2F)C1=O	771261716	DRXNKAJAZMVUEA-HXUWFJFHSA-N	448.838	1.716	50	20	IDGD	
COc1cc(C)c(S(=O)(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)cc1OC	771606266	GQWFMLLNOWORAX-UHFFFAOYSA-N	441.893	1.292	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)[C@H]1CCN(C(=O)OCc2ccccc2)C1	772283388	MPMUFXFPJAICBJ-INIZCTEOSA-N	449.508	1.500	50	20	IDGD	
COc1ccc(Cn2ncc(C)c2NC(=O)C(=O)NNc2nc(C)cc(C)n2)cc1OC	773479560	AFMIPCUUEADIAC-UHFFFAOYSA-N	439.476	1.746	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)ncc1Br	773613076	NSDKXMVADVWJFS-UHFFFAOYSA-N	445.277	1.368	50	20	IDGD	
O=C(NNc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(CC(=O)N2CCSCC2)cc1	773638779	JKMZNCVQISYEMH-UHFFFAOYSA-N	443.485	1.795	50	20	IDGD	
O=C(Cc1csc(N2CCOCC2)n1)NN=C1C(=O)Nc2c(F)cc([N+](=O)[O-])cc21	774347988	HYZIDQFKDUAUEY-UHFFFAOYSA-N	434.409	1.042	50	20	IDGD	
COC(=O)c1ccccc1CC(=O)NNC(=O)c1cc(-c2ccc(OC)c(OC)c2)[nH]n1	775805004	ZEVFKXBKCAWBOQ-UHFFFAOYSA-N	438.440	1.884	50	20	IDGD	
COc1cccc([C@@H]2[C@@H](C(=O)NNC(=O)COc3ccccc3O)CC(=O)N2C2CC2)c1	776475912	OEZLDXABQNEEAM-HTAPYJJXSA-N	439.468	1.679	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)COC2CCN(C(=O)OC(C)(C)C)CC2)C[C@H](C)O1	777087709	ACBSXLBDRILUPY-HOTGVXAUSA-N	442.557	1.049	50	20	IDGD	
O=C(c1cccnc1SC(F)F)N1CCN(S(=O)(=O)CBr)CC1	777777508	KKJOUTBFXWKXNJ-UHFFFAOYSA-N	430.296	1.836	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@@H](C(=O)NNC(=O)c2ccc(Cl)cc2F)[C@@H](C)O)cc1	779532889	XCFBDCWCNMWEPI-BDJLRTHQSA-N	443.884	1.276	50	20	IDGD	
COC(=O)c1cn(C2CN(C(=O)CCC(=O)C(C#N)=C3N(C)c4ccccc4N3C)C2)nn1	779549217	LBRACNYHODGRSD-UHFFFAOYSA-N	449.471	1.119	50	20	IDGD	
COc1ccc(NNC(=O)[C@H]2CCCCN2S(=O)(=O)c2ccc(C(C)=O)cc2)nc1	781533981	QTAPWLLSMJCLJL-GOSISDBHSA-N	432.502	1.979	50	20	IDGD	
CC(C)(C)OC(=O)N1CCc2[nH]nc(C(=O)NNC(=O)COc3ccc(C#N)cc3)c2C1	782654517	PZOCIDZYWKHXNA-UHFFFAOYSA-N	440.460	1.415	50	20	IDGD	
C[C@H]1CN(C(=O)c2ccc(NC(=O)C(=O)NNc3cncc(Cl)n3)cc2)C[C@H](C)O1	783259431	FEPOAJXIHGTDFM-RYUDHWBXSA-N	432.868	1.461	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2cccc(C(=O)OCc3ccccc3)c2)CCS(=O)(=O)C1	783427273	NYHKKKBQPYVGDM-NRFANRHFSA-N	445.497	1.180	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)C(=O)Nc1ccc(N2CCCC2)c(Cl)c1	784002012	IIOXEBHVTIVWQW-UHFFFAOYSA-N	433.852	1.049	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1cccc(NC(=O)C(=O)NNc2nccnc2Cl)c1	784780716	JWZYYOIJJQGWNB-UHFFFAOYSA-N	426.886	1.289	50	20	IDGD	
CC(=O)N(C)c1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)cc1	784835899	ZIMWQYOBVAFYBU-UHFFFAOYSA-N	440.428	1.747	50	20	IDGD	
COC(=O)CN1CCN(c2ccc(NC(=O)C(=O)NNc3cccnc3Cl)cc2)CC1	784843802	TVPGYHAUZCVRRR-UHFFFAOYSA-N	446.895	1.112	50	20	IDGD	
CC(=O)NCc1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3cc(C)ccc3C)[nH]n2)cc1	785126694	BLJJHKZMGYJMBQ-UHFFFAOYSA-N	448.483	1.729	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccc(Oc3ccccc3F)nc2)n1	787544584	VZHHYQCAEBHWKJ-UHFFFAOYSA-N	426.408	1.612	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)[C@H]1CC(=O)N(c2cc(Cl)ccc2OC)C1	788163958	LZPSMKSSCPVJNE-LBPRGKRZSA-N	427.885	1.638	50	20	IDGD	
CN1CCCC(C)(C)[C@H]1CNC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	790895155	GSOHVNGNDQBEJC-HXUWFJFHSA-N	430.597	1.650	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)c3ccccc32)n[nH]1	791054757	QLOZAUIBBIUOLX-CQSZACIVSA-N	440.481	1.808	50	20	IDGD	
O=C(NNc1nc2ccccn2n1)C1(NS(=O)(=O)c2cccc(F)c2)CCCCC1	791242773	JNRWCDSODJPUGE-UHFFFAOYSA-N	432.481	1.993	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)[C@](C)(O)Cn1cc(C(F)(F)F)ccc1=O	792032845	CYWOGKGIWWOZEO-QGZVFWFLSA-N	447.797	1.741	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@](C)(O)Cn2c(C)cccc2=O)cc1Br	792163565	DSHMRQUVQWOYLO-GOSISDBHSA-N	438.278	1.140	50	20	IDGD	
CN(CCC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)C(=O)OCc1ccccc1	792813160	ZIFPSEUOQUORFG-UHFFFAOYSA-N	437.456	1.353	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cnc(CC3CC3)nc2)cc1	793022303	URNCCTDUMUELDX-ZDUSSCGKSA-N	427.461	1.381	50	20	IDGD	
CCCc1c(NC(=O)C(=O)NNC(=O)C2CCC2)cnn1-c1cc(F)c(OC)cc1F	797005198	AIHWRFPJCORXJX-UHFFFAOYSA-N	435.431	1.998	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)Nc2cccc(S(=O)(=O)N3CCCN(C)CC3)c2)n1	797623052	GKFIQVRANFYNAN-UHFFFAOYSA-N	446.533	1.183	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](c2cccc(F)c2)N2CCOCC2)cc1C	798310481	ZBVOEBCPFXQDEH-LJQANCHMSA-N	428.464	1.602	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)Nc2ccc(O[C@H]3CCN(C)C3=O)cc2C)c1	799239194	ULBNYHTYULHPAD-SFHVURJKSA-N	440.460	1.424	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cc(OC)cc(OC)c2C)cc1	800621986	DKAHARCEASIMAC-CQSZACIVSA-N	445.472	1.964	50	20	IDGD	
Cn1c(N)c(C(=O)/C(C#N)=C/c2c(F)ccc(Br)c2F)c(=O)n(C)c1=O	800721419	MLWYWLRMSKBXMT-FNORWQNLSA-N	425.189	1.497	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CCc2c(C)nc(-c3cccnc3)nc2O)cc1	801108611	PKZXWKOQTUXQIM-UHFFFAOYSA-N	434.456	1.580	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@@H]2CCCN2c2ccc(C#N)cc2)cc1	802066590	ZYDQARZOFVYOCB-SFHVURJKSA-N	427.486	1.783	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)c2cn(Cc3noc(C)n3)nn2)c(OC)cc1Cl	802079833	CIPMLDNBRYKOEK-UHFFFAOYSA-N	436.816	1.155	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)[C@H]2CC[C@H](C(F)(F)F)NC2=O)c(OC)cc1Cl	802081469	PUDLRJUVZUCDEJ-JVXZTZIISA-N	438.790	1.967	50	20	IDGD	
Cc1ccc(C2=NO[C@@H](CNC(=O)NNC(=O)CNC(=O)c3cccs3)C2)cc1C	802378969	FURUSMYFLDEOFV-OAHLLOKOSA-N	429.502	1.618	50	20	IDGD	
O=C(COC(=O)c1cc(O)ccc1C(F)(F)F)NNC(=O)c1ccc([N+](=O)[O-])cc1	803528312	RDJOJAVGWFOXOV-UHFFFAOYSA-N	427.291	1.937	50	20	IDGD	
CCn1c(=O)nc(O)c2c(C(=O)NNc3ccc(-n4ccnc4)nn3)cc(C(C)C)nc21	804956104	ABTYDCFOMYYFBZ-UHFFFAOYSA-N	435.448	1.373	50	20	IDGD	
O=C(Cc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1ccc(F)c(N2C(=O)CCC2=O)c1	806975518	CMGLJTDAPQITCR-UHFFFAOYSA-N	446.822	1.461	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)NC[C@H](N2CCOCC2)C(F)(F)F)cc1	807541397	MWNWLXUZAXKTCX-CJNGLKHVSA-N	448.442	1.446	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)NC[C@@H]2CCCS(=O)(=O)C2)c1	807580636	CRZDNWIQVVMEML-JTQLQIEISA-N	434.312	1.227	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H]2CCN(c3ccccc3F)C2)c1	809940509	LFBWXIKJQWPUGE-HNNXBMFYSA-N	434.493	1.364	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN2CCN(c3snc(C)c3C#N)CC2)cc1C	810065629	ZAYCFJQIRMRQJK-UHFFFAOYSA-N	432.575	1.839	50	20	IDGD	
CC(C)c1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2O)n(-c2ccccc2)n1	810387444	WUOGXDBKLOWTAY-UHFFFAOYSA-N	437.456	1.866	50	20	IDGD	
CC(C)S(=O)(=O)c1ccc(C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)cc1	812730677	ROUHJKIDUDNNAR-UHFFFAOYSA-N	425.532	1.876	50	20	IDGD	
CCCCOc1ccc(C(=O)NCC(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)cc1	812733069	YHUWYXDTQPAILF-UHFFFAOYSA-N	448.545	1.989	50	20	IDGD	
CSc1nnnn1-c1cccc(NC(=O)NNc2ccccc2S(=O)(=O)N(C)C)c1	814575117	ZOCKPNXIKKMHPO-UHFFFAOYSA-N	448.534	1.783	50	20	IDGD	
Cc1nc(-c2ccccc2NC(=O)C(=O)NNC(=O)[C@@H]2CCc3nncn3C2)cs1	815691023	CPSBXGYCCCGHFB-GFCCVEGCSA-N	425.474	1.059	50	20	IDGD	
CC(=O)N1c2ccccc2C[C@H]1C(=O)NNC(=O)[C@H]1CCCN(C(=O)OC(C)(C)C)C1	816510472	WRQLHRUDJDAZLX-WMZOPIPTSA-N	430.505	1.759	50	20	IDGD	
COc1ccc(Cn2cc(C(=O)NNc3ccccc3S(=O)(=O)N(C)C)cn2)cc1	817054573	OPIHKNYSMJQGAY-UHFFFAOYSA-N	429.502	1.947	50	20	IDGD	
Cc1occc1C(=O)Nc1nc(CC(=O)NNC(=O)COc2ccc(C#N)cc2)cs1	916108178	PYZRFAHXXZKIHM-UHFFFAOYSA-N	439.453	1.937	50	20	IDGD	
Cc1ccc(C)n1-c1ccc(C(=O)NNC(=O)NCCS(=O)(=O)NC(C)(C)C)cc1	916622398	OBHCHECRGYWVPO-UHFFFAOYSA-N	435.550	1.756	50	20	IDGD	
COc1cc(C(=O)NCC(=O)NNC(=O)c2ccc(Cl)cc2O)ccc1OC(F)F	918357852	CLDJSZXVJCAJFV-UHFFFAOYSA-N	443.790	1.847	50	20	IDGD	
Cc1nc(-c2cccc(Cl)c2)sc1C(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1	919885222	NZPLTHZJUJFCSI-GFCCVEGCSA-N	428.923	1.903	50	20	IDGD	
NC(=O)c1ccc(/C=C\C(=O)N2CCC[C@H]2C(=O)NNC(=O)Cc2ccc(F)cc2)cc1	920033382	YLFBXTDKHKTZJB-DIBVOSKASA-N	438.459	1.319	50	20	IDGD	
Cc1ccc(S(C)(=O)=O)cc1S(=O)(=O)NNC(=O)c1ccc(Br)cc1	1115862753	CMGRWNVVKUWHEI-UHFFFAOYSA-N	447.332	1.784	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@@H]2CC(=O)N(c3ccc(C#N)cc3)C2)cc(OC)c1OC	1115909059	UVWCEGFEWFXWNL-OAHLLOKOSA-N	438.440	1.398	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)CC1(CC(=O)N2CCOCC2)CCCC1	1116664408	JQEPNGBMAJEOPV-MRXNPFEDSA-N	425.526	1.311	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NN=Cc1cc(C)ncn1)N(S(C)(=O)=O)CC2	1117698165	YGHKEXVRMVDUMX-QGZVFWFLSA-N	447.517	1.201	50	20	IDGD	
CCOC(=O)c1ncc(C(=O)NNC(=O)COc2ccc(Br)cc2)s1	1321318893	QTWWEVRQAAGWQK-UHFFFAOYSA-N	428.264	1.922	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CN(Cc2nc(O)c3ccccc3n2)CCO1)c1ccccc1Cl	1322076206	ISGMHWGBBUXAPT-KRWDZBQOSA-N	441.875	1.651	50	20	IDGD	
O=C(NCc1ccncc1OC[C@H]1CCOC1)NNC(=O)c1cncn1-c1ccccc1	1323460219	FIJVCMGSLIOGGG-INIZCTEOSA-N	436.472	1.827	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)c1ccc(N2CCC[C@@H](C(N)=O)C2)cc1	1324036098	FQCMBPMMUABHBG-GOEBONIOSA-N	428.464	1.756	50	20	IDGD	
CN(C)C(=O)[C@@H]1CCC[C@H](NC(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)C1	1339221080	OTOMEKGYMHHCLE-CVEARBPZSA-N	439.557	1.611	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3n[nH]c4c(F)cccc34)C2)C1	1778636756	FAAHTIORGHKSMP-BBATYDOGSA-N	439.285	1.929	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)/C=C3\C(=O)Nc4ccccc43)C2)C1	1778910026	YIPWUBCVKCUCDY-HKGQPFLSSA-N	448.317	1.635	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnn(C)c3Cl)C2)C1	1779863864	WPBFVTFMGYNSPQ-LRDDRELGSA-N	433.734	1.691	50	20	IDGD	
O=C(c1cccc(-c2cnccn2)c1)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1780184846	BMKHOESKYHCKMH-WIYYLYMNSA-N	430.892	1.187	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](COC(C)=O)OC(C)=O)C2	1780704955	YUNZKQKZGHSYHT-MIALQEHNSA-N	446.928	1.013	50	20	IDGD	
Cc1nnc(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@](C)(Cl)CCl)C2)o1	1780713271	PITCSYBPRRDSEQ-FSPWUOQZSA-N	433.336	1.671	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1c[nH]c(=O)cn1)C2	1780715736	XYYOGQIGGZYIKK-FSPWUOQZSA-N	431.320	1.134	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)CC(=O)Nc3ccc(F)cc3)C2)C1	1780883991	RKDKRUZMOCHLOH-UZLBHIALSA-N	441.887	1.238	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](COC)NC(=O)OC(C)(C)C)CCO2	1781217098	FFTSEKQPBZAUFL-SXGZJXTBSA-N	447.960	1.373	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)ncn1)C2	1781901575	RADLBRGRTAIVOZ-WPKBUWHJSA-N	441.326	1.483	50	20	IDGD	
C=CCNC(=O)/C=C\C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)Br)C1	1781995556	PNXRQILMMUNWER-NHQFCNANSA-N	442.354	1.142	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Br)C2	1782003845	WUGHNKPHEVXPPI-NJBDSQKTSA-N	444.139	1.974	50	20	IDGD	
CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1782053721	SWWGTWCQTBBALC-SFHVURJKSA-N	445.303	1.908	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc3ncccc3[nH]1)C2	1782178498	KMIFLRCCASGHHG-FIKMYACPSA-N	434.924	1.944	50	20	IDGD	
Cc1ccc(C)c(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CCC(=O)NN(C)C)C2)c1	1782214057	LMDXPXVOBREYCM-HYBUGGRVSA-N	444.576	1.804	50	20	IDGD	
O=C(CCc1c[nH]c2ccc(F)cc12)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1783671659	IFENAUYXNRPZLS-GHTZIAJQSA-N	437.899	1.669	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3[C@H]4c5ccccc5S[C@H]43)C[C@@H]21)[C@H](O)CCl	1784092196	IWAVXAPMYFINQB-HRAVXQGUSA-N	436.961	1.454	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN(C)C(=O)c3ccccc3)[C@H]2C1	1784347411	SMAIKBWCIDMGRA-VJANTYMQSA-N	435.952	1.756	50	20	IDGD	
COc1ncc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Br)C[C@@H]32)cc1C	1786272402	MREVXEFZCREHIV-CYUUQNCZSA-N	444.301	1.682	50	20	IDGD	
O=C(Cc1ccc2c(c1)OCO2)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21	1786597189	BWHMTJGEMUJCGX-XEZPLFJOSA-N	429.300	1.741	50	20	IDGD	
Cc1noc(C)c1CC(=O)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1	1786717313	FLUCWIRETUVILR-UHFFFAOYSA-N	447.300	1.962	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)c3cc(=O)cco3)CCC2)cc1)c1ccc(B(O)O)cc1	1788140643	DYKHXWTWCAWMEW-UHFFFAOYSA-N	432.241	1.381	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3[nH]nc4ncccc34)C[C@@H]21	1788765070	RCFULWIBNOFYNA-BPUTZDHNSA-N	431.569	1.403	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(-c4ccccn4)[nH]n3)[C@H]2C1	1788949552	OUZJZWLUTFGUFL-XLPNERPQSA-N	447.923	1.319	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(=O)nc4cccnn34)[C@H]2C1	1789197800	GTMRFICALKHKIH-MPTYRVRUSA-N	447.923	1.090	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3ccc(OC)cc3C#N)[C@H]2C1	1789843442	KYDLTPFVTTXNEY-QLIIJSOBSA-N	449.935	1.343	50	20	IDGD	
Cc1noc(C)c1CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]2C1	1789922895	XIILOASSCUSNRE-ATVPRXPUSA-N	432.290	1.504	50	20	IDGD	
C=C(CC(=O)OCC)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]2C1	1789923379	JWASAGPIGAXCLF-PWNZVWSESA-N	435.290	1.166	50	20	IDGD	
CCCNC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](Br)CC)[C@H]2C1	1790958551	UNTDMAMMDFPPNB-JONQDZQNSA-N	446.386	1.446	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nccnc3C)C[C@@H]21	1790960588	MZTJGBWVOVQGQO-AJNGGQMLSA-N	425.327	1.552	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(Cl)nn3)C[C@@H]21	1791056292	RLWRABLKVPCNFZ-BLFANLJRSA-N	431.718	1.507	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnn4ccc(C)cc34)C[C@@H]21	1791254896	VXZQPYQULQNSDJ-XPYUAMARSA-N	434.924	1.490	50	20	IDGD	
C[C@@H](C(=O)NC1(c2ccc(NC(=O)CCC(=O)NN(C)C)cc2)CCC1)n1ccnc1	1791599470	ITZSXVZSONNNPB-INIZCTEOSA-N	426.521	1.951	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3ccc(O)cn3)[C@H]2C1	1791706750	RTBOVUBVPBFRGE-PYTWLRIVSA-N	440.338	1.340	50	20	IDGD	
Cc1ccc(=O)n(C(C)(C)C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C(C)(C)CCl)n1	1792782786	DVAXGVWLEPCERQ-SCAQPMJSSA-N	438.956	1.141	50	20	IDGD	
Cc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)CBr)nn1C(F)F	1792872722	ZCONTXMSKCFBBN-ZKCLLBTKSA-N	449.296	1.821	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(F)ccc1C(F)(F)F)C2)[C@@H](O)CCl	1792983342	HXGMAHVZVFETSL-OWLDWWDNSA-N	438.805	1.647	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCCN1C(=O)c2ccccc2C1=O)[C@H](O)CCl	1794125720	YGAAHUJHNWLCCF-BASYENTBSA-N	447.919	1.301	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCCn1c(O)nc3ccccc31)C2)[C@H](F)Cl	1796367870	YQLXPPPQTJRJLP-GGNLRSJOSA-N	438.887	1.646	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cn2ccccc2n1	1796829592	QBKAQAVLRUWEJO-UMPJEAMMSA-N	435.322	1.711	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc2cnccc2c1)c1ccc(B(O)O)cc1	1797498200	BIKCEBMSJATSEY-KOUNCHBCSA-N	429.285	1.480	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc2cnccc2c1	1797499756	APQDYMKXXVCUNM-REPLKXPHSA-N	444.495	1.799	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccn2cncc2c1	1797501445	GOWSJQZDYRTUMX-FAYQHZLMSA-N	435.322	1.569	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)c1cc(-c2cccs2)on1	1798125795	LKFWPXNGCZWJHW-DDFXLWFNSA-N	425.894	1.206	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(-c2ccccn2)[nH]n1	1798173212	JNXNEAZOQBQQDK-JRATXPSKSA-N	448.321	1.458	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(O)c(OC)c1	1798953665	DVDSEKSRLDERMQ-LOUJCGABSA-N	441.322	1.778	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nccc3[nH]ccc13)C2)[C@H](F)Br	1799346202	JABAAADOUIRZOF-FJHTZYQYSA-N	425.258	1.457	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c(c1)OCCO3)C2)[C@H](F)Br	1799347286	KPNZYMBXTDJHPR-VZAMPYOESA-N	443.269	1.352	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(Cl)cc(Cl)n1)C2	1800978850	MBTLZQYPQCTICE-HOZXKAFVSA-N	436.723	1.845	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1(NC(=O)OC(C)(C)C)CC1)C2	1802283709	XNRMKOLYGTVJCL-LXTVHRRPSA-N	429.945	1.936	50	20	IDGD	
COc1cncc(CCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CCC(=O)NN(C)C)c1	1802333096	MJJYZNPICNJNOR-BCDXTJNWSA-N	431.537	1.034	50	20	IDGD	
CN(C)C(=O)NCC(=O)NC[C@@H]1CCN(C(=O)[C@](C)(Cl)CCl)[C@@H]1c1cccnc1	1802681290	PHNYSZDDDIIODT-ZSZQSSIHSA-N	444.363	1.595	50	20	IDGD	
CC(C)[C@H](S)C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1803598114	JOYYVXUWGCDYGD-SXLOBPIMSA-N	441.362	1.035	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1803694362	HWTXZFQOVNAJKE-ZWOKBUDYSA-N	437.972	1.868	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@H]1c1cccnc1)c1cnsn1	1804995480	IGSXRMYURQHNSJ-DRZSPHRISA-N	428.287	1.943	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)c3cc4cccn4cn3)CC2)C1	1809978817	UKTOBGWONDKNHX-UHFFFAOYSA-N	446.316	1.173	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)C2CCCC2)[C@H]1c1cccnc1	1810298598	KGHYNBYDODJZDG-PXNSSMCTSA-N	436.516	1.590	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1ccc(F)cc1	1811900963	QGYBWBAQRGWKNT-DENIHFKCSA-N	447.275	1.534	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)C(F)(F)Cl)[C@H]1c1cccnc1	1813072544	DASOPQZEMUXMML-CJNGLKHVSA-N	431.871	1.292	50	20	IDGD	
O=C(O)c1cnncc1C(=O)N1CC[C@H](CNC(=O)C(Cl)Cl)[C@@H]1c1cccnc1	1813078253	GTMJOPGRDMJHDD-RISCZKNCSA-N	438.271	1.693	50	20	IDGD	
C=CCOCCCC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1815207249	ZKWLDKRYTWCLJN-LJQANCHMSA-N	440.309	1.378	50	20	IDGD	
Cc1c(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)[C@H](F)Cl)n[nH]2)cn2[nH]cnc(=O)c12	1818041646	UFVGGZQVSQQFHP-DOMZBBRYSA-N	435.847	1.894	50	20	IDGD	
CC(C)=NO[C@H](C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1	1820977503	ZSPISJJYWNKNQP-GDBMZVCRSA-N	435.529	1.576	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc[n+]([O-])cc3)sc2C1	1821054640	SHCIJLRHCUGATC-GXSJLCMTSA-N	425.308	1.786	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)COC(=O)C(F)(F)F)[nH]n1	1822369755	HXGCOBDSAYPILV-GXSJLCMTSA-N	440.806	1.761	50	20	IDGD	
Cc1ccnc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)c1	1822414824	ZNSGVNGNWCKZSC-KRWDZBQOSA-N	427.509	1.792	50	20	IDGD	
CC[S@](=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1	1823006368	AATFINAULWGKHY-VZPAGZTGSA-N	440.360	1.904	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H]3CCC(=O)N3C)sc2C1	1823043059	QCMQABVLBRXSMB-UMNHJUIQSA-N	443.367	1.707	50	20	IDGD	
COC1(CC(=O)Nc2cc([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)CCC1	1823070304	AVDALLMWYKAIQE-GOSISDBHSA-N	440.309	1.355	50	20	IDGD	
Cn1cc2cc(C(=O)Nc3nc4c(s3)C[C@@H](NC(=O)[C@@H](O)CCl)CC4)ccc2n1	1823949500	PUJZCIOTHISCTD-WFASDCNBSA-N	433.921	1.855	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)CCl)CC2)c1cc2cccnc2nc1O	1823981019	VPNRWGVVEHJUFT-MFKMUULPSA-N	447.904	1.617	50	20	IDGD	
CC[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCn1ccnn1)CC2	1825453365	WXKWGRIFXGELAD-WDEREUQCSA-N	441.355	1.910	50	20	IDGD	
Cc1nc(C)c(C(=O)N[C@@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)o1	1826087640	HBJJTODSKVHLFC-GFCCVEGCSA-N	434.522	1.347	50	20	IDGD	
CCS(=O)(=O)N[C@@H](C)C(=O)N[C@H]1CCc2nc(NC(=O)C(Cl)Cl)sc2C1	1826092876	NJKFJVJYKZTNNU-YUMQZZPRSA-N	443.378	1.187	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC[C@H]1C1CCN(C(=O)C23CC(F)(C2)C3)CC1	1827055859	MOIMJOFPCDXLEZ-BVVFMGSASA-N	428.313	1.492	50	20	IDGD	
Cc1cc(CC(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)no1	1827060699	XPQPOJHNRKQGRG-NRFANRHFSA-N	439.321	1.139	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(F)nc3F)CCO2)C1	1829533736	OIIYEPNERYKPHL-PIGZYNQJSA-N	448.264	1.213	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)COc3ccc(O)cc3)C2)C1	1830354292	WBFIKYODQAQGRK-OAQYLSRUSA-N	440.924	1.492	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3ccco3)C2)C1	1830535108	JFKIPBUSPYNGEG-DNVCBOLYSA-N	443.338	1.700	50	20	IDGD	
CC#CC[C@H](C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2)c1ccccc1	1830732466	YUTMPQXURPDBDP-SXWKCWPCSA-N	448.947	1.240	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)CCc2cn[nH]c2)CC1	1831871253	PXKCBTLOZSXPIJ-IBGZPJMESA-N	432.569	1.335	50	20	IDGD	
C#CCO[C@@H](C)C(=O)NC1CCN(C2CCN(C(=O)[C@H](C)Br)CC2)CC1	1833469025	JUJULLUWRSMRNT-GJZGRUSLSA-N	428.371	1.380	50	20	IDGD	
Cc1cc[nH]c1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)CBr)C2)C1	1833538535	VBKKMIVPJQNYLC-KSSFIOAISA-N	428.327	1.424	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ocnc3C)CCO2)C1	1834369334	HPHWXOQFUFOOQU-DYVFJYSZSA-N	430.299	1.227	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)CSC(=N)N)CC2)CC1	1834652757	AYFJSZTWZGIIIO-LBPRGKRZSA-N	448.431	1.216	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cnncc3C(=O)O)CC2)CC1	1835920532	BQBSDIDSNPNCFT-QGZVFWFLSA-N	437.928	1.377	50	20	IDGD	
CCc1ccnc(C(=O)N2CCO[C@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)c1	1836360821	JXRDCBYYWLAIIN-NRFANRHFSA-N	435.597	1.566	50	20	IDGD	
CC(=O)O[C@H](C(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)C(C)C	1836717182	MAOGWATYZCUVAK-ROUUACIJSA-N	432.945	1.172	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)N1C[C@@H]3C[C@H]3C1)CCO2	1837279731	RKSOKJDLCDEVMR-ZZAJSIFASA-N	427.973	1.191	50	20	IDGD	
CCOCC(=O)N1CCC(OC2CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CC2)CC1	1837702088	SDWXHRCFDXMQRC-LFVJCYFKSA-N	447.536	1.156	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ncoc3C)CCO2)C1	1838208347	DGFOFYDXBLMQQT-SUMWQHHRSA-N	430.299	1.227	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3nnc(C)s3)C2)C1	1839142423	OIHZKADPFKPBPT-KDOFPFPSSA-N	430.958	1.253	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(C)c([N+](=O)[O-])cn3)C2)C1	1839144565	FFIWOGHMHAIBQY-IFXJQAMLSA-N	440.884	1.386	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnn4cccc(C)c34)C2)C1	1839148516	ZOUBMLLOAURIOA-UWJYYQICSA-N	434.924	1.730	50	20	IDGD	
Cc1ccsc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839198041	RCHFCRAIQFNIEA-CJNGLKHVSA-N	435.315	1.817	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(O)cc3F)CCO2)C1	1839317552	IUNZHZRINGPCTP-SGTLLEGYSA-N	445.285	1.385	50	20	IDGD	
CC(C)c1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)no1	1840031423	PNEAQYWWDBXOEI-SCLBCKFNSA-N	444.326	1.651	50	20	IDGD	
Cc1nc(F)ccc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2	1840034486	NHTURJDJBQOAOI-XIKOKIGWSA-N	444.301	1.383	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4ncoc4c3)C2)C1	1840152628	NZADTGYJGOXRIK-YWZLYKJASA-N	437.880	1.152	50	20	IDGD	
O=C(C(Cl)Cl)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CCc4ccccc4O3)C2)C1	1840190999	ZEXTYELUBXCENT-JXFKEZNVSA-N	443.327	1.640	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(NC(C)=O)cc3)CCO2)C1	1840727398	FDJKYLFWHTVHET-GHTZIAJQSA-N	437.924	1.732	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCCC12CN(C(=O)[C@@H](O)c1ccco1)C2	1841924013	NFJYWYLUYHVLLG-ZFWWWQNUSA-N	441.912	1.649	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC2(CCCN2C(=O)CNC(=O)c2cccs2)C1	1842065376	NLYOFQWPHQNOKV-GFCCVEGCSA-N	428.352	1.855	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC2(CCCN2C(=O)[C@H](CO)NC(=O)OC(C)(C)C)C1	1843326579	WDHMBKZZBOCTTF-OLZOCXBDSA-N	448.358	1.249	50	20	IDGD	
C[C@H](NC(=O)c1cnccn1)C(=O)N1CC2(CCCN2C(=O)[C@](C)(Cl)CCl)C1	1845171300	RDIMPXAKKPTQLF-YVEFUNNKSA-N	428.320	1.035	50	20	IDGD	
CC(=O)c1cccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)c3ccccc3F)CC2)c1	15991454	LQOGIZFKCVDUPS-UHFFFAOYSA-N	447.488	1.890	50	20	IDGD	
NS(=O)(=O)c1ccc(Cl)c(C(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)c1	24235464	CTSYPAUZTRWGAV-UHFFFAOYSA-N	446.268	1.259	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1Br	24291448	WRVGWRIMFXSIIL-UHFFFAOYSA-N	441.307	1.826	50	20	IDGD	
C#CCNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cc3c(s2)CC[C@@H](C)C3)cc1	27331877	AKSPSMGXFAZYJF-CYBMUJFWSA-N	431.539	1.859	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)N1CCC(C(=O)NC2CCCCC2)CC1	725873908	USAYROHLYKESOE-UHFFFAOYSA-N	435.550	1.380	50	20	IDGD	
Cc1ccc(C)c(S(=O)(=O)NCC(=O)NNC(=O)c2cc(Br)c[nH]2)c1	726292657	CQTWUAGMDXVFGQ-UHFFFAOYSA-N	429.296	1.134	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)NCC(=O)N1CCc2ccccc2C1	726715287	MEHPLIPQLXEBII-UHFFFAOYSA-N	426.473	1.379	50	20	IDGD	
O=C(NNC(=O)N1CCO[C@@H](c2ccccc2F)C1)c1csc(N2CCOCC2)n1	727474143	ZYRGCSDJFDYDCO-MRXNPFEDSA-N	435.481	1.547	50	20	IDGD	
COCCNC(=O)CSc1ccccc1C(=O)NNc1nc(-c2ccncc2)no1	728072380	GYXWHBFHDWAGGD-UHFFFAOYSA-N	428.474	1.743	50	20	IDGD	
COc1cc(C(=O)NCC(=O)NNc2nc(-c3ccccc3)no2)cc(OC)c1OC	728080489	RWFRNGXQCFXKII-UHFFFAOYSA-N	427.417	1.636	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)COc3ccc(Cl)cc3)cc2)CC1	728213386	KDFMBDBEARBICY-UHFFFAOYSA-N	438.937	1.798	50	20	IDGD	
O=C(COC(=O)c1ccc(Cl)nc1Cl)NNC(=O)[C@H]1COc2ccccc2O1	728338458	DGZXNBZYYBIHFV-GFCCVEGCSA-N	426.212	1.533	50	20	IDGD	
CCOc1cn(-c2ccccc2)nc1C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	728845170	DUMFCSTVCCCDJV-UHFFFAOYSA-N	435.488	1.739	50	20	IDGD	
CN(C)CCOc1ccccc1CNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1	728952554	YKFBKNPABUNUHI-UHFFFAOYSA-N	441.536	1.164	50	20	IDGD	
CS(=O)(=O)CCNC(=S)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1	729159826	YCDDWBIRRWCLIT-LJQANCHMSA-N	446.598	1.153	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(CCNC(=O)NNC(=O)c2ccc(C#N)cc2)s1	729227039	GRECTOVZTCNQKC-UHFFFAOYSA-N	449.558	1.837	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)[C@@H]2Nc3ccccc3S(=O)(=O)N2)c(C)n1-c1ccccc1	729258372	RKMDZHTVQANLGK-LJQANCHMSA-N	439.497	1.585	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)[C@@H]1CCCN1S(=O)(=O)c1cccs1	729451924	JWSWIDILVQHEOI-INIZCTEOSA-N	432.527	1.704	50	20	IDGD	
O=C(CNC(=O)c1c(Cl)cccc1[N+](=O)[O-])NNC(=O)Cn1cnc2ccccc21	731058825	BQHBVZQESOISHK-UHFFFAOYSA-N	430.808	1.175	50	20	IDGD	
CC(C)(C(=O)NNC(=O)c1cccc(S(=O)(=O)NC[C@H]2CCCO2)c1)c1ccccc1	731231396	NQKWJKLPOJWYMR-GOSISDBHSA-N	445.541	1.883	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)c2ccccc2OC)cc1S(=O)(=O)N1CCOCC1	731492776	IJGKYXIQZVZHDQ-UHFFFAOYSA-N	447.513	1.353	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)N1CCN(S(=O)(=O)c2ccc(Cl)c(Cl)c2)CC1	731848684	KVOLSWAOWCQPHA-NSHDSACASA-N	437.349	1.246	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)NCc2ccc(N(C)S(C)(=O)=O)cc2)c1	732476023	VYVPAZGHAKVLPW-UHFFFAOYSA-N	434.518	1.609	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)N[C@H]2CCN(c3ccccc3C(N)=O)C2)c1C	732595414	QQIDMQFQHOZRMU-SJORKVTESA-N	439.516	1.779	50	20	IDGD	
NC(=O)[C@H]1CC(C(=O)NNc2nc(-c3ccc(Cl)cc3)no2)=NN1c1ccccc1	732976979	VYDSUJHCMVDANM-OAHLLOKOSA-N	425.836	1.953	50	20	IDGD	
Cn1c(NNC(=O)CN2C(=O)c3ccccc3N3C(=O)CC[C@]23C)nc2ccccc2c1=O	733365822	SWWAEAGPIWXJAZ-HSZRJFAPSA-N	446.467	1.376	50	20	IDGD	
N#Cc1ccc(N2C(=O)N[C@@H](CCC(=O)NNC(=O)Cc3ccc(Cl)cc3)C2=O)cc1	733777123	NYQZEMQHKCEMEU-KRWDZBQOSA-N	439.859	1.807	50	20	IDGD	
CCc1cc(NNC(=O)CN2C(=O)COc3ccc([N+](=O)[O-])cc32)nc(-c2ccccn2)n1	734357417	UDSXCSRNRJSHLP-UHFFFAOYSA-N	449.427	1.878	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)C(=O)NCCCc2ccccc2)CC1	734821459	KKQBEMJQNJPEEZ-UHFFFAOYSA-N	447.536	1.465	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)N[C@@H](C)CN2CCN(c3ccccn3)CC2)cc1	735585126	AODOZJLZBVMCQM-KRWDZBQOSA-N	442.520	1.010	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)CCNC(=O)c2ccc(F)cc2)cc1C	736794898	CBJKGQRURWMZLE-UHFFFAOYSA-N	435.477	1.882	50	20	IDGD	
COc1ccccc1OCC(=O)NN=C(C)c1cccc(S(=O)(=O)N2CCOCC2)c1	739401123	YDKJLPXXODLEBA-UHFFFAOYSA-N	447.513	1.635	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2ccccc2CN2CCOCC2)cc(OC)c1OC	740738290	CWNUJYMKMFMUCF-UHFFFAOYSA-N	429.473	1.619	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=S)N[C@H]2CCOc3ccccc32)cc1	741478344	XRYMFHPTHDHGDO-KRWDZBQOSA-N	448.570	1.635	50	20	IDGD	
O=C(CN1C(=O)[C@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O)NNC(=O)c1ccc(-c2ccc(F)cc2)s1	742485229	BZYORERPBDZGBH-OSLDLMBLSA-N	443.456	1.478	50	20	IDGD	
C[C@@H](CN1CCN(c2ccccc2)CC1)NC(=O)NNC(=O)CNC(=O)c1cccs1	743577993	GPODUQFMPGWHJU-INIZCTEOSA-N	444.561	1.019	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)c1nc(-c2cccc(F)c2)no1	743705434	TYSMESPCOBBUGS-NSHDSACASA-N	447.448	1.984	50	20	IDGD	
C[C@@H]1Cc2cc(C(=O)NNC(=O)Nc3ccc(N(C)C)cc3)ccc2N1S(C)(=O)=O	743828733	CNBAZBMZNQUISE-CYBMUJFWSA-N	431.518	1.930	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)c1ccccc1F)C(=O)NNC(=O)NC1CCCC1	744052741	QTEAAXDNDNIAGR-CQSZACIVSA-N	432.543	1.499	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)CCCc2nnc(-c3ccccc3)o2)cc1	744741749	JBHPGXGDILPNCN-UHFFFAOYSA-N	433.424	1.935	50	20	IDGD	
Cc1ccc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)N3CCOCC3)cc2)cc1C	745992940	OIGUYGCCCFUVOQ-UHFFFAOYSA-N	432.502	1.791	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@@]2(O)CCN(Cc3ccccc3)C2)cc1Br	746250649	RMDYKQIZGVQYBD-HXUWFJFHSA-N	448.317	1.856	50	20	IDGD	
O=C1CN(S(=O)(=O)c2ccc(C(=O)NNc3ccc(Cl)c(F)c3)cc2)CCN1	746695086	AMEIRINRRCDMQL-UHFFFAOYSA-N	426.857	1.357	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(CC(=O)NNC(=O)c2ccc(Cl)cc2F)C(=O)C1	747331928	DGMFNHPJMPZVIX-UHFFFAOYSA-N	428.848	1.319	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)CCN/C(O)=C1/N=CC=CC1=O	748593672	JNJSJDSRPZVBPF-ZCXUNETKSA-N	435.506	1.123	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)NCCNC(=O)Cc2cccc(F)c2)c1C	749015457	YOESGEZIZSVYEQ-INIZCTEOSA-N	430.480	1.899	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)NCC2CCN(CC(=O)NC(C)(C)C)CC2)cc1	751112031	RBEXUNQEBFBNIJ-UHFFFAOYSA-N	447.584	1.715	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)c1cccc(NC(=O)[C@H]2Cc3ccccc3O2)c1	751202323	BZMCSMGZYPDUNO-LJQANCHMSA-N	448.435	1.413	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)c1ccccc1I	751214547	BFDZCZATZUBBDR-UHFFFAOYSA-N	429.239	1.544	50	20	IDGD	
CCOC(=O)[C@H]1Cc2cc(S(=O)(=O)NNC(=O)NCCc3cccs3)ccc2O1	751541332	WIBDXWTYPWZKNO-MRXNPFEDSA-N	439.515	1.350	50	20	IDGD	
CCN1C(=O)[C@@H]2CN(C(=O)/C(C#N)=C/c3cc(C)n(C[C@H]4CCCO4)c3C)CCN2C1=O	752507435	IUFMYEOJYZDZFP-INQFTJRBSA-N	439.516	1.686	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)c1nc(Cc2ccccc2)no1	753035851	CBUNHNNUDMJPBO-CYBMUJFWSA-N	443.485	1.769	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)NCC2(NC(=O)OC(C)(C)C)CCC2)nc2ccccc21	753330255	OKIITYFESRJLGM-UHFFFAOYSA-N	430.509	1.894	50	20	IDGD	
O=C(CSc1ccc(Cl)cc1)NNC(=O)NC1CCN(S(=O)(=O)C2CC2)CC1	753968846	ZDRAYALTLNGUHO-UHFFFAOYSA-N	446.982	1.719	50	20	IDGD	
C[C@@H](CS(=O)(=O)c1ccc(F)cc1)C(=O)NNC(=O)[C@@H](C)Oc1ccc(F)cc1	755048178	DOGNUOLWMRYDGP-QWHCGFSZSA-N	426.441	1.990	50	20	IDGD	
C[C@H](CS(=O)(=O)c1ccc(F)cc1)C(=O)NNC(=O)c1cc(Br)c[nH]1	755066750	XSVPXWRWNKUBCU-SECBINFHSA-N	432.271	1.787	50	20	IDGD	
O=C(Cc1ccc2ccccc2c1)NNC(=O)NCCN1C(=O)[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O	755259210	SLIAWHZFIRDPDT-JYAXBFRTSA-N	432.480	1.520	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1cnn(C)c1)C(=O)NNc1c(F)cc(F)cc1Br	755407033	LOSPMBDGENSOJL-SSDOTTSWSA-N	438.254	1.271	50	20	IDGD	
CC(C)Cc1nnc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)s1	755413631	XLDZMVSXQOWNPY-UHFFFAOYSA-N	426.524	1.453	50	20	IDGD	
O=C(COc1cccc(NC(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)c1)Nc1ccccc1	756017751	ISLFLWNIELWVFL-CQSZACIVSA-N	446.485	1.292	50	20	IDGD	
NC(=O)CCNC(=O)c1cccc(NC(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)c1	756390513	IIYNUQLAWPJFFX-UHFFFAOYSA-N	427.505	1.661	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)Nc1ccc(S(=O)(=O)NCc2ccccc2)cc1	756865671	UNPYWVZGUZCYTA-UHFFFAOYSA-N	427.486	1.970	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCN(c3ccc(F)cc3Cl)CC2)n1	757163614	PHPROPMHVOGGNE-UHFFFAOYSA-N	425.917	1.756	50	20	IDGD	
COc1ccc(CC(=O)NCc2ccc(C(=O)NNc3ccc(C(N)=O)nn3)cc2)cc1	757402260	LVUFNPDDCVZSLP-UHFFFAOYSA-N	434.456	1.200	50	20	IDGD	
Cc1ccc(-n2nnc(C(=O)N3CCN(S(=O)(=O)CBr)CC3)c2C)cc1	758523248	MZLIITHYFJKLFO-UHFFFAOYSA-N	442.339	1.324	50	20	IDGD	
Cc1nc(-c2ccccc2)[nH]c1C(=O)N1CCN(S(=O)(=O)CBr)CC1	758527982	NGVLTGOITUUEDY-UHFFFAOYSA-N	427.324	1.825	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)N[C@@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1C#N	758751960	LPAUHXUQOXDKQO-KCQAQPDRSA-N	435.456	1.682	50	20	IDGD	
CC(C)[C@H](C(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1)N1CCCC1=O	758787074	RRXSHMOPPSPNAX-MRXNPFEDSA-N	425.530	1.269	50	20	IDGD	
COC(=O)c1cccc(CC(=O)NNC(=O)c2cc(-c3ccc(OC)c(OC)c3)[nH]n2)c1	759816657	UYEJGFHUKSBTAD-UHFFFAOYSA-N	438.440	1.884	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2ccc(OCC(F)F)nc2)ccc1Cl	761204500	GFIQBMVAFSAGMX-UHFFFAOYSA-N	434.808	1.101	50	20	IDGD	
Cn1cnc2cc(C=NNC(=O)c3cccc(S(=O)(=O)N4CCOCC4)c3)ccc21	761254024	OICLNAGADSXRER-UHFFFAOYSA-N	427.486	1.358	50	20	IDGD	
C#CCNS(=O)(=O)c1cccc(C(=O)NNC(=O)CSc2ccccc2OC)c1	761633631	NUNVHFAOUKDWNO-UHFFFAOYSA-N	433.511	1.160	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)N[C@@H]1CCCN(Cc2ccccc2)C1=O	761793380	GSWDHHNNIVCKGU-QGZVFWFLSA-N	434.456	1.471	50	20	IDGD	
Cc1[nH]c(-c2ccncc2)nc(=O)c1CC(=O)NNC(=O)c1cc(-c2ccccc2)[nH]n1	762929706	AASYFOFZIKOMII-UHFFFAOYSA-N	429.440	1.534	50	20	IDGD	
C=CCNC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3n2)cc1	763449350	BMHSFFKYLWOVBQ-UHFFFAOYSA-N	432.440	1.942	50	20	IDGD	
O=C(NNC(=O)c1ccccn1)C(=O)Nc1cc(I)ccc1Cl	763464959	ZEAAAFUVFHTNCG-UHFFFAOYSA-N	444.616	1.739	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(-c2noc(C(F)F)n2)cc1	763468919	YEKYPJURMLQQMQ-UHFFFAOYSA-N	446.326	1.982	50	20	IDGD	
CCOC(=O)N(C)c1ccc(NC(=O)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1	763471064	CELOPVGPLODELP-UHFFFAOYSA-N	429.389	1.587	50	20	IDGD	
CCCN1C(=O)CCc2cc(NC(=O)C(=O)NNC(=O)c3c(C)nc4ccccn34)ccc21	763628377	JGFVHSWEMSLJPG-UHFFFAOYSA-N	448.483	1.732	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(Cl)c2-n2cccn2)c1	763631074	UKQASRKYABIISZ-UHFFFAOYSA-N	427.848	1.999	50	20	IDGD	
CCOC(=O)N(C)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(OC)cc2)cc1	763658803	CMKJZXLVSYYBKF-UHFFFAOYSA-N	444.444	1.453	50	20	IDGD	
CCN(CC)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2F)cc1	763678208	ACRFAUUQVOSUGQ-UHFFFAOYSA-N	430.436	1.473	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2ccc(-n3cc(C)cn3)c(F)c2)c1	763775154	LVIBMRGISCKPHN-UHFFFAOYSA-N	441.419	1.737	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)C(=O)Nc1ccc(CCN2CCCC2)cc1	763789696	AGCLKONFPDQVIK-UHFFFAOYSA-N	448.483	1.373	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)C(=O)Nc1ccc(F)cc1Br	763790586	LPWPEVJUJXQRSA-UHFFFAOYSA-N	448.208	1.637	50	20	IDGD	
CCOc1cccc(NC(=O)C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)c1	763790723	NRAIUUNSOMRWPW-UHFFFAOYSA-N	437.456	1.776	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)C(=O)Nc2ccc3c4c(cccc24)CC3)c2ccccc2c1=O	763791840	ZEWQEVLABNMNRB-UHFFFAOYSA-N	441.447	1.585	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccc(OC[C@@H]2CCCO2)c1	763809702	ZHMZBLWIALGLDN-SFHVURJKSA-N	438.440	1.281	50	20	IDGD	
Cn1c(=O)oc2c(NC(=O)C(=O)NNC(=O)CCSc3ccc(F)cc3)cccc21	763894329	AFZJDESHNMOEDA-UHFFFAOYSA-N	432.433	1.539	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)C(=O)Nc2ccc(N3CCOCC3)c(F)c2)cc1	763895228	AVJJFDCSNUBVNP-UHFFFAOYSA-N	446.504	1.849	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2nn(C(C)(C)C)cc2C#N)cc1OC	763903699	SGWWSUMPBAXUFY-UHFFFAOYSA-N	428.449	1.317	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)C(=O)Nc1ccccc1SCc1ccccc1	764001756	FCEZDYYOHJADHD-HNNXBMFYSA-N	447.538	1.500	50	20	IDGD	
Cc1nccn1-c1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)on2)cn1	764003573	HTLCBBUDJMIZRG-UHFFFAOYSA-N	431.412	1.630	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)on2)cc1	764004600	YWPSMTJSBLLFCF-UHFFFAOYSA-N	438.396	1.293	50	20	IDGD	
Cc1ccc(S(C)(=O)=O)cc1NC(=O)C(=O)NNC(=O)c1cccc(C(F)(F)F)c1	764037695	UEXHXZCVWYLBBK-UHFFFAOYSA-N	443.403	1.817	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Br)cc2Cl)cn1	764058922	KOKRCYBYPGYVQQ-UHFFFAOYSA-N	427.642	1.906	50	20	IDGD	
Cc1nc(Br)ccc1NC(=O)C(=O)NNC(=O)c1ccc(Cl)cc1O	764126209	FOOMNDBSKVHKBZ-UHFFFAOYSA-N	427.642	1.911	50	20	IDGD	
Cc1ncsc1C(=O)NNC(=O)C(=O)Nc1ccc(OCC(F)(F)C(F)F)nc1	764245344	DVXIRIDFKBXJIN-UHFFFAOYSA-N	435.359	1.525	50	20	IDGD	
C=CCNC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2cccc3ncccc23)cc1	764252613	JCHPRHGMRXWCNA-UHFFFAOYSA-N	432.440	1.942	50	20	IDGD	
CC(C)n1nnnc1-c1ccccc1NC(=O)C(=O)NNC(=O)C(C)(C)c1ccccc1	764308516	CXHKQZCSYWMAAM-UHFFFAOYSA-N	435.488	1.985	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)ncn3C)cc1Br	764326857	PPHHGKFTEQXXGY-UHFFFAOYSA-N	446.261	1.744	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(C(F)(F)F)ccc2N2CCOCC2)o1	764372112	WEQARIXHLAUADV-UHFFFAOYSA-N	440.378	1.843	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2ccc(C(F)(F)F)nc2)n[nH]1	764378309	YDHJMSIWASUKJI-UHFFFAOYSA-N	448.361	1.899	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(N2CCCCCCC2)c(F)c1	764399067	JKRSFTIBYNHAHC-OAHLLOKOSA-N	438.500	1.734	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1F)C(=O)Nc1ccn(CCc2ccncc2)n1	764411213	TUBCEUPVQOARCF-UHFFFAOYSA-N	430.827	1.713	50	20	IDGD	
COC(=O)CCCC(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2OC)c1	764451047	WHMGHHXFHNNPAB-UHFFFAOYSA-N	449.485	1.600	50	20	IDGD	
CC[C@H](C)NS(=O)(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)OC(C)(C)C)c1	765398390	ITODWJFANSUZMT-LBPRGKRZSA-N	428.511	1.399	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)C[C@@H]3CC[C@H](C)C3)CC2)cc1	765729367	PJAJFTSQOBCALE-ZWKOTPCHSA-N	436.578	1.275	50	20	IDGD	
CCS[C@H](C)c1noc(CN(C)C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)n1	765751084	JMVZPDKAVIHCSX-CYBMUJFWSA-N	448.553	1.763	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3ccc4c(c3)CCC(=O)N4)CC2)cc1	765754003	JGSBZJNHBWDJDL-UHFFFAOYSA-N	435.528	1.459	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1cc(C(=O)N2CCSCC2)ccc1C	766264996	USTRRRPLKSVDQO-UHFFFAOYSA-N	430.490	1.064	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)N[C@H]1CC(=O)N(c2ccc(Cl)c(F)c2)C1	766554029	SQRWAFCCEDPELV-ZDUSSCGKSA-N	444.854	1.805	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)CCc2cc3ccccc3nc2O)ccc1Cl	767191749	JIIWAXNWFZHHNY-UHFFFAOYSA-N	448.888	1.635	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@H]2CC(C(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)C[C@H](C1)C2=O	767761096	BGYZOKITNZPKFP-GOOCMWNKSA-N	446.460	1.818	50	20	IDGD	
CO[C@H](CNC(=O)OC(C)(C)C)CC(=O)NNc1nc(O)c2cnn(C(C)(C)C)c2n1	767918642	YBJDNXZSODGRPL-NSHDSACASA-N	437.501	1.660	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2cc(C)c(F)c([N+](=O)[O-])c2)cc(OC)c1OC	768263487	RXGPIYSMONXBPZ-UHFFFAOYSA-N	443.409	1.691	50	20	IDGD	
CCOC(=O)c1[nH]c(C)c(S(=O)(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c1C	768500528	SCQZWPZRUBHYLH-UHFFFAOYSA-N	431.474	1.617	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)CCC(=O)c2ccc3c(c2)CCC(=O)N3)C[C@H](C)O1	768686686	ILCTUQNEZNGYOV-GJZGRUSLSA-N	430.505	1.181	50	20	IDGD	
O=S(=O)(CBr)N1CCN(S(=O)(=O)c2ccc3ccccc3c2)CC1	769935008	DCELWSIOBSADNX-UHFFFAOYSA-N	433.349	1.828	50	20	IDGD	
C[C@H](CNC(=O)NNc1nc(O)c2cnn(C)c2n1)Oc1ccc(Br)cc1	770400186	ODVNIBXMMAHERB-SECBINFHSA-N	436.270	1.925	50	20	IDGD	
CC[C@H](NC(=O)NNc1nc(O)c2cnn(C)c2n1)[C@H]1CN(Cc2ccccc2)CCO1	770410084	GYZIILTUYYEDIQ-DLBZAZTESA-N	440.508	1.375	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)N1CCS(=O)(=O)[C@@H]2CCCC[C@@H]21	770649192	MZTYOSNGRLZDNJ-VBNZEHGJSA-N	429.926	1.890	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCN(C(=O)OCc2ccccc2)C1)c1ccc(-n2cnnn2)cc1	770822834	JTSDJTVXAGOLEJ-KRWDZBQOSA-N	435.444	1.082	50	20	IDGD	
CN1C(=O)N(CC(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)C(=O)C12CCCCC2	770968443	WDNXAOGGQSZQOP-UHFFFAOYSA-N	444.496	1.327	50	20	IDGD	
N#Cc1ccc(-c2ccc(OCC(=O)NNC(=O)[C@H]3CCCCS3(=O)=O)cc2)cc1	771866843	FZOPCWCPSHLXLL-LJQANCHMSA-N	427.482	1.719	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)N[C@@H]3CC(=O)N(C4CCCCC4)C3)nc21	772564319	YXIVYFZSLHNPAV-GFCCVEGCSA-N	430.513	1.847	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNS(=O)(=O)c1cc(C(=O)O)sc1C(C)(C)C	773254052	ZDIVJUFCVIZWAB-UHFFFAOYSA-N	435.524	1.578	50	20	IDGD	
Nc1ccccc1S(=O)(=O)NCC(=O)NNC(=O)c1ccc(-c2ccc(F)cc2)s1	774326179	AGDXKSHKDFZQMD-UHFFFAOYSA-N	448.501	1.876	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)Nc2ccc(C[C@@H]3NC(=O)NC3=O)cc2)cc1OC	775704866	HLILCYIRVAENGW-HNNXBMFYSA-N	441.444	1.311	50	20	IDGD	
O=C(NCc1nc(C(F)(F)F)n[nH]1)NNC(=O)c1ccc(F)cc1Br	776254267	PLSAHBZDKDIQGL-UHFFFAOYSA-N	425.140	1.869	50	20	IDGD	
CC(C)(C)OC(=O)N1CC=C(CNC(=O)NNC(=O)CNC(=O)c2cccs2)CC1	777498314	KIRJEVUOIWZPMS-UHFFFAOYSA-N	437.522	1.376	50	20	IDGD	
NS(=O)(=O)N1CCN(S(=O)(=O)c2cccc(S(F)(F)(F)(F)F)c2)CC1	777947260	IZHCUSDBMCGMGM-UHFFFAOYSA-N	431.430	1.854	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)Cc2ccc(C(=O)NNC(=O)c3ccncn3)cc2)cc1	778286214	KESMVVTVZJEQBQ-UHFFFAOYSA-N	439.497	1.681	50	20	IDGD	
COC1(C(=O)NNC(=O)CNC(=O)OC(C)(C)C)CCN(C(=O)OC(C)(C)C)CC1	778436013	BVRVREPNTFUKKK-UHFFFAOYSA-N	430.502	1.075	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CNC(=O)OC(C)(C)C)c(I)c1	778438228	MNSYNASQYLYGLQ-UHFFFAOYSA-N	449.245	1.586	50	20	IDGD	
COc1ccc2nc(NNC(=O)c3ccc(S(=O)(=O)CC(N)=O)cc3)c(C)cc2c1	778476971	OFEMPPKIHMQOQN-UHFFFAOYSA-N	428.470	1.568	50	20	IDGD	
O=C(N[C@]1(C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)CCOC1)OCc1ccccc1	779708608	XBPCBOGXRIGSSS-HXUWFJFHSA-N	428.401	1.441	50	20	IDGD	
C[C@H](C(=O)NNC(=O)CCNC(=O)OC(C)(C)C)N1CCN(c2ccc(F)cc2)CC1	780971556	NSPMIGSYVZTINT-OAHLLOKOSA-N	437.516	1.398	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)c2ccc(OC)c(-n3cnnn3)c2)c1	781685384	VFCNZEASELFCFW-UHFFFAOYSA-N	447.249	1.517	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)Nc2cccc(N3CCN(C(C)=O)CC3)c2)c1O	782080605	BFQUGLRZVNVCBX-UHFFFAOYSA-N	427.461	1.536	50	20	IDGD	
CCOc1cc(N2CCOC(C)(C)C2)ccc1NC(=O)C(=O)NNc1nccc(OC)n1	782123266	FNVCSJFJQRNNOZ-UHFFFAOYSA-N	444.492	1.581	50	20	IDGD	
C[C@@H]1CN(C(=O)c2ccc(NC(=O)C(=O)NNc3ncncc3Cl)cc2)C[C@@H](C)O1	782165187	FBJIGDQJISAOPE-VXGBXAGGSA-N	432.868	1.461	50	20	IDGD	
O=C(NNc1ncncc1Cl)C(=O)Nc1ccc2nc(N3CCOCC3)sc2c1	782166035	MUWIGSZQZLWNEF-UHFFFAOYSA-N	433.881	1.658	50	20	IDGD	
CN(C)CCc1ccccc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)C(F)F)cc1	782700010	SAEIHYHCGAWCBM-UHFFFAOYSA-N	440.472	1.869	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)CCC(=O)Nc2ccc3nc(O)[nH]c3n2)cc1Cl	782804336	CGLSIXJMTIHWKC-UHFFFAOYSA-N	432.824	1.966	50	20	IDGD	
CCC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)c1	782896066	BKFUDOHBJJHPLL-UHFFFAOYSA-N	445.501	1.281	50	20	IDGD	
CCN(CC)CCNC(=O)c1cccc(NC(=O)C(=O)NNc2cncc(Cl)n2)c1	783260074	VSXLXNBKZCDREM-UHFFFAOYSA-N	433.900	1.283	50	20	IDGD	
CO[C@H](C)c1cccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)c1	783263696	JVSFRPDAMXOUMB-CYBMUJFWSA-N	435.506	1.558	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2ccc(C(=O)N(C)[C@@H]3CCCN(C)C3)cc2)nc(C)n1	783332044	UOEODYJSKKDTRJ-GOSISDBHSA-N	439.520	1.341	50	20	IDGD	
COC(=O)[C@H](C)Cc1ccc(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)cc1	785067288	JMZLWVJFGNXBNW-CQSZACIVSA-N	437.456	1.015	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)cc(OC)c1C(C)C	785068551	WWPUVGLWBBNHEY-UHFFFAOYSA-N	439.472	1.804	50	20	IDGD	
O=C(NNC(=O)c1cnc(O)c2ccccc12)c1ccc(S(=O)(=O)N2CCCC2)cc1	786690123	RLVBTNHSMCRAKB-UHFFFAOYSA-N	440.481	1.800	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)cc1N1CCNC1=O	787549586	NNYYUVFFBBEZBC-UHFFFAOYSA-N	447.398	1.282	50	20	IDGD	
CCc1c(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cnn1C1CCCC1	789258901	HWLSOHRDYCKERR-LJQANCHMSA-N	442.472	1.705	50	20	IDGD	
C[C@](O)(CN1C(=O)NC2(CCCC2)C1=O)C(=O)NNC(=O)c1cc2c(s1)CCCCC2	790070225	MGCGJAGVYRJKLH-FQEVSTJZSA-N	448.545	1.394	50	20	IDGD	
Cn1cc(Br)cc(NC(=O)C(=O)NNc2cccc(F)c2[N+](=O)[O-])c1=O	790997537	RLLQWNYTRVOESF-UHFFFAOYSA-N	428.174	1.277	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)C(=O)Nc2ccc(Cc3nnc4n3CCC4)cc2)c1	792265651	SEPDZOQRKGSSOV-UHFFFAOYSA-N	434.456	1.684	50	20	IDGD	
CCNc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	792401709	ZKZCIJWEFSSFRX-UHFFFAOYSA-N	443.935	1.991	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)nc1Br	793027665	YSAUZYBOTAZQMK-UHFFFAOYSA-N	439.291	1.736	50	20	IDGD	
N#CC[C@@H](CC(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1)c1ccccc1	793681673	JGFYRIQNPSZYGK-NRFANRHFSA-N	433.512	1.679	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNS(=O)(=O)c1cc(Cl)ccc1[N+](=O)[O-]	794599054	UHSVODPTYHPCSO-UHFFFAOYSA-N	442.837	1.484	50	20	IDGD	
C=C(CBr)COC(=O)Cc1ccc(OC)c(S(=O)(=O)N2CCOCC2)c1	795306357	IQEIRPZENAEINA-UHFFFAOYSA-N	448.335	1.753	50	20	IDGD	
COC(=O)c1cc(F)c(Br)cc1NC(=O)C(=O)NNc1ccc(OC)cn1	797030249	LIXRZQNHNRUDGD-UHFFFAOYSA-N	441.213	1.860	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)Cn2nnc(-c3ccc(Cl)cc3)n2)cc1C	798308845	BYHRIBITSWOPNS-UHFFFAOYSA-N	427.852	1.396	50	20	IDGD	
O=C(NCc1ccncc1OCC(F)(F)F)NNC(=O)c1ccc2c(c1)OCCO2	798522843	YGWASIUKOIFMTP-UHFFFAOYSA-N	426.351	1.938	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)C(=O)Nc2ccc3c(c2)OCC(=O)N3C)cc1	799258708	KAAHWDXLNIMYFX-UHFFFAOYSA-N	428.470	1.228	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(OCCBr)cc1)c1ccc2c(c1)OCO2	799519336	GZIVJGRZFRQCFR-UHFFFAOYSA-N	443.275	1.812	50	20	IDGD	
O=C(COC(=O)CCNS(=O)(=O)c1cccs1)NNC(=O)c1cccc(Cl)c1	800943178	UVHVZODYFJDBKQ-UHFFFAOYSA-N	445.906	1.074	50	20	IDGD	
Cn1ncnc1COC(=O)/C(C#N)=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	801192132	MGIPNISVLHDFGG-ZSOIEALJSA-N	439.863	1.858	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2ccc(C(=O)NNC(=O)Nc3ccccc3)cc2)C[C@H](C)O1	801984630	FQGHWSJLSICMFX-GJZGRUSLSA-N	432.502	1.951	50	20	IDGD	
C[C@H](C(=O)NNC(=O)Nc1ccc(Br)cc1)N1C(=O)NC2(CCCC2)C1=O	801995841	VLMXMIXFHMREST-SNVBAGLBSA-N	438.282	1.855	50	20	IDGD	
COCCOc1ccc(S(C)(=O)=O)cc1NC(=O)NNC(=O)c1cccc(C#N)c1	806735979	IICHFUZTATUGEZ-UHFFFAOYSA-N	432.458	1.453	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cc3n(n2)CCCC3)cc1Br	806979586	ASDGCTLRDJZUCT-UHFFFAOYSA-N	436.266	1.390	50	20	IDGD	
CCc1nnc(NC(=O)[C@H](C)[C@H](C)NC(=O)NNc2ccc(-n3cccn3)nn2)s1	807565168	HTTJTROGFHZGFN-MNOVXSKESA-N	430.498	1.366	50	20	IDGD	
CC[C@H](C)C(=O)NNS(=O)(=O)c1cc(Cl)c(OCC(=O)N(C)C)c(Cl)c1	808076902	CFSSNIVOIBBAPA-VIFPVBQESA-N	426.322	1.816	50	20	IDGD	
Cc1cc(C(F)(F)F)nn1CC(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	811032165	AIKRNXKURCJCLP-UHFFFAOYSA-N	448.446	1.846	50	20	IDGD	
CC(C)N(C)S(=O)(=O)c1ccc(C(=O)OCC(=O)NNC(=O)c2cccs2)cc1	811846565	UCWSLIGBYIGJOZ-UHFFFAOYSA-N	439.515	1.395	50	20	IDGD	
CN(C)c1ccc(Cl)cc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	813033214	JYCYZUKLWRVDPY-UHFFFAOYSA-N	439.925	1.738	50	20	IDGD	
Cc1ccc(-n2c(NNC(=O)[C@H](CO)NC(=O)C(C)C)nc3ccccc3c2=O)c(C)c1	813452289	KZLQCLXKJRHLIS-SFHVURJKSA-N	437.500	1.579	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NN=Cc1nccs1)N(S(C)(=O)=O)CC2	814758848	JRIYILHXDASPNL-CQSZACIVSA-N	438.531	1.560	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2cccc(N(C)C)c2)nnn1Cc1ccccc1F	815565541	RYJMWHLQZFFHSI-UHFFFAOYSA-N	439.451	1.240	50	20	IDGD	
CC(=O)Nc1cccc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)N(C)C)c1C	815751926	USRWLYIYKPKAAA-UHFFFAOYSA-N	433.490	1.286	50	20	IDGD	
Cn1nncc1NNC(=O)CN(Cc1ccccc1)S(=O)(=O)c1ccc(Cl)cc1	816770112	KDKGTBUNMWRBET-UHFFFAOYSA-N	434.909	1.803	50	20	IDGD	
O=C(c1cccc(NS(=O)(=O)c2ccc3c(c2)OCCCO3)c1)N1CC[C@H](B(O)O)C1	864234167	ODFPHCAASFEAAQ-HNNXBMFYSA-N	446.290	1.338	50	20	IDGD	
O=C(Cc1ccc(Cl)cc1)NN=Cc1c(N2CCOCC2)nc2ccccn2c1=O	874085130	XVKVXIVFAXUGRV-UHFFFAOYSA-N	425.876	1.877	50	20	IDGD	
O=C(COC(=O)[C@@H]1CC(=O)N(c2ccc(F)c([N+](=O)[O-])c2)C1)NNC(=O)c1ccccc1	904221675	YDPUPMJJJYVTSP-CYBMUJFWSA-N	444.375	1.091	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)[C@@H]2CC(=O)N(Cc3ccccc3Cl)C2)C[C@@H](C)O1	912920215	YQWZZFWCEGMAEV-HLLBOEOZSA-N	436.940	1.335	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)CCC/N=C2/NS(=O)(=O)c3ccccc32)c(C)c1	913164271	CMFZBQZKBDGDMV-UHFFFAOYSA-N	443.529	1.382	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)NCCN2CCS(=O)(=O)CC2)c(C)n1C[C@H]1CCCO1	915264200	OFTAHXOSTXGYEU-QRRJMBGHSA-N	434.562	1.038	50	20	IDGD	
CC(=O)c1cccc(S(=O)(=O)NCC(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)c1	915787999	QMIFRYAVJMJMOL-MRXNPFEDSA-N	447.513	1.399	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NC[C@H](c2ccco2)N2CCCCC2)c2ccccc2c1=O	915895939	QQJINSNSRZZEJP-QGZVFWFLSA-N	438.488	1.698	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNS(=O)(=O)c2ccccc2C#N)cc1	916108632	DGSOTYIGLNBCEW-UHFFFAOYSA-N	428.499	1.602	50	20	IDGD	
Cc1nn(C)c(C)c1-c1cc(C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)n[nH]1	916125623	TYXVFUQJZDSNOL-UHFFFAOYSA-N	448.487	1.793	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NC[C@@H](c2ccc(C)o2)N2CCOCC2)cc1OC	916228106	IAYPGEBAMAPJSP-INIZCTEOSA-N	432.477	1.623	50	20	IDGD	
CC(=NNC(=O)[C@H](C)CN1C[C@H](C)O[C@H](C)C1)c1ccc(O)c(CN2CCOCC2)c1	916365901	MOTIGTYSPLDUKU-KURKYZTESA-N	432.565	1.810	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCc2ccc(OCCOC)cc2)c2ccccc2c1=O	916514244	HBIXFJAIYLHRTA-UHFFFAOYSA-N	439.472	1.586	50	20	IDGD	
Cc1n[nH]c(C)c1CCC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	916558816	ZXPQULOBMLNDPU-UHFFFAOYSA-N	433.534	1.595	50	20	IDGD	
O=C(NCc1ccc(S(=O)(=O)NC[C@@H]2CCCO2)cc1)NNc1cccc([N+](=O)[O-])c1	916649710	QDMZIMHPXICTRA-KRWDZBQOSA-N	449.489	1.878	50	20	IDGD	
COCCN1C(=O)c2ccc(C(=O)NNC(=O)c3cc4c(s3)CCC4)cc2S1(=O)=O	916745840	QJLWTIOZZINCDP-UHFFFAOYSA-N	449.510	1.103	50	20	IDGD	
CN(CC(=O)NNC(=O)c1cc(Cl)ccc1O)C(=O)c1ccc(Br)o1	917393996	WQKHCJBKMDHVQC-UHFFFAOYSA-N	430.642	1.934	50	20	IDGD	
CCC(CC)C(=O)N1CCC(NC(=O)NNC(=O)Cc2nc3ccccc3n2C)CC1	918232212	QGISHNUNYZPDLR-UHFFFAOYSA-N	428.537	1.873	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCCc2ccc([N+](=O)[O-])cc2)cc1	919780617	ITWKJLCITIIYOJ-UHFFFAOYSA-N	449.489	1.097	50	20	IDGD	
COc1ccc(OC)c(CCNC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)c1	919790526	SDHKUKQBEQELIW-UHFFFAOYSA-N	449.533	1.492	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)CNC(=O)c1cc(F)cc(F)c1	920210493	CHBISHGNNIWRGD-UHFFFAOYSA-N	445.470	1.054	50	20	IDGD	
O=C(NN=Cc1cnn(-c2ccc(Br)cc2)c1)N[C@@H]1CCS(=O)(=O)C1	920379406	VYMUIBKHZMEPIP-CYBMUJFWSA-N	426.296	1.455	50	20	IDGD	
C[C@H](Nc1ccc(C(=O)NNC(=O)CN2CCCC2=O)cc1[N+](=O)[O-])c1ccccn1	920432503	BCRGVDWIFOGZCP-ZDUSSCGKSA-N	426.433	1.546	50	20	IDGD	
Cc1ccc(S(=O)(=O)Oc2ccc(S(=O)(=O)NNC(=O)NCC3CC3)cc2)cc1	920834023	UYSXBROBXGGGAM-UHFFFAOYSA-N	439.515	1.665	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c2c(C(C)C)noc2n1	920850279	TYTFPBYWXMNLIQ-UHFFFAOYSA-N	445.501	1.980	50	20	IDGD	
NC(=O)[C@@H]1CCCN1Cc1cccc(NC(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)c1	920932988	ZFJQAUIGLIHCFV-FQEVSTJZSA-N	447.499	1.993	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)c2ccc(CSc3nc[nH]n3)cc2)c2ccccc2c1=O	933507373	RSVYIUOWHQNQQU-UHFFFAOYSA-N	435.469	1.419	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Cc2ccccc2NS(C)(=O)=O)cc(OC)c1OC	1116032334	NXYGBMITXUWTPN-UHFFFAOYSA-N	437.474	1.088	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)c2n[nH]cc2I)o1	1116622089	MBYZHKZTVJWJKO-UHFFFAOYSA-N	431.234	1.524	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc3c(nc2O)CCC(C)(C)C3)c1	1253386098	DCURGVJDAQSPEB-UHFFFAOYSA-N	446.529	1.627	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)[C@H]2CC[C@H](C(F)(F)F)NC2=O)CC1	1318622983	SWZBUQRYGPGIGO-NWDGAFQWSA-N	436.431	1.238	50	20	IDGD	
CCn1nc(C(C)C)cc1C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	1322437595	WNHJXWVXIVVMCX-UHFFFAOYSA-N	434.566	1.719	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)NCc2ccc3c(c2)OCCO3)CC1	1327261723	MMLUEDCWOJITLF-UHFFFAOYSA-N	434.493	1.935	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)c3cc4cc(F)ccc4[nH]3)C2)C1	1778410572	VCSJMRGKXPNPSS-JOCHJYFZSA-N	445.495	1.124	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2c[nH]c3ncccc23)C1	1778520977	JWHZQBHXXJPRGR-CSODHUTKSA-N	434.924	1.944	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](C)Nc3cnccn3)C2)C1	1779062605	WRYISLBHZFZHLC-DEYYWGMASA-N	440.342	1.280	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(CCN(C(=O)/C=N/O[C@@H]3CCCCO3)C2)C1	1779103794	YZQQOBPFESSDIR-RQGFIMDQSA-N	427.574	1.197	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)C(=O)Nc3cccnc3)C2)C1	1779204142	AXTHMAIVDNAKQB-ZWKOTPCHSA-N	429.304	1.086	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)N1CCO[C@]2(CCN(C(=O)CO[Si](C)(C)C)C2)C1	1779300174	PMYYOKTVTLJJFN-FQEVSTJZSA-N	443.617	1.583	50	20	IDGD	
CC(=O)NC(C)(C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CO[Si](C)(C)C)C1	1779539548	AUIGUNYALGNTTE-OXQOHEQNSA-N	427.618	1.267	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccnc(OC)c3)C2)C1	1779562381	LQHNDIHUZOHZTC-KSSFIOAISA-N	426.311	1.707	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccnc4c3OCO4)C2)C1	1780022778	JKGNHAJPYXYIIY-KZULUSFZSA-N	440.294	1.285	50	20	IDGD	
Cn1ncc2c(C(=O)N3CCO[C@]4(CCN(C(=O)[C@@H](F)Br)C4)C3)cccc21	1781329483	GNHPBRLZKADJMR-QAPCUYQASA-N	439.285	1.707	50	20	IDGD	
CC(=O)N/C(C)=C/C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@](C)(Cl)CCl)C2	1781463706	LDPSGQFRXMHNCG-APNFSWDMSA-N	434.364	1.777	50	20	IDGD	
C[C@@H](CC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2)Oc1ccccc1	1781602423	WPIGHJBNSRSKNO-FAGZOMQFSA-N	438.952	1.958	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ncc(OC)cc1F)C2	1782170830	AJGVGXKBAJIIKO-YYFZDKIDSA-N	443.903	1.611	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C=N/N1CCCCC1)C2	1782175316	GVAPYRLNNCNRIN-QEORTHCHSA-N	428.961	1.226	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccn3nccc3c1)C2	1782175353	ILQBFFHFNFVLMN-DBXWQHBBSA-N	434.924	1.716	50	20	IDGD	
CC(C)[C@@H](O)C(=O)N1CCO[C@]2(CCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1	1782862041	OCCYVDXOXCMQMM-ALNQAOQGSA-N	433.455	1.719	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)Cc3cc(C)n(C)n3)CCO2)C1	1783344112	QOXKTAAVEZGYNP-CRAIPNDOSA-N	427.343	1.274	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3nc(C)c(C)[nH]c3=O)CCO2)C1	1783344932	UPRPRVLENXKWSZ-ACJLOTCBSA-N	441.326	1.004	50	20	IDGD	
COC(=O)[C@H]1CC[C@H](C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](C)Br)C3)C2)CC1	1783529194	GEHJOQVAEAZSEA-DEXNDLTESA-N	445.354	1.579	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccc([N+](=O)[O-])cc3F)CCO2)C1	1783538664	XGKKDVRLPAJTKJ-APPDUMDISA-N	444.257	1.961	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc([N+](=O)[O-])c(OC)c3)CCO2)C1	1783883482	IYGPQKXTFZYXLZ-KUHUBIRLSA-N	441.868	1.301	50	20	IDGD	
COc1ccc(F)cc1CC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1784084116	GPOCRINEBCFGCW-AEFFLSMTSA-N	447.276	1.897	50	20	IDGD	
Cc1nc2ccncc2cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]2C1	1784092084	GZXQSBPTJVALDU-FDARSICLSA-N	432.908	1.131	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(-n4cccn4)cc3)C[C@@H]21)[C@@H](O)CCl	1784092717	UODFVIWPUWAODN-WNHJNPCNSA-N	432.908	1.065	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccn(CCOC)n3)C[C@@H]21	1784617843	GTDPGPOAVGELFS-OVWQWFNUSA-N	426.945	1.530	50	20	IDGD	
CC(C)N1CCC(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)Br)C[C@@H]32)CC1	1784996593	NHVIPLNYBVJNFS-UBDQQSCGSA-N	444.414	1.870	50	20	IDGD	
C#CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@]2(CN(C(=O)[C@@H](F)Cl)CCO2)C1	1785574416	JFZPLGKQDNLIBL-IQUTYRLHSA-N	431.892	1.267	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3C[C@H]3C3CC3)C[C@@H]21	1787506822	OPYRYSIGHDMBPD-UFTKBXCMSA-N	441.532	1.146	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)c1n[nH]c2cc(Cl)ccc12	1788409496	OLVBJIOYHLDXQL-CEFQPYBMSA-N	441.315	1.409	50	20	IDGD	
COc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)Br)C[C@@H]32)ccn1	1788908989	IWOSNZQEBPAEJJ-MXAVVETBSA-N	426.311	1.467	50	20	IDGD	
Cn1ncc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]3C2)c1Cl	1789870811	XNOWMDRNPQKZJN-HTWFXAOOSA-N	437.755	1.903	50	20	IDGD	
Cn1nc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]3C2)c2c1CCC2	1789926362	VCHMXFKTDKESST-YLUJIRGKSA-N	443.317	1.193	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCN3CCCC3)C[C@@H]21	1790962573	JEQBZRJQWSSMSW-QAETUUGQSA-N	430.387	1.626	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3cncnc3)C[C@@H]21	1791058488	ZODTVZUSPPIUOT-OEAJRASXSA-N	425.327	1.172	50	20	IDGD	
C=CC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCl	1793107123	NROONNGNIXEVFF-QRJUGERDSA-N	429.945	1.694	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccn(C(F)F)c1=O)C2	1793449537	YABOYPPCDIPBEW-AYRXBEOTSA-N	431.867	1.854	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c(c1)n(C)c(=O)n3C)C2	1793449649	GWLNCSYXPCHFRP-RCJHGTSTSA-N	448.951	1.488	50	20	IDGD	
CC(C)N1CCC(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)Br)C3)CC1	1793800042	KDEBCSCLCCQYEY-MXASKKJJSA-N	430.387	1.480	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(C)(F)F	1795475203	DPGPEPPQHHIJGR-DRXBFXEBSA-N	441.387	1.379	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)c1ccc(C(F)(F)F)[nH]1	1796191957	VCMGQHAHOPKMTB-QDMKHBRRSA-N	435.211	1.279	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1(C(F)(F)F)CC1	1797270310	YGPXHDLCXDZHGH-WISYIIOYSA-N	427.261	1.950	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(O)c([N+](=O)[O-])c1)C2	1797956182	HLBKABSAZIGWJD-ZSBFGKGUSA-N	437.525	1.355	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnc2c(c1)NC(=O)CS2	1800037986	ZDUREFUEWKEUCI-ZWUHOBOKSA-N	438.937	1.346	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](O)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCBr)C2	1800591200	RKVHOCUCUHYGNH-GFQSEFKGSA-N	434.331	1.253	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](CN)c1ccccc1)C2	1800639623	KTHXMYUSIKXONZ-ADHGMGHFSA-N	438.366	1.492	50	20	IDGD	
COc1ccc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)Br)cn1	1800757054	MKDYRQSHOGSJCL-FRQROOTJSA-N	440.338	1.396	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1(F)CCC1	1801620245	KXMIMVINKLFIBE-ZSBFGKGUSA-N	449.435	1.616	50	20	IDGD	
O=C1CC[C@H](C(=O)NC[C@@H]2CCN(C(=O)[C@@H](F)Br)[C@@H]2c2cccnc2)CN1	1802611236	SCXWGYVPORUWGY-WMHQRMGPSA-N	441.301	1.304	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](C)c1ccccn1	1803147569	SYYGAKLNHLOZPI-LVJSKEACSA-N	436.516	1.957	50	20	IDGD	
O=C([C@@H](O)CCl)N1CCCC2(CCN(C(=O)[C@@H]3CC(=O)N(C4CCCC4)C3)CC2)C1	1805517394	HARBSGVTFMWQGW-AEFFLSMTSA-N	439.984	1.608	50	20	IDGD	
O=C([C@H](O)CCl)N1CCCC2(CCN(C(=O)C(F)(F)C(F)(F)C(=O)O)CC2)C1	1805518151	PDRMZOYZEWMXGI-SNVBAGLBSA-N	432.798	1.173	50	20	IDGD	
O=C(C1CCC2(CC1)OCCO2)N1CCC2(CCCN(C(=O)[C@@H](O)CCl)C2)CC1	1805526512	UGAARGKEUVIDGT-KRWDZBQOSA-N	428.957	1.751	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)/C=C/c2ccoc2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1	1807369286	FBJBXFFFGOHTSG-MXBTTZKWSA-N	445.284	1.387	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)NS(=O)(=O)CC)[C@H]1c1cccnc1	1808244769	OJFITGRTCVSLST-IWCQGFGOSA-N	444.985	1.433	50	20	IDGD	
Cc1ncoc1C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1	1810299916	VMWCWOHHEZHZNS-CRAIPNDOSA-N	449.471	1.010	50	20	IDGD	
Cn1c(C(=O)N2CC[C@H](CNC(=O)CO[Si](C)(C)C)[C@@H]2c2cccnc2)cccc1=O	1810539634	DPALDVADWZTQES-UTKZUKDTSA-N	442.592	1.951	50	20	IDGD	
C[C@H](C(=O)N1CC[C@@H](CNC(=O)CO[Si](C)(C)C)[C@@H]1c1cccnc1)n1ccnn1	1810543907	GQVFSWNFGJQIDO-AYBZRNKSSA-N	430.585	1.792	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)CS(C)(=O)=O)sc2C1	1814327499	FOKVHALWTAOFIU-IUCAKERBSA-N	438.369	1.273	50	20	IDGD	
O=C(CCN1CCOCC1)Nc1nc2c(s1)C[C@@H](NC(=O)CCBr)CC2	1814639712	LEUKWNGMFIOIGV-LBPRGKRZSA-N	445.383	1.562	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cnn(-c3cccnc3)c2)[nH]n1)[C@H](O)CCl	1814869479	QJNSBTBUUJBGSI-DLBZAZTESA-N	443.895	1.896	50	20	IDGD	
C[C@@H](O)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)n[nH]1	1815705078	WKYXJBYWVSILSV-KWCYVHTRSA-N	443.932	1.915	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CN2CCNC2=N)n[nH]1	1817298790	QCJVTHRVWBFEKC-CMPLNLGQSA-N	426.319	1.025	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](O)c2ccccc2)[nH]n1)c1ccc(B(O)O)cc1	1817471027	COAKBBRUJJUGNE-FPOVZHCZSA-N	448.288	1.129	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H]2C[C@]2(F)Cl)n[nH]1	1822507238	MHZYMODMDKGMMB-AEDCBLDQSA-N	428.896	1.699	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(O)n2)CC1	1825943642	PLTGLWVUSKTBLM-FQEVSTJZSA-N	437.305	1.014	50	20	IDGD	
CCc1cc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)no1	1827052178	BSJLXVBXFYMQHJ-NRFANRHFSA-N	439.321	1.464	50	20	IDGD	
O=C(c1ccc(O)cc1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827052686	XFICAFAKOWHTFC-QFIPXVFZSA-N	436.317	1.619	50	20	IDGD	
CC(=O)C[C@H](C)C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](C)CBr)CCO2)C1	1830543910	HGRYUNIDXHYTNG-PMUMKWKESA-N	433.343	1.089	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ncc(F)cc3F)C2)C1	1831641016	UMJBXGTYZAMMHL-LIRRHRJNSA-N	431.867	1.837	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1COc3ccccc3O1)CCO2	1832501033	YUGMBXBEPSMBKL-XERREHJYSA-N	438.908	1.300	50	20	IDGD	
COc1ncccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1834124781	HWLCRSAWCAYBBN-FQEVSTJZSA-N	425.913	1.425	50	20	IDGD	
Cc1noc(CC(=O)N2CCC(N3CCC(NC(=O)CCBr)CC3)CC2)n1	1834421883	RJOHUZVYJRZMOO-UHFFFAOYSA-N	442.358	1.277	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@]3(CN(C(=O)CCBr)CCO3)C2)cc1	1834823705	DWWGSIWJGCNSIW-IBGZPJMESA-N	425.323	1.850	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@]3(CN(C(=O)CCBr)CCO3)C2)cc1O	1834823937	NWMIHJWEBRKOQI-IBGZPJMESA-N	441.322	1.556	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)c1cc[nH]c2nccc1-2	1835008985	JCJSHNIREKGPRW-GOSISDBHSA-N	433.940	1.299	50	20	IDGD	
O=C(C#CC1(O)CCCCC1)NC1CCN(C2CCN(C(=O)[C@H](F)Cl)CC2)CC1	1835751516	VPLGIHAUJGNJJK-IBGZPJMESA-N	427.948	1.791	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)Cc3cc(C)[nH]n3)CC2)CC1	1835788459	DWTNCBFOLVUFAY-SFHVURJKSA-N	425.961	1.086	50	20	IDGD	
O=C(c1cnn2ccccc12)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836717493	DFMOKRSKHAAPJI-LJQANCHMSA-N	434.924	1.546	50	20	IDGD	
O=C(c1[nH]nc2ncccc12)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836718104	SAGUGQPLQJNZII-INIZCTEOSA-N	435.912	1.170	50	20	IDGD	
CCN(CC)C[C@@H](C)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836718719	ATTREBXMPHTOCX-APWZRJJASA-N	432.005	1.563	50	20	IDGD	
O=C(COc1ccccc1F)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836719069	KVZMDWCVULEQNH-SFHVURJKSA-N	442.915	1.803	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)Cc3cc(C)no3)CC2)CC1	1837093982	VPDQPIXHUUVUKV-SFHVURJKSA-N	427.929	1.778	50	20	IDGD	
Cn1cncc1C(=O)N1CCC(OC2CCN(C(=O)[C@H](F)Br)CC2)CC1	1837512900	PNTWPIJEOZUYCC-HNNXBMFYSA-N	431.306	1.723	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)Cc3nnc(C)s3)CC2)CC1	1837953273	XLQFSANMYQMZCO-MRXNPFEDSA-N	444.985	1.641	50	20	IDGD	
Cc1nc(C)c(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@](C)(Cl)CCl)C3)C2)o1	1838006053	IFRMAPHMKAMFJW-QZTJIDSGSA-N	434.320	1.598	50	20	IDGD	
O=C(c1cc(Cl)cc(Cl)n1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1838240005	FXNDEDRCAKEAEB-XJKSGUPXSA-N	440.686	1.993	50	20	IDGD	
Cc1nc(F)ccc1C(=O)N1CCO[C@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1	1838266908	KBRVUNZGQGAKPH-FQEVSTJZSA-N	439.560	1.451	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3c(C)n[nH]c3C)CC2)CC1	1838445054	YHRDBSWQEYDWEE-QGZVFWFLSA-N	426.945	1.893	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3cnc[nH]3)C2)C1	1839150062	AYZDCIYCVDMNER-QZTJIDSGSA-N	433.336	1.035	50	20	IDGD	
COc1cccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)n1	1839151656	ZNSNBZUVRDQELS-MOPGFXCFSA-N	446.331	1.397	50	20	IDGD	
COc1cc(C)c(C)cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1839464574	UYIZFCHSGUOCFM-XLIONFOSSA-N	428.888	1.916	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)Cc1ccccc1)CCO2	1839956602	VUJCFXARIZMHGO-JQVVWYNYSA-N	438.952	1.454	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccnc3SC)C2)C1	1840153952	GKWISSSOUTUDHH-KXBFYZLASA-N	443.953	1.127	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(C)cc3O)C2)C1	1840156638	RHPGGVDWOMIONI-UZLBHIALSA-N	426.897	1.024	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](CC(=O)N2CC3(CCCN3C(=O)[C@@H](O)CCl)C2)C1	1841347965	GLWNQFOQEASXBC-HOTGVXAUSA-N	443.972	1.827	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC2(CCCN2C(=O)c2ccc(S(C)(=O)=O)cn2)C1	1842256040	LSBXAVPYQPUKOI-ZDUSSCGKSA-N	444.351	1.476	50	20	IDGD	
CC(C)c1nn2ccccc2c1C(=O)N1CCCC12CN(C(=O)c1ccc(B(O)O)cc1)C2	1843220192	FHRUSLGXWJZDHB-UHFFFAOYSA-N	446.316	1.268	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2c(F)ccc(O)c2F)C1	1845470365	ADVLIYGGRCTYTK-BRJLIKDPSA-N	445.426	1.621	50	20	IDGD	
Cc1nn2cc(CC(=O)N3CC4(CCCN4C(=O)[C@H](C)Br)C3)nc2s1	1846175491	BUEFGUZPTXOLNV-JTQLQIEISA-N	426.340	1.629	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@H]1CC13CN(C(=O)OC(C)(C)C)C3)C2	1846365022	WJCGUDGBLHVPTD-HUUCEWRRSA-N	441.956	1.701	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1O	1847235076	SQDVHUNPSVYIMJ-XAJHFOFHSA-N	443.972	1.824	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H]1C[C@H](O)CN1C(=O)OC(C)(C)C	1847869702	UXUGASMVTADSNZ-QEOTZNIISA-N	443.972	1.966	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(F)cc2)C1	14940098	QHMVOHLOECTFMX-HNNXBMFYSA-N	437.468	1.756	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)CCc2nc3ccccc3s2)c1	16593912	VWGQIKVYYCIULY-UHFFFAOYSA-N	432.527	1.940	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Cc2ccc(OC)c(F)c2)c1	20901062	HBGXYRJXQCHKCT-UHFFFAOYSA-N	437.493	1.869	50	20	IDGD	
C[C@@H](SCC(=O)Nc1ccc(F)cc1)C(=O)NNC(=O)[C@H]1COc2ccccc2O1	23712883	CVURKEQKTNKYST-SJKOYZFVSA-N	433.461	1.873	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@@H](C)C(=O)NNC(=O)Cn1nnc2ccccc2c1=O	27202773	LSLOUPKNCOAHBK-ZDUSSCGKSA-N	429.864	1.677	50	20	IDGD	
Cc1oc(-c2ccccc2)nc1CC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	105567733	LEFIEPYIKDRGDO-UHFFFAOYSA-N	442.497	1.904	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)c1cn(-c2ccccc2Cl)nn1	109455710	VGRMMEBQNZVJFN-UHFFFAOYSA-N	433.881	1.289	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)N[C@H](CN1CCCC1=O)c1ccccc1	726091852	BGIFFHLYQCXIEE-OAHLLOKOSA-N	429.502	1.172	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2CCCN2S(=O)(=O)c2ccc(C)cc2)cc1	726276452	SXHJLFNIFYERSO-SFHVURJKSA-N	444.513	1.243	50	20	IDGD	
NS(=O)(=O)c1ccc(CNC(=S)NNC(=O)c2ccc(Br)s2)cc1	726441213	JMMGMDNVKVLQBR-UHFFFAOYSA-N	449.377	1.467	50	20	IDGD	
O=C(NNC(=O)N1CCO[C@H](c2ccccc2F)C1)c1csc(N2CCOCC2)n1	727474142	ZYRGCSDJFDYDCO-INIZCTEOSA-N	435.481	1.547	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2cn(-c3ccc(Cl)cc3)nn2)n1	728721927	LCPPOYVSXYMPJH-UHFFFAOYSA-N	434.865	1.233	50	20	IDGD	
CCNC(=O)COc1ccc(CNC(=O)NNC(=O)c2cccc(C#N)c2)cc1OC	728945691	FSUQZMPSDLBHKG-UHFFFAOYSA-N	425.445	1.226	50	20	IDGD	
COCCOc1cn(-c2ccccc2)nc1C(=O)NNC(=O)Cn1cnc2ccccc21	729298858	WNZUCSKJQYHACN-UHFFFAOYSA-N	434.456	1.708	50	20	IDGD	
O=C(CN1CCN(Cc2nc(-c3cccs3)no2)CC1)NNC(=O)c1cccs1	729469891	JQQMQHWHLBSWRL-UHFFFAOYSA-N	432.531	1.438	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)c2ccc(S(=O)(=O)NC(C)(C)C)cc2)cn1	729691769	AOZSGCSHMPLPSW-UHFFFAOYSA-N	437.547	1.798	50	20	IDGD	
O=C(NCCC(=O)N1CCN(c2ccccn2)CC1)NNC(=O)c1cccc2ncccc12	730126313	WQFYACLTUVTRMK-UHFFFAOYSA-N	447.499	1.313	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)c2cc(S(=O)(=O)N3CCC[C@@H](C)C3)cn2C)cc1	730205937	SGBUFHILWKZPOC-MRXNPFEDSA-N	448.545	1.594	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cc(F)ccc2N2CCOCC2)cc(OC)c1OC	730768584	CUDNCMIDOCODDW-UHFFFAOYSA-N	433.436	1.763	50	20	IDGD	
CC(C)(C)C1CCC2(CC1)NC(=O)N(CC(=O)NNC(=O)COc1ccccc1O)C2=O	730782180	JERUFLLKCMSIFJ-UHFFFAOYSA-N	446.504	1.445	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc(Br)cc([N+](=O)[O-])c1)c1ccc2c(c1)OCO2	731181536	UDWDIKZPYYXPCO-UHFFFAOYSA-N	444.219	1.709	50	20	IDGD	
Cc1c(C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)nnn1-c1ccc2ncccc2c1	731327427	WDVGLMZIXBECCE-IBGZPJMESA-N	430.424	1.725	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc([C@H](C)N[C@@H](C)C(=O)NNC(=O)CC(C)C)cc1	732197200	XDAJSAVIEUCVSS-HOTGVXAUSA-N	426.583	1.950	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)N[C@H](Cc1ccccc1)CN1CCOCC1	732476358	GICOMFAMJBAXFG-PKOBYXMFSA-N	444.507	1.867	50	20	IDGD	
Cc1nc2[nH]n(C)c(=O)c2c(C)c1CCC(=O)NNC(=O)c1cc(-c2ccccc2)on1	733128395	NSOSWNQHCGPXQQ-UHFFFAOYSA-N	434.456	1.927	50	20	IDGD	
O=C(NCCc1ccc(F)cc1Cl)NNC(=O)c1csc(N2CCOCC2)n1	733336217	OEYWCYBKRLBACD-UHFFFAOYSA-N	427.889	1.959	50	20	IDGD	
CCc1ccc(OCC(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)cc1	735117097	BFFAOJKVSMLUBZ-UHFFFAOYSA-N	433.534	1.102	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)N1CCCN(S(=O)(=O)c2ccccc2)CC1	738496986	IDJCTRMKFPJONC-UHFFFAOYSA-N	446.529	1.341	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)N[C@H]2CCN(c3ccc(Cl)cc3)C2=O)cc1	740483307	AGIIKNQIYRANOA-KRWDZBQOSA-N	432.864	1.863	50	20	IDGD	
CC(=NNC(=O)c1cccc(S(C)(=O)=O)c1)c1cccc(N2CCCS2(=O)=O)c1	741162514	FVLMCXGYJCBKKW-UHFFFAOYSA-N	435.527	1.784	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)[C@H]2CCCN(C(=O)COc3ccccc3)C2)c1	741207081	OZMHESMHWOFYNU-SFHVURJKSA-N	425.485	1.839	50	20	IDGD	
COC(=O)c1cc(Cl)cc(S(=O)(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c1	741649306	QCUZYPKOGYCHPB-UHFFFAOYSA-N	446.890	1.153	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=S)N[C@@H]2CCc3ccccc3C2)ccc1Cl	742978104	OVGZVKINMZICOL-CQSZACIVSA-N	438.962	1.654	50	20	IDGD	
CC(=O)N[C@H](CC(=O)NNC(=O)CCN1C[C@H](C)O[C@@H](C)C1)c1ccc(F)cc1F	743291553	QVMHEEAFKQTYAR-ZJNRKIDTSA-N	426.464	1.179	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NCCc2ccc3c(c2)OCCO3)cc1	743505229	UBITVDIBPRVKEM-UHFFFAOYSA-N	434.474	1.440	50	20	IDGD	
C[C@@H]1CCCC[C@]12NC(=O)N(CC(=O)NNC(=O)Nc1ccc(OC(F)F)cc1)C2=O	743832648	XQYDXBVBCFPFLG-WYRIXSBYSA-N	439.419	1.941	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)OCCNS(=O)(=O)c2cnn(C)c2)c(C)n1CC(C)C	744499961	RIGYSDDZNSWHDJ-NVMNQCDNSA-N	433.534	1.923	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1)[C@H]1CCOC1	745861049	HXFJAZCNCCVHAL-YJBOKZPZSA-N	446.529	1.534	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)c1ccc(Br)cc1Cl)CN1CCN(C)CC1	745863898	ZBOLSKSTAUSGNY-GFCCVEGCSA-N	446.777	1.930	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2cc(C(=O)O)ccc2F)cc1Br	745978820	CNKMKXDGLVEJTA-UHFFFAOYSA-N	447.238	1.918	50	20	IDGD	
NC(=O)COc1ccc(C=NNC(=O)Cc2nn3c(C4CCCCC4)nnc3s2)cc1	745987310	SRYDHJIEMDZVAK-UHFFFAOYSA-N	441.517	1.790	50	20	IDGD	
COc1cc(-c2noc(CCC(=O)NNC(=O)N3CCOCC3)n2)cc(Cl)c1OC	745996030	JGLBLZRUYOQNBQ-UHFFFAOYSA-N	439.856	1.413	50	20	IDGD	
CN(C)C(=O)COc1ccccc1C(=O)OCC(=O)NNC(=O)c1cccc(Cl)c1	746198277	YLLKVOSSIOYOKR-UHFFFAOYSA-N	433.848	1.425	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCCCN(C(C)C)C(C)C	746421762	LNGQJVFDLOGBEE-UHFFFAOYSA-N	426.587	1.741	50	20	IDGD	
CO[C@]1(C)CC(=NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)C1(C)C	746559457	WSJBDUDONKPMPW-OAQYLSRUSA-N	437.562	1.947	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCCCCC2)cc1)NNC(=O)Cc1ccncc1	747323681	HPUHBNNAEFRSFI-UHFFFAOYSA-N	444.557	1.969	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc2c(c1)nc(CCC(=O)NNc1ccc(C#N)cc1)n2C	748126021	IJHGZMVNCNHRBJ-UHFFFAOYSA-N	426.502	1.771	50	20	IDGD	
Cc1ccsc1[C@H]1C[C@@H]1C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	749239806	FKNPMCHDANKMLW-GJZGRUSLSA-N	435.575	1.634	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NC[C@H]2CCCO[C@@H]2C(C)C)cc1	753035967	WDXCNJMVWWZNET-VQIMIIECSA-N	440.566	1.397	50	20	IDGD	
CO[C@@H](C)c1nc(CNC(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)cs1	753056992	NYPBPPBVUVSLOC-NSHDSACASA-N	428.540	1.759	50	20	IDGD	
CCNC(=O)c1cccc(NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)c1	755513420	JXKBHHIVKGLSHE-UHFFFAOYSA-N	447.517	1.218	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)c2ccc3ccccc3n2)n([C@H]2CCS(=O)(=O)C2)n1	755535661	QYNCXXBXPGGLPW-AWEZNQCLSA-N	428.474	1.566	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)Nc1ccccc1C(=O)N1CCCC1	755538075	ZKJKXEVJQGBLHU-UHFFFAOYSA-N	437.504	1.782	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)Nc1ccc(S(=O)(=O)N(C)OC)cc1	755538305	PXZPSXYKAJFHGH-UHFFFAOYSA-N	436.490	1.663	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)Nc1ccc(NC(=O)CN2CCOCC2)cc1	755598998	JKSABLPBBMDYJM-UHFFFAOYSA-N	429.452	1.492	50	20	IDGD	
CCc1nc(C=NNC(=O)CN2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)cs1	755789869	LHLWYMHAEKHDAD-UHFFFAOYSA-N	435.575	1.471	50	20	IDGD	
O=C(CSc1ccc(Cl)cc1)NNC(=O)NCCN1C(=O)[C@@H]2[C@@H](C1=O)[C@H]1C=C[C@H]2C1	756092104	CVDIFEAGXBWNQD-SYWGBEHUSA-N	448.932	1.570	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)Nc2cc(-n3cnnn3)ccc2F)cc1	756336570	WWGWFWKGXLMGNF-GFCCVEGCSA-N	429.412	1.820	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCC[C@@H]2Cn2c(C)nc3ccccc32)n1	756625479	NYQSAYFDSDCPEL-MRXNPFEDSA-N	426.546	1.964	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)cc1NS(C)(=O)=O	756781616	HNFBHOFUMDJIHV-NSHDSACASA-N	440.453	1.826	50	20	IDGD	
Cc1nn([C@H]2CCS(=O)(=O)C2)c(C)c1NC(=O)NNC(=O)Cc1ccc(Cl)cc1	757871734	LPLBDHFIHZIDGT-HNNXBMFYSA-N	439.925	1.908	50	20	IDGD	
COC1CCC(CC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)CC1	758043894	SNHDTENPVBZMSF-UHFFFAOYSA-N	439.534	1.064	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)CCc1nc2cc(C(F)(F)F)ccc2s1	758047915	ZNHQSFRBGGJWDF-MRVPVSSYSA-N	438.453	1.333	50	20	IDGD	
C[C@@H]1CCCCN1S(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccccn2)c1	758834693	QBDRLGDRKQOGKA-CQSZACIVSA-N	445.501	1.044	50	20	IDGD	
COC(=O)c1cccc(CC(=O)OCC(=O)NNC(=O)c2cc(Cl)ccc2OC)c1	758901487	FQWOIBYGUJRYSQ-UHFFFAOYSA-N	434.832	1.682	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)NCc2ccc(S(C)(=O)=O)c(Cl)c2)c1	759297883	JJKIDWYMKIUQTJ-UHFFFAOYSA-N	441.893	1.905	50	20	IDGD	
O=C(COC(=O)c1scnc1C1CCCC1)NNC(=O)[C@H]1COc2ccccc2O1	759754494	QEVMEHQIXPMDMX-OAHLLOKOSA-N	431.470	1.945	50	20	IDGD	
NC(=O)[C@@H]1CC[C@H](CNC(=O)NNC(=O)c2ccc(COc3ccc(Cl)cc3)cc2)O1	760204222	PCDZNGUCPAYAEW-MSOLQXFVSA-N	446.891	1.896	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)c1ccc(=O)n(-c2cnn(C)c2)c1	760798810	RZVFKLSCQOVWKU-HNNXBMFYSA-N	431.452	1.953	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NN=C1C[C@@H](C)N(C)C1)N(S(C)(=O)=O)CC2	761805901	YEBRKXYVMPBJJE-DYVFJYSZSA-N	438.550	1.149	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2cccc([C@H]3CCOC3)c2)CC1	762251846	BWQIUSHZWNPHQT-SFHVURJKSA-N	445.545	1.279	50	20	IDGD	
CC[C@@H](Nc1c([N+](=O)[O-])c(C)nn1C)C(=O)NNC(=O)CSc1ccccc1OC	762360524	DVTBLDZIOOVFJO-GFCCVEGCSA-N	436.494	1.776	50	20	IDGD	
O=C(NNC(=O)c1cc(C(=O)NNC(=O)c2ccccc2)cc([N+](=O)[O-])c1)c1ccccc1	763361634	INTQHJOSABTDRV-UHFFFAOYSA-N	447.407	1.744	50	20	IDGD	
Cc1nn(-c2ccc(Br)cc2)cc1C(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1	763436946	CDWVTIABEVOUTN-NSHDSACASA-N	441.307	1.139	50	20	IDGD	
CCOC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3n2)cc1	763450258	MAFQUEHLSSZNHB-UHFFFAOYSA-N	436.424	1.576	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccncc2)n([C@H]2CCN(Cc3ccccc3)C2)n1	763465329	WOCNEVFWSLXMQM-IBGZPJMESA-N	447.499	1.433	50	20	IDGD	
COC(=O)c1cc(C(C)(C)C)sc1NC(=O)C(=O)NNC(=O)c1ccc2c(c1)OCO2	763550511	BLWNJTGBPHDQPV-UHFFFAOYSA-N	447.469	1.961	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1ccccc1-c1nnnn1C(C)C	763628798	FVPVRKPYDOTGPP-UHFFFAOYSA-N	447.459	1.277	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccccc1-n1ccc(C)n1	763680785	HRKYCWZSMSVQFB-UHFFFAOYSA-N	437.456	1.744	50	20	IDGD	
Cc1nc(N2CCOCC2)ccc1NC(=O)C(=O)NNC(=O)C12CC3CC(CC(C3)C1)C2	763735645	QQBHONATPMSMGG-UHFFFAOYSA-N	441.532	1.529	50	20	IDGD	
CC(C)n1ncc2cc(NC(=O)C(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)ccc21	763790228	GVSBRJISLDREDO-UHFFFAOYSA-N	447.455	1.264	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)NNC(=O)C(=O)Nc1cccc(N2CCCNC2=O)c1	763860984	NEAVKFYUWMPMEK-UHFFFAOYSA-N	434.456	1.416	50	20	IDGD	
CON(C)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)CSc2ccc(C)cc2)cc1	763895435	DUCREHDEINNWOA-UHFFFAOYSA-N	430.486	1.507	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(C(=O)OC)ccc2C)cc1OC	763911918	RUDIBCKLDXWMKM-UHFFFAOYSA-N	443.456	1.979	50	20	IDGD	
CN(C)C(=O)C[C@@H]1CN(C(=O)C(=O)NNC(=O)Cc2ccsc2)c2ccc(Cl)cc21	764035198	OMFOYGCWEIQBTL-CYBMUJFWSA-N	448.932	1.700	50	20	IDGD	
C[S@](=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cccc(C(F)(F)F)c2)cc1F	764039868	BJEFSGWHEUXVIG-LJAQVGFWSA-N	431.367	1.982	50	20	IDGD	
O=C(NNC(=O)C1CCCC1)C(=O)Nc1ccc(-c2csc(N3CCOCC3)n2)cc1	764077194	MPZZMAGJTBINOG-UHFFFAOYSA-N	443.529	1.923	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2ccc(Br)nc2C)cc1	764131095	GEJIENIQPBDZLD-UHFFFAOYSA-N	435.278	1.880	50	20	IDGD	
O=C(NNC(=O)c1ccoc1)C(=O)Nc1cc(F)c(I)c(F)c1	764162941	GCLNUOVEPIXFJL-UHFFFAOYSA-N	435.124	1.562	50	20	IDGD	
CCOC(=O)c1cc(F)c(F)cc1NC(=O)C(=O)NNC(=O)[C@H]1Cc2ccccc2O1	764168236	ORPUSWKVNBWFFI-MRXNPFEDSA-N	433.367	1.231	50	20	IDGD	
CN1C(=O)COc2ccc(NC(=O)C(=O)NNC(=O)c3c(Cl)cccc3Cl)cc21	764222070	UOYYXOLXIBPGFJ-UHFFFAOYSA-N	437.239	1.748	50	20	IDGD	
COC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)cc1F	764245392	ROTQIOJLZHLXOY-UHFFFAOYSA-N	427.392	1.745	50	20	IDGD	
NC(=O)c1ccc(F)c(NC(=O)C(=O)NNC(=O)c2cc(F)ccc2Br)c1	764270247	JHGMPTTZMYIMRB-UHFFFAOYSA-N	441.188	1.226	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)o1	764332873	NNNXDWMOGRAQRP-UHFFFAOYSA-N	428.417	1.457	50	20	IDGD	
O=C(NNC(=O)C(F)(F)Oc1ccccc1)C(=O)Nc1cccc(CN2CCOC2=O)c1	764380381	YCVZKZJCTRRLMC-UHFFFAOYSA-N	448.382	1.397	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1cnn(-c2ccccc2F)c1	764398278	RHYZEFKHQNIFNM-UHFFFAOYSA-N	443.460	1.898	50	20	IDGD	
CS(=O)(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2F)cc1	764411383	WFDGOJWWKFJUIR-UHFFFAOYSA-N	427.841	1.423	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)C(=O)Nc2ccc(OC3CCCC3)nc2)c1	764434395	WJAXBYHZSAGQOZ-UHFFFAOYSA-N	426.433	1.156	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@@H](C)C(=O)NNC(=O)[C@@H](C)S(=O)(=O)C1CCOCC1	764561870	ACTOUBOUXUAHED-UONOGXRCSA-N	446.953	1.854	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cccnc3Br)CC2)cc1	766651128	ZNMJDCZUVBBKSU-UHFFFAOYSA-N	446.349	1.731	50	20	IDGD	
O=C(COC(=O)[C@@H]1CC(=O)N(c2ccc(Cl)c(F)c2)C1)NNC(=O)c1cccs1	766977615	RQFXXSWVMGIDJO-SNVBAGLBSA-N	439.852	1.898	50	20	IDGD	
Cc1ccc(CN2C[C@@H](C(=O)OCC(=O)NNC(=O)Cc3ccccc3C)CC2=O)cc1	767241187	RNTGEKAIGSCWIO-FQEVSTJZSA-N	437.496	1.585	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	767278646	HLIIOVSLVYMUSA-QGZVFWFLSA-N	443.525	1.985	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)CCC(=O)N2CCN(c3ccccc3)CC2)c1O	767888343	BZAXNLWGJLVMMM-UHFFFAOYSA-N	426.473	1.291	50	20	IDGD	
Cc1nc2cc(O)nn2c(C)c1CCC(=O)NNC(=O)c1cc(-c2cccs2)[nH]n1	768260631	LUWKKWRGBHIYTR-UHFFFAOYSA-N	425.474	1.897	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3ccc(-n4cnnn4)c(C)c3)n[nH]2)cc1OC	768277771	SAMUXDHDTVDJJF-UHFFFAOYSA-N	448.443	1.453	50	20	IDGD	
O=C1CN(S(=O)(=O)c2cccc(C(=O)NNc3c(F)cccc3Cl)c2)CCN1	770198324	VOVYYUOOMJCURM-UHFFFAOYSA-N	426.857	1.357	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)[C@H]1CC(=O)N(c2c(F)cccc2F)C1	770574845	MVLUHGFHDONEQD-ZDUSSCGKSA-N	433.411	1.943	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1cc(-c2ccc3c(c2)CCO3)no1	771335995	YAHYZHDGEQKDMS-UHFFFAOYSA-N	434.456	1.744	50	20	IDGD	
O=C(CN1CC=C(c2ccc3c(c2)OCCO3)CC1)NNC(=O)c1ccc([N+](=O)[O-])cc1	771463750	MCDJGHFXKFTVOZ-UHFFFAOYSA-N	438.440	1.916	50	20	IDGD	
CC(C)c1nccnc1NNC(=O)[C@H]1CCCN1S(=O)(=O)c1cccc([N+](=O)[O-])c1	772844860	PFPLDWQVCJTPEL-OAHLLOKOSA-N	434.478	1.805	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)CN(C)S(=O)(=O)c1ccccc1	772970448	CMGMIVYOTOWNIS-CYBMUJFWSA-N	425.894	1.575	50	20	IDGD	
CNS(=O)(=O)c1cc(NC(=O)C(=O)NNc2ccc(C(F)(F)F)cn2)ccc1C	773680308	PXYKXMSLUQKBRW-UHFFFAOYSA-N	431.396	1.399	50	20	IDGD	
Cc1nn(C)c(C)c1-c1cc(C(=O)NNC(=O)[C@H]2CCCN(C(=O)OC(C)(C)C)C2)n[nH]1	774272751	SZAZHQNTCNJDMF-AWEZNQCLSA-N	445.524	1.835	50	20	IDGD	
Cc1cc(S(N)(=O)=O)ccc1CNC(=O)NNC(=O)[C@H](C)Oc1cccc(C)c1C	775204236	YQNTWLSRZRFHEW-HNNXBMFYSA-N	434.518	1.557	50	20	IDGD	
NS(=O)(=O)c1ccc(NCCC(=O)NNc2ccc(C(F)(F)F)cn2)c([N+](=O)[O-])c1	775251199	KYMCROPXZMEHIT-UHFFFAOYSA-N	448.383	1.601	50	20	IDGD	
CN(C)C(=O)[C@H]1CC[C@H](CNC(=O)NNC(=O)c2cc(F)ccc2Br)O1	775455517	VCGNIVOVMMSUMI-ZWNOBZJWSA-N	431.262	1.168	50	20	IDGD	
O=C(NNc1ccc(F)cc1Br)N[C@H]1CCO[C@]2(CCS(=O)(=O)C2)C1	776077454	SOURRTOUYOILPJ-XHDPSFHLSA-N	436.303	1.951	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1)N[C@H]1CCCOCC1	776632586	HAULRORPWHNORS-IBGZPJMESA-N	435.488	1.902	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)N[C@H]1CCCOc2cc(F)ccc21	776885381	HZUJJMRERCOCFB-AWEZNQCLSA-N	435.481	1.977	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNS(=O)(=O)c1cc(Cl)c(Cl)c(C(=O)O)c1	777939845	RFAODNNVPVHJBT-UHFFFAOYSA-N	442.277	1.526	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)[C@@H]1CCN(Cc2ccccc2)C1	778806106	KWPVSIMNZYYMLP-QFBILLFUSA-N	444.557	1.945	50	20	IDGD	
Cn1c(=O)c2c(ncn2CC(=O)NN=Cc2cc(Cl)cc(C(F)(F)F)c2)n(C)c1=O	780236352	QIJKKEMHDMOVEE-UHFFFAOYSA-N	442.785	1.256	50	20	IDGD	
N#C[C@H](c1ccc(F)cc1)N1CCN(CC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)CC1	780313590	WMYNWGVRTIVRKI-LJQANCHMSA-N	440.435	1.377	50	20	IDGD	
Cc1cc(Br)cc(S(=O)(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1	780366764	XZXJSKGSBRNSOF-OAHLLOKOSA-N	427.276	1.907	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)cc1)C(=O)Nc1cc(C(F)(F)F)ccc1-n1cccn1	782833435	IHFSZNQRCLERPM-UHFFFAOYSA-N	433.346	1.996	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)C(=O)Nc1ccccc1Sc1ccccc1	784002888	WJYMAAGTCFIGIJ-UHFFFAOYSA-N	438.465	1.947	50	20	IDGD	
CN(C)CC(=O)Nc1ccc(NC(=O)C(=O)NNc2ccc(Br)cn2)cc1	784340854	ROGKBYRGYDWFIL-UHFFFAOYSA-N	435.282	1.426	50	20	IDGD	
CNC(=O)[C@@H]1CN(C(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2O1	784380550	WWLNQHJLEQXPIN-HNNXBMFYSA-N	433.808	1.232	50	20	IDGD	
O=C(NNc1cccc([N+](=O)[O-])c1)C(=O)Nc1cccc(Cn2nc3ccccn3c2=O)c1	784830962	FKXYRVNEHIAPOS-UHFFFAOYSA-N	447.411	1.534	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1cccc(OCC#N)c1	784833294	MUHPKWUDXBTIJD-UHFFFAOYSA-N	445.501	1.748	50	20	IDGD	
CC(C)(C)c1nnc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)s1	784836245	UJYOWEUORQUIHD-UHFFFAOYSA-N	433.462	1.914	50	20	IDGD	
Cn1ccnc(NNC(=O)C(=O)Nc2ccnn2Cc2c(Cl)cccc2Cl)c1=O	785090453	SEIPLNNZNVFQSG-UHFFFAOYSA-N	436.259	1.414	50	20	IDGD	
CC[C@@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNc2nccc(N(CC)CC)n2)cc1	785226153	QUBRQPFLXHEXFP-CQSZACIVSA-N	427.509	1.933	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2ccccc2-c2nnnn2C(C)C)n1	785227901	ZLYJWLGNVMIUDZ-UHFFFAOYSA-N	438.496	1.639	50	20	IDGD	
COc1cc(F)cc(NNC(=O)C(=O)Nc2ccc(CC(=O)N3CCN(C)CC3)cc2)c1	785241376	HBOPDMDYLFVYTK-UHFFFAOYSA-N	443.479	1.233	50	20	IDGD	
O=C(COC(=O)/C=C\c1ccc(I)o1)NNC(=O)c1cccs1	788917415	ONOOZEIIJXKEQI-XQRVVYSFSA-N	446.222	1.963	50	20	IDGD	
CC(C)(C)OC(=O)N1CC2(C[C@H]2C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)C1	789181724	BIGIZUUHUVQQEE-HNNXBMFYSA-N	430.509	1.097	50	20	IDGD	
CC(C)c1csc(NC(=O)C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)n1	789730705	YQMDJQJKJXZNGS-UHFFFAOYSA-N	444.561	1.565	50	20	IDGD	
CO[C@H]1CCOc2c(NC(=O)C(=O)NNC(=O)c3cc(Br)c[nH]3)cccc21	790951469	FUXWYCJYKIIIJS-ZDUSSCGKSA-N	437.250	1.647	50	20	IDGD	
CNC(=O)COc1ccc(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2Cl)c(C)c1	797072827	OABSYGPNTBRHNL-UHFFFAOYSA-N	435.824	1.763	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2cc(Cl)ccc2N2CCSCC2)n1	797369870	OMZQDJQAKALYMW-UHFFFAOYSA-N	433.921	1.996	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)Cc2ccccn2)cc(Br)cc1[N+](=O)[O-]	797536159	WAMUXIJCCFPWKH-UHFFFAOYSA-N	436.222	1.389	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@H]1CC(C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)=NO1	798986524	QJGOIRRYCJYPGI-SNVBAGLBSA-N	434.478	1.569	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc4c(c3)OCC(=O)N4C)n[nH]2)cc1	799258864	ODEQTFVZLWPDAP-UHFFFAOYSA-N	448.439	1.140	50	20	IDGD	
CC[C@@](O)(C(=O)OCC(=O)NNC(=O)Cc1nc(C)cs1)c1cccc(Cl)c1	800322146	PDQJPVRLZQCDAW-SFHVURJKSA-N	425.894	1.636	50	20	IDGD	
CC(C)(C)[C@H](NC(N)=O)C(=O)NNC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1	800324288	SMMHYHQRWLMHAO-MRXNPFEDSA-N	435.488	1.778	50	20	IDGD	
O=C(COC(=O)c1ccc(CN2CCCC2)cc1)NNC(=O)[C@H]1COc2ccccc2O1	801868363	QNSWBZLZKYAAMX-HXUWFJFHSA-N	439.468	1.427	50	20	IDGD	
O=C(N=c1cc[nH]cc1)NNC(=O)c1cccc(S(=O)(=O)N2CCc3ccccc32)c1	802024117	HVUDKLJBTPXJGF-UHFFFAOYSA-N	437.481	1.721	50	20	IDGD	
O=C(NNC(=O)[C@H]1CC(=O)N(CCN2CCOCC2)C1)Nc1ccc(Cl)cc1Cl	802095341	ZUJXVSUFZFEWSF-LBPRGKRZSA-N	444.319	1.327	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)c1ccc(S(=O)(=O)N2CCCCC2)cc1	804954759	NWVQVGXVSJSKEZ-UHFFFAOYSA-N	427.490	1.594	50	20	IDGD	
Cc1cc(Cl)ccc1OCCCC(=O)NNC(=O)C(=O)N=c1ccnc2n(C)[nH]cc1-2	806972795	LXGWPBZAKWREGV-UHFFFAOYSA-N	444.879	1.249	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cc(Cl)cc3c2OCC(=O)N3)cc1	806974884	XYRMRHXCICLNJB-UHFFFAOYSA-N	432.820	1.144	50	20	IDGD	
Cc1cccn(Cc2c(F)cccc2NC(=O)C(=O)NNC(=O)Cc2ccccn2)c1=O	806978991	OUXSEHICHARDTQ-UHFFFAOYSA-N	437.431	1.068	50	20	IDGD	
COc1cc(C=NNC(=O)CSc2nnc(O)nc2O)cc(OC)c1OCC(F)F	807958935	KHGDECCCYLZABH-UHFFFAOYSA-N	445.404	1.186	50	20	IDGD	
CN(C)CCN1C(=O)C(=NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)c2ccccc21	807974013	QDURSKAHZUOOIR-UHFFFAOYSA-N	429.502	1.524	50	20	IDGD	
CN(C)c1ncc(C=NNC(=O)c2cccc(NN=Cc3cnc(N(C)C)n3C)c2)n1C	811631305	TUXUCTUFQHIFOR-UHFFFAOYSA-N	436.524	1.496	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(Oc2ccc(Cl)cc2)cc1)[C@@H]1CCS(=O)(=O)C1	811678847	DKLUBXUJZDKKAK-GFCCVEGCSA-N	444.918	1.877	50	20	IDGD	
COC(=O)[C@H](CF)NC(=O)/C(C#N)=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	813690746	NRTUHMFZDASUCN-OIQJVACTSA-N	447.854	1.613	50	20	IDGD	
Cc1nccc(CCC(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)n1	814363797	QKMLGYZQNRGTPY-UHFFFAOYSA-N	442.479	1.937	50	20	IDGD	
COC(=O)c1scc(C)c1NC(=O)C(=O)NNc1ccccc1S(=O)(=O)N(C)C	815751467	AHUPUBNOWLWMHB-UHFFFAOYSA-N	440.503	1.175	50	20	IDGD	
O=C(CNc1ccccc1)NNC(=O)c1cccc(S(=O)(=O)NC[C@H]2CCCO2)c1	849211933	BWHGWQZCEUQCKX-QGZVFWFLSA-N	432.502	1.017	50	20	IDGD	
CC1CCN(C[C@@H](C)C(=O)NN=Cc2c(N3CCOCC3)nc3ccccn3c2=O)CC1	874091619	TWJFEIGLDPEEDO-GOSISDBHSA-N	440.548	1.349	50	20	IDGD	
COC(=O)NNC(=O)C1CCN(S(=O)(=O)c2cccc(OC(F)(F)F)c2)CC1	896316743	KJRMHSICTFURNQ-UHFFFAOYSA-N	425.385	1.373	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)NCc2ccc(C(=O)N3CCOCC3)cc2)c1	913625787	IHNJDMCUMDRAPS-UHFFFAOYSA-N	426.473	1.377	50	20	IDGD	
COCCN1C[C@H](C(=O)NNC(=O)c2cc3c(C)nn(-c4ccccc4)c3s2)CC1=O	914459403	FRVCGFFGPRCHRC-CQSZACIVSA-N	441.513	1.651	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2cnn(-c3ccccn3)c2C)c2ccccc2c1=O	914714042	TXLIKSASFREJOM-UHFFFAOYSA-N	431.456	1.770	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)C1CCN(C(=O)COc2ccccc2)CC1	914846504	MHYVVMIAYMYZSU-UHFFFAOYSA-N	429.448	1.670	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)NC[C@H](c2ccc(F)cc2)N2CCOCC2)cc1	915897759	JTYWERQQEXGKCZ-HXUWFJFHSA-N	441.463	1.480	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)NCCCN2C(=O)NC3(CCCC3)C2=O)c1C	915906168	OTQXZIPWWHNUGR-INIZCTEOSA-N	445.520	1.656	50	20	IDGD	
O=C(NCCCC1CCCC1)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	916517414	PWFPJSYLBLXNHD-UHFFFAOYSA-N	438.550	1.622	50	20	IDGD	
COC(=O)CCOc1ccc(S(=O)(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1	917731882	OOEYXBBTIYMTPX-UHFFFAOYSA-N	436.442	1.023	50	20	IDGD	
C[C@H]1C[C@H]1c1ccc(CNC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)o1	918078022	LTUADDRMDPARSL-WMLDXEAASA-N	448.549	1.560	50	20	IDGD	
Cc1ccc(C)c(S(=O)(=O)NCCC(=O)NNC(=O)c2ccc(Cl)cc2O)c1	918357518	GCHXFEVLOUUUAR-UHFFFAOYSA-N	425.894	1.792	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@H](C)CN2CCC[C@@H](C)C2)cc1	919914485	HKYBTNYKMXOEFA-IAGOWNOFSA-N	439.582	1.066	50	20	IDGD	
COCCOCCC(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccc(C)cc2C)c1	920340449	OWPKPIPTGRCFGV-UHFFFAOYSA-N	449.529	1.918	50	20	IDGD	
COCCNC(=O)/C(C#N)=C\c1cn(CCC(N)=O)nc1-c1cccc(Br)c1	933001430	CJJHDPWKJSVIGM-ZROIWOOFSA-N	446.305	1.858	50	20	IDGD	
COCCn1cc(NC(=O)NNC(=O)c2cc(OC)ccc2Br)ccc1=O	1116563305	ITHVYPKDYUIHRJ-UHFFFAOYSA-N	439.266	1.732	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)c1cc(NC(C)=O)c(OC)c(OC)c1	1116614431	WPZZYPARNZRTRG-UHFFFAOYSA-N	437.474	1.831	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCc2ccccc2CS(=O)(=O)NC(C)C)cc1	1317998149	KJLTVCZOLJXFKZ-UHFFFAOYSA-N	434.518	1.667	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N2CC[C@@](O)(C3CC3)C2)cc1	1321375937	NGFHOHGGBQVFQQ-JYFCICGUSA-N	449.511	1.714	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(C(=O)CNC(=O)NNC(=O)c2ccccc2Cl)CC1	1321840369	JORADFHMWQSTAX-UHFFFAOYSA-N	439.900	1.363	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](F)Cl)C2)ncc1[N+](=O)[O-]	1778025675	GAYCLLBFUWQKSI-RVKKMQEKSA-N	428.848	1.960	50	20	IDGD	
Cc1nc[nH]c1CSCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Cl)C1	1778029998	JXOVWBHBGHPYEE-QGPMSJSTSA-N	432.949	2.000	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@]2(CN(C(=O)CCC(=O)N3CCCC3)CCO2)C1	1779294528	SPEXOPXHCLCLKZ-HXUWFJFHSA-N	425.602	1.070	50	20	IDGD	
Cn1cccc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CO[Si](C)(C)C)C2)c1=O	1779539601	FTKWFZAYVIOPTP-DYESRHJHSA-N	435.597	1.364	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3c(F)cncc3F)C2)C1	1779725259	JDEBDZYPEULXSA-DIFFPNOSSA-N	432.265	1.834	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H]1CN(Cc3ccccc3)CCO1)CCO2	1781218380	HAUIFWLJXFSXMW-MIZPHKNDSA-N	449.979	1.735	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](NC(C)=O)c1ccc(F)cc1)CCO2	1781218938	UHZNXOJRPOJWSH-OPYAIIAOSA-N	439.915	1.850	50	20	IDGD	
CN(C)c1cncc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)c1	1781326321	NHPICTNSYMKVHT-RHSMWYFYSA-N	429.290	1.282	50	20	IDGD	
O=C(c1noc2c1CCCC2)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781331069	KLGGUVCPFPBIAB-YOEHRIQHSA-N	430.274	1.687	50	20	IDGD	
O=C(c1n[nH]c2ccc(F)cc12)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781332426	YKGKJSFDRFJPAF-PBHICJAKSA-N	443.248	1.836	50	20	IDGD	
O=C(c1n[nH]c2cccc(F)c12)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781332431	HNOKLMBQWYYNSF-RHSMWYFYSA-N	443.248	1.836	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccccc3-n3nccn3)C2)C1	1781834917	RWXWLOVIJFYBLD-OAQYLSRUSA-N	431.924	1.976	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1ncccn1)C2	1781996852	VPFKTHBOYCYUNM-PMUMKWKESA-N	425.327	1.316	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(CCN(C(=O)c3ccc(C4CC4)cc3)C2)C1	1782020585	MRVVXWYVYBVDDK-DEOSSOPVSA-N	434.301	1.001	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc4cccnc4nc3O)C2)C1	1782267337	HNAUMHVSQBAOMK-BUXKBTBVSA-N	449.305	1.562	50	20	IDGD	
O=C(/C=C/c1cnc[nH]1)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Br)C2	1782431294	BWYYJAUJFZRTLA-FALOVXMHSA-N	429.290	1.627	50	20	IDGD	
Cc1ccn2c(C(=O)N3CC[C@@]4(CN(C(=O)CO[Si](C)(C)C)CCO4)C3)cnc2c1	1782490860	YNJUGIORWNOQJM-OAQYLSRUSA-N	430.581	1.938	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)c1ncc(Cl)cc1Cl	1783427355	VDMLCPQXGLQAAE-RETIQXCHSA-N	436.723	1.581	50	20	IDGD	
CCOC(=O)[C@@H]1CCC[C@H](C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Cl)C[C@@H]32)C1	1784070348	VNRYLOGIXMPIFQ-FQMQPWHVSA-N	432.920	1.870	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3c(F)ccc(F)c3F)[C@H]2C1	1784834236	UVQJCDVTRKWDGV-DPYKFYPSSA-N	448.869	1.880	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)c(Cl)c1	1785033027	HUTBIVAQEKPFDS-QFIPXVFZSA-N	442.708	1.086	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)COc3ccccc3C#N)C2)C1	1785383668	WFJGTPYOXKHBLG-AUUYWEPGSA-N	436.306	1.550	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC1(c2ccc(NC(=O)CN3CCCCC3)cc2)CCC1	1787899532	WVJNWSBOPMZMLW-UHFFFAOYSA-N	429.565	1.979	50	20	IDGD	
Cc1nccn1[C@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]2C1	1789872546	IVINYLSZUGZMEP-NVTBQPJSSA-N	431.364	1.969	50	20	IDGD	
CCN(CC)C[C@@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)Br)C[C@@H]21	1790606051	WKBUFMIIIBKECQ-XAJHFOFHSA-N	432.403	1.727	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN3CCCCC3=O)C[C@@H]21	1790963863	MYTAKXSYRFOKDH-JONQDZQNSA-N	444.370	1.152	50	20	IDGD	
CCOc1ncccc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@](C)(Cl)CCl)C2	1792380497	WQMZEMLRUUIIRK-QPWUGHHJSA-N	430.332	1.920	50	20	IDGD	
O=C(CCc1cnc2ccccc2c1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2	1792819981	SOAWBIONMYPTGH-NZGUISNBSA-N	431.920	1.357	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ncccc1-c1ccccc1)C2)[C@H](O)CCl	1792978428	VFRWLYDHIWAAPL-UKBAYJJMSA-N	429.904	1.552	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cn1ccc2ccc([N+](=O)[O-])cc21)[C@@H](O)CCl	1793407277	OTFOPVKNDCFCRJ-KRXQYRFLSA-N	434.880	1.787	50	20	IDGD	
COc1ccc(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)cc1C	1793892309	SZDNETFOTXGDJA-WKCHPHFGSA-N	436.317	1.178	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccnc1OCC1CC1	1794448108	AXADNRFOWXWGAY-XEMDLRDOSA-N	447.608	1.925	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)c1cc2c(s1)CCCC2	1796189080	UGQMXBNVIAFGGZ-REPLKXPHSA-N	438.358	1.872	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Cl	1796368899	RSVVNUFBTSEJIJ-KHMAMNHCSA-N	433.908	1.510	50	20	IDGD	
Cc1ccc(SCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCC(=O)NN(C)C)C3)cc1	1797124304	RLCJUQWSOMMJHC-FAQVEIGNSA-N	448.589	1.050	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccn2cncc12	1797522980	NQCOWSALOKOUFM-UESRRSCYSA-N	425.316	1.774	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](COC(C)=O)OC(C)=O	1798476721	IBMFTXWGANCXQX-XFIYOXNOSA-N	447.326	1.293	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ncccn1)C2	1799220026	GLENJDKXYAUKKW-QDMKHBRRSA-N	439.428	1.876	50	20	IDGD	
O=C(Cc1cc(Br)ccc1O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2	1799253353	WPASKTPMONOVLG-OXUXUCFPSA-N	449.704	1.821	50	20	IDGD	
Cn1nc2c(c1C(=O)N1C[C@@H]3COC[C@H](C1)[C@@H]3NC(=O)[C@@](C)(Cl)CCl)CCC2	1799279322	IGGDDYMRBFFDQP-RHQBZFHZSA-N	429.348	1.348	50	20	IDGD	
C[C@@H](Nc1ccccn1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Br	1799350159	SUUQLXITLPFLMC-GGUBGCTKSA-N	429.290	1.162	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H](C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](F)Cl)C3)[C@@H](O)C1	1799981953	QXKRPJJFZIMDIK-IWTMDLJTSA-N	433.908	1.387	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cn1ccnc1)C2	1800332366	FAVYZOWQSKIHFW-IBMUYAKESA-N	441.438	1.358	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3cc(OC)ccc3o1)C2	1800976763	GXSAWPIXPSJQCX-MVWRLGRASA-N	436.892	1.898	50	20	IDGD	
CC(C)(C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1ccccn1	1801218724	PXTFEODWEINFLN-NEBZKDRISA-N	428.302	1.639	50	20	IDGD	
COC(=O)[C@@H]1CC[C@H](C(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)C1	1803137359	MMJANFMHSOZNDW-YKJOPOJSSA-N	437.924	1.276	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2nccnc2C(N)=O)[C@H]1c1cccnc1	1803692318	SGXLJQXXCOKARA-VKJFTORMSA-N	444.923	1.698	50	20	IDGD	
Cc1cc[nH]c1C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1805005154	SIVOGPXJWVBPIX-NQIIRXRSSA-N	432.289	1.031	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2nccs2)[C@H]1c1cccnc1	1805942572	XLPRWWWPTJXHBQ-MAUKXSAKSA-N	430.534	1.231	50	20	IDGD	
C[C@H](CN)C(=O)N1CCC2(CCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)CC1	1806756925	QBLJJCLQOPNZHX-CVEARBPZSA-N	445.004	1.945	50	20	IDGD	
CC1=CC[C@H](C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)CC1	1807363539	OZVZHKYVPQGBGX-RRPUWOKSSA-N	447.344	1.827	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)CSc2ncccn2)[C@H]1c1cccnc1	1807576508	NXCFCFWDDPFJKV-SOLBZPMBSA-N	449.964	1.924	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)CNC(=O)c2ccco2)[C@H]1c1cccnc1	1807595972	NJGPNCPVCOVJRQ-JTDSTZFVSA-N	448.907	1.364	50	20	IDGD	
O=C(Cc1ccc(F)cc1)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1	1809968240	OFQBXGRGTBTHMX-UHFFFAOYSA-N	438.308	1.593	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC2(CCCN(C(=O)Cc3cccs3)C2)CC1	1810107476	WXIZNESIQDOWES-UHFFFAOYSA-N	441.557	1.834	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)[C@@H]2CCC=CO2)[C@@H]1c1cccnc1	1810264850	VMAAERVVRKADBY-LQWHRVPQSA-N	429.521	1.153	50	20	IDGD	
Cc1nnc(CC(=O)N2CC[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]2c2cccnc2)o1	1810541639	LIWLTALTVFVCFI-OXJNMPFZSA-N	431.569	1.873	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)CCc2ccc(O)nn2)[C@H]1c1cccnc1	1812328327	MWFMVFYHMNRTDS-RIFZZMRRSA-N	447.923	1.470	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)[C@H](C)NC(C)=O)[C@@H]1c1cccnc1	1812779015	NZKCTTKHHVRTSO-OSMBCOQSSA-N	439.354	1.786	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)Cc2cccc(OC)n2)[C@H]1c1cccnc1	1813028485	QVIXLIQFMKSAFC-MMOPVJDHSA-N	446.935	1.988	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)CSc2nc[nH]n2)[C@H]1c1cccnc1)C(Cl)Cl	1813081883	FGEVREHSFVTQGJ-YPMHNXCESA-N	429.333	1.802	50	20	IDGD	
C[C@@H](CBr)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CS(C)(=O)=O)[nH]n1	1814780302	LJOXVFISBQFHAX-CMPLNLGQSA-N	435.344	1.477	50	20	IDGD	
C[C@H](CBr)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2C[C@H](O)CN2)[nH]n1	1814784379	WVEJCGVRFZZSAA-XWUBHJNHSA-N	428.331	1.156	50	20	IDGD	
O=C(CNc1ccc(F)cc1)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](O)CCl)CC2	1814832078	RJDCNBKGNIEQJT-GXTWGEPZSA-N	426.901	1.906	50	20	IDGD	
Cc1c(F)ccc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@H](O)CCl)CC3)c1N	1815235122	RYRWNPXBOWDVQN-NOZJJQNGSA-N	426.901	1.998	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@H]1C[C@H]1C1CC1)CC2)c1cccc(B(O)O)c1	1815350432	VQCBRSWKIDFBRI-PMPSAXMXSA-N	425.319	1.095	50	20	IDGD	
CCc1[nH]nc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@H](O)CCl)CC3)c1Cl	1815804657	JJKKVHUAZFJPQO-GMSGAONNSA-N	432.333	1.908	50	20	IDGD	
O=C(Cc1ccc2c(c1)OCO2)Nc1cc([C@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1	1816997757	IEIWZWRBRIALKR-HUUCEWRRSA-N	434.880	1.973	50	20	IDGD	
COc1ccnc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)c1	1817476758	PPOSXQYMGRBGPM-IBGZPJMESA-N	449.276	1.113	50	20	IDGD	
CC[C@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](C)NS(=O)(=O)CC)[nH]n1	1820855771	WXVPJMJHMZXSPR-MBNYWOFBSA-N	433.962	1.747	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1)c1cccc(-n2cncn2)c1	1821295725	CQKASAJOXPHWFL-SJORKVTESA-N	443.895	1.896	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CN(C)C(=O)C(=O)O)n[nH]1	1821712980	IESJZTMYUGHPNG-WCQYABFASA-N	427.889	1.352	50	20	IDGD	
C[C@H](Br)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1822185207	YYCGYNYKQNSCLU-NHYWBVRUSA-N	449.114	1.179	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(F)nc1)CC2	1826087514	GGKWRMCGQHNPJP-GFCCVEGCSA-N	434.497	1.276	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)c2ccc(O)cn2)CC1	1826212564	JIKVDIIYAFWWRU-OAQYLSRUSA-N	437.305	1.014	50	20	IDGD	
COCCn1ccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)[C@@H](O)CCl)CC2)n1	1827824113	OSHVNQLJHGICEX-ROUUACIJSA-N	426.945	1.363	50	20	IDGD	
COc1ccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)cc1O	1830248659	WVZCCGWYYXPVTC-IBGZPJMESA-N	447.315	1.203	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(F)nc3F)C2)C1	1830352853	SJLNQWZPPVGHFH-LJQANCHMSA-N	431.867	1.695	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnn4ccncc34)C2)C1	1830362409	VTWXZLQKMYTUSC-HXUWFJFHSA-N	435.912	1.064	50	20	IDGD	
C[C@H](Sc1cccs1)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1	1830730548	BFQYKAPLEBLJOX-IYOUNJFTSA-N	448.994	1.285	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](CC)N(CC)CC)C2)C1	1831640115	IYVNYYFXLKOEMN-UEXGIBASSA-N	432.005	1.971	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(C(C)=O)[nH]n3)C2)C1	1831644403	WZYHEILSENZLDZ-IFXJQAMLSA-N	426.901	1.090	50	20	IDGD	
C[C@@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1)n1ccnc1	1831870497	DJMDKYLULGKMKS-PKOBYXMFSA-N	432.569	1.437	50	20	IDGD	
Cc1nc(CC(=O)N2CCC([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)cs1	1831871247	PTYZEZCJECIJBJ-IBGZPJMESA-N	449.621	1.987	50	20	IDGD	
O=C([C@H](F)Br)N1CCC([C@H]2CCCCN2C(=O)CN2C(=O)C=CC2=O)CC1	1831986640	SVWYGSPWDYLVLO-DYVFJYSZSA-N	444.301	1.222	50	20	IDGD	
N#Cc1ccc(CCC(=O)NC2CCN(C3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)cc1	1833038774	FFNPYYFVYRQTDZ-NRFANRHFSA-N	446.979	1.662	50	20	IDGD	
CC[C@H](NC(C)=O)C(=O)NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1	1833096917	LJHUXCAYQFZJSH-HOTGVXAUSA-N	449.365	1.163	50	20	IDGD	
CC[C@@H](NC(C)=O)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)Br)CC2)CC1	1833097312	LXOIAIDQOHDWDM-CXAGYDPISA-N	445.402	1.256	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)/C=C/c3cccnc3)CCO2)C1	1833104643	KWTPVKAKNLBOQP-IHMJFIQFSA-N	438.322	1.335	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](F)c3ccccc3)CC2)CC1)[C@H](O)CCl	1833307967	FPUAFGPYXXOCIS-MOPGFXCFSA-N	425.932	1.869	50	20	IDGD	
Cc1cncc(C(=O)N2CCOC[C@]3(CN(C(=O)CCBr)CCO3)C2)c1	1834819579	WHLIJJCOCUPLPO-SFHVURJKSA-N	426.311	1.245	50	20	IDGD	
COc1cccc(CC(=O)N2CCC(N3CCC(NC(=O)[C@@H](F)Cl)CC3)CC2)n1	1835078631	QAJALYCOESFTCW-LJQANCHMSA-N	426.920	1.739	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CN(C)C(=O)OC(C)(C)C)CCO2)C1	1835210477	QGHHENMTAPCPJH-FOIQADDNSA-N	447.960	1.327	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC1CCN(C2CCN(C(=O)c3cc(CO)on3)CC2)CC1	1836399808	NCGPMYPINHPYBI-IBGZPJMESA-N	447.363	1.588	50	20	IDGD	
O=C([C@H](F)Cl)N1CCOC[C@]2(C1)CN(C(=O)[C@]1(F)CCCCC1(F)F)CCO2	1836627714	MZCMQWGGGVGOKE-VBNZEHGJSA-N	430.826	1.895	50	20	IDGD	
O=C(Cc1ccc(F)cn1)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836716858	VQMVVUVBPSCGCK-GOSISDBHSA-N	427.904	1.362	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc4c(c3)CNC4=O)CCO2)C1	1837147399	LBLSUVDASQOKJO-PGRDOPGGSA-N	449.935	1.408	50	20	IDGD	
Cc1ccsc1C(=O)N1CCOC[C@@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1837711990	BNFBUZWCVTXAAD-LJQANCHMSA-N	426.611	1.978	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)c(C)n1	1837715563	XVMXFGYNBODFAQ-NRFANRHFSA-N	435.597	1.620	50	20	IDGD	
CC(C)n1nccc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)Br)C2)C1	1838024780	OOVMMMIFCKCYET-KSSFIOAISA-N	443.342	1.317	50	20	IDGD	
C/C(=C/C(=O)N1CCC(OC2CCN(C(=O)CO[Si](C)(C)C)CC2)CC1)C(=O)O	1838432409	SKKXEYSLDAFGFW-SQFISAMPSA-N	426.586	1.867	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(F)cc3)CCO2)C1	1838953697	KVGNVLWCHBDFKH-LIRRHRJNSA-N	443.313	1.927	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3n[nH]c4cccc(F)c34)C2)C1	1839147877	FVUYVTHZXZKVRZ-RNODOKPDSA-N	438.887	1.789	50	20	IDGD	
O=C(/C=C/c1ccoc1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839199660	ZIKPFFXVAFKHTC-PHQDNCEWSA-N	431.258	1.440	50	20	IDGD	
C#CC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](Br)Cc3ccccc3)C2)C1	1839810223	LYWOCYRUWGKLQM-FXAWDEMLSA-N	435.318	1.082	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(F)c(C)c3N)C2)C1	1840152143	YKGZJUHFOIKSHA-FOIQADDNSA-N	443.903	1.040	50	20	IDGD	
O=C(c1c[nH]c2ncccc12)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840187533	HRVSARNYVGJLDD-GOSISDBHSA-N	427.288	1.437	50	20	IDGD	
O=C(c1nc2ccccc2o1)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840189707	HWQRQVQBFRNKMF-GOSISDBHSA-N	428.272	1.702	50	20	IDGD	
C[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)CCBr)C2)C1)n1cccc1	1840350682	PKQWEQGPYGMUDV-QAPCUYQASA-N	428.327	1.291	50	20	IDGD	
O=C(c1cccc2c1CCCC2)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1	1840719607	CUDRQTHCXQJNAG-SIKLNZKXSA-N	436.936	1.235	50	20	IDGD	
C[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1)c1ccccc1	1840892996	OVJZBYYEXCPPLS-QOKNQOGYSA-N	443.313	1.937	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)N3CCCC34CN(C(=O)c3ccc(B(O)O)cc3)C4)c[nH]2)cc1	1842170993	UDZSTNAVPVIVHW-UHFFFAOYSA-N	443.312	1.801	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)COc2ccc(F)cc2)C1	1842686891	XYECBEOXEYCSCX-MFKUBSTISA-N	441.463	1.542	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1cnn(C)c1Cl)C2	1843416407	GAZBDLVHZCTQRG-FSJBWODESA-N	431.884	1.025	50	20	IDGD	
Cn1c(=O)c(C(=O)N2CCCC23CN(C(=O)[C@H](F)Br)C3)nc2ccccc21	1843744314	MGCYJDJUZTUTRD-AWEZNQCLSA-N	437.269	1.441	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1ncccc1C(F)(F)F)C2	1844264655	USIANZYSUOHRNI-UHFFFAOYSA-N	448.405	1.230	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@H](O)c2cccc(Br)c2)C1	1845042160	BEGBTPWBUVCSHN-GJZGRUSLSA-N	445.741	1.940	50	20	IDGD	
COCCOCCOCCC(=O)N1CC2(CCCN2C(=O)[C@@](C)(Cl)CCl)C1	1845173162	XXVVTXLZAKDMMP-KRWDZBQOSA-N	425.353	1.496	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCCC12CN(C(=O)CSc1nc[nH]n1)C2	1845872032	RPQVOCMTZYVZAX-MKMNVTDBSA-N	444.467	1.986	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)C1=CCN(C(=O)OC(C)(C)C)C1)C2	1846360263	DEFFGPJAHUCOII-OAHLLOKOSA-N	427.929	1.621	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)CCc2ccccc2F)C1	1846698099	XXZIPTIMHMXFCD-UHFFFAOYSA-N	425.464	1.274	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC2(CCCN2C(=O)CN2C(=O)CSC2=S)C1	1847055986	VNUFLCWPZYJKHE-SNVBAGLBSA-N	434.381	1.224	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1O	1847235074	SQDVHUNPSVYIMJ-QUSNUVHPSA-N	443.972	1.824	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2cc(C(=O)NNc3nnc(C)c(=O)[nH]3)ccc2C)cc1	10899237	BWQBBFITSVJPFV-UHFFFAOYSA-N	428.474	1.648	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)COc2ccc([N+](=O)[O-])cc2)c2ccccc2c1=O	15945462	GGZYELSHGDNPSF-UHFFFAOYSA-N	425.401	1.726	50	20	IDGD	
CCOC(=O)/C(C#N)=C/Nc1cc(S(=O)(=O)N(CC)CC)ccc1N1CCOCC1	18988897	VACXVEIRVZOIEE-FOCLMDBBSA-N	436.534	1.936	50	20	IDGD	
C[C@@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)C1=O	23743041	CUVVOSKUVJQKGA-YJSBENSXSA-N	442.491	1.957	50	20	IDGD	
O=C(NNC(=O)c1cnn2c(-c3ccccc3)ccnc12)c1csc(N2CCOCC2)n1	46902915	OZIFGZPFRBFSMO-UHFFFAOYSA-N	449.496	1.764	50	20	IDGD	
O=C(CC1CCCC1)NNC(=O)c1cc(S(=O)(=O)N2CCOCC2)ccc1Cl	725896615	MNKSULJTDZLXBX-UHFFFAOYSA-N	429.926	1.702	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)[C@@H](c1ccccc1)N1CCC(O)CC1	727765297	SLUNQOIDOGSCCB-JOCHJYFZSA-N	427.501	1.810	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)c2cc(S(=O)(=O)N3CCCC3)c(C)o2)c1	728206195	ABHDAQHTLUTHIL-UHFFFAOYSA-N	436.490	1.254	50	20	IDGD	
C[C@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(S(=O)(=O)NNC(=O)NCC3CC3)cc2)C1	728262277	BULXYGCUTBBNRI-OKILXGFUSA-N	444.579	1.256	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)c2ccccc2O)cc1NC(=O)c1ccccn1	728501371	IYXOCOFOJIGVOZ-UHFFFAOYSA-N	442.453	1.671	50	20	IDGD	
CCS(=O)(=O)N1CCC(C(=O)NNC(=O)Cc2cccnc2)(c2ccccc2)CC1	728852762	VDRNFICSECTTAC-UHFFFAOYSA-N	430.530	1.155	50	20	IDGD	
CS(=O)(=O)c1ccc(Br)c(C(=O)NNC(=O)c2ccc(Cl)nc2)c1	728859564	RPOONJJRPJUJHO-UHFFFAOYSA-N	432.683	1.976	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)NCC1(c2ccccc2Cl)CCOCC1	730025971	VKUDJSZNVOMCSA-UHFFFAOYSA-N	434.880	1.742	50	20	IDGD	
O=C(NNC(=O)c1cccc2ncccc12)c1ccc(S(=O)(=O)N=c2cc[nH]cc2)cc1	730226128	DLCFNEJWEJDLBM-UHFFFAOYSA-N	447.476	1.927	50	20	IDGD	
CCCCCOc1ccc(C(C)=NNC(=O)CSc2nn(C)c(=O)n(C)c2=O)cc1	730571887	WTFRJZCAZLYWPA-UHFFFAOYSA-N	433.534	1.681	50	20	IDGD	
O=C(CN(Cc1ccco1)c1cccc(Cl)c1)NNC(=O)N[C@@H]1CCS(=O)(=O)C1	732061409	HFUKDWSVDPYYHY-CQSZACIVSA-N	440.909	1.457	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)C3CCC3)CC2)cc1OC	732142295	UYWCFIQUUSKCAP-UHFFFAOYSA-N	425.507	1.052	50	20	IDGD	
N#CCCn1cc(/C=C(\C#N)C(=O)NS(=O)(=O)[C@@H]2CCOC2)c(-c2ccccc2)n1	733722233	UVPFGLMZGGGPMD-QIPHDZALSA-N	425.470	1.606	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NN=C1C(=O)Nc2cccc(Br)c21	734303953	MYEIPYWOBIPZBD-UHFFFAOYSA-N	426.271	1.929	50	20	IDGD	
CCOCCCN1CC[C@H](NC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)[C@H](C)C1	734545025	VERVMBKSGFJBDM-XLIONFOSSA-N	428.537	1.953	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCc2ccc(N(C)C)cc2C)cc1	734687674	PJGMNWAMEHIOIU-UHFFFAOYSA-N	447.561	1.521	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)c2ccc(-n3cncn3)nc2)CC1	734822537	ZRAAEBUFWKPHML-UHFFFAOYSA-N	430.469	1.006	50	20	IDGD	
CS(=O)(=O)CC[C@@H](NS(=O)(=O)c1ccccc1)C(=O)NNc1c(F)cccc1F	735697782	HDUSEIMTCAABAN-OAHLLOKOSA-N	447.485	1.190	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)c2ccc3c(c2)C(=O)N(C)C3=O)cc1C	736755472	PRWOGUZDOXJLJL-UHFFFAOYSA-N	429.454	1.463	50	20	IDGD	
CSC[C@H](C(=O)NNC(=O)COCc1ccccc1)N1C(=O)[C@H]2CCCC[C@@H]2C1=O	737636621	SYBMWHNPTFSMKS-YESZJQIVSA-N	433.530	1.257	50	20	IDGD	
CCN(CC)S(=O)(=O)CC(=O)NNC(=O)c1cc(-c2ccco2)nc2ccccc12	742240947	FGCHZVROFMRDPD-UHFFFAOYSA-N	430.486	1.927	50	20	IDGD	
CCC1(CC)NC(=O)N(CC(=O)NNC(=O)NCc2cccc(C(F)(F)F)c2)C1=O	742457607	ISROSWVKZVKEPN-UHFFFAOYSA-N	429.399	1.646	50	20	IDGD	
Cc1cc2c(cc1C)O[C@H](C(=O)NNC(=O)c1ccc(S(=O)(=O)N3CCCC3)cc1)C2	742474991	RMVBYFXGOYGHDN-FQEVSTJZSA-N	443.525	1.853	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](CNC(=O)NNC(=O)CNC(=O)c1ccco1)c1ccccc1	743578627	YATVTSXRIHSAFP-OAHLLOKOSA-N	445.476	1.606	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)COc2ccc(Br)cc2C=O)c1	744757742	DUNBQSGEYLLJLU-UHFFFAOYSA-N	449.257	1.953	50	20	IDGD	
COc1cc(/C=C/C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)cc(OC)c1O	745510191	AMPSWAITIILJAT-VOTSOKGWSA-N	425.397	1.299	50	20	IDGD	
O=C(CNC(=O)c1ccccc1)NNc1ccc(S(=O)(=O)Nc2nccs2)cc1	747942844	KMGILCWRKOHAIB-UHFFFAOYSA-N	431.499	1.817	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCOCC2)cc1C(=O)NNc1cccc([N+](=O)[O-])c1	747995218	KSGSIEJNELPQIR-UHFFFAOYSA-N	436.446	1.381	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)NC[C@]2(N(C)C)CCSC2)c2ccccc2c1=O	748647044	KXZYKUGWGKFMBA-HXUWFJFHSA-N	432.550	1.359	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCc1ccc(OCC2CC2)nc1	749187525	QOIVKNNKVVLJHA-UHFFFAOYSA-N	446.533	1.616	50	20	IDGD	
Cc1cc(C)cc(C(=O)N2CCC[C@H](C(=O)NNC(=O)CNC(=O)c3ccco3)C2)c1	751203368	NWQKBLJIPJJOHI-INIZCTEOSA-N	426.473	1.326	50	20	IDGD	
CCn1c(SCC(=O)NNC(=O)CNC(=O)c2cccs2)nnc1-c1ccco1	751211809	VLJVVECAMCYOIT-UHFFFAOYSA-N	434.503	1.289	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)COc3ccccc3[N+](=O)[O-])n[nH]2)cc1OC	751297928	MUAIIAOMWGBCTR-UHFFFAOYSA-N	441.400	1.842	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2cc(C(=O)NNC(=O)CO)ccc2Cl)cc1Cl	753437217	GMPRKRWTDYFBFP-UHFFFAOYSA-N	432.285	1.856	50	20	IDGD	
O=C(NNc1ccc(C(F)(F)F)nn1)c1c(F)ccc(S(=O)(=O)NC2CC2)c1F	755191722	PFPMSYXBBAJYOZ-UHFFFAOYSA-N	437.350	1.971	50	20	IDGD	
COC(=O)CNC(=O)c1ccc(NC(=O)NNC(=O)c2cc(OC)cc(OC)c2)cc1	755547307	NUQJGELPRGMDOY-UHFFFAOYSA-N	430.417	1.073	50	20	IDGD	
CCN1CCN(C(=O)c2ccc(NC(=O)NNC(=O)c3c(C)nc4ccccn34)cc2)CC1	756252370	DWWSMPIYJYOAFY-UHFFFAOYSA-N	449.515	1.887	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)Nc1cccc(C[S@@](=O)c2ccccc2)c1	756591107	PMAFQHNVPAMNDB-WQIZZMQYSA-N	435.527	1.582	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)Nc2cccc(S(=O)(=O)NC3CC3)c2C)c1	756707697	WLTBDYULXMMRNF-UHFFFAOYSA-N	446.489	1.256	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1ccccc1Oc1cc(F)cc(F)c1	757689802	QTNZAZMFHJMDDG-JTQLQIEISA-N	428.417	1.848	50	20	IDGD	
O=C(CC1CCCC1)NNC(=O)Nc1ccc(NC(=O)CCN2C(=O)CNC2=O)cc1	758016295	FMJNZTCDJYPDNY-UHFFFAOYSA-N	430.465	1.300	50	20	IDGD	
CN(NC(=O)COc1ccc(F)cc1F)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758786282	LHWMFTWXPYLNPT-UHFFFAOYSA-N	428.436	1.979	50	20	IDGD	
C[C@H]1CCCN(c2ccc(C(=O)NNC(=O)C(=O)Nc3ccccn3)cc2[N+](=O)[O-])C1	758840493	IQOHVUHIPDUTGM-ZDUSSCGKSA-N	426.433	1.626	50	20	IDGD	
C[C@H](CN1CCOCC1)C(=O)NN=Cc1ccc(OCCN2CCOCC2)c(Cl)c1	759191059	AYPBZBACQHJEJE-QGZVFWFLSA-N	438.956	1.469	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)CCc2nnc(C3CCCC3)o2)c1	760265902	XJXIBDRMMBDRBM-UHFFFAOYSA-N	435.506	1.371	50	20	IDGD	
O=C(NNC(=O)C(F)(F)Oc1ccccc1)C(=O)Nc1ccnn1Cc1ccc(F)cc1	760290605	KELFAUHPZWZFNZ-UHFFFAOYSA-N	447.373	1.828	50	20	IDGD	
O=C(Cn1cc(Br)c(=O)c([N+](=O)[O-])c1)NNC(=O)c1ccc(Cl)cc1	763271538	JKHVRXYHDSIKME-UHFFFAOYSA-N	429.614	1.634	50	20	IDGD	
C#CCOc1cccc(NC(=O)C(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)c1	763538606	DWVZSIFLBORICN-UHFFFAOYSA-N	427.413	1.124	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(S(C)(=O)=O)cc2)c2ccccc2n1	763617376	ZJVVRISUBCZNMH-UHFFFAOYSA-N	426.454	1.346	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2ccc([S@](=O)C(F)(F)F)cc2)c1	763629780	HYJMCIWCCLVHIN-PMERELPUSA-N	443.403	1.787	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(C(=O)NC(C)C)cc1C	763648894	XXCVONBNGMEOAE-UHFFFAOYSA-N	442.472	1.307	50	20	IDGD	
COc1cc(OC)c(OC)cc1NC(=O)C(=O)NNC(=O)COc1ccc(C)c(C)c1	763667194	RVKLOJYHCXPXQJ-UHFFFAOYSA-N	431.445	1.494	50	20	IDGD	
Cc1nnc(-c2cccc(NC(=O)C(=O)NNC(=O)COc3ccc(Cl)cc3)c2)n1C	763686881	WMTQREKIKBBOQF-UHFFFAOYSA-N	442.863	1.609	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(NC(=O)c3ccccc3)nc2)cc1	763811314	JBUWEQXBQDFPDG-UHFFFAOYSA-N	447.451	1.807	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccc(OC[C@@H]2CCCO2)cc1	763848530	CRGSZHPOEWCSLS-PBHICJAKSA-N	445.447	1.937	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1cccc(OCCN(C)C)c1	763864314	AIPCRKFQZVWIGR-AWEZNQCLSA-N	432.452	1.320	50	20	IDGD	
COC(=O)c1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccccc1F	763864441	JKMSOXLDHVCHOJ-JTQLQIEISA-N	437.811	1.819	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(C(C)=O)cc2)cc1OC	763873705	XVWTXACBWUTKJR-CYBMUJFWSA-N	429.429	1.460	50	20	IDGD	
NC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCCCCC3)cc1	763913971	HQKYRLRUEBYBOJ-UHFFFAOYSA-N	444.513	1.671	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)C(=O)Nc1ccc2nc(C3CC3)sc2c1	763917028	OBYITWWZGGEDOB-UHFFFAOYSA-N	448.468	1.549	50	20	IDGD	
COc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NNC(=O)Cc1ccc(Cl)cc1	763931911	LTYJTPMIJFCANX-UHFFFAOYSA-N	432.864	1.379	50	20	IDGD	
Cc1cnc(O)n1-c1ccccc1NC(=O)C(=O)NNC(=O)c1cc(Br)c[nH]1	763994894	JEAHWBIROOXCPS-UHFFFAOYSA-N	447.249	1.377	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2cc(Br)cn2C)cnn1CC(C)C	764005346	ZFBFWVBQLXPAAU-UHFFFAOYSA-N	425.287	1.348	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)on2)cc1F	764016782	NFNYZBVUIBYZRC-UHFFFAOYSA-N	426.360	1.667	50	20	IDGD	
COCCCn1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(C)cc3)[nH]n2)n1	764110936	MUOXFNKHOMBPQE-UHFFFAOYSA-N	425.449	1.018	50	20	IDGD	
O=C(CC(F)(F)F)NNC(=O)C(=O)Nc1ccc(F)cc1I	764115014	KWGMAMODIALQMS-UHFFFAOYSA-N	433.099	1.469	50	20	IDGD	
CC[C@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)Cc2ccccc2OC)cc1	764132462	OKRGSBYPFATNHN-AWEZNQCLSA-N	426.473	1.552	50	20	IDGD	
CC(C)(C)[S@](=O)Cc1cccc(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)c1	764164637	SASWOXKMORACJW-FZEVHQGJSA-N	443.525	1.823	50	20	IDGD	
C[C@H]1CN(Cc2ccccc2NC(=O)C(=O)NNC(=O)c2ccc(C#N)cc2)C[C@@H](C)O1	764182702	PKBIJYNCBGRKAJ-IYBDPMFKSA-N	435.484	1.567	50	20	IDGD	
CN(C)C(=O)COc1cccc(NC(=O)C(=O)NNC(=O)c2cccc3ncccc23)c1	764253966	XDHGHXXJPWOSGE-UHFFFAOYSA-N	435.440	1.102	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C(=O)Nc1cc(C(=O)N(C)C)ccc1OC)c1ccccc1	764330393	VXDISCFMPFMXIC-INIZCTEOSA-N	426.473	1.677	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1	764342847	SHYXWCZUHGYAAR-UHFFFAOYSA-N	426.433	1.171	50	20	IDGD	
CN(C)C(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)cc1	764383314	ZZMOSXCJRPBDTQ-UHFFFAOYSA-N	440.485	1.169	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NC1CC(OCc2ccccc2)C1	766085700	SYWLRHIDGRFGPH-UHFFFAOYSA-N	445.545	1.980	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N1CCOC2(CCOCC2)C1	767937166	GKUUXWVAEHVJND-ZDUSSCGKSA-N	442.310	1.839	50	20	IDGD	
CN(C)C(=O)NNS(=O)(=O)c1ccc(F)c2ncc(I)cc12	768274217	PJTBCRDLYJWFJM-UHFFFAOYSA-N	438.222	1.443	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3c[nH]nc3-c3cccnc3)CC2)cc1	768290072	CTXOGEWSGOKWLW-UHFFFAOYSA-N	433.516	1.359	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=S)NCCSC)ccc1OC	769767468	MCHOAGZWWUKRBL-UHFFFAOYSA-N	434.609	1.198	50	20	IDGD	
CCOC(=O)CON=C(C(=O)NNC(=O)c1ccc(Cl)cc1Cl)c1cc[nH]n1	770823058	JUIJURBDOUIUQN-UHFFFAOYSA-N	428.232	1.462	50	20	IDGD	
COc1cc([N+](=O)[O-])ccc1OC(=O)CNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	771301445	JOIXHSKBEQCBJJ-UHFFFAOYSA-N	437.430	1.189	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)[C@H]2CCCc3sccc32)CC1	771579604	VVYAVQHBDFLEAL-HNNXBMFYSA-N	435.575	1.642	50	20	IDGD	
COc1nn(C)c2nc(C)c(CCC(=O)O[C@H](C)C(=O)NNC(=O)CC(C)C)c(C)c12	771995836	GOSPNYVVXRFPRZ-CQSZACIVSA-N	433.509	1.652	50	20	IDGD	
CC(C)(C)OC(=O)N1CCSC[C@@H]1CC(=O)NNC(=O)[C@H]1COc2ccccc2O1	772009838	KEFMSEGMGNAVBT-XJKSGUPXSA-N	437.518	1.716	50	20	IDGD	
COc1c([N+](=O)[O-])ccc(C=NNC(=O)CCN2CCN(c3ccccc3)CC2)c1O	772989315	FCXKYZSBVVIBEW-UHFFFAOYSA-N	427.461	1.971	50	20	IDGD	
CCNC(=O)COc1cccc(NC(=O)C(=O)NNc2ncc(Cl)cc2Cl)c1	773683537	WJRZHPDRWOJWOW-UHFFFAOYSA-N	426.260	1.985	50	20	IDGD	
CS(=O)(=O)N1CCN(c2ccc(NC(=O)NNc3ccc([N+](=O)[O-])cc3)cn2)CC1	775617612	NPJKIWUVLZPALP-UHFFFAOYSA-N	435.466	1.220	50	20	IDGD	
Cc1sc2ncc(C(=O)NNC(=O)Nc3ccc(S(C)(=O)=O)cc3)c(=O)n2c1C	775791237	GHNDFOIFMKAVRS-UHFFFAOYSA-N	435.487	1.243	50	20	IDGD	
CCO[C@@H]1C[C@@H](NC(=O)NNC(=O)CNC(=O)c2cccs2)[C@@H]1Oc1ccccc1	776476699	KWSHAWGQVWZVOU-RKVPGOIHSA-N	432.502	1.433	50	20	IDGD	
C=CCNC(=O)CNC(=O)/C(C#N)=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	777514918	HYRUTTHTRMWGLV-XNTDXEJSSA-N	440.891	1.404	50	20	IDGD	
Cc1nnc(-c2cccc(C(=O)N3CCN(S(=O)(=O)CBr)CC3)c2)o1	777832293	LVQYRJFVZDPZKD-UHFFFAOYSA-N	429.296	1.485	50	20	IDGD	
COc1ccc(N2CCN(C(=O)/C=C\C(=O)NNc3cccc([N+](=O)[O-])c3)CC2)cc1	778391440	LLFVKVKZMGPJAN-KTKRTIGZSA-N	425.445	1.952	50	20	IDGD	
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)CNC(=O)OC(C)(C)C	778434281	XUOXLADOSLFMQY-KRWDZBQOSA-N	445.520	1.523	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)c2ccccc2c1=O	778529980	FQZNEWJCFCDAHS-UHFFFAOYSA-N	425.357	1.128	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)/C=C\C(=O)Nc1ccc2n[nH]cc2c1	778949183	BDGWPPRWFZHTTI-HJWRWDBZSA-N	430.465	1.510	50	20	IDGD	
CCNC(=O)N(C)NC(=O)[C@H](CCSC)NS(=O)(=O)c1ccc(OCC)cc1	780710954	HZOIPPSLGAVXGO-HNNXBMFYSA-N	432.568	1.178	50	20	IDGD	
CC(=O)N1CCN(c2cccc(NC(=O)C(=O)NNC(=O)c3ccc(C)c(F)c3)c2)CC1	782126626	YCTKMTUFMBAQCH-UHFFFAOYSA-N	441.463	1.202	50	20	IDGD	
Cc1cc(OCc2ccc(C(=O)NNC(=O)C(=O)NCC(=O)N(C)C)cc2)ccc1Cl	782701872	LOUSEPNCAGUBIH-UHFFFAOYSA-N	446.891	1.193	50	20	IDGD	
O=C(NNc1ncccc1C(F)(F)F)C(=O)Nc1ccc(S(=O)(=O)NC2CC2)cc1	783121607	PAOJBSNMOLGJES-UHFFFAOYSA-N	443.407	1.623	50	20	IDGD	
Cc1ccccc1NC(=O)NNC(=O)C(=O)Nc1ccc(F)c(N2CCCS2(=O)=O)c1	783417281	OZHCEGHBEJFIMM-UHFFFAOYSA-N	449.464	1.465	50	20	IDGD	
Cc1ccc(NNC(=O)C(=O)Nc2ccc(-c3csc(N4CCOCC4)n3)cc2)nn1	783952063	OHAGPZWOJVINPO-UHFFFAOYSA-N	439.501	1.827	50	20	IDGD	
CCOc1ccc(OC)cc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	784210208	IITYNMUUYUDBIA-UHFFFAOYSA-N	448.501	1.616	50	20	IDGD	
Cc1cc(Br)ccc1NNC(=O)C(=O)Nc1ccc(S(C)(=O)=O)nc1	784414385	QHEFHOAMZMQTTM-UHFFFAOYSA-N	427.280	1.638	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)F)cc1)C(=O)Nc1ccc2c(c1)C(=O)NCC2	784835535	QQOMYSHDVZQHHV-UHFFFAOYSA-N	438.412	1.051	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2[C@H](C(F)(F)F)[C@H]3CC[C@H]2O3)c1	785444578	JNPHNWWTSYILBR-YIYPIFLZSA-N	435.424	1.054	50	20	IDGD	
NC(=O)c1ncccc1C(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	786642322	YLLCCRFBGUWZLQ-UHFFFAOYSA-N	442.435	1.014	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2cccc(OC(F)F)c2)cccc1N1CCNC1=O	787543093	UKIWLYSJQANFNL-UHFFFAOYSA-N	447.398	1.526	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)CN2CCc3ccccc3C2=O)c1	788746614	TUAKAZDPOKRIHZ-UHFFFAOYSA-N	432.274	1.917	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccccc1	790065846	SXTSHUAIKOIQIF-MRXNPFEDSA-N	427.523	1.166	50	20	IDGD	
Cc1cccc(=O)n1C[C@](C)(O)C(=O)NNC(=O)NCc1cccc(C(F)(F)F)c1	792097049	PGILOIVMYSKJTM-SFHVURJKSA-N	426.395	1.457	50	20	IDGD	
C[C@H]1[C@H](NCC(=O)NNC(=O)c2ccc(C#N)cc2)[C@H](C)CCN1C(=O)OC(C)(C)C	796658526	MWRZIPJMNDPKJT-ZRGWGRIASA-N	429.521	1.943	50	20	IDGD	
Cn1cc2c(n1)CCC[C@@H]2C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	798347028	XQYONAPLXYCKDO-INIZCTEOSA-N	431.518	1.086	50	20	IDGD	
COc1coc(C(=O)NNc2nc3ccccc3c(=O)n2CCCOC(C)C)cc1=O	798967248	SYOVOSUMMXFYRE-UHFFFAOYSA-N	428.445	1.930	50	20	IDGD	
NS(=O)(=O)C1CCN(C(=O)NNC(=O)c2ccc(Br)cc2Cl)CC1	799916481	LFFQXCAQOQNHME-UHFFFAOYSA-N	439.719	1.210	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(N3CCCS3(=O)=O)cc2C)cc1	801108715	RIGNECNTOUBEJO-UHFFFAOYSA-N	430.486	1.243	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN(CCNC(C)=O)Cc1ccsc1	801557251	DSJBRNCDVLWRLZ-UHFFFAOYSA-N	438.937	1.809	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)NS(=O)(=O)c2cnc3n2CCC3)c(C)n1C[C@@H]1CCCO1	802206983	PMZNAKKMZOAVAQ-LTXFRBGYSA-N	443.529	1.839	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1cc2ccccc2c(=O)n1C	803871552	IFQQYNWTNSOCEF-UHFFFAOYSA-N	443.843	1.819	50	20	IDGD	
O=C(NNc1nccnc1C1CCC1)c1ccc(F)c(S(=O)(=O)Cc2ncon2)c1	805471356	HPVUWJJLOLCOSY-UHFFFAOYSA-N	432.437	1.997	50	20	IDGD	
CNS(=O)(=O)c1cc(NC(=O)C(=O)NNc2cccc(C(F)(F)F)c2)ccc1F	806983804	HSMMWPBXJPIHGD-UHFFFAOYSA-N	434.371	1.834	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNc2ccc(-n3ccnc3)nn2)sc2c1CCC2	807429997	XBGNJPNYBASNDH-UHFFFAOYSA-N	441.473	1.471	50	20	IDGD	
O=C(COC(=O)c1ccnc(C(F)(F)F)c1)NNC(=O)[C@H]1COc2ccccc2O1	808667555	YRYCHKZEFLVTKT-CYBMUJFWSA-N	425.319	1.245	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)CNS(=O)(=O)c1ccc(Cl)c(Cl)c1	810566071	ZCTZOADWDPLJQN-UHFFFAOYSA-N	430.313	1.970	50	20	IDGD	
CCOCC(C)(C)CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	812435807	WAODNUVHMJBGMJ-UHFFFAOYSA-N	440.566	1.868	50	20	IDGD	
CC[C@@H](CNC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1)OC	812593815	SLFWKYIJQVGGMM-LBPRGKRZSA-N	426.520	1.918	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)cc1	812727877	ZDKAEWYTIOHTFN-AWEZNQCLSA-N	440.547	1.055	50	20	IDGD	
CCCc1nnc(SCC(=O)NNc2ccc([N+](=O)[O-])cc2Br)n1N	813526432	JVKSVMQAWFSYET-UHFFFAOYSA-N	430.288	1.851	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@H](F)C[C@H]1CNC(=O)NNC(=O)CNC(=O)c1cccs1	813816163	LRZBKOUGCNFCPD-RYUDHWBXSA-N	443.501	1.156	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN(c2ccccc2)C1=O)c1csc(N2CCOCC2)n1	814365323	FZVBHPCWUXWXHQ-OAHLLOKOSA-N	429.502	1.184	50	20	IDGD	
Cn1ncc(C(=O)NNC(=O)c2cc(-c3ccccc3)on2)c1I	814842540	LDAWNPYPCNOQNR-UHFFFAOYSA-N	437.197	1.755	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1)[C@@H]1C[C@@H]1C	815563762	NJCQHVKCHMFSOJ-KPZWWZAWSA-N	439.428	1.756	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2ccc(N(C(C)=O)C3CC3)cc2)c1	815566479	VPZMUOFQWLVFLE-UHFFFAOYSA-N	440.456	1.619	50	20	IDGD	
O=C(NNC(=O)C1(c2ccc(Br)cc2)CCCC1)[C@@H]1CCS(=O)(=O)C1	827398575	FRBXCNKFPPDBJI-GFCCVEGCSA-N	429.336	1.843	50	20	IDGD	
COCCCNC(=S)N(C)NC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(C)s2)C1	849167788	VAWKPKSTTCIYOC-CQSZACIVSA-N	448.636	1.331	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc(C#N)n1C	856531694	COSCEPJXRUFTHN-ZHZULCJRSA-N	445.527	1.472	50	20	IDGD	
O=C1CC[C@@H](C(=O)NNC(=O)c2cccc(S(=O)(=O)Nc3ccc(Cl)cc3)c2)N1	913138165	WWODOYTVSFCCIQ-HNNXBMFYSA-N	436.877	1.180	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(N2CCCC2)c(C(=O)NNc2nccc(OC)n2)c1	914762705	BYGSLAUTDHAZRO-UHFFFAOYSA-N	448.549	1.873	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)CS[C@H](C)C(=O)Nc1cc(C)on1	915775853	RMLWVBLXWZJQQP-CYBMUJFWSA-N	444.517	1.803	50	20	IDGD	
CN(C)[C@@H](CNC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)c1ccccc1Cl	915904224	VMWKLRNQIXUZJU-KRWDZBQOSA-N	442.907	1.834	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)c2cc(S(=O)(=O)N3CCCC3)c(C)o2)c1	916092887	NEADZSPSNTVYCD-UHFFFAOYSA-N	435.502	1.829	50	20	IDGD	
Cc1nc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)cs1	916230291	VUPQUHVLEZZWFZ-UHFFFAOYSA-N	437.547	1.770	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)N[C@H](CN2CCCC2=O)c2ccccc2)cc1	916459911	QPADJEQFTPIBKY-LJQANCHMSA-N	426.473	1.768	50	20	IDGD	
C[C@H](Cn1cccn1)NC(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	916464476	WOOCBKGSJZEVCS-MRXNPFEDSA-N	445.487	1.618	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCCN2CCN(c3ccc(F)cc3)CC2)cc1OC	916513647	IXUMGFGAOINWJF-UHFFFAOYSA-N	445.495	1.609	50	20	IDGD	
O=C(NC[C@@H]1CCN(C2CC2)C1)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	916577956	OBTQKLJBUOOTND-INIZCTEOSA-N	449.577	1.290	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1	916607782	QKGCWVNWFIMUMR-QGZVFWFLSA-N	427.461	1.969	50	20	IDGD	
Cn1nc(C(C)(C)C)cc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	916726295	HXGXUOAKZINMTM-UHFFFAOYSA-N	447.561	1.967	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCN(c3cccc([N+](=O)[O-])c3)CC2)cc1OC	917119612	OOGSQIUWVPJTSW-UHFFFAOYSA-N	443.460	1.195	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)c2nnc(O)c3ccccc23)c(OC)c1OC	917529420	PJTMQRQQNNXCNA-UHFFFAOYSA-N	426.429	1.755	50	20	IDGD	
COc1cc(S(=O)(=O)NNC(=O)c2cc(C)nc3ccccc23)cc(C(=O)O)c1OC	917720851	SYMWYDAMQDJRQP-UHFFFAOYSA-N	445.453	1.882	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)NCc1ccc(N2CCOCC2)c(F)c1	918217778	MTIOGYKTGFJQTI-UHFFFAOYSA-N	432.452	1.580	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)CCCNC(=O)c2ccc(F)cc2)c2ccccc2c1=O	919805792	POUGZHCPLKITCQ-UHFFFAOYSA-N	439.447	1.527	50	20	IDGD	
O=C(CCc1ncc(-c2ccc(F)cc2F)o1)NNC(=O)N[C@H]1CCS(=O)(=O)C1	919889311	KTWMRGQTEJYGTO-NSHDSACASA-N	428.417	1.070	50	20	IDGD	
CN1CCN(C(=O)/C(C#N)=C/c2cn(CCC(N)=O)nc2-c2ccc(Cl)cc2)CC1	920848773	PXYQHPVJRPHZHA-FOWTUZBSSA-N	426.908	1.760	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)NCc2cccnc2N2CCN(C)CC2)cc1OC	921199740	OSABDWCPTMYPMG-UHFFFAOYSA-N	442.520	1.385	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)CNC(=O)OC(C)(C)C)c2ccccc2c1=O	921301781	FQSJBWFFCPVDQC-UHFFFAOYSA-N	431.493	1.872	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCN(c2ccc3c(c2)OCCO3)C1=O)c1cncn1-c1ccccc1	1116007839	INDCKHLVLFQFLX-KRWDZBQOSA-N	447.451	1.458	50	20	IDGD	
NC(=O)CC[C@@H](NC(=O)OCc1ccccc1)C(=O)NNC(=O)c1ccccc1Cl	1319637189	HLAIRUHPTBMKLF-MRXNPFEDSA-N	432.864	1.662	50	20	IDGD	
O=C(NCc1cc(OCC(F)F)ccn1)NNC(=O)C1CCN(c2ncccn2)CC1	1325023192	JISGCTGRZUTBGY-UHFFFAOYSA-N	435.435	1.263	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)NCCCCCS(C)(=O)=O)CC1	1325763674	VWSHDVUKZRUBMN-UHFFFAOYSA-N	434.559	1.179	50	20	IDGD	
NC(=O)[C@@H]1CCCN(c2ccc(C(=O)NNC(=O)c3cnn(-c4ccccc4)c3)cc2)C1	1338978096	YNSJINFDELLJQV-QGZVFWFLSA-N	432.484	1.649	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ncn(-c3ccccc3)n1)C2)[C@H](F)Cl	1778026394	SZCAQDXBZSISKH-GQIGUUNPSA-N	435.887	1.929	50	20	IDGD	
C[C@H](Nc1cnccn1)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2	1779059270	RLKQDZDVMRMAPM-MORSLUCNSA-N	430.336	1.343	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(=O)cco1)C2)[C@H](F)Br	1780771783	QBOGFGLFUKXTBM-JKIFEVAISA-N	431.258	1.458	50	20	IDGD	
O=C([C@@H](O)c1cccc(Br)c1)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Cl)CCO2	1780972823	XJVIWPUQLVHZOZ-ZQIUZPCESA-N	449.704	1.847	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cccc(S(C)(=O)=O)c3)CCO2)C1	1781211451	UWDQHIPVTDDCET-LPHOPBHVSA-N	428.938	1.551	50	20	IDGD	
Cc1cc(NC(=O)CC(=O)N2CCO[C@]3(CCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)no1	1781229530	IJDKZUBWUJBJID-ZWKOTPCHSA-N	447.319	1.378	50	20	IDGD	
C=C(CC(=O)OCC)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2	1781264269	RKEIVTSGQUXPKO-KSSFIOAISA-N	431.327	1.357	50	20	IDGD	
Cc1ccccc1NCC(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781331272	NJYHVXPBBOPNDG-WMZOPIPTSA-N	428.302	1.927	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(N(C)C)cn1)C2	1782171255	WAIGIKBGDAIUPB-HGHGUNKESA-N	438.956	1.529	50	20	IDGD	
C[C@H](Cc1ccco1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)C2	1782598493	MDODWBGAVUWWKS-LYHRCORUSA-N	448.564	1.345	50	20	IDGD	
COc1cc(Cl)ccc1CC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1782897742	SDVUYDCVEFLBJU-HNAYVOBHSA-N	431.316	1.321	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)/C=C/c3cc(C)on3)CCO2)C1	1783349932	WKMXIBDWDFAABP-BWZQFPAASA-N	426.311	2.000	50	20	IDGD	
Cc1ccc(OC(C)(C)C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]3C2)nc1	1784093166	PTVNLIACUGPEQN-NXOAAHMSSA-N	439.940	1.127	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN3CCC(C)CC3)[C@H]2C1	1784320839	PTGPIEZXDWEDFT-FJIDUMEYSA-N	444.414	1.872	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc4ncnn4c3)C[C@@H]21	1784620805	NDGVRIGDVOOASB-FJIDUMEYSA-N	433.940	1.659	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3C[C@H]3F)C[C@@H]21	1785079612	RSEKHSFIJXHZCR-CMXYNOPPSA-N	447.935	1.456	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)N2CC[C@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)c1	1785113895	WSXOPBJXHLPJRB-NRFANRHFSA-N	433.581	1.940	50	20	IDGD	
N[C@@H](CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)c1cccnc1	1786928425	IPPYOFIRTJSYLW-BWJWTDLKSA-N	443.317	1.142	50	20	IDGD	
CN[C@@H](CC(=O)Nc1ccc(C2(NC(=O)[C@@H](C)Br)CCC2)cc1)C(=O)O	1788065394	QIZDOFUITMRMDB-RISCZKNCSA-N	426.311	1.967	50	20	IDGD	
C[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)N1C[C@H]2C[C@H]2C1	1788509048	KRHLBAJFFRFMRO-LTAJLKHCSA-N	428.371	1.091	50	20	IDGD	
C=CC(=O)N[C@@H](C)C(=O)Nc1ccc(C2(NC(=O)CCC(=O)NN(C)C)CCC2)cc1	1789644487	TUUWIKDBZZSRDU-HNNXBMFYSA-N	429.521	1.184	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3n[nH]c4cccc(F)c34)[C@H]2C1	1790485023	WXLUEMCPCZHOJE-JFILPPLUSA-N	438.887	1.549	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc4c(c3)CCNCC4)[C@H]2C1	1790620460	NGHCLLZPUPDAEQ-QRFRQXIXSA-N	448.995	1.628	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cn(C)nc3C)C[C@@H]21	1790957927	FFMXALNMPRVVGX-HNKHHVNMSA-N	427.343	1.495	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc(OCF)cn3)C[C@@H]21	1791056777	ARKCCOJNIOTETA-UHXUPSOCSA-N	445.289	1.159	50	20	IDGD	
Cc1nccn1[C@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]2C1	1791064612	APRAENZAEJHMIM-WOOFSFRISA-N	427.343	1.516	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CC[C@H](C(=O)OC)CC3)C[C@@H]21	1791250052	XKYJTBLCYQOKBI-QQCJEOGWSA-N	444.956	1.199	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1ccc(C2(NC(=O)CCc3cn[nH]c3)CCC2)cc1	1791599416	GKUCGPIKIHIMCT-UHFFFAOYSA-N	426.521	1.849	50	20	IDGD	
Cc1c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)CBr)nc2ccccn12	1792868102	PROBYRKVNXPETG-LJGDNWOOSA-N	449.349	1.877	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C=C/C(=O)NCc1ccccc1	1792941250	HKHZARDQIWQTDI-JBJYQZIFSA-N	433.936	1.466	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCl)c1ccc(Br)nc1F	1793110606	MIEDIOQCQKZCKB-DTHBNOIPSA-N	434.693	1.835	50	20	IDGD	
COc1ccc([C@@H]2C[C@@H]2C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)cc1	1793521682	XTNNOKJRPOUYJY-QWCYLASJSA-N	448.328	1.431	50	20	IDGD	
Cn1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)cn1	1794141346	VGFNAVRAMWTHBQ-FZKCQIBNSA-N	439.944	1.804	50	20	IDGD	
Cc1nccn1CCCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCBr	1795117046	JYMWCQZODCKRPH-JLVBRIDZSA-N	427.343	1.346	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1nc[nH]n1	1796489522	HSAUSXKIZPXDLG-RNJOBUHISA-N	426.905	1.189	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnc2[nH]ncc2c1	1797343753	GWSMMPYQYZXMLK-QPKOPYBWSA-N	436.310	1.192	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1n[nH]c2ccccc12	1797415720	XFBHLUMFTOSNEV-FAXLKDOZSA-N	435.322	1.940	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1cnc3[nH]ccc3c1)C2	1797956428	CTJYLQDTTNPFKA-RMFSNUHRSA-N	444.608	1.937	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1c(F)cccc1F)C2	1797957404	LORZRQWQIASADO-VTEUUUEMSA-N	426.536	1.948	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cc1ccc3c(c1)CCC3)C2	1798440748	NEZMEBGKYGWCLH-ACDBMABISA-N	447.539	1.668	50	20	IDGD	
Cc1ccc(NCCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)c(C)c1	1798503713	XFWUSLDWGRSFRQ-KOUNCHBCSA-N	449.360	1.737	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c(-c3ccncn3)noc1C)C2	1799268658	BUXRSTZURQHDLO-LOUJCGABSA-N	433.896	1.661	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Br)C1	1799352278	NSWJVJIYWDSAEM-ZLCQRPCESA-N	449.317	1.246	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc(N3CCCNC(=O)C3)n1)C2	1800069300	CLUUEGATDQQSFE-YYIAUSFCSA-N	447.967	1.677	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(OC(F)F)cc1)c1ccc(B(O)O)cc1	1800473632	GBJWFRYHUQHQLQ-BCDXTJNWSA-N	444.243	1.533	50	20	IDGD	
CC(=O)Nc1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)ccc1C	1800640631	NCYVEGKELWMVQV-WKCHPHFGSA-N	449.316	1.199	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3cnccc3[nH]1)C2	1800641549	DSAYGZKUHUCODL-LOUJCGABSA-N	435.322	1.940	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3ncncc3c1)C2	1800759118	IEVOJYRLCHBMFB-RMIITELYSA-N	433.306	1.616	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1[nH]cnc1-c1cccnc1)C2	1800760260	LJIQAERLRCIDRQ-REBRKWNGSA-N	448.321	1.458	50	20	IDGD	
CCOC(=O)c1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](Cl)COC)cc1	1800979571	PQICMJSGRDFJOB-XMTFNYHQSA-N	438.908	1.320	50	20	IDGD	
CC(C)N1CCC[C@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)CBr)C2	1801570529	JVTPAEJAQJHPDK-UHDSXZAQSA-N	430.387	1.480	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H]2C[C@@]2(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](O)CCl)C3)C1	1801893812	PLWANFGBJRMXRD-VUSYMWPTSA-N	441.956	1.481	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc3[nH]ccc3n2)[C@@H]1c1cccnc1)[C@H](O)CCl	1803142952	PARQYOVBMUVSCG-GDIGMMSISA-N	427.892	1.877	50	20	IDGD	
COC[C@@H](NC(C)=O)C(=O)N1CCC2(CCCN(C(=O)[C@@H](C)CBr)C2)CC1	1805385300	VYZIWHGFJPKQSL-GOEBONIOSA-N	446.386	1.400	50	20	IDGD	
Cc1ccoc1C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1808494431	PMBCMZKAYYHYOP-QUCCMNQESA-N	433.273	1.296	50	20	IDGD	
NC(=O)c1nccnc1C(=O)N1CCC2(CCCN(C(=O)CCBr)C2)CC1	1809067257	VBQHTYLOPJRUSX-UHFFFAOYSA-N	438.326	1.205	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)N1CCC2(CCCN(C(=O)CCBr)C2)CC1	1809067430	ZLFVYGKNRXPTJZ-CQSZACIVSA-N	431.375	1.710	50	20	IDGD	
CC[C@@H](NC)C(=O)N1CCCC2(CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CC2)C1	1809952561	CCGSERXZDYEMNN-GZPJKGAFSA-N	430.553	1.350	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCBr)n[nH]1	1816780749	IZRMFEKAMKUMBY-CMPLNLGQSA-N	429.319	1.634	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)Cc2cscn2)[nH]n1)c1ccc(B(O)O)cc1	1817471712	YCWCOEQRJRQWDW-KRWDZBQOSA-N	439.306	1.095	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc4ncnn4c3)sc2C1	1819402815	QGGADOCFRDJJKC-NEPJUHHUSA-N	434.909	1.665	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3n[nH]cc3[N+](=O)[O-])sc2C1	1820303701	YVPDTPFGOUFJNF-SFYZADRCSA-N	428.858	1.254	50	20	IDGD	
CN(C)C(=O)NCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@](C)(Cl)CCl)n[nH]1	1820863504	ZZDAYFJZEADKTL-PXAZEXFGSA-N	433.340	1.909	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)CCn2cncn2)[nH]n1)[C@@H](F)Br	1820936564	BWAVRYXLZBXKLA-SMDDNHRTSA-N	428.266	1.774	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)c3c[nH]c(=O)cn3)sc2C1	1821474061	IBOHYBUSCFBMNH-DTWKUNHWSA-N	440.323	1.626	50	20	IDGD	
CC(C)n1ccc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)CCC(=O)NN(C)C)CC3)n1	1821681242	NIJCYNKYGBVSHN-ZDUSSCGKSA-N	447.565	1.519	50	20	IDGD	
C[C@@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1)n1cccc1	1822678469	YLFMMICIJSTHAD-RDJZCZTQSA-N	429.525	1.838	50	20	IDGD	
C[C@H](Cn1ccnc1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1	1822789289	OZVVFBOQDFSRQY-NVXWUHKLSA-N	444.540	1.308	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)CN3CCCCC3=O)sc2C1	1825867735	JEUVLGFJVCCRSP-NWDGAFQWSA-N	428.942	1.321	50	20	IDGD	
C[C@](O)(CC(=O)O)CC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CO[Si](C)(C)C)CC2	1826073782	IXLLTVMBJMPTNZ-BBATYDOGSA-N	443.598	1.522	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1	1826083629	PGSJCGSRTVFFBJ-RYUDHWBXSA-N	429.974	1.836	50	20	IDGD	
CCOC(=O)N[C@H](O)C(=O)N1CCC([C@H]2CCCCN2C(=O)CCBr)CC1	1826358319	DRLPZBYQJOEWRL-GDBMZVCRSA-N	448.358	1.456	50	20	IDGD	
O=C1CCCN1CC(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@H](F)Br)CC1	1826728995	RCYFCEXMWIBXMW-YOEHRIQHSA-N	432.334	1.919	50	20	IDGD	
CC1=C(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)CCO1	1827052948	PUNBKQNJCNRLHL-NRFANRHFSA-N	426.322	1.294	50	20	IDGD	
O=C([C@H](F)Br)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)n2)CC1	1827601733	OLMROZXDJRCGNQ-OCCSQVGLSA-N	445.289	1.812	50	20	IDGD	
C[C@H](NC(=O)c1cnccn1)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H](F)Cl)CC1	1829026165	KPTXNWIPXWYBTQ-XKQJLSEDSA-N	439.919	1.749	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)C1(O)CCC1)CCO2	1829746832	TZIULRBJDAKCNU-VKJFTORMSA-N	447.370	1.167	50	20	IDGD	
COc1ccnc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)c1	1830364437	KIZWPUGIOXQZCC-HXUWFJFHSA-N	425.913	1.425	50	20	IDGD	
Cc1nccn1[C@H](C)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830370232	MUTIRDJKGJZVRI-QRWLVFNGSA-N	426.945	1.474	50	20	IDGD	
O=C([C@H](O)CCl)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2CC(c3ccccc3)=NN2)CC1	1831062195	RSJGYRSBKQLFER-PCCBWWKXSA-N	446.979	1.972	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccnc3S)C2)C1	1831638663	GBMDGGFDBIVFCQ-DNVCBOLYSA-N	427.954	1.848	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(O)ccc3O)C2)C1	1831653781	LTOZLOWSXPJGIL-OXQOHEQNSA-N	426.897	1.575	50	20	IDGD	
Cc1cc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)cn1C	1831872969	AGNDZZCQYWPETB-FQEVSTJZSA-N	431.581	1.940	50	20	IDGD	
O=C(/C=C/c1ccc(F)cc1F)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1	1832132463	UARKCOLOVBEAEC-ZRRAGKFRSA-N	444.862	1.034	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)Cc2ccc(O)cn2)CC1	1832321106	HGOPMSCWOQZQHH-FQEVSTJZSA-N	445.564	1.322	50	20	IDGD	
C[C@H](Cc1ccco1)C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)CCl)CC2)CC1	1833313149	XTSCALFSGZDTJI-DNVCBOLYSA-N	425.957	1.630	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](F)Cl)CC2)CC1)c1cnn(-c2cccnc2)c1	1834002993	AHKPZYGXUWLHTB-LJQANCHMSA-N	448.930	1.987	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cccc(=O)n3C)CC2)CC1	1834083522	XBMNKPBBFYBQPP-SFHVURJKSA-N	436.984	1.978	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(N2CCC(NC(=O)C3CCC3)CC2)CC1	1834355061	LXQDHRXTIXQUCI-WGOQTCKBSA-N	442.564	1.492	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](CN)c1ccccc1)CCO2	1835813914	WKUFDVGOPRVULG-DXIQSLLYSA-N	437.968	1.593	50	20	IDGD	
O=C(c1cnoc1C1CC1)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836716571	CJWQHTHJKFOMAS-QGZVFWFLSA-N	425.913	1.764	50	20	IDGD	
CC(F)(F)C(C)(C)C(=O)N1CCOC[C@@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1837710122	JJFQCPDIIRERNM-LJQANCHMSA-N	436.572	1.976	50	20	IDGD	
CCc1ccnc(C(=O)N2CCOC[C@@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)c1	1837711824	RRPIUBUQYQAMKE-OAQYLSRUSA-N	435.597	1.566	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cccn4ccnc34)C2)C1	1837713045	DQKPXFWATZAGBL-OAQYLSRUSA-N	446.580	1.256	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3oncc3C)CCO2)C1	1838400198	QIQCAKFGALDIEI-DYVFJYSZSA-N	430.299	1.227	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)COc3ccc(O)nn3)CC2)CC1	1838636854	AZLOGJGNCVMOAS-INIZCTEOSA-N	440.928	1.577	50	20	IDGD	
O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(F)c1)CCO2	1838910111	UUAYUYQUKKGWDJ-SFHVURJKSA-N	429.286	1.681	50	20	IDGD	
Cc1ccn(C)c1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2	1839153679	OETKILHBBQWRMJ-OALUTQOASA-N	432.348	1.640	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3n[nH]c4c(C)cccc34)CCO2)C1	1839596335	SDHDTYRVVTVWSY-IIBYNOLFSA-N	434.924	1.959	50	20	IDGD	
CC(C)N[C@H](C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](C)Br)CCO2)C1)C(C)C	1840032125	OEMDIVRHGIINLV-BXWFABGCSA-N	448.402	1.249	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(F)cc3OC)CCO2)C1	1840641111	OOZOVMRPGYQNOE-OXJNMPFZSA-N	428.888	1.922	50	20	IDGD	
CCCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)[C@@H](O)CCl)C2	1841922524	ZZTARHNMQASMHD-GJZGRUSLSA-N	431.961	1.873	50	20	IDGD	
O=C(CCc1c[nH]c2ccc(F)cc12)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843015208	TWZZXSPKXJFSEN-UHFFFAOYSA-N	449.291	1.437	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2cn3ccccc3n2)C1	1843646500	OCFLEBFFLYBACX-MFKUBSTISA-N	433.472	1.285	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)[C@@H]2[C@H]3Sc4ccccc4[C@@H]32)C1	1844271241	VUGKYTNPQYLNDL-AABGKKOBSA-N	434.326	1.071	50	20	IDGD	
O=C([C@@H](O)CCl)N1CC2(CCCN2C(=O)Cc2cc(Br)ccc2O)C1	1845149294	SPLKPBBTSDVZSD-AWEZNQCLSA-N	431.714	1.500	50	20	IDGD	
CC(C)(C)OC(=O)NC12CC(C(=O)N3CCCC34CN(C(=O)[C@H](O)CCl)C4)(C1)C2	1846108948	MQINNQWDJTYHFB-XYJCDUHRSA-N	427.929	1.237	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1ccc2c(c1)NC(=O)CO2	1847500981	IEYLOAMPWDDBPB-UGFHNGPFSA-N	436.306	1.864	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CN(C)NC(=O)NCc1ccccc1	1847868789	HQCZQDCNFGRLRJ-QYZOEREBSA-N	449.983	1.942	50	20	IDGD	
Cc1nn2cc(CC(=O)N3CC[C@H]4[C@@H]3CCN4C(=O)[C@@H](F)Br)nc2s1	1847977431	XTACBDUBVPLOOA-GMXVVIOVSA-N	430.303	1.534	50	20	IDGD	
Nn1c(SCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)nnc1-c1ccc(Cl)cc1	8659370	GIEDETMLRPXWSG-UHFFFAOYSA-N	447.864	1.774	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)c2cccc(S(=O)(=O)N(C)C(C)C)c2)cc1	9752354	TWRJNXYRTZRDOB-UHFFFAOYSA-N	447.513	1.642	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)C[C@@H](C)N3S(C)(=O)=O)cc1	15025206	HNSQKLWQJZXLBR-CYBMUJFWSA-N	430.486	1.105	50	20	IDGD	
O=C(CSc1ccc(S(=O)(=O)N2CCCC2)cn1)NNC(=O)c1ccc(F)cc1	17226239	VXXOEPAGDJERNJ-UHFFFAOYSA-N	438.506	1.559	50	20	IDGD	
O=C(NNC(=O)c1ccccn1)c1ccc(S(=O)(=O)NCCc2cccs2)cc1	24480206	VQKNHIUJHGYPTP-UHFFFAOYSA-N	430.511	1.739	50	20	IDGD	
CN1CC(=O)N(CCCC(=O)NNC(=O)c2cc(-c3ccco3)nc3ccccc23)C1=O	105006504	QRUFEOWGLHFVKJ-UHFFFAOYSA-N	435.440	1.930	50	20	IDGD	
CCCCCS(=O)(=O)CC(=O)NNC(=O)[C@@H](C)Oc1cccc(Br)c1	110817137	JXOOYGCUDOERRD-GFCCVEGCSA-N	435.340	1.969	50	20	IDGD	
Cc1ccccc1-n1ccnc1SCC(=O)NNC(=O)CNC(=O)c1cccs1	725741537	PRLOEAZCHSVYPQ-UHFFFAOYSA-N	429.527	1.912	50	20	IDGD	
C#Cc1cccc(NC(=S)NNC(=O)CCCNS(=O)(=O)c2ccc(F)cc2)c1	727498026	PLOZHUBLAGVRCZ-UHFFFAOYSA-N	434.518	1.883	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)[C@@H]2CCCC[C@H]2C(=O)N2CCCC2)c2ccccc2c1=O	728151222	XMGIUTQGEADNGQ-NVXWUHKLSA-N	425.489	1.123	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)c2cc(S(=O)(=O)N3CCCCC3)cn2C)c1	728206190	ZUUHTXUVVDRNEZ-UHFFFAOYSA-N	449.533	1.081	50	20	IDGD	
O=C(Cn1cc(Br)ccc1=O)NNC(=O)c1cc(F)ccc1Br	728548498	GDDMZHUMWBLISB-UHFFFAOYSA-N	447.058	1.974	50	20	IDGD	
C[C@H](C(=O)NNC(=O)c1cc(F)ccc1Br)N1C(=O)[C@H]2CCCC[C@@H]2C1=O	728550878	LXDUPGFRDDJDSE-USWWRNFRSA-N	440.269	1.913	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)NCCN2CCOC[C@H]2C)c2ccccc2c1=O	729613750	HGQNMLADGWKAQN-MRXNPFEDSA-N	444.536	1.251	50	20	IDGD	
O=C(NCCc1cccs1)NNC(=O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1	732062245	DFAKAPGQQSCHHF-GFCCVEGCSA-N	437.503	1.896	50	20	IDGD	
Cc1nn([C@@H]2CCS(=O)(=O)C2)c2nc(C3CC3)cc(C(=O)NNC(=O)C3CCC3)c12	732143268	ZBAWOFKTYKCYNW-CQSZACIVSA-N	431.518	1.538	50	20	IDGD	
CC(=O)N[C@@H](CC(=O)NNC(=O)CCN1C[C@H](C)O[C@H](C)C1)c1c(F)cccc1F	732263726	OATRVAWGKHZXGI-AHIWAGSCSA-N	426.464	1.179	50	20	IDGD	
CN1CCN(C[C@H](NC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c2ccccc2)CC1	733351184	SZHUYPHWWNIRBS-QFIPXVFZSA-N	447.543	1.805	50	20	IDGD	
C[C@@]1(NNC(=O)N[C@@H]2CCN(Cc3ccc(C(F)(F)F)cc3)C2)CCS(=O)(=O)C1	734071415	JTXFVEUNKJGEDS-NVXWUHKLSA-N	434.484	1.661	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)[C@@H]1CC(=O)N(c2ccc(Cl)cc2)C1	734241628	SKHMJLHQHADOFI-GFCCVEGCSA-N	439.900	1.548	50	20	IDGD	
O=C(NNC(=O)c1cccnc1SCC1CCCCC1)N[C@@H]1CCS(=O)(=O)C1	734428632	WGNHKJXERBZBKA-CQSZACIVSA-N	426.564	1.885	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(/C#N)C(=O)N[C@@H]2CCN(CCN3CCOCC3)C2)c1C	734468284	QHJJXRDNZXGDSN-NFIHMNEHSA-N	443.592	1.742	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)NCc3cc(S(N)(=O)=O)ccc3F)cc2C1	734516999	NANTTZJEYPNTNQ-SNVBAGLBSA-N	440.522	1.804	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)N[C@@H]3CCN(CCN4CCOCC4)C3)cc2C1	734686738	TUHIQNSMLZEOQY-NVXWUHKLSA-N	435.594	1.223	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)[C@@H]2C[C@H]2c2c(F)cccc2F)ccc1Cl	734809241	JHPKBGDEMSINHE-NXEZZACHSA-N	429.832	1.830	50	20	IDGD	
CCC(=O)N1CCC[C@@H](C(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)C1	734824631	GOHDXQVZLDTREQ-CQSZACIVSA-N	425.530	1.365	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)[C@H]2C[C@H]2c2ccc(F)cc2)CC1	735117332	RFCPBHWZWOVPLZ-IRXDYDNUSA-N	433.509	1.404	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)c2cnn(C)c2)cc1S(=O)(=O)Nc1ccc(F)cc1	735521875	ISXBNWLXLAUFHR-UHFFFAOYSA-N	431.449	1.743	50	20	IDGD	
O=C(CN1CCN(Cc2nc(O)c3ccccc3n2)CC1)NNC(=O)c1ccc(F)cc1	738298834	IFVFAVVKTWDCLR-UHFFFAOYSA-N	438.463	1.053	50	20	IDGD	
CN1CCN(Cc2ccc(CNC(=O)NNC(=O)COCc3ccccc3)cc2)CC1	738456121	DVLXHMYTIKNDSO-UHFFFAOYSA-N	425.533	1.481	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)[C@H]2CCCN(C(=O)COc3ccccc3)C2)c1	741172672	CZBMADUJNQQFNX-INIZCTEOSA-N	441.484	1.782	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)N[C@H](C)[C@@H]1CN(Cc2ccccc2)CCO1	741284688	YEGFYWSLCAKMHQ-UTKZUKDTSA-N	426.517	1.858	50	20	IDGD	
CC(=O)N[C@@H](CC(=O)OCC(=O)NNC(=O)c1ccc(C#N)cc1)c1ccc(F)cc1F	745143246	ZFONLLHZJMJCMT-SFHVURJKSA-N	444.394	1.408	50	20	IDGD	
O=C(NN=C1CCC[C@H](N2C(=O)c3ccccc3C2=O)C1)c1ccc(-n2cnnn2)cc1	745198435	QMZHNGQDLGZHCY-KRWDZBQOSA-N	429.440	1.987	50	20	IDGD	
COC1CCN(C2(CNC(=O)NNC(=O)c3cc([N+](=O)[O-])ccc3O)CCCC2)CC1	745807414	CDTFVSBUNNDPRY-UHFFFAOYSA-N	435.481	1.668	50	20	IDGD	
CS[C@H]1CC[C@@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)C1	745896121	GRTXVEYZIDYZEA-CABCVRRESA-N	426.564	1.699	50	20	IDGD	
CSCC[C@H](C(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)N1C(=O)[C@H]2CCCC[C@H]2C1=O	746022144	ABTBECRFWLSMRV-OWCLPIDISA-N	448.501	1.653	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)[C@H]2CCCN(C(=O)NC3CCCC3)C2)c2ccccc2c1=O	746096509	IRPNMKRTLHFRLU-AWEZNQCLSA-N	440.504	1.059	50	20	IDGD	
N#Cc1ccc(NNC(=O)Cn2cc(Br)c(O)nc2=O)cc1C(F)(F)F	746889813	PVLPQXSDFCRWOD-UHFFFAOYSA-N	432.156	1.745	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2ccc([C@@]3(C)NC(=O)NC3=O)cc2)ccc1OC(C)C	748011970	KNJUYRAGPPLOGE-JOCHJYFZSA-N	440.456	1.612	50	20	IDGD	
Cc1ccc(CNC(=O)c2cccc(CNC(=O)NNC(=O)C(=O)N3CCCC3)c2)cc1	748454338	QNBMUJIFBVCWIX-UHFFFAOYSA-N	437.500	1.378	50	20	IDGD	
CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)NNC(=O)[C@@H]1COc2ccccc2O1	749330839	AZQBUEMLMHINDH-PXNSSMCTSA-N	440.431	1.342	50	20	IDGD	
O=C(CC1CCCC1)NNC(=O)c1ccc2c(c1)S(=O)(=O)N(C[C@H]1CCCO1)C2=O	749940933	ZREXIDYSJNLINX-OAHLLOKOSA-N	435.502	1.351	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)C1CCC(NC(=O)CC2CCCCC2)CC1	751198442	DQKILAHPWQZJRG-UHFFFAOYSA-N	432.521	1.802	50	20	IDGD	
Cn1nnc2cc(C(=O)NNC(=O)[C@@H]3Cc4ccccc4CN3Cc3ccccc3)cnc21	755203768	TXPCSUOZTFLLJQ-NRFANRHFSA-N	441.495	1.751	50	20	IDGD	
CCOc1ccc(Oc2ccccc2NC(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)cc1	755429531	HANZOVKWWQCWAK-CYBMUJFWSA-N	436.490	1.968	50	20	IDGD	
Cn1c(C=NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)nc2ccccc21	755471190	DOAFSQCEZDMSMA-UHFFFAOYSA-N	427.486	1.358	50	20	IDGD	
O=C1CN(c2ccc(NC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)cc2Cl)CCN1	755938617	WEPUSSNRDVHCKT-UHFFFAOYSA-N	432.824	1.651	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1nnc(C23CC4CC(CC(C4)C2)C3)s1	756019148	CPZMBYCXKORYPR-RODOAYEJSA-N	442.567	1.096	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1ccc(Br)cc1C(F)(F)F	756124536	SBRCFBWUHUBCHY-ZCFIWIBFSA-N	447.233	1.558	50	20	IDGD	
COC(=O)c1cccc(NC(=O)C(=O)NNC(=O)CC2CCCC2)c1Br	756155845	WFABQBUSKMCDIK-UHFFFAOYSA-N	426.267	1.902	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)Nc2ccc(C(N)=O)c(F)c2)c2ccccc2c1=O	756350650	FAUJPQAWKUSYJV-UHFFFAOYSA-N	426.408	1.682	50	20	IDGD	
Cc1ccc(C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c(Br)n1	756431877	DJJVRMBLFOVYJP-UHFFFAOYSA-N	437.206	1.679	50	20	IDGD	
CCOC(=O)C1CCN(C(=O)c2ccc(NC(=O)NNC(=O)c3cnccn3)cc2)CC1	756682650	OVAYVWAUBOCMIM-UHFFFAOYSA-N	440.460	1.358	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)N[C@@H]2CCN(C(=O)CCc3ccccc3)C2)cc1	757272178	FWXKWXJQGYNJAR-LJQANCHMSA-N	435.484	1.501	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)c2nn(CCC(C)C)c(=O)c3ccccc23)ncn1	757763398	MFYALDNCXHQWOA-UHFFFAOYSA-N	425.449	1.708	50	20	IDGD	
O=C(CN1c2cccc3cccc(c23)S1(=O)=O)NNC(=S)NC[C@@H]1CCCCO1	758180507	LNZGPVBJWSABRX-AWEZNQCLSA-N	434.543	1.413	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)N[C@@H]2CCO[C@@H](c3ccc(F)cc3)C2)c2ccccc2c1=O	758715364	QJJQTVCULPWZNC-CRAIPNDOSA-N	439.447	1.937	50	20	IDGD	
Cc1ccc(N2CCN(C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)CC2)cc1C	758765538	LOJOYPDYQDVKHH-UHFFFAOYSA-N	437.548	1.873	50	20	IDGD	
CNc1nnc(CC(=O)NNC(=O)c2nc(-c3ccccc3)n(-c3ccccc3)n2)s1	758794650	LQOCJMBQQBEMSP-UHFFFAOYSA-N	434.485	1.831	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC2(CC1)CC(C(=O)NNC(=O)COCc1ccccc1)=NO2	760353157	PXOKBVQINYYOPI-UHFFFAOYSA-N	446.504	1.897	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)N1CCO[C@H]([C@@H](C)NC(=O)OC(C)(C)C)C1	760713884	DZAWOZJJRPPHJN-HIFRSBDPSA-N	446.508	1.611	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)CCc2nc(-c3ccsc3)no2)n1	762406561	GBWSRTWSSAWXGV-UHFFFAOYSA-N	435.487	1.429	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H]1[C@H]1COCCC1=NNC(=O)Cc1cc(O)nc(O)n1	762422857	MUVWNWJMTUCSCP-DZGCQCFKSA-N	435.481	1.339	50	20	IDGD	
O=C(NN=Cc1ccc(OCCBr)c(Cl)c1)N[C@H]1CCS(=O)(=O)C1	763160964	BMVBEXQPJQYYMG-NSHDSACASA-N	438.731	1.934	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)c3cc(S(=O)(=O)NC(C)C)c[nH]3)n[nH]2)cc1	763164472	OGTGYEQFIZZGQJ-UHFFFAOYSA-N	444.517	1.729	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)c2ccccn2)sc2c1CC[C@H](C)C2	763466000	CGPFXHCVZDTSRT-NSHDSACASA-N	430.486	1.844	50	20	IDGD	
CCCNS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2c[nH]c3ccccc23)cc1	763535172	PFQMKVNPSAEEQM-UHFFFAOYSA-N	443.485	1.256	50	20	IDGD	
COc1cc(C)c(NC(=O)C(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)cc1OC	763540142	SDGOMOMHYXPUAX-UHFFFAOYSA-N	447.444	1.438	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(N3CCCC3=O)c2)cc1OC	763549891	BCOUAWIQTANFKR-UHFFFAOYSA-N	426.429	1.230	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc2c(c1)CCCC(=O)N2	763662183	FTHBYQNKSIIAJU-UHFFFAOYSA-N	426.429	1.135	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(CCN3CCCC3)c2)cc1	763678569	GJNIFUDUIQBGGV-UHFFFAOYSA-N	435.484	1.361	50	20	IDGD	
Cc1nc(-c2cccc(NC(=O)C(=O)NNC(=O)COc3ccc(Cl)cc3)c2)no1	763686875	WGEVTIRRJZMUJC-UHFFFAOYSA-N	429.820	1.863	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(N2CCOC[C@@H]2C)cc1	763712068	DGXMMLCDOMXKMV-INIZCTEOSA-N	440.500	1.639	50	20	IDGD	
CC(=O)Nc1cc(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)ccc1Cl	763745387	DJAXYGDCSCLGEQ-UHFFFAOYSA-N	443.891	1.837	50	20	IDGD	
CNC(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)c2cc(OC)cc(OC)c2)c1	763771512	HVEZRNALBKXLIE-UHFFFAOYSA-N	434.836	1.117	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3cc4c(s3)CCC4)cc2)CCO1	763781277	HXHHWQVHIGOYMC-ZDUSSCGKSA-N	428.514	1.862	50	20	IDGD	
Cc1c(Cl)cc(NC(=O)C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1Cl	763789720	BGLOLUYEVUKNRN-UHFFFAOYSA-N	448.266	1.948	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cnn(CC(F)(F)F)c2)c1C	763853402	YTIWIDVFLWSLRB-LBPRGKRZSA-N	427.383	1.616	50	20	IDGD	
CCCOc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1Cl	763921888	RNVFKBUYNJVFOT-UHFFFAOYSA-N	443.851	1.504	50	20	IDGD	
O=C(Cc1ccsc1)NNC(=O)C(=O)Nc1ccnc(OCC(F)(F)C(F)F)c1	764033723	NLXZFISZQLPDQL-UHFFFAOYSA-N	434.371	1.751	50	20	IDGD	
COC(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)c2cccc(Br)c2)c1	764058369	GJHAOVDFVLVUTE-UHFFFAOYSA-N	434.246	1.564	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2cccc(N3CCCCC3)c2)c1	764078003	PYVKOPQAERPYSS-UHFFFAOYSA-N	444.513	1.480	50	20	IDGD	
O=C(CCC1CCCCC1)NNC(=O)C(=O)Nc1cccc(S(=O)(=O)NC2CC2)c1	764210953	KWLJFSXMBIDYRH-UHFFFAOYSA-N	436.534	1.574	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)C(=O)Nc1ccc(CN2C(=O)CCC2=O)cc1	764239225	HIHZLOONXIJTCS-UHFFFAOYSA-N	447.451	1.076	50	20	IDGD	
Cc1cc(N(C)C)ccc1NC(=O)C(=O)NNC(=O)c1cc(Br)ccc1O	764279098	YLZKPMNLWMOABB-UHFFFAOYSA-N	435.278	1.929	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)C(=O)Nc1ccnc(OCC(F)(F)F)c1	764367840	NMXZACZUVNLBQX-UHFFFAOYSA-N	426.351	1.325	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)Nc2nccs2)cc1)c1ccc2nnc(O)n2c1	764494111	LJHFIPWCIAEKAU-UHFFFAOYSA-N	431.459	1.449	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3nc4nc(C)cc(C)n4n3)n[nH]2)cc1OC	765596953	PCMGPGHEPJSPDV-UHFFFAOYSA-N	436.432	1.223	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)[C@@H]2CC[C@@H](C(F)(F)F)NC2=O)n[nH]1	768275397	BBCUSTOABVOUCY-YGRLFVJLSA-N	425.367	1.303	50	20	IDGD	
CCCCC(=O)N1CSC[C@@H]1C(=O)NNC(=O)c1cc(-c2ccccc2OC)[nH]n1	768280694	CJDYEPNMDHZCPI-MRXNPFEDSA-N	431.518	1.938	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)c1nccc2c(S(N)(=O)=O)cccc12	768465213	YPRUXCDMNUUUSH-LLVKDONJSA-N	432.433	1.250	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)CCC(=O)c2ccc(Cl)cn2)c1	768961519	GSKHMLKKMRBZEA-UHFFFAOYSA-N	438.893	1.409	50	20	IDGD	
CCSCc1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)no1	769730536	WJCJQEMEKOWKFW-UHFFFAOYSA-N	438.531	1.787	50	20	IDGD	
CN1CCN(CC(=O)N(C)c2ccc(NC(=O)NNc3cccc([N+](=O)[O-])c3)cc2)CC1	770022754	GSUSSMHAZLTZDA-UHFFFAOYSA-N	441.492	1.954	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@@H]2CC(=O)N(c3c(F)cccc3F)C2)cc(OC)c1OC	770573041	OMAGQAPTCHRWFY-GFCCVEGCSA-N	449.410	1.805	50	20	IDGD	
COc1ccc(Br)cc1C(=O)CCC(=O)NNc1nc(O)c2cnn(C)c2n1	770984956	VNQPQMOPYOAVEO-UHFFFAOYSA-N	449.265	1.946	50	20	IDGD	
COc1ccccc1[C@]1(C)NC(=O)N(CC(=O)NNC(=O)c2cccc(Cl)c2)C1=O	771221245	FMBCBKWHZMIRSV-FQEVSTJZSA-N	430.848	1.577	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)C1CCN(C(=O)c2cc(OC)cc(OC)c2)CC1	772015474	GWZJCIUMLWUAKH-ZDUSSCGKSA-N	435.477	1.045	50	20	IDGD	
CSc1nnnn1-c1cccc(NC(=O)C(=O)NNc2ccc(C(F)(F)F)cn2)c1	773665500	FYIVJYGQGLXDEA-UHFFFAOYSA-N	438.395	1.880	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(F)c(NC(=O)C(=O)NNc2ccc(C(F)(F)F)cn2)c1	773670097	TWLRILGCVWXJLU-UHFFFAOYSA-N	449.386	1.572	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ncc(Cl)cc2Cl)cc1NS(C)(=O)=O	773677753	IYBWIWRIECECNM-UHFFFAOYSA-N	448.288	1.850	50	20	IDGD	
CO[C@H](c1ccc(Br)cc1)[C@H](C)NC(=O)NNC(=O)C(=O)N1CCCC1	774341371	PHASAMANLMPISE-FZMZJTMJSA-N	427.299	1.478	50	20	IDGD	
CC[C@H](C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1)c1ccc(OC)cc1	775946219	UJHXGKBSPNDKJK-LPHOPBHVSA-N	428.441	1.719	50	20	IDGD	
Cn1cc([C@@H](NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c2ccc(F)cc2)cn1	776197910	XYBQJSGFQNOQHX-SFHVURJKSA-N	445.476	1.696	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)NC[C@H]1COC2(CCOCC2)O1	776887146	QIBQBQOBPJOPKI-HNNXBMFYSA-N	432.502	1.985	50	20	IDGD	
CC1CCC2(CC1)OC[C@@H](CNC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)O2	776949991	PZPCCSWWPCFGTK-SHBDPFAUSA-N	425.507	1.356	50	20	IDGD	
Cc1cc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)nn1[C@H](C)C1CC1	777192803	YCFVHLHYZBYHDV-ACJLOTCBSA-N	428.445	1.307	50	20	IDGD	
COCc1cccc(CC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1	777402867	MQNJHCXEEFBGFI-UHFFFAOYSA-N	431.514	1.621	50	20	IDGD	
O=C(CCc1nc(-c2ccsc2)no1)N1CCN(S(=O)(=O)CBr)CC1	777777151	GDQPXVJDEWASGM-UHFFFAOYSA-N	449.352	1.557	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)[C@@H](Cc2c[nH]c3cc(F)ccc23)NC(C)=O)nc1C	778421553	NUFLNJKZLPAHIE-GOSISDBHSA-N	442.451	1.773	50	20	IDGD	
CCNC(=O)N(C)NC(=O)[C@@H](NS(=O)(=O)c1ccc(Br)cc1)C(C)C	780712113	YFBCPMPHZGFNNB-ZDUSSCGKSA-N	435.344	1.445	50	20	IDGD	
Cc1cc(C)c(S(=O)(=O)NNC(=O)c2nnc(-c3ccccc3)o2)c(C)c1CC(=O)O	782253242	WVKFVOGQSFUOFC-UHFFFAOYSA-N	444.469	1.912	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN[C@@H](CN2CCOCC2)c2ccccc2)cc1OC	782456359	MHIYXXKKAXUBPC-IBGZPJMESA-N	442.516	1.128	50	20	IDGD	
CN(C)CCc1ccccc1NC(=O)C(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	782702421	QYTAKMXLYJZFLC-UHFFFAOYSA-N	436.472	1.082	50	20	IDGD	
Cc1ccc(C(=O)N2CCSCC2)cc1NC(=O)C(=O)NNC(=O)c1ccc(O)cc1	782831239	AQVWTNMKAHJXIK-UHFFFAOYSA-N	442.497	1.289	50	20	IDGD	
CC[C@H](C)n1nc(NC(=O)C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)cc1C	782896236	CRHQQKJQYIGCDK-NSHDSACASA-N	449.537	1.164	50	20	IDGD	
O=C1CN(c2ccc(NC(=O)C(=O)NNc3ccc(Br)cc3)cc2)CCN1	783009595	NHBRKAOKBMGVMA-UHFFFAOYSA-N	432.278	1.467	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2ccc(Br)cc2S(C)(=O)=O)cc1	783035955	KDFHWLMIIVLODJ-UHFFFAOYSA-N	442.291	1.943	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)NCc1ccc(N2CCOC2=O)cc1	783310003	RPULGPXLPDQBPV-UHFFFAOYSA-N	428.445	1.951	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2ccc(Oc3ccccc3)c(C#N)c2)CCS(=O)(=O)C1	783427301	RHXJVGVMHNZOKV-FQEVSTJZSA-N	428.470	1.487	50	20	IDGD	
Cc1cccc(NC(=O)NCC(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)c1	783704511	NOCVFXTXKBKJBL-UHFFFAOYSA-N	448.524	1.752	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NN=Cc1c[nH]ccc1=NC(=O)C(C)(C)C	783813491	MUBZRRVIPOBCOX-UHFFFAOYSA-N	430.534	1.854	50	20	IDGD	
COc1ccc(C(=O)N2CCCCCC2)cc1NC(=O)C(=O)NNc1ccc(C)nn1	783952054	NZHHQCFKZBNGIY-UHFFFAOYSA-N	426.477	1.892	50	20	IDGD	
N#CCCSc1ccccc1NC(=O)C(=O)NNC(=O)CNC(=O)c1cccs1	784005389	YHRRNSJNZBGZFS-UHFFFAOYSA-N	431.499	1.270	50	20	IDGD	
O=C(NNc1nc(Br)cn2ccnc12)[C@@H]1CC=CC[C@@H]1C(=O)N1CCOCC1	784782774	DHYYCOFALLYGCP-OLZOCXBDSA-N	449.309	1.376	50	20	IDGD	
O=C(NNc1ccc(Cl)nc1)C(=O)Nc1cccc(Cn2nc3ccccn3c2=O)c1	784869784	LNZJQHVELXGXEP-UHFFFAOYSA-N	437.847	1.675	50	20	IDGD	
COC(=O)c1ccc(C(F)(F)F)cc1NC(=O)C(=O)NNc1ccnc(N(C)C)n1	784968783	DUJAGALPRKLLRC-UHFFFAOYSA-N	426.355	1.430	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2ccc(N3CCSCC3)cc2)n1	785226419	GVTIYAIHHNEIGD-UHFFFAOYSA-N	429.550	1.958	50	20	IDGD	
CC[C@]1(C)Oc2ccc(NC(=O)C(=O)NNC(=O)Cc3nc4ccccc4n3C)cc2O1	785994589	OEPSRBHZPBGHCZ-JOCHJYFZSA-N	437.456	1.799	50	20	IDGD	
Cn1cc(-c2ncccc2NC(=O)C(=O)NNC(=O)CSc2ccccc2O)cn1	786416144	CXFWWLXDEFNPOA-UHFFFAOYSA-N	426.458	1.066	50	20	IDGD	
COC[C@@H](C)Oc1ccc(Cl)cc1S(=O)(=O)NNC(=O)COc1ccccc1O	786845976	SCGZEWSPQGGHGK-GFCCVEGCSA-N	444.893	1.848	50	20	IDGD	
CC(=O)N[C@H](CC1CCC1)C(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	787439825	MCRJBGGGHITTPC-HXUWFJFHSA-N	449.983	1.300	50	20	IDGD	
COc1cc(F)cc(NNC(=O)C(=O)Nc2ccc(C)c(C(=O)N3CCOCC3)c2)c1	787575500	IWZRTHSBNIZYLQ-UHFFFAOYSA-N	430.436	1.697	50	20	IDGD	
CCc1[nH]nc(C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c1Br	789143892	LUKXODSYLOJRRE-UHFFFAOYSA-N	440.210	1.261	50	20	IDGD	
COc1cc(C)nc(NNC(=O)NC[C@@H](Cc2cccc(F)c2)C(=O)N2CCOCC2)n1	789310617	PWFXVEVLEGQAPB-MRXNPFEDSA-N	446.483	1.277	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(C(=O)NNc2nc3ccccn3n2)cc1Br	791256649	UNJVRTOUTZNNQT-UHFFFAOYSA-N	439.295	1.499	50	20	IDGD	
CC[C@H](C)n1ncc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(C(C)=O)cc2)c1C	792267843	DITFWZVZURHZOH-WFASDCNBSA-N	429.477	1.919	50	20	IDGD	
COc1ccc(-c2nnc(SCC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)n2N)cc1	792859911	TUSAGFFTBPSKHB-UHFFFAOYSA-N	443.445	1.129	50	20	IDGD	
CCOC(=O)c1oc2ccc(S(=O)(=O)NNC(=O)[C@H]3CCc4nncn4C3)cc2c1C	793449354	ASKCXZFHIVWGDB-LBPRGKRZSA-N	447.473	1.082	50	20	IDGD	
CC(=NNC(=O)NCCNC(=O)OC(C)(C)C)c1cc(S(N)(=O)=O)c(C)cc1C	794511819	JLJVYQFMZBSNGD-UHFFFAOYSA-N	427.527	1.499	50	20	IDGD	
NS(=O)(=O)c1cc(C(=NNC(=O)CNC(=O)c2cccnc2)C2CC2)ccc1Cl	794520032	JGUZWLIHZPKBFI-UHFFFAOYSA-N	435.893	1.043	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)[C@H]2COc3ccccc3O2)c(Br)c1	794578759	MHILUFMBEVOSGF-CQSZACIVSA-N	443.275	1.607	50	20	IDGD	
CN(NS(=O)(=O)c1cccc(CC#N)c1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	795181205	JKEZHJMUKUZSPH-UHFFFAOYSA-N	437.522	1.550	50	20	IDGD	
CNC(=O)c1cc(Cl)cc(S(=O)(=O)NNC(=O)c2ccc(Cl)cc2O)c1OC	795300263	LTJRNDHNIXEERR-UHFFFAOYSA-N	448.284	1.691	50	20	IDGD	
CN(Cc1cn(-c2cccc(Br)c2)nn1)C(=O)NNC(=O)Cc1cccnc1	796539744	DQILGFOMVZYFRG-UHFFFAOYSA-N	444.293	1.840	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(F)c(N2CCOC2=O)c1	796991332	KHNMYFWCUFTERR-UHFFFAOYSA-N	431.336	1.090	50	20	IDGD	
COC(=O)c1cc(F)c(Br)cc1NC(=O)C(=O)NNC(=O)CCC(C)C	797003526	BMRCMUIJBLLMHB-UHFFFAOYSA-N	432.246	1.897	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)CSc2nnnn2CC(F)(F)F)c2ccccc2n1	799008840	DALVYVSBUOFEQA-UHFFFAOYSA-N	425.396	1.645	50	20	IDGD	
Cc1ccc(-c2ccnn2C)cc1NC(=O)C(=O)NNC(=O)COc1ccc(C#N)cc1	799257432	KSNGOADSJXOUAO-UHFFFAOYSA-N	432.440	1.432	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(S(=O)(=O)NNC(=O)c2ccccc2OC)c1	800836014	JXYXJEVSPBZMGO-UHFFFAOYSA-N	441.531	1.349	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)c2ccnc3c2nnn3C)cc(OCC)c1OCC	801081717	QCUFKGJUJILSGE-UHFFFAOYSA-N	428.449	1.634	50	20	IDGD	
CCCc1c(C(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)[nH]c(C)c1C(=O)OC	802065527	DJDXRQFOYLQGQX-UHFFFAOYSA-N	436.490	1.932	50	20	IDGD	
Cc1ccc2c(c1)nc(CNC(=O)NNC(=O)CCN1CCN(c3ccccc3)CC1)n2C	802322042	DJIUVLCPEGPEJZ-UHFFFAOYSA-N	449.559	1.924	50	20	IDGD	
COc1ccc(C2=NO[C@H](CNC(=O)NNC(=O)c3cc(Br)c[nH]3)C2)cc1	802369797	NKHXRNQGNQPXTB-ZDUSSCGKSA-N	436.266	1.923	50	20	IDGD	
CCCCCCOc1ccc(C(=O)NNC(=O)NC2CC(NS(C)(=O)=O)C2)cc1	802418466	DLRBMGFMSUOQCC-UHFFFAOYSA-N	426.539	1.670	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1nc(Cc2ccccc2)cs1	806978930	NGRKCRJFFCPBQQ-UHFFFAOYSA-N	426.454	1.604	50	20	IDGD	
CC(C)(C(=O)NNC(=O)C(=O)Nc1ccc(F)c(N2CCCNC2=O)c1)c1ccccc1	806980518	YARSXSUEELWZOA-UHFFFAOYSA-N	441.463	1.809	50	20	IDGD	
CC(C)Cc1ccc([C@H](CNC(=O)NNC(=O)CNC(=O)c2ccco2)N(C)C)cc1	807601699	MEVAUJMBKXCPGK-SFHVURJKSA-N	429.521	1.841	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1nc2c(s1)CCCC2(C)C	810385220	ONGZOZDGGRDMAX-UHFFFAOYSA-N	432.502	1.931	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccccc2-n2cnc(C#N)n2)c1C	810385989	IDJXLCLQJCTRHJ-OAHLLOKOSA-N	447.455	1.309	50	20	IDGD	
O=C(CNS(=O)(=O)c1c(Cl)cccc1Cl)NNC(=O)COCc1ccccc1	810424489	RTKUMBVRHPNTNU-UHFFFAOYSA-N	446.312	1.636	50	20	IDGD	
Cc1nc2c(c(O)nn2C)c(C)c1CCC(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	812732723	RFUGGUCOESMZPO-UHFFFAOYSA-N	446.533	1.617	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccn(-c3ccccc3)n2)cc1	813033061	CDPFDOCWULZPKY-UHFFFAOYSA-N	428.474	1.204	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccc(OC3CCCC3)nc2)cc1	813033769	KPMGCSKMEZETHU-UHFFFAOYSA-N	447.517	1.735	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)[C@]3(C(F)(F)F)CCN(C(=O)OC(C)(C)C)C3)nc21	813451901	FNHJPTBJCPZABJ-INIZCTEOSA-N	445.402	1.702	50	20	IDGD	
CCOC(=O)Nc1scnc1C(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	813508768	MEQJEJTXCLZOSI-UHFFFAOYSA-N	425.854	1.442	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)C2CCC(OC[C@@H]3CCCO3)CC2)n1	815346949	QYRRMZIIYDZPMT-GPANFISMSA-N	439.534	1.439	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2F)cc1)[C@H]1C[C@@H]1C	815565178	FIXAAECYSDGNEI-UGSOOPFHSA-N	442.447	1.752	50	20	IDGD	
CCOC(=O)CN1C(=O)C(F)(F)c2cc(NC(=O)C(=O)NNc3ncccc3C)ccc21	815619255	HXCLOOSDRKGOFP-UHFFFAOYSA-N	447.398	1.473	50	20	IDGD	
Cn1nncc1NNC(=O)C1CCN(S(=O)(=O)c2cc(Cl)ccc2Cl)CC1	816770431	XKHINYPUVBAPBS-UHFFFAOYSA-N	433.321	1.666	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)c2cnn(C)c2I)cc1	816781651	RIXVYJUSBBEUAN-UHFFFAOYSA-N	449.274	1.032	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)c1ccc2c(c1)CCCN2S(C)(=O)=O	825636823	JPMMTGJWKOIAJP-UHFFFAOYSA-N	432.502	1.281	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)c1cccc(-c2nc(=O)o[nH]2)c1	857431046	ANAWMLDMCCDGIF-UHFFFAOYSA-N	436.472	1.003	50	20	IDGD	
O=C(c1ccc(Cl)c(S(=O)(=O)Nc2ccc(F)cc2)c1)N1CC[C@@H](B(O)O)C1	864234844	XAVMXFKKHRZCEG-GFCCVEGCSA-N	426.662	1.969	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)c(S(=O)(=O)NC[C@@H]2CCCO2)c1)c1ccncc1	912768617	HGNMZOAXRLXBPM-AWEZNQCLSA-N	438.893	1.267	50	20	IDGD	
C=CCNC(=S)NNC(=O)[C@@H](CCSC)NS(=O)(=O)/C=C\c1ccccc1	913435511	OFPQLNVWSUHOSK-VSKPTYQZSA-N	428.605	1.380	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)c1ccc(S(=O)(=O)NC(C)(C)C)o1	915189693	XXPCEXSXCIQICR-UHFFFAOYSA-N	447.517	1.730	50	20	IDGD	
COCCNS(=O)(=O)c1cccc(C(=O)NNC(=S)Nc2ccc(C)c(C)c2)c1	915598244	OTGXEPZBKPQPSO-UHFFFAOYSA-N	436.559	1.860	50	20	IDGD	
CC(=NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1ccc(C(=O)O)cc1	915939924	YUSOGDLXVPRFEZ-UHFFFAOYSA-N	431.470	1.560	50	20	IDGD	
CS(=O)(=O)N1CCC(NC(=O)NNC(=O)COc2ccccc2-c2ccccc2)CC1	916238100	WHRIMYFYSAFJNM-UHFFFAOYSA-N	446.529	1.487	50	20	IDGD	
Cc1nn([C@H]2CCS(=O)(=O)C2)c(Cl)c1C=NNC(=O)COc1ccccc1C#N	916322157	ORSITXRQTXPWFM-AWEZNQCLSA-N	435.893	1.605	50	20	IDGD	
COc1cc(OC)c(OC)cc1C=NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	916334917	RBXOXFSDEWYJDR-UHFFFAOYSA-N	427.866	1.777	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)N1CCCC[C@H]1C	916446914	DGQBXASUKSZGQP-UXHICEINSA-N	430.597	1.792	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)C2=Cc3ccccc3CC2)c1	916567466	IFSLVNMTTKIRAO-UHFFFAOYSA-N	435.527	1.488	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)NCCS(=O)(=O)Cc3ccccc3)n[nH]2)cc1	916636746	LBCFVPAWKNXKHU-UHFFFAOYSA-N	441.513	1.944	50	20	IDGD	
O=C(O)COc1ccc(S(=O)(=O)NNC(=O)c2ccc(F)cc2Br)cc1	917753359	HYPZYIFEBFJTKZ-UHFFFAOYSA-N	447.238	1.675	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)[C@@H]2CCCN(S(=O)(=O)c3ccc(F)cc3)C2)c(O)c1	918337130	CQCADEOZIKSSEF-CQSZACIVSA-N	435.477	1.702	50	20	IDGD	
COc1ccc([C@@]2(C)NC(=O)N(CC(=O)NNC(=O)Nc3ccccc3C)C2=O)cc1	918690951	MYODPIOARQOZAK-OAQYLSRUSA-N	425.445	1.624	50	20	IDGD	
C[C@H](Sc1ccc(Br)cc1)C(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1	919886323	REHWJTFNKXULMN-ONGXEEELSA-N	436.353	1.447	50	20	IDGD	
CNS(=O)(=O)c1ccc([C@@H](C)NC(=O)NNC(=O)CCc2ccc(OC)cc2)cc1	919909870	DPXKPBJKQTUMGM-CQSZACIVSA-N	434.518	1.628	50	20	IDGD	
Cc1ccc(N2CCC(C(=O)OCC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)CC2)nc1	920612732	YRKNYBCQRZMZKF-UHFFFAOYSA-N	441.444	1.519	50	20	IDGD	
N#C/C(=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)NCC(=O)NC1CC1	920848822	HWKGIXMFFWZPCC-NTEUORMPSA-N	440.891	1.381	50	20	IDGD	
CCNC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cc(C)c(C)c([N+](=O)[O-])c1	920858169	FGRSUTLVOMPVMZ-UHFFFAOYSA-N	435.462	1.976	50	20	IDGD	
CS(=O)(=O)Cc1ccc(CNC(=O)NNC(=O)c2cncn2-c2ccccc2)cc1	1317908219	RYUFVJKLKYNYQI-UHFFFAOYSA-N	427.486	1.561	50	20	IDGD	
COC(=O)C(=O)NNC(=O)NCCCCN1CCN(c2cccc(C(F)(F)F)c2)CC1	1318876980	NIJRYTFKPOKOIC-UHFFFAOYSA-N	445.442	1.111	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(CCC(=O)NNC(=O)c2cncn2-c2ccccc2)CC1	1321055087	HBYCNSAJJCBVHC-UHFFFAOYSA-N	442.520	1.576	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)C23C[C@H]4C[C@@H](CC(O)(C4)C2)C3)ccc1Cl	1321439186	TWDLMXXINKTXSR-BASMTZLZSA-N	427.910	1.080	50	20	IDGD	
CNS(=O)(=O)c1ccc(CC(=O)NNC(=O)c2cc(F)ccc2Br)cc1	1323861756	NPNXKSWDZFKUMJ-UHFFFAOYSA-N	444.282	1.500	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCCC[C@@H]2CCNC(=O)OC(C)(C)C)n1	1346251689	IBKYHHBPSCPJSE-OAHLLOKOSA-N	439.582	1.911	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)N[C@@H]2COc3c(F)cc(F)cc3C2)c2ccccc2c1=O	1346928678	BVAQJMYSKKKFLU-LBPRGKRZSA-N	429.383	1.159	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(-n3cccn3)nc1)C2)[C@H](F)Cl	1778029609	DAUPKERLSNHNME-OXFYSEKESA-N	435.887	1.929	50	20	IDGD	
CCOc1ccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)nn1	1780426003	CJIOBUCIBYVXCW-ZWKOTPCHSA-N	431.320	1.555	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc[n+]([O-])c1)C2	1781901557	QKFSVFCQSHQKIG-FRQCXROJSA-N	440.338	1.621	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Br)C2)[C@@H]1C[C@H]2CC[C@@H]1O2	1782022907	AEOBXEJLKVFWFW-TWEGOSIYSA-N	433.318	1.758	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)n2ccnc2C)C1	1782632397	VVKBHPAQZSDPOY-WVSUBDOOSA-N	426.945	1.520	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](O)CCl)C3)c1	1782993362	OOKJPQFUFYWEOZ-DBXWQHBBSA-N	437.924	1.372	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cc4ncsc4[nH]3)CCO2)C1	1783538657	VHHOTYITSSCPJI-QFYYESIMSA-N	427.324	1.851	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H]3C[C@@]34C(=O)Nc3ccccc34)C2)C1	1783541889	BZZNHSYEDITPFR-GMWOSMDTSA-N	445.947	1.991	50	20	IDGD	
O=C(c1cnc(C(F)(F)F)cn1)N1CCO[C@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783945187	DTKSTSPKBARXID-AWEZNQCLSA-N	427.210	1.743	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(C(=O)N2CCO[C@]3(CCN(C(=O)C(Cl)Cl)C3)C2)C1	1783948004	QWAODINOEWNRAG-SFHVURJKSA-N	436.336	1.487	50	20	IDGD	
C[C@H](CNC(=O)OC(C)(C)C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21	1784102251	VMUJSPYJYVXRSS-QTVXIADOSA-N	435.924	1.661	50	20	IDGD	
CC(C)[C@@H](O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C[C@@H]21	1784187311	DIFJBMZRYRLXRY-PEJPZTRWSA-N	447.482	1.868	50	20	IDGD	
O=C(/C=C/c1ccc([N+](=O)[O-])o1)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21	1784219435	BZMPASJKRBGXNG-PRPBNIASSA-N	432.260	1.984	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)[C@@H]3[C@H]4C=CS[C@H]43)CCC2)cc1)c1ccc(B(O)O)cc1	1788143389	AGYUUORKQMDYJN-VAMGGRTRSA-N	434.326	1.989	50	20	IDGD	
C[C@@H](Cn1ccnc1)C(=O)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1	1788149353	LHTSQLLDSXIGED-KRWDZBQOSA-N	446.316	1.647	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)[C@@H]1[C@H]2Sc3ccccc3[C@@H]21	1788618897	YDCNFYQLZXQADS-UJUUFAPJSA-N	436.961	1.454	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3Cc4ccccc4O3)C[C@@H]21	1788762479	BHRGJCSTDWPBSC-ZULIPRJHSA-N	432.593	1.821	50	20	IDGD	
COc1ccnc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)Br)C[C@@H]32)c1	1788892806	VISSUWLKHNYCGL-DSPQJCBJSA-N	426.311	1.467	50	20	IDGD	
Cc1ncncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)CBr)C[C@@H]21	1788969145	RPQMUQRLHCBDCL-MZGVZZPPSA-N	425.327	1.409	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]3C2)nc1	1789923077	RVHHGBOAGIKPOE-LVGORTOPSA-N	430.274	1.374	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnn4c3OCCC4)[C@H]2C1	1790372473	FZBDHGXAXKBWDI-DHMWGJHJSA-N	441.326	1.042	50	20	IDGD	
CCc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]3C2)nn1C	1791058836	IGKPLTMXGVNYRC-DSPQJCBJSA-N	427.343	1.359	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(F)cnc3Cl)C[C@@H]21	1791255021	ABSNVQYYDBRVAK-HPEDKQMDSA-N	434.295	1.721	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cncc4cnccc34)C[C@@H]21	1791255710	ZGDYOHWEXZSWOH-VKOGCVSHSA-N	432.908	1.477	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1c(Cl)cncc1Cl)c1cccc(B(O)O)c1	1792460719	XIYVDZFFRXBTAE-QDMKHBRRSA-N	448.115	1.634	50	20	IDGD	
C[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CO[Si](C)(C)C)C2	1792762035	MVSWDFBTBQCVSL-MPTYRVRUSA-N	443.617	1.341	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cn(C(C)(C)C)nn1)C2	1792872493	KQIWRXGGUVDBHV-GUIRCDHDSA-N	442.358	1.267	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C=C/C(=O)NCc1ccccc1	1792938745	ZRMUFOXUQNYZAN-UKLJKRKFSA-N	447.963	1.856	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(-c3ccc(O)nn3)cc1)C2)[C@H](F)Cl	1796366887	LCNIFKJEHCHQSO-DACLVMHWSA-N	434.855	1.587	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1nnsc1C1CC1	1796644648	RZNZOKHWCMDUCN-KXGXSXBTSA-N	429.340	1.402	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc2occc2c1	1797566381	KCWVNCKLRBXBIP-BJWYYQGGSA-N	433.468	1.997	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccnc1OCC1CC1)C2	1797954550	VOWJIXGSZLHHEW-XEMDLRDOSA-N	447.608	1.925	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc([N+](=O)[O-])c2c1OCO2)[C@H](O)CCl	1799341132	PCPJDUBSUGFDER-FBKDDSFISA-N	425.825	1.175	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1c[nH]c3ccccc13)C2)[C@H](F)Br	1799348308	GLUSIKVWUPPWGF-GGNLRSJOSA-N	438.297	1.991	50	20	IDGD	
CN(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C(C)(F)F)C2)NC(=O)NCc1ccccc1	1799864990	WOGJWMCKQVSOMV-BJWYYQGGSA-N	437.491	1.626	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](O)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@](C)(Cl)CCl)C2	1800600515	UVKBDHPZBFZAKX-WAPIYPGOSA-N	438.352	1.704	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C[C@H](N)c1cccnc1)C2	1800638940	DLKJUOCDVGSSNV-RIUYPTKQSA-N	439.354	1.235	50	20	IDGD	
Cc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)Br)cc2c[nH]nc12	1800762574	VKDUPQNOZYAXLB-FIUQPQMISA-N	435.322	1.858	50	20	IDGD	
NC(=O)c1ncccc1C(=O)NC[C@@H]1CCN(C(=O)C(Cl)Cl)[C@H]1c1cccnc1	1804817414	ULZUKQSLODJHGC-WFASDCNBSA-N	436.299	1.699	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@@H](CNC(=O)c2ncn(C)n2)[C@@H]1c1cccnc1	1805317961	JSEIGDVEWCYYIT-SNPRPXQTSA-N	435.326	1.561	50	20	IDGD	
Cc1ncoc1C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1805863046	UHQOYILSRRTYLU-QFBILLFUSA-N	428.493	1.071	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)c2ccccc2O)[C@H]1c1cccnc1)c1cccc(B(O)O)c1	1807369547	NPNKFGJFBSTKRX-GCJKJVERSA-N	445.284	1.100	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1808260799	XKNWHWCJYFEJMT-YTQUADARSA-N	429.713	1.098	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)[C@@H]2CCCS2(=O)=O)[C@@H]1c1cccnc1	1808277311	BTLAFVMUTRCLDN-LUKYLMHMSA-N	427.954	1.682	50	20	IDGD	
Cc1cc(NC(=O)CC(=O)N2CC[C@H](CNC(=O)[C@H](F)Cl)[C@H]2c2cccnc2)no1	1808312967	NXFYBAIVLAGJOS-XWIAVFTESA-N	437.859	1.947	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)c2ncc[nH]2)[C@H]1c1cccnc1	1808414445	IEJOZJCZEVLIOV-ISOPGZDOSA-N	448.487	1.258	50	20	IDGD	
O=C(CCBr)N1CCCC2(CCN(C(=O)c3nc[nH]c3[N+](=O)[O-])CC2)C1	1809065871	BKPOWHIOEPCKPN-UHFFFAOYSA-N	428.287	1.948	50	20	IDGD	
CN1CCN(CC(=O)NC[C@@H]2CCN(C(=O)CO[Si](C)(C)C)[C@H]2c2cccnc2)CC1	1809598333	HAFOIIYRFRKTNZ-UGKGYDQZSA-N	447.656	1.186	50	20	IDGD	
Cc1ccc(C(=O)N2CCC3(CCCN(C(=O)c4cccc(B(O)O)c4)C3)CC2)c(C)n1	1809978045	QHIUUOXQGTVAKU-UHFFFAOYSA-N	435.333	1.537	50	20	IDGD	
Cc1ccn(C)c1C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1811609938	BSPPXAWDMOKECD-PGRDOPGGSA-N	440.548	1.421	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2c3c(nn2C)CCC3)[C@@H]1c1cccnc1	1812227366	XGPZGHUUKIKXNM-AYBZRNKSSA-N	445.951	1.877	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)CCn2cncn2)[C@@H]1c1cccnc1	1813321758	PDUGSDAFXSDWCB-BQFCYCMXSA-N	449.353	1.943	50	20	IDGD	
COC(=O)[C@@H]1CC[C@H](C(=O)N2CCCC[C@@H]2c2cc(NC(=O)[C@@H](O)CCl)n[nH]2)C1	1814863980	DZZNMRODXHUJEF-MXYBEHONSA-N	426.901	1.591	50	20	IDGD	
N=C(N)SCCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](F)Br)CC2	1814950614	FBNFUBULHZWNRH-QUBYGPBYSA-N	438.348	1.762	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)C1CC(F)(F)C1)CC2)c1ccc(B(O)O)cc1	1815336055	ZBRQSBQFDNOAMM-CYBMUJFWSA-N	435.261	1.094	50	20	IDGD	
Cc1ccoc1C(=O)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1	1815354424	AMDHPQUVMPIJNP-CQSZACIVSA-N	425.275	1.264	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC[C@@H]1c1cc(NC(=O)C(F)(F)C(F)F)n[nH]1	1815542693	NTNRQFRAKVNXMJ-CYBMUJFWSA-N	442.178	1.296	50	20	IDGD	
NC(=O)c1ncccc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCBr)n[nH]1	1816782038	YMIDHYVSVSILLS-ZDUSSCGKSA-N	449.309	1.995	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2C[C@@H]2C2CC2)[nH]n1	1819401677	NOBBSRINFJUCCU-RKVPGOIHSA-N	437.504	1.760	50	20	IDGD	
COc1ccccc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1820438776	VLPGKLFZCTYPNW-IBGZPJMESA-N	448.288	1.718	50	20	IDGD	
O=C(N[C@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1)c1nc[nH]c1[N+](=O)[O-]	1823002173	ACGCJCMGYQBIMO-CDUCUWFYSA-N	447.246	1.691	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H]2CCCOC2)n[nH]1	1823468662	BWJLYPIZALJFGU-SUMWQHHRSA-N	441.492	1.141	50	20	IDGD	
CCS(=O)(=O)CC(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H](F)Br)CC1	1824468259	YICVDJRJWKVEHA-DZGCQCFKSA-N	441.363	1.731	50	20	IDGD	
COc1nn(C)cc1C(=O)N[C@H]1CCc2nc(NC(=O)[C@H](C)Br)sc2C1	1825637146	SXZRWKJYXQGXNK-IUCAKERBSA-N	442.339	1.894	50	20	IDGD	
O=C(COc1ccc(O)nn1)N[C@@H]1CCc2nc(NC(=O)C(Cl)Cl)sc2C1	1826103433	MQWXKALLDQEBNS-SSDOTTSWSA-N	432.289	1.433	50	20	IDGD	
C[C@@]1(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)CC1(F)F	1827060032	MSKVPURHPQYQCY-NQIIRXRSSA-N	434.292	1.645	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ncc[nH]2)CC1	1827680731	GMLOUIPSXQPCSM-CMPFEXHJSA-N	439.520	1.777	50	20	IDGD	
CCc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)n[nH]1	1830538986	XELLUCMGBKIYKH-UGSOOPFHSA-N	443.342	1.073	50	20	IDGD	
CCOC(=O)[C@@H]1CCC[C@H](C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)C1	1830701804	BCVRBQFNGMSERV-QCBUCWTNSA-N	448.919	1.347	50	20	IDGD	
Cc1ccc2cc(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)[C@@H](O)CCl)CCO4)ccc2n1	1830727816	GMVJNIKUAYMFMG-SIKLNZKXSA-N	447.919	1.213	50	20	IDGD	
O=C(CCCC(F)(F)F)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1832261611	LFUKCYBROGTWMC-JSGCOSHPSA-N	449.239	1.866	50	20	IDGD	
Cn1ncc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)c1C(F)(F)F	1833327175	XSSFDQHYQCVANG-IUODEOHRSA-N	442.797	1.043	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)c3cccn(C)c3=O)CC2)CC1	1833530461	YIFAVAURUNVADQ-LJQANCHMSA-N	436.984	1.978	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)c3cncn3C)CC2)CC1	1834242583	BUAJALLLDMNENH-AWEZNQCLSA-N	440.386	1.636	50	20	IDGD	
CCn1nccc1C(=O)NC1CCN(C2CCN(C(=O)[C@H](C)Br)CC2)CC1	1834278042	FTXVNYWRSLZHRI-AWEZNQCLSA-N	440.386	1.872	50	20	IDGD	
CC[C@@H](C(=O)N1CCOC[C@]2(CN(C(=O)CCBr)CCO2)C1)N(CC)CC	1834819784	UXSJQERDFQRZHJ-LPHOPBHVSA-N	448.402	1.348	50	20	IDGD	
Cc1nc(C(=O)N2CCC(OC3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)sc1C	1836718185	JLUSRYYAQFWDNW-INIZCTEOSA-N	429.970	1.972	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)C[C@H](NC)C(=O)O)CC2)CC1	1836918632	BAWKRVXNVHWMOU-SJORKVTESA-N	431.961	1.455	50	20	IDGD	
CN1CCN(CCC(=O)N2CCC(OC3CCN(C(=O)[C@H](F)Cl)CC3)CC2)CC1	1837806623	LIDROBXQVLOQLK-IBGZPJMESA-N	432.968	1.157	50	20	IDGD	
N=C(N)SCC(=O)N1CCC(OC2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1837827753	AWEXSRRPOZNQRJ-CYBMUJFWSA-N	439.351	1.302	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(C)nc3OC)CCO2)C1	1838172301	NVQJFHUSKAMPKM-LAUBAEHRSA-N	439.940	1.876	50	20	IDGD	
Cc1nc(F)ccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)Br)C2)C1	1838268631	RRAODRZBWZGHLD-KPZWWZAWSA-N	444.301	1.383	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H]3Cc4ccccc4N3)CCO2)C1	1839733332	CXPYHAYVGUYZCV-PGRDOPGGSA-N	435.952	1.745	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(F)cc3)C2)C1	1840034820	XWASQYMCHQJBTK-UGSOOPFHSA-N	429.286	1.679	50	20	IDGD	
COc1cc(F)cc(/C=C/C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)c1	1840084797	HDERDVJLVUXGQN-WSIKHEBHSA-N	444.862	1.838	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4c(c3)COC4)C2)C1	1840152613	NJSNZAWHESIELS-GHTZIAJQSA-N	438.908	1.041	50	20	IDGD	
C[C@H](Oc1ccccn1)C(=O)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1840427793	ROAWFBQCDPYUPG-SCLBCKFNSA-N	432.304	1.109	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3cnccn3)CCO2)C1	1840458057	JAXDBODGROVGDH-OALUTQOASA-N	445.347	1.102	50	20	IDGD	
C[C@H]1CC[C@H](C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)CC1	1840530729	IIZBDMBNOMACRY-XSWJXKHESA-N	435.334	1.960	50	20	IDGD	
Cc1cc(C)c(OCC(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)c(C)c1	1841529838	MCXGKPXUOOPJDY-UHFFFAOYSA-N	436.317	1.188	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H]2C[C@H](C(=O)N3CC4(CCCN4C(=O)[C@H](F)Cl)C3)O[C@H]2C1	1843366705	LOAZIBXOLXAUKH-KBXIAJHMSA-N	445.919	1.749	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)Cc1cnc(C)s1)C2	1843417338	YBPWLVLVFGGEAC-YDZHTSKRSA-N	428.518	1.331	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@]1(NC(=O)OC(C)(C)C)CCOC1)C2	1845166370	QSFLNPYJMOPSAO-VBKZILBWSA-N	429.945	1.891	50	20	IDGD	
Cc1ccc(/C=C/C(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)s1	1846582344	CSXZXKXABYBVHV-AATRIKPKSA-N	425.514	1.585	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CCSC(=N)N	1848099724	SUYRTKHYVOOCSZ-AVGNSLFASA-N	447.989	1.337	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)NC(C)C)cc2)cc1OC	15475817	SEUCRUAJCGLOPD-UHFFFAOYSA-N	435.502	1.855	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2cc(C3CC3)nc3c2c(C)nn3C)c2ccccc2c1=O	22976166	GKLFCIUKTQJQBP-UHFFFAOYSA-N	445.483	1.959	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccccc2)c1	116904300	DIHQCIJAJQFFCV-UHFFFAOYSA-N	433.530	1.965	50	20	IDGD	
CC(C)(C)OC(=O)NC1CCN(C(=O)NNC(=O)CNC(=O)c2cccs2)CC1	725872559	DTYVCQJVNFELTE-UHFFFAOYSA-N	425.511	1.208	50	20	IDGD	
CC[C@@H](NC(=O)NNC(=O)CNC(=O)c1cccs1)c1ccccc1OCC(=O)NC	725872578	DYCOKORIYNJIFF-CQSZACIVSA-N	447.517	1.084	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)[C@H](C)N2C(=O)NC3(CCCC3)C2=O)cc1OC	726522197	FSKREYHJNMFNSW-AWEZNQCLSA-N	446.504	1.888	50	20	IDGD	
COc1ccc(CN2C[C@@H](C(=O)NNC(=O)c3nn(-c4ccccc4)cc3O)CC2=O)cc1	726619813	PJBGQDRCPIUUMQ-INIZCTEOSA-N	449.467	1.396	50	20	IDGD	
Cc1cccc(Oc2ccc(S(=O)(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)cc2)c1	728509751	MACGSNZBALVUMD-ZDUSSCGKSA-N	427.504	1.035	50	20	IDGD	
CCN(CC)C(=O)c1ccc(C(=O)NNC(=O)c2nn(CC)c(=O)c3ccccc23)cc1	729299763	GUSCAKZHIVPLKR-UHFFFAOYSA-N	435.484	1.973	50	20	IDGD	
O=C(CCCNS(=O)(=O)c1ccc(F)cc1)NNC(=O)Cn1ccc2ccccc21	729540374	AUSSHSWGCGHIKP-UHFFFAOYSA-N	432.477	1.687	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)N[C@H](C)[C@H](C)N2CCOCC2)c2ccccc2c1=O	729624660	WMOYFYLMJNKYIM-CABCVRRESA-N	430.509	1.031	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)N2CCN([C@@H]3CCC[C@H]3O)CC2)N(C)c2ccccc21	730083399	KPRQJVAHJAUNEK-IFMALSPDSA-N	437.544	1.715	50	20	IDGD	
Cc1c(C(=O)NNC(=O)Cn2cnc3ccccc32)nnn1-c1cccc2cnccc12	731186714	PYTIWBUGQDWDTK-UHFFFAOYSA-N	426.440	1.935	50	20	IDGD	
CC(C)S(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1	731989617	MYDBTYJLHTWIJA-UHFFFAOYSA-N	449.508	1.475	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2ccc(-n3cnnn3)c(C)c2)cc1Br	732033245	PCYQIWVFSKAMFJ-UHFFFAOYSA-N	431.250	1.817	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N[C@@H](C)c2ccccc2)c1	732084365	BQJGBBVGBJOFCS-ZDUSSCGKSA-N	427.486	1.832	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cnc3nc(O)nc(O)c3c2)cc1Br	732176157	UCELKCULAADXPU-UHFFFAOYSA-N	434.206	1.282	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)CCCN2CCN(c3ccccc3)CC2)c2ccccc2c1=O	732257020	BLBUHHMSXBXPIA-UHFFFAOYSA-N	448.527	1.297	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)c2cnn(-c3ccccc3)c2)c2ccccc2c1=O	733774973	VQYKPOPUDQGIKF-UHFFFAOYSA-N	430.424	1.246	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)c2cn(Cc3ccccc3)nn2)CC1	734825432	ZTZAZOLZVFAZJN-UHFFFAOYSA-N	443.508	1.670	50	20	IDGD	
COc1cccc([C@H](C)C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)c1	735118321	RSOJJMFLIHZYLZ-HNNXBMFYSA-N	433.534	1.273	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)CNC(=O)c2ccc(C#N)cc2)cc1C	736807089	KWMOQJUVYUIFPU-UHFFFAOYSA-N	428.470	1.225	50	20	IDGD	
CC(C)c1ccc(N2CC[C@H](C(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)C2=O)cc1	741660839	OLCFEZTVXVGRAM-LJQANCHMSA-N	447.495	1.871	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)NC[C@@H]2CN3CCC[C@H]3CO2)cc1Cl	743593962	KHQBUWWMOZLLAJ-NWDGAFQWSA-N	427.889	1.556	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2ccc(CN3CCCC3=O)cc2)cc1	743830621	ZVBBJYBRHNZNSK-UHFFFAOYSA-N	430.486	1.679	50	20	IDGD	
Cc1nn(CC(C)C)c(C)c1CCC(=O)OCC(=O)NNC(=O)c1ccc(C#N)cc1	744526419	NYOXYXBYOICGGO-UHFFFAOYSA-N	425.489	1.965	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)NC[C@H](c1ccc(F)cc1)N1CCOCC1	746744570	RXXITNTZEOOMQF-LJQANCHMSA-N	440.479	1.420	50	20	IDGD	
COC[C@@H](Cc1ccccc1)NC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	746778785	FLDNWBSGUFKMSM-OAQYLSRUSA-N	439.560	1.787	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)C1CCN(c2ccc3nnc(C(F)(F)F)n3n2)CC1	747323758	OSGSDLBTGWIGNS-UHFFFAOYSA-N	448.409	1.145	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)c1ccccc1F)C(=O)NNC(=O)Cc1ccncc1	747428092	CUIZCRHDGTUPKC-HNNXBMFYSA-N	440.522	1.011	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1Cl	748641550	ZTYLTTBMPIXPQL-UHFFFAOYSA-N	425.850	1.693	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2cc(OC)c(C(=O)O)cc2Cl)c(OC)c1	749140915	COBTYLQPYBDMCL-UHFFFAOYSA-N	444.849	1.687	50	20	IDGD	
COc1ccccc1NC(=O)CN1CCN(CC(=O)NNC(=O)c2ccc(C)cc2)CC1	750228383	IVBYNQSDGHXEBY-UHFFFAOYSA-N	439.516	1.021	50	20	IDGD	
O=C(NNC(=O)N1CCOCC1)c1sccc1S(=O)(=O)NC1CCCCCC1	751387433	SVPCXWLXIZTDFJ-UHFFFAOYSA-N	430.552	1.436	50	20	IDGD	
C[C@H]1CCC2=S=C(C(=O)NNC(=O)c3ccc(N4CCCS4(=O)=O)cc3)C=C2C1	751443143	SJWKCLHERNHVAY-ZDUSSCGKSA-N	433.555	1.826	50	20	IDGD	
Cc1ccc(Cl)cc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	752997490	NFSQITCMQHZVDE-UHFFFAOYSA-N	437.905	1.744	50	20	IDGD	
COc1ccc(C(=O)CNC(=O)CCC(=O)NNc2ccc(C(F)(F)F)nn2)cc1	755189502	LZTYSMGDPLCYRI-UHFFFAOYSA-N	425.367	1.726	50	20	IDGD	
CCOc1cc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)ccc1OC	755965775	PRQCLOHKYRGTBD-UHFFFAOYSA-N	436.490	1.811	50	20	IDGD	
CC(C)CNC(=O)c1ccc(NC(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)cc1Cl	756110521	NLMQULQSGSZEIP-LLVKDONJSA-N	430.914	1.313	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)nc1)Nc1ccc(N2CCN(C(=O)C3CC3)CC2)nc1	756296400	ZJGLDTDQAIBDEK-UHFFFAOYSA-N	443.895	1.655	50	20	IDGD	
Cc1c(CS(C)(=O)=O)cccc1NC(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	756598702	WJBGFDCVCVQITC-UHFFFAOYSA-N	443.485	1.897	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)COc2cccc(C(F)(F)F)c2)cc1S(N)(=O)=O	756639096	WTAJILWFMMWTIP-UHFFFAOYSA-N	446.407	1.893	50	20	IDGD	
CC1(C)CCCC[C@H]1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	757751339	SNHHYLHDPJRYKI-QGZVFWFLSA-N	438.550	1.620	50	20	IDGD	
COCCS(=O)(=O)c1ccc(CNC(=O)NNC(=O)COc2cccc(C)c2)cc1	758856178	RXTHGEOAUHISJC-UHFFFAOYSA-N	435.502	1.325	50	20	IDGD	
O=C(N=c1cc[nH]cc1I)NNC(=O)[C@H]1COc2ccccc2O1	760028377	HZIOYAMOOJZHPK-CYBMUJFWSA-N	440.197	1.101	50	20	IDGD	
CC1(C)C(=O)N(C[C@](C)(O)C(=O)NNC(=O)c2cc(Br)c[nH]2)c2ccccc21	760073387	IANFMSQCVJHHOD-IBGZPJMESA-N	449.305	1.614	50	20	IDGD	
CCO[C@@H]1C[C@@H](NC(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)[C@@]12CCCO2	760140949	DXBRYUABVDDGKC-RKVPGOIHSA-N	427.527	1.121	50	20	IDGD	
CC(C)(C)C(=O)NNC(=O)C(=O)Nc1ccc(S(=O)(=O)NC2=NCCCCC2)cc1	761071413	GDEVVDANBDDPFW-UHFFFAOYSA-N	437.522	1.069	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)C(=O)Nc2ccc(CN3C(=O)CCCC3=O)cc2)c1	761073613	UZOVYVJFBGFTDV-UHFFFAOYSA-N	438.440	1.594	50	20	IDGD	
CN1C(=O)COc2ccc(NC(=O)C(=O)NNC(=O)c3ccccc3Br)cc21	763483013	LGCWGPPFKZYBFC-UHFFFAOYSA-N	447.245	1.204	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cc(C#N)ccc2Cl)cc(OC)c1OC	763538618	FAEQXDCDYDEPBL-UHFFFAOYSA-N	432.820	1.637	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(OC[C@H]3CCCO3)c2)cc1OC	763550794	RRRHXLMFPXSAMY-QGZVFWFLSA-N	443.456	1.661	50	20	IDGD	
CCCNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)COc2cc(C)cc(C)c2)c1	763645743	YYGDBPHBXZFPNJ-UHFFFAOYSA-N	426.473	1.608	50	20	IDGD	
CO[C@]1(CNC(=O)NNC(=O)[C@@H]2Cc3ccccc3CN2Cc2ccccc2)CCOC1	763646804	JYDPNBJVNGLXCG-URXFXBBRSA-N	438.528	1.749	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2cc(N3CCOC3=O)ccc2C)c1	763649936	MZIUCYUTWDXDSH-UHFFFAOYSA-N	440.456	1.733	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(OC[C@@H]3CCCO3)c2)cc1	763658731	ARGGMEMQXKFKNU-IBGZPJMESA-N	443.456	1.418	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(C(=O)N(C)OC)cc1	763717510	XAQJWKGXXDNZEV-UHFFFAOYSA-N	428.445	1.047	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)C(=O)Nc1ccccc1C(F)(F)F	763804654	OJRRXRWGFOXQKX-UHFFFAOYSA-N	426.307	1.779	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(Cl)c(C(N)=O)c2)c1C	763851154	QYSNYUALHAMEFW-GFCCVEGCSA-N	432.864	1.609	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)C(=O)NCC2	763853337	KGWZZQLITIFQKS-AWEZNQCLSA-N	446.463	1.679	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)oc(=O)n2C	763855335	VNPFFQFXDBSIGI-CYBMUJFWSA-N	448.435	1.838	50	20	IDGD	
CCc1nnc(-c2cccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc3ccccc3F)c2)o1	763856282	GOQXLMOEPWVEIL-LBPRGKRZSA-N	441.419	1.992	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cnn(CC(F)F)c2)cc1	763861088	MIKCHDOUOSFQHE-NSHDSACASA-N	425.392	1.100	50	20	IDGD	
CS(=O)(=O)c1c(Cl)cccc1NC(=O)C(=O)NNC(=O)Cc1c[nH]c2ccccc12	763864434	AHOVXWFZOJQEQL-UHFFFAOYSA-N	448.888	1.553	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)Cc2c[nH]c3ccccc23)cnc1Br	763864972	FYSLQYZIGVETCZ-UHFFFAOYSA-N	430.262	1.962	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cc3c(cc2C)OCO3)cc1	763875918	BQUUDVDBDMFBGY-CYBMUJFWSA-N	427.413	1.480	50	20	IDGD	
COC(=O)c1cccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(C(C)=O)cc2)c1	763878348	PARCXGAJXGQXJO-ZDUSSCGKSA-N	427.413	1.229	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccc(CCC(=O)N2CCCC2)cc1	763931421	GHQHIJPGRCRVRO-UHFFFAOYSA-N	440.475	1.709	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)c2cccn2C)sc2c1CCCCC2	763999163	PXJOQPSFWCEPGI-UHFFFAOYSA-N	432.502	1.932	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1cccn(Cc2ccccc2)c1=O	764004429	VWPWKIIZHNNREC-UHFFFAOYSA-N	448.435	1.068	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1	764040422	HPMFHNWMWQDULT-KBPBESRZSA-N	444.463	1.848	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1cccc(CS(=O)(=O)C(C)C)c1	764049404	YTZRZJQCPYYDHP-UHFFFAOYSA-N	433.486	1.418	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cc(C)[nH]n2)n(-c2cccc(Br)c2)n1	764106502	LUSGNQSNNBOEOQ-UHFFFAOYSA-N	446.265	1.374	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cccc(-n4cnnn4)c3C)n[nH]2)cc1	764112329	VXGMFVVKFFYSJR-UHFFFAOYSA-N	445.443	1.069	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccnn2Cc2ccccc2)o1	764138094	AVCAWZJMWLDVCO-UHFFFAOYSA-N	438.488	1.766	50	20	IDGD	
CCCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)cc1Cl	764154712	TZZXEKRGGKGWCN-KRWDZBQOSA-N	444.875	1.569	50	20	IDGD	
CC(C)n1nnnc1-c1ccccc1NC(=O)C(=O)NNC(=O)CCOc1ccccc1	764165979	BPRNPARVSMSHCR-UHFFFAOYSA-N	437.460	1.476	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2O1)C(=O)Nc1cc(F)c(Br)c(F)c1	764167558	KUGWNOCDUDNJRL-CYBMUJFWSA-N	440.200	1.817	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2O1)C(=O)Nc1ccc(N2CCCC2=O)c(Cl)c1	764167863	NASFOGGHUVXTLG-QGZVFWFLSA-N	442.859	1.556	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccn(-c3ncccc3C(F)(F)F)n2)c1	764234836	LCGBICRUXISGIY-UHFFFAOYSA-N	443.345	1.557	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)C(=O)Nc1cccc(N2CCCCC2=O)c1	764242289	CTAWOEPALAQPKB-UHFFFAOYSA-N	433.468	1.944	50	20	IDGD	
CNC(=O)CCOc1ccc(NC(=O)C(=O)NNC(=O)c2cccc3ncccc23)cc1	764257790	NLFQTQVMFBCNHR-UHFFFAOYSA-N	435.440	1.149	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)C(=O)Nc1ccc(OC[C@H]2CCCO2)cc1	764277290	AZCIHUVMYGCHDD-GOSISDBHSA-N	427.457	1.669	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)C2CCC2)cc1NC(=O)c1cccc(F)c1	764334311	COBGJQGBMAGLBD-UHFFFAOYSA-N	428.420	1.973	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)C(=O)Nc1ccc(SC(F)F)nc1	764351999	WAYRELLYIOEHQK-UHFFFAOYSA-N	432.412	1.982	50	20	IDGD	
COc1ccc(CN(C)C)cc1NC(=O)C(=O)NNC(=O)CSc1ccccc1OC	764398505	SXDYHIOHBDJLOE-UHFFFAOYSA-N	446.529	1.644	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)N[C@H]1CCN(c2ccc(Cl)c(F)c2)C1=O	764510850	DNPWMEHRDRIUEX-INIZCTEOSA-N	444.854	1.805	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)cn1	764519632	UBAXWPZBPMDHPY-UHFFFAOYSA-N	448.980	1.879	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNc2cc(C)ncn2)cc(Br)c1F	764672323	HAOQZAQCMXBSED-UHFFFAOYSA-N	426.202	1.555	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NN=Cc1ccc(N2CCOCC2)s1	764826849	BUKVZPOAPXTZKC-UHFFFAOYSA-N	441.557	1.493	50	20	IDGD	
CCOC(=O)NNC(=O)C(=O)Nc1cccc(C(=O)N2CCc3sccc3C2)c1C	765394837	FKEUOFIUJDXZPS-UHFFFAOYSA-N	430.486	1.971	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2ccc(C)c(C(=O)NNC(=O)c3cc(C)[nH]n3)c2)cc1	765586339	DKSKMANDOUWYLM-UHFFFAOYSA-N	443.485	1.911	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)CN1C(=O)[C@H](C)Oc2ccccc21	767277272	DKYQZGYUXAGCTC-HNNXBMFYSA-N	425.441	1.042	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)C[C@@H]1CN(Cc2ccccc2)CCO1	767346975	ZODWZPVGPKCEBW-OAQYLSRUSA-N	439.512	1.519	50	20	IDGD	
O=C(C/N=C1/NS(=O)(=O)c2ccccc21)NNc1ccc(C(F)(F)F)cc1[N+](=O)[O-]	767852142	QECOGQUUUSNXIV-UHFFFAOYSA-N	443.363	1.795	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(F)cc2C(=O)N(C)C)cc1OC	768239201	VSULVNMJRZLEQT-UHFFFAOYSA-N	446.435	1.335	50	20	IDGD	
O=C(NNC(=O)c1cc2ccccc2o1)C(=O)Nc1cc(C2CC2)nn1-c1ncccn1	768241240	FIYVNHDGMRKFGE-UHFFFAOYSA-N	431.412	1.686	50	20	IDGD	
CC(C)(O)C(=O)NNC(=O)c1occc1CS(=O)(=O)c1ccc(Br)cc1	768245898	WMNLZGJUEFZCPJ-UHFFFAOYSA-N	445.291	1.548	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)Cc3c(C)nc(C)nc3O)n[nH]2)cc1OC	768279768	RUMMICAQCCZPLL-UHFFFAOYSA-N	426.433	1.210	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCc2cccc3c2OCCCO3)c2ccccc2c1=O	770426261	NOAYIMPCCVUUBD-UHFFFAOYSA-N	437.456	1.722	50	20	IDGD	
O=C(NNc1ccnc(Br)c1)c1ccccc1S(=O)(=O)N1CCOCC1	771552825	PHDZBSPZEJHNGL-UHFFFAOYSA-N	441.307	1.622	50	20	IDGD	
Cc1cc(=O)c(C(=O)O[C@H](C)C(=O)NNC(=O)CC(C)C)nn1-c1cccc(Cl)c1	772156979	UOKCWBQAUZEPGI-CYBMUJFWSA-N	434.880	1.933	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)C[C@@H]2CSCCN2C(=O)OC(C)(C)C)cc1	772389391	USFOXHAGEWWHAN-OAHLLOKOSA-N	438.550	1.997	50	20	IDGD	
CC(C)NC(=O)N1CCC[C@H]1C(=O)NNC(=O)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	773420173	WYWSTXPPNMSYOK-CABCVRRESA-N	425.530	1.363	50	20	IDGD	
CCOC(=O)c1c(NC(=O)NNc2cccc(S(C)(=O)=O)c2)c(C#N)cn1CCOC	775766630	AZLFVZPYDUHWLM-UHFFFAOYSA-N	449.489	1.735	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)[C@H](O)Cc2cccc(C(F)(F)F)c2)c2ccccc2c1=O	778292742	DCNAKNIJTWYDGO-OAHLLOKOSA-N	434.374	1.317	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)c3cc(S(=O)(=O)N(C)C)cn3C)n[nH]2)cc1	778603071	UEYAGPSXKWDPOH-UHFFFAOYSA-N	430.490	1.049	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2ccc(OC(C)(C)C)nc2)c1	779408532	VBCLMHJGJYHZSJ-UHFFFAOYSA-N	449.533	1.653	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(S(=O)(=O)C(F)(F)F)cc1)c1ccccc1F	780366677	WTDUKOBXNUZDDB-UHFFFAOYSA-N	426.369	1.743	50	20	IDGD	
Cn1c(CCC(=O)NN=c2cc[nH]cc2)nc2cc(S(=O)(=O)N3CCCCC3)ccc21	780761284	NEPNYPNBCYSRNW-UHFFFAOYSA-N	442.545	1.641	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)CCCCNC(=O)OC(C)(C)C)c1	781666161	LGNYAJJYLCMUSO-UHFFFAOYSA-N	442.538	1.393	50	20	IDGD	
CC(C)[C@H]1CN(CC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)CCN1C(=O)OC(C)(C)C	781988556	LQBAXGNLHOFVKY-QGZVFWFLSA-N	449.508	1.933	50	20	IDGD	
CC(C)(C)c1nsc(Oc2ccc(NC(=O)C(=O)NNC(=O)CO)cc2Cl)n1	782123139	BJZLWUAPMHJVPY-UHFFFAOYSA-N	427.870	1.360	50	20	IDGD	
CN(C)C1CCN(c2ccc(NC(=O)C(=O)NNC(=O)c3ccc(O)cc3)cc2)CC1	782832688	RPLPFJYCHLQMQO-UHFFFAOYSA-N	425.489	1.322	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)cc1)C(=O)Nc1ccc(-c2noc(C(F)(F)F)n2)cc1	782837615	PBWPNQJJVGSHMW-UHFFFAOYSA-N	435.318	1.861	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2ccc(Oc3ccc(Cl)cn3)cc2)CCS(=O)(=O)C1	783423974	CFHTXZWYEFWHOG-GOSISDBHSA-N	438.893	1.664	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2ccc(NC(=O)C(=O)NNc3ccccc3)cc2)C[C@@H](C)O1	784765007	KZVWFQRJSIRQAL-GASCZTMLSA-N	432.502	1.566	50	20	IDGD	
Cc1ccc([C@@]2(C)NC(=O)N(CC(=O)Nc3cccc(NC(=O)NN(C)C)c3)C2=O)cc1	788253879	LHUCGJNOXCUTLU-JOCHJYFZSA-N	438.488	1.999	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)c(C)cc1C	788330093	DFKIZBACOGSUPY-CYBMUJFWSA-N	431.420	1.783	50	20	IDGD	
O=C(NNc1cccc(F)c1[N+](=O)[O-])[C@H]1CN(Cc2nc(O)c3ccccc3n2)CCO1	791067585	VRSBPEVAVUACLR-MRXNPFEDSA-N	442.407	1.727	50	20	IDGD	
COc1ccc(OC)c(C2=NO[C@@H](C(=O)NNC(=O)[C@H](C)Oc3ccccc3F)C2)c1	791461390	ZMHFQJKUMRAVDA-HXPMCKFVSA-N	431.420	1.951	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(OC)c(NC(=O)NNc2nc3ccccn3n2)c1	792209610	RBWXNQDRDNOZKP-UHFFFAOYSA-N	433.494	1.917	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2nc3ccccn3n2)cc(N2CCN(C(C)C)CC2)c1	792395088	OTDUBYGPZZNWKU-UHFFFAOYSA-N	436.520	1.650	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@@H]2[C@H]3[C@H]4C[C@@H]5[C@@H]6[C@H]4[C@H]2[C@@H]6C[C@H]53)cc1	792804878	YDAZGNSULVEHSD-IVIFUQJSSA-N	429.542	1.157	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)C(=O)Nc1cccc(-c2cccc(Cl)c2)c1	793022350	VZSQEOBFJUIMQW-AWEZNQCLSA-N	435.889	1.528	50	20	IDGD	
COc1ccc(N2C[C@@H](C(=O)NNC(=O)C(=O)Nc3ccc(C)cc3)CC2=O)c(OC)c1	793212976	NTIQAUSCULPHIR-AWEZNQCLSA-N	440.456	1.151	50	20	IDGD	
CCOC(=O)c1cc(S(=O)(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c(F)cc1C	795280791	MUGWKAJOZRBDDY-INIZCTEOSA-N	438.433	1.460	50	20	IDGD	
C[C@H]1CN(Cc2csc(NC(=O)NNc3ccc(-n4ccnc4)nn3)n2)C[C@@H](C)O1	796656092	QTNVADIJUYIPJI-BETUJISGSA-N	429.510	1.877	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)ccc1Cl	798322903	MXDQAVOSVRDDIX-UHFFFAOYSA-N	444.922	1.185	50	20	IDGD	
COC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2cccc(N(C)C)c2)c1OC(C)C	799257699	PWPGMTDRYLRCCJ-UHFFFAOYSA-N	442.472	1.726	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)NCc2cccc(CS(N)(=O)=O)c2)c1C	800718030	ZIOUPHMYMBAAPS-HNNXBMFYSA-N	434.518	1.390	50	20	IDGD	
COc1ccc(Cl)c(NC(=O)NNC(=O)C/N=C2/NS(=O)(=O)c3ccccc32)c1	802116183	UHBHVWOBJPBNDE-UHFFFAOYSA-N	437.865	1.240	50	20	IDGD	
O=C(NC[C@@H](c1ccc(F)cc1)N1CCOCC1)NNc1ccc(-n2ccnc2)nn1	804859286	PWSOHDSHSUNCTF-KRWDZBQOSA-N	426.456	1.501	50	20	IDGD	
O=C(COc1cccc(C(F)(F)F)c1)NNC(=O)C(=O)Nc1cc2n(n1)CCCC2	806973380	NUKZQIIEGAMILB-UHFFFAOYSA-N	425.367	1.403	50	20	IDGD	
CN1CCN(C(=O)c2ccc(NC(=O)C(=O)NNc3nccnc3C3CCC3)cc2)CC1	807460634	SPHAIRCZCDJCRL-UHFFFAOYSA-N	437.504	1.214	50	20	IDGD	
CC(C)CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)NNC(=O)c1cc(Br)c[nH]1	809972015	BPIACGBYMWNYHT-CYBMUJFWSA-N	425.287	1.035	50	20	IDGD	
COc1cc(F)c(F)cc1NC(=O)C(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	810385263	ZCCQCNFAIWHEJZ-UHFFFAOYSA-N	431.355	1.264	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2ncc(F)cn2)c(C(=O)NCC(F)(F)F)cc1F	810396037	SKDZRMWUXGYGKG-UHFFFAOYSA-N	432.309	1.437	50	20	IDGD	
COc1ccc(S(=O)(=O)NCC(=O)NNc2nc3ccccc3cc2C)cc1OC	810919701	MDCQQZLTVWIQBR-UHFFFAOYSA-N	430.486	1.982	50	20	IDGD	
Cc1cc(NC(=O)[C@@H](C)SCC(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)no1	812728831	BBMCVOQGTYRVCH-GFCCVEGCSA-N	441.535	1.437	50	20	IDGD	
C=CCNS(=O)(=O)c1ccc(C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)cc1	812732500	JMGSIMNLFUGWLJ-UHFFFAOYSA-N	438.531	1.158	50	20	IDGD	
CC(C)(C)OC(=O)N1CCOc2ccc(NC(=O)C(=O)NNc3ncccn3)cc2C1	812981254	RUNIBBTVKXJPGJ-UHFFFAOYSA-N	428.449	1.688	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)c2cccnc12	813033062	CJNLWABAEQKOCP-UHFFFAOYSA-N	427.486	1.875	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@H](F)C[C@H]1CNC(=O)NNC(=O)COc1ccccc1O	813812484	WKOIMZAADPFRMN-STQMWFEESA-N	426.445	1.449	50	20	IDGD	
Cc1nc(-c2ccccc2NC(=O)C(=O)NNC(=O)[C@H]2CCc3nncn3C2)cs1	815691024	CPSBXGYCCCGHFB-LBPRGKRZSA-N	425.474	1.059	50	20	IDGD	
CC(C)NC(=O)c1ccc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)N(C)C)cc1	815752111	COUDZJGESVQOGM-UHFFFAOYSA-N	447.517	1.157	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)C(=O)Nc2ccc(N(C)C)nc2)c1	815866217	SZUZQKDUAMOOCI-UHFFFAOYSA-N	436.266	1.779	50	20	IDGD	
CC(C)[C@@H](NC(=O)NCc1ccc(F)cc1)C(=O)NNC(=O)c1ccc2c(c1)OCCO2	913897868	DDZJMROLXBTXFA-LJQANCHMSA-N	444.463	1.882	50	20	IDGD	
Cc1noc(CCCC(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)n1	915109583	LJRYVUVAGNQYIV-UHFFFAOYSA-N	446.471	1.864	50	20	IDGD	
COc1c(F)cc(CC(=O)NNC(=O)c2cc(-c3ccccc3)on2)cc1S(N)(=O)=O	915596718	XEIXCEOZQBHXKI-UHFFFAOYSA-N	448.432	1.140	50	20	IDGD	
O=C(Cc1nn2c(C3CCCCC3)nnc2s1)NN=C1C(=O)Nc2cc(O)ccc21	915947921	JPWUYRAFFNVOMR-UHFFFAOYSA-N	425.474	1.954	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)NCc1ccnc(OCC(F)(F)F)c1	916396908	NFQHKJHHDYLKBT-UHFFFAOYSA-N	443.338	1.840	50	20	IDGD	
C[C@@H]1C[C@@H](C)CN(CCCCNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)C1	916506125	YKTLSZSCXCOUFL-HZPDHXFCSA-N	438.598	1.682	50	20	IDGD	
CSCC[C@H](NC(=O)c1ccccc1)C(=O)NNC(=O)C(=O)Nc1ccc(C)c(C)c1	916561817	GKJFBWLUCUIEQP-SFHVURJKSA-N	442.541	1.941	50	20	IDGD	
O=C(NCc1cc(Cl)c2c(c1)OCCO2)NNC(=O)c1nnc(O)c2ccccc12	916628234	HINJYCWOHFLLMZ-UHFFFAOYSA-N	429.820	1.904	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@H](C)S(=O)(=O)c2ccc(F)cc2)cc(OC)c1OC	917905134	DSFMAGPAGCIKQH-NSHDSACASA-N	440.449	1.475	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)[C@H]2CCCN(C(=O)CCOc3ccccc3)C2)n1	918550270	FWDZKAPWRMRYBH-SFHVURJKSA-N	427.505	1.355	50	20	IDGD	
CNC(=O)NNC(=O)[C@H](CCSC)NS(=O)(=O)c1ccc(Cl)c(Cl)c1	919877976	WHPNAMVFKKRNIT-NSHDSACASA-N	429.351	1.354	50	20	IDGD	
Cc1cccc(C)c1OC[C@@H](C)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	919923267	FHPYXSBWXPSGFY-MRXNPFEDSA-N	448.545	1.965	50	20	IDGD	
O=C(CN1CCCC1=O)NNC(=O)C[C@](O)(c1nc2ccccc2s1)C(F)(F)F	920435513	ISFRFDWCCAROHV-INIZCTEOSA-N	430.408	1.206	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)c1cc([N+](=O)[O-])ccc1N1CCOCC1	920813434	VRQHKKLTRPEXCH-CYBMUJFWSA-N	432.408	1.799	50	20	IDGD	
CCCC[C@@H](/N=C1/NS(=O)(=O)c2ccccc21)C(=O)NNC(=O)NCc1ccco1	920858308	MMUFDDYWYCNGDB-OAHLLOKOSA-N	433.490	1.408	50	20	IDGD	
Cc1nn(C)c(Br)c1C(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1	1256638238	BDEVYONQEVVMGC-UHFFFAOYSA-N	444.330	1.899	50	20	IDGD	
CCS(=O)(=O)CCOc1ccc(S(=O)(=O)NNC(=O)c2ccc(OC)cc2)cc1	1318056349	HMHJEQHKUJOQLJ-UHFFFAOYSA-N	442.515	1.132	50	20	IDGD	
COC(=O)c1cc(CNC(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)oc1C	1322976037	PBWXWLRUGLQVGN-UHFFFAOYSA-N	438.481	1.852	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnc4cc(C)ccn4c3=O)C2)C1	1777999410	ZROZLMDAIDFORU-HRAATJIYSA-N	432.908	1.464	50	20	IDGD	
O=C([C@@H]1CN(Cc2ccccc2)CCO1)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Cl)CCO2	1778277389	YVUYNUZBMVHCGO-BBTUJRGHSA-N	439.915	1.252	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(CCN(C(=O)CS[C@@H]3CCCCO3)C2)C1	1779078215	NTYXEVJYTHTANE-SJORKVTESA-N	435.384	1.861	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](COC(C)=O)OC(C)=O)C1	1779404926	NYTYLVJZZFWAIN-MIALQEHNSA-N	446.928	1.013	50	20	IDGD	
Cc1[nH]nc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CO[Si](C)(C)C)C2)c1F	1779540393	IDZAYSYODQXRQM-AUUYWEPGSA-N	426.565	1.836	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Br)C1)N1C[C@H]2C[C@H]2C1	1780775040	VHRMKDCHUFYHNV-WLQXYJQWSA-N	446.361	1.531	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C2(C(=O)OC)CC2)C1	1781813843	PHVVAPBNNHXWLA-PMUMKWKESA-N	445.354	1.627	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)Br)C1	1782002936	XUNRMXOPVUKCEC-BRXULGCHSA-N	425.751	1.538	50	20	IDGD	
Cc1cc(F)c(F)c(C(=O)N2CC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c1	1782073091	QKWBEQSMRIPOPC-NRFANRHFSA-N	438.475	1.090	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(C)nc(O)c1)C2	1782173144	YPPPRPMWRDKBMO-JXXFODFXSA-N	425.913	1.477	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ncc(F)cc3F)CCO2)C1	1783342499	JGYILXGBEQNBHV-PXAZEXFGSA-N	432.265	1.977	50	20	IDGD	
Cc1nn(C)c(C)c1CC(=O)N1CCO[C@]2(CCN(C(=O)[C@H](C)Br)C2)C1	1783538390	CIMLJPKFNNKAQA-KPZWWZAWSA-N	427.343	1.193	50	20	IDGD	
CC(=O)NCC(C)(C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]2C1	1783964712	ZEKZKFINYLRAAH-TUUVXOQKSA-N	446.386	1.159	50	20	IDGD	
Cc1cc2nc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]4C3)[nH]c2cc1C	1784091810	CQGLXBRSYLMJOK-ZZCKCESHSA-N	434.924	1.373	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3CCCCN3C)[C@H]2C1	1784121614	WARLIKFYJBUDFE-KSWRQPAISA-N	430.387	1.624	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)Cc3cc(F)ccc3[N+](=O)[O-])C2)C1	1785533631	XTNACJLXUDYMFP-BEFAXECRSA-N	443.859	1.360	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]2C1	1787449337	JKJQNOMDXWNABA-UVPYHEFZSA-N	447.935	1.900	50	20	IDGD	
Cc1cnn([C@H](C)C(=O)NC2(c3ccc(NC(=O)c4ccc(B(O)O)cc4)cc3)CCC2)c1	1788143574	ONEUVKIJBQEPME-QGZVFWFLSA-N	446.316	1.880	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(O)nc3)[C@H]2C1	1789300803	HJRKFFQOIJQRQQ-XQLPTFJDSA-N	426.311	1.554	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC1(c2ccc(NC(=O)c3ccc(CO)o3)cc2)CCC1	1789767161	ASFJJKRIPGUKKX-UHFFFAOYSA-N	428.489	1.893	50	20	IDGD	
CC[C@@H](Cl)C(=O)Nc1ccc(C2(NC(=O)CN3CCS(=O)(=O)CC3)CCC2)cc1	1790487573	CZKSSACEXFQNHA-QGZVFWFLSA-N	441.981	1.868	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(O)c(F)c3)C[C@@H]21	1791060969	NHKSABXRSWJAGA-LESCFKLSSA-N	429.286	1.908	50	20	IDGD	
Cc1ccc(C(=O)C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Br)C[C@@H]32)cc1	1791173442	CJWBVYKZNYTTNN-JKQORVJESA-N	441.297	1.848	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3CCC[C@@H](C(=O)OC)C3)[C@H]2C1	1791247587	LPKHKTYUHMIZBN-COZGXFGHSA-N	444.956	1.199	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCCn3ccnc3)[C@H]2C1	1791559665	FCTOGZBMTUZEMP-QAETUUGQSA-N	441.370	1.674	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccccc1C(N)=O)C2	1792874646	WBLSODBDWVSGNP-JFILPPLUSA-N	438.322	1.020	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(S(C)(=O)=O)cn1	1794749803	NXCAOGNYCXPIRO-YFQWEKLQSA-N	448.372	1.973	50	20	IDGD	
CC(C)(C)OC(=O)CCCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCBr	1795112964	HZAYBEFLCMOTAO-ZSBFGKGUSA-N	447.370	1.873	50	20	IDGD	
N#Cc1ccc(CCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)cc1	1796189553	BKWHXHSGHQOURM-KOUNCHBCSA-N	431.301	1.123	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2)c1cc(N2CCCC2)ccn1	1796583474	CYQOOYWPMJVWRS-YWVIFJGQSA-N	427.332	1.689	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](C)c1ccccn1)C2	1796893213	RTXFRKSYXVSUKC-LVJSKEACSA-N	436.516	1.957	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C#CC1CC1)C2	1798521507	LRCSOEDNNDOPSS-VPTLXERWSA-N	441.440	1.137	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnoc1)C2	1798522422	XBCHZRUWHTXWJZ-ZSBFGKGUSA-N	444.400	1.025	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Br)C1	1799352276	NSWJVJIYWDSAEM-LACSLYJWSA-N	449.317	1.246	50	20	IDGD	
Cn1cc2cc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@@H](F)Br)C4)ccc2n1	1799910983	XJHRVDCABDJKLO-OCVGTWLNSA-N	439.285	1.467	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C[C@H](O)CNC(=O)OC(C)(C)C	1800182837	UUGAGHBKQXGDGU-QRJUGERDSA-N	447.960	1.154	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCCNC(=O)OC(C)(C)C)C2	1800982301	CEMFKOGTOLDWFQ-IVSAIRAKSA-N	447.960	1.135	50	20	IDGD	
CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](Cl)COC	1800983320	YIZUVPJBBUMJEC-NPJQDHAYSA-N	447.960	1.133	50	20	IDGD	
O=C(O)C#CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](Br)Cc1ccccc1	1801572888	YRCYTLJAZBYPLM-YVSFHVDLSA-N	433.302	1.719	50	20	IDGD	
CCc1[nH]nc(C(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)c1Cl	1803139358	XMENLVGWMYGGAY-MRRJBJDNSA-N	440.331	1.940	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)n1	1803140934	JMLVZSQOLNIZTM-SUMDDJOVSA-N	445.907	1.354	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)c1	1803145727	HJRNUSJBWUEPRF-YZGWKJHDSA-N	444.919	1.959	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccccc2F)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1	1807376209	UEWVJIQBDFAQKT-PGRDOPGGSA-N	447.275	1.534	50	20	IDGD	
Cc1ccncc1C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1808791261	HQEJAVKMONBUGT-PGRDOPGGSA-N	438.532	1.478	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)c1cnnc2ccccc12	1809135607	GCQAYIBWTXLVCK-CWFSZBLJSA-N	439.903	1.944	50	20	IDGD	
Cc1cc(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)ccn1	1810786059	ANAQYJOCHGVBNA-UNMCSNQZSA-N	444.300	1.098	50	20	IDGD	
C[C@H](C(=O)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@@H]1c1cccnc1)n1ccnn1	1812398994	ZTYXZONQEAPSSB-BEAPCOKYSA-N	439.289	1.631	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)C2CC(F)(F)C2)[C@@H]1c1cccnc1	1813068618	PEIICEFPOARRKY-DNVCBOLYSA-N	437.491	1.506	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2cc(F)cn2C)[C@@H]1c1cccnc1	1813069816	DACIPULMSXSYKP-HRAATJIYSA-N	444.511	1.252	50	20	IDGD	
Cc1ccc(CC(=O)N2CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)o1	1813072481	CEPHFLBTPCJXRO-JPYJTQIMSA-N	441.532	1.605	50	20	IDGD	
Cc1ccnc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cccc(B(O)O)c2)CC3)c1	1817468929	HWODWFLHSPMTSR-HNNXBMFYSA-N	436.302	1.066	50	20	IDGD	
CN1CCN(C2(C(=O)N3CCCC[C@H]3c3cc(NC(=O)[C@@H](F)Cl)n[nH]3)CC2)CC1	1818041145	BVWXTBBPIHTSJO-GOEBONIOSA-N	426.924	1.716	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@H](O)CCl)CC2)c1ccc2cccnc2n1	1818972498	XHISMCLZFDXTEU-BXUZGUMPSA-N	431.905	1.912	50	20	IDGD	
O=C(CS[C@@H]1CCCCO1)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](O)CCl)CC2	1819860237	DXNYYJXKRQOPHQ-ITDIGPHOSA-N	433.983	1.915	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](F)Cl)CC2)c1cc(=O)nc2cccnn12	1821265398	XTBUEYCHAKROGS-RMLUDKJBSA-N	436.856	1.306	50	20	IDGD	
CN(C)C(=O)NCC(=O)N[C@@H]1CCc2nc(NC(=O)[C@](C)(Cl)CCl)sc2C1	1822858040	TWYXJXUBKLYPII-JDNHERCYSA-N	436.365	1.563	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc[n+]([O-])c1)CC2	1825637002	PITRPIINAJTKTM-MWLCHTKSSA-N	425.308	1.786	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc3nn[nH]c3c1)CC2	1826004951	WGOVQMAIQFWTCL-WDEREUQCSA-N	434.909	1.894	50	20	IDGD	
CSCC[C@H](O)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](C)Br)CC2	1826136142	VPOLQBSAOUPSNP-KKZNHRDASA-N	436.397	1.953	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccnc4ncccc34)C2)C1	1830366304	PEGMERWKIXYIPN-JOCHJYFZSA-N	446.935	1.965	50	20	IDGD	
O=C(CCn1ccnn1)N1CCC([C@H]2CCCCN2C(=O)[C@@H](F)Br)CC1	1830381309	ISNWTKBYONASKH-GDBMZVCRSA-N	430.322	1.978	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CC3(F)F)C2)C1	1830540274	PIZSREBOTMUQLV-JMSVASOKSA-N	425.270	1.129	50	20	IDGD	
O=C(c1cc(F)ccc1Cl)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1830733363	KLDBDYSBZNJERL-MAUKXSAKSA-N	435.279	1.149	50	20	IDGD	
CC1(C)CCC(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)CC1	1830733390	KZPIDOZHLBVDCR-DYESRHJHSA-N	430.973	1.649	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC[C@H]1C1CCN(C(=O)C[C@@H](NC)C(=O)O)CC1	1831548305	AMJMLDSNCCNPHF-XHSDSOJGSA-N	446.386	1.842	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)n3cc(C)cn3)C2)C1	1831657119	LXEQYDWGCKMAIZ-UWVAXJGDSA-N	426.945	1.616	50	20	IDGD	
C[C@@H](Cn1ccnc1)C(=O)N1CCC([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1	1831876946	NTBQOGSXDHNEKL-AZUAARDMSA-N	446.596	1.512	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)CCc2ncc[nH]2)CC1	1832075676	IFELQHVOZQSHJD-SFHVURJKSA-N	432.569	1.335	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)[C@H]2CCCSC2)CC1	1832857000	UHHVKJQAYJDUIH-FPOVZHCZSA-N	444.406	1.743	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)/C=C/c3ccco3)CCO2)C1	1833078554	ZVYFDZOGVBTEFC-CRPWZZHVSA-N	427.295	1.533	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3ccc4n[nH]cc4c3)CC2)CC1)[C@H](O)CCl	1833310973	ZSIKVXBHZYSNAG-LJQANCHMSA-N	433.940	1.348	50	20	IDGD	
C#CCO[C@H](C)C(=O)NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1	1833466513	GXZCUVYMERDGLX-CJNGLKHVSA-N	432.334	1.287	50	20	IDGD	
Cc1cc(C)n(CCC(=O)N2CCC(N3CCC(NC(=O)[C@@H](F)Cl)CC3)CC2)n1	1835083932	ZYQRABDLCNUXBD-LJQANCHMSA-N	427.952	1.996	50	20	IDGD	
C[C@@H]1CC[C@H](C(=O)NC2CCN(C3CCN(C(=O)CO[Si](C)(C)C)CC3)CC2)O1	1835465010	ZRQJHHCBZHPYEV-VQIMIIECSA-N	425.646	1.977	50	20	IDGD	
Cc1cc(CC(=O)N2CCC(N3CCC(NC(=O)CO[Si](C)(C)C)CC3)CC2)n[nH]1	1835836974	HRJKBZBKIPSDLF-UHFFFAOYSA-N	435.645	1.684	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnn4cc(C)cnc34)CCO2)C1	1836949475	NBHUSQHMENRTGU-UZLBHIALSA-N	435.912	1.125	50	20	IDGD	
O=C(CCBr)N1CCC(OC2CCN(C(=O)CCn3ccnn3)CC2)CC1	1837654711	NEXGVUSFVSXNDF-UHFFFAOYSA-N	442.358	1.452	50	20	IDGD	
C[C@H](C(=O)N1CCC(OC2CCN(C(=O)CCBr)CC2)CC1)n1cncn1	1837654771	VAYFQCSHQKIBGL-CQSZACIVSA-N	442.358	1.623	50	20	IDGD	
N#Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)c(Cl)c1	1839423476	DGUFELOBTUJGLC-CRAIPNDOSA-N	430.263	1.816	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccccc3F)C2)C1	1840032392	XNWCYJFNGUOXRK-LIRRHRJNSA-N	443.313	1.608	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)cc1F	1840034217	FAVIHVZUQTZODX-KUHUBIRLSA-N	443.313	1.988	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cn3cnc4ccccc43)CCO2)C1	1840100885	LZJJPKUXUZTZHN-VGOFRKELSA-N	448.951	1.900	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3ncccc3C)C2)C1	1840151097	VGCCJNUVCJIUNF-LAUBAEHRSA-N	439.940	1.033	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)n1cccc1)CCO2	1840348335	KHOFLNCIZGHQEG-GPMSIDNRSA-N	442.354	1.537	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3cc(F)ccc3F)CCO2)C1	1840812001	VAKJLGGXCNSPIV-JXFKEZNVSA-N	446.878	1.218	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)COc2cccc(Cl)c2)C1	1841204202	NGQFRCUBYXZQLT-UHFFFAOYSA-N	443.891	1.235	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H](C(=O)N2CC3(CCCN3C(=O)[C@@H](O)CCl)C2)C[C@H]2C[C@H]21	1841354841	ZNABXKCAYSTELK-KBXIAJHMSA-N	427.929	1.187	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)c2ccnc(C(F)(F)F)c2)C1	1842328800	MCTPUVBJBRMWFG-UHFFFAOYSA-N	427.427	1.290	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)c2ccc(CS(C)(=O)=O)nc2)C1	1843215413	PORWXZBAUHYDEI-MRXNPFEDSA-N	427.954	1.851	50	20	IDGD	
Cn1ncc(Br)c1C(=O)N1CCCC12CN(C(=O)CO[Si](C)(C)C)C2	1843605013	PMMQQRRCFSBNFM-UHFFFAOYSA-N	429.391	1.851	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)CCc1ccccc1F)C2	1844265607	VDSLFBNPZFWYRF-UHFFFAOYSA-N	425.464	1.274	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2onc3ccccc23)C1	1845636672	ZIERDEQJNZFHDV-ZVHZXABRSA-N	434.456	1.779	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H](O)C[C@H]1C(=O)N1CCCC12CN(C(=O)C(C)(C)CCl)C2	1846216472	SUMAWUNQEJQLEG-CABCVRRESA-N	443.972	1.825	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@H]1CC(=O)CN1C(=O)OC(C)(C)C)C2	1846360662	XUDWYAMKDZFGBM-CABCVRRESA-N	443.928	1.022	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CCc1cncc(C)c1	1848197231	ZFMFHYVBSHNGNE-FMEPYYHXSA-N	436.516	1.658	50	20	IDGD	
C[C@H](NC(=O)OCc1ccccc1)C(=O)OCC(=O)NNC(=O)c1ccc(Cl)cc1	15343080	IATAHDSQEHJCOF-ZDUSSCGKSA-N	433.848	1.959	50	20	IDGD	
CCn1c(=O)c2ccccc2n(CC(=O)NNC(=S)Nc2ccc(C)cc2C)c1=O	28616717	ZLMFRWDGVYHWGY-UHFFFAOYSA-N	425.514	1.818	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)c1ccc(N2CCCC2)nc1	116722873	MCHQISIKETYJPN-UHFFFAOYSA-N	443.529	1.541	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](NS(=O)(=O)c2ccc(C)cc2)C(C)C)cc1	726276160	KVTKKSZESAZQKN-SFHVURJKSA-N	446.529	1.392	50	20	IDGD	
COc1ccc(CN2C[C@@H](C(=O)NNC(=O)COc3cc(C)ccc3C)CC2=O)cc1	726521736	PNXLEVOGFOAGFR-SFHVURJKSA-N	425.485	1.887	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCCc1cccc(C(N)=O)c1	726609849	GZXRMUJHQVNMDL-LBPRGKRZSA-N	449.305	1.888	50	20	IDGD	
CC(C)CC(=O)N[C@@H](C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)c1ccccc1	727368559	BBYFFYPXHHWHFL-LJQANCHMSA-N	431.514	1.755	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)COc3ccc(C#N)cc3)cc2)CC1	728213225	HAIRYAYQYVAHAL-UHFFFAOYSA-N	429.502	1.016	50	20	IDGD	
Nc1c(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)ccc(Cl)c1Cl	728330276	NWFDLNLQHMAXCO-CYBMUJFWSA-N	440.239	1.720	50	20	IDGD	
CC(C)[C@@H](NS(=O)(=O)c1ccc2c(c1)OCCCO2)C(=O)NNC(=O)CC(C)(C)C	728607583	COGWOXPFRVTNAW-GOSISDBHSA-N	441.550	1.734	50	20	IDGD	
CC(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1	728845930	QPCYSKFKOWLWLF-UHFFFAOYSA-N	431.518	1.336	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](CCC(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1)c1ccccc1	729303766	ZMAOPTLOMWJQBT-JKSUJKDBSA-N	439.534	1.615	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CSc1nnnn1C1CCOCC1	729936845	IUUZDORSFULCMD-UHFFFAOYSA-N	426.886	1.240	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)Cc3cccc(NS(C)(=O)=O)c3)n[nH]2)cc1	730278740	RNXDRZJRCQMVDT-UHFFFAOYSA-N	427.486	1.760	50	20	IDGD	
COc1ccc(-c2noc(CCCC(=O)NNC(=O)COc3ccccc3O)n2)cc1	730781004	BHWMJLGGBBODLU-UHFFFAOYSA-N	426.429	2.000	50	20	IDGD	
O=C(CCCCOc1ccc(Br)cc1)NNC(=O)N[C@@H]1CCS(=O)(=O)C1	731186887	XMOMGYWEQSGEFY-CYBMUJFWSA-N	448.339	1.516	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)Nc2ccn(CCN3CCOCC3)n2)c1C	731335795	KIMPCLZGFYVUNP-HKWRFOASSA-N	426.521	1.826	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)c1nnn(-c2cccc3c2CCN(C)C3)c1C	731471223	PAAMQQCVQSABGC-UHFFFAOYSA-N	444.499	1.595	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2ccsc2NC(=O)c2ccco2)n1	731520686	MRFKOZLRLOELMU-UHFFFAOYSA-N	448.482	1.905	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)c1nnn(-c2cccc3c2CCN(C)C3)c1C	731759018	LUMNYPVLKKIHNH-UHFFFAOYSA-N	449.515	1.445	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)N[C@@H](Cc2ccccc2)CN2CCOCC2)c1	732476745	VFGVVESNXDYXEP-FQEVSTJZSA-N	425.533	1.640	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)Cc1ccc(S(N)(=O)=O)cc1	734252159	GANFRJNYWSNALH-UHFFFAOYSA-N	440.547	1.097	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)c1ccc(C)cc1)C(=O)NNc1nccnc1Cl	734261804	HWDRDFIGZZNDQN-ZDUSSCGKSA-N	429.955	1.982	50	20	IDGD	
CCOC(=O)c1cc(S(=O)(=O)NNC(=O)[C@H]2Cc3ccccc3O2)cc([N+](=O)[O-])c1C	734807335	LKTXHBKQXXVAGB-QGZVFWFLSA-N	449.441	1.393	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNS(=O)(=O)c2cc(C(=O)O)cs2)CC1	734807661	ZBOCCDNUNWDOCI-UHFFFAOYSA-N	448.523	1.338	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)c2ccc(CNC(N)=O)cc2)CC1	734825610	JMLBQSQEJGPTIF-UHFFFAOYSA-N	434.497	1.198	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)NC[C@H](C)CN2CCOCC2)c1	739050280	WSDNMFUULDSGGG-LBPRGKRZSA-N	429.315	1.370	50	20	IDGD	
CC(=NNC(=O)c1ccc2c(c1)OCCO2)c1cccc(S(=O)(=O)N2CCOCC2)c1	739411061	DZKGFHCVBHXUPN-UHFFFAOYSA-N	445.497	1.633	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)NC[C@H](O)c1cc(Cl)c2c(c1)OCCO2	740058125	RFCQLWWBEIVRIS-INIZCTEOSA-N	435.864	1.692	50	20	IDGD	
CCS(=O)(=O)N1CCC(C(=O)NNc2ccnc(N(C)C)n2)(c2ccccc2)CC1	740107467	INAHJTYTSHQYGO-UHFFFAOYSA-N	432.550	1.369	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)c1cccc(NS(=O)(=O)c2cccs2)c1	740849832	MPXIFGQRJVHTNF-UHFFFAOYSA-N	438.531	1.615	50	20	IDGD	
CNC(=O)c1cccc(CCNC(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)c1	740920153	GSJWIGYBTCCNER-UHFFFAOYSA-N	430.461	1.259	50	20	IDGD	
CC(=O)NCC(=O)N1CCc2cc(C(=O)NNC(=O)c3cccc4ccccc34)ccc21	741576548	VXXNGVQEZLZTBH-UHFFFAOYSA-N	430.464	1.940	50	20	IDGD	
O=C(NNC(=O)C(F)(F)Oc1ccccc1)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])o1	741593495	IMZQKTIZMINKSI-GFCCVEGCSA-N	438.343	1.612	50	20	IDGD	
N=C1NC(=O)[C@H](CC(=O)NNC(=O)[C@@H]2Cc3ccccc3CN2Cc2ccccc2)S1	742600156	SSPZRFKPKSLWDO-ROUUACIJSA-N	437.525	1.317	50	20	IDGD	
COc1ccccc1-c1noc([C@@H](C)NC(=O)NNC(=O)CNC(=O)c2cccs2)n1	743577501	PTOWDTLZKDKKSS-LLVKDONJSA-N	444.473	1.628	50	20	IDGD	
CCS(=O)(=O)NCc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)cc1	743820646	DRHYVHYITFJRAF-UHFFFAOYSA-N	432.502	1.142	50	20	IDGD	
COc1ccc(-n2ccc(C(=O)NNC(=O)Nc3ccc(S(C)(=O)=O)cc3)n2)cc1	743829285	KITSHUCGQNOREU-UHFFFAOYSA-N	429.458	1.751	50	20	IDGD	
Cc1cccc(C)c1NC(=O)CN1CCN(CC(=O)NNC(=O)c2ccc(C#N)cc2)CC1	744385645	ROUVRYGXYUVNDR-UHFFFAOYSA-N	448.527	1.192	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)N2CCN(CC(=O)NNC(=O)c3ccc(C#N)cc3)CC2)c1	744406827	KACNTVNZGIXCOE-GOSISDBHSA-N	449.511	1.239	50	20	IDGD	
C[C@H](C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1)N1CCc2ccccc2C1	744621262	MZRYBHKNXGJFLZ-QGZVFWFLSA-N	444.557	1.597	50	20	IDGD	
O=C(COC(=O)Cc1ccc(NC(=O)C2CC2)cc1)NNC(=O)c1cccc([N+](=O)[O-])c1	745492644	IEHRUVNYFXFAMY-UHFFFAOYSA-N	440.412	1.490	50	20	IDGD	
CCN1CCN(C[C@@H](C)CNC(=O)NNC(=O)Nc2ccc(OC(F)F)cc2)CC1	745862932	QHRAPADDLZGBST-AWEZNQCLSA-N	428.484	1.897	50	20	IDGD	
COc1cc(C)nc(NNC(=O)[C@H]2CCCCN2S(=O)(=O)c2ccc(C(C)=O)cc2)n1	746633458	UUOWKTUHAFEBGU-QGZVFWFLSA-N	447.517	1.683	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)NCc1cc(F)ccc1N1CCOCC1	746768134	VBHYPFGIFOLPAC-UHFFFAOYSA-N	426.452	1.383	50	20	IDGD	
NC(=O)c1ccc(C(=O)NNC(=O)[C@@H]2Cc3ccccc3CN2Cc2ccccc2)nc1	748841084	JDNVAVMOJZYDJA-NRFANRHFSA-N	429.480	1.569	50	20	IDGD	
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	749583420	LVXMBHUMHOPOMB-OXQOHEQNSA-N	444.557	1.945	50	20	IDGD	
Cc1c(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cnn1CCC(C)C	750169566	NHGKHMFPNXUARP-GOSISDBHSA-N	430.461	1.382	50	20	IDGD	
CC1(C)NC(=O)N(CCCC(=O)NNC(=O)c2ccc(COc3ccccc3)o2)C1=O	751611919	ZMPABLPAHBICHN-UHFFFAOYSA-N	428.445	1.730	50	20	IDGD	
CC[C@@H](NC(=O)NNC(=O)c1ccc(F)cc1Br)C(=O)N1CCOCC1	753061016	XYMAEDWLNPZAKN-CYBMUJFWSA-N	431.262	1.170	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)Nc1ccccc1I	755345396	XCNYKANHCKKYOL-UHFFFAOYSA-N	449.212	1.733	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCOCC2)cc1NC(=O)NNC(=O)C1CCCC1	755407716	CSPKJBMBVZGDFY-UHFFFAOYSA-N	426.495	1.059	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)Nc1ccccc1C(=O)N1CCN(C)CC1	755622162	FBGNDORLQBBLOX-UHFFFAOYSA-N	435.488	1.497	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)Nc1cc(N2CCCS2(=O)=O)ccc1F	756154285	FYKZXPTYKFROLC-UHFFFAOYSA-N	436.421	1.561	50	20	IDGD	
COC(=O)c1cccc(NC(=O)C(=O)NNc2cncc(Cl)n2)c1Br	756179146	XVNARSPXPUHZKQ-UHFFFAOYSA-N	428.630	1.761	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1ccc(Oc2ccc(Cl)nn2)cc1	756561104	BIGHYQILWZUFQX-SECBINFHSA-N	428.858	1.013	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2ccc3c(c2)C(=O)N(C)CC3)c2ccccc2c1=O	757689670	GIQBBFWDYIVGLT-UHFFFAOYSA-N	434.456	1.511	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)Nc1cnn(-c2ccccc2Br)c1	757774777	AKQPTGOZGVVTRL-JTQLQIEISA-N	442.295	1.222	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H]2CN(C3CC3)C[C@H]2C)c1	757790164	ALRYUYXZLOPLNU-RDTXWAMCSA-N	437.566	1.144	50	20	IDGD	
CC[C@H](Cc1ccccc1Br)C(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1	758156565	ATZYWTFSHCVTGW-DGCLKSJQSA-N	432.340	1.535	50	20	IDGD	
C[C@@H]1CN(c2ccc(CNC(=O)NNC(=O)C(=O)Nc3ccccn3)cc2F)C[C@@H](C)O1	758704075	WHFBUXMJXSUMQR-ZIAGYGMSSA-N	444.467	1.303	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)C[C@@H](c1ccccc1)OC2=O)C(=O)Nc1ccccn1	758837729	DWILCMHQYBJMQL-SFHVURJKSA-N	430.420	1.936	50	20	IDGD	
COc1ccc2c(c1)OC[C@@H]2CC(=O)NNC(=O)c1sc(N2CCOCC2)nc1C	760264480	UJXCBPNOPWRQMA-ZDUSSCGKSA-N	432.502	1.624	50	20	IDGD	
Cc1cc(C)nc(-n2nccc2NC(=O)C(=O)NNC(=O)Cc2cccc3ccccc23)n1	760278457	XNDPFRMYZAJDOO-UHFFFAOYSA-N	443.467	1.761	50	20	IDGD	
CCn1c(=O)n(CC)c2nc(NC(=O)CCC(=O)NNC(=O)c3ccc(C#N)cc3)ccc21	761151332	ZNBVNTXRFZYPRF-UHFFFAOYSA-N	449.471	1.289	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)CN1C(=O)N[C@]2(CCCC[C@H]2C)C1=O	761622937	ZXXAYBKMQPZYKV-XCLFUZPHSA-N	434.518	1.435	50	20	IDGD	
Cn1c(SCC(=O)NNC(=O)c2cccc(C#N)c2)nc2cc([N+](=O)[O-])ccc2c1=O	762485707	WFBPWJBOSMKVCN-UHFFFAOYSA-N	438.425	1.267	50	20	IDGD	
C[C@H]1CN(c2ccccc2NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)C[C@@H](C)O1	763548759	PWEDVGXEPMQSRO-OKILXGFUSA-N	440.456	1.429	50	20	IDGD	
CC(C)S(=O)(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)c1	763552364	YVKJRVANTVZDSE-UHFFFAOYSA-N	447.469	1.138	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2-c2ccccc2)nn1CCC#N	763643988	MSOODNNDLLVDRR-UHFFFAOYSA-N	446.467	1.937	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)ccc1Cl	763695769	WKKZLLUFQFJHMR-UHFFFAOYSA-N	440.239	1.945	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccccc1C(=O)N(CC)CC	763714343	UHIAGWKIUDETHP-UHFFFAOYSA-N	440.500	1.896	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc2c(cc1Cl)OCCO2	763807429	BOJOXZKICWJBNE-UHFFFAOYSA-N	430.804	1.148	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)C(=O)Nc1cccc(Cl)c1-n1cncn1	763840417	LEEGQLSYTFZVTG-UHFFFAOYSA-N	432.799	1.225	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)OCCO3)cc1	763860382	GMMJZFSEMJQODJ-ZDUSSCGKSA-N	429.429	1.410	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cccc(-n3ccnc3)c2)cc1	763879055	VXFYDJBJLYRRBH-HNNXBMFYSA-N	435.440	1.628	50	20	IDGD	
O=C(CCSc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccnn1Cc1ccccn1	763894901	FTNUKFFYYAUZIS-UHFFFAOYSA-N	442.476	1.734	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)N2C[C@@H]3CCCN3c3ccccc32)cc1OC	763903704	SKHFFHKQZFSONU-INIZCTEOSA-N	438.484	1.871	50	20	IDGD	
Cc1ccc(Br)c(NC(=O)C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c1	763916171	AIHKCUVPSPPEQD-UHFFFAOYSA-N	444.249	1.133	50	20	IDGD	
Cc1ccc(-c2nnco2)cc1NC(=O)C(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	763943981	IWISOEHAHWBBTB-UHFFFAOYSA-N	447.411	1.336	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)C(=O)Nc1ccc2c(c1)OC(F)(F)O2	763995990	SRUWIGPMTLEOCN-UHFFFAOYSA-N	431.149	1.498	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)on1)C(=O)Nc1ccc(O[C@H]2CCOC2)cc1	764004425	VUGAAUWPZZVOGU-KRWDZBQOSA-N	436.424	1.909	50	20	IDGD	
O=C(NNC(=O)c1c(Cl)cccc1Cl)C(=O)Nc1cc(-n2cnnn2)ccc1F	764221716	WSBYBGLHXYAEBQ-UHFFFAOYSA-N	438.206	1.508	50	20	IDGD	
C[C@H](c1cccc(NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)c1)N1CCOCC1	764243107	LZEICKALYGYYMH-QGZVFWFLSA-N	449.511	1.821	50	20	IDGD	
CN1C(=O)CCc2cc(NC(=O)C(=O)NNC(=O)c3cccc(OC(F)F)c3)ccc21	764259448	HYPWOLOQPPSSNG-UHFFFAOYSA-N	432.383	1.597	50	20	IDGD	
O=C(NNC(=O)c1cc2ccccc2o1)C(=O)Nc1ccc(CCN2CCOCC2)cc1	764330744	HODNDHHWXLJHFN-UHFFFAOYSA-N	436.468	1.707	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)c2ccccc2n1	765738393	KDUCJTHFXLWYCE-UHFFFAOYSA-N	431.496	1.762	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1cccc(CN(C)Cc2cscn2)c1	766262049	PZHHDMSHAIAENF-UHFFFAOYSA-N	427.490	1.656	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)CNC(=O)CNC(=O)OC(C)(C)C)n[nH]2)c1	767120042	QVOYPNRHUAWWQD-UHFFFAOYSA-N	444.492	1.095	50	20	IDGD	
O=C(NNC(=O)c1cccc(Br)c1)NC1CCN([C@@H]2CCC[C@H]2O)CC1	767958919	LCLRFDXWBRKJFK-HZPDHXFCSA-N	425.327	1.771	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)Nc2ccccc2OCC(=O)Nc2cccnc2)n1	768008534	DGSIHKPOIMDKHH-UHFFFAOYSA-N	437.460	1.765	50	20	IDGD	
CO[C@@H](CNC(=O)OC(C)(C)C)CC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	768223359	CXAKARMIJPGKEK-CYBMUJFWSA-N	444.510	1.173	50	20	IDGD	
CCOc1ccc(OCc2ccc(C(=O)NNC(=O)C(=O)Nc3cncnc3)cc2)cc1	768233287	MTVQWQVIVDJAPX-UHFFFAOYSA-N	435.440	1.854	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(Cl)s1)NNC(=O)c1cc(-c2cccs2)[nH]n1	768262657	LOUQLXIEBTWZOB-UHFFFAOYSA-N	445.935	1.593	50	20	IDGD	
C[C@H](CBr)COC(=O)[C@@H](NS(=O)(=O)c1ccc(Cl)cc1)[C@H](C)O	770304774	KZNSOUNPUJGNGW-NRUUGDAUSA-N	428.732	1.942	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)[C@H]2CC(=O)N(c3c(F)cccc3F)C2)c2ccccc2c1=O	770577868	HPVGZVVYHDWYJO-NSHDSACASA-N	441.394	1.026	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1cc(S(=O)(=O)N(CC)CC)ccc1Cl	771882251	OLIRSENYLKLPJO-LLVKDONJSA-N	433.914	1.473	50	20	IDGD	
CN(CCNC(=O)NNC(=O)c1ccc(Cl)cc1F)S(=O)(=O)c1cccs1	772017995	ZQRPXNKYZYBUTP-UHFFFAOYSA-N	434.902	1.805	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)c2cnn(CC(=O)NC3CCCC3)c2)c1C	772043284	RPSLHTOAQUVCQG-INIZCTEOSA-N	427.505	1.787	50	20	IDGD	
CC(C)(C)OC(=O)Nc1cccc(CC(=O)NNC(=O)CNC(=O)c2cccnc2)c1	772180236	SJJNAQRBOKQLHR-UHFFFAOYSA-N	427.461	1.549	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)c1cc(N2C[C@H](C)O[C@H](C)C2)ccn1	772561079	OBQCGDDXQQBBJI-OKILXGFUSA-N	434.518	1.864	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)c2nnn(-c3cccc4cccnc34)c2C)c1	773072934	DGUMUFGXZKOJIC-UHFFFAOYSA-N	430.428	1.552	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1)C(=O)Nc1ccc(F)cn1	773544146	YEFXTJFZCGZAHO-FQEVSTJZSA-N	447.470	1.934	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2c(Cl)cccc2Cl)n([C@@H]2CCS(=O)(=O)C2)n1	773691998	UNQLJSUUSNPNQO-SNVBAGLBSA-N	446.316	1.940	50	20	IDGD	
Cn1cc([C@@H](NC(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)c2ccc(F)cc2)cn1	776196758	JTGPSBDNEXPLKJ-KRWDZBQOSA-N	428.380	1.907	50	20	IDGD	
CN(NC(=O)c1cncc(-c2cnn(C)c2)c1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776204649	DPMHCKFPCUKAFX-UHFFFAOYSA-N	443.508	1.731	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2c[nH]c3c(F)cc(F)cc3c2=O)c2ccccc2c1=O	776315169	RAACUSGFQXWOEP-UHFFFAOYSA-N	439.378	1.611	50	20	IDGD	
C[C@H]1[C@@H](C)N(C(=O)NNC(=O)CNC(=O)c2cccs2)CCN1C(=O)OC(C)(C)C	776322397	ZLAQPYPDYNKMST-OLZOCXBDSA-N	439.538	1.548	50	20	IDGD	
COc1ccc(C(C)(C)C(=O)N2CCN(S(=O)(=O)CBr)CC2)cc1OC	777776976	BARGEUJBWPOWGI-UHFFFAOYSA-N	449.367	1.808	50	20	IDGD	
CCOc1cnc(C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)cn1	777813670	UFHJEASNCQMNJL-UHFFFAOYSA-N	432.912	1.108	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)[C@H](C)CS(=O)(=O)c2ccc(OC)cc2)nc1C	778421449	NACARTADADWEQB-GFCCVEGCSA-N	436.490	1.523	50	20	IDGD	
COc1ccc(Cn2cc(C(=O)NNC(=O)CCN3C[C@H](C)O[C@@H](C)C3)cn2)cc1OC	779370553	HZNRWBKAEMGXAS-HOTGVXAUSA-N	445.520	1.209	50	20	IDGD	
C[C@H](O)c1cn(C2CN(C(=O)CCC(=O)C(C#N)=C3N(C)c4ccccc4N3C)C2)nn1	779562291	NNBQUAJRGKNENI-AWEZNQCLSA-N	435.488	1.385	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(C(=O)NNc2ncncc2Cl)ccc1Br	781825665	OLGROHQSZABILM-UHFFFAOYSA-N	434.703	1.900	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(CNC(=O)NNC(=O)Cn2ccc3ccccc32)c1	782535734	AZZIRPORCPMRNC-UHFFFAOYSA-N	429.502	1.422	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C(=O)Nc2ccc3oc(C4CC4)nc3c2)nc2ccccc21	782894976	UCEKXOQMSBWYMC-UHFFFAOYSA-N	432.440	1.921	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCc2ccc(N3CCOC3=O)cc2)nc1	783311318	DQKGLYDHIQVXHH-UHFFFAOYSA-N	448.505	1.551	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNc2ccc(F)cc2F)cc1S(=O)(=O)N(C)C	783342958	PPZYTKVXSVNRHH-UHFFFAOYSA-N	442.444	1.696	50	20	IDGD	
CN(c1ccc(NC(=O)C(=O)NN[C@@]2(C)CCS(=O)(=O)C2)cc1F)C1CCCCC1	783423936	BPPDJTDICMXDGD-FQEVSTJZSA-N	440.541	1.731	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2cc(F)c(F)cc2I)ncn1	783948214	SUMQMKMPGFBTBC-UHFFFAOYSA-N	433.156	1.750	50	20	IDGD	
NC(=O)CCOc1ccccc1NC(=O)C(=O)NNc1ccc(OC(F)(F)F)cc1	784801771	XAZJEBUJHPVOBN-UHFFFAOYSA-N	426.351	1.921	50	20	IDGD	
COc1cc(F)cc(NNC(=O)C(=O)Nc2ccc(NS(C)(=O)=O)c(Cl)c2)c1	785241421	JFFBCBQMCBELTJ-UHFFFAOYSA-N	430.845	1.941	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)[C@@H]3CCCN3c3ccccc3)cc2)CC1	787461141	KQHHDDUDBAMMDJ-NRFANRHFSA-N	443.573	1.735	50	20	IDGD	
NS(=O)(=O)c1ccccc1NNC(=O)c1cccc(S(=O)(=O)NC2CCCC2)c1	788229392	WYAZOWZGSDUNAR-UHFFFAOYSA-N	438.531	1.312	50	20	IDGD	
COc1ccsc1S(=O)(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	788914738	FFQBRQHJKVNIFU-UHFFFAOYSA-N	434.540	1.555	50	20	IDGD	
COc1nc(Br)ccc1NC(=O)C(=O)NNC(=O)c1cc2ccccc2o1	789586548	PQYZZNMLRJWBPK-UHFFFAOYSA-N	433.218	1.999	50	20	IDGD	
O=C(NNC(=O)[C@H]1OCC[C@H]1c1ccccc1)C(=O)Nc1ccc2c(c1)OC(F)(F)O2	789809578	AMQWKTQKEHVNLL-BBRMVZONSA-N	433.367	1.667	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1cc(-c2cccc(C#N)c2)no1	789870757	IRASESXNPRVPAE-UHFFFAOYSA-N	438.469	1.890	50	20	IDGD	
COCCN(C)c1ccc(C=NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)cn1	790166371	FJKDWQCOIBWUSY-UHFFFAOYSA-N	438.576	1.741	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)Cc2cccnc2Br)c2ccccc2c1=O	791297017	PMXOHFNJCPNCHZ-UHFFFAOYSA-N	444.289	1.968	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c(F)cc1C	793022694	BFWPMQRENLOVRI-UHFFFAOYSA-N	432.364	1.619	50	20	IDGD	
CN(C)c1nccc(NNC(=O)C(=O)Nc2cc(C(C)(C)C)nn2-c2ccc(C#N)cc2)n1	793046438	MMSBKGLBHSJUPP-UHFFFAOYSA-N	447.503	1.979	50	20	IDGD	
O=C(CCCCC/N=C1/NS(=O)(=O)c2ccccc21)NNC(=O)NCC(F)(F)F	798314415	KQWOKYSGBWGWGC-UHFFFAOYSA-N	435.428	1.178	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@@H]1CC(C(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)=NO1	798961632	ABYMHGXPKJPVPP-JTQLQIEISA-N	448.484	1.400	50	20	IDGD	
CC(C)(C(=O)NNC(=O)COc1ccc(OCc2ccccc2)cc1)N1CCOCC1	801103715	OIKAKAXZMPYHBK-UHFFFAOYSA-N	427.501	1.903	50	20	IDGD	
Cc1c(/C=C(\C#N)C(=O)NC[C@@H]2CCn3ncc(C(=O)NC(C)C)c3C2)cc(C#N)n1C	803412685	LJVRIQWNNGFAFN-LQZLHMKNSA-N	433.516	1.826	50	20	IDGD	
CNS(=O)(=O)c1cc(NC(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)ccc1F	806545481	XIJCNGGCEVDDSW-UHFFFAOYSA-N	447.489	1.191	50	20	IDGD	
COCCn1cc(C(=O)NNC(=O)c2cc(OC)ccc2Br)c(=O)cc1C	806784994	DNGHRMDJVIOJSE-UHFFFAOYSA-N	438.278	1.649	50	20	IDGD	
Cc1cccc(F)c1NNC(=O)C(=O)N1C[C@H](C[C@H]2COCC(=O)N2)c2ccccc21	806982709	CXLOBXWSHCRSIC-GJZGRUSLSA-N	426.448	1.613	50	20	IDGD	
O=C(NC[C@@H](c1cccs1)N1CCCC1)NNC(=O)c1ccc(-n2cnnn2)cc1	807005793	NFAQNIHTGGXLNI-INIZCTEOSA-N	426.506	1.505	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(NC(=O)C(=O)NNc2ccc(Cl)c(F)c2)ccc1F	807022935	VTXRVIXMHKQFCR-UHFFFAOYSA-N	432.836	1.950	50	20	IDGD	
NS(=O)(=O)c1ccc(C=NNC(=O)c2csc(N3CCOCC3)n2)cc1Cl	807953653	VOEWPFQWFCYANE-UHFFFAOYSA-N	429.911	1.044	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNS(=O)(=O)c1cccc(C(=O)N(C)CC)c1	808069328	UBVINPLSKZWOTI-UHFFFAOYSA-N	435.502	1.566	50	20	IDGD	
O=C(NNC(=O)c1cccnc1)C(=O)Nc1cnn(-c2ccc(F)cc2)c1C(F)(F)F	810384422	BRCPTJUQMDQTBA-UHFFFAOYSA-N	436.325	1.825	50	20	IDGD	
COC(=O)c1cc(Br)cc(C(=O)NNC(=O)CNC(=O)c2cccs2)c1	812492881	PTTXJBPQPGEIFJ-UHFFFAOYSA-N	440.275	1.488	50	20	IDGD	
Cc1nc2c(c(C)nn2C)c(C)c1CC(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	812732951	DSPWFTOMJZLQLC-UHFFFAOYSA-N	430.534	1.830	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2cc(C)cnc2Br)cc1	812979320	OEIUTLAKJCTIOF-UHFFFAOYSA-N	435.278	1.880	50	20	IDGD	
COCCOCc1ccc(CNC(=O)NNC(=O)Cc2nc3ccccc3n2C)cc1	813183025	SJRONCINHDKICM-UHFFFAOYSA-N	425.489	1.809	50	20	IDGD	
CCC(=NNC(=O)Nc1ccc(S(N)(=O)=O)cc1)c1ccccc1OCC(=O)N(C)C	814969996	RKDGLFXLRZFAHW-UHFFFAOYSA-N	447.517	1.737	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cc(C)c3nccn3c2)ccc1OC(C)C	815566711	CKWWDVGJDWIJNT-UHFFFAOYSA-N	425.445	1.838	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCc2nncn2C1)C(=O)Nc1cc(C2CCC2)nn1-c1ccccc1	815691076	DXLLACMKGLCHKG-OAHLLOKOSA-N	448.487	1.080	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)C(=O)Nc2ccc3nccn3c2)c1	815866017	LNARKCFCPHMXLQ-UHFFFAOYSA-N	432.234	1.965	50	20	IDGD	
CC(C)CNS(=O)(=O)c1ccc(C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)cc1	914749081	ADKPBECXMQVRPP-CQSZACIVSA-N	437.493	1.989	50	20	IDGD	
O=C(NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)o1)c1cc(-c2ccccc2)on1	914752709	GUIMTNTZHDCYMA-UHFFFAOYSA-N	430.442	1.794	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2ccc(CC)cc2)cc1	915783530	NGWBNUBDLNTGBJ-UHFFFAOYSA-N	433.486	1.165	50	20	IDGD	
COc1cc(CNC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)ccc1OC(C)C	916392945	BGVGPRSDFVRFMZ-UHFFFAOYSA-N	425.449	1.602	50	20	IDGD	
C=CCNC(=O)c1cccc(S(=O)(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)c1	917718083	VCAJUHRVIOCBDZ-UHFFFAOYSA-N	449.485	1.252	50	20	IDGD	
O=C(CNC(=O)c1cccc(Br)c1)NNC(=O)c1ccc(Cl)cc1O	918358427	PUKYULKXOUAMQH-UHFFFAOYSA-N	426.654	1.999	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)[C@H]2CCN(c3cccc(Br)c3)C2=O)c1O	919756426	HMWMMIHLOGYHFZ-CQSZACIVSA-N	448.273	1.977	50	20	IDGD	
CSCC[C@H](NC(=O)c1ccc([N+](=O)[O-])o1)C(=O)NNC(=O)Cc1ccc(F)cc1	919810035	RNHDSWWWJOYVSB-ZDUSSCGKSA-N	438.437	1.569	50	20	IDGD	
Cc1ccccc1C1(CNC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)CCOCC1	919920904	CRQNJTPCNUXZID-UHFFFAOYSA-N	435.488	1.663	50	20	IDGD	
O=C1CCC(=O)N(c2ccc(C(=O)NNC(=O)c3ccc(Br)s3)cc2)N1	920287747	JZDPHYHORHWKKB-UHFFFAOYSA-N	437.275	1.743	50	20	IDGD	
COCCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2C[C@H](C)C[C@@H](C)C2)c1	920863109	YSGAMCNEIBYYAS-HUUCEWRRSA-N	426.539	1.334	50	20	IDGD	
O=C(NNC(=S)NC1CCOCC1)c1cccc(NC(=S)NC2CCOCC2)c1	1338429672	LYTBUZCVGTZVGR-UHFFFAOYSA-N	437.591	1.440	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)Cc2cnc[nH]2)C1	1777991827	ULAQMCVOGNITCL-DDUZABMNSA-N	427.343	1.497	50	20	IDGD	
CN1CCc2cc(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)[C@@H](O)CCl)C4)ccc21	1778642441	CHJJSOJVFXNFBS-NNMXDRDESA-N	435.952	1.406	50	20	IDGD	
COc1ccnc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)c1OC	1780452999	SNVJIOKSLILFFL-YOEHRIQHSA-N	446.273	1.233	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccccc3C)C2)C1	1780578179	KSELXYGBINQKTB-QADUPLGGSA-N	437.500	1.573	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)N2CCN(C)CC2)C1	1780641129	QJJCMHPGTZCQLX-NEYJZJCJSA-N	429.005	1.154	50	20	IDGD	
CCOC(=O)N1CCC(C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](Cl)CC)C3)C2)CC1	1781224480	WNMZRHBFFFKALD-UZLBHIALSA-N	429.945	1.702	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)Cn3nnc4ccccc43)CCO2)C1	1781224697	NFLHHUGFHIGDMG-MOPGFXCFSA-N	440.331	1.498	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H]2CCCS2(=O)=O)C1	1781650005	KZYVWZXTHKVCPL-SPYBWZPUSA-N	434.986	1.343	50	20	IDGD	
CCOc1cccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)c1O	1781978988	NFTDGDRBRAANGH-CRAIPNDOSA-N	445.285	1.925	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cncc(O)c1)C2	1782002907	ZORDOEUQKJVGGG-WBHUJUFNSA-N	426.311	1.698	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cccc4c3NC(=O)C4)C2)C1	1782410326	KDEKPTRONYVJOW-BLVKFPJESA-N	436.306	1.408	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2)c1cc(F)cc(F)c1F	1782973959	JSLFDGNUQJKQRT-QMTMVMCOSA-N	434.842	1.831	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)N1CC[C@]2(C1)CN(C(=O)CO[Si](C)(C)C)CCO2	1783398737	QXSFKRFHIKROEX-IBGZPJMESA-N	429.590	1.193	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccc4c(c3)CC(=O)N4)CCO2)C1	1783533752	GZMNMRBMPHVVGU-CWTRNNRKSA-N	436.306	1.408	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)Cc3ccc(F)c(C#N)c3)CCO2)C1	1783535775	CCYWGOZPFDOMIQ-DJJJIMSYSA-N	438.297	1.853	50	20	IDGD	
COc1cnc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]3C2)cn1	1783968166	QVAMEXZWNGAHIL-OSFYFWSMSA-N	441.326	1.110	50	20	IDGD	
COc1ccc2nc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]4C3)ccc2c1	1784093483	XCMOIGBZBCZRTK-QHERXFFYSA-N	447.919	1.436	50	20	IDGD	
CCc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Br)C[C@@H]32)cn1	1785880211	PHLPUWSVSGSQQU-QCEMKRCNSA-N	428.302	1.928	50	20	IDGD	
CC(C)(NCCC#N)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21	1786857573	SXHWBUQUGNMESV-KKUMJFAQSA-N	429.359	1.033	50	20	IDGD	
CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]2C1	1787451579	WWSRYJQKBJVOLO-YYFQZIEXSA-N	435.924	1.804	50	20	IDGD	
C[C@H](C(=O)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1)n1cccn1	1788149382	MKCVNRNYECLNMP-MRXNPFEDSA-N	432.289	1.572	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(C)n(CC)n3)[C@H]2C1	1789003526	QSHMNQVHPSXMJZ-JKQORVJESA-N	441.370	1.978	50	20	IDGD	
COc1cc(OC)c(F)c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](O)CCl)C[C@@H]32)c1	1789237401	ZQCSOPKOYZPXKC-SIUGBPQLSA-N	444.887	1.036	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnn4c3OCCC4)[C@H]2C1	1790372474	FZBDHGXAXKBWDI-JURCDPSOSA-N	441.326	1.042	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4occc4c3O)[C@H]2C1	1790439084	FMMPOWDHHOCFBJ-RPZXMPESSA-N	436.892	1.986	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CC3CCOCC3)C[C@@H]21	1790961990	UDASFANSIKYWQO-QAETUUGQSA-N	431.371	1.956	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3ccc4c(c3)CCO4)[C@H]2C1	1791003889	MMDDSTJSLFGROO-ZJOUEHCJSA-N	446.620	1.995	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cn4cccnc4n3)C[C@@H]21	1791056101	NTSHVALHPGCVKL-OSFYFWSMSA-N	436.310	1.106	50	20	IDGD	
Cc1ccc(C(=O)C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]3C2)cc1	1791063381	GSIJXJOLPCUMGN-IWCQGFGOSA-N	437.334	1.941	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(-n4cccn4)nc3)C[C@@H]21)C(Cl)Cl	1791298278	MLXKYKVFHGYELU-KKUMJFAQSA-N	438.315	1.664	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3cnccn3)[C@H]2C1	1791661076	SEBNRAQXCJUPBX-HJWJTTGWSA-N	439.354	1.562	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c(cnn3C)c1)C2	1792868262	SJYANBWMBVLAJD-PTOXDTDZSA-N	449.349	1.808	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CCc3nc[nH]c3C1)C2	1792871953	FSUBJIYHEXBVSG-MNLSVMLLSA-N	439.354	1.135	50	20	IDGD	
CN(C)c1cccc(OCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CO[Si](C)(C)C)C3)c1	1793860365	ZQSXSXBVKUKZQB-FAQVEIGNSA-N	449.624	1.573	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnoc1)C2	1793880192	UBFSPEPSRSAPTE-XGUBFFRZSA-N	442.900	1.010	50	20	IDGD	
Cc1noc(C)c1CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)CBr)C2	1794136139	NIRLSEZKAISQPW-MKXCTONWSA-N	442.354	1.845	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)COc1ccc(F)cc1	1795198768	WXBKTISZMDGHMA-KOFHJDLBSA-N	429.286	1.578	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1n[nH]c2c1CCCC2	1796161877	BUMYTQNWTYJAMG-NFFDBFGFSA-N	439.354	1.523	50	20	IDGD	
CCn1nc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CCC(=O)NN(C)C)C3)c2ccccc21	1796483902	GGOPQFWTOOJZRJ-BJWYYQGGSA-N	440.548	1.681	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1nnsc1C1CC1	1796645591	VSXMCSUNFSXLHD-BSTOTGJRSA-N	433.303	1.309	50	20	IDGD	
Cc1cc(NC(=O)CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](F)Br)C3)no1	1796869407	AOJZYAKFFIEVCF-DDIVZENXSA-N	431.262	1.640	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2cnccc2[nH]1	1797515280	DCDHSTSQCCGJKF-MBMVNNNZSA-N	435.322	1.797	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2c(c1)CNC2=O	1797549152	JTEVSAYKIIPPMC-FKEXNYPISA-N	440.327	1.370	50	20	IDGD	
Cn1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CO[Si](C)(C)C)c2cccnc21	1797956865	HQWRSNMWNGGNLA-CCWDJLKJSA-N	430.581	1.628	50	20	IDGD	
C[C@H](Nc1ccccn1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@](C)(Cl)CCl)C2	1797977588	IHPVPSYBWBLLMU-WXZWTWHISA-N	429.348	1.708	50	20	IDGD	
O=C(Cc1c(F)cccc1F)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2	1798983602	NFSNZZQOVBQZBU-UIHHKEIPSA-N	435.240	1.787	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ncc[nH]1)C2	1799220136	UDQZLQJPLGDIQP-BTTYYORXSA-N	427.417	1.809	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1(Br)CC1	1799360666	UUVIJRCPNCUQBC-FBKDDSFISA-N	428.154	1.740	50	20	IDGD	
CCN(CC)[C@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)c1ccccc1	1800300719	QZNPUGJYSGQOQE-WPVAHCMFSA-N	437.968	1.259	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cncc3cnccc13)C2	1800760271	LVFIEYMKEZFCRZ-DPYKFYPSSA-N	433.306	1.616	50	20	IDGD	
C=C1C[C@@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Cl)C3)N(C(=O)OC(C)(C)C)C1	1801103893	IXRFHHLTYRNWHD-QRJUGERDSA-N	445.919	1.676	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1(c2ccccc2)CCC1)c1cccc(B(O)O)c1	1802191964	LSGTWYVRZGNHNY-KOUNCHBCSA-N	432.329	1.740	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)C#CC2(O)CCCCC2)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803142086	ABBHBXDPJPWARF-CMKODMSKSA-N	433.936	1.386	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cn3c(F)cccc3n2)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803148973	ZFCVELZPZXKVGL-URLQWDBASA-N	445.882	1.788	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H](CNC(=O)CN2CCOC2=O)[C@@H]1c1cccnc1	1803337993	FPWDAWVDVDRRDT-APWZRJJASA-N	434.569	1.391	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)CS(=O)(=O)CC)[C@H]1c1cccnc1	1803685827	CVKPPBBAOQFYKM-RYRKJORJSA-N	429.970	1.930	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1)c1cc(O)ncn1	1803739409	VWODJMLSOGVPDB-GUYCJALGSA-N	434.294	1.682	50	20	IDGD	
Cc1nc(CC(=O)N2CC[C@@H](CNC(=O)CO[Si](C)(C)C)[C@@H]2c2cccnc2)no1	1810540402	MYJYYFACSGLDLU-JXFKEZNVSA-N	431.569	1.873	50	20	IDGD	
NC(=O)c1ccccc1C(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1	1811268573	BJMHGISGCPGKDY-QGTPRVQTSA-N	430.892	1.100	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2nc3ccccn3n2)[C@@H]1c1cccnc1	1813030893	NCOWOIWEDMEDHQ-SOLBZPMBSA-N	442.907	1.698	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)CCc2cnccn2)[C@@H]1c1cccnc1	1813032888	GYSRMRRRZOEKRX-XKGZKEIXSA-N	431.924	1.764	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)CCc2ccc[nH]2)[C@@H]1c1cccnc1	1813071142	NUMWFMAUWNJGOM-WZONZLPQSA-N	440.548	1.421	50	20	IDGD	
COC1(CC(=O)N2CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)CCC1	1813072619	BZYIJKXNCCWBCZ-AVRDEDQJSA-N	445.564	1.420	50	20	IDGD	
Cc1ccc(CC(=O)N[C@@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)cc1	1815339823	QREJJCOQPYPCKH-GOSISDBHSA-N	449.341	1.600	50	20	IDGD	
Cc1ccc(CC(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)cc1	1817471634	UGHVYARAACDJNW-OAQYLSRUSA-N	446.316	1.947	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](Cl)COC)[nH]n1	1819355856	XYHHTKDYVJKNKG-BZPMIXESSA-N	428.921	1.363	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCCC[C@H]1c1cc(NC(=O)Cn2ccncc2=O)n[nH]1	1821655632	AUJDYSKDHIKMDF-HNNXBMFYSA-N	432.557	1.510	50	20	IDGD	
CC(C)=NO[C@H](C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1	1822415690	PDSNMFKRRZJTQB-GDBMZVCRSA-N	435.529	1.576	50	20	IDGD	
O=C(N[C@@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1)c1cc[n+]([O-])cc1	1823007713	RZLCWTVKVQOFIE-SKDRFNHKSA-N	429.271	1.693	50	20	IDGD	
C=CCOCCCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1	1824499277	NNKNTMSAUKUXGV-QFIPXVFZSA-N	442.365	1.583	50	20	IDGD	
C=C(C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(B(O)O)cc1)CC2)C(F)(F)F	1825263922	BWQYMRXEKQATGA-LBPRGKRZSA-N	439.224	1.167	50	20	IDGD	
CC[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CN1CCOC1=O)CC2	1825441013	ISKNUJLFZQGCRO-NXEZZACHSA-N	445.339	1.681	50	20	IDGD	
C[C@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)C[C@](C)(O)CC(=O)O)sc2C1	1826078530	UULAGXJLRYGYRW-BEPCFFQHSA-N	448.339	1.454	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CC[C@@H](N)C(N)=O)CC1	1826935465	QGGIZAIJRZDDQW-VCBZYWHSSA-N	435.396	1.435	50	20	IDGD	
O=C(c1ccc(F)nc1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827051826	HGXCRSUJMLGNOM-FQEVSTJZSA-N	439.296	1.448	50	20	IDGD	
O=C1NCCn2nc(C(=O)N3CCC([C@@H]4CCCCN4C(=O)[C@@H](F)Cl)CC3)cc21	1827607144	QWVHPTZAQNARDH-GOEBONIOSA-N	425.892	1.394	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H]2CC2(F)F)CC1	1828924428	SEMVMHOTQFMDCX-IRXDYDNUSA-N	435.475	1.574	50	20	IDGD	
Cc1n[nH]cc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1	1829742820	PTIQKEQWTTZLLY-IBGZPJMESA-N	439.520	1.264	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CN2CC(=O)NC2=O)CC1	1830313844	ORHYWXNIUUYIFZ-AUUYWEPGSA-N	447.363	1.394	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3c[nH]c4ncccc34)C2)C1	1830362196	NTFHKFFXUFTYHM-NRFANRHFSA-N	434.924	1.898	50	20	IDGD	
O=C(C#Cc1ccc(Cl)cc1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1830468753	SPSBKVAROSNIBR-MJGOQNOKSA-N	429.275	1.682	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1C[C@H]1C1CC1)CCO2	1830490382	TVOOTHZKSGEBIF-UEABVUSTSA-N	429.355	1.520	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)ccc2O)CC1	1830765888	QJBWGKMKUKMUBQ-IBGZPJMESA-N	446.548	1.704	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2nc[nH]c2[N+](=O)[O-])CC1	1831832375	GQGWHVIFUGGNRB-UONOGXRCSA-N	427.889	1.805	50	20	IDGD	
O=C([C@H](F)Br)N1CCOC[C@@]2(C1)CN(C(=O)C(F)(F)C(F)F)CCO2	1832190373	VYFIATIQDPSREL-QPUJVOFHSA-N	439.175	1.034	50	20	IDGD	
Cn1cnc(C(=O)N2CCC(N3CCC(NC(=O)CCBr)CC3)CC2)c1	1834421044	ANKXQISERRLRFS-UHFFFAOYSA-N	426.359	1.390	50	20	IDGD	
Cc1cc(F)cc(C(=O)N2CCOC[C@]3(CN(C(=O)CCBr)CCO3)C2)c1	1834823739	HOZMNYGLSXWUPL-IBGZPJMESA-N	443.313	1.989	50	20	IDGD	
CCN(CC)C[C@H](C)C(=O)N1CCOC[C@@]2(CN(C(=O)CCBr)CCO2)C1	1834825347	XTDXEMCDYUBMPO-QFBILLFUSA-N	448.402	1.206	50	20	IDGD	
O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)COc1ccccc1)CCO2	1834949523	PSGYWJHDPWDWLX-LJQANCHMSA-N	441.322	1.307	50	20	IDGD	
CC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)[C@H](C)N3C[C@@H]4C[C@H]4C3)CC2)CC1	1836397353	YCCOHKZSVMEMFZ-BOSXTWCSSA-N	425.017	1.916	50	20	IDGD	
O=C(c1cc(Cl)ncn1)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836718191	JOHHMAQUPWOPEJ-HNNXBMFYSA-N	431.320	1.342	50	20	IDGD	
O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(F)nc1)CCO2	1837843349	HKCJEASKPGIYIN-QGZVFWFLSA-N	430.274	1.076	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)c(C)n1C	1838384895	MSMSGVWXLRYVJH-YJBOKZPZSA-N	446.317	1.402	50	20	IDGD	
COCc1c[nH]c(C(=O)N2CCO[C@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)c1	1838512004	DTIXWCGFYAKDDT-HXUWFJFHSA-N	427.929	1.496	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)CN3CCCCC3)C2)C1	1839151825	FCMHKEBRXOPQLR-OALUTQOASA-N	436.380	1.165	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(F)n3)C2)C1	1839965188	PWKRLFYLTKAZNA-UGSOOPFHSA-N	444.301	1.464	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3ccoc3)CCO2)C1	1840516886	QUFZMSMIAHTGMX-KSSFIOAISA-N	429.311	1.452	50	20	IDGD	
Cc1cccc(F)c1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1840651520	CCOYVUHWUGLUSV-CRAIPNDOSA-N	447.276	1.895	50	20	IDGD	
C[C@@]1(C(=O)N2CCO[C@]3(COCCN(C(=O)CCBr)C3)C2)CC1(F)F	1840825027	UKHNIIFBXLUYJZ-GJZGRUSLSA-N	425.270	1.273	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC12CN(C(=O)C(F)(F)C(F)(F)C(=O)O)C2	1841285911	XKMIZERLVBJVKF-QMMMGPOBSA-N	433.196	1.576	50	20	IDGD	
O=C(c1ccc(Br)c([N+](=O)[O-])c1)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1	1841352704	HJJRDPFYEONOLZ-CYBMUJFWSA-N	446.685	1.774	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)Cc2[nH]nc3c(Cl)cccc23)C1	1845024903	AJGGXXHGELHCHP-UHFFFAOYSA-N	446.939	1.335	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@H]2CCCN2C(=O)OC(C)(C)C)C1	1846202452	JOVBDQVLNWNJKF-CABCVRRESA-N	429.945	1.843	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)c1ccc(OC)c(Br)n1)C2	1846363110	PXXAWTQRLAQUDM-NSHDSACASA-N	446.729	1.924	50	20	IDGD	
CC#C[C@@H](CC(=O)N1CCCC12CN(C(=O)c1cccc(B(O)O)c1)C2)c1ccc(O)cc1	1846413851	YKQJGQUKZXTCLQ-IBGZPJMESA-N	446.312	1.086	50	20	IDGD	
O=C(Cc1cc(F)ccc1Br)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl	1847556284	HBVRNSRMOQLQTI-KKUMJFAQSA-N	433.705	1.932	50	20	IDGD	
CC(C)(C)OC(=O)N1CCCC[C@H]1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl	1847562569	AXILPMJTCXMNJG-YHUYYLMFSA-N	429.945	1.578	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)Cn1c(=O)[nH]c(=O)c2ccccc21	10286741	ZWWHJZBDHYQGPI-UHFFFAOYSA-N	435.465	1.583	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)c1ccc2c(c1)C[C@@H](C)N2S(C)(=O)=O	14842324	MNCMCOBXAXMYSW-GFCCVEGCSA-N	427.486	1.428	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)CCCN1C(=O)NC(C)(C)C1=O	18052503	UHBKZFAYNUCBCK-CQSZACIVSA-N	426.473	1.865	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1	110883388	SQYFNXIJILPSCP-UHFFFAOYSA-N	442.457	1.978	50	20	IDGD	
CN(C(=O)OC(C)(C)C)[C@H]1CCCN(CC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)C1	725812158	BYHHVZIPNPUJSE-INIZCTEOSA-N	435.481	1.687	50	20	IDGD	
C[C@H]1CCCCN1Cc1ccc(CNC(=O)NNC(=O)CNC(=O)c2ccco2)cc1	725872271	MHERPNQJORXLRY-INIZCTEOSA-N	427.505	1.914	50	20	IDGD	
O=C(CC1CCCCC1)NCCNC(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	726261661	QYPWWPYSKOUOFK-UHFFFAOYSA-N	428.493	1.609	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)NCc2ccc([C@]3(C)NC(=O)NC3=O)cc2)c1	726282771	SGKMUZSZSHWVCZ-QFIPXVFZSA-N	439.472	1.267	50	20	IDGD	
C[C@H](NC(=S)NNC(=O)N[C@@H]1CCS(=O)(=O)C1)c1ccc(Cl)cc1Cl	726476205	GXIBCPVXQULOPU-WCBMZHEXSA-N	425.363	1.920	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2oc3ccccc3c2CS(C)(=O)=O)cc1C	726630315	DEKXEPOKJCQSDW-UHFFFAOYSA-N	443.481	1.994	50	20	IDGD	
O=C(CNC(=O)NCc1ccc(F)cc1)NNc1ccc(S(=O)(=O)NC2CC2)cc1	726862823	CZXQBGIMRKBHBU-UHFFFAOYSA-N	435.481	1.209	50	20	IDGD	
CC(=O)N[C@@H](CC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)c1c(F)cccc1F	727303612	WROPTDUBZAGDFF-INIZCTEOSA-N	439.440	1.397	50	20	IDGD	
CNS(=O)(=O)c1cccc([C@H](C)NC(=O)NNC(=O)c2ccc3c(c2)OCCO3)c1	727607987	JTQJPJVNWNDICW-LBPRGKRZSA-N	434.474	1.071	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNS(=O)(=O)c2cc3c(cc2[N+](=O)[O-])OCCO3)c1	728260564	IWYFXKCUHKMIEE-UHFFFAOYSA-N	439.402	1.007	50	20	IDGD	
COc1ccc(CCCC(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1	728338620	FMIKSUGSHRYUQI-LJQANCHMSA-N	428.441	1.549	50	20	IDGD	
O=C(C[C@@H](NC(=O)c1ccccc1)c1ccccc1)NNC(=O)[C@@H]1CCS(=O)(=O)C1	728371598	ADUKGLHABCIILQ-QZTJIDSGSA-N	429.498	1.130	50	20	IDGD	
CCOC(=O)C1=NN(c2ccccc2)[C@H](C(=O)NNC(=O)Cc2nc3ccccc3n2C)C1	728712762	DFIZNSWGKQDKNV-IBGZPJMESA-N	448.483	1.461	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)c1ccc(I)c(F)c1	729180659	GKLJWHWMKKQICA-UHFFFAOYSA-N	447.229	1.683	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)CCCc2ccc3c(c2)CC(=O)N3)c1	729297881	KLPDZIZISFCAAK-UHFFFAOYSA-N	444.513	1.215	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc2c(c1)CCCC2)NNC(=O)CCc1ccccc1O	730034469	UXQWXDLGBSTUFL-UHFFFAOYSA-N	445.541	1.720	50	20	IDGD	
O=C(NNC(=O)C1CCN(S(=O)(=O)c2cccnc2)CC1)c1cccc2ncccc12	730226752	XLZUKZQUBYFLTH-UHFFFAOYSA-N	439.497	1.492	50	20	IDGD	
CN(Cc1cnn(-c2ccccc2)n1)C(=O)NNC(=O)c1csc(N2CCOCC2)n1	730577861	CTAYSWQDBNIHTR-UHFFFAOYSA-N	442.505	1.047	50	20	IDGD	
Cc1cccc(N2C(=O)N[C@@H](CCC(=O)NNC(=O)c3nnc(O)c4ccccc34)C2=O)c1	730767744	KRTRJYFNRNJILO-INIZCTEOSA-N	448.439	1.310	50	20	IDGD	
COCCN1C(=O)c2ccc(C(=O)NNC(=O)C(C)(C)c3ccccc3)cc2S1(=O)=O	731175510	YYBKLNMNMFCWOA-UHFFFAOYSA-N	445.497	1.216	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2nnc(O)c3ccccc23)nnn1-c1cccc2cnccc12	731186369	MZJSKMFCONCABI-UHFFFAOYSA-N	440.423	1.848	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)NCCCNC(=O)c2ccc(F)cc2)cc1OC	732248918	LARAKYIVNMRDKJ-UHFFFAOYSA-N	432.452	1.997	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@@H]2CC(c3cc(F)ccc3F)=NO2)cc(OC)c1OC	732629062	GJNMFMWGBSOYMZ-KRWDZBQOSA-N	435.383	1.945	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCCC(=O)Nc1ccccc1	733336657	XWRXDNMNNARNCQ-UHFFFAOYSA-N	432.506	1.261	50	20	IDGD	
N#Cc1ccc(N2C(=O)N[C@@H](CCC(=O)NNC(=O)CCCc3ccccc3)C2=O)cc1	733758303	RDVRRBXYPRWBFB-IBGZPJMESA-N	433.468	1.934	50	20	IDGD	
CCCc1nnc(S)n1CC(=O)NNc1ccccc1S(=O)(=O)NC(C)(C)C	734253038	PNCGYUYHUTYGNE-UHFFFAOYSA-N	426.568	1.739	50	20	IDGD	
C[C@@H]1CN(C[C@@H](C)C(=O)NN=Cc2ccccc2OCC(=O)NCC2CC2)C[C@@H](C)O1	734746575	ZUIUPJVPCMDNOK-KZNAEPCWSA-N	430.549	1.787	50	20	IDGD	
CN(C)CC[C@H](NC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)C(C)(C)C	734954469	UZJIANVXUVVMOI-FQEVSTJZSA-N	432.613	1.896	50	20	IDGD	
C[C@@H](Cc1ccc(F)cc1)C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	735118561	WTMZTXNDCLRZAX-HNNXBMFYSA-N	435.525	1.479	50	20	IDGD	
COC[C@H](NC(=O)NNC(=O)CNC(=O)c1ccco1)c1cccc(C(F)(F)F)c1	735761429	PNXPPPQDSOXOGQ-ZDUSSCGKSA-N	428.367	1.746	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)COCc1ccccc1)c1ccc(S(=O)(=O)N(C)C)cc1	738985365	NINIALOUIFGUKQ-HNNXBMFYSA-N	434.518	1.545	50	20	IDGD	
O=C(NNC(=O)c1csc(NC2CC2)n1)c1ccc(S(=O)(=O)N2CCCC2)cc1	740749729	MWZFDMQUVGNKGH-UHFFFAOYSA-N	435.531	1.577	50	20	IDGD	
CS(=O)(=O)[C@@H]1CCC[C@H](NC(=O)NNC(=O)c2ccc(F)cc2Br)C1	741093352	PQBASXXQTXALAR-WDEREUQCSA-N	436.303	1.888	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)c2ccc(S(=O)(=O)CC(=O)N(C)C)cc2)c1	742033241	KZPWFSDHSKARTO-UHFFFAOYSA-N	447.513	1.005	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1c[nH]cc1-c1ccc2c(c1)OCCO2	742066517	DFGXRDUJVYQCOK-UHFFFAOYSA-N	448.483	1.921	50	20	IDGD	
CCO[C@H](C)c1ncc(C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)s1	742470851	BGQZENRCRMWPAB-CYBMUJFWSA-N	440.547	1.631	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)c1cn(Cc2ccccn2)nn1	742471989	VYELEHUMVOWVHJ-UHFFFAOYSA-N	431.250	1.324	50	20	IDGD	
O=C(NCc1coc(-c2ccccc2)n1)NNC(=O)c1csc(N2CCOCC2)n1	743510193	RKAXCWQDPMPICC-UHFFFAOYSA-N	428.474	1.779	50	20	IDGD	
CCO[C@@H](C)c1nc(CN2CCN(CC(=O)NNC(=O)c3ccc(F)cc3)CC2)cs1	744412606	HBXQUVJIYAVKIS-HNNXBMFYSA-N	449.552	1.959	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)CCNC(=O)c2ccc3ccccc3c2)c1	744677904	MQEPVXCIDQJCAW-UHFFFAOYSA-N	444.447	1.836	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)c1	745093296	KDKYBIMHAHEJIE-IBGZPJMESA-N	438.459	1.914	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NC[C@H](C)Oc2ccc(OC)cc2)c2ccccc2c1=O	745900409	WUMOISJNMIYMLI-AWEZNQCLSA-N	439.472	1.837	50	20	IDGD	
CC[C@@H](C)NS(=O)(=O)c1ccc(C(=O)NNC(=O)Cc2cn3ccccc3n2)cc1	746545900	YYZOEGCYLMTCRD-CQSZACIVSA-N	429.502	1.415	50	20	IDGD	
C[C@@H](CN(C)C(=O)OC(C)(C)C)C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	746815616	AUOYRPDKMQPERX-ZDUSSCGKSA-N	442.538	1.201	50	20	IDGD	
O=C(CCOc1ccccc1)NNC(=O)[C@H]1CCCN(S(=O)(=O)c2ccccc2)C1	747177592	LOUKWVVHMZKUPL-KRWDZBQOSA-N	431.514	1.704	50	20	IDGD	
Cc1ccc(C(=O)NNS(=O)(=O)c2ccc(C(=O)O)c(Br)c2)c(O)c1	747606276	DBCJFOCEEZUFOE-UHFFFAOYSA-N	429.248	1.785	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)CNc3cccc(Cl)c3)cc2)CC1	748618775	GWBSNSNRBVOJAM-UHFFFAOYSA-N	437.953	1.831	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CC(=O)N(c2cn[nH]c2)C1)c1ccc(Br)cc1Cl	748849859	YBEBRPGXSAYJAJ-MRVPVSSYSA-N	426.658	1.640	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)N[C@@H]1CCN(CCCc2ccccc2)C1=O	750292951	VJPSDKAURIDNPP-QGZVFWFLSA-N	426.473	1.335	50	20	IDGD	
O=C(NNC(=O)C1CCC(NC(=O)C2CCCC2)CC1)c1csc(N2CCOCC2)n1	751293381	HCEDLLKRFQHDDB-UHFFFAOYSA-N	449.577	1.606	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(CCC(=O)NNC(=S)N[C@H](C)C2CC2)cc1	751617822	BZAVOBQEIDETAE-CQSZACIVSA-N	426.608	1.944	50	20	IDGD	
C[C@H](NC(=S)NNC(=O)c1cccc(S(=O)(=O)NC[C@@H]2CCCO2)c1)C1CC1	751620970	NDOPJNRAPKKHPU-WFASDCNBSA-N	426.564	1.051	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)NC[C@H]3CCC[C@@]34NC(=O)N(C)C4=O)n[nH]2)cc1	753021981	KYERSBJZTOQPKF-SPLOXXLWSA-N	439.476	1.050	50	20	IDGD	
CCn1cc([C@H]2C[S@](=O)CCN2C(=O)NNC(=O)c2cccc(OC(F)F)c2)cn1	753130497	MICCTJMJIHIHAM-DHMKHTPVSA-N	441.460	1.664	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)NCC2(CO)CCC2)cc1	753289168	AHENDNBWAGSRPQ-GZTJUZNOSA-N	437.500	1.620	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)c1ccc(CNS(C)(=O)=O)o1	753566582	SCLGAZOLCYJKGV-UHFFFAOYSA-N	434.499	1.836	50	20	IDGD	
CC(C)C(=O)NCCCNC(=O)NNC(=O)[C@H](C)Oc1cccc(Br)c1	756050729	MKKPMHWQJRBMNI-LBPRGKRZSA-N	429.315	1.709	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)Nc2cccnc2N2CCOCC2)cc1	756184057	QXBKAUZBNJSLAA-HNNXBMFYSA-N	429.477	1.937	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Nc2ccc(C)c(S(N)(=O)=O)c2)ccc1OC(C)C	756638725	REVAWJGQIIGVKU-UHFFFAOYSA-N	436.490	1.905	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)Nc2ncn(CC(=O)N(C)C)n2)cc1OC	756771091	QRRAIDXWCMMWJM-UHFFFAOYSA-N	433.469	1.020	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)CSc2ccc(C(N)=O)cc2[N+](=O)[O-])c(OC)c1	757179110	BJJOJJUPDHYYRI-UHFFFAOYSA-N	434.430	1.724	50	20	IDGD	
CS(=O)(=O)Cc1ccc(NC(=O)NNC(=O)c2nnc(O)c3ccccc23)cc1F	757676641	VOXRFKQABMNRFC-UHFFFAOYSA-N	433.421	1.486	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)Nc2ccc(F)c(S(=O)(=O)NC3CC3)c2)c1O	757872164	UHGJRWPTIPIOOJ-UHFFFAOYSA-N	438.437	1.447	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)[C@H](C)Sc1ccnc2cc(Cl)ccc12	758031651	XMEJIKRQZAAJQY-UWVGGRQHSA-N	430.939	1.454	50	20	IDGD	
Cc1ccn2c(=O)c(C(=O)NN(C)C(=O)N3CCN(C(=O)OC(C)(C)C)CC3)cnc2c1	758782716	XMKKQDGIEWISKX-UHFFFAOYSA-N	444.492	1.252	50	20	IDGD	
Cn1cc(-n2cc(C(=O)NNC(=O)c3cc(F)ccc3Br)ccc2=O)cn1	760813975	MTACWEMSYLKSTK-UHFFFAOYSA-N	434.225	1.547	50	20	IDGD	
CC[C@H](NC(=O)NNC(=O)COc1ccccc1O)[C@@H]1CN(Cc2ccccc2)CCO1	760900087	URFMHOQDFXSJFV-RXVVDRJESA-N	442.516	1.781	50	20	IDGD	
Cc1c(I)cccc1C(=O)NNC(=O)CCN1C[C@H](C)O[C@@H](C)C1	760986464	ALLGVUUCCPDTCH-RYUDHWBXSA-N	445.301	1.860	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2cc(S(C)(=O)=O)ccc2Cl)n1	761272870	OWAAUCMTNOXOBX-UHFFFAOYSA-N	445.906	1.055	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)c2ccccc2c1=O	761788386	UVZMFTQQWAHRDV-GOSISDBHSA-N	448.483	1.069	50	20	IDGD	
O=C(NNc1nccc(N2CCOCC2)n1)c1csc(-c2ccc3c(c2)OCO3)n1	762865131	IYURYAKIPJLXOY-UHFFFAOYSA-N	426.458	1.922	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)c2cccc(S(=O)(=O)NC[C@H]3CCCO3)c2)n1	762905944	BZVTYFBXTJZJAS-MRXNPFEDSA-N	448.549	1.537	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)NC1Cc2ccccc2C1	763153889	UXFNERMWGSEWFE-UHFFFAOYSA-N	428.514	1.583	50	20	IDGD	
CCCOC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(OC)c(OC)c2)cc1	763551317	OFZZPAHCLKIUPA-UHFFFAOYSA-N	429.429	1.670	50	20	IDGD	
CCOc1cc2c(cc1NC(=O)C(=O)NNC(=O)COc1ccccc1OC)O[C@H](C)C2	763645774	BALJIDMACRMCPT-CYBMUJFWSA-N	443.456	1.582	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(Br)c(F)c2)cc1	763682158	RRURYJURFRLCLM-UHFFFAOYSA-N	435.209	1.625	50	20	IDGD	
COCCc1cc(NC(=O)C(=O)NNC(=O)CSc2ccc(Cl)cc2)n(C)n1	763736049	RQOXPYVQEMAJFK-UHFFFAOYSA-N	425.898	1.141	50	20	IDGD	
COc1cc(OC)c(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)cc1Cl	763746516	ZXIFUECDEJSBIL-UHFFFAOYSA-N	446.891	1.896	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)C(=O)Nc2cccc(F)c2F)c2ccccc2c1=O	763791570	VUSPGOIPXDJNNG-UHFFFAOYSA-N	429.383	1.655	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)cc1C	763849290	KRMWHCSXQXXUPF-OAHLLOKOSA-N	427.457	1.952	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc3ccccc3c2)ccc1C(N)=O	763856038	XMSWVXTXWSPZEW-CQSZACIVSA-N	434.452	1.801	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)OC)cc2)cc1	763859456	BMNAPAZMWMUFSU-CYBMUJFWSA-N	429.429	1.425	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@H](C)C(=O)NNC(=O)C(=O)Nc1ccn(CC(F)F)n1	763884802	YBVMSPDOKVHNBT-LLVKDONJSA-N	443.838	1.972	50	20	IDGD	
CC(C)CC(=O)NNC(=O)C(=O)Nc1cnn(C2CCN(C(=O)OC(C)(C)C)CC2)c1	763887847	CZRSVGSHDUDAQP-UHFFFAOYSA-N	436.513	1.587	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cnn(-c3ccncc3)c2)cc1OC	763911822	OCYSVSLBGKJTQS-UHFFFAOYSA-N	438.444	1.464	50	20	IDGD	
CCC1CCC2(CC1)NC(=O)N(CC(=O)NNC(=O)CSc1ccccc1O)C2=O	764045273	IACPVYUSFTYHMP-UHFFFAOYSA-N	434.518	1.523	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)nc1)C(=O)Nc1ccc(I)cc1	764100000	FYBIHLDOQXPYPM-UHFFFAOYSA-N	444.616	1.739	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2cccc(Cn3cccnc3=O)c2)cc1	764127341	SETHZUXGLBAHIE-UHFFFAOYSA-N	449.467	1.019	50	20	IDGD	
C[C@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(NC(=O)C(=O)NNC(=O)c3ccoc3)cc2)C1	764163837	MUBLUPBJTJLNJP-OKILXGFUSA-N	448.501	1.346	50	20	IDGD	
CC(C)CCC(=O)NNC(=O)C(=O)Nc1cccc(S(=O)(=O)/N=C2\CCCN2C)c1	764203244	REEAJLNOTZHJPD-XQNSMLJCSA-N	437.522	1.022	50	20	IDGD	
O=C(CCCc1cccs1)NNC(=O)C(=O)Nc1cccn(CC(F)(F)F)c1=O	764339454	MBWFFMADKPAOLM-UHFFFAOYSA-N	430.408	1.581	50	20	IDGD	
COc1cc(OC)c(OC)cc1NC(=O)C(=O)NNC(=O)CSc1ccccc1O	764400826	IIUVQNWLOLMLFM-UHFFFAOYSA-N	435.458	1.296	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)C(=O)Nc1ccc(N2CCOCC2)c(F)c1	764404354	JJTCFHAATGTPGL-UHFFFAOYSA-N	448.476	1.246	50	20	IDGD	
Cc1c(Br)cc(C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)c(=O)n1C	764743120	MLRJQHGFQOBRFR-JTQLQIEISA-N	426.242	1.824	50	20	IDGD	
CCOc1ccccc1C(=O)NCC(=O)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	765607672	RNHJFWMVDGIMAM-UHFFFAOYSA-N	425.420	1.806	50	20	IDGD	
O=C(COC(=O)[C@H]1CC(=O)N(c2ccc(Cl)c(F)c2)C1)NNC(=O)c1cccs1	766977614	RQFXXSWVMGIDJO-JTQLQIEISA-N	439.852	1.898	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)CCn1cnc2sccc2c1=O	767267316	DXHVLKFQVXETGN-UHFFFAOYSA-N	428.470	1.090	50	20	IDGD	
CC(=NNC(=O)C[C@@H](C(=O)NN=C(C)c1cscn1)N1CCOCC1)c1cscn1	767900890	OCYVBEOBYNELMK-INIZCTEOSA-N	449.562	1.071	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)c1ccc([N+](=O)[O-])c(O)c1	768292093	UDJQZPOEZSSZRO-UHFFFAOYSA-N	447.879	1.533	50	20	IDGD	
O=C(CC12CC3CC(CC(C3)C1)C2)NCC(=O)NNC(=O)c1ccc2c(c1)OCCO2	770428625	YQYDQWZAWLKUTC-UHFFFAOYSA-N	427.501	1.942	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)NCC1CCN(S(C)(=O)=O)CC1	770445447	GQWGPCFQDSANGE-LBPRGKRZSA-N	432.930	1.109	50	20	IDGD	
C[C@H](NC(=O)c1n[nH]c2ccccc12)C(=O)NNc1nc(O)c2cnn(C(C)(C)C)c2n1	770966392	SVBUZEWAMAEVBT-JTQLQIEISA-N	437.464	1.425	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)Cc2cc(Br)ccc2F)c2ccccc2c1=O	771231000	YDXUXZLWBOOTHJ-UHFFFAOYSA-N	433.237	1.839	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)CCC[S@@](=O)c1ccc(Br)cc1	772135522	HKWYXKJFDNZYED-JPQMIFPKSA-N	433.324	1.826	50	20	IDGD	
O=C(CC[C@@H]1Cc2ccccc2NC1=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772195674	NMSCPFFRZJBJEA-OAHLLOKOSA-N	428.876	1.695	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)Nc1ccc(OCC(F)F)c(C(F)(F)F)c1	772538379	PZWYTBIKBBTDHK-QMMMGPOBSA-N	445.366	1.937	50	20	IDGD	
CC(=O)NC[C@@H]1CCn2ncc(C(=O)NNC(=O)[C@@H](C)Oc3cccc(Cl)c3)c2C1	772994314	KCMBWYAPLGUVPU-TZMCWYRMSA-N	433.896	1.464	50	20	IDGD	
COCCCS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2cnc3ccccc3n2)cc1	773717632	CZGXFUGQPOZYNU-UHFFFAOYSA-N	443.485	1.522	50	20	IDGD	
C[C@H]1CN(C(=O)Cn2cc(NC(=O)C(=O)NNc3cccc(Cl)c3)cn2)C[C@H](C)O1	773745125	VHGXLBOAZVKGGJ-STQMWFEESA-N	434.884	1.254	50	20	IDGD	
CS(=O)(=O)Nc1ccc(OCCNC(=O)NNC(=O)c2ccc(Cl)cc2F)cc1	773786814	KKHJARLAIVSWNW-UHFFFAOYSA-N	444.872	1.874	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNc2nccnc2C(C)C)cccc1C(=O)N1CCOCC1	774000161	PNMKTZXXSADNJJ-UHFFFAOYSA-N	426.477	1.463	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)Nc2ccnn2[C@H]2CCS(=O)(=O)C2)o1	776056620	MDAUKBWZRZTYBZ-ZDUSSCGKSA-N	438.510	1.144	50	20	IDGD	
CN(NC(=O)c1csc(-c2cnn(C)c2)n1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776201159	GCDYJWCHXRGLSY-UHFFFAOYSA-N	449.537	1.793	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)N[C@@H]2CCN(C(=O)CCc3ccccc3)C2)c1	776626863	CBNUOYADVZLHSU-GOSISDBHSA-N	430.530	1.950	50	20	IDGD	
CC[C@@H](C)C(=O)N1CCC[C@@H](C(=O)N2CCN(S(=O)(=O)CBr)CC2)C1	777836306	IKBIONTZSWWJIM-ZIAGYGMSSA-N	438.388	1.098	50	20	IDGD	
Cc1nn(C)c(-n2cccn2)c1C(=O)NNC(=O)[C@@H](C)Oc1cccc(Br)c1	778297485	NEMXAWVSKCMVSA-GFCCVEGCSA-N	447.293	1.905	50	20	IDGD	
Cn1c(SCC(=O)NNC(=O)CNC(=O)OC(C)(C)C)nnc1-c1cccs1	778438756	XKLIRQYWDHXGKS-UHFFFAOYSA-N	426.524	1.308	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cnn(C)c2C(F)(F)F)cc1OC	782119912	BAZZDYQCEUVXPP-UHFFFAOYSA-N	443.382	1.636	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cnn(C)c2C(F)(F)F)c1C	782121051	QKQPPJKFCSCNQR-LLVKDONJSA-N	427.383	1.609	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NN=C[C@@H]1CCSC1)N(S(C)(=O)=O)CC2	782168341	CSSTZCIOPBHPRC-BBRMVZONSA-N	441.575	1.808	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2ccc(O)cc2)cc(OC)c1Br	782833352	GKXXHHJFFHKTHL-UHFFFAOYSA-N	438.234	1.572	50	20	IDGD	
CN(C)c1nc2cc(NC(=O)C(=O)NNC(=O)Cc3nc4ccccc4n3C)ccc2o1	782888896	XEBNTQRWHKXDJN-UHFFFAOYSA-N	435.444	1.109	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2ccc(S(=O)(=O)/N=C3\CCCN3C)cc2)cc1	783021744	HLWSXXZYLQCTIN-HKOYGPOVSA-N	445.501	1.590	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2ccc(C)c(S(=O)(=O)NC3CC3)c2C)cc1	783035618	XZBDAEGHSXSWIC-UHFFFAOYSA-N	432.502	1.835	50	20	IDGD	
Cc1ccc(NNC(=O)C(=O)Nc2ccc(C(=O)NCCN3CCOCC3)cc2)cc1	783343186	OUQMRUAYIOUJDO-UHFFFAOYSA-N	425.489	1.139	50	20	IDGD	
Cc1ccc(NNC(=O)C(=O)Nc2ccc(N(C)C(=O)CN3CCN(C)CC3)cc2)cc1	783346576	SIJQLHULUJYVBH-UHFFFAOYSA-N	438.532	1.287	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2cc(Cl)ccc2OC2CCCC2)CCS(=O)(=O)C1	783426680	JOAQVVNKHATQJN-SFHVURJKSA-N	429.926	1.798	50	20	IDGD	
COc1ccc(C(=O)N2CCCCCC2)cc1NC(=O)C(=O)NNc1cc(C)ncn1	783945549	MOXBHISNDPZEQZ-UHFFFAOYSA-N	426.477	1.892	50	20	IDGD	
COC(=O)c1cccc(C#Cc2cccc(NC(=O)C(=O)NNc3nccn(C)c3=O)c2)c1	785090662	WISIGHXJDXBSSF-UHFFFAOYSA-N	445.435	1.049	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(F)c(NC(=O)C(=O)NNc2ccc(C#N)c(Cl)c2)c1	785092036	PFWRTETYZMLXLL-UHFFFAOYSA-N	439.856	1.683	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2c(OC)cccc2S(C)(=O)=O)c(Cl)n1	785331302	SRMSBDMOEYGCPF-UHFFFAOYSA-N	428.854	1.238	50	20	IDGD	
O=C(Cc1cccc(C(F)F)c1)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	790556083	BTQJVFRUQWBVLO-UHFFFAOYSA-N	430.455	1.772	50	20	IDGD	
O=C(NNC(=O)c1ccc(F)cc1Br)C(=O)Nc1cccc(N2CCC2=O)c1	790952876	WYVAKUHHXXGHMC-UHFFFAOYSA-N	449.236	1.725	50	20	IDGD	
O=C(NNc1cccc(F)c1[N+](=O)[O-])C(=O)Nc1cc(N2CCNC2=O)ccc1Cl	790999676	WNFAIPXAZWIFEL-UHFFFAOYSA-N	436.787	1.999	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)CCC=C2)c1cccc(S(=O)(=O)N2CCOCC2)c1	791002033	AAGVFVMNNWNDGZ-UHFFFAOYSA-N	441.509	1.742	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)[C@@](C)(O)Cn2cc(C(F)(F)F)ccc2=O)c1	792013574	CKHNQGNBABUAMU-IBGZPJMESA-N	441.406	1.461	50	20	IDGD	
CC(C)(C)OC(=O)NCc1cccc(NC(=O)C(=O)NNc2nc3ccccn3n2)c1	792389801	XHDRDCQYBNGWDD-UHFFFAOYSA-N	425.449	1.836	50	20	IDGD	
C[C@](O)(CN1C(=O)NC2(CCCC2)C1=O)C(=O)NNc1ccccc1OC(F)(F)F	793877341	WFJRBUJEWNIXIY-INIZCTEOSA-N	430.383	1.644	50	20	IDGD	
Cc1nc(-c2ccccc2NC(=O)C(=O)NNC(=O)CNC(=O)c2cccs2)cs1	797070664	LUKOEWGLQWQVEY-UHFFFAOYSA-N	443.510	1.696	50	20	IDGD	
CC(=O)c1ccc(NC(=O)C(=O)NNC(=O)CNC(=O)OCc2ccccc2)cc1C	797368498	BNKOAZWJAARGIS-UHFFFAOYSA-N	426.429	1.210	50	20	IDGD	
CCN(CC)C(=O)COc1cccc(NC(=O)C(=O)NNC(=O)c2cccc(C)n2)c1	797369842	MZBGYWSQJGCLKA-UHFFFAOYSA-N	427.461	1.037	50	20	IDGD	
CS(=O)(=O)Cc1cccc(NC(=O)NNC(=O)CNC(=O)OCc2ccccc2)c1	797620672	UMMCVYJUVXFKFK-UHFFFAOYSA-N	434.474	1.310	50	20	IDGD	
COc1ccc(S(N)(=O)=O)c(OC)c1C(=O)NNC(=O)c1cc(C)nc2ccccc12	799007147	RXYLMWXOJWZFPC-UHFFFAOYSA-N	444.469	1.283	50	20	IDGD	
O=C(NNC(=O)N1CCC[C@@H](CN2CCOCC2)C1)c1ccc(Br)s1	799858328	RSSIKEMMWOPYJA-LBPRGKRZSA-N	431.356	1.909	50	20	IDGD	
Cn1nnc2c(C(=O)NNC(=O)COc3ccc(OCc4ccccc4)cc3)ccnc21	800796521	IZFLDJRCLOUYMH-UHFFFAOYSA-N	432.440	1.782	50	20	IDGD	
O=C(NNc1ccc(C(F)(F)F)nn1)c1ccc(F)c(S(=O)(=O)N2CCOCC2)c1	801178913	SBQYTVDMIVACFR-UHFFFAOYSA-N	449.386	1.412	50	20	IDGD	
O=C(CCCN1C(=O)c2ccc(Br)cc2C1=O)NNC(=O)N=c1cc[nH]cc1	802024809	KVPHYVYGDXBKAD-UHFFFAOYSA-N	446.261	1.495	50	20	IDGD	
O=C(NNC(=O)[C@H]1CC(=O)N([C@@H]2CCS(=O)(=O)C2)C1)Nc1ccc(Cl)cc1Cl	802088003	IHFQUWOFGYFPRO-GXSJLCMTSA-N	449.316	1.182	50	20	IDGD	
COc1ccc(C2=NO[C@H](CNC(=O)NNC(=O)c3nnc(O)c4ccccc34)C2)cc1	802359221	IUUUNDIQOOHHGD-AWEZNQCLSA-N	436.428	1.481	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)c1cccc(NN2C(=O)[C@H]3CC=CC[C@H]3C2=O)c1	802490860	YKYNPEJLGCMIND-KDURUIRLSA-N	448.479	1.977	50	20	IDGD	
CC(=O)N[C@](C)(C(=O)NNc1nccnc1C1CCC1)c1ccc(S(C)(=O)=O)cc1	805464561	KLQLTPVQNIJKAT-FQEVSTJZSA-N	431.518	1.642	50	20	IDGD	
O=C(Cn1cc(Cl)cn1)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	806345286	SOERQXPEVAOTBE-UHFFFAOYSA-N	439.906	1.860	50	20	IDGD	
C[C@@H](C#N)S(=O)(=O)c1ccc(NC(=O)NNC(=O)COc2ccc(C#N)cc2)cc1	806457932	CVLVBNLGVJVVRA-ZDUSSCGKSA-N	427.442	1.476	50	20	IDGD	
Cc1cc([N+](=O)[O-])ccc1NNC(=O)C(=O)Nc1ccc(C(=O)N2CCOCC2)c(F)c1	807455558	JWLXNVIYFPCTAY-UHFFFAOYSA-N	445.407	1.597	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN2CCC[C@H](CNS(=O)(=O)C3CC3)C2)cc1C	808771221	WCCFZHVMLUZZGI-CQSZACIVSA-N	442.607	1.174	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc3c(c2)CCCCC3=O)c1	809941233	YZNLFPLREAHUCS-UHFFFAOYSA-N	429.498	1.921	50	20	IDGD	
COc1ccc(CNC(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)cc1S(N)(=O)=O	812426897	MSBJDYJAQOJXLX-UHFFFAOYSA-N	436.534	1.389	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)N[C@H]1CCN(C(=O)OC(C)(C)C)C2(CCC2)C1	813793828	BCHWRWDSWSRIEY-CABCVRRESA-N	428.530	1.691	50	20	IDGD	
Cn1ncc(C(=O)NNC(=O)c2cc(Br)c[nH]2)c1I	814799652	OEOGYKLFNPTIJU-UHFFFAOYSA-N	438.023	1.190	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2ccc(Br)c(C#N)c2)c1	815565889	CUVCMDDCLVIDNF-UHFFFAOYSA-N	447.245	1.738	50	20	IDGD	
COC(=O)N1CCN(c2ccc(NC(=O)C(=O)NNc3c(C)cc(C)cc3C)cn2)CC1	815589212	LFBXNZBHZNZQPW-UHFFFAOYSA-N	440.504	1.977	50	20	IDGD	
CCOc1ccc(NNC(=O)C(=O)Nc2cccc(CN3CCC(C(N)=O)CC3)c2)cc1	815815818	SRDXZZGZBSZCAW-UHFFFAOYSA-N	439.516	1.864	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1	817054387	HYCJZMFYCISWMG-UHFFFAOYSA-N	430.446	1.788	50	20	IDGD	
CC[C@@H](C)[C@H](NC(=O)N1CCCC1)C(=O)NNc1ccccc1S(=O)(=O)N(C)C	817054821	ZUZAPEHGLSEVBL-PBHICJAKSA-N	425.555	1.600	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)NCc1ccc(C(=O)N2CCOCC2)cc1	913638287	DXDGNNHQGYZHOE-UHFFFAOYSA-N	446.891	1.965	50	20	IDGD	
N#C/C(=C/c1cn(CCC(N)=O)nc1-c1ccc(Br)cc1)C(=O)OCCO	914328221	JRVISPAAJZASPC-LCYFTJDESA-N	433.262	1.630	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)[C@@H]1CC(=O)N(CC(F)(F)F)C1	914710840	MFRNZIKAHGCTPB-SECBINFHSA-N	438.200	1.386	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)NC[C@H](c2cccs2)N2CCN(C)CC2)c1	915901050	DDCPTOAUUHDCKW-GOSISDBHSA-N	447.561	1.698	50	20	IDGD	
COc1cc(Br)cc(C=NNC(=O)Cn2nnc(-c3ccccc3)n2)c1O	915907418	LXDNPTLCZBLFMU-UHFFFAOYSA-N	431.250	1.967	50	20	IDGD	
Cc1oc(C(=O)NNC(=O)c2cc(Br)c[nH]2)cc1S(=O)(=O)N1CCCC1	916134008	YDRFKDMFQDNATB-UHFFFAOYSA-N	445.295	1.538	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)NCc2ccc(C(=O)N3CCOCC3)cc2)c1	916248398	CWBRANBQZOPKLX-UHFFFAOYSA-N	440.500	1.685	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)NCC(C)(C)N1CCN(C)CC1	916258711	FFVNREMTZLQTJV-QGZVFWFLSA-N	427.549	1.964	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)NCCNS(=O)(=O)c1cccc(Cl)c1	916294728	GLEYRMHVFDLMPP-UHFFFAOYSA-N	444.872	1.167	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NC[C@H]2CCS(=O)(=O)C2)ccc1OCCC(C)C	916375001	ATANUVAVEZXXGQ-CQSZACIVSA-N	427.523	1.499	50	20	IDGD	
CCCCNC(=O)c1ccc(CNC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1	916639769	ZASISIIIHCFPDS-IBGZPJMESA-N	426.473	1.887	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CN2CCN(C(=O)Cc3c[nH]c4ccccc34)CC2)cc1	917151815	FJIILMSWKWFUMO-UHFFFAOYSA-N	433.512	1.624	50	20	IDGD	
COc1ccc(S[C@H](C)C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1	917328242	OGBDBNDSCXMSST-ACJLOTCBSA-N	446.481	1.706	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)c1ccc(S(=O)(=O)NC[C@@H]2CCCO2)cc1	919822704	BJCRUINAYPGREV-KRWDZBQOSA-N	447.513	1.156	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)CCNS(=O)(=O)/C=C\c2ccccc2)cc1	919833006	OUXDKRBJSRPHGX-PEZBUJJGSA-N	431.514	1.756	50	20	IDGD	
NC(=O)c1ccc(/C=C/C(=O)N2CCC[C@H]2C(=O)NNC(=O)Cc2ccc(F)cc2)cc1	920033384	YLFBXTDKHKTZJB-UBIUBJKMSA-N	438.459	1.319	50	20	IDGD	
O=C(CCC(=O)N1CCOCC1)NNC(=O)c1cn(-c2ccccc2)nc1-c1ccccc1	920342267	VGVKSGIFKSAESR-UHFFFAOYSA-N	447.495	1.939	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)NC[C@H](c1cccc(F)c1)N1CCOCC1	921247596	IAZDKRXINWISGB-LJQANCHMSA-N	434.443	1.748	50	20	IDGD	
O=C(NNC(=O)c1cncn1-c1ccccc1)N[C@@H]1CC(=O)N([C@H]2C[C@@H]2c2ccccc2)C1	1116176454	YUCFZDHFZXVIKF-RLLQIKCJSA-N	444.495	1.973	50	20	IDGD	
CNC(=O)c1cccc(C(=O)NNC(=O)COc2ccc(OCc3ccccc3)cc2)n1	1319154357	XJKPDIIAOKRAMW-UHFFFAOYSA-N	434.452	1.860	50	20	IDGD	
C[C@H]1C[C@H](C)CC2(C1)NC(=O)N(CC(=O)NNC(=O)c1cncn1-c1ccccc1)C2=O	1319504488	IAWFBTMZNUVDDQ-GJZGRUSLSA-N	438.488	1.380	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@@H](C)[C@H](C)C(=O)NNC(=O)c2ccc(OC)cc2)cc1	1326288238	PQVRHJOIDALMSB-KBPBESRZSA-N	442.472	1.198	50	20	IDGD	
O=C(CCC(=O)N1CCN(c2ccccc2)CC1)NNC(=O)c1cncn1-c1ccccc1	1340494638	FYNVOPHIDMUHQL-UHFFFAOYSA-N	446.511	1.762	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnn4cccnc34)C2)C1	1778442753	YAEMEUCUUTZYAS-FZKQIMNGSA-N	436.310	1.204	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(CCN(C(=O)c3cn4cc(F)ccc4n3)C2)C1	1778541394	CJTQVYXECXOESH-SFHVURJKSA-N	439.285	1.702	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@]2(CN(C(=O)CCNC(=O)c3ccccc3)CCO2)C1	1779300543	VBZYBWYXILFKSI-QFIPXVFZSA-N	447.608	1.488	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H]1CC[C@H](O)CC1)C2)[C@H](F)Br	1780777706	ZKMQSSAWDFTPHD-ZURLZEQWSA-N	435.334	1.742	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)Cc3ccc(C(=O)OC)s3)C2)C1	1780899274	UZEPIIXVQKEBSF-KUHUBIRLSA-N	444.937	1.161	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H]1C[C@@]13C(=O)Nc1ccccc13)CCO2	1781221360	CPVGQUXIEFBXCQ-FRMGNDQPSA-N	431.920	1.744	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@](C)(Cl)CCl)C3)C2)ncc1[N+](=O)[O-]	1781230212	QNCRFRNBUFRMTR-QZTJIDSGSA-N	445.303	1.978	50	20	IDGD	
CC(C)(C)n1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)nn1	1781232443	UOTNWZRLMBFPEB-ROUUACIJSA-N	432.352	1.713	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](F)Br)C3)C2)cc1F	1781325087	IRPGDLSSUXPYNS-YOEHRIQHSA-N	433.249	1.968	50	20	IDGD	
Cn1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](F)Br)C3)C2)c2cccnc21	1781331848	QZWCDLHAVWHPFW-KBXCAEBGSA-N	439.285	1.707	50	20	IDGD	
O=C(c1ccc(O)c([N+](=O)[O-])c1)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781332920	KKUDPYFPXQCWPE-CZUORRHYSA-N	446.229	1.434	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)nc2nccn12	1781334120	VKENBGWXCUSBBO-CXAGYDPISA-N	440.273	1.172	50	20	IDGD	
CCOC(CC(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1)OCC	1781334349	LZUJZFJRCRZKOK-GDBMZVCRSA-N	425.295	1.296	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(CCN(C(=O)c3ccc([N+](=O)[O-])cc3F)C2)C1	1781552325	ZPTUAJZZARIYCP-QGZVFWFLSA-N	444.257	1.962	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@]2(CN(C(=O)Cc3cc[nH]n3)CCO2)C1	1782867352	RPQQQWZAVAIABH-NAVGAYGYSA-N	441.438	1.667	50	20	IDGD	
CCOC(=O)C1(C(=O)N2CC[C@@]3(CN(C(=O)[C@H](C)CBr)CCO3)C2)CC1	1782913119	QWWIWPDFFOQDOY-CXAGYDPISA-N	431.327	1.191	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cc4cccnn4c3)CCO2)C1	1783354151	UYRXKKJHUCECSA-LPHOPBHVSA-N	435.322	1.951	50	20	IDGD	
CC(C)[C@H]1CC[C@H](C(=O)N2CC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)CC1	1783370994	VWRZKUAZHCNUFT-KHCICDEESA-N	442.365	1.272	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3csc(C(F)(F)F)n3)CCO2)C1	1783877940	SEAFCSPUMPQQEG-MEBBXXQBSA-N	441.859	1.859	50	20	IDGD	
O=C(CCc1cccc([N+](=O)[O-])c1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21	1784881983	AEKFABFVLYLPEX-OWLYRPNTSA-N	439.896	1.107	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)Cc3cc(F)ccc3[N+](=O)[O-])C2)C1	1785533636	XTNACJLXUDYMFP-HNAYVOBHSA-N	443.859	1.360	50	20	IDGD	
O=C(Cc1ccc(F)cn1)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1	1788198975	OPNUDEQDVDVFSK-UHFFFAOYSA-N	447.275	1.891	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4cccnc4n3)[C@H]2C1	1788287286	RJPXWMBLWSRZFV-CUSZFKRNSA-N	432.908	1.477	50	20	IDGD	
COC(OC)C(=O)NC1(c2ccc(NC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)cc2)CCC1	1788644022	VAKSKNLLVOYQLJ-VULFUBBASA-N	441.488	1.873	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccnc3SC)[C@H]2C1	1789071277	UGRJMWQTRIWSGQ-HNKHHVNMSA-N	427.954	1.651	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nc4ccccn4n3)C[C@@H]21	1789866265	MRAIHQPJKRLEBD-WFTHSTBKSA-N	440.331	1.559	50	20	IDGD	
COC(=O)C12CC(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]4C3)(C1)C2	1789872354	SQPXFXNUEIWQBJ-VYCBZTLZSA-N	447.359	1.546	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C=C/C3CCCC3)[C@H]2C1	1789895912	KDEVCFSLKLRFFT-JIGQMWBCSA-N	441.532	1.025	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)Br)C[C@@H]21	1790610637	SBCLORUJEAVSFK-NDKCEZKHSA-N	435.315	1.311	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3C=CCN3)C[C@@H]21	1790694460	RKMJVIHDJYHYCB-SNVXUZMMSA-N	442.466	1.379	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cn3ccnc3C)C[C@@H]21	1790964425	PXLCBRAHNAYJGC-VGWMRTNUSA-N	427.343	1.345	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4ccnn4c3)C[C@@H]21	1791063709	QLCHLIWXNDKSSA-QCPWZWHMSA-N	435.322	1.711	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(OC)c(OC)c3)C[C@@H]21	1791254597	XHWAWAWOBIUBEE-FPXQBCRKSA-N	440.924	1.551	50	20	IDGD	
CC[C@@H](NC(C)=O)C(=O)NC1(c2ccc(NC(=O)CCC(=O)NN(C)C)cc2)CCC1	1791595690	MJBWZOKPNMLQNM-GOSISDBHSA-N	431.537	1.408	50	20	IDGD	
CC(C)n1cnc(C(=O)NC2(c3ccc(NC(=O)CCC(=O)NN(C)C)cc3)CCC2)n1	1791601769	XWAHJDKZAQFKHP-UHFFFAOYSA-N	441.536	1.980	50	20	IDGD	
C[C@H](Oc1ccccn1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21	1791622099	UDWGKJCIKDFZDF-SMSYFYOWSA-N	444.301	1.519	50	20	IDGD	
COc1ncc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)CBr)cc1C	1792870527	QZJZOKSHOONUNM-HNKHHVNMSA-N	440.338	1.633	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1sc3nccnc3c1N)C2	1793446880	QFXHLVQGHVEBBY-GFQSEFKGSA-N	437.953	1.884	50	20	IDGD	
COC[C@@H](C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN(C)NC(=O)NCc1ccccc1)C2	1793672790	VARVXDBTUBQWKE-RSPOEFSDSA-N	445.564	1.253	50	20	IDGD	
COc1cccc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Br)C3)n1	1794015371	OBXNYQQVBMIBTH-LZDSYCOUSA-N	444.301	1.303	50	20	IDGD	
Cc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCBr)nn1C(F)F	1795114996	WIFGGECTZVVXGO-GNXNZQSNSA-N	435.269	1.575	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCOc1ccccc1	1795120939	PGJQDYNOBUBBDD-ZXFNITATSA-N	425.323	1.829	50	20	IDGD	
CC(C)(C)c1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)ccn1	1796188304	NLCPIMXTLVKTRW-ACDBMABISA-N	435.333	1.625	50	20	IDGD	
O=C(/C=C/c1ccc(F)cc1F)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1	1796190096	UZUFOTHWCLMOLN-YWRWEQHZSA-N	440.255	1.610	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cnc[nH]1	1796334855	WSKFZZDZIUGECW-OACMFWKTSA-N	441.438	1.427	50	20	IDGD	
CC(C)(C)c1cnc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Br)C3)cn1	1796759367	YSEFFUFFDRLJSG-JLUCKKNBSA-N	443.317	1.668	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2ncsc2[nH]1	1797980662	XORNDYCGCHJQMT-NJBDSQKTSA-N	441.351	1.859	50	20	IDGD	
Cn1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Br)c(C(F)F)n1	1799347197	IHHGWKZUOVVMOC-UJYYTQATSA-N	439.232	1.251	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(F)cc([N+](=O)[O-])c1)C2)[C@@H](F)Br	1799348271	FSCDXHMIJBMPLJ-RDBQEKCUSA-N	448.220	1.628	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1(Br)CC1)C2)[C@@H](F)Br	1799348484	IYYGTQSQRGVFSU-UTINFBMNSA-N	428.096	1.194	50	20	IDGD	
CN(C)CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](Br)Cc1ccccc1	1800435491	ISDOOKOJCCRBNP-SFNKJDCFSA-N	438.366	1.144	50	20	IDGD	
CCC(=O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](Br)Cc1ccccc1)C2	1800480688	DKWJJEFJDWIPGM-KYHPRHEASA-N	437.334	1.561	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc3c1OCC3)C2	1800641300	XUEIXBKNKSQPIK-FSDCSDTHSA-N	437.334	1.998	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cn(C(C)(C)C)nn1)C2	1800760614	VZFSWBOQNGAYPF-FMSGJZPZSA-N	428.331	1.020	50	20	IDGD	
COc1cccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)Br)C3)c1C	1801652929	KRGIKRNGKKQDFO-ZJOBFFGXSA-N	425.323	1.990	50	20	IDGD	
COC(=O)C[C@H](NC(=O)OC(C)(C)C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](F)Cl)C2	1802020368	DCTSQXFLPXCEEP-WHRXGGIHSA-N	449.907	1.615	50	20	IDGD	
C#CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2	1802126520	IDWSNEOGFMMMMM-KHMAMNHCSA-N	431.892	1.027	50	20	IDGD	
COc1ccccc1OCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCC(=O)NN(C)C	1802334753	OJNZFWMVJKROSM-BJWYYQGGSA-N	432.521	1.085	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CC(=O)Nc1ccc(F)cc1)C2	1802336328	JYWQJEVXXLCKAO-BCDXTJNWSA-N	447.511	1.166	50	20	IDGD	
CCC(=O)N[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)CO[Si](C)(C)C)[C@@H]1c1cccnc1	1803435975	TYNSIYFDGCFSAE-OXFYSEKESA-N	434.613	1.854	50	20	IDGD	
O=C(/C=C/c1ccoc1)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1804313871	LXCOVXWLVSLOAS-SJUPYBQOSA-N	445.284	1.387	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC2(CCN(C(=O)[C@@H]3CCC(=O)NC3)CC2)C1	1805382414	FMHGEPSSJSUAQV-LSDHHAIUSA-N	428.371	1.775	50	20	IDGD	
CN(CC(=O)N1CCC2(CCCN(C(=O)[C@@H](O)CCl)C2)CC1)C(=O)c1ccccc1	1805517458	ISPVUAPBNAGXBA-SFHVURJKSA-N	435.952	1.590	50	20	IDGD	
O=C(c1cccc(N2CCOCC2)c1)N1CCC2(CCCN(C(=O)[C@H](O)CCl)C2)CC1	1805527231	WIICYGKMRRSYAQ-HXUWFJFHSA-N	449.979	1.968	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2cc3n(n2)CCNC3=O)[C@H]1c1cccnc1	1806084765	QTAALIHTOPDQPY-RLFYNMQTSA-N	444.923	1.359	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H](CNC(=O)CN2CCOCC2)[C@@H]1c1cccnc1	1806905409	MPVZUGCHTQELLB-NQIIRXRSSA-N	434.613	1.271	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)Cc2nnc(C)s2)[C@H]1c1cccnc1	1807538480	GLVDPBROMTYCHK-RVKKMQEKSA-N	437.953	1.744	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)[C@H]1CC[C@H]2CCC(=O)N2C1	1807727252	RRTMNHSWNNCYOR-KVIJGQROSA-N	448.951	1.088	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1CCN(C(=O)[C@@H]2CNC(=O)C2)[C@@H]1c1cccnc1	1808317794	KPSICLWJZZMDKC-BFIPOCKSSA-N	427.332	1.460	50	20	IDGD	
O=C1C[C@H](C(=O)N2CC[C@H](CNC(=O)[C@@H](F)Br)[C@H]2c2cccnc2)CCN1	1808678637	MDSUKHKSTQZCSS-UIBBOPPKSA-N	441.301	1.304	50	20	IDGD	
C[C@@H]1CCc2c(C(=O)NC[C@@H]3CCN(C(=O)[C@H](O)CCl)[C@@H]3c3cccnc3)n[nH]c21	1809250097	DPAXIHQWINHNHM-MGPHVCOZSA-N	431.924	1.774	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)c1ccc2nncn2c1	1809911953	WIRZOBHNMIBFNJ-LESCRADOSA-N	428.880	1.044	50	20	IDGD	
C/C=C/C=C\C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1	1810305958	RKNBXDMIHQWVMO-PWNNCYNXSA-N	434.500	1.532	50	20	IDGD	
C[C@H](C(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)n1ccccc1=O	1810515706	TVIVRQBJMRNAPX-WMEZAQDKSA-N	432.908	1.110	50	20	IDGD	
CCC[C@H](NC(C)=O)C(=O)N1CC[C@H](CNC(=O)[C@@H](Cl)COC)[C@@H]1c1cccnc1	1813037359	FSFLTTZXUFUNEI-XWSJACJDSA-N	438.956	1.646	50	20	IDGD	
Cn1cc(CC(=O)NC[C@@H]2CCN(C(=O)[C@@H](F)Br)[C@H]2c2cccnc2)cn1	1813458810	AEJLHVMEXSFMAK-BHYGNILZSA-N	438.301	1.754	50	20	IDGD	
C[C@H](C(=O)NC[C@H]1CCN(C(=O)CO[Si](C)(C)C)[C@@H]1c1cccnc1)n1cnnn1	1813471432	YFYXLIFILZCGOS-QGPMSJSTSA-N	431.573	1.187	50	20	IDGD	
Cc1ccc(CC(=O)NC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)o1	1813515037	PZZCTINZKZYZPP-MBSDFSHPSA-N	441.532	1.605	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)COCCOC)sc2C1	1814312582	SAVWSDIVYBSGNL-GHMZBOCLSA-N	434.356	1.892	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](N)CCC(N)=O)n[nH]1	1817246116	WFXMJEQSHJYZEG-NTZNESFSSA-N	443.346	1.026	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2sccc2F)[nH]n1)c1ccc(B(O)O)cc1	1817470510	TUTVMTFNZIRFQV-INIZCTEOSA-N	442.281	1.910	50	20	IDGD	
CN1CCN(CC(=O)Nc2cc([C@H]3CCCCN3C(=O)[C@](C)(Cl)CCl)[nH]n2)CC1	1818913789	MOEKLOLULQLKMM-DNVCBOLYSA-N	445.395	1.886	50	20	IDGD	
CCS(=O)(=O)CC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](C)Br)n[nH]1	1822183967	IJEXZLNULQXHEW-CMPLNLGQSA-N	435.344	1.620	50	20	IDGD	
O=C1NCc2cc(C(=O)N3CCC([C@@H]4CCCCN4C(=O)[C@H](O)CCl)CC3)ccc21	1824186301	MRCSYLQCYBPZPN-RBUKOAKNSA-N	433.936	1.763	50	20	IDGD	
COC[C@@H](C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1	1824606237	YAANCCHELYFPMK-BEFAXECRSA-N	431.537	1.201	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cnc(N(C)C)o2)CC1	1825756964	MLZBEQKKJHOQHP-KRWDZBQOSA-N	448.568	1.347	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(O)ccc1O)CC2	1826088311	DDEQIHMWMMTNKZ-NSHDSACASA-N	447.517	1.153	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H]1CCCSC1)CC2	1826092037	JDXYEAZZBMISEU-STQMWFEESA-N	439.607	1.571	50	20	IDGD	
O=C([C@@H]1CCC=CO1)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827057589	KPQDSNSCYHCAHS-RTWAWAEBSA-N	426.322	1.292	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H](N)CN)CC1	1827585538	ULWTUGXUMRHTLC-RZGBZVGDSA-N	445.514	1.777	50	20	IDGD	
O=C(C1CC(F)(F)C1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1829991788	VYFASQUIMOHMTF-FZMZJTMJSA-N	429.233	1.179	50	20	IDGD	
Cc1ccc(F)cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1830077685	CGUBDFVPOGXZNL-YJBOKZPZSA-N	447.276	1.895	50	20	IDGD	
C[C@H](Oc1ccccn1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830370511	SHUQILIUXXXBDW-KKSFZXQISA-N	439.940	1.570	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3ccc[nH]3)C2)C1	1830538711	NOCMTNSRBAUNIG-BEFAXECRSA-N	442.354	1.435	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3Cc4ccccc4CN3)C2)C1	1831647685	YBHBPFWUXWHXEK-MZKRTTBSSA-N	449.979	1.565	50	20	IDGD	
CC(C)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2	1832549299	LTWFMHCKDDVRQH-YWZLYKJASA-N	447.960	1.231	50	20	IDGD	
O=C(/C=C/c1ccsc1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1833141860	QYYZLWUBPDWEPH-YSCDTDAQSA-N	447.326	1.908	50	20	IDGD	
CC[C@H](C(=O)NC1CCN(C2CCN(C(=O)[C@@H](Cl)COC)CC2)CC1)N(CC)CC	1833539328	QOMCVERGXITHCO-VQTJNVASSA-N	445.048	1.932	50	20	IDGD	
CCc1nn(C)c(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)c1Cl	1833593556	SOYOLOWPMVTZDO-WMLDXEAASA-N	437.299	1.240	50	20	IDGD	
Cc1cc(C(=O)NC2CCN(C3CCN(C(=O)[C@H](F)Br)CC3)CC2)nn1C	1834174616	KSNKYNLUFYPDLU-INIZCTEOSA-N	444.349	1.604	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)COC(=O)C(F)(F)F)CC2)CC1	1835686201	NOWBVRZRQYDECC-CQSZACIVSA-N	441.878	1.681	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(C=O)s3)CCO2)C1	1835942166	ZWMGZGXSXHZCLP-IBGZPJMESA-N	428.938	1.896	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)c3cnc(O)nc3O)CC2)CC1	1836393999	GQUOYWRWWYHVET-OAHLLOKOSA-N	425.917	1.090	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC1CCN(C2CCN(C(=O)c3cccnn3)CC2)CC1	1836400195	YPELBLJZJUQLFY-LJQANCHMSA-N	428.364	1.898	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)C1(F)CCCCC1)CCO2	1836617730	UOFRDUPZHHUWAY-IBGZPJMESA-N	430.593	1.967	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836670320	MJJWZJCCPDEXJX-SWLSCSKDSA-N	439.778	1.616	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3ccc(CO)o3)CC2)CC1	1838465677	AJKQRHVGQPIMSR-KRWDZBQOSA-N	428.913	1.638	50	20	IDGD	
N#Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)CCBr)C3)C2)cc1	1838950202	NVAZOOQZMMUCLC-IBGZPJMESA-N	436.306	1.413	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(NC(C)=O)n3)C2)C1	1839142699	WOBDLZLWSGYABH-MGPUTAFESA-N	438.912	1.127	50	20	IDGD	
Cc1ncncc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2	1839153669	OABQUYPNONJPOV-ZWKOTPCHSA-N	431.320	1.091	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(Cl)c(F)c3)CCO2)C1	1839272489	QIQHIONVDBHNPK-DNVCBOLYSA-N	449.306	1.803	50	20	IDGD	
Cc1cc(F)cc(C(=O)N2CCO[C@]3(COCCN(C(=O)CCBr)C3)C2)c1	1839283987	NSLBXOFNRTWZNQ-IBGZPJMESA-N	443.313	1.989	50	20	IDGD	
Cc1cnc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)s1	1840031181	HYZOISXQYOWWOK-BLLLJJGKSA-N	432.340	1.305	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(OC)cc3C)C2)C1	1840154305	RUINJVUDMDONPJ-GHTZIAJQSA-N	440.924	1.327	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@]1(C)CC1(F)F)CCO2	1840829372	BTFFRXSEDRUEML-APHBMKBZSA-N	439.297	1.662	50	20	IDGD	
COc1ccc(/C=C/C(=O)N2CCCC23CN(C(=O)[C@H](O)CCl)C3)c(OC)c1OC	1841435080	HOEUSNMZVTVSJR-PMGBHYCQSA-N	438.908	1.529	50	20	IDGD	
CCC(=O)N[C@H](C)C(=O)N1CCCC12CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)C2	1841535911	USIRQYJMJOCWNT-BRYYZUPOSA-N	430.455	1.990	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)CC(=O)OC(C)(C)C)C1	1841743439	GBPWRUDDZLDWON-OEAKJJBVSA-N	431.493	1.056	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2cc(Cl)c(F)cc2F)C1	1845300144	SIFRWVTTWZYBBF-UHFFFAOYSA-N	449.845	1.748	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC12CN(C(=O)[C@@H](O)CCNC(=O)OC(C)(C)C)C2	1846178210	KSRGKGYAJJULEC-OLZOCXBDSA-N	448.358	1.249	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CCO2)C1	1847152839	VHVFSOKLJUVSLM-HUUCEWRRSA-N	445.944	1.080	50	20	IDGD	
C=CCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl	1847564832	DIBSEFMRRUZXPD-YHUYYLMFSA-N	429.945	1.647	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](CC(N)=O)NC(=O)OC(C)(C)C	1847871815	LUCOBWVTTJJHMD-AJNGGQMLSA-N	444.960	1.364	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H]1CCCN1C	1847962537	FQQFABFWFUUTRD-BZSNNMDCSA-N	430.461	1.430	50	20	IDGD	
CC(C)OCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCCSSCCC(=O)O	2088599438	VQTRIDIPAKEESF-INIZCTEOSA-N	444.575	1.817	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cccc(NC(=O)C3CC3)c2)c1	25416605	HYQGVZBLZISSOJ-UHFFFAOYSA-N	430.486	1.360	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@H](C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)C(C)C)cc1	26692502	QTWDBHZIKQVKFT-OALUTQOASA-N	447.513	1.285	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(F)cc2)C1)c1ccc2c(c1)OCO2	26965418	WDMKPRUFUXCOKF-CQSZACIVSA-N	449.460	1.416	50	20	IDGD	
C[C@H]1CC(C)(C)C[C@@]2(C1)NC(=O)N(CC(=O)NNC(=O)c1cc(Cl)ccc1O)C2=O	105349516	OIXGZDFXFFVWPL-PRWKNARSSA-N	436.896	1.943	50	20	IDGD	
CCN(CC)C(=O)CCCC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	110966060	FJBSOSOBVFLYDT-UHFFFAOYSA-N	438.550	1.271	50	20	IDGD	
COC(=O)c1ccc(O)c(C=NNC(=O)CN2c3cccc4cccc(c34)S2(=O)=O)c1	726736998	DGRUALYXRVLXNG-UHFFFAOYSA-N	439.449	1.991	50	20	IDGD	
CSCc1nc2ccccc2n1CC(=O)NNC(=O)C1CCN(c2ncccn2)CC1	728848216	ZRRDZRMFBVZTHJ-UHFFFAOYSA-N	439.545	1.753	50	20	IDGD	
CC(=O)NC1(c2noc(CCC(=O)NNC(=O)CNc3ccccc3)n2)CCCCCC1	729513563	YIEXEPIIVRZGOY-UHFFFAOYSA-N	442.520	1.947	50	20	IDGD	
CN(C)c1ccc(NC(=S)NNC(=O)c2ccc3c(c2)CCN3S(C)(=O)=O)cc1	729689996	XSVBNRXLICUDEW-UHFFFAOYSA-N	433.559	1.706	50	20	IDGD	
O=C(NN=c1cc[nH]c2ccccc12)c1cccc(S(=O)(=O)NC[C@H]2CCCO2)c1	730288441	JCMWUGVTJVEVPZ-MRXNPFEDSA-N	426.498	1.871	50	20	IDGD	
Cc1cccc(N2C(=O)N[C@@H](CCC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)C2=O)c1	730768425	OPPUPTPSIBVDKG-INIZCTEOSA-N	425.401	1.569	50	20	IDGD	
CC(CCN1C(=O)c2ccccc2C1=O)=NNC(=O)c1csc(N2CCOCC2)n1	730947118	DABYBSITCMECBA-UHFFFAOYSA-N	427.486	1.772	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)nnn1-c1cccc2cnccc12	731185567	KETHFTZVKXLOGP-UHFFFAOYSA-N	440.427	1.174	50	20	IDGD	
C[C@H](NC(=O)CCC(=O)NNC(=O)c1cccn1C)C(=O)c1ccc(Br)cc1	732051836	AYWMYYXHGFLKBG-LBPRGKRZSA-N	449.305	1.716	50	20	IDGD	
CC(C)(C(=O)NNC(=O)CC[C@H]1NC(=O)N(c2ccc(C#N)cc2)C1=O)c1ccccc1	733760943	LTYVRXCBKYBTSE-GOSISDBHSA-N	433.468	1.888	50	20	IDGD	
CN1CCN(C(=O)CCNC(=O)/C(C#N)=C\c2cn(CCC#N)nc2-c2ccccc2)CC1	733975270	MVIUNINIKZDHGD-SILNSSARSA-N	445.527	1.651	50	20	IDGD	
Cc1cc(NNC(=O)CNC(=O)[C@H]2c3ccccc3C(=O)N2Cc2ccccc2)ncn1	734254569	QTTXQGVCPGKHST-OAQYLSRUSA-N	430.468	1.742	50	20	IDGD	
CC(=O)NCCCNC(=O)NNc1ccc(S(=O)(=O)NC2CCCCCCC2)cn1	735579547	NAYXUOHZQIZJEJ-UHFFFAOYSA-N	440.570	1.625	50	20	IDGD	
COC[C@H](C)CNC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	737064451	GRSRRBONMRCLJB-OAHLLOKOSA-N	434.518	1.392	50	20	IDGD	
CC(C)C[C@H](C(=O)NNC(=O)COCc1ccccc1)N1C(=O)[C@@H]2CC=CC[C@H]2C1=O	737634662	LCDRIWXWNXNOMM-GUDVDZBRSA-N	427.501	1.717	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)[C@H]2CCC[C@H]2NC(=O)OC(C)(C)C)n1	740296521	LBVRVTZECUNYNV-QWHCGFSZSA-N	440.522	1.378	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)[C@](C)(O)c2cccc(C(F)(F)F)c2)n1	741346454	CGABMYFKIFQUFV-QGZVFWFLSA-N	445.419	1.611	50	20	IDGD	
CC(C)(C)OC(=O)N(CC(=O)NNC(=O)COc1ccccc1F)C[C@@H]1CCCO1	742034437	ZKUCYWXIIDTGCH-AWEZNQCLSA-N	425.457	1.768	50	20	IDGD	
O=C(CCc1nc2cc(Br)ccc2s1)NNC(=O)[C@H]1CCS(=O)(=O)C1	742491301	RXUHIMNHYJRUFK-VIFPVBQESA-N	446.348	1.574	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNS(=O)(=O)c2cc(C(=O)O)ccc2F)c1	745979304	XWNVOJUGWHJSQC-UHFFFAOYSA-N	447.238	1.918	50	20	IDGD	
COC(=O)[C@H]1CCC[C@@H](C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)C1	746096973	STHMVAJNLPHOEC-CVEARBPZSA-N	437.518	1.212	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)c2cccc(CS(=O)(=O)NC(C)(C)C)c2)c1	746356797	KDJWIUWJNZKESI-UHFFFAOYSA-N	449.529	1.997	50	20	IDGD	
CC(C)c1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)nn1C	746580594	ZSJZMAOTHWVRAX-UHFFFAOYSA-N	433.534	1.793	50	20	IDGD	
O=C(NNC(=O)c1cnc(-c2ccc(C(F)(F)F)cc2)s1)N[C@@H]1CCS(=O)(=O)C1	746594314	NNURPTCHESIRES-LLVKDONJSA-N	448.448	1.960	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)c1cnn(CC(=O)NC2CCCCC2)c1	746678324	PSEOXPCLDJRVCM-UHFFFAOYSA-N	427.505	1.734	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)Cn2c(S)nc3ccccc3c2=O)o1	746687840	LKAMAFNHZNOIIB-UHFFFAOYSA-N	429.502	1.581	50	20	IDGD	
COc1ccc(NNC(=O)c2cc(S(=O)(=O)N(C)C)ccc2N2CCOCC2)cc1	746883807	VWWACSBALBTBDB-UHFFFAOYSA-N	434.518	1.539	50	20	IDGD	
COC(=O)[C@H](O)C1CCN(C(=O)/C(C#N)=C\c2cc(C)n(C[C@@H]3CCCO3)c2C)CC1	747517384	JZGCXHUYQBNVCU-BWRIXDJYSA-N	429.517	1.963	50	20	IDGD	
O=C(Cn1nnc(-c2ccccc2)n1)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1	748520343	NSPAPRIIUKQIGS-UHFFFAOYSA-N	426.380	1.777	50	20	IDGD	
O=C(CCc1ccccc1)NNC(=O)c1ccc(F)c(S(=O)(=O)N2CCOCC2)c1	749803867	IFXPHDWSJHAZPY-UHFFFAOYSA-N	435.477	1.240	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)N[C@@H]2CCN(c3cccc(Cl)c3)C2=O)cc1	750670514	MFEQEDHXHQLCGQ-QGZVFWFLSA-N	427.848	1.726	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)[C@H]3CCc4nnc(C)n4C3)n[nH]2)cc1OC	750794664	LTKNUGOFIZEBEW-ZDUSSCGKSA-N	425.449	1.017	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNS(=O)(=O)c2cc(F)c(F)c(C(=O)O)c2)cc1	751143190	WWNFSPLSPRXFAS-SNVBAGLBSA-N	444.412	1.839	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)c1ccc(C)c(S(=O)(=O)NC2CCCC2)c1	752521535	PXJOTOBYSQONSM-UHFFFAOYSA-N	438.550	1.282	50	20	IDGD	
CN(C)N(C(=O)[C@H]1CC(=O)N(CCOc2ccccc2Cl)C1)[C@@H]1CCS(=O)(=O)C1	752761898	CFDCBYWSVCDCFT-LSDHHAIUSA-N	443.953	1.060	50	20	IDGD	
O=C(NNC(=O)NC1CCN(S(=O)(=O)C2CC2)CC1)Nc1ccc(OC(F)F)cc1	753967755	OYULOQRQRYDHQM-UHFFFAOYSA-N	447.464	1.580	50	20	IDGD	
C[C@H](NS(=O)(=O)c1ccc(C(N)=O)cc1)C(=O)NNc1cc(C(F)(F)F)ccc1F	754148353	ILUCISFQFBVNNB-VIFPVBQESA-N	448.398	1.754	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)Nc2ccc(S(=O)(=O)N3C[C@@H](C)O[C@H](C)C3)cc2)o1	755423858	RDMWDEPYGYWPHF-ZIAGYGMSSA-N	436.490	1.852	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(N(C)C)c(NC(=O)NNC(=O)c2ccccc2O)c1	755434083	JDODEFQKROORDT-UHFFFAOYSA-N	449.533	1.955	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)[C@](C)(O)CN2Cc3ccccc3C2=O)o1	756812153	KXFPANHVTSRVHG-JOCHJYFZSA-N	428.489	1.289	50	20	IDGD	
O=C1C[C@@H](Cc2ccc(NC(=O)NNC(=O)c3cnn(-c4ccccc4)c3)cc2)C(=O)N1	756817521	XLOWSOOYDWDVGG-OAHLLOKOSA-N	432.440	1.544	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2cc(F)cc(Cl)c2)CC1	757388059	MQVBPFWZAPWTTB-UHFFFAOYSA-N	427.889	1.567	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NCC(=O)NN=c2cc[nH]cc2Cl)c1	757422332	UAKBHJLASRBTEZ-UHFFFAOYSA-N	439.925	1.061	50	20	IDGD	
CN(NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc12)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758781979	JTOKDAXEAUEKCO-UHFFFAOYSA-N	447.452	1.720	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCN(c3ccc(C)c(C)c3)CC2)cc1OC	759335601	MMQWJXJPQDABFN-UHFFFAOYSA-N	426.517	1.904	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	760801691	VJSAQERYMIYBAE-OAHLLOKOSA-N	449.464	1.262	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCCC(=O)NNC(=O)CNc1ccccc1	761040396	HGZMABBOLISGAK-INIZCTEOSA-N	433.509	1.152	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)C2(NC(=O)OC(C)(C)C)CC2)cc1C	761525836	QSEHOTMBXAJWJK-UHFFFAOYSA-N	425.507	1.980	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	761783312	QQMJVQAGYVBNFI-GOSISDBHSA-N	448.483	1.713	50	20	IDGD	
CCN1C(=O)c2ccc(C(=O)NNC(=O)CSc3ccccc3OC)cc2S1(=O)=O	762360489	CVYNSIMXYSZHFW-UHFFFAOYSA-N	449.510	1.413	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)C#Cc3ccc4c(c3)OCO4)n[nH]2)cc1OC	763151788	FSWVARVQGWRKCE-UHFFFAOYSA-N	434.408	1.635	50	20	IDGD	
Cc1c(Br)cc(C(=O)O)cc1S(=O)(=O)NNC(=O)c1ccc(C#N)cc1	763278587	DAPRIKZZFQHMEN-UHFFFAOYSA-N	438.259	1.951	50	20	IDGD	
CCOC(=O)C(C)(C)n1cc(NC(=O)C(=O)NNC(=O)c2c[nH]c3ccccc23)cn1	763541610	YMJZHGNWFROZKC-UHFFFAOYSA-N	426.433	1.062	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)Nc1ccc(N2CCCC2)c(F)c1	763571340	MJGHZHJSPRNYGH-GOSISDBHSA-N	428.420	1.352	50	20	IDGD	
COCCc1cc(NC(=O)C(=O)NNC(=O)COc2cc(C)ccc2C(C)C)n(C)n1	763597543	PEUOJYMGUFUCJS-UHFFFAOYSA-N	431.493	1.206	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)NCc1ccc(N2CCCS2(=O)=O)cc1	763662872	BPPQTNKZGYSTTB-UHFFFAOYSA-N	441.513	1.712	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)C(=O)Nc1cnc(C2CC2)nc1	763692364	AFWMFTUSZHQYHW-UHFFFAOYSA-N	434.250	1.281	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(C)c(N2CCOC2=O)c1	763716198	CFDYYLDCBZKPQN-UHFFFAOYSA-N	440.456	1.679	50	20	IDGD	
O=C(CN1CCCc2ccccc21)NNC(=O)C(=O)Nc1ccccc1N1CCOC1=O	763729354	WZEGDWVYDOQHOP-UHFFFAOYSA-N	437.456	1.182	50	20	IDGD	
CC(=O)Nc1ccc(Cl)c(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)c1	763807693	FIYWEIXZXKLFSG-UHFFFAOYSA-N	429.820	1.335	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(NC(C)=O)cc2)cc1	763861105	MIZASMOLVWUEOA-ZDUSSCGKSA-N	428.445	1.597	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)cccc1N1CCOC1=O	763864382	CHLGPPROUNUTHS-CYBMUJFWSA-N	444.419	1.644	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(C(C)=O)cc2)c(F)c1	763872619	PAIBGAKEPJYPOH-GFCCVEGCSA-N	445.403	1.368	50	20	IDGD	
COC(=O)c1ccsc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccc(C(C)=O)cc1	763879483	WWVLSXDHTKMCFC-LLVKDONJSA-N	433.442	1.291	50	20	IDGD	
O=C(CCSc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccn(Cc2ccccn2)n1	763895964	VLNDQVIEBMRKPB-UHFFFAOYSA-N	442.476	1.734	50	20	IDGD	
Cc1cccc(NC(=O)C(=O)NNC(=O)Cc2ccc(F)cc2)c1C(=O)N1CCCC1	763921045	PPNPLCPWVBNZOK-UHFFFAOYSA-N	426.448	1.699	50	20	IDGD	
CCN1CCN(c2ccc(NC(=O)C(=O)NNC(=O)c3cc(Cl)ccc3O)cc2)CC1	763973893	GKQUMSLTCBZTSH-UHFFFAOYSA-N	445.907	1.587	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)Nc1ccccc1N1CCCC1	764002901	VWCSMIADOUGHNT-UHFFFAOYSA-N	434.294	1.788	50	20	IDGD	
Cc1ccn(-c2ccccc2NC(=O)C(=O)NNC(=O)c2cc(Br)cn2C)n1	764005094	UBXORMPJXSZCTO-UHFFFAOYSA-N	445.277	1.681	50	20	IDGD	
C=CCNC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1	764005436	XRTBAWRURRHBMB-UHFFFAOYSA-N	439.428	1.165	50	20	IDGD	
Cc1nnnn1-c1cccc(NC(=O)C(=O)NNC(=O)c2cccc(C(F)(F)F)c2)c1	764040555	MKPKWJGPIQGMKY-UHFFFAOYSA-N	433.350	1.389	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2c(F)cc(Cl)cc2F)c1	764078612	XYXJKENJHHWXLF-UHFFFAOYSA-N	431.804	1.421	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2cc(OC)c(OC)c(OC)c2)cc1	764132139	OYFGKASZAPIOSN-UHFFFAOYSA-N	431.445	1.440	50	20	IDGD	
COC(=O)c1cc(OC)ccc1NC(=O)C(=O)NNC(=O)CCc1ccc(OC)cc1	764132988	ZMSJUSNHKYJBNC-UHFFFAOYSA-N	429.429	1.209	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1cc(C(=O)NC(C)C)ccc1Cl	764139266	QLJZEHDYHJQWDG-UHFFFAOYSA-N	446.891	1.815	50	20	IDGD	
O=C(CC1CC1)NNC(=O)C(=O)Nc1ccc(NC(=O)[C@H]2CCCO2)cc1C(F)(F)F	764141943	IFJQKSVOGDMLSK-CQSZACIVSA-N	442.394	1.709	50	20	IDGD	
Cc1conc1NC(=O)C(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1	764178783	JLCMMIMYRCANEW-LJQANCHMSA-N	433.468	1.696	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)C(=O)Nc1cccc(Cn2cccnc2=O)c1	764239587	PFTWLXKOZCTBME-UHFFFAOYSA-N	444.451	1.032	50	20	IDGD	
Cc1ncsc1C(=O)NNC(=O)C(=O)Nc1ccc(OCCc2ccccc2)nc1	764247663	WXEQCFNNBMOABC-UHFFFAOYSA-N	425.470	1.868	50	20	IDGD	
Cc1ccc2cccc(NC(=O)C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)c2n1	764259947	LRRBTAITEFIWBF-UHFFFAOYSA-N	433.472	1.336	50	20	IDGD	
Cc1ccc(I)cc1C(=O)NNc1nccc(N2CCOCC2)n1	764328461	DHNPIPRUFQPDSF-UHFFFAOYSA-N	439.257	1.983	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)C(=O)Nc1ccnn1C1CCN(CC)CC1)c1ccccc1	764331940	KHJINOPFBMXKJV-GOSISDBHSA-N	426.521	1.820	50	20	IDGD	
CNS(=O)(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cc3ccccc3o2)ccc1C	764332163	NKPJGQBJDDGTHM-UHFFFAOYSA-N	430.442	1.049	50	20	IDGD	
CS(=O)(=O)c1ccc(F)c(NC(=O)C(=O)NNC(=O)CCCc2cccs2)c1	764335913	VWVHXSORLKIVDW-UHFFFAOYSA-N	427.479	1.400	50	20	IDGD	
Cc1nnc(-c2cccc(NC(=O)C(=O)NNC(=O)c3cnn(-c4ccccc4)c3)c2)n1C	764352081	ZPCCGPRNJPFCCR-UHFFFAOYSA-N	444.455	1.376	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)N3C[C@H](C)O[C@@H](C)C3)cc2)o1	764370943	JRHRWWLVLIGMSM-KBPBESRZSA-N	428.445	1.237	50	20	IDGD	
CCOc1ccc(OC)cc1NC(=O)C(=O)NNC(=O)CSc1ccccc1OC	764393461	OAQQJYNDWRIJCV-UHFFFAOYSA-N	433.486	1.981	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)[C@H](C)NS(=O)(=O)c2cccc(C#N)c2)cc1	764565253	BDLSGJJVHFFMOI-AWEZNQCLSA-N	432.527	1.473	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NN=C2CCN(CCN3CCOCC3)CC2)n[nH]1	764800115	JZERROXUFUNTDP-UHFFFAOYSA-N	426.521	1.599	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	765248867	WGWUBKKJPSQJGC-UHFFFAOYSA-N	435.527	1.730	50	20	IDGD	
O=C(CCOc1cccc(Cl)c1)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765733017	LKQZDAUKJZPKQV-UHFFFAOYSA-N	444.919	1.714	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNc2cnc3ccccc3n2)sc1Br	765989446	KQQSMUOAGWYYMY-UHFFFAOYSA-N	428.293	1.858	50	20	IDGD	
O=C(COC(=O)COc1ccc2c(c1)CCCC2)NNC(=O)[C@H]1COc2ccccc2O1	767526442	DPIMDHKPVVWVOU-HXUWFJFHSA-N	440.452	1.475	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cnc(Cl)c(Br)c2)cc1	768237431	KVWOMYUKUDHNOS-UHFFFAOYSA-N	441.669	1.971	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)CCNC(=O)N1CCc2ccccc2C1	768628313	KPTRMVPHZRQJKK-UHFFFAOYSA-N	446.529	1.700	50	20	IDGD	
CC(C)c1nnc(NC(=O)CCC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)s1	769463395	XNIHJIJAKKYZPB-UHFFFAOYSA-N	443.489	1.088	50	20	IDGD	
CCOC(=O)N1CC[C@H](NC(=O)NNC(=O)[C@@H](C)Oc2cccc(Br)c2)C1	770325038	MYECFUWXDZXEKX-YPMHNXCESA-N	443.298	1.778	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)[C@H](C)NS(=O)(=O)c2cccc(C(F)(F)F)c2)c(O)c1	770989459	GHRQANZNKYZCKF-NSHDSACASA-N	445.419	1.847	50	20	IDGD	
C[C@H]1C[C@@H](CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)CCO1	771424814	AQCZSKOGMNXYTA-HOTGVXAUSA-N	438.550	1.620	50	20	IDGD	
CC(C)c1[nH]nc(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)c1[N+](=O)[O-]	771540663	VNHBZUNPOAXHEZ-UHFFFAOYSA-N	438.466	1.219	50	20	IDGD	
CN1CCN(c2ccc(C=NNC(=O)Cc3csc(N4CCOCC4)n3)cc2)CC1	771550485	QPAOBIYGVNHUQV-UHFFFAOYSA-N	428.562	1.424	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)c1cc(S(=O)(=O)N(C)C)ccc1Cl	771887747	LEPRHBFPJYQOGT-LLVKDONJSA-N	433.914	1.329	50	20	IDGD	
C[C@@H]1C[C@H](NC(=O)OC(C)(C)C)CCN1C(=O)NNC(=O)CNC(=O)c1cccs1	771977432	KIFSNAITRIJKMU-CHWSQXEVSA-N	439.538	1.596	50	20	IDGD	
CCn1c(=O)nc(O)c2c(C(=O)O[C@H](C)C(=O)NNC(=O)CC(C)C)cc(C3CC3)nc21	771997011	XKVHNPRFGMNAEE-LLVKDONJSA-N	445.476	1.133	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1cc([N+](=O)[O-])ccc1I	772003744	LTOVAJPDAULDDQ-SSDOTTSWSA-N	435.174	1.302	50	20	IDGD	
CCC(CC)[C@H](C(=O)NNC(=O)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1)N1CCOCC1	773413736	IVBWACMENGACER-QZTJIDSGSA-N	440.585	1.918	50	20	IDGD	
O=C(CN1CCOCC1)Nc1ccc(NC(=O)C(=O)NNc2ccc3ccccc3n2)cc1	773661499	JLJAFUKAHDRDSC-UHFFFAOYSA-N	448.483	1.587	50	20	IDGD	
CC[C@H](C)NS(=O)(=O)Cc1cccc(NC(=O)C(=O)NNc2ccc(C#N)cc2)c1	773701430	RTVGHTQTFKXSQG-AWEZNQCLSA-N	429.502	1.858	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccccc1S(=O)(=O)N1CCCC1)c1ccc(Cl)nc1	775269236	AXKKMYMYURWXLZ-UHFFFAOYSA-N	444.922	1.143	50	20	IDGD	
COc1cc(NC(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)cc(OC)c1	775393450	BUXKRQHXYCIUAJ-UHFFFAOYSA-N	436.490	1.873	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)Nc2cnn(-c3ccccc3S(C)(=O)=O)c2)c1	776472181	GTZHCMIRYOEOOF-UHFFFAOYSA-N	449.514	1.828	50	20	IDGD	
COC(=O)[C@](C)(NCC(=O)NNC(=O)c1ccccc1)c1cccc(Br)c1	777616526	ZMYKBNLGJKDOAS-LJQANCHMSA-N	434.290	1.888	50	20	IDGD	
Cn1cc(C(=O)NNS(=O)(=O)c2cc(Br)c(Cl)c(C(=O)O)c2)cn1	777630075	UNXKUBUFVLTLDX-UHFFFAOYSA-N	437.659	1.158	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3cc4nn[nH]c4cc3F)n[nH]2)cc1OC	781956065	RZGUHXUBVSRNDH-UHFFFAOYSA-N	425.380	1.579	50	20	IDGD	
CC(=O)N1CCN(Cc2cccc(NC(=O)C(=O)NNc3ccc4ccccc4n3)c2)CC1	782124500	PDFCTXUKFOZQOD-UHFFFAOYSA-N	446.511	1.981	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2ccnn2[C@H]2CCN(Cc3ccccc3)C2)nc1	782145189	MEEXUDACOAADPE-KRWDZBQOSA-N	435.488	1.816	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)CSc2nnc3ccccn23)c2ccccc2c1=O	782548097	GFKHRMATEKWLGS-UHFFFAOYSA-N	437.485	1.573	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)cc1)C(=O)Nc1cccc(C(=O)N2CCc3ccccc32)c1	782837373	JGRLQEFIMZHVEL-UHFFFAOYSA-N	444.447	1.995	50	20	IDGD	
N#Cc1ccc(Cn2cnc(NC(=O)C(=O)NNc3ccc([N+](=O)[O-])cc3Cl)n2)cc1	784392373	OSFHOYWHDJFFBQ-UHFFFAOYSA-N	440.807	1.841	50	20	IDGD	
O=C(NNc1ccc(Br)nc1)C(=O)Nc1cc(F)cc(N2CCOCC2)c1	784807286	YJGBMKDJUYAFMQ-UHFFFAOYSA-N	438.257	1.902	50	20	IDGD	
C[C@@H]1CCCN(S(=O)(=O)c2ccc(NC(=O)C(=O)NNc3ncc(F)cn3)cc2)C1	784955077	AHYDKJOELSGTKR-GFCCVEGCSA-N	436.469	1.118	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)Nc1cccc(CCN2CCCC2)c1	785023351	GDBHHODNXUZPLR-UHFFFAOYSA-N	441.444	1.338	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)N[C@@H]1CCCN(C2CCCCC2)C1=O	785923739	MIJBFYKVFIPJEL-QGZVFWFLSA-N	440.504	1.846	50	20	IDGD	
O=C(NCc1nc(-c2cccc(F)c2)no1)NNC(=O)c1nn(-c2ccccc2)cc1O	787406582	CREHXASPDBIOAV-UHFFFAOYSA-N	437.391	1.911	50	20	IDGD	
CCS(=O)(=O)CCn1cc(C)c(NC(=O)C(=O)NNc2cc(F)c(F)cc2F)n1	787563586	PUYKPSWNIKNBNX-UHFFFAOYSA-N	433.412	1.125	50	20	IDGD	
CCc1c(C(=O)NNC(=O)CNc2ccc(OC)cc2)nnn1Cc1ccc(F)cc1	787865461	BLZPNKCICSYONG-UHFFFAOYSA-N	426.452	1.910	50	20	IDGD	
COc1ccc(OC)c([C@H]2C[C@@H]2C(=O)OCC(=O)NNC(=O)Cc2nc(C)cs2)c1	788201916	RIPWLOKCQZVVCA-HIFRSBDPSA-N	433.486	1.506	50	20	IDGD	
CC(C)n1nc(-c2ccco2)cc1NC(=O)C(=O)NNC(=O)Cc1nc2ccccc2n1C	789745649	CJXHIAHTNOAQSM-UHFFFAOYSA-N	449.471	1.939	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)N[C@@H]2CCN(Cc3ccc(C)cc3)C2=O)cc1	790697201	LORSZGJSCMRWHC-LJQANCHMSA-N	426.473	1.514	50	20	IDGD	
COCCN1C(=O)CCc2cc(NC(=O)C(=O)NNc3cccc(F)c3[N+](=O)[O-])ccc21	790999078	WDCKHYGFRXLJLK-UHFFFAOYSA-N	445.407	1.741	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@@H](C#N)Cc2ccc(C#N)cc2)cc1	792018327	VGKTZZREUOGCAR-GOSISDBHSA-N	439.497	1.017	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc2ccn(C)c(=O)c2c1	793023134	IDIHAIMZDBKMBK-UHFFFAOYSA-N	438.440	1.102	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNc2ccc3c(=O)[nH]ccc3c2)ccc1N1CCCC1=O	793068812	DSSCPWPWPJCCKZ-UHFFFAOYSA-N	435.440	1.745	50	20	IDGD	
O=C(NNC(=O)c1cc(F)c(F)cc1C(=O)c1ccccc1)N[C@@H]1CCS(=O)(=O)C1	793178081	WMIAWYCAYCNLRH-GFCCVEGCSA-N	437.424	1.327	50	20	IDGD	
CCCn1nc(C(=O)NNS(=O)(=O)c2cnc(C)c(C#N)c2)c2ccccc2c1=O	793350041	DTZJVHCRHQYNHB-UHFFFAOYSA-N	426.458	1.005	50	20	IDGD	
CCOC(=O)[C@H](C)NC(=O)c1ccc(NC(=O)NNC(=O)c2cccc(C)n2)cc1F	797631435	RGIOVMWASZZQKO-LBPRGKRZSA-N	431.424	1.677	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@H]2C(=O)NNC(=O)CNc2cccc(OC)c2)cc1	799098506	MEZLCZPLMZLSCZ-IBGZPJMESA-N	426.473	1.568	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)NCc2ncnn2C(C)(C)C)c2ccccc2c1=O	800742509	RHTNGRMDAPJWAH-UHFFFAOYSA-N	426.481	1.468	50	20	IDGD	
CN(CCC(N)=O)C(=O)/C(C#N)=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	804743260	CJDKPZOEVWBJGF-GXDHUFHOSA-N	428.880	1.320	50	20	IDGD	
O=C(NNc1cccc(F)n1)c1cc(I)ccc1-n1cnnn1	804765360	NAZNPTHVAWFJTO-UHFFFAOYSA-N	425.165	1.558	50	20	IDGD	
O=C(NNc1nc2ccccn2n1)C(=O)Nc1ccc2nccnc2c1Br	807033173	HUSDWCAKGLWTAO-UHFFFAOYSA-N	427.222	1.517	50	20	IDGD	
CN1CCN(C(=O)NNC(=O)[C@@H]2CC(=O)N(C)[C@H]2c2ccc(Cl)c(Cl)c2)CC1	807382314	AGVWLYLSDHYMGV-WBMJQRKESA-N	428.320	1.501	50	20	IDGD	
COc1ccc(S(=O)(=O)NCC(=O)NNc2cccc(Br)c2)cc1OC	810042442	VRKQPXLYQOEIAP-UHFFFAOYSA-N	444.307	1.888	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2cc(C(N)=O)ccc2OCC(F)F)cc1OC	810343299	RPYGXIBWWXYGSC-UHFFFAOYSA-N	438.387	1.913	50	20	IDGD	
O=C(COc1cc(F)cc(F)c1)NNc1ccccc1S(=O)(=O)N1CCOCC1	810462712	YAANKLQSZMIBNC-UHFFFAOYSA-N	427.429	1.508	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NN=C1CCCc2ccc(S(N)(=O)=O)cc21	811643694	KHNHZKWDGOYXPH-UHFFFAOYSA-N	425.511	1.198	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)CNC(=O)c1ccco1)c1ccc(N2CCCCC2=O)cc1	811872256	LPRGUSAZQIJYCR-AWEZNQCLSA-N	427.461	1.618	50	20	IDGD	
Cc1cc(CNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc(N2CCCC2)n1	811874327	LKMVPKOYIJDIMO-UHFFFAOYSA-N	438.536	1.527	50	20	IDGD	
COc1ncc(C=NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)s1	812222162	LEWSTMAAIGUXDR-UHFFFAOYSA-N	438.531	1.256	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)c2ccc(S(=O)(=O)NC3CC3)cc2)cc1	812731863	YCUIIVMHCNDVHI-UHFFFAOYSA-N	438.531	1.135	50	20	IDGD	
COC(=O)CCc1csc(NC(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)n1	812955495	VMHBIYYJSDTQSP-UHFFFAOYSA-N	427.508	1.648	50	20	IDGD	
COC(=O)c1cn(-c2cccc(NC(=O)C(=O)NNc3ccc(Cl)c(F)c3)c2)nn1	812988514	ZOAWYYXNTHNIRN-UHFFFAOYSA-N	432.799	1.928	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCc2nncn2C1)c1nn(Cc2ccccc2)c(=O)c2ccccc12	814211637	KYMZXSBWCGYAAP-INIZCTEOSA-N	443.467	1.060	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1cn(Cc2ccccc2)nn1	815568204	YSBAHBLUHSIEEI-UHFFFAOYSA-N	428.836	1.388	50	20	IDGD	
COc1ccc(-c2noc(CCC(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)n2)cc1	837087423	AMDQVPOFRHFNRV-UHFFFAOYSA-N	434.416	1.115	50	20	IDGD	
O=C(c1ccc(Br)c(F)c1)N1CCC[C@H](C(=O)N2CC[C@@H](B(O)O)C2)C1	864231075	IRSCBWYUPJKHQM-QWHCGFSZSA-N	427.079	1.516	50	20	IDGD	
COc1cc(C(=O)NCC(=O)NNC(=O)CNc2ccc(C)cc2)ccc1OC(F)F	913431454	LUTSHZACCOIPAT-UHFFFAOYSA-N	436.415	1.594	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCCNC(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)cc1	916278228	IVRHEVKYEDWQKH-UHFFFAOYSA-N	434.562	1.820	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)NCc1cccc(CN2CCCC2=O)c1	916414550	DFECIXLNTCERFP-UHFFFAOYSA-N	441.444	1.627	50	20	IDGD	
COc1cc(C#N)ccc1OCC(=O)NNC(=O)COc1ccc(Br)cc1	916418707	KOJGDSKBVKCMAA-UHFFFAOYSA-N	434.246	1.935	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2cc3ccccc3cc2O)cc1C	917358399	WEEVPUDVYMSMHT-UHFFFAOYSA-N	427.482	1.902	50	20	IDGD	
Cc1cc(O)c(C(=O)O)cc1S(=O)(=O)NNC(=O)c1ccc(F)cc1Br	917754579	AHIYHWPUIZZKHN-UHFFFAOYSA-N	447.238	1.924	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)c2nnc(-c3ccccc3)o2)c2cccnc12	919961760	PEGIIUSHCCRXDD-UHFFFAOYSA-N	425.426	1.917	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccccc1C(F)(F)F)NNC(=O)c1c[nH]c2ccccc12	920211726	SFJVWCQTQLADAG-UHFFFAOYSA-N	440.403	1.926	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)C(C)(C)NC(=O)OC(C)(C)C	921301973	KIOWJDSBFLZGAL-UHFFFAOYSA-N	427.527	1.352	50	20	IDGD	
C=CCOc1ccc(/C=C\C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1OC	933506738	ZMJOYNNJBSSIQM-BENRWUELSA-N	434.452	1.981	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)c2ccc(C(=O)NC3CC3)cc2)CC1	1253685623	NEBJBNYQFWNOJT-UHFFFAOYSA-N	430.505	1.987	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)c2ccccc2S(C)(=O)=O)CC1	1318903750	UFKPZQNMMBXGLQ-UHFFFAOYSA-N	425.507	1.498	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3c4ccccc4nn3C)cc2)CC1	1320381414	PAEVAXHBZFHGDX-UHFFFAOYSA-N	428.518	1.266	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4nccn4c3)C2)C1	1778011832	PVUJEFRKYQQFID-IFXJQAMLSA-N	435.322	1.809	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2)c1ccc2cc(O)ccc2n1	1778508428	YDSPCFFQCMFCSL-NNMXDRDESA-N	447.919	1.668	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2)c1cc(O)nc2ccccc12	1778547127	VXKMPBCZZPLOBZ-NJNPRVFISA-N	447.919	1.668	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnc3ncccn23)C1	1778654205	KRJATSNKYZMHOD-YYFZDKIDSA-N	435.912	1.111	50	20	IDGD	
Cc1nc[nH]c1CSCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2	1779287040	LJCLZDAWFQJQCK-FRQCXROJSA-N	444.985	1.065	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@]2(C1)CN(C(=O)Cc1cccc([N+](=O)[O-])c1)CCO2	1779294962	SOOSBWPHMKKTLV-FQEVSTJZSA-N	435.553	1.819	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Br)C1)n1cccn1	1780777067	LWMWHUBDBZVQHN-VWPFQQQWSA-N	431.306	1.649	50	20	IDGD	
CCCc1ccc(C(=O)N2CC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)cc1	1780844587	LHVBSJSYTXPUPH-DEOSSOPVSA-N	436.317	1.076	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2)c1cc(O)cc([N+](=O)[O-])c1	1781093086	WVCUGJZCHSGMJC-GPMSIDNRSA-N	441.868	1.028	50	20	IDGD	
CCOC(=O)O[C@@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(Cl)Cl)C2	1781516207	LJOWDUHAMMKZNI-XWCIJXRUSA-N	425.309	1.866	50	20	IDGD	
CSCC[C@H](O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)Br)C2	1782232164	ZPKMIKGRWDTJLF-UMPJEAMMSA-N	437.400	1.398	50	20	IDGD	
Cn1cc2cc(C(=O)N3CC[C@]4(C3)CN(C(=O)[C@@H](F)Br)CCO4)ccc2n1	1782244643	GGKRMTKOODWBQE-QAPCUYQASA-N	439.285	1.707	50	20	IDGD	
C#CCO[C@@H](C)C(=O)N1CCO[C@@]2(CCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1	1782861974	NNYAUKJLLNAIQM-YHFQMYGNSA-N	443.450	1.740	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H]3CCc4ccccc4O3)C2)C1	1783848410	LQOMJOBVFWPZDR-GZRFBZBPSA-N	437.334	1.994	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cn4cc(Cl)ccc4n3)CCO2)C1	1783876440	XVJWFPZMGCXVIN-KUHUBIRLSA-N	441.315	1.685	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cccc(NC(=O)OC)c3)CCO2)C1	1783880775	LNUZDRCUYMPEGE-OXJNMPFZSA-N	439.896	1.562	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H]3CCc4nc[nH]c4C3)C2)C1	1784346009	UVZOZQJMIPKPJF-TYILLQQXSA-N	439.354	1.376	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)C(=O)c3cccn3C)C2)C1	1784610842	IVFCAUYSHGXKQP-SCLBCKFNSA-N	426.311	1.211	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3ncccn3)[C@H]2C1	1785424471	OVFICYBJNMWJDM-XQLPTFJDSA-N	425.327	1.172	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC1(c2ccc(NC(=O)CN3CC(=O)NC3=O)cc2)CCC1	1786686774	VNJQJFCIAHUMLW-SFHVURJKSA-N	441.315	1.909	50	20	IDGD	
O=C(Cc1ccc(F)cn1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21	1787034284	HEAIFILHJASCOB-LOHUMSBYSA-N	432.265	1.433	50	20	IDGD	
Cn1c(=O)c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]3C2)nc2ccccc21	1787446705	AFQMBTWOZPZVJJ-WXRXAMBDSA-N	436.871	1.061	50	20	IDGD	
C[C@H](NC(=O)c1ccccc1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]2C1	1787451473	SMGIDMITROEFPY-JVNPIMRCSA-N	425.888	1.319	50	20	IDGD	
CCN(C)[C@H](C)C(=O)NC1(c2ccc(NC(=O)c3cnccc3C(=O)NN)cc2)CCC1	1789521686	CYVNLIXEGUVILA-OAHLLOKOSA-N	438.532	1.773	50	20	IDGD	
CN1CCC(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]3C2)CC1	1789868298	WKNQQGBBVKXBDT-BOSXTWCSSA-N	434.408	1.934	50	20	IDGD	
C[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2C1)c1cccs1	1791293238	PIGFZKKXPZEXFV-QZWWFDLISA-N	436.578	1.204	50	20	IDGD	
COc1cncc(CCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]3C2)c1	1791294371	ZRZIDKSDDSBRGT-BPUTZDHNSA-N	430.332	1.806	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnc(Cl)nc1	1792414598	YNPUKYSYIYUNOW-FTORJNITSA-N	443.895	1.516	50	20	IDGD	
CCc1nn(C)c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](O)CCl)c1Br	1793110688	UAHDBJROJSUVGZ-NOHGZBONSA-N	447.761	1.597	50	20	IDGD	
COc1ccc(-c2cc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)[C@@H](O)CCl)n[nH]2)cc1	1793112656	SXZUGHNORQSQNE-YGTYGHESSA-N	432.908	1.937	50	20	IDGD	
C/C=C(/C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1793879306	YOMUROQVINRINC-RITUNRGESA-N	429.945	1.674	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)c1ccncc1C(F)(F)F	1796189142	CBCSTMDLWJZOIC-MUJYYYPQSA-N	447.222	1.346	50	20	IDGD	
COc1ccc2nc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@H](O)CCl)C4)ccc2c1	1796999993	PTASGUJWFJEPNP-GTYSZEQSSA-N	433.892	1.046	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cn2ccsc2n1	1797482311	HAGMEJKSLVJKTG-NRWUCQMLSA-N	441.351	1.630	50	20	IDGD	
Cc1cc(C(N)=O)cc(C)c1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2	1797736735	RCAPETNBOIGSNN-AGGWBTHJSA-N	428.316	1.409	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc3ccccc3n1)C2	1797955975	SGZJJSSLXBOYLH-YVWYUNDQSA-N	428.565	1.685	50	20	IDGD	
CC(C)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CC[C@H]2CCC(=O)N2C1	1799144775	SIADJNVYHWUOKF-KCYAQADSSA-N	425.957	1.242	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nc3cc([N+](=O)[O-])ccc3[nH]1)C2	1799271811	CGGKTNUTUJHCIG-DDFXLWFNSA-N	435.868	1.692	50	20	IDGD	
COc1cnc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@](C)(Cl)CCl)c(F)c1	1799277700	VXMZUHHELKXUIA-MSNRECKUSA-N	434.295	1.669	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc[nH]c3nccc1-3)C2)[C@@H](F)Br	1799346151	FPUHEPNLQALZHM-RDBQEKCUSA-N	425.258	1.408	50	20	IDGD	
Cc1cnc(Cl)c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Br)c1	1799347441	LFHGAXLFPILXGB-LFSVMHDDSA-N	434.693	1.937	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(CO)c(F)c1)C2)[C@@H](F)Br	1799351873	DHFDLIQOSFHSCM-AYRXBEOTSA-N	433.249	1.212	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1c(F)cc(OC)cc1F	1799593479	XLXKYAFZMUMMSN-WYFUGZQLSA-N	432.851	1.430	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](O)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](F)Br	1800162205	LUGVBHAEVTVHIT-VGDATSSVSA-N	438.294	1.158	50	20	IDGD	
COC[C@H](NC(C)=O)C(=O)N1CC[C@@H](CNC(=O)C(C)(C)CCl)[C@@H]1c1cccnc1	1802900940	IEGPZPQEXLTSJX-BZSNNMDCSA-N	438.956	1.504	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)Cn2cnc3ccccc32)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803146770	PZYHQAJJHOHIPG-NBHGPNQESA-N	441.919	1.737	50	20	IDGD	
C[C@H](CC(N)=O)C(=O)NC[C@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1	1803663380	FLMZJTDXXHLJPR-SUYBPPKGSA-N	425.327	1.384	50	20	IDGD	
COc1cncc(CCC(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@H]2c2cccnc2)c1	1804482119	QGUYXHRGQUMMFD-DSKINZAPSA-N	446.935	1.724	50	20	IDGD	
NC(=O)c1ncccc1C(=O)NC[C@H]1CCN(C(=O)C(Cl)Cl)[C@@H]1c1cccnc1	1804817410	ULZUKQSLODJHGC-IUODEOHRSA-N	436.299	1.699	50	20	IDGD	
Cc1ccc(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)nc1	1805870754	XVNVMUCZLPTDIJ-DENIHFKCSA-N	444.300	1.098	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2nccs2)[C@H]1c1cccnc1	1805942569	XLPRWWWPTJXHBQ-CRAIPNDOSA-N	430.534	1.231	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)C(F)(F)C(F)(F)C(=O)O)[C@@H]1c1cccnc1)[C@@H](F)Cl	1808308395	JYGBMNHZHPXVAL-HBNTYKKESA-N	443.756	1.977	50	20	IDGD	
CC(=O)OC[C@H](OC(C)=O)C(=O)N1CC[C@H](CNC(=O)[C@@H](F)Cl)[C@H]1c1cccnc1	1808313811	PUKHSXFNMQEATL-YYIAUSFCSA-N	443.859	1.117	50	20	IDGD	
C[C@@H]1CCc2c(C(=O)NC[C@@H]3CCN(C(=O)[C@@H](O)CCl)[C@@H]3c3cccnc3)n[nH]c21	1809250095	DPAXIHQWINHNHM-BDOZRKEQSA-N	431.924	1.774	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)/C=C\C(=O)NC2CC2)[C@H]1c1cccnc1	1810137525	XCWYVOICPIKPRN-RGQFZIAOSA-N	449.349	1.706	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)c2ccc[nH]2)[C@@H]1c1cccnc1	1810624928	YWJNKOWPGAWFPO-KXBFYZLASA-N	433.472	1.042	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@@H](CNC(=O)Cn2ccncc2=O)[C@H]1c1cccnc1	1812339812	LPLXWRBYRHVHBY-QFBILLFUSA-N	431.924	1.609	50	20	IDGD	
CC(C)CCC(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1	1812601200	XAZCOUZUTOKHNW-DYESRHJHSA-N	438.532	1.836	50	20	IDGD	
Cc1ccoc1C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1813070910	OBWPUROUPJOOME-XLIONFOSSA-N	427.505	1.676	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)CCn2ccnn2)[C@@H]1c1cccnc1	1813435433	GPHYIDLYPYLMOW-QRTARXTBSA-N	435.326	1.553	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)Cc2cnn(C)c2)[C@H]1c1cccnc1	1813459984	OUYNIDHHDGUYOR-QANKJYHBSA-N	434.338	1.847	50	20	IDGD	
COc1ccnc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)[C@H](O)CCl)n[nH]2)c1OC	1814872836	GQJPDXWYDYYUGM-QWHCGFSZSA-N	437.884	1.728	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)C23CC(F)(C2)C3)n[nH]1	1815286547	BSCXJFQLVGKLTM-TVRCVXMWSA-N	441.467	1.606	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@H]1CCc2nc(NC(=O)c3nc4ncccn4n3)sc2C1	1818306716	PDUFGALKAZRGMZ-NSHDSACASA-N	445.581	1.658	50	20	IDGD	
Cc1ccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)c(C)n1	1820046847	XAFOUNSDHNPLRK-HXUWFJFHSA-N	447.304	1.721	50	20	IDGD	
CC(C)c1cc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)CCC(=O)NN(C)C)CC3)n[nH]1	1821551709	PHRWDXTUNRWCLR-GFCCVEGCSA-N	447.565	1.588	50	20	IDGD	
Cc1nc(C)c(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)o1	1822414401	DSLAEBSCJUZIKW-OAHLLOKOSA-N	431.497	1.693	50	20	IDGD	
CCCC(=O)N[C@@H](C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1	1822414908	NUIBSDHCELQKPJ-GOEBONIOSA-N	449.556	1.080	50	20	IDGD	
C[C@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)CCBr)CC1)n1cnnn1	1826360061	CMSHWXDQPUKXLU-UKRRQHHQSA-N	427.347	1.639	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)n2)CC1	1827602118	BQPCNFCMBRBTQR-BXUZGUMPSA-N	441.326	1.905	50	20	IDGD	
CC(C)n1cnc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)n1	1827863635	JIDJYMCVPTYLAU-SFHVURJKSA-N	447.584	1.465	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cnccn2)CC1	1828925756	QVWIJJFPIKOLSI-LJQANCHMSA-N	437.504	1.022	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2c[nH]c(=O)cn2)CC1	1829718727	ZUIMVSMRWSHYCP-IUODEOHRSA-N	425.327	1.787	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)C(C)(C)C)CCO2	1830631836	IGCMAZYZBHXUFR-PMUMKWKESA-N	435.359	1.023	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)C(F)(F)C(F)F)CCO2)C1	1832189733	MHZUOOGWBLQMQT-KBPBESRZSA-N	439.233	1.580	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC([C@H]2CCCCN2C(=O)CCS(C)(=O)=O)CC1	1832398422	IVDRPMJFLQLYQN-QGZVFWFLSA-N	432.659	1.892	50	20	IDGD	
O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)CCc1cccs1)CCO2	1833155813	VLECOTXHPKWEBL-SFHVURJKSA-N	445.379	1.922	50	20	IDGD	
O=C1CCc2ccc(C(=O)N3CCC(N4CCC(NC(=O)[C@H](O)CCl)CC4)CC3)cc21	1833311900	GUKPJHSBLNQNDD-OAQYLSRUSA-N	447.963	1.600	50	20	IDGD	
COc1ccc(F)c(C(=O)N2CCC(N3CCC(NC(=O)[C@H](O)CCl)CC3)CC2)c1	1833312779	DGPZMHIFLZFAFF-LJQANCHMSA-N	441.931	1.619	50	20	IDGD	
COC(=O)CCCCCC(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)CCl)CC2)CC1	1833312815	GFULDPNRSBVMBA-SFHVURJKSA-N	445.988	1.281	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)Cn3cc([N+](=O)[O-])cn3)CC2)CC1	1833786961	ONVBBQXQNCWJGP-KRWDZBQOSA-N	440.932	1.380	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@](C)(Cl)CCl)C3)C2)cn1	1833998958	AWEKONXAFWAFRA-MOPGFXCFSA-N	430.332	1.696	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccncc3)CCO2)C1	1834020157	NVLOWLPUPQUHAI-QAPCUYQASA-N	426.311	1.325	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)Cc3ccccc3)C2)C1	1834822636	ZSZMCZMHUWKEML-LJQANCHMSA-N	425.323	1.471	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](OC)c1ccccc1)CCO2	1835285598	NUWWGHNNQDZAOA-BBTUJRGHSA-N	440.924	1.084	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](C)NC(=O)NCC)CC2)CC1	1835704778	ZAZQSPZMDABYNQ-CRAIPNDOSA-N	444.020	1.673	50	20	IDGD	
O=C(c1cnc(C(F)(F)F)cn1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1836375640	OCLOWABPZHRVOE-WFASDCNBSA-N	440.781	1.100	50	20	IDGD	
O=C(Cc1ccc2c(c1)CCCO2)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1836680088	QHDAWAYLZYBMPV-TZIWHRDSSA-N	440.899	1.545	50	20	IDGD	
O=C([C@H](O)CCl)N1CCC(OC2CCN(C(=O)[C@H]3Cc4ccccc4O3)CC2)CC1	1836717414	WIXOMQXGZCPKRC-UYAOXDASSA-N	436.936	1.588	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc4cccnc4n3)CCO2)C1	1836832465	BJHOGQYRDDAJFJ-HRAATJIYSA-N	432.908	1.717	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc4cn[nH]c4cn3)CCO2)C1	1837192158	FUEULAGBCNTBAM-FQEVSTJZSA-N	435.912	1.293	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)CCCn3cccc3)C2)C1	1837718167	YSEKUWSCUCTEHG-NRFANRHFSA-N	437.613	1.576	50	20	IDGD	
Cc1n[nH]c(C)c1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)CBr)C2)C1	1837801562	WHGXQTCJSWDBBN-KPZWWZAWSA-N	443.342	1.128	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3cn[nH]c3)C2)C1	1839150487	NUKXSTXUNAGSRP-ZWKOTPCHSA-N	433.336	1.035	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)ccc1O	1839310253	FPLABBSEURCVHD-YJBOKZPZSA-N	445.285	1.461	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3occc3C)C2)C1	1839964067	FJQTWWKPNKKHHZ-KSSFIOAISA-N	429.311	1.832	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](C)Br)CCO2)C1	1840030406	KQHLGQJNOPOGMG-HEHGZKQESA-N	425.751	1.634	50	20	IDGD	
CC1=CC[C@H](C(=O)N2CCOC[C@]3(CN(C(=O)[C@@H](C)Br)CCO3)C2)CC1	1840033240	YKYCYYXAUBPFMI-GJYPPUQNSA-N	429.355	1.973	50	20	IDGD	
Cn1ncc2cc(C(=O)N3CCOC[C@]4(C3)CN(C(=O)C(Cl)Cl)CCO4)ccc21	1840188517	NXHOKWXQUKARQW-IBGZPJMESA-N	441.315	1.447	50	20	IDGD	
CCc1[nH]nc(C(=O)N2CCCC23CN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C3)c1F	1842309260	KTCZRFIATUBNOH-FSJBWODESA-N	429.456	1.062	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)Cc1csc(C)n1)C2	1843415502	TYDDQCOCPGBNPR-YDZHTSKRSA-N	428.518	1.331	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC2(CCCN2C(=O)[C@@H](O)NC(=O)OC(C)(C)C)C1	1845436458	JQCOQVOGGVMTQH-VXGBXAGGSA-N	434.331	1.064	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC2(CCCN2C(=O)c2cnc3c(c2)CCNCC3)C1	1845797858	DVPFPWHQZKQDQV-INIZCTEOSA-N	435.366	1.760	50	20	IDGD	
O=C(c1cc(O)n[nH]1)N1CC2(CCCN2C(=O)[C@@H](Br)Cc2ccccc2)C1	1845941096	FBRBOBXHPDGOLN-AWEZNQCLSA-N	433.306	1.939	50	20	IDGD	
CC(C)(C)OC(=O)N1CC2(CC(C(=O)N3CCCC34CN(C(=O)[C@@H](F)Cl)C4)=NO2)C1	1846123114	JHRDHTVVWIDYMB-CYBMUJFWSA-N	444.891	1.490	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)Cc1ccc([N+](=O)[O-])c(OC)c1)C2	1846363314	BFAWRWUFOKKCRE-CQSZACIVSA-N	425.869	1.603	50	20	IDGD	
Cc1cc2nnc(C(=O)N3CC[C@H]4[C@@H]3CCN4C(=O)[C@@H](C)CBr)c(C)n2n1	1847501760	WTZNWBAEJDWCMB-BPNCWPANSA-N	435.326	1.588	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H]1CC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl	1847556090	CQOKGFKWEZFHAA-UGUYLWEFSA-N	429.945	1.578	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)cc1	17253982	MGPIHXCEXAUGMQ-UHFFFAOYSA-N	431.514	1.410	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)c2ccc(CCNS(C)(=O)=O)cc2)cc1OC	24290045	AKJYZFODYMWJBL-UHFFFAOYSA-N	449.529	1.651	50	20	IDGD	
O=C(COC(=O)c1ccc(OC(F)(F)F)cc1)NNC(=O)[C@H]1COc2ccccc2O1	104537089	KPICRZQSWDJCGN-OAHLLOKOSA-N	440.330	1.729	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C2=NN(c3ccccc3)[C@@H](C(N)=O)C2)o1	109019522	VAOKGXKDHPKKKF-QGZVFWFLSA-N	426.477	1.003	50	20	IDGD	
CCOc1ccc(C(=O)CCC(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)cc1OCC	728382550	YCSCRDJWKQPTBB-CQSZACIVSA-N	426.491	1.029	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)N1CCN(CC(=O)NC2CCCCC2)CC1	728593979	APYGPDRTVKQUTK-UHFFFAOYSA-N	441.536	1.064	50	20	IDGD	
COC(=O)N1CCC[C@@H](NC(=O)NNC(=O)c2cc(OC)ccc2Br)C1	728751137	JLDMZJAHKYPNGQ-SNVBAGLBSA-N	429.271	1.633	50	20	IDGD	
O=C(Nc1sccc1C(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1)c1ccccc1Cl	730207245	LOYLORGUHVHVTB-JTQLQIEISA-N	441.918	1.850	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1ccccc1	730671634	HUEBWXNTTSWILW-HNNXBMFYSA-N	432.502	1.413	50	20	IDGD	
Cc1ccc(-c2noc(CCC(=O)NNC(=O)CCN3C[C@H](C)O[C@@H](C)C3)n2)cc1F	732262679	VGCXWSNCADXIRN-GJZGRUSLSA-N	433.484	1.763	50	20	IDGD	
C[C@@H]1Cc2ccccc2N1C(=O)[C@H]1CCCC[C@H]1C(=O)NNC(=O)C(=O)N1CCCC1	732755093	ODYCIGIUWIRKAP-NXHRZFHOSA-N	426.517	1.540	50	20	IDGD	
Cn1c(NNC(=O)[C@@H]2CCCN(S(=O)(=O)c3ccccc3)C2)nc2ccccc2c1=O	733260407	DNTHIEWUNZBWIH-OAHLLOKOSA-N	441.513	1.478	50	20	IDGD	
O=C1NC(=O)C2(CCC(C(=O)NNc3cc(C(F)(F)F)nc(-c4ccccn4)n3)CC2)N1	734260382	KHMDAJLIOCXVOL-UHFFFAOYSA-N	449.393	1.769	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCc2ccccc2)cc1C(=O)NNC(=O)c1cnn(C)c1	735471410	WBRGDHIJCBAEJW-UHFFFAOYSA-N	427.486	1.282	50	20	IDGD	
CCCC[C@@H](COC)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	737061618	SSLDQIOIMPVYBW-INIZCTEOSA-N	426.539	1.620	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)N1CCN(C(=O)Cc2ccccc2F)CC1	738497635	ZRKCKTSHCBWLJY-UHFFFAOYSA-N	428.464	1.470	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1)NNC(=O)c1ccccc1Cl	740887555	ZIYAYUPXRVKNJW-UHFFFAOYSA-N	445.863	1.467	50	20	IDGD	
O=C(COC(=O)C[C@H]1CN(Cc2ccccc2)CCO1)NNC(=O)c1cccc(Cl)c1	741355219	OVEJZZAQKBLQJZ-IBGZPJMESA-N	445.903	1.935	50	20	IDGD	
CC(C)(C)C(=O)NCc1ccc(C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1	741534763	JXZDALODTSZEKI-UHFFFAOYSA-N	431.514	1.827	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)[C@@H]3CCCCN3C(=O)c3ccc(O)nn3)cc2C1	741740463	AIKUIXDZBFJRKO-WFASDCNBSA-N	443.529	1.824	50	20	IDGD	
Cc1nn(C)c2sc(C(=O)N[C@@H](C)C(=O)NNc3ccccc3S(C)(=O)=O)cc12	743366850	COPYUQRLEMBYMY-NSHDSACASA-N	435.531	1.608	50	20	IDGD	
O=C(Cc1cc(O)nc(O)n1)NN=Cc1ccc(OC(=O)c2cccc([N+](=O)[O-])c2)cc1	743445871	JVJBNPFGZHAKPS-UHFFFAOYSA-N	437.368	1.708	50	20	IDGD	
NC(=O)[C@@H](NNC(=O)CNC(=O)c1cccs1)c1ccc(Br)cc1F	743473080	ANNXXQHHNFMUQK-ZDUSSCGKSA-N	429.271	1.227	50	20	IDGD	
C[C@@H](CN1CCN(c2ccccc2)CC1)NC(=O)NNC(=O)c1cc(Br)c[nH]1	743507938	GZEQOJIAQGYSFP-AWEZNQCLSA-N	449.353	1.932	50	20	IDGD	
COc1cccc(C(=O)NCCNC(=O)NNC(=O)c2cccc(Br)c2)c1	743530922	WUGCBPNPQUKPPU-UHFFFAOYSA-N	435.278	1.832	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2ccc(N(C)C)cc2)cc1S(=O)(=O)NC(C)C	743827252	ARUBKYTXODRDII-UHFFFAOYSA-N	449.533	1.914	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)Nc2ccnn2[C@@H]2CCS(=O)(=O)C2)c1C	744378184	JWQIGIUMNXODQR-ZKTNYTPDSA-N	431.518	1.853	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)[C@@H]1CCCN1Cc1ccccc1	744620244	HOJANKCTGIGWPR-FQEVSTJZSA-N	444.557	1.815	50	20	IDGD	
O=C(NNC(=O)c1sccc1S(=O)(=O)N1CCCC[C@@H]1CCO)c1ccccn1	745475075	TZMHDWASGUNUFC-CYBMUJFWSA-N	438.531	1.144	50	20	IDGD	
C[C@H]1C[C@@H](NC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])C(=O)N1c1ccccc1	745880774	BAWZBPJWHHFSRV-DZGCQCFKSA-N	427.417	1.498	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)N[C@@H]2CCCN(CC(F)(F)F)C2=O)cc1	746340138	VVVDOKMJQQBAKM-SWLSCSKDSA-N	446.426	1.736	50	20	IDGD	
Cc1ccc(OCCCC(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1C	747041281	XZRMKPRIZUCOPR-HXUWFJFHSA-N	442.468	1.993	50	20	IDGD	
CCS(=O)(=O)N1CCC(C(=O)NNc2nc(-c3ccccn3)nc3c2CCC3)CC1	748340335	XHQJMKMQHGHKEV-UHFFFAOYSA-N	430.534	1.532	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)NC[C@@H](c1ccccc1Cl)N1CCOCC1	748620262	LGEUITUYMYTQHV-PBHICJAKSA-N	428.917	1.095	50	20	IDGD	
Cc1ncc(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)c(C(C)C)n1	748620885	VIKMNFRHFSHWOU-UHFFFAOYSA-N	432.550	1.601	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)NNC(=O)[C@@H](C)Oc2ccc(OCC)cc2)o1	748641340	UAHIPUUAPOABRJ-GFCCVEGCSA-N	426.447	1.632	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)c2cc(S(=O)(=O)NC)cs2)cc1	748689029	FOVLOYFQWMSRSL-LLVKDONJSA-N	427.504	1.283	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)c1cccc(CS(N)(=O)=O)c1	749400366	GAKIDJDYDKALNJ-CQSZACIVSA-N	427.482	1.857	50	20	IDGD	
COc1ccc(-c2noc(CCC(=O)NNC(=O)CNC(=O)c3cccs3)n2)cc1	751208597	HGHNOMQMLMJHCV-UHFFFAOYSA-N	429.458	1.317	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)c2cc(S(=O)(=O)N(C)C)oc2C)cc1	753179503	TXXNBYOTHMZVIM-CYBMUJFWSA-N	439.490	1.466	50	20	IDGD	
CCOc1ccc(NC(=O)NNC(=O)c2cccnc2)cc1S(=O)(=O)N1CCCC1	755470615	PXRNRPBKBHTZQW-UHFFFAOYSA-N	433.490	1.731	50	20	IDGD	
COC(=O)CNC(=O)c1ccc(NC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1	755549463	SRQNGUNDELUVJO-UHFFFAOYSA-N	436.428	1.242	50	20	IDGD	
CN(CC(=O)OCC(=O)NNC(=O)c1cccc(Cl)c1)C(=O)OCc1ccccc1	755677751	RPBNZDDMFNUARI-UHFFFAOYSA-N	433.848	1.913	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)Nc2cccc(OC[C@H]3CCCO3)c2)c2ccccc2c1=O	755723751	WXJDIUUEGSQKDP-MRXNPFEDSA-N	437.456	1.958	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3csc([C@H]4CCCO4)n3)CC2)cc1	756003714	SHWUTVHQAKQNDX-LJQANCHMSA-N	443.573	1.882	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)Nc1cccc(C(=O)N2CCSCC2)c1	756274529	SNHLVKDCBREKIA-GOSISDBHSA-N	442.497	1.868	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)Nc2ccc3c(ccn3CC(=O)N3CCOCC3)c2)cc1	756293622	JAKITXCCLSEGET-UHFFFAOYSA-N	446.467	1.838	50	20	IDGD	
O=C(Cn1cc(NC(=O)NNC(=O)c2ccc(COc3ccccc3)o2)cn1)NC1CC1	756797062	WSUWEGZFHFDXPM-UHFFFAOYSA-N	438.444	1.800	50	20	IDGD	
CCOc1cc(C(=O)N(C)C)ccc1NC(=O)NNC(=O)[C@H]1COc2ccccc2O1	756869323	RWADZWZHQMMIGA-GOSISDBHSA-N	428.445	1.780	50	20	IDGD	
Cc1cnn(-c2ccc(S(=O)(=O)NNC(=O)c3cc([N+](=O)[O-])ccc3O)cc2F)c1	757654016	FEXDAIIPLQUVEL-UHFFFAOYSA-N	435.393	1.557	50	20	IDGD	
COCc1nc2n(n1)C[C@H](NC(=O)NNC(=O)c1ccc(Br)s1)CC2	757784963	BUKNTMQLWRMYFN-MRVPVSSYSA-N	429.300	1.208	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)[C@H](CC(C)C)/N=C2/NS(=O)(=O)c3ccccc32)nc1	759728328	BUJFBYPBYBIBFU-HNNXBMFYSA-N	445.501	1.465	50	20	IDGD	
O=C(NNC(=O)c1ccncc1)C(=O)Nc1cc(F)c(F)cc1I	763465226	VVTRIANUDMWHJW-UHFFFAOYSA-N	446.151	1.364	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(-c2nnc3n2CCCC3)cc1	763467636	FWHFVDCRZXZWBZ-UHFFFAOYSA-N	449.427	1.589	50	20	IDGD	
C[C@H]1Oc2ccc(NC(=O)C(=O)NNC(=O)c3ccccc3Br)cc2NC1=O	763484369	YCCRUCGCZVUCIL-SECBINFHSA-N	447.245	1.568	50	20	IDGD	
CN(C)c1ccc(C(F)(F)F)cc1NC(=O)C(=O)NNC(=O)c1ccc2c(c1)OCO2	763547527	DAULRRIHDWXLDB-UHFFFAOYSA-N	438.362	1.900	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2cc(N3CCCC3=O)ccc2F)c1	763644874	ODROANJAEGTGEU-UHFFFAOYSA-N	442.447	1.734	50	20	IDGD	
O=C(COc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1ccc(C(=O)NC2CC2)cc1	763683839	BBZIIROEOUMXKQ-UHFFFAOYSA-N	430.848	1.397	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(OCC3CCOCC3)cc2)c1	763757792	KHYLWFBHEUAUHX-UHFFFAOYSA-N	440.500	1.958	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)C(=O)Nc2cccc(OC3CCCC3)c2)c2ccccc2c1=O	763791587	WVISCNZVMWRSPK-UHFFFAOYSA-N	449.467	1.655	50	20	IDGD	
CCOc1cc(C(=O)N(C)C)ccc1NC(=O)C(=O)NNC(=O)COc1ccc(F)cc1	763839245	HIILWEXDSXXXJW-UHFFFAOYSA-N	446.435	1.091	50	20	IDGD	
CNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)cc1Cl	763872866	PNGMGQKNIXARIO-JTQLQIEISA-N	436.827	1.392	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)CCN3C(C)=O)cc1OC	763900102	AIXDSPBSLJGNDX-UHFFFAOYSA-N	440.456	1.403	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)OCC(=O)N3)cc1OC	763911327	KPAYCYSUIVDGPZ-UHFFFAOYSA-N	442.428	1.215	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)cc1F	763995234	OTDCQKMZRBLILR-UHFFFAOYSA-N	427.186	1.103	50	20	IDGD	
COc1ccccc1Oc1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)cc1	764002082	ISPSUEYNDULLOS-CYBMUJFWSA-N	447.469	1.008	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)c(OCc2ccccc2)c1	764002698	QQFMHDNNVCVFMW-MRXNPFEDSA-N	445.497	1.095	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(-n3cnc4ccccc43)nc2)c1O	764132341	SSQUUZXQGKHAIU-UHFFFAOYSA-N	446.423	1.534	50	20	IDGD	
Cc1cc(S(C)(=O)=O)ccc1NC(=O)C(=O)NNC(=O)c1cccc2cccnc12	764149608	WXYWCQQUTDHDJL-UHFFFAOYSA-N	426.454	1.346	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)C(=O)Nc1ccccc1N1CCCC1	764202431	CFKLLUUDAAJLJV-UHFFFAOYSA-N	433.509	1.678	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)C(=O)Nc1ccc2c(c1)OC(C)(C)O2	764204114	JCBUIIALKVETRQ-UHFFFAOYSA-N	436.465	1.585	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)C(=O)Nc2ccc3nc(C)cn3c2)c1	764232007	LYWATUHDDUOYEL-UHFFFAOYSA-N	446.261	1.814	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)C(=O)Nc1ccc(CCN2CCOCC2)cc1	764239523	NXWLLIREUQPCHG-UHFFFAOYSA-N	449.511	1.302	50	20	IDGD	
CCCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)C(C)(C)c2ccccc2)cc1	764314587	VCJXBHSOHRMVBE-UHFFFAOYSA-N	446.529	1.902	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C(=O)Nc1ccc(S(=O)(=O)C(F)F)cc1)c1ccccc1	764332433	TZQJYYGAXMRHPF-HNNXBMFYSA-N	439.440	1.963	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N[C@@H](C)c3ccccc3)c2)n[nH]1	765587436	WINPALNTWYJKBN-AWEZNQCLSA-N	427.486	1.832	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)CC3=CCCCC3)CC2)cc1	765726256	AIOCVMCZMCPLLO-UHFFFAOYSA-N	434.562	1.339	50	20	IDGD	
Cc1nn(C)c(C)c1CC(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	765757952	IJQLRHVZWDHQKG-UHFFFAOYSA-N	432.956	1.198	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1cc(C)n(CCCOc2ccc(F)cc2)n1	766264233	FXHSLRSKVBOSOT-UHFFFAOYSA-N	443.439	1.680	50	20	IDGD	
C[C@@H](c1ccccc1)[C@@](C)(O)C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	766636571	QJTJCQTXSNFGMQ-MHECFPHRSA-N	438.528	1.147	50	20	IDGD	
O=C(NNC(=O)c1cccc2ccsc12)c1cccc(S(=O)(=O)N2CCOCC2)c1	767048045	YQCXJXGTQDEENZ-UHFFFAOYSA-N	445.522	1.997	50	20	IDGD	
Cc1cccc(C)c1CCNC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	767215799	GLJSGRAIGAUIME-UHFFFAOYSA-N	446.577	1.503	50	20	IDGD	
O=C(NNC(=O)c1ccc(Br)s1)NC1CCN([C@H]2CCC[C@@H]2O)CC1	767937255	IKMVWULGPOZVRN-RYUDHWBXSA-N	431.356	1.832	50	20	IDGD	
O=C1CCC(=O)N(c2ccc(C(=O)NNC(=O)c3cc(-c4ccc(F)cc4)[nH]n3)cc2)N1	768280298	YEZOYQZDGPWVAM-UHFFFAOYSA-N	436.403	1.449	50	20	IDGD	
CC(C)[C@H](NC(=O)OC(C)(C)C)C(=O)NCC(=O)NNC(=O)C(C)(C)c1ccccc1	768402095	NVNIQHLZSZZLJP-KRWDZBQOSA-N	434.537	1.777	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)[C@H](C)S(=O)(=O)c1ccc(F)cc1	768639329	OVGSMUSGXMRPKK-NSHDSACASA-N	430.479	1.543	50	20	IDGD	
Cc1cc(Br)ccc1S(=O)(=O)NNC(=O)c1cc([N+](=O)[O-])ccc1O	769872318	WPOLWDIHMGLIGG-UHFFFAOYSA-N	430.236	1.995	50	20	IDGD	
COc1ccc2c(c1)nc(CNC(=O)NNC(=O)c1csc(N3CCOCC3)n1)n2C	770306011	JTALSGLDEXHXTR-UHFFFAOYSA-N	445.505	1.019	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	770650559	VSKYLQYRBYJVPL-ZBEGNZNMSA-N	434.836	1.309	50	20	IDGD	
CN(CCC1CCN(c2ccncc2)CC1)C(=O)NNC(=O)CNC(=O)c1cccs1	770772999	CSEKXMSWTQSMGU-UHFFFAOYSA-N	444.561	1.852	50	20	IDGD	
COCCS(=O)(=O)c1ccc(C(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)cc1	770964468	CHRHLTWXAFFACZ-UHFFFAOYSA-N	448.505	1.464	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)c3sccc3S(=O)(=O)N3CCCCC3)nc21	770972941	KQSKKAGVEHYFTN-UHFFFAOYSA-N	437.507	1.062	50	20	IDGD	
COc1ccc(C(=O)O[C@@H](C)C(=O)NNC(=O)CC(C)C)cc1S(=O)(=O)NC(C)C	771855247	YMAFHKKLNQARCP-ZDUSSCGKSA-N	443.522	1.121	50	20	IDGD	
CS(=O)(=O)c1cc(Br)ccc1NC(=O)C(=O)NNc1cccc(C#N)c1	773683033	PFLTZUMYFNJSFO-UHFFFAOYSA-N	437.275	1.806	50	20	IDGD	
CCOc1cnc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)cn1	777767135	YCCJSVKBVXWUGO-UHFFFAOYSA-N	433.490	1.125	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)[C@@H]1CC(=O)N(c2cccc3ccccc23)C1	778432970	FFVHBDXUYNFXBA-OAHLLOKOSA-N	426.473	1.865	50	20	IDGD	
CC(C)(C)OC(=O)N=c1cc[nH]cc1C(=O)OCC(=O)NNC(=O)c1cccc(C#N)c1	781391056	LHZOQTFHLOYQCR-UHFFFAOYSA-N	439.428	1.340	50	20	IDGD	
O=S(=O)(CBr)NCCCN(C1CC1)S(=O)(=O)c1cccc(F)c1	782472107	HTQYTQXYEXVGGT-UHFFFAOYSA-N	429.333	1.641	50	20	IDGD	
CC[C@H](C)NS(=O)(=O)Cc1cccc(NC(=O)C(=O)NNc2cc(C)nc(C)n2)c1	783324821	OQWKKHPZCQZJAI-LBPRGKRZSA-N	434.522	1.393	50	20	IDGD	
CCOc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NN=c1sc2ccccc2n1C	783350393	ZTTJEWDNWVPZEH-UHFFFAOYSA-N	441.513	1.911	50	20	IDGD	
CNS(=O)(=O)c1cccc(NC(=O)C(=O)NN=c2sc3ccccc3n2C)c1C	783351944	PFWIKOYNZKBLGK-UHFFFAOYSA-N	433.515	1.027	50	20	IDGD	
O=C(NNc1ccc(-n2cccn2)nn1)C(=O)Nc1ccccc1I	783433380	RZCHJRDKZNZAHN-UHFFFAOYSA-N	449.212	1.349	50	20	IDGD	
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)NNC(=O)c1ccc(Cl)cc1O	783811053	REDZUMKZXAVNCD-UHFFFAOYSA-N	429.794	1.364	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCCCC2)cc1NC(=O)C(=O)NNc1ccc(C)nn1	783954406	VHGJFMLSIJKEQP-UHFFFAOYSA-N	448.505	1.050	50	20	IDGD	
N#Cc1ccccc1Oc1ccc(NC(=O)C(=O)NNC(=O)C(=O)N2CCCC2)cc1F	783996683	IKHMJKPLSLCSOU-UHFFFAOYSA-N	439.403	1.198	50	20	IDGD	
Cc1cc(SC(C)(C)C)ccc1NC(=O)C(=O)NNC(=O)CNC(=O)c1ccco1	784002239	MLWGKKJTUUWRSH-UHFFFAOYSA-N	432.502	1.995	50	20	IDGD	
COC(=O)c1cc(C)ccc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	784215023	BCHSAWSPGQPIJE-UHFFFAOYSA-N	446.485	1.304	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)C(=O)Nc2ccc(N3CCCN(C)CC3)cc2)c1	784851572	LPBZTYYQCPNPIH-UHFFFAOYSA-N	425.489	1.697	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)C(=O)Nc2cc3c(cc2[N+](=O)[O-])OCCCO3)c1	784853107	XGJPIPXAVWCHDM-UHFFFAOYSA-N	430.373	1.625	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2ccccc2S(=O)(=O)C(F)F)n1	785230762	DRGHAVPQSGGGIM-UHFFFAOYSA-N	442.448	1.401	50	20	IDGD	
C[C@@H](CNC(=O)C(=O)Nc1ccccc1S[C@@H](Cl)C(F)(F)F)S(N)(=O)=O	785300587	VPUVHFYUADEZAO-JVXZTZIISA-N	433.861	1.638	50	20	IDGD	
Cc1cc2c(cc1C)O[C@@H](C(=O)OCC(=O)NNC(=O)[C@H]1COc3ccccc3O1)C2	786392422	VVWOMOHMGKXAFX-RTBURBONSA-N	426.425	1.138	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)c1nc(C(F)(F)F)cs1	787418595	QJQCFTSTVCJPIE-MRVPVSSYSA-N	426.384	1.843	50	20	IDGD	
COc1ccc(OC)c([C@H]2C[C@H]2C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c1	788203406	XRJSKJPNQIVAOI-NVXWUHKLSA-N	443.412	1.720	50	20	IDGD	
Cc1cc(C)cc(C(=O)N2CCC[C@H](C(=O)NNc3ccccc3S(N)(=O)=O)C2)c1	788229179	UZBMGXHNWRTXNB-INIZCTEOSA-N	430.530	1.946	50	20	IDGD	
CC(C)c1ncc(S(=O)(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)[nH]1	788914189	BPYLFPWGYFQFSP-UHFFFAOYSA-N	430.531	1.331	50	20	IDGD	
CS(=O)(=O)CC[C@H](C(=O)OCC(=O)NNC(=O)c1ccc(C#N)cc1)c1ccccc1	789109033	RXTCWZWCEMUUBT-SFHVURJKSA-N	443.481	1.081	50	20	IDGD	
CCNC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)COc2cc(C)ccc2C)c1C	789731944	LDZOZLJJLJEKKZ-UHFFFAOYSA-N	441.488	1.918	50	20	IDGD	
O=C(NNC(=O)[C@H]1OCC[C@H]1c1ccccc1)C(=O)Nc1cccc(N2CCCC2=O)c1	789810810	QMIOHDQAOVLJNZ-ICSRJNTNSA-N	436.468	1.472	50	20	IDGD	
O=C(NNC(=O)[C@H]1OCC[C@H]1c1ccccc1)C(=O)Nc1ccn(-c2ncccc2F)n1	789810981	BFOVBFYAQQTPRE-YOEHRIQHSA-N	438.419	1.065	50	20	IDGD	
CCc1nn(C)c(CC)c1CC(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	790652115	VBQLTQNMAIAFOF-UHFFFAOYSA-N	436.557	1.817	50	20	IDGD	
CCOC(=O)c1cc(C=NNC(=O)CN2c3cccc4cccc(c34)S2(=O)=O)on1	792943117	YDXOMXVJFZCPCU-UHFFFAOYSA-N	428.426	1.664	50	20	IDGD	
Cc1cc(C)nc(-n2nc(C(=O)NNC(=O)CNC(=O)OCc3ccccc3)cc2C)n1	794077714	XDMDSOHGPVKSED-UHFFFAOYSA-N	437.460	1.275	50	20	IDGD	
CC(=O)N[C@@H](CC(=O)NNc1ccccc1S(=O)(=O)N(C)C)c1c(F)cccc1F	795160589	FAMQANKHASKCNM-INIZCTEOSA-N	440.472	1.926	50	20	IDGD	
CC(C)[C@H](NC(=O)NCc1ccccc1)C(=O)NNc1ccccc1S(=O)(=O)N(C)C	795182201	RHFHXWHYIFWRCL-IBGZPJMESA-N	447.561	1.904	50	20	IDGD	
Cc1cccc(=O)n1C[C@](C)(O)C(=O)OCC(=O)C(C#N)=C1N(C)c2ccccc2N1C	795765828	ABFVSHQNPGCZFE-QHCPKHFHSA-N	436.468	1.341	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN[C@H](CO)c2ccccc2OC(F)(F)F)n1	796526062	QDJYXGWIQNVETB-GFCCVEGCSA-N	432.424	1.363	50	20	IDGD	
CCn1cc(C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)c(C(F)(F)F)n1	797791403	ICNOOBMNWMSXQF-UHFFFAOYSA-N	432.428	1.598	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1ccc(Br)c(OC(F)(F)F)c1	800806988	OYCMZIVAZLPBIC-MRVPVSSYSA-N	445.213	1.543	50	20	IDGD	
CC(C)(C(=O)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1)N1CCOCC1	801145845	JAEXEDMLYMNYNW-QFIPXVFZSA-N	436.556	1.872	50	20	IDGD	
CCc1ccccc1-n1cc(O)c(C(=O)OCC(=O)NNC(=O)Cc2ccccc2C)n1	801420325	PWZNBRUWUVTPQT-UHFFFAOYSA-N	436.468	1.996	50	20	IDGD	
Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)NNC(=O)CCN1C[C@H](C)O[C@@H](C)C1	806338815	AFRURPTZJFHLDN-QWRGUYRKSA-N	443.298	1.926	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cccc3c2CNC3=O)ccc1OC(C)C	806975614	HPPIOYPYRLOBHJ-UHFFFAOYSA-N	426.429	1.126	50	20	IDGD	
COC(=O)c1c(C)csc1NC(=O)C(=O)NNC(=O)c1cc(Br)c[nH]1	806977131	WYJFLMLVSIITEL-UHFFFAOYSA-N	429.252	1.333	50	20	IDGD	
O=C(NC[C@H](c1ccccc1)N1CCCC1)NNC(=O)c1csc(N2CCOCC2)n1	807006460	ZAUWIFZKPJWWNR-GOSISDBHSA-N	444.561	1.761	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNc2ccc(-n3ccnc3)nn2)sc(C)c1C	807428877	JASQBZZQDCKCEJ-UHFFFAOYSA-N	429.462	1.599	50	20	IDGD	
COC(=O)Nc1cccc(CNC(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)c1	807492228	MJBILKIOXNZIBF-UHFFFAOYSA-N	436.494	1.773	50	20	IDGD	
O=C(COC(=O)[C@H]1C[C@@H](c2ccccc2)OC1=O)NNC(=O)c1cccc([N+](=O)[O-])c1	808588027	HYBSFMZRHPRYSL-CVEARBPZSA-N	427.369	1.203	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)CNS(=O)(=O)c1ccccc1C(F)(F)F	810194527	XLBYDVHPGIXSPZ-UHFFFAOYSA-N	445.419	1.382	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@@H]2c3ccccc3O[C@@H]2C)cc1	812430780	RNKIEDWPOTVKID-KUHUBIRLSA-N	432.502	1.468	50	20	IDGD	
Cc1cc(C)c(NC(=O)C(=O)NNC(=O)[C@@H]2CCc3nncn3C2)cc1Br	815691780	BDKXZXIUXYXLPF-LLVKDONJSA-N	435.282	1.006	50	20	IDGD	
CCOc1ccc(C(F)(F)F)cc1NC(=O)C(=O)NNC(=O)[C@H]1CCc2nncn2C1	815692677	YFOZHEKMDFLILN-JTQLQIEISA-N	440.382	1.044	50	20	IDGD	
CCOc1c(Br)cc(Cl)cc1NC(=O)C(=O)NNC(=O)[C@H]1CCCO1	815778914	JWWIQQYUZXAXBW-LLVKDONJSA-N	434.674	1.766	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(C)c(C(=O)NNC(=O)CNc2cccc(OC)c2)c1	825782056	POWWWAXHBZEJOG-UHFFFAOYSA-N	448.545	1.907	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)N2CCC(NS(C)(=O)=O)CC2)c(C)n1C[C@H]1CCCO1	843901583	QZZLMHRDRVOYOP-JKALPCAWSA-N	434.562	1.731	50	20	IDGD	
C=CCNC(=S)NNC(=O)c1cc(S(=O)(=O)NCC(C)C)ccc1Br	913435801	UWXWSTHDGMWVAZ-UHFFFAOYSA-N	449.396	1.678	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)Cc2cc3ccccc3nc2O)cc1OC	915571068	BQUYNOWOHXZZSB-UHFFFAOYSA-N	439.424	1.505	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NCc2ccc(C(=O)N3CCOCC3)cc2)cc1	916248985	SQSJUWHQTGQUDN-UHFFFAOYSA-N	442.472	1.077	50	20	IDGD	
CCOc1ccc(C=NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c(O)c1	916258686	IVKPJMFXJPXINC-UHFFFAOYSA-N	433.486	1.576	50	20	IDGD	
CN1CCN(CCCNC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)[C@H](c2ccccc2)C1	916485107	MYTORNBNPOGVAL-FQEVSTJZSA-N	440.504	1.918	50	20	IDGD	
Cc1nn(-c2ccccc2)cc1CCCNC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	916627670	KZBAUPXYTPHJKJ-UHFFFAOYSA-N	445.487	1.733	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)N[C@@H]1CCN2CCCC[C@H]12	916639258	SFLHWMIWJHIYOO-QZTJIDSGSA-N	435.550	1.042	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)N[C@H]1CCCOc2ccc(F)cc21	919792129	OYZPYLVTYJOEIC-AWEZNQCLSA-N	435.481	1.977	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccccc2)C1	919820516	KJIMZGRQMHZWJK-QGZVFWFLSA-N	431.514	1.486	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)Nc1cccc(CN2CCC[C@H]2C(N)=O)c1	920932702	BCXWHAWMCQTGLC-KUHUBIRLSA-N	443.479	1.896	50	20	IDGD	
CCCNC(=O)NNC(=O)c1ccc(NC(=O)C[C@@H]2SC(N3CCCC3)=NC2=O)cc1	921042126	BHYCLUFYCAGZRQ-HNNXBMFYSA-N	446.533	1.463	50	20	IDGD	
CC[C@]1(C(=O)NNC(=O)CCN2C[C@@H](C)O[C@H](C)C2)CCN(C(=O)OC(C)(C)C)C1	1116344175	IEWWYBGOMHRTOF-ZOCZFRKYSA-N	426.558	1.670	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2cccc3cccnc23)cc1	1117671304	FGLMOLBAJLSONZ-UHFFFAOYSA-N	428.470	1.373	50	20	IDGD	
COC(=O)C1(CNC(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)CCCC1	1319044914	FLWAZXRFQOJYRZ-UHFFFAOYSA-N	426.514	1.697	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C1CCC1)C2	1778091049	DMQSUVGZFAFPRO-UYVYXKLWSA-N	429.521	1.434	50	20	IDGD	
COc1ccc(F)c(C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](F)Br)C3)C2)c1	1781335642	YJZLGPAJEIEIAM-YOEHRIQHSA-N	433.249	1.968	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccnc1S)C2	1782167399	NDAUEMVDFPUVBZ-QMTMVMCOSA-N	427.954	1.752	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnc3ncccn13)C2	1782173099	XGWVFIXXQPHPBM-AKCHCHLHSA-N	435.912	1.111	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)Oc1ccccn1)C2	1782179465	XSSHRWOASCORAI-ZGPJWRFFSA-N	439.940	1.617	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)N1CC[C@@]2(CN(C(=O)[C@@H](C)CBr)CCO2)C1	1782698049	FUMTXLPIMZROMR-AHIWAGSCSA-N	435.315	1.409	50	20	IDGD	
C=C(Oc1ccccc1O)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](C)Br)C2)C1	1783533901	BBGJOKXIGYSGSY-ORAYPTAESA-N	439.306	1.898	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(CCN(C(=O)[C@@H]3CCc4ccccc4O3)C2)C1	1783838139	GDKDKZHIAWLLCP-FXAWDEMLSA-N	437.334	1.995	50	20	IDGD	
Cc1cccc(Cl)c1C(=O)N1CCO[C@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1	1783935007	OQPORBLFZUUYIE-NRFANRHFSA-N	436.940	1.465	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H]1C(=O)N1CCO[C@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783941520	DUBBYPXFNLUOBE-SGTLLEGYSA-N	436.336	1.629	50	20	IDGD	
COc1ncccc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21	1786011062	LWHZHVPBLROFMB-PYJNHQTQSA-N	430.274	1.374	50	20	IDGD	
COc1cnc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]32)cn1	1786243152	QWJLYYULOBUGTR-XBPIAWKYSA-N	431.320	1.315	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnnc(Cl)c3)C[C@@H]21	1786401283	WMKKEDSCVOACRO-DRZSPHRISA-N	431.718	1.508	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC1(c2ccc(NC(=O)CN3CCS(=O)(=O)CC3)cc2)CCC1	1786690053	DKNZOIUGVAGXON-QGZVFWFLSA-N	441.981	1.868	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)[C@H]1CNc2ccccc21	1786876941	XZJDTXLBISLPQL-OHYFQZGNSA-N	440.313	1.866	50	20	IDGD	
O=C(Cn1cc(Cl)cn1)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21	1787002551	UZOGPZYCJDHISC-UBHSHLNASA-N	433.734	1.301	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3noc4ccccc34)[C@H]2C1	1787007899	NJDMDACORGDVBE-AMVTXUCVSA-N	435.908	1.604	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)[C@H]3SC(=N)NC3=O)[C@H]2C1	1787492485	FQZGPTGPPLAXEA-WCBJTDJXSA-N	444.985	1.176	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C=N/O[C@@H]3CCCCO3)[C@H]2C1	1788660901	RFRNXNMYFLKKCB-HUGHUKRNSA-N	446.342	1.279	50	20	IDGD	
CCn1nc(C)cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]2C1	1789922309	CTOKGAHFSPGKQI-NZBPQXDJSA-N	431.306	1.495	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C(\C)NC(C)=O)C[C@@H]21	1790964646	VZKLOQPZUIHFDC-HXBQTNNPSA-N	430.343	1.180	50	20	IDGD	
C[C@@H](O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](Br)Cc3ccccc3)C[C@@H]21	1791053858	UWSTVIHTIHMTRD-XNJHUCFUSA-N	439.350	1.353	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(OC)cc3O)C[C@@H]21	1791253726	HKVBFBOUIXVJSZ-RPZXMPESSA-N	426.897	1.248	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CC=CCC1	1792880186	OZSGVQGXYWCUIB-HRHRNMPXSA-N	427.505	1.066	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(Cl)sc1Cl)C2)[C@H](O)CCl	1792980412	HTPNBTUQSYFEAQ-UJYYTQATSA-N	427.737	1.858	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc3c1NC(=O)C3=O)C2	1793449241	RIUIKERGBNJZCX-VZAMPYOESA-N	433.892	1.432	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccccc1-n1nccn1)C2	1793452286	WBZGCJZCSDHCMX-LORHWOILSA-N	431.924	1.878	50	20	IDGD	
CN(C)c1cncc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@](C)(Cl)CCl)C3)c1	1794297016	FCXAHNGVCKPBIP-MVWRLGRASA-N	429.348	1.587	50	20	IDGD	
Cc1ccc2cc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3cccc(B(O)O)c3)ccc2n1	1796191543	WJKCYMNLGRVVLG-KOUNCHBCSA-N	443.312	1.789	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnoc1COC	1796688700	WGWLCJJVHQPLOT-NDPMZMCLSA-N	430.299	1.198	50	20	IDGD	
CC(C)(C)OC(=O)N1CCOC[C@@H]1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](F)Cl	1796804593	MJAJVHBZRVMBIL-XLWJZTARSA-N	433.908	1.795	50	20	IDGD	
Cc1nc[nH]c1CSCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CO[Si](C)(C)C	1797956803	DNBMYPYWZIQZRK-CCWDJLKJSA-N	440.642	1.392	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1=CCCC1)C2	1798522577	AAUQCYNAJZBHLK-CWPLJXCYSA-N	443.456	1.834	50	20	IDGD	
CCOC(=O)c1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)C(Cl)Cl)C3)ccn1	1798688288	AMJSXWFSEKYKOD-DABQJJPHSA-N	430.288	1.265	50	20	IDGD	
Cc1c(Br)c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Cl)C3)nn1C	1798715265	VWHDIHRMWXVMPF-PKCZLINISA-N	437.697	1.229	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(=O)nc2sccn12)[C@H](F)Br	1799096385	URHJEVSGSGWEQQ-WJZNIJOASA-N	443.298	1.698	50	20	IDGD	
C[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Br)c1ccc(O)cc1	1799348216	DNMUBBNFRXRGRW-BCEUIYSSSA-N	429.286	1.776	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1Cc3ccccc3O1)C2)[C@H](F)Br	1799348818	BOGMTESWINDEAT-IPQWEPCOSA-N	427.270	1.270	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ncc(F)cc1F)C2	1800640068	JMEYSPQKYPBXSB-QPPBUOOMSA-N	432.265	1.737	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1(C)CCCCC1	1800930790	MVNAFUXXYHQUPR-BRTCSPBQSA-N	443.548	1.680	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc3ccccc13)C2	1801011122	DWFWOSTZEIXGKD-FEJSZKPUSA-N	438.528	1.416	50	20	IDGD	
COCCOCCOCCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](C)Br)C2	1802086997	VSUVFEYMIAIHDW-LVQVYYBASA-N	435.359	1.478	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1C[C@H]1c1ccccc1	1802208287	WJBAWADZAMPIQT-SQIBXOBRSA-N	433.512	1.741	50	20	IDGD	
O=C(CCBr)NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1	1806340977	SNQMGIBXKFKZSW-FZKQIMNGSA-N	449.305	1.992	50	20	IDGD	
Cc1cc(C(=O)NCC(=O)N2CC[C@H](CNC(=O)[C@H](F)Cl)[C@@H]2c2cccnc2)no1	1808313628	IZNMNRXMDPUFFC-COXVUDFISA-N	437.859	1.348	50	20	IDGD	
Cc1ccnc(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)c1	1808533361	NJAJJIXZDBWGJX-UGKGYDQZSA-N	444.300	1.098	50	20	IDGD	
Cc1occc1C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1	1810299508	RDTQOBWLBCFTLK-OXJNMPFZSA-N	448.483	1.615	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)c1ccnc2ncccc12	1812156688	MKSCYUGCKXZPQC-ZYSHUDEJSA-N	439.903	1.944	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2nc(C)c(C)[nH]c2=O)[C@H]1c1cccnc1	1813028296	NYDZHEIJWAMGCM-RYRKJORJSA-N	447.923	1.355	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2c3c(nn2C)CCC3)[C@H]1c1cccnc1	1813034790	XTQOKWWBENUJTP-IEZWGBDMSA-N	445.951	1.877	50	20	IDGD	
Cc1nc(C(=O)N2CC[C@@H](CNC(=O)C(Cl)Cl)[C@H]2c2cccnc2)c(=O)[nH]c1C	1813077824	OOSDEQVRVLHTIG-DZGCQCFKSA-N	438.315	1.905	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)C2CCC(O)CC2)[C@H]1c1cccnc1	1813196911	BKAAIJPPXKEIDI-REMCXBOUSA-N	445.564	1.012	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(F)c[nH]2)[nH]n1)c1cccc(B(O)O)c1	1817479406	MGLMROGMTYEYJF-KRWDZBQOSA-N	425.229	1.176	50	20	IDGD	
O=C(CCN1CCOC1=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCBr)CC2	1818691301	RHXQDSMXWMRWLO-JTQLQIEISA-N	445.339	1.682	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](O)c2ccccc2)[nH]n1	1822413045	NINUELZUUKUNET-UTKZUKDTSA-N	442.520	1.508	50	20	IDGD	
Cc1ccn(CC(=O)N[C@H]2CCc3nc(NC(=O)[C@@H](F)Br)sc3C2)n1	1823002967	VTYSALPUTREHBE-TVQRCGJNSA-N	430.303	1.951	50	20	IDGD	
O=C([C@H](O)CCl)N1CCCC[C@H]1C1CCN(C(=O)C(F)(F)C(F)(F)C(=O)O)CC1	1824178025	BWNHARUAWDTUER-NWDGAFQWSA-N	446.825	1.561	50	20	IDGD	
Cc1nccn1CC(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](F)Br)CC2	1824710160	VNEMFAZIEGLBTA-NOZJJQNGSA-N	430.303	1.951	50	20	IDGD	
CC(C)(CCl)C(=O)N[C@H]1CCc2nc(NC(=O)[C@H]3CCCS3(=O)=O)sc2C1	1824925503	JAZLODDWBPDTDF-GXFFZTMASA-N	433.983	1.897	50	20	IDGD	
N=C1NCCN1CC(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCBr)CC1	1826871763	LGURRTBEJGVLGQ-OAHLLOKOSA-N	428.375	1.231	50	20	IDGD	
Cc1nnsc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1	1827822199	YEBVUXUTOOSGRE-MRXNPFEDSA-N	436.582	1.453	50	20	IDGD	
C=C(C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1)C(F)(F)F	1831450873	HNYLBCBSTKRPIW-SFHVURJKSA-N	438.255	1.718	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCBr)C2)C1	1831644174	QGNRGTOFIKIFCN-CJNGLKHVSA-N	425.751	1.635	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4cccn4cn3)C2)C1	1831645576	CMJAJPZJLFFQEI-LAUBAEHRSA-N	434.924	1.812	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4ncccn4n3)C2)C1	1831651623	RZJXTJDGJCNUKQ-MGPUTAFESA-N	435.912	1.207	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)COc2ccc(O)nn2)CC1	1831834735	HFDREFVWGBOQEW-HOTGVXAUSA-N	440.928	1.435	50	20	IDGD	
CCc1ncsc1C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)CCl)CC2)CC1	1833313792	QZZLSTVDXKCPRG-MRXNPFEDSA-N	428.986	1.490	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccoc3C)CCO2)C1	1834143007	MFJPFEVXUOQZEB-CRAIPNDOSA-N	429.311	1.832	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3cn(C)cn3)CC2)CC1	1834288037	XZKRKBGAMWBABC-CYBMUJFWSA-N	426.359	1.389	50	20	IDGD	
Cc1ccccc1NCC(=O)NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1834773703	MCECAKKLDSCYQN-FQEVSTJZSA-N	436.984	1.578	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)c3ccnc(Cl)c3)C2)C1	1834819161	IJOQGAAIRCAJFH-KRWDZBQOSA-N	446.729	1.590	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@H]1C(=O)N1CCC(N2CCC(NC(=O)[C@H](F)Cl)CC2)CC1	1835083928	ZUTGQDLZADUQBR-KURKYZTESA-N	443.947	1.848	50	20	IDGD	
CC(C)CNC(=O)C(=O)NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1	1835126997	IDWHTLFMWMHEIR-UHFFFAOYSA-N	445.402	1.115	50	20	IDGD	
CCc1cc(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)cc(C)n1	1835238058	AEHCOHDIGHNLQR-FQEVSTJZSA-N	436.984	1.737	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)C3CCC(O)CC3)CC2)CC1)[C@@H](F)Br	1836414285	BYXOMGHBHNMRBJ-QWFMPGPPSA-N	448.377	1.800	50	20	IDGD	
COc1cc(C(=O)N2CCC(OC3CCN(C(=O)C(Cl)Cl)CC3)CC2)n(C)n1	1837278311	RFJNXTDDDPXWLK-UHFFFAOYSA-N	433.336	1.845	50	20	IDGD	
Cc1ccc(CC(=O)N2CCOC[C@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)cc1	1837712522	XCOBSDYQGJJRPB-JOCHJYFZSA-N	434.609	1.845	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)[C@@H]3[C@H]4COC[C@H]43)CC2)CC1	1838773422	FXRLQHONPLCBRF-VZEFYGNVSA-N	429.355	1.661	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)Cc3cc(C)on3)CC2)CC1	1838787561	YRFIELYPUWXOPD-SFHVURJKSA-N	427.929	1.778	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccncc3)CCO2)C1	1839057475	FDXUCAADJCPWQH-KXBFYZLASA-N	440.338	1.112	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3cccnc3OC)C2)C1	1839142684	VWUPSZLSMKJZOM-UTKZUKDTSA-N	439.940	1.497	50	20	IDGD	
O=C(CCc1ccsc1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839199745	STONRKDUUDICFJ-NVXWUHKLSA-N	449.342	1.828	50	20	IDGD	
C[C@H](C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H](F)Br)CCO2)C1)c1ccccc1	1839203670	RMPBJUNCWSBRRO-ZSZQSSIHSA-N	443.313	1.937	50	20	IDGD	
Cc1cc(C#N)cc(C(=O)N2CCO[C@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)c1	1839452510	FSQONPMQYBXYOE-QFIPXVFZSA-N	445.592	1.788	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)C(C)=O)C2)C1	1839961655	DUJSBYWSBINXPY-KBXCAEBGSA-N	433.343	1.232	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)[C@H](C)CC)C2)C1	1839962549	JXRPWEOJPXINBE-BASYENTBSA-N	435.359	1.023	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccnc(C)n3)C2)C1	1839964013	CORLMJUJDLIHJJ-KBXCAEBGSA-N	441.326	1.029	50	20	IDGD	
Cc1cncc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)c1	1840031547	UARVJTCGVLLYEY-KSSFIOAISA-N	426.311	1.243	50	20	IDGD	
Cc1cccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)c1	1840034130	AXXCPBACWHYEOC-KXBFYZLASA-N	425.323	1.848	50	20	IDGD	
O=C(c1cc(F)cc(F)c1F)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840190868	QVKQLEAIASFSGF-QGZVFWFLSA-N	441.233	1.978	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCCC12CN(C(=O)Cc1cc[nH]n1)C2	1841925252	CRCKSTBNOUZBCN-AWEZNQCLSA-N	425.917	1.288	50	20	IDGD	
Cc1nc2cc(C(=O)N3CC4(CCCN4C(=O)c4cccc(B(O)O)c4)C3)ccc2s1	1843014088	WEESGFQTXOIRBK-UHFFFAOYSA-N	435.314	1.415	50	20	IDGD	
CCc1c(Br)c(C(=O)N2CCCC23CN(C(=O)[C@H](O)CCl)C3)nn1C	1843143276	XWDRVAZMKHNETA-LLVKDONJSA-N	433.734	1.162	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)C(=O)c1ccc(Cl)cc1)C2	1844263294	NYFCYNPMSHDXTF-UHFFFAOYSA-N	441.875	1.038	50	20	IDGD	
C[C@H](NC(=O)c1ccccn1)C(=O)N1CC2(CCCN2C(=O)[C@@](C)(Cl)CCl)C1	1845172634	VWFOCCJIXZIZTG-UGSOOPFHSA-N	427.332	1.640	50	20	IDGD	
C[C@@H](CC(=O)N1CCCC12CN(C(=O)c1cnccc1C(=O)NN)C2)Oc1ccccc1	1845878825	UXGAITZPDSITBV-INIZCTEOSA-N	437.500	1.360	50	20	IDGD	
COc1ccc([N+](=O)[O-])c(C(=O)N2CC3(CCCN3C(=O)[C@H](C)Br)C2)n1	1846176963	PQJQFHSGXIAAAD-JTQLQIEISA-N	427.255	1.599	50	20	IDGD	
CC(=O)C(C)(C)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1847718042	KKBWKDKQSOPJOW-KKUMJFAQSA-N	429.945	1.936	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)OCc2cc(=O)n(C)c(=O)n2C)c(C)n1C[C@H]1CCCO1	10874555	QIRGRHULQKBVHR-KFVRLDSISA-N	426.473	1.332	50	20	IDGD	
COc1ccc(C(=O)NCC(=O)NNC(=S)NCCc2cccs2)cc1[N+](=O)[O-]	21125064	WIUVXIIIAKIIGS-UHFFFAOYSA-N	437.503	1.133	50	20	IDGD	
C=CCNS(=O)(=O)c1cccc(C(=O)NNC(=O)Cc2nc3ccccc3n2C)c1	26538979	ZKUMYMBGIMWMIG-UHFFFAOYSA-N	427.486	1.041	50	20	IDGD	
Cc1ccc(S(=O)(=O)NC2CC2)cc1C(=O)NNC(=O)c1c(C)nc2ccccn12	28643120	IDIVPCQYELZYLJ-UHFFFAOYSA-N	427.486	1.467	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)NCc1ccc(NC(=O)c2ccncc2)cc1	725872435	WKOBUHXKNZVDJF-UHFFFAOYSA-N	436.428	1.187	50	20	IDGD	
COCCCNC(=S)N(C)NC(=O)CCNC(=O)NC12CC3CC(CC(C3)C1)C2	726075271	BXFMCEWUGUVTOA-UHFFFAOYSA-N	425.599	1.519	50	20	IDGD	
C[C@]1(c2ccc(CNC(=O)NNC(=O)Cc3ccc4ccccc4c3)cc2)NC(=O)NC1=O	726281787	DCQSYZGVJVRJLJ-XMMPIXPASA-N	445.479	1.968	50	20	IDGD	
CN(CCCNC(=S)NNC(=O)Cc1csc(N2CCOCC2)n1)c1ccccc1	726436734	IFKMZKGDWIXCQF-UHFFFAOYSA-N	448.618	1.544	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@@H](c2ccccc2)N2CCN(C)CC2)cc(OC)c1OC	727753172	UEKYAECSLHVOGT-HXUWFJFHSA-N	442.516	1.462	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)NCCC(=O)NNC(=O)CCCc2ccccc2)cc1	727861142	WZMBLQXIDNBZRD-UHFFFAOYSA-N	431.514	1.728	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)c1ccccc1)C(=O)NNc1nc(-c2cccnc2)no1	728079032	HNRIMTHCIWYTNJ-OAHLLOKOSA-N	448.530	1.675	50	20	IDGD	
N#Cc1ccc(N2CCC[C@@H]2C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1	728159979	CTRUHUYCZNEEBJ-HSZRJFAPSA-N	446.555	1.887	50	20	IDGD	
COc1cc(OC)cc(C(=O)N2CCN(C(=O)NNC(=O)c3cccc(C#N)c3)CC2)c1	728953900	YZUZKBPQGMEBSG-UHFFFAOYSA-N	437.456	1.388	50	20	IDGD	
COc1ccccc1OCCCNC(=O)NNc1ccc(S(=O)(=O)NC(C)C)cn1	729613990	AYOYRISYPYQDOW-UHFFFAOYSA-N	437.522	1.872	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)[C@@H]2CCCN(S(=O)(=O)Cc3ccccc3)C2)cc1	730585717	LCWWMFQRCKGKKO-LJQANCHMSA-N	444.557	1.796	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)[C@@H]2CCN(c3ccc4c(c3)OCCO4)C2=O)cc1	730585845	QKASFXRMHMZLRW-KRWDZBQOSA-N	440.456	1.079	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)NCc2cccc(CN3CCC[C@H](C(N)=O)C3)c2)c1	731042895	AQEZMDCHSGVNQV-FQEVSTJZSA-N	434.500	1.400	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCCCN2C[C@H](C)O[C@H](C)C2)cc1Br	732237352	BVIQGNDTRNHPEZ-BETUJISGSA-N	443.342	1.901	50	20	IDGD	
C[C@]1(c2ccccc2)NC(=O)N(CC(=O)NNC(=O)NCc2ccc(Cl)cc2)C1=O	733004476	JXISKUYOPBBLMS-HXUWFJFHSA-N	429.864	1.638	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)NNC(=O)[C@H]1CC(=O)N(c2ccc3c(c2)OCCO3)C1	733004687	PXVSOYUILHRHAW-AWEZNQCLSA-N	444.875	1.995	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)NCc1ccccc1S(=O)(=O)N(C)CCO)c1ccccc1	733041644	ZSFUUEUJCRFNKY-GOSISDBHSA-N	448.545	1.324	50	20	IDGD	
O=C(NNC(=O)[C@@H](Cc1cccnc1)NC(=O)c1ccccc1)c1cccc([N+](=O)[O-])c1	733252208	HTQUIWSPSAIVCH-LJQANCHMSA-N	433.424	1.792	50	20	IDGD	
Cn1nc(C(=O)NN=Cc2ccccc2OCC(=O)NCC2CC2)c2ccccc2c1=O	734746971	NFASFXUXCDOGMS-UHFFFAOYSA-N	433.468	1.602	50	20	IDGD	
O=C(NCCNS(=O)(=O)c1ccccc1[N+](=O)[O-])NNc1ccc(OC(F)F)cc1	735188589	HTDNLYVKOBXURU-UHFFFAOYSA-N	445.404	1.801	50	20	IDGD	
COCCNS(=O)(=O)c1cccc(CNC(=O)/C(C#N)=C/c2cc(C#N)n(C)c2C)c1	735478574	PPDCZYKPHZIENX-VCHYOVAHSA-N	441.513	1.353	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(\C#N)C(=O)N2CCC[C@H](CNS(N)(=O)=O)C2)c1C	739696505	IVYDUHRSUCTTJD-BKXMXULZSA-N	437.566	1.251	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1ccnc(N2CCCCC2)n1	740321132	YKQFMQWSBXUQRQ-UHFFFAOYSA-N	447.879	1.747	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)COc1ccccc1O)[C@@H]1CN(Cc2ccccc2)CCO1	741276617	AFRVJVGASHNUCK-JXFKEZNVSA-N	428.489	1.391	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2c(C)nc3ccccn23)cc(NS(C)(=O)=O)c1OC	742490000	WFWQJXPBESEREM-UHFFFAOYSA-N	447.473	1.106	50	20	IDGD	
N=C1NC(=O)[C@H](CC(=O)NNC(=O)[C@H]2Cc3ccccc3CN2Cc2ccccc2)S1	742600148	SSPZRFKPKSLWDO-MSOLQXFVSA-N	437.525	1.317	50	20	IDGD	
CCCCc1ccc(NC(=S)NNC(=O)CN2C(=O)[C@H]3[C@H]4CC[C@@H](O4)[C@@H]3C2=O)cc1	743821310	LWRNHHNWSAPAEM-LMSBXDPUSA-N	430.530	1.509	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)c2cccc(I)c2)c1	744476670	SPYSDUPMXNBTOC-UHFFFAOYSA-N	449.204	1.781	50	20	IDGD	
CCN(CC)C(=O)N1CCC(C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)CC1	744751437	URBCCXHMJKPDNF-UHFFFAOYSA-N	429.477	1.036	50	20	IDGD	
CCN1CCN(C[C@H](C)CNC(=O)NNC(=O)c2cc(F)ccc2Br)CC1	745863458	VBAYHAUNHWVPNZ-CYBMUJFWSA-N	444.349	1.806	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)N[C@@H]2CC(=O)N([C@H]3C[C@@H]3c3ccccc3)C2)cc1C	745915231	XTBHTEQHVAEXGS-AQNXPRMDSA-N	449.511	1.729	50	20	IDGD	
Cc1ccc(C)n1-c1ccc(C(=O)NNC(=O)N[C@H]2C[C@@H](C)N(c3cnn(C)c3)C2=O)cc1	745916722	FUVZWWHOEJNYFA-UZLBHIALSA-N	449.515	1.966	50	20	IDGD	
O=C(COC(=O)Cn1nc(-c2ccccc2)oc1=O)NNC(=O)c1cccc(Cl)c1	746189145	ZSPVROKPUOFTSH-UHFFFAOYSA-N	430.804	1.161	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2cc(F)ccc2Br)nc2nc(O)nc(O)c12	746215489	IOQYOUDDLSNWHI-UHFFFAOYSA-N	436.197	1.721	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)[C@@H]1CCCN(c2ncnc3sccc23)C1	746556377	UXBIXNYNGZUXPA-CQSZACIVSA-N	435.513	1.946	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)OCC(=O)N2CCC2)cc1	746934596	IDSFCNBOGIEBNA-WJDWOHSUSA-N	437.456	1.117	50	20	IDGD	
Cc1c(Cl)cc(C(=O)O)cc1S(=O)(=O)NNC(=O)CNC(=O)c1cccs1	747610323	AJYQIAKQBKKPHO-UHFFFAOYSA-N	431.879	1.148	50	20	IDGD	
Cc1ccc(CNC(=O)C2CCN(CC(=O)NNC(=O)Cc3nc(C)cs3)CC2)cc1	747845784	IIFNYSQMOPTDPI-UHFFFAOYSA-N	443.573	1.478	50	20	IDGD	
Cn1ccnc(NNC(=O)C2CCN(S(=O)(=O)c3ccc4c(c3)CCCC4)CC2)c1=O	747937538	HWLPHKFTWLNEJO-UHFFFAOYSA-N	445.545	1.203	50	20	IDGD	
O=C(NN=Cc1ccccc1OCc1cn2ccccc2n1)N[C@H]1CCS(=O)(=O)C1	748586207	ROISDCZDGZICED-INIZCTEOSA-N	427.486	1.734	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NCC(=O)N1CCN(c2ccccc2)CC1	749219524	BFYOBIRVAQUVQK-INIZCTEOSA-N	443.479	1.272	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H]2CCC[C@H](N(C)C)C2)c1	749589843	JGYOTPCNNHPDQA-IRXDYDNUSA-N	439.582	1.534	50	20	IDGD	
Cc1ccccc1C(=O)NNS(=O)(=O)c1ccc(NS(=O)(=O)C(C)C)c(F)c1	749755322	KWJPEPIVHOALFM-UHFFFAOYSA-N	429.495	1.908	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)N[C@@H]1CCN(c2cccc(Cl)c2)C1=O	750267001	KJLTYWZZAMMSQW-MRXNPFEDSA-N	440.851	1.065	50	20	IDGD	
CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)OCC(=O)NNC(=O)c1ccccc1	750411197	UXJUIWAVRLIUIY-IBGZPJMESA-N	440.431	1.359	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2cccc(F)c2I)C[C@H](C)O1	750530816	WGZBQIOLAGCAOP-QWRGUYRKSA-N	449.264	1.691	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(OC)cc2)c1	750871018	DKXQZQMVEZPPBX-UHFFFAOYSA-N	448.501	1.125	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)[C@H]1CC(=O)N(CCOc2ccccc2Cl)C1	751988730	SRFLJXSLEFWVKR-KRWDZBQOSA-N	445.903	1.932	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)NC[C@H]2CCCN2S(C)(=O)=O)c(C)n1C[C@@H]1CCCO1	753144548	RTHZQRCABHCJAA-INQFTJRBSA-N	434.562	1.731	50	20	IDGD	
Cc1cccc(NS(=O)(=O)c2cc(C(=O)NNC(=O)Cc3cc[nH]n3)ccc2C)c1	755288751	LECPSOVTJRDNKU-UHFFFAOYSA-N	427.486	1.831	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)Nc2ccc(S(=O)(=O)N(C)OC)cc2)c1	755535413	NYBFIMOTXKWBNG-UHFFFAOYSA-N	438.462	1.352	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)Nc1ccc(NC(=O)CN2CCOCC2)cc1	755598065	DNAICUWXRCOAMY-UHFFFAOYSA-N	429.452	1.492	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)Nc2ccccc2C(=O)N2CCN(C)CC2)cc1	755623888	SLMHKDZMFPZIEK-UHFFFAOYSA-N	441.488	1.315	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)Nc1ccccc1C(=O)N1CCOCC1	755624266	RGOZVGJJJQUXKT-UHFFFAOYSA-N	442.472	1.789	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)Nc2ccc(S(=O)(=O)N(C)C3CC3)cc2)c1O	756405140	XLPAGCIDGRSXMS-UHFFFAOYSA-N	434.474	1.650	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(NC(=O)NNC(=O)Cc2c[nH]c3ccccc23)cc1	756784981	RJBGHHNFYRHMPQ-UHFFFAOYSA-N	445.501	1.488	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)CN2C(=O)N[C@]3(C[C@@H](C)C[C@@H](C)C3)C2=O)cc1C	756866106	WSZGRXFLEHAORR-HSAQVAQVSA-N	430.505	1.576	50	20	IDGD	
O=C(Oc1ccc([N+](=O)[O-])c2ccccc12)C1=NN([C@H]2CCS(=O)(=O)C2)C(=O)CC1	757421061	BHYVTGWINNQKLM-LBPRGKRZSA-N	431.426	1.819	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)Nc2ccc(C(=O)N3CCOCC3)cc2C)cc1	757830933	MOPXKFSYLNCARR-UHFFFAOYSA-N	442.472	1.708	50	20	IDGD	
CS(=O)(=O)N1CCc2c(NC(=O)NNC(=O)CSc3ccccc3O)cccc21	758301738	WQKIPKURQMWBNX-UHFFFAOYSA-N	436.515	1.659	50	20	IDGD	
O=C(NC[C@H](c1ccc(Cl)cc1)N1CCOCC1)NNC(=O)C(=O)Nc1ccccn1	758723026	CRDFOVWIPKAXCL-MRXNPFEDSA-N	446.895	1.077	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCCC(=O)NNc1nc(-c2cccnc2)no1	760877359	KJOWFXLYONXYSC-CQSZACIVSA-N	445.480	1.481	50	20	IDGD	
CC(=O)Nc1cc(C(=O)NNC(=O)CCN2C[C@@H](C)O[C@H](C)C2)cc(C(F)(F)F)c1	760988560	RQOJEYNJHGIZMO-VXGBXAGGSA-N	430.427	1.924	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)CN1C(=O)NC2(C[C@@H](C)C[C@H](C)C2)C1=O	761626290	VKJJCAGWVGFYQE-KBPBESRZSA-N	448.545	1.681	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCCCN(C)C)cc1C(=O)NNc1ccccc1[N+](=O)[O-]	761786041	MGERYYMEPQURHW-UHFFFAOYSA-N	435.506	1.890	50	20	IDGD	
O=C(NNC(=O)[C@H]1CN2CCCN1CC2)c1cn(-c2ccccc2)nc1-c1ccccc1	763263374	AFZDCPDZVKQBQN-OAQYLSRUSA-N	430.512	1.690	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccccc1C(=O)N1CCCC1	763441752	JEGZQKNDYRNIHK-UHFFFAOYSA-N	425.401	1.231	50	20	IDGD	
CCC(C)(C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1	763465669	BWNKOAKSXHLYKB-UHFFFAOYSA-N	441.444	1.913	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1cccc(Cl)c1N1CCOCC1	763468660	PWEDTXSKFLZBHH-UHFFFAOYSA-N	447.835	1.485	50	20	IDGD	
CCNC(=O)c1ccc(C)c(NC(=O)C(=O)NNC(=O)c2ccc(OC)c(OC)c2)c1	763543831	RHLYQKXTCSFSLW-UHFFFAOYSA-N	428.445	1.162	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)C2CC2)c(C(=O)N2[C@@H](C)CCC[C@@H]2C)cc1OC	763558375	NVJNKHZBFJGJAK-STQMWFEESA-N	446.504	1.603	50	20	IDGD	
CCOC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)COc2cccc(C)c2)cc1C#N	763624656	YNMJEYZVBUVEDR-UHFFFAOYSA-N	439.428	1.600	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(CC(F)(F)F)cc2)cc1	763659397	NMIZQGGDNPAFQF-UHFFFAOYSA-N	425.363	1.965	50	20	IDGD	
Cc1nnc(-c2cccc(NC(=O)C(=O)NNC(=O)COc3ccc(Cl)cc3)c2)o1	763685549	CRCICVHXNPFGME-UHFFFAOYSA-N	429.820	1.863	50	20	IDGD	
O=C(NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)C(=O)Nc1ccc(F)cc1	763797091	OPVHOGLYPLALTM-UHFFFAOYSA-N	434.449	1.010	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)C(=O)Nc1cccc(-n2ccnn2)c1	763854787	TZYQAASDTRMSOK-HNNXBMFYSA-N	444.451	1.974	50	20	IDGD	
CCc1nnc(-c2cccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc3ccc(F)cc3)c2)o1	763872057	JOKAORMFKXAXNL-LBPRGKRZSA-N	441.419	1.992	50	20	IDGD	
O=C(Cc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1cccc(CN2CCCC2=O)c1	763936668	OEVISTLJGHHRCZ-UHFFFAOYSA-N	428.876	1.791	50	20	IDGD	
CN(C)Cc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(Br)s2)c1	763942165	WKXFWPIEWGXCCY-UHFFFAOYSA-N	425.308	1.972	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc(C(=O)N2C[C@H](C)O[C@H](C)C2)cc1	763955962	IROMEYZHUDNNBD-IYBDPMFKSA-N	438.484	1.644	50	20	IDGD	
CCOc1cc(C(=O)N(C)C)ccc1NC(=O)C(=O)NNC(=O)c1cc(Cl)ccc1O	763978498	KAKAWIMUKAWECW-UHFFFAOYSA-N	448.863	1.546	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)Nc1ccc(OCC2CC2)cc1	764004659	KXLJECRDDUYNTP-UHFFFAOYSA-N	435.278	1.976	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2cccc(OC3CCCC3)c2)c1	764076654	DNMWPQYHTVHLMP-UHFFFAOYSA-N	445.497	1.811	50	20	IDGD	
CC[C@H](C)C(=O)NNC(=O)C(=O)Nc1cc(Br)cnc1OCC(F)(F)F	764081960	LJAHIPXYTGLKPR-ZETCQYMHSA-N	441.204	1.917	50	20	IDGD	
O=C(CC1CC1)NNC(=O)C(=O)Nc1ccc(CN2CCN(c3ccccn3)CC2)cc1	764142128	LOXWZEDFXDBXPC-UHFFFAOYSA-N	436.516	1.290	50	20	IDGD	
COC(=O)c1cc(Br)ccc1NC(=O)C(=O)NNC(=O)CCc1ccco1	764176451	BROILMQFKTZIDF-UHFFFAOYSA-N	438.234	1.547	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccnc(OCC(F)(F)C(F)F)c2)cc1	764176876	IDUXPRVFVMLVBL-UHFFFAOYSA-N	439.325	1.632	50	20	IDGD	
C[C@@H]1CN(Cc2ccccc2NC(=O)C(=O)NNC(=O)Cc2cccnc2)C[C@@H](C)O1	764267791	KDZBSRZFURQZQS-HZPDHXFCSA-N	425.489	1.019	50	20	IDGD	
CC(C)(C)n1nccc1NC(=O)C(=O)NNC(=O)c1cc(F)ccc1Br	764270751	SSRJVZRKKOPTLD-UHFFFAOYSA-N	426.246	1.939	50	20	IDGD	
NS(=O)(=O)c1ccc(CCC(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)cc1	764329240	GJOPQUQRQUZGNR-UHFFFAOYSA-N	438.456	1.580	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)C(=O)Nc1ccccc1C(=O)N1CCCCC1	764363912	WISXCQWWLSVRGH-UHFFFAOYSA-N	438.484	1.615	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1ccn(-c2cccc(C(F)(F)F)c2)n1	764400500	QAOLOXRXMOCNNE-NSHDSACASA-N	443.382	1.029	50	20	IDGD	
C[C@H](Cn1ncc2ccccc2c1=O)NC(=O)NNC(=O)c1cc([N+](=O)[O-])ccc1O	764466596	HYJODMCLTHUJLT-LLVKDONJSA-N	426.389	1.043	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)Nc3ccccc3F)CC2)cc1	765313927	WTYYIXJKXOVFGL-UHFFFAOYSA-N	449.508	1.293	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2ccc(=O)n(-c3ccccc3F)n2)c2ccccc2c1=O	765527652	DLYYRQKJHMSDAN-UHFFFAOYSA-N	448.414	1.176	50	20	IDGD	
C[C@@H](CCc1cccc(F)c1)C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765739345	URFRILRHJQHMGG-SFHVURJKSA-N	440.519	2.000	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)cc1	766258874	NZPSPMWJIYNVAO-CQSZACIVSA-N	442.428	1.968	50	20	IDGD	
CC(C)c1cc(C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)nn1C	766660606	OUAHYQLSBZFDQH-UHFFFAOYSA-N	432.956	1.776	50	20	IDGD	
Cn1ncc([N+](=O)[O-])c1C(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	766756586	NNNSIEPDMXXMJG-UHFFFAOYSA-N	447.411	1.161	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(F)cc2C(=O)N(C)C)cc1C	768229275	AQJBUEMXQXLOFM-UHFFFAOYSA-N	430.436	1.309	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNS(=O)(=O)c2ccc(C(=O)O)c(F)c2)cc1	768496078	JXJLQDJIDZIVSH-LLVKDONJSA-N	426.422	1.700	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)NC[C@@H]3CCN(CC(F)(F)F)C3)nc21	770344060	GRQYCYQQURPWRJ-JTQLQIEISA-N	430.435	1.797	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)c2ccc3nc(C(F)(F)F)cn3c2)c1	770430748	LAVCLJRNUBXPLB-UHFFFAOYSA-N	431.330	1.843	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)C3CCN(C(=O)N4CCCC4)CC3)nc21	770964848	FMLPTOHIZLTWCC-UHFFFAOYSA-N	430.513	1.658	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)c3ccc(I)c(F)c3)nc21	770985067	XFJNMGJVTXGWDW-UHFFFAOYSA-N	428.165	1.570	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)CN1C(=O)N[C@@](C)(c2ccccc2OC)C1=O)c1ccccc1	771265681	FVRFSEXABFBEIC-MWTRTKDXSA-N	438.484	1.803	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)N[C@@H]1CC(=O)N(c2c(F)cccc2F)C1	771434160	LTIQPIYQZKGQNN-SNVBAGLBSA-N	442.382	1.363	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)N[C@@H]2CC(=O)N(c3c(F)cccc3F)C2)cc1	771436926	WFSKNHNTBQWNOB-GFCCVEGCSA-N	434.399	1.488	50	20	IDGD	
COc1ccccc1[C@]1(C)NC(=O)N(CC(=O)NNC(=O)CNc2ccc(C)cc2)C1=O	771539025	CDZAMGQQZJZXJF-QFIPXVFZSA-N	439.472	1.030	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)[C@H](O)Cc2ccccc2Cl)c2ccccc2c1=O	771882230	NYNYQGJAPWPSPE-QGZVFWFLSA-N	428.876	1.995	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1c(Cl)ccc(S(=O)(=O)NC)c1Cl	772181582	NITQNTNJKGUCAF-ZETCQYMHSA-N	426.278	1.004	50	20	IDGD	
O=C(NNc1c(F)cccc1F)C(=O)N1C[C@H](C(=O)N2CCOCC2)Oc2ccccc21	773714818	ZECMFTIHEHZPOP-QGZVFWFLSA-N	446.410	1.061	50	20	IDGD	
CS(=O)(=O)CCCCCNC(=O)NNC(=O)COc1ccc(Br)cc1	773718718	RSMRTIMSXPNAJQ-UHFFFAOYSA-N	436.328	1.373	50	20	IDGD	
CCC(CC)n1nc(C)cc1C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	775780937	UNCPXHAQXRYCHN-UHFFFAOYSA-N	440.548	1.772	50	20	IDGD	
CN(NC(=O)c1cc(OCC(F)F)ccn1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776204749	FPTCZBPYDHLPRJ-UHFFFAOYSA-N	443.451	1.975	50	20	IDGD	
CN(NC(=O)c1ccnc(N2CCCCC2)n1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776211836	HREOMVAXTSILBP-UHFFFAOYSA-N	447.540	1.716	50	20	IDGD	
O=C(NNC(=O)[C@]1(F)CCN(C(=O)OCc2ccccc2)C1)[C@@H]1COc2ccccc2O1	776739511	SEJZKZRCNPNFCJ-AVRDEDQJSA-N	443.431	1.725	50	20	IDGD	
O=C(NNc1ccccc1[N+](=O)[O-])C(=O)Nc1ccc(C(=O)N2CCOCC2)c(F)c1	778724298	QHFQLCYWQYVCQS-UHFFFAOYSA-N	431.380	1.288	50	20	IDGD	
O=C(NNc1ccnc(F)c1)c1cccc(NS(=O)(=O)c2ccc3nnn(O)c3c2)c1	781436101	LQDFGSMHVYTSPD-UHFFFAOYSA-N	443.420	1.760	50	20	IDGD	
COc1cc(Br)ccc1CCC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	782553965	XTNYJWGOVWBDCH-UHFFFAOYSA-N	445.277	1.827	50	20	IDGD	
Cc1cc(Br)c(F)cc1NC(=O)C(=O)NNC(=O)Cc1cn2ccccc2n1	785060733	KPANPDZGPTTZDD-UHFFFAOYSA-N	448.252	1.873	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2ccc3oc(=O)n(CCN(C)C)c3c2)cc1Cl	785116409	KAOSNVHYQNWPIQ-UHFFFAOYSA-N	447.879	1.900	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1cccc(-n2ccnc2)c1	785330465	HXSPKQOBFBAVPP-UHFFFAOYSA-N	429.458	1.366	50	20	IDGD	
COC(=O)c1cc(NC(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)cn1C	785861463	YYEHYFKMDWWGQL-UHFFFAOYSA-N	438.485	1.453	50	20	IDGD	
N#C/C(=C/C1CC1)C(=O)OCC(=O)N1CCN(S(=O)(=O)c2ccc(Cl)cc2)CC1	786679740	PYJAOOOERKLUSD-PTNGSMBKSA-N	437.905	1.576	50	20	IDGD	
COCCOc1ccc(F)cc1S(=O)(=O)NNC(=O)c1nnc(-c2ccccc2)o1	786720091	USQSXWYZRIHPTC-UHFFFAOYSA-N	436.421	1.524	50	20	IDGD	
Cc1cccc(CNC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c1Br	786839095	UMRDVWCEQACVPG-UHFFFAOYSA-N	430.266	1.877	50	20	IDGD	
O=C(COC(=O)c1cccc(Br)c1)NNC(=O)[C@H]1COc2ccccc2O1	788598855	ONBLNTWULNOYLM-OAHLLOKOSA-N	435.230	1.593	50	20	IDGD	
CCC(=NNC(=O)Cn1c(=O)c2c(ncn2CC)n(Cc2ccccc2)c1=O)c1cn[nH]c1	788977714	LRDYWHDYFOJIEW-UHFFFAOYSA-N	448.487	1.082	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(C)s2)C1	790063635	PNENMZTVIKCBRC-CQSZACIVSA-N	447.579	1.394	50	20	IDGD	
C[C@@]1(C2CC2)NC(=O)N(c2ccc(CNC(=O)NNC(=O)c3cccc(C#N)c3)cc2)C1=O	790709823	RWNMVOXFNAWBKR-QHCPKHFHSA-N	446.467	1.927	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)c2c[nH]c3ncc(Br)cc23)c2ccccc2c1=O	792015480	ARNIBLMQRIMSJL-UHFFFAOYSA-N	441.245	1.647	50	20	IDGD	
O=C(CCSCc1ccccc1)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	792237052	HAJYYGWKFOYDSM-UHFFFAOYSA-N	440.569	1.915	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(CCC(=O)NNC(=O)CSc2ccccc2O)CC1	792285850	IFAWFRJYFMHKTA-UHFFFAOYSA-N	438.550	1.575	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2cc(OC)cc(-n3cccn3)c2)cc1	792355110	PPSXODRKKWSPTD-UHFFFAOYSA-N	437.456	1.608	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)nc1Br	793035238	MROQNEIZUHIEJA-UHFFFAOYSA-N	445.277	1.368	50	20	IDGD	
CC(=NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1)c1ccccc1-n1ccnn1	794920832	UZMVULDSBOQKOX-UHFFFAOYSA-N	431.500	1.566	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)CN1CCN([C@H]2CCN(Cc3ccccc3)C2)CC1	796383695	LXJWQYZOUVXLJE-DEOSSOPVSA-N	449.599	1.577	50	20	IDGD	
Cc1nsc(NC2CC2)c1C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	796645411	QUWOPUPKFLBSOY-CQSZACIVSA-N	432.458	1.170	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)Nc2cccc(NC(=O)NCC(N)=O)c2)c1C	798060106	YINJBOMBGANQBF-LICLKQGHSA-N	438.488	1.904	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)CCC(=O)N2CCN(c3ccccn3)CC2)c2ccccc2n1	799006349	AGUHOTGZYZDXBA-UHFFFAOYSA-N	446.511	1.828	50	20	IDGD	
Cc1ccc(C(=O)NNS(=O)(=O)c2cc(Br)cc(C(N)=O)c2)c(O)c1	799522441	LYKDOZRQZWGPHX-UHFFFAOYSA-N	428.264	1.185	50	20	IDGD	
CC(C)(C)OC(=O)N1CCCC(=NNC(=O)CSc2nnc(O)nc2O)CCC1	800810547	UBIIYEPCYVEKDD-UHFFFAOYSA-N	426.499	1.658	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(C)cc2)ccc1OCC(=O)OC	801110408	ZJFQMTCQTZPUFO-UHFFFAOYSA-N	429.429	1.345	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)c1ccc(F)c(S(=O)(=O)N(C)C)c1	801195841	FUWHGKDMJNOSNT-UHFFFAOYSA-N	445.494	1.245	50	20	IDGD	
Cc1cccc(-n2cc(O)c(C(=O)OCC(=O)NNC(=O)c3cccc(C#N)c3)n2)c1C	801419174	YWUVPZFQVDFDFC-UHFFFAOYSA-N	433.424	1.684	50	20	IDGD	
O=C(Cn1[nH]cc2c(=O)ncnc1-2)NNC(=O)Nc1ccc(Br)cc1Cl	802041930	IZOAIYGGDLUOPD-UHFFFAOYSA-N	440.645	1.340	50	20	IDGD	
COCCn1nc(C(=O)NNC(=O)Nc2ccc(Br)cc2Cl)ccc1=O	802043157	RNBHBGIYJMAOFW-UHFFFAOYSA-N	444.673	1.772	50	20	IDGD	
Cc1nc(C(F)(F)F)ccc1NC(=O)C(=O)NNC(=O)c1cnn(-c2ccccc2)c1	802567850	ZFDQWRKQCOGATQ-UHFFFAOYSA-N	432.362	1.994	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)c(C)c1OC	804163064	AHNXXPDONZQJBK-UHFFFAOYSA-N	427.866	1.388	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(F)c(C(C)=O)c2)cc1	806975079	MYHZXQUDTBUERF-CYBMUJFWSA-N	429.404	1.784	50	20	IDGD	
CNC(=O)c1cccc(NC(=O)C(=O)NNc2ccc(Cl)nc2)c1Br	807014264	TUQXGICBBVKKLV-UHFFFAOYSA-N	426.658	1.939	50	20	IDGD	
N#Cc1cc(NC(=O)C(=O)NNc2ccc(-n3ccnc3)nn2)ccc1OC(F)(F)F	807428939	LJNDSDWNJWUCKN-UHFFFAOYSA-N	432.322	1.514	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)NNC(=O)C(=O)Nc2ccccn2)CC12CCC2	813797995	YGLLQOOASRPAQE-CQSZACIVSA-N	446.508	1.673	50	20	IDGD	
CN(C)c1cc(Br)cc(C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c1	814405214	ALKNYUNWBJCOTD-UHFFFAOYSA-N	440.319	1.993	50	20	IDGD	
Cn1nc(Br)cc1C(=O)NNC(=O)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	816509898	GEFIUFSAGKLWSC-SNVBAGLBSA-N	430.303	1.591	50	20	IDGD	
O=C(NNc1nc[nH]n1)[C@H]1CCCN(S(=O)(=O)c2ccc(Br)s2)C1	816634040	WTBAUXSRUAZOSA-QMMMGPOBSA-N	435.329	1.173	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)c1cnc2c(c1)c(O)nc(=O)n2C1CC1	879609792	IAOXIRZTAFXRED-JTQLQIEISA-N	427.392	1.200	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)Nc2cccc(S(=O)(=O)N3CCOCC3)c2)cc(C#N)n1C	906081139	ANPLVSSLHSPNAO-YVLHZVERSA-N	439.497	1.772	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)NC2CC2)cc1)NNC(=O)[C@@H]1COc2ccccc2O1	913465077	CSXORFZAJPXAIG-IBGZPJMESA-N	445.497	1.047	50	20	IDGD	
CN(C)c1ncccc1C(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	915274159	QAVROPWOEWXAKF-UHFFFAOYSA-N	442.479	1.981	50	20	IDGD	
CC(=O)Nc1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)ccc1C	915635613	SOMVTGNPLXYAQA-UHFFFAOYSA-N	444.513	1.813	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)NCc1ccc(S(=O)(=O)NC)s1	916233367	VGNQZTFZSQTJFB-UHFFFAOYSA-N	426.520	1.128	50	20	IDGD	
CNS(=O)(=O)c1cccc(CNC(=O)NNC(=O)c2ccc(Br)s2)c1	916486139	ZNOQYKZHXBIKTJ-UHFFFAOYSA-N	447.336	1.563	50	20	IDGD	
CC(C)(C)OC(=O)N(CCCNC(=O)NNC(=O)[C@H]1COc2ccccc2O1)C1CC1	916631457	QXSZYEXPCYRWLC-QGZVFWFLSA-N	434.493	1.946	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)N[C@H]2CCN3CCCC[C@@H]23)c2ccccc2c1=O	916638927	NLJUDMLBALLKOR-ROUUACIJSA-N	426.521	1.767	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)c1ccc(Cl)nc1	917745935	CZJANAOCMNZCIT-UHFFFAOYSA-N	444.922	1.143	50	20	IDGD	
C[C@H]1CCCN(S(=O)(=O)c2ccc(CNC(=O)NNC(=O)CC(F)(F)F)cc2)C1	918081433	AMTVABKZGRGZBK-LBPRGKRZSA-N	436.456	1.890	50	20	IDGD	
O=C(CN1C(=O)[C@@H]2[C@@H](C1=O)[C@H]1C=C[C@H]2C1)NNC(=O)c1ccc(F)cc1Br	918339968	YDNKZRUFQJLNLU-DMAMZFHHSA-N	436.237	1.156	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(F)c(S(=O)(=O)N(C)C)c2)cc1C	918687437	XYWHHFMCXWLSAY-UHFFFAOYSA-N	436.465	1.093	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)CCCNS(=O)(=O)c2ccc(C)cc2)cc1	919557919	BGHPVOCYEMJFTJ-UHFFFAOYSA-N	447.513	1.366	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H](C)Cc2ccc(O)cc2)c1	919910976	FJAKQWBCFMIMPS-OAHLLOKOSA-N	448.545	1.998	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)Cn3cc(C)cn3)c2)cc1	920400271	HDPGDUYDXXVDNG-UHFFFAOYSA-N	443.485	1.462	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)CNC(=O)OCc2ccccc2)c2ccccc2c1=O	921301063	MECPTYWSZUOTRD-UHFFFAOYSA-N	437.456	1.494	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CN2CCC(CN3C(=O)c4ccccc4C3=O)CC2)cc1	1253404556	YFBXVVCUPUUTJK-UHFFFAOYSA-N	434.496	1.764	50	20	IDGD	
Cn1c(C(=O)O)cc(Br)c1C=NNC(=O)Cn1nnc(-c2ccccc2)n1	1318601240	XNJRFSKHQVWMLK-UHFFFAOYSA-N	432.238	1.290	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)c1cc2c(c(S(N)(=O)=O)c1)CCC2	1318973612	KOTUWTPRNROJLM-UHFFFAOYSA-N	433.486	1.061	50	20	IDGD	
O=C(CSCc1cccs1)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	1319207311	KUWIVXZBIZFLRS-UHFFFAOYSA-N	432.571	1.587	50	20	IDGD	
C=C1c2ccccc2C(=O)N1[C@H](C)C(=O)OCC(=O)NNC(=O)Cc1nc(C)cs1	1322067667	LPYMFWKWWRNELW-CYBMUJFWSA-N	428.470	1.200	50	20	IDGD	
CCCN1C(=O)c2ccccc2N2C(=O)CC[C@@]12C(=O)NNc1nncc(N)c1Cl	1330398971	SXKWXLMMZKUIFO-LJQANCHMSA-N	429.868	1.544	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)CCc3nc4cccnc4[nH]3)CC2)cc1	1333506587	AVODETCGWJZDOK-UHFFFAOYSA-N	435.532	1.164	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)c3cnn(-c4ncccc4Cl)c3C(F)F)nc21	1334109835	MGDACEIUHJBGJE-UHFFFAOYSA-N	435.782	1.998	50	20	IDGD	
CCOCCCn1c(NNC(=O)c2cn(C3CCOCC3)nn2)nc2ccccc2c1=O	1343517376	CCFWREJRXDHQCY-UHFFFAOYSA-N	441.492	1.523	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnn4c(C)cc(C)nc34)C2)C1	1777779832	MRRPEYPFYDPWGQ-OXQOHEQNSA-N	435.912	1.043	50	20	IDGD	
CC1=CC[C@H](C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cccc(B(O)O)c2)C3)CC1	1778748527	PFYUVZTUNJKYBN-SNYIIPAISA-N	440.349	1.240	50	20	IDGD	
CC[S@](=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@](C)(Cl)CCl)C2	1779220411	JKZMMUITQCMWJZ-OFARMESDSA-N	441.421	1.895	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnncc2C(=O)O)C1	1779691363	FNRNJFQRVDRDPW-RZQQEMMASA-N	438.912	1.710	50	20	IDGD	
COc1cc(OC)cc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)c1	1780662327	VWEGRDLWNMLOQK-ORAYPTAESA-N	441.322	1.931	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](NC(C)=O)c3ccc(F)cc3)C2)C1	1780910703	LVVHZYLMBYRFCS-BBTUJRGHSA-N	439.915	1.850	50	20	IDGD	
CCOc1cnc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](F)Br)C3)C2)cn1	1781326965	VOINPOWZZHONRN-XJKSGUPXSA-N	431.262	1.009	50	20	IDGD	
O=C([C@@H](F)Br)N1CC[C@]2(C1)CN(C(=O)[C@H](O)c1ccccc1Cl)CCO2	1781334802	QAUARZUIBIVORV-CPUCHLNUSA-N	449.704	1.894	50	20	IDGD	
Cc1cc(O)c([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1782104789	NZJHQJKKAAAASA-QGZVFWFLSA-N	432.260	1.856	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)CCc3cncnc3)CCO2)C1	1783342914	QHMBDTUYZLFMDO-MAUKXSAKSA-N	425.327	1.413	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](C)Br)C2)C1	1783534723	NQNBGYPKVXALRG-ORAYPTAESA-N	435.322	1.870	50	20	IDGD	
O=C(COc1ccc(O)cc1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21	1783842851	YVYUFWDXQIMFGH-JIRONKKISA-N	445.285	1.441	50	20	IDGD	
CC(C)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3Cc4ccccc4CN3)C[C@@H]21	1783850125	BVLUEJQJTWJICN-MUGJNUQGSA-N	433.980	1.946	50	20	IDGD	
O=C(Cn1ccc2sccc2c1=O)N1CCO[C@@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783943018	DONIHVXJYJWUCW-SFHVURJKSA-N	444.340	1.697	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(=O)c3ccco3)[C@H]2C1	1785141722	XGBKCLQPTSJMNA-XPCVCDNBSA-N	427.295	1.616	50	20	IDGD	
COc1cnc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CO[Si](C)(C)C)C[C@@H]32)c(F)c1	1785737991	PJIFCFDGCAWAKO-QRTARXTBSA-N	439.560	1.674	50	20	IDGD	
C[C@@H](C(=O)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1)n1ccnc1	1786231986	SHBFCOIWQSBPCZ-INIZCTEOSA-N	432.289	1.572	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)c1nccc2[nH]ccc12	1787336639	KUZHBFKGCBQMEF-ZAJUMQRFSA-N	439.285	1.847	50	20	IDGD	
C[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]2C1)N1CSCSC1	1787446404	IKYQUKMAGBXYAH-HTVCTNPSSA-N	425.979	1.544	50	20	IDGD	
O=C(NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1)C(=O)c1ccccc1	1788140780	WFAFAJAAGFPKRV-UHFFFAOYSA-N	442.280	1.997	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc4ncccn4n3)[C@H]2C1	1788303803	MDWXNSSSBXXMKQ-NGOJXBLDSA-N	440.331	1.559	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]2C1)n1ccccc1=O	1788764692	RXJJLGKQMGMOPL-OWSLCNJRSA-N	435.597	1.241	50	20	IDGD	
Cn1nc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]3C2)c2c1CCC2	1789868373	TWZMKEOSUMKCNL-DXJCSPRDSA-N	443.375	1.738	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CNC(=O)C(F)(F)F)[C@H]2C1	1791311967	TZJAXOHRYVTIIY-RVMXOQNASA-N	427.851	1.052	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1ccc(C2(NC(=O)c3cnc(N(C)C)o3)CCC2)cc1	1791599329	HPZPASDSYDGYNY-UHFFFAOYSA-N	442.520	1.861	50	20	IDGD	
Cc1nc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)CBr)c(C)s1	1792870834	WEUGOKCTMLJUOL-MJRMRKOOSA-N	444.395	1.923	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3cncn3c1)C2	1792871058	PZHCFTXHNMXDKN-JJAZEVLHSA-N	435.322	1.569	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3ncncc3c1)C2	1792871405	XYILKTQBCZYDPE-PTOXDTDZSA-N	447.333	1.864	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CNC(=O)OC(C)(C)C	1793006084	CAMXNPNESFPAOC-QRJUGERDSA-N	431.961	1.918	50	20	IDGD	
O=C(Cc1ccc(F)c(F)c1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2	1795297484	ZSPQKAJQSBXXEZ-OJXGSEEGSA-N	435.240	1.787	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)c1ncc(Cl)cc1Cl	1796189687	OYEUDTWPPDOLIS-MUJYYYPQSA-N	448.115	1.634	50	20	IDGD	
CCOC(=O)c1cccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Cl)c1F	1796366234	ODHKRZKXSWVISJ-OJXGSEEGSA-N	430.835	1.740	50	20	IDGD	
C[C@H](Nc1ccccn1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2	1797977570	HSPLLXQYDLBWRA-ZZVJUGKHSA-N	429.290	1.162	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cn3cccnc3n1)C2	1799275870	CLKRGASXQOFFQQ-AZGFTEDZSA-N	426.304	1.169	50	20	IDGD	
CC(=O)Nc1ccccc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Br	1799352296	ONFPKPXAKHONHS-VZAMPYOESA-N	442.285	1.539	50	20	IDGD	
C[C@H](O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C#N)=C/c1ccc(Br)cc1	1800335859	YVGBHKXXQJFRPZ-QGSZRHHWSA-N	448.317	1.326	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)Nc1ccccn1)C2	1800642014	RAKJKGRGCXHMCP-JBXGNFEISA-N	439.354	1.645	50	20	IDGD	
Cc1nc2ncccn2c1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)Br	1800756887	GHVUSWGUKSEFFA-DEQVHRJGSA-N	436.310	1.024	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1noc3ccccc13)C2	1800756982	SJIXVFJWFUCQCK-ZIVKBKJYSA-N	436.306	1.743	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc(Cl)cc1OC)C2	1800979364	BZHPHPJQIWRONQ-MVWRLGRASA-N	445.343	1.735	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@H]1CCN(C(=O)c2ncnn2C)[C@H]1c1cccnc1	1803007421	AHEAWHZDIHGNSK-YUELXQCFSA-N	435.326	1.561	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cncc3cnccc23)[C@@H]1c1cccnc1)[C@H](O)CCl	1803140004	AYTMBVAXKKFUTH-CWFSZBLJSA-N	439.903	1.944	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)Cn2ccnn2)[C@@H]1c1cccnc1)[C@H](F)Br	1808663222	YRWIHCYOYXYZRS-CFVMTHIKSA-N	425.262	1.070	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)c1ccc2cnccc2n1	1809140802	MWNDWIFHVWKVHX-PWIZWCRZSA-N	439.903	1.944	50	20	IDGD	
CN1CCN(CC(=O)NC[C@H]2CCN(C(=O)CO[Si](C)(C)C)[C@H]2c2cccnc2)CC1	1809598331	HAFOIIYRFRKTNZ-KNQAVFIVSA-N	447.656	1.186	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)c1ccc2cccnc2n1	1809724055	WRNSZRGZOXBBOZ-WDSOQIARSA-N	439.903	1.944	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2cc3n(n2)CCCO3)[C@H]1c1cccnc1	1809868732	XHCHYBLXJYNWJN-TXPKVOOTSA-N	447.923	1.634	50	20	IDGD	
CC(C)=NO[C@H](C)C(=O)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1	1809970017	YNAATGUAHWDXTC-QGZVFWFLSA-N	429.326	1.012	50	20	IDGD	
O=C(COC(=O)C(F)(F)F)NC[C@@H]1CCN(C(=O)[C@@H](F)Cl)[C@@H]1c1cccnc1	1810183293	PQSZTAVKXVFBKN-CYZMBNFOSA-N	425.766	1.727	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)Cc2cccc(OC)n2)[C@@H]1c1cccnc1	1813028486	QVIXLIQFMKSAFC-PLMTUMEDSA-N	446.935	1.988	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cnc3c(c2)CCNCC3)[nH]n1)[C@H](O)CCl	1814874750	CUWYXBCEAJOLAA-QZTJIDSGSA-N	446.939	1.399	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1CCc2nc(NC(=O)Cn3ccnn3)sc2C1	1815764677	YZIKWCHAACUOKS-VHSXEESVSA-N	427.328	1.378	50	20	IDGD	
CC(C)CNC(=O)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCBr)CC2	1817322941	HCMYNDYJHUJRBY-JTQLQIEISA-N	431.356	1.612	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@H]2CCCSC2)[nH]n1)c1cccc(B(O)O)c1	1817479330	QGTIQZGFTVJLLS-MAUKXSAKSA-N	442.350	1.539	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2CCCCO2)[nH]n1	1819400440	KRIKIQCGUSBWNC-IRXDYDNUSA-N	441.492	1.283	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2)c1ccc(F)cc1	1822177216	BSMWJXBJCUGMDD-MRXNPFEDSA-N	439.277	1.502	50	20	IDGD	
COc1nccnc1C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1	1823001518	HHUAMHAQASJQCU-HQJQHLMTSA-N	444.286	1.858	50	20	IDGD	
COc1ncccc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1	1825904551	ZOMMMRXUDAAXFH-IBGZPJMESA-N	445.564	1.697	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)c2cscn2)CC1	1825985959	JZPTUZZBQMQUMC-LJQANCHMSA-N	427.335	1.370	50	20	IDGD	
CO/C=C(\C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1	1828798457	SLUYGVRMAHOEDT-IQGVVSCOSA-N	429.521	1.469	50	20	IDGD	
C=CCO[C@H](C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1	1828923966	ZJKFEQHSRIAOCP-UZLBHIALSA-N	443.548	1.510	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)N1CCC([C@H]2CCCCN2C(=O)CO[Si](C)(C)C)CC1	1829101903	HNLBPVPAFXQHHB-DLBZAZTESA-N	426.634	1.905	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)/C=C/c3cccc(C)n3)CCO2)C1	1829728358	LPITVUBMSBKVIV-KGMRQTNPSA-N	437.924	1.113	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1	1830363959	UWCOPJQBEDLJFO-IRXDYDNUSA-N	429.772	1.944	50	20	IDGD	
CCC[C@H]1CC[C@H](C(=O)N2CCOC[C@]3(CN(C(=O)[C@@H](O)CCl)CCO3)C2)CC1	1830736003	OWVTUATUHLVOTC-RYLXDESZSA-N	430.973	1.649	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)C[C@@H]3CCCCO3)CCO2)C1	1832339263	XSDKFUAINLKMGK-GJYPPUQNSA-N	447.370	1.433	50	20	IDGD	
Cc1nc[nH]c1C(=O)N1CCC(N2CCC(NC(=O)[C@H](C)CBr)CC2)CC1	1833263528	MUKLUUVXPQHNAM-CYBMUJFWSA-N	440.386	1.934	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(N(C)C)cn3)CCO2)C1	1833643377	QHYDUZISTMXELJ-UTKZUKDTSA-N	438.956	1.625	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)c3cnccn3)CC2)CC1	1834122187	STMVCKRVIBYHJX-CQSZACIVSA-N	438.370	1.693	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](C)CBr)C3)C2)nc1	1834371730	QCANXNPEHMPNQP-BEFAXECRSA-N	440.338	1.491	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@]3(CN(C(=O)CCBr)CCO3)C2)cnc1C	1834818858	DURYHMIEDGQWHR-IBGZPJMESA-N	440.338	1.553	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H]3CCc4nc[nH]c4C3)CC2)CC1)[C@@H](F)Cl	1835083699	QQYWHZBDGDFQDO-SCLBCKFNSA-N	425.936	1.621	50	20	IDGD	
C[C@H]1CCc2c(C(=O)N3CCC(OC4CCN(C(=O)[C@H](O)CCl)CC4)CC3)n[nH]c21	1836717071	GPYJLNQFMIFKFE-SUMWQHHRSA-N	438.956	1.671	50	20	IDGD	
O=C(c1cccc2c1OCC2)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836718377	WOSWUOWBXFRBKY-LJQANCHMSA-N	436.936	1.833	50	20	IDGD	
Cc1cc2nc(C(=O)N3CCO[C@@]4(COCCN(C(=O)[C@@H](F)Cl)C4)C3)[nH]c2cc1C	1837345929	QQKJCLHEESSTQM-OXQOHEQNSA-N	438.887	1.784	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3n[nH]c4ccccc34)C2)C1	1837713335	XLXSVEDCWWSOAM-OAQYLSRUSA-N	446.580	1.484	50	20	IDGD	
O=C(c1cc(-c2ccncc2)[nH]n1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1838011222	NJUNGTLLAQFRGM-VQIMIIECSA-N	437.859	1.076	50	20	IDGD	
O=C(c1ccc(OCCCO)cc1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1838547587	FTHBXEMHJYGFHL-YLJYHZDGSA-N	444.887	1.052	50	20	IDGD	
O=C(c1cccc(F)c1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1838911280	JXBGJNMCBQGRIF-YOEHRIQHSA-N	433.249	1.586	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CSCc3[nH]cnc3C)C2)C1	1839145363	FPBKBCBXYVFWQN-DNVCBOLYSA-N	444.985	1.425	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnn4cc(C)cnc34)C2)C1	1839146353	XKMRGADFUSHRHZ-UZLBHIALSA-N	435.912	1.125	50	20	IDGD	
Cc1ncc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)s1	1839152599	FMWQHZQKWFLJMW-IAGOWNOFSA-N	436.361	1.758	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccc(F)c(C#N)c3)CCO2)C1	1839187518	HPDYHAYOZIQZGG-LAUBAEHRSA-N	437.899	1.714	50	20	IDGD	
Cc1cccc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)n1	1839198582	JJRZXNHRHQIQOM-SJLPKXTDSA-N	444.301	1.079	50	20	IDGD	
Cc1nc2ccc(F)cn2c1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1839526785	XPDGQGHOGZQOEL-LPHOPBHVSA-N	442.850	1.386	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)C3CCSCC3)CCO2)C1	1840922368	IEYMVHGFZHKREB-KBXCAEBGSA-N	449.411	1.617	50	20	IDGD	
CC(C)(Cc1ccccc1)C(=O)N1CCCC12CN(C(=O)c1cnccc1C(=O)NN)C2	1841292216	QPZGKWWYJOMSRH-UHFFFAOYSA-N	435.528	1.771	50	20	IDGD	
C#CCCC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1	1841352612	AVSWSUFYUDHEHF-CVEARBPZSA-N	441.956	1.486	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC2(CCCN2C(=O)c2cc(=O)cco2)C1	1842578005	URNRGXMMBKXSHW-AWEZNQCLSA-N	439.896	1.589	50	20	IDGD	
COc1ccc2nc(C(=O)N3CC4(CCCN4C(=O)c4ccc(B(O)O)cc4)C3)ccc2c1	1843011267	LYEHAALDZVFSGP-UHFFFAOYSA-N	445.284	1.054	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)/C=C/c2cc3ccccc3o2)C1	1843835842	CVABJKPKLNTFCO-VOTSOKGWSA-N	445.479	1.962	50	20	IDGD	
Cn1nc(C(F)(F)F)cc1C(=O)N1CCCC12CN(C(=O)[C@H](F)Br)C2	1844509050	FBNOYEYSWGGWQV-JTQLQIEISA-N	427.196	1.946	50	20	IDGD	
CC[C@H](C)[C@@H](N)C(=O)N1CC2(CCCN2C(=O)c2cc([N+](=O)[O-])ccc2OC(C)=O)C1	1844692303	JLHWPHMVXMOAKY-SCLBCKFNSA-N	432.477	1.711	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2cccc(F)c2F)C1	1844965104	VRSPNSMVVMEWAS-DHRITJCHSA-N	429.427	1.916	50	20	IDGD	
COc1ccccc1CC(=O)N1CCCC12CN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2	1846061540	RYOYDKORHKGJHL-PCLIKHOPSA-N	437.500	1.575	50	20	IDGD	
Cc1c(Cl)cccc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cnccc1C(=O)NN	1847368938	SYPQWCAPQHDXQZ-ROUUACIJSA-N	427.892	1.776	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cccc2c1NC(=O)C2=O	1847501503	RBKMULVAULIDGL-SWHYSGLUSA-N	434.290	1.668	50	20	IDGD	
CCCn1nc(C(=O)NNS(=O)(=O)c2ccc(NC(C)=O)cc2)c2ccccc2c1=O	16095537	JSJXBUQAUWQZHA-UHFFFAOYSA-N	443.485	1.388	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)[C@@H](NS(=O)(=O)c2ccc(C)cc2)C(C)C)cc1	17111870	JOXHGUHULZPLQM-FQEVSTJZSA-N	433.530	1.833	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NNC(=O)COc2cc(C)ccc2C)cc1	17202962	RYDWUWBJMMZYIF-IBGZPJMESA-N	445.541	1.991	50	20	IDGD	
O=C(COC(=O)COc1ccc(F)cc1Br)NNC(=O)c1ccccc1	28919084	KIXITIZUYYXCQV-UHFFFAOYSA-N	425.210	1.971	50	20	IDGD	
CC(C)(C)OC(=O)NCC1CCN(CC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)CC1	109805589	IRJXVOWPSTYEMO-UHFFFAOYSA-N	435.481	1.593	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)[C@@H]1CCCN(C(=O)Nc2ccccc2)C1	725742005	XMHMMOGEXAEPCN-CQSZACIVSA-N	429.502	1.569	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)NCCN2CCS(=O)(=O)CC2)c(C)n1-c1ccccc1F	726939256	RJEWZLDKRWVJJC-XMHGGMMESA-N	444.532	1.987	50	20	IDGD	
O=C(NCc1ccc2c(c1)OCCCO2)NNC(=O)c1csc(N2CCOCC2)n1	727473368	JYSDJDCDXRCKQH-UHFFFAOYSA-N	433.490	1.285	50	20	IDGD	
CCCCC(=O)N1CSC[C@H]1C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	728212016	PDDNIEURYAKABW-INIZCTEOSA-N	426.564	1.662	50	20	IDGD	
C=CCOc1c(Br)cc(C=NNC(=O)[C@@H](C)NS(C)(=O)=O)cc1OCC	728435994	BWWYUJYVPHSADY-LLVKDONJSA-N	448.339	1.800	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)N2CCN(C(=O)CN3CCCC3)CC2)c1C	728551777	NMQAAILIYZFOST-RCCKNPSSSA-N	427.549	1.425	50	20	IDGD	
O=C(NNC(=O)[C@H]1CC(=O)N(c2ccc3c(c2)CCC3)C1)C1CCN(c2ncccn2)CC1	728846151	SLKAZWICTCVGGL-IBGZPJMESA-N	448.527	1.382	50	20	IDGD	
COc1cc(OC)c(OC)cc1CNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1	728955487	YLWWXEXFWDDUAZ-UHFFFAOYSA-N	444.492	1.249	50	20	IDGD	
CC(C)[C@@H](NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)c1nc(C2CC2)no1	729052034	DLMXRPIGNHJWAO-OAHLLOKOSA-N	428.497	1.681	50	20	IDGD	
Cc1noc(C)c1CCNC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	730678717	ZZOBQKQCWXIYDU-UHFFFAOYSA-N	435.506	1.263	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)N1CCN(S(=O)(=O)c2ccc(Cl)s2)CC1	731848865	OVMMHMSTBBQPBG-GFCCVEGCSA-N	436.987	1.290	50	20	IDGD	
CNS(=O)(=O)C1CCN(C(=O)/C(C#N)=C/c2cc(C)n(C[C@H]3CCCO3)c2C)CC1	732126148	CAJOEQPFVPBULL-TVNWYLLRSA-N	434.562	1.731	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCCCC2)cc1S(=O)(=O)NNC(=O)c1ccc[nH]1	733249690	QAIHOBIRHAEMGB-UHFFFAOYSA-N	426.520	1.121	50	20	IDGD	
CCOCCCn1c(NNC(=O)c2cccc(-n3cnnn3)c2)nc2ccccc2c1=O	733268071	IUWFEYMPYDEDMZ-UHFFFAOYSA-N	434.460	1.556	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])o2)cc1	733560223	XWJOSCSSMILNLS-AWEZNQCLSA-N	444.400	1.105	50	20	IDGD	
CCc1ccccc1N1C[C@H](C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)CC1=O	734241986	NOEVVYVUUBWPAO-OAHLLOKOSA-N	433.509	1.457	50	20	IDGD	
Cn1nc(SCC(=O)NN=Cc2ccc(-c3c(F)cccc3F)o2)c(=O)n(C)c1=O	734365559	LPWINSDMTQGZBD-UHFFFAOYSA-N	435.412	1.260	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)C(C)(C)C	734387788	UEYVUTPJQWIRPU-HNNXBMFYSA-N	425.551	1.470	50	20	IDGD	
COc1cccc(OC)c1Oc1ccc(CNC(=O)NNC(=O)c2cnn(C)c2)cn1	735510224	JPWIYUAZFAEDSM-UHFFFAOYSA-N	426.433	1.769	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc2c(c1)OCCCO2)NNc1c(F)cccc1F	735701306	UMNVBQYNLBPRLX-UHFFFAOYSA-N	427.429	1.938	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NC[C@@H](O)C1CCOCC1	736650550	WLBXEANXTWNTNX-XHDPSFHLSA-N	430.299	1.334	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)Cn2cnc3sccc3c2=O)cc1C	736735407	OWWLERVRPMQCGT-UHFFFAOYSA-N	434.499	1.395	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)C[C@@H]2Oc3ccccc3NC2=O)cc1C	736764199	JQMDXSYYRUUMEX-AWEZNQCLSA-N	431.470	1.713	50	20	IDGD	
COc1cccc(C(=O)NNS(=O)(=O)c2cccc(I)c2)c1O	739667939	DKJMSIAWKIAONO-UHFFFAOYSA-N	448.238	1.629	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1	740914787	GRRJFNPOOQPDAK-UHFFFAOYSA-N	427.417	1.416	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)c1ccco1	741514356	KGGFTVRLQINECB-OAHLLOKOSA-N	435.502	1.184	50	20	IDGD	
Cn1c(=O)n(C)c2cc(S(=O)(=O)NNC(=O)CC(C)(C)C)c(Br)cc21	741657577	RZMAQSGNTYEXRB-UHFFFAOYSA-N	433.328	1.385	50	20	IDGD	
CCCCS(=O)(=O)N1CCC[C@@H]1C(=O)NNC(=O)c1cccc(Br)c1	742771826	DAYVREJHNCBUQM-CQSZACIVSA-N	432.340	1.804	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)c1ccc2c(c1)CC(=O)N2C	743588244	XYJQATURMRBGQB-GFCCVEGCSA-N	445.501	1.706	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)CCCOc1ccc(S(C)(=O)=O)cc1	743746007	BUTAUYLSGUCIPD-UHFFFAOYSA-N	430.486	1.666	50	20	IDGD	
CN(CC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)C[C@H]1CCN(Cc2ccccc2)C1	744425943	NBNCXYYCZQSWIF-GOSISDBHSA-N	425.489	1.810	50	20	IDGD	
CC(C)(C)c1ncc(/C=C/C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)s1	745682670	YOOKLBXRIHUJRS-ROJDOSBLSA-N	445.497	1.984	50	20	IDGD	
O=C(NNC(=O)N1CCOCC1)[C@@H]1CCCN(C(=O)c2ccccc2OC(F)F)C1	745986066	JEUMMQHWLKSBAL-CYBMUJFWSA-N	426.420	1.213	50	20	IDGD	
CCCCN1C(=O)CC[C@@H](C(=O)NNC(=O)N2CCOCC2)[C@@H]1c1ccccc1OC	745991866	HYVATINLNICVDJ-XLIONFOSSA-N	432.521	1.848	50	20	IDGD	
Cc1cc(=O)c(C(=O)NNC(=O)N2CCOCC2)nn1-c1cccc(C(F)(F)F)c1	745991883	INMHORJQZHBYHM-UHFFFAOYSA-N	425.367	1.246	50	20	IDGD	
Cc1noc(C(F)F)c1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	746093681	SJHYJUDXQJMCKH-UHFFFAOYSA-N	428.417	1.780	50	20	IDGD	
COc1cc(C)nc(NNC(=O)NCc2cccc(CN3CCC[C@@H](C(N)=O)C3)c2)n1	746760096	LBIMDGKOTBRHFG-QGZVFWFLSA-N	427.509	1.317	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)NCCNS(=O)(=O)c2cccs2)c1C	747133556	PLLDPCMEEUMZCJ-ATVHPVEESA-N	436.559	1.815	50	20	IDGD	
CC(C)C(=O)NCCNC(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1	747865464	GFLQRYHVFAYUEZ-OAQYLSRUSA-N	437.544	1.716	50	20	IDGD	
CS(=O)(=O)CC[C@@H](NC(=O)c1ccc(Cl)cc1)C(=O)NNc1ccc(C#N)cc1	748106185	JOHGGZHWWJNVHW-QGZVFWFLSA-N	434.905	1.888	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)(F)F)cc1)[C@H]1CC(=O)N(CC(F)(F)F)C1	748520860	WASQQDVZZXPKED-QMMMGPOBSA-N	433.330	1.834	50	20	IDGD	
CCc1cc(N2CCC(NC(=O)NNC(=O)c3ccc(OC)c(OC)c3)CC2)ncn1	748663453	LZPMIVZXQQZGJL-UHFFFAOYSA-N	428.493	1.669	50	20	IDGD	
COC(=O)c1cc(OC)c(S(=O)(=O)NNC(=O)c2cccc(Br)c2)s1	749010661	HXKAKLDSYSZMBA-UHFFFAOYSA-N	449.304	1.929	50	20	IDGD	
O=C(NCCc1ccc(O)cc1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	749347226	OACHCCPAEPERLZ-UHFFFAOYSA-N	432.502	1.363	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(Cl)s1)NNC(=O)c1cc(-c2ccccc2)on1	749842939	OFMWRLZUTLNHSR-UHFFFAOYSA-N	440.890	1.796	50	20	IDGD	
O=C(NNc1nc(Br)cn2ccnc12)[C@H]1CC(=O)N(Cc2ccccc2)C1	750249809	KIAHFRYZAWFCEG-ZDUSSCGKSA-N	429.278	1.984	50	20	IDGD	
O=C(Cc1csc(N2CCOCC2)n1)NN=CC1(CN2CCOCC2)CCCCC1	751134665	NUIGDQLYZYIYGS-UHFFFAOYSA-N	435.594	1.907	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)c1nn(-c2ccc(F)c(F)c2)c2c1CCC2	751204183	VMPNCHSPPWTZAD-UHFFFAOYSA-N	429.383	1.423	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)[C@@H]2CCCN(C(=O)c3ccc4n[nH]cc4c3)C2)c1	751290520	MVGAROSBFUYBRM-QGZVFWFLSA-N	435.484	1.950	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2C[C@H](CNC(=O)OC(C)(C)C)C[C@H]2C)n1	752069511	PHTBOACFSQSSGJ-KGLIPLIRSA-N	425.555	1.377	50	20	IDGD	
C[C@H]1Cc2cc(C(=O)NNc3nc4ccccc4c(=O)n3C)ccc2N1S(C)(=O)=O	752902075	IDKJKDFNFXUNDE-LBPRGKRZSA-N	427.486	1.401	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)c(C(F)F)n1	755180369	QFHQCZABFKKVGW-UHFFFAOYSA-N	440.882	1.590	50	20	IDGD	
COc1ccc([N+](=O)[O-])cc1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	755322935	YHMDSTRVRSLZFV-UHFFFAOYSA-N	437.434	1.320	50	20	IDGD	
COc1cc(C=NNC(=O)[C@@H]2COc3ccccc3O2)c([N+](=O)[O-])cc1OCC(=O)O	755488607	WZCUAZXDVJYPHY-KRWDZBQOSA-N	431.357	1.357	50	20	IDGD	
COC(=O)CNC(=O)c1ccc(NC(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)cc1	755551192	XJSDTWWKTGPRJS-UHFFFAOYSA-N	436.428	1.446	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CN2CCC[C@@H](NC(=O)c3cc4ccccc4o3)C2)c1	756043356	ZZDQRILMJUZIEX-LJQANCHMSA-N	445.479	1.960	50	20	IDGD	
C=CCNC(=O)c1ccc(NC(=O)NNC(=O)c2nn(CC)c(=O)c3ccccc23)cc1	756112973	XEEIUBNDFCTPDP-UHFFFAOYSA-N	434.456	1.799	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)ccc1Br	756845873	UPJOWALHMWAZDJ-UHFFFAOYSA-N	432.238	1.900	50	20	IDGD	
CS(=O)(=O)CCn1cccc(NC(=O)NNC(=O)c2cccc3ccccc23)c1=O	757781363	RTXUTVUEABZMKL-UHFFFAOYSA-N	428.470	1.513	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)CN(Cc1ccco1)c1cccc(Cl)c1	758043825	KZPVVISDXHLZDF-LBPRGKRZSA-N	428.898	1.025	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCCc1cccc([N+](=O)[O-])c1	758654473	YQCYANRHSMLPFB-UHFFFAOYSA-N	434.478	1.383	50	20	IDGD	
CN(NC(=O)C#Cc1ccc2c(c1)OCO2)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758781421	CNAFKIIZXNORPW-UHFFFAOYSA-N	430.461	1.403	50	20	IDGD	
CCn1cc(C(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3CN2Cc2ccccc2)cn1	758908200	NYGMDHVRQCQUDC-NRFANRHFSA-N	431.496	1.860	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)c2cccn3c(I)cnc23)nc1	759734450	GYYOHLXRLBWABI-UHFFFAOYSA-N	437.197	1.877	50	20	IDGD	
Cc1nn(-c2ccccc2)c2sc(C(=O)NNC(=O)C(=O)Nc3cnns3)cc12	760278354	BZGRXOZGOFBOAS-UHFFFAOYSA-N	427.471	1.647	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)Cc3cccc(OCC#N)c3)n[nH]2)cc1OC	760402699	IIEZVIYJBPRXFR-UHFFFAOYSA-N	435.440	2.000	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCCC(=O)NNc1cc(C#N)cc(Cl)n1	760928148	DLUKRWPQRVSTBQ-CYBMUJFWSA-N	436.900	1.956	50	20	IDGD	
C=C(C)COCCNC(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	762367678	GBXLPRKOHJLQRP-UHFFFAOYSA-N	435.488	1.925	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)[C@@H](C)N1C(=O)c2ccc(C)cc2C1=O	762404908	NCFGZUVTJRCMJT-CYBMUJFWSA-N	427.482	1.928	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)[C@H]2CCCN(S(=O)(=O)c3ccccc3)C2)n1	762908548	VTYIHQNTNRYNFS-INIZCTEOSA-N	432.550	1.867	50	20	IDGD	
COC(=O)CSCc1cccc(NC(=O)C(=O)NNC(=O)c2c[nH]c3ccccc23)c1	763535499	UWWUSMAJOFNUOO-UHFFFAOYSA-N	440.481	1.974	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C)c(N3CCOC3=O)c2)cc1OC	763552339	YYJDSQXDRJLICB-UHFFFAOYSA-N	442.428	1.369	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(N3CCOC[C@@H]3C)cc2)c1	763619319	SCEYFAUMPQWVEH-INIZCTEOSA-N	426.473	1.385	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2cc(NC(C)=O)c(F)cc2F)c1	763773003	RORPEQGYPSWQJA-UHFFFAOYSA-N	436.371	1.340	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)OCO3)c2ccccc2c1=O	763791529	UUKSJHDKWBHPCU-UHFFFAOYSA-N	437.412	1.106	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c(C)c1	763797551	WGARIVPNGJJIAA-UHFFFAOYSA-N	444.513	1.488	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cccc([C@H]3CNC(=O)C3)c2)c1C	763849786	MZOIPKINNFDZCJ-NVXWUHKLSA-N	438.484	1.460	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccc(-c2csnn2)cc1	763859205	YUNYMWILYNOVSD-NSHDSACASA-N	429.433	1.898	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)CN(C)C3)cc1	763862207	VMWKNZRTOKZYNJ-CQSZACIVSA-N	426.473	1.584	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1-c1ncco1	763921771	OJVCHHVXSIKKEY-UHFFFAOYSA-N	432.400	1.025	50	20	IDGD	
Cc1ccc(Oc2ccc(NC(=O)C(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)cn2)cc1C	764001682	BWBWYSHIEUFQQG-CQSZACIVSA-N	446.485	1.011	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)Nc1cccc(OC(F)F)c1	764004533	GIISZNMMKHBZJH-UHFFFAOYSA-N	431.193	1.789	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccccc2OC(F)F)c1	764078679	ZWOOJMBJYIIHPW-UHFFFAOYSA-N	427.385	1.091	50	20	IDGD	
O=C(CC(F)(F)F)NNC(=O)C(=O)Nc1ccnn1Cc1cnn(-c2ccccc2)c1	764111874	HDGSUBNXEKURDG-UHFFFAOYSA-N	435.366	1.155	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1cc(S(C)(=O)=O)ccc1Cl	764138590	FMOJXDKITACDBG-UHFFFAOYSA-N	439.877	1.081	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(=O)n(Cc3ccccc3Cl)c2)c1	764233659	CTYXDXKUESOUGA-UHFFFAOYSA-N	449.854	1.821	50	20	IDGD	
COC(=O)c1cc(F)c(F)cc1NC(=O)C(=O)NNC(=O)c1cccc2ncccc12	764252861	MZWWUDHVKBTTBL-UHFFFAOYSA-N	428.351	1.699	50	20	IDGD	
Cc1nn(-c2ccc(C(=O)NNC(=O)CNC(=O)c3cccnc3)cc2)c(C)c1Cl	764344763	JAEDJQONVYEWQJ-UHFFFAOYSA-N	426.864	1.729	50	20	IDGD	
COc1c(C(=O)NNC(=O)CNC(=O)c2cccnc2)sc(C)c1Br	764344962	MNDVIVPIHAOBIS-UHFFFAOYSA-N	427.280	1.414	50	20	IDGD	
CNC(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)c1	764345517	GRSINJQPDIEGED-UHFFFAOYSA-N	425.228	1.458	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)c(Cl)c1)C(=O)Nc1cc2c(cc1Cl)OCCO2	764345984	PFPSIRQNNJTPSB-UHFFFAOYSA-N	426.212	1.870	50	20	IDGD	
CCn1nc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)cc1C1CC1	764387884	NVYJXUUSROMYKU-UHFFFAOYSA-N	425.424	1.709	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1ccc2nc(Cc3ccccc3)oc2c1	764397159	GKLKMXSGUOQTHW-CQSZACIVSA-N	440.456	1.556	50	20	IDGD	
Cc1nc(-c2cccc(NC(=O)C(=O)NNC(=O)CSc3ccccc3O)c2)no1	764399935	BISQPNFFQXNEGZ-UHFFFAOYSA-N	427.442	1.629	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COCCO1)C(=O)Nc1cc(Cl)ccc1SCC(F)(F)F	764430090	SNMFOYULIMBPOH-JTQLQIEISA-N	441.815	1.496	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1ccc(N2CCCC2=O)cc1	765734645	BGQFOKLOOLALBK-UHFFFAOYSA-N	449.511	1.032	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cccc(Cn4ccnc4)c3)CC2)cc1	766649088	NNWWPKJXRSCUPQ-UHFFFAOYSA-N	446.555	1.819	50	20	IDGD	
CCOC(=O)N1CCC(NC(=O)CCCNC(=O)NNc2ncnc3ccsc23)CC1	766877286	FHKLVKXYPNOASG-UHFFFAOYSA-N	449.537	1.835	50	20	IDGD	
O=C(CSc1nnc(O)nc1O)NN=Cc1ccc(Br)cc1[N+](=O)[O-]	767765630	QNNINVXBTIJSHC-UHFFFAOYSA-N	429.212	1.196	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cc(C3CC3)nn2-c2ncccn2)cc1	768236554	DQHZDAAEQOGKTH-UHFFFAOYSA-N	435.444	1.013	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CSc2nnc(-c3n[nH]c4c3CCC4)n2N)cc1C	768427940	JMABMQYHTUWNBZ-UHFFFAOYSA-N	446.562	1.356	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)c1nccc2c(S(N)(=O)=O)cccc12	768488288	YISKCRYRFRNCHE-UHFFFAOYSA-N	446.510	1.444	50	20	IDGD	
O=C(NCCc1cscn1)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	769194335	BWTXAKMQFDJGOM-UHFFFAOYSA-N	437.547	1.504	50	20	IDGD	
COc1ccccc1[C@@H](CNC(=O)NNc1nc(O)c2cnn(C)c2n1)N1CCCCC1	770349549	JUXYNRRZFQUWAE-MRXNPFEDSA-N	440.508	1.931	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2ccoc2Br)CC1	770500887	AZVQUAOMIKQGAC-UHFFFAOYSA-N	444.311	1.130	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)NCCS(=O)(=O)NCC1CCC1	770514854	WSIUUMWUHGDNMP-LBPRGKRZSA-N	432.930	1.157	50	20	IDGD	
CC(C)(C)OC(=O)N1CCSC[C@H]1CC(=O)OCC(=O)NNC(=O)c1ccccc1	772283770	CSKUYUSEEUJXFV-OAHLLOKOSA-N	437.518	1.733	50	20	IDGD	
Cc1ccc(-n2nc(C)cc2NC(=O)C(=O)NNC(=O)c2cccc(OC(F)F)c2)nn1	773496549	OBBBMYAHEDSYOO-UHFFFAOYSA-N	445.386	1.280	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2cc(-c3cc(F)cc(F)c3)nn2C)c1	773521816	WECOESQKFKPHIJ-UHFFFAOYSA-N	443.410	1.839	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COCCN1CC(F)(F)F)c1ccc(COc2ccccc2)o1	773712414	IEARBDSYYSMXEZ-HNNXBMFYSA-N	427.379	1.883	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNc2nccc(OC)n2)c2ccccc12	773724814	ZGHAVJBQCQMNIX-UHFFFAOYSA-N	425.401	1.272	50	20	IDGD	
CC[C@H](C)NS(=O)(=O)c1cccc(NC(=O)C(=O)NNc2nccnc2C(C)C)c1	773992739	UPVBGUFOLJCIER-ZDUSSCGKSA-N	434.522	1.759	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)N[C@H](c1ccccc1OC(F)F)C(F)(F)F	776003042	WIKKAEKYVIZIPJ-OIBJUYFYSA-N	448.370	1.160	50	20	IDGD	
Cc1cc2ncc(C(=O)NN(C)C(=O)N3CCN(C(=O)OC(C)(C)C)CC3)c(C)n2n1	776205137	KDASXFDEBIMMIT-UHFFFAOYSA-N	431.497	1.595	50	20	IDGD	
COc1ccc(OC)c(CC(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)c1	776206204	RAGDAWKEIBEFSU-UHFFFAOYSA-N	436.509	1.882	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)N1CCC(n2ccc(C(F)(F)F)n2)CC1	778639828	HESAHQZRLVOJBF-UHFFFAOYSA-N	428.371	1.303	50	20	IDGD	
COCCN1C(=O)CCc2cc(NC(=O)C(=O)NNC(=O)c3cc(C)oc3C)ccc21	778706078	LJIRJMRCLGTYPN-UHFFFAOYSA-N	428.445	1.222	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)C(=O)Nc1ccccc1-c1c(F)cccc1F	778711287	XNULKNCHASSMQD-NSHDSACASA-N	437.424	1.152	50	20	IDGD	
Cn1cnn(-c2ccc(NC(=O)C(=O)NNc3ccccc3OC(F)(F)F)cc2)c1=O	778803260	LTNHHTFPMGMEKU-UHFFFAOYSA-N	436.350	1.551	50	20	IDGD	
O=C(NNC(=O)[C@H](O)[C@@H](O)c1nc2ccccc2s1)c1cccc(Br)c1	779526066	ULFGSGYRCXDYIO-ZIAGYGMSSA-N	436.287	1.914	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2cccc(C(C)(F)F)c2)c2ccccc2c1=O	782121306	ULXBHNZHKYQLCF-UHFFFAOYSA-N	443.410	1.928	50	20	IDGD	
CCCCCn1nc(C)cc1NC(=O)C(=O)NNC(=O)Cc1nc2ccccc2n1C	782894557	OXJWBLIWQQWORD-UHFFFAOYSA-N	425.493	1.597	50	20	IDGD	
N#Cc1ccc(Oc2ccc(NC(=O)C(=O)NNC(=O)C(=O)NC3CC3)cc2Cl)cc1	782967084	RDTDCOMTRTUXJD-UHFFFAOYSA-N	441.831	1.368	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCC(CCCn3ccnc3)CC2)cc1OC	783032312	YKNYNRFMDYAKQV-UHFFFAOYSA-N	429.521	1.854	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2ccc3nc(Cc4ccccc4)oc3c2)CCS(=O)(=O)C1	783426278	HARNLCLYGCKWFE-NRFANRHFSA-N	442.497	1.555	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2cccc(CSC3CCCC3)c2)CCS(=O)(=O)C1	783428879	YHARLQFUJSGIKQ-LJQANCHMSA-N	425.576	1.999	50	20	IDGD	
O=C(NNC(=O)C1(Cc2ccc(OC(F)(F)F)cc2)CC1)N[C@H]1CCS(=O)(=O)C1	784361151	UGTUVSXXGCFNBF-LBPRGKRZSA-N	435.424	1.425	50	20	IDGD	
O=C(NNc1nc(-c2ccc(Cl)cc2)no1)C(=O)Nc1ccc(-n2nccn2)nc1	784799349	DCCOEZZJEDDLJT-UHFFFAOYSA-N	425.796	1.448	50	20	IDGD	
CCOC(=O)Cn1ccc2cc(NC(=O)C(=O)NNc3ccnc(N(C)C)n3)ccc21	784970545	JLNMTVKAUHXCBS-UHFFFAOYSA-N	425.449	1.142	50	20	IDGD	
N#C/C(=C/c1ccc(O)cc1)C(=O)N1CCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)CC1	786644799	GVODHALEKJFMCM-SSZFMOIBSA-N	442.453	1.740	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(C(=O)[C@H](C)OC(=O)/C(C#N)=C/C3CC3)CC2)cc1	786677390	HIKIXHMWQQPEOT-HZGBGQKMSA-N	431.514	1.620	50	20	IDGD	
CCOC[C@@H](NC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)C(C)C	788869481	GTGWSVROROJPQH-QGZVFWFLSA-N	426.539	1.476	50	20	IDGD	
Cc1ccc(CN2CC[C@H](NC(=O)NNC(=O)c3cc([N+](=O)[O-])ccc3O)C2=O)cc1	790696781	NVZDZFJRHKAAIE-INIZCTEOSA-N	427.417	1.354	50	20	IDGD	
CO[C@H]1CCOc2c(NC(=O)C(=O)NNC(=O)COc3ccc(Cl)cc3)cccc21	790952168	PFKXVDBPVMSAIB-INIZCTEOSA-N	433.848	1.975	50	20	IDGD	
CNC(=O)c1cc2cc(NC(=O)C(=O)NNC(=O)c3cccc4ncccc34)ccc2[nH]1	792356965	WGKUSXBCIBXLMV-UHFFFAOYSA-N	430.424	1.475	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc(OC(C)C)nn3)n[nH]2)cc1	793027712	YXIARWMQJAOYRN-UHFFFAOYSA-N	437.460	1.616	50	20	IDGD	
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNc1ccccc1S(=O)(=O)N(C)C	795176882	GSSMBQWZKOYHMV-IBGZPJMESA-N	443.529	1.609	50	20	IDGD	
CCn1c(SCC(=O)NNC(=O)CN2CCCC2=O)nnc1-c1ccc(Cl)cc1	800695465	YDUPVUKETYJURZ-UHFFFAOYSA-N	436.925	1.480	50	20	IDGD	
O=C(NNc1ncccc1F)C(=O)Nc1ccc2c(ccn2CC(=O)N2CCOCC2)c1	807301161	YMGLWPKRPJEHEE-UHFFFAOYSA-N	440.435	1.116	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)[C@H]1CCCN(C(=O)c2ccc3n[nH]cc3c2)C1	807369890	OATNGMKNBNPGNS-HNNXBMFYSA-N	431.493	1.352	50	20	IDGD	
CCCn1nc(C(=O)NN=C2C(=O)N(CCN(C)C)c3ccccc32)c2ccccc2c1=O	807952839	ONJWGIGZKIAKNZ-UHFFFAOYSA-N	446.511	1.849	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)CNS(=O)(=O)c2c(F)cccc2F)cc1	810195576	OCIKPNSTDPSNGH-UHFFFAOYSA-N	427.429	1.032	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@@H]2CCCN(c3ccccc3)C2=O)cc(OC)c1OC	814362114	PXESXSNXUYTBJQ-INIZCTEOSA-N	427.457	1.917	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@](C)(O)c2ccc(Cl)cc2)c1	814722095	JRRUSTFXWMBTAV-SFHVURJKSA-N	425.894	1.259	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)c2ccc(I)cc2)C[C@@H](C)O1	912921765	WAMCPUGFHCUWCZ-VXGBXAGGSA-N	431.274	1.552	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)[C@@H]2CC(=O)N(c3ccc(F)c([N+](=O)[O-])c3)C2)c1	913123489	OCUYLNAZQALQPS-GFCCVEGCSA-N	446.391	1.565	50	20	IDGD	
COc1cc(C=NNC(=O)c2ccc(Cl)nc2)ccc1OCC(=O)N1CCOCC1	915973125	FWLDIVAQRRSEOV-UHFFFAOYSA-N	432.864	1.745	50	20	IDGD	
CCOc1cccc2c1OCC(C(=O)NNC(=O)c1csc(N3CCOCC3)n1)=C2	916135982	CIIBFWUCHANANV-UHFFFAOYSA-N	430.486	1.615	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)NCC[C@@](O)(c2nccn2C)C(F)(F)F)cc1	916379058	YYFJPIOHJXAZRB-QGZVFWFLSA-N	445.467	1.991	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)Cn1cc(Br)cn1	917903576	AFOLNYJLGOBKCZ-UHFFFAOYSA-N	435.326	1.005	50	20	IDGD	
Cn1nnnc1SCCC(=O)NNC(=O)COc1ccccc1Cc1ccccc1	917907652	GMBDWDRQHCCZAY-UHFFFAOYSA-N	426.502	1.510	50	20	IDGD	
C[C@H](NC(=O)C1CCCCC1)C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	918398601	CLKSXTYGKPXKSQ-SFHVURJKSA-N	429.565	1.431	50	20	IDGD	
Nc1c(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc(F)cc1[N+](=O)[O-]	918399817	XHZNLQXGDWRMMT-UHFFFAOYSA-N	430.440	1.289	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)cc1NC(=O)c1ccccc1	919884414	FOBQKBCBXHYZCF-INIZCTEOSA-N	430.486	1.378	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@H]2CCCN(Cc3cccnc3)C2)cc(OC)c1OC	920253661	FBFQDVKOOKWXLY-INIZCTEOSA-N	428.489	1.781	50	20	IDGD	
O=C(NNC(=O)c1ccccc1CSc1nc[nH]n1)c1csc(N2CCOCC2)n1	920473606	TXAYBKGDQGPUGS-UHFFFAOYSA-N	445.530	1.465	50	20	IDGD	
CC(C)[C@H](C(=O)OCC(=O)NNC(=O)c1cccs1)n1nnc(-c2ccccc2)n1	920585049	VTIGLPYKNGKMRF-MRXNPFEDSA-N	428.474	1.603	50	20	IDGD	
Cc1ccc(N2C(=O)/C(=C\NNC(=O)CCN3CCOCC3)c3ccccc3C2=O)cc1	1317700769	SNHQMAYBGXDVCN-PGMHBOJBSA-N	434.496	1.866	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@@H]2CN(Cc3nc(O)c4ccccc4n3)CCO2)cc1	1319260918	NDCVXCKNTYZKRV-SFHVURJKSA-N	437.456	1.006	50	20	IDGD	
COc1ccccc1[C@@]1(C)NC(=O)N(CC(=O)NNC(=O)c2ccccc2Cl)C1=O	1319390575	CIWZHUUEBCTRGS-HXUWFJFHSA-N	430.848	1.577	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@H]1CC(=O)N(C)c2ccccc21	1321541891	RYBWJQXSGPIKRT-AWEZNQCLSA-N	429.502	1.199	50	20	IDGD	
CS(=O)(=O)c1ccc(F)c(S(=O)(=O)NNC(=O)c2cncn2-c2ccccc2)c1	1322066065	ZQHQMCQUTAHEJJ-UHFFFAOYSA-N	438.462	1.038	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1cc2c(nc1O)CCC(C)(C)C2	1334706207	SXUMPDZLZGGSLR-UHFFFAOYSA-N	445.545	1.978	50	20	IDGD	
O=C(c1ccc2nonc2c1)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1777718651	CZIBULUXJJCSBJ-CJNGLKHVSA-N	427.230	1.357	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3nn(C)c4c3CCC4)C2)C1	1777963934	ALMIGGUQNJHFRT-IFXJQAMLSA-N	439.354	1.526	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccn4nccc4c3)C2)C1	1778740529	SGDUXCSNZQTLFU-APWZRJJASA-N	435.322	1.951	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3nnc(-c4ccccc4)o3)C2)C1	1779113680	AQBLJDUITKBLAA-DJJJIMSYSA-N	449.305	1.964	50	20	IDGD	
CCc1nn(C)c(C(=O)N2CCO[C@@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)c1Cl	1779295775	BIRSTTKVYQIJTH-LJQANCHMSA-N	443.020	1.931	50	20	IDGD	
O=C(c1cncc2cnccc12)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1780014423	ITJHKFXCEFWOQQ-MAUKXSAKSA-N	437.269	1.764	50	20	IDGD	
COc1c(Cl)ccnc1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](C)Br)CCO2	1780327745	AXIJIVDQDMGBNM-APPDUMDISA-N	446.729	1.971	50	20	IDGD	
C[C@@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Br)C1)n1cccn1	1780777068	LWMWHUBDBZVQHN-ZOMKSWQUSA-N	431.306	1.649	50	20	IDGD	
Cc1ccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C3)cc1O	1780866978	CRIQKBSBBGIJIL-AUSIDOKSSA-N	446.548	1.201	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C=C(\C)NC(C)=O)C1	1781465063	ACFHTXPJMSMLAA-OICGPCSFSA-N	444.370	1.714	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)CC(N)=O)C2	1781897135	CVINIAUMVPRGQZ-HNSFDTNUSA-N	432.359	1.185	50	20	IDGD	
COc1cc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](F)Cl)CCO3)cc([N+](=O)[O-])c1OC	1782116930	WDODGFKKDBGYQR-MAUKXSAKSA-N	445.831	1.590	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ncn(C(C)C)n1)C2	1782172698	KRNGIULFJVRUIV-SPYBWZPUSA-N	427.933	1.240	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)n1ccccc1=O)C2	1782175689	PCRMBHKFRNETGW-BZLDKRAPSA-N	439.940	1.177	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnc4ccc(F)cn34)C2)C1	1782464805	IEXVZJWJLZSMML-KZULUSFZSA-N	439.285	1.700	50	20	IDGD	
Cc1cnn([C@@H](C)C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](F)Br)C3)c1	1782514132	JSTVGTBBERNUQG-JTOWHCCKSA-N	445.333	1.957	50	20	IDGD	
Cc1nn(C)c(C)c1CC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(Cl)Cl)C2	1782553588	QVGLMPZSMGMKIH-DNVCBOLYSA-N	431.364	1.897	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cc(C)n(CC)n3)CCO2)C1	1783352765	SMLSKRCNHVYRKC-RDTXWAMCSA-N	427.343	1.828	50	20	IDGD	
COc1ncc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](C)Br)C3)C2)cc1F	1783532681	RHJUINFAIFWOMC-PIGZYNQJSA-N	430.274	1.456	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](C)Br)C3)C2)c(O)c1	1783535759	CKDBBHVILAYIID-KZULUSFZSA-N	427.295	1.628	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(=O)c3ccccc3)C[C@@H]21	1783967416	HJXVYUZQMNZFPX-HJWJTTGWSA-N	437.334	1.880	50	20	IDGD	
O=C(C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]2C1)c1ccc(Cl)cc1	1784084197	NRORCRUEEGCQET-HNKHHVNMSA-N	429.300	1.102	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=N/O[C@H]3CCCCO3)C[C@@H]21	1784618421	ZVSAXVZOXKTWCK-BRLCOEBDSA-N	429.945	1.903	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(CO)c(F)c3)C2)C1	1785263112	LSXBMYIHYZKVQH-YJYMSZOUSA-N	443.313	1.793	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3CCCC3)[C@H]2C1	1786307331	OSURDGJKVDGBCU-QECDCCOMSA-N	429.521	1.290	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4c(n3)NC(=O)CC4)[C@H]2C1	1787265375	ZLDFOIFXOUUJNL-ZOBUZTSGSA-N	448.951	1.825	50	20	IDGD	
O=C(NC1(c2ccc(NC(=O)c3cccc(O)n3)cc2)CCC1)c1cccc(B(O)O)c1	1787387654	WFQQGZROQOTDMS-UHFFFAOYSA-N	431.257	1.529	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]2C1)N1CSCSC1	1787446407	IKYQUKMAGBXYAH-QMVSFRDZSA-N	425.979	1.544	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(N4CCOCC4)c3)C[C@@H]21)[C@H](F)Cl	1787449193	CXIJYIIIOQZSDB-WNHJNPCNSA-N	439.915	1.651	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)c1ncccc1Br	1788960155	ROIMASPAQCKSSX-VTPLQMEGSA-N	446.729	1.037	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc(Cl)nc3)C[C@@H]21	1790960525	BKDGZYQDAJJASS-PYJNHQTQSA-N	445.745	1.897	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cncnc3C)C[C@@H]21	1790960863	SLAWMCMKGRUGRU-HNKHHVNMSA-N	425.327	1.552	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(F)ccc3OC)C[C@@H]21	1791256614	RPMIJHRFQYPCLV-PTOXDTDZSA-N	428.888	1.681	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3CCC(O)CC3)[C@H]2C1	1791404268	HPKYOGXDXWBZPA-NHHQPVPPSA-N	431.371	1.548	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCCn3ccnc3)[C@H]2C1	1791567193	PJLPBYXZPCSVIR-VGWMRTNUSA-N	427.343	1.426	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3ccc(Cl)cc3[nH]1)C2)[C@H](O)CCl	1792972477	QAPFAKIFQHBKDK-CZAMWMTLSA-N	426.300	1.624	50	20	IDGD	
CCN(CC)[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](O)CCl)c1ccccc1	1792984405	ZVELZWCGDVILQG-IVDHNXQLSA-N	437.968	1.259	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1C[C@@]13C(=O)Nc1ccccc13)C2	1793452722	HVLVGUSOXISVGX-ABJWLNFASA-N	445.947	1.894	50	20	IDGD	
O=C(CSc1ccncc1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2	1793950310	CRBMUPDIRHWMCQ-BAESOJJISA-N	432.315	1.454	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnn2c(C)cc(C)nc12	1796919290	QKFRIJNQCONADC-CYGHRXIMSA-N	433.940	1.957	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(F)nc1F)C2	1800638242	VELWVFYKGKXLHF-QPPBUOOMSA-N	432.265	1.737	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2ccsc2[nH]1	1800947828	KEQYFBOSVIONNE-BTTYYORXSA-N	438.513	1.794	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(F)c1Cl)C2	1801012815	ZFDNCXAHMBUNEE-DBWKPXFBSA-N	440.903	1.055	50	20	IDGD	
COC[C@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cn1c(=O)n(C)c3ccccc31)C2	1802273256	NAWGYIMTJOPRIZ-FZKCQIBNSA-N	434.924	1.232	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@H](CNC(=O)CCSC(=N)N)[C@H]1c1cccnc1	1807127624	PGNUOMPQJJKZEW-MAUKXSAKSA-N	437.642	1.956	50	20	IDGD	
COc1nccc(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)c1F	1807711225	KDTSLPRHAJGQQV-JLJPHGGASA-N	436.871	1.544	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)[C@@H]1CC[C@@H]2CCC(=O)N2C1	1807727254	RRTMNHSWNNCYOR-VAVNGKDRSA-N	448.951	1.088	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2[nH]nc3ccncc23)[C@H]1c1cccnc1	1808101548	NMXNXVFGCWVKEE-URLQWDBASA-N	442.907	1.926	50	20	IDGD	
CN1CCN(C2(C(=O)N3CC[C@H](CNC(=O)[C@H](F)Cl)[C@@H]3c3cccnc3)CC2)CC1	1808314152	CPOGOQLHFYYMPL-SQNIBIBYSA-N	437.947	1.402	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc(O)nn2)[C@@H]1c1cccnc1)[C@H](F)Br	1808651201	KGYXOMMAMPWUFR-GLQYFDAESA-N	438.257	1.587	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)c1cc2n(n1)CCCC2	1809861469	RWCQIZYACFKCHR-KFKAGJAMSA-N	431.924	1.534	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1	1809978636	FNGFPKAXKDWUNG-UHFFFAOYSA-N	432.402	1.063	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)c2ccnnc2O)[C@H]1c1cccnc1	1811233706	QSEGIXVKFVNNNC-CORIIIEPSA-N	434.294	1.680	50	20	IDGD	
C=C[C@H](O)C(C)(C)C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1813072425	DMCDMKDUGHTJSW-LQWHRVPQSA-N	445.564	1.034	50	20	IDGD	
C[C@@H](CBr)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CNC(=O)N(C)C)[nH]n1	1814776154	JLHKZETYMHRWFE-AAEUAGOBSA-N	443.346	1.704	50	20	IDGD	
CC(C)(C)[C@@H](O)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1814822857	PAWXQOPIUJJVSI-RDJZCZTQSA-N	443.508	1.121	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1sccc1F	1815428056	ZOCRZLJTFQNBDH-MRXNPFEDSA-N	442.281	1.910	50	20	IDGD	
CCc1cc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)CCC(=O)NN(C)C)CC3)n[nH]1	1815903931	QZVIYLFFESGKBD-LBPRGKRZSA-N	433.538	1.027	50	20	IDGD	
C[C@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)CC(F)(F)C(=O)O)sc2C1	1817095786	NWDXFCPPRANBHJ-BQBZGAKWSA-N	440.266	1.949	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819401669	NHRHGSSPTOJHGX-HNNXBMFYSA-N	447.927	1.979	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(F)c[nH]2)[nH]n1	1819404800	ZRVRXEVOOKESOV-MRXNPFEDSA-N	440.439	1.495	50	20	IDGD	
COC[C@H](NC(C)=O)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](C)Br)[nH]n1	1819612826	DZTJIMYTXOYJME-DDTOSNHZSA-N	444.330	1.336	50	20	IDGD	
O=C(C#CC1(O)CCCCC1)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](O)CCl)CC2	1819841869	SOZZTWVHPYIKMF-JSGCOSHPSA-N	425.938	1.353	50	20	IDGD	
COc1ccccc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1820438464	OTHWJZOXGHGXEQ-IBGZPJMESA-N	448.288	1.718	50	20	IDGD	
CCNC(=S)NCC(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](C)Br)n[nH]1	1822188882	PFWHKMUMGCYPRS-PWSUYJOCSA-N	445.387	1.669	50	20	IDGD	
CC(=O)C[C@@H](C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1822345598	XBVMTNWRKJZHNT-SJKOYZFVSA-N	441.492	1.329	50	20	IDGD	
CCO/C=C/C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1822603673	HIFYSQHAZPLMLZ-JCVNQNCUSA-N	427.465	1.264	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@H](O)CCl)CC2)c1c(F)ccc(O)c1F	1823632685	DPASHRFMUDQWMD-RDDDGLTNSA-N	431.848	1.952	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H](O)C(C)C)CC1	1824254234	QGXNSALRKCZHQG-MOYYENFUSA-N	445.564	1.757	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)C[C@@H]2CCCCO2)CC1	1824912395	BJBRFUXLYKCFNL-VQTJNVASSA-N	436.597	1.938	50	20	IDGD	
CC[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H]1CCC(=O)N1C)CC2	1825452020	UXPRDBXVXKPILI-FOGDFJRCSA-N	443.367	1.849	50	20	IDGD	
O=C([C@H](O)CCl)N1CCC([C@H]2CCCCN2C(=O)c2cnc(OCF)cn2)CC1	1825545325	RVNODCFODWZRQH-HZPDHXFCSA-N	428.892	1.615	50	20	IDGD	
CCc1cc(C(=O)N[C@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)no1	1826087653	IHBFIXPHRQQARW-NSHDSACASA-N	434.522	1.292	50	20	IDGD	
CC(C)O[C@H](C)C(=O)N[C@@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1	1826088075	RDWZUKFUMRSUEB-CHWSQXEVSA-N	425.555	1.242	50	20	IDGD	
O=C([C@H](O)N1CCOCC1)N1CCC([C@@H]2CCCCN2C(=O)CCBr)CC1	1826358245	BNNLNKPXFJDPGE-LPHOPBHVSA-N	446.386	1.042	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H](O)c2ccccc2)CC1	1826651773	DSXOXXXEOXDQAG-OFNKIYASSA-N	444.576	1.713	50	20	IDGD	
Cc1nnsc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827059744	USNILSNFZXBJQX-GOSISDBHSA-N	442.350	1.073	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)CCc2cccnc2)CC1	1827218474	RPSCEGCNUXVVLU-HSZRJFAPSA-N	449.360	1.628	50	20	IDGD	
CC(=O)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Cl)CCN2C(=O)OCc1ccccc1	1829053034	WKCYJTOZEHBCRK-OXJNMPFZSA-N	439.871	1.562	50	20	IDGD	
Cc1cccc(/C=C/C(=O)N2CCO[C@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)n1	1829720451	AJFLUQLYLDDLBR-HYGBKTPJSA-N	447.608	1.711	50	20	IDGD	
C[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1)n1ccnc1	1830981374	AFCMXILOQJQDGA-FHLIZLRMSA-N	433.336	1.137	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnoc3COC)C2)C1	1831647071	OXIWENPILZUNMU-HNAYVOBHSA-N	429.901	1.299	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ncccc3C)CCO2)C1	1831842202	RGXCVEWHHAQXMC-DNVCBOLYSA-N	440.338	1.634	50	20	IDGD	
C[C@H](Nc1nccs1)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)CCl)CC2)CC1	1833310312	GODRSICODANVSU-BBRMVZONSA-N	444.001	1.115	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)[C@@H]3CCCN3C)CC2)CC1	1833623654	QQZLQZWGMHPUPR-MSOLQXFVSA-N	443.430	1.826	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(OC)n3)CCO2)C1	1833762447	TVSRTEQXRGNYLB-FOIQADDNSA-N	425.913	1.568	50	20	IDGD	
C[C@H](Cn1cccn1)C(=O)NC1CCN(C2CCN(C(=O)CO[Si](C)(C)C)CC2)CC1	1833889915	HKANGTNNCRXITJ-GOSISDBHSA-N	449.672	1.942	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)CCN(C)C)CC2)CC1	1834614432	CTPHEMOIKZEMFZ-HNNXBMFYSA-N	431.419	1.541	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)[C@@H]3[C@H]4C=CS[C@H]43)C2)C1	1834825477	YIMXLIOHNAQMTE-DNNBLBMLSA-N	431.352	1.103	50	20	IDGD	
COCc1oncc1C(=O)NC1CCN(C2CCN(C(=O)[C@H](Cl)COC)CC2)CC1	1835236836	UBAJMWOETAZPKA-QGZVFWFLSA-N	442.944	1.260	50	20	IDGD	
C[C@@H](C(=O)N1CCC(N2CCC(NC(=O)CO[Si](C)(C)C)CC2)CC1)n1cncn1	1835837939	UMPSYDZCRPGDRY-INIZCTEOSA-N	436.633	1.262	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3[nH]nc4ccncc34)CCO2)C1	1836448036	ZTSYTTGRVGZPSE-FOIQADDNSA-N	435.912	1.435	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnn4ncccc34)CCO2)C1	1836467038	SEBPIVYDGSLYHJ-FQEVSTJZSA-N	435.912	1.064	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(F)nc3)C2)C1	1837715180	BGQHVXKVPOCKBI-LJQANCHMSA-N	425.533	1.142	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4ccnn4c3)C2)C1	1837715749	HUWXQXCLRMPNIN-NRFANRHFSA-N	446.580	1.256	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)c(C)n1C	1838384894	MSMSGVWXLRYVJH-QAPCUYQASA-N	446.317	1.402	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3cc(F)ccn3)C2)C1	1839142750	ZLQXIYDHAOKSDE-FXAWDEMLSA-N	427.904	1.627	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3noc4ccccc34)C2)C1	1839143655	CYONKMJOPQQASR-IERDGZPVSA-N	435.908	1.844	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(C)nc3OC)C2)C1	1839145855	GDGODHLJGOUKKN-OXJNMPFZSA-N	425.913	1.486	50	20	IDGD	
Cc1c(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)cnn1C	1839151181	KGGOTOLSRXLATG-QZTJIDSGSA-N	433.336	1.035	50	20	IDGD	
O=C(c1cccc(-c2cnco2)c1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1	1839365037	WMPFNBYKSRAIIO-UWJYYQICSA-N	449.891	1.011	50	20	IDGD	
N#Cc1ccc(F)c(C(=O)N2CCO[C@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)c1	1839422444	UXUOIXCOSQMEJD-GOSISDBHSA-N	430.263	1.571	50	20	IDGD	
Cn1nc2c(c1C(=O)N1CCO[C@@]3(COCCN(C(=O)C(C)(C)CCl)C3)C1)CCC2	1839581224	DNGOHBVJOYGWEE-NRFANRHFSA-N	438.956	1.244	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)[C@@H](C)CC)C2)C1	1839962552	JXRPWEOJPXINBE-YRBFXIGRSA-N	435.359	1.023	50	20	IDGD	
O=C(c1ccc2[nH]ccc2n1)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840188369	FZZAKFMHWRUHSI-GOSISDBHSA-N	427.288	1.437	50	20	IDGD	
C[C@H](Cc1ccccn1)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1840330735	NNTWQRANCWOKFD-VGSWGCGISA-N	437.968	1.982	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccc(O)cn3)CCO2)C1	1840494846	WLTIQYJBIIUJDO-HXUWFJFHSA-N	425.913	1.051	50	20	IDGD	
CC(C)[C@H](S)C(=O)N1CCCC12CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2	1841626831	FFAFEJOHAQYKGX-IBGZPJMESA-N	447.605	1.490	50	20	IDGD	
COc1ccc(C(=O)N2CC3(CCCN3C(=O)c3cccc(B(O)O)c3)C2)cc1Cl	1843015288	AVQJNXOAQZTHPI-UHFFFAOYSA-N	428.681	1.159	50	20	IDGD	
CC#CC[C@H](C(=O)N1CC2(CCCN2C(=O)c2cnccc2C(=O)NN)C1)c1ccccc1	1844264681	WQJGNQNADZENBQ-IBGZPJMESA-N	445.523	1.699	50	20	IDGD	
C/C=C/C=C\C(=O)N1CC2(CCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)C1	1845039396	LJJVFJRUMYBQIA-JIJKKIFDSA-N	425.533	1.668	50	20	IDGD	
CCOC(=O)c1ncn2c1CC[C@H](C(=O)N1CCCC13CN(C(=O)[C@H](Cl)CC)C3)C2	1845863353	VGKWGVMYEJPCKJ-LSDHHAIUSA-N	436.940	1.843	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(CC(=O)N2CC3(CCCN3C(=O)C(Cl)Cl)C2)CC1	1846389464	RDMIXSNZESULGR-UHFFFAOYSA-N	449.379	1.546	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=O)COc2ccc(C#N)cc2)c1	16006610	LRGQWTDZEPAQTE-UHFFFAOYSA-N	436.877	1.302	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)c2ccc3c(c2)C[C@H](C)N3S(C)(=O)=O)cc1	17161389	ZZDSBJJKVFUYIQ-AWEZNQCLSA-N	445.497	1.324	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2cc(OC)c3c(c2)OCCO3)c2ccccc2c1=O	17163243	HOOASUIGJLBCKN-UHFFFAOYSA-N	438.440	1.661	50	20	IDGD	
COc1ccc(N(C)S(=O)(=O)c2cccc(C(=O)NNC(=O)c3ccccn3)c2)cc1	17328937	TWALFBKWCIPCCK-UHFFFAOYSA-N	440.481	1.990	50	20	IDGD	
CNS(=O)(=O)c1ccc(CCC(=O)NNC(=O)c2cc(Br)c[nH]2)cc1	23914974	DQNHUMMFWFQFIF-UHFFFAOYSA-N	429.296	1.079	50	20	IDGD	
CC(C)(C)NC(=S)NNC(=O)c1ccc(Cl)c(S(=O)(=O)NC[C@H]2CCCO2)c1	28716664	WWXOLOVIILCSLZ-GFCCVEGCSA-N	448.998	1.705	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(N2CCC(C)CC2)c(C(=O)NNC(=O)OC)c1	725897897	LCAJJNZVBQNRSY-UHFFFAOYSA-N	426.539	1.954	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NC3CC(c4ccccc4)C3)nc2)CC1	728400625	UIBKXCUEZVLNOC-UHFFFAOYSA-N	444.561	1.590	50	20	IDGD	
CC(C)N(CC(N)=O)C(=O)/C(C#N)=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	728856966	PXOIWKYZIJEIPM-OQLLNIDSSA-N	442.907	1.708	50	20	IDGD	
CCOc1ccc(/C=C(\C#N)C(=O)N2CCN([C@@H](C)C(=O)NCCCOC)CC2)cc1	728889235	SBRHENQJVGBCJR-CSRGTXSUSA-N	428.533	1.678	50	20	IDGD	
COCCOc1ccc(CNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1	728946897	SSJJINVMJSGKHB-UHFFFAOYSA-N	428.493	1.249	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)c1ccc(SCc2cn3ccccc3n2)cc1	729275745	REUODCKLBVNYOE-CYBMUJFWSA-N	447.542	1.325	50	20	IDGD	
COc1cc(N2C[C@@H](C(=O)NNC(=O)CNc3ccccc3)CC2=O)cc(OC)c1OC	729513986	DRARLFOHSDJFFL-AWEZNQCLSA-N	442.472	1.325	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NCCc2nc(C(C)(C)C)cs2)c2ccccc2c1=O	729622700	VUGDQQRKMRBEDA-UHFFFAOYSA-N	428.518	1.874	50	20	IDGD	
COc1cc(C(=O)NNC(=S)Nc2ccc(N(C)C)cc2)cc(OC)c1OCC(N)=O	729691139	DRGPVMFRPAYEBO-UHFFFAOYSA-N	447.517	1.265	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cc(C(=O)NNC(=O)Cc2cc[nH]n2)ccc1C	730102686	MBZCPSUWHNWUSP-UHFFFAOYSA-N	443.485	1.531	50	20	IDGD	
Cc1ccc([C@@]2(C)NC(=O)N(CC(=O)NNC(=O)c3cccc4ncccc34)C2=O)cc1	730226508	KJNLOLIVBAONJN-HSZRJFAPSA-N	431.452	1.771	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2c[nH]nc2C)c([N+](=O)[O-])cc1OCc1cscn1	732082857	PTPWFQKEUQDJOA-UHFFFAOYSA-N	432.418	1.745	50	20	IDGD	
CC(=NNC(=O)NCc1ccc(Cl)cc1)c1ccc(S(=O)(=O)NCC(=O)O)cc1	732927501	OLVBLFCQGFCSFC-UHFFFAOYSA-N	438.893	1.926	50	20	IDGD	
Cc1cccc(N2C(=O)N[C@@H](CCC(=O)NNC(=O)c3cnn(-c4ccccc4)c3)C2=O)c1	733108239	CBDYMFRAFVBLBZ-IBGZPJMESA-N	446.467	1.847	50	20	IDGD	
CC[C@@H](C#N)Oc1cc(CNC(=O)NNC(=O)CNC(=O)c2ccco2)ccc1OC	733656740	OWBPEBJJPVQOBS-AWEZNQCLSA-N	429.433	1.230	50	20	IDGD	
N#Cc1cccc(OCc2cccc(C(=O)NNC(=O)N[C@H]3CCS(=O)(=O)C3)c2)c1	734428361	POTRHDCJDCIBKX-KRWDZBQOSA-N	428.470	1.268	50	20	IDGD	
CCn1c(NNC(=O)[C@@H](C)CS(=O)(=O)c2ccc(OC)cc2)nc2ccccc2c1=O	735032544	RQNPCIIHVCJDAE-AWEZNQCLSA-N	444.513	1.978	50	20	IDGD	
Cc1cc(NNC(=O)C2CCN(c3ccc4nnc(C(F)(F)F)n4n3)CC2)nc(C)n1	736711930	SONWQFVLVDERBB-UHFFFAOYSA-N	435.414	1.910	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1	738496024	KGABWBVSVFCCOT-UHFFFAOYSA-N	430.480	1.834	50	20	IDGD	
O=C(NNC(=O)c1ccnc(-n2cccn2)c1)c1cccc(S(=O)(=O)N2CCCC2)c1	739473678	XFOOATKZMBXSOM-UHFFFAOYSA-N	440.485	1.127	50	20	IDGD	
CS(=O)(=O)CC[C@H](Cc1cccc(Br)c1)C(=O)NNc1cnccn1	741283678	DLFHGNMASATIFZ-CYBMUJFWSA-N	427.324	1.976	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCN(c2cccc(Cl)c2)C1=O)c1csc(N2CCOCC2)n1	742036310	IPPPOLFNJAONIV-CQSZACIVSA-N	449.920	1.447	50	20	IDGD	
Cc1cccc(NC(=S)NNC(=O)[C@@H](C)NS(=O)(=O)c2c(C)nn(C)c2C)c1C	743297442	RCHXEXQPPACVEW-CYBMUJFWSA-N	438.579	1.338	50	20	IDGD	
CNS(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2cccc(Br)c2)s1	743687368	PHZDVDJLULPJEF-UHFFFAOYSA-N	447.336	1.563	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCCC(=O)NNC(=O)Nc2ccc(N(C)C)cc2)cc1C	743828433	KTCDKERZNCMODT-UHFFFAOYSA-N	433.534	1.891	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccc(F)cc3F)CC2)cc1	744394025	XMZNZWLDXMTERO-UHFFFAOYSA-N	427.411	1.055	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	744403181	MEBVQQJCHDYGBU-ZDUSSCGKSA-N	448.867	1.599	50	20	IDGD	
CC(C)Cn1nc(C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)c2ccccc2c1=O	744560247	MXVQEBYFIUCEHB-UHFFFAOYSA-N	447.451	1.542	50	20	IDGD	
CC[S@](=O)c1ccccc1C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	744620078	BNAQLZMHEQMOFT-NDEPHWFRSA-N	437.543	1.592	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)CNC(=O)[C@H]1c2ccccc2C(=O)N1Cc1ccccc1	745838363	LTADPYJDOSRXEB-OAQYLSRUSA-N	445.479	1.300	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCn2ccnc2C1)c1ccccc1NS(=O)(=O)c1cccs1	747648999	PKJHSHPETFOQHP-CYBMUJFWSA-N	445.526	1.769	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@@H](C(=O)NNC(=O)c3cccc(Cl)n3)C2)cc1	749560168	HAAKUMNPBWPOJT-CQSZACIVSA-N	436.921	1.905	50	20	IDGD	
CC[C@@H](NC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)c1nnc2n1CCCCC2	749581847	KDTWLESDFXZGFC-OAHLLOKOSA-N	449.537	1.895	50	20	IDGD	
CCOc1cc(C=NNC(=O)CNC(=O)c2cccs2)ccc1O[C@H](C)C(=O)N(C)C	750948455	RWEJZHCYYJZFRY-CQSZACIVSA-N	446.529	1.882	50	20	IDGD	
CC[C@H](C)C(=O)N1CCC[C@H](C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)C1	751295517	ZMWODMDVKVOYCM-ZFWWWQNUSA-N	437.566	1.334	50	20	IDGD	
O=C(NNS(=O)(=O)c1cnn([C@@H]2CCOC2)c1)c1ccc(COc2ccccc2)o1	751538848	PNSBCLNCOLIGMB-CQSZACIVSA-N	432.458	1.640	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)c1ccc(C)cc1)C(=O)NNC(=O)c1ccc(C)o1	752781720	XTRWBAMVXIUKRP-OAHLLOKOSA-N	425.532	1.758	50	20	IDGD	
N#Cc1ccc(CN2CC[C@@H](NC(=O)NNC(=O)COc3ccccc3F)C2=O)cc1	753026431	AONQDCLCBFVGPL-QGZVFWFLSA-N	425.420	1.208	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)N[C@H](C)CO[C@@H]2CCOC2)c2ccccc2c1=O	753948656	PSCGLZBOBRTCKC-HZPDHXFCSA-N	445.520	1.725	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)CN2C(=O)N[C@]3(CCc4ccccc43)C2=O)c2ccccc2n1	754778615	YYHVUIBNBNHTMG-DEOSSOPVSA-N	443.463	1.698	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNc2ccc(C(F)(F)F)nn2)sc1Br	755187845	QGDZHCCXNGQYQT-UHFFFAOYSA-N	446.230	1.724	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)Nc2cccc(S(=O)(=O)NC3CC3)c2)cc1	755585458	MLRDHVFHUMKGCL-UHFFFAOYSA-N	429.458	1.231	50	20	IDGD	
C=CCN(C)S(=O)(=O)c1ccc(NC(=O)NNC(=O)COc2ccccc2F)cc1	755934206	ZNMRYBQJRQGWND-UHFFFAOYSA-N	436.465	1.864	50	20	IDGD	
NC(=O)CCNC(=O)c1cccc(NC(=O)NNC(=O)c2cccc(Br)c2)c1	756395733	YYJMWGWJVJRMDD-UHFFFAOYSA-N	448.277	1.521	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)ccc1C(=O)NC(C)C	756484424	XIQNSDYFUWRODK-UHFFFAOYSA-N	439.520	1.993	50	20	IDGD	
O=C(NNC(=O)c1ccc2ccccc2n1)Nc1ccccc1OCC(=O)N1CCOCC1	756872173	CASILTYGKHRARW-UHFFFAOYSA-N	449.467	1.939	50	20	IDGD	
CCc1noc(C)c1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	757771054	NWIAWMCPQWFNLF-UHFFFAOYSA-N	437.478	1.033	50	20	IDGD	
CS(=O)(=O)CCn1cccc(NC(=O)NNC(=O)c2ccc3ccccc3c2)c1=O	757780022	DXUBQXVRKIHJLK-UHFFFAOYSA-N	428.470	1.513	50	20	IDGD	
Cn1c(N)c(C(=O)/C(C#N)=C/c2ccc(OCC(F)(F)F)c(F)c2)c(=O)n(C)c1=O	757919564	LFSZCEOCAOJNIU-BJMVGYQFSA-N	426.326	1.536	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2cc(S(C)(=O)=O)cc(C)c2C)n1	758941496	DGNDXPZXGDJMBZ-UHFFFAOYSA-N	439.515	1.019	50	20	IDGD	
N#Cc1ccc(C(=O)NNS(=O)(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)cc1	760342046	FMPYONZIXWCUMN-UHFFFAOYSA-N	448.526	1.356	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)c1cc(F)c(F)cc1I	760490433	AQXUDKDLJSXEPW-UHFFFAOYSA-N	449.151	1.353	50	20	IDGD	
COCc1nc(OC)c2c(C)c(C(=O)NNC(=O)Cn3cnc4ccccc43)sc2n1	761571509	XTMPJWHQYNEPQY-UHFFFAOYSA-N	440.485	1.966	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)on2)c1	761783770	CFDVBOBEFVMINI-UHFFFAOYSA-N	432.433	1.806	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NN=Cc1cc(Br)cc(Br)c1N	763406993	UDTQLDXHNUYHLU-LURJTMIESA-N	442.133	1.182	50	20	IDGD	
COC(=O)c1cc(Cl)cc(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1	763573851	VCCVGZDGJYACNJ-HNNXBMFYSA-N	433.804	1.053	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1cc(C)n(-c2cccc(F)c2)n1	763627547	BKXIPGGNUSNFSA-UHFFFAOYSA-N	435.419	1.676	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)COc2cc(C)cc(C)c2)c(F)cc1F	763649834	YYFRPVWNZSXRIL-UHFFFAOYSA-N	435.383	1.533	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(F)c(OC(C)C)c(F)c1	763663572	WALDXECNDQPAOO-UHFFFAOYSA-N	437.399	1.926	50	20	IDGD	
COc1cccc(-c2cc(NC(=O)C(=O)NNC(=O)COc3ccc(C#N)cc3)n(C)n2)c1	763673356	CZVPTXMTHYISPA-UHFFFAOYSA-N	448.439	1.132	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)C(=O)Nc1ccc(OCC(F)(F)F)cc1	763678754	IRMFHNJROFCLQZ-UHFFFAOYSA-N	429.326	1.932	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(C(=O)NCC(C)C)cc1	763712499	SXRMDIZBBUTAGT-UHFFFAOYSA-N	440.500	1.800	50	20	IDGD	
COC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)c1	763729398	YIBYZSBXOOZPSB-UHFFFAOYSA-N	425.445	1.404	50	20	IDGD	
O=C(NNC(=O)C12CC3CC(CC(C3)C1)C2)C(=O)Nc1ccccc1CN1CCNC1=O	763735206	NERRPMSUJQJOOJ-UHFFFAOYSA-N	439.516	1.514	50	20	IDGD	
CNC(=O)c1ccc(OC)c(NC(=O)C(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)c1	763735833	TWKJLEQKONRWOI-UHFFFAOYSA-N	428.489	1.357	50	20	IDGD	
CCOC(=O)N(C)c1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)cc1	763866984	SCBJPNLJUKBQON-ZDUSSCGKSA-N	446.435	1.972	50	20	IDGD	
COC(=O)c1cc(OC)ccc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccc(F)cc1	763872179	LGJGIDWAMMJRIH-LLVKDONJSA-N	433.392	1.174	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(C(N)=O)c(Cl)c2)cc1	763878261	OJCPUPLFIZXFNE-LLVKDONJSA-N	446.847	1.195	50	20	IDGD	
CCOC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(OCC)c(OC)c2)cc1	763902263	UHOUVFRUYMIHOH-UHFFFAOYSA-N	429.429	1.670	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)OC)c(F)c2)cc1OC	763910946	IEEJMENFLDKXTK-UHFFFAOYSA-N	447.419	1.809	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)C(=O)Nc1cccc(OCC(=O)N2CCCC2)c1	763919439	SXXUZKPKFJVGRS-UHFFFAOYSA-N	442.447	1.156	50	20	IDGD	
CCN1CCN(c2ccc(NC(=O)C(=O)NNC(=O)Cc3ccc(F)cc3)cc2)CC1	763919690	SBCVRWLYFXNBFD-UHFFFAOYSA-N	427.480	1.296	50	20	IDGD	
CS(=O)(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)Cc2ccc(Cl)cc2)c1	763941840	QQWYDSPLUQGDQH-UHFFFAOYSA-N	444.296	1.726	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)on1)C(=O)Nc1ncn(Cc2ccccc2)n1	764016090	FOYCTNHSFCXGDU-UHFFFAOYSA-N	431.412	1.381	50	20	IDGD	
COC(=O)Cc1ccccc1NC(=O)C(=O)NNC(=O)c1cccc(Br)c1	764059433	VDYKHPFFENPFCX-UHFFFAOYSA-N	434.246	1.564	50	20	IDGD	
CC[C@@H](C)C(=O)NNC(=O)C(=O)Nc1cc(C)nn1[C@H]1CCN(Cc2ccccc2)C1	764087219	YJUZRVWVTXMIGS-QAPCUYQASA-N	426.521	1.771	50	20	IDGD	
COC(=O)CCSCc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(C)cc2O)c1	764105310	PTBLJPHDHBBSHA-UHFFFAOYSA-N	445.497	1.897	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccnn2-c2ccc(Cl)cc2)c1O	764132840	RLEHMIZSZRHQHX-UHFFFAOYSA-N	429.820	1.640	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)[C@H]3Cc4ccccc4O3)cc2)C[C@@H](C)O1	764155227	WZXDRMMYRXJSBF-QEEYODRMSA-N	438.484	1.390	50	20	IDGD	
CC(C)(C)OC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)c(F)c1	764163935	NMWVRLZSWZEQSN-QGZVFWFLSA-N	443.431	1.871	50	20	IDGD	
CN(C)C1CCN(c2ccc(NC(=O)C(=O)NNC(=O)CCc3ccco3)cc2F)CC1	764177487	PJPQHCJUXRRMJF-UHFFFAOYSA-N	445.495	1.668	50	20	IDGD	
COc1ccc(Cn2ncc(C)c2NC(=O)C(=O)NNC(=O)CC(C)(C)C)cc1OC	764199501	UFSZEHBNTPSCNI-UHFFFAOYSA-N	431.493	1.779	50	20	IDGD	
C=CCNC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1	764343466	QWVVLLQJZNHBKY-UHFFFAOYSA-N	447.455	1.580	50	20	IDGD	
C[C@@H]1CCCCN1CCOc1ccccc1C(=O)NNC(=O)CNC(=O)c1cccnc1	764345815	XEUYZABTYFUQPC-QGZVFWFLSA-N	439.516	1.526	50	20	IDGD	
CCN(CC)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)cc1	764349882	TZGJCBAAQGRRAD-UHFFFAOYSA-N	432.864	1.927	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(N3C(=O)c4ccccc4C3=O)c2)o1	764368765	ZAVILZBXVMQFOE-UHFFFAOYSA-N	432.392	1.788	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)C(=O)N1C[C@H](CC(=O)N(C)C)c2cc(Cl)ccc21	764388918	KUOUWJQXIQMCKB-ZDUSSCGKSA-N	443.891	1.413	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(-c2cn3ccsc3n2)cc1	764400602	QSIYTEQYZAYPLM-LBPRGKRZSA-N	431.474	1.200	50	20	IDGD	
CC(C)(C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)cc1	764400705	GQIJFQMXFGPYKC-UHFFFAOYSA-N	444.513	1.799	50	20	IDGD	
COCc1ccc([C@H]2CCCN2C(=O)NNC(=O)c2csc(N3CCOCC3)n2)o1	767296300	JLJYBGZKNBTQSB-OAHLLOKOSA-N	435.506	1.911	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNS(=O)(=O)c2cc(Cl)c(F)c(C(=O)O)c2)c1	767738599	YKWXGVOJLGSASU-UHFFFAOYSA-N	432.813	1.818	50	20	IDGD	
CCOC1CC(CNC(=O)NNC(=O)Nc2ccc(N(C)C)cc2)(N2CCOCC2)C1	767896883	ROGFVSISKBIIEV-UHFFFAOYSA-N	434.541	1.358	50	20	IDGD	
Cc1cc(NC(=O)c2cccc(Cl)c2)ccc1NC(=O)C(=O)NNC(=O)CN(C)C	768240505	XKWWMESGNBCQFV-UHFFFAOYSA-N	431.880	1.548	50	20	IDGD	
CC(C)N(C)S(=O)(=O)c1ccc(F)c(C(=O)NNC(=S)Nc2ccccn2)c1	768584145	LADLVSVMPNJXRU-UHFFFAOYSA-N	425.511	1.881	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)NC2CCN([C@@H]3CCCC[C@H]3O)CC2)cc1	769165517	ZFOALRIJSIDDQF-MAODMQOUSA-N	448.564	1.951	50	20	IDGD	
CS(=O)(=O)c1ccc(C(=O)NNC(=O)Cc2ccc(F)cc2)cc1Br	769613974	HECQSGATEVVQOO-UHFFFAOYSA-N	429.267	1.995	50	20	IDGD	
CCCCn1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c(C)n1	770210155	UJUMQZBKRCFMMM-UHFFFAOYSA-N	449.533	1.087	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)c3nn(Cc4ccccc4)c(=O)c4ccccc34)nc21	770971897	MOKNSZJAOMNVSG-UHFFFAOYSA-N	442.439	1.584	50	20	IDGD	
Cc1cc(F)ccc1-n1cc(O)c(C(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)n1	772887980	DXVSIQJEDYQREV-UHFFFAOYSA-N	445.838	1.756	50	20	IDGD	
Cc1noc(-c2ccccc2)c1NC(=O)C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	773499843	MFCKWAQKXIZBHG-UHFFFAOYSA-N	432.400	1.025	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccc(F)cc1OCC#N	774001911	LIMXIUKGZMKCGW-LLVKDONJSA-N	434.811	1.935	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2cc(C#N)ccc2Cl)cc(OC)c1OC	775251036	FECCQBRBZVEJTF-UHFFFAOYSA-N	425.850	1.861	50	20	IDGD	
N#Cc1ccc(Cl)c(S(=O)(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)c1	775287411	LDCRXKBTMUJTCQ-UHFFFAOYSA-N	427.269	1.491	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@H]1CN(CC(=O)NNC(=O)c2ccccc2Cl)CCO1	775847267	BPCQHBNSRGJKFG-ZDUSSCGKSA-N	426.901	1.327	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)N[C@@H](c1ccc(OC(F)F)cc1)C(F)(F)F	776012844	KEUYFBVLAHWCRF-KOLCDFICSA-N	445.366	1.657	50	20	IDGD	
CCC(CC)n1nc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1C	776427280	DFQJZYLJQDOVSR-GOSISDBHSA-N	430.461	1.697	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)[C@H]2CCCN(C(=O)c3ccc4n[nH]cc4c3)C2)c1	776540833	AKSYJLVVRUCOBN-HNNXBMFYSA-N	441.513	1.962	50	20	IDGD	
COCCO[C@@H]1COCC[C@H]1NC(=O)NNC(=O)c1ccc(OC(C)C)c(OC)c1	776935533	CRDKIFBMERGBEX-CRAIPNDOSA-N	425.482	1.247	50	20	IDGD	
COc1ccc2nc(NNC(=O)C3CCN(c4ccc5nnnn5n4)CC3)c(C)cc2c1	778476819	RXOJPRCBXFVTCJ-UHFFFAOYSA-N	433.476	1.744	50	20	IDGD	
O=C(NNC(=O)c1cnc2ncc(Br)cc2c1)c1ccc(-n2cnnn2)cc1	780173422	ISORAXYKSWGZMY-UHFFFAOYSA-N	439.233	1.443	50	20	IDGD	
O=C(NN=c1cc[nH]cc1)c1cccc(NS(=O)(=O)c2ccc3c(c2)OCCO3)c1	780759267	HNXVPZONCNMLPJ-UHFFFAOYSA-N	426.454	1.832	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)C2CCN(S(=O)(=O)c3cn(C)c(C)n3)CC2)c1	780795994	IFDIOEYHNATLLY-UHFFFAOYSA-N	435.506	1.059	50	20	IDGD	
COc1ccc(NNC(=O)C2CCN(S(=O)(=O)c3ccc(C(C)=O)cc3)CC2)nc1	781519085	NVBDADYSQWWIMH-UHFFFAOYSA-N	432.502	1.837	50	20	IDGD	
Nc1ncc(C=NNC(=O)c2cc(S(=O)(=O)NCc3ccccc3)ccc2O)cn1	781588494	UVWHDKIGIKFETF-UHFFFAOYSA-N	426.458	1.007	50	20	IDGD	
Cn1ncc(NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c1C(F)(F)F	782105279	ZPFZJYMISNYFMR-UHFFFAOYSA-N	439.442	1.804	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C(=O)Nc2ccc(Cc3ccncc3)cc2)nc2ccccc21	782885789	IUWGOASKZJWUBZ-UHFFFAOYSA-N	442.479	1.888	50	20	IDGD	
Cc1nnc(-c2cccc(NC(=O)C(=O)NNC(=O)Cc3nc4ccccc4n3C)c2)n1C	782893282	FOTMMYKHENLCDL-UHFFFAOYSA-N	446.471	1.006	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)nc2ccccc21	782894142	MOXIONFPMYDTDE-UHFFFAOYSA-N	448.483	1.138	50	20	IDGD	
CNS(=O)(=O)c1cccc(NC(=O)C(=O)NNc2ccccc2Br)c1C	782989359	YTWHOKNQORWZQQ-UHFFFAOYSA-N	441.307	1.747	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNc2cncc(Cl)n2)c(OCC(F)(F)F)c1	783259582	FVSGOMMUHGTWDJ-UHFFFAOYSA-N	447.757	1.940	50	20	IDGD	
Cc1ccnc(NNC(=O)C(=O)Nc2ccc(S(=O)(=O)N3C[C@@H](C)O[C@H](C)C3)cc2)c1	783934130	MVIDVPKAOCGOTG-HUUCEWRRSA-N	447.517	1.270	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)C(=O)Nc1cccc(C(=O)c2ccccc2)c1	784004471	OIVUNJFAWVSPOU-UHFFFAOYSA-N	434.408	1.027	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)c2nnn(Cc3noc(C)n3)c2C)cc1OC	784740699	JPVCXTFCZSCCQD-UHFFFAOYSA-N	443.464	1.589	50	20	IDGD	
O=C(NNc1ccc(Br)nc1)C(=O)Nc1ccc(CCN2CCOCC2)cc1	784808996	JWQDZBILJGZVLL-UHFFFAOYSA-N	448.321	1.801	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1ccnn1-c1ccccc1	785340553	YZSXCORRHMUGPR-UHFFFAOYSA-N	429.458	1.366	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1ccc(S(=O)(=O)Nc2ccccc2F)cc1	785422698	PLAJBBCVBCLJSO-LBPRGKRZSA-N	437.449	1.729	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)[C@@H](O)Cc2ccccc2Cl)cc1OC	785730192	ARHVOOIBDNBBKN-HNNXBMFYSA-N	436.848	1.265	50	20	IDGD	
CCS(=O)(=O)CCn1cc(C)c(NC(=O)NNC(=O)[C@H](C)Oc2ccccc2F)n1	786731823	HTXMOQAOIZDCGL-ZDUSSCGKSA-N	441.485	1.386	50	20	IDGD	
Cc1nc(Cn2nnc(C(=O)NNC(=O)Cc3nc(-c4ccccc4)cs3)c2C)no1	786828065	GSNXPNZNIQCQRM-UHFFFAOYSA-N	438.473	1.453	50	20	IDGD	
O=C(NCCOCC(F)F)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	788318282	DZPPVSDGUSPZRI-UHFFFAOYSA-N	448.473	1.775	50	20	IDGD	
CCn1cc(S(=O)(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)nc1C	788914784	FYQXSKXIRQLFEN-UHFFFAOYSA-N	430.531	1.009	50	20	IDGD	
CN(NS(=O)(=O)Cc1cccc(C#N)c1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	788917581	QFLITLHWAGQEQJ-UHFFFAOYSA-N	437.522	1.497	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)ccc1Cl	789729536	AROMFTHJWQQSRG-UHFFFAOYSA-N	437.836	1.774	50	20	IDGD	
CS(=O)(=O)Nc1cc(C(=O)NNC(=O)c2ccc3c(c2)OCO3)cc(C(F)(F)F)c1	792015031	RNCZIPVQNYVEPO-UHFFFAOYSA-N	445.375	1.880	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cnc(CC3CC3)nc2)cc1	793021365	CTMGXMKSMSKXFP-CYBMUJFWSA-N	425.445	1.185	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)c(F)cc1C	793022718	BJWMOROHLCBQPE-QGZVFWFLSA-N	445.403	1.237	50	20	IDGD	
CCc1nc(C(=O)NNc2ccccc2S(=O)(=O)N(C)C)nn1-c1ccccc1F	795169653	SANIXCYLKXHTPJ-UHFFFAOYSA-N	432.481	1.976	50	20	IDGD	
CC(C)(C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1)c1ccccc1[N+](=O)[O-]	796445629	NLRJOBUMPFHSNY-KRWDZBQOSA-N	443.412	1.403	50	20	IDGD	
C[C@@H]1CCN(C(=O)OC(C)(C)C)[C@H](C)[C@H]1NCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	796644376	KNDHIZCOSWEBKS-LBTNJELSSA-N	449.508	1.979	50	20	IDGD	
CC(C)Oc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)cc1C(N)=O	796989496	FQZWUPYVFKYEKB-GFCCVEGCSA-N	446.435	1.265	50	20	IDGD	
CNC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCC3)c(C)c1	796989513	FZUWQGJRBQRWHF-UHFFFAOYSA-N	430.486	1.070	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)c2ccoc2C2(O)CCOCC2)c2ccccc2c1=O	798150456	OGEWRZMWPWINAG-UHFFFAOYSA-N	440.456	1.643	50	20	IDGD	
Cc1cccc(-n2ncc(C(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)c2C(F)(F)F)c1	800521533	VKRDISHQIIXUOP-NSHDSACASA-N	430.408	1.395	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NC[C@H]2CCCC(F)(F)C2)cc1	800718809	NPOBTPPTMQRLTO-AWEZNQCLSA-N	432.493	1.771	50	20	IDGD	
CC(C)[C@@H](NC(=O)c1ccc(Cl)s1)C(=O)NNc1nccc(N2CCOCC2)n1	801633308	YQIVIPMXSPHJMO-OAHLLOKOSA-N	438.941	1.926	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)Nc3ccccc3)CC2)cc1	801987266	ZCBWDOSWLZOWKF-UHFFFAOYSA-N	432.502	1.949	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)NC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1	802332731	OYXCTYWXBKDRAL-HNNXBMFYSA-N	442.497	1.943	50	20	IDGD	
Cc1cc([N+](=O)[O-])ccc1NNC(=O)[C@@H]1CCCC[C@H]1C(=O)N[C@H]1CCS(=O)(=O)C1	805386002	CXQTZOCOBOXQJY-NUEKZKHPSA-N	438.506	1.456	50	20	IDGD	
N#Cc1ccc(NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1Br	806621450	LMWBRZPQRKVUHU-UHFFFAOYSA-N	427.222	1.763	50	20	IDGD	
CNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2ccccc2F)c1Br	806972466	AEXFEVMKKPRLKH-UHFFFAOYSA-N	437.225	1.348	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1cnn(C)c1-c1ccccc1	806975091	NEZKIFSDJKISKW-ZDUSSCGKSA-N	425.420	1.780	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)C(=O)Nc2nc(C3CCOCC3)cs2)c2ccccc21	806975807	PKWONQTUZBQEIJ-UHFFFAOYSA-N	427.486	1.929	50	20	IDGD	
Cc1cc(N2CCCCCC2)ccc1NC(=O)C(=O)NNC(=O)CNC(=O)c1ccco1	807004816	WTOZVMFYINCIQJ-UHFFFAOYSA-N	441.488	1.484	50	20	IDGD	
Cc1cc([N+](=O)[O-])ccc1NNC(=O)C(=O)Nc1ccc(F)c(S(=O)(=O)N(C)C)c1	807457199	VHIWUKRBMQYFOI-UHFFFAOYSA-N	439.425	1.374	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3c(F)ccc(O)c3F)cc2)CC1	809664423	GTOWDJAJNFQLCE-UHFFFAOYSA-N	426.445	1.363	50	20	IDGD	
O=C1CC(C(=O)NNC(=O)C(=O)Nc2ccccn2)(c2cccc(Br)c2)C1	810528621	VQONINZFMBNASB-UHFFFAOYSA-N	431.246	1.231	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)c2ccc(S(=O)(=O)C(F)F)cc2)cc1	812728919	FAYZKKLXDBKOQW-UHFFFAOYSA-N	433.458	1.690	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)CCc2ccccc2O)nnn1Cc1ccccc1F	815569249	LXRLZPQDPUDNGM-UHFFFAOYSA-N	440.435	1.198	50	20	IDGD	
C[C@H](NC(=O)CCC(=O)NNc1ncncc1F)C(=O)c1ccc(Br)cc1	817080379	LYBDJRCKIWTZCB-JTQLQIEISA-N	438.257	1.989	50	20	IDGD	
O=C(CCC(=O)N1CCN(S(=O)(=O)c2ccccc2)CC1)NNc1ccc(F)cc1	832707258	NUZICJXILVLMEQ-UHFFFAOYSA-N	434.493	1.582	50	20	IDGD	
Cc1cc(C)nc(SCc2ccc(C(=O)NNC(=O)CC[C@@H]3NC(=O)NC3=O)cc2)n1	849120458	UMLMMUUEJKFSFB-HNNXBMFYSA-N	442.501	1.135	50	20	IDGD	
O=C(COC(=O)CCNC(=O)c1ccc(Br)cc1)NNC(=O)c1ccccc1	849198692	FJTRNXOCCAQFLL-UHFFFAOYSA-N	448.273	1.573	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)NC2CCN(S(C)(=O)=O)CC2)c(C)n1C[C@H]1CCCO1	913086881	DGJHHTVSLFTOOG-JKALPCAWSA-N	434.562	1.731	50	20	IDGD	
CC(=O)c1cccc(S(=O)(=O)NCC(=O)NNC(=O)c2ccc(C(C)(C)C)cc2)c1	913607239	XEZMPBWBCAIBRX-UHFFFAOYSA-N	431.514	1.926	50	20	IDGD	
CC(=O)Nc1ccc(NC(=S)NNC(=O)c2sc(N3CCOCC3)nc2C)cc1	915117715	WVHPQPJKRKHUAS-UHFFFAOYSA-N	434.547	1.878	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccc(C(=O)OCC(=O)NNC(=O)c2cccs2)o1	915415885	OTJIBSQFSNNGHR-UHFFFAOYSA-N	429.476	1.036	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)[C@H](C)N1C(=O)[C@H]2CCCC[C@@H]2C1=O	915775736	NWXYBBZXCSKOPJ-KKUMJFAQSA-N	425.489	1.310	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)CNS(=O)(=O)c1ccc(Cl)cc1	915789156	SPRNALCXGSZBHM-NSHDSACASA-N	429.857	1.372	50	20	IDGD	
O=C(NC[C@H]1CCCO1)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	915879536	REAVLIDGPIUNEO-QGZVFWFLSA-N	432.502	1.288	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NC[C@@H](c2ccco2)N2CCCC2)c2ccccc2c1=O	915896910	PUUYHJUYUKGSAC-KRWDZBQOSA-N	438.488	1.791	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@H](c2cccs2)N2CCCC2)c1	915902236	VGORAIHJWZOBJK-MRXNPFEDSA-N	436.559	1.933	50	20	IDGD	
O=C(NCc1cn2ccccc2n1)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	915910167	SBATWVOMAHLDPV-UHFFFAOYSA-N	442.501	1.263	50	20	IDGD	
CCCN1C(=O)C(=NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)c2ccccc21	916278058	AAPYAKCAQWKQLX-UHFFFAOYSA-N	428.514	1.893	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)NNC(=O)NCCNS(=O)(=O)c1cccc(Cl)c1	916295082	HXEWFNDYRAKGHQ-UHFFFAOYSA-N	449.920	1.673	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)N1CCC[C@@H](C)C1	916450121	CMTUHGPQBWQBFU-UXHICEINSA-N	430.597	1.650	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)N[C@H](CN2CCCC2)c2ccccc2)c2ccccc2c1=O	916466159	FKDNQNRLQQCGOZ-LJQANCHMSA-N	434.500	1.715	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)N[C@@H](c2ccc3c(c2)OCCO3)C2CC2)c2ccccc2c1=O	918139944	NGWSCIKQVDORBQ-LJQANCHMSA-N	449.467	1.800	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)n(-c2ccccc2)n1)N[C@@H]1CCS(=O)(=O)C1	919884895	ICDWQVCRTGPOSR-MRXNPFEDSA-N	439.497	1.670	50	20	IDGD	
CS(=O)(=O)N1CCC[C@H](NC(=O)NNC(=O)c2cc3c(s2)CCCCCC3)C1	920240468	UQCOJYOIYQLUMY-AWEZNQCLSA-N	428.580	1.775	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@H](C(C)C)N2C[C@H](C)O[C@H](C)C2)c2ccccc2c1=O	920275594	FMUQDZWPQHMCTH-KHYOSLBOSA-N	429.521	1.311	50	20	IDGD	
CCOCCOc1ccc(Br)cc1C=NNC(=O)N[C@H]1CCS(=O)(=O)C1	921259501	APTYKOSHEOQTRP-AWEZNQCLSA-N	448.339	1.685	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@@H](Cc2ccccc2)NC(=O)c2cccnc2)cc1OC	921299131	IDEHCLDTPLMZMB-LJQANCHMSA-N	448.479	1.901	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)c1cn(-c2ccc(Br)cc2)nn1	1318190846	LQOFNJTXHSASHI-UHFFFAOYSA-N	449.290	1.282	50	20	IDGD	
O=C(COc1ccccc1O)NNS(=O)(=O)Cc1ccc(Br)cc1F	1318312583	RBOFJULKODPXMG-UHFFFAOYSA-N	433.255	1.823	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2n[nH]c3c2CCCC3)ccc1NS(=O)(=O)C(F)(F)F	1323464879	GEYKXGXMIATHAI-UHFFFAOYSA-N	445.423	1.933	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3n[nH]c4c3CC[C@H]4C)C2)C1	1777854017	HIJVTQBUISEGIY-FTLABTOESA-N	425.327	1.686	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CC1CC1)C2	1778091397	OLUYNGAIPSVKRK-UYVYXKLWSA-N	429.521	1.434	50	20	IDGD	
CC(=O)NC(C)(C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@](C)(Cl)CCl)C1	1780708005	ZWGRQKNSSMRLHU-NIKGAXFTSA-N	436.380	1.651	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)nc2nccn12	1781234125	IQYIRQLWWLMDNM-OALUTQOASA-N	440.331	1.718	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)n1cncn1)C2	1782002910	WXHFTPDSXPDACW-ZOMKSWQUSA-N	428.331	1.136	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)c3cccc4ccoc34)C2)C1	1782447908	IEXCVRDCVJTLPD-QHCPKHFHSA-N	449.467	1.189	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H]3CC(c4ccccc4)=NN3)C2)C1	1782606665	OASHWOPSYYBMNR-NQYLQCIDSA-N	449.349	1.366	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)C(=O)c3cccn3C)CCO2)C1	1783354532	STVKDSYZPDFZLR-ACJLOTCBSA-N	426.311	1.211	50	20	IDGD	
O=C(/C=C/c1cc(F)c(F)c(F)c1)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1783716815	VAWSVFCYTYECCK-RJIWVICYSA-N	432.826	1.547	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)COc3ccc(OC)cc3)[C@H]2C1	1783779806	JVCKBBXIOFDTNK-FZDIXFNVSA-N	440.924	1.308	50	20	IDGD	
COCCn1nccc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(C)(C)CCl)[C@H]2C1	1783849854	LOOVSRKECUOZDN-ZOBUZTSGSA-N	426.945	1.388	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(C)(C)CNC(C)=O)[C@H]2C1	1784645209	KASLJJKJCBWSOI-JONQDZQNSA-N	446.386	1.302	50	20	IDGD	
C#CCCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)CCO2	1785424034	OUAYKWIXAAPBQB-NRFANRHFSA-N	429.429	1.377	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3nccnc3OC)[C@H]2C1	1785652300	QADRNLPBMCPXMT-FQUUOJAGSA-N	441.326	1.252	50	20	IDGD	
Cc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Br)C[C@@H]32)nc1C	1785771179	GBMAMUYZVFYXBN-SDADXPQNSA-N	428.302	1.982	50	20	IDGD	
CC(C)n1cnc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)Br)C[C@@H]32)n1	1787671849	PQBVFFZDBGQNRQ-RFGFWPKPSA-N	428.331	1.236	50	20	IDGD	
Cc1cc(C(=O)NC2(c3ccc(NC(=O)c4cccc(B(O)O)c4)cc3)CCC2)cc(O)n1	1788143934	XDOJNSCTEROTFV-UHFFFAOYSA-N	445.284	1.837	50	20	IDGD	
O=C(CN1CCS(=O)(=O)CC1)NC1(c2ccc(NC(=O)[C@H](F)Cl)cc2)CCC1	1788582564	OCZKZIFSSGZSJW-INIZCTEOSA-N	431.917	1.385	50	20	IDGD	
CC(C)(C)n1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]3C2)nn1	1788763295	GRMXQJOJIVJLDL-ZOBUZTSGSA-N	437.617	1.478	50	20	IDGD	
NC[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]2C1)c1ccccc1	1789923089	XVYAWOCSYSQMGQ-WOYTXXSLSA-N	442.329	1.399	50	20	IDGD	
COc1ccc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Cl)C[C@@H]32)c([N+](=O)[O-])c1	1789965796	WWMUBDAECRKCFK-GKEYINFOSA-N	443.859	1.660	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cccc([N+](=O)[O-])c3)C[C@@H]21	1791251071	UJTJZXIALUWXFJ-OWLYRPNTSA-N	439.896	1.371	50	20	IDGD	
Cc1ccn(CC(=O)NC2(c3ccc(NC(=O)CCC(=O)NN(C)C)cc3)CCC2)n1	1791599218	AIUKHPZRPHGDML-UHFFFAOYSA-N	426.521	1.699	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1ccc(C2(NC(=O)CN3CCCCC3=O)CCC2)cc1	1791602383	BQXBGDVXEHAYLL-UHFFFAOYSA-N	443.548	1.506	50	20	IDGD	
Cc1cc(C)c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]32)c(C)c1	1791933877	LJYFPEOJACSTFD-UFYCRDLUSA-N	444.576	1.578	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(F)cc(F)c3F)[C@H]2C1	1791994998	ADENVFJKBHTODH-CFMVVWHZSA-N	434.842	1.951	50	20	IDGD	
O=C(CCOc1ccc(F)cc1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2	1792734042	RZBNUAGNQXPKIP-CZAMWMTLSA-N	447.276	1.875	50	20	IDGD	
Cc1cccc(C)c1SCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](O)CCl	1792981261	RZEOQDXNZFELEK-DFGXFYAUSA-N	426.966	1.585	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1c(F)c(C)nn1C	1794497324	YCNLHWNUMKCAMH-OPDFLTKYSA-N	431.306	1.244	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccncc1C(F)(F)F	1796625758	WZALQFXFECJYKP-JLUCKKNBSA-N	435.830	1.557	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2nc(CO)[nH]c2c1	1796868908	KFBXVMCFUFRUQD-YGTYGHESSA-N	434.924	1.666	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2c(c1)NC(=O)CO2	1797450793	WPQAUVZZMKRPGV-YVWYUNDQSA-N	447.564	1.072	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/C1CC1)C2	1798521527	MWYAWTVYZPKECZ-CPVVTZALSA-N	443.456	1.690	50	20	IDGD	
C[C@H]1CCc2c(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@](C)(Cl)CCl)n[nH]c21	1799275331	PQYGRVKMBRACRU-MVNYESKYSA-N	429.348	1.899	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(C#N)cc1Cl	1799752403	RDVAAJCPMLLMDE-RMHZUWNSSA-N	426.300	1.669	50	20	IDGD	
CCO/C=C/C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN(C)NC(=O)NCc1ccccc1	1799869420	OCFMWPQGLOOMSE-PODJEOQNSA-N	443.548	1.521	50	20	IDGD	
CC[C@H](NC)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C#N)=C/c1ccc(F)cc1F	1800332982	JTNYOXZMFHFGAP-DRZPZYELSA-N	432.471	1.459	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnco1)C2)[C@@H](Br)Cc1ccccc1	1800435595	KVWUQZUXXZSVCM-DFGXFYAUSA-N	448.317	1.884	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(C#N)cc1Cl)C2	1800977003	FOPJJIWCXIUDNC-DLTLXFJOSA-N	426.300	1.669	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1n[nH]c3c(F)cccc13)C2	1802337790	SEOKNWBMPMGIHH-BTTYYORXSA-N	430.484	1.327	50	20	IDGD	
Cn1cccc(C(=O)N2CC[C@H](CNC(=O)CCBr)[C@@H]2c2cccnc2)c1=O	1806343132	SZXFYTQRUNMVOY-QAPCUYQASA-N	447.333	1.885	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC2(CCCN(C(=O)CN3CCS(=O)(=O)CC3)C2)CC1	1806700238	MUVAPYOMZYOMKJ-KRWDZBQOSA-N	448.029	1.356	50	20	IDGD	
CC(=O)NCCC(=O)N1CC[C@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]1c1cccnc1	1808318309	UQAMMKRTJJCDKA-SUMDDJOVSA-N	429.348	1.850	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@@H]1c1cccnc1)[C@H](F)Cl	1808319006	KLQHOWXAOZWWOE-GLQYFDAESA-N	444.941	1.482	50	20	IDGD	
O=C(O)CSCC(=O)N1CC[C@H](CNC(=O)[C@H](F)Br)[C@@H]1c1cccnc1	1808677980	DZKRDOKEEKVPDG-UGFHNGPFSA-N	448.314	1.596	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)c2c[nH]c(=O)cn2)[C@@H]1c1cccnc1	1811458033	FJTPXWTXYCRCJH-ZQIUZPCESA-N	448.321	1.658	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@H](CNC(=O)Cn2ccncc2=O)[C@H]1c1cccnc1	1812342737	BRMCYQWQEFOYNY-LAUBAEHRSA-N	443.580	1.196	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)CSC(=N)N)[C@H]1c1cccnc1	1812865685	ZFEHSWDUJXUZOI-JKOKRWQUSA-N	428.356	1.497	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)Cn2nc(C)cc2C)[C@H]1c1cccnc1	1813028217	LFIZQJKODHKCRJ-HBFSDRIKSA-N	433.940	1.855	50	20	IDGD	
CCc1ccnc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)c1	1817471090	DSSQDFJTFDJLFT-HXUWFJFHSA-N	447.304	1.667	50	20	IDGD	
Cc1cc(C(=O)NCC(=O)N2CCCC[C@@H]2c2cc(NC(=O)[C@@H](F)Cl)n[nH]2)no1	1818039409	BDWYVMWYLQHFJW-IUODEOHRSA-N	426.836	1.663	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CC2(O)CCC2)[nH]n1	1819404753	XBQWRAATQQVTKW-INIZCTEOSA-N	441.492	1.019	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1	1819801082	YLQFDAOJKVODCU-JOYOIKCWSA-N	436.925	1.385	50	20	IDGD	
O=C(N[C@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1)c1cc(CO)on1	1823006415	FGBFNMMIQUAGHD-UPONEAKYSA-N	433.259	1.540	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cn(C)nc1OC)CC2	1825994447	ULTFQFMPEWUWEY-KOLCDFICSA-N	427.914	1.365	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc3ncnn3c1)CC2	1825999627	AWNUZOQQARCJOJ-NWDGAFQWSA-N	434.909	1.665	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)C#Cc2ccccc2)CC1	1826523161	KOGPAWVLUZPQFW-DEOSSOPVSA-N	444.340	1.651	50	20	IDGD	
N=C1NCCN1CC(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H](F)Br)CC1	1826874370	NAEHVFUIEDZYHD-UKRRQHHQSA-N	432.338	1.137	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CCCCO1)CCO2	1829926869	UDIVGOGYWKKPKC-HDMKZQKVSA-N	433.343	1.185	50	20	IDGD	
O=C(CN1CCOC1=O)N1CCC([C@H]2CCCCN2C(=O)[C@H](F)Br)CC1	1830376232	KSHTZHDFQXHMAZ-HIFRSBDPSA-N	434.306	1.749	50	20	IDGD	
COC(=O)[C@@H]1CC[C@@H](C(=O)N2CCO[C@@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)C1	1830704932	CJIMIQHFDVGWAY-ZOCZFRKYSA-N	444.956	1.297	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccn4cncc4c3)C2)C1	1831649704	AIKTWFMGBNXACE-GHTZIAJQSA-N	434.924	1.812	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)CCC(=O)N3CCCC3)CCO2)C1	1832419776	SCDLYTWNVQCZDO-NRFANRHFSA-N	443.972	1.110	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)cnc1C	1833299852	TUKQAGUOTJAPNM-QAPCUYQASA-N	444.301	1.459	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)CSC3CCCC3)CC2)CC1)[C@H](O)CCl	1833306482	TYXFTDWZTBDFCZ-GOSISDBHSA-N	432.030	1.834	50	20	IDGD	
Cc1nc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@](C)(Cl)CCl)C3)C2)ccc1F	1833466329	YJONDADDQFBGCS-RTBURBONSA-N	448.322	1.835	50	20	IDGD	
Cc1cc(C(=O)NC2CCN(C3CCN(C(=O)CO[Si](C)(C)C)CC3)CC2)nn1C	1834173523	CATFXMZLZKIYIC-UHFFFAOYSA-N	435.645	1.765	50	20	IDGD	
COCCOCC(=O)NC1CCN(C2CCN(C(=O)[C@H](C)CBr)CC2)CC1	1834565391	RAHJANSKWQGPNB-OAHLLOKOSA-N	448.402	1.252	50	20	IDGD	
CC[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](Cl)COC)C2)C1)c1ccccc1	1834754320	MNJBFEUFPXNZRV-CNNODRBYSA-N	438.952	1.890	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)CCc3cnn(C)c3)CC2)CC1	1834821529	PQLKHUQGWHLDTI-LJQANCHMSA-N	439.988	1.178	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3cccnc3)CCO2)C1	1836162722	XVIXWZYNEQMILE-VQIMIIECSA-N	440.338	1.254	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)c3csnn3)CC2)CC1	1836945174	OPWUGRZOYWIHDA-NSHDSACASA-N	431.356	1.934	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCC(OC2CCN(C(=O)CCn3ccnn3)CC2)CC1	1838638119	PZPFEGJLHCJCNS-IBGZPJMESA-N	446.379	1.903	50	20	IDGD	
Cc1noc(C)c1CC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2	1839150653	SSVKCNULSYXGIQ-OALUTQOASA-N	448.347	1.527	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccccn3)C2)C1	1839964622	XMUPDGDFBMORTE-LPHOPBHVSA-N	440.338	1.254	50	20	IDGD	
COc1cscc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2	1840032925	NPKKINFKLMRBBM-SJKOYZFVSA-N	447.351	1.610	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(F)(F)Cl)CCO2	1840283212	QEAGSQNSNORKKG-GWCFXTLKSA-N	433.677	1.305	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCCn3ccnc3)CCO2)C1	1840383267	NWWDLWLGNJIMLF-YLJYHZDGSA-N	426.945	1.527	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)c2nc(-c3ccccc3)ns2)C1	1843119309	DCGDDEYYHRITDW-UHFFFAOYSA-N	448.313	1.016	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)CS[C@H]1CCCCO1)C2	1843416165	HSBWXEACZDKEFV-FSTGKYBXSA-N	447.561	1.584	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@H]1CN(C(=O)OC(C)(C)C)C[C@H]1O)C2	1845166232	ITEZGFNCKVWQDS-SOUVJXGZSA-N	429.945	1.435	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)c1ccc(C(=O)OC)cc1[N+](=O)[O-])C2	1846363861	IIYHYHQSJRHWJV-AWEZNQCLSA-N	439.852	1.452	50	20	IDGD	
C#CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)CCBr)C2	1847071750	VIWAKGOIRIJSDO-AWEZNQCLSA-N	442.354	1.891	50	20	IDGD	
O=C([C@H](O)CCl)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](Br)Cc1ccccc1	1847564336	YKQROJIZUWPFNI-YHUYYLMFSA-N	429.742	1.794	50	20	IDGD	
CC(C)(C)OC(=O)N1CCCC[C@@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](O)CCl)C1	1847568197	FJLWTEYMGITKIT-QZWWFDLISA-N	443.972	1.825	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)C1CCC(CO)CC1	1848082358	WZZKDVHUBZTLJM-JWFPNHEVSA-N	429.521	1.121	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C[C@@H](NC(N)=O)c2cccs2)c2ccccc2c1=O	14044400	ZHSGMGYMKHJIOC-CYBMUJFWSA-N	428.474	1.039	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2ccc(C(=O)NNC(=S)NC(C)(C)C)cc2)C[C@H](C)O1	14894874	GHDOBFDJMKZBNG-STQMWFEESA-N	428.580	1.392	50	20	IDGD	
C[C@@H]1CC(C)(C)C[C@]2(C1)NC(=O)N(CC(=O)OCC(=O)NNC(=O)c1ccccc1)C2=O	22208579	NHMASVQBISNZDC-PEBXRYMYSA-N	444.488	1.128	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CNC(=O)c2cccc([N+](=O)[O-])c2)ccc1OC(C)C	27237490	MCYUDXBIYUIYDB-UHFFFAOYSA-N	430.417	1.582	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)Cc2coc(-c3ccccc3)n2)cc1OC	57727222	GJODQEJOFMMUBK-UHFFFAOYSA-N	439.424	1.906	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)CC(C1CC1)C1CC1	109170459	VBUUTERRDMFYPV-UHFFFAOYSA-N	449.573	1.614	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)CN2C(=O)[C@@H](C)Oc3ccccc32)cc1	115402102	QDXSDONXXLVKLU-HUUCEWRRSA-N	427.457	1.814	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(-n3cnnc3)cc2)c1	116609784	YSNSHCAYNQKFNR-UHFFFAOYSA-N	442.501	1.373	50	20	IDGD	
C[C@H](C(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1)N1CCN(C)CC1	725895200	VPPWTYGXHUAANG-AUSIDOKSSA-N	435.572	1.397	50	20	IDGD	
Cc1ccc(NC(=S)NNC(=O)CN(C)C2=NS(=O)(=O)c3ccccc32)c(C)c1	725906795	CHOUXDJBOUEDKK-UHFFFAOYSA-N	431.543	1.702	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)NC[C@@H](c1cccc(Cl)c1)N1CCCC1	726092071	DCRZZMHRBICGFA-INIZCTEOSA-N	433.896	1.830	50	20	IDGD	
CNS(=O)(=O)c1cccc([C@H](C)NC(=O)NNC(=O)COc2cc(C)cc(C)c2)c1	727608565	AFLYNRSCICVGEI-HNNXBMFYSA-N	434.518	1.682	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)[C@@H]1C[C@@H](O)CN1C(=O)OCc1ccccc1	727766628	ZKWHDBUHDPTDPN-KYJSFNMBSA-N	445.447	1.512	50	20	IDGD	
O=C(CCC/N=C1/NS(=O)(=O)c2ccccc21)NNc1nc(-c2ccccc2)no1	728080469	PPIKNNQRLMLVTR-UHFFFAOYSA-N	426.458	1.699	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(CCC(=O)N([C@@H]2CCS(=O)(=O)C2)N(C)C)cc1	728177578	DKHWJBJSTANWDJ-QGZVFWFLSA-N	445.607	1.142	50	20	IDGD	
O=C(COC(=O)c1ccn(-c2ccccc2F)n1)NNC(=O)[C@H]1COc2ccccc2O1	728326691	FRYFZQFVQBVGOG-GOSISDBHSA-N	440.387	1.156	50	20	IDGD	
O=C(CSc1nnc(-c2cccs2)n1C1CC1)NNC(=O)[C@@H]1CCS(=O)(=O)C1	728460973	PFOHUZHUHALJMP-SNVBAGLBSA-N	441.560	1.016	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)[C@@H](C(C)C)S(=O)(=O)C1CCCCC1	729297649	CFXICZMHCSXQMP-LJQANCHMSA-N	426.535	1.994	50	20	IDGD	
O=C(CC(F)(F)F)NNC(=O)CC1(CC(=O)NNC(=O)CC(F)(F)F)CCCC1	729861821	XPCWTQDHODYSBV-UHFFFAOYSA-N	434.337	1.527	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc(F)c(F)c1)NNC(=O)CCc1ccccc1O	730034262	FVKGAUWUAOCNGO-UHFFFAOYSA-N	427.429	1.119	50	20	IDGD	
COc1ccc(CNC(C)=O)cc1S(=O)(=O)NNC(=O)c1cccc2ncccc12	730203579	FBCRSYOXQJVEBI-UHFFFAOYSA-N	428.470	1.503	50	20	IDGD	
COc1ccc(C(=O)CNC(=O)CCC(=O)NNC(=O)c2cccc3ncccc23)cc1	730226472	NBEMEIQOGLLROH-UHFFFAOYSA-N	434.452	1.784	50	20	IDGD	
C[C@@H]1CCCN(S(=O)(=O)c2cc(C(=O)NNc3nc(-c4ccncc4)no3)n(C)c2)C1	730283444	YCCFERPBOHDOMP-CYBMUJFWSA-N	445.505	1.648	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)Cc1csc(NC(=O)c2cccs2)n1	730778326	GGDXWEKFHMFTPX-UHFFFAOYSA-N	432.483	1.931	50	20	IDGD	
O=C(CCCCC/N=C1/NS(=O)(=O)c2ccccc21)NNC(=O)Cc1ccccc1F	731344356	HMJDGVPVCAJIQB-UHFFFAOYSA-N	446.504	1.815	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NCCc1nc(-c2ccc(Cl)cc2)no1	731683665	WFIBGXGGDOFHDH-UHFFFAOYSA-N	448.892	1.754	50	20	IDGD	
O=C(CCSc1ccc(F)cc1)NNC(=O)NCCS(=O)(=O)NCC1CCC1	731760997	MHQSPAAOQOVUHZ-UHFFFAOYSA-N	432.543	1.358	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@H](C(=O)NNc2ccccc2S(C)(=O)=O)C(C)C)cc1	732301564	DILCPBHCBORHHS-SFHVURJKSA-N	439.559	1.845	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)N[C@@H](Cc2ccccc2)CN2CCOCC2)c1	732476756	VNOGTNUBHHCPLA-IBGZPJMESA-N	442.516	1.591	50	20	IDGD	
CC(C)OCCCn1c(NNC(=O)c2ccc(S(C)(=O)=O)o2)nc2ccccc2c1=O	733265958	NVDOMZPSIGLSAH-UHFFFAOYSA-N	448.501	1.965	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)Cn2cc(Br)cn2)CC1	734825409	DXSBULHYUZLHMV-UHFFFAOYSA-N	445.318	1.376	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)CCCCN2CCOCC2)CC1	734825634	KHFVIUODUWZNRE-UHFFFAOYSA-N	427.546	1.219	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)Cc1ccc([N+](=O)[O-])cc1Cl	735461511	GDORUCHCXTXGNQ-UHFFFAOYSA-N	439.881	1.853	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN2CCN(c3ccc([N+](=O)[O-])nc3)CC2)cc1C	736308306	LBYZQJNWOHZPLM-UHFFFAOYSA-N	432.506	1.505	50	20	IDGD	
O=C(NCc1cc(F)ccc1N1CCOCC1)NNC(=O)c1cnn(-c2ccccc2)c1	740915057	JTLSHWNCDVZOKF-UHFFFAOYSA-N	438.463	1.992	50	20	IDGD	
CCS(=O)(=O)NCCNC(=O)NNC(=O)Nc1ccc(Br)cc1Cl	743591037	FDKBTJUDAQETLL-UHFFFAOYSA-N	442.723	1.378	50	20	IDGD	
COc1cc(C#N)ccc1OCC(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	744621002	KREVREIGNJRAGH-UHFFFAOYSA-N	446.485	1.110	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1c[nH]c2ccccc2c1=O	744621079	NTKUXUNXOILSRP-UHFFFAOYSA-N	428.470	1.306	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1nnc(O)c2ccccc12	745883501	JCLHBOPUTVDHAT-UHFFFAOYSA-N	430.804	1.615	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2noc(-c3cccc(F)c3)n2)cc1	746093131	CNECYYBTMMSUPW-UHFFFAOYSA-N	447.448	1.266	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)NNC(=O)c2ccc(OC(C)C)c(OC)c2)o1	748639365	AWBDORQUVYXAOC-UHFFFAOYSA-N	426.447	1.875	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2ccc(NC(C)=O)c(Cl)c2)cc1OC	748640640	XFALCROGLKLBGR-UHFFFAOYSA-N	427.866	1.939	50	20	IDGD	
COC(=O)c1cc(OC)c(S(=O)(=O)NNC(=O)c2nnc(-c3ccccc3)o2)s1	749012609	QSDKDTZNZDEZPS-UHFFFAOYSA-N	438.443	1.217	50	20	IDGD	
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	749583572	MSMYRTSLDIJAJE-OXQOHEQNSA-N	434.504	1.517	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)c1ccccc1F)C(=O)NNC(=O)CC1CCCC1	749952192	JLWPEOIWAUIHJI-OAHLLOKOSA-N	431.555	1.953	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)c1ccc2c(c1)C[C@H](c1ccccc1)OC2=O	751204958	TVKRNKGZVIWGJS-LJQANCHMSA-N	433.420	1.925	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)NCCNS(=O)(=O)c1ccc(Cl)s1	752171929	ZICSHGONGUSELA-UHFFFAOYSA-N	432.911	1.333	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCO[C@@]3(CCc4ccccc43)C2)cc1OC	753274617	KKZXDFLXABIGSX-QHCPKHFHSA-N	425.485	1.639	50	20	IDGD	
C[C@H](CCNC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)N1CCCCC1	753419711	MIXYXZSSYLDTLB-HXUWFJFHSA-N	430.597	1.794	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2ccc(C)c([N+](=O)[O-])c2)cc1	755338347	YDWFDJSNMCYJJZ-UHFFFAOYSA-N	435.462	1.685	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCCCC2)cc1NC(=O)NNC(=O)c1cc(C)[nH]n1	755410753	FMNJOVFNZYHSKG-UHFFFAOYSA-N	436.494	1.368	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)Nc2cc(C)nn2[C@@H]2CCS(=O)(=O)C2)c2ccccc2n1	755537774	YIJGTUHJLIMQMM-CQSZACIVSA-N	442.501	1.874	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)N2CCN([C@@H](C)C(=O)N3CCCC3)CC2)c1C	755727841	KYRUXUHKGKLQFW-OFXNXBLFSA-N	441.576	1.813	50	20	IDGD	
COc1ccc(Br)c(NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c1	756294989	JVRYXDVDYRXUFU-UHFFFAOYSA-N	432.238	1.900	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1ccc(Br)cc1C(F)(F)F	758054063	NGAZJBXYGQWBAG-LURJTMIESA-N	432.218	1.167	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)NCCC(=O)NNc2nc(O)c3ccccc3n2)cc1	758299397	JKPHJVSXFUVIDH-UHFFFAOYSA-N	429.458	1.350	50	20	IDGD	
O=C(NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)NNC(=O)c1c[nH]c2ccccc12	758691976	CULNNQFRHDQMTH-UHFFFAOYSA-N	431.430	1.494	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccc(Br)cc2)c1)C(=O)Nc1ccccn1	758833131	DWJPLBQTSHEFBT-UHFFFAOYSA-N	429.234	1.430	50	20	IDGD	
CN1C(=O)CCc2cc(C(=O)NNC(=O)NC3CCN(C(=O)OC(C)(C)C)CC3)ccc21	759122583	WZBVENPVJMSWOA-UHFFFAOYSA-N	445.520	1.939	50	20	IDGD	
O=C(NC[C@H]1CN(Cc2ccccc2)CCCO1)NNC(=O)[C@@H]1COc2ccccc2O1	759233498	UUNPRLZITBHTQT-RXVVDRJESA-N	440.500	1.448	50	20	IDGD	
CCNS(=O)(=O)c1ccc(CC(=O)NNC(=O)c2cccc(Br)c2)cc1	759385406	FYPQBSOTBXQXOQ-UHFFFAOYSA-N	440.319	1.751	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)c3ccnc(O)c3)c2)cc1	760223670	IYGLKXMRMRPJLH-UHFFFAOYSA-N	442.453	1.671	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)[C@@H]2CN(C(=O)OC(C)(C)C)CCC2(F)F)C[C@@H](C)O1	760787637	LNNCNCKPIAVKMO-KFWWJZLASA-N	448.511	1.525	50	20	IDGD	
Cc1nn(CC(F)F)c(C)c1C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	760800031	KZVNPKBPDBTINL-UHFFFAOYSA-N	429.449	1.090	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)ccc1C(=O)NC(C)C	763471060	CDUYUZLRSYFXGY-UHFFFAOYSA-N	427.417	1.441	50	20	IDGD	
COC(=O)CCSc1cccc(NC(=O)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c1	763472103	TTZCPUVHDUNWTK-UHFFFAOYSA-N	446.441	1.650	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cccc(-n3nnnc3C)c2)c2ccccc2n1	763615257	MKRFXRKXBQZNPE-UHFFFAOYSA-N	430.428	1.227	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2Cc2ccccc2)cn(C)c1=O	763719083	UVSFQCLPXNKQCD-UHFFFAOYSA-N	448.479	1.449	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)C2=S=C3CCCC3=C2)n([C@H]2C[C@H]3CC[C@H]2C3)n1	763780630	CDDPBWGPVUXJRJ-YDHLFZDLSA-N	427.530	1.840	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2ccc(Cl)cc2F)c2ccccc2c1=O	763785112	FJQWTDAPJBCFKN-UHFFFAOYSA-N	431.811	1.609	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cc3c(cc2F)CCC(=O)N3)c1C	763850726	PBOQBEJCLAFLQS-CYBMUJFWSA-N	442.447	1.881	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccc([S@](C)=O)c(F)c1	763865556	LJVZNUSTYXSPCB-UIHBWLLHSA-N	425.413	1.256	50	20	IDGD	
Cc1csc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(Br)c2)n1	763882525	JRLYNVQKGCNVEA-SECBINFHSA-N	427.280	1.767	50	20	IDGD	
CC(C)COc1ccc(NC(=O)C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cn1	763945454	YESKYUDOJYKLPF-UHFFFAOYSA-N	438.444	1.407	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccc(N2C[C@@H](C)O[C@H](C)C2)cc1	764131634	JTJSZUNOWNRSBN-HZPDHXFCSA-N	440.500	1.637	50	20	IDGD	
O=C(CC1CC1)NNC(=O)C(=O)Nc1ccc(NC(=O)CN2CCCCCCC2)cc1	764142739	JUVFWPQRTONXPK-UHFFFAOYSA-N	429.521	1.777	50	20	IDGD	
CN(C)c1nnc(-c2ccc(NC(=O)C(=O)NNC(=O)Cn3ccc4ccccc43)cc2)o1	764239740	RLMCPHQCKIJJPG-UHFFFAOYSA-N	447.455	1.543	50	20	IDGD	
CSc1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	764260944	UHZCKBKXGOBLER-UHFFFAOYSA-N	448.936	1.854	50	20	IDGD	
Cc1cc(N2CCSCC2)ccc1NC(=O)C(=O)NNC(=O)COc1ccccc1O	764277094	HLOBZGXJYOUKNS-UHFFFAOYSA-N	444.513	1.419	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)C(=O)Nc1ccc(NC(=O)c2ccccc2)nc1	764365816	CTALSROZYNHJTE-UHFFFAOYSA-N	447.451	1.637	50	20	IDGD	
C#CCOc1cc(F)ccc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	764387953	OPEVYOIMOBXBPN-UHFFFAOYSA-N	439.378	1.767	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)C(=O)Nc2cc(C)n(-c3cccc(F)c3)n2)c1	764432302	DWHDXWSCXJDWKV-UHFFFAOYSA-N	439.407	1.073	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=S)Nc3ccc(C(N)=O)cc3)n[nH]2)cc1OC	764501476	YXQHJGYNDJFYMR-UHFFFAOYSA-N	440.485	1.824	50	20	IDGD	
Cc1cccc(NC(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)n1	765271107	NSIUNUMCILUXCC-UHFFFAOYSA-N	447.517	1.196	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)cc(S(N)(=O)=O)c1C	765607159	LOEBQNBPKBOPFC-UHFFFAOYSA-N	431.449	1.555	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)cc1OC	765756596	ZIOCKBWPYIOFFS-UHFFFAOYSA-N	446.935	1.936	50	20	IDGD	
CCn1nc(C)c(C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)c1C	766667775	DAYBHYGZAILUGZ-UHFFFAOYSA-N	432.956	1.752	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)N[C@@H]2CCN(C3CCCCC3)C2=O)nc1	767172192	YSMWDMWEPBZTNT-MRXNPFEDSA-N	438.554	1.328	50	20	IDGD	
CC1(C)CCC[C@]2(C1)NC(=O)N(CC(=O)NNC(=O)c1ccc3c(c1)OCCO3)C2=O	768565806	KXTIZZCTHBQENN-OAQYLSRUSA-N	430.461	1.110	50	20	IDGD	
C[C@]1(c2cccc(C(=O)NNC(=O)CSc3ccc(Cl)cc3)c2)NC(=O)NC1=O	768900125	OPAQPDLWKCWAPC-LJQANCHMSA-N	432.889	1.948	50	20	IDGD	
CC(=NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)c1ccc(F)cn1	770589971	CXZMCTLKGAPMGX-UHFFFAOYSA-N	434.493	1.715	50	20	IDGD	
O=C(CN1CCC(O)(Cc2cccc(F)c2)CC1)NNC(=O)c1cccc([N+](=O)[O-])c1	770699730	GTZBTFTYVGNIQG-UHFFFAOYSA-N	430.436	1.565	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)NCC(=O)NNc2ccnc(Br)c2)cc1	771746162	RVXCJBZXPNAMKY-UHFFFAOYSA-N	427.280	1.468	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1ccc(S(=O)(=O)N2CCCCCC2)cc1	771891631	ANPNXZQRFZEABK-CQSZACIVSA-N	425.507	1.354	50	20	IDGD	
COc1ccc(CC(=O)O)cc1S(=O)(=O)NNC(=O)[C@@H](C)Oc1cccc(Cl)c1	773251648	NMYSKUHWDCMOJX-LLVKDONJSA-N	442.877	1.753	50	20	IDGD	
O=C(NNc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1	773657167	YXVCALDBTBSGFN-UHFFFAOYSA-N	447.473	1.851	50	20	IDGD	
Cc1cnn(-c2ccc(C(N)=O)cc2NC(=O)C(=O)NNc2ccc(C(F)(F)F)cn2)c1	773666360	NIZGJTRJZHCTTQ-UHFFFAOYSA-N	447.377	1.775	50	20	IDGD	
COc1cc([C@H](NC(=O)NNC(=O)c2c[nH]nc2C)C(F)(F)F)cc(OC)c1OC	775995977	ODTHYLOZZHMTLX-AWEZNQCLSA-N	431.371	1.992	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN[C@H](c2ccc3c(c2)OCCO3)C2CC2)cc1OC	776014109	GRBDMKGMZZNFHV-QFIPXVFZSA-N	441.484	1.977	50	20	IDGD	
C[C@@H](CN1CCN(c2ccccc2)CC1)NC(=O)NNc1cccc(S(C)(=O)=O)c1	776620857	YSMOEEVKNKQEEC-KRWDZBQOSA-N	431.562	1.927	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@@H](O)Cc2cccc(C(F)(F)F)c2)c2ccccc2c1=O	778296429	WQBAFLRMRMGQBQ-INIZCTEOSA-N	448.401	1.800	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)N3CCOCC3)c(F)c2)cc1	778708370	ZWNWGDXOXDQNMB-UHFFFAOYSA-N	442.447	1.260	50	20	IDGD	
CC(C)(C)OC(=O)NCc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(C#N)c2)cc1	778709328	DFFJIILXTMGQDP-UHFFFAOYSA-N	437.456	1.983	50	20	IDGD	
COc1ccc(-n2cc(O)c(C(=O)NNc3nc(O)c4cnn(C(C)(C)C)c4n3)n2)cc1	779516757	HUXOMEJAPCKKKK-UHFFFAOYSA-N	438.448	1.944	50	20	IDGD	
C[C@](O)(CC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)c1ccccc1	780849789	POJQKLRCQVBBAG-QFIPXVFZSA-N	445.541	1.920	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNc2ncncc2Cl)c2ccccc12	782166847	YAMACMMZSAPSKW-UHFFFAOYSA-N	429.820	1.917	50	20	IDGD	
O=C(NNc1ccc(-n2cccn2)nn1)C(=O)Nc1ccc(OCc2ccccc2)nc1	783436319	KLPZIOHWLPDOAB-UHFFFAOYSA-N	430.428	1.718	50	20	IDGD	
O=C(NNc1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(S(=O)(=O)C[C@H]2CCCO2)cc1	784828812	UNAFETAFCFFCCJ-MRXNPFEDSA-N	448.457	1.629	50	20	IDGD	
O=C(NNc1ccc(Cl)nc1)C(=O)Nc1ccc(F)c(S(=O)(=O)NC2CC2)c1	784871142	DJBNZEXFDDULAG-UHFFFAOYSA-N	427.845	1.397	50	20	IDGD	
CS(=O)(=O)c1ccccc1CC(=O)NNC(=O)c1cc(F)ccc1Br	786089282	QCCWFRGFANHVAW-UHFFFAOYSA-N	429.267	1.995	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)[C@H](C)N2CCc3ccccc32)cc1OC	788143563	LXERBWYFCRTJHW-AWEZNQCLSA-N	427.457	1.459	50	20	IDGD	
CCCOc1cc(OC)ccc1C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	789736077	UVPKFLWXZVNXOT-UHFFFAOYSA-N	441.893	1.860	50	20	IDGD	
COc1cc(Cl)c(S(=O)(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1OC	790339947	JPEGVYNUECCTHD-OAHLLOKOSA-N	428.850	1.507	50	20	IDGD	
NS(=O)(=O)c1ccc(Br)c(C(=O)NNc2cccc(F)c2[N+](=O)[O-])c1	791070148	YUUMOKONZCULAJ-UHFFFAOYSA-N	433.215	1.901	50	20	IDGD	
Cc1nc2ccc(C(=O)NNc3ccccc3S(=O)(=O)N3CCOCC3)cc2n1C	793595024	YTEYXYOMFYSYTB-UHFFFAOYSA-N	429.502	1.660	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)CCNC(=O)c1ccc([N+](=O)[O-])cc1	795176480	AZDGIIUVTMRZQU-UHFFFAOYSA-N	435.462	1.108	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1ccc(OCC(F)(F)F)c(F)c1	800623370	NPXHEAXOUUEDJQ-UHFFFAOYSA-N	445.325	1.637	50	20	IDGD	
O=C(COCC(=O)NNC(=O)Nc1ccc(Cl)cc1Cl)NCc1cccnc1	802085245	FUMKUVMHSZQUFA-UHFFFAOYSA-N	426.260	1.874	50	20	IDGD	
COc1cccc(/C=C(\C(=O)NNC(=O)Nc2ccc(N(C)C)cc2)n2nnnc2C)c1	802119397	ILPQGZORHCWROR-CPNJWEJPSA-N	436.476	1.907	50	20	IDGD	
CN(C(=O)OC(C)(C)C)[C@H](C(=O)NNC(=O)CNC(=O)OC(C)(C)C)c1cnn(C)c1	803054446	OWFMWUIAFLDFRV-AWEZNQCLSA-N	440.501	1.000	50	20	IDGD	
Cc1cnn(Cc2ccccc2F)c1NC(=O)C(=O)NNc1ccc(-n2ccnc2)nn1	807429298	RWLXPFYUWLOPSD-UHFFFAOYSA-N	435.423	1.436	50	20	IDGD	
Cc1cc([N+](=O)[O-])ccc1NNC(=O)C(=O)Nc1cc(S(=O)(=O)N2CCCC2)ccn1	807455326	KAGGSCDYOMHIFZ-UHFFFAOYSA-N	448.461	1.165	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)N[C@@H]3CCCN(C(=O)CCC(F)(F)F)C3)nc21	807574650	UDHIDVLCYTZSPK-SECBINFHSA-N	430.391	1.029	50	20	IDGD	
NS(=O)(=O)c1ccccc1CNC(=O)NNC(=O)c1ccc(F)cc1Br	807605256	QUBZZRIGKMGKRV-UHFFFAOYSA-N	445.270	1.380	50	20	IDGD	
NC(=O)C[C@@H]1CCN(C(=O)NNC(=O)[C@H]2Cc3ccccc3CN2Cc2ccccc2)C1	808256045	KBUCGGOXSPLIMQ-GHTZIAJQSA-N	435.528	1.552	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)cc1-c1ncco1	813033680	GGBNTIFMQBKFCG-UHFFFAOYSA-N	443.485	1.982	50	20	IDGD	
C[C@H](NC(=O)c1cccs1)C(=O)NNC(=O)COc1ccc(Br)cc1	813287960	MALGDASZXYXOTH-JTQLQIEISA-N	426.292	1.855	50	20	IDGD	
CCOC(=O)c1cc(COC)cc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)c1	815568536	LTJUOYFVMZABCR-UHFFFAOYSA-N	449.847	1.768	50	20	IDGD	
CC[C@H](C)Sc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2CCc3nncn3C2)c(C)c1	815692587	VNHAXCLKMOPHOT-KBPBESRZSA-N	430.534	1.826	50	20	IDGD	
COc1ccc(S(=O)(=O)NC2CC2)cc1NC(=O)C(=O)NNc1cccc(Cl)n1	815726657	OKDKHKWILGAWMZ-UHFFFAOYSA-N	439.881	1.266	50	20	IDGD	
Cn1nncc1NNC(=O)c1cc(S(=O)(=O)N2CCCCC2)ccc1Br	816770493	ZROMCEFSTMBDIE-UHFFFAOYSA-N	443.327	1.509	50	20	IDGD	
CCS(=O)(=O)N[C@H](C)C(=O)NNC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1	816829012	XRQWOXKYLVVIOC-CQSZACIVSA-N	442.501	1.023	50	20	IDGD	
C[C@H]1CCCN(S(=O)(=O)c2ccc(C(=O)NNC(=O)CNc3ccccc3)cc2)C1	823327721	BSZRRLWSMYANLF-INIZCTEOSA-N	430.530	1.980	50	20	IDGD	
CN1C(=O)c2ccc(S(=O)(=O)NNC(=O)c3ccc(Cl)cc3Cl)cc2C1=O	861660210	HXTNLTJNIMBALQ-UHFFFAOYSA-N	428.253	1.843	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NN=Cc2c(OC)nc(N)nc2N2CCCC2)cc1	863966648	IWNIAUVMBXJTSS-CQSZACIVSA-N	428.493	1.984	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)[C@H]2CS[C@H](Cc3ccccc3F)C(=O)N2)cc1	888625559	TXBBKBZBESKOKZ-QZTJIDSGSA-N	442.472	1.066	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)[C@H](C)NS(=O)(=O)c2cccc(C(F)(F)F)c2)n1	913025798	UVYGZRWOYOGQFK-LBPRGKRZSA-N	447.439	1.033	50	20	IDGD	
CC(=O)Nc1cccc(-n2nnnc2SCC(=O)NNC(=O)c2ccc(C)cc2)c1	913123082	CKTHQKQEZFTJOJ-UHFFFAOYSA-N	425.474	1.482	50	20	IDGD	
CCOC(=O)CC(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccc(OC)cc2)c1	913428734	UKABJUMFZHJNPR-UHFFFAOYSA-N	435.458	1.210	50	20	IDGD	
O=C(COC(=O)c1cccc(Nc2ncccn2)c1)NNC(=O)c1ccc([N+](=O)[O-])cc1	914627227	KRLHZJWKWGXKMS-UHFFFAOYSA-N	436.384	1.746	50	20	IDGD	
O=C(NCc1ccncc1)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	915881490	IKNDWWKEFUWXJB-UHFFFAOYSA-N	428.452	1.984	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCCCOc2cccc(C)c2)cc1	916225320	HLYGAMXZTVLTKS-UHFFFAOYSA-N	448.545	1.723	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCC(C)(C)N2C[C@H](C)O[C@H](C)C2)c2ccccc2c1=O	916234459	GKEZAJUBLNMROP-GASCZTMLSA-N	444.536	1.248	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCC[C@](O)(c2nccn2C)C(F)(F)F)cc1OC	916377239	AMTXAQPKFZADJM-KRWDZBQOSA-N	445.398	1.222	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CNC(=O)Cc2cccc3ccccc23)cc1C	916563023	YFIMFYZRWRUJGD-UHFFFAOYSA-N	432.480	1.901	50	20	IDGD	
COc1ccc(OC2CCN(CC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)CC2)cc1	917139314	UIYPFOMQFSABAB-UHFFFAOYSA-N	428.445	1.908	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3C[C@@H](C)O[C@H](C)C3)c2)c(O)c1	918341295	RJXOGDUSAMMBMG-HUUCEWRRSA-N	447.513	1.573	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCc1ccn(-c2ccccc2)n1	918776313	NLDQFHGRGSDJMD-UHFFFAOYSA-N	441.517	1.618	50	20	IDGD	
CCN(CC)CCC(=O)NN=C1CCN(S(=O)(=O)c2ccc(NC(C)=O)cc2)CC1	920367465	MNUPFBKXGPVNEN-UHFFFAOYSA-N	437.566	1.634	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)CN(C)Cc3ccccc3)cc2)CC1	1115979590	RBNAKDHOSZYSCP-UHFFFAOYSA-N	431.562	1.198	50	20	IDGD	
COC(=O)c1cc(C(=O)OCC(=O)NNC(=O)c2ccc(C)cc2)n(-c2ccccc2)n1	1318252959	KLZKJLQXIPLOHN-UHFFFAOYSA-N	436.424	1.585	50	20	IDGD	
Cn1c(C(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)cc(Br)c1C=O	1319291044	KLHVGHHZKKQOSY-UHFFFAOYSA-N	436.270	1.957	50	20	IDGD	
COC(=O)c1cc(Cl)ccc1S(=O)(=O)NNC(=O)c1cncn1-c1ccccc1	1320140462	SGXVMYZYPIHVSU-UHFFFAOYSA-N	434.861	1.936	50	20	IDGD	
Cc1ccc(S(=O)(=O)C[C@H](C)NC(=O)NNC(=O)c2cncn2-c2ccccc2)cc1	1320422309	POEWLNAQOJPHLZ-INIZCTEOSA-N	441.513	1.987	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)NCc1cccc(CN2CCN(C)CC2)c1	1321507408	WKAWHGLTWUZBPY-UHFFFAOYSA-N	435.532	1.534	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)Nc2cnn(C[C@H]3CCCO3)c2)CC1	1323828896	FBUKKYWQBJBZFD-MRXNPFEDSA-N	436.513	1.862	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H]3ON=C(c4ccccc4)O3)C2)C1	1778870868	KDFCGZPPJMAQDX-NDXORKPFSA-N	435.908	1.959	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2)c1ccc(C(F)(F)F)[nH]1	1779577582	STJIFEHXNKOWEK-SUYBPPKGSA-N	437.846	1.761	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cn4[nH]cnc(=O)c4c3C)C2)C1	1780016173	FMOCINYRNVTXEX-QRWLVFNGSA-N	435.912	1.182	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(CCN(C(=O)c3cc(-n4ccnc4)ccn3)C2)C1	1780386435	WQHINKUAFDVTSF-IBGZPJMESA-N	448.321	1.496	50	20	IDGD	
COC(=O)c1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)cn1	1781229855	MXBIYQQRPSUZIT-RBUKOAKNSA-N	444.315	1.548	50	20	IDGD	
O=C(c1cc(O)cc([N+](=O)[O-])c1)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1781938598	HWYXOJUREIPESV-XJKSGUPXSA-N	446.229	1.434	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CC2CCC2)C1	1783176116	RLCRNYZQZNRNIY-LVGVVDSRSA-N	443.548	1.825	50	20	IDGD	
CCC[C@H](NC(C)=O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)Br)C2	1783190871	UKLSADRRZRXOAL-PSFFPDNBSA-N	446.386	1.589	50	20	IDGD	
C[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1783709657	DTKMITZMLGWSFB-FOIQADDNSA-N	443.617	1.581	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(=O)c3ccco3)C[C@@H]21	1783970324	WAPZUDFIHDSCQQ-ABHRYQDASA-N	427.295	1.473	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)Cc3ccc(OC)c(F)c3)C2)C1	1784703821	ASWQYSOVUDMPPB-MGPUTAFESA-N	428.888	1.461	50	20	IDGD	
COC(=O)[C@H]1CC[C@H](C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)C(Cl)Cl)C[C@@H]32)CC1	1784798690	QVOPPFJRXPTFFA-YTFOTSKYSA-N	435.348	1.749	50	20	IDGD	
O=C(Cc1ccc2ncccc2c1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21	1784805021	KLKNJVWVEDRESR-ZULIPRJHSA-N	431.920	1.357	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cncn3-c3ccncc3)[C@H]2C1	1785753443	YVYDBJWPECTPPH-RMRDIRSESA-N	431.924	1.878	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCN3CCCCC3)[C@H]2C1	1786579863	XGEZTTXWFFMYAU-QAETUUGQSA-N	430.387	1.626	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)Nc3nccs3)[C@H]2C1	1787490056	XXDVYBADQRNNKN-LXFSFDBISA-N	430.958	1.177	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3snnc3C)[C@H]2C1	1787633148	MBUPPZYMNTYLSW-RVMXOQNASA-N	431.356	1.613	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)c3ccc(O)cn3)CCC2)cc1)c1ccc(B(O)O)cc1	1788140750	RVJPAHVKCCSYHE-UHFFFAOYSA-N	431.257	1.529	50	20	IDGD	
Cc1cc(C(N)=O)cc(C)c1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21	1788597828	YVYZDKFOAFHTSJ-QEJZJMRPSA-N	442.343	1.799	50	20	IDGD	
CCc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)CBr)C[C@@H]32)n(C)n1	1788941359	PTTUOLOQHMNYBW-HPZZRFSDSA-N	441.370	1.607	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3CCCN(C)C3)[C@H]2C1	1789744968	KUVOSIPREQSAGK-VIQHNZTISA-N	430.387	1.481	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)c1cccc2nccn12	1790417022	RNUJSAIDQPRXBG-LMRQPLJMSA-N	439.285	1.618	50	20	IDGD	
CCN(CC)C[C@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)Br)C[C@@H]21	1790606047	WKBUFMIIIBKECQ-QEOTZNIISA-N	432.403	1.727	50	20	IDGD	
C[C@H]1[C@@H](C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](O)CCl)CCN1C(=O)OC(C)(C)C	1793117425	KACPLADROIHRRB-WBAHDQRJSA-N	443.972	1.870	50	20	IDGD	
CCS(=O)(=O)N[C@H](C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@](C)(Cl)CCl)C2	1793535775	DHSVQLZZNWOGSB-VBTGVMJWSA-N	428.382	1.189	50	20	IDGD	
C#CCO[C@H](C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1793562310	ONHCCCNACOKENG-UUAJXVIYSA-N	441.956	1.795	50	20	IDGD	
CN(C)c1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Br)C3)nc1	1794461763	TYIOPMGIWBMNDW-BAESOJJISA-N	429.290	1.041	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c(F)ccnc1Cl)C2	1795111574	XSZPBIPYCCZWLQ-WDAIWFPHSA-N	434.693	1.862	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2)c1csc(Br)n1	1796689506	SINXGGGJSDXCMX-MBLNEYKQSA-N	426.695	1.643	50	20	IDGD	
CC(=O)Nc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@](C)(Cl)CCl)C3)ccn1	1796747278	BZWVJOQMZYXOKZ-QHHYFVSCSA-N	443.331	1.480	50	20	IDGD	
C[C@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CO[Si](C)(C)C)C2)[C@H]1SC(=N)NC1=O	1796878550	HNAURSNUHBKNQS-DKBOKBLXSA-N	426.615	1.279	50	20	IDGD	
Cc1cnc2c(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@@H](C)Br)C4)cnn2c1	1797419813	VOYJHVQARHKSMC-GUIRCDHDSA-N	436.310	1.024	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CN(Cc2ccccc2)CCO1)[C@@H](O)CCl	1797853206	CSTAYJGXZDDHLK-WPVAHCMFSA-N	435.952	1.125	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1[nH]cnc1-c1cccnc1	1798496054	MZHWNKCWGUNZBR-MHEUCROKSA-N	448.321	1.458	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1CCC3(CC1)OCCO3)C2	1799279359	KTCQRIFJXJNXJX-RCJHGTSTSA-N	449.375	1.746	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(O)c([N+](=O)[O-])c1	1799483167	LUZNPCMECHBTGL-UMPJEAMMSA-N	425.869	1.911	50	20	IDGD	
CO/C=C(\C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN(C)NC(=O)NCc1ccccc1	1799871437	FFCURVLDSZPVDM-CNPWXLQSSA-N	443.548	1.521	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)NC(=O)c1ccccn1	1800201421	PBHVNSWSSXTIBW-RPUYLAQPSA-N	436.940	1.197	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3n(n1)CCCC3)C2	1800758977	BDUUREDRXKGQJQ-JFILPPLUSA-N	425.327	1.206	50	20	IDGD	
Cc1cc(C)n2ccc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)c3cccc(B(O)O)c3)C4)c2n1	1801193005	UZKNOTDIOKCQGY-ACDBMABISA-N	446.316	1.197	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CC[C@H](N)C(N)=O)C2	1801437111	HPZBTXIPMABBMV-ZPLALWFASA-N	445.470	1.103	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H]1CN(Cc3ccccc3)CCO1)C2	1802274380	WUNUPIOHXYJECV-FDKIHUSFSA-N	449.979	1.779	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2nn[nH]c2C(F)(F)F)[C@H]1c1cccnc1)[C@@H](O)CCl	1803140559	GUOFNTAOWADTIM-GVXVVHGQSA-N	446.817	1.138	50	20	IDGD	
O=C(Cc1cnccn1)NC[C@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1	1803295553	JLLUNDBQECFUPX-DNVCBOLYSA-N	432.322	1.905	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)CCN2C(=O)C=CC2=O)[C@@H]1c1cccnc1	1803912798	KGZICDCFXCNUBL-FIKGOQFSSA-N	446.935	1.810	50	20	IDGD	
O=C(CSc1ccncc1)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1	1804351032	NGFPTDZYXBRZPQ-WDYCEAGBSA-N	434.949	1.874	50	20	IDGD	
CN(CC(=O)N1CCC2(CCCN(C(=O)[C@H](O)CCl)C2)CC1)C(=O)OC(C)(C)C	1805519005	KAZXTZCZHAXREA-OAHLLOKOSA-N	431.961	1.684	50	20	IDGD	
CN1CCCC[C@@H]1C(=O)N1CCCC2(CCN(C(=O)c3cnccc3C(=O)NN)CC2)C1	1805549721	YDSQGMQHKDSKMP-LJQANCHMSA-N	442.564	1.014	50	20	IDGD	
C=CCOCCCC(=O)N1CCCC2(CCN(C(=O)c3cnccc3C(=O)NN)CC2)C1	1806015139	RLWSBWFEFXIYDE-UHFFFAOYSA-N	443.548	1.513	50	20	IDGD	
CSCC[C@H](O)C(=O)N1CC[C@H](CNC(=O)CCBr)[C@H]1c1cccnc1	1806346464	HODPLHFCMNGDGF-HLLBOEOZSA-N	444.395	1.986	50	20	IDGD	
CC1(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)CCCC1	1807360167	OSDVEUMMVMBSLX-PZJWPPBQSA-N	435.333	1.661	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cc(=O)nc3cccnn23)[C@@H]1c1cccnc1)[C@@H](F)Cl	1808315100	KDABPDKIQSORJJ-MORSLUCNSA-N	444.854	1.339	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)c1nc2ccccc2[nH]1	1809035649	HJECMFFFXXHQLW-QGTPRVQTSA-N	427.892	1.877	50	20	IDGD	
O=C(C#CC1(O)CCCCC1)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1	1810329718	GFPIAFIVKISZFS-NLWGTHIKSA-N	433.936	1.386	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)CNC(=O)OC)[C@H]1c1cccnc1	1812779135	PDIYPQGTBNLKOX-YCPHGPKFSA-N	441.326	1.617	50	20	IDGD	
COCc1oncc1C(=O)N1CC[C@H](CNC(=O)[C@@H](Cl)COC)[C@H]1c1cccnc1	1813031843	XODXUXSDNLKWIX-UWWQBHOKSA-N	436.896	1.789	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)[C@@H]2CCCS2)[C@H]1c1cccnc1	1813615318	FPTLPPZUKPHYAZ-FUHIMQAGSA-N	433.578	1.356	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CN2CCNC2=N)n[nH]1	1817298792	QCJVTHRVWBFEKC-PWSUYJOCSA-N	426.319	1.025	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)C(F)(F)Cl)CC2	1819801371	JZUBHGDOSUQAHD-ZETCQYMHSA-N	444.851	1.199	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2nccnc2C(N)=O)n[nH]1	1820022823	XXDAUGOGQMUURP-LBPRGKRZSA-N	433.900	1.870	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCn1ccnn1)CC2	1822868915	CDSGWUZGHZRARU-QLJPJBMISA-N	431.349	1.973	50	20	IDGD	
Cc1nccn1CC(=O)N[C@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1	1823009226	MWCABEHJTLSJNE-ZANVPECISA-N	430.303	1.951	50	20	IDGD	
CC(C)[C@H](S)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1	1824544036	KEJSBOGYNZXPDO-PXNSSMCTSA-N	426.627	1.934	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(C(C)=O)[nH]n1)CC2	1825994654	WWKMXAPVLXCBTB-NXEZZACHSA-N	425.898	1.548	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCCn1ccnc1)CC2	1826092166	OXJSMRZPFCFMKH-AWEZNQCLSA-N	447.565	1.105	50	20	IDGD	
C[C@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)[C@H]3CCNC(=O)C3)sc2C1	1826228451	LVZXTMMIPIDIQS-GUBZILKMSA-N	429.340	1.365	50	20	IDGD	
CC(C)(O)CC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1	1826635378	NHLMNXVIKCUBJX-GOSISDBHSA-N	431.537	1.079	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H]2CCC(=O)N2)CC1	1826664163	JVHWTKPPYGRNNX-IMJJTQAJSA-N	428.371	1.916	50	20	IDGD	
Cc1cnn([C@H](C)C(=O)Nc2nc3c(s2)C[C@H](NC(=O)CCC(=O)NN(C)C)CC3)c1	1826752985	WJQLZAAOGBRBPU-ZIAGYGMSSA-N	447.565	1.194	50	20	IDGD	
O=C(Cc1ccsc1)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827054827	MKSMHSXPOXWTLD-OAQYLSRUSA-N	440.374	1.904	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)C2=COCC2)CC1	1828926083	YCOHALUVRSXDBQ-IBGZPJMESA-N	427.505	1.223	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccc(C#N)cc3)CCO2)C1	1829898944	OQGFYHUUUWAVBX-UGKGYDQZSA-N	433.936	1.965	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)CN2CCCCC2)CC1	1831870781	GJLKDDGEVMMNHD-FQEVSTJZSA-N	435.613	1.465	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cncc(O)c2)CC1	1831874262	GAKMIYJLRMUTJB-IBGZPJMESA-N	431.537	1.394	50	20	IDGD	
C=CCCc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)c(O)n1	1833699176	UILLOHYQGRNMAI-OXJNMPFZSA-N	441.887	1.510	50	20	IDGD	
Nc1ncc(C(=O)NC2CCN(C3CCN(C(=O)[C@H](F)Br)CC3)CC2)s1	1834768043	YSLMZGZEGBAYCE-ZDUSSCGKSA-N	448.362	1.601	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cc(O)nc(O)n3)CC2)CC1	1835076599	SEBIURYSGJKOPN-AWEZNQCLSA-N	425.917	1.090	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)COCc3ccccc3)CCO2)C1	1835365470	VKXFYPPBNNLYJS-QFIPXVFZSA-N	438.952	1.925	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3oc(C)nc3C)CC2)CC1	1835941787	AQWIBOILLGJNTA-QGZVFWFLSA-N	426.945	1.730	50	20	IDGD	
O=C(Cc1noc2ccccc12)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1835980395	NQLIQPUVNITYNG-MJGOQNOKSA-N	425.844	1.361	50	20	IDGD	
CC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)c3cnn4ncccc34)CC2)CC1	1836393896	ALOOMEZDYKAVFW-SFHVURJKSA-N	432.956	1.932	50	20	IDGD	
Cc1nc2sccn2c1C(=O)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1837146163	BPQQFIGSMCNHDM-QGZVFWFLSA-N	447.344	1.578	50	20	IDGD	
CCn1nc(C(C)C)cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1838813660	WHGQGSOGZIXZHD-IBGZPJMESA-N	447.363	1.900	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(OCC)nn3)CCO2)C1	1838829482	AXSGPKVIAURFAA-FOIQADDNSA-N	440.928	1.353	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)C3(c4ccc(O)cc4)CC3)C2)C1	1839141498	KBPGNQWONDRNQL-GHTZIAJQSA-N	436.936	1.898	50	20	IDGD	
N#Cc1cc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)ccc1F	1839187163	NPCBXOUZWHZBAF-MJGOQNOKSA-N	427.835	1.231	50	20	IDGD	
CNc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)cc1	1840032287	UAZBYRIWPARTAD-KUHUBIRLSA-N	440.338	1.582	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(F)c3)C2)C1	1840034754	WOOYFAVYARPWKN-UGSOOPFHSA-N	429.286	1.679	50	20	IDGD	
Cc1ncc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)s1	1840036494	LPIXXBFBCGPKBJ-SJCJKPOMSA-N	446.367	1.234	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C)cc(Cl)c3)C2)C1	1840155878	FRJNPQNFIRIGCO-YLJYHZDGSA-N	445.343	1.972	50	20	IDGD	
Cn1ccnc1C(=O)N1CCCC12CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1842511200	CAVBHELBCYFHQY-ZDUSSCGKSA-N	425.917	1.369	50	20	IDGD	
O=C(c1ccc(Cl)c(Cl)c1)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843014460	LGLGBAHMYAWALD-UHFFFAOYSA-N	433.100	1.804	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)c2cc(C)nn2-c2cccc(=O)n2C)C1	1843132383	MMYHECZFYDLNCB-OAHLLOKOSA-N	431.924	1.714	50	20	IDGD	
O=C(c1n[nH]cc1I)N1CC2(CCCN2C(=O)[C@H](F)Cl)C1	1843364369	HIOITSYPHKADCH-VIFPVBQESA-N	426.617	1.366	50	20	IDGD	
CC[C@H](C(=O)N1CC2(CCCN2C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C1)N(CC)CC	1843415401	OWTCMQHOXWQAKX-WCIBBKAISA-N	430.553	1.444	50	20	IDGD	
CCOC(=O)c1cccc(C(=O)N2CCCC23CN(C(=O)CCC(=O)NN(C)C)C3)c1F	1844699163	KYGHTVMOGKMCKS-UHFFFAOYSA-N	448.495	1.192	50	20	IDGD	
C[C@H](Br)C(=O)N1CC2(CCCN2C(=O)COCCNC(=O)OC(C)(C)C)C1	1845154961	NQNXPVYGXTXDAO-ZDUSSCGKSA-N	448.358	1.515	50	20	IDGD	
CC(C)n1nc(C(=O)N2CC3(CCCN3C(=O)[C@H](C)Br)C2)cc1C(=O)O	1846175948	DIYZKJGQOCYIEI-NSHDSACASA-N	427.299	1.763	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@H]1Cc3[nH]nc(C(F)(F)F)c3C1)C2	1846364498	RTABLKYEFAZIJP-JQWIXIFHSA-N	434.846	1.601	50	20	IDGD	
COc1ccc([C@@H](O)C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](C)CBr)cc1	1847392477	SFESQSJZINKDIC-OSMBCOQSSA-N	425.323	1.961	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](C)CBr	1847499928	RIXPVTBWUGIAOV-QMHWVQJVSA-N	427.339	1.975	50	20	IDGD	
O=C(Cc1cc(F)ccc1Cl)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cccc(B(O)O)c1	1848016381	XVQGKJXVLIBIII-OALUTQOASA-N	430.672	1.217	50	20	IDGD	
COC(=O)[C@@H](F)C(Nc1ccc(SC#N)cc1Cl)=C1C(=O)NC(=S)NC1=O	9864818	FONAHQCKNFKRTQ-JTQLQIEISA-N	428.854	1.621	50	20	IDGD	
Cc1cc(OCC(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)no1	18154512	GOMJVYIBZJGZQQ-UHFFFAOYSA-N	444.469	1.302	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)CN2C(=O)N[C@](C)(c3ccc(F)cc3)C2=O)cc1	105569171	TVMYQRPEOIHEFD-OAQYLSRUSA-N	427.436	1.161	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)c2nn(-c3ccccc3F)c(C)cc2=O)cc1	138247607	YZFPMAYYJMVXHU-UHFFFAOYSA-N	425.420	1.562	50	20	IDGD	
C[C@H](NS(=O)(=O)c1cccc(C(F)(F)F)c1)C(=O)NNC(=S)NC(C)(C)C	726136870	RFJVKDRAMLVFPR-VIFPVBQESA-N	426.486	1.666	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)N[C@@H](CN1CCN(C)CC1)c1ccccc1	727946047	QUOCXOXZNMJILH-NRFANRHFSA-N	439.560	1.947	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)Cn2nnc3ccccc3c2=O)c1	728528766	LELBAPWKJCHFJO-UHFFFAOYSA-N	432.234	1.024	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)[C@H]1CCCN(C(=O)c2ccccc2OC(F)F)C1	728851565	KTHHQOGRNXUXMS-HNNXBMFYSA-N	432.427	1.925	50	20	IDGD	
CCCC[C@H](/N=C1/NS(=O)(=O)c2ccccc21)C(=O)NNC(=O)c1cccc(C#N)c1	728872585	OAGKQJUJAQETSP-KRWDZBQOSA-N	439.497	1.617	50	20	IDGD	
CCCCCC(=O)NC1CCN(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)CC1	728961641	JSFKREFWVOPMAF-UHFFFAOYSA-N	445.568	1.595	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12)N(C)C1CC1	729617419	NZLFJTLUGISHHZ-MRXNPFEDSA-N	448.527	1.872	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN1S(=O)(=O)c1cccs1)c1cccc2ncccc12	730226582	NFEGVAHYNSBSFY-MRXNPFEDSA-N	430.511	1.911	50	20	IDGD	
CC(=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O)c1ccc(N2CCCCCC2)cc1	730569133	PDCWJNKFRNEMDG-UHFFFAOYSA-N	444.561	1.492	50	20	IDGD	
O=C(CCNC(=O)N1CCc2ccccc2C1)NNC(=O)c1cc(Br)c[nH]1	731865172	HJZIJGGWDSGSGQ-UHFFFAOYSA-N	434.294	1.696	50	20	IDGD	
COC(=O)N1CCC[C@H](NC(=O)NNC(=O)c2ccc(OC)c(Br)c2)C1	732245403	UHAPBCLCSYPIGF-NSHDSACASA-N	429.271	1.633	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)N[C@H]2CCN(c3ccccc3C(N)=O)C2)cc1OC	732576560	ZVBBAJLPQKTTIQ-HNNXBMFYSA-N	441.488	1.416	50	20	IDGD	
COc1nn(C)c2nc(C)c(CCC(=O)NNc3nc4ccccc4c(=O)n3C)c(C)c12	733261700	ZTBZFKBPHRRTNS-UHFFFAOYSA-N	435.488	1.917	50	20	IDGD	
CCOC(=O)N[C@H](C(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1)C(C)C	734820970	BVSHOZIQCFYKNE-AWEZNQCLSA-N	429.518	1.487	50	20	IDGD	
CC(C)[C@@H](C(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)N1C[C@H](C)O[C@H](C)C1	741018873	CZBOMKFPTJSWDF-IYOUNJFTSA-N	436.465	1.033	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)c1ccc(C[C@@H]2CC(=O)NC2=O)cc1	741144198	KHDCKUYVMVYHQC-MRXNPFEDSA-N	425.441	1.131	50	20	IDGD	
O=C(NNS(=O)(=O)c1cnn(-c2ccccc2F)c1)c1cnn(-c2ccccc2)c1	742030243	ULQHUWVZULKZSG-UHFFFAOYSA-N	426.433	1.820	50	20	IDGD	
O=C(COc1ccccc1-c1ccccc1)NNC(=O)CN1C(=O)[C@H]2[C@H](C1=O)[C@H]1CC[C@H]2O1	742472886	XHCYNCSYOOBBMC-MCEIDBOGSA-N	449.463	1.042	50	20	IDGD	
Cc1nn(C)c(C)c1C[C@H](C)C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	743334931	OTKOYNBAUXIOPH-HNNXBMFYSA-N	448.593	1.295	50	20	IDGD	
Cc1cc(NNC(=O)[C@@H](C)NS(=O)(=O)c2c(C)nn(C)c2C)ccc1Br	743416406	NDHIBYCKYZPSKK-LLVKDONJSA-N	444.355	1.918	50	20	IDGD	
O=C(NN=C1CCN(Cc2ccccc2)C1=O)c1cccc(S(=O)(=O)N2CCCC2)c1	743420296	BLBBCDAFYOMMPZ-UHFFFAOYSA-N	440.525	1.989	50	20	IDGD	
O=C(NNC(=O)N1CC[C@H](COCc2ccccc2)C1)C1CCN(c2ncccn2)CC1	743588774	IMYUSAVZIFEETP-IBGZPJMESA-N	438.532	1.973	50	20	IDGD	
Cc1nsc(N2CCCN(C(=O)NNC(=O)c3cnn(-c4ccccc4)c3)CC2)n1	743609614	ZXTSHPNEYVAIAZ-UHFFFAOYSA-N	426.506	1.599	50	20	IDGD	
CNC(=O)NNC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(Br)s1	743885380	WKQATQRELPYUNQ-QMMMGPOBSA-N	425.330	1.014	50	20	IDGD	
CC(C)C(=O)N1CCCC[C@@H]1C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	744619558	SGDUZNZRXJOMDI-QGZVFWFLSA-N	438.550	1.188	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1)c1cnn(C)c1	745838659	LPZLOINHBRGXLI-LBPRGKRZSA-N	448.530	1.988	50	20	IDGD	
O=C(NCCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1)NNc1cc(F)c(F)c(F)c1	746754322	AEKOQOFCDULXFV-UHFFFAOYSA-N	433.368	1.617	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)NCCCNC(=O)c1ccc(Br)cc1	747584058	BXGFTMKZLXYFIM-UHFFFAOYSA-N	434.294	1.537	50	20	IDGD	
CC(=O)N[C@H](Cc1c[nH]c2ccc(Br)cc12)C(=O)NNc1nccn(C)c1=O	747945252	FQVQGVXHJRQCHF-OAHLLOKOSA-N	447.293	1.215	50	20	IDGD	
Cn1c(=O)nc(O)c2c(C(=O)NNc3ccc(S(C)(=O)=O)cc3)cc(C3CC3)nc21	748156954	STKCWAAIQWNAQP-UHFFFAOYSA-N	429.458	1.072	50	20	IDGD	
O=C(NNc1ccc(Br)cc1F)[C@@H]1CC(=O)N(CCN2CCOCC2)C1	748188732	VXNQXBFIMMCQPA-GFCCVEGCSA-N	429.290	1.212	50	20	IDGD	
N#CCCn1cc(/C=C(/C#N)C(=O)NNC(=O)C(=O)N2CCCC2)c(-c2ccccc2)n1	748240914	LNKKUXUQBBWQKI-LGMDPLHJSA-N	431.456	1.141	50	20	IDGD	
O=C(CCc1ccco1)NNC(=O)c1ccc(C(=O)NNC(=O)CCc2ccco2)cc1	748354718	MAYBEUFYYHJTHF-UHFFFAOYSA-N	438.440	1.660	50	20	IDGD	
CCc1cc(N2CCC(NC(=O)NNC(=O)[C@H](C)Oc3ccc(F)cc3)CC2)ncn1	748663139	GDHXINRWMONTPO-AWEZNQCLSA-N	430.484	1.945	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN1S(=O)(=O)c1cccs1)c1cccc2cccnc12	749224283	PUVWPKSIMKMQGQ-HNNXBMFYSA-N	430.511	1.911	50	20	IDGD	
Cn1c(N)c(C=NNC(=O)c2cc(-c3ccncc3)nc3ccccc23)c(=O)n(C)c1=O	749807207	MFKPYYDLEKTDNV-UHFFFAOYSA-N	429.440	1.040	50	20	IDGD	
O=C(CCCS(=O)(=O)N1CCCC1)NNc1nc(Br)cn2ccnc12	750248898	ZBBHXQRGLOKNIN-UHFFFAOYSA-N	431.316	1.141	50	20	IDGD	
O=C(CCc1cc(Cl)ccc1Br)NNC(=O)N[C@@H]1CCS(=O)(=O)C1	750862781	BNRYDULCNASVMM-LLVKDONJSA-N	438.731	1.553	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cccn2Cc2ccncc2)cc1	751290162	JAFDPIZGLMOGNL-UHFFFAOYSA-N	441.513	1.322	50	20	IDGD	
CCOC(=O)c1ccc(N2CC(NC(=O)NNC(=O)Cn3ccc4ccccc43)C2)nc1	753279373	KIRYFWLVRIHSMK-UHFFFAOYSA-N	436.472	1.432	50	20	IDGD	
Cc1oc(S(=O)(=O)N(C)C)cc1C(=O)NNc1nc(Br)cn2ccnc12	753341261	HGPRJVYIFWSSOE-UHFFFAOYSA-N	443.283	1.400	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2c(Cl)ccc(F)c2N)cc1OC	754117988	RJNIPGGZCPWRMW-UHFFFAOYSA-N	425.800	1.697	50	20	IDGD	
COc1ccc(C2(C(=O)OCC(=O)NNC(=O)Cc3nc(C)cs3)CCC2)cc1OC	755137693	ASKMDKKFPLQFAX-UHFFFAOYSA-N	447.513	1.824	50	20	IDGD	
O=C(Cc1cc[nH]n1)NNC(=O)c1ccc(I)c(Br)c1	755267771	BEJRAHGBHVZOIT-UHFFFAOYSA-N	449.046	1.781	50	20	IDGD	
O=C(Cc1cc[nH]n1)NNC(=O)c1ccc(NS(=O)(=O)c2ccc(Cl)s2)cc1	755270854	VJGMKEOJDOSUEO-UHFFFAOYSA-N	439.906	1.929	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)Nc1ccc(CCN2CCOCC2)cc1	756165438	QQZYHFFQOVUHNB-UHFFFAOYSA-N	443.460	1.701	50	20	IDGD	
COCCCn1ccc(NC(=O)NNC(=O)c2cc(-c3ccc(OC)c(OC)c3)[nH]n2)n1	756658499	KHHVWWBHSNVQHL-UHFFFAOYSA-N	443.464	1.793	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)Nc1cccc(N2CCCNC2=O)c1	756792408	KCLQOXIZTUCTKV-UHFFFAOYSA-N	438.492	1.466	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)[C@](C)(O)CN3Cc4ccccc4C3=O)n[nH]2)cc1	756811825	FCXKXRQFGZAYPS-HSZRJFAPSA-N	433.468	1.553	50	20	IDGD	
O=C(CC12CC3CC(CC(C3)C1)C2)NNC(=O)Nc1cnn(CCN2CCOCC2)c1	756826510	HVGKCTMIQHCCCZ-UHFFFAOYSA-N	430.553	1.975	50	20	IDGD	
C[C@@H]1CN(C(=O)Cn2cc(NC(=O)NNC(=O)c3ccc(Cl)nc3)cn2)C[C@@H](C)O1	756837079	FMEABXBXLJETKD-VXGBXAGGSA-N	435.872	1.034	50	20	IDGD	
CN(C)C(=O)c1cc(NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)ccc1F	757610982	OKGGBQOBZKSJLE-UHFFFAOYSA-N	429.456	1.387	50	20	IDGD	
O=C(NNC(=O)c1ccccc1O)Nc1cccc(S(=O)(=O)NCc2ccco2)c1	757863118	NWNWTPKSXOQSNL-UHFFFAOYSA-N	430.442	1.930	50	20	IDGD	
COc1ccc(OC)c(CCCNC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c1	758652461	SRXOXICAPQKZNV-UHFFFAOYSA-N	425.449	1.256	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccc(Br)cc21)C1CCN(c2ncccn2)CC1	759021017	UOGNLBZVKAIGQX-HNNXBMFYSA-N	446.305	1.779	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CN2CCO[C@@H](c3cccc(OC(F)F)c3)C2)c1	759365903	WNINVJIMQQKBJI-GOSISDBHSA-N	430.411	1.994	50	20	IDGD	
C[C@H](O)C[C@@H](CNC(=O)NNC(=O)c1csc(N2CCOCC2)n1)c1ccccc1	759608784	CSWBKLUYWSWPQF-HOCLYGCPSA-N	433.534	1.478	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cn1)c1cccc(S(=O)(=O)N2CCCCC2)c1	761785002	GNYRENLWHKWIEV-UHFFFAOYSA-N	433.446	1.239	50	20	IDGD	
CC[C@@H](NC(=O)NNC(=O)Cn1nc(C)cc1C)[C@@H]1CN(Cc2ccccc2)CCO1	761796504	YBTVOVITMASKJF-UXHICEINSA-N	428.537	1.510	50	20	IDGD	
O=C(NNC(=O)c1cc(F)c(O)c(F)c1)c1cccc(S(=O)(=O)N2CCCC2)c1	762543431	MRPMHVBSTSYOGQ-UHFFFAOYSA-N	425.413	1.530	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C2=NN(c3ccccc3)C(=O)[C@@H](C)N2)n[nH]1	763156179	XCCTVINYNLUKAZ-CYBMUJFWSA-N	447.455	1.185	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)C(=O)Nc1cccc(CN2CCCCC2)c1	763446000	NRJBSOMLWORLEB-UHFFFAOYSA-N	425.445	1.980	50	20	IDGD	
COCCOc1c(Cl)cccc1NC(=O)C(=O)NNC(=O)c1ccc2c(c1)OCO2	763550499	AWVBWVBXKBAIAM-UHFFFAOYSA-N	435.820	1.494	50	20	IDGD	
C[C@@H]1CN(Cc2ccccc2NC(=O)C(=O)NNC(=O)c2ccccc2F)C[C@@H](C)O1	763568460	LDCASLLEFMRAOU-HUUCEWRRSA-N	428.464	1.835	50	20	IDGD	
COc1cc(Br)cc(NC(=O)C(=O)NNC(=O)c2c(C)nc3ccccn23)c1	763629048	NXDLTCUYQBXHAA-UHFFFAOYSA-N	446.261	1.814	50	20	IDGD	
CS(=O)(=O)[C@H]1CCCN(C(=O)NNC(=O)c2ccc(Br)cc2Cl)C1	763661450	BRRWKRMUVJIVOQ-JTQLQIEISA-N	438.731	1.966	50	20	IDGD	
COC(=O)COc1cccc(NC(=O)C(=O)NNC(=O)COc2cc(C)ccc2C)c1	763665816	OUMAZIYJMYZFDI-UHFFFAOYSA-N	429.429	1.020	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc3c(cnn3C(F)F)c2)cc1	763674976	RVNFZGBQEMBORU-UHFFFAOYSA-N	428.355	1.468	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2ccc(-n3nc(C)cc3C)nc2)c1	763771898	GQPLTJTVRBSPSH-UHFFFAOYSA-N	438.444	1.301	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cnn(-c3cnc4ccccc4n3)c2)cc1	763811762	MLSAKWFPZLJFLO-UHFFFAOYSA-N	445.439	1.289	50	20	IDGD	
CCN1CCC(n2nccc2NC(=O)C(=O)NNC(=O)COc2ccc(C)cc2)CC1	763821469	QZFBTJDTALZLSG-UHFFFAOYSA-N	428.493	1.013	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1CC(CC(=O)NNC(=O)CNC(=O)c1cccnc1)C2	763823651	JTWNGTQXQNAXGI-IRXDYDNUSA-N	445.520	1.527	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)cc1N1CCOC1=O	763871601	GHPPCSHGUCLNRZ-CYBMUJFWSA-N	444.419	1.644	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccc(Sc3nccn3C)cc2)n1	763883298	ZLCGYDJKHAOWJD-UHFFFAOYSA-N	427.490	1.171	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3ccc(-n4cncn4)c(F)c3)cc2C1	763940366	GXWAGAOPVCKHPU-NSHDSACASA-N	442.476	1.992	50	20	IDGD	
Cc1nnc(-c2cccc(NC(=O)C(=O)NNC(=O)c3cc(Br)c[nH]3)c2)n1C	763996746	ZVLONTNTDILOEX-UHFFFAOYSA-N	446.265	1.281	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1ccc2nc(C(F)F)[nH]c2c1	764003320	BINOKBGKJXMRGI-UHFFFAOYSA-N	431.355	1.671	50	20	IDGD	
CN(C)C(=O)c1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)c1ccc2c(c1)OCCO2	764006163	LLXNOUFQYGILES-UHFFFAOYSA-N	446.847	1.213	50	20	IDGD	
Cn1ccnc1C(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)nc2)cc1	764093281	QXPJBDOKLURGQC-UHFFFAOYSA-N	426.820	1.099	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2ccc3nc4n(c(=O)c3c2)CCC4)cc1	764124088	BLPRZHDQQOEOEE-UHFFFAOYSA-N	449.467	1.070	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2ccc(N3CCOC[C@H]3C)cc2)cc1	764124737	OONCSETWSZRQDN-MRXNPFEDSA-N	440.500	1.639	50	20	IDGD	
CC(C)CNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cccc(C#N)c2)cc1Cl	764238799	XDKPZZOTJAOSBB-UHFFFAOYSA-N	441.875	1.997	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)C(=O)Nc1ccc(OCC(F)(F)C(F)F)nc1	764268222	MLDMHZGHELBCBQ-UHFFFAOYSA-N	429.330	1.084	50	20	IDGD	
CC(C)CCn1nccc1NC(=O)C(=O)NNC(=O)c1cc(Br)ccc1O	764281117	YSXCOHVKWSMXKA-UHFFFAOYSA-N	438.282	1.797	50	20	IDGD	
COc1ccc(Cn2nccc2NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)cc1	764348935	DPSHVRNGQQFTLG-UHFFFAOYSA-N	443.847	1.699	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)C(=O)Nc2ccc(Br)cc2Br)cn1	764359528	UXEPDUORBZZLEN-UHFFFAOYSA-N	445.071	1.345	50	20	IDGD	
CCOC(=O)c1cnn(-c2cccc(NC(=O)C(=O)NNC(=O)c3ccc(C)o3)c2)c1C	764370634	SWNYDBQYCBRXJE-UHFFFAOYSA-N	439.428	1.659	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(N2CCCCC2)c(Cl)c1	764397650	LMKQPUHJNRDURI-CYBMUJFWSA-N	426.901	1.468	50	20	IDGD	
CC(=NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1cccc(C(=O)O)c1	764648924	MXKIWPNWUMYRIA-UHFFFAOYSA-N	431.470	1.560	50	20	IDGD	
CCOc1ccc(C(=O)NNS(=O)(=O)c2cc3c4c(c2)CC(=O)N4CCC3)cc1OC	764932034	NECFSRMWMAGFCC-UHFFFAOYSA-N	445.497	1.553	50	20	IDGD	
COc1cc2c(cc1OC)CN(C(=O)CCC(=O)NNC(=O)Cc1ccccc1F)CC2	765469130	PKTRRLOJEOJDOE-UHFFFAOYSA-N	443.475	1.898	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)c1ccc2c(c1)NC(=O)[C@H](C)S2	767230999	FFDJHHGAFQRSEL-ZDUSSCGKSA-N	427.482	1.975	50	20	IDGD	
CC(C)(O)C(=O)NNC(=O)[C@@]12CCC(=O)N1c1ccccc1C(=O)N2Cc1ccccc1	768259066	FGSVHPXBUDCHFC-HSZRJFAPSA-N	436.468	1.084	50	20	IDGD	
CCc1ccc(-c2cc(-c3nnc(SCC(=O)NNC(=O)C4CC4)n3N)n[nH]2)cc1	768417216	RYCBVGGBAVXTFG-UHFFFAOYSA-N	426.506	1.261	50	20	IDGD	
C[C@@H]1CCCN(S(=O)(=O)c2cc(C(=O)NNC(=S)Nc3ccccn3)n(C)c2)C1	768579447	NUERDPSOQRJRSY-CYBMUJFWSA-N	436.563	1.472	50	20	IDGD	
CCCCS(=O)(=O)c1ccc(C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)cc1	768901146	SYFMOIAYKFFUCG-UHFFFAOYSA-N	443.481	1.750	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2ccc(OCC(F)(F)F)cn2)n1	768926484	GRQGLEUZRVVQNE-UHFFFAOYSA-N	432.380	1.335	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2cnn(C)c2Cc2ccccc2)c2ccccc2c1=O	770074671	ZHJVOCLQDDHMJK-UHFFFAOYSA-N	430.468	1.816	50	20	IDGD	
CCN1CCN(Cc2ccc(CNC(=O)NNc3nc(O)c4cnn(C)c4n3)cc2)CC1	770342055	QISIALDZGHOKSP-UHFFFAOYSA-N	439.524	1.033	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1ccc(Cl)c(S(=O)(=O)N(CC)CC)c1	771882212	NRBCMTUWWYXQPZ-LLVKDONJSA-N	433.914	1.473	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1ccc(S(=O)(=O)N2CCC[C@H](C)C2)cc1	771942280	WJIZCPUMAPEYMI-UONOGXRCSA-N	425.507	1.210	50	20	IDGD	
CCN1CCN(c2ccc(C(=O)NNC(=O)C(=O)NCc3ccc(Cl)cc3)cc2)CC1	772883915	GKNXXZAZLIKYFL-UHFFFAOYSA-N	443.935	1.559	50	20	IDGD	
COc1cc(Cl)ccc1NC(=O)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	773496029	JMDUDKIJJFMZTF-UHFFFAOYSA-N	432.868	1.141	50	20	IDGD	
Cc1ccc(C(=O)NNS(=O)(=O)c2cc(Cl)ccc2CS(C)(=O)=O)c(O)c1	774613018	ASZKTTVHOYNYKQ-UHFFFAOYSA-N	432.907	1.522	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccccc2OC(F)(F)F)c1	775521313	HHNLFEMXAOXOCB-UHFFFAOYSA-N	431.392	1.910	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(OCC(=O)NNC(=O)c2nnc(O)c3ccccc23)CC1	777085949	MDKWMKOCJPELOU-UHFFFAOYSA-N	445.476	1.513	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)COc1ccc(C=O)cc1Br	778438761	XVKPJYXFUDRYGG-UHFFFAOYSA-N	430.255	1.313	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)C2CCC2)ccc1I	778566271	NFSOJUWAZZAXCI-UHFFFAOYSA-N	438.243	1.187	50	20	IDGD	
O=C1CCc2cc(NC(=O)C(=O)NNC(=O)c3cc(Br)c[nH]3)c(F)cc2N1	778710185	NYGRYOZRPFFIFF-UHFFFAOYSA-N	438.213	1.201	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2ccc(Br)cc2S(C)(=O)=O)nc1	782148538	YSTZIELFUCSOJS-UHFFFAOYSA-N	443.279	1.338	50	20	IDGD	
Cn1cc(NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c(C(F)(F)F)n1	782807787	GGQCPNMCFMNSTE-UHFFFAOYSA-N	439.442	1.804	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)cc1)C(=O)Nc1cc(Cl)ccc1N1CCSCC1	782835779	FDNSVMQGKLCGJE-UHFFFAOYSA-N	434.905	1.999	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)C(=O)Nc1cc(F)cc(Cl)c1	782896602	KQYFACUHGLWBRX-UHFFFAOYSA-N	441.872	1.480	50	20	IDGD	
CN1CCN(C(=O)Cc2ccc(NC(=O)C(=O)NNc3cccc4c3CCCC4)cc2)CC1	783450998	BOACPEAKOUCNCA-UHFFFAOYSA-N	449.555	1.964	50	20	IDGD	
CS(=O)(=O)CCSc1cc(Br)ccc1C=NNC(=O)C(=O)NC1CC1	783816718	VHRNSJPDLYXLIO-UHFFFAOYSA-N	448.364	1.315	50	20	IDGD	
CN(Cc1ccccc1)S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccccn2)cc1	784798083	MKLMZJYFWWIDRD-UHFFFAOYSA-N	439.497	1.984	50	20	IDGD	
O=C(NNc1cccnc1Cl)C(=O)N1C[C@@H](C(=O)N2CCCCC2)Oc2ccccc21	784838836	FURHXPWOVDQHPR-KRWDZBQOSA-N	443.891	1.985	50	20	IDGD	
C[C@H]1CCCN(S(=O)(=O)c2ccc(NC(=O)C(=O)NNc3ncc(F)cn3)cc2)C1	784955078	AHYDKJOELSGTKR-LBPRGKRZSA-N	436.469	1.118	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)OCc2nc3c(=O)n(C)c(=O)n(C)c3[nH]2)c(C)n1CC(C)C	785035320	LBQCEHBETCZCKV-PXNMLYILSA-N	438.488	1.685	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc(-n4ccnc4)nc3)n[nH]2)c1	785130555	UNDSHQAPNGWAAO-UHFFFAOYSA-N	444.455	1.674	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccccc2CNC(=O)/C(C#N)=C\c2ccc(O)cc2)CC1	787373781	KLSDABCYAISFHV-RGEXLXHISA-N	440.525	1.552	50	20	IDGD	
Cc1cc(C(=O)N2CCC[C@@H]2C(=O)NNc2ccc(-n3ccnc3)nn2)ccc1[N+](=O)[O-]	788178514	RVTWNLAYTZSGHN-MRXNPFEDSA-N	436.432	1.627	50	20	IDGD	
Cc1nn(-c2ccc(Cl)cc2)c(NC(=O)C(=O)NNC(=O)Cc2cccnc2)c1C	792268884	OVHADOPCYUYSPA-UHFFFAOYSA-N	426.864	1.866	50	20	IDGD	
Cc1cccc(NC(=S)NNC(=O)Cn2c(CS(C)(=O)=O)nc3ccccc32)c1	792959877	HITUDTKHRNOWJY-UHFFFAOYSA-N	431.543	1.907	50	20	IDGD	
CSCc1ccc(NC(=O)C(=O)NNC(=O)CNC(=O)OCc2ccccc2)cc1	797369063	NFILRAIXCXDMHO-UHFFFAOYSA-N	430.486	1.562	50	20	IDGD	
CC(C)Oc1cc(F)ccc1NC(=O)C(=O)NNC(=O)CNC(=O)OCc1ccccc1	797369431	WQIXOVDJUUVAHI-UHFFFAOYSA-N	446.435	1.625	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2cc3cnn(CC)c3nc2C)c2ccccc2c1=O	799295885	BIMFBZGBMPCVOQ-UHFFFAOYSA-N	433.472	1.954	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@@H](C(=O)NNC(=O)Nc2ccc(Cl)cc2)[C@H](C)O)cc1	802017833	BKBQPFCIOVCZLB-BLLLJJGKSA-N	440.909	1.529	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)[C@@H]2CCCN2C(=O)c2ccc3c(c2)OCO3)cc1	802053354	PEPPYTZNLVNKKY-INIZCTEOSA-N	426.429	1.881	50	20	IDGD	
CN(CC(=O)NNC(=O)Nc1c(Cl)cc(Cl)cc1Cl)[C@H]1CCS(=O)(=O)C1	802069340	HDUMKJBFOKETQA-VIFPVBQESA-N	443.740	1.918	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccccc1)NNC(=O)Cc1nc(-c2ccccc2)cs1	802578830	JEXYMCIQKCZYQI-UHFFFAOYSA-N	444.538	1.869	50	20	IDGD	
Cc1c(C(=O)NNc2ccccc2S(=O)(=O)NC(C)(C)C)nnn1Cc1ccncc1	802828321	ZUHNJHIWANQIST-UHFFFAOYSA-N	443.533	1.864	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2nc(C3CCOCC3)cs2)cc1OC	806975169	PMZYKUAUQFROOB-UHFFFAOYSA-N	448.501	1.844	50	20	IDGD	
CSCc1ccc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1	807538099	MFQQAAPGYZRCBA-UHFFFAOYSA-N	436.559	1.944	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCC(=O)NNC(=O)CC2CCCC2)cc1OCC	810282424	WDZUIWVIWQJSAM-UHFFFAOYSA-N	427.523	1.490	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCC(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)cc1C	810812232	AJLPLKOEIQSXBI-UHFFFAOYSA-N	442.538	1.034	50	20	IDGD	
Cc1ccc(C)c(S(=O)(=O)NCC(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)c1	811461484	CYSRXPDCGAXTST-AWEZNQCLSA-N	439.921	1.850	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NN=C1CCCC[C@H]1[C@@H]1CCCN1C(=O)OC(C)(C)C	811642076	YGXQTDBVYQHDOH-LZWOXQAQSA-N	430.571	1.986	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2cccc(CN3CCNC(=O)C3)c2)cc1Cl	812987157	HRISYRFGGAVECF-UHFFFAOYSA-N	431.880	1.362	50	20	IDGD	
Cc1c(C(=O)NNC(=S)Nc2cccc(Br)c2)nnn1-c1ccn(C)n1	814405000	QJYQOVHPGTWPTD-UHFFFAOYSA-N	435.311	1.703	50	20	IDGD	
O=C(NN=Cc1cc2cccnc2n1S(=O)(=O)c1ccccc1)[C@@H]1CCS(=O)(=O)C1	814781318	FFLWLEVEWBCTFJ-OAHLLOKOSA-N	446.510	1.158	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccc(N(C(C)=O)[C@@H]2C[C@@H]2C)cc1	815568550	MHMNDBCGZXJGJS-IFXJQAMLSA-N	438.484	1.785	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCc2nncn2C1)C(=O)Nc1ccc2c(c1)OC1(CCCCC1)O2	815692342	OSRCISSGKXJIBC-CYBMUJFWSA-N	440.460	1.058	50	20	IDGD	
Cc1c(NC(=O)CSCC(=O)NCCCSC#N)c(=O)n(-c2ccccc2)n1C	816539350	CEKMPBHIECWNCC-UHFFFAOYSA-N	433.559	1.877	50	20	IDGD	
COC(=O)c1cc(NNC(=O)CN2C(=O)N[C@@](C)(c3ccc(F)cc3)C2=O)ccc1C	816688190	HKXBYKDUTZWACY-NRFANRHFSA-N	428.420	1.831	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NN=C1CCn3cccc31)N(S(C)(=O)=O)CC2	818257144	IAMIIRQZMXTLEU-SFHVURJKSA-N	446.529	1.678	50	20	IDGD	
O=C(CCNc1ccccc1[N+](=O)[O-])NNC(=O)CCN1CCN(c2ccccc2)CC1	818808655	VXYOQWRWJDMJPG-UHFFFAOYSA-N	440.504	1.757	50	20	IDGD	
O=C(CN1CCN(Cc2cccc3cccnc23)CC1)NNC(=O)c1cccc([N+](=O)[O-])c1	897330524	WDGWHQVETLNKPE-UHFFFAOYSA-N	448.483	1.722	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)NCC(=O)NNC(=O)CC23CC4CC(CC(C4)C2)C3)cc1	913500063	JHALFVLMKUBGDJ-UHFFFAOYSA-N	447.557	1.921	50	20	IDGD	
Cn1cc(S(=O)(=O)N2CCCCC2)cc1C(=O)NNC(=O)Cc1c[nH]c2ccccc12	914846159	AJQHOKBDIIOYTL-UHFFFAOYSA-N	443.529	1.685	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)CNS(=O)(=O)c2ccc3c(c2)OCCCO3)cc1	915784359	XBPXCWCPVQJQEE-UHFFFAOYSA-N	433.486	1.150	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)NNC(=O)NCCN1CCN(Cc2ccccc2)CC1	915901912	NPHSLCPRQONOJV-UHFFFAOYSA-N	434.544	1.859	50	20	IDGD	
Cc1cnn(-c2ccc(C(=O)NNC(=O)c3ccc(Cl)c(S(N)(=O)=O)c3)cc2)c1	916133256	AUPQHHRXKNILPY-UHFFFAOYSA-N	433.877	1.556	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)NCc2ccc(C(=O)N3CCOCC3)cc2)c1	916247824	HJYBBLWCTDOQCW-UHFFFAOYSA-N	442.472	1.320	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)CCOc2ccccc2[N+](=O)[O-])c2ccccc2c1=O	917565626	RYPDFYKLPMPXAG-UHFFFAOYSA-N	439.428	1.945	50	20	IDGD	
O=C(CNC(=O)NC1CCCCC1)NNC(=O)COc1ccc(Br)cc1	917907639	FBIYRVTTYLVFLI-UHFFFAOYSA-N	427.299	1.607	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)CCSc2nnnn2C)c2ccccc2c1=O	917920195	OPNYPWOOLXEPAF-UHFFFAOYSA-N	444.521	1.054	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2ccc([N+](=O)[O-])c(Br)c2)cc1	1319301625	YXACIKPURBPGTK-UHFFFAOYSA-N	430.236	1.989	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)N[C@@H]1CCO[C@@]2(CCSC2)C1	1319345115	TUSSNDDZPXLYDV-ACJLOTCBSA-N	441.579	1.287	50	20	IDGD	
Cc1nc(S(=O)(=O)N2CCC(C(=O)NNc3ccc4c(=O)[nH]ccc4c3)CC2)cn1C	1322132408	HIIKJDSULVHIHX-UHFFFAOYSA-N	444.517	1.114	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CC(=O)N(c2ccc(F)cc2F)C1)c1cncn1-c1ccccc1	1322657186	WKNBWCUROOACMX-CYBMUJFWSA-N	425.395	1.965	50	20	IDGD	
C[C@H](CNC(=O)OC(C)(C)C)C(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1	1327889469	IISCKJVROHPZMZ-CYBMUJFWSA-N	428.530	1.942	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(CCN(C(=O)/C=C3\C(=O)Nc4ccccc43)C2)C1	1778905467	GFRPOTNBLDSHGW-TWMGVTGTSA-N	443.576	1.704	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](C)Nc3cnccn3)C2)C1	1779053111	ZEQWEOFRCMSNQH-QWQRMKEZSA-N	440.342	1.138	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(Cl)ncn3)C2)C1	1779815727	HKCZIADPLTYDCY-BZNIZROVSA-N	431.718	1.605	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cn1ccccc1=O)C2	1780712631	BTUQMOBPQOFWOF-CDHQVMDDSA-N	444.359	1.599	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)[C@H](O)Cc3ccccc3)CCO2)C1	1781233055	PHRCZBXRZHPHMV-UXPWSPDFSA-N	429.344	1.656	50	20	IDGD	
O=C(CCc1cc(F)ccn1)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781326806	UWLLMOTYQOHMJI-DOTOQJQBSA-N	432.265	1.674	50	20	IDGD	
O=C(CCCc1ccncc1)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781327132	XIHHSSMLYZRUMM-FUHWJXTLSA-N	428.302	1.925	50	20	IDGD	
Cc1c(F)ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)c1N	1781330803	GOEJCQDGRTXWDF-RHSMWYFYSA-N	432.265	1.850	50	20	IDGD	
O=C(c1c(F)ccc(O)c1F)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781334213	WFBFKVRUVSKCFW-XJKSGUPXSA-N	437.212	1.804	50	20	IDGD	
O=C(c1cc(F)cc([N+](=O)[O-])c1)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1781768174	CXTFPVIUHQFVGY-XJKSGUPXSA-N	448.220	1.868	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CNC(=O)OC)C2	1781903893	GLUVJUYZSZHCLQ-PBFPGSCMSA-N	434.331	1.030	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1c[nH]c3nccc-3c1)C2	1782172694	KKASOCUXVGPKSX-CSODHUTKSA-N	434.924	1.896	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)CCn3nc(C)cc3C)CCO2)C1	1783355429	RNPBPBKHDYRCGH-LPHOPBHVSA-N	441.370	1.893	50	20	IDGD	
COc1ccc(OCC(=O)N2CCO[C@]3(CCN(C(=O)[C@H](C)Br)C3)C2)cc1	1783527395	BRIRYRLXUAFADF-IFXJQAMLSA-N	441.322	1.687	50	20	IDGD	
O=C(/C=C/c1cc(F)c(F)c(F)c1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1783716801	VAWSVFCYTYECCK-FFNBLRSRSA-N	432.826	1.547	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1C[C@H]1c1ccc(F)cc1)CCO2	1783932724	BGRHZQNKDADLCO-YYDVJCTNSA-N	446.523	1.132	50	20	IDGD	
CCOC(=O)N1CCC(C(=O)N2CCO[C@]3(CCN(C(=O)C(Cl)Cl)C3)C2)CC1	1783951881	LCJNOBINTWYDQX-SFHVURJKSA-N	436.336	1.489	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)COc3cccnc3)C[C@@H]21	1783968657	FCUOVVPZOBMNHB-OHFALNGGSA-N	440.338	1.471	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(Cl)nn3)C[C@@H]21	1783970599	XGBFIYWEXDYITL-MNXVOIDGSA-N	445.745	1.754	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3cc(C)n(C)n3)[C@H]2C1	1784243108	VWAXWOLOWOXTJK-LLLHUVSDSA-N	441.370	1.424	50	20	IDGD	
Cc1cccc(C(=O)N2CC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)c1Cl	1785028466	QPWBTHIGPCWSQX-QFIPXVFZSA-N	442.708	1.086	50	20	IDGD	
Cc1nc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Br)C[C@@H]32)ccc1F	1785626239	RQPQZFKXKCBPRG-GVARAGBVSA-N	432.265	1.813	50	20	IDGD	
CN1CCC(C(=O)Nc2ccc(C3(NC(=O)CCC(=O)NN(C)C)CCC3)cc2)CC1	1785879224	RKJZLFRRNBPIES-UHFFFAOYSA-N	429.565	1.835	50	20	IDGD	
CC(C)n1cnc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCBr)[C@H]3C2)n1	1786406827	IZFNATQWIWDXHQ-IHRRRGAJSA-N	428.331	1.237	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CC(F)(F)C(=O)O)[C@H]2C1	1787436491	CBMZVCXEEVBFLX-VEABSNGSSA-N	431.263	1.312	50	20	IDGD	
COC(=O)C1(C(=O)NC2(c3ccc(NC(=O)c4ccc(B(O)O)cc4)cc3)CCC2)CC1	1788143540	LYFMTUITMDXURK-UHFFFAOYSA-N	436.273	1.067	50	20	IDGD	
Cc1nccnc1C(=O)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1	1789895272	IFBCDXDDOLELEX-UHFFFAOYSA-N	430.273	1.526	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnn4ccccc34)C[C@@H]21	1791057209	IQOZCNIABGMSJR-RMRKRWHISA-N	435.322	1.711	50	20	IDGD	
COc1cccc(CCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]3C2)n1	1791294299	VHQZNJNXXHCPFC-QEJZJMRPSA-N	430.332	1.806	50	20	IDGD	
CCSc1ncccc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](Cl)COC)C2	1792399838	XYNQOPAIUVIEJI-XRGAULLZSA-N	427.954	1.651	50	20	IDGD	
Cc1snc2sc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@@H](O)CCl)cc12	1792976719	KYVIIOMSFXTKKW-QPPBUOOMSA-N	429.951	1.469	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc3ccc(Cl)cc3c1)C2)[C@@H](O)CCl	1792980404	ODYQFENYAQHUNK-DACLVMHWSA-N	438.311	1.691	50	20	IDGD	
COc1cc(OC)c(F)c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Cl)C3)c1F	1795490354	NLWPVCKZFYBEQP-PSNKQFAISA-N	436.814	1.720	50	20	IDGD	
CC[C@@H](NC)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2	1796179193	RPGMLWDTXQYIRD-BASYENTBSA-N	432.477	1.770	50	20	IDGD	
O=C(Cc1ccc2c(c1)CCC2)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1	1796190181	YKDVKWGHBWQPCC-NUNAXRQHSA-N	432.329	1.350	50	20	IDGD	
COc1cc(N2CCC(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)[C@H](F)Cl)CC2)ncn1	1796804385	KVPWAXYYWQPRFL-KRXQYRFLSA-N	439.919	1.874	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnc2cc(C)ccn2c1=O	1797065856	VERUHNQMPHEROC-HIRMHNASSA-N	446.935	1.614	50	20	IDGD	
Cc1csc(CCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)c1	1798440694	LFPWJSVWGDOBCO-MUJYYYPQSA-N	441.557	1.940	50	20	IDGD	
C[C@@H](Cc1ccco1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnccc1C(=O)NN	1798443552	HNXGOCKDUHMSIA-JONQDZQNSA-N	425.489	1.409	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](NC(=O)OC)c1ccccc1)C2	1799264447	KXLUZBLJXJKKHD-CWQOZTLDSA-N	437.924	1.691	50	20	IDGD	
C[C@H](Nc1ccccn1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@](C)(Cl)CCl	1799275685	AFTAEBMWXKNDTR-MABMQTIPSA-N	429.348	1.708	50	20	IDGD	
COc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@](C)(Cl)CCl)ccc1O	1799277884	UVOWXHRPAQLFIZ-AODNKKSCSA-N	431.316	1.840	50	20	IDGD	
Cc1cc(C)n(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@](C)(Cl)CCl)n1	1799278715	WPIFASVSGDQKGE-LORHWOILSA-N	431.364	1.716	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc2c(c1)NC(=O)[C@H](C)O2	1799293751	LRSRGIDTVFFRKH-HVQZGBDUSA-N	435.908	1.912	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](O)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@](C)(Cl)CCl	1800081670	AQJDLWKYPSVARN-DYNNSRMTSA-N	438.352	1.704	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCCNC(=O)OC(C)(C)C	1802122937	BTJFCKRQOTXPJP-IVSAIRAKSA-N	447.960	1.135	50	20	IDGD	
COc1nc(C)ccc1C(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1	1803141993	VXAWXSZKPPZXTG-NJAFHUGGSA-N	432.908	1.713	50	20	IDGD	
Cc1cccnc1C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1803800419	RJYVXKHHHOFGLV-KNQAVFIVSA-N	444.300	1.098	50	20	IDGD	
C[C@H](CS(C)(=O)=O)C(=O)N1CCCC2(CCN(C(=O)[C@@H](F)Br)CC2)C1	1806046583	MBEGNDCTQHLOII-CHWSQXEVSA-N	441.363	1.589	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC2(CCCN(C(=O)c3ccc(F)s3)C2)CC1	1807282582	YZENWIXZEGHWDF-UHFFFAOYSA-N	430.310	1.726	50	20	IDGD	
CC(C)[C@H](S)C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1807359100	DTGPEUWTPZBIRK-SXLOBPIMSA-N	441.362	1.035	50	20	IDGD	
Cc1ccncc1C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1807361947	JYLXLFXPJUNCON-SIKLNZKXSA-N	444.300	1.098	50	20	IDGD	
CC1=CC[C@H](C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)CC1	1807376764	WFKIYPBTKRIJBI-ZEYPLWLESA-N	447.344	1.827	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC2(CCCN(C(=O)[C@@H]3CNc4ccccc43)C2)CC1	1809801568	DHXAPBWGVVEJSJ-OAQYLSRUSA-N	447.344	1.421	50	20	IDGD	
O=C(COc1ccccc1)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1	1809968309	RGWVWGNINDKVDC-UHFFFAOYSA-N	436.317	1.290	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)[C@H]2CCCSC2)[C@H]1c1cccnc1	1813074763	UTEXOBRVNWCVRK-WFXMLNOXSA-N	447.605	1.604	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)CCc2ccoc2)[C@H]1c1cccnc1	1813528517	NGGXYBUDJMJCKS-WMZHIEFXSA-N	441.532	1.686	50	20	IDGD	
CCS(=O)(=O)CC(=O)Nc1cc([C@H]2CCCCN2C(=O)CCBr)[nH]n1	1815170476	NURQIJWKGALERT-GFCCVEGCSA-N	435.344	1.622	50	20	IDGD	
Cc1cn(CC(=O)N2CCCC[C@@H]2c2cc(NC(=O)[C@H](F)Cl)n[nH]2)c(=O)nc1O	1818045376	UIRRJKLPAVVFPJ-RISCZKNCSA-N	426.836	1.207	50	20	IDGD	
Cn1cc(F)cc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1818385146	NTIQSXGNUGYUCA-KRWDZBQOSA-N	439.256	1.187	50	20	IDGD	
Cc1cc(C(=O)NCC(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@H](F)Cl)CC3)no1	1819931074	CMLSUCPGGKFNRH-OQPBUACISA-N	429.861	1.316	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1cccc(F)c1	1820489545	SNQYMPHZGMRBOM-LJQANCHMSA-N	436.252	1.848	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CS(C)(=O)=O)[nH]n1	1820864156	RMPMFDGNKWMOTJ-NHYWBVRUSA-N	425.338	1.683	50	20	IDGD	
C[C@H](Br)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccnc2C(N)=O)[nH]n1	1822186345	KYXIPJPRBHOPDP-GXFFZTMASA-N	449.309	1.993	50	20	IDGD	
CCc1oncc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1	1822412933	KJMYNUUSMANFRW-OAHLLOKOSA-N	431.497	1.639	50	20	IDGD	
Cc1nccn1CC(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1	1823009220	MWCABEHJTLSJNE-NOZJJQNGSA-N	430.303	1.951	50	20	IDGD	
C=CCO[C@H](C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1	1824504924	VZRCKGFTWUOMED-DYESRHJHSA-N	428.338	1.191	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](N)Cc1cscn1)CC2	1825998872	OEDGYKUPASJWSV-DLOVCJGASA-N	443.982	1.335	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1nn(C)c3c1CCC3)CC2	1825999768	CLQWBZHPVLBZIB-PWSUYJOCSA-N	437.953	1.845	50	20	IDGD	
O=C1C[C@@H](C(=O)N2CCC([C@@H]3CCCCN3C(=O)CCBr)CC2)CCN1	1826360781	VIICEMJXQNFIKO-HOTGVXAUSA-N	428.371	1.917	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)CCc3ccoc3)sc2C1	1827114656	NUCZRYFAIXUJKH-AWEZNQCLSA-N	433.534	1.654	50	20	IDGD	
CC(=O)N1CCN(CC(=O)N2CCCC[C@H]2C2CCN(C(=O)[C@@H](F)Cl)CC2)CC1	1828493034	PJOJWIMTUKIBIH-PKOBYXMFSA-N	430.952	1.305	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnncc2C(=O)O)CC1	1829254666	JLGHYHVOOJUNFI-DLBZAZTESA-N	438.912	1.662	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)COc3ccccc3OC)CCO2)C1	1830229618	XZUNYFUGIUWLFK-HRAATJIYSA-N	440.924	1.548	50	20	IDGD	
Cc1nccn1CC(=O)N1CCCC[C@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1	1831185933	NRTJXEFEPSJZPB-IBGZPJMESA-N	432.569	1.184	50	20	IDGD	
O=C(CNCP(=O)(O)O)N1CCC([C@@H]2CCCCN2C(=O)C(Cl)Cl)CC1	1831877892	FZPFZYINKGTYCW-LBPRGKRZSA-N	430.269	1.135	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccnc(F)c1)CCO2	1831903515	WLBGZDDVCOOUGY-IBGZPJMESA-N	425.533	1.142	50	20	IDGD	
Cc1nccn1[C@H](C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1	1832314744	WTABINVYSARKDJ-YLJYHZDGSA-N	446.596	1.745	50	20	IDGD	
CC(=O)N(C)[C@@H](C)C(=O)N1CCC(N2CCC(NC(=O)C(C)(C)CCl)CC2)CC1	1833215149	BWIXHVFARTUNIS-HNNXBMFYSA-N	429.005	1.690	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)CCl)CC2)CC1	1833306677	WZNAMHUVZJSJNW-DOMZBBRYSA-N	438.794	1.189	50	20	IDGD	
Cc1oncc1C(=O)NC1CCN(C2CCN(C(=O)[C@H](C)Br)CC2)CC1	1834242736	UZOGWHYHSQFXEL-LBPRGKRZSA-N	427.343	1.952	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccc(F)cn3)CCO2)C1	1836030270	WHDMSGHRRNLAEH-PXNSSMCTSA-N	427.904	1.627	50	20	IDGD	
CSc1ncccc1C(=O)NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836035509	ZATOFNCLFJACGQ-KRWDZBQOSA-N	440.997	1.588	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](C)NC=O)CC2)CC1	1836672920	GEROJIMRIGGQJZ-ZIAGYGMSSA-N	432.359	1.151	50	20	IDGD	
Cc1nc(C(=O)N2CCOC[C@@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)ccc1F	1837712481	UKMVMIDMCCMFHL-HXUWFJFHSA-N	439.560	1.451	50	20	IDGD	
Cc1ncncc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1	1838094706	HWKPVGNCGZXHIF-QZTJIDSGSA-N	431.320	1.091	50	20	IDGD	
CN(C)c1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)c1	1838924786	IKZSKLZYDFGDDZ-JOCHJYFZSA-N	449.624	1.674	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(OC)cc3C)CCO2)C1	1839026381	WETZQVQBBWKXCA-WIYYLYMNSA-N	440.924	1.327	50	20	IDGD	
O=C(CC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1)Nc1ccc(F)cc1	1839029542	RXVCELZROAPRRZ-MJGOQNOKSA-N	445.850	1.145	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(OC)cc3O)C2)C1	1839145689	CKQSCMUORPRJMB-UZLBHIALSA-N	426.897	1.488	50	20	IDGD	
CC(C)[C@H]1CC[C@H](C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)CC1	1839974496	OLJVCIPNEFVNKJ-RYLXDESZSA-N	430.973	1.505	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(OC)cc3C)C2)C1	1840154306	RUINJVUDMDONPJ-NQIIRXRSSA-N	440.924	1.327	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCCCCC(=O)OC)CCO2)C1	1840233927	CTLXNKHMOWYICD-UWJYYQICSA-N	446.972	1.974	50	20	IDGD	
COc1ccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)cc1F	1840526506	IXWMLVMELKMASA-PKOBYXMFSA-N	432.851	1.368	50	20	IDGD	
C[C@@]1(C(=O)N2CCO[C@]3(COCCN(C(=O)CCBr)C3)C2)CC=CCC1	1840553133	GUTJDXZEBMZLAH-MOPGFXCFSA-N	429.355	1.974	50	20	IDGD	
CC(C)N1CCC[C@H]1C(=O)N1CCO[C@@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1	1840583280	FUTCFAWIMASGAF-GHTZIAJQSA-N	441.645	1.167	50	20	IDGD	
Cc1cc(CC(=O)N2CC3(CCCN3C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)no1	1841925475	ZPKUCCQTCCZAGP-HNNXBMFYSA-N	440.928	1.861	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@H]1C[C@](C)(O)CN1C(=O)OC(C)(C)C)C2	1845167849	XDEMQRNRRAROCY-SIFCLUCFSA-N	443.972	1.968	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@H]2Cc3[nH]nc(C(F)(F)F)c3C2)C1	1845858691	KDYXPMFHTMVFON-ZYHUDNBSSA-N	434.846	1.601	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@]2(C[C@H]2C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](O)CCl)C1	1847564140	RMAIWOVBFDKKDL-UFJVTBDRSA-N	441.956	1.435	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H]2CC[C@@H]1[C@@H](C(=O)N1CC[C@H]3[C@@H]1CCN3C(=O)[C@@H](O)CCl)C2	1847568119	BGBBOBBLZDVLLS-WBAHDQRJSA-N	441.956	1.576	50	20	IDGD	
CCC(CC)(CC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)C(=O)O	10167616	QBOPRHWHOXSHER-UHFFFAOYSA-N	425.507	1.513	50	20	IDGD	
Cc1ccc(S(=O)(=O)NC(C)(C)C)cc1C(=O)NNC(=O)c1ccc2c(c1)OCO2	26963422	FEDWVVOPVSKIMQ-UHFFFAOYSA-N	433.486	1.875	50	20	IDGD	
Cc1cc(C(=O)NNS(=O)(=O)c2ccc3[nH]c(=O)[nH]c3c2)c(C)n1-c1ccccc1	60486880	PKRWRKXBERMTIY-UHFFFAOYSA-N	425.470	1.887	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2cc(C#N)cn2C(C)(C)C)c1	725853537	UVRNYVPUCNLYTJ-UHFFFAOYSA-N	432.506	1.832	50	20	IDGD	
CCOCC(C)=NNC(=O)C[C@H]1c2cc(OC)c(OC)cc2CCN1S(C)(=O)=O	726424254	RCPMZSJTEMXPAP-INIZCTEOSA-N	427.523	1.481	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)Cc1nc(-c2ccccc2)cs1)N1C(=O)NC2(CCCC2)C1=O	726524949	RFKQXIAWCBEAIX-ZDUSSCGKSA-N	441.513	1.753	50	20	IDGD	
Cc1occc1C(=O)NC1CCN(CC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)CC1	727436715	GYYIJMFRBFLLHY-UHFFFAOYSA-N	429.433	1.152	50	20	IDGD	
CNS(=O)(=O)c1cccc([C@H](C)NC(=O)NNC(=O)Cc2c[nH]c3ccccc23)c1	727610817	TZRTXPUWWNPNIY-ZDUSSCGKSA-N	429.502	1.710	50	20	IDGD	
O=C(NNc1nc(-c2cccnc2)no1)[C@@H]1CCCN(S(=O)(=O)c2ccc(F)cc2)C1	728079455	VPJLWUSZYAAAMZ-CQSZACIVSA-N	446.464	1.815	50	20	IDGD	
C[C@@H]1Cc2ccccc2N1Cc1ccoc1C(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1	728518491	UTKZEMYVABFOIZ-CZUORRHYSA-N	432.502	1.362	50	20	IDGD	
O=C(NNC(=O)N1CCCN(c2nccs2)CC1)c1csc(N2CCOCC2)n1	728945166	UDKJTOAYIUYARQ-UHFFFAOYSA-N	437.551	1.003	50	20	IDGD	
COc1ccnc(N2CCN(CC(=O)NNC(=O)c3cc(Cl)ccc3OC)CC2)c1	729482443	IWXHWNMMHKYCAT-UHFFFAOYSA-N	433.896	1.335	50	20	IDGD	
Cc1cc(COc2ccc(C=NNC(=O)N[C@H]3CCS(=O)(=O)C3)cc2)oc1C(=O)O	729932924	OGLFGMQUMVRMJE-AWEZNQCLSA-N	435.458	1.685	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)NCCOc1ccc(S(C)(=O)=O)cc1	730066993	RDDBDBDIOVCFAI-UHFFFAOYSA-N	431.474	1.069	50	20	IDGD	
O=C(CCNC(=O)c1ccc(Br)cc1)NNC(=O)COc1ccccc1O	730780899	YCFYWDZSJVRPIR-UHFFFAOYSA-N	436.262	1.501	50	20	IDGD	
CC(C)(C(=O)NNC(=O)N1CCN(S(=O)(=O)Cc2ccccc2)CC1)c1ccccc1	731221925	JSNILTXCVLQXGB-UHFFFAOYSA-N	444.557	1.853	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)N1CCN(S(=O)(=O)c2ccccc2Cl)CC1	731849336	WODRXOBYHGUPOF-AWEZNQCLSA-N	430.958	1.228	50	20	IDGD	
O=C(NN=C1CCS(=O)(=O)c2cc(F)c(F)cc21)c1csc(N2CCOCC2)n1	731924067	QIDUUAPPVSMKBE-UHFFFAOYSA-N	442.469	1.569	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NC[C@H]2CN3CCC[C@@H]3CO2)cc1Br	732246288	PLKMITCGRBKPPM-OLZOCXBDSA-N	427.299	1.265	50	20	IDGD	
Cc1cc(C)nc(SCc2ccc(C(=O)NNC(=O)C3CCS(=O)(=O)CC3)cc2)n1	732932224	NUMJFKFOXBKYDI-UHFFFAOYSA-N	448.570	1.972	50	20	IDGD	
Cc1csc([C@](O)(CC(=O)NNc2nc3ccccc3c(=O)n2C)C(F)(F)F)n1	733260991	VURFEASGBBFWDW-MRXNPFEDSA-N	427.408	1.982	50	20	IDGD	
CCOc1cc(CNC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)ccc1OC	734007413	UAHVUNAWASPTGV-UHFFFAOYSA-N	449.533	1.840	50	20	IDGD	
Cc1ccc2ncc(C(=O)NNc3ccccc3S(=O)(=O)NC(C)(C)C)c(=O)n2c1	734251621	KDCAKOHIIJDLFI-UHFFFAOYSA-N	429.502	1.837	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)N[C@@H]2CCN(C3CC3)C2)c2ccccc2c1=O	734285629	QGHSPPSAOUVVKT-OAHLLOKOSA-N	426.521	1.767	50	20	IDGD	
COc1ccc([C@H]2[C@H](C(=O)NNC(=O)COc3ccc(F)cc3)CCC(=O)N2C)cc1	734418706	HEVZVBAOIJBXEV-NQIIRXRSSA-N	429.448	1.970	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)N[C@H]2CC(=O)N(c3ccc(Oc4ccccc4)cc3)C2)cn1	735583214	WNRVXDKYZOMMJJ-INIZCTEOSA-N	434.456	1.962	50	20	IDGD	
COC(=O)c1cc(Br)cc(S(=O)(=O)NNC(=O)NCc2ccco2)c1	736062787	JLQDBMVHRNVNSJ-UHFFFAOYSA-N	432.252	1.521	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1cccc(Oc2cnccn2)c1	736543184	FUKLYGIZGALCTL-UHFFFAOYSA-N	440.485	1.945	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNS(=O)(=O)c1c(C(=O)OC)sc2ccccc12	740812275	ARNIJWNOQZHJST-UHFFFAOYSA-N	427.504	1.302	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCCCOC[C@@H]1CCOC1	740903206	JMKVVALJJIUIKG-KGLIPLIRSA-N	444.326	1.990	50	20	IDGD	
CCn1c(=O)c(C(=O)/C(C#N)=C/c2cnn(CCOC)c2)c(N)n(Cc2ccccc2)c1=O	742350188	SGXHGXZFKGXFND-WOJGMQOQSA-N	448.483	1.293	50	20	IDGD	
CC(C)(C)c1nc2ccc(S(=O)(=O)NNC(=O)CNC(=O)c3ccco3)cc2s1	743255672	MJONRXNDDWUSBP-UHFFFAOYSA-N	436.515	1.926	50	20	IDGD	
CCc1nc(C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)nn1-c1ccccc1F	743292584	GEENJSMJDOKACV-UHFFFAOYSA-N	435.419	1.935	50	20	IDGD	
O=C(NN=Cc1c(N2CCOCC2)nc2ccccn2c1=O)Nc1ccc(C(=O)O)cc1	743443451	GKXFTRIMYRFQPF-UHFFFAOYSA-N	436.428	1.385	50	20	IDGD	
C[C@H]1CCCN(C(C)(C)CNC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)C1	743561428	MTTHPKYCLAEXBF-AWEZNQCLSA-N	425.555	1.936	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)N[C@H](C)CN2CCN(c3ccccc3)CC2)cc1	745836626	CJTUUGQIZYAQIR-LJQANCHMSA-N	425.533	1.915	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)NCCCN1C(=O)COc2ccccc21	745858136	XXYXCTXVCQIBNC-UHFFFAOYSA-N	442.472	1.610	50	20	IDGD	
COc1cc(C)nc(NNC(=O)NC2CCN(S(=O)(=O)Cc3ccccc3)CC2)n1	746769007	ISTQKYLAHMKJRI-UHFFFAOYSA-N	434.522	1.414	50	20	IDGD	
CCS(=O)(=O)N1CCC(C(=O)NNC(=O)c2ccc(C#N)cc2)(c2ccccc2)CC1	747171797	DOQZPNAWYKKCNC-UHFFFAOYSA-N	440.525	1.703	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)N[C@H](C)c1ccc(NC(=O)c2ccncc2)cc1	748628971	BFZBSMBTYXJCJR-CABCVRRESA-N	429.477	1.777	50	20	IDGD	
O=C(NNc1ccc(OCC(F)(F)F)cc1)[C@@H]1CC(=O)N([C@H]2CCS(=O)(=O)C2)C1	748694908	HEYKEGPPJFGQEB-YPMHNXCESA-N	435.424	1.106	50	20	IDGD	
Cc1cc(Br)ccc1NNC(=O)[C@@H]1CC(=O)N([C@H]2CCS(=O)(=O)C2)C1	748730175	KJMVIBPDHBORHY-YPMHNXCESA-N	430.324	1.236	50	20	IDGD	
O=C(NCCN1CCCc2ccccc21)NNC(=O)c1csc(N2CCOCC2)n1	749213603	JXPAVWKCIXHSQL-UHFFFAOYSA-N	430.534	1.377	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)c2c[nH]nc2-c2ccc3c(c2)OCO3)c1	752141320	TZGPVPWPGCCWEG-UHFFFAOYSA-N	433.380	1.295	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CN2CCCC[C@@H]2c2nnc(C3CCOCC3)o2)c1	752925488	MXZHENOWDQPASO-GOSISDBHSA-N	438.488	1.823	50	20	IDGD	
CCOC(=O)c1ccc(N2CC(NC(=O)NNC(=O)c3ccc4ccccc4n3)C2)nc1	753278679	FURVMTMOUFTHHX-UHFFFAOYSA-N	434.456	1.639	50	20	IDGD	
CO[C@H]1C[C@@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)C1(C)C	753554941	FEDNZTKRJZIOGN-SJORKVTESA-N	438.550	1.619	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)NC3CCN(S(=O)(=O)C4CC4)CC3)cc2C1	753801616	KIGZIGZCFNJMHE-LBPRGKRZSA-N	440.591	1.774	50	20	IDGD	
O=C(CN1C(=O)c2ccc(Br)cc2C1=O)NNc1ccc(C(F)(F)F)nn1	755182627	NDFGDMZZJVVMHE-UHFFFAOYSA-N	444.167	1.997	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1ccc(Cc2nc3ccccc3s2)cc1	755446141	ADHOYXFXZIGVIH-LBPRGKRZSA-N	447.542	1.978	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)Nc1cccc(S(=O)(=O)NC2CC2)c1	755585406	LMZJPPGBLOVEPN-UHFFFAOYSA-N	432.502	1.921	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)Nc2ccc(-n3cnnn3)c(C)c2)cc1	755676964	CQGNONPLXNUWBP-CQSZACIVSA-N	425.449	1.990	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)Nc1cccc(C(=O)Nc2cccc(F)c2)c1	756088728	FYPDCILKZAVTCE-CYBMUJFWSA-N	434.449	1.665	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)Nc1ccccc1CN1CCOCC1	756112204	BAVGDOPYOPVEIX-UHFFFAOYSA-N	436.472	1.877	50	20	IDGD	
COc1cccc(-c2noc(SCC(=O)NNC(=O)CNC(=O)OC(C)(C)C)n2)c1	756126236	YBQFICXZGLGCLA-UHFFFAOYSA-N	437.478	1.509	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)Nc2ccc(N3C(=O)CCC3=O)c(C)c2)cc1	756557956	YQUXRSIWNYAWGL-UHFFFAOYSA-N	426.429	1.889	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)Nc1ccc(F)c(S(=O)(=O)NC(C)(C)C)c1	756706164	PGIGFNVNFUWZFR-LLVKDONJSA-N	434.490	1.107	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)Nc2cnn(-c3ccccc3S(C)(=O)=O)c2)c1	756708200	ZWWNGKUSAGTMIU-UHFFFAOYSA-N	442.501	1.808	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)N[C@H]2CCN(c3ccccc3OC)C2=O)cc1OC	757296516	SSGIMOBJYNWPAK-HNNXBMFYSA-N	442.472	1.852	50	20	IDGD	
CNS(=O)(=O)c1cccc(NC(=O)NNC(=O)[C@H](C)Oc2ccc(C(C)=O)cc2)c1C	757727374	QJRXSJVORVCOGY-AWEZNQCLSA-N	448.501	1.726	50	20	IDGD	
Cc1cc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)ccc1Br	757780171	KAPBDRDYSGDZQQ-MRXNPFEDSA-N	449.257	1.902	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)[C@H]1CCCN(c2ncnc3sccc23)C1	760443374	XRNUQHDKQNRMDJ-ZDUSSCGKSA-N	448.549	1.970	50	20	IDGD	
O=C(NNc1ncc(F)cn1)c1ccccc1NS(=O)(=O)c1ccc2c(c1)OCCO2	760912642	UNWWHQJQYKPJLD-UHFFFAOYSA-N	445.432	1.945	50	20	IDGD	
NC(=O)c1ncccc1C(=O)NNC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1	763234507	VYNFGYBSWPVCIJ-UHFFFAOYSA-N	427.424	1.503	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)c1ccc(F)c(I)c1	763322123	NMXPIOLYRSKGLI-UHFFFAOYSA-N	431.161	1.214	50	20	IDGD	
Cc1cc(C(=O)O)c(F)c(S(=O)(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)c1	763439735	PVVWKUFHJOUKJK-UHFFFAOYSA-N	433.458	1.447	50	20	IDGD	
CN1CCN(c2ccccc2NC(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)CC1	763483875	XHFGFPYUZMYBEW-UHFFFAOYSA-N	434.541	1.896	50	20	IDGD	
O=C(NNC(=O)c1ccccc1O)C(=O)Nc1ccn(-c2ncccc2C(F)(F)F)n1	763527656	PRVNQWCPQUBGMV-UHFFFAOYSA-N	434.334	1.391	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)[nH]n1)C(=O)N1C[C@H]2CCCN2c2ccccc21	763604926	LTQWXMPZPQMGFY-MRXNPFEDSA-N	430.468	1.853	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)cc1F	763605548	VAWZLISOACZSFN-UHFFFAOYSA-N	441.419	1.641	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(CC(=O)N(C)C)cc2)c2ccccc2n1	763617134	UPYZOVNDLXJROK-UHFFFAOYSA-N	433.468	1.574	50	20	IDGD	
O=C(COc1cccc(C(F)(F)F)c1)NNC(=O)C(=O)Nc1ccc2c(c1)OCO2	763638984	GWOYUEBVLLCFKH-UHFFFAOYSA-N	425.319	1.599	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccc(CS(C)(=O)=O)c1C	763714517	YCEVJZSDZRDISV-UHFFFAOYSA-N	447.513	1.267	50	20	IDGD	
O=C(NNC(=O)C12CC3CC(CC(C3)C1)C2)C(=O)Nc1cccc(Cn2cccnc2=O)c1	763727803	NZQRHEPIXZIWIJ-UHFFFAOYSA-N	449.511	1.594	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)C(=O)Nc2cccc(Cl)c2-n2cncn2)c1	763760256	JFJZQBRQZJBGPO-UHFFFAOYSA-N	427.852	1.386	50	20	IDGD	
Cn1cccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccco3)nc3ccccc23)c1=O	763762340	APXNKTNEVROSJB-UHFFFAOYSA-N	431.408	1.593	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)cn1C	763849316	KXFXSYATVMBADX-AWEZNQCLSA-N	430.461	1.372	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(OC)cc2OC)cc1OC	763911910	QVXIZAPHGQRRSG-UHFFFAOYSA-N	431.445	1.901	50	20	IDGD	
CCn1cnnc1-c1ccccc1NC(=O)C(=O)NNC(=O)Cc1ccc(Cl)cc1	763936088	CPQYYJIRTALGTN-UHFFFAOYSA-N	426.864	1.947	50	20	IDGD	
Cc1cnc(O)n1-c1ccccc1NC(=O)C(=O)NNC(=O)Cc1ccc(Cl)cc1	763937111	WWVITGLFYSCMBU-UHFFFAOYSA-N	427.848	1.868	50	20	IDGD	
O=C(NNC(=O)c1ccc(Br)s1)C(=O)Nc1ccnn1Cc1ccccn1	763942337	YEFRMQFHWUGDJK-UHFFFAOYSA-N	449.290	1.550	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)C(=O)Nc1ccc2c(c1)C(=O)CCC2	763945335	WSXSEVOUTMGAHV-UHFFFAOYSA-N	433.424	1.497	50	20	IDGD	
CS(=O)(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3c2)cc1	764066580	JYMZJJMAYIELHQ-UHFFFAOYSA-N	425.466	1.784	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)cc1Cl	764166569	CKLVBOKUWUWOOX-KRWDZBQOSA-N	433.848	1.455	50	20	IDGD	
CC(C)(C)OC(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)c1	764168548	QRXAIABCOCEKEI-SFHVURJKSA-N	439.468	1.660	50	20	IDGD	
COc1ccc(Cn2ncc(C)c2NC(=O)C(=O)NNC(=O)CC2CCCC2)cc1OC	764189058	UWZXLJADHOGBOT-UHFFFAOYSA-N	443.504	1.923	50	20	IDGD	
CNC(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)c2cccc(OC(F)F)c2)c1	764259063	BVHBWTZTQDELMB-UHFFFAOYSA-N	440.790	1.701	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)C(=O)Nc1ccccc1OC(F)F	764259799	JMBYYQLCYKFROA-UHFFFAOYSA-N	434.403	1.081	50	20	IDGD	
CCS(=O)(=O)c1cc(F)ccc1NC(=O)C(=O)NNC(=O)C(C)(C)c1ccccc1	764301308	AKRKSIHGOXGQQA-UHFFFAOYSA-N	435.477	1.683	50	20	IDGD	
Cc1cnn(-c2ccc(C(N)=O)cc2NC(=O)C(=O)NNC(=O)C(C)(C)c2ccccc2)c1	764309862	WOUWKSFEAUNKFM-UHFFFAOYSA-N	448.483	1.343	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)C(=O)Nc1ccc(S(=O)(=O)C2CCCC2)cc1	764318134	BEGNFJHDQVNZMU-UHFFFAOYSA-N	447.488	1.871	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)C(=O)Nc1cccc(N2CCCNC2=O)c1	764350424	FZLMHACVJYKGNY-UHFFFAOYSA-N	447.455	1.192	50	20	IDGD	
CC(C)N1C(=O)C(=NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)c2ccccc21	764819307	QNURLCCNZCEQKY-UHFFFAOYSA-N	433.512	1.720	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NN=C1C(=O)Nc2cc(O)ccc21	764838171	BNCAJQAQSIZJRI-UHFFFAOYSA-N	427.892	1.636	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1SC1CCCC1)N[C@H]1CCS(=O)(=O)C1	764874241	PDJANDADJUJVQF-NSHDSACASA-N	442.519	1.761	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)Cc1c[nH]c2cc(Br)ccc12	765510378	VHZVSIIJEPKLAC-UHFFFAOYSA-N	430.262	1.445	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cc(Br)c[nH]3)CC2)cc1	765748815	ISYWXYGMVBNDLE-UHFFFAOYSA-N	434.338	1.664	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@H](C(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)C1	766642413	HODHNXXDBRSTST-VQTJNVASSA-N	430.549	1.239	50	20	IDGD	
C[C@@H](OC[C@H]1CCCO1)C(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	766663378	KGUSZCLQIAQVRT-VQIMIIECSA-N	438.956	1.189	50	20	IDGD	
CCC1(CC)[C@@H](NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)C[C@H]1OC	767162442	UZXBJYHVRIWKKU-DLBZAZTESA-N	440.566	1.540	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2C)cc1NC(=O)CCN(C)C	768238079	PLEJQBWYDXIDGT-UHFFFAOYSA-N	425.489	1.593	50	20	IDGD	
CSCC[C@@H](NC(=O)c1ccc2ccccc2n1)C(=O)NNC(=O)c1cc(C)[nH]n1	768274011	MRMWPLGXMGOSLK-MRXNPFEDSA-N	426.502	1.579	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)c1c[nH]nc1-c1ccc2c(c1)OCO2	768635058	UUNILZYYLLHWGB-UHFFFAOYSA-N	430.442	1.974	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN[C@@H](C(=O)OC)c2ccc(OC)c(O)c2)cc1C	770685597	AIRCVJRHQQUVAF-GOSISDBHSA-N	435.502	1.598	50	20	IDGD	
CS(=O)(=O)CCOc1cccc(NC(=O)C(=O)NNc2c(F)cccc2Cl)c1	770812545	XXACFDJDQDOSSG-UHFFFAOYSA-N	429.857	1.984	50	20	IDGD	
C=CCNc1ncc(C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)s1	771043841	BQBOYNYTCQMPPG-UHFFFAOYSA-N	448.980	1.973	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)[C@H]1CC(=O)N(c2ccccc2F)C1	772196934	BPOXDHYXUBNCAT-ZDUSSCGKSA-N	432.839	1.296	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)[C@@H](O)[C@@H](O)c1nc2ccccc2s1	772998978	YVCIHABHGAEGNE-CIISACIHSA-N	435.889	1.959	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)N1CCC(c2nnc3n2CCCC3)CC1	773263357	CQOBFRWGFZHAPZ-UHFFFAOYSA-N	431.522	1.026	50	20	IDGD	
Cc1ccc(-n2nccc2NC(=O)C(=O)NNC(=O)CC23CC4CC(CC(C4)C2)C3)nn1	773494468	SEAXIPNTWRAVTM-UHFFFAOYSA-N	437.504	1.663	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2cc(Cl)ccc2C(=O)N2CCCCC2)n1	773726660	PNSJMZAITCOYKV-UHFFFAOYSA-N	432.868	1.847	50	20	IDGD	
CN(C)C(=O)[C@H]1CC[C@@H](CNC(=O)NNC(=O)c2ccc(Br)cc2Cl)O1	774699685	HSENOCMPWIYQKS-GXFFZTMASA-N	447.717	1.682	50	20	IDGD	
CN(NC(=O)c1cn(Cc2ccccc2)nn1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776204339	CJGQOBWHEDDLJD-UHFFFAOYSA-N	443.508	1.576	50	20	IDGD	
Cn1c(CNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)nc2cc(Cl)ccc21	777506838	BBSHPUWVMVHKED-UHFFFAOYSA-N	442.911	1.764	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CNC(=O)OC(C)(C)C)c1NC(=O)c1ccncc1	778436505	LXZSCXUGYYQLDV-UHFFFAOYSA-N	427.461	1.928	50	20	IDGD	
O=C(NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12)N[C@@H]1CCC[C@H]1CCO	779710316	CHKUTMVYQKQYPZ-FXAWDEMLSA-N	449.511	1.940	50	20	IDGD	
CC(=O)Nc1ccc(C)c(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1	780172041	SGTFSWCISXDFIA-UHFFFAOYSA-N	444.513	1.813	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCN([C@H](C#N)c3ccc(F)cc3)CC2)n1	780315204	NWSPVFKNWARRRF-QGZVFWFLSA-N	430.509	1.163	50	20	IDGD	
N#CCCn1cc(/C=C(\C#N)C(=O)OCC(=O)NC(N)=O)c(-c2ccc(Cl)cc2)n1	782092637	IQQRMJANSCGAHI-MDWZMJQESA-N	426.820	1.762	50	20	IDGD	
O=C(NNC(=O)C1CCCC1)C(=O)Nc1ccc2c(c1)CCC(=O)N2CC(F)(F)F	782118004	VHGSQXHNZAIDRZ-UHFFFAOYSA-N	426.395	1.804	50	20	IDGD	
O=C(NNc1ccccc1F)C(=O)Nc1ccc(N2CCOCC2)cc1N1CCOCC1	782707639	YXKMVPPAYDIIQQ-UHFFFAOYSA-N	443.479	1.581	50	20	IDGD	
CCc1cc(NC(=O)C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)ccc1C	782896995	LEUVVLGTZWFLJF-UHFFFAOYSA-N	431.518	1.559	50	20	IDGD	
O=C(NNc1ccc(Br)cn1)C(=O)Nc1ccc2nc3n(c(=O)c2c1)CCC3	784340993	UCHPFVRNBRNNSO-UHFFFAOYSA-N	443.261	1.582	50	20	IDGD	
CCCS(=O)(=O)Nc1cccc(NC(=O)C(=O)NNc2ccc(C(F)(F)F)nn2)c1	784891129	DGICYHMMCXRPFD-UHFFFAOYSA-N	446.411	1.729	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)Nc1ccc(N2CCCC2)c(F)c1	785024009	QADDGCLVSFMAMP-UHFFFAOYSA-N	431.380	1.439	50	20	IDGD	
COc1ccc([C@@]2(C)NC(=O)N(NC(=O)COC(=O)/C(C#N)=C/c3ccccc3)C2=O)cc1	785365826	MOQUTKZCLLCUKF-GTUDIADOSA-N	448.435	1.644	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(C)c(C(=O)N(C)C(C)C)c2)cc1	787541048	JYLUBVXEXGOECD-UHFFFAOYSA-N	440.500	1.949	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(Cl)c2)cc1C(=O)N1CCOCC1	787541063	KSECFDTUYGVORN-UHFFFAOYSA-N	444.875	1.521	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCCC(=O)Nc2cccc(NC(=O)NN(C)C)c2)cc1	788262273	KANIZJUCXMCUEN-UHFFFAOYSA-N	449.533	1.991	50	20	IDGD	
C[C@@H]([C@H](C)C(=O)NNC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1)S(C)(=O)=O	788265459	LQNZKMDVTDDMIH-GJZGRUSLSA-N	441.513	1.765	50	20	IDGD	
CN1C(=O)Cc2cc(NC(=O)C(=O)NNC(=O)c3ccccc3Br)ccc21	789729680	FFTKDIDEFIBNFI-UHFFFAOYSA-N	431.246	1.368	50	20	IDGD	
COCCCOc1cccc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)c1	789816987	HOVZEQWKKWBGQI-PMACEKPBSA-N	441.484	1.761	50	20	IDGD	
Cc1cc(C(=O)N2CCSCC2)ccc1NC(=O)C(=O)NNc1nc2ccccn2n1	792394307	PPFIROQINVMBGC-UHFFFAOYSA-N	439.501	1.309	50	20	IDGD	
COC(=O)c1nn(C)c(C)c1/C=C(\C#N)C(=O)Nc1c(C)n(C)n(-c2ccccc2)c1=O	792866989	RNGQKHNQQIUCES-RVDMUPIBSA-N	434.456	1.859	50	20	IDGD	
Cc1ccc(S(=O)(=O)NNC(=O)CNC(=O)OCc2ccccc2)c(C)c1C(=O)O	794599043	TYCXFCBSDKLMIK-UHFFFAOYSA-N	435.458	1.238	50	20	IDGD	
Cc1c(Cl)cc(S(=O)(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1C(=O)O	794867259	VLXKFKMOAJTVAM-HNNXBMFYSA-N	426.834	1.496	50	20	IDGD	
Cc1ccc2c(c1)CC[C@@H](C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1)O2	795109700	PLKDJSCVZOFDGU-SFHVURJKSA-N	445.545	1.163	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)[C@@H]1CCCN(C(=O)Cc2ccccc2)C1	795181749	OIDZKJMURNQGJY-GOSISDBHSA-N	444.557	1.861	50	20	IDGD	
CCOC(=O)c1cc(S(=O)(=O)NNC(=O)c2ccc3c(c2)OCCO3)c(F)cc1C	795290623	RJMOEPDBUAUAII-UHFFFAOYSA-N	438.433	1.705	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN1C(=O)OCc1ccccc1)c1ccc(-n2cnnn2)cc1	797701746	BEYWAWGKBGNQDE-GOSISDBHSA-N	435.444	1.225	50	20	IDGD	
CC(C)(C)OC(=O)[C@H]1CC(C(=O)NNC(=O)NCC(F)(F)F)=NN1c1ccccc1	798315319	FHWGEOZCQMHLAQ-CYBMUJFWSA-N	429.399	1.856	50	20	IDGD	
COc1ccccc1C(=O)NNS(=O)(=O)c1cc(Br)cc(C(N)=O)c1	799530307	GXIZOGOBBLHTJY-UHFFFAOYSA-N	428.264	1.180	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCCCNC(=O)/C=C\c2ccccc2)cc1OC	799861471	SYEGUNCFRCEVPY-XFXZXTDPSA-N	426.473	1.868	50	20	IDGD	
C[C@H](Sc1ccccc1C(=O)OCC(=O)NNC(=O)c1ccc(Cl)cc1)C(N)=O	801486251	HUZVFMDTGNPXCB-NSHDSACASA-N	435.889	1.924	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)Nc2ccc(Br)cc2)ccc1F	801995379	HRNSDHAJNOPKIA-UHFFFAOYSA-N	431.243	1.702	50	20	IDGD	
Cc1nnnn1[C@@H](Cc1ccc(F)cc1)C(=O)NNC(=O)Nc1ccc(N(C)C)cc1	802121368	AFOPQXWDRIGAHD-SFHVURJKSA-N	426.456	1.823	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCCc2ccc3c(c2)OCCO3)cc(OC)c1OC	806991904	MWCRGIDQUNDDFJ-UHFFFAOYSA-N	431.445	1.670	50	20	IDGD	
Cc1ccc(Br)c(S(=O)(=O)NCCNC(=O)NNc2ncccn2)c1	807564616	VHVCWJZAORFTAG-UHFFFAOYSA-N	429.300	1.152	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)CNS(=O)(=O)c1c(Cl)cccc1Cl	810374660	BIXBASQUAOYAPS-UHFFFAOYSA-N	432.285	1.742	50	20	IDGD	
COCCOCc1ccc(C(=O)N2CCN(S(=O)(=O)CBr)CC2)cc1	812543017	CNEUREDNARSCBO-UHFFFAOYSA-N	435.340	1.290	50	20	IDGD	
Cc1nnnn1-c1cc(NC(=O)NNc2ccccc2S(=O)(=O)N(C)C)ccc1F	814630940	WTUDIXSNQBWEEI-UHFFFAOYSA-N	434.457	1.509	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)COCc2ccccc2)cc1)[C@H]1C[C@@H]1C	815570061	PLSROJDWJOUGHV-YWZLYKJASA-N	438.484	1.751	50	20	IDGD	
C[C@@]1(c2ccccc2)NC(=O)N(CC(=O)NNC(=S)NCCc2cccs2)C1=O	838849832	GLIVNNYKRBLHPU-IBGZPJMESA-N	431.543	1.253	50	20	IDGD	
C=CCNC(=S)NNC(=O)c1ccc(Br)c(S(=O)(=O)NC(C)(C)C)c1	915269720	WJNVVBNXKSESKH-UHFFFAOYSA-N	449.396	1.821	50	20	IDGD	
O=C(CCS(=O)(=O)c1ccc2c(c1)CCC2)NNC(=O)[C@@H]1COc2ccccc2O1	915273762	HSXLZPDXZFGGHC-IBGZPJMESA-N	430.482	1.327	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)c1cc(C2CC2)nc2c1c(O)nn2C	915287325	FOFKEACZQZGROV-UHFFFAOYSA-N	433.472	1.925	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)N[C@@H](c2ccccc2)c2nccn2C)nc1	916220452	HDCZBOYTKRYESS-SFHVURJKSA-N	443.533	1.918	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)NCC2(N3CCSCC3)CCCC2)cc1C	916616228	GTUIPUDSDBRSLZ-UHFFFAOYSA-N	433.578	1.934	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)NCc2ccc(S(=O)(=O)N(C)C)cc2)c1	916646617	DAUZGCATLXDMBL-UHFFFAOYSA-N	434.518	1.463	50	20	IDGD	
CCCOc1ccc(C(=O)NNS(=O)(=O)c2ccc(CCNC(C)=O)cc2)cc1OC	917727695	MTDJNJBGOAVYDO-UHFFFAOYSA-N	449.529	1.786	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1cccc(N(C)C)c1)c1ccc(S(=O)(=O)N(C)C)cc1	918105369	PRHOCYPLKKHAJT-AWEZNQCLSA-N	433.534	1.708	50	20	IDGD	
CN(C)N(C(=O)[C@H]1CCCN(C(=O)CCOc2ccccc2)C1)[C@H]1CCS(=O)(=O)C1	918557330	WUAKSQDVFCKKDD-ROUUACIJSA-N	437.562	1.186	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCCc2cc(OC)ccc2OC)c2ccccc2c1=O	919790516	RXYOWZLOZGQNAT-UHFFFAOYSA-N	439.472	1.620	50	20	IDGD	
CCCOc1c(Cl)cc(C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)cc1OCC	919883423	CTGYCVRRYPRMPT-LBPRGKRZSA-N	433.914	1.659	50	20	IDGD	
O=C(NCc1ccccc1N1CCCC1)NNC(=O)c1csc(N2CCOCC2)n1	919922569	UIYSXFFMBSICSK-UHFFFAOYSA-N	430.534	1.724	50	20	IDGD	
Cc1ccc(C)n1-c1c(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cnn1C	919973821	LAUBHADNWGRPDL-UHFFFAOYSA-N	449.559	1.801	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)CN2C(=O)COc3ccc([N+](=O)[O-])cc32)o1	920272474	ZMAMFUKIUKGVJM-UHFFFAOYSA-N	445.432	1.216	50	20	IDGD	
COCCCNC(=O)NNC(=O)c1ccc(S(=O)(=O)N2C[C@@H](C)C[C@@H](C)C2)cc1	920862497	LTRZWZDORRYSCV-GASCZTMLSA-N	426.539	1.334	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NCc2ccccc2S(=O)(=O)NC(C)(C)C)cc1	920919352	JXCMANJHESMVCR-UHFFFAOYSA-N	448.545	1.981	50	20	IDGD	
CS(=O)(=O)Cc1ccccc1CNC(=O)NNC(=O)c1cncn1-c1ccccc1	1116248208	OOTRRKLEEZRQRW-UHFFFAOYSA-N	427.486	1.561	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)Cn3cc(C(F)(F)F)ccc3=O)nc21	1319292443	MSBQBSIHTICXCZ-UHFFFAOYSA-N	425.371	1.611	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NC2CCN(CC(=O)Nc3ccccc3)CC2)cc1	1337480879	LKVUYCLKXVBAFB-UHFFFAOYSA-N	425.489	1.742	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CC(=O)Nc2cc(C)on2)C1	1778075062	WKIYRHBTNKUYFQ-STXHMFSFSA-N	440.928	1.843	50	20	IDGD	
O=C(c1cc2cccnc2[nH]1)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1778590424	ABUCQPQKHFFWSO-DYVFJYSZSA-N	425.258	1.697	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)o1	1779027348	OBDLXIDMDHXGQO-ROUUACIJSA-N	432.304	1.918	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3[nH]cnc3-c3cccnc3)C2)C1	1780057077	KVZSUIMRKKUFBR-YJYMSZOUSA-N	448.321	1.699	50	20	IDGD	
C#CCCC(=O)N1CCO[C@]2(CCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1	1780099023	PJOOOTNYTAXNSG-OAQYLSRUSA-N	429.429	1.377	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)CC34CCCN3CCC4)C2)C1	1781134088	CWUJJOSVLRKJDI-BEFAXECRSA-N	428.371	1.618	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CCC(=O)NN(C)C)C2)cc1C	1782212377	YVBLTJJKYBXTKL-HYBUGGRVSA-N	444.576	1.804	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnc4ccc(F)cn34)C2)C1	1782464807	IEXVZJWJLZSMML-SGTLLEGYSA-N	439.285	1.700	50	20	IDGD	
C[C@H](Cc1ccncc1)C(=O)N1CC[C@]2(CN(C(=O)[C@H](F)Br)CCO2)C1	1782661094	OUZUGIHINGLJAU-QIIPPGSGSA-N	428.302	1.781	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1CC[C@@H](C(=O)OC)C1)CCO2	1783343679	OQUQYJWSZUEGSJ-CUYVQJCZSA-N	445.354	1.579	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)/C=C/c3ccc([N+](=O)[O-])o3)CCO2)C1	1783529784	MVWNPMXHHNASSU-LOFMDIFOSA-N	442.266	1.814	50	20	IDGD	
CN1CCC(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCBr)C[C@@H]32)CC1	1783653384	AZHXSHJVMUEUBW-ULQDDVLXSA-N	430.387	1.483	50	20	IDGD	
COC(=O)[C@H]1CC[C@@H](C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)C(C)(C)CCl)[C@H]3C2)C1	1783847465	OGOODZNEMIFTCO-XAJHFOFHSA-N	428.957	1.820	50	20	IDGD	
Cc1nc2ncccn2c1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(C)(C)CCl)[C@H]2C1	1783850036	MXFVKFCBZVYAKA-JYJNAYRXSA-N	433.940	1.896	50	20	IDGD	
CC(C)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CC[C@H]4CCC(=O)N4C3)C[C@@H]21	1783851735	GOFWBXMFDXOMFP-FPSMNIFISA-N	439.984	1.632	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3csc4c3CCCO4)CCO2)C1	1783874238	AYJBGOKRIYDXAW-HNAYVOBHSA-N	428.938	1.770	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(C(F)(F)F)ccn3)CCO2)C1	1783877768	PMKKBTUWLWIWRB-GUYCJALGSA-N	435.830	1.798	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(Br)cn3)CCO2)C1	1783877950	SFLRYYCTNHKBRF-DYVFJYSZSA-N	446.729	1.541	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCOc3ccc(F)cc3)C[C@@H]21)[C@H](O)CCl	1784084519	WBRWLDSDPZFNDK-RUGDWHBFSA-N	428.888	1.174	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(Br)cn3)C[C@@H]21)[C@H](O)CCl	1784090978	GCXJOCOWAONCEK-FATJJJSSSA-N	446.729	1.037	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccnc(C(F)(F)F)c3)[C@H]2C1	1785824498	QYPFMNJRJBAPGN-XQLPTFJDSA-N	449.857	1.948	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]2C1	1787449332	JKJQNOMDXWNABA-QMHWVQJVSA-N	447.935	1.900	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@]3(C)C[C@H]3C)[C@H]2C1	1789778734	PKVKZDLXXVDOPY-NNBPNGFISA-N	429.521	1.146	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccn(CC)n3)C[C@@H]21	1790961641	SOUVIRFKYXMXJO-YXWQFLTLSA-N	427.343	1.670	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)c3ccccc3)C[C@@H]21	1791287997	MEWKYGNJNOZSST-RYLXDESZSA-N	434.512	1.050	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ncc(Cl)cc1Cl)c1ccc(B(O)O)cc1	1792464407	AUCVGKDHODWQNU-MUJYYYPQSA-N	448.115	1.634	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCCC(=O)OC(C)(C)C	1793023866	NDHVZRJNNSMJFI-ZJOBFFGXSA-N	447.370	1.871	50	20	IDGD	
CO[C@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCl	1793106256	BSOZXZNHJOVRPV-AQGHMYMLSA-N	447.960	1.153	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cn3nc(C)sc3n1)C2	1793447338	DTTTXACDQUJEAG-YXPYIKCWSA-N	439.969	1.639	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ncc(F)cc1F	1793575169	UWBHGVYNDYAJSM-NJBDSQKTSA-N	432.265	1.594	50	20	IDGD	
COc1cccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Br)C3)c1	1795241796	VLVLURVISMFECF-DLTLXFJOSA-N	429.286	1.518	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2ncccn2n1	1797381511	ZAAQEPYUTVEEOR-OQMKEHIESA-N	436.310	1.106	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@](F)(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](O)CCl)C3)C1	1797898768	XOJMEUHLOQYVAD-MTCCJSQRSA-N	447.935	1.573	50	20	IDGD	
C[C@H](Cc1ccccc1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnccc1C(=O)NN	1798443555	HQRPTUFECUYXAW-OQIJWPOYSA-N	435.528	1.816	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)c1ccc2occ(Cl)c2c1	1798610251	LWBVZZWMRYRAHM-RBNVPPIJSA-N	427.284	1.889	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(C(F)(F)F)[nH]1	1798666441	JJFCDBHNOXSEMC-CLLJXQQHSA-N	429.443	1.658	50	20	IDGD	
O=C(Cc1c(F)cccc1F)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2	1798982601	GMFBBCZNWPTOCM-KSPBDQMDSA-N	431.277	1.882	50	20	IDGD	
COc1cc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Cl)C3)ccc1[N+](=O)[O-]	1799249485	NUBOMEQXAXSMTE-LZDSYCOUSA-N	429.832	1.270	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C#CC1(O)CCCCC1)C2	1799277510	WKUWWHHERIHXCP-HIRMHNASSA-N	431.360	1.511	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(-c3cccnc3)[nH]n1)C2	1800760577	SVPNNQVUCZKJSQ-MBMVNNNZSA-N	448.321	1.458	50	20	IDGD	
CC[C@@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnncc1C(=O)O)C2	1801804491	VRVIZUXGARDOEA-FBKDDSFISA-N	425.283	1.600	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(C(=O)N(C)C)c1	1801912543	LMZNPKWXNKAIQS-FCGDIQPGSA-N	435.952	1.999	50	20	IDGD	
C[C@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCC(=O)NN(C)C)[S@@](=O)c1ccccc1	1802338004	HATPZBXKVFVVEH-KTODCTLPSA-N	448.589	1.194	50	20	IDGD	
Cc1cccc(C(=O)NC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)n1	1805521213	UKQIFTBBEGTPKP-PGRDOPGGSA-N	438.532	1.478	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)c1n[nH]c2c1CCCC2	1808041069	RAAZHULQAYNJJP-YJLNNSPDSA-N	431.924	1.603	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)c2cnco2)[C@@H]1c1cccnc1	1808408716	JPEBMINTWPOWBF-CPJWQURSSA-N	449.471	1.523	50	20	IDGD	
Cc1ccnc(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)c1	1808533359	NJAJJIXZDBWGJX-KNQAVFIVSA-N	444.300	1.098	50	20	IDGD	
CNC(=S)NCCC(=O)NC[C@H]1CCN(C(=O)C(C)(C)CCl)[C@H]1c1cccnc1	1810308100	IZKSLKWHWCRIMT-WBVHZDCISA-N	440.013	1.836	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@H](CNC(=O)c2cc[n+]([O-])cc2)[C@H]1c1cccnc1	1811193963	QIZLFRWYVLKNIV-AZUAARDMSA-N	428.565	1.886	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)CCn2cncn2)[C@@H]1c1cccnc1	1812867348	ICOJYTULYHWQOK-JLJPHGGASA-N	435.326	1.553	50	20	IDGD	
NC(=O)c1nccnc1C(=O)N1CC[C@@H](CNC(=O)C(Cl)Cl)[C@H]1c1cccnc1	1813078204	GLNQECKPYAEVJM-SMDDNHRTSA-N	437.287	1.094	50	20	IDGD	
C=CCNC(=O)/C=C\C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](F)Br)[nH]n1	1814438758	TWWGTXPQAKCWAN-GORHOLETSA-N	442.289	1.951	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)C2CCC3(CC2)OCCO3)[nH]n1)[C@@H](O)CCl	1814874686	AGGYCCKPSNSXBJ-HOTGVXAUSA-N	440.928	1.935	50	20	IDGD	
O=C(CCC(F)(F)F)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1	1815339407	DTGJOJFGJBIZQA-GFCCVEGCSA-N	441.240	1.391	50	20	IDGD	
O=C(CC(F)(F)F)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1	1815339447	GDJCJCQUIPZJHY-LLVKDONJSA-N	427.213	1.001	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2coc(Cl)n2)n[nH]1	1816179791	PJFZKOBAOKQDQG-CYBMUJFWSA-N	437.888	1.730	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1)c1cncn1-c1ccncc1	1816220600	UWSNWUNNFBNOCD-DOTOQJQBSA-N	443.895	1.896	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc(=O)oc2)n[nH]1	1816645001	AMYMUXNGVFYDOV-OAHLLOKOSA-N	430.465	1.042	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@H]1CCc2nc(NC(=O)c3cnc(O)nc3O)sc2C1	1817083306	QDJQOKBNMZACKU-VIFPVBQESA-N	437.554	1.422	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc(F)c[nH]2)[nH]n1)c1ccc(B(O)O)cc1	1817475350	OAQBFBRIGQGPNE-QGZVFWFLSA-N	425.229	1.176	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3cn4ncccc4n3)sc2C1	1818466506	QVTUIZOGXRJQJW-WDEREUQCSA-N	434.909	1.665	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H]2CC2(F)F)[nH]n1	1819403053	TXBMXVURRFGLLB-TZMCWYRMSA-N	433.419	1.369	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H]2CCCS2(=O)=O)n[nH]1	1821834146	IBRZULGEORQOLU-LSDHHAIUSA-N	442.614	1.831	50	20	IDGD	
CC(C)=NO[C@@H](C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1	1822415692	PDSNMFKRRZJTQB-HOCLYGCPSA-N	435.529	1.576	50	20	IDGD	
CC(=O)N[C@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H](O)CCl)CC1)C(C)(C)C	1824359056	YHZHQWUZXJYYAN-OKZBNKHCSA-N	429.989	1.757	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)Cn1nccn1)CC2	1825451198	GQDPAXDLMHYCPV-ZJUUUORDSA-N	427.328	1.520	50	20	IDGD	
Cc1cnc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)s1	1825692205	BXCBMIDCTKFLTG-LJQANCHMSA-N	441.362	1.678	50	20	IDGD	
O=C(Cn1cnc2ccccc21)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](O)CCl)CC2	1825846537	SYGDVOUWGMLPCW-IAQYHMDHSA-N	433.921	1.705	50	20	IDGD	
Cc1cc(C)n(CCC(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@@H](O)CCl)CC3)n1	1826573328	IDTKMZWJCQRSFF-JSGCOSHPSA-N	425.942	1.558	50	20	IDGD	
Cn1cccc1C(=O)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](F)Br)CC2	1827001706	UTQKWXPDLDIEQR-SDBXPKJASA-N	443.298	1.967	50	20	IDGD	
O=C(C[C@H]1CCCCO1)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827055597	FGEDHIHVNXWYJG-FGZHOGPDSA-N	442.365	1.559	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccnn2)CC1	1828924266	NFGWTWWHKDFKRS-LJQANCHMSA-N	437.504	1.022	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C1(c3ccccc3)CC1)CCO2	1829843054	DWTCTSDQSNPYJR-GHTZIAJQSA-N	436.936	1.428	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccccn3)C2)C1	1830538433	FTBPOOKVKOJVIK-HNAYVOBHSA-N	440.338	1.112	50	20	IDGD	
C[C@H](Sc1ccccc1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1830725239	IFGBNUCLNYCIBK-RIFZZMRRSA-N	442.965	1.223	50	20	IDGD	
Cc1noc(C)c1C(=O)N1CCC([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1	1831871991	JSLRXUZWRFIHDB-GOSISDBHSA-N	433.553	1.898	50	20	IDGD	
COC[C@@H](C)C(=O)N1CCC(N2CCC(NC(=O)[C@H](C)CBr)CC2)CC1	1833265501	ZBYLDFRFRYJPOO-HUUCEWRRSA-N	432.403	1.872	50	20	IDGD	
C[C@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)[C@@H]3CCCO3)CC2)CC1	1833265956	FRLQEEJMVUUEJI-PBHICJAKSA-N	430.387	1.768	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(Cl)nc3F)CCO2)C1	1833267216	LBEDZSVEGDBLNY-ACJLOTCBSA-N	434.295	1.962	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(NC(C)=O)n3)CCO2)C1	1833338505	OBAZKCMIQPLTPI-YWZLYKJASA-N	438.912	1.127	50	20	IDGD	
Cc1ncoc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)CBr)C2)C1	1834363331	ZMXUKCICTCIFMK-YVEFUNNKSA-N	430.299	1.084	50	20	IDGD	
Cc1ccccc1C(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1	1834798375	NMPZACCHNIYUIX-UHFFFAOYSA-N	449.360	1.174	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCBr)CCO3)C2)cn1C	1834821820	ZSBVJCNHJUBRGG-GOSISDBHSA-N	428.327	1.189	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3cccs3)CCO2)C1	1836091973	JZAOYCGWBKYJDT-DYVFJYSZSA-N	431.352	1.530	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)Cc3ccc4ncnn4c3)CC2)CC1	1836341333	YQNXQMADIYUFAV-IBGZPJMESA-N	446.983	1.861	50	20	IDGD	
COC[C@@H](NC(C)=O)C(=O)N1CCC(OC2CCN(C(=O)C(C)(C)CCl)CC2)CC1	1836623873	ZZBXWOMREGMOSS-GOSISDBHSA-N	445.988	1.401	50	20	IDGD	
CCOC(CC(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)OCC	1836719654	BEZZFHLIXWAUFV-KRWDZBQOSA-N	434.961	1.374	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnn4cc(C)cnc34)CCO2)C1	1836944791	WJVXGGHDYNSPEM-UTKZUKDTSA-N	449.939	1.515	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4ccccn4n3)C2)C1	1837713352	YMABQGWOOALUHM-NRFANRHFSA-N	446.580	1.256	50	20	IDGD	
Cc1cnn([C@H](C)C(=O)N2CCOC[C@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)c1	1837718076	XDYGJIKJWRGIQC-XLIONFOSSA-N	438.601	1.060	50	20	IDGD	
COCc1c[nH]c(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)c1	1838519104	ZTGJJSOZMKNQEW-RBUKOAKNSA-N	448.347	1.467	50	20	IDGD	
COc1ccccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)Br)C2)C1	1838877763	XVPIGJDFUWTEMN-AUUYWEPGSA-N	441.322	1.549	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(CC(C)C)nn3C)C2)C1	1839144335	VOGRMGPONMBGHA-UWJYYQICSA-N	440.972	1.706	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)ON=C(C)C)C2)C1	1839965675	HKTOIQDDOOGNAF-RVKKMQEKSA-N	448.358	1.417	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)COC3CCCCC3)C2)C1	1840030445	MSCCYYSCJZMRHN-BEFAXECRSA-N	447.370	1.576	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)c(C)o1	1840031453	QPUXEBVVIPLMDN-ACJLOTCBSA-N	429.311	1.750	50	20	IDGD	
Cc1nc(C)c(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)o1	1840033871	SZOXIZODCALJEQ-APPDUMDISA-N	430.299	1.145	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C=C/C3CCCC3)C2)C1	1840034344	INJDLYRLXKDASL-QLHUVDSISA-N	429.355	1.973	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)c(C)n1	1840034709	UYKJBZSTXUXCHY-KUHUBIRLSA-N	440.338	1.552	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc4cc[nH]c34)C2)C1	1840152774	SSRZMQLZGOAVQP-LAUBAEHRSA-N	435.908	1.492	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(OC)c3F)C2)C1	1840156230	LCIZZMNMABMLPX-QRWLVFNGSA-N	444.887	1.158	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(F)cc3OC)CCO2)C1	1840641455	GWLWHTGCVGCDQU-OXQOHEQNSA-N	444.887	1.158	50	20	IDGD	
C[C@@H]1CC[C@@H](C(=O)N2CCCC23CN(C(=O)[C@@H](O)CCl)C3)CN1C(=O)OC(C)(C)C	1841033984	YADDYJKPFHCGKY-OAGGEKHMSA-N	443.972	1.825	50	20	IDGD	
O=C(c1cn2cccc(Br)c2n1)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1	1841353149	GVIDUEAZOUVEHG-ZDUSSCGKSA-N	441.713	1.514	50	20	IDGD	
CC(C)(C)OC(=O)N1CC2(C[C@@H]2C(=O)N2CC3(CCCN3C(=O)[C@@H](O)CCl)C2)C1	1841353905	XEGUANGZTDWWDG-KGLIPLIRSA-N	427.929	1.047	50	20	IDGD	
Cc1cccc(C)c1N1C[C@@H](C(=O)N2CCCC23CN(C(=O)[C@@H](O)CCl)C3)CC1=O	1841915122	VDMZCARRHZLQCZ-IRXDYDNUSA-N	433.936	1.459	50	20	IDGD	
O=C(c1ccc(N2CCOCC2)cn1)N1CC2(CCCN2C(=O)CCBr)C1	1842637653	QAZHSSNHOXEQPE-UHFFFAOYSA-N	437.338	1.520	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1cc3n(n1)CCCC3)C2	1843416208	LOAGZKIJZKVQOI-BUVRLJJBSA-N	437.504	1.170	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)c2ccncn2)C1	1843470869	NEGDYXIVOGFJNF-UHFFFAOYSA-N	425.401	1.441	50	20	IDGD	
C[C@@H]1CC[C@H](C(=O)N2CCCC23CN(C(=O)CN(C)NC(=O)NCc2ccccc2)C3)O1	1843881511	IFFHWVXMVBIIBC-IEBWSBKVSA-N	443.548	1.104	50	20	IDGD	
COc1ccc(CC(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)cc1C	1844263520	NDKYVAYHUKLPFN-UHFFFAOYSA-N	437.500	1.062	50	20	IDGD	
COC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)CO[Si](C)(C)C)C1	1844377973	PLWRITDNFGQQOI-HNNXBMFYSA-N	443.617	1.581	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@H]2[C@H]3CN(C(=O)OC(C)(C)C)C[C@H]32)C1	1846155833	OWMUCBONXDVIIH-QXSJWSMHSA-N	441.956	1.557	50	20	IDGD	
C[C@@H]1Oc2ccccc2N(CCC(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)C1=O	16192181	DIAYRUCDLFWFHF-ZDUSSCGKSA-N	445.859	1.848	50	20	IDGD	
Cn1c(N)c(C(=O)/C(C#N)=C/c2ccc(-n3cnc4ccccc43)cc2)c(=O)n(C)c1=O	16881674	RSIUXGNZQPEXHB-RVDMUPIBSA-N	426.436	1.795	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)Cn2cnc3sccc3c2=O)c2ccccc2c1=O	17196551	HCCGLDMQHILSGL-UHFFFAOYSA-N	438.469	1.210	50	20	IDGD	
O=C(CCNC(=O)c1ccc(Br)cc1)NNC(=O)c1cccc([N+](=O)[O-])c1	17329630	OEOIKVMQWNAFAG-UHFFFAOYSA-N	435.234	1.938	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@H](C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)C(C)C)cc1	17394504	GNZDVSJNHMJLHB-KRWDZBQOSA-N	434.474	1.667	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)N/N=C2/C(=O)Nc3cc4c(cc32)OCCCO4)c1	17415514	TYRCHDFAHKLYKL-UHFFFAOYSA-N	444.469	1.184	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@@H](C)Oc2ccc3ccccc3c2)ccc1OCC(N)=O	24154343	CGAWNLHBADXXNK-CQSZACIVSA-N	437.452	1.941	50	20	IDGD	
COc1cc(I)c(C(=O)NNC(=O)c2cccnc2)cc1OC	110172270	YEHZWHZKUCGZBF-UHFFFAOYSA-N	427.198	1.778	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)NCC1(c2ccc3c(c2)OCCO3)CCCC1	725873317	XRFPWBMGPZBYSR-UHFFFAOYSA-N	442.472	1.623	50	20	IDGD	
CC[C@@H](C)C(=O)N1CCC[C@@H](C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)C1	726033395	GRTJDGBBBXAQTC-UKRRQHHQSA-N	434.449	1.184	50	20	IDGD	
COc1ccc(OC)c(NC(=S)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1	726437821	LIMQGYKHQZHOQA-UHFFFAOYSA-N	438.531	1.586	50	20	IDGD	
NS(=O)(=O)c1ccc(CNC(=S)NNC(=O)CSc2ccc(Cl)cc2)cc1	726438068	QOHAFPBQCKSWEZ-UHFFFAOYSA-N	444.991	1.775	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)NCCN(C(=O)OC(C)(C)C)C2CC2)cc1C	727605993	LJRRHXWACQJXCK-UHFFFAOYSA-N	433.509	1.972	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)c2ccc(N3CCCC3)nn2)cc1	727847766	ADSQXEWCSLLFJJ-UHFFFAOYSA-N	438.517	1.572	50	20	IDGD	
Cc1ccc(CCC(=O)NCC(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)cc1	728211067	FSVODDDNBOXSPV-UHFFFAOYSA-N	430.530	1.628	50	20	IDGD	
O=C1Nc2cc(N3CCOCC3)ccc2C1=NNC(=O)C1CCN(c2ncccn2)CC1	728782075	CMLCYOQYYBQGQK-UHFFFAOYSA-N	435.488	1.002	50	20	IDGD	
CC[C@@]1(C)NC(=O)N(CC(=O)NNC(=O)c2ccc(Br)cc2Cl)C1=O	728832481	NJVYYNJVKMPSBA-OAHLLOKOSA-N	431.674	1.584	50	20	IDGD	
C[C@H](C(=O)Nc1cccc(F)c1)N1CCN(C(=O)NNC(=O)c2cccc(C#N)c2)CC1	728955129	YNIGUBSSJVAILE-OAHLLOKOSA-N	438.463	1.697	50	20	IDGD	
CN(C)C(=O)COc1ccccc1C(=O)NNc1ccc(S(=O)(=O)C(F)F)cc1	728975252	HQQZDAKWCJIDQD-UHFFFAOYSA-N	427.429	1.907	50	20	IDGD	
COC(=O)Nc1ccccc1C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	729751805	QRASBXCBXJYMFJ-INIZCTEOSA-N	429.385	1.009	50	20	IDGD	
COC(=O)c1cccc(S(=O)(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)c1C	731181161	NQDIJVYCUGAFOP-UHFFFAOYSA-N	438.458	1.431	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)N1CCC[C@H](C(=O)Nc2ccc(Br)cn2)C1	731849082	RIVFVQPETPRUBT-NEPJUHHUSA-N	426.315	1.441	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)CCN3CCN(C(=O)[C@@H]4CCCO4)CC3)cc2C1	732053150	XYHLDBQGXNGRTM-WBVHZDCISA-N	448.589	1.347	50	20	IDGD	
C=CC(=O)NCCNC(=O)/C(C#N)=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	732099544	HVPANDATMHHWEM-PTNGSMBKSA-N	440.891	1.404	50	20	IDGD	
O=C(COC(=O)[C@H]1CCN(c2ccc(F)cc2)C1=O)NNC(=O)c1cccc([N+](=O)[O-])c1	732329658	LFBCIPZQMNSVRS-INIZCTEOSA-N	444.375	1.091	50	20	IDGD	
CCc1cc(N2CCC[C@@H](NC(=O)NNC(=O)Cc3nc4ccccc4n3C)C2)ncn1	732914172	MJOZNJBFZHBNDT-MRXNPFEDSA-N	436.520	1.468	50	20	IDGD	
CC(=O)N1C=Cc2ccccc2[C@H]1CC(=O)NNC(=O)NCCNC(=O)OC(C)(C)C	734239432	OZFYMZJOAIFXMX-QGZVFWFLSA-N	431.493	1.806	50	20	IDGD	
COc1ccc(S(=O)(=O)C[C@@H](C)C(=O)OCC(=O)NNC(=O)c2ccccc2)cc1	735160334	GPNYVQPRUOMSDV-CQSZACIVSA-N	434.470	1.109	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)c2ccc3c(c2)CCN3C(=O)CNC(C)=O)cc1	735634006	ZYKCHKPLELDCFS-UHFFFAOYSA-N	438.484	1.114	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)c2cccc3c2O[C@H](C)C(=O)N3)cc1C	736816793	DCPMWCWPWWOMAE-LLVKDONJSA-N	431.470	1.956	50	20	IDGD	
Cn1ccnc1[C@@](O)(CCNC(=O)NNC(=O)COCc1ccccc1)C(F)(F)F	738462088	VIIUGGAGEASZOA-KRWDZBQOSA-N	429.399	1.107	50	20	IDGD	
O=C(CN1CCN(c2ncnc3ccsc23)CC1)NNC(=O)c1ccc([N+](=O)[O-])cc1	741793638	NWHXENMVWINMBO-UHFFFAOYSA-N	441.473	1.183	50	20	IDGD	
O=C(C[C@H]1CN(Cc2ccccc2)CCO1)NNC(=O)c1nn(-c2ccccc2)cc1O	743293423	ZACSVWRDEVALCC-IBGZPJMESA-N	435.484	1.630	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2cccc([N+](=O)[O-])c2)c1	743346763	SHRHKDKRPKSITD-UHFFFAOYSA-N	449.489	1.770	50	20	IDGD	
CN1CCN(c2ccc(CNC(=O)NNC(=O)Nc3ccc(OC(F)F)cc3)cn2)CC1	743528872	PSXWQGLFRJTTKW-UHFFFAOYSA-N	449.462	1.971	50	20	IDGD	
CCOc1ccc(/C=C(\C#N)C(=O)O[C@H](C)C(=O)N(CC)[C@@H]2CCS(=O)(=O)C2)cc1	744572188	XRGXRWFODJZMAR-VTYXAESKSA-N	434.514	1.960	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)CCCc2nc(-c3cccs3)no2)cc1	744742423	YZJQYKFZRKHYJG-UHFFFAOYSA-N	439.453	1.997	50	20	IDGD	
CCN(C)[C@@H](C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1)c1ccccc1	745102659	YLENJXCGQIGTIW-UYAOXDASSA-N	427.457	1.210	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)c2cccc(NC(=O)CCn3ccnc3)c2)c1	746307349	SPESNBACPXYVHV-UHFFFAOYSA-N	435.444	1.340	50	20	IDGD	
COc1cc(OC)cc(N2CC[C@@H](NC(=O)NNC(=O)c3c[nH]c4ccccc34)C2=O)c1	747956855	WYYGUAGYJYSQOD-LJQANCHMSA-N	437.456	1.935	50	20	IDGD	
O=C(COC(=O)c1ccc(C(=O)c2cc[nH]c2)cc1)NNC(=O)[C@H]1COc2ccccc2O1	748902272	DPKUKJZTAHHPOK-LJQANCHMSA-N	449.419	1.390	50	20	IDGD	
Cc1ccc(Br)cc1NC(=O)CNC(=O)NNc1ccc(-n2cccn2)nn1	749191042	AQFCUDNOHSVZGO-UHFFFAOYSA-N	445.281	1.998	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCCCc2nc(C(C)C)no2)c2ccccc2c1=O	749356276	DVUVGAQAWBRFNF-UHFFFAOYSA-N	427.465	1.500	50	20	IDGD	
CNS(=O)(=O)C[C@@H]1CCCN1C(=O)/C(C#N)=C/c1cc(C)n(C[C@@H]2CCCO2)c1C	749510082	KKNWYRIVLZUHSH-AQKLWOLUSA-N	434.562	1.731	50	20	IDGD	
C[C@H](Sc1ccnc2cc(Cl)ccc12)C(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1	749927693	UTCGHBANAJDWHA-JQWIXIFHSA-N	442.950	1.886	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)c2cc(Br)ccc2n1	751062150	KKXOTQNAUSKCFN-SNVBAGLBSA-N	426.292	1.501	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)N[C@H]2CCCN(Cc3ccccn3)C2=O)cc1	753289392	MGTYOWPOQLDLCJ-SFHVURJKSA-N	425.493	1.675	50	20	IDGD	
COc1ccc(-n2c(C)cc(/C=C(\C#N)C(=O)NCCCN3CCNC(=O)C3)c2C)cc1	753861711	CUVVVKUFIWNYGA-XSFVSMFZSA-N	435.528	1.948	50	20	IDGD	
O=C(CN1CCOCC1)Nc1ccc(NC(=O)NNC(=O)c2ccc(O)c(Cl)c2)cc1	755598251	FXCMDLQWVUDNKV-UHFFFAOYSA-N	447.879	1.783	50	20	IDGD	
CCOc1ccc(C#N)cc1NC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1	756212241	KQACZXCCTACSIR-UHFFFAOYSA-N	445.501	1.739	50	20	IDGD	
O=C(COC(=O)c1csc([C@H]2CCCO2)n1)NNC(=O)[C@@H]1COc2ccccc2O1	756459936	NPAIAGJSKYYOEA-CABCVRRESA-N	433.442	1.139	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)Nc1cc(S(N)(=O)=O)cc(C)c1C	756637028	YYZKPULTTXZJNM-UHFFFAOYSA-N	436.490	1.581	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(NC(=O)NNC(=O)COc2ccc(C)cc2)cc1	756783219	FQCGLKASGRAYNW-UHFFFAOYSA-N	436.490	1.151	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)[C@@](C)(O)CN2Cc3ccccc3C2=O)cc1	756797853	SXGDHXDCYQWAKS-CMJOXMDJSA-N	441.484	1.407	50	20	IDGD	
O=C(NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)Nc1cnn(CC2CC2)c1	756812807	GNACLTCAMHELAX-UHFFFAOYSA-N	432.506	1.544	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)Nc1ccc(C[C@@H]2CC(=O)NC2=O)cc1	756815946	PLAQWVRETKLPBN-TZMCWYRMSA-N	428.420	1.651	50	20	IDGD	
COC(=O)c1ccc(NC(=O)NNC(=O)c2cc(OC)cc(OC)c2)cc1C(=O)OC	756818259	PXAKIEODSFUPKK-UHFFFAOYSA-N	431.401	1.744	50	20	IDGD	
CNC(=O)Cn1nc(NC(=O)NNC(=O)c2cc(F)ccc2Br)cc1C	757821536	CKDMYACQMXDINV-UHFFFAOYSA-N	427.234	1.306	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1cc(C2CC2)nc2onc(CC(C)(C)C)c12	758036364	QWICEXMCJOXLDX-JTQLQIEISA-N	437.522	1.388	50	20	IDGD	
COc1ccc2nc(C)c(C(=O)N3CCN(S(=O)(=O)CBr)CC3)cc2c1	758527443	KWHCIWQTRWZZQX-UHFFFAOYSA-N	442.335	1.992	50	20	IDGD	
C=C[C@H](CC(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1)c1ccccc1	760154861	YZVBJKQFRNTGOH-QGZVFWFLSA-N	429.546	1.821	50	20	IDGD	
Cc1cc(C)nc(-n2nccc2NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)n1	760289848	GPOPTLCKSFHBGN-UHFFFAOYSA-N	445.386	1.037	50	20	IDGD	
Nc1cc(C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)ccc1Br	760550655	WKIDAHKLHYSIGS-UHFFFAOYSA-N	437.206	1.558	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N1CCS(=O)(=O)CC[C@H]1C	763129887	WKRLFCIGMRJIBE-VXGBXAGGSA-N	448.339	1.466	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC2(CC1)CC(C(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)=NO2	763233573	PATVNSBLIFECGV-UHFFFAOYSA-N	447.448	1.902	50	20	IDGD	
Cc1nn(-c2ccc(Br)cc2)cc1C=NNC(=O)[C@H](C)NS(C)(=O)=O	763362254	GZKAKJPGVSLMLQ-NSHDSACASA-N	428.312	1.331	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)CSc2ccccc2O)cc(F)c1F	763408077	BDLATATZCPDQMZ-UHFFFAOYSA-N	432.426	1.559	50	20	IDGD	
O=C(NNC(=O)c1c[nH]c2ccccc12)C(=O)Nc1cc2c(cc1[N+](=O)[O-])OCCCO2	763536257	PCQQPDRBYSQHEX-UHFFFAOYSA-N	439.384	1.637	50	20	IDGD	
COc1ccc(OC(C)C)c(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1	763571798	OTCSMUUUUMKISL-SFHVURJKSA-N	429.429	1.408	50	20	IDGD	
CCN(Cc1ccccc1NC(=O)C(=O)NNC(=O)COc1ccc(C)c(C)c1)C(C)=O	763666483	GAPGLWLVKKEXIG-UHFFFAOYSA-N	440.500	1.837	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(OCc3ccncc3)cc2)cc1	763679042	KRJMGMAMKIDPPB-UHFFFAOYSA-N	445.435	1.697	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(OC)c(OC)cc1C	763681498	LJUYBFLRXYAMRC-UHFFFAOYSA-N	431.445	1.576	50	20	IDGD	
CCNC(=O)c1ccc(C)c(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)c1	763727369	DJMDQGWLPPBGIL-UHFFFAOYSA-N	437.500	1.283	50	20	IDGD	
CCOC(=O)c1cn(C)nc1NC(=O)C(=O)NNC(=O)CSc1ccc(Cl)cc1	763734014	KISYRMDRHWTPQQ-UHFFFAOYSA-N	439.881	1.128	50	20	IDGD	
COCCOc1ccccc1NC(=O)C(=O)NNC(=O)CN1CCCc2ccccc21	763745975	MBSWRSDYUZPLNL-UHFFFAOYSA-N	426.473	1.251	50	20	IDGD	
CS(=O)(=O)CCOc1cccc(NC(=O)C(=O)NNC(=O)c2cccc(Cl)c2)c1	763748583	USJQJNCHARVMET-UHFFFAOYSA-N	439.877	1.163	50	20	IDGD	
COCCOc1ncccc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1cccc(C)c1C	763839358	FVAWDHAPYWFUPJ-OAHLLOKOSA-N	430.461	1.277	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cccc(OCC#N)c2)cc1	763862414	XFYBNWPRJMGZNQ-CQSZACIVSA-N	426.429	1.541	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccc(O[C@@H]2CCOC2)cc1	763868014	ZQPAKNVFXREBDS-SCLBCKFNSA-N	431.420	1.547	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)c2cccnc12	763873527	VGTKUBGBZCUJAF-LBPRGKRZSA-N	426.404	1.936	50	20	IDGD	
CCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(OCC)c(OC)c2)c(C)c1	763901316	NJDQOPNDVCCWDA-UHFFFAOYSA-N	442.472	1.552	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(CC(=O)NC)cc2)cc1OC	763911329	KVFZWMNDVKJPIL-UHFFFAOYSA-N	442.472	1.172	50	20	IDGD	
O=C(NNC(=O)c1cc2c(s1)CCCCCC2)C(=O)Nc1cccc(-n2cnnn2)c1	763912647	ZCQLDAVDKRKZJI-UHFFFAOYSA-N	439.501	1.783	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)C(=O)Nc1cc2c(cc1Br)OCCO2	763955463	BJDDCIJBJYUPIM-UHFFFAOYSA-N	434.246	1.928	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)C(=O)Nc1cc(Br)ccc1-n1cccn1	763995045	FVNBBYOLHFTSAY-UHFFFAOYSA-N	431.250	1.373	50	20	IDGD	
C[C@@H]1C[C@@H](C)CN(C(=O)c2ccccc2NC(=O)C(=O)NNC(=O)c2cccn2C)C1	763999570	VAVGVDPVEBWQQF-HUUCEWRRSA-N	425.489	1.543	50	20	IDGD	
O=C(Cc1ccsc1)NNC(=O)C(=O)Nc1cc(Br)cnc1-n1cccn1	764033185	HGHWGEBKVACVCD-UHFFFAOYSA-N	449.290	1.420	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2cc(NC(C)=O)c(F)cc2F)cc1	764125326	UGFNXLNAXZGBDY-UHFFFAOYSA-N	434.399	1.651	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2ccc(N3CCO[C@H](C)C3)cc2)cc1	764128109	ZKEIYOKDSVIZLW-MRXNPFEDSA-N	440.500	1.639	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2cc(F)ccc2Br)c1O	764131676	RMFPHFWDZAYWKR-UHFFFAOYSA-N	426.198	1.702	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)c1ccnc(Cl)c1I	764185569	BPWYSYYWTQLPGY-UHFFFAOYSA-N	447.616	1.885	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)C(=O)Nc2ccnn2CC2CC2)c1	764231975	KZAWBOVRKAYROJ-UHFFFAOYSA-N	436.266	1.464	50	20	IDGD	
CC1(C)Cc2cc(NC(=O)C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)ccc2O1	764258830	AERAIBRNHHNZBY-UHFFFAOYSA-N	438.488	1.193	50	20	IDGD	
Cc1cn2cc(NC(=O)C(=O)NNC(=O)c3cc(F)ccc3Br)ccc2n1	764270016	BFXRULICHUHNSL-UHFFFAOYSA-N	434.225	1.944	50	20	IDGD	
Cc1cc(C(=O)NC(C)C)ccc1NC(=O)C(=O)NNC(=O)COc1ccccc1O	764277806	ODUPLKVGMRMVPX-UHFFFAOYSA-N	428.445	1.004	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cnn(CC(F)F)c2)cc1Br	764326599	NQOMLYGMUHQRAZ-UHFFFAOYSA-N	446.208	1.319	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)C(=O)Nc1ccccc1C(=O)N1CCOCC1)c1ccccc1	764327954	IBDHTFSNNQYMBI-QGZVFWFLSA-N	438.484	1.439	50	20	IDGD	
CCOC(=O)c1cc(C)sc1NC(=O)C(=O)NNC(=O)c1ccc(O)c(Cl)c1	764345280	FAHHEDGPNLUXJQ-UHFFFAOYSA-N	425.850	1.992	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)C(=O)Nc1ccc(O[C@H]2CCOC2)cc1	764350719	IXWKAAHDQMIMOL-IBGZPJMESA-N	435.440	1.440	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccn(CCCOC)n3)n[nH]2)cc1	764385338	YEKSELNPIYGXDJ-UHFFFAOYSA-N	439.476	1.272	50	20	IDGD	
CC(C)(C)OC(=O)NNC(=O)C(=O)Nc1ccc2c(c1)CCN2C(=O)c1cccnc1	765394248	YGHXYKCZMNHNPZ-UHFFFAOYSA-N	425.445	1.779	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)NCc1cccc(C(=O)N2CCOCC2)c1	765694332	BZIZGGAAHLCTHO-UHFFFAOYSA-N	432.502	1.389	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@H](C)Oc3ccc(F)cc3)CC2)cc1	765748075	JGLGANPOGKAKBU-SFHVURJKSA-N	428.508	1.867	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@H]2CN(Cc3ccccc3)C[C@@H]2C)c2ccccc2c1=O	765890880	HBHYSJSSCDRSAH-JXFKEZNVSA-N	448.527	1.881	50	20	IDGD	
CCn1cc(CC(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)c2ccccc21	766642165	JZHBFYPKFMOCRO-UHFFFAOYSA-N	447.539	1.809	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)CN1CCN(Cc2nc(O)c3ccccc3n2)CC1	766846151	KZORELDGACJPQI-UHFFFAOYSA-N	448.527	1.152	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@H](C(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)[C@H](C)O)cc1	767302051	RMNZAMCRJFOAJG-FTBFDPLKSA-N	449.573	1.387	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3cn(C)nc3-c3cccnc3)n[nH]2)cc1OC	768275554	ANGMRGCJOVZEBR-UHFFFAOYSA-N	447.455	1.964	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)NC2CCN([C@H]3CCCC[C@@H]3O)CC2)cc1C	769165504	FARWAWANTRSPGI-OALUTQOASA-N	431.537	1.340	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)c3cccc(CN4CCOCC4)c3)nc21	770958162	JCXSCRPVFMFRHC-UHFFFAOYSA-N	425.493	1.876	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1ccc(Cl)c(S(=O)(=O)N(CC)CC)c1	771882215	NRBCMTUWWYXQPZ-NSHDSACASA-N	433.914	1.473	50	20	IDGD	
Cc1nn(C)c(C)c1-c1cc(C(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)n[nH]1	772183064	PWVVRNAKUAOJJV-UHFFFAOYSA-N	429.868	1.158	50	20	IDGD	
C[C@H](NS(=O)(=O)c1cccs1)C(=O)NNC(=O)[C@@H](C)Oc1cccc(Cl)c1	772965355	XIIUPETWPZBDOV-WDEREUQCSA-N	431.923	1.683	50	20	IDGD	
C[C@H]1CN(C(=O)c2ccc(NC(=O)C(=O)NNc3ccccc3[N+](=O)[O-])cc2)C[C@@H](C)O1	773654494	XISIPSRJRGVTLM-OKILXGFUSA-N	441.444	1.926	50	20	IDGD	
CN(C)C(=O)COc1cccc(NC(=O)C(=O)NNc2ccc(C(F)(F)F)cn2)c1	773665801	GCJMRSKRHIACGN-UHFFFAOYSA-N	425.367	1.649	50	20	IDGD	
CCOC(=O)C(C)(C)n1cc(NC(=O)C(=O)NNc2ccc(C(F)(F)F)cn2)cn1	773667636	RGNHYBDHXQMSBO-UHFFFAOYSA-N	428.371	1.677	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1)c1ccc(OC)cc1	775643181	NQDPZBPESRRWPL-CQSZACIVSA-N	425.894	1.951	50	20	IDGD	
COc1ccc([N+](=O)[O-])cc1C(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776205254	LRSRSXLZUFUGJW-UHFFFAOYSA-N	437.453	1.853	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)N[C@@H]2C[C@H](OCC)[C@@H]2OC)c2ccccc2c1=O	776528257	XAQSOCFKWRRDPD-ZIFCJYIRSA-N	445.520	1.723	50	20	IDGD	
CC(C)NS(=O)(=O)c1cccc(CNC(=O)NNc2cccc(S(C)(=O)=O)c2)c1	776617681	XAPCMLQTHARWFN-UHFFFAOYSA-N	440.547	1.603	50	20	IDGD	
COc1c(F)cc(S(=O)(=O)NNC(=O)c2cc(Br)c[nH]2)cc1[N+](=O)[O-]	777600334	OKMHQFABBPUFJT-UHFFFAOYSA-N	437.203	1.456	50	20	IDGD	
C[C@@H](NC(=O)c1cccc(Cl)c1Cl)C(=O)NNC(=O)CNC(=O)OC(C)(C)C	778443709	WIIUFJPXLVKETD-SECBINFHSA-N	433.292	1.784	50	20	IDGD	
COCCNC(=O)Cn1cc(NC(=O)C(=O)NN(c2ccccc2)c2ccccc2)cn1	782820770	HULXDHZKLVJZIM-UHFFFAOYSA-N	436.472	1.454	50	20	IDGD	
Cc1ccc(-n2nccc2NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2Cl)nn1	782925412	ITDGKKDEMYICEU-UHFFFAOYSA-N	434.243	1.677	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2ccccc2OCC(=O)N2CCOCC2)cc1	783036327	VTHZHCNYPDZWBP-UHFFFAOYSA-N	428.445	1.015	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(NC(=O)C(=O)NNc2ncccc2C(F)(F)F)c1	783120737	WYJZBASTZWJODF-UHFFFAOYSA-N	431.396	1.433	50	20	IDGD	
CN(c1ccccc1NC(=O)C(=O)NN=c1sc2ccccc2n1C)S(C)(=O)=O	783349406	IMRJVMPZUQEKGN-UHFFFAOYSA-N	433.515	1.206	50	20	IDGD	
CC(=O)N1CCN(c2cccc(NC(=O)C(=O)NNC(=O)Nc3ccccc3C)c2)CC1	783416553	YLKWKMNYKFGJGM-UHFFFAOYSA-N	438.488	1.455	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2cccc(NC(=O)c3ccccc3)c2)CCS(=O)(=O)C1	783425523	IKOXXNZQEJECOU-FQEVSTJZSA-N	430.486	1.075	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CNC(=O)c2cccs2)c(Br)c1	784005152	RCKAYWGRGOVONZ-UHFFFAOYSA-N	439.291	1.335	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)[C@H]1CC=CC[C@H]1C(=O)N1CCOCC1	784456830	OVEYSGFDTCNBKG-JKSUJKDBSA-N	433.530	1.376	50	20	IDGD	
CNC(=O)CCOc1ccc(NC(=O)C(=O)NNc2ccnc(Br)c2)cc1	784837527	WMAUKWNAOKFHKY-UHFFFAOYSA-N	436.266	1.441	50	20	IDGD	
CN1CCC/C1=N\S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccnc(F)c2)cc1	784848981	PUZJVZQWSDEONH-LFVJCYFKSA-N	434.453	1.115	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)C(=O)Nc1ccnn1-c1ccc(Cl)cc1	785060818	NWUQKHODTWJJPW-UHFFFAOYSA-N	437.847	1.502	50	20	IDGD	
CN1CCN(C(=O)c2ccc(NC(=O)C(=O)NNc3ccc(Cl)c(F)c3)cc2)CC1	785180437	VAYFJZPIKQHMEW-UHFFFAOYSA-N	433.871	1.949	50	20	IDGD	
O=C(COC(=O)[C@H]1[C@H]2CC[C@@H](O2)[C@@H]1C(F)(F)F)NNC(=O)c1ccc([N+](=O)[O-])cc1	785802371	UXMOORPQRGYMFO-RFHZTLPTSA-N	431.323	1.255	50	20	IDGD	
CCc1c(C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)nnn1Cc1ccc(F)cc1	786650003	BVSRNNZJHRPMGK-UHFFFAOYSA-N	449.446	1.350	50	20	IDGD	
CCOC1CC(CCNC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)C1	788858221	BACHCTHDFUKGTG-UHFFFAOYSA-N	426.539	1.151	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCN(c3ccccc3F)C[C@@H]2C)cc1OC	789497131	PEEPSPSFWVZWTN-HNNXBMFYSA-N	430.480	1.815	50	20	IDGD	
Cc1ccc(-n2cccn2)cc1NC(=O)C(=O)NNC(=O)COc1ccccc1[N+](=O)[O-]	789586787	POFVWULIOKFVDB-UHFFFAOYSA-N	438.400	1.254	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)OCc2ncccn2)cc1	791287076	DGYBZTSYQHJOSI-LFIBNONCSA-N	432.440	1.874	50	20	IDGD	
Cc1nn(-c2ccc(Cl)cc2)c(NC(=O)C(=O)NNC(=O)Cc2ccncc2)c1C	792267173	WJZJXIJXUQMYHW-UHFFFAOYSA-N	426.864	1.866	50	20	IDGD	
COc1ccc([C@H](CNC(=O)NNC(=O)c2cccc(C)n2)N2CCOCC2)cc1OC	792788882	GJGLXVSKPJRKFI-SFHVURJKSA-N	443.504	1.425	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@H]2[C@@H]3[C@@H]4[C@H]5[C@H]6C[C@@H]4[C@H]2[C@@H]6C[C@H]53)cc1	792804880	YDAZGNSULVEHSD-WJWQPDCLSA-N	429.542	1.157	50	20	IDGD	
CSSCCNC(=O)C(=O)Nc1ccc(S(=O)(=O)N2C[C@H](C)O[C@H](C)C2)cc1	793078278	DQQKZWPAJARCQC-BETUJISGSA-N	447.604	1.550	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)c1ccc(Br)cn1	793239941	QRHNNPYXOUOIIZ-JTQLQIEISA-N	441.307	1.953	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)N1CCNC(=O)[C@H]1c1ccc(Br)cc1	796577982	ZHNHMDSJAQHNMR-MLGOLLRUSA-N	425.327	1.504	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc(N3CCNC3=O)ccc2Cl)cc1C	798308529	FUJVCWUNSPOKGR-UHFFFAOYSA-N	429.864	1.886	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)N[C@H]1CCCC12CCOCC2	800739384	CDDIIFBAKZWMMK-FQEVSTJZSA-N	429.565	1.878	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)[C@@H]2CS[C@H](Cc3ccccc3F)C(=O)N2)cc1	802061511	XRNSOZPPIAJVPO-DLBZAZTESA-N	432.477	1.830	50	20	IDGD	
COc1ccc(C2=NO[C@@H](CNC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)C2)cc1F	802343508	VQCDKMACERJVII-CQSZACIVSA-N	431.380	1.880	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)NCC(F)(F)F)(n2cccn2)CC1	803351525	DHXKHHGOTDLFDU-UHFFFAOYSA-N	434.419	1.502	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@@H](C(=O)NNc2ccc3c(=O)[nH]ccc3c2)[C@H](C)O)cc1	803433199	KNIOYRQHPSEURT-SCLBCKFNSA-N	430.486	1.008	50	20	IDGD	
CSCC[C@H](NC(=O)c1cccc(C)c1)C(=O)NNc1ccc(-n2ccnc2)nn1	804957600	MKPDUVUXOWVYRW-INIZCTEOSA-N	425.518	1.966	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)[C@H]2CCN(c3ccc(C#N)cc3F)C2)c1	805587841	RBVTWRIZJYXONM-KRWDZBQOSA-N	435.415	1.400	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(NC(=O)C(=O)NNC(=O)CCC2CCCCC2)ccc1F	806978166	PLXAHQXLANZKEY-UHFFFAOYSA-N	442.513	1.522	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2cccc(F)c2Cn2cccc(C)c2=O)n1	806984626	ZCSCRWHSVLLAHH-UHFFFAOYSA-N	426.408	1.225	50	20	IDGD	
Cn1cc(NC(=O)C(=O)NNc2ccc(-c3cccc(C(F)(F)F)c3)nn2)ccc1=O	807298682	GGHYNGKAGROPPS-UHFFFAOYSA-N	432.362	1.943	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)NCc2ccncc2OC[C@@H]2CCOC2)c1	807615499	HVEWFZNZUUVBFT-CQSZACIVSA-N	430.461	1.658	50	20	IDGD	
O=C(CNS(=O)(=O)c1cccc(Br)c1)NN=c1cc[nH]c2ccccc12	810361728	RCMYZFZGUQORCF-UHFFFAOYSA-N	435.303	1.841	50	20	IDGD	
COC(=O)C(C)(C)c1csc(NC(=O)C(=O)NNc2ccc(Br)nc2)n1	815600280	PEMYEILSIOQTDD-UHFFFAOYSA-N	442.295	1.833	50	20	IDGD	
CC(C)OCCCn1c(NNC(=O)c2cnn3c2OCCC3)nc2ccccc2c1=O	815604334	LKGWPGAYKGRXOS-UHFFFAOYSA-N	426.477	1.948	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)c1ccc(-n2ncc(C#N)c2N)cc1	817053421	QMFKZMSFXHECEK-UHFFFAOYSA-N	425.474	1.333	50	20	IDGD	
Cc1ccc(-c2nnc(S)n2CC(=O)NNc2ccccc2S(=O)(=O)N(C)C)cc1	817055227	RXJNVXVNVCQFNR-UHFFFAOYSA-N	446.558	1.936	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)c2cn(C)c3c(cnn3C)c2=O)c1	818746030	OXWZJAUIICRONM-UHFFFAOYSA-N	434.250	1.578	50	20	IDGD	
O=C(CNc1ccccc1)NNC(=O)CNS(=O)(=O)c1ccc(Cl)c(Cl)c1	823327374	HHMBJJVQOVVASZ-UHFFFAOYSA-N	431.301	1.531	50	20	IDGD	
COc1ccc(-n2cnnc2SCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1	849185844	XFNCQWOHZZFCRM-UHFFFAOYSA-N	428.430	1.737	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2ccc(C(C)(C)C)cc2)cc1	913607177	FLGBYXKUZLFLPH-UHFFFAOYSA-N	431.514	1.926	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cn2cccn2)o1)c1ccc(S(=O)(=O)N2CCCC2)cc1	915057996	MUMKJZAKHZUMRX-UHFFFAOYSA-N	443.485	1.384	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)Cc2ccc(C(=O)NNC(=O)CSCC#N)cc2)cc1	915187988	FBBMVVUXNCDTFS-UHFFFAOYSA-N	446.554	1.834	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccccc1C(F)(F)F)NNC(=O)COc1ccc(F)cc1	915785051	CXQZDWNLXIBFTG-UHFFFAOYSA-N	449.382	1.349	50	20	IDGD	
Cc1cnn(-c2ccc(C(=O)NNC(=O)c3sc(N4CCOCC4)nc3C)cc2)c1	916134591	RFBQSRCRWMPRPK-UHFFFAOYSA-N	426.502	1.857	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)NCCCOC[C@H]2CCCO2)c2ccccc2c1=O	916210183	XWBXELDWMZOZGX-OAHLLOKOSA-N	431.493	1.507	50	20	IDGD	
COc1ccc(OCC(=O)NN=C(C)c2ccc(S(=O)(=O)N3CCNCC3)cc2)cc1	916296829	NTAZPFCAAIDUQR-UHFFFAOYSA-N	446.529	1.208	50	20	IDGD	
CC(C)(C)C(=O)NNC(=O)c1cc(S(=O)(=O)N2CCOCC2)c(Cl)cc1Cl	917180347	UTJHFYLPSPFJSB-UHFFFAOYSA-N	438.333	1.821	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2cccc(Cn3ccnc3)c2)ccc1Cl	918204264	XSJKQMRCILZHII-UHFFFAOYSA-N	433.877	1.307	50	20	IDGD	
CC(C)[C@@H](Oc1ccccc1C#N)C(=O)NNC(=O)c1csc(N2CCOCC2)n1	918285387	JWUHUPRHAZRQLQ-QGZVFWFLSA-N	429.502	1.716	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)OCC(=O)NCCCN2CCCCCC2=O)cc(C#N)n1C	919044087	HDODREAFWQPRLO-WQRHYEAKSA-N	425.489	1.564	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)c1ccc(N2NC(=O)CCC2=O)cc1	920285791	UYWGTPDUFJMEAK-UHFFFAOYSA-N	426.429	1.083	50	20	IDGD	
CN1CCN(c2ccccc2NC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])CC1	920930838	WMMLBROTWGFGIA-UHFFFAOYSA-N	428.449	1.578	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2ccc(N3CCCC3)nc2)cc1	920931114	CDBIVIIMDSRKKT-UHFFFAOYSA-N	446.533	1.464	50	20	IDGD	
CCOc1ccc(CN(C)C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1OC	1248486031	MTOSVSUWSNEGNX-UHFFFAOYSA-N	425.449	1.556	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCC2CCN(S(=O)(=O)c3ccccc3)CC2)cc1	1318102641	HASXTZSTGPZVSY-UHFFFAOYSA-N	446.529	1.740	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNS(=O)(=O)c2ccc(CC#N)cc2)cc1	1323497394	VLZUSTVVJQYIDU-UHFFFAOYSA-N	442.526	1.797	50	20	IDGD	
CS(=O)(=O)Nc1cccc(F)c1CNC(=O)NNC(=O)CSc1ccccc1O	1336289714	OYGIQDOXVGSLPO-UHFFFAOYSA-N	442.494	1.526	50	20	IDGD	
CC(C)c1nc(CC(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](F)Br)C3)C2)no1	1781325575	FUDGKZLGJIRRKC-BBRMVZONSA-N	433.278	1.256	50	20	IDGD	
COc1cccc(OC)c1C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781333642	HSQCOUCENNYDCK-MAUKXSAKSA-N	445.285	1.838	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C1CCN(C)CC1)C2	1781995540	PDULYRZWVKPKGS-IDHHARJASA-N	430.387	1.626	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc(C(N)=O)cc2)C1	1782865360	VUZZBSDGFNTTNU-XMSQKQJNSA-N	447.608	1.765	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)Cc3ccc(O)cn3)CCO2)C1	1783354274	OPYOOCZWHATCGL-CRAIPNDOSA-N	426.311	1.333	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)CCc3cnccn3)CCO2)C1	1783354306	PGCKWGNJBMGURX-CRAIPNDOSA-N	425.327	1.413	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)CN3CCCCC3=O)CCO2)C1	1783354569	CLTGEYZJUHELPO-KDOFPFPSSA-N	430.343	1.002	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3c(F)ccc([N+](=O)[O-])c3C)CCO2)C1	1783881660	SODUYRRWCJZPOG-DJJJIMSYSA-N	443.859	1.740	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(-c4ccccc4)[nH]n3)CCO2)C1	1783882323	QEOSRAJMUJPWML-IERDGZPVSA-N	432.908	1.774	50	20	IDGD	
COC(OC)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C[C@@H]21	1784291583	BZGVAJBRQYKOQW-DKQAGWEXSA-N	449.454	1.470	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4nccn4c3)C[C@@H]21	1786406793	FKMLQUZPOCGFFM-JYJNAYRXSA-N	435.322	1.713	50	20	IDGD	
NC[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)c1ccccc1	1786920531	XJSUBHZOUNPXEN-XSLAGTTESA-N	438.366	1.494	50	20	IDGD	
Cc1ncc(C(=O)Nc2ccc(C3(NC(=O)c4ccc(B(O)O)cc4)CCC3)cc2)cn1	1787216416	SDCPVEANAVBCHJ-UHFFFAOYSA-N	430.273	1.526	50	20	IDGD	
COc1ccc2nc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)[C@H](O)CCl)C[C@@H]43)ccc2c1	1787977700	WTNQRHYEJFMPHD-UQOODKLHSA-N	447.919	1.436	50	20	IDGD	
O=C(Cc1cccnc1)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1	1788143541	CFDYKAUODIMAHJ-UHFFFAOYSA-N	429.285	1.752	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C3\C(=O)Nc4ccccc43)C[C@@H]21	1791255373	OUQNMAFOOWMDGS-XGTSDOITSA-N	447.919	1.256	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCCCn3cccc3)C[C@@H]21	1791255427	QRQUMOGQABCWTE-VJANTYMQSA-N	425.957	1.892	50	20	IDGD	
CC[C@@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)CBr)C2)N(CC)CC	1793454574	NGMLGMOJSHEDBY-UHDSXZAQSA-N	432.403	1.727	50	20	IDGD	
CC(C)(C)OC(=O)N1CCOC[C@@H]1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](F)Cl)C2	1793841680	VPJTZKGFYKKJKJ-XLWJZTARSA-N	433.908	1.795	50	20	IDGD	
CO[C@@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)Br)C2)c1ccccc1	1795173395	SQZDRYOQUIDCIG-BTYMGIQYSA-N	425.323	1.747	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1ccc2c[nH]nc2c1	1796168273	LCRGVSQCLDJEBY-NEBZKDRISA-N	425.258	1.457	50	20	IDGD	
CCn1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)n1	1796890082	YSAGJEOQUQDDIB-YDOXXCSQSA-N	425.493	1.289	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1ccn2ccnc2c1	1797446492	VYJMFQHGJXQNDU-NEBZKDRISA-N	425.258	1.228	50	20	IDGD	
CCOC(=O)N1CCC(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](Cl)CC)CC1	1799271071	LCMQWHQJIVPPTB-YVSFHVDLSA-N	429.945	1.462	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccn3cncc3c1)C2)[C@H](F)Br	1799350133	RIDNMXKWKCJZGP-NEBZKDRISA-N	425.258	1.228	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1ccc2ncnn2c1	1799850547	BNPCTIKFEBASOK-HNKHHVNMSA-N	434.338	1.941	50	20	IDGD	
C[C@@H](Cc1ccncc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2	1800192815	FBITWZAVPOTKFE-SLZITWOASA-N	428.302	1.540	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc3c1OC(C)(C)C3)C2	1800974792	AQANXJJSQQVUHG-MVJTYMMSSA-N	436.936	1.857	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1Cc2[nH]nc(C(F)(F)F)c2C1)[C@@H](O)CCl	1801413535	GWEDAPUVJXLBTR-QEGBUVANSA-N	434.846	1.381	50	20	IDGD	
CC(=O)Nc1ccccc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)Br)C2	1801780495	LUFZSXKXHNKYFY-DPYKFYPSSA-N	438.322	1.632	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCNC(=O)c1ccccc1	1801948456	PZSQKJGABXGOIZ-AJYBTWMASA-N	435.952	1.804	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)C(C)(C)CCl)[C@@H]1c1cccnc1	1802902629	RQBNVHFLFCZIKH-APWZRJJASA-N	437.972	1.725	50	20	IDGD	
CC(C)[C@H](S)C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1807359096	DTGPEUWTPZBIRK-IHPCNDPISA-N	441.362	1.035	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H]2C[C@@H]2C2CC2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807361278	WNPBXWHZADEXJZ-BDKRGJGYSA-N	433.317	1.127	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)c1[nH]nc2ncccc12	1808104584	KJLYQURZJYSACY-JLJPHGGASA-N	428.880	1.272	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC2(CCCN(C(=O)c3ccc(F)cn3)C2)CC1	1808716086	CONHUUPGXKDHEN-UHFFFAOYSA-N	425.269	1.059	50	20	IDGD	
N#CC1(C(=O)NC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)CCC1	1814052107	NQNVYODRJQKZRG-QFBILLFUSA-N	447.499	1.094	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnnc(Cl)c2)n[nH]1	1816024505	AMCGSNHYLLADEM-AWEZNQCLSA-N	448.915	1.532	50	20	IDGD	
O=C(CCBr)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(=O)n2O)[nH]n1	1816781125	HINAAKXMGJXSFE-GFCCVEGCSA-N	438.282	1.900	50	20	IDGD	
O=C(CCBr)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(=O)n2O)[nH]n1	1816781137	HINAAKXMGJXSFE-LBPRGKRZSA-N	438.282	1.900	50	20	IDGD	
C[C@H](Nc1nccs1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1	1818083241	CFECMJILTVZMPI-DRZSPHRISA-N	426.930	1.959	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](F)Cl)CC2)c1cc2n(n1)CCCNC2=O	1818913245	HFIXZYPMPYOAMH-SDBXPKJASA-N	440.888	1.233	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnc(O)[nH]3)sc2C1	1820669810	GOYRZXBHOJLOBY-HTQZYQBOSA-N	428.312	1.971	50	20	IDGD	
CN1CCCn2nc(C(=O)Nc3cc([C@@H]4CCCCN4C(=O)[C@H](O)CCl)[nH]n3)cc2C1	1821591801	OVRKUIZPQOWSHM-DLBZAZTESA-N	449.943	1.347	50	20	IDGD	
C=CCC(F)(F)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1821985061	AUTXLFAAKFQPGM-MRXNPFEDSA-N	432.236	1.607	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(Cl)nn2)[nH]n1	1822414740	LFZRBXRTYNIVCY-CQSZACIVSA-N	448.915	1.532	50	20	IDGD	
CC(=O)OC[C@H](OC(C)=O)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)C(Cl)Cl)n[nH]1	1822423806	MCJQNUOGZSDLQE-OLZOCXBDSA-N	449.291	1.700	50	20	IDGD	
N#Cc1cc(CC(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@@H](O)CCl)CC3)ccc1F	1822960426	VMNMNVXQICKCIB-DOMZBBRYSA-N	436.896	1.908	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1	1823356636	UWHSKELNYWHGRZ-ZIAGYGMSSA-N	443.932	1.916	50	20	IDGD	
O=C(c1cnc(OCF)cn1)N1CCC([C@H]2CCCCN2C(=O)[C@@H](O)CCl)CC1	1824180399	HJNBSAXELAKNPV-CVEARBPZSA-N	428.892	1.615	50	20	IDGD	
CCS(=O)(=O)N[C@H](C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)C(Cl)Cl)CC1	1824461606	HKLJFIAJIOHVDD-TZMCWYRMSA-N	442.409	1.738	50	20	IDGD	
CC(C)[C@H](S)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1	1824544038	KEJSBOGYNZXPDO-XLIONFOSSA-N	426.627	1.934	50	20	IDGD	
CN1N=C(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)CCBr)CC2)CCC1=O	1824923648	IYURXBFXOITMNS-MRXNPFEDSA-N	441.370	1.999	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(O)nc(O)n1)CC2	1825641504	OSHZNBJZULSIFK-RQJHMYQMSA-N	442.295	1.354	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)Cc1c(C)n[nH]c1C)CC2	1826007185	TUJDEURKBVFGKB-YPMHNXCESA-N	425.942	1.892	50	20	IDGD	
CCn1nc(C(=O)N[C@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)cc1C	1826088239	VJOHUIRCTJIJRO-ZDUSSCGKSA-N	447.565	1.267	50	20	IDGD	
Cc1nccn1CCCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)CCl)CC2	1826692091	LIPSDKPBWSGPBG-OCCSQVGLSA-N	425.942	1.640	50	20	IDGD	
CC(C)C1(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2ccc(B(O)O)cc2)CC3)CCC1	1827394953	WLKAKOJRAFHBTB-INIZCTEOSA-N	441.362	1.875	50	20	IDGD	
O=C1NCCCn2nc(C(=O)N3CCC([C@@H]4CCCCN4C(=O)[C@H](F)Cl)CC3)cc21	1827610001	ZXWNTEYQFSAAKF-RDJZCZTQSA-N	439.919	1.784	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cscn2)CC1	1828925952	UYJDCVPYYMODFB-GOSISDBHSA-N	442.545	1.689	50	20	IDGD	
C=CCOCCCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](Br)CC)C2)C1	1831413321	VHKKIOMAPLXIOG-QFBILLFUSA-N	447.370	1.599	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](NC(C)C)C(C)C)C2)C1	1831646920	PBNDSIOCJYAKEI-UEXGIBASSA-N	432.005	1.873	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)[C@@H]2CCCS2)CC1	1832433913	LYABZFSCYQODAU-UXHICEINSA-N	430.379	1.495	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3ccc4ncoc4c3)CC2)CC1)[C@H](O)CCl	1833310123	JOBLFVGLBVRHHD-GOSISDBHSA-N	434.924	1.613	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)CCC3CCC3)CC2)CC1	1833399839	KFBPBFJMPTXAPV-UHFFFAOYSA-N	435.613	1.511	50	20	IDGD	
CCc1ncccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1833519351	PYVVNQMHPLXGIR-YJBOKZPZSA-N	444.301	1.405	50	20	IDGD	
Cn1nc(C(=O)NC2CCN(C3CCN(C(=O)[C@@](C)(Cl)CCl)CC3)CC2)cc1O	1833945564	OOBOEKRVGKQYKY-IBGZPJMESA-N	446.379	1.547	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3cnsn3)CC2)CC1	1833980338	JEEVJYRIDXKXDK-CQSZACIVSA-N	444.399	1.897	50	20	IDGD	
COCCn1ccc(C(=O)NC2CCN(C3CCN(C(=O)C(Cl)Cl)CC3)CC2)n1	1835186941	RVIUKZSQMVUNGP-UHFFFAOYSA-N	446.379	1.518	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)[C@H]3CC[C@@H](C)O3)CC2)CC1	1835466031	NSXADUDPWMTYSS-JKIFEVAISA-N	430.387	1.909	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@@H]3Cc4ccccc4O3)CC2)CC1	1835478655	CJJUZAYYLGHOCV-CTNGQTDRSA-N	449.979	1.816	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3ccn4ccnc4c3)CC2)CC1	1835573865	OEWOLKUGXCMPNP-LJQANCHMSA-N	447.967	1.773	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC1CCN(C2CCN(C(=O)c3cnc(N)s3)CC2)CC1	1835833596	WCZXAKIKFNIMBN-UHFFFAOYSA-N	439.658	1.762	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cnccc1F)CCO2	1836316182	QOYUPXRANGDVMZ-LJQANCHMSA-N	425.533	1.142	50	20	IDGD	
O=C(Cn1cc([N+](=O)[O-])cn1)N1CCC(OC2CCN(C(=O)[C@H](F)Cl)CC2)CC1	1837136508	RUNXOBUHGIJMGT-INIZCTEOSA-N	431.852	1.324	50	20	IDGD	
CC(C)c1nc(C(=O)N2CCOC[C@@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)co1	1837710140	KQOURBRCHOTQQO-HXUWFJFHSA-N	439.585	1.720	50	20	IDGD	
CCc1noc(C)c1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1	1838058759	WGCFUWOJTKBQJY-OALUTQOASA-N	448.347	1.852	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](C)n3ccnn3)CC2)CC1	1838730506	XKEBBGFLDXNAGE-UONOGXRCSA-N	442.358	1.621	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(OC)cc3F)C2)C1	1839147283	MDHZUGLSCGDTHM-UZLBHIALSA-N	428.888	1.922	50	20	IDGD	
CCc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)n[nH]1	1839152429	YYDPQYXQHBNKEY-ZWKOTPCHSA-N	433.336	1.278	50	20	IDGD	
O=C(c1ccc(Cl)o1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839200052	BCMZXHDAIDHZAD-SWLSCSKDSA-N	439.665	1.694	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)cc1F	1839202224	XXAIKURJGGXPPV-QAPCUYQASA-N	447.276	1.895	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3ccc(C#N)cc3)C2)C1	1840149660	WPKZULSFOCTGQT-KNQAVFIVSA-N	449.935	1.201	50	20	IDGD	
O=C(/C=C/c1cccc(O)c1)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840189640	DHLGTXFXAMZJQW-VZSQWMKGSA-N	429.300	1.666	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)c1ccccc1Cl)CCO2	1840318093	NWCRUFVJFOYZEL-XAUMDUMWSA-N	445.343	1.847	50	20	IDGD	
COC1(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@](C)(Cl)CCl)C3)C2)CCC1	1840617261	TXQAJPBASSOWCF-IEBWSBKVSA-N	437.364	1.638	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)Cc2cc(OC)c(OC)c(OC)c2)C1	1841785929	QGWVEGDAPDFOSS-OAHLLOKOSA-N	440.924	1.712	50	20	IDGD	
O=C([C@@H](O)CCl)N1CC2(CCCN2C(=O)CCc2nc(-c3ccc(F)cc3)no2)C1	1842021365	UGZYZSRLTJHIJN-HNNXBMFYSA-N	436.871	1.611	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC2(CCCN2C(=O)CNC(=O)c2cccs2)C1	1842063249	MEHYJHPOOWXVPR-GFCCVEGCSA-N	428.352	1.712	50	20	IDGD	
CN(CC(=O)N1CC2(CCCN2C(=O)CC(F)(F)F)C1)NC(=O)NCc1ccccc1	1842805382	NSRQQNHFXCTMNJ-UHFFFAOYSA-N	441.454	1.488	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)Cc2cc3cccnc3cc2F)C1	1845141166	ZBNSCXRUMZBOMW-UHFFFAOYSA-N	447.275	1.113	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCCC12CN(C(=O)c1ccc(CS(C)(=O)=O)nc1)C2	1845170287	JFKDDYRZTKBUJG-KRWDZBQOSA-N	448.372	1.680	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC12CN(C(=O)C[C@@H](O)CNC(=O)OC(C)(C)C)C2	1846178451	YELSNTJRFNQLGT-QWHCGFSZSA-N	448.358	1.249	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)n(C)c1	23567507	FVSGDPNKGGJWEY-ZDUSSCGKSA-N	440.497	1.423	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cc(Br)c[nH]2)cc1	24124319	BBCQJRNATXJNEO-UHFFFAOYSA-N	443.323	1.929	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CC(=O)N(Cc2ccccc2Cl)C1)[C@@H]1COc2ccccc2O1	26692465	JYSLUCNWYFBQBQ-KDOFPFPSSA-N	429.860	1.676	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNS(=O)(=O)c1ccc([N+](=O)[O-])cc1[N+](=O)[O-]	28780095	WGQCZZWODYDBEI-UHFFFAOYSA-N	448.211	1.227	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)NNC(=O)c1cccc(S(=O)(=O)NCC2CC2)c1	29757027	ONTJYACGVZSMHQ-UHFFFAOYSA-N	426.498	1.860	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)c2cccc(S(=O)(=O)NCC3CC3)c2)cc1C	105931458	IVFZIMGOPRBXTH-UHFFFAOYSA-N	431.514	1.832	50	20	IDGD	
COc1ccc(/C=C\C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1OC	209351571	QMXMXPMVQFJPKE-QIBOZCLASA-N	442.424	1.248	50	20	IDGD	
O=C(CN1CCC(C(=O)Nc2cccc(F)c2)CC1)NNC(=O)c1cccc([N+](=O)[O-])c1	725802255	LMIGFVBEXYYURW-UHFFFAOYSA-N	443.435	1.846	50	20	IDGD	
Cc1noc(C)c1S(=O)(=O)N1CCC[C@H](C(=O)NNc2nc(-c3ccncc3)no2)C1	726369646	DCLKOMPZPBBAAN-AWEZNQCLSA-N	447.477	1.280	50	20	IDGD	
COc1ccc(Cl)cc1N1CC[C@H](NC(=O)NNC(=O)CNC(=O)c2ccco2)C1	726719380	RMRQWICQGNTROX-ZDUSSCGKSA-N	435.868	1.281	50	20	IDGD	
CCNS(=O)(=O)c1cccc(C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)c1	726862584	VDAAQEUTFGBALB-UHFFFAOYSA-N	438.531	1.182	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)CCCc2ccccc2)cc1	727721411	HDOLUZGTSKHWLM-UHFFFAOYSA-N	425.532	1.269	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NN=Cc1ccc(OC(=O)c2cccc([N+](=O)[O-])c2)cc1	728437185	MLTZDLSQCFFTPN-GFCCVEGCSA-N	434.430	1.202	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(Cl)s1)NNC(=O)c1cccc(OC(F)F)c1	728544390	ZSTBJXDTHUHZPT-UHFFFAOYSA-N	439.849	1.742	50	20	IDGD	
Cc1cc(CN2C(=O)c3ccccc3C2=O)cc(C(=O)NNC(=O)Cc2cccnc2)c1O	728851915	DOTYZMNEYJBFSV-UHFFFAOYSA-N	444.447	1.896	50	20	IDGD	
O=C(CCNS(=O)(=O)c1cccc([N+](=O)[O-])c1)NNC(=O)Cn1ccc2ccccc21	729451819	FKLHXBVASNUCIY-UHFFFAOYSA-N	445.457	1.066	50	20	IDGD	
O=C(COc1ccccc1Cc1ccccc1)NNC(=O)NC[C@H]1CN2CCC[C@H]2CO1	729620140	WKYZHQWOCFPCGL-SFTDATJTSA-N	438.528	1.850	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)Cc2cc[nH]n2)cc1S(=O)(=O)Nc1ccc(F)cc1	730102817	ODEHWKUCDSOZSD-UHFFFAOYSA-N	431.449	1.662	50	20	IDGD	
CS(=O)(=O)c1ccc(OCCNC(=O)NNC(=O)c2cccc3ncccc23)cc1	730125422	HMTQVDYCRLUBBQ-UHFFFAOYSA-N	428.470	1.661	50	20	IDGD	
CCc1ccccc1O[C@H](C(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1)c1ccccc1	730535538	QHRQKHRACMSECI-MJGOQNOKSA-N	431.514	1.887	50	20	IDGD	
CN1CCN(C[C@H](NC(=O)NNC(=O)COc2ccccc2O)c2ccccc2)CC1	730912353	SYPOCUPKDZDTKP-SFHVURJKSA-N	427.505	1.090	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)Nc2ccn(CCN3CCOCC3)n2)c1C	731335797	KIMPCLZGFYVUNP-HMMYKYKNSA-N	426.521	1.826	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)[C@@H]2CC(=O)N(c3ccc4c(c3)CCC4)C2)C[C@@H](C)O1	732262038	HYXVAYHEVHXZNL-JTDSTZFVSA-N	428.533	1.175	50	20	IDGD	
O=C(CNC(=O)c1ccc(Br)o1)NNC(=O)NCc1ccc(Cl)cc1	733003997	YMKYAXTYJDFPAB-UHFFFAOYSA-N	429.658	1.956	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)c2sccc2-n2cnnn2)CC1	734822536	ZOUCKMALLZIFGW-UHFFFAOYSA-N	436.498	1.067	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNS(=O)(=O)c2ccc(F)c(NC(C)=O)c2)cc1	736539924	SAYZWCGHKQHKES-LBPRGKRZSA-N	439.465	1.960	50	20	IDGD	
CCN1CCN(CCCCNC(=O)NNC(=O)c2cccc(Br)c2)CC1	743548229	IRAHUUISEHBNDC-UHFFFAOYSA-N	426.359	1.811	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)NCCS(=O)(=O)NC(C)C)cc1Cl	743592434	PALWVVPSTTUYFR-UHFFFAOYSA-N	437.906	1.021	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)N[C@H]2CC(=O)N(CCOc3ccccc3)C2)cc1	743638644	STSZSKNNNNUIAR-SFHVURJKSA-N	440.500	1.638	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCc1noc(-c2cccs2)n1	745183151	NUOBIJQSIROTAV-UHFFFAOYSA-N	449.518	1.544	50	20	IDGD	
CC(=O)c1cccc(O[C@H](C)C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c1	745230656	OMFKHEGCZKEDCP-CYBMUJFWSA-N	429.385	1.569	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)N[C@@H]1CC(=O)N([C@@H]2C[C@H]2c2ccccc2)C1	745914062	HKSXBDWHJOVKCK-NZSAHSFTSA-N	426.448	1.692	50	20	IDGD	
CC[C@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)C1CCOCC1	746427242	VDWXLJAHYZRIRU-SFHVURJKSA-N	438.550	1.620	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)c2ccc(Cl)cc2F)cc1C(=O)N(C)C	747618129	NOUJYJOMTZGHSK-UHFFFAOYSA-N	429.857	1.813	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1cnc2c(cnn2CC(C)C)c1	748212429	NAZHZABIUKQGOS-UHFFFAOYSA-N	443.533	1.764	50	20	IDGD	
CS(=O)(=O)c1cc(C(=O)NNC(=O)Cc2ccc(F)cc2)ccc1Br	749161431	MPAOWMHPBPYODL-UHFFFAOYSA-N	429.267	1.995	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1CN(CC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)CC2	750054196	ARXJSZSGCLXTQG-RDJZCZTQSA-N	447.492	1.830	50	20	IDGD	
CCN(CC)C(=O)[C@@H](NNC(=O)Cc1csc(N2CCOCC2)n1)c1ccccc1	750198693	UWWWGIMOLZIWPD-IBGZPJMESA-N	431.562	1.753	50	20	IDGD	
Cc1c(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cnn1CCC(C)C	750424582	SSHPMUBQLUAYII-UHFFFAOYSA-N	440.548	1.457	50	20	IDGD	
CN(C)C(=O)CN1C(=O)C(=NNC(=O)NCc2ccco2)c2cc(Br)ccc21	750936122	MKDXVEQBLKIHCO-UHFFFAOYSA-N	448.277	1.680	50	20	IDGD	
O=C(NNC(=O)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1)[C@H]1CCS(=O)(=O)C1	751062873	NSKYJKXIUHHSPF-WMLDXEAASA-N	433.452	1.023	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(/C#N)C(=O)NNC(=O)CNC(=O)c2ccco2)c1C	751204925	SMJFSUXUDDNLGT-DUPVFGOHSA-N	427.461	1.390	50	20	IDGD	
Cc1ccc(NC(=O)CS[C@@H](C)C(=O)NNC(=O)CNC(=O)c2cccs2)cc1	751208577	FZQSHLKNTRGJEK-ZDUSSCGKSA-N	434.543	1.694	50	20	IDGD	
O=C(NNc1ccc(-c2ccccc2)nn1)c1cccc(S(=O)(=O)N2CCOCC2)c1	754473680	OGQSPHAXRQGDHI-UHFFFAOYSA-N	439.497	1.921	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)c2cncc(NC(C)=O)c2)ccc1N1CCCC1=O	755590998	CDKTZJURROPFAN-UHFFFAOYSA-N	426.433	1.642	50	20	IDGD	
COC(=O)CCNC(=O)c1ccc(NC(=O)NNC(=O)c2ccc3c(c2)OCO3)cc1	755604665	ROQWSAQEQJVICP-UHFFFAOYSA-N	428.401	1.175	50	20	IDGD	
CCOCCOCc1cccc(NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c1	755969930	LUQLKDSALZMEDR-UHFFFAOYSA-N	425.449	1.682	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)Nc1ccc(CCN2CCOCC2)cc1	756163546	FSUFLFVGWSLUJO-UHFFFAOYSA-N	436.472	1.677	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2cccc(OCCS(C)(=O)=O)c2)cc1OC	756298527	YEWQPZNVBWNSFK-UHFFFAOYSA-N	437.474	1.594	50	20	IDGD	
CCOC(=O)C1CCN(C(=O)c2ccc(NC(=O)NNC(=O)c3ccccn3)cc2)CC1	756683549	ROMNXFMSPHZWFD-UHFFFAOYSA-N	439.472	1.963	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)Nc1ccn(CCS(C)(=O)=O)n1	756761712	RDLZMGICBNPJLU-UHFFFAOYSA-N	448.530	1.826	50	20	IDGD	
CO[C@](C)(C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)c1ccccc1F	757768653	ZJVHQUZPRCXRMY-NRFANRHFSA-N	449.504	1.933	50	20	IDGD	
C[C@@H]1CN(Cc2ccc(CNC(=O)NNC(=O)C(=O)Nc3ccccn3)cc2)C[C@@H](C)O1	758687731	RDHPSDWJZXVOTF-HZPDHXFCSA-N	440.504	1.160	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)[C@@H](C)NS(=O)(=O)c1ccc(C#N)cc1	762349426	IMVDTALBWIDHBB-CYBMUJFWSA-N	448.526	1.173	50	20	IDGD	
Nc1c(Br)cc(Br)cc1C=NNC(=O)[C@H]1CCS(=O)(=O)C1	763408361	QYCQSMOMPIJDAU-ZETCQYMHSA-N	439.129	1.679	50	20	IDGD	
CNC(=O)Cn1nc(NC(=O)C(=O)NNC(=O)c2sc3ccccc3c2Cl)cc1C	763577653	IRBPBOMKPCJBNX-UHFFFAOYSA-N	448.892	1.205	50	20	IDGD	
O=C(NCc1csc(-c2ccco2)n1)NNC(=O)C1CCN(c2ncccn2)CC1	763608195	LXXWIDJEXARBQY-UHFFFAOYSA-N	427.490	1.940	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2csc(-c3ccccn3)n2)c1	763648076	SXDGRXIJOJMNGI-UHFFFAOYSA-N	425.470	1.987	50	20	IDGD	
CCCNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)COc2cc(C)ccc2C)c1	763665667	MYUJNXMGLWMBMP-UHFFFAOYSA-N	426.473	1.608	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2ccccc2-n2c(C)cnc2O)c1	763668111	IUSMEBQXCATANT-UHFFFAOYSA-N	437.456	1.668	50	20	IDGD	
COC(=O)c1ccc(OC)cc1NC(=O)C(=O)NNC(=O)C12CC3CC(CC(C3)C1)C2	763736687	YBSGLMKQQINKNP-UHFFFAOYSA-N	429.473	1.784	50	20	IDGD	
CCOC(=O)/C=C\c1ccc(NC(=O)C(=O)NNC(=O)c2nnc(O)c3ccccc23)cc1	763789728	AFIOZYSJPIKTHX-XFXZXTDPSA-N	449.423	1.311	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)C(=O)Nc2ccccc2OC(F)(F)F)c2ccccc2c1=O	763789826	FLLYSUVUJZUNDR-UHFFFAOYSA-N	449.345	1.232	50	20	IDGD	
CCOc1cc(C(=O)N(C)C)ccc1NC(=O)C(=O)NNC(=O)COc1ccc(C)cc1	763812088	OUKDHTUVNGHBAR-UHFFFAOYSA-N	442.472	1.260	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(OCc2ccccc2)nc1	763815000	ZDWNWIDLMQXAES-UHFFFAOYSA-N	445.435	1.697	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(S(=O)(=O)N[C@@H](C)CC)c2)cc1	763832613	YWHYJXOOWQLTEY-AWEZNQCLSA-N	446.529	1.726	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccc(C(=O)N2CCCC2)cc1	763839322	JHRLQSKZGTUDCR-UHFFFAOYSA-N	428.420	1.227	50	20	IDGD	
CCN1CCC(n2nccc2NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)CC1	763857829	PGWWQVINLJKNGN-CQSZACIVSA-N	446.483	1.232	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)cc1C(=O)N(C)C	763865064	HRJVCBGIZLSCJB-ZDUSSCGKSA-N	430.436	1.389	50	20	IDGD	
COCCn1ncc2ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc3ccc(F)cc3)cc21	763870650	AVWNJNCGBVUFIL-ZDUSSCGKSA-N	443.435	1.375	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(C(C)=O)cc2)cc1F	763877997	NQMPDBAJCXNAQD-GFCCVEGCSA-N	445.403	1.368	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)Cn2nc(C)cc2C)cc1Cc1ccccc1	763880964	KPBVZZQHERPOAI-UHFFFAOYSA-N	435.484	1.885	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)C(=O)NCC2	763903175	PGZXIPHAIIPDRS-UHFFFAOYSA-N	449.492	1.804	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)C(=O)Nc1cccc(F)c1I	763996404	QBLZLAHVDOXPSO-UHFFFAOYSA-N	430.177	1.169	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)N3CCCC[C@@H]3C)cc2C)n[nH]1	764106365	LIIATTYIBOCBAZ-AWEZNQCLSA-N	426.477	1.441	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2cc(F)ccc2OC[C@H]2CCCO2)c1O	764133878	YSDVUPBXBFPONM-CYBMUJFWSA-N	447.419	1.497	50	20	IDGD	
O=C(NNC(=O)c1ccoc1)C(=O)Nc1cccc(-c2cn(Cc3ccccc3)nn2)c1	764160097	NRVCUEFOVAVWRT-UHFFFAOYSA-N	430.424	1.986	50	20	IDGD	
O=C(CCCc1ccccc1)NNC(=O)C(=O)Nc1cccc(S(=O)(=O)NC2CC2)c1	764224469	QGMZXWNEZRPHRV-UHFFFAOYSA-N	444.513	1.236	50	20	IDGD	
CCCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(C#N)c2)cc1	764237550	IORICQQPUJUKRK-UHFFFAOYSA-N	429.458	1.110	50	20	IDGD	
Cc1ccc(C(=O)NC2CC2)cc1NC(=O)C(=O)NNC(=O)c1cccc(OC(F)F)c1	764249810	DYZJGHWYUPWFBO-UHFFFAOYSA-N	446.410	1.888	50	20	IDGD	
O=C(NNC(=O)c1cccc2ncccc12)C(=O)Nc1ccc(CN2C(=O)CCC2=O)cc1	764260818	RRYMSMYNWQAFKK-UHFFFAOYSA-N	445.435	1.284	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)C(=O)Nc1ccc([C@@H](C)NC(=O)OC(C)(C)C)cc1	764298161	PNOJYWQTYTWQRY-LLVKDONJSA-N	430.465	1.704	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C(=O)Nc1ccc(C)cc1OCC(=O)N(C)C)c1ccccc1	764330731	XAVYBBTUSXPAAF-KRWDZBQOSA-N	440.500	1.742	50	20	IDGD	
CCN(CC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)CC(=O)Nc1c(C)cccc1C	764332556	RHFJEDGFHINOEP-UHFFFAOYSA-N	427.461	1.933	50	20	IDGD	
CCN1CCC[C@@H]1CN1C[C@@H](C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)CC1=O	764332940	BISXGAOWVDXOMU-GOEBONIOSA-N	449.502	1.633	50	20	IDGD	
Cc1nnc(-c2cccc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc3ccccc3)c2)o1	764380323	VULHQPPFCIOADA-UHFFFAOYSA-N	431.355	1.803	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)C(=O)Nc1ccc(N2CCOC2=O)cc1	764392928	APDKSGCQDJJZGK-UHFFFAOYSA-N	430.442	1.227	50	20	IDGD	
C[C@@H](Cn1ncc2ccccc2c1=O)NC(=O)NNC(=O)c1cc([N+](=O)[O-])ccc1O	764466601	HYJODMCLTHUJLT-NSHDSACASA-N	426.389	1.043	50	20	IDGD	
C[C@H]1CN(C(=O)OC(C)(C)C)CC[C@H]1NC(=O)NNC(=O)c1cc([N+](=O)[O-])ccc1O	764541716	VXPQLQUCUPOCKV-SMDDNHRTSA-N	437.453	1.890	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)CN2C(=O)CCOc3ccccc32)n[nH]1	765600218	KLZAAZXGBMHUEC-UHFFFAOYSA-N	435.440	1.662	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3ccccc3Cn3cncn3)n[nH]2)cc1OC	765601990	VEHKRHXMTUBKAH-UHFFFAOYSA-N	447.455	1.809	50	20	IDGD	
Cc1ccc2c(CC(=O)NNC(=O)CN3CCN(C(=O)c4ccccc4)CC3)coc2c1	765739188	QONJAHDVTWRUNU-UHFFFAOYSA-N	434.496	1.889	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)c1cccc(CN2CCOCC2)c1	767345640	TZGSWPDLEDPOGY-UHFFFAOYSA-N	425.485	1.374	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCc2cccnc21)c1ccc(S(=O)(=O)N2CCCC2)cc1	767430220	GILYYLTXMZWUKZ-GOSISDBHSA-N	428.514	1.747	50	20	IDGD	
CCc1nn(C)c(Cl)c1C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	767641559	JMOZZKVNMQVCDM-UHFFFAOYSA-N	427.914	1.414	50	20	IDGD	
CCn1cnc2c1c(=O)n(CC(=O)NN=C(C)c1occc1C)c(=O)n2Cc1ccccc1	767753661	DNOWGVTZBLCALT-UHFFFAOYSA-N	448.483	1.870	50	20	IDGD	
Cc1ccnc(NNC(=O)CCC(=O)N2CCN(S(=O)(=O)c3ccc(F)cc3)CC2)c1	768228438	IZGBQYNZTHHNJS-UHFFFAOYSA-N	449.508	1.286	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)[C@@H](O)[C@@H](O)c1nc2ccccc2s1	768639437	QNCATICDEMAXSI-JKSUJKDBSA-N	437.499	1.246	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)[C@H](Cc3ccccc3)n3nnnc3C)n[nH]2)cc1	768849002	ZMQRXBQZEAWVHG-FQEVSTJZSA-N	430.472	1.925	50	20	IDGD	
COC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(NC(=O)NNc3cnccn3)cc2)C1	769942979	OYFYKWXUVGESDW-CYBMUJFWSA-N	434.478	1.199	50	20	IDGD	
Cc1c(C(=O)O[C@H](C)C(=O)NNC(=O)CC(C)C)nnn1-c1ccc(OC(F)F)cc1	772107093	ULWQFBGQGIVISR-GFCCVEGCSA-N	439.419	1.916	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)c1cccc(I)c1O	772315602	KQDDKPPVJJCJKR-VIFPVBQESA-N	434.230	1.736	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)c1cccc([C@@]2(C)NC(=O)NC2=O)c1	772965344	XFVQIAAHAVEBDP-BIBXISHDSA-N	430.848	1.623	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NCCc1ccc(OCC(F)(F)F)nc1	773263824	DSWHETLWJQZYPF-UHFFFAOYSA-N	445.423	1.387	50	20	IDGD	
COC(=O)CCNC(=O)c1ccc(NC(=O)C(=O)NNc2ccc3ccccc3n2)cc1	773661058	DQOAAOAZBZGUSI-UHFFFAOYSA-N	435.440	1.610	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ncn(Cc2ccccc2)n1	774009735	SJUKPPRKELBXCX-CYBMUJFWSA-N	442.863	1.533	50	20	IDGD	
O=C(NCc1cccnn1)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	775035293	YBQRKPHAGQSKPF-UHFFFAOYSA-N	429.440	1.379	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)NCCc2ccc(OCCN3CCCC3)cc2)n1	775456396	WQDZYORVYCQMCF-UHFFFAOYSA-N	428.537	1.548	50	20	IDGD	
CN(NC(=O)COCCOc1ccccc1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776203046	ZDODIAMXFSLZMK-UHFFFAOYSA-N	436.509	1.718	50	20	IDGD	
COc1ccc([C@@]2(C)NC(=O)N(CC(=O)NNc3cccc(S(C)(=O)=O)c3)C2=O)cc1	776528043	QFXAIVREDKOHAP-HXUWFJFHSA-N	446.485	1.009	50	20	IDGD	
CCC[C@H]1C[C@H](C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)CCO1	779713075	KCKUHDUUKFPCAF-SJORKVTESA-N	439.534	1.064	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1S(=O)(=O)NNC(=O)c1ccc2ccccc2n1	780363169	LQRRHZAYUNOFSA-UHFFFAOYSA-N	434.499	1.108	50	20	IDGD	
O=C(NNC(=O)C(=O)NC1CC1)C(=O)Nc1cc(C(F)(F)F)ccc1N1CCCCC1	782965113	GOQXPPPGAUXWQE-UHFFFAOYSA-N	441.410	1.060	50	20	IDGD	
O=C(NNc1ncnc2ccsc12)C(=O)Nc1cc2c(cc1[N+](=O)[O-])OCCCO2	783252778	CTOGGEUMECXLKD-UHFFFAOYSA-N	430.402	1.843	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NCc2ccc(N3CCOC3=O)cc2)c2ccccc2c1=O	783317917	XLLWHCHJHZYHBU-UHFFFAOYSA-N	436.428	1.034	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2cc(Cl)ccc2N2CCSCC2)CCS(=O)(=O)C1	783429054	ZIJYERVBJHIZEK-KRWDZBQOSA-N	446.982	1.030	50	20	IDGD	
O=C(NNc1ccccn1)C(=O)Nc1ccccc1N1CCN(CCc2ccncc2)CC1	784793894	YLVGRVQBSFMKRS-UHFFFAOYSA-N	445.527	1.923	50	20	IDGD	
COC(=O)c1cc(F)c(F)cc1NC(=O)C(=O)NNc1cccc(S(C)(=O)=O)c1	784844795	OGFKZRRGZWYABM-UHFFFAOYSA-N	427.385	1.237	50	20	IDGD	
COc1cccc(NNC(=O)C(=O)Nc2ccc(C(=O)N3CCOCC3)c(Cl)c2)n1	784846636	UQDVXGXFTYINFL-UHFFFAOYSA-N	433.852	1.298	50	20	IDGD	
Cc1ccc(-n2nc(NC(=O)C(=O)NNC(=O)Cc3cn4ccccc4n3)cc2C)cc1	785068560	WZBKSPVFOHKAIS-UHFFFAOYSA-N	431.456	1.465	50	20	IDGD	
CS(=O)(=O)CCOc1cccc(NC(=O)C(=O)NNc2cc(F)c(F)c(F)c2)c1	785088426	LRKPUOXHOITWHM-UHFFFAOYSA-N	431.392	1.609	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1cccc(S(=O)(=O)Nc2ccc(C)cc2)c1	785437618	OASZMPKJEFOZSL-CQSZACIVSA-N	433.486	1.899	50	20	IDGD	
CCS(=O)(=O)CCn1cc(C)c(NC(=O)NNC(=O)COc2ccc(Cl)cc2)n1	786741640	WNVQEHHXAWIYGN-UHFFFAOYSA-N	443.913	1.511	50	20	IDGD	
CN(C)[C@@H]1CCCC(=NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)C1	788408017	OUZCUZSYNQQOLE-LJQANCHMSA-N	436.578	1.617	50	20	IDGD	
Cc1cc(F)c(Br)cc1NC(=O)C(=O)NNC(=O)COc1ccccc1C#N	789586026	IQZRPTWLEFWDKT-UHFFFAOYSA-N	449.236	1.933	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H]2CC(=O)c3ccccc32)c1	789728002	VOQPQJDGANIHCZ-SFHVURJKSA-N	429.498	1.848	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)C(=O)Nc1ccnc(Oc2ccc(F)cc2F)c1	789734560	DARMTKUYNPVDBL-UHFFFAOYSA-N	427.367	1.876	50	20	IDGD	
COc1ccc(NC(C)=O)cc1NC(=O)C(=O)NNC(=O)[C@H]1OCC[C@H]1c1ccccc1	789818447	KZVCKZWZVYQCNW-LPHOPBHVSA-N	440.456	1.312	50	20	IDGD	
COc1ccc(C(=O)N2CCN(S(=O)(=O)CBr)CC2)c(OC(F)F)c1	789844072	FDZWUQLEAKSLIJ-UHFFFAOYSA-N	443.266	1.737	50	20	IDGD	
C[C@@]1(C2CC2)NC(=O)N(c2cccc(CNC(=O)NNC(=O)Cc3ccncc3)c2)C1=O	790892249	BNNCPTUDQBCZEQ-QFIPXVFZSA-N	436.472	1.380	50	20	IDGD	
N#Cc1ccc(C[C@@H](C#N)C(=O)N2CCN(S(=O)(=O)CBr)CC2)cc1	792299532	DGIIIZPTZALYIU-HNNXBMFYSA-N	425.308	1.067	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)C1(S(C)(=O)=O)CCN(C(=O)OC(C)(C)C)CC1	794797956	ZNGUUIKSLRWPID-UHFFFAOYSA-N	439.534	1.570	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)Cc2cccc3ccccc23)cc1OC	796999172	PJPHNIOMLGVWQH-UHFFFAOYSA-N	435.436	1.964	50	20	IDGD	
O=C(NNC(=O)c1cccn1-c1c(Cl)cccc1Cl)N[C@@H]1CCS(=O)(=O)C1	798929032	JXJZOBWSUSMRPZ-SNVBAGLBSA-N	431.301	1.915	50	20	IDGD	
Cn1cc2c(n1)CCC[C@H]2C(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	798980180	GNIDQHFRYCBNGM-GOSISDBHSA-N	444.967	1.459	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2cc(S(=O)(=O)N(C)C)ccc2O)c2ccccc2n1	799009654	HHJALCXGQPRIGY-UHFFFAOYSA-N	428.470	1.574	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc(O[C@H]2CCN(C)C2=O)cc1C	799258619	IEFREFVKOPFBHE-SFHVURJKSA-N	440.456	1.013	50	20	IDGD	
COC(=O)c1cc(C=NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)n(C)c1C	800814809	ZFQCXVSZQIJZKP-UHFFFAOYSA-N	425.533	1.696	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2CCCN(C(=O)c3ccc4n[nH]cc4c3)C2)cc1	801107134	MTHVHAFTTPMJEP-MRXNPFEDSA-N	448.483	1.510	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)N[C@H](C)CCNS(=O)(=O)c2ccccc2)c1	801738232	NFQUVUPQAVBPIB-MRXNPFEDSA-N	434.518	1.461	50	20	IDGD	
CS(=O)(=O)N1CCN(CC(=O)NNC(=O)Nc2ccc(-c3ccccc3)cc2)CC1	802039066	VLWCCFBCSCIGDO-UHFFFAOYSA-N	431.518	1.084	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2c(F)ccc(S(=O)(=O)NC3CC3)c2F)cc1	802054049	FPQOEKLZWURFMP-UHFFFAOYSA-N	440.428	1.881	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)C(C)(C)NC(=O)C(F)(F)F)c(OC)cc1Cl	802078043	ILFWPWJPMYOGGR-UHFFFAOYSA-N	426.779	1.967	50	20	IDGD	
CCCN(NC(=O)[C@@H](NS(=O)(=O)c1ccc(C)cc1)[C@H](C)O)C(=O)OC(C)(C)C	804592168	AQGHEPUZSUFMLX-HOCLYGCPSA-N	429.539	1.701	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)c1cccc(NS(=O)(=O)C(F)(F)F)c1	804954378	DEKLWQCEDFCBGL-UHFFFAOYSA-N	427.368	1.681	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@H](C(=O)NNc3ccc(-n4ccnc4)nn3)C2)cc1	804957213	FSHMPNJZDYFFQF-INIZCTEOSA-N	441.517	1.515	50	20	IDGD	
N#Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1Br	806972196	KYCRCUMGXRROTQ-UHFFFAOYSA-N	432.190	1.629	50	20	IDGD	
Cc1nc2c3cccnc3nn2c(C)c1CCC(=O)NNc1nccc(N2CCOCC2)n1	807075887	KTKADRUQVPKPSI-UHFFFAOYSA-N	447.503	1.597	50	20	IDGD	
Cc1nn(C)c(C)c1CC(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	807393780	PGFJMIBYUBMPIQ-UHFFFAOYSA-N	444.495	1.799	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)NCCCN2C(=O)c3ccccc3C2=O)cc1C	807494806	NQXMRPMBZSSVPQ-UHFFFAOYSA-N	437.456	1.259	50	20	IDGD	
CCO[C@H]1CC(=NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)[C@@H]1SC	807944292	WDQZLCCGFZNHJD-IRXDYDNUSA-N	427.548	1.334	50	20	IDGD	
O=C(NNC(=O)N1CC[C@]2(CCc3ccccc3O2)C1)c1csc(N2CCOCC2)n1	811851948	YUZAVNJBVACYBA-OAQYLSRUSA-N	443.529	1.804	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)c2cccc(NC(=O)[C@@H]3CCCO3)c2)cc1	812730210	AZIJJRFAZFGAQJ-SFHVURJKSA-N	432.502	1.811	50	20	IDGD	
C[C@@H](NCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)c1ccc(N2CCCNC2=O)cc1	812900807	MLKIZRYEQHTSRO-CQSZACIVSA-N	440.460	1.626	50	20	IDGD	
CC[C@@]1(C)Oc2ccc(NC(=O)C(=O)NNc3ccc(S(=O)(=O)N(C)C)cc3)cc2O1	813033495	WFZQLKAMXGJASB-FQEVSTJZSA-N	448.501	1.916	50	20	IDGD	
CC[C@@H]1[C@H](C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)CCN1C(=O)OC(C)(C)C	813367945	PZZSJRAXNXWDPN-HZPDHXFCSA-N	429.481	1.459	50	20	IDGD	
COC(=O)c1ccc(C=NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)n1C	814691146	OTPXNZGTEBJEII-UHFFFAOYSA-N	432.502	1.750	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1cccc(-n2ccnc2)c1	815751987	XGGNFOBYLVOYLV-UHFFFAOYSA-N	428.474	1.204	50	20	IDGD	
CN(C)c1nc(C=NNC(=O)CSc2nnc(O)nc2O)c(Cl)n1-c1ccccc1	818269459	AVDDKVODBSRITN-UHFFFAOYSA-N	448.896	1.430	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)[C@@H]2CCCCN2S(=O)(=O)c2ccccc2)cc1	825536033	KILAXFOCOXRWLL-IBGZPJMESA-N	446.529	1.498	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccc3c(c2)OCO3)CC1)NNC(=O)c1ccccc1Cl	897547659	BIKWVDUSXUBMJP-UHFFFAOYSA-N	444.875	1.288	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)NCCNS(=O)(=O)c2ccccc2)c1C	914723495	XDONHFJYITUSQE-XMHGGMMESA-N	430.530	1.753	50	20	IDGD	
CCS(=O)(=O)N1CCC(NC(=O)NNC(=O)c2cc3c(s2)CCCCC3)CC1	916260373	YGHTXZZHIFNYNB-UHFFFAOYSA-N	428.580	1.775	50	20	IDGD	
C[C@H]1CN(C[C@@H](C)C(=O)NN=Cc2ccccc2OCC(=O)N2CCCC2)C[C@@H](C)O1	916372164	OJLBMVVEIZVEIG-QRVBRYPASA-N	430.549	1.883	50	20	IDGD	
CC1CCN(c2ccc(CNC(=O)NNC(=O)[C@H]3COc4ccccc4O3)cn2)CC1	916388684	DMAMGKAHPJPJPM-LJQANCHMSA-N	425.489	1.988	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)NNC(=O)NCCNS(=O)(=O)Cc1ccccc1	916516570	GPALWUCLQZBWBF-UHFFFAOYSA-N	429.502	1.160	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NC[C@@H](C)N2CCc3ccccc3C2)nc1	916603949	UGHWTDHDWBZYSG-MRXNPFEDSA-N	446.577	1.841	50	20	IDGD	
O=C(CN1CCC[C@@H](C(=O)Nc2ccccn2)C1)NNC(=O)c1ccc([N+](=O)[O-])cc1	917397874	WRZNQTHLHDMJQS-OAHLLOKOSA-N	426.433	1.102	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNS(=O)(=O)c1cc(CNC(C)=O)ccc1OC	917731901	PPHRXXSYODQWJJ-UHFFFAOYSA-N	441.893	1.617	50	20	IDGD	
CCc1c(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cnn1-c1ccccn1	917919607	SNRGLMVMZBIAOR-UHFFFAOYSA-N	448.892	1.205	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)Nc2nc3c(s2)CCCC3)ccc1Cl	920928654	ZRHCGVJZBLJJAV-UHFFFAOYSA-N	429.911	1.789	50	20	IDGD	
C=C(Br)CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(CC)CC)c1	921126305	MAHARYPTNAMBDB-UHFFFAOYSA-N	433.328	1.570	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)c2cc(S(=O)(=O)NC)ccc2Br)cc1	1317701498	OHTWSYCVHRQVDO-UHFFFAOYSA-N	440.319	1.994	50	20	IDGD	
O=C(COCC(=O)NNC(=O)c1ccccc1Cl)NNC(=O)c1ccccc1Cl	1322539890	BMKDKGVALIHIDH-UHFFFAOYSA-N	439.255	1.232	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H]2CCCC[C@H]2N(C)C)c1	1322740632	OBSHKAPNEIXPRP-QZTJIDSGSA-N	439.582	1.534	50	20	IDGD	
Cn1cc(N2CC[C@H](NC(=O)NNC(=O)c3cc(F)ccc3Br)C2)cn1	1339222103	YLBXXDFQAODDMV-NSHDSACASA-N	425.262	1.545	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc3c(cc2Cl)NC(=O)C3)c1	1339758941	IYDNGXQDCOOIOU-UHFFFAOYSA-N	436.877	1.160	50	20	IDGD	
C[C@@H]1CCc2c(C(=O)N3CC[C@@]4(CN(C(=O)CCBr)CCO4)C3)n[nH]c21	1777850292	LHJSIUHPTJNOOT-KZULUSFZSA-N	425.327	1.688	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccn4nccc4c3)C2)C1	1778740531	SGDUXCSNZQTLFU-LPHOPBHVSA-N	435.322	1.951	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(CCN(C(=O)c3nnc(-c4ccccc4)o3)C2)C1	1779110949	WCNWRTNTUDFXTQ-LJQANCHMSA-N	449.305	1.965	50	20	IDGD	
C[C@@H](NNc1ccccc1)C(=O)N1CCO[C@]2(CCN(C(=O)CO[Si](C)(C)C)C2)C1	1779294728	LZJIXHRUWDADGB-UTKZUKDTSA-N	434.613	1.673	50	20	IDGD	
COc1ccc(OCC(=O)N2CCO[C@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)cc1	1779294753	MMQNNHADOZTQCI-NRFANRHFSA-N	436.581	1.755	50	20	IDGD	
Cn1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)c2cccnc21	1779296751	CPEGBWILKTYWNK-OAQYLSRUSA-N	430.581	1.868	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccccc1C(N)=O)C2	1779546873	VOLYYOHEUDLEQM-XMSQKQJNSA-N	447.608	1.765	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Br)C2)c1cc[n+]([O-])cc1	1779945447	QTWAJTNFEKSGQA-JKIFEVAISA-N	430.274	1.138	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)[C@@H]1SC(=N)NC1=O)C2	1780702525	KBELBSVGVDIJFZ-IFICMAFDSA-N	444.985	1.320	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](F)Br)C2)c(O)n1	1780774001	RKKRDQXHYPGMFY-HBUWYVDXSA-N	444.301	1.914	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Br)C1	1780776854	GRHAKMFTJRYJNJ-OZTPJHRESA-N	429.714	1.445	50	20	IDGD	
COc1ccc2[nH]cc(/C=C/C(=O)N3CC[C@@]4(C3)CN(C(=O)[C@H](O)CCl)CCO4)c2c1	1781389128	XECIZNKXKZRBTJ-YEWIQJOJSA-N	447.919	1.619	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)N1C[C@@H]3C[C@H]3C1)C2	1782175068	BOMUHBFZPSTSHL-PPQMTQGISA-N	427.973	1.094	50	20	IDGD	
CSCC[C@@H](O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CO[Si](C)(C)C)C2	1782231365	NAAVMPVRJHLCDM-GPMSIDNRSA-N	432.659	1.466	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cn4cccnc4n3)CCO2)C1	1783349230	KGDRUXBQBDFYRJ-SCLBCKFNSA-N	436.310	1.346	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3c(O)cc(O)cc3O)CCO2)C1	1783535739	BTZXSFQRPGOVGZ-BTDLBPIBSA-N	429.267	1.030	50	20	IDGD	
Cc1cc(C)c(OCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]3C2)c(C)c1	1784084229	OAQJGDASCFRVEA-VJANTYMQSA-N	438.952	1.570	50	20	IDGD	
CC(C)N1CCC(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)Br)C[C@@H]32)CC1	1784996591	NHVIPLNYBVJNFS-DKIMLUQUSA-N	444.414	1.870	50	20	IDGD	
CN(C)c1cncc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Br)C[C@@H]32)c1	1785555051	QFPGSPZLQOUOHV-DDWPSWQVSA-N	443.317	1.431	50	20	IDGD	
Cc1nccn1[C@@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCBr)[C@H]2C1	1786407676	HHMUQQNPYAMWBS-TUUVXOQKSA-N	427.343	1.517	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)c1ccc2c(c1)CCCC2=O	1787999658	XGWNSRHYYVOQPC-UUXHPUJUSA-N	434.920	1.399	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc4ncccn34)[C@H]2C1	1788004087	GCPMCNDXPXVTHA-ZOBUZTSGSA-N	431.569	1.174	50	20	IDGD	
CC(C)=NO[C@H](C)C(=O)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1	1788150280	AJARENJXNSFYOB-MRXNPFEDSA-N	437.305	1.915	50	20	IDGD	
CC(=O)O[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CO[Si](C)(C)C)C[C@@H]21)C(C)C	1788477767	BTDTYBKVGBLMJE-DWRORGKVSA-N	428.602	1.405	50	20	IDGD	
CC(=O)O[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]21)C(C)C	1788480733	YLRXRQGMDDOJLA-XHWCBRGXSA-N	437.364	1.790	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C=N/N3CCCCC3)[C@H]2C1	1788603485	FPKVFIFLMOFJOP-FBSHZBFYSA-N	429.359	1.221	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc4[nH]ncc4c3)C[C@@H]21	1789867831	GWRXNMXMHMZWMX-TZMKYKESSA-N	440.331	1.788	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)[C@H](F)Br	1789922660	NOTYOBLKVXCGTG-GMOBBJLQSA-N	430.112	1.442	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(Cl)ncn1)C2	1792872415	GBDFDGVQDJHVBL-DYNIEEOBSA-N	431.718	1.364	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](C)n1ccnc1	1793319474	NXKHDSYBRQNMHW-PIEAIKFESA-N	425.493	1.216	50	20	IDGD	
C=CCOCCCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2	1793574687	DKOBHYXFABUONW-DPEPCVEMSA-N	429.521	1.741	50	20	IDGD	
Cc1nc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)Br)C3)c(C)s1	1794181270	PIZCXJMYFIDION-NJYNRLGGSA-N	430.368	1.675	50	20	IDGD	
CC(C)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnn(-c2cccnc2)c1	1794442672	JPHNELSQEDNXNO-ALXJQNPVSA-N	431.924	1.736	50	20	IDGD	
CC(C)c1csc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)n1	1794547515	OVUGORLOSQVEFS-BJWYYQGGSA-N	427.335	1.512	50	20	IDGD	
CCCCC[C@@H](C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1	1796443842	NDRYICNSRLMKHY-XEBLMJKWSA-N	445.564	1.926	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1c[nH]c2ncccc12	1796876943	QZTDZNHIYXMCEC-RDBQEKCUSA-N	425.258	1.457	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(F)cnc1Cl	1798046023	GVMPFCNSPHDQMG-DRXBFXEBSA-N	429.952	1.929	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnn(C)c1Cl	1798346771	DMPOEJMRNYLXSP-LFSVMHDDSA-N	433.734	1.450	50	20	IDGD	
COc1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)cc1F	1798439491	CTJUGWJUXGXRRA-QDMKHBRRSA-N	441.463	1.398	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nn[nH]c1C(F)(F)F)C2	1799276767	LGLDLWGADABKHK-KSCJFIISSA-N	444.241	1.263	50	20	IDGD	
C[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@](C)(Cl)CCl)n1ccccc1=O	1799277508	WKJOQAVTWVMXTG-TWAUDHPGSA-N	430.332	1.235	50	20	IDGD	
COc1cc2c(O)cccc2cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2	1800012534	FTCGAUNVYGEEDD-VLBMKZOESA-N	448.903	1.357	50	20	IDGD	
CN(C)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C#N)=C/c1ccc(F)cc1F	1800332746	XTNAFVOIQREHJY-JFABSOQWSA-N	432.471	1.413	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(C(F)(F)F)ccn1)C2	1800977187	SXTKUPXXTJDQKA-WJNVRWDZSA-N	435.830	1.557	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(-c2ncc[nH]2)cc1	1801820531	ZLHLGVOHLSSQAJ-XMTFNYHQSA-N	432.908	1.534	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cc3ncsc3[nH]2)[C@H]1c1cccnc1)[C@H](O)CCl	1803142530	DZLIMJAXQSWTCA-MAZHCROVSA-N	433.921	1.939	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC2(CCCN(C(=O)[C@@H]3CCC(=O)NC3)C2)CC1	1804981862	KHLDRVZDLKMSNE-CABCVRRESA-N	428.371	1.917	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)c2ncn(C)n2)[C@@H]1c1cccnc1	1805328570	JSWFTKGZNMYCIC-KKUMJFAQSA-N	435.326	1.703	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCCC2(CCN(C(=O)Cn3cc(C)c(O)nc3=O)CC2)C1	1806164504	ZJQONJKAJSLZNM-INIZCTEOSA-N	438.956	1.896	50	20	IDGD	
COC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@@H]1c1cccnc1	1806377680	RSZQQDKMHIJYNR-APHBMKBZSA-N	430.274	1.731	50	20	IDGD	
C#CCCCCC(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1807374139	IRPNOLNNYUYBNP-OFNKIYASSA-N	433.317	1.275	50	20	IDGD	
Cc1cnn(CC(=O)NC[C@@H]2CCN(C(=O)[C@@H](F)Br)[C@@H]2c2cccnc2)c1	1807668583	NJTNLGSTQMGBBD-USXIJHARSA-N	438.301	1.983	50	20	IDGD	
CN1CCN(CCC(=O)N2CCCC3(CCN(C(=O)[C@@H](F)Br)CC3)C2)CC1	1809556467	SDASNLVRKMCAKK-QGZVFWFLSA-N	447.393	1.546	50	20	IDGD	
O=C(Cc1cccs1)N1CCCC2(CCN(C(=O)c3cccc(B(O)O)c3)CC2)C1	1810106422	LHYVISSYZNBTMX-UHFFFAOYSA-N	426.347	1.515	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1CCN(C(=O)COc2cccnn2)[C@@H]1c1cccnc1	1810547813	IYWUCZHLNFALEV-LAUBAEHRSA-N	443.580	1.808	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2ccc(F)nc2)[C@H]1c1cccnc1	1810700888	IYJDBKOOQRDOBY-HRAATJIYSA-N	442.495	1.308	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@H]1c1cccnc1)c1cnc(O)[nH]1	1810949955	GSKHOQHHXLVEHB-DRZSPHRISA-N	426.246	1.520	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)Cc2ccccc2)[C@H]1c1cccnc1	1813070510	IIMGIXVRIYFOMC-YKSBVNFPSA-N	437.544	1.703	50	20	IDGD	
N[C@@H](Cc1cscn1)C(=O)N1CC[C@H](CNC(=O)C(Cl)Cl)[C@@H]1c1cccnc1	1813079024	CNUKPVBIOLIBHC-SNPRPXQTSA-N	442.372	1.918	50	20	IDGD	
O=C(CCn1ccnn1)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@H]1c1cccnc1	1813432528	NCDWDVFTDQZLJJ-BPUTZDHNSA-N	439.289	1.460	50	20	IDGD	
O=C(CCN1CCOCC1)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](F)Br)CC2	1814643362	BVFBZWPFUOEORF-QMTHXVAHSA-N	449.346	1.468	50	20	IDGD	
CN1N=C(C(=O)Nc2cc([C@H]3CCCCN3C(=O)CCBr)[nH]n2)CCC1=O	1815620357	LVGXUGQQNOLWAG-CYBMUJFWSA-N	439.314	1.795	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccc(=O)n2O)n[nH]1	1816148903	JLRLRMUIMXINHC-ZYHUDNBSSA-N	438.282	1.898	50	20	IDGD	
Cc1ncsc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1816491852	GFVRHGXRVHAJEI-INIZCTEOSA-N	439.306	1.474	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3nc4ccccn4n3)sc2C1	1816659298	AYKAYJFCKPAPRY-GHMZBOCLSA-N	434.909	1.665	50	20	IDGD	
Cc1cccc(CC(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)c1	1816922440	VSYNROUVYWVASR-OAQYLSRUSA-N	446.316	1.947	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)Cc2cccnc2)[nH]n1)c1cccc(B(O)O)c1	1817475017	JMYZGZFVQFENQV-LJQANCHMSA-N	433.277	1.033	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1	1817475967	XPCMIQWWEHSTTD-NHYWBVRUSA-N	449.114	1.179	50	20	IDGD	
CCOC(=O)N[C@H](O)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](C)Br)[nH]n1	1819244456	VDGCKBURINIDOG-GLXFQSAKSA-N	446.302	1.250	50	20	IDGD	
Nc1n[nH]c(CCC(=O)N2CCCC[C@@H]2c2cc(NC(=O)[C@H](F)Br)n[nH]2)n1	1820935787	SXUGYHBFFQZKOY-RNCFNFMXSA-N	443.281	1.425	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3c4c(nn3C)CCC4)sc2C1	1824245693	YEDLDEWRSMYUDH-PWSUYJOCSA-N	437.953	1.845	50	20	IDGD	
CCc1oncc1C(=O)N[C@@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1	1826080494	NLHXYOOOLODSMN-LLVKDONJSA-N	434.522	1.292	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)C2CCOCC2)CC1	1826579448	VNTCQOKHMYBASP-OAQYLSRUSA-N	428.338	1.026	50	20	IDGD	
Cn1cccc1C(=O)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](F)Br)CC2	1827001703	UTQKWXPDLDIEQR-AMIZOPFISA-N	443.298	1.967	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)Cc2cscn2)CC1	1827124911	FPDLPARXKDJVKZ-HXUWFJFHSA-N	441.362	1.299	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H]2C[C@H](O)CN2)CC1	1830202424	LPBQRBMMWWNSST-BSWAZPDLSA-N	430.387	1.360	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2C[C@H](O)CN2)CC1	1830202426	LPBQRBMMWWNSST-IWCQGFGOSA-N	430.387	1.360	50	20	IDGD	
CCOc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)nn1	1830364397	IQHPBXSHUSVULZ-FQEVSTJZSA-N	440.928	1.210	50	20	IDGD	
CC[C@@H](NC(C)=O)C(=O)NC1CCN(C2CCN(C(=O)C(C)(C)CCl)CC2)CC1	1833094199	RDLTYVSETSYNRL-GOSISDBHSA-N	429.005	1.738	50	20	IDGD	
COCC1(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](F)Br)CC3)CC2)CC1	1833462709	VYHLHJRFVJCADX-OAHLLOKOSA-N	434.350	1.675	50	20	IDGD	
Cn1cc(CC(=O)N2CCC(N3CCC(NC(=O)CCBr)CC3)CC2)cn1	1834423588	SEZMRWLRGJKVIV-UHFFFAOYSA-N	440.386	1.319	50	20	IDGD	
C=CC(=O)N[C@@H](C)C(=O)N1CCC(N2CCC(NC(=O)CCBr)CC2)CC1	1834424109	YNFXVCDDFYJGPJ-AWEZNQCLSA-N	443.386	1.034	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(C)cnc3Cl)CCO2)C1	1834559337	HMDKVXCKGJCMTP-HNAYVOBHSA-N	446.331	1.367	50	20	IDGD	
CC(C)c1cc(C(=O)N2CCOC[C@]3(CN(C(=O)CCBr)CCO3)C2)n[nH]1	1834823638	AIVURCDKCIQMJZ-SFHVURJKSA-N	443.342	1.388	50	20	IDGD	
Cc1ccccc1NCC(=O)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1835867459	YBUJSOPDAHAJOW-LJQANCHMSA-N	430.332	1.667	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3[nH]nc4ccncc34)CCO2)C1	1836446055	VBCGNUUNCWGBSF-FQEVSTJZSA-N	435.912	1.293	50	20	IDGD	
O=C(C1Cc2ccccc2C1)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836721520	POQNPMYKCMXYCU-OAQYLSRUSA-N	434.964	2.000	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc4cncn4c3)CCO2)C1	1837118623	XPOHKJJMUNARNT-RXVVDRJESA-N	434.924	1.812	50	20	IDGD	
CC(C)c1cc(C(=O)N2CCOC[C@@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)no1	1837712271	MLJFZNMJEHQKPO-HXUWFJFHSA-N	439.585	1.720	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cnc4[nH]ncc4c3)CC2)CC1	1838306096	DNVCGQQIZXRJCQ-SFHVURJKSA-N	449.939	1.824	50	20	IDGD	
CSc1cccc(C(=O)N2CCO[C@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)c1O	1838565614	CCISLRMGZVGEJO-GOSISDBHSA-N	449.356	1.988	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cn4c(F)cccc4n3)C2)C1	1839148090	LXXXXSNKVZQBJB-VLIAUNLRSA-N	438.887	1.561	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccnc3C)C2)C1	1839963566	OHLNHEKYSHWFTR-VQIMIIECSA-N	440.338	1.634	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(C)nc3)C2)C1	1839963598	PQALPYDHFZGBIU-VQIMIIECSA-N	440.338	1.634	50	20	IDGD	
O=C(Cc1ccc2c(c1)CCO2)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1839998430	VQSKNRZAGRMOFT-AZUAARDMSA-N	426.872	1.155	50	20	IDGD	
CCc1ncsc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2	1840034873	ZTJGDWHNHHOAKZ-PXAZEXFGSA-N	446.367	1.559	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1C[C@]1(F)Cl)CCO2	1840242291	OJYHFYPOOMLCCH-GUYJKWIASA-N	441.725	1.398	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)[C@H]3CCCS3)CCO2)C1	1840580003	ZONIPLZGBDMHKA-COXVUDFISA-N	425.378	1.575	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc([C@H](C)C#N)c3)CCO2)C1	1840716723	RCNJIKNZUXKDBA-WVBUVRCRSA-N	449.935	1.637	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](O)[C@H](C(=O)N2CC3(CCCN3C(=O)[C@H](F)Cl)C2)C1	1843363859	CTHUZSNORSEDGI-RDBSUJKOSA-N	433.908	1.342	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)CC1CCN(C)CC1)C2	1843415080	ICNSXDWPFGKABR-LFVJCYFKSA-N	428.537	1.056	50	20	IDGD	
Cc1ccc(=O)n(C(C)(C)C(=O)N2CCCC23CN(C(=O)[C@H](C)CBr)C3)n1	1844353162	PFCLEJQMWZZQHD-CYBMUJFWSA-N	439.354	1.521	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)c2cnc(-c3ccccc3)s2)C1	1844547183	LBPRWYGBDUQTBK-UHFFFAOYSA-N	447.325	1.621	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2	1845166261	LAPBEPBTTQKVDB-KRWDZBQOSA-N	435.956	1.553	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CCc1ccc(C#N)cc1	1847211114	BBYRWLUCWJPHSD-NRTQMZOKSA-N	446.511	1.827	50	20	IDGD	
CC1(C)C=C(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](O)CCl)CN1C(=O)c1ccccc1	1847564842	ZTDLMPQTDHOHAZ-FHWLQOOXSA-N	445.947	1.649	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1ccc(CS(C)(=O)=O)nc1	1847869683	TUNJOQQHLDSYNF-ULQDDVLXSA-N	427.954	1.849	50	20	IDGD	
[C-]#[N+][C@@H]1CCCN1C(=O)CN(CC(=O)N1CCC[C@H]1C#N)[C@@]12C[C@@H]3C[C@@H](C[C@](O)(C3)C1)C2	2048532312	ZNGKHEQNHHQWJR-BIJGXDNXSA-N	439.560	1.754	50	20	IDGD	
O=C(C[C@@H](NC(=O)c1ccccc1Cl)c1ccccc1)NNC(=O)C(=O)NC1CC1	9889602	AMEQIPMWNGFBRW-QGZVFWFLSA-N	428.876	1.627	50	20	IDGD	
COc1ccc(C(=O)NNC(=S)NCCc2cccs2)cc1S(=O)(=O)N(C)C	11517369	ZGCOCJKFQVAAKC-UHFFFAOYSA-N	442.588	1.359	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(OCC(F)(F)F)nc2)c1	14260588	YKLUBIADWJBNFF-UHFFFAOYSA-N	446.407	1.348	50	20	IDGD	
O=C(CN1CCN(S(=O)(=O)c2ccccc2)CC1)NNC(=O)c1ccccc1Cl	15409988	IWWVZMHWSCLLEN-UHFFFAOYSA-N	436.921	1.108	50	20	IDGD	
Cc1c(NC(=O)[C@H](C)SCC(=O)NNC(=O)C2CC2)c(=O)n(-c2ccccc2)n1C	15794009	NLFSCPYXWZKKSQ-ZDUSSCGKSA-N	431.518	1.102	50	20	IDGD	
COc1ccc(-c2nnc(SCC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)n2C)cc1	21371696	PKAWPDKNTAQYKS-UHFFFAOYSA-N	442.457	1.952	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NCCOC)c(C(=O)NNC(=O)c2ccccc2)c1	27687476	KULYAVQFSLXXMI-UHFFFAOYSA-N	448.545	1.850	50	20	IDGD	
Cc1nc2n(n1)C[C@@H](NC(=O)NNC(=O)[C@H](C)Oc1cccc(Br)c1)CC2	727230008	YLFVWGNHXRFMES-GWCFXTLKSA-N	437.298	1.462	50	20	IDGD	
COc1cccc(S(=O)(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1	727351559	NHZQVLGFNREEAR-UHFFFAOYSA-N	439.515	1.103	50	20	IDGD	
O=C1Cc2cc(S(=O)(=O)NNC(=O)c3nnc(-c4ccccc4)o3)c(Cl)cc2N1	728014316	ABSXFAHBVBPLMW-UHFFFAOYSA-N	433.833	1.508	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@H]2CCCN2c2ccc(C#N)cc2)c2ccccc2c1=O	728170446	MVBAMZRKDXCWIY-LJQANCHMSA-N	430.468	1.718	50	20	IDGD	
CCCc1c(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)[nH]c(C)c1C(C)=O	728329521	BMKIAFIRKGEJAQ-KRWDZBQOSA-N	443.456	1.622	50	20	IDGD	
NS(=O)(=O)Cc1cccc(C(=O)NNC(=O)c2cc(F)ccc2Br)c1	728546788	GYOALTXHORIGPS-UHFFFAOYSA-N	430.255	1.452	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)nnn1-c1ccccc1Cl	728855284	FDCGYCLIRAEQCJ-UHFFFAOYSA-N	447.908	1.597	50	20	IDGD	
Cc1cccc(NS(=O)(=O)c2ccc(Cl)c(C(=O)NNC(=O)c3cnn[nH]3)c2)c1	729455734	WDNYJNGXCOQRET-UHFFFAOYSA-N	434.865	1.642	50	20	IDGD	
CC(C)(C)OC(=O)N1CCCC[C@@H]1C(=O)NNC(=O)c1csc(N2CCOCC2)n1	730515782	YRRAKJPQWQFLIU-CQSZACIVSA-N	439.538	1.530	50	20	IDGD	
COCCCNC(=O)NNC(=O)CC[C@H]1NC(=O)N(c2ccc(Cl)c(Cl)c2)C1=O	730531939	GDPDTOBHJXJJJA-CYBMUJFWSA-N	446.291	1.565	50	20	IDGD	
O=C(Oc1ccc(C=NNC(=O)[C@H]2CCS(=O)(=O)C2)cc1)c1cccc([N+](=O)[O-])c1	730577919	MIFGMHQPYIGTKW-HNNXBMFYSA-N	431.426	1.699	50	20	IDGD	
COc1ccc(-n2ccnc2SCC(=O)NNC(=O)COc2ccccc2O)cc1	730778628	RTVNCKUNJBRMJD-UHFFFAOYSA-N	428.470	1.905	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)[C@H](C)N1CCN(c2ccc(F)cc2)CC1	732264447	RPCYAABQMZXURV-INIZCTEOSA-N	429.496	1.604	50	20	IDGD	
O=C(COC(=O)c1cc(F)ccc1N1CCOCC1)NNC(=O)c1cccc([N+](=O)[O-])c1	732341812	NCBASWBYQXWZTG-UHFFFAOYSA-N	446.391	1.189	50	20	IDGD	
CN1CCN(c2cc(CNC(=O)NNC(=O)NCc3ccc(Cl)cc3)ccn2)CC1	732992733	YEAJOOZTNCENQK-UHFFFAOYSA-N	431.928	1.700	50	20	IDGD	
CCOCCCn1c(NNC(=O)Cn2cc([N+](=O)[O-])ccc2=O)nc2ccccc2c1=O	733268006	GDIHVYAZAWCHKG-UHFFFAOYSA-N	442.432	1.036	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)CNC(=O)c1ccc(C(C)(C)C)cc1	734263207	ZFSCMZZGPPCXIE-UHFFFAOYSA-N	435.525	1.569	50	20	IDGD	
CN1C(=O)C[C@@H](C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)[C@@H]1c1cccc(Cl)c1	734393605	SXOMQBCGRPWREW-AEFFLSMTSA-N	449.916	1.724	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)c2ccc(N3CCNC3=O)cc2)CC1	734824496	AIZOSUWLJJADIC-UHFFFAOYSA-N	446.508	1.560	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)c2cn(-c3ccccc3)nc2-c2ccccc2)c(=O)n(C)c1=O	735030709	HOJSGTISOYSWJY-UHFFFAOYSA-N	444.451	1.012	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)[C@@H]2CCC[C@@H](C(F)(F)F)C2)CC1	735118897	ZKTBRYIYKRFSOG-ZIAGYGMSSA-N	449.499	1.830	50	20	IDGD	
COC(=O)COc1cccc(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)c1	744619779	YIFSHDXDPKHMPE-UHFFFAOYSA-N	449.485	1.016	50	20	IDGD	
CN(CC(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1)c1ccccc1[N+](=O)[O-]	744619959	BJCXRIWNUTXHRU-UHFFFAOYSA-N	449.489	1.195	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)cc1	744879289	WTLZFIFYRYRHLL-UHFFFAOYSA-N	434.368	1.270	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NCCCN1C(=O)COc2ccccc21	745857637	RLWVCKDNYGTGGB-CQSZACIVSA-N	430.436	1.739	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)NC[C@H](C)CN2CCN(C)CC2)c(C)n1-c1ccccc1	745859841	FDTPTEBZZDZSCF-KRWDZBQOSA-N	426.565	1.922	50	20	IDGD	
CSCC[C@H](C(=O)NNC(=O)COc1ccc(C)cc1)N1C(=O)[C@H]2CCCC[C@@H]2C1=O	746129376	HXLMXKUEOSNUBE-OKZBNKHCSA-N	447.557	1.818	50	20	IDGD	
NC(=O)CC[C@@H](C(=O)NNC(=O)CCCc1ccccc1)N1C(=O)c2ccccc2C1=O	746210522	SHAKVEZVTFWPHS-SFHVURJKSA-N	436.468	1.087	50	20	IDGD	
COc1ccc(C2(CNC(=O)NNC(=O)Cc3cn4ccccc4n3)CCOCC2)cc1	746755879	LBCJMZHRDHOOPT-UHFFFAOYSA-N	437.500	1.964	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CN(C)CCCOc2cccc(S(C)(=O)=O)c2)cc1	747088541	RMPQVQUTCRADSR-UHFFFAOYSA-N	433.530	1.560	50	20	IDGD	
CC(C)C[C@H](NC(=O)c1ccc(Cl)cc1Cl)C(=O)NNC(=O)C(=O)N1CCCC1	748342435	HHDSKMJAUXKVKX-HNNXBMFYSA-N	443.331	1.908	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)NCCC(=O)N2CCN(c3ccccc3)CC2)c1	748466186	WDLCUDLHOHTDSZ-UHFFFAOYSA-N	439.516	1.443	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCn2cncc2C1)c1ccccc1NS(=O)(=O)c1cccs1	749568342	KAPBULBIRZQSIB-ZDUSSCGKSA-N	445.526	1.769	50	20	IDGD	
CN1C[C@H](NC(=O)NNc2ccc(S(=O)(=O)NC3CCCCCCC3)cn2)CC1=O	750653633	XSZCQOANQYNCBL-OAHLLOKOSA-N	438.554	1.330	50	20	IDGD	
Cc1nn(-c2ccc(F)cc2)c(C)c1CC(=O)NNC(=O)CNC(=O)c1cccs1	751206399	KTEYDJPLZATRAZ-UHFFFAOYSA-N	429.477	1.810	50	20	IDGD	
O=C(NCc1cccc(C(F)(F)F)c1)NNS(=O)(=O)c1cc(C(=O)O)ccc1O	751213519	ZIQQZEXDOQZKSK-UHFFFAOYSA-N	433.364	1.802	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)n[nH]2)cc1OC	751379957	AVVWXJYYIOXSLF-UHFFFAOYSA-N	448.480	1.563	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2ccc(=O)n(-c3cccc(F)c3)c2)cc1	751619342	XSWBTIOVGTZMJG-UHFFFAOYSA-N	444.444	1.847	50	20	IDGD	
CC[C@H](NC(=O)NNC(=O)[C@@H](C)Oc1ccc2ccccc2c1)C(=O)N1CCOCC1	753057035	KOABKBXOCICDOC-BEFAXECRSA-N	428.489	1.575	50	20	IDGD	
Cn1nc(SCC(=O)NN=C2CC3(CCCCC3)Oc3ccccc32)c(=O)n(C)c1=O	753696389	WRIATVJDPZFCKM-UHFFFAOYSA-N	443.529	1.577	50	20	IDGD	
CON(C)S(=O)(=O)c1ccc(NC(=O)NNC(=O)c2cc(-c3ccccc3)on2)cc1	755536518	VKTXLGAJALNNOV-UHFFFAOYSA-N	445.457	1.990	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)c2coc(S(=O)(=O)N(C)C)c2)cc1Cl	756143108	KWKBTMZNJKQREN-UHFFFAOYSA-N	446.869	1.667	50	20	IDGD	
CNC(=O)CCOc1ccc(NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1	756462984	ZZVCGDAQLHQUMR-UHFFFAOYSA-N	434.474	1.072	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1NS(C)(=O)=O	756782646	SUAMTAGHAMISAV-UHFFFAOYSA-N	444.473	1.719	50	20	IDGD	
Cc1nc(-c2ccc(C)c(NC(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)c2)n[nH]1	756871497	MJYFLKDFOWBBCU-UHFFFAOYSA-N	428.474	1.959	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)c1cc(-c2ccccc2)nc2cc(F)ccc12	758035691	NLCINMCCMBNEOF-GFCCVEGCSA-N	430.461	1.740	50	20	IDGD	
COC(=O)[C@@H](C)Cc1ccc(NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1	760077468	OQRSOURLVOUJAG-ZDUSSCGKSA-N	433.486	1.908	50	20	IDGD	
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)NNc1nc(O)c2ccccc2n1	760165391	ZDSGXCFSZQFMFY-INIZCTEOSA-N	438.444	1.339	50	20	IDGD	
CC(C)(C)C(=O)NNC(=O)C(=O)Nc1cccc(CS(=O)(=O)Cc2ccccc2)c1	761072424	MSMUMGJFTKHLHN-UHFFFAOYSA-N	431.514	1.934	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCCOc2ccc(Cl)cn2)nc1	761781067	UMOJJZPOXJATMD-UHFFFAOYSA-N	428.902	1.522	50	20	IDGD	
CCc1csc(-n2cc(C(=O)NNC(=O)c3nn(CC)c(=O)c4ccccc34)cn2)n1	762738952	VQWZDGRFFNPPDT-UHFFFAOYSA-N	437.485	1.696	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)CN(C)S(=O)(=O)c2ccc(NC(C)=O)cc2)n1	762914520	VOPGNOYWEGXOBS-UHFFFAOYSA-N	449.537	1.045	50	20	IDGD	
CCOC(=O)c1cnn2c(C(=O)NNC(=O)C3=S=C4CC[C@@H](C)CC4=C3)ccnc12	763270519	OSZFAHRMYDYWCO-LLVKDONJSA-N	427.486	1.505	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)Nc1ccc(-n2cccn2)c(Cl)c1	763579015	SNMMVAWIBCDGLT-QGZVFWFLSA-N	441.831	1.452	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(N3C(=O)CCCC3=O)cc2)c1	763619397	VVDOELJXAOEXEZ-UHFFFAOYSA-N	438.440	1.203	50	20	IDGD	
COCCOCc1cccc(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)c1	763728416	PKTXMUUXMZCOMG-UHFFFAOYSA-N	440.500	1.388	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)[C@H]3C[C@@]34CCOC4)c2)cc1	763731642	BGNSLQCGMZUJBX-WIYYLYMNSA-N	445.497	1.684	50	20	IDGD	
Cc1nnnn1-c1cccc(NC(=O)C(=O)NNC(=O)CC23CC4CC(CC(C4)C2)C3)c1	763736070	MKBPTZUXLUWSKF-UHFFFAOYSA-N	437.504	1.663	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(Cl)c2)cc1C	763747208	BLJSTDGMIORSEI-UHFFFAOYSA-N	438.893	1.810	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)cc1Br	763807104	KEOHHIJKBDDDMG-UHFFFAOYSA-N	431.246	1.794	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccn(Cc2ccccc2)n1	763873922	YHAZVDPCLAXIHL-CQSZACIVSA-N	425.420	1.624	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)C(=O)Nc1ccc(Oc2ccncc2)cc1	763916750	KLAOXHJCDSFICB-UHFFFAOYSA-N	444.411	1.249	50	20	IDGD	
Cc1cc(C(=O)NC(C)C)ccc1NC(=O)C(=O)NNC(=O)c1cc(Cl)ccc1O	763978876	OAYMPRCEXHORSK-UHFFFAOYSA-N	432.864	1.892	50	20	IDGD	
COc1cc(Br)c(NC(=O)C(=O)NNC(=O)c2cccn2C)cc1OC	763995019	CUMUMDHBWZZJEE-UHFFFAOYSA-N	425.239	1.205	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)Nc1ccc(-c2csnn2)cc1	764004537	GIXOGMQWWHWWAI-UHFFFAOYSA-N	449.290	1.706	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1ccc(OCc2ccccc2)nc1	764005964	GYDWMXLUIGCLMC-UHFFFAOYSA-N	448.435	1.832	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccn(-c2ccc(C#N)cc2Cl)n1	764040723	KLOSUMYSKVZECL-UHFFFAOYSA-N	438.831	1.806	50	20	IDGD	
O=C(NNC(=O)c1cccc(Br)c1)C(=O)Nc1ccc(-n2cncn2)c(F)c1	764062819	FJBZXZNBKKLSHW-UHFFFAOYSA-N	447.224	1.569	50	20	IDGD	
CC[C@@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(Cl)c(S(=O)(=O)N(CC)CC)c1	764086017	SGBACQWDGDFJEY-LLVKDONJSA-N	432.930	1.503	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccnn3Cc3ccccn3)n[nH]2)cc1	764111791	QKPATJZWQYYRRT-UHFFFAOYSA-N	444.455	1.425	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1cccc(C(=O)NC(C)(C)C)c1	764136377	POSJBLXRTTXFLQ-UHFFFAOYSA-N	426.473	1.552	50	20	IDGD	
NC(=O)C1CCN(c2ccc(NC(=O)C(=O)NNC(=O)CCc3ccccc3)cc2)CC1	764185225	KHTWCINICMSIPL-UHFFFAOYSA-N	437.500	1.107	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(OC(F)F)c2)cc1S(C)(=O)=O	764259147	DHVSZEBREHNLNN-UHFFFAOYSA-N	441.412	1.400	50	20	IDGD	
CCOC(=O)c1cc(F)c(F)cc1NC(=O)C(=O)NNC(=O)COc1ccccc1O	764275121	JMBFIIDJUYJNFZ-UHFFFAOYSA-N	437.355	1.012	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)CCc2ccccc2O)ccc1Br	764288171	DZNCQGFZBQTBCF-UHFFFAOYSA-N	436.262	1.882	50	20	IDGD	
C[C@@H](c1ccc(NC(=O)C(=O)NNC(=O)CCc2ccccc2O)cc1)N1CCOCC1	764289243	QDSSFDFQLJFCMF-INIZCTEOSA-N	440.500	1.504	50	20	IDGD	
Cc1cc(C)nc(Sc2ccc(NC(=O)C(=O)NNC(=O)Cc3cc[nH]n3)cc2)n1	764297752	YEDZJBZTFSAYMQ-UHFFFAOYSA-N	425.474	1.296	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)C(=O)Nc1ccc(NC(=O)[C@@H]2CCCO2)cc1	764321472	XRIAPJBARLWOFY-KRWDZBQOSA-N	428.420	1.272	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@H]2C)ccc1NC(=O)C(=O)NNC(=O)c1cnn(C)c1	764360187	UJYRWQHPQVKERQ-CQSZACIVSA-N	426.477	1.143	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)NCC(=O)N1CCN(c2ccccc2)CC1	764384316	NWQFCJJVAQDZDH-UHFFFAOYSA-N	443.529	1.164	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)[C@H](C)NS(=O)(=O)c3ccc(C#N)cc3)cc2C1	764569990	AGRGJLMUZPEIDD-STQMWFEESA-N	446.554	1.873	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNc2cncc(Cl)n2)cc(Br)c1F	764674459	ZRZDALAERCUOIW-UHFFFAOYSA-N	446.620	1.900	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)CN1CCN(C(=O)c2ccc([N+](=O)[O-])s2)CC1	766845908	MUZVGJLFDNOSNG-UHFFFAOYSA-N	445.501	1.113	50	20	IDGD	
CN(C)CCS(=O)(=O)c1ccccc1C(=O)NNC(=O)c1cccc(OC(F)F)c1	767415022	NVOGABWCCZPISU-UHFFFAOYSA-N	441.456	1.698	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CSc2nnc(-c3cc(-c4ccccc4)[nH]n3)n2N)c1	768438138	SMKVHAVNWLXJLI-UHFFFAOYSA-N	448.512	1.911	50	20	IDGD	
O=C(NNC(=S)Nc1ccccn1)c1ccc(S(=O)(=O)NC[C@H]2CCCO2)cc1	768581374	OWWDBCFUOQRNJM-CQSZACIVSA-N	435.531	1.170	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)c3ccc(S(=O)(=O)Nc4ccccc4)cc3)nc21	770974658	OGARNHWORVDHLS-UHFFFAOYSA-N	439.457	1.627	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)Cc1ccccc1I	771254930	JZICMKJQPDMRJH-UHFFFAOYSA-N	427.198	1.004	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)C(C)(C)S(=O)(=O)c1ccc(Br)cc1	772067552	DYAVLXNVRFMRGR-SNVBAGLBSA-N	449.323	1.491	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CCCNC(=O)c2cccnc2)cc1Br	772118022	HEJJTOGZJHNTTL-UHFFFAOYSA-N	435.278	1.824	50	20	IDGD	
C[C@H]1CN(c2ccc(C(=O)NNC(=O)C(=O)NCc3ccc(Cl)cc3)cn2)C[C@@H](C)O1	772194783	DOMXRZOFFRYHOC-OKILXGFUSA-N	445.907	1.426	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)CNC(=O)c2cc3ccccc3[nH]2)C1	773411789	RJUWBCYBQBBZCC-HNNXBMFYSA-N	443.504	1.692	50	20	IDGD	
CCNC(=O)COc1ccc(NC(=O)C(=O)NNc2ncc(Cl)cc2Cl)cc1	773680493	RDFLSPJPBHRRSM-UHFFFAOYSA-N	426.260	1.985	50	20	IDGD	
COc1ccc(S(=O)(=O)C(F)(F)F)cc1NC(=O)C(=O)NNc1cccc(C#N)c1	773689624	UVYPJWUBCQAFPP-UHFFFAOYSA-N	442.375	1.942	50	20	IDGD	
COc1ccccc1[C@](N)(C(=O)NNC(=O)c1nnc(O)c2ccccc12)C(F)(F)F	776096486	LQIQSJLTQAREFW-SFHVURJKSA-N	435.362	1.522	50	20	IDGD	
COCCO[C@@H]1COCC[C@@H]1NC(=O)NNC(=O)c1ccc(COc2ccccc2)o1	776845250	UMMCLLGNVDAEJI-PKOBYXMFSA-N	433.461	1.623	50	20	IDGD	
CN(NC(=O)COc1c(I)cc(Cl)c2cccnc12)C(N)=O	778416645	GLHGDZRLLUUDQP-UHFFFAOYSA-N	434.621	1.913	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2ccc(C(=O)NNc3ncncc3Cl)cc2)C[C@@H](C)O1	781829546	AVQXASHDDFMUTP-TXEJJXNPSA-N	425.898	1.685	50	20	IDGD	
O=C(NCc1ccccc1CN1CC[C@@H](O)C1)NNC(=O)c1ccc2c(c1)OCCO2	781835712	VRJKAFSDLHIFBB-GOSISDBHSA-N	426.473	1.169	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCOC[C@@H]1CC(=O)c1ccco1	781929795	FIODBEPDTFGXPO-AWEZNQCLSA-N	435.864	1.676	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN[C@@H](CO)c2ccc(C(F)(F)F)cc2)cc1OC	782090158	JDONPEZNXAPFJI-HNNXBMFYSA-N	441.406	1.807	50	20	IDGD	
Cc1ccc(-n2nc(NC(=O)C(=O)NNC(=O)Cc3nc4ccccc4n3C)cc2C)cc1	782885764	IBLVMEIGVZNZMK-UHFFFAOYSA-N	445.483	1.704	50	20	IDGD	
CCOC(=O)c1c(F)cccc1NC(=O)C(=O)NNC(=O)Cc1nc2ccccc2n1C	782888054	VHEYCHOWYJLLIY-UHFFFAOYSA-N	441.419	1.218	50	20	IDGD	
CCc1c(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)cnn1CC(C)C	782893737	KNRHMOZZVANBML-UHFFFAOYSA-N	425.493	1.317	50	20	IDGD	
O=C(NNc1ncnc2ccsc12)C(=O)Nc1ccc(CCN2CCOCC2)cc1	783262187	NVFMYSIFXOBYBI-UHFFFAOYSA-N	426.502	1.648	50	20	IDGD	
CCOc1cc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)ccc1C	783265835	YKZDAVCKCZCWEG-UHFFFAOYSA-N	435.506	1.557	50	20	IDGD	
COc1ccc(Cn2nccc2NC(=O)C(=O)NNc2cc(C)ccn2)c(OC)c1OC	783930743	MBDOJOYJFNMGGI-UHFFFAOYSA-N	440.460	1.742	50	20	IDGD	
CCOC(=O)c1ccccc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)C(F)F)cc1	784834236	YLDVOAAMTJPAIS-UHFFFAOYSA-N	441.412	1.941	50	20	IDGD	
COc1cc(OC)c(NC(=O)C(=O)NNc2cccc(S(C)(=O)=O)c2)cc1Cl	784839857	QUAJQAXIBRBDLL-UHFFFAOYSA-N	427.866	1.843	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(NC(=O)C(=O)NNc2cccc(OC)n2)ccc1C	784846766	VMCMRJTVWDWHRN-UHFFFAOYSA-N	435.506	1.511	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ccc(C#N)c(Cl)c2)cc1S(=O)(=O)N(C)C	785092057	QWIFOOHLYCTXRZ-UHFFFAOYSA-N	435.893	1.852	50	20	IDGD	
C[C@H]1CC(C)(C)C[C@@]2(C1)NC(=O)N(CC(=O)NNc1ccc(-n3ccnc3)nn1)C2=O	788177737	MBLHQQHKBIJNNR-RNODOKPDSA-N	426.481	1.242	50	20	IDGD	
Cc1ccc2[nH]cc(C(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)c(=O)c2c1	788260633	CUMMAJHGVBTZEX-UHFFFAOYSA-N	428.470	1.162	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)[C@H]2CCCc3c(O)cccc32)cc1OC	789252919	OVFQMGMGNUWIOU-INIZCTEOSA-N	428.441	1.834	50	20	IDGD	
CCCOc1nc(C)ccc1C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	790120589	SDBDRHAZIJOGGF-UHFFFAOYSA-N	426.882	1.554	50	20	IDGD	
CC(C)c1c(C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)cnn1-c1ccccc1Cl	790491295	HGQJLLOMKAXLMW-LBPRGKRZSA-N	439.925	1.780	50	20	IDGD	
CC(C)=CCCNC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	790516627	FMZQOAXJPPPKLG-UHFFFAOYSA-N	438.550	1.327	50	20	IDGD	
CCOc1nc(C)ccc1C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	790783569	FKXUTICKIJIIDQ-UHFFFAOYSA-N	425.489	1.008	50	20	IDGD	
CCS(=O)(=O)c1ccc(CNC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)s1	792217093	CPHNZDAIRRHGIU-AWEZNQCLSA-N	425.488	1.212	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(Cc2nnc3n2CCC3)cc1	792263981	HCYMGZZOYQBCBC-UHFFFAOYSA-N	449.427	1.123	50	20	IDGD	
CCn1cc([C@H](O)CN(CC(=O)NNC(=O)c2cccs2)Cc2ccccc2)cn1	792365334	NECQMRBAFWVSNM-GOSISDBHSA-N	427.530	1.961	50	20	IDGD	
COC(=O)Cn1ncc(NC(=O)C(=O)NNc2ccc(Br)c(F)c2)c1C	797017506	SRUURXXTJYGZNU-UHFFFAOYSA-N	428.218	1.348	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)Nc1cccc2c1CCO2	797670362	AADZSIQDOMJEOI-UHFFFAOYSA-N	430.486	1.873	50	20	IDGD	
CC(=O)NNC(=O)c1ccc(I)c(I)c1	798823632	OCIDHFTUHQYQKZ-UHFFFAOYSA-N	429.983	1.677	50	20	IDGD	
Cc1cc(O[C@H]2CCN(C)C2=O)ccc1NC(=O)C(=O)NNc1cccc(F)c1[N+](=O)[O-]	799262855	FGUMBZUPGYYJEA-INIZCTEOSA-N	445.407	1.734	50	20	IDGD	
O=C(CCCCC(=O)NN=C1CC(=O)N2CCCC[C@H]12)NN=C1CC(=O)N2CCCC[C@H]12	799467259	IZVCVYKXRTWCIT-QZTJIDSGSA-N	444.536	1.061	50	20	IDGD	
CNC(=O)CNC(=O)c1cccc(NC(=O)NNC(=O)COc2cc(C)ccc2C)c1	800597527	YAOZHHWACAZCSY-UHFFFAOYSA-N	427.461	1.011	50	20	IDGD	
O=C(CN1CCN(CC(=O)N2CCCCCC2)CC1)NNC(=O)c1cccc(Cl)c1	800722116	WDLWHZYGCXUFGO-UHFFFAOYSA-N	435.956	1.121	50	20	IDGD	
C[C@]1(c2ccc(C(=O)NNC(=O)Nc3ccc(Br)cc3)cc2)NC(=O)NC1=O	801998239	VMSIVKZFYYZMCA-GOSISDBHSA-N	446.261	1.970	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@H]2CCCN2C(=O)Cc2ccccc2)cc1	802063481	GXBSTKODVNLLHH-GOSISDBHSA-N	444.513	1.477	50	20	IDGD	
Cc1ccc(C)n1-c1c(C(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)cnn1C	802068576	LKNCEVPVTKUBIQ-UHFFFAOYSA-N	430.490	1.698	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)c2ccc(CS(N)(=O)=O)cc2)c(OC)cc1Cl	802078646	RTJCAALTJUHZCW-UHFFFAOYSA-N	442.881	1.612	50	20	IDGD	
O=C1N[C@H](C(=O)NNc2ccc(-n3ccnc3)nn2)CS[C@H]1Cc1ccccc1F	804951428	ROGGUNISLSFJAM-GJZGRUSLSA-N	427.465	1.087	50	20	IDGD	
O=C(NC[C@H](N1CCOCC1)C(F)(F)F)NNC(=O)c1cccc(Br)c1	805160455	YQUMSGJESJSQRC-LBPRGKRZSA-N	439.232	1.656	50	20	IDGD	
CCOC(=O)C(C)(C)CC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	806782335	KGDVKHJCNBOARQ-UHFFFAOYSA-N	426.539	1.045	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc2c(c1)OCCCO2)NNc1nccnc1C1CCC1	807779621	OWNNPKMNXLCCPP-UHFFFAOYSA-N	433.490	1.327	50	20	IDGD	
Cc1ccc(S(C)(=O)=O)cc1C(=O)NNC(=O)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	808010523	BJEJWNBVRZVOMM-CQSZACIVSA-N	439.534	1.807	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)(F)F)cc1)C(=O)Nc1cccc2c1COC2=O	808938531	YCKGGXHYGOLQQP-UHFFFAOYSA-N	443.359	1.732	50	20	IDGD	
Cc1ccc(S(=O)(=O)N=S2(=O)CCN(S(=O)(=O)CCCCCl)CC2)cc1	809383653	HKBBMZRVYLNWKV-UHFFFAOYSA-N	443.012	1.816	50	20	IDGD	
COC(=O)c1c(F)ccc(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3n2)c1F	810385411	RUUZQRSRQFPJTG-UHFFFAOYSA-N	428.351	1.699	50	20	IDGD	
Cc1cc(C)nc(-n2nccc2NC(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)n1	812966644	UMPWJMVCMKCUIE-UHFFFAOYSA-N	430.494	1.678	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1csc(N2CCOCC2)n1)[C@@H]1OCCc2sccc21	813867745	UHLMVTXIYIRRDA-NHYWBVRUSA-N	437.547	1.688	50	20	IDGD	
Cc1ccc(-n2[nH]c(C(=O)NNC(=O)[C@H]3CCCN(C(=O)OC(C)(C)C)C3)cc2=O)cc1	819658587	NMQXVRHOJSXCRL-HNNXBMFYSA-N	443.504	1.882	50	20	IDGD	
CC(C)[C@@H](NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)c1ccc2c(c1)OCCO2	838617009	OJRQVUHMCZBARR-LJQANCHMSA-N	437.460	1.775	50	20	IDGD	
O=C(NNC(=O)C1CC1)c1cc(S(=O)(=O)NC[C@H]2CCCO2)ccc1Br	913415822	QKLVIKOJGXXVIJ-LLVKDONJSA-N	446.323	1.077	50	20	IDGD	
O=C(NN=C1CCN(c2cnccn2)CC1)c1cccc(S(=O)(=O)N2CCCC2)c1	915935844	YMWFXLWSDQOZTP-UHFFFAOYSA-N	428.518	1.647	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCc2ccc(Cn3cncn3)cc2)nc1	916227799	MBABNTKIUWORQD-UHFFFAOYSA-N	444.521	1.234	50	20	IDGD	
CCN(CC)[C@H](CNC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)Cc1ccccc1	916442230	ITLCNHOSWBUGMP-IBGZPJMESA-N	446.573	1.987	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)CCc3c(C)c4c(C)nn(C)c4[nH]c3=O)n[nH]2)cc1	917178834	UGNGSTOBECXKOZ-UHFFFAOYSA-N	447.499	1.971	50	20	IDGD	
O=C(Cn1cnc2ccc(Br)cc2c1=O)NNC(=O)c1ccc(Cl)nc1	917252368	NGPANNUPYFMYJL-UHFFFAOYSA-N	436.653	1.669	50	20	IDGD	
CNC(=O)Cn1cc(NC(=O)/C(C#N)=C/c2cn(CCC#N)nc2-c2ccccc2)cn1	918633715	DZTGVJANVSAQIV-LICLKQGHSA-N	428.456	1.952	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCc2ccn(-c3ccccc3)n2)c2ccccc2c1=O	919658388	UWMNLYQBGJVOCR-UHFFFAOYSA-N	431.456	1.746	50	20	IDGD	
Cc1ccc(O[C@@H](C)C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)c(Br)c1	919885060	JPVULVWFYPZUOQ-QWRGUYRKSA-N	434.312	1.042	50	20	IDGD	
COc1ccc(C2(C(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)CCOCC2)cc1	920285324	PATGBSHFYNYNRN-UHFFFAOYSA-N	436.468	1.452	50	20	IDGD	
CCn1cc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)ccc1=O	920929666	XXPNWRJGDPAVBJ-UHFFFAOYSA-N	433.490	1.119	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cc(S(=O)(=O)N3CCC[C@@H](C)C3)cn2C)cc1	1116004750	SADUZXQQKSKWEL-CQSZACIVSA-N	434.518	1.529	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)cs1	1252237127	ILXCOUBFETUSLJ-UHFFFAOYSA-N	447.535	1.491	50	20	IDGD	
COC(=O)c1ccc(C(F)(F)F)cc1S(=O)(=O)NNC(=O)c1n[nH]c2c1CCCC2	1318315504	DPFUTPWGYQNTHH-UHFFFAOYSA-N	446.407	1.717	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CCNC(=O)[C@@H]2CCCN2C(=O)OC(C)(C)C)cc1	1320292743	PXNJOLIIQDMKIY-INIZCTEOSA-N	434.493	1.362	50	20	IDGD	
CN1CCc2cc(C(=O)N3CC[C@@]4(CN(C(=O)CO[Si](C)(C)C)CCO4)C3)ccc21	1777918679	DMKHCXHUIWKDHB-JOCHJYFZSA-N	431.609	1.974	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(O)nc(O)n2)C1	1778014874	FWACSJIRLIDNKF-BBEGDGIKSA-N	426.901	1.423	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(CCN(C(=O)c3[nH]cnc3-c3cccnc3)C2)C1	1780052069	FVJCIFYPPWFFKA-IBGZPJMESA-N	448.321	1.700	50	20	IDGD	
COC(=O)C12CC(C(=O)N3CCO[C@@]4(CCN(C(=O)[C@@](C)(Cl)CCl)C4)C3)(C1)C2	1781232582	KTEBOCUZNGBCJP-MKCYZYCBSA-N	433.332	1.396	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cccc(F)c3[N+](=O)[O-])C2)C1	1781773023	YAJZZAMRUSYGRB-PIGZYNQJSA-N	444.257	1.961	50	20	IDGD	
CC(=O)N/C(=C\c1ccco1)C(=O)N1CC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1781859986	OACXNAUQQNHRKJ-LRJKXPEMSA-N	437.924	1.852	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)c1ccccc1)C2	1782209012	GRDIOQWWCKMJQV-RZFNWQHOSA-N	448.539	1.584	50	20	IDGD	
Cc1ccc(O)c(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CCC(=O)NN(C)C)C2)c1	1782212373	XZOBUJLRCWDQDR-AUSIDOKSSA-N	446.548	1.201	50	20	IDGD	
Cn1nc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)C(Cl)Cl)C2)c2c1CCC2	1782217553	NWKKENRGAPTXQY-AUUYWEPGSA-N	429.348	1.840	50	20	IDGD	
O=C(C1CCN(c2ccc(F)cn2)CC1)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Cl)CCO2	1782797925	SEOGUCAUKUCSDO-XLIONFOSSA-N	442.894	1.801	50	20	IDGD	
COc1cc(F)ccc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2	1782846282	KCYSGYFLGAQFMP-XAUMDUMWSA-N	428.888	1.562	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ncn(C(C)C)n3)CCO2)C1	1783348023	SBXSCUYBEAKRQK-CXAGYDPISA-N	428.331	1.476	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)c1cc(C2CC2)on1	1783762480	MXAKDSOLPNIDGM-LWWSYDQCSA-N	430.274	1.836	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cn3ccc4c(F)cccc43)C[C@@H]21)[C@H](O)CCl	1784083897	HYMMKNQBVPOAMR-JOQQVMPUSA-N	437.899	1.360	50	20	IDGD	
O=C1CCCc2cc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]4C3)ccc21	1784093479	WGVTZYWDIJKYBR-UHMOLFJZSA-N	434.920	1.399	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C[C@H]3CCCCO3)[C@H]2C1	1784957193	KBFYGNPVUVDLKC-KSWRQPAISA-N	431.371	1.956	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CC=CCC3)C[C@@H]21	1787506811	OIKVCRWEPLKFPP-OWDVSOMSSA-N	441.532	1.456	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc4ccccc4o3)[C@H]2C1	1787946850	DVWROFZKGYWTFE-ZWOKBUDYSA-N	442.516	1.399	50	20	IDGD	
CC(C)CNC(=O)C(=O)Nc1ccc(C2(NC(=O)CCC(=O)NN(C)C)CCC2)cc1	1788666944	NUXOIGOHTZPDHX-UHFFFAOYSA-N	431.537	1.266	50	20	IDGD	
COc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Br)C[C@@H]32)ccn1	1788906694	XYOMIBIUPWQSTQ-ABHRYQDASA-N	430.274	1.374	50	20	IDGD	
CCN(C)[C@@H](C)C(=O)NC1(c2ccc(NC(=O)c3cnccc3C(=O)NN)cc2)CCC1	1789521684	CYVNLIXEGUVILA-HNNXBMFYSA-N	438.532	1.773	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(O)c(F)c3)C[C@@H]21)[C@@H](F)Br	1789923353	HTMNHCHAJBKRTL-LWWSYDQCSA-N	433.249	1.815	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc(OC)c(C)c3)C[C@@H]21	1791251231	ASKGICSVUBPHDL-LLLHUVSDSA-N	425.913	1.246	50	20	IDGD	
CC[C@@H](NC(=O)OC(C)(C)C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Cl)C[C@@H]21	1792128536	CYDJOXKUPSYKPF-SBJFKYEJSA-N	435.924	1.804	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nnsc1C1CC1)C2	1792868106	PUHNJRNYIWAHTJ-SYEHKZFSSA-N	443.367	1.650	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnn(C(C)(C)C)c1)C2	1792869968	FIOCXSCLFHAYRT-HNKHHVNMSA-N	441.370	1.872	50	20	IDGD	
O=C(/C=C/c1ccc([N+](=O)[O-])o1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2	1793108013	PGOMFBQHHMTXRG-VIQOOVDJSA-N	442.266	1.576	50	20	IDGD	
Cc1c(Br)c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](O)CCl)nn1C	1793113556	NRSQYHLCUGXHMQ-USZNOCQGSA-N	433.734	1.343	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN(C)C(=O)c1ccccc1)C2	1793447858	NTDLMBRLKDYPGJ-DMUMMCEESA-N	435.952	1.756	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(C(=O)O)n(C(C)C)n1	1794434661	ATVOAZJUWFGJGE-ZWUHOBOKSA-N	426.901	1.383	50	20	IDGD	
C[C@@H](Nc1cccnc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2	1795606223	WBYKFCLYJJWVNS-AMVBZWJASA-N	429.290	1.162	50	20	IDGD	
CC(=O)Nc1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)ccc1C	1796193138	NQRNIVKWAZNAJF-WKCHPHFGSA-N	449.316	1.199	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccncc1F)C2	1796892484	HBEDPZZFLNOMHH-SSJPOKSSSA-N	426.452	1.607	50	20	IDGD	
CC(C)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(-c2ccncc2)[nH]n1	1798146004	ISGYVZYXJFQCBO-JLVBRIDZSA-N	431.924	1.940	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(Cl)s1)C2	1798440833	XZJVRWZACNENPL-ZSBIGDGJSA-N	433.921	1.966	50	20	IDGD	
Cc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)Br)C3)nn1C(F)F	1798677284	QVAFZFYWUFLUOX-HNCHTBHHSA-N	435.269	1.573	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cn(C(C)(C)C)nn1	1798708440	DYMGGLSQMALOAM-NRWUCQMLSA-N	428.331	1.020	50	20	IDGD	
COC(C)(C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C#N)=C/c1ccc(F)cc1F	1800329870	HILBRKXKDNEJSU-SQABCVSLSA-N	433.455	1.886	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cccnc1Cl)C2	1800756456	DCPDRZFAILLUGS-DNVSUFBTSA-N	430.730	1.651	50	20	IDGD	
CCN(CC)C[C@H](C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2	1801283160	XRSVEDJLRZOXLH-LGXVYYPLSA-N	444.580	1.737	50	20	IDGD	
O=C1CC[C@H](C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](Br)Cc2ccccc2)N1	1801568204	UOYLMKSIMLFESC-FLXSYLCISA-N	448.361	1.909	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CCC(=O)NN(C)C)c1	1802332354	BFKYKVNBLQADAU-REPLKXPHSA-N	430.549	1.693	50	20	IDGD	
Cc1nc2ccc(F)cn2c1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCC(=O)NN(C)C	1802338565	ONYZALAUTXYNON-BJWYYQGGSA-N	444.511	1.407	50	20	IDGD	
C=CCNC(=O)/C=C\C(=O)NC[C@@H]1CCN(C(=O)[C@@H](Cl)COC)[C@@H]1c1cccnc1	1802499255	ROTJBJHJCXUSJW-IBUODOPDSA-N	434.924	1.200	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cc3cccnn3c2)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803148855	XXXLMVCROIGMQS-ZYSHUDEJSA-N	427.892	1.649	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC2(CCCN(C(=O)C3=NN(C)C(=O)CC3)C2)CC1	1806629461	XTIKQVQYDQBMKO-CQSZACIVSA-N	441.370	1.999	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)C2CCCCC2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807362435	GZJSRWHCRVDWOY-UNMCSNQZSA-N	435.333	1.661	50	20	IDGD	
CCOC(=O)C1(C(=O)NC[C@@H]2CCN(C(=O)[C@H](Cl)COC)[C@H]2c2cccnc2)CC1	1812468057	MYYILLGJQHUMSB-BBWFWOEESA-N	437.924	1.685	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)Cn2ccccc2=O)[C@H]1c1cccnc1	1812865410	YBCQQMJEGFFVDN-GMBSWORKSA-N	447.333	1.733	50	20	IDGD	
Cc1cnc(C(=O)N2CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)s1	1813070587	JYRXBRVQQRASIF-QFBILLFUSA-N	444.561	1.539	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2ccsc2)[C@H]1c1cccnc1	1813070929	MKNWRWITNZAUDL-UZLBHIALSA-N	429.546	1.836	50	20	IDGD	
O=C(O)CSCC(=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@@H]1c1cccnc1	1813086213	LFFHCVMXCUXBPE-NILFDRSVSA-N	448.314	1.596	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)CSCC(=O)O)[C@@H]1c1cccnc1	1813088367	BCHAZFZDEOIVRM-ZQIUZPCESA-N	429.926	1.159	50	20	IDGD	
CN[C@H](CC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@](C)(Cl)CCl)CC2)C(=O)O	1815081596	DRGFZDNRRGXJMB-XDBGJTNISA-N	437.349	1.354	50	20	IDGD	
O=C(Cn1nnc2ccccc21)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1	1815546827	WJNQNOOAWBMLQF-HOCLYGCPSA-N	431.884	1.446	50	20	IDGD	
Cc1cnc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)cn1	1816414342	XLUBVGHJWJZICP-MRXNPFEDSA-N	428.497	1.187	50	20	IDGD	
O=C(CCBr)Nc1cc([C@H]2CCCCN2C(=O)CN2CCCC2=O)[nH]n1	1816782233	LPUAMNOHIXXXRT-CYBMUJFWSA-N	426.315	1.809	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CS(C)(=O)=O)n[nH]1	1817057441	WISQECHDYDTUJR-ABAIWWIYSA-N	425.338	1.683	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](O)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](F)Cl)n[nH]1	1818042292	XMQVCLQOUZQRLM-MPKXVKKWSA-N	433.868	1.779	50	20	IDGD	
Cc1nccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)n1	1818324810	JUBANEGTMGDJNT-INIZCTEOSA-N	428.497	1.187	50	20	IDGD	
CN1C(=O)CC[C@H]1C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](F)Br)n[nH]1	1820939397	HVRAUBGOPCLMQS-MJVIPROJSA-N	430.278	1.713	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1	1822416813	QGIDUIYYLKYYBW-YPMHNXCESA-N	443.346	1.558	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC[C@H]1c1cc(NC(=O)C(F)(F)Cl)n[nH]1	1822565311	BVRCVDLQRZHLJT-ZDUSSCGKSA-N	426.616	1.227	50	20	IDGD	
CCc1ncccc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1	1825513821	VHWABGCTHIEKDZ-HSZRJFAPSA-N	449.360	1.871	50	20	IDGD	
Cc1ncccc1C(=O)N[C@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1	1826080389	HRFBRGWSQFJWHT-ZDUSSCGKSA-N	430.534	1.445	50	20	IDGD	
O=C([C@@H]1CCCS1)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827059642	FMGSSWVHCIIDMT-PMACEKPBSA-N	430.379	1.495	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccns2)CC1	1828926006	XEQYHKXHRGYTJV-KRWDZBQOSA-N	442.545	1.689	50	20	IDGD	
Cc1ocnc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1	1829432845	OSZWRAJCIQOTNT-GOSISDBHSA-N	440.504	1.529	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2nccnc2C(N)=O)CC1	1829511365	PILVYZJYTUVLME-GJZGRUSLSA-N	437.928	1.063	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccnc(Cl)n3)C2)C1	1830365542	YMRQOLXMHVQHIN-GOSISDBHSA-N	431.320	1.465	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)/C=C/c3ccc([N+](=O)[O-])o3)CCO2)C1	1830910037	HSVWCMTVNNSIKP-LCRPYPQISA-N	441.868	1.675	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CN2CCNC2=N)CC1	1831549167	MLKAVLCJLQUASM-CVEARBPZSA-N	442.402	1.620	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCBr)C2)C1	1831644175	QGNRGTOFIKIFCN-CZUORRHYSA-N	425.751	1.635	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)CN2CCCCC2=O)CC1	1831768523	NIXPKCODESEGHN-QZTJIDSGSA-N	427.973	1.872	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc3n(n2)CCC3)CC1	1831873299	OYBHPJKDXSTNRV-FQEVSTJZSA-N	444.580	1.436	50	20	IDGD	
O=C(CNCP(=O)(O)O)N1CCC([C@H]2CCCCN2C(=O)C(Cl)Cl)CC1	1831877891	FZPFZYINKGTYCW-GFCCVEGCSA-N	430.269	1.135	50	20	IDGD	
Cc1cc(C(=O)N2CCC(N3CCC(NC(=O)[C@@H](C)CBr)CC3)CC2)n[nH]1	1833262937	BLDONYXLXASPPT-ZDUSSCGKSA-N	440.386	1.934	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@H](C)Cn3cccn3)CC2)CC1	1833890495	ZIRZGGBOKXRMLX-APWZRJJASA-N	439.988	1.345	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnc(N(C)C)o3)CCO2)C1	1833896167	QJSPWNQFGUCLPK-IFXJQAMLSA-N	428.917	1.218	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)CNC(C)(C)C)CC2)CC1	1834695409	FUKQIHIDRHYKCZ-HNNXBMFYSA-N	445.446	1.977	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)C(F)(F)C(F)F)C2)C1	1834819332	LXZRQFYLQZNDPC-CYBMUJFWSA-N	435.212	1.128	50	20	IDGD	
Cc1ccn2ncc(C(=O)NC3CCN(C4CCN(C(=O)[C@H](O)CCl)CC4)CC3)c2c1	1835035494	RYQDGRMWNOKDHD-HXUWFJFHSA-N	447.967	1.428	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccc(F)cc3)CCO2)C1	1835052102	QWKPTWKHWPDGEL-YLJYHZDGSA-N	428.888	1.078	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)Cc3cnc[nH]3)CC2)CC1	1835064554	XKGKNNJEHWHKIF-QGZVFWFLSA-N	440.386	1.697	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](N)Cc3cccnc3)CC2)CC1	1835099428	XPYILSDNQUKZFX-UXHICEINSA-N	436.000	1.540	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H](O)c3ccccc3)CCO2)C1	1835291059	BMNVOAKSRGCUHN-DBVUQKKJSA-N	445.343	1.413	50	20	IDGD	
Cc1cnc(C(=O)N2CCC(N3CCC(NC(=O)CO[Si](C)(C)C)CC3)CC2)cn1	1835833531	ORBZNRFWQIULOI-UHFFFAOYSA-N	433.629	1.822	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cn4cccnc4n3)CCO2)C1	1836882357	ALXMPCRPDSMYLD-HXUWFJFHSA-N	435.912	1.064	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)CBr)C3)C2)ccn1	1837934808	NLGSGPRPGLGYJD-AUUYWEPGSA-N	440.338	1.491	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(CC)nn3C)CCO2)C1	1838038922	LKGWDIJIFSBPFR-UZLBHIALSA-N	426.945	1.460	50	20	IDGD	
Cc1cnoc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)CBr)C2)C1	1838389305	BUAYBOSFIFDRHU-SJCJKPOMSA-N	430.299	1.084	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C=C/C(=O)c3cccs3)C2)C1	1839144475	AWPCVCSSPRWMBH-XOUUHQBZSA-N	440.949	1.961	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3nnc(-c4ccccc4)o3)C2)C1	1839146235	WVERXWSYUABJNF-KKSFZXQISA-N	448.907	1.824	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cn(C)c4ncccc34)C2)C1	1839146239	WVXASCTUFLUTAF-LAUBAEHRSA-N	434.924	1.661	50	20	IDGD	
CC(C)Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)cc1	1839404012	ZTMHJAPUZXTDHG-UGKGYDQZSA-N	438.952	1.555	50	20	IDGD	
O=C(c1ccc2occc2c1O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1839564366	INRKIKJUAOQHIB-APWZRJJASA-N	426.828	1.743	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3noc(C)c3C)C2)C1	1839962638	MJLSVRZDMLOFBI-KDOFPFPSSA-N	444.326	1.535	50	20	IDGD	
Cc1nc(C)c(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)o1	1840033874	SZOXIZODCALJEQ-PIGZYNQJSA-N	430.299	1.145	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)COc3ccccc3C#N)CCO2)C1	1840820366	LXGHKIQPLDXUNS-UWJYYQICSA-N	435.908	1.411	50	20	IDGD	
NCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)CCCCCCCCBr)CCO2	1840937111	UPHDIGMZAGOHCA-IBGZPJMESA-N	448.402	1.527	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2cccnc2Cl)C1	1840968332	HJLRUFVSVNVBLA-ZMOGYAJESA-N	428.880	1.686	50	20	IDGD	
O=C(CCc1nc(-c2ccc(F)cc2)no1)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1	1841350052	FISYTSHNAZFLJK-OAHLLOKOSA-N	436.871	1.611	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCCC12CN(C(=O)c1cncc(O)c1)C2	1841925356	NRMBCRFBLDXDQJ-HNNXBMFYSA-N	438.912	1.736	50	20	IDGD	
CC1(C)Cc2cccc(C(=O)N3CC4(CCCN4C(=O)c4ccc(B(O)O)cc4)C3)c2O1	1843011168	YNTSTXPKFRGWJI-UHFFFAOYSA-N	434.301	1.211	50	20	IDGD	
COc1cc(F)ccc1C(=O)N1CC2(CCCN2C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C1	1843417221	KBDYENRXJVOOAX-AFUMVMLFSA-N	441.463	1.785	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)[C@@H]1CCc3ccccc3C1)C2	1844265343	STGQTORPCVGLQJ-GOSISDBHSA-N	433.512	1.307	50	20	IDGD	
CCn1ccc(C(=O)N2CC3(CCCN3C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)n1	1844692153	NOKOVFHZZUPBAE-UHFFFAOYSA-N	441.444	1.867	50	20	IDGD	
COc1cc(C(=O)N2CCCC23CN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C3)ccc1O	1844945132	DZDNJOFOPODRGE-ZVHZXABRSA-N	439.472	1.352	50	20	IDGD	
CN(C)C(=O)c1cccc(C(=O)N2CC3(CCCN3C(=O)[C@@H](F)Br)C2)c1	1845220570	AAJXGLDNQBFUAL-CQSZACIVSA-N	426.286	1.896	50	20	IDGD	
O=C(c1cc(Br)cc2cn[nH]c12)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl	1847564098	STCSJJODJGLBRF-MELADBBJSA-N	441.713	1.741	50	20	IDGD	
C[S@](=O)Cc1cccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1	11771818	VPOKBWNINORCNV-GDLZYMKVSA-N	449.554	1.424	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)c1cnc2n(c1=O)CCS2	15762858	UPWIQCPOJDDSTO-SECBINFHSA-N	439.291	1.340	50	20	IDGD	
C[C@@H]1Cc2cc(C(=O)NNC(=O)c3ccc4c(c3)OCCO4)ccc2N1S(C)(=O)=O	21904173	BODBNJMXZYWYLL-GFCCVEGCSA-N	431.470	1.243	50	20	IDGD	
COc1ccc(C)cc1CC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	28195608	YXYNUYFUYFBKPX-UHFFFAOYSA-N	447.513	1.028	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc(F)cc1)NNC(=O)c1cc(-c2ccccc2)on1	28793068	RTMACRLBWQZYQT-UHFFFAOYSA-N	432.433	1.610	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)CCNC(=O)c2ccc([N+](=O)[O-])cc2)cc1	28803190	KSJVUZJJLKCZSJ-UHFFFAOYSA-N	428.401	1.028	50	20	IDGD	
COc1ccc(/C=C(\C#N)C(=O)OCC(=O)NCCc2ccc(S(N)(=O)=O)cc2)cc1	36784371	JGGWYNPPMYVEPH-SFQUDFHCSA-N	443.481	1.152	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCCO[C@H]1CCCC[C@H]1C	117322266	QBFRMVDIENRNKG-HIFRSBDPSA-N	425.555	1.827	50	20	IDGD	
C[C@@H]1CCC[C@@H](C)N1C(=O)COc1ccc(C(=O)NNC(=O)CN2CCCC2=O)cc1	726088270	VZZHWSXRHAXRPM-HZPDHXFCSA-N	430.505	1.238	50	20	IDGD	
CC(C)NC(=O)CNC(=S)NNC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1	727270709	LLIYFYJAOKJQGL-UHFFFAOYSA-N	437.529	1.568	50	20	IDGD	
C#Cc1cccc(NC(=S)NNC(=O)[C@@H]2CS[C@H](Cc3ccccc3F)C(=O)N2)c1	727499686	LAPULZZQLMSYGM-ZWKOTPCHSA-N	442.541	1.968	50	20	IDGD	
O=C(C[C@@H](c1ccccc1)N1CCOC1=O)NNC(=O)c1csc(N2CCOCC2)n1	728264143	AAXWSKAYPZNZJS-INIZCTEOSA-N	445.501	1.324	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN1C(=O)OCC(F)(F)F)C1CCN(c2ncccn2)CC1	728844733	AWLXORNPGFMROV-ZDUSSCGKSA-N	444.414	1.004	50	20	IDGD	
CC(C)NC(=O)Nc1cccc(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1	728890406	PPSNHOGZLPBPSE-UHFFFAOYSA-N	425.493	1.684	50	20	IDGD	
CC[C@H](C)NC(=O)CN1CCN(C(=O)NNC(=O)c2c(Cl)cccc2Cl)CC1	728954075	KOQWQTBVZQESQZ-LBPRGKRZSA-N	430.336	1.880	50	20	IDGD	
C[C@@H]1Cc2cc(C(=O)NNC(=O)Cn3ccc4ccccc43)ccc2N1S(C)(=O)=O	729450052	KPBBYRQYNOAYMQ-CQSZACIVSA-N	426.498	1.813	50	20	IDGD	
C[C@]1(c2ccc(CNC(=O)NNC(=O)Cn3ccc4ccccc43)cc2)NC(=O)NC1=O	729612030	UMYUBEGDCNANQD-JOCHJYFZSA-N	434.456	1.227	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(S(=O)(=O)NNC(=O)C(C)(C)c2ccccc2)c1	731180063	OVHMCZLLXURHDR-UHFFFAOYSA-N	425.532	1.224	50	20	IDGD	
Cc1c(C(=O)NNC(=O)CNC(=O)c2ccco2)nnn1-c1ccc(OC(C)C)cc1	731331764	WYTVNZAGSQCPEU-UHFFFAOYSA-N	426.433	1.147	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)N1CCN(S(=O)(=O)c2ccc(Cl)c(Cl)c2)CC1	731848683	KVOLSWAOWCQPHA-LLVKDONJSA-N	437.349	1.246	50	20	IDGD	
Cc1c(C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cnn1-c1ccc(F)cc1	732324039	VQIYTTAOEQTJKQ-UHFFFAOYSA-N	441.375	1.846	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)NCCCC(=O)N2CCc3ccccc32)cc1C	732476045	XBFQCLNYEMYGJS-UHFFFAOYSA-N	437.500	1.942	50	20	IDGD	
CCCCNC(=O)NNS(=O)(=O)c1cc(S(=O)(=O)N2CCCCC2)ccc1C	733249244	GNIVBVZMVZHGKH-UHFFFAOYSA-N	432.568	1.462	50	20	IDGD	
CC(=O)Nc1ccc(NS(C)(=O)=O)c(C(=O)NNc2nc3ccccc3c(=O)n2C)c1	733261608	GZJXQXQGJKWISM-UHFFFAOYSA-N	444.473	1.020	50	20	IDGD	
CC(C)c1cc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)on1	734071958	MVIMIRZULOQPDC-UHFFFAOYSA-N	435.506	1.727	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)Cc1cc(Cl)c2c(c1)OCCO2	734239595	GAMWPXULNULCGQ-UHFFFAOYSA-N	428.873	1.509	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)CCCc1nc(O)c2ccccc2n1	734241924	XATYKNOEICGBLY-UHFFFAOYSA-N	432.481	1.513	50	20	IDGD	
COCCOc1ccc(-n2nc(C)c(C(=O)NNC(=O)c3ccc(Cl)nc3)n2)cc1	735036803	CNALOAPWOBDWDZ-UHFFFAOYSA-N	430.852	1.724	50	20	IDGD	
CC(C)COc1cccc(C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)c1	735117637	ZUKGFNHJFVOMKG-UHFFFAOYSA-N	447.561	1.809	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)NCc2cc(F)ccc2N2CCOCC2)cc1	741092563	GMSADCPPRJGXOA-UHFFFAOYSA-N	427.436	1.443	50	20	IDGD	
O=C(COC(=O)c1cccc(CN2CCOCC2)c1)NNC(=O)c1cccc([N+](=O)[O-])c1	741333268	FAQJMXBTXMOAKL-UHFFFAOYSA-N	442.428	1.045	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)c2cn(Cc3ccccn3)nn2)c2ccccc2c1=O	742475147	WVUORTQIQAAUPM-UHFFFAOYSA-N	432.444	1.087	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1=O	743588542	BJLZDCDJVVCUJU-INIZCTEOSA-N	433.415	1.752	50	20	IDGD	
CC(C)(C)C(=O)NNC(=O)CN1CCC[C@H](C(=O)Nc2ccc(Br)cn2)C1	744389747	YSSAPYUWZUOMRV-LBPRGKRZSA-N	440.342	1.688	50	20	IDGD	
O=C(CN1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1)NNC(=O)c1ccc([N+](=O)[O-])cc1	744421383	FHJKPYCMNFQIKL-UHFFFAOYSA-N	443.416	1.807	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2ccccc2)cc1	744453865	OGKVZBXJRBLGPX-IBGZPJMESA-N	434.452	1.557	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)[C@@H](c1ccccc1)n1cccn1	744621340	QFTROFLDQUBYMS-HXUWFJFHSA-N	441.513	1.637	50	20	IDGD	
Cc1nn(C)c(C)c1C[C@H](C)C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	744621445	SBEJSXQSZYSZLR-AWEZNQCLSA-N	435.550	1.380	50	20	IDGD	
Cc1ccc(NC(=O)[C@H]2CCCN(CC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)C2)nc1	746456946	GEQLOAYHTMKJHQ-INIZCTEOSA-N	440.460	1.410	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)C1(NS(=O)(=O)c2cccc(F)c2)CCCCC1	747324613	FDTRTTDDTBHJRP-UHFFFAOYSA-N	434.493	1.592	50	20	IDGD	
CN(Cc1nc(C(F)(F)F)cs1)C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	747490314	ISEQLVCHXWAOAT-UHFFFAOYSA-N	426.384	1.624	50	20	IDGD	
O=C(NCCNS(=O)(=O)Cc1ccccc1)NNC(=O)c1ccc(Cl)cc1F	747578355	CXHIIYBZRMBJRP-UHFFFAOYSA-N	428.873	1.543	50	20	IDGD	
CC(C)CS(=O)(=O)CC(=O)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1	747778045	AKPVVNHZJRVTAR-NRFANRHFSA-N	443.569	1.832	50	20	IDGD	
COc1ccc(-c2nn(CCC#N)cc2/C=C(\C#N)C(=O)N[C@@H](C)CC(N)=O)cc1OC	748715996	JCNFPSCBUUBOND-KNGSKEOJSA-N	436.472	1.768	50	20	IDGD	
C[C@@H](c1ccncc1)N1CCC(NC(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)CC1	749235368	AFINZHFKOBAVTE-ZDUSSCGKSA-N	428.449	1.865	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)[C@@H]2CCCN2S(=O)(=O)c2cccs2)c1O	749267261	SOAPDKRRJWEJIU-LBPRGKRZSA-N	425.488	1.077	50	20	IDGD	
COc1cc2ncn(CCCC(=O)NNC(=S)N[C@@H](C)C3CC3)c(=O)c2cc1OC	751620954	MNYVOGLRNFUPRU-LBPRGKRZSA-N	433.534	1.488	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)NC[C@H]3CCC[C@@]34NC(=O)N(C)C4=O)cc2C1	752000095	PWIIVWGVBMQRAP-JNHSQIPHSA-N	433.534	1.537	50	20	IDGD	
COc1cc(OC)cc(N2C[C@H](C(=O)NNC(=O)c3ccc4c(c3)OCO4)CC2=O)c1	752400874	WKDZDTJRRSDQMS-CYBMUJFWSA-N	427.413	1.247	50	20	IDGD	
COc1cc(OC)cc(N2C[C@@H](C(=O)NNC(=O)NCCc3cccs3)CC2=O)c1	752517705	WYLMCADCKKUHHX-ZDUSSCGKSA-N	432.502	1.691	50	20	IDGD	
COc1cc(C(=O)NNC(=S)Nc2ccc(N(C)C)cc2)sc1S(N)(=O)=O	754203584	GBFVESBRJLWDQR-UHFFFAOYSA-N	429.549	1.102	50	20	IDGD	
N#C/C(=C\c1ccc(O)cc1)C(=O)OCC(=O)NCc1ccccc1CN1CCOCC1	754539075	WIVNKGDDVJBKAT-FYJGNVAPSA-N	435.480	1.991	50	20	IDGD	
C[C@H](C(=O)NNC(=O)c1csc(N2CCOCC2)n1)[C@@H](C)NC(=O)OC(C)(C)C	755327044	UGVXRGYEFVSFCB-NWDGAFQWSA-N	427.527	1.290	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)Nc1ccc(CN2C(=O)CCC2=O)cc1	755660547	ARXTWSRWUKSBEF-UHFFFAOYSA-N	441.400	1.476	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(C(=O)CCC(=O)NNc3cc(C)ccn3)CC2)cc1	755846108	SKHJGKMJOKGMME-UHFFFAOYSA-N	445.545	1.455	50	20	IDGD	
COC(=O)c1ccc(OC(C)C)c(NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c1	756260908	YODYJHZNZMOAQN-UHFFFAOYSA-N	439.432	1.703	50	20	IDGD	
COCCn1ccc(NC(=O)NNC(=O)[C@@H](C)Oc2cccc(Br)c2)n1	756311431	PUNFVWXUQOHNFL-LLVKDONJSA-N	426.271	1.912	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)Nc1ccc(C(=O)NCC(=O)N(C)C)c(Cl)c1	757724364	FJAPPPPMGSUGCW-UHFFFAOYSA-N	447.879	1.633	50	20	IDGD	
COCCS(=O)(=O)c1ccc(CNC(=O)NNC(=O)Cc2ccccc2OC)cc1	759262955	ZZWNURPHEUZMIR-UHFFFAOYSA-N	435.502	1.188	50	20	IDGD	
COc1ccc(Br)c(NC(=O)C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c1	763445522	JGHBTIQFUSTNKU-UHFFFAOYSA-N	437.206	1.766	50	20	IDGD	
CN(C)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1Cl	763468654	PSHYQGBRJIEDNL-UHFFFAOYSA-N	433.808	1.350	50	20	IDGD	
O=C1C[C@H](c2cccc(NC(=O)C(=O)NNC(=O)c3ccccc3Br)c2)CN1	763484386	ZDMKJLYZRNIRBX-LBPRGKRZSA-N	445.273	1.452	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)c2ccccc2O)sc2c1CCSC2	763529786	NGFQMGNSACBQCF-UHFFFAOYSA-N	449.510	1.819	50	20	IDGD	
O=C(NNC(=O)c1c[nH]c2ccccc12)C(=O)Nc1ccc(N2CCCS2(=O)=O)cc1	763534887	LCILLBAPJQRBMW-UHFFFAOYSA-N	441.469	1.108	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(F)ccc2OC(F)F)cc1OC	763551583	QJBBUUXDGZWASN-UHFFFAOYSA-N	427.335	1.844	50	20	IDGD	
CNC(=O)c1cc(NC(=O)C(=O)NNC(=O)COc2cc(C)cc(C)c2)ccc1Cl	763646019	AHAWANIYIATZRZ-UHFFFAOYSA-N	432.864	1.481	50	20	IDGD	
CC1CCN(c2ccc(NC(=O)C(=O)NNC(=O)COc3ccc(C#N)cc3)cc2)CC1	763680257	DYAGCPZDVWNOCW-UHFFFAOYSA-N	435.484	1.959	50	20	IDGD	
COC(=O)[C@H](C)Cc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)cc1	763695796	XJGUHFBZLCWYGL-CYBMUJFWSA-N	447.875	1.857	50	20	IDGD	
CCNC(=O)c1ccc(C)c(NC(=O)C(=O)NNC(=O)c2cc(OC)cc(OC)c2)c1	763772110	MNYHXFANPDZRMW-UHFFFAOYSA-N	428.445	1.162	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccc(C(=O)N2CCCCC2)c1	763809665	YXTLODWYWUXGNV-UHFFFAOYSA-N	449.467	1.349	50	20	IDGD	
CCS(=O)(=O)c1cc(F)ccc1NC(=O)C(=O)NNC(=O)COc1ccc(C)cc1	763809864	RZLDVAHEDNXCEL-UHFFFAOYSA-N	437.449	1.093	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccnc(OCC(F)(F)F)c1	763838295	SEVPBHVLTYIPMY-UHFFFAOYSA-N	430.314	1.327	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1csc(-c2ccccn2)n1	763872698	OHYAVOPLKQMUQN-NSHDSACASA-N	429.433	1.898	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)C(=O)Nc2cccc([C@H]3CNC(=O)C3)c2)cc1	763897819	GOJPCAYZNIYPDP-OAHLLOKOSA-N	426.498	1.477	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(NC(=O)C3CC3)cc2)cc1OC	763902835	YILQHBGMAUYVJT-UHFFFAOYSA-N	440.456	1.842	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)C(=O)Nc1ccc(CCC(F)(F)F)cc1	763921291	LKQLAKDHKHAMNS-UHFFFAOYSA-N	447.377	1.557	50	20	IDGD	
O=C(Cc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1ccc(CN2C(=O)CCC2=O)cc1	763936660	NSBVKDVKVATVFR-UHFFFAOYSA-N	442.859	1.318	50	20	IDGD	
O=C(NNC(=O)c1cc(Cl)ccc1O)C(=O)Nc1ccc2nc3n(c(=O)c2c1)CCC3	763977944	BMFVPNCHFHCRQW-UHFFFAOYSA-N	441.831	1.101	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)cccc1N1CCOC1=O	764003480	DSHMGQVAOGNTGU-UHFFFAOYSA-N	440.412	1.123	50	20	IDGD	
O=C(Cc1ccsc1)NNC(=O)C(=O)Nc1ccc(C(=O)NCC(F)(F)F)cc1	764034263	MIKCMFDVLDTWTH-UHFFFAOYSA-N	428.392	1.369	50	20	IDGD	
COc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NNC(=O)c1ccc2ccccc2c1	764067849	ZIUCQXXSIFLVNQ-UHFFFAOYSA-N	434.452	1.950	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1Cl	764268151	XWKXRPSOBZZZAM-UHFFFAOYSA-N	432.868	1.141	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1ccccc1OC[C@@H]1CCCCO1	764279864	GNJUYRBSPOVJFA-HNNXBMFYSA-N	443.456	1.505	50	20	IDGD	
CCN1CCN(c2ccc(NC(=O)C(=O)NNC(=O)c3ccc(O)c(Cl)c3)cc2)CC1	764350075	WDQYGSNRKUHCBJ-UHFFFAOYSA-N	445.907	1.587	50	20	IDGD	
NC(=O)CCSc1ccccc1NC(=O)C(=O)NNC(=O)c1ccc(Cl)cc1F	764410982	YGTCFMLHZCHZPQ-UHFFFAOYSA-N	438.868	1.846	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)C(=O)Nc2cc(-c3nc(C)co3)ccc2C)c1	764433226	MQLLOPFTUGQQFX-UHFFFAOYSA-N	436.428	1.712	50	20	IDGD	
Cc1ccccc1S(=O)(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	765118369	BRZMPIASLZSLIX-UHFFFAOYSA-N	436.965	1.776	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)NCc2cccc(N3CCCS3(=O)=O)c2)cc1	765303660	OTRTWGHKHXZCLB-UHFFFAOYSA-N	446.533	1.828	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)CCNC(=O)c3cccs3)n[nH]2)cc1OC	765597531	IRENWIFEPFWEEZ-UHFFFAOYSA-N	443.485	1.737	50	20	IDGD	
Cc1oc(C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)cc1S(=O)(=O)N(C)C	765618971	IYQUMCHJIOOKPJ-UHFFFAOYSA-N	435.437	1.442	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)c2ccccc2OC)cc1F	765647981	LHWACCBDBGKTQO-UHFFFAOYSA-N	431.467	1.219	50	20	IDGD	
COc1ccc(Cl)cc1S(=O)(=O)N1CCN(C(=O)NNC(=O)C(C)(C)C)CC1	765767962	NALZHXPHWFVPQO-UHFFFAOYSA-N	432.930	1.442	50	20	IDGD	
CC(C)[C@H](C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1)N1CCCCC1	766636540	PQYDTLXPYVDEJX-OAQYLSRUSA-N	429.565	1.102	50	20	IDGD	
Cc1n[nH]c(C)c1CCC(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	766659903	IKINRVQCDHUXHZ-UHFFFAOYSA-N	432.956	1.578	50	20	IDGD	
Cc1cn2c(C=NNC(=O)c3cccc(S(=O)(=O)N4CCOCC4)c3)c(C)nc2s1	767027558	DGLCCHVBHVIASD-UHFFFAOYSA-N	447.542	1.797	50	20	IDGD	
O=C(Nc1ccccc1S[C@H](Cl)C(F)(F)F)C(=O)N1CCN(C(=O)CO)CC1	768111181	CQZAWKGIYGYGTK-HNNXBMFYSA-N	439.843	1.508	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CSc2nc3cc(S(=O)(=O)N(C)C)ccc3o2)c1	768193438	TVQUPJWXVMABJY-UHFFFAOYSA-N	448.526	1.940	50	20	IDGD	
CC(C)(C)[C@H](Br)C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	768210258	VGNBMSXJDOGZND-CQSZACIVSA-N	434.356	1.960	50	20	IDGD	
COCCOCCS(=O)(=O)NC(=O)/C(C#N)=C\c1cc(C)n(C[C@@H]2CCCO2)c1C	768220443	RAYSFMSRQQUWMY-OVCORXIESA-N	439.534	1.300	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(F)cc2C(=O)N(C)C)c1C	768237523	MBSYGEQKXNZTIN-CQSZACIVSA-N	444.463	1.698	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NCC(=O)NNc2ccc([N+](=O)[O-])cc2)c1	768247678	UWMSBHRVMZKNHQ-UHFFFAOYSA-N	449.489	1.498	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)C[C@@H](C)NC(=O)C3CCCC3)n[nH]2)cc1OC	768277215	QGZOUNKDLWOZDT-CYBMUJFWSA-N	443.504	1.940	50	20	IDGD	
CCN1CCC[C@@H]1CN1C[C@H](C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)CC1=O	768279282	MBNUGRCJNNGIGH-NVXWUHKLSA-N	442.495	1.310	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)Sc1nnc(-c2cc(-c3ccc(F)cc3)[nH]n2)n1N	768420542	OMHDIPCVYVZXQN-LLVKDONJSA-N	446.512	1.862	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(C)=O	768634718	ODWGBUBOVIIDAU-QGZVFWFLSA-N	444.513	1.771	50	20	IDGD	
Cn1c(NNC(=O)CN2C(=O)N[C@@]3(CCCC(C)(C)C3)C2=O)nc2ccccc2c1=O	769089338	HRKPEXOMAYPLFJ-OAQYLSRUSA-N	426.477	1.267	50	20	IDGD	
CS(=O)(=O)CCn1cccc(NC(=O)NNc2ccc(OC(F)(F)F)cc2)c1=O	770080431	RGTKTMIMDKRSIE-UHFFFAOYSA-N	434.396	1.940	50	20	IDGD	
C[C@H](NC(=O)NNc1nc(O)c2cnn(C)c2n1)c1cc(F)ccc1N1CCN(C)CC1	770373699	UQBPYCVYPIDRKX-LBPRGKRZSA-N	443.487	1.347	50	20	IDGD	
C[C@H](NS(=O)(=O)c1cccc(C(F)(F)F)c1)C(=O)NNC(=O)Cc1ccncc1	771006851	WGOORARLSYGQCL-NSHDSACASA-N	430.408	1.157	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)[C@@H]1CCCN1C(=O)c1ccc2c(c1)OCO2	772066629	ZLOMKYHPEPHHEI-HIFRSBDPSA-N	433.461	1.145	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)[C@H]1CCCC[C@@H]1C(=O)N1CCCC1	772890096	VURVAJBRUCXACW-IRXDYDNUSA-N	434.924	1.532	50	20	IDGD	
Cc1oc2ncn(C)c(=O)c2c1C(=O)NNC(=O)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	774270999	KRCMJAHYARYJBQ-GFCCVEGCSA-N	433.465	1.243	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)NC[C@H]2CC[C@H](C(=O)N(C)C)O2)cc1OC	774773769	YUFQHPLFJZXUBD-NVXWUHKLSA-N	436.509	1.454	50	20	IDGD	
O=C(NNC(=O)c1ccn(C(F)F)n1)c1cccc(S(=O)(=O)N2CCCCC2)c1	775636534	FJZOZECPNCZJOC-UHFFFAOYSA-N	427.433	1.528	50	20	IDGD	
Cc1ccc(S(=O)(=O)C[C@H](C)NC(=O)NNC(=O)Cc2nc3ccccc3n2C)cc1	776196903	WBMSEDOWWIZRKQ-HNNXBMFYSA-N	443.529	1.617	50	20	IDGD	
O=C(NNC(=O)c1cnc(C(F)(F)F)nc1)c1ccc(S(=O)(=O)N2CCCC2)cc1	777757412	LWEPCDOUKVCMRQ-UHFFFAOYSA-N	443.407	1.355	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)NC2CCN(S(=O)(=O)CC(C)C)CC2)cc1	777765603	WPLRTJKVBUEECO-UHFFFAOYSA-N	442.607	1.868	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)/C=C\c2cc3cnn(C(C)C)c3[nH]c2=O)nc1C	778430275	QZQHHWKUFSWWBM-SREVYHEPSA-N	425.449	1.737	50	20	IDGD	
CNC(=O)[C@@H]1CN(C(=O)C(=O)NNc2ccccc2OC(F)(F)F)c2ccccc2O1	778797789	BZWYIHVUCNDDHS-HNNXBMFYSA-N	438.362	1.569	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)C(=O)Nc1cc(Cl)ccc1Cl	782896477	IYYIRSZFNQBSOK-UHFFFAOYSA-N	444.300	1.686	50	20	IDGD	
Cc1cc2cc[nH]c2cc1NC(=O)C(=O)NNC(=O)c1csc(N2CCOCC2)n1	782897031	LOFOEZXOWNOBPB-UHFFFAOYSA-N	428.474	1.169	50	20	IDGD	
CCOC(=O)[C@@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNc2ccc(OC)cc2)cc1	783035904	IKYPHOXNMRGJJX-CYBMUJFWSA-N	428.445	1.458	50	20	IDGD	
COC(=O)c1ccsc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	784215948	JXSONTGUEQSMPY-UHFFFAOYSA-N	438.487	1.057	50	20	IDGD	
COC(=O)[C@H]1CN(C(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2O1	784380096	MMRFQAWXJDPWMS-OAHLLOKOSA-N	434.792	1.659	50	20	IDGD	
CNS(=O)(=O)c1ccc(C)c(NC(=O)C(=O)NNc2ccc(OC(F)(F)F)cc2)c1	784803855	OGOVIGWJVBPKPJ-UHFFFAOYSA-N	446.407	1.884	50	20	IDGD	
CN(C)CCn1c(=O)oc2ccc(NC(=O)C(=O)NNc3cccc([N+](=O)[O-])c3)cc21	784833511	MLYMMVAQKYNICM-UHFFFAOYSA-N	428.405	1.146	50	20	IDGD	
COCCn1nc(C)c(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)c1C	784835893	YWOTUHKBGPTUGQ-UHFFFAOYSA-N	445.448	1.224	50	20	IDGD	
O=C(NNc1ccc(C(F)(F)F)nn1)C(=O)Nc1cccc(-c2nnnn2C2CC2)c1	784891402	NSURXRFRHXQRRC-UHFFFAOYSA-N	433.354	1.566	50	20	IDGD	
Cc1cc2ccccc2nc1NNC(=O)C(=O)Nc1ccc(C[C@H]2CC(=O)NC2=O)cc1	785165028	NKSXKCSSWLLPFI-INIZCTEOSA-N	431.452	1.830	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2c(C)cccc2C(=O)N2CCCC2)n1	785227386	PTARCYPJIHBYAW-UHFFFAOYSA-N	439.520	1.949	50	20	IDGD	
COCc1nc(Cl)cc(NNC(=O)CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])n1	788141723	FVPKWSHBMRKNLZ-UHFFFAOYSA-N	429.220	1.711	50	20	IDGD	
Cc1cccc(-c2nnc(S)n2CCC(=O)NNc2ccccc2S(N)(=O)=O)c1	788223783	NFWTVISLZBFONB-UHFFFAOYSA-N	432.531	1.723	50	20	IDGD	
CC1=C(C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)[C@H](C)n2ncnc2N1C	788263404	ZJGZPRRVLSOJOR-ZDUSSCGKSA-N	436.476	1.315	50	20	IDGD	
C[C@@H]1C[C@@H](C)CC2(C1)NC(=O)N(CC(=O)NNc1nnc(-c3ccccn3)s1)C2=O	788557993	DQPPIULRNRBZQI-VXGBXAGGSA-N	429.506	1.790	50	20	IDGD	
CCNC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)c1C	789734774	HAWRFTVWHOCIEX-UHFFFAOYSA-N	436.472	1.877	50	20	IDGD	
CC(C)(C)OC(=O)CCc1cccc(NC(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)c1	791910810	UAIMGGUCPHFEQQ-AWEZNQCLSA-N	425.507	1.548	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)CCc2cnc3ccccc3c2)cc1	792017638	LOAMFCHMINKQEC-UHFFFAOYSA-N	440.525	1.944	50	20	IDGD	
COc1ccc([C@@H]2C[C@H]2NC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)cc1	792773481	TUEQFIOWIZLMMP-JKSUJKDBSA-N	431.518	1.797	50	20	IDGD	
COCCOC1CCC(C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)CC1	792806676	UMUJGEHAMUPHPS-UHFFFAOYSA-N	430.505	1.960	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)Cc1ccc(S(=O)(=O)N(C)C)cc1	792893629	HZIFGOLNHJVLHS-UHFFFAOYSA-N	425.894	1.603	50	20	IDGD	
COc1nccnc1C=NNC(=O)c1cc(S(=O)(=O)NCc2ccccc2)ccc1O	792961025	XASJKLXVYAAZSE-UHFFFAOYSA-N	441.469	1.433	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(CC(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)cc1	793748423	HOSYAACCZXAROV-UHFFFAOYSA-N	445.476	1.470	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C2CCN(S(=O)(=O)c3ccc(C)c(C)c3)CC2)n1	794079960	FINGRBCIMLKWHM-UHFFFAOYSA-N	430.530	1.869	50	20	IDGD	
CCS(=O)(=O)c1cccc(CC(=O)NNc2ccccc2S(=O)(=O)N(C)C)c1	795169461	QDMDWLHMEFNFPJ-UHFFFAOYSA-N	425.532	1.416	50	20	IDGD	
CC(C)S(=O)(=O)c1ccc(CC(=O)NNc2ccccc2S(=O)(=O)N(C)C)cc1	795177613	OCKYPKPCUDCJHI-UHFFFAOYSA-N	439.559	1.805	50	20	IDGD	
O=C(NNC(=O)c1ccc(C(F)(F)F)cc1N1CCCC1)N[C@@H]1CCS(=O)(=O)C1	795528838	YSBVJNLZGQRUIJ-GFCCVEGCSA-N	434.440	1.437	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNS(=O)(=O)c1c(Cl)cc(F)cc1Cl	797817854	FMJSAMLRASDRTA-UHFFFAOYSA-N	426.278	1.934	50	20	IDGD	
O=C(NNC(=O)c1ccccc1Br)C(=O)Nc1ccc(N2CCC2=O)cc1	799257266	HIJXHKDUBPKKHQ-UHFFFAOYSA-N	431.246	1.586	50	20	IDGD	
CSC[C@H](C)C(=O)N1CCC(C(=O)OCC(=O)NNC(=O)c2ccc(C)cc2)CC1	799542857	QJYQFSNYQGDMIP-HNNXBMFYSA-N	435.546	1.537	50	20	IDGD	
Cn1c(=O)n(C)c2cc(N3CCCCC3)c(NC(=O)C(=O)NNC(=O)CC(C)(C)C)cc21	800623287	KPUYBHROYXIVKK-UHFFFAOYSA-N	444.536	1.389	50	20	IDGD	
O=C1CCC(=O)N(c2ccc(C(=O)NNC(=O)Nc3ccc(OC(F)F)cc3)cc2)N1	802044616	XOINIXZNZPZBAM-UHFFFAOYSA-N	433.371	1.913	50	20	IDGD	
CN(C)C(=O)COc1ccccc1C(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	802067929	RLUJTNLMNWFWKX-UHFFFAOYSA-N	434.474	1.024	50	20	IDGD	
C[C@@H](CC(=O)NNc1ccc2c(=O)[nH]ccc2c1)/N=C1/NS(=O)(=O)c2ccccc21	803428939	JDTLXLGGMAENIH-LBPRGKRZSA-N	425.470	1.489	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCC2(S(C)(=O)=O)CCCC2)cc(OC)c1OC	804865517	JQIGILGLLHATMH-UHFFFAOYSA-N	429.495	1.014	50	20	IDGD	
CN(C)S(=O)(=O)C[C@@H](NC(=O)NNC(=O)c1ccc2ccccc2c1)C(F)(F)F	804926026	UGFYQZUIDPZDJI-CQSZACIVSA-N	432.424	1.606	50	20	IDGD	
CN(CCc1ccccc1[N+](=O)[O-])C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	805069478	XPDWZDNCMWBRCF-UHFFFAOYSA-N	427.465	1.517	50	20	IDGD	
COC(=O)c1cc(C)c(NC(=O)C(=O)NNC(=O)COc2cccc(C)c2)c(Cl)c1	806973546	QUVGSCDENZHPON-UHFFFAOYSA-N	433.848	1.908	50	20	IDGD	
CCC(C)(C)[C@@H]1CCc2nc(NC(=O)C(=O)NN[C@@]3(C)CCS(=O)(=O)C3)sc2C1	807001173	RTALZCIMVLHHJF-BLVKFPJESA-N	442.607	1.821	50	20	IDGD	
CN1CCN(C(=O)NNC(=O)c2ccn(-c3c(Cl)cc([N+](=O)[O-])cc3Cl)n2)CC1	807380296	FSKSZSWSCOQOJV-UHFFFAOYSA-N	442.263	1.689	50	20	IDGD	
Cc1nc2c3cccnc3nn2c(C)c1CCC(=O)N([C@@H]1CCS(=O)(=O)C1)N(C)C	808024908	VEGFUAADHRWESQ-OAHLLOKOSA-N	430.534	1.319	50	20	IDGD	
COc1cc(Cl)c(NC(=O)C(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])cc1C	808934516	IYYWXQDOYKOHDC-UHFFFAOYSA-N	436.808	1.730	50	20	IDGD	
CN(NC(=O)c1ccc2c(c1)SCC(=O)N2)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	811032310	HFZHEQNBYURGFM-UHFFFAOYSA-N	449.533	1.980	50	20	IDGD	
O=C(NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12)c1cnn(CCF)c1	813367330	XWSAPOBZDWHXFC-UHFFFAOYSA-N	434.431	1.686	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)NNC(=O)CNC(=O)c2ccco2)CC12CCC2	813801776	UBWMQGHUWAZCFT-CQSZACIVSA-N	449.508	1.662	50	20	IDGD	
CCC(CC)(CNC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)OC	813873364	XNWRQSSKOKDQHD-UHFFFAOYSA-N	426.539	1.620	50	20	IDGD	
COCCOc1cc2c(cc1C=NNC(=O)Nc1ccc(S(N)(=O)=O)cc1)OCO2	814964402	RVKJKWKCTYFFBB-UHFFFAOYSA-N	436.446	1.244	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1cnn(Cc2ccccc2)c1	815751065	QIRPIVJKWQZMOD-UHFFFAOYSA-N	442.501	1.264	50	20	IDGD	
CC(=O)Nc1c(C)ccc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)N(C)C)c1C	815751968	WSGQTZMDZNBMCT-UHFFFAOYSA-N	447.517	1.594	50	20	IDGD	
COCCNS(=O)(=O)c1c[nH]c(C(=O)NNc2ccc(OC)cc2C(F)(F)F)c1	816702644	WCEOMAKHJCXDGJ-UHFFFAOYSA-N	436.412	1.724	50	20	IDGD	
O=C(CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])NNC(=O)[C@H]1CCc2nncn2C1	816883533	FIWVFRHLJLRIPL-JTQLQIEISA-N	441.370	1.417	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)OCc2nc(C)no2)cc1	854247524	ULOPILFHPKACFY-OQLLNIDSSA-N	436.428	1.776	50	20	IDGD	
O=C(NN=Cc1ccc(-n2cncn2)c(F)c1)c1cccc(S(=O)(=O)N2CCCC2)c1	863950525	ABEUQZVDFIBLMB-UHFFFAOYSA-N	442.476	1.955	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)/C(=C\c1ccccc1)n1nnnc1C	894410464	OOOGMSRARIVZCT-CPNJWEJPSA-N	430.472	1.739	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)c1cccc(S(=O)(=O)NC2CCCC2)c1	913465154	JFSUCBJGKRUIHG-IBGZPJMESA-N	445.497	1.509	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1cc(C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)ccc1F	914601520	VASIXZSECCPKSH-UHFFFAOYSA-N	438.437	1.886	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@@H]2CC(=O)N(c3ccc(F)cc3F)C2)cc(OC)c1OC	914747921	VRGWATZEESCVNQ-GFCCVEGCSA-N	449.410	1.805	50	20	IDGD	
CC(C)S(=O)(=O)c1ccccc1C(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	915464984	QCNXMSSJLXGPOL-UHFFFAOYSA-N	449.441	1.395	50	20	IDGD	
CCOC(=O)N1CCC(NC(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)CC1	915878951	YGLDDIVPQPPVAF-UHFFFAOYSA-N	444.492	1.542	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NCCN1CCN(Cc2ccccc2)CC1	915900964	AITLERIIDIEANV-SFHVURJKSA-N	443.523	1.741	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)CN3CCCC3=O)nn2-c2ccccc2)cc1	916147895	MKZKBOBMESVTEO-UHFFFAOYSA-N	433.468	1.931	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NC[C@@H]2COc3ccccc3C2)nc1	916198851	FVYBIIAEAYVSHT-OAHLLOKOSA-N	433.534	1.990	50	20	IDGD	
N#Cc1cccc(NNC(=O)NCc2ccccc2CS(=O)(=O)N2CCOCC2)c1	916229069	LVCSZWCYYYFBHE-UHFFFAOYSA-N	429.502	1.547	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCc2ccnc(-n3cccn3)c2)c2ccccc2c1=O	916394170	FFLAGZMQKQQVFI-UHFFFAOYSA-N	432.444	1.141	50	20	IDGD	
C[C@@H](Cn1cccn1)NC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	916464478	WPCAPSMBEQEHSX-ZDUSSCGKSA-N	448.530	1.778	50	20	IDGD	
CC(C)OCc1ccc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1	916535566	VGKYLGCRFOIVAO-IBGZPJMESA-N	428.441	1.756	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)NCc2ccc(OCC(=O)N(C)C)c(OC)c2)cc1	916641377	APCOFDNNCDHAIQ-UHFFFAOYSA-N	428.489	1.869	50	20	IDGD	
CCn1c(NNC(=O)Cc2c(C)nc(-c3cccnc3)nc2O)nc2ccccc2c1=O	917410260	KJNPRTLNKDMHFQ-UHFFFAOYSA-N	431.456	1.968	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)CN(C)C(=O)c2ccc(Br)o2)cc1C	917908693	RSYWLGPEJCNSQT-UHFFFAOYSA-N	438.278	1.957	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)CNC(=O)NC2CCCCC2)c2ccccc2c1=O	917914392	AGCGBGYUDAFAQV-UHFFFAOYSA-N	428.493	1.199	50	20	IDGD	
CCC(CC)C(=O)N1CCC(NC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)CC1	918016661	VHQOXBNNWUXBLZ-UHFFFAOYSA-N	442.520	1.949	50	20	IDGD	
CN(CC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)c1nc2ccccc2s1	919743303	OYPAEXGQUJXDST-UHFFFAOYSA-N	447.542	1.444	50	20	IDGD	
CCN1CCN(c2ccc(NC(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)c(C)c2)CC1	920931837	FGNJURWSNZGFAN-UHFFFAOYSA-N	449.519	1.579	50	20	IDGD	
O=C(NC[C@@H]1CCOC1)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	1317883014	KOAOSOSTJVSWIH-INIZCTEOSA-N	432.502	1.146	50	20	IDGD	
CCN1CCN(CCCCNC(=O)NNC(=O)c2ccc(Br)cc2)CC1	1319047459	OYNLGIVJJLOJTP-UHFFFAOYSA-N	426.359	1.811	50	20	IDGD	
CCO[C@@H]1C[C@@H](NC(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)[C@@]12CCCO2	1320453936	CUGSNVXDVBQRCB-ZOCZFRKYSA-N	440.541	1.691	50	20	IDGD	
C[C@H](O)CNS(=O)(=O)c1ccc(C(=O)NNC(=O)CC23CC4CC(CC(C4)C2)C3)cc1	1336954970	AJOSPFRDGRWSBF-HIGJEIRPSA-N	449.573	1.713	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc4n(n3)CCCO4)C2)C1	1778558904	WQWXPNGMAWTGLD-SCLBCKFNSA-N	441.326	1.283	50	20	IDGD	
C=CC[C@@H](C(=C)C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2	1779272004	SLFZZQJWKOUILO-YZUZCNPQSA-N	440.349	1.262	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccc3ncncc3c1)CCO2	1779296835	HKRNAUUJZSFWEB-OAQYLSRUSA-N	428.565	1.925	50	20	IDGD	
Cc1cc(C(N)=O)cc(C)c1C(=O)N1CCO[C@]2(CCN(C(=O)CO[Si](C)(C)C)C2)C1	1779297099	QWWIQYIZNHLGQZ-QFIPXVFZSA-N	447.608	1.697	50	20	IDGD	
COCc1c[nH]c(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)c1	1780073459	HNVABTAKIRWQIL-ACJLOTCBSA-N	428.327	1.636	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3nn[nH]c3C(F)(F)F)C2)C1	1780364328	KOUUWPGIZNTFOV-UONOGXRCSA-N	444.241	1.503	50	20	IDGD	
Cc1ccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2ccc(B(O)O)cc2)C3)cc1	1780456036	CXZCGNLULUGAPB-ZJSXRUAMSA-N	436.317	1.116	50	20	IDGD	
N#Cc1cc(CC(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](O)CCl)C3)ccc1F	1780754216	JJOVAWLAZXZZDJ-DBXWQHBBSA-N	437.899	1.353	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCc1cncnc1)C2)[C@H](F)Br	1780771516	JRLHYPXKQLBCMN-UWWQBHOKSA-N	443.317	1.614	50	20	IDGD	
Cn1nc2c(c1C(=O)N1CCO[C@]3(CCN(C(=O)[C@](C)(Cl)CCl)C3)C1)CCC2	1781233641	VRXMOJNJPCRCSM-RTBURBONSA-N	429.348	1.589	50	20	IDGD	
CCC1(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](C)CBr)C3)COC1	1781642998	NOPXZUXYJWAKKI-SPYBWZPUSA-N	431.371	1.958	50	20	IDGD	
CCOc1ncccc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](Cl)COC)C1	1782168155	QZXFSDVZHNXKID-CBGDNZLLSA-N	439.940	1.862	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](OC(C)=O)C(C)C)C2	1782175041	AVRANBHUBNHZPY-WOCWXWTJSA-N	432.945	1.342	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)N1CC[C@]2(CN(C(=O)[C@@H](F)Br)CCO2)C1	1782706248	HIBGOJXBHWNJFP-UEKVPHQBSA-N	425.251	1.068	50	20	IDGD	
O=C(C1CCC2(CC1)OCCO2)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1782943955	FOIRZRVOEGBQSG-WMLDXEAASA-N	449.317	1.440	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](C)n1cccc1C=O)CCO2	1783532815	NPOKAVXKNIJADF-DEYYWGMASA-N	426.311	1.475	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)Cc3ccc4ncccc4c3)CCO2)C1	1783870937	JWBNWLDSEJKFNN-AVRDEDQJSA-N	431.920	1.861	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3c[nH]c4ccc(OC)nc34)CCO2)C1	1783880585	DKUNRTKHGGPANE-VBKZILBWSA-N	436.896	1.269	50	20	IDGD	
CC(=O)Nc1ccccc1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](C)Br)CCO2	1785100827	SOADLXNBWVSWSI-ORAYPTAESA-N	438.322	1.872	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1)c1ccnc(F)c1	1786516739	BHSDUXYIOCXQDV-UHFFFAOYSA-N	433.248	1.962	50	20	IDGD	
Cn1cc(CCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Br)C[C@@H]32)cn1	1787012302	PIPZDNGCSBCYGA-YXWQFLTLSA-N	431.306	1.023	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21)c1cnc(C(F)(F)F)cn1	1787246909	NQADTBQPPGPHRG-QXEWZRGKSA-N	441.237	1.892	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1cc2ccccc2o1	1787944341	IRIKNLLXSGBGOX-JLMWRMLUSA-N	448.284	1.020	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccn4nccc4c3)[C@H]2C1	1788445416	KWKXWBKNPBDREA-IKICRFKJSA-N	449.349	1.959	50	20	IDGD	
COC(=O)C12CC(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]4C3)(C1)C2	1788763434	CXZVGYNVPFAAEG-VICSCYKQSA-N	438.597	1.161	50	20	IDGD	
CCC[C@H](NC(C)=O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]2C1	1788765897	BYNQTXCUWNUBKV-XSLAGTTESA-N	427.618	1.122	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3c(F)cncc3F)[C@H]2C1	1789005864	VYAHBNCHUCFLDF-ASHKBJFXSA-N	446.292	1.984	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]3C2)cc(O)n1	1789866596	UIPGPERLSVSSPG-XPVILTJLSA-N	430.332	1.925	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnn4ncccc34)C[C@@H]21)[C@H](F)Br	1789922620	JPSGNFPJOHLKNS-LVGORTOPSA-N	440.273	1.013	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc4nccn34)[C@H]2C1	1790411426	AJHBFSPPGYKJMQ-JKQORVJESA-N	449.349	1.959	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccn(-c4ccccc4)n3)C[C@@H]21	1791254276	RSAGVPMLBIZBNB-CAIZAGQASA-N	446.935	1.719	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)Sc3ccccn3)C[C@@H]21	1791256679	UKSHKXIXZAFFEX-XAJHFOFHSA-N	441.981	1.796	50	20	IDGD	
COc1ccsc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)CBr	1792872352	AUKKAFKLZUZKNY-NRWUCQMLSA-N	431.352	1.991	50	20	IDGD	
CC(C)(C)[C@H](O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)C2	1792919803	QHGUKGQLSCWUSY-UHVSXOQYSA-N	447.482	1.868	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(F)(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](O)CCl)C1	1793117171	DVAONOYRUCYRQS-XJFOESAGSA-N	433.908	1.183	50	20	IDGD	
COc1cccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCBr)c1C	1795117097	MRLNKEBLWIRLNY-ZSBFGKGUSA-N	425.323	1.992	50	20	IDGD	
CCC[C@H](NC(=O)c1ccccc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Cl	1796364836	NDSHIIFQNOBBQV-ADHGMGHFSA-N	439.915	1.709	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(Cl)c2nncn2c1	1798381001	WBBYTXNWAAAUHJ-XFMPKHEZSA-N	426.304	1.888	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc3c(c1)CCCO3)C2	1798443726	ZCXBQUAKEFRALV-BCDXTJNWSA-N	449.511	1.576	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@](C)(Cl)CCl	1799279227	CQFZJEHPKMCDNW-AZGFTEDZSA-N	438.352	1.337	50	20	IDGD	
C[C@@H](NC(=O)c1ccc(F)cc1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](O)CCl)C2	1799811773	QLVTXTDCPZYWAM-ZQOQDGPXSA-N	425.888	1.182	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1(N2CCN(C)CC2)CC1	1799977303	BZESIGZTVCNTLQ-YVSFHVDLSA-N	441.414	1.578	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c(F)c(C)nn1C)C2	1800638875	BTIFKUCMQZPFMY-OPDFLTKYSA-N	431.306	1.244	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc(N(C)C)o1)C2	1800639321	OSDDJNWFIRIZHH-GFQSEFKGSA-N	429.315	1.117	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCC(=O)N1CCCC1)C2	1800640445	YGPNMAYJCOTYCZ-KRXQYRFLSA-N	444.370	1.152	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3nonc3c1)C2	1800641139	OFDOVTZSZNDTIZ-ZWUHOBOKSA-N	437.294	1.600	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ncn(C(C)C)n1)C2	1800641359	ZMEIEBCIXUWNOX-XJFOESAGSA-N	428.331	1.236	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2	1800785605	HMOLUUUWZLLXGG-AIEDFZFUSA-N	433.908	1.510	50	20	IDGD	
O=C(NCCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(Cl)Cl)c1ccccc1	1801020972	AQBQNYQWLLKINB-MIFYACCESA-N	428.316	1.200	50	20	IDGD	
CC(C)(CCl)C(=O)NC[C@@H]1CCN(C(=O)COc2ccc(O)nn2)[C@@H]1c1cccnc1	1802904685	NFGKRERWMIYGJA-HNAYVOBHSA-N	447.923	1.927	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)C(F)(F)C(F)F)[C@H]1c1cccnc1	1804012371	ARIMAZVRNPGIIH-CZUORRHYSA-N	447.433	1.361	50	20	IDGD	
Cc1ccc(CCC(=O)N2CCCC3(CCN(C(=O)CCC(=O)NN(C)C)CC3)C2)cn1	1807000286	ONBFGHOTIITAAF-UHFFFAOYSA-N	443.592	1.927	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)CNCP(=O)(O)O)[C@@H]1c1cccnc1	1807024190	MHUWLHUWJCMLMP-VYDXJSESSA-N	446.872	1.220	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1807372599	GZTXGLDCIPNYPE-NZSAHSFTSA-N	429.713	1.098	50	20	IDGD	
Cc1nnc(CC(=O)NC[C@H]2CCN(C(=O)CCBr)[C@@H]2c2cccnc2)o1	1807467391	MLPOQZDEQQMIEU-RDTXWAMCSA-N	436.310	1.807	50	20	IDGD	
Cc1noc(CC(=O)NC[C@@H]2CCN(C(=O)[C@H](F)Br)[C@H]2c2cccnc2)n1	1807525501	UYBJVXRFIYSWPM-RCBQFDQVSA-N	440.273	1.712	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc[n+]([O-])c2)[C@H]1c1cccnc1)[C@H](F)Br	1808650670	BZOQRVOBQWOJBZ-BPUTZDHNSA-N	437.269	1.725	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)c1snnc1C1CC1	1808850359	KUZMSNRUNXJEFH-OFQRWUPVSA-N	435.937	1.730	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H](CNC(=O)Cn2nccn2)[C@H]1c1cccnc1	1808961855	YKVRBKCPKRRQME-KYJSFNMBSA-N	425.320	1.615	50	20	IDGD	
O=C(c1cc(F)cc(F)c1)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1	1809969807	UAXMNQCCJWAIHJ-UHFFFAOYSA-N	442.271	1.803	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2ccc(F)nc2)[C@@H]1c1cccnc1	1810700895	IYJDBKOOQRDOBY-IERDGZPVSA-N	442.495	1.308	50	20	IDGD	
COc1nc(C)ccc1C(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1	1811045008	FWCRALFRHJKWEG-RYQLBKOJSA-N	432.908	1.713	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)CN2CCOC2=O)[C@@H]1c1cccnc1	1812864951	YNVJTXLXLJCZSE-DUVNUKRYSA-N	439.310	1.323	50	20	IDGD	
Cc1nc(CC(=O)Nc2cc([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)cs1	1815893109	SPDQBZQCUGYSKI-MRXNPFEDSA-N	447.565	1.782	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)CCl)CC2)c1ncn(-c2ccccc2)n1	1817487777	ZXIBREVQEUUWQA-RISCZKNCSA-N	446.920	1.549	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)C1(F)CCC1)CC2	1819801889	VBVGBGADXWVAGQ-JTQLQIEISA-N	432.481	1.260	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN2CCNC2=N)[nH]n1	1820863463	DNTFIDAZYCZKFI-YVEFUNNKSA-N	430.340	1.478	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3cn(C(C)(C)C)nn3)sc2C1	1821638389	MVUPMRPRQPMIIR-QWRGUYRKSA-N	440.957	1.969	50	20	IDGD	
CCOC(=O)C1(C(=O)Nc2cc([C@H]3CCCCN3C(=O)[C@H](Cl)COC)[nH]n2)CC1	1821805243	GRSDQSXRLXZMFI-TZMCWYRMSA-N	426.901	1.999	50	20	IDGD	
Cc1cncc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)c1	1822412698	FGJUAGMOHXACNQ-QGZVFWFLSA-N	427.509	1.792	50	20	IDGD	
CCn1nccc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1	1822413546	ZCTSZZAEXPMQOI-OAHLLOKOSA-N	430.513	1.305	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(F)cn1C)CC2	1826086312	RJUHALIAIWOSKS-LBPRGKRZSA-N	436.513	1.220	50	20	IDGD	
COC(=O)NCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](C)CBr)CC2	1826495325	MYNMJMJLZUTSKY-IUCAKERBSA-N	433.328	1.442	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CCc2nc(N)n[nH]2)CC1	1828806515	KZCJIJKCRUFWKC-CABCVRRESA-N	426.949	1.193	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(O)nc(Cl)c3)C2)C1	1830358636	QAXFRGZMSAIYEP-IBGZPJMESA-N	446.331	1.776	50	20	IDGD	
Cc1ncsc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)CBr)CCO2	1830537805	PAUKERKNWJOZJB-SJKOYZFVSA-N	446.367	1.553	50	20	IDGD	
Cc1ccncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)CBr)CCO2	1830538472	GISVTJWRCAZTNH-DNVCBOLYSA-N	440.338	1.491	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3noc(C(C)C)n3)C2)C1	1831639568	CJDJIRCOLDVFNF-YWZLYKJASA-N	442.944	1.599	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ncc(Cl)cn3)C2)C1	1831644079	NNMCJZRWKQUPRT-KSSFIOAISA-N	431.320	1.608	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cn4ccccc4n3)C2)C1	1831647475	VTIAAMRBWAMKRM-IERDGZPVSA-N	434.924	1.812	50	20	IDGD	
CC(=O)C[C@H](C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1	1831798823	ICALQFNBTCBRMI-HRAATJIYSA-N	428.338	1.215	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2nc3ncccn3n2)CC1	1831832291	FTZJFRDFAMPDQR-JKSUJKDBSA-N	434.928	1.611	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccnc(F)c3)CCO2)C1	1831907105	GXIXHVKZRULOMY-PXAZEXFGSA-N	430.274	1.074	50	20	IDGD	
O=C(CCBr)N1CCC([C@H]2CCCCN2C(=O)CN2C(=O)C=CC2=O)CC1	1831983761	DOANFNZJDULROV-OAHLLOKOSA-N	440.338	1.316	50	20	IDGD	
O=C(Cc1c(F)ccc(F)c1F)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1832072832	WGHCMRTUMINCKF-AEFFLSMTSA-N	438.805	1.637	50	20	IDGD	
CCCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2	1832549508	SRLVMXFVPVVWMI-YWZLYKJASA-N	447.960	1.375	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3cccc(Cl)n3)CCO2)C1	1833174364	WVBLVGUKJOSMHC-FQEVSTJZSA-N	444.359	1.999	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cncc(N(C)C)c3)CCO2)C1	1833358784	UXTFNJAVEWKXAW-WIYYLYMNSA-N	438.956	1.625	50	20	IDGD	
CN(C)c1ncc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@](C)(Cl)CCl)C3)C2)o1	1833900837	CWGKZMFJCYUODV-MSOLQXFVSA-N	449.335	1.047	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccoc3C)CCO2)C1	1834143010	MFJPFEVXUOQZEB-MAUKXSAKSA-N	429.311	1.832	50	20	IDGD	
COc1ccc(CC(=O)NC2CCN(C3CCN(C(=O)[C@H](O)CCl)CC3)CC2)cc1	1834508778	FOLYYUWCXJBLSR-HXUWFJFHSA-N	437.968	1.409	50	20	IDGD	
Cc1ccccc1OCC(=O)NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1834533749	YNBZWZCLLHFELC-IBGZPJMESA-N	437.968	1.545	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1)c1cc(CO)on1	1836188106	GDRKSZQRXZSQAI-UHFFFAOYSA-N	443.342	1.137	50	20	IDGD	
O=C(c1ccn(C(F)F)n1)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836718668	YQOJJROBNQRCPX-OAHLLOKOSA-N	434.871	1.490	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(NC(C)=O)o3)CCO2)C1	1837448415	LGQYDEWFDUJFNH-MGPUTAFESA-N	441.912	1.716	50	20	IDGD	
C[C@@H](C(=O)N1CCC(OC2CCN(C(=O)[C@H](F)Cl)CC2)CC1)N1CCN(C)CC1	1838084280	UHMOXKNYGDXGPT-YJBOKZPZSA-N	432.968	1.155	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3[nH]cc4c3CCC4)CCO2)C1	1838454841	VDAVQAXYBMMYGW-UXHICEINSA-N	444.359	1.810	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)[C@@H]3C[C@@]3(F)Cl)CC2)CC1	1838789694	UATVDJSIOHNAFX-JXFKEZNVSA-N	446.951	1.283	50	20	IDGD	
Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1839427926	AAMJTTMHOANJLM-QAPCUYQASA-N	447.822	1.647	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnc4cc(C)ccn34)CCO2)C1	1839602047	IBMFKPCIUIFPPN-HRAATJIYSA-N	434.924	1.730	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccc(F)c(F)c3)C2)C1	1840151460	BZFRZYFOQZTIKZ-YWZLYKJASA-N	446.878	1.218	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCCc3cccnc3)C2)C1	1840156185	JMZALXNPGKJBBD-WIYYLYMNSA-N	439.940	1.115	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(C)cc3OC)C2)C1	1840156643	ROUYMEKEMWVUFD-DYESRHJHSA-N	440.924	1.327	50	20	IDGD	
CC(C)C[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1	1841353816	RFYFHHASUNAIBY-CABCVRRESA-N	431.961	1.729	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)COc2ccc(Cl)c(F)c2)C1	1841566450	SWKSHBFPRVPMNS-UHFFFAOYSA-N	446.671	1.055	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)c2cnc3cc(Cl)ccn23)C1	1843208318	OLLJLMYNRTVWLW-UHFFFAOYSA-N	432.912	1.178	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1ccc3c[nH]nc3c1)C2	1843415830	RSSJLXOEDWXBMU-AFUMVMLFSA-N	433.472	1.514	50	20	IDGD	
Cc1ccc(COCC(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)cc1C	1843435399	XUGXPPBPGZKPPA-UHFFFAOYSA-N	436.317	1.017	50	20	IDGD	
COc1ccc([C@H]2C[C@H]2C(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)cc1	1844263525	NHUFGHAGUMPHNY-RTBURBONSA-N	449.511	1.314	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)c2ccc3occ(Cl)c3c2)C1	1844747775	RHOZSRCPFFBYAR-UHFFFAOYSA-N	438.676	1.897	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@H]2CC23CN(C(=O)OC(C)(C)C)C3)C1	1846118498	MXWZMZSPFDWGNT-HUUCEWRRSA-N	441.956	1.701	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)c1ccc3sc(N)nc3c1)C2	1846384668	UIAUFYRCJFQORM-UHFFFAOYSA-N	430.534	1.069	50	20	IDGD	
Cc1ccc(-c2nnc(SCC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)n2N)cc1	10784757	HJYYCBDWKNKLQT-UHFFFAOYSA-N	427.446	1.429	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1ccc(Cn2cncn2)cc1	10887582	MZDAFDIAGFBGQZ-UHFFFAOYSA-N	427.490	1.003	50	20	IDGD	
Cc1cc(N2CCN(CC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)CC2)nc(C(C)C)n1	15032603	WSNWEHFIUJBMFC-UHFFFAOYSA-N	441.492	1.400	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cccnc2SC(F)F)cc1	17406714	BCKXVEAQUGLESH-UHFFFAOYSA-N	444.485	1.786	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Cc2sc(=S)[nH]c2C)cc1	17407093	SKDFEDYYDGZWCC-UHFFFAOYSA-N	428.561	1.433	50	20	IDGD	
C[C@H]1CC(C)(C)C[C@@]2(C1)NC(=O)N(CC(=O)NNC(=O)c1ccc3c(c1)OCO3)C2=O	22929423	LWSJTQFFTZOCLV-LAJNKCICSA-N	430.461	1.313	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)CCNS(=O)(=O)c1cc(C)ccc1C	25413349	UHQYQUNYCOUSRF-UHFFFAOYSA-N	449.529	1.597	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)NCc1ccc([C@@]2(C)NC(=O)NC2=O)cc1	726283387	YIUKBKISOMJPKX-XUSGNXJCSA-N	443.435	1.178	50	20	IDGD	
CN(CCCNC(=S)NNC(=O)c1csc(N2CCOCC2)n1)c1ccccc1	726445641	ZYAAKQFPLLHMAR-UHFFFAOYSA-N	434.591	1.615	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3cc(-c4ccco4)[nH]n3)cc2)CC1	728215275	XEIDLKVCKVXJBL-UHFFFAOYSA-N	430.490	1.363	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)Cc3cn(C)c4ccccc34)cc2)CC1	728215843	KDAOPVLKHJOPBA-UHFFFAOYSA-N	441.557	1.800	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)N(C2CC2)[C@H]2CCS(=O)(=O)C2)N(C)c2ccccc21	728868784	YOYYJNBSJNBORC-INIZCTEOSA-N	442.541	1.835	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)NCc2nc(C)no2)cc1	729329622	VPWRJRGPRKDJCU-OQLLNIDSSA-N	435.444	1.349	50	20	IDGD	
COc1cc(OC)c(CCNC(=O)NNC(=O)COc2ccc(C#N)cc2)c(OC)c1	731119108	MTLRGQUOKYLXHS-UHFFFAOYSA-N	428.445	1.536	50	20	IDGD	
Cc1c(C(=O)NNC(=O)CNC(=O)c2cccs2)nnn1-c1ccc(OC(C)C)cc1	731331744	WCNCBYPROCIMAE-UHFFFAOYSA-N	442.501	1.615	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)c1cc(S(=O)(=O)N(C)C)ccc1N1CCCCC1	732086422	CQDLEZSXFLESBL-UHFFFAOYSA-N	434.522	1.034	50	20	IDGD	
O=C(NNC(=O)C1CCN(C(=O)COc2ccccc2)CC1)c1cnn(-c2ccccc2)c1	733110117	BHXBUGQMAHEUJC-UHFFFAOYSA-N	447.495	1.951	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)c1ccccc1NS(C)(=O)=O	734251900	SCUSGMHRDPAHOK-UHFFFAOYSA-N	440.547	1.892	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)c2ccnc(-n3ccnc3)c2)CC1	734825637	KIHCLBIPGWKCKQ-UHFFFAOYSA-N	429.481	1.611	50	20	IDGD	
C[C@@H]1CN(S(=O)(=O)c2ccc(C(=O)NNc3ccc(Cl)nn3)cc2)C[C@@H](C)O1	735688586	AZWXERPUSVAZEU-VXGBXAGGSA-N	425.898	1.685	50	20	IDGD	
COc1cccc(NCC(=O)NN=C(C)c2cccc(S(=O)(=O)N3CCOCC3)c2)c1	739413920	SVHZEUIJYWODQH-UHFFFAOYSA-N	446.529	1.668	50	20	IDGD	
O=C(NCc1nc(C(F)(F)F)cs1)NNC(=O)c1csc(N2CCOCC2)n1	740903698	RULRNKRTLMQZTG-UHFFFAOYSA-N	436.441	1.599	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)c1ncoc1-c1ccc2c(c1)OCCO2	741917844	BJUJIGBTHWBOGW-UHFFFAOYSA-N	428.426	1.365	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)c1cnc(O)c(Br)c1	742032975	DUIBKENYBLHVFO-UHFFFAOYSA-N	448.321	1.523	50	20	IDGD	
Cc1ccc(OCCC(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)c(Br)c1	742367354	UYVPMMYNTOARRS-NSHDSACASA-N	434.312	1.044	50	20	IDGD	
CCOc1ccc(-c2nnc(SCC(=O)NNC(=O)c3ccc(C#N)cc3)n2N)cc1	742449814	QKAPPCOVANZNHO-UHFFFAOYSA-N	437.485	1.483	50	20	IDGD	
O=C(NCc1cccc(C(F)(F)F)c1)NNC(=O)C1=CC=CN2CCS(=O)(=O)N=C12	742459245	IRJQROQXTLEXEM-UHFFFAOYSA-N	443.407	1.033	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)CNC(=O)c2cc3ccccc3[nH]2)c2ccccc2c1=O	742475193	YKDIWGJWUFAVHO-UHFFFAOYSA-N	446.467	1.479	50	20	IDGD	
CC(C)C(=O)c1ccc(S(=O)(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1	743257350	LACLTSNCLCABGJ-UHFFFAOYSA-N	431.518	1.541	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)CC1CCC1)N(S(C)(=O)=O)CC2	743297134	LHQRFRFWYUKLJJ-INIZCTEOSA-N	439.534	1.290	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)NC2CC2)cc1)NNC(=O)Cc1cn2ccccc2n1	746637345	MCXZBVHUJNLMRE-UHFFFAOYSA-N	441.513	1.098	50	20	IDGD	
CN(C)C(=O)NNC(=O)c1cc(S(=O)(=O)NCc2cccnc2)c(Cl)cc1Cl	747168992	VJRYNPMTPARHNR-UHFFFAOYSA-N	446.316	1.783	50	20	IDGD	
O=C(CN1CCOC[C@H]1C[C@H](O)c1ccccc1)NNC(=O)c1cccc([N+](=O)[O-])c1	747655510	CEVVKIBQYIOTKG-MOPGFXCFSA-N	428.445	1.180	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)c2ccc([C@@]3(C)NC(=O)NC3=O)cc2)cc1OC	748014068	GMLRRUCMJMAXSZ-JOCHJYFZSA-N	440.456	1.613	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)c2ccc(S(N)(=O)=O)c(Br)c2)cc1	748048396	VPXPBYMPTMVKKT-UHFFFAOYSA-N	442.291	1.245	50	20	IDGD	
CCCc1nc(C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)nn1-c1ccccc1Cl	748718114	RRNILNVIQRBTAD-NSHDSACASA-N	440.913	1.004	50	20	IDGD	
CC(CCO)=NNC(=O)c1ccc(S(=O)(=O)N2CCN(Cc3ccccc3)CC2)cc1	749857610	CVOFUZMNOGFHDS-UHFFFAOYSA-N	444.557	1.681	50	20	IDGD	
CCC(=O)NCc1cc(S(=O)(=O)NNC(=O)NCCc2cccs2)ccc1OC	751540553	IGGQNCLLYYOIMT-UHFFFAOYSA-N	440.547	1.518	50	20	IDGD	
C[C@@H]1C[C@@H](CNC(=O)OC(C)(C)C)CN1C(=O)NNC(=O)CNC(=O)c1cccs1	752153629	GBGNXIAUPZPPLN-OLZOCXBDSA-N	439.538	1.454	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc(S(N)(=O)=O)cc(Cl)c2F)cc1C	752263822	GTROMQIEOLZCNM-UHFFFAOYSA-N	442.856	1.143	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)CN(C(=O)OC(C)(C)C)C2CC2)c2ccccc2c1=O	753394194	UVUZNGGDRUVELZ-UHFFFAOYSA-N	429.477	1.577	50	20	IDGD	
CCOC(=O)[C@H](NCC(=O)NNC(=O)c1cc(Cl)ccc1OC)[C@H]1CCCOC1	754261200	JOXSRVFYVBSYPF-YVEFUNNKSA-N	427.885	1.058	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)c2ccc(O)c([N+](=O)[O-])c2)cc1	754836839	QIEWGELZPDFRKX-UHFFFAOYSA-N	428.430	1.796	50	20	IDGD	
C[C@@H](NCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)c1nc(-c2cccc(F)c2)no1	755038381	IQEPMLVLQPABMK-LLVKDONJSA-N	428.380	1.896	50	20	IDGD	
CN(C1CCCCC1)S(=O)(=O)c1ccc(NC(=O)NNC(=O)c2cnccn2)cc1	755447906	VFZWIXBFHIGQLI-UHFFFAOYSA-N	432.506	1.896	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1cccc(-n2ccnn2)c1	755936778	LRIIJHZWIILECG-UHFFFAOYSA-N	428.474	1.045	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)Nc2ccc(F)c(S(=O)(=O)N3CCOCC3)c2)c1	756034151	WNGOLXUXHRCMHX-UHFFFAOYSA-N	447.448	1.185	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2cnc(C3CC3)nc2)c1	756373662	YFWUEDIOJRLWGM-UHFFFAOYSA-N	432.506	1.851	50	20	IDGD	
CCc1ccc(NC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc1S(N)(=O)=O	756524025	GXUARZQJGCJRKP-UHFFFAOYSA-N	444.473	1.254	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)[C@@](C)(O)CN2Cc3ccccc3C2=O)c1C	756796330	HYAJBFZOTQPROK-MWTRTKDXSA-N	425.485	1.625	50	20	IDGD	
CN(NC(=O)C(=O)NCc1ccc(F)cc1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758786332	LUZOEVZYYZZBET-UHFFFAOYSA-N	437.472	1.078	50	20	IDGD	
COc1cc(Br)c(N)c(C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)c1	759304047	DZQYNIJUQWRNSH-UHFFFAOYSA-N	447.245	1.530	50	20	IDGD	
COc1ccc(C(=O)CC(C)(C)CC(=O)NNC(=O)CNC(=O)c2cccnc2)cc1	759399275	BTWPOEXOBFTWNO-UHFFFAOYSA-N	426.473	1.657	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(F)(F)[C@H](C(=O)NNC(=O)COc2ccccc2O)C1	760296494	NQLBBTQFCVZYEK-LBPRGKRZSA-N	429.420	1.811	50	20	IDGD	
C[C@@H](CC(=O)NNC(=O)NCCc1cccs1)NS(=O)(=O)c1cccnc1Cl	760449286	DZPAOVWKEAOQGQ-NSHDSACASA-N	445.954	1.427	50	20	IDGD	
Cn1cc(C(=O)NNS(=O)(=O)c2ccc(OC(F)(F)F)cc2Br)cn1	762474392	FSCGHWIIIHVMBA-UHFFFAOYSA-N	443.201	1.705	50	20	IDGD	
O=C(NNc1nccc(N2CCOCC2)n1)C1CCN(C(=O)/C=C\c2ccccc2)CC1	762855066	FFECTTFBMWEWCJ-SREVYHEPSA-N	436.516	1.708	50	20	IDGD	
COCCOc1ccc(C#N)cc1NC(=O)C(=O)NNC(=O)COc1cccc(C)c1	763629621	FRGPYXLNUOTWTN-UHFFFAOYSA-N	426.429	1.057	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccc(Cl)c1-n1cncn1	763716239	DWTXKXWNVXTEBC-UHFFFAOYSA-N	442.863	1.648	50	20	IDGD	
CN(C)C(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)CSc2ccc(Cl)cc2)cc1	763733826	JHGCJAPUTHLSEH-UHFFFAOYSA-N	448.932	1.849	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)C(=O)Nc2cc(F)ccc2OC[C@H]2CCCO2)c1	763757669	JXHLUWXQRDPNAK-QGZVFWFLSA-N	444.463	1.849	50	20	IDGD	
COC(=O)c1cc(Cl)cc(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)c1	763807280	OBOLTFJWWJXOEP-UHFFFAOYSA-N	430.804	1.163	50	20	IDGD	
Cc1nc(C(=O)NNC(=O)CNC(=O)c2cccnc2)nn1-c1c(Cl)cccc1Cl	763812872	COKLYRNUUGIDCR-UHFFFAOYSA-N	448.270	1.469	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(N3C[C@H](C)O[C@@H](C)C3)nc2)cc1	763832562	XYVWQGJMWMSSSJ-GJZGRUSLSA-N	425.489	1.657	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccccc2O[C@@H](C)C#N)cc1	763862457	XMAUCUNIMNBDEQ-LSDHHAIUSA-N	440.456	1.930	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1cccc(OC[C@@H]2CCCO2)c1	763863767	BVIBNOBRVRTUOV-YOEHRIQHSA-N	445.447	1.937	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cccnc2Br)cc1	763871705	HMILFWXRARBNRX-NSHDSACASA-N	449.261	1.600	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cc(CN(C)C)ccc2C)cc1	763872569	OLWUUTINWNALQM-INIZCTEOSA-N	440.500	1.813	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)C(=O)CCC3)cc1	763877072	HJOKPYDVZWYLGY-AWEZNQCLSA-N	437.452	1.962	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(-c3ncon3)cc2)cc1OC	763902138	NNGOWVQQNIZBHI-UHFFFAOYSA-N	425.401	1.544	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2nn(C(C)(C)C)cc2C#N)ccc1OC(C)C	763916693	RYECMVNJJBFXCU-UHFFFAOYSA-N	442.476	1.705	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3cnn(C[C@@H]4CCCO4)c3)cc2C1	763939659	NOTXYCCJRWLBPD-WFASDCNBSA-N	431.518	1.648	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CC[C@@H](C)C3)cn1C	763941969	LGAXVRISYYYKSX-LLVKDONJSA-N	432.502	1.788	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc(NC(=O)[C@H](C)n2cncn2)cc1	763950020	IBJZVOFIVNDGQB-AWEZNQCLSA-N	435.444	1.186	50	20	IDGD	
COc1cc(OC)c(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)cc1F	763998255	NXDYXRGCIFXZCN-UHFFFAOYSA-N	429.202	1.333	50	20	IDGD	
O=C(Cc1ccsc1)NNC(=O)C(=O)Nc1ccc(F)cc1I	764033188	HGPZNYLOPHBXOP-UHFFFAOYSA-N	447.229	1.820	50	20	IDGD	
CC[C@@H](C)C(=O)NNC(=O)C(=O)Nc1cc(NC(=O)CN2CCCC[C@@H]2C)ccc1F	764084647	VNDKKYAXANYIDP-KGLIPLIRSA-N	435.500	1.771	50	20	IDGD	
CC(=O)N(C)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(C)cc3)[nH]n2)cc1	764111703	RRTWYYMPGYMDRS-UHFFFAOYSA-N	434.456	1.768	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(OC)c2O)c(C(F)(F)F)c1	764132480	XMJNMRTTYZNCEK-UHFFFAOYSA-N	427.335	1.828	50	20	IDGD	
N#Cc1ccc(OC(F)F)c(NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)c1	764239029	ARDYNYURPKPSAR-UHFFFAOYSA-N	427.367	1.900	50	20	IDGD	
CCN(CC)C(=O)COc1cccc(NC(=O)C(=O)NNC(=O)c2scnc2C)c1	764246804	RLPQNDNSEIVWNT-UHFFFAOYSA-N	433.490	1.098	50	20	IDGD	
COc1ccc(C=NNC(=O)CN2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)cc1C	764816843	DJOZZWCGQUWFOL-UHFFFAOYSA-N	444.557	1.769	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)Nc2cc(-n3cnnn3)ccc2C)n[nH]1	765308808	AXXXPWJKUPBPFZ-UHFFFAOYSA-N	433.432	1.836	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)cc(S(N)(=O)=O)c1C	765318623	JYSQOWIUUOSTOP-UHFFFAOYSA-N	428.511	1.017	50	20	IDGD	
CNS(=O)(=O)c1ccc(CCC(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)cc1	765617061	RCPMFHHQAOFMQP-UHFFFAOYSA-N	445.476	1.518	50	20	IDGD	
Cc1cccc(NC(=S)NNC(=O)[C@@H](C)NS(=O)(=O)c2cccc(C#N)c2)c1C	767854617	IUVCKKDTNLGUKF-CQSZACIVSA-N	431.543	1.860	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)Nc1cccc(C(=O)N2CCOCC2)c1	769228498	UHOWZYIBYJVLAD-UHFFFAOYSA-N	448.501	1.720	50	20	IDGD	
CSCCNC(=S)NNC(=O)c1cccc(S(=O)(=O)N2C[C@@H](C)C[C@@H](C)C2)c1	769777978	KVXOLYDTTQPXGX-OKILXGFUSA-N	444.648	1.825	50	20	IDGD	
CCOC(=O)CNC(=O)C1CCN(S(=O)(=O)c2ccc(CCCCl)cc2)CC1	771974679	BXTKMDBGSFPIPS-UHFFFAOYSA-N	430.954	1.938	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)[C@H]1CCCN(S(=O)(=O)c2ccccc2)C1	771988157	JBLFQHDTYYPOKY-CVEARBPZSA-N	439.534	1.213	50	20	IDGD	
Cc1ccc(C(=O)N[C@@H](C(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)C(C)C)cc1	772188835	YWYKVKHSPAMUGY-GOSISDBHSA-N	444.919	1.867	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)[C@H]3CCCCO3)c2)cc1	772220742	ZPJCKIPGTFKOQW-GOSISDBHSA-N	433.486	1.826	50	20	IDGD	
CCCCS(=O)(=O)N1CCC[C@H]1C(=O)NNC(=O)[C@H](C)Oc1cccc(Cl)c1	772969736	OQQHKOUYIWHUBG-BBRMVZONSA-N	431.942	1.849	50	20	IDGD	
O=C(NNc1cnc2ccccc2n1)C(=O)Nc1ccc(I)cn1	773575599	ASDVGWLYWBXAKM-UHFFFAOYSA-N	434.197	1.711	50	20	IDGD	
CC(C)C[C@H](/N=C1/NS(=O)(=O)c2ccccc21)C(=O)NNc1cc(Cl)nc(N)n1	773862946	ZKWGNHBOORECNS-NSHDSACASA-N	437.913	1.309	50	20	IDGD	
CS(=O)(=O)c1ccc(CNC(=O)NNc2nc3ccccn3n2)cc1C(F)(F)F	775211637	HWOXNXKMRIVJLJ-UHFFFAOYSA-N	428.396	1.978	50	20	IDGD	
NS(=O)(=O)c1cccc(N2C[C@@H](C(=O)NNc3ncc(Cl)cc3Cl)CC2=O)c1	775269310	HIHXPYZGXCMIKN-VIFPVBQESA-N	444.300	1.532	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)NNc2cnccn2)cc1	775278994	QFIYSXSJGJGDRN-GDNBJRDFSA-N	432.444	1.274	50	20	IDGD	
CN(C)C(=O)c1cccc(C(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)c1	776201904	MUPPOURDMWYLOU-UHFFFAOYSA-N	433.509	1.638	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)COC2CCN(C(=O)OC(C)(C)C)CC2)C[C@@H](C)O1	777087719	ACBSXLBDRILUPY-IYBDPMFKSA-N	442.557	1.049	50	20	IDGD	
CNS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccccc2OC(F)(F)F)cc1	778802249	WKNCLADKRZVWMD-UHFFFAOYSA-N	432.380	1.575	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)[C@@H]2C[C@]23CCN(C(=O)OC(C)(C)C)C3)nc2ccccc21	780171903	UNLLLISMIBENAR-FPTDNZKUSA-N	427.505	1.910	50	20	IDGD	
N#Cc1ccc(N2CCC[C@@H](NC(=O)NNC(=O)Cc3cn4ccccc4n3)C2=O)cc1	780894796	SHAGSZFNGBZOLD-GOSISDBHSA-N	431.456	1.274	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)[C@]2(NC(=O)OCc3ccccc3)CCOC2)nc1C	781021884	TVBMBLYEPQQTNX-NRFANRHFSA-N	443.460	1.490	50	20	IDGD	
Cc1nc(Cn2nnc(C(=O)NNC(=O)COc3ccccc3-c3ccccc3)c2C)no1	781854758	GEFYXCMXBWXUMQ-UHFFFAOYSA-N	447.455	1.833	50	20	IDGD	
COc1ccc(NNC(=O)Nc2cccc(S(=O)(=O)N3CCCN(C)CC3)c2)nc1	782035158	XFAOWHRZQPOVHU-UHFFFAOYSA-N	434.522	1.565	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2cccc(Cn3nc4ccccn4c3=O)c2)nc1	782142970	VSZSOXRFCRPQAK-UHFFFAOYSA-N	433.428	1.030	50	20	IDGD	
COc1ccc(NC(=O)c2cccc(NC(=O)C(=O)NNc3cc(C)nc(C)n3)c2)cn1	783324313	GQPLFSHUGMYXQF-UHFFFAOYSA-N	435.444	1.831	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2ccc(NC(=O)NC[C@@H]3CCCO3)cc2)nc(C)n1	783325114	SRSSNXBACCKVMX-INIZCTEOSA-N	427.465	1.476	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)CCS(=O)(=O)C1	783427999	VPZXLZWCUKLQEC-FQEVSTJZSA-N	428.470	1.487	50	20	IDGD	
COC(=O)[C@@H](Cc1ccc(Cl)cc1)NNC(=O)c1sc(N2CCOCC2)nc1C	783569376	FMBIBBAMCBNWCP-OAHLLOKOSA-N	438.937	1.960	50	20	IDGD	
CC1(C)Oc2ccc(NC(=O)C(=O)NNc3ccc(S(=O)(=O)NC4CC4)cc3)cc2O1	784214326	VSUFTFLPMCIGKZ-UHFFFAOYSA-N	446.485	1.716	50	20	IDGD	
COC(=O)c1cc(I)cc(NC(=O)C(=O)NNc2ccccn2)c1	784801058	LOTSRWIJLJNZTK-UHFFFAOYSA-N	440.197	1.555	50	20	IDGD	
CCCCNS(=O)(=O)c1cccc(NC(=O)C(=O)NNc2cccc(C(=O)OC)c2)c1	784853711	MTOWOYKMQCMVNX-UHFFFAOYSA-N	448.501	1.633	50	20	IDGD	
O=C(NNc1cccc(C(F)(F)F)n1)C(=O)Nc1ccc(CN2C(=O)CCC2=O)cc1	784958623	OJUSKBSYHOFYNS-UHFFFAOYSA-N	435.362	1.831	50	20	IDGD	
CN(C)c1nccc(NNC(=O)C(=O)Nc2cccc(I)c2)n1	784970810	NRSGBSUKBMVBLN-UHFFFAOYSA-N	426.218	1.229	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)c2c[nH]nc2-c2ccc3c(c2)OCO3)c2ccccc2c1=O	785013932	MORHUFPZQGDNRY-UHFFFAOYSA-N	432.396	1.127	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1cccc(Br)c1	785330150	FIJVYSUYMAGGSK-UHFFFAOYSA-N	442.291	1.943	50	20	IDGD	
O=C(COC(=O)CCc1nnc(C2CCCC2)o1)NNC(=O)c1ccc([N+](=O)[O-])cc1	786751412	DGNIZOCDQAOCEH-UHFFFAOYSA-N	431.405	1.572	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1	787340991	JXRSJKIGRWKMPD-UHFFFAOYSA-N	445.379	1.936	50	20	IDGD	
COCCNC(=O)CN1CCN(C(=O)/C(C#N)=C\c2cc(C)n([C@H](C)COC)c2C)CC1	790445220	PBKVLOPOXNNTIQ-LZAZYHHXSA-N	445.564	1.126	50	20	IDGD	
COc1ccc(OC)c(C2=NO[C@@H](C(=O)NNC(=O)[C@@H](C)Oc3ccc(F)cc3)C2)c1	792020009	CJBTYGNRXJYWRI-CWTRNNRKSA-N	431.420	1.951	50	20	IDGD	
CC(=O)NC[C@H]1CCn2ncc(C(=O)NNC(=O)CSc3ccc(Cl)cc3)c2C1	792735112	LDLHHVOKALYTKJ-ZDUSSCGKSA-N	435.937	1.788	50	20	IDGD	
O=C(NNS(=O)(=O)c1cccc(OC(F)(F)F)c1F)c1ccc(-n2cnnn2)cc1	793350180	GJVQWVQQTSLUFK-UHFFFAOYSA-N	446.342	1.323	50	20	IDGD	
CCOC(=O)c1cc(Cl)cc(S(=O)(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1	793351336	VWRUXLJRCGTMED-MRXNPFEDSA-N	440.861	1.666	50	20	IDGD	
CCOCCCn1c(NNC(=O)[C@@H]2COCCN2C2CCCC2)nc2ccccc2c1=O	793498871	PPBZISDXXSIEBD-FQEVSTJZSA-N	443.548	1.910	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)[C@@H]1CN(C(=O)OC(C)(C)C)CCO1	795169441	PVXOUJGVEMPFKD-AWEZNQCLSA-N	428.511	1.016	50	20	IDGD	
CN(C(=O)[C@H]1CCN(CC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)C1)c1ccccc1	797529809	HLCXJBSXPBUYRB-INIZCTEOSA-N	425.445	1.341	50	20	IDGD	
CC(=O)N[C@](C)(C(=O)NNc1cccc([N+](=O)[O-])c1C)c1ccc(S(C)(=O)=O)cc1	797746284	TUBCBYCJCKDOIW-IBGZPJMESA-N	434.474	1.801	50	20	IDGD	
CO[C@H](C(=O)NNC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1)c1cnn(C)c1	798829587	IFBOADSJNHMLFT-SFHVURJKSA-N	431.456	1.817	50	20	IDGD	
Cc1ccc(Cc2sc(NC(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)nc2C)cc1	799431138	DWXJZUILAILOFT-LBPRGKRZSA-N	425.536	1.441	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)[C@H]2CCCN(S(=O)(=O)c3ccccc3)C2)cc1	802061119	KQJVFJXDSRYTRH-HNNXBMFYSA-N	432.502	1.949	50	20	IDGD	
Cc1nn(-c2ccc(S(N)(=O)=O)cc2)c(C)c1CCC(=O)NNc1ncccc1F	804219924	TYJAAHRFDAKPDR-UHFFFAOYSA-N	432.481	1.747	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1CNC(=O)NNc1ccc(-n2ccnc2)nn1	804987684	JNTNVZDIGSSUFQ-UHFFFAOYSA-N	444.521	1.565	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)c1ccc2oc(O)nc2c1	805192082	XNJDRZCKBZXQTO-UHFFFAOYSA-N	443.891	1.766	50	20	IDGD	
CCOC(=O)CC(C)(C)CC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	806341988	AOWXIZQPHHRGGF-UHFFFAOYSA-N	439.534	1.602	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)c1cc([N+](=O)[O-])ccc1N1CCOCC1	806365115	HTMOSJZYKYNPHM-UHFFFAOYSA-N	429.433	1.313	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)Nc1nc(Cc2ccccc2)cs1	806973739	VCPLCNZFOMVLKJ-QGZVFWFLSA-N	438.465	1.660	50	20	IDGD	
COC(=O)c1cc(C)c(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)c(Cl)c1	806974053	RMIYTQOOERPFMQ-UHFFFAOYSA-N	444.831	1.472	50	20	IDGD	
Cc1nc(Cl)cc(NNC(=O)CNS(=O)(=O)c2cccc(Br)c2)n1	810437888	KRFJBRRTSZXUBP-UHFFFAOYSA-N	434.703	1.623	50	20	IDGD	
Cc1cccc(Br)c1C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	811272735	UPDATDQNFCYVBU-OAHLLOKOSA-N	449.257	1.902	50	20	IDGD	
C[C@H]1Oc2ccccc2N(CC(=O)NNC(=O)COc2ccc(Br)cc2)C1=O	811878217	JIDVABLPHBQBSC-GFCCVEGCSA-N	448.273	1.789	50	20	IDGD	
CC[C@H](CNC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1)OC	812593814	SLFWKYIJQVGGMM-GFCCVEGCSA-N	426.520	1.918	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)CCNC(=O)N2CCc3ccccc3C2)cc1	812732151	USLNSRBUWSFNGO-UHFFFAOYSA-N	445.545	1.538	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H](C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)C[C@H]2C[C@H]21	815408423	HYLLZOPOKXLWCX-OAGGEKHMSA-N	430.509	1.238	50	20	IDGD	
COC(=O)c1cnn(C)c1NC(=O)C(=O)NNC(=O)c1sc(-c2ccccc2)nc1C	815567094	OKFIECKPDLHRMO-UHFFFAOYSA-N	442.457	1.038	50	20	IDGD	
CNC(=O)Oc1cccc(NC(=O)C(=O)NNC(=O)CSc2ccccc2OC)c1	815571112	VKRCGFMSBZZKDS-UHFFFAOYSA-N	432.458	1.292	50	20	IDGD	
CCC(=O)Nc1ccc(C)c(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)N(C)C)c1	815751648	IJMKOZWIICGBGK-UHFFFAOYSA-N	447.517	1.676	50	20	IDGD	
CC(C)COc1ccc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)N(C)C)cn1	815751971	WVFJJQYNOJGXCR-UHFFFAOYSA-N	435.506	1.449	50	20	IDGD	
CCOc1ccc(NNC(=O)C(=O)Nc2ccc(C(=O)N3CCN(C)CC3)cc2)cc1	815816256	OPHVXUZEHVENBB-UHFFFAOYSA-N	425.489	1.555	50	20	IDGD	
COc1ccc(S(=O)(=O)NCCC(=O)NNc2nc3ccccc3n2C)cc1OC	816576953	PHRGOGUOHZYTII-UHFFFAOYSA-N	433.490	1.402	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N[C@@H](CCSC)C(=O)NNc2ncncc2F)cc1	817070689	LAFJDYGDJKATMP-HNNXBMFYSA-N	443.526	1.558	50	20	IDGD	
C[C@H]1CC(C)(C)C[C@@]2(C1)NC(=O)N(CC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)C2=O	912764469	QHCIEWXWVNCWPW-FKIZINRSSA-N	431.449	1.493	50	20	IDGD	
COC(=O)Nc1ccc(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1	912988606	LGPGGPKYULFQDO-UHFFFAOYSA-N	426.838	1.241	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)CNS(=O)(=O)c2cccs2)cc1	915188822	WZIFZKXPRDNQIA-GFCCVEGCSA-N	427.504	1.040	50	20	IDGD	
CCC[C@@H](C)NC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	915886726	BLXYIMLYCJVQDG-OAHLLOKOSA-N	426.539	1.159	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=S)Nc1cccc(S(=O)(=O)N(C)C)c1	916112733	DVEQDIIJJCOMFH-UHFFFAOYSA-N	437.547	1.375	50	20	IDGD	
Cc1cc(CNC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)ccc1F	916231116	CUKBMCZBJBNUIJ-UHFFFAOYSA-N	436.513	1.292	50	20	IDGD	
CC(C)n1nc(C(=O)NNS(=O)(=O)c2csc(C(=O)O)c2)c2ccccc2c1=O	917722462	VYLLEMXHJXPXQR-UHFFFAOYSA-N	436.471	1.360	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NC2CCN(Cc3ccncc3)CC2)cc(OC)c1OC	918014087	HRYPQZABAICCBI-UHFFFAOYSA-N	443.504	1.716	50	20	IDGD	
O=C(COc1ccccc1CNC(=O)NNC(=O)c1ccccc1)NC[C@@H]1CCCO1	918217091	ZCPKNWSZRQVPJU-SFHVURJKSA-N	426.473	1.505	50	20	IDGD	
O=C(NNC(=O)C1(S(=O)(=O)c2ccc(Cl)cc2)CC1)c1ccc(-n2cnnn2)cc1	919690334	DEDRJCPIBKSJJA-UHFFFAOYSA-N	446.876	1.083	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)COCc1ccccc1	919799249	MTHYTMPRNSLHSE-INIZCTEOSA-N	448.545	1.734	50	20	IDGD	
Cc1sc2ncnc(SCCC(=O)NNC(=O)N[C@H]3CCS(=O)(=O)C3)c2c1C	919883976	CYZHSSNMUFYGFH-NSHDSACASA-N	443.576	1.308	50	20	IDGD	
COc1ccc([C@@H](CNC(=O)NNC(=O)Cc2ccccc2OC)N2CCOCC2)cc1	919898091	WHSRUJAISJDPJR-HXUWFJFHSA-N	442.516	1.650	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)CN2C(=O)N[C@]3(CCCC[C@@H]3C)C2=O)o1	920272334	MYXANJUHPCMQTH-QKKBWIMNSA-N	433.509	1.383	50	20	IDGD	
COc1ccc(-c2nn(CCC#N)cc2C(=O)NNC(=O)c2cccn2C)cc1[N+](=O)[O-]	920852900	ZMSJPXMWPLHYPN-UHFFFAOYSA-N	437.416	1.794	50	20	IDGD	
O=C(NC[C@@]1(N2CCOCC2)CCSC1)NNC(=O)c1ccc(Br)cc1	1115884826	XMCIDHBZVPGALB-KRWDZBQOSA-N	443.367	1.601	50	20	IDGD	
C[C@H](CCNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)N(C)C(=O)OC(C)(C)C	1251795109	ALVDBAQYQVALOM-OAHLLOKOSA-N	449.556	1.669	50	20	IDGD	
Cc1nn(CCO)c(C)c1C=NNC(=O)CN1c2cccc3cccc(c23)S1(=O)=O	1317993107	NYJDQCSTROJGRU-UHFFFAOYSA-N	427.486	1.304	50	20	IDGD	
CN1CCN(Cc2cccc(CNC(=O)NNC(=O)CSc3ccccc3O)c2)CC1	1319601921	TUMSMEICSMLYNZ-UHFFFAOYSA-N	443.573	1.762	50	20	IDGD	
CC(C)(C)OC(=O)NCC(F)(F)CNC(=O)NNC(=O)c1cncn1-c1ccccc1	1321528326	ZQIGFPSCVAYEPS-UHFFFAOYSA-N	438.435	1.976	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)[C@@H]2CCCCN2Cc2cccnc2)n1	1321701668	UJSKDCMFOPWEJX-INIZCTEOSA-N	431.518	1.134	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)c1cncn1-c1ccccc1)N1CCN(c2ccc(F)cc2)CC1	1321910081	LTHRSOYBLSEYMM-KRWDZBQOSA-N	436.491	1.983	50	20	IDGD	
O=C(NCc1ccccc1CN1CC[C@@H](O)C1)NNC(=O)c1cncn1-c1ccccc1	1342097533	GTCAVDWXTGDEHK-HXUWFJFHSA-N	434.500	1.583	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2)c1cccc2ncccc12	1778451990	QOHIIKYXADVQDO-NNMXDRDESA-N	431.920	1.962	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(Cl)Cl)C2)c1cc2cn[nH]c2cn1	1779194659	JMEJHDVBICLBGE-RDTXWAMCSA-N	426.304	1.889	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(Cl)nn1)C2)[C@H](F)Br	1780775048	VTUDPXNJIBKGPD-PVXIVEMSSA-N	449.708	1.948	50	20	IDGD	
COc1ncc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)cc1C	1781328715	XCDZFEWSVWJFQW-CXAGYDPISA-N	430.274	1.533	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc[n+]([O-])c1)C2	1781996834	UQIWCHBZDROHMI-JCKWVBRZSA-N	426.311	1.231	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1c(O)cc(O)cc1O)C2	1782179893	WYUOFCRPIFUGHT-OWDMVUQNSA-N	442.896	1.185	50	20	IDGD	
COC(=O)[C@@H]1CC[C@H](C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)C(Cl)Cl)C2)C1	1782214158	MMGALLAURVNWGA-FGBSKUFISA-N	435.348	1.893	50	20	IDGD	
O=C(c1cnc2ccc(F)cn12)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1782462546	NQWZOTQPYDWNKB-WMLDXEAASA-N	443.248	1.607	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cncc(C(F)(F)F)c3)CCO2)C1	1783878233	WSLRJDQVKFPEEB-WMLDXEAASA-N	435.830	1.798	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccnc4c(O)cccc34)C[C@@H]21)[C@H](O)CCl	1784092266	LYMGXVSIEKPPBX-HZCDGDGTSA-N	433.892	1.133	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCBr)[C@H]2C1)N1C[C@@H]2C[C@H]2C1	1786406539	XBBBVDZAOYRSJY-NQCBRMCBSA-N	428.371	1.091	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc([N+](=O)[O-])c4c3OCO4)C[C@@H]21)[C@H](F)Cl	1787447689	CFFQPRZBMUMZFM-ZMZMUDBPSA-N	443.815	1.451	50	20	IDGD	
CN1CCCC[C@H]1C(=O)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1	1788140052	FYUXLQHUXSHEPB-NRFANRHFSA-N	435.333	1.598	50	20	IDGD	
C[C@H](C(=O)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1)C1(O)CCC1	1788145168	IGYGPIQJCXPZPO-MRXNPFEDSA-N	436.317	1.665	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)c3ccc(CO)o3)CCC2)cc1)c1cccc(B(O)O)c1	1788147919	ORRZXOIJSUMFFI-UHFFFAOYSA-N	434.257	1.513	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1(c2ccc(NC(=O)c3[nH]nnc3C)cc2)CCC1	1788344633	YMDIMAGBWGZBHH-VULFUBBASA-N	448.487	1.995	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc4n(n3)CCCC4)[C@H]2C1	1788356473	ZAZNWGFDTUQFNU-HPZZRFSDSA-N	439.354	1.596	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3nc(O)n4c3CCCC4)[C@H]2C1	1788788613	IZMJIMIRDDNFKQ-DZKIICNBSA-N	438.956	1.783	50	20	IDGD	
Cc1nc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]3C2)c(=O)[nH]c1C	1789868735	KVZGIEGIHKQUSH-MNUAXYBXSA-N	445.347	1.216	50	20	IDGD	
C[C@@H](Cn1ccnc1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]2C1	1789873520	YOPHSTSXHOCKTO-SIBFUHKCSA-N	431.364	1.735	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)Cc3ccccc3)C[C@@H]21)[C@@H](F)Br	1789924685	AJFBUGALQOKWEW-QUSNUVHPSA-N	443.313	1.260	50	20	IDGD	
C[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21)[S@@](=O)c1ccccc1	1790601272	XOGAUMAVJZATDX-BVEJICRYSA-N	447.384	1.966	50	20	IDGD	
CCOc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](C)Br)[C@H]3C2)nn1	1791058673	BBNJWLSKXJVECF-ABHRYQDASA-N	441.326	1.252	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccncc3C(F)(F)F)C[C@@H]21	1791254079	KSSUSGIPBOERQI-MZGVZZPPSA-N	449.857	1.948	50	20	IDGD	
CCOC(=O)c1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C(C)(C)CCl)ccn1	1792784037	JUMOZGDQEPDEAV-SCAQPMJSSA-N	437.924	1.727	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CC[C@@H]1CNc3ccccc3C1)C2)[C@@H](O)CCl	1792977109	QNDYGMSYOWASHT-IIWNNQTBSA-N	435.952	1.240	50	20	IDGD	
C[C@H](CBr)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](C)[C@H]1SC(=N)NC1=O)C2	1792988320	VPUQIYGWZZFLAN-HDLKOFKZSA-N	445.383	1.458	50	20	IDGD	
C[C@@H]1[C@H](C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](O)CCl)CCN1C(=O)OC(C)(C)C	1793117426	KACPLADROIHRRB-XJTKPRQNSA-N	443.972	1.870	50	20	IDGD	
COc1ccc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)Br)C3)cn1	1793895160	VBYDJKSRHAGTFU-FRQROOTJSA-N	440.338	1.396	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)[C@H]1[C@@H]2CCC[C@H]1c1ccccc1N2	1795498836	IGWMXUWYMAKDTF-XJAUGPLOSA-N	447.963	1.554	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cc(F)cc(F)c1	1795843092	XWRLDTDWBUZPGH-MMPOEDRJSA-N	431.277	1.880	50	20	IDGD	
CC(C)c1csc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)n1	1796190720	DHTYABLPDXJAJT-BJWYYQGGSA-N	427.335	1.512	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)c1cc2ccc(Cl)cc2nn1	1796241054	ZBNHWNQEQTWLEP-LZDSYCOUSA-N	439.299	1.086	50	20	IDGD	
CN1CCN(c2ccc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@@H](F)Cl)cc2)CC1	1796361173	KLNDVWPOIBQLPA-UKBAYJJMSA-N	438.931	1.176	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2ncncc2c1	1797468646	LERVICPGNIBTST-XEMDLRDOSA-N	428.565	1.685	50	20	IDGD	
N#Cc1ccc(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)cc1	1798440186	PUTVOXYMNNLSDN-BCDXTJNWSA-N	432.484	1.051	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](NC(C)=O)c1ccc(F)cc1	1799057616	QBSVEDBPIRJJEX-HAYURNKSSA-N	439.915	1.610	50	20	IDGD	
CCc1[nH]nc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Br)c1Cl	1799346160	GETUYDLZVBGSLU-LVNATWPUSA-N	437.697	1.519	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(-c2cc[nH]n2)cc1	1799698730	XHVKYHFWHNHMAS-SFNKJDCFSA-N	432.908	1.534	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](F)Br)c1cccn2c(O)nnc12	1800159315	QSMZAJXTNYRXAI-DTHBNOIPSA-N	426.246	1.377	50	20	IDGD	
C[C@@H](CN)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](Br)Cc1ccccc1	1800436288	URXAXTYAEZVPPX-JFMONLCZSA-N	438.366	1.177	50	20	IDGD	
C[C@@H](CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCC(=O)NN(C)C)C2)c1ccccc1	1800601409	RGTDPWLHODFLBZ-CVFMPKEZSA-N	430.549	1.143	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCNC(=O)OC(C)(C)C)C2	1800763956	PXBIZSPWQKFOEG-GUIRCDHDSA-N	448.358	1.274	50	20	IDGD	
Cc1ncc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)CBr)C3)s1	1801329631	WRCOXPPJBPZOFJ-YGSHXTJESA-N	430.368	1.615	50	20	IDGD	
CC(C)N(C)CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)C2	1801553386	ADYQYFNWSMUUAY-SJXZZSFPSA-N	446.498	1.802	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCc1c[nH]c2ncccc12	1804266461	KQZSCXKXKWGNOR-BCDXTJNWSA-N	440.548	1.507	50	20	IDGD	
C#CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](O)CCl)C2	1804371173	YWSXHHZGOBLPSM-QRJUGERDSA-N	427.929	1.141	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)c2ncc[nH]2)[C@H]1c1cccnc1	1805156663	VTGKRQYDCCNMNJ-GYPFKPTKSA-N	448.487	1.258	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H](CNC(=O)[C@@H]2CCC(=O)N2)[C@H]1c1cccnc1	1806631029	BBKZPLLVOUYEJH-JJAZEVLHSA-N	437.338	1.397	50	20	IDGD	
O=C(CC(F)(F)F)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1806835652	IQSDHFWWGULXDM-CRAIPNDOSA-N	435.211	1.033	50	20	IDGD	
Cc1cncc(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)c1	1807363852	OVPKBMVACKSWJG-KNQAVFIVSA-N	444.300	1.098	50	20	IDGD	
C[C@H](C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)n1cccc1	1807373799	GSEFVCPSNVXXSM-AGHHOFFYSA-N	446.316	1.144	50	20	IDGD	
O=C(/C=C/c1cccc(O)c1)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1	1809973248	CVHNCAWFDGMWSY-BJMVGYQFSA-N	448.328	1.630	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)c2ccco2)[C@H]1c1cccnc1	1810297776	DLPLOYVHLVCIEY-KXBFYZLASA-N	434.456	1.307	50	20	IDGD	
CC(C)O[C@H](C)C(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1810434958	HSKYXXLEAMMZJW-BLIXFSHQSA-N	433.553	1.274	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@H]1CCN(C(=O)CCn2ccnn2)[C@@H]1c1cccnc1	1810549221	YOUVUNDIUMBZHO-YLJYHZDGSA-N	430.585	1.621	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)Cn2ccccc2=O)[C@H]1c1cccnc1	1813030510	IVGZNUYFRQSNQF-ZWOKBUDYSA-N	432.908	1.203	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1cccs1)CC2)c1cccc(B(O)O)c1	1815355111	NDCYDRPHJMNGIV-ZDUSSCGKSA-N	427.316	1.424	50	20	IDGD	
CC1=CC[C@@H](C(=O)N[C@@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)CC1	1815356858	UQOZROZIJCGSJR-RHSMWYFYSA-N	439.346	1.795	50	20	IDGD	
CCc1ncccc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1816162071	BUAWRTPZNVBEHE-HXUWFJFHSA-N	447.304	1.667	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1)c1cnc(OCF)cn1	1816181465	ALJRFJJDESCYBJ-QWHCGFSZSA-N	426.836	1.411	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)Cc2ccccc2O)[nH]n1)c1cccc(B(O)O)c1	1817476908	GTEWDIPMIKEBTC-IBGZPJMESA-N	448.288	1.344	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccn3c(O)nnc23)n[nH]1	1817967848	ANRWPHBOSQAKJR-TZMCWYRMSA-N	447.883	1.718	50	20	IDGD	
C[C@H](NC(=O)c1cnccn1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](F)Cl)n[nH]1	1818039846	JQOUPHOKXYTEEX-XEGUGMAKSA-N	437.863	1.545	50	20	IDGD	
COc1ccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)nc1	1818400666	MNVHAXUESYAAGV-IBGZPJMESA-N	449.276	1.113	50	20	IDGD	
CCOC(=O)N[C@H](O)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CO[Si](C)(C)C)[nH]n1	1819241702	OJUJYBSOVOIYAO-CXAGYDPISA-N	441.561	1.318	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)C13CC(C1)C3)CC2	1819800848	BCQUNYGZRBAEOQ-IMKMIKCMSA-N	426.502	1.168	50	20	IDGD	
Cc1ccc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2ccc(B(O)O)cc2)CC3)cc1	1822265385	KCUDPJPTRRXHEA-KRWDZBQOSA-N	435.314	1.671	50	20	IDGD	
COCc1c[nH]c(C(=O)N2CCCC[C@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)c1	1822414903	NPRPPVHRNBDJPB-KRWDZBQOSA-N	445.524	1.563	50	20	IDGD	
CC[C@H](NC(C)=O)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1	1822999602	VENMBKOMVXDLAY-PTRXPTGYSA-N	435.319	1.660	50	20	IDGD	
CC(C)(CCl)C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H]3CCCS3(=O)=O)sc2C1	1824925502	JAZLODDWBPDTDF-GWCFXTLKSA-N	433.983	1.897	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)Cc3ccccc3O)sc2C1	1825303311	HSFKMEZFPBNXFF-AWEZNQCLSA-N	445.545	1.376	50	20	IDGD	
Cc1nc(C(=O)N[C@@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)cs1	1826080380	GVJFBXXTJKNIEC-LLVKDONJSA-N	436.563	1.507	50	20	IDGD	
O=C(Cc1cscn1)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827055264	WPFNQXIIVNWMNJ-FQEVSTJZSA-N	441.362	1.299	50	20	IDGD	
C[C@@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1)n1cccc1	1827060451	JDVFCELMFQNGCW-AVRDEDQJSA-N	437.349	1.662	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@H]1CCc2nc(NC(=O)C34CC(C3)C4)sc2C1	1827353739	PIIWJFZCFPSGQL-WYQOQFIBSA-N	440.529	1.989	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1	1830363957	UWCOPJQBEDLJFO-DLBZAZTESA-N	429.772	1.944	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(F)s3)C2)C1	1830535818	UAAZFYQHZRHTJZ-SJCJKPOMSA-N	449.342	1.988	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)no1	1830537695	MEPNOXODCAGEPM-YVEFUNNKSA-N	430.299	1.084	50	20	IDGD	
O=C(CCCc1ccccc1F)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1830719488	DZIGPAYFPUVTBD-WIYYLYMNSA-N	442.915	1.205	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(OC)ccn3)C2)C1	1831650764	KYRGMIKBMQAVFJ-OXQOHEQNSA-N	425.913	1.568	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)[C@@H]2CCCOC2)CC1	1832867139	DUGZMCACRBJDQH-TZIWHRDSSA-N	428.338	1.026	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)Cc3ccc4c(c3)CCC4)CC2)CC1)[C@@H](O)CCl	1833307845	ALZWICLBIFMGNT-QFIPXVFZSA-N	448.007	1.889	50	20	IDGD	
CC(=O)NC(C)(C)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1833486702	WNNRGFDHYPSHHP-OAHLLOKOSA-N	449.365	1.163	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(OC(F)F)cn3)CCO2)C1	1833641823	QTYRWHXSRARASF-LIRRHRJNSA-N	447.866	1.770	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)Cc3noc(C)n3)CC2)CC1	1833808794	DQXNQIAEAXQSTG-KRWDZBQOSA-N	425.961	1.900	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)c3cc(C4CC4)on3)C2)C1	1834820295	VRGFSPBNHUMJBE-SFHVURJKSA-N	442.310	1.407	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CN3CCCCC3)CCO2)C1	1835378720	COTMCRWCOGSXJA-LPHOPBHVSA-N	446.386	1.102	50	20	IDGD	
Cn1nc(C(=O)N2CCC(N3CCC(NC(=O)CO[Si](C)(C)C)CC3)CC2)cc1O	1835834869	CHKGEBAOHXBSAC-UHFFFAOYSA-N	437.617	1.162	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(Cl)cnc3OC)C2)C1	1839141531	KRWQZRUOGUDINB-DNVCBOLYSA-N	446.331	1.831	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cc(C)on3)C2)C1	1839967124	BDYTWTOWIZNSIT-YJBOKZPZSA-N	444.326	1.155	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccc(F)cc3F)C2)C1	1840155548	DZHPWVZJUQEPSP-OXQOHEQNSA-N	446.878	1.218	50	20	IDGD	
O=C(c1cc(-c2ccco2)no1)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840187480	DFRLLWHDNGEITA-SFHVURJKSA-N	444.271	1.808	50	20	IDGD	
O=C(CCCn1cccc1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1840461638	NJZABUPZPSCFEE-WMZOPIPTSA-N	446.317	1.415	50	20	IDGD	
CN(CC(=O)N1CC2(CCCN2C(=O)c2cscn2)C1)NC(=O)NCc1ccccc1	1842470701	YIDSISOXTNXBCO-UHFFFAOYSA-N	442.545	1.306	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)c2cc(O)nc3ccccc23)C1	1843691845	ZKHXBNASPKZOMP-UHFFFAOYSA-N	425.489	1.130	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)c2c(Cl)ccc(Cl)c2O)C1	1845476390	OEPJPJRYALJQEF-UHFFFAOYSA-N	449.099	1.510	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)Cc2cccc(F)c2F)C1	1846083922	OTEFJXOQIZYDKU-VULFUBBASA-N	443.454	1.845	50	20	IDGD	
COc1cc(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](O)CCl)cc([N+](=O)[O-])c1OC	1847561863	JNEFVOSVGZTHGQ-OBJOEFQTSA-N	427.841	1.027	50	20	IDGD	
O=C(c1cccc(Br)c1[N+](=O)[O-])N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl	1847562570	YRODOYZJGXJNGD-RWMBFGLXSA-N	446.685	1.772	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)/C=C/c1cnc[nH]1	1848098777	XTNHLVUGECLAIL-GHNZZDGLSA-N	437.928	1.757	50	20	IDGD	
O=C(NNC(=O)C1CC1)c1ccc(S(=O)(=O)N2CCN(Cc3ccccc3)CC2)cc1	15788159	QKHJHOIFEURUIV-UHFFFAOYSA-N	442.541	1.364	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCCC(=O)NNC(=O)COc2ccc(C)c(C)c2)cc1	17203532	RGCRSRLIXHXYDT-UHFFFAOYSA-N	449.529	1.597	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCCCCC2)cc1C(=O)NNC(=O)c1ccccn1	17328969	KLTFVRIYHKTHFE-UHFFFAOYSA-N	432.502	1.730	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)Cc2ccc(S(N)(=O)=O)cc2)c(C)n1-c1ccccc1	110927378	YMKWKGIYYVAASL-UHFFFAOYSA-N	426.498	1.745	50	20	IDGD	
Cn1c(CC(=O)NNC(=S)NCCc2ccc3c(c2)OCCO3)nc2ccccc21	726745607	VBQKWYLSKNRXOU-UHFFFAOYSA-N	425.514	1.625	50	20	IDGD	
CS(=O)(=O)Nc1ccc(O)c(C(=O)NNC(=O)CCSc2ccc(F)cc2)c1	728203133	GNWYMGMGVFFQBG-UHFFFAOYSA-N	427.479	1.846	50	20	IDGD	
O=C(COC(=O)c1cccn1Cc1ccccc1)NNC(=O)[C@@H]1COc2ccccc2O1	728320032	YAVKXGDBROKNJB-FQEVSTJZSA-N	435.436	1.681	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)C2CCN(c3cnccn3)CC2)c1	728609103	NAQBCPBJRRPMEL-UHFFFAOYSA-N	434.294	1.925	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)NCCNc2ccc(C#N)cn2)c1	728743805	CHAIZTWQWAHRGO-UHFFFAOYSA-N	433.266	1.780	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)[C@H]2CCCN(S(=O)(=O)Cc3ccccc3)C2)c1	730495334	CBQVQOSLZLIAIS-IBGZPJMESA-N	426.498	1.561	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](Cc1cn(Cc2ccccc2)cn1)C(=O)NNC(=O)NC1CC1	730533643	YUTRVBMCJXVNCL-SFHVURJKSA-N	442.520	1.860	50	20	IDGD	
CC(C)(C(=O)NNC(=O)NCCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1ccccc1	731222833	WWTYYIPJNYRFGU-UHFFFAOYSA-N	449.489	1.181	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)NCc1ccccc1N1CCN(C(C)=O)CC1	731544289	IUBCAXZESWXKAX-UHFFFAOYSA-N	425.489	1.508	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)NC[C@H]2CN(C)CCN2C)cc(OCC)c1OCC	732253667	LUSCFZKJVAFSDN-INIZCTEOSA-N	437.541	1.073	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)N1CCN(c2ccc(F)cc2)CC1	732269603	IHYFFODYFAPOAW-HNNXBMFYSA-N	448.520	1.201	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NNc2ccccc2S(C)(=O)=O)cc1	732301606	FKUCJGACLALKAR-KRWDZBQOSA-N	437.543	1.695	50	20	IDGD	
Cc1nc(C(F)(F)F)ccc1C(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	732322194	FFBOVXSJEWUAIJ-UHFFFAOYSA-N	426.307	1.935	50	20	IDGD	
C[C@H]1C[C@H](C)CN(S(=O)(=O)NNC(=O)c2ccc(CSc3nncn3C)cc2)C1	733876320	ITMRZOAOWUTMKN-KBPBESRZSA-N	438.579	1.565	50	20	IDGD	
CN1CC[C@@H](NC(=O)NNc2ccc(S(=O)(=O)NC3CCCCCCC3)cn2)C1=O	739059655	RWRWMUUAJAQEBP-MRXNPFEDSA-N	438.554	1.330	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)c1nc(C)n(-c2c(Cl)cccc2Cl)n1	740853217	YOYIFHNRXQDYHR-UHFFFAOYSA-N	427.292	1.948	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)[C@H]2CCCN(C(=O)c3ccncc3)C2)cc1OC	742037855	IZFAPMQFCSSYKK-KRWDZBQOSA-N	426.473	1.802	50	20	IDGD	
CNS(=O)(=O)c1ccc(CCC(=O)NNC(=O)c2cccc(Br)c2)cc1	742771260	KZJDGQYPBUZUHN-UHFFFAOYSA-N	440.319	1.751	50	20	IDGD	
Cc1ccc(CN2C(=O)CC[C@H]2C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc1	743292196	AWZXUPFWYMLYIV-SFHVURJKSA-N	433.468	1.839	50	20	IDGD	
CN(C)C1(CNC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)Cc2ccccc2C1	743634501	UWNLJJQOJRYNTC-UHFFFAOYSA-N	430.530	1.133	50	20	IDGD	
O=C(CNC(=O)c1ccc2c(c1)OCO2)NNC(=O)c1cc(Br)ccc1O	743732020	HVSRVBBYTOSWFI-UHFFFAOYSA-N	436.218	1.074	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)CN2C(=O)NC3(CCCC3)C2=O)cc1Cl	743835505	CVWBGBUNQZIRNC-UHFFFAOYSA-N	439.856	1.375	50	20	IDGD	
CCC[C@@H](C)N1C[C@H](C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)CC1=O	744619044	FWRNIFQGAWZVNE-HZPDHXFCSA-N	438.550	1.188	50	20	IDGD	
Cn1cc(C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)c(-c2ccc([N+](=O)[O-])cc2)n1	744845355	QBLHZWVWRUFNHJ-UHFFFAOYSA-N	448.395	1.485	50	20	IDGD	
Cn1ccnc1[C@@H](NC(=O)NNC(=O)c1cc([N+](=O)[O-])ccc1O)c1ccccc1F	745394596	JIXKLNSCVOQVRI-INIZCTEOSA-N	428.380	1.907	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCCc2cn3cccc(C)c3n2)nc1	746778215	VADDZUGMKJPMFB-UHFFFAOYSA-N	445.549	1.937	50	20	IDGD	
C[C@@H](CS(C)(=O)=O)C(=O)NNC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1	746823160	VXSUGFBGEJLCJX-AWEZNQCLSA-N	427.486	1.376	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)N[C@@H]1CCN(CC(F)(F)F)C1	747308134	MASHSMQEUQKDEL-LLVKDONJSA-N	439.232	1.795	50	20	IDGD	
CNS(=O)(=O)Cc1ccc(CNC(=O)NNC(=O)c2ccc(Cl)cc2F)cc1	747490733	BSIXNISBPZXDSM-UHFFFAOYSA-N	428.873	1.673	50	20	IDGD	
Cn1cc(S(=O)(=O)N2CCOCC2)cc1C(=O)NNc1ccc(C(F)(F)F)cc1	747589486	HLWMHYVDYIDLBI-UHFFFAOYSA-N	432.424	1.822	50	20	IDGD	
COc1cccc(C(=O)NNS(=O)(=O)c2ccc(C(=O)O)c(Br)c2)c1O	747608780	NUNWJQXAPWJOFF-UHFFFAOYSA-N	445.247	1.485	50	20	IDGD	
Cc1ccc(CNC(=O)C2CCN(CC(=O)NNC(=O)c3ccc(F)cc3)CC2)cc1	747847276	NKRWBEJJKLMEQS-UHFFFAOYSA-N	426.492	1.924	50	20	IDGD	
Cc1ccc(NC(=O)[C@@H]2CCCN(CC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)C2)nc1	748815966	BGZFVELLZKZLPX-MRXNPFEDSA-N	440.460	1.410	50	20	IDGD	
COCCCN1C(=O)C(=NNC(=O)N2CCOCC2)c2cc(Br)ccc21	750935995	LANXDYWGCSKJEI-UHFFFAOYSA-N	425.283	1.578	50	20	IDGD	
COCCCNC(=O)NN=C1C(=O)N(Cc2ncon2)c2ccc(Br)cc21	750936652	WVBOREAGSXTPNZ-UHFFFAOYSA-N	437.254	1.419	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2ccc(F)cc2Br)oc1C	751147126	YTNWQJCTJFGMCJ-UHFFFAOYSA-N	435.227	1.900	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCCN(C(=O)CCc3ccccc3)CC2)n1	751484953	VHYBRMXMSVSTLR-UHFFFAOYSA-N	443.573	1.309	50	20	IDGD	
CCOC(=O)C1(C(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)CCC1	751577234	KJRNKYKXVLBOMW-UHFFFAOYSA-N	448.483	1.883	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)NNC(=S)Nc2ccc(OC(C)C)cc2)c(C)o1	751616021	BAJHNHUPXPDQSM-UHFFFAOYSA-N	426.520	1.915	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)NCCNS(=O)(=O)c2ccc(Cl)s2)c1	752170139	WSFLQBRPPIOGON-UHFFFAOYSA-N	427.895	1.196	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)NC[C@@H]2CCN(S(C)(=O)=O)C2)c(C)n1C[C@H]1CCCO1	753130439	YVCKRQHWKOLYRF-GHEFCESTSA-N	434.562	1.589	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](n2cc(C(=O)NNc3ccc(C(N)=O)nn3)cn2)C1	753424828	MEBXJVHKIOKDMT-ZDUSSCGKSA-N	430.469	1.101	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1	755515662	GGCJFOJBVVZAAZ-QGZVFWFLSA-N	434.474	1.366	50	20	IDGD	
COC(=O)c1nscc1S(=O)(=O)NNC(=O)c1cc(F)ccc1Br	755974137	LJOFFNICJGBSCS-UHFFFAOYSA-N	438.256	1.455	50	20	IDGD	
COC(=O)CCOc1ccc(NC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc1	756279713	VCMNPXRXOSCPHD-UHFFFAOYSA-N	439.428	1.986	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CN2CCCC[C@H]2CNC(=O)Nc2ccccc2)c1	756580188	NVCBVWRONYQEJX-FQEVSTJZSA-N	434.500	1.995	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(NC(=O)NNC(=O)CCc2ccccc2O)cc1	756785385	TUJUYRUOXASTQQ-UHFFFAOYSA-N	436.490	1.102	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)[C@@](C)(O)CN2Cc3ccccc3C2=O)cc1OC	756798632	ZWIDOCLCLLVBFR-QFIPXVFZSA-N	427.457	1.262	50	20	IDGD	
CS(=O)(=O)Nc1cc2ccccc2cc1C(=O)OCC(=O)NNC(=O)c1cccs1	756815938	HPGOPCILSGWVCF-UHFFFAOYSA-N	447.494	1.891	50	20	IDGD	
Cc1cc(C(=O)N2CCOCC2)ccc1NC(=O)NNC(=O)COCc1ccccc1	757830930	MMJINYUKUGWNDG-UHFFFAOYSA-N	426.473	1.837	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)Nc2ccc(-c3nnnn3C(C)C)c(F)c2)c1	757995304	VQNLWKUJDPVLDK-UHFFFAOYSA-N	441.427	1.880	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)[C@@H](C)Sc1ccnc2cc(Cl)ccc12	758031648	XMEJIKRQZAAJQY-NXEZZACHSA-N	430.939	1.454	50	20	IDGD	
CCNS(=O)(=O)c1ccc(CC(=O)NNC(=O)Nc2ccc(OC(F)F)cc2)cc1	759380994	OEZWYORGOYZKHJ-UHFFFAOYSA-N	442.444	1.982	50	20	IDGD	
O=C(NCC1CC1)NNC(=O)[C@@]12CCC(=O)N1c1ccccc1C(=O)N2Cc1ccccc1	759591195	LMIWJOASDZSQRL-XMMPIXPASA-N	447.495	1.906	50	20	IDGD	
COC[C@@H](C)n1c(C)cc(/C=C(\C#N)C(=O)N2CCC3(CC2)NC(=O)N(C)C3=O)c1C	759621356	HNVOZCPBPVKPGP-CLXYIWAZSA-N	427.505	1.762	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)[C@@H]3CCNC(=O)C3)c2)c(C)c1	760224487	OAINKTQRZKSNRO-MRXNPFEDSA-N	444.513	1.391	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccnn2Cc2ccc(F)cc2)cc1OC	760278100	AIMKGIMUCXIIAU-UHFFFAOYSA-N	441.419	1.487	50	20	IDGD	
CCOc1ccccc1C(=O)N1CCC[C@H]1C(=O)NNC(=O)CCNC(=O)OC(C)(C)C	760440391	XCUVYWBFKWLDFC-INIZCTEOSA-N	448.520	1.752	50	20	IDGD	
CC(=O)N(CCc1ccccc1)CC(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12	761200315	PJAVEVKFYFNIHK-UHFFFAOYSA-N	449.511	1.830	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)NCc1ccccc1CS(C)(=O)=O	761724781	YOWIPJNJUJYENV-UHFFFAOYSA-N	437.543	1.863	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCCCN(C)C)cc1C(=O)NNC(=O)c1ccccc1F	761754696	QGXRRYGJFMGMDG-UHFFFAOYSA-N	436.509	1.439	50	20	IDGD	
CC(=NNC(=O)NCCNC(=O)OC(C)(C)C)c1c(C)nn(CCS(C)(=O)=O)c1C	763176041	NPTJBYGYLIKSSZ-UHFFFAOYSA-N	444.558	1.092	50	20	IDGD	
CCOC(=O)c1cnn(-c2cccc(NC(=O)C(=O)NNC(=O)c3ccccn3)c2)c1C	763467709	RTLXMMOTWHWVLX-UHFFFAOYSA-N	436.428	1.152	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cc(CN(C)C)ccc2C)cc(OC)c1OC	763540384	ULIYIRNXYLNKBT-UHFFFAOYSA-N	444.488	1.482	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccn(-c3ccccc3)n2)cc(OC)c1OC	763540423	UVJIQSHOVHGBQC-UHFFFAOYSA-N	439.428	1.298	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1cc(Br)ccc1F	763630366	ZOMFCKRSJWAWOJ-UHFFFAOYSA-N	434.225	1.944	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N1CCC[C@@H](S(C)(=O)=O)C1	763642354	QKBZNVNEBVTFMT-SMDDNHRTSA-N	448.339	1.466	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccccc2OC(F)(F)F)cc1	763660711	GBLCKDPBKMDCFB-UHFFFAOYSA-N	427.335	1.759	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(OC(C)C)c(C#N)c2)cc1	763662055	SLHAEALCURCPES-UHFFFAOYSA-N	426.429	1.519	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(C(=O)c2nccn2C)cc1	763711753	ASOLTUWEXCYWKO-UHFFFAOYSA-N	449.467	1.378	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(OC)c(NC(C)=O)c1	763713901	RFOABJOBGGLCMM-UHFFFAOYSA-N	428.445	1.381	50	20	IDGD	
CCc1nnc(-c2ccc(NC(=O)C(=O)NNC(=O)c3cc(OC)cc(OC)c3)cc2)o1	763774402	CJWIMUHPXQEICH-UHFFFAOYSA-N	439.428	1.716	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(OC[C@@H]2CCCO2)cc1	763808711	PPXIYBJLXHGXQD-SFHVURJKSA-N	438.440	1.281	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccccc2CN2CCSCC2)cc1	763820057	DLVWLKVAVTZRJO-UHFFFAOYSA-N	442.541	1.709	50	20	IDGD	
O=C(CCc1nc2ccccc2n1-c1ccccc1)NNC(=O)CNC(=O)c1cccnc1	763825785	WIKJLSLOQORDGQ-UHFFFAOYSA-N	442.479	1.931	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)N2C[C@H](C)Oc3ccccc32)cc1	763870651	BIWOKISSPVMFJQ-DZGCQCFKSA-N	425.441	1.618	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1cccc(CC(=O)OC(C)(C)C)c1	764041155	RRVNVRPRHRLTMV-UHFFFAOYSA-N	427.457	1.979	50	20	IDGD	
Cc1cc(S(C)(=O)=O)ccc1NC(=O)C(=O)NNC(=O)c1ccc2ccccc2c1	764061471	FCXMKHMNZNCTDM-UHFFFAOYSA-N	425.466	1.951	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2ccc(S(C)(=O)=O)cc2C)cc1	764125884	DLTCSUYFAPRKTE-UHFFFAOYSA-N	433.486	1.126	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccc(N2C[C@H](C)O[C@@H](C)C2)cc1	764131630	JTJSZUNOWNRSBN-HOTGVXAUSA-N	440.500	1.637	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(Cn3cncn3)cc2)o1	764138975	MVBATXYXZFELCR-UHFFFAOYSA-N	439.476	1.161	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3cccc(C4OCCO4)c3)cc2)CC1	764140060	HHMOVRAMWGIJNI-UHFFFAOYSA-N	446.529	1.425	50	20	IDGD	
CC(C)n1nnnc1-c1ccccc1NC(=O)C(=O)NNC(=O)c1cccc2cccnc12	764151059	DXZPURFWGIQRLG-UHFFFAOYSA-N	444.455	1.869	50	20	IDGD	
CC[C@@H](C)NS(=O)(=O)c1cccc(NC(=O)C(=O)NNC(=O)CCc2ccccc2)c1	764186433	WVPJGQWVYYHUDS-OAHLLOKOSA-N	446.529	1.482	50	20	IDGD	
CNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(F)ccc2Br)cc1	764276272	BKJRRCJVUUVMOI-UHFFFAOYSA-N	437.225	1.348	50	20	IDGD	
CCOC(=O)c1c(C)csc1NC(=O)C(=O)NNC(=O)c1ccc(OC)cc1OC	764285916	DLSVSLMOCAFDHK-UHFFFAOYSA-N	435.458	1.650	50	20	IDGD	
NC(=O)CCSc1ccccc1NC(=O)C(=O)NNC(=O)c1cc2ccccc2o1	764331424	WKEPCNOSGOQQLM-UHFFFAOYSA-N	426.454	1.800	50	20	IDGD	
Cc1cc(C(=O)N2CCC[C@@H](C)C2)ccc1NC(=O)C(=O)NNC(=O)c1cnn(C)c1	764360133	XANLUAFEVJHMHM-CYBMUJFWSA-N	426.477	1.000	50	20	IDGD	
COC(=O)c1cc(Br)c(F)cc1NC(=O)C(=O)NNC(=O)OC(C)(C)C	765388343	CEKLSZSEFISLHA-UHFFFAOYSA-N	434.218	1.869	50	20	IDGD	
CON(C)C(=O)[C@H](CCSC)NC(=O)NNC(=O)c1cc2c(s1)CC[C@@H](C)C2	765632370	CYSJRMZHHYLONQ-YPMHNXCESA-N	428.580	1.958	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)CCOc3cccc(F)c3)CC2)cc1	765748880	RXJUKTWNQNFJFP-UHFFFAOYSA-N	428.508	1.868	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)c1ccc(S(=O)(=O)C(C)C)cc1	767287367	XXBUOBSOBYMZFY-UHFFFAOYSA-N	432.498	1.724	50	20	IDGD	
COc1cc2c(cc1NC(=O)C(=O)NNC(=O)c1cnn(-c3ccccc3)c1)NC(=O)CC2	768240884	BUTRMRPUVJEHGK-UHFFFAOYSA-N	448.439	1.165	50	20	IDGD	
C[C@H](C(=O)NNC(=O)CNc1ccccc1)N1C(=O)c2ccc(Br)cc2C1=O	769649025	YKGKEJIWQSSIIZ-LLVKDONJSA-N	445.273	1.693	50	20	IDGD	
Cc1cc(NNC(=O)CN2C(=O)N[C@](C)(c3ccc(Br)cc3)C2=O)nc(C)n1	771581524	FOFJECFVEJVUDI-GOSISDBHSA-N	447.293	1.766	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)C1CCN(C(=O)c2ccoc2)CC1	772193724	ZNDVSZFAUYJHKT-UHFFFAOYSA-N	432.864	1.249	50	20	IDGD	
CC(C)[C@H](C(=O)OCC(=O)C(C#N)=C1N(C)c2ccccc2N1C)N1CCCS1(=O)=O	773188527	NLKCDIXSQBCYOV-LJQANCHMSA-N	446.529	1.480	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)cc1C(N)=O	773264958	OYZUFPILFCYETQ-SNVBAGLBSA-N	427.866	1.225	50	20	IDGD	
O=C(COC(=O)c1ccnc(O)c1Br)NNC(=O)c1ccc([N+](=O)[O-])cc1	773656417	DSEVMSLXXLYXFO-UHFFFAOYSA-N	439.178	1.076	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)cc1	774003492	WKVLLOWTJUYSMV-GFCCVEGCSA-N	449.847	1.445	50	20	IDGD	
C=CCOc1cccnc1C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	775521688	YIISXYDVICQZDS-UHFFFAOYSA-N	430.486	1.506	50	20	IDGD	
COC(=O)Cn1cccc1C=NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	776183423	MWJLHYZVNBEUPP-UHFFFAOYSA-N	432.502	1.600	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)c2cnc3scc(C)n3c2=O)cc1C	776464505	NTVCKVFIUDWOQH-UHFFFAOYSA-N	434.499	1.615	50	20	IDGD	
CC(C)N1C(=O)C[C@H](C(=O)NNC(=O)C(=O)N2CCCC2)[C@H]1c1ccc(Cl)c(F)c1	776472950	FRKHGCLGWZWDGQ-SUMWQHHRSA-N	438.887	1.547	50	20	IDGD	
COC1(C(=O)NNc2cccc(S(C)(=O)=O)c2)CCN(C(=O)OC(C)(C)C)CC1	776714957	MRBYWEXFRNAOBN-UHFFFAOYSA-N	427.523	1.949	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)CN2C(=O)N[C@]3(C[C@H](C)CC(C)(C)C3)C2=O)nc1C	778423481	DEGPPCQLABBSMG-GTJPDFRWSA-N	446.508	1.542	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)CC[S@@](=O)c2ccc3c(c2)OCCO3)nc1C	778423922	ITIRCLOHNRGAPK-SSEXGKCCSA-N	434.474	1.374	50	20	IDGD	
COC[C@@H](C)n1c(C)cc(/C=C(/C#N)C(=O)NS(=O)(=O)c2c(C)nn(C)c2OC)c1C	778852635	OLUHRSBVMFQZLE-ZLYHGVDXSA-N	449.533	1.775	50	20	IDGD	
Nc1cccc([N+](=O)[O-])c1C(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	779533652	KSRHYPGUYFFFDA-UHFFFAOYSA-N	446.895	1.409	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNc2cc(C)nc(C)n2)c(OCC(F)(F)F)c1	783324894	RAIDADUOURSVKL-UHFFFAOYSA-N	441.366	1.903	50	20	IDGD	
COc1ccc(S(=O)(=O)NC2CC2)cc1NC(=O)C(=O)NNc1ccc(F)cc1F	783342762	IXLYGDPXVHUJMH-UHFFFAOYSA-N	440.428	1.496	50	20	IDGD	
CCOc1cc(C(=O)N(C)C)ccc1NC(=O)C(=O)NN=c1sc2ccccc2n1C	783349527	KXZFLGIALVDXNA-UHFFFAOYSA-N	441.513	1.911	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2ccccc2Nc2ccc(F)cc2F)CCS(=O)(=O)C1	783425712	CXVHCPILPOQIQW-LJQANCHMSA-N	438.456	1.845	50	20	IDGD	
COc1ccccc1Oc1ccc(NC(=O)C(=O)NNC(=O)C(=O)N2CCCC2)cc1	784000004	RJJRMJZCZIZOOF-UHFFFAOYSA-N	426.429	1.196	50	20	IDGD	
C[C@@H](C1CC1)n1cc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)cn1	784218503	VNVKSBJYXNKKOY-LBPRGKRZSA-N	432.506	1.377	50	20	IDGD	
CS(=O)(=O)c1c(F)cc(NC(=O)C(=O)NNc2ccnc(Br)c2)cc1F	784829138	XYSABPPPDHJXOM-UHFFFAOYSA-N	449.233	1.608	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)F)cc1)C(=O)Nc1ccn(-c2ccncc2)n1	784832658	CNHHVFLJVULHQI-UHFFFAOYSA-N	436.400	1.345	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2ccc(CCN3CCOCC3)cc2)n1	785225899	LJDGMINYVOLCSY-UHFFFAOYSA-N	441.536	1.279	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2ccc(NS(=O)(=O)CC)cc2)n1	785232678	JSRTXNACGQHQRE-UHFFFAOYSA-N	435.510	1.166	50	20	IDGD	
O=C(NNC(=O)C(=O)Nc1ccccn1)N[C@@H]1CCN(c2cccc(Br)c2)C1	787371347	VTVBIIMRAVHTBN-CYBMUJFWSA-N	447.293	1.392	50	20	IDGD	
N#C/C(=C\c1ccc(O)cc1)C(=O)N1CCC(C(=O)NCCCN2CCOCC2)CC1	787387498	MDHOLWLAJPVELY-CAPFRKAQSA-N	426.517	1.376	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)cccc1N1CCNC1=O	787544522	SJGBTUDMQYXXAR-CYBMUJFWSA-N	443.435	1.217	50	20	IDGD	
COc1ccc(Br)cc1C(=O)CCC(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1	788023236	JXKPBHCRZWUMBY-JTQLQIEISA-N	447.307	1.003	50	20	IDGD	
CCNC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1C	789731210	BFTVIQHXWXZKJS-QGZVFWFLSA-N	441.444	1.062	50	20	IDGD	
CC(C)(C)OC(=O)Nc1ccc(CC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)nc1	791512870	MLJJDRRLXCZLAC-UHFFFAOYSA-N	448.501	1.836	50	20	IDGD	
C[C@@H]1CN(c2ccnc(C(=O)NNc3ccc(S(=O)(=O)N(C)C)cc3)c2)C[C@@H](C)O1	794730566	MTCNXDALOOMGRD-HUUCEWRRSA-N	433.534	1.702	50	20	IDGD	
C=C(CBr)COC(=O)CS(=O)(=O)N1CCN(c2cccc(C)c2)CC1	795468378	XFYGMFIZLBCUGT-UHFFFAOYSA-N	431.352	1.941	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)c(Cl)c1)Nc1cc(S(=O)(=O)N2CCCC2)ccn1	797675395	SDEMFITUNXKIBX-UHFFFAOYSA-N	439.881	1.692	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cnn(CCO[C@@H]3CCCCO3)c2C)cc1	801105482	FBVSKLWLZXNDOW-GOSISDBHSA-N	429.477	1.443	50	20	IDGD	
COc1cc2c(cc1OC)CN(C(=O)CCC(=O)NNC(=O)N=c1cc[nH]cc1)CC2	802023260	PLZUBKUOUMXNOS-UHFFFAOYSA-N	427.461	1.039	50	20	IDGD	
C[C@]1(c2ccccc2)NC(=O)N(CC(=O)NNC(=O)Nc2ccc3c(c2)OCO3)C1=O	802093414	UDLYPIVHBHROLE-HXUWFJFHSA-N	425.401	1.035	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)c2cccc(CN3CCS(=O)(=O)CC3)c2)cc1	802123381	OOXUALVYWPSJTD-UHFFFAOYSA-N	445.545	1.450	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1)C(=O)Nc1cc(F)c(N2CCOCC2)cc1F	806972840	NXVPRZNGMGSHRJ-UHFFFAOYSA-N	438.818	1.855	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C(=O)Nc2ncc(C(F)(F)F)s2)nc2ccccc21	812982956	UPLXBSOAOPSSHY-UHFFFAOYSA-N	426.380	1.377	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)C(=O)Nc1ccc([C@H]2CCOC2)cc1	815569194	KIJVWEOMUVWXOH-HNNXBMFYSA-N	434.493	1.581	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCc2nncn2C1)C(=O)Nc1cccc(Br)c1Cl	815692013	HOOVXGADPMWCHX-QMMMGPOBSA-N	441.673	1.043	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1cccc(Br)c1	815751472	ANLDKECATKUAHX-UHFFFAOYSA-N	441.307	1.781	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)[C@]2(c3ccccc3)CCC(=O)NC2)cc1	816818190	TVJMFOMJWBPXRF-WAIKUNEKSA-N	425.485	1.848	50	20	IDGD	
O=C(CN1C(=O)N[C@@]2(CCc3ccccc32)C1=O)NNC(=S)NCCc1cccs1	838822204	MNSDFYZYGNXEKL-HXUWFJFHSA-N	443.554	1.179	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)[C@H](CC(C)C)N1C(=O)[C@@H]2CC=CC[C@H]2C1=O	864001386	ZETSQZQEUOVHOB-ZACQAIPSSA-N	443.500	1.587	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)COc1ccc2c(c1)CCC(=O)N2	876242201	RFSZZRWRSCDZMK-UHFFFAOYSA-N	448.273	1.939	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)CNS(=O)(=O)c2ccccc2F)cc1	912839909	OVQRYAJNNRIROP-CYBMUJFWSA-N	439.465	1.118	50	20	IDGD	
C[C@@H]1CCCCN1C(=O)CN1CCN(CC(=O)NNC(=O)c2cccc(Cl)c2)CC1	913053422	QNBZDXMICLHCPF-MRXNPFEDSA-N	435.956	1.120	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1)NNC(=O)c1cccnc1	913109483	FJOZQZFMGSRRDX-UHFFFAOYSA-N	436.799	1.493	50	20	IDGD	
Cn1c(=O)nc(O)c2c(C(=O)NNC(=O)c3cc(Br)c[nH]3)cc(C3CC3)nc21	914446058	ORUGPOASCKOXOS-UHFFFAOYSA-N	447.249	1.077	50	20	IDGD	
CS(=O)(=O)NCCNC(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccc(Cl)cc1	914604886	AOKATFIADGJPNF-PTNGSMBKSA-N	446.920	1.690	50	20	IDGD	
COc1c(F)cc(CC(=O)NNC(=O)c2ccc(C(C)(C)C)cc2)cc1S(N)(=O)=O	915594179	JAHMJIZXQUDIOH-UHFFFAOYSA-N	437.493	1.783	50	20	IDGD	
O=C(NNC(=O)c1cn(-c2ccccc2)nc1-c1ccccc1)N[C@H]1CCS(=O)(=O)C1	915880703	WJHMWGZQOHGGIY-INIZCTEOSA-N	439.497	1.670	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)Cc2ccc(C(=O)NNC(=O)C3(O)CCCC3)cc2)cc1	916145102	SDBZJAIRVQPZPK-UHFFFAOYSA-N	445.541	1.882	50	20	IDGD	
CN1CCN(C(C)(C)CNC(=O)NNC(=O)c2ccc(COc3ccccc3)o2)CC1	916258756	GXUOWHDJKHATRJ-UHFFFAOYSA-N	429.521	1.829	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1[nH]c2ccc(Br)cc2c1Cl	918208715	IPMDIJBNGYJDNN-SSDOTTSWSA-N	434.699	1.780	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)NCc1ccccc1OCC(=O)NC[C@H]1CCCO1	918217352	HLFZSOYIAKQXKQ-GOSISDBHSA-N	440.500	1.813	50	20	IDGD	
O=C(CN1C(=O)[C@@H]2CCCC[C@H]2C1=O)NNC(=O)c1ccc(F)cc1Br	918340584	UJLWZHVHNKIEEG-GHMZBOCLSA-N	426.242	1.524	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)N3CCC[C@H](CNS(C)(=O)=O)C3)cc2C1	918779516	YAXJLGWAXRIYNV-CHWSQXEVSA-N	428.580	1.489	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccn2)nc2ccccc12)N[C@@H]1CCS(=O)(=O)C1	919883055	ADWUGPIQOJQZDK-CYBMUJFWSA-N	425.470	1.428	50	20	IDGD	
C[C@@H]1CN(Cc2cccc(CNC(=O)NNC(=O)COc3ccc(C#N)cc3)c2)CCO1	920238370	WBOIZVOQTUFABR-QGZVFWFLSA-N	437.500	1.688	50	20	IDGD	
COc1ccc(C2(C(=O)NNC(=O)c3csc(N4CCOCC4)n3)CCOCC2)cc1	920287606	GVXQLWXGTCWGCU-UHFFFAOYSA-N	446.529	1.498	50	20	IDGD	
O=C(CN1CCCC1=O)NNC(=O)c1ccc(S(=O)(=O)Nc2ccccc2F)cc1	920826827	SVCDKIWIKYEWAB-UHFFFAOYSA-N	434.449	1.010	50	20	IDGD	
C[C@@H]1CN(Cc2csc(NC(=O)NNC(=O)[C@@H]3COc4ccccc4O3)n2)C[C@@H](C)O1	920932984	ZAAFIGKTQCULLN-XNJGSVPQSA-N	447.517	1.745	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)NCc2cccnc2N2CCN(C)CC2)c1C	921248465	ZJQUYUWNUXMLFD-SFHVURJKSA-N	440.548	1.748	50	20	IDGD	
C[C@H](C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1)c1ccc(F)cc1F	1182815275	BGKWPFPIAQYCNX-ZDUSSCGKSA-N	439.488	1.543	50	20	IDGD	
CS(=O)(=O)Nc1cccc(F)c1CNC(=O)NNC(=O)c1cccc(OC(F)F)c1	1319206074	JKDFPICJHLDQSU-UHFFFAOYSA-N	446.407	1.943	50	20	IDGD	
CCOc1ccc(NC(=S)NNC(=O)[C@H](CC)N=c2nn[nH]n2-c2ccccc2)cc1	1331402290	HVAPSSPDKIWODD-KRWDZBQOSA-N	440.533	1.691	50	20	IDGD	
C[C@H](O)CNS(=O)(=O)c1ccc(C(=O)NNC(=O)NCc2ccc(Cl)cc2)cc1	1337094968	YGXUCNGHELMSJR-LBPRGKRZSA-N	440.909	1.143	50	20	IDGD	
COC(=O)CN1CCN(c2ccc(NC(=O)NNC(=O)c3ccc(OC)cc3)cc2)CC1	1337785987	RQHLSMVYUQVBOV-UHFFFAOYSA-N	441.488	1.457	50	20	IDGD	
CC1=CC[C@H](C(=O)N2CC[C@@]3(CN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)CCO3)C2)CC1	1778103073	XYZJIBOXALUOGH-OCAHMQCSSA-N	441.532	1.697	50	20	IDGD	
COc1ccc([N+](=O)[O-])c(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](F)Cl)C3)n1	1778376277	KZMXSFKCZAHELL-HNJNHCNJSA-N	444.847	1.660	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@]2(C1)CN(C(=O)c1ccc3nccnc3c1)CCO2	1779297227	XHSPJYBOHKKAMM-NRFANRHFSA-N	428.565	1.925	50	20	IDGD	
Cn1ccc2c(O)ncc(C(=O)N3CCO[C@@]4(CCN(C(=O)CO[Si](C)(C)C)C4)C3)c21	1779298959	QXMNQJUYSDJNQO-OAQYLSRUSA-N	446.580	1.574	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)cc1OC	1780655743	LCBLVWIQSIDFFN-QAPCUYQASA-N	445.285	1.838	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C1(N3CCN(C)CC3)CC1)C2	1780708572	UQTIPFUIYYEDKO-WAOWUJCRSA-N	441.016	1.298	50	20	IDGD	
Cc1nccn1CC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@](C)(Cl)CCl)C1	1780716651	KYHXLSKDIFXHQJ-AYOQOUSVSA-N	431.364	1.942	50	20	IDGD	
O=C(c1ccc(C(F)(F)F)c(F)c1)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1781619496	DWRRLICADNQWPC-PBHICJAKSA-N	438.805	1.888	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ncnn1C)C2	1781901569	QTASDVXDYSCGKJ-PBFPGSCMSA-N	428.331	1.116	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(C)c(NC(C)=O)c3)C2)C1	1781913360	CGVKJSDBQKILAD-UTKZUKDTSA-N	437.924	1.651	50	20	IDGD	
O=C(COc1cccnn1)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Br)C2	1782520846	AYAYUHVYPRSFNY-ISTRZQFTSA-N	445.289	1.060	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3sc(N)nc3C)CCO2)C1	1783342657	MTVMBLBGNBRVFK-BZNIZROVSA-N	431.356	1.651	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](OC(C)=O)C(C)C)CCO2	1783349851	UENLFARBPAUHTG-RLFYNMQTSA-N	433.343	1.578	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](N)c1cccc(Cl)c1)CCO2	1783533402	UPGVIWSIEZJTIH-PNPHSEOMSA-N	444.757	1.953	50	20	IDGD	
Cc1nn(C)c(C)c1CC(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](C)Br)C2)C1	1783538397	CIMLJPKFNNKAQA-KZULUSFZSA-N	427.343	1.193	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3CCN(C)CC3)[C@H]2C1	1783595530	XKCOLZKVTGWPHE-HJWJTTGWSA-N	430.387	1.339	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](C)Sc1ccccn1)CCO2	1783879936	ZXQYTYKZYLMHJA-DOXZYTNZSA-N	427.954	1.646	50	20	IDGD	
Cc1ccc(SCC(=O)N2CCO[C@@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc1	1783936407	VNGQBOOYJZEWMR-JOCHJYFZSA-N	448.589	1.290	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(C)(C)CNC(C)=O)[C@H]2C1	1784645210	KASLJJKJCBWSOI-VGWMRTNUSA-N	446.386	1.302	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)COc3ccc(C(=O)OC)cc3)C2)C1	1785721660	XLLBPNTUSBUSIM-UWJYYQICSA-N	438.908	1.699	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cn3cc(Cl)cn3)[C@H]2C1	1787004982	SYFZQDVMRRUYDG-MXAVVETBSA-N	447.761	1.690	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3snnc3C3CC3)[C@H]2C1	1787740429	CWXWCXUOBCUKNM-IXOXFDKPSA-N	443.367	1.792	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])[nH]3)CCC2)cc1)c1cccc(B(O)O)c1	1788147747	BBTSJFXHZNMSKE-UHFFFAOYSA-N	448.244	1.664	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(Cl)nn3)[C@H]2C1	1788834032	FZSGNEHJZRHSCG-UHXUPSOCSA-N	445.745	1.754	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3ccc4ncnn4c3)[C@H]2C1	1789714689	KDZBQEDHDGXIRD-FJIDUMEYSA-N	433.940	1.659	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccn4cncc4c3)C[C@@H]21)[C@@H](F)Br	1789926069	MPTQKZYCRLBLRY-QCEMKRCNSA-N	439.285	1.618	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cn4ncccc4n3)C[C@@H]21)[C@@H](F)Br	1789926421	XGLDEMPMXZFMGX-TZQJONAQSA-N	440.273	1.013	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccccc3-n3nccn3)[C@H]2C1	1790167814	DUCOZQUHDQDXPB-RMRDIRSESA-N	447.923	1.114	50	20	IDGD	
CC1(C)CCc2cccc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@@H](O)CCl)c2O1	1792978206	KJYQBVCFOKRJEA-MVJTYMMSSA-N	436.936	1.593	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](O)CCl	1792983745	MYEDHWKPHVLVDT-STNLWOQDSA-N	439.846	1.061	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CCc2ccoc2C1	1793124005	NTSDFNOXNUQOGL-MSJOGUNTSA-N	425.323	1.758	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C[C@H]1COc2ccccc2O1	1793268153	KHNRLJZXJFTIHJ-GEYWLOKFSA-N	448.592	1.658	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c(Br)cnn1C)C2	1793449783	MXVURVVOJBLMFT-ZMJPVWNMSA-N	447.761	1.793	50	20	IDGD	
Cc1cccc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)CBr)C3)n1	1793907623	JXVPMIMDFVTPQA-AMVTXUCVSA-N	438.366	1.943	50	20	IDGD	
COc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)CBr)C3)s1	1794329111	QUYCJBKSILPRCK-OHTBPHCPSA-N	431.352	1.991	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CS[C@H]1CCCCO1)C2	1795115925	VEUFUIQSMIDTKE-RMHZUWNSSA-N	435.384	1.621	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1nc(O)n2c1CCCC2	1797985586	RZJFWAKASMCBRZ-NMRSOGARSA-N	445.347	1.365	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3ccnn3c1)C2	1799279919	XMVBZLONECSFFM-MVWRLGRASA-N	425.316	1.774	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](O)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](F)Br)C2	1800599647	ARCRZRMMSOTYRB-FBUUZDRASA-N	438.294	1.158	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnnc(Cl)c1)C2	1800639933	CNUXGHFOCWBXMW-GFQSEFKGSA-N	431.718	1.507	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc2nscc12)c1ccc(B(O)O)cc1	1801071130	AYROKHUSROVHKT-BJWYYQGGSA-N	435.314	1.542	50	20	IDGD	
NC(=O)c1ccc(C(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]2c2cccnc2)cc1	1803145607	FFMYVUQEYZJVPB-KZNAEPCWSA-N	430.892	1.100	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cccc3nccn23)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803146550	BPPBXSMRHAWCBI-VDZJLULYSA-N	427.892	1.649	50	20	IDGD	
COC(=O)C12CC(C(=O)N3CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]3c3cccnc3)(C1)C2	1803147000	FPWOIOOBNUYPQB-OJYSUCSVSA-N	435.908	1.030	50	20	IDGD	
O=C(Cc1cnccn1)NC[C@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1	1803295551	JLLUNDBQECFUPX-BEFAXECRSA-N	432.322	1.905	50	20	IDGD	
Cc1noc(C)c1C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1805538582	SOVASYZDWFWNBQ-UWJYYQICSA-N	442.520	1.379	50	20	IDGD	
CC(=O)N1CC[C@H](CNC(=O)CN(C)NC(=O)NCc2ccccc2)[C@H]1c1cccnc1	1807453100	NCQFBNFLVHKMIK-IFMALSPDSA-N	438.532	1.454	50	20	IDGD	
C[C@H](CC(N)=O)C(=O)N1CC[C@H](CNC(=O)[C@](C)(Cl)CCl)[C@@H]1c1cccnc1	1808289584	FQCNMTXEKBGLBV-KJPHAFAOSA-N	429.348	1.835	50	20	IDGD	
O=C(CCN1CCOCC1)N1CCC2(CCCN(C(=O)CCBr)C2)CC1	1809065977	KNCOQGJWMADWNY-UHFFFAOYSA-N	430.387	1.725	50	20	IDGD	
COc1cc(C(=O)N2CC[C@@H](CNC(=O)CO[Si](C)(C)C)[C@@H]2c2cccnc2)n(C)n1	1810541881	WUOGCWUZSAKEEU-JXFKEZNVSA-N	445.596	1.995	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)Cc2cscn2)[C@@H]1c1cccnc1	1813071173	ODKKADIOHOODNV-HRAATJIYSA-N	444.561	1.160	50	20	IDGD	
C[C@H](CBr)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2CNC(=O)O2)[nH]n1	1814778335	GHGBXUMODGJPCQ-USWWRNFRSA-N	428.287	1.541	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1CCc2nc(NC(=O)Cn3ccccc3=O)sc2C1	1815448126	QJGXWTFZZSCFLY-CYBMUJFWSA-N	434.594	1.769	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)CCBr)[nH]n1)c1cccc(=O)n1O	1816146510	JGTXABOURMTNAS-LBPRGKRZSA-N	438.282	1.900	50	20	IDGD	
C[C@@H]1CCC[C@H]1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnccc1C(=O)NN)CC2	1818880837	WUZMXCNKTQKALK-JHJVBQTASA-N	442.545	1.804	50	20	IDGD	
CNC(=S)NCCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](C)Br)[nH]n1	1819409049	QIDWTTFMMWHERL-PWSUYJOCSA-N	445.387	1.669	50	20	IDGD	
Cc1cc(C(=O)NCC(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@H](F)Cl)CC3)no1	1819931075	CMLSUCPGGKFNRH-SDBXPKJASA-N	429.861	1.316	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](COC)NC(C)=O)sc2C1	1820184868	XDADYSFKDFZXSU-MBNYWOFBSA-N	430.958	1.614	50	20	IDGD	
CC(C)n1ccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)n1	1820338898	HAEDMTXCUMJELH-KRWDZBQOSA-N	444.540	1.866	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc4cccnn4n3)sc2C1	1821168475	MYSLMWCMSHGAJT-ZYHUDNBSSA-N	434.909	1.665	50	20	IDGD	
Cc1ccc(CC(=O)N2CCCC[C@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)o1	1822417074	XRIDNGOKAKRMOK-KRWDZBQOSA-N	430.509	1.919	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CN2C(=O)C=CC2=O)n[nH]1	1822531477	HWOOXEYKKNILEP-CMPLNLGQSA-N	438.282	1.110	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)[C@@H]1CCCS1	1823008613	IAMPKKWBZVQOAN-SJORKVTESA-N	428.323	1.291	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H]2C[C@H]2C2CC2)CC1	1824070642	RUSRWQMTSOMKHK-ZJOUEHCJSA-N	439.560	1.965	50	20	IDGD	
O=C1CCCN1CC(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H](F)Br)CC1	1826728993	RCYFCEXMWIBXMW-RHSMWYFYSA-N	432.334	1.919	50	20	IDGD	
O=C(COc1cccnn1)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](F)Br)CC2	1826762994	VMKMPIBDPCHONB-AMIZOPFISA-N	444.286	1.615	50	20	IDGD	
CC[C@H](NC)C(=O)N1CCC([C@@H]2CCCCN2C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)CC1	1827680505	MCMSRMKZHQTSTE-PTBWTGOTSA-N	444.580	1.738	50	20	IDGD	
Nc1n[nH]c(CCC(=O)N2CCCC[C@H]2C2CCN(C(=O)CCBr)CC2)n1	1828801576	GUTVUPRLJHNFGU-AWEZNQCLSA-N	441.374	1.724	50	20	IDGD	
CCc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)no1	1830540065	MKFMVAAXIFQEGE-SCLBCKFNSA-N	444.326	1.338	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3C[C@H]4CC[C@@H]3O4)C2)C1	1830543898	HCGXHIMYQJWEBR-RGQDEETRSA-N	445.354	1.041	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)CN(C)C(=O)C(=O)O)CC1	1831160321	GJWSTEWXYBAJME-HZPDHXFCSA-N	429.945	1.557	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCCn3ccnc3C)C2)C1	1831657215	MVEHIWORXZENOI-NQIIRXRSSA-N	440.972	1.836	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H](N)Cc2cccnc2)CC1	1831831751	AOWSLVIONVNAHQ-UFYCRDLUSA-N	436.984	1.825	50	20	IDGD	
Cc1cccnc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)Br)C2)C1	1831840360	AREROODRMHCBKV-KBXCAEBGSA-N	426.311	1.243	50	20	IDGD	
O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)c1sccc1F)CCO2	1831914269	ZPXRWYFSWJQZDC-MRXNPFEDSA-N	435.315	1.742	50	20	IDGD	
COC(=O)NCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H](C)CBr)CC1	1832062287	AYXCCTVYNZXHQX-UKRRQHHQSA-N	432.359	1.993	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cccc(-n4cncn4)c3)CC2)CC1)[C@@H](F)Cl	1835081734	ZYVLBKYQZBDDGG-LJQANCHMSA-N	448.930	1.987	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3noc4ccccc34)CCO2)C1	1835982878	YCNLLSRBAFLEIQ-IERDGZPVSA-N	435.908	1.844	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)C(C)(C)CCl)CC2)CC1	1836624803	TWFHQZDJTJBMAZ-UHFFFAOYSA-N	445.004	1.623	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC(OC2CCN(C(=O)[C@H]3C[C@H]3C3CC3)CC2)CC1	1836657463	RGLOZPZIURVOLZ-VXKWHMMOSA-N	440.349	1.025	50	20	IDGD	
CCc1cc(C(=O)N2CCC(OC3CCN(C(=O)[C@H](O)CCl)CC3)CC2)n(C)n1	1836717655	AGLAEUKLVKISCJ-GOSISDBHSA-N	426.945	1.194	50	20	IDGD	
COc1cccc(C(=O)N2CCOC[C@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)c1	1837715091	VIULRKUGSPFFGM-NRFANRHFSA-N	436.581	1.617	50	20	IDGD	
CC(C)n1nccc1C(=O)N1CCOC[C@@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1837715572	XWULWSDPLSQCGV-HXUWFJFHSA-N	438.601	1.386	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc([N+](=O)[O-])[nH]3)CCO2)C1	1838824889	YHTFMEJIDIMLBT-SFHVURJKSA-N	428.873	1.258	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)cn1C	1839200118	BYDUMWZMRYONIM-YOEHRIQHSA-N	432.290	1.094	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(O)cc3F)CCO2)C1	1839317033	HKFRDJNNPZPIKU-RTBURBONSA-N	449.306	1.838	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3Cl)C2)C1	1840033745	OQUIBSDWKHRNKL-SJKOYZFVSA-N	446.729	1.588	50	20	IDGD	
CC[C@H]1CC[C@H](C(=O)N2CCOC[C@@]3(CN(C(=O)[C@H](Cl)COC)CCO3)C2)CC1	1840156501	TZUGTTBCXOSHAQ-IKVWTGGYSA-N	430.973	1.913	50	20	IDGD	
CC(C)(C)OC(=O)NC1(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)CC1	1840956371	RYLARAKNCDRACB-FZKQIMNGSA-N	449.907	1.035	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)CC2CCN(C)CC2)C1	1841125249	VMRGMZVYLWEQTB-LFVJCYFKSA-N	428.537	1.056	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)c2ncccn2)C1	1842481861	HSEOTHIXZZUGEA-UHFFFAOYSA-N	425.401	1.441	50	20	IDGD	
O=C([C@@H]1C[C@H]1c1ccc(Cl)cc1)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843011343	UCUJPIZIDVRGGM-VQTJNVASSA-N	438.720	1.641	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1ncc(F)cc1F)C2	1843415265	GDBRSYFMBHNDHK-BRJLIKDPSA-N	430.415	1.311	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)CC(=O)OC(C)(C)C)C2	1843415373	NZTODTFXNIVNCF-OEAKJJBVSA-N	431.493	1.056	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1ccc(CO)c(F)c1)C2	1843417214	IYNFEYOQUJKSGD-AFUMVMLFSA-N	441.463	1.269	50	20	IDGD	
Cn1c(=O)n(C)c2cc(C(=O)N3CCCC34CN(C(=O)[C@@](C)(Cl)CCl)C4)ccc21	1843734649	XESFYOZUOKPXGU-IBGZPJMESA-N	439.343	1.930	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1cc(-c3ccccc3)[nH]n1)C2	1844264514	AJLBQUMATUVNPL-UHFFFAOYSA-N	445.483	1.206	50	20	IDGD	
O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)[C@H](F)Br)C1	1845220626	DCEOPFRILJQEEH-UJAVWCLSSA-N	429.242	1.711	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC12CN(C(=O)[C@@H]1CC[C@H]3CCC(=O)N3C1)C2	1846071972	ZKSYQOSYROIORM-ILXRZTDVSA-N	426.355	1.764	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)COCCOCCOCCOC)C1	1846255991	HSGHWLJDZXVYID-QGZVFWFLSA-N	434.961	1.294	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@]2(C(=O)N3CC4(CCCN4C(=O)C(Cl)Cl)C3)C[C@H]1CO2	1846388462	KJGXEIGKZJGKNI-BUXKBTBVSA-N	448.347	1.772	50	20	IDGD	
C[C@H](Br)C(=O)N1CC2(CCCN2C(=O)C2(F)CN(C(=O)OC(C)(C)C)C2)C1	1847131686	CKFOMHDJPUBSGP-LBPRGKRZSA-N	448.333	1.932	50	20	IDGD	
CC[C@H](C)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl	1847565099	HQZFCXLFCXVLJI-RFBLXINOSA-N	431.961	1.727	50	20	IDGD	
C[C@@H]1CN(S(=O)(=O)c2ccc(C(=O)NNC(=S)NC(C)(C)C)cc2)C[C@@H](C)O1	14894871	GHDOBFDJMKZBNG-CHWSQXEVSA-N	428.580	1.392	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C2CCN(S(C)(=O)=O)CC2)ccc1OCCC(C)C	25438879	DSBSSRTWJUOXRS-UHFFFAOYSA-N	441.550	1.553	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc(OC)c1C	26772680	KKCUCMYSAITSIJ-UHFFFAOYSA-N	435.502	1.402	50	20	IDGD	
CCOC(Cn1cc(C(=O)NNC(=O)c2ccc(Br)s2)nn1)OCC	109709224	MPPSNBFFGXALSV-UHFFFAOYSA-N	432.300	1.576	50	20	IDGD	
O=C(CN1CCC(C(=O)Nc2cccc(F)c2)CC1)NNC(=O)c1ccc([N+](=O)[O-])cc1	725802091	GFQREBIWMCFLMS-UHFFFAOYSA-N	443.435	1.846	50	20	IDGD	
COC(=O)CCCN1CCC(=NNC(=O)CCN2CCN(c3ccccc3)CC2)CC1	727057896	LCTFMSMWAJCSFY-UHFFFAOYSA-N	429.565	1.720	50	20	IDGD	
CNS(=O)(=O)c1cccc([C@H](C)NC(=O)NNC(=O)c2c(C)nc3ccccn23)c1	727609158	HYVDYQFVFHXLTF-LBPRGKRZSA-N	430.490	1.256	50	20	IDGD	
Cc1nc(S(=O)(=O)N2CCC(C(=O)NNc3nc(-c4ccccc4)no3)CC2)cn1C	728080009	WIZPYUYTAWJZNW-UHFFFAOYSA-N	445.505	1.323	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)NCc2ccc(-n3cncn3)nc2)c1	728745169	XOAWYGKAWRENDI-UHFFFAOYSA-N	446.265	1.578	50	20	IDGD	
O=C(NCCN1C(=O)CSC1=O)NNC(=O)c1ccc(Br)cc1Cl	728952528	WMIAXCRNNDKBEB-UHFFFAOYSA-N	435.687	1.742	50	20	IDGD	
CCN(CC)[C@@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)c1ccccc1	729283504	TYPZGPORNUQDTK-LJQANCHMSA-N	432.546	1.781	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)NCCS(=O)(=O)NCc1ccccc1	729508305	WLEITOHVUJBZRL-UHFFFAOYSA-N	429.502	1.091	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)c2ccc(S(=O)(=O)N(C)C(C)C)cc2)cn1	729692204	OEYBKNLUBBXBPG-UHFFFAOYSA-N	437.547	1.751	50	20	IDGD	
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)NNC(=O)c1cccc2ncccc12	730225453	DPCVWLOTHNEXTG-IBGZPJMESA-N	449.467	1.556	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=O)c2cccc3ncccc23)n(C)c1	730225500	GJEIAZADCDOWDM-UHFFFAOYSA-N	429.502	1.679	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)NC2CCN(CC#N)CC2)cc(OCC)c1OCC	730584110	XJZJQLSZYVEXPP-UHFFFAOYSA-N	433.509	1.815	50	20	IDGD	
CN1CCN(CCCNC(=O)NNC(=O)COc2ccccc2O)[C@H](c2ccccc2)C1	730823050	OKXALANCULHDTH-IBGZPJMESA-N	441.532	1.480	50	20	IDGD	
O=C(NNc1nc(-c2ccncc2)no1)[C@H]1CS[C@@H](Cc2ccccc2F)C(=O)N1	732065627	RVYDHPVHNNOJTE-CABCVRRESA-N	428.449	1.557	50	20	IDGD	
CN1CCN(C)[C@@H](CNC(=O)NNC(=O)COc2ccccc2Cc2ccccc2)C1	732474317	ACOKIIKTGMGHER-FQEVSTJZSA-N	425.533	1.232	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)NCC2CCN(S(=O)(=O)C(F)(F)F)CC2)cc1	732675766	GYBASLMAKUFNMT-UHFFFAOYSA-N	436.456	1.755	50	20	IDGD	
CN1C(=O)CC[C@H](C(=O)NNC(=O)C(=O)N2CCCC2)[C@H]1c1ccc(C(F)(F)F)cc1	734432871	XDLNBVGLSVGSLR-GOEBONIOSA-N	440.422	1.385	50	20	IDGD	
C[C@@H](c1ccccc1)N1CCC(NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)CC1	734947268	UFJOZLXGYBPLHV-INIZCTEOSA-N	434.504	1.832	50	20	IDGD	
Cc1cc(F)ccc1N1CCC[C@H](NC(=O)NNC(=O)CNC(=O)c2cccs2)C1	735326503	OOXVMPWCORUCCL-HNNXBMFYSA-N	433.509	1.925	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)N[C@@H](C)CN2CCN(c3ccccn3)CC2)c1	735519291	SMBCCXBCJRDHAW-SFHVURJKSA-N	426.521	1.310	50	20	IDGD	
CCOC(=O)C(=O)N1CCN(C(=O)/C(C#N)=C\c2cc(C)n(C[C@H]3CCCO3)c2C)CC1	736132094	RYKYGKQDYCDRMM-QRRJMBGHSA-N	442.516	1.425	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)Cc2cnn(-c3ccccc3)n2)cc1C	736788425	ZMSCNWCFGBHZQU-UHFFFAOYSA-N	427.486	1.747	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)NCCCCN2CCN(C)CC2)c1	737065543	SIDGXCMJLFAYDU-UHFFFAOYSA-N	442.358	1.429	50	20	IDGD	
CC(C)C[C@H](C(=O)NNC(=O)COCc1ccccc1)N1C(=O)[C@H]2CC=CC[C@H]2C1=O	737634660	LCDRIWXWNXNOMM-CEXWTWQISA-N	427.501	1.717	50	20	IDGD	
CCOc1ccc(Br)cc1S(=O)(=O)NNC(=O)C(=O)NC(CC)CC	740812582	PNDBJGXOUFFPNE-UHFFFAOYSA-N	436.328	1.462	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@H](NC(=O)NNC(=O)c1nn(-c2ccccc2)cc1O)C1CC1	741282195	UEUFLSGWITVUSH-HNNXBMFYSA-N	444.492	1.825	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)c1ccc(CNS(=O)(=O)CC)cc1	741659220	CYTQXPGZJIQFMF-UHFFFAOYSA-N	435.502	1.365	50	20	IDGD	
Cc1nn(C)c2sc(C(=O)N[C@H](C)C(=O)NNC(=O)Cn3ccc4ccccc43)cc12	742069273	PBEJDSNIGKLBJF-CYBMUJFWSA-N	438.513	1.864	50	20	IDGD	
O=C(CCN1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O)NNC(=O)CC12CC3CC(CC(C3)C1)C2	742471290	HDABSBOIJXTYKJ-KTVYBIJISA-N	429.517	1.293	50	20	IDGD	
O=C(CSCc1nc(O)c2c3c(sc2n1)CCC3)NNc1ncnc2[nH]cnc12	743470128	OZMSNNDFRZLDJV-UHFFFAOYSA-N	428.503	1.928	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1ccn(-c2ccccc2F)n1	744620213	GKXGHSHTANTYEF-UHFFFAOYSA-N	445.476	1.789	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](CCNC(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)C1	745809680	LDATWEJMELNPML-LBPRGKRZSA-N	437.453	1.892	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)c1nc(C(C)(C)C)no1	745919476	GWPLBEDGOYFNFQ-LLVKDONJSA-N	438.510	1.323	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@@H](C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)C1	746096975	STHMVAJNLPHOEC-HZPDHXFCSA-N	437.518	1.212	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCc2nccn2C1)c1ccccc1NS(=O)(=O)c1cccs1	746347044	PGYIYHPLEFVEDD-ZDUSSCGKSA-N	445.526	1.769	50	20	IDGD	
CCNC(=O)NNC(=O)c1cc(S(=O)(=O)NCc2cccnc2)c(Cl)cc1Cl	747161266	IMIKKAKFIRCVCQ-UHFFFAOYSA-N	446.316	1.831	50	20	IDGD	
COc1cc(CN2CCN(CC(=O)NNC(=O)c3ccccc3Cl)CC2)cc(OC)c1	747842459	DRDNSDNPLOCYQT-UHFFFAOYSA-N	446.935	1.936	50	20	IDGD	
N#CCCCS(=O)(=O)c1ccc(C(=O)NNC(=O)c2nnc(O)c3ccccc23)cc1	748212460	OPIFDGWJSSUVDJ-UHFFFAOYSA-N	439.453	1.488	50	20	IDGD	
O=C(Cc1ccc(S(=O)(=O)N2CCOCC2)s1)NNc1ccc(F)c(F)c1F	748215349	JEGZLHJPURAXQM-UHFFFAOYSA-N	435.449	1.872	50	20	IDGD	
O=C(Cc1ccc(Cl)cc1)NNC(=O)NCCC(=O)N1CCN(c2ccccn2)CC1	748464656	HZCCHXYZAWURSG-UHFFFAOYSA-N	444.923	1.347	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)c1ccc2ncc(I)n2c1	749401346	YXOXMVWWRVWZQC-UHFFFAOYSA-N	443.245	1.005	50	20	IDGD	
Cn1nc(SCC(=O)NN=Cc2ccc(-c3cccc(F)c3)s2)c(=O)n(C)c1=O	750931874	CHGQSCKAKIRANL-UHFFFAOYSA-N	433.490	1.589	50	20	IDGD	
COCCCNC(=O)NNC(=O)c1cc(OC)c(OC)cc1I	751372044	QYLCQEKZYOFKRE-UHFFFAOYSA-N	437.234	1.289	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1nc(-c2cnn(C)c2)oc1C	752503933	QRPFOUXHRWBSNI-UHFFFAOYSA-N	431.478	1.060	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc3c(c2)ncn3C)c1	753380828	LNFRYKBXGUDLLF-UHFFFAOYSA-N	429.502	1.679	50	20	IDGD	
O=C(CO)NNC(=O)c1ccc(NC(=O)c2ccccc2I)cc1	753440311	ZSQGUWIRVBXHRY-UHFFFAOYSA-N	439.209	1.297	50	20	IDGD	
CCc1c(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cnn1CCC(C)C	755597319	YVFKKTOBWCVTNP-IBGZPJMESA-N	444.488	1.636	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)Nc2ccc(C(=O)N3CCCC3)cc2)c2ccccc2c1=O	755610965	VLGAMKFRQZMHGX-UHFFFAOYSA-N	434.456	1.636	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)Nc2ccc(-n3cnnn3)c(C)c2)n[nH]1	755679929	OUGILLVVOQRINF-UHFFFAOYSA-N	433.432	1.836	50	20	IDGD	
O=C(NNC(=O)c1ccccc1O)Nc1ccc(F)c(S(=O)(=O)N2CCOCC2)c1	756030486	HOHXTELXPLUXJA-UHFFFAOYSA-N	438.437	1.019	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)Nc1cccc(N2CCS(=O)(=O)CC2)c1	756204513	BYUSDIIYNCSGPI-UHFFFAOYSA-N	436.465	1.292	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)Nc1nnc(Cc2cccc(F)c2)s1	756462872	BBZZJBYWXMSDGJ-UHFFFAOYSA-N	439.436	1.710	50	20	IDGD	
CC(=NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1ccccc1C(=O)O	757451640	WLJZRVBKJBIKFG-UHFFFAOYSA-N	431.470	1.560	50	20	IDGD	
O=C(CN1CCN(Cc2cccc(Cl)c2)C(=O)C1)NNC(=O)c1cccc([N+](=O)[O-])c1	758753174	CZAACOKBJBCUGG-UHFFFAOYSA-N	445.863	1.354	50	20	IDGD	
CCN(CC)C(=O)CCCC(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758785897	GVCQGVIKNIMMKW-UHFFFAOYSA-N	427.546	1.661	50	20	IDGD	
CC(C)(c1ccc(NC(=O)C(=O)NNC(=O)CNC(=O)c2ccco2)cc1)C(F)(F)F	760303560	QYUJMMILTDJYBX-UHFFFAOYSA-N	440.378	1.635	50	20	IDGD	
C[C@H]1CCN(C(=O)CCC(=O)C(C#N)=C2N(C)c3ccccc3N2C)CCS1(=O)=O	760791582	WSDXATKELKIBRI-HNNXBMFYSA-N	430.530	1.693	50	20	IDGD	
C[C@@H](NC(=S)NNC(=O)CCNC(=O)[C@@H]1CCCN1C(=O)OC(C)(C)C)C1CC1	760826784	XYISEFLZLPQDON-OCCSQVGLSA-N	427.571	1.186	50	20	IDGD	
COc1ccc(S(=O)(=O)C(F)(F)F)cc1NC(=O)C(=O)NNC(=O)C(C)(C)C	761073548	VJVYUSIVAADBOW-UHFFFAOYSA-N	425.385	1.121	50	20	IDGD	
C[C@H]1CN(Cc2ccc(C(=O)NNc3nccc(N4CCOCC4)n3)cc2)C[C@@H](C)O1	762848093	NMPMYJUJJSUHHQ-CALCHBBNSA-N	426.521	1.679	50	20	IDGD	
CCc1noc(-c2ccc(C)c(NC(=O)C(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)c2)n1	763455498	SRMFTNRXUZXKAB-UHFFFAOYSA-N	438.400	1.915	50	20	IDGD	
CN(C)C(=O)COc1cccc(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3n2)c1	763456026	VCMFQMPHHXLIGH-UHFFFAOYSA-N	435.440	1.102	50	20	IDGD	
COc1ccc(I)c(NC(=O)C(=O)NNC(=O)c2cccnc2)c1	763487407	ABICKCBSJGEYTB-UHFFFAOYSA-N	440.197	1.095	50	20	IDGD	
O=C(NNC(=O)c1cccnc1)C(=O)Nc1ccnn1Cc1cccc(Br)c1	763488940	RPJOZDNIYPLYKI-UHFFFAOYSA-N	443.261	1.489	50	20	IDGD	
CSc1ccccc1NC(=O)C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	763531272	MBOLLCBIBDHBNX-UHFFFAOYSA-N	441.557	1.707	50	20	IDGD	
CC[C@@H](C)n1ncc(NC(=O)C(=O)NNC(=O)COc2ccc(OC)cc2)c1C1CC1	763660644	FPBQVKSKGKWGDP-CYBMUJFWSA-N	429.477	1.905	50	20	IDGD	
O=C(NNC(=O)C1=S=C2CCCC2=C1)C(=O)Nc1ccnn1-c1ccc(Cl)cc1	763784929	KGYOBOBSAKMUPQ-UHFFFAOYSA-N	429.889	1.814	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)C(=O)Nc2ccc3[nH]ccc3c2)c2ccccc2c1=O	763790467	JRPXRYOVNNVTSV-UHFFFAOYSA-N	432.440	1.858	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNC(=O)c2nnc(O)c3ccccc23)cc1Cl	763790686	MYTUXMBKQFKPIW-UHFFFAOYSA-N	429.820	1.787	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)n(C2CCOCC2)n1	763872175	LBHXPNDJGZJWBN-CYBMUJFWSA-N	433.440	1.236	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccnn2-c2ccccc2C)cc1	763873739	YKLUJZVQQVDEOY-INIZCTEOSA-N	449.467	1.937	50	20	IDGD	
CNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2c(C)cc(Cl)cc2C)cc1	763883938	SMOSTQREVJZQPH-CYBMUJFWSA-N	446.891	1.870	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2c(C)nn(C)c2-n2ccnc2C)cc(OC)c1OC	763917984	FKZVCWWKMZALRX-UHFFFAOYSA-N	428.449	1.323	50	20	IDGD	
COc1cc(OC)cc(N2C[C@H](C(=O)NNC(=O)CSc3ccccc3O)CC2=O)c1	764046620	IAKMSWIHVPDJPC-CYBMUJFWSA-N	445.497	1.702	50	20	IDGD	
COC(=O)c1ccc(C)c(NC(=O)C(=O)NNC(=O)c2cccc(Br)c2)c1	764063327	NRUZHAGGMPNQHM-UHFFFAOYSA-N	434.246	1.944	50	20	IDGD	
COc1ccc(Cn2nccc2NC(=O)C(=O)NNC(=O)CCc2ccccc2O)cc1	764288168	DZIZADZRSZLXSL-UHFFFAOYSA-N	437.456	1.364	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)C(=O)Nc1cccc(-c2nnc3n2CCCCC3)c1C	764296043	SPNMPKDZUCJRHT-UHFFFAOYSA-N	436.476	1.411	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)CN(C)C3)cc1Br	764326450	IWBSZXNALUDYHZ-UHFFFAOYSA-N	447.289	1.803	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=S)NCCc1cccnc1	764519629	SZFKDIWHUUBJRE-UHFFFAOYSA-N	447.008	1.591	50	20	IDGD	
CN(CC(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1)[C@H]1CCSC1	764753589	YUSVLDVNFBBMEK-KRWDZBQOSA-N	440.013	1.042	50	20	IDGD	
CC(=NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1)c1ccc(S(C)(=O)=O)cc1	764827914	MNLLKRDOIDGFPX-UHFFFAOYSA-N	442.541	1.388	50	20	IDGD	
CN(C)C(=O)c1ccc(C=NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)[nH]1	764840339	MDBYGLSKKQVCAH-UHFFFAOYSA-N	430.940	1.638	50	20	IDGD	
COCCC(=O)N1CCC(NC(=O)NNC(=O)c2ccc(COc3ccccc3)o2)CC1	767939576	ZJHFGAWUHYNGND-UHFFFAOYSA-N	444.488	1.830	50	20	IDGD	
COc1ccc(OCC(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)cc1C	768175966	WNOISTMOJWKBGE-UHFFFAOYSA-N	435.502	1.547	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CSc2nnc(-c3cccc(C)c3)n2N)cc1OC	768442969	RPUHTYLVOQUNLE-UHFFFAOYSA-N	442.501	1.538	50	20	IDGD	
O=C(CN1C(=O)COc2cc(Br)ccc21)NNC(=S)Nc1ccccn1	768584746	XVWHQXLXWPHSTP-UHFFFAOYSA-N	436.291	1.587	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)c1ccc(S(=O)(=O)NC(C)C)cc1	768635984	MNLDOXLVJNXLSQ-UHFFFAOYSA-N	441.531	1.542	50	20	IDGD	
N#Cc1cc(Cl)nc(NNC(=O)c2cc(S(=O)(=O)N3CCOCC3)ccc2F)c1	768701906	NFJWLKQTZUTXKH-UHFFFAOYSA-N	439.856	1.524	50	20	IDGD	
N#Cc1ccc(OC2CCC(NC(=O)NNC(=O)COc3ccccc3O)CC2)nc1	769030133	PSTOKUINFPHNPW-UHFFFAOYSA-N	425.445	1.758	50	20	IDGD	
CC(=O)N1CCc2c(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc3cccc(C)c3C)cccc21	769265528	JVGDVLNDEZGPRN-OAHLLOKOSA-N	438.484	1.766	50	20	IDGD	
CCCCCCn1cc(S(=O)(=O)NNC(=O)CCc2ccccc2O)c(O)nc1=O	769634349	WRZFVRUQELABNK-UHFFFAOYSA-N	438.506	1.177	50	20	IDGD	
Cn1ccnc1[C@@H](O)[C@H]1CCCN(C(=O)NNC(=O)c2cc(Br)c[nH]2)C1	769950981	DKOQBOBNSWAZLG-GWCFXTLKSA-N	425.287	1.311	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCOCC2)cc1C(=O)OC[C@@H](C)CBr	770324925	UKJBQATYGBUADC-LBPRGKRZSA-N	436.324	1.904	50	20	IDGD	
O=C(NNc1ccc(Br)c(F)c1)C1=NN([C@@H]2CCS(=O)(=O)C2)C(=O)CC1	771681354	JTWJQANATSVOGH-SNVBAGLBSA-N	447.286	1.197	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1	772182924	ODPZRCFWCAZEBY-UHFFFAOYSA-N	442.819	1.511	50	20	IDGD	
O=C(CCCN1C(=O)c2ccccc2C1=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772188388	MPSVQQRSPAHQSX-UHFFFAOYSA-N	442.859	1.180	50	20	IDGD	
CC(C)[C@H](C(=O)NNC(=O)c1ccc(COc2ccccc2)o1)N1CCCS1(=O)=O	772632169	XBRLLZKOFMQYJO-GOSISDBHSA-N	435.502	1.680	50	20	IDGD	
CN1CCN(Cc2ccc(C(=O)NNC(=O)C(=O)NCc3ccc(Cl)cc3)cc2)CC1	772888452	JDTIFBVVQQGFGV-UHFFFAOYSA-N	443.935	1.165	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)C(=O)Nc2cccc3cc[nH]c23)c2ccccc2c1=O	773493662	FYSRQSUXRJRBKF-UHFFFAOYSA-N	432.440	1.858	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)N[C@@H]3CCN(c4ccccc4C(F)(F)F)C3)nc21	776265288	PZZUIDWBHKGUMK-SNVBAGLBSA-N	436.398	1.993	50	20	IDGD	
CCOC(=O)N1CCC[C@@H]([C@H](C)NC(=O)NNC(=O)CNC(=O)c2cccs2)C1	776866335	DRWQDEWWYJHWLU-QWHCGFSZSA-N	425.511	1.065	50	20	IDGD	
O=C(COC(=O)[C@]1(F)CCN(C(=O)OCc2ccccc2)C1)NNC(=O)c1cccs1	777233077	CFMGIZSPJJIIEJ-FQEVSTJZSA-N	449.460	1.803	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)CNC(=O)c2ccccc2C(F)(F)F)nc1C	778422553	PXEDCFUTKIEJIK-UHFFFAOYSA-N	425.367	1.854	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)c2cc(S(=O)(=O)NC(C)C)ccc2F)nc1C	778430685	YFXZBSGBDCMVJN-UHFFFAOYSA-N	439.469	1.544	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)[C@H](O)[C@H](O)c1nc2ccccc2s1	779540978	VFXBVEDFBISBBA-SJORKVTESA-N	433.511	1.639	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1)N[C@@H]1CCC[C@H]1CCO	779710320	CKZDIKCJDLIDKG-FXAWDEMLSA-N	449.515	1.884	50	20	IDGD	
Cc1ccc(-n2c(NNC(=O)CN3CCN(C)C(=O)C3)nc3ccccc3c2=O)c(C)c1	780695646	SVLMBPJDFLKBBL-UHFFFAOYSA-N	434.500	1.220	50	20	IDGD	
O=C(COc1ccccc1CNC(=O)NNc1ncncc1Cl)NC[C@@H]1CCCO1	780974287	QJCRSVUJYVWKOM-AWEZNQCLSA-N	434.884	1.630	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1cc(NC(=O)C(=O)NNc2ncncc2Cl)ccc1F	782165545	GZTRSWGPYGFHSD-UHFFFAOYSA-N	444.876	1.428	50	20	IDGD	
CC(C)C(=O)Nc1nc(CC(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)cs1	782353342	PMRIAIJYHWTGGK-UHFFFAOYSA-N	438.893	1.938	50	20	IDGD	
CC(C)(C)c1ccc(NC(=O)C(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1	782897974	UDKSIZAXBBOIEW-UHFFFAOYSA-N	431.518	1.677	50	20	IDGD	
Cc1cn(-c2ccc(C#N)cn2)nc1NC(=O)C(=O)NNc1ncccc1C(F)(F)F	783120770	XVTKWFYBWGXRET-UHFFFAOYSA-N	430.350	1.943	50	20	IDGD	
Cc1ccc(C)c(NNC(=O)C(=O)Nc2ccc(NC(=O)CN3CCOCC3)cc2)c1	783362036	JDDGTTGZCOPQNY-UHFFFAOYSA-N	425.489	1.656	50	20	IDGD	
Cc1ccccc1NC(=O)NNC(=O)C(=O)Nc1ccc(N2C[C@H](C)O[C@@H](C)C2)nc1	783416819	BGVZOSHMQLSBGQ-GJZGRUSLSA-N	426.477	1.795	50	20	IDGD	
COc1ccc(-c2nn(CCC#N)cc2/C=C(/C#N)C(=O)NN2CCCNC2=O)cc1OC	783602811	JGZPLYLWQHBABZ-WJDWOHSUSA-N	449.471	1.834	50	20	IDGD	
O=C(NNc1ccccc1Cl)C(=O)N1C[C@@H](C(=O)N2CCOCC2)Oc2ccccc21	784775044	SNCXKGAMWYFGMM-SFHVURJKSA-N	444.875	1.436	50	20	IDGD	
O=C(NNc1ncccc1Cl)C(=O)Nc1ccc(CC(=O)N2CCSCC2)cc1	784815378	VPMBVBVPXFAAPX-UHFFFAOYSA-N	433.921	1.935	50	20	IDGD	
CS(=O)(=O)c1ccc(F)c(NC(=O)C(=O)NNc2ccnc(Br)c2)c1	784830253	JPJUANYBYQLXAK-UHFFFAOYSA-N	431.243	1.469	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)C(=O)Nc2ccc(S(=O)(=O)C(F)F)cc2)c1	784852354	SWTOKEMXTSMLEK-UHFFFAOYSA-N	427.385	1.551	50	20	IDGD	
O=C(NNc1ncc(F)cn1)C(=O)Nc1cc(I)ccc1Cl	784955180	DFWMKBKZDKZUHA-UHFFFAOYSA-N	435.584	1.956	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)C(=O)Nc1cccc(N2CCCCC2=O)c1	785067778	NISWUCMPCLHHFA-UHFFFAOYSA-N	434.456	1.180	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2ccnc(OCC(F)(F)F)c2)n1	785225701	JJRPRJIGKXIJAI-UHFFFAOYSA-N	427.387	1.741	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)N1CCc2cc(F)c(F)cc21	785330392	GTFHZUQRJPLOKC-UHFFFAOYSA-N	425.413	1.409	50	20	IDGD	
Cc1cn(C)c(CC(=O)NNC(=O)c2ccccc2)c1C(=O)NNC(=O)c1ccccc1	786600013	IHOCPRUDZOZFPE-UHFFFAOYSA-N	433.468	1.412	50	20	IDGD	
O=C(NNS(=O)(=O)CCCCCl)c1cccc(S(=O)(=O)N2CCCCC2)c1	788046569	GDPYOCBEFQGQTL-UHFFFAOYSA-N	437.971	1.444	50	20	IDGD	
C[C@@]1(NNC(=O)N[C@@H]2CCCN(c3ccc(Cl)cc3Cl)C2=O)CCS(=O)(=O)C1	788916911	RVVAMMYYPXUCMJ-CXAGYDPISA-N	449.360	1.870	50	20	IDGD	
Cc1nc(-c2ccc(NC(=O)C(=O)NNC(=O)[C@H]3OCC[C@H]3c3ccccc3)cc2)n[nH]1	789811202	XFVUJCCIXUKKIB-ROUUACIJSA-N	434.456	1.439	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)N(C)CC(=O)NNc2cccc(F)c2[N+](=O)[O-])cc1	790587841	GKRUOFGDWKPRTP-UHFFFAOYSA-N	439.425	1.456	50	20	IDGD	
O=C(NNC(=O)c1cnccn1)Nc1cc(Br)cc(C(=O)N2CCCC2)c1	790598056	IPSITTBFLLGVIA-UHFFFAOYSA-N	433.266	1.942	50	20	IDGD	
COc1cc(Cl)c(Cl)cc1NC(=O)C(=O)NNC(=O)CNC(=O)c1ccco1	792280483	PWAGDIFXHFZKJB-UHFFFAOYSA-N	429.216	1.111	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)CCCNC(=O)c1ccc(F)cc1F	795169324	MVTUOQPSZKXNAS-UHFFFAOYSA-N	440.472	1.868	50	20	IDGD	
CCCc1c(NC(=O)C(=O)NNc2cnccn2)cnn1-c1cc(F)c(OC)cc1F	796989088	NOMAEEFQAOMQIQ-UHFFFAOYSA-N	431.403	1.983	50	20	IDGD	
CC(C)(C)c1ccccc1NC(=O)C(=O)NNC(=O)CNC(=O)OCc1ccccc1	797368860	ICGPWPQAKBSLFD-UHFFFAOYSA-N	426.473	1.996	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNC(=O)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1	797369398	UVPDZTSHFMTLSM-UHFFFAOYSA-N	449.807	1.261	50	20	IDGD	
Cc1cc(C(F)(F)F)ccc1S(=O)(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	800831610	XFZZFVYYVDJBMM-UHFFFAOYSA-N	426.380	1.613	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)Nc2ccc(Br)cc2)ccc1S(N)(=O)=O	801998026	KOIXZWZMFXGJBR-UHFFFAOYSA-N	427.280	1.871	50	20	IDGD	
NS(=O)(=O)c1cnn(CC(=O)NNC(=O)Nc2c(Cl)cc(Cl)cc2Cl)c1	803396071	AODFXASCBNTAJO-UHFFFAOYSA-N	441.684	1.344	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@@H](C(=O)NNc3ccc(-n4ccnc4)nn3)C2)cc1	804957214	FSHMPNJZDYFFQF-MRXNPFEDSA-N	441.517	1.515	50	20	IDGD	
CCc1nnc(NC(=O)[C@H](C)[C@H](C)NC(=O)NNc2ccccc2S(C)(=O)=O)s1	805878492	NAORPHDOGMRXJV-MNOVXSKESA-N	440.551	1.793	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)C(=O)Nc2cc(Cl)cc3c2OCC(=O)N3)c1	806968987	VBNWCBYUSHHPRM-UHFFFAOYSA-N	438.849	1.156	50	20	IDGD	
CN1CCC[C@@H](N(C)C(=O)c2ccc(NC(=O)C(=O)NNc3cccc(F)n3)cc2)C1	807391350	NXIFBZIRZHUAAS-MRXNPFEDSA-N	428.468	1.469	50	20	IDGD	
CCNS(=O)(=O)c1ccc2c(c1)N(C(=O)C(=O)NNc1nccnc1C1CCC1)CC2	807459761	FQNFRPAOUHBWJC-UHFFFAOYSA-N	444.517	1.075	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)[C@@H]1C[C@H](c2ccccc2)OC1=O	808589271	CVIPQEGFWAAKFV-DOTOQJQBSA-N	446.843	1.957	50	20	IDGD	
CC(C)c1ccccc1NC(=S)NNC(=O)CNS(=O)(=O)c1ccc(C#N)cc1	810323714	RWENIFXXJRLGLD-UHFFFAOYSA-N	431.543	1.978	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2cc(O)c3ccccc3c2)CC1	810413118	CESNMISNQQPLOP-UHFFFAOYSA-N	441.513	1.633	50	20	IDGD	
COC(=O)c1ccccc1NNC(=O)CNS(=O)(=O)c1cccc(Br)c1	810891075	CJJIGYFEWHIABF-UHFFFAOYSA-N	442.291	1.657	50	20	IDGD	
Cc1cnc(Br)c(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1	812980636	YIVQNUQZXLYHNT-CYBMUJFWSA-N	435.234	1.078	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)N[C@@H]3CC(=O)N(c4ccccc4F)C3)nc21	813236262	IVUIRGZSBXITSM-LLVKDONJSA-N	442.455	1.858	50	20	IDGD	
O=C(CN1CCCc2ccccc21)NNC(=O)C(=O)Nc1nc(CC(F)(F)F)cs1	815565240	HMZVMWDILCXTIR-UHFFFAOYSA-N	441.435	1.787	50	20	IDGD	
CCOC(=O)c1cc(COC)cc(NC(=O)C(=O)NNC(=O)Cc2ccccc2F)c1	815569516	XDEAADGJGHTQIW-UHFFFAOYSA-N	431.420	1.477	50	20	IDGD	
CN(NC(=O)c1cc(Cn2cccn2)on1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	816088117	YKRXONRRJXFRGV-UHFFFAOYSA-N	433.469	1.169	50	20	IDGD	
CC(C)CNS(=O)(=O)c1ccc(Br)c(C(=O)NNc2cnnn2C)c1	816770870	PDAXIQOGVFDKMB-UHFFFAOYSA-N	431.316	1.269	50	20	IDGD	
CC(C)n1nc(C(=O)NNS(=O)(=O)Cc2ccc(C(=O)O)cc2)c2ccccc2c1=O	821128244	UWYHHWNFYHGTAN-UHFFFAOYSA-N	444.469	1.440	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Cn2cnc3ccccc32)cc1C	879731961	UECIECJEXHQAJN-UHFFFAOYSA-N	429.502	1.121	50	20	IDGD	
O=C(NNc1ncccn1)[C@H]1CCCN(S(=O)(=O)c2ccc(Br)s2)C1	913043869	BYSWCUXGROKYSE-JTQLQIEISA-N	446.352	1.845	50	20	IDGD	
O=C(Cc1ccc(Cl)cc1)NNC(=O)[C@H]1CC(=O)N(c2ccc3c(c2)OCCO3)C1	913156731	FCHZPOBJSMCQAR-AWEZNQCLSA-N	429.860	1.854	50	20	IDGD	
CN(C)N(C(=O)c1ccc(-n2cc(Br)cn2)cc1)[C@H]1CCS(=O)(=O)C1	915141499	TZQTUGSIMKMLEB-HNNXBMFYSA-N	427.324	1.741	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NC[C@@H](c2ccc(OC)c(OC)c2)N(C)C)cc1OC	915898106	QUIKNTWKNZJTEL-INIZCTEOSA-N	446.504	1.968	50	20	IDGD	
COc1ccc(NCC(=O)NN=C(C)c2ccc(S(=O)(=O)N3CCOCC3)cc2)cc1	915916444	UKTKGGSFVUOADO-UHFFFAOYSA-N	446.529	1.668	50	20	IDGD	
COc1ccccc1OCC(=O)NN=C(C)c1ccc(S(=O)(=O)N2CCOCC2)cc1	916296551	UWCTXUKQNMPPIB-UHFFFAOYSA-N	447.513	1.635	50	20	IDGD	
Cc1nc2c(C(N)=O)cnn2c(C)c1CCC(=O)NNC(=O)Cc1cccc2ccccc12	917630662	DMUCABUDSXMMFA-UHFFFAOYSA-N	444.495	1.921	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)NCc2ccc(CN3CCCC3=O)cc2)c1	918124726	AYYBWDSVPVFCLM-UHFFFAOYSA-N	426.473	1.970	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CN2C(=O)COc3cc(Br)ccc32)c(O)c1	918338967	GSYWTMFLWFXMRM-UHFFFAOYSA-N	434.246	1.650	50	20	IDGD	
C[C@H]1C[C@H](C)CN(C(C)(C)CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)C1	919788927	XEILYQJCMALTPC-GJZGRUSLSA-N	438.598	1.680	50	20	IDGD	
Cc1nc(SCC(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)c2c(C)c(C)sc2n1	919884759	KZNCTDKRIQURHX-NSHDSACASA-N	443.576	1.226	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)CNC(=O)c2ccc(Br)o2)o1	920272272	IAXHRYDYFQRSFY-UHFFFAOYSA-N	441.282	1.668	50	20	IDGD	
CN1C(=C(C#N)C(=O)COC(=O)CN2C(=O)[C@@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2=O)N(C)c2ccccc21	922223165	WGHQPTUZLKWYJQ-BMHXQBNDSA-N	446.463	1.227	50	20	IDGD	
CN1CCN(c2cc(CNC(=O)NNC(=O)c3ccc(Br)cc3)ccn2)CC1	1115853468	CRWIBSUHUIRABZ-UHFFFAOYSA-N	447.337	1.740	50	20	IDGD	
COc1ccc(S(=O)(=O)CCC(=O)NNC(=O)c2cccc(OC(F)F)c2)cc1	1115979632	VVKFUOLDWCASFZ-UHFFFAOYSA-N	428.413	1.922	50	20	IDGD	
CCN(CC)C(=O)c1ccc(S(=O)(=O)NNC(=O)c2cncn2-c2ccccc2)cc1	1317976372	YOSKZYOQMYXCBV-UHFFFAOYSA-N	441.513	1.978	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)N[C@@H]2CCCN(C(=O)c3ccccc3)C2)nc2ccccc21	1318155641	KTCDPTZIIFCFCT-QGZVFWFLSA-N	434.500	1.751	50	20	IDGD	
O=C(NNC(=O)c1ccn(-c2ccncc2)n1)c1ccc(S(=O)(=O)N2CCCC2)cc1	1320830822	OBAOJVMTVXMASI-UHFFFAOYSA-N	440.485	1.127	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)/C=C/c3cc(C)on3)C2)C1	1779132944	YSVBIPLFWNEGDN-WZYSVALVSA-N	426.311	2.000	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(O)no3)C2)C1	1779677992	VWTMGXNIOYKMOV-NPZXAABXSA-N	444.394	1.709	50	20	IDGD	
O=C(CC12CCCN1CCC2)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2	1780662975	ZDQKNPMMYGFGSE-SQGPQFPESA-N	427.973	1.119	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(OC)c(O)cc3[N+](=O)[O-])CCO2)C1	1781216919	CFWGXTSCXKJQMW-DJJJIMSYSA-N	441.868	1.770	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)/C=N/O[C@@H]3CCCCO3)CCO2)C1	1781229480	DPTBMJRMAOJJSS-MRZPIDLUSA-N	436.336	1.582	50	20	IDGD	
O=C(Cc1cccc([N+](=O)[O-])c1)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781324642	BHEDMOINGISWJK-NVXWUHKLSA-N	444.257	1.658	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](F)Br)C3)C2)ncc1[N+](=O)[O-]	1781329901	NFYKCPPUXBURRT-XJKSGUPXSA-N	445.245	1.432	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(OC(F)F)cc3)C2)C1	1781703303	BFFTYKNQBCXDQZ-BEFAXECRSA-N	432.851	1.985	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)CCCn3ccnc3)CCO2)C1	1783351864	BYNTUVNPPGIKBV-QAPCUYQASA-N	427.343	1.667	50	20	IDGD	
CC(=O)N[C@H](C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](C)Br)C2)C1)C(C)(C)C	1783530506	ZVHMJDCQMCWSDQ-WPKBUWHJSA-N	432.359	1.151	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc4nn(C)cc4c3)CCO2)C1	1783536282	ILUOHLSNQAIUEE-YJYMSZOUSA-N	435.322	1.800	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)c1cccnc1S	1783546603	BPXGXJYNHWALJH-XYJRDEOASA-N	432.315	1.654	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cc(CC(C)C)nn3C)CCO2)C1	1783874297	CNGACLBPHODHAF-OXJNMPFZSA-N	426.945	1.316	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(=O)ccn3C)C[C@@H]21	1783970595	XFLFDZSYKMRLQM-HPZZRFSDSA-N	440.338	1.010	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4c(c3)CNC4=O)C[C@@H]21	1784617755	MVHBZCRSBLKTCF-QZHFEQFPSA-N	433.936	1.931	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccnc(F)c3)[C@H]2C1	1784739984	ZWRZXOHJCCQOPL-AJNGGQMLSA-N	428.302	1.988	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@](C)(O)C(F)(F)F)[C@H]2C1	1784876002	OMYVXDXDYUCCHL-YMYJPDDMSA-N	435.270	1.516	50	20	IDGD	
CC(=O)N[C@H](Cc1cccc(F)c1)C(=O)N1CC[C@@]2(CN(C(=O)[C@H](F)Cl)CCO2)C1	1785454267	LTWUCUYUHPCHIR-UWVAXJGDSA-N	443.878	1.237	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3ccc(F)cn3)[C@H]2C1	1787035337	BHPXDLKAJVJBLE-STECZYCISA-N	442.329	1.916	50	20	IDGD	
C[C@H](CNC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]2C1	1787443751	SEYZEUXHSAUVTM-QTVXIADOSA-N	435.924	1.661	50	20	IDGD	
O=C(NC1(c2ccc(NC(=O)c3ccc(F)cn3)cc2)CCC1)c1cccc(B(O)O)c1	1787534399	WKODKIVUFPUKSM-UHFFFAOYSA-N	433.248	1.962	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc(O)cn3)C[C@@H]21	1789872471	GFDQNQSNFNGGOT-DLLGKBFGSA-N	430.332	1.546	50	20	IDGD	
Cc1nccnc1C(=O)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1	1789895235	CQPWVTFOFLZUNG-UHFFFAOYSA-N	430.273	1.526	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4ccccn4n3)C[C@@H]21)[C@H](F)Br	1789922319	CWFYMFVNJVUZKI-MZGVZZPPSA-N	439.285	1.618	50	20	IDGD	
C[C@@H](Nc1ccccn1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]2C1	1789926061	MCHKXUIRPBFKQG-BLDNINTCSA-N	443.317	1.552	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc4[nH]ncc4c3)C[C@@H]21	1791056348	UZPKTPJKGHXMIG-GVARAGBVSA-N	436.310	1.335	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(NC(C)=O)cc3)C[C@@H]21	1791256334	MDNWZTQMUROPDE-KANFNMMFSA-N	437.924	1.492	50	20	IDGD	
C[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(C)(C)CCl)N1CSCSC1	1792783361	VCWXVPTVUFMYRY-APIJFGDWSA-N	436.043	1.884	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c[nH]c3ncccc13)C2	1792867463	CDHWBMQOXBLTIE-NFFDBFGFSA-N	435.322	1.797	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1[nH]nc3ccncc13)C2	1792868091	PFNXIXJWJQLWIC-MCYUEQNJSA-N	436.310	1.192	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccn3ccnc3c1)C2	1792870857	LWNJTTNQEVRSNZ-FAYQHZLMSA-N	435.322	1.569	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(OC(F)F)cc1F)C2)[C@@H](O)CCl	1792981310	UEBIYFIRAQGAQV-OWLDWWDNSA-N	436.814	1.230	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C[C@@H]1OCCc2ccccc21)c1ccc(B(O)O)cc1	1793487494	AYBXSRVHYDOMPL-KGSLCBSSSA-N	448.328	1.322	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN1CCc2sccc2C1	1793896543	LPXNARTWEBCKCH-RCJHGTSTSA-N	425.982	1.713	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cccc(OC)n1	1793989611	FLTKVJVCGWGZBK-HRJSJKBJSA-N	440.338	1.396	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(OC(F)F)cn1)C2	1795112694	RYGMYVJGPBDKKC-QHBPRCKVSA-N	448.264	1.671	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H]2C[C@]21C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Cl	1796369550	YVFCOYSHJHMNGM-NMQXAITKSA-N	445.919	1.510	50	20	IDGD	
COc1cc(C#N)cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)c1	1798440068	YVVCZCPXWCFKFJ-BJWYYQGGSA-N	448.483	1.131	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2)c1cc([N+](=O)[O-])cc2c1OCC2	1798521034	VOMUTKBMAZIJIL-GNXNZQSNSA-N	444.271	1.537	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccccc1C(=O)OCCO)C2	1798626993	DPJPHNXLPZJHIJ-BJWYYQGGSA-N	448.592	1.939	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1=NN(c3ccccc3)C(=O)C1)C2	1799269552	IDOMHWBOHINBGJ-MVWRLGRASA-N	432.908	1.386	50	20	IDGD	
C[C@@H](S)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN(C)NC(=O)NCc1ccccc1	1799869462	PVMHCVMWXYIYLH-NRSFXHEJSA-N	433.578	1.289	50	20	IDGD	
CCCC(=O)N[C@H](C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](Br)CC	1800641868	KWMZTRIHRQQVPR-XYFZXANASA-N	432.359	1.054	50	20	IDGD	
Cn1c(=O)n(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)C(Cl)Cl)c2ccccc21	1802341987	LKQAUBWSGGIJJL-CLLJXQQHSA-N	425.316	1.782	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC2(CCCN(C(=O)c3cc(C4CC4)on3)C2)CC1	1805148897	JGCYDBPWRJPFIP-UHFFFAOYSA-N	431.537	1.770	50	20	IDGD	
CC(=O)OC[C@@H](OC(C)=O)C(=O)N1CCC2(CCCN(C(=O)C(C)(C)CCl)C2)CC1	1805262449	VPEPJPKENSIITC-QGZVFWFLSA-N	444.956	1.977	50	20	IDGD	
CC(C)=NO[C@H](C)C(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1808869471	RWOJYLDDROROPM-BLIXFSHQSA-N	446.552	1.261	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)c3cccc4nc[nH]c34)CC2)C1	1809966561	FACRLCSUNHNGPR-UHFFFAOYSA-N	446.316	1.401	50	20	IDGD	
C[C@](O)(CC(=O)O)CC(=O)N1CCCC[C@H]1c1cc(NC(=O)CCBr)n[nH]1	1816784228	ARGFOMMTEGIVIH-YVEFUNNKSA-N	445.314	1.803	50	20	IDGD	
C[C@@]1(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)CC1(F)F	1817480051	XMPVSHFJBYZVKN-BEFAXECRSA-N	432.236	1.441	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCBr)CC2	1820141343	UADCVPQZCCHOSK-NXEZZACHSA-N	429.340	1.531	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@H](O)CCl)CC2)c1cc(-c2ccccn2)[nH]n1	1820639324	HJNZIXYWFGEVDI-MEBBXXQBSA-N	446.920	1.754	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)Cn2ccccc2=O)[nH]n1)[C@H](F)Br	1820932911	VDDWYPJWEJCYSI-LRDDRELGSA-N	440.273	1.954	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)Cn2ccncc2=O)n[nH]1	1821659266	YLWQNYKYFAKBDS-DGCLKSJQSA-N	437.298	1.442	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](C)O)n[nH]1	1822175662	KWOSTPRWRXJWQS-BDJLRTHQSA-N	445.432	1.930	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)CNC(=S)NCC)sc2C1	1824492536	OZVSIUCFJMGJKS-GHMZBOCLSA-N	432.015	1.947	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(=O)n2O)CC1	1825494181	BZDZJIIPZWYXDV-HOTGVXAUSA-N	425.913	1.573	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H]2CCC(=O)N2)CC1	1826536918	JVHWTKPPYGRNNX-VNQPRFMTSA-N	428.371	1.916	50	20	IDGD	
Cc1nc(C)c(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)o1	1827057911	MYDQSWSBBNGYLJ-HXUWFJFHSA-N	439.321	1.518	50	20	IDGD	
C[C@]1(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2ccc(B(O)O)cc2)CC3)CC1(F)F	1828047757	UMRCVUSJXPITTR-KZULUSFZSA-N	435.261	1.094	50	20	IDGD	
O=C([C@H](O)CCl)N1CCC([C@H]2CCCCN2C(=O)/C=N/O[C@H]2CCCCO2)CC1	1828971009	AGEMTEBFWGLUBT-RESBBRTPSA-N	429.945	1.735	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2	1830543298	PGJBBKQWZOEPKP-HEHGZKQESA-N	425.751	1.491	50	20	IDGD	
C=CCOCCCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](Br)CC)C2)C1	1831413317	VHKKIOMAPLXIOG-APWZRJJASA-N	447.370	1.599	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)OC(=O)OCC)C2)C1	1831658607	XZLLVKHOXYKSQP-YZVOILCLSA-N	434.917	1.412	50	20	IDGD	
COc1cccc(CCC(=O)N2CCO[C@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)n1	1832826029	KQGLZDDNCRFGBJ-LJQANCHMSA-N	446.331	1.283	50	20	IDGD	
COc1cc(C)ccc1C(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)CCl)CC2)CC1	1833312992	PBZFVQCCDQKKOR-IBGZPJMESA-N	437.968	1.789	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(C)nc3)CCO2)C1	1833998684	NHODFEPZIPBOFU-LPHOPBHVSA-N	440.338	1.634	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)c3ncc[nH]3)CC2)CC1	1834029789	OQFSSZFXYVYUOM-ZDUSSCGKSA-N	426.359	1.626	50	20	IDGD	
Cc1ccc(OCC(=O)NC2CCN(C3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)cc1	1834535649	LOAYCINAZYYGEI-FQEVSTJZSA-N	437.968	1.545	50	20	IDGD	
Cc1nccn1CC(=O)N1CCC(N2CCC(NC(=O)CO[Si](C)(C)C)CC2)CC1	1835837353	IDTHWHMINFSPAA-UHFFFAOYSA-N	435.645	1.615	50	20	IDGD	
Cn1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)c2cccnc21	1837191218	JVEQFIQXHVCHFU-LJQANCHMSA-N	441.315	1.447	50	20	IDGD	
CN1C(=O)CC[C@H]1C(=O)N1CCC(OC2CCN(C(=O)CCBr)CC2)CC1	1837654434	MDVDXXFECLPDHO-INIZCTEOSA-N	444.370	1.391	50	20	IDGD	
C[C@H](Cc1ccncc1)C(=O)N1CCOC[C@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1837715638	BOEOVCDVZHMFCQ-GCJKJVERSA-N	449.624	1.568	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3[nH]nc4ccncc34)CC2)CC1	1838049419	XIDXBLUODIWNCR-QGZVFWFLSA-N	449.939	1.824	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cnc4[nH]ncc4c3)CC2)CC1	1838306095	DNVCGQQIZXRJCQ-GOSISDBHSA-N	449.939	1.824	50	20	IDGD	
COc1ccc2[nH]cc(C(=O)N3CCO[C@]4(COCCN(C(=O)[C@H](F)Cl)C4)C3)c2n1	1838487667	CSYNAOKDXCNMLR-QFBILLFUSA-N	440.859	1.176	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(O)cc3)CCO2)C1	1838971140	DHSZPLQLUCEREX-RTBURBONSA-N	431.316	1.699	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4cccnc4nc3O)C2)C1	1839148452	YNSXOFBBAKHRRS-KKSFZXQISA-N	448.907	1.423	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3C[C@]3(F)Cl)C2)C1	1839155061	HKRUNHFILPYITQ-VCOSZWKGSA-N	431.719	1.604	50	20	IDGD	
O=C(c1cccnc1S)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839197081	HPDYVZFAYFLAGJ-WBMJQRKESA-N	448.314	1.131	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccccc3C(N)=O)CCO2)C1	1839349508	YOIROOPLTGTLHR-NRFANRHFSA-N	437.924	1.121	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)CCO2)C1	1839354877	YHYVIXAWLNIFTG-VQIMIIECSA-N	443.859	1.821	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cc3cccnn3c1)CCO2	1839560625	AWFMBKKLAVZAJE-OAQYLSRUSA-N	446.580	1.256	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C1(C(=O)OCC)CC1)CCO2	1839760034	ZESSHGFHBBGQNL-BEFAXECRSA-N	430.929	1.194	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)C3=CCCS3)C2)C1	1839963041	YEJGEXYXGGBJTH-CXAGYDPISA-N	433.368	1.637	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccn(CC)n3)C2)C1	1839963526	NHEIZROXKAUZKB-RDTXWAMCSA-N	443.342	1.147	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840189568	YQHXLIVDWBBDHB-HXUWFJFHSA-N	440.327	1.971	50	20	IDGD	
COC1(CC(=O)N2CCO[C@]3(COCCN(C(=O)CCBr)C3)C2)CCC1	1840615039	PKPYQTXBMJQCQB-SFHVURJKSA-N	433.343	1.187	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)C3Cc4ccccc4C3)CCO2)C1	1840944383	DOCACZVSMAFKIY-KNQAVFIVSA-N	436.936	1.112	50	20	IDGD	
CCn1nccc1C(=O)N1CCCC12CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1842517099	BFRWCBVPAGSNLT-AWEZNQCLSA-N	439.944	1.852	50	20	IDGD	
Cc1cc(C)c(OCC(=O)N2CC3(CCCN3C(=O)c3cccc(B(O)O)c3)C2)c(C)c1	1843013071	FFZNDFFRFWYQJM-UHFFFAOYSA-N	436.317	1.188	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H](C(=O)N2CC3(CCCN3C(=O)[C@H](F)Cl)C2)[C@H]2OCC[C@H]21	1843366641	JJGRMRLKWMYCGD-YJNKXOJESA-N	445.919	1.749	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC2(CCCN2C(=O)C2CN(C(=O)OC(C)(C)C)C2)C1	1843842496	YQLWGOZSXIWYGD-GFCCVEGCSA-N	430.343	1.840	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2ncccc2C(F)(F)F)C1	1844530824	LLEDLFXRSWUDGK-UHFFFAOYSA-N	448.405	1.230	50	20	IDGD	
C[C@H](NC(=O)c1ccccn1)C(=O)N1CCCC12CN(C(=O)[C@](C)(Cl)CCl)C2	1845770438	WKTOHNVEWOHCLB-SCLBCKFNSA-N	427.332	1.640	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@H](Cc1cccc(F)c1)NC(C)=O)C2	1846365669	NMJBZDUDKBTBNX-QZTJIDSGSA-N	439.915	1.330	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](C(=O)N1CCCC12CN(C(=O)C(Cl)Cl)C2)C(C)(C)O	1847091955	HIOGDRGIWNFSSV-LLVKDONJSA-N	438.352	1.658	50	20	IDGD	
COC(=O)c1ccc(OCC(=O)N2CCCC23CN(C(=O)[C@H](F)Br)C3)cc1	1847148502	ZTDFEQCIAHLKKT-HNNXBMFYSA-N	443.269	1.746	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cnc2c(c1)CCNCC2	1847502226	NBBMDZBEGLUFTR-BVGQSLNGSA-N	435.366	1.616	50	20	IDGD	
Cc1cccc(N2C[C@H](C(=O)NNC(=O)c3csc(N4CCOCC4)n3)CC2=O)c1C	12801406	QGNROPNVPAFDJH-OAHLLOKOSA-N	443.529	1.411	50	20	IDGD	
CN(NC(=O)CCn1c(=O)oc2cc(S(=O)(=O)N3CCCC3)ccc21)c1ccccc1	15832545	JSHNLTIWHIDXDA-UHFFFAOYSA-N	444.513	1.937	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COc2cccc(C)c2)cc1S(=O)(=O)NC(C)C	15877078	QOLRAPPJHVWJNU-UHFFFAOYSA-N	435.502	1.530	50	20	IDGD	
C[C@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)NNC(=O)c2cc(Cl)ccc2O)C1=O	105545478	FEKCEBINCSBTAF-LJQANCHMSA-N	434.811	1.413	50	20	IDGD	
CC(C)NC(=O)Nc1cccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1	106117966	ZIQAVKWZNIOKMV-UHFFFAOYSA-N	447.517	1.542	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NCCc1ccc(Br)s1	725873143	KTWRCVDXNHOPLH-UHFFFAOYSA-N	431.337	1.875	50	20	IDGD	
O=C(CN1CCC(C(=O)Nc2ccc(F)cc2)CC1)NNC(=O)c1cccc([N+](=O)[O-])c1	726185767	XSRLSTHFZRBNRF-UHFFFAOYSA-N	443.435	1.846	50	20	IDGD	
COc1ccc(-c2nn(CCC#N)cc2/C=C(/C#N)C(=O)N[C@H]2CC(=O)N(C)C2)cc1OC	726537033	IVPGYNUJMOWQJY-VUZIPCMWSA-N	448.483	1.735	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(N3CCCC3)nc2)cc1OC	727210448	PJAHTBOCTBIJLP-UHFFFAOYSA-N	428.445	1.317	50	20	IDGD	
O=C(NCCCc1nc2c(s1)CCCC2)NNC(=O)c1ccc(-n2cnnn2)cc1	727231048	ZPEJFHIJTVONIR-UHFFFAOYSA-N	426.506	1.574	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)NCC(=O)N(C)CCc2ccccn2)c1	727607871	JQTCVGGNSNEZNO-UHFFFAOYSA-N	441.532	1.924	50	20	IDGD	
CC/C=C(\C)C(=O)N1CSC[C@H]1C(=O)NNC(=O)c1nn(CC)c(=O)c2ccccc12	728018981	ZBKDGDMQMDHBNO-OIQJVACTSA-N	443.529	1.435	50	20	IDGD	
Cc1c(C(=O)N([C@@H]2CCS(=O)(=O)C2)N(C)C)sc2nc3n(c(=O)c12)CCCCC3	728180138	PFRJCXSYVNDYEN-CYBMUJFWSA-N	438.575	1.599	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)NCc1ccc(S(=O)(=O)N2CCCCC2)cc1	728942046	IPHGNFVMAUBOQM-UHFFFAOYSA-N	431.518	1.329	50	20	IDGD	
NS(=O)(=O)c1ccc(CCC(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)cc1	728974288	LOWPVWBPJRGMQP-UHFFFAOYSA-N	433.458	1.406	50	20	IDGD	
C[C@H]1CCCCN1CCOc1ccccc1C(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1	731186534	OTZCBQHHXVYYCE-JKSUJKDBSA-N	438.550	1.071	50	20	IDGD	
Cc1c(/C=C(\C#N)C(=O)N2CCN(CC(=O)N[C@@H]3CCC[C@H](C)C3)CC2)cc(C#N)n1C	731198682	JOKWQPYMNZVOKA-HAUBNOCLSA-N	436.560	1.951	50	20	IDGD	
CC[C@H](N=c1nn[nH]n1-c1ccccc1)C(=O)NNC(=O)c1cc(-c2ccccc2)on1	731471065	QIRQHCBVTBUYSF-INIZCTEOSA-N	432.444	1.391	50	20	IDGD	
COc1ccc(CN([C@@H](C)C(=O)NNC(=O)CC(C)C)[C@@H]2CCS(=O)(=O)C2)cc1	731848713	MAGZYQVECSMIRR-DOTOQJQBSA-N	425.551	1.266	50	20	IDGD	
CCCc1ccc(S(=O)(=O)N2CCN([C@@H](C)C(=O)NNC(=O)CC(C)C)CC2)cc1	732196627	DPBDIFTZAHQBPD-KRWDZBQOSA-N	438.594	1.527	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)c2ccn(S(=O)(=O)c3ccc(C)cc3)c2)c1O	732276331	HRDNDAXVYLEDDF-UHFFFAOYSA-N	429.454	1.823	50	20	IDGD	
CCCNC(=O)CCCC(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	732750333	MSCPGVBCHJFAAK-UHFFFAOYSA-N	449.511	1.902	50	20	IDGD	
C[C@H](Oc1ccccc1Br)C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	732751450	PSDOZZGKUWFLKA-NSHDSACASA-N	431.250	1.653	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)N[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1C	734218518	VNWUFIBQJDEVIG-MRXNPFEDSA-N	433.509	1.972	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@@H]2CCC[C@H](C(=O)N(C)C)C2)c2ccccc2c1=O	734222785	WNPNLQRWAMXJPY-UONOGXRCSA-N	428.493	1.007	50	20	IDGD	
Cc1cc(NNC(=O)CCn2c(=O)oc3cc(S(=O)(=O)N4CCCC4)ccc32)ncn1	734254564	QGKCNICYHKZWIO-UHFFFAOYSA-N	446.489	1.011	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)N(C)CC(=O)NNc2cc(F)c(F)cc2F)cc1	734553483	NWVQWABWWPSVNR-UHFFFAOYSA-N	430.408	1.826	50	20	IDGD	
O=C(NNC(=O)c1ccccc1F)NC1CCN(S(=O)(=O)Cc2ccccc2)CC1	735583824	GQYNUVNYNRDABO-UHFFFAOYSA-N	434.493	1.764	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)c1cc(N2CCCC2=O)cc(C(F)(F)F)c1	740851022	LYJILRFWBIFRIP-UHFFFAOYSA-N	428.411	1.898	50	20	IDGD	
Cc1c(C(=O)NNC(=O)NCc2cccc(C(F)(F)F)c2)cnn1-c1ccc(O)nn1	742453435	IWCMKDVFVOINCS-UHFFFAOYSA-N	435.366	1.839	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(Br)c(F)c1)[C@@H]1COc2ccccc2O1	743252271	UERIVIJMYKKQTN-AWEZNQCLSA-N	431.239	1.738	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NCC2(N3CCCC3)CCOCC2)cc1	743623044	USJRRVBBMXEIDL-UHFFFAOYSA-N	439.538	1.071	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)Cc2ccc(NC(=O)C3CC3)cc2)cc1	743830650	JFMWKIQRPCDIMC-UHFFFAOYSA-N	430.486	1.834	50	20	IDGD	
COc1cccc(OC)c1OC1CCN(CC(=O)NNC(=O)c2cccc(C#N)c2)CC1	744386503	GTJLUJFWXZLBIG-UHFFFAOYSA-N	438.484	1.880	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CN2CCN([C@@H]3CCN(c4ccccc4)C3=O)CC2)c1	744399889	YWLQESJPLOLZLU-OAQYLSRUSA-N	435.528	1.179	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)c2ccc(CNC(=O)C3CCCC3)cc2)c1	744944857	HOGZCOVDLUMXPR-UHFFFAOYSA-N	448.479	1.983	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2nn(-c3ccc(F)cc3)nc2C)n1	745469704	XIUYYGLSEZQDJV-UHFFFAOYSA-N	432.437	1.027	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1)c1cnn(C)c1	745839171	OGZVJQWVMUSUNS-HNNXBMFYSA-N	445.487	1.827	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)N[C@@H]3CC[C@@H]4CCC[C@@H]4C3)nc2)CC1	745875403	GERGSQVTECVIJZ-GVDBMIGSSA-N	436.582	1.613	50	20	IDGD	
CN(C)C(=O)NNC(=O)CN1C(=O)/C(=C\c2ccc(Br)cc2)SC1=S	746005952	FIYXPDOHNFDGCD-YRNVUSSQSA-N	443.348	1.953	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)CCN1CCN(c2ccccn2)CC1	746095803	CQNVDHFCQZYEGQ-UHFFFAOYSA-N	435.532	1.353	50	20	IDGD	
Cc1ccc(C(=O)NNc2oc(C(C)C)nc2C#N)cc1S(=O)(=O)N1CCOCC1	746526074	XCLHGOJXKXFUNZ-UHFFFAOYSA-N	433.490	1.756	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)c1ccc(Cl)c(S(=O)(=O)N2CCCCC2)c1	747323041	HUSDOPHTHPRQNU-UHFFFAOYSA-N	436.921	1.913	50	20	IDGD	
O=C(NNC(=O)C(=O)N1CCCC1)N[C@H](Cn1cnc2ccccc21)c1ccc(F)cc1	748454412	SVHVZJCFUHWEJT-GOSISDBHSA-N	438.463	1.870	50	20	IDGD	
COc1cc(OC)cc(N2CC[C@H](NC(=O)NNC(=O)c3cc([N+](=O)[O-])ccc3O)C2)c1	748661815	NNMYQMRYLZVCDU-LBPRGKRZSA-N	445.432	1.541	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CN2CCCN(C(=O)Cc3cccc(F)c3)CC2)cc1	748833797	AOPJJUFTQULDIE-UHFFFAOYSA-N	426.492	1.672	50	20	IDGD	
O=C(NCc1ccc(OCC2CC2)nc1)NNC(=O)c1csc(N2CCOCC2)n1	749187441	KPONWUGLYZCVNL-UHFFFAOYSA-N	432.506	1.308	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@@H]2CCCN2C(=O)c2ccc3c(c2)OCO3)cc1OC	749467941	AZGCDXBJVKKZEF-HNNXBMFYSA-N	441.440	1.498	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2cn(-c3cccc(C)c3)nn2)c2ccccc2c1=O	751055902	VHZSRTXPRLBSJA-UHFFFAOYSA-N	431.456	1.770	50	20	IDGD	
CCn1c(NNC(=O)CSc2ccc(C(N)=O)cc2[N+](=O)[O-])nc2ccccc2c1=O	751883614	OSKVYZIFKYGIJK-UHFFFAOYSA-N	442.457	1.659	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CCNS(=O)(=O)c2ccc(Br)cc2)o1	752524306	CFJGEQSEPRUKCU-UHFFFAOYSA-N	430.280	1.480	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CNC(=O)[C@@H]2c3ccccc3C(=O)N2Cc2ccccc2)o1	752779796	SIXZVVJGOMVVJG-NRFANRHFSA-N	446.463	1.863	50	20	IDGD	
N#CCCn1cc(/C=C(/C#N)C(=O)NCCCn2cc(CO)nn2)c(-c2ccccc2)n1	753012454	VZYGKXIYCBTZQM-PDGQHHTCSA-N	430.472	1.661	50	20	IDGD	
CCc1cc(Br)ccc1NNC(=O)CCc1nc2c(O)nc(=O)n(C)c2[nH]1	753173796	NLJHRXZLSSBYLQ-UHFFFAOYSA-N	435.282	1.763	50	20	IDGD	
O=C(NNC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1)c1ccc2nn[nH]c2n1	753768659	FRJAKVBHBUPCHO-UHFFFAOYSA-N	425.412	1.675	50	20	IDGD	
Cc1cc(C)c(S(=O)(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1[N+](=O)[O-]	755006067	RSPZBUJCBDBCEE-UHFFFAOYSA-N	441.491	1.128	50	20	IDGD	
CCCC[C@@H](NC(=O)[C@@H](C)NC(=O)C(C)(C)C)C(=O)NNC(=O)c1ccc(C#N)cc1	755252572	BYKSBVBRPCSKPZ-RHSMWYFYSA-N	429.521	1.545	50	20	IDGD	
Cc1nccc(NCc2cccc(C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)c2)n1	755340750	FHSQBAHUGIDDRW-UHFFFAOYSA-N	443.508	1.866	50	20	IDGD	
CN1CCN(C(=O)c2ccccc2NC(=O)NNC(=O)c2nnc(O)c3ccccc23)CC1	755622303	GCUDEIGXCHSGJO-UHFFFAOYSA-N	449.471	1.190	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)Nc1ccc(S(=O)(=O)NCCOC)cc1)c1ccccc1	756782691	CYFFCHCHUUJVCK-GOSISDBHSA-N	434.518	1.958	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Nc2ccc3c(c2)N(C)C(=O)CO3)cc(OC)c1OC	756819007	RTAUDOAOQKWLAO-UHFFFAOYSA-N	430.417	1.534	50	20	IDGD	
Cc1cc(C(=O)NNc2ccc(C(N)=O)nn2)cc(C)c1OCC(=O)N1CCCCC1	757398582	KCRCFZBHHGLPPB-UHFFFAOYSA-N	426.477	1.341	50	20	IDGD	
Cc1nn(-c2cccc(C(F)(F)F)c2)c(C)c1C(=O)C(=O)NNc1ccc(C(N)=O)nn1	757403855	GUYURLCTEVBIPF-UHFFFAOYSA-N	447.377	1.723	50	20	IDGD	
CS(=O)(=O)Cc1ccc(NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1F	757677027	WMZOZCHYCXMPKK-UHFFFAOYSA-N	443.478	1.240	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)N[C@H]2CN(C(=O)OC(C)(C)C)C[C@@H]2C#N)c1	758774401	HIMCEKPEUZZDHN-HOTGVXAUSA-N	431.493	1.772	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccc(F)cc2)c1-n1cccc1)C(=O)Nc1ccccn1	758832105	SUFAMDWOJMGSLH-UHFFFAOYSA-N	433.403	1.597	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)NC[C@]3(Cc4ccc(F)cc4)CCC[C@H]3O)nc21	759650048	OBCZMQBVUAJTRF-FOIQADDNSA-N	429.456	1.608	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)N=c2cc[nH]cc2I)c1	760024120	HFWOXJPKQJTIJG-UHFFFAOYSA-N	442.213	1.592	50	20	IDGD	
CC1(C)C(=O)N(C[C@](C)(O)C(=O)NNC(=O)c2nnc(O)c3ccccc23)c2ccccc21	760065511	GXNJLYUOADEOFB-QHCPKHFHSA-N	449.467	1.172	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)CNC(=O)c1c(Cl)cccc1[N+](=O)[O-]	760432596	LHVYSDOESGJCAM-UHFFFAOYSA-N	443.844	1.040	50	20	IDGD	
COC(=O)C12CCC(C(=O)NN(C)C(=O)N3CCN(C(=O)OC(C)(C)C)CC3)(CC1)C2	760503764	FGIXMTUTPYTXKU-UHFFFAOYSA-N	438.525	1.746	50	20	IDGD	
CCC(=O)N1CC[C@@H](NC(=O)NNC(=O)[C@H]2Cc3ccccc3CN2Cc2ccccc2)C1	762381691	DAGYSWYRXIJQMY-FGZHOGPDSA-N	449.555	1.955	50	20	IDGD	
O=C(NNC(=O)c1ccncc1)C(=O)Nc1ccc(=O)n(Cc2ccccc2Cl)c1	763464190	MJAGCEDBJHITQR-UHFFFAOYSA-N	425.832	1.345	50	20	IDGD	
CC(C)OC(=O)c1c(NC(=O)C(=O)NNC(=O)c2ccncc2)sc2c1CCCC2	763465134	SWJAUGLIJUVHRI-UHFFFAOYSA-N	430.486	1.987	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)C(=O)Nc2cc(C)n(CCC#N)n2)c1	763595694	BMUMUCBYCFQCFX-UHFFFAOYSA-N	426.477	1.702	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(C(N)=O)cc2F)c(C)n1-c1ccccc1	763602095	NHAKJKHXYWJPJY-UHFFFAOYSA-N	437.431	1.732	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1cc(Cl)ccc1C(=O)N(C)C	763628434	KJBWQYXXZHRNLS-UHFFFAOYSA-N	442.863	1.398	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(C(=O)NC(C)(C)C)cc2)cc1C	763666556	JFRUEVOPVDBLJC-UHFFFAOYSA-N	440.500	1.997	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(Cl)c(NC(C)=O)c1	763680484	GBMLQIVXOAQGPS-UHFFFAOYSA-N	448.863	1.862	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(Br)nc2C)cc1C	763681456	XKWVAXVCPVKUPI-UHFFFAOYSA-N	435.278	1.934	50	20	IDGD	
CC(C)c1cc(NC(=O)C(=O)NNC(=O)COc2ccc(Br)cc2)no1	763693833	BNGQUIXEVWTMKO-UHFFFAOYSA-N	425.239	1.725	50	20	IDGD	
O=C(COC(=O)c1ccc([N+](=O)[O-])c(Cl)c1)NNC(=O)[C@@H]1COc2ccccc2O1	763720660	YOJJDSKDSHBZBS-HNNXBMFYSA-N	435.776	1.392	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)[C@@H]3C[C@@]34CCOC4)c2)cc1	763731628	BGNSLQCGMZUJBX-GHTZIAJQSA-N	445.497	1.684	50	20	IDGD	
COC(=O)C(C)(C)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(OC)cc(OC)c2)cc1	763772567	NBMHZGHURHVMMN-UHFFFAOYSA-N	443.456	1.554	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccnc1Oc1ccccc1	763807503	CPERCZRECBYKNM-UHFFFAOYSA-N	431.408	1.910	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)C(=O)Nc2nc(C)cs2)c2ccccc2c1=O	763821148	SDVSPMHJXBELKT-UHFFFAOYSA-N	442.501	1.751	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(C(N)=O)c(Cl)c2)c1C	763854375	PRKHEFDUENUZFK-LBPRGKRZSA-N	432.864	1.609	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccnn1Cc1ccccc1	763864569	KTSYOUJFGBPQLW-AWEZNQCLSA-N	425.420	1.624	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)C(=O)N(C)CC2	763870711	BTDMCXLNFXBFSA-GFCCVEGCSA-N	428.420	1.007	50	20	IDGD	
CC(C)Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc(Br)s2)n(C)n1	763942406	ZBIZCUOZCYGIPN-UHFFFAOYSA-N	428.312	1.842	50	20	IDGD	
CC(C)N(C)c1cccc(NC(=O)C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)c1	763945440	XZNHXAKSEMGFQB-UHFFFAOYSA-N	436.472	1.822	50	20	IDGD	
O=C(NNC(=O)c1cc(Cl)ccc1O)C(=O)Nc1ccnc(OCC(F)(F)F)c1	763974465	QLXTVEIVYFIGLA-UHFFFAOYSA-N	432.742	1.781	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)C(=O)Nc1ccnn1Cc1cccc(Cl)c1Cl	763996321	PRRMMWLTQFRUAT-UHFFFAOYSA-N	435.271	1.976	50	20	IDGD	
Cc1cc(Br)ccc1NC(=O)C(=O)NNC(=O)c1ccc2c(c1)OCCO2	764005942	GNQGDYFKNSIYQT-UHFFFAOYSA-N	434.246	1.928	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)nc2)c(Br)c1	764099538	BBFFALUZIUHQGX-UHFFFAOYSA-N	427.642	1.906	50	20	IDGD	
O=C(CC(F)(F)F)NNC(=O)C(=O)Nc1cc(C(F)(F)F)ccc1N1CCOCC1	764116044	IWLJLNFSPGFPHX-UHFFFAOYSA-N	442.316	1.580	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1O)C(=O)Nc1ccc(OCC(F)(F)F)nc1	764117216	OLEGPGNEAAUDJF-UHFFFAOYSA-N	432.742	1.781	50	20	IDGD	
Cn1cnnc1-c1cccc(NC(=O)C(=O)NNC(=O)c2cccc(OC(F)F)c2)c1	764260339	VLTDUHVKVSOZNG-UHFFFAOYSA-N	430.371	1.483	50	20	IDGD	
Cc1ccc(C(=O)NCC(F)(F)F)cc1NC(=O)C(=O)NNC(=O)Cc1ccccn1	764265038	XXQWKRCVNGRGEK-UHFFFAOYSA-N	437.378	1.011	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)C(=O)Nc1cc(Cl)ccc1C(=O)N1CCCC1	764355618	FQODREYGZLLSHL-UHFFFAOYSA-N	429.864	1.300	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2cc(C)nn2C(C)(C)C)n[nH]1	764377921	SNMBQZZEHUNXHX-UHFFFAOYSA-N	439.476	1.745	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)[C@@H]2CN(C(=O)OC(C)(C)C)CCO2)cc1	764560637	XTZCMQFSUUJFID-PBHICJAKSA-N	437.493	1.636	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)c1cnc2[nH]cnc2c1	764753322	VWCPFLQAYJDLOP-UHFFFAOYSA-N	427.896	1.190	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3cc(-n4cccn4)ccn3)n[nH]2)cc1OC	765596761	LLRNRWLSZPZWDH-UHFFFAOYSA-N	433.428	1.749	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)CCc3c(C)nn(C)c3C)CC2)cc1	765753919	DPDHNVDOHRPQLN-UHFFFAOYSA-N	426.565	1.243	50	20	IDGD	
COC(=O)NNC(=O)c1cc(S(=O)(=O)NCc2cccnc2)c(Cl)cc1Cl	765855773	GJOBGATZNNQNEY-UHFFFAOYSA-N	433.273	1.868	50	20	IDGD	
Cc1noc(C)c1S(=O)(=O)N1CCC(C(=O)NNc2ncnc3ccsc23)CC1	766674878	BKSQDCNQZPOSLD-UHFFFAOYSA-N	436.519	1.840	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)C(=O)Nc1cnn(C(F)F)c1	768234708	YRYJYKVPTCXNFS-UHFFFAOYSA-N	432.181	1.206	50	20	IDGD	
Cc1cccc(-c2nnc(SCC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)n2N)c1	768448584	KRPQBQZBGQVINV-UHFFFAOYSA-N	427.446	1.429	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C[C@@H](C)S(=O)(=O)c1ccc(F)cc1	768634863	QXYDZJNVCFCLEG-GFCCVEGCSA-N	444.506	1.933	50	20	IDGD	
CNc1nc(C(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)cs1	769470836	PAKRXNDHJZPXDT-UHFFFAOYSA-N	445.526	1.738	50	20	IDGD	
CS(=O)(=O)c1ccc(C(=O)NNC(=S)Nc2ccccn2)cc1Br	769748720	KGGPNKHFMIMNBN-UHFFFAOYSA-N	429.321	1.879	50	20	IDGD	
CSCCNC(=S)NNC(=O)c1ccc(C)c(S(=O)(=O)NC2CCCC2)c1	769765920	OUEHRBFPIXDDQS-UHFFFAOYSA-N	430.621	1.688	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)N[C@@H]3CCCN(c4ccccc4Cl)C3=O)nc21	770399075	DKMMOSHCUHHOTI-GFCCVEGCSA-N	430.856	1.544	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccccc1Cl)NNC(=O)c1ccc2c(c1)OCCO2	770428592	XLICWRMHAQFFGE-UHFFFAOYSA-N	439.877	1.241	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)COc1ccccc1Cc1ccccc1)[C@H]1CN(C)CCO1	770434920	IQPZBJGRFCISFU-DYESRHJHSA-N	426.517	1.706	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)c3cccc(N4CCCS4(=O)=O)c3)nc21	770969106	RVJQWNCUMOUSIG-UHFFFAOYSA-N	445.505	1.584	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)[C@@H]3CC(=O)N(Cc4cccc(C(F)(F)F)c4)C3)nc21	770972291	HAHYQFHKIITXNC-LLVKDONJSA-N	449.393	1.580	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)[C@H]3CCN(c4ccc(Cl)c(Cl)c4)C3=O)nc21	770985098	YSAGVYNBOIJDPX-SECBINFHSA-N	436.259	1.872	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1nn(-c2ccc(F)cc2)cc1Br	772135328	BVILFGQMEZFYQS-VIFPVBQESA-N	427.230	1.877	50	20	IDGD	
COC(=O)Cn1cc(C(C)=NNC(=O)c2sc(-c3ccc(OC)cc3)cc2N)nn1	772840311	FYVAYGMAAXDMRN-UHFFFAOYSA-N	428.474	1.924	50	20	IDGD	
Cc1nc(-c2ncccn2)nc(O)c1CC(=O)NNC(=O)[C@@H](C)Oc1cccc(Cl)c1	772993512	CBWJXUHBZGOIPP-GFCCVEGCSA-N	442.863	1.758	50	20	IDGD	
COC(=O)c1c(F)cccc1NNC(=O)[C@@H]1CC(=O)N(c2ccc3c(c2)OCCO3)C1	773625300	HLRHEAPTXNMGRK-GFCCVEGCSA-N	429.404	1.880	50	20	IDGD	
O=C(NNc1cc(F)c(F)c(F)c1)C(=O)Nc1cnn(Cc2nnc3n2CCCC3)c1	773693119	RKVKCWGWADMZCB-UHFFFAOYSA-N	434.382	1.358	50	20	IDGD	
COc1ccc(CN(C)C)cc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1cccc(Cl)c1	774007349	GFQPXZRUYNBMNP-ZDUSSCGKSA-N	448.907	1.964	50	20	IDGD	
CN(C(=O)OC(C)(C)C)[C@@H](C(=O)NNc1nc(-c2ccncc2)no1)c1cnn(C)c1	776343383	DODSSMYQKMALRF-CQSZACIVSA-N	428.453	1.916	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)[C@H]2CCN(c3ccc4c(c3)OCCO4)C2=O)c1	776534806	WXHPNOHTNSLUPS-MRXNPFEDSA-N	431.470	1.358	50	20	IDGD	
CC(C)N1C(=O)C[C@H](C(=O)NNC(=O)N2CCOCC2)[C@H]1c1ccc(Cl)c(F)c1	776704633	DIKGLSGPGILRMD-SUMWQHHRSA-N	426.876	1.850	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)[C@@H](Cc2cccc(OC)c2)n2nnnc2C)nc1C	778422184	LMFQLCAKIGCKNM-QGZVFWFLSA-N	440.464	1.192	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)nc1C	778429364	REPVTJQDRCQBFU-UHFFFAOYSA-N	447.517	1.893	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(/C#N)C(=O)NNC(=O)CNC(=O)OC(C)(C)C)c1C	778437212	ZETLZQUXTPWBIB-DUPVFGOHSA-N	433.509	1.891	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)Nc1ccnn1Cc1ccc(F)cc1	779456304	JNJSFSBCKQSOPE-UHFFFAOYSA-N	438.467	1.930	50	20	IDGD	
CC(C)(C)OC(=O)N1CC=C(CNC(=O)NNC(=O)COc2ccc(C#N)cc2)CC1	779679904	HIRIBMIBMVLTHR-UHFFFAOYSA-N	429.477	1.835	50	20	IDGD	
CCOC(=O)COc1c(Br)cc(C)cc1C=NNC(=O)C(=O)NC(C)C	781588294	SMWLXZJNTUBVQA-UHFFFAOYSA-N	428.283	1.674	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2ccc(O)cc2)cccc1C(=O)N1CCSCC1	782832942	AQSNFVNMKJFTOT-UHFFFAOYSA-N	442.497	1.289	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C(=O)Nc2ccccc2SCCC#N)nc2ccccc21	782887356	UDKSXOHIBQDPFZ-UHFFFAOYSA-N	436.497	1.908	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)cc1OC(F)F	782893354	ILIPTDAVHDQYNG-UHFFFAOYSA-N	431.399	1.812	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2ccc3c(ccn3CCN3CCOCC3)c2)nc(C)n1	783324436	LWSOXOBIANSNHZ-UHFFFAOYSA-N	437.504	1.462	50	20	IDGD	
COc1ccc(S(=O)(=O)NC2CC2)cc1NC(=O)C(=O)NNc1cc(C)ccc1C	783362042	JOTPQRVPROORTF-UHFFFAOYSA-N	432.502	1.835	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2c(C)nn(CC(C)C)c2C)cc(OC)c1OC	783805202	QSQUPOGPGKUEPA-UHFFFAOYSA-N	440.522	1.805	50	20	IDGD	
O=C(NNc1ccccc1)C(=O)Nc1ccc(Cl)c(S(=O)(=O)N2CCOCC2)c1	784764971	JDUKTLJWHBSJCK-UHFFFAOYSA-N	438.893	1.443	50	20	IDGD	
COc1ccc(Cn2ncc(C)c2NC(=O)C(=O)NNc2nccnc2Cl)cc1OC	784777768	KMEHLECOCNZXQA-UHFFFAOYSA-N	445.867	1.782	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)C(=O)Nc2ccnn2CCc2ccccc2)c1	784839691	OECZOHOHNDQRTD-UHFFFAOYSA-N	427.486	1.611	50	20	IDGD	
COC(=O)c1c(NC(=O)C(=O)NNc2cccc(S(C)(=O)=O)c2)sc(C)c1C	784846062	JWARCSKCRWDTEE-UHFFFAOYSA-N	425.488	1.637	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccc(Cl)nc2)cc1	784871569	PBDNDKGDPJXVER-UHFFFAOYSA-N	425.898	1.847	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)c(OC)n1	785099340	FHKOLEODCSHARA-UHFFFAOYSA-N	435.387	1.351	50	20	IDGD	
COc1cc(C(=O)NNC(=O)N[C@@H]2CCCN(C3CCCCC3)C2=O)cc(OC)c1OC	785565259	WBDCPYAJFLXASK-MRXNPFEDSA-N	448.520	1.980	50	20	IDGD	
O=C(COC(=O)CCCOc1ccc2c(c1)NC(=O)CC2)NNC(=O)c1ccccc1	787185334	QXNMAVHLNQDYPT-UHFFFAOYSA-N	425.441	1.735	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(Cl)cc2-n2cccn2)c1	788331591	SQYFNLRRIMBMQC-UHFFFAOYSA-N	426.864	1.991	50	20	IDGD	
O=C(CC(F)(F)F)NNC(=O)NC[C@H](Cc1cccc(F)c1)C(=O)N1CCOCC1	789313837	QGNXRLSPCPSHTF-ZDUSSCGKSA-N	434.390	1.126	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)C(=O)Nc1nc2c(s1)CCCCC2	789731182	DSOZEGGNEJEAEY-UHFFFAOYSA-N	426.296	1.902	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C(=O)Nc2nc(CC(C)(C)C)cs2)nc2ccccc21	789749393	NZYNNKWOFNEPGT-UHFFFAOYSA-N	428.518	1.947	50	20	IDGD	
O=C(NNC(=O)[C@H]1OCC[C@H]1c1ccccc1)C(=O)Nc1cnc(-c2ccccc2)nc1	789810471	NXPAAIITYWPEKG-OALUTQOASA-N	431.452	1.802	50	20	IDGD	
CN1C(=O)C[C@@H](C(=O)NNC(=O)C(=O)N2CCCC2)[C@H]1c1ccc(Cl)c(Cl)c1	790551224	XPTWFFXHGZGNMN-IAQYHMDHSA-N	427.288	1.283	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(Br)c(C(=O)NNc2ncccc2C)c1	791218961	GWQGOZGWWSWCTC-UHFFFAOYSA-N	443.323	1.834	50	20	IDGD	
CN(C)N(C(=O)c1nn(-c2cc(Cl)ccc2[N+](=O)[O-])cc1O)[C@H]1CCS(=O)(=O)C1	792856425	YJMQYYWAJQCJPV-NSHDSACASA-N	443.869	1.245	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@@H](OC(C)C)c2ccccc2)cc1	794181748	AJHUOKXFMCJLRY-FQEVSTJZSA-N	433.530	1.929	50	20	IDGD	
Cn1cc(C(=O)CCC(=O)NNc2ccc(S(=O)(=O)Nc3nccs3)cc2)cn1	795158708	LZROQSPQELCZBI-UHFFFAOYSA-N	434.503	1.784	50	20	IDGD	
O=C(COC(=O)CCc1cnc2ccccc2c1)NNC(=O)[C@H]1COc2ccccc2O1	795803743	DDTRBVHYFXAMQL-HXUWFJFHSA-N	435.436	1.698	50	20	IDGD	
NS(=O)(=O)c1ccc(C(=O)NNc2ncnc3ccsc23)cc1Br	798333877	ZSQQUEXOTWFVHM-UHFFFAOYSA-N	428.293	1.858	50	20	IDGD	
Cc1ccc(-c2ccnn2C)cc1NC(=O)C(=O)NNC(=O)Cc1nc2ccccc2n1C	799260732	WVRYJMMPRQJZNJ-UHFFFAOYSA-N	445.483	1.611	50	20	IDGD	
O=C(CCc1ccccc1)NNC(=O)NCCNS(=O)(=O)c1ccc(Cl)cc1F	799668602	JIEYWOZZVWAGQD-UHFFFAOYSA-N	442.900	1.721	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)NCCNS(=O)(=O)c2ccc(Cl)cc2F)cc(C#N)n1C	799740814	DPFQOTVOWXDKLP-AUWJEWJLSA-N	449.895	1.999	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(OC(F)(F)F)c(C#N)c2)c1	799834564	PJFNIXNIYYVORA-UHFFFAOYSA-N	435.362	1.923	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)c2ccc(S(=O)(=O)N(C)C)cc2)cc1	801105522	GJGQVYFSBBYWRL-CQSZACIVSA-N	432.502	1.135	50	20	IDGD	
COc1ccc(Cn2cc(C(=O)NNC(=O)C(=O)Nc3ccc(C)cc3)cn2)cc1OC	801106282	SYPYKCUVQPSKEQ-UHFFFAOYSA-N	437.456	1.657	50	20	IDGD	
COc1ccc(-n2cc(O)c(C(=O)OCC(=O)NNC(=O)c3ccc(C#N)cc3)n2)cc1	801363298	WJCSSACVSHUMGE-UHFFFAOYSA-N	435.396	1.076	50	20	IDGD	
COc1ccc([C@]2(C)NC(=O)N(CC(=O)NNC(=O)Nc3cc(F)cc(F)c3)C2=O)cc1	802006884	RVJBPGNBCPHIQV-FQEVSTJZSA-N	447.398	1.593	50	20	IDGD	
O=C(NNC(=O)c1ccc(N2C(=O)CCC2=O)c([N+](=O)[O-])c1)Nc1ccc2c(c1)OCO2	802095535	IUPCMIIFJBDXQK-UHFFFAOYSA-N	441.356	1.443	50	20	IDGD	
O=C(NNC(=O)c1cccc(Br)c1)C(=O)Nc1ccc(OC(F)F)nc1	802567359	UBNRMUPKNBKZHG-UHFFFAOYSA-N	429.177	1.845	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)N[C@@H]1CC(=O)N(c2ccc(Cl)c(F)c2)C1	805248686	JTZNPDKQNMUVKX-LLVKDONJSA-N	430.831	1.886	50	20	IDGD	
CNC(=O)c1cccc(NC(=O)NNC(=O)COc2ccccc2O)c1Br	806734479	JYJIQOFITLQCRB-UHFFFAOYSA-N	437.250	1.746	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)CNC(=O)c2ccco2)c(F)cc1Br	807004688	RKIQFWCXTHUOER-UHFFFAOYSA-N	441.213	1.006	50	20	IDGD	
O=C(NNc1ccc2c(=O)[nH]ccc2c1)C(=O)Nc1cc(F)c(N2CCOCC2)cc1F	807080430	VIQDPBAPRPJZRC-UHFFFAOYSA-N	443.410	1.725	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cncc(C(F)(F)F)c3)CC2)cc1	808408295	NIOIEAQHYVIKNV-UHFFFAOYSA-N	435.450	1.988	50	20	IDGD	
Cn1nc(C(=O)NN=C2CCCc3ccc(S(N)(=O)=O)cc32)c2ccccc2c1=O	811632859	FEGASUSCKICQCW-UHFFFAOYSA-N	425.470	1.051	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)c2ccc(=O)n(-c3ccc(F)cc3)n2)cc1	812729909	WCTVUPSKQBPQBR-UHFFFAOYSA-N	431.449	1.379	50	20	IDGD	
CC(=NNC(=O)c1cc(-c2ccc(C)cc2)[nH]n1)c1ccc(S(=O)(=O)CC(N)=O)cc1	814805012	OBEXIIQUVJHJLV-UHFFFAOYSA-N	439.497	1.798	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)C(=O)Nc2cnc(C3CC3)nc2)c1	815866176	RJNISIDPSRFGKU-UHFFFAOYSA-N	434.250	1.985	50	20	IDGD	
COCCCN(C(=O)/C(C#N)=C/c1cc(C)n(CCOC)c1C)[C@@H]1CCS(=O)(=O)C1	841771896	ZRSRNPJNMPFHHU-UMSHPIDHSA-N	437.562	1.711	50	20	IDGD	
COc1ccc([N+](=O)[O-])cc1NS(=O)(=O)c1cccc(C(=O)N2CC[C@H](B(O)O)C2)c1	864234769	VRWSIKFRSUPTSN-ZDUSSCGKSA-N	449.250	1.093	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)CCc2c(C)nn(CCC#N)c2C)c2ccccc2c1=O	883955331	GNWSKNUZZJVCDG-UHFFFAOYSA-N	449.515	1.927	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2cc(C(=O)NNc3ncccn3)ccc2Cl)C[C@@H](C)O1	913044316	MIRPOJQELIFKAB-TXEJJXNPSA-N	425.898	1.685	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)CSc2nnc(C3CCCCC3)n2N)cc1	913240545	YVSUUSWPBIJCAF-UHFFFAOYSA-N	446.533	1.445	50	20	IDGD	
C[C@@H]1CN(c2ccccc2C=NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)CCO1	915944754	JAJOHNHRXGTIFZ-MRXNPFEDSA-N	430.530	1.926	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCCc2ccc(C(=O)OC)cc2)c2ccccc2c1=O	916248733	KREQIMUVGHMZTG-UHFFFAOYSA-N	437.456	1.390	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)NCC(=O)N(C)Cc2ccccc2)cc1	918090693	RRQZHZIXTGHEFA-INIZCTEOSA-N	428.489	1.842	50	20	IDGD	
Cc1nnc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)s1	919672561	WTVGNCDRQKPFTL-UHFFFAOYSA-N	446.514	1.792	50	20	IDGD	
Cc1ccc(-c2nn(-c3ccccc3)cc2C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)o1	919885708	QTETXBDKLHGDBS-AWEZNQCLSA-N	443.485	1.572	50	20	IDGD	
Cc1nccn1-c1ccc(CNC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1F	920239353	CUOBWQMXBMTTHC-IBGZPJMESA-N	425.420	1.990	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)c1cc([N+](=O)[O-])cc(S(C)(=O)=O)c1	920275600	LVTLUIMTTICUKN-SNVBAGLBSA-N	425.394	1.366	50	20	IDGD	
C[C@@H](C(=O)OCC(=O)NNC(=O)c1cccc(Cl)c1)S(=O)(=O)c1ccc(F)cc1	920532553	LNDVPECTDINAJZ-NSHDSACASA-N	442.852	1.646	50	20	IDGD	
CC(C)[C@H](C(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12)N1C[C@@H](C)O[C@H](C)C1	921201317	MNDPLKPHCAZFGB-JXXFODFXSA-N	443.548	1.872	50	20	IDGD	
O=C(Cc1coc(-c2ccccc2)n1)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	1116301388	KRBPCAMHLNCUDV-UHFFFAOYSA-N	447.495	1.490	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccc(F)cc2C1)c1cccc(S(=O)(=O)N2CCCC2)c1	1116399287	XXLHGCLFUHNIJX-MRXNPFEDSA-N	447.488	1.623	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@H]2CC(=O)N(c3ccc(C#N)cc3)C2)c2ccccc2c1=O	1320611798	NTMCLMFSKTXTAL-HNNXBMFYSA-N	444.451	1.102	50	20	IDGD	
Cc1c(C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)cnn1C1CCCC1	1336414344	OSZZVHMAWCBFSJ-UHFFFAOYSA-N	447.565	1.395	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CC(F)(F)C(=O)O)C1	1778014858	USHKASZGLITCMV-UEKVPHQBSA-N	441.269	1.394	50	20	IDGD	
Cc1nccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](C)CBr)C3)n1	1778306481	FWNNQGHPRYWHAY-URKNILKWSA-N	439.354	1.944	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCN2CCOC2=O)C1	1778775695	DDHHQAKKNWWQBQ-RZQQEMMASA-N	429.945	1.750	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](C)n3ccccc3=O)C2)C1	1779267629	AKVOMYPAFRLDHH-SUNYJGFJSA-N	426.311	1.023	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccn(C(F)F)n3)C2)C1	1779618717	WVZSKZOIYWVJEW-MEDUHNTESA-N	435.269	1.895	50	20	IDGD	
O=C(c1ccc(-c2ccccc2)nc1)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1779890331	SASBMQCXVTWZPJ-DENIHFKCSA-N	429.904	1.792	50	20	IDGD	
Cc1ccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cccc(B(O)O)c2)C3)cc1	1780456030	BKXHTXXSPOQQFF-ZJSXRUAMSA-N	436.317	1.116	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)[C@H](CN)c3ccccc3)CCO2)C1	1781227411	LDAAUXIGZJMEKV-LSTHTHJFSA-N	428.360	1.795	50	20	IDGD	
O=C(C#CC1(O)CCCCC1)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781331585	NHQGCXUQLAHWAA-YJBOKZPZSA-N	431.302	1.205	50	20	IDGD	
O=C(Cc1ccc2c(c1)CCO2)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781332584	BTCPRLIEMPVTGI-IEBWSBKVSA-N	441.297	1.684	50	20	IDGD	
CNc1nsnc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)Br)C1	1781995326	JHMYTVVYJUJOLY-GLKRBJQHSA-N	446.371	1.491	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCc1cnccn1)C2	1782002923	XPRILLCJZWFUCM-IDHHARJASA-N	439.354	1.707	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1noc(C(C)C)n1)C2	1782172069	MUOCYRKAWRRSQL-BXTJHSDWSA-N	442.944	1.503	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C1CC3(CCC3)C1)C2	1782213989	FZDBHDBCPIIPME-WZONZLPQSA-N	434.581	1.454	50	20	IDGD	
CCOC(=O)O[C@@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C(Cl)Cl)C1	1782221508	XLOXTHYHXOLOAF-XWCIJXRUSA-N	425.309	1.866	50	20	IDGD	
Cc1ccc(C)c(CC(=O)N2CC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c1	1783291872	DEDGQLUFBPSDIX-QHCPKHFHSA-N	430.549	1.049	50	20	IDGD	
COc1ncc(Cl)cc1C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](C)Br)C2)C1	1783527677	FFXKXFKKEXJYBU-GTNSWQLSSA-N	446.729	1.971	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(-c4ncc[nH]4)cc3)CCO2)C1	1783884904	VOQDDGSNTQHCLD-DYESRHJHSA-N	432.908	1.774	50	20	IDGD	
CC(=O)N/C(=C\c1ccco1)C(=O)N1CCO[C@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783947191	OXNLSHCRLOYANT-WAFIBAPDSA-N	430.288	1.390	50	20	IDGD	
O=C(Cc1cc(F)ccc1[N+](=O)[O-])N1CCO[C@@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783952129	OBTXTTHEAWZCJH-KRWDZBQOSA-N	434.251	1.910	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)n3ccnc3)C[C@@H]21	1783964458	UEFRPWSUIGNYBJ-QRJUGERDSA-N	427.343	1.455	50	20	IDGD	
COC(=O)CCCCCC(=O)N1CC[C@]2(CN(C(=O)CCBr)CCO2)C1	1784044382	UKFUDZHGTKIKHR-GOSISDBHSA-N	433.343	1.725	50	20	IDGD	
O=C1CCCc2cc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]4C3)ccc21	1784093480	WGVTZYWDIJKYBR-UUXHPUJUSA-N	434.920	1.399	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CNc3ccc(F)cc3)[C@H]2C1	1786813681	DNTGMZUXUBVWFJ-MGHWNKPDSA-N	427.904	1.471	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](CN)c3ccccc3)[C@H]2C1	1786924894	UHCHYHOEHYFVJJ-UONLAYADSA-N	442.387	1.945	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccccc3C3CC3)C[C@@H]21)c1cccc(B(O)O)c1	1786986605	PKXNNZQTFAOJEE-TZYHBYERSA-N	448.328	1.151	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3cnn(C)c3)[C@H]2C1	1787008880	FBWNBOZISSBDKA-HJWJTTGWSA-N	441.370	1.363	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(OCCCO)cc3)C[C@@H]21)[C@H](F)Cl	1787447708	DNVYYCHEOKOZHS-DKIMLUQUSA-N	428.888	1.576	50	20	IDGD	
C[C@@H](C(=O)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1)n1cccn1	1788149381	MKCVNRNYECLNMP-INIZCTEOSA-N	432.289	1.572	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C/N=C/c3ccco3)[C@H]2C1	1788676653	USMFBGNDFLEKNO-XZEUKZFCSA-N	440.338	1.709	50	20	IDGD	
C[C@H]1CCc2c(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]4C3)n[nH]c21	1788762675	KXJGLRRTNOQACY-OTRWWLKZSA-N	434.613	1.904	50	20	IDGD	
Cc1noc(N)c1C(=O)NC1(c2ccc(NC(=O)c3cnccc3C(=O)NN)cc2)CCC1	1789522903	VVOIZTSITRNDDY-UHFFFAOYSA-N	449.471	1.625	50	20	IDGD	
CC1CCN(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]3C2)CC1	1789868191	SCHYMCMHDZPGME-OGNFBWPZSA-N	434.408	1.934	50	20	IDGD	
Cc1cc(/C=C/C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]3C2)no1	1789926184	QGKAJWTWBHWCKB-MKZIQFNVSA-N	430.274	1.666	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3ccnc(OC)c3)C[C@@H]21	1791252563	MUGGSHCSLONNEV-FJIDUMEYSA-N	439.940	1.256	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3ccccc3F)C[C@@H]21	1791256366	NYUZKZIDQCQXLC-BMFAXAFESA-N	426.916	1.992	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCCCCC(=O)OC)[C@H]2C1	1791353839	LOIBXJGACLLWDJ-QAETUUGQSA-N	432.945	1.343	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1ccc(C2(NC(=O)[C@@](C)(O)C(F)(F)F)CCC2)cc1	1791599905	OVCWCKYTZAYNLC-GOSISDBHSA-N	444.454	1.807	50	20	IDGD	
C[C@H](Oc1ccccn1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21	1791622101	UDWGKJCIKDFZDF-YGJAXBLXSA-N	444.301	1.519	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCNC(=O)c3ccccc3)[C@H]2C1	1792119760	YYUAVJNUABEGGB-VJANTYMQSA-N	435.952	1.804	50	20	IDGD	
O=C([C@@H](O)CCl)N1CC[C@H]2CO[C@@H](CNC(=O)C34CC(c5ccccc5)(C3)C4)[C@H]2C1	1792329773	SIDMLTJCYNAGFB-FYJNAVQZSA-N	432.948	1.688	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CC[C@H](C(=O)OC)CC1	1793604803	VQBYHNDJQMXSTE-WJWMFLMHSA-N	428.957	1.963	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CSc1ccncc1	1793950677	NBNMCKMPASFIIR-ZDFLXESQSA-N	432.373	2.000	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCBr)[C@@H]1CC[C@H]2CCC(=O)N2C1	1795495560	ZRKFFSYVDOCXGA-RBGFHDKUSA-N	426.355	1.811	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCc1ccsc1	1796226810	WKISJOIMCXXHHQ-MUJYYYPQSA-N	427.530	1.631	50	20	IDGD	
C[C@H](NC(=O)c1ccc(F)cc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Cl	1796367695	PKBFAFAWWXJCPH-LLKOPVJYSA-N	429.851	1.068	50	20	IDGD	
CC(C)(C)OC(=O)N1CC2(C[C@@H]2C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Cl)C1	1796370095	HFPPOAQAYIXRRA-XLWJZTARSA-N	445.919	1.367	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(CCN2CCCC2)nc1	1796504881	ZVUZXZCGPQWALF-KOUHRCEDSA-N	448.995	1.941	50	20	IDGD	
Cc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CO[Si](C)(C)C)nn1C(F)F	1797957587	PEOJQRGXAXTTHV-YWVIFJGQSA-N	430.528	1.641	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nc3ccccc3[nH]1)C2)[C@@H](F)Br	1799347762	RGVSXODZHXMPPI-RDBQEKCUSA-N	425.258	1.457	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccn(C(F)F)n1)C2)[C@H](F)Br	1799348878	CJKCOWDINBFZHL-OEIWMXHLSA-N	425.205	1.172	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2sc(C)cc2[nH]1	1799948766	DYUQFNOQSQJCOF-IPJQOSJUSA-N	425.938	1.995	50	20	IDGD	
COc1ccc(C)c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)c1	1800536697	OPZAOAKXRKBBSY-MUJYYYPQSA-N	437.500	1.568	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnccc1N(C)C)C2	1800638869	BOJMKKRZMVAYCJ-IARIHHJXSA-N	439.354	1.524	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C[C@@H](C)NC(=O)OC(C)(C)C)C2	1800975944	YRZNHBSAAAZLEQ-OWVAZHOYSA-N	447.960	1.133	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(-c3cccs3)on1)C2	1800977027	PEPMQGQMFSSCQQ-IPJQOSJUSA-N	439.921	1.860	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(Cl)ccc1OC)C2	1800978371	BXXIEZZUPPTJAL-DJZPMSPPSA-N	431.316	1.806	50	20	IDGD	
CC[C@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](COC(C)=O)OC(C)=O)C2	1801801295	CZERGPPLGHBPBX-QRJUGERDSA-N	447.326	1.293	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCS(=O)(=O)c1ccccc1)C2	1802272947	GLMFFFLVDJIRDN-KYHPRHEASA-N	442.965	1.742	50	20	IDGD	
Cc1cc[nH]c1C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1805004972	PVLMHFDUYGIERV-RXVVDRJESA-N	432.289	1.031	50	20	IDGD	
C[C@H](C(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)n1ccccc1=O	1810515703	TVIVRQBJMRNAPX-QSOKESPWSA-N	432.908	1.110	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)N1CCCC2(CCN(C(=O)[C@@H](C)CBr)CC2)C1	1810811805	LMOVFPDGHODOGF-KBPBESRZSA-N	431.375	1.696	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)c1nc2ccc(F)cn2n1	1812288464	KFOJKJNEQONZQU-QRTARXTBSA-N	446.870	1.183	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2[nH]nc3ccncc23)[C@@H]1c1cccnc1	1813031157	OVXMERWMGMLXPY-URLQWDBASA-N	442.907	1.926	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)CSc2nc[nH]n2)[C@H]1c1cccnc1	1813349976	FCDZYKBEXXAOEG-OFQRWUPVSA-N	438.941	1.252	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)[C@@H](O)CCl)n[nH]2)n1	1814868077	VALMOQFUUPBRLY-CABCVRRESA-N	434.884	1.669	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)cc([N+](=O)[O-])c2)[nH]n1)[C@@H](O)CCl	1814873001	QFYJHFOSGOUKDG-GJZGRUSLSA-N	437.840	1.929	50	20	IDGD	
Cc1nscc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1816259573	BRXCEHUHDAONQH-QGZVFWFLSA-N	439.306	1.474	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)CC(F)(F)C(=O)O)sc2C1	1817095575	JLNQYFKLFJYBIZ-JGVFFNPUSA-N	425.841	1.419	50	20	IDGD	
O=C(CC(F)(F)C(=O)O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](F)Br)CC2	1817096356	MQMJJCUEYZPUCY-SSDLBLMSSA-N	444.229	1.856	50	20	IDGD	
C=CCSCC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1	1817474133	NHOYKIKFUVKTRG-KRWDZBQOSA-N	428.323	1.315	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)c(C)n1C	1817477071	YBDACDPCOAKWLB-HXUWFJFHSA-N	449.320	1.665	50	20	IDGD	
COCCC(=O)N1CCCC[C@H]1c1cc(NC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)n[nH]1	1818111840	KRUUKARHOZYAQR-OHHQFBAHSA-N	429.481	1.572	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)CCN3CCOC3=O)sc2C1	1818697158	NIICVSSFNPABQQ-MNOVXSKESA-N	430.914	1.151	50	20	IDGD	
CC(=O)OC[C@H](OC(C)=O)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)C(Cl)Cl)[nH]n1	1819432304	GCEJZPVCLBDKIO-STQMWFEESA-N	449.291	1.700	50	20	IDGD	
C[C@H](Br)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CNC(=O)N(C)C)[nH]n1	1822185756	PTGOGCXHERDCMV-CMPLNLGQSA-N	429.319	1.456	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CSCC(=O)OC)[nH]n1	1822371401	RQAVFXBHJVEQQK-WCQYABFASA-N	432.930	1.562	50	20	IDGD	
CC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](COC(C)=O)OC(C)=O)CC2	1822850544	STIWEQNIEXLQMR-MBNYWOFBSA-N	445.925	1.567	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)[C@@H]1CCCSC1	1823452374	GCUFBVRFAWSEDC-CRAIPNDOSA-N	442.350	1.539	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccco2)CC1	1825263527	ILMDWEOGLSBXFP-NELJVSICSA-N	436.317	1.906	50	20	IDGD	
CC[C@@H](NC(C)=O)C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](C)Br)sc2C1	1825635956	NEJDBWJGVPGGRA-DVVUODLYSA-N	431.356	1.753	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CSCC(=O)OC)CC2	1825994110	HVEJHVVPVJMZAM-ZJUUUORDSA-N	435.955	1.215	50	20	IDGD	
Cc1cn(CC(=O)N2CCC([C@@H]3CCCCN3C(=O)[C@H](F)Cl)CC2)c(=O)nc1O	1827615227	DAALDCGCJKXADC-HOCLYGCPSA-N	428.892	1.411	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)COc3ccc(O)cc3)CCO2)C1	1830337965	BDXXLVJSTBLLNM-OAQYLSRUSA-N	440.924	1.492	50	20	IDGD	
CCCNC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1831193394	RXQKAHMPEYWJQH-HXUWFJFHSA-N	431.961	1.014	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)n3cc(C)cn3)C2)C1	1831657110	LXEQYDWGCKMAIZ-ABSDTBQOSA-N	426.945	1.616	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)CC[C@H]2CCOC2)CC1	1832452808	NBXAWMXRJILIFQ-PGRDOPGGSA-N	442.365	1.416	50	20	IDGD	
CC(C)CNC(=O)C(=O)N1CCC(N2CCC(NC(=O)C(C)(C)CCl)CC2)CC1	1833215494	VULBLHVUPNKEAF-UHFFFAOYSA-N	429.005	1.595	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(OC(F)F)cn3)CCO2)C1	1833641820	QTYRWHXSRARASF-AUUYWEPGSA-N	447.866	1.770	50	20	IDGD	
Cc1cc(C(=O)NC2CCN(C3CCN(C(=O)[C@H](F)Br)CC3)CC2)on1	1834209154	RGRIHZKMYROJPA-HNNXBMFYSA-N	431.306	1.859	50	20	IDGD	
Cc1cc(C(=O)N2CCC(N3CCC(NC(=O)CCBr)CC3)CC2)no1	1834421276	ZWXDBPAEEZGVKR-UHFFFAOYSA-N	427.343	1.953	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)[C@@H]3C[C@@]3(F)Cl)C2)C1	1834826185	FPQAJXAWCZXQJR-GLQYFDAESA-N	427.698	1.152	50	20	IDGD	
O=C(CCc1ccccc1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1834840629	RSCGRNIKBXLQQZ-PKOBYXMFSA-N	443.313	1.766	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)CCc3cccnc3)CC2)CC1	1834887954	LQBMQOABADOODF-HXUWFJFHSA-N	436.984	1.840	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)/C=C/c3ccccc3)CCO2)C1	1835114826	XAYBFEZFQHEYDI-IFABGAQTSA-N	437.334	1.940	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CN3CCCCC3)CCO2)C1	1835378722	COTMCRWCOGSXJA-VQIMIIECSA-N	446.386	1.102	50	20	IDGD	
Cn1nc(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](F)Cl)CC3)CC2)c2c1CCC2	1835395760	MMGRGIVROXKJLF-GOSISDBHSA-N	425.936	1.628	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)c1ccc2cccnc2n1	1835529061	JKPKWKDYAPHTOT-LJQANCHMSA-N	445.951	1.415	50	20	IDGD	
CCCC(=O)N[C@@H](C)C(=O)NC1CCN(C2CCN(C(=O)[C@H](Cl)COC)CC2)CC1	1835820664	DMNSPHLQFKPUQD-MAUKXSAKSA-N	445.004	1.117	50	20	IDGD	
CSc1ncccc1C(=O)NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836035510	ZATOFNCLFJACGQ-QGZVFWFLSA-N	440.997	1.588	50	20	IDGD	
O=C(c1nnsc1C1CC1)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836718034	PXBHPFBPHFULEO-HNNXBMFYSA-N	442.969	1.627	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@@H]3CCCS3(=O)=O)CC2)CC1	1836922663	OVSJJWASPSTLCE-MSOLQXFVSA-N	449.013	1.970	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc4c(c3)CNC4=O)CCO2)C1	1837147397	LBLSUVDASQOKJO-GCJKJVERSA-N	449.935	1.408	50	20	IDGD	
C=C[C@H](O)C(C)(C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)CBr)C2)C1	1837391337	LDRXRBBFJINYOJ-ZRGWGRIASA-N	447.370	1.047	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)Cn3ccnn3)CC2)CC1	1837981874	ZZVSWTWTUILCSA-INIZCTEOSA-N	442.358	1.450	50	20	IDGD	
CCOC(=O)N[C@@H](O)C(=O)N1CCC(OC2CCN(C(=O)[C@H](Cl)CC)CC2)CC1	1838356952	JGHIQVMSOINNNT-CVEARBPZSA-N	433.933	1.067	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(C)nn3C(F)F)CCO2)C1	1838714569	MIEZOPCWZJJEPM-FZKQIMNGSA-N	434.871	1.674	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(F)cc3OC)C2)C1	1839148888	MQFRHNHHPAAFSX-JXFKEZNVSA-N	428.888	1.922	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)nn1C	1839150874	AHJGORHZDAJCGU-ROUUACIJSA-N	433.336	1.035	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C1(Br)CC1)CCO2	1839205367	FZHUEFIWPVSDSX-CZUORRHYSA-N	437.762	1.778	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1C[C@H]1c1ccccc1)CCO2	1840121050	DZYZOLCAYYFHTP-LMVRJCEZSA-N	436.936	1.500	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccc(Cl)cc3)C2)C1	1840151561	FWSMWWCXYXEIDT-FXAWDEMLSA-N	445.343	1.593	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(F)cc(F)c3)C2)C1	1840154001	HVQMDKLLTPJFCA-APWZRJJASA-N	432.851	1.289	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C=C/C3CCCCC3)C2)C1	1840154887	JFFVSBLFOAHSGV-BIZHUJQWSA-N	428.957	1.833	50	20	IDGD	
Cc1ccncc1CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840186165	FFWDAHJLOZWORB-IBGZPJMESA-N	430.332	1.583	50	20	IDGD	
CC(C)N1CCC(C(=O)N2CCOC[C@]3(CN(C(=O)C(Cl)Cl)CCO3)C2)CC1	1840186582	KZVKKQCMJMNULQ-LJQANCHMSA-N	436.380	1.367	50	20	IDGD	
Cc1cc(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](C)CBr)C3)C2)no1	1840366402	JVJHBPQOFJAXRG-FZKQIMNGSA-N	444.326	1.013	50	20	IDGD	
C[C@]1(C(=O)N2CCO[C@]3(COCCN(C(=O)CCBr)C3)C2)CC1(F)F	1840825026	UKHNIIFBXLUYJZ-CABCVRRESA-N	425.270	1.273	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCCC12CN(C(=O)c1ccc(O)nn1)C2	1841924303	VKUFVADAQZZZCH-ZDUSSCGKSA-N	439.900	1.131	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1cn3ccccc3n1)C2	1843415925	DMGKHJHLRCDYTB-MFKUBSTISA-N	433.472	1.285	50	20	IDGD	
COC(=O)c1ccc(CC(=O)N2CCCC23CN(C(=O)[C@@H](F)Br)C3)s1	1845000686	HRZXUSPTAXJUML-CYBMUJFWSA-N	433.299	1.971	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@H]1C[C@H]3C[C@H]3N1C(=O)OC(C)(C)C)C2	1846360495	PGULBBMVQVAKKQ-KLHDSHLOSA-N	441.956	1.842	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)c1ncc(Cl)cc1Cl)C2	1846383608	NICDVYFXWUTZPF-UHFFFAOYSA-N	428.320	1.578	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H]1CC[C@H](O)CC1	1848098491	GCEYBWZKFCOECA-WOYTXXSLSA-N	443.972	1.871	50	20	IDGD	
C[C@@H]1Cc2cc(C(=O)NNC(=S)NCCc3cccs3)ccc2N1S(C)(=O)=O	11519575	ONTOGDSZWRLZHF-GFCCVEGCSA-N	438.600	1.810	50	20	IDGD	
CS(=O)(=O)Nc1ccc(C(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)cc1	12990581	XGGQLZHJTJQCHX-UHFFFAOYSA-N	425.850	1.330	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1cnn(Cc2ccccc2)c1	14890544	GYLJCSOXSLUBOF-UHFFFAOYSA-N	426.502	1.608	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)Nc3ccc(Cl)cc3)c2)cn1	17397559	JRANPYHELYYLBJ-UHFFFAOYSA-N	433.877	1.949	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)n[nH]1)c1cccc(S(=O)(=O)NC2CC2)c1	17519240	ZSECZLDLRDYIJA-UHFFFAOYSA-N	425.470	1.592	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cc(-c3cccs3)n[nH]2)cc1	107697010	IMAAMMSPMGRPDI-UHFFFAOYSA-N	433.515	1.528	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1cc(Br)sc1Br	303607483	BBFXSHULNMQRJD-RXMQYKEDSA-N	446.142	1.469	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NCC(=O)Nc1cc(Cl)ccc1Cl	726082863	CLHUIBPOBKNTKY-UHFFFAOYSA-N	444.300	1.754	50	20	IDGD	
O=C(COc1cccc(NC(=O)C2CC2)c1)NNc1ccc(S(=O)(=O)NC2CC2)cc1	726863334	NENQLEASQHIOJO-UHFFFAOYSA-N	444.513	1.998	50	20	IDGD	
O=C(NNC(=S)NCC1CCC1)c1cc(S(=O)(=O)NCc2ccccc2)ccc1O	727273214	YHKGUKSNQCPVFZ-UHFFFAOYSA-N	448.570	1.780	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)CSC[C@@H]2CCCCO2)c1	727363999	FAWCSDUFOJETSP-INIZCTEOSA-N	443.591	1.780	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)[C@@H]3CCCOC3)c2)cc1	727722291	ICZCGJMBWQDZON-OAHLLOKOSA-N	433.486	1.684	50	20	IDGD	
CC1CCC(NC(=O)CN2CCN(CC(=O)NNC(=O)c3ccccc3Cl)CC2)CC1	728293852	LTVBXSHVQCFTKP-UHFFFAOYSA-N	449.983	1.414	50	20	IDGD	
COc1ccc(CNC(=O)NNC(=O)CNC(=O)c2ccco2)cc1OC1CCCC1	728597589	UWYMKFOUVMDMMN-UHFFFAOYSA-N	430.461	1.870	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)COc1ccc2cc(Br)ccc2c1	729274608	VNJLGGKARATUFZ-SNVBAGLBSA-N	444.307	1.066	50	20	IDGD	
CS(=O)(=O)c1ccc(Cl)c(S(=O)(=O)NNC(=O)CCc2ccccc2O)c1	729962689	FSJCHTZESKONBF-UHFFFAOYSA-N	432.907	1.391	50	20	IDGD	
C[C@@H]1CCCN(S(=O)(=O)c2cc(C(=O)NNC(=O)CCc3ccccc3)n(C)c2)C1	730179826	CLZYPYRBLBOFNZ-MRXNPFEDSA-N	432.546	1.840	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN1S(=O)(=O)c1cccs1)c1cccc2ncccc12	730226580	NFEGVAHYNSBSFY-INIZCTEOSA-N	430.511	1.911	50	20	IDGD	
C[C@@H]1CN(S(=O)(=O)c2ccc(C(=O)NNC(=O)Cc3ccccc3F)cc2)C[C@@H](C)O1	731328724	DGKXNBIEHPOPRP-HUUCEWRRSA-N	449.504	1.627	50	20	IDGD	
O=C(COC(=O)[C@H]1CC(=O)N(c2ccc(F)cc2)C1)NNC(=O)c1cccc([N+](=O)[O-])c1	732340894	AGHLJEZARPTGHU-ZDUSSCGKSA-N	444.375	1.091	50	20	IDGD	
C[C@H](Oc1ccccc1Br)C(=O)NNC(=O)CCN1C[C@@H](C)O[C@H](C)C1	732828907	WJTKJXZSBKZBIE-MCIONIFRSA-N	428.327	1.863	50	20	IDGD	
CS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1[N+](=O)[O-]	733110494	MWIMZVLEMKUUPQ-UHFFFAOYSA-N	429.414	1.259	50	20	IDGD	
COC[C@@H](C)S(=O)(=O)NC(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccccc1	733715252	RFKHLZDWOMUXPC-QJISPJEISA-N	427.486	1.852	50	20	IDGD	
COC(=O)COc1cccc(CNC(=O)NNC(=O)c2nnc(O)c3ccccc23)c1	734671885	RXVYISSCBZTWFH-UHFFFAOYSA-N	425.401	1.031	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNS(=O)(=O)c2cccc(C(=O)O)c2)CC1	734807111	GKVDGQGBIPICCP-UHFFFAOYSA-N	442.494	1.277	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)[C@@H]2CCCN2C(=O)C(C)(C)C)CC1	734825999	SFLPZRJPQIHXGP-HNNXBMFYSA-N	439.557	1.753	50	20	IDGD	
CC[C@H](NC(=O)NNC(=O)c1cnn(C)c1)c1ccccc1OCC(=O)N1CCCC1	735582865	SKPZSJUCGGRKOZ-KRWDZBQOSA-N	428.493	1.517	50	20	IDGD	
Cc1cccc(NC(=S)NNC(=O)c2cc(C)c3c(=O)n(C)c(=O)n(C)c3n2)c1C	738507632	RJJQXKQAKHJQIM-UHFFFAOYSA-N	426.502	1.189	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C[C@H]2CN(Cc3ccccc3)CCO2)cc(OC)c1OC	740738274	CJUGQOSGOCQLPV-SFHVURJKSA-N	443.500	1.765	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)c1cc(S(=O)(=O)N2CCCCC2)ccc1C	740851059	NLXWSJWVCFRVDH-UHFFFAOYSA-N	438.550	1.235	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCc2ccc(N3CC=CC3)cc2)c2ccccc2c1=O	741090727	MOOBJEULUNKNQL-UHFFFAOYSA-N	432.484	1.937	50	20	IDGD	
CN(C)C(=O)Cn1cc(C(=O)NNC(=O)c2cc(-c3ccccc3)nc3ccccc23)nn1	742774762	STWRUSOHYFJLDX-UHFFFAOYSA-N	443.467	1.656	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)N(C)Cc1ccccc1	743606156	ZGHSFTFNRRTULA-HNNXBMFYSA-N	433.534	1.946	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2ccccc2NS(=O)(=O)CC)c2ccccc2c1=O	743738224	XJKVIWVCOJJVLS-UHFFFAOYSA-N	443.485	1.253	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CN2CCN(C(=O)[C@H](C)Oc3ccccc3C)CC2)c1	744406816	JOEDKDLUQORFQE-IBGZPJMESA-N	438.528	1.676	50	20	IDGD	
CC(=O)N1CCc2ccccc2[C@H]1CC(=O)OCC(=O)NNC(=O)c1ccc(C#N)cc1	744522068	BPNFOHXFPVMUEK-HXUWFJFHSA-N	434.452	1.398	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)c1cc(S(=O)(=O)N2CCCC2)ccc1O	745993549	IUUDFNHYYUCQNR-UHFFFAOYSA-N	442.497	1.593	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@@H](C)C(=O)NNC(=O)CCN/C(O)=C1/N=CC=CC1=O	746098628	WJMZWYJXWYYVDN-ITEXZYEPSA-N	434.880	1.788	50	20	IDGD	
O=C(CCNS(=O)(=O)/C=C/c1ccccc1)NNC(=O)Cc1cn2ccccc2n1	746702160	QDYGGRIBQIDZKN-JLHYYAGUSA-N	427.486	1.005	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)CCn1c(S)nnc1-c1ccc(OC)cc1	747401083	CMXMKMFTWOFMKT-UHFFFAOYSA-N	434.522	1.085	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCc2ccccc2)cc1C(=O)NNC(=O)Cc1ccncc1	747429640	WOEGEFLMKUDYDR-UHFFFAOYSA-N	438.509	1.872	50	20	IDGD	
O=C(CSCc1nc(O)c2c3c(sc2n1)CCCC3)NNC(=O)C(=O)N1CCCC1	748246646	NDXUKZBUKBHWLV-UHFFFAOYSA-N	449.558	1.279	50	20	IDGD	
Cc1ccc(C(=O)NNc2ccccc2S(=O)(=O)NC(C)(C)C)cc1S(N)(=O)=O	748603123	SEUDULHSKJHFEE-UHFFFAOYSA-N	440.547	1.476	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)Nc1nc(-c2ccc3c(c2)CCC(=O)N3)cs1	748661605	MNOMKVJWWTUVTJ-NSHDSACASA-N	433.490	1.899	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)c2cc(Cn3cc(Br)cn3)on2)cc1	751547707	DLUYPORBEJTWQE-UHFFFAOYSA-N	434.250	1.830	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)Cc2ccc(Br)c(F)c2)c1	751602605	QVOGYMVYACQZBA-UHFFFAOYSA-N	429.267	1.995	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(Cl)c(S(=O)(=O)NNC(=O)c2ccc(C)o2)c1	753087275	ZYZVPYPZJSHGTC-UHFFFAOYSA-N	449.938	1.895	50	20	IDGD	
CC(C)c1ccccc1NC(=S)NNC(=O)c1ccc(S(=O)(=O)CC(N)=O)cc1	754425821	ZMJRNYXBJWXXSS-UHFFFAOYSA-N	434.543	1.700	50	20	IDGD	
O=C(COC(=O)c1cc2cc(F)ccc2oc1=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	754602022	MBYXWPANLFAPLN-UHFFFAOYSA-N	429.316	1.458	50	20	IDGD	
O=C(NNC(=O)c1cccc2ncccc12)NC1CCN(S(=O)(=O)C(F)(F)F)CC1	755306084	NKGDTFQCJKFDJY-UHFFFAOYSA-N	445.423	1.493	50	20	IDGD	
Cc1ccc(C(=O)Nc2ccccc2)cc1NC(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1	755825347	DLJSZLTWIFESSO-OAHLLOKOSA-N	430.486	1.835	50	20	IDGD	
CCN(CCNC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)CCC(F)(F)F	755851302	XWQBUZOZHHTSEJ-UHFFFAOYSA-N	439.460	1.700	50	20	IDGD	
Cc1c(NC(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)cccc1C(=O)Nc1ccccc1	756280386	OUVSLRVWEAFFMM-AWEZNQCLSA-N	430.486	1.835	50	20	IDGD	
CCc1ccc(NC(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)cc1S(N)(=O)=O	756524106	HEQKXVURBUMLGY-UHFFFAOYSA-N	446.464	1.892	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1NS(C)(=O)=O	756787073	NVQDZNQGAZYTRX-UHFFFAOYSA-N	436.446	1.304	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)nc1)Nc1ccccc1OCC(=O)N1CCOCC1	756873117	HGSSDWBBGNVWBK-UHFFFAOYSA-N	433.852	1.439	50	20	IDGD	
CSCCNC(=S)NNC(=O)[C@H]1CCC(=O)N1Cc1ccc(Br)cc1	756892925	MEWKHGDCSHYWJS-CYBMUJFWSA-N	445.408	1.798	50	20	IDGD	
CCN1CCN(C(=O)Cc2ccc(NC(=O)NNC(=O)c3cccc(C#N)c3)cc2)CC1	757579809	GUQXAUYKPAIFCO-UHFFFAOYSA-N	434.500	1.731	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)cn1	758151184	RWRADPWEHVCODC-UHFFFAOYSA-N	443.526	1.372	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)c2cccnc2I)nc1C	758574112	JYHWVAQGOZSLPR-UHFFFAOYSA-N	427.202	1.718	50	20	IDGD	
COc1cc(CNC(=O)NNC(=O)C(=O)Nc2ccccn2)ccc1OCCC(C)C	758682804	GGJVKWHPYFKZPF-UHFFFAOYSA-N	429.477	1.984	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)N[C@@H]2CN(C(=O)OC(C)(C)C)C[C@H]2C#N)c1	758770516	LIGLZYWUXUHYBO-NVXWUHKLSA-N	431.493	1.772	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CNC(=O)NNC(=O)C(=O)Nc1ccccn1)c1ccccc1	758811344	ABZSGUXBLPFEGV-HNNXBMFYSA-N	442.476	1.617	50	20	IDGD	
O=C(CC1CCCCC1)NC1CCC(C(=O)NNC(=O)C(=O)Nc2ccccn2)CC1	758832293	WQLNSBRSCQDKRY-UHFFFAOYSA-N	429.521	1.813	50	20	IDGD	
Cc1ccnc(-n2nccc2NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)c1	760276241	AUXLEECWDAOEGI-ZDUSSCGKSA-N	426.408	1.268	50	20	IDGD	
CCOc1ccc(OCc2ccc(C(=O)NNC(=O)C(=O)Nc3cnns3)cc2)cc1	760279339	MPQCLQYIRIRLES-UHFFFAOYSA-N	441.469	1.916	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)[C@H]1CCCN1C(=O)c1ccc2c(c1)OCO2	760437867	LKIODEGRCZYSMT-CQSZACIVSA-N	448.476	1.082	50	20	IDGD	
CC(=O)N[C@@H](CC(=O)NNC(=O)CCNC(=O)OC(C)(C)C)c1c(F)cccc1F	760443191	RLYGDKZJKIUXOL-AWEZNQCLSA-N	428.436	1.594	50	20	IDGD	
C[C@H]1C[C@@H](C(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)CCC1=O	763273069	XOKNPNHDBVNXPO-YJBOKZPZSA-N	443.525	1.931	50	20	IDGD	
O=C(NNC(=O)c1ccccc1F)C(=O)Nc1ccc(CN2C(=O)CSC2=O)cc1	763560488	BQKHSFCGBYFXQX-UHFFFAOYSA-N	430.417	1.421	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)[nH]n1)C(=O)Nc1ccc(C(=O)N2CCCC2)cc1	763606252	XKXAPKUCZOKBBT-UHFFFAOYSA-N	446.467	1.712	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2c(C)nc3ccccn23)c(OC)c1OC	763624866	OPPMYKKVZASORY-UHFFFAOYSA-N	427.417	1.068	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2ccc(N3CCOCC3)c(F)c2)c1	763649927	MSKINNOWATXZKC-UHFFFAOYSA-N	444.463	1.444	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)C(=O)Nc1cnc2c(c1)COCC2	763693262	DLRVJHRPTSKIQI-UHFFFAOYSA-N	449.261	1.082	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)C(=O)Nc2c(F)cccc2F)c2ccccc2c1=O	763791881	YFHVCUOUPDYAST-UHFFFAOYSA-N	429.383	1.655	50	20	IDGD	
COc1cc(OC)c(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)cc1Cl	763806339	BKGDROCXTOYQBM-UHFFFAOYSA-N	432.820	1.394	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(CCN2CCCCC2)cc1	763807647	PNSSXGPFEJSQOI-UHFFFAOYSA-N	449.511	1.752	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(CN3CCN(CC)CC3)cc2)cc1	763831043	GJWVPOMNUUCPMW-UHFFFAOYSA-N	437.544	1.786	50	20	IDGD	
CNC(=O)c1ccc(OC)c(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)c1	763847994	GHAFDHLLJUERCH-CQSZACIVSA-N	442.472	1.225	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccccc1N1CCOC1=O	763848255	BBHVNCWYHZLJAF-LBPRGKRZSA-N	430.392	1.336	50	20	IDGD	
CC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)cc1Cl	763848488	CIUFLDNSQCSVNQ-JTQLQIEISA-N	436.827	1.991	50	20	IDGD	
COc1cc(C(=O)N(C)C)ccc1NC(=O)C(=O)NNC(=O)Cc1c[nH]c2ccccc12	763865225	MAVFJMINRVRVIG-UHFFFAOYSA-N	437.456	1.207	50	20	IDGD	
COC(=O)c1ccccc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccc(C(C)=O)cc1	763873699	XRKINRQDTHDAPU-CYBMUJFWSA-N	427.413	1.229	50	20	IDGD	
CCc1cc(O)nc(-c2cccc(NC(=O)C(=O)NNC(=O)Cn3nc(C)cc3C)c2)n1	763881931	RKHKQURCSGRCLD-UHFFFAOYSA-N	437.460	1.011	50	20	IDGD	
CS(=O)(=O)c1c(Cl)cccc1NC(=O)C(=O)NNC(=O)Cc1ccc(F)cc1	763931600	IUBVCGQPOKWWMH-UHFFFAOYSA-N	427.841	1.211	50	20	IDGD	
CC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(Br)s2)c1	763942147	VXDCHFGYAXYBBO-UHFFFAOYSA-N	425.264	1.869	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)[C@H]1CCCN1C(=O)c1ccc2c(c1)OCO2	764045784	REVTWPDOQHCKRM-CQSZACIVSA-N	443.481	1.665	50	20	IDGD	
COc1cc(C(=O)N(C)C)ccc1NC(=O)C(=O)NNC(=O)Cc1ccc2ccccc2c1	764091381	JXIQYOGKSCKXJB-UHFFFAOYSA-N	448.479	1.879	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)nc1)C(=O)Nc1ccc(CCN2CCSCC2)cc1	764093326	SYFQGKNYBRSXFT-UHFFFAOYSA-N	447.948	1.726	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2ccc(C)nc2Br)cc1	764125082	RBQXPYHIAHIUDB-UHFFFAOYSA-N	435.278	1.880	50	20	IDGD	
COC(=O)c1ccc(OC)cc1NC(=O)C(=O)NNC(=O)CCc1ccc(OC)cc1	764131151	GYQSITVEAFXIHI-UHFFFAOYSA-N	429.429	1.209	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(F)(F)F)nc2)o1	764139691	YUWNMQIAEGTPMM-UHFFFAOYSA-N	427.383	1.935	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)CC2CCCC2)cc1-n1nnnc1C1CC1	764178533	CTAOJYXXKFELGC-UHFFFAOYSA-N	427.465	1.215	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2cccc(C#N)c2)c1	764232569	QQVLUKDFOJTXDH-UHFFFAOYSA-N	443.485	1.035	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)cc1F	764239026	ALPGPOQBNUOQKE-UHFFFAOYSA-N	428.420	1.592	50	20	IDGD	
CC(C)Oc1ccc(Br)cc1NC(=O)C(=O)NNC(=O)Cc1ccccn1	764264946	VYUJKVWLIGYEDH-UHFFFAOYSA-N	435.278	1.960	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)C(=O)Nc1cnn(-c2ccccc2Br)c1	764268446	UAZCLSCFOZXBDI-UHFFFAOYSA-N	443.261	1.358	50	20	IDGD	
CCc1noc(C)c1NC(=O)C(=O)NNC(=O)c1cc(-c2ccc(OC)c(OC)c2)[nH]n1	764379045	PIQVUAYMYOQBKY-UHFFFAOYSA-N	442.432	1.352	50	20	IDGD	
O=C(NN=C1CCCc2nc(O)ccc21)c1cccc(S(=O)(=O)N2CCOCC2)c1	764646570	AWIJLQHECAGLNV-UHFFFAOYSA-N	430.486	1.279	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNS(=O)(=O)c2cc3c4c(c2)CC(=O)N4CCC3)c1	764933448	YGVUWEOCGRIJGU-UHFFFAOYSA-N	431.470	1.162	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N[C@H](C)[C@H]2CCOC2)cc1	765097684	MTKLCKDLGFLQNI-PCRVIDNCSA-N	437.500	1.882	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNS(=O)(=O)c3ccc4c(c3)CCO4)CC2)cc1	765127848	RFZHGPIPMFVPSC-UHFFFAOYSA-N	444.557	1.057	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)CSc2nnc(-c3cccnc3)n2Cc2ccco2)cn1	765469425	NYUOHGBJNSAFGB-UHFFFAOYSA-N	438.473	1.268	50	20	IDGD	
CCC1(CC)[C@H](NC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)C[C@H]1OC	765635268	QJMYUDMSJIVIBG-ZIAGYGMSSA-N	425.555	1.826	50	20	IDGD	
O=C(CSc1ccc(F)cc1)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765739512	WLGJFZSXQVQVLZ-UHFFFAOYSA-N	430.505	1.523	50	20	IDGD	
CC(=O)N1CCc2cc(C(=O)NNC(=O)CN3CCN(Cc4ccc(C)cc4)CC3)ccc21	765753925	DWAMNCQTDCIDGD-UHFFFAOYSA-N	449.555	1.483	50	20	IDGD	
C[S@](=O)c1ccc(C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)cc1	765757227	ANUVGOLECCULPA-PMERELPUSA-N	448.976	1.656	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)[C@H]2C[C@@H]2c2cc(F)c(F)c(F)c2)ccc1Cl	766634551	ZHYOATVGTUWBJI-ZJUUUORDSA-N	447.822	1.969	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)[C@@H]2CCCN(C(=O)NCC(C)C)C2)n[nH]1	768280791	CXUBWRKPPQWTAK-OAHLLOKOSA-N	442.520	1.924	50	20	IDGD	
O=C(NNC(=S)Nc1ccccn1)C1CCN(C2=NS(=O)(=O)c3ccccc32)CC1	768578026	KAVLDPJARXZDMV-UHFFFAOYSA-N	444.542	1.260	50	20	IDGD	
CCCC[C@@H](/N=C1/NS(=O)(=O)c2ccccc21)C(=O)NNC(=S)NCCSC	770247702	QTLGBUNFSKKWNK-CYBMUJFWSA-N	443.620	1.142	50	20	IDGD	
Cc1cccc(F)c1NNC(=O)C(=O)N1C[C@@H](C(=O)N2CCOCC2)Oc2ccccc21	770821617	GFBCNVQYJWQOIU-SFHVURJKSA-N	442.447	1.230	50	20	IDGD	
CC[C@H](C)NS(=O)(=O)c1ccc(C(=O)O[C@H](C)C(=O)NNC(=O)CC(C)C)cc1	771933661	XEBTUXRRPBLJQA-UONOGXRCSA-N	427.523	1.502	50	20	IDGD	
COc1ccc(S(=O)(=O)C(F)(F)F)cc1NC(=O)C(=O)NNc1nc(C)cc(C)n1	773483935	YGMONWRWBSPOIA-UHFFFAOYSA-N	447.395	1.477	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)c1ccn(C(F)F)n1	775781027	XXIWUDZBNVNWIJ-UHFFFAOYSA-N	426.855	1.510	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)c2sc(N3CCCC3)nc2Cl)cc1	775885486	BMZXSLYHWVITOD-UHFFFAOYSA-N	433.877	1.886	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)NC[C@@H](c2ccc(F)cc2)N2CCOCC2)c1	776608512	IWUZPFRHUZWYCS-IBGZPJMESA-N	436.509	1.929	50	20	IDGD	
COc1nc(C)c(Br)cc1C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	776829824	TZEWCYBGJVMUID-UHFFFAOYSA-N	449.309	1.629	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)N[C@H](CO)c1ccc(Br)cc1	778639296	BAISFBBVWLJHKL-GFCCVEGCSA-N	441.307	1.304	50	20	IDGD	
CCOc1ccc(NC(=S)NNC(=O)c2cc(S(=O)(=O)N(C)C)cn2C)cc1	778669096	HCEBCWUEWQSZOQ-UHFFFAOYSA-N	425.536	1.306	50	20	IDGD	
NC(=O)CCOc1ccccc1NC(=O)C(=O)NNc1ccccc1OC(F)(F)F	778800990	IZHZLALHXHVMGZ-UHFFFAOYSA-N	426.351	1.921	50	20	IDGD	
COc1ccc(NNC(=O)[C@@H]2CCCCN2S(=O)(=O)c2ccc([N+](=O)[O-])cc2)nc1	781521699	WINLPYVPSOVXGV-INIZCTEOSA-N	435.462	1.685	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)C1(c2cc(C(F)(F)F)ccc2Cl)CC1	781919368	DWJKJSCDELYUFA-QMMMGPOBSA-N	427.832	1.476	50	20	IDGD	
CCOc1ccc(NC(=O)NNC(=O)C2CCC2)cc1S(=O)(=O)N1CCOCC1	782548843	CPOBUOYSQDNMRH-UHFFFAOYSA-N	426.495	1.059	50	20	IDGD	
C[C@@H]1CN(Cc2ccccc2NC(=O)C(=O)NNC(=O)c2ccc(O)cc2)C[C@@H](C)O1	782833043	XHDNAQVRZBYWCZ-HUUCEWRRSA-N	426.473	1.401	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2ccc(C(=O)N3CCOCC3)c(Cl)c2)nc(C)n1	783326132	AXOXPOJKQCJXIX-UHFFFAOYSA-N	432.868	1.301	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc3c(c2)CCC(=O)N3)c1	783390928	RBWXQZXMIRHDCA-UHFFFAOYSA-N	444.513	1.677	50	20	IDGD	
Cc1ccc(Cn2cccc(NC(=O)C(=O)NNc3ccc(-n4cccn4)nn3)c2=O)cc1	783437172	VOJXYSQOPHXJPZ-UHFFFAOYSA-N	444.455	1.263	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)CNC(=O)c2cccs2)c2cccnc2c1C	784004546	HDSQHSBQXIXARI-UHFFFAOYSA-N	425.470	1.429	50	20	IDGD	
COC[C@@H](C)NS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2cc(Cl)ccn2)cc1	784862046	VJTNDNHQRNNXJD-LLVKDONJSA-N	441.897	1.130	50	20	IDGD	
Cc1cccc(Cn2nccc2NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)c1	785060182	GZXFEDVHNXVJCM-UHFFFAOYSA-N	431.456	1.216	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1ccc(O[C@H]2CCOC2)cc1	785331773	ZSNKNFLVNUPUHA-HNNXBMFYSA-N	449.485	1.348	50	20	IDGD	
CCOc1cc(C(=O)NNS(=O)(=O)C[C@H]2CCCOC2)cc(OCC)c1OCC	788138558	CVZFCBONQJADDT-AWEZNQCLSA-N	430.523	1.874	50	20	IDGD	
COc1ccc(C(=O)NNc2ccc(-n3ccnc3)nn2)cc1S(=O)(=O)NC(C)C	788177528	GMFAFNYFNKKMDD-UHFFFAOYSA-N	431.478	1.115	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)[C@H](c2cnn(C)c2)N(C)C(=O)OC(C)(C)C)cc1	788632980	WULBPYYSOQUGOA-SFHVURJKSA-N	446.508	1.596	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cc(N3C[C@H](C)O[C@H](C)C3)ccn2)cc(OC)c1OC	789941201	GVDYDMNAINRBLR-OKILXGFUSA-N	444.488	1.796	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])cc1	790746708	UKUXCQBRRQPSPI-UHFFFAOYSA-N	434.767	1.806	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)NCc2ccc(S(=O)(=O)N3CCCCC3)cc2)n1	792774430	TXDWWRMQUNTNMD-UHFFFAOYSA-N	431.518	1.709	50	20	IDGD	
CNC(=O)Cn1ccc2ccc(NC(=O)C(=O)NNc3ccc4c(=O)[nH]ccc4c3)cc21	793070215	YWMNVDMFDPVMCE-UHFFFAOYSA-N	432.440	1.311	50	20	IDGD	
Cc1nc2ccc(S(=O)(=O)NNC(=O)C(=O)NCc3ccc(Cl)cc3)cc2s1	793415457	KNZICLXYDGMZCU-UHFFFAOYSA-N	438.918	1.884	50	20	IDGD	
Cc1ccc([N+](=O)[O-])c(OCCC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c1	798317113	UYOLASRDBNRQEF-UHFFFAOYSA-N	425.401	1.380	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)Nc2ccc(O[C@H]3CCN(C)C3=O)cc2C)cc1	799241868	VWQSYAGKLVUGIR-IBGZPJMESA-N	442.472	1.845	50	20	IDGD	
CCOc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NNC(=O)COc1cc(C)ccc1C	799257765	RTLLAXMNFMAQNG-UHFFFAOYSA-N	430.417	1.775	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN([C@H](CNC(=O)NNC(=O)C(C)(C)C)C(F)(F)F)CC1	801016257	UECCJUHEHGUOIQ-GFCCVEGCSA-N	439.479	1.847	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2nn(-c3ccc(F)cc3)cc2C)n1	801449711	PBZVTKGOIPSUOK-UHFFFAOYSA-N	431.449	1.632	50	20	IDGD	
C[C@@H](Oc1ccc(C=O)cc1)C(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	803101747	IVZSCUXXDBRCLW-OAHLLOKOSA-N	434.493	1.902	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cnn(C)c2-c2ccccc2)cc1	806974678	FJTDLUALYCWCLE-HNNXBMFYSA-N	449.467	1.843	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)Cn1cc(Cl)cn1	807093042	ICCICPQUJXKKRS-UHFFFAOYSA-N	425.320	1.155	50	20	IDGD	
C/C(C=NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C)=C/c1ccccc1OC(F)F	811645697	WDGAEAPAUVIGFM-LMNDOEFESA-N	446.414	1.241	50	20	IDGD	
CC1(C)NC(=O)N(c2cccc(NC(=O)NNC(=O)[C@H]3COc4ccccc4O3)c2)C1=O	812974907	RMHXNYLVCVZTOB-MRXNPFEDSA-N	439.428	1.514	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(C)cnc2Br)c(OC)c1	812980670	VLAIQPYYJMWGSX-UHFFFAOYSA-N	437.250	1.569	50	20	IDGD	
O=C(COC(=O)c1ccccc1NC(=O)C1CC1)NNC(=O)c1cccc([N+](=O)[O-])c1	815518260	HAPPMCOUVKBOBT-UHFFFAOYSA-N	426.385	1.561	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)cc1)C1CC1	815566114	JLFYZJSHGBDPKR-ZDUSSCGKSA-N	442.447	1.894	50	20	IDGD	
Cc1nn([C@H]2CCS(=O)(=O)C2)c2nc(C3CC3)cc(C(=O)NNC(=O)CC3CC3)c12	819109821	KVVIKVHORFWOIN-AWEZNQCLSA-N	431.518	1.538	50	20	IDGD	
O=C(CNc1ccccc1)NNC(=O)CNS(=O)(=O)c1c(Cl)cccc1Cl	823327583	SSIGTXYXQVCGCX-UHFFFAOYSA-N	431.301	1.531	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(Br)cc1)NNc1ccccc1[N+](=O)[O-]	913105374	PYAGTOBCVLWROE-UHFFFAOYSA-N	429.252	1.779	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)c2ccc3c(c2)C(=O)N(Cc2ccco2)C3=O)cc1	913429759	ZALUNBLBELYUAU-UHFFFAOYSA-N	448.435	1.958	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)[C@H]2CCCN(C(=O)Cc3ccccc3)C2)nc2ccccc21	914750533	KWFPMSVWCXUWAT-SFHVURJKSA-N	433.512	1.745	50	20	IDGD	
COc1ccnc(NNC(=O)CCNS(=O)(=O)c2ccc(Br)cc2)n1	914861313	KGNFHHSVVRNHGQ-UHFFFAOYSA-N	430.284	1.059	50	20	IDGD	
O=C(COC(=O)Cn1cc(Br)ccc1=O)NNC(=O)c1cccc(Cl)c1	915034455	JZONNKIVUASWMP-UHFFFAOYSA-N	442.653	1.269	50	20	IDGD	
Cc1oc(C(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1S(=O)(=O)N1CCCC1	915834237	RSTQHZXNLYAUGX-UHFFFAOYSA-N	435.458	1.219	50	20	IDGD	
COC(=O)CCCNC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	915894215	ICZMGQWCJHPAMC-UHFFFAOYSA-N	440.503	1.446	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NCCN1CCN(Cc2ccccc2)CC1	915900963	AITLERIIDIEANV-GOSISDBHSA-N	443.523	1.741	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2ccc(-c3ccccc3)nc2O)ccc1Cl	916133318	FOSIYQAVKCQLJR-UHFFFAOYSA-N	446.872	1.830	50	20	IDGD	
CC(=NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)c1cccc(-n2cnnn2)c1	916320644	FAJBIUKSKWIDSN-UHFFFAOYSA-N	439.501	1.601	50	20	IDGD	
CC(C)N(C)Cc1ccccc1CNC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	916386817	GOLIFKGEFRKMLX-UHFFFAOYSA-N	436.516	1.918	50	20	IDGD	
O=C(NC[C@@H](c1ccccc1)N1CCOCC1)NNC(=O)[C@H]1COc2ccccc2O1	916510043	ZUPMJPTUXZIIEJ-FXAWDEMLSA-N	426.473	1.230	50	20	IDGD	
O=C(NCCN1CCN(c2ccccc2)CC1)NNC(=O)c1nn(-c2ccccc2)cc1O	916514318	ATNQFONYVCKRRW-UHFFFAOYSA-N	449.515	1.344	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCc2cccc(CN(C)C)c2)nc1	916568955	QPJTZSQHAIEGPX-UHFFFAOYSA-N	434.566	2.000	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNC(=O)NCCS(=O)(=O)NC(C)(C)C)cc1	916622493	VKNQCJRDTOZAJA-UHFFFAOYSA-N	428.555	1.773	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)NCCCn3nc4n(c3=O)CCCC4)n[nH]2)cc1	916650161	QHAYKWHPQVQOBV-UHFFFAOYSA-N	438.492	1.114	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)CNC(=O)OCC(F)(F)F	917496404	GFDVCWMTZISUPP-QMMMGPOBSA-N	442.188	1.652	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)c2ccc(Br)cc2n1	917624963	INOXHKQHUXGMTG-SNVBAGLBSA-N	426.292	1.501	50	20	IDGD	
C[C@H]1C[C@@H](C)CN(C(C)(C)CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)C1	919788926	XEILYQJCMALTPC-GASCZTMLSA-N	438.598	1.680	50	20	IDGD	
O=C(CC1(CC(=O)N2CCOCC2)CCCC1)NNC(=O)[C@H]1COc2ccccc2O1	1248521212	FFIZUAFCLIWSBS-GOSISDBHSA-N	431.489	1.173	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Nc2ccccc2S(=O)(=O)N1)c1cc(F)ccc1Br	1252614381	HTIILRQEEPTLSP-CYBMUJFWSA-N	443.254	1.079	50	20	IDGD	
O=C1CCc2ccc(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)[C@H](F)Cl)C4)nc2N1	1777818957	NWKMDSZVLYDINS-PTSWNOGYSA-N	438.887	1.628	50	20	IDGD	
O=C(c1cccc(OC2CCOCC2)n1)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Cl)CCO2	1779904004	MEMKHMKUHNLDKF-FXAWDEMLSA-N	441.887	1.617	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(OC)n(C)n2)C1	1780241546	TYBJYQMXCHNVLH-YYFZDKIDSA-N	426.945	1.964	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)Cc3cn4nc(C)sc4n3)CCO2)C1	1781214652	BALIQTVOQABNDJ-KBXCAEBGSA-N	425.942	1.489	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H]1[C@@H](O)CCN1Cc1ccccc1)CCO2	1781219387	MSGBYKDULMMIHV-IHFIDZABSA-N	449.979	1.469	50	20	IDGD	
Cn1nc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)c2c1CCC2	1781230650	XYPNQNLXNMRVAS-RBUKOAKNSA-N	429.348	1.589	50	20	IDGD	
O=C(c1ccc2[nH]ccc2n1)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781332135	UJUPAXAGBTXZGT-RHSMWYFYSA-N	425.258	1.697	50	20	IDGD	
C[C@H](O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C(C#N)=C/c2ccc(F)cc2F)C1	1781599112	ZETHRDOAAFRTKB-IQAHDMLFSA-N	433.455	1.766	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccccc3-n3nccn3)C2)C1	1781840483	VFTGRKQTPDJONU-AUUYWEPGSA-N	448.321	1.494	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@@]2(C1)CN(C(=O)c1cc(O)n[nH]1)CCO2	1782864990	ZTDMOOPBWMGISB-NPZXAABXSA-N	443.410	1.444	50	20	IDGD	
C[C@@H](CC(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2)c1ccccc1	1783278809	ADKTUHJWYQVATM-MHECFPHRSA-N	436.317	1.004	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)CCc3ccnc(OC)c3)CCO2)C1	1783872609	CWSBLRNYDXKSMQ-UZLBHIALSA-N	425.913	1.107	50	20	IDGD	
O=C(C(Cl)Cl)N1CC[C@]2(C1)CN(C(=O)[C@H]1CC(c3ccccc3)=NN1)CCO2	1783949274	IMCBFUIKPZDLHD-BEFAXECRSA-N	425.316	1.386	50	20	IDGD	
CNc1nsnc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]2C1	1783964056	IQRMKAGWUMWQOX-RHYQMDGZSA-N	446.371	1.204	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)n3ccnc3)[C@H]2C1	1784253672	FTPLJDVYPAWMHP-OWYFMNJBSA-N	427.343	1.455	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Cl)C[C@@H]21)[C@@H]1CC(=O)N(C2CCCC2)C1	1784967869	PJJUNCWWKHAOID-RXXJBJGQSA-N	429.920	1.292	50	20	IDGD	
Cn1cnc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]3C2)c1C(F)(F)F	1787447185	QCZWHMLNTAUPSA-AVWBDOJWSA-N	426.798	1.567	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])o3)CCC2)cc1)c1ccc(B(O)O)cc1	1788139724	XDALEFQPURYWTN-UHFFFAOYSA-N	449.228	1.929	50	20	IDGD	
C[C@@H](Nc1ccccn1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21	1788779510	RZKBIPUTPKNLIR-UGUYLWEFSA-N	439.354	1.647	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21)c1ccc(Br)cn1	1788831508	BTCGRGZWUGJUPW-RETIQXCHSA-N	434.693	1.972	50	20	IDGD	
CCOC(CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]2C1)OCC	1789873304	UDHVBFZKSBQPDM-XLPNERPQSA-N	439.380	1.992	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CCc4nc[nH]c4C3)C[C@@H]21	1791064651	BIPGNNSYXUCPHB-RVFOSREFSA-N	439.354	1.278	50	20	IDGD	
COc1ccc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]3C2)c(C#N)c1	1791296346	DUAARHVSTQAUQB-JQFCIGGWSA-N	440.327	1.893	50	20	IDGD	
Cc1cnn([C@@H](C)C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]32)c1	1791596918	MSXNOYFENYMOKL-GMHRPJKWSA-N	431.364	1.969	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1ccc(C2(NC(=O)c3ccc(O)nc3)CCC2)cc1	1791601289	ZIHQTFZRJSPERG-UHFFFAOYSA-N	425.489	1.908	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCc1ccc(C#N)cc1	1792425774	AGMZDDGASMFCIO-UEILYKACSA-N	434.334	1.864	50	20	IDGD	
COC(=O)CCCCCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)CBr	1792871866	BCHUQLOAQGPEKE-AFIMGQEJSA-N	447.370	1.731	50	20	IDGD	
COC(OC)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)C2	1793174614	JOYHVBVBUFIIQS-INHOUBOVSA-N	435.427	1.080	50	20	IDGD	
COc1ccc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Br)C3)cc1	1795129742	HIGLOTYLBJAIPH-LTCOOKNTSA-N	443.313	1.908	50	20	IDGD	
Cc1ccc(SCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)cc1	1796191500	RCPGATWFSOPBAD-ACDBMABISA-N	438.358	1.719	50	20	IDGD	
COC(=O)N(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Cl)Cc1ccccc1	1796369259	WDXDJFYJYNGHTK-MVJTYMMSSA-N	441.887	1.379	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc3cn[nH]c3cn1)C2	1796892500	IMFMDGPTHWVGCK-CABXZLHPSA-N	448.487	1.344	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1ccc2[nH]ccc2n1	1797397386	AOZKCYWNHPCUOQ-OWLDWWDNSA-N	425.258	1.457	50	20	IDGD	
Cc1cnc2c(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)CO[Si](C)(C)C)C4)cnn2c1	1797420034	CHUWHRZTSXMZKS-JLVBRIDZSA-N	431.569	1.092	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1[C@H]2Sc3ccccc3[C@H]21	1797771855	SUKFITKUHUDSDG-JLNKEJEHSA-N	436.961	1.718	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1sccc1Cl)C2	1798440008	SJLDNOSZIMVIGK-ZSBIGDGJSA-N	433.921	1.966	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(C(F)(F)F)[nH]1)c1ccc(B(O)O)cc1	1798663568	JXFDDHKYJWCNAO-QDMKHBRRSA-N	435.211	1.279	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(C)(C)NC(=O)OC(C)(C)C)C2	1799263100	FIWAZULDTPCAQX-XGUBFFRZSA-N	431.961	1.897	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CCc3nc[nH]c3C1)C2	1799278329	ATBSVVZMMHQJOJ-OVFJVZGRSA-N	429.348	1.341	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1COc3ccccc3O1)C2)[C@@H](F)Br	1799344786	VROOMSMWYYPBDW-LZYVBGRKSA-N	443.269	1.107	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(O)cc1F	1799568707	WQJRZVKJBIXYRJ-YHYOWMERSA-N	429.286	1.908	50	20	IDGD	
COc1cc(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](O)CCl)C3)ccc1[N+](=O)[O-]	1800045699	DHJWXZPQJLSJEJ-FQLMCAECSA-N	425.869	1.384	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Cn1cccn1)C2	1800640305	QEKKCHCJOBSLJO-RBZJEDDUSA-N	427.343	1.282	50	20	IDGD	
CC(C)[C@H]1CC[C@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2ccc(B(O)O)cc2)C3)CC1	1800654488	HIQWOQWUJXJWDQ-IIHZSMLWSA-N	442.365	1.032	50	20	IDGD	
Cc1cccn2ncc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)CCC(=O)NN(C)C)C4)c12	1801155149	YEUDETBOYBEESX-BJWYYQGGSA-N	426.521	1.268	50	20	IDGD	
C#CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](Cl)CC)C2	1802129078	YSRTYDQNOITMRV-ZHCJQAHYSA-N	441.956	1.510	50	20	IDGD	
C/C(=C\c1cccnc1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnccc1C(=O)NN)C2	1802946942	ASYMXSSRPNKVQI-XOXKHUMBSA-N	434.500	1.435	50	20	IDGD	
CCOc1ccc(C(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)nn1	1803142045	WSIYDPXZXPWJKO-HFTRVMKXSA-N	433.896	1.190	50	20	IDGD	
Cc1nc(C(=O)NC[C@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)co1	1805691293	VQCCYELJRWRPKJ-DNVCBOLYSA-N	449.471	1.010	50	20	IDGD	
CC(F)(F)C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1	1806962816	LUDYVRAVLRZXNW-BBRMVZONSA-N	432.431	1.055	50	20	IDGD	
O=C(CCN1CCCCC1)N1CCCC2(CCN(C(=O)c3cccc(B(O)O)c3)CC2)C1	1809318341	NVLDIVTVDSLBKM-UHFFFAOYSA-N	441.381	1.087	50	20	IDGD	
CC(C)c1cc(C(=O)N2CCC3(CCCN(C(=O)c4ccc(B(O)O)cc4)C3)CC2)on1	1809971539	YUJUPIJVEFDUPI-UHFFFAOYSA-N	439.321	1.636	50	20	IDGD	
N#CC1(C(=O)N2CC[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)CCC1	1810309417	QWPFHTGNFBVQTN-QFBILLFUSA-N	447.499	1.094	50	20	IDGD	
O=C(c1cnc(C(F)(F)F)cn1)N1CCCC2(CCN(C(=O)[C@@H](O)CCl)CC2)C1	1810424133	MUZAWPVQSRRIHI-ZDUSSCGKSA-N	434.846	1.940	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)CC(F)(F)C(=O)O)[C@H]1c1cccnc1	1812865435	YKDWEPLNFXSZPZ-SUHUHFCYSA-N	448.264	1.981	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)C2CC(C)(C)C2)[C@@H]1c1cccnc1	1813130090	VVANMEHOBQTDGE-UTKZUKDTSA-N	429.565	1.897	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)C(=O)c2ccccc2)[nH]n1)c1cccc(B(O)O)c1	1817473104	GBNQFVDOLUUPBV-IBGZPJMESA-N	446.272	1.278	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)C(Cl)Cl)CC2)c1nc2ncccn2n1	1818310136	FCKKSXIGUAHUEG-ZETCQYMHSA-N	426.289	1.610	50	20	IDGD	
Cc1cnc2c(C(=O)Nc3cc([C@@H]4CCCCN4C(=O)[C@H](O)CCl)[nH]n3)cnn2c1	1819070970	JNZAYPZQRUIAEP-LSDHHAIUSA-N	431.884	1.666	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](O)NC(=O)OCC)n[nH]1	1819238368	UQXSZWFBLOMFKD-NORZTCDRSA-N	429.905	1.874	50	20	IDGD	
Cc1nc2sccn2c1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](O)CCl)CC2	1819352179	XBLUYBJCOWEROZ-ONGXEEELSA-N	439.950	1.986	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819403804	GMMGWQCUGZXYFG-UKRRQHHQSA-N	433.900	1.732	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H]2CCCS2)[nH]n1	1819404425	KEIDTDYONKNHGU-HZPDHXFCSA-N	443.533	1.610	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)C2=COCC2)n[nH]1	1822985733	FLTVSFQHXSJNRY-INIZCTEOSA-N	425.449	1.018	50	20	IDGD	
O=C(CN1CCCC1=O)N[C@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1	1823004053	OWJFSVWDAMXEMA-SDBXPKJASA-N	433.303	1.368	50	20	IDGD	
O=C(CC[C@@H]1CCOC1)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1823028983	WASPHTXBCDVISH-BEFAXECRSA-N	440.309	1.212	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H]2CNC(=O)O2)CC1	1824569576	PNXXQKJJROUTRI-CFVMTHIKSA-N	430.343	1.746	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCN1CCOC1=O)CC2	1825640027	CUJXBSISNQEJRO-UWVGGRQHSA-N	445.339	1.681	50	20	IDGD	
Cc1cc(CC(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)on1	1827050060	GTSXOIQXRJJKIT-NRFANRHFSA-N	439.321	1.139	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)C2CC(F)(F)C2)CC1	1828922069	KEEQQWWWWQIZGT-GOSISDBHSA-N	449.502	1.964	50	20	IDGD	
C[C@@H]1CC[C@H](C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)CC2)O1	1828923973	DTASDXIKDYECLT-UIAACRFSSA-N	443.548	1.486	50	20	IDGD	
O=C(Cc1ccc(Cl)c(F)c1)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1	1830291311	QUZKEGKGSJRDMU-VQIMIIECSA-N	449.306	1.078	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CN2C(=O)C=CC2=O)CC1	1830321780	ROXILNPLCFAYQB-YWZLYKJASA-N	444.359	1.767	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2[C@H]3C=CS[C@@H]32)CC1	1831152363	HHYDVXDKWVGLJB-MHTWAQMVSA-N	440.374	1.475	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4c(c3)CNC4=O)C2)C1	1831649725	AXLZKQAAVOSNIO-GCJKJVERSA-N	449.935	1.408	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(F)s3)CCO2)C1	1833218266	ASECJRZBVPZKJJ-BZNIZROVSA-N	435.315	1.741	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cc4cccn4cn3)CC2)CC1)[C@H](O)CCl	1833310572	RYKNRUBLRDGUPN-LJQANCHMSA-N	433.940	1.119	50	20	IDGD	
CCN(CC)C[C@@H](C)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)CCl)CC2)CC1	1833311649	BOKWUCBNUYBAPZ-APWZRJJASA-N	431.021	1.136	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H]3Cc4ccccc4N3)CC2)CC1)[C@H](O)CCl	1833312630	ZMVXKVFJPONXNP-VQTJNVASSA-N	434.968	1.195	50	20	IDGD	
Cc1noc(CC(=O)NC2CCN(C3CCN(C(=O)CO[Si](C)(C)C)CC3)CC2)n1	1834851400	SHIAHKUWSPRGHQ-UHFFFAOYSA-N	437.617	1.344	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccccc3Cl)CCO2)C1	1835013671	FMIJLGQOSFPYMM-XLIONFOSSA-N	445.343	1.593	50	20	IDGD	
CNc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](Cl)COC)C3)C2)cc1	1835610084	IOFFILIXTZTKFX-YLJYHZDGSA-N	425.913	1.052	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)c3cc(O)no3)CC2)CC1	1835973183	LPXAYMIRGRVEKG-LBPRGKRZSA-N	443.342	1.596	50	20	IDGD	
CCc1[nH]nc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](Cl)CC)C3)C2)c1Cl	1836230779	DXXYTRMVUTXVMR-SGTLLEGYSA-N	433.336	1.713	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc4ncccn4n3)CCO2)C1	1836866280	DZABMMPEJZEOBW-HXUWFJFHSA-N	435.912	1.064	50	20	IDGD	
C=C[C@@H](O)C(C)(C)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](Cl)COC)CC2)CC1	1838386197	BVKCERHUDYTCQG-ZWKOTPCHSA-N	430.973	1.812	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(O)c([N+](=O)[O-])c3)C2)C1	1839147507	SWLNDFGXORXMTG-IFXJQAMLSA-N	441.868	1.388	50	20	IDGD	
C=CCSCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839199020	QIDDWOJQOBEJHE-DZGCQCFKSA-N	425.320	1.053	50	20	IDGD	
Cc1nc(C)c(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)o1	1839200572	MMLVYZPSFXPYMJ-CJNGLKHVSA-N	434.262	1.052	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3n[nH]c(C)c3F)C2)C1	1839962698	OLUGGJZZZUZDMA-SJCJKPOMSA-N	447.305	1.101	50	20	IDGD	
Cc1ccc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)o1	1840036828	RMQFBPSRBXGKIO-KDOFPFPSSA-N	429.311	1.370	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(OC)c3)C2)C1	1840154361	VLJHKKHHIOWDKL-FXAWDEMLSA-N	426.897	1.019	50	20	IDGD	
O=C(c1cc2cccn2cn1)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840188537	OMVXACCLYAMZOQ-GOSISDBHSA-N	427.288	1.208	50	20	IDGD	
O=C(C1CC2(CCC2)C1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1840604393	DPBWIJINAVEIQY-KBXCAEBGSA-N	433.318	1.714	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(CO)c(F)c3)CCO2)C1	1840783724	YKNDMOQNIFUFSX-OXJNMPFZSA-N	428.888	1.405	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1CCCSC1)CCO2	1840867881	SCLRRVNORFBLSZ-VKJFTORMSA-N	449.411	1.760	50	20	IDGD	
COc1ccc([C@@H](O)C(=O)N2CCCC23CN(C(=O)[C@@H](C)CBr)C3)cc1	1841181829	NHPOUYHNCLKLNK-XJKSGUPXSA-N	425.323	1.963	50	20	IDGD	
Cc1ccc(=O)n(C(C)(C)C(=O)N2CC3(CCCN3C(=O)[C@@H](C)CBr)C2)n1	1841287675	AMCCQDBYANYARC-ZDUSSCGKSA-N	439.354	1.521	50	20	IDGD	
CC(=O)N(C)CCC(=O)N1CCCC12CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)C2	1841837651	FRRNMYMTCOLYSW-LICLKQGHSA-N	430.455	1.944	50	20	IDGD	
O=C([C@@H]1C[C@H]1c1ccc(Cl)cc1)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843013947	HGEJYTXQGPOQNX-VQTJNVASSA-N	438.720	1.641	50	20	IDGD	
CN(CC(=O)N1CCCC12CN(C(=O)[C@@H]1CC=CCC1)C2)NC(=O)NCc1ccccc1	1845038340	RDTPRJMJRJEYBY-HXUWFJFHSA-N	439.560	1.892	50	20	IDGD	
COC(=O)Nc1cccc(C(=O)N2CCCC23CN(C(=O)CCC(=O)NN(C)C)C3)c1	1845275057	DEBGVPZOMSCYFI-UHFFFAOYSA-N	431.493	1.055	50	20	IDGD	
COc1ccc(/C=C/C(=O)N2CCCC23CN(C(=O)c2ccc(B(O)O)cc2)C3)c(F)c1	1846244337	INLFXDNVVZSMSL-UXBLZVDNSA-N	438.264	1.045	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@]1(NC(=O)OC(C)(C)C)CCOC1)C2	1846364048	USCACJSZSWGCQA-VBKZILBWSA-N	445.944	1.127	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@]2(O)CCN(C(=O)OC(C)(C)C)C2)C1	1846410353	NYJIVKWKFPQAFL-YCRPNKLZSA-N	443.972	1.969	50	20	IDGD	
Cn1c(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](O)CCl)cc2c1-c1ncccc1OC2	1847559008	GXAYLYXVYIBBPI-OFQRWUPVSA-N	430.892	1.395	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1c(F)ccnc1Cl	1848284496	QKBLTLCAZLQOTN-KBPBESRZSA-N	432.843	1.002	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)c1cccnc1N1CCOCC1	14322565	PWPWIWNSJJEKGA-UHFFFAOYSA-N	435.278	1.521	50	20	IDGD	
O=C(NNC(=O)c1ccc2[nH]nnc2c1)c1cccc(S(=O)(=O)N2CCCCC2)c1	24153966	AGTYFKMNVIRUFP-UHFFFAOYSA-N	428.474	1.207	50	20	IDGD	
CON(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(-c3ccccc3)on2)c1	27262255	OJHMJPINCNXPLT-UHFFFAOYSA-N	430.442	1.598	50	20	IDGD	
CS(=O)(=O)Nc1cc(C(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)ccc1F	725994688	ZQSNYTAXAGAIRY-UHFFFAOYSA-N	443.840	1.469	50	20	IDGD	
CN(CC(=O)NNC(=S)Nc1cccc(Cl)c1)C1=NS(=O)(=O)c2ccccc21	726098760	QGLHYBIKZFRQOC-UHFFFAOYSA-N	437.934	1.739	50	20	IDGD	
Cc1nc2nc(C(F)(F)F)nn2c(C)c1CCC(=O)NNC(=S)NCC1CCC1	727867041	MFUSCSYTYHLLFC-UHFFFAOYSA-N	429.472	1.988	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)COc3ccccc3C#N)cc2)CC1	728213430	KYFXQLAZPSZQBE-UHFFFAOYSA-N	429.502	1.016	50	20	IDGD	
CC(C)(C)CC(=O)NNS(=O)(=O)c1cc(S(C)(=O)=O)ccc1Br	728509344	JEZBJABDBHZWDW-UHFFFAOYSA-N	427.342	1.598	50	20	IDGD	
COc1ccc(CCN2C[C@@H](C(=O)NNC(=O)c3cccc(C#N)c3)CC2=O)cc1OC	728827259	KNWAXHOOJJIOCR-SFHVURJKSA-N	436.468	1.428	50	20	IDGD	
Cn1cnnc1SCC(=O)Nc1cccc(C(=O)NNC(=O)c2cccc(C#N)c2)c1	728871749	CFDCKZDCLPFFKE-UHFFFAOYSA-N	435.469	1.492	50	20	IDGD	
C=CCNS(=O)(=O)c1cccc(C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)c1	728974427	NMOQPINGYYJQHI-UHFFFAOYSA-N	445.469	1.904	50	20	IDGD	
CN(C)[C@H](CNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)Cc1ccccc1	729044956	PKGZEGKWGFGDAX-IBGZPJMESA-N	425.537	1.196	50	20	IDGD	
O=C(NNC(=O)[C@@H]1C[C@@H](O)CN1C(=O)OCc1ccccc1)c1ccc2ccccc2n1	729282243	NLQKVVTZXSXCIJ-XLIONFOSSA-N	434.452	1.768	50	20	IDGD	
Cc1noc(CCCC(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)n1	729298452	HHHKRIZAEHQFFI-UHFFFAOYSA-N	446.467	1.920	50	20	IDGD	
CN(C)c1ccc(NC(=S)NNC(=O)c2cccc(N3CCCS3(=O)=O)c2)cc1	729689545	MKAXXGLDLKSPLC-UHFFFAOYSA-N	433.559	1.924	50	20	IDGD	
COc1cccc([C@@H](CNC(=O)NNC(=O)COc2ccccc2O)N2CCCC2)c1	730904745	PFIYYEYZEBCXIU-GOSISDBHSA-N	428.489	1.947	50	20	IDGD	
Cc1nc(S(=O)(=O)N2CCC(C(=O)NNC(=O)C(C)(C)c3ccccc3)CC2)cn1C	731173310	LLLOKIHXZVNIPQ-UHFFFAOYSA-N	447.561	1.254	50	20	IDGD	
CC(=O)c1cccc(S(=O)(=O)NCCC(=O)NNC(=O)C(C)(C)c2ccccc2)c1	731231431	PKSYWHSPEFINMY-UHFFFAOYSA-N	431.514	1.683	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)NCc1ccccc1OCCN1CCOCC1	731361802	YEHOXHGTNUFKOB-UHFFFAOYSA-N	430.480	1.610	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)c2cccc(S(=O)(=O)CC(F)F)c2)cc1	731532433	ZGTPKURCNKIJOF-UHFFFAOYSA-N	440.424	1.652	50	20	IDGD	
Cc1cccc2nc(CNC(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)cn12	731761869	KYEPWTSNNSNSRA-UHFFFAOYSA-N	430.490	1.037	50	20	IDGD	
CC(=O)Nc1cc(Cl)ccc1C(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	732337897	WWAKLZAQKAXQBK-UHFFFAOYSA-N	434.792	1.825	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)N[C@@H](Cc1ccccc1)CN1CCOCC1	732476735	UZRABALVUZZEQL-IBGZPJMESA-N	430.480	1.478	50	20	IDGD	
CCOCCCN1CC[C@H](NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)[C@H](C)C1	734544401	RORLUHIPIMBFHS-MJGOQNOKSA-N	447.584	1.160	50	20	IDGD	
COC(=O)[C@@H](NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)c1ccc(F)cc1	735506661	DJVPGACFTKHCJQ-SFHVURJKSA-N	435.477	1.759	50	20	IDGD	
COc1ccc(F)cc1CN1CCN(C(=O)NNC(=O)COCc2ccccc2)CC1	738497223	OXLVUBMAHQMGEC-UHFFFAOYSA-N	430.480	1.910	50	20	IDGD	
CCC(=NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1c(C)nn(C)c1C	741837529	LGRABARSKQOIQB-UHFFFAOYSA-N	433.534	1.602	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NC[C@@H](c2ccc(C)cc2)N(C)C)c2ccccc2c1=O	743334337	UVBIDHYPWMHBDI-IBGZPJMESA-N	436.516	1.972	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCCNC(=O)NNC(=O)Nc2ccc(N(C)C)cc2)cc1	743530728	PWPSSOHZKFNMCO-UHFFFAOYSA-N	434.522	1.375	50	20	IDGD	
CCCCN1C(=O)CC[C@H](C(=O)NNC(=O)C(=O)NC2CC2)[C@@H]1c1ccc(OC)cc1	744463434	DIWIJXZUFZVWJY-HKUYNNGSSA-N	430.505	1.201	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)[C@H]2CCCN(C(=O)c3ccc(F)cc3)C2)c1	744531181	LZFDOLNHEHMFFQ-SFHVURJKSA-N	441.459	1.991	50	20	IDGD	
C[C@@H]1C[C@@H](C)CN(C[C@@H](C)NC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)C1	745768333	VXFSITDIQKUAMK-RBSFLKMASA-N	425.555	1.792	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)NCCCN1CCC[C@@H](C(N)=O)C1	745828908	AWHLMNDKRHQFSZ-VQIMIIECSA-N	441.532	1.525	50	20	IDGD	
O=C(NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)N[C@@H]1CCc2c(O)cccc21	745865214	FPOQVSXFHSYIQR-GOSISDBHSA-N	444.513	1.808	50	20	IDGD	
CCO[C@H](CCNC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1)C(C)C	746421457	QWLUCDHXSLGZTF-QGZVFWFLSA-N	428.555	1.397	50	20	IDGD	
CC(C)NS(=O)(=O)CCNC(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccccc1	746527019	SXDIGCPLKNIQAC-QGOAFFKASA-N	440.529	1.815	50	20	IDGD	
CSc1nc(C(C)C)nc(C)c1C(=O)NNC(=O)c1csc(N2CCOCC2)n1	747200490	XXTZMTXZIJAOGQ-UHFFFAOYSA-N	436.563	1.998	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1)N[C@@H]1CCS(=O)(=O)C1	747979939	NPEVFDQJSIOECW-UXHICEINSA-N	442.541	1.131	50	20	IDGD	
CCn1cc(CC(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)c2ccccc21	748212420	MLDYJVZWGDJCPW-UHFFFAOYSA-N	434.905	1.966	50	20	IDGD	
N#CCCCS(=O)(=O)c1ccc(C(=O)NNC(=O)COc2ccc(C#N)cc2)cc1	748214476	SCMDMIJYXYCOIU-UHFFFAOYSA-N	426.454	1.476	50	20	IDGD	
COc1cccc(C(C)(C)CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1	750444779	AKNIXBFVSNKKNQ-UHFFFAOYSA-N	448.545	1.867	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)N[C@H]2CCN(CCCc3ccccc3)C2=O)nc2ccccc21	750662020	WKAQDZPJDMEHEA-IBGZPJMESA-N	448.527	1.680	50	20	IDGD	
CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)NNC(=O)CNC(=O)c2ccco2)CC1	751206777	MUVDRCAFJFXFQT-UHFFFAOYSA-N	429.433	1.615	50	20	IDGD	
CCOCCCn1c(NNC(=O)CN2C(=O)c3ccccc3C2=O)nc2ccccc2c1=O	752038660	HHLFZAYJPUDWPQ-UHFFFAOYSA-N	449.467	1.562	50	20	IDGD	
CCOC(=O)c1ccc(N2CC(NC(=O)NNC(=O)c3c(C)nc4ccccn34)C2)nc1	753281905	ZXHDMLWGKZGZHJ-UHFFFAOYSA-N	437.460	1.047	50	20	IDGD	
CC(=NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)c1ccc2c(c1)CCC(=O)N2C	754700529	LPIBFMMEGBSANP-UHFFFAOYSA-N	428.514	2.000	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)Cn2ccc3ccccc32)n([C@H]2CCS(=O)(=O)C2)n1	755529973	CPFKGWRNNTURGA-HNNXBMFYSA-N	430.490	1.359	50	20	IDGD	
CSc1nnnn1-c1cccc(NC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1	755734957	PLYXCOBFCGCXAL-OAHLLOKOSA-N	427.446	1.377	50	20	IDGD	
CCOC(=O)[C@@]1(NCC(=O)NNC(=O)c2ccc(OC)c(OC)c2)CCc2ccccc21	756599688	SWISUCUFADILAF-HSZRJFAPSA-N	441.484	1.459	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2cnn(CC(F)F)c2)c1	756704249	JCEAKZWYJQXPCY-UHFFFAOYSA-N	444.464	1.645	50	20	IDGD	
CCOC(=O)[C@H](C)NC(=O)c1ccc(NC(=O)NNC(=O)Cn2nc(C)cc2C)cc1	756790757	RWJXGAOZSVLOHF-AWEZNQCLSA-N	430.465	1.034	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccc(Br)cc21)c1ccc(-n2cnnn2)cc1	758096125	PWGKMFCVUGAFGA-AWEZNQCLSA-N	429.234	1.362	50	20	IDGD	
O=C(C1CC(OCc2ccccc2)C1)N1CCN(S(=O)(=O)CBr)CC1	758517407	KPHAZTHLLBMSFA-UHFFFAOYSA-N	431.352	1.808	50	20	IDGD	
Cc1nn(-c2ccccc2)cc1C(=O)N1CCN(S(=O)(=O)CBr)CC1	758528879	YSMGKUJSIJGSBI-UHFFFAOYSA-N	427.324	1.621	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)C(=O)Nc1ccccn1)Oc1cccc(Br)c1	758817037	QRVRCYHLRNWFMI-NSHDSACASA-N	436.266	1.581	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc2c(c1)nc(CCC(=O)NNc1ncccc1[N+](=O)[O-])n2C	759292996	YXQUONVEBZEZIY-UHFFFAOYSA-N	447.477	1.203	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)CCCn2cnc3cc(OC)c(OC)cc3c2=O)nc1	759721223	DLERVQMXPKWPBU-UHFFFAOYSA-N	441.444	1.519	50	20	IDGD	
Cc1ccnc(-n2nccc2NC(=O)C(=O)NNC(=O)C2=S=C3CC[C@H](C)CC3=C2)c1	760277716	PYKGUDBJBBGWSN-LBPRGKRZSA-N	438.513	1.500	50	20	IDGD	
C=CCNC(=O)NC(=O)COC(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccccc1	761396470	DXQHUYRLZBITPA-ATVHPVEESA-N	432.440	1.926	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)CNC(=O)NCc1ccc([N+](=O)[O-])cc1	761619543	QIKZXBXJTNFBKK-UHFFFAOYSA-N	447.473	1.342	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)N[C@H]2CCN(C(=O)C3CCCC3)C2)nc1	762386165	JKYSEGPCORYUNN-HNNXBMFYSA-N	438.554	1.186	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(OC)c(NC(=O)C(=O)NNC(=O)c2ccccc2)c1	763419462	FGUUYVHHTKGACK-UHFFFAOYSA-N	448.501	1.125	50	20	IDGD	
O=C(NNC(=O)c1ccncc1)C(=O)Nc1ccc(NC(=O)C2CC2)cc1C(F)(F)F	763466251	JKWAXGZUBRTXGZ-UHFFFAOYSA-N	435.362	1.849	50	20	IDGD	
CC(C)(C)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1	763573417	RZYVIQXYEZCQEF-QGZVFWFLSA-N	425.441	1.841	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(Cl)c(-n3nnnc3C3CC3)c2)c(C)o1	763584251	XGZHBUDZXATRQY-UHFFFAOYSA-N	443.851	1.803	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cc(C)n(-c3ccccc3)c2C)cn1C	763601960	PEWUCGDVMRQOMZ-UHFFFAOYSA-N	437.456	1.619	50	20	IDGD	
CCN1CCC(n2nccc2NC(=O)C(=O)NNC(=O)c2cc(C)nc3ccccc23)CC1	763615688	GDMUGLAXOSYMDE-UHFFFAOYSA-N	449.515	1.796	50	20	IDGD	
CS(=O)(=O)c1cccc(NC(=O)C(=O)NNC(=O)CC23CC4CC(CC(C4)C2)C3)c1	763732490	FTUYZYJZBFKVFQ-UHFFFAOYSA-N	433.530	1.783	50	20	IDGD	
CC[C@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(OC)cc(OC)c2)cc1	763772954	RCFHSNLGIFSNPQ-ZDUSSCGKSA-N	442.472	1.632	50	20	IDGD	
CCCOC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)cc1	763874003	YPCAONHZYKCEJK-ZDUSSCGKSA-N	431.420	1.946	50	20	IDGD	
O=C1Cc2cc(NC(=O)C(=O)NNC(=O)c3ccc(COc4ccccc4)o3)ccc2N1	763950105	QRUDJUFWMFNEMV-UHFFFAOYSA-N	434.408	1.753	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc(CN2C(=O)CCCC2=O)cc1	764040027	BPCNRXWZQCLIBN-UHFFFAOYSA-N	438.440	1.134	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cccc(N4CCCC4=O)c3)n[nH]2)cc1	764110779	KXWVNUFEQIFQKJ-UHFFFAOYSA-N	446.467	1.912	50	20	IDGD	
CC(=O)N(Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)cc1)C(C)C	764163100	HMTADVXBHDYTFE-FQEVSTJZSA-N	438.484	1.533	50	20	IDGD	
CCN1CCC(n2nccc2NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)CC1	764246254	ZIFLXFUIEVTBJQ-UHFFFAOYSA-N	437.504	1.281	50	20	IDGD	
COCCOc1ccc(C#N)cc1NC(=O)C(=O)NNC(=O)c1cccc2ncccc12	764257342	CUYWPECTZCHBAP-UHFFFAOYSA-N	433.424	1.531	50	20	IDGD	
Cc1cc(Br)c(NC(=O)C(=O)NNC(=O)Cc2ccccn2)cc1[N+](=O)[O-]	764271318	ZSWZYOREQDNEOR-UHFFFAOYSA-N	436.222	1.389	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NN=C1C(=O)Nc2c(F)ccc(Cl)c21	764827960	NNNFHTWXLOYDAE-UHFFFAOYSA-N	443.866	1.710	50	20	IDGD	
O=C(CCC(=O)N1CCN(c2ccccn2)CC1)NNC(=O)c1cccc(OC(F)F)c1	765406709	TZPYPWWVQMXDGA-UHFFFAOYSA-N	447.442	1.573	50	20	IDGD	
CCOC(=O)NNC(=O)C(=O)Nc1ccc(N2C(=O)c3ccccc3C2=O)c(Cl)c1	765408105	QSVXAOWPBRMSHX-UHFFFAOYSA-N	430.804	1.856	50	20	IDGD	
CC[C@@H](CC(=O)NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1)C(C)C	765727841	IXSWRVKXQFATHR-SFHVURJKSA-N	438.594	1.521	50	20	IDGD	
CON(C)S(=O)(=O)c1cc(C(=O)NNc2ccccc2S(C)(=O)=O)ccc1Cl	766662768	MNABYNABNULTAY-UHFFFAOYSA-N	447.922	1.682	50	20	IDGD	
CCOC(=O)c1ccc(N2CCN(CC(=O)NNC(=O)Cc3ccccc3C)CC2)nc1	766848860	NOYGFSDGCJOUCA-UHFFFAOYSA-N	439.516	1.079	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)c2ccccc2S(=O)(=O)CCN(C)C)c1C	767161221	FRKVEXODGQBKQU-QGZVFWFLSA-N	447.557	1.867	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1ccccc1	767236093	GZWWHXSIJCBEMK-HXUWFJFHSA-N	437.496	1.923	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)[C@@H]1CCCN1C(=O)OCC(F)(F)F	767328495	GOJXNLHDDWRHFI-AWEZNQCLSA-N	445.394	1.391	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)c2cnc3sccn3c2=O)cc1	767912231	MUSUGTUWSKQMCQ-UHFFFAOYSA-N	441.498	1.252	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)CCSc2ccc(F)cc2)n(-c2ncccn2)n1	768238282	QSHXBJWHQKMGQO-UHFFFAOYSA-N	443.464	1.378	50	20	IDGD	
CN(C)C(=O)COc1ccc(C(F)(F)C(=O)NNC(=O)COc2ccc(F)cc2)cc1	769356415	SIVJQOGFUHNMRU-UHFFFAOYSA-N	439.390	1.611	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)NCc3cccnc3N3CCOCC3)nc21	770342455	QYGWDWNGDZEJLA-UHFFFAOYSA-N	441.496	1.345	50	20	IDGD	
COC(=O)c1cc(N2CCOCC2)ccc1NC(=O)C(=O)NNc1c(C)cccc1F	770816434	VGZFWNNRBJVMPX-UHFFFAOYSA-N	430.436	1.839	50	20	IDGD	
Cc1oc(C(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)cc1S(=O)(=O)N(C)C	770967585	XPQYCZXTNPRUBH-UHFFFAOYSA-N	437.482	1.196	50	20	IDGD	
NC(=O)c1cc(OC2CCN(C(=O)NNC(=O)CCCc3ccccc3)CC2)ccn1	771966460	BZNOEEZEUVUFRS-UHFFFAOYSA-N	425.489	1.787	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1cccc(NC(=O)[C@H]2Cc3ccccc3O2)c1	772025711	RKFHUQZSSISNLS-FZKQIMNGSA-N	425.441	1.732	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)c1ccc(=O)n(-c2ccc(F)cc2)n1	772898812	SKVVVGBKOLKQJB-UHFFFAOYSA-N	443.822	1.102	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)c2nnn(-c3ccc4ncccc4c3)c2C)c1	773070049	LVKSWRCREGIPFP-UHFFFAOYSA-N	430.428	1.552	50	20	IDGD	
Cc1ccc(-n2nc(C)cc2NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)nn1	773500668	VKHUNRWLKYPWEA-UHFFFAOYSA-N	429.824	1.038	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(I)cn2)cc1	773525502	RBGNFVCUXUVUHY-UHFFFAOYSA-N	438.225	1.648	50	20	IDGD	
COc1cc(C)c(NC(=O)C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)cc1C	773627942	IXIKPFQCRWIWMX-UHFFFAOYSA-N	447.517	1.313	50	20	IDGD	
CN1CCN(C(=O)c2ccccc2NC(=O)C(=O)NNc2ccc3ccccc3n2)CC1	773661773	LWULJRTVBXDLFB-UHFFFAOYSA-N	432.484	1.704	50	20	IDGD	
CNS(=O)(=O)c1ccc2c(c1)N(C(=O)C(=O)NNc1ccc(C(F)(F)F)cc1)CC2	773762451	ZUGPAYBAXPCJOY-UHFFFAOYSA-N	442.419	1.646	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(Cl)c2S(C)(=O)=O)cc1F	773888359	GMWSADZVUMWVMD-UHFFFAOYSA-N	427.841	1.591	50	20	IDGD	
CCn1cc(-c2nn(C)cc2C(=O)NNC(=O)c2nn(CC)c(=O)c3ccccc23)cn1	778292475	BXGQDYBZPHFVOA-UHFFFAOYSA-N	434.460	1.108	50	20	IDGD	
CCCN(CC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)C[C@H]1COc2ccccc2O1	778513341	CTXJESVGLSLMGT-KRWDZBQOSA-N	428.445	1.908	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2cccc(C(=O)NNc3cc(Cl)nc(N)n3)c2)C[C@@H](C)O1	779373323	FMPOIEKVLIBBEC-PHIMTYICSA-N	440.913	1.267	50	20	IDGD	
CC(C)(C)OC(=O)NCc1nnc(SCC(=O)NNC(=O)c2cccc(C#N)c2)o1	780346011	ATZONXWMRHBKGU-UHFFFAOYSA-N	432.462	1.519	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2cccc(S(=O)(=O)NC(C)(C)C)c2C)nc1	782146022	SORDRTIJIOMAGZ-UHFFFAOYSA-N	435.506	1.557	50	20	IDGD	
Cc1cc(C)cc(NNC(=O)C(=O)Nc2cc(S(=O)(=O)N3CCOCC3)ccc2C)c1	783357403	WZOJRXCRXAQMCD-UHFFFAOYSA-N	446.529	1.715	50	20	IDGD	
N#CCCn1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)n1	783407383	BFRMXGWMLYRXLS-UHFFFAOYSA-N	430.368	1.172	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NN/C=C2\C(=O)NC(=O)c3ccccc32)cc1	783679274	LGVRATJAAGCWAS-YVLHZVERSA-N	434.481	1.653	50	20	IDGD	
CCn1cnc2c1c(=O)n(CC(=O)NN=C(C)[C@H]1CCCO1)c(=O)n2Cc1ccccc1	783811910	OBAKRINAVLLAHA-QGZVFWFLSA-N	438.488	1.099	50	20	IDGD	
O=C(NNC(=O)N1CCCN(c2ncccc2F)CC1)C1CCN(c2ncccn2)CC1	784075967	IPLSFMVVXQTILL-UHFFFAOYSA-N	442.499	1.180	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)[C@@H]2CC=CC[C@@H]2C(=O)N2CCOCC2)cc1	784294865	TYIBPFYUKWZTOX-AHRSYUTCSA-N	445.516	1.441	50	20	IDGD	
CSCCNC(=S)NNC(=O)c1cnn([C@@H]2CCCN(C(=O)OC(C)(C)C)C2)c1	784690006	CQGMAGRQLXWMLN-CQSZACIVSA-N	442.611	1.927	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(NC(=O)C(=O)NNc2ncccc2Cl)ccc1Cl	784820965	FMFZXXGAVXVLEL-UHFFFAOYSA-N	432.289	1.721	50	20	IDGD	
CNS(=O)(=O)c1ccc2c(c1)N(C(=O)C(=O)NNc1ccc(C#N)c(Cl)c1)CC2	785095363	VKDUPZHKFKWKLE-UHFFFAOYSA-N	433.877	1.152	50	20	IDGD	
C[C@@H]1[C@H](C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)CCN1C(=O)OC(C)(C)C	786257415	VSWRALPQNSIVPD-IUODEOHRSA-N	425.507	1.497	50	20	IDGD	
CCOc1nc2ccc(C(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)cc2[nH]1	788261740	QKBWLOORUYNYCP-UHFFFAOYSA-N	431.474	1.287	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2ccc(C#N)c(Br)c2)cc1OC	788476117	ABMKLGBRYOFILL-UHFFFAOYSA-N	440.275	1.961	50	20	IDGD	
O=C(NNc1nnc(-c2ccccn2)s1)[C@H]1CCN(c2ccc3c(c2)OCCO3)C1=O	788567697	QFDMKZIJMNXEKU-CYBMUJFWSA-N	438.469	1.868	50	20	IDGD	
Cc1cc(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)sc1Cl	788735746	MIJPRYZMEISJTI-UHFFFAOYSA-N	437.952	1.584	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c(OC(C)C)c1	789727232	LAXDGWKCYDXINI-UHFFFAOYSA-N	435.502	1.808	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccc3c2OCC[C@@H]3N(C)C)cc1C	789732697	UBZHQOANLFCNSA-IBGZPJMESA-N	440.500	1.854	50	20	IDGD	
CNC(=O)c1cc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)ccc1Cl	789809609	BLOQJZBPTAMAIJ-YOEHRIQHSA-N	444.875	1.358	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)nn1-c1ccccc1	789811415	ZJFCLXWGFGHBMM-ICSRJNTNSA-N	433.468	1.839	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)[C@@H]1CCN(c2cccc(Br)c2)C1=O	790063405	JFRCJWINHSKCPG-AWEZNQCLSA-N	442.310	1.739	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2cccc(N3CCC3=O)c2)cc1	790581895	VCHPALRNWCOSQK-UHFFFAOYSA-N	445.501	1.205	50	20	IDGD	
O=C(NCc1ccco1)Nc1ccc(NC(=O)C(=O)NNc2nc3ccccn3n2)cc1	792387796	HXMPCXGAOHBEQK-UHFFFAOYSA-N	434.416	1.726	50	20	IDGD	
O=C(NNC(=O)c1cccc(C(F)(F)F)c1)C(=O)Nc1ccc2c(c1F)CCNC2=O	793025158	ILISUNKENZQSMB-UHFFFAOYSA-N	438.337	1.530	50	20	IDGD	
Cc1cccc([C@H](CC(=O)NNC(=O)CNC(=O)OCc2ccccc2)NC(N)=O)c1	794062080	SSEJJIKDRKOWFO-KRWDZBQOSA-N	427.461	1.168	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)c2cc(S(=O)(=O)NCc3ccccc3)ccc2O)n1	794090567	WQJZASMFOKGJLB-UHFFFAOYSA-N	440.481	1.649	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)Nc1ccc(OC(F)F)c(C(F)(F)F)c1	797662739	CTXKDPQTJLOYSP-SSDOTTSWSA-N	431.339	1.894	50	20	IDGD	
COC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)c1C	798042471	UBXKIHWPRVIOLL-UHFFFAOYSA-N	436.428	1.963	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)[C@@H](C)NC(=O)CCc2ccccc2)c2ccccc2c1=O	799520201	OGDYNDNDBKUMLZ-MRXNPFEDSA-N	449.511	1.876	50	20	IDGD	
COCCOc1cncc(C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)c1	801103240	APCHYKLOOKUOPJ-UHFFFAOYSA-N	425.445	1.472	50	20	IDGD	
COCCOc1cncc(C(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)c1	801157316	CVHVCZNBYHZHQD-UHFFFAOYSA-N	437.497	1.450	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)N[C@@H](C)CCNS(=O)(=O)c2ccccc2)c1	801738231	NFQUVUPQAVBPIB-INIZCTEOSA-N	434.518	1.461	50	20	IDGD	
COc1cc(N2CCN(C(=O)NNC(=O)CNC(=O)c3cccs3)CC2)ccc1F	801748877	MZTLQLWPSKFPTP-UHFFFAOYSA-N	435.481	1.189	50	20	IDGD	
COc1ccc(-c2nn(CCC#N)cc2/C=C(/C#N)C(=O)NC[C@@](C)(O)CO)cc1OC	801976148	PCDQTUSZWVPVIH-FGWWRKRSSA-N	439.472	1.247	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)Cn2c(O)nc3ccccc3c2=O)cc1Cl	802072843	XLUJNIVKLBMHFU-UHFFFAOYSA-N	447.835	1.626	50	20	IDGD	
O=C(CN1C(=O)Cn2c(cc3ccccc32)C1=O)NNC(=O)Nc1ccc2c(c1)OCO2	802100955	DMCBFTACWIGQDQ-UHFFFAOYSA-N	435.396	1.205	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NCc2ccsc2Br)c2ccccc2c1=O	802329211	AISQHVISJBXHLX-UHFFFAOYSA-N	436.291	1.902	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)N2CCC[C@@H](CN(C)S(C)(=O)=O)C2)c1C	804184834	FSBNAXQSXCAQKX-TYJAPOHBSA-N	436.578	1.788	50	20	IDGD	
Cc1nc2c3cccnc3nn2c(C)c1CCC(=O)NNc1ccc(-n2ccnc2)nn1	804956024	VUCCWVPCJSHFKN-UHFFFAOYSA-N	428.460	1.946	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)Nc2cc(F)c(F)cc2N2CCOCC2)cc1	806712705	BDEDSEXOTOYIRN-UHFFFAOYSA-N	431.399	1.905	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)Nc1ccc(F)c(N2CCCNC2=O)c1	806804276	JLIIGSIYNXQHTI-UHFFFAOYSA-N	439.411	1.188	50	20	IDGD	
CN1CCN(C(=O)NNC(=O)c2nn(-c3cccc(Br)c3)c3c2CCC3)CC1	807380983	YWZGCDUWVVEHCX-UHFFFAOYSA-N	447.337	1.725	50	20	IDGD	
Cc1cc([N+](=O)[O-])ccc1NNC(=O)C(=O)Nc1cccc(CN2CCN(C)CC2)c1	807456003	SAUYKPUTNZLAPG-UHFFFAOYSA-N	426.477	1.732	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNc2nccnc2C2CCC2)cc1OC	807462057	HVRCJSXMJXIZEJ-UHFFFAOYSA-N	448.505	1.596	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)C(=O)Nc1ccc(Oc2cccnc2)cc1	808934863	WQYARYYZUXGVFN-UHFFFAOYSA-N	444.411	1.249	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)Nc2cc(C(N)=O)ccc2OCC(F)F)cc1	810341401	IQNBMIQCFZSICL-UHFFFAOYSA-N	438.387	1.670	50	20	IDGD	
O=C(CNS(=O)(=O)c1cccnc1)NNC(=O)c1ccc(Br)cc1Cl	810347064	PGSATMSDZBMHEW-UHFFFAOYSA-N	447.698	1.237	50	20	IDGD	
O=C(NNC(=O)c1ccccc1Br)C(=O)N1CCN(c2ccccc2)CC1	812446302	XFFVFKJXFPDJCO-UHFFFAOYSA-N	431.290	1.559	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)CSc2nnnn2C2CCCC2)cc1	812728498	NLCVOTVALICYCQ-UHFFFAOYSA-N	425.540	1.274	50	20	IDGD	
COc1cc(C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)cc(NC(C)=O)c1OC	812732076	RBDFSYVVIBRSLL-UHFFFAOYSA-N	436.490	1.669	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)N2CCN([C@@H](C)C(=O)NC3CC3)CC2)c1C	812757801	VICIGQGGGVEZAT-OFBHVFLISA-N	427.549	1.470	50	20	IDGD	
Cc1ccc(Cn2nccc2NC(=O)C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)o1	813034126	YNNWIWBVPKANAG-UHFFFAOYSA-N	446.489	1.165	50	20	IDGD	
CCCc1nnc(SCC(=O)NNC(=O)c2ccc(F)cc2Br)n1N	813416377	PCRJGRKSDFJQOF-UHFFFAOYSA-N	431.291	1.399	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2ccc(OC(C)(C)C)cn2)cc1	814211268	WXUQBAFSQKXJPT-UHFFFAOYSA-N	434.518	1.649	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)Nc1ccc(CS(C)(=O)=O)c(F)c1	814667549	KGIFCPPQKMBSLR-UHFFFAOYSA-N	444.510	1.769	50	20	IDGD	
CCc1nocc1C=NNC(=O)Cn1c(=O)c2c(ncn2CC)n(Cc2ccccc2)c1=O	814745699	DXCBMAOSHVJLAH-UHFFFAOYSA-N	449.471	1.129	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)N(C)C)cc1Cl	815751903	TZVWJAADKKOVLJ-UHFFFAOYSA-N	426.882	1.681	50	20	IDGD	
O=C(COC(=O)CCNS(=O)(=O)/C=C\c1ccccc1)NNC(=O)c1cccs1	834582410	MHILXPWJLJGCPF-XFXZXTDPSA-N	437.499	1.033	50	20	IDGD	
O=C(N1CC[C@H](B(O)O)C1)C1(S(=O)(=O)c2ccc(Br)cc2)CCCC1	864234699	UAARRWXISMAIOB-LBPRGKRZSA-N	430.129	1.611	50	20	IDGD	
C[C@@H](CN1CCOCC1)C(=O)NN/C=C1\C(=O)N(c2ccccn2)C(=O)c2ccccc21	912745195	CEVWWHLIFKVSTL-UYPHOHSBSA-N	435.484	1.199	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)CCNS(=O)(=O)/C=C\c1ccccc1	912861313	OQQURLHNSRYNPV-ZSMUJPCHSA-N	435.477	1.721	50	20	IDGD	
O=C(CNS(=O)(=O)c1cccc(Br)c1)NNC(=O)c1ccccc1F	913415860	YCNHJHCTEKBXEI-UHFFFAOYSA-N	430.255	1.328	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Cc2c(C)nc3c(c(C)nn3C)c2C)c2ccccc2c1=O	916091485	ARXHIZADSHHXAV-UHFFFAOYSA-N	447.499	1.627	50	20	IDGD	
CSc1nccn1-c1ccc(C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1	916124733	BQDWCLYAXAMHBW-UHFFFAOYSA-N	434.481	1.916	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)NCC[C@@](O)(c1nccn1C)C(F)(F)F	916377468	TZKPGSAGINAKCB-MRXNPFEDSA-N	449.817	1.866	50	20	IDGD	
N#Cc1cccc(CNC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1	916406608	GHYUTRKEFHQFHD-UHFFFAOYSA-N	427.486	1.487	50	20	IDGD	
NC(=O)c1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)cc1	916556249	NTYGFPZMFJCVLZ-UHFFFAOYSA-N	430.486	1.035	50	20	IDGD	
NS(=O)(=O)c1cccc(CNC(=O)NNC(=O)c2ccc(F)cc2Br)c1	918212227	YDQYWTAAPVXXSV-UHFFFAOYSA-N	445.270	1.380	50	20	IDGD	
COC1(C(=O)OCC(=O)NNC(=O)c2cccs2)CCN(C(=O)OC(C)(C)C)CC1	919520081	QGSBGYXPOVEHCK-UHFFFAOYSA-N	441.506	1.468	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1)c1ccccc1	919806963	XGDWPQLSXYEXME-OAHLLOKOSA-N	432.458	1.457	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)CN1C(=O)c2ccccc2N2C(=O)CC[C@]12C	919822373	PQIMZBOSUUNBMA-HSZRJFAPSA-N	436.468	1.384	50	20	IDGD	
O=C(N=c1cc[nH]cc1)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	919896770	IXGVCNOPONUKNM-UHFFFAOYSA-N	425.470	1.449	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCc2cccc(NC(=O)[C@@H]3CCCO3)c2)cc1OC	920236359	BEWCUSFGGGVWGG-SFHVURJKSA-N	442.472	1.966	50	20	IDGD	
CCCCNC(=O)NNC(=O)c1cc(C2CC2)nc2c1c(C)nn2[C@H]1CCS(=O)(=O)C1	920823166	STBZUASJWVMGIJ-AWEZNQCLSA-N	448.549	1.721	50	20	IDGD	
CC(=O)c1cccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)NCc3ccco3)CC2)c1	920856515	PNKMMHMEBCSONH-UHFFFAOYSA-N	448.501	1.414	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2ccccc2CN2C(=O)CNC2=O)cc1OC	920929477	RGJQOVWZVVNLGM-UHFFFAOYSA-N	427.417	1.222	50	20	IDGD	
COc1ccc(C=NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1OCC(N)=O	1116087801	JICXLHRALJWCGF-UHFFFAOYSA-N	434.493	1.657	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)c2cncn2-c2ccccc2)c1	1317724698	OYVCHUKRXDMUNX-UHFFFAOYSA-N	431.449	1.337	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NC1CCC2(CCOCC2)CC1	1319490628	RBPRBSFBQLTCLF-UHFFFAOYSA-N	437.566	1.972	50	20	IDGD	
Cc1cccc(C)c1C(=O)N1CCO[C@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1	1779036811	GDAQDSRKLMKDPL-QHCPKHFHSA-N	437.500	1.059	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)/C=C/C(=O)NCc3ccco3)C2)C1	1779207756	YKJMZKKYKOUYAB-QDYDYXSASA-N	437.924	1.689	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@]2(CN(C(=O)/C=C/C(=O)NCc3ccco3)CCO2)C1	1779298023	FAWXLPKDRSNTGV-IRUYWQDXSA-N	449.580	1.133	50	20	IDGD	
CCCC(=O)N[C@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)Br)C2	1779520503	SDWQGEOSKRVKGM-DEXNDLTESA-N	446.386	1.589	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)C3=Cc4ccccc4NC(=O)C3)C2)C1	1779991517	VIRNJLLUDKGCBT-JTSKRJEESA-N	447.919	1.496	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CNC(=O)C(F)(F)F)C2	1780709669	REFRZANZNVWGCZ-XHBSWPGZSA-N	427.851	1.196	50	20	IDGD	
Cn1nc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@](C)(Cl)CCl)C2)cc1O	1780710054	DMTWTFFNYSXXEU-FSPWUOQZSA-N	433.336	1.490	50	20	IDGD	
Cc1ccn(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@](C)(Cl)CCl)C2)n1	1780710464	WAEUHKUZUOTKBX-ATZDWAIDSA-N	431.364	1.942	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3nc4ccccc4n(C)c3=O)CCO2)C1	1781219397	OWIHQEDWFQQYSE-SZNDQCEHSA-N	432.908	1.394	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)c3cnn4c3OCCC4)CCO2)C1	1781233777	DPLAOTTYJFWTQS-ROUUACIJSA-N	431.320	1.345	50	20	IDGD	
COc1cc(F)ccc1CC(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781337736	VEYATKZILSJLKX-WMZOPIPTSA-N	447.276	1.897	50	20	IDGD	
Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1781983875	RUAIHEHIVAHTKK-RDTXWAMCSA-N	429.832	1.086	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cccc(-n4cncn4)c3)C2)C1	1782019403	VBKGREGTCILKKD-KUHUBIRLSA-N	448.321	1.494	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)ccc1O)C2	1782178454	JOOYEZUMOATRJI-WRWLIDTKSA-N	426.897	1.479	50	20	IDGD	
O=C([C@@H]1C=CCN1)N1CCO[C@@]2(CCN(C(=O)[C@H](Br)Cc3ccccc3)C2)C1	1783024165	UZSDYTKYTRHOPW-LVCYWYKZSA-N	448.361	1.351	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3sc(N)nc3C)CCO2)C1	1783342661	MTVMBLBGNBRVFK-MEDUHNTESA-N	431.356	1.651	50	20	IDGD	
CCCC(=O)N[C@H](C)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](Br)CC)C2)C1	1783348938	DIVVESWBVVUWKJ-LBTNJELSSA-N	432.359	1.295	50	20	IDGD	
Cc1nc2sccn2c1C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](C)Br)C2)C1	1783534535	VXUTYBRKLOIASY-APPDUMDISA-N	441.351	1.931	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(O)c([N+](=O)[O-])c3)CCO2)C1	1783537538	ONAODYVCVRYKDN-DIFFPNOSSA-N	442.266	1.527	50	20	IDGD	
COc1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](C)Br)C3)C2)cc(Cl)n1	1783538760	VPRXDBWWEDATFT-PIGZYNQJSA-N	446.729	1.971	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(OC(F)F)cn3)CCO2)C1	1783873409	OIFWDBYQRLHKAT-UGSOOPFHSA-N	433.839	1.380	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3n[nH]c4c(Cl)cccc34)CCO2)C1	1783882019	PAEFREIGUNFYPF-LIRRHRJNSA-N	441.315	1.914	50	20	IDGD	
C[C@@H](CC(=O)N1CCO[C@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1)c1ccccc1	1783937552	URUXETCABHESSU-MBSDFSHPSA-N	430.549	1.383	50	20	IDGD	
O=C(C(Cl)Cl)N1CC[C@@]2(C1)CN(C(=O)[C@@H]1C[C@@]13C(=O)Nc1ccccc13)CCO2	1783950095	KDOUIXXWGOCUKC-SVIJTADQSA-N	438.311	1.530	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CSc3ccc(F)cc3F)C[C@@H]21)[C@@H](O)CCl	1784085593	LOEKSMABGVLTBF-MZGVZZPPSA-N	448.919	1.636	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3c(C)noc3C)[C@H]2C1	1785087090	UKUQRXTUIHZEQC-HJWJTTGWSA-N	442.354	1.987	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(CO)c(F)c3)C2)C1	1785266077	IGKJQKISKBPXNP-XIKOKIGWSA-N	429.286	1.545	50	20	IDGD	
O=C(C[C@@H]1NC(=O)NC1=O)Nc1ccc(C2(NC(=O)[C@H](F)Br)CCC2)cc1	1786761728	JVMVBFVEBFMDDM-AAEUAGOBSA-N	441.257	1.409	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4occc4c3)C[C@@H]21)c1cccc(B(O)O)c1	1786982818	DFTGXLWTSFZIIZ-VCOUNFBDSA-N	448.284	1.020	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3[nH]ccc3C)C[C@@H]21	1787508765	LWOHSACJEQOCII-GZERKGCBSA-N	440.504	1.050	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnn4c3CCC4)C[C@@H]21)[C@@H](F)Br	1789925620	RXUIHUSSPIUSDE-HQRZJTNHSA-N	429.290	1.113	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc4ccccn34)C[C@@H]21	1791057874	ROZVGPKCVDIGNI-YXWQFLTLSA-N	435.322	1.711	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3cnc4[nH]ccc4c3)[C@H]2C1	1791142332	ZYMKXLHXJYVKHJ-OKYOBFRVSA-N	448.951	1.729	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(-c4ncc[nH]4)cc3)C[C@@H]21	1791256166	GNPXQRUAPOBYSY-VJANTYMQSA-N	446.935	1.924	50	20	IDGD	
C/C(=C/C(=O)Nc1ccc(C2(NC(=O)c3cnccc3C(=O)NN)CCC2)cc1)C(=O)O	1792259181	QDHQXLRGTQXQRW-QBFSEMIESA-N	437.456	1.464	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)COc1cccc(Cl)c1	1792749427	RWGUTBVQHLSXHH-VLWCASSMSA-N	431.316	1.562	50	20	IDGD	
CN(C)c1cccc(OCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C(C)(C)CCl)c1	1792782229	KDGFPFBYILSKKQ-CWPLJXCYSA-N	437.968	1.986	50	20	IDGD	
C[C@H](N[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](O)CCl)C1CC1)c1ccccc1	1792983498	KQQODVDDCJSBNQ-FHYBNVNPSA-N	449.979	1.305	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccn(C(C)(C)C)n1	1794420916	FZCIUVJZXRHLNH-GUIRCDHDSA-N	427.343	1.625	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(Br)nc1F)[C@H](O)CCl	1794532372	UDHALJCZTOITMF-DTHBNOIPSA-N	434.693	1.835	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccnnc1	1794673524	JKICLVCXWZFPMQ-GKEMIQDWSA-N	439.422	1.565	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN(C)C(=O)OC(C)(C)C	1795336334	CNBOWEKRHHPLMK-IVSAIRAKSA-N	431.961	1.850	50	20	IDGD	
COCc1oncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2	1797167709	UFPMIZUWJYAFAS-JWBKOJIWSA-N	442.476	1.207	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1c(F)cccc1F	1798985161	AAHYJLDRMGNDDY-PXDYOCJYSA-N	431.277	1.880	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cncc(C(F)(F)F)c1)C2	1800978800	KHVSNQMGRREQCK-AYRXBEOTSA-N	435.830	1.557	50	20	IDGD	
CC#C[C@@H](CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)c1ccc(O)cc1	1801051822	UXJCJZMYSZTCDB-JHLLAZCVSA-N	434.920	1.079	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCCn1ccnc1	1801307327	MRLAAKLQEQZMGO-JYYAWHABSA-N	427.343	1.426	50	20	IDGD	
C[C@H](Sc1ccccn1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2	1801314291	NAFOLOYIDQBUMV-ZJOBFFGXSA-N	442.379	1.937	50	20	IDGD	
CCOC(=O)C(C)(C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)CBr)C2	1802085201	FRRYSSONPCGHDT-FQUUOJAGSA-N	433.343	1.196	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)Cc2cccnc2Cl)[C@@H]1c1cccnc1)[C@H](O)CCl	1803136388	PQSBSNXXEUJRRM-LZLYRXPVSA-N	437.327	1.978	50	20	IDGD	
CCS(=O)(=O)CC(=O)NC[C@@H]1CCN(C(=O)[C@H](C)Br)[C@H]1c1cccnc1	1803518087	PKOLPVUFUXMYER-NOLJZWGESA-N	446.367	1.306	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2cccc(=O)n2O)[C@H]1c1cccnc1	1804949934	HLLXZCDKCUANTN-RLFYNMQTSA-N	434.880	1.054	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1)c1cccc(=O)n1O	1804954699	ZPCZOGZGQXLUEZ-KBXCAEBGSA-N	449.305	1.585	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2cccc(=O)n2C)[C@H]1c1cccnc1	1805314674	BXVNGFANAOLYNK-TXPKVOOTSA-N	432.908	1.354	50	20	IDGD	
O=C(C1=NN(c2ccccc2)C(=O)C1)N1CCC2(CCCN(C(=O)[C@@H](O)CCl)C2)CC1	1805523783	VOJMAVJTCRAIKP-SFHVURJKSA-N	446.935	1.610	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1	1809063443	VPYVWWFOZSEDNE-QKLQHJQFSA-N	441.919	1.957	50	20	IDGD	
O=C(CCN1CCOCC1)N1CCCC2(CCN(C(=O)[C@@H](F)Br)CC2)C1	1809588418	MDLOLCWDFWKTSZ-MRXNPFEDSA-N	434.350	1.630	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2c(O)cc(O)cc2O)[C@@H]1c1cccnc1	1811433534	MKTMZAJRKLAPOA-RFUYNDQBSA-N	449.891	1.772	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@H]1c1cccnc1)c1cc(CO)on1	1811590940	AJLXYBUFDRMOTR-CQDKDKBSSA-N	441.257	1.572	50	20	IDGD	
Cc1ccccc1C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1811776918	QBGYZYWRSUCTBQ-REWPJTCUSA-N	443.312	1.703	50	20	IDGD	
Cn1cc2cc(C(=O)NC[C@@H]3CCN(C(=O)[C@H](O)CCl)[C@@H]3c3cccnc3)ccc2n1	1812095430	SICVIJARSMWEHU-PWIZWCRZSA-N	441.919	1.888	50	20	IDGD	
C[C@H](NC(=O)c1ccccn1)C(=O)NC[C@@H]1CCN(C(=O)[C@H](F)Cl)[C@H]1c1cccnc1	1812347685	PFWXHCWBWZYYGG-IKICRFKJSA-N	447.898	1.835	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2ccc3nn[nH]c3c2)[C@H]1c1cccnc1	1813034197	DSDJQFXLUWGPCJ-BXWFABGCSA-N	442.907	1.926	50	20	IDGD	
O=C(CCc1ccoc1)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1813522573	FLOFUFYFOZILKG-NZQKXSOJSA-N	447.300	1.307	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CSCC(=O)OC)n[nH]1	1815224205	CXJAKXITEXXWLW-AAEUAGOBSA-N	432.930	1.562	50	20	IDGD	
O=C(C[C@@H]1CCCCO1)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1	1815336992	IQSGJIPPWJQIEC-CVEARBPZSA-N	443.334	1.008	50	20	IDGD	
O=C(Cn1ccccc1=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](F)Br)CC2	1815448960	XJINFDOVCBPCLU-OTYXRUKQSA-N	443.298	1.608	50	20	IDGD	
CC[C@@H](NC(N)=O)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CO[Si](C)(C)C)CC2	1817018093	VPVPFQCZMNVPDW-GHMZBOCLSA-N	427.603	1.354	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)C(=O)c2ccccc2)[nH]n1)c1ccc(B(O)O)cc1	1817471675	VLUNCRPQVUZTOT-LJQANCHMSA-N	446.272	1.278	50	20	IDGD	
CC1CCN(CC(=O)N2CCCC[C@@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)CC1	1822413152	WXYKXJHXWWDHMR-GOSISDBHSA-N	447.584	1.507	50	20	IDGD	
C[C@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1)N1C[C@H]2C[C@H]2C1	1822416089	NPVBAMIDDNVBNJ-XLMAVXFVSA-N	445.568	1.115	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1n[nH]cc1[N+](=O)[O-])CC2	1826003385	KSQHGBFOVOULCX-HTQZYQBOSA-N	428.858	1.254	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)C(=O)c2ccccc2)CC1	1826289744	OINDNBOKEQPPHW-FQEVSTJZSA-N	442.560	1.862	50	20	IDGD	
COC(=O)NCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](C)CBr)CC2	1826495326	MYNMJMJLZUTSKY-RKDXNWHRSA-N	433.328	1.442	50	20	IDGD	
C[C@H](C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@](C)(Cl)CCl)CC2)n1cnnn1	1826990247	XTEKNBMQNYYHBH-XWRVAKJBSA-N	432.337	1.539	50	20	IDGD	
CC[C@@H](NC)C(=O)N1CCC([C@H]2CCCCN2C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)CC1	1827680506	MCMSRMKZHQTSTE-SANVWHIPSA-N	444.580	1.738	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3cccc(C#N)c3)CCO2)C1	1830461674	VZMANAANRWLPQY-DENIHFKCSA-N	433.936	1.965	50	20	IDGD	
C#CCCCCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)CBr)CCO2	1830544276	SYGNTVHSSXHJKS-VQIMIIECSA-N	429.355	1.667	50	20	IDGD	
O=C(c1ccc(Cl)cc1F)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1830720052	RVLKSKVXFXRCPP-CRAIPNDOSA-N	435.279	1.149	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CN2C(=O)C=CC2=O)CC1	1831656014	DDNNDWVJBRBQHC-DZGCQCFKSA-N	440.338	1.315	50	20	IDGD	
CC[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)CCBr)C2)C1)N(CC)CC	1831663856	NCLKNSXHWFXCQD-VQIMIIECSA-N	448.402	1.348	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2C[C@]2(F)Cl)CC1	1831963638	KNBWTHCFIDFNGA-TWOQFEAHSA-N	430.952	1.904	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cccnc3S)CC2)CC1)[C@H](O)CCl	1833306563	VISCIQHAEZUJTH-MRXNPFEDSA-N	426.970	1.155	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)s1	1833959170	QUGATDUYCJXSTO-CXAGYDPISA-N	431.352	1.910	50	20	IDGD	
O=C(COc1ccc(F)cc1)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1834967183	SWDRCMTWDQSNLM-GOSISDBHSA-N	435.279	1.465	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H]3CC(c4ccccc4)=NN3)CC2)CC1)[C@@H](F)Cl	1835081714	ZWGCSPRHJKPCGH-VQTJNVASSA-N	449.958	1.859	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)c1cnc2ccccn12	1835348569	DJNIFYJQPCFLJU-GOSISDBHSA-N	433.940	1.119	50	20	IDGD	
Cc1cc(C)nc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)c1	1836312152	ZXJXWZUKZGRTJJ-QAPCUYQASA-N	444.301	1.459	50	20	IDGD	
CCC1(C(=O)N2CCC(N3CCC(NC(=O)[C@@H](F)Br)CC3)CC2)COC1	1836413980	SKIZRTASSWLRGR-OAHLLOKOSA-N	434.350	1.675	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3[nH]nc4ccncc34)CCO2)C1	1836448038	ZTSYTTGRVGZPSE-QRWLVFNGSA-N	435.912	1.435	50	20	IDGD	
O=C(c1ccc2n[nH]cc2c1)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836717476	CVFUKJTYLNAKPM-IBGZPJMESA-N	434.924	1.775	50	20	IDGD	
CCC(=O)N[C@H](C)C(=O)N1CCC(OC2CCN(C(=O)CCBr)CC2)CC1	1836820761	KQBQETRTSICTEL-CQSZACIVSA-N	446.386	1.685	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)C3(Br)CC3)C2)C1	1837715074	UHCJUCZAGBAPIB-MRXNPFEDSA-N	449.418	1.222	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1837715976	USAPWMZTUWIKJU-CJNGLKHVSA-N	437.407	1.078	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc4cccnn4n3)CCO2)C1	1838423225	JPVVDNUWYSINMS-UZLBHIALSA-N	435.912	1.207	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cc[n+]([O-])cc3)CC2)CC1	1838510990	WNUHPNFOIIVHQC-GOSISDBHSA-N	425.913	1.186	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccccc3Cl)CCO2)C1	1838866949	UYYSTTUMCQXJHA-QFBILLFUSA-N	431.316	1.664	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CC34CCCN3CCC4)CCO2)C1	1839116879	POICXSJTLVRRBE-AVRDEDQJSA-N	442.000	1.869	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4ncncc4c3)C2)C1	1839145409	GTTMBGFSVCWXJW-UWJYYQICSA-N	432.908	1.717	50	20	IDGD	
COc1ccc(C)c(C(=O)N2CCO[C@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)c1	1839360715	VNFRFTSEIDBBMM-LJQANCHMSA-N	431.316	1.877	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cccn3nccc13)CCO2	1839539286	GRKBJIHCEWTELP-OAQYLSRUSA-N	446.580	1.256	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCO[C@]2(COCCN(C(=O)C(F)F)C2)C1	1839743536	XGLYGKIVTBYCQT-CDXDBMBRSA-N	441.381	1.593	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CNC(C)(C)C)C2)C1	1839963276	GLKVSUWJQNFHPZ-RDTXWAMCSA-N	434.375	1.004	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CCCCC3(F)F)C2)C1	1840150125	FRRBJHWNNVNDTJ-RVKKMQEKSA-N	438.899	1.522	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4cc(C)ccc4[nH]3)C2)C1	1840152815	UVKDOCNTXIFQRB-VGOFRKELSA-N	449.935	1.800	50	20	IDGD	
C[C@H](Oc1ccccc1)C(=O)N1CCOC[C@]2(CN(C(=O)C(Cl)Cl)CCO2)C1	1840189843	OLHMEGZTXOJVPM-IFXJQAMLSA-N	431.316	1.714	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC12CN(C(=O)[C@@H](O)NC(=O)OC(C)(C)C)C2	1841288577	CXFYYSQCVGEQPD-VXGBXAGGSA-N	434.331	1.064	50	20	IDGD	
COc1ccc(CC(=O)N2CCCC23CN(C(=O)[C@H](O)CCl)C3)c(Br)c1	1841376089	PBHPOYGJPXLKDM-OAHLLOKOSA-N	445.741	1.803	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@H](CC(N)=O)NC(=O)OC(C)(C)C)C2	1841671735	FIWFORSKMXHULN-KGLIPLIRSA-N	444.960	1.366	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)Cc2ccc(Cl)s2)C1	1841939753	QAHFUNGTNLVNSA-UHFFFAOYSA-N	433.921	1.460	50	20	IDGD	
O=C(c1csc(-c2cccnc2)n1)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843013760	JMAWWVADAWFWDJ-UHFFFAOYSA-N	448.313	1.016	50	20	IDGD	
C[C@@H](Sc1cccs1)C(=O)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843014333	YHBGBTKWCDIFNR-CQSZACIVSA-N	430.360	1.426	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2ccn3ccnc3c2)C1	1844076881	AFSMGNZMFIPXKU-MFKUBSTISA-N	433.472	1.285	50	20	IDGD	
C[C@H](NC(=O)c1cnccn1)C(=O)N1CCCC12CN(C(=O)[C@@](C)(Cl)CCl)C2	1844333188	XLIILIJDBGSFGO-SJCJKPOMSA-N	428.320	1.035	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H]2C[C@]21C(=O)N1CCCC12CN(C(=O)[C@H](O)CCl)C2	1846258710	FZWUGINLYIGDSK-LRDNONRASA-N	427.929	1.189	50	20	IDGD	
O=C(CCBr)N1CC2(CCCN2C(=O)c2ccc(N3C(=O)C=CC3=O)cc2)C1	1846890760	DPQZXQPGCIMZCB-UHFFFAOYSA-N	446.301	1.718	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](F)Cl)[C@@H](O)C1	1847233425	AKBRWJPGYSTRBV-YTFOTSKYSA-N	433.908	1.341	50	20	IDGD	
COc1c(Br)cccc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl	1847562470	WGSXNROHZZTOEF-MELADBBJSA-N	431.714	1.873	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)n[nH]1	1848099482	NHJUPKBLNNAUOC-KKUMJFAQSA-N	425.917	1.666	50	20	IDGD	
O=C(O)CCSSCCNC(=O)c1cccc(S(=O)(=O)NC[C@@H]2CCCO2)c1	2088603695	HSDKASHVBBEADP-AWEZNQCLSA-N	448.588	1.730	50	20	IDGD	
CS(=O)(=O)NCCc1ccc(C(=O)NNC(=O)c2cc(-c3ccccc3)n[nH]2)s1	17519510	AOIPTRNIEHREDU-UHFFFAOYSA-N	433.515	1.305	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(OC[C@H]3CCCO3)cc2)c1	30549450	QOMKAEAQZUBZIL-GOSISDBHSA-N	447.513	1.570	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)[C@H]2CCCN(S(=O)(=O)c3ccccc3)C2)cc1	110888968	FBVOSOAOZBBUEK-KRWDZBQOSA-N	430.530	1.655	50	20	IDGD	
CC(=NNC(=O)C(=O)NC1CC1)c1ccc(NC(=O)C[C@@H]2Nc3ccccc3NC2=O)cc1	725853775	VZCRYCGWSHCPHU-IBGZPJMESA-N	448.483	1.567	50	20	IDGD	
C[C@H](NS(=O)(=O)c1ccc(Cl)cc1)C(=O)NNC(=O)c1ccc2c(c1)OCO2	725905928	JQDHUWZKLGYFSW-JTQLQIEISA-N	425.850	1.197	50	20	IDGD	
O=C(NNC(=O)N1CCO[C@H](c2ccc(F)c(Cl)c2)C1)c1ccc(-n2cnnn2)cc1	727474113	YPHGYGCOTOSHEK-KRWDZBQOSA-N	445.842	1.883	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCc2cccc(C(=O)NCCN(C)C)c2)cc1OC	727479823	PQNJWZCOJONUEM-UHFFFAOYSA-N	443.504	1.139	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCCc2ccc(OC)c(OC)c2OC)cc1OC	727840984	JAWRCMVJDGYALR-UHFFFAOYSA-N	433.461	1.916	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)[C@H]2CCCC[C@@H]2C(=O)N2CCCC2)c2ccccc2c1=O	728151225	XMGIUTQGEADNGQ-RDJZCZTQSA-N	425.489	1.123	50	20	IDGD	
Cn1c(N)c(C(=O)/C(C#N)=C/c2csc(-c3ccc4c(c3)OCO4)n2)c(=O)n(C)c1=O	728569224	RTDBQMGUTDVZQJ-VZUCSPMQSA-N	437.437	1.308	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)NC2CCN(CCN(C)C)CC2)c1	728743047	YDGZEULHJGUFNC-UHFFFAOYSA-N	442.358	1.428	50	20	IDGD	
C[C@@H](C(=O)NC1CC1)N1CCN(C(=O)NNC(=O)c2c(Cl)cccc2Cl)CC1	728953839	DGRYDZAUPSVTDW-NSHDSACASA-N	428.320	1.633	50	20	IDGD	
CC(=O)N1C[C@@H](C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)Oc2ccccc21	728974136	GGQXFUYMXJVFDM-INIZCTEOSA-N	425.413	1.940	50	20	IDGD	
O=C(NNC(=O)N1CCc2c(cnn2-c2ccccc2)C1)c1ccc(-n2cnnn2)cc1	730578481	SQHLIIHTGXDHRI-UHFFFAOYSA-N	429.444	1.261	50	20	IDGD	
O=C(CCn1cnc2sc3c(c2c1=O)CCCC3)NNC(=O)COc1ccccc1O	730778237	LFCXJDFVTFTQAC-UHFFFAOYSA-N	442.497	1.659	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)C1CCN(S(=O)(=O)c2ccc3c(c2)CCC3)CC1	731852632	GJAGQEULQYKQLC-UHFFFAOYSA-N	431.518	1.069	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1)c1ccc2c(c1)OCCO2	731964660	LEHGQTKWGOPZBH-GFCCVEGCSA-N	446.441	1.493	50	20	IDGD	
C[C@@H]1Cc2ccccc2N1C(=O)[C@@H]1CCCC[C@H]1C(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1	732751883	ZGANWYXRBQRIPW-VDHUWJSZSA-N	447.557	1.353	50	20	IDGD	
CS(=O)(=O)Nc1cccc(CNC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c1	733339080	OMGPKONJZXHKMN-UHFFFAOYSA-N	428.474	1.388	50	20	IDGD	
C[C@@H](CNC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)Oc1ccccc1	733849044	CZTCJGHSDMUTEL-INIZCTEOSA-N	448.549	1.111	50	20	IDGD	
CCCc1ccc(N2C[C@H](C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)CC2=O)cc1	734239998	GWDYLDGCMATDKM-MRXNPFEDSA-N	447.536	1.847	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)[C@H]2CCCCN2c2ncccn2)cc1C	736775050	JBTZFCBGTJHJSH-CQSZACIVSA-N	431.518	1.772	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)CCC(=O)c2ccc3c(c2)OCCO3)c1	741814244	QAPUZKBOPJIIHX-UHFFFAOYSA-N	437.408	1.297	50	20	IDGD	
COCc1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)no1	742469704	HLZCPVNVYBDYRU-UHFFFAOYSA-N	444.469	1.374	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNC(=O)CCN2C(=O)[C@H]3[C@H](C2=O)[C@H]2CC[C@H]3O2)cc1	742473858	OUGZKYDOYSYXOB-HNBVOPMISA-N	443.500	1.425	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)c2cccc(CS(N)(=O)=O)c2)cc1Cl	743833917	MFHCRQKCHJTUBU-UHFFFAOYSA-N	442.881	1.612	50	20	IDGD	
CCCS(=O)(=O)Nc1ccc(C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)cc1	744943189	GWWDPLCFECXIQE-UHFFFAOYSA-N	444.469	1.328	50	20	IDGD	
C[C@@H](CCc1cccc(F)c1)C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	745585712	SYTLABQACFDGDF-IFXJQAMLSA-N	430.432	1.925	50	20	IDGD	
Cc1csc([C@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)C2CC2)n1	745863845	JJAWSLSHNSSEBK-OAHLLOKOSA-N	437.547	1.797	50	20	IDGD	
C[C@@H]1C[C@H](NC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)C(=O)N1c1ccccc1	745881702	LDMVUSPFLMXTFI-PBHICJAKSA-N	434.456	1.716	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)NCCS(=O)(=O)C(C)(C)C)c1	745895018	LWBGLTXYAOEAKS-UHFFFAOYSA-N	436.328	1.615	50	20	IDGD	
COC[C@@H](C)n1c(C)cc(/C=C(/C#N)C(=O)NCCNS(=O)(=O)c2cccnc2)c1C	746272681	VUGWXAZQRLSCHR-VXIUPONVSA-N	445.545	1.709	50	20	IDGD	
CC(C)(C)NS(=O)(=O)Cc1cccc(C(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1	746352805	LUMFBAQIUXYDTF-GOSISDBHSA-N	447.513	1.506	50	20	IDGD	
COc1cc(C)nc(NNC(=O)[C@@H]2CC(=O)N(c3cc(OC)c(OC)c(OC)c3)C2)n1	746633404	SIKQEPJITVIPRX-GFCCVEGCSA-N	431.449	1.316	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)NC1CCN(C(=O)c2ccccc2F)CC1	746744397	LWMFYMSVRIGPIC-UHFFFAOYSA-N	438.463	1.651	50	20	IDGD	
Cc1nn(C)c(C)c1[C@H](C)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	746819831	DCCDFQWEBUKBIJ-AWEZNQCLSA-N	447.561	1.776	50	20	IDGD	
C[C@H](c1ccccc1)[C@](C)(O)C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	747413609	UDWHZMRMTCYZAS-IERDGZPVSA-N	433.530	1.705	50	20	IDGD	
COc1ccc(Br)c(S(=O)(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1	747596249	LDFCPKWQKJTNAO-CQSZACIVSA-N	443.275	1.607	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)c2cc(S(=O)(=O)N3CCC3)ccc2Cl)cc1	748690816	CFFDLQIXRQYRBP-UHFFFAOYSA-N	448.888	1.446	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)c2cc(S(=O)(=O)NC)cs2)cc1OC	748693236	CCCMEJISFBEEPG-UHFFFAOYSA-N	427.504	1.528	50	20	IDGD	
O=C1CN(S(=O)(=O)c2ccc(C(=O)NNc3cccc4cnccc34)cc2)CCN1	748758780	CQTJVYMJSQMESA-UHFFFAOYSA-N	425.470	1.112	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN1C(=O)c1ccc2c(c1)OCO2)c1cc(Cl)ccc1O	749719458	PLMVQSNAUZYEGL-CQSZACIVSA-N	431.832	1.840	50	20	IDGD	
O=C(NNS(=O)(=O)c1cccc(F)c1F)c1cccc(S(=O)(=O)N2CCCC2)c1	751261658	VYFWPFSECHUMKH-UHFFFAOYSA-N	445.469	1.373	50	20	IDGD	
C[C@H](NC(=S)NNC(=O)C1CCN(S(=O)(=O)/C=C/c2ccccc2)CC1)C1CC1	751620790	MHTOSURCUXNIGU-GOFCXVBSSA-N	436.603	1.993	50	20	IDGD	
O=C(NC[C@@H](O)CS(=O)(=O)c1cccs1)NNC(=O)c1cccc2ccccc12	752181530	RUZULFHYNJXSKX-CQSZACIVSA-N	433.511	1.680	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)CNC(=O)c1cccs1)c1noc(Cc2ccccc2)n1	753036846	DFUXBPAFEUHHPX-GFCCVEGCSA-N	428.474	1.543	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)CCc1ccoc1	753180591	GVXBAELHWAQVMS-UHFFFAOYSA-N	435.502	1.013	50	20	IDGD	
C[C@H](C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1)c1ccc(S(C)(=O)=O)cc1	753294178	PJQOUSKNRWSLJA-ZDUSSCGKSA-N	437.543	1.778	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)c1ccccc1F)C(=O)NNc1cc(Cl)nc(N)n1	753453244	BVHLVWSAHUPQPG-JTQLQIEISA-N	448.933	1.395	50	20	IDGD	
O=C(Cc1ccccn1)NNC(=O)Nc1cccc(S(=O)(=O)NC2=NCCCCC2)c1	755496204	SFOPGVUNALGBCT-UHFFFAOYSA-N	444.517	1.728	50	20	IDGD	
CNC(=O)c1cccc(NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c1C	755659447	UMNSCUFMRBDOTQ-UHFFFAOYSA-N	438.532	1.720	50	20	IDGD	
CCOc1cccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c1	756089179	ZFEIAXVIBYFTKC-UHFFFAOYSA-N	448.501	1.573	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)Nc1cc(N2CCCS2(=O)=O)ccc1F	756156147	ZUXNDLCQJXLANM-UHFFFAOYSA-N	446.464	1.788	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)NNC(=O)c1ccccc1OC	756674530	XLBZCZHDNFZUIK-UHFFFAOYSA-N	436.490	1.811	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)NNc2cc(C(F)(F)F)nc(-c3ccccn3)n2)co1	756772064	CYBNNDNZVCCANQ-UHFFFAOYSA-N	442.379	1.815	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)Nc2ccc(F)c(-n3nnnc3C3CC3)c2)c1O	756779761	VCZBYXPWJONJHM-UHFFFAOYSA-N	427.396	1.860	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)Nc1cc(Br)cn(C)c1=O	757588514	BJLSFYOZOFCWQK-UHFFFAOYSA-N	439.266	1.778	50	20	IDGD	
O=C(Cc1ccc(Cl)cc1)NNC(=O)NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1	758693066	KPPVDTJSYWAFSD-UHFFFAOYSA-N	440.865	1.595	50	20	IDGD	
O=C(NC[C@H](O)c1ccc(Cl)c(F)c1)NNC(=O)C1CCN(c2ncccn2)CC1	762576357	MDAYIIWRQTXHEO-INIZCTEOSA-N	436.875	1.550	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)NCCC2CC(O)C2)cc1	762720323	QHFHJQLPFMRMDW-SFQUDFHCSA-N	437.500	1.618	50	20	IDGD	
CNS(=O)(=O)Cc1ccc(CNC(=O)NNC(=O)CSc2ccccc2O)cc1	763445579	KIKINBPYWBOCQT-UHFFFAOYSA-N	438.531	1.064	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1cccnc1OCc1ccccc1	763467359	CQCZLKOUDJLNOI-UHFFFAOYSA-N	435.396	1.969	50	20	IDGD	
O=C(NNC(=O)c1cccnc1)C(=O)Nc1ccc(CC(=O)N2CCc3ccccc32)cc1	763488657	NNERIENPIFUZNY-UHFFFAOYSA-N	443.463	1.613	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)cc(OC)c1	763539483	LVDKBOSQAOQYLZ-UHFFFAOYSA-N	433.417	1.129	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cc(C(=O)N3CCSCC3)ccc2C)c(C)o1	763577250	UKHACQZSEIODFH-UHFFFAOYSA-N	444.513	1.794	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)C(=O)Nc2ccccc2-n2ccnn2)c1	763601257	JXTXLEYWSJVHTA-UHFFFAOYSA-N	436.472	1.864	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(N2CCCC2)c(F)c1	763684809	NXDUCFSGAXZXAE-UHFFFAOYSA-N	444.463	1.990	50	20	IDGD	
O=C(CN1CCCc2ccccc21)NNC(=O)C(=O)Nc1ccc(C(=O)N2CCCC2)cc1	763729066	TZMTUYFSSHGGMI-UHFFFAOYSA-N	449.511	1.461	50	20	IDGD	
CC(C)OC(=O)NCc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(N(C)C)c2)cc1	763754483	SDVUSDQHIOZDJF-UHFFFAOYSA-N	441.488	1.787	50	20	IDGD	
COCCn1ccc2ccc(NC(=O)C(=O)NNC(=O)c3cc(OC)cc(OC)c3)cc21	763771891	GAXWQDHKCBJOGE-UHFFFAOYSA-N	440.456	1.705	50	20	IDGD	
COc1cc2nc(C)sc2cc1NC(=O)C(=O)NNC(=O)COc1ccccc1C#N	763808647	ZTVJYAMQSLKMSK-UHFFFAOYSA-N	439.453	1.650	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(N3C[C@@H](C)O[C@H](C)C3)cc2)cc1	763809928	VVSHAUQUGLNAMZ-IAGOWNOFSA-N	440.500	1.774	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(F)cc1Br	763812462	GLORJLNMOKUAFB-UHFFFAOYSA-N	435.209	1.625	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)oc(=O)n3C)c1C	763840180	JCWBHYKUAQNFSE-ZDUSSCGKSA-N	426.429	1.302	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccc(OCc2ccncc2)cc1	763841316	QBIKUAQHSCWFQY-UHFFFAOYSA-N	438.415	1.965	50	20	IDGD	
CO[C@H](C)C(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)Cc2ccc(Cl)cc2)c1	763931237	DVOYPPQJJQBQEH-GFCCVEGCSA-N	432.864	1.642	50	20	IDGD	
COC(=O)c1cc(Cl)ccc1NC(=O)C(=O)NNC(=O)c1cc(Cl)ccc1O	763977474	RXEBNOZFDDGJJZ-UHFFFAOYSA-N	426.212	1.885	50	20	IDGD	
CNC(=O)c1cc(Oc2ccccc2NC(=O)C(=O)NNC(=O)C2CCCC2)ccn1	764071683	XQGURVFKSIWWCW-UHFFFAOYSA-N	425.445	1.510	50	20	IDGD	
Cc1cccc(C(=O)N2CCCC2)c1NC(=O)C(=O)NNC(=O)[C@H]1Cc2ccccc2O1	764154981	VOJMPENDKPBQMV-GOSISDBHSA-N	436.468	1.321	50	20	IDGD	
CS(=O)(=O)c1cccc(Oc2ccc(NC(=O)C(=O)NNC(=O)c3ccoc3)cc2)c1	764159091	RBQWRUZGGMRGAL-UHFFFAOYSA-N	443.437	1.875	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2O1)C(=O)Nc1cccc(CN2CCCCC2=O)c1	764168188	ODXSQPHUBHRQFD-IBGZPJMESA-N	436.468	1.289	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(NC(=O)c3ccncc3)c2)cc1	764177749	UVJOQXYBCNDCCM-UHFFFAOYSA-N	428.408	1.605	50	20	IDGD	
CC(C)(C)CC(=O)NNC(=O)C(=O)Nc1ccc2c(ccn2CC(=O)N2CCOCC2)c1	764201761	BDLDQHPXWWHHIN-UHFFFAOYSA-N	443.504	1.022	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)C(=O)Nc1cccc(N2CCOC2=O)c1	764203947	GNPNHDRKLQBALG-UHFFFAOYSA-N	449.464	1.034	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)C(=O)Nc1cccn(CC(F)(F)F)c1=O	764242564	HVJCRVKZQMVPJB-UHFFFAOYSA-N	435.362	1.151	50	20	IDGD	
CN(C(=O)c1ccc(NC(=O)C(=O)NNC(=O)Cc2cccnc2)cc1)C1CCCCC1	764264008	NPEXZAVNQSHHDG-UHFFFAOYSA-N	437.500	1.815	50	20	IDGD	
O=C(NNC(=O)c1cc(F)ccc1Br)C(=O)Nc1ccccc1-n1ccnn1	764270721	RSFISYWMACFNQA-UHFFFAOYSA-N	447.224	1.569	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)C(=O)Nc1ccc(OCc2cccc(F)c2)c(F)c1	764297387	QJHQJWQSFZUAHP-UHFFFAOYSA-N	429.383	1.975	50	20	IDGD	
C[C@@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3ccc(O)c(Cl)c3)cc2)CCO1	764349340	JRJXIPVJVHYMTL-GFCCVEGCSA-N	432.864	1.670	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)C(=O)Nc2cc(C(C)(C)C)nn2-c2ccc(F)cc2)cn1	764359355	PUXIWYAINGRKAK-UHFFFAOYSA-N	427.440	1.442	50	20	IDGD	
Cc1cc(S(C)(=O)=O)ccc1NC(=O)C(=O)NNC(=O)C(F)(F)Oc1ccccc1	764380147	PUYZPPBRFSYINU-UHFFFAOYSA-N	441.412	1.156	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1)C(=O)Nc1ccccc1Cn1cncn1	764387265	HXGFTDCGSSMCRJ-UHFFFAOYSA-N	448.418	1.255	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1F)C(=O)Nc1cccc(CN2CCOC2=O)c1	764413996	ZLQWMOURCBFHIZ-UHFFFAOYSA-N	434.811	1.831	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)[C@@H](C)S(=O)(=O)C2CCOCC2)cc1OC	764576480	ZLJCOQAMLMXIJB-CYBMUJFWSA-N	428.507	1.227	50	20	IDGD	
C[C@H](CC(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1)C1CCN(C(=O)OC(C)(C)C)CC1	765071248	SBQLDRJAYAUFRK-HIFRSBDPSA-N	446.570	1.177	50	20	IDGD	
CCOC(=O)NNC(=O)C(=O)Nc1ccc(NC(=O)[C@H]2CCCO2)cc1C(F)(F)F	765407142	DBSSKQNOZBRXJG-GFCCVEGCSA-N	432.355	1.539	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)c2ccc(=O)n(-c3ccccc3F)n2)o1	765669906	OIXYEUNUYSPAQY-UHFFFAOYSA-N	427.436	1.881	50	20	IDGD	
Cc1cccc2[nH]cc(CC(=O)NNC(=O)CN3CCN(C(=O)c4ccccc4)CC3)c12	765739312	SRJHVARORPMTGW-UHFFFAOYSA-N	433.512	1.624	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNc2nccnc2OC)c(OCC(F)(F)F)c1	766272818	WPYZCJYQASPCON-UHFFFAOYSA-N	443.338	1.295	50	20	IDGD	
O=C(Cc1csc2nccn12)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	766667466	AFRBWCHRWGZZFM-UHFFFAOYSA-N	446.964	1.557	50	20	IDGD	
Cc1cc(Br)ccc1C(=O)N1CCC[C@@H](C(=O)NNC(=O)C(C)(C)O)C1	768245434	AYDSMXHYSFXCTH-GFCCVEGCSA-N	426.311	1.528	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)c1cccc(S(=O)(=O)NC(C)C)c1	768627651	BIOXFCHSKMHOJN-UHFFFAOYSA-N	441.531	1.542	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(Cl)c(C(=O)NNc2cc(C#N)cc(Cl)n2)c1	768708370	XNBQKQRLVGZSNF-UHFFFAOYSA-N	444.300	1.942	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1	772131819	IYDOTJBJSDUXLM-NEPJUHHUSA-N	440.478	1.386	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)[nH]n1)Nc1cnn(Cc2nnc3n2CCCC3)c1	772636279	NILWXEUGYHZSNU-UHFFFAOYSA-N	446.475	1.716	50	20	IDGD	
CCOc1ccc(C(=O)NNS(=O)(=O)c2ccc(C(=O)OC)c(F)c2)cc1OC	773249544	LLFOAQWWQBFQJF-UHFFFAOYSA-N	426.422	1.643	50	20	IDGD	
CNS(=O)(=O)c1cccc(S(=O)(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)c1	773263237	FMUZNYJUCCLEOQ-NSHDSACASA-N	447.922	1.025	50	20	IDGD	
COc1cccc(C(=O)NCC(=O)NNC(=O)[C@H]2CCCN(C(=O)OC(C)(C)C)C2)c1	773420236	OVTLRLZCDAOMKH-HNNXBMFYSA-N	434.493	1.220	50	20	IDGD	
O=C(NNc1cccc(C(F)(F)F)c1)C(=O)Nc1ccn(CCN2CCOCC2)n1	773740215	OSPRSDQEMRKWJR-UHFFFAOYSA-N	426.399	1.316	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NC[C@@H]2CC[C@H](C(=O)N(C)C)O2)cc1Br	774715443	FQKRDRLJZBNVEM-SMDDNHRTSA-N	443.298	1.038	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1N1CCOCC1	776701225	BSEFBGUCVWIOLL-UHFFFAOYSA-N	430.417	1.280	50	20	IDGD	
Cc1cc2ccccc2nc1NNC(=O)[C@@H](C)NS(=O)(=O)c1ccc(C(N)=O)cc1	777478958	PJEUELLLFIDIGK-CYBMUJFWSA-N	427.486	1.452	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)[C@@H](C)n1nnnc1C(C)(C)C	777796132	UJKMWAFWUROCQV-MNOVXSKESA-N	439.314	1.909	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)c2cc(C(=O)OC)no2)c2ccccc2c1=O	777796156	VCUZINPDNMPWOQ-UHFFFAOYSA-N	427.417	1.436	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2ccc3c(c2)OCO3)cc1Br	777933845	XBWCZMIHSZEULT-UHFFFAOYSA-N	429.248	1.810	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CNC(=O)OC(C)(C)C)cc1I	778438235	RVCXHWWRRICZJG-UHFFFAOYSA-N	433.246	1.885	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@H](C(=O)NNC(=O)CCCc2ccccc2)[C@@H](C)O)cc1	779515022	RRSXVLHZIZPLTD-UZLBHIALSA-N	433.530	1.193	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)[C@@H]2CCCN2S(=O)(=O)c2cccc([N+](=O)[O-])c2)c1	780797248	XQJHCLJZQPJRST-KRWDZBQOSA-N	448.457	1.678	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)C2(OC)CCC2)c1	781929872	MONLHWJWWMLVLM-UHFFFAOYSA-N	433.486	1.826	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)(F)F)cc1)C(=O)Nc1ccc2c(c1)OCO2	783409357	TZOXTKWTSMAWST-UHFFFAOYSA-N	431.348	1.791	50	20	IDGD	
Cc1ccccc1NC(=O)NNC(=O)C(=O)Nc1ccc(CC(=O)N2CCOCC2)cc1	783415833	LCJUADHAELFTRA-UHFFFAOYSA-N	439.472	1.188	50	20	IDGD	
Cc1ccccc1NC(=O)NNC(=O)C(=O)Nc1cccc(N2CCCS2(=O)=O)c1	783415997	NTDZVKAPFZHOOP-UHFFFAOYSA-N	431.474	1.326	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)CCS(=O)(=O)C1	783425364	HTPZRPPMPHUCSJ-FQEVSTJZSA-N	428.470	1.487	50	20	IDGD	
Cn1c(=O)n(C)c2cc(NC(=O)C(=O)NNc3ccc(OCC(F)(F)F)cc3)ccc21	784368980	QMOXRLPXDRVJOO-UHFFFAOYSA-N	437.378	1.900	50	20	IDGD	
CCn1cc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)NC(C)(C)C)ccc1=O	784833996	XALMYIJSQBXGNZ-UHFFFAOYSA-N	435.506	1.027	50	20	IDGD	
O=C(NNc1cccnn1)C(=O)Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1	784858579	QZMZYJDNABGREK-UHFFFAOYSA-N	445.527	1.923	50	20	IDGD	
Cc1cn(-c2ccc(C#N)cn2)nc1NC(=O)C(=O)NNc1cccc(C(F)(F)F)n1	784958589	MWQLQCSDDMWEOU-UHFFFAOYSA-N	430.350	1.943	50	20	IDGD	
COC(=O)c1c(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)sc(C)c1C	785060682	JMYCTENSWVGRNQ-UHFFFAOYSA-N	429.458	1.128	50	20	IDGD	
Cn1ccnc(NNC(=O)C(=O)Nc2ccc(OCc3cccc(C#N)c3)c(F)c2)c1=O	785090774	YEYRLJSJBZIQQF-UHFFFAOYSA-N	436.403	1.452	50	20	IDGD	
CCc1cc(Br)ccc1NNC(=O)C(=O)Nc1cnn(CC(=O)N(C)C)c1	785099386	RTHOWXARPOAXSH-UHFFFAOYSA-N	437.298	1.378	50	20	IDGD	
CCOc1ccc(NS(=O)(=O)CCCCCl)cc1S(=O)(=O)N1CCOCC1	788046457	GRXMDBWXTVUUJO-UHFFFAOYSA-N	440.971	1.867	50	20	IDGD	
CN1CCN(C(=O)NNC(=O)CCCCCn2c(S)nc3ccccc3c2=O)CC1	788170090	ZHKNHHKKCVEJSV-UHFFFAOYSA-N	432.550	1.234	50	20	IDGD	
COC(=O)c1sc(S(=O)(=O)NNC(=O)c2ccc3c(c2)OCO3)c(C)c1Cl	788478993	WJUFEXIHXMNCJY-UHFFFAOYSA-N	432.863	1.849	50	20	IDGD	
O=C(COC(=O)[C@@H]1CCCc2c(O)cccc21)NNC(=O)[C@H]1COc2ccccc2O1	789254163	VAJSQYAVULJFIK-DNVCBOLYSA-N	426.425	1.343	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)ccc1Cl	789732556	BDNFNKRCWALOFO-UHFFFAOYSA-N	425.850	1.152	50	20	IDGD	
COc1cc(C(F)(F)F)ncc1NC(=O)C(=O)NNC(=O)C(F)(F)Oc1ccccc1	792266015	LJLJSVDULMIDFB-UHFFFAOYSA-N	448.304	1.867	50	20	IDGD	
O=C(CCc1ccccc1O)NNS(=O)(=O)c1ccc(C(=O)O)cc1OC(F)(F)F	792700048	XXCZEZYYMGGNIX-UHFFFAOYSA-N	448.375	1.931	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(CC(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)cc1	793750615	RHUOOLFCEGCAMU-UHFFFAOYSA-N	433.515	1.392	50	20	IDGD	
C[C@H]1CCC(=NNC(=O)C(=O)NN=C2CC[C@@H](C)C[C@H]2n2cncn2)[C@H](n2cncn2)C1	794453075	IVGFEELHLMMELH-LTCOOKNTSA-N	440.512	1.236	50	20	IDGD	
C[C@](O)(CSc1cccc(F)c1)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	796144094	RAZXUZKVLFJWTF-FQEVSTJZSA-N	433.509	1.523	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CN2CC[C@@H](N3CCN(C(=O)OC(C)(C)C)CC3)C2)c1	796615519	KNVIILYFXMZDJN-LJQANCHMSA-N	445.564	1.383	50	20	IDGD	
CC(C)Oc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2F)cc1C(N)=O	797012292	OSQJBYLVSUQJKN-UHFFFAOYSA-N	436.827	1.765	50	20	IDGD	
Cn1cc2c(n1)CCC[C@H]2C(=O)NNC(=O)c1ccc(CSc2nncn2C)cc1	798825292	NGZCIHFHSDDQOY-OAHLLOKOSA-N	425.518	1.722	50	20	IDGD	
Cc1ccc(C2=NO[C@@H](CNC(=O)NNC(=O)COc3ccccc3[N+](=O)[O-])C2)cc1	800753493	DPWGOEFNCYSCLT-OAHLLOKOSA-N	427.417	1.806	50	20	IDGD	
CN(NS(=O)(=O)c1cccc2c1OCO2)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	800935676	PNNBCVQMTOAPGW-UHFFFAOYSA-N	442.494	1.213	50	20	IDGD	
CCS(=O)(=O)N1CCC(C(=O)NNC(=O)Nc2ccc(Br)cc2)CC1	801997493	LMRWDBSPJTXYQN-UHFFFAOYSA-N	433.328	1.664	50	20	IDGD	
N#Cc1cc(C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)ccc1F	802762827	NAERBHMFRFFVFA-UHFFFAOYSA-N	429.883	1.930	50	20	IDGD	
O=C(NC[C@@H](N1CCOCC1)C(F)(F)F)NNC(=O)c1cnn(-c2ccccc2)c1	805110503	WMELZEZDUFVEAK-OAHLLOKOSA-N	426.399	1.079	50	20	IDGD	
COc1ccc(CN2CC[C@H](NC(=O)NNC(=O)Cc3ccc(F)cc3)C2=O)c(OC)c1	806027744	QRAJHPIKEQTCOL-SFHVURJKSA-N	444.463	1.517	50	20	IDGD	
O=C1COC[C@@H](C[C@@H]2CN(C(=O)C(=O)NNc3cccc([N+](=O)[O-])c3)c3ccccc32)N1	806968182	ALVLPTFVYXTNAT-UKRRQHHQSA-N	439.428	1.073	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNS(=O)(=O)c1cccnc1C(F)(F)F	808104585	YTWWJOQGLLFIHL-UHFFFAOYSA-N	436.799	1.380	50	20	IDGD	
CNC(=O)c1cc(O[C@@H]2CCCN(C(=O)/C(C#N)=C/c3cc(C#N)n(C)c3C)C2)ccn1	808234737	OLARKBMHSIBXDZ-HIOHBZOZSA-N	432.484	1.937	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cccc3c2COC3=O)cc1	808934331	AHGQUZJRMHAFKV-GFCCVEGCSA-N	427.413	1.309	50	20	IDGD	
COC(=O)C[C@@H](C)CC(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	809559814	BBWLBGLIAYDNPS-HNNXBMFYSA-N	436.472	1.739	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)[C@@H]1C[C@H](c2ccccc2)OC1=O	809702910	ASSUQHLSGDUFBD-FUHWJXTLSA-N	445.497	1.455	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(Br)cc1)NNC(=O)Cc1ccccc1F	810373374	RSXCOKUITHWKCJ-UHFFFAOYSA-N	444.282	1.257	50	20	IDGD	
CCOc1cc(C(=O)NNS(=O)(=O)c2cncc(C#N)c2)cc(OCC)c1OCC	811675255	GMNRRPKCVMOTIU-UHFFFAOYSA-N	434.474	1.773	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NCc2ncccc2N(C)C)c2ccccc2c1=O	812536036	NWHLYDRBRSQNJP-UHFFFAOYSA-N	437.504	1.802	50	20	IDGD	
COc1ccc(C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)cc1N1CCNC1=O	812727353	PUVMTACWCYPTKX-UHFFFAOYSA-N	433.490	1.232	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cc(C)nc3onc(C)c23)cc1OC	812881700	ANTQHGWUWDUKGA-UHFFFAOYSA-N	428.401	1.475	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2ccc(Br)cc2Cl)nnn1-c1ccn(C)n1	814408213	FAXAHSSBUKTRMK-UHFFFAOYSA-N	438.673	1.800	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)C[C@@H]2CCCS(=O)(=O)C2)cc(OCC)c1OCC	814715494	YPBLSXKBEXQYIO-AWEZNQCLSA-N	442.534	1.859	50	20	IDGD	
O=C(COC(=O)c1cccc(OC[C@@H]2CCCO2)c1)NNC(=O)c1cccc([N+](=O)[O-])c1	844475297	ZYMOIUOTQPQQDW-SFHVURJKSA-N	443.412	1.771	50	20	IDGD	
Cc1noc2ncc(C(=O)NNC(=O)c3ccc(S(=O)(=O)N4CCCC4)cc3)cc12	879765893	RHZVUTMQMHMBGL-UHFFFAOYSA-N	429.458	1.391	50	20	IDGD	
CCOC(=O)N1CCC[C@H](C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)C1	912988230	LLQAQAQGZQLNQT-AWEZNQCLSA-N	429.477	1.607	50	20	IDGD	
COc1ccc(CCNC(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)cc1OC	914827590	UTIFOUKQDQLWJQ-UHFFFAOYSA-N	437.522	1.654	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)[C@@H]2CC[C@@H](C(F)(F)F)NC2=O)c2ccccc2c1=O	915190995	ZFNUKXDPDRZZBU-OLZOCXBDSA-N	439.394	1.025	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)[C@@H](Cc2cccc(F)c2)n2nnnc2C)c1	915691391	ZXSNVNJMFGCKMD-GOSISDBHSA-N	428.424	1.383	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)NCCc2ccc(S(N)(=O)=O)cc2)c2ccccc2n1	915883785	LFRWUDHUDIYDGZ-UHFFFAOYSA-N	427.486	1.377	50	20	IDGD	
Cc1ccc([C@@H](CNC(=O)NNC(=O)COc2ccc(C#N)cc2)N2CCOCC2)o1	916229424	PNSPROYFELFBGJ-GOSISDBHSA-N	427.461	1.242	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)NCc2ccccc2S(=O)(=O)N(C)C)c1C	916237575	BRFASPZLHYMERX-INIZCTEOSA-N	448.545	1.852	50	20	IDGD	
CC(=NNC(=O)c1ccc(-n2cnnn2)cc1)c1ccc(OCC(=O)N2CCCC2)cc1	916352114	QPXRDMTWXMNMNE-UHFFFAOYSA-N	433.472	1.818	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)NC[C@@H](c1ccccc1)N1CCOCC1	916509414	OBYTYFRRQAIDMI-LPHOPBHVSA-N	430.480	1.997	50	20	IDGD	
Cn1cnnc1SCC(=O)Nc1cccc(C(=O)NNC(=O)c2ccc(Cl)nc2)c1	917253491	OLTTWVCSAPKOCD-UHFFFAOYSA-N	445.892	1.669	50	20	IDGD	
O=C(CCn1cc(Cl)cn1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	917528469	DIRWHGBXTJQIEU-UHFFFAOYSA-N	425.898	1.172	50	20	IDGD	
Cc1nn(CC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c(C)c1Cl	918141250	KLKDUCHXQDBFHM-UHFFFAOYSA-N	439.925	1.399	50	20	IDGD	
COc1ccc([C@@H]2CCCN2C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c(OC)c1	918779252	JADKFPPKMPXYSR-SFHVURJKSA-N	437.460	1.871	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)[C@@H](C)NC(=O)C1CCCCC1	919636732	YNXGLVQUCCJFGU-GFCCVEGCSA-N	439.896	1.738	50	20	IDGD	
O=C(CN1CCC[C@H](C(=O)Nc2ccc(Cl)cn2)C1)NNC(=O)c1ccc(F)cc1	919673794	YKBJVZIQQAHSFT-AWEZNQCLSA-N	433.871	1.986	50	20	IDGD	
COc1ccc(-n2ccc(C(=O)NNC(=O)c3csc(N4CCOCC4)n3)n2)cc1	919810063	UWUYNJZKJZSUIE-UHFFFAOYSA-N	428.474	1.249	50	20	IDGD	
CCOC(=O)C1CCC(NC(=O)NNC(=O)c2csc(N3CCOCC3)n2)CC1	921118244	NLEFPWDISKFKJP-UHFFFAOYSA-N	425.511	1.046	50	20	IDGD	
CN1CCN(Cc2cccc(CNC(=O)NNC(=O)COc3ccccc3O)c2)CC1	1251704193	GTTFVBQWXXYEGP-UHFFFAOYSA-N	427.505	1.049	50	20	IDGD	
COC(=O)c1ccc(Cl)cc1S(=O)(=O)NNC(=O)c1cncn1-c1ccccc1	1318136124	RAYPDKOIRBQXJK-UHFFFAOYSA-N	434.861	1.936	50	20	IDGD	
COc1ccc(C(=O)NN=Cc2ccc(OCC(=O)N3CCOCC3)c(OC)c2)cc1	1318442233	IILIHNGPUVMSSE-UHFFFAOYSA-N	427.457	1.705	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(CCN(C(=O)c3cnnc4ccccc34)C2)C1	1777724640	YXLYUWDQZKYMBF-IBGZPJMESA-N	433.306	1.858	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)c3cc4ccccc4o3)C2)C1	1777842023	AVJWTCZBJAEFNH-QHCPKHFHSA-N	449.467	1.189	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(C)(C)F)C2	1778091206	LCDOSECGXSHFLB-BBPCXNGUSA-N	435.500	1.382	50	20	IDGD	
Cc1ccccc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2	1780336447	UEORKOJAGSZGLF-ZJSXRUAMSA-N	436.317	1.116	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1cccnc1)C2)[C@@H](F)Br	1780773170	FJDPMAGYSRHYIS-QGPMSJSTSA-N	428.302	1.829	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](F)Br)C2)cc(O)n1	1780773739	VIJLQTFFZOAOMH-DDUZABMNSA-N	444.301	1.914	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)[C@@H](N)Cc3cccnc3)CCO2)C1	1781230626	XNJUFQPTKUYETA-SNRMKQJTSA-N	429.348	1.018	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(NC(C)=O)c(O)c3)C2)C1	1782135910	OJGXAZJDDHPJOG-QRWLVFNGSA-N	439.896	1.048	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Br)C2	1782177953	BLKYUMIHCZSFFQ-RTWAVKEYSA-N	429.714	1.445	50	20	IDGD	
C[C@H](C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@](C)(Cl)CCl)C2)n1cncn1	1782532370	YDQNNRZVCFORLG-KJWYOANISA-N	432.352	1.589	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccncn1)CCO2	1782866238	OEHVVONQFXXCDA-KYIYGJGQSA-N	439.422	1.805	50	20	IDGD	
COC(=O)[C@H]1CC[C@H](C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](C)Br)C3)C2)CC1	1783529196	GEHJOQVAEAZSEA-GPINWOSQSA-N	445.354	1.579	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](N)c1cccc(Cl)c1)CCO2	1783533404	UPGVIWSIEZJTIH-WBHUJUFNSA-N	444.757	1.953	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@H](C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)C1	1783866370	FOBUEDOIHFADAF-NXEZDXNNSA-N	445.354	1.579	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H]1Cc3ccccc3CN1C)CCO2	1783873680	SFWWFJYOOOSJPJ-JQVVWYNYSA-N	435.952	1.127	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cc(Cl)c(O)cc3O)CCO2)C1	1783880318	HCMJBAJKWCQZBI-FZKQIMNGSA-N	433.288	1.449	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3c(C)nc4ccc(F)cn34)CCO2)C1	1783881970	OQMNVCUPBMTTRJ-MGPUTAFESA-N	438.887	1.479	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc(N(C)C)o3)C[C@@H]21	1783969862	QEOLCWZYWBAJLT-XUXIUFHCSA-N	443.342	1.365	50	20	IDGD	
CCOC(=O)c1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]3C2)cc1	1784092092	GMAWETGDMQCGDW-FJIDUMEYSA-N	438.908	1.056	50	20	IDGD	
Cn1cccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]32)c1=O	1784733643	MCURIKKGPWAPJM-XPVILTJLSA-N	430.332	1.215	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(CC(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](F)Cl)CCO3)C1	1785480187	IHMFOCHIBBIKQG-BEFAXECRSA-N	433.908	1.608	50	20	IDGD	
C[C@@H](CBr)C(=O)Nc1ccc(C2(NC(=O)CN3CCNC3=N)CCC2)cc1	1786068982	GJLBWPVONRWFDW-ZDUSSCGKSA-N	436.354	1.991	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C[C@H](N)c3cccnc3)[C@H]2C1	1786928455	KDPJBVCFHHAIAZ-DRCYAFTPSA-N	443.375	1.688	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(C=O)s3)[C@H]2C1	1786989644	IISGPJAMLPMYGF-XWUBHJNHSA-N	429.336	1.937	50	20	IDGD	
C=CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]2C1	1787443721	RSGAMPWDTLFTPT-ARKGTOAJSA-N	447.935	1.970	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4c(c3)CCN4C)[C@H]2C1	1787998788	KDEDVELLWNUPOF-JPLJXNOCSA-N	435.952	1.526	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CSCc3[nH]cnc3C)[C@H]2C1	1788538165	PXPPKJHOVLFEQK-MPTYRVRUSA-N	428.986	1.948	50	20	IDGD	
COc1ccnc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]32)c1	1788892029	CWBTWYGDYIRBLX-BCRCDCHUSA-N	430.332	1.920	50	20	IDGD	
Cc1c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)C(C)(C)CCl)C[C@@H]32)cn2[nH]cnc(=O)c12	1789172802	RSJMTMUEDYOGSM-BPUTZDHNSA-N	449.939	1.189	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C\C(=O)NC3CC3)C[C@@H]21	1789867602	AWBWNXCSEMPEMJ-HDAVKZNTSA-N	432.348	1.037	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CSc3ncccn3)C[C@@H]21)[C@@H](F)Br	1789922181	FVKSHGKCQSACCK-ZJQBRPOHSA-N	447.330	1.239	50	20	IDGD	
CCN1CCC(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]3C2)CC1	1789926958	MCAAUEWCYVBOGY-YHUYYLMFSA-N	434.350	1.389	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccnc(C)n3)C[C@@H]21	1790961664	NTNPJGVDBYUYEF-AYDFFVQHSA-N	425.327	1.552	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3(C(F)(F)F)CCC3)C[C@@H]21	1791251871	YNZUPLCFGMZFQD-FQUUOJAGSA-N	426.863	1.953	50	20	IDGD	
CCOc1cccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](Cl)COC)[C@H]3C2)c1O	1791256569	BSVPQJHUOGPSPZ-SCNOPHJPSA-N	440.924	1.638	50	20	IDGD	
CC(=O)NCC(=O)Nc1ccc(C2(NC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CCC2)cc1	1791266632	JVDLPEFBTSBVPZ-MZJWZYIUSA-N	438.488	1.391	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3CCc4nc[nH]c4C3)[C@H]2C1	1791530487	UOJZHRQGUFPVKI-RVFOSREFSA-N	439.354	1.278	50	20	IDGD	
CCC[C@H](NC(C)=O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)CBr)C[C@@H]21	1792182099	KOZPUXOYFXTTPQ-VFTHGPRRSA-N	446.386	1.302	50	20	IDGD	
CC(C)NC(=O)OC(C)(C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(C)(C)CCl	1792784685	PIGZNSUYPZUQNK-QDMKHBRRSA-N	431.961	1.754	50	20	IDGD	
C[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)CBr)n1ccccc1=O	1792870361	FPJJZIVCGUFKKW-JGFGOLAASA-N	440.338	1.030	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCl)[C@@H]1CC(=O)N(Cc2ccccc2)C1	1793107086	NDRFCMUYPJDFFG-UJWQCDCRSA-N	433.936	1.273	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C[C@H]1OCCc2ccccc21	1793488647	OFJCUDONVIUECG-RCLSDMTESA-N	442.560	1.702	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCBr)c1cc(=O)nc2sccn12	1795494371	VAQWLQQMYCNXLZ-ZSBIGDGJSA-N	439.335	1.793	50	20	IDGD	
Cc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Br)C3)ncc1[N+](=O)[O-]	1796602144	URLHSCKZHAWNLG-DJBIQUGXSA-N	445.245	1.192	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1ccc2cccnc2n1	1797358974	QDSLZZVDUXAIOF-NEBZKDRISA-N	437.269	1.524	50	20	IDGD	
C[C@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CO[Si](C)(C)C	1797953883	NYQILAXPNONRAT-MPTYRVRUSA-N	443.617	1.341	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccnn1)C2	1799220599	IKRHDJMVFPYCSW-QDMKHBRRSA-N	439.428	1.876	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1(CNC(=O)OC(C)(C)C)CC1)C2	1799264698	NMNBKRGMYVABRG-FZKCQIBNSA-N	443.972	1.898	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccccc1C(N)=O)C2	1799277144	UMSIDWCRIBFXPP-CVGJEZRXSA-N	428.316	1.225	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nnsc1C1CC1)C2)[C@@H](F)Br	1799347328	MDFQCSOAWZKRDB-BSTOTGJRSA-N	433.303	1.309	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CNC(=O)OC(C)(C)C	1800673965	JIDHXUJAJDGOBC-GUIRCDHDSA-N	448.358	1.132	50	20	IDGD	
COc1cccc(CCC(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)n1	1803135892	KAKDOJWRQOYBMR-MMOPVJDHSA-N	446.935	1.724	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cn3ccccc3n2)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803138931	HXKHVQJVNHZWPB-VDZJLULYSA-N	427.892	1.649	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)n1cccc1C=O	1803139337	XGNDVBURQFULEW-JZGRTCEGSA-N	432.908	1.562	50	20	IDGD	
CNC(=O)CC(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)CBr)[C@H]1c1cccnc1	1803473274	NHUCCXZSSWNEAP-JDFRZJQESA-N	425.327	1.255	50	20	IDGD	
CSCC(C)(C)C(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1803631083	JXNIDLLDQFNXHR-XLIONFOSSA-N	449.621	1.850	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)c2ccc[n+]([O-])c2)[C@@H]1c1cccnc1	1804781710	CRVGHDQGKXNSFI-LXZKKBNFSA-N	433.306	1.818	50	20	IDGD	
O=C(Cc1ccc2c(c1)OCO2)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1	1806674272	DCXRNFMQAUESRL-FIKGOQFSSA-N	445.903	1.659	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)C(C)(C)NCCC#N)[C@H]1c1cccnc1	1807149131	CZNZBZKMQGRBFD-FGTMMUONSA-N	435.956	1.623	50	20	IDGD	
Cc1cc[nH]c1C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1807361666	HBPLVSFEGIYYEQ-GHTZIAJQSA-N	432.289	1.031	50	20	IDGD	
Cc1ccc(C(=O)N2CCCC3(CCN(C(=O)CCC(=O)NN(C)C)CC3)C2)nc1C	1807797176	VKSHMVJRUQXBBR-UHFFFAOYSA-N	429.565	1.916	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC2(CCCN(C(=O)c3cncc(F)c3)C2)CC1	1808569475	NSPAHLMPZWHLBP-UHFFFAOYSA-N	425.269	1.059	50	20	IDGD	
CC[C@@H](NC(C)=O)C(=O)N1CC[C@H](CNC(=O)[C@H](F)Br)[C@@H]1c1cccnc1	1808649497	SIAMPOJQHKGDSD-WCVJEAGWSA-N	443.317	1.693	50	20	IDGD	
N=C(N)SCC(=O)N1CC[C@H](CNC(=O)[C@@H](F)Br)[C@@H]1c1cccnc1	1808661660	OJABGHVKELSLBZ-KGYLQXTDSA-N	432.319	1.405	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H](CNC(=O)c2c[nH]c(=O)cn2)[C@H]1c1cccnc1	1811453708	LSMLDQGGZGDROT-NRXGSXMXSA-N	438.315	1.721	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2cccn(C)c2=O)[C@@H]1c1cccnc1	1813028948	ZBRAELSAUAZSFM-BPQIPLTHSA-N	432.908	1.354	50	20	IDGD	
C=CCO[C@H](C)C(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1813069067	UESUUICGLHVCGP-MMOPVJDHSA-N	431.537	1.052	50	20	IDGD	
Cc1cccc(CC(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2ccc(B(O)O)cc2)CC3)c1	1813907202	VSQIDMIXXZYNIX-SFHVURJKSA-N	449.341	1.600	50	20	IDGD	
Cc1ccnc(C(=O)N[C@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)c1	1815341070	SXDKGDQXGPFFQP-HNNXBMFYSA-N	436.302	1.066	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H]1CCC(F)(F)C1)CC2)c1cccc(B(O)O)c1	1815347898	VXOUNGUSEMGQEK-OCCSQVGLSA-N	449.288	1.484	50	20	IDGD	
O=C(Cc1cccs1)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1	1815354842	URNCUPJGKYJXQA-CQSZACIVSA-N	441.343	1.353	50	20	IDGD	
Cc1nn(C)c(C(=O)Nc2cc([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)c1F	1816246074	ZEVQFGVSHKXGHJ-CQSZACIVSA-N	448.503	1.270	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2csc(N)n2)n[nH]1	1817389181	RRAGNIAYBNCSOL-CYBMUJFWSA-N	434.526	1.127	50	20	IDGD	
CS(=O)(=O)N1CCC(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)[C@H](F)Cl)[nH]n2)CC1	1818815061	NZQOAMGHEQTMAU-ZFWWWQNUSA-N	449.936	1.608	50	20	IDGD	
Cc1ccc(O)c(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)c1	1820463480	QQWJWIRBBOPNGF-LJQANCHMSA-N	448.288	1.723	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1cc([C@H]2CCCCN2C(=O)C[C@H](NC)C(=O)O)[nH]n1	1822087147	GOSWZKQVWMMEGH-WCFLWFBJSA-N	444.330	1.638	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](N)CCC(N)=O)[nH]n1	1822087660	MVNLYUKEJRXSMR-GMXVVIOVSA-N	443.346	1.168	50	20	IDGD	
C[C@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1)C1(O)CCC1	1823733456	WNUPRKXZKBZYFB-UTKZUKDTSA-N	442.365	1.151	50	20	IDGD	
Cc1cccn2ncc(C(=O)Nc3nc4c(s3)C[C@@H](NC(=O)[C@@H](O)CCl)CC4)c12	1824335144	QFBWMJDVGUFEHN-FZMZJTMJSA-N	433.921	1.925	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](C)n3ccnn3)sc2C1	1824692156	BIGXMBWKQIDNBX-IVZWLZJFSA-N	427.328	1.691	50	20	IDGD	
CC[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)C1=NNC(=O)C1)CC2	1825445843	JOFAJRDXMXLIIE-JGVFFNPUSA-N	428.312	1.105	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC([C@@H]2CCCCN2C(=O)Cn2ccnn2)CC1	1827235299	ZYYZWQIVQCLORZ-ZBFHGGJFSA-N	426.359	1.929	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccncc2F)CC1	1827958673	LWQFNKAMGGINKZ-LJQANCHMSA-N	433.528	1.827	50	20	IDGD	
CNC(=S)NCCC(=O)N1CCC([C@H]2CCCCN2C(=O)CO[Si](C)(C)C)CC1	1829102676	DLWWCUUAPFKLDJ-QGZVFWFLSA-N	442.702	1.942	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCCC[C@H]1C1CCN(C(=O)CN2C(=O)C=CC2=O)CC1	1829103138	DGOSONGDXDBNFU-KRWDZBQOSA-N	435.597	1.383	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](C)NC(=O)OC(C)(C)C)CCO2)C1	1830303731	KTLXNOSLLYSMKC-MDOVXXIYSA-N	447.960	1.373	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnn4ncccc34)C2)C1	1830357575	HGOXZBIHZMYVFT-HXUWFJFHSA-N	435.912	1.064	50	20	IDGD	
O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)COC1CCCCC1)CCO2	1830375538	IAQHCVJVPGFULG-LJQANCHMSA-N	447.370	1.577	50	20	IDGD	
O=C(c1ccc(Cl)c(F)c1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1830732987	CSUVWHNVROBUCE-QAPCUYQASA-N	435.279	1.149	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3cnn(C)c3)C2)C1	1831646287	KLJZOFPTINHIHD-PXNSSMCTSA-N	426.945	1.217	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)C[C@](C)(O)CC(=O)O)CC1	1831869432	NHWWRXXTVLWLKQ-YRNRMSPPSA-N	432.945	1.476	50	20	IDGD	
O=C1C[C@H](C(=O)N2CCCC[C@@H]2C2CCN(C(=O)[C@H](F)Br)CC2)CCN1	1831942422	VUOJJRMLKLRXIO-FMKPAKJESA-N	432.334	1.823	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)CCc2ncc[nH]2)CC1	1832075671	IFELQHVOZQSHJD-GOSISDBHSA-N	432.569	1.335	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)/C=C/c3ccoc3)CCO2)C1	1832652276	FANHTBKTYYFIRM-FPZJGVQBSA-N	441.322	1.923	50	20	IDGD	
Cn1nc(C(=O)N2CCC(N3CCC(NC(=O)C(C)(C)CCl)CC3)CC2)cc1O	1833212291	WMSUIULQSLDINO-UHFFFAOYSA-N	425.961	1.576	50	20	IDGD	
COc1ccc(C(=O)N2CCC(N3CCC(NC(=O)[C@@H](O)CCl)CC3)CC2)cc1F	1833306716	ZKPLIUZPUPEFHY-SFHVURJKSA-N	441.931	1.619	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)C3CCSCC3)C2)C1	1834827873	SHJAHJPTJCBSLI-KRWDZBQOSA-N	435.384	1.371	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)Cc3cccnc3)CC2)CC1	1834880776	DKSVRKCWVHLBPG-HNNXBMFYSA-N	437.382	1.979	50	20	IDGD	
C[C@H](C(=O)N1CCC(N2CCC(NC(=O)[C@@H](F)Cl)CC2)CC1)n1cccc1C=O	1835080279	OPMROULGJMXPAI-RDTXWAMCSA-N	426.920	1.968	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@H](OC(C)=O)C(C)C)CC2)CC1	1835650464	JZGYJKRPOWOVPX-RBUKOAKNSA-N	445.988	1.400	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3ccnc(Cl)n3)CC2)CC1	1835912154	WLQWNMXTNHKBFE-HNNXBMFYSA-N	444.363	1.569	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3nnc(C)s3)CCO2)C1	1836076634	MJQBTYLQABMUIN-KDOFPFPSSA-N	430.958	1.253	50	20	IDGD	
Cc1n[nH]cc1C(=O)NC1CCN(C2CCN(C(=O)[C@H](C)CBr)CC2)CC1	1836152145	COPLJPVLMTUHCZ-CYBMUJFWSA-N	440.386	1.934	50	20	IDGD	
Cc1ccc(CCC(=O)N2CCC(OC3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)nc1	1836715564	VBJAVXDUJALZOB-FQEVSTJZSA-N	437.968	1.921	50	20	IDGD	
O=C(c1ccncc1Cl)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836718558	SNLCFIFBLABHGP-QGZVFWFLSA-N	430.332	1.947	50	20	IDGD	
Cn1cnc(C(=O)N2CCC(OC3CCN(C(=O)[C@H](F)Br)CC3)CC2)n1	1837383227	WXSDZKRTPZCXTL-ZDUSSCGKSA-N	432.294	1.118	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)/C=C/c3cc(C)on3)CCO2)C1	1837552327	KQIBLCQHTZJVPZ-ZARSWLQMSA-N	425.913	1.860	50	20	IDGD	
C[C@@H](C(=O)N1CCC(OC2CCN(C(=O)[C@@H](F)Cl)CC2)CC1)N1CCN(C)CC1	1838084278	UHMOXKNYGDXGPT-MAUKXSAKSA-N	432.968	1.155	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1c(F)cncc1F)CCO2	1838165676	QKCLKLPKBYCRAH-LJQANCHMSA-N	443.523	1.281	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(OC)ccc3F)C2)C1	1839148486	AKSIGCFUMGZMQW-JXFKEZNVSA-N	428.888	1.922	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3cnc4[nH]ccc4c3)C2)C1	1839148953	OVTJVIUOSJGKHN-GCJKJVERSA-N	448.951	1.969	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C#N)c[nH]3)C2)C1	1839153871	UJWLDPWZBQKMKF-QZTJIDSGSA-N	429.304	1.193	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)/C=C/C3CCCCC3)CCO2)C1	1839184352	IWAOTCDUMCWSMW-BIZHUJQWSA-N	428.957	1.833	50	20	IDGD	
O=C(CCc1ccsc1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839199746	STONRKDUUDICFJ-RDJZCZTQSA-N	449.342	1.828	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3c(C)n[nH]c3C)CCO2)C1	1839238314	GMPFMQIBGOGBKL-PXNSSMCTSA-N	426.945	1.433	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(O)c(F)c3)CCO2)C1	1839302880	REAVHAQSHFLLOT-FQEVSTJZSA-N	428.888	1.866	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3coc(Cl)n3)C2)C1	1840031028	DGLJGGWPHMBGGO-ZUZCIYMTSA-N	436.690	1.181	50	20	IDGD	
C[C@H](Br)C(=O)N1CC2(CCCN2C(=O)c2cccc(S(C)(=O)=O)c2)C1	1841172977	HDPLTUHVZMDHSJ-LBPRGKRZSA-N	429.336	1.691	50	20	IDGD	
COc1c(Br)cccc1C(=O)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1	1841352910	TYZLDMFAKIUXKP-CYBMUJFWSA-N	431.714	1.874	50	20	IDGD	
CN1CCC[C@@H](C(=O)N2CC3(CCCN3C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)C1	1841925037	HXBPNKPHUDAFJD-CVEARBPZSA-N	442.988	1.664	50	20	IDGD	
Cc1ccc(=O)n(C(C)(C)C(=O)N2CC3(CCCN3C(=O)[C@@H](F)Br)C2)n1	1845217977	GGYAGHLILKELDN-CYBMUJFWSA-N	429.290	1.181	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)C1CN(C(=O)OCc3ccccc3)C1)C2	1846364479	RIFSNBYFJNQCHB-GOSISDBHSA-N	449.935	1.712	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc(O)n(C)n1	1848327842	ODVVYYFKLHVURE-HOTGVXAUSA-N	443.416	1.088	50	20	IDGD	
CC(=O)N[C@H](CC(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1)c1cccs1	10414797	UIWVAXXPZPZSHJ-GFCCVEGCSA-N	444.922	1.077	50	20	IDGD	
O=C(CNC(=O)c1cccc(Br)c1)NNC(=O)c1cc(Cl)ccc1O	10625739	RDIDFXHBWHGUFR-UHFFFAOYSA-N	426.654	1.999	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)c2n[nH]c(=O)c3ccccc23)c([N+](=O)[O-])cc1OC	17195453	WRPVZKBLDSFBPU-UHFFFAOYSA-N	427.373	1.313	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)CCc2c(C)nc3nc(N)nn3c2C)c1C	18103409	UZDPFJAMTPREHK-OAHLLOKOSA-N	425.493	1.488	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)CCNS(=O)(=O)c1ccc(F)cc1	25414566	RIILLHKMSWKPEC-UHFFFAOYSA-N	439.465	1.119	50	20	IDGD	
O=C(NNC(=O)c1cc(C2CC2)[nH]n1)c1cccc(S(=O)(=O)NCc2ccccc2)c1	30562921	UCKJGLICPUZQGY-UHFFFAOYSA-N	439.497	1.840	50	20	IDGD	
COc1ccc(CN2C[C@@H](C(=O)NNC(=O)[C@H](C)Oc3ccccc3F)CC2=O)cc1	726497529	BWHHBQGCLXTSIP-HOCLYGCPSA-N	429.448	1.798	50	20	IDGD	
CCn1cc(Br)cc1C(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	726818082	BMHWHHRHIZOESL-UHFFFAOYSA-N	439.222	1.797	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)c2cc(-c3ccco3)nc3c(C(N)=O)ncn23)c(C)c1	728205468	KADHNRMIKYYOMG-UHFFFAOYSA-N	447.455	1.578	50	20	IDGD	
COc1ccc(OCC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)cc1	728213773	PQGPZFXWLBSZCT-UHFFFAOYSA-N	434.518	1.153	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)CCn2c(=O)n(C)c3ccccc32)c1	728529618	HEPDGOTUOSLTPN-UHFFFAOYSA-N	447.289	1.962	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)NCC(F)(F)F)cc1Br	729689833	STJCDHMCYLYTTE-UHFFFAOYSA-N	447.233	1.206	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCCn2c(=O)oc3ccccc32)nc1	730127448	CZJHFEFZKVHZKN-UHFFFAOYSA-N	434.478	1.003	50	20	IDGD	
O=C(COC(=O)[C@H]1CC(=O)N(c2ccc(F)cc2)C1)NNC(=O)c1ccc([N+](=O)[O-])cc1	730369165	JNFRWGZPRWGFEJ-ZDUSSCGKSA-N	444.375	1.091	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)[C@@H]1CCCN(C(=O)c2ccc3n[nH]cc3c2)C1	730778204	DHIQBWPZBFYBND-OAHLLOKOSA-N	437.456	1.347	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)N[C@@H]2CCN(c3ccccc3C(N)=O)C2)cc1	732575423	AUYXMUOUTMZMQJ-MRXNPFEDSA-N	425.489	1.336	50	20	IDGD	
CS(=O)(=O)NCCc1ccc(C(=O)NNC(=O)NCc2ccc(Cl)cc2)s1	733003398	LWRCEGQGPIQQHF-UHFFFAOYSA-N	430.939	1.637	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])o1)c1cnn(-c2ccccc2)c1	733109712	ASFBAHJRHJMUIP-HNNXBMFYSA-N	438.400	1.439	50	20	IDGD	
CN(C)[C@@H](CNC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)c1c(F)cccc1F	734675209	HSFKOHJRRJMMRO-INIZCTEOSA-N	430.419	1.187	50	20	IDGD	
COc1cc(OC)cc(C(=O)Nc2ccc(C(=O)NNC(=O)c3cnn(C)c3)c(O)c2)c1	735521463	FVAQVHGUWJKWJO-UHFFFAOYSA-N	439.428	1.470	50	20	IDGD	
O=C(COC(=O)Cc1ccccc1OC(F)F)NNC(=O)[C@@H]1COc2ccccc2O1	735733661	RGIAJSIUJAABRJ-INIZCTEOSA-N	436.367	1.361	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NC2CCN(C[C@H]3CCOC3)CC2)ccc1OC(C)C	736395211	MNIXETGCZNIGEO-MRXNPFEDSA-N	434.537	1.927	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NC[C@@H](C)CN1CCOCC1	739049570	PXWKTERJZZSWPI-KGLIPLIRSA-N	443.342	1.515	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CSc1nnc([C@@H]2CCCCO2)n1N	743455096	IHRSYXJVCLCDDV-ZDUSSCGKSA-N	440.913	1.449	50	20	IDGD	
Cc1ccc(N2C[C@@H](C(=O)NNC(=O)Nc3ccc(S(C)(=O)=O)cc3)CC2=O)cc1F	743830974	NXCHBYKBHLKTKV-ZDUSSCGKSA-N	448.476	1.743	50	20	IDGD	
O=C(CCNc1ccccc1[N+](=O)[O-])NNc1ccccc1S(=O)(=O)N1CCOCC1	744621944	JUXOIXDLKHPDFS-UHFFFAOYSA-N	449.489	1.561	50	20	IDGD	
COc1cc(OC)cc(C(=O)Oc2ccc(C=NNC(=O)C(=O)NC3CC3)cc2OC)c1	744824172	RENJFIVQWYDGTF-UHFFFAOYSA-N	441.440	1.660	50	20	IDGD	
COC(=O)COc1ccc(C(C)=NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1	744999507	SOMCRUHTZBOVKN-UHFFFAOYSA-N	439.877	1.693	50	20	IDGD	
O=C(NCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNc1ccc(Cl)nc1	745311203	SOINLCXUZHDKDP-UHFFFAOYSA-N	425.898	1.582	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2ccc(F)c(Br)c2)n1	745573007	CQDRPIHCWRSLBN-UHFFFAOYSA-N	430.255	1.900	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)NCCCN2CCC[C@H](C(N)=O)C2)c1	745830166	KBXQCVSJELUNFX-KRWDZBQOSA-N	433.553	1.415	50	20	IDGD	
CCCCN1C(=O)CC[C@H](C(=O)NNC(=O)N2CCOCC2)[C@@H]1c1ccccc1OC	745991865	HYVATINLNICVDJ-PXNSSMCTSA-N	432.521	1.848	50	20	IDGD	
Cc1ccc(C)c(S(=O)(=O)Oc2ccc(C(=O)NNC(=O)N3CCOCC3)cc2)c1	745993195	ZPUGMUHIIYVJAP-UHFFFAOYSA-N	433.486	1.758	50	20	IDGD	
CC(C)NC(=O)NNC(=O)[C@@H]1CCCN1C(=O)NCc1cccc(Br)c1	746176840	WAWHONIBAPNESV-AWEZNQCLSA-N	426.315	1.862	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)c2cn(CC(=O)C(C)(C)C)nn2)c1	746215306	NIOPCEBHSSZRTB-UHFFFAOYSA-N	438.282	1.739	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)c2ccc(CS(N)(=O)=O)cc2)cc1OC	746346574	MEPMBJUJHDMBBW-UHFFFAOYSA-N	435.502	1.737	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)[C@H]1CCCN1c1ncccn1	747347793	GQYMLQMCJQOKIZ-IUODEOHRSA-N	434.294	1.823	50	20	IDGD	
CC(C)(C)OC(=O)[C@H]1CN(C(=O)NNC(=O)c2ccc(Br)s2)CCO1	747490377	JYQJRQJPMPQENC-SECBINFHSA-N	434.312	1.908	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2ccc3c(c2)CCCN3C(C)=O)cc1OC	747846557	UGCBXRMABAVDKB-UHFFFAOYSA-N	433.486	1.626	50	20	IDGD	
C[C@H]1CCc2c(sc3nc(CCC(=O)NNC(=O)C(=O)N4CCCC4)nc(O)c23)C1	748247441	NXIJCSBVJWRUHH-NSHDSACASA-N	431.518	1.224	50	20	IDGD	
O=C(CCc1nc(-c2ncccn2)no1)NNc1nc(-c2ccccn2)nc2c1CCC2	748337222	BPHRZXKEGTWJMJ-UHFFFAOYSA-N	429.444	1.943	50	20	IDGD	
COc1cc(OC)cc(N2CC[C@@H](NC(=O)NNC(=O)c3cccc(N(C)C)c3)C2)c1	748659600	BNFVWWZWDCJJRS-MRXNPFEDSA-N	427.505	1.993	50	20	IDGD	
NS(=O)(=O)Cc1cccc(C(=O)NNC(=O)COc2ccccc2-c2ccccc2)c1	749400192	UJYLZOGCEDLYDO-UHFFFAOYSA-N	439.493	1.982	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)[C@H]1CCCN1C(=O)c1ccc2c(c1)OCO2	749468448	DIPKVWOMBFRRNK-CZUORRHYSA-N	443.431	1.774	50	20	IDGD	
Cc1noc(C)c1[C@@H](C)CC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	754084554	LEGUGXPUWYDOKV-AWEZNQCLSA-N	435.550	1.864	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN(C)CCN1C(=O)c2ccccc2C1=O	754360911	ANLPTOFNXJEWTH-UHFFFAOYSA-N	444.875	1.338	50	20	IDGD	
O=C(NNC(=O)c1ccccn1)Nc1ccc(Cl)c(S(=O)(=O)N2CCOCC2)c1	755361029	KABWJLDIYVAWJV-UHFFFAOYSA-N	439.881	1.222	50	20	IDGD	
COC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(NC(=O)NNC(=O)c3ccc[nH]3)cc2)C1	755557604	KESRMNGICVTWHM-CYBMUJFWSA-N	449.489	1.055	50	20	IDGD	
Cc1c(NNC(=O)NC2CCN(S(=O)(=O)C(F)(F)F)CC2)cccc1[N+](=O)[O-]	756148207	FWRMWFVVLUYNRX-UHFFFAOYSA-N	425.389	1.843	50	20	IDGD	
COC(=O)CCCc1nnc(NC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)s1	756687255	UQDNHBRZLDFVRJ-UHFFFAOYSA-N	445.461	1.392	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)Nc1ccc(S(=O)(=O)NCC2CC2)cc1	756786120	XOGAKXOFMMVPFM-UHFFFAOYSA-N	443.485	1.478	50	20	IDGD	
CN(NC(=O)[C@@]1(C)Cc2ccccc2C(=O)O1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758787616	UJUDXEXOVAUBGA-JOCHJYFZSA-N	446.504	1.794	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)NC[C@H]2CSCCN2Cc2ccccc2)cc1	759322493	KPBZSJVSLLLUHG-IBGZPJMESA-N	439.541	1.885	50	20	IDGD	
Cc1cc(C)c(C=NNC(=O)C[C@@H](C(=O)NN=Cc2[nH]c(C)cc2C)N2CCOCC2)[nH]1	760260168	LCSOQIRTZSFYSJ-FQEVSTJZSA-N	441.536	1.268	50	20	IDGD	
Cc1ccnc(-n2nccc2NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)c1	760278601	ZXJGDNWHJVZLAR-CYBMUJFWSA-N	426.408	1.268	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)C(=O)Nc1ccc([S@@](=O)C(F)(F)F)cc1	763550731	GCPXBDJOUYMUTN-SSEXGKCCSA-N	443.359	1.442	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)N2C[C@@H](CC(=O)N(C)C)c3cc(Cl)ccc32)c(C)o1	763581626	CGIBVWMQAYHCCS-CYBMUJFWSA-N	446.891	1.920	50	20	IDGD	
COc1ccc(NC(C)=O)cc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccccc2)[nH]n1	763611619	BJSLAYGHLKWAMG-UHFFFAOYSA-N	436.428	1.443	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)n(C)c(=O)n3C)c2ccccc2n1	763617145	VCSYERHSXCOZOI-UHFFFAOYSA-N	432.440	1.133	50	20	IDGD	
O=C(COc1cccc(C(F)(F)F)c1)NNC(=O)C(=O)Nc1cnc2c(c1)COCC2	763640092	SMQQSWAVFSZMPQ-UHFFFAOYSA-N	438.362	1.338	50	20	IDGD	
COC(=O)NCc1ccc(NC(=O)C(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)cc1	763732145	AHEUKEXLZJJPPE-UHFFFAOYSA-N	428.489	1.845	50	20	IDGD	
O=C(CN1CCCc2ccccc21)NNC(=O)C(=O)Nc1ccnn1CCc1ccccc1	763746077	QDRBDCZKCPOQPK-UHFFFAOYSA-N	446.511	1.665	50	20	IDGD	
CN1CC(=O)N(c2cccc(NC(=O)C(=O)NNC(=O)c3cccc(Cl)c3)c2)C1=O	763747820	MUVPIVGHUOTBFN-UHFFFAOYSA-N	429.820	1.138	50	20	IDGD	
CC(C)n1nnnc1-c1ccccc1NC(=O)C(=O)NNC(=O)c1cccc(Cl)c1	763750095	HXYXCHIFGQTCMB-UHFFFAOYSA-N	427.852	1.974	50	20	IDGD	
Cc1cn(C2CCCCC2)nc1NC(=O)C(=O)NNC(=O)COc1ccccc1[N+](=O)[O-]	763802823	AWERPAHWNJXXAU-UHFFFAOYSA-N	444.448	1.770	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)C(=O)Nc1cnn(-c2ccccc2F)c1	763804668	PCYMHBDHGWSWNE-UHFFFAOYSA-N	442.363	1.085	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(-n3cc(C)cn3)c(F)c2)cc1	763820315	FMSSYTIOQPWWHG-UHFFFAOYSA-N	425.420	1.793	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3cccc4c3oc(=O)n4C)cc2C1	763941977	LHEXUNQXIJNZQT-JTQLQIEISA-N	428.470	1.718	50	20	IDGD	
NC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cccc(Br)c2)ccc1Cl	764063061	KEAMOGWPUPPMMH-UHFFFAOYSA-N	439.653	1.601	50	20	IDGD	
C#CCOc1ccc(F)cc1NC(=O)C(=O)NNC(=O)c1cccc(Br)c1	764063205	KRYFZBMTUISWEX-UHFFFAOYSA-N	434.221	2.000	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1cccc(C)c1C(=O)N1CCCC1	764131046	DCUQXSDPKFTKES-UHFFFAOYSA-N	438.484	1.568	50	20	IDGD	
COC(=O)c1cc(Cl)ccc1NC(=O)C(=O)NNC(=O)CCc1ccc(OC)cc1	764132216	QYSNDMWXJRTMCI-UHFFFAOYSA-N	433.848	1.854	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2cccc([C@@H](C)N3CCOCC3)c2)c1O	764133811	XTYHMPVMVDZYIV-CQSZACIVSA-N	442.472	1.194	50	20	IDGD	
CN(C)CC(=O)NNC(=O)C(=O)Nc1ccc(C(=O)N(C)C2CCCCC2)c(Cl)c1	764204639	WZRQUQXABBBANN-UHFFFAOYSA-N	437.928	1.392	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)C(=O)Nc1ccc2nc3n(c(=O)c2c1)CCC3	764243682	VYOLZFCGXMCTGF-UHFFFAOYSA-N	444.451	1.084	50	20	IDGD	
CCOC(=O)COc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)c1	764349821	RDQOGVMDSNRQNY-UHFFFAOYSA-N	435.820	1.387	50	20	IDGD	
COc1nccnc1NNC(=O)Nc1cccc(S(=O)(=O)NC2=NCCCCC2)c1	764597342	GPGIWPVAYHFMHT-UHFFFAOYSA-N	433.494	1.885	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NN=Cc3cc(C)ccc3F)CC2)cc1	764820467	ZBOYJHJSRXEROC-UHFFFAOYSA-N	432.521	1.899	50	20	IDGD	
CC(C)[C@H](C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)N1C(=O)c2ccccc2C1=O	765313647	SDXYQJIOVFAQPN-QGZVFWFLSA-N	446.504	1.760	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)Cn3nc(-c4ccccc4)oc3=O)n[nH]2)cc1	765571666	MZTCRBYRCPKDSY-UHFFFAOYSA-N	432.440	1.917	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(C)o2)c(I)c1	765699516	ULFJRFCVZLAFAL-UHFFFAOYSA-N	443.197	1.601	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)[C@@H](C)N3C(=O)NC4(CCCC4)C3=O)n[nH]2)cc1	768268623	QDGHXPFURXWQOS-CYBMUJFWSA-N	438.488	1.653	50	20	IDGD	
COc1ccccc1-n1c(C)nnc1SCC(=O)NNC(=S)NCCSC	770248009	PMCACIGYBAPOAI-UHFFFAOYSA-N	426.593	1.535	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)N[C@H]2CC(=O)N(c3c(F)cccc3F)C2)nc2ccccc21	771436079	UGUYUIXFDMTDMK-LBPRGKRZSA-N	442.426	1.530	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1cccc(S(=O)(=O)N2C[C@@H](C)C[C@@H](C)C2)c1	771886862	DRHPAMMPCIXZCQ-QLFBSQMISA-N	439.534	1.456	50	20	IDGD	
CCS(=O)(=O)NCCc1ccc(S(=O)(=O)NNC(=O)NC2CCCCC2)s1	773226073	GROXLQWRAGWFAM-UHFFFAOYSA-N	438.597	1.055	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)c2ccnc(O[C@@H]3CCOC3)c2)C1	773420780	PLLYNDZICOEPKZ-JKSUJKDBSA-N	434.493	1.657	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(C(=O)NNC(=O)[C@H]2CCCN(C(=O)OC(C)(C)C)C2)C1	774246165	OOKJDZUYYNSWEH-ZDUSSCGKSA-N	426.514	1.648	50	20	IDGD	
CC(=NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1)c1ccc(Cl)cn1	774396535	HLDFRYUSAPEXRR-UHFFFAOYSA-N	449.964	1.890	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)N(C)CC(=O)NNc2cnc3ccccc3n2)cc1	774773763	JSWAPLYWYSGMDH-UHFFFAOYSA-N	428.474	1.352	50	20	IDGD	
O=C(COC(=O)c1cccc(N2C(=O)CCC2=O)c1)NNC(=O)c1cccc(Cl)c1	774849934	FEQHZRYTRBYRJV-UHFFFAOYSA-N	429.816	1.611	50	20	IDGD	
O=C(c1cc(Br)ccc1O)N1CCN(S(=O)(=O)CBr)CC1	777777866	QNSQXKXUMOHFOY-UHFFFAOYSA-N	442.129	1.595	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)CN(C)C(=O)c2ccc(Br)o2)nc1C	778423392	AXNDEYCHACNPSX-UHFFFAOYSA-N	440.254	1.533	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)c1cc(F)ccc1I	778448272	QJOAXFZDKJPXNS-UHFFFAOYSA-N	437.209	1.716	50	20	IDGD	
COCCN1C(=O)CCc2cc(NC(=O)C(=O)NNC(=O)Cc3ccc(F)cc3)ccc21	778709210	DQEPYIBZSZLIPV-UHFFFAOYSA-N	442.447	1.080	50	20	IDGD	
O=C(NNC(=O)c1c[nH]nc1-c1ccsc1)c1ccc(S(=O)(=O)N2CCCC2)cc1	780172308	XWZUYVFOWYZYOQ-UHFFFAOYSA-N	445.526	1.998	50	20	IDGD	
CN(C)CCc1ccccc1NC(=O)C(=O)NNC(=O)c1cc(Br)cn1C	782703113	WTFNNOYWWFGJRN-UHFFFAOYSA-N	436.310	1.291	50	20	IDGD	
O=C(NNc1ncccc1C(F)(F)F)C(=O)Nc1cccc(Cn2cccnc2=O)c1	783119647	BFGLZUFFZDIEES-UHFFFAOYSA-N	432.362	1.787	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2ccc(C(=O)N(C)[C@H]3CCCN(C)C3)cc2)nc(C)n1	783332045	UOEODYJSKKDTRJ-SFHVURJKSA-N	439.520	1.341	50	20	IDGD	
Cn1c(=NNC(=O)C(=O)Nc2cccc(Cn3cccnc3=O)c2)sc2ccccc21	783349560	LYUBYGRLAWXKSE-UHFFFAOYSA-N	434.481	1.415	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)C(=O)Nc1cccc(COCc2ccco2)c1	784004773	UNBLMQSJXWQNCS-UHFFFAOYSA-N	440.412	1.105	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N2CCC3(CC2)COC(=O)N3)cc1Br	784318537	ISRSUMNTRMUZHR-UHFFFAOYSA-N	427.255	1.387	50	20	IDGD	
CC(C)(C)OC(=O)N1CCc2ncc(NC(=O)C(=O)NNc3nccnc3Cl)cc2C1	784776532	KMCDJIRSUMMMFF-UHFFFAOYSA-N	447.883	1.900	50	20	IDGD	
O=C(NNc1nc(-c2ccc(Cl)cc2)no1)C(=O)Nc1ccc2c(c1)S(=O)(=O)CC2	784800138	ULRZIORGURWZOF-UHFFFAOYSA-N	447.860	1.802	50	20	IDGD	
CCNC(=O)N1CCc2ccc(NC(=O)C(=O)NNc3cccc(S(C)(=O)=O)c3)cc21	784844147	HTOJWZXKJHHIDZ-UHFFFAOYSA-N	445.501	1.264	50	20	IDGD	
CCNC(=O)N(C)NC(=O)C(=O)Nc1ccc(NC(=O)CN2CCCCCCC2)cc1	784915276	JDPWREHTMUTKGH-UHFFFAOYSA-N	432.525	1.522	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2ccc(N3CCCN(C)CC3)cc2)n1	785233725	NMBDEQGHLCZEAP-UHFFFAOYSA-N	440.552	1.547	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1cc(C)n([C@@H](C)C2CC2)n1	785331102	ORHJVOMQOBIQOI-LBPRGKRZSA-N	435.506	1.656	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)c(C)cc1C	788330074	CGGDFUVSNCQDHK-UHFFFAOYSA-N	433.848	1.908	50	20	IDGD	
COC(=O)c1cncc(S(=O)(=O)NNC(=O)c2ccc(OC)c(Br)c2)c1	788494203	QSAMRZCUGOWZBI-UHFFFAOYSA-N	444.263	1.263	50	20	IDGD	
COc1ccc(C(=O)NNc2nnc(-c3ccccn3)s2)cc1S(=O)(=O)N(C)C	788562384	FHGUUMNQFDFARB-UHFFFAOYSA-N	434.503	1.616	50	20	IDGD	
CCOC[C@@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)C(C)C	788875032	CMZHZERUOWTMJP-QGZVFWFLSA-N	426.539	1.476	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1nc2c(s1)CCCCCC2	789731391	DRZLUEZVMPWRAT-UHFFFAOYSA-N	427.486	1.839	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccc2c1OCC[C@@H]2N(C)C	789733256	WIRPVZUIQCGTQO-SFHVURJKSA-N	440.500	1.799	50	20	IDGD	
CN(C)[C@@H]1CCOc2c(NC(=O)C(=O)NNC(=O)c3cc([N+](=O)[O-])ccc3O)cccc21	789769825	UUTBXCPFOZLNGN-OAHLLOKOSA-N	443.416	1.085	50	20	IDGD	
COc1cccc(NC(=O)COc2ccc(C(=O)NNC(=O)CN3CCCC3=O)cc2)c1	789856913	NHPCTVPFERVAID-UHFFFAOYSA-N	440.456	1.096	50	20	IDGD	
O=C(NNc1nc2ccccn2n1)C1CCN(c2ccc3nnc(C(F)(F)F)n3n2)CC1	791259147	XQFDHHVWBYSSIV-UHFFFAOYSA-N	446.397	1.546	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2cccc([N+](=O)[O-])c2OC)cc(OC)c1OC	794867226	UYAGKHGBYJRWMH-UHFFFAOYSA-N	441.418	1.253	50	20	IDGD	
COC(=O)c1cc(F)cc(NC(=O)C(=O)NNC(=O)CCc2ccc(OC)cc2)c1F	797001771	LYQBDEJSQMYWCC-UHFFFAOYSA-N	435.383	1.479	50	20	IDGD	
CCC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)CNC(=O)OCc2ccccc2)cc1	797369074	NIXAURIMLMRFOX-UHFFFAOYSA-N	441.444	1.047	50	20	IDGD	
CCOc1cc(/C=C(\C#N)S(N)(=O)=O)cc(Br)c1OCC(=O)N(C)C	799893485	HLIIUEZXPDSDJB-VZUCSPMQSA-N	432.296	1.468	50	20	IDGD	
O=C(N=c1cc[nH]cc1)NNC(=O)c1sccc1S(=O)(=O)NCc1cccs1	802025270	YYDYZWPZKMQAHP-UHFFFAOYSA-N	437.528	1.572	50	20	IDGD	
C[C@@H](Sc1ccccc1C(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)C(N)=O	802069215	YDONSADNBFJYFG-LLVKDONJSA-N	436.515	1.523	50	20	IDGD	
COc1ccc(C2=NO[C@@H](CNC(=O)NNC(=O)COc3ccc(C#N)cc3)C2)cc1C	802358196	ZEMGIMYLJWQOPO-GOSISDBHSA-N	437.456	1.778	50	20	IDGD	
O=C(NCc1ccccn1)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	804030070	CUJRQKNHGPJRRY-UHFFFAOYSA-N	439.497	1.704	50	20	IDGD	
CN1CCC/C1=N/S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2cccc(F)n2)cc1	807392881	NEJCXQVHLWLMGP-JLPGSUDCSA-N	434.453	1.115	50	20	IDGD	
C[C@H]1COCC[C@H]1CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	807508585	GWWSRQVSZJBPFO-RDJZCZTQSA-N	438.550	1.478	50	20	IDGD	
C=CCCCCCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	807572346	ZDSVMLJJCPVULD-UHFFFAOYSA-N	438.550	1.788	50	20	IDGD	
N#Cc1ncn(-c2ccccc2NC(=O)C(=O)NNC(=O)c2c(Cl)cccc2Cl)n1	810386895	WLFYJGHSZFVMSX-UHFFFAOYSA-N	444.238	1.845	50	20	IDGD	
CCOc1cc(Br)c(F)cc1NC(=O)C(=O)NNC(=O)Cc1cccnc1	810387408	VAXOGYQMLVQGEC-UHFFFAOYSA-N	439.241	1.711	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1cccc2c1OCC(=O)N2	810407209	PFICQQVMAFMVJE-SNVBAGLBSA-N	432.820	1.224	50	20	IDGD	
Cc1cc([N+](=O)[O-])ccc1NNC(=O)C(=O)Nc1cc(C(N)=O)ccc1OCC(F)F	810416169	QQMVYWPVGHHMTL-UHFFFAOYSA-N	437.359	1.728	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NN=Cc1cn(-c2ccccc2Br)nn1	811641098	NJDZHZXPQFQHQZ-UHFFFAOYSA-N	433.291	1.971	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NC[C@](C)(O)Cc2ccc(OC)c(OC)c2)c(OC)c1	811876783	VWKUAPUGOYWYRO-JOCHJYFZSA-N	447.488	1.659	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@H](O)c3ccc(Cl)cc3F)CC2)cc1	813487620	JHDXYGAGHMHYQH-OAQYLSRUSA-N	448.926	1.786	50	20	IDGD	
COC(=O)c1ccccc1NNC(=O)c1cc(S(=O)(=O)NCCCN(C)C)ccc1C	813508034	CKKPNVAPDWXLJX-UHFFFAOYSA-N	448.545	1.769	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)Cc2ccc(F)cc2)cc1)[C@H]1C[C@H]1C	815567346	VEYZBLZOACWADB-YJYMSZOUSA-N	426.448	1.916	50	20	IDGD	
Cc1cccc(-n2c(NNC(=O)COCc3nncn3C)nc3ccccc3c2=O)c1C	815603915	YFURGEHIBNUTFA-UHFFFAOYSA-N	433.472	1.791	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H](CN2CCCC2)c2ccccc2)c1	816810488	NMYRUYVKVQOAPN-FQEVSTJZSA-N	444.557	1.578	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)CCn1c(S)nc2ccccc2c1=O	817054057	RBRWCKOOVZDQIY-UHFFFAOYSA-N	447.542	1.469	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)[C@@H](NS(=O)(=O)c1ccc(C)cc1)C(C)C	825624252	IPQFCCARSXUVLJ-FQEVSTJZSA-N	448.545	1.566	50	20	IDGD	
Cc1ccc(C(=O)NN=c2sc3ccccc3n2C)cc1S(=O)(=O)N1CCOCC1	855572420	VEXYYYHVARFFDW-UHFFFAOYSA-N	446.554	1.815	50	20	IDGD	
CS(=O)(=O)CC[C@H](Cc1cccc(Br)c1)C(=O)N1CC[C@@H](B(O)O)C1	864234881	XUGOGIJTAPQHMK-ZIAGYGMSSA-N	432.145	1.118	50	20	IDGD	
C[C@H]1CC(C)(C)C[C@]2(C1)NC(=O)N(CC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)C2=O	912764472	QHCIEWXWVNCWPW-YUNKPMOVSA-N	431.449	1.493	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N[C@H](CN2CCOCC2)c2ccccc2)cc1OC	914601285	RHRMFYDTAOZPIC-GOSISDBHSA-N	428.489	1.721	50	20	IDGD	
Cc1ccc(-c2nc(C(=O)OCC(=O)NNC(=O)[C@@H]3COc4ccccc4O3)cs2)o1	915255589	UBWDXAZBVJDBFS-INIZCTEOSA-N	443.437	1.856	50	20	IDGD	
CNS(=O)(=O)Cc1ccc(CNC(=O)NNC(=O)CSc2ccc(C)cc2)cc1	916228657	MOQQHNWCZIAIDS-UHFFFAOYSA-N	436.559	1.667	50	20	IDGD	
O=C(NCc1ccc(S(=O)(=O)N2CCOCC2)s1)NNc1cccc([N+](=O)[O-])c1	916233494	XXTKQOIUMVEXPS-UHFFFAOYSA-N	441.491	1.504	50	20	IDGD	
CC(=NNC(=O)CN1CCCC1=O)c1ccc(S(=O)(=O)NCc2ccc(F)cc2)cc1	916358057	ZSPJCCVCJRRQQX-UHFFFAOYSA-N	446.504	1.767	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCCC(=O)N1CCCCC1	916438005	UJTLXQHIMQFFQS-CYBMUJFWSA-N	441.326	1.949	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NC[C@H](c2ccsc2)N(C)C)c2ccccc2c1=O	916449316	BSNUIQZLJUBKMH-MRXNPFEDSA-N	428.518	1.725	50	20	IDGD	
CC[C@@H](NC(=O)NNC(=O)c1ccc(OC)c(OC)c1)c1ccccc1OCC(=O)NC	918222557	XRUPSWBOWHGWCY-MRXNPFEDSA-N	444.488	1.924	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1cnc2ncnn2c1C(C)C	919273562	TZFIBLSPKQOBPS-UHFFFAOYSA-N	446.851	1.528	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2ccc(N3CCNC3=O)c(C)c2)cc(OC)c1OC	919690189	MDWGMLJMGINLHB-UHFFFAOYSA-N	428.445	1.625	50	20	IDGD	
CC(=O)NCc1ccc(C(=O)NNC(=O)c2ccc(CSc3nncn3C)cc2)cc1	921155061	VOJBAVFCSWDFJH-UHFFFAOYSA-N	438.513	1.818	50	20	IDGD	
O=C(NNC(=O)[C@H]1CS[C@@H](Cc2ccccc2F)C(=O)N1)c1ccc2ccccc2n1	935742357	HMWCSKUYIMCRQZ-MOPGFXCFSA-N	438.484	1.978	50	20	IDGD	
Cc1nn([C@H]2CCS(=O)(=O)C2)c(Cl)c1C=NNC(=O)CCN1CCC(C)CC1	1317698376	OMENYSPLQXJBOP-HNNXBMFYSA-N	429.974	1.777	50	20	IDGD	
CNC(=O)Cc1ccc(NC(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1	1320114477	YWOXOVCZOIZZRD-UHFFFAOYSA-N	433.509	1.775	50	20	IDGD	
Cc1ncc(C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)c(C2CC2)n1	1321153469	BUBNKCNRPGCZOA-UHFFFAOYSA-N	442.951	1.895	50	20	IDGD	
CCNS(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)c2cncn2-c2ccccc2)c1	1321816281	DQJHHPDVTVQTON-UHFFFAOYSA-N	431.449	1.384	50	20	IDGD	
CCOC(=O)c1ncc(C(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)s1	1346481126	LSRPCBJBSSYPKQ-UHFFFAOYSA-N	426.495	1.728	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cn4ncccc4n3)C2)C1	1777954567	DLYHLPCQZYBHDW-SCLBCKFNSA-N	436.310	1.346	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](Br)CC)C2	1777982201	WUWMQQPDCJKTCH-KYZVSKTDSA-N	447.374	1.121	50	20	IDGD	
CC(C)n1cnc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](C)Br)C3)n1	1778280430	YRFWWUFCFYFQME-PMUMKWKESA-N	442.358	1.770	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2c[nH]c3ncccc23)C1	1778520974	JWHZQBHXXJPRGR-CBGDNZLLSA-N	434.924	1.944	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)/C=N/N3CCCCC3)C2)C1	1779013964	OQBYUDYJKLUTTH-KUDSMGGUSA-N	429.359	1.319	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(C1)CN(C(=O)C13CCC(CC1)CC3)CCO2	1779035013	ZSMXVYCNNPCDFV-KKOYGPPHSA-N	441.532	1.099	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)n2ccccc2=O)C1	1779530890	JPHNDTGNCIIMRS-ZGPJWRFFSA-N	439.940	1.177	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc[n+]([O-])cc2)C1	1779945128	LIIWRLIINGSTHH-AYOQOUSVSA-N	430.332	1.684	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)[C@@H](O)Cc3ccccc3)CCO2)C1	1781233056	PHRCZBXRZHPHMV-VDGAXYAQSA-N	429.344	1.656	50	20	IDGD	
CN(C)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781327786	AANJRFAXSALCGR-YOEHRIQHSA-N	429.290	1.282	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)NC(C)=O)C1	1781789909	VMKDPXKMCFCQQV-CTNYNGJSSA-N	432.359	1.198	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(=O)NCC(C)C)C2	1781900956	SXSYJWKUCBDHNY-SPYBWZPUSA-N	446.386	1.446	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@@]2(C1)CN(C(=O)c1cn[nH]c1)CCO2	1782866012	HECIJURKBCQPDG-JMDQKNPTSA-N	427.411	1.739	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)/C=N/O[C@@H]3CCCCO3)CCO2)C1	1783534417	UGSOMRAPAITVHG-NYBIFMDASA-N	432.315	1.129	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3c(F)ccc(OC)c3OC)CCO2)C1	1783881782	UEWLCYKTJTWVIL-RNODOKPDSA-N	444.887	1.540	50	20	IDGD	
O=Cc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCBr)[C@H]3C2)s1	1786406147	UNGXLCSBTQTJES-UBHSHLNASA-N	429.336	1.939	50	20	IDGD	
Cc1nc(N)sc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]2C1	1788763865	AUAFNDFYXRFYHG-IHRRRGAJSA-N	426.615	1.479	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccnc4c3OCO4)[C@H]2C1	1789182019	AQDWTOGMKUNAFG-IMIFBBOLSA-N	440.294	1.187	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(=O)nc4sccn34)C[C@@H]21	1789861690	IZUDPJOPVTXURV-ABHRYQDASA-N	438.937	1.367	50	20	IDGD	
CN1CCC(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]3C2)CC1	1789868299	WKNQQGBBVKXBDT-OGNFBWPZSA-N	434.408	1.934	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnnc(Cl)c3)C[C@@H]21	1789869235	ZJLXEHPGQJIMKZ-PYERRIOISA-N	435.739	1.960	50	20	IDGD	
Cc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Br)C[C@@H]32)ccc1O	1790070463	RKSMIOVCDNXWDN-DARAHFNDSA-N	429.286	1.984	50	20	IDGD	
C[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)c1ccccn1	1791715615	CITSUKAKZZQOKT-IICXDKKESA-N	428.302	1.855	50	20	IDGD	
Cc1ccc(C(=O)NCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C(C)(C)CCl)cc1	1792786207	AWPQPULRNSSOJC-IZZQQSIFSA-N	435.952	1.579	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(F)(F)c1ccco1)C2	1792872217	RDTZWMBWEQRYQR-NRWUCQMLSA-N	435.265	1.992	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CC(=O)Nc1cc(C)on1)C2	1793446641	GTWFNPYCADQUCZ-KYZVSKTDSA-N	426.901	1.309	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1cc(C)no1	1794150995	LALOEXXPOJHMKE-YDOXXCSQSA-N	426.477	1.298	50	20	IDGD	
CN(C)c1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCBr)C3)nc1	1794458588	MBXYASRYOLRNMA-FVCICTRLSA-N	425.327	1.136	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cocn1	1794939298	FFLWLKNRKCCJMY-PSKFDLRZSA-N	428.395	1.763	50	20	IDGD	
COc1ccc(-c2cc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@@H](O)CCl)C4)no2)cc1	1796498711	MSCSXZXTHIIKBB-CSHUHZATSA-N	449.891	1.153	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1occc1Br	1797010734	RJBRCVJIZJPUPH-CLLJXQQHSA-N	441.326	1.667	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](OC(C)=O)C(C)C	1797596962	WGMUPKMTVMDINE-JKJDWNRSSA-N	433.343	1.337	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)n1ccccc1=O	1797930798	BGUMUAOIFONUDC-LBKYZSNHSA-N	440.338	1.030	50	20	IDGD	
COc1nc(C)ccc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)Br)C2	1798248596	MWWKJMJJAPUQSO-XPCVCDNBSA-N	426.311	1.385	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(Cl)c2nncn2c1	1798381036	XCKJKCHYRDNFIY-QDMKHBRRSA-N	447.927	1.008	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ncon1	1799034568	AFBAKDCBWYQMHJ-CLLJXQQHSA-N	429.389	1.469	50	20	IDGD	
C[C@@H]1CCc2c(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@@](C)(Cl)CCl)n[nH]c21	1799275335	PQYGRVKMBRACRU-RFKGOXMFSA-N	429.348	1.899	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3cccnn3n1)C2	1799276750	KYIMSPMCXWAIQM-TYYYEBLRSA-N	426.304	1.169	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)Cc1ccccc1)C2	1799279792	UAYVVDUIUHJQAY-JZBZHOAESA-N	429.344	1.416	50	20	IDGD	
C[C@H](NNc1ccccc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Br	1799341941	AQSPDBMTGOVOOZ-IGNRKKQASA-N	443.317	1.272	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3ccccn3n1)C2)[C@H](F)Br	1799347511	OPSHBASRHWBLLU-JLUCKKNBSA-N	425.258	1.228	50	20	IDGD	
COc1cccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Br)c1C	1799352049	JLNUHOJNEUVBJM-NOXHYTERSA-N	429.286	1.897	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)C1CCC2(CC1)OCCO2	1800382834	QYFDHJYSUXIIJK-XGUBFFRZSA-N	449.317	1.200	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c(C)nc3sccn13)C2	1800976729	FTJGOWARAAXUIK-CRWXNKLISA-N	426.926	1.161	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1Cc2[nH]nc(C(F)(F)F)c2C1)[C@H](O)CCl	1801413533	GWEDAPUVJXLBTR-GRZGAGJTSA-N	434.846	1.381	50	20	IDGD	
CC[C@@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](C)NS(=O)(=O)CC)C2	1801798430	HLIOWXCXBRXOLS-RKQHYHRCSA-N	438.388	1.126	50	20	IDGD	
C=CCC(CC=C)C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1803081768	HJZHPZSUJCLHPL-FYYLOGMGSA-N	447.344	1.849	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccn3ccnc3c2)[C@H]1c1cccnc1)[C@@H](O)CCl	1803142941	OWJHTCGRVJFGRH-LNLFQRSKSA-N	427.892	1.649	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC2(CCCN(C(=O)[C@H](O)C(C)(C)C)C2)CC1	1805442354	JCUIDEDRRCTPHO-LEBHPONQSA-N	445.564	1.759	50	20	IDGD	
CS(=O)(=O)c1ccc(C(=O)N2CCCC3(CCN(C(=O)[C@@H](F)Cl)CC3)C2)nc1	1807679427	FUCKFQOBXHTWSL-OAHLLOKOSA-N	431.917	1.864	50	20	IDGD	
Cn1ccc(=O)cc1C(=O)N1CC[C@H](CNC(=O)CO[Si](C)(C)C)[C@H]1c1cccnc1	1810543630	DEPZKTLUOITZST-DYESRHJHSA-N	442.592	1.951	50	20	IDGD	
COc1ccnc(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)c1OC	1811647180	GIXSXPJLEHZYPG-RLFYNMQTSA-N	448.907	1.413	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)Cc2cccc(OC)n2)[C@H]1c1cccnc1	1813028484	QVIXLIQFMKSAFC-MDKPJZGXSA-N	446.935	1.988	50	20	IDGD	
CCS(=O)(=O)CC(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](F)Br)[nH]n1	1815174413	RZDUSKABIGGJHU-GWCFXTLKSA-N	439.307	1.527	50	20	IDGD	
CC(C)=CCCC(=O)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1	1815359964	GXWAXTNNCBIHOD-MRXNPFEDSA-N	427.335	1.795	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)Cn2cnnn2)n[nH]1	1817613558	RYBRGLAWZBYUEQ-ZYHUDNBSSA-N	425.291	1.120	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnc(O)nc2O)n[nH]1	1818022086	FTUUUSOHJZWQIB-GZMMTYOYSA-N	439.270	1.700	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2n[nH]c3c2CS(=O)(=O)C3)[nH]n1)[C@H](F)Cl	1818037478	KCZPGUWLFURKTB-FZMZJTMJSA-N	444.876	1.402	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ncccn2)[nH]n1	1818111390	INTASEUKGOJOAZ-PASSITCSSA-N	449.475	1.640	50	20	IDGD	
CCc1cc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)n(C)n1	1819835897	LOQTZCJDKKOZOT-INIZCTEOSA-N	444.540	1.385	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@H](C(=O)Nc2cc([C@@H]3CCCCN3C(=O)[C@@H](O)CCl)[nH]n2)C1	1822361440	QNZVWWYWHNQART-XRGAULLZSA-N	440.928	1.981	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(O)n2)[nH]n1	1822413422	VLJOFJQWIYKRRF-HNNXBMFYSA-N	429.481	1.189	50	20	IDGD	
C=CCNC(=O)/C=C\C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1	1822998446	DICRASAPZYDOJE-JHYAKEMISA-N	445.314	1.604	50	20	IDGD	
Cc1nnc(CC(=O)N[C@H]2CCc3nc(NC(=O)[C@H](F)Br)sc3C2)o1	1823002181	AOLBKWHUBFIFNU-MADCSZMMSA-N	432.275	1.680	50	20	IDGD	
Cc1ccc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)CCC(=O)NN(C)C)CC3)cc1O	1823209269	XDVSOCBPFCCBHD-AWEZNQCLSA-N	445.545	1.756	50	20	IDGD	
COCCCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1	1824060821	VMEMFHAXGLIJHA-LJQANCHMSA-N	431.537	1.345	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H](N)CCC(N)=O)CC1	1824093573	OIZJLSCKYABHPD-KBMXLJTQSA-N	445.402	1.230	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CN2C(=O)CNC2=O)CC1	1824609666	OAIOQVMRWIMDIR-JKSUJKDBSA-N	426.945	1.565	50	20	IDGD	
N#Cc1ccc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)cc1	1827056064	AGFNFEPYHQNUGC-QHCPKHFHSA-N	445.328	1.785	50	20	IDGD	
Cc1cc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)no1	1827056355	SUZCCCMEFNYGRK-HXUWFJFHSA-N	425.294	1.210	50	20	IDGD	
O=C([C@H](F)Br)N1CCC([C@H]2CCCCN2C(=O)c2c[nH]c(=O)cn2)CC1	1829717006	WBWOSVUIMISFPL-HIFRSBDPSA-N	429.290	1.694	50	20	IDGD	
O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)c1cc(C3CC3)on1)CCO2	1830196065	ZHWKPJGLNUIEMN-SFHVURJKSA-N	442.310	1.407	50	20	IDGD	
C/C(=C\c1ccc(C)o1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1830732086	UPSGWONONDFZSK-FZKUXKMZSA-N	426.897	1.047	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCN2CCOCC2)CC1	1831830274	OGGIAWZZVCDOFU-RTBURBONSA-N	429.989	1.582	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)COC(=O)C(F)(F)F)CC1	1831831461	ZEYWOHBNURACRG-UONOGXRCSA-N	442.862	1.965	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3ccc(F)nc3)CCO2)C1	1832837739	QNFJSIMLFUOIQO-OXJNMPFZSA-N	427.904	1.627	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)[C@H]2CCCOC2)CC1	1832867137	DUGZMCACRBJDQH-FPOVZHCZSA-N	428.338	1.026	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3cncc(OC)c3)CCO2)C1	1832916267	MMUNNOSRVGUCQG-NQIIRXRSSA-N	439.940	1.497	50	20	IDGD	
O=Cc1ccc(C(=O)N2CCC(N3CCC(NC(=O)[C@H](O)CCl)CC3)CC2)s1	1833310526	MALBNSVFAMRUIY-MRXNPFEDSA-N	427.954	1.346	50	20	IDGD	
COc1ccc(F)c(C(=O)N2CCC(N3CCC(NC(=O)[C@@H](O)CCl)CC3)CC2)c1	1833312778	DGPZMHIFLZFAFF-IBGZPJMESA-N	441.931	1.619	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3c[nH]c(C(C)(C)C)c3)CCO2)C1	1833382494	BFKXTCPELVYDKG-IIBYNOLFSA-N	441.956	1.636	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)CN3CCOC3=O)CC2)CC1	1833529620	DYXVFKOWYVKOCU-QGZVFWFLSA-N	428.961	1.418	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)[C@H](C)N(C)C(C)=O)CC2)CC1	1833533095	VSDCUUHKVQBDKK-KXBFYZLASA-N	429.005	1.832	50	20	IDGD	
COc1cccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@](C)(Cl)CCl)C3)C2)n1	1833769135	VVBSUJKGZYXJID-RTBURBONSA-N	446.331	1.397	50	20	IDGD	
Cn1nc(C(=O)NC2CCN(C3CCN(C(=O)CO[Si](C)(C)C)CC3)CC2)cc1O	1833945254	UBBRRRKQEUEMOZ-UHFFFAOYSA-N	437.617	1.162	50	20	IDGD	
COCCOCC(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)Br)CC2)CC1	1834566691	GVGUUWYDIXDYJC-CQSZACIVSA-N	434.375	1.004	50	20	IDGD	
N#Cc1ccc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCBr)CCO3)C2)cc1	1834823845	NAYZOSBSELZUCS-LJQANCHMSA-N	436.306	1.413	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)c1cccc2nc[nH]c12	1834988551	OUEGBIGUXMNJCU-GOSISDBHSA-N	433.940	1.348	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)c1ccc2c(c1)OCO2	1835280111	RUCNAQDAGRVOGW-QGZVFWFLSA-N	437.924	1.200	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)CC3CCOCC3)CCO2)C1	1835422707	ACRKSHZXKNGPRF-OALUTQOASA-N	437.364	1.496	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3n[nH]cc3[N+](=O)[O-])CC2)CC1	1835867044	HMHXZKMTLXLZSL-HNNXBMFYSA-N	440.932	1.911	50	20	IDGD	
CC[C@@H](Br)C(=O)NC1CCN(C2CCN(C(=O)[C@H]3CCCO3)CC2)CC1	1836541969	PIGNAPZKWHPRRL-IAGOWNOFSA-N	430.387	1.911	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccn4cncc4c3)CCO2)C1	1837074116	UPTPUNNICOIKTO-GHTZIAJQSA-N	434.924	1.812	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cc(C)nn3C)CC2)CC1	1837465162	GFEVSNNJUIIZRY-QGZVFWFLSA-N	426.945	1.595	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(F)nc3)CCO2)C1	1837851463	KMTLEOOUCMJWGS-RDTXWAMCSA-N	444.301	1.464	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccnc(Cl)n3)CCO2)C1	1837919886	SKUVBCJKGCEGMH-UGSOOPFHSA-N	431.320	1.608	50	20	IDGD	
CCn1nc(C(=O)N2CCO[C@]3(COCCN(C(=O)CCBr)C3)C2)cc1C	1838147770	JPRHGYBQPYIHCI-SFHVURJKSA-N	443.342	1.066	50	20	IDGD	
C[C@H]1CCC[C@H]1C(=O)N1CCC(OC2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1	1838298154	SXFQUGKPGZBGCA-FXAWDEMLSA-N	436.597	1.794	50	20	IDGD	
C[C@H](C(=O)N1CCC(OC2CCN(C(=O)[C@@](C)(Cl)CCl)CC2)CC1)n1cnnn1	1838637728	AWAJHYZQRTWDQG-ACJLOTCBSA-N	447.367	1.469	50	20	IDGD	
CC(C)c1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)n[nH]1	1838698698	UXLCZHVJIFRYET-YOEHRIQHSA-N	447.305	1.294	50	20	IDGD	
Cc1ccc(O)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)c1	1838893818	RKJLDKHPCCCTGA-QAPCUYQASA-N	445.285	1.461	50	20	IDGD	
O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(F)cc1F)CCO2	1839004823	IVZBDTHCWIYYMV-GOSISDBHSA-N	447.276	1.820	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnn4cccc(F)c34)C2)C1	1839148078	LOYVMMSOBRVYPK-QRWLVFNGSA-N	438.887	1.561	50	20	IDGD	
O=C(c1ccc(O)cc1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839201777	JCHVIULFKRGFTC-YOEHRIQHSA-N	431.258	1.153	50	20	IDGD	
O=C(/C=C/C1CCCC1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839202016	QQBBAMACIFCUMG-OZZQIWQLSA-N	433.318	1.880	50	20	IDGD	
Cc1cccnc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2	1840030528	OMVMSUFEGPCGGB-RDTXWAMCSA-N	426.311	1.243	50	20	IDGD	
C=CCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)C1	1840171984	KORDEJXQPKREEU-MGPUTAFESA-N	445.944	1.151	50	20	IDGD	
COc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)ccc1O	1840189204	CPLQVAONWPEGRX-SFHVURJKSA-N	433.288	1.275	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)/C=C/c3cnc[nH]3)CCO2)C1	1840343787	ZVOXWODWOUCIMU-RFLFSSTKSA-N	431.320	1.116	50	20	IDGD	
COc1ccc(C(=O)N2CC3(CCCN3C(=O)[C@H](O)CCl)C2)nc1Br	1841352157	YXMOUICNJWMIOF-LLVKDONJSA-N	432.702	1.269	50	20	IDGD	
C=CC[C@H](CC(=O)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1)NC(=O)OC(C)(C)C	1841354822	YYWVXEXLNMLBLZ-CABCVRRESA-N	429.945	1.649	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)CN2CCC(C)CC2)C1	1841501389	BWTCOCQGQZORCW-JJIBRWJFSA-N	428.537	1.056	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@@H](O)CC(=O)N1CC2(CCCN2C(=O)CCBr)C1	1842638732	BRIXPQQHDGCMPO-ZDUSSCGKSA-N	448.358	1.251	50	20	IDGD	
C[C@H](Br)C(=O)N1CC2(CCCN2C(=O)c2ccc3c(c2)n(C)c(=O)n3C)C1	1843735042	RRSYBCXVZBZMCE-LBPRGKRZSA-N	435.322	1.477	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)Cc1cncnc1)C2	1844692179	QMGFGDQPFRBVSJ-UHFFFAOYSA-N	439.428	1.370	50	20	IDGD	
CN(CC(=O)N1CCCC12CN(C(=O)C(Cl)Cl)C2)NC(=O)NCc1ccccc1	1845039361	IIZWSFBQBMMASQ-UHFFFAOYSA-N	442.347	1.340	50	20	IDGD	
Cc1occ(C(F)(F)F)c1C(=O)N1CC2(CCCN2C(=O)CCC(=O)NN(C)C)C1	1846384889	VXGSXKLLHCRUKY-UHFFFAOYSA-N	430.427	1.797	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@]2(O)CCN(C(=O)OC(C)(C)C)C2)C1	1846412025	JVKGFRPEMOKPOR-VBKZILBWSA-N	429.945	1.579	50	20	IDGD	
Cc1cccc(NS(=O)(=O)c2ccc(C)c(C(=O)NNC(=O)C(=O)NC3CC3)c2)c1	9889990	GMNIYKQGKQVHTR-UHFFFAOYSA-N	430.486	1.144	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(OCC(=O)NNC(=O)CC(C)C)c([N+](=O)[O-])c1	10160226	APVKVRZVGJUFTB-UHFFFAOYSA-N	430.483	1.198	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)c2occc2CS(=O)(=O)c2ccccc2)cc1	26694789	FFMRHBHGRJNNIQ-UHFFFAOYSA-N	439.449	1.965	50	20	IDGD	
Cc1cc2c(c(C)c1Cl)C(=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O)CCO2	727777439	ONIFSERRIHLSPM-UHFFFAOYSA-N	437.909	1.144	50	20	IDGD	
CN(C)N(C(=O)CN1C(=O)NC2(CCC(C(C)(C)C)CC2)C1=O)[C@@H]1CCS(=O)(=O)C1	728180385	ZQORDMFPYDKKKD-RDYUPDBUSA-N	442.582	1.006	50	20	IDGD	
C[C@]1(c2ccccc2)NC(=O)N(CC(=O)NNC(=O)c2cccc(OC(F)F)c2)C1=O	728489146	ZDWKWDITQLQELL-HXUWFJFHSA-N	432.383	1.516	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(N2CCCCC2)c(C(=O)NNC(=O)Cc2cccnc2)c1	728852743	SMZPOLYITHQFLQ-UHFFFAOYSA-N	445.545	1.326	50	20	IDGD	
COc1ccc([C@@H](CNC(=O)NNC(=O)Cc2cccnc2)N2CCOCC2)cc1OC	728944496	ZXLVMFSFMFAZKS-GOSISDBHSA-N	443.504	1.045	50	20	IDGD	
C[C@@H]1C[C@@H](C)CN(C(C)(C)CNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)C1	728949874	WMSRWXFSRNLXFO-IAGOWNOFSA-N	431.585	1.780	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)NC1CCN(CC2CCCC2)CC1	728952272	SXFOIOILUBMIIO-UHFFFAOYSA-N	429.569	1.678	50	20	IDGD	
CCN1CCC[C@@H]1CN1C[C@@H](C(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)CC1=O	729626370	CZLGNFNYPAZTHA-CEXWTWQISA-N	430.549	1.551	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCOc2ccc(F)c(F)c2)c1	730129026	OPRLGLYDOYDOJV-UHFFFAOYSA-N	442.444	1.238	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NNC(=O)COc2ccccc2O)cc1	730782210	IVSXFXZWQGCRER-INIZCTEOSA-N	433.486	1.080	50	20	IDGD	
CC(C)NC(=O)C(=O)NNC(=O)c1cnn(-c2ncccc2Cl)c1C(F)(F)Cl	730999206	OZCSMDWVBVCAOH-UHFFFAOYSA-N	435.218	1.494	50	20	IDGD	
O=C(Cc1ccc(S(=O)(=O)N2CCCC2)s1)NNC(=O)Cc1ccccc1F	731329381	JJHWSTKYXHNZJR-UHFFFAOYSA-N	425.507	1.604	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)NCCNC(=O)c1ccc(Br)cc1	731403552	OOHNUCKPCGRGNF-UHFFFAOYSA-N	437.269	1.891	50	20	IDGD	
CC(=NNC(=O)c1ccnc(N(C)C)c1)c1ccc(OCC(=O)N2CCOCC2)cc1	731562030	JDJMMLSZZLRRGS-UHFFFAOYSA-N	425.489	1.539	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)N1CCN(CC(=O)Nc2ccc(OC(F)(F)F)cc2)CC1	731848476	FVNZHXBWGWKDOS-CYBMUJFWSA-N	445.442	1.087	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)Sc1nc2cc(S(=O)(=O)N(C)C)ccc2o1	731904367	JDPOWBMOQFXWMI-LLVKDONJSA-N	428.536	1.752	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)N1CCC(C(=O)c2ccc3c(c2)NC(=O)[C@H](C)O3)CC1	732199015	DIPAMEQVMGVDBX-CABCVRRESA-N	444.532	1.883	50	20	IDGD	
CN(CC(=O)NNc1ccccc1S(C)(=O)=O)C(=O)c1ccc(Br)o1	732301608	FLSNCIZUAFCNFJ-UHFFFAOYSA-N	430.280	1.661	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)[C@H](Cc1ccccc1)NC(=O)c1cccnc1	732303932	OOTMOQLHLQQJRH-IBGZPJMESA-N	438.509	1.970	50	20	IDGD	
NC(=O)c1ccccc1N1CC[C@@H](NC(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)C1	732576163	QKLCRQFXDVNEIA-OQLYILNASA-N	425.533	1.911	50	20	IDGD	
CCOc1cccc(N2CCN(C(=O)NNC(=O)c3cnn(-c4ccccc4)c3)CC2)n1	733350778	AKTQRXBCZVLJRU-UHFFFAOYSA-N	435.488	1.843	50	20	IDGD	
Cc1c(C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)nnn1-c1cccc(Cl)c1	734239861	XSQLZYMPPMPQAM-UHFFFAOYSA-N	437.888	1.698	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)[C@@H]1CCCC[C@@H]1C(=O)N1CCCC1	734241592	RIXBEQUMMKGIRA-CABCVRRESA-N	425.530	1.270	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(OC)c(C(=O)NNC(=O)COCc2ccccc2)c1	737637152	PAXSPRKCPKYSHH-UHFFFAOYSA-N	449.529	1.704	50	20	IDGD	
Cc1cc(C#N)ccc1S(=O)(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	740811957	KMQNNOXWBUGIPU-UHFFFAOYSA-N	437.522	1.759	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)N[C@@H](C)[C@H]2CN(Cc3ccccc3)CCO2)c1	741277691	CPAGXCRWNYCIJU-HRAATJIYSA-N	442.516	1.937	50	20	IDGD	
COc1ccnc(NNC(=O)[C@@H](Cc2c[nH]c3ccc(Br)cc23)NC(C)=O)n1	742043843	BBAFHLQGOSUNOD-OAHLLOKOSA-N	447.293	1.920	50	20	IDGD	
C[C@H](CN1CCN(c2ccccc2)CC1)NC(=O)NNC(=O)c1cc(Br)c[nH]1	743507940	GZEQOJIAQGYSFP-CQSZACIVSA-N	449.353	1.932	50	20	IDGD	
CN(C[C@H]1CCCN1C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)C(=O)OC(C)(C)C	743512546	WDBPEJVPMYPTCU-MRXNPFEDSA-N	444.496	1.348	50	20	IDGD	
O=C(NCCC(=O)N1CCOCC1)NNC(=O)Nc1ccc(Br)cc1Cl	743546533	NTIWQTJHDQBNGB-UHFFFAOYSA-N	448.705	1.687	50	20	IDGD	
O=C(CN1C(=O)NC2(CCCCC2)C1=O)NNC(=O)c1cc(Br)ccc1O	743730472	ZHOIALFKVYNWNC-UHFFFAOYSA-N	439.266	1.170	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)C2(c3ccc(F)cc3)CCOCC2)c1	744859709	VOZXQDKGEUPGNE-UHFFFAOYSA-N	425.416	1.750	50	20	IDGD	
NC(=O)[C@H]1CCCN(CCCNC(=O)NNC(=O)c2cc(F)ccc2Br)C1	745828873	ABGJKXDLYUNWKU-NSHDSACASA-N	444.305	1.120	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)N[C@@H]2CC(=O)N(CCOc3ccccc3)C2)cc1	745848981	ZEGYWROIMRKXOV-MRXNPFEDSA-N	442.472	1.084	50	20	IDGD	
C[C@H](NC(=O)OC(C)(C)C)C(Cc1ccccc1)=NNC(=O)N[C@H]1CCS(=O)(=O)C1	746563993	FPNZWURYYUSVNI-HOCLYGCPSA-N	438.550	1.985	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)NC[C@H]3CCCO3)c2)cc1	747214620	LRGCISOSRVSFJK-QGZVFWFLSA-N	428.470	1.090	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)[C@@H]1CCCN1C(=O)c1ccc(Br)cc1	747324066	YIPMBQKOTFWWHN-INIZCTEOSA-N	431.290	1.839	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)Cc2ccncc2)cc1S(=O)(=O)NCc1ccccc1	747428868	YRKKLULBUSDBKG-UHFFFAOYSA-N	438.509	1.872	50	20	IDGD	
COCCn1cc(S(=O)(=O)NNC(=O)c2ccc(Br)cc2Cl)cn1	747791204	SOCNDRKQWCWECX-UHFFFAOYSA-N	437.703	1.569	50	20	IDGD	
CCn1c(O)nc2cc(C(=O)NNc3nc(Br)cn4ccnc34)ccc2c1=O	750247911	VRMNPCVPWOFQFT-UHFFFAOYSA-N	444.249	1.684	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)N[C@H]1CCN(CCCc2ccccc2)C1=O	750659391	GCNLHGRYLRHGLQ-IBGZPJMESA-N	428.464	1.769	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)[C@@H]2CCc3nnc(C)n3C2)cc(OCC)c1OCC	750715210	QQXFVXXSMUPPCM-CQSZACIVSA-N	431.493	1.806	50	20	IDGD	
O=C(Cc1csc(N2CCOCC2)n1)NNC(=S)NC12CC3CC(CC(C3)C1)C2	750974456	OUMCGJISNQJUOD-UHFFFAOYSA-N	435.619	1.986	50	20	IDGD	
O=C(COC(=O)[C@H]1CC(=O)N(c2cn[nH]c2)C1)NN=C(c1ccccc1)c1ccccc1	751679852	RWQRSOFHEDRDPD-SFHVURJKSA-N	431.452	1.875	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NC2CN(C(=O)OC(C)(C)C)C2)nc1	751804871	QZWJJEBFLNIGJS-UHFFFAOYSA-N	428.515	1.014	50	20	IDGD	
COC(=O)COc1c(C)cc(C(=O)OCC(=O)NNC(=O)c2cccc(C)c2)cc1C	752569882	YHJASDDVGPXTJF-UHFFFAOYSA-N	428.441	1.782	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)N[C@H]2CCN(Cc3ccc(C#N)cc3)C2=O)c1	753722821	LMBXMUUAQDUSAC-FQEVSTJZSA-N	435.484	1.685	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)N[C@H](C)CO[C@H]2CCOC2)c2ccccc2c1=O	753948793	RMGGGTXHYACPGD-CABCVRRESA-N	431.493	1.335	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(NC(=O)COC(=O)/C(C#N)=C\c2ccc(O)cc2)c1	754539372	YCIUMRQXUYOECX-GDNBJRDFSA-N	429.454	1.731	50	20	IDGD	
CCOc1ccc(NC(=O)NNC(=O)c2ccccn2)cc1S(=O)(=O)N(CC)CC	755452300	YYFLDEHXJRKCEG-UHFFFAOYSA-N	435.506	1.977	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)c2cccc(-n3ccnn3)c2)CC1	755902949	KVAJMOZOXVLOPZ-UHFFFAOYSA-N	429.481	1.611	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2cccnc2OC(C)C)cc1	755947958	UVIOKSWVILEGKF-UHFFFAOYSA-N	435.506	1.651	50	20	IDGD	
COC(=O)CCSCc1cccc(NC(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)c1	756393601	OMMFAVKKPPYNCQ-CYBMUJFWSA-N	429.520	1.070	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)CNC(=O)c2ccccc2C(F)(F)F)cc1	756724402	FHICKLACCJUJEY-UHFFFAOYSA-N	437.374	1.748	50	20	IDGD	
CCOc1cc(C(=O)N(C)C)ccc1NC(=O)NNC(=O)c1cncc(NC(C)=O)c1	756871338	KLEIMALGCFQCTC-UHFFFAOYSA-N	428.449	1.607	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2nc(CCC(=O)OC)cs2)c2ccccc2c1=O	757733636	DCASKGIRCVCSTN-UHFFFAOYSA-N	444.473	1.445	50	20	IDGD	
COCCCS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1	757822195	GMUBKDWKOCWWHD-UHFFFAOYSA-N	436.446	1.872	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@@H](C)n2nnnc2C(C)(C)C)cc1Br	758147393	XHPIUHAXBYZIFI-SECBINFHSA-N	425.287	1.764	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)Nc2nccs2)cc1)c1cccn2c(O)nnc12	758311264	XWCBGVNFRUWXMW-UHFFFAOYSA-N	431.459	1.449	50	20	IDGD	
O=C(NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)NNC(=O)c1ccc2ccccc2n1	758692658	BYLMMEZFTCWWTE-UHFFFAOYSA-N	443.441	1.561	50	20	IDGD	
C[C@H]1CN(c2ccc(CNC(=O)NNC(=O)C(=O)Nc3ccccn3)cc2F)C[C@@H](C)O1	758704074	WHFBUXMJXSUMQR-OKILXGFUSA-N	444.467	1.303	50	20	IDGD	
CCS(=O)(=O)N1CCC(CNC(=O)NNC(=O)c2ccc(Cl)cc2Cl)CC1	758742675	JWMPUMBNZGUQGG-UHFFFAOYSA-N	437.349	1.999	50	20	IDGD	
CN(NC(=O)c1cc2c(cc1F)NC(=O)CC2)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758782620	UDKWISGMXIGVHS-UHFFFAOYSA-N	449.483	1.960	50	20	IDGD	
COc1cc(F)cc(NNC(=O)c2ccc3c(c2)S(=O)(=O)N(C[C@H]2CCCO2)C3=O)c1	759310544	ABTJYEPDQMBAML-OAHLLOKOSA-N	449.460	1.915	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)[C@H]2CC(=O)N(CCc3ccc(OC)c(OC)c3)C2)nc1	759725399	ODWADBPEXWFVEY-INIZCTEOSA-N	442.472	1.420	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)N[C@@H]2CCOC[C@@H]2OCC)c2ccccc2c1=O	760127398	PHIRYZFCSHYHMA-SJORKVTESA-N	431.493	1.335	50	20	IDGD	
COC[C@@H](C)n1c(C)cc(/C=C(\C#N)C(=O)NCCNS(=O)(=O)NC(C)C)c1C	760639119	DFGFBYPDUOVZAX-BFERYNQYSA-N	425.555	1.168	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2ccc(F)c(Cl)c2F)CC1	761071464	FSZWHDCTXUFASA-UHFFFAOYSA-N	445.879	1.706	50	20	IDGD	
Cc1cc(C)n(-c2ccccc2CNC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)n1	761780008	XQMULWJLEUFBES-UHFFFAOYSA-N	445.483	1.880	50	20	IDGD	
CC[C@H](NC(=O)NNc1ccc(-n2cccn2)nn1)[C@H]1CN(Cc2ccccc2)CCO1	761795863	XLPDSQUOWWDUJW-RBUKOAKNSA-N	436.520	1.968	50	20	IDGD	
CCN(CC(=O)NNC(=O)c1ccccc1Cl)CC(=O)Nc1ccc2c(c1)OCCO2	762222811	MYRRTPJEMDRKCL-UHFFFAOYSA-N	446.891	1.833	50	20	IDGD	
O=C(NNC(=O)c1ccncc1)C(=O)Nc1cnn(-c2ccccc2Br)c1	763463970	IYCSUIZUAPVEAA-UHFFFAOYSA-N	429.234	1.430	50	20	IDGD	
Cc1cc(C2=S=c3ccc(F)cc3=N2)ccc1NC(=O)C(=O)NNC(=O)c1ccncc1	763466736	NLKRJDXBVSZFGE-UHFFFAOYSA-N	449.467	1.724	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cnc(Br)c(C)c2)cc1OC	763550357	DQDNFLAMECATHX-UHFFFAOYSA-N	437.250	1.569	50	20	IDGD	
CCCCOC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2c(C)nc3ccccn23)cc1	763624168	KHPFJIGLUBENGQ-UHFFFAOYSA-N	437.456	1.999	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(O[C@@H]2CCOC2)cc1	763657521	OGBBKNOHCXSOSN-MRXNPFEDSA-N	429.429	1.028	50	20	IDGD	
CN(C)C(=O)COc1ccc(NC(=O)C(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)cc1	763723430	NWBOPOKSAIJVAJ-UHFFFAOYSA-N	442.516	1.456	50	20	IDGD	
COc1cc(F)c(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)cc1OC	763746237	RBVALIIQDOCMGT-UHFFFAOYSA-N	430.436	1.382	50	20	IDGD	
COC(=O)c1cc(OC)c(OC)cc1NC(=O)C(=O)NNC(=O)c1cc2c(s1)CCC2	763784092	USZRKSIHGTZSLO-UHFFFAOYSA-N	447.469	1.440	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)C(=O)Nc2cc(F)ccc2F)c2ccccc2c1=O	763801089	DZOPZDGNKZSOFZ-UHFFFAOYSA-N	443.410	1.875	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)C(=O)Nc1cccc(N2CCCCC2)c1	763803964	IRMLAOCBTDCKQL-UHFFFAOYSA-N	441.444	1.750	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(-n3ccnc3C)nc2)c1C	763839276	CXVRUTGVJJLTFS-HNNXBMFYSA-N	436.472	1.746	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccc(-n2cncn2)c(F)c1	763872720	OKTAMYQBPFJIAA-NSHDSACASA-N	430.371	1.099	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cnc(N(C)C)nc2)cc1OC	763912067	MVACZGWZKDTZJB-UHFFFAOYSA-N	430.465	1.130	50	20	IDGD	
NC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCCCC3)cc1	763968399	OREXMLFPZMMMAX-UHFFFAOYSA-N	430.486	1.281	50	20	IDGD	
COc1cccc(-c2nsc(NC(=O)C(=O)NNC(=O)c3ccc(Cl)cc3O)n2)c1	764126582	MQDZDGRTAFNMGO-UHFFFAOYSA-N	447.860	1.972	50	20	IDGD	
CN(C)C(=O)c1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)c1ccc(Cl)cc1O	764127362	VAZHAHJORBBVBO-UHFFFAOYSA-N	439.255	1.801	50	20	IDGD	
CCOC(=O)c1cnn(-c2cccc(NC(=O)C(=O)NNC(=O)c3ccoc3)c2)c1C	764162415	BIOPVNPIZUOKID-UHFFFAOYSA-N	425.401	1.350	50	20	IDGD	
CN(Cc1cccc(NC(=O)C(=O)NNC(=O)Cc2ccccn2)c1)C(=O)OC(C)(C)C	764263975	LBXHUOBYRFHGHB-UHFFFAOYSA-N	441.488	1.777	50	20	IDGD	
CCOC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)C(C)(C)c2ccccc2)cc1	764308316	ANCRSSKYONRREQ-UHFFFAOYSA-N	427.457	1.692	50	20	IDGD	
CN1CCN(Cc2cccc(NC(=O)C(=O)NNC(=O)CCCc3cccs3)c2)CC1	764342458	YUUUVNSIRXMXKQ-UHFFFAOYSA-N	443.573	1.604	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)C(=O)Nc2ccc(OCc3ccccn3)c(Cl)c2)cn1	764357781	AGHQPVRILWIJQO-UHFFFAOYSA-N	428.836	1.447	50	20	IDGD	
COC(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)cc1	764378257	XFQRVRNURGTTAV-UHFFFAOYSA-N	427.442	1.253	50	20	IDGD	
CC(=NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1)c1ccc([S@@](C)=O)cc1	764827861	KMDGGMIRCHHQJD-SSEXGKCCSA-N	426.542	1.722	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNS(=O)(=O)c3cc(F)ccc3F)CC2)cc1	765124194	AABTZSNYMMWKLU-UHFFFAOYSA-N	438.500	1.401	50	20	IDGD	
Cc1ccc(CN2C[C@@H](C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)CC2=O)cc1	765312907	HAJAFFPNTSQELE-KRWDZBQOSA-N	432.521	1.796	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1)c1ccc(CN2C(=O)CNC2=O)cc1	765606925	IZLPYMQEPFDUQA-UHFFFAOYSA-N	436.403	1.342	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NCC(=O)NNc1nc(-c2ccccn2)nc2c1CCC2	767149903	CHBAVOYKQITAMU-UHFFFAOYSA-N	441.492	1.111	50	20	IDGD	
O=C(CCC(=O)c1ccc2c(c1)CCC(=O)N2)NNC(=O)c1nnc(O)c2ccccc12	767250390	UWTDKOJLCUZFED-UHFFFAOYSA-N	433.424	1.644	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)COc2ccc3c(c2)CCCC3)cc1OC	767529739	UNISOHIYBKSWNE-UHFFFAOYSA-N	442.468	1.966	50	20	IDGD	
COCCOCCS(=O)(=O)NC(=O)/C(C#N)=C/c1cc(C)n(C[C@@H]2CCCO2)c1C	768220442	RAYSFMSRQQUWMY-GQEMFKIVSA-N	439.534	1.300	50	20	IDGD	
CCCCCCn1cc(S(=O)(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c(O)nc1=O	769620786	PWPZNGPOUQPVNF-UHFFFAOYSA-N	439.450	1.061	50	20	IDGD	
COc1ccc([C@@H](CNC(=O)NNc2nc(O)c3cnn(C)c3n2)N2CCCC2)cc1	769819650	UIILZPUQDJCTGP-MRXNPFEDSA-N	426.481	1.541	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)CNC(=O)c3c(F)cccc3Cl)nc21	771010222	UKUIPKYJYIDOQV-UHFFFAOYSA-N	435.847	1.953	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N[C@@H]1CCO[C@@]2(CCOC2)C1	771444143	NGSKCSPXDQHRIT-WRSAYESZSA-N	442.310	1.885	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)C(=O)Nc1cc(OC)ccc1OC	771884230	LEDQCVRYEHVHBX-UHFFFAOYSA-N	425.445	1.402	50	20	IDGD	
CC1(C)CCC[C@@H]1C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	771913242	KUYUYVKPJIKFJM-GOSISDBHSA-N	437.562	1.614	50	20	IDGD	
Cc1ccc(C)c(S(=O)(=O)NCCC(=O)O[C@H](C)C(=O)NNC(=O)CC(C)C)c1	771944393	WEBZRUAWKPXIKU-OAHLLOKOSA-N	427.523	1.097	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)[C@H]1CC(=O)N(c2cccc(Br)c2)C1	771984174	FKCIXUUJAWUSOV-MNOVXSKESA-N	426.267	1.291	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)c1ccc(N2CCCS2(=O)=O)cc1Cl	772138702	GBFKLDVVHQETNF-GFCCVEGCSA-N	445.925	1.619	50	20	IDGD	
Cc1nn(C)c2sc(C(=O)N[C@H](C)C(=O)O[C@H](C)C(=O)NNC(=O)CC(C)C)cc12	772152194	AGKQDWBCLYLDEL-VXGBXAGGSA-N	437.522	1.187	50	20	IDGD	
O=C(COC(=O)c1ccc(F)c(Cl)c1F)NNC(=O)[C@H]1COc2ccccc2O1	773561473	LAYBRICMCBMQNW-CYBMUJFWSA-N	426.759	1.762	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2ccc(C)c(I)c2)n1	773725994	FICCKCBZYZMUOX-UHFFFAOYSA-N	427.202	1.480	50	20	IDGD	
C[C@H](NCC(=O)NNC(=O)c1ccccc1Cl)c1cccc(S(=O)(=O)N(C)C)c1	775338442	MQNYOCVFVTZTKQ-ZDUSSCGKSA-N	438.937	1.702	50	20	IDGD	
CN(NC(=O)COc1ccccc1[N+](=O)[O-])C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776210940	CJASZRKDAUECTJ-UHFFFAOYSA-N	437.453	1.609	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)[C@@H]2CCCN(S(=O)(=O)c3ccccc3)C2)c1	776538561	IRSMFOAYZGFXIL-OAHLLOKOSA-N	437.543	1.634	50	20	IDGD	
CCc1cc(C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)cc(O)n1	778378571	DIGIWGLCSCQPCJ-UHFFFAOYSA-N	431.924	1.582	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)CN2C(=O)NC3(C[C@@H](C)C[C@H](C)C3)C2=O)nc1C	778425289	ONBUJFKVQPUNMJ-RYUDHWBXSA-N	432.481	1.152	50	20	IDGD	
COCCN(CCOC)S(=O)(=O)c1ccc(C(=O)NNc2cc(Cl)ccn2)cc1	778447111	CIFUSQYDKTUPHE-UHFFFAOYSA-N	442.925	1.775	50	20	IDGD	
CCN(CC)c1ccc(S(=O)(=O)N2CCOCC2)cc1NC(=O)NN=c1cc[nH]cc1	782007109	VOMPRNHXKLSPSS-UHFFFAOYSA-N	448.549	1.519	50	20	IDGD	
CC[C@H](C)NS(=O)(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(O)cc2)c1	782834385	UKDAPEPUCYUVMR-ZDUSSCGKSA-N	448.501	1.010	50	20	IDGD	
CC(=O)Nc1ccc(Cl)c(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)c1	782885694	GVAXVDYRGSDEJL-UHFFFAOYSA-N	442.863	1.514	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)C(=O)Nc1ccccc1C(C)(C)C	782896447	IMLHMRDCVNLEOJ-UHFFFAOYSA-N	445.545	1.985	50	20	IDGD	
Cc1cc(C)cc(NNC(=O)C(=O)Nc2cccc(S(=O)(=O)N3CCOCC3)c2)c1	783356544	KMMWHPIBIVNQRY-UHFFFAOYSA-N	432.502	1.406	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2ccccc2CN2CCc3ccccc32)CCS(=O)(=O)C1	783426520	MLIGDYYUZNDCHM-QFIPXVFZSA-N	442.541	1.386	50	20	IDGD	
Cc1c([N+](=O)[O-])cn(CC(=O)NNC(=O)c2ccccc2Cl)c(=O)c1Br	783928292	OTPKGNXYPMGYKX-UHFFFAOYSA-N	443.641	1.942	50	20	IDGD	
CS(=O)(=O)c1c(F)cc(NC(=O)C(=O)NNc2ccc(Br)nc2)cc1F	784807234	WYEGXPPUUCXKOW-UHFFFAOYSA-N	449.233	1.608	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)F)cc1)C(=O)Nc1cccc(-n2ccnc2)c1	784835799	WZKNIVCYIDOBKS-UHFFFAOYSA-N	435.412	1.950	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2cccnn2)cc1S(=O)(=O)N1CCCCCC1	784862284	BACXMJXOYFKEJH-UHFFFAOYSA-N	432.506	1.432	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2cccc(CN3C(=O)CNC3=O)c2)cc1Cl	785118356	RKGDONUBRJUGCX-UHFFFAOYSA-N	431.836	1.482	50	20	IDGD	
Cc1cc2ccccc2nc1NNC(=O)C(=O)Nc1ccc(C[C@@H]2CC(=O)NC2=O)cc1	785165029	NKSXKCSSWLLPFI-MRXNPFEDSA-N	431.452	1.830	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@@H]1[C@H]2CC[C@@H](O2)[C@@H]1C(F)(F)F	785443936	MJQSJECYBCEZRP-KKOKHZNYSA-N	434.440	1.405	50	20	IDGD	
C[C@H]1[C@H](C(=O)NNC(=O)c2csc(N3CCOCC3)n2)CCN1C(=O)OC(C)(C)C	786258016	XMDLKNNZSHLKFH-QWHCGFSZSA-N	439.538	1.386	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2ccccc2-c2nnc(C)o2)cc1OC	786383268	JUBSULFRLZBESR-UHFFFAOYSA-N	440.412	1.680	50	20	IDGD	
Cc1c(Br)ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)c1F	789731650	HNINJZFNIUCFTN-UHFFFAOYSA-N	449.236	1.933	50	20	IDGD	
Cc1cc2n[nH]cc2cc1NC(=O)C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	792263813	BUVMOROCZNMZPL-UHFFFAOYSA-N	449.515	1.170	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)c2sc(S(N)(=O)=O)c(C)c2Cl)cc1	792803971	YCWJFQLKEQBCER-UHFFFAOYSA-N	431.923	1.760	50	20	IDGD	
COC(=O)c1cc(F)cc(NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)c1F	797007708	QRNDWEUDUBGOOG-UHFFFAOYSA-N	427.747	1.510	50	20	IDGD	
COC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1C	798042714	ZXBLLLMCVLPKMH-MRXNPFEDSA-N	428.401	1.099	50	20	IDGD	
C=C(C)[C@@H]1OCC[C@H]1CNC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	798116046	BHHIMXRBRQWSEA-WMZOPIPTSA-N	436.534	1.396	50	20	IDGD	
CCOc1cc(C(=O)NNS(=O)(=O)c2c(N)noc2C)cc(OCC)c1OCC	798247101	OTTYTWPORIVMRC-UHFFFAOYSA-N	428.467	1.385	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)[C@H]3CCCC(=O)N3)c2)c(C)c1	799518406	JVMCXPGINCIOQQ-GOSISDBHSA-N	444.513	1.534	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)c1cc(N)cc(I)c1	803851563	NLHFYIPGVLKIKZ-VIFPVBQESA-N	433.246	1.612	50	20	IDGD	
COc1cc(S(=O)(=O)N2CCOCC2)cc(C(=O)NNc2ncccc2F)c1OC	804214067	RXXDKYPOIIMWBV-UHFFFAOYSA-N	440.453	1.016	50	20	IDGD	
C[C@@H]1C[C@@H](N2CCOCC2)CN1C(=O)CCC(=O)C(C#N)=C1N(C)c2ccccc2N1C	804440054	RDVXNGKIWLBXAI-QZTJIDSGSA-N	437.544	1.979	50	20	IDGD	
Cn1cncc1CC(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2Cl)c1	806337223	AMSHJGFEXZWBEK-UHFFFAOYSA-N	447.904	1.878	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(C(=O)NC)c2Br)cc1	806974656	QONQSBLMOWZFFG-UHFFFAOYSA-N	447.289	1.771	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)C(=O)Nc1ccc(F)cc1OC1CCOCC1	806978451	BZVIXYURHGVEPN-UHFFFAOYSA-N	445.447	1.808	50	20	IDGD	
COC(=O)N1CCC(CNC(=O)NNC(=O)c2cc(OC)ccc2Br)CC1	807525816	TYJBFLUCULPFIZ-UHFFFAOYSA-N	443.298	1.880	50	20	IDGD	
CCc1nnc(NC(=O)[C@H](C)[C@H](C)NC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)s1	807566617	YQHQOGLYTUXOLF-ZJUUUORDSA-N	435.466	1.616	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)Nc1ccc2c(c1)C(=O)N(CC1CC1)C2=O	808830675	JKWJYYQVKLGXDE-UHFFFAOYSA-N	446.423	1.808	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2CC)cc1OC	810385987	ICYMTEWQNXBARP-UHFFFAOYSA-N	430.417	1.964	50	20	IDGD	
COc1ccc(C(C)=NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1O	811629533	VJQPMSUSXFVQSQ-UHFFFAOYSA-N	433.486	1.576	50	20	IDGD	
COC(=O)c1cn(-c2cccc(NC(=O)NNC(=O)c3cc(Cl)ccc3O)c2)nn1	812979917	GZDWLAHVFCMVDQ-UHFFFAOYSA-N	430.808	1.879	50	20	IDGD	
O=C(COC(=O)C1(N2C(=O)c3ccccc3C2=O)CCCC1)NNC(=O)c1cccs1	815441503	YINHTYLPLPDBEM-UHFFFAOYSA-N	441.465	1.661	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNc2cccc(S(C)(=O)=O)c2)cc1)C1CC1	815558726	MFBGGJPKESTBOB-UHFFFAOYSA-N	430.486	1.687	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCc2nncn2C1)C(=O)Nc1cccc(COC2CCCCC2)c1	815691897	DZGYMQYHJZKHQR-MRXNPFEDSA-N	440.504	1.476	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)c2cc(N3CCNC(=O)C3)ccn2)c1	818762733	DXZLQUARYBMTAJ-UHFFFAOYSA-N	448.277	1.324	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1)NNC(=O)CC1CC1	819104356	JTYBTWJDJGYFKD-UHFFFAOYSA-N	427.832	1.975	50	20	IDGD	
O=C(NNc1ncccn1)c1ccc(NS(=O)(=O)c2ccc3c(c2)OCCO3)cc1	913040352	QBWXGHIKSKWYRY-UHFFFAOYSA-N	427.442	1.806	50	20	IDGD	
O=C(NNc1ncccn1)c1cc(S(=O)(=O)N2CCOCC2)c(Cl)cc1Cl	913040420	VMEDRMNJQWRTBR-UHFFFAOYSA-N	432.289	1.561	50	20	IDGD	
Cc1cc(C)n(CCCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)n1	915889938	RXQRBGZXAUYXHA-UHFFFAOYSA-N	448.549	1.319	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NC[C@@H](c2ccccc2)N(C)C)cc1	915891109	GZRHPKYQYLRZAB-IBGZPJMESA-N	447.561	1.249	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)CS(=O)(=O)Cc2ccc(C#N)cc2)c1C	916111289	KAWHPSGDPKBFLZ-MRXNPFEDSA-N	429.498	1.705	50	20	IDGD	
O=C(NC[C@H]1CCS(=O)(=O)C1)NNC(=O)c1ccccc1OCc1ccc(F)cc1	916375257	RAMJTXRDTUDIQV-OAHLLOKOSA-N	435.477	1.783	50	20	IDGD	
Cc1cc(C)n(-c2ccc(CNC(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)cn2)n1	916419876	WRBVXSCYNUSVPA-UHFFFAOYSA-N	432.448	1.004	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NC[C@H](C)N2CCC[C@H](C)C2)cc1	916450562	SNPMUPVOYHQEHQ-IRXDYDNUSA-N	439.582	1.066	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)N[C@H](CN1CCCC1=O)c1ccccc1	916462794	QGDBNIHTVUFWCC-QGZVFWFLSA-N	426.473	1.768	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)CCC(=O)N1CC(=O)Nc2ccccc21	916560284	GQMPNLMJSIBGLP-UHFFFAOYSA-N	448.483	1.512	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)NCc2ccc(S(=O)(=O)N(C)C)cc2)cc1C	916646904	VAEHYJGTLYYUBD-UHFFFAOYSA-N	447.517	1.023	50	20	IDGD	
COCCNS(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc3ccccc3c2)c1	918111389	XIUITYKFGRSBTR-UHFFFAOYSA-N	427.482	1.839	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CCNS(=O)(=O)c2ccc3ccccc3c2)c(O)c1	918337823	VMQZJEPRSNUUGA-UHFFFAOYSA-N	427.482	1.983	50	20	IDGD	
CCc1noc2ncc(C(=O)NNC(=O)c3ccc(S(=O)(=O)N4CCCC4)cc3)cc12	918397536	LXCAOKBKRZTKDY-UHFFFAOYSA-N	443.485	1.645	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)NC[C@@H](c1ccc(C)cc1)N1CCOCC1	919909218	TWXYIDLLBARFBL-FQEVSTJZSA-N	426.517	1.950	50	20	IDGD	
Cc1cc(F)ccc1S(=O)(=O)Nc1ccccc1C(=O)NNC(=O)CN1CCCC1=O	920435636	MBGCLFLXLIKWLR-UHFFFAOYSA-N	448.476	1.318	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)Nc1ccccc1CN1C(=O)CNC1=O	920934100	BOXVLBCXZBVURG-UHFFFAOYSA-N	431.836	1.867	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)NCc1cccc(CN2CCN(C)CC2)c1	1115977542	JIAYQTRZPCTBSN-KRWDZBQOSA-N	443.523	1.871	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(S(=O)(=O)NNC(=O)c2ccc(OC)cc2)c1	1256626890	OBZWBWIYTMAZIG-UHFFFAOYSA-N	441.531	1.349	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)CNC(=O)NC2CCCCC2)CC1	1318668193	PONULVJWZHIWRZ-UHFFFAOYSA-N	425.530	1.413	50	20	IDGD	
COc1cc(Br)c(OC)c(C(=O)NNc2nccc(N3CCOCC3)n2)c1	1319164755	YERZSJKAKYOJSC-UHFFFAOYSA-N	438.282	1.850	50	20	IDGD	
Cc1nccn1-c1ccc(CNC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cn1	1319301291	OEMHIUYVQRBVEJ-UHFFFAOYSA-N	428.474	1.123	50	20	IDGD	
CC(=O)NC1CCC(NC(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)CC1	1323414756	AHGOWUXMRGOWBW-UHFFFAOYSA-N	425.530	1.411	50	20	IDGD	
CC(C)(C)OCc1cc(CNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)no1	1338388451	WVCHLIMBCMBBAQ-UHFFFAOYSA-N	431.497	1.527	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(Cl)Cl)C2)c1[nH]nc2ccncc12	1777908285	OIFDHODPDLFHQR-FZKQIMNGSA-N	426.304	1.889	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(C)(C(=O)N2CC[C@@]3(CN(C(=O)[C@@H](F)Cl)CCO3)C2)C1	1778315150	WBVCWGCBXQZYHH-BFUOFWGJSA-N	433.908	1.608	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnn4cccnc34)C2)C1	1778442756	YAEMEUCUUTZYAS-UGSOOPFHSA-N	436.310	1.204	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](OC(C)=O)C(C)C)C2)C1	1778801024	XZZYMFGJAMYWEL-DAYGRLMNSA-N	433.343	1.578	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)c(O)c1	1780555417	GERXZXTUIALKEC-KPZWWZAWSA-N	427.295	1.628	50	20	IDGD	
COC(=O)[C@H]1CC[C@H](C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)CC1	1781326982	VWBFCCAGBSBAGT-MMQJMDILSA-N	449.317	1.486	50	20	IDGD	
O=C(c1c(F)ccc(O)c1F)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781334204	WFBFKVRUVSKCFW-CJNGLKHVSA-N	437.212	1.804	50	20	IDGD	
CC[C@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](Cl)COC)C1)N(CC)CC	1782171941	HBNXMBVKVIODBZ-NEYJZJCJSA-N	432.005	1.875	50	20	IDGD	
CCN(CC)C[C@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](Cl)COC)C1	1782179553	JNUFLKGRMGDZQF-XKGFGPFHSA-N	432.005	1.732	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(C)nc(O)c3)CCO2)C1	1783347875	QEUIYUOVKBANFM-KDOFPFPSSA-N	426.311	1.713	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cc4cccnn4c3)CCO2)C1	1783354153	UYRXKKJHUCECSA-VQIMIIECSA-N	435.322	1.951	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)CCc3cncc(OC)c3)CCO2)C1	1783873825	VGVFZETUVXAMCA-YLJYHZDGSA-N	425.913	1.107	50	20	IDGD	
C[C@@H](C(=O)N1CCO[C@]2(CCN(C(=O)C(Cl)Cl)C2)C1)N1CSCSC1	1783945666	AVBCZRPRONBMQP-NHYWBVRUSA-N	428.407	1.663	50	20	IDGD	
Cc1nn(C)c(C)c1CC(=O)N1CC[C@@]2(CN(C(=O)CCBr)CCO2)C1	1784508201	ZKTDPXXTOXXXLH-SFHVURJKSA-N	427.343	1.194	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)CCNC(=O)c3ccccc3)C2)C1	1785328278	CRMMEXGOVXQIAV-QFIPXVFZSA-N	435.952	1.901	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4nn[nH]c4c3)C[C@@H]21	1786407134	HRTKACWRTQRBKG-XEZPLFJOSA-N	436.310	1.336	50	20	IDGD	
CCn1nccc1C(=O)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1	1787505145	WMDAUPFUHYPGQN-UHFFFAOYSA-N	432.289	1.644	50	20	IDGD	
O=C(Cc1cncnc1)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1	1788144915	CPNJETGGHDZLSL-UHFFFAOYSA-N	430.273	1.147	50	20	IDGD	
Cn1nc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]3C2)c2c1CCC2	1788762687	LWHUUTKZMOGZBG-ZVZYQTTQSA-N	434.613	1.354	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(O)cc3F)C[C@@H]21)[C@@H](F)Br	1789923513	QYCPDCHXNDYLDA-MOUXYMJCSA-N	433.249	1.815	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]3C2)o1	1789925731	IIGRYPCLWMEKRW-TZQJONAQSA-N	446.273	1.522	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCSC)C[C@@H]21	1790964490	YLLBLGQSWDHSBX-LXFSFDBISA-N	437.400	1.254	50	20	IDGD	
COCc1c[nH]c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](C)Br)[C@H]3C2)c1	1791058767	DZWPGLSBHGRJBS-PCBIJLKTSA-N	428.327	1.538	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CNC(=O)C(F)(F)F)[C@H]2C1	1791311966	TZJAXOHRYVTIIY-CYDGBPFRSA-N	427.851	1.052	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)n3cccn3)[C@H]2C1	1791642097	AYTBQJQXMMRJQJ-CWVYHPPDSA-N	427.343	1.597	50	20	IDGD	
COc1cccc(N2C[C@@H](C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)[C@H](O)CCl)CC2=O)c1	1793106605	OPLUPBYBNUKARZ-SELXPKCUSA-N	449.935	1.286	50	20	IDGD	
C=CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](O)CCl)C2	1793830338	YLOOJVRETHCSOC-QRJUGERDSA-N	429.945	1.694	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCN1C(=O)c2ccccc2C1=O	1794120259	JXQHYDLDCRXADY-KRXQYRFLSA-N	447.919	1.565	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cn3cc(F)ccc3n1)C2	1795115964	XGCSYVAETYYRSB-DPIQGUFMSA-N	439.285	1.462	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCOc1ccccc1	1795120938	PGJQDYNOBUBBDD-AFIMGQEJSA-N	425.323	1.829	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)n1cccc1C=O	1795746766	QWMCBJKOMBOFEM-WVCIDPQESA-N	440.338	1.482	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc[nH]c2nccc1-2	1796181283	FBUUJRRXBMYHCH-NFFDBFGFSA-N	435.322	1.749	50	20	IDGD	
Cc1cnc(Cl)c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)c1	1796190724	DWSQLCSPGZKQAT-BJWYYQGGSA-N	427.697	1.289	50	20	IDGD	
CC(=O)N[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Cl)c1ccc(F)cc1	1796367515	KFDYRWTVTKVVDS-KUHBDSFDSA-N	429.851	1.127	50	20	IDGD	
Cc1cnc2c(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@](C)(Cl)CCl)C4)cnn2c1	1797420407	TZICRIYQTTUSJF-FCIKYMEBSA-N	440.331	1.477	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cn2ccsc2n1	1797486149	XHKGIABTGJJGMX-OPDFLTKYSA-N	441.351	1.773	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](O)CCl)C3)C1	1797819546	ONCUNRNGISTVLO-ARKGTOAJSA-N	429.945	1.481	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1ccc(C#N)cc1)C2	1797952895	KKPRFUUJAPMVEU-HATOLVCRSA-N	429.593	1.932	50	20	IDGD	
COc1ccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)C(C)(C)CCl)C3)c(C#N)c1	1799238052	XRKDBIJBZIVCDB-XEMDLRDOSA-N	433.936	1.964	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c(c1)n(C)c(=O)n3C)C2	1799267554	BENIONLJPUBSIO-KRXQYRFLSA-N	434.924	1.098	50	20	IDGD	
NC[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Br)c1ccccc1	1799346148	FPJHURJOZMXOTR-XFIYOXNOSA-N	428.302	1.009	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3nccnc3c1)C2)[C@H](F)Br	1799347922	XLLFIZLWYIVWGZ-VZAMPYOESA-N	437.269	1.524	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(=O)nc3cccnn13)C2	1800081202	DKPGYMKCGNBLTN-RJAOAUJVSA-N	438.315	1.578	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cn[nH]c1)C2	1800332961	HHHQETGOHAXKKP-IANMSCASSA-N	427.411	1.498	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cn1cc(Cl)cn1)C2	1800638904	CMSDUHPRGFTSOQ-NDPMZMCLSA-N	433.734	1.300	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)Cn1cccn1)C2	1800640304	QEKKCHCJOBSLJO-RBGFHDKUSA-N	427.343	1.282	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(C(N)=O)cc1)C2	1800644158	LBMCAQYHLXVMES-FZKCQIBNSA-N	438.322	1.162	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H]1CC(=O)N(C3CCCC3)C1)C2	1802271162	YOEGDORLVZNRME-VGAPYMQISA-N	425.957	1.670	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1CCN(C(=O)[C@@H]2CCC(=O)N2)[C@@H]1c1cccnc1	1803010034	ZKDIHNKFAMIWTN-VWNJHIHFSA-N	437.338	1.397	50	20	IDGD	
O=C(Cc1cncnc1)NC[C@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1	1804646777	IJVXLBOWIPBHCL-APWZRJJASA-N	432.322	1.905	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H](CNC(=O)CN2CCOCC2)[C@@H]1c1cccnc1	1806909885	ZMVJVPBIJZRKBS-KPFFTGBYSA-N	443.375	1.656	50	20	IDGD	
Cc1cc(NC(=O)CC(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)no1	1808391337	FXMNBPGSBOJNII-QMTMVMCOSA-N	449.895	1.012	50	20	IDGD	
C[C@@H]1CCC[C@@H]1C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1809656110	HXGKUWTZKQPILH-XEHJXZTKSA-N	435.333	1.517	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)CCN2CCOCC2)[C@H]1c1cccnc1	1813030236	FNKPXUFRAUMEIR-HBFSDRIKSA-N	438.956	1.064	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)Cc2ccc(O)cn2)[C@H]1c1cccnc1	1813033455	NTOBQGLLTITMBL-QSFXBCCZSA-N	432.908	1.685	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)C2CCSCC2)[C@@H]1c1cccnc1	1813074511	SOMBKJAMFGPYGO-GHTZIAJQSA-N	447.605	1.604	50	20	IDGD	
C[C@H]1CC[C@H](C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)CC1	1813546008	JYISFVPPAUJAHM-ZVEOBBNSSA-N	449.360	1.907	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)CC[C@H]2CCOC2)[C@H]1c1cccnc1	1813629902	KLQPQIRYYWTKRZ-GEQKSPFYSA-N	445.564	1.277	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)CS(=O)(=O)N3CCCC3)sc2C1	1817276311	QKGPTQGOKQCJDA-RYUDHWBXSA-N	448.998	1.498	50	20	IDGD	
O=C(Cn1ccncc1=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](F)Br)[nH]n1	1821656857	RAOXUAZKDYZMLD-IAQYHMDHSA-N	441.261	1.349	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)C(F)(F)C(F)F)[nH]n1	1822410988	UYAPQYSAQIOHBR-LLVKDONJSA-N	436.410	1.675	50	20	IDGD	
Cc1noc(N)c1C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1	1823005298	ZBGVCTOXJHWRKH-LHLIQPBNSA-N	432.275	1.938	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)c2ccccc2O)CC1	1825662677	LGAGLTVXPULZFB-NRFANRHFSA-N	436.317	1.619	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H](N)CCC(N)=O)CC1	1826817966	PLXDYRVTONATQU-CWRNSKLLSA-N	445.402	1.230	50	20	IDGD	
Cc1ccc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)o1	1830545426	JHGNHJCRCFPYJH-IFXJQAMLSA-N	443.338	1.618	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)Nc3ccccn3)C2)C1	1831650805	LGMQEMDDNOIQEL-FIKGOQFSSA-N	438.956	1.746	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(OC)nc3)CCO2)C1	1831945821	QYNRELQHRLQFNU-UZLBHIALSA-N	425.913	1.568	50	20	IDGD	
COc1cccc(C(=O)N2CCC(N3CCC(NC(=O)[C@@H](O)CCl)CC3)CC2)c1C	1833313020	QPUCTDZPCJMBSF-IBGZPJMESA-N	437.968	1.789	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3n[nH]c(C4CC4)c3F)CCO2)C1	1833677768	STRRIGYDGPEIKQ-VLIAUNLRSA-N	442.919	1.904	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cnn(C)c3C)CC2)CC1	1834281075	ODPUTCIRVKIJRR-SFHVURJKSA-N	425.961	1.168	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cnc4ncccn34)CC2)CC1	1835388123	MGNRUVKZQMFBRS-KRWDZBQOSA-N	448.955	1.168	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC(OC2CCN(C(=O)Cc3cc[nH]n3)CC2)CC1	1836674126	ODYJXUXWAMIEJK-AWEZNQCLSA-N	441.370	1.982	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)c3nccs3)CC2)CC1	1837549503	OGUKCFXVRCMUDS-UHFFFAOYSA-N	437.566	1.128	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4nc[nH]c4c3)C2)C1	1837713027	CZOJEDVHAVLJCS-NRFANRHFSA-N	446.580	1.484	50	20	IDGD	
CCc1nc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)co1	1838138636	CPVWPNQXGFKUAC-ROUUACIJSA-N	434.320	1.543	50	20	IDGD	
Cc1ccn(C)c1C(=O)N1CCO[C@]2(COCCN(C(=O)CCBr)C2)C1	1838815885	BUATYELOZMIFHX-SFHVURJKSA-N	428.327	1.189	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(O)cc3)CCO2)C1	1838971923	ROTDRCKRCJVQDR-LPHOPBHVSA-N	441.322	1.636	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCC(F)(F)F)C2)C1	1839963351	IIHJKBKWEQFMJH-SWLSCSKDSA-N	445.276	1.959	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(O)cc3)C2)C1	1839966101	VEPISTLWYXAUJU-APWZRJJASA-N	441.322	1.636	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CC[C@H]3CCOC3)C2)C1	1839967700	VGJGLLBYXDYSPX-BXWFABGCSA-N	447.370	1.433	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccc4c(c3)CCO4)CCO2)C1	1839998855	PTGGLUONYINFGI-GCJKJVERSA-N	436.936	1.638	50	20	IDGD	
Cc1ccc(O)c(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)c1	1840034276	GRDZEDNVYMBJMG-IFXJQAMLSA-N	441.322	1.554	50	20	IDGD	
CCOc1cccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](Cl)COC)CCO3)c1	1840154121	LWXBVZKXWYTDSW-GHTZIAJQSA-N	440.924	1.409	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(C)c(F)c3)C2)C1	1840154219	PMIDIXUWBIRSGM-OXQOHEQNSA-N	428.888	1.458	50	20	IDGD	
CC(C)(C)OC(=O)N1CC2(CC[C@@H](C(=O)N3CCCC34CN(C(=O)[C@@H](F)Cl)C4)O2)C1	1841080739	JQIVHWJLQPOUCU-UONOGXRCSA-N	445.919	1.893	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2ccc(Cl)cc2F)C1	1841145119	CEOIHZPDBYOWCO-UHFFFAOYSA-N	431.855	1.608	50	20	IDGD	
Cc1cc(Cl)cc(C(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)c1	1844265589	RMXBGRFVLSWQQI-UHFFFAOYSA-N	427.892	1.778	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)CS[C@@H]2CCCCO2)C1	1844290590	XVMBFEZUONVXFW-MMTNMYCKSA-N	447.561	1.584	50	20	IDGD	
CCn1nc(C(=O)N2CCCC23CN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C3)cc1C	1844533089	NIWZCQBUMLIICV-HZHRSRAPSA-N	425.493	1.162	50	20	IDGD	
Cc1ccn2c(=O)c(C(=O)N3CC4(CCCN4C(=O)[C@H](F)Br)C3)cnc2c1	1845217839	YMOHFRWWUFWUJT-AWEZNQCLSA-N	437.269	1.510	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC12CN(C(=O)Cn1c(=O)n(C)c3ccccc31)C2	1846177245	FPXGEJYHAGDLOC-CYBMUJFWSA-N	435.322	1.327	50	20	IDGD	
CC(=O)N[C@H](C(=O)N1CC2(CCCN2C(=O)[C@H](C)Br)C1)c1ccc(F)cc1	1846178296	PBYTWBGMWWMVHR-LRDDRELGSA-N	440.313	1.990	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc2ccc(Cl)cc2[nH]1	1847205645	DCSSOIYSUPVBKQ-PMACEKPBSA-N	437.692	1.630	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)Cc1cncnc1	1848249698	ACVUNSYXWCWSRZ-ROUUACIJSA-N	439.428	1.368	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)CN2C(=O)NC3(CCC(CC)CC3)C2=O)cc1OC	12691966	WATWXXWMEGNJLU-UHFFFAOYSA-N	446.504	1.746	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)c2ccccc2c1=O	17189469	KFIHTHUIWQOEQG-UHFFFAOYSA-N	426.429	1.517	50	20	IDGD	
Cc1[nH]c(=O)[nH]c(=O)c1CCC(=O)NNC(=O)c1cc2c(s1)CC[C@H](C(C)(C)C)C2	27314177	SLFSJQIGYHRVCA-ZDUSSCGKSA-N	432.546	1.978	50	20	IDGD	
O=C(NNC(=O)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(Cl)cc1)c1ccccc1F	725906049	NXJJFAPJTGBJRU-WBMJQRKESA-N	441.868	1.064	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)NC[C@H](c1cccc(Cl)c1)N1CCCC1	726092072	DCRZZMHRBICGFA-MRXNPFEDSA-N	433.896	1.830	50	20	IDGD	
Cc1nn(CCC#N)c(C)c1CCC(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	726863380	RBJZVGMTDMZWEF-UHFFFAOYSA-N	430.534	1.930	50	20	IDGD	
CCOc1ccc(C(=O)NNS(=O)(=O)c2cc(F)ccc2C(=O)OC)cc1OC	727351618	OUENDIRWNBIODB-UHFFFAOYSA-N	426.422	1.643	50	20	IDGD	
C#Cc1cccc(NC(=S)NNC(=O)Cn2c(=O)ccn(Cc3ccccc3)c2=O)c1	727500994	FECBPEIWBZOOPE-UHFFFAOYSA-N	433.493	1.057	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@H]2CCN(CCc3ccccc3)C2)c1	728603899	SXQGWPHCAUAWQC-GOSISDBHSA-N	444.557	1.599	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)NC[C@@H](C(C)C)N2CCOCC2)c1	728742360	BTDJYEJDANXLDJ-INIZCTEOSA-N	443.342	1.759	50	20	IDGD	
CC(C)(C(=O)NNC(=O)C1CCN(c2ncccn2)CC1)c1ccc2c(c1)OCCO2	728846223	VHCZUAHWVFZXST-UHFFFAOYSA-N	425.489	1.589	50	20	IDGD	
CCOC(=O)N1CCC(NC(=O)CCCNC(=O)NNC(=O)c2cccc(C#N)c2)CC1	728952695	AGLLSKNYRUTOCO-UHFFFAOYSA-N	444.492	1.020	50	20	IDGD	
O=C(NC[C@@H]1CN2CCC[C@H]2CO1)NNC(=O)c1ccc(Br)cc1Cl	729500629	VAHUQJPPOLYUFJ-NWDGAFQWSA-N	431.718	1.910	50	20	IDGD	
CC(C)(C)CC(=O)N1CSC[C@H]1C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	730074791	BXIXXZPTZOCSSB-AWEZNQCLSA-N	427.548	1.189	50	20	IDGD	
O=C(Cc1ccc(NC(=O)c2ccc(Br)o2)cc1)NNC(=O)Cc1cc[nH]n1	730102271	MFBJUPXCDKKTKM-UHFFFAOYSA-N	446.261	1.950	50	20	IDGD	
Cc1c(/C=C(\C#N)C(=O)N2CCN(CC(=O)N[C@@H]3CCC[C@@H](C)C3)CC2)cc(C#N)n1C	731198680	JOKWQPYMNZVOKA-DITITPFASA-N	436.560	1.951	50	20	IDGD	
COc1cc([N+](=O)[O-])c(C(=O)NNC(=O)CCN2C[C@H](C)O[C@@H](C)C2)cc1SC	732258515	DUANFSNGKSMBFR-RYUDHWBXSA-N	426.495	1.586	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)N[C@H](Cc1ccccc1)CN1CCOCC1	732476853	ZOUKMVMDCLPPQC-GOSISDBHSA-N	430.480	1.478	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)N[C@H]1CCN(c2ccccc2C(N)=O)C1	732594798	JANSXHUTJHOXQG-INIZCTEOSA-N	425.489	1.336	50	20	IDGD	
CCC[C@H](NC(=O)Cc1ccccc1)C(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	732676024	AHSASHWUZDQCGM-SFHVURJKSA-N	435.484	1.867	50	20	IDGD	
Cc1cc(C)nc(SCc2ccc(C(=O)NNC(=O)C(C)(C)S(C)(=O)=O)cc2)n1	733084574	GOGUKROBOPGRDF-UHFFFAOYSA-N	436.559	1.970	50	20	IDGD	
CC(C)OCCCn1c(NNC(=O)[C@H](C)Sc2nncn2C)nc2ccccc2c1=O	733265770	KLVIASFBPMLIAV-AWEZNQCLSA-N	445.549	1.964	50	20	IDGD	
CCOc1ccc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)C3=COCC3)cc2)cc1	734120394	QGVWBHZKUJUDNU-UHFFFAOYSA-N	431.470	1.951	50	20	IDGD	
CC(C)n1c(C(F)(F)F)nc2cc(C(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)ccc21	734389697	UZZGDLHUPNIISW-NSHDSACASA-N	432.424	1.832	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)C(C)(C)C	734672874	CERRWVKCGGYKMQ-CQSZACIVSA-N	426.539	1.334	50	20	IDGD	
CCOC(=O)N[C@@H](C(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1)C(C)C	734820971	BVSHOZIQCFYKNE-CQSZACIVSA-N	429.518	1.487	50	20	IDGD	
COCCOc1ccc(-n2nc(C)c(C(=O)NNC(=O)c3c(C)nc4ccccn34)n2)cc1	735030703	HFSQYWXUKQMWKG-UHFFFAOYSA-N	449.471	1.632	50	20	IDGD	
CCCCOc1ccc(C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)cc1	735117177	CHPHCCGBJWEBCU-UHFFFAOYSA-N	447.561	1.954	50	20	IDGD	
CCOC(=O)N1CCC[C@@H](C(=O)OCC(=O)NNC(=O)c2cc(C)c(CC)s2)C1	736772843	UOBFELURAJCYME-CYBMUJFWSA-N	425.507	1.792	50	20	IDGD	
CC(C)C(=O)N(C)Cc1ccc(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1	741558319	CUKRQMNBNWZTAS-UHFFFAOYSA-N	438.532	1.769	50	20	IDGD	
Cc1nnc(S)n1CCNC(=O)CCC(=O)C(C#N)=C1N(C)c2ccccc2N1C	742182000	OFIAQNDOBRUMHB-UHFFFAOYSA-N	425.518	1.662	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)[C@@H]1CCCN(c2ncnc3sccc23)C1	742611669	CVHZTNRPGWDFHW-GFCCVEGCSA-N	428.474	1.078	50	20	IDGD	
CCc1ccc(N2CCN(C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)CC2)cc1	743589213	QWGRBFNNONAWSJ-UHFFFAOYSA-N	437.548	1.818	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)c2cc(Br)ccc2O)o1	743731932	DJIQCBLJEOQWMA-UHFFFAOYSA-N	432.252	1.073	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)CNC(=O)NCc2ccc([N+](=O)[O-])cc2)cc1	743828695	AUHQFESPSHTXEV-UHFFFAOYSA-N	429.437	1.313	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)CNC(=O)c2ccc(C#N)cc2)cc1Cl	743834587	LLPNHHMEQHRLRW-UHFFFAOYSA-N	431.836	1.812	50	20	IDGD	
C[C@H]1CN(c2ccc(C(=O)OCC(=O)NNC(=O)c3ccc(C#N)cc3)cn2)C[C@@H](C)O1	744716076	ZPMONBBGVHKMNY-GASCZTMLSA-N	437.456	1.185	50	20	IDGD	
O=C(COC(=O)[C@@H]1C[C@H]1c1ccc2c(c1)OCCO2)NNC(=O)c1ccc([N+](=O)[O-])cc1	745285886	LVNALPGZFRTKGC-JKSUJKDBSA-N	441.396	1.474	50	20	IDGD	
C[C@@H]1C[C@@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)CCN1C	745859293	ZZCPLWUAMVMZEO-WBVHZDCISA-N	437.566	1.288	50	20	IDGD	
C[C@@H](NC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)c1cccc(C#N)c1	745923410	QGORVXJXWXGIEX-OAHLLOKOSA-N	443.533	1.277	50	20	IDGD	
CN(C)[C@@H](CNC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)c1ccc(Cl)cc1	746776361	DEJZNKZPBPZNHX-KRWDZBQOSA-N	442.907	1.834	50	20	IDGD	
COc1cc(C(C)=NNC(=O)[C@H](C)CN2CCOCC2)ccc1S(=O)(=O)C(F)F	747041178	HKFLVCSYWMHPDG-GFCCVEGCSA-N	433.477	1.500	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)CSc2nnc(S)s2)c2ccccc2c1=O	747345504	NZFHZFIYOBCPNH-UHFFFAOYSA-N	436.544	1.671	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)c1ccc(C)cc1)C(=O)NNC(=O)Cc1ccncc1	747428125	FTIVFAVFSAPUIG-KRWDZBQOSA-N	436.559	1.180	50	20	IDGD	
CC(C)(CO)[C@@H](CNC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)c1ccccc1	747456017	JXENOXFQVNLNRS-SFHVURJKSA-N	433.530	1.836	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)NCC(=O)Nc1cc(Br)ccc1C	748625937	VZHVBYRKYCSXCT-NSHDSACASA-N	431.287	1.078	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)CNC(=O)CCc2ccc(C)cc2)c2ccccc2c1=O	749161413	YGJXPPAZFNEROB-UHFFFAOYSA-N	449.511	1.625	50	20	IDGD	
CCN1CCN(C(=O)CNC(=O)/C(C#N)=C\c2cc(C)n(C[C@@H]3CCCO3)c2C)CC1	750734116	ONHXDKAGGICFAM-MSTPFNHUSA-N	427.549	1.471	50	20	IDGD	
Cc1cc(C)cc(C(=O)N2CCC[C@H](C(=O)NNC(=O)CNC(=O)c3cccs3)C2)c1	751206441	MZIHGIPWFJFZGK-INIZCTEOSA-N	442.541	1.795	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)Nc1ccccc1C(=O)N1CCOCC1	755622909	JRWXXPCSPIMDAP-CQSZACIVSA-N	430.436	1.918	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)Nc1cc(Br)ccc1N1CCOCC1	756040143	WSWGFLYVGZKALT-GFCCVEGCSA-N	445.314	1.490	50	20	IDGD	
CCNC(=O)c1ccc(NC(=O)NNC(=O)c2nn(CC)c(=O)c3ccccc23)c(C)c1	756085711	UPVFURJBSVBHRK-UHFFFAOYSA-N	436.472	1.941	50	20	IDGD	
CCOCC(=O)NNC(=O)Nc1cccc(S(=O)(=O)/N=C2/CCCCCN2C)c1	756166421	NLZRIJAIGDQAQC-JWGURIENSA-N	425.511	1.469	50	20	IDGD	
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)cc1	756816683	TUENOQINMMFHTD-GXTWGEPZSA-N	440.522	1.860	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)CN2C(=O)NC3(C[C@@H](C)C[C@H](C)C3)C2=O)c1	756863293	IEAHUOQUUMWEDV-GJZGRUSLSA-N	430.505	1.576	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)[C@@](C)(O)CN3Cc4ccccc4C3=O)n[nH]2)c1	756879731	NWLPQWSVDKYJHD-DEOSSOPVSA-N	447.495	1.862	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNS(=O)(=O)c1cc(F)c(Br)cc1F	756936751	UBFQDZWTCAXCSG-UHFFFAOYSA-N	428.255	1.342	50	20	IDGD	
Cc1nn(-c2ccc(Br)cc2)c(C)c1C(=O)NNc1ccc(C(N)=O)nn1	757399511	NVJRBQGIXANMLC-UHFFFAOYSA-N	430.266	1.897	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CN2C(=O)NC3(C[C@@H](C)C[C@H](C)C3)C2=O)cc1C	757633255	JXYHKJVXUVXKKW-STQMWFEESA-N	443.504	1.136	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)[C@H]2COc3ccc(Br)cc32)c1	758656897	VHHZEMCTZOTGLB-HNNXBMFYSA-N	444.241	1.801	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)N[C@H]2CCO[C@@H](c3ccc(F)cc3)C2)c2ccccc2c1=O	758715367	QJJQTVCULPWZNC-MAUKXSAKSA-N	439.447	1.937	50	20	IDGD	
CCS(=O)(=O)N1CCC(CNC(=O)NNC(=O)Cc2ccc3ccccc3c2)CC1	758740997	BKPXAIBXGAXUEY-UHFFFAOYSA-N	432.546	1.774	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)N[C@H]2CN(C(=O)OC(C)(C)C)C[C@H]2C#N)cc1OC	758777753	PQUMFIMZQCXUCL-CABCVRRESA-N	447.492	1.797	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NC[C@@]1(Cc2ccc(F)cc2)CCC[C@@H]1O	759691237	BAODJMQRCQUVNO-UWJYYQICSA-N	448.520	1.721	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)c1cccnc1I	760451243	RETYPFCRCKCPFI-UHFFFAOYSA-N	434.234	1.362	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])o1	762371186	RRFQWWUBMIVIFD-GFCCVEGCSA-N	448.457	1.741	50	20	IDGD	
O=C(NNC(=O)c1ccccc1)C(=O)Nc1cccc(N2C(=O)c3ccccc3C2=O)c1	763420718	WPGVXYGRHYLJCF-UHFFFAOYSA-N	428.404	1.887	50	20	IDGD	
O=C(NNC(=O)c1ccccc1O)C(=O)Nc1cccc(C(=O)N2CCc3ccccc32)c1	763526229	IDLTVDHOURZEQH-UHFFFAOYSA-N	444.447	1.995	50	20	IDGD	
CCCCn1ncc(NC(=O)C(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)c1C	763539608	OGHLVLVFBIZFPM-UHFFFAOYSA-N	433.465	1.417	50	20	IDGD	
CSc1cc2c(cc1NC(=O)C(=O)NNC(=O)[C@H]1COc3ccccc3O1)OCCO2	763571985	KBEZOYZEHRKWOG-MRXNPFEDSA-N	445.453	1.106	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(-c2nccc(C)n2)cc1	763661447	BQCMLDDAKZDXLI-UHFFFAOYSA-N	435.440	1.626	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(Br)c(F)c2)cc1	763661769	PBDICANOBSNGHJ-UHFFFAOYSA-N	440.225	1.762	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(-c2nnco2)ccc1C	763680764	HQARUCOYMJJRHJ-UHFFFAOYSA-N	439.428	1.609	50	20	IDGD	
CCn1cnnc1-c1ccccc1NC(=O)C(=O)NNC(=O)COc1ccc(Cl)cc1	763686318	LKFYJHUMGWTNHQ-UHFFFAOYSA-N	442.863	1.783	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)C(C)C)cccc1C(=O)N1CCc2sccc2C1	763816759	OIVRPJKDMUZNPZ-UHFFFAOYSA-N	428.514	1.997	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(-n3cncn3)c(Cl)c2)cc1	763822065	VJVJOLDCVIDMBZ-UHFFFAOYSA-N	428.836	1.394	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)C(=O)N1CCc2c1cccc2C(F)(F)F	763839061	FBJMYRLZUPBVCA-UHFFFAOYSA-N	425.338	1.960	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)C(=O)Nc1ncn(Cc2ccc(Cl)cc2)n1	763841066	NLBRRDIXFWFMCJ-UHFFFAOYSA-N	446.826	1.284	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)c(F)c1	763841209	ORWNHNBOVJLQGG-ZDUSSCGKSA-N	431.420	1.783	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)C(=O)Nc1cccc(C(N)=O)c1	763884774	XUUNMUHSCIIRRN-JTQLQIEISA-N	449.261	1.101	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(NC(=O)OC)c(F)c2)cc1OC	763902709	OYXCZCIITVXCER-UHFFFAOYSA-N	448.407	1.811	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)Nc1ccc(CN2C(=O)CCC2=O)cc1	763917749	MDTCVJMFLVCGAY-UHFFFAOYSA-N	428.470	1.986	50	20	IDGD	
CC[C@H](C)NS(=O)(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)c2ccccc2C)c1	763962964	WBQIBMNAAKJGSI-HNNXBMFYSA-N	446.529	1.613	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)C(=O)Nc1ccc(O[C@@H]2CCOC2)cc1	763994994	LARNBVMZMXYBDY-CYBMUJFWSA-N	437.250	1.345	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)nc1)C(=O)Nc1cccc(-c2nnnn2C2CC2)c1	764100283	LQANFHBSNDQXMG-UHFFFAOYSA-N	426.824	1.123	50	20	IDGD	
O=C(CC(F)(F)F)NNC(=O)C(=O)Nc1cccc(N2C(=O)c3ccccc3C2=O)c1	764113154	UMZVINOLPATYSJ-UHFFFAOYSA-N	434.330	1.526	50	20	IDGD	
CCOC(=O)c1cc(F)c(F)cc1NC(=O)C(=O)NNC(=O)c1cccc(OC)c1O	764131048	MINBMXAXYFCCIA-UHFFFAOYSA-N	437.355	1.255	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(OCCc3ccccc3)nc2)cc1	764176302	FJQLANQEGMUFJS-UHFFFAOYSA-N	429.436	1.974	50	20	IDGD	
CCOc1ncccc1NC(=O)C(=O)NNC(=O)c1cc(F)ccc1Br	764270025	BMNFIXRSXWQRQO-UHFFFAOYSA-N	425.214	1.782	50	20	IDGD	
CC(=O)Nc1ccc(C)c(NC(=O)C(=O)NNC(=O)c2cc(Br)ccc2O)c1	764280694	RKTGDMORSDMQEB-UHFFFAOYSA-N	449.261	1.821	50	20	IDGD	
Cc1nn(-c2ccc(C#N)cc2)c(NC(=O)C(=O)NNC(=O)Cc2ccccc2F)c1C	764319822	BIGYDQLSZSEITE-UHFFFAOYSA-N	434.431	1.829	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)C(=O)Nc1ccc(N2C[C@H](C)O[C@H](C)C2)nc1)c1ccccc1	764328316	OTPOMOSQBORMBJ-JTDSTZFVSA-N	439.516	1.975	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)C(=O)Nc1ccc(N2CCc3sccc3C2)nc1	764352891	DOARCGIIVSABAK-UHFFFAOYSA-N	436.497	1.429	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)ccc1C(=O)N(C)C	764370065	MOGBFHKLUYLZSD-UHFFFAOYSA-N	434.399	1.455	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2cccs2)[nH]n1)C(=O)Nc1cccc(C(=O)NC2CC2)c1	764383179	XOMFCGGYVKUGPN-UHFFFAOYSA-N	438.469	1.430	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ncccc2C)ccc1C	764385760	IAYUNGLNSLEFEZ-UHFFFAOYSA-N	447.517	1.129	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)CCC(=O)N1CCN(c2ccccc2)CC1	764553107	QWRJATSCSOBBRE-KRWDZBQOSA-N	442.491	1.869	50	20	IDGD	
Cn1c(=O)c2c(ncn2CC(=O)NN=Cc2ccc(-c3c(F)cccc3F)o2)n(C)c1=O	764812300	ILNSEKYJRSSAMF-UHFFFAOYSA-N	442.382	1.122	50	20	IDGD	
COc1cccc([C@@H](O)C(=O)NNC(=O)c2cc(-c3ccc(OC)c(OC)c3)[nH]n2)c1	765228421	GLOKKCHSLOAQIS-LJQANCHMSA-N	426.429	1.597	50	20	IDGD	
CCOc1cccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)n1	765315781	KOPHQRNQQPDART-UHFFFAOYSA-N	433.490	1.731	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)c1c[nH]nc1-c1ccc2c(c1)OCCO2	765418009	MLSJKVGCWIWKEL-UHFFFAOYSA-N	445.476	1.914	50	20	IDGD	
COc1cc(-c2noc(CCC(=O)NNC(=O)c3cc(C)[nH]n3)n2)cc(Cl)c1OC	765587236	RIXGLTUXGFFYPB-UHFFFAOYSA-N	434.840	1.833	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCc2cccnc21)c1cccc(S(=O)(=O)N2CCCC2)c1	766329534	VYQQGXICSPEMEM-SFHVURJKSA-N	428.514	1.747	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)NNC(=O)c1ccc(N2C(=O)CCC2=O)c([N+](=O)[O-])c1	767428229	AHFRTCBKIWFPMC-UHFFFAOYSA-N	435.396	1.733	50	20	IDGD	
O=C(COC(=O)COc1ccc2c(c1)CCCC2)NNC(=O)[C@@H]1COc2ccccc2O1	767526440	DPIMDHKPVVWVOU-FQEVSTJZSA-N	440.452	1.475	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N2CCOC3(CCOCC3)C2)cc1Br	767949702	VFKJZEYLFMIVMT-UHFFFAOYSA-N	428.283	1.694	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3ccccc3-n3cnnn3)n[nH]2)cc1OC	768275738	GBUHYFHFXTXGSO-UHFFFAOYSA-N	434.416	1.144	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc2c(c1)OCCCO2)NNc1nc2ccccc2[nH]1	768515267	PPRUDZLJPVFBJQ-UHFFFAOYSA-N	431.474	1.536	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)Nc1cc(Br)c(=O)n(C)c1	769242989	RULYLAAGYOWBAH-UHFFFAOYSA-N	445.295	1.709	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(C)(C)N2C(=O)c3ccccc3C2=O)cc1OC	770220085	OWEHEPQXQOJUOX-UHFFFAOYSA-N	425.441	1.930	50	20	IDGD	
COc1cc2c(c(OC)c1OC)CCN(CC(=O)NNC(=O)Cc1ccccc1C)CC2	770251115	IMNWGIBXSFDTLM-UHFFFAOYSA-N	441.528	1.812	50	20	IDGD	
CC1(C)[C@H](NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)C[C@H]1OCc1ccccc1	770305145	DVJOETNDTKKWIG-RTBURBONSA-N	435.488	1.990	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNS(=O)(=O)c1c(Cl)nc2sccn12	771607714	QSECMWRFLZWUTK-UHFFFAOYSA-N	448.313	1.329	50	20	IDGD	
Cc1cc(C(=O)N2CCC[C@@H]2C(=O)O[C@H](C)C(=O)NNC(=O)CC(C)C)ccc1[N+](=O)[O-]	772076650	RPKIHHUKPYMLAU-RHSMWYFYSA-N	448.476	1.633	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)Cc3cccc(OCC(=O)NC)c3)n[nH]2)cc1	772228196	LPBIRCDYBWPRDR-UHFFFAOYSA-N	435.484	1.768	50	20	IDGD	
O=C(Cn1cc(C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)cn1)NC1CCCC1	772477768	SFUNGWFXZODFOF-UHFFFAOYSA-N	439.451	1.546	50	20	IDGD	
Cc1ccccc1NC(=O)NNC(=O)C(=O)Nc1ccc(I)cn1	773642396	MRIYNWWFBDUWIB-UHFFFAOYSA-N	439.213	1.786	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1cccc(OCCN(C)C)c1	774006141	AYTZYSNVUQJHNF-CQSZACIVSA-N	448.907	1.834	50	20	IDGD	
CO[C@H](c1ccccc1F)[C@@H](C)NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1	775736139	NMILLDAQDOONEG-KDOFPFPSSA-N	430.484	1.939	50	20	IDGD	
Cc1cnn(-c2ccc(S(=O)(=O)NNC(=O)CNC(=O)OC(C)(C)C)cc2F)c1	777939415	OHCJYGRFAQUSKJ-UHFFFAOYSA-N	427.458	1.154	50	20	IDGD	
Cc1onc(CC(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)c1C#N	779531664	DCCKMBVFIHNPMW-UHFFFAOYSA-N	430.896	1.016	50	20	IDGD	
COc1cccc(C(=O)NNS(=O)(=O)c2cc(C(=O)O)c(F)c(Cl)c2F)c1O	779834804	XGILLGDJBGKYJC-UHFFFAOYSA-N	436.776	1.654	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)[C@H]2CCN2C(=O)OC(C)(C)C)cc1	780161477	ZLETWFSJUBQTBG-OAHLLOKOSA-N	446.533	1.878	50	20	IDGD	
Cc1cccc(-c2nnc(S)n2CCC(=O)NNC(=O)CCNC(=O)OC(C)(C)C)c1	780971936	VVIQQTLKIPOZPG-UHFFFAOYSA-N	448.549	1.995	50	20	IDGD	
Cc1ccc(CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)c(N2CCCC2)n1	781385871	GWQHDMUOXBIJLD-UHFFFAOYSA-N	445.549	1.428	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2cccc(-c3cnco3)c2)nc1	783265785	XRMGREDRGSAQOR-UHFFFAOYSA-N	444.473	1.505	50	20	IDGD	
O=C(NNc1ccc(-n2cccn2)nn1)C(=O)Nc1ccc(N2CCCC2)c(Cl)c1	783432934	IHKYKTYGKPUEAH-UHFFFAOYSA-N	426.868	1.998	50	20	IDGD	
O=C(NNc1ccccc1Cl)C(=O)Nc1cccc(S(=O)(=O)N2CCOCC2)c1	784774258	NLMWNQMNGLIUKA-UHFFFAOYSA-N	438.893	1.443	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ccnc(Br)c2)cc1S(C)(=O)=O	784828444	IFQLMFLSUQUCSR-UHFFFAOYSA-N	427.280	1.638	50	20	IDGD	
O=C(NNc1cccc(F)c1F)C(=O)Nc1ccc(F)c(N2CCCS2(=O)=O)c1	785015782	RMRUJIZTPPAZFO-UHFFFAOYSA-N	428.392	1.726	50	20	IDGD	
CNS(=O)(=O)c1ccc2c(c1)N(C(=O)C(=O)NNc1cc(F)c(F)c(F)c1)CC2	785083579	UDDDBMSSYHRKMR-UHFFFAOYSA-N	428.392	1.044	50	20	IDGD	
CS(=O)(=O)N1CCc2c(NC(=O)C(=O)NNc3ccc(Cl)c(F)c3)cccc21	785185844	KFAIHWXWNHETRZ-UHFFFAOYSA-N	426.857	1.883	50	20	IDGD	
Cn1cc(-c2ncccc2NC(=O)C(=O)NNC(=O)c2cccc(C(F)(F)F)c2)cn1	786417455	QBBXQTGXPLRWDI-UHFFFAOYSA-N	432.362	1.901	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)N[C@@H]1CCCN(Cc2ccc(F)cc2F)C1=O	786967698	NRTXDIKIRCRADC-MRXNPFEDSA-N	448.426	1.571	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CC(=O)c2ccccc21)c1ccc(S(=O)(=O)N2CCCC2)cc1	789734803	HUIXTCASBJCWGE-GOSISDBHSA-N	427.482	1.602	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(C)s2)C1	790063633	PNENMZTVIKCBRC-AWEZNQCLSA-N	447.579	1.394	50	20	IDGD	
CCS(=O)(=O)c1ccc([C@H](C)NC(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1	790989985	WYYIPZMQAOFSHZ-ZDUSSCGKSA-N	433.486	1.957	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H]2[C@H]3[C@@H]4C[C@@H]5[C@@H]6C[C@@H]([C@@H]3[C@@H]64)[C@@H]52)c1	792774836	YCXGAZHAEAMWIQ-NNZJSVBASA-N	443.569	1.872	50	20	IDGD	
C[C@@](O)(CN1C(=O)NC2(CCCC2)C1=O)C(=O)NNc1ccc(F)cc1Br	793709102	MZBKXVSOOYTFPZ-MRXNPFEDSA-N	443.273	1.647	50	20	IDGD	
O=C(CCCS(=O)(=O)c1ccc(Cl)cc1)NNC(=O)c1ccc(-n2cnnn2)cc1	794786038	XRTCMLNSNMSHGL-UHFFFAOYSA-N	448.892	1.331	50	20	IDGD	
CCCC[C@@H](C)C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	799857822	YHNWUIYHMCJVKH-MRXNPFEDSA-N	425.551	1.614	50	20	IDGD	
COCN1C(=O)CCc2cc(NC(=O)NNC(=O)COc3ccccc3OC)ccc21	801780162	PWBPNRGQFZYOCD-UHFFFAOYSA-N	428.445	1.810	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)Nc2ccc(Br)cc2)o1	801996273	CNEIWBKMNRDNHU-UHFFFAOYSA-N	431.268	1.759	50	20	IDGD	
O=C(CN1C(=O)N[C@@]2(CCc3ccccc32)C1=O)NNC(=O)Nc1ccc(Cl)cc1	802016552	GASCLHBPECIBEI-HXUWFJFHSA-N	427.848	1.886	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)N=c3cc[nH]cc3)CC2)c(C)c1	802030117	XHAJJWVTWNRXFH-UHFFFAOYSA-N	431.518	1.374	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)CNC(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)C)cc1	802059873	WWKOJAPNZQLPSN-INIZCTEOSA-N	437.497	1.513	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)c2ccccc2S(=O)(=O)N2CCOCC2)cc1	802117576	UXOFVZOLKLIWQS-UHFFFAOYSA-N	447.517	1.240	50	20	IDGD	
COc1cccc(CCC(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1F	803727428	OZPOKRRBJVQUMO-KRWDZBQOSA-N	432.404	1.298	50	20	IDGD	
O=C1CC[C@@]2(C(=O)NNc3ccc(-n4ccnc4)nn3)N1c1ccccc1C(=O)N2C1CC1	804958773	MSFSWKSQGGBGIA-QFIPXVFZSA-N	444.455	1.247	50	20	IDGD	
CCN(CC)CC(=O)Nc1cccc(NC(=O)C(=O)NNc2ccccc2[N+](=O)[O-])c1	806983793	AFTANYAIDBFUTJ-UHFFFAOYSA-N	428.449	1.957	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)CNS(=O)(=O)c2cccc(F)c2)o1	810200926	RFMYUMBNFWZHMV-UHFFFAOYSA-N	426.470	1.000	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)nc1)C(=O)Nc1ccc(Br)c([N+](=O)[O-])c1	810384127	DHYMOUDSWZBHAO-UHFFFAOYSA-N	442.613	1.805	50	20	IDGD	
Cn1nncc1COC(=O)/C(C#N)=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	811031531	SDDHHFORYKKXEN-RIYZIHGNSA-N	439.863	1.858	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)NCCc1c[nH]c2cccc(Br)c12	811872678	PYMWCYMEGNBPHA-UHFFFAOYSA-N	448.277	1.826	50	20	IDGD	
CCOC(=O)c1ccc(NNC(=O)[C@H](C)NS(=O)(=O)c2c(C)nn(C)c2C)cc1C	812724158	VCOSQJMDINFUJX-ZDUSSCGKSA-N	437.522	1.332	50	20	IDGD	
Cc1cnc(Br)c(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)c1	812980241	QDJBUCGUHAVYGX-UHFFFAOYSA-N	443.261	1.942	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)cc1C	813034138	YQGZEHRYJCNKDI-UHFFFAOYSA-N	434.474	1.114	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCC[C@@]2(O)C[C@H]3CC[C@H]2C3)nc1	813784916	YQJBXYFNIOMUCE-YZVOILCLSA-N	425.555	1.679	50	20	IDGD	
CC(C)(C)OC(=O)NCCOc1ccc(NC(=O)C(=O)NNc2ncncc2F)cc1	815764103	RBKWWRBEPLCFJG-UHFFFAOYSA-N	434.428	1.601	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCO1)C(=O)Nc1cc(C(F)(F)F)ccc1N1CCCCC1	815779390	CZDRPIHXWDWTQB-OAHLLOKOSA-N	428.411	1.961	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)CCNC(=O)c2ccc(C(C)(C)C)cc2)C[C@@H](C)O1	912924585	AEEIXITUEVBWOJ-CALCHBBNSA-N	432.565	1.751	50	20	IDGD	
COc1ccc(Cn2ncc3cc(C(=O)NNC(=O)c4cccnc4)cnc32)c(OC)c1	914846303	GPLSQJGBNWSHCQ-UHFFFAOYSA-N	432.440	1.967	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)CCNS(=O)(=O)c1ccc(F)cc1	915775858	RRPCUZOOZKCWHJ-UHFFFAOYSA-N	447.492	1.254	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)NCCN1CCN(Cc2ccccc2)CC1	915902689	ZYGRWLOXKFXOAK-GOSISDBHSA-N	443.523	1.741	50	20	IDGD	
COc1cc2ncn(CCCC(=O)NNC(=O)c3ccc(Cl)nc3)c(=O)c2cc1OC	917253267	AIFDOWNMPGWCLD-UHFFFAOYSA-N	445.863	1.704	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2ccc3c(=O)n4c(nc3c2)CCCCC4)C[C@H](C)O1	917363125	SQSFSPWXOPQWHC-HOTGVXAUSA-N	441.532	1.383	50	20	IDGD	
CCNC(=O)COc1cccc(CNC(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)c1	918090550	HYVMYFICGHWRMZ-UHFFFAOYSA-N	441.488	1.287	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cc(-c3ccccc3)no2)cc1OC	919188083	JLWPPHUROLJPFL-UHFFFAOYSA-N	425.397	1.977	50	20	IDGD	
CCCCS(=O)(=O)N1CCC[C@H]1C(=O)OCC(=O)NNC(=O)c1cccc(Cl)c1	919362162	WCFMNRQMDUKIJQ-HNNXBMFYSA-N	445.925	1.239	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)c1sccc1S(=O)(=O)N1CCCCC1	919820559	PONPYWMTDJHAGA-UHFFFAOYSA-N	437.543	1.935	50	20	IDGD	
CN(C)C(=O)Cn1cc(C(=O)NNC(=O)c2ccccc2OCc2ccc(F)cc2)nn1	919926554	VGCBXBKLOUUXET-UHFFFAOYSA-N	440.435	1.159	50	20	IDGD	
C[C@@]1(NNC(=O)NC[C@@H]2CCN(c3cccc(Br)c3)C2)CCS(=O)(=O)C1	920049168	RJINZYCHOKXTLB-SUMWQHHRSA-N	445.383	1.656	50	20	IDGD	
CCC(=O)N1CCCC[C@@H]1C(=O)NNC(=O)c1ccc(CSc2nncn2C)cc1	920288523	WXSBRJCIEZKHKA-MRXNPFEDSA-N	430.534	1.660	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)C1(NC(C)=O)CCCCC1	920535528	SNHDWMHUJVCYGJ-UHFFFAOYSA-N	425.869	1.492	50	20	IDGD	
CCn1cnnc1CNC(=O)/C(C#N)=C\c1cn(CCC(N)=O)nc1-c1ccc(OC)cc1	920852731	YWAXFUDGLKUMQZ-YBEGLDIGSA-N	448.487	1.269	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)Nc2nc(CN3CCOCC3)cs2)cc1	920933197	KUGNCZFRWKBGIV-AWEZNQCLSA-N	449.533	1.994	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@@H]2CCCN2C(=O)c2ccc(OC)cc2OC)cc1	1317814345	WJYMDQORIKWLGW-SFHVURJKSA-N	427.457	1.778	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)NC1CCN([C@@H]2CCCC[C@@H]2O)CC1	1319252867	QBEMRGNPOBXFOB-SJORKVTESA-N	428.493	1.047	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cn(CCOc3ccc(C=O)cc3Cl)nn2)cc1	1319721873	KZMCTRBSBIVGSG-UHFFFAOYSA-N	443.847	1.906	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)c2ccc(N3CCC[C@H](C(N)=O)C3)cc2)nc1C	1319895063	QCMODTPXIRSZOP-HNNXBMFYSA-N	426.477	1.420	50	20	IDGD	
O=C(NNc1cncc(Br)c1)c1cccc(S(=O)(=O)N2CCOCC2)c1	1320252828	VTBHWAAAHADSPR-UHFFFAOYSA-N	441.307	1.622	50	20	IDGD	
Cc1oc2ncn(C)c(=O)c2c1C(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1	1321909667	KKYJVSWADULCKM-UHFFFAOYSA-N	433.465	1.243	50	20	IDGD	
Cc1ccc2[nH]c(C(=O)N3CC[C@]4(CN(C(=O)CCC(=O)NN(C)C)CCO4)C3)cc2c1	1777743977	KCPLTTHUFXSAMG-QHCPKHFHSA-N	441.532	1.293	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cc(N3CCCC3)ccn1)CCO2	1779295469	NXUNHOYNVWTLOR-QFIPXVFZSA-N	446.624	1.977	50	20	IDGD	
COc1nc(C)ccc1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1779741135	PILXZXVEPKQNMU-CXAGYDPISA-N	430.274	1.533	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccn(-c4ccccc4)n3)C2)C1	1780344384	VDRUGAQKWPURTG-DYESRHJHSA-N	432.908	1.570	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](NC(=O)OC)c1ccccc1)CCO2	1781211054	HGAKQDJZOXSVHA-FVJLSDCUSA-N	437.924	1.931	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)Cn1ccnc1)C2	1782002725	UYZUFDDNCLVGOH-YKTARERQSA-N	441.370	1.817	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc4cccnc4nc3O)C2)C1	1782267044	CFPPUSLITZWUKY-FOIQADDNSA-N	434.880	1.033	50	20	IDGD	
O=C(c1cn2c(F)cccc2n1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1782373328	HQDVIMYBRHNIED-RHSMWYFYSA-N	443.248	1.607	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnc4c(c3)NC(=O)CS4)C2)C1	1782422437	JUVDMKQXYNMZBM-YJYMSZOUSA-N	438.937	1.587	50	20	IDGD	
C[C@H](C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@](C)(Cl)CCl)C2)n1cncn1	1782532364	YDQNNRZVCFORLG-DTTOXWODSA-N	432.352	1.589	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@]2(CN(C(=O)C(=O)C3CC3)CCO2)C1	1782861063	GIAHNJRDPQPXMR-KYIYGJGQSA-N	429.423	1.681	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ncn(C(C)C)n3)CCO2)C1	1783348025	SBXSCUYBEAKRQK-GUYCJALGSA-N	428.331	1.476	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cnn(C)c3Cl)CCO2)C1	1783350742	BLXUEIOUVCHHST-MLGOLLRUSA-N	433.734	1.691	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cc(O)ccc3O)CCO2)C1	1783354324	YCWQLFHMSXAMPM-RDTXWAMCSA-N	427.295	1.715	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@H](C(=O)N2CC[C@@]3(CN(C(=O)[C@H](C)Br)CCO3)C2)C1	1783866373	FOBUEDOIHFADAF-ZTENYAIWSA-N	445.354	1.579	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)CCc3ccnc(OC)c3)CCO2)C1	1783872606	CWSBLRNYDXKSMQ-JXFKEZNVSA-N	425.913	1.107	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccnc4c(O)cccc34)CCO2)C1	1783881848	NDUGDNOGMGTWIC-HRAATJIYSA-N	433.892	1.638	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3cncnc3)C[C@@H]21	1783965267	GDRAGJIQZVFRIQ-HJWJTTGWSA-N	439.354	1.420	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4nccn4c3)C[C@@H]21	1783966691	JVCXLIYXMIKWNO-IWCQGFGOSA-N	449.349	1.959	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ncccc3F)C[C@@H]21	1783969696	JOPYTXGIVCMOSA-ABHRYQDASA-N	428.302	1.845	50	20	IDGD	
COc1ccc(F)cc1CC(=O)N1CC[C@@]2(CN(C(=O)CCBr)CCO2)C1	1784080394	ZSXZVKAOUUXTKC-IBGZPJMESA-N	443.313	1.992	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3c(C)c[nH]c3C)[C@H]2C1	1784220521	HKAHTOBYTRXPDF-KANFNMMFSA-N	425.957	1.798	50	20	IDGD	
C[C@H](Oc1ccccn1)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2	1784489117	UWCYHUWMVPHLFA-JVPBZIDWSA-N	430.332	1.915	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3COc4ccccc4O3)[C@H]2C1	1785043585	MOGDNMHDKXXITD-IJCKYZCQSA-N	438.908	1.060	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(=O)n3C)[C@H]2C1	1785866864	WYSVLOXHDKABJZ-YXWQFLTLSA-N	440.338	1.010	50	20	IDGD	
Cc1cnc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)CBr)C[C@@H]32)cn1	1785985027	BEFAHJVDNHEIKM-PCBIJLKTSA-N	425.327	1.409	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)c1ccc2c[nH]nc2c1	1787320846	XWZQSNXKESJOJK-DARAHFNDSA-N	439.285	1.847	50	20	IDGD	
N[C@@H](C(=O)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1)c1ccccn1	1788143913	VKTHXJUTCRAEJT-OAQYLSRUSA-N	444.300	1.209	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C=N/N3CCCCC3)[C@H]2C1	1788603486	FPKVFIFLMOFJOP-LRBDOGNESA-N	429.359	1.221	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)CBr)C[C@@H]21	1791249115	FIPQKUXTHBCVTK-HTOAHKCRSA-N	425.751	1.251	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4c(c3)NC(=O)CC4)C[C@@H]21	1791256642	FTNMKTREELTZFV-BMFAXAFESA-N	449.935	1.418	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3cncn3c1)C2	1792871057	PZHCFTXHNMXDKN-FAYQHZLMSA-N	435.322	1.569	50	20	IDGD	
CCOc1ccc(Cl)cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](O)CCl	1792981079	ZNGOFHDGDJZLAM-DJZPMSPPSA-N	431.316	1.542	50	20	IDGD	
CC(C)(C)OC(=O)CCCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc(B(O)O)c1)C2	1793162466	WEFZLCWVBNDBON-REPLKXPHSA-N	444.337	1.130	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2)[C@@H]1CC(=O)N(Cc2ccccc2)C1	1793206594	UGKONBDDJGBWLS-WCWVYFQPSA-N	437.899	1.159	50	20	IDGD	
Cc1ccc(CCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)cc1F	1793527747	WKGAZZKOIUTCNH-WKCHPHFGSA-N	438.308	1.699	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)nc(Cl)c1	1794415638	GPDZABUILRUXLM-NWJSVONSSA-N	446.729	1.817	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCBr	1795114553	VMSLBTZHFOTVKL-XOIINTDNSA-N	435.322	1.631	50	20	IDGD	
C[C@@H](Sc1ccccn1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCBr	1795117010	JAZNRWUKQCKYCF-VWPFQQQWSA-N	442.379	1.937	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(Br)ncc1F)C2)[C@H](F)Cl	1796365127	QMGPJAHRHHZQNT-XXHBBNRNSA-N	438.656	1.721	50	20	IDGD	
C[C@H]1Oc2ccc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)C(Cl)Cl)C4)cc2NC1=O	1798584055	ACTJECHBBFVLOT-ADGXKJENSA-N	442.299	1.413	50	20	IDGD	
COc1cccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)CBr)C3)c1	1798887363	ZLALPOIMIGJJKD-JJAZEVLHSA-N	425.323	1.929	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1Cc3ccccc3O1)C2	1799275937	DNKGTDNVCHFXMT-QUYZETPZSA-N	427.328	1.816	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CNc3ccccc31)C2)[C@H](F)Br	1799346443	QRHUIOXBVFQNEM-AYCVOAMHSA-N	426.286	1.476	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)Oc1ccccc1	1799379986	XRISSRSVKLMCSO-SVZOTFJBSA-N	425.323	1.827	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(=C/c1ccco1)NC(C)=O	1799685012	OZSCAUPDJVPMKP-JJQBXIMZSA-N	437.924	1.754	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2ncccc2[nH]1	1799890126	RSZONPFYVCSTPW-KOFHJDLBSA-N	435.322	1.797	50	20	IDGD	
O=C(Cc1ccc2c(c1)CCO2)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2	1800689943	MQIMGSMNZVWOQQ-DACLVMHWSA-N	441.297	1.444	50	20	IDGD	
CC(=O)N[C@H](C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2	1801682713	UPYDLRHOTKIKIQ-BQDHKBFISA-N	446.460	1.297	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc3c(c2)OCCO3)[C@H]1c1cccnc1)[C@H](O)CCl	1803138676	DCXDBDSDBVFZMG-QKLQHJQFSA-N	445.903	1.772	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)Cc2ccccc2)[C@H]1c1cccnc1	1806519405	CHUOBVHBGRXHDQ-HYBUGGRVSA-N	437.544	1.703	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)[C@@H]2CCC(=O)N2)[C@H]1c1cccnc1	1806638624	BLOMHALAVBYELF-QBYUYEEZSA-N	437.338	1.540	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)c2ccccc2O)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807360340	AGLFXEDXDXTSLF-GCJKJVERSA-N	445.284	1.100	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)s1	1807369457	KKTFYTHAGNMIJJ-WIYYLYMNSA-N	449.341	1.765	50	20	IDGD	
COCCOCC(=O)N1CC[C@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]1c1cccnc1	1808295894	MWUSTTNQHWIGEY-SZVBFZGTSA-N	432.348	1.987	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)c3cc4cccnc4[nH]3)CC2)C1	1809972091	LWYAECJPWOVPDQ-UHFFFAOYSA-N	446.316	1.401	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)c3cccn4cncc34)CC2)C1	1809972596	SAEIQKIDAHIQFW-UHFFFAOYSA-N	446.316	1.173	50	20	IDGD	
O=C(c1ccc2nonc2c1)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1	1809977816	JCSCXIUWZIBLDZ-UHFFFAOYSA-N	448.288	1.061	50	20	IDGD	
CN1N=C(C(=O)N2CC[C@@H](CNC(=O)CO[Si](C)(C)C)[C@@H]2c2cccnc2)CCC1=O	1810539720	IKADJEWVZQHUBB-JXFKEZNVSA-N	445.596	1.547	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)c1cc2cccnn2n1	1811264466	XKIBADHQHZBXLL-QGTPRVQTSA-N	428.880	1.044	50	20	IDGD	
Cc1nnc(CC(=O)N2CC[C@H](CNC(=O)[C@@H](C)Br)[C@@H]2c2cccnc2)o1	1812863284	GJKVMQVMQSVFQI-ZLENFMNRSA-N	436.310	1.805	50	20	IDGD	
CC[C@H](NC(C)=O)C(=O)N1CC[C@H](CNC(=O)[C@@H](C)Br)[C@@H]1c1cccnc1	1812864551	WBLWXELPJCVNQA-VZEFYGNVSA-N	439.354	1.786	50	20	IDGD	
CNc1nsnc1C(=O)N1CC[C@H](CNC(=O)[C@@H](Cl)COC)[C@H]1c1cccnc1	1813028869	WFZKEYQOMKKQSQ-VNHYZAJKSA-N	438.941	1.548	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)CCC(F)(F)F)[C@H]1c1cccnc1	1813071127	NMJDJZIOVOMEHP-BEFAXECRSA-N	443.470	1.803	50	20	IDGD	
C=CCC(CC=C)C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1	1815335490	AHYVCSATDWFJGI-QGZVFWFLSA-N	439.346	1.817	50	20	IDGD	
CC(=O)N(C)[C@@H](C)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CO[Si](C)(C)C)CC2	1817301119	BLXUUTAABFJXNH-WCQYABFASA-N	426.615	1.773	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](O)N2CCOCC2)n[nH]1	1819442197	XAQVFYROBDYWIU-OHNRDTAOSA-N	427.933	1.460	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2nc[nH]c2[N+](=O)[O-])[nH]n1	1822367851	BIKIWNPWKFDOFY-ONGXEEELSA-N	425.833	1.601	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)C[C@@](C)(O)CC(=O)O)n[nH]1	1822415761	XHPKZUHQFRLRFK-RRUGBERISA-N	430.889	1.271	50	20	IDGD	
CC[C@H](NC(C)=O)C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1	1822999599	VENMBKOMVXDLAY-HOTUBEGUSA-N	435.319	1.660	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnc(OC)cn1)CC2	1825999931	YCHAQPGSRAUTGV-NXEZZACHSA-N	425.898	1.421	50	20	IDGD	
CSCC[C@@H](O)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCBr)CC2	1826125097	UGVIHGKHXJKOBK-GXSJLCMTSA-N	436.397	1.954	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)CCn3cncn3)sc2C1	1826611214	QMLWUGDISYGIIQ-QWRGUYRKSA-N	441.355	1.910	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H](N)CCC(N)=O)CC1	1830316271	HLNXQIHNZDVZOW-YZVOILCLSA-N	435.396	1.435	50	20	IDGD	
C[C@@H](Cn1cccn1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830358619	PSXRQGHAWCKCPZ-JXFKEZNVSA-N	426.945	1.241	50	20	IDGD	
O=C(Cn1ccncc1=O)N1CCC([C@H]2CCCCN2C(=O)[C@H](F)Br)CC1	1830382540	KLVBHHDDVDJGII-PBHICJAKSA-N	443.317	1.554	50	20	IDGD	
O=C(Cn1ccncc1=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H](F)Br)CC1	1830382544	KLVBHHDDVDJGII-YOEHRIQHSA-N	443.317	1.554	50	20	IDGD	
O=C(c1scnc1C1CC1)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1833732371	XEYOCDVILYCXFO-KRWDZBQOSA-N	434.345	1.894	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)c3ccc(F)nc3F)C2)C1	1834820090	MTEDBOKZGXKHHD-KRWDZBQOSA-N	448.264	1.215	50	20	IDGD	
C[C@]1(C(=O)N2CCOC[C@]3(CN(C(=O)CCBr)CCO3)C2)CC=CCC1	1834826324	LIKJPZIMJLYLAY-OALUTQOASA-N	429.355	1.974	50	20	IDGD	
Cn1ccc2cccc(C(=O)NC3CCN(C4CCN(C(=O)[C@@H](O)CCl)CC4)CC3)c21	1835399271	WARLXVHYMBIPDQ-FQEVSTJZSA-N	446.979	1.963	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)C(Cl)Cl)CC2)CC1)c1ccc2nncn2c1	1835585481	QTFFGSCXDSVNNE-UHFFFAOYSA-N	439.347	1.718	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CCNC(C)C)CCO2)C1	1835888917	BWLVVSZWRAOZLL-QAPCUYQASA-N	434.375	1.004	50	20	IDGD	
CCN(C)[C@H](C)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](F)Br)CC2)CC1	1836413995	SYISFLNQFOJEJB-CZUORRHYSA-N	435.382	1.589	50	20	IDGD	
COC(=O)[C@@H]1CC[C@@H](C(=O)N2CCC(OC3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)C1	1836711547	RZFZWLUVZRRVJY-RKVPGOIHSA-N	444.956	1.174	50	20	IDGD	
Cc1cc(CCC(=O)N2CCC(OC3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)ccn1	1836715715	WSWCNJKPDRKSAH-FQEVSTJZSA-N	437.968	1.921	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3coc(Cl)n3)C2)C1	1837712131	GKMOBTXMVVYCGJ-KRWDZBQOSA-N	431.949	1.250	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(F)cc(F)c3)CCO2)C1	1839003605	PZXVCYKZTWEQGP-XIKOKIGWSA-N	447.276	1.818	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCCC(=O)OC(C)(C)C)C2)C1	1839141492	JXCZQAKVUMRPNB-IIBYNOLFSA-N	446.972	1.972	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C=C/C(=O)c3cccs3)C2)C1	1839144474	AWPCVCSSPRWMBH-XKRVECJUSA-N	440.949	1.961	50	20	IDGD	
Cc1n[nH]c(C)c1CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2	1839154236	HXDSANLRVCBISD-RBUKOAKNSA-N	447.363	1.262	50	20	IDGD	
Cc1cc(F)ccc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839203416	KOBIKPFAVBGZFL-MAUKXSAKSA-N	447.276	1.895	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)c(O)c1OC	1839376696	NFDFDTPPRCIDAY-QFBILLFUSA-N	446.859	1.014	50	20	IDGD	
C/C=C/C(=O)N1CCO[C@]2(COCCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1	1839816361	YJYDBOZWVCALKX-XOGKJJLSSA-N	431.439	1.904	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(F)nc3)C2)C1	1840033563	IZJIEFIBRJGGHV-PXAZEXFGSA-N	430.274	1.074	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CC(OCC)OCC)CCO2)C1	1840279762	AOSYMRGJXVNUNU-OXJNMPFZSA-N	434.961	1.640	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H]3CCCS3)CCO2)C1	1840580005	ZONIPLZGBDMHKA-RRQGHBQHSA-N	425.378	1.575	50	20	IDGD	
C[C@@]1(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCBr)C3)C2)CC1(F)F	1840825029	UKHNIIFBXLUYJZ-LSDHHAIUSA-N	425.270	1.273	50	20	IDGD	
O=C([C@@H](O)CCl)N1CC2(CCCN2C(=O)c2csc(-n3ncc4ccccc43)n2)C1	1842261429	GIYCHCMMUWVENW-INIZCTEOSA-N	445.932	1.899	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC2(CCCN2C(=O)c2ccc3c(n2)NC(=O)CC3)C1	1843231538	DRYUTNUVEGLFAP-GFCCVEGCSA-N	435.322	1.814	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H](F)C[C@@H](C(=O)N2CCCC23CN(C(=O)[C@H](O)CCl)C3)C1	1843887911	NGNOIWHVZUPPPE-RBSFLKMASA-N	447.935	1.385	50	20	IDGD	
COC(=O)c1ccc(OCC(=O)N2CC3(CCCN3C(=O)CO[Si](C)(C)C)C2)cc1	1844379684	AKBNDWYIGTYMLR-UHFFFAOYSA-N	434.565	1.907	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)c2ccc([N+](=O)[O-])c3c2OCO3)C1	1844758973	SGSNRMCPAJARAN-LBPRGKRZSA-N	425.825	1.394	50	20	IDGD	
CS(=O)(=O)CC(=O)N1CC2(CCCN2C(=O)[C@H](Br)Cc2ccccc2)C1	1845940665	CSHAGPIDIXVORS-OAHLLOKOSA-N	443.363	1.241	50	20	IDGD	
COc1cc(Cl)ccc1CC(=O)N1CC2(CCCN2C(=O)CCC(=O)NN(C)C)C1	1846386015	UQFFGSFVRDDGDF-UHFFFAOYSA-N	436.940	1.468	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CCO2)C1	1847151566	BOVBOSGXQMFKQJ-LSDHHAIUSA-N	429.945	1.843	50	20	IDGD	
CC(C)(C)OC(=O)N1CCCC[C@@H]1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl	1847562830	AXILPMJTCXMNJG-JONQDZQNSA-N	429.945	1.578	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2cc(C(=O)O)cc(C)c2C)cc(OC)c1OC	13078634	UBOYZPUYCLDDSY-UHFFFAOYSA-N	438.458	1.651	50	20	IDGD	
COc1ccc(/C=C(\C#N)C(=O)OCC(=O)NN2C(=O)NC3(CCC(C)CC3)C2=O)cc1	18192767	DAIJBQCKCFVPHS-LFIBNONCSA-N	440.456	1.677	50	20	IDGD	
O=C(NNC(=O)c1n[nH]c(=O)c2ccccc12)c1cnc2c(cnn2Cc2ccccc2)c1	23389742	RGKGXPZNBOOTFW-UHFFFAOYSA-N	439.435	1.791	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@H](C)Oc2ccc3ccccc3c2)ccc1OCC(N)=O	24154348	CGAWNLHBADXXNK-AWEZNQCLSA-N	437.452	1.941	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)NCc2ccc([C@@]3(C)NC(=O)NC3=O)cc2)c1	726282770	SGKMUZSZSHWVCZ-JOCHJYFZSA-N	439.472	1.267	50	20	IDGD	
CCCC(=O)N1CSC[C@H]1C(=O)NNC(=O)COc1ccc(Br)cc1	727295010	KKDZGCFIHULWFC-ZDUSSCGKSA-N	430.324	1.677	50	20	IDGD	
O=C(NNC(=S)NCC1CCC1)c1cccc(S(=O)(=O)NC[C@@H]2CCCO2)c1	727866021	KUWUXRHFWGSCSV-HNNXBMFYSA-N	426.564	1.053	50	20	IDGD	
O=C(NNc1nc(-c2cccnc2)no1)[C@H]1CCCCN1S(=O)(=O)c1ccccc1	728078659	OQAJGYMZGAOPNM-MRXNPFEDSA-N	428.474	1.818	50	20	IDGD	
O=C(COC(=O)c1c[nH]nc1C1CCCCC1)NNC(=O)[C@@H]1COc2ccccc2O1	728344228	SZIIKVQAMFTCHW-KRWDZBQOSA-N	428.445	1.602	50	20	IDGD	
COc1ccc(C2(C(=O)OCC(=O)NNC(=O)Cc3nc(C)cs3)CCOCC2)cc1	728729682	TVODITSMXMILJD-UHFFFAOYSA-N	447.513	1.442	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)c1cc([N+](=O)[O-])ccc1I	728851441	ALSZJTOHMSHLCE-UHFFFAOYSA-N	426.170	1.598	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)Cc2cccnc2)ccc1Br	728856381	ONEOPMNDTMBQPH-UHFFFAOYSA-N	428.264	1.183	50	20	IDGD	
CCCS(=O)(=O)N1CCCC[C@H]1C(=O)NNc1ccc(S(=O)(=O)C(F)F)cc1	728972209	HBNBQSQPAKFGPM-AWEZNQCLSA-N	439.506	1.720	50	20	IDGD	
O=C(NNC(=O)c1c(F)ccc(S(=O)(=O)NC2CC2)c1F)c1ccc(Cl)nc1	729839788	NICRLJDNRQQPMR-UHFFFAOYSA-N	430.820	1.529	50	20	IDGD	
COC(=O)C1CCC(NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)CC1	730131829	VNJIJDJNOFPZNB-UHFFFAOYSA-N	431.537	1.261	50	20	IDGD	
O=C(NCCc1cccs1)NNC(=O)[C@@H]1CCN(c2ccc3c(c2)OCCO3)C1=O	730533283	XFFDCUMKQGNPHI-HNNXBMFYSA-N	430.486	1.445	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccccc2)C1	730779666	BRANPRURBXXPGS-OAHLLOKOSA-N	433.486	1.019	50	20	IDGD	
CC(C)(C)c1ccc(S(=O)(=O)NCCC(=O)NNC(=O)COc2ccccc2O)cc1	730782601	QCXJMKPCHLNFAE-UHFFFAOYSA-N	449.529	1.585	50	20	IDGD	
O=C(COC(=O)[C@H](c1ccccc1)N1CCC(O)CC1)NNC(=O)c1cccc(Cl)c1	731247540	IBOMLAJHIQXABK-FQEVSTJZSA-N	445.903	1.842	50	20	IDGD	
CCCNC(=O)CCC(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	731865553	MPWFVPJUYXNJAK-UHFFFAOYSA-N	435.488	1.456	50	20	IDGD	
COC(=O)c1ccc2[nH]cc(C=NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)c2c1	731924859	QGYYLFVUKBQOEH-UHFFFAOYSA-N	428.470	1.969	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)NCCN/C(O)=C1\N=CC=CC1=O	732466461	OGWPKLRRJDXCLN-BMRADRMJSA-N	440.485	1.589	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2)c1cnn(-c2ccccc2)c1	733123091	QYCQGHVKTYDRAU-UHFFFAOYSA-N	445.413	1.175	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCc2ccnc(OC3CCOCC3)c2)cc1OC	733339135	QUJBCDHSXMUPDX-UHFFFAOYSA-N	430.461	1.801	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)N2CCC(C(=O)NCCCN3CCCC3)CC2)cc(C#N)n1C	733975289	NUHIWVLGJOYZKM-STZFKDTASA-N	436.560	1.953	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)c(Br)c1	734238853	ADUFHYPEALWYST-UHFFFAOYSA-N	431.287	1.926	50	20	IDGD	
Cc1nn(-c2ccccc2)c(C)c1CC(=O)NNC(=O)NCCNC(=O)OC(C)(C)C	734238941	BYUVOXOSYJJUMQ-UHFFFAOYSA-N	430.509	1.887	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)C[C@@H]1Oc2ccccc2NC1=O	734250916	PDMDLNYXOJEQNO-INIZCTEOSA-N	432.502	1.996	50	20	IDGD	
CCOC(=O)c1cc(S(=O)(=O)NNC(=O)c2ccc(C)cc2O)cc([N+](=O)[O-])c1C	734806538	DRAHTUHXLGKLIX-UHFFFAOYSA-N	437.430	1.717	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)COCCOc2ccccc2)CC1	734824620	GCHRIXBEQJVDQL-UHFFFAOYSA-N	436.509	1.812	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NCCc2ccc(Br)cc2)c2ccccc2c1=O	735386341	NSGYRXIZORPUFM-UHFFFAOYSA-N	444.289	1.883	50	20	IDGD	
CCc1nc(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)nn1-c1ccccc1	735462321	WKUDJHSWTKPYNX-UHFFFAOYSA-N	427.490	1.198	50	20	IDGD	
Cc1nc(-c2cccnc2)nc(NNC(=O)C2=NN(c3ccc(F)cc3)[C@H](C(N)=O)C2)c1C	736696722	MHKHIWIZFUFPDE-SFHVURJKSA-N	448.462	1.858	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)N1CCN(C(=O)Cc2c[nH]c3ccccc23)CC1	738495710	JPGAESUSBKCPBM-UHFFFAOYSA-N	449.511	1.812	50	20	IDGD	
COCCn1c(SCC(=O)NNC(=O)c2cccc(C)c2)nnc1-c1ccncc1	742449909	NCXZRYZKDATMMN-UHFFFAOYSA-N	426.502	1.848	50	20	IDGD	
Cc1ccc(CN2C(=O)CC[C@H]2C(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1	742478317	MXEBNEQQRUOYHB-KRWDZBQOSA-N	443.529	1.240	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)N[C@@H]1CC(=O)N(CCOc2ccccc2)C1	743509908	MVXLFYLLFPLUIM-MRXNPFEDSA-N	436.472	1.267	50	20	IDGD	
COc1ccccc1C[C@H](C)N(C)C(=O)NNC(=O)c1csc(N2CCOCC2)n1	743510171	QZGOATGCHQQOJQ-AWEZNQCLSA-N	433.534	1.906	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@@H]1CCCC[C@H]1NC(=O)NNC(=O)CNC(=O)c1ccco1	743578252	WULCXZLVLGOXBN-UONOGXRCSA-N	437.497	1.423	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CN2CCC(c3n[nH]c(-c4ccccc4)n3)CC2)c1	744392479	OUAZQGLMCUZWML-UHFFFAOYSA-N	429.484	1.984	50	20	IDGD	
COc1cc(C(=O)Oc2ccc(C=NNC(=O)C(=O)NC(C)C)cc2)cc(OC)c1OC	744812296	KMLWIDUFFXIKHJ-UHFFFAOYSA-N	443.456	1.906	50	20	IDGD	
O=C(NCc1ccc(OCC(F)(F)F)nc1)NNC(=O)c1cc([N+](=O)[O-])ccc1O	745471158	VVJMRGXFZOBNFM-UHFFFAOYSA-N	429.311	1.781	50	20	IDGD	
CC(C)OC(=O)[C@H](C)CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	745904315	APEDMRQVPFHHJV-CQSZACIVSA-N	440.522	1.003	50	20	IDGD	
CCS(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)c1	746269781	KMKMYBFFVTVETN-UHFFFAOYSA-N	432.474	1.088	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)CCc2nc(O)c3cnn(-c4ccccc4)c3n2)cc1	747174405	LBRKWEPHVSYWGI-UHFFFAOYSA-N	427.424	1.787	50	20	IDGD	
C[C@@H](c1ccc([S@@](C)=O)cc1)N(C)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	747500971	OINPGSUBHBWGBM-PBNKOMEISA-N	444.561	1.864	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNS(=O)(=O)c1cc(Br)c(C)cc1OC	747618063	ZEWDLVUAIUXALR-UHFFFAOYSA-N	436.328	1.380	50	20	IDGD	
O=C(NNc1ccc(F)cc1Br)[C@H]1CC(=O)N(CCN2CCOCC2)C1	748075403	YCGWWUPHPUCYOY-LBPRGKRZSA-N	429.290	1.212	50	20	IDGD	
Cn1c(=O)n(CC(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)c2ccccc21	748509960	AJTKYGPJGPAPLF-UHFFFAOYSA-N	428.392	1.777	50	20	IDGD	
CN(C)N(C(=O)c1cccc(F)c1I)[C@@H]1CCS(=O)(=O)C1	749648287	SFUSMLXEKQNARD-SECBINFHSA-N	426.251	1.536	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)c1csc(N2CCOCC2)n1)CNC(=O)OC(C)(C)C	749768032	HLHDPJPNQUFFKY-LBPRGKRZSA-N	442.542	1.085	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(C(=O)N2CCOCC2)cc1)c1cc2ccccc2o1	749867358	UZQVSPDXVFGOEZ-UHFFFAOYSA-N	429.454	1.529	50	20	IDGD	
COc1ccc([C@H](C)CC(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1	750539230	NBSRZFPJITWSIQ-AUUYWEPGSA-N	428.441	1.719	50	20	IDGD	
Cc1cc(S(=O)(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)sc1Br	751207020	FUPMUTMSTFZIEP-UHFFFAOYSA-N	443.308	1.418	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)Cc1csc(NC(=O)c2ccco2)n1	751209968	WAOJFFWNGFDEKM-UHFFFAOYSA-N	433.471	1.170	50	20	IDGD	
O=C(Cc1ccc(Br)c(F)c1)NNC(=O)C1CCN(c2ncccn2)CC1	751888444	JQWYYSNBOMWFOW-UHFFFAOYSA-N	436.285	1.985	50	20	IDGD	
CC[C@H](NC(=O)/C(C#N)=C\c1cc(C)n(C[C@@H]2CCCO2)c1C)C(=O)N1CCOCC1	752480869	BZHDDHUBVQVCMM-OOMCBONISA-N	428.533	1.945	50	20	IDGD	
O=C(NNC(=O)c1cc(F)c(F)c(O)c1F)c1cccc(S(=O)(=O)N2CCCC2)c1	754829275	KHBKKOYTQZOULV-UHFFFAOYSA-N	443.403	1.669	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N(CC)CC)cc1NC(=O)NNC(=O)Cc1cccnc1	755441063	GWDAAIWRPQZFTP-UHFFFAOYSA-N	449.533	1.906	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)Nc2ccccc2C(=O)N2CCN(C)CC2)cc1	755624395	SUQQBORGUOYOJU-UHFFFAOYSA-N	439.516	1.868	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2ncc(C(C)C)s2)c2ccccc2c1=O	756164274	PCPIDRSSLHHKCM-UHFFFAOYSA-N	428.474	1.396	50	20	IDGD	
Cc1c(NC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cccc1C(=O)N1CCOCC1	756184953	UKDNKDULXQMIPI-UHFFFAOYSA-N	427.417	1.842	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)Nc1ccccc1CN1C(=O)CCC1=O	756220548	IKAYDKOMUOYQKZ-UHFFFAOYSA-N	448.439	1.693	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)Nc2cnn(CCN3CCOCC3)c2)cc1OC	756827410	TXZMXFQRUJTMBH-UHFFFAOYSA-N	432.481	1.089	50	20	IDGD	
Cc1ccc(S(=O)(=O)Nc2ccccc2F)cc1C(=O)NNc1ccc(C(N)=O)nn1	757407570	KOUFCGWMBNMPFM-UHFFFAOYSA-N	444.448	1.581	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)COc2ccc(F)cc2)cc1S(=O)(=O)NC1CC1	757863660	GASDWZPPDMKUEW-UHFFFAOYSA-N	436.465	1.807	50	20	IDGD	
CCCc1cc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)n(C)n1	757890453	GLSCEDLWBCWHDR-UHFFFAOYSA-N	434.522	1.624	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(F)(F)[C@H](C(=O)NNC(=O)Cc2cn3ccccc3n2)C1	757985119	HWKOCTOOPKRXIX-AWEZNQCLSA-N	437.447	1.917	50	20	IDGD	
Cc1cc(F)cc(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)c1[N+](=O)[O-]	758505234	PWXHNZAEYCIXRF-UHFFFAOYSA-N	438.437	1.820	50	20	IDGD	
O=C(NCC1(c2cccc(Br)c2)CC1)NNC(=O)C(=O)Nc1ccccn1	758783933	BEVHBRWOCDPMKM-UHFFFAOYSA-N	432.278	1.845	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)NCCCc2ccc3c(c2)OCCO3)cc1C	758894458	LOVGMMDSIICYQY-UHFFFAOYSA-N	426.473	1.976	50	20	IDGD	
COCCS(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2ccc3ccccc3n2)cc1	759262768	WTHUKJYXHFMJJF-UHFFFAOYSA-N	442.497	1.799	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCNC(=O)[C@H]1c1ccccc1C	759920393	DJQADYOCPURSBP-LJQANCHMSA-N	430.892	1.591	50	20	IDGD	
Cc1ccnc(-n2nccc2NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)c1	760289267	CLWZYOWHDACXGA-UHFFFAOYSA-N	436.457	1.427	50	20	IDGD	
Cc1cc(C)nc(-n2nccc2NC(=O)C(=O)NNc2ccc(Cl)cc2[N+](=O)[O-])n1	760307795	SKUPXARHTHOLCM-UHFFFAOYSA-N	430.812	1.923	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(Br)c([N+](=O)[O-])c1)c1ccc2c(c1)OCO2	760334411	GQXOVIOBRKNEAX-UHFFFAOYSA-N	444.219	1.709	50	20	IDGD	
O=C(NCCOc1ncccc1Cl)NNC(=O)c1csc(N2CCOCC2)n1	760716537	SHFKPKUQWLKYTF-UHFFFAOYSA-N	426.886	1.051	50	20	IDGD	
C[C@@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)cc2)C[C@@H](C)O1	763445836	LJFOARNGXNPLCS-ZIAGYGMSSA-N	441.444	1.608	50	20	IDGD	
CC(C)NC(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c1	763454320	HGBZSEOXTOKUMX-UHFFFAOYSA-N	447.835	1.786	50	20	IDGD	
Cc1ccc(N2CCOC2=O)cc1NC(=O)C(=O)NNC(=O)c1ccc2ccccc2n1	763466259	JWKUXJLBGAIEHU-UHFFFAOYSA-N	433.424	1.900	50	20	IDGD	
CCCN1C(=O)CCc2cc(NC(=O)C(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)ccc21	763471316	HHDIEVXALIUWIS-UHFFFAOYSA-N	439.428	1.684	50	20	IDGD	
CCCN1CCN(c2ccc(NC(=O)C(=O)NNC(=O)c3cccnc3)cc2Cl)CC1	763492306	UOXDSWWZNBHKJQ-UHFFFAOYSA-N	444.923	1.667	50	20	IDGD	
CC(C)Cn1cc(NC(=O)C(=O)NNC(=O)COc2cccc(C(F)(F)F)c2)cn1	763638968	GHCRDCASDDHRKN-UHFFFAOYSA-N	427.383	1.723	50	20	IDGD	
CCCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2cc(C)cc(C)c2)cc1	763645094	PUIJHMWYAOQSQZ-UHFFFAOYSA-N	426.473	1.608	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(Br)nc1C	763662547	JKLNTZDIQGKXJN-UHFFFAOYSA-N	437.250	1.326	50	20	IDGD	
CCNC(=O)c1ccc(C)c(NC(=O)C(=O)NNC(=O)COc2ccccc2OCC)c1	763682420	OAUUBWBITKATED-UHFFFAOYSA-N	442.472	1.308	50	20	IDGD	
O=C(CN1CCCc2ccccc21)NNC(=O)C(=O)Nc1cccc(Oc2cnccn2)c1	763736408	SXCBHKGNQJRWMW-UHFFFAOYSA-N	446.467	1.808	50	20	IDGD	
CCCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(OC)cc(OC)c2)cc1	763773401	WHCYASUISQWCSQ-UHFFFAOYSA-N	428.445	1.243	50	20	IDGD	
NC(=O)c1cnn2c(C(=O)NNc3nnc(-c4ccccc4)n3-c3ccccc3)ccnc12	763779954	SWVGSVXEPGPQFF-UHFFFAOYSA-N	439.439	1.833	50	20	IDGD	
CSc1nnnn1-c1cccc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCC3)c1	763781312	IUPPCBKNCKVDEV-UHFFFAOYSA-N	443.514	1.334	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)C(=O)Nc2cccc(C#N)c2)c2ccccc2c1=O	763801369	QDDUSNSNNMCTRN-UHFFFAOYSA-N	432.440	1.468	50	20	IDGD	
COC(=O)c1cc(Cl)ccc1NC(=O)C(=O)NNC(=O)COc1ccccc1C#N	763814408	SYBWCJBZKRUPSA-UHFFFAOYSA-N	430.804	1.163	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)C(=O)Nc1cccc(CN2CCCC2=O)c1	763837520	ICFBLWWSRAKPAE-UHFFFAOYSA-N	428.420	1.113	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)Cc2c[nH]c3ccccc23)cc1S(C)(=O)=O	763861970	XUEOTJPIVMQPCV-UHFFFAOYSA-N	428.470	1.208	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccnn2Cc2ccc(C(C)C)cc2)n1	763893266	SMMNVKZNDUSSIO-UHFFFAOYSA-N	437.504	1.654	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)C(=O)Nc1ncn(Cc2ccc(Cl)cc2)n1	763933537	ZXJUATSTXBNOCV-UHFFFAOYSA-N	430.827	1.448	50	20	IDGD	
O=C1COc2ccc(NC(=O)C(=O)NNC(=O)c3ccc(Br)s3)cc2N1	763940531	ITRSQWPBTXSVMU-UHFFFAOYSA-N	439.247	1.241	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)CCC(=O)N2	764002093	IURDMOFSCYGPEH-UHFFFAOYSA-N	434.250	1.072	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)Nc1c[nH]nc1-c1ccccc1	764005100	UKGWDYHNSKOBFG-UHFFFAOYSA-N	431.250	1.577	50	20	IDGD	
O=C(NNC(=O)c1cccc(Br)c1)C(=O)Nc1ccccc1N1CCOC1=O	764059044	NUDKVJOSFVGIHT-UHFFFAOYSA-N	447.245	1.805	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(NC(=O)C3CC3)cc2)o1	764138747	JJGHDJBTDJXDGN-UHFFFAOYSA-N	441.488	1.870	50	20	IDGD	
CCCN1C(=O)CCc2cc(NC(=O)C(=O)NNC(=O)[C@H]3Cc4ccccc4O3)ccc21	764167011	HCIWPYPJKRHJMZ-LJQANCHMSA-N	436.468	1.465	50	20	IDGD	
Cc1ncsc1C(=O)NNC(=O)C(=O)Nc1ccc(OCc2ccccn2)c(F)c1	764244195	CYXKJGSODGDEPB-UHFFFAOYSA-N	429.433	1.964	50	20	IDGD	
CCc1noc(-c2cc(Cl)ccc2NC(=O)C(=O)NNC(=O)Cc2cccnc2)n1	764266506	KMHHVLKOAFNNCC-UHFFFAOYSA-N	428.836	1.676	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccccn2)cc1OCc1ccncc1	764268261	OJHAGCCVGZMABV-UHFFFAOYSA-N	435.440	1.393	50	20	IDGD	
O=C1CCc2ccc(NC(=O)C(=O)NNC(=O)c3cc(Br)ccc3O)cc2N1	764278095	RYFVRPIOVQVSEJ-UHFFFAOYSA-N	447.245	1.439	50	20	IDGD	
C[C@H]1CN(Cc2ccccc2NC(=O)C(=O)NNC(=O)Cc2ccncc2)C[C@H](C)O1	764354571	SZIWHCHHPHBIAJ-HOTGVXAUSA-N	425.489	1.019	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COCc2ccccc2)ccc1C(=O)NC(C)C	764366464	MFRXBOXLUUTUKQ-UHFFFAOYSA-N	426.473	1.436	50	20	IDGD	
O=C(NNC(=O)C(F)(F)Oc1ccccc1)C(=O)Nc1ccn(Cc2ccncc2)n1	764379571	FJLOJEFPQYYMKI-UHFFFAOYSA-N	430.371	1.084	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(Oc2ccc(Cl)cn2)cc1	764397177	GNVKYSNSONSLKX-LBPRGKRZSA-N	436.852	1.665	50	20	IDGD	
COc1cccc([C@H](O)C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)c1	764586510	VTVVXYKOZDRALU-IBGZPJMESA-N	447.513	1.364	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2cnn(-c3ncccc3C#N)c2)c1	764737831	GOCHMUMONMEAQE-UHFFFAOYSA-N	425.430	1.009	50	20	IDGD	
CCOc1cccc(NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)n1	765319914	COXOGELVYKOSIU-UHFFFAOYSA-N	433.490	1.731	50	20	IDGD	
CNS(=O)(=O)c1ccc([C@@H](C)NC(=O)NNc2ccccc2S(C)(=O)=O)cc1	765686394	PWRRYTKJDDIFQQ-GFCCVEGCSA-N	426.520	1.386	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)c1ccc([N+](=O)[O-])cc1	765755250	QPADVYRKGALYSZ-UHFFFAOYSA-N	431.880	1.827	50	20	IDGD	
O=C(CCSCc1ccccn1)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	766646155	FGSNCWSNOLGSOU-UHFFFAOYSA-N	441.557	1.310	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	766660756	RGJJPSQRRNUSMG-UHFFFAOYSA-N	445.951	1.726	50	20	IDGD	
COc1ccc(S(=O)(=O)CCC(=O)NNc2ccccc2S(C)(=O)=O)cc1OC	766669028	DUTRZUNTDWQVCQ-UHFFFAOYSA-N	442.515	1.414	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)c1cccc(N2CCCS2(=O)=O)c1	768645221	NYISQGQWHZPEFH-UHFFFAOYSA-N	439.515	1.396	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)[C@@H]1CCN(C(=O)OCc2ccccc2)C1	770703182	ZKLTYGVZESDHOQ-MRXNPFEDSA-N	434.493	1.707	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)N[C@@H]1CC(=O)N(c2c(F)cccc2F)C1	770844206	ZWQQUPFYTLOWLZ-LLVKDONJSA-N	436.440	1.898	50	20	IDGD	
CC(=O)Nc1cc(S(=O)(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)ccc1C	771606287	HDMGEKKCLYUEQF-UHFFFAOYSA-N	438.893	1.233	50	20	IDGD	
O=C(NNc1ccc2ccccc2n1)C(=O)Nc1cccc(S(=O)(=O)NC2CC2)c1	773655367	SAISYKQLHJDCKY-UHFFFAOYSA-N	425.470	1.757	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNS(=O)(=O)c1cnn(CC(F)(F)F)c1	775286620	AEBIGUGEAFIOCK-UHFFFAOYSA-N	429.421	1.060	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCCCC(=O)NNc2cccc(S(C)(=O)=O)c2)cc1C	776529287	FPSNPHSKAHAEOO-UHFFFAOYSA-N	439.559	1.909	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)[C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)c1	776534985	YIIQLKGERRPWGB-CYBMUJFWSA-N	438.487	1.808	50	20	IDGD	
Cc1ccc(I)cc1C(=O)NNC(=O)CNC(=O)OC(C)(C)C	778443240	NAQJLZZJTSHHOG-UHFFFAOYSA-N	433.246	1.885	50	20	IDGD	
CN1CCN(CCCNC(=O)NNC(=O)CNC(=O)OC(C)(C)C)[C@@H](c2ccccc2)C1	778616272	AOVGPBLNGBVEBB-GOSISDBHSA-N	448.568	1.220	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)N[C@H]1CCCC[C@H]1CNC(=O)OC(C)(C)C	778679564	BDRGHWIKYTXEDG-KBPBESRZSA-N	443.545	1.925	50	20	IDGD	
COC(=O)[C@H](c1ccc(Cl)cc1)N1CCN(S(=O)(=O)CBr)CC1	782415597	RMLOBEPPLGIRLY-ZDUSSCGKSA-N	425.732	1.854	50	20	IDGD	
Cc1cc(C)cc(NNC(=O)C(=O)Nc2cccc(S(=O)(=O)N3CCN(C)CC3)c2)c1	783355784	JEGVZEWPBPHYOY-UHFFFAOYSA-N	445.545	1.321	50	20	IDGD	
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)NNC(=O)C(F)(F)Oc1ccccc1	783830976	FPJDEKOZEKNWLN-UHFFFAOYSA-N	445.356	1.363	50	20	IDGD	
O=C(NNc1ccc(OC(F)F)cc1)C(=O)Nc1ccc(CN2C(=O)CNC2=O)cc1	784308018	KDCVLNDARNXALH-UHFFFAOYSA-N	433.371	1.422	50	20	IDGD	
O=C(NNc1ccc(Cl)nn1)C(=O)Nc1cc2c(cc1Br)OCCO2	784791840	CLLAKLRQZVHZMQ-UHFFFAOYSA-N	428.630	1.746	50	20	IDGD	
COCCn1ncc2ccc(NC(=O)C(=O)NNc3ccnc(Br)c3)cc21	784829174	YMPHOZJEMJDNPP-UHFFFAOYSA-N	433.266	1.922	50	20	IDGD	
CON(C)S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccccc2C(F)(F)F)cc1	784831523	SBDPDZUYEONWTA-UHFFFAOYSA-N	446.407	1.969	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)cc1F	784834954	DLPGGXUIXRONEE-UHFFFAOYSA-N	445.375	1.690	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)C(=O)Nc2ccc(N3CCOCC3)c(F)c2)c1	784840949	KWYWEVNYCAZPKE-UHFFFAOYSA-N	436.465	1.148	50	20	IDGD	
CN(C)c1nccc(NNC(=O)C(=O)Nc2ccc3c(c2)CCN3C(=O)OC(C)(C)C)n1	784971478	ZXBIXWIPDPVJJP-UHFFFAOYSA-N	441.492	1.922	50	20	IDGD	
O=C(COC(=O)[C@H]1[C@H]2CC[C@@H](O2)[C@@H]1C(F)(F)F)NNC(=O)c1cccc([N+](=O)[O-])c1	785809316	YQFLQIVNGCDAPY-RFHZTLPTSA-N	431.323	1.255	50	20	IDGD	
CN(C(=O)OC(C)(C)C)[C@H](C(=O)OCC(=O)NNC(=O)c1ccccc1)c1cnn(C)c1	786700161	RHRHLHSIWCADKZ-KRWDZBQOSA-N	445.476	1.333	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)cc1N1CCNC1=O	787549341	LWOXWYKQMHQRDI-UHFFFAOYSA-N	443.485	1.108	50	20	IDGD	
Cc1cc(F)cc(-n2cc(C(=O)NNC(=O)Nc3ccc(S(C)(=O)=O)cc3)nn2)c1	788764519	UJSFSBJCHGBSQO-UHFFFAOYSA-N	432.437	1.585	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)c3ccc(C)c(O)c3)CC2)cc1	789146509	ILVUAWVCRJNPPL-UHFFFAOYSA-N	431.514	1.871	50	20	IDGD	
CC(C)(C)OC(=O)N1CC2(C[C@@H]2C(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)C1	789286281	NKGZCMCUOXHCHC-CQSZACIVSA-N	437.880	1.901	50	20	IDGD	
CC[C@H]1CCc2nc(NC(=O)C(=O)NNC(=O)c3nnc(O)c4ccccc34)sc2C1	789731308	BJQBMLQNKSHJFD-JTQLQIEISA-N	440.485	1.707	50	20	IDGD	
COc1c(C)cnc(Cn2cnc(NC(=O)C(=O)NNc3ccccc3[N+](=O)[O-])n2)c1C	789745357	GXLOGDRZLSQEIN-UHFFFAOYSA-N	440.420	1.337	50	20	IDGD	
COC(=O)CCNC(=O)c1ccc(NC(=O)C(=O)NNc2ccc(Cl)c(OC)c2)cc1	789804958	TVFMBPXJONNQFN-UHFFFAOYSA-N	448.863	1.723	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)c2cnnn2-c2cccc(F)c2)c2ccccc2c1=O	789869449	VNAOPYNCVPJYQM-UHFFFAOYSA-N	435.419	1.772	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)[C@H]2[C@@H](C)CC(=O)C[C@H]2C(=O)NNc2nc(C)cc(C)n2)n1	791122568	AQFBOBIVOUDLMS-HKJPBSJPSA-N	440.508	1.318	50	20	IDGD	
Cc1ccn(C[C@@](C)(O)C(=O)NNC(=O)NCc2cccc(C(F)(F)F)c2)c(=O)c1	791129049	VHERBBJZTVOQAM-GOSISDBHSA-N	426.395	1.457	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)on2)cc(-n2cccn2)c1	792355027	NTAYKTGQCZWICM-UHFFFAOYSA-N	446.423	1.936	50	20	IDGD	
Cn1ccc2ccc(NC(=O)C(=O)NNC(=O)CCSc3ccc(F)cc3)cc2c1=O	793022285	TWEXNJVWFZTHQR-UHFFFAOYSA-N	442.472	1.946	50	20	IDGD	
C[C@](O)(CN1C(=O)NC2(CCCC2)C1=O)C(=O)NNc1ccc(C#N)c(C(F)(F)F)c1	793710992	TUDCYTMHWHGHJG-KRWDZBQOSA-N	439.394	1.636	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CC[C@@H]3[C@@H](CCN3C(=O)OC(C)(C)C)C2)n1	795126577	DJMISOSLVHXBFM-LSDHHAIUSA-N	437.566	1.473	50	20	IDGD	
COC(=O)c1c(CC(=O)NNc2ccccc2S(=O)(=O)N(C)C)[nH]c(C(C)=O)c1C	795169692	TVYBULNIHJHFGO-UHFFFAOYSA-N	436.490	1.248	50	20	IDGD	
Cc1ccc(S(=O)(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)cn1	795336937	XRHFZFLAMAICQZ-UHFFFAOYSA-N	437.953	1.171	50	20	IDGD	
COC(=O)[C@H]1CC[C@H](C(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)CC1	797940829	UMXHHQPUAOSQST-MXVIHJGJSA-N	430.549	1.239	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)CCC(=O)N2CCN(c3ncccn3)CC2)c2ccccc2n1	799008147	NOHWIBDLBCUQFL-UHFFFAOYSA-N	447.499	1.223	50	20	IDGD	
C[C@@H](c1ccccc1)N(C)C(=O)CN(C)CC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	800500282	QAXKUIQBEZDEQG-HNNXBMFYSA-N	427.461	1.507	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(I)c(O)c2)cc1	801110470	BZTHGWHLAWGIKE-UHFFFAOYSA-N	439.209	1.705	50	20	IDGD	
O=C(NNC(=O)C1=CC=CN2CCS(=O)(=O)N=C12)Nc1ccc(Br)cc1	801996310	BGXUXOZMZDIYIA-UHFFFAOYSA-N	440.279	1.099	50	20	IDGD	
O=C(NNC(=O)c1ccc2oc(O)nc2c1)c1cccc(S(=O)(=O)N2CCCC2)c1	805154605	PDRWYOYBUSZJLG-UHFFFAOYSA-N	430.442	1.393	50	20	IDGD	
COCCNC(=O)[C@@H](C)OC(=O)c1ccc(NC(=O)NNC(=O)c2scnc2C)cc1	806752736	KWWFRGVPJOTNOV-GFCCVEGCSA-N	449.489	1.226	50	20	IDGD	
COCCNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2ccc(C(C)(C)C)cc2)c1	806974415	KIMKXBVYVROTPJ-UHFFFAOYSA-N	440.500	1.760	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)c1sccc1S(=O)(=O)N1CCCCC1	807370053	UKFNMRAEQPVJIW-UHFFFAOYSA-N	433.552	1.473	50	20	IDGD	
Cc1cc([N+](=O)[O-])ccc1NNC(=O)C(=O)Nc1ccccc1C(=O)N1CCN(C)CC1	807458337	YRRMTTMMYBRPEX-UHFFFAOYSA-N	440.460	1.373	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNC(=O)NC2CCC3(CC2)NC(=O)NC3=O)cc1	807544792	CDXABXWVMCJAIF-UHFFFAOYSA-N	431.493	1.576	50	20	IDGD	
COc1cc(F)c(F)cc1NC(=O)C(=O)NNC(=O)CSc1ccccc1OC	810387224	LORCOTIBYMCORV-UHFFFAOYSA-N	425.413	1.860	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)[C@H]1CCN(c2ccccc2F)C1	810462459	RJYBLPCWUYKBSY-INIZCTEOSA-N	448.520	1.816	50	20	IDGD	
COc1ccc(C[C@](C)(O)CNC(=O)NNC(=O)c2c(C)nc3ccccn23)cc1OC	811851504	GNLZNJXWNUZWTQ-QFIPXVFZSA-N	441.488	1.598	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NC[C@@](C)(O)Cc2ccc(OC)c(OC)c2)c(OC)c1	811876784	VWKUAPUGOYWYRO-QFIPXVFZSA-N	447.488	1.659	50	20	IDGD	
Cc1cc(CNC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc(N2CCCC2)n1	811937448	DBUAESMVUWMKED-UHFFFAOYSA-N	431.518	1.538	50	20	IDGD	
O=C(NNC(=O)C1CCC(OC[C@H]2CCCO2)CC1)c1csc(N2CCOCC2)n1	814736952	XTQQFESIMDRXPI-UYSNPLJNSA-N	438.550	1.495	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc(F)cc2Br)cn2ccnc12	815567767	LGWKTNSFZHENHX-UHFFFAOYSA-N	434.225	1.944	50	20	IDGD	
CCOC(=O)c1nc(NC(=O)C(=O)NNC(=O)[C@H](CC)c2ccccc2)sc1C(C)=O	815569674	CFCNWJSCTOAFSW-CYBMUJFWSA-N	446.485	1.802	50	20	IDGD	
O=C(NNc1ncncc1F)C(=O)Nc1cc(F)c(I)c(F)c1	815765880	HDDWBGFDOSTGEC-UHFFFAOYSA-N	437.119	1.580	50	20	IDGD	
Cc1nnnn1[C@@H](Cc1ccc(F)cc1)C(=O)NNc1ccccc1S(=O)(=O)N(C)C	817053714	CYKFMJWBZGJDFT-KRWDZBQOSA-N	447.496	1.298	50	20	IDGD	
COC(=O)c1c(F)cccc1NNC(=O)[C@@H](NS(=O)(=O)c1ccc(C)cc1)[C@@H](C)O	819710279	DREOXNFNFLXQPN-PXAZEXFGSA-N	439.465	1.092	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)[C@H]2CCCN(S(=O)(=O)c3ccccc3)C2)cc1	915060810	ZFTIDFHDTJGZDD-KRWDZBQOSA-N	431.514	1.622	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)Cc2nc3ncccn3n2)cc(OCC)c1OCC	915806552	OXCXSTMJIIEFAX-UHFFFAOYSA-N	428.449	1.324	50	20	IDGD	
O=C(NCCOc1ccccc1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	915894506	BRMHJFCIARLPKC-UHFFFAOYSA-N	432.502	1.494	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNC(=O)NC2CCN(S(C)(=O)=O)CC2)cc1	916237764	JMKQCQVSPPBELU-UHFFFAOYSA-N	426.539	1.480	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)NCCNS(=O)(=O)Cc2ccccc2)c1	916517206	YSBAPEMFBNOQJC-UHFFFAOYSA-N	434.518	1.132	50	20	IDGD	
O=C(NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)N[C@@H]1CCN2CCC[C@H]2C1	916574197	WZFAHGVQHJDICX-SJORKVTESA-N	435.550	1.042	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1csc(N2CCOCC2)n1)c1ccc2c(c1)CC(=O)N2	916649104	IMMPPHPZCGOCGL-LLVKDONJSA-N	430.490	1.180	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)CSCC(=O)Nc3cc(C)on3)n[nH]2)cc1	917175705	JDHSIFATOBWROC-UHFFFAOYSA-N	428.474	1.814	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)c2ccc(F)cc2Br)cc1C(=O)O	917754017	WGRLGMAGDKSBAV-UHFFFAOYSA-N	447.238	1.918	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)[C@H](C)NS(=O)(=O)c2cccs2)cc1OC	917924667	GKBIYAFBNIJWNV-NSHDSACASA-N	427.504	1.283	50	20	IDGD	
C[C@@H](CN1CCCC1=O)NC(=O)NNC(=O)[C@@H](C)Oc1cccc(Br)c1	918099845	BZBCKURQXFLOKX-NWDGAFQWSA-N	427.299	1.558	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)NC[C@@H]3CCCO3)cc2)c(O)c1	918337113	BWVGXAWQXHFWJX-HNNXBMFYSA-N	433.486	1.233	50	20	IDGD	
C[C@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)NNC(=O)c2ccc(Cl)cc2O)C1=O	918358921	DKMYDMPGCDFQQB-LJQANCHMSA-N	434.811	1.413	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)c3cccc(CN4C(=O)CNC4=O)c3)n[nH]2)cc1	918695394	WLYXHXHUBGLGPU-UHFFFAOYSA-N	432.440	1.512	50	20	IDGD	
Cc1c(CC(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)nnn1-c1ccccc1	919609434	ILPJDDVYHICOHJ-UHFFFAOYSA-N	427.848	1.776	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)c2sccc2S(=O)(=O)N2CCCCC2)c1O	919755731	YAXCGGHZCXLRGV-UHFFFAOYSA-N	439.515	1.712	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)c1cc([N+](=O)[O-])cc(S(C)(=O)=O)c1	920287765	KGKZQEYXVILVSI-JTQLQIEISA-N	425.394	1.366	50	20	IDGD	
CC(=NNC(=O)c1cc(S(=O)(=O)NCc2ccccc2)ccc1O)c1cnn(C)c1	920827136	JHSWPVBQJWJHCH-UHFFFAOYSA-N	427.486	1.758	50	20	IDGD	
C[C@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)c1ccc(CSc2nncn2C)cc1	921299290	NYYYOQBTSFCJDJ-LBPRGKRZSA-N	434.522	1.782	50	20	IDGD	
COC(=O)c1cc(C(=O)OCC(=O)NNC(=O)c2cccs2)n(-c2ccccc2)n1	1318273794	FFJNTDYVIUPTBR-UHFFFAOYSA-N	428.426	1.338	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)N[C@@H]2CCC[C@@H](S(C)(=O)=O)C2)CC1	1318801337	RWQJJBJJSVGODI-HUUCEWRRSA-N	446.570	1.320	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4cnccc4c3)C2)C1	1777862794	KPYMMTSFDDMVSZ-HSZRJFAPSA-N	439.516	1.051	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H]3Cc4ccccc4O3)C2)C1	1778249577	UXRFAWFVDVSYNU-RIFZZMRRSA-N	437.334	1.994	50	20	IDGD	
C[C@@H](Nc1ccccn1)C(=O)N1CC[C@@]2(CN(C(=O)CCBr)CCO2)C1	1779321739	OHAHENNRMASNQY-RDTXWAMCSA-N	425.327	1.497	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CC(F)(F)C(=O)O)C2	1780711509	GONBEJSALYMNTH-HFBAOOFYSA-N	445.290	1.847	50	20	IDGD	
CC(C)c1ccc(C(=O)N2CC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)cc1	1780760626	MLSSXUOTAVRDJE-DEOSSOPVSA-N	436.317	1.247	50	20	IDGD	
Nc1ncc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](F)Br)C2)s1	1780771470	IRAXLEOWBDHCCA-UEKVPHQBSA-N	435.319	1.543	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H]3CCN3C(=O)OC(C)(C)C)C2)C1	1781016831	IHEBZVPARNZKHI-MDOVXXIYSA-N	429.945	1.843	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C=C(\C)NC(C)=O)C2	1781904920	FJEWZHKHVVOMQG-OICGPCSFSA-N	444.370	1.714	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnc(OC)c(F)c1)C2	1782171302	ZCFLDXRKVAZCJE-YYFZDKIDSA-N	443.903	1.611	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1n[nH]c3c1CC[C@H]3C)C2	1782172861	OXCLEPTWLLOBEJ-CRKCHWSSSA-N	438.956	1.841	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)n2cccn2)C1	1782555038	SCEBZQUQLYJFDM-YYAJDYIMSA-N	441.370	1.989	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cnccc3N(C)C)CCO2)C1	1783532923	UCGOFSIPMNBXNE-ACJLOTCBSA-N	425.327	1.375	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cc4ncsc4[nH]3)CCO2)C1	1783538660	VHHOTYITSSCPJI-QLJPJBMISA-N	427.324	1.851	50	20	IDGD	
Cc1noc(C)c1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]2C1	1783968245	RWZRCMUUUAKQBL-HJPIBITLSA-N	428.327	1.916	50	20	IDGD	
CC(=O)NCC(C)(C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)CBr)C[C@@H]21	1784640314	CDTMRTKAYBOCGF-OEAJRASXSA-N	446.386	1.159	50	20	IDGD	
O=C(Cc1cccnc1Cl)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21	1785166820	LQWNOGSDBPJACB-ABHRYQDASA-N	448.720	1.948	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cn3cc(Cl)cn3)[C@H]2C1	1787002103	XOJKJVMNFASHPO-JURCDPSOSA-N	447.761	1.547	50	20	IDGD	
O=C(NC1(c2ccc(NC(=O)c3cc(=O)cco3)cc2)CCC1)c1cccc(B(O)O)c1	1787592321	IFXBMTGMBMXJKX-UHFFFAOYSA-N	432.241	1.381	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CC[S@](=O)CC)[C@H]2C1	1788490372	BPSFLEPAIQSSBH-DCTMNQNWSA-N	437.400	1.298	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)Nc3ccccn3)[C@H]2C1	1788783332	QNJOYAXIKZCNLO-QRJUGERDSA-N	439.354	1.645	50	20	IDGD	
Cc1nc(F)ccc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21	1789063213	ZJWIKZUQGCQDHE-GZCFXPHUSA-N	432.265	1.813	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cncc4cnccc34)[C@H]2C1	1789173022	JSIFPLDSASWABD-VKOGCVSHSA-N	432.908	1.477	50	20	IDGD	
Cc1n[nH]cc1C(=O)NC1(c2ccc(NC(=O)c3cnccc3C(=O)NN)cc2)CCC1	1789521024	KFYWWRQSTCSGLL-UHFFFAOYSA-N	433.472	1.778	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1ccc(C2(NC(=O)CC3(O)CCC3)CCC2)cc1	1789523543	GUZVWUFSLYJHKJ-UHFFFAOYSA-N	437.500	1.738	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C#CC3(O)CCCCC3)C[C@@H]21	1789870797	WSJNHHQGAJEJFX-BOSXTWCSSA-N	445.387	1.901	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc4c3NC(=O)C4)[C@H]2C1	1790448540	DPZOTYKHBVYSQM-LLLHUVSDSA-N	435.908	1.028	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CCCCN3C)C[C@@H]21	1790958566	VFQYHYYOANWIBC-WOYTXXSLSA-N	430.387	1.624	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(CO)c(F)c3)[C@H]2C1	1792092524	FCQAZGJTXKSAQI-CUSZFKRNSA-N	428.888	1.165	50	20	IDGD	
O=C(COc1ccc(O)cc1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2	1792778070	NULLRLAUFYGIRA-OXUXUCFPSA-N	431.258	1.051	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(C)(C)Cc1ccccc1	1792878346	XHJCUKIQVMZYOP-HATOLVCRSA-N	444.576	1.218	50	20	IDGD	
O=C(/C=C/c1ccc([N+](=O)[O-])o1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2	1793108507	AGFUGLGGFOYRDF-PNKBIWGBSA-N	446.229	1.481	50	20	IDGD	
COC(=O)[C@H]1CC[C@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)Br)C3)CC1	1793609344	NOZRJQHFYUBEJA-SDSMMKDESA-N	445.354	1.339	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cccnc1Cl	1793954668	FXHFRBXIOMDRGV-IKVITTDRSA-N	430.730	1.651	50	20	IDGD	
CC(C)Cc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CO[Si](C)(C)C)C3)n(C)n1	1796017373	QPBAFMPFIZPQRQ-CWPLJXCYSA-N	436.629	1.673	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1(c3ccc(F)cc3)CC1)C2	1796187743	BBXUAZKWTZNNOE-WKCHPHFGSA-N	436.292	1.489	50	20	IDGD	
O=C(Cc1ccc(F)c(F)c1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1	1796191172	HBDPLIPGBPJYNC-BCDXTJNWSA-N	428.244	1.139	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(N2CCCC2)ccn1	1796583899	KPAMPVSUFMGZTD-LORHWOILSA-N	436.940	1.139	50	20	IDGD	
COC[C@H](NC(=O)OC(C)(C)C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C(Cl)Cl)C2	1796844214	YJLHLPYASGHPHW-RNJOBUHISA-N	438.352	1.968	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1nc(O)n2c1CCCC2)[C@@H](F)Br	1798660717	SGMAXZDFBJBHEQ-FBKDDSFISA-N	429.290	1.867	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CNc3ccccc31)C2)[C@@H](F)Br	1799346445	QRHUIOXBVFQNEM-VUBORPHZSA-N	426.286	1.476	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1n[nH]c2ccc(C#N)cc12	1799885629	UMJNGJVSRJGVQZ-VFFTVRQLSA-N	446.305	1.421	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C)=C/c1ccc(OC)cc1	1800295842	HUUXTXLPJXMVKF-DPVLJBQWSA-N	436.936	1.942	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(=O)c1ccc(Cl)cc1)C2	1800754366	MREOMNKDXRCBHU-IKVITTDRSA-N	443.725	1.896	50	20	IDGD	
COc1cc(C)ccc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)Br	1800762469	BVFVCFIZRBZULD-VWPFQQQWSA-N	425.323	1.990	50	20	IDGD	
Cc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)CBr)C3)c(O)c1	1801688968	ZPHZXUCPVVYCNN-VWPFQQQWSA-N	425.323	1.935	50	20	IDGD	
Cc1ccc(=O)n(C(C)(C)C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](C)Br)n1	1801963421	JMFPYECWMWKJGE-APIJFGDWSA-N	439.354	1.708	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H]1CC(=O)N(Cc3ccccc3)C1)C2	1802269474	GQPMPWRZJABMAA-OUUBHVDSSA-N	447.963	1.927	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)[C@@H]2CC=CCC2)[C@H]1c1cccnc1	1803029715	ZBZSHTYDUZRINX-PLMTUMEDSA-N	448.527	1.756	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@H](CNC(=O)CN2CCOC2=O)[C@H]1c1cccnc1	1803337167	NCBAPFLAKOHCQU-GMBSWORKSA-N	443.331	1.776	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)[C@@H](C)CS(C)(=O)=O)[C@H]1c1cccnc1	1803586833	FHKDOPDUYVSEAL-PQEBFOHHSA-N	429.970	1.786	50	20	IDGD	
Cc1ccc(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)o1	1803779107	IQUPDIYUYFMRED-WIYYLYMNSA-N	433.273	1.296	50	20	IDGD	
CC(=O)NC(C)(C)C(=O)N1CC[C@H](CNC(=O)[C@@H](F)Br)[C@H]1c1cccnc1	1808649056	IZSOEYAFKGOYNZ-RBSFLKMASA-N	443.317	1.693	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)[C@@H](C)Cn2cncn2)[C@@H]1c1cccnc1	1810479872	HQUZIUZCEHRENY-RANZSIQMSA-N	434.928	1.269	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)Cn2cncn2)[C@H]1c1cccnc1	1812776855	OAAHKVXKBCSQTK-ZOBUZTSGSA-N	435.326	1.553	50	20	IDGD	
CN1CCN(CCC(=O)Nc2nc3c(s2)C[C@H](NC(=O)C(C)(C)CCl)CC3)CC1	1814575722	ZDUQVWUDGNJRKI-CQSZACIVSA-N	442.029	1.958	50	20	IDGD	
CC(C)(CCl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(=O)n3[nH]nnc3n2)[nH]n1	1814693893	IJVBROYGJCVAJO-LBPRGKRZSA-N	447.887	1.107	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CN2CC(=O)NC2=O)n[nH]1	1815668304	YCGBSWUBPZAQLD-APPDUMDISA-N	445.307	1.190	50	20	IDGD	
CN[C@H](CC(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCBr)n[nH]1)C(=O)O	1816781969	JLEDXYKTBKVAOZ-VXGBXAGGSA-N	430.303	1.250	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](N)CCC(N)=O)n[nH]1	1817248835	FFJATBQHYRAIJO-BFCNOCSMSA-N	433.340	1.231	50	20	IDGD	
Cc1cccc(CC(=O)N2CCCC[C@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)c1	1817471078	DPSJJPBHGBRRBG-NRFANRHFSA-N	446.316	1.947	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)C(F)(F)Cl)[nH]n1)c1ccc(B(O)O)cc1	1817475479	PLCXIKMYSPAGIN-ZDUSSCGKSA-N	426.616	1.227	50	20	IDGD	
C[Si](C)(C)OCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H]1CCCS1(=O)=O)CC2	1820169670	REYLJYZJBBWCEN-RISCZKNCSA-N	445.639	1.484	50	20	IDGD	
C[C@H](Br)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)n2)[nH]n1	1822187651	YLKVMANNRUUECI-KWQFWETISA-N	439.270	1.700	50	20	IDGD	
C=CCOCCCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1	1824499035	FFJHQJWYTBASLC-QFIPXVFZSA-N	442.365	1.583	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)CSCC(=O)OC)CC1	1824518137	YUAUGSTVICPFEE-HZPDHXFCSA-N	434.986	1.766	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)CCc2ccccn2)CC1	1825331431	VXZIADVRUJPQEV-HSZRJFAPSA-N	449.360	1.628	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)Cn1nc(C)cc1C)CC2	1825994730	YHCSMUCKKVNSGP-STQMWFEESA-N	425.942	1.822	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)/C=C\C(=O)NC1CC1)CC2	1826000512	UWMBZSGLXPYYQL-QHDQMSKJSA-N	426.926	1.144	50	20	IDGD	
Cc1nc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)co1	1827055946	KTYPJIIDQYRLHB-HXUWFJFHSA-N	425.294	1.210	50	20	IDGD	
C[C@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)CCS(C)(=O)=O)sc2C1	1827215495	ZWTQLBLXDNDFBY-IUCAKERBSA-N	438.369	1.273	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cnncc2C(=O)O)CC1	1829254670	JLGHYHVOOJUNFI-IRXDYDNUSA-N	438.912	1.662	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CCC(F)(F)C1)CCO2	1829653686	DWXVALHROPVXBB-QAPCUYQASA-N	434.556	1.730	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C13CC(F)(C1)C3)CCO2	1831580930	VOPSWCQFXLFGGY-HELAGCTPSA-N	433.318	1.366	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCc2cn[nH]c2)CC1	1831871256	PXKCBTLOZSXPIJ-LJQANCHMSA-N	432.569	1.335	50	20	IDGD	
O=C(Cc1ccc(F)cc1Cl)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1	1832273895	GUHVMEVGNCJRNC-QFBILLFUSA-N	449.306	1.078	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3cncc(OC)c3)CCO2)C1	1832916269	MMUNNOSRVGUCQG-WIYYLYMNSA-N	439.940	1.497	50	20	IDGD	
Cc1nc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)cs1	1832963073	LRFNNAHPORJOFQ-IBGZPJMESA-N	429.970	1.715	50	20	IDGD	
Cc1cnc(C(=O)NC2CCN(C3CCN(C(=O)[C@H](F)Br)CC3)CC2)cn1	1834162626	CHBZCUCKOMYLJR-INIZCTEOSA-N	442.333	1.661	50	20	IDGD	
COCCn1ccc(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](F)Cl)CC3)CC2)n1	1835185128	KIYFIKDXDUKSKV-QGZVFWFLSA-N	429.924	1.249	50	20	IDGD	
COCC1(C(=O)N2CCC(N3CCC(NC(=O)[C@@H](F)Br)CC3)CC2)CC1	1836413335	BZPXFOLOPBMTEF-OAHLLOKOSA-N	434.350	1.675	50	20	IDGD	
CCC1(C(=O)N2CCC(N3CCC(NC(=O)[C@H](F)Br)CC3)CC2)COC1	1836413979	SKIZRTASSWLRGR-HNNXBMFYSA-N	434.350	1.675	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)CCc3cnc[nH]3)CC2)CC1)[C@@H](F)Br	1836414215	YWHQDSKDXCZLBQ-QGZVFWFLSA-N	444.349	1.604	50	20	IDGD	
O=C(c1cc[nH]c2nccc1-2)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1836440436	DQSQUZCSNABQQT-SFHVURJKSA-N	427.288	1.388	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cccn3cncc13)CCO2	1837112525	FUCHBBSLVXMOHI-NRFANRHFSA-N	446.580	1.256	50	20	IDGD	
O=C(c1ncccn1)N1CCC(OC2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1837504011	IRBRGUBWKDMDAS-CQSZACIVSA-N	429.290	1.779	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCC(OC2CCN(C(=O)COCCO)CC2)CC1	1838638241	DDMVMQUVCIHIQP-SFHVURJKSA-N	425.353	1.230	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)COc3ccc(OC)cc3)C2)C1	1839141187	AEPFNVRHQHOVQU-NQIIRXRSSA-N	440.924	1.548	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)n3cccc3C=O)C2)C1	1839143721	GMSQJNWNIRXWIC-SYNHAJSKSA-N	425.913	1.335	50	20	IDGD	
CC(C)(C)[C@H](O)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2	1839150386	KYBUNEQMRGFTBE-JEBQAFNWSA-N	425.353	1.086	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccn4nccc34)CCO2)C1	1839538188	XNBOCDXPEXRCNP-UWJYYQICSA-N	434.924	1.812	50	20	IDGD	
CCN(CC)C[C@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)Br)C2)C1	1839680035	VVQTVTOFSFCYLO-BXWFABGCSA-N	448.402	1.204	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1839961715	GHQCQBMIOVHGFB-CXAGYDPISA-N	439.778	1.881	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)/C=C/c3ccco3)C2)C1	1839962830	RZAWHCKWZUYEHA-KCVJVMPHSA-N	441.322	1.923	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCN3CCCCC3)C2)C1	1840032075	NFOKCMINXMDTNK-QFBILLFUSA-N	446.386	1.102	50	20	IDGD	
O=C(c1ccc2c(c1)COC2)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840188676	WTIJPIKVSZJOMA-LJQANCHMSA-N	429.300	1.591	50	20	IDGD	
CSc1ccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)cc1	1840302052	RXCJRBUGVYRDLJ-XLIONFOSSA-N	442.965	1.007	50	20	IDGD	
COC1(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)CCC1	1840617263	TXQAJPBASSOWCF-PKOBYXMFSA-N	437.364	1.638	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)C2CCC(C(F)(F)F)CC2)C1	1841798189	IDLVKBQQPSLKKZ-UHFFFAOYSA-N	438.255	1.552	50	20	IDGD	
CCCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)[C@H](O)CCl)C2	1841922525	ZZTARHNMQASMHD-LSDHHAIUSA-N	431.961	1.873	50	20	IDGD	
Cc1nocc1C(=O)N1CCCC12CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2	1842494215	ICCZNOBPJKTPMU-UHFFFAOYSA-N	440.504	1.146	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@H]2C[C@H](O)CN2C(=O)OC(C)(C)C)C1	1843104190	XYLJBJKWUSDLEX-XHSDSOJGSA-N	443.972	1.968	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1nc(C)c(C)s1)C2	1843416478	PHUAWGIXHHWYAW-YDZHTSKRSA-N	428.518	1.711	50	20	IDGD	
CC(C)(C)c1cc(C(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)ccn1	1844263683	IKAJTPAOQMXSSS-UHFFFAOYSA-N	436.516	1.508	50	20	IDGD	
Cc1ccc(/C=C/C(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)s1	1844265179	CDCYGWAWIZIZAQ-AATRIKPKSA-N	425.514	1.585	50	20	IDGD	
O=C([C@@H](F)Br)N1CC2(CCCN2C(=O)c2ccc(OCCCO)cc2)C1	1844705828	RDJYVCOAGGFTDI-OAHLLOKOSA-N	429.286	1.955	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC2(CCCN2C(=O)Cc2cn3c(nc2=O)SCC3)C1	1845022750	PKPAOSHTAJKWMP-KRWDZBQOSA-N	445.372	1.331	50	20	IDGD	
COc1cc(Cl)cc(C(=O)N2CCCC23CN(C(=O)c2ccc(B(O)O)cc2)C3)c1	1846855003	WWAGAHKXAGSAMD-UHFFFAOYSA-N	428.681	1.159	50	20	IDGD	
Cc1cc(Cl)ccc1OCCCC(=O)NNC(=O)Cn1c(=O)[nH]c(=O)c2ccccc21	10290937	YIFRDTCVTODMCE-UHFFFAOYSA-N	444.875	1.658	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@@H]2CC(=O)Nc3cc(F)ccc32)cc1	10471372	DCAUYYVRDYANTI-MRXNPFEDSA-N	448.476	1.028	50	20	IDGD	
COc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NNC(=O)CSc2ccc(C)cc2)cc1	12673935	QRIQSLNMSVUYES-AWEZNQCLSA-N	437.543	1.610	50	20	IDGD	
O=C(NNC(=O)c1sccc1S(=O)(=O)N1CCCCC1)c1cccc([N+](=O)[O-])c1	14049448	UCSXBAHJAPXRPS-UHFFFAOYSA-N	438.487	1.906	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(Cl)cc2[N+](=O)[O-])c1	15896041	ZLYVCMAIYKZKLH-UHFFFAOYSA-N	426.838	1.573	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)CCCNC(=O)C(C)(C)C)c1	25432457	DKKMSJMUAXGXKM-UHFFFAOYSA-N	440.566	1.421	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCN(C(=O)c3cc4ccccc4[nH]3)CC2)n1	110193389	XCMJWHOPHDXOQQ-UHFFFAOYSA-N	440.529	1.081	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NN(C)C(=S)NCCCOC)ccc1F	726076110	MWARRLPDBKPBFP-UHFFFAOYSA-N	434.559	1.344	50	20	IDGD	
O=C(CN1c2cccc3cccc(c23)S1(=O)=O)NNC(=S)NCCc1ccccn1	726123035	CZVIMHOEADJREV-UHFFFAOYSA-N	441.538	1.482	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)N[C@H]1C[C@H]1c1cccc(Br)c1	726609768	CVXBGAHFMUPVBA-HOTGVXAUSA-N	442.277	1.925	50	20	IDGD	
CCOC(=O)c1sc2ncc(S(=O)(=O)NNC(=O)NCCCOC)cc2c1C	726766798	MEVHPVDHOKFUNE-UHFFFAOYSA-N	430.508	1.310	50	20	IDGD	
CN(C)CCCOc1ccc(CNC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1	728602613	JDZPYIJPGLPYHN-FQEVSTJZSA-N	428.489	1.688	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	728755071	WCXIARWYJLSZRV-SFHVURJKSA-N	441.488	1.869	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)Cc1c(C)nc2c(c(O)nn2C)c1C	729283088	NPIFXDCLVSDHCT-UHFFFAOYSA-N	427.461	1.458	50	20	IDGD	
O=C(/C=C/c1cncc(F)c1)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	729295133	CIAGPQDOJQZASJ-BQYQJAHWSA-N	432.477	1.870	50	20	IDGD	
O=C(COC(=O)c1csc(-c2ccoc2)n1)NNC(=O)[C@@H]1COc2ccccc2O1	731090807	IRRFHKCYGDKXFP-HNNXBMFYSA-N	429.410	1.547	50	20	IDGD	
CCn1c(S)nnc1CCNC(=O)CCC(=O)C(C#N)=C1N(C)c2ccccc2N1C	731442924	OPULYLRETYNKAE-UHFFFAOYSA-N	439.545	1.916	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)sc(C)c1C	731880349	KYCLLHRZUXIPKG-CQSZACIVSA-N	431.470	1.631	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2CCCCN2C)c1	732259186	NWOKZZJLKYXTIE-SFHVURJKSA-N	446.529	1.741	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2nn(-c3ccc(F)c(F)c3)c3c2CCC3)C[C@H](C)O1	732259757	JSLWEGKZSWQQJU-KBPBESRZSA-N	447.486	1.900	50	20	IDGD	
O=C(CN1C(=O)Cn2c(cc3ccccc32)C1=O)NNC(=O)c1cnn(-c2ccccc2)c1	733169974	KVSUIAGJMREEQF-UHFFFAOYSA-N	442.435	1.271	50	20	IDGD	
C[C@@H](CS(C)(=O)=O)NC(=O)NNC(=O)CCCOc1ccc(Cl)cc1Cl	733662916	QYANUXPDIAIDFL-JTQLQIEISA-N	426.322	1.916	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2ccc(-n3cccc3)cc2)CC1	735117225	DGVGUYOIGUWDAI-UHFFFAOYSA-N	440.529	1.565	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2cccc3c2ccn3C)CC1	735117294	PEWODJABZSPFJL-UHFFFAOYSA-N	428.518	1.266	50	20	IDGD	
Cn1cc(S(=O)(=O)N2CCCCC2)cc1C(=O)NNC(=O)COCc1ccccc1	737636392	MIVWTBXDHLCREI-UHFFFAOYSA-N	434.518	1.178	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)CSc1nnc(C)n1-c1cccc(OC)c1	740851342	ZQPAVAMNPRFHSY-UHFFFAOYSA-N	434.522	1.129	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1cccc(N(C)C)c1)[C@H]1CN(Cc2ccccc2)CCO1	741282479	PSPUHWCHBOIVKL-DYESRHJHSA-N	425.533	1.986	50	20	IDGD	
Cc1nn([C@@H]2CCS(=O)(=O)C2)c(Cl)c1C=NNC(=O)c1cc([N+](=O)[O-])ccc1O	741770797	JJQYJWGZLHWOGG-LLVKDONJSA-N	441.853	1.582	50	20	IDGD	
Cc1nn([C@H]2CCS(=O)(=O)C2)c(Cl)c1C=NNC(=O)c1cc([N+](=O)[O-])ccc1O	741770811	JJQYJWGZLHWOGG-NSHDSACASA-N	441.853	1.582	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNS(=O)(=O)c3cccc(-c4nnnn4C)c3)cc2C1	742025409	GGYFDBGKQRSBSX-LLVKDONJSA-N	432.531	1.687	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C[C@@H](C)/N=C2/NS(=O)(=O)c3ccccc32)cc1	742477536	QKOMDSOEFWUIFJ-CQSZACIVSA-N	430.486	1.039	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=S)N[C@@H]2CCc3ccccc3C2)cc1	742976131	UGUPQEFQUAPWOY-GOSISDBHSA-N	446.598	1.668	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)N[C@H](C)COCC(F)(F)F)nc1	743340752	AUHFPKPOOSFRGG-LLVKDONJSA-N	427.449	1.706	50	20	IDGD	
CCNC(=O)COc1cccc(CNC(=O)NNC(=O)Nc2ccc(N(C)C)cc2)c1	743542146	JRGZGFLZYVXHPB-UHFFFAOYSA-N	428.493	1.803	50	20	IDGD	
CC(=O)c1cccc(O[C@@H](C)C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)c1	745107407	BIZIDRMQFAECJY-AWEZNQCLSA-N	432.502	1.719	50	20	IDGD	
O=C(COC(=O)c1ccc(C[C@H]2CC(=O)NC2=O)cc1)NNC(=O)c1ccc(Cl)cc1	745108879	XEZGWNXSPPEBJR-HNNXBMFYSA-N	443.843	1.163	50	20	IDGD	
CS(=O)(=O)c1cccc([C@H](NC(=O)NNC(=O)C(=O)N2CCCC2)c2ccccc2)c1	745908143	WPFYQFGNFPJZCA-GOSISDBHSA-N	444.513	1.132	50	20	IDGD	
Cc1nc(-c2ccc(C(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)cc2)n[nH]1	746094232	SXJQZLOACMUDFF-UHFFFAOYSA-N	428.474	1.105	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2ccc(N=c3cc[nH]cc3)cc2)ccc1Cl	746097247	DLTYBUXYMDINRQ-UHFFFAOYSA-N	445.888	1.623	50	20	IDGD	
CC(C)NC(=O)C(=O)NNS(=O)(=O)c1cc(Br)cc(C(F)(F)F)c1	746592369	WXUYBXWAAUMNBH-UHFFFAOYSA-N	432.218	1.302	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN1Cc1ccc(F)cc1)c1csc(N2CCOCC2)n1	747200454	WROWDSLKUSLTNG-QGZVFWFLSA-N	433.509	1.544	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)NCc1cc(Br)c(OC)c(OC)c1	748625528	SIQWNNHZIQWRRN-SNVBAGLBSA-N	434.287	1.348	50	20	IDGD	
COc1ccc(S(=O)(=O)NCCC(=O)NNc2cccc([N+](=O)[O-])c2C)cc1OC	748660427	ICIKPYNQZKVGEB-UHFFFAOYSA-N	438.462	1.732	50	20	IDGD	
NS(=O)(=O)Cc1ccc(C(=O)NNC(=O)c2ccc(F)cc2Br)cc1	748839487	ZQAOHSLXWMICPH-UHFFFAOYSA-N	430.255	1.452	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)CNC(=O)OC(C)(C)C	749870728	KNAHMBBUBBCSPY-GFCCVEGCSA-N	443.526	1.587	50	20	IDGD	
O=C(CNC(=O)c1ccc2c(c1)OCO2)NNc1nc(Br)cn2ccnc12	750243982	SEJZFDHBTQRBPU-UHFFFAOYSA-N	433.222	1.094	50	20	IDGD	
Cc1nn(C)c2nc(-c3ccccc3)cc(C(=O)NNC(=O)CNC(=O)c3ccco3)c12	751204780	OZSXZLBOFOUDHB-UHFFFAOYSA-N	432.440	1.728	50	20	IDGD	
CS(=O)(=O)N1CCN(c2ccc(NC(=O)/C(C#N)=C/c3ccc(F)cc3)cn2)CC1	752302740	LJOUTFGCGQLNNU-FOWTUZBSSA-N	429.477	1.848	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)[C@@H](c1ccccc1)N1CCC(O)CC1	752387576	CWWDTYCIHXSNPJ-QGZVFWFLSA-N	435.525	1.040	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)c3ccc(C)o3)CC2)cc1	752777609	NWKCXXWNZNFXJG-UHFFFAOYSA-N	433.486	1.653	50	20	IDGD	
Nc1nc(Cl)cc(NNC(=O)C2CCN(S(=O)(=O)/C=C\c3ccccc3)CC2)n1	753454554	IEKOLKQGEWKGQU-FLIBITNWSA-N	436.925	1.868	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@@H]2[C@H]3CCO[C@H]3C23CCCC3)c2ccccc2c1=O	755076946	DIJKBTXJUMVAQX-KBAYOESNSA-N	425.489	1.708	50	20	IDGD	
O=C(Cc1cc[nH]n1)NNC(=O)c1cccc(Br)c1I	755269522	RXLPFZQMMFZBGI-UHFFFAOYSA-N	449.046	1.781	50	20	IDGD	
C[C@H](C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)[C@@H](C)NC(=O)OC(C)(C)C	755314804	ZTEXJUYPIRDURV-ZWKOTPCHSA-N	447.580	1.895	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NN=Cc2cnc(N3CCOCC3)s2)cc1	755518997	GQISSTMPHPURTF-UHFFFAOYSA-N	437.547	1.059	50	20	IDGD	
C[C@@H]1C[C@@H](C)CC2(C1)NC(=O)N(CC(=O)NNC(=O)Cc1nc3ccccc3n1C)C2=O	756863252	IWVHZHQFTKLUQL-ZIAGYGMSSA-N	440.504	1.010	50	20	IDGD	
CN(c1ccccc1NC(=O)NNC(=O)COc1ccccc1[N+](=O)[O-])S(C)(=O)=O	757660691	HHOWDOPSFUBDPP-UHFFFAOYSA-N	437.434	1.222	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)[C@]1(Cc2ccc(Cl)cc2)C[C@H]2CC[C@H]1C2	758048800	WSJJIERWNRIULZ-VFSPDHHESA-N	427.954	1.774	50	20	IDGD	
NC(=O)[C@H](Cc1ccccc1)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	758143542	OAAHDLGTFAXIOJ-KRWDZBQOSA-N	444.538	1.880	50	20	IDGD	
CS(=O)(=O)N1CCc2c(NC(=O)NNC(=O)COc3ccc(Cl)cc3)cccc21	758300972	RHVUYMJNPNPIIE-UHFFFAOYSA-N	438.893	1.894	50	20	IDGD	
Cc1cc(Br)oc1C(=O)N1CCN(S(=O)(=O)CBr)CC1	758528616	WRGFEULEIWKQQG-UHFFFAOYSA-N	430.118	1.791	50	20	IDGD	
CN1CCC(=NNC(=O)CN(Cc2ccccc2)S(=O)(=O)c2ccc(Cl)cc2)C1=O	761749411	QCDDNIMBVFOJKV-UHFFFAOYSA-N	448.932	1.865	50	20	IDGD	
O=C(COc1ccc(Br)cc1F)NNc1nccc(N2CCOCC2)n1	762863186	ZHDUMDADTNNCQV-UHFFFAOYSA-N	426.246	1.737	50	20	IDGD	
O=C(NNC(=O)c1ccccc1Br)C(=O)Nc1cnn(-c2ccccn2)c1	763483432	SGCNBTIKODWXHO-UHFFFAOYSA-N	429.234	1.430	50	20	IDGD	
COc1cc2c(cc1OC)CN(Cc1ccccc1NC(=O)C(=O)NNC(C)=O)CC2	763515494	OFKFKYIEZFKZRU-UHFFFAOYSA-N	426.473	1.368	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(NC(=O)C3CC3)nc2)c2ccccc2n1	763616960	QQCCUSQJSFYMTI-UHFFFAOYSA-N	432.440	1.686	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1ccc(F)cc1OCC1CC1	763629543	MNJADCIQHCXDRP-UHFFFAOYSA-N	425.420	1.970	50	20	IDGD	
Cn1ncc(NC(=O)C(=O)NNC(=O)COc2cccc(C(F)(F)F)c2)c1C(F)F	763640311	XCPWXJGISRKMDN-UHFFFAOYSA-N	435.309	1.541	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)cc1C(=O)NC(C)C	763695385	SPWGGEAYWQXSDW-UHFFFAOYSA-N	446.891	1.952	50	20	IDGD	
Cc1nn(C)c(NC(=O)C(=O)NNC(=O)COc2ccccc2Cc2ccccc2)c1C	763719080	UULPBGURRDKKCR-UHFFFAOYSA-N	435.484	1.793	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2ccc(C)cc2Cl)c2ccccc2c1=O	763785008	AHENETDETXRMLE-UHFFFAOYSA-N	427.848	1.778	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)C(=O)Nc2cnn(CC)c2)c2ccccc2c1=O	763821697	WKWQPIAAGMPXQA-UHFFFAOYSA-N	439.476	1.203	50	20	IDGD	
CN(C)C(=O)c1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)COc1ccc(F)cc1	763838237	QUKYIJOSUQJYOC-UHFFFAOYSA-N	436.827	1.346	50	20	IDGD	
Cc1cc(C(=O)NC(C)C)ccc1NC(=O)C(=O)NNC(=O)COc1ccc(F)cc1	763839314	JDEOKHLASXIISL-UHFFFAOYSA-N	430.436	1.437	50	20	IDGD	
Cc1nn(CC(F)(F)F)c(C)c1CC(=O)OCC(=O)NNC(=O)c1ccc(C#N)cc1	763844743	VFQMYPXSFOBWDR-UHFFFAOYSA-N	437.378	1.481	50	20	IDGD	
Cc1cc(C(=O)NC(C)C)ccc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccc(F)cc1	763866238	NWKCABFVSPNGGN-AWEZNQCLSA-N	444.463	1.826	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)CCSc2ccc(F)cc2)cccc1-n1cnnn1	763895229	MTSFLZUNPRVXBE-UHFFFAOYSA-N	443.464	1.378	50	20	IDGD	
CCn1cc(NC(=O)C(=O)NNC(=O)c2sc(-c3ccccc3)nc2C)ccc1=O	763900147	GJBMONKKFVEBCU-UHFFFAOYSA-N	425.470	1.700	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(CC(C)C)nn2C)cc1OC	763910886	GFNYWFOKDJFPCT-UHFFFAOYSA-N	431.493	1.816	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1cccc(-c2n[nH]c(C3CC3)n2)c1	764003517	FMFFZMHPGYJKDM-UHFFFAOYSA-N	448.439	1.520	50	20	IDGD	
O=C(Cc1ccsc1)NNC(=O)C(=O)Nc1ccc(F)c(-n2nnnc2C2CC2)c1	764035189	NXRNLROMQCFHPP-UHFFFAOYSA-N	429.437	1.069	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc(NC(=O)[C@@H]2CCCO2)cc1	764043173	PXHOYSLHNLIWCV-KRWDZBQOSA-N	426.429	1.212	50	20	IDGD	
CNC(=O)Cn1ccc2ccc(NC(=O)C(=O)NNC(=O)c3cccc4ccccc34)cc21	764051512	LTXBNCWSMOZZEY-UHFFFAOYSA-N	443.463	1.940	50	20	IDGD	
COc1cc(F)c(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(C)cc3)[nH]n2)cc1OC	764109751	BAEYEGYTHGYJCN-UHFFFAOYSA-N	441.419	1.941	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CCc2ncc(NC(=O)C(=O)NNC(=O)CC3CC3)cc2C1	764145255	ZGXYDTQDILBHPU-CQSZACIVSA-N	431.493	1.350	50	20	IDGD	
CCOCCCNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2cccc(C#N)c2)c1	764241561	AHYSOMSGHIUMDE-UHFFFAOYSA-N	437.456	1.114	50	20	IDGD	
CN(C)CC1CCN(c2ccc(NC(=O)C(=O)NNC(=O)Cc3cccnc3)cc2)CC1	764269090	VLBQYKCLIJZJLO-UHFFFAOYSA-N	438.532	1.188	50	20	IDGD	
CN(c1ccccc1)S(=O)(=O)c1cccc(NC(=O)C(=O)NNC(=O)C2CCC2)c1	764336144	ZPJYYBWVTULXQL-UHFFFAOYSA-N	430.486	1.398	50	20	IDGD	
CN(C)C(=O)COc1ccc(NC(=O)C(=O)NNC(=O)CCCc2cccs2)cc1	764336149	ZPOHOIPQFBMLLP-UHFFFAOYSA-N	432.502	1.324	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)C1=NN(c2ccccc2)[C@@H](c2ccccc2)C1	764342788	RJPFUCVUZBWREH-OAQYLSRUSA-N	442.479	1.966	50	20	IDGD	
CC(C)C(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1	764350370	DHRMEJJGGHCIAF-UHFFFAOYSA-N	434.456	1.867	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)C(=O)Nc2ccc(OCc3cccc(C#N)c3)c(F)c2)cn1	764357922	FIFUQZQRFAJJQD-UHFFFAOYSA-N	436.403	1.410	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)c2cnn(C)c2)sc2c1CC[C@H](CC)C2	764360502	YZXJECDSTUSPIL-NSHDSACASA-N	447.517	1.573	50	20	IDGD	
COCCOc1ccc(F)cc1NC(=O)C(=O)NNC(=O)c1cc(-c2cccs2)[nH]n1	764378021	VLCQOGPHXVIUBN-UHFFFAOYSA-N	447.448	1.702	50	20	IDGD	
O=C(NNC(=O)C(F)(F)Oc1ccccc1)C(=O)Nc1ccccc1Cn1cncn1	764380151	PVLAPBGYBQFNDS-UHFFFAOYSA-N	430.371	1.084	50	20	IDGD	
N#CCOc1cc(F)ccc1NC(=O)C(=O)NNC(=O)c1cc(-c2cccs2)[nH]n1	764382978	TYWRUQJUFZYRRS-UHFFFAOYSA-N	428.405	1.579	50	20	IDGD	
CNS(=O)(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2F)ccc1C	764413107	MSAIVSBBSAZMAL-UHFFFAOYSA-N	442.856	1.095	50	20	IDGD	
CN(C)c1ncc(Br)cc1C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C	765313473	NGWJFKCCNIROQV-UHFFFAOYSA-N	444.330	1.976	50	20	IDGD	
NC(=O)Nc1cccc(C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)c1	765756826	RDEHVBYIJVRAEY-UHFFFAOYSA-N	444.923	1.409	50	20	IDGD	
O=C(CCCC(=O)c1ccc2c(c1)OCCO2)NNC(=O)c1nnc(O)c2ccccc12	766631870	SSHVXPFODXYDMD-UHFFFAOYSA-N	436.424	1.921	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)C(=O)c3ccc(Cl)cc3)CC2)cc1	766643439	WDIQAYIBVLRVFI-UHFFFAOYSA-N	428.920	1.796	50	20	IDGD	
O=C(NCCC(=O)N1CCN(c2ccccn2)CC1)NNc1ncnc2ccsc12	766913922	OJHFRBCZYSAFDD-UHFFFAOYSA-N	426.506	1.451	50	20	IDGD	
CC(C)c1ccnc(N2CCN(C(=O)NNC(=O)c3cc(Br)c[nH]3)CC2)n1	767298786	STGJLXDLUWWRHD-UHFFFAOYSA-N	436.314	1.867	50	20	IDGD	
O=C(NNC(=O)c1ccc(Br)s1)NC1CCN([C@@H]2CCC[C@H]2O)CC1	767937256	IKMVWULGPOZVRN-VXGBXAGGSA-N	431.356	1.832	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C1=S=C(NC(=O)c2ccco2)C=C1C	768634286	IHVCZELZBKCLTO-UHFFFAOYSA-N	449.510	1.560	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)c(C(C)(C)C)n1	768948765	NQHXITUXABLZDA-UHFFFAOYSA-N	446.983	1.950	50	20	IDGD	
Cc1cnn(Cc2ccccc2F)c1NC(=O)C(=O)NNC(=O)C1=S=C2CCCC2=C1	769264326	FEPHQKFNNGSOQP-UHFFFAOYSA-N	441.488	1.667	50	20	IDGD	
CCOC(=O)NNC(=O)Nc1cc(S(=O)(=O)N(CC)CC)ccc1N1CCOCC1	769925005	JMMPFYMGADEOKS-UHFFFAOYSA-N	443.526	1.336	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)NCCn3c(O)nc4ccccc43)nc21	770409157	QLGRROKPMUBFQO-UHFFFAOYSA-N	425.453	1.669	50	20	IDGD	
CCOC(=O)[C@@]1(C(C)C)CCN(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)C1	770479846	BMZGIMJGSUROEJ-IBGZPJMESA-N	439.538	1.245	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)c1cc(N2C[C@H](C)O[C@@H](C)C2)ccn1	770813027	AHWFLBMNGPHLDT-HOTGVXAUSA-N	428.489	1.934	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCN(C(=O)OCc2ccccc2)C1)c1ccc(-n2cnnn2)cc1	770823039	JTSDJTVXAGOLEJ-QGZVFWFLSA-N	435.444	1.082	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)c3cccc(NC(=O)c4ccc5nc[nH]c5c4)c3)nc21	770973649	FYAJNLHNNCLXIK-UHFFFAOYSA-N	443.427	1.954	50	20	IDGD	
COc1ccccc1C(=O)NCC(=O)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1	771430908	DICOLDBSIQONHK-UHFFFAOYSA-N	431.392	1.862	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)C(=O)NNc1cccc(C#N)c1	773683545	WWIFGPPAAGQSDD-UHFFFAOYSA-N	431.474	1.289	50	20	IDGD	
Cc1cnn(-c2ccc(C(N)=O)cc2NC(=O)C(=O)NNc2cnc3ccccc3n2)c1	773722314	CZUDXVMCTUZQIR-UHFFFAOYSA-N	430.428	1.305	50	20	IDGD	
CN(C)CC(=O)NNC(=O)Nc1cccc(CS(=O)(=O)c2ccc(F)cc2F)c1	775624690	OTLXMHNKBZPLGU-UHFFFAOYSA-N	426.445	1.653	50	20	IDGD	
CC(C)N1CC[C@H](NC(=O)NNC(=O)C(=O)NC2CC2)[C@H]1c1ccc(Cl)c(F)c1	777750539	PYVSITGMBBZSIR-JKSUJKDBSA-N	425.892	1.612	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1	778225178	LOXYNYKFYQCDHW-UHFFFAOYSA-N	441.416	1.749	50	20	IDGD	
O=C1CCc2cc(NC(=O)C(=O)NNC(=O)c3cc(-c4cccs4)[nH]n3)c(F)cc2N1	778711152	CQILZLFXGJSTCK-UHFFFAOYSA-N	442.432	1.562	50	20	IDGD	
COc1cccc(NNC(=O)NCc2cccc(NC(=O)CCN3CCOCC3)c2)n1	779979041	ZOAYFYGEMCRFPY-UHFFFAOYSA-N	428.493	1.577	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1Cl)C(=O)Nc1cnn(C[C@@H]2CCCO2)c1	782927431	QXIZMCHVJNXZMK-LBPRGKRZSA-N	426.260	1.769	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2cccc(F)c2I)nc(C)n1	783324771	BQUDWKGQZIBAQM-UHFFFAOYSA-N	429.193	1.919	50	20	IDGD	
Cc1ccccc1NC(=O)NNC(=O)C(=O)Nc1ccc(C(=O)N2CCOCC2)cc1	783411543	SCYGAILAGHOCCZ-UHFFFAOYSA-N	425.445	1.259	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2ccc(-c3cn4ccsc4n3)cc2)CCS(=O)(=O)C1	783426070	FPWOTYYFTOUNQC-SFHVURJKSA-N	433.515	1.199	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNc3ccc(-n4cccn4)nn3)cc2)C[C@H](C)O1	783433329	PIOYAHQUJLYSIW-GJZGRUSLSA-N	436.476	1.358	50	20	IDGD	
CC(=O)N[C@@H](CC(C)C)C(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	783565863	JACZXPDINQUSHH-FQEVSTJZSA-N	449.511	1.757	50	20	IDGD	
Cc1ccc(NNC(=O)C(=O)Nc2cc(C)n(CCCOc3ccc(F)cc3)n2)nn1	783949315	GUYMOUHYYIPFNV-UHFFFAOYSA-N	427.440	1.980	50	20	IDGD	
O=C(NNc1ccc(Br)cn1)C(=O)Nc1cccc(C(=O)N2CCOCC2)c1	784338795	BTYUWVXAYSIAAN-UHFFFAOYSA-N	448.277	1.398	50	20	IDGD	
COc1ncc(NC(=O)C(=O)NNc2ccc(Br)cc2Cl)cc1C(N)=O	784841513	UOOPBTWKRHARJH-UHFFFAOYSA-N	442.657	1.687	50	20	IDGD	
COc1ccc2nc(NNC(=O)C(=O)Nc3ccc(C)c(S(N)(=O)=O)c3)c(C)cc2c1	785163161	RWPGHSTWLFRXDE-UHFFFAOYSA-N	443.485	1.589	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)[C@H]2[C@H](C(F)(F)F)[C@H]3CC[C@H]2O3)cc1OC	785803800	NCTCHXPOPSTSPW-CZPYZCIJSA-N	446.378	1.364	50	20	IDGD	
Cc1nc2nc(N)nn2c(C)c1CCC(=O)NNC(=O)c1ccc(Br)s1	789250284	GPDJFZNJGVANAV-UHFFFAOYSA-N	438.311	1.541	50	20	IDGD	
CC[C@H]1CCc2nc(NC(=O)C(=O)NNC(=O)Cc3cn4ccccc4n3)sc2C1	789767641	BYQKINICZFORHU-LBPRGKRZSA-N	426.502	1.634	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)[C@@H]1CC(=O)N(C)[C@@H]1c1ccc(Cl)c(Cl)c1	790664109	PLVVBJOIODNTQF-MLGOLLRUSA-N	443.331	1.965	50	20	IDGD	
N#Cc1ccc(C[C@H](C#N)C(=O)N2CCN(S(=O)(=O)CBr)CC2)cc1	792299535	DGIIIZPTZALYIU-OAHLLOKOSA-N	425.308	1.067	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)c1ccc(Br)cn1	792907182	GJAISWVJICIHFP-LBPRGKRZSA-N	448.325	1.942	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)c2cccc(NN3C(=O)[C@H]4CC=CC[C@@H]4C3=O)c2)nc1	793735689	PCBFNYKDWFUWCM-IRXDYDNUSA-N	435.440	1.903	50	20	IDGD	
CN(CCC(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1)C(=O)OC(C)(C)C	794779581	GPEOZDFAIVBMON-UHFFFAOYSA-N	434.902	1.005	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)[C@H]1CC(=O)N(c2ccc3c(c2)CCC3)C1	795152605	UTKHNHJDHKBDCI-KRWDZBQOSA-N	442.541	1.922	50	20	IDGD	
CCNC(=O)N(C)c1cccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)c1	796997792	CYYKKMPHJUXZNZ-UHFFFAOYSA-N	441.444	1.023	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccccc2C(=O)N2C[C@H](C)C[C@@H](C)C2)n1	797369598	AKXWYXONVRGBMH-HUUCEWRRSA-N	437.500	1.908	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)Nc2ccc3c(ccn3CC(=O)N3CCOCC3)c2)n1	797621101	XXHAXIOSXHGCIJ-UHFFFAOYSA-N	436.472	1.670	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cc(OC)cc(OC)c2C)cc1	800621985	DKAHARCEASIMAC-AWEZNQCLSA-N	445.472	1.964	50	20	IDGD	
O=C(COC(=O)[C@@H](O)c1cccc(C(F)(F)F)c1)NNC(=O)c1cccc([N+](=O)[O-])c1	803808926	GPWZMMQNDSVHBB-HNNXBMFYSA-N	441.318	1.651	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)[C@@H]1CCN(c2ccccc2Br)C1=O	804952381	LASKYEWSNKKOLR-LBPRGKRZSA-N	442.277	1.921	50	20	IDGD	
COc1ccc(CS(C)(=O)=O)cc1NC(=O)NNC(=O)c1cnn(-c2ccccc2)c1	806637118	XNMSEMCFHMHAKN-UHFFFAOYSA-N	443.485	1.892	50	20	IDGD	
CNS(=O)(=O)Cc1ccc(CNC(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)cc1	806970383	JKJZGCGOBOSWHN-CYBMUJFWSA-N	438.481	1.173	50	20	IDGD	
Cc1cn(-c2ccc(Cl)cc2)nc1NC(=O)C(=O)NNc1ccc(-n2ccnc2)nn1	807428474	FGSVYJSSQCGHAF-UHFFFAOYSA-N	437.851	1.892	50	20	IDGD	
CCOCC(=O)NNC(=O)N[C@@H]1CCCN(c2c(C)cc(Br)cc2C)C1=O	807542791	DNQGLIDAIUNEPM-CQSZACIVSA-N	441.326	1.928	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)NCCCn2cc(Br)cn2)c1	807612623	SIIMJWAFKOPZMI-UHFFFAOYSA-N	426.271	1.697	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCC2(SC)CCN(C)CC2)c2ccccc2c1=O	812550124	RSYZWYNADQDGJN-UHFFFAOYSA-N	432.550	1.188	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(N3CCCC3=O)cc2)cc1OC	839543633	VJKSWWWSWBKTLM-UHFFFAOYSA-N	441.440	1.449	50	20	IDGD	
O=C(CSc1ccccc1C(=O)N1CC[C@H](B(O)O)C1)Nc1ccc2c(c1)OCO2	864234660	ZAZQJXWIZCHVMT-ZDUSSCGKSA-N	428.275	1.835	50	20	IDGD	
Cc1ccc(OCC(=O)NN=Cc2c(N3CCOCC3)nc3ccccn3c2=O)cc1C	864238163	WPYDDNAQAVFUSD-UHFFFAOYSA-N	435.484	1.677	50	20	IDGD	
Cn1c(=O)nc(O)c2cc(C(=O)NNC(=O)c3ccc(COc4ccccc4)o3)cnc21	895210278	KOMPLYWEDSWWSM-UHFFFAOYSA-N	435.396	1.281	50	20	IDGD	
COc1cccc(/C=C(\C#N)C(=O)OCC(=O)N2CCN(CC(=O)NC(C)(C)C)CC2)c1	912612189	NDFHWZHMMQFPBU-LDADJPATSA-N	442.516	1.204	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)Cn1ncc2ccccc2c1=O	912895674	JZYQHLQVAQNCLI-UHFFFAOYSA-N	431.246	1.385	50	20	IDGD	
O=C(CNS(=O)(=O)c1c(Cl)cccc1Cl)NNC(=O)c1ccc2c(c1)OCO2	913415656	HINJCMSUOQETDP-UHFFFAOYSA-N	446.268	1.462	50	20	IDGD	
O=C(NNC(=O)N1CCCN(C(=O)c2ccccc2)CC1)c1cc(Br)c[nH]1	913463241	YDDMIBJDQIWXRJ-UHFFFAOYSA-N	434.294	1.980	50	20	IDGD	
CC(C)C(=O)Nc1ccc(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1	914749699	KHRSCMANFWBKRT-UHFFFAOYSA-N	438.893	1.657	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2CCCN(C(=O)Cc3ccccc3)C2)cc1C	914882050	RCIMCNRONRUJRE-LJQANCHMSA-N	436.512	1.871	50	20	IDGD	
O=C(COC(=O)[C@@H]1CCCN(C(=O)Cc2ccccc2)C1)NNC(=O)c1cccs1	914943182	PLTYHDHBDHFIPY-MRXNPFEDSA-N	429.498	1.534	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCCNC(=O)NNC(=O)[C@H](C)Oc2ccccc2F)cc1	916277051	RCZCEWZYCBVBKH-AWEZNQCLSA-N	438.481	1.210	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)N[C@@H]1COc2ccccc2C1	916635885	FHHOUYIQBHQNEN-KRWDZBQOSA-N	444.513	1.419	50	20	IDGD	
COc1ccc(CCCNC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)cc1	918019725	XMSZJTQJSGZWER-UHFFFAOYSA-N	433.534	1.874	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)COc1ccccc1C#N)c1ccc(S(=O)(=O)N(C)C)cc1	918105730	UYKDFIAXMUSMSC-CQSZACIVSA-N	445.501	1.279	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)Cc2nnn(-c3ccccc3)c2C)c2ccccc2c1=O	919962403	OJULIPTXNOYAGG-UHFFFAOYSA-N	445.483	1.699	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)CCNC(=O)OCC(F)(F)F)c2ccccc2c1=O	919971972	BPBSSJQAXDFTHR-UHFFFAOYSA-N	443.382	1.246	50	20	IDGD	
CCn1c(NNC(=O)CN2C(=O)Cn3c(cc4ccccc43)C2=O)nc2ccccc2c1=O	920254025	FXVJQDXHFVFSFD-UHFFFAOYSA-N	444.451	1.497	50	20	IDGD	
COc1cc(C=NNC(=O)N[C@H]2CCS(=O)(=O)C2)ccc1OC(=O)c1cccnc1	920380098	GRPYHTKPJAUYPY-HNNXBMFYSA-N	432.458	1.130	50	20	IDGD	
Cc1cc(S(=O)(=O)Nc2ccccc2C(=O)NNC(=O)CN2CCCC2=O)ccc1F	920435620	LNNPHFTXOFKUCZ-UHFFFAOYSA-N	448.476	1.318	50	20	IDGD	
CN(CCCOc1ccc(S(C)(=O)=O)cc1)CC(=O)NNC(=O)c1cccs1	920835934	QDCQFCYLBJYAAG-UHFFFAOYSA-N	425.532	1.314	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)c2cc(S(C)(=O)=O)ccc2F)CC1	1322998062	DQVHLYKYRFWSAG-UHFFFAOYSA-N	443.497	1.637	50	20	IDGD	
Cn1c(=O)n(C)c2cc(C(=O)N3CC[C@]4(C3)CN(C(=O)C(Cl)Cl)CCO4)ccc21	1777868972	WHDHDZSMEOFBEN-IBGZPJMESA-N	441.315	1.124	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2c(C)nc3ncccn23)C1	1778634796	SHWRTMZCXZUTQD-WHSLLNHNSA-N	449.939	1.419	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)c(O)n1	1780269697	RKNFSQYMHILJOM-XIKOKIGWSA-N	426.311	1.570	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1cnccn1)C2)[C@@H](F)Br	1780770111	CDFSQALCPZGRPW-FRFSOERESA-N	429.290	1.224	50	20	IDGD	
Cc1ccccc1OCC(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781327906	DGAZMAJTCIDDOH-WMZOPIPTSA-N	429.286	1.894	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2c3c(nn2C)CCC3)C1	1781372328	RBJNWVSFTLCEDW-LUQKVYGDSA-N	438.956	1.290	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnc(N)s1)C2	1781998177	OYCGTSHPNKQCKI-KANYHAFZSA-N	431.356	1.636	50	20	IDGD	
CCOC(CC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](Cl)COC)C1)OCC	1782180096	RRHXKUCZQOVYHR-JXXFODFXSA-N	434.961	1.543	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3nc4ccc(F)cn4n3)C2)C1	1782569214	GTRZTZCIGQVOHU-QZTJIDSGSA-N	444.294	1.548	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(C)(C)CCl)[C@H]2C1	1783853689	SXNNHQWFDDKNAA-ZQDZILKHSA-N	447.960	1.074	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3nccc(Cl)c3OC)CCO2)C1	1783881257	JYUJEDLKIMUEJN-UGSOOPFHSA-N	432.304	1.441	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)C(=O)c3cccn3C)C2)C1	1784606715	LIPKHMKTSVOBBO-ACJLOTCBSA-N	426.311	1.069	50	20	IDGD	
Cc1cc(Cl)cc(C(=O)N2CC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c1	1785046911	FJNGNSUXZVDMON-OAQYLSRUSA-N	436.940	1.465	50	20	IDGD	
CC(C)(C)OC(=O)N1CC=C(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](F)Cl)CCO3)CC1	1785319331	UKPXZQIBCSRQSQ-QRWLVFNGSA-N	445.919	1.918	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)COc3ccc(C(=O)OC)cc3)C2)C1	1785721658	XLLBPNTUSBUSIM-LAUBAEHRSA-N	438.908	1.699	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3n[nH]c4c(F)cccc34)[C@H]2C1	1788395956	OTVZIHIXTYNOSC-ZIEJDFEHSA-N	438.887	1.549	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)c1ccncc1-c1ccccc1	1789077790	IVGCUBQAMOLRIZ-DVWBAYGPSA-N	443.931	1.942	50	20	IDGD	
CC(C)(C)n1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]3C2)cn1	1789922612	PXVDKDBOJYZALE-MXAVVETBSA-N	445.333	1.922	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3c[nH]c4cnccc34)C[C@@H]21)[C@H](F)Br	1789926171	PPGWJXLPXGPXTL-NZBMOFRJSA-N	439.285	1.847	50	20	IDGD	
C[C@H](Oc1cccnc1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]2C1	1789926917	LEXPWLPOJMZJIX-OSZUESSQSA-N	444.301	1.519	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@@H](C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]3C2)C1	1791298534	ZAITYCQAFOHJFW-MRLBHPIUSA-N	435.348	1.749	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCc1ccc(C#N)cc1	1792483200	UNHAUJKHLGUWJD-ACDBMABISA-N	425.533	1.502	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C[C@@H](N)c1cccnc1)C2	1792868007	QCZZMRORPBLCPX-AEWXESQOSA-N	439.354	1.092	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC=C(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](O)CCl)C1	1793110998	VYIHDTGZURBBNH-YVSFHVDLSA-N	441.956	1.792	50	20	IDGD	
Cc1ccc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)CBr)C3)nc1	1794087020	CFKUHYNDITWWPK-OAFZBRQQSA-N	438.366	1.943	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc(Br)nc1)C2)[C@@H](F)Cl	1796367255	CDZSEPLLCUTNOU-BAESOJJISA-N	434.693	1.511	50	20	IDGD	
Cn1cnc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CO[Si](C)(C)C)C3)c1C(F)(F)F	1796605045	VDERHBKZOOLVMW-DABQJJPHSA-N	448.518	1.494	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cc1cccc(Cl)n1)C2	1798440767	PRQBRAPVTWQCGC-QDMKHBRRSA-N	442.907	1.228	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2)c1n[nH]c2c1CCc1ncccc1-2	1798475464	AHKANLPECILEOD-DEHFKTMOSA-N	433.871	1.308	50	20	IDGD	
Cc1ccncc1CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Br	1799344365	JNGNOMCDKYWBFI-FSDCSDTHSA-N	428.302	1.603	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nccc3occc13)C2)[C@@H](F)Br	1799346720	YBGGVDVYWGDIKE-YJKIEOBBSA-N	426.242	1.722	50	20	IDGD	
COc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Br)c(OC)c1	1799349429	ZTOWAMQORHEDMQ-OXUXUCFPSA-N	445.285	1.598	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2c(c1)NC(=O)CC2	1800102235	CMGSMGSBPQJIRX-YYAJDYIMSA-N	435.908	1.028	50	20	IDGD	
Cc1cccn2ncc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@H](C)CBr)C4)c12	1800103841	LZHVRCVTPAHQDO-PNBKFKSVSA-N	449.349	1.877	50	20	IDGD	
Cc1cc2cc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)CCC(=O)NN(C)C)C4)ccc2[nH]1	1800117587	CWZUXLSHHOSDEI-OPMZPASUSA-N	441.532	1.053	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c(F)cncc1F)C2	1800642086	VSBXJYNLWHJJKZ-DDIVZENXSA-N	432.265	1.737	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Oc1cccnc1)C2	1800644240	OUDJCZPGMJCRQM-BDLOOMQFSA-N	440.338	1.612	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(CO)c(F)c1	1801902576	LZNGZSNUDJIMQQ-MVWRLGRASA-N	433.307	1.758	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Cl)C3)C[C@H]2C[C@H]21	1802136305	FAJFJHNLERGVGG-VUFNAHJJSA-N	445.919	1.508	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cn3c(Cl)cccc3n1)C2	1802336577	NJCNWHFADWBFMD-QDMKHBRRSA-N	446.939	1.613	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)N2CCOCC2)[C@H]1c1cccnc1	1803691286	BMAAKIIJSVDTMB-CGBFIWBNSA-N	438.956	1.146	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)Cn2cc([N+](=O)[O-])cn2)[C@H]1c1cccnc1	1808250205	IOVPNKYNWOXMAB-HFTRVMKXSA-N	434.884	1.910	50	20	IDGD	
CNc1ccc(C(=O)N2CCCC3(CCN(C(=O)CCC(=O)NN(C)C)CC3)C2)cc1	1809725670	PXDMSPKHZVWUNB-UHFFFAOYSA-N	429.565	1.946	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)c3n[nH]c4ccccc34)CC2)C1	1809978973	ZXCKDCPDLSWRKJ-UHFFFAOYSA-N	446.316	1.401	50	20	IDGD	
CCOC(=O)N[C@H](O)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](Cl)CC)[C@@H]1c1cccnc1	1810100423	SNZCOTQIKRONRP-LJIGWXMPSA-N	426.901	1.169	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)Nc2cnccn2)[C@H]1c1cccnc1	1813033135	ZYXVZQODHAYGQU-WMEZAQDKSA-N	446.939	1.632	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2cccn2C)[C@H]1c1cccnc1	1813069710	ASIBAHQBLTZQTC-UTKZUKDTSA-N	426.521	1.113	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)Cc3ccc(F)cc3)sc2C1	1813934799	UNTPXWMBDFSZNC-OAHLLOKOSA-N	447.536	1.810	50	20	IDGD	
Cc1csc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)c1	1815337303	RGNDGDCQFXIUBK-CQSZACIVSA-N	441.343	1.732	50	20	IDGD	
C[C@@H](C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1)c1ccccn1	1817474237	BGIJEFJMDLRVHE-QRWLVFNGSA-N	447.304	1.594	50	20	IDGD	
Cc1ccnc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)c1	1817474308	CXOBQNMRRGVOIS-IBGZPJMESA-N	433.277	1.413	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1ccc(F)nc1	1819692595	YGHGGNJNUQMVST-KRWDZBQOSA-N	437.240	1.243	50	20	IDGD	
COc1ccc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)CCBr)CC3)nn1	1821066405	SSQVZKBBNMRMCG-VIFPVBQESA-N	440.323	1.953	50	20	IDGD	
COc1cc(C#N)cc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@H](O)CCl)CC3)c1	1821383946	LEJORLANRVDAMV-IUODEOHRSA-N	434.905	1.849	50	20	IDGD	
CC(C)n1cnc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)n1	1822414359	SORJUMWTCNMRPG-HNNXBMFYSA-N	445.528	1.261	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CSc1nc[nH]n1)CC2	1825646717	BUEMCXJQOGHUNY-SFYZADRCSA-N	445.368	1.749	50	20	IDGD	
O=C([C@@H]1CCCS1(=O)=O)N1CCC([C@H]2CCCCN2C(=O)CCBr)CC1	1826359784	OMVHEDWBZIFEHQ-CVEARBPZSA-N	449.411	1.968	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC([C@H]2CCCCN2C(=O)CC[C@@H](N)C(N)=O)CC1	1826936684	ZBIKJBFCXBXOCV-IAGOWNOFSA-N	426.634	1.050	50	20	IDGD	
CC(C)C1(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2cccc(B(O)O)c2)CC3)CCC1	1827394546	NWVAIACTZJDWTB-MRXNPFEDSA-N	441.362	1.875	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4c(c3)OCO4)C2)C1	1830362057	KANQIRPPXUOHMK-NRFANRHFSA-N	438.908	1.750	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)C3CCN(C(C)C)CC3)C2)C1	1831639936	HEIIZCQZNNTURB-KNQAVFIVSA-N	444.016	1.971	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)CSc3ccncc3)CCO2)C1	1832701210	INXYCWJVRRJABC-HXUWFJFHSA-N	441.981	1.895	50	20	IDGD	
O=C1CCc2ccc(C(=O)N3CCC(N4CCC(NC(=O)[C@@H](O)CCl)CC4)CC3)cc21	1833311898	GUKPJHSBLNQNDD-NRFANRHFSA-N	447.963	1.600	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@@H]3CCCCN3C)CC2)CC1	1833323557	PYBLMGJRGFQRSD-OALUTQOASA-N	429.005	1.296	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(O)nc(Cl)c3)CCO2)C1	1833574688	KWVCILGHVOOSLU-AUUYWEPGSA-N	446.331	1.918	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)C[C@@H]3CCCCO3)CC2)CC1	1833684117	PSFJPDXBGFBPHM-OALUTQOASA-N	429.989	1.771	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)CBr)C3)C2)cn1	1833991500	UPVYASMOVYNNAG-AUUYWEPGSA-N	440.338	1.491	50	20	IDGD	
Cc1nscc1C(=O)N1CCOC[C@]2(CN(C(=O)CCBr)CCO2)C1	1834819380	PGBRFLKMSYSDIB-INIZCTEOSA-N	432.340	1.307	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)c3cc(F)cc(F)c3)C2)C1	1834823745	HWOGFYRMSOEESN-GOSISDBHSA-N	447.276	1.820	50	20	IDGD	
C[C@@H](Cc1ccco1)C(=O)N1CCOC[C@@]2(CN(C(=O)CCBr)CCO2)C1	1834826689	TWMJEDZTEHASSW-HNAYVOBHSA-N	443.338	1.700	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H]3COc4ccccc4O3)CC2)CC1)[C@H](F)Cl	1835079085	LLQKGQMYGYLEGR-MOPGFXCFSA-N	439.915	1.932	50	20	IDGD	
O=C(c1nccc2[nH]ccc12)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1836448283	WPFYOKVZHGGAIP-GOSISDBHSA-N	427.288	1.437	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C1(C(F)(F)F)CC1)CCO2	1836723484	OHKPETUSKLTMAN-IUODEOHRSA-N	428.835	1.039	50	20	IDGD	
O=C(c1cc2cc(F)ccc2[nH]1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1836803280	AVDVQXMGTFUPAW-APWZRJJASA-N	427.835	1.911	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)[C@@H]3CNC(=O)O3)CC2)CC1	1836903892	SMKPITRAKSGGIX-CABCVRRESA-N	446.342	1.267	50	20	IDGD	
O=C(c1ccc(C(F)(F)F)[nH]1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1837764505	CEERLHFOVDRXGA-WFASDCNBSA-N	427.782	1.638	50	20	IDGD	
COC(=O)NCC(=O)N1CCC(OC2CCN(C(=O)[C@H](C)Br)CC2)CC1	1838773539	NGMGQSTZLYGKQF-LBPRGKRZSA-N	434.331	1.124	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3noc(C)c3C)C2)C1	1839962639	MJLSVRZDMLOFBI-KSSFIOAISA-N	444.326	1.535	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cncs3)C2)C1	1839963618	QGJNFMKKFJDXMW-WBMJQRKESA-N	432.340	1.387	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccc(C)o3)C2)C1	1839967680	UIZFBWDOSYAXMU-QFBILLFUSA-N	443.338	1.760	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)C3CC(F)(F)C3)C2)C1	1840030854	YSKNLLLFYRMARG-IAQYHMDHSA-N	425.270	1.272	50	20	IDGD	
C[C@@H](Cc1ccncc1)C(=O)N1CCOC[C@@]2(CN(C(=O)C(Cl)Cl)CCO2)C1	1840189834	OASLNMSTGNIGLM-LIRRHRJNSA-N	430.332	1.520	50	20	IDGD	
O=C(c1ccc2c(c1)CCCO2)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840190892	SXWXCNUXUAXPHV-HXUWFJFHSA-N	443.327	1.885	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)Oc1ccccn1)CCO2	1840422716	IBRBGUVURWSQOQ-FIKGOQFSSA-N	439.940	1.713	50	20	IDGD	
C[C@H](Oc1ccccn1)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1840422815	LDMGOKRNUZLQEZ-KKSFZXQISA-N	439.940	1.570	50	20	IDGD	
COc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)cc(OC)c1C	1840756866	SRJLYHYEOOFZBJ-FXAWDEMLSA-N	444.887	1.617	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCO)C(=O)N1CC2(CCCN2C(=O)CCBr)C1	1842637180	MMZZLLWKFSGFOP-ZDUSSCGKSA-N	448.358	1.251	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC2(CCCN2C(=O)CCN2CCOCC2)C1	1842841026	QTTZPPHWUNEITK-LDADJPATSA-N	444.482	1.797	50	20	IDGD	
CCOC(=O)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)[C@H](F)Cl)C1	1843367511	IOJVKVDZTPDDBH-RYUDHWBXSA-N	435.880	1.181	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1cc(O)nc(Cl)c1)C2	1843415622	SFPJZLJORIEZBH-WYMPLXKRSA-N	444.879	1.392	50	20	IDGD	
Cn1c(=O)n(CC(=O)N2CCCC23CN(C(=O)[C@H](F)Br)C3)c2ccccc21	1843860414	RSRAAXVRIYXFDO-HNNXBMFYSA-N	439.285	1.234	50	20	IDGD	
O=C([C@@H](O)CCl)N1CC2(CCCN2C(=O)c2cc(Br)cc3cn[nH]c23)C1	1844127855	BMXJLSKYIXXDLU-ZDUSSCGKSA-N	441.713	1.742	50	20	IDGD	
O=C([C@@H]1CC(=O)N(C2CCCC2)C1)N1CC2(CCCN2C(=O)[C@@H](F)Br)C1	1845216510	UEBHZPRLQSPVMN-IUODEOHRSA-N	430.318	1.671	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H]1C[C@H]1c1ccc(F)c(F)c1	1847608200	VGYWJMIGAAOYBP-JWWGGVBKSA-N	440.255	1.264	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H]1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](F)Br	1847959276	XBQZZVAAVCSUAL-WUHRBBMRSA-N	434.306	1.888	50	20	IDGD	
O=C(O)CCSSCCNC(=O)c1cccc(S(=O)(=O)NC[C@H]2CCCO2)c1	2088603696	HSDKASHVBBEADP-CQSZACIVSA-N	448.588	1.730	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@H]2CCCN(C(=O)OC(C)(C)C)C2)c2ccccc2c1=O	15720986	PUZJVSGPPWMLCL-AWEZNQCLSA-N	443.504	1.825	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)C(=O)c2c(C)nn(-c3ccccc3)c2C)cc1	16546345	CTBDONVTMZPMBM-UHFFFAOYSA-N	434.452	1.985	50	20	IDGD	
Cc1cccc(-c2nnc(S)n2CC(=O)NNC(=O)c2ccc3c(c2)OCCO3)c1	21904198	PEUMGUKWDAJSBG-UHFFFAOYSA-N	425.470	1.775	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)c1sccc1S(=O)(=O)N1CCCC1	25318460	WMXFBDCBTPGNPQ-LBPRGKRZSA-N	441.506	1.900	50	20	IDGD	
Cc1cc(N2CCN(CC(=O)NNC(=O)Cc3nc(C)cs3)CC2)nc(C(C)C)n1	27545678	GGKZPBLJEQBZPC-UHFFFAOYSA-N	431.566	1.185	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2Cc3ccccc3C[C@@H]2c2nnc(C)o2)n1	303013391	XNGNIINHPSWZPB-MRXNPFEDSA-N	426.502	1.632	50	20	IDGD	
C[C@@H]1C[C@@H](C)CN(C(=O)CN2CCN(C(=O)NNC(=O)CCCc3ccccc3)CC2)C1	727846111	KYTLWGAVEWJIQU-WOJBJXKFSA-N	443.592	1.872	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2ccc3nc(C(F)F)[nH]c3c2)ccc1Cl	730079356	BASVIJUWZVDHHE-UHFFFAOYSA-N	443.819	1.876	50	20	IDGD	
COc1cc(C=NNC(=O)CSc2nnc(O)nc2O)cc(Br)c1O	730556487	MODSOAGCJOIACZ-UHFFFAOYSA-N	430.240	1.002	50	20	IDGD	
CC(=NNC(=O)Cc1cc(O)nc(S)n1)c1ccc(OCC(=O)N2CCCC2)cc1	730586361	GCEJGGCDDBTTKJ-UHFFFAOYSA-N	429.502	1.555	50	20	IDGD	
C[C@@H](Sc1ncccc1C(=O)NNC(=O)COc1ccccc1O)C(=O)N1CCCC1	730778870	XVKMSQQGBYPQIR-CQSZACIVSA-N	444.513	1.730	50	20	IDGD	
O=C(CC[C@H]1NC(=O)N(c2ccc(Cl)cc2)C1=O)NNC(=O)CNc1ccccc1	730830257	OYIUBJLKTAGAEK-MRXNPFEDSA-N	429.864	1.805	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2ccc([N+](=O)[O-])cc2)cc1Br	732048456	JZDUXFXZKPFORQ-UHFFFAOYSA-N	430.236	1.989	50	20	IDGD	
CCS(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1	732540140	BEICXVDFGTYTNC-UHFFFAOYSA-N	435.481	1.087	50	20	IDGD	
O=C(NCC1CCN(S(=O)(=O)C(F)(F)F)CC1)NNC(=O)c1c[nH]c2ccccc12	732673761	RNQJHLAVSRGEBT-UHFFFAOYSA-N	447.439	1.674	50	20	IDGD	
O=C(CNC(=O)NCc1ccc([N+](=O)[O-])cc1)NNC(=O)NCc1ccc(Cl)cc1	733004893	WNOTXRREGYRRJH-UHFFFAOYSA-N	434.840	1.578	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)N[C@H](CN1CCOCC1)c1ccccc1	733337092	HEJPRJMPIALXRK-OAQYLSRUSA-N	434.500	1.890	50	20	IDGD	
O=C(NCCN1C(=O)CNC1=O)NNC(=O)c1ccc(COc2ccc(Cl)cc2)cc1	733656559	AZAISQKSKAORSI-UHFFFAOYSA-N	445.863	1.415	50	20	IDGD	
Cn1c(=O)n(CCC(=O)NNc2ccccc2S(=O)(=O)NC(C)(C)C)c2ccccc21	734251094	YJZYMUWOGLXUKN-UHFFFAOYSA-N	445.545	1.950	50	20	IDGD	
CCCc1nc(C)c(C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)s1	735117620	ZMFROHZECPFWHN-UHFFFAOYSA-N	438.579	1.492	50	20	IDGD	
CS[C@@H]1CCC[C@H](NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)C1	735385455	ZMIGLOQLTSDTRD-LSDHHAIUSA-N	428.580	1.620	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)N[C@@H]2CCN(c3cnn(C)c3)C2=O)c1	735583708	BJJVCOZIJSSXJB-QGZVFWFLSA-N	428.493	1.367	50	20	IDGD	
Cc1nc(CNC(=O)/C(C#N)=C/c2cn(CCC(N)=O)nc2-c2ccc(Cl)cc2)no1	736091768	GWRMHPMRWHTDSS-RIYZIHGNSA-N	439.863	1.994	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)c2cnc3ncnn3c2C(C)C)cc1C	736786743	LAKMMVGOPVVJSB-UHFFFAOYSA-N	430.490	1.798	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Cc2csc(-c3ccoc3)n2)cc1	737766400	GWINRJNQMPQSKD-UHFFFAOYSA-N	448.526	1.722	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN2CCN(CCN3[C@@H](C)CC[C@@H]3C)CC2)cc1C	738308191	FCQYYBSAWNKTQB-ROUUACIJSA-N	435.638	1.870	50	20	IDGD	
COC(=O)Nc1ccc(CCNC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1	739033122	VYIBYUOIRWOIAW-UHFFFAOYSA-N	438.444	1.299	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)NC[C@@H](O)c1cc(Cl)c2c(c1)OCCO2	740058126	RFCQLWWBEIVRIS-MRXNPFEDSA-N	435.864	1.692	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CSc2nnc(-c3ccco3)n2CCC(N)=O)c1	742451109	OYAUCPSEQWEXOM-UHFFFAOYSA-N	428.474	1.275	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)N[C@@H]3C[C@H]3c3cccc(F)c3)nc2)CC1	743357075	VPQBNWHHPCPFDG-ZWKOTPCHSA-N	448.524	1.339	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NCCCN2CCc3ccccc32)cc1	743526031	RVMSCKPJJVLTQK-UHFFFAOYSA-N	431.518	1.879	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CCCOc2ccc(S(C)(=O)=O)cc2)cc1OC	743605898	FNQGOERUZMXVRX-UHFFFAOYSA-N	436.486	1.728	50	20	IDGD	
O=C(CN1CCC(C(=O)NCCc2cccs2)CC1)NNC(=O)c1ccc(F)cc1	745170611	ALBHYMAYDWGMRT-UHFFFAOYSA-N	432.521	1.719	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)[C@H](c2cccc(F)c2)N2CCOCC2)c1	745424255	PKIAYSMTSJUAOX-FQEVSTJZSA-N	429.448	1.512	50	20	IDGD	
COc1cc(OC)c(S(=O)(=O)NNC(=O)c2ccccc2O)cc1Br	747595972	SPIUINCLCHJDJU-UHFFFAOYSA-N	431.264	1.795	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2)c1ccc(Cl)cc1F	747617792	MCFDTCCDPZHFHD-UHFFFAOYSA-N	431.785	1.782	50	20	IDGD	
CCCC[C@H](NC(N)=O)C(=O)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1	747780952	GANKIQWMKIVOTR-SFTDATJTSA-N	437.544	1.988	50	20	IDGD	
CCn1c(=O)nc(O)c2c(C(=O)NNc3ccc(S(C)(=O)=O)cc3)cc(C(C)C)nc21	748131006	IVQCTDDPGWQING-UHFFFAOYSA-N	445.501	1.801	50	20	IDGD	
Cc1sc2ncnc(N3CCC(C(=O)NNC(=O)C(=O)N4CCCC4)CC3)c2c1C	748246643	FCRHCZZIVIMKGV-UHFFFAOYSA-N	430.534	1.294	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)NCCCN1CCN(c2ccncc2)CC1	748343552	KDQKZMRZFOHDET-UHFFFAOYSA-N	436.520	1.194	50	20	IDGD	
Cc1nnnn1[C@H](Cc1ccccc1)C(=O)NNc1ccc(S(=O)(=O)C(F)F)cc1	748610064	AJSLRBGXLBAMTK-MRXNPFEDSA-N	436.444	1.905	50	20	IDGD	
NC(=O)CC[C@H](C(=O)NNc1ccc(OC(F)F)cc1)N1C(=O)c2ccccc2C1=O	748637214	IQDOFNQOQMBYEN-OAHLLOKOSA-N	432.383	1.661	50	20	IDGD	
CNC(=O)CCNC(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccc(OC)c(OC)c1	748722138	PNGZFLVNPUCGEP-LFIBNONCSA-N	436.472	1.640	50	20	IDGD	
COc1cc(S(=O)(=O)NNC(=O)[C@H]2COc3ccccc3O2)c(Cl)cc1C(=O)O	749140579	AMEWVPMKOHIXCW-CQSZACIVSA-N	442.833	1.196	50	20	IDGD	
C[C@H](C(=O)NNc1nc(Br)cn2ccnc12)S(=O)(=O)c1ccc(F)cc1	750247309	OXTJLJZDULOYGB-SECBINFHSA-N	442.270	1.936	50	20	IDGD	
CCOc1ccc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)[C@H](C)N(C)C)cc2)cc1	750605735	HMIXMYPDICXWDB-AWEZNQCLSA-N	434.518	1.597	50	20	IDGD	
Cc1sc(=O)n(CC(=O)NNC(=O)CNC(=O)c2cccs2)c1-c1ccc(F)cc1	751206198	GUKWKIBQQBDLGW-UHFFFAOYSA-N	448.501	1.663	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(\C#N)C(=O)NNC(=O)CNC(=O)c2cccs2)c1C	751209350	PFHSRJOISUZONW-VEJKBTLKSA-N	443.529	1.858	50	20	IDGD	
COc1cc(OC)cc(N2C[C@@H](C(=O)NNC(=O)c3cccc(N(C)C)c3)CC2=O)c1	752267541	FJXLWYVYOSNMTN-HNNXBMFYSA-N	426.473	1.584	50	20	IDGD	
Cn1c(=O)c2c(ncn2CC(=O)NN=Cc2cc(C(F)(F)F)ccc2Cl)n(C)c1=O	753714409	NNVYQYZVSVONEN-UHFFFAOYSA-N	442.785	1.256	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)N[C@H]1CCN(Cc2ccc(C#N)cc2)C1=O	753733481	QNJOFHADIDOXQQ-KDOFPFPSSA-N	439.447	1.596	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(NC(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)c1	755365653	BFVOWEHAXFHERD-UHFFFAOYSA-N	434.503	1.855	50	20	IDGD	
C[C@@H]1CN(c2ccc(NC(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)cc2)CCO1	756671877	LBVWAYYISFQQQC-CQSZACIVSA-N	436.472	1.625	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N[C@@H]2CN(C(=O)OC(C)(C)C)C[C@@H]2C#N)c(OC)c1	758757165	FYGVZZYIFFQGLE-SWLSCSKDSA-N	433.465	1.407	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NN=C1C[C@H](C)N(C)C1)N(S(C)(=O)=O)CC2	761805905	YEBRKXYVMPBJJE-GUYCJALGSA-N	438.550	1.149	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=S)NCc1ccc(OC(F)(F)F)cc1	763164079	LSWWTMSPWPPJQS-UHFFFAOYSA-N	427.408	1.406	50	20	IDGD	
CS(=O)(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3n2)c1	763465856	DBNRYAPIELUXEK-UHFFFAOYSA-N	446.872	1.691	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C)c(C)c(NC(=O)C(=O)NNC(=O)c2cccnc2)c1	763490731	CRPLUNTVMCPJCU-UHFFFAOYSA-N	447.517	1.129	50	20	IDGD	
O=C(NC[C@@H]1CCCO1)Nc1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2F)cc1	763555616	IQYFICIEOXRPGO-HNNXBMFYSA-N	443.435	1.526	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(CN3C(=O)CSC3=O)cc2)c(C)o1	763576967	QRTLYTRAOLFDEW-UHFFFAOYSA-N	430.442	1.492	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)[nH]n1)C(=O)Nc1ccc(Cn2cncn2)cc1	763605421	SLAVQYHSLDAXOG-UHFFFAOYSA-N	430.428	1.116	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccc(C(=O)NC2CC2)c1	763684797	NOBHHVLHINMQTJ-UHFFFAOYSA-N	440.456	1.142	50	20	IDGD	
N#Cc1ccc(Cn2cnc(NC(=O)C(=O)NNC(=O)C34CC5CC(CC(C5)C3)C4)n2)cc1	763728491	UNOQIRWZFTYZNL-UHFFFAOYSA-N	447.499	1.500	50	20	IDGD	
CC(=O)N(Cc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(N(C)C)c2)cc1)C1CC1	763760266	JSGXZJDQCGZWDJ-UHFFFAOYSA-N	437.500	1.663	50	20	IDGD	
CSc1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	763791585	WRXLWIFQNGDNSQ-UHFFFAOYSA-N	445.888	1.709	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccc(-n2cccn2)c(F)c1	763848604	DKGGBXXTQYRVJW-LBPRGKRZSA-N	429.383	1.704	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc3ccccc3c2)c(OC)n1	763856052	XUZPTQVTGCKGEA-CYBMUJFWSA-N	438.440	1.805	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(OC)nc2Cl)cc1	763861223	NAERQGXCRAWNCS-LLVKDONJSA-N	436.852	1.696	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cccc(C(=O)N(C)C)c2)cc1	763870646	BGFCXAYVZAHOAA-CQSZACIVSA-N	440.456	1.144	50	20	IDGD	
CCc1cc(O)nc(-c2cccc(NC(=O)C(=O)NNC(=O)Cc3ccc(F)cc3)c2)n1	763919780	UWDTVQDZBXYPTA-UHFFFAOYSA-N	437.431	1.879	50	20	IDGD	
Cc1cc(C)n(-c2ccc(C(F)(F)F)cc2NC(=O)C(=O)NNC(=O)c2cnccn2)n1	764025621	XOCWWHRFXRSIEQ-UHFFFAOYSA-N	447.377	1.698	50	20	IDGD	
CCN(Cc1ccccc1NC(=O)C(=O)NNC(=O)c1cc(C)[nH]n1)C(=O)OC(C)(C)C	764105941	DANXDTGOVMDMJR-UHFFFAOYSA-N	444.492	1.875	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)cc1N1CCOC1=O	764125058	QUROSXLPQAKZEI-UHFFFAOYSA-N	448.819	1.411	50	20	IDGD	
C[C@H]1CN(C(=O)c2ccc(NC(=O)C(=O)NNC(=O)CC3CCCC3)cc2)C[C@H](C)O1	764184137	NIBSDWKCDGQLRP-GJZGRUSLSA-N	430.505	1.602	50	20	IDGD	
Cc1ncsc1C(=O)NNC(=O)C(=O)N1CCc2cc(Br)cc(F)c21	764247635	VLLROKRTHCRTBB-UHFFFAOYSA-N	427.255	1.703	50	20	IDGD	
COC(=O)c1c(NC(=O)C(=O)NNC(=O)Cc2cccnc2)sc2c1CCCCC2	764263542	IQIBPCHGGXJRGT-UHFFFAOYSA-N	430.486	1.527	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1ccc([S@@](=O)C(F)(F)F)cc1	764276074	YQIBSJYUGBYOMU-SSEXGKCCSA-N	445.375	1.185	50	20	IDGD	
O=C(Cc1cc[nH]n1)NNC(=O)C(=O)Nc1ccc(Cl)c(C(=O)Nc2ccccc2)c1	764286356	SNOUXESZGYGUCB-UHFFFAOYSA-N	440.847	1.644	50	20	IDGD	
Cc1cc(C(=O)N2CCC[C@H](C)C2)ccc1NC(=O)C(=O)NNC(=O)c1cnn(C)c1	764360141	XANLUAFEVJHMHM-ZDUSSCGKSA-N	426.477	1.000	50	20	IDGD	
Cn1ccnc1-c1csc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)n1	764380220	SHFBGDYWDYEJFD-UHFFFAOYSA-N	436.400	1.301	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)CCCOc2ccc3c(c2)OCO3)c2ccccc2c1=O	764544178	BXWANBOMUMHNSG-UHFFFAOYSA-N	438.440	1.765	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)[C@@H](O)CCc1ccccc1	765175069	HGNFOXXCWRHGAC-NRFANRHFSA-N	444.963	1.599	50	20	IDGD	
Cn1ncc(C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)c1C1CC1	766662980	IGEVIZIBJGZUNC-UHFFFAOYSA-N	430.940	1.530	50	20	IDGD	
NC(=O)c1ccc(C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)cc1	766663719	MIVOJNGZMVRHGC-UHFFFAOYSA-N	429.908	1.018	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)[C@@H]1CCCN(C(=O)NCC(C)C)C1	768634938	SEDCPTCSOKSISD-CQSZACIVSA-N	426.539	1.619	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3O)CC2)cc1	769301597	IIDMKAOFSBLSRV-UHFFFAOYSA-N	427.461	1.188	50	20	IDGD	
CO[C@@H](c1ccc(F)cc1)[C@H](C)NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1	770768815	ALOVAWJDVBFVNG-KBXCAEBGSA-N	430.484	1.939	50	20	IDGD	
CC(C)CNC(=O)N1CCC[C@@H](C(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)C1	770965740	LUYZGIGRQQYFIJ-CYBMUJFWSA-N	432.529	1.808	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)c3cccc(CS(=O)(=O)c4ccccc4)c3)nc21	770970606	BUVRKVCLWKBYFA-UHFFFAOYSA-N	438.469	1.800	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)CN2C(=O)N[C@@](C)(c3ccc(F)c(Cl)c3)C2=O)nc1	771437160	MZJLIGXJEFIBPD-IBGZPJMESA-N	449.826	1.571	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1ccc(S(=O)(=O)N(C)C2CCCCC2)cc1	771963597	NZPQIXLCQVOWBS-CQSZACIVSA-N	439.534	1.743	50	20	IDGD	
Cn1nc(-c2cc(F)cc(F)c2)cc1NC(=O)C(=O)NNC(=O)Cc1ccc(F)cc1	773528434	AULCGOGWKYEMPU-UHFFFAOYSA-N	431.374	1.833	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ccccc2[N+](=O)[O-])cc1S(=O)(=O)NC1CC1	773654340	SENCTNMURFGSDM-UHFFFAOYSA-N	433.446	1.426	50	20	IDGD	
CN1CCN(C(=O)c2ccccc2NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2)CC1	773657041	VHESGEPAJAJRAQ-UHFFFAOYSA-N	426.433	1.064	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNc2ccc(C#N)cc2)cc1S(=O)(=O)N(C)C	773700325	IQJVMQDKKCHHMY-UHFFFAOYSA-N	431.474	1.289	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)N[C@H]2CCN(c3cccc(Br)c3)C2=O)n1	775227219	YCPBSFYGUKJAEP-HNNXBMFYSA-N	449.309	1.398	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)NCCC(=O)NNc2cccc(S(C)(=O)=O)c2)cc1	776534684	OZRIONJWLZJHAX-UHFFFAOYSA-N	439.515	1.104	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1CNC(=O)NNc1cccc(S(C)(=O)=O)c1	776611139	QIZGFLPQYIZSPU-UHFFFAOYSA-N	426.520	1.167	50	20	IDGD	
Cc1ccc(Cl)c(OCC(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1	778221875	LNBRITWWDWTAEC-KRWDZBQOSA-N	434.832	1.558	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)N2CC[C@@H](OCCN3CCOCC3)C2)c1C	778333868	GKDKRIOLTFCTTA-ONQWYEKWSA-N	430.549	1.608	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)[C@H]2CS[C@H](Cc3ccccc3F)C(=O)N2)nc1C	778423064	ZPSWNUQULUUFCV-HZPDHXFCSA-N	447.492	1.387	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)c1cc(S(=O)(=O)N(C)C)cn1C	778538769	QOIXHZZEYOTBSY-UHFFFAOYSA-N	447.542	1.782	50	20	IDGD	
C[C@H](C(=O)NNc1ccc([N+](=O)[O-])cc1Br)S(=O)(=O)C1CCOCC1	779144914	BGIAITMOEYIFBS-SECBINFHSA-N	436.284	1.783	50	20	IDGD	
O=C(NNC(=O)[C@@H](O)[C@@H](O)c1nc2ccccc2s1)c1cccc(Br)c1	779526065	ULFGSGYRCXDYIO-UONOGXRCSA-N	436.287	1.914	50	20	IDGD	
COc1ccc(C[C@H](C)C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)cc1OC	781322377	NOFIGJNKRAEHKO-AWEZNQCLSA-N	425.441	1.758	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)cc1)C(=O)Nc1cccc(I)c1	782833434	IHCJLBOLWPDPMD-UHFFFAOYSA-N	425.182	1.397	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)NCc1ccc(N2CCOC2=O)cc1	783021729	UXLWXJGSKSQUSE-UHFFFAOYSA-N	435.481	1.779	50	20	IDGD	
O=C(NNc1nccnc1Cl)C(=O)Nc1cccc(F)c1I	784780761	LHXHWSHXARQKLB-UHFFFAOYSA-N	435.584	1.956	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ccnc(N(C)C)n2)cc1OCC1CCOCC1	784977206	ATKUDUZXDFCJQG-UHFFFAOYSA-N	428.493	1.738	50	20	IDGD	
COc1cc(F)cc(NNC(=O)C(=O)Nc2ccc(C(=O)N3CCOCC3)c(F)c2)c1	785234119	HUCONWLHIBBKDH-UHFFFAOYSA-N	434.399	1.528	50	20	IDGD	
COC(=O)CCc1cccc(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)c1	786423125	RLTRCWPALDZYRP-UHFFFAOYSA-N	437.456	1.008	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cc(N3CCNC3=O)ccc2C)c2ccccc2n1	787541938	YHKWCHAIIHESCK-UHFFFAOYSA-N	446.467	1.781	50	20	IDGD	
COc1cc(NNC(=O)NCc2ccc(C(=O)N3CCNC(=O)C3)cc2)ccc1Cl	788860180	OHXMTICZSIPHEW-UHFFFAOYSA-N	431.880	1.747	50	20	IDGD	
O=C(Cn1c(S)nc2ccccc2c1=O)NNC(=O)c1ccc(Br)s1	789249043	BGZGENPFACMVTE-UHFFFAOYSA-N	439.316	1.970	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2cc(C)c([N+](=O)[O-])cc2C)cc1	789435998	WNMBFNBGTFINIX-UHFFFAOYSA-N	449.489	1.993	50	20	IDGD	
Cc1ccnc(-n2nccc2NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)c1	789811572	FFAUXHZTEREAMR-LPHOPBHVSA-N	434.456	1.234	50	20	IDGD	
CC(C)(C)OC(=O)Nc1ccccc1CCC(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1	790483229	FSQCDCVSDJWOBB-CQSZACIVSA-N	425.507	1.548	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)N[C@@H]2CCN(Cc3ccc(C)cc3)C2=O)c1	790699872	YVOZYUGPRXNFPT-LJQANCHMSA-N	426.473	1.757	50	20	IDGD	
CCS(=O)(=O)c1ccc([C@@H](C)NC(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1	790989982	WYYIPZMQAOFSHZ-CYBMUJFWSA-N	433.486	1.957	50	20	IDGD	
CS(=O)(=O)c1cc(NC(=O)C(=O)NNc2cccc(F)c2[N+](=O)[O-])ccc1Cl	790998887	KUMAQWRUUFUQSL-UHFFFAOYSA-N	430.801	1.873	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)NNC(=O)CNC(=O)OCc2ccccc2)c(F)c1	794598820	NNJZPLCQPWIGKT-UHFFFAOYSA-N	438.437	1.020	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CC[C@@H]3[C@H](CCN3C(=O)OC(C)(C)C)C2)n1	795126575	DJMISOSLVHXBFM-HUUCEWRRSA-N	437.566	1.473	50	20	IDGD	
Cc1cc(OCC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)ccc1[N+](=O)[O-]	797405145	YQHHVCZTZLBENS-UHFFFAOYSA-N	441.488	1.642	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(Cl)c(CN3CCOCC3)c2)c1	797534904	FUXZFNRMKTXIOH-UHFFFAOYSA-N	441.875	1.444	50	20	IDGD	
CCn1cc(C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c(C(F)(F)F)n1	797934737	SIODRFCYUWSBIH-UHFFFAOYSA-N	429.311	1.448	50	20	IDGD	
CC(C)n1ncc(C(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)c1N	798826612	KQKJODBMKDOQBJ-UHFFFAOYSA-N	445.483	1.879	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2cc(F)c(Br)cc2Cl)n1	799259253	WQZGPKFTWZTKIU-UHFFFAOYSA-N	446.664	1.841	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)c(C)c(OC)c1	800622304	KFDSXWUCMVROAK-UHFFFAOYSA-N	426.473	1.551	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc(Br)c3c(c2)OCCO3)cc1	801110895	JHYYWMJGZCTDIH-UHFFFAOYSA-N	434.246	1.928	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1cc([N+](=O)[O-])cc(I)c1C	801479385	ZYQARHRCESMNNW-QMMMGPOBSA-N	449.201	1.611	50	20	IDGD	
O=C(N=c1cc[nH]cc1)NNC(=O)c1cccc(S(=O)(=O)NCc2cccs2)c1	802025500	JOXXRWNSOGLGHO-UHFFFAOYSA-N	431.499	1.510	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2ccc(=O)n(-c3ccccc3F)n2)cc1	802064389	OUYCTXMXRBSVJB-UHFFFAOYSA-N	445.432	1.242	50	20	IDGD	
COc1ccc(CN2CC[C@H](NC(=O)NNC(=O)c3ccc(C#N)cc3)C2=O)c(OC)c1	805027316	JUXJKDSUBJYXER-SFHVURJKSA-N	437.456	1.321	50	20	IDGD	
CC[C@H](NC(=O)NNc1ccc(-n2ccnc2)nn1)[C@@H]1CN(Cc2ccccc2)CCO1	805203701	QOUBMNNYQZQZKC-OALUTQOASA-N	436.520	1.968	50	20	IDGD	
COc1cnc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)s1	806515128	OLONAXKSJGMUES-UHFFFAOYSA-N	439.519	1.793	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)C(=O)Nc1cc(F)c(N2CCOCC2)cc1F	806972221	LWBHWQMRWMKGBJ-UHFFFAOYSA-N	449.370	1.109	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccc(N3CCCCCC3)cc2C)n1	806975338	UPFBCPHXVCBNER-UHFFFAOYSA-N	426.521	1.975	50	20	IDGD	
CNC(=O)c1cccc(NC(=O)C(=O)NNc2nccnc2C2CCC2)c1Br	807462305	UEXCOOKPCZUBTN-UHFFFAOYSA-N	447.293	1.948	50	20	IDGD	
COc1cccc2c(C(=O)NNc3ccc(S(=O)(=O)N4CCN(C)CC4)cc3)n[nH]c12	809664925	OQOISMFIJJBVGY-UHFFFAOYSA-N	444.517	1.265	50	20	IDGD	
Cc1c(Cl)c(C(F)(F)F)nn1CC(=O)NNC(=O)NCCNC(=O)OC(C)(C)C	810619393	PSSJVPWHSMDDGE-UHFFFAOYSA-N	442.826	1.719	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)N(C[C@@H]2CCCO2)[C@@H]2CCS(=O)(=O)C2)c1C	811966823	FUOKATWBUGYKPQ-JLJDZFQCSA-N	449.573	1.853	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)N[C@H]1C[C@H](C)S(=O)(=O)c2sccc21	812649958	LQFWNHRBJITZCK-GWCFXTLKSA-N	433.515	1.955	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])cccc1-c1ncco1	815566324	QDCIRWJUOIVAQG-UHFFFAOYSA-N	439.384	1.723	50	20	IDGD	
C#CCOc1cc(F)ccc1NC(=O)C(=O)NNc1ccccc1S(=O)(=O)N(C)C	815751613	GVAGBZYFQQDVLV-UHFFFAOYSA-N	434.449	1.170	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2CCCO2)cc1NC(=O)C1CCCCC1	815779618	NSYXHMHMXAVLIW-QGZVFWFLSA-N	432.477	1.479	50	20	IDGD	
CCOc1ccc(NNC(=O)C(=O)Nc2cccc(S(=O)(=O)NC3CC3)c2C)cc1	815815490	CVELMXHKOVVLKY-UHFFFAOYSA-N	432.502	1.916	50	20	IDGD	
CC(C)c1nnc(NC(=O)CCC(=O)NNc2ccccc2S(=O)(=O)N(C)C)s1	817055203	QYLGOWUIBDOQOW-UHFFFAOYSA-N	440.551	1.774	50	20	IDGD	
CCOc1ccc(OCc2ccc(C(=O)NN=Cc3cn(C)c(=O)n(C)c3=O)cc2)cc1	839387362	LNXGEFCUCYJSQQ-UHFFFAOYSA-N	436.468	1.826	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)CSc1nnnn1C1CC1	849201901	COJFVYDYAFCLSZ-SECBINFHSA-N	441.311	1.478	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)NCc2ccc(C(=O)NNc3ncccn3)cc2)cc1	913044388	UPWKMYIRKULENE-UHFFFAOYSA-N	440.485	1.670	50	20	IDGD	
COc1ccc(N2C[C@@H](C(=O)OCC(=O)NNC(=O)c3cccc(Cl)c3)CC2=O)cc1	913320879	DXMTZIOTQYTOAF-AWEZNQCLSA-N	445.859	1.706	50	20	IDGD	
CCN(CC)C(=O)N1CCC(C(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)CC1	915552300	VLBIEFRCMBFIIQ-UHFFFAOYSA-N	438.912	1.818	50	20	IDGD	
CCC(=O)c1ccc(OCC(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1	915789088	HZWYTWZTLADGBZ-UHFFFAOYSA-N	439.877	1.420	50	20	IDGD	
O=C(COCCOc1ccccc1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	915801790	FYOFZGPEWLSAKB-UHFFFAOYSA-N	447.513	1.328	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)c1nc(NCc2ccco2)ncc1Cl	915806228	JWFAAZQTZUCAFW-HNNXBMFYSA-N	429.820	1.936	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NCc3cccc(Cl)c3)nc2)CC1	915883810	MCDDDASOMIFOQB-UHFFFAOYSA-N	438.941	1.497	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@@H](c2ccco2)N2CCCCC2)c1	915896002	UJBCHAHBHIGUHL-KRWDZBQOSA-N	434.518	1.854	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H]2CCCN(Cc3ccccc3)C2)c1	916606271	BZIMLKNFYJDVNV-SFHVURJKSA-N	430.530	1.699	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN(C)Cc1cnn(-c2ccccc2)n1	917112683	OTXLYULJJYGXBH-UHFFFAOYSA-N	428.880	1.822	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NC2CCN(C(C)(C)C)CC2)cc1	918094988	RXLLLOLTXZZFGP-UHFFFAOYSA-N	439.582	1.209	50	20	IDGD	
C[C@@H](NC(=O)NN[C@@]1(C)CCS(=O)(=O)C1)c1cc2c(cc1Br)OCCO2	918097488	QXIUXXVMQAFUDB-HWPZZCPQSA-N	448.339	1.662	50	20	IDGD	
CC[C@@H](NC(=O)NNC(=O)COc1cccc(C)c1)c1ccccc1OCC(=O)NC	918222575	YCNIREBXDILFLA-GOSISDBHSA-N	428.489	1.980	50	20	IDGD	
NC(=O)[C@H]1CCCN1Cc1cccc(NC(=O)NNC(=O)c2nnc(O)c3ccccc23)c1	920928513	KOXLUNGKEBQLOJ-QGZVFWFLSA-N	449.471	1.252	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NN=Cc1ccc(N2CCN(C)CC2)c(F)c1	1321782946	CIXXGXPUPGTJBR-UHFFFAOYSA-N	446.552	1.943	50	20	IDGD	
O=C(NNC(=O)[C@H]1Nc2ccccc2S(=O)(=O)N1)Nc1ccc(Cl)cc1Cl	1327170629	CYPRSPRKLXYKLH-ZDUSSCGKSA-N	430.273	1.876	50	20	IDGD	
Cc1cscc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2	1778221729	CFNHKLZTFQJRTE-DENIHFKCSA-N	442.346	1.178	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](F)Cl)CCO3)C1	1778237823	LIRUTLGZCCKLBH-NJSLBKSFSA-N	433.908	1.608	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](C)n3ccccc3=O)C2)C1	1779267627	AKVOMYPAFRLDHH-PMUMKWKESA-N	426.311	1.023	50	20	IDGD	
CCc1cc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](F)Br)C2)nn1C	1780773671	LLBNGYCDGHIFGT-IIDMSEBBSA-N	445.333	1.801	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc(O)cc2F)C1	1780941034	LFMAAMZZKVXCCF-XAUMDUMWSA-N	428.888	1.913	50	20	IDGD	
O=C([C@H](F)Br)N1CC[C@@]2(C1)CN(C(=O)[C@H]1Cc3ccccc3CN1)CCO2	1781332091	ZQNMNENRWADXKC-JTDSTZFVSA-N	440.313	1.221	50	20	IDGD	
CSCC[C@@H](O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)Br)C1	1782001717	JVBQPQHSHILZQU-VMUDFCTBSA-N	437.400	1.398	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](O)Cc3ccccc3)C2)C1	1783344153	PJDJAMSUZFGSHX-ZWOKBUDYSA-N	439.350	1.593	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccc4cncn4c3)CCO2)C1	1783349740	SBFWZHRIXOUHQR-QFBILLFUSA-N	435.322	1.951	50	20	IDGD	
COc1cccc(CCC(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](C)Br)C3)C2)n1	1783529202	GOOPEZBGCWGQIM-AUUYWEPGSA-N	440.338	1.636	50	20	IDGD	
COc1ccccc1CC(=O)N1CCO[C@]2(CCN(C(=O)[C@H](C)Br)C2)C1	1783540354	UQDOHSKHQULWGH-IFXJQAMLSA-N	425.323	1.851	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)CCCNC(=O)OC(C)(C)C)CCO2)C1	1783884067	OIUUILLOMIJFJT-YWZLYKJASA-N	447.960	1.375	50	20	IDGD	
CCc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]3C2)nn1C	1783969144	DVSAFBGJJUXRKC-HPZZRFSDSA-N	441.370	1.607	50	20	IDGD	
COC(=O)[C@H]1CC[C@H](C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CO[Si](C)(C)C)C[C@@H]32)C1	1784081630	WUIJEFZQCMDENW-ATIWLJMLSA-N	440.613	1.407	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H](CC(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](F)Cl)CCO3)C1	1784152518	NXATUEUOHJUAEU-UVFQYZLESA-N	447.935	1.998	50	20	IDGD	
COc1cccc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)Br)C[C@@H]32)n1	1785201436	KGSPDOCMHURQSF-SDADXPQNSA-N	440.338	1.396	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3ccc(OC)cc3)[C@H]2C1	1786421583	BMRLHFIKBKBHOD-FFGOWVMKSA-N	438.952	1.861	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)c1snnc1C1CC1	1787739869	SZNQTIHYMFJNIK-AYGWYOGXSA-N	447.330	1.699	50	20	IDGD	
Cc1ccc(SCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](O)CCl)C[C@@H]32)cc1	1788094250	LUMYXNKAOLLXQM-OWLYRPNTSA-N	426.966	1.667	50	20	IDGD	
CCN1CCC(C(=O)NC2(c3ccc(NC(=O)c4cccc(B(O)O)c4)cc3)CCC2)CC1	1788149948	HZQMBDGQJXVGAL-UHFFFAOYSA-N	449.360	1.846	50	20	IDGD	
CCc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]3C2)cn1	1789922862	WMQHEUSTWYDAIE-TUUVXOQKSA-N	428.302	1.928	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cn4c(F)cccc4n3)[C@H]2C1	1790423680	RXLUWHDSJKLNFD-AYDFFVQHSA-N	438.887	1.321	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4ccnn4c3)[C@H]2C1	1790442815	AFUMLEVUHYAPFV-IKICRFKJSA-N	449.349	1.959	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cncc(O)c3)[C@H]2C1	1791108892	ZMLXCZJKQDBNKS-APYUEPQZSA-N	426.311	1.412	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(F)(F)F)C[C@@H]21	1791251708	QNHJXWUTVNSBKF-MZGVZZPPSA-N	449.857	1.948	50	20	IDGD	
O=C(/C=C/c1cnccn1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21	1791700126	NDSPYKJPTIUPRM-OTNOIYACSA-N	427.274	1.160	50	20	IDGD	
C#CCO[C@H](C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2	1793571504	XKDSXSGPMQPBLS-MXASKKJJSA-N	443.456	1.810	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)[C@H]1COc2ccccc2O1	1793842470	LXUYWUMKXYZFDE-LZYVBGRKSA-N	443.269	1.107	50	20	IDGD	
CN(C)c1cccc(OCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)C(C)(C)CCl)C3)c1	1793856231	CRQVOKNAPSYUAU-CWPLJXCYSA-N	437.968	1.986	50	20	IDGD	
Cc1ncccc1CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)CBr)C2	1793916797	NFDTZDYCMFCOJH-UEILYKACSA-N	438.366	1.943	50	20	IDGD	
Cc1noc(C)c1CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)Br)C2	1794139462	CGVGWIQVCASBJI-JAMKOXHTSA-N	428.327	1.597	50	20	IDGD	
CC(C)(C)n1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Br)C3)n1	1794421102	ZAYANYRPJRXYTE-ZMJPVWNMSA-N	431.306	1.532	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1ccc(Br)cn1)[C@@H](O)CCl	1794440164	USFKTHWSSCDGPS-XGUBFFRZSA-N	430.730	1.625	50	20	IDGD	
COC(=O)[C@H]1CCC[C@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCBr)C1	1795116896	DSYRHTWMBPHHQQ-JGFGOLAASA-N	445.354	1.340	50	20	IDGD	
CC(C)N[C@@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)CBr)C2)C(C)C	1795713179	FRKWLEXTWLSTKN-SIRPWMCASA-N	432.403	1.630	50	20	IDGD	
C[C@@H](CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)Oc1ccccc1	1796189897	CATUBIZMPWIIMH-DVWBAYGPSA-N	436.317	1.476	50	20	IDGD	
CO/C=C(\C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1797618311	WMJRLVHHNKBKSL-DLRZWJSXSA-N	445.944	1.258	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnn3cccc(F)c13)C2	1797957648	WPZKHXCADLNHDQ-ZSBFGKGUSA-N	434.544	1.528	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)COC(=O)C(F)(F)F	1798345031	JPNGLBHDADBPLY-VLEAKVRGSA-N	429.233	1.904	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CN(Cc3ccccc3)CCO1)C2	1799267908	HXTRQPLNYQRORN-LUYSREMJSA-N	449.979	1.494	50	20	IDGD	
C[C@@H](Oc1ccccn1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@](C)(Cl)CCl	1799278773	XNWMZWUTKLEIGJ-TWAUDHPGSA-N	430.332	1.675	50	20	IDGD	
C[C@H](Oc1ccccc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Br	1799347618	SQOARBTWXMZWOC-PLPKTUSISA-N	429.286	1.734	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3ccoc3cn1)C2)[C@@H](F)Br	1799349600	ZTBPRQANMFGTTC-BAESOJJISA-N	426.242	1.722	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)NC(=O)OC(C)(C)C	1800597822	SUGAJCZNLSHKOR-KBRXKUPHSA-N	448.358	1.641	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3nccnc3c1)C2	1800756865	FKOUPPWMHPVDJZ-MBMVNNNZSA-N	433.306	1.616	50	20	IDGD	
C[C@H](CNC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(Cl)Cl	1801015278	AVJXUJGVYZFKBY-FVCCEPFGSA-N	438.352	1.541	50	20	IDGD	
Cc1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CCC(=O)NN(C)C)cc2c[nH]nc12	1802338077	KACBBDCVFLUCOA-BCDXTJNWSA-N	426.521	1.496	50	20	IDGD	
CN(C)C(=O)NCC(=O)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@H]1c1cccnc1	1802680403	JKLXFNCFSWUXGR-QEJZJMRPSA-N	444.305	1.049	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@H]1CCN(C(=O)[C@@H]2CNC(=O)O2)[C@H]1c1cccnc1	1803011614	QVPNTLCLUYRKPF-RZFFKMDDSA-N	439.310	1.227	50	20	IDGD	
O=C(Cc1cnccn1)NC[C@@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1	1803295556	JLLUNDBQECFUPX-KXBFYZLASA-N	432.322	1.905	50	20	IDGD	
Cc1c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)ccc(F)c1F	1803651185	RJASESKNZSKNBR-BTTYYORXSA-N	443.454	1.837	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H](CNC(=O)[C@H](C)CC(N)=O)[C@H]1c1cccnc1	1803671842	NNIVUEYMJVNNBQ-JJAZEVLHSA-N	439.354	1.772	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)CN(C)C(=O)C(=O)O)[C@@H]1c1cccnc1	1803694762	LPKGCQUXKSFLKI-HLLBOEOZSA-N	438.912	1.038	50	20	IDGD	
C[C@H](CS(C)(=O)=O)C(=O)N1CCCC2(CCN(C(=O)CO[Si](C)(C)C)CC2)C1	1806042588	LRPDYRWPOYPKDU-MRXNPFEDSA-N	432.659	1.750	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)C(Cl)Cl)[C@@H]1c1cccnc1)c1nc[nH]c1[N+](=O)[O-]	1808370884	INFOFOYVJJEPAD-ZYHUDNBSSA-N	427.248	1.836	50	20	IDGD	
Cc1c[nH]cc1C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1808581026	RMAHIIVMYWSTPI-NQIIRXRSSA-N	432.289	1.031	50	20	IDGD	
Cn1cc(CC(=O)N2CC[C@H](CNC(=O)[C@@H](F)Br)[C@@H]2c2cccnc2)cn1	1808681064	OLLKEOLGGQDYRZ-HYVNUMGLSA-N	438.301	1.754	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)c1ccc2ncncc2c1	1809916032	VAZHMSDDUGCBNM-DBVUQKKJSA-N	439.903	1.944	50	20	IDGD	
O=C(CCc1ccsc1)N1CCCC2(CCN(C(=O)c3cccc(B(O)O)c3)CC2)C1	1810043025	VGYLTYJAXVRLQW-UHFFFAOYSA-N	440.374	1.906	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2c(F)c(C)nn2C)[C@H]1c1cccnc1	1813029530	OPWDWCMGSVDFPI-ZOBUZTSGSA-N	437.903	1.836	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)/C=N/N2CCCCC2)[C@@H]1c1cccnc1	1813030702	FXNMKWKDFVURPX-NJUJKJDKSA-N	435.956	1.813	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2ccc(F)s2)[C@@H]1c1cccnc1	1813070124	GEVGQLLQRKPWFP-MGPUTAFESA-N	447.536	1.975	50	20	IDGD	
CC[C@@H](O)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[nH]n1	1814770863	XSQSTMLZOAYSMA-JXBLVPALSA-N	429.481	1.307	50	20	IDGD	
CN[C@H](CC(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@](C)(Cl)CCl)CC2)C(=O)O	1815081594	DRGFZDNRRGXJMB-FUXNSRLFSA-N	437.349	1.354	50	20	IDGD	
CC(C)[C@H](S)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1815240150	KPAIWGGBSXNDTL-AEFFLSMTSA-N	430.339	1.350	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(O)n(C)n2)n[nH]1	1816125187	VPVIEXMXDRZDHS-SKDRFNHKSA-N	425.287	1.938	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)C2CCOCC2)n[nH]1	1817013317	NNWZMPYYJWWDLN-QGZVFWFLSA-N	441.492	1.141	50	20	IDGD	
Cc1ccnc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2cccc(B(O)O)c2)CC3)c1	1817468931	HWODWFLHSPMTSR-OAHLLOKOSA-N	436.302	1.066	50	20	IDGD	
COC(=O)c1ccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)[C@H](O)CCl)[nH]n2)cn1	1818222085	NHRRIMRUJYITLD-LSDHHAIUSA-N	435.868	1.497	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](O)CCl)CC2)c1cn2ccsc2n1	1819214856	WOHZYSYEGODAIP-GZMMTYOYSA-N	425.923	1.678	50	20	IDGD	
Cc1cc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)ccn1	1819752032	GQJRVUXUKPORLN-IBGZPJMESA-N	433.277	1.413	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1)c1nn[nH]c1C(F)(F)F	1820323570	PVTSTWYJIUNVEY-DTWKUNHWSA-N	435.794	1.452	50	20	IDGD	
COc1ccnc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)[C@@H](O)CCl)[nH]n2)c1OC	1820385930	HCNHCKYSCIOXBH-OLZOCXBDSA-N	437.884	1.728	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3nccnc3C(N)=O)sc2C1	1821032478	MJSRPAMWJNZUJX-NXEZZACHSA-N	436.925	1.665	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(F)cn2C)[nH]n1	1822415613	CSHODOGWNFXYRY-OAHLLOKOSA-N	433.488	1.566	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H]2C[C@@]2(F)Cl)n[nH]1	1822507240	MHZYMODMDKGMMB-BVRBVLIYSA-N	428.896	1.699	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2C[C@H]2C2CC2)CC1	1824070643	RUSRWQMTSOMKHK-ZVDOUQERSA-N	439.560	1.965	50	20	IDGD	
O=C1OCCN1CC(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H](F)Br)CC1	1824333231	ANWSKDHSSCARMG-UKRRQHHQSA-N	434.306	1.749	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)N[C@H]1CCc2nc(NC(=O)[C@H](Cl)COC)sc2C1	1826000104	KWPWRFRVOWFKEU-OUAUKWLOSA-N	431.946	1.017	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC[C@H]1C1CCN(C(=O)[C@H]2CC[C@H](O)CC2)CC1	1827060248	CPGYUYSYTLSCGP-NYVOZVTQSA-N	442.365	1.151	50	20	IDGD	
C[C@H](NC(=O)c1cnccn1)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H](F)Cl)CC1	1827608947	MRCQKVPTHDWFTC-JQFCIGGWSA-N	439.919	1.749	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)/C(C)=C/c3cccs3)CCO2)C1	1829706994	ZTCVTWWCLYNVAQ-NNFIISAESA-N	442.965	1.862	50	20	IDGD	
COc1cnc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)c(F)c1	1830357694	DRYDZBTWQHGEBC-FQEVSTJZSA-N	443.903	1.564	50	20	IDGD	
Cc1cc[nH]c1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2	1830535498	PHAUCYSTQPRYTP-KBXCAEBGSA-N	428.327	1.424	50	20	IDGD	
Cc1cc2cccc(C(=O)N3CCOC[C@]4(C3)CN(C(=O)[C@H](O)CCl)CCO4)c2[nH]1	1830728044	NNBQHTMNTKMEAX-UTKZUKDTSA-N	435.908	1.146	50	20	IDGD	
Cc1cc(C)c(OCC(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)c(C)c1	1831168899	QDJWNLABDLPPKR-PZJWPPBQSA-N	442.915	1.981	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)Cc2ccccn2)CC1	1831870558	AKWYKRCTVLIZHO-FQEVSTJZSA-N	429.565	1.617	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3ccnc(C)c3)CCO2)C1	1832627512	LGTPLIWUEODSPS-RXVVDRJESA-N	439.940	1.033	50	20	IDGD	
O=C(CCc1ccc(F)nc1)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1832837913	IUUZENHHRGRAMO-SFHVURJKSA-N	434.295	1.413	50	20	IDGD	
C[C@@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)c3ncnn3C)CC2)CC1	1833262615	YQVOHQKASARLJP-ZDUSSCGKSA-N	441.374	1.031	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)C3=NN(C)C(=O)CC3)CC2)CC1	1833529531	CNUPBOBALKFHIE-KRWDZBQOSA-N	439.988	1.574	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)Cc3cc(C)no3)CC2)CC1	1833734624	PEMWNFFRTIEIQJ-GOSISDBHSA-N	426.945	1.351	50	20	IDGD	
CCc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCBr)C3)C2)cn1	1833890234	WWZRUWZNUYXUSH-LJQANCHMSA-N	440.338	1.499	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(N2CCC(NC(=O)CC3CC3)CC2)CC1	1834557735	BWFWNYBEDFMYQS-WGOQTCKBSA-N	442.564	1.492	50	20	IDGD	
COc1cccc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCBr)CCO3)C2)c1	1834824249	ZWHVPSIIDQRWLA-LJQANCHMSA-N	441.322	1.550	50	20	IDGD	
Cc1nc(F)ccc1C(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836717806	CPOUEVQFFWLZJZ-QGZVFWFLSA-N	427.904	1.741	50	20	IDGD	
C[C@H](Cc1ccccn1)C(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836720348	QYYLASVGPKBWBK-OXQOHEQNSA-N	437.968	1.859	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)COc3cc(Cl)ccn3)CCO2)C1	1837654022	IFMYIWVPWMIFNY-HNAYVOBHSA-N	446.331	1.588	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)Nc1ccccn1)CCO2	1837738725	XXPBDHJBKWNBPD-LLGFUMIMSA-N	438.956	1.746	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@H](C)N(C)C(C)=O)CC2)CC1	1838106558	AFGBEGDKSVVGOT-KBXCAEBGSA-N	431.961	1.106	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cnc(Cl)s1)CCO2	1838158440	HCEJIFZOTHWQPE-KRWDZBQOSA-N	448.017	1.718	50	20	IDGD	
CC[S@](=O)CCC(=O)N1CCC(OC2CCN(C(=O)[C@H](Cl)COC)CC2)CC1	1838363059	SVSMDZPTOQKOAS-UULLZXFKSA-N	437.002	1.398	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccn(C(C)C)n3)CCO2)C1	1838780381	CSVXXEJPJYQVIX-UZLBHIALSA-N	426.945	1.942	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(O)c(OC)c3)CCO2)C1	1838972663	OTTZTOYUILYBJQ-KKSFZXQISA-N	440.924	1.878	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(OC)cc(OC)c3)C2)C1	1839146073	JLYYJHBNUOFJJL-WIYYLYMNSA-N	440.924	1.791	50	20	IDGD	
Cc1ncsc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2	1839151614	XXBPRAXCRSVHMX-IRXDYDNUSA-N	436.361	1.758	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CCC(F)(F)C3)C2)C1	1840029543	JALBQCLNLUKFGZ-XEZPLFJOSA-N	439.297	1.662	50	20	IDGD	
CCc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)cn1	1840030909	AJSHEHLWMVZDEO-AUUYWEPGSA-N	440.338	1.497	50	20	IDGD	
Cc1cc(C)nc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)c1	1840032139	OHTPRXADMVMVNF-HNAYVOBHSA-N	440.338	1.552	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)Oc1cccnc1)CCO2	1840453391	OWRQEECIINBNPH-OXFYSEKESA-N	425.913	1.323	50	20	IDGD	
CC(C)(C)OC(=O)N1CC2(CC[C@H](C(=O)N3CCCC34CN(C(=O)[C@H](F)Cl)C4)O2)C1	1841080737	JQIVHWJLQPOUCU-KGLIPLIRSA-N	445.919	1.893	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)CCc2ccc(F)nc2)C1	1842007597	JKQMILAPBQWDBZ-CVKSISIWSA-N	440.479	1.491	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)C#CC1(O)CCCCC1)C2	1843416183	INWQDLYOCMFSMV-KOEQRZSOSA-N	439.516	1.022	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2ccc3nccnc3c2)C1	1843779402	GONYRRTYHXWDRV-JFLMPSFJSA-N	445.483	1.581	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)c2nn(C)c(C)c2Br)C1	1844810716	PKONEYZFXBZDLA-NSHDSACASA-N	433.734	1.562	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC2(CCCN2C(=O)COCCNC(=O)OC(C)(C)C)C1	1845154960	NQNXPVYGXTXDAO-CYBMUJFWSA-N	448.358	1.515	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)Cc1csc(N2CCOCC2)n1	14805043	GMLKXJDKMWDDQR-UHFFFAOYSA-N	428.518	1.282	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1	15991526	LTGYLFVUMVVPQF-SFHVURJKSA-N	433.486	1.318	50	20	IDGD	
CCOC(=O)c1cc(C(=O)NNC(=O)c2cc(Br)c[nH]2)cc([N+](=O)[O-])c1	24122742	VDVUQEFCYHVIQA-UHFFFAOYSA-N	425.195	1.937	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)CN2C(=O)N[C@@](C)(C3CC3)C2=O)cc1OC	24288198	WYIPEUPROKRCNB-NRFANRHFSA-N	432.477	1.356	50	20	IDGD	
Cc1ccc(-n2cnnc2SCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1	24766737	VTJSDMWMHOSIQP-QGZVFWFLSA-N	425.470	1.655	50	20	IDGD	
CN(CC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)C(=O)OC(C)(C)C	60377825	YZFXPIJUOWTEDN-UHFFFAOYSA-N	440.522	1.099	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)Cc2csc(NC(=O)c3ccco3)n2)cc1	105110899	VKTOXHJVGFYSND-UHFFFAOYSA-N	429.458	1.799	50	20	IDGD	
CC(C)(C)SCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	727608469	UADBGDLKEIGPLU-UHFFFAOYSA-N	428.580	1.947	50	20	IDGD	
Cc1nc(C(=O)N([C@@H]2CCS(=O)(=O)C2)N(C)C)nn1-c1c(Cl)cccc1Cl	728234688	RKPSTIGCTPVYNV-LLVKDONJSA-N	432.333	1.988	50	20	IDGD	
C[C@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(S(=O)(=O)NNC(=O)C3CCCC3)cc2)C1	728259937	MJTWKUORVTWYGJ-GASCZTMLSA-N	443.591	1.853	50	20	IDGD	
CS(=O)(=O)N1CCCN(C(=O)NNC(=O)c2ccc(COc3ccccc3)o2)CC1	728944444	CIMIECAAUIBWMB-UHFFFAOYSA-N	436.490	1.180	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCCc2ccc(NC(C)=O)cc2)cc(OC)c1OC	728944486	DBYCQLLBKSRWDR-UHFFFAOYSA-N	430.461	1.858	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)CCNS(=O)(=O)/C=C\c2ccccc2)cn1	729693346	USPTWWYAFKQDGN-BENRWUELSA-N	435.531	1.388	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)[C@@H]1CCN(c2ccccc2Br)C1=O	730782288	LYEXOIRCDGPXBN-LBPRGKRZSA-N	448.273	1.734	50	20	IDGD	
COc1ccc(CCNC(=O)NNC(=O)COc2ccccc2O)cc1OC(F)F	730827032	NLYASNOPQVPLEV-UHFFFAOYSA-N	425.388	1.954	50	20	IDGD	
COc1cc(OC)c(CCNC(=O)NNC(=O)c2c(C)nc3ccccn23)c(OC)c1	731043577	GZJBVJYDYARAPE-UHFFFAOYSA-N	427.461	1.855	50	20	IDGD	
COc1cccc(C(=O)NNS(=O)(=O)c2cc(Br)cc([N+](=O)[O-])c2)c1O	731179155	VPHTVSRAPGCSDR-UHFFFAOYSA-N	446.235	1.695	50	20	IDGD	
COc1cc(C(=O)N2CCN(C(=O)NNC(=O)c3ccccc3OC)CC2)ccc1C	731500017	WPWWJXXZRYCCRM-UHFFFAOYSA-N	426.473	1.825	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCCc2ccc(O)c(OC)c2)nc1	734219369	TWFIHDWTDVTHDW-UHFFFAOYSA-N	437.522	1.695	50	20	IDGD	
C[C@H]1CN(Cc2ccccn2)CCC1=NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	734361863	JRHJSFCXXBKDAS-INIZCTEOSA-N	429.546	1.960	50	20	IDGD	
O=C(NNC(=O)c1cc2c(s1)CCCCCC2)N[C@H]1CCN(CCN2CCOCC2)C1	734686660	SECZXZUHRJSBFH-SFHVURJKSA-N	449.621	1.758	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)CNC(=O)CC2CCCCC2)CC1	734825277	AARWTIXWQAFVSP-UHFFFAOYSA-N	439.557	1.803	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)Cc2cccc3ccccc23)CC1	735118341	SNTYCTXMINEBST-UHFFFAOYSA-N	439.541	1.857	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN2CCN(CC(=O)NC3CCCCC3)CC2)cc1C	736309686	DMANLGVERXNJNE-UHFFFAOYSA-N	449.621	1.446	50	20	IDGD	
O=C(COC(=O)Cc1ccc(S(=O)(=O)CC(F)F)cc1)NNC(=O)c1cccs1	736917979	YRCOZMIANMBDRG-UHFFFAOYSA-N	446.453	1.334	50	20	IDGD	
COc1ccc(C(=O)NN=C(C)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1OC	739399904	JMKAZVIUJDLXON-UHFFFAOYSA-N	447.513	1.879	50	20	IDGD	
COc1ccc(NCC(=O)NN=C(C)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1	739400172	NDRPZBMLPUPTLT-UHFFFAOYSA-N	446.529	1.668	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)[C@H](C)NC(=O)c1ccc(Br)s1	740851580	MPSSKCVQWGEJCI-QMMMGPOBSA-N	433.328	1.081	50	20	IDGD	
O=C(COC(=O)c1cccc(CN2CCOCC2)c1)NNC(=O)c1ccc(Cl)cc1	741335906	IBYLAJMUFBBYPX-UHFFFAOYSA-N	431.876	1.790	50	20	IDGD	
C[C@@H](C(=O)N(C)CC(=O)NNC(=O)NCc1cccc(C(F)(F)F)c1)n1cccn1	742448229	ITBBHRLDMQCSAR-LBPRGKRZSA-N	426.399	1.452	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NCc2ccc(N3CCCC3=O)cc2)cc1	743509216	ZMMHLVCEFACLSU-UHFFFAOYSA-N	445.501	1.753	50	20	IDGD	
CCOC(=O)NNC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc(Br)s1	743734333	OJVQJHDIEABJTB-SECBINFHSA-N	440.341	1.831	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)Nc2ccnn2[C@H]2CCS(=O)(=O)C2)c1C	744378181	JWQIGIUMNXODQR-PNDHZVEESA-N	431.518	1.853	50	20	IDGD	
COc1ccc(-c2noc(CCC(=O)OCC(=O)NNC(=O)c3cccc(C#N)c3)n2)cc1	744541946	IVKFXGUCOQWISY-UHFFFAOYSA-N	449.423	1.554	50	20	IDGD	
Cc1cc(Br)c(N)c(C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)c1	745058278	JZMZJSKHJZDZGW-UHFFFAOYSA-N	431.246	1.829	50	20	IDGD	
O=C(NCCc1cc(Cl)c2c(c1)OCCO2)NNC(=O)c1cc([N+](=O)[O-])ccc1O	745404123	MBSVHPVFCPSZTH-UHFFFAOYSA-N	436.808	1.912	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)NC[C@@H](C)CN1CCN(C)CC1	745861186	AAWNIKIIEICMOX-MSOLQXFVSA-N	427.549	1.821	50	20	IDGD	
CC[C@H](C)C[C@@H](C)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	745889309	GVIRZKDMTJFXBR-LSDHHAIUSA-N	426.539	1.476	50	20	IDGD	
C[C@@]1(NNC(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CCS(=O)(=O)C1	745904126	MASFUUJOBHVWMA-SCLBCKFNSA-N	432.493	1.638	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)N[C@@H]1CC(=O)N([C@H]2C[C@H]2c2ccccc2)C1	745915386	YULSNEGICVWNFX-JLSDUUJJSA-N	446.467	1.436	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)NCC(C)(C)C(=O)NCC)c2ccccc2c1=O	746329229	XKBDMZRBDWIRFH-UHFFFAOYSA-N	444.536	1.693	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)NCCN1CCN(Cc2ccccc2)CC1	746744040	QADQTSFVYYAINA-UHFFFAOYSA-N	435.532	1.025	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)NCc1cccc(NC(=O)[C@@H]2CCCO2)c1	746755621	GXJDOGQADKYQTG-SFHVURJKSA-N	436.472	1.525	50	20	IDGD	
C[C@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(C(=O)NNC(=O)Cc3ccncc3)cc2)C1	747323063	ZAGLJQFIODZYEL-IYBDPMFKSA-N	430.530	1.752	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)NC1CCN(C2CCCCC2)CC1	747492211	LUVUJJNGCOWRGQ-UHFFFAOYSA-N	436.582	1.721	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)[C@@H](C)C1CC1)N(S(C)(=O)=O)CC2	747934095	BXUSPVSBYQYOEQ-BLLLJJGKSA-N	439.534	1.146	50	20	IDGD	
CC(C)c1nc(C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)nn1-c1ccccc1Cl	748171205	CFDJYSYDTVLNFH-NSHDSACASA-N	425.898	1.240	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NCCCN2CCN(c3ccncc3)CC2)cc1	748466040	UHFZDECQVORRGN-UHFFFAOYSA-N	442.520	1.012	50	20	IDGD	
COc1cc(Br)ccc1C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	748617726	CKIHJOAHRWVTSE-UHFFFAOYSA-N	427.276	1.936	50	20	IDGD	
Cn1c(=O)c2cc(C(=O)NNc3ccc(OCC(F)(F)F)cc3)n(C)c2n(C)c1=O	748710349	RXSSGTVHSHFKBT-UHFFFAOYSA-N	425.367	1.274	50	20	IDGD	
CNS(=O)(=O)CC(=O)NNc1nc2ccccc2c(=O)n1-c1ccc(C(C)C)cc1	751580136	CAVCGLMMPCZLHK-UHFFFAOYSA-N	429.502	1.501	50	20	IDGD	
C[C@@H](NC(=S)NNC(=O)C1CCN(S(=O)(=O)c2cc(F)ccc2F)CC1)C1CC1	751618113	CSOLYQDMVRRREM-LLVKDONJSA-N	446.545	1.659	50	20	IDGD	
CNC(=O)[C@@H](C)NC(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccc(OC)c(OC)c1	752748390	YMXPXJZZIWHPOA-DWKHYPNZSA-N	436.472	1.639	50	20	IDGD	
COc1c(S(=O)(=O)NNC(=O)NCC2CC2)cc(Br)c(C)c1[N+](=O)[O-]	755001196	FFFYMBIDXATBJG-UHFFFAOYSA-N	437.272	1.577	50	20	IDGD	
N#Cc1cc(F)c(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c(F)c1	755038077	ZEKXRUDWOGXNAI-UHFFFAOYSA-N	434.424	1.696	50	20	IDGD	
CC(=O)Nc1ccc(O)c(C(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)c1	755173289	CXBDOATULSZULN-UHFFFAOYSA-N	435.481	1.694	50	20	IDGD	
CCOc1ccc(Oc2ccc(NC(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)cc2)cc1	755430113	OGZAYLIQMUYRQU-CYBMUJFWSA-N	436.490	1.968	50	20	IDGD	
COc1cc(C=NNC(=O)c2ccc3c(c2)OCCO3)c([N+](=O)[O-])cc1OCC(=O)O	755627309	IJUNIWZWTAGDHJ-UHFFFAOYSA-N	431.357	1.602	50	20	IDGD	
COC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2ccc(O)cc2)c1Br	756172887	BUUDAWFKXANTPD-UHFFFAOYSA-N	436.218	1.341	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)cc1NS(C)(=O)=O	756517747	UPMFPTLJMZXFKB-UHFFFAOYSA-N	443.526	1.824	50	20	IDGD	
CCN(CC(=O)NNC(=O)c1ccc(OC)c(OC)c1)[C@H]1CCN(c2ccccc2)C1=O	756524635	KBRIXSFRHWYDSC-SFHVURJKSA-N	440.500	1.592	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2ccc3[nH]nc(C(=O)OC)c3c2)c2ccccc2c1=O	756572159	JFJRYEPOLLKMDC-UHFFFAOYSA-N	449.427	1.546	50	20	IDGD	
CNC(=O)Cn1ccc2ccc(NC(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)cc21	756762608	PLEQPOATPRGUSE-UHFFFAOYSA-N	447.455	1.101	50	20	IDGD	
NC(=O)c1ccc(NNC(=O)COc2ccc(C(=O)c3ccc(Cl)cc3)cc2)nn1	757409316	ZZQHOBYPQNULNT-UHFFFAOYSA-N	425.832	1.982	50	20	IDGD	
O=C(NNC(=O)C(=O)Nc1ccccn1)N[C@@H]1CCN(c2ccc(C(F)(F)F)cc2)C1	758784299	CLNONOQYGGCNMS-CYBMUJFWSA-N	436.394	1.648	50	20	IDGD	
O=C(NCCCc1ccc(Br)cc1F)NNC(=O)C(=O)Nc1ccccn1	758786184	YXBAJQULQJMMKS-UHFFFAOYSA-N	438.257	1.885	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CC(=O)N(c2cc(Cl)cc(Cl)c2)C1)C(=O)Nc1ccccn1	758833034	CYCGZZKFOAJFQL-SNVBAGLBSA-N	436.255	1.527	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2cccnc2)c1)c1ccc(S(=O)(=O)N2CCCC2)cc1	759637280	RCBBKYVRJMRVBM-UHFFFAOYSA-N	440.485	1.127	50	20	IDGD	
CCCn1c(=O)nc(O)c2c(C(=O)NNc3ccc(C(=O)OC)cn3)cc(C3CC3)nc21	759722046	UZPXYPFGFUOYAL-UHFFFAOYSA-N	438.444	1.723	50	20	IDGD	
COc1ccc(S(N)(=O)=O)cc1NC(=O)COC(=O)/C(C#N)=C\c1ccc(O)cc1	759900062	USZYGTIYFBMADQ-JYRVWZFOSA-N	431.426	1.137	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)c1cnc([C@H]2CCCO2)s1	760224944	YKSKQTHZPMKRRG-QGZVFWFLSA-N	429.546	1.968	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)Cc1csc(NC(=O)C(C)(C)C)n1	760437053	AJOCNSFAQMPEKJ-UHFFFAOYSA-N	427.527	1.732	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)c1cn(-c2ccc(C(F)(F)F)cn2)nn1	760441800	FIERVZWXZIOQGQ-UHFFFAOYSA-N	443.386	1.357	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)NC[C@]1(N2CCOCC2)CCSC1	761661437	LHJXRFHEQJCMEL-LJQANCHMSA-N	440.591	1.326	50	20	IDGD	
CC(=NNC(=O)c1cccc(S(C)(=O)=O)c1)c1c(C)nn(CCS(C)(=O)=O)c1C	763165271	HPECOKTXJVVUBG-UHFFFAOYSA-N	440.547	1.102	50	20	IDGD	
Cc1c(Br)cc(C(=O)O)cc1S(=O)(=O)NNC(=O)NCc1ccco1	763284488	SPEQGURYMSABKE-UHFFFAOYSA-N	432.252	1.741	50	20	IDGD	
COC(=O)Nc1cc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)ccc1F	763604287	LAWGQWVUFXSUPW-UHFFFAOYSA-N	440.391	1.794	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)C(=O)Nc1cccc(OC[C@@H]2CCCO2)c1	763680134	RWRWQHSOSGRVSW-INIZCTEOSA-N	431.420	1.548	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)n([C@H]2C[C@H]3CC[C@H]2C3)n1	763680178	DAZJLUFFEGJNDL-BQFCYCMXSA-N	436.472	1.589	50	20	IDGD	
Cc1ccc(NC(=O)C(C)C)cc1NC(=O)C(=O)NNC(=O)COc1ccc(C#N)cc1	763681821	OLAQRFURSYKBTB-UHFFFAOYSA-N	437.456	1.626	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])cc1OC(C)C	763804302	RPJVLMWKFPZHRH-UHFFFAOYSA-N	446.416	1.556	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cccc([C@@H]3CNC(=O)C3)c2)c1C	763849790	MZOIPKINNFDZCJ-WBVHZDCISA-N	438.484	1.460	50	20	IDGD	
CCCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(OCC)c(OC)c2)cc1	763899843	CTCNJCPAMDRKKW-UHFFFAOYSA-N	442.472	1.633	50	20	IDGD	
Cc1cc(C(=O)NCC(C)C)ccc1NC(=O)C(=O)NNC(=O)Cc1ccc(F)cc1	763919438	SWEJYWGTJAHUIO-UHFFFAOYSA-N	428.464	1.849	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc2c(ccn2CCN2CCOCC2)c1	763955635	FLQKTKRPELCVAJ-UHFFFAOYSA-N	449.511	1.682	50	20	IDGD	
CS(=O)(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCCCC3)cc1	763967372	BJHUCVGECHYWBT-UHFFFAOYSA-N	449.554	1.961	50	20	IDGD	
O=C(NNC(=O)c1cc(Cl)ccc1O)C(=O)Nc1ccc(CCN2CCOCC2)cc1	763974182	MXKPGBZXBYUVGD-UHFFFAOYSA-N	446.891	1.320	50	20	IDGD	
Cc1cc(C)n(-c2ccc(NC(=O)C(=O)NNC(=O)c3cc(Cl)ccc3O)cn2)n1	763977962	BSDQNIDTVKIHRQ-UHFFFAOYSA-N	428.836	1.643	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)Nc1ccc(OC(F)F)c(F)c1	764005147	VTAJQQHBOVZAON-UHFFFAOYSA-N	449.183	1.928	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1Br	764005929	GIQCYVXSMSNLCT-UHFFFAOYSA-N	434.246	1.928	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2cccc3c2CN(c2ccccn2)C3)c1O	764131220	OQFSQBYXDQUWLY-UHFFFAOYSA-N	447.451	1.716	50	20	IDGD	
Cc1cc(C)cc(-n2nc(NC(=O)C(=O)NNC(=O)[C@H]3Cc4ccccc4O3)cc2C)c1	764168466	PFMPEHSIAMIRTI-LJQANCHMSA-N	433.468	1.887	50	20	IDGD	
C[C@H]1CN(C(=O)c2ccc(NC(=O)C(=O)NNC(=O)CCc3ccco3)cc2)C[C@@H](C)O1	764170867	ZDAHEBHMRZDIGM-GASCZTMLSA-N	442.472	1.248	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)C(C)C)cc1NC(=O)C(=O)NNC(=O)CCC(C)C	764202310	BSQTWLHRLCXVRW-UHFFFAOYSA-N	426.539	1.546	50	20	IDGD	
CN(C)N(C(=O)c1ccc(F)c(I)c1)[C@@H]1CCS(=O)(=O)C1	764229335	KSIKYURPSYFZMW-SNVBAGLBSA-N	426.251	1.536	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)C(=O)Nc1ccc(-n2nccn2)cc1C(F)(F)F	764263719	LAIWIESUJMTFLG-UHFFFAOYSA-N	433.350	1.010	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)C(=O)Nc1ccccc1OC[C@H]1CCCCO1	764363603	SSSCQUKAROKMFX-GOSISDBHSA-N	441.484	1.937	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)n(-c2ccccc2)n1	764378032	HEROHPDUYOBSBZ-UHFFFAOYSA-N	429.383	1.938	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cccc4c3oc(=O)n4C)n[nH]2)cc1	764384740	KOUYUUQCAZATQN-UHFFFAOYSA-N	448.439	1.484	50	20	IDGD	
CS(=O)(=O)NCCc1ccc(C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)s1	765570328	ZDKZVJKAGCMOCP-UHFFFAOYSA-N	439.544	1.366	50	20	IDGD	
CC(C)Oc1cc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)ccn1	765736983	CWDZHTHNXNRCBF-UHFFFAOYSA-N	425.489	1.088	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)N[C@H]2CCC[C@H]2C(=O)NC)c2ccccc2c1=O	766277519	ULMUXFMOSZBUNR-SJORKVTESA-N	442.520	1.445	50	20	IDGD	
O=C(Cc1csc2nccn12)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	766664170	OQZBGZQDSYQEFJ-UHFFFAOYSA-N	446.964	1.557	50	20	IDGD	
CO[C@@H](C(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1)c1ccccc1	766664910	XNXZFTKDEQXTJM-OAQYLSRUSA-N	430.936	1.993	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)CCc1c(C)nc2cc(O)nn2c1C	767308756	LZEMSJXVBKGNEO-UHFFFAOYSA-N	439.472	1.226	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)nc1)C(=O)Nc1cnc(Cl)c(Br)c1	768239688	NERUSKXHNIYEFY-UHFFFAOYSA-N	433.049	1.946	50	20	IDGD	
CC(C)c1cc(NC(=O)C(=O)NNC(=O)c2cc3ccccc3o2)n(-c2ncccn2)n1	768242173	PLVZDTNNCANGOK-UHFFFAOYSA-N	433.428	1.932	50	20	IDGD	
COc1ccc(NNC(=O)CS(=O)(=O)c2ccc(C(C)=O)c(F)c2)c([N+](=O)[O-])c1	769310673	LMVYNKQSTYLMEF-UHFFFAOYSA-N	425.394	1.862	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)NC(C(N)=O)C(N)=O)c(C)n1-c1cccc(C(F)(F)F)c1	769757426	YBNJKRMQEIVJOL-NTUHNPAUSA-N	433.390	1.475	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)N[C@@H]1CC(=O)N(c2c(F)cccc2F)C1	770845594	ZJTIQMDINKLQGX-BDJLRTHQSA-N	432.383	1.241	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)CCc3nc(O)c4c5c(sc4n3)CCC5)nc21	771019906	GSYVOVJNIQZROU-UHFFFAOYSA-N	426.462	1.344	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1ccc(S(=O)(=O)N(C)C2CCCCC2)cc1	771963596	NZPQIXLCQVOWBS-AWEZNQCLSA-N	439.534	1.743	50	20	IDGD	
CN(C)N(C(=O)c1cc(I)c(F)cc1F)[C@H]1CCS(=O)(=O)C1	772038104	WFRNGEALAXESFE-QMMMGPOBSA-N	444.241	1.675	50	20	IDGD	
COc1ccc(C(=O)O[C@H](C)C(=O)NNC(=O)CC(C)C)nc1I	772238397	URGPIYBNPSYQSL-SECBINFHSA-N	449.245	1.434	50	20	IDGD	
CC[C@@]1(C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)CCCN1C(=O)OC(C)(C)C	772558753	VCIZANXTFWMTSR-QFIPXVFZSA-N	443.504	1.874	50	20	IDGD	
Cc1cc(S(=O)(=O)NCCNC(=O)NNc2ncnc3ccsc23)c(C)s1	772627803	YXDWZHBVXBASDD-UHFFFAOYSA-N	426.549	1.974	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNS(=O)(=O)c1cccc(S(C)(=O)=O)c1	773267043	VSLUUFVHKNREAX-LLVKDONJSA-N	432.907	1.521	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCCCCCS(C)(=O)=O)cc1Br	773298264	XSDTYCKLMZABFN-UHFFFAOYSA-N	436.328	1.617	50	20	IDGD	
COC(=O)N1CCC[C@@H]([C@@H](C)NC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)C1	773567211	MALPBVWOGWKNCO-CHWSQXEVSA-N	441.510	1.293	50	20	IDGD	
COc1ccc(C(=O)N2CCOCC2)cc1NC(=O)C(=O)NNc1ccc2ccccc2n1	773655290	PWJMMHAKRULYBY-UHFFFAOYSA-N	449.467	1.798	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)CN2C(=O)N[C@@]3(C[C@H](C)CC(C)(C)C3)C2=O)nc1C	778423489	DEGPPCQLABBSMG-XUSGNXJCSA-N	446.508	1.542	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)NCc1ccc(N2CCOCC2)c(F)c1	778620427	MGXHTZLHLMSOLF-UHFFFAOYSA-N	425.461	1.017	50	20	IDGD	
COC[C@@H](C)n1ccc(NC(=O)C(=O)NNC(=O)COc2cccc(C(F)(F)F)c2)n1	778708004	ZDVQNFCDERWSPQ-LLVKDONJSA-N	443.382	1.274	50	20	IDGD	
COc1cccc([C@H]2[C@@H](NC(=O)NNC(=O)C(=O)Nc3ccccn3)CCN2C2CC2)c1	779400382	NOZUNAIQNJQYGU-HKUYNNGSSA-N	438.488	1.337	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)c2n[nH]c3c2CN(C(=O)OC(C)(C)C)CC3)c1	782688229	VVAXQBNUNLYQPS-UHFFFAOYSA-N	443.464	1.131	50	20	IDGD	
CN(C)CCNC(=O)Cn1cc(NC(=O)C(=O)NN(c2ccccc2)c2ccccc2)cn1	782820539	CWKYWUXYKNXBPK-UHFFFAOYSA-N	449.515	1.369	50	20	IDGD	
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)NNC(=O)c1cccc2cccnc12	783822563	VFHLVHCKGIRIIS-UHFFFAOYSA-N	430.398	1.553	50	20	IDGD	
O=C(NNC(=O)C(=O)N1CCCC1)C(=O)Nc1ccc2nc(Cc3ccccc3)oc2c1	784002956	NIGCETAECLHNAL-UHFFFAOYSA-N	435.440	1.127	50	20	IDGD	
CNS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccc(OC(F)(F)F)cc2)cc1	784801610	FPZCKSBHZAXBNU-UHFFFAOYSA-N	432.380	1.575	50	20	IDGD	
O=C(NNc1cc(F)c(F)cc1F)C(=O)Nc1ncn(CC(=O)N2CCCCCC2)n1	784893474	UPYPJGMELSEAIA-UHFFFAOYSA-N	439.398	1.180	50	20	IDGD	
CCCc1c(NC(=O)C(=O)NNC(=O)c2scnc2C)cnn1-c1cccc(C#N)c1	785990578	JNFIICPFVHYFEO-UHFFFAOYSA-N	437.485	1.861	50	20	IDGD	
COc1nccnc1NNC(=O)Nc1cnc(N2CCN(C(=O)OC(C)(C)C)CC2)nc1	786179605	QWYYKWQQPLJQBF-UHFFFAOYSA-N	445.484	1.481	50	20	IDGD	
CCS(=O)(=O)CCn1cc(C)c(NC(=O)NNC(=O)c2ccc(OC)c(OC)c2)n1	786719542	WYWUWAKPLOQIIK-UHFFFAOYSA-N	439.494	1.110	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)c1cnn(-c2ccncc2)c1C(F)F	787490388	BBPAYWCBGPKOHF-UHFFFAOYSA-N	448.817	1.936	50	20	IDGD	
CN(C)NC(=O)Nc1cccc(NS(=O)(=O)c2ccc(OCc3ncnn3C)cc2)c1	788093233	OFGVCIWDBLAUPL-UHFFFAOYSA-N	445.505	1.793	50	20	IDGD	
Cn1c(=O)n(C)c2nc(NC(=O)CCC(=O)NNc3ccc(F)c([N+](=O)[O-])c3)ccc21	788146824	FQEDPWZGTDZMRH-UHFFFAOYSA-N	431.384	1.181	50	20	IDGD	
NS(=O)(=O)c1ccccc1NNC(=O)C1CCN(C(=O)CCc2ccccc2)CC1	788232893	ZRRUYQPCYBBHDD-UHFFFAOYSA-N	430.530	1.649	50	20	IDGD	
Cn1cc(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)c(-c2ccoc2)n1	789971537	UYMWJUXPFCIANL-UHFFFAOYSA-N	431.474	1.458	50	20	IDGD	
CCS(=O)(=O)c1ccc([C@H](C)NC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1	790988041	LWDJGMAEEPGNOW-UGSOOPFHSA-N	433.486	1.712	50	20	IDGD	
CSSCCNC(=O)C1CCN(S(=O)(=O)c2ccc3c(c2)OCCO3)CC1	791113360	FQQCAYYLYXZMGG-UHFFFAOYSA-N	432.589	1.986	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CSc1nnnn1-c1ccccc1OC	792368313	VKCHCBVJHSDMPO-UHFFFAOYSA-N	448.892	1.886	50	20	IDGD	
O=C(NNC(=O)[C@H](F)CC1CCCCC1)c1cccc(S(=O)(=O)N2CCOCC2)c1	792773429	RKMYUBZYYPELGG-GOSISDBHSA-N	441.525	1.777	50	20	IDGD	
COc1ccc(C(=O)CCC(=O)N([C@@H]2CCS(=O)(=O)C2)N(C)C)c(OC)c1OC	792853057	CDXNXGVYBOPPHL-CYBMUJFWSA-N	428.507	1.168	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)NCc2ccc(C(=O)N3C[C@H](C)O[C@@H](C)C3)cc2)n1	792919487	JKFXOTPWDBMDKM-HOTGVXAUSA-N	425.489	1.784	50	20	IDGD	
COCc1cc(C(=O)OC)cc(S(=O)(=O)NNC(=O)c2ccc3c(c2)OCCO3)c1	793353775	RFNNHKFKPPAXHB-UHFFFAOYSA-N	436.442	1.014	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)[C@H](C)N(C)CC(F)(F)F)n[nH]2)cc1OC	793751960	YZPHGITWXGFJHT-JTQLQIEISA-N	429.399	1.738	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NCCN(C)S(=O)(=O)c2ccc(F)cc2)cc1	798118350	RCPUTUMMJVBPNR-UHFFFAOYSA-N	438.481	1.164	50	20	IDGD	
N#Cc1cc(S(=O)(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)ccc1C(F)(F)F	799914416	NXZYXCUDDMSIGL-UHFFFAOYSA-N	437.363	1.176	50	20	IDGD	
CC(C)(C)n1ncnc1CNC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	800742598	WJAZCTCYNOSKHE-UHFFFAOYSA-N	428.541	1.076	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@@]1(C)CCN(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)C1	800983749	SZKRSZNZTQBAML-HXUWFJFHSA-N	444.496	1.253	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2CCCN(C(=O)Cc3ccc(F)cc3)C2)cc1	801108878	UHZMWHPJCPCEHW-QGZVFWFLSA-N	440.475	1.701	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=O)Nc2ccc3c(c2)OCO3)c1	802093340	REONOZBRUKANFD-UHFFFAOYSA-N	440.865	1.786	50	20	IDGD	
O=C(NNc1c(F)cc(C(=O)NC2CC2)cc1F)C(=O)Nc1ccc(OC(F)F)nc1	802573796	QWYVCSOIMAOHRG-UHFFFAOYSA-N	441.341	1.935	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)N2CCC[C@@H]2C(=O)NNc2cccc(F)n2)o1	804770312	ZXHWUYLLIZTJGI-LLVKDONJSA-N	426.426	1.287	50	20	IDGD	
N#Cc1ccc(N2CC[C@H](C(=O)NNC(=O)c3nn(-c4ccccc4)cc3O)C2)c(F)c1	806346610	ODZZUHHETMLOOH-HNNXBMFYSA-N	434.431	1.876	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)NNC(=O)C(=O)Nc1cc(Cl)cc2c1OCC(=O)N2	806975035	LJVMVGGIIUZBSF-UHFFFAOYSA-N	441.831	1.481	50	20	IDGD	
COc1cc(NNC(=O)C(=O)Nc2ccc(F)c(S(=O)(=O)N(C)C)c2)ccc1Cl	807067905	BTPPPRCKSJLAAF-UHFFFAOYSA-N	444.872	1.820	50	20	IDGD	
COC[C@]1(C(=O)NNC(=O)COc2ccccc2F)CCN(C(=O)OC(C)(C)C)C1	809934274	OLQDCVJYOQIPPI-FQEVSTJZSA-N	425.457	1.626	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccoc2)c(C(=O)NCC(F)(F)F)cc1F	810386900	WOQOLDGQWLPYGU-UHFFFAOYSA-N	430.314	1.419	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)Cc1sc(N2CCOCC2)nc1-c1ccccc1	810467792	BXOOFTGOBLDLJE-UHFFFAOYSA-N	437.525	1.974	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc2c(C)nn(C)c2c1	812980015	KSGIAUCLMLLECW-UHFFFAOYSA-N	425.445	1.445	50	20	IDGD	
O=C(NNC(=O)c1cnn2c1OCCC2)c1nc(-c2ccccc2)n(-c2ccccc2)n1	814218708	YIDIQRLQVXESPI-UHFFFAOYSA-N	429.440	1.988	50	20	IDGD	
Cc1ccc(NC(=O)NNc2ccccc2S(=O)(=O)N(C)C)cc1S(N)(=O)=O	814641677	JVQXLXLIQGFIHN-UHFFFAOYSA-N	427.508	1.041	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccc([C@@H]3CCOC3)cc2)nc1	815586380	HOPMOMGZSDLADG-OAHLLOKOSA-N	447.517	1.354	50	20	IDGD	
O=C(COc1ccccc1-c1ccccc1)NNC(=O)c1ccc2[nH]c(=O)c(=O)[nH]c2c1	863996453	XATUXUPIGYIUDN-UHFFFAOYSA-N	430.420	1.723	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)[C@H]1CS[C@@H](Cc2ccccc2F)C(=O)N1	892500476	WDIPFONQKAQREU-SJORKVTESA-N	435.452	1.334	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)c1cnn(-c2ccc(F)cc2)c1C(F)(F)F	893186055	CVQPWJQODFQRJS-VIFPVBQESA-N	434.371	1.226	50	20	IDGD	
C[C@@H](CN1CCOCC1)C(=O)NN/C=C1/C(=O)N(c2ccccn2)C(=O)c2ccccc21	912745194	CEVWWHLIFKVSTL-TWQQJCIXSA-N	435.484	1.199	50	20	IDGD	
Cc1ccccc1[C@H](CC(=O)OCC(=O)NNC(=O)c1cccc(Cl)c1)NC(N)=O	914645315	WEUXNSCTDRYVDK-INIZCTEOSA-N	432.864	1.752	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)CNS(=O)(=O)c1ccc(C)cc1	915775543	HAFOWPVMUOLQLN-UHFFFAOYSA-N	429.502	1.033	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)c1cccnc1	915918462	TZAZQWZLGRCERD-OAHLLOKOSA-N	431.518	1.961	50	20	IDGD	
C[C@@H](CN1C[C@@H](C)O[C@H](C)C1)C(=O)NN=C1C(=O)Nc2cc(N3CCOCC3)ccc21	915954403	DMTRJPGZSSEICE-ARFHVFGLSA-N	429.521	1.041	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCN(C)c2ccccc2)c1	916225639	DLVAEYGOANFHJK-UHFFFAOYSA-N	447.561	1.798	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)N(C)c1ccccc1	916451135	DEWAAMRUDUGQAI-OAHLLOKOSA-N	433.534	1.406	50	20	IDGD	
O=C(CN1CCN(C(=O)CCC2CCCCC2)CC1)NNC(=O)c1ccc([N+](=O)[O-])cc1	917406209	LRAVVRMRLJWFOF-UHFFFAOYSA-N	445.520	1.861	50	20	IDGD	
COC(=O)c1sc(S(=O)(=O)NNC(=O)c2ccc(C)cc2O)c(C(=O)OC)c1C	917753330	HFWWKYMAPDPSFE-UHFFFAOYSA-N	442.471	1.267	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCCOCCc2ccccc2)c1	918096434	ZMDFXMJGQUNULV-UHFFFAOYSA-N	448.545	1.530	50	20	IDGD	
O=C(NNC(=O)c1ccc2nc(O)oc2c1)c1ccc(S(=O)(=O)N2CCCC2)cc1	919810560	MENCPTLCXWAXKM-UHFFFAOYSA-N	430.442	1.393	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCC2CCN(Cc3ccccc3)CC2)c1	920281003	JRNJJWPLDRPHOY-UHFFFAOYSA-N	444.557	1.946	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)[C@H](Cc1ccccc1)NC(=O)c1cccnc1	921302125	OIGQYBDBBCJTIP-FQEVSTJZSA-N	436.443	1.788	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)c2cc3c(c(S(N)(=O)=O)c2)CCC3)cc1OC	1328881765	YEDUPSIQXUNITG-UHFFFAOYSA-N	447.513	1.695	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)c2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)nc2ccccc21	1337740910	IMFOEJMTCFZIFF-MRXNPFEDSA-N	434.500	1.279	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCC(=O)NNC(=O)CSc2ccccc2O)cc1	1347360576	DTAITBLYJKESKT-UHFFFAOYSA-N	439.515	1.009	50	20	IDGD	
C[C@H](Nc1nccs1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2	1778066937	IYJNALQSNCEIAW-HNSFDTNUSA-N	430.958	1.057	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CN1CCCCC1=O)C2	1779545748	INOBMRLZUMIUFA-DYESRHJHSA-N	439.629	1.364	50	20	IDGD	
Cc1ncncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)CBr)C2	1779794850	WCJZKFZRHCPKSV-URKNILKWSA-N	439.354	1.944	50	20	IDGD	
O=C(c1ccc(N2CCCC2)c(F)c1)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1780143711	UAZBOWYCUXYJKL-RXVVDRJESA-N	439.915	1.469	50	20	IDGD	
Cc1n[nH]c(C)c1CC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Br)C2	1780826590	CIVFVPYZLNMUPF-UWWQBHOKSA-N	445.333	1.773	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)Cc3ccc(C(=O)OC)s3)CCO2)C1	1781218065	MNJHCOKQRFWEPQ-LIRRHRJNSA-N	428.938	1.925	50	20	IDGD	
CCn1nccc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)Br)C1	1781996599	OAVFFLTYXHIYQG-DDUZABMNSA-N	427.343	1.814	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(CCN(C(=O)c3n[nH]c4cccc(F)c34)C2)C1	1782479415	DDGBSDPGDSCXKF-SFHVURJKSA-N	439.285	1.931	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)Cc3cnc(C)s3)CCO2)C1	1783352954	KCBQKBJXQZRKCI-YOEHRIQHSA-N	430.368	1.997	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cnn4c3CCC4)CCO2)C1	1783353597	PZCQYEZDECABPQ-KSSFIOAISA-N	425.327	1.446	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)COc3cccc(N(C)C)c3)CCO2)C1	1783873185	LZIZGOVTRGIKHJ-NQIIRXRSSA-N	439.940	1.215	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(Cl)ncn3)C[C@@H]21	1783970319	RTBWEFFLMGLERE-MNXVOIDGSA-N	445.745	1.754	50	20	IDGD	
CC#C[C@H](CC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](Cl)COC)CCO2)c1ccc(O)cc1	1784019191	CCPHBQRMBSJCPM-RFWXGWTQSA-N	448.947	1.973	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccn4cncc34)C[C@@H]21	1786407371	ZXLKSGCTIVOCJF-QRTARXTBSA-N	435.322	1.713	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccnn3-c3ccccc3)[C@H]2C1	1787771282	KAMYOYSDIIEAAU-BOLBYERCSA-N	446.935	1.719	50	20	IDGD	
COc1ccnc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]3C2)c1	1789870587	PKMAAMCCNWZHII-BCRCDCHUSA-N	430.332	1.920	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccccc3O)C[C@@H]21	1791063610	MVSJQSXKYAVSMV-QEWYBTABSA-N	425.323	1.698	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)n3cccn3)[C@H]2C1	1791642103	AYTBQJQXMMRJQJ-YXMSTPNBSA-N	427.343	1.597	50	20	IDGD	
CC(=O)N[C@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@](C)(Cl)CCl)C2)C(C)(C)C	1793194178	LWDUARSEKNCERS-YHZMMZGRSA-N	436.380	1.363	50	20	IDGD	
C#CCCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1793882625	OPQFJINDNSXUHC-IVSAIRAKSA-N	427.929	1.122	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ncc(C)s1)C2	1796889857	MOKTZGCEVYAFBV-NGYDUSEUSA-N	428.518	1.837	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCCn1ccnc1)C2	1796893018	HPZOUWSBVIKNQA-ADDUXVCJSA-N	439.520	1.436	50	20	IDGD	
CSc1ncccc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc(B(O)O)c1)C2	1799012869	VGJNXRBXMZBGTF-BJWYYQGGSA-N	425.319	1.049	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)[S@](=O)c1ccccc1	1800217138	RDRSQWDATBQBAF-QFURWZGWSA-N	426.966	1.790	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc2c(c1)C(=O)CC2)c1cccc(B(O)O)c1	1800969126	XAJXOKBHJHXVGJ-ACDBMABISA-N	432.285	1.061	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCN1C(=O)c3ccccc3C1=O)C2	1802272826	GXUYKKKJAVNGHH-BASYENTBSA-N	447.919	1.565	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(-c3ccccc3)[nH]n1)C2	1802336025	BKGMQEKDSLMFIS-BCDXTJNWSA-N	438.532	1.702	50	20	IDGD	
C[C@@H](C#N)c1cccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CCC(=O)NN(C)C)c1	1802344334	WVMPRRHFWSWATF-QLIIJSOBSA-N	425.533	1.938	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1CCN(C(=O)[C@H](C)NC=O)[C@@H]1c1cccnc1	1803016017	WGHCIQIAORITAM-BFJAYTPKSA-N	425.327	1.253	50	20	IDGD	
N=C(N)SCCC(=O)N1CC[C@H](CNC(=O)CCBr)[C@H]1c1cccnc1	1806340866	PASPNQFYUXXSIY-CZUORRHYSA-N	442.383	1.889	50	20	IDGD	
CC(=O)C(=O)N1CCC2(CCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)CC1	1806756766	JHEIVKIJIRSMRC-HNNXBMFYSA-N	429.945	1.939	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H](CNC(=O)CCSC(=N)N)[C@H]1c1cccnc1	1807127620	PGNUOMPQJJKZEW-CRAIPNDOSA-N	437.642	1.956	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)c1cccc2c[nH]nc12	1808056021	XHLLCIWKENYTFC-KVSKMBFKSA-N	427.892	1.877	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)c2ccno2)[C@@H]1c1cccnc1	1808415010	RFQOQAJRSWPZSA-CPJWQURSSA-N	449.471	1.523	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)Cc2ccccc2)[C@H]1c1cccnc1	1813070509	IIMGIXVRIYFOMC-RDPSFJRHSA-N	437.544	1.703	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H](CNC(=O)C(Cl)Cl)[C@@H]1c1cccnc1)N1CCN(C)CC1	1813078795	KWRHHSJGFVUHKI-OIISXLGYSA-N	442.391	1.527	50	20	IDGD	
C[C@H](CBr)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CNC(=O)N(C)C)[nH]n1	1814776157	JLHKZETYMHRWFE-YPMHNXCESA-N	443.346	1.704	50	20	IDGD	
C[C@@H](CBr)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H]2C[C@H](O)CN2)[nH]n1	1814784376	WVEJCGVRFZZSAA-AUZPSNTRSA-N	428.331	1.156	50	20	IDGD	
CC(C)(C)OCC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1815592247	FHJNCQKSYOZZKV-MRXNPFEDSA-N	443.508	1.529	50	20	IDGD	
CC(C)CNC(=O)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](C)CBr)CC2	1817319929	CNOHJWAXSYAGHO-MNOVXSKESA-N	445.383	1.858	50	20	IDGD	
CN1CCN(CC(=O)N2CCCC[C@@H]2c2cc(NC(=O)CO[Si](C)(C)C)n[nH]2)CC1	1819594025	XOYMZFJFJFENBM-QGZVFWFLSA-N	436.633	1.501	50	20	IDGD	
C[C@H](CS(C)(=O)=O)C(=O)N[C@@H]1CCc2nc(NC(=O)CO[Si](C)(C)C)sc2C1	1820160160	FYQBQMUBJWDDHT-VXGBXAGGSA-N	447.655	1.587	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1CCc2nc(NC(=O)c3cnncc3C(=O)O)sc2C1	1820500555	BNMSTTQSXAZIBQ-SNVBAGLBSA-N	449.565	1.709	50	20	IDGD	
CCNC(=S)NCC(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](C)Br)[nH]n1	1821644018	FQWKOHHIPVSCRP-CMPLNLGQSA-N	445.387	1.669	50	20	IDGD	
CCC(=O)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[nH]n1	1821904445	CFGGUJDFENBNEL-GIEPYWIESA-N	427.465	1.515	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)C(C)(C)NCCC#N)CC2	1825999666	SVPFZYJLJJSQAU-RYUDHWBXSA-N	427.958	1.591	50	20	IDGD	
O=C([C@@H](O)N1CCOCC1)N1CCC([C@H]2CCCCN2C(=O)CCBr)CC1	1826358247	BNNLNKPXFJDPGE-VQIMIIECSA-N	446.386	1.042	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1CCc2nc(NC(=O)CSc3nc[nH]n3)sc2C1	1826671966	SECMZLVCEGOVPS-SNVBAGLBSA-N	440.627	1.817	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H](N)CCC(N)=O)CC1	1830316268	HLNXQIHNZDVZOW-KHYOSLBOSA-N	435.396	1.435	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)CCc2cncnc2)CC1	1831870978	JOOAEMCQDZUMIF-FQEVSTJZSA-N	444.580	1.402	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)C[C@@H]3CCCCO3)CCO2)C1	1832339267	XSDKFUAINLKMGK-JTDSTZFVSA-N	447.370	1.433	50	20	IDGD	
COc1ccc(C(=O)NC2CCN(C3CCN(C(=O)[C@H](O)CCl)CC3)CC2)cc1F	1833166441	OETXUGWJFWBGCG-GOSISDBHSA-N	441.931	1.619	50	20	IDGD	
Cc1ccc(CCC(=O)N2CCC(N3CCC(NC(=O)[C@H](O)CCl)CC3)CC2)cn1	1833308154	KIWCHLKZQMGFNA-HXUWFJFHSA-N	436.984	1.494	50	20	IDGD	
Cn1ccnc1C(=O)NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1834270382	BUVXCGPISQEYFO-CQSZACIVSA-N	430.322	1.296	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)c1nnsc1C1CC1	1835209272	MZMZOIBQVLAPPM-HNNXBMFYSA-N	441.985	1.200	50	20	IDGD	
COc1ncccc1C(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836714941	DZFFSTBNRZQLIQ-KRWDZBQOSA-N	425.913	1.302	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc4n(n3)CCCO4)CCO2)C1	1836966547	DBTJOJVZQQEWHO-MGPUTAFESA-N	440.928	1.143	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3nnc(-c4ccccc4)o3)CCO2)C1	1837537609	ZGKLYUBFZCOTCI-IERDGZPVSA-N	448.907	1.824	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCC(OC2CCN(C(=O)c3cnc(O)[nH]3)CC2)CC1	1838477071	AHGXCUNDTYXJIU-SFHVURJKSA-N	433.336	1.964	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)CSc3nc[nH]n3)CC2)CC1	1838636561	AJTOZESDHOTQPK-OAHLLOKOSA-N	429.974	1.913	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnn4c(C)cc(C)nc34)C2)C1	1839144499	BUMVWHBXMAMALT-UWJYYQICSA-N	449.939	1.434	50	20	IDGD	
CCc1ccnc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)c1	1839152238	RNVMSVCKGIXTJG-VQTJNVASSA-N	444.359	1.950	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)c3ccc(O)cc3)C2)C1	1840154732	FCEKPCSWKRRAJL-UQASEVPWSA-N	440.924	1.206	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cc(C)ccc3C)C2)C1	1840155422	BKXUWMFQDLLZTO-KNQAVFIVSA-N	438.952	1.556	50	20	IDGD	
O=C(c1ccc(CO)c(F)c1)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1840784046	IBTHXFRXHVEJGL-GOSISDBHSA-N	435.279	1.192	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(OC)c3F)CCO2)C1	1840794295	WHEQZTKRNXLHLD-YWZLYKJASA-N	428.888	1.922	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(C(=O)N2CC3(CCCN3C(=O)CCBr)C2)C1	1842638155	UUHBHHNEZJAZAB-UHFFFAOYSA-N	430.343	1.842	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)[C@H](CN)c2ccccc2)C1	1842970640	DGJLTDBGKDWEBD-CVLFLDGLSA-N	436.516	1.066	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2nccc3occc23)C1	1843157629	UQHXSCNIZFHMOM-AFUMVMLFSA-N	434.456	1.779	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)[C@@H]1CCCCN1C)C2	1844692018	YIVDHPPCOQANDG-SFHVURJKSA-N	444.488	1.821	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)Cc2n[nH]c3cc(Cl)ccc23)C1	1845026873	PBPZULFCQVHYRD-UHFFFAOYSA-N	446.939	1.335	50	20	IDGD	
C[C@H](Br)C(=O)N1CC2(CCCN2C(=O)c2cnc3c(c2)NC(=O)CS3)C1	1845670546	XRKCTKOEFWEWPL-JTQLQIEISA-N	439.335	1.726	50	20	IDGD	
O=C([C@@H](O)CCl)N1CC2(CCCN2C(=O)[C@@H](Br)Cc2ccccc2)C1	1845940177	BFHSLLWVTDLEJB-GJZGRUSLSA-N	429.742	1.796	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)CC[C@H]1CNc3ccccc3C1)C2	1846384641	PXZQDNMLQHMQAK-GOSISDBHSA-N	441.576	1.627	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC2(CCCN2C(=O)C2(F)CN(C(=O)OC(C)(C)C)C2)C1	1847131683	CKFOMHDJPUBSGP-GFCCVEGCSA-N	448.333	1.932	50	20	IDGD	
O=C(c1nn(-c2ccccc2)c2c1COC2)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl	1847559725	KFTTZOFATQIVHW-XYJFISCASA-N	430.892	1.318	50	20	IDGD	
O=C(Cc1ccc(F)cc1Cl)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cccc(B(O)O)c1	1848017041	SIJRJJABIXQMHD-OALUTQOASA-N	430.672	1.217	50	20	IDGD	
Cc1ccc(N2C(=O)C[C@@H](C(=O)NNC(=O)C(=O)NC3CC3)[C@@H]2c2cccs2)cc1	11684134	JHFAVOVRPURSTG-CRAIPNDOSA-N	426.498	1.577	50	20	IDGD	
Cn1cc(S(N)(=O)=O)cc1C(=O)NNC(=O)c1cc2c(s1)CC[C@@H](C(C)(C)C)C2	27314127	DYJSNJRNHYILAA-GFCCVEGCSA-N	438.575	1.960	50	20	IDGD	
CCOC(=O)c1ccc(N2CCCN(CC(=O)NNC(=O)c3ccccc3)CC2)nc1	725797454	CQPQYCPSLVSHSF-UHFFFAOYSA-N	425.489	1.232	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)N1CCCN(CCCc2ccccc2)CC1	725870801	AQRRDWQGJFAOPI-UHFFFAOYSA-N	427.505	1.391	50	20	IDGD	
CC(C)[C@@H](NS(=O)(=O)c1ccc2c(c1)OCCCO2)C(=O)NNC(=O)OC(C)(C)C	725897909	LXBBAJFXOUJMQC-MRXNPFEDSA-N	443.522	1.707	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)[C@@H](C)NC(=O)c2n[nH]c3ccccc23)cc1	726379037	DTKCTJSZOZZDSK-ZIAGYGMSSA-N	439.472	1.695	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)NCCC(=O)N=c2cc[nH]cc2)N(C)c2ccccc21	726535563	TUNHFHYFQPDDIQ-UHFFFAOYSA-N	432.484	1.619	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)[C@H]2CSCN2C(=O)C(C)(C)C)c2ccccc2c1=O	728150830	KSZKONUHZYZJSP-OAHLLOKOSA-N	445.545	1.515	50	20	IDGD	
CSc1nc(C(C)C)nc(C)c1C(=O)OCC(=O)NNC(=O)Cc1nc(C)cs1	728717280	CFEPOKGFPLYOPN-UHFFFAOYSA-N	437.547	1.942	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCCN1C(=O)c1ccccc1)C1CCN(c2ncccn2)CC1	728847790	PHXKTDKVYODWBC-LJQANCHMSA-N	436.516	1.535	50	20	IDGD	
O=C(NNS(=O)(=O)c1sccc1Br)C1CCN(c2ncccn2)CC1	728854058	KMWFTDHBCRCXBO-UHFFFAOYSA-N	446.352	1.527	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)c2ccccn2)cc1Br	729296379	VCBXOGWKNSTNOE-UHFFFAOYSA-N	427.280	1.169	50	20	IDGD	
CC(=O)N1Cc2ccccc2C[C@H]1C(=O)NNC(=O)c1sc(N2CCOCC2)nc1C	729300440	PIGLRUWYJCRHTI-KRWDZBQOSA-N	443.529	1.023	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCN(c2ccc3c(c2)OCCO3)C1=O)c1cc(Cl)ccc1O	730585514	GWADDZAHKDLFPU-CYBMUJFWSA-N	431.832	1.631	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)/C=C\c1ccccc1)C(=O)NNC(=O)c1c[nH]nc1C	732084202	QUFWASFNHJWAGW-HGPCXVNDSA-N	437.547	1.191	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCc2nnnn2-c2ccccc2)cc1Br	732246269	KMAXWXRTEUQCKG-UHFFFAOYSA-N	446.265	1.578	50	20	IDGD	
NC(=O)c1ccccc1N1CC[C@@H](NC(=O)NNC(=O)c2cc(Br)c[nH]2)C1	732572779	GLYQHHRZCRRFHT-LLVKDONJSA-N	435.282	1.099	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)c1cc(=O)c2cc(Br)ccc2[nH]1	732956044	FJFPGNFCIKDYTA-UHFFFAOYSA-N	449.286	1.543	50	20	IDGD	
COCCN1C[C@@H](C(=O)NNc2nc3ccccc3c(=O)n2-c2cccc(C)c2C)CC1=O	733265237	YJQAXAZYYITVFB-KRWDZBQOSA-N	449.511	1.941	50	20	IDGD	
Cc1cc(NNC(=O)[C@@H]2CC(=O)N([C@H]3CCS(=O)(=O)C3)C2)ccc1Br	734254952	RJMTWYXQNWLJDP-YPMHNXCESA-N	430.324	1.236	50	20	IDGD	
CN1C(=O)C[C@H](C(=O)NNC(=O)[C@H]2COc3ccccc3O2)[C@H]1c1cccc(Cl)c1	734387231	NJKOYXLIGUQXCU-POZUXBRTSA-N	429.860	1.847	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2c(Cl)nc3ccccn23)CC1	735116670	BOHJBMUJDKLPQO-UHFFFAOYSA-N	449.924	1.076	50	20	IDGD	
CS(=O)(=O)CCNC(=O)NNc1ccc(S(=O)(=O)NC2CCCCCCC2)cn1	735579800	MHMWNFMWBVUQGG-UHFFFAOYSA-N	447.583	1.144	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN2CCC(C(N)=O)(c3ccccc3)CC2)cc1C	736311266	HDBZHSKRBQZKBL-UHFFFAOYSA-N	428.558	1.899	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)COCc2ccccc2)cc1Br	737756534	QSBLUSOJSMYKCH-UHFFFAOYSA-N	429.292	1.984	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)N[C@@H]2CCC[C@H](S(C)(=O)=O)C2)nc1	741093159	NPGQSLJMGFTDHA-KGLIPLIRSA-N	447.583	1.094	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)[C@@H]1CCCN(C(=O)COc2ccccc2)C1	741206341	ALPKVLKBTVGTHM-MRXNPFEDSA-N	429.448	1.670	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNS(=O)(=O)c1cnn(-c2ccc(Cl)cc2)c1C	742032316	RTBZOKKDIFDVTM-UHFFFAOYSA-N	427.914	1.448	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)NNC(=O)c1cccc(Br)c1	743510068	PEHJPNUPOJCEOQ-UHFFFAOYSA-N	431.250	1.694	50	20	IDGD	
CCc1nncn1CCNC(=O)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1	743573530	CZSUTNUUVPSVPY-NRFANRHFSA-N	447.543	1.798	50	20	IDGD	
Cc1cc(=O)oc2cc(OCC(=O)OCC(=O)NNC(=O)c3ccc(C#N)cc3)ccc12	744463017	WKFWVZYIDDVDKR-UHFFFAOYSA-N	435.392	1.356	50	20	IDGD	
NC(=O)N[C@@H](CC(=O)NNC(=O)[C@@H]1COCCO1)c1cccc(Oc2ccccc2)c1	744645636	AKFIEUAEGGTDDN-ROUUACIJSA-N	428.445	1.141	50	20	IDGD	
Cc1ccc([C@@](O)(CC(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)C(F)(F)F)o1	744656701	FELYGOLDWZXRSD-SFHVURJKSA-N	439.346	1.604	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c(-c2ccncc2)n1	745835689	WTVZISNXESXISF-UHFFFAOYSA-N	433.516	1.455	50	20	IDGD	
Cc1ccc(C)c(S(=O)(=O)Nc2ccc(C(=O)NNc3nccn(C)c3=O)cc2)c1	747942177	YQTICZDLIAQJGK-UHFFFAOYSA-N	427.486	1.955	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)N2CCC(C(=O)NNc3ccc(C#N)cc3)CC2)o1	748114903	JUWQMCCJBVGMGC-UHFFFAOYSA-N	446.485	1.872	50	20	IDGD	
CSCC[C@@H](NC(=O)c1ccc([N+](=O)[O-])o1)C(=O)NNC(=O)[C@@H]1Cc2ccccc2O1	748273309	DVPZJJRNROWNKW-DOMZBBRYSA-N	448.457	1.190	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)(F)F)cc1)c1cnc2nc(O)nc(O)c2c1	748521362	ODTZFKAWPQMBCK-UHFFFAOYSA-N	429.336	1.486	50	20	IDGD	
COc1cc(OC)cc(N2CC[C@H](NC(=O)NNC(=O)c3ccc(OC)c(OC)c3)C2)c1	748662028	PMHCRTMUAPZROO-HNNXBMFYSA-N	444.488	1.944	50	20	IDGD	
CN(C)CCOc1ccccc1N1CCN(CC(=O)NNC(=O)c2ccccc2)CC1	750047806	RJNIJQNWMPDYRZ-UHFFFAOYSA-N	425.533	1.210	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)[C@H]2CCN(C)c3ccccc32)CC1	750796437	WFVAEQYFAYDHTF-KRWDZBQOSA-N	444.561	1.085	50	20	IDGD	
CC(C)(C)c1ccc(S(=O)(=O)NCCC(=O)NNc2cc(Cl)nc(N)n2)cc1	753463313	DPCRJGHDLPSDPF-UHFFFAOYSA-N	426.930	1.821	50	20	IDGD	
Cc1cc(Br)cn2cc(CCNC(=O)NNC(=O)Cc3cccnc3)nc12	754183524	HIFGJKWKHPRPQI-UHFFFAOYSA-N	431.294	1.916	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)Nc2cccc(-n3cnnn3)c2C)n[nH]1	755444594	OYWVQNVGISCMBI-UHFFFAOYSA-N	433.432	1.836	50	20	IDGD	
COc1cc(C=NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)c2c(c1)C[C@H](C)O2	755791874	VGGHLYYLDBZIHX-KRWDZBQOSA-N	436.512	1.927	50	20	IDGD	
CCCCNC(=O)[C@H]1CC[C@H](C)N(CC(=O)NNC(=O)c2ccc(OC)c(OC)c2)C1	756499711	CFZQLGKRROFJQV-RDJZCZTQSA-N	434.537	1.482	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)Nc1ccc(F)c(S(=O)(=O)NC2CC2)c1	757873719	KVWRWFWQUQMPLY-UHFFFAOYSA-N	446.464	1.689	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)CN(Cc1ccco1)c1cccc(Cl)c1	758043823	KZPVVISDXHLZDF-GFCCVEGCSA-N	428.898	1.025	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1ccc(Sc2ccc([N+](=O)[O-])cc2)cc1	758050424	CHNOHDXSOGTPGZ-NSHDSACASA-N	438.487	1.445	50	20	IDGD	
Cc1nc(COc2cccc(C(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)c2)no1	758399879	GUNMZJJTSLWGQF-UHFFFAOYSA-N	430.442	1.435	50	20	IDGD	
O=C(COC(=O)c1cn(Cc2cccc(F)c2)nn1)NNC(=O)c1ccc(Cl)cc1	759449682	QBZZVZOVEQTFQE-UHFFFAOYSA-N	431.811	1.737	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)N2CCN(c3ncc(F)cn3)CC2)N(C)c2ccccc21	760124574	BWDJQPHGGWGUTP-UHFFFAOYSA-N	449.490	1.935	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)cc1C	761793345	FWZSRMHITSXGEP-IBGZPJMESA-N	437.500	1.764	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)c1cc(C(N)=O)n(-c2ccccc2)n1	762348509	DJCRGISPAKFJDX-UHFFFAOYSA-N	425.470	1.533	50	20	IDGD	
O=C(NCc1ccn2ccnc2c1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	762402949	QOVZXHQPMRJNLK-UHFFFAOYSA-N	442.501	1.263	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)N2CCC[C@@H](n3cc(C(=O)OC)nn3)C2)c1C	762728537	PLYYHDFACXVDHV-ZYNFKGNASA-N	440.504	1.900	50	20	IDGD	
COc1cc(C(=O)NNc2nccc(N3CCOCC3)n2)c([N+](=O)[O-])cc1OC(F)F	762850917	NQERTBNOJDZJAP-UHFFFAOYSA-N	440.363	1.588	50	20	IDGD	
CCN(CC)C(=O)COc1ccc(NC(=O)C(=O)NNC(=O)c2ccncc2)cc1Cl	763463462	YXUAJKCZKDNZCF-UHFFFAOYSA-N	447.879	1.382	50	20	IDGD	
O=C1C[C@H](c2cccc(NC(=O)C(=O)NNC(=O)c3cc4ccccc4cc3O)c2)CN1	763522640	NQLHFLOICYKAJW-INIZCTEOSA-N	432.436	1.549	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(-c3cc[nH]n3)cc2)cc(OC)c1OC	763540502	WCYGWGFWMUGAKG-UHFFFAOYSA-N	439.428	1.502	50	20	IDGD	
Cn1ccc(NC(=O)C(=O)NNC(=O)c2cn(-c3ccccc3)nc2-c2ccccc2)n1	763599925	BSXZAMBXWDNTQQ-UHFFFAOYSA-N	429.440	1.673	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)cc1	763659488	OYRDQWTYXNJLOY-UHFFFAOYSA-N	436.346	1.751	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)COc2cc(C)ccc2C)ccc1NC(C)=O	763665342	FYQSRVHQFACLDP-UHFFFAOYSA-N	428.445	1.435	50	20	IDGD	
COc1ccc(Br)c(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)c1	763674645	OWWKFTDONWRBDN-UHFFFAOYSA-N	447.245	1.494	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)C(=O)Nc1ccc2c(c1)OC(F)(F)O2	763803967	IRXVNQHCPJKNNL-UHFFFAOYSA-N	438.299	1.081	50	20	IDGD	
CCN(CC)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)cc1	763852359	WUYFHZXEALBOAU-CQSZACIVSA-N	444.463	1.861	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)c(C)c1	763858708	WGVVHPVBVFWWOY-ZDUSSCGKSA-N	447.419	1.239	50	20	IDGD	
Cc1ccc(-c2nnco2)cc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccc(F)cc1	763871938	IXMCXNFJPMWJJT-LBPRGKRZSA-N	427.392	1.738	50	20	IDGD	
O=C(NNC(=O)C1=S=C2CCCCCC2=C1)C(=O)Nc1ccnn1Cc1ccccc1	763968403	OTYJCOFECVIJKH-UHFFFAOYSA-N	437.525	1.999	50	20	IDGD	
Cc1noc(COc2ccc(NC(=O)C(=O)NNC(=O)c3cc(Cl)ccc3O)cc2)n1	763973648	DFYDZFPNKBCEOG-UHFFFAOYSA-N	445.819	1.716	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)Nc1c(F)cccc1-n1cccn1	764004635	JTKPZYWUPYIVAA-UHFFFAOYSA-N	449.240	1.512	50	20	IDGD	
C=C(C)COc1cccc(NC(=O)C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c1	764078365	RTDRTRPPDLJVJC-UHFFFAOYSA-N	431.470	1.445	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)c2cc(C)[nH]n2)sc2c1CCCS2	764097474	FCMINZCVKDSKBD-UHFFFAOYSA-N	437.503	1.394	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)C(=O)N(C)CC3)o1	764138092	AREUAJASPBASKO-UHFFFAOYSA-N	441.488	1.149	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C(=O)Nc1cccc(-n2nnnc2SC)c1)c1ccccc1	764328083	KNDIUDMXZYUEHS-INIZCTEOSA-N	439.501	1.664	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2ccc(F)c(F)c2F)n[nH]1	764376703	FTDNWEYUVYSJAJ-UHFFFAOYSA-N	433.346	1.902	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1nn(C(C)(C)C)cc1C#N	764393092	OAEKKGZWMKTHFN-UHFFFAOYSA-N	430.490	1.397	50	20	IDGD	
Cc1cc(Cl)ccc1OCCCC(=O)NNC(=O)[C@@H](C)S(=O)(=O)C1CCOCC1	764457408	KQIAKPDIBWDJID-CQSZACIVSA-N	446.953	1.937	50	20	IDGD	
C[C@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1NC(=O)NNC(=O)c1nnc(O)c2ccccc12	764562954	FBPVEEAAXVDTGQ-WFASDCNBSA-N	444.492	1.925	50	20	IDGD	
COc1cc2c(cc1OC)CN(C(=O)CCC(=O)NNC(=O)c1ccc(C#N)cc1)CC2	765336965	OQXJPRQSPSOBDQ-UHFFFAOYSA-N	436.468	1.702	50	20	IDGD	
CN1CC(=O)N(Cc2ccc(C(N)=O)cc2NC(=O)[C@H](Br)C(C)(C)C)C1=O	768225447	FDCJRUYDJCJKBI-AWEZNQCLSA-N	439.310	1.928	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)[C@H](C(C)C)N3CCCC3=O)n[nH]2)cc1OC	768275521	DGROKRCDIHLHJY-IBGZPJMESA-N	429.477	1.502	50	20	IDGD	
O=C(COC(=O)CCC(=O)c1ccc(Cl)cn1)NNC(=O)[C@H]1COc2ccccc2O1	769185795	QOTHKSFHYGHEKW-QGZVFWFLSA-N	447.831	1.229	50	20	IDGD	
COc1cc(OC)cc(C(=O)Nc2ccc(C(=O)NNC(=O)N3CCOCC3)c(O)c2)c1	769742016	PGDPKJZMJXEHQO-UHFFFAOYSA-N	444.444	1.348	50	20	IDGD	
O=C(NNC(=O)c1ccc(N2CCCc3ccccc32)cc1)N[C@@H]1CCS(=O)(=O)C1	770156896	LAYUCZMGOMHVOX-QGZVFWFLSA-N	428.514	1.902	50	20	IDGD	
COc1ncc(NC(=O)C(=O)NNc2ccc(Br)c(F)c2)cc1C(N)=O	770815090	HDQGHVSQUHSFBW-UHFFFAOYSA-N	426.202	1.173	50	20	IDGD	
COc1cc(/C=C(\C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)c2ccccc2)ccc1O	772376421	UAEPAWGQFRIEGF-FDIDWWNZSA-N	445.497	1.459	50	20	IDGD	
COc1ccc(C(=O)NCC(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)cc1OC	772970478	CXFPEUKSJRZXNW-GFCCVEGCSA-N	435.864	1.702	50	20	IDGD	
CCOC(=O)C(C)(C)n1cc(NC(=O)C(=O)NNc2ncc(Cl)cc2Cl)cn1	773679379	YGGMJUPCOOHKSR-UHFFFAOYSA-N	429.264	1.965	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)C(C)C)cc1NC(=O)C(=O)NNc1cccc(C#N)c1	773688118	CSXWXJKACNMGED-UHFFFAOYSA-N	429.502	1.977	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2cccc(CN(C)C(=O)C(F)(F)F)c2)n1	773730611	HZHCPZZHCIUUPY-UHFFFAOYSA-N	426.355	1.088	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccccc2N2CCC(C(N)=O)CC2)cc1F	773889015	OSOUQMWYPVLTKI-UHFFFAOYSA-N	441.463	1.236	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)N[C@H](CS(C)(=O)=O)c3ccccc3)nc21	774272947	AXHATQKHTLTSEP-CQSZACIVSA-N	447.521	1.699	50	20	IDGD	
O=C(NNC(=O)c1cccc(Br)c1)Nc1ccc(C[C@@H]2NC(=O)NC2=O)cc1	775703719	QYDKBDYMZPEOSA-AWEZNQCLSA-N	446.261	1.666	50	20	IDGD	
CC(C)N1C(=O)c2ccc(C(=O)NNc3cccc(S(C)(=O)=O)c3)cc2S1(=O)=O	776528830	TZMAYBOCEYHKSY-UHFFFAOYSA-N	437.499	1.400	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)CC1	777088123	OSLHTVIVICCKIX-KRWDZBQOSA-N	435.477	1.390	50	20	IDGD	
CC[C@H](C)Oc1cc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)ccn1	777182814	IUYATOGXDIGZIF-GUYCJALGSA-N	429.429	1.403	50	20	IDGD	
O=C(NC[C@H]1COC2(CCOCC2)O1)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1	777755181	OGOGRQPZXSELNG-LBPRGKRZSA-N	439.412	1.528	50	20	IDGD	
COc1ccc(N2CCN(C(=O)/C=C/C(=O)NNc3nc(-c4cccnc4)no3)CC2)cc1	778268234	JCCLUECAPYEVAS-CMDGGOBGSA-N	449.471	1.488	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N[C@H](CO)c1cnn(C)c1	778589751	RNRGTEFUIJNZEA-QMTHXVAHSA-N	426.271	1.014	50	20	IDGD	
Cn1cnc(-c2ccc(C(=O)NNC(=O)CCN3CCN(c4ccccc4)CC3)cc2)n1	779714342	BIDCYWCFKIJIEG-UHFFFAOYSA-N	433.516	1.455	50	20	IDGD	
C[C@H]1CN(Cc2ccc(C(=O)NNC(=O)CCNC(=O)OC(C)(C)C)cc2)C[C@@H](C)O1	780971945	VYNTUAUQEGYQCP-IYBDPMFKSA-N	434.537	1.972	50	20	IDGD	
Cc1ccc(S(=O)(=O)NC2CC2)cc1C(=O)NNC(=O)CCNC(=O)OC(C)(C)C	780972050	XSKQTSQJDQZIAZ-UHFFFAOYSA-N	440.522	1.112	50	20	IDGD	
Cn1nc(Br)cc1C=NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	782113706	QCBCODBQJYZAPT-UHFFFAOYSA-N	440.323	1.731	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cnn(C)c2C(F)(F)F)cc1	782121378	WQVJHXFXMWWBOE-JTQLQIEISA-N	441.366	1.195	50	20	IDGD	
CN(Cc1ccccc1NC(=O)C(=O)NNC(=O)C(=O)N1CCCC1)C1CCCCC1	783998867	HTYNIHYOFISGMI-UHFFFAOYSA-N	429.521	1.159	50	20	IDGD	
Cc1cc2cc[nH]c2cc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	784210495	QWUHELXTCTVIAF-UHFFFAOYSA-N	427.486	1.999	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNc3ccc(Br)cn3)cn2)C[C@@H](C)O1	784340312	AAVJTJAYRBFGMX-TXEJJXNPSA-N	449.309	1.935	50	20	IDGD	
O=C(NNc1nccnc1Cl)C(=O)Nc1cccc(S(=O)(=O)N2CCCCC2)c1	784781086	XLKTVMWMACMFFN-UHFFFAOYSA-N	438.897	1.386	50	20	IDGD	
CN1CCC[C@@H](N(C)C(=O)c2ccc(NC(=O)C(=O)NNc3nccnc3Cl)cc2)C1	784781845	PAJRZFOTJITGCG-OAHLLOKOSA-N	445.911	1.378	50	20	IDGD	
O=C(NNc1ccc(F)c(F)c1F)C(=O)Nc1ccc(F)c(S(=O)(=O)NC2CC2)c1	784810962	MRCNJFCARUOEIL-UHFFFAOYSA-N	446.382	1.766	50	20	IDGD	
COC(=O)[C@H]1CN(C(=O)C(=O)NNc2ccnc(Br)c2)c2ccccc2O1	784828624	MQHBFMOQOCBBRL-CYBMUJFWSA-N	435.234	1.254	50	20	IDGD	
CC(=O)N(C)c1ccc(NC(=O)C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)cc1	785099442	FZGIAZGESOIMLT-UHFFFAOYSA-N	445.426	1.922	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)C(=O)Nc3cccc(OCC#N)c3)n[nH]2)c1	785128739	MSHVERJZPMASPJ-UHFFFAOYSA-N	432.440	1.996	50	20	IDGD	
COc1cc(F)cc(NNC(=O)C(=O)Nc2ccc(OC)c(-n3nnnc3C3CC3)c2)c1	785237229	LYSPTQGDQZGWCZ-UHFFFAOYSA-N	441.423	1.778	50	20	IDGD	
CCOC(=O)[C@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNc2cc(F)cc(OC)c2)cc1	785246126	LHIVAYUXSKENOY-LBPRGKRZSA-N	446.435	1.598	50	20	IDGD	
O=C(NN=C1C(=O)Nc2ccc(Br)c(Cl)c21)N[C@H]1CCS(=O)(=O)C1	788014683	GHPCEIGMFJFZEW-LURJTMIESA-N	435.687	1.245	50	20	IDGD	
Cc1nn(C)c(-n2ccnc2C)c1C(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12	788262061	IFPVVLNLZRYFMX-UHFFFAOYSA-N	448.487	1.588	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)c2ccc(C(=O)NNC(=O)CN3CCCC3=O)cc2)cc1	789857472	UPEDCHBXYSXWHN-UHFFFAOYSA-N	444.513	1.204	50	20	IDGD	
CN(C)C1CCN(c2ccc(NC(=O)C(=O)NNc3nc4ccccn4n3)cc2F)CC1	792396205	YQXFZYAAUWTNBE-UHFFFAOYSA-N	440.483	1.481	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NN=Cc1c(Br)n[nH]c1Br	793024536	IRJKVYXXCYURIW-UHFFFAOYSA-N	430.060	1.210	50	20	IDGD	
CC(C)NS(=O)(=O)c1cccc(C(=O)NNC(=O)CNC(=O)OCc2ccccc2)c1	794063272	DLARXNXHHASXAZ-UHFFFAOYSA-N	448.501	1.061	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)CCc1ccccc1C(N)=O	795815981	DJFHJYWIVIVGKZ-UHFFFAOYSA-N	433.848	1.385	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3n2)c(OC)c(C)c1OC	796990923	IINJLBHJPFVSBN-UHFFFAOYSA-N	438.440	1.969	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccc(F)cc1-c1cnn(C)c1	796991048	ZGRJKYAMCTYLGR-LBPRGKRZSA-N	443.410	1.919	50	20	IDGD	
Cc1ccc(N2CCOCC2)cc1NC(=O)C(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	797535880	QGAOVFBGCRQJJL-UHFFFAOYSA-N	427.417	1.140	50	20	IDGD	
Cc1cc(O[C@H]2CCN(C)C2=O)ccc1NC(=O)NNC(=O)c1ccc2c(c1)OCCO2	799240809	LYDVIRLQFBUOPN-SFHVURJKSA-N	440.456	1.842	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NN=Cc2cn(CC(=O)O)c3ccccc23)cc1	799868916	BIVYPJDXQOOXHA-UHFFFAOYSA-N	442.497	1.805	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CCC(=O)Nc2nnc(CC(C)C)s2)cc1	801106085	QQOOOMWSQBJLCX-UHFFFAOYSA-N	432.506	1.550	50	20	IDGD	
COc1ccc([C@H]2[C@H](C(=O)NNC(=O)C(=O)Nc3ccc(C)cc3)CCC(=O)N2C)cc1	801106226	PVLZRTHTECSCBG-QUCCMNQESA-N	438.484	1.699	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN1C(=O)c1ccc2c(c1)OCO2)Nc1ccc2c(c1)OCO2	802096712	BLMRMDDCXBAPSU-CQSZACIVSA-N	440.412	1.602	50	20	IDGD	
COc1ccc(S(=O)(=O)C[C@H](C)C(=O)NNC(=O)Nc2ccc3c(c2)OCO3)cc1	802105005	NUDHPUOFZSWYLR-LBPRGKRZSA-N	435.458	1.687	50	20	IDGD	
COC(=O)N1CCC(CNC(=O)NNC(=O)c2ccc(OC)c(Br)c2)CC1	805103966	HFJZBLDOTUSEBW-UHFFFAOYSA-N	443.298	1.880	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)CCCC(=O)c2ccc3c(c2)OCCO3)C[C@H](C)O1	806339919	LKVWYWCAYASHMB-HOTGVXAUSA-N	433.505	1.458	50	20	IDGD	
COc1ccc2cc(NC(=O)C(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)ccc2c1	806976148	GOEIXZJHQBHHRU-UHFFFAOYSA-N	441.465	1.652	50	20	IDGD	
Cn1c(COC(=O)/C(C#N)=C/c2cn(CCC#N)nc2-c2ccccc2)cc(=O)n(C)c1=O	808433515	KMLWIFITNNNXMU-GZTJUZNOSA-N	444.451	1.512	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)c2cnc3[nH]c(O)nc3c2)cc(OCC)c1OCC	809542589	CMQLKJRBIHKMGM-UHFFFAOYSA-N	429.433	1.934	50	20	IDGD	
O=C(CNc1ccccc1)NNC(=O)CNS(=O)(=O)c1ccc(Br)s1	809991712	ARLWNPQRUUWJSR-UHFFFAOYSA-N	447.336	1.048	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCC(=O)NNc2ncccc2[N+](=O)[O-])cc1OCC	810528406	RNQAEEZEYUEXLE-UHFFFAOYSA-N	439.450	1.209	50	20	IDGD	
O=C(CNS(=O)(=O)c1cccc(F)c1)NNc1ccc([N+](=O)[O-])cc1Br	811222622	VARPWOZAXIIRSA-UHFFFAOYSA-N	447.242	1.918	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNS(=O)(=O)c1ccc2c(c1)NC(=O)CC(=O)N2	812558131	UQURXLPUQNVLJL-UHFFFAOYSA-N	438.849	1.253	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)CS(=O)(=O)CCCc2ccccc2)cc1	812732831	TUAWEIXUVIYZSF-UHFFFAOYSA-N	439.559	1.428	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)c1ccc(N2CCCNC2=O)cc1	812868631	XEGJNOPYBJTINW-AWEZNQCLSA-N	449.475	1.287	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNc2cccc(S(C)(=O)=O)c2)cc1)[C@@H]1C[C@H]1C	815558622	JAUROJUWQVCORJ-BFUOFWGJSA-N	444.513	1.933	50	20	IDGD	
Cn1cc(NC(=O)C(=O)NNC(=O)c2cn(-c3ccccc3)nc2-c2ccccc2)nn1	815564408	ICUXNSHWYBWARZ-UHFFFAOYSA-N	430.428	1.068	50	20	IDGD	
Cc1cc(C#N)cnc1C(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	815827803	OTFWMPCMBHBGIK-UHFFFAOYSA-N	426.908	1.494	50	20	IDGD	
COCCN(C)NC(=O)c1cc(S(=O)(=O)N2CCCCC2)ccc1Br	816562026	WHNUXGZTERNFQV-UHFFFAOYSA-N	434.356	1.847	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc(OC(F)(F)F)cc1)NNC(=O)c1ccncc1	912769124	ZECJWOOETVWIIB-UHFFFAOYSA-N	432.380	1.110	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)CNS(=O)(=O)c2ccc(C#N)cc2)cc1OC	913069801	MENSGQKYYMRCHC-UHFFFAOYSA-N	446.485	1.095	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCc2ccccc2CN2CCOCC2)cc1OC	913632515	ZSDKWCJYXGTXAQ-UHFFFAOYSA-N	428.489	1.680	50	20	IDGD	
COc1ccnc(NNC(=O)C2CCN(S(=O)(=O)c3cccnc3Cl)CC2)n1	914762545	NJOQWHXOGARCQB-UHFFFAOYSA-N	426.886	1.078	50	20	IDGD	
COc1ccnc(NNC(=O)c2ccc(OC)c(S(=O)(=O)NCc3ccccn3)c2)n1	914861597	ZVDZVFJKDQSUDK-UHFFFAOYSA-N	444.473	1.124	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(-c3ccccc3F)on2)c1	914864499	KQIBJEZVBUFXHK-UHFFFAOYSA-N	432.433	1.806	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)cc1C	914882183	YDDAOTFSLIAENA-UHFFFAOYSA-N	446.529	1.637	50	20	IDGD	
CCOc1ccccc1C(=O)N1CCC[C@@H]1C(=O)OCC(=O)NNC(=O)c1cccs1	915007340	NDFGBCAPAUHJDP-OAHLLOKOSA-N	445.497	1.756	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)NCCN1CCN(Cc2ccccc2)CC1	915902670	ZGBBCFQCAZEQJA-UHFFFAOYSA-N	435.532	1.405	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)c1ccc2c(c1)S(=O)(=O)N(C1CC1)C2=O	916742260	ACONFXNPAJCTST-LLVKDONJSA-N	447.444	1.361	50	20	IDGD	
CC(C)N1C(=O)c2ccc(C(=O)NNC(=O)[C@@H](C)Oc3ccc(F)cc3)cc2S1(=O)=O	916746483	QMABRNRUZVUSOW-GFCCVEGCSA-N	449.460	1.607	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNS(=O)(=O)c1ccc(C#N)c(Cl)c1	917724483	ZBMHIOQUCSQAPS-UHFFFAOYSA-N	441.922	1.437	50	20	IDGD	
CC[C@H](NC(=O)NNC(=O)COc1ccc(C)cc1)c1ccccc1OCC(=O)NC	918220863	CDYQUYZUPXMPEG-SFHVURJKSA-N	428.489	1.980	50	20	IDGD	
CC[C@@H](NC(=O)NNC(=O)COc1ccccc1F)c1ccccc1OCC(=O)NC	918221886	PUCWECQABIBTPC-MRXNPFEDSA-N	432.452	1.811	50	20	IDGD	
Cc1nn([C@H]2CCS(=O)(=O)C2)c2nc(C3CC3)cc(C(=O)NNC(=O)C(C)(C)C)c12	918584998	PGRRVFMTMUQVRE-ZDUSSCGKSA-N	433.534	1.784	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCCN2CCc3sccc3C2)c2ccccc2c1=O	919785146	VNKNEOWBLFXWEU-UHFFFAOYSA-N	440.529	1.480	50	20	IDGD	
C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)NNC(=O)c2csc(N3CCOCC3)n2)C1	919786004	OKYXGMMIVYFVAT-DOTOQJQBSA-N	444.561	1.759	50	20	IDGD	
COc1ccc(C2(CNC(=O)NNC(=O)[C@H]3COc4ccccc4O3)CCOCC2)cc1	919925399	VFSVWTSPWHQZLF-HXUWFJFHSA-N	441.484	1.914	50	20	IDGD	
CCCc1noc2nc(-c3ccco3)cc(C(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)c12	920217225	XNBULJOOFVPPPB-NSHDSACASA-N	432.458	1.631	50	20	IDGD	
COc1ccc(C2(C(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)CCOCC2)cc1	920218384	GBALIGULQNSSLT-UHFFFAOYSA-N	432.498	1.608	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)Nc2nc(CN3C[C@H](C)O[C@@H](C)C3)cs2)c1O	920938309	JXRGRJPDRQRSKZ-RYUDHWBXSA-N	435.506	1.933	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)Cc2ccc(S(=O)(=O)NC)cc2)cc1	1320158197	IYRBKZONFZVTBQ-AWEZNQCLSA-N	435.502	1.151	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)CNS(=O)(=O)c1ccccc1	1324171998	XGEVEBSJTFKSIB-UHFFFAOYSA-N	440.547	1.185	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@@H]2CC(=O)N(Cc3ccccc3)C2)c1	1335908022	WMFYEEWOKQWXQV-INIZCTEOSA-N	444.513	1.083	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1nc3ncccn3n1)C2	1779543865	CQCXKKQRFAAMOT-FOIQADDNSA-N	446.584	1.103	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3c(F)cncc3F)C2)C1	1779725266	JDEBDZYPEULXSA-PIGZYNQJSA-N	432.265	1.834	50	20	IDGD	
Cn1c(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](F)Cl)CCO3)cc2c[nH]c3nccc-3c21	1780036969	LMBPKHIFSBFMAU-UZLBHIALSA-N	433.871	1.984	50	20	IDGD	
COc1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](C)Br)C3)nn1C	1780246069	WPDPKMNYVUCKRB-WPKBUWHJSA-N	443.342	1.340	50	20	IDGD	
COCc1c[nH]c(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](F)Br)C2)c1	1780773989	QXRSAJMYGKKEAQ-RVKKMQEKSA-N	446.317	1.979	50	20	IDGD	
O=C(CC12CCCN1CCC2)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1781137549	UQDROLARYPQXKY-CRAIPNDOSA-N	432.334	1.525	50	20	IDGD	
Cc1nc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@](C)(Cl)CCl)C3)C2)c(=O)[nH]c1C	1781225431	WVAOJDLUJNJZLS-MSOLQXFVSA-N	431.320	1.067	50	20	IDGD	
O=C(c1ccc2ncoc2c1)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781330141	RCBIMIGXZNNKBS-YOEHRIQHSA-N	426.242	1.962	50	20	IDGD	
CSc1ncccc1C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781331247	HENYYVXAMUWEAW-BLLLJJGKSA-N	432.315	1.938	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)COc2ccccc2C#N)C1	1783133699	AJANAJUYTZACEF-SFGWALBWSA-N	449.935	1.705	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)CNC(=O)c3ccco3)CCO2)C1	1783343639	WDMDVFNUIWHKJQ-UGSOOPFHSA-N	442.310	1.013	50	20	IDGD	
Cc1nnc(CCC(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](C)Br)C3)C2)s1	1783532542	PENGUMNDXJPYLP-ZBEGNZNMSA-N	431.356	1.392	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3c(O)cc(O)cc3O)CCO2)C1	1783535737	BTZXSFQRPGOVGZ-BMLIUANNSA-N	429.267	1.030	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)Cn3cnc4ccccc43)CCO2)C1	1783540001	PSEXZBVUBFQOQV-LIRRHRJNSA-N	435.322	1.650	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](C)N(C)C(=O)OC(C)(C)C)CCO2	1783880012	DPHXZSAETHWKQK-QEEYODRMSA-N	447.960	1.326	50	20	IDGD	
CC(C)(C)OC(=O)N1CC=C(C(=O)N2CCO[C@@]3(CCN(C(=O)C(Cl)Cl)C3)C2)C1	1783941436	CWUAYSBFGMAJPT-LJQANCHMSA-N	448.347	1.797	50	20	IDGD	
O=C(C[C@H]1CNc2ccccc2O1)N1CCO[C@@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783946170	JIUIEDUJCIMCFH-DJJJIMSYSA-N	428.316	1.883	50	20	IDGD	
Cc1[nH]nc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]3C2)c1F	1783970294	UXUDTKZHPFZWFY-IXOXFDKPSA-N	431.306	1.482	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3Cc4ccccc4CN3C)[C@H]2C1	1785024390	KEBZKFWQDVZXHQ-SXYSDOLCSA-N	449.979	1.277	50	20	IDGD	
Cc1nn(C)c(C)c1C(=O)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1	1786494313	ANEUKXJSJSBJTH-UHFFFAOYSA-N	446.316	1.778	50	20	IDGD	
Cc1nnc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCBr)C[C@@H]32)s1	1787055563	FSNMGUOYLSLRQI-AVGNSLFASA-N	431.356	1.154	50	20	IDGD	
COC(=O)c1ccccc1CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]2C1	1787443582	MPWPWFOKUDMYAA-XPYUAMARSA-N	440.899	1.920	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccnc3OCC3CC3)C[C@@H]21)[C@@H](F)Cl	1787444341	VGSKZFHEHIALLS-QSPRXWTASA-N	425.888	1.998	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(F)cn3C)[C@H]2C1	1787748351	XOGSKTPRFKQZFZ-ZIEJDFEHSA-N	430.318	1.931	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC1(c2ccc(NC(=O)CCN3CCOCC3)cc2)CCC1	1787931017	BMAYOEBLSVWYHM-UHFFFAOYSA-N	445.564	1.216	50	20	IDGD	
Cn1nc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]32)c2c1CCC2	1788021276	KYFNLGBFJSOBRW-VOOFSGFHSA-N	443.375	1.738	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CS[C@@H]3CCCCO3)[C@H]2C1	1788646313	FRARFEFRNCFENV-RNGZQALNSA-N	434.986	1.480	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1ccc(C2(NC(=O)CNCP(=O)(O)O)CCC2)cc1	1791561964	ACHOAODVSUYJQX-CQSZACIVSA-N	433.829	1.099	50	20	IDGD	
C[C@H](C(=O)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1)n1cccn1	1791878991	NGHAPIYPPOUGHT-MRXNPFEDSA-N	432.289	1.572	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3CC3)[C@H]2C1	1791880754	XGVZPDQDBQGARJ-FNHZYXHNSA-N	431.445	1.523	50	20	IDGD	
CCC[C@H](NC(C)=O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]21	1792184695	HQSYPQUORSPBMN-SIBFUHKCSA-N	436.380	1.507	50	20	IDGD	
CC(C)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(-n3cncn3)c1)C2	1792784535	JUMQDJJNYPFHLU-ALXJQNPVSA-N	431.924	1.736	50	20	IDGD	
CN(C)C(=O)c1cccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C(C)(C)CCl)c1	1792786119	OOUNXOIYXWMVDZ-BCDXTJNWSA-N	435.952	1.857	50	20	IDGD	
Cc1cccc(-c2ncccc2C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](O)CCl)c1	1792977366	ULYLMJQPUJKGHZ-PIKOESSRSA-N	443.931	1.860	50	20	IDGD	
COc1cc(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](O)CCl)cc(OC)c1OC	1793106683	GXWIUHRPWKTISM-FZKCQIBNSA-N	440.924	1.493	50	20	IDGD	
O=C(CSc1ccncc1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2	1793949826	SUNFNIWMMKLLGS-FVCICTRLSA-N	428.352	1.548	50	20	IDGD	
Cc1ccn2c(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)CCBr)cnc2c1	1795116538	QCXNOUFYQZGWKK-ZSBFGKGUSA-N	435.322	1.631	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc2cnccc2c1)c1cccc(B(O)O)c1	1797498251	HNFYQJYXMXHHKW-KOUNCHBCSA-N	429.285	1.480	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NO[C@@H](c2ccccc2)C1)c1cccc(B(O)O)c1	1797752167	TXKWRYBNIHZSOO-XAPVIXHLSA-N	447.300	1.136	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3nc(CO)[nH]c3c1)C2	1797956026	WLPVGQLMMNMUGU-YVWYUNDQSA-N	446.580	1.110	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1(F)CN(C(=O)OC(C)(C)C)C1)C2	1799273460	HISUTJQPQNMEGJ-LXTVHRRPSA-N	447.935	1.552	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)c1cccc(Br)c1)[C@@H](O)CCl	1799870232	GLBYJAVTKLCEJI-XFIYOXNOSA-N	445.741	1.720	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1cnn2cccc(F)c12	1800123650	HENFUXPWECZAQA-FJHTZYQYSA-N	443.248	1.367	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nccc3nc[nH]c13)C2	1800639529	IGOQYIWLOAHLMD-GFQSEFKGSA-N	436.310	1.335	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1cc(F)ccn1)C2	1800640238	MLOZQLLSABXPHN-VLWCASSMSA-N	442.329	1.916	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ncn(-c3ccccc3)n1)C2	1800758217	VCEYREGOWOHNIS-AYDFFVQHSA-N	448.321	1.254	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(CC(C)C)nn1C)C2	1800975849	VPIQWLRHSPOKKH-CXHZTBPHSA-N	426.945	1.076	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CCCN1Cc1ccccc1)C2	1800981542	OZDGZABSWZFZKI-VIYGXFRKSA-N	449.979	1.494	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C[C@H]1OCCc3ccccc31)C2	1802334127	IQOCVEFAANBCEJ-RCLSDMTESA-N	442.560	1.702	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cccc3nc[nH]c23)[C@H]1c1cccnc1)[C@H](O)CCl	1803139862	XFVVZQKSKMSYJG-YJLNNSPDSA-N	427.892	1.877	50	20	IDGD	
CN(C)c1ccc(C(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)cn1	1803139989	AVVZKAIHXQMYCP-HHXXYDBFSA-N	431.924	1.462	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc3cncn3c2)[C@H]1c1cccnc1)[C@@H](O)CCl	1803142854	KXKWMWSOZMMBCF-SNRMKQJTSA-N	427.892	1.649	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)c2cccn(C)c2=O)[C@H]1c1cccnc1	1803835054	HDKCEXGPVRHKIR-YSVLISHTSA-N	447.333	1.883	50	20	IDGD	
Cc1cscc1C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1807361153	HLIFWWFCDDRLJG-WIYYLYMNSA-N	449.341	1.765	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cccc(F)c2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807362848	WTNRDCJQBQVNBM-SIKLNZKXSA-N	447.275	1.534	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)NC[C@@H]1CCN(C(=O)CO[Si](C)(C)C)[C@@H]1c1cccnc1	1808228129	AFYUJIQGOZFNRK-XYJFISCASA-N	435.601	1.386	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)[C@H](C)N2CCN(C)CC2)[C@@H]1c1cccnc1	1808273581	DKFBCSYVUCFNNY-FRYIKTPZSA-N	436.000	1.741	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)[C@@H](F)Cl)[C@H]1c1cccnc1	1808312362	CWASSIKAKNUWRB-MHZISWMZSA-N	448.886	1.756	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)c3cccc4ccnn34)CC2)C1	1809980679	OVGSZCGLEIQRAR-UHFFFAOYSA-N	446.316	1.173	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1ccc(F)cc1	1811900232	LXLTTZQEJPIBJR-SIKLNZKXSA-N	447.275	1.534	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)Cn2nccn2)[C@H]1c1cccnc1	1812777240	NXJHIYPXMULSEG-ZOBUZTSGSA-N	435.326	1.553	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)no1	1813070425	IWZOTNTURTZXSK-JXFKEZNVSA-N	428.493	1.071	50	20	IDGD	
COC(=O)NCC(=O)NC[C@@H]1CCN(C(=O)[C@H](C)Br)[C@@H]1c1cccnc1	1813268931	MALJLCBRRIVUFN-CORIIIEPSA-N	427.299	1.227	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H](CNC(=O)CCn2ccnn2)[C@@H]1c1cccnc1	1813428358	YPYNUVREWZXMCA-KYJSFNMBSA-N	449.353	1.800	50	20	IDGD	
O=C(CCn1ccnn1)NC[C@@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1	1813432541	ZGVLKKZGRDOFBX-YJBOKZPZSA-N	435.326	1.554	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3sc(N)nc3C)sc2C1	1815148577	LMLJYSQUYPIDNO-DTWKUNHWSA-N	429.955	1.970	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CC(C)(C)O)n[nH]1	1817061240	KBMGLZDGBVSDIZ-CBFMJHRQSA-N	443.508	1.697	50	20	IDGD	
COc1ccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)cc1	1817476541	JFQNFOBMZCXZRZ-HXUWFJFHSA-N	448.288	1.718	50	20	IDGD	
Cn1cc(F)cc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1818385014	GUGYGOVJPPGENB-KRWDZBQOSA-N	439.256	1.187	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CC(F)(F)F)[nH]n1	1819402154	PXXMXTKVBWUNMY-ZDUSSCGKSA-N	439.398	1.667	50	20	IDGD	
Cn1cc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@H](O)CCl)CC3)c2cccnc21	1819428293	OSIMXEWKNXKWIQ-IINYFYTJSA-N	433.921	1.855	50	20	IDGD	
CC[C@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](COC(C)=O)OC(C)=O)[nH]n1	1820856535	PKUYPRAPQVMFMT-CWRNSKLLSA-N	442.900	1.914	50	20	IDGD	
O=C(N[C@@H]1CCc2nc(NC(=O)[C@@H]3CC[C@@H]4CCC(=O)N4C3)sc2C1)[C@H](O)CCl	1822621399	FHFDPIOVCSRKMO-HKUMRIAESA-N	440.953	1.056	50	20	IDGD	
CN1CCN(C2(C(=O)Nc3nc4c(s3)C[C@H](NC(=O)[C@H](F)Cl)CC4)CC2)CC1	1822716065	VPWHJIXZFUNSAB-RISCZKNCSA-N	429.949	1.370	50	20	IDGD	
O=C([C@H](O)CCl)N1CCC([C@@H]2CCCCN2C(=O)Cn2nnc3ccccc32)CC1	1824849361	BXEDUKQZYFEZNG-PKOBYXMFSA-N	433.940	1.651	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnn3c1OCCC3)CC2	1826004945	VSIPMSDZQMMBNY-JQWIXIFHSA-N	439.925	1.602	50	20	IDGD	
Cc1nc(F)ccc1C(=O)N[C@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1	1826087970	MGOMENKBIJYBBG-LBPRGKRZSA-N	448.524	1.584	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H]3CCNC(=O)C3)sc2C1	1826228801	PRZJNUWGNUTBFC-VWYCJHECSA-N	443.367	1.755	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(=O)n3[nH]cnc3n2)CC1	1827049512	OWEXQEFTIRXKOB-GDBMZVCRSA-N	434.928	1.668	50	20	IDGD	
Cc1cc(CC(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)on1	1827050061	GTSXOIQXRJJKIT-OAQYLSRUSA-N	439.321	1.139	50	20	IDGD	
O=C([C@@H]1CCCS1)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827055167	QXFJTESARNVVRT-UXHICEINSA-N	430.379	1.495	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cccc(Cl)n3)C2)C1	1830357608	BHBDEQGMLDTWEU-HXUWFJFHSA-N	444.359	1.999	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)CS[C@H]3CCCCO3)C2)C1	1830364662	OAISPLRPALQFNX-PXNSSMCTSA-N	449.013	1.968	50	20	IDGD	
CC[C@H](O)C(=O)N1CCO[C@]2(COCCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1	1830526779	LUDBUFGQEFBOPB-VVMXEWNRSA-N	449.454	1.099	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3nnc(C)s3)C2)C1	1831641341	YEBDMNPDXXSQIK-HNAYVOBHSA-N	444.985	1.643	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)C[C@@H](N)c3cccnc3)C2)C1	1831645675	FEODZKNXORFTAY-UEXGIBASSA-N	438.956	1.335	50	20	IDGD	
CC[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)CCBr)C2)C1)N(CC)CC	1831663851	NCLKNSXHWFXCQD-APWZRJJASA-N	448.402	1.348	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCCC(F)(F)F)CCO2)C1	1832264966	GRAVVRFJOAYBIF-XJKSGUPXSA-N	430.851	1.429	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3nccc4[nH]ccc34)CC2)CC1)[C@H](O)CCl	1833310875	XENYEXDXPNFZHZ-GOSISDBHSA-N	433.940	1.348	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3c(F)cccc3F)CC2)CC1)[C@@H](O)CCl	1833313519	IYBSONBAMDQDIF-KRWDZBQOSA-N	429.895	1.750	50	20	IDGD	
CC(C)(C)c1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)ccn1	1833369134	PFKYVOQOLSOVHT-JXFKEZNVSA-N	427.904	1.984	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccnc(Cl)c3)CCO2)C1	1834185434	IADKWNJZYCBMMM-KSSFIOAISA-N	432.304	1.059	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)CCN3CCOCC3)CC2)CC1	1834638331	CEPQBXAZWBJIGQ-IBGZPJMESA-N	429.005	1.298	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)c3ccncc3Cl)C2)C1	1834823059	GZMDTWCYUCMITM-KRWDZBQOSA-N	446.729	1.590	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)C(Cl)Cl)CC2)CC1)c1cnn2ncccc12	1835040708	VUWXAKCLIRITJV-UHFFFAOYSA-N	439.347	1.718	50	20	IDGD	
CCOC(=O)N[C@@H](O)C(=O)N1CCC(OC2CCN(C(=O)C(C)(C)CCl)CC2)CC1	1836623234	DLNIGABRDYFLTC-INIZCTEOSA-N	447.960	1.315	50	20	IDGD	
CC(=O)N[C@H](C(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1)C(C)(C)C	1836713328	DQNGPFBNELPNOM-QZTJIDSGSA-N	445.988	1.136	50	20	IDGD	
CN(C)c1cncc(C(=O)N2CCC(OC3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)c1	1836715697	WRIHVFSCDCHQAH-IBGZPJMESA-N	438.956	1.360	50	20	IDGD	
O=C1Cc2cc(C(=O)N3CCC(OC4CCN(C(=O)[C@@H](O)CCl)CC4)CC3)ccc2N1	1836717160	KYZKQFLSCOOWFN-IBGZPJMESA-N	449.935	1.393	50	20	IDGD	
O=C(c1cccc2c[nH]nc12)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836718286	UPKBJJQRZNGIPA-SFHVURJKSA-N	434.924	1.775	50	20	IDGD	
C[C@H](C(=O)N1CCC(OC2CCN(C(=O)[C@](C)(Cl)CCl)CC2)CC1)n1cnnn1	1838637729	AWAJHYZQRTWDQG-FZKQIMNGSA-N	447.367	1.469	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3cnc[nH]3)C2)C1	1839150064	AYZDCIYCVDMNER-ZWKOTPCHSA-N	433.336	1.035	50	20	IDGD	
Cc1nc(C)c(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)o1	1839153877	UOBUZYSEURYTEW-ZWKOTPCHSA-N	434.320	1.598	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(F)c(F)c3)C2)C1	1840034338	IHJCIBZABIHWQL-XIKOKIGWSA-N	447.276	1.818	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(O)ccc3F)C2)C1	1840034805	XSTCCSRBMZQQTD-KPZWWZAWSA-N	445.285	1.385	50	20	IDGD	
CC[C@H](C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H](Cl)COC)CCO2)C1)c1ccccc1	1840151266	ZEEQSADZWBUSMW-IPJJNNNSSA-N	438.952	1.890	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C)c(O)c(C)c3)C2)C1	1840156049	HRFPXDBARJVXFE-LAUBAEHRSA-N	440.924	1.333	50	20	IDGD	
N#Cc1cc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)ccc1F	1840189528	WWZSFXPTQBIDQC-LJQANCHMSA-N	444.290	1.500	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)C3CC(C)(C)C3)CCO2)C1	1840222735	NEFUFQZSDFQWHI-KUHUBIRLSA-N	431.371	1.910	50	20	IDGD	
CC(C)[C@H]1CC[C@H](C(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)CC1	1844265187	CZKBKGFYLPGERG-QAQDUYKDSA-N	427.549	1.965	50	20	IDGD	
O=C([C@@H](F)Br)N1CC2(CCCN2C(=O)c2ccc([N+](=O)[O-])c3c2OCO3)C1	1844758478	QLFMAKGOPUPGPG-CYBMUJFWSA-N	444.213	1.831	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@]2(C[C@@H]2C(=O)N2CCCC23CN(C(=O)[C@@H](O)CCl)C3)C1	1846156517	WDQDWPPPHFKTBC-SIFCLUCFSA-N	441.956	1.437	50	20	IDGD	
C[C@H]1CC[C@@H](C(=O)N2CCCC23CN(C(=O)[C@@H](O)CCl)C3)CN1C(=O)OC(C)(C)C	1847149526	YADDYJKPFHCGKY-XHSDSOJGSA-N	443.972	1.825	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1848098796	ZNQKKYQYADLABQ-XUXIUFHCSA-N	438.352	1.574	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)[C@]23CCC(=O)N2c2ccccc2S3)cc1	10671043	CQTSBASUMSKYQR-OAQYLSRUSA-N	425.466	1.928	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1	15726983	YKVDSPVJHAUKNR-UHFFFAOYSA-N	434.416	1.549	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C2CCN(S(=O)(=O)c3ccccc3)CC2)cc1C	15886483	WJPUZLQAWMCFCC-UHFFFAOYSA-N	445.541	1.931	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c([N+](=O)[O-])cc1OC	17193166	ZHQXCHKXNSVREW-UHFFFAOYSA-N	441.400	1.324	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc2c1O[C@H](C)C2	26745585	BMXWUTTYGRDCBK-GFCCVEGCSA-N	433.486	1.344	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)c2cc(S(=O)(=O)NC(C)C)ccc2F)c1	106012331	SZUOGCVNIOVGON-UHFFFAOYSA-N	437.493	1.969	50	20	IDGD	
O=C(COC(=O)c1c(Cl)nc2ccccn12)NNC(=O)[C@@H]1COc2ccccc2O1	116786955	RTBAJWBVTNJVNN-ZDUSSCGKSA-N	430.804	1.132	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NCc1ccc(C(=O)N2CCCCC2)cc1	725872678	GLNQVOWHOKCBEG-UHFFFAOYSA-N	443.529	1.635	50	20	IDGD	
CC(C)c1ccccc1NC(=S)NNC(=O)c1cnc2c(c1)c(=O)n(C)c(=O)n2C	727171752	MOYIAVHKYNNCOE-UHFFFAOYSA-N	426.502	1.387	50	20	IDGD	
CN(CCO)S(=O)(=O)c1ccc(C(=O)NNC(=O)CC23CC4CC(CC(C4)C2)C3)cc1	728312106	BVYHGAUHPNBCTN-UHFFFAOYSA-N	449.573	1.667	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CCCN(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)C1	728958623	BVUFXNYOJJXPHT-MRXNPFEDSA-N	447.540	1.423	50	20	IDGD	
COC(=O)Cc1cc(=O)n(-c2ccc(C(=O)NNC(=O)c3cccc4ncccc34)cc2)[nH]1	730228052	YGUIIBJEHSWVKZ-UHFFFAOYSA-N	445.435	1.504	50	20	IDGD	
O=C(NNc1ccc(Br)cc1)c1ccc2c(c1)S(=O)(=O)N=C1N=CNN12	731784892	KQYRWRFLBCRBJY-UHFFFAOYSA-N	435.263	1.617	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)N2CCC(C(=O)NCCN(C)C)CC2)c1C	733169362	XYSQCSFAHPHQRA-RCCKNPSSSA-N	429.565	1.575	50	20	IDGD	
COCCOc1cn(-c2ccccc2)nc1C(=O)NNc1nc2ccccc2c(=O)n1C	733260956	UDQCFRULDPEXDU-UHFFFAOYSA-N	434.456	1.901	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)N[C@H]2CCN(CCN3CCOCC3)C2)c1C	734468003	NTGRJDIJTVEZFF-VAZXNAHHSA-N	429.565	1.181	50	20	IDGD	
Cc1cc(C)c(C)c(S(=O)(=O)N2CCC(C(=O)NNC(=O)c3cnn(C)c3)CC2)c1C	735445419	ULCKIQHXDSAJKP-UHFFFAOYSA-N	447.561	1.516	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN2CCN(C(=O)c3cccc(OC)c3)CC2)cc1C	736309378	VYXHLFSHBZICCB-UHFFFAOYSA-N	444.557	1.847	50	20	IDGD	
CCc1ccc(O[C@@H](C)C(=O)N2CCN([C@@H](C)C(=O)NNC(=O)CC(C)C)CC2)cc1	736620859	DSLCFNZKKKFLTI-ROUUACIJSA-N	432.565	1.743	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)N[C@@H]1CCN(c2ccc(Cl)cc2)C1=O	740484655	QYIDTFAFKGEMAO-MRXNPFEDSA-N	427.848	1.726	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)N[C@@H](C)[C@H]2CN(Cc3ccccc3)CCO2)cc1	741437271	XVLCNAVKCUVRQZ-GHTZIAJQSA-N	426.517	1.994	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)c2cc(N3CCOC3=O)ccc2F)c2ccccc2c1=O	741661804	YVSKLQUEVHNNEI-UHFFFAOYSA-N	425.376	1.104	50	20	IDGD	
O=C(NCc1cccnc1OCC(F)(F)F)NNC(=O)c1cc([N+](=O)[O-])ccc1O	745470970	NSIDWEVVIRYYSK-UHFFFAOYSA-N	429.311	1.781	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)NCCCN2C(=O)COc3ccccc32)nc2ccccc21	745857409	PVAVNGVTVHRZIO-UHFFFAOYSA-N	436.472	1.262	50	20	IDGD	
CO[C@H](CNC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1)C(C)C	745928540	PSDPHPULJUMFFC-LJQANCHMSA-N	448.545	1.780	50	20	IDGD	
NC(=O)COc1ccc(C=NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)cc1	745984361	PPUKFRBQKQOJAA-UHFFFAOYSA-N	444.513	1.489	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cc(-c3ccccn3)no2)cc1	746094452	XLTCFZDEAPXFHV-UHFFFAOYSA-N	429.458	1.127	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)[C@@H](C)N3C(=O)[C@@H]4[C@H]5CC[C@@H](O5)[C@@H]4C3=O)cc2C1	746100485	NBXQXRWOAMQMAM-KXYDIPTESA-N	431.514	1.185	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(C(=O)NNC(=O)Cc2cn3ccccc3n2)ccc1Cl	746549315	OSGWJMVYUGHDIE-UHFFFAOYSA-N	435.893	1.242	50	20	IDGD	
CC(C)CNS(=O)(=O)c1ccc(C(=O)NNC(=O)Cc2cn3ccccc3n2)cc1	746641591	PRKAGEQJXZFQPT-UHFFFAOYSA-N	429.502	1.272	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)CC2(CS(C)(=O)=O)CC2)cc1	746816408	QITJOQMOQLEKND-UHFFFAOYSA-N	437.547	1.083	50	20	IDGD	
O=C(CCN1C(=O)[C@H]2[C@H](C1=O)[C@H]1CC[C@H]2O1)NNc1nc(-c2ccccn2)nc2c1CCC2	748341588	UZPZSWQXNCRYJJ-PSBWJHGTSA-N	448.483	1.023	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)NCCC(=O)N1CCCCCC1	748343927	OTRJLOOMPSTRNS-UHFFFAOYSA-N	441.326	1.951	50	20	IDGD	
COc1cc(OC)cc(N2CC[C@@H](NC(=O)NNC(=O)COc3ccccc3C#N)C2)c1	748661034	ICKAZODURZFGBY-MRXNPFEDSA-N	439.472	1.564	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCCCc2nc3ccccc3[nH]2)nc1	749347699	XRLOYQHKIIXLBC-UHFFFAOYSA-N	431.522	1.904	50	20	IDGD	
O=C(NCC1CCN(S(=O)(=O)C(F)(F)F)CC1)NNC(=O)c1cc2ccccc2o1	749569198	AWQIKWCSPNMAPB-UHFFFAOYSA-N	448.423	1.938	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@H](C)c2ncc(C)s2)cc1	750662253	KVROEPXWGNIIDH-CYBMUJFWSA-N	425.536	1.472	50	20	IDGD	
CCOC(=O)[C@@H]1Cc2cc(S(=O)(=O)NNC(=O)COCc3ccccc3)ccc2O1	751547160	JWJCAZBWDOFMRF-SFHVURJKSA-N	434.470	1.080	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)c1cc(S(=O)(=O)N(C)C)c(C)o1	753564114	SCARGKGCXMPYAB-UHFFFAOYSA-N	425.463	1.077	50	20	IDGD	
COc1ccc2c(c1)C=C(C(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1)CO2	755042307	ZTXCSIUAWKFVPL-UHFFFAOYSA-N	445.497	1.248	50	20	IDGD	
CCc1nn(C)c(CC)c1CNC(=O)NNc1ccc(S(=O)(=O)N(CC)CC)cn1	755081826	ATHGOJDGYONZLI-UHFFFAOYSA-N	437.570	1.797	50	20	IDGD	
NC(=O)c1ccc(/C=C/C(=O)N2CCC[C@@H]2C(=O)NNc2ccc(C(F)(F)F)nn2)cc1	755182615	MVGQFZVRXOEADM-AZWQULSGSA-N	448.405	1.742	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNS(=O)(=O)c2csnc2C(=O)OC)cc1	755956091	JVOWTYNHNLNEOK-JTQLQIEISA-N	429.476	1.105	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2cn(C)c(=O)cc2C)c1	756890402	JMLXYGDYHJZQCL-UHFFFAOYSA-N	435.506	1.191	50	20	IDGD	
NC(=O)c1ccc(NNC(=O)c2ccc(S(=O)(=O)Nc3ccccc3F)cc2)nn1	757402789	PDTORJVJRDLINT-UHFFFAOYSA-N	430.421	1.272	50	20	IDGD	
CCO[C@@H]1C[C@@H](NC(=O)NNC(=O)COc2ccc(Br)cc2)[C@]12CCCO2	759325455	YZHAAAGBABFVDJ-IIDMSEBBSA-N	442.310	1.885	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN([C@H]2CCCN(CCI)C2)C(=O)C1	759453409	WGWGWKBFHBIVKY-ZDUSSCGKSA-N	437.322	1.965	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)[C@@H](C)N2C(=O)c3ccc(Br)cc3C2=O)nc1	759725413	PKGZQMCKHBGIDT-SECBINFHSA-N	447.245	1.759	50	20	IDGD	
O=C(CN1C(=O)c2cccc([N+](=O)[O-])c2C1=O)NNC(=O)c1cc(-c2cccs2)[nH]n1	763168003	NRNKPVLEWNOQPT-UHFFFAOYSA-N	440.397	1.104	50	20	IDGD	
NC(=O)CCSc1ccccc1NC(=O)C(=O)NNC(=O)c1ccc2ccccc2n1	763451373	WSJYCNBDOKTGMY-UHFFFAOYSA-N	437.481	1.602	50	20	IDGD	
Cc1nc(-c2ccc(NC(=O)C(=O)NNC(=O)c3ccccc3Br)cc2)n[nH]1	763483457	UFFZWLJBLHMUAG-UHFFFAOYSA-N	443.261	1.942	50	20	IDGD	
CCCc1ccccc1NC(=O)C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	763529935	DDYFTFGGWDOEEF-UHFFFAOYSA-N	437.544	1.937	50	20	IDGD	
CCCS(=O)(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2c[nH]c3ccccc23)c1	763540336	FYQHQITTXSBSRJ-UHFFFAOYSA-N	443.485	1.719	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)C(=O)Nc1cccc(C#Cc2ccccn2)c1	763550639	IOKSUSOPFHXEOK-UHFFFAOYSA-N	428.404	1.610	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccn(Cc3ccccn3)n2)c2ccccc2n1	763615409	OGDAFNLRPLQYHH-UHFFFAOYSA-N	429.440	1.583	50	20	IDGD	
CN(C)c1ncncc1NC(=O)C(=O)NNC(=O)COc1ccccc1-c1ccccc1	763643998	NBQVGLRQLPAKSU-UHFFFAOYSA-N	434.456	1.375	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2ccccc2-n2nc(C)nc2C)c1	763646208	CXDZCMGYSBSHCA-UHFFFAOYSA-N	436.472	1.666	50	20	IDGD	
CC[C@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C)c(C)c2)cc1	763667087	POARSZQWYCXXNV-INIZCTEOSA-N	440.500	1.997	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(OC[C@H]3CCCO3)c2)cc1	763673206	AHMINENWXVYSQC-LJQANCHMSA-N	438.440	1.281	50	20	IDGD	
COc1cc(F)ccc1NC(=O)C(=O)NNC(=O)COc1ccc(Br)cc1	763695646	ROWOWZASUCYGIW-UHFFFAOYSA-N	440.225	1.762	50	20	IDGD	
Cc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NNC(=O)CN1CCCc2ccccc21	763732781	DTMNOXHMZNQTQM-UHFFFAOYSA-N	437.500	1.236	50	20	IDGD	
CCCN1Cc2cccc(NC(=O)C(=O)NNC(=O)COc3ccccc3[N+](=O)[O-])c2C1	763803373	HEKVLSFXGZCADV-UHFFFAOYSA-N	441.444	1.485	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)C(=O)Nc1ccc(-n2cncn2)nc1	763850958	CGAOOWIEUYDAIS-CQSZACIVSA-N	445.439	1.369	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)c2cccnc12	763948683	KZXFTGGMDMKGHB-UHFFFAOYSA-N	446.423	1.534	50	20	IDGD	
COC(=O)[C@@H]1CN(C(=O)C(=O)NNC(=O)Cc2ccc3ccccc3c2)c2ccccc2O1	764083374	QZJFBKJVTVTKPM-FQEVSTJZSA-N	447.447	1.497	50	20	IDGD	
CC[C@@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(CCn2nnc(-c3ccccc3)n2)cc1	764087202	XSKIPWLOHHNBQE-OAHLLOKOSA-N	435.488	1.715	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1O)C(=O)Nc1ccnc(OCC(F)(F)F)c1	764125904	AHFXSRNRMJLEBB-UHFFFAOYSA-N	432.742	1.781	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ncn(Cc3ccc(Cl)cc3)n2)c1O	764131227	OVDHQSUZEHLQGW-UHFFFAOYSA-N	444.835	1.094	50	20	IDGD	
CC(C)OC(=O)NCc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)cc1	764151960	BAERJUJBYFXKGX-GOSISDBHSA-N	440.456	1.411	50	20	IDGD	
CCN(CC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)Cc1ccc(C(=O)N(C)C)cc1	764233105	KKDPBXZJFIQFGM-UHFFFAOYSA-N	427.461	1.580	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)cc1S(C)(=O)=O	764243360	VHEISRCOVMPHOX-UHFFFAOYSA-N	428.470	1.139	50	20	IDGD	
CC(C)Oc1ccc(NC(=O)C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1	764268162	YEZFYACYYMSHPP-UHFFFAOYSA-N	426.477	1.266	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2sc(C)nc2C)cc1Br	764326430	HYXUYZYYADLEKP-UHFFFAOYSA-N	427.280	1.931	50	20	IDGD	
CNC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)ccc1Cl	764350731	JPXZNFDIOFTGTC-UHFFFAOYSA-N	440.847	1.285	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)C(=O)Nc2cnn(-c3ccccc3F)c2C)c1	764434826	ZDOJICAGSLGSSL-UHFFFAOYSA-N	439.407	1.073	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)c1ccc2c(c1)nc(O)n2CC(F)(F)F	764512325	BSQGGGKRTZUOCH-OAHLLOKOSA-N	436.346	1.905	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)Nc3ccc(S(C)(=O)=O)nc3)n[nH]2)cc1	765306845	KIXROLJCZXXUEW-UHFFFAOYSA-N	428.474	1.904	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@]1(C)CCCC[C@H]1C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	765542890	SPEUUIGSOIFFCQ-KKSFZXQISA-N	443.508	1.897	50	20	IDGD	
CCCN1CCN(c2ccc(NC(=O)C(=O)NNc3nccnc3OC)cc2Cl)CC1	766264609	NBEMITQUQCDVRF-UHFFFAOYSA-N	447.927	1.752	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)c2ccccc2S(=O)(=O)CCN(C)C)cc1OC	767163620	OQYBRSBBVOTENI-UHFFFAOYSA-N	449.529	1.504	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)[C@@H]1CC(=O)N(c2ccccc2Cl)C1	767270174	QOBDVXDQCDXSHN-MRXNPFEDSA-N	443.887	1.935	50	20	IDGD	
COc1cc(C(=O)OCC(=O)NNC(=O)Cc2ccccc2C)cc(NC(C)=O)c1OC	767352674	GBVUYNFSOADQSX-UHFFFAOYSA-N	443.456	1.518	50	20	IDGD	
COC(=O)c1cccc(CCNC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)c1	768675995	BVJJUHJQTPBVMN-UHFFFAOYSA-N	447.517	1.261	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1cccc2c1CCN2C(C)=O	769267901	UHMFGBUDFXWNEM-UHFFFAOYSA-N	430.848	1.657	50	20	IDGD	
O=C(COC(=O)CSCc1ccc(F)cc1)NNC(=O)[C@H]1COc2ccccc2O1	769673714	JATJXQMHFGHZKC-QGZVFWFLSA-N	434.445	1.590	50	20	IDGD	
CC[C@H](C#N)Oc1cc(CNC(=O)NNc2nc(O)c3cnn(C)c3n2)ccc1OC	770394593	KUWLKHYMMFMHCV-GFCCVEGCSA-N	426.437	1.585	50	20	IDGD	
CS(=O)(=O)N1CCCc2cc(C(=O)NNC(=O)c3ccc4c(c3)OCCO4)ccc21	770420233	VGQOYVLLDXUPMB-UHFFFAOYSA-N	431.470	1.245	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)CCCN3C(=O)c4ccccc4C3=O)nc21	770954837	IMZDRKVMVBYLJD-UHFFFAOYSA-N	437.460	1.806	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)[C@@H](NS(=O)(=O)c1ccc2ccccc2c1)C(C)C	771881677	BRKBNCOCFMPUPJ-KUHUBIRLSA-N	449.529	1.632	50	20	IDGD	
O=C(C[C@H](O)c1cccc(F)c1)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	772555168	MDOYMMGPPQZWKM-IBGZPJMESA-N	449.504	1.885	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNS(=O)(=O)c2ccc(C(=O)OC)c(F)c2)cc1	773249038	DBQQGSLESZOVPN-GFCCVEGCSA-N	440.449	1.788	50	20	IDGD	
O=C(NNc1ccc(C(F)(F)F)cn1)C(=O)Nc1cccc(S(=O)(=O)NC2CC2)c1	773669418	KMKNDIZLKSCPOW-UHFFFAOYSA-N	443.407	1.623	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2c(C)n(C)n(-c3ccccc3)c2=O)cc1F	773888220	GRHZMHNZXVLIHN-UHFFFAOYSA-N	425.420	1.332	50	20	IDGD	
COc1ccnc(NNC(=O)Nc2cccc(S(=O)(=O)NC3=NCCCCC3)c2)n1	775460251	SFQKVDSOYCELBS-UHFFFAOYSA-N	433.494	1.885	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)c1	776467152	PTDVNCJKGWOMDW-UHFFFAOYSA-N	438.531	1.474	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc(OC)c1OC	778218192	DGRLCITWIINPEI-UHFFFAOYSA-N	437.478	1.472	50	20	IDGD	
Cc1nn(C)c(-n2cccn2)c1C(=O)OCC(=O)C(C#N)=C1N(C)c2ccccc2N1C	778483558	XYQITFHLLSDYCT-UHFFFAOYSA-N	431.456	1.962	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccc3c(c2)CC(C)(C)O3)nc1	783264397	OTRRVYSIRGDOKZ-UHFFFAOYSA-N	447.517	1.564	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccc3c(c2)C(=O)CCC3)nc1	783265654	WGTIGBVCHODKAT-UHFFFAOYSA-N	445.501	1.369	50	20	IDGD	
CCN1CCN(S(=O)(=O)c2cccc(NC(=O)C(=O)NNc3ccc(C)cc3)c2)CC1	783346582	SJSSWINFZYSBPM-UHFFFAOYSA-N	445.545	1.403	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)C(=O)Nc1cccc(-n2cccc2)c1	784210560	VMLLTGGTLSOHBX-UHFFFAOYSA-N	439.497	2.000	50	20	IDGD	
Cc1cccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)c1	784230043	JLMNHLSOFAPGTD-UHFFFAOYSA-N	431.518	1.013	50	20	IDGD	
C[C@H](C[S@](C)=O)NC(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1	784254391	LICXEKYWHNEYKL-YRJQNMBXSA-N	428.558	1.711	50	20	IDGD	
O=C1C[C@@H](Cc2ccc(NC(=O)C(=O)NNc3ccc(Br)cn3)cc2)C(=O)N1	784344819	BDFNQQCKHIOVNT-LLVKDONJSA-N	446.261	1.131	50	20	IDGD	
COc1cccc(NNC(=O)C(=O)Nc2ccc(F)c(S(=O)(=O)NC(C)(C)C)c2)n1	784846028	KXYCHAXGFYSITM-UHFFFAOYSA-N	439.469	1.388	50	20	IDGD	
O=C(NNc1cccc(C(F)(F)F)n1)C(=O)Nc1ccc(N2CCCS2(=O)=O)cc1	784954548	PBMYGYGSIRLDLU-UHFFFAOYSA-N	443.407	1.722	50	20	IDGD	
O=C(NNc1ncc(F)cn1)C(=O)Nc1ccnn1Cc1ccc(OC(F)(F)F)cc1	784958069	VPSQWFGAYSDOIJ-UHFFFAOYSA-N	439.329	1.841	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2c[nH]nc2-c2ccc3c(c2)OCO3)cc(OC)c1OC	784993306	IELAXDAUWVKXLI-UHFFFAOYSA-N	440.412	1.906	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1cccc(Cl)c1N(C)C	785330750	LDXUTPRXBCYWHU-UHFFFAOYSA-N	440.909	1.900	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2ccccc2CCOC)c2ccccc2c1=O	786414189	KNFYGGYHQGQVHU-UHFFFAOYSA-N	437.456	1.005	50	20	IDGD	
Cc1cnc(Cl)c(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)c1	787896984	RXEKELQXURILAH-UHFFFAOYSA-N	426.886	1.207	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)Nc1ccnc(Oc2ccc(F)cc2F)c1	788740052	VITWCYYKFLLJBB-JTQLQIEISA-N	426.401	1.740	50	20	IDGD	
CN1CCC(Oc2ccc(CNC(=O)NNC(=O)[C@@H]3COc4ccccc4O3)cc2)CC1	790926069	KSMFPASBNFVUSI-NRFANRHFSA-N	440.500	1.830	50	20	IDGD	
Cc1cc(Cn2nnc(C(=O)NNC(=O)c3ccc(Br)s3)c2C)on1	794196716	VRRNIXHNCQHJKK-UHFFFAOYSA-N	425.268	1.830	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)CNC(=O)OCc2ccccc2)c2cccnc2c1C	797369184	PXPBEJVWRUZKSR-UHFFFAOYSA-N	449.467	1.864	50	20	IDGD	
Cn1cc(C(=O)NNS(=O)(=O)c2cc(C(F)(F)F)ccc2Br)cn1	799123400	UKSRRIQYKLGSDD-UHFFFAOYSA-N	427.202	1.825	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2CC(=O)N(C(C)(C)C)[C@H]2c2cnn(C)c2)cc1	801110837	HSSNEXOWHGHLAT-AEFFLSMTSA-N	440.504	1.203	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)NC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1	802329896	OFKXTIGBEFLWAR-HNNXBMFYSA-N	426.429	1.230	50	20	IDGD	
COc1cc(C(=O)CCC(=O)NNc2ccc(-n3ccnc3)nn2)cc(OC)c1OC	804958500	ZNSOGMSAGOXPAN-UHFFFAOYSA-N	426.433	1.794	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N2C[C@H](N3CCOCC3)C[C@H]2C)cc1Br	805104231	NRULXXGMPIDTRX-TZMCWYRMSA-N	441.326	1.607	50	20	IDGD	
CCc1nnc(NC(=O)[C@@H](C)[C@H](C)NC(=O)NNC(=O)Cc2cn3ccccc3n2)s1	805878303	IATIWQCWXYAFDF-RYUDHWBXSA-N	444.521	1.284	50	20	IDGD	
COC(=O)c1cc(Br)c(OC)cc1NC(=O)C(=O)NNC(=O)CC1CC1	806977526	NLLODVQQWLPHEL-UHFFFAOYSA-N	428.239	1.130	50	20	IDGD	
C[C@@H](CCOCc1ccccc1)NC(=O)NNC(=O)c1csc(N2CCOCC2)n1	807607604	RBPYBKFEEGBUAN-HNNXBMFYSA-N	433.534	1.919	50	20	IDGD	
O=C1CC(C(=O)N2CCN(S(=O)(=O)CBr)CC2)(c2cccc(Cl)c2)C1	810909389	DECREBWFFGHJGC-UHFFFAOYSA-N	449.754	1.767	50	20	IDGD	
C[C@H](CN1CCOCC1)C(=O)NN=C1CCN(C(=O)OC(C)(C)C)C[C@@H]1[C@@H]1CCOC1	812225349	XJKMWRHDWKHTRC-KZNAEPCWSA-N	438.569	1.720	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)N2CCN([C@H](C)C(=O)NC3CC3)CC2)c1C	812757803	VICIGQGGGVEZAT-WRDGEJPTSA-N	427.549	1.470	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)nnn1Cc1ccccc1F	815566312	PSKPTVSELFUCIC-UHFFFAOYSA-N	444.398	1.078	50	20	IDGD	
O=C(NNC(=O)C1CCCC1)c1cccc(NS(=O)(=O)c2ccc3nnn(O)c3c2)c1	914868459	HBXBRFMHYZYHRH-UHFFFAOYSA-N	444.473	1.421	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)CNC(=O)CC23CC4CC(CC(C4)C2)C3)c1	915077160	GPSHQHQIRXFDAP-UHFFFAOYSA-N	447.557	1.574	50	20	IDGD	
O=C(NC[C@@H]1CC1(Cl)Cl)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	915907912	JJTVWIFRRDCJNS-ZDUSSCGKSA-N	449.360	1.999	50	20	IDGD	
Cc1ccc(C=NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1[N+](=O)[O-]	916258337	SUAHSLYREGPJNR-UHFFFAOYSA-N	432.458	1.688	50	20	IDGD	
COCCOc1ccc(CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1	916514511	SBBDFVBPZKIECD-UHFFFAOYSA-N	435.506	1.149	50	20	IDGD	
O=C(Cc1cccc2ccccc12)NNC(=O)NC[C@]1(N2CCOCC2)CCSC1	916636873	NUWURSQMTLFGSE-JOCHJYFZSA-N	428.558	1.921	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2cc(Br)c[nH]2)cc1	916646839	QOQQEBNXIRLMMK-UHFFFAOYSA-N	444.311	1.172	50	20	IDGD	
COc1cc(C(=O)NCC(=O)NNC(=O)c2ccc(Cl)nc2)ccc1OC(F)F	917250593	BFKZLWYGGYOQBY-UHFFFAOYSA-N	428.779	1.536	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)CN(C)C(=O)c1ccc(Br)o1	917392896	WEGPHJWEXGYKSL-UHFFFAOYSA-N	434.250	1.531	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)NC2CCN(CC3CC3)CC2)c2ccccc2c1=O	918083810	LPCFSTYDLNYMRT-UHFFFAOYSA-N	426.521	1.796	50	20	IDGD	
CCNC(=O)COc1cccc(CNC(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)c1	918091520	WGINNYYTIONARW-CQSZACIVSA-N	432.452	1.639	50	20	IDGD	
O=C(CCCNC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)Nc1ccc(Cl)cc1	918095402	YKYHOPQMFPDQGZ-UHFFFAOYSA-N	442.867	1.679	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)CN1CCCC1	918223985	VQSYGVANLDPYMP-INIZCTEOSA-N	437.566	1.147	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccccc1	919822280	JSFPHAXJJYLSIF-GOSISDBHSA-N	431.514	1.629	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N[C@@H](C)Cn2cncn2)cc1	920851670	MSCDOGSYNPWODE-MBBOSUJBSA-N	448.487	1.137	50	20	IDGD	
COc1ccc(CN2C[C@H](C(=O)NNC(=O)c3cncn3-c3ccccc3)CC2=O)cc1	1115956058	WOIFBEHRCLLQAD-QGZVFWFLSA-N	433.468	1.691	50	20	IDGD	
COc1cc(C=NNC(=O)CCN2CCC(C)CC2)ccc1OCC(=O)N1CCOCC1	1317711662	BVOMZFGRNCOALL-UHFFFAOYSA-N	446.548	1.505	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3ncoc3[C@@H]3CCCO3)CC2)cc1	1319401568	QJAHBDYBSUIGSU-SFHVURJKSA-N	427.505	1.413	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)c1cc2c(cn1)OCCC2	1320006596	ZLRRXQBXPWLJAN-UHFFFAOYSA-N	443.935	1.639	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CCNC(=O)[C@H]2CCCN2C(=O)OC(C)(C)C)cc1	1320292744	PXNJOLIIQDMKIY-MRXNPFEDSA-N	434.493	1.362	50	20	IDGD	
Nc1cnnc(NNC(=O)c2ccc(Cl)c(S(=O)(=O)N3CCCC3)c2)c1Cl	1324008344	CUEHZCCLSFNTDY-UHFFFAOYSA-N	431.305	1.907	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H]3Cc4ccccc4O3)C2)C1	1778243401	ZUTMXIVBEATBQT-ZTQAJYAQSA-N	437.334	1.851	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc4n(n3)CCCO4)C2)C1	1778553332	AKSOWVYJQIUEKK-FZKQIMNGSA-N	441.326	1.140	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2)c1ccc2c(c1)CCCC2=O	1778646037	IMISWRVJZNQRBG-TXTKFYIRSA-N	448.947	1.933	50	20	IDGD	
O=C(c1cc(Cl)c2nncn2c1)N1CC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1778948580	WCUYBMPZIFPQQN-MRXNPFEDSA-N	432.695	1.630	50	20	IDGD	
C=C(C)CC(C)(C)C(=O)N1CC[C@]2(CN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CCO2)C1	1779241745	YJGKSFXCAWQJJA-VAHWYXDJSA-N	443.548	1.943	50	20	IDGD	
CN(C)C(=O)c1cccc(C(=O)N2CCO[C@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)c1	1779299591	AEVLOKAABNDEJN-QFIPXVFZSA-N	447.608	1.683	50	20	IDGD	
O=C(c1cc[nH]c2nccc1-2)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781331760	VPCAITIQORQFCC-GUYCJALGSA-N	425.258	1.649	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ncn(C)n1)C2	1781901873	ZMRYHOVUBJNKQR-OGHNNQOOSA-N	428.331	1.116	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCCn2ccnc2C)C1	1782491256	XYBOBGXEUAPKJP-WAOWUJCRSA-N	440.972	1.739	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cc4ncccn4n3)CCO2)C1	1783349097	HESREVRSRUNPRP-UGSOOPFHSA-N	436.310	1.346	50	20	IDGD	
COc1cnc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](C)Br)C3)C2)c(F)c1	1783532667	QTSSXLJZQXGEHV-GTNSWQLSSA-N	430.274	1.456	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)Cc1ccccc1)CCO2	1783539595	MDPUUSXFZWCGAY-ZSZQSSIHSA-N	425.323	1.203	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(Cl)cnc3OC)CCO2)C1	1783869311	OSBXWYARNAIIJO-KDOFPFPSSA-N	432.304	1.441	50	20	IDGD	
Cc1cc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]32)nn1C	1784241436	TYQBZVCUZOJXOE-QBWPOKONSA-N	431.364	1.487	50	20	IDGD	
O=C(c1ccc(CO)c(F)c1)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1785268719	VVMRMBDGARNZLR-YOEHRIQHSA-N	433.249	1.452	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3n[nH]c4ccccc34)C[C@@H]21	1786407254	URTNFVVKCHOKSA-NOLJZWGESA-N	435.322	1.941	50	20	IDGD	
Cc1n[nH]c(C)c1CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCBr)[C@H]2C1	1786408803	BSEIJXMNRIUYLS-BPUTZDHNSA-N	427.343	1.334	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc4[nH]ncc34)[C@H]2C1	1787312974	UCOBYLBAYKVNQD-HJXMPXNTSA-N	435.322	1.940	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC1(c2ccc(NC(=O)c3ccc(O)cn3)cc2)CCC1	1787582527	HZOXJGLYNQUOBE-UHFFFAOYSA-N	446.467	1.847	50	20	IDGD	
Cn1nc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Br)C[C@@H]32)c2c1CCC2	1788020858	HDGHHVPJDZPIOJ-ZAJUMQRFSA-N	443.317	1.193	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C#CC3(O)CCCCC3)C[C@@H]21	1788764827	XGTAWIFJSJGWQV-FHWLQOOXSA-N	436.625	1.516	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)ON=C(C)C)[C@H]2C1	1789957388	PZZUUMRTWKNJSF-CWVYHPPDSA-N	432.359	1.941	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccccc3C(N)=O)[C@H]2C1	1790128380	HZKMHFHJLKSWHL-NADSTKFWSA-N	442.343	1.615	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3scnc3C3CC3)C[C@@H]21	1791252077	BJHKPUHLYGEDQK-AJNGGQMLSA-N	427.954	1.868	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1ccc(C2(NC(=O)CSCC(=O)O)CCC2)cc1	1791602521	JPPCYGYEXUNRRE-UHFFFAOYSA-N	436.534	1.311	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CNC(=O)OC(C)(C)C	1793006089	CAMXNPNESFPAOC-YIDVYQOGSA-N	431.961	1.918	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CNC(=O)OC(C)(C)C	1793011337	BNPQFUUBNCCYFO-PDWCTOEPSA-N	448.358	1.294	50	20	IDGD	
C#CCO[C@@H](C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)C2	1793348001	VRYMTRRUEWKHSI-XVOKVJDBSA-N	443.450	1.500	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCC(=O)N1CCCC1	1793803178	BWXKVTKFKQZILL-ZXFNITATSA-N	444.370	1.010	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnccc1C(F)(F)F	1794719816	IXXHSJYZBJNORJ-BAESOJJISA-N	435.830	1.557	50	20	IDGD	
Cn1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C3)cn1	1795110250	LPGRWBUPEVZGFI-FZKCQIBNSA-N	439.944	1.804	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cn1cc(Cl)cn1	1795761276	FYQAYAPYJFSCCN-NDPMZMCLSA-N	433.734	1.300	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)[C@@H]1C[C@H]1c1ccc(F)cc1	1796189568	DMXFZZKAFICUPS-LILSUDLASA-N	436.292	1.561	50	20	IDGD	
CCCc1onc(C)c1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1	1796191029	QDYLCIBOTSJXPS-BCDXTJNWSA-N	425.294	1.181	50	20	IDGD	
O=C(/C=C/C(=O)c1cccs1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2	1796444654	AWULMFXXQSDAIH-SHXSXUFKSA-N	441.347	1.862	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2c(c1)OCO2	1796787287	BUPXOOFXRWFSGG-UMPJEAMMSA-N	439.306	1.792	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cc1cccc(C)n1)C2	1796890979	RRUUYVAFMRLDFU-INZAXJFKSA-N	436.516	1.705	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2nccnc2c1	1797057427	ZJJIGRVJKHZBJS-MBMVNNNZSA-N	433.306	1.616	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CSc1ccc(C)cc1	1797124747	ZPKFSHZCBKDCDK-LORHWOILSA-N	426.966	1.931	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)c1cc(-c2cccs2)on1	1798125796	LKFWPXNGCZWJHW-DZJQYVJYSA-N	425.894	1.206	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)c1ccncc1-c1ccccc1	1798341238	ZWGWAFKYMRFNAB-WOUAJJJCSA-N	429.904	1.552	50	20	IDGD	
CN(C)c1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Br)C3)cc1	1798937593	FURPEBZIVGVJJO-XRGAULLZSA-N	428.302	1.646	50	20	IDGD	
COc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)CBr)C3)ccc1O	1798948047	LSNKRORYMBBHFA-DPYKFYPSSA-N	441.322	1.635	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1c(F)ccc(O)c1F	1799729270	LTHQKNVPTNYAFU-AMDHYVTDSA-N	433.249	1.657	50	20	IDGD	
C[C@@H](CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCC(=O)NN(C)C)c1ccccc1	1801012589	BBOQRVVBDHZCGU-CVFMPKEZSA-N	430.549	1.143	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cccc3c2OCCO3)[C@H]1c1cccnc1)[C@H](O)CCl	1803139652	RZVIINGSKCYLST-WDYCEAGBSA-N	445.903	1.772	50	20	IDGD	
Cc1nccn1CCCC(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]1c1cccnc1	1803145534	DPCKHOLOULMANA-QWFCFKBJSA-N	433.940	1.672	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)CN2CCN(C)CC2)[C@H]1c1cccnc1	1803692956	BETQONGQXILHSJ-DYXWJJEUSA-N	436.000	1.742	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(OCC2CC2)cc1)c1cccc(B(O)O)c1	1803792332	XZZJZVHPFMNCRK-KOUNCHBCSA-N	448.328	1.721	50	20	IDGD	
Cc1oncc1C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1	1805799563	SMUBMOHVVFHPIT-DNVCBOLYSA-N	449.471	1.010	50	20	IDGD	
O=C(CCBr)NC[C@H]1CCN(C(=O)Cc2cncnc2)[C@@H]1c1cccnc1	1806341919	IGZQCBJMJRZRDF-VQIMIIECSA-N	432.322	1.905	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1CCN(C(=O)CSC(=N)N)[C@@H]1c1cccnc1	1808297390	ZDGWRRJUUABPAE-QEORTHHSSA-N	432.377	1.950	50	20	IDGD	
C[C@H](CC(N)=O)C(=O)N1CC[C@H](CNC(=O)[C@@H](F)Br)[C@@H]1c1cccnc1	1808649424	RLIVLVZAIVUIHL-WAZAZEMKSA-N	429.290	1.289	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)N1CC[C@H](CNC(=O)[C@@H](F)Br)[C@H]1c1cccnc1	1808662270	JTBHOGLDVCVNSJ-XJFOESAGSA-N	444.305	1.225	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)[C@@H]3[C@@H]4C=CS[C@@H]34)CC2)C1	1809980628	YMDAWMHKOJBOKW-IPMKNSEASA-N	426.347	1.086	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)c1nn[nH]c1C(F)(F)F	1811562140	DCPAAXVJZCHBKK-GVXVVHGQSA-N	446.817	1.138	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)C(=O)c2cccn2C)[C@H]1c1cccnc1	1813033825	SXDDVNSMIPCUMZ-BQFCYCMXSA-N	432.908	1.563	50	20	IDGD	
C[C@H](Oc1ccccn1)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1	1813407246	SUEWWNJLHCNOSS-XPYUAMARSA-N	432.908	1.550	50	20	IDGD	
C=CCNC(=O)/C=C\C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](F)Br)[nH]n1	1814438760	TWWGTXPQAKCWAN-OPXNRTNISA-N	442.289	1.951	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H]2C[C@@H]2F)[nH]n1	1818113768	XZTFQQCCJNJFHE-PKIILGJSSA-N	429.456	1.894	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H]2CCCCO2)[nH]n1	1819400439	KRIKIQCGUSBWNC-IAGOWNOFSA-N	441.492	1.283	50	20	IDGD	
COc1ccnc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@H](O)CCl)CC3)c1OC	1821792961	BPOABTFJRCSFEI-GXSJLCMTSA-N	440.909	1.381	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CNC(=O)N(C)C)CC1	1823881413	AVCRCGMICUVWKG-ZFWWWQNUSA-N	431.375	1.661	50	20	IDGD	
C[C@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1)n1ccnc1	1824313683	ZNZZNQJHQOEVOH-DYESRHJHSA-N	438.337	1.057	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnc3ncccn13)CC2	1826000193	OCFKFFZPPYHDRY-WDEREUQCSA-N	434.909	1.665	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2CCC=CO2)CC1	1828896529	WRGWJXXXXSLREK-PMACEKPBSA-N	441.532	1.611	50	20	IDGD	
Cc1[nH]ccc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1	1828926765	RFVYGYLUJVMJME-FQEVSTJZSA-N	438.532	1.869	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3CC(F)(F)C3)C2)C1	1830534153	XJADJJXVKKRJIM-WBMJQRKESA-N	439.297	1.519	50	20	IDGD	
O=C(/C=C/c1ccc(F)cc1F)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1830726257	PXXUAUIHQUFBCG-ZEYJBVPASA-N	444.862	1.034	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnn4c3OCCC4)C2)C1	1831653211	BWHVJEGBQIZXQG-OXJNMPFZSA-N	440.928	1.143	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccnc4c3OCO4)C2)C1	1831654110	IKOPRORINWFCPA-MGPUTAFESA-N	439.896	1.288	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(=O)n2O)CC1	1831829085	XYFMVTZJFHFFAI-HOTGVXAUSA-N	425.913	1.573	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnncc2C(=O)O)CC1	1831831369	WNNSLQOCCWTLQC-IRXDYDNUSA-N	438.912	1.662	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3ccc(C)s3)CCO2)C1	1832888012	FMUSIXWBUHDNTQ-PXNSSMCTSA-N	444.981	1.699	50	20	IDGD	
CN(C)C(=O)NCC(=O)NC1CCN(C2CCN(C(=O)C(C)(C)CCl)CC2)CC1	1833142529	VVKFKDQQSCZENK-UHFFFAOYSA-N	429.993	1.094	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cnc4ccccn34)CC2)CC1)[C@H](O)CCl	1833310229	MJWLCYKQLFTRKT-GOSISDBHSA-N	433.940	1.119	50	20	IDGD	
CN(C)c1ccc(C(=O)N2CCC(N3CCC(NC(=O)[C@H](O)CCl)CC3)CC2)cc1	1833313504	IAQLQFKDTUZFHL-HXUWFJFHSA-N	436.984	1.538	50	20	IDGD	
Cc1nn(C)cc1C(=O)NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1	1833583511	VGPYDGSLCCWTKB-INIZCTEOSA-N	444.349	1.604	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ncc(C)s3)CCO2)C1	1833805221	LBQZNVFVSCIICY-CXAGYDPISA-N	446.367	1.695	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccs3)CCO2)C1	1833940498	NYNAORVGCULSSS-DYVFJYSZSA-N	431.352	1.992	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3c(F)c(C)nn3C)CC2)CC1	1834030354	VCILYBYAPQECER-INIZCTEOSA-N	443.951	1.307	50	20	IDGD	
COc1ccnc(C(=O)N2CCC(N3CCC(NC(=O)[C@@H](F)Cl)CC3)CC2)c1OC	1835082197	VOAILWRCLJRQQJ-GOSISDBHSA-N	442.919	1.818	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](C)n3ccccc3=O)CC2)CC1	1835824673	AKBXECRZQSVQRI-APWZRJJASA-N	436.984	1.998	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC1CCN(C2CCN(C(=O)CSC(=N)N)CC2)CC1	1835833567	RYHYFDUSMCBCST-UHFFFAOYSA-N	429.663	1.036	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCC(N2CCC(NC(=O)c3cccnn3)CC2)CC1	1835895579	BYKJFENHVFYDHF-LJQANCHMSA-N	428.364	1.898	50	20	IDGD	
CC(C)N[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)Br)C2)C1)C(C)C	1835900933	LTQDSHSOFGMODT-GJYPPUQNSA-N	448.402	1.249	50	20	IDGD	
CC(C)NCCC(=O)N1CCC(N2CCC(NC(=O)[C@@H](F)Br)CC2)CC1	1836412755	SMJDRMNWDABDGD-QGZVFWFLSA-N	435.382	1.637	50	20	IDGD	
Cc1nccn1CC(=O)N1CCC(N2CCC(NC(=O)[C@H](F)Br)CC2)CC1	1836413981	SPCWNSXZYFVAJH-KRWDZBQOSA-N	444.349	1.454	50	20	IDGD	
O=C(c1cnccc1Cl)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836718688	ZUJCPTLFBWAAGS-QGZVFWFLSA-N	430.332	1.947	50	20	IDGD	
Cc1nccn1[C@H](C)C(=O)N1CCOC[C@@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1837718083	XIWYHGDKUKUMOL-OXQOHEQNSA-N	438.601	1.060	50	20	IDGD	
O=C(c1cc(-c2ccccc2)[nH]n1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1838688883	KRMCVMAFZPEJMC-XLIONFOSSA-N	436.871	1.681	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(F)c(F)c1)CCO2	1839009377	GTCRZTOKDYJRTF-FQEVSTJZSA-N	442.535	1.886	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CC=CCC1)CCO2	1839130188	NSQDBYFSFAXYFF-FRQCXROJSA-N	429.355	1.973	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)/C=C/c3cnc(C)s3)C2)C1	1839148499	ANXQDCYATBGKLM-BSCWQEJHSA-N	427.954	1.939	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CC(c3ccccc3)=NN1)CCO2	1839636068	HHCGYRKAGFNFIN-JLMWRMLUSA-N	448.951	1.226	50	20	IDGD	
COc1ccc(F)cc1CC(=O)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840190648	GLEWHPBBRVVEOU-IBGZPJMESA-N	449.306	1.637	50	20	IDGD	
O=C([C@@H](F)Cl)N1CC2(CCCN2C(=O)CN2C(=O)COc3ccc(Cl)cc32)C1	1841855661	SCGAGHVRKSOHEX-MRXNPFEDSA-N	430.263	1.803	50	20	IDGD	
O=C(c1cc(Cl)cc(Cl)n1)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843011789	SNWLPWRJYXKZRI-UHFFFAOYSA-N	434.088	1.199	50	20	IDGD	
COc1cc(Cl)ccc1CC(=O)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843012199	NDBPAIPDMYETEY-UHFFFAOYSA-N	442.708	1.088	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2c[nH]c3nccc-3c2)C1	1843275273	DMASAALGCMMQSJ-VULFUBBASA-N	433.472	1.466	50	20	IDGD	
Cn1cc(-n2cc(C(=O)N3CCCC34CN(C(=O)[C@@H](O)CCl)C4)c3ccccc32)cn1	1843461426	CVQRDHMYCGYKMM-IBGZPJMESA-N	441.919	1.781	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2nnsc2C2CC2)C1	1843541673	GJLCRODQXPAADP-WSDLNYQXSA-N	441.517	1.367	50	20	IDGD	
Cn1ncc(C(=O)N2CC3(CCCN3C(=O)[C@@H](F)Br)C2)c1C(F)(F)F	1845216248	FNIZSCLRXPSOLJ-SNVBAGLBSA-N	427.196	1.946	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)[C@@H](F)Br)C1	1845217495	CQJHNRAHNJQHII-HMASQMOLSA-N	428.262	1.014	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2ccc(O)cc2F)C1	1845362156	WEQLVIBUPXTVCK-ZMOGYAJESA-N	427.436	1.482	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)[C@@H](C)n2cncn2)C1	1846600368	VXJLCGYQRVADSM-CYBMUJFWSA-N	442.432	1.190	50	20	IDGD	
O=C(c1cccc([N+](=O)[O-])c1Br)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl	1847562033	PUUWTZOIJJXQKI-GMXVVIOVSA-N	446.685	1.772	50	20	IDGD	
CN1N=C(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)/C(C#N)=C/c2ccc(F)cc2F)CCC1=O	1848046315	FGMQWDIDIMCNBL-DTVHYBFXSA-N	441.438	1.682	50	20	IDGD	
COc1cccc(-c2nn(-c3ccc(C)cc3)cc2C(=O)NNC(=O)C(=O)NC2CC2)c1	9889425	IDVYNWRGOYEYIO-UHFFFAOYSA-N	433.468	1.896	50	20	IDGD	
COc1cc(OC)c(OC)cc1CNC(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	10411026	KLLSLJZYMJNBOJ-UHFFFAOYSA-N	441.444	1.748	50	20	IDGD	
C[C@H](NS(=O)(=O)c1ccc(Cl)cc1)C(=O)NNC(=O)c1cc(Br)c[nH]1	23914322	AVHAMYDXVSAUSX-QMMMGPOBSA-N	449.714	1.559	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)[C@@H]2CCCN(C(=O)c3ccc(F)cc3)C2)nc2ccccc21	26538645	FXLPOMPEELNPER-MRXNPFEDSA-N	437.475	1.955	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)N2CCOCC2)c1	27338082	VIVWIIVKRMBGTP-UHFFFAOYSA-N	434.474	1.183	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NCCOC)c(C(=O)NNC(=O)c2ccccn2)c1	27339716	HNKWKTSFALDSFI-UHFFFAOYSA-N	449.533	1.245	50	20	IDGD	
O=C(CC12CC3CC(CC(C3)C1)C2)NNS(=O)(=O)c1ccc2c(c1)NC(=O)CC(=O)N2	28686776	RQBVFSUFZIVNBX-UHFFFAOYSA-N	446.529	1.883	50	20	IDGD	
COCCCNC(=S)N(C)NC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(F)cc2)C1	726078222	GNVHOQDTAHHFJT-AWEZNQCLSA-N	446.570	1.100	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)N[C@H]2CCCN(C(=O)OC)C2)c2ccccc2c1=O	726717528	YZWMISRJJABZAX-AWEZNQCLSA-N	444.492	1.371	50	20	IDGD	
CCOc1c(Br)cc(C(=O)N([C@@H]2CCS(=O)(=O)C2)N(C)C)cc1OC	728179404	KMHPRAIOWSWVHT-GFCCVEGCSA-N	435.340	1.962	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN1c1ncnc2sccc12)[C@@H]1COc2ccccc2O1	728455433	PSWONTVRZIZBFR-CJNGLKHVSA-N	425.470	1.648	50	20	IDGD	
COc1cc(C=NNC(=O)C2CCN(c3ncccn3)CC2)cc(OC)c1OC(C)=O	728783546	VJOKTJARJRXORM-UHFFFAOYSA-N	427.461	1.786	50	20	IDGD	
C[C@H](C(=O)NNc1ccc(S(=O)(=O)C(F)F)cc1)N1C(=O)[C@H]2CCCC[C@H]2C1=O	728974728	ZQVKJDFDTVGMKG-HONMWMINSA-N	429.445	1.690	50	20	IDGD	
Cn1ncc2c(O)nc(CCC(=O)NNc3ccc(S(=O)(=O)C(F)F)cc3)nc21	728976034	XZWUSHHWNYCGKB-UHFFFAOYSA-N	426.405	1.141	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(CCCNC(=O)NNC(=O)c2cccc(C#N)c2)CC1	729047115	ACVMCFJEIYLPBQ-UHFFFAOYSA-N	430.509	1.445	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Cc2c(C)nc3c(c(O)nn3C)c2C)c2ccccc2c1=O	729281493	DKQOZWMIPUYYPU-UHFFFAOYSA-N	449.471	1.024	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)NCc1ccc(C(=O)N2CCOCC2)cc1	729495157	QURRQZBANXFZMV-UHFFFAOYSA-N	435.484	1.644	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2cccc3ncccc23)cc1	730118336	HUAALAMKIUTVSN-UHFFFAOYSA-N	427.486	1.629	50	20	IDGD	
CCCCOc1ccc(C(=O)NNS(=O)(=O)c2ccc(C(=O)OC)o2)cc1OC	730766109	WGOJMCZCZUDGIY-UHFFFAOYSA-N	426.447	1.877	50	20	IDGD	
CCOC(=O)/C(C#N)=C\Nc1cc(S(=O)(=O)N(CC)CC)ccc1N1CCOCC1	730941307	VACXVEIRVZOIEE-NXVVXOECSA-N	436.534	1.936	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)[C@@H]1CCCN(S(=O)(=O)Cc2ccccc2)C1	731328710	UIUIUMGLOLEGIM-GOSISDBHSA-N	433.505	1.758	50	20	IDGD	
Cc1c(C(=O)NNC(=O)Cn2cnc3ccccc32)nnn1-c1cccc2c1CCN(C)C2	731470083	MZMVZXMFQBPTQK-UHFFFAOYSA-N	444.499	1.375	50	20	IDGD	
C[C@@H]1CN(S(=O)(=O)c2cc(C(=O)NNC(=O)C3CCC3)ccc2Cl)C[C@@H](C)O1	732141413	KSLBKXKZFVIVSO-VXGBXAGGSA-N	429.926	1.699	50	20	IDGD	
O=C(CNC(=O)N1CCc2ccccc2C1)NNc1ccc(S(=O)(=O)C(F)F)cc1	732286563	GNVROOYTYFTAAO-UHFFFAOYSA-N	438.456	1.894	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)NCCCNC(=O)c2cccc(F)c2)cc1C	732468993	SXAIPKGNPGGYIZ-UHFFFAOYSA-N	429.452	1.532	50	20	IDGD	
Cn1cc(-c2ncc(C(=O)OCC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)s2)cn1	732687440	HTRRLTZOEUBVNI-UHFFFAOYSA-N	430.402	1.070	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)[C@@H]1CCCN1S(=O)(=O)c1cccc([N+](=O)[O-])c1	732937713	PJILCDMQTAPBIV-INIZCTEOSA-N	448.457	1.218	50	20	IDGD	
O=C(NCCN1CCN(C(=O)C2CCCCC2)CC1)NNc1ccc(-n2cccn2)nn1	733651162	DQMLOJQCZYABTJ-UHFFFAOYSA-N	441.540	1.013	50	20	IDGD	
CC(C)NC(=O)C(=O)NNC(=O)[C@H]1CCC(=O)N(C)[C@H]1c1ccc(C(F)(F)F)cc1	734418786	NKYLBDUOCIUCOU-ZFWWWQNUSA-N	428.411	1.287	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H](Cc2ccccc2)C2CC2)c1	737066302	JFHVIYVDGQMAGO-LJQANCHMSA-N	430.530	1.902	50	20	IDGD	
COc1ccccc1-c1nn(C)cc1C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C	740825529	MXPJXPDKEOJZJF-UHFFFAOYSA-N	432.481	1.564	50	20	IDGD	
Cc1ccc(Br)cc1S(=O)(=O)NNC(=O)c1cc([N+](=O)[O-])ccc1O	743268807	LOUIUNFFBISDJF-UHFFFAOYSA-N	430.236	1.995	50	20	IDGD	
CCOCCOc1ccc(S(=O)(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)cc1	743269171	ZDHYYEAYDUZXQT-UHFFFAOYSA-N	425.419	1.339	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)[C@H]3C[C@@]34CCc3ccccc34)cc2)CC1	743334675	MKSTYSXKEYMPMG-FYYLOGMGSA-N	440.569	1.970	50	20	IDGD	
Cc1cc2c(cc1C)O[C@@H](C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1)C2	743417856	DWILSJJAZXVZMX-GOSISDBHSA-N	445.545	1.081	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)ccc1O)c1ccc(=O)n(-c2ccccc2)n1	743733560	LWWJVVURDXFJKJ-UHFFFAOYSA-N	429.230	1.775	50	20	IDGD	
COc1ccc(CN2C[C@@H](C(=O)NNC(=O)Nc3ccc(N(C)C)cc3)CC2=O)cc1	743826799	PEOBWGZUMGLEPB-INIZCTEOSA-N	425.489	1.963	50	20	IDGD	
CS(=O)(=O)CC[C@@H](NC(=O)c1ccccc1Cl)C(=O)NNC(=O)NC1CCCC1	744059569	ULMVAZONBJLNDY-OAHLLOKOSA-N	444.941	1.146	50	20	IDGD	
C[C@@H]1CC[C@@H](C)N1CC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	746093061	JLZGBMQPPLUPAA-IAGOWNOFSA-N	444.557	1.799	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)CSc1ccc(Cl)cc1)N1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O	746093725	LOXOLCJWPPXCBS-LRZXTXFSSA-N	437.905	1.130	50	20	IDGD	
COc1cc2c(cc1CNC(=O)NNc1ccc(S(=O)(=O)NC(C)C)cn1)O[C@@H](C)C2	746345408	MNIRTBRNJUADMZ-ZDUSSCGKSA-N	449.533	1.927	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)c1cccc(NC(=O)CCn2ccnc2)c1	746545726	UDVZVONCTNZPLW-UHFFFAOYSA-N	431.456	1.563	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1[N+](=O)[O-]	746579559	IRYSHSFXNZOLEE-UHFFFAOYSA-N	434.474	1.547	50	20	IDGD	
COc1ccc(CN2CC[C@@H](NC(=O)NNC(=O)Cc3cn4ccccc4n3)C2=O)cc1	746765418	JNRASIZWUZEZGZ-GOSISDBHSA-N	436.472	1.017	50	20	IDGD	
C[C@H](CS(C)(=O)=O)C(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1	746840999	BVLOXGCCXGQTDC-OXQOHEQNSA-N	429.542	1.442	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)c2cccc(CN3CCS(=O)(=O)CC3)c2)c2ccccc21	747337839	URRWQUCTVUPHMN-UHFFFAOYSA-N	440.525	1.484	50	20	IDGD	
COc1ccc(C(=O)NNc2nccn(C)c2=O)cc1S(=O)(=O)N1C[C@@H](C)C[C@@H](C)C1	747945725	PGWXRIQCOWFBDP-OKILXGFUSA-N	449.533	1.212	50	20	IDGD	
CO[C@](C)(C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1)c1ccccc1	748620631	SHUWWXYCQLUQTE-NRFANRHFSA-N	432.546	1.628	50	20	IDGD	
CCCn1nc(C(=O)NNS(=O)(=O)c2cccc3c2OCCO3)c2ccccc2c1=O	751263431	ZUYQJDXLQIKOJY-UHFFFAOYSA-N	444.469	1.201	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1ccccc1-n1ccnn1	752297367	HOPYGOXXNDJEPX-UHFFFAOYSA-N	429.820	1.547	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2ccc(CNS(C)(=O)=O)o2)c(C)n1-c1ccccc1	753564097	RNGBBWUXYPIZAI-UHFFFAOYSA-N	430.486	1.811	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)N[C@H]1CCN(c2ncccc2F)C1	755300701	CPPZSUJJMOAQSN-ZDUSSCGKSA-N	425.424	1.335	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)c3cccc(I)c3O)nc21	755315935	BXPSWWPTEMLUCQ-UHFFFAOYSA-N	426.174	1.136	50	20	IDGD	
O=C(Cc1cc[nH]n1)NNC(=O)Nc1ccc(Cl)c(S(=O)(=O)N2CCCCC2)c1	755434564	MDBFCGOIEBWJNL-UHFFFAOYSA-N	440.913	1.633	50	20	IDGD	
COC(=O)CNC(=O)Cc1ccc(NC(=O)NNC(=O)CCc2ccccc2O)cc1	755861233	CKNYKOXJHSZKIX-UHFFFAOYSA-N	428.445	1.009	50	20	IDGD	
Cc1oc(C(=O)OCC(=O)C(C#N)=C2N(C)c3ccccc3N2C)cc1S(N)(=O)=O	756438362	PQYFZOWTQIIHAF-UHFFFAOYSA-N	430.442	1.283	50	20	IDGD	
CNC(=O)CCOc1ccc(NC(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)cc1	756457976	IMYFCOUMKNPJTC-UHFFFAOYSA-N	446.460	1.694	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)Nc2ccc(CNS(C)(=O)=O)cc2)c1C	756625830	NAUPPRRXZBMRMP-HNNXBMFYSA-N	434.518	1.973	50	20	IDGD	
Cc1nc(C(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)nn1-c1ccc(F)cc1	756744307	GIEBJXSOMFQFSR-UHFFFAOYSA-N	431.811	1.986	50	20	IDGD	
CC(C)Cn1cc(NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cn1	756802897	LGVHSPHVXVQZLP-UHFFFAOYSA-N	434.522	1.790	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)Nc2cc(C3CC3)nn2[C@@H]2CCS(=O)(=O)C2)c1	756855688	LUKFVNDYQHVMMT-MRXNPFEDSA-N	446.533	1.653	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)NCc2cc3c(cc2OC(F)F)OCO3)cc1	757253315	WZQVNNWITLUUST-UHFFFAOYSA-N	434.355	1.798	50	20	IDGD	
Cc1ccc(C)c(S(=O)(=O)Oc2ccc(C(=O)NNc3ccc(C(N)=O)nn3)cc2)c1	757407141	GHQVDTCGAWBASF-UHFFFAOYSA-N	441.469	1.717	50	20	IDGD	
CS(=O)(=O)CCn1cccc(NC(=O)NNC(=O)Cc2cccc3ccccc23)c1=O	757780387	HVMGIIVFSWOICO-UHFFFAOYSA-N	442.497	1.442	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2cccnc2OCC(F)F)c2ccccc2c1=O	757819445	UISOTEFKKDYAOG-UHFFFAOYSA-N	432.387	1.922	50	20	IDGD	
Cc1cc(C(=O)N2CCOCC2)ccc1NC(=O)NNC(=O)COc1ccccc1C#N	757829156	CQJDOHLPRQJICB-UHFFFAOYSA-N	437.456	1.571	50	20	IDGD	
O=C(NNC(=O)C(=O)Nc1ccccn1)N[C@@H]1CCCN(Cc2ccc(F)cc2Cl)C1	758756500	VVSZKHBZBMCSEQ-OAHLLOKOSA-N	448.886	1.808	50	20	IDGD	
Cc1cc(S(C)(=O)=O)cc(C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)c1C	760117728	JENDYUYGINPUIZ-UHFFFAOYSA-N	428.470	1.673	50	20	IDGD	
Cc1cc(C)nc(-n2nccc2NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)n1	760277655	OSEBZPBUAXXHJZ-UHFFFAOYSA-N	432.444	1.020	50	20	IDGD	
Cc1c(C(=O)NNC(=O)CCNC(=O)OC(C)(C)C)nnn1-c1ccc2c(c1)OCCO2	760437057	APHGYWHREIUPRD-UHFFFAOYSA-N	446.464	1.023	50	20	IDGD	
COc1cc2cc(C(=O)NNC(=O)CCNC(=O)OC(C)(C)C)[nH]c2c(OC)c1OC	760451724	WCRYKFOMZZSEBW-UHFFFAOYSA-N	436.465	1.870	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccccc2C(=O)NC(C)(C)C)cc1C	763666720	JVTFJBLVDVPZHH-UHFFFAOYSA-N	440.500	1.997	50	20	IDGD	
O=C1C[C@@H](c2cccc(NC(=O)C(=O)NNC(=O)COc3ccc(Cl)cc3)c2)CN1	763687097	ZCEAGYOKSAEOAS-CYBMUJFWSA-N	430.848	1.108	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccccc2S(=O)(=O)C(F)F)c1	763760276	KCULCYLGOFAWAX-UHFFFAOYSA-N	440.428	1.149	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)Nc2ccccc2S(=O)(=O)C(F)F)cc1	763834905	UIUSEHRGTRAGMN-UHFFFAOYSA-N	425.413	1.645	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccn(-c2ccccc2Cl)n1	763841125	NTRZGJUMBXVIPB-UHFFFAOYSA-N	431.811	1.830	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)C(=O)Nc1cccc(-n2ccnn2)c1	763854790	TZYQAASDTRMSOK-OAHLLOKOSA-N	444.451	1.974	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(Cl)c(C(N)=O)c2)cc1	763860513	IFWLTSVHSZVHCD-LLVKDONJSA-N	448.863	1.391	50	20	IDGD	
COc1cc(OC)c(OC)cc1NC(=O)C(=O)NNC(=O)c1cc(Br)c[nH]1	763995078	LSKOBTAPKQAPIJ-UHFFFAOYSA-N	441.238	1.203	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)C(=O)Nc1cccc(Sc2ccccc2)c1	764001730	DOOMGRDRHBWYMU-CYBMUJFWSA-N	433.511	1.358	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)Nc1cnn(-c2ccccc2F)c1	764001969	IBMOCOSNNNJYLQ-UHFFFAOYSA-N	449.240	1.512	50	20	IDGD	
Cc1ccc([C@]2(C)NC(=O)N(CC(=O)NNC(=O)CSc3ccccc3O)C2=O)cc1	764048590	BRLZWZXXVYXFRW-NRFANRHFSA-N	442.497	1.407	50	20	IDGD	
COc1cccc(-c2nsc(NC(=O)C(=O)NNC(=O)Cc3ccccc3OC)n2)c1	764135935	JUFYYUFYIGJVGO-UHFFFAOYSA-N	441.469	1.551	50	20	IDGD	
CN(C)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cccc3ncccc23)cc1Cl	764260236	MWSDRIZCIBDFFA-UHFFFAOYSA-N	439.859	1.990	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1ccc(NC(=O)c2ccccc2)nc1	764275672	PTYXUFCSXHJANG-UHFFFAOYSA-N	449.423	1.204	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cc(F)ccc2Br)cn1C	764278085	RQXQQRUNAYGMOF-UHFFFAOYSA-N	441.213	1.113	50	20	IDGD	
COC(=O)c1c(NC(=O)C(=O)NNC(=O)Cc2ccccc2F)sc2c1CCCC2	764313319	KXCKRCZXBYGIET-UHFFFAOYSA-N	433.461	1.881	50	20	IDGD	
CCOc1cc(NC(=O)C(=O)NNC(=O)Cc2ccccc2F)c([N+](=O)[O-])cc1OCC	764319249	NAYRYKPSLPJZHM-UHFFFAOYSA-N	448.407	1.860	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C(=O)Nc1ccc(OC)c(N2CCOC2=O)c1)c1ccccc1	764332224	PQYWXUOIJHYGJT-INIZCTEOSA-N	440.456	1.932	50	20	IDGD	
CN(C)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)cc1	764388975	VNJDYBQJJRGRAD-UHFFFAOYSA-N	438.419	1.317	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)N[C@@H]1CCN(c2c(F)cccc2F)C1=O	764444760	AUGASLPZUOMSGM-CYBMUJFWSA-N	436.440	1.898	50	20	IDGD	
CCOCCCNC(=S)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	764518798	IDDTVDMDLYLRSL-UHFFFAOYSA-N	428.002	1.380	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNc2nc(C)cc(C)n2)cc(Br)c1F	764664339	VNFSTZWLBNAXOS-UHFFFAOYSA-N	440.229	1.863	50	20	IDGD	
Cn1c(SCC(=O)NN=C2CCN(CCN3CCOCC3)CC2)nc2ccccc21	764732928	QETQCJHSHOLHRG-UHFFFAOYSA-N	430.578	1.566	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)Cc3ccc(S(N)(=O)=O)s3)n[nH]2)c1	765577713	WLXZPYZEEZWKQR-UHFFFAOYSA-N	433.515	1.406	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H]2CCO[C@@H](c3ccccc3)C2)c1	765915466	JHQBBQYRUPVDPL-PKOBYXMFSA-N	446.529	1.801	50	20	IDGD	
O=C(NNc1cnccn1)C(=O)Nc1ccc(CN2CCN(c3ccccn3)CC2)cc1	766260174	KTSYJJNKTXWKQU-UHFFFAOYSA-N	432.488	1.276	50	20	IDGD	
Cn1nc(C(C)(C)C)cc1C(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	766660593	OCKMLYFEDXMSSN-UHFFFAOYSA-N	446.983	1.950	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)c1nn(-c2ccc(F)cc2)nc1C	767352245	CXJAOPUQRYLCPR-UHFFFAOYSA-N	425.420	1.570	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCCC(=O)NNc2ccc(OC)cc2[N+](=O)[O-])cc1	768327528	BEWGUNXLFOFZDS-UHFFFAOYSA-N	438.462	1.814	50	20	IDGD	
CCNC(=O)N(C)NC(=O)/C(C#N)=C\c1cn(CCC(N)=O)nc1-c1ccc(OC)cc1	768413547	SPZLGNAWBJFBNB-PTNGSMBKSA-N	439.476	1.034	50	20	IDGD	
CCNS(=O)(=O)c1ccc(C(=O)NNc2c(OC)cccc2S(C)(=O)=O)cc1	768613450	UPAFPNCJGUDPIM-UHFFFAOYSA-N	427.504	1.154	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)NCCC3CCS(=O)(=O)CC3)nc21	768984109	ZIXOLXZIIBANTG-UHFFFAOYSA-N	425.515	1.128	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1ccc(O)c(C(=O)NNC(=O)c2c[nH]nc2C)c1	769781957	DSKCTZMMAYZNDF-UHFFFAOYSA-N	445.457	1.308	50	20	IDGD	
NS(=O)(=O)c1cccc(NC(=O)COC(=O)[C@@]23CC[C@@H](C[C@H]2Br)C3)c1	769983741	WZLOJYSURKBAIV-OWRWGESLSA-N	431.308	1.769	50	20	IDGD	
Cc1cc(Br)c(F)cc1NC(=O)C(=O)NNC(=O)COc1ccc(C#N)cc1	770773355	HHOBHSMVOWXHPN-UHFFFAOYSA-N	449.236	1.933	50	20	IDGD	
C[C@@H]1CCCN(S(=O)(=O)c2ccc(C(=O)NNc3nc(O)c4cnn(C)c4n3)cc2)C1	770971455	JNLUHIIFNMKYLH-GFCCVEGCSA-N	445.505	1.246	50	20	IDGD	
Cc1c(F)cc(C(=O)O)cc1S(=O)(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	771606884	YTLKVCSZLVIOMY-UHFFFAOYSA-N	443.840	1.112	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCCNC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)s1	771990538	OVTSCZJUVNLOPZ-UHFFFAOYSA-N	448.530	1.165	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1cnn(-c2ccc(Cl)nn2)c1C(F)(F)F	772030835	HGQFFYMAEFFJME-ZETCQYMHSA-N	434.762	1.437	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)c1ccc([C@]2(C)NC(=O)NC2=O)cc1	772962485	BWOWWJHWFXFLOR-GIPWTMENSA-N	430.848	1.623	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2cccc(CS(=O)(=O)c3ccccc3)c2)n1	773725910	BIFCBOSHUYKFRX-UHFFFAOYSA-N	441.469	1.541	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)NC[C@@H]2CC[C@H](C(=O)N(C)C)O2)c(C)n1C[C@@H]1CCCO1	775213555	VKLNAOOHMQIJRZ-OSULDFMKSA-N	428.533	1.943	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(N2CCOCC2)c(NC(=O)NNc2ccc(C#N)cc2)c1	775692203	GWJASJYWAPLEAL-UHFFFAOYSA-N	444.517	1.794	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)Nc1nnc(-c2c(F)cccc2Cl)s1	775904310	XUEOBUCJLMOGOD-ZETCQYMHSA-N	433.874	1.585	50	20	IDGD	
CCNS(=O)(=O)c1ccccc1S(=O)(=O)NNC(=O)c1ccc(Cl)cc1F	777634914	AADXJTKQQXZNDF-UHFFFAOYSA-N	435.886	1.401	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)Nc1ccnn1Cc1ccc(C(F)(F)F)cc1	779465818	KDTVVZXAODBHSV-GFCCVEGCSA-N	445.423	1.538	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2cnn([C@H](C)C3CC3)c2)cc1	779504376	JTPNKCSRRGBPKY-CQSZACIVSA-N	434.522	1.636	50	20	IDGD	
O=C(CN1CCC[C@H](S(=O)(=O)N2CCc3ccccc32)C1)NNC(=O)c1cccs1	779625017	SQUKTSRYYBZXSA-INIZCTEOSA-N	448.570	1.366	50	20	IDGD	
Cc1c(NNC(=O)[C@@H]2C[C@@H](O)CN2S(=O)(=O)c2ccc(F)cc2)cccc1[N+](=O)[O-]	780951188	RTAWIWUYNPMXTA-DYVFJYSZSA-N	438.437	1.310	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)C2(NS(=O)(=O)c3c(C)noc3C)CCCC2)c1	781034684	NNAKTFIHOYBSBZ-UHFFFAOYSA-N	436.490	1.812	50	20	IDGD	
COc1ccc(C(=O)c2ccccc2C(=O)NNC(=O)CNC(=O)c2cccnc2)cc1	781428210	BEQAJYLYDHVBBV-UHFFFAOYSA-N	432.436	1.512	50	20	IDGD	
COC(=O)c1scc(C)c1NC(=O)C(=O)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	782124612	QOKFMZROGLKVKQ-UHFFFAOYSA-N	445.432	1.772	50	20	IDGD	
COc1ncc(NC(=O)C(=O)NNc2ccc(Br)cc2F)cc1C(N)=O	783085133	BREQOOXOQURRGH-UHFFFAOYSA-N	426.202	1.173	50	20	IDGD	
COc1cc(Br)c(NC(=O)C(=O)NNc2cncc(Cl)n2)cc1OC	783258627	MBXIVGJALDNKNF-UHFFFAOYSA-N	430.646	1.992	50	20	IDGD	
CCNC(=O)COc1cccc(NC(=O)C(=O)NNc2ccc(Cl)cc2[N+](=O)[O-])c1	783291279	KXFAMVDGDRERNN-UHFFFAOYSA-N	435.824	1.845	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2cnc3c(c2)CN(C(=O)OC(C)(C)C)CC3)nc(C)n1	783326449	GSIFWORDTXDFSA-UHFFFAOYSA-N	441.492	1.863	50	20	IDGD	
Cc1ccc(NNC(=O)C(=O)Nc2cccc(S(=O)(=O)/N=C3\CCCN3C)c2)cc1	783342893	CQQMQGHRVYURIB-HKOYGPOVSA-N	429.502	1.890	50	20	IDGD	
CCOC(=O)[C@@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNc2ccc(C)cc2)cc1F	783348459	JFVZYEWUBRYSGT-CYBMUJFWSA-N	430.436	1.897	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NN=Cc2cn(Cc3cccnc3)nn2)c1	783777670	TWPASLBQVLNUTC-UHFFFAOYSA-N	441.517	1.516	50	20	IDGD	
C[C@@H]1CCC[C@@H](OCc2cccc(NC(=O)C(=O)NNC(=O)C(=O)N3CCCC3)c2)C1	784003258	SJPXKHICYCKCCX-CRAIPNDOSA-N	430.505	1.490	50	20	IDGD	
C[C@@H]1CN(S(=O)(=O)c2ccc(NC(=O)C(=O)NNc3ccccc3)cc2)C[C@@H](C)O1	784765011	KZVWFQRJSIRQAL-HUUCEWRRSA-N	432.502	1.566	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2nc(-c3ccc(Cl)cc3)no2)cc1	784799782	MMDCYDSWHCMADB-UHFFFAOYSA-N	435.849	1.875	50	20	IDGD	
O=C(NNC(=O)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-])N[C@H]1CCS(=O)(=O)C1	784892310	DDASUJJHWRREFI-AWEZNQCLSA-N	448.457	1.305	50	20	IDGD	
O=C(NNc1c(F)cc(F)cc1Br)C(=O)Nc1ccc(-n2cnnn2)cc1	785007101	GHWYDSWGYQCILX-UHFFFAOYSA-N	438.192	1.785	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)Nc1ccc(Br)cc1F	785024164	SWXHTCAIYKNOID-UHFFFAOYSA-N	441.169	1.602	50	20	IDGD	
CC(=O)Nc1cccc(NC(=O)C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)c1	785100798	ZTNNKGKNEUJYQN-UHFFFAOYSA-N	431.399	1.897	50	20	IDGD	
COc1ccc2nc(NNC(=O)C(=O)Nc3cc(C)nn3-c3ncccn3)c(C)cc2c1	785164876	ZPIDSOIUPPDNBK-UHFFFAOYSA-N	432.444	1.918	50	20	IDGD	
COc1ccc(OC)c([C@@H]2C[C@H]2C(=O)N2CCN(S(=O)(=O)CBr)CC2)c1	788526056	PLVGARFMWSGWDB-DZGCQCFKSA-N	447.351	1.634	50	20	IDGD	
COCCOc1cc(OC)ccc1C(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	788582804	JKJWQNZBPGBIFV-UHFFFAOYSA-N	426.429	1.687	50	20	IDGD	
C[C@H](C(=O)NNC(=O)c1ccc(CSc2nncn2C)cc1)N(C)CC(F)(F)F	792787097	LOQIEIIEFPRARQ-LLVKDONJSA-N	430.456	1.751	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(Cl)n2)cc1Br	793025509	LYDZDVKWBHNIIM-UHFFFAOYSA-N	427.642	1.906	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1	794060705	NXVQSWULCIZMSD-UHFFFAOYSA-N	438.400	1.468	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cc3nccnc3cc2F)cc1OC	795866653	GUBIDNKAJSQSJI-UHFFFAOYSA-N	428.376	1.404	50	20	IDGD	
O=C(COC(=O)[C@H]1CCCN1C(=O)OCc1ccccc1)NNC(=O)c1ccccc1	797504735	VXUXXAUTFNJDNL-GOSISDBHSA-N	425.441	1.792	50	20	IDGD	
Cc1nc2cc(F)c(F)cc2n1CC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	798126697	BMCBRZIUWZJIDZ-UHFFFAOYSA-N	437.428	1.879	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)c2cccc(S(=O)(=O)NCc3ccco3)c2)nc1	798336279	IUNLPDHNVCGSKD-UHFFFAOYSA-N	430.442	1.697	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)C(=O)Nc2ccc(OC(F)(F)F)c(C#N)c2)c1	799833895	FZYMDHKXZCEIHU-UHFFFAOYSA-N	442.375	1.942	50	20	IDGD	
CC(C)(COCc1ccccc1)C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	800290759	RAORDLKZXBTSBJ-LJQANCHMSA-N	442.468	1.760	50	20	IDGD	
CC[C@](O)(C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)c1cccc(Cl)c1	800379788	WNEIVKLJYRJAPT-LJQANCHMSA-N	439.921	1.649	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@H]2CCCC[C@H]2C(=O)N2CCCC2)cc1	802063861	RIQSZXDLNHGPNE-DLBZAZTESA-N	436.534	1.672	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)Cc2csc(-c3nc[nH]n3)n2)cc1Cl	802072300	LLHHXKHKXBTGLR-UHFFFAOYSA-N	437.869	1.994	50	20	IDGD	
C[C@H](C#N)S(=O)(=O)c1ccc(NC(=O)NNC(=O)c2nnc(O)c3ccccc23)cc1	806456669	SQYWTPODRLYABO-LLVKDONJSA-N	440.441	1.488	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)Nc1nc(Cc2ccccc2)cs1	807017053	CHRUTHQZAFHKCF-UHFFFAOYSA-N	441.425	1.747	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cc3ccccc3nc2C)cc1	807312333	KOLWZPYBXLFEIH-UHFFFAOYSA-N	426.498	1.933	50	20	IDGD	
C[C@H]1CN(c2ccccc2NC(=O)C(=O)NNc2ccc(-n3ccnc3)nn2)C[C@@H](C)O1	807429030	OFZBMWZMWDQXDB-GASCZTMLSA-N	436.476	1.358	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NN=Cc3ccc(F)c(S(N)(=O)=O)c3)CC2)cc1	807975980	IXGYMLIEIGLWLT-UHFFFAOYSA-N	447.536	1.049	50	20	IDGD	
O=C(CNS(=O)(=O)c1c(F)cccc1F)NNC(=O)Cc1ccc2ccccc2c1	810152602	WPGOEBATOBDOMR-UHFFFAOYSA-N	433.436	1.786	50	20	IDGD	
COC(=O)c1c(F)ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)c1C	810386012	IWWZYVTZHYCHDS-NSHDSACASA-N	435.383	1.613	50	20	IDGD	
N#Cc1ncn(-c2ccccc2NC(=O)C(=O)NNc2ccccc2Br)n1	810392084	UJSXCDHLCHJXJX-UHFFFAOYSA-N	426.234	1.983	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)CNS(=O)(=O)c2c(C)c(C)cc(C)c2C)n1	810560550	DUBBXXPPZMRTJD-UHFFFAOYSA-N	434.566	1.978	50	20	IDGD	
CC[C@@H](C)Sc1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2CCc3nncn3C2)c(C)c1	815692590	VNHAXCLKMOPHOT-ZIAGYGMSSA-N	430.534	1.826	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1cc(C(F)(F)F)ccn1	815750519	CRIPOWOKHHICKG-UHFFFAOYSA-N	431.396	1.433	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(N2C[C@H](C(=O)NCC(Cl)Cl)CC2=O)cc1	816605456	ZLDYLPBCJNJDIX-GFCCVEGCSA-N	436.361	1.990	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@H](CC(C)C)N2C(=O)[C@@H]3CC=CC[C@H]3C2=O)cc1OC	859322956	NFQFVVXGLMHCER-ZACQAIPSSA-N	443.500	1.831	50	20	IDGD	
Cc1ccc([C@]2(C)NC(=O)N(CC(=O)NNC(=O)COc3cc(C)cc(C)c3)C2=O)cc1	863997219	VTBKHICLAVTHII-QHCPKHFHSA-N	438.484	1.605	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NN=Cc2c(N3CCOCC3)nc3ccccn3c2=O)c1	864237392	VQPFSMOXWTZACL-UHFFFAOYSA-N	435.484	1.677	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1ccc(Cl)c([N+](=O)[O-])c1	912848194	RIFGUHNEFSZJLM-UHFFFAOYSA-N	425.854	1.925	50	20	IDGD	
Cc1ccc(C)c(N2N=C(C(=O)NNC(=O)CCN3C[C@H](C)O[C@@H](C)C3)CCC2=O)c1	912919882	SGOYBLALYREDDQ-IRXDYDNUSA-N	429.521	1.433	50	20	IDGD	
COc1ccc(-c2nn(CCC#N)cc2/C=C(\C#N)C(=O)NNC(=O)C2CC2)cc1OC	914457007	KNWBHVPGCOPEIB-MHWRWJLKSA-N	434.456	1.945	50	20	IDGD	
O=C(NNC(=O)c1ccc(Br)s1)c1ccc(S(=O)(=O)N2CCCC2)o1	914752474	YCNIJUPZSFKCEA-UHFFFAOYSA-N	448.320	1.963	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(F)c(C(=O)NNC(=S)NCCc2cccs2)c1	914882171	XKUJFLHMRIEAFV-UHFFFAOYSA-N	444.579	1.926	50	20	IDGD	
O=C(COC(=O)c1cn(-c2ccccc2C(F)(F)F)nn1)NNC(=O)c1cccs1	914914768	ZQMGMXRWDDCNPL-UHFFFAOYSA-N	439.375	1.966	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)NCc2ccc(S(N)(=O)=O)s2)cc1OC	915906032	DBGCVLABHAEBGL-UHFFFAOYSA-N	442.519	1.337	50	20	IDGD	
CCOc1cc(C=NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)ccc1O	916258654	HSCMDBPIQCPERR-UHFFFAOYSA-N	433.486	1.576	50	20	IDGD	
CC[C@H](CNC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)N1CCc2ccccc2C1	916445539	SFIJFBDVMBCVLT-LJQANCHMSA-N	444.557	1.871	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)SCC(=O)Nc2ccc(F)cc2)cc1	916830733	SFCGVGLGSUVGMA-CYBMUJFWSA-N	432.477	1.980	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)CN(C)C(=O)c1ccc(Br)o1	917388379	ZPSRVKFHAKNUNI-UHFFFAOYSA-N	438.278	1.903	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NCc1cccc(OCC(=O)N(C)C)c1	918223438	HGWINJMTQSSSQF-CQSZACIVSA-N	432.452	1.591	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2oc(Br)cc2C)cc1OC	919379870	PQGIEZKQLHFESF-UHFFFAOYSA-N	441.234	1.986	50	20	IDGD	
O=C(NCc1cccc(C(=O)NC[C@H]2CCCO2)c1)NNC(=O)c1ccc([N+](=O)[O-])cc1	920346776	CCXYDWSROBFIEC-GOSISDBHSA-N	441.444	1.648	50	20	IDGD	
CC(C)NC(=O)C(=O)NNC(=O)c1ccccc1NC(=O)c1cccc(Br)c1	920431851	SPFKWQJPRZQYHB-UHFFFAOYSA-N	447.289	1.987	50	20	IDGD	
COc1cc(OC)cc(C(=O)N2CCC(C(=O)NNC(=O)NCc3ccco3)CC2)c1	920855895	DIXNDRGGNJACSS-UHFFFAOYSA-N	430.461	1.680	50	20	IDGD	
CCCCn1c(C)cc(/C=C(/C#N)C(=O)NCCN2CCN(S(C)(=O)=O)CC2)c1C	921165057	DVIBRTSFJQGOQM-HKWRFOASSA-N	435.594	1.505	50	20	IDGD	
COC(=O)c1ccc(S(=O)(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)s1	1318903303	LDXGKSXUQRHNKV-UHFFFAOYSA-N	447.535	1.491	50	20	IDGD	
Cn1cc([C@H](NC(=O)NNC(=O)c2csc(N3CCOCC3)n2)c2ccccc2)cn1	1325221329	YKXJQOBZNJQDGQ-QGZVFWFLSA-N	441.517	1.447	50	20	IDGD	
NC(=O)[C@H]1CCCN(c2ccc(C(=O)NNC(=S)NCCc3cccs3)cc2)C1	1347323077	MXFMVDXKENKOKX-HNNXBMFYSA-N	431.587	1.801	50	20	IDGD	
Cc1nc2ncccn2c1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2	1777901244	AMHQVCHFFBCRCZ-RBUKOAKNSA-N	440.331	1.718	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@]2(CN(C(=O)COc3cc(Cl)ccn3)CCO2)C1	1779299358	YPQBXXDCYQGQOX-LJQANCHMSA-N	441.988	1.795	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)CC(C)(C)C(=O)OC(C)(C)C)C2)C1	1780889416	DNNIRMSTNFJZKF-VFNWGFHPSA-N	446.972	1.828	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@]2(C1)CN(C(=O)c1nc[nH]n1)CCO2	1782864848	XAZUBOHXRDSILV-FZXOMJPYSA-N	428.399	1.134	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](C)S)C2)C1	1783899851	WUCYCXJNTZEQPD-BLVKFPJESA-N	437.474	1.282	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cccc(C#N)c1Cl)CCO2	1783934907	KUQJOHFQUYIPBR-NRFANRHFSA-N	447.923	1.028	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3C[C@H]4CC[C@@H]3O4)C[C@@H]21	1783973485	BPTPMKHLPXQMBU-HIXZSHCBSA-N	429.355	1.565	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(-c4cccnc4)cc3)C[C@@H]21)[C@@H](O)CCl	1784092041	DOUPWQPLVLRFQV-TUFLPTIASA-N	443.931	1.942	50	20	IDGD	
Cc1cccc(C(=O)N2CC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c1Cl	1785034465	SFYQPAHZRCIQQA-NRFANRHFSA-N	436.940	1.465	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnn(-c4cccnc4)c3)[C@H]2C1	1785731386	MZAJCESQJJJPNL-QZHFEQFPSA-N	447.923	1.114	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3cc(F)cc(F)c3)[C@H]2C1	1787079334	BPPOPSYEUJBCME-RUGDWHBFSA-N	430.879	1.741	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC1(c2ccc(NC(=O)c3nc[nH]c3[N+](=O)[O-])cc2)CCC1	1788613053	BLHMNEUOGHXCIW-UHFFFAOYSA-N	443.464	1.439	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4n(n3)CCCO4)C[C@@H]21	1791055757	HQOWGAATTNWYLD-OSFYFWSMSA-N	441.326	1.042	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1ccc(C2(NC(=O)C(=O)c3ccco3)CCC2)cc1	1791599364	DUKYDSJIGCIVSE-UHFFFAOYSA-N	426.473	1.969	50	20	IDGD	
COc1ccc([C@H](C)C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)cc1	1792933612	BROWSIXFLVBOJS-KQLYMOGASA-N	436.317	1.431	50	20	IDGD	
COc1ccc([C@H](C)C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)cc1	1792934488	WYKQNYBXTRAEDH-KQLYMOGASA-N	436.317	1.431	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1CCCCN1C	1793132985	MYAWQTOVNASERX-HPQGMATESA-N	428.537	1.243	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](C)NS(=O)(=O)CC	1793536246	QLJXZMKAUDHRTA-PDWCTOEPSA-N	438.388	1.126	50	20	IDGD	
CC(C)(C)OC(=O)NCCCCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](O)CCl)C2	1793867877	JFVAXTTZRCXNEO-FZKCQIBNSA-N	431.961	1.919	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1csc(C)n1	1795283257	VMECEBWELFSOFD-LSOZKBPJSA-N	428.518	1.837	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)Nc1cccnc1	1795603011	UPMJIAPPRSBKQQ-SVZOTFJBSA-N	439.354	1.503	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)[C@H]1CCc2ccccc2C1	1796192084	HDXRLKCUABADQU-IITNATTFSA-N	432.329	1.423	50	20	IDGD	
CCOC(=O)N(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Cl)Cc1ccco1	1796369338	WOEROHRTUYKMGP-DLTLXFJOSA-N	445.875	1.362	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(N2CCCC2)ccn1	1796582654	BNLISOYYOYPVPM-UPHUGPLXSA-N	446.624	1.737	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc2c1OCCO2	1796963531	BPVVEIIXAIGVOB-JFILPPLUSA-N	439.306	1.444	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(C(F)(F)F)c[nH]1	1797015126	FQAYPKQGBHQZOX-BTTYYORXSA-N	429.443	1.658	50	20	IDGD	
COc1nc(C)ccc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2	1798249796	VFHKDVVHJOHVCK-XCCSTKFXSA-N	430.274	1.292	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cc1cc(F)cc(F)c1)C2	1798440172	FYSWZHIERXMTRX-BJWYYQGGSA-N	443.454	1.458	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)no1	1798890419	SCNRAMGVJZKVQR-CLLJXQQHSA-N	444.400	1.779	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H]1CCC(=O)N1)C2	1799217678	BMAHHZYBFHGBNJ-LOUJCGABSA-N	444.444	1.051	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H]1CCCO1)C2	1799221478	NNKWWHMMTUZHRZ-YGTYGHESSA-N	431.445	1.951	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCCc1cccnc1)C2)[C@@H](F)Br	1799352354	RVBZQMHJLHGGNT-YALNPMBYSA-N	428.302	1.684	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2)c1cccc(N2CCOCC2)c1	1799610983	OXAHTYVRBOYTEX-MVJTYMMSSA-N	425.888	1.261	50	20	IDGD	
CCc1[nH]nc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](Br)CC)c1F	1800639350	QEJPYRFJPDVUEJ-MIJXAVMKSA-N	431.306	1.488	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H]2C[C@]21C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2	1800772877	QIRBMFFDFAUQKP-RNCJLBHCSA-N	445.919	1.510	50	20	IDGD	
COc1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](O)CCl)C3)cc([N+](=O)[O-])c1OC	1800820319	RHASGLNHVDRBTC-XFMPKHEZSA-N	441.868	1.464	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(C(=O)OC)cc1C	1801912011	RNCQVMAUGAOSKF-CYGHRXIMSA-N	438.908	1.239	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cc1cccc([N+](=O)[O-])c1)C2	1802329788	PIJIERAPSSJVTF-BJWYYQGGSA-N	431.493	1.149	50	20	IDGD	
O=C(CN1CCCC1)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@H]1c1cccnc1	1802555649	LJKLNWCDGAYVEB-BHYGNILZSA-N	427.318	1.874	50	20	IDGD	
CN(C)C(=O)NCC(=O)NC[C@H]1CCN(C(=O)CO[Si](C)(C)C)[C@H]1c1cccnc1	1802679255	HHNYQZRVAZPYGO-APWZRJJASA-N	435.601	1.210	50	20	IDGD	
Cn1nncc1C(=O)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@@H]1c1cccnc1	1804750654	XTPURDCUJJRTTR-YUTCNCBUSA-N	425.262	1.220	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1ccsc1	1805418966	AOHTZUSXEMGMBA-PXNSSMCTSA-N	435.314	1.456	50	20	IDGD	
O=C(c1cnc(C(F)(F)F)cn1)N1CCC2(CCCN(C(=O)[C@@H](O)CCl)C2)CC1	1805523658	SADGNBJLDYDVOD-ZDUSSCGKSA-N	434.846	1.940	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H](CNC(=O)CSC(=N)N)[C@@H]1c1cccnc1	1806996858	DUCHSRKZUXJPPP-KYOSRNDESA-N	442.383	1.745	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CC(F)(F)F)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807365604	VWALQLLFNUBTMR-YJBOKZPZSA-N	435.211	1.033	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1807367056	PTYUMZMFKSJZMQ-NEWSRXKRSA-N	429.713	1.098	50	20	IDGD	
Cc1nnc(CC(=O)NC[C@H]2CCN(C(=O)CCBr)[C@H]2c2cccnc2)o1	1807467386	MLPOQZDEQQMIEU-KDOFPFPSSA-N	436.310	1.807	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)c2ccon2)[C@H]1c1cccnc1	1808414898	PDNIPJDUVXEZPD-RBIZEYAUSA-N	449.471	1.523	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)c2ccc[nH]2)[C@H]1c1cccnc1	1810624924	YWJNKOWPGAWFPO-DNVCBOLYSA-N	433.472	1.042	50	20	IDGD	
O=C1Cc2cccc(C(=O)NC[C@@H]3CCN(C(=O)[C@@H](O)CCl)[C@H]3c3cccnc3)c2N1	1812207976	LZUYKQMSYPITBG-KNBMTAEXSA-N	442.903	1.496	50	20	IDGD	
CC(C)CNC(=O)C(=O)N1CC[C@H](CNC(=O)[C@@H](C)Br)[C@H]1c1cccnc1	1812864865	SMYQMHWWOHBOFQ-FVQBIDKESA-N	439.354	1.643	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)Cc2ccccc2)[C@@H]1c1cccnc1	1813070508	IIMGIXVRIYFOMC-HYBUGGRVSA-N	437.544	1.703	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CNC(=O)c2cccnc2)n[nH]1	1815785891	CUIWVRYTGYARRZ-GDBMZVCRSA-N	448.911	1.481	50	20	IDGD	
C[C@H](C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](F)Cl)sc2C1)[C@@H]1SC(=N)NC1=O	1817121896	UIKGWKZXJFFTEO-FTEGDLIOSA-N	433.918	1.392	50	20	IDGD	
CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](F)Cl)n[nH]1	1818044189	VEUDZJKSFXICCU-IIAWOOMASA-N	439.879	1.407	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](C)Br)[nH]n1	1819355686	WCSDFHNJNUSIBV-NQBHXWOUSA-N	443.346	1.893	50	20	IDGD	
C[Si](C)(C)OCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCN1CCOC1=O)CC2	1820165877	VELOCPQLHIPZHD-LBPRGKRZSA-N	440.598	1.749	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2)c1ccc(O)cc1	1822229925	OFGMKTWEHTTXES-OAHLLOKOSA-N	437.286	1.068	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CSCC(=O)OC)[nH]n1	1822371404	RQAVFXBHJVEQQK-YPMHNXCESA-N	432.930	1.562	50	20	IDGD	
C=C[C@H](O)C(C)(C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1	1822416148	RWGMIYSUMSFTOU-HOTGVXAUSA-N	434.541	1.348	50	20	IDGD	
C=C[C@H](O)C(C)(C)C(=O)N[C@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1	1826087507	FXYAGJITTNTOSH-WFASDCNBSA-N	437.566	1.001	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)Cc3cnn(C)c3)sc2C1	1826948853	JDSSAUVXHJOLQF-GXSJLCMTSA-N	426.340	1.815	50	20	IDGD	
O=C(C#Cc1ccccc1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827051035	LJUUGDGCVBUJKX-DEOSSOPVSA-N	444.340	1.651	50	20	IDGD	
O=C(c1cncc(O)c1)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827053152	FPOPRPAPLCHNGV-OAQYLSRUSA-N	437.305	1.014	50	20	IDGD	
O=C(CCBr)N1CCC([C@H]2CCCCN2C(=O)c2cnc(O)nc2O)CC1	1827589044	ODSSGRCHCCUOSL-CQSZACIVSA-N	441.326	1.906	50	20	IDGD	
O=C1Nc2c(cccc2C(=O)N2CCCC[C@@H]2C2CCN(C(=O)[C@@H](O)CCl)CC2)C1=O	1828716224	CNGFRQIUCCIAFL-SJORKVTESA-N	447.919	1.654	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)C34CC(F)(C3)C4)C2)C1	1830535605	QSJAKNVKQDOFMR-HELAGCTPSA-N	433.318	1.366	50	20	IDGD	
Cc1ncoc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)CBr)CCO2	1830537607	LFKSLKIMHSOMRO-SJKOYZFVSA-N	430.299	1.084	50	20	IDGD	
C[C@@H]1CC[C@H](C(=O)N2CCOC[C@]3(CN(C(=O)[C@@H](C)CBr)CCO3)C2)O1	1830540957	XCGNNIHJTDCXRM-BORJPKMPSA-N	433.343	1.041	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccn4nccc4c3)C2)C1	1831650255	GJZRYCQFCAFQFL-NQIIRXRSSA-N	434.924	1.812	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3Cc4ccccc4O3)C2)C1	1831651819	SWGSOWBRBPLEQU-JLMWRMLUSA-N	436.936	1.854	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)c2cc(F)c[nH]2)CC1	1831706187	BLDPCVPLZSWUKI-FQEVSTJZSA-N	427.285	1.381	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1CCCCC1(F)F)CCO2	1831726426	KRDGPXKNZVPRQM-MPGHIAIKSA-N	438.899	1.522	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)/C=C/c3ccoc3)CCO2)C1	1832643948	XGJMKECMTAAJIC-HMSPERNYSA-N	441.322	1.780	50	20	IDGD	
CCCNC(=O)CCC(=O)NC1CCN(C2CCN(C(=O)[C@H](Cl)COC)CC2)CC1	1833426068	NPFPCRQATTXTBN-GOSISDBHSA-N	445.004	1.118	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)C3CCCCC3)CC2)CC1)c1cccc(B(O)O)c1	1834801157	RTWPHIHAEBRBTJ-UHFFFAOYSA-N	441.381	1.132	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccccc3F)CCO2)C1	1835008005	KONKYFDYNZYQNX-IFXJQAMLSA-N	443.313	1.608	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)C(=O)NCC(C)C)CC2)CC1	1835126744	GFSIKJWYQUOMJL-GOSISDBHSA-N	429.005	1.738	50	20	IDGD	
COCCC(=O)N1CCO[C@@]2(COCCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1	1835233753	BOMBLRQHTDCZAT-BPNKPRMTSA-N	449.454	1.365	50	20	IDGD	
O=C(c1ncc(F)cc1F)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836713768	KQOQQUICIUUVLE-MRXNPFEDSA-N	431.867	1.572	50	20	IDGD	
CC(=O)O[C@H](C(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1)C(C)C	1836717180	MAOGWATYZCUVAK-MSOLQXFVSA-N	432.945	1.172	50	20	IDGD	
O=C([C@@H]1Cc2ccccc2O1)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836717408	WIXOMQXGZCPKRC-ICSRJNTNSA-N	436.936	1.588	50	20	IDGD	
O=C1CC[C@@H](C(=O)N2CCC(OC3CCN(C(=O)CCBr)CC3)CC2)N1	1837651693	FLLFAIUAQLSTIF-HNNXBMFYSA-N	430.343	1.049	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)N1CCC(OC2CCN(C(=O)CCBr)CC2)CC1	1837653777	YDUHFGBJMDOCCC-HNNXBMFYSA-N	447.374	1.217	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3nccnc3C)CCO2)C1	1838216092	BBLPHIKCEPAKOO-RDTXWAMCSA-N	441.326	1.029	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@@H]3CCCS3(=O)=O)CC2)CC1	1838637394	NUIMBCMRAQRFDT-IRXDYDNUSA-N	434.986	1.580	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)cc1N(C)C	1839115998	QMVBMHKAXLBKEM-PXNSSMCTSA-N	443.903	1.366	50	20	IDGD	
O=C(CCC(F)(F)F)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839199477	ORNLVZWUYXSFLW-AAEUAGOBSA-N	435.212	1.476	50	20	IDGD	
C=C(C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)Br)C2)C1)C(F)(F)F	1839894576	GKMOVCAIFLGGFS-FZMZJTMJSA-N	429.233	1.345	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(O)nc3)C2)C1	1839965578	DQVSIMCUSZGETH-KDOFPFPSSA-N	442.310	1.031	50	20	IDGD	
CSc1ccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)cc1	1840302732	IHLVYHZAQXPWQW-MJGOQNOKSA-N	430.929	1.942	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@H]2C[C@@H]3C[C@@H]3N2C(=O)OC(C)(C)C)C1	1841360746	ICNZZSSOYAKESA-VGWMRTNUSA-N	441.956	1.842	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)N1CC2(CCCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C1	1841924724	VERXIBOEBIRDFQ-KGLIPLIRSA-N	442.944	1.013	50	20	IDGD	
CCc1c(Br)c(C(=O)N2CCCC23CN(C(=O)[C@@H](Cl)COC)C3)nn1C	1843144489	UMPDJDFPKSADNP-NSHDSACASA-N	447.761	1.816	50	20	IDGD	
CC(=O)N[C@H](C(=O)N1CCCC12CN(C(=O)[C@H](C)Br)C2)c1ccc(F)cc1	1845006920	SBPBTHDUMFNFEJ-LRDDRELGSA-N	440.313	1.990	50	20	IDGD	
COC(=O)CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)[C@@H](F)Cl)C2	1845146318	NEAQXCAWNWPWCN-TZMCWYRMSA-N	449.907	1.571	50	20	IDGD	
O=C(c1cnc2c(c1)CCNCC2)N1CC2(CCCN2C(=O)[C@H](F)Br)C1	1845219885	OZDNKKPKSUITAL-HNNXBMFYSA-N	425.302	1.277	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)Cc1cc[nH]n1	1848098595	KUKAUVFWZMTXRL-KKUMJFAQSA-N	425.917	1.286	50	20	IDGD	
O=C(COC(=O)c1cc([N+](=O)[O-])ccc1Cl)NNC(=O)[C@H]1COc2ccccc2O1	10665212	IICSNVXJNSQRAU-OAHLLOKOSA-N	435.776	1.392	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2ccc(Cl)c(S(=O)(=O)N(C)C)c2)cc1OC	15793183	OGSWUILIPXJHHO-UHFFFAOYSA-N	441.893	1.682	50	20	IDGD	
CCOc1ccc(N2C[C@H](C(=O)NNC(=O)Cc3nc4ccccc4n3C)CC2=O)cc1	15926542	JNTZZPJIKPIYMS-OAHLLOKOSA-N	435.484	1.715	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(C)c(NC(=S)NNC(=O)Cc2cc(C)n[nH]2)c1	17514278	MIJRSFADFWHUOU-UHFFFAOYSA-N	438.579	1.617	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)c1ccccc1)C(=O)NNc1nc(-c2ccncc2)no1	110327630	CTOCYHPKAUTFKX-OAHLLOKOSA-N	448.530	1.675	50	20	IDGD	
Cc1nc2ccccc2c(=O)n1-c1ccc(C(=O)N([C@@H]2CCS(=O)(=O)C2)N(C)C)cc1	728177992	QVDNHKFYOYZMPU-GOSISDBHSA-N	440.525	1.800	50	20	IDGD	
NS(=O)(=O)c1ccc(CC(=O)NNC(=O)c2ccc(F)cc2Br)cc1	728313651	IWKRVIREJYYJNZ-UHFFFAOYSA-N	430.255	1.239	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CC(=O)N(c2ccccc2Cl)C1)C1CCN(c2ncccn2)CC1	728845044	FFPDHXJIRGWFCO-OAHLLOKOSA-N	442.907	1.547	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1ccc(OC[C@H]2CCCO2)cc1	728848288	KPHLFXBWOALFRH-LJQANCHMSA-N	425.489	1.712	50	20	IDGD	
C[C@@H](NC(=O)c1n[nH]c2ccccc12)C(=O)NNc1ccc(S(=O)(=O)C(F)F)cc1	728971960	NONVPAXFMNQWMD-SNVBAGLBSA-N	437.428	1.821	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NC[C@H]1CN2CCC[C@@H]2CO1	729494865	HYGORQCHTFDODB-BJJXKVORSA-N	441.326	1.410	50	20	IDGD	
O=C(Cc1cc[nH]n1)NNC(=O)c1cc(Br)ccc1I	730091028	ZBRGCXSGBMQEII-UHFFFAOYSA-N	449.046	1.781	50	20	IDGD	
CCCS(=O)(=O)c1ccccc1S[C@H](C)C(=O)N([C@H]1CCS(=O)(=O)C1)N(C)C	730452057	VNXBFBVMDPLBOP-CABCVRRESA-N	448.632	1.843	50	20	IDGD	
CC(=NNC(=O)CSc1nnc(O)nc1O)c1ccc(O)c(CN2CCCCC2)c1	730558816	RWKDQBNDJZOYKU-UHFFFAOYSA-N	432.506	1.607	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)c2cnc(C)[nH]2)c1	732259107	LMPVTNLFLLKUFD-UHFFFAOYSA-N	429.458	1.602	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)NCCC(=O)NNc2ccccc2S(C)(=O)=O)cc1	732302180	CTESHEFNPXQJRQ-UHFFFAOYSA-N	439.515	1.104	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)NCCC(=O)NN=c2cc[nH]c3ccccc23)cc1	733364349	HMNMIYUSEZUBAA-UHFFFAOYSA-N	427.486	1.427	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)c2cc(S(N)(=O)=O)ccc2F)c1	733370776	NZWDOLUDQQNSSU-UHFFFAOYSA-N	446.254	1.319	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)c2cc(-c3c(C)nn(C)c3C)[nH]n2)cc1C	736787407	QVCBEOPHDHWEGF-UHFFFAOYSA-N	444.517	1.977	50	20	IDGD	
CC(=NNC(=O)COc1ccc(F)cc1)c1cccc(S(=O)(=O)N2CCOCC2)c1	739400737	RAMPFDCDUDZCHI-UHFFFAOYSA-N	435.477	1.766	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)/C(=C\c1ccco1)n1nnnc1-c1ccccc1	740852380	YARIBHCKOPSKRS-GHRIWEEISA-N	437.460	1.383	50	20	IDGD	
CC(C)CC(=O)Nc1ccc(Cl)c(C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)c1	741671574	IUUNZKKBHMABOC-LBPRGKRZSA-N	430.914	1.456	50	20	IDGD	
CC(C)c1nn([C@@H]2CCS(=O)(=O)C2)cc1C(=O)NNC(=O)c1ccc2c(c1)OCCO2	742502522	JZAYDPSQAVTVPI-CQSZACIVSA-N	448.501	1.212	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)c1nc(-c2cccc(F)c2)no1	743705428	TYSMESPCOBBUGS-LLVKDONJSA-N	447.448	1.984	50	20	IDGD	
Cc1ccc(CCC(=O)NCC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)cc1	743829364	NIHSLOLGJQEZNT-UHFFFAOYSA-N	432.502	1.300	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Cc2csc(-c3cccnc3)n2)c1	743838439	WNNRDZOLHVUGDF-UHFFFAOYSA-N	445.526	1.459	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(Br)c([N+](=O)[O-])c2)cc1	744455301	IJYPAOBLGSXPEY-UHFFFAOYSA-N	447.201	1.847	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)COc2ccc(N3CCCC3=O)cc2)c1	744520841	PFEJPAJPCPXLFS-UHFFFAOYSA-N	436.424	1.068	50	20	IDGD	
Cc1nn(C)c2nc(C3CC3)cc(C(=O)OCC(=O)NNC(=O)c3cccc(C#N)c3)c12	744544028	JTHZEDPYGKJAHK-UHFFFAOYSA-N	432.440	1.644	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C1(NS(=O)(=O)c2c(C)noc2C)CCCC1	746240670	SNPSODYWOSZAAX-UHFFFAOYSA-N	436.490	1.352	50	20	IDGD	
COc1ccccc1C(=O)N[C@@H](CCSC)C(=O)NNC(=O)c1ccc(C#N)cc1	747176026	ZUXZBNITUOBCGX-KRWDZBQOSA-N	426.498	1.880	50	20	IDGD	
Cc1c(Br)cccc1S(=O)(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	747609742	YHPXWPAXWRVVAB-UHFFFAOYSA-N	447.332	1.784	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2cccc3c2CCCC3)c1	748639228	DRLNQSRDEBDZEQ-UHFFFAOYSA-N	437.543	1.439	50	20	IDGD	
NS(=O)(=O)c1ccc(NCCC(=O)NNc2cc(F)c(F)cc2F)c([N+](=O)[O-])c1	748797141	OGAPVOYCDFNAIR-UHFFFAOYSA-N	433.368	1.605	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)N(C)C[C@H](O)CN2CCOCC2)c(C)n1C[C@H]1CCCO1	751430415	KPJJRNPDOAUJBC-JQDNONOBSA-N	430.549	1.342	50	20	IDGD	
COc1cc(OC)cc(N2C[C@@H](C(=O)NNC(=O)c3cnn(-c4ccccc4)c3)CC2=O)c1	752312781	SYNGGGUJHVHAQV-HNNXBMFYSA-N	449.467	1.704	50	20	IDGD	
COc1ccc(-c2nn(-c3ccccc3)cc2CC(=O)NNC(=O)C(=O)NC2CC2)cc1	752728895	HVJZVJWMCFELJK-UHFFFAOYSA-N	433.468	1.516	50	20	IDGD	
CCOC(=O)c1ccc(N2CC(NC(=O)NNc3cccc(S(C)(=O)=O)c3)C2)nc1	753284408	RBGBPYRZAVABEM-UHFFFAOYSA-N	433.490	1.177	50	20	IDGD	
CCN(CC)S(=O)(=O)CC(=O)NNc1ccc(S(=O)(=O)Nc2ccccc2)cc1	753434869	NBLNZGDCEPLPJP-UHFFFAOYSA-N	440.547	1.602	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)c1cccc(I)c1O	754834288	VOILIBOBQKQIJI-UHFFFAOYSA-N	442.209	1.845	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)CNC(=O)c2ccccc2C(F)(F)F)C[C@@H](C)O1	755681922	HFDOLFBTQMCRGC-CHWSQXEVSA-N	430.427	1.082	50	20	IDGD	
COc1ccc(-c2nn(CCC#N)cc2/C=C(\C#N)C(=O)N[C@H]2CNC(=O)C2)cc1OC	755931518	FFPBGQAARHUVOC-YBYKNVHQSA-N	434.456	1.393	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)Nc2ccc(S(=O)(=O)N(C)C3CC3)cc2)c1	756401520	IRGPVDNODICTJE-UHFFFAOYSA-N	448.501	1.953	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN(CCN2CCOCC2)c2ccccc2)cc1OC	756553936	PEMCEIHJTBFICU-UHFFFAOYSA-N	442.516	1.304	50	20	IDGD	
CN(C1CCCCC1)S(=O)(=O)c1ccccc1NC(=O)NNC(=O)c1cnn(C)c1	756562662	IATOPLDFVIIAPB-UHFFFAOYSA-N	434.522	1.840	50	20	IDGD	
COC(=O)[C@H]1c2ccccc2CCN1CC(=O)NNC(=O)c1ccc(OC)c(OC)c1	756608825	VUPOGBNYVJGKOV-HXUWFJFHSA-N	427.457	1.237	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)Nc2ccc(C)c(S(N)(=O)=O)c2)n[nH]1	756639563	ZUYMYNUEKMNHIK-UHFFFAOYSA-N	444.473	1.508	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)cc1OC	756765365	HQVNFBKJTNVWLZ-UHFFFAOYSA-N	442.384	1.711	50	20	IDGD	
CCCNS(=O)(=O)c1ccc(NC(=O)NNC(=O)COc2ccccc2C#N)cc1	756775839	LMXQVDDZCXYJNQ-UHFFFAOYSA-N	431.474	1.478	50	20	IDGD	
COc1cc(C=NNC(=O)C(=O)Nc2ccccn2)cc(I)c1O	758381977	UQYGMAWADFKPBU-UHFFFAOYSA-N	440.197	1.489	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)NCCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)c1	758692771	XWBOITNWDOJGCW-UHFFFAOYSA-N	435.462	1.079	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)[nH]n1)C(=O)Nc1ccnn1Cc1ccc(F)cc1	760278913	INGVLYRIAJELSZ-UHFFFAOYSA-N	447.430	1.860	50	20	IDGD	
NS(=O)(=O)c1ccc(C(=O)NNC(=O)Nc2ccc(Br)cc2Cl)cn1	762746535	XEVPOUJJWBYSAJ-UHFFFAOYSA-N	448.686	1.611	50	20	IDGD	
COCCOc1cn(-c2ccccc2)nc1C(=O)NNc1nccc(N2CCOCC2)n1	762855317	MNEBVVBLIXXZJW-UHFFFAOYSA-N	439.476	1.281	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C3=NN(c4ccccc4)C(=O)[C@@H](C)N3)n[nH]2)cc1	763166579	UYWHBRKFUPLSQC-CQSZACIVSA-N	445.483	1.739	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccc3ccn(C)c3c2)cc(OC)c1OC	763540037	PQRCXRCKNJIYRZ-UHFFFAOYSA-N	426.429	1.604	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)Nc1cccc(Cl)c1-n1cccn1	763570581	GJJHWPHYQREGRG-MRXNPFEDSA-N	441.831	1.452	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)n([C@@H]2C[C@H]3CC[C@H]2C3)n1	763573862	VKOJRRKTDVXART-OIPACUDHSA-N	439.472	1.479	50	20	IDGD	
COC(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)COc2cc(C)ccc2C(C)C)c1	763595663	AWYKSPXJXDEWFZ-UHFFFAOYSA-N	441.484	1.999	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(Oc2cccnc2)nc1	763662830	KPFQLGCFJCEMRO-UHFFFAOYSA-N	437.412	1.442	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(N3CCOC3=O)c2)cc1C	763667064	OYFHLHLDFCCLRT-UHFFFAOYSA-N	426.429	1.425	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2cc(F)ccc2Cl)c1	763717796	ABMSUXOCXIPJEZ-UHFFFAOYSA-N	442.856	1.129	50	20	IDGD	
O=C(CN1CCCc2ccccc21)NNC(=O)C(=O)Nc1cnn(-c2ccccc2F)c1	763728243	KRTBXSKTYRFDSZ-UHFFFAOYSA-N	436.447	1.550	50	20	IDGD	
CCn1nccc1NC(=O)C(=O)NNC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1	763804975	PTSXFNCNVLPVKL-UHFFFAOYSA-N	444.455	1.550	50	20	IDGD	
C[C@H](Sc1ccc(Br)cc1)C(=O)NNC(=O)CNC(=O)c1cccnc1	763819401	AIKDMNWKPIZSHY-NSHDSACASA-N	437.319	1.902	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)S(=O)(=O)CC3)c1C	763855200	VDDYHNGZGSPKIN-AWEZNQCLSA-N	445.497	1.187	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)n1	763892193	ATLQZSHGWTUGEJ-GJZGRUSLSA-N	446.483	1.039	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(Br)nc2)cc1OC	763902926	ZHCPFIKPWDSOCW-UHFFFAOYSA-N	437.250	1.651	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)C(=O)Nc1ccc(OCC(F)F)cc1	763996740	ZRRWCGUKOGNICM-UHFFFAOYSA-N	431.193	1.821	50	20	IDGD	
CCN1CCN(c2ccc(NC(=O)C(=O)NNC(=O)c3ccccc3OC)cc2)CC1	764040444	IRVGTKNCTLYIEG-UHFFFAOYSA-N	425.489	1.237	50	20	IDGD	
O=C(NNC(=O)c1ccc2ccccc2c1)C(=O)Nc1cccc(C(=O)N2CCOCC2)c1	764064744	OZZQMTAJLQSLCM-UHFFFAOYSA-N	446.463	1.712	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)C(C)(C)c2ccccc2)cc1S(=O)(=O)N(C)C	764314656	XSUIAOPYNQKMIX-UHFFFAOYSA-N	446.529	1.309	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)c1nccnc1-c1nc2ccccc2s1	764343685	QHSFPAZPRVSKSY-UHFFFAOYSA-N	433.453	1.339	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)C(=O)Nc1cccc(CN2CCOC2=O)c1	764401145	LXLVYROGLYYRCP-UHFFFAOYSA-N	444.469	1.223	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)NCc1ccc(CN2CCC(O)CC2)cc1	764403663	NSICBVZTLSEWHQ-UHFFFAOYSA-N	444.557	1.972	50	20	IDGD	
COCCc1ccc(Oc2ccc(NC(=O)C(=O)NNC(=O)[C@@H]3COCCO3)cc2)cc1	764435863	YCUUMBMZXROJST-IBGZPJMESA-N	443.456	1.169	50	20	IDGD	
Cc1ccccc1-n1nc(C)c2cc(C(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)sc21	764615931	NZQQTWITCIDZNO-CYBMUJFWSA-N	432.527	1.900	50	20	IDGD	
C[C@H](NS(=O)(=O)c1ccc(C#N)cc1)C(=O)NNC(=O)c1cc(-c2ccccc2)on1	764634302	DNVLHJRUJYZPMV-ZDUSSCGKSA-N	439.453	1.341	50	20	IDGD	
CC[C@H](O[C@@H]1CCC[C@@H](C)C1)C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765735325	JWKDCHRHALSUHS-NRSPTQNISA-N	444.576	1.966	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)[C@H]1C[C@]12CCCc1ccccc12	765738805	OMKOZKXVNSFSIX-GJZUVCINSA-N	446.551	1.886	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)C12C[C@H]3C[C@@H](CC(F)(C3)C1)C2	766639942	BCJCTSUPKDCEAR-RDNZODCXSA-N	442.535	1.900	50	20	IDGD	
CCN=c1nc(NCC)n2c(SCC(=O)NNc3ncnc4ccsc34)n[nH]c2n1	766678554	LAOZDPQSERBJAI-UHFFFAOYSA-N	445.538	1.045	50	20	IDGD	
C=CCn1c(SCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)nnc1-c1ccccn1	768417574	HIPMMKKZDPFXMM-UHFFFAOYSA-N	439.457	1.988	50	20	IDGD	
C=CCn1c(SCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)nnc1-c1ccccn1	768419125	UNHMCZSDYQXCPT-UHFFFAOYSA-N	439.457	1.988	50	20	IDGD	
CCOc1ccc(N2C[C@H](C(=O)NNc3c(OC)cccc3S(C)(=O)=O)CC2=O)cc1	768629220	OYOHCMSYASBMDP-CQSZACIVSA-N	447.513	1.994	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)[C@H]1CC(=O)N(c2ccc(F)cc2F)C1	768641209	OAVJXGNYFDJCRA-NSHDSACASA-N	439.440	1.873	50	20	IDGD	
CC1(C)C(=O)Nc2ccc(C(=O)OCC(=O)NNC(=O)[C@@H]3COc4ccccc4O3)cc21	768693884	CPRCAINNYGREKH-KRWDZBQOSA-N	439.424	1.061	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cccc([C@]3(C)NC(=O)NC3=O)c2)ccc1OC(C)C	768930257	OVCXOTYZJZDOPN-QFIPXVFZSA-N	440.456	1.612	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2ccc3nnc(C(C)(C)C)n3c2)c2ccccc2c1=O	769538046	OZWVWFWVVCUQGM-UHFFFAOYSA-N	433.472	1.831	50	20	IDGD	
COc1ccc(S(=O)(=O)NC2CC2)cc1NC(=O)C(=O)NNc1c(C)cccc1F	770824105	PDPAVJLKCUPSJK-UHFFFAOYSA-N	436.465	1.665	50	20	IDGD	
O=C(NNC(=O)N1CCO[C@H](CN2C(=O)c3ccccc3C2=O)C1)c1cc2ccccc2o1	771219992	POXBQWMWZCBJFQ-HNNXBMFYSA-N	448.435	1.784	50	20	IDGD	
COc1ccccc1[C@]1(C)NC(=O)N(CC(=O)NNc2oc(C(C)C)nc2C#N)C1=O	771383757	ZHOMICPZXFHFPO-FQEVSTJZSA-N	426.433	1.589	50	20	IDGD	
COc1ccc(N2C[C@H](C(=O)NNC(=O)C(=O)NCc3ccc(Cl)cc3)CC2=O)cc1	772194699	CANMTOGPDYWLER-CQSZACIVSA-N	444.875	1.165	50	20	IDGD	
Cc1cnccc1OC1CCN(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)CC1	772341784	VGQSCZMLKIAJMQ-UHFFFAOYSA-N	446.533	1.581	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@@H]2CC(=O)N(C3CCCCC3)C2)c2ccccc2c1=O	772553016	ZTVNBRXEXRDRID-CQSZACIVSA-N	440.504	1.294	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)cc1-n1cnnn1	774003471	WHWZNUCQBIRHJF-GFCCVEGCSA-N	443.851	1.178	50	20	IDGD	
O=C(NNc1cnc2ccccc2n1)Nc1ccc(F)c(S(=O)(=O)N2CCOCC2)c1	775531559	GENBTVSWWCDHNP-UHFFFAOYSA-N	446.464	1.938	50	20	IDGD	
O=C(CCN1C(=O)CNC1=O)Nc1ccc(NC(=O)NNc2c(F)cccc2F)cc1	775759564	GEWHCSWJBXGGOT-UHFFFAOYSA-N	432.387	1.994	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)N[C@@H]2CCN(c3ccc(Cl)cc3)C2)c2ccccc2c1=O	776633704	UWVARRYRDOMATF-CQSZACIVSA-N	440.891	1.810	50	20	IDGD	
CCOC(=O)N1CCC[C@@H]([C@@H](C)NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)C1	776874559	LNDNBRBUWZQUMG-NVXWUHKLSA-N	447.540	1.280	50	20	IDGD	
Cc1cc(F)c2nc(O)cc(C(=O)OCC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)c2c1	778874023	OHUOPGLBENYOHJ-UHFFFAOYSA-N	442.359	1.914	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@H](C(=O)NNC(=O)c2cc3ccccc3o2)[C@H](C)O)cc1	779529872	QFGHSYGEWIVFNT-UGSOOPFHSA-N	431.470	1.230	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3ccc(-c4ncn(C)n4)cc3)CC2)cc1	779937858	WEPNMZGXYOYBID-UHFFFAOYSA-N	447.543	1.369	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)[C@@H]2CC(=O)N(c3cc(OC)c(OC)c(OC)c3)C2)c1	780792357	VBGQBSFWMLEJTQ-CQSZACIVSA-N	443.456	1.995	50	20	IDGD	
CCOc1cc(/C=C/C(=O)N2CCN(S(=O)(=O)CBr)CC2)ccc1O	781017879	LHAHSJDJIAMZAT-GQCTYLIASA-N	433.324	1.631	50	20	IDGD	
COc1ccc(C[C@@H](C)C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1OC	781157269	CKFGMYZKDYHAJP-OAHLLOKOSA-N	427.505	1.736	50	20	IDGD	
COC(=O)c1cc(C(=O)NNC(=O)[C@H]2Cc3ccccc3CN2Cc2ccccc2)on1	781421510	GUYQTWAGOOJQGV-LJQANCHMSA-N	434.452	1.849	50	20	IDGD	
Cc1ccc(SCC(F)(F)F)c(NC(=O)C(=O)NN[C@]2(C)CCS(=O)(=O)C2)c1	783425359	HTBFFNKVZLMAKF-OAHLLOKOSA-N	439.481	1.786	50	20	IDGD	
Cc1cc(F)ccc1NNC(=O)C(=O)Nc1cnn(CC(=O)N2C[C@H](C)O[C@H](C)C2)c1	783446641	UPVPFLPVOMCBQT-OKILXGFUSA-N	432.456	1.048	50	20	IDGD	
CNS(=O)(=O)c1cccc(NC(=O)C(=O)NNc2ccc(Br)cn2)c1C	784341981	VNSLPZFOZSVCIV-UHFFFAOYSA-N	442.295	1.142	50	20	IDGD	
COCCOc1cc(NC(=O)C(=O)NNc2ccnc(Br)c2)ccc1OC	784837444	SJOZNMOURGHAGR-UHFFFAOYSA-N	439.266	1.960	50	20	IDGD	
COCCOc1c(Cl)cccc1NC(=O)C(=O)NNc1cccc(S(C)(=O)=O)c1	784838933	AIIKHYUBGCCOOG-UHFFFAOYSA-N	441.893	1.851	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)C(=O)Nc2ccc(NC(=O)[C@@H]3CCCO3)cc2)c1	784850862	CUQKWCSNAOJOQW-KRWDZBQOSA-N	426.429	1.673	50	20	IDGD	
COC(=O)c1cc(N2CCOCC2)ccc1NC(=O)C(=O)NNc1cc(Cl)ccn1	784861301	VPCOVNPXLLVQQU-UHFFFAOYSA-N	433.852	1.440	50	20	IDGD	
COC(=O)c1cc(OC)c(OC)cc1NC(=O)C(=O)NNc1cc(F)c(F)cc1F	784886673	RPHPVXNLLJYICB-UHFFFAOYSA-N	427.335	1.990	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1ccccc1O[C@H]1CCOC1	785330086	DKLMZNKKGMQZTJ-ZDUSSCGKSA-N	449.485	1.348	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C(F)(F)F)cc1OC	785803797	NCTCHXPOPSTSPW-BHTHQVBYSA-N	446.378	1.364	50	20	IDGD	
O=C(NNC(=O)c1csc(Cl)c1)c1cccc(S(=O)(=O)N2CCOCC2)c1	786610915	ZEURATPBJHEUDB-UHFFFAOYSA-N	429.907	1.497	50	20	IDGD	
COC(=O)c1sc(S(=O)(=O)NNC(=O)c2ccc3c(c2)OCCO3)c(C)c1Cl	788480884	NFNCYDPAJSCINC-UHFFFAOYSA-N	446.890	1.891	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)NCc2nc(-c3cccc(Br)c3)no2)n1	790894301	CZGKPDKXCGWCPX-UHFFFAOYSA-N	448.281	1.843	50	20	IDGD	
C[C@@H]1CC(=O)C[C@@H](C(=O)NNC(=O)OC(C)(C)C)[C@H]1C(=O)NNC(=O)OC(C)(C)C	791123802	KFWDIJCLQMYZHE-RTXFEEFZSA-N	428.486	1.330	50	20	IDGD	
O=C(NNc1nc2ccccn2n1)C(=O)Nc1ccc(-c2noc(C(F)(F)F)n2)cc1	792393088	CEQGKBBCKUGTDG-UHFFFAOYSA-N	432.322	1.880	50	20	IDGD	
CC[C@@H](C)CC[C@H](O)CC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	793710417	LVQVFTFGMABFNQ-AEFFLSMTSA-N	426.583	1.643	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(C(=O)NNC(=O)CNC(=O)OCc2ccccc2)cc1	794069897	MGQOLLOVJYHFBU-UHFFFAOYSA-N	448.501	1.061	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)[C@H]1CCS(=O)(=O)c2ccccc21	795995034	UWCNGPSWQPALMC-KRWDZBQOSA-N	435.527	1.532	50	20	IDGD	
O=C(NNc1ccc2ccccc2n1)C(=O)Nc1cc(S(=O)(=O)N2CCCC2)ccn1	797016587	LIVYZVZMPQWEKQ-UHFFFAOYSA-N	440.485	1.496	50	20	IDGD	
COC(=O)[C@@H](C)S(=O)(=O)NC(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccccc1	797282553	HLBXRNSMYKNKNU-VQCBNXJZSA-N	441.469	1.378	50	20	IDGD	
COc1ccc(/C=C(/C#N)C(=O)O[C@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)cc1	798303592	PEYIKIFENZCQCY-LKKYZFDUSA-N	429.454	1.820	50	20	IDGD	
CCOC(=O)[C@]1(COC)CCCN(CC(=O)NNC(=O)c2cc(C)c(CC)s2)C1	799198256	FASXBXMBQCBONA-HXUWFJFHSA-N	425.551	1.672	50	20	IDGD	
Cc1cc(O[C@@H]2CCN(C)C2=O)ccc1NC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	799239515	ZAWWNLPYNSHDKB-QGZVFWFLSA-N	427.417	1.979	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(O[C@@H]3CCN(C)C3=O)cc2C)c(O)c1	799258413	BZCOEMMPZHIAKS-GOSISDBHSA-N	440.456	1.018	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N1CC[C@H](S(C)(=O)=O)C1	799859386	HBBTUNHQEDAFOK-GWCFXTLKSA-N	434.312	1.076	50	20	IDGD	
CN(C(=O)OC(C)(C)C)[C@H](C(=O)NNC(=O)CSc1ccccc1O)c1cnn(C)c1	802942008	MLUKNCXXHXYYQK-KRWDZBQOSA-N	449.533	1.973	50	20	IDGD	
CN(CC(=O)NNc1ccc2c(=O)[nH]ccc2c1)S(=O)(=O)c1cccc([N+](=O)[O-])c1	803439054	QIHXKKBNEMQABU-UHFFFAOYSA-N	431.430	1.200	50	20	IDGD	
Cc1cccc(N2CCN(S(=O)(=O)CC(=O)NNc3ccc([N+](=O)[O-])cc3C)CC2)c1	805376265	QNZIHGZRBSKBRZ-UHFFFAOYSA-N	447.517	1.807	50	20	IDGD	
C[C@@H](C#N)S(=O)(=O)c1ccc(NC(=O)NNC(=O)c2cc(Br)c[nH]2)cc1	806457721	ARIGYLSDWHLMBC-VIFPVBQESA-N	440.279	1.929	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(NC(=O)NNC(=O)c2cc(Br)c[nH]2)ccc1F	806543979	PCHZDDMZKRSXHH-UHFFFAOYSA-N	448.274	1.633	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)N[C@@H](CS(=O)(=O)N(C)C)C(F)(F)F)c2ccccc2n1	806564687	GAWUNEKGZWKBEV-AWEZNQCLSA-N	447.439	1.310	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cc(Cl)cc3c2OCC(=O)N3)cc1C	806973578	RVECMHVDHHUJQQ-UHFFFAOYSA-N	446.847	1.453	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1nc(Cc2ccccc2)cs1	806976515	FMEMFMYGMJINIT-UHFFFAOYSA-N	438.465	1.905	50	20	IDGD	
Cc1c(C(F)(F)F)nn(C)c1NC(=O)C(=O)NNC(=O)C(F)(F)Oc1ccccc1	806979404	SZWYORCHUGPEJW-UHFFFAOYSA-N	435.309	1.505	50	20	IDGD	
C[C@H](Oc1ccccc1NC(=O)C(=O)NNC(=O)CNC(=O)c1ccco1)C(F)(F)F	807004662	RAOOPDWSWCGUIC-JTQLQIEISA-N	442.350	1.125	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(NC(=O)C(=O)NNc2cccc(F)c2[N+](=O)[O-])ccc1F	807068537	LHFYQULJCJXDJF-UHFFFAOYSA-N	443.388	1.205	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)COc1cccc(I)c1	807369353	WRFSGPUOEVPQSO-UHFFFAOYSA-N	436.246	1.607	50	20	IDGD	
COCc1c(Br)cccc1NC(=O)C(=O)NNc1ccc(-n2ccnc2)nn1	807428647	HFQVYNODLURHJI-UHFFFAOYSA-N	446.265	1.653	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(=NNC(=O)C(=O)Nc2ccccn2)[C@@H]([C@@H]2CCOC2)C1	812226318	KVBPIBFYZBDEMM-HUUCEWRRSA-N	431.493	1.786	50	20	IDGD	
CCc1ccccc1OCC(=O)NNS(=O)(=O)c1ccc2c(c1)C[C@H](C)N2C(C)=O	812541015	MUSKMEIRIMEHJJ-AWEZNQCLSA-N	431.514	1.935	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N(C)Cc2nncn2C)cc1	813695585	DFYRKEIHTJXNCH-MHWRWJLKSA-N	448.487	1.128	50	20	IDGD	
O=C(CNC(=O)NNC(=O)c1ccc(Br)s1)NCCN1CCCCCC1	814270636	BHMDSASOQLUWRN-UHFFFAOYSA-N	446.371	1.447	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1ccccc1N1CCCC1	815751464	AFERNCUVFCMZNY-UHFFFAOYSA-N	431.518	1.619	50	20	IDGD	
CCOc1ccc(NNC(=O)C(=O)Nc2cc(C(=O)OC)cc(S(C)(=O)=O)c2)cc1	815815700	NODKAFVRRYZLGB-UHFFFAOYSA-N	435.458	1.357	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NNC(=O)[C@H]2CN(Cc3ccccc3)CCO2)C1	816510030	KQOATOOZBXXBMW-RTBURBONSA-N	446.548	1.682	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)CNS(=O)(=O)c2cccs2)c1	818756893	LYKHDRKHHWVEOY-UHFFFAOYSA-N	448.320	1.719	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)c1ccc(S(=O)(=O)NC(C)(C)C)cc1	825649211	IFAZAMHSBNHRKF-UHFFFAOYSA-N	434.518	1.645	50	20	IDGD	
Cc1ccc(N2C[C@H](C(=O)OCC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)CC2=O)cc1	849123007	PVZCJJYLKRVWFD-OAHLLOKOSA-N	440.412	1.261	50	20	IDGD	
CC1CCN(C[C@H](C)C(=O)NN=Cc2c(N3CCOCC3)nc3ccccn3c2=O)CC1	874091620	TWJFEIGLDPEEDO-SFHVURJKSA-N	440.548	1.349	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CSCCS1)c1cccc(S(=O)(=O)N2CCCCC2)c1	912643222	JTXVIWQLIVHBEU-HNNXBMFYSA-N	429.589	1.471	50	20	IDGD	
O=C(NNc1ncccn1)c1cccc(S(=O)(=O)NCc2ccc3c(c2)OCO3)c1	913044373	SNRALGMQXRCPGO-UHFFFAOYSA-N	427.442	1.441	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)c1cccc(S(=O)(=O)NC2CCCC2)c1	913623967	SVJYTYRPJZREAN-UHFFFAOYSA-N	435.477	1.887	50	20	IDGD	
CN(C)N(C(=O)[C@@H]1CC(=O)N(c2cccc(Br)c2)C1)[C@H]1CCS(=O)(=O)C1	914437340	HSJKPMJABXPWEP-DOMZBBRYSA-N	444.351	1.294	50	20	IDGD	
COc1ccc(CSCC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1[N+](=O)[O-]	914751731	AFODUVKJKVBUPS-UHFFFAOYSA-N	443.445	1.274	50	20	IDGD	
O=C(COC(=O)[C@H]1CC(=O)N(C2CCCCC2)C1)NNC(=O)c1ccc([N+](=O)[O-])cc1	914928609	IYIWCPDEBOAWSH-AWEZNQCLSA-N	432.433	1.080	50	20	IDGD	
O=C(NCCC1=CCCCC1)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	915878379	ZUVMQNIZNQRHGI-UHFFFAOYSA-N	436.534	1.542	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@H](C)c2nc3ccccc3[nH]2)cc1	915926545	DVZXTHQHGAAKCF-CQSZACIVSA-N	444.517	1.583	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)NC[C@@H](C(C)C)N2CCN(C)CC2)cc1OC	916257731	AVPKBNRWVJVGRM-SFHVURJKSA-N	435.569	1.700	50	20	IDGD	
CC(=NNC(=O)[C@H](C)Oc1ccc(F)cc1)c1ccc(S(=O)(=O)N2CCNCC2)cc1	916339652	IXFTYUBOQVBAIU-INIZCTEOSA-N	448.520	1.727	50	20	IDGD	
O=C(NNC(=O)c1ccc2ccccc2n1)c1ccc2c(c1)S(=O)(=O)N(C1CC1)C2=O	916746344	MORNPMINAUVMGM-UHFFFAOYSA-N	436.449	1.617	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)NCCNC(=O)c2ccc(Br)cc2)n1	918141169	NGHLEILZGDTLJH-UHFFFAOYSA-N	437.298	1.023	50	20	IDGD	
CC[C@@H](NC(=O)NNC(=O)c1ccc2c(c1)OCCO2)c1ccccc1OCC(=O)NC	918222018	SDISWXBEEQRTGP-MRXNPFEDSA-N	442.472	1.678	50	20	IDGD	
CN(C)C(=O)COc1cccc(CNC(=O)NNC(=O)c2cc(Br)c[nH]2)c1	918223783	MSNXBCGFOSDYQB-UHFFFAOYSA-N	438.282	1.388	50	20	IDGD	
COc1ccc(CNC(=O)NNC(=O)c2cc(Br)c[nH]2)c(OC)c1OC	918226652	MYIJGIYPYGAPEE-UHFFFAOYSA-N	427.255	1.947	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)NCC(=O)N2CCN(C(=O)OC(C)(C)C)CC2)cc(C#N)n1C	918678538	ANFKKOSZHUSEFR-YVLHZVERSA-N	440.504	1.308	50	20	IDGD	
Cc1nn(C)c(C(=O)NNC(=O)c2nc(-c3ccccc3)n(-c3ccccc3)n2)c1[N+](=O)[O-]	918754732	DFUFLNDEYMONKB-UHFFFAOYSA-N	446.427	1.959	50	20	IDGD	
O=C(NC[C@H]1CCCCO1)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	920344200	QARXHYQAYHANPB-QGZVFWFLSA-N	435.484	1.958	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)Nc2nccs2)cc1)C1CCS(=O)(=O)CC1	1116199530	DXJQDUWAGAYXSH-UHFFFAOYSA-N	430.533	1.212	50	20	IDGD	
C=CCNC(=S)NNC(=O)c1cc(C2CC2)nc2c1c(C)nn2[C@@H]1CCS(=O)(=O)C1	1317737729	HPBMQSCEHSZDDE-CYBMUJFWSA-N	448.574	1.272	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)N2C[C@H]3C[C@H]3C2)C1	1779262890	JOVYVBJCRISDHU-SQPDSBPRSA-N	442.398	1.624	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnc4snnc4c3)C2)C1	1780071617	IFTKFPPOIJPJLR-QFYYESIMSA-N	440.323	1.313	50	20	IDGD	
COc1cc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)ccc1O	1780752261	KZBYHVDEVXEBKE-SGTLLEGYSA-N	427.295	1.628	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc4c(n3)OCCO4)CCO2)C1	1781226890	CFQDLLUUSINGEA-RTBURBONSA-N	444.315	1.533	50	20	IDGD	
COC(=O)[C@@H]1CC[C@H](C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](F)Br)C3)C2)C1	1781325588	ODBVPRGQAGTYKJ-PFHKOEEOSA-N	435.290	1.096	50	20	IDGD	
O=C([C@H](F)Br)N1CC[C@]2(C1)CN(C(=O)[C@H]1Cc3ccccc3CN1)CCO2	1781332089	ZQNMNENRWADXKC-GJYPPUQNSA-N	440.313	1.221	50	20	IDGD	
C[C@H](Cc1ccco1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCC(=O)NN(C)C)C1	1782214420	QGLYBHFDQSRIOM-LYHRCORUSA-N	448.564	1.345	50	20	IDGD	
O=C(c1cnc2c(c1)CCNCC2)N1CC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1782730377	ICKYIMKXWZSGSP-LJQANCHMSA-N	427.332	1.017	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cc4ccccn4n3)CCO2)C1	1783348046	SRLCIGKVZOOGGE-KXBFYZLASA-N	435.322	1.951	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)Cc3ccc(F)c(C#N)c3)CCO2)C1	1783535767	CCYWGOZPFDOMIQ-BFUOFWGJSA-N	438.297	1.853	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccccc3OC(F)F)CCO2)C1	1783883896	MTYYVTDEIXXHQW-LIRRHRJNSA-N	432.851	1.985	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C#Cc3ccc(Cl)cc3)[C@H]2C1	1783921858	MPTLQRLKJNTNNI-KANFNMMFSA-N	439.339	1.925	50	20	IDGD	
Cc1nnc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]3C2)s1	1783965244	DKADGXVGGWHBJS-SAXRGWBVSA-N	445.383	1.400	50	20	IDGD	
CCn1nc(C(C)C)cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]2C1	1784092470	IPYNJDMGBSPNDR-USJZOSNVSA-N	426.945	1.219	50	20	IDGD	
O=C(CCc1ccccc1Cl)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21	1786599620	GYXPIPJMHFSDSE-LAQRGFTBSA-N	429.344	1.852	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](N)c3ccccn3)[C@H]2C1	1786872577	RUEIGBHOUNFRAF-QZLJAVCYSA-N	439.354	1.235	50	20	IDGD	
CC[C@H]1CC[C@H](C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)CC1	1786986647	USLDNEHXXAIBEF-XWCXQPFMSA-N	442.365	1.176	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3snnc3C3CC3)[C@H]2C1	1787740765	LKTJFGPZQWXMRS-KKUMJFAQSA-N	438.626	1.860	50	20	IDGD	
C[C@@H](Oc1cccnc1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]2C1	1789926920	LEXPWLPOJMZJIX-ZLTXHLNPSA-N	444.301	1.519	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]3C2)cc(O)n1	1791057068	APQNXIPTBDFZRT-DHMWGJHJSA-N	426.311	1.472	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnn4c(C)cc(C)nc34)C[C@@H]21	1791254934	XFXIZEJUCOXOHV-OWLYRPNTSA-N	449.939	1.193	50	20	IDGD	
CN1CC(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)/C(C#N)=C/c4ccc(F)cc4F)C[C@@H]32)C1	1791796541	DEWGGFMTACLCLX-ZGUZDIQNSA-N	444.482	1.413	50	20	IDGD	
C[C@@H](Cn1ccnc1)C(=O)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1	1791868479	BRIRLHRVNHSAPJ-KRWDZBQOSA-N	446.316	1.647	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2	1793152551	OWSXGNDUOVKJCK-XBORSJSESA-N	447.935	1.804	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1CCC(C)CC1	1793385921	JPHDAOHVBCRAGR-PNFLAOTCSA-N	442.564	1.491	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)NC(=O)c1ccccn1)C2	1793453700	RTJBHGAMJUGGIR-UJHHCITNSA-N	436.940	1.197	50	20	IDGD	
O=C(CCCc1ccncc1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2	1794132961	QQXHUCLXORVYMH-FSDCSDTHSA-N	428.302	1.684	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1cccnc1Cl	1794220232	BGKOEHJULPLKQE-QDMKHBRRSA-N	442.907	1.228	50	20	IDGD	
Cc1nc[nH]c1CSCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCBr	1795115974	YDPLNHAQUGQUDI-FVCICTRLSA-N	445.383	1.326	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)c1ccc(C(F)(F)F)[nH]1	1796188730	MVSWMGXIJUODAY-QDMKHBRRSA-N	435.211	1.279	50	20	IDGD	
CN(C)c1ccc([N+](=O)[O-])c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Cl)c1	1796365905	GAVNVXGIFCPYDE-OJXGSEEGSA-N	428.848	1.398	50	20	IDGD	
CC(C)(C)OC(=O)N1C(=O)CC[C@@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Cl	1796368104	CJRXVDUDYLUSJX-OGMFBOKVSA-N	447.891	1.037	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CC=CCC1)C2	1796439528	IRNLEMOAAZZPDL-HRHRNMPXSA-N	427.505	1.066	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CN(Cc2ccccc2)CCO1)[C@H](O)CCl	1797853203	CSTAYJGXZDDHLK-IVDHNXQLSA-N	435.952	1.125	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)c1ccncc1-c1ccccc1	1798341237	ZWGWAFKYMRFNAB-JSJNYSNDSA-N	429.904	1.552	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1c[nH]c3nccc-3c1)C2	1798440153	FBFFDCSRBSTHGO-MUJYYYPQSA-N	433.472	1.079	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c(c1)CC(=O)N3)C2	1799277524	WXXVTFOFVJJEEN-ACNBBOPNSA-N	440.327	1.621	50	20	IDGD	
COc1ccccc1OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Br	1799343341	SJXRBQTZMVFXQY-CZAMWMTLSA-N	445.285	1.354	50	20	IDGD	
COc1cccc(OC)c1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCC(=O)NN(C)C)C2	1799565987	SVBHRSPQDHNRQW-MUJYYYPQSA-N	432.521	1.329	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cn1cnc2ccccc21	1800888525	QJVWTYPMQXSYQO-VPTLXERWSA-N	430.581	1.477	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C[C@@H]1COc3ccccc3O1)C2	1800971394	YLFOQXDXHIENJG-HWEQFAERSA-N	438.908	1.060	50	20	IDGD	
CC[C@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccn3c(O)nnc13)C2	1801801187	BBDJAMHXOKRWGE-OPDFLTKYSA-N	436.310	1.860	50	20	IDGD	
COC[C@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCS(=O)(=O)c1ccccc1)C2	1802272942	GLMFFFLVDJIRDN-DFGXFYAUSA-N	442.965	1.742	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]2c2cccnc2)c1	1803145724	HJRNUSJBWUEPRF-MISYRCLQSA-N	444.919	1.959	50	20	IDGD	
COc1cccc(CC(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)n1	1804393409	ASCHUWKBRCDACZ-XAUMDUMWSA-N	432.908	1.333	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2c(F)c(C)nn2C)[C@@H]1c1cccnc1	1805150562	QLKYYOXUGZVITN-ZOBUZTSGSA-N	437.903	1.836	50	20	IDGD	
Cn1c(=O)c(C(=O)N2CCC3(CCCN(C(=O)[C@H](O)CCl)C3)CC2)nc2ccccc21	1805524183	KHVIOPIWBOCXKS-QGZVFWFLSA-N	446.935	1.378	50	20	IDGD	
Cc1cccnc1CCC(=O)N1CCCC2(CCN(C(=O)c3ccc(B(O)O)cc3)CC2)C1	1806916802	GVRLHQDNPIUKRJ-UHFFFAOYSA-N	449.360	1.547	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)NC[C@H]1CCN(C(=O)CO[Si](C)(C)C)[C@H]1c1cccnc1	1808430793	KIMPCZIQZRCBMS-ZTNFWEORSA-N	434.613	1.806	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC2(CCCN(C(=O)[C@H]3CNc4ccccc43)C2)CC1	1809801565	DHXAPBWGVVEJSJ-NRFANRHFSA-N	447.344	1.421	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)N1CC[C@H](CNC(=O)CO[Si](C)(C)C)[C@H]1c1cccnc1	1810546007	KPSCDOVTSHTXIU-SZVBFZGTSA-N	449.628	1.647	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)c1cnc2ccc(F)cn12	1812237939	LZGJUTNNWAGKSI-POZUXBRTSA-N	445.882	1.788	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)[C@H](C)Nc2cnccn2)[C@@H]1c1cccnc1	1813033126	ZYXVZQODHAYGQU-PCODUJHASA-N	446.939	1.632	50	20	IDGD	
O=C(CCc1ccoc1)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1813523789	WXUKATVOGBCCBT-NZQKXSOJSA-N	447.300	1.307	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)Cc2cnc3ccccn23)[nH]n1)[C@@H](O)CCl	1814863741	BDULPYUNQNRBAZ-HOTGVXAUSA-N	430.896	1.892	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccnc2C(N)=O)n[nH]1	1816077162	JSYSZIJLWCITFA-MFKMUULPSA-N	449.309	1.993	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cn[nH]c1)CC2	1817279758	CGXZVDGZIBGJJN-SQXLOGQISA-N	440.489	1.226	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnc[nH]2)[nH]n1	1818111306	BRXVNWZFPWFCRS-YEEYNWEUSA-N	437.464	1.573	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](F)Cl)[nH]n1)c1cc2n(n1)CCCNC2=O	1818975311	JMEKOEYLRCQKSN-SWLSCSKDSA-N	437.863	1.580	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H]2CCC=CO2)n[nH]1	1819375546	WESSIAZYWUUOHY-IAGOWNOFSA-N	439.476	1.407	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H]1CCCS1)CC2	1819801049	GEYHGKHYNRSEOP-HZMBPMFUSA-N	446.558	1.263	50	20	IDGD	
CC(C)O[C@@H](C)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCC(=O)NN(C)C)CC2	1820015244	FXMSKGQVTJQRDU-QWHCGFSZSA-N	425.555	1.242	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc(O)nc2)n[nH]1	1820255276	SCEIFOGKOGZDIJ-OAHLLOKOSA-N	429.481	1.189	50	20	IDGD	
CC(C)N(C)CC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1822993750	KMFDQWPQBJDIET-KRWDZBQOSA-N	442.524	1.054	50	20	IDGD	
CC(C)OCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1	1823868520	VWRZGRPQVDEEIS-IBGZPJMESA-N	431.537	1.343	50	20	IDGD	
N[C@@H](Cc1cscn1)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@H](O)CCl)CC1	1824183159	PVMORODGGDBECS-GVDBMIGSSA-N	428.986	1.232	50	20	IDGD	
CC(C)(C)OCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1	1824896089	GCSJDLQLDONJLG-IBGZPJMESA-N	445.564	1.734	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)C[C@@H]2CCCCO2)CC1	1824904536	BXXHEFOIBKBTRU-VXKWHMMOSA-N	442.365	1.559	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@H]1CCc2nc(NC(=O)[C@H]3CNC(=O)C3)sc2C1	1825190982	GEJFWOHWOVGKHJ-BBBLOLIVSA-N	429.340	1.222	50	20	IDGD	
CCc1ccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)cn1	1825748753	DXPXMRVHRORYLR-HSZRJFAPSA-N	449.360	1.871	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1nc3ncccn3n1)CC2	1826000310	RPRQFBFMWIUISU-NXEZZACHSA-N	435.897	1.060	50	20	IDGD	
N[C@@H](Cc1cscn1)C(=O)N[C@@H]1CCc2nc(NC(=O)C(Cl)Cl)sc2C1	1826099051	OPUOJMXUKDFCMG-APPZFPTMSA-N	434.374	1.885	50	20	IDGD	
Cc1nc2ncccn2c1C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H](O)CCl)CC1	1828229149	RNTDYANSJRWYGK-IRXDYDNUSA-N	433.940	1.871	50	20	IDGD	
O=C([C@@H](O)CCl)N1CCC([C@@H]2CCCCN2C(=O)COC(=O)C(F)(F)F)CC1	1828833159	JGQGMTOADLATDZ-STQMWFEESA-N	428.835	1.311	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(Cl)cc3C)CCO2)C1	1830124572	MFAJKLNFMHZXHL-XLIONFOSSA-N	445.343	1.972	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)CNC(C)=O)C2)C1	1831640564	NRKABEKCIVLTST-OXJNMPFZSA-N	431.961	1.013	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc(OCC)cn3)C2)C1	1831644139	PQLJBHUGSAHPNG-QRWLVFNGSA-N	440.928	1.353	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H]2C[C@H]3CC[C@@H]2O3)CC1	1831684505	GICIPUUOJWYELP-WTGUMLROSA-N	434.581	1.547	50	20	IDGD	
CC[S@@](=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1	1831873634	QTUUJOQBNOSQQF-YVGXBJCXSA-N	442.626	1.138	50	20	IDGD	
Cc1c[nH]c(C)c1CCC(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)CCl)CC2)CC1	1833305968	HLTOTGGUYOYULW-FQEVSTJZSA-N	439.000	1.735	50	20	IDGD	
COc1cccc(C(=O)N2CCO[C@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)n1	1833762667	VQMRPKWGXBZXRE-HXUWFJFHSA-N	425.913	1.425	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3c[nH]c4nccc-4c3)CC2)CC1	1835014774	IDSLVOPHNFUSEU-IBGZPJMESA-N	447.967	1.954	50	20	IDGD	
CC(=O)O[C@H](C(=O)NC1CCN(C2CCN(C(=O)C(Cl)Cl)CC2)CC1)C(C)C	1835651598	ZNDHCKYTCNGHRI-INIZCTEOSA-N	436.380	1.949	50	20	IDGD	
CC[S@@](=O)CCC(=O)NC1CCN(C2CCN(C(=O)C(C)(C)CCl)CC2)CC1	1835653923	SNFRURDYGNAYNT-MUUNZHRXSA-N	434.046	1.982	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CNc3ccccc31)CCO2	1835718442	WZCKDZHGNZJNMI-GCJKJVERSA-N	447.608	1.504	50	20	IDGD	
Cc1cc(CC(=O)N2CCC(N3CCC(NC(=O)CO[Si](C)(C)C)CC3)CC2)no1	1835837266	AIYLQAKKSUVDPM-UHFFFAOYSA-N	436.629	1.949	50	20	IDGD	
O=C(CCc1ccsc1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1836007691	XOZVYBBHSLYLID-WBVHZDCISA-N	449.342	1.828	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3c(C)n[nH]c3C)CCO2)C1	1837808799	XUMOXASTSWXOSH-KBXCAEBGSA-N	443.342	1.270	50	20	IDGD	
C=CC(=O)N[C@@H](C)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1838427722	FACWPFCSYORFTI-BLLLJJGKSA-N	448.333	1.366	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3noc(C(C)C)n3)C2)C1	1839142677	VRWSQRBSHDLRFN-LIRRHRJNSA-N	428.917	1.209	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(O)ccc3O)C2)C1	1839154243	IEXGALUDQOJDJQ-OALUTQOASA-N	447.315	1.404	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(OC)cc3F)CCO2)C1	1839292128	SWIWYDHNDQMKKE-JXFKEZNVSA-N	428.888	1.922	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H]3Cc4ccccc4N3)CCO2)C1	1839733682	UUWDUERDRCBCSE-ZWCUEREDSA-N	435.952	1.887	50	20	IDGD	
O=C(C[C@@H]1C[C@@H]2CC[C@H]1C2)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1839915228	JKCIWHHWBRRCNJ-OKVDMCGNSA-N	447.345	1.960	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)Cc1cc(F)ccc1F)C2	1843417180	FYZIQPVDVRAZNW-VULFUBBASA-N	443.454	1.845	50	20	IDGD	
COc1cc(C)ccc1C(=O)N1CC2(CCCN2C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C1	1843417278	QNCSNKANFMJNQV-PCLIKHOPSA-N	437.500	1.955	50	20	IDGD	
Cc1nc2cccc(C(=O)N3CCCC34CN(C(=O)CCC(=O)NN(C)C)C4)c2s1	1843669076	JIRJNVFBTITLOB-UHFFFAOYSA-N	429.546	1.795	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@H](NC(C)=O)c2ccc(F)cc2)C1	1845006877	MYGXTEYJUTXUDZ-SJORKVTESA-N	425.888	1.460	50	20	IDGD	
C=CCSCC(=O)N1CC2(CCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)C1	1845038371	VNDFNPFNRNTADF-UHFFFAOYSA-N	445.589	1.455	50	20	IDGD	
O=C(COC(=O)COc1ccc2ccccc2c1)NNC(=O)[C@@H]1COc2ccccc2O1	10592013	ILUSIUXUSUCZBJ-FQEVSTJZSA-N	436.420	1.749	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cc(=O)[nH]c3ccccc23)cc1OC	11459207	VUJWRMQJMWSJNT-UHFFFAOYSA-N	425.397	1.163	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)c1ccc(S(=O)(=O)C(F)F)cc1	26737365	PFMIMEPURUIAEQ-UHFFFAOYSA-N	428.413	1.922	50	20	IDGD	
C[C@H]1CCCC[C@@]12NC(=O)N(CC(=O)NNC(=O)c1cc(Br)c[nH]1)C2=O	28717698	GUTDNAXJHOUTKA-XXFAHNHDSA-N	426.271	1.039	50	20	IDGD	
Cc1ccc(C(=O)C2CCN(C(=O)NNC(=O)CNC(=O)c3ccco3)CC2)c(C)c1	725871988	TZNDTSUYEHZMNR-UHFFFAOYSA-N	426.473	1.962	50	20	IDGD	
Cc1ccc([C@H](CN2CCOCC2)NCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1	727385053	XDVRUNIPYPUJSG-FQEVSTJZSA-N	441.488	1.327	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNS(=O)(=O)c2cc3c(cc2Cl)NC(=O)C3)c1	728015517	QJZVCLOFMUKXFF-UHFFFAOYSA-N	425.850	1.475	50	20	IDGD	
O=C(COC(=O)CCOc1ccc(Cl)cc1)NNC(=O)[C@@H]1COc2ccccc2O1	728328813	MDRCLDQBUNPZST-KRWDZBQOSA-N	434.832	1.640	50	20	IDGD	
Cn1ccnc1CNC(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	728753201	OMCQHEDYRFDVCT-UHFFFAOYSA-N	431.460	1.266	50	20	IDGD	
CC(=NNC(=O)Cc1cccnc1)c1ccc(S(=O)(=O)N2CCC(C(=O)O)CC2)cc1	728785873	SRBOHBZRLGGCPW-UHFFFAOYSA-N	444.513	1.650	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NCCCCC(C)(C)C)nc2)CC1	729613427	RMWHLFWAMTXPJR-UHFFFAOYSA-N	426.587	1.860	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)c1cc(Cl)ccc1-n1cnnn1	730076834	AGUOKFNRMHXKND-UHFFFAOYSA-N	433.881	1.513	50	20	IDGD	
CCN(C)c1ccccc1CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	730135879	NELINRCHUVVPRE-UHFFFAOYSA-N	433.534	1.537	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N[C@@H](C)CN2CCN(C)CC2)cc1Br	732256121	VOGQMMDDOPTPIN-LBPRGKRZSA-N	428.331	1.038	50	20	IDGD	
Cc1nc(CN2CCC(CNC(=O)NNC(=O)c3ccc4c(c3)OCCO4)CC2)oc1C	732257581	UGEJGEPSMJQKBR-UHFFFAOYSA-N	443.504	1.919	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)NCCN/C(O)=C2\N=CC=CC2=O)c(C)n1-c1ccccc1	732466566	PHSXGQGSNJLHDU-XUTLUUPISA-N	436.472	1.565	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)c1cccc(O)c1	732890194	VXKJQLDPHSKWMX-AWEZNQCLSA-N	432.502	1.882	50	20	IDGD	
N#Cc1ccc(N2C(=O)N[C@@H](CCC(=O)NNC(=O)c3cccc4ncccc34)C2=O)cc1	733775641	KLBHCNKWKLSOKU-IBGZPJMESA-N	442.435	1.773	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)NCCc2cccs2)cc1C(=O)N(C)C	734416093	KYRICMUOKDFVCP-UHFFFAOYSA-N	426.520	1.194	50	20	IDGD	
COc1ccc(S(=O)(=O)C[C@@H](C)C(=O)NNC(=O)c2cc(Br)c[nH]2)cc1	735030791	KLWHSYJAGOTGCS-SNVBAGLBSA-N	444.307	1.657	50	20	IDGD	
O=C(NCC[S@](=O)Cc1ccccc1)NNC(=O)c1nn(-c2ccccc2)cc1O	735106816	CSLZXRPHRLLHQQ-PMERELPUSA-N	427.486	1.471	50	20	IDGD	
CC(C)(C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1)c1ccc([N+](=O)[O-])cc1	740394718	LMXVPNKNYXTNGR-KRWDZBQOSA-N	443.412	1.403	50	20	IDGD	
COc1ccccc1-c1nn(C)cc1C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	740647355	IUGPQKHQANSKDP-UHFFFAOYSA-N	428.470	1.574	50	20	IDGD	
O=C(NNC(=O)c1nccn2ccnc12)c1ccccc1NS(=O)(=O)c1cccs1	741144654	YBDVLNCXVDLLCP-UHFFFAOYSA-N	442.482	1.666	50	20	IDGD	
COc1ccc(Oc2ccc(S(=O)(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)cc2)cc1	741203303	DUOROBGUUDFFMC-ZDUSSCGKSA-N	440.499	1.232	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)[C@@H]1CCCN(C(=O)COc2ccccc2)C1	741213136	ASBBAFJFZMSOEV-MRXNPFEDSA-N	427.457	1.236	50	20	IDGD	
Cc1ccc(NC(=S)NNC(=O)CN2CCN(C(=O)OC(C)(C)C)CC2=O)c(C)c1	741302785	XKHCDOLKEQRNTQ-UHFFFAOYSA-N	435.550	1.700	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cccc(C(=O)NC)c2)c1	742032201	AOHXVFQBRSGFMC-UHFFFAOYSA-N	432.502	1.152	50	20	IDGD	
NC(=O)[C@H]1CC(C(=O)NNC(=O)NCc2cccc(C(F)(F)F)c2)=NN1c1ccccc1	742453134	DXITXNIJBOKGTA-MRXNPFEDSA-N	448.405	1.656	50	20	IDGD	
CC(C)Nc1ncccc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	743285972	VGSJYVKXEFVCSC-UHFFFAOYSA-N	431.518	1.761	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2cc(N3CCOCC3)ccn2)c2ccccc2c1=O	743885309	TZQDMEYPNHWQRY-UHFFFAOYSA-N	436.472	1.113	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CN2CCC(C(=O)NCCc3cccs3)CC2)c1	744390220	CAOOXAGMPJJUQT-UHFFFAOYSA-N	439.541	1.452	50	20	IDGD	
CCN1CCN(C(=O)CC2CCN(CC(=O)NNC(=O)c3cccc(C)c3)CC2)CC1	744403336	XICFCUCOHCGIPK-UHFFFAOYSA-N	429.565	1.022	50	20	IDGD	
CCO[C@@H]1C[C@@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)C12CCCC2	745918012	MQYQAHMUMUSGBJ-IAGOWNOFSA-N	438.550	1.619	50	20	IDGD	
COc1cc2c(cc1CNC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)O[C@@H](C)C2	746348353	XCWMVMCCRZIMAM-LBPRGKRZSA-N	448.501	1.958	50	20	IDGD	
C[C@H](NS(=O)(=O)c1ccc(C(N)=O)cc1)C(=O)NNc1ccc(C(F)(F)F)cc1	747604868	ILVHLUFFAGHUOQ-JTQLQIEISA-N	430.408	1.614	50	20	IDGD	
COc1cc(OC)cc(N2CC[C@H](NC(=O)NNc3ccc(-n4cccn4)nn3)C2=O)c1	747954148	HZGJONUGCHSXQV-INIZCTEOSA-N	438.448	1.111	50	20	IDGD	
CCOc1ccc(N2C(=O)/C(=C\NNC(=O)C(=O)N3CCCC3)c3ccccc3C2=O)cc1	748208225	LXLAWSWLDLHJSN-HKWRFOASSA-N	448.479	1.856	50	20	IDGD	
COCCOCC(=O)NC1CCC(C(=O)NNC(=O)Cc2ccc3ccccc3c2)CC1	748840434	KFQKRAMDBTVXLC-UHFFFAOYSA-N	441.528	1.868	50	20	IDGD	
Cn1nc(SCC(=O)NN=C2CC3(CCCC3)Oc3ccccc32)c(=O)n(C)c1=O	749809806	KLCDGVUPBKBBCI-UHFFFAOYSA-N	429.502	1.187	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)N[C@H]2CC(=O)N(C3CC3)C2)cc(OCC)c1OCC	750654483	AWDGDXSWRWSLJO-AWEZNQCLSA-N	434.493	1.590	50	20	IDGD	
Cc1cc(C)cc(C(=O)N2CCC[C@@H](C(=O)NNC(=O)CNC(=O)c3ccco3)C2)c1	751203369	NWQKBLJIPJJOHI-MRXNPFEDSA-N	426.473	1.326	50	20	IDGD	
CCCCN1C(=O)c2ccc(C(=O)NNC(=O)CNC(=O)c3cccs3)cc2C1=O	751211775	URKSFYZSFQVSCM-UHFFFAOYSA-N	428.470	1.335	50	20	IDGD	
Cn1c(NNC(=O)CCNS(=O)(=O)/C=C\c2ccccc2)nc2ccccc2c1=O	752905811	AUZWOKZYJXOAGO-OWBHPGMISA-N	427.486	1.357	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCCC[C@@H]2c2nnc(C3CCOCC3)o2)n1	752926900	RDVDLLGLCIBEBJ-OAHLLOKOSA-N	448.549	1.646	50	20	IDGD	
Cc1nc(-c2ncccn2)nc(O)c1CC(=O)NNC(=S)NCCc1cccs1	753078703	PYZKVIQZPGJGCY-UHFFFAOYSA-N	429.531	1.290	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)[C@H](CC(C)C)N2CCCCC2=O)c2ccccc2c1=O	755048263	YNEILSDOVQPHEJ-SFHVURJKSA-N	441.532	1.995	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)Nc2ccc(N3C[C@H](C)O[C@H](C)C3)nc2)cc1	755867013	UMQLLNKOWVCHOT-GASCZTMLSA-N	429.477	1.936	50	20	IDGD	
COC(=O)c1n[nH]c2ccc(NC(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)cc12	756574112	ONAFZYSETFZTIW-UHFFFAOYSA-N	431.430	1.220	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)Nc2cnn(CC(=O)NC3CC3)c2)c1	756795931	MNDWRVSPCROYFW-UHFFFAOYSA-N	428.493	1.825	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)c2cncc(N3CCOCC3)c2)c1	756978231	USAPMMQVVNAEES-UHFFFAOYSA-N	435.278	1.764	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)Nc1cc(Br)c(=O)n(C)c1	757689688	NHIKOXFYXRBANJ-SECBINFHSA-N	427.230	1.907	50	20	IDGD	
COCc1nc2n(n1)C[C@@H](NC(=O)NNC(=O)c1ccc(OCCC(C)C)cc1)CC2	757790943	XCPJCXWKDFQUQB-INIZCTEOSA-N	430.509	1.808	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)Nc2ccc(-n3ncn(C)c3=O)cc2)cc1	757864489	ZEQHZKPVOXWWPJ-CQSZACIVSA-N	440.460	1.590	50	20	IDGD	
CCCc1cc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(CC)CC)c2)n(C)n1	757889799	AFBHNABBMYCMHR-UHFFFAOYSA-N	436.538	1.870	50	20	IDGD	
CCCc1c(NC(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)cnn1-c1cccc(F)c1	758015451	ZUEYYAZISDPBFF-NSHDSACASA-N	426.474	1.054	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)Nc1ccc(NC(=O)CCN2C(=O)CNC2=O)cc1	758040055	NMPBIUHXOSZWMW-UHFFFAOYSA-N	438.444	1.342	50	20	IDGD	
COc1ccc2c(c1)C=C(C(=O)N1CCN(S(=O)(=O)CBr)CC1)CO2	758528419	UNYITIOHAKMPOE-UHFFFAOYSA-N	431.308	1.297	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)N[C@@H]2CN(C(=O)OC(C)(C)C)C[C@@H]2C#N)c1	758774410	HIMCEKPEUZZDHN-JKSUJKDBSA-N	431.493	1.772	50	20	IDGD	
O=C(NNC(=O)c1ccc(NS(=O)(=O)c2ccccc2)cc1)C(=O)Nc1ccccn1	758828103	PZOLAJCXJBEEFO-UHFFFAOYSA-N	439.453	1.282	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)[C@@H](C)NC(=O)c2ccc(Br)s2)nc1	759734403	DCLBMVIIURLBAJ-MRVPVSSYSA-N	427.280	1.954	50	20	IDGD	
COc1ccccc1C(=O)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	760455533	SWDWQSAJSNQQMA-UHFFFAOYSA-N	431.470	1.124	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H]2CCC[C@@H]3OCC[C@H]32)c1	761789337	GJBLNFVETMHOEC-KSZLIROESA-N	438.550	1.619	50	20	IDGD	
CC(=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O)c1cc(Br)ccc1F	763150022	DFTICYMFRODSLY-UHFFFAOYSA-N	444.286	1.013	50	20	IDGD	
CCS(=O)(=O)N[C@H](CCSC)C(=O)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	763172884	DHGRPBAXFLEFQI-CYBMUJFWSA-N	443.526	1.038	50	20	IDGD	
O=C(NNC(=O)c1cc(Cl)ccc1-n1cnnn1)c1cc(-c2ccc(F)cc2)[nH]n1	763177705	POZLQLUTFVBITA-UHFFFAOYSA-N	426.799	1.920	50	20	IDGD	
CCNC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3n2)cc1	763466292	LHGQEZFZQCHIIQ-UHFFFAOYSA-N	435.440	1.149	50	20	IDGD	
COc1ccc(NC(C)=O)cc1NC(=O)C(=O)NNC(=O)c1cc2ccccc2cc1O	763528621	WHNUVXHCUHUNHJ-UHFFFAOYSA-N	436.424	1.912	50	20	IDGD	
O=C(NNC(=O)c1c[nH]c2ccccc12)C(=O)Nc1cc(F)cc(N2CCOCC2)c1	763541193	OVHHCCNUCLHSQD-UHFFFAOYSA-N	425.420	1.543	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)C(=O)Nc1cnn(-c2ccccc2Cl)c1	763558949	OIPKDPBYPMIQOV-UHFFFAOYSA-N	427.804	1.654	50	20	IDGD	
CCOC(=O)/C=C\c1ccc(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1	763572465	RKJSNSJNYHYQCP-ZVBPTUHVSA-N	439.424	1.189	50	20	IDGD	
COC(=O)C(C)(C)c1ccc(NC(=O)C(=O)NNC(=O)COc2cc(C)cc(C)c2)cc1	763649832	YTYMZBUGCALUIY-UHFFFAOYSA-N	441.484	1.919	50	20	IDGD	
CCNC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)COc2ccccc2OC)c1	763661426	BIZNSDGGEOHMAX-UHFFFAOYSA-N	429.433	1.002	50	20	IDGD	
C=CCNC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)COc2cc(C)ccc2C)cc1	763665385	HPPNZBGOAMURFD-UHFFFAOYSA-N	439.472	1.776	50	20	IDGD	
CCc1ncsc1NC(=O)C(=O)NNC(=O)COc1ccc(Br)cc1	763696213	UKWHDYMRXCRTPP-UHFFFAOYSA-N	427.280	1.633	50	20	IDGD	
Cc1ccc(C(=O)NC2CC2)cc1NC(=O)C(=O)NNC(=O)CN1CCCc2ccccc21	763746500	YZDYBUVBGSWQRC-UHFFFAOYSA-N	449.511	1.426	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(Oc2cccnc2)nc1	763807927	RXJJXSOXWUZJOJ-UHFFFAOYSA-N	432.396	1.305	50	20	IDGD	
O=C(CCCOc1ccccc1Br)NNC(=O)CNC(=O)c1cccnc1	763824324	NJDPQWBGHNWUGF-UHFFFAOYSA-N	435.278	1.581	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)cnn1-c1ccccc1	763848646	FAGYCKZDWYEYTK-AWEZNQCLSA-N	425.420	1.873	50	20	IDGD	
COc1ccc(NC(C)=O)cc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccc(F)cc1	763873073	QHMRKQCUOKOIHE-NSHDSACASA-N	432.408	1.346	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cnn(C)c2C(F)F)cc1OC	763910331	DXKDPMYENLVQMR-UHFFFAOYSA-N	425.392	1.555	50	20	IDGD	
O=C(NNC(=O)C1=S=C(c2ccc(F)cc2)C=C1)C(=O)Nc1cccc([N+](=O)[O-])c1	763976595	WUIAMHUJOUINKW-UHFFFAOYSA-N	428.401	1.516	50	20	IDGD	
Cc1nn(-c2ccc(Br)cc2)c(NC(=O)C(=O)NNC(=O)c2ccc[nH]2)c1C	763980403	VNSJVCSNPPYYOX-UHFFFAOYSA-N	445.277	1.979	50	20	IDGD	
O=C(Cc1cccc2ccccc12)NNC(=O)C(=O)Nc1cnn(Cc2ccccn2)c1	764035099	FGKOCWXQLGHGAT-UHFFFAOYSA-N	428.452	1.808	50	20	IDGD	
C[S@@](=O)c1cccc(NC(=O)C(=O)NNC(=O)c2ccc(F)cc2Br)c1	764084756	HGMXAFAKZICAQT-AREMUKBSSA-N	442.266	1.725	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)C(=O)Nc1ccnc(OCC(F)(F)C(F)F)c1	764263230	APOJLEAEOAZPHS-UHFFFAOYSA-N	429.330	1.084	50	20	IDGD	
CNS(=O)(=O)c1ccc(C)c(NC(=O)C(=O)NNC(=O)c2cc3ccccc3o2)c1	764330631	DHRQUBPNTFZTAV-UHFFFAOYSA-N	430.442	1.049	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)N2C[C@@H](C(=O)N3CCCCC3)Oc3ccccc32)o1	764371560	PCZAQWWKKZXVAW-SFHVURJKSA-N	440.456	1.156	50	20	IDGD	
CS(=O)(=O)Cc1cc(F)ccc1NC(=O)C(=O)NNC(=O)c1ccc(Cl)cc1F	764410726	OOAYTIOWDCJKBY-UHFFFAOYSA-N	445.831	1.563	50	20	IDGD	
CSc1nc2nc(C)c(CC(=O)NNC(=O)CSc3ccccc3O)c(C)n2n1	765402082	DLYYPZBKVOKWKZ-UHFFFAOYSA-N	432.531	1.651	50	20	IDGD	
CCOC(=O)NNC(=O)C(=O)Nc1ccc(Oc2ccccc2S(=O)(=O)CC)cc1	765405268	NMFNEXGZPRJYNF-UHFFFAOYSA-N	435.458	1.988	50	20	IDGD	
CCOC(=O)N1CCC[C@H](C(=O)NNC(=O)c2cc(-c3ccc(OC)c(OC)c3)[nH]n2)C1	765595621	AJFADRRWZSFETH-AWEZNQCLSA-N	445.476	1.723	50	20	IDGD	
Cn1cc([N+](=O)[O-])cc1C(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	765756598	ZIQWMEFMRRGWTP-UHFFFAOYSA-N	434.884	1.166	50	20	IDGD	
O=C(Cc1cccc(OCCCOc2ccccc2)c1)NNC(=O)[C@@H]1CCS(=O)(=O)C1	766310805	MFIWKEPRZYFOJH-GOSISDBHSA-N	446.525	1.659	50	20	IDGD	
Cc1cc(C)n([C@@H](C)CC(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)n1	766642861	NRAFUUUTYUEMPQ-SFHVURJKSA-N	426.521	1.056	50	20	IDGD	
CCn1c(NNC(=O)c2cc(S(=O)(=O)N(C)C)ccc2O)nc2ccccc2c1=O	767026936	MVLNZUQFNLWQDM-UHFFFAOYSA-N	431.474	1.129	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cc(C)[nH]n2)cc1S(=O)(=O)Cc1cc(C)no1	768277287	DEGCNGZUJRBXQV-UHFFFAOYSA-N	433.446	1.072	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)c1cc([N+](=O)[O-])cc(S(C)(=O)=O)c1	768634282	IDBCCWBZFADTEY-UHFFFAOYSA-N	443.459	1.167	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)CCCC[C@@H]1SC[C@H]2NC(=O)N[C@@H]21	768636872	YZSRCDCCQPPSHP-FFSVYQOJSA-N	442.563	1.268	50	20	IDGD	
Cc1cc(Br)ccc1S(=O)(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	769865966	MZCQQCZJMRSIPY-UHFFFAOYSA-N	447.332	1.784	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N[C@@H](C)[C@H]1CN(C)CCO1	769967574	PIDLZSOPLLKPSN-SLEUVZQESA-N	429.315	1.266	50	20	IDGD	
CCOc1ccc(-c2nnc(S)n2CCC(=O)NNC(=S)NCCSC)cc1	770248127	SRSVJMXATVNCAS-UHFFFAOYSA-N	440.620	1.881	50	20	IDGD	
CS(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)Cn2ccc3ccccc32)cc1F	771143241	KFHMYBAZYBJTTN-UHFFFAOYSA-N	440.478	1.162	50	20	IDGD	
C[C@H]1CN(C(=O)NNC(=O)c2cccc(OC(F)F)c2)CCN1c1nccn2cnnc12	771214431	JMGUFGJOEKTQML-LBPRGKRZSA-N	446.418	1.291	50	20	IDGD	
CC(=O)N1CCN(S(=O)(=O)c2cccc(C(=O)NNc3c(C)cccc3F)c2)CC1	771697344	MYNXDCDHRVNVRM-UHFFFAOYSA-N	434.493	1.744	50	20	IDGD	
CCCCn1cc(C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)c(C)n1	771734735	HKWSVCKMROBAIV-UHFFFAOYSA-N	435.554	1.080	50	20	IDGD	
CSc1cc(CNC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)ccn1	772604735	WZHJHSQQQCBIMX-UHFFFAOYSA-N	437.547	1.263	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)NCCN(C)S(=O)(=O)c2cccs2)c1	772624603	LZRVKEUIYRRBGP-UHFFFAOYSA-N	440.547	1.395	50	20	IDGD	
C[C@@H](C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1)c1cn(C)c2ccccc12	772845310	RTDBSHDPKODBJO-JLTOFOAXSA-N	437.452	1.812	50	20	IDGD	
O=Cc1ccc(OC(F)(F)C(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)cc1	772888795	MZUTWDBCUXSAGW-UHFFFAOYSA-N	425.775	1.588	50	20	IDGD	
CCCCS(=O)(=O)N1CCC[C@H]1C(=O)NNC(=O)[C@@H](C)Oc1cccc(Cl)c1	772969737	OQQHKOUYIWHUBG-CJNGLKHVSA-N	431.942	1.849	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cc(C)c(Br)cn2)cc1	773524247	GNPMBKKCSVLPIM-UHFFFAOYSA-N	437.250	1.326	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(NC(=O)C(=O)NNc2ccc(C#N)cc2)ccc1C	773692312	DMSZKVPLEJHZAQ-UHFFFAOYSA-N	429.502	1.979	50	20	IDGD	
CO[C@@H]1[C@H](C)[C@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)C1(C)C	776069701	NNCONXDKEMDFJL-XOKHGSTOSA-N	438.550	1.475	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)N[C@H]1CCO[C@@H](CC(C)C)C1	776885648	OEBRQFVZTSWDQN-GJZGRUSLSA-N	425.555	1.826	50	20	IDGD	
Cc1c[nH]cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)c1=O	777791307	GDTYXXRDGIPXKN-UHFFFAOYSA-N	440.481	1.237	50	20	IDGD	
COc1cc(OC)c(NC(=O)C(=O)NNC(=O)Cc2cccnc2)cc1Br	778709859	JKJGVXHDPPCCSN-UHFFFAOYSA-N	437.250	1.190	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@H](C(=O)NNc2ccccc2Br)[C@@H](C)O)cc1	779537048	OBUKMINNCHAGPF-WBMJQRKESA-N	442.335	1.929	50	20	IDGD	
O=C(COc1ccccc1-c1ccccc1)NNC(=O)[C@H](O)[C@@H](O)c1nc2ccccc2[nH]1	779580428	ZQPMWLUXENFVNV-FGZHOGPDSA-N	446.463	1.851	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)[C@H](c2c(F)cccc2Cl)N(C)C)n1	780114137	FLEJXNYHGDQROB-KRWDZBQOSA-N	442.900	1.780	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccccc1S(=O)(=O)NC1CC1)c1ccc2ccccc2c1	780374894	RWIJCWUJMYAGCM-UHFFFAOYSA-N	445.522	1.904	50	20	IDGD	
COC(=O)c1ccc(NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c(OC)c1	782079918	PPMXBCSBKWKBRS-UHFFFAOYSA-N	428.449	1.341	50	20	IDGD	
O=C(Cn1cc(NC(=O)C(=O)NN(Cc2ccccc2)c2ccccc2)cn1)NC1CC1	782825844	ZBEPDFGNUDRDJO-UHFFFAOYSA-N	432.484	1.838	50	20	IDGD	
CC(C)C[C@@H](C)n1nccc1NC(=O)C(=O)NNC(=O)Cc1nc2ccccc2n1C	782887094	NZWRVKOUGCKONK-CQSZACIVSA-N	425.493	1.706	50	20	IDGD	
COc1ccc(Cn2ncc(C)c2NC(=O)C(=O)NNc2cc(C)nc(C)n2)cc1OC	783323819	ACZDZEYVUUCFOA-UHFFFAOYSA-N	439.476	1.746	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)cn(C)c1=O	783408799	NMJMSQDYJTTZIX-UHFFFAOYSA-N	432.380	1.069	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1ccccc1Br	784005140	QNNVJLJJUIPTFF-UHFFFAOYSA-N	425.264	1.027	50	20	IDGD	
O=C(NNc1nc(C(F)(F)F)cs1)C(=O)Nc1ccc(C(=O)N2CCOCC2)cc1	785144790	MQONSMKEKFQITK-UHFFFAOYSA-N	443.407	1.716	50	20	IDGD	
CNC(=O)[C@@H]1CN(C(=O)C(=O)NNc2cc(C(F)(F)F)ccc2F)c2ccccc2O1	785167272	RRYXEFPAAQTYCM-HNNXBMFYSA-N	440.353	1.828	50	20	IDGD	
COc1cc(F)cc(NNC(=O)C(=O)Nc2ccc3nc(N4CCOCC4)oc3c2)c1	785236767	IBXLVDOEESKSIS-UHFFFAOYSA-N	429.408	1.894	50	20	IDGD	
COC(=O)[C@@](C)(CNC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)c1ccccc1	787310233	XEZVFBCFIJBQMH-FQEVSTJZSA-N	433.486	1.165	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])cc1OC(C)C	787541016	IJISLQCPTJTVTE-UHFFFAOYSA-N	430.417	1.855	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)Cn1cnc2ccc(Br)cc2c1=O	788159325	VXPKMNCYWLRMBZ-UHFFFAOYSA-N	441.282	1.096	50	20	IDGD	
COc1ccc(C(=O)Nc2cccc(NC(=O)NN(C)C)c2)cc1S(=O)(=O)NC1CC1	788254551	NWVNPGRFYPQBBH-UHFFFAOYSA-N	447.517	1.986	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2nc(C3CCC3)cs2)cc(OC)c1OC	789730671	XCECDNSNZCFKCF-UHFFFAOYSA-N	434.474	1.836	50	20	IDGD	
NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)cc1Cl	789809628	CGADXAOAPABWAX-BBRMVZONSA-N	430.848	1.098	50	20	IDGD	
O=C(NNC(=O)c1c[nH]nc1-c1ccoc1)c1cccc(S(=O)(=O)N2CCCC2)c1	789867096	KCXOQDKLDXTUOI-UHFFFAOYSA-N	429.458	1.529	50	20	IDGD	
COc1cc(OC2CC2)ccc1C(=O)N1CCN(S(=O)(=O)CBr)CC1	790853777	YLAZVYBYICJIPL-UHFFFAOYSA-N	433.324	1.676	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1cc(NC(=O)C(=O)NNc2nc3ccccn3n2)ccc1F	792392285	YULBFDGEHAPPAR-UHFFFAOYSA-N	449.468	1.027	50	20	IDGD	
CCc1cccc(C)c1NNC(=O)C(=O)Nc1c(C)nn([C@@H]2CCS(=O)(=O)C2)c1C	799842392	DSRUGZXDNCTAMT-MRXNPFEDSA-N	433.534	1.812	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc(=O)c3cc(Br)ccc3[nH]2)cc1	801108955	QZUVPMOFPPBVBV-UHFFFAOYSA-N	443.257	1.999	50	20	IDGD	
COc1cc(C(=O)NNC(=O)N=c2cc[nH]cc2)c([N+](=O)[O-])cc1OCc1cscn1	802027147	UACKZAKXPRHXRH-UHFFFAOYSA-N	444.429	1.922	50	20	IDGD	
COc1ccc(-c2ccc(C)c(NC(=O)C(=O)NNC(=O)Cn3nc(C)cc3C)c2)cn1	802566645	ZEMXEITVZCWDDJ-UHFFFAOYSA-N	436.472	1.665	50	20	IDGD	
NC(=O)C1CCN(c2ncccc2CNC(=O)NNc2ccc3c(=O)[nH]ccc3c2)CC1	806735074	SVEDQXPGRXZSRR-UHFFFAOYSA-N	435.488	1.451	50	20	IDGD	
O=C(Cc1ccsc1)NNC(=O)C(=O)Nc1ccc2nccnc2c1Br	806977086	VIZOFCQFLIEYNP-UHFFFAOYSA-N	434.275	1.782	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)C(=O)Nc2cccc3c2CNC3=O)c1	806978159	PHJYHURCXHICOV-UHFFFAOYSA-N	447.245	1.101	50	20	IDGD	
CC(=O)N1CCN(c2cccc(NC(=O)C(=O)NNc3ccc([N+](=O)[O-])cc3C)c2)CC1	807456486	AIOUXGBUZOICCM-UHFFFAOYSA-N	440.460	1.654	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)C(=O)Nc2cc(C)c(F)cc2C(=O)NCC(F)(F)F)n1	810382948	QJKBULDZWHWGKQ-UHFFFAOYSA-N	442.373	1.915	50	20	IDGD	
C[S@](=O)Cc1cccc(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c1	810442396	RKWDFTGYXWVCCO-PMERELPUSA-N	428.558	1.538	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2ccc3c(c2)SCC(=O)N3)cc1OC	811296248	QIPPSVWHFUYSBR-UHFFFAOYSA-N	445.453	1.366	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)N2CCN(c3ccccc3)CC2)ccc1OC(C)C	812451604	IVFQANJRHJHFDJ-UHFFFAOYSA-N	440.500	1.592	50	20	IDGD	
CC[C@]1(C)Oc2ccc(NC(=O)C(=O)NNc3ccc(S(=O)(=O)N(C)C)cc3)cc2O1	813033496	WFZQLKAMXGJASB-HXUWFJFHSA-N	448.501	1.916	50	20	IDGD	
CCc1nc(C)c(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)o1	813876795	YJFGJLFJJKDTIV-UHFFFAOYSA-N	449.533	1.864	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)[C@@H]1CC2CCC1CC2	814252808	KAAMYNWGRAFSPD-AFMYVXGZSA-N	449.573	1.614	50	20	IDGD	
C[C@@H](Oc1ccccc1NC(=O)C(=O)NNC(=O)[C@@H]1CCc2nncn2C1)c1ccccc1	815692476	RTJPXARNOGQLHI-NVXWUHKLSA-N	448.483	1.767	50	20	IDGD	
Cc1cc(C)c(NC(=O)C(=O)NNC(=O)[C@H]2CCc3nncn3C2)c(Br)c1	815693292	RSDSPIDBGUOXEG-NSHDSACASA-N	435.282	1.006	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@H]2CCCO2)nn1-c1ccc(Cl)c(Cl)c1	815779775	VEMNRVKNZJIXGO-CYBMUJFWSA-N	426.260	1.752	50	20	IDGD	
O=C(CN1CCN(CC(=O)Nc2ccccc2)CC1)NNC(=O)c1cccc(Cl)c1	818364400	REDPZBNCZAFKQM-UHFFFAOYSA-N	429.908	1.357	50	20	IDGD	
CCCC[C@@H](/N=C1/NS(=O)(=O)c2ccccc21)C(=O)NNC(=O)CNc1ccccc1	823328874	XOQHMTARUOPRQX-QGZVFWFLSA-N	443.529	1.543	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(N2CCCC2)c(C(=O)NNC(=O)c2ccncc2)c1	865894757	ASLKGHIASDWHJB-UHFFFAOYSA-N	445.545	1.787	50	20	IDGD	
O=C(NCc1ccccc1)NC1(C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)CCCC1	876140168	WWVUHJUUMKTKNO-IBGZPJMESA-N	438.484	1.786	50	20	IDGD	
COc1ccc(C(=O)NNc2ccc(F)cc2F)cc1S(=O)(=O)N1CCOCC1	876993678	MYZOPJLXMMAHOK-UHFFFAOYSA-N	427.429	1.751	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)c1ccc(S(=O)(=O)NCC(C)C)cc1	914749004	UQCKNRRSWCEKRJ-UHFFFAOYSA-N	449.529	1.860	50	20	IDGD	
CC(=NNC(=O)Cn1nnc(-c2ccccc2)n1)c1ccc(S(=O)(=O)N(C)C)cc1	915907467	PQMWVLRIWYJPNU-UHFFFAOYSA-N	427.490	1.131	50	20	IDGD	
C[C@@H]1CN(C[C@@H](C)C(=O)NN=C2C(=O)Nc3cc(N4CCOCC4)ccc32)C[C@@H](C)O1	915954404	DMTRJPGZSSEICE-BZUAXINKSA-N	429.521	1.041	50	20	IDGD	
CCOc1ccc(NC(=S)NNC(=O)CS(=O)(=O)Cc2ccc(C#N)cc2)cc1	916163153	SNVHLHIUUNIUTB-UHFFFAOYSA-N	432.527	1.890	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)NCc2ccccc2S(=O)(=O)N(C)C)c1C	916237576	BRFASPZLHYMERX-MRXNPFEDSA-N	448.545	1.852	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NC[C@H](C(C)C)N2CCN(C)CC2)ccc1OC(C)C	916257995	HZQOIISXHWSENS-GOSISDBHSA-N	435.569	1.698	50	20	IDGD	
CC(=NNC(=O)[C@H]1COc2ccccc2O1)c1ccc(OCC(=O)N2CCOCC2)cc1	916292303	WKNXIOGIPZQHMI-OAQYLSRUSA-N	439.468	1.604	50	20	IDGD	
CC(=NNC(=O)[C@@H](C)Oc1ccc(F)cc1)c1ccc(S(=O)(=O)N2CCNCC2)cc1	916339653	IXFTYUBOQVBAIU-MRXNPFEDSA-N	448.520	1.727	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)NCCCn3nc4n(c3=O)CCCC4)cc2C1	916649596	INKHUTNFGOIDIC-ZDUSSCGKSA-N	432.550	1.602	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NCCOc2cccc(C(F)(F)F)c2)c2ccccc2c1=O	916650824	PIEYHMRZUPEZBP-UHFFFAOYSA-N	449.389	1.975	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1	918220294	WEABKLHNYFJYJR-UHFFFAOYSA-N	441.463	1.568	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NC2CCN(Cc3ccc(F)cc3)CC2)c1	918223973	VHFBGLROICYNRJ-UHFFFAOYSA-N	448.520	1.838	50	20	IDGD	
Cc1nccn1-c1ncccc1CNC(=O)NNC(=O)c1csc(N2CCOCC2)n1	919779661	SOAXHXUPDSRIBN-UHFFFAOYSA-N	442.505	1.013	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc(C(F)(F)F)ccc1Cl)N[C@@H]1CCS(=O)(=O)C1	919961297	ZWIQUNIVIVSZPI-MRVPVSSYSA-N	435.833	1.038	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)CN1C(=O)Cn2c(cc3ccccc32)C1=O	920275186	NJFFJSZBINEGNP-ZDUSSCGKSA-N	438.415	1.378	50	20	IDGD	
Cn1c(=O)nc(O)c2nc(CCC(=O)NNC(=O)c3cc4c(s3)CCCCC4)[nH]c21	920275257	RCWYFADNEQVJEV-UHFFFAOYSA-N	430.490	1.086	50	20	IDGD	
CC(C)(C)C(=O)N1CCC[C@@H](C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)C1	920421919	MEJIVUPIAKPCDL-GFCCVEGCSA-N	444.941	1.033	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Cc2c(C)nn(C(F)F)c2C)cc1	920884305	GSOUIWNSTJYXMS-UHFFFAOYSA-N	443.476	1.214	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@@H]12	921302511	XNCGRQXJTTYBLW-DKICVRJWSA-N	444.561	1.472	50	20	IDGD	
CCn1c(=O)oc2cc(S(=O)(=O)NNC(=O)c3cncn3-c3ccccc3)ccc21	1116610085	OZIYLCDFMRIAIM-UHFFFAOYSA-N	427.442	1.423	50	20	IDGD	
CS(=O)(=O)NC1(CNC(=O)NNC(=O)c2ccc(Br)cc2)CCCCC1	1317889532	PBSUPPINVOVBBZ-UHFFFAOYSA-N	447.355	1.645	50	20	IDGD	
COc1cccc(N2CCC(NC(=O)NNC(=O)CNC(=O)c3cccs3)CC2)c1	1318142233	ZCPFIYWFKXZSAZ-UHFFFAOYSA-N	431.518	1.486	50	20	IDGD	
CS(=O)(=O)Nc1ccccc1CC(=O)NNC(=O)c1ccc(F)cc1Br	1318482180	ZWOCFUXIVQVCSJ-UHFFFAOYSA-N	444.282	1.963	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C1CCN(C(=O)c2cccnc2)CC1	1320414673	CZNLERMLOAWWQQ-UHFFFAOYSA-N	432.502	1.489	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc4cn[nH]c4cn3)C2)C1	1778777155	PAFQBSWXXSKDBR-SCLBCKFNSA-N	436.310	1.575	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc3c(c2)CC(=O)N3)C1	1778921641	GZJQNRVBXZEPDY-AQOAWAETSA-N	449.935	1.563	50	20	IDGD	
COc1ccc2[nH]cc(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)[C@H](O)CCl)C4)c2c1	1779004637	KFGWVDQTQYSOQZ-WOIUINJBSA-N	449.935	1.904	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@]2(C1)CN(C(=O)Cn1cnc3ccccc31)CCO2	1779301018	FUKGKVKEJMBHAF-NRFANRHFSA-N	430.581	1.718	50	20	IDGD	
C[C@H](Cn1cncn1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCBr)C2	1779497385	FOVOCIJVCLYUAJ-IIDMSEBBSA-N	442.358	1.213	50	20	IDGD	
Cc1cccc(C)c1C(=O)N1CC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1	1781802174	VBHMNLAKRFZESN-HSZRJFAPSA-N	437.500	1.059	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H]1CCC(=O)N1C)C2	1781902669	DLWWQVHGHIVKRC-NXEZDXNNSA-N	444.370	1.295	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2)[C@H]1CCc2ccccc2C1	1781937177	XZZKACHILXZIKS-DZCCDHAISA-N	434.964	1.905	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)N1CC[C@@]2(CN(C(=O)[C@@H](Br)CC)CCO2)C1	1782711385	FUBICEAVBIUYJO-IGCXYCKISA-N	435.315	1.551	50	20	IDGD	
CCC[C@H]1CC[C@H](C(=O)N2CC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)CC1	1783367927	ZMXLZXCJZTWMKW-YDHSSHFGSA-N	436.597	1.796	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN3CCSCC3)C[C@@H]21	1783964103	KLGWUVHIHCAOPY-UGUYLWEFSA-N	448.427	1.046	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](O)c3ccccc3Cl)C2)C1	1784250565	HHAIEALTIIQGMT-GPMSIDNRSA-N	431.316	1.457	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCOCCOCCOC)C[C@@H]21	1784622158	FLUGQOIVLKUMIP-OKYOBFRVSA-N	448.988	1.443	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3cnc[nH]3)[C@H]2C1	1785223538	LXEZNAWAHWSUOR-HNKHHVNMSA-N	427.343	1.496	50	20	IDGD	
CCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1	1785578498	MUCPBPOQQJKGBU-MDOVXXIYSA-N	447.960	1.109	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(OC)nn3C)[C@H]2C1	1785616938	PGSXJAGXKJJPGP-XPCVCDNBSA-N	443.342	1.196	50	20	IDGD	
COc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)Br)C[C@@H]32)nc1	1787760987	HFWOXZUSRWSZQW-DSPQJCBJSA-N	426.311	1.467	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cn4ncccc4n3)[C@H]2C1	1788017703	OILALBZYEQLHOL-VODUFIJXSA-N	440.331	1.559	50	20	IDGD	
O=C1Cc2cc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)C(Cl)Cl)C[C@@H]43)ccc2N1	1788263765	QWVWZKWSJSCNAF-WHOFXGATSA-N	426.300	1.578	50	20	IDGD	
O=C(NC1(c2ccc(NC(=O)c3cnccc3F)cc2)CCC1)c1ccc(B(O)O)cc1	1788354535	RVSPXYQPLNMINT-UHFFFAOYSA-N	433.248	1.962	50	20	IDGD	
CC(C)n1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Br)C[C@@H]32)n1	1789371692	NTAFKNDZDUHQIW-JURCDPSOSA-N	431.306	1.748	50	20	IDGD	
COc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]32)nn1C	1789402387	NLSQPULIGYMHBW-XBPIAWKYSA-N	433.336	1.258	50	20	IDGD	
Cc1nccn1CC(=O)NC1(c2ccc(NC(=O)c3cnccc3C(=O)NN)cc2)CCC1	1789521967	RGCMFYWQECEGTK-UHFFFAOYSA-N	447.499	1.638	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]3C2)nc1C	1789922024	BWKRVTNIATVTLG-SDADXPQNSA-N	428.302	1.982	50	20	IDGD	
O=C(Cc1ccncc1)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1	1790386372	TUMSNBAFXKLREB-UHFFFAOYSA-N	429.285	1.752	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc(OC)cc3C#N)C[C@@H]21	1791253757	IXFDDSNZUMNTFI-QLIIJSOBSA-N	449.935	1.343	50	20	IDGD	
CCOC(=O)c1c(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Cl)C3)c[nH]c1C	1793126558	JKBWLHNAZQVZCB-LTCOOKNTSA-N	443.903	1.556	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(C(=O)O)n(C(C)C)n1	1794432115	NAFAAKSYPXCVJR-UMPJEAMMSA-N	440.928	1.773	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](O)c1ccccc1	1795380390	KYMQCHYWLBKTCJ-QEOTZNIISA-N	425.323	1.483	50	20	IDGD	
Cc1c(F)ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Br)C3)c1N	1795702575	UDZKCOKFMBQIAM-OWLDWWDNSA-N	432.265	1.610	50	20	IDGD	
Cc1cc2cc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3ccc(B(O)O)cc3)ccc2[nH]1	1796189516	XJERCFKXMNSETC-WKCHPHFGSA-N	431.301	1.722	50	20	IDGD	
C[C@H](Nc1nccs1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@](C)(Cl)CCl)C2	1796414933	HCADKCMSWSAQIX-QHRNJGFCSA-N	435.377	1.769	50	20	IDGD	
C[C@H](NC(=O)c1cnccn1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@](C)(Cl)CCl)C2	1798551067	DLVJTJWGOWOQNU-NEXRYAKISA-N	442.347	1.469	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@]1(C)C[C@H]1C	1799165590	WPYCTHJDBHBBMP-JLXCYSRLSA-N	445.472	1.769	50	20	IDGD	
CN(C)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@](C)(Cl)CCl	1799276476	JKANGURDHTVRKM-UESRRSCYSA-N	429.348	1.587	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)n1ccnc1C)C2	1800644448	UKCIJJJHBUDLOY-NZBFACKJSA-N	427.343	1.516	50	20	IDGD	
COc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)Br)c(C)c1	1800760070	YURRNBIJUTUKQY-VWPFQQQWSA-N	425.323	1.990	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cc3ccccc3n1C)C2	1800971293	UUBOWYOLUKIFNX-HPNQWNLUSA-N	433.936	1.564	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnn(C(C)(C)C)c1Cl)C2	1800974406	VSAGDCUYYRDCEQ-NEBZKDRISA-N	447.363	1.749	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(Cl)cc3nn[nH]c13)C2	1800978390	CIVCKFPWIVTKCV-FJHTZYQYSA-N	442.303	1.068	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H]1C[C@H](O)CN1)C2	1801440368	SWCIJLJOYXJPFN-PXOJZXEFSA-N	430.455	1.233	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1CCN(C(=O)[C@H](C)n2ccnn2)[C@@H]1c1cccnc1	1803013832	AOALTCDYNDRERF-YQFWSFKMSA-N	449.353	1.971	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@H]1CCN(C(=O)CCn2ccnn2)[C@@H]1c1cccnc1	1803017638	MZCRHFBFBPTDQI-QGPMSJSTSA-N	449.353	1.800	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)C#CC2(O)CCCCC2)[C@H]1c1cccnc1)[C@H](O)CCl	1803142094	ABBHBXDPJPWARF-NSHGMRRFSA-N	433.936	1.386	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cnn3ccncc23)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803143237	XPPIUDYEENJUHH-JCGIZDLHSA-N	428.880	1.044	50	20	IDGD	
CCOC(=O)/C=C/C(=O)NC[C@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1	1806294058	LRBUSVFGOWGQBU-BYPNVWOASA-N	438.322	1.992	50	20	IDGD	
CN[C@H](CC(=O)NC[C@@H]1CCN(C(=O)[C@@](C)(Cl)CCl)[C@H]1c1cccnc1)C(=O)O	1807206267	SPJQXYTYZQIFIZ-MVWRLGRASA-N	445.347	1.386	50	20	IDGD	
CN1CCN(CCC(=O)N2CC[C@H](CNC(=O)[C@H](F)Cl)[C@H]2c2cccnc2)CC1	1808308128	ASNMKXOVDTULNK-QRQLOZEOSA-N	425.936	1.259	50	20	IDGD	
O=C(/C=C/c1cccnc1)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1	1809975037	PZCUBRIIXNSXAF-BQYQJAHWSA-N	433.317	1.320	50	20	IDGD	
O=C(/C=C/c1cccc(O)c1)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1	1809980189	KRTZHLRDIBEJNI-CMDGGOBGSA-N	448.328	1.630	50	20	IDGD	
Cc1ncoc1C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1	1810299925	VMWCWOHHEZHZNS-YJBOKZPZSA-N	449.471	1.010	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ncn(-c3ccccc3)n2)[nH]n1)[C@H](O)CCl	1814871567	SFBMLBURDABGHV-JKSUJKDBSA-N	443.895	1.896	50	20	IDGD	
CC(C)CNC(=O)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCBr)CC2	1817322944	HCMYNDYJHUJRBY-SNVBAGLBSA-N	431.356	1.612	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)CCc2ccccn2)[nH]n1)c1cccc(B(O)O)c1	1817474178	ORTNCTPCKZNCJK-FQEVSTJZSA-N	447.304	1.423	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCc2nc(N)n[nH]2)n[nH]1	1819286234	PALGJGYUVMUTCP-DIFFPNOSSA-N	443.339	1.971	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@H](O)CCl)CC3)o1	1819783470	XWCBNIUGDCGSQU-MWLCHTKSSA-N	426.882	1.520	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H]2CCNC(=O)C2)n[nH]1	1822483540	DKFNENWSDLRMHL-GMXVVIOVSA-N	426.315	1.711	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CNC(=O)N(C)C)CC1	1823877660	OPDNZELGYXCNKL-HOCLYGCPSA-N	445.402	1.908	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)Cn1cc(Cl)cn1)CC2	1825998335	FLGOWSLJHQYZKB-QWRGUYRKSA-N	432.333	1.859	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cn3ncccc3n1)CC2	1825999598	AJXUVRAJZRNREY-GHMZBOCLSA-N	434.909	1.665	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)CNC(=O)C(F)(F)F)sc2C1	1826144955	ZILIMYAPJZFWKX-HTQZYQBOSA-N	426.848	1.751	50	20	IDGD	
CN1CCCC[C@@H]1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827049629	YQGTYYCCBLDEST-FCHUYYIVSA-N	441.381	1.084	50	20	IDGD	
O=C(CCC(F)(F)F)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827051309	RJJMAQCDHDFRBT-GOSISDBHSA-N	440.271	1.942	50	20	IDGD	
CO[C@H](C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)CC1	1827679887	ZJMTUDFYKRQUPM-YLGWQQNMSA-N	431.537	1.775	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)C2CCOCC2)CC1	1828925990	WIEYQQXRZMLJPG-FQEVSTJZSA-N	443.548	1.345	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(F)ccc3C)CCO2)C1	1830079487	LXCVBLALSUQLON-PXNSSMCTSA-N	428.888	1.458	50	20	IDGD	
COCc1oncc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830357845	LULHOYMKRVPAAL-LJQANCHMSA-N	429.901	1.156	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4cncn4c3)C2)C1	1830362428	WXRLXYQAVMUCKH-OAQYLSRUSA-N	434.924	1.669	50	20	IDGD	
CC(=O)C(C)(C)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H](C)CBr)CCO2)C1	1830533304	JZVHSURJKPVVLM-UGSOOPFHSA-N	433.343	1.089	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4cccn4cn3)C2)C1	1831645581	CMJAJPZJLFFQEI-UWJYYQICSA-N	434.924	1.812	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H](N)Cc2cccnc2)CC1	1831831749	AOWSLVIONVNAHQ-SLFFLAALSA-N	436.984	1.825	50	20	IDGD	
Cc1ncccc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1	1831872038	LQMITBOBEVFMRW-FQEVSTJZSA-N	429.565	1.996	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)Cc3cc(F)cc(F)c3)CC2)CC1)[C@H](O)CCl	1833310663	NZPYBVPSTLPCQH-LJQANCHMSA-N	443.922	1.679	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)N(C)C(C)=O)CC2)CC1	1833533091	VSDCUUHKVQBDKK-DNVCBOLYSA-N	429.005	1.832	50	20	IDGD	
Cc1ccsc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)Br)C2)C1	1833948570	QSOCNDUYPQWUGT-GUYCJALGSA-N	431.352	1.910	50	20	IDGD	
Cc1ncsc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)Br)C2)C1	1834269452	ZNFBXIWTNWVRHS-BZNIZROVSA-N	432.340	1.305	50	20	IDGD	
O=C(C#Cc1ccccc1)N1CCO[C@@]2(COCCN(C(=O)CCBr)C2)C1	1835097169	TZIOYTOCIZBVOQ-HXUWFJFHSA-N	435.318	1.280	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](F)Cl)CC2)CC1)c1cccn(C(F)F)c1=O	1835857868	DCNFPDFPPFQZJY-HNNXBMFYSA-N	448.873	1.963	50	20	IDGD	
N[C@@H](CC(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1)c1cccnc1	1836716888	WKUPUXYIDKEGTO-RBUKOAKNSA-N	438.956	1.070	50	20	IDGD	
O=C(c1cccc2ccnn12)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836719503	UTOJJOIJJUIQFS-IBGZPJMESA-N	434.924	1.546	50	20	IDGD	
COc1ccccc1C(=O)N1CCOC[C@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1837715155	ZUIAQOFPORUOQZ-NRFANRHFSA-N	436.581	1.617	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)[C@@H]3CCC(=O)N3)CC2)CC1	1837738272	BVOLPSUGTMFJSW-HOTGVXAUSA-N	444.370	1.437	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3ccc(OC)cn3)CC2)CC1	1838176475	HKPIICYQCJMCHF-GOSISDBHSA-N	439.940	1.956	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(CC)n(C)n3)CCO2)C1	1838271661	RQMATTZPHNWLOY-JXFKEZNVSA-N	426.945	1.460	50	20	IDGD	
O=C(CCc1ccc[nH]1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839198974	GXTSHNUEPBUGCA-NVXWUHKLSA-N	432.290	1.094	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)c(F)c1	1839201550	ASEOLSQZMDZHTQ-CRAIPNDOSA-N	447.276	1.895	50	20	IDGD	
COc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)cc1	1839201823	KNFFOUBCESKWPW-MAUKXSAKSA-N	445.285	1.456	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)C#Cc3ccccc3)C2)C1	1840032068	MYPXMVKYMXUEPS-UZLBHIALSA-N	435.318	1.278	50	20	IDGD	
O=C(C(Cl)Cl)N1CCO[C@]2(COCCN(C(=O)[C@@]3(F)CCCC=C3F)C2)C1	1840190452	YHGWCKKGXMQSCT-IAGOWNOFSA-N	427.275	1.992	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)C3=COCCC3)CCO2)C1	1840213945	CJHHOZXCGPKTNZ-KDOFPFPSSA-N	431.327	1.168	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CCN3CCCC3)CCO2)C1	1840940953	NEHDWJWJRFRPFO-VQIMIIECSA-N	446.386	1.102	50	20	IDGD	
COc1ccc(C(=O)N2CCCC23CN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C3)cc1F	1841159467	SBAGDIZGSSSXQJ-AFUMVMLFSA-N	441.463	1.785	50	20	IDGD	
COc1ccc([C@H]2C[C@H]2C(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)cc1	1841573399	AFAIMWQREMAYKB-RTBURBONSA-N	449.511	1.314	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)C2CCC(CO)CC2)C1	1841905243	FLGZNZSFSXSQSD-BUVRLJJBSA-N	429.521	1.123	50	20	IDGD	
CC[C@@H](C)[C@@H](O)C(=O)N1CC2(CCCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C1	1841923997	LRFLAYDDQAWRIX-QLFBSQMISA-N	431.961	1.729	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](C(=O)N2CC3(CCCN3C(=O)[C@H](F)Cl)C2)[C@@H](O)C1	1843361670	HPTPKSHXVGGTJD-IHRRRGAJSA-N	433.908	1.342	50	20	IDGD	
COc1ccc(C(=O)N2CC3(CCCN3C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)s1	1843415457	JLTJLHNSEXTRMX-LPYMAVHISA-N	429.502	1.708	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1cccc3ccncc13)C2	1844265081	TTYKGIZNORDLSG-UHFFFAOYSA-N	430.468	1.364	50	20	IDGD	
N#Cc1cc(C(=O)N2CCCC23CN(C(=O)[C@@H](O)CCl)C3)ccc1Br	1845457803	JSEBSNXDBJKYGT-AWEZNQCLSA-N	426.698	1.737	50	20	IDGD	
O=C(c1cc(CO)on1)N1CC2(CCCN2C(=O)[C@@H](Br)Cc2ccccc2)C1	1845942024	GRKQCFYDJPBRCF-INIZCTEOSA-N	448.317	1.990	50	20	IDGD	
CC(C)[C@H](CNC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)[C@@H](O)CCl)C2	1846311027	ALUPOMANDOUWKQ-GJZGRUSLSA-N	431.961	1.586	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)CCc2ccc(S(=O)(=O)NC)cc2)cc1OC	12693226	WKDODYDGPHKCPA-UHFFFAOYSA-N	435.502	1.396	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)CCNS(=O)(=O)c1ccc(C)c(C)c1	15884602	UENNCXGRUVZGST-UHFFFAOYSA-N	435.502	1.207	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cc(Br)c[nH]2)cc(Cl)c1OCC(N)=O	21408741	XOZQKQHNQKLKHZ-UHFFFAOYSA-N	445.657	1.378	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccc(F)cc2)c2c1CCC2)c1ccc(-n2cnnn2)cc1	22193029	VIOULKXUQCJSGF-UHFFFAOYSA-N	432.419	1.551	50	20	IDGD	
C[C@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)NNC(=O)Cc2ccc(Cl)cc2)C1=O	27247047	PYRZCSCPPHTHFO-HXUWFJFHSA-N	432.839	1.636	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(C)c(C(=O)NNC(=O)c2ccc3c(c2)OCCO3)c1	105278380	PAGINBCSEVNGHO-UHFFFAOYSA-N	447.513	1.872	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)NC2CC2)cc1)NNC(=O)c1ccc2c(c1)OCCO2	105819845	XBRHIZPYBKFFHJ-UHFFFAOYSA-N	445.497	1.292	50	20	IDGD	
Cc1csc([C@@](O)(CC(=O)OCC(=O)NNC(=O)c2cccs2)C(F)(F)F)n1	725929451	JHPZRLPJGFMIJU-AWEZNQCLSA-N	437.421	1.657	50	20	IDGD	
C[C@@]1(c2ccc(CNC(=O)NNC(=O)Cc3cccc4ccccc34)cc2)NC(=O)NC1=O	726282778	SLLNLOYDLHNMIC-DEOSSOPVSA-N	445.479	1.968	50	20	IDGD	
O=C(CCNS(=O)(=O)c1cccnc1)NNC(=O)c1cc(F)ccc1Br	728549455	MLOPXWPWUXNCEO-UHFFFAOYSA-N	445.270	1.113	50	20	IDGD	
O=C(NNC(=S)NCCc1ccc2c(c1)OCCO2)C1CCN(c2ncccn2)CC1	728796895	LNTNABILRFSDSD-UHFFFAOYSA-N	442.545	1.202	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)F)cc1)c1ccc(S(=O)(=O)N2CCCC2)o1	728975123	FDYGKSLFGOKWBU-UHFFFAOYSA-N	449.457	1.817	50	20	IDGD	
O=C(CCNS(=O)(=O)c1cccs1)NNc1ccc(S(=O)(=O)C(F)F)cc1	728976623	YWHFAFVJZSYKLR-UHFFFAOYSA-N	439.487	1.556	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)c2ccc3c(c2)C(=O)NC3=O)c2ccccc2c1=O	729283984	OLOQYHWFTWNOQI-UHFFFAOYSA-N	447.451	1.545	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Cn2ccc3ccccc32)cc(Cl)c1OCC(N)=O	729450109	OSUZNSMWUCAVQN-UHFFFAOYSA-N	430.848	1.629	50	20	IDGD	
COc1cc(C)cc(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)c1O	730284376	KDEITEVIJFFYGZ-UHFFFAOYSA-N	434.518	1.402	50	20	IDGD	
O=C(CNC(=O)c1c(Cl)cccc1[N+](=O)[O-])NNC(=O)c1ccc2ccccc2n1	731051104	UPXZXALJFKBAIV-UHFFFAOYSA-N	427.804	1.987	50	20	IDGD	
CSCC[C@@H](C(=O)NNC(=O)Cc1ccccc1F)N1C(=O)[C@H]2CCCC[C@H]2C1=O	731329504	UKPABIISMHMHMC-UXLLHSPISA-N	435.521	1.813	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NC[C@@H]2CN3CCC[C@@H]3CO2)cc1Br	732246287	PLKMITCGRBKPPM-CHWSQXEVSA-N	427.299	1.265	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)N[C@@H]2CCN(c3ccccc3C(N)=O)C2)c1	732575710	HCEYIIWTNOJCJE-CQSZACIVSA-N	427.461	1.026	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN1S(=O)(=O)c1cccc([N+](=O)[O-])c1)NC1CCCCC1	732950033	PPBAGNIZBHKBOZ-MRXNPFEDSA-N	439.494	1.411	50	20	IDGD	
O=C(NCC1CCSCC1)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	733658432	XXBQNHNYXCRULV-UHFFFAOYSA-N	426.564	1.558	50	20	IDGD	
Cc1ccc(-n2cc(C(=O)NNC(=O)NC3CCN(C(=O)OC(C)(C)C)CC3)nn2)cc1	734824529	BLMAATAUSHXNJR-UHFFFAOYSA-N	443.508	1.919	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)Cc2c[nH]c3ccc(F)cc23)CC1	735118313	RLUSYASQVORWPL-UHFFFAOYSA-N	446.508	1.324	50	20	IDGD	
CN(CCCNC(=O)OC(C)(C)C)C(=O)NNC(=O)c1csc(N2CCOCC2)n1	736370242	JFKQWPPNLKKQCA-UHFFFAOYSA-N	442.542	1.181	50	20	IDGD	
COc1ccc(S(=O)(=O)NCCC(=O)NNc2ncccc2C(F)(F)F)cc1OC	740096949	WPSLZAGLLCXAQI-UHFFFAOYSA-N	448.423	1.929	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)c1ccc(S(=O)(=O)Cc2ccccc2)cc1	741186127	YVEQDKBUFBXJJD-UHFFFAOYSA-N	441.465	1.445	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=S)N[C@H]1CCOc2ccccc21	741475952	JXTOZJPJPIYESO-AWEZNQCLSA-N	433.559	1.921	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(C(=O)N2CCOCC2)cc1)c1cccc2ccccc12	741656463	WLIXMUXSSSYFAQ-UHFFFAOYSA-N	439.493	1.936	50	20	IDGD	
O=C(CN1C(=O)[C@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O)NNc1c(F)cc(F)cc1Br	742709016	UBQMPJQOEHRYQX-AAXDQBDMSA-N	430.205	1.333	50	20	IDGD	
Cn1c(=O)oc2cc(S(=O)(=O)NNC(=O)c3cccc(Br)c3)ccc21	743263589	HHZDGHSYVKSSJD-UHFFFAOYSA-N	426.248	1.517	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc(Br)ccc1F)c1cc([N+](=O)[O-])ccc1O	743268511	WAPACMGPYRAZQC-UHFFFAOYSA-N	434.199	1.825	50	20	IDGD	
CCO[C@@H](C)c1nc(CN2CCN(CC(=O)NNC(=O)c3ccccc3)CC2)cs1	744411604	QBBUJVWTFYZMNB-INIZCTEOSA-N	431.562	1.819	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)C2(c3ccc(F)cc3)CCOCC2)cc1	744857078	DDHWDHGGCKKBJR-UHFFFAOYSA-N	425.416	1.750	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)N[C@H]1CCc2c(O)cccc21	745865249	LEFRARUPPRKLFA-SFHVURJKSA-N	444.513	1.808	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)c1ccc([N+](=O)[O-])cc1I	747323038	XWUDDEJCVAZWKU-UHFFFAOYSA-N	426.170	1.598	50	20	IDGD	
O=C(NC1=S=C(C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)C=C1)Nc1ccccc1	747348865	UFLPWINJMKDFSK-UHFFFAOYSA-N	425.426	1.783	50	20	IDGD	
O=C(NNC(=O)[C@H]1CS[C@H](Cc2ccccc2F)C(=O)N1)c1cccc2cccnc12	747425305	FOXZKMVKRHHJSQ-QZTJIDSGSA-N	438.484	1.978	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1cccc(C(=O)NNc2nccn(C)c2=O)c1)c1ccccc1	747942231	OZNDDCLAASSKGH-CQSZACIVSA-N	427.486	1.577	50	20	IDGD	
O=C(NNc1cccc(Br)c1)c1ccc2c(c1)S(=O)(=O)N=C1N=CNN12	748019401	FGNRVSOVFLUIBA-UHFFFAOYSA-N	435.263	1.617	50	20	IDGD	
CS(=O)(=O)CC[C@H](NS(=O)(=O)c1ccccc1)C(=O)NNc1cccc(F)c1	748089852	WSSMUMMSVYHENM-INIZCTEOSA-N	429.495	1.051	50	20	IDGD	
O=C(CSc1nnnn1CC(F)(F)F)NNc1ccc(S(=O)(=O)C(F)F)cc1	748609500	DINVOJNRYJUJRX-UHFFFAOYSA-N	446.383	1.467	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cnc3ccccc3c2C)cc1	748690083	XVMGCBXPLZETHO-UHFFFAOYSA-N	426.498	1.933	50	20	IDGD	
O=C(CCn1cnc2sccc2c1=O)NNc1nc(Br)cn2ccnc12	750245970	GDAXXVCLHZNNDA-UHFFFAOYSA-N	434.279	1.797	50	20	IDGD	
O=C(NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1)N[C@H]1CC[C@H](O)CC1	753716961	UCFZMZMLWFLVDE-JOCQHMNTSA-N	438.531	1.796	50	20	IDGD	
CC(C)n1cnc(S(=O)(=O)NNC(=O)c2ccc(CSc3nncn3C)cc2)c1	753948957	HRUDYIOZRNMECN-UHFFFAOYSA-N	435.535	1.508	50	20	IDGD	
CCCC[C@H](NC(=O)[C@@H](C)NC(=O)C(C)(C)C)C(=O)NNC(=O)c1cccc(C#N)c1	755327151	PIVMRUTWWXCNNT-PBHICJAKSA-N	429.521	1.545	50	20	IDGD	
COC(=O)CNC(=O)Cc1ccc(NC(=O)NNC(=O)c2cccc3ncccc23)cc1	755863249	ABXIHIZDAXNLDH-UHFFFAOYSA-N	435.440	1.533	50	20	IDGD	
C[C@H]1C[C@@H](C)C[C@]2(C1)NC(=O)N(CC(=O)NNC(=O)[C@@H](C)Oc1ccccc1F)C2=O	756866544	DTYWZFWXQVIHIX-VJAMOUOBSA-N	434.468	1.487	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N2CCO[C@H]([C@H]3CCCO3)C2)cc1Br	756937542	YEOWSOOZLNYZAX-CABCVRRESA-N	428.283	1.692	50	20	IDGD	
C[C@H]1C[C@H](NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)CN1Cc1ccccc1	757773560	PIJHNSULYFWWBQ-YJBOKZPZSA-N	430.530	1.697	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2ccnc(OCC(F)F)c2)ccc1Cl	758076253	QKYUNFXCMYDDAC-UHFFFAOYSA-N	434.808	1.101	50	20	IDGD	
O=C(COC(=O)c1ccc(CS(=O)(=O)C(F)F)cc1)NNC(=O)c1cccs1	759380871	PPGZMDFFXCIVNY-UHFFFAOYSA-N	432.426	1.504	50	20	IDGD	
COc1cccc2c1CCC2=NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	759647020	UPQBFKJYKZYZKY-UHFFFAOYSA-N	429.498	1.796	50	20	IDGD	
CN(C)N(C(=O)c1cc(F)c(F)cc1I)[C@H]1CCS(=O)(=O)C1	760319430	ZCILBIGTNPPCLE-QMMMGPOBSA-N	444.241	1.675	50	20	IDGD	
C[C@H](CC(=O)NNC(=O)Cn1ccc2ccccc21)NS(=O)(=O)c1cccnc1Cl	760539849	GUFOANNODBCMQR-CYBMUJFWSA-N	449.920	1.594	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)Nc1ccc(CN2C(=O)CCCC2=O)cc1	760963426	SOOMLAMBLDQGLU-UHFFFAOYSA-N	440.456	1.966	50	20	IDGD	
O=C(NNC(=O)c1cc2n(n1)CCCO2)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	761446773	RUBQNOHNHCJBTR-UHFFFAOYSA-N	444.455	1.442	50	20	IDGD	
O=C(NNC(=O)c1ccccc1)C(=O)Nc1ccc2c(c1)CCN2C(=O)c1cccnc1	763423959	ZQRMJFKLPYRFEP-UHFFFAOYSA-N	429.436	1.684	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc3ccccc3cc2O)cc1-n1cnnn1	763525712	BNDRQBCDYCCELZ-UHFFFAOYSA-N	431.412	1.229	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(NC(C)=O)c(Cl)c2)cc1OC	763544297	VQZNWCQYELWQCW-UHFFFAOYSA-N	434.836	1.715	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C)cc2OCCN(C)C)cc1OC	763550245	BIFRMBSWISJSRZ-UHFFFAOYSA-N	444.488	1.352	50	20	IDGD	
CN(C)CCOc1cccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)c1	763602178	VNSFCAVSIKZEBT-UHFFFAOYSA-N	436.472	1.417	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cc(NC(C)=O)ccc2Cl)cc1	763659050	HUKNVCVOTHPCPS-UHFFFAOYSA-N	434.836	1.472	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2ccnn2Cc2ccccc2F)c1	763665352	GGLVDQFEOHEJAF-UHFFFAOYSA-N	439.447	1.852	50	20	IDGD	
COC(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)c1	763683872	BVYZVJYEOIHMTQ-UHFFFAOYSA-N	440.239	1.945	50	20	IDGD	
CCN(CC)Cc1cccc(NC(=O)C(=O)NNC(=O)c2cc(OC)cc(OC)c2)c1	763772967	RKVURLRGTKUHTH-UHFFFAOYSA-N	428.489	1.945	50	20	IDGD	
CCOC(=O)/C=C/c1ccc(NC(=O)C(=O)NNC(=O)c2cc(OC)cc(OC)c2)cc1	763775445	RCHRWBAGHMAIQA-JXMROGBWSA-N	441.440	1.680	50	20	IDGD	
COc1ccc(OC(C)C)c(NC(=O)C(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])c1	763804434	SFFNBUFJNJQKCJ-UHFFFAOYSA-N	446.416	1.556	50	20	IDGD	
C[C@@H](CC(=O)c1cccc(Br)c1)C(=O)NNC(=O)CNC(=O)c1cccnc1	763821773	XCIILAJAUHPVQD-LBPRGKRZSA-N	447.289	1.630	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(C(=O)N3CCSCC3)c2)cc1	763832382	PSGBKYIHIJHSDN-UHFFFAOYSA-N	440.525	1.838	50	20	IDGD	
CCN1CCN(c2ccc(NC(=O)C(=O)NNC(=O)Cc3c[nH]c4ccccc34)cc2)CC1	763862006	YSRSLQVTBZLEMW-UHFFFAOYSA-N	448.527	1.638	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1cc(C(F)(F)F)cnc1O	763866630	XEXLPTVPNIFDQY-MRVPVSSYSA-N	430.314	1.499	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCCCC2)cc1NC(=O)C(=O)NNC(=O)CC(C)C	763887835	CEZKRGXDSVKTSU-UHFFFAOYSA-N	440.522	1.002	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)C(=O)Nc1cccc(N2CCCC2=O)c1	763943954	HJDHWRYQYTYOCC-UHFFFAOYSA-N	448.439	1.104	50	20	IDGD	
CNC(=O)c1ccc(OC)c(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CC[C@@H](C)C3)c1	763951197	ZWEXXFUSUYOXBL-LLVKDONJSA-N	444.513	1.641	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cccc(CN(C)C(=O)OC(C)(C)C)c2)n[nH]1	764097129	AFOPTHJEXQYNNA-UHFFFAOYSA-N	430.465	1.485	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccccc1OC[C@@H]1CCCCO1	764130456	IFXNXHUMFWMRCB-KRWDZBQOSA-N	441.484	1.972	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(CNC(C)=O)cc2)o1	764139704	ZITWSDAXDFFRRB-UHFFFAOYSA-N	429.477	1.157	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)C(=O)Nc2cc(N3CCCC3=O)ccc2Cl)c1	764230623	CPAGETOWCUPFEW-UHFFFAOYSA-N	425.832	1.738	50	20	IDGD	
CCN(CC)CCn1ccc2cc(NC(=O)C(=O)NNC(=O)Cc3ccccn3)ccc21	764266592	GPDQAKSGSINUQZ-UHFFFAOYSA-N	436.516	1.707	50	20	IDGD	
CN(C)c1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	764266994	POBCASMDZFJUON-UHFFFAOYSA-N	445.911	1.199	50	20	IDGD	
O=C(CCCc1cccs1)NNC(=O)C(=O)Nc1cc2c(cc1[N+](=O)[O-])OCCCO2	764340598	FKKWHEVHGHSCMS-UHFFFAOYSA-N	448.457	1.926	50	20	IDGD	
COCCCOc1ccccc1NC(=O)C(=O)NNC(=O)c1cnn(-c2ccccc2)c1	764342778	JPGCWQSRAQYLAW-UHFFFAOYSA-N	437.456	1.687	50	20	IDGD	
CO[C@@H](C)C(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)c1	764348991	BLKZKIUJPXPBLS-JTQLQIEISA-N	434.836	1.419	50	20	IDGD	
CC(C)(C)NC(=O)c1ccccc1NC(=O)C(=O)NNC(=O)c1ccc(O)c(Cl)c1	764349881	TXJFDZISQNOYFT-UHFFFAOYSA-N	432.864	1.974	50	20	IDGD	
COC(=O)c1cccc(C#Cc2cccc(NC(=O)C(=O)NNC(=O)c3cnn(C)c3)c2)c1	764357850	CKHWKXFNPNYQMZ-UHFFFAOYSA-N	445.435	1.006	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNC(=O)COCc2ccccc2)ccc1Cl	764362244	BYZMFYJLCOXOER-UHFFFAOYSA-N	433.848	1.819	50	20	IDGD	
O=C(NNC(=O)C(F)(F)Oc1ccccc1)C(=O)Nc1ccc(-c2csnn2)cc1	764378723	MRXTZMQTJNVVON-UHFFFAOYSA-N	433.396	1.963	50	20	IDGD	
COc1c(F)cc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)cc1F	764389119	ZKRHXZUIMAUQBI-UHFFFAOYSA-N	433.346	1.902	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2cccs2)[nH]n1)Nc1cccc(N2C(=O)CNC2=O)c1	765306325	AXXMFWWJOOFPSF-UHFFFAOYSA-N	425.430	1.661	50	20	IDGD	
COCCOc1ccc(NC(=O)NNC(=O)c2cc(-c3ccccc3OC)[nH]n2)cn1	765308855	CKUVPZWKJCOXSD-UHFFFAOYSA-N	426.433	1.972	50	20	IDGD	
CC(C)(C)OC(=O)N[C@]1(C)CCCC[C@H]1C(=O)NNC(=O)CNC(=O)c1cccnc1	766229966	ZCFMQKKVRJZNIY-YCRPNKLZSA-N	433.509	1.432	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)CN1CCN(Cc2noc(C(C)(C)C)n2)CC1	766894030	HUYUYOVUZCGRRO-UHFFFAOYSA-N	428.537	1.183	50	20	IDGD	
COc1ccc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1Cl	767216965	TUWVTDRPHAXOHD-UHFFFAOYSA-N	440.909	1.743	50	20	IDGD	
COc1ccccc1[C@@]1(C)NC(=O)N(CC(=O)NNc2cc(C#N)cc(Cl)n2)C1=O	768711794	USUICGYOGVNFCY-LJQANCHMSA-N	428.836	1.526	50	20	IDGD	
O=C(NNC(=O)c1ncccc1C(F)(F)F)c1cccc(S(=O)(=O)N2CCCC2)c1	770571992	ZKERUNNMSMESTP-UHFFFAOYSA-N	442.419	1.960	50	20	IDGD	
C[C@H](NS(=O)(=O)c1cccc(C(F)(F)F)c1)C(=O)NNC(=O)Cc1cccnc1	770952166	KXYAKOVYHONDIK-NSHDSACASA-N	430.408	1.157	50	20	IDGD	
C[C@@H]1CCCCN1S(=O)(=O)c1cccc(C(=O)NNc2nc(O)c3cnn(C)c3n2)c1	770973759	HKFFGQGKUWFFFE-GFCCVEGCSA-N	445.505	1.389	50	20	IDGD	
C[C@H]1CN(C(=O)NNC(=O)Cn2ccc3ccccc32)CCN1c1nccn2cnnc12	771217168	XVXUSKIPACRDKF-HNNXBMFYSA-N	433.476	1.031	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)c1cc(O)nc(C2CC2)c1	771414899	AASUXJOFZCMCNJ-UHFFFAOYSA-N	443.935	1.897	50	20	IDGD	
COC(=O)c1ccc(S(=O)(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)cc1C	771606288	HDQAPQYQFNGINW-UHFFFAOYSA-N	439.877	1.061	50	20	IDGD	
COc1ccc(/C=C/C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1O	771845517	MIMSOYVCSCHBOF-CSKARUKUSA-N	445.497	1.660	50	20	IDGD	
CCCCN1C(=O)c2ccccc2N2C(=O)CC[C@]12C(=O)O[C@@H](C)C(=O)NNC(=O)CC	771965994	MEPJLRFNCBMRDB-FPTDNZKUSA-N	444.488	1.255	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)[C@@]1(F)CCN(C(=O)OCc2ccccc2)C1	772241648	RMGLBNQWLDCLKP-QVKFZJNVSA-N	437.468	1.862	50	20	IDGD	
C[C@@H](C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1)c1cn(C)c2ccccc12	772845315	RTDBSHDPKODBJO-VLIAUNLRSA-N	437.452	1.812	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cn(C)nc1C(F)(F)F	773524373	HWNLFWAMQCREAO-UHFFFAOYSA-N	429.355	1.003	50	20	IDGD	
COCc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(Br)cc2)cc1	773525705	PJBLSJJWOIIEFV-UHFFFAOYSA-N	436.262	1.760	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2O1)C(=O)Nc1cccc(-c2ncc3n2CCCC3)c1	773540084	HXUQORSIXIWSKD-FQEVSTJZSA-N	445.479	1.976	50	20	IDGD	
O=C(NNc1cccc(C(F)(F)F)c1)C(=O)Nc1cccc(CN2C(=O)CNC2=O)c1	773762163	KZVRFTFNIRISPJ-UHFFFAOYSA-N	435.362	1.839	50	20	IDGD	
C[C@@H](NCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)c1ccc(N2CCOCC2)cc1	775259910	LOLYDFXPTNCSQG-OAHLLOKOSA-N	427.461	1.543	50	20	IDGD	
C[C@H](CN(C)Cc1ccccc1)NC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	775775660	ZHOGPPARRQBXMC-OAHLLOKOSA-N	433.534	1.946	50	20	IDGD	
COc1ccc(C(=O)NNc2nc(-c3ccccn3)nc3c2CCC3)cc1-n1cnnn1	776160852	SDVONQFVPHRJFP-UHFFFAOYSA-N	429.444	1.769	50	20	IDGD	
CC#CCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccc(OC)cc2)c1	776205042	KCLGZZIJLZXCOD-UHFFFAOYSA-N	430.486	1.853	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)N[C@@H]2CC(=O)N([C@H]3C[C@H]3c3ccccc3)C2)c1	776623747	PIQTWBDJGGHTEY-NEWSRXKRSA-N	428.514	1.873	50	20	IDGD	
CCc1nc(-c2ccc(C(=O)N3CCN(S(=O)(=O)CBr)CC3)cc2)n[nH]1	777832149	KFXFHIYUQKLVRH-UHFFFAOYSA-N	442.339	1.474	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)[C@H]2CCCN2C(=O)c2ccc3c(c2)OCO3)nc1C	778424662	ZFJUYFYOIOSFDB-OAHLLOKOSA-N	441.444	1.438	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)N[C@@H]1CCC[C@@H]1CCO	779710380	FPJCSLSANBDCFX-CRAIPNDOSA-N	438.550	1.356	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N[C@@H](CO)C1CCOCC1	782494578	WBJDOWLSQAMFSB-NHYWBVRUSA-N	430.299	1.334	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)NCc2cccc(S(=O)(=O)N(C)C)c2)cc1	782534869	GXSGLDRLYPOYTF-UHFFFAOYSA-N	434.518	1.409	50	20	IDGD	
CCCCOc1ccccc1NC(=O)C(=O)NNC(=O)c1csc(N2CCOCC2)n1	782896249	DBTFIZVKOYZZHG-UHFFFAOYSA-N	447.517	1.558	50	20	IDGD	
O=C(NNc1ccc(Cl)cc1)C(=O)Nc1cc(C2CC2)nn1[C@@H]1CCS(=O)(=O)C1	783340398	SMFFGNZQGHVKRD-CQSZACIVSA-N	437.909	1.855	50	20	IDGD	
CNS(=O)(=O)c1cccc(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2Cl)c1C	784393908	XZTYQJWAPXOZLU-UHFFFAOYSA-N	441.853	1.547	50	20	IDGD	
NS(=O)(=O)c1cccc(NC(=O)C(=O)NNc2nc(-c3ccc(Cl)cc3)no2)c1	784800235	XKYGATVCZOGYRA-UHFFFAOYSA-N	436.837	1.119	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2cccc(S(=O)(=O)N(C)C)c2)cc1Cl	785116308	FYOSNIVTVLLGDH-UHFFFAOYSA-N	426.882	1.681	50	20	IDGD	
COc1cc(F)cc(NNC(=O)C(=O)Nc2ccc(N3CCNC(=O)C3)c(Cl)c2)c1	785235340	XGPSZRKQALZZSL-UHFFFAOYSA-N	435.843	1.506	50	20	IDGD	
CN(NC(=O)Nc1cc(C(N)=O)ccc1F)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	785838386	KMMDMENMIHMGCR-UHFFFAOYSA-N	438.460	1.566	50	20	IDGD	
COC(=O)CCc1cccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)c1	786414153	KDVDMEKUJGMNKR-CYBMUJFWSA-N	431.420	1.485	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)cc1N1CCNC1=O	787544075	OGUZTJVFONJWSV-CYBMUJFWSA-N	443.435	1.217	50	20	IDGD	
O=C(NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12)NOC[C@@H]1CCOC1	788323266	DBYXJTVWZRJCHM-MRXNPFEDSA-N	437.456	1.357	50	20	IDGD	
COC(=O)c1sc(S(=O)(=O)NNC(=O)CNC(=O)OC(C)(C)C)c(C)c1Cl	788492629	JXQDLZYPNJCNDQ-UHFFFAOYSA-N	441.915	1.331	50	20	IDGD	
Cc1noc(-c2ccc(C(F)(F)F)cc2NC(=O)C(=O)NNC(=O)Cc2ccncc2)n1	789734270	ISLCCMBUANAAPB-UHFFFAOYSA-N	448.361	1.787	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)cc1S(C)(=O)=O	789811120	USMONEMNBAVKNE-WMZOPIPTSA-N	445.497	1.057	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)NNC(=O)COc2ccccc2OC)c1C	790007416	SAQRHQRWZXJPNJ-PDGQHHTCSA-N	426.473	1.893	50	20	IDGD	
COc1cc(NNC(=O)c2cc(S(=O)(=O)N3CCOCC3)cn2C)ccc1Cl	790181734	XHFNEFNFOHZHNC-UHFFFAOYSA-N	428.898	1.465	50	20	IDGD	
Cc1c(C(=O)NNC(=O)CCN2C[C@H](C)O[C@@H](C)C2)nnn1Cc1ccc(F)cc1F	792207646	DSVMJTPORZFYLI-STQMWFEESA-N	436.463	1.173	50	20	IDGD	
CCS(=O)(=O)c1ccc(CNC(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)s1	792221648	DCJDHGHBAQHYLW-UHFFFAOYSA-N	438.531	1.628	50	20	IDGD	
CC(C)Oc1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)nn1	793024195	COVNZEAJHCXDGJ-UHFFFAOYSA-N	427.396	1.193	50	20	IDGD	
COc1c(NC(=O)C(=O)NNC(=O)CCCc2cccs2)cc(Cl)cc1C(N)=O	793026193	PYHUVHJEDCPWGO-UHFFFAOYSA-N	438.893	1.618	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)NNC(=O)c2cccc(C)n2)cc(OCC)c1OCC	793229389	YSICWBMXZWAUPR-UHFFFAOYSA-N	445.476	1.875	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccccc1S(=O)(=O)C(F)F)c1cccc([N+](=O)[O-])c1	794577274	SQQCBWRYXUCGDI-UHFFFAOYSA-N	435.386	1.214	50	20	IDGD	
CC(=NNC(=O)C(=O)NN=C(C)c1ccc2nc(O)oc2c1)c1ccc2nc(O)oc2c1	794862515	RKRVLWAXCZWZBU-UHFFFAOYSA-N	436.384	1.761	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(-c3noc(C(F)(F)F)n3)cc2)n1	797371009	XIOLZNJHDJCBSF-UHFFFAOYSA-N	434.334	1.859	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@H]2C[C@H](c3ccccc3)C2)cc1	798117256	WGBDRHDTILSLQS-IYARVYRRSA-N	430.530	1.892	50	20	IDGD	
NS(=O)(=O)c1ccc(F)c(C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)c1	798335611	PIPINHFNRRTEDR-UHFFFAOYSA-N	428.392	1.400	50	20	IDGD	
O=C(NNC(=O)c1ccccc1)C(=O)Nc1cnc(N2CCOCC2)c(Br)c1	799257224	BMCWXEFZIJFKBF-UHFFFAOYSA-N	448.277	1.080	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)[C@@H](NC(N)=O)C(C)(C)C)c2ccccc2c1=O	800316080	QPFKIFYHLUGMPZ-MRXNPFEDSA-N	430.509	1.431	50	20	IDGD	
NS(=O)(=O)Cc1cccc(C(=O)NNc2cc([N+](=O)[O-])ccc2Br)c1	800617252	BGYLVXYPANAODY-UHFFFAOYSA-N	429.252	1.903	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)[C@@H](C)NS(=O)(=O)c2c(C)nn(C)c2C)c(Cl)c1	802047378	CGCCLHWUDSMMJE-LLVKDONJSA-N	442.929	1.518	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)NC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1	802336131	WITHVKQXKHDDTN-KRWDZBQOSA-N	434.456	1.335	50	20	IDGD	
CC(C)CSc1ccc(S(=O)(=O)NCC(=O)NNc2ncccn2)cc1[N+](=O)[O-]	802462629	YLIPOKFIWFPFTM-UHFFFAOYSA-N	440.507	1.555	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)N[C@@H]2CCCN(C(=O)Cc3ccccc3)C2)cc1	802474622	NQZVDEUOBZBGON-GOSISDBHSA-N	440.500	1.638	50	20	IDGD	
O=C(COC(=O)c1ccc(C(F)(F)F)s1)NNC(=O)[C@H]1COc2ccccc2O1	803864073	NGHHLDRJDHGYIG-LLVKDONJSA-N	430.360	1.911	50	20	IDGD	
COc1cccc(C2(C(=O)NNc3ncccc3S(=O)(=O)N3CCN(C)CC3)CC2)c1	806872415	JCWDUZGMQWMDLW-UHFFFAOYSA-N	445.545	1.201	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)C1(c2cc(F)cc(Br)c2)CC1	807082443	QHHDPGMMJUEXLW-UHFFFAOYSA-N	435.253	1.592	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)N[C@H]1CCCN(C(=O)N2CCCC2)C1	807457454	DQZCGCGWWDXEBI-HNNXBMFYSA-N	435.550	1.798	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)NC1C[C@@H]2CC[C@H](C1)N2CC(=O)N(C)C	807514687	MWQKGCCVUJHUEZ-AYHJJNSGSA-N	431.537	1.042	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cncc(C(F)(F)F)c2)cc1OC	808617132	FJEKITAQOBQKSG-UHFFFAOYSA-N	427.335	1.736	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)CCc2ccc(OC)cc2)cc2[nH]ccc12	808934739	SVGOSXMYDWITTD-UHFFFAOYSA-N	438.440	1.682	50	20	IDGD	
Cc1c(Cl)c(C(F)(F)F)nn1CC(=O)NNC(=O)CCN1C[C@H](C)O[C@@H](C)C1	809981446	LEGKMHYKPPNRPX-UWVGGRQHSA-N	425.839	1.510	50	20	IDGD	
C[C@H]1C[C@H](NC(=O)NNC(=O)COc2ccccc2O)c2ccsc2S1(=O)=O	812650280	TYDYXCCSUHAFCH-JQWIXIFHSA-N	425.488	1.470	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)CNC(=O)c2ccccc2OC(F)F)cc1	812731629	OQOWYCFDJVIBFR-UHFFFAOYSA-N	442.444	1.411	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)[C@H]1OCCc2sccc21	813870264	UMRNCVLSADXHLD-CXAGYDPISA-N	430.534	1.787	50	20	IDGD	
Cc1cc(OCc2ccc(C(=O)NNC(=O)C3=C[C@@H](O)[C@@H](O)[C@H](O)C3)cc2)ccc1Cl	816815548	XVIQJXNNLGBQSX-VAMGGRTRSA-N	446.887	1.401	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)cc2nc(O)[nH]c12)c1ccc2c(c1)OCCO2	816831571	YFDVHKZVMATGPN-UHFFFAOYSA-N	433.218	1.877	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)CN2C(=O)N[C@@](C)(c3ccc(F)cc3)C2=O)c2ccccc2n1	818516030	MASWPOCGARIKEI-QHCPKHFHSA-N	449.442	1.911	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)[C@H]2CC(=O)N(Cc3ccccc3Cl)C2)c1	849366693	XVMXPAYKOYSVDK-HNNXBMFYSA-N	430.892	1.957	50	20	IDGD	
Cc1ccc(S(=O)(=O)Nc2ccc(C(=O)N3CC[C@@H](B(O)O)C3)cc2)cc1[N+](=O)[O-]	864234771	VSDGZPYHYCHMHB-CQSZACIVSA-N	433.251	1.393	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](NC(=O)NCc2ccccc2)C(C)C)cc1C	896035756	BDMYTEZVSWQZEV-IBGZPJMESA-N	439.516	1.913	50	20	IDGD	
COc1ccccc1NC(=S)NNC(=O)CN1C(=O)c2cccc([N+](=O)[O-])c2C1=O	913441326	YCSHJDNMSRUMKI-UHFFFAOYSA-N	429.414	1.217	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc(Cl)c1O	913465280	PUUVXYLEIIEYHA-UHFFFAOYSA-N	441.893	1.769	50	20	IDGD	
Cc1cc(O)c(C(=O)O)cc1S(=O)(=O)NNC(=O)c1ccc(Br)s1	914688874	IMKCVVWOPYQONW-UHFFFAOYSA-N	435.277	1.846	50	20	IDGD	
O=C(O)COc1ccc(S(=O)(=O)NNC(=O)c2ccc(COc3ccccc3)o2)cc1	915045025	PZEIZOVLECLQLD-UHFFFAOYSA-N	446.437	1.945	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)c1ccc(S(=O)(=O)NC(C)(C)C)o1	915269935	GQVKEGVBUYKXAA-UHFFFAOYSA-N	425.463	1.205	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)NCc2ccc(NS(C)(=O)=O)cc2)cc1OC	916380380	CGZSQPHCTJSTCA-UHFFFAOYSA-N	436.490	1.610	50	20	IDGD	
O=C(NCCCN1CCN(c2ccccc2)CC1)NNC(=O)c1cccc([N+](=O)[O-])c1	916490090	VXPCCIBFDWHDKN-UHFFFAOYSA-N	426.477	1.751	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)c2ccc(OC)c(OC)c2)sc(C)c1C	916563077	TTZHKVHHLVOYAC-UHFFFAOYSA-N	449.485	1.959	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)NNC(=O)c2cc(-c3ccc(C)cc3)[nH]n2)ccc1OC	917178051	GYKUGYICMQFKGV-UHFFFAOYSA-N	443.485	1.377	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(\C#N)C(=O)OCC(=O)N2CCC[C@@H](NC(C)=O)C2)c1C	918818769	YVJCMGKINFELPJ-GIEBZNKFSA-N	444.532	1.890	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)NCCN2C(=O)c3ccccc3C2=O)cc1OC	919788200	FPKZZPSYAIUJQZ-UHFFFAOYSA-N	426.429	1.334	50	20	IDGD	
COc1cc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)ccc1C	919791560	ZGKFKYGCTFPMGS-UHFFFAOYSA-N	446.529	1.932	50	20	IDGD	
CCCS(=O)(=O)N1CCCC[C@@H]1C(=O)NNC(=S)Nc1ccc(OCC)cc1	919811543	YLNXDEGKMIDBHY-MRXNPFEDSA-N	428.580	1.997	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCc2ccccc2-n2ccnc2)c2ccccc2c1=O	919920656	ITQGPRSDTVQAAN-UHFFFAOYSA-N	431.456	1.746	50	20	IDGD	
COc1ccnc(NNC(=O)c2ccccc2NS(=O)(=O)c2cccc([N+](=O)[O-])c2)n1	920453805	HWNHHSGXTSQCFC-UHFFFAOYSA-N	444.429	1.951	50	20	IDGD	
CN1CCN(c2ccccc2CNC(=O)NNC(=O)c2cncn2-c2ccccc2)CC1	1115986440	ZAHYPHPFEYTLOD-UHFFFAOYSA-N	433.516	1.768	50	20	IDGD	
O=C(Cn1nc2n(c1=O)CCCCC2)NNc1cc(C(F)(F)F)nc(-c2ccccn2)n1	1116074522	JAXCLZYRHOVJSR-UHFFFAOYSA-N	448.409	1.785	50	20	IDGD	
Cn1nc(Br)c2c(=O)n(CC(=O)NNc3ccc(C(C)(C)C)nn3)cnc21	1251942757	BCLQIWKSMDUDBE-UHFFFAOYSA-N	435.286	1.123	50	20	IDGD	
Cc1ccc(NC(=S)NNC(=O)c2ccc(S(=O)(=O)N(C)CCO)cc2)cc1C	1261892805	YMRUKTCMRRUGNG-UHFFFAOYSA-N	436.559	1.548	50	20	IDGD	
Cc1nccn1-c1ncccc1CNC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	1318055478	ALJQIGGAUKXPSO-UHFFFAOYSA-N	428.474	1.123	50	20	IDGD	
O=C(Cn1nc2n(c1=O)CCCCC2)NNC(=O)c1ccc(F)cc1Br	1323790757	UPNSMFACBKDFMB-UHFFFAOYSA-N	426.246	1.134	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)c1cc2c(c(S(N)(=O)=O)c1)CCC2	1324557213	BIVZHFUHKNEXBB-UHFFFAOYSA-N	435.527	1.385	50	20	IDGD	
COC(=O)C(=O)NN=Cc1cc(I)c(Br)cc1F	1344547722	CRQMYNIGCIQMCW-UHFFFAOYSA-N	428.983	1.816	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)COC(=O)C(F)(F)F)C1	1779278863	CNZRMOHBSFAJGC-XHBSWPGZSA-N	428.835	1.623	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(-c4ccccn4)[nH]n3)C2)C1	1779632294	ZOKRKRIWSIBGHW-YJYMSZOUSA-N	448.321	1.699	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnc(O)[nH]3)C2)C1	1779645398	NQENDUITPBBQFU-NPZXAABXSA-N	443.410	1.444	50	20	IDGD	
COc1nc(C)ccc1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](C)Br)CCO2	1779743598	OSDZONDZEHDYEA-UGSOOPFHSA-N	426.311	1.626	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@@]3(CN(C(=O)CCBr)CCO3)C2)nn1C(F)F	1780301150	BRFVUENZZKKKEX-MRXNPFEDSA-N	435.269	1.815	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccn(-c4ccccc4)n3)C2)C1	1780344386	VDRUGAQKWPURTG-UTKZUKDTSA-N	432.908	1.570	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3nn(C)c(C)c3Br)C2)C1	1780368305	IOARMIISXGUNPQ-SJCJKPOMSA-N	447.761	1.952	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3nccc(OC)c3OC)C2)C1	1780444858	GQGWEPWUXOZEMF-VBKZILBWSA-N	425.913	1.950	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCN1CCCC1)C2)[C@H](F)Br	1780778532	LPKIHCMDAZMWLH-UWWQBHOKSA-N	434.350	1.677	50	20	IDGD	
O=C(COc1ccccc1F)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781335225	WKQJXYJVYYJMEX-DOTOQJQBSA-N	433.249	1.725	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CNC(=O)OC(C)(C)C)C2	1782178570	ASCPZNQAZALIKD-STXHMFSFSA-N	447.960	1.279	50	20	IDGD	
C[C@H](Cn1ccnc1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CO[Si](C)(C)C)C2	1782545709	RXOAGMGQVDACEB-DBXWQHBBSA-N	436.629	1.885	50	20	IDGD	
COC(=O)C12CC(C(=O)N3CC[C@]4(C3)CN(C(=O)[C@@](C)(Cl)CCl)CCO4)(C1)C2	1783444911	KIPWJYSKTYSNSU-RGVPCPSESA-N	433.332	1.396	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)CSc3ccncc3)CCO2)C1	1783529528	LPMGLEVVIFQMLZ-DYVFJYSZSA-N	428.352	1.787	50	20	IDGD	
O=C1CCc2ccc(C(=O)N3CCO[C@@]4(CCN(C(=O)C(Cl)Cl)C4)C3)cc2N1	1783949886	NUKSMFWLXYIVSO-LJQANCHMSA-N	426.300	1.819	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc4ccccc4c3)C[C@@H]21)[C@@H](O)CCl	1784086126	GFIBLSLZOHOFHF-TUFLPTIASA-N	430.932	1.962	50	20	IDGD	
CCn1nc(C(C)C)cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]2C1	1784092473	IPYNJDMGBSPNDR-ZZCKCESHSA-N	426.945	1.219	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)c1cccc2nc[nH]c12	1787298405	WGAYDMVZDXZZRC-ZAJUMQRFSA-N	439.285	1.847	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4nn(C)cc4c3)[C@H]2C1	1790354238	SOKAQGCRJSVPLL-XPYUAMARSA-N	434.924	1.420	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnn4cccc(C)c34)C[C@@H]21	1791257255	USBPFWHCXFJYFE-OWLYRPNTSA-N	434.924	1.490	50	20	IDGD	
COc1cc(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](O)CCl)ccc1[N+](=O)[O-]	1793115366	LHHWJBYFCUQURR-FQLMCAECSA-N	425.869	1.384	50	20	IDGD	
CCOCCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1793882648	QYECBICKLABADG-IVSAIRAKSA-N	447.960	1.135	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1CCOCC1	1795882997	JZQGPARCDJMXNZ-ZCZGSMFASA-N	444.482	1.842	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1noc2c1CCCC2	1796154657	DNJDTNILWZBQKK-FJHTZYQYSA-N	430.274	1.447	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)C(=O)c1ccc(Cl)cc1	1796187845	HINJLPZCWFCZBD-REPLKXPHSA-N	440.692	1.155	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1=NN(c2ccccc2)C(=O)C1	1796480530	MBMUYTZDEXOMQW-MQJTVSLUSA-N	446.935	1.776	50	20	IDGD	
COc1ccc(F)cc1CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CO[Si](C)(C)C	1797956431	CWEKCFVDDJHYIQ-VPTLXERWSA-N	438.572	1.818	50	20	IDGD	
CCOC(=O)c1cccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Cl)C3)c1F	1798533446	YEDOPGCNHFPSTK-OJXGSEEGSA-N	430.835	1.740	50	20	IDGD	
CCSc1cccnc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc(B(O)O)c1)C2	1799510458	MTTMJVYNEYCICS-BCDXTJNWSA-N	439.346	1.439	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1ccc(C#N)cc1)C2	1800754230	KAELDQUWBVAEHS-UEILYKACSA-N	434.334	1.864	50	20	IDGD	
C#CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(Cl)Cl	1801021576	XLWREAADHBQCEZ-XJFOESAGSA-N	448.347	1.296	50	20	IDGD	
CCOC(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)OCC	1801149704	WRIHKSURPVRCHB-BAESOJJISA-N	425.295	1.056	50	20	IDGD	
COc1cc(F)ccc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)Br)C2	1801647983	UYECJUHVPZBBDP-OVZMXSCWSA-N	429.286	1.821	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CCCO1	1801920353	UDOPKOLNPZQUBM-YGTYGHESSA-N	431.445	1.951	50	20	IDGD	
CSc1ccc(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)cc1	1802648740	YVWMXGKOLWGXEU-ACDBMABISA-N	438.358	1.583	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cc3cnccc3[nH]2)[C@H]1c1cccnc1)[C@@H](O)CCl	1803143253	XVTNNUWBVCTBQR-JVPBZIDWSA-N	427.892	1.877	50	20	IDGD	
C[C@H](Cc1ccccn1)C(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]1c1cccnc1	1803146255	MMFQHLVMDMJUNK-RARDXLECSA-N	430.936	1.961	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)c2ncnn2C)[C@@H]1c1cccnc1	1805281129	GKMMFVFILTUBHV-KKUMJFAQSA-N	435.326	1.703	50	20	IDGD	
Cc1ccnc(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)c1	1807362588	MFXXBXYWEZXJLB-KNQAVFIVSA-N	444.300	1.098	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)[C@H](C)N2CCN(C)CC2)[C@@H]1c1cccnc1	1808273588	DKFBCSYVUCFNNY-OJAHFUOMSA-N	436.000	1.741	50	20	IDGD	
Cc1noc(CC(=O)N2CC[C@H](CNC(=O)[C@H](F)Br)[C@@H]2c2cccnc2)n1	1808661372	KAMPMMCXRUNADH-KCXAZCMYSA-N	440.273	1.712	50	20	IDGD	
O=C(C#Cc1ccccc1)N1CCCC2(CCN(C(=O)c3ccc(B(O)O)cc3)CC2)C1	1809297105	OOYADDQQKRLIRC-UHFFFAOYSA-N	430.313	1.263	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)c1ccn2ccnc2c1	1809871945	RVLLPJVDKBRCDE-LNLFQRSKSA-N	427.892	1.649	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)CCNC(=S)NC)[C@H]1c1cccnc1	1810306546	VPPCILNAISXWOQ-SOLBZPMBSA-N	440.013	1.979	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2cnc(N(C)C)o2)[C@@H]1c1cccnc1	1813029507	ODVCXTRRGFPNOQ-HLLBOEOZSA-N	435.912	1.709	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H]2CCC(=O)NC2)n[nH]1	1814519040	YJBMBWOECMOFEH-DYEKYZERSA-N	440.342	1.959	50	20	IDGD	
Cc1nc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)cs1	1815354723	BYARGYFINCLIOE-CYBMUJFWSA-N	442.331	1.127	50	20	IDGD	
O=C(CNC(=O)c1ccco1)Nc1nc2c(s1)C[C@@H](NC(=O)C(Cl)Cl)CC2	1815656539	VWMFRXYHIWFBFC-QMMMGPOBSA-N	431.301	1.882	50	20	IDGD	
CO/C=C(\C)C(=O)N[C@H]1CCc2nc(NC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)sc2C1	1817281962	UMULKEDZEJWNMH-CKGZQHNFSA-N	444.517	1.739	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)CCC(F)(F)F)[nH]n1)c1ccc(B(O)O)cc1	1817471438	OBFSUXPKRRTSJP-HNNXBMFYSA-N	438.215	1.738	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)C23CC(F)(C2)C3)[nH]n1	1819401747	QPMFTOZZNSUUMT-TVRCVXMWSA-N	441.467	1.606	50	20	IDGD	
CNC(=S)NCCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](C)Br)[nH]n1	1819409048	QIDWTTFMMWHERL-JQWIXIFHSA-N	445.387	1.669	50	20	IDGD	
C[Si](C)(C)OCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)/C=C\C(=O)NC1CC1)CC2	1820165443	GFKMXEYPNDDKKS-YXVBKTCISA-N	436.610	1.741	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cnc(O)nc2O)[nH]n1)[C@@H](F)Br	1820932958	WKZJJDRIVQNQDS-GXSJLCMTSA-N	443.233	1.607	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)[C@H]1C[C@]1(F)Cl	1822502821	VLUJSGBCGVHMAD-FRIZHTMISA-N	434.664	1.320	50	20	IDGD	
O=C(c1c(O)cc(O)cc1O)N1CCC([C@@H]2CCCCN2C(=O)[C@H](O)CCl)CC1	1824188069	MTRVJICJELGHAX-WMLDXEAASA-N	426.897	1.636	50	20	IDGD	
C[C@H](C(=O)N[C@@H]1CCc2nc(NC(=O)C(Cl)Cl)sc2C1)N1CCN(C)CC1	1826104310	KNZSFTUNDNMBRB-GHMZBOCLSA-N	434.393	1.495	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1CCc2nc(NC(=O)C(F)(F)Cl)sc2C1	1826395482	MXSPMQANUHYGBN-SSDOTTSWSA-N	444.851	1.199	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)CNC(=O)OC)sc2C1	1826506997	VPQVVOROMBYZSH-DTWKUNHWSA-N	433.328	1.585	50	20	IDGD	
O=C(c1[nH]cc2c1CCC2)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827052121	ARAPJWXHGHHEMF-JOCHJYFZSA-N	449.360	1.730	50	20	IDGD	
C=CCSCC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1	1828923303	BWWCYVWUTHQODN-IBGZPJMESA-N	445.589	1.838	50	20	IDGD	
O=C(c1cc(-c2ccccc2)on1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1830719395	CONYIGBEHJJLHR-DYESRHJHSA-N	449.891	1.011	50	20	IDGD	
CC(=O)N[C@@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1)C(C)(C)C	1831083627	SETJOKRDYLRXSG-KKSFZXQISA-N	445.988	1.259	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnn4ccncc34)C2)C1	1831645512	BTNIPLWSAZIZME-JXFKEZNVSA-N	435.912	1.207	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4ncnn4c3)C2)C1	1831650367	GVTMSVSPGVBZQD-UZLBHIALSA-N	435.912	1.207	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4nn[nH]c4c3)C2)C1	1831654780	XTWVKNBMKABZED-FOIQADDNSA-N	435.912	1.435	50	20	IDGD	
C[C@]1(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1(F)F	1832803864	PMQKQPIAOONKAC-DYESRHJHSA-N	449.502	1.964	50	20	IDGD	
CCN(C)[C@H](C)C(=O)N1CCC(N2CCC(NC(=O)[C@H](C)CBr)CC2)CC1	1833265008	UXSCYMBBKGSYLP-HZPDHXFCSA-N	445.446	1.929	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](F)Cl)CC2)CC1)c1cnc(OCF)cn1	1833989139	CYJQPAUNSIYEEE-MRXNPFEDSA-N	431.871	1.502	50	20	IDGD	
CC[C@H](C)[C@@H](O)C(=O)N1CCC(N2CCC(NC(=O)CCBr)CC2)CC1	1834422313	GKECPUAKRGSIMM-KBXCAEBGSA-N	432.403	1.750	50	20	IDGD	
O=C(COc1ccc(F)cc1)NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1834472425	KAZPAHNZMXBUDX-IBGZPJMESA-N	441.931	1.376	50	20	IDGD	
Cc1nc(C(=O)N2CCC(N3CCC(NC(=O)[C@H](F)Cl)CC3)CC2)c(=O)[nH]c1C	1835078594	NSFGAKUPRPGKKF-INIZCTEOSA-N	427.908	1.106	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3nc4ccc(F)cn4n3)CC2)CC1)[C@@H](F)Cl	1835081048	DWZFIYNTXZAYAW-MRXNPFEDSA-N	440.882	1.588	50	20	IDGD	
COc1nccc(C(=O)N2CCC(OC3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)c1F	1836718038	QJBOLMMKTPYFKA-INIZCTEOSA-N	443.903	1.441	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cn(C)c4ncccc34)CCO2)C1	1837190639	YLBFCWGUPRQKLH-UTKZUKDTSA-N	434.924	1.661	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@H](N)c3ccccn3)CC2)CC1	1837876051	YIXHEVUWEXFMLL-IEBWSBKVSA-N	438.956	1.334	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)ccc1O	1839309914	UZIDPNNAINPGNL-IFXJQAMLSA-N	441.322	1.554	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3cccc(C#N)c3)C2)C1	1840149087	DKRNAMUDIZEQMH-SIKLNZKXSA-N	449.935	1.201	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C)cc(F)c3F)C2)C1	1840155364	ZDPQKCIRKAPZBW-MGPUTAFESA-N	446.878	1.597	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H](C(=O)N2CC3(CCCN3C(=O)C(C)(C)CCl)C2)[C@@H](O)C1	1841226744	CBCOCRHGNGAJFB-GJZGRUSLSA-N	443.972	1.683	50	20	IDGD	
O=C(c1ccccc1OC(F)F)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843012758	NYIYSWBZVSAOPX-UHFFFAOYSA-N	430.216	1.099	50	20	IDGD	
Cc1ccc(NCCC(=O)N2CC3(CCCN3C(=O)c3cccc(B(O)O)c3)C2)c(C)c1	1843014192	JCXXJNXFDIMVFG-UHFFFAOYSA-N	435.333	1.302	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC2(CCCN2C(=O)/C=C/C(=O)NCc2ccco2)C1	1844343157	ANDWRRYQMBENNT-VBROQKIQSA-N	438.322	1.686	50	20	IDGD	
O=C([C@H](Br)Cc1ccccc1)N1CC2(CCCN2C(=O)c2cc(CO)on2)C1	1844821310	CZKKKXGUUDEUBS-MRXNPFEDSA-N	448.317	1.990	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@]1(NC(=O)OC(C)(C)C)CCOC1)C2	1846364050	USCACJSZSWGCQA-XOBRGWDASA-N	445.944	1.127	50	20	IDGD	
O=C(c1ccc(F)cc1)N1CCC[C@H]1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl	1847518639	JICJIJPITZMQMA-XSLAGTTESA-N	437.899	1.232	50	20	IDGD	
CCS(=O)(=O)CC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)/C(C#N)=C/c1ccc(F)cc1F	1847788623	LKRWHODSLXDNSR-UMYNOAJGSA-N	437.468	1.508	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CC(=O)N(c2ccc3c(c2)OCCO3)C1)c1cc(Cl)ccc1O	10600779	MNOOZCHRBYBXJU-LLVKDONJSA-N	431.832	1.631	50	20	IDGD	
CCNC(=O)COC(=O)/C(C#N)=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	11373577	UXMKQFICDKHFOK-NTEUORMPSA-N	429.864	1.665	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)Cc1csc(-c2ccccn2)n1	12701709	VJIBMEQDTMHSRK-UHFFFAOYSA-N	444.542	1.810	50	20	IDGD	
O=C(CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)NNC(=O)COc1ccc(F)cc1	14894043	VBHRZSJFZXPZIO-UHFFFAOYSA-N	432.364	1.648	50	20	IDGD	
C[C@H]1Cc2cc(C(=O)NNC(=O)Cn3cnc4ccccc43)ccc2N1S(C)(=O)=O	17405007	OSGBWIMGBXKXPN-ZDUSSCGKSA-N	427.486	1.208	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)c2ccc(S(=O)(=O)NC3CC3)cc2)cc1	18072030	ASICEJSJFBCTII-CQSZACIVSA-N	447.513	1.755	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CCc2nc3ccccc3c(=O)[nH]2)cc(OC)c1OC	26954326	HLIYRLAMFUBOGS-UHFFFAOYSA-N	426.429	1.343	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)CN1C(=O)N[C@]2(CCc3ccccc32)C1=O	27266423	FKAKAZAWBYQLDY-NRFANRHFSA-N	442.859	1.503	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(/C#N)C(=O)N2CCN(CC(=O)NC(C)C)CC2)c1C	105584724	QSNWVLKBTZDFRB-UMUMUWHJSA-N	429.565	1.888	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)[C@H]1CCCN(C(=O)Nc2ccccc2F)C1	725739499	HTRSYIAGITYQDH-ZDUSSCGKSA-N	447.492	1.709	50	20	IDGD	
Cc1cc(S(=O)(=O)NNC(=O)c2ccc3c(c2)OCO3)ccc1OCCCC(=O)O	726155440	KCXOXOUIYPSELI-UHFFFAOYSA-N	436.442	1.591	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](CNC(=O)NNC(=O)COc2ccccc2C#N)C1	726269471	ZXJNVXXOEUTYOQ-HNNXBMFYSA-N	431.493	1.915	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)C[C@@H]3OC(=O)c4ccccc43)cc2)CC1	728213692	GSCCXLHXGPFFKB-IBGZPJMESA-N	444.513	1.368	50	20	IDGD	
COc1cc(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)ccc1[N+](=O)[O-]	728213896	GDLZWINBMXMHLX-UHFFFAOYSA-N	449.489	1.296	50	20	IDGD	
CC1CCC(NC(=O)CN2CCN(C(=O)NNC(=O)c3ccc(C#N)cc3)CC2)CC1	728308225	PIKMXJWKHQHMQS-UHFFFAOYSA-N	426.521	1.225	50	20	IDGD	
CC(=O)N(c1ccc(F)cc1)c1nc(C=NNC(=O)[C@@H](C)NS(C)(=O)=O)cs1	728435253	WFCUSYUQQCZHHR-SNVBAGLBSA-N	427.483	1.355	50	20	IDGD	
COc1cc(N2C[C@H](C(=O)NNC(=O)c3cccc(C#N)c3)CC2=O)cc(OC)c1OC	728825333	VKKCENQDVHVYDY-OAHLLOKOSA-N	438.440	1.398	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1cn(-c2ccc(Cl)cc2)nn1	728847486	HRPGZIXKHBBHIX-UHFFFAOYSA-N	426.868	1.388	50	20	IDGD	
COC(=O)Nc1ccccc1C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	729751806	QRASBXCBXJYMFJ-MRXNPFEDSA-N	429.385	1.009	50	20	IDGD	
CCn1c(NNC(=O)[C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])o2)nc2ccccc2c1=O	732055871	GCRMQZTXONIXHS-CQSZACIVSA-N	440.416	1.666	50	20	IDGD	
Cc1c(C(=O)NNC(=O)CCN2C[C@@H](C)O[C@H](C)C2)nnn1-c1ccc(OC(C)C)cc1	732259264	BNUZBBTXGZEQBC-HZPDHXFCSA-N	444.536	1.623	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2csc(-c3ccc4c(c3)OCCO4)n2)C[C@H](C)O1	732260385	RZQMBWPJJHCUCL-KBPBESRZSA-N	446.529	1.842	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)[C@@H](CCSC)NC(=O)Cc2ccccc2)c1O	732828244	SESHJMILKVZYEE-MRXNPFEDSA-N	431.514	1.642	50	20	IDGD	
C[C@@H]1CCCC[C@H]1OCC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	733088719	VGXFWLSUWKYKTQ-CRAIPNDOSA-N	439.534	1.064	50	20	IDGD	
CC[C@H](C#N)Oc1cc(CNC(=O)NNC(=O)COc2ccccc2O)ccc1OC	733652686	FWMARKJSJLNKKR-OAHLLOKOSA-N	428.445	1.991	50	20	IDGD	
N#Cc1ccccc1OCc1cccc(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)c1	734124129	VWIBNCPDOAKLOU-QGZVFWFLSA-N	428.470	1.268	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)[C@@H]1CCCN1c1ncnc2sccc12	734239695	WGASILZBEFZUNJ-ZDUSSCGKSA-N	449.537	1.515	50	20	IDGD	
O=C(NNc1cnccn1)c1cc(S(=O)(=O)N2CCCC2)ccc1Br	734245064	FVRLWXYIEVCHEN-UHFFFAOYSA-N	426.296	1.781	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2ccc(S(N)(=O)=O)cc2)ccc1Br	734254113	RGQOSXASRLALST-UHFFFAOYSA-N	427.280	1.487	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])c1	734999053	MSXPSHXRFPTCBD-UHFFFAOYSA-N	441.849	1.882	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)Cc2c[nH]c3ccccc23)CC1	735117088	AVDLKVWETHUWMG-UHFFFAOYSA-N	428.518	1.185	50	20	IDGD	
COc1ccc(S(=O)(=O)C[C@@H](C)C(=O)OCC(=O)NNC(=O)c2cccs2)cc1	735161176	OVGDYFMSLVJINV-GFCCVEGCSA-N	440.499	1.171	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)N(C)CC(=O)NNc2cccc(C(F)(F)F)n2)cc1	740136224	IJIHFPRCMDIPTR-UHFFFAOYSA-N	445.423	1.823	50	20	IDGD	
C[C@H](C(=O)OCC(=O)NNC(=O)c1cccs1)N1CCN(c2ccc(F)cc2)CC1	740981862	FKOZKAVNGFENJL-CQSZACIVSA-N	434.493	1.402	50	20	IDGD	
CC(C)c1ccc(N2CC[C@@H](C(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)C2=O)cc1	741660837	OLCFEZTVXVGRAM-IBGZPJMESA-N	447.495	1.871	50	20	IDGD	
Cc1ccc(CN2C(=O)CC[C@H]2C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1	742635505	RVRSPDNMNMIUCV-IBGZPJMESA-N	436.516	1.340	50	20	IDGD	
CCN(CC)[C@@H](CNC(=O)NNC(=O)c1csc(N2CCOCC2)n1)c1ccco1	743340859	MQTKVVJGXAQZLL-HNNXBMFYSA-N	436.538	1.600	50	20	IDGD	
O=C(CN1C(=O)[C@H]2[C@H](C1=O)[C@H]1CC[C@H]2O1)Oc1ccc([N+](=O)[O-])cc1Br	744168126	IZLTUABMXVCFPK-HBJVGIJOSA-N	425.191	1.425	50	20	IDGD	
O=C(C[C@H]1OCCc2ccccc21)NNc1ccccc1S(=O)(=O)N1CCOCC1	744622225	XKJCXZCTOXJVMU-LJQANCHMSA-N	431.514	1.855	50	20	IDGD	
Cc1nn(C)c2sc(C(=O)N[C@H](C)C(=O)OCC(=O)NNC(=O)c3cccs3)cc12	745269517	BYJFPTMPPKUFAF-SNVBAGLBSA-N	449.514	1.127	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCc2cc(C#N)ccc2F)cc1	745891635	XCPVBPBNCSDUAC-UHFFFAOYSA-N	433.465	1.157	50	20	IDGD	
CN(CC(=O)NNC(=O)Cc1cn2ccccc2n1)C(=O)c1ccc(Br)o1	746550783	VEXVIYUYDOYPNK-UHFFFAOYSA-N	434.250	1.152	50	20	IDGD	
COc1cccc(C[C@H](C(=O)NNC(=O)c2cccc3cccnc23)n2nnnc2C)c1	747422146	FWJQGKBCJRSVSK-LJQANCHMSA-N	431.456	1.783	50	20	IDGD	
COC(=O)c1cc(C)c(C)c(S(=O)(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1	747613845	WMAHSXOZUYWPME-UHFFFAOYSA-N	447.517	1.106	50	20	IDGD	
CCOc1ccc(S(=O)(=O)Nc2cccc(C(=O)NNc3nccn(C)c3=O)c2)cc1	747938487	WCLWSWCNHLWMAV-UHFFFAOYSA-N	443.485	1.737	50	20	IDGD	
O=C(COC(=O)c1ccc(C(=O)c2cc[nH]c2)cc1)NNC(=O)c1cccc([N+](=O)[O-])c1	748898675	OQYPJVOIMSYFSX-UHFFFAOYSA-N	436.380	1.772	50	20	IDGD	
O=C(NNC(=O)c1cc2ccccc2o1)c1ccc(S(=O)(=O)N2CCOCC2)cc1	749473725	LWRYAZLCPRTBJF-UHFFFAOYSA-N	429.454	1.529	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN1C(=O)c1ccc2c(c1)OCO2)c1cc(Cl)ccc1O	749719444	PLMVQSNAUZYEGL-AWEZNQCLSA-N	431.832	1.840	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1C(=O)Nc2ccccc2S1(=O)=O	750008245	UABBIMYVIDOQPN-UHFFFAOYSA-N	438.849	1.346	50	20	IDGD	
C[C@H](C(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1)N1CCSCC1	750913969	IBODSLSNTRURRD-MRXNPFEDSA-N	440.013	1.042	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)N[C@@H]1CCN(c2cccc(Cl)c2)C1	751101721	GZNWJXZBNIUQDL-QGZVFWFLSA-N	443.939	1.956	50	20	IDGD	
CC(C)[C@@H]1OCCC[C@@H]1CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	753033263	BBZQUAYAJLCEPT-WBVHZDCISA-N	426.539	1.332	50	20	IDGD	
COCC[C@H](Cc1ccco1)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	753284123	ZZVJCKCRHVSGRH-OAHLLOKOSA-N	438.506	1.122	50	20	IDGD	
Cc1nn(C)c(C)c1S(=O)(=O)N[C@H](C)C(=O)NNc1ccc(-c2ccccc2)nn1	754471065	WHBBVXOCMVJTTO-CYBMUJFWSA-N	429.506	1.304	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)c2c(C)nc3ccccn23)cc1S(=O)(=O)N(C)C	755392486	HFGXHUPABLPDEY-UHFFFAOYSA-N	430.490	1.668	50	20	IDGD	
O=C(CC1CC1)NNC(=O)Nc1ccc(CC(=O)N2CCN(c3ncccn3)CC2)cc1	755690883	HAJMPTSMIVUECF-UHFFFAOYSA-N	437.504	1.321	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2ccc(OC)c(OC)c2)cc(F)c1F	755959483	UCVGDMXWXUZGGX-UHFFFAOYSA-N	430.385	1.392	50	20	IDGD	
O=C(NNC(=O)[C@H]1CC(=O)N(c2cc(Cl)cc(Cl)c2)C1)C(=O)Nc1ccccn1	758833030	CYCGZZKFOAJFQL-JTQLQIEISA-N	436.255	1.527	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)C2(NS(=O)(=O)c3c(C)noc3C)CCCC2)nc1	759737818	GUUOGFUNEDFADP-UHFFFAOYSA-N	437.478	1.207	50	20	IDGD	
C[C@H]1C[C@H](C)CN(S(=O)(=O)c2ccc(NC(=O)C(=O)NNC(=O)C(C)(C)C)cc2)C1	761073647	VQGIDKLAXRPTQV-KBPBESRZSA-N	438.550	1.485	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2cc(F)ccc2Br)n1	762408875	HELIGTMEQIRPLL-UHFFFAOYSA-N	430.255	1.900	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(OC[C@H]2CCCO2)cc1	763446023	NVGHIRLJUGXNSW-QGZVFWFLSA-N	428.401	1.552	50	20	IDGD	
CN(C)c1nnc(-c2ccc(NC(=O)C(=O)NNC(=O)c3ccc4ccccc4n3)cc2)o1	763451012	SPFMHCBVBMAHHP-UHFFFAOYSA-N	445.439	1.751	50	20	IDGD	
COc1ccc(NC(=O)c2cccc(NC(=O)C(=O)NNC(=O)c3ccccn3)c2)cn1	763468397	YCIXPTONBWBMGH-UHFFFAOYSA-N	434.412	1.137	50	20	IDGD	
NC(=O)CCOc1ccccc1NC(=O)C(=O)NNC(=O)c1cc2ccccc2cc1O	763526512	HHMUJXXKQCQSIV-UHFFFAOYSA-N	436.424	1.199	50	20	IDGD	
C[C@H](c1ccccc1)n1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)n1	763575602	YTNZKOZSSPMECF-KDOFPFPSSA-N	435.440	1.418	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)Nc1ccc(-c2n[nH]c(C3CC3)n2)cc1	763577722	KFMTXFSYJLXNBY-QGZVFWFLSA-N	448.439	1.275	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccnc(C(=O)N(C)C)c2)c(C)n1-c1ccccc1	763602093	NFQQPEMPCYTTQZ-UHFFFAOYSA-N	448.483	1.591	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)NC(C)(C)C)cc2)c1	763771939	ILWMEJLZKGVNRZ-UHFFFAOYSA-N	442.472	1.632	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCC3)c(OCCN(C)C)c1	763782913	IHZVPFCBOCBFCT-UHFFFAOYSA-N	430.530	1.885	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)C(=O)Nc1cccc(Br)c1	763791535	UXCZUWLMVLOHOW-UHFFFAOYSA-N	430.218	1.498	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccnc1OCc1ccccc1	763814099	PBCDLWBOZNRFBY-UHFFFAOYSA-N	445.435	1.697	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(S(C)(=O)=O)cc2)c1C	763847641	DSNUWJFGEJWKMZ-AWEZNQCLSA-N	433.486	1.260	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccccc1N1CCN(C)CC1	763850938	QYNDBIJPWJBGQM-HNNXBMFYSA-N	443.479	1.131	50	20	IDGD	
NC(=O)CCSc1ccccc1NC(=O)C(=O)NNC(=O)Cc1c[nH]c2ccccc12	763860989	NGUSGNBODACUBK-UHFFFAOYSA-N	439.497	1.464	50	20	IDGD	
COc1ccc(CN(C)C)cc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccc(F)cc1	763865388	KHDZZEKPMKQFGY-CYBMUJFWSA-N	432.452	1.449	50	20	IDGD	
CC[C@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)cc1	763873778	WHFDOFFCPKSVMF-UONOGXRCSA-N	444.463	1.907	50	20	IDGD	
CS(=O)(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3c2)cc1F	764061274	BNEFTUXMFOBEQH-UHFFFAOYSA-N	443.456	1.923	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc([S@@](C)=O)c(F)c3)n[nH]2)cc1	764110280	HHRNQBVYQSDWCC-WJOKGBTCSA-N	443.460	1.661	50	20	IDGD	
CN(C)CCCOc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)cc1	764166382	BNRVSMREPQYQBO-LJQANCHMSA-N	426.473	1.107	50	20	IDGD	
CS(=O)(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)c2c(Cl)cccc2Cl)cc1	764221073	KODHWOGJVSFHGV-UHFFFAOYSA-N	444.296	1.938	50	20	IDGD	
CN(C)N(C(=O)c1ccc(F)c(I)c1)[C@H]1CCS(=O)(=O)C1	764229334	KSIKYURPSYFZMW-JTQLQIEISA-N	426.251	1.536	50	20	IDGD	
CCOc1cc(NC(=O)C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)ccc1C	764258855	BBJDFYNJNNJNQM-UHFFFAOYSA-N	426.477	1.186	50	20	IDGD	
C[C@H]1CN(Cc2cccc(NC(=O)C(=O)NNC(=O)Cc3ccccn3)c2)C[C@@H](C)O1	764263789	IXJGOYDKWBVNQY-IYBDPMFKSA-N	425.489	1.019	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1	764268197	ZNXQRDIEVSUQAP-UHFFFAOYSA-N	447.839	1.041	50	20	IDGD	
Cc1ccnc(Oc2ccc(NC(=O)C(=O)NNC(=O)COc3ccccc3O)cc2)n1	764276202	ZSUUGLWVCLCVPD-UHFFFAOYSA-N	437.412	1.448	50	20	IDGD	
Cc1ccc(Cn2nccc2NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)s1	764345940	MVDCHTQDNSNECC-UHFFFAOYSA-N	449.496	1.887	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1ccccc1Cn1cncn1	764391983	BAALVUSXPDHHFB-UHFFFAOYSA-N	440.485	1.213	50	20	IDGD	
COC(=O)c1cc(C)ccc1NC(=O)C(=O)NNC(=O)CSc1ccccc1OC	764392823	LORXRPKUGUCEPD-UHFFFAOYSA-N	431.470	1.668	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(C)c(Oc2cc(C)ccn2)c1	764401881	YVEJIKYHNYLHLA-HNNXBMFYSA-N	430.461	1.628	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2F)c1	764411990	CEMNDGYKVKBMMC-UHFFFAOYSA-N	442.856	1.129	50	20	IDGD	
CCn1cc(NC(=S)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)cn1	764519345	QJTFKKPZKVHGKA-UHFFFAOYSA-N	435.985	1.692	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)N[C@@H]1CCN(C(=O)CCc2ccccc2)C1	765832193	XLWNMAXSLRZQFI-QGZVFWFLSA-N	430.530	1.950	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2ccc([N+](=O)[O-])c3cccnc23)n1	766232752	YFFBNJZCGVRIDZ-UHFFFAOYSA-N	429.414	1.455	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)c1ccnc(C2CC2)n1	766663626	KRJWPYMFXVPMFU-UHFFFAOYSA-N	428.924	1.586	50	20	IDGD	
NS(=O)(=O)c1ccc(NCCC(=O)NNc2c(F)cccc2Cl)c([N+](=O)[O-])c1	770299380	ZYTOXBLDJXRHCD-UHFFFAOYSA-N	431.833	1.980	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2ccc(OC(F)(F)F)c(N)c2)n1	770530549	CEBVZZREHCYLDZ-UHFFFAOYSA-N	432.380	1.479	50	20	IDGD	
CC/C=C(\C)C(=O)N1CSC[C@H]1C(=O)NNc1nc(O)c2cnn(C(C)(C)C)c2n1	770959789	ZSKZGXMIIKBQOL-HJTPGIPUSA-N	433.538	1.988	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)[C@@H](c3ccccc3)N3CCC(O)CC3)nc21	771010745	ZIOLJNDICCCSJW-QGZVFWFLSA-N	439.520	1.928	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)CN1C(=O)N[C@@](C)(c2ccccc2OC)C1=O)c1ccccc1	771265680	FVRFSEXABFBEIC-HJPURHCSSA-N	438.484	1.803	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)N[C@H]2CCN(C(=O)OCC)C2)c2ccccc2c1=O	771393935	SKWYYQDVRYOAMM-AWEZNQCLSA-N	444.492	1.371	50	20	IDGD	
O=C(NNC(=O)C1(OCc2ccccc2)CCOCC1)C1CCN(c2ncccn2)CC1	772108544	WAKGJHSZASUVEB-UHFFFAOYSA-N	439.516	1.606	50	20	IDGD	
Cc1cc(N2CCCS2(=O)=O)ccc1C(=O)O[C@@H](C)C(=O)NNC(=O)CC(C)C	772152259	BXYGJHJQIGPIBR-AWEZNQCLSA-N	425.507	1.274	50	20	IDGD	
C[C@@H]1CN(c2cccc3cnccc23)CCN1C(=O)NNC(=O)CNC(=O)c1ccco1	772352666	CFJZOMMUAVTTRW-OAHLLOKOSA-N	436.472	1.509	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCCOCc2ccc(OC)cc2)c2ccccc2c1=O	772566331	WJKSOCMAUXJXNB-UHFFFAOYSA-N	439.472	1.586	50	20	IDGD	
COc1ccc([C@H](OC)[C@@H](C)NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1	772582975	QKVGKKUKAZMJMU-BFUOFWGJSA-N	439.472	1.662	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)C[C@@H](O)c3cccc(F)c3)cc2)CC1	772818729	XUXQCEBGOSBHEM-LJQANCHMSA-N	436.509	1.329	50	20	IDGD	
CC/C=C(/C)C(=O)N1CSC[C@@H]1C(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772897715	LGXUZSOPLHZEPH-KYHFQZCVSA-N	438.937	1.361	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc(Cl)cn3)n[nH]2)cc1OC	773547186	UKWSOGPKGIPOOP-UHFFFAOYSA-N	444.835	1.542	50	20	IDGD	
O=C(NNc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(C(=O)NC2CCOCC2)cc1	773657139	YSLMHVCYQKPQSZ-UHFFFAOYSA-N	427.417	1.585	50	20	IDGD	
O=C(NNc1c(F)cccc1F)C(=O)Nc1cccc(S(=O)(=O)N2CCOCC2)c1	773706239	YZHOFMBTEQDKGT-UHFFFAOYSA-N	440.428	1.068	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNc2cccc(Cl)c2C)ccc1S(=O)(=O)N(C)C	773766003	CPLCADVYTBPYJG-UHFFFAOYSA-N	440.909	1.989	50	20	IDGD	
Cc1cc(CNC(=O)NNC(=O)c2cc3c(s2)CC[C@H](C)C3)ccc1S(N)(=O)=O	775228570	JIESIDBTCUVYLU-NSHDSACASA-N	436.559	1.973	50	20	IDGD	
O=C(CCSc1ccc(F)cc1)NNC(=O)Nc1ccc(C[C@H]2NC(=O)NC2=O)cc1	775703838	ROLOSCSWJZQZMS-MRXNPFEDSA-N	445.476	1.911	50	20	IDGD	
COc1ccc([C@H](NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)C(F)(F)F)cc1	775995543	HAYPLWJIAWWAPZ-HNNXBMFYSA-N	435.366	1.919	50	20	IDGD	
CCOC(=O)N1CCC[C@H]([C@@H](C)NCC(=O)NNC(=O)c2cc(Cl)ccc2OC)C1	776826402	GUCMBQYNVLLVNL-KGLIPLIRSA-N	440.928	1.956	50	20	IDGD	
CCOC(=O)N1CCC[C@@H]([C@@H](C)NCC(=O)NNC(=O)c2cc(Cl)ccc2OC)C1	776826406	GUCMBQYNVLLVNL-ZIAGYGMSSA-N	440.928	1.956	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@@H](C)C2CCN(C(=O)OC)CC2)c2ccccc2c1=O	777254423	KGPAFEPAIOIRGV-ZDUSSCGKSA-N	444.492	1.227	50	20	IDGD	
O=C(NN=Cc1cnn(Cc2ccc(C(F)(F)F)cc2)c1)N[C@H]1CCS(=O)(=O)C1	777433146	WCHPAFWUVPYNIG-HNNXBMFYSA-N	429.424	1.770	50	20	IDGD	
O=C(c1cccc(N2CCOC2=O)c1)N1CCN(S(=O)(=O)CBr)CC1	777779728	SEYDJMGPASAIMU-UHFFFAOYSA-N	432.296	1.083	50	20	IDGD	
COc1cc(C=NNC(=O)[C@H](C)CN2CCOCC2)c([N+](=O)[O-])cc1OCC(F)F	778541041	WKTWFICYNRPAGT-GFCCVEGCSA-N	430.408	1.666	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)CNC(=O)c1cccs1)[C@@H]1CCN(Cc2ccccc2)C1	778639265	APNIIXUHRGWZTM-NVXWUHKLSA-N	429.546	1.719	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)c1ccc(I)cc1	780974001	MBEDGAXUQCYBFN-UHFFFAOYSA-N	433.246	1.967	50	20	IDGD	
C[C@@H](CNC(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccc(Cl)cc1)S(N)(=O)=O	782037689	LDMPEFINDRZFLY-GRRFOWRYSA-N	446.920	1.817	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)C(=O)Nc1c(F)cc(F)cc1F	782897372	NYUDPLCWRKGLCL-UHFFFAOYSA-N	443.407	1.105	50	20	IDGD	
Cc1cc(C)n(-c2cccc(NC(=O)C(=O)NNC(=O)CNC(=O)c3cccs3)c2)n1	784003573	JHIQDNHUUFJSLP-UHFFFAOYSA-N	440.485	1.067	50	20	IDGD	
CN1CCC[C@@H](N(C)C(=O)c2ccc(NC(=O)C(=O)NNc3ccnc(F)c3)cc2)C1	784848157	DIHBMRYJCUPFLC-QGZVFWFLSA-N	428.468	1.469	50	20	IDGD	
COC(=O)c1cc(OC)c(OC)cc1NC(=O)C(=O)NNc1ccc(C(F)(F)F)nn1	784886341	PATRQYBKXFTZPW-UHFFFAOYSA-N	443.338	1.381	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cnc(O)c4ccccc34)CC2)cc1	787125670	IFEABXIOTGWCIJ-UHFFFAOYSA-N	433.512	1.828	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(Cl)cc1-n1cccn1	788332081	WMTAQSGTBAPINM-UHFFFAOYSA-N	438.831	1.562	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)C2CCC(NC(=O)C(C)(C)C)CC2)n1	789207211	RZOORCHBMBZKPC-UHFFFAOYSA-N	438.550	1.406	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2cc(-c3ccc(F)cc3F)nn2C)c1	789731865	IRERNFRDJNXQPE-UHFFFAOYSA-N	443.410	1.839	50	20	IDGD	
CNC(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)c1	789817837	KEFXGILTCQENJJ-YOEHRIQHSA-N	444.875	1.358	50	20	IDGD	
COC(=O)c1cc(Cl)cc(S(=O)(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c1OC	790049581	HVDSTYFDAYPEPP-UHFFFAOYSA-N	443.821	1.667	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2nnc(O)c3ccccc23)ccc1C(F)(F)F	790951897	MLFHIFBYIGGXQO-UHFFFAOYSA-N	449.345	1.763	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)Cc2cccnc2)cc(N2CCN(C(C)C)CC2)c1	792266645	BCFZWVHQKMNZMJ-UHFFFAOYSA-N	438.532	1.249	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2ccc(N3CCCCC3)c3ncccc23)CCS(=O)(=O)C1	792354330	YETCAUBZWYMJOR-OAQYLSRUSA-N	445.545	1.362	50	20	IDGD	
Cc1ccc2c(c1)CC[C@H](C(=O)NNC(=O)CN1CCN(C(=O)c3ccccc3)CC1)O2	793682397	MYCSFANYLYMIBQ-OAQYLSRUSA-N	436.512	1.294	50	20	IDGD	
COC(=O)c1cc(F)cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)c1F	796990721	WMQVACBVAPOWDF-GFCCVEGCSA-N	449.410	1.922	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2cnn(-c3ccc(C(F)(F)F)cc3)c2)n1	797371075	OSXHXCQEDOTLSM-UHFFFAOYSA-N	432.362	1.994	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@H]2C(=O)NNc2nccc(N3CCOCC3)n2)cc1	799101639	PRIJVZQXDWMRQT-KRWDZBQOSA-N	426.477	1.070	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)N(C)[C@@H](C)c1cccc(S(N)(=O)=O)c1	799857987	YJWCREABHYGNGV-ZDUSSCGKSA-N	430.490	1.338	50	20	IDGD	
CN1C(=C(C#N)C(=O)COC(=O)CCC[C@]2(C)NC(=O)NC2=O)N(C)c2ccccc21	801428984	JUDNNUJQOGUNEH-NRFANRHFSA-N	425.445	1.188	50	20	IDGD	
CN(CC(=O)NNC(=O)Nc1ccccc1)S(=O)(=O)c1ccc(Br)cc1	801988877	UQMDGABWHNBTJD-UHFFFAOYSA-N	441.307	1.923	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCN(c2ccc3c(c2)OCCO3)C1=O)Nc1cc(F)cc(F)c1	802006888	WCDCOTXNZLMJBT-HNNXBMFYSA-N	432.383	1.942	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)C2CCN(c3ccc(C#N)cc3F)CC2)C[C@@H](C)O1	806341043	YKZZQMVXVTYWGD-IYBDPMFKSA-N	431.512	1.560	50	20	IDGD	
CC(C)(C(=O)NNC(=O)CNC(=O)c1ccco1)S(=O)(=O)c1ccc(Cl)cc1	806737377	RXLJEEJVCWUDON-UHFFFAOYSA-N	427.866	1.063	50	20	IDGD	
COCC1(CNC(=O)NN[C@@]2(C)CCS(=O)(=O)C2)CCN(C(=O)OC(C)(C)C)CC1	807270833	ZEVJKVGQNZGPJX-SFHVURJKSA-N	448.586	1.031	50	20	IDGD	
CO[C@H](C)c1nsc(NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)n1	809923973	FZLGWIBGAPPNRN-LLVKDONJSA-N	442.523	1.027	50	20	IDGD	
COC(=O)c1c(F)ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)c1C	810385438	SDRDKHVZMRXPIK-UHFFFAOYSA-N	439.403	1.711	50	20	IDGD	
COC(=O)c1c(F)ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)c1C	810386011	IWWZYVTZHYCHDS-LLVKDONJSA-N	435.383	1.613	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@H](F)C[C@H]1CNC(=O)NNC(=O)COc1ccc(F)cc1	813813747	CQWZPYSOLQYELH-KBPBESRZSA-N	428.436	1.882	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NN=C1CCS[C@H]1C)N(S(C)(=O)=O)CC2	814759089	QISWTLXMLUQSLC-BLLLJJGKSA-N	441.575	1.950	50	20	IDGD	
Cc1ccc(COc2cccc(NC(=O)C(=O)NNC(=O)[C@@H]3CCc4nncn4C3)c2)cc1	815692295	NWQJFIYXISRQEI-QGZVFWFLSA-N	448.483	1.514	50	20	IDGD	
CCN(CC)c1ccc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)N(C)C)cn1	815751856	RHHZYMFDEOASTD-UHFFFAOYSA-N	434.522	1.260	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CSc2nnc(-c3cccs3)n2CCC(N)=O)cc1	817850724	DTADREBIJXPZER-UHFFFAOYSA-N	444.542	1.744	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)[C@H]2Cc3ccccc3CN2C(C)=O)c2ccccc2c1=O	834683959	NZJWZUFWKJKWRN-HXUWFJFHSA-N	447.495	1.541	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CSc2nc3cc(S(=O)(=O)N(C)C)ccc3o2)cc1	849120270	LJQPGLKYZSORAI-UHFFFAOYSA-N	448.526	1.940	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)[C@H]2CC(=O)N(c3ccc(Br)c(C)c3)C2)n1	913897857	CENWCLILUOLARL-AWEZNQCLSA-N	448.321	1.771	50	20	IDGD	
CCc1ccccc1OCC(=O)NNS(=O)(=O)c1ccc(C(=O)N2CCOCC2)cc1	915185572	FRZSFBYLNLFZDQ-UHFFFAOYSA-N	447.513	1.110	50	20	IDGD	
COC(=O)Cc1cc(=O)n(-c2ccc(C(=O)NN=c3sc4ccccc4n3C)cc2)[nH]1	915193766	RLUDDOWMHLUUQG-UHFFFAOYSA-N	437.481	1.680	50	20	IDGD	
NS(=O)(=O)c1ccc(CCNC(=O)NNC(=O)CSc2ccc(Cl)cc2)cc1	915883987	NOTBBULLQSPCCL-UHFFFAOYSA-N	442.950	1.653	50	20	IDGD	
CN(C)C1(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)CCCCCC1	915917272	NSUMEZBJKJFFQU-UHFFFAOYSA-N	439.582	1.536	50	20	IDGD	
CC(=NNC(=O)C1=S=C2CCCC2=C1)c1ccc(S(=O)(=O)N2CCNCC2)cc1	916315611	XGKHFBKNLICJHY-UHFFFAOYSA-N	432.571	1.323	50	20	IDGD	
CCOc1cc(C=NNC(=O)[C@H](C)CN2CCOCC2)ccc1O[C@@H](C)C(=O)N(C)C	916362072	ILNMAVKQCXWYKF-SJORKVTESA-N	434.537	1.359	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)NCCCS(=O)(=O)Cc1ccccc1	916577165	MNZPFJZXHYSFPB-UHFFFAOYSA-N	429.502	1.592	50	20	IDGD	
Cc1c(N(C)S(=O)(=O)c2ccc(Cl)c(C(=O)NN)c2)c(=O)n(-c2ccccc2)n1C	916665632	UCNGMLDMCFYFFL-UHFFFAOYSA-N	449.920	1.566	50	20	IDGD	
O=C(CSc1nnc(-c2ccc3ccccc3c2)o1)NNC(=O)[C@@H]1CCS(=O)(=O)C1	917625875	ZQXMLLJMHZOHAF-OAHLLOKOSA-N	446.510	1.564	50	20	IDGD	
COC(=O)COc1ccc(S(=O)(=O)NNC(=O)c2ccc(Br)s2)cc1	917728358	ZAYISLBTEWELPC-UHFFFAOYSA-N	449.304	1.686	50	20	IDGD	
C[C@]1(NNC(=O)NCCCN2CCN(c3ccccc3Cl)CC2)CCS(=O)(=O)C1	920813355	GUVMKJQKVBNQOF-IBGZPJMESA-N	444.001	1.233	50	20	IDGD	
CCCOc1c(Br)cc(C(=O)NNC(=O)CN2CCCC2=O)cc1OC	920826434	LRCRQTGAYZPKJQ-UHFFFAOYSA-N	428.283	1.630	50	20	IDGD	
O=C(NCCc1cccs1)NNC(=O)c1cc(S(=O)(=O)N2CCSCC2)c[nH]1	921028264	WBCULCBGDQJWEQ-UHFFFAOYSA-N	443.576	1.000	50	20	IDGD	
O=C(CCNS(=O)(=O)/C=C\c1ccccc1)NNC(=O)c1cncn1-c1ccccc1	1317710943	QTZJGPWWIRWFMD-OWBHPGMISA-N	439.497	1.614	50	20	IDGD	
O=C(NCCNC(=O)c1c(F)cccc1F)NNC(=O)c1cncn1-c1ccccc1	1321773053	NNBXWXKTTGSSMK-UHFFFAOYSA-N	428.399	1.525	50	20	IDGD	
CN1C(=O)COc2ccc(NC(=O)NNC(=O)C3CCN(C(=O)OC(C)(C)C)CC3)cc21	1337798176	DWPYAMVXNIWSQV-UHFFFAOYSA-N	447.492	1.842	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H](O)Cc2cccc(OC)c2)c1	1338724940	XWRWDTDBQOZJQF-IBGZPJMESA-N	449.529	1.090	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnnc4ccccc34)C2)C1	1777730459	YSHUXRWGIBKBRH-DJJJIMSYSA-N	433.306	1.857	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3nn(C)c4c3CCC4)C2)C1	1777963962	ATOFERRKKFGBTP-SGTLLEGYSA-N	425.327	1.136	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(-n3cncn3)c1)C2)[C@@H](F)Cl	1778028470	KCQCJJPWMCVPGZ-MBOZVWFJSA-N	435.887	1.929	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2)c1cnnc2ccccc12	1778526830	CTCPVLBPGHHAKJ-DBXWQHBBSA-N	432.908	1.357	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)/C=N/O[C@@H]3CCCCO3)C2)C1	1779105083	IGGCAUSHPWYHRF-SMABWXKKSA-N	446.342	1.519	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccnnc2O)C1	1779966701	UXVGWGDKXUOFBI-PMUMKWKESA-N	441.326	1.483	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(CN(C(=O)COC(C)C)CCO2)C1	1780095277	OEFRQSCIAYVJLD-NRFANRHFSA-N	449.460	1.389	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@]2(C)C[C@@H]2C)C1	1780617921	ITJATANZIUIZHB-GHTHYRKVSA-N	443.548	1.680	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(O)c([N+](=O)[O-])c3)CCO2)C1	1781235340	YBWVBDNUOMEADF-MSOLQXFVSA-N	446.287	1.980	50	20	IDGD	
O=C(c1cc(C(F)F)no1)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781330839	HLSAVWOTWTUVNL-IINYFYTJSA-N	426.189	1.746	50	20	IDGD	
O=C(c1cc(F)cc([N+](=O)[O-])c1)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781332828	JTNVWAZPHQTLTN-XJKSGUPXSA-N	448.220	1.868	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)nc2nccn12	1782355051	PPBLMEXXNUZODT-SUMWQHHRSA-N	440.273	1.172	50	20	IDGD	
O=C(CCN1CCCC1)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Br)C2	1783319345	OEJNDZZYJCXXMI-QGPMSJSTSA-N	434.350	1.677	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccn4nccc4c3)CCO2)C1	1783349574	NTZYIWLNHBLCRL-QFBILLFUSA-N	435.322	1.951	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H]1CCc3nc[nH]c3C1)CCO2	1783540426	WKFIIAYSCINTFH-VEVIJQCQSA-N	425.327	1.128	50	20	IDGD	
Cc1nnsc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]2C1	1783965323	IJDGNOXJTSLOOD-IXOXFDKPSA-N	431.356	1.471	50	20	IDGD	
Cc1cc2[nH]c(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]4C3)cc2s1	1784092499	OLJLKCXRQJNUEC-RKLWJJNISA-N	425.938	1.731	50	20	IDGD	
CCCNC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CO[Si](C)(C)C)C[C@@H]21	1784376615	ZULRPJIDPBVWRK-ULQDDVLXSA-N	427.618	1.124	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN3C(=O)CSC3=S)C[C@@H]21	1784624985	YKERXVNVJVRRTQ-FQUUOJAGSA-N	448.010	1.234	50	20	IDGD	
Cc1nnc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)CBr)C[C@@H]32)s1	1787056597	LYGGMNYKOYIQFT-SAXRGWBVSA-N	445.383	1.400	50	20	IDGD	
C[C@H](NC(=O)c1ccc(F)cc1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]2C1	1787449190	NNNZSDKPOYPMBC-VCQFHVMDSA-N	443.878	1.458	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]2C1	1788762399	VBVQMTQGEZEJRY-QPSCCSFWSA-N	435.435	1.849	50	20	IDGD	
O=C(CC(=O)Nc1ccc(F)cc1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21	1789682142	ZEOFZTZXFDHGAJ-HEWDHTHVSA-N	429.851	1.668	50	20	IDGD	
CC(C)(C)OC(=O)CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]2C1	1789921397	GHXAPNYKOJIWQL-ASHKBJFXSA-N	437.306	1.388	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]3C2)c(O)n1	1789924750	UVRRZKSNNQUJNX-PYJNHQTQSA-N	430.274	1.379	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(F)c(F)cc3F)[C@H]2C1	1790044777	SIDCPCWOTOHGNW-PYERRIOISA-N	434.842	1.951	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cn3ccnc3C)[C@H]2C1	1790653181	ZECMACABWCWDSA-VGWMRTNUSA-N	427.343	1.345	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cncc(O)c3)C[C@@H]21	1790963467	CBEXPZWFRHJEIV-KSYCFECVSA-N	426.311	1.554	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)NC(=O)OC(C)(C)C)[C@H]2C1	1791157385	IYJDKGASXNYHHM-CWVYHPPDSA-N	431.961	1.897	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](N)c3cccc(Cl)c3)C[C@@H]21	1791251771	VMMYJJOEKBDUOT-JFMONLCZSA-N	444.359	1.573	50	20	IDGD	
C[C@H](CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2C1)c1ccccc1	1791293282	RWZZKXGXXFEVRR-HZEGPAAWSA-N	444.576	1.533	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc([N+](=O)[O-])o1	1792356988	RNBUAUACXIZLSO-FBKDDSFISA-N	430.255	1.565	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3nonc3c1)C2	1792868239	RWPXIULZYDIKGS-VFFTVRQLSA-N	437.294	1.457	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](Br)Cc1ccccc1)C2)C(=O)C1CC1	1792901722	KBVHRVGTYCNRNL-XMTFNYHQSA-N	449.345	1.561	50	20	IDGD	
COC(=O)c1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](O)CCl)c([N+](=O)[O-])c1	1793115013	VTDOMJGZLDAGBE-ZWUHOBOKSA-N	439.852	1.233	50	20	IDGD	
CN(C)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1795873002	CNHZEVANCLPWDX-FZKCQIBNSA-N	430.977	1.708	50	20	IDGD	
COc1ccccc1CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1	1796188006	SXPVAJKAXHYPMQ-WKCHPHFGSA-N	436.317	1.260	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@]1(F)CCCCC1(F)F	1797804627	AOVOFDPZUVYZEW-YGTYGHESSA-N	432.487	1.915	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc2[nH]ccc2n1	1798054052	OFQGAJPEXAEPLO-BTTYYORXSA-N	433.472	1.127	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccnc3ccccc13)C2	1798440098	AHDNEGBRGPBQOX-MUJYYYPQSA-N	444.495	1.799	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](O)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CO[Si](C)(C)C	1798628376	YPPLWAKUIYVQCQ-UMPJEAMMSA-N	429.590	1.319	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(OCCCO)cc1	1799245204	UVBTVLHILNDSDD-REPLKXPHSA-N	446.548	1.073	50	20	IDGD	
COc1cc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@](C)(Cl)CCl)ccn1	1799273609	DKYNXPLDHRUXND-ZDUSMZPESA-N	444.359	1.849	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(Cl)c(O)cc1O	1800292138	KMUOLLOEMRPAEU-CLLJXQQHSA-N	438.912	1.376	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](O)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CO[Si](C)(C)C)C2	1800599618	JEGLSAFGXASKBB-FQLMCAECSA-N	429.590	1.319	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CC1CCN(C)CC1)C2	1800637758	HVEUXQAQNKFFIK-KYHPRHEASA-N	430.387	1.481	50	20	IDGD	
CC[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](Br)CC)N(CC)CC	1800639863	AJZAQRUGOIVJJZ-BPKGMFCQSA-N	432.403	1.870	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COc1cccnc1)C2	1800640416	WTAWABSFNNJXHH-IARIHHJXSA-N	426.311	1.224	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1Cc3ccccc3N1)C2	1800643445	SFFCSLQBVXNXHY-DTYCBIMDSA-N	436.350	1.786	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/c1ccc([N+](=O)[O-])o1)C2	1800970691	HFWKNEYWUQGUBO-VLDRXHLPSA-N	427.841	1.044	50	20	IDGD	
C[C@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCC(=O)NN(C)C)C2)[S@](=O)c1ccccc1	1801274583	BYSQYGMHLGEHLT-NHBUCKSFSA-N	448.589	1.194	50	20	IDGD	
C[C@@H](Oc1cccnc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@](C)(Cl)CCl)C2	1801404601	XWRDXJUAOPQMQI-TWAUDHPGSA-N	430.332	1.675	50	20	IDGD	
CC[C@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(=O)nc3cccnn13)C2	1801803601	FVEFMYCIPSEMAU-CRWXNKLISA-N	448.321	1.515	50	20	IDGD	
O=C(Cc1cc(F)ccc1F)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2	1801973787	WEKCFFANFDRNQJ-IVWMJMPLSA-N	431.277	1.882	50	20	IDGD	
O=C(CCCCCCCCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(O)O)C2	1802188722	QEYOZLFGRWLXEH-MIFYACCESA-N	435.359	1.012	50	20	IDGD	
COC(=O)[C@@H]1CC[C@H](C(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)C1	1803130475	QSDPXOIFJUCDAP-KVDVXYDOSA-N	437.924	1.276	50	20	IDGD	
COc1ncccc1CCC(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]1c1cccnc1	1803141594	PXOKHTADWBJNKR-QWFCFKBJSA-N	446.935	1.724	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1cc(F)ccc1[N+](=O)[O-]	1804314951	JUYGBDPUQICQIH-BJWYYQGGSA-N	449.483	1.288	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C12CC(c3ccccc3)(C1)C2)c1cccc(B(O)O)c1	1804575085	FRVSEDLRENYONM-GPCVTYTCSA-N	444.340	1.740	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)[C@H]1CNc2ccccc21	1807173029	WWTGRILYFVVBBX-UUXHPUJUSA-N	428.920	1.896	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)c2cnc[nH]2)[C@@H]1c1cccnc1	1808414305	HEMIOWUCUOMDQM-PAAWNMQJSA-N	448.487	1.258	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)C3(c4ccccc4)CC3)CC2)C1	1809968269	USMRWDCEQRKIIB-UHFFFAOYSA-N	446.356	1.943	50	20	IDGD	
CSCC(C)(C)C(=O)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1	1809968742	CELOJFFKUDZBKG-UHFFFAOYSA-N	432.395	1.600	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)c1cncc2cnccc12	1811295754	TYFARWKHEOCIBP-CWFSZBLJSA-N	439.903	1.944	50	20	IDGD	
Cc1ccn(C)c1C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1811606634	LYNVDDVPOQNGLM-SIKLNZKXSA-N	446.316	1.042	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)c1cc2cccnn2c1	1812187122	MMJBGEXKRVDNNJ-KFKAGJAMSA-N	427.892	1.649	50	20	IDGD	
CCOC(=O)C1(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](Cl)COC)[C@H]2c2cccnc2)CC1	1812468059	MYYILLGJQHUMSB-ULQDDVLXSA-N	437.924	1.685	50	20	IDGD	
CC(=O)N[C@H](C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](O)CCl)n[nH]1)C(C)(C)C	1814863990	FCSKXMKWLFHJLG-SQWLQELKSA-N	427.933	1.552	50	20	IDGD	
O=C(NCCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](O)CCl)n[nH]1)c1ccccc1	1814875794	IRYHXDKVJVCRFG-IAGOWNOFSA-N	447.923	1.822	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1cscn1	1816485920	DCANGMCFMNHCSD-INIZCTEOSA-N	425.279	1.166	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2C[C@@H]2F)[nH]n1	1818111007	XZTFQQCCJNJFHE-NRGKRRITSA-N	429.456	1.894	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)C2=NNC(=O)C2)n[nH]1	1819338570	RMZAKSHHMVKCQZ-BXKDBHETSA-N	425.287	1.309	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](O)N2CCOCC2)n[nH]1	1819441869	OJJCZIGFOKSQLK-YOEHRIQHSA-N	427.933	1.317	50	20	IDGD	
Cc1c(C(=O)Nc2cc([C@H]3CCCCN3C(=O)[C@H](F)Cl)[nH]n2)cn2[nH]cnc(=O)c12	1820117492	HWORVRXRNHIBTQ-DOMZBBRYSA-N	435.847	1.894	50	20	IDGD	
O=C(O)CSCC(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](F)Br)n[nH]1	1820936421	BZVKQWFGQLUEOP-ZANVPECISA-N	437.291	1.910	50	20	IDGD	
Cc1nc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)cs1	1822412977	MGRYCVVINLGSJQ-HNNXBMFYSA-N	433.538	1.854	50	20	IDGD	
Cc1nnsc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1	1822413965	JKOPQYVLJLGLSQ-CYBMUJFWSA-N	434.526	1.249	50	20	IDGD	
C=C(CC(=O)OCC)C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](Cl)COC)sc2C1	1826007018	POEHPLWCMKJUQL-RYUDHWBXSA-N	429.926	1.818	50	20	IDGD	
O=C(CN1C(=O)C=CC1=O)N1CCC([C@@H]2CCCCN2C(=O)CCBr)CC1	1826360566	OSOIUMDKFKBYLT-HNNXBMFYSA-N	440.338	1.316	50	20	IDGD	
Cc1ccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)c(C)n1	1827052620	SDUDDVZZXYQTKU-HSZRJFAPSA-N	449.360	1.925	50	20	IDGD	
CC(C)[C@H](S)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827055561	CZJFYFNXPGAJDO-UXHICEINSA-N	432.395	1.554	50	20	IDGD	
Cc1ccc2[nH]cc(CC(=O)N3CCOC[C@@]4(C3)CN(C(=O)[C@H](O)CCl)CCO4)c2c1	1830726202	PJBUHTYQTBHIQY-DENIHFKCSA-N	449.935	1.075	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3n[nH]c(CC)c3F)C2)C1	1831644115	OPSOOIAZBBRFPX-ORAYPTAESA-N	430.908	1.589	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccnn3C(C)C)C2)C1	1831649710	ANDOJFGZUCEPEF-OXQOHEQNSA-N	426.945	1.942	50	20	IDGD	
COC[C@H](NC(C)=O)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](C)Br)CC1	1831655342	OCZPCBXKSCARGX-COXVUDFISA-N	446.386	1.541	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCn3nc(C)cc3C)C2)C1	1831656673	HEPRIYPNBIURRH-NQIIRXRSSA-N	440.972	1.754	50	20	IDGD	
CSCC[C@@H](O)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1	1831898151	KGNAZNCCQQGQMA-ZWKOTPCHSA-N	442.626	1.093	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)CS[C@@H]3CCCCO3)CC2)CC1)[C@@H](O)CCl	1833311795	DZSSNOSQERTVDX-PKOBYXMFSA-N	448.029	1.418	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)c3cc(=O)ccn3C)CC2)CC1	1833533855	SRTDZLGWUUYLLE-LJQANCHMSA-N	436.984	1.978	50	20	IDGD	
Cc1nocc1C(=O)N1CCC(N2CCC(NC(=O)CCBr)CC2)CC1	1834421246	WMBKGPXKZGJXMB-UHFFFAOYSA-N	427.343	1.953	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccccc3Cl)CCO2)C1	1835013669	FMIJLGQOSFPYMM-FXAWDEMLSA-N	445.343	1.593	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)NCCC#N)CCO2	1835674699	FCRPIMXXLVIOJL-JXFKEZNVSA-N	428.961	1.132	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cn3cc(Cl)cn3)CCO2)C1	1835969421	IAFXIBPAZYCHSB-YJBOKZPZSA-N	433.336	1.400	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3cncnc3)CCO2)C1	1836053176	WAEIZSFFIKUBNU-RTBURBONSA-N	445.347	1.102	50	20	IDGD	
O=C(c1cccn2nccc12)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836719530	VUMSGOJXIIIXCA-LJQANCHMSA-N	434.924	1.546	50	20	IDGD	
O=C(CN1CCCCC1=O)N1CCC(OC2CCN(C(=O)C(Cl)Cl)CC2)CC1	1838781192	OVSABLWKLPYIDV-UHFFFAOYSA-N	434.364	1.801	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccncc3)CCO2)C1	1839061453	VHOSCRRDVGELNN-APWZRJJASA-N	440.338	1.254	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(CO)c(F)c3)C2)C1	1839149683	OFUSCFMHLOOOHL-OXQOHEQNSA-N	428.888	1.405	50	20	IDGD	
C[C@H](Cc1ccco1)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](F)Br)CCO2)C1	1839203450	LMXNHEOSPLAAQG-XUWXXGDYSA-N	447.301	1.605	50	20	IDGD	
Cc1cc(F)cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)c1	1839284425	CWWPSHRXDKGBFS-LIRRHRJNSA-N	443.313	1.988	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H]3[C@H]4C=CS[C@@H]43)CCO2)C1	1839699817	VSHVVGBHCLSEIB-ZVPUSRDESA-N	435.373	1.554	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)C[C@@H]3C[C@@H]4CC[C@H]3C4)CCO2)C1	1839915836	BIBHSQPLQKOLGE-XNXCGYLDSA-N	428.957	1.523	50	20	IDGD	
COC1(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)CCC1	1840036303	IPPPPBBNKIXITG-KBXCAEBGSA-N	433.343	1.185	50	20	IDGD	
O=C(c1cc(C(F)F)no1)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840187928	FSMXCOJYJQDQHS-OAHLLOKOSA-N	428.219	1.486	50	20	IDGD	
C[C@H](Cc1ccccn1)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1840335831	XVCJOLCDGDMOSU-KUHUBIRLSA-N	430.332	1.520	50	20	IDGD	
Cc1ncc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)s1	1840397518	FZAMHAMMVLWXKP-IBGZPJMESA-N	429.970	1.715	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc([C@H](C)C#N)c3)CCO2)C1	1840716722	RCNJIKNZUXKDBA-GTCCEBARSA-N	449.935	1.637	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC2(CCCN2C(=O)c2cc(=O)nc3sccn23)C1	1844625128	CORVIVDPJZTAQZ-INIZCTEOSA-N	429.329	1.809	50	20	IDGD	
O=C(c1ccc([N+](=O)[O-])c2c1OCO2)N1CC2(CCCN2C(=O)[C@H](F)Br)C1	1845218658	SNQYNLJRFOCAMU-ZDUSSCGKSA-N	444.213	1.831	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl)C(C)(C)C	1847559741	KMVFVAFQVSXAKQ-BYNSBNAKSA-N	431.961	1.727	50	20	IDGD	
O=Cc1ccccc1-c1cncc(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](O)CCl)c1	1847563714	OWDYFNRQBZESTA-UFYCRDLUSA-N	427.888	1.976	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)N1CCN(S(=O)(=O)c2ccccc2)CC1	9746326	LZQZLHBZVKSQKO-UHFFFAOYSA-N	442.501	1.004	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Cc2ccc3c(c2)CCO3)c1	11331125	YDDOGRRUMVONON-UHFFFAOYSA-N	431.514	1.656	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)Cc2nc3ccccc3n2C)c([N+](=O)[O-])cc1OC	16179109	MCFWFLMGXOWYNT-UHFFFAOYSA-N	427.417	1.893	50	20	IDGD	
COc1ccc(C(=O)NNc2nnc(C)c(O)n2)cc1S(=O)(=O)N1CCCCCC1	23310569	NLCLMFICOGEQJH-UHFFFAOYSA-N	436.494	1.216	50	20	IDGD	
CCCOc1ccc(C(=O)NNS(=O)(=O)c2ccc3c(c2)NC(=O)CO3)cc1OC	137734866	GTBZDYMIMOBHDI-UHFFFAOYSA-N	435.458	1.438	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CNc2ccc(C)cc2)cc1S(=O)(=O)NC1CC1	196485601	IFEBBPZZAHPXQE-UHFFFAOYSA-N	432.502	1.317	50	20	IDGD	
CC(=O)N(CCC(=O)NNC(=O)c1csc(N2CCOCC2)n1)Cc1ccccc1	726157189	LQQSZHZPGHTLOI-UHFFFAOYSA-N	431.518	1.180	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)CNS(=O)(=O)c3ccc4c(c3)COC4)cc2C1	726381952	KKIXSGXHHDRNIH-GFCCVEGCSA-N	449.554	1.643	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccc(F)cc2F)CC1)NNC(=O)c1ccccc1Cl	726971469	KSVMJXJKPNSMAE-UHFFFAOYSA-N	436.846	1.837	50	20	IDGD	
CC(C)c1ccccc1NC(=S)NNC(=O)[C@@H]1CC(=O)N(CCN2CCOCC2)C1	727172483	GKNUWXVQFXBJKP-MRXNPFEDSA-N	433.578	1.308	50	20	IDGD	
CNS(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=O)c2cccc(OC(F)F)c2)c1	728546196	ZHCQLVAUYVANNE-UHFFFAOYSA-N	433.820	1.924	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2cccc(NC(=O)NC3CC3)c2)n1	728733543	XIFFPVAIXPGSQW-UHFFFAOYSA-N	431.474	1.282	50	20	IDGD	
O=C(COc1cccc(N2CCCC2=O)c1)NNC(=O)C1CCN(c2ncccn2)CC1	728847459	GLIUIGQQWAKXKU-UHFFFAOYSA-N	438.488	1.046	50	20	IDGD	
COc1cc(OC)c(CCNC(=O)NNC(=O)c2ccc(OC)c(OC)c2)c(OC)c1	731044397	QOUUHYTZXCSVEV-UHFFFAOYSA-N	433.461	1.916	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(C)c(C(=O)NNC(=O)C(C)(C)c2ccccc2)c1	731201128	IJKAXVWHTNLMES-UHFFFAOYSA-N	433.530	1.659	50	20	IDGD	
O=Cc1ccc(OCC(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)c([N+](=O)[O-])c1	731735883	UFOVSLKTNXQWPX-UHFFFAOYSA-N	435.776	1.444	50	20	IDGD	
COc1ccc(C(=O)NNC(=S)NCCCN2CCOCC2)cc1Br	731950582	WLULHQBEQVBAEE-UHFFFAOYSA-N	431.356	1.289	50	20	IDGD	
O=C(CNS(=O)(=O)c1cccc(C(F)(F)F)c1)NNc1nc(-c2cccnc2)no1	732110603	GKBOVODFIKTBGE-UHFFFAOYSA-N	442.379	1.572	50	20	IDGD	
C[C@@H](CC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1)C(=O)c1ccccc1	732829576	AWQBCIKSFFIBJI-KRWDZBQOSA-N	444.557	1.975	50	20	IDGD	
O=C(NNc1nc(-c2ccc(Cl)cc2)no1)C1CCN(c2ccc3nnnn3n2)CC1	732977961	WXEGFFWHDXNZLX-UHFFFAOYSA-N	440.855	1.582	50	20	IDGD	
Cc1ccc(N2C[C@@H](C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)CC2=O)cc1F	734241897	MHCGJNXCNBOPKK-ZDUSSCGKSA-N	437.472	1.342	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)N[C@H]2CCN(C3CCN(C)CC3)C2)cc1	734284066	PVFSAWHJZUKAOT-IRXDYDNUSA-N	433.553	1.352	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(C(C)=NNC(=O)NCCNC(=O)OC(C)(C)C)cc1	734304129	RMRAUMNKWNCWBV-UHFFFAOYSA-N	427.527	1.996	50	20	IDGD	
Cc1nc(-c2cnn(C)c2)sc1C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	734322362	RXXSXJCJRNQQGW-UHFFFAOYSA-N	426.506	1.320	50	20	IDGD	
C[C@@H]1CN(Cc2ccccn2)CCC1=NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	734361865	JRHJSFCXXBKDAS-MRXNPFEDSA-N	429.546	1.960	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)N[C@@H]2CCCc3nc(C)ncc32)nc1	734950549	MBOZWXMZBLUCCQ-QGZVFWFLSA-N	433.538	1.914	50	20	IDGD	
CC(=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O)c1ccc(SC(F)F)cc1	734978880	WNJSCRZVFYBULT-UHFFFAOYSA-N	429.474	1.426	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)c2ccccc2SCC(N)=O)cc1C	736752951	XVGBYPJPGOPERH-UHFFFAOYSA-N	435.527	1.814	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2Cc3cc(F)ccc3O2)c1	740812290	BJSXVHMVJVTPSH-SFHVURJKSA-N	435.477	1.621	50	20	IDGD	
CC(=NNC(=O)Cc1cc(O)nc(S)n1)c1ccc(S(=O)(=O)CC(F)F)cc1	741758113	ADCUDZFIQZSXEF-UHFFFAOYSA-N	430.458	1.593	50	20	IDGD	
O=C(NCc1nnnn1C1CC1)NNC(=O)Nc1ccc(Br)cc1Cl	743697148	AVAHNNDWFUFLFZ-UHFFFAOYSA-N	429.666	1.960	50	20	IDGD	
C[C@H](CC(=O)NNC(=O)NCc1ccc(Cl)cc1)/N=C1/NS(=O)(=O)c2ccccc21	743822663	BLRIUSLAVKLCHN-GFCCVEGCSA-N	449.920	1.688	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)CCNS(=O)(=O)/C=C\c2ccccc2)c1	744561177	OGWSCLNIEFJGDM-QBFSEMIESA-N	445.497	1.280	50	20	IDGD	
Cc1cc(C)c(N2C[C@H](C(=O)OCC(=O)NNC(=O)c3cccc(C#N)c3)CC2=O)c(C)c1	744699480	WNAKUMGVYMGRHZ-LJQANCHMSA-N	448.479	1.841	50	20	IDGD	
COc1ccc(CN2CC[C@@H](NC(=O)NNC(=O)c3cc([N+](=O)[O-])ccc3O)C2=O)cc1	745829430	ZRHKOGWOCPBCCF-MRXNPFEDSA-N	443.416	1.054	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2sc(-c3ccccc3)nc2C)cn1C	745977598	ZSTSMXUDWXOKKP-UHFFFAOYSA-N	434.499	1.867	50	20	IDGD	
O=C(NNC(=O)N1CCOCC1)c1ccccc1NS(=O)(=O)c1ccc(F)c(F)c1	745991605	ACDPBXKQPOSZIF-UHFFFAOYSA-N	440.428	1.452	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)c1cc2c(s1)CC[C@@H](C)C2)N1C(=O)[C@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O	746100489	NBXQXRWOAMQMAM-SWPMLPDNSA-N	431.514	1.185	50	20	IDGD	
CC(C)[C@H](NC(=O)NC(C)(C)C)C(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	747042310	RHRPHDLWCINWRL-HNNXBMFYSA-N	437.453	1.021	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)Cn2cnc3ccc(Br)cc3c2=O)cc1	747171928	WDDVROMOXWFGMB-UHFFFAOYSA-N	426.230	1.492	50	20	IDGD	
O=C(NNc1ccc(F)cc1Br)[C@@H]1CC(=O)N(CCN2CCOCC2)C1	748075399	YCGWWUPHPUCYOY-GFCCVEGCSA-N	429.290	1.212	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@](F)(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)C1	748287741	RDYATNDISHZNQL-GOSISDBHSA-N	443.501	1.090	50	20	IDGD	
COC(=O)c1cc(OC)c(S(=O)(=O)NNC(=O)c2ccc(Cl)cc2OC)s1	748791420	SORPPIHEAOFARV-UHFFFAOYSA-N	434.879	1.829	50	20	IDGD	
N#CCNC(=O)/C(C#N)=C/c1cn(CCC(N)=O)nc1-c1cccc(Br)c1	749608242	BEVFJVLZUXAQAL-MDWZMJQESA-N	427.262	1.735	50	20	IDGD	
O=C(CCOc1ccccc1Br)NNC(=O)CNC(=O)c1cccs1	751206406	LCSSVNRVABQKLU-UHFFFAOYSA-N	426.292	1.857	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1ccc(=O)n(-c2cccc(F)c2)c1	751271881	KGTDZYHLCNFUFM-UHFFFAOYSA-N	436.447	1.444	50	20	IDGD	
O=C(Cc1ccc(Br)c(F)c1)NNC(=O)c1csc(N2CCOCC2)n1	751546916	QURQECFQZRIWMF-UHFFFAOYSA-N	443.298	1.885	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)[C@H](c1ccccc1)N1CCC(O)CC1	752387575	CWWDTYCIHXSNPJ-KRWDZBQOSA-N	435.525	1.040	50	20	IDGD	
N#Cc1cc(Br)cc(S(=O)(=O)NNC(=O)c2ccc3c(c2)OCCO3)c1	754259491	RODUWIYXKPRIBU-UHFFFAOYSA-N	438.259	1.715	50	20	IDGD	
O=C(CO)NNC(=O)Nc1cc(S(=O)(=O)N2CCCCC2)ccc1Oc1ccccc1	755436132	ZDFNFHXGABTERR-UHFFFAOYSA-N	448.501	1.799	50	20	IDGD	
COC(=O)CN1CCN(c2ccc(NC(=O)NNC(=O)c3ccc(Cl)nc3)cc2)CC1	756393639	OSKQRCLIMBYYFG-UHFFFAOYSA-N	446.895	1.497	50	20	IDGD	
CCS(=O)(=O)N1CCC(CNC(=O)NNC(=O)CCc2ccc(OC)cc2)CC1	758741160	DJMKLSOOYHTUSC-UHFFFAOYSA-N	426.539	1.020	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@H](NC(=O)NNC(=O)C(=O)Nc1ccccn1)C1CCCCC1	758762899	GLJQEDBLEGBLLV-HNNXBMFYSA-N	448.524	1.824	50	20	IDGD	
COCCS(=O)(=O)c1ccc(CNC(=O)NNC(=O)Cc2c[nH]c3ccccc23)cc1	759378732	ITWIIEDBUKPAEM-UHFFFAOYSA-N	444.513	1.661	50	20	IDGD	
Cc1cc(C)nc(-n2nccc2NC(=O)C(=O)NNC(=O)c2cc3ccccc3cc2O)n1	760280651	WFZIPKKAMIKWEQ-UHFFFAOYSA-N	445.439	1.538	50	20	IDGD	
CS(=O)(=O)CCn1cccc(NC(=O)C(=O)NNc2ccc(Cl)cc2Cl)c1=O	762229261	NJEGHMTWGLHSIC-UHFFFAOYSA-N	447.300	1.282	50	20	IDGD	
COc1ccc(C[C@@H](C)CNC(=O)NNC(=O)CNC(=O)c2cccs2)cc1OC	762572306	YSZRPFQVFKVOTJ-CYBMUJFWSA-N	434.518	1.704	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)NC[C@@H]1CCN(C)[C@@H]1c1ccc(Cl)c(F)c1	763090264	BDNMPOTUGUUDSQ-HACGYAERSA-N	430.908	1.854	50	20	IDGD	
CN(C)C(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc3ccccc3cc2O)cc1	763527513	OQFDDXOLJZJVLW-UHFFFAOYSA-N	434.452	1.576	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2ccccc2O)cccc1S(=O)(=O)NC(C)(C)C	763529911	YUJQDXHYSQDAEH-UHFFFAOYSA-N	448.501	1.177	50	20	IDGD	
O=C(NNC(=O)C1CC1)C(=O)Nc1ccc(NC(=O)[C@H]2CCCO2)cc1C(F)(F)F	763559058	XLDNMSKUCPXCIR-CYBMUJFWSA-N	428.367	1.319	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)[nH]n1)C(=O)Nc1cccc(N2CCCC2=O)c1	763603877	BMJZDSMCLWZHOR-UHFFFAOYSA-N	432.440	1.603	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)N[C@H]1CCCC[C@@H]1N1CCOCC1	763661418	WFLSJLBPSWUVLA-IRXDYDNUSA-N	428.493	1.165	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccccc2C(=O)NC(C)(C)C)cc1	763662652	YQLKZICCPNSWRL-UHFFFAOYSA-N	442.472	1.388	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(OCCN(C)C)cc2)cc1C	763681270	VQMIHFHAVKPIOD-UHFFFAOYSA-N	428.489	1.409	50	20	IDGD	
COC(=O)c1c(C2CC2)csc1NC(=O)C(=O)NNC(=O)c1cccc(N(C)C)c1	763754837	VSJKEAJHZMBGHM-UHFFFAOYSA-N	430.486	1.878	50	20	IDGD	
CC(=O)N1CCCc2cc(NC(=O)C(=O)NNC(=O)Cc3c[nH]c4ccccc34)ccc21	763856949	JFRJRDBUWMZIPR-UHFFFAOYSA-N	433.468	1.796	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1cccn(CC(F)(F)F)c1=O	763866095	TWGOGFAQMWTFQQ-JTQLQIEISA-N	444.341	1.103	50	20	IDGD	
CCOC(=O)/C=C/c1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)cc1	763872876	PODNBRHFKQBBMZ-YGLIYXGISA-N	443.431	1.955	50	20	IDGD	
Cc1cc(S(C)(=O)=O)ccc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccccc2)on1	764003164	AOTKRFJZJXJENU-UHFFFAOYSA-N	442.453	1.453	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)Nc1ccc(SC(F)F)nc1	764004599	IQEZNZMQNICOLK-UHFFFAOYSA-N	448.249	1.897	50	20	IDGD	
O=C(Cc1cccc2ccccc12)NNC(=O)C(=O)Nc1cccc(Cn2cncn2)c1	764028250	MEXDBUJZTDFTBO-UHFFFAOYSA-N	428.452	1.808	50	20	IDGD	
CCCc1cc(NC(=O)C(=O)NNC(=O)c2ccc(F)cc2Br)n(C)n1	764084790	WIMZMNUJQOTPOA-UHFFFAOYSA-N	426.246	1.674	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2ccc(N3CCO[C@@H](C)C3)cc2)cc1	764128108	ZKEIYOKDSVIZLW-INIZCTEOSA-N	440.500	1.639	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(N3CCSCC3)cc2C)c1O	764132652	OZTUKXISXNJAMS-UHFFFAOYSA-N	444.513	1.662	50	20	IDGD	
CS(=O)(=O)Cc1ccccc1NC(=O)C(=O)NNC(=O)c1c(Cl)cccc1Cl	764221351	NRIWIADGSSAQOF-UHFFFAOYSA-N	444.296	1.938	50	20	IDGD	
COc1ccc(NC(=O)c2ccc(NC(=O)C(=O)NNC(=O)Cc3ccccn3)cc2)cc1	764263318	FBBAGYANVWUCSZ-UHFFFAOYSA-N	447.451	1.671	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)CCc2ccccc2O)cccc1C(=O)N1CCCC1	764280513	BEAHRLNLSHHHSI-UHFFFAOYSA-N	438.484	1.655	50	20	IDGD	
O=C(NNC(=O)c1cc2ccccc2o1)C(=O)Nc1ccc(NC(=O)[C@H]2CCCO2)cc1	764332362	RIVWNYDKAVFWME-QGZVFWFLSA-N	436.424	1.950	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)COCc2ccccc2)cc1N1CCOC1=O	764368530	YAKIVLPANIGWPD-UHFFFAOYSA-N	426.429	1.254	50	20	IDGD	
CCn1c(NNC(=O)[C@@H](C)NS(=O)(=O)c2ccc(C#N)cc2)nc2ccccc2c1=O	764717521	QVLYNLKZNXDHSF-CYBMUJFWSA-N	440.485	1.098	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1ccc(C(F)(F)F)cc1	765738447	KHGMRQZYOJDIJW-UHFFFAOYSA-N	434.418	1.924	50	20	IDGD	
COc1ccc(CC(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)cc1F	765755920	JCLZAIFMDBKAOX-UHFFFAOYSA-N	448.926	1.995	50	20	IDGD	
O=C(NNC(=O)[C@@H]1C[C@@H]1c1cc(F)c(F)c(F)c1)c1csc(N2CCOCC2)n1	766630107	MSYWEOUWVASBDM-GHMZBOCLSA-N	426.420	1.962	50	20	IDGD	
Cc1ccn2ncc(C(=O)NNC(=O)CN3CCN(Cc4ccccc4Cl)CC3)c2c1	766858699	GLVKNNXFBPAYHZ-UHFFFAOYSA-N	440.935	1.875	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)c2ncccc12	768236389	BRDPBISWQKHXPT-UHFFFAOYSA-N	433.424	1.670	50	20	IDGD	
CC(C)(O)C(=O)NNC(=O)c1nnn(-c2ccc(Br)cc2)c1C(F)(F)F	768255240	HFOYXXIKGLYYDZ-UHFFFAOYSA-N	436.188	1.581	50	20	IDGD	
CCCS(=O)(=O)N1CCCC[C@H]1C(=O)NNC(=O)c1cc(-c2cccs2)[nH]n1	768261410	SWTJNRKJHDNGPD-AWEZNQCLSA-N	425.536	1.494	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(\C#N)C(=O)OCC(=O)N2CCN(C(C)=O)CC2)c1C	768747431	LECCGYWKTCENDX-YODDIOPGSA-N	430.505	1.453	50	20	IDGD	
C[C@H]1CCCN(C(=O)C(=O)NNC(=O)c2nc(-c3ccccc3)n(-c3ccccc3)n2)C1	769675071	KGVMVEOZESMGSA-INIZCTEOSA-N	432.484	1.954	50	20	IDGD	
CSCCNC(=S)NNC(=O)c1ccc(S(=O)(=O)N2CCC[C@H](C)C2)cc1	769770785	ZFWRKZZLRMQTOO-ZDUSSCGKSA-N	430.621	1.579	50	20	IDGD	
CC(C)OCCCn1c(NNC(=O)c2cnc(O)c([N+](=O)[O-])c2)nc2ccccc2c1=O	770428642	YVPHJKDEIYSRBB-UHFFFAOYSA-N	442.432	1.977	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1cccc(C(F)(F)F)c1)C(=O)NNC(=O)Cc1ccc(F)cc1	770952123	YWEMLLNMZYPOFP-LLVKDONJSA-N	447.410	1.901	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2cc(C)c(Br)cn2)c1	773525191	LTXBVAUHGXQHNT-UHFFFAOYSA-N	435.278	1.934	50	20	IDGD	
CCOC(=O)Cn1cccc(NC(=O)C(=O)NNc2cccc(C(F)(F)F)c2)c1=O	773749712	BTRFUPAUDYPDHJ-UHFFFAOYSA-N	426.351	1.512	50	20	IDGD	
CO[C@H]1CCC[C@@H]1CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	775459738	PDDVJIJQBJVTJA-AEFFLSMTSA-N	438.550	1.620	50	20	IDGD	
COc1cc([C@@H](NC(=O)NNC(=O)c2cnn(C)c2)C(F)(F)F)cc(OC)c1OC	775999084	HFZQKWQYGKXSDY-CQSZACIVSA-N	431.371	1.694	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@@H](C)C2CN(C(=O)OC(C)(C)C)C2)cc(OC)c1OC	776318182	QHDJMIUENQZNFN-LBPRGKRZSA-N	437.493	1.976	50	20	IDGD	
CCO[C@@H]1C[C@H](NC(=O)NNC(=O)[C@H](C)Oc2cccc(Br)c2)[C@@H]1OC	776473685	OPQYFTAZSBKOOO-HPEDKQMDSA-N	430.299	1.739	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCCC(=O)NNc2cccc(S(C)(=O)=O)c2)cc1C	776529232	ZLDVRHKJVDRNQY-UHFFFAOYSA-N	425.532	1.519	50	20	IDGD	
Cc1nn(-c2ccccc2)c2sc(C(=O)NNC(=O)NCC(=O)N3CCOCC3)cc12	776637400	RTXKRQRHWJMSTG-UHFFFAOYSA-N	442.501	1.198	50	20	IDGD	
COc1ccc(N2C[C@@H](C(=O)NNc3cccc(S(C)(=O)=O)c3)CC2=O)c(OC)c1	776720833	IOOOPTWHXVPXQT-ZDUSSCGKSA-N	433.486	1.604	50	20	IDGD	
O=C(NNC(=O)[C@]1(F)CCN(C(=O)OCc2ccccc2)C1)[C@H]1COc2ccccc2O1	776739512	SEJZKZRCNPNFCJ-GCJKJVERSA-N	443.431	1.725	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)CNC(=O)OC(C)(C)C)c(Cl)c1Cl	777940918	PEYJXZDGUNRAPM-UHFFFAOYSA-N	428.294	1.836	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)[C@H](CC(C)C)N2C(=O)[C@@H]3CC=CC[C@H]3C2=O)nc1C	778428563	NMEKOWQEVDIBBD-INMHGKMJSA-N	443.504	1.771	50	20	IDGD	
CC(C)N(CC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)CC(=O)Nc1ccc(F)cc1	778515776	PGARLDNNVJOLOQ-UHFFFAOYSA-N	431.424	1.844	50	20	IDGD	
CCCn1nc(C(=O)NNS(=O)(=O)c2ccccc2COC)c2ccccc2c1=O	778555629	ATJPGNIETUPUHG-UHFFFAOYSA-N	430.486	1.576	50	20	IDGD	
O=C(NNc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(C(=O)N2CCOCC2)c(F)c1	778724825	VXBVUNHJPKHTRJ-UHFFFAOYSA-N	431.380	1.288	50	20	IDGD	
Cc1nn(C)c(-n2cccn2)c1C(=O)NNc1ccccc1S(=O)(=O)NC(C)(C)C	779011314	FYCVXRRHTKCNMR-UHFFFAOYSA-N	431.522	1.748	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)Nc2cccc(S(=O)(=O)N3CCN(C)CC3)c2)c1	780520711	BSHNVWOJBKNANJ-UHFFFAOYSA-N	447.517	1.558	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NN=Cc3cc(Br)nn3C)CC2)cc1	782251397	DZIKWESLQGSGTJ-UHFFFAOYSA-N	433.354	1.759	50	20	IDGD	
CC(C)CCNS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(O)cc2)cc1	782833064	BTNFSHRSSBKVJB-UHFFFAOYSA-N	448.501	1.116	50	20	IDGD	
O=C(NNc1cc(Cl)ccc1Cl)C(=O)Nc1ccn(CC(=O)N2CCOCC2)n1	783368459	WLYHHUWEIIGMMC-UHFFFAOYSA-N	441.275	1.131	50	20	IDGD	
Cc1c(C(C)(C)C)nn(-c2ccccc2)c1NC(=O)C(=O)NN[C@]1(C)CCS(=O)(=O)C1	783428480	WPJQHFAMPAUBHT-OAQYLSRUSA-N	447.561	1.615	50	20	IDGD	
CCCCn1nc(C(=O)NN=Cc2cn(Cc3cccnc3)nn2)c2ccccc2c1=O	783806788	OHBUADKTRSARQQ-UHFFFAOYSA-N	430.472	1.995	50	20	IDGD	
Cc1nc(Cn2cc(C(=O)NNC(=O)[C@@H](C)Oc3c(C)cc(Cl)cc3C)nn2)no1	784724278	QSABDUHPZGMYHW-LLVKDONJSA-N	433.856	1.517	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(NC(=O)C(=O)NNc2ccc(Cl)nn2)ccc1C	784789715	NQQNYCKYRXMNDX-UHFFFAOYSA-N	440.913	1.551	50	20	IDGD	
CN1C(=O)c2ccc(NC(=O)C(=O)NNc3ccc(F)cc3Br)cc2C1=O	784803270	JDZZDMANYLZTEM-UHFFFAOYSA-N	435.209	1.896	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)cnn1CC(C)C	784835772	WIFIVALWETVOSD-UHFFFAOYSA-N	429.449	1.926	50	20	IDGD	
NC(=O)COc1ccc(NC(=O)C(=O)NNc2c(F)cc(F)cc2Br)cc1	785011361	YOCLEYVNUDJUFO-UHFFFAOYSA-N	443.204	1.673	50	20	IDGD	
Cn1c(C(C)(C)C)nc2cc(NC(=O)C(=O)NNC(=O)Cc3cn4ccccc4n3)ccc21	785061175	UICYEXXVTAPBPO-UHFFFAOYSA-N	447.499	1.847	50	20	IDGD	
COc1ccc2nc(NNC(=O)C(=O)Nc3cccc(-n4cnnn4)c3C)c(C)cc2c1	785163798	JLJMFNPQCYJSQR-UHFFFAOYSA-N	432.444	1.918	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@]2(O)CCc3ccccc3C2)c1	785671145	XFPACCVMXGPLQZ-QFIPXVFZSA-N	445.541	1.398	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NN[C@@]2(C)CCS(=O)(=O)C2)c(OCc2ccccc2)c1	785991906	HLACDTQHYHWYQA-NRFANRHFSA-N	447.513	1.411	50	20	IDGD	
Cc1ccc(-n2cc(NC(=O)C(=O)NNC(=O)c3cc([N+](=O)[O-])ccc3O)cn2)c(C)c1	786429057	KNFQRNXYWALINH-UHFFFAOYSA-N	438.400	1.503	50	20	IDGD	
CC1(NC(=S)NNC(=O)c2cc(S(=O)(=O)NCc3ccccc3)ccc2O)CC1	789176801	CFARZASLJXJMCP-UHFFFAOYSA-N	434.543	1.532	50	20	IDGD	
CN(Cc1ccccc1NC(=O)C(=O)NN[C@]1(C)CCS(=O)(=O)C1)c1ccccc1	789751211	STYLFDDDMYWUSH-OAQYLSRUSA-N	430.530	1.460	50	20	IDGD	
O=C(NNC(=O)c1ccc(Br)s1)C(=O)Nc1cccc(N2CCC2=O)c1	790952773	VEWXZVODGIBTQD-UHFFFAOYSA-N	437.275	1.647	50	20	IDGD	
O=C(NNC(=O)c1ccccc1Br)C(=O)Nc1cccc(N2CCC2=O)c1	790955987	BQXBEIHUMHBYLE-UHFFFAOYSA-N	431.246	1.586	50	20	IDGD	
O=C(Cc1csc2ccc(Br)cc12)NNC(=O)N[C@H]1CCS(=O)(=O)C1	792083191	IMAQLUJSHBONKZ-NSHDSACASA-N	446.348	1.724	50	20	IDGD	
O=C(NC[C@@H]1CCN(Cc2ccccc2)C1)NNC(=O)c1csc(N2CCOCC2)n1	792229771	YPMQMCHRQRAUQL-KRWDZBQOSA-N	444.561	1.446	50	20	IDGD	
CN(C)N(C(=O)C[C@H](NC(=O)c1ccc(O)cc1)c1ccccc1)[C@@H]1CCS(=O)(=O)C1	792853629	FZQKYRBQWLLASS-QUCCMNQESA-N	445.541	1.746	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)c2cnn(CCO)c2-c2ccccc2)c1	793032466	LNZOXGBRVDEUKE-UHFFFAOYSA-N	428.470	1.021	50	20	IDGD	
CCn1ncnc1CNC(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	793457679	NCHFWFFRKJIVMR-UHFFFAOYSA-N	446.475	1.144	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2c(F)c(F)cc(F)c2F)cc(OC)c1OC	795281118	PNVLQIMBSHSQEO-UHFFFAOYSA-N	438.355	1.892	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN[C@@H]2[C@H](C)CCN(C(=O)OC(C)(C)C)[C@@H]2C)n1	796649842	IQBLEQMDFYDCKF-RVZJWNSFSA-N	439.582	1.765	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(F)c(N2CCOC2=O)c1	796989878	JYVOTLQUDMPKJC-UHFFFAOYSA-N	444.419	1.510	50	20	IDGD	
O=C(NC[C@H]1CCC(F)(F)C1)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	797550876	HAXVKVBUXBYCDK-ZDUSSCGKSA-N	446.476	1.087	50	20	IDGD	
COc1cncc(S(=O)(=O)NNC(=O)c2ccc(CSc3nncn3C)cc2)c1	799120648	QVDSRJFGWBTOOO-UHFFFAOYSA-N	434.503	1.134	50	20	IDGD	
CC(C)(C)OC(=O)NCC[C@@H]1CCCN(CC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)C1	799360278	IDXSUTLPWJDVLZ-HNNXBMFYSA-N	449.508	1.983	50	20	IDGD	
NC(=O)c1cc(Br)cc(S(=O)(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c1	799518236	GXHVMAMVUCFEGL-UHFFFAOYSA-N	443.235	1.080	50	20	IDGD	
CCc1cccc(C)c1NNC(=O)C(=O)Nc1cc(S(=O)(=O)N2CCCC2)ccn1	799843160	PZIFUQXGBVIJFA-UHFFFAOYSA-N	431.518	1.819	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)NCCNS(=O)(=O)c1ccc(F)cc1Cl	801015778	LOTHYGKFBSRFKD-UHFFFAOYSA-N	444.872	1.410	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CC[S@@](=O)c2ccc3c(c2)OCCO3)cc1	801110744	FPBDAHDTPDQAQF-SSEXGKCCSA-N	431.470	1.050	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)Cn2c(O)nc3ccccc3c2=O)c(OC)cc1Cl	802077935	CZPHNOUSEXPOBW-UHFFFAOYSA-N	447.835	1.626	50	20	IDGD	
Cc1ccc(/C=C(\C#N)C(=O)OCC(=O)Nc2cc(C)nn2[C@@H]2CCS(=O)(=O)C2)cc1	802399579	CXWPHJNJAMEGLO-WAFWZSCLSA-N	442.497	1.948	50	20	IDGD	
C=CCn1c(=O)c2ccccc2n2c(SCC(=O)NNc3ncccc3F)nnc12	804213295	KYKXYZVMRXJKOY-UHFFFAOYSA-N	425.449	2.000	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)N1CCN([C@@H]2CCN(Cc3ccccc3)C2)CC1	805096981	HMCIPCSNKCNLBC-HXUWFJFHSA-N	437.544	1.942	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)ncc1Cl)c1csc(N2CCOCC2)n1	806337473	DGFFGOHXWDNBLY-UHFFFAOYSA-N	446.714	1.865	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)Nc2ccc(F)c(S(=O)(=O)NC)c2)o1	806547237	YHYQDWHEBDJVKF-UHFFFAOYSA-N	441.485	1.635	50	20	IDGD	
COCCNC(=O)[C@@H](C)OC(=O)c1ccc(NC(=O)NNC(=O)c2ccc(C)o2)cc1	806750844	MOIDWSCHKGPIPQ-CYBMUJFWSA-N	432.433	1.362	50	20	IDGD	
O=C1COC[C@H](C[C@H]2CN(C(=O)C(=O)NNc3cccc(Cl)c3)c3ccccc32)N1	806984012	KPQZLNFWUIRYNP-BBRMVZONSA-N	428.876	1.819	50	20	IDGD	
O=C1COC[C@H](C[C@H]2CN(C(=O)C(=O)NNc3ccccc3[N+](=O)[O-])c3ccccc32)N1	806984381	JYTATZRFNSCGPP-KBPBESRZSA-N	439.428	1.073	50	20	IDGD	
COc1ccc(CNC(=O)NNC(=O)c2ccc(Cl)cc2F)cc1S(N)(=O)=O	812431279	DMHQBLLXWQTOGV-UHFFFAOYSA-N	430.845	1.279	50	20	IDGD	
CC(=O)N1C[C@H]2[C@@H](NC(=O)NNc3ccc(S(=O)(=O)NC(C)C)cn3)CCC[C@H]2C1	812432100	BLVZPBKQJCMOTD-UAGQMJEPSA-N	438.554	1.041	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)NCCc1c[nH]c2cccc(Br)c12	812513731	WZYZLMRRFHVGTI-LLVKDONJSA-N	427.299	1.855	50	20	IDGD	
Cc1cnc(Br)c(NC(=O)C(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)c1	812987057	JXDQZWDNJYHAOK-UHFFFAOYSA-N	438.194	1.166	50	20	IDGD	
CCn1nncc1C(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2OC)c1	814698268	XFKGEUIUJMXTJY-UHFFFAOYSA-N	444.473	1.182	50	20	IDGD	
CCN(C(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2CCCO2)cc1)c1ccccc1	815778813	GVTUXDYQSOVVBW-LJQANCHMSA-N	438.484	1.547	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)/C=C\CN(C)CC(F)(F)F)CC2)cc1	815827312	UGVZVFNRROLRIY-ARJAWSKDSA-N	441.498	1.310	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)CCn1c(S)nc2ccccc2c1=O	825644181	XJRIZKKWEXIPLJ-UHFFFAOYSA-N	427.486	1.343	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)[C@@H](CSC)N1C(=O)[C@H]2CCCC[C@H]2C1=O	864001343	YEOILBVSDCGZNZ-QLFBSQMISA-N	449.529	1.128	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)c1ccc2ccccc2c1)C(=O)N1CC[C@@H](B(O)O)C1	864232337	ZZYDKACUWOBFHN-AEFFLSMTSA-N	436.364	1.315	50	20	IDGD	
Cc1c(C=NNC(=O)Cc2csc(N3CCOCC3)n2)c(=O)n(-c2ccccc2)n1C	912804361	FVOCRNKYILEVQH-UHFFFAOYSA-N	440.529	1.470	50	20	IDGD	
CC(=O)c1cccc(S(=O)(=O)NCC(=O)NNC(=O)c2cc3c(s2)CC[C@@H](C)C3)c1	913162460	NPNGJXDHLHLWHA-GFCCVEGCSA-N	449.554	1.815	50	20	IDGD	
Cc1cc(C)c(C)c(S(=O)(=O)NCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1C	913416733	RQYGKBRBOPWXBR-GOSISDBHSA-N	447.513	1.186	50	20	IDGD	
C[C@@H](OCc1ccccc1)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	915062989	NTAQRYYPTXKKGW-MRXNPFEDSA-N	447.513	1.074	50	20	IDGD	
O=Cc1cc(Br)ccc1OCC(=O)OCC(=O)NNC(=O)c1ccccc1	915590668	VRWKXGXBMNDZLC-UHFFFAOYSA-N	435.230	1.645	50	20	IDGD	
CCCCCCNC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	915882643	YVRJDOGPTGRUCR-UHFFFAOYSA-N	440.566	1.551	50	20	IDGD	
O=C(O)COc1ccc(Br)cc1C=NNC(=O)c1ccc(-n2cnnn2)cc1	915952458	WOQXOFUFOZRIGS-UHFFFAOYSA-N	445.233	1.652	50	20	IDGD	
CCCNC(=O)CN1CCC(NC(=O)NNC(=O)c2cc(C)nc3ccccc23)CC1	916518732	IKHZGPIDVRXKCN-UHFFFAOYSA-N	426.521	1.478	50	20	IDGD	
COc1cccc(-n2c(CC(=O)NNC(=O)[C@@H](C)OC)csc2=NCc2ccco2)c1	917919407	FQKIKKLNXJGDNL-CQSZACIVSA-N	444.513	1.966	50	20	IDGD	
O=C(NNC(=O)c1ccc(F)cc1NC(=O)c1ccoc1)c1ccc(-n2cnnn2)cc1	917926611	ZGCLLRNXGCWKIN-UHFFFAOYSA-N	435.375	1.722	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)NCCNC(=O)c1ccc(Br)cc1	918141422	RNLHZPJOXGNTRJ-UHFFFAOYSA-N	437.269	1.891	50	20	IDGD	
CN(C)c1ncccc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	918186601	GRNLFRLSBUUJAN-UHFFFAOYSA-N	431.518	1.397	50	20	IDGD	
CCOc1ccc(Nc2ncccc2C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)cc1	919888146	AOOLPDXLWMQAJM-CQSZACIVSA-N	433.490	1.355	50	20	IDGD	
CC(=O)NCCCNC(=O)/C(C#N)=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	920854334	YINNWQBOKKQOAR-WJDWOHSUSA-N	442.907	1.628	50	20	IDGD	
COc1nc(N)nc(N2CCCC2)c1C=NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1	1318656970	SYNAVSMWUNEPIU-UHFFFAOYSA-N	447.540	1.765	50	20	IDGD	
Cn1ccc2c(O)ncc(C(=O)N3CC[C@H]4OCCC[C@@]4(CNC(=O)[C@@H](F)Cl)C3)c21	1778030831	NCRPMSONIFRJNT-AKCHCHLHSA-N	438.887	1.941	50	20	IDGD	
CC(C)n1cnc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](F)Br)C3)n1	1778280190	YPPAHNUZSWKREO-PBFPGSCMSA-N	446.321	1.677	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(CCN(C(=O)c3cn4ccsc4n3)C2)C1	1778626568	IAYBKDSEMICKEA-INIZCTEOSA-N	427.324	1.624	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@](C)(Cl)CCl)C1)n1ccnn1	1780716450	IQNUCPUXUCDWGX-DTTOXWODSA-N	432.352	1.589	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3c(F)ccc([N+](=O)[O-])c3C)C2)C1	1781987942	YXCODNKFTPLZOK-BFUOFWGJSA-N	443.859	1.740	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ncc(Cl)cn1)C2	1782171281	XNKMULDAXITTEN-HBUWYVDXSA-N	431.320	1.511	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1[nH]nc3ccncc13)C2	1782172872	PFTPQMMRNVUOFB-YYFZDKIDSA-N	435.912	1.339	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc3c1NC(=O)C3)C2	1782179754	SVBWULZXWCUANZ-DRSNIGMVSA-N	449.935	1.563	50	20	IDGD	
COc1ccc(CC(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](C)Br)C3)C2)cc1O	1783529318	UFWKOFCZMNFDDH-BFUOFWGJSA-N	441.322	1.557	50	20	IDGD	
C=C[C@H](O)C(C)(C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]2C1	1783966253	BSNLNGWRLCFJHT-QXKUPLGCSA-N	431.371	1.570	50	20	IDGD	
CC1(C)Cc2cccc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]4C3)c2O1	1784090342	ADNPXPSQYPCHBD-DKIMLUQUSA-N	436.936	1.593	50	20	IDGD	
C[C@@H](Oc1ccccn1)C(=O)N1CC[C@]2(CN(C(=O)CCBr)CCO2)C1	1784486658	PONLEUSWYLJODM-KDOFPFPSSA-N	426.311	1.464	50	20	IDGD	
COc1cccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)c1F	1785299929	DYSBCIMBXHYMNR-RHSMWYFYSA-N	433.249	1.968	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3ccn(C)n3)[C@H]2C1	1787049251	ORZPRNNHZZRLPN-HNKHHVNMSA-N	427.343	1.116	50	20	IDGD	
CN(C)c1ncc(C(=O)Nc2ccc(C3(NC(=O)c4cccc(B(O)O)c4)CCC3)cc2)o1	1787258564	WOQNXDCJKMAHHX-UHFFFAOYSA-N	448.288	1.482	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3ccc4c(c3)OCO4)C[C@@H]21)[C@H](F)Cl	1787445331	FUBCJTUZBBJZCL-IPQUUHLSSA-N	426.872	1.862	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccnc(Cl)n3)C[C@@H]21	1788764163	BWAZAXHBMUEXQX-YDHLFZDLSA-N	426.977	1.575	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccn(C(F)F)c3=O)[C@H]2C1	1788797855	WDQLYAIYMHPIMT-MHEUCROKSA-N	447.866	1.091	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(Cl)ncn3)[C@H]2C1	1789055593	ZZUSGKNPTZSOBO-UHXUPSOCSA-N	445.745	1.754	50	20	IDGD	
C[C@H](NC(=O)c1cnccn1)C(=O)Nc1ccc(C2(NC(=O)[C@@H](O)CCl)CCC2)cc1	1789597759	QSLKBQPSGGUYOH-GUYCJALGSA-N	445.907	1.329	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(C)(C)OC(=O)NC(C)C)C[C@@H]21	1789866826	PEXGUNUUGAFSCY-JONQDZQNSA-N	431.961	1.897	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cncnc3)C[C@@H]21	1790960696	BBWVHIZGNBFHOU-VGWMRTNUSA-N	425.327	1.172	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3Cc4ccccc4CN3C)C[C@@H]21	1791252623	QGAMEARATBELKB-AFDCHOCNSA-N	449.979	1.277	50	20	IDGD	
Cc1noc(C)c1CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)CBr	1792869914	DASKDIZJVYILJG-MKXCTONWSA-N	442.354	1.845	50	20	IDGD	
COc1cc(Cl)ccc1CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](O)CCl	1792983845	QOZRNPIQDXEUAY-HRJSJKBJSA-N	431.316	1.080	50	20	IDGD	
COc1ccc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCBr)C3)cn1	1793893424	UXLLLNIQQDQMKF-CCWDJLKJSA-N	440.338	1.397	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1CCc2nc(O)nc(O)c2C1	1794383945	JMUOWJAHGCGNAT-XQLPTFJDSA-N	448.596	1.482	50	20	IDGD	
NC[C@@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1ccccc1	1795675587	MGLXJXHEPOVPTD-JKJDWNRSSA-N	428.302	1.009	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1ccc2n[nH]cc2c1	1796151136	ZLAJTPHQSVXIAW-NEBZKDRISA-N	425.258	1.457	50	20	IDGD	
C=CCCc1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)c(O)n1	1796190732	FIJVBWUSYYYYMR-ACDBMABISA-N	449.316	1.151	50	20	IDGD	
C[C@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](F)Br)C2)[C@@H]1SC(=N)NC1=O	1796879381	NHBWQXDILBULPL-CQZONYGUSA-N	435.319	1.118	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cc1noc3ccccc13)C2	1798439135	GWQRKAKMKWDXSC-QDMKHBRRSA-N	448.483	1.321	50	20	IDGD	
Cn1c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)cc2ccccc21	1798440263	JQKMBABJYBWDOR-BJWYYQGGSA-N	446.511	1.742	50	20	IDGD	
C[C@@H]1Oc2ccc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@H](F)Cl)C4)cc2NC1=O	1798583332	ZUZYNIOYYXRKQA-PXLMAEHWSA-N	425.844	1.144	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1ccc(Br)nc1)[C@@H](O)CCl	1799787647	XDFSBKVTUXIWOU-CRWXNKLISA-N	430.730	1.625	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)NC(=O)OC(C)(C)C	1800590929	SRFFCQUBPVSKPN-ZHZXCYKASA-N	448.358	1.499	50	20	IDGD	
CC[C@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCOCCOCCOC)C2	1801804958	JNVPASMQFMKKHM-YVSFHVDLSA-N	449.386	1.868	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cc[nH]c3nccc2-3)[C@H]1c1cccnc1)[C@H](O)CCl	1803138516	BOPMQKCQRGNFKF-QGTPRVQTSA-N	427.892	1.829	50	20	IDGD	
O=C(CCC(=O)N1CCCC1)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1	1804144684	BGZAOWHRUZNPKW-SQGPQFPESA-N	436.940	1.090	50	20	IDGD	
COc1nccnc1C(=O)NC[C@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1	1804971692	PJOAJMJKFLWOQX-PBHICJAKSA-N	448.321	1.985	50	20	IDGD	
CCOC(=O)/C=C/C(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)Br)[C@H]1c1cccnc1	1806299307	LCIBZGCNKSTPKJ-WVSCRYBUSA-N	438.322	1.990	50	20	IDGD	
O=C(CCBr)NC[C@@H]1CCN(C(=O)Cn2ccccc2=O)[C@H]1c1cccnc1	1806340247	ASABJFKFGKLEQN-JXFKEZNVSA-N	447.333	1.734	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@H]1CCN(C(=O)CN2CCOCC2)[C@H]1c1cccnc1	1808295410	HTKYXNBDKAZISC-KPFFTGBYSA-N	443.375	1.656	50	20	IDGD	
Cc1cc(NC(=O)CC(=O)N2CC[C@H](CNC(=O)[C@@H](F)Cl)[C@@H]2c2cccnc2)no1	1808312966	NXFYBAIVLAGJOS-JEBQAFNWSA-N	437.859	1.947	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)CCN2CCOC2=O)[C@@H]1c1cccnc1	1809531008	BBVNQLQWERRCTR-BQFCYCMXSA-N	438.912	1.184	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)c1ccc2[nH]ccc2n1	1809788745	VQEJSMJYIXKGKA-GDIGMMSISA-N	427.892	1.877	50	20	IDGD	
COc1ccsc1C(=O)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1	1809971262	OPCLSLOHOQAXIN-UHFFFAOYSA-N	442.346	1.595	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC2(CCCN(C(=O)c3nccc4[nH]ccc34)C2)CC1	1810649858	PILXCGJQJSGGFN-UHFFFAOYSA-N	440.548	1.781	50	20	IDGD	
O=C(CN1CCCCC1=O)NC[C@H]1CCN(C(=O)C(Cl)Cl)[C@H]1c1cccnc1	1812976492	GOHKOXPPOQJFGM-PBHICJAKSA-N	427.332	1.904	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc([N+](=O)[O-])o2)n[nH]1	1814311213	AMBHVFRWKIUNDO-ZDUSSCGKSA-N	447.452	1.590	50	20	IDGD	
CC(C)OCC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1814550728	JXSRAYKSBBSSSZ-MRXNPFEDSA-N	429.481	1.139	50	20	IDGD	
CCC[C@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](O)N2CCOCC2)[nH]n1	1815319331	IGWJNTSDLHFEAV-DHSIGJKJSA-N	427.933	1.460	50	20	IDGD	
C=C(Oc1ccccc1O)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)CCl)CC2	1817258159	RRLXOYCHKOPDGK-RISCZKNCSA-N	437.905	1.953	50	20	IDGD	
N#Cc1ccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)cc1	1817472322	FXPUGHIWEXTLJU-FQEVSTJZSA-N	443.272	1.581	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H]1CCCS1)CC2	1819801055	GEYHGKHYNRSEOP-QMTHXVAHSA-N	446.558	1.263	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CC1CCC1)CC2	1819801513	MXSMZDHOGIMXLW-LBPRGKRZSA-N	428.518	1.558	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@H]1CCc2nc(NC(=O)c3cnc(O)[nH]3)sc2C1	1820658770	OMCKUPQRQPIZFN-YUMQZZPRSA-N	428.312	1.829	50	20	IDGD	
C=CCC(F)(F)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1821986418	UMFFCONUTYIPDG-INIZCTEOSA-N	432.236	1.607	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)COc2ccc(O)nn2)[nH]n1	1822376624	NROSBSBYIWBHFG-DGCLKSJQSA-N	438.872	1.230	50	20	IDGD	
CCS(=O)(=O)N[C@@H](C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)C(Cl)Cl)n[nH]1	1822419361	WWKFWYLZRUWEIF-GXSJLCMTSA-N	440.353	1.533	50	20	IDGD	
CC(=O)c1cc(C(=O)N[C@H]2CCc3nc(NC(=O)[C@H](F)Br)sc3C2)n[nH]1	1823001356	CXTLNYCPIZZOHS-MADCSZMMSA-N	444.286	1.985	50	20	IDGD	
COC1(CC(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)CCC1	1823072241	WYKWAKBFCAFUMU-SFHVURJKSA-N	440.309	1.355	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H](C)n2cnnn2)CC1	1824096303	OKHVHDQSDQTAJL-IJEWVQPXSA-N	441.374	1.885	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(O)n(C)n1)CC2	1825637413	ZNCXKWUMNYMBKB-JGVFFNPUSA-N	428.312	1.591	50	20	IDGD	
Cc1noc(C)c1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1	1825858162	COYKLOHUSHKQIM-FQEVSTJZSA-N	439.321	1.518	50	20	IDGD	
C[C@H](C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCBr)CC2)n1cnnn1	1826971654	ITZSLNUKIDLSMX-BDAKNGLRSA-N	428.316	1.088	50	20	IDGD	
Cc1ccncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827053215	YPTIPQKRNGVMQA-QFIPXVFZSA-N	435.333	1.617	50	20	IDGD	
CCOC(=O)C(C)(C)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](Cl)COC)CC2	1828215406	VHFOGNPXGQAQFV-GHMZBOCLSA-N	431.942	1.898	50	20	IDGD	
C#CC(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)[C@H](Cl)COC)C2)C1	1829267653	XCHOFVFMRZFCDB-GCJKJVERSA-N	447.919	1.326	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)C3(Br)CC3)C2)C1	1830363592	DNNATWISBNPFGR-MRXNPFEDSA-N	437.762	1.635	50	20	IDGD	
CCn1nccc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2	1830537599	KZUXFEZYAVAXAD-KBXCAEBGSA-N	443.342	1.004	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCN3CCCCC3)C2)C1	1831647036	PWUXSBXVFBYUSK-NQIIRXRSSA-N	429.989	1.726	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(C)nc3OC)C2)C1	1831652286	XODDBDKHXLIPCE-UWJYYQICSA-N	439.940	1.876	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CNC(=O)c2ccco2)CC1	1831830873	XZCOPDYHAZNJCK-IAGOWNOFSA-N	439.940	1.883	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2nccnc2C(N)=O)CC1	1831833154	UNWBKJYJCKYYGZ-LSDHHAIUSA-N	437.928	1.063	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2cnc[nH]2)CC1	1832096979	RTCKDKBWOFTSNW-CQQBXOTJSA-N	436.321	1.036	50	20	IDGD	
CC[C@H](C)[C@H](N)C(=O)N1CCC(N2CCC(NC(=O)[C@H](C)CBr)CC2)CC1	1833261960	FGXGSSCPNJPHIY-DAYGRLMNSA-N	445.446	1.962	50	20	IDGD	
COc1cnc(C(=O)N2CCC(N3CCC(NC(=O)[C@@H](O)CCl)CC3)CC2)c(F)c1	1833308288	PTEWMRSLIXYDBE-KRWDZBQOSA-N	442.919	1.014	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnn(C(C)(C)C)c3)CCO2)C1	1833455623	WYJDNJPKZKXQKH-OXJNMPFZSA-N	426.945	1.726	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cnoc1C1CC1)CCO2	1834613960	DISMSXMJVJJKOB-HXUWFJFHSA-N	437.569	1.474	50	20	IDGD	
Cc1nccc(C(=O)NC2CCN(C3CCN(C(=O)[C@H](F)Br)CC3)CC2)n1	1835219043	KJBWNHBLRBNBHI-INIZCTEOSA-N	442.333	1.661	50	20	IDGD	
CCCNC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)[C@@H](Cl)COC)CC2)CC1	1836821836	JHMDIUYJEZZVFZ-SFHVURJKSA-N	445.988	1.545	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](C)CC(N)=O)CC2)CC1	1836911933	FFKNIICMSPOJCX-BBRMVZONSA-N	446.386	1.670	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@H](CC)NC(N)=O)CC2)CC1	1836920179	YVEUPXLZEHVPMN-IRXDYDNUSA-N	430.977	1.839	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)C#CC3(O)CCCCC3)CCO2)C1	1837486595	KKWSHWWEKDYLJE-QFIPXVFZSA-N	440.968	1.406	50	20	IDGD	
O=C(c1nnc(-c2ccccc2)o1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1837537094	MXRCSEYMTUBIME-IFXJQAMLSA-N	438.843	1.341	50	20	IDGD	
CC(=O)N1CCC(OC2CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)CC2)CC1	1837757254	SHGIISGOUSTRLB-UHFFFAOYSA-N	445.564	1.351	50	20	IDGD	
O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(F)cc1F)CCO2	1839004824	IVZBDTHCWIYYMV-SFHVURJKSA-N	447.276	1.820	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CC34CCCN3CCC4)CCO2)C1	1839116883	POICXSJTLVRRBE-PGRDOPGGSA-N	442.000	1.869	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4c(c3)CCN4C)C2)C1	1839144959	PDJLHSCRGJXXGH-XMSQKQJNSA-N	435.952	1.766	50	20	IDGD	
CCn1nccc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2	1839151356	PCXURXMMYRGJAN-MSOLQXFVSA-N	433.336	1.209	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc4ccsc4[nH]3)CCO2)C1	1839521633	AORIAPVADAVBDA-AUUYWEPGSA-N	441.937	1.553	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1C[C@@H]1F)CCO2	1839771355	BPIFVCGKEKTVAO-YFOLIPHBSA-N	449.429	1.686	50	20	IDGD	
Cc1onc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)c1C	1840030119	AOHMHCHCWQIZRM-SJKOYZFVSA-N	430.299	1.145	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(F)c(F)c3)C2)C1	1840034335	IHJCIBZABIHWQL-KPZWWZAWSA-N	447.276	1.818	50	20	IDGD	
O=C(C(Cl)Cl)N1CCO[C@]2(COCCN(C(=O)[C@@H]3COc4ccccc4O3)C2)C1	1840186232	BVUFJGRTFIPHJY-KXBFYZLASA-N	445.299	1.087	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC2(CCCN2C(=O)CNC(=O)c2cccs2)C1	1842065377	NLYOFQWPHQNOKV-LBPRGKRZSA-N	428.352	1.855	50	20	IDGD	
Cc1ccc2nc(C(=O)N3CCCC34CN(C(=O)c3ccc(B(O)O)cc3)C4)sc2c1	1842565828	PDDGRUCZRAPRSY-UHFFFAOYSA-N	435.314	1.415	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)CC(C)(C)C(=O)OC(C)(C)C)C1	1844996579	HTKREJIUMWFQDI-UHFFFAOYSA-N	438.569	1.321	50	20	IDGD	
C=C1CC(C(=O)N2CC3(CCCN3C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1	1845038250	JQWFGTXGLYLZRX-UHFFFAOYSA-N	425.533	1.502	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC2(CCCN2C(=O)[C@H]2CC[C@H]3CCC(=O)N3C2)C1	1845068850	UDTBGSBPURDPDM-ILXRZTDVSA-N	426.355	1.622	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC[C@H]2[C@@H]1CCN2C(=O)c1c(Cl)cncc1Cl	1847202392	VKMNBRXZBCGCSO-HOTGVXAUSA-N	434.088	1.197	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)[C@@H]1CC(=O)N(c2cc(Cl)ccc2OC)C1	15668576	GJCGZMFBBJILEO-CYBMUJFWSA-N	447.875	1.937	50	20	IDGD	
COc1ccc(OC)c(S(=O)(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)c1	16095403	OSHHBIBCPNJYHT-UHFFFAOYSA-N	446.485	1.618	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)CCc1cnn(-c2ccccc2)c1	16177451	LOQSARSHTWUNFB-UHFFFAOYSA-N	440.529	1.868	50	20	IDGD	
CON(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)c1	20919291	JYLVOYQISUWOGP-OAHLLOKOSA-N	435.502	1.714	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)c3nccnc3N)c2)c(C)c1	21438068	RVIYQEYNJFHSMO-UHFFFAOYSA-N	440.485	1.551	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NCc1cccc(NC(=O)C2CCC2)c1	726088481	HHDXQAIYRRYWNI-UHFFFAOYSA-N	429.502	1.747	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)N1CCC(C(=O)Nc2ccc(F)cc2)CC1	726191810	KTOIKGPMCVPOOW-UHFFFAOYSA-N	447.492	1.709	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1cc(N2CCCC2=O)cc(C(F)(F)F)c1	728234740	SKAHJMSZUHDUJC-SNVBAGLBSA-N	433.408	1.028	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NN=Cc1ccc(OC(F)(F)[C@@H](F)C(F)(F)F)cc1	728437236	NVAMPTUBXSVXSS-UFBFGSQYSA-N	435.346	1.946	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2cccn2C)c(Br)cc1F	728503150	KTWPPTCVEBJXBM-UHFFFAOYSA-N	434.243	1.337	50	20	IDGD	
O=C(NCc1cccc(CO)c1)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	729621753	QDHHIIJUOSVDMO-UHFFFAOYSA-N	446.529	1.498	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)[C@H](CC(C)C)N2C(=O)[C@@H]3CC=CC[C@H]3C2=O)cn1	729692356	FVOHHNFSMSSWKO-OAGGEKHMSA-N	445.545	1.774	50	20	IDGD	
COc1ccc(-n2c(C)nnc2SCC(=O)NNC(=O)COc2ccccc2O)cc1	730782386	NUJNTAPBEHCXBT-UHFFFAOYSA-N	443.485	1.608	50	20	IDGD	
CCN1CCN(C(=O)CC2CCN(C(=O)/C(C#N)=C\c3cc(C#N)n(C)c3C)CC2)CC1	731200997	MAKVHPHUBVLQES-STZFKDTASA-N	436.560	1.905	50	20	IDGD	
Cc1c(C(=O)NNC(=O)COc2ccccc2O)nnn1-c1cccc2c1CCN(C)C2	731476712	KGNIXWTZMZYFQN-UHFFFAOYSA-N	436.472	1.109	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CCNC(=O)Cc2ccccc2)cc1Br	732034542	VDGVUCKITNDUQT-UHFFFAOYSA-N	434.290	1.968	50	20	IDGD	
O=C(CCn1ccnn1)NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2Cl)c1	732049603	VNDWQBVILPPXFH-UHFFFAOYSA-N	448.892	1.584	50	20	IDGD	
C#CCOc1ccccc1CNC(=O)NNc1ccc(S(=O)(=O)N(CC)CC)cn1	734216658	XKXQKGNEVISWTO-UHFFFAOYSA-N	431.518	1.950	50	20	IDGD	
Cc1cc(NNC(=O)c2ccc(NS(=O)(=O)c3ccc4nc(O)[nH]c4c3)cc2)ncn1	734254361	RQZYNWBNSOQSMR-UHFFFAOYSA-N	439.457	1.925	50	20	IDGD	
CN1C(=O)CC[C@@H](C(=O)NNC(=O)C(=O)N2CCCC2)[C@H]1c1ccc(C(F)(F)F)cc1	734432870	XDLNBVGLSVGSLR-GDBMZVCRSA-N	440.422	1.385	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)CCC1CC1)N(S(C)(=O)=O)CC2	734543679	SUILDKLZTIXGKK-INIZCTEOSA-N	439.534	1.290	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)CNC(=O)OCc2ccccc2)CC1	734825099	ULPQLAXQDXICJP-UHFFFAOYSA-N	449.508	1.643	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2cccc(-n3cccc3)c2)CC1	735117100	NWGXCINPDQLHFV-UHFFFAOYSA-N	440.529	1.565	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@H]2CCCO[C@@H]2C(C)(C)C)c1	735762459	MPQNDUOGNWMXFL-WBVHZDCISA-N	440.566	1.722	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)[C@@H](O)c2ccc(Br)cc2)n1	740969780	FRYSFMOOPGXPNR-HNNXBMFYSA-N	442.291	1.181	50	20	IDGD	
CCN1CCC(=NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)[C@@H](C)C1	741453250	NSIQGAJSJWSANE-KRWDZBQOSA-N	436.578	1.474	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)N[C@@H]2CCN(c3ccccc3C(N)=O)C2)cc1	743606368	UKCZQYMYMGJWME-OAHLLOKOSA-N	425.493	1.466	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@H]2CCCN(C(=O)c3ccncc3)C2)cc1	743831613	ZXFGNIWPLRFVLC-HNNXBMFYSA-N	445.501	1.190	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)CCS(=O)(=O)c2ccc(Cl)cc2)cc1	744464880	CCBOASNRDJBMDL-UHFFFAOYSA-N	449.872	1.380	50	20	IDGD	
O=C(COc1ccc2c(c1)CCC2)NNc1ccccc1S(=O)(=O)N1CCOCC1	744618821	DOHANCCACHQDPE-UHFFFAOYSA-N	431.514	1.718	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)[C@H](c2ccccc2)N2CCSCC2)n1	745088921	HQROXWCWGNZNEP-IBGZPJMESA-N	448.570	1.475	50	20	IDGD	
O=C(NCc1ccnc(OC2CCOCC2)c1)NNC(=O)c1cc([N+](=O)[O-])ccc1O	745820840	WIBHZOVSURJQTK-UHFFFAOYSA-N	431.405	1.397	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NC[C@@H](C)Oc2cccc(F)c2)c2ccccc2c1=O	745880143	ZTDBOWCXRKYXKS-CYBMUJFWSA-N	427.436	1.967	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H]2C[C@](C)(OC)C2(C)C)c1	745932137	KMTBMEAEEOSCAY-JXFKEZNVSA-N	440.566	1.865	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2ccc(C(=O)NNC(=O)N3CCOCC3)cc2)cc1	745992627	FTSLEEGVJAPHCN-UHFFFAOYSA-N	434.474	1.183	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)[C@@H]1CCCN1C(=O)c1ccc2c(c1)OCO2	746555910	IWOFFCDDZNETCB-INIZCTEOSA-N	435.440	1.058	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)Cc1cn2ccccc2n1)[C@H]1CN(Cc2ccccc2)CCO1	746766990	IBDNHDGHBKJDDC-YLJYHZDGSA-N	436.516	1.497	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)NCc1ccc(N(C)C(=O)c2ccncc2)cc1	748629150	ACOQSSSVWBDAIH-HNNXBMFYSA-N	429.477	1.240	50	20	IDGD	
C[C@@H](Cc1ccncc1)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	749618332	CVNBJZVXVKLDME-INIZCTEOSA-N	445.545	1.831	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1CN(CC(=O)NNC(=O)c1cccc(C#N)c1)CC2	750062909	OODLNOCCPLMGIO-ROUUACIJSA-N	427.505	1.793	50	20	IDGD	
CN1CC[C@@H](C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)c2ccccc21	750788228	LSCWNEOGJBKUGU-HXUWFJFHSA-N	435.528	1.216	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NCC2CCN(CC(=O)NC(C)(C)C)CC2)cc1	751110391	CQQZIFWFTCMXLK-UHFFFAOYSA-N	433.553	1.331	50	20	IDGD	
COc1c(S(=O)(=O)NNC(=O)c2cnn(C)c2)cc(Br)c(C)c1[N+](=O)[O-]	755027281	RGZRPCADXRHMOF-UHFFFAOYSA-N	448.255	1.031	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1nnc(SCc2ccc(F)cc2)s1	755417729	PZCIGSZQAMTALL-MRVPVSSYSA-N	448.527	1.060	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1NC(C)=O	755624037	VHGPESRWZAXYKN-UHFFFAOYSA-N	449.489	1.370	50	20	IDGD	
CCNC(=O)c1ccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1	755941100	KELHRSGRQRPMLX-UHFFFAOYSA-N	433.490	1.153	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)Nc2cccc(N3C(=O)CN(C)C3=O)c2)cc1	755994257	XRJRIEULYJOQGO-UHFFFAOYSA-N	427.417	1.325	50	20	IDGD	
C=CCN(CC=C)C(=O)c1ccc(NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1	756204642	OWYAOMSMYWYWOO-UHFFFAOYSA-N	446.471	1.943	50	20	IDGD	
CS(=O)(=O)CCOc1cccc(NC(=O)NNC(=O)c2ccc3c(c2)OCCO3)c1	756298314	SWAJPXNXQVDXBA-UHFFFAOYSA-N	435.458	1.348	50	20	IDGD	
COCCCOc1cccc(NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1	756894367	NKRSPOIVTQOZIX-UHFFFAOYSA-N	428.493	1.961	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)Nc2ccc(C(N)=O)nc2)cc(OCC)c1OCC	757700812	UHQGSXOESLUIFC-UHFFFAOYSA-N	431.449	1.843	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)Nc2ccc(C)c(S(=O)(=O)NC3CC3)c2)c1O	757873893	MUTAWFBPKGQLBZ-UHFFFAOYSA-N	434.474	1.616	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)Nc1cnc2c(c1)COCC2	757929408	SSHPUBPZBPHOAD-UHFFFAOYSA-N	445.501	1.405	50	20	IDGD	
CSCC[C@@H](NC(=O)c1ccc([N+](=O)[O-])o1)C(=O)NNc1nc(O)c2ccccc2n1	758300390	WUDHXCNXKHQULQ-GFCCVEGCSA-N	446.445	1.831	50	20	IDGD	
COc1ccc(C2(C(=O)N3CCN(S(=O)(=O)CBr)CC3)CCC2)cc1	758524090	UBLYUORDBCTCET-UHFFFAOYSA-N	431.352	1.943	50	20	IDGD	
CN(NC(=O)c1ccccc1Cn1cncn1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758787575	SLFJMOJNAVIQLP-UHFFFAOYSA-N	443.508	1.576	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)NC[C@H]2CN(Cc3ccccc3)CCCO2)c1	758856262	VWBUBKKADNOKJE-NRFANRHFSA-N	426.517	1.995	50	20	IDGD	
CCNc1nc(C)c(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)s1	759233691	FPXYWPPMKMGLCL-UHFFFAOYSA-N	438.579	1.576	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NNC(=O)CNC(=O)c2ccco2)cc1Br	759679885	IWEHRFBEIQOIIH-UHFFFAOYSA-N	446.279	1.180	50	20	IDGD	
CC1(C)C(=O)N(C[C@](C)(O)C(=O)NNC(=O)NCCc2cccs2)c2ccccc21	760170301	TUWULTRFXPZUJX-NRFANRHFSA-N	430.530	1.696	50	20	IDGD	
N#Cc1ccc2[nH]cc(C=NNC(=O)c3cccc(S(=O)(=O)N4CCOCC4)c3)c2c1	760214949	DCELNUANFJZFCE-UHFFFAOYSA-N	437.481	1.824	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)COc2ccc(OCc3ccccc3)cc2)co1	763283670	NYDIUZVGNABFLW-UHFFFAOYSA-N	445.453	1.346	50	20	IDGD	
CNC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cc(C)nc3ccccc23)ccc1Cl	763616529	MWLVBMHRTNGDPB-UHFFFAOYSA-N	439.859	1.956	50	20	IDGD	
O=C(CN1CCCc2ccccc21)NNC(=O)C(=O)Nc1ccc(OC2CCCC2)nc1	763728358	LPCHYCLAKRPEEY-UHFFFAOYSA-N	437.500	1.942	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2ccc(Cl)c(C#N)c2)c2ccccc2c1=O	763785086	DDJZVHQPHUFJIS-UHFFFAOYSA-N	438.831	1.341	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2ccc(OC(F)F)cc2)c2ccccc2c1=O	763787065	VLPTZPUCEQBSCB-UHFFFAOYSA-N	445.382	1.418	50	20	IDGD	
CCc1cc(O)nc(-c2cccc(NC(=O)C(=O)NNC(=O)COc3ccc(C)cc3)c2)n1	763812037	NVEYZRPHLXHBDP-UHFFFAOYSA-N	449.467	1.885	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)C(=O)Nc2nn(-c3ccc(C#N)cn3)cc2C)cc1	763895383	DDLRYXDJTUWRCY-UHFFFAOYSA-N	449.496	1.634	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)on2)cc1[N+](=O)[O-]	764013344	WVYRVNNWQBJQCM-UHFFFAOYSA-N	425.357	1.658	50	20	IDGD	
CC(C)(C)OC(=O)N1CCc2ncc(NC(=O)C(=O)NNC(=O)C3CCCC3)cc2C1	764076830	HNMFITRIVAINSF-UHFFFAOYSA-N	431.493	1.651	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(-c3nnc4n3CCCCCC4)cc2)n[nH]1	764100104	VNPMKNIOBUSRNU-UHFFFAOYSA-N	436.476	1.493	50	20	IDGD	
CCCCN1CCc2ccc(NC(=O)C(=O)NNC(=O)c3cccc(OC)c3O)cc21	764130468	IOMQRLVWUQSDQR-UHFFFAOYSA-N	426.473	1.963	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccc(Oc2nccc(C)n2)cc1	764139264	QLEGISUEOVXBRL-UHFFFAOYSA-N	435.440	1.915	50	20	IDGD	
COC(=O)c1c(NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)sc2c1CCCC2	764162939	GMYXASHTEKZCQL-CQSZACIVSA-N	443.481	1.503	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2O1)C(=O)Nc1ccc2nc(-c3ccccn3)oc2c1	764165339	XBQYTWUTEKUZJN-LJQANCHMSA-N	443.419	1.979	50	20	IDGD	
CN(C)CC(=O)NNC(=O)C(=O)Nc1ccc(Oc2ncc(Cl)cc2Cl)cc1	764203872	KXRJEQPLCDTJNY-UHFFFAOYSA-N	426.260	1.828	50	20	IDGD	
CCOC(=O)c1c(F)cccc1NC(=O)C(=O)NNC(=O)Cn1ccc2ccccc21	764244531	JGHIFRCKGIYJDZ-UHFFFAOYSA-N	426.404	1.743	50	20	IDGD	
CC[C@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2O)cc1	764278062	QGXPYEKZEYIIQS-ZDUSSCGKSA-N	428.445	1.085	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C(=O)Nc1cccc(OCCS(C)(=O)=O)c1)c1ccccc1	764329690	YHJVKDJSQKRCGY-SFHVURJKSA-N	447.513	1.390	50	20	IDGD	
NC(=O)c1cc(C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)nn1-c1ccccc1	764329952	RYFIYKZMHDTWQG-UHFFFAOYSA-N	440.410	1.899	50	20	IDGD	
O=C(CCCc1cccs1)NNC(=O)C(=O)Nc1cccc(N2CCCNC2=O)c1	764342024	SHAKBFLFXIWSLZ-UHFFFAOYSA-N	429.502	1.777	50	20	IDGD	
COC(=O)c1cc(Cl)ccc1NC(=O)C(=O)NNC(=O)C(F)(F)Oc1ccccc1	764378025	GOCSLFVPPIZKDP-UHFFFAOYSA-N	441.774	1.884	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cnn(-c4ccccn4)c3)n[nH]2)cc1C	764387945	NIBKECMGSCBJAS-UHFFFAOYSA-N	444.455	1.674	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)C(=O)Nc1ccc(CCN2CCCC2)cc1	764394185	PIJGHFIJJRUKSP-UHFFFAOYSA-N	442.541	1.909	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)C(=O)Nc2ccc(Oc3ccc(C)cn3)cc2)c1	764432121	CIXQNQFCKWCFGF-UHFFFAOYSA-N	448.439	1.935	50	20	IDGD	
Cc1oc(-c2ccccc2)nc1C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765736987	CWFZFCYVVDVZRU-UHFFFAOYSA-N	447.495	1.869	50	20	IDGD	
COc1ccccc1[C@H](C)CC(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765737189	XHPDHESSUAUNMV-GOSISDBHSA-N	438.528	1.794	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)CN(C)C(=O)OC(C)(C)C)n[nH]2)cc1OC	768278393	GQSHVRVTHHVMFV-UHFFFAOYSA-N	433.465	1.722	50	20	IDGD	
CCc1c(C(=O)NNC(=O)CNC(=O)c2cccs2)cnn1-c1ccccc1OC	769456854	YNBWSIWRVQHKMQ-UHFFFAOYSA-N	427.486	1.696	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)Nc1cnn(CCN2CCOCC2)c1	770544693	KPICVBXRJZJZJW-CQSZACIVSA-N	436.900	1.489	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H]1CC(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772885059	UFOWZVKAZXJDKF-HNNXBMFYSA-N	438.912	1.893	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)[C@@H]1CN(C(=O)OC(C)(C)C)CCO1	772967573	OHXAKOCGTFNZKC-WFASDCNBSA-N	427.885	1.891	50	20	IDGD	
O=C(NNc1cnc2ccccc2n1)C(=O)Nc1cc(N2CCNC2=O)ccc1Cl	773722901	PGJXRLCDEDGRLB-UHFFFAOYSA-N	425.836	1.895	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)NCc1ccc(S(N)(=O)=O)c(C)c1	775222126	HUVCHRWJSWCKJQ-UHFFFAOYSA-N	438.531	1.274	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)N[C@H]2CC(=O)N(CCOc3ccccc3)C2)c1	776620753	UTKHRBUWEXJJFK-INIZCTEOSA-N	432.502	1.396	50	20	IDGD	
CC1CCC2(CC1)OC[C@H](CNC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)O2	776949990	PZPCCSWWPCFGTK-BTUGKURYSA-N	425.507	1.356	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)c1cc(C)n(-c2cccc(C#N)c2)n1	780198563	PCEZULYTAIIJGN-UHFFFAOYSA-N	431.452	1.908	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)Nc1cccc(N2CCN(C(C)=O)CC2)c1	782084415	ZPQFPHBBJFJSBC-UHFFFAOYSA-N	425.489	1.759	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1c(C)csc1C(=O)OC	782120185	AFPMXXABZBRXPY-UHFFFAOYSA-N	435.458	1.407	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)N2C[C@H](CC(=O)N(C)C)c3cc(Cl)ccc32)nc1	782143170	WKEBBXUFXJXXIO-LBPRGKRZSA-N	431.880	1.795	50	20	IDGD	
COc1ccc(S(=O)(=O)NC(C)(C)C)cc1NC(=O)C(=O)NNc1cccc(F)c1	783040349	MCZLLXQSJJYYNC-UHFFFAOYSA-N	438.481	1.993	50	20	IDGD	
CN1CCN(C(=O)Cc2ccc(NC(=O)C(=O)NNc3ccc(Cl)cc3)cc2)CC1	783335865	DAQRELMPSBEBFZ-UHFFFAOYSA-N	429.908	1.738	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2ccc(N3CCCCC3)c(Cl)c2)CCS(=O)(=O)C1	783428668	YFVQUGZFSRIVMR-SFHVURJKSA-N	428.942	1.467	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc2c(c1)CCN2C(=O)C(=O)NN(C)c1ccccc1	783434838	XCBNBVCZGGWRBZ-UHFFFAOYSA-N	430.530	1.774	50	20	IDGD	
O=C(NNC(=O)C(=O)N1CCCC1)C(=O)Nc1ccc(SCc2cccnc2)cc1	783998611	FDLVTVNGBOBGLU-UHFFFAOYSA-N	427.486	1.082	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1cccc(-c2nccs2)c1	784004581	HITCBSQBNKDLAD-UHFFFAOYSA-N	429.483	1.388	50	20	IDGD	
CNC(=O)COc1ccc(NC(=O)C(=O)NNc2ccc(OC(F)(F)F)cc2)cc1	784802008	NESDEGQUSPORDA-UHFFFAOYSA-N	426.351	1.792	50	20	IDGD	
CN1CCC[C@H](N(C)C(=O)c2ccc(NC(=O)C(=O)NNc3ncccc3Cl)cc2)C1	784817504	IEIRPYRTZTTYDD-INIZCTEOSA-N	444.923	1.983	50	20	IDGD	
CCOC(=O)N(C)c1ccc(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)cc1	785067762	MKFAISOHJXEHRP-UHFFFAOYSA-N	438.444	1.256	50	20	IDGD	
COC(=O)[C@@H]1CN(C(=O)C(=O)NNc2nc(C(F)(F)F)cs2)c2ccccc2O1	785143938	FOANQWJYMGYKBK-JTQLQIEISA-N	430.364	1.572	50	20	IDGD	
Cn1cnn(-c2ccc(NC(=O)C(=O)NNc3nc(C(F)(F)F)cs3)cc2)c1=O	785145548	GQAUKJBAIGKKDW-UHFFFAOYSA-N	427.368	1.128	50	20	IDGD	
Cn1cnn(-c2ccc(NC(=O)C(=O)NNc3cc(C(F)(F)F)ccc3F)cc2)c1=O	785171489	WYHBSOFCVPXOLM-UHFFFAOYSA-N	438.341	1.811	50	20	IDGD	
Cc1cc(=O)c(C(=O)NNC(=O)N2CCN(C)CC2)nn1-c1ccccc1C(F)(F)F	788169160	JTSLRLUKNFRPAW-UHFFFAOYSA-N	438.410	1.162	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)cnc1Br	788524459	ZITJEFGCVIJCFN-UHFFFAOYSA-N	431.287	1.919	50	20	IDGD	
CC(C)(C)n1cc(C#N)cc1NC(=O)C(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	789731455	HZJHOTVXWWABRF-UHFFFAOYSA-N	435.444	1.406	50	20	IDGD	
Cn1nc(-c2ccc(F)cc2F)cc1NC(=O)C(=O)NNC(=O)Cc1ccc(F)cc1	789739949	CSUBHHCFCUQBCT-UHFFFAOYSA-N	431.374	1.833	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)cc([N+](=O)[O-])c1C	790120931	WGQGBXJVESVBTP-UHFFFAOYSA-N	435.462	1.588	50	20	IDGD	
CN(CC(=O)NNc1cccc(F)c1[N+](=O)[O-])S(=O)(=O)c1cccc([N+](=O)[O-])c1	790588649	HGFWQBHCLPUDDU-UHFFFAOYSA-N	427.370	1.406	50	20	IDGD	
CCCn1c(=O)n(CCC(=O)NNc2ccccc2S(=O)(=O)N(C)C)c2ccccc21	795177737	RHPZHRNOQXSWCG-UHFFFAOYSA-N	445.545	1.997	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNC(=O)C(=O)Nc1ccc(-c2ncco2)cc1	797369046	MROJGCLXMBUNSZ-UHFFFAOYSA-N	437.412	1.354	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2cc(N3CCOCC3)ccc2C)n1	797538922	QQAFPOMXUMLYNW-UHFFFAOYSA-N	427.509	1.550	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)c1ccccc1F)C(=O)NNC(=O)NCC(F)(F)F	798315487	IXZBLMIUHMMFOW-JTQLQIEISA-N	446.448	1.118	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2nc(C)n(-c3n[nH]c(C(F)(F)F)n3)n2)c2ccccc2n1	799008037	LGQSNKYXVMYVDD-UHFFFAOYSA-N	445.365	1.644	50	20	IDGD	
COC(=O)c1ccc(S(=O)(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)cc1OC	799120978	XFBVDNSJAWQZAG-UHFFFAOYSA-N	435.458	1.047	50	20	IDGD	
CCn1ncc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)c1C(F)(F)F	799257710	QMSNVHFVQMTLKF-UHFFFAOYSA-N	435.366	1.712	50	20	IDGD	
CCn1ncc(NC(=O)C(=O)NNC(=O)c2cccc(OC(F)F)c2)c1C(F)(F)F	799258524	CSTIJZFDOPUZDG-UHFFFAOYSA-N	435.309	1.923	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCC(F)(F)C1)c1cccc(S(=O)(=O)N2CCOCC2)c1	799854286	KVCWUOWSRDARGQ-AWEZNQCLSA-N	431.461	1.294	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)c(C)c(OC)c1	800623463	PPHXIZKEUOLYGG-UHFFFAOYSA-N	439.428	1.303	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)NCCNS(=O)(=O)c2ccc(F)cc2Cl)c1	801013348	RXZBMDGRZLNASZ-UHFFFAOYSA-N	439.856	1.273	50	20	IDGD	
O=C(COC(=O)c1nn(-c2ccccc2F)cc1O)NNC(=O)c1cccc([N+](=O)[O-])c1	801380150	QZFGUTIVZYVOIH-UHFFFAOYSA-N	443.347	1.243	50	20	IDGD	
CC(C)[C@H](C(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)N1C[C@@H](C)O[C@H](C)C1	802067750	ZFHUGSLQAXCNGU-CKEIUWERSA-N	426.539	1.377	50	20	IDGD	
CCCCS(=O)(=O)N1CCC(C(=O)NNC(=O)Nc2ccc3c(c2)OCO3)CC1	802107149	KKPGPOTWIAAIKJ-UHFFFAOYSA-N	426.495	1.410	50	20	IDGD	
COCCCn1nccc1C=NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	802704468	QWGKPTFSYILZDA-UHFFFAOYSA-N	433.534	1.858	50	20	IDGD	
Cn1nnnc1Sc1ccc([N+](=O)[O-])cc1C(=O)NNc1ccc2c(=O)[nH]ccc2c1	803439781	LXHUOFPTRWKGHF-UHFFFAOYSA-N	438.429	1.868	50	20	IDGD	
CCOC(=O)CC(C)(C)CC(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	806973635	GJFIMEBBZKBDQP-UHFFFAOYSA-N	427.523	1.520	50	20	IDGD	
O=C1COC[C@@H](C[C@H]2CN(C(=O)C(=O)NNc3cccnc3Cl)c3ccccc32)N1	807013438	RSNPNOJKMJOVMY-QWHCGFSZSA-N	429.864	1.214	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NNC(=O)Cn2cnc3sccc3c2=O)C1	808011347	UCWXKKLJLGYGRR-GFCCVEGCSA-N	435.506	1.253	50	20	IDGD	
C#CC[C@]1(C(=O)NNC(=O)c2nnc(O)c3ccccc23)CCCN1C(=O)OC(C)(C)C	809537810	SJXNYYODGZEAMP-JOCHJYFZSA-N	439.472	1.889	50	20	IDGD	
CC(C)(C)C[C@H](CC(=O)NNC(=O)c1cccnc1)C(=O)NNC(=O)c1cccnc1	809545693	OYDGQKNDVNXJMJ-INIZCTEOSA-N	426.477	1.141	50	20	IDGD	
CCc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccc(C(C)=O)cc1	810386193	PRIPIRKPVUUPRZ-CYBMUJFWSA-N	442.428	1.913	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C[C@H](c2ccccc2)N2CCOC2=O)cc1	812730708	STFKHBAIMSJUSC-GOSISDBHSA-N	432.502	1.964	50	20	IDGD	
O=C(NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)Nc1ccc2c(c1)OCO2	813467402	GNBDSNKUTUHSKD-UHFFFAOYSA-N	432.458	1.666	50	20	IDGD	
Cc1nn(C)c(N)c1C=NNC(=O)c1cc(S(=O)(=O)NCc2ccccc2)ccc1O	814778560	LIXYKECCJBAFKD-UHFFFAOYSA-N	442.501	1.259	50	20	IDGD	
Cc1ccc(-c2nnco2)cc1NC(=O)C(=O)NNc1ccccc1S(=O)(=O)N(C)C	815751875	SBXLCDWGLCKSEB-UHFFFAOYSA-N	444.473	1.377	50	20	IDGD	
CC(C)c1c(Cl)ncnc1NNC(=O)[C@@H](C)NS(=O)(=O)c1ccc(C(N)=O)cc1	816486044	LRGBQYWTKQEZNH-SNVBAGLBSA-N	440.913	1.162	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)N2CCC(C(=O)N3CCOCC3)CC2)c1C	842684154	IIMJOUFSJFDTFA-RCCKNPSSSA-N	428.533	1.756	50	20	IDGD	
CC(C)n1ncc2cc(/C=C\C(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)c(=O)[nH]c21	891625304	PAOXFJVEHMVKKO-HJWRWDBZSA-N	447.455	1.027	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)/C(=C/c1ccccc1)n1nnnc1C	894410465	OOOGMSRARIVZCT-UYRXBGFRSA-N	430.472	1.739	50	20	IDGD	
CCOC(=O)c1ccc(N2C(=O)/C(=C/NNC(=O)CCCO)c3ccccc3C2=O)cc1	912753252	WWWDRJDJXPDFSB-XMHGGMMESA-N	437.452	1.785	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)C1=NN(c2ccccc2)C(=O)[C@@H](C)N1	915189212	DNSKNPCQSFTLSL-CQSZACIVSA-N	433.472	1.085	50	20	IDGD	
CCOc1ccc(CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1OC	915257754	IUAUIYSHVBLTEP-UHFFFAOYSA-N	435.506	1.531	50	20	IDGD	
COC(=O)c1cccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)c1	916096574	VSKUSHHZPKXNBO-UHFFFAOYSA-N	445.497	1.723	50	20	IDGD	
CN(C)N(C(=O)[C@@H]1CCN(c2ccccc2Br)C1=O)[C@H]1CCS(=O)(=O)C1	916109925	OYGYMHIPWJTJDK-QWHCGFSZSA-N	444.351	1.294	50	20	IDGD	
Cc1nc2ccccc2n1CCNC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	916195443	KGKZJCCDNOQHKD-UHFFFAOYSA-N	449.559	1.887	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)NCc2ccc(-n3ccnc3)nc2)c2ccccc2c1=O	916236644	OCUAIYRRXLGVBQ-UHFFFAOYSA-N	446.471	1.702	50	20	IDGD	
CCS(=O)(=O)NCCNC(=O)NNC(=O)c1ccccc1OCc1ccc(F)cc1	916516675	NOBXWUPCCAJPLQ-UHFFFAOYSA-N	438.481	1.288	50	20	IDGD	
O=C(NCCS(=O)(=O)Cc1ccccc1)NNC(=O)c1cc(Br)c[nH]1	916636174	QQTUGQIEACLVNJ-UHFFFAOYSA-N	429.296	1.336	50	20	IDGD	
Cc1ccc(C)c(S(=O)(=O)NCC(=O)NNC(=O)c2cc(C)nc3ccccc23)c1	917365447	SSNZENCXTVXMNL-UHFFFAOYSA-N	426.498	1.900	50	20	IDGD	
CCOc1ccc(C(=O)NNS(=O)(=O)c2ccc([C@@H](C)NC(C)=O)s2)cc1OC	918399972	WONIQOGBHBZJQX-LLVKDONJSA-N	441.531	1.976	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)NCc1ccc(C(=O)N2CCOCC2)cc1	919901163	LCOUGKAAUYISNN-UHFFFAOYSA-N	426.473	1.241	50	20	IDGD	
COc1ccccc1NC(=S)NNC(=O)c1ccc(S(=O)(=O)NCCC#N)cc1	921160133	KJKCSMBJOATPCR-UHFFFAOYSA-N	433.515	1.519	50	20	IDGD	
CCOC(=O)C1(CNC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)CCCC1	1122091661	CSZOCOZGYVETMB-UHFFFAOYSA-N	439.538	1.356	50	20	IDGD	
O=C(CC1(CC(=O)N2CCOCC2)CCCC1)NNC(=O)c1cc(Br)c[nH]1	1248521447	HVXVNBCRENBWNM-UHFFFAOYSA-N	441.326	1.738	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)NCc2ccccc2N2CCN(C)CC2)c1	1318331444	FLQUYZDCWQNVKJ-UHFFFAOYSA-N	425.533	1.965	50	20	IDGD	
O=C(COC(=O)c1ccc(Cn2cccc2)cc1)NNC(=O)[C@@H]1COc2ccccc2O1	1318332050	JZTNQFHNMQSQLO-FQEVSTJZSA-N	435.436	1.681	50	20	IDGD	
O=C1CN(c2ccc(NC(=O)NNC(=O)c3n[nH]c4c3CCCC4)cc2Cl)CCN1	1320123845	IDVKDQOYGXNCDH-UHFFFAOYSA-N	431.884	1.345	50	20	IDGD	
C[C@@H]1Oc2c(cccc2C(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)NC1=O	1339205362	YBPKKDIOTDFKPG-LBPRGKRZSA-N	432.477	1.814	50	20	IDGD	
COc1ccc(S(=O)(=O)CCC(=O)NNC(=O)CSc2ccccc2OC)cc1	1341311204	XNSBEFSWRFMHKU-UHFFFAOYSA-N	438.527	1.807	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCBr)C2	1778105563	YSVIZGKJSHTGGI-DDUZABMNSA-N	432.359	1.152	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cn4cccnc4n3)C2)C1	1778473944	GFNJVVFUMGOYQE-SCLBCKFNSA-N	436.310	1.204	50	20	IDGD	
COc1nc(C)ccc1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2	1779738086	IBKFJLGHTJHRCC-DJJJIMSYSA-N	440.338	1.873	50	20	IDGD	
O=C(c1cccnc1-c1ccc(F)cc1)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1780348822	ZQQILAWFPXFCRL-GCJKJVERSA-N	447.894	1.931	50	20	IDGD	
CN(C)c1cncc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@](C)(Cl)CCl)C3)C2)c1	1781224140	HYVIOTBCORXHLY-RTBURBONSA-N	429.348	1.827	50	20	IDGD	
CN(C)c1cccc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)c1	1781334162	MNXZIMDRNSZNDX-CRAIPNDOSA-N	428.302	1.887	50	20	IDGD	
CCOC(=O)C1(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](F)Br)C3)CC1	1781626164	RYHXTGHAPVDTJJ-IIYDPXPESA-N	449.317	1.534	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H]1CC[C@H]3CCC(=O)N3C1)C2)C(Cl)Cl	1782219378	YHGWWASYUMRIEW-UJKGCTCZSA-N	446.375	1.705	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3nccc4nc[nH]c34)CCO2)C1	1783347501	JWFXKLNCZGLKGS-XIKOKIGWSA-N	436.310	1.575	50	20	IDGD	
COc1cnc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](C)Br)C3)C2)c(F)c1	1783532669	QTSSXLJZQXGEHV-PIGZYNQJSA-N	430.274	1.456	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3CCN(C)CC3)[C@H]2C1	1783598441	DDRJESKJQQOMOZ-QAETUUGQSA-N	430.387	1.481	50	20	IDGD	
CC1(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)/C(C#N)=C/c4ccc(F)cc4F)C[C@@H]32)COC1	1783671667	YXUCBFVDOURILU-IPHSZAQTSA-N	445.466	1.888	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)Cc3cc(F)ccc3OC)CCO2)C1	1783878312	CWMBJAIAWWVQDL-OXQOHEQNSA-N	428.888	1.461	50	20	IDGD	
C[C@@H](Sc1ccccc1)C(=O)N1CCO[C@@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1	1783933295	GLIPKMVBCDRYPX-VGOFRKELSA-N	448.589	1.370	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(-c4ccccc4)n3)C[C@@H]21)[C@H](O)CCl	1784090454	HAEAMDFQXILXMQ-PZBISTMVSA-N	443.931	1.942	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)C3(c4ccccc4F)CC3)C2)C1	1785463483	WTMSUXZCCNHFCZ-QFIPXVFZSA-N	446.523	1.060	50	20	IDGD	
CN1CCCC[C@H]1C(=O)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1	1786151314	NAVBFJDFXAZHDO-NRFANRHFSA-N	435.333	1.598	50	20	IDGD	
O=C(/C=C/C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]2C1)NCc1ccccc1	1787443920	XMFHZYPPPUAJCG-KTHDREROSA-N	437.899	1.373	50	20	IDGD	
Cc1nc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](O)CCl)C[C@@H]32)c(C(F)(F)F)o1	1787481088	VXJKXIUPRPIUDJ-YFKTTZPYSA-N	439.818	1.195	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4cnccc4n3)[C@H]2C1	1787891099	ZYUDRZFJSBFTGU-FPXQBCRKSA-N	432.908	1.477	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)N3C[C@H]4C[C@H]4C3)[C@H]2C1	1788516900	RVTPXIAJFOORHC-WSKJNLASSA-N	442.398	1.480	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)Nc3ccccn3)[C@H]2C1	1788783331	QNJOYAXIKZCNLO-OWYFMNJBSA-N	439.354	1.645	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)c1ccc(Cl)nn1	1788837332	KYEOIOIZRKBLLK-GVXVVHGQSA-N	431.718	1.508	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21)[C@H]1CC[C@H]2CCC(=O)N2C1	1789770627	ABIJFUUNPNDFFX-YTFOTSKYSA-N	432.348	1.171	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3nc(C)no3)C[C@@H]21	1790962168	WUQFBXADHBLPGD-FQUUOJAGSA-N	429.315	1.074	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/c3cnccn3)C[C@@H]21	1790963348	FQHOQTPTWUBJTF-OQSFXPJBSA-N	437.338	1.643	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(-n4cncn4)c3)C[C@@H]21)C(Cl)Cl	1791296694	GQMHETBZJPNNDQ-BPUTZDHNSA-N	438.315	1.664	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)Cn1cccn1)C2	1792869836	BUDPHIYWJFBANX-DGXTUMSLSA-N	427.343	1.140	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(-n3cccn3)nc1)C2	1793449181	QIMIJYMOMLEUMP-SFNKJDCFSA-N	431.924	1.878	50	20	IDGD	
Cc1cccc(C)c1N1C[C@@H](C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](O)CCl)C3)CC1=O	1794130193	YJYPYBLGQYPPRT-OYSTVDSJSA-N	447.963	1.894	50	20	IDGD	
COc1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)cc1F	1796185707	IXIQWVXXTBAYKH-BCDXTJNWSA-N	426.253	1.080	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(C(F)(F)F)n1C	1797201417	IMEBXDNHRDGDHS-BTTYYORXSA-N	443.470	1.669	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1Cc3ccccc3CN1)C2	1799275268	OBLJHHXSRKJENS-KSZKVXGTSA-N	440.371	1.527	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CSc1ccncc1)C2)[C@@H](F)Br	1799344260	FOBOBLYKSIYHFN-BAESOJJISA-N	432.315	1.454	50	20	IDGD	
Cc1ccn2c(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)CO[Si](C)(C)C)C4)cnc2c1	1800084943	FDECYUGILQQIGP-CWPLJXCYSA-N	430.581	1.697	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(OC(F)F)cc1	1800474536	IXVWDHOFKNUUNV-MUJYYYPQSA-N	438.475	1.913	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c(O)cc(O)cc1O)C2	1800643245	NGQDOJARZLTWJP-FXZYXXQUSA-N	443.294	1.180	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)Br	1800761631	DDASGFXVDQXRAR-LDMBFOFVSA-N	426.149	1.533	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(OC(C)C)c(C#N)c1)C2	1800983123	PLGFDLYKYZOLNO-AJYBTWMASA-N	449.935	1.802	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)[C@H]1C[C@@H]1C1CC1	1802991562	YQOVEXPDSHYKCR-WSWWRLHASA-N	433.317	1.127	50	20	IDGD	
CC(=O)NCCC(=O)N1CC[C@H](CNC(=O)[C@@H](C)CBr)[C@@H]1c1cccnc1	1803013762	ACUMEWXASCJLRC-XCRHUMRWSA-N	439.354	1.645	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)ncc1[N+](=O)[O-]	1803138884	HCIBOIGYDFOXGT-OLMNPRSZSA-N	447.879	1.613	50	20	IDGD	
COc1ccc(F)c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)c1	1803596268	ARKFLBZPTASAHW-BJWYYQGGSA-N	426.253	1.080	50	20	IDGD	
Cn1nc(C(=O)NC[C@@H]2CCN(C(=O)CCBr)[C@@H]2c2cccnc2)cc1O	1804895003	RMAQVFZAAGEIRC-SUMWQHHRSA-N	436.310	1.625	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC2(CCCN(C(=O)[C@H]3CCCCO3)C2)CC1	1804951809	RKCLAMAJFUCMLB-WZGTUUFSSA-N	443.548	1.921	50	20	IDGD	
COC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@H]1c1cccnc1	1806377685	RSZQQDKMHIJYNR-RCBQFDQVSA-N	430.274	1.731	50	20	IDGD	
O=C([C@H](O)CCl)N1CCC2(CCCN(C(=O)C(F)(F)C(F)(F)C(=O)O)C2)CC1	1806533741	SLQHRPMAYQEJLH-SNVBAGLBSA-N	432.798	1.173	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cc[n+]([O-])cc2)[C@@H]1c1cccnc1)[C@@H](F)Br	1808676342	PKIXJLUIRGQTNR-ARFHVFGLSA-N	437.269	1.725	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)c1nnsc1C1CC1	1808734201	WBEOPRSFPNWICF-OFQRWUPVSA-N	435.937	1.730	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC2(CCCN(C(=O)c3n[nH]c4c3CCCC4)C2)CC1	1810600494	AIURHTXJRHMCEA-UHFFFAOYSA-N	444.580	1.506	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](Cl)COC)[C@@H]1c1cccnc1	1812368207	YHOKHOUAXNCOAA-BSWAZPDLSA-N	441.912	1.903	50	20	IDGD	
CCS(=O)(=O)CC(=O)N1CC[C@H](CNC(=O)[C@H](C)Br)[C@@H]1c1cccnc1	1812863939	FCKOBMIJGFAYEE-BJJXKVORSA-N	446.367	1.306	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)CCS(C)(=O)=O)[C@@H]1c1cccnc1	1813573193	DHTZYWCMELAOGG-RYRKJORJSA-N	429.970	1.930	50	20	IDGD	
O=C(COc1ccc(F)cc1)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](O)CCl)CC2	1813717714	ZLQCAAUYGMAKMI-FZMZJTMJSA-N	427.885	1.873	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)CS(C)(=O)=O)sc2C1	1814327497	FOKVHALWTAOFIU-BDAKNGLRSA-N	438.369	1.273	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cncc(F)c2)[nH]n1)c1cccc(B(O)O)c1	1817473154	IZBSRBUPJYUDGX-GOSISDBHSA-N	437.240	1.243	50	20	IDGD	
CC(C)[C@@H](S)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1	1817473845	CFADNUJQPYCWDM-FUHWJXTLSA-N	430.339	1.350	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCc2cccnc2)n[nH]1	1817637024	ZEMNETGXERHZOT-GOSISDBHSA-N	441.536	1.803	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2n[nH]c3c2CS(=O)(=O)C3)[nH]n1)[C@@H](F)Cl	1818037474	KCZPGUWLFURKTB-BXUZGUMPSA-N	444.876	1.402	50	20	IDGD	
Cc1cc(C)n2ncc(C(=O)Nc3cc([C@H]4CCCCN4C(=O)[C@@H](O)CCl)[nH]n3)c2n1	1818584305	SFROKDSNAYHYPU-CVEARBPZSA-N	445.911	1.975	50	20	IDGD	
CO/C=C(\C)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1)CC2	1819539274	DGXNBTVNNBVXNK-QHGBOQLOSA-N	444.517	1.739	50	20	IDGD	
CC[C@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](Cc2cnc[nH]2)NC(C)=O)[nH]n1	1820859959	IBAIVCAMFNHUKO-USXIJHARSA-N	449.943	1.890	50	20	IDGD	
C[C@H](NC(=O)c1ccccn1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1	1821662985	XGVIHYUJAWHQGM-MAZHCROVSA-N	448.911	1.215	50	20	IDGD	
CCOc1ccc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@H](Cl)COC)CC3)nn1	1821760222	CGMUBMQECJWVLZ-WDEREUQCSA-N	439.925	1.811	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1	1822417013	VONNHZRVNAMKLJ-TZMCWYRMSA-N	428.921	1.029	50	20	IDGD	
CC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CS(=O)(=O)N1CCCC1)CC2	1822846434	ZEJHLILYOCTFEG-RYUDHWBXSA-N	448.998	1.498	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(O)cc3F)sc2C1	1823347159	IOGOLFBEPULBBE-NSHDSACASA-N	449.508	1.587	50	20	IDGD	
CN1N=C(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)[C@H](F)Br)CC2)CCC1=O	1824925740	FMFMZSSFBTUXCA-ZBFHGGJFSA-N	445.333	1.905	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cnsn2)CC1	1825522058	IUOVZDALQCMTGJ-KRWDZBQOSA-N	443.533	1.084	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1nccc3nc[nH]c13)CC2	1825998869	NWVNMTVHNPDCSE-UWVGGRQHSA-N	434.909	1.894	50	20	IDGD	
C[C@@H]1C[C@]1(C)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1	1828924013	IBUAIHAAZFMGQQ-ZOUOIUENSA-N	427.549	1.965	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)CC[C@@H](N)C(N)=O)CC1	1829102283	NBOXJEZHXNQFGN-IAGOWNOFSA-N	426.634	1.050	50	20	IDGD	
Cc1c(F)cccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1830161275	VAFSOYGRYVANGQ-QAPCUYQASA-N	447.276	1.895	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(O)nc(Cl)c3)C2)C1	1830358638	QAXFRGZMSAIYEP-LJQANCHMSA-N	446.331	1.776	50	20	IDGD	
C[C@H](C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2)n1ccccc1=O	1830364722	RHHYLGOHVFWHCN-IERDGZPVSA-N	439.940	1.131	50	20	IDGD	
Cc1ccncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1	1831873335	PZLCICMJMARYTB-FQEVSTJZSA-N	429.565	1.996	50	20	IDGD	
COc1ccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)cc1C	1832093967	NJMYEHAGWBAGLH-HXUWFJFHSA-N	445.343	1.806	50	20	IDGD	
O=C(c1ccc(Cl)nc1F)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1833269635	VIWZDWJTNBWGOG-MRXNPFEDSA-N	440.686	1.748	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cccnc3S)CC2)CC1)[C@@H](O)CCl	1833306561	VISCIQHAEZUJTH-INIZCTEOSA-N	426.970	1.155	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)CCc3cccs3)CC2)CC1)[C@@H](O)CCl	1833307901	CXJKCXLOYBHNQD-SFHVURJKSA-N	427.998	1.852	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)[C@@H]3CCC(=O)N3C)CC2)CC1	1833532966	CCIWAEBZNBTHHF-ROUUACIJSA-N	426.989	1.586	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)CNC(=O)c3cccnc3)CC2)CC1	1833771661	JCWKOPHTONYJSO-LJQANCHMSA-N	449.983	1.400	50	20	IDGD	
COc1ccc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCBr)CCO3)C2)cc1	1834824207	WOXITIDXMJXWPT-LJQANCHMSA-N	441.322	1.550	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)C#Cc3ccccc3)CCO2)C1	1835103229	YULPODUHXNZRGE-NQIIRXRSSA-N	449.345	1.668	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3c(C)n[nH]c3C)CC2)CC1	1835870958	SPOJPUWGUDHXRR-QGZVFWFLSA-N	425.961	1.466	50	20	IDGD	
CCCC(=O)N[C@H](C)C(=O)N1CCC(N2CCC(NC(=O)[C@H](Cl)CC)CC2)CC1	1836396856	NOJGTRHKKBAZMN-CRAIPNDOSA-N	429.005	1.880	50	20	IDGD	
O=C(CS[C@H]1CCCCO1)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836717252	PQGVWCJRTTZOAY-MJGOQNOKSA-N	449.013	1.845	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc4cnccc34)CCO2)C1	1837036749	ZEWPIIHETIIXPR-KNQAVFIVSA-N	447.919	1.559	50	20	IDGD	
Cc1cc(/C=C/C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)no1	1837557288	GVDRSKSOZPEHAO-RHINWDHMSA-N	446.273	1.143	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)CN3CCOCC3)CC2)CC1	1837805254	AJCKGNLFXFDZKV-OAHLLOKOSA-N	446.386	1.101	50	20	IDGD	
CN1C(=O)CC[C@H]1C(=O)N1CCC(OC2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1838649028	SKWKKTKNQSPQPR-GOEBONIOSA-N	448.333	1.296	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3ncccc3OC)C2)C1	1839142093	DSXLBJHGRQAPIS-IERDGZPVSA-N	439.940	1.497	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccn(-c4ccccc4)n3)C2)C1	1839145656	BUJWIGJIPOGPPA-AVRDEDQJSA-N	446.935	1.960	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)ccc1F	1840035003	CXDZVQHWAYRAAD-AUUYWEPGSA-N	443.313	1.988	50	20	IDGD	
COC1(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)CCC1	1840617260	TXQAJPBASSOWCF-HKUYNNGSSA-N	437.364	1.638	50	20	IDGD	
Cc1cccc(C)c1N1C[C@H](C(=O)N2CC3(CCCN3C(=O)[C@H](O)CCl)C2)CC1=O	1841350326	VNZSXBLQTNEYCM-IAGOWNOFSA-N	433.936	1.459	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC2(CCCN2C(=O)[C@@H](CCO)NC(=O)OC(C)(C)C)C1	1841431950	UNZBBKKHXYKIGB-CHWSQXEVSA-N	448.358	1.249	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)[C@H](C)Nc2cccnc2)C1	1842924419	ZQKBSHODZHEEMA-CXEIWHQESA-N	437.504	1.219	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)[C@H]1C[C@@H]1c1ccc(F)cc1)C2	1844263175	BPHFVWLQUVQJEU-MSOLQXFVSA-N	437.475	1.445	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)C2(c3ccc(Cl)cc3)CC2)C1	1845916481	GMTMDDSAEKVGRC-UHFFFAOYSA-N	438.720	1.569	50	20	IDGD	
COc1ccc([N+](=O)[O-])cc1C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	14798009	WNZVAYWYDFHJSJ-UHFFFAOYSA-N	427.461	1.577	50	20	IDGD	
O=C(/C=C/c1ccc(I)o1)NNC(=O)[C@@H]1COc2ccccc2O1	15795309	QHWGFNQFLWPLPO-CFNZNRNTSA-N	440.193	1.885	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(C(=O)NNC(=O)c2n[nH]c(=O)c3ccccc23)cc1	15941730	AKWKXHNBMWZMAM-UHFFFAOYSA-N	443.485	1.028	50	20	IDGD	
C[C@H]1CC(C)(C)C[C@]2(C1)NC(=O)N(CC(=O)NNC(=O)c1ccc3c(c1)OCO3)C2=O	22929430	LWSJTQFFTZOCLV-QKVFXAPYSA-N	430.461	1.313	50	20	IDGD	
CCCn1nc(C(=O)NNS(=O)(=O)c2cccc(C(=O)OC)c2)c2ccccc2c1=O	24259115	QWJNEKOHBNZKRH-UHFFFAOYSA-N	444.469	1.216	50	20	IDGD	
C[C@@H](NC(=O)c1ccccc1)C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	25257949	WEQWTXKIEOJQMR-OAHLLOKOSA-N	444.513	1.051	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)c2ccc(S(C)(=O)=O)cc2)cc1	26752492	BYAWXXZEUXXJBX-UHFFFAOYSA-N	445.526	1.586	50	20	IDGD	
O=C(COC(=O)c1c(Cl)nc2ccccn12)NNC(=O)[C@H]1COc2ccccc2O1	116786953	RTBAJWBVTNJVNN-CYBMUJFWSA-N	430.804	1.132	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCCN2C(=O)Cc3ccccc32)cc(OC)c1OC	725860811	UICUYMUXMSOZRB-UHFFFAOYSA-N	428.445	1.246	50	20	IDGD	
COc1ccc(OC)c(NC(=S)NNC(=O)Cc2csc(N3CCOCC3)n2)c1	726436830	MLTACBCAFIECRE-UHFFFAOYSA-N	437.547	1.557	50	20	IDGD	
C[C@H](C(=O)NNC(=O)NCc1cccc(C(F)(F)F)c1)N1C(=O)NC2(CCCC2)C1=O	726528790	GNEASOADVPJZSR-LLVKDONJSA-N	441.410	1.789	50	20	IDGD	
NS(=O)(=O)c1ccc(CCNC(=O)NNC(=O)c2c(Cl)cccc2Cl)cc1	727851958	SOPOPJPZLZBERV-UHFFFAOYSA-N	431.301	1.828	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)[C@@H]2CCCN2C(=O)OCC(F)(F)F)cc1	727931331	WGFUBHXCPZYXNB-ZDUSSCGKSA-N	431.367	1.463	50	20	IDGD	
COc1cc(C(=O)NNc2nc(-c3cccnc3)no2)ccc1OCC(=O)NC(C)C	728076844	KCBIBBURACUXTR-UHFFFAOYSA-N	426.433	1.801	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)N2CCN(c3oc(-c4ccco4)nc3C#N)CC2)c1	728953914	ZCPBQYXBOLBYKS-UHFFFAOYSA-N	431.412	1.855	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)[C@@H]2CC(=O)N(C[C@@H]3CCCN3CC)C2)cc1OC	729627774	UVQIBQNSGAGRFB-MSOLQXFVSA-N	446.548	1.578	50	20	IDGD	
CC/C=C(\C)C(=O)N1CSC[C@H]1C(=O)OCC(=O)NNC(=O)c1ccc(Cl)cc1	730321744	BQJKPZVZHANEDD-XANQCZFBSA-N	439.921	1.902	50	20	IDGD	
CC(=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O)c1ccc2c(c1)Cc1ccccc1-2	730569408	ZHCVWLOUAJXSQF-UHFFFAOYSA-N	435.509	1.683	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)COc1ccccc1O)n1nnc(-c2ccc(Cl)cc2)n1	730782611	QISLRYQBGGBSDI-AWEZNQCLSA-N	430.852	1.877	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)NC[C@@]2(C)CCOC2)cc1	733181123	QWRUJUZLCIRDIB-XMQQHFNTSA-N	437.500	1.884	50	20	IDGD	
COc1ccc(C(=O)NNc2nc3ccccc3c(=O)n2C)cc1S(=O)(=O)NC(C)C	733260917	FAIPAAHSQMFYHU-UHFFFAOYSA-N	445.501	1.386	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)Cn2cc(Br)cn2)cc1C	736792905	FYPNUXXGEPPQHX-UHFFFAOYSA-N	429.296	1.582	50	20	IDGD	
O=C(CCCc1nc(C2CC2)no1)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	739678995	OPYGHPWAZZKIFU-UHFFFAOYSA-N	447.517	1.515	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@H]2CCCN(C(=O)NCC(C)C)C2)c2ccccc2c1=O	741207236	KZUSKBTYHIBWKI-HNNXBMFYSA-N	442.520	1.255	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H]2[C@H]3CCO[C@@H]3C2(C)C)c1	741426614	VVFWXBFYGBMNHL-ZACQAIPSSA-N	438.550	1.475	50	20	IDGD	
Cc1cc(C)nc(-n2[nH]c(C(=O)NNC(=O)c3cc4c(s3)CC[C@H](C)C4)cc2=O)n1	741740933	JBEADRAXUSMXIF-JTQLQIEISA-N	426.502	1.834	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)c1ccc2c(c1)CC(=O)N2C	743588245	XYJQATURMRBGQB-LBPRGKRZSA-N	445.501	1.706	50	20	IDGD	
Cc1ccc(NC(=O)N(C)C)c(C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c1	745035640	BDLBWUHWSGROSU-UHFFFAOYSA-N	443.416	1.615	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1)[C@H]1CCOC1	745861337	KHQDYTTVZBHVAT-OLZOCXBDSA-N	438.531	1.918	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)N[C@H]2C[C@H](C)N(c3cnn(C)c3)C2=O)cc1OC	745919722	WQYMHWQJLPDSDM-BBRMVZONSA-N	444.492	1.356	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NCCc2nc(C(F)(F)F)cs2)c2ccccc2c1=O	745920908	RSURZKIMXXBDRD-UHFFFAOYSA-N	440.407	1.596	50	20	IDGD	
CCOc1ccc(OCc2ccc(C(=O)NNC(=O)c3nc(O)nc(O)c3N)cc2)cc1	746093207	NDEHUWJDWCSRTF-UHFFFAOYSA-N	439.428	1.523	50	20	IDGD	
COC(=O)CNS(=O)(=O)c1cccc(NC(=O)c2c(C)nn(CCCl)c2C)c1	746128222	NXFNJAPMGDEIHU-UHFFFAOYSA-N	428.898	1.442	50	20	IDGD	
Cn1ncnc1COc1ccc(S(=O)(=O)NNC(=O)c2cc3c(s2)CCC3)cc1	746592318	WAPITKIIHUNQSP-UHFFFAOYSA-N	433.515	1.568	50	20	IDGD	
COc1cc(C)nc(NNC(=O)CCn2cnc3ccc(Br)cc3c2=O)n1	746633218	QVTXCJKOWDFRGH-UHFFFAOYSA-N	433.266	1.799	50	20	IDGD	
O=C(NCCOc1ncccc1C(F)(F)F)NNC(=O)c1ccc(-n2cnnn2)cc1	746702141	LSFODKLDROOCHP-UHFFFAOYSA-N	436.354	1.099	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)[C@@H]1Cc2ccccc2CN1Cc1ccccc1	747787794	VXHYUZHBGNXDPZ-PMACEKPBSA-N	427.526	1.196	50	20	IDGD	
O=C(NCCS(=O)(=O)N1CCOCC1)NNc1nc(Cl)c(Cl)cc1Cl	748111872	POUMHAVONVSVJE-UHFFFAOYSA-N	432.717	1.330	50	20	IDGD	
COc1cc(CN2CCN(CC(=O)NNC(=O)c3ccccc3)CC2)cc(OC)c1OC	749852632	JKXNSCUNIIHEGX-UHFFFAOYSA-N	442.516	1.291	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)NNC(=O)NCc2cccc(C(F)(F)F)c2)c(C)o1	751362469	VRLUYZWHBBDYDI-UHFFFAOYSA-N	434.396	1.659	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N[C@H]2CCN(Cc3ccc(C#N)cc3)C2=O)cc1OC	753025751	OXGWBUPUDRWYJR-KRWDZBQOSA-N	437.456	1.321	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=S)Nc1ccc2c(c1)OCCO2	753787509	XJIZCUXNTZVTLD-UHFFFAOYSA-N	441.557	1.988	50	20	IDGD	
COc1cc(OC)cc(OCCCNC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1	753924616	JEWDKXDEMVJILQ-LJQANCHMSA-N	431.445	1.643	50	20	IDGD	
Cc1sc2ccc(Cl)cc2c1S(=O)(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1	753982253	VXYGTIQHYWCLJY-JTQLQIEISA-N	437.952	1.543	50	20	IDGD	
Cn1c(=O)oc2cc(C=NNC(=O)c3cccc(S(=O)(=O)N4CCCC4)c3)ccc21	754902168	WWISIVPWVOGRHU-UHFFFAOYSA-N	428.470	1.680	50	20	IDGD	
COc1cccc(-c2noc(SCC(=O)NNC(=O)CNC(=O)c3cccs3)n2)c1	755223957	WMRBELMZFHUFIQ-UHFFFAOYSA-N	447.498	1.476	50	20	IDGD	
C[C@H](NC(=O)OC(C)(C)C)[C@@H](C)C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	755314792	ZTEXJUYPIRDURV-MSOLQXFVSA-N	447.580	1.895	50	20	IDGD	
CCN1CCN(c2ccc(NC(=O)NNC(=O)[C@H]3COc4ccccc4O3)cc2)CC1	755471637	HVPDLXMJTDAOJT-HXUWFJFHSA-N	425.489	1.821	50	20	IDGD	
Cc1c(/C=C(\C#N)C(=O)NC2CCN(S(=O)(=O)C(F)(F)F)CC2)cc(C#N)n1C	755690595	NOBYZTWCGLWZGM-NTUHNPAUSA-N	429.424	1.542	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccc(C(=O)N3CCOCC3)cc2)c1	755933645	MTGKAMBUEMULPR-UHFFFAOYSA-N	446.485	1.029	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)Nc2ccc(CCN3CCOCC3)cc2)cc1	756165868	ROSXFEHDLHDNPC-UHFFFAOYSA-N	428.489	1.802	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)c2ccc3c(c2)OCO3)cc1N1CCCS1(=O)=O	756705761	PLXMWHJGOUYJDN-UHFFFAOYSA-N	432.458	1.730	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)Nc1ccc(S(=O)(=O)NC2CC2)cc1	756774368	CDYBSOYELPREQY-UHFFFAOYSA-N	448.501	1.758	50	20	IDGD	
CCc1c(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cnn1CCC(C)C	756795850	DDAIIJJFPVBUDK-UHFFFAOYSA-N	435.550	1.817	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2Br)c1	758032474	TWQLUJQVPYVGAQ-UHFFFAOYSA-N	442.247	1.836	50	20	IDGD	
COc1cccc(NNC(=O)Nc2ccc(NC(=O)CCN3C(=O)CNC3=O)cc2)n1	758062285	IWVKWPMIVARDEF-UHFFFAOYSA-N	427.421	1.119	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@H](NC(=O)NNC(=O)CSc2ccccc2O)[C@H](C#N)C1	758758019	HZIZOAVVLWRYNM-CHWSQXEVSA-N	435.506	1.574	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H](C#N)[C@H](NC(=O)NNC(=O)c2cc(Br)c[nH]2)C1	758780261	ZSRCMAFUBXRAEL-JOYOIKCWSA-N	441.286	1.480	50	20	IDGD	
CN(NC(=O)c1cccnc1-n1cccn1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758782328	QETTTWZBUZAYDI-UHFFFAOYSA-N	429.481	1.517	50	20	IDGD	
Cc1nnc(-c2cccc(C(=O)OCC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)c2)o1	758980262	VPPJJLGKEFDBLB-UHFFFAOYSA-N	425.357	1.571	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(F)(F)[C@@H](C(=O)OCC(=O)NNC(=O)c2cccs2)C1	759291165	PCDANBHWXFXELT-LLVKDONJSA-N	447.460	1.945	50	20	IDGD	
Cc1nc2ccnn2c(C)c1C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	761167040	PXIRCEYZQGPCFI-UHFFFAOYSA-N	430.490	1.124	50	20	IDGD	
CC(C)(C)OC(=O)Cc1ccccc1NC(=O)C(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	763454327	HOHDDQMTLGOMKU-UHFFFAOYSA-N	442.428	1.879	50	20	IDGD	
Cc1ccc2c(c1)=S=C(c1ccc(NC(=O)C(=O)NNC(=O)c3ccncc3)cc1)N=2	763462300	MAJQVTMIVKFUOU-UHFFFAOYSA-N	431.477	1.585	50	20	IDGD	
COc1c(Br)cc(Cl)cc1NC(=O)C(=O)NNC(=O)c1ccccn1	763467813	SZYIOIMYDJPWRY-UHFFFAOYSA-N	427.642	1.906	50	20	IDGD	
O=C(NNC(=O)c1cccnc1)C(=O)Nc1ccc(C(=O)NCc2ccccc2F)cc1	763491724	MNOHKPZPSBTYJS-UHFFFAOYSA-N	435.415	1.550	50	20	IDGD	
Cc1ccc(F)c(NC(=O)C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c1	763532340	WAIHYRRWECCSAA-UHFFFAOYSA-N	427.480	1.432	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)Nc1cc(C2CC2)nn1-c1ccccc1	763572095	LSDCUQGKWNLZTI-IBGZPJMESA-N	447.451	1.676	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2-c2ccccc2)ccc1C(N)=O	763643277	BAJKEPHLPWHDAR-UHFFFAOYSA-N	446.463	1.926	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)c1	763645350	UPGYYWZNUJCCJI-UHFFFAOYSA-N	438.484	1.704	50	20	IDGD	
COC(=O)CCOc1ccc(NC(=O)C(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)cc1	763727232	IPUFLIKQBXNKMR-UHFFFAOYSA-N	443.500	1.931	50	20	IDGD	
Cc1nc(-c2cccc(NC(=O)C(=O)NNC(=O)COc3ccccc3C#N)c2)oc1C	763807690	FIGWIRPMWMQPGV-UHFFFAOYSA-N	433.424	1.995	50	20	IDGD	
CCN(c1ccccc1)S(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)C(C)C)cc1	763833025	UTDAKMQIOLRLTR-UHFFFAOYSA-N	432.502	1.644	50	20	IDGD	
CO[C@H]1Cc2ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc3cccc(C)c3C)cc2C1	763840251	JWNGNAQWEOBVKD-BEFAXECRSA-N	425.485	1.970	50	20	IDGD	
Cc1cnc(O)n1-c1ccccc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccccc1F	763864203	GXSDTGBZUZOWJJ-CYBMUJFWSA-N	441.419	1.579	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccc(CN2CCCC2=O)cc1	763865839	RMDHJCWEMJUGSR-AWEZNQCLSA-N	442.447	1.502	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cnn(-c3ccncc3)c2)cc1	763878522	QTBCVROEADUARK-AWEZNQCLSA-N	436.428	1.023	50	20	IDGD	
CCCn1nccc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1cccc(Br)c1	763880758	ASJVIUZGXXOGIB-NSHDSACASA-N	438.282	1.609	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cccn2C)cc1NC(=O)CN1CCCCC1	763992736	IDULRANLNVMJQP-UHFFFAOYSA-N	440.504	1.158	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)c2cccn2C)sc2c1CC[C@@H](C)C2	763998461	JNXVFNUQNIXTJJ-LLVKDONJSA-N	432.502	1.788	50	20	IDGD	
Cc1ccc(Cn2nccc2NC(=O)C(=O)NNC(=O)c2cccc(Br)c2)o1	764059096	PICPYMZXNAVGEY-UHFFFAOYSA-N	446.261	1.995	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)nc2)ccc1N1CCSCC1	764101345	PQVGFYJRRWHQLJ-UHFFFAOYSA-N	433.921	1.996	50	20	IDGD	
COc1cc(OC)c(Cn2nccc2NC(=O)C(=O)NNC(=O)CC(C)(C)C)c(OC)c1	764197801	HHAHKHBEOPHZIK-UHFFFAOYSA-N	447.492	1.479	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CC(C)(C)C)cc1S(=O)(=O)NC(C)(C)C	764201943	IBAXOJGWZOXIRE-UHFFFAOYSA-N	426.539	1.594	50	20	IDGD	
CS(=O)(=O)N1CCc2c(NC(=O)C(=O)NNC(=O)CCC3CCCCC3)cccc21	764221975	RKCCYIJWXUXQNU-UHFFFAOYSA-N	436.534	1.455	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)C(=O)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1	764267249	FTCFAPMQYQJYNO-LJQANCHMSA-N	447.499	1.054	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc(-n4nccn4)cc3)n[nH]2)cc1C	764388046	XECYJRFULZSCJM-UHFFFAOYSA-N	444.455	1.674	50	20	IDGD	
Cc1ccc(NC(=O)Nc2ccccc2)cc1NC(=O)C(=O)NNC(=O)[C@H]1COCCO1	764434328	PYGYXUBHARBMLU-QGZVFWFLSA-N	441.444	1.140	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NN=Cc1cccnc1N)N(S(C)(=O)=O)CC2	764663727	XFDWLTFCSQIDMG-INIZCTEOSA-N	447.517	1.080	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)NCc2ccc(N3CCCS3(=O)=O)cc2)c1	764782341	OPHUWGJCGMXLLK-UHFFFAOYSA-N	446.529	1.753	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3ccc([S@](C)=O)cc3)n[nH]2)cc1OC	765597810	XMSGRDYEBIZDDL-PMERELPUSA-N	428.470	1.906	50	20	IDGD	
O=C(Cc1ccc(-n2cccn2)cc1)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765736817	BBGIPDNPXJRWAS-UHFFFAOYSA-N	446.511	1.020	50	20	IDGD	
Cn1ncc2cc(C(=O)NNC(=O)CN3CCN(Cc4ccccc4Cl)CC3)cnc21	765755960	JLFBNBVIZZRBAT-UHFFFAOYSA-N	441.923	1.201	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C#N)cc2OC)cc1Br	766259613	AETLOFWLZRUGPH-UHFFFAOYSA-N	447.245	1.738	50	20	IDGD	
C[C@H]1Cc2ccc(Br)cc2CN1C(=O)NNC(=O)CNC(=O)c1ccco1	766530180	NVEYMHUWKNYLOK-NSHDSACASA-N	435.278	1.960	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)NCCOc1ccc(S(=O)(=O)C(F)(F)F)cc1	766545074	GCUBCMBWFRMHEX-UHFFFAOYSA-N	446.407	1.327	50	20	IDGD	
CCc1nnc(O)c(C(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)c1CC	766641894	NTRQBCRLOLWSJF-UHFFFAOYSA-N	440.548	1.194	50	20	IDGD	
O=C(NNC(=O)C12CC3CC(CC(C3)C1)C2)C(=O)Nc1cc(C2CC2)nn1-c1ncccn1	768237529	MEARRAKJZPCKNX-UHFFFAOYSA-N	449.515	1.842	50	20	IDGD	
CSCCNC(=S)NNC(=O)Cc1csc(NC(=O)c2ccccc2F)n1	769769565	NOHMOZZGSKSHLP-UHFFFAOYSA-N	427.552	1.935	50	20	IDGD	
COc1ccc(N2C[C@@H](C(=O)NNC(=O)c3ccc4c(c3)OCCO4)CC2=O)c(OC)c1	770392506	VMNCWDVTGSZKQU-AWEZNQCLSA-N	441.440	1.289	50	20	IDGD	
CN(NC(=O)c1cc(O)nc2ccc(S(=O)(=O)Nc3ccc(F)cc3)cc12)C(N)=O	770537232	WMKUPMZXFIKJLW-UHFFFAOYSA-N	433.421	1.536	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)NNC(=O)[C@H]1COc2ccccc2O1	770650539	VSKYLQYRBYJVPL-BDJLRTHQSA-N	434.836	1.309	50	20	IDGD	
Cc1cccc(F)c1NNC(=O)C(=O)Nc1cccc(S(=O)(=O)NC2=NCCC2)c1	770822178	ZRJKICIIWRYTTI-UHFFFAOYSA-N	433.465	1.687	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)c1cc(S(=O)(=O)N(C)C)ccc1Cl	771887749	LEPRHBFPJYQOGT-NSHDSACASA-N	433.914	1.329	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)C1CCN(C(=O)c2cc(Cl)ccc2OC)CC1	771995774	XLIGCVUGYBFRHZ-LBPRGKRZSA-N	439.896	1.690	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1cccc(NS(=O)(=O)c2cccs2)c1	772020616	FCEQGRQBRYNNPV-LLVKDONJSA-N	425.488	1.652	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)N[C@@H]1CC(=O)N(C2CCCCC2)C1	772563677	CSGWCEOXUSPBPB-CQSZACIVSA-N	426.477	1.456	50	20	IDGD	
O=C(NNC(=O)N1CC[C@H]2[C@@H](CCCN2C2CC2)C1)C1CCN(c2ncccn2)CC1	773006468	UHJCOAVUNLFYPD-HKUYNNGSSA-N	427.553	1.383	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)C(=O)Nc2ccnn2-c2ccc(C)nn2)cc1	773498968	GHGKKOGVKJIBKO-UHFFFAOYSA-N	425.474	1.157	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(Br)cn1	773525688	OTPVESYURDRDGB-UHFFFAOYSA-N	437.250	1.408	50	20	IDGD	
Cc1nc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)ccc1Br	773526460	AQVNHWVOKABEBP-JTQLQIEISA-N	439.241	1.845	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(-c3nnc(N(C)C)o3)cc2)cc1F	773885260	LGECZUYJSNIZTA-UHFFFAOYSA-N	426.408	1.650	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccccc1N1CCOC1=O	774010612	YKXCDEHNGRYTML-GFCCVEGCSA-N	446.847	1.850	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCCNC(=O)NNc2cccc(S(C)(=O)=O)c2)s1	776624958	GSMVWWIKJCAYRB-UHFFFAOYSA-N	432.549	1.065	50	20	IDGD	
CSc1cccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1[N+](=O)[O-]	777084711	JAFUGTZOYLNRAX-UHFFFAOYSA-N	438.487	1.642	50	20	IDGD	
Cc1cc(F)c([N+](=O)[O-])cc1S(=O)(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	777919965	KLFOGCHQBPIWCI-UHFFFAOYSA-N	431.423	1.069	50	20	IDGD	
COC[C@H](C)n1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc3ccccc3c2)n1	778707192	HVTSULUCTCTNFM-LSDHHAIUSA-N	439.472	1.797	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3cnc(C(F)(F)F)nc3)cc2)CC1	779011945	MSMMPMSXXZDCIP-UHFFFAOYSA-N	444.439	1.188	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1ccc(-c2ncn(C)n2)cc1	780278280	SIMWKKWVNFLYDK-UHFFFAOYSA-N	443.847	1.762	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2nnc(-c3c[nH]nc3C)s2)c2ccccc2c1=O	782092522	GICSXYJDCOEZQJ-UHFFFAOYSA-N	439.461	1.433	50	20	IDGD	
COC(=O)c1cc(F)cc(S(=O)(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)c1	782259431	QWBWWJIZJCIDMT-UHFFFAOYSA-N	433.458	1.227	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)C(=O)Nc1ccc(F)c(F)c1F	782896469	IWFWVSOFTKZNHW-UHFFFAOYSA-N	443.407	1.105	50	20	IDGD	
CCOc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NNc1ncnc2ccsc12	783261242	BNWRUUSUHBWSAA-UHFFFAOYSA-N	428.474	1.874	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ccc(Cl)cc2)cc1S(=O)(=O)NC1CC1	783340445	VNTMFCMIXYXDNO-UHFFFAOYSA-N	438.893	1.871	50	20	IDGD	
O=C(NNc1ccc(-n2cccn2)nn1)C(=O)Nc1ccc([S@@](=O)C(F)(F)F)cc1	783433506	USCDAJIGLDIZIZ-SSEXGKCCSA-N	439.379	1.372	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)c2nccc3c(S(N)(=O)=O)cccc23)o1	783574848	OZMNGGOEFIHQTC-UHFFFAOYSA-N	445.501	1.392	50	20	IDGD	
Cc1cc(F)ccc1-n1ccc(C(=O)N2CCN(S(=O)(=O)CBr)CC2)n1	783602140	ASWWQKWXIXGXRF-UHFFFAOYSA-N	445.314	1.760	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2cc(C)nn2[C@H]2CCN(Cc3ccccc3)C2)ncn1	783945518	LRUWIBXACIIEQK-SFHVURJKSA-N	434.504	1.819	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)[C@H]2CC=CC[C@H]2C(=O)N2CCOCC2)cc1	784294867	TYIBPFYUKWZTOX-LSTHTHJFSA-N	445.516	1.441	50	20	IDGD	
Cc1cn(-c2ccc(C#N)cn2)nc1NC(=O)C(=O)NNc1ccc(Br)cn1	784340797	FTXQANZFWVSHLT-UHFFFAOYSA-N	441.249	1.687	50	20	IDGD	
Cn1c(C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)cc2c(=O)n3ccccc3nc21	784457478	TZWLZRPZSOFXSL-UHFFFAOYSA-N	433.453	1.713	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)c2ccc(CN3CCC(CO)CC3)cc2)c1	785710368	PYMSCUDSWWLTAN-UHFFFAOYSA-N	439.512	1.817	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2cc(Cl)ccc2OCC2CCC2)CCS(=O)(=O)C1	786423051	BNASWDFAZLZYCX-SFHVURJKSA-N	429.926	1.655	50	20	IDGD	
COC(=O)[C@](C)(CNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)c1ccccc1	787261931	XOEPKFBTUKKDBI-JOCHJYFZSA-N	440.504	1.154	50	20	IDGD	
CC(=O)N[C@H](CC1CCC1)C(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	787374095	PQMSKKPGYXQESH-MRXNPFEDSA-N	425.530	1.411	50	20	IDGD	
Cn1nc(-c2ccsc2)cc1NC(=O)C(=O)NNC(=O)c1cc(Br)c[nH]1	787545095	ZWQWJRVWANUYEW-UHFFFAOYSA-N	437.279	1.639	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NC[C@@H](c2ccnn2C)C(C)C)c2ccccc2c1=O	788322061	UHSOBHBQDHPNRO-MRXNPFEDSA-N	425.493	1.534	50	20	IDGD	
CN(C)[C@H]1CCCC(=NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)C1	788408015	OUZCUZSYNQQOLE-IBGZPJMESA-N	436.578	1.617	50	20	IDGD	
Cc1nc2c(cnn2C(C)C)cc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	790018248	CIKYCZADNAVFBU-UHFFFAOYSA-N	444.517	1.646	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccccc2)C1	790062951	DMVLGVDDUQXHRW-OAHLLOKOSA-N	427.523	1.024	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccc2ccn(C)c(=O)c2c1	793021645	HVVDOMGUNDHSLQ-LBPRGKRZSA-N	426.404	1.231	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNC(=O)c1cc([N+](=O)[O-])ccc1OC(F)F	794063728	QNTCLYSDYXZHQZ-UHFFFAOYSA-N	438.343	1.884	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3C[C@H](C)O[C@H](C)C3)c2)n1	794074599	CPVXIGOTJQIYIL-GASCZTMLSA-N	432.502	1.263	50	20	IDGD	
Cn1ccc(CCC(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)n1	794201370	VGRQIXKFQWRIFM-UHFFFAOYSA-N	441.513	1.292	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NCC2([S@@](C)=O)CCC2)c2ccccc2c1=O	798120634	PIKWNNBPXVSOKC-SSEXGKCCSA-N	433.534	1.442	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)OCC(=O)N2C	799259303	XTMXEMMNLHVICV-UHFFFAOYSA-N	432.820	1.104	50	20	IDGD	
O=C(NCCNS(=O)(=O)c1ccc(F)cc1F)NNC(=O)c1cc2c(s1)CCC2	799669839	JGWFCYONXCDISU-UHFFFAOYSA-N	444.485	1.438	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)CNC(=O)c2ccc(OC(F)F)c(OC)c2)cc1	802055857	UZBJGUQHQBFPRX-UHFFFAOYSA-N	438.387	1.888	50	20	IDGD	
COc1ccc(C)cc1N1C[C@@H](C(=O)NNC(=O)Nc2ccc3c(c2)OCO3)CC1=O	802104669	HYVUMBJZHKIYRH-ZDUSSCGKSA-N	426.429	1.938	50	20	IDGD	
Cc1ccc(Cc2ccccn2)cc1NC(=O)C(=O)NNC(=O)[C@H]1COc2ccccc2O1	802566086	YPYHAWORGIUTAD-OAQYLSRUSA-N	446.463	1.907	50	20	IDGD	
COC(=O)c1c(F)cc(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3n2)cc1F	802566100	ZLBABQBZFPWZLH-UHFFFAOYSA-N	428.351	1.699	50	20	IDGD	
CNS(=O)(=O)N1CCC(C(=O)NNc2ccc(Br)cc2Cl)CC1	802829647	SOIRRTWWFLPUDK-UHFFFAOYSA-N	425.736	1.722	50	20	IDGD	
Cc1cc([N+](=O)[O-])ccc1NNC(=O)[C@@H]1CCCC[C@@H]1C(=O)N[C@@H]1CCS(=O)(=O)C1	805386003	CXQTZOCOBOXQJY-VNQPRFMTSA-N	438.506	1.456	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(N2CCOCC2)c(NC(=O)NNc2cccc(F)n2)c1	806367374	MLXSFBAOZQYYLY-UHFFFAOYSA-N	438.485	1.456	50	20	IDGD	
O=C(CC(F)(F)F)NNC(=O)C(=O)Nc1cc(C(F)(F)F)cc(Br)n1	806977417	IFJKBWYXMDBJJG-UHFFFAOYSA-N	437.094	1.901	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1)C(=O)Nc1nc2c(s1)CSCC2	806979373	SBEPFQVSMKIZES-UHFFFAOYSA-N	446.489	1.861	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)Nc2cc(C(N)=O)ccc2OCC(F)F)cc1	810341654	OOJGHQIXKBBMHS-UHFFFAOYSA-N	433.371	1.533	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)CNS(=O)(=O)c3c(C)noc3C)n[nH]2)cc1C	810584826	HAQDJDCFDYKMBE-UHFFFAOYSA-N	446.489	1.038	50	20	IDGD	
O=C(NCCc1ccc(S(=O)(=O)N2CCCCC2)s1)NNc1ncncc1F	814306649	FKDMIKJDBYUCRH-UHFFFAOYSA-N	428.515	1.721	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)C2(Cc3cccc(F)c3)CCOCC2)c2ccccc2c1=O	814364516	FUDOIUHIPQGANQ-UHFFFAOYSA-N	438.459	1.873	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCc2nncn2C1)Nc1ccc(OCc2noc(C3CC3)n2)cc1	814640240	XYUKSRCDBKOETG-CYBMUJFWSA-N	438.448	1.533	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCc2nncn2C1)C(=O)Nc1ccc(CCCc2ccccc2)cc1	815692355	PCKIKXMNOVOCFR-LJQANCHMSA-N	446.511	1.802	50	20	IDGD	
CC(C)C[C@@H](C)n1nccc1NC(=O)C(=O)NNc1ccccc1S(=O)(=O)N(C)C	815751853	RDHVYRWUPIABTJ-CQSZACIVSA-N	436.538	1.822	50	20	IDGD	
CCOC(=O)c1cc(-c2ccccc2)ccc1NC(=O)C(=O)NNC(=O)[C@H]1CCCO1	815778417	PVMSJMKXLBXBEQ-GOSISDBHSA-N	425.441	1.795	50	20	IDGD	
COCCN(CCOC)S(=O)(=O)c1ccc(C(=O)NNc2cccc(Cl)n2)cc1	817005570	ZDBLEHBHQZQTKU-UHFFFAOYSA-N	442.925	1.775	50	20	IDGD	
Cc1ccc([C@]2(C)NC(=O)N(CC(=O)NNC(=O)COc3ccc(F)cc3)C2=O)cc1	910814764	BRAKNGXMDBTLNO-NRFANRHFSA-N	428.420	1.128	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)CN2C(=O)N[C@]3(C[C@H](C)CC(C)(C)C3)C2=O)cc1	913429555	HZVANAOOGPMZQD-PEBXRYMYSA-N	445.520	1.391	50	20	IDGD	
C[C@@H](c1ccc(S(C)(=O)=O)cc1)N(C)C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	913463249	YYUFKPBPQZFBPP-ZDUSSCGKSA-N	443.489	1.113	50	20	IDGD	
CN(CC(=O)NNC(=O)c1ccccc1OCc1ccc(F)cc1)[C@@H]1CCS(=O)(=O)C1	914532219	DGBGNOPVPVMEDB-QGZVFWFLSA-N	449.504	1.285	50	20	IDGD	
CCCN(C(=O)[C@H](C)OC(=O)/C(C#N)=C/c1ccc(OC)cc1)[C@@H]1CCS(=O)(=O)C1	916726444	CYLLEBVULHQBLV-YFCLQTKISA-N	434.514	1.960	50	20	IDGD	
CC(C)C(=O)N1CCCC[C@@H]1C(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12	917531004	NTUGNNNUQRLDIM-QGZVFWFLSA-N	427.505	1.776	50	20	IDGD	
Cc1nc(N2CCOCC2)nc(O)c1CCC(=O)NNC(=O)c1ccc(Cl)cc1O	918359162	OFJACXQPZQHALQ-UHFFFAOYSA-N	435.868	1.080	50	20	IDGD	
COCCNS(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(C)nc3ccccc23)c1	918691939	LUIOGOZZKPVVBI-UHFFFAOYSA-N	442.497	1.543	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2ccc(C(F)(F)F)n2)cc1)c1ccc(-n2cnnn2)cc1	919974550	JLLLWYFLNPBBGF-UHFFFAOYSA-N	442.361	1.942	50	20	IDGD	
O=C(NC[C@@H](c1cccs1)N1CCOCC1)NNC(=O)c1cncn1-c1ccccc1	1115850946	XFZFHJLJRRDVMQ-KRWDZBQOSA-N	440.529	1.951	50	20	IDGD	
CCOc1ccc(N2CCN(CC(=O)NNC(=O)c3ccc(OC)c(OC)c3)CC2)cc1	1116418344	YHKMFNQCIWGWTR-UHFFFAOYSA-N	442.516	1.686	50	20	IDGD	
CC(C)(C)c1ccc(NNC(=O)CNS(=O)(=O)c2ccc3c(c2)OCCCO3)nn1	1318597371	GETQXDMRXJWZAF-UHFFFAOYSA-N	435.506	1.357	50	20	IDGD	
CC(C)NC(=S)NNC(=O)CN1C(=O)N[C@](C)(c2ccc(Br)cc2)C1=O	1319298172	HPMIVEUHOCTXJS-MRXNPFEDSA-N	442.339	1.120	50	20	IDGD	
CO/C=C(\C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C1	1778090901	GYOGTKRUKYWRRK-CWCDLFDWSA-N	445.520	1.185	50	20	IDGD	
O=C(c1cc2cnccc2[nH]1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1778678173	SBXHJNPOPUHHQM-RHSMWYFYSA-N	425.258	1.697	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4c(c3)CNC4=O)C2)C1	1778725694	FLEZCJIZCPRWCP-PMACEKPBSA-N	440.327	1.610	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Br)C2)c1ccc(Cl)nn1	1779630870	FXPXSFZNMCXKJK-AXAPSJFSSA-N	449.708	1.948	50	20	IDGD	
CSc1ncccc1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1779838711	FAYBTLQEYMREOK-MLGOLLRUSA-N	432.315	1.938	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Br)C2)c1ccnnc1O	1779965170	HMTFYVUMTSCUMD-XHBSWPGZSA-N	431.262	1.000	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H]1C[C@H]1F)CCO2	1780098187	FHAINFYCAPBTHZ-YYFZDKIDSA-N	435.408	1.322	50	20	IDGD	
COc1cc(C#N)cc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)c1	1780172914	KWOMPJQIYBIFOG-CRAIPNDOSA-N	440.269	1.701	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(F)(F)C(F)(F)C(=O)O)C2	1780699778	HWYURPVIMBACIR-FIXISWKDSA-N	446.825	1.873	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)c1ccco1)C2)[C@@H](F)Br	1780770729	XZIQISBMHXLHTG-UMPJEAMMSA-N	433.274	1.517	50	20	IDGD	
Cc1cc(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](F)Br)C2)on1	1780770865	HDUWXAWADUWMJG-FRFSOERESA-N	432.290	1.730	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)c1ccccc1)C2)[C@H](F)Br	1780771974	XNIFLVIWTHFVHI-PASDCYSWSA-N	443.313	1.924	50	20	IDGD	
C[C@H](Nc1cnccn1)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@](C)(Cl)CCl)C2)C1	1781229710	IKNSFGNVRAUHHY-KKXDTOCCSA-N	430.336	1.343	50	20	IDGD	
COC(=O)C12CC(C(=O)N3CCO[C@]4(CCN(C(=O)[C@@](C)(Cl)CCl)C4)C3)(C1)C2	1781232584	KTEBOCUZNGBCJP-RGVPCPSESA-N	433.332	1.396	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cccc3nccn23)C1	1781316327	QJERMDOBPCTZBB-LUQKVYGDSA-N	434.924	1.716	50	20	IDGD	
COc1ccc(F)cc1CC(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781335421	YDRGGBYBJRDFSK-WMZOPIPTSA-N	447.276	1.897	50	20	IDGD	
C[C@H](Cc1ccccn1)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781335671	ZCRKSMBSZMIDBV-DDUZABMNSA-N	428.302	1.781	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)C2)C1	1781765628	HBUYDKUPBMVZFD-QAPCUYQASA-N	429.832	1.431	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCNC(C)=O)C1	1781795414	HBOXASZQTFGTEO-IIDMSEBBSA-N	432.359	1.200	50	20	IDGD	
O=C(c1ccccc1N1CCCCC1)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1782025948	HWDZQBQPNXVEAB-KNQAVFIVSA-N	435.952	1.720	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@]1(C)CC=CCC1)C2	1782213950	BPOYPHJWUNUOFS-YFXJRYMSSA-N	434.581	1.620	50	20	IDGD	
Cc1cc2[nH]c(C(=O)N3CC[C@@]4(CN(C(=O)CCC(=O)NN(C)C)CCO4)C3)cc2s1	1782299580	SVMKWLVYBHDEAD-OAQYLSRUSA-N	447.561	1.354	50	20	IDGD	
CCOC(=O)N1CCC(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](F)Cl)C3)CC1	1783130335	IEEFPOGLIHNVCN-GQIGUUNPSA-N	447.935	1.903	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)CCn3nc(C)cc3C)CCO2)C1	1783355431	RNPBPBKHDYRCGH-VQIMIIECSA-N	441.370	1.893	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)CNC(=O)OC(C)(C)C)C2)C1	1783401673	TUMQTUKUMPPNQZ-SCLBCKFNSA-N	448.358	1.515	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3(c4ccccc4)CC3)[C@H]2C1	1783572463	NBIJOHPILKDHDW-IHPCNDPISA-N	442.560	1.071	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@H]1C(=O)N1CC[C@]2(CN(C(=O)CCBr)CCO2)C1	1783849264	AMGXXJJUMMOSGQ-CLCXKQKWSA-N	443.338	1.357	50	20	IDGD	
CCOC(=O)[C@@H]1CCC[C@H](C(=O)N2CCO[C@@]3(CCN(C(=O)C(Cl)Cl)C3)C2)C1	1783939303	BZONCZWOYRTTMF-IQUTYRLHSA-N	435.348	1.990	50	20	IDGD	
CN(CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21)C(=O)c1ccccc1	1784346252	XIRFYOUWWYZNHG-JYJNAYRXSA-N	442.343	1.542	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)c3ccccc3)[C@H]2C1	1786669164	OMHQXNAZVKZQFU-JCECYMMASA-N	439.350	1.873	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC1(c2ccc(NC(=O)CCc3cn[nH]c3)cc2)CCC1	1786851877	NEXNXUFLNDXWSX-UHFFFAOYSA-N	426.521	1.849	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)N(C)C(C)=O)[C@H]2C1	1787521068	BHWTXJRAPQTMBT-WGIXJMRHSA-N	432.359	1.006	50	20	IDGD	
CC(C)=NO[C@@H](C)C(=O)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1	1788150279	AJARENJXNSFYOB-INIZCTEOSA-N	437.305	1.915	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)Nc1ccc(C2(NC(=O)CCC(=O)NN(C)C)CCC2)cc1	1788658094	CAOLXLKAYJMUND-OAHLLOKOSA-N	431.537	1.360	50	20	IDGD	
CC(C)(C)NCC(=O)NC1(c2ccc(NC(=O)c3cnccc3C(=O)NN)cc2)CCC1	1789522378	CRDKWBRWGYLNAB-UHFFFAOYSA-N	438.532	1.821	50	20	IDGD	
CCc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]3C2)nn1C	1789870262	BLNZCYYCDYDLGZ-HAHWVIBASA-N	431.364	1.812	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3ccc(F)c(C#N)c3)[C@H]2C1	1789907186	AHAGEWQDRKKAON-XPYUAMARSA-N	437.899	1.473	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4ncccc4[nH]3)C[C@@H]21)[C@H](F)Br	1789923298	DRPKRFSEBMYKJX-GREKMHCPSA-N	439.285	1.847	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC1(c2ccc(NC(=O)c3ccc(O)nc3)cc2)CCC1	1790107803	ABYAEFCKTNEORN-UHFFFAOYSA-N	425.489	1.908	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)Cn3cccn3)C[C@@H]21	1790960793	GGGYHMQMFPUWKP-VIQHNZTISA-N	441.370	1.672	50	20	IDGD	
COc1ccc([C@H](O)C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCBr)C3)cc1	1792713905	YDZODTZIUVDXIK-DACLVMHWSA-N	441.322	1.103	50	20	IDGD	
CCc1[nH]nc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)CBr)c1F	1792870191	LWFXSJWPVARLAP-NJBDSQKTSA-N	431.306	1.345	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CS[C@@H]1CCCCO1)C2	1792871201	RIBGFOUMURBMTH-BDLOOMQFSA-N	449.411	1.867	50	20	IDGD	
Cc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)CBr)cc1O	1792874104	KWERYXJRZQROHY-JJAZEVLHSA-N	425.323	1.935	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1C[C@H]1c1ccc(F)cc1	1792907883	ABWNMPZFEPKYIG-LJDSDSDDSA-N	430.524	1.940	50	20	IDGD	
C[C@@H](CBr)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1(N3CCN(C)CC3)CC1)C2	1792991452	IABWYSAFMXXKCU-NXOAAHMSSA-N	441.414	1.436	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CNC(=O)c1ccco1	1796286486	IYTVEIAUHNJMLW-CRWXNKLISA-N	426.311	1.821	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccn2c(O)nnc12	1796723153	LTURGLWGVMJMLM-RVMXOQNASA-N	436.310	1.718	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cncc3cnccc13)C2	1797957309	GBJAWGCFNTUQBW-CWPLJXCYSA-N	428.565	1.685	50	20	IDGD	
COc1cccc(OC)c1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CO[Si](C)(C)C	1797957718	XZXUIPMFEDAWSL-YVWYUNDQSA-N	436.581	1.759	50	20	IDGD	
Cc1cc(C#N)cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)c1	1798441697	DJPUROZHTCGJJD-BCDXTJNWSA-N	432.484	1.431	50	20	IDGD	
COc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)Br)C3)ccc1C	1798972442	LKZSKIHRJWVCOH-JJAZEVLHSA-N	425.323	1.990	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1CN(C(=O)OC(C)(C)C)C1)C2	1799267644	CPNSOYHMWLPVFF-FZKCQIBNSA-N	429.945	1.460	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1COc3ccccc3O1)C2	1799273972	NNMATVLUHCKSGE-ULAROXBWSA-N	443.327	1.652	50	20	IDGD	
CC(=O)Nc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@](C)(Cl)CCl)ccn1	1799275356	PXUOONLEGUPAJP-MVWRLGRASA-N	443.331	1.480	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN(C)C(=O)OC(C)(C)C)C2	1800757203	WLLLNHMDHNASQE-XPCVCDNBSA-N	448.358	1.226	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cccc(Cl)n1)C2	1800758480	ZXZRLZGCMCWLAT-OVZMXSCWSA-N	430.730	1.651	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCc1ccc3c(c1)OCO3)C2	1802333374	QCMCVVORGDRLSQ-BCDXTJNWSA-N	444.532	1.359	50	20	IDGD	
COc1ccccc1OCC(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]1c1cccnc1	1803136584	DBTZOXDSTOOYGD-LLGFUMIMSA-N	447.919	1.775	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2cccnc2C(N)=O)[C@H]1c1cccnc1	1804816634	QCRJIZIMMRUHQO-QILLFSRXSA-N	445.907	1.149	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2cc(C(C)=O)[nH]n2)[C@@H]1c1cccnc1	1805261054	DFHNWNQPPZPNLS-MPGHIAIKSA-N	433.896	1.581	50	20	IDGD	
Cn1ncnc1C(=O)NC[C@@H]1CCN(C(=O)[C@](C)(Cl)CCl)[C@@H]1c1cccnc1	1805279077	IUMOVYGRLHCZJM-PMUMKWKESA-N	425.320	1.766	50	20	IDGD	
CC(C)C1(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)CCC1	1807364228	CXEBEELAXDULAN-RBBKRZOGSA-N	449.360	1.907	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)C2CCCCC2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1	1807371757	ZOUNXEKZWVGLMP-UNMCSNQZSA-N	435.333	1.661	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2[nH]nc3ccncc23)[C@H]1c1cccnc1	1813031149	OVXMERWMGMLXPY-ALKREAHSSA-N	442.907	1.926	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)C#Cc2ccccc2)[C@@H]1c1cccnc1	1813071393	PGZRZQDRHYEZMK-PXDATVDWSA-N	447.539	1.512	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H]2C[C@@H]2C2CC2)n[nH]1	1814759188	JISIZAMHORACBT-RVKKMQEKSA-N	437.504	1.760	50	20	IDGD	
O=C(CCC1CCC1)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1	1815350555	XTSIGVOOYINKAX-INIZCTEOSA-N	427.335	1.629	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)C[C@H]2CCCCO2)n[nH]1	1815608387	FDMPDAKWTSRPKY-WBVHZDCISA-N	434.541	1.734	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CN2CCOCC2)n[nH]1	1817151864	QWZIACLLNISHPG-UKRRQHHQSA-N	442.358	1.908	50	20	IDGD	
Nc1c(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)[C@@H](O)CCl)[nH]n2)sc2nccnc12	1817433733	IWPNTGQDZIPMIP-QWRGUYRKSA-N	449.924	1.902	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)/C=C/c2ccco2)[nH]n1)c1ccc(B(O)O)cc1	1817471179	SIKYOGFTAWOZML-VYENPZKTSA-N	434.261	1.702	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)C[C@@H]2CCCCO2)[nH]n1)c1cccc(B(O)O)c1	1817473801	AQIMRPKTQIVQTN-HKUYNNGSSA-N	440.309	1.355	50	20	IDGD	
CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](F)Cl)n[nH]1	1818044191	VEUDZJKSFXICCU-IJEWVQPXSA-N	439.879	1.407	50	20	IDGD	
COC[C@H](NC(C)=O)C(=O)Nc1cc([C@H]2CCCCN2C(=O)C(C)(C)CCl)[nH]n1	1819605654	FKAXDQHRZMGDOP-LSDHHAIUSA-N	427.933	1.818	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](C)n2cnnn2)[nH]n1	1822092712	UEUQXGFSYJPQBY-GVXVVHGQSA-N	439.318	1.823	50	20	IDGD	
CCCC(=O)N[C@H](C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](Cl)COC)n[nH]1	1822372205	DYBWQZJKJDLMJT-UMVBOHGHSA-N	427.933	1.960	50	20	IDGD	
COc1cccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)n1	1822412854	HYISUGHBEFIKKQ-MRXNPFEDSA-N	443.508	1.492	50	20	IDGD	
C[C@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)CC1)[C@@H]1SC(=N)NC1=O	1824183130	PRCPCBQBYHJFPO-MXAVVETBSA-N	444.985	1.008	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)C[C@H]2NC(=O)NC2=O)CC1	1825069814	ATNULYLPPYDEIR-ARFHVFGLSA-N	426.945	1.612	50	20	IDGD	
Cc1cncc(C(=O)N[C@@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)c1	1826080737	VQJIVVRYIBOPOH-CQSZACIVSA-N	430.534	1.445	50	20	IDGD	
Cc1ccc(C(=O)N[C@@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)cc1O	1826088718	KQDNQLISDMKDOL-CQSZACIVSA-N	445.545	1.756	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)Cn3cc(C)c(O)nc3=O)sc2C1	1827994948	WBFYNEBNLPLJDR-QWRGUYRKSA-N	439.925	1.343	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)CN2CCN(C(C)=O)CC2)CC1	1828493675	RTKKROLAMIUELL-WOJBJXKFSA-N	441.016	1.788	50	20	IDGD	
CNC(=S)NCCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)CO[Si](C)(C)C)CC1	1828929149	IHWICGMPSJDRJD-QGZVFWFLSA-N	442.702	1.942	50	20	IDGD	
Cc1cccc(C(=O)N2CCO[C@]3(COCCN(C(=O)CCBr)C3)C2)c1F	1830094300	NHKHQQIWMCTNSD-IBGZPJMESA-N	443.313	1.989	50	20	IDGD	
Cc1nc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)ccc1F	1830358109	LXJOKAYRFRAKBG-HXUWFJFHSA-N	427.904	1.864	50	20	IDGD	
O=C(CCCCCCCCCCCl)N1CCOC[C@]2(C1)CN(C(=O)C(O)O)CCO2	1830401263	QNKGUWMIRIDJQF-NRFANRHFSA-N	448.988	1.503	50	20	IDGD	
C[C@H](Cn1cccn1)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1	1831872048	MEJJGLDXTOCDNW-QUCCMNQESA-N	446.596	1.512	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1	1831874428	JFAXPFGUMRODAK-ZBFHGGJFSA-N	445.402	1.763	50	20	IDGD	
O=C1NCCn2nc(C(=O)N3CCC([C@@H]4CCCCN4C(=O)C(Cl)Cl)CC3)cc21	1831877889	FVAKWDXGSVFBIQ-AWEZNQCLSA-N	442.347	1.664	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)C[C@H]3CCCCO3)CCO2)C1	1832347276	TYKFVGWOLLHOGH-MNEFBYGVSA-N	437.364	1.638	50	20	IDGD	
CN(C)c1cncc(C(=O)NC2CCN(C3CCN(C(=O)[C@H](F)Cl)CC3)CC2)c1	1833931500	QJVHNYBMDKOGAF-SFHVURJKSA-N	425.936	1.867	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3cc(O)n(C)n3)CC2)CC1	1833946711	APFNNSUVECLLEW-LBPRGKRZSA-N	442.358	1.094	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3c(C)noc3C)CCO2)C1	1834067985	FIDAPGFJNBLQHH-KSSFIOAISA-N	444.326	1.535	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1)c1cncnc1	1834237261	XVVCMPLIDCZFNC-OAHLLOKOSA-N	428.306	1.352	50	20	IDGD	
CC[C@H](C)[C@@H](N)C(=O)NC1CCN(C2CCN(C(=O)[C@H](C)Br)CC2)CC1	1834689372	IHEIDKULMTUAPB-GRDNDAEWSA-N	431.419	1.715	50	20	IDGD	
C=CCC(F)(F)C(=O)N1CCOC[C@]2(CN(C(=O)CCBr)CCO2)C1	1834824889	OOOYZCSKIDCPIW-HNNXBMFYSA-N	425.270	1.439	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cc(C)nc(O)c3)CC2)CC1	1835089544	SYUQZXZQPXNPJI-SFHVURJKSA-N	438.956	1.535	50	20	IDGD	
Cc1nc(N)sc1C(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1835801211	OGDJWAPUAQANDQ-SFHVURJKSA-N	430.958	1.369	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC1CCN(C2CCN(C(=O)[C@H]3CC[C@H](O)CC3)CC2)CC1	1835837437	HJQSHMMFZHSUNU-IRJFHVNHSA-N	439.673	1.961	50	20	IDGD	
O=C(Cc1c(F)cccc1F)NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836313533	QDYGOUHVLYDQFJ-IBGZPJMESA-N	443.922	1.679	50	20	IDGD	
Cc1ccn2ncc(C(=O)N3CCC(OC4CCN(C(=O)[C@H](O)CCl)CC4)CC3)c2c1	1836718418	XHCWQAMAUSPHDN-HXUWFJFHSA-N	448.951	1.855	50	20	IDGD	
COc1ccc(C(=O)N2CCOC[C@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)cn1	1837710149	LHJQOMKYMRXLMV-FQEVSTJZSA-N	437.569	1.012	50	20	IDGD	
Cc1nc(F)ccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1	1838267693	BABKURLNKSDGIA-OALUTQOASA-N	448.322	1.835	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)Oc3cccnc3)C2)C1	1839148448	ADXCZNQEDADCBK-OXFYSEKESA-N	425.913	1.323	50	20	IDGD	
Cc1ccc(F)c(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)c1	1839312927	AGKJENNWKDGSTR-CRAIPNDOSA-N	447.276	1.895	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(F)cc3)C2)C1	1840034818	XWASQYMCHQJBTK-FZKQIMNGSA-N	429.286	1.679	50	20	IDGD	
O=C1Cc2cc(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)C(Cl)Cl)CCO4)ccc2N1	1840188322	CQDYKRACKXKQBD-LJQANCHMSA-N	442.299	1.055	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CC3(OC)CCC3)CCO2)C1	1840617397	AZKAITPSENSDIG-KXBFYZLASA-N	447.370	1.576	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@H]2CCN(C(=O)OC(C)(C)C)C[C@@H]2O)C1	1841028066	SDJVOMDNUNRSOC-PMPSAXMXSA-N	443.972	1.825	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H](F)C[C@@H](C(=O)N2CC3(CCCN3C(=O)[C@H](O)CCl)C2)C1	1841351619	WEKZVZUULZHQGX-RBSFLKMASA-N	447.935	1.385	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@]2(C[C@H]2C(=O)N2CC3(CCCN3C(=O)[C@H](O)CCl)C2)C1	1841353545	DDGWEVRLFKZENE-MDOVXXIYSA-N	441.956	1.437	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1cc(C(C)C)no1)C2	1843416398	DIRKPTPEMAMNGT-OEAKJJBVSA-N	426.477	1.749	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1cc(C)n(C(F)F)n1)C2	1843416463	NFTPVVLQLHCLAI-ZMOGYAJESA-N	447.446	1.538	50	20	IDGD	
CCn1nc(C(=O)N2CC3(CCCN3C(=O)CCC(=O)NN(C)C)C2)c2ccccc21	1846384683	WNRVSBWYHVYIKT-UHFFFAOYSA-N	426.521	1.246	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC[C@H]2[C@@H]1CCN2C(=O)C1CCC(C(F)(F)F)CC1	1847986294	UXXBRVDJVZWDDC-MZQWUDBDSA-N	438.255	1.551	50	20	IDGD	
O=C(NNC(=O)c1ccccn1)c1ccc(OS(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1	17328396	OOEUIVUOIMXPBH-UHFFFAOYSA-N	442.409	1.832	50	20	IDGD	
CC(C)CC(=O)NNC(=O)CCc1nc2cc(S(=O)(=O)N3CCCCC3)ccc2n1C	17820400	BLSMZFDCYZBSPW-UHFFFAOYSA-N	449.577	1.874	50	20	IDGD	
CC(C)[C@H](NC(=O)COc1ccccc1)C(=O)NNC(=O)[C@@H]1COc2ccccc2O1	21190756	OKHRNKQLRIPJPC-ICSRJNTNSA-N	427.457	1.194	50	20	IDGD	
CC(=O)N1c2ccc(S(=O)(=O)NNC(=O)c3ccc4c(c3)OCCO4)cc2C[C@H]1C	105452641	BEQJWDFBNNMEFR-GFCCVEGCSA-N	431.470	1.379	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NNC(=O)c2cc(Cl)ccc2O)cc1	108491360	AQMHCQWMFLETMF-INIZCTEOSA-N	437.905	1.968	50	20	IDGD	
Cc1nn(-c2ccccc2)cc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	726523010	ABQGESMTUPUISG-UHFFFAOYSA-N	427.486	1.506	50	20	IDGD	
O=C(NNC(=O)[C@H]1CC[C@H](C(F)(F)F)NC1=O)c1cc(F)ccc1Br	728550063	XPECTJPQWCNGIV-OIBJUYFYSA-N	426.164	1.806	50	20	IDGD	
O=C(NNC(=O)c1c(F)ccc(S(=O)(=O)NC2CC2)c1F)c1cccc([N+](=O)[O-])c1	729834169	VMCFIYDABCOQJE-UHFFFAOYSA-N	440.384	1.389	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CNC(=O)c2c(F)cccc2Cl)cc(OC)c1OC	730584231	QSVASYWABZIXLB-UHFFFAOYSA-N	439.827	1.696	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)[C@H]1CCCN1C(=O)/C=C\c1ccc(C(N)=O)cc1	731492499	KRLBODFWTUMCMI-ADYSOMBNSA-N	436.468	1.260	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)N1CCC[C@@H](CN2CCN(c3ccccn3)CC2)C1	731849618	AQNBPZWUEKSPGK-UXHICEINSA-N	430.597	1.498	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2ccc(COc3ccc(C#N)cc3)o2)C[C@@H](C)O1	732261722	FNVHFIRWXXAVSG-IYBDPMFKSA-N	426.473	1.991	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)COc2ccccc2OCC(F)(F)F)C[C@H](C)O1	732262569	UOBMRTBJOPCFDQ-KBPBESRZSA-N	433.427	1.653	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCC(C)(C)N2CCN(C)CC2)cc1Br	732443707	CGFOQFUORIMHEN-UHFFFAOYSA-N	442.358	1.428	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)N[C@H](Cc1ccccc1)CN1CCOCC1	732476356	GICOMFAMJBAXFG-IEBWSBKVSA-N	444.507	1.867	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CC(c2cc(F)ccc2F)=NO1)c1csc(N2CCOCC2)n1	732653841	LLKTUMOMGQQSAL-HNNXBMFYSA-N	437.428	1.212	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CN2CCN([C@H](CO)c3ccc(Cl)cc3)CC2)cc1	732667306	OFWLGUNYXUJLID-HXUWFJFHSA-N	430.936	1.761	50	20	IDGD	
CCc1cc(N2CCC[C@H](NC(=O)NNC(=O)CCc3ccc(OC)cc3)C2)ncn1	732915077	YYKZRXDSSNUJHJ-SFHVURJKSA-N	426.521	1.980	50	20	IDGD	
Cn1c(NNC(=O)Cc2ccc(S(=O)(=O)N3CCCC3)s2)nc2ccccc2c1=O	733263367	YQFONVPOTVDJOU-UHFFFAOYSA-N	447.542	1.465	50	20	IDGD	
O=C(NCCNC(=O)c1c(F)cccc1F)NNC(=O)c1cnn(-c2ccccc2)c1	733348202	ISJXHRVPPLKZCU-UHFFFAOYSA-N	428.399	1.525	50	20	IDGD	
COc1ccc(S(=O)(=O)C[C@@H](C)C(=O)NNC(=O)c2cc(OC)cc(OC)c2)cc1	734989949	IURLMHNPZKXWTP-CYBMUJFWSA-N	436.486	1.583	50	20	IDGD	
Cc1ccc(C)n1-c1ccc(C(=O)NNC(=O)N[C@H]2CCN(c3cnn(C)c3)C2=O)cc1	735584834	ZWLLSRYWWHARKA-IBGZPJMESA-N	435.488	1.577	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)[C@H]2CC(=O)N(c3ccccc3)C2)cc1C	736777514	NVMILQJZCXSPGL-AWEZNQCLSA-N	429.498	1.976	50	20	IDGD	
CCc1cc(NNC(=O)Cn2cc(Br)c(O)nc2=O)nc(-c2ccccn2)n1	738537952	DDMGZINNTDXKSN-UHFFFAOYSA-N	446.265	1.269	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)c2ccc(OC)c(N3CCNC3=O)c2)cc1OC	742037709	DSGUCKZVIXRHRJ-UHFFFAOYSA-N	428.445	1.707	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)[C@H]3Cc4cc(F)ccc4O3)cc2)CC1	743335550	ZMJRWQYOGJYTIM-LJQANCHMSA-N	434.493	1.209	50	20	IDGD	
CC(C)(C)C(=O)NNC(=O)CN1CCC(C(=O)Nc2ccc(Br)cn2)CC1	744389132	LAJWDZDGQOVDLE-UHFFFAOYSA-N	440.342	1.688	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)N[C@@H]1CCN(c2ccc(C)cc2)C1=O	745855978	BWMPDTILKVMEQN-QGZVFWFLSA-N	426.473	1.908	50	20	IDGD	
COc1nn(C)c2nc(C)c(CCC(=O)NNC(=O)Cc3cn4ccccc4n3)c(C)c12	746553338	JMSXFBRCOLYRGO-UHFFFAOYSA-N	435.488	1.564	50	20	IDGD	
COC(=O)c1ccsc1N1CC[C@@H](NC(=O)NNC(=O)c2cc3c(s2)CCC3)C1=O	746783062	ZYQGVVUZCFXTAZ-GFCCVEGCSA-N	448.526	1.834	50	20	IDGD	
CCCCCn1nc(C(=O)NN=C2CCN(S(C)(=O)=O)CC2)c2ccccc2c1=O	747627588	HEMUVFCYMZIBMZ-UHFFFAOYSA-N	433.534	1.728	50	20	IDGD	
O=C(CCc1ncc(-c2ccccc2Br)o1)NNC(=O)C(=O)N1CCCC1	748240837	YZRLQHSWHLKVAP-UHFFFAOYSA-N	435.278	1.807	50	20	IDGD	
Cc1c(NNC(=O)[C@H](CCC(N)=O)N2C(=O)c3ccccc3C2=O)cccc1[N+](=O)[O-]	748669265	AOTIECSACTXWNK-INIZCTEOSA-N	425.401	1.277	50	20	IDGD	
CC(=O)Nc1ccc(NS(C)(=O)=O)c(C(=O)NNC(=O)c2cc3ccccc3o2)c1	749477200	UYVJKGSCYWQYEP-UHFFFAOYSA-N	430.442	1.838	50	20	IDGD	
CCn1c(SCC(=O)NNC(=O)CNC(=O)c2ccco2)nnc1-c1cccs1	751207054	QBXLUSQFSUYHNM-UHFFFAOYSA-N	434.503	1.289	50	20	IDGD	
Cc1cc(F)cc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1[N+](=O)[O-]	752556034	VVSFLTHKQWPQHP-OAHLLOKOSA-N	433.348	1.187	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)N[C@@H]2COc3cc(F)cc(F)c32)nc1	753417522	BSEYLIUIPMDWBG-CYBMUJFWSA-N	427.433	1.806	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2ccc(NC(=O)NNC(=O)c3ccccn3)cc2)C[C@H](C)O1	755424473	UQZKRVPPBPWZQX-KBPBESRZSA-N	433.490	1.346	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)Cc2ccc(C(=O)NN=Cc3cn(C)nn3)cc2)cc1	755485569	BTTSJKJQQPXANB-UHFFFAOYSA-N	426.502	1.708	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccc(C(=O)NC3CC3)cc2)c1	755580728	NABGKHXLMVKRKC-UHFFFAOYSA-N	445.501	1.296	50	20	IDGD	
NC(=O)CCOc1ccccc1NC(=O)NNC(=O)c1cc(Br)ccc1O	756067393	RSOFKSQKGNHUAZ-UHFFFAOYSA-N	437.250	1.875	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc1-n1nnnc1C	756319729	LFZZXVVOALYVAW-UHFFFAOYSA-N	449.431	1.337	50	20	IDGD	
COCCS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2ccc(O)c(Cl)c2)cc1	756550528	IQVBNDJYTPZPHD-UHFFFAOYSA-N	427.866	1.932	50	20	IDGD	
COc1ccc(-c2cc(N(C)CC(=O)NNC(=O)c3ccc(OC)c(OC)c3)n[nH]2)cc1	756602766	XZJHIWHZMTZPRP-UHFFFAOYSA-N	439.472	2.000	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1)Nc1cnn(CCN2CCOCC2)c1	756826238	DLUJTYBZQGBFQQ-UHFFFAOYSA-N	442.455	1.211	50	20	IDGD	
CCN(CC(=O)NNC(=O)c1ccc(OC)c(OC)c1)C[C@H]1COc2ccccc2O1	757439056	RAIBKIQFPHFTCE-INIZCTEOSA-N	429.473	1.627	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)NNC(=O)Cc2ccccc2OC)cc(S(C)(=O)=O)c1	757609317	SEPJRKACRLCBOS-UHFFFAOYSA-N	449.485	1.671	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2c(F)cc(C#N)cc2F)cc(OC)c1OC	757645455	MJPFNSXVWASJQO-UHFFFAOYSA-N	427.385	1.486	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c(C)n1	757655995	HMKPVLOKPLIYSY-UHFFFAOYSA-N	433.490	1.186	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccccc2O[C@H]2CCOC2)c1	757678935	ROGURPMIURNPPY-HNNXBMFYSA-N	448.501	1.571	50	20	IDGD	
CC(C)n1ncc(C(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)c1N	757721195	QGCTUHJIOWLHHS-UHFFFAOYSA-N	445.487	1.823	50	20	IDGD	
CCOC(=O)c1cn(C)nc1NC(=O)NNC(=O)c1cc(-c2ccccc2OC)[nH]n1	757925374	GRABEGXPBGJFKW-UHFFFAOYSA-N	427.421	1.462	50	20	IDGD	
C[C@@H](C#N)Oc1ccccc1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	757977257	IOGOPKPMBVMKJS-ZDUSSCGKSA-N	431.474	1.694	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)c1cccc(Oc2ccc(Cl)c(Cl)c2)n1	758026560	RIRYSLYCHNIZKG-SECBINFHSA-N	447.300	1.879	50	20	IDGD	
COc1ccc(C(=O)NNc2nc(O)c3ccccc3n2)cc1S(=O)(=O)NC1CC1	758298354	IOANAADKVLRZEI-UHFFFAOYSA-N	429.458	1.542	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)Cc1c(C)nc2[nH]n(C)c(=O)c2c1C	762350747	QYHFNZYGPCIHIK-UHFFFAOYSA-N	429.502	1.369	50	20	IDGD	
Cc1nc(C(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)c(=O)[nH]c1C	763273340	YWNCJHIEZCUSER-UHFFFAOYSA-N	447.498	1.324	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccncc3)nc3ccccc23)nn1C	763540864	XIUFHXUOSCNOAW-UHFFFAOYSA-N	429.440	1.738	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(C(=O)NCC(C)C)cc2)c1	763630822	ODKSPIDYWNRSAN-UHFFFAOYSA-N	426.473	1.546	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(C)n([C@@H](C)C2CC2)n1	763685331	TXEOWFOZVBBPRI-AWEZNQCLSA-N	429.477	1.726	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)n(C2CCOCC2)n1	763859224	ZHDTYTISSKUESK-ZDUSSCGKSA-N	433.440	1.236	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cccc(C(=O)OC)c2C)cc1	763861921	TZXYSBYCSYKDNB-AWEZNQCLSA-N	443.456	1.734	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cccc3c2OCCO3)cc1	763879053	VWPQENGVRXMUJW-CYBMUJFWSA-N	427.413	1.214	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(CC(=O)N(C)C)cc2)cc1OC	763900398	DUPIWABJPKABAJ-UHFFFAOYSA-N	442.472	1.124	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Br)s2)cc1	763940210	FGTPYAZIGLXLBS-UHFFFAOYSA-N	446.304	1.314	50	20	IDGD	
Cc1ccc(S(C)(=O)=O)cc1NC(=O)C(=O)NNC(=O)c1cc2c(s1)CC[C@@H](C)C2	763941961	LEXCQAUPTFUZBU-LLVKDONJSA-N	449.554	1.985	50	20	IDGD	
Cc1ccc(Oc2ccccc2)c(NC(=O)C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)c1	763998247	NVCPYNKDRXZJAO-AWEZNQCLSA-N	431.470	1.308	50	20	IDGD	
COc1ccc(NC(C)=O)cc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccccc2)on1	764015871	AEFJSSBIIONMNG-UHFFFAOYSA-N	437.412	1.708	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1cccc(C(=O)NC2CC2)c1	764019472	MVVDLAWEOOJVNZ-UHFFFAOYSA-N	430.848	1.641	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)c(O)c1	764105558	UONIGJHUNVEJIL-OKILXGFUSA-N	444.463	1.853	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cc(Br)ccc2-n2cccn2)n[nH]1	764105918	CQYVNELTLXPMON-UHFFFAOYSA-N	432.238	1.066	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cnn(C[C@H]4CCCO4)c3)n[nH]2)cc1	764109713	AVZOJAYAVQRJQD-MRXNPFEDSA-N	437.460	1.160	50	20	IDGD	
O=C(CCCc1ccccc1)NNC(=O)C(=O)Nc1ccccc1C(=O)N1CCOCC1	764225073	XLTMCOKCENSYJK-UHFFFAOYSA-N	438.484	1.268	50	20	IDGD	
O=C(CCCc1ccccc1)NNC(=O)C(=O)Nc1ccc(NC(=O)[C@H]2CCCO2)cc1	764226794	RVHNGYLOQSITEU-LJQANCHMSA-N	438.484	1.913	50	20	IDGD	
O=C(NNC(=O)c1cccc(OC(F)F)c1)C(=O)Nc1ccccc1C(=O)N1CCCC1	764250029	HBQWEYOTUYXVMK-UHFFFAOYSA-N	446.410	1.924	50	20	IDGD	
Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NNC(=O)c1cc(Br)ccc1O	764280737	SBBYUJJXUADYSH-UHFFFAOYSA-N	437.206	1.771	50	20	IDGD	
C[S@](=O)Cc1cc(NC(=O)C(=O)NNC(=O)COCc2ccccc2)ccc1Cl	764367122	JLOSTYSEXRIKFH-LJAQVGFWSA-N	437.905	1.521	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)C(=O)Nc1ccn(-c2ccccc2Cl)n1	764367190	JRDYZGYTAYWAEW-UHFFFAOYSA-N	427.848	1.828	50	20	IDGD	
CCOC(=O)c1ccsc1NC(=O)C(=O)NNC(=O)C(F)(F)Oc1ccccc1	764369820	JXSVARILDIYJHH-UHFFFAOYSA-N	427.385	1.683	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1)C(=O)Nc1cccc(-n2ccnc2)c1	764389067	XRLBGVFNMMUEBM-UHFFFAOYSA-N	433.403	1.801	50	20	IDGD	
CNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(C)c(C)c3)[nH]n2)c1C	764389147	XYYVOMXVKQLKAE-UHFFFAOYSA-N	448.483	1.761	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cc1F	764519391	RIMVVSXDHKRIEB-UHFFFAOYSA-N	445.520	1.610	50	20	IDGD	
O=C(CCC(=O)N1CC(=O)Nc2ccccc21)NNC(=O)CSc1ccccc1O	765250429	SEYWJNWQSIAUFT-UHFFFAOYSA-N	428.470	1.397	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)c1cc(I)cc([N+](=O)[O-])c1	765779584	WRMVHRVGNHHXDX-UHFFFAOYSA-N	426.170	1.598	50	20	IDGD	
Cc1cc(C)c(C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)c(O)n1	766659911	IZWGXYJMUCOJHD-UHFFFAOYSA-N	431.924	1.636	50	20	IDGD	
CON=Cc1ccc(C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)cc1	766660627	PVLDECJYIJVZCQ-UHFFFAOYSA-N	443.935	1.899	50	20	IDGD	
CC[C@H](C)[C@H](NC(=O)N1CCCC1)C(=O)OCC(=O)NNC(=O)Cc1ccccc1C	767348261	WJSOBWVXCDYAJW-YWZLYKJASA-N	432.521	1.448	50	20	IDGD	
CN(C)C(=O)c1cc(F)ccc1NC(=O)C(=O)NNC(=O)Cc1c[nH]c2ccccc12	768236562	DTORDMCYNGOHJE-UHFFFAOYSA-N	425.420	1.337	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NC[C@]2(C)CCO[C@@H]2C2CC2)nc1	768535746	QUJHENAPVFBWOQ-MJGOQNOKSA-N	425.555	1.943	50	20	IDGD	
O=C(NNS(=O)(=O)c1sc(C(=O)O)cc1Br)c1ccc(Cl)nc1	769628162	LLJAYSICIOSVLA-UHFFFAOYSA-N	440.684	1.881	50	20	IDGD	
O=C(CCNC(=O)NC12CC3CC(CC(C3)C1)C2)NNC(=O)c1ccc2c(c1)OCCO2	770379706	SLRHHQRNWHRGQG-UHFFFAOYSA-N	442.516	1.877	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NNc2nc(O)c3cnn(C)c3n2)ccc1C	770974825	QUQOOQZRNVXVQB-UHFFFAOYSA-N	433.494	1.165	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3cc(O)nc(C4CC4)c3)cc2)CC1	771431643	LNPOMORXQSMCKT-UHFFFAOYSA-N	431.518	1.358	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1O)c1cccc(S(=O)(=O)N2CCCC2)c1	771846797	SLTKQUBQZULPHC-UHFFFAOYSA-N	434.430	1.160	50	20	IDGD	
COc1ccc(-n2nnc(C(=O)NNC(=O)C(=O)NCc3ccc(Cl)cc3)c2C)cc1	772897392	HEFCGRWWRLHCOK-UHFFFAOYSA-N	442.863	1.315	50	20	IDGD	
O=C(NNc1ccccc1[N+](=O)[O-])C(=O)Nc1ccc(S(=O)(=O)N2CCCC2)cc1	773655445	PNTFMVCFIZBXFU-UHFFFAOYSA-N	433.446	1.461	50	20	IDGD	
Cn1cc(Br)cc(NC(=O)C(=O)NNc2ccc(C(F)(F)F)cn2)c1=O	773675015	GJVYOZJGBSYJTA-UHFFFAOYSA-N	434.172	1.643	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1cnn(-c2ccncc2)c1	774000994	BVDWKDYBFVRKMZ-LBPRGKRZSA-N	428.836	1.474	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1cccnc1OCC(F)F	774010269	XKTTUDPWCVPQBB-SNVBAGLBSA-N	442.806	1.932	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)c2cccc([N+](=O)[O-])c2N2CCOCC2)c1	776456652	UJPIODOSQFDOQT-UHFFFAOYSA-N	442.428	1.358	50	20	IDGD	
O=C(c1ccc(OC[C@H]2CCCO2)cc1)N1CCN(S(=O)(=O)CBr)CC1	777778177	ZXKKIWXDNXANHB-MRXNPFEDSA-N	447.351	1.684	50	20	IDGD	
Cc1c[nH]cc(C(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)c1=O	777792047	ONPQKKSRWYISLN-UHFFFAOYSA-N	432.483	1.620	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)CCCCCNC(=O)OC(C)(C)C)c2ccccc2c1=O	780171166	ILUYXMDGZQPJFC-UHFFFAOYSA-N	431.493	1.780	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)c2cnc(NC(=O)OC(C)(C)C)cn2)c2ccccc2c1=O	783566425	BNNAIZFUBLSQTH-UHFFFAOYSA-N	439.432	1.145	50	20	IDGD	
Cc1cc(OCc2cccc(F)c2)ccc1NC(=O)C(=O)NNC(=O)C(=O)N1CCCC1	783999129	KDKGETAWLJZIAF-UHFFFAOYSA-N	442.447	1.421	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1ccc(Cl)c(OC(F)F)c1	784004419	FZGLZQZMGVNPFQ-UHFFFAOYSA-N	446.819	1.519	50	20	IDGD	
Cc1nnnn1-c1cccc(NC(=O)C(=O)NNc2ccc(OCC(F)(F)F)cc2)c1	784370051	DZHVPLFAKPMWDQ-UHFFFAOYSA-N	435.366	1.994	50	20	IDGD	
O=C(NNc1ccc(Br)nc1)C(=O)Nc1ccccc1S(=O)(=O)C(F)F	784810802	GXTDVWXVJWLZTK-UHFFFAOYSA-N	449.233	1.922	50	20	IDGD	
CS(=O)(=O)c1ccc(-c2csc(CC(=O)NNC(=O)Cc3ccncc3)n2)cc1	784944560	MOAOMWMLSJRFSH-UHFFFAOYSA-N	430.511	1.541	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2cc(Br)c(=O)n(C)c2)cc1Cl	785118758	WSJGBAUYKMYFLB-UHFFFAOYSA-N	429.658	1.892	50	20	IDGD	
O=C(COCCNC(=O)c1ccccc1)NNC(=O)Cc1nc(-c2ccccc2)cs1	785125784	UTHNNZQTKNRMPY-UHFFFAOYSA-N	438.509	1.947	50	20	IDGD	
COc1ccc2nc(NNC(=O)C(=O)Nc3cnn(CC(=O)NC4CC4)c3)c(C)cc2c1	785162633	IGTJEMAKRPOZFO-UHFFFAOYSA-N	437.460	1.109	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)N[C@H]2CCCN(Cc3ccc(F)cc3F)C2=O)n1	786962684	QAPDWRPQZZXZQD-KRWDZBQOSA-N	434.447	1.300	50	20	IDGD	
CN1CCN(c2ccc(NC(=O)C(=O)NNc3cccnn3)cc2Br)CC1	787902269	VCQHURYBRCWGPH-UHFFFAOYSA-N	434.298	1.073	50	20	IDGD	
O=C(NNc1nnc(-c2ccccn2)s1)c1ccc2c(c1)S(=O)(=O)N(C1CC1)C2=O	788555905	XVIZGGNDUUIXBR-UHFFFAOYSA-N	442.482	1.664	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)c(O)c1	789735281	KYIXPXIIWFPCAO-UHFFFAOYSA-N	441.893	1.947	50	20	IDGD	
CC(C)Oc1cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)ccc1C(N)=O	789740009	DMGRZJUDJHFEQB-GFCCVEGCSA-N	446.435	1.265	50	20	IDGD	
COC(=O)c1cc(Cl)ccc1NC(=O)C(=O)NNC(=O)[C@H]1OCC[C@H]1c1ccccc1	789811865	GHNQOUFXCDUUIZ-YOEHRIQHSA-N	445.859	1.785	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)c1ccc(Cl)c(S(=O)(=O)N(CC)CC)c1	790065802	RTUDATSOTWCASQ-UHFFFAOYSA-N	449.957	1.921	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@@](C)(O)Cn2ccc(C)cc2=O)ccc1OCCC(C)C	790483245	KTMVOWFLWXFCHC-QHCPKHFHSA-N	445.516	1.802	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)Cc1ccc(I)cc1	792596998	KGJYBNPDEJOXDA-UHFFFAOYSA-N	427.198	1.004	50	20	IDGD	
CNS(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)cc1C	794579608	ZOJQSGLRQCVPIO-UHFFFAOYSA-N	441.575	1.429	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCC(=O)NNC(=O)NC2CCCCC2)cc1OCC	798148974	BFMATKVDBOGCRL-UHFFFAOYSA-N	442.538	1.425	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2cc(Cl)ccc2-n2cnnn2)cc1	802066553	QZLJWKZDSIFGIZ-UHFFFAOYSA-N	435.853	1.186	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN1C(=O)c1ccc2c(c1)OCO2)Nc1ccc2c(c1)OCO2	802096711	BLMRMDDCXBAPSU-AWEZNQCLSA-N	440.412	1.602	50	20	IDGD	
COc1ccc(C2=NO[C@H](CNC(=O)NNc3nc(O)c4cnn(C)c4n3)C2)cc1C	802351865	MAOKHGXKTMLCGQ-LBPRGKRZSA-N	426.437	1.205	50	20	IDGD	
Cc1c(C(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)nnn1Cc1ccncc1	803971897	FDGNRCNDUIBVMZ-UHFFFAOYSA-N	428.836	1.301	50	20	IDGD	
COC(=O)N(C)NC(=O)c1ccc(NS(=O)(=O)c2ccc3c(c2)OCCCO3)cc1	804123770	VUTXYQUQVVERAD-UHFFFAOYSA-N	435.458	1.992	50	20	IDGD	
CCOC(=O)[C@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNc2cccc(F)n2)cc1F	807391204	JZUXSAQUWHQMCQ-JTQLQIEISA-N	435.387	1.123	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCCC[C@H]1COC(=O)NC1CC1	810039117	QQDCVYWETAMEDW-HNNXBMFYSA-N	438.912	1.853	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C#N)c(F)c2)cc1Br	810387274	NJEQHLFOLONWNX-UHFFFAOYSA-N	435.209	1.868	50	20	IDGD	
CN(C)c1cc(C(=O)N2CCN(S(=O)(=O)CBr)CC2)nc2ccccc12	810909262	AZKFPDLYZFOZDV-UHFFFAOYSA-N	441.351	1.741	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)CNS(=O)(=O)c1ccc(Cl)cc1	811462681	VIEKPDJDPJXUEU-NSHDSACASA-N	446.312	1.887	50	20	IDGD	
C[C@@H]1CN(C(=O)NNC(=O)CNC(=O)c2ccco2)C[C@@]1(C)CNC(=O)OC(C)(C)C	811872167	JVGMDWGXEWPPSV-ZUOKHONESA-N	437.497	1.233	50	20	IDGD	
CC[C@H](CNC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1)OC	812589216	ILCXDIWXYASWNG-QGZVFWFLSA-N	434.518	1.534	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)[C@H]2CCN(c3ccc(C#N)cc3F)C2)cc1	812733243	KSKVFRJSFIXCJG-HNNXBMFYSA-N	431.493	1.917	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccc(-c3csnn3)cc2)cc1	813033163	HNSOSEZAEBTADL-UHFFFAOYSA-N	446.514	1.537	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)c2c(I)cnn2C)c1C	814102827	QWNWKCLXRYGGCS-LLVKDONJSA-N	442.257	1.870	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1)NNc1ncncc1F	814294992	WPQUHSFYQNTQSZ-IBGZPJMESA-N	435.463	1.900	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c2ccccc2c1)N[C@@H]1CCS(=O)(=O)C1	814406623	DYLGBJUHVVHGGL-GFCCVEGCSA-N	426.292	1.733	50	20	IDGD	
COc1ccc(NC(=O)NNc2cccc(Cl)n2)cc1S(=O)(=O)N1CCOCC1	814491380	ZOXFFDNJWMPRAG-UHFFFAOYSA-N	441.897	1.913	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)c2c(I)cnn2C)o1	814621911	GBMSTBMCTSCFCV-UHFFFAOYSA-N	445.261	1.534	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)[C@H]2CCCCN2S(=O)(=O)c2ccccc2)cc1	901424441	UEATYOSANWIGNP-LJQANCHMSA-N	431.514	1.765	50	20	IDGD	
O=C(COC(=O)Cn1cccc(C(F)(F)F)c1=O)NNC(=O)c1ccc(Cl)cc1	907461346	OURIFZDGKSAICD-UHFFFAOYSA-N	431.754	1.525	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)[C@@H]1CCCN1C(=O)c1cc(Cl)ccc1Cl	914719718	ONEDJRVFEFYDJU-HZMBPMFUSA-N	448.328	1.180	50	20	IDGD	
CN(C)[C@H](CNC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)c1ccccc1	915891090	FULRNCOLVJCZCN-JOCHJYFZSA-N	438.576	1.832	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)NNC(=O)NCCCN1C(=O)NC2(CCCCC2)C1=O	916266806	ZMUDPJYRPZRDME-UHFFFAOYSA-N	440.504	1.686	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)NCCCN1C(=O)NC2(CCCCC2)C1=O	916268794	STBPXBAJGTUVNB-UHFFFAOYSA-N	435.456	1.180	50	20	IDGD	
CC(=NNC(=O)COc1ccc(C)c(C)c1)c1ccc(S(=O)(=O)NCCC(=O)O)cc1	916297875	MBICVWBOXDFQHT-UHFFFAOYSA-N	447.513	1.976	50	20	IDGD	
O=C(NCc1ccc(N2CCSCC2)cc1)NNC(=O)[C@H]1COc2ccccc2O1	916626113	SKMGJABRIIMHDD-LJQANCHMSA-N	428.514	1.910	50	20	IDGD	
COc1cc(N2C[C@@H](C(=O)NNC(=O)c3ccc(Cl)nc3)CC2=O)cc(OC)c1OC	917252319	KQBITPXRTZLBQI-LBPRGKRZSA-N	448.863	1.575	50	20	IDGD	
COc1cc(S(=O)(=O)NNC(=O)c2cn(C)c3ccccc23)cc(C(=O)O)c1OC	917731752	YNYSPWHULAQXOW-UHFFFAOYSA-N	433.442	1.517	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCCN(C)Cc2ccccc2)nc1	919790739	WIWGDWJJICIUTE-UHFFFAOYSA-N	434.566	1.870	50	20	IDGD	
C[C@@H](Sc1cc(Cl)ccc1Cl)C(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1	919885046	JOKYVZQNSHBDQB-PSASIEDQSA-N	426.347	1.992	50	20	IDGD	
CCn1ncc2c(C(=O)NNC(=O)N[C@H]3CCS(=O)(=O)C3)cc(-c3ccccc3)nc21	919889699	RSLOFNHCPQFDQB-AWEZNQCLSA-N	442.501	1.249	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNS(=O)(=O)c1ccc(F)c(S(C)(=O)=O)c1	920310385	FIMCAMZLVCKFCS-UHFFFAOYSA-N	436.870	1.515	50	20	IDGD	
C[C@H]1CN(Cc2csc(NC(=O)NNC(=O)c3ccc4c(c3)OCCO4)n2)C[C@H](C)O1	920933455	ZZKUVVUZJWZNLV-STQMWFEESA-N	447.517	1.990	50	20	IDGD	
Cc1nc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)ccc1C#N	1317805939	ZHNHLRSNKFWJBL-UHFFFAOYSA-N	427.486	1.511	50	20	IDGD	
COc1cc(Br)c(OC)c(C(=O)NNC(=O)CNC(=O)c2ccco2)c1	1325364051	ACDHAWFRFMBECK-UHFFFAOYSA-N	426.223	1.250	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2cncn2-c2ccccc2)c(F)cc1F	1338823752	IRNMJMUOGSRAIO-UHFFFAOYSA-N	436.396	1.560	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)c2cc3c(c(S(N)(=O)=O)c2)CCC3)cc1OC	1339298433	VRALGTDEAWRMIL-UHFFFAOYSA-N	433.486	1.305	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H]3CCC[C@H]3C)C2)C1	1778337302	FMEZPRHIWQHCLV-XOCFCFQCSA-N	429.521	1.387	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cn4cc(F)ccc4n3)C2)C1	1778542168	KRPUDIKNDPFWNX-KZULUSFZSA-N	439.285	1.700	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)c3ccc(Cl)cc3)CCO2)C1	1779032671	QLPMHHNRXFGSOY-OAQYLSRUSA-N	443.891	1.096	50	20	IDGD	
CN1CCC[C@H](C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CO[Si](C)(C)C)C2)C1	1779546890	WFUFRQPPFJLIRK-WAOWUJCRSA-N	425.646	1.694	50	20	IDGD	
Cc1noc(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@](C)(Cl)CCl)C2)n1	1780713346	RXHLPMXGKCSBCW-FSPWUOQZSA-N	433.336	1.671	50	20	IDGD	
CC(=O)N[C@@H](C(=O)N1CC[C@]2(CN(C(=O)C(Cl)Cl)CCO2)C1)c1ccc(F)cc1	1780915760	YNFWSXJXKWYOQU-DNVCBOLYSA-N	446.306	1.637	50	20	IDGD	
O=C(c1cc(O)nc(Cl)c1)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781326717	RQHSTXFEUXDYRU-IUODEOHRSA-N	436.665	1.575	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1n[nH]c3c1CC[C@@H]3C)C2	1782172863	OXCLEPTWLLOBEJ-RYSHRAHSSA-N	438.956	1.841	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CSCC(=O)O)C1	1782223711	BXVLMKBRYYKCJL-CSMYWGQOSA-N	441.377	1.554	50	20	IDGD	
O=C(CC1Cc2ccccc2C1)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2	1783303679	NQVDOOJNQHIAHG-MIZPHKNDSA-N	434.964	1.905	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc4ncnn4c3)CCO2)C1	1783349060	GURABKQLZOIDQO-KSSFIOAISA-N	436.310	1.346	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cn4cccnc4n3)CCO2)C1	1783349231	KGDRUXBQBDFYRJ-UGSOOPFHSA-N	436.310	1.346	50	20	IDGD	
COc1ccc(OCC(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](C)Br)C3)C2)cc1	1783527401	BRIRYRLXUAFADF-KUHUBIRLSA-N	441.322	1.687	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccnc3S)[C@H]2C1	1783544683	KTCAEOOYOICSDL-JURCDPSOSA-N	442.379	1.995	50	20	IDGD	
CC[C@H](NC(C)=O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](Br)CC)C[C@@H]21	1783582762	XZHPZSPLFJNTMN-QMHWVQJVSA-N	432.359	1.054	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3nnc(-c4ccccc4)o3)CCO2)C1	1783877207	HIKFGRWFXZYUSN-MGPUTAFESA-N	434.880	1.434	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(NC(=O)C4CC4)cc3)CCO2)C1	1783880061	FNTLPRAWOKJMRH-AVRDEDQJSA-N	449.935	1.732	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(NC(=O)C4CC4)cc3)CCO2)C1	1783880066	FNTLPRAWOKJMRH-XMSQKQJNSA-N	449.935	1.732	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccn4c(C)cc(C)nc34)CCO2)C1	1783880864	HWNCBYZUYKZZQD-LAUBAEHRSA-N	434.924	1.648	50	20	IDGD	
Cn1c(=O)n(C)c2cc(C(=O)N3CCO[C@@]4(CCN(C(=O)C(Cl)Cl)C4)C3)ccc21	1783947964	OWBJEIMIESNSCS-LJQANCHMSA-N	441.315	1.124	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3CC[C@H](C(=O)OC)CC3)[C@H]2C1	1784798670	QDVGRPVSQQSAOB-QQCJEOGWSA-N	444.956	1.199	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H]3CCCN3C(C)C)C2)C1	1784806796	KXAUJTRDRHTGNU-BXWFABGCSA-N	430.387	1.863	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(O)nc(O)c3)[C@H]2C1	1787295392	LXIOAEDNKVBRTH-YCTNLIARSA-N	432.304	1.322	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(-c4ccc(O)nn4)cc3)C[C@@H]21)[C@@H](F)Cl	1787449561	HHUNAJOHONRIMU-RIVXBTQJSA-N	448.882	1.977	50	20	IDGD	
Cc1cc(CC(=O)NC2(c3ccc(NC(=O)c4cccc(B(O)O)c4)cc3)CCC2)n[nH]1	1788147975	RZRLIAQBNPJUCD-UHFFFAOYSA-N	432.289	1.388	50	20	IDGD	
Cn1ncc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCBr)C[C@@H]32)c1Cl	1789081281	KPPUOJTUXSCTKJ-DRZSPHRISA-N	433.734	1.452	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3CC[C@H]4CCC(=O)N4C3)[C@H]2C1	1789766908	GABOOQWHLHSKMF-DYKIIFRCSA-N	439.984	1.775	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cn3cc(Cl)cn3)C[C@@H]21)[C@@H](F)Br	1789922750	PIFNMGCZKWXMFM-QVSJOPQTSA-N	437.697	1.207	50	20	IDGD	
Cc1nn(C)c(C)c1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)Br)[C@H]2C1	1791055403	VFQLDJZGWQHYME-HJPIBITLSA-N	427.343	1.414	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(SC)c3O)C[C@@H]21	1791254151	OJECXVSVPLCICS-TUUVXOQKSA-N	442.965	1.961	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3CC(=O)C3)[C@H]2C1	1792162422	STOSDUWWXQVBJG-UWQBARMFSA-N	443.450	1.831	50	20	IDGD	
Cc1cc(Br)ccc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](O)CCl	1792980172	MTVPDRANEGILSB-NOXHYTERSA-N	445.741	1.560	50	20	IDGD	
C[C@@H](CBr)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CNC(=O)c1ccco1)C2	1792989088	AFLZLTXBTGZBIN-FQUUOJAGSA-N	426.311	1.679	50	20	IDGD	
O=C(Cc1cc([N+](=O)[O-])ccc1F)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2	1793811806	SAINVUUTLRIWNR-QHBPRCKVSA-N	434.251	1.670	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(C(=O)O)n(C(C)C)n1	1794759002	ACMVMOFXLNNDPG-XJFOESAGSA-N	426.901	1.668	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](N)c1cccc(Cl)c1	1795629891	KJNJJECNDFKHKH-KKYDWHDCSA-N	444.757	1.713	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1nc2ccc(C(F)(F)F)cn2n1)[C@@H](O)CCl	1796432672	YPSXYLUBZUWZRD-RNJOBUHISA-N	445.829	1.600	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc2c1OCC2	1796792346	YPZNYCAMEFRWSC-FAYQHZLMSA-N	437.334	1.856	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc2c1OCCO2	1796962496	IQGYIXIXVUIRJR-KNLUSZGBSA-N	443.327	1.897	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@](C)(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](O)CCl)C3)C1	1797757899	NICAUCCHCJSSDU-WUUQAYSMSA-N	443.972	1.871	50	20	IDGD	
Cn1ncc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CO[Si](C)(C)C)c1C(F)(F)F	1797952855	MOEDONQYCVRVBR-JJLQDPRZSA-N	448.518	1.494	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CCc3ccoc3C1)C2)[C@H](F)Br	1799343149	OOCPYHKMACZWKG-QUEVPRLRSA-N	429.286	1.665	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3nccn3c1)C2	1800640846	ISJDSRHRILSGRE-IVSAIRAKSA-N	435.322	1.711	50	20	IDGD	
O=C(Cn1cncn1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](Br)Cc1ccccc1	1801568166	UAZZLZRGTONPNL-MHORFTMASA-N	446.349	1.923	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1(c3cccc(F)c3)CC1)C2	1802333229	OBQUKJSYYSKLNG-REPLKXPHSA-N	430.524	1.869	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2cccnc2C(N)=O)[C@@H]1c1cccnc1	1804816637	QCRJIZIMMRUHQO-ZVZYQTTQSA-N	445.907	1.149	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2ccns2)[C@@H]1c1cccnc1	1805220724	JVYFCBWFPHLBFV-BEFAXECRSA-N	430.534	1.231	50	20	IDGD	
COc1ccnc(C(=O)N2CCC3(CCCN(C(=O)[C@H](O)CCl)C3)CC2)c1OC	1805525008	BENJZKNXVLHQQF-CQSZACIVSA-N	425.913	1.543	50	20	IDGD	
COc1cnc(C(=O)NC[C@@H]2CCN(C(=O)CCBr)[C@H]2c2cccnc2)cn1	1806038604	IYJPHKLWNCOSFN-KSSFIOAISA-N	448.321	1.985	50	20	IDGD	
CSCC[C@H](O)C(=O)N1CC[C@@H](CNC(=O)CCBr)[C@@H]1c1cccnc1	1806346467	HODPLHFCMNGDGF-ZOBUZTSGSA-N	444.395	1.986	50	20	IDGD	
C[C@]1(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)CC=CCC1	1807375601	UFHNORJCYLNVFF-KJWPAHLWSA-N	447.344	1.827	50	20	IDGD	
Cc1nnc(CC(=O)NC[C@@H]2CCN(C(=O)[C@@H](C)Br)[C@H]2c2cccnc2)o1	1807474616	INLKHVAOLWVKET-WHCBVINPSA-N	436.310	1.805	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2cc(=O)n3[nH]cnc3n2)[C@@H]1c1cccnc1	1808260832	YNVMZAAFVJXRSS-GRDNDAEWSA-N	443.895	1.150	50	20	IDGD	
Cc1ccc(=O)n(C(C)(C)C(=O)N2CC[C@H](CNC(=O)[C@@H](F)Cl)[C@@H]2c2cccnc2)n1	1808313596	IIVAONNAFBEQNF-BPQIPLTHSA-N	449.914	1.922	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)[C@@H]2CC2(F)F)[C@H]1c1cccnc1	1809524176	ZFNRABYSISVXRT-XOKHGSTOSA-N	444.442	1.055	50	20	IDGD	
CCC(C)(C)C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1	1810304519	DRQGZSVLDOQTPO-QFBILLFUSA-N	438.532	1.836	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)CCNC(C)=O)[C@H]1c1cccnc1	1812779247	QMDNQKKCQFQHOI-BQFCYCMXSA-N	439.354	1.787	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2cc(OC)n(C)n2)[C@@H]1c1cccnc1	1813033801	ZZNXHMPHGSUBDI-RLFYNMQTSA-N	435.912	1.397	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)C(C)(C)NCCC#N)sc2C1	1814985340	FLOROUQNWFYLAA-NEPJUHHUSA-N	427.958	1.591	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1	1817475968	XPCMIQWWEHSTTD-XHDPSFHLSA-N	449.114	1.179	50	20	IDGD	
C=C(C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1)C(F)(F)F	1817476943	IJKJVSHGPQMRSL-HNNXBMFYSA-N	436.199	1.514	50	20	IDGD	
COCc1oncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](Cl)COC)CC2	1817805371	YPDOIDZIKAIHNJ-KOLCDFICSA-N	428.898	1.757	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](F)Br)CC2)c1cc[n+]([O-])cc1	1821053567	UBQVKIYOFZIMHH-JOYOIKCWSA-N	429.271	1.693	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCc2ccccn2)[nH]n1	1822410147	AQXPJNZGPWSDQE-SFHVURJKSA-N	441.536	1.803	50	20	IDGD	
Cc1cnn([C@H](C)C(=O)Nc2cc([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)c1	1822750491	CGHUZWBLMDAJDA-NVXWUHKLSA-N	444.540	1.541	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](C)n2cnnn2)n[nH]1	1822853240	YWFZUBUABBGELT-MDZLAQPJSA-N	439.318	1.681	50	20	IDGD	
CN(CC(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)CC1)C(=O)c1ccccc1	1824178173	DMDRMLDECDBCBN-PMACEKPBSA-N	449.979	1.978	50	20	IDGD	
C=CCC(F)(F)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2	1825249989	BLHITWLODGPTKR-CYBMUJFWSA-N	435.261	1.260	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@H]1CCc2nc(NC(=O)CCn3ccnn3)sc2C1	1826868951	MZNUARKUGBNZMD-QWRGUYRKSA-N	441.355	1.768	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)/C=C/C2CC2)CC1	1828923425	JVSPPGYKILINDE-ROUKRRSUSA-N	425.533	1.885	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)CN)CCN2C(=O)OCc2ccccc2)C1	1828961654	UWZAYNUFUCPYAX-UWJYYQICSA-N	436.940	1.415	50	20	IDGD	
C[C@@H](NNc1ccccc1)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1829814902	URVVZLZLVGXBRZ-KUHUBIRLSA-N	445.347	1.252	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(C4CC4)on3)CCO2)C1	1830201319	YELVUOMRPWZENA-XIKOKIGWSA-N	442.310	1.405	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccn(C)c3)C2)C1	1830535081	IPUDDJLHIQCIER-KDOFPFPSSA-N	428.327	1.126	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccns3)C2)C1	1830535350	MXXKNLJNMQEIOU-LRDDRELGSA-N	432.340	1.244	50	20	IDGD	
Cc1cncc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)c1	1830537434	IHACDEBWDZBWTA-BEFAXECRSA-N	440.338	1.491	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ncccc3F)C2)C1	1830542679	BIVJBEZCASPIDL-SCLBCKFNSA-N	444.301	1.322	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(O)cc3)C2)C1	1830543563	URKXRYQEFOMOSF-KUHUBIRLSA-N	441.322	1.493	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H]2CCNC(=O)C2)CC1	1831656802	KVLSVNJOANTPSZ-NUEKZKHPSA-N	428.371	1.916	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H](C)n2cnnn2)CC1	1831656820	LJLAACYDQXJLOM-GUTXKFCHSA-N	427.347	1.637	50	20	IDGD	
C[C@@H](Cn1ccnc1)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1	1832227634	SAMBZRRIICJHOS-AZUAARDMSA-N	446.596	1.512	50	20	IDGD	
CC(C)(CCl)C(=O)NC1CCN(C2CCN(C(=O)CC(F)(F)C(=O)O)CC2)CC1	1833215147	BSOCPHDSXMFHTE-UHFFFAOYSA-N	437.915	1.933	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3nc(C(C)C)cs3)CCO2)C1	1833287713	BDHNAEDXEVGVDX-AUUYWEPGSA-N	445.969	1.590	50	20	IDGD	
CC(C)c1nc(C(=O)N2CCO[C@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)co1	1833346153	AREOWEBUBCQQOQ-FQEVSTJZSA-N	439.585	1.720	50	20	IDGD	
COC(=O)C12CC(C(=O)N3CCC(N4CCC(NC(=O)[C@@H](F)Cl)CC4)CC3)(C1)C2	1835083693	QMMTUYRYLBVFNZ-APMMTJHUSA-N	429.920	1.436	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@H](C)N3C[C@H]4C[C@H]4C3)CC2)CC1	1835671888	AWVSGXSVMOFANG-LJCCNALRSA-N	425.017	1.916	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1Cc3ccccc3O1)CCO2	1836643780	KXFJFDWJWLWZPB-KPLVRAHFSA-N	436.936	1.854	50	20	IDGD	
O=C(c1cccn2ccnc12)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836717268	REPVEMSANBIKFZ-GOSISDBHSA-N	434.924	1.546	50	20	IDGD	
C[C@H](Oc1ccccn1)C(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836720370	RTBUBDWLDCEXCW-MAUKXSAKSA-N	439.940	1.447	50	20	IDGD	
CC(C)N1CCC[C@H]1C(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836720591	XOMMJAPWRGYRCQ-RBUKOAKNSA-N	429.989	1.458	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)OC(C)C)CCO2	1837604044	SFFZWHZJDZJNEW-RLFYNMQTSA-N	435.359	1.430	50	20	IDGD	
Cc1nc(C(=O)N2CCO[C@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)sc1C	1838409659	JOSZSMPDUBYNRZ-IBGZPJMESA-N	441.626	1.681	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(C)n(C(F)F)n3)CCO2)C1	1838707967	CKJLAZIVOPNFHE-ACJLOTCBSA-N	434.871	1.674	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3c(F)cccc3F)CCO2)C1	1838995869	WKWNSIGURANALM-MGPUTAFESA-N	430.879	1.981	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)NNc3ccccc3)C2)C1	1839141496	KBBYGWHZVKCFJN-MMOPVJDHSA-N	438.956	1.465	50	20	IDGD	
CCc1[nH]nc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](Cl)CC)CCO3)c1Cl	1839143744	HATUASJTISOHOK-SGTLLEGYSA-N	433.336	1.713	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3[nH]cnc3-c3cccnc3)C2)C1	1839145851	FRCJNVIJNKQBFR-IERDGZPVSA-N	447.923	1.559	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)cc1	1839201900	NAPKYINEEANYFD-QAPCUYQASA-N	429.286	1.756	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(F)cc3F)C2)C1	1840034811	XUYXNCIWAKQFOJ-SGTLLEGYSA-N	447.276	1.818	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4cc(C)ccc4[nH]3)C2)C1	1840152816	UVKDOCNTXIFQRB-VGSWGCGISA-N	449.935	1.800	50	20	IDGD	
O=C(c1n[nH]c2c1CCCC2)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840187776	WIMSSJIJXKKJGV-SFHVURJKSA-N	431.320	1.162	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)CC[C@@H]3CCOC3)CCO2)C1	1840589853	VPUHULIXPIJHAO-MNEFBYGVSA-N	437.364	1.496	50	20	IDGD	
O=C(c1cnn2c(-c3cccs3)ccnc12)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1	1841351043	JSOBBLLVUXIKJU-HNNXBMFYSA-N	445.932	1.875	50	20	IDGD	
O=C(c1cc2c[nH]nc2cc1Br)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1	1841352060	UGNDQRFOMLUOBU-CQSZACIVSA-N	441.713	1.742	50	20	IDGD	
O=C(c1ccc2[nH]nc(C(F)(F)F)c2c1)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1	1841353412	XJIUAHVCLDHVOK-CYBMUJFWSA-N	430.814	1.998	50	20	IDGD	
COCCOCC(=O)N1CCCC12CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2	1842776435	HPLVPYSOYRUIIH-UHFFFAOYSA-N	435.433	1.000	50	20	IDGD	
CN(CC(=O)N1CCCC12CN(C(=O)C(C)(C)CCl)C2)NC(=O)NCc1ccccc1	1845038350	SPDQUPYFSZCIJQ-UHFFFAOYSA-N	449.983	1.801	50	20	IDGD	
O=C1CSc2ncc(C(=O)N3CC4(CCCN4C(=O)[C@H](F)Br)C3)cc2N1	1845219218	BEFPGSXBMTZUPR-LBPRGKRZSA-N	443.298	1.633	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)CN2C(=O)c3cccc([N+](=O)[O-])c3C2=O)c1	15886262	FMOIODWYCHHZJZ-UHFFFAOYSA-N	426.385	1.034	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1OC	17461005	HIROPZOYWBRHCS-UHFFFAOYSA-N	433.486	1.563	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cc([N+](=O)[O-])ccc2OC)cc1OC	19284764	QCPQDUWZCVNARH-UHFFFAOYSA-N	433.373	1.239	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc(F)c(F)c1)NNC(=S)NCCc1cccs1	21125166	MDWWBRBVQKPLRC-UHFFFAOYSA-N	448.542	1.433	50	20	IDGD	
Cc1nn(CC(C)C)c(C)c1CCC(=O)NNC(=O)c1csc(N2CCOCC2)n1	24291732	DYHMGBQIZFCSKY-UHFFFAOYSA-N	434.566	1.843	50	20	IDGD	
C[C@H]1CC(C)(C)C[C@@]2(C1)NC(=O)N(CC(=O)NNC(=O)Cc1c[nH]c3ccccc13)C2=O	45591541	UWZXYNQFZITODI-LFVRLGFBSA-N	439.516	1.995	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2cnn(-c3ccccn3)c2C(C)C)n1	110962788	LBFBBSOFIPRYRD-UHFFFAOYSA-N	442.501	1.703	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCCO[C@@H]1CCCC[C@@H]1C	117322256	QBFRMVDIENRNKG-DZGCQCFKSA-N	425.555	1.827	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCN(c2ccccc2C#N)CC1	725801191	VWGJDDJAKZIUOF-UHFFFAOYSA-N	427.892	1.803	50	20	IDGD	
COc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NNC(=S)Nc2cc(C)ccc2C)cc1	725907469	CARYSAFDRZNYRG-AWEZNQCLSA-N	436.559	1.997	50	20	IDGD	
O=C(NNC(=O)N1CCOCC1)c1cc(Cl)ccc1NS(=O)(=O)c1ccccc1	727376981	CBVPCVGLLSKGMS-UHFFFAOYSA-N	438.893	1.827	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3ccc(-n4cccn4)cc3)cc2)CC1	728213171	FWWFAQMWKVADSN-UHFFFAOYSA-N	440.529	1.565	50	20	IDGD	
CC(C)(C)c1nc(CC(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cs1	728341051	BLWQSXZPWIMWCC-OAHLLOKOSA-N	433.486	1.514	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCC(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1)c1ccccc1	729303764	ZMAOPTLOMWJQBT-HOTGVXAUSA-N	439.534	1.615	50	20	IDGD	
CC(=O)N1CCC(CNC(=O)NNC(=O)[C@H](C)Oc2cccc(Br)c2)CC1	729495155	QSNLTQSIRLRBHP-LBPRGKRZSA-N	441.326	1.805	50	20	IDGD	
CC[C@@H](NC(=O)NNC(=O)[C@@H](C)Oc1ccccc1F)c1cccc(S(N)(=O)=O)c1	729613512	UBXYWIBRIVLXCE-MLGOLLRUSA-N	438.481	1.722	50	20	IDGD	
Cc1nnc(SCC(=O)NNC(=O)COc2ccccc2O)n1Cc1ccccc1	730778046	AMAZGNOMTVFQMM-UHFFFAOYSA-N	427.486	1.659	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)c1ccc(S(=O)(=O)NC[C@H]2CCCO2)cc1	731344251	CPOOZAOGCQIJNC-MRXNPFEDSA-N	435.477	1.287	50	20	IDGD	
Cn1cc(/C=C\C(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)cn1	731516059	IJGLLFZVDWHKIH-KHPPLWFESA-N	439.497	1.373	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)c1ccc(S(=O)(=O)NCCc2cccs2)cc1	732082234	ARVXUSSTNGOFOS-UHFFFAOYSA-N	433.515	1.375	50	20	IDGD	
C[C@@H](CSc1ccccc1)C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	732390761	GNEPUVRQGRFTMO-KBXCAEBGSA-N	430.482	1.945	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)NCC1CCN(S(=O)(=O)C(F)(F)F)CC1	732675433	CQCQMUFKHBDAPB-UHFFFAOYSA-N	440.419	1.260	50	20	IDGD	
CCOCCCn1c(NNC(=O)c2ccc(-n3cnnn3)c(C)c2)nc2ccccc2c1=O	733266290	GQAUOUWRBAZAQQ-UHFFFAOYSA-N	448.487	1.864	50	20	IDGD	
COc1cc(CNC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)ccc1OCCO	733349263	ZWSLFZMWEDLCOT-UHFFFAOYSA-N	425.445	1.396	50	20	IDGD	
Cc1cc(NNC(=O)[C@H](NS(=O)(=O)c2ccc3c(c2)OCCCO3)C(C)C)ncn1	734254466	VOVHMDSXGQRAIQ-GOSISDBHSA-N	435.506	1.393	50	20	IDGD	
O=C(NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1)N[C@H]1CCN(C2CC2)C1	734286081	YTNREBGZPOWAJY-ZDUSSCGKSA-N	449.558	1.730	50	20	IDGD	
COc1ccc(CN2CC[C@H](NC(=O)NNC(=O)c3c(C)nc4ccccn34)C2=O)cc1	734515986	BWJGHBWSYHAIAK-KRWDZBQOSA-N	436.472	1.396	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H]2C[C@@H]2c2c(F)cccc2F)c1	734947729	YWJXLXXSTPVHSA-XJKSGUPXSA-N	438.456	1.715	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)[C@@H]2C[C@@H]2c2ccc(F)cc2)CC1	735117331	RFCPBHWZWOVPLZ-IAGOWNOFSA-N	433.509	1.404	50	20	IDGD	
C[C@@H]1CN([C@@H](CNC(=O)NNC(=O)c2cnn(C)c2)c2c(F)cccc2Cl)CCO1	735580223	RYRAXPWKPYZEGY-WBMJQRKESA-N	438.891	1.619	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN2CCN(C(=O)Cc3ccccc3)CC2)cc1C	736308424	JSIPNSBOPJAKGY-UHFFFAOYSA-N	428.558	1.767	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1ccc([N+](=O)[O-])cc1Br	739552781	VYJKCCDYLWCZGX-UHFFFAOYSA-N	449.265	1.825	50	20	IDGD	
CS(=O)(=O)[C@@H]1CCCCC1=NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	741451640	LCLPHFWEZUWCBY-GOSISDBHSA-N	441.575	1.934	50	20	IDGD	
COC(=O)c1cc(Cl)cc(S(=O)(=O)NNC(=O)c2ccc3c(c2)OCCO3)c1	741645792	FIRMKZRSUIJFCQ-UHFFFAOYSA-N	426.834	1.521	50	20	IDGD	
CC(=O)N[C@H](CC(=O)NNC(=O)c1nnc(O)c2ccccc12)c1ccc(F)cc1F	741659875	GDRIWKFNJCDUGK-MRXNPFEDSA-N	429.383	1.642	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN(C[C@@H]2CCCO2)C(=O)OC(C)(C)C)cc1OC	741880118	BZHIIOTXDYVJLL-HNNXBMFYSA-N	437.493	1.881	50	20	IDGD	
CC(C)(C)n1cc(C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)c(-c2ccc(F)cc2F)n1	741894914	NADONGBETJSEHN-LLVKDONJSA-N	440.472	1.779	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)CCN2C(=O)CCc3ccccc32)cc1	743829189	FRYJEBONPOQXTD-UHFFFAOYSA-N	430.486	1.612	50	20	IDGD	
O=C(COC(=O)c1cc(N2CCCC2=O)ccc1F)NNC(=O)c1ccc([N+](=O)[O-])cc1	745192349	YGFPKRSPOVBZAO-UHFFFAOYSA-N	444.375	1.479	50	20	IDGD	
COc1ccc(O[C@H](C)CNC(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)cc1	745898765	BCLUDLXLVARVRR-CQSZACIVSA-N	437.522	1.871	50	20	IDGD	
CCN(CC)S(=O)(=O)CC(=O)NNC(=O)COc1ccccc1Cc1ccccc1	746094181	DKWFPEKVHDGZEV-UHFFFAOYSA-N	433.530	1.475	50	20	IDGD	
C[C@H]1OC(C)(C)N(C(=O)OC(C)(C)C)[C@H]1C(=O)NNC(=O)c1nnc(O)c2ccccc12	746096464	GLUCYVMTRXCPSU-IAQYHMDHSA-N	445.476	1.857	50	20	IDGD	
CC(C)[C@@H](C(=O)NNc1ccc(S(=O)(=O)C(F)F)cc1)N1CCCS1(=O)=O	748611071	DZFWSWZVWDMNII-ZDUSSCGKSA-N	425.479	1.186	50	20	IDGD	
Cc1ccc(CCC(=O)NCC(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)cc1	749309986	RERYYWIJNGALTH-UHFFFAOYSA-N	431.876	1.702	50	20	IDGD	
CNS(=O)(=O)c1ccc(-c2ccc(C=NNC(=O)CNC(=O)c3ccco3)o2)cc1	750937438	WCJRQXGGFZACRL-UHFFFAOYSA-N	430.442	1.328	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)NC[C@H]2CCC[C@@]23NC(=O)N(C)C3=O)cc1OC	752025520	YHMWWQFCLQCTSJ-SPLOXXLWSA-N	447.492	1.149	50	20	IDGD	
COc1cc(OC)cc(N2C[C@H](C(=O)NNC(=O)[C@H](C)Oc3ccc(F)cc3)CC2=O)c1	752400866	WEOXGOVQMBTBIA-UONOGXRCSA-N	445.447	1.811	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)NC[C@@H]1CCN(S(C)(=O)=O)C1	753005345	UMGVRBXINSQGJL-ZDUSSCGKSA-N	437.547	1.344	50	20	IDGD	
CC[C@H](NC(=O)NNC(=O)c1cc(F)ccc1Br)C(=O)N1CCOCC1	753047814	WRVNZFHYYVZCJE-ZDUSSCGKSA-N	431.262	1.170	50	20	IDGD	
O=C(NNC(=O)N1CCC[C@@H](S(=O)(=O)N2CCc3ccccc32)C1)c1ccccc1	754142093	VBXVTTHXHAYMBE-GOSISDBHSA-N	428.514	1.898	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)N[C@@H]1[C@H]2CCO[C@H]2C12CCCC2	754837692	BCYDAMYCANQFNV-FVQBIDKESA-N	435.550	1.580	50	20	IDGD	
Cc1cc(C)c(S(=O)(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1[N+](=O)[O-]	755000205	DKQPFJKKCDZECL-UHFFFAOYSA-N	427.460	1.238	50	20	IDGD	
O=C(NNC(=O)c1cccc(-n2ccnn2)c1)c1ccc(S(=O)(=O)N2CCCC2)cc1	755407542	NPUDFLLZLMSGNA-UHFFFAOYSA-N	440.485	1.127	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2cc3c(cc2F)CCC(=O)N3)c2ccccc2c1=O	755739017	DADHQGCACLQQHA-UHFFFAOYSA-N	438.419	1.907	50	20	IDGD	
COC(=O)c1nc(Cl)ccc1S(=O)(=O)NNC(=O)c1cccc(Br)c1	755974714	MREDYHSEYSCSMH-UHFFFAOYSA-N	448.682	1.907	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)NCCN2C(=O)[C@@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2=O)cc1	756096076	ONEYHCYAFYVLIQ-LBTBCDHLSA-N	428.514	1.225	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)Nc1cnc(C2CC2)nc1	756370111	GZESOXAIHVKKIX-UHFFFAOYSA-N	444.517	1.995	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)ccc1C(=O)N(C)C	756706286	ZOPXAQSPFQNCNW-UHFFFAOYSA-N	447.517	1.414	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)Nc3cnn(-c4ncccn4)c3)n[nH]2)cc1OC	756757293	CQMZBFOARHOKKX-UHFFFAOYSA-N	449.431	1.536	50	20	IDGD	
C[C@@H]1C[C@@H](C)CC2(C1)NC(=O)N(CC(=O)NNC(=O)c1cnn(-c3ccccc3)c1)C2=O	756995938	MTEKYYMIOIDDKX-HUUCEWRRSA-N	438.488	1.380	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H](CCC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)C1	758095907	MNPHMSMJXUATOD-CQSZACIVSA-N	429.481	1.461	50	20	IDGD	
CCOc1ccc(-c2nc(CC(=O)NNC(=O)C(=O)Nc3ccccn3)cs2)cc1	758838230	CPPXHZSLXPHBHF-UHFFFAOYSA-N	425.470	1.932	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc2c(c1)COC2)NNC(=O)c1ccc2ccccc2n1	759679508	RXUASFAQOZGOCP-UHFFFAOYSA-N	426.454	1.005	50	20	IDGD	
CCOc1nc(C(F)(F)F)ccc1C(=O)NNC(=O)c1csc(N2CCOCC2)n1	760067615	WWAFGOYLTULGBK-UHFFFAOYSA-N	445.423	1.867	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCCC(=O)NNC(=O)c1cccc(C#N)c1	760813653	LKPVLZXXGHBXOH-MRXNPFEDSA-N	429.477	1.225	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)[C@@H]1CN(C(=O)OC(C)(C)C)CCO1	761636932	LCAIHRQLYJKHSF-AWEZNQCLSA-N	425.507	1.571	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)NC[C@H]1[C@@H](C)OC(C)(C)N1C(=O)OC(C)(C)C	762332024	UOFLXURSHVEUEI-MCIONIFRSA-N	432.518	1.129	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)c1nc(S(C)(=O)=O)n2ccccc12	762370575	NDHABPFNTXOVPZ-UHFFFAOYSA-N	434.499	1.300	50	20	IDGD	
O=C(COC(=O)c1cc(Cl)cc(Cl)n1)NNC(=O)[C@H]1COc2ccccc2O1	762948783	JAPCJZIAQIGRLL-CYBMUJFWSA-N	426.212	1.533	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)N1CCN(S(C)(=O)=O)c2ccccc2C1	763454000	PIYSEKSPAVMBJR-UHFFFAOYSA-N	442.501	1.279	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2O)cc1OCC1CCOCC1	763531933	UKGYITYMALOWLD-UHFFFAOYSA-N	427.457	1.906	50	20	IDGD	
CC(C)(C)c1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccccc2-n2cncn2)cc1	763595522	SHPCCEBRYUQWBQ-UHFFFAOYSA-N	436.472	1.730	50	20	IDGD	
Cc1nc(-c2cccc(NC(=O)C(=O)NNC(=O)c3cc(-c4ccccc4)[nH]n3)c2)no1	763603854	BCXRWERITLAXSP-UHFFFAOYSA-N	431.412	1.835	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(NC(=O)c3ccncc3)c2)c1	763623420	LVSWFQZDBNHBIL-UHFFFAOYSA-N	447.451	1.807	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cc(N3CCCC3=O)ccc2F)cc1	763660061	VUMPAZHKERWNEJ-UHFFFAOYSA-N	444.419	1.126	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(Cl)c(C(=O)NC)c1	763713334	YCOAVAGPPHSGJV-UHFFFAOYSA-N	432.864	1.427	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2cc(NC(C)=O)ccc2OC)c1	763775214	ONXAPZYLZWUYJS-UHFFFAOYSA-N	430.417	1.071	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccc(F)cc1Br	763838847	VSVRNVNQXIQUOU-UHFFFAOYSA-N	428.189	1.892	50	20	IDGD	
CCCNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)c1	763848232	AYMNSLGDVNBNJW-CYBMUJFWSA-N	430.436	1.519	50	20	IDGD	
COC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(C(C)=O)cc2)c1	763870667	BNONKEHKOCQHAP-CYBMUJFWSA-N	442.428	1.621	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@@H](C)C(=O)NNC(=O)C(=O)Nc1cnc2c(c1)COCC2	763884928	ZEWCJYYEACVQFM-ZDUSSCGKSA-N	446.891	1.978	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccn(Cc3ccccn3)n2)cc1OC	763900998	KECVCIDAMUMZTE-UHFFFAOYSA-N	438.444	1.133	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)C(=O)Nc1ccccc1N1CCCCC1	763922284	UTDCVPKWZGTCGJ-UHFFFAOYSA-N	434.460	1.052	50	20	IDGD	
CSCCc1ccc(NC(=O)C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc1	763948684	LAIRHRJFIVPLLV-UHFFFAOYSA-N	439.497	1.883	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3cccc(Cn4cncn4)c3)cc2C1	763949323	OHGCUOBMLGIQTE-ZDUSSCGKSA-N	438.513	1.912	50	20	IDGD	
COC(=O)NCc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(Br)c2)cc1	764063599	UMHRISNNEHPENZ-UHFFFAOYSA-N	449.261	1.705	50	20	IDGD	
COc1ccc(S(=O)(=O)C(F)(F)F)cc1NC(=O)C(=O)NNC(=O)C1CCCC1	764069631	ZGBWHSVUQBBOBG-UHFFFAOYSA-N	437.396	1.265	50	20	IDGD	
COC(=O)c1ccc(N2CCCC2)c(NC(=O)C(=O)NNC(=O)c2ccc(C)cc2O)c1	764105177	LKZRAGKIMOYXMQ-UHFFFAOYSA-N	440.456	1.487	50	20	IDGD	
CO[C@@H]1Cc2ccc(NC(=O)C(=O)NNC(=O)c3cc(-c4ccc(C)cc4)[nH]n3)cc2C1	764111047	MUAKQKMHUBBFHT-GOSISDBHSA-N	433.468	1.898	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccccc2-c2noc(C)n2)o1	764138675	HHLBPPDUIAEFCA-UHFFFAOYSA-N	440.460	1.880	50	20	IDGD	
CCOc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NNC(=O)CCCc1ccccc1	764223565	JAKBGMLNMYKKDS-UHFFFAOYSA-N	440.500	1.896	50	20	IDGD	
COC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2cccc3ncccc23)cc1F	764261044	WPSWTQPJCPYOMU-UHFFFAOYSA-N	425.376	1.952	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)Cc2cccnc2)cc1NC(=O)OC(C)(C)C	764267700	JGOIHLNJEMZRCC-UHFFFAOYSA-N	443.460	1.766	50	20	IDGD	
CCCc1cc(NC(=O)C(=O)NNC(=O)c2cc(F)ccc2Br)n(C)n1	764276222	AQLDLDGSMZHHPJ-UHFFFAOYSA-N	426.246	1.674	50	20	IDGD	
CN(CC(=O)NNc1ccc(S(=O)(=O)Nc2nccs2)cc1)[C@@H]1CCSC1	764494056	KJMFTQHUAMVUGI-CYBMUJFWSA-N	427.577	1.824	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C[C@H]1CN(C(=O)OC(C)(C)C)CCO1	764565216	ZQMNSZGXFWGTCI-BBRMVZONSA-N	425.457	1.766	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NN=CC[C@H]1CCOC1)N(S(C)(=O)=O)CC2	765569561	KKTRCHKPOJBKFP-WMLDXEAASA-N	439.534	1.481	50	20	IDGD	
Cc1c(/C=C(\C#N)C(=O)Nc2cccc(S(=O)(=O)NCCN(C)C)c2)cc(C#N)n1C	765722048	ABGIPHFJNCDAFM-LICLKQGHSA-N	440.529	1.591	50	20	IDGD	
CCc1noc2ncc(C(=O)NNC(=O)CN3CCN(C(=O)c4ccccc4)CC3)cc12	765735282	JEYYSLCOQHVTHM-UHFFFAOYSA-N	436.472	1.004	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2cc([N+](=O)[O-])c(O)cc2C)cc(OC)c1OC	766306224	CGPCLTAWRKGUNP-UHFFFAOYSA-N	441.418	1.258	50	20	IDGD	
CC(=O)N1CCc2ccccc2[C@@H]1CC(=O)OCC(=O)NNC(=O)Cc1ccccc1C	767264481	AXQIYBSCZACQBH-NRFANRHFSA-N	437.496	1.764	50	20	IDGD	
CC(C)(C)[C@@H](Br)C(=O)N1CCN(c2cc(N3CCOCC3)ncn2)CC1	768175375	MEEMDAPKNXRROF-INIZCTEOSA-N	426.359	1.771	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1ccc(C#N)cc1)C(=O)NNC(=O)c1cc(-c2cccs2)[nH]n1	768259825	AGYXLRQAUCTQSS-LLVKDONJSA-N	444.498	1.138	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NC2CCN([C@H]3CCC[C@H]3O)CC2)ccc1OC(C)C	769152364	DTGLIZPUFMEBON-ZWKOTPCHSA-N	434.537	1.804	50	20	IDGD	
COc1ccccc1C(=O)NNS(=O)(=O)c1sc(C(=O)O)cc1Br	769634533	XLGJABCJXOJGKR-UHFFFAOYSA-N	435.277	1.841	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)CNC(=O)NCc3ccc(Cl)cc3)nc21	770966019	JFAHTYLWLMVNHA-UHFFFAOYSA-N	446.899	1.883	50	20	IDGD	
CC(C)NS(=O)(=O)c1c[nH]c(C(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)c1	770967586	XREXQEBLQFDTRL-UHFFFAOYSA-N	436.498	1.059	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)cc1	771045962	QHHAEAOZKMQVAO-ZDUSSCGKSA-N	445.476	1.652	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)[C@@H]1CSCN1C(=O)c1ccc(C(C)(C)C)cc1	772094481	DBSNJPYIXSVNLT-CJNGLKHVSA-N	435.546	1.988	50	20	IDGD	
O=C(Cn1nnc(-c2ccc(Cl)cc2)n1)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772904406	HCQRPXCGLQLOPA-UHFFFAOYSA-N	448.270	1.111	50	20	IDGD	
Cc1oc(S(=O)(=O)N(C)C)cc1C(=O)NNC(=O)[C@H](C)Oc1cccc(Cl)c1	772962940	GOYBXXJWAVBJPF-NSHDSACASA-N	429.882	1.720	50	20	IDGD	
CC(C)c1nccnc1NNC(=O)C(=O)Nc1ccc(F)c(-n2nnnc2C2CC2)c1	773992763	LGHROVGJQWBEGD-UHFFFAOYSA-N	425.428	1.674	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccn(Cc2ccccn2)n1	774002532	QZPQCODKXFTMNX-ZDUSSCGKSA-N	442.863	1.533	50	20	IDGD	
CC1C[C@H](C(=O)NNc2ccc(Cl)nn2)[C@@H](C(=O)NNc2ccc(Cl)nn2)C1	776153334	VEKLJPYLBCXSJV-UWVGGRQHSA-N	425.280	1.822	50	20	IDGD	
Cc1cc(Br)cc(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1	777142177	ZRKIOYSASRAVIZ-HNNXBMFYSA-N	434.246	1.683	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)[C@@]3(F)CCN(C(=O)OCc4ccccc4)C3)nc21	777400134	SHARRTXBKILIQX-LJQANCHMSA-N	429.412	1.263	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)C[C@@H]1C=CCCC1	777412924	XFAUWTUMFMYUEF-GOSISDBHSA-N	435.546	1.534	50	20	IDGD	
Cc1cc(Br)cc(C=NNC(=O)[C@H](C)NS(C)(=O)=O)c1OC(F)F	777886555	ZQVNRAAQPIKJLQ-QMMMGPOBSA-N	428.255	1.747	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@@H]2CC(C)(C)OC2(C)C)cc1	779384988	PVQPPJQSTHQXAK-OAHLLOKOSA-N	426.539	1.292	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)c1ccc2cc[nH]c2n1	779533319	JAMKRCZHEUIZPD-UHFFFAOYSA-N	426.908	1.795	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)N1CCC[C@@H](S(=O)(=O)N2CCc3ccccc32)C1	779624672	QLOZTHZRZNYOGJ-FUHWJXTLSA-N	436.578	1.425	50	20	IDGD	
CCC[C@@H]1C[C@H](C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)CCO1	780522444	VBBQSASTJTYBBF-HZPDHXFCSA-N	425.555	1.056	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)c2ccc(S(=O)(=O)NC[C@@H]3CCCO3)cc2)c1	780790839	ANLVYMRNVFVFQL-KRWDZBQOSA-N	433.486	1.687	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)CNS(=O)(=O)c2ccc(Br)s2)c1	781034533	JITBRSBFRLIJRT-UHFFFAOYSA-N	448.320	1.719	50	20	IDGD	
Cc1nn(-c2ccc(S(N)(=O)=O)cc2)c(C)c1CCC(=O)NNc1ncncc1Cl	781834499	XILRMUJLOXUOMT-UHFFFAOYSA-N	449.924	1.656	50	20	IDGD	
O=C(NNC(=O)[C@@H]1C[C@H](O)CN1S(=O)(=O)c1ccc(Cl)cc1)NC1CCCCC1	781929835	LOMDGWYTMRVOKK-HOCLYGCPSA-N	444.941	1.127	50	20	IDGD	
COc1cc(C)ccc1Oc1ccc(NC(=O)C(=O)NNC(=O)C(=O)NC2CC2)cc1F	782967013	QINVQTKRAHVXPG-UHFFFAOYSA-N	444.419	1.300	50	20	IDGD	
CNS(=O)(=O)c1cc(NC(=O)C(=O)NNc2ccccc2Br)ccc1C	782982763	NHOLWOWQVSYVRT-UHFFFAOYSA-N	441.307	1.747	50	20	IDGD	
CCNC(=O)COc1cccc(NC(=O)C(=O)NN=c2sc3ccccc3n2C)c1	783350385	ZJZBATJQUUAYKE-UHFFFAOYSA-N	427.486	1.325	50	20	IDGD	
Cc1ccc(C(=O)NCC2CC2)cc1NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	784474331	AFHQPKUVDGVZIB-UHFFFAOYSA-N	448.483	1.848	50	20	IDGD	
COC(=O)c1cc(N2CCOCC2)ccc1NC(=O)C(=O)NNc1ccc(Cl)nc1	784874781	MGTNQVTUMNAGAP-UHFFFAOYSA-N	433.852	1.440	50	20	IDGD	
CN1CCN(C(=O)c2ccccc2NC(=O)C(=O)NNc2cc(F)c(F)cc2F)CC1	784891699	ZBGMORBKZFABJF-UHFFFAOYSA-N	435.406	1.573	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)C(=O)Nc1cccc(Cl)c1-n1cccn1	785060743	KUGGIKJLQXOGJN-UHFFFAOYSA-N	437.847	1.502	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2ncn(CC(=O)N3CCCCCC3)n2)cc1Cl	785118681	UITSTJHQMAPQMC-UHFFFAOYSA-N	449.899	1.425	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2cccc(CN3CCN(C)CC3)c2)n1	785226127	QBZLLQVDHHBWEL-UHFFFAOYSA-N	440.552	1.152	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1cc(C2CCCC2)nn1C	785330473	IJYKAXSCKIWQJI-UHFFFAOYSA-N	435.506	1.572	50	20	IDGD	
CC(C)N1C(=O)C[C@@H](C(=O)NNC(=O)N2CCN(C)CC2)[C@H]1c1ccc(Cl)c(F)c1	788168769	BVWCNVJEXXKMCK-RDTXWAMCSA-N	439.919	1.765	50	20	IDGD	
Cn1nc([C@@H]2CCCO2)cc1NC(=O)C(=O)NNC(=O)CCSc1ccc(F)cc1	789740938	KVUOQKSHXOQTAM-HNNXBMFYSA-N	435.481	1.679	50	20	IDGD	
COCC1(CNC(=O)NNC(=O)Cc2cccnc2)CCN(C(=O)OC(C)(C)C)CC1	790709795	ROJVQQDHCKIKCL-UHFFFAOYSA-N	435.525	1.618	50	20	IDGD	
C[C@](O)(Cn1cc(C(F)(F)F)ccc1=O)C(=O)NNC(=O)C12CC3CC(CC(C3)C1)C2	792016770	AHDBVXLSAHDRPV-MMVGZCIASA-N	441.450	1.982	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2nc3ccccn3n2)n(-c2ccc(C(F)(F)F)cn2)n1	792394973	VSSKDLXJGSIGFE-UHFFFAOYSA-N	445.365	1.719	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)CS(=O)(=O)Nc1ccc(OC(C)C)cc1	792797660	IQKMDXLEZACXDN-UHFFFAOYSA-N	435.502	1.614	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)[C@@H]2N(C(=O)OC(C)(C)C)CC2(C)C)c2ccccc2c1=O	792812312	RHKQUDFBKUCAKE-HNNXBMFYSA-N	429.477	1.340	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)nc1Br	793050459	PJNJWDPLOBFRME-UHFFFAOYSA-N	431.250	1.129	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2cc(F)ccc2Br)cnc1C	793391761	BMELIKFUMRPAKM-UHFFFAOYSA-N	446.254	1.702	50	20	IDGD	
COc1ccc2nc(NNC(=O)[C@@](C)(O)CN3C(=O)NC4(CCCC4)C3=O)c(C)cc2c1	793780994	OHOBBGPTUIQCGE-NRFANRHFSA-N	441.488	1.611	50	20	IDGD	
Cc1nc(-c2ccccc2NC(=O)C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cs1	797000575	TVGXIAQYZXEXEW-UHFFFAOYSA-N	448.468	1.494	50	20	IDGD	
CCNC(=O)N(C)c1cccc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)c1	797007775	RPDJOYKFJJUERW-UHFFFAOYSA-N	449.414	1.610	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccnn2[C@@H]2CCN(Cc3ccccc3)C2)n1	797370390	BCBWQRSDQBZRPW-GOSISDBHSA-N	447.499	1.433	50	20	IDGD	
Cc1cc(S(N)(=O)=O)cc(NC(=O)NNC(=O)CNC(=O)OCc2ccccc2)c1C	797627699	OFPBVEGLDZBQSH-UHFFFAOYSA-N	449.489	1.030	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1nc2c(s1)C[C@H](c1ccccc1)CC2	799437615	QQFFDIXEDYKTON-DGCLKSJQSA-N	437.547	1.506	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)c1ccccc1Sc1ccccc1[N+](=O)[O-]	799834456	NKERDXCUMDYVDE-LLVKDONJSA-N	438.487	1.445	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2cncc(OCCOC)c2)c2ccccc2c1=O	800798611	LLSPCHJACCAPTI-UHFFFAOYSA-N	425.445	1.302	50	20	IDGD	
O=C(COC(=O)c1nn(-c2ccc(F)cc2)cc1O)NNC(=O)c1cccc([N+](=O)[O-])c1	801326059	YWLFWVVITOXFOP-UHFFFAOYSA-N	443.347	1.243	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)/C=C/c1ccccc1)C(=O)NNC(=O)N=c1cc[nH]cc1	802030873	VLZQRILILXXBQW-IDKBZEPQSA-N	449.558	1.368	50	20	IDGD	
C=CCNS(=O)(=O)c1cc(C(=O)NNC(=O)Nc2ccc3c(c2)OCO3)ccc1F	802100493	QSAUJVITBHMGKE-UHFFFAOYSA-N	436.421	1.485	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(C(OC)OC)o2)c1	806305926	BHQNHHSDVFXEGK-UHFFFAOYSA-N	439.490	1.676	50	20	IDGD	
O=C(NNC(=O)c1ccccc1F)C(=O)Nc1ccc2nccnc2c1Br	806972653	FFVZVKRHRJPLLU-UHFFFAOYSA-N	432.209	1.931	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2ccc(-n3ccnc3)nn2)nn1-c1ccc(F)cc1F	808943958	FJYSUDZZPOWVKU-UHFFFAOYSA-N	439.386	1.516	50	20	IDGD	
COc1cc(CNC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)ccc1OC(F)F	813528827	RNYCEZURTGSMBA-UHFFFAOYSA-N	433.375	1.417	50	20	IDGD	
COc1cc(C=NNC(=O)Nc2ccc(S(N)(=O)=O)cc2)cc(OC)c1OC(C)=O	814968082	NJMNJKTXGJZLFB-UHFFFAOYSA-N	436.446	1.432	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)C(=O)Nc1ccc([C@@H]2CCOC2)cc1	815566265	NRTCNDDFSAVXJV-CQSZACIVSA-N	428.401	1.264	50	20	IDGD	
CC(C)n1cnnc1SCC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	817026799	UJNDVEVDXXREKV-UHFFFAOYSA-N	431.566	1.311	50	20	IDGD	
COc1cc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc(OC)c1C	848948597	RLSLRTQUZDZXOG-GOSISDBHSA-N	430.413	1.156	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCNC(=O)[C@H]1c1cccc(C)c1	848951375	SPXRKAHNHDLQMN-LJQANCHMSA-N	430.892	1.591	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2N2CCOCC2)c1	863997313	SBYHXXGEBSNAMU-UHFFFAOYSA-N	428.445	1.888	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)[C@@H]1CS[C@@H](Cc2ccccc2F)C(=O)N1	892500475	WDIPFONQKAQREU-IRXDYDNUSA-N	435.452	1.334	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCC(C)(C)N1CCOCC1	913623768	AESLCICVLDHZTR-CYBMUJFWSA-N	443.342	1.658	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2csc(Br)c2)ccc1Cl	914333583	HRQLOPQGRAFKHF-UHFFFAOYSA-N	438.712	1.886	50	20	IDGD	
O=C(CCCc1nc(-c2ccc(Cl)cc2)no1)NNC(=O)[C@@H]1CCS(=O)(=O)C1	915141082	BNEGRAISEFOWQX-GFCCVEGCSA-N	426.882	1.295	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(CNC(=O)NNc2ccc(-n3cccn3)nn2)cc1	915924920	KODKKRIOVFAOAJ-UHFFFAOYSA-N	444.521	1.519	50	20	IDGD	
CCCCOc1ccc(C(C)=NNC(=O)CSc2nn(C)c(=O)n(C)c2=O)cc1OC	915958710	RPNPPBIHSXVMJB-UHFFFAOYSA-N	449.533	1.299	50	20	IDGD	
Cc1ccc([C@H](CN2CCOCC2)NC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1	916216190	RELVAKJOXNPSAF-IBGZPJMESA-N	427.461	1.921	50	20	IDGD	
Cc1n[nH]cc1CNC(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	916578758	ULAHJGWKYXUGNB-UHFFFAOYSA-N	431.460	1.564	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3cccs3)c2)n1	916829400	SFLSJTRCWNIXEC-UHFFFAOYSA-N	447.542	1.501	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)COc1ccccc1C#N)c1cccc(NS(C)(=O)=O)c1	918086798	PUSVZYMWZBAVFE-ZDUSSCGKSA-N	431.474	1.400	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCCC(=O)NC1CCCCC1	918125663	LYKZTOYFWZFZQL-UHFFFAOYSA-N	438.554	1.071	50	20	IDGD	
CCN(CCCNC(=O)/C(C#N)=C\c1cc(C)n(C[C@H]2CCCO2)c1C)S(C)(=O)=O	918670047	HNUOETUIQPPTBL-QRRJMBGHSA-N	436.578	1.979	50	20	IDGD	
CC[C@@H](C)[C@@H](C)NC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	920048630	JGFIQVCEQYAGDZ-HZPDHXFCSA-N	440.566	1.405	50	20	IDGD	
NC(=O)[C@H]1CCCN1Cc1cccc(NC(=O)NNC(=O)c2ccc3c(c2)OCCO3)c1	920933323	TWAQAVXLRFRAON-QGZVFWFLSA-N	439.472	1.374	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)c1ccc(N2CCCC2=O)cc1	920965313	KELMPTGKDDZNGO-AWEZNQCLSA-N	444.513	1.922	50	20	IDGD	
C[C@H](NS(=O)(=O)c1ccc(Cl)cc1)C(=O)NNC(=O)c1cncn1-c1ccccc1	1248442371	ZACISPMUWZCDHY-ZDUSSCGKSA-N	447.904	1.654	50	20	IDGD	
O=C(NNC(=O)C1CCN(C(=O)COc2ccccc2)CC1)c1n[nH]c2c1CCCC2	1317822714	YHULWSRSZBOEJN-UHFFFAOYSA-N	425.489	1.367	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCc2cccc(C(=O)NC[C@H]3CCCO3)c2)cc1	1318066235	WKVGUXIBKNQXIC-LJQANCHMSA-N	426.473	1.748	50	20	IDGD	
C[C@H](C(=O)NNC(=O)C1CCN(c2ncccn2)CC1)c1ccc(S(C)(=O)=O)cc1	1331661280	OQSVWLZEIALAKP-AWEZNQCLSA-N	431.518	1.048	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)CNC(=O)c2cc(Cl)ccn2)n[nH]1	1340600404	KDUMFLJCNMQGLG-UHFFFAOYSA-N	428.836	1.325	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Cl)C2)c1ccc2c(n1)OCCO2	1777953079	GGFHBLZLVXJWGL-SPYBWZPUSA-N	427.860	1.515	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@](C)(Cl)CCl)C2	1778105626	FDTMTYPAKITNBE-OYYCAODRSA-N	436.380	1.603	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)Cn3c(=O)n(C)c4ccccc43)C2)C1	1778164166	BSPIXJXIZAXFRC-YCRPNKLZSA-N	434.924	1.187	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2)c1cccc2cccnc12	1778461484	VHZPPXVDZUAKMN-JBYIUTFZSA-N	431.920	1.962	50	20	IDGD	
CC(C)(C)c1cc(C(=O)N2CC[C@@]3(CN(C(=O)CCBr)CCO3)C2)[nH]n1	1779571730	AHTVAWIWJZKSBK-GOSISDBHSA-N	427.343	1.936	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2n[nH]cc2[N+](=O)[O-])C1	1779603028	IBICLBQRPVHFLN-OAUYIBNBSA-N	448.307	1.682	50	20	IDGD	
CCn1nc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)cc1C	1779713670	CXKBQGNSJOVXIL-UGSOOPFHSA-N	427.343	1.686	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3[nH]cnc3-c3cccnc3)C2)C1	1780055933	GIHMVBXRSZBCEG-MGPUTAFESA-N	433.896	1.169	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)n(C(F)F)n1	1780312739	FQUKPJADMFWDPI-NHYWBVRUSA-N	439.232	1.721	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)N2CCN(C)CC2)C1	1780637213	QYPRXCWYMXVOEV-JZJXAQOMSA-N	443.032	1.544	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cncc(O)c1)C2)[C@@H](F)Br	1780777225	OZVYCXREENFORI-CKEIUWERSA-N	430.274	1.605	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2)c1cc(O)c(O)c(Cl)c1	1781119137	ALFIXMXKIHDCGU-SPYBWZPUSA-N	447.315	1.478	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@](C)(Cl)CCl)C3)C2)nc2nccn12	1781234128	IQYIRQLWWLMDNM-RTBURBONSA-N	440.331	1.718	50	20	IDGD	
O=C(c1c[nH]c2nccc-2c1)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781331057	KGBDMTZUUXSTQR-SUMWQHHRSA-N	425.258	1.649	50	20	IDGD	
Cc1nc2sccn2c1C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781331535	MUCGIJPCPBLUMY-BLLLJJGKSA-N	445.314	1.838	50	20	IDGD	
O=C([C@@H](F)Br)N1CC[C@@]2(C1)CN(C(=O)[C@@H]1Cc3ccccc3CN1)CCO2	1781332088	ZQNMNENRWADXKC-FRQCXROJSA-N	440.313	1.221	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnn3c1CCC3)C2	1782001678	HUDIDUYSODHQHM-URKNILKWSA-N	439.354	1.740	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)n1cccc1C=O)C2	1782170278	GNLBQZNKQYJQEI-QTQZEZTPSA-N	439.940	1.629	50	20	IDGD	
CC(C)c1nc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CCC(=O)NN(C)C)C2)co1	1782208916	AMSHWTWDMRWKNA-VGOFRKELSA-N	449.552	1.299	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)n2cccn2)C1	1782562266	RVVMZWSZCQEVMY-ATNYBXOESA-N	427.343	1.741	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)CN3CCCCC3=O)CCO2)C1	1783354564	CLTGEYZJUHELPO-KBXCAEBGSA-N	430.343	1.002	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)C13CC(C(=O)OC)(C1)C3)CCO2	1783354969	GKIWKBWXQZVVBQ-KSBHDHOUSA-N	443.338	1.333	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)N1CC[C@]2(CN(C(=O)CCBr)CCO2)C1	1783396209	XNAIIWSXNCFBFQ-QGZVFWFLSA-N	434.331	1.126	50	20	IDGD	
CCn1nc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](Cl)COC)C3)C2)c2ccccc21	1783874804	HKPKGDQOBLILJE-HRAATJIYSA-N	434.924	1.754	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cccc3ccncc13)CCO2	1783937577	VEMUJQOPBFRPEF-HSZRJFAPSA-N	439.516	1.051	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc(Cl)c(Cl)c3)C[C@@H]21)[C@@H](O)CCl	1784091580	YBZNTGFKIQKSJA-RETIQXCHSA-N	436.723	1.581	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CNC(=O)c3cccs3)C[C@@H]21	1784616330	PGXSAKKFXWFHSR-JONQDZQNSA-N	441.981	1.865	50	20	IDGD	
C[C@H](Cn1cccn1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]21	1785442154	MYXSVYYCGRIOSS-XZLOLGPPSA-N	431.364	1.735	50	20	IDGD	
CCOC(=O)c1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]3C2)cc1	1787449619	JIGXJGIRSOREHG-LUKYLMHMSA-N	426.872	1.991	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)c1cnc2ccccn12	1787934000	OIWFDUHJINJOGE-DUPGQFARSA-N	439.285	1.618	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3ON=C(c4ccccc4)O3)[C@H]2C1	1788520016	DTQGVTKQLCMHMZ-QYRAFCHESA-N	435.908	1.718	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)c1ccn(C(F)F)n1	1788940120	RLEZZPSTLWJULP-QSFUFRPTSA-N	439.232	1.562	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C3(Br)CC3)C[C@@H]21)[C@H](F)Br	1789923562	UVDVCGDSQCZDAT-NAKRPEOUSA-N	442.123	1.584	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3CCN(CC)CC3)C[C@@H]21	1790962494	CAHJBKZMGOHLPJ-XSLAGTTESA-N	444.414	1.872	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccn4ccnc34)C[C@@H]21	1791056120	OGJOVVPNOVZIFB-SDADXPQNSA-N	435.322	1.711	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CNc4ccccc43)C[C@@H]21	1791057510	FAJACTOWGPRGAI-IALZYPHNSA-N	436.350	1.959	50	20	IDGD	
COc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)CBr)nc1	1792867802	HVXFUYONEOFESQ-JFILPPLUSA-N	426.311	1.324	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1Cc3ccccc3N1)C2	1792871980	GRXYKIZXMWKTQU-CNGORYIKSA-N	436.350	1.644	50	20	IDGD	
CC(C)(C)OC(=O)NCCCCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2	1793634732	FSAJAVBWZJIVBD-OCVGTWLNSA-N	435.924	1.805	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCn1c(=O)oc2ccccc21	1793982244	JOKVBSJEXPSTFU-QOIOWGMHSA-N	449.935	1.982	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc3nccn3c1)C2	1796892464	FSIQEBYAFCIXGL-MVUGMWCJSA-N	447.499	1.720	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)ccc1F)C2	1796892675	DVVXTAFJJOQVJF-SSJPOKSSSA-N	441.463	1.917	50	20	IDGD	
Cn1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)c(C(F)(F)F)c1	1797155703	XHAWZCYGOCPEKP-MUJYYYPQSA-N	449.238	1.289	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3cccnn3c1)C2	1799279364	LCXUGYAQKBWMIL-QHHYFVSCSA-N	425.316	1.774	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc2c1NC(=O)C2	1800031581	DZURLMQHCNTKFU-VFFTVRQLSA-N	436.306	1.168	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](NC(=O)c1ccccc1)[C@@H](C)O)C2	1800067935	UBTZLLFUYUARJS-FSPSIFDESA-N	435.952	1.821	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c[nH]c3cnccc13)C2	1800642067	UZCXCLRVVHPXIV-RBNVPPIJSA-N	435.322	1.940	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(CO)c(F)c1)C2	1800645364	WRXCTVSAMIKIDL-IVSAIRAKSA-N	443.313	1.695	50	20	IDGD	
COC(=O)C12CC(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@@](C)(Cl)CCl)C4)(C1)C2	1800704740	VYZAMPWGNOLVAD-NKUQNZOUSA-N	433.332	1.156	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CSc1ccncc1)C2	1800757590	QOEFNDZWLUGQRB-JFILPPLUSA-N	428.352	1.547	50	20	IDGD	
COc1cccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Br)C3)c1C	1800822264	RAOUJEFVTBASTF-DACLVMHWSA-N	443.313	1.826	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(F)cc([N+](=O)[O-])c1)C2	1800976978	FEMXCCJVSSVBDY-VZAMPYOESA-N	429.832	1.191	50	20	IDGD	
COc1ccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)Br)C3)cc1F	1801503284	ZQBFNAUBBCVGST-NASWQRNTSA-N	443.313	1.750	50	20	IDGD	
CC[C@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](C)NS(=O)(=O)CC)C2	1801798425	HLIOWXCXBRXOLS-RGDJUOJXSA-N	438.388	1.126	50	20	IDGD	
CC(=O)Nc1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CCC(=O)NN(C)C)ccc1C	1802337799	ARICRHCKWQKEFC-REPLKXPHSA-N	443.548	1.578	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccccc1OC(F)F)C2	1802343458	DJHBTISRHFRJPI-QDMKHBRRSA-N	438.475	1.913	50	20	IDGD	
O=C1CC[C@@H](C(=O)NC[C@@H]2CCN(C(=O)[C@@H](F)Br)[C@H]2c2cccnc2)N1	1806641582	OYMTZNFPSNQDBB-NZBPQXDJSA-N	427.274	1.057	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CCc2ccc[nH]2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807366270	YDXVOWUTSJGUKR-WMZHIEFXSA-N	446.316	1.042	50	20	IDGD	
Cc1c[nH]cc1C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1807375524	PVRYLPUYXRCQHX-GHTZIAJQSA-N	432.289	1.031	50	20	IDGD	
C[C@]1(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)CC1(F)F	1807375617	UGFOQZARIAAKLX-YRISNDGFSA-N	443.259	1.126	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2cc3n(n2)CCNC3=O)[C@H]1c1cccnc1	1808249338	DYXOJHXYULHKFU-VKJFTORMSA-N	444.923	1.359	50	20	IDGD	
O=C(CS(=O)(=O)N1CCCC1)NC[C@@H]1CCN(C(=O)[C@@H](F)Cl)[C@@H]1c1cccnc1	1808414933	VWCWDKBAJNXOMA-USXIJHARSA-N	446.932	1.047	50	20	IDGD	
Cc1cc(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)cn1C	1808723155	CJERJZIPRBXUHF-KNQAVFIVSA-N	446.316	1.042	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)c3c(F)cncc3F)CC2)C1	1809971259	OCSMQZLUCTZIJV-UHFFFAOYSA-N	443.259	1.198	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@H]1CCN(C(=O)Cn2ccccc2=O)[C@@H]1c1cccnc1	1810541500	KMLMRJYFVPANOI-XMSQKQJNSA-N	442.592	1.801	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)CO[Si](C)(C)C)[C@@H]1c1cccnc1	1810548666	RZGBMBUFNQTIPP-UWJYYQICSA-N	449.628	1.312	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)C(C)(C)NCCC#N)sc2C1	1814985344	FLOROUQNWFYLAA-RYUDHWBXSA-N	427.958	1.591	50	20	IDGD	
Cc1ncc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)s1	1817471791	NKXZIWLGASHDMV-MRXNPFEDSA-N	439.306	1.474	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)CN2CCOC2=O)[nH]n1)[C@@H](F)Br	1820932199	YWRMDMYUTCIKEC-GXFFZTMASA-N	432.250	1.545	50	20	IDGD	
C=CCNC(=O)/C=C\C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](F)Br)n[nH]1	1820933748	CRRPVRPYMAUQOO-INIQLVOJSA-N	442.289	1.951	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CNC(=O)c2ccco2)[nH]n1	1822368522	JBTJKVHMEHEFJJ-GXTWGEPZSA-N	437.884	1.679	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)Cc2ccc(O)cn2)[nH]n1	1822416780	PBZKRAYUKWFEGA-KRWDZBQOSA-N	443.508	1.118	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H]2CCNC(=O)C2)n[nH]1	1822483530	DKFNENWSDLRMHL-DMDPSCGWSA-N	426.315	1.711	50	20	IDGD	
CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](F)Cl)[nH]n1	1822701319	FPYPANYDWVWQPU-FMKPAKJESA-N	439.879	1.407	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CN1CCCC1=O)CC2	1822863535	MYPDHOGAPPLXIO-BTDLBPIBSA-N	433.361	1.914	50	20	IDGD	
O=C(CCc1ccoc1)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1822918310	FEUWBCFABRWGNH-IBGZPJMESA-N	436.277	1.621	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@H]1CCc2nc(NC(=O)[C@H]3CCCS3(=O)=O)sc2C1	1824933529	FXILVVGXAFLOLQ-SMDDNHRTSA-N	445.639	1.484	50	20	IDGD	
CCC(=O)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1)CC2	1825087067	BGOMMNALRTYOFZ-BPDROILWSA-N	430.490	1.168	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccnc3c1OCO3)CC2	1826002813	CUEUQJLEYHZAIC-KOLCDFICSA-N	438.893	1.746	50	20	IDGD	
CNc1ccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)cc1	1827051012	KLWJPYYFFFAHQU-HSZRJFAPSA-N	449.360	1.955	50	20	IDGD	
CC(C)c1nc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)no1	1830357811	HDSJNIFHHXJDBZ-FQEVSTJZSA-N	442.944	1.457	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830361853	GWONNEOFBYNBKL-QFIPXVFZSA-N	448.951	1.978	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)c(C)n1C	1830364318	FUQBPBHPGHRRGK-NRFANRHFSA-N	425.957	1.977	50	20	IDGD	
CCc1noc(C)c1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830364708	QZLOMJGSANQBFO-HXUWFJFHSA-N	427.929	1.880	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ncc(F)cc3F)CCO2)C1	1831956358	ASGMKVIUVQKDPT-AUUYWEPGSA-N	431.867	1.837	50	20	IDGD	
COc1cc(F)ccc1C(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)CCl)CC2)CC1	1833312851	ICQGDEHKBAEDSE-SFHVURJKSA-N	441.931	1.619	50	20	IDGD	
C[C@H](C(=O)NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1)n1ccnc1	1833378112	DQGRIGHQWCLWDI-CJNGLKHVSA-N	444.349	1.706	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)Cn3ccccc3=O)CC2)CC1	1833532455	PRTMMTRWWNMPQB-IBGZPJMESA-N	436.984	1.827	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)c3cc(=O)ccn3C)CC2)CC1	1833533853	SRTDZLGWUUYLLE-IBGZPJMESA-N	436.984	1.978	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)nc1	1834379425	XSIWHYIQHWLTQB-YOEHRIQHSA-N	430.274	1.151	50	20	IDGD	
O=C(Cc1noc2ccccc12)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1835983049	IKFSSAUUKYKFBD-IBGZPJMESA-N	442.299	1.630	50	20	IDGD	
CCc1[nH]nc(C(=O)N2CCO[C@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)c1Cl	1836227219	BYTNYORQZMLCDZ-LJQANCHMSA-N	447.363	1.961	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCC(OC2CCN(C(=O)CN3CCNC3=N)CC2)CC1	1836623607	WRTCUSCUNAPJFW-UHFFFAOYSA-N	427.977	1.090	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cc3cccnc3[nH]1)CCO2	1837007633	CHZSEXWOEJJXSJ-NRFANRHFSA-N	446.580	1.484	50	20	IDGD	
Cn1nncc1C(=O)N1CCC(OC2CCN(C(=O)[C@@](C)(Cl)CCl)CC2)CC1	1837231418	NGJZFNOLCOTHLR-SFHVURJKSA-N	432.352	1.664	50	20	IDGD	
Cn1nc(C(=O)N2CCC(OC3CCN(C(=O)[C@H](F)Br)CC3)CC2)cc1O	1837270264	IHSOASFHWBPNLO-HNNXBMFYSA-N	447.305	1.428	50	20	IDGD	
O=C(CCBr)N1CCC(OC2CCN(C(=O)c3c[nH]c(=O)cn3)CC2)CC1	1837654485	RMFUEYCNTZWILC-UHFFFAOYSA-N	441.326	1.167	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc4ncsc4[nH]3)CCO2)C1	1837752758	FEKHROILYQBXLM-KZULUSFZSA-N	426.926	1.712	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3ncn(C(C)C)n3)CC2)CC1	1838148662	LHLQRKQHYFHWAE-QGZVFWFLSA-N	441.960	1.725	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)cc1OC	1838932297	YUSIWMPNJUOYGJ-LJQANCHMSA-N	447.315	1.578	50	20	IDGD	
COc1cc(OC)cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)c1	1838933762	GHBTTZCIAOYGAR-QFBILLFUSA-N	430.860	1.308	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(OC)cc3F)C2)C1	1839147280	MDHZUGLSCGDTHM-JXFKEZNVSA-N	428.888	1.922	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccc4c(c3)CCO4)C2)C1	1839147710	AGNUYGIQISYZJR-AVRDEDQJSA-N	436.936	1.638	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CC3(OC)CCC3)C2)C1	1839967584	QXHWKOKFJZIDCF-DNVCBOLYSA-N	447.370	1.576	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CC[C@@H]3CCOC3)C2)C1	1840035939	AFUHKRZZYLCWFG-HDMKZQKVSA-N	433.343	1.043	50	20	IDGD	
COc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)cc1F	1840187206	MGVNQBBQBPPFGY-SFHVURJKSA-N	435.279	1.708	50	20	IDGD	
Cc1oncc1C(=O)N1CC2(CCCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C1	1841924183	DYRXBPQMPLPUMP-AWEZNQCLSA-N	426.901	1.932	50	20	IDGD	
Cc1ncc(C(=O)N2CC3(CCCN3C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)cn1	1841924297	UGRZBAXVPXOTII-HNNXBMFYSA-N	437.928	1.734	50	20	IDGD	
Cc1c(C(=O)N2CC3(CCCN3C(=O)c3cccc(B(O)O)c3)C2)cccc1C(F)(F)F	1843015294	BENZJNKTQKPIOQ-UHFFFAOYSA-N	446.234	1.824	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)c2cc(Cl)c(F)cc2F)C1	1845299751	ZOUYJODFHSBSJC-UHFFFAOYSA-N	434.635	1.429	50	20	IDGD	
COc1ccc(F)c(C(=O)N2CCCC23CN(C(=O)CCC(=O)NN(C)C)C3)c1OC	1845424288	IVMBCMKQEMWMPC-UHFFFAOYSA-N	436.484	1.033	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H]1CCN1C(=O)OC(C)(C)C	1847957141	BZDZSLVMJZBPDV-RFGFWPKPSA-N	430.343	1.981	50	20	IDGD	
COc1ccc(CN(C)C(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1OC	9789910	CAZOHOCHGYLHFO-UHFFFAOYSA-N	435.506	1.483	50	20	IDGD	
COc1cc(C(=O)NNC(=O)COc2ccccc2F)cc(Cl)c1OCC(N)=O	14320264	YZCPBGXJNBYGJS-UHFFFAOYSA-N	425.800	1.192	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Cn2nnc(-c3ccccc3)n2)cc1Br	14801951	VNUVMLCHQFLVQA-UHFFFAOYSA-N	431.250	1.572	50	20	IDGD	
Cc1ccc([C@@]2(C)NC(=O)N(CC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)C2=O)cc1	17329714	SERDIFJMCXCHEU-HXUWFJFHSA-N	425.401	1.131	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)c2cc(S(=O)(=O)NC3CC3)ccc2C)cc1OC	28078258	VRBDIWCLLGHDDC-UHFFFAOYSA-N	447.513	1.918	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C1CCN(C(=O)Nc2ccccc2)CC1	725741890	VJYWRNUWAADUNI-UHFFFAOYSA-N	429.502	1.569	50	20	IDGD	
Cc1ccc(-c2nnc(S)n2CCC(=O)NNC(=O)CNC(=O)c2cccs2)cc1	725902416	MLDAFUIKFBWHRA-UHFFFAOYSA-N	444.542	1.571	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)Cc1ccc(S(=O)(=O)N2CCCC2)s1	725909199	FIVCNTWLXVVFQL-UHFFFAOYSA-N	447.542	1.492	50	20	IDGD	
Cc1c(C(=O)NNC(=O)NCc2ccco2)nnn1C1CCN(C(=O)OC(C)(C)C)CC1	726160372	BFSIBVLAYCXKKU-UHFFFAOYSA-N	447.496	1.896	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)NCC(=O)N(C)CCc2ccccn2)cc1OC	727480263	HTNCRYNRTAXSAX-UHFFFAOYSA-N	429.477	1.134	50	20	IDGD	
C[C@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)NNC(=O)CCCc2ccccc2)C1=O	727717391	OXLCJFRXNYJKLC-JOCHJYFZSA-N	426.448	1.763	50	20	IDGD	
O=C(CCCc1ccccc1)NNC(=O)NCCNS(=O)(=O)c1cccc(Cl)c1	727841537	RCYSUXFIKFOQRZ-UHFFFAOYSA-N	438.937	1.972	50	20	IDGD	
CCCCC(=O)N1CSC[C@@H]1C(=O)NNC(=O)c1nn(CC)c(=O)c2ccccc12	728018146	HLMGNHKJPILSPJ-OAHLLOKOSA-N	431.518	1.269	50	20	IDGD	
CCOc1ccccc1[C@H](CC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)NC(C)=O	728238743	JDHUNROXEKYNRB-SFHVURJKSA-N	447.513	1.517	50	20	IDGD	
CC(C)C[C@@H](NC(=O)c1ccc(Cl)cc1)C(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1	728370790	CEIIMSRFLTWCHK-DZGCQCFKSA-N	429.926	1.067	50	20	IDGD	
C[C@H](NC(=O)c1n[nH]c2ccccc12)C(=O)OCC(=O)NNC(=O)c1ccc(Cl)cc1	728371354	XNCRCKAABPXPDE-NSHDSACASA-N	443.847	1.339	50	20	IDGD	
O=C(CCNS(=O)(=O)c1c(Cl)cccc1Cl)NNC(=O)Cc1cccnc1	728893831	VXWITBNNXTVXME-UHFFFAOYSA-N	431.301	1.447	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N[C@@H](C)[C@H](C)N1CCOCC1	729623061	FTIRFADONNORKG-IHRRRGAJSA-N	443.342	1.656	50	20	IDGD	
CCN1CCC[C@@H]1CN1C[C@H](C(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)CC1=O	729626372	CZLGNFNYPAZTHA-GUDVDZBRSA-N	430.549	1.551	50	20	IDGD	
CC(=O)Nc1cc(F)c(S(=O)(=O)NNC(=O)c2ccc3c(c2)OCO3)cc1Cl	729662397	MSAJIXKSKAJJJG-UHFFFAOYSA-N	429.813	1.790	50	20	IDGD	
Cc1nnnn1/C(=C\c1ccccc1)C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	730077404	WSANVXIKVWLSQQ-UYRXBGFRSA-N	439.501	1.564	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)c1ccccc1NS(=O)(=O)C(F)(F)F	730095321	AWULGLNWOZFUFT-CQSZACIVSA-N	445.375	1.549	50	20	IDGD	
NC(=O)[C@@H]1CCCN(Cc2cccc(CNC(=O)NNC(=O)c3ccccc3O)c2)C1	731116622	CNLQNYIWTYHDDS-QGZVFWFLSA-N	425.489	1.234	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)c2cc(C(N)=O)n(-c3ccccc3)n2)cc1	731958559	SKFWBIIBNLZHQE-AWEZNQCLSA-N	437.456	1.598	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc2c(c1)nc(CCC(=O)NNC(=O)C1CCC1)n2C	732142770	JXZYJMIZICTRAV-UHFFFAOYSA-N	435.550	1.484	50	20	IDGD	
Cc1c(C(=O)NNC(=O)CCN2C[C@@H](C)O[C@H](C)C2)nnn1-c1cccc2cnccc12	732260124	BAJAXGUQXPBFTM-HUUCEWRRSA-N	437.504	1.384	50	20	IDGD	
COc1cc(Br)c(/C=C(/C#N)C(=O)c2c(N)n(C)c(=O)n(C)c2=O)cc1OC	732578182	IUEGRRQXIYVFBW-YHYXMXQVSA-N	449.261	1.236	50	20	IDGD	
O=C(NN=C1CCC(O)(C(F)(F)F)CC1)c1cccc(S(=O)(=O)N2CCOCC2)c1	734744136	BLYXEHZENYDNHS-UHFFFAOYSA-N	449.451	1.661	50	20	IDGD	
O=C(Cn1nnc(C2(NC(=O)c3ccccc3)CCCC2)n1)NNC(=O)c1ccccc1	734982217	PASDNIZDTXTLDH-UHFFFAOYSA-N	433.472	1.334	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)[C@H]2CCCc3ccccc32)CC1	735117721	HAJHXRQGBZAQTQ-SFHVURJKSA-N	429.546	1.581	50	20	IDGD	
CC(=O)NC[C@@H]1CN(C(=O)/C(C#N)=C/c2cn(CCC#N)nc2-c2ccccc2)CCO1	735476867	UNNXMKXPCRJKNV-PRWBYUBPSA-N	432.484	1.734	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)N2C[C@@H](C)C[C@H](C)C2)c1	739667536	PMKRPVRFBWNMAL-GJZGRUSLSA-N	446.595	1.174	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)c1cc(S(=O)(=O)N(C)C(C)C)ccc1Cl	740852103	KSBPCRHXGVWASD-UHFFFAOYSA-N	446.957	1.435	50	20	IDGD	
CC(C)[C@H](C(=O)OCC(=O)NNC(=O)c1ccc(Cl)cc1)N1C[C@@H](C)O[C@H](C)C1	741027192	QTKANIYBBZWORE-HBUWYVDXSA-N	425.913	1.778	50	20	IDGD	
Cn1cc(-c2cccc(C(=O)NNC(=O)c3ccc(Cl)c(S(N)(=O)=O)c3)c2)cn1	741663112	XMSGLHZNIVOLNW-UHFFFAOYSA-N	433.877	1.463	50	20	IDGD	
COc1ccc(CN2CC[C@H](NC(=O)NNC(=O)Nc3ccc(N(C)C)cc3)C2=O)cc1	743616666	MFUNHJICVUGCBU-IBGZPJMESA-N	440.504	1.898	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])o2)c1	745029489	OWIDRGJISGAURG-AWEZNQCLSA-N	444.400	1.105	50	20	IDGD	
N#CCCn1cc(/C=C(\C#N)C(=O)NCCN2CCCS2(=O)=O)c(-c2ccccc2)n1	747202201	ISHYGQODYQKFFR-NBVRZTHBSA-N	438.513	1.522	50	20	IDGD	
COc1cc(S(=O)(=O)NNC(=O)c2ccc(Cl)cc2F)cc(C(=O)O)c1OC	747618802	WMNKJNOQOCWUTJ-UHFFFAOYSA-N	432.813	1.818	50	20	IDGD	
CCCCCCNC(=O)[C@@H]1CCCN(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)C1	748329026	OPBFDRMCAPANGQ-QGZVFWFLSA-N	442.524	1.425	50	20	IDGD	
Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)NNC(=O)c1csc(N2CCOCC2)n1	748640952	PSHPYRCSSOGFOH-UHFFFAOYSA-N	441.491	1.128	50	20	IDGD	
NS(=O)(=O)c1ccc(NCCC(=O)NNc2ccc(OC(F)F)cc2)c([N+](=O)[O-])c1	748658975	BMMWTXOKGVOAHW-UHFFFAOYSA-N	445.404	1.789	50	20	IDGD	
Cc1cc(Br)ccc1NNC(=O)Cn1cc(Br)c(O)nc1=O	748743595	IFCXUWZGDKZJKF-UHFFFAOYSA-N	432.072	1.926	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)NCC(=O)N1CCN(c2ccc(Cl)cc2)CC1	750335369	NLWUMJZDJIHLMC-UHFFFAOYSA-N	447.898	1.701	50	20	IDGD	
CC(C)N1C[C@@H](NC(=O)NNC(=O)COc2ccc(OCc3ccccc3)cc2)CC1=O	750643625	JERKBCDUKIKYGE-SFHVURJKSA-N	440.500	1.984	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)N[C@H]2CC(=O)N(C3CC3)C2)c2ccccc2c1=O	750653626	XNFRRFKWPXREJS-AWEZNQCLSA-N	440.504	1.294	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CSc2nnc3n(C)c4ccccc4n23)cc1OC	751139781	OSLUGSDGABAZAZ-UHFFFAOYSA-N	440.485	1.792	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)C1CCN(C(=O)CCc2ccccc2)CC1	751202719	WBSMQILSUYKYKZ-UHFFFAOYSA-N	426.473	1.028	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)c1cc(Cn2cc(Br)cn2)on1	751562986	MXGPIZPZDOOJQA-UHFFFAOYSA-N	444.249	1.713	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)c1ccc(S(C)(=O)=O)cc1	753427265	DGFDUOFORGVTSK-GFCCVEGCSA-N	439.515	1.450	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)N[C@@H]1[C@H]2CCO[C@@H]2C12CCCC2	754837691	BCYDAMYCANQFNV-BMFZPTHFSA-N	435.550	1.580	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@@H](C)[C@H](C)NC(=O)OC(C)(C)C)c2ccccc2c1=O	755312488	LAPXXSLIFZHJLA-STQMWFEESA-N	431.493	1.727	50	20	IDGD	
CCc1c(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cnn1CC(C)C	755411481	RDTDIFQPDKBLBC-UHFFFAOYSA-N	427.914	1.477	50	20	IDGD	
CN(C)c1ccc(S(=O)(=O)N2CCCCC2)cc1NC(=O)NNC(=O)Cc1cc[nH]n1	755434040	DQZTXVBFWTWGEG-UHFFFAOYSA-N	449.537	1.046	50	20	IDGD	
CCCc1nnc(NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)s1	755471363	MZKKXSJFWIHWKD-UHFFFAOYSA-N	438.535	1.742	50	20	IDGD	
COc1ccc(C(=O)NN=Cc2cc(OC)c(OCC(=O)O)cc2[N+](=O)[O-])cc1OC	755481727	RRAPMQZZDJJMEG-UHFFFAOYSA-N	433.373	1.848	50	20	IDGD	
COC(=O)c1cc(NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c(F)cc1F	755849266	IJCJKZLVFRVMEV-UHFFFAOYSA-N	427.385	1.621	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccc([N+](=O)[O-])c(Cl)c2)c1	756334854	TZYIERXJEKYGEA-UHFFFAOYSA-N	441.853	1.965	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1N1CCOC1=O	756849325	XTQCVXBTCMNNEY-UHFFFAOYSA-N	432.458	1.822	50	20	IDGD	
Cc1cc(C(=O)N2CCOCC2)ccc1NC(=O)NNC(=O)c1c(C)nc2ccccn12	757828998	AYUIJQCJFFKZRW-UHFFFAOYSA-N	436.472	1.890	50	20	IDGD	
O=C(/C=C/c1ccc(Cl)nc1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	758044699	XZIZFQRODOGDBT-VQHVLOKHSA-N	434.905	1.994	50	20	IDGD	
O=C([C@H]1CC(=O)N(c2ccc(F)cc2)C1)N1CCN(S(=O)(=O)CBr)CC1	758536431	WDYYWYOKGCRSEQ-LBPRGKRZSA-N	448.314	1.005	50	20	IDGD	
CCn1c(=O)n(CC)c2nc(NC(=O)CCC(=O)NNC(=O)CCc3ccco3)ccc21	761154973	JMGJMUVCYMVJRL-UHFFFAOYSA-N	442.476	1.330	50	20	IDGD	
O=C(CN1CCN(c2nc3ccccc3s2)CC1)NNC(=O)c1ccc([N+](=O)[O-])cc1	762266066	JUGKUKIXRVIPOF-UHFFFAOYSA-N	440.485	1.788	50	20	IDGD	
COc1cccc(C(=O)NNS(=O)(=O)c2cc(Br)cc(C(=O)O)c2)c1O	762471986	LPEKLLGVEKRNIQ-UHFFFAOYSA-N	445.247	1.485	50	20	IDGD	
COc1ccc(Cl)cc1N1C[C@@H](C(=O)NNc2nccc(N3CCOCC3)n2)CC1=O	762857027	QKKHWEWGCMKPPE-ZDUSSCGKSA-N	446.895	1.471	50	20	IDGD	
CCc1c(C(=O)NNc2nccc(N3CCOCC3)n2)nnn1-c1cccc(Cl)c1	762861888	RNRNCMBYNVQSBY-UHFFFAOYSA-N	428.884	1.867	50	20	IDGD	
CCOC(=O)c1cnn2c(C(=O)NNC(=O)C3=S=C4CCCCCC4=C3)ccnc12	763270682	TULCUTOQSOBESI-UHFFFAOYSA-N	427.486	1.649	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccccc1OCC(F)(F)F	763443282	ZXEHVOVCJOZXKJ-UHFFFAOYSA-N	426.307	1.936	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1cccc(C(=O)N2CCCCC2)c1	763467126	PAUGBBUNINMQHH-UHFFFAOYSA-N	439.428	1.621	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)N[C@H]1CCN(Cc2ccccc2)C1=O	763486424	LIAKSKAUSSYXQW-INIZCTEOSA-N	433.509	1.423	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)Nc1ccc(Oc2ccccn2)cc1	763570004	CZWWUXXEUXCKOM-SFHVURJKSA-N	434.408	1.800	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(S(=O)(=O)C[C@H]3CCCO3)cc2)c(C)o1	763577255	ULIFBNNWKBZWBX-OAHLLOKOSA-N	449.485	1.249	50	20	IDGD	
N#C/C(=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)OCC1(CO)COC1	763606993	NBQJYMYYRPLUII-CHHVJCJISA-N	444.875	1.538	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1ccn([C@@H](C)c2ccccc2)n1	763625420	QVUZJCLRJJSXOX-HNNXBMFYSA-N	431.456	1.848	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(N(C)C(C)C)c(F)c1	763664579	YFJJRZUAOFZEHA-UHFFFAOYSA-N	432.452	1.844	50	20	IDGD	
CCc1noc(-c2ccc(C)c(NC(=O)C(=O)NNC(=O)COc3ccc(C#N)cc3)c2)n1	763678954	JWFWDUARNIIEOS-UHFFFAOYSA-N	448.439	1.644	50	20	IDGD	
CCN1CCC(n2nccc2NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)CC1	763694855	LQRDONIWFGQDPG-UHFFFAOYSA-N	448.911	1.358	50	20	IDGD	
COc1ccc(OC(F)F)c(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)c1	763727260	APVDTACMZZPXBX-UHFFFAOYSA-N	448.426	1.835	50	20	IDGD	
Cc1cccc(NC(=O)C(=O)NNC(=O)c2cccc(N(C)C)c2)c1C(=O)N1CCCC1	763754450	RCEQJXMVKARBND-UHFFFAOYSA-N	437.500	1.697	50	20	IDGD	
Cc1c(Br)cccc1NC(=O)C(=O)NNC(=O)COc1ccccc1C#N	763808829	RIRTUCQKBBDBOL-UHFFFAOYSA-N	431.246	1.794	50	20	IDGD	
COC(=O)CCc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)cc1	763871027	CIOSAXLLFWEORK-ZDUSSCGKSA-N	431.420	1.485	50	20	IDGD	
Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)C(=O)NNC(=O)CC(C)C	763881127	FEHSKRIQPWRHKF-SFHVURJKSA-N	426.521	1.771	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)cc1NS(C)(=O)=O	763974679	VSAUIRPFHFQJHJ-UHFFFAOYSA-N	440.865	1.125	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)on2)ccc1N1CCOCC1	764016788	NVHYBFUIKFWGGH-UHFFFAOYSA-N	449.467	1.886	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc(NC(=O)[C@H]2CCCO2)cc1	764043175	PXHOYSLHNLIWCV-QGZVFWFLSA-N	426.429	1.212	50	20	IDGD	
CC(C)(C)c1nnc(NC(=O)C(=O)NNC(=O)c2cccc(Br)c2)s1	764063259	MHPAPUBYTMZJRV-UHFFFAOYSA-N	426.296	1.998	50	20	IDGD	
Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)C(=O)NNC(=O)C1CCCC1	764066159	IPMUFEKUYCJEKN-IBGZPJMESA-N	438.532	1.915	50	20	IDGD	
CC[C@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(NC(=O)[C@@H]2CCCO2)cc1C(F)(F)F	764082387	NKAACIMJWOWWSX-HZMBPMFUSA-N	444.410	1.955	50	20	IDGD	
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC(=O)C(=O)NNC(=O)Cc2cc[nH]n2)cc1	764292511	CFMJRZRBPMAJHC-LBPRGKRZSA-N	430.465	1.324	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)COC3)cc1Br	764326455	JCQSIPQWKMLKOY-UHFFFAOYSA-N	434.246	1.888	50	20	IDGD	
CS(=O)(=O)c1nc(C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)c2ccccn12	764329635	ZXEPCSVMVXVSDE-UHFFFAOYSA-N	449.439	1.665	50	20	IDGD	
CS(=O)(=O)CCc1ccc(NC(=O)C(=O)NNC(=O)c2cc3ccccc3o2)cc1	764340958	BFHXLHQNJVFNLD-UHFFFAOYSA-N	429.454	1.420	50	20	IDGD	
CN(C)C(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)ccc1F	764377955	UCPUIMUECGNHLO-UHFFFAOYSA-N	444.448	1.379	50	20	IDGD	
Cc1ccc(-c2ccc(C=NNC(=O)Cn3cnc4c3c(=O)n(C)c(=O)n4C)s2)cc1	764812717	PSCPAJRFUCVCKR-UHFFFAOYSA-N	436.497	1.621	50	20	IDGD	
O=C(CCNC(=O)N1CCc2ccccc2C1)NNC(=O)CSc1ccccc1O	765248430	RTWXZGCPMNHMGK-UHFFFAOYSA-N	428.514	1.790	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccccc1Cl)NNC(=O)CSc1ccccc1O	765402931	KQGIKZIXAXPHBQ-UHFFFAOYSA-N	443.934	1.654	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C[C@@H](NC(N)=O)c2cccs2)n[nH]1	765601689	SBDWFYNWWJVKNT-CYBMUJFWSA-N	428.474	1.708	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1ccnn1Cc1cccc(Br)c1	766269806	FGQSVPPKFOYEEL-UHFFFAOYSA-N	446.265	1.574	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2ccc(N3C(=O)CCC3=O)c([N+](=O)[O-])c2)cc1OC	766322912	GAKNFFPIPDJQBX-UHFFFAOYSA-N	442.384	1.340	50	20	IDGD	
Cc1ccn2ncc(C(=O)NNC(=O)c3ccc(S(=O)(=O)N4CCCC4)cc3)c2c1	766836965	ARTDKUZLHIUCBG-UHFFFAOYSA-N	427.486	1.502	50	20	IDGD	
Cc1cc(C)n2nc(C(=O)NNC(=O)[C@@H](C)Oc3cccc(Br)c3)nc2n1	769421530	VZJJWRRAHCQIIK-LLVKDONJSA-N	433.266	1.732	50	20	IDGD	
Cc1ccc(C(=O)NNS(=O)(=O)c2sc(C(=O)O)cc2Br)c(O)c1	769626128	QIBOOJRXLUAJNS-UHFFFAOYSA-N	435.277	1.846	50	20	IDGD	
Cc1cc(Br)ccc1S(=O)(=O)NNC(=O)[C@@H]1COc2ccccc2O1	769862083	HZTWSTLSSJARQS-AWEZNQCLSA-N	427.276	1.907	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)c1ccc(Br)c(S(C)(=O)=O)c1	772066541	WQGNYPZHGZKZRM-SNVBAGLBSA-N	449.323	1.591	50	20	IDGD	
Cc1cccc(N2C(=O)N[C@@H](CCC(=O)O[C@H](C)C(=O)NNC(=O)CC(C)C)C2=O)c1	772095394	CFTIIZAPDLJJKT-ZBFHGGJFSA-N	432.477	1.325	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)c1cccc([C@]2(C)NC(=O)NC2=O)c1	772965347	XFVQIAAHAVEBDP-YBTHPKLGSA-N	430.848	1.623	50	20	IDGD	
O=C(NNC(=O)N1CC[C@@H]2[C@@H](CCCN2C2CC2)C1)C1CCN(c2ncccn2)CC1	773006480	UHJCOAVUNLFYPD-PKOBYXMFSA-N	427.553	1.383	50	20	IDGD	
Cc1ccc([C@](O)(CC(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)C(F)(F)F)o1	773389730	IJRGLHIYEAEPSV-MRXNPFEDSA-N	438.403	1.583	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cn(C)nc2C(F)(F)F)c1C	773528675	PTFXNUUTHNDMHR-LLVKDONJSA-N	427.383	1.609	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(NC(=O)C(=O)NNc2ncccn2)ccc1Cl	773718060	AOWXSAQTBUPIHI-UHFFFAOYSA-N	426.886	1.242	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2ccc(N3CCOCC3)cc2C(F)(F)F)n1	773731604	SEIJMJWMXPTQSU-UHFFFAOYSA-N	440.382	1.422	50	20	IDGD	
CN(C)CC(=O)NNC(=O)Nc1ccc(I)cc1Br	775663388	RAZOOMSREOYOQT-UHFFFAOYSA-N	441.067	1.768	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)N[C@@H](c1ccc(C(C)(C)C)cc1)C(F)(F)F	775953845	BBWZTOOTPNXDTE-GWCFXTLKSA-N	438.472	1.856	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)N[C@@H]3CCO[C@@]4(CCS(=O)(=O)C4)C3)cc2C1	776077006	PQUUKQWCLUREND-TVZGQMOCSA-N	441.575	1.553	50	20	IDGD	
C[C@]1(NNC(=O)N[C@@H]2CCN(c3ccccc3C(F)(F)F)C2=O)CCS(=O)(=O)C1	776183780	WCOLJOYLVVXJMQ-WBMJQRKESA-N	434.440	1.192	50	20	IDGD	
COc1ccc(Cn2cc(C(=O)OCC(=O)NNC(=O)c3ccccc3)cn2)cc1OC	778462833	KWVOIJFMEXCAQY-UHFFFAOYSA-N	438.440	1.567	50	20	IDGD	
CN(C)C(=O)COc1ccccc1C(F)(F)C(=O)NNC(=O)[C@H]1COc2ccccc2O1	778523872	HYWWCEWRVBNFQA-QGZVFWFLSA-N	449.410	1.233	50	20	IDGD	
COCCN1C(=O)CCc2cc(NC(=O)C(=O)NNC(=O)c3cccc(Cl)c3)ccc21	778707758	XBHBFWDKJLNOTO-UHFFFAOYSA-N	444.875	1.665	50	20	IDGD	
O=C(NNS(=O)(=O)c1cnc(-c2ccccc2)nc1)c1csc(N2CCOCC2)n1	780365978	IDWFKAKXJFBVRS-UHFFFAOYSA-N	446.514	1.060	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)[C@@H]2CN(Cc3nc(O)c4ccccc4n3)CCO2)c1	780792632	MSBOYCOFLHYDET-SFHVURJKSA-N	437.456	1.466	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NN=CC(C)(C)N2C(=O)c3ccccc3C2=O)c1	782132627	FOFAYPBIUFEDOU-UHFFFAOYSA-N	442.497	1.727	50	20	IDGD	
CCOc1ccc(/C=C(/C#N)C(=O)O[C@H](C(=O)N[C@@H]2CCS(=O)(=O)C2)C(C)C)cc1	782452187	ZXTIAPHVJPXDPF-YOZJQLQOSA-N	434.514	1.863	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ncnc3ccsc23)cc1-n1nnnc1C	783263887	ZJZXVXXNCSWDDK-UHFFFAOYSA-N	425.434	1.066	50	20	IDGD	
CN1CCCN(c2ccc(NC(=O)C(=O)NN=c3sc4ccccc4n3C)cc2)CC1	783351477	GZTLCACJBSODND-UHFFFAOYSA-N	438.557	1.952	50	20	IDGD	
COC[C@H](C)NS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2cc(C)ccc2C)cc1	783366319	BDDMGGKATJFNCC-HNNXBMFYSA-N	434.518	1.698	50	20	IDGD	
Cc1coc(-c2ccc(C)c(NC(=O)C(=O)NNC(=O)CNC(=O)c3cccs3)c2)n1	784003956	AWLONENIPPTAGI-UHFFFAOYSA-N	441.469	1.536	50	20	IDGD	
CCOc1cc(C)ccc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	784217075	UBYUWVZSAIEPJZ-UHFFFAOYSA-N	432.502	1.916	50	20	IDGD	
CN(c1ccccc1NC(=O)C(=O)NNc1ccc(Br)cn1)S(C)(=O)=O	784339618	OEMMBFJJOCBPTF-UHFFFAOYSA-N	442.295	1.322	50	20	IDGD	
COc1ccc(C(=O)CCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c(OC)c1OC	784583996	BFRREPJJUPGBSG-SFHVURJKSA-N	444.440	1.663	50	20	IDGD	
COC(=O)[C@H]1CCCCN1C(=O)c1cccc(NC(=O)C(=O)NNc2ccnc(F)c2)c1	784848690	LYHKFTPGKXKKGF-MRXNPFEDSA-N	443.435	1.470	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)C(=O)Nc2ccc(NC(=O)[C@H]3CCCO3)cc2)c1	784850863	CUQKWCSNAOJOQW-QGZVFWFLSA-N	426.429	1.673	50	20	IDGD	
COc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)C(=O)NNc1cc(Cl)ccn1	784861268	SRWUJFMDKCFGTM-UHFFFAOYSA-N	427.870	1.076	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNc2ncc(F)cn2)c(Br)cc1F	784950502	RJOJQHHHNKWUFB-UHFFFAOYSA-N	430.165	1.386	50	20	IDGD	
CN(C)c1nccc(NNC(=O)C(=O)Nc2ccc(C(=O)N3CCc4ccccc43)cc2)n1	784970819	OBHWBHRXZRCKSU-UHFFFAOYSA-N	445.483	1.827	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1nnn(Cc2ccc(C(F)(F)F)cc2)c1C	787150559	RRYWDSHFDUMMTI-NSHDSACASA-N	427.383	1.756	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)c3cc([C@@H]4CCN(C(=O)OC(C)(C)C)C4)[nH]n3)nc21	787358836	KUSQDXVBKZDABB-SNVBAGLBSA-N	443.468	1.273	50	20	IDGD	
Cn1nc(-c2ccsc2)cc1NC(=O)C(=O)NNC(=O)c1cc(-c2cccs2)[nH]n1	787549242	ITQQGGRCDMKUEO-UHFFFAOYSA-N	441.498	2.000	50	20	IDGD	
O=C(CN1C(=O)COc2ccc([N+](=O)[O-])cc21)NNC(=O)c1cc2ccccc2cc1O	792516979	RZJUYEDANAOWOE-UHFFFAOYSA-N	436.380	1.640	50	20	IDGD	
CN(C)N(C(=O)c1nn(-c2cc(Cl)ccc2[N+](=O)[O-])cc1O)[C@@H]1CCS(=O)(=O)C1	792856424	YJMQYYWAJQCJPV-LLVKDONJSA-N	443.869	1.245	50	20	IDGD	
Cc1cc(C(=O)NNC(=S)NC(C)(C)C)c(C)n1Cc1ccc(S(N)(=O)=O)cc1	793276118	SPANGWANCKMDIZ-UHFFFAOYSA-N	437.591	1.708	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CN2C(=O)C(F)(F)Oc3ccccc32)cc1C	794199594	HIZVZKOIEUCFST-UHFFFAOYSA-N	432.383	1.408	50	20	IDGD	
CNS(=O)(=O)N1CCC(C(=O)NNC(=O)COc2ccccc2-c2ccccc2)CC1	794763492	FVXZGZPNBAMHNQ-UHFFFAOYSA-N	446.529	1.056	50	20	IDGD	
CN(C)c1c(Cl)cccc1NC(=O)C(=O)NNC(=O)CNC(=O)OCc1ccccc1	797368887	ILGZCIUQOMKGIW-UHFFFAOYSA-N	447.879	1.418	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)c(C)c(OC)c1	800626205	AHIBJJGMGRXXEA-UHFFFAOYSA-N	425.445	1.228	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)C2(S(=O)(=O)c3ccccc3)CC2)cc1	802067979	UGZWHTFATVQKIJ-UHFFFAOYSA-N	437.499	1.249	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NC[C@@H]2CC(c3ccc4c(c3)CCO4)=NO2)cc1OC	802334842	PMJVWPNSWIXLRX-INIZCTEOSA-N	440.456	1.776	50	20	IDGD	
COc1ccc(C2=NO[C@H](CNC(=O)NNC(=O)COc3ccc(C#N)cc3)C2)cc1F	802348084	OOPPXEACHKTZBM-INIZCTEOSA-N	441.419	1.608	50	20	IDGD	
COc1ccc(NNC(=O)C2(S(C)(=O)=O)CCN(C(=O)OC(C)(C)C)CC2)nc1	803150120	BXHKKSDOTFHABA-UHFFFAOYSA-N	428.511	1.348	50	20	IDGD	
CC(C)[C@H](NS(=O)(=O)c1ccc2c(c1)OCCCO2)C(=O)NNc1ncccc1F	804216470	GAIGTRZWQMFFFS-KRWDZBQOSA-N	438.481	1.828	50	20	IDGD	
CS(=O)(=O)CCOc1ccc(Cl)cc1NC(=O)C(=O)NNc1cccc(F)n1	807391119	GJZQVIHCFUAYDW-UHFFFAOYSA-N	430.845	1.379	50	20	IDGD	
COc1ccc(S(=O)(=O)NCC(=O)NNC(=O)C(C)(C)c2ccccc2)cc1OC	810372025	WTZRLHYFNNUKAS-UHFFFAOYSA-N	435.502	1.107	50	20	IDGD	
N#Cc1ncn(-c2ccccc2NC(=O)C(=O)NNC(=O)Cc2ccc3ccccc3c2)n1	810384170	GHICFOVIXKJLGD-UHFFFAOYSA-N	439.435	1.621	50	20	IDGD	
O=C(NNC(=O)c1sc2ccccc2c1Br)N[C@@H]1CCS(=O)(=O)C1	810580851	IJCXQOROJBUUSV-MRVPVSSYSA-N	432.321	1.795	50	20	IDGD	
O=C(CCOc1ccccc1)NNS(=O)(=O)CCCN1C(=O)c2ccccc2C1=O	811684027	RJQOPVOTRLIOQX-UHFFFAOYSA-N	431.470	1.092	50	20	IDGD	
CCS(=O)(=O)c1c(Cl)cccc1C=NNC(=O)Nc1ccc(S(N)(=O)=O)cc1	814965346	MKWHOLJARNJLMF-UHFFFAOYSA-N	444.922	1.937	50	20	IDGD	
CNC(=O)Oc1cccc(NC(=O)C(=O)NNC(=O)CSc2ccc(Cl)cc2)c1	815565631	VOMBBTKZPODCCO-UHFFFAOYSA-N	436.877	1.936	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2ccn(-c3ccc(Br)cc3)n2)n1	815574384	NXQRLBVUAVIHAP-UHFFFAOYSA-N	432.238	1.515	50	20	IDGD	
CCCOc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2CCc3nncn3C2)cc1OCCC	815691375	OHHOQKCIPHNZDE-AWEZNQCLSA-N	444.492	1.204	50	20	IDGD	
CS(=O)(=O)C1(C(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)CCOCC1	815854381	ZRJOPXQEIBPDBB-UHFFFAOYSA-N	430.426	1.017	50	20	IDGD	
CCc1ccc(C#CC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)cc1	815854903	VTZLDOQPNXYBNY-UHFFFAOYSA-N	426.542	1.680	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)c2sccc2S(=O)(=O)N2CCCC2)nc2ccccc21	822780696	QZDZRVYSPWBGFQ-UHFFFAOYSA-N	447.542	1.423	50	20	IDGD	
CN(c1ccccc1)c1ccc(C=NNC(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)cc1	867655619	ZEIHAJDNHJSSFK-UHFFFAOYSA-N	445.483	1.352	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2ccc(F)cc2C)c1	873920325	NMUKYEFYMMWBOO-UHFFFAOYSA-N	443.522	1.788	50	20	IDGD	
CCn1c(NNC(=O)c2cnc3c(c2)c(O)nc(=O)n3C2CC2)nc2ccccc2c1=O	901557204	LNMFOSJIWGSRTJ-UHFFFAOYSA-N	433.428	1.319	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CN(C)[C@@H]2CCS(=O)(=O)C2)ccc1OCCC(C)C	914531805	FTZXTCYULJDREA-MRXNPFEDSA-N	441.550	1.000	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)CNS(=O)(=O)c2cccc(Br)c2)cc1	915782627	DTHBVQQUDCCINH-UHFFFAOYSA-N	440.319	1.751	50	20	IDGD	
CNS(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2cc3c(s2)CC[C@H](C)C3)s1	916231975	BLZIEHMKSIELST-JTQLQIEISA-N	442.588	1.987	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCCNC(=O)NNC(=O)COc2ccc(C)c(C)c2)cc1	916278424	OVCSIGNKJKCJND-UHFFFAOYSA-N	434.518	1.300	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)NCc2ccc(S(=O)(=O)N(C)C)cc2)c1C	916646708	JILXTTWFLPZWTJ-INIZCTEOSA-N	448.545	1.852	50	20	IDGD	
CSCC[C@H](NC(=O)c1ccccc1)C(=O)NNC(=O)CCN1C[C@H](C)O[C@H](C)C1	917362875	PPFGXNIUCYHYLZ-JZXOWHBKSA-N	436.578	1.185	50	20	IDGD	
O=C(NNC(=O)c1cc(F)cc2nccnc12)c1ccc(S(=O)(=O)N2CCCC2)cc1	917522192	DKSFEJHPLVBJJQ-UHFFFAOYSA-N	443.460	1.628	50	20	IDGD	
COC1(C(=O)NNC(=O)COc2ccc(F)cc2)CCN(C(=O)OC(C)(C)C)CC1	917916421	IQWRSEFOYWHZNM-UHFFFAOYSA-N	425.457	1.768	50	20	IDGD	
CCNC(=O)COc1cccc(CNC(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)c1	918091519	WGINNYYTIONARW-AWEZNQCLSA-N	432.452	1.639	50	20	IDGD	
O=C(NCc1cccc(CN2CCOCC2)c1)NNC(=O)c1cc(Br)c[nH]1	918224622	WUMMVKSPECZTSN-UHFFFAOYSA-N	436.310	1.754	50	20	IDGD	
Cc1nc(Cc2ccc(F)cc2)sc1C(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1	919887299	ZMNFZXDEXZKCNV-CYBMUJFWSA-N	426.495	1.313	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)cc1	1320299790	TXZLAVAQRCXKJW-UHFFFAOYSA-N	427.505	1.470	50	20	IDGD	
COc1ccc(Cl)cc1CCNC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	1338957030	AUPWDQNOIPFVRM-UHFFFAOYSA-N	425.894	1.939	50	20	IDGD	
COc1ccc(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](F)Cl)C2)cc1O	1778022437	KHCRFPPWPGEYQG-YVWKXTFCSA-N	428.888	1.992	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](F)Cl)C2)C1	1778026325	RVZJMWMTLUGRRM-STXHMFSFSA-N	447.935	1.902	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)[C@@H]2SC(=N)NC2=O)C1	1778085131	RHGNYYYDRWTAJM-IFICMAFDSA-N	444.985	1.320	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@]3(F)CCCCC3(F)F)C2)C1	1778222929	MQVKZNCIKNCEQE-IAOVAPTHSA-N	426.863	1.988	50	20	IDGD	
Cc1nc[nH]c1CSCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2	1778913875	UOWVPCMATOSRHH-PXAZEXFGSA-N	445.383	1.565	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CC[C@]3(CN(C(=O)CCBr)CCO3)C2)o1	1779025065	RKKDOWRFZONUPB-KRWDZBQOSA-N	428.283	1.467	50	20	IDGD	
O=C(CS[C@@H]1CCCCO1)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1779083435	SYUXBZXWDHHORR-IJEWVQPXSA-N	439.347	1.767	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cn3ccsc3n2)C1	1779093334	VZJBQLGJZVEKNP-ZXYWRSMDSA-N	440.953	1.777	50	20	IDGD	
Cn1nc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CO[Si](C)(C)C)C2)c2c1CCC2	1779543943	GCEBVLWNEIILGV-XMSQKQJNSA-N	448.640	1.888	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cc(S(C)(=O)=O)ccc3F)CCO2)C1	1781219941	SSMXFFHPLKZANF-DNVCBOLYSA-N	446.928	1.690	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCn1ccnn1)C2	1781904301	NPUYVYAGPJRGOT-HDMKZQKVSA-N	442.358	1.356	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cn1ccnc1C)C2	1781905267	MPNMUAQMFCYKOZ-FRQCXROJSA-N	441.370	1.879	50	20	IDGD	
COc1cc(CCC(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](C)Br)C3)C2)ccn1	1783530270	WGTMRQQIQBKCNI-LIRRHRJNSA-N	440.338	1.636	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)C#CC3(O)CCCCC3)CCO2)C1	1783533715	GDZCRKRVYNOOFH-DNVCBOLYSA-N	427.339	1.298	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3n[nH]c4c(F)cccc34)CCO2)C1	1783533724	GFDODHSFEIYUTF-VOJFVSQTSA-N	439.285	1.929	50	20	IDGD	
COc1nc(C)ccc1C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](C)Br)C2)C1	1783535560	AAZHRBHJKDGAMP-ACJLOTCBSA-N	426.311	1.626	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ncn(C)c3C(F)(F)F)CCO2)C1	1783876083	URVOHELUOFEIOR-BZNIZROVSA-N	438.834	1.136	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](O)c3ccccc3Cl)C2)C1	1784251682	OQBZVURQUGTNPF-WBHUJUFNSA-N	445.741	1.987	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3c(F)ccnc3Cl)[C@H]2C1	1785483515	YVAZWZZUIZGZIC-MNXVOIDGSA-N	434.295	1.721	50	20	IDGD	
CN(C)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CO[Si](C)(C)C)C[C@@H]21	1785758321	VCQDNVWNOVMCRF-IEZWGBDMSA-N	434.613	1.592	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3ccc4c(c3)OCO4)[C@H]2C1	1786597916	XXKOAAFGRFMDJW-FPXQBCRKSA-N	438.908	1.191	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1)C(=O)c1ccco1	1786754390	QHMDTSGVPQYTMN-UHFFFAOYSA-N	432.241	1.590	50	20	IDGD	
Cc1ccn(CC(=O)Nc2ccc(C3(NC(=O)CCC(=O)NN(C)C)CCC3)cc2)n1	1786920019	JWWFPGMJCOUCEB-UHFFFAOYSA-N	426.521	1.699	50	20	IDGD	
Cc1cc(C(=O)Nc2ccc(C3(NC(=O)CCC(=O)NN(C)C)CCC3)cc2)nn1C	1787355981	QMBQFLYDSKVRER-UHFFFAOYSA-N	426.521	1.849	50	20	IDGD	
CC(=O)Nc1ccc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]3C2)cc1	1787447315	TXELLVIVAXSSDE-PCODUJHASA-N	425.888	1.702	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnn4ccncc34)[C@H]2C1	1788038625	CZVJTFMSXNZGHJ-DSPQJCBJSA-N	436.310	1.106	50	20	IDGD	
O=C(CCCn1ccnc1)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1	1788143569	NSWQWHILQVVCGY-UHFFFAOYSA-N	446.316	1.791	50	20	IDGD	
Cn1cc(CC(=O)NC2(c3ccc(NC(=O)c4ccc(B(O)O)cc4)cc3)CCC2)cn1	1788145383	NQPUDWAPRJQOMQ-UHFFFAOYSA-N	432.289	1.090	50	20	IDGD	
Cc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Cl)C[C@@H]32)c(-n2nccn2)c1	1789291123	LITFADOFEUIGFY-IKICRFKJSA-N	435.887	1.703	50	20	IDGD	
C[C@H](C(=O)Nc1ccc(C2(NC(=O)CCC(=O)NN(C)C)CCC2)cc1)N1C[C@H]2C[C@H]2C1	1789446108	YSLGNZIEDVMAMJ-KURKYZTESA-N	441.576	1.834	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(-n4cnnc4)cc3)C[C@@H]21	1789861309	OYPAZVIWQKILDR-WNHJNPCNSA-N	431.924	1.878	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CNC(=O)c3ccc(C)cc3)C[C@@H]21	1789864172	MWEJOIMHVSONPO-OKYOBFRVSA-N	435.952	1.722	50	20	IDGD	
C[C@H](Cn1cncn1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]2C1	1789870537	MHGDDXHGJSUHNV-ZFHCCXERSA-N	432.352	1.130	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]2C1	1789924698	BIXCNLUBCXAVAE-MOLYVOAJSA-N	439.278	1.218	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(C)(C)OC(=O)NC(C)C)C[C@@H]21	1791254202	PUECSXBCSBOUJS-JONQDZQNSA-N	447.960	1.133	50	20	IDGD	
O=C(CC[C@H]1CCOC1)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1	1792021792	VRNWLXKSLSEBBR-KRWDZBQOSA-N	436.317	1.931	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C#CC1CC1)C2	1793878165	AWWIQYGJKHKSIR-DFGXFYAUSA-N	439.940	1.122	50	20	IDGD	
CC(C)OC(=O)c1ncccc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2	1794314346	FBCXWGYCORWREG-LMWOUKEDSA-N	427.860	1.384	50	20	IDGD	
CC(C)N[C@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)CBr)C2)C(C)C	1795713181	FRKWLEXTWLSTKN-UHDSXZAQSA-N	432.403	1.630	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](C)N1C[C@H]3C[C@H]3C1)C2	1796892055	XMLFBKLOJDHTSF-LIQYNLLCSA-N	440.548	1.099	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1cn2cc(F)ccc2n1	1797429721	MEQFXDWOKUKUTE-OWLDWWDNSA-N	443.248	1.367	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)nc(Cl)c1)C2	1798440717	NEBBRTRTGXUHMB-CLLJXQQHSA-N	444.879	1.005	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1c(F)ccc(OC)c1OC	1799663014	LDQYRGFGWDOQOH-IPJQOSJUSA-N	444.887	1.300	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc[nH]1)C2)[C@H](Br)Cc1ccccc1	1800435552	KEVIXTCVMLPHPQ-KYHPRHEASA-N	447.333	1.619	50	20	IDGD	
COc1cccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CO[Si](C)(C)C)C3)c1C	1800820531	ZMQBOIMIVNCGLE-OPMZPASUSA-N	434.609	1.987	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3cc(OC)ccc3o1)C2	1800976764	GXSAWPIXPSJQCX-QHHYFVSCSA-N	436.892	1.898	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCCNC(=O)OC(C)(C)C)C2	1800982304	CEMFKOGTOLDWFQ-JYYAWHABSA-N	447.960	1.135	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C(F)(F)c1ccco1	1801306360	OWRNVXRXABHBQS-CLLJXQQHSA-N	433.415	1.322	50	20	IDGD	
CC[C@@H](C(=O)N1CCCC2(CCN(C(=O)c3cccc(B(O)O)c3)CC2)C1)N(CC)CC	1806170117	WLYLWUXPZZEYQI-NRFANRHFSA-N	443.397	1.332	50	20	IDGD	
O=C(/C=C\C(=O)NC1CC1)NC[C@@H]1CCN(C(=O)C(Cl)Cl)[C@H]1c1cccnc1	1810133697	KKAUFWXMLOTXTN-HSYSNWJFSA-N	425.316	1.726	50	20	IDGD	
CN(C)c1ccc(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)cn1	1811060038	KOXVYQJRGVKMNG-IEZWGBDMSA-N	431.924	1.462	50	20	IDGD	
CC(=O)N/C(C)=C/C(=O)NC[C@@H]1CCN(C(=O)CO[Si](C)(C)C)[C@@H]1c1cccnc1	1812320064	WCTMEXMSKOEDBV-ODQNTDMBSA-N	432.597	1.979	50	20	IDGD	
CC(=O)N/C(C)=C/C(=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@@H]1c1cccnc1	1812320331	FQYOQHQNPVCVQV-WXWPUYFMSA-N	441.301	1.818	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc(-n3cnnc3)cc2)[nH]n1)[C@@H](O)CCl	1814869838	CVZOSWGUYRGFHG-SJORKVTESA-N	443.895	1.896	50	20	IDGD	
O=C1Cc2cc(C(=O)N3CCCC[C@@H]3c3cc(NC(=O)[C@H](O)CCl)n[nH]3)ccc2N1	1814873681	SZVPHUDHXZUGQP-HZPDHXFCSA-N	431.880	1.810	50	20	IDGD	
CN1CCN(CC(=O)N2CCCC[C@H]2c2cc(NC(=O)CCBr)n[nH]2)CC1	1816782529	SZHCMNOJWRBDBQ-HNNXBMFYSA-N	441.374	1.434	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)CCl)CC2)c1ccc2c(n1)OCCO2	1816951827	DBLLDLVDCQOEGW-SKDRFNHKSA-N	438.893	1.135	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)Cn2cccc([N+](=O)[O-])c2=O)[nH]n1)[C@@H](F)Cl	1818043213	IDNXZTQFQHOMQV-IAQYHMDHSA-N	440.819	1.706	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cnccc3C(=O)NN)n[nH]2)c[nH]1	1819402915	NPKCBJPYXIKIHY-KRWDZBQOSA-N	436.476	1.664	50	20	IDGD	
CCC(C)(C)C(=O)N[C@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1	1819800107	LYFIUDHHSBZVRY-NSHDSACASA-N	430.534	1.804	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2c[nH]c(=O)cn2)n[nH]1	1820248019	GKAWUWQVZBKNBV-MFKMUULPSA-N	437.298	1.972	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](O)CCl)CC2)c1cc(-c2ccncc2)[nH]n1	1820586120	ITEOYNGRMRFQCT-XHDPSFHLSA-N	446.920	1.754	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@H](O)CCl)CC2)c1nc2ccc(F)cn2n1	1824387729	GUXIFKSKKKJFLP-MWLCHTKSSA-N	438.872	1.150	50	20	IDGD	
CC[C@H](C)[C@H](O)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1	1824547682	IASLFZYPVKOUOD-DQLDELGASA-N	430.354	1.007	50	20	IDGD	
CC[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H]1CCC(=O)N1)CC2	1825445252	QORJBGJQLPWDAA-NGZCFLSTSA-N	429.340	1.507	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)CNC(=O)OC)sc2C1	1826506996	VPQVVOROMBYZSH-BDAKNGLRSA-N	433.328	1.585	50	20	IDGD	
CC[C@H](C)[C@H](O)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1	1828923692	UOERVOQHSCUHDS-BEVDRBHNSA-N	445.564	1.325	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccc(O)cn3)C2)C1	1830370826	ZEXHKGCNHGUTCL-FQEVSTJZSA-N	425.913	1.051	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)c[nH]1	1830538777	POVGTHRYDUZAKU-SCLBCKFNSA-N	428.327	1.424	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnn4ccccc34)C2)C1	1831646101	FNHJIDJGKFRLPI-UWJYYQICSA-N	434.924	1.812	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4n(n3)CCCO4)C2)C1	1831651066	NKFBPSHWMLAWPE-FOIQADDNSA-N	440.928	1.143	50	20	IDGD	
C[C@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCBr)CC1)n1cnnn1	1832284976	KFLFTWRJDDHDMP-UKRRQHHQSA-N	427.347	1.639	50	20	IDGD	
C[C@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)c3cc[nH]n3)CC2)CC1	1833265049	NMHMRUMTONIRCM-CYBMUJFWSA-N	426.359	1.626	50	20	IDGD	
CC[C@H](C)[C@@H](O)C(=O)NC1CCN(C2CCN(C(=O)[C@H](C)CBr)CC2)CC1	1833494545	DRJRDHPIWOCSIA-HDMKZQKVSA-N	446.430	1.996	50	20	IDGD	
COc1cccc(C(=O)N2CCO[C@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)n1	1833767127	SREVIEGCEKKTNW-FQEVSTJZSA-N	437.569	1.012	50	20	IDGD	
O=C(CCBr)NC1CCN(C2CCN(C(=O)c3ccc(=O)oc3)CC2)CC1	1834421231	UVJVDCNEGWJIHF-UHFFFAOYSA-N	440.338	1.610	50	20	IDGD	
Cc1ncc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCBr)CCO3)C2)s1	1834821627	QKGOGFLTVYNSTI-MRXNPFEDSA-N	432.340	1.307	50	20	IDGD	
Cn1ccc(CC(=O)NC2CCN(C3CCN(C(=O)[C@@](C)(Cl)CCl)CC3)CC2)n1	1834848703	FHNCETSBHMNBGL-FQEVSTJZSA-N	444.407	1.771	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cc(C)nc(O)c3)CC2)CC1	1835089542	SYUQZXZQPXNPJI-GOSISDBHSA-N	438.956	1.535	50	20	IDGD	
CC(C)CCC(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1	1835738272	QRMJPVFGQROZBN-UHFFFAOYSA-N	444.580	1.307	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccccn3)CCO2)C1	1836191837	YASPQRSWTQLPRI-RTBURBONSA-N	430.332	1.317	50	20	IDGD	
C=CC(=O)N[C@@H](C)C(=O)N1CCC(N2CCC(NC(=O)[C@](C)(Cl)CCl)CC2)CC1	1836399558	DQDVBBSLKUGXBE-VBKZILBWSA-N	447.407	1.485	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cncc(O)c3)CC2)CC1)[C@@H](F)Br	1836414355	GPJALUHFKNNKQH-MRXNPFEDSA-N	443.317	1.663	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)[C@H](C)CC(N)=O)CC2)CC1	1836911934	FFKNIICMSPOJCX-CJNGLKHVSA-N	446.386	1.670	50	20	IDGD	
O=C(c1ccc2scnc2c1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1837063315	OFDXYGXQSWKUPP-CRAIPNDOSA-N	427.885	1.901	50	20	IDGD	
Cc1ccc(CC(=O)N2CCOC[C@@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)cn1	1837710043	DTKZHELNGQKWLH-NRFANRHFSA-N	435.597	1.240	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(CO)o3)CCO2)C1	1837971770	HRNVXYJICFUSTK-RDTXWAMCSA-N	445.310	1.015	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3snnc3C)CC2)CC1	1838139628	QGDFYDGXCLYQRL-HNNXBMFYSA-N	430.958	1.713	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cnc4ncccn34)CC2)CC1	1838242028	DUXAQWVWPJVKQR-QGZVFWFLSA-N	449.939	1.595	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)nn1C(F)F	1838709297	GZIWMAMTVQGCNJ-INIZCTEOSA-N	441.262	1.460	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3ccc4nn[nH]c4c3)CC2)CC1	1838719223	UJORFGOVFDWHIP-KRWDZBQOSA-N	449.939	1.824	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)CCCn3ccnc3)CC2)CC1	1838786713	QBDJMEXLGLJQIU-LJQANCHMSA-N	440.972	1.916	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccc(OC)c(O)c3)C2)C1	1839141587	MZQWPOVREAGBPC-KKSFZXQISA-N	440.924	1.417	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(F)n3)C2)C1	1840033403	CIOWZFRTYODOIT-PXAZEXFGSA-N	430.274	1.074	50	20	IDGD	
C[C@@H](Nc1nccs1)C(=O)N1CCOC[C@@]2(CN(C(=O)C(Cl)Cl)CCO2)C1	1840187494	FMTKBRLFHXOKKS-BZNIZROVSA-N	437.349	1.204	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(C)c(O)c(C)c3)CCO2)C1	1840677175	SNVMMFXJOCGFBH-LAUBAEHRSA-N	440.924	1.333	50	20	IDGD	
C[C@H](Br)C(=O)N1CC2(CCCN2C(=O)[C@H]2CCN2C(=O)OC(C)(C)C)C1	1841766473	QFYQOAAZIPNRHM-QWHCGFSZSA-N	430.343	1.983	50	20	IDGD	
CCn1nccc1C(=O)N1CCCC12CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2	1842518567	MQIKHJSKQHZOTA-UHFFFAOYSA-N	441.444	1.867	50	20	IDGD	
CCc1c(Br)c(C(=O)N2CCCC23CN(C(=O)[C@H](Cl)COC)C3)nn1C	1843144488	UMPDJDFPKSADNP-LLVKDONJSA-N	447.761	1.816	50	20	IDGD	
Cc1cc2nc(C(=O)N3CC4(CCCN4C(=O)c4cnccc4C(=O)NN)C3)[nH]c2cc1C	1844264465	VVHKPUJYXNUVNS-UHFFFAOYSA-N	447.499	1.309	50	20	IDGD	
C[C@H]1[C@@H](C(=O)N2CCCC23CN(C(=O)[C@H](O)CCl)C3)CCCN1C(=O)OC(C)(C)C	1845144045	OGAGSQCHWOGXSG-HRCADAONSA-N	443.972	1.825	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCCC12CN(C(=O)c1ccc(N3CCOCC3)cn1)C2	1845169604	UKSIFQJXUAOVFU-LJQANCHMSA-N	441.359	1.972	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)C23CC(NC(=O)OC(C)(C)C)(C2)C3)C1	1846110089	PNSBGNUSEPHNIF-WPUWVODUSA-N	441.956	1.891	50	20	IDGD	
CCN(CC)[C@@H](C(=O)N1CC2(CCCN2C(=O)CCC(=O)NN(C)C)C1)c1ccccc1	1846385957	PBISHBDHBUOXIY-JOCHJYFZSA-N	443.592	1.646	50	20	IDGD	
C[C@@H](C(=O)N1CCCC12CN(C(=O)[C@H](Br)Cc1ccccc1)C2)n1cnnn1	1846648344	WKHWGEVHLMWFQR-GOEBONIOSA-N	447.337	1.444	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H]2C[C@]21C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl	1847563608	LENMHVRVNKMPIV-HOJQFNHUSA-N	427.929	1.187	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CCN1C(=O)c2ccccc2C1=O	1848087246	QRPVKZGKYZNKAZ-IKGGRYGDSA-N	433.892	1.128	50	20	IDGD	
Nn1c(SCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)nnc1-c1ccc(Cl)cc1	8659364	JFBXSDULSCYQOY-UHFFFAOYSA-N	447.864	1.774	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)/C=C/c1ccccc1)C(=O)NNC(=S)NC(C)(C)C	14894996	GPLFGYZTCPVEMQ-HFBDAHEESA-N	444.648	1.992	50	20	IDGD	
C[C@@]1(C2CC2)NC(=O)N(CC(=O)NNC(=O)COc2ccccc2-c2ccccc2)C1=O	17202057	ZUCBQYPXIVOVCX-QHCPKHFHSA-N	436.468	1.600	50	20	IDGD	
C#CCNS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)c1	18103915	FLWMDDMJMKHZTA-MRXNPFEDSA-N	429.498	1.443	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2ccccc2OCc2noc(C)n2)c2ccccc2c1=O	23688505	MOYIUVXHVUUNJU-UHFFFAOYSA-N	448.439	1.762	50	20	IDGD	
Cc1ccnc2nc(C(=O)NNC(=O)c3nc(-c4ccccc4)n(-c4ccccc4)n3)nn12	25384303	WZHBUJPYABZWJF-UHFFFAOYSA-N	439.439	1.755	50	20	IDGD	
COc1ccc([N+](=O)[O-])cc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	45843713	COBLVKRKHZMAEI-UHFFFAOYSA-N	448.457	1.463	50	20	IDGD	
COc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NNC(=O)c2cc(Cl)ccc2O)cc1	108494471	UWDFCCCLQLNNMM-JTQLQIEISA-N	427.866	1.182	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2cc3c([nH]c2=O)CC(C)(C)CC3=O)c2ccccc2c1=O	111152567	PXJUEZNWZPRFLH-UHFFFAOYSA-N	449.467	1.335	50	20	IDGD	
CC(C)(C)OC(=O)NCC1CCN(C(=O)NNC(=O)CNC(=O)c2cccs2)CC1	725873333	MHFOIYNERWPXNU-UHFFFAOYSA-N	439.538	1.455	50	20	IDGD	
Cn1c(=O)nc(O)c2nc(CCC(=O)NNC(=O)c3c(Cl)cccc3Cl)[nH]c21	727804789	QISNRSJKGAOFEL-UHFFFAOYSA-N	425.232	1.063	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(CNC(=O)NNc2cccc([N+](=O)[O-])c2C)cc1	728130019	RLZKPXXVZCHYJG-UHFFFAOYSA-N	437.478	1.654	50	20	IDGD	
COCCNS(=O)(=O)c1cccc(C(=O)NNC(=O)CNc2ccc(C)cc2C)c1	728205380	FFDXPCPZHCYROP-UHFFFAOYSA-N	434.518	1.101	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)COc3cccc(C#N)c3)cc2)CC1	728215448	FIYCGQRGJFJADZ-UHFFFAOYSA-N	429.502	1.016	50	20	IDGD	
CC(C)(C)c1nc(CC(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cs1	728341050	BLWQSXZPWIMWCC-HNNXBMFYSA-N	433.486	1.514	50	20	IDGD	
COc1ccc(CNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1[N+](=O)[O-]	728947230	RMIMBLNGVKPZSS-UHFFFAOYSA-N	429.437	1.140	50	20	IDGD	
O=C(CN1CCN(C(=O)NNC(=O)Cn2ccc3ccccc32)CC1)NCc1ccccc1	729510902	PTTCFNMVUVFKFN-UHFFFAOYSA-N	448.527	1.316	50	20	IDGD	
N#C/C(=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)N1CCO[C@H](C#N)C1	729979278	DDWIRQOERWIVNH-IDGGIGOKSA-N	438.875	1.737	50	20	IDGD	
CCS(=O)(=O)N[C@@H](CCSC)C(=O)NNC(=O)c1cc2c(s1)CC[C@@H](C)C2	730517005	HGPMLNCJYYQMFM-YPMHNXCESA-N	433.621	1.695	50	20	IDGD	
COc1ccc(-c2ccc(C(=O)NNC(=O)N[C@@H]3CCS(=O)(=O)C3)c(F)c2)c(F)c1	730534054	JVLMJSHOQGZYQZ-GFCCVEGCSA-N	439.440	1.772	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)NCCCCN1CCN(c2ccccc2)CC1	730823386	JAOODTCJENCBCJ-UHFFFAOYSA-N	441.532	1.704	50	20	IDGD	
O=C(CN1C(=O)COc2ccc([N+](=O)[O-])cc21)NNC(=O)NCc1ccc(Cl)cc1	733003243	CCSZPZPXKJNULG-UHFFFAOYSA-N	433.808	1.504	50	20	IDGD	
Cn1c(NNC(=O)CCCOc2ccc(S(C)(=O)=O)cc2)nc2ccccc2c1=O	733263279	SPOFOVCDUXBBTQ-UHFFFAOYSA-N	430.486	1.639	50	20	IDGD	
CN(C)CC(=O)NNC(=O)Cc1ccc(NC(=O)c2ccc(Br)cc2)cc1	733360865	GQUGMKZJCBKEHK-UHFFFAOYSA-N	433.306	1.953	50	20	IDGD	
CCc1ccc(C(=O)NNc2cnnc3ccccc23)cc1S(=O)(=O)N1CCOCC1	733812310	UXSXJGUXQBCSKL-UHFFFAOYSA-N	441.513	1.970	50	20	IDGD	
CN1C(=O)CC[C@H](C(=O)NNC(=O)C(=O)NC2CC2)[C@@H]1c1ccc(C(F)(F)F)cc1	734418360	KJJHWJPVDJOERI-ZFWWWQNUSA-N	426.395	1.041	50	20	IDGD	
Cc1sc(=O)n(CCC(=O)NNC(=O)c2ccc(CSc3nncn3C)cc2)c1C	734418909	VYFAGXYMSLCVKV-UHFFFAOYSA-N	446.558	1.799	50	20	IDGD	
O=C(CCC1CCCCC1)NNC(=O)NCCNS(=O)(=O)c1ccccc1[N+](=O)[O-]	735097454	SIOQRRFQUUCTGG-UHFFFAOYSA-N	441.510	1.564	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)C(F)(F)c2ccc(F)cc2)CC1	735117627	ZOUZSQYAIYCAEE-UHFFFAOYSA-N	443.451	1.392	50	20	IDGD	
Cn1cc(N2CC[C@H](NC(=O)NNc3ccc(S(=O)(=O)C(F)(F)F)cc3)C2=O)cn1	735584465	UMJDMMMBNVTQMC-ZDUSSCGKSA-N	446.411	1.145	50	20	IDGD	
CS(=O)(=O)c1cc(C(=O)NNC(=O)COCc2ccccc2)ccc1Br	737629401	PIXMSOFQSLAEDN-UHFFFAOYSA-N	441.303	1.830	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)NC2CC2)cc1)NNC(=O)COCc1ccccc1	737926714	NQGOSKPFLFGXEP-UHFFFAOYSA-N	431.514	1.424	50	20	IDGD	
Cc1ccc(NCCCNC(=O)NNC(=O)COc2ccccc2C#N)c([N+](=O)[O-])c1	740491450	ZGDQSBMPQHLCAN-UHFFFAOYSA-N	426.433	1.986	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)C1CCN(C(=O)c2cc(OC)cc(OC)c2)CC1	740851409	DFRDWIFTCMKWOA-UHFFFAOYSA-N	448.520	1.008	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)c1ccc2c(c1)C(=O)N(Cc1ccco1)C2=O	740852067	JFMQEPSFZFQYID-UHFFFAOYSA-N	426.429	1.142	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCC[C@H](C)C2)cc1	740853126	UDHXEUVSOWEFNJ-AWEZNQCLSA-N	438.550	1.173	50	20	IDGD	
COc1cc(CCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)ccc1C	741423623	BTPMLQHEGPDYHP-UHFFFAOYSA-N	434.518	1.441	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)[C@H](C)NC(=O)c1cc2c(C)nn(C)c2s1	743286462	YLXANBQWYBGYNS-ZDUSSCGKSA-N	443.529	1.850	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1cncn1-c1ccc(F)cc1	744619494	QWTMMSNTPRALOL-UHFFFAOYSA-N	445.476	1.789	50	20	IDGD	
CCN(C(=O)[C@H](C)OC(=O)/C(C#N)=C/c1cc(C#N)n(C)c1C)[C@@H]1CCS(=O)(=O)C1	744633061	SYOQHVSSDAASMC-XPWNJVKXSA-N	432.502	1.079	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H]2CC[C@H](SC)C2)c1	745893770	GMOJFOWABGHLIO-CABCVRRESA-N	428.580	1.945	50	20	IDGD	
O=C(NNC(=O)N1CCOCC1)c1ccc2c(=O)n(Cc3ccco3)c(S)nc2c1	745988172	UBDSPFCNUQNONW-UHFFFAOYSA-N	429.458	1.013	50	20	IDGD	
O=C(NNC(=O)N1CCOCC1)c1ccc(Cl)c(S(=O)(=O)N2CCCCC2)c1	745993050	VGIAHHMJNJILCM-UHFFFAOYSA-N	430.914	1.201	50	20	IDGD	
C[C@H]1Cc2cc(C(=O)NNC(=O)Cc3cn4ccccc4n3)ccc2N1S(C)(=O)=O	746548475	IGNBJEBWBFUBJZ-ZDUSSCGKSA-N	427.486	1.049	50	20	IDGD	
COc1cc(C)nc(NNC(=O)C2CCN(S(=O)(=O)c3ccc(C(C)=O)cc3)CC2)n1	746633651	YPUGNUNLJQPVRF-UHFFFAOYSA-N	447.517	1.540	50	20	IDGD	
COC[C@H](Cc1ccccc1)NC(=O)NNC(=O)c1sc(N2CCOCC2)nc1C	746779104	HCXHLISVUJVHOS-INIZCTEOSA-N	433.534	1.490	50	20	IDGD	
C[C@H](C(=O)NNc1ccc(F)cc1Br)N1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O	748074320	XZFWPYQTAFFQIP-FVJKAEFOSA-N	426.242	1.582	50	20	IDGD	
CNS(=O)(=O)c1csc(C(=O)NNc2nc(-c3ccccn3)nc3c2CCC3)c1	748853804	YZURFZKBAABACP-UHFFFAOYSA-N	430.515	1.754	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCCNC(=O)C(C)(C)C	749420246	JRBWZPBLVSQYJE-NSHDSACASA-N	429.315	1.709	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCC(OC[C@@H]3CCCCO3)CC2)cc1OC	750062523	OKDNYEZIOZVDJS-SFHVURJKSA-N	435.521	1.515	50	20	IDGD	
O=C(CN1CCN(C(=O)NNC(=O)c2cc3ccccc3o2)CC1)NCc1ccccc1	750290282	VOCGSVMZVFYUQN-UHFFFAOYSA-N	435.484	1.721	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)c1cc(Br)cc([N+](=O)[O-])c1Cl	750863639	DEDZSXBZDSMDDP-UHFFFAOYSA-N	445.613	1.795	50	20	IDGD	
CCC(=O)NCc1cc(S(=O)(=O)NNC(=O)CCOc2ccccc2)ccc1OC	751549115	SFOVIWVEINIPPE-UHFFFAOYSA-N	435.502	1.500	50	20	IDGD	
C[C@H]1CCCN(S(=O)(=O)c2cc(C(=O)NNC(=S)N[C@@H](C)C3CC3)n(C)c2)C1	751617835	LEQXYMAMQQYNTQ-STQMWFEESA-N	427.596	1.353	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1)C(=O)NC1CN(S(=O)(=O)c2ccc3c(c2)OCCO3)C1	752756632	DFNZYXSOFVOTJV-OQLLNIDSSA-N	443.456	1.693	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)Nc1ccc(Br)c(C(=O)OC)c1C	753234770	NDBKBMAXKCAOCB-SNVBAGLBSA-N	432.271	1.748	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccnnc2C)c1	753278126	GQLFYIDYYDBWAL-UHFFFAOYSA-N	441.469	1.669	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)NNC(=O)N[C@H]1CCCN(Cc2ccccn2)C1=O	753287439	CJROXLMQZLWNRM-KRWDZBQOSA-N	430.896	1.940	50	20	IDGD	
CS(=O)(=O)N1CCN(CCNC(=O)NNc2cc(C(F)(F)F)ccc2F)CC1	754639574	GQNXZEKPLOVMLT-UHFFFAOYSA-N	427.424	1.048	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@]23CCC(=O)N2c2ccccc2S3)c2ccccc2c1=O	754717634	VEWCQWXDYFZFCU-JOCHJYFZSA-N	449.492	1.806	50	20	IDGD	
C[C@H](CS(=O)(=O)c1ccc(F)cc1)C(=O)NNC(=O)[C@@H](C)Oc1ccccc1F	755050036	VENMMQCECYAGAJ-CHWSQXEVSA-N	426.441	1.990	50	20	IDGD	
CCN(c1ccccc1)S(=O)(=O)c1cccc(C(=O)NNC(=O)Cc2cc[nH]n2)c1	755283445	XLIHUDQIMCSGLG-UHFFFAOYSA-N	427.486	1.629	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2cc(C(=O)NNC(=O)Cc3cc[nH]n3)ccc2C)cc1	755289257	QBZBVUAXUNBOBC-UHFFFAOYSA-N	427.486	1.831	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NC(=O)NNC(=O)c2ccc3c(c2)OCO3)cc1	755360283	ODYLPNMPUJQXJC-UHFFFAOYSA-N	434.474	1.912	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)Nc1ccc(NC(=O)[C@H]2CCCO2)cc1	755642053	VFTADFIYYDQPAT-QGZVFWFLSA-N	443.416	1.944	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1C(=O)NC(C)C	756490330	NQTAVWBBLUOWKT-UHFFFAOYSA-N	439.520	1.993	50	20	IDGD	
COC(=O)N(C)Cc1ccc(NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1	756609975	GLIDQJXOUHEBNY-UHFFFAOYSA-N	434.474	1.755	50	20	IDGD	
CS(=O)(=O)c1ccccc1-n1cc(NC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cn1	756703599	AUKSELDGEPCRLI-UHFFFAOYSA-N	444.429	1.651	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2c(C)ccn(C)c2=O)c1	757630496	LDCBYMIQFGVZLZ-UHFFFAOYSA-N	435.506	1.191	50	20	IDGD	
CN(C)C(=O)CNC(=O)c1ccc(NC(=O)NNC(=O)c2ccccc2F)cc1Cl	757726479	WUUMFJJFEJGRDM-UHFFFAOYSA-N	435.843	1.764	50	20	IDGD	
N#Cc1c(F)cccc1-n1ccc(NC(=O)NNC(=O)c2nnc(O)c3ccccc23)n1	757979718	UDDZKQZBCLJLGO-UHFFFAOYSA-N	432.375	1.998	50	20	IDGD	
Cc1cc(F)cc2c(=O)c(C(=O)N3CCN(S(=O)(=O)CBr)CC3)c[nH]c12	758528556	WGENMSXVHKLTBN-UHFFFAOYSA-N	446.298	1.416	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCN(c2ccc(Cl)c(Cl)c2)C1=O)C(=O)Nc1ccccn1	758832818	JHHFUBITSGRYNG-NSHDSACASA-N	436.255	1.527	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)[C@H]2COc3ccc(Br)cc32)C[C@@H](C)O1	760120515	XVWTYHXAAWCQBU-JMSVASOKSA-N	426.311	1.572	50	20	IDGD	
C[C@H](NC(=O)CCC(=O)NNc1ncc(F)cn1)C(=O)c1ccc(Br)cc1	760911313	FKGRRQVEROZDDL-JTQLQIEISA-N	438.257	1.989	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(OCC(=O)NNc2ncc(F)cn2)c([N+](=O)[O-])c1	760922502	JAUQVQHBWLDUDH-UHFFFAOYSA-N	442.429	1.077	50	20	IDGD	
COC(=O)N[C@@H](C)C(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccc(C)cc2C)c1	761191988	PMDGCFRAPVLYSL-AWEZNQCLSA-N	448.501	1.610	50	20	IDGD	
COc1cc(NC(=O)C2CC2)ccc1S(=O)(=O)NNC(=O)COc1ccccc1O	761275567	ZERUOPFQSHBSBC-UHFFFAOYSA-N	435.458	1.138	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)c1ccoc1)N(S(C)(=O)=O)CC2	761418317	XDKQHCBTPLBFBZ-OAHLLOKOSA-N	437.474	1.007	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)N[C@H]1CCCN(c2ccccc2F)C1=O	761820307	FHDXNHXHWCALTJ-HNNXBMFYSA-N	438.419	1.614	50	20	IDGD	
O=C(Cc1csc(-c2ccc3c(c2)OCO3)n1)NNc1nccc(N2CCOCC2)n1	762864985	HGIDZIFAZCAXHZ-UHFFFAOYSA-N	440.485	1.851	50	20	IDGD	
O=S(=O)(CBr)N1CCN(S(=O)(=O)Cc2cccc3cccnc23)CC1	763205731	DNKHLCACTCRYOR-UHFFFAOYSA-N	448.364	1.364	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc3ccccc3cc2O)c(F)c1	763522762	QCTWMMDFYZMRDV-UHFFFAOYSA-N	425.372	1.871	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2c[nH]c3ccccc23)cc1NS(C)(=O)=O	763536228	OBVVSFGOZXPAJK-UHFFFAOYSA-N	429.458	1.248	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(C)c3ncccc23)cc(OC)c1OC	763539160	JONHQOACOOSJJE-UHFFFAOYSA-N	438.440	1.969	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)ccc1Cl	763569468	ACERJKCCQJKFKI-HNNXBMFYSA-N	433.804	1.053	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2ccnn2Cc2ccc(C)s2)c1	763623303	DOSZJYNJZBTQDU-UHFFFAOYSA-N	427.486	1.775	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2c(C)nc3ccccn23)cnc1Br	763628613	CKXFZYCNBKFWRA-UHFFFAOYSA-N	431.250	1.508	50	20	IDGD	
COC(=O)c1cc2cc(NC(=O)C(=O)NNC(=O)c3c(C)nc4ccccn34)ccc2o1	763630014	USDLDCVVPQQVTK-UHFFFAOYSA-N	435.396	1.575	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2ccnn2CCc2ccccc2)c1	763648631	FIXHMHQKYQLIIS-UHFFFAOYSA-N	435.484	1.908	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2ccc(N3CCOC[C@@H]3C)cc2)c1	763773024	SAIKRSWTONQMHZ-AWEZNQCLSA-N	442.472	1.329	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2ccc(C(F)(F)F)cc2)c2ccccc2c1=O	763785678	KXUPLKHGGCXHRJ-UHFFFAOYSA-N	447.373	1.835	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cccc(S(C)(=O)=O)c2)c1C	763852077	UTXWUVSGGFDPFZ-CQSZACIVSA-N	433.486	1.260	50	20	IDGD	
COC(=O)c1cccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(C(C)=O)cc2)c1C	763871081	DFKBXCCDTBSQHU-CQSZACIVSA-N	441.440	1.538	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccc(N2CCO[C@H](C)C2)cc1	763871214	FJROHSVMNFIGTN-CABCVRRESA-N	444.463	1.604	50	20	IDGD	
Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)C(=O)NNC(=O)CC(C)C	763881126	FEHSKRIQPWRHKF-GOSISDBHSA-N	426.521	1.771	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3ccc(CC(=O)N(C)C)cc3)cc2C1	763940714	HSSZCSCKPQSPHI-CYBMUJFWSA-N	442.541	1.903	50	20	IDGD	
C[S@](=O)c1cccc(NC(=O)C(=O)NNC(=O)c2ccc(COc3ccccc3)o2)c1	763950349	UCXXEGATKPNNBA-HKBQPEDESA-N	441.465	1.996	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2cc(Br)cn2C)cc1Cl	764004332	DCORUYQPIGPSIK-UHFFFAOYSA-N	429.658	1.849	50	20	IDGD	
COC(=O)c1csc(NC(=O)C(=O)NNC(=O)c2cccc(Br)c2)c1	764063049	JUKWHHCBPBRQHD-UHFFFAOYSA-N	426.248	1.697	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)NCC(C)C)cc2C)c(O)c1	764104719	CYYCQDXNVMPXHD-UHFFFAOYSA-N	426.473	1.795	50	20	IDGD	
CCOc1ccc(C(=O)N2CCCCC2)cc1NC(=O)C(=O)NNC(=O)c1cc(C)[nH]n1	764106791	SVURQLUVMXCTCT-UHFFFAOYSA-N	442.476	1.143	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)CCC2CCCCC2)cccc1C(=O)N1CCOCC1	764210563	JSVFSENSYKOOEW-UHFFFAOYSA-N	444.532	1.914	50	20	IDGD	
O=C(NNC(=O)c1cccc2ncccc12)C(=O)Nc1ccc(S(=O)(=O)C(F)F)cc1	764259897	KZTLCFPPBFLJHG-UHFFFAOYSA-N	448.407	1.631	50	20	IDGD	
Cc1ccc(NC(=O)C2CC2)cc1NC(=O)C(=O)NNC(=O)COc1ccccc1O	764275603	OVLZTOPOOYUXJY-UHFFFAOYSA-N	426.429	1.214	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)C(=O)Nc1cccnc1N1CCCCC1	764350969	NHOZXDGKXJVJMR-UHFFFAOYSA-N	433.472	1.657	50	20	IDGD	
COC(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)c1	764394611	UGLJTSUZTRQVCM-UHFFFAOYSA-N	437.861	1.710	50	20	IDGD	
COc1cc(C(C)=NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)c(OC)cc1O	764826842	BTPRTQLXAVQQNK-UHFFFAOYSA-N	440.500	1.708	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CC[C@@]3(CCN(C(=O)OC(C)(C)C)C3)C2)n1	765030696	IAPJFTFWDFYMDW-HXUWFJFHSA-N	437.566	1.474	50	20	IDGD	
O=C(CCC(=O)N1CCN(c2ccccc2)CC1)NNC(=O)c1cnn(-c2ccccc2)c1	765532581	CSFGWPJZCNYJHH-UHFFFAOYSA-N	446.511	1.762	50	20	IDGD	
CNC(=O)[C@@H]1CCC[C@@H]1NC(=O)NNC(=O)[C@@H](C)Oc1cccc(Br)c1	765649960	XMVXSUMKPGQPKM-HONMWMINSA-N	427.299	1.462	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1ccc(CC(=O)N2CCc3ccccc32)cc1	766272862	YFVPHCUMRYGLIY-UHFFFAOYSA-N	446.467	1.699	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)c2csc(S(C)(=O)=O)c2)cc1C	767056222	RDBCAJVOCJJHKJ-UHFFFAOYSA-N	430.529	1.702	50	20	IDGD	
CN(CCC1CCN(c2ccncc2)CC1)C(=O)NNC(=O)CNC(=O)c1ccco1	770773097	DKHBDTVFMIOKMZ-UHFFFAOYSA-N	428.493	1.384	50	20	IDGD	
Cc1cccc(F)c1NNC(=O)C(=O)N1C[C@H](C(=O)N2CCOCC2)Oc2ccccc21	770821616	GFBCNVQYJWQOIU-GOSISDBHSA-N	442.447	1.230	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)c1ccc2c(c1N)C(=O)c1ccccc1C2=O	771882158	MSHKVFZRNBZSQS-GFCCVEGCSA-N	437.452	1.783	50	20	IDGD	
CC(C)(C)OC(=O)N1CCSC[C@H]1CC(=O)NNC(=O)c1nnc(O)c2ccccc12	772219322	BFGVPEXBIBTYEH-GFCCVEGCSA-N	447.517	1.839	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2)c(C(=O)N(C)C)cc1OC	773640453	YYVWECRLRDRZEX-UHFFFAOYSA-N	431.405	1.396	50	20	IDGD	
CC(=O)N1CCN(Cc2ccc(NC(=O)C(=O)NNc3nccnc3C(C)C)cc2)CC1	773999166	CGLZJWLTMCOIHL-UHFFFAOYSA-N	439.520	1.346	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccn(CC(F)(F)F)n1	774006190	BYCKJBWRYHYPIE-VIFPVBQESA-N	433.774	1.652	50	20	IDGD	
COC(=O)C1(c2ccc(S(=O)(=O)NNC(=O)c3ccc4c(c3)OCCO4)cc2)CC1	776272874	YSZCQKMEBLAXHP-UHFFFAOYSA-N	432.454	1.286	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CN2CCN(c3nnc(C(F)(F)F)s3)CC2)c1	776860377	CDFUUXLBTSJMMM-UHFFFAOYSA-N	428.440	1.449	50	20	IDGD	
COC(=O)Nc1ccc(S(=O)(=O)NNC(=O)Cn2ccc3ccccc32)cc1[N+](=O)[O-]	777626811	ZUEGIENJWMCHRT-UHFFFAOYSA-N	447.429	1.738	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@H]2CCO[C@H](CC(C)C)C2)cc1	777751125	CXJHARXTEPWYLO-DLBZAZTESA-N	440.566	1.540	50	20	IDGD	
O=C(CCCOc1ccc(F)cc1F)N1CCN(S(=O)(=O)CBr)CC1	777836173	GNHHYOATDMBUOX-UHFFFAOYSA-N	441.294	1.950	50	20	IDGD	
Cc1ccc2cccnc2c1S(=O)(=O)NNC(=O)C1CCN(c2ncccn2)CC1	777932159	BLZHMNIFBGAKKN-UHFFFAOYSA-N	426.502	1.559	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)[C@@H]2CC(=O)N(c3cc(OC)cc(OC)c3)C2)nc1C	778422242	XTFORRBCDGNJOF-CYBMUJFWSA-N	443.460	1.475	50	20	IDGD	
COc1ccc(Br)cc1CNC(=O)NNC(=O)CNC(=O)OC(C)(C)C	778639949	JSQJCKWAZIKPOP-UHFFFAOYSA-N	431.287	1.813	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)N[C@@H](CO)Cc1c[nH]c2ccccc12	778649668	KMYCGHUKRUDBIF-QGZVFWFLSA-N	437.504	1.108	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)N2CCC[C@@H](S(=O)(=O)NC3CCCC3)C2)cc(C#N)n1C	781524247	SAWMQALAQPNNAY-PLMLNFJUSA-N	429.546	1.965	50	20	IDGD	
COC(=O)c1cc(Br)c(F)cc1NC(=O)C(=O)NNc1ccc(OC)cn1	782146125	YPQZGNPMNIFNDW-UHFFFAOYSA-N	441.213	1.860	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccccc1-c1ccno1)c1csc(N2CCOCC2)n1	782248407	ACEFYTSJXIXSMA-UHFFFAOYSA-N	435.487	1.258	50	20	IDGD	
Cc1cc(OCc2cccc(Cl)c2)ccc1NC(=O)C(=O)NNC(=O)C(=O)NC1CC1	782964284	BUDWJGYILIOYAB-UHFFFAOYSA-N	444.875	1.592	50	20	IDGD	
Cc1ccc(NNC(=O)C(=O)Nc2cccc(S(=O)(=O)N3CCCN(C)CC3)c2)cc1	783348428	GFDZALKXVIHMKC-UHFFFAOYSA-N	445.545	1.403	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)(F)F)cc1)C(=O)Nc1cnn(CC2CC2)c1	783409324	SRXYDFXWKGQJMY-UHFFFAOYSA-N	431.396	1.668	50	20	IDGD	
CCCN(C(=O)c1ccccc1NC(=O)C(=O)NN[C@]1(C)CCS(=O)(=O)C1)C(C)C	783423920	BNPRADZSQIBOLD-HXUWFJFHSA-N	438.550	1.084	50	20	IDGD	
Cn1ccnc1Sc1ccc(NC(=O)C(=O)NNc2ccc(-n3cccn3)nn2)cc1	783432857	GGRBSRDGBSBBEW-UHFFFAOYSA-N	435.473	1.629	50	20	IDGD	
O=C(NNc1ccc(-n2cccn2)nn1)C(=O)Nc1cc(F)c(Br)cc1F	783437293	WOAZTYIUBGVWMD-UHFFFAOYSA-N	438.192	1.785	50	20	IDGD	
Cc1cc(-c2ncccc2NC(=O)C(=O)NNC(=O)CNC(=O)c2ccco2)cs1	784001797	DKDQLYOLQLLYQG-UHFFFAOYSA-N	427.442	1.227	50	20	IDGD	
COCCS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2cccc([N+](=O)[O-])c2C)cc1	784351134	BUGBUTIOAOBTJC-UHFFFAOYSA-N	436.446	1.405	50	20	IDGD	
CC(C)C[C@H](C(=O)OCC(=O)NNC(=O)c1ccccc1)N1C(=O)[C@H]2CC=CC[C@H]2C1=O	784473561	XGPPYANLUWOCMO-FGTMMUONSA-N	441.484	1.357	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(N(C)C)c(NC(=O)C(=O)NNc2ccccc2)c1	784765367	XQVJONIAJYVHCT-UHFFFAOYSA-N	433.534	1.865	50	20	IDGD	
CCCNC(=O)[C@H]1CN(C(=O)C(=O)NNc2cccc([N+](=O)[O-])c2)c2ccccc2O1	784832006	WZMMQSBSUZFYPV-QGZVFWFLSA-N	427.417	1.358	50	20	IDGD	
CC(=O)Nc1cc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)ccc1F	784835862	XHTSORUZRAFKEK-UHFFFAOYSA-N	444.391	1.862	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)C(=O)Nc2cccc(-c3nnnn3C3CC3)c2)c1	784839869	RJHGCPSCFZPYTK-UHFFFAOYSA-N	441.473	1.160	50	20	IDGD	
CN(C)CCn1c(=O)oc2ccc(NC(=O)C(=O)NNc3cc(F)c(F)c(F)c3)cc21	785086904	IXTKCMCJUPUIMB-UHFFFAOYSA-N	437.378	1.655	50	20	IDGD	
Cc1cnn(-c2ccc(C(N)=O)cc2NC(=O)C(=O)NNc2ccc(C#N)c(Cl)c2)c1	785092543	ZICRYOKCZYVEEK-UHFFFAOYSA-N	437.847	1.887	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)C(=O)Nc3cc(C)n(CCC#N)n3)n[nH]2)c1	785126629	ATZZRVFIEYHCDQ-UHFFFAOYSA-N	434.460	1.512	50	20	IDGD	
Cc1cc(=O)n(CC(=O)NC(C)C)c(C)c1C(=O)NNC(=O)NCc1ccc(Cl)cc1	787426904	CSRBPMUJPXDOFD-UHFFFAOYSA-N	447.923	1.787	50	20	IDGD	
CN(NS(=O)(=O)c1ccc2c(c1)CCC2)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	788915210	IOZYCGRZDBVPIT-UHFFFAOYSA-N	438.550	1.973	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2nc3c(s2)C[C@H](C(C)(C)C)CC3)n1	789740443	HBBODSXVOIJDHA-CYBMUJFWSA-N	432.550	1.894	50	20	IDGD	
O=C(CC1(CC(=O)NNc2nc3ccccn3n2)CCCC1)NNc1nc2ccccn2n1	791252452	GONBJKRJYJSRHQ-UHFFFAOYSA-N	448.491	1.699	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@@H](C)C(=O)NNC(=O)[C@@](C)(O)Cn1c(C)cccc1=O	792023778	VZJPWUYMMDQJEY-BTYIYWSLSA-N	435.908	1.793	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)c3cc(NS(C)(=O)=O)cc(C(F)(F)F)c3)nc21	792180964	UQNZFRRDEYKETQ-UHFFFAOYSA-N	445.383	1.216	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NC(=O)NNC(=O)c2cc(-c3ccccc3)on2)nc1	797652519	JTWUHWZNCXPAQI-UHFFFAOYSA-N	430.446	1.453	50	20	IDGD	
COC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)COc2cc(C)ccc2C)c1C	798042300	PSZCAVUAQVLJCJ-UHFFFAOYSA-N	428.445	1.955	50	20	IDGD	
Cn1nncc1C(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2Cl)c1	798822880	ASGITTQWHODCPN-UHFFFAOYSA-N	434.865	1.344	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@@H]2C(=O)NNC(=S)Nc2ccc(OC)nc2)cc1	799290032	WTBXSXDQPSSNSN-MRXNPFEDSA-N	429.502	1.721	50	20	IDGD	
COCN1C(=O)CCc2cc(NC(=O)NNC(=O)COc3ccc(OC)cc3)ccc21	801789421	WBGPMECAVDFMDM-UHFFFAOYSA-N	428.445	1.810	50	20	IDGD	
CCN1CCC[C@@H]1CN1C[C@@H](C(=O)NNC(=O)Nc2ccc(OC(F)F)cc2)CC1=O	802043591	IDZQZYWOLNDUGF-DZGCQCFKSA-N	439.463	1.774	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)c2cccc(S(N)(=O)=O)c2C)c(OC)cc1Cl	802081861	GJISSULPVVRUHH-UHFFFAOYSA-N	442.881	1.780	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CC(=O)N(c2ccc3c(c2)OCCO3)C1)Nc1ccc2c(c1)OCO2	802103513	DIUOAWRJCQKTDQ-GFCCVEGCSA-N	440.412	1.392	50	20	IDGD	
COc1ccc(C(=O)NNc2ccc3c(=O)[nH]ccc3c2)cc1S(=O)(=O)NC1CC1	803435374	WQWNKIAUYFIGFP-UHFFFAOYSA-N	428.470	1.734	50	20	IDGD	
Cc1cc([N+](=O)[O-])ccc1NNC(=O)Cc1ccc(S(=O)(=O)N2CCOCC2)s1	805381656	KQHDAMJDCWGOQB-UHFFFAOYSA-N	440.503	1.671	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(Br)c2)ccn1	806975202	QMJWQDMEBONNFO-JTQLQIEISA-N	437.250	1.406	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(NC(=O)C(=O)NNc2ccccc2[N+](=O)[O-])ccc1F	806984644	NOZXHNPRRWXJCF-UHFFFAOYSA-N	425.398	1.066	50	20	IDGD	
CCc1ccc(NC(=O)C(=O)NNC(=O)CNC(=O)OCc2ccccc2)cc1Cl	807070993	USNJRJZQYKXCGR-UHFFFAOYSA-N	432.864	1.915	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)NC[C@H](N2CCOCC2)C(F)(F)F)c1C	807540557	YCBBRBZKRGTUIX-HOCLYGCPSA-N	432.443	1.664	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@@H]1C[C@H](c2ccccc2)OC1=O	809556820	OKKIMHGLHIIQTL-LSDHHAIUSA-N	430.486	1.354	50	20	IDGD	
C#CC[C@]1(C(=O)NNC(=O)c2cncc(NC(C)=O)c2)CCCN1C(=O)OC(C)(C)C	809729855	PVENJJDDUAAXPE-OAQYLSRUSA-N	429.477	1.594	50	20	IDGD	
CCOc1cc(Br)c(F)cc1NC(=O)C(=O)NNC(=O)Cc1ccccn1	810387287	NYWUKKVYSDWRMT-UHFFFAOYSA-N	439.241	1.711	50	20	IDGD	
COC(=O)c1ccc(Cl)c(C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c1	811293060	ZZOJHBYCHOQAMZ-UHFFFAOYSA-N	435.776	1.653	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@H]2COc3ccccc32)c1	812442475	DFJVJXWYLZHUHI-INIZCTEOSA-N	446.529	1.837	50	20	IDGD	
C=C(C)COc1cccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)c1	813033695	HDFNXXGSOOHJRK-UHFFFAOYSA-N	432.502	1.974	50	20	IDGD	
Cc1nn(C)c(N2CCOCC2)c1C=NNC(=O)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	814971903	SUBPRKUKJOMFGT-MRXNPFEDSA-N	434.541	1.662	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1nc(CC(F)(F)F)cs1	815564194	ATXXLVCKRMUYGW-UHFFFAOYSA-N	426.380	1.604	50	20	IDGD	
CN(C)c1ccc(C2(C(=O)NNc3ccccc3S(=O)(=O)N3CCOCC3)CC2)cc1	815734358	AWQCJHLOOLHFRH-UHFFFAOYSA-N	444.557	1.948	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1cc(C#N)cn1C(C)(C)C	815751927	UTLBAIPEMVUSSC-UHFFFAOYSA-N	432.506	1.447	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)[C@H]2COCCN2CC(F)(F)F)C1	816510408	VLGZTNGTEMYHOE-QWHCGFSZSA-N	438.447	1.044	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)CSc2nnc3ccccn23)C1	819658574	NCVZLQGKVVZDEV-ZDUSSCGKSA-N	434.522	1.616	50	20	IDGD	
Cc1ccc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1-n1cccc1	839237452	IYERWNDIZNMPIT-FQEVSTJZSA-N	435.436	1.930	50	20	IDGD	
Cc1nnnn1/C(=C/c1ccccc1)C(=O)OCC(=O)NNC(=O)c1ccc(Cl)cc1	849196224	CVSMMXITGYPYPP-GZTJUZNOSA-N	440.847	1.637	50	20	IDGD	
COc1cccc([C@@]2(C)NC(=O)N(NC(=O)/C(C#N)=C\c3cc(C#N)n(C)c3C)C2=O)c1	863708987	VXEUXTZKYSNQOR-HRAFRWSSSA-N	432.440	1.619	50	20	IDGD	
CSC[C@H](C(=O)NNC(=O)c1ccc2ccccc2n1)N1C(=O)[C@@H]2CCCC[C@H]2C1=O	912766814	PUEXULZPJTYIPT-IIDMSEBBSA-N	440.525	1.903	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)Cc2ccc(S(N)(=O)=O)s2)cc1OC	915188968	MVJVWJWEQFDLJC-UHFFFAOYSA-N	427.504	1.197	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)NCC(=O)NNC(=O)Cc2c[nH]c3ccccc23)cc1	915787573	BVVZGAUHHWFLGG-UHFFFAOYSA-N	428.470	1.039	50	20	IDGD	
COc1ccc([C@H](CNC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)N2CCOCC2)cc1	915896975	NNMQUUSGMXVBJC-IBGZPJMESA-N	443.460	1.621	50	20	IDGD	
O=C(NCc1cn2ccccc2n1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	915907420	LZDKNVXSGBLODE-UHFFFAOYSA-N	442.501	1.263	50	20	IDGD	
CCNC(=O)c1ccc(CNC(=O)NNC(=O)c2nn(CC)c(=O)c3ccccc23)cc1	916392262	STGPJOXAPMQBSS-UHFFFAOYSA-N	436.472	1.310	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)NCCS(=O)(=O)Cc2ccccc2)nc2ccccc21	916635985	KRWLWCSLSNDMSU-UHFFFAOYSA-N	429.502	1.061	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)NCc1ccc(CS(C)(=O)=O)cc1	918101914	MLGNTNLKZUMDAS-UHFFFAOYSA-N	435.502	1.539	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)N[C@@H](CN1CCOCC1)c1ccc(C)cc1	919902422	MIGNFQBALXJHQM-FQEVSTJZSA-N	426.517	1.950	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCc1cccc(OCC#N)c1	1318470072	ACXMISNJBCWDQN-UHFFFAOYSA-N	430.490	1.335	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)CCCNC(=O)c2cccnc2)CC1	1319323888	AKIOCAOBYLTAQK-UHFFFAOYSA-N	433.509	1.386	50	20	IDGD	
COc1cccc(-c2noc(SCC(=O)NNC(=O)c3n[nH]c4c3CCCC4)n2)c1	1323799383	ZSEVKEHYTOUFRL-UHFFFAOYSA-N	428.474	1.900	50	20	IDGD	
C=C[C@@H](O)C(C)(C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCBr)C2	1779332330	GPDDBUKSRCIRGP-SPYBWZPUSA-N	431.371	1.858	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(OCCCO)cc3)C2)C1	1780126537	LTOKIVRUTUAPNS-NQIIRXRSSA-N	440.924	1.145	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](NC(C)=O)c1ccc(F)cc1)CCO2	1781218926	UHZNXOJRPOJWSH-BBTUJRGHSA-N	439.915	1.850	50	20	IDGD	
CCOC(CC(=O)N1CCO[C@]2(CCN(C(=O)[C@](C)(Cl)CCl)C2)C1)OCC	1781232444	FYJZVSMHFDECMN-QZTJIDSGSA-N	425.353	1.842	50	20	IDGD	
O=C(c1cn2c(F)cccc2n1)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781332271	FLNXXPXGFWZTAS-RHSMWYFYSA-N	443.248	1.607	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)n1cncn1)C2	1782002908	WXHFTPDSXPDACW-VMUDFCTBSA-N	428.331	1.136	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(CCN(C(=O)c3ccnc4ncccc34)C2)C1	1782339062	NFTJJDAYDXJZMD-OAQYLSRUSA-N	428.565	1.925	50	20	IDGD	
O=C(c1ncon1)N1CCO[C@]2(CCN(C(=O)[C@@H](Br)Cc3ccccc3)C2)C1	1783022271	JSGFDCVQHNAKGI-KXBFYZLASA-N	449.305	1.519	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3ccc(C#N)cc3)[C@H]2C1	1783443953	MKYCWZONRLIRMX-HAGHYFMRSA-N	433.936	1.724	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)Cc3cccc(Cl)n3)CCO2)C1	1783531689	BBLSCCRKWUIZQG-PXAZEXFGSA-N	430.730	1.891	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccnc4ncccc34)CCO2)C1	1783535478	DNSMMHWTZQMMCU-BFUOFWGJSA-N	433.306	1.857	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CC[C@@]2(CN(C(=O)[C@H](C)Br)CCO2)C1	1783857016	GVDNGVKYPBCYGN-ZTENYAIWSA-N	443.338	1.355	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)CCc3ccc(OC)nc3)CCO2)C1	1783872598	COOKWEUEPYMPLO-JXFKEZNVSA-N	425.913	1.107	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1CCC[C@@H](C(=O)OC)C1)CCO2	1783879206	PRLYVGBLZJKJHF-DICRZQGBSA-N	430.929	1.050	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(Cl)cc4nn[nH]c34)CCO2)C1	1783880973	HHFGJAAUBJUNAE-UGSOOPFHSA-N	442.303	1.309	50	20	IDGD	
O=C([C@@H](O)CCl)N1CCO[C@]2(CCN(C(=O)[C@H]3CC[C@H](C(F)(F)F)CC3)C2)C1	1785380578	IYTPLHRZRIJIHO-WSMBLCCSSA-N	426.863	1.785	50	20	IDGD	
C#CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@@]2(CN(C(=O)[C@@H](Cl)CC)CCO2)C1	1785575832	GJVYBGYCPMIEJE-QYWGDWMGSA-N	441.956	1.750	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)Nc3nccs3)[C@H]2C1	1787490055	XXDVYBADQRNNKN-FQKPHLNHSA-N	430.958	1.177	50	20	IDGD	
CC(=O)N/C(C)=C/C(=O)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1	1788143449	FRQZOYGAGDWQEK-CCEZHUSRSA-N	435.289	1.154	50	20	IDGD	
CC(=O)O[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)Br)C[C@@H]21)C(C)C	1788479116	CLOVVIUVSLKIIJ-VLVIQNCWSA-N	433.343	1.337	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cncc(C(F)(F)F)c3)[C@H]2C1	1789017928	DUIVNUFFPQVKED-DDWPSWQVSA-N	449.857	1.948	50	20	IDGD	
O=Cc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]3C2)s1	1789922544	LMJTVRWRXMYGBJ-HVTMNAMFSA-N	433.299	1.844	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cn[nH]c3)C[C@@H]21	1790694458	RFPBQNVPPWYXIO-LWOJADLZSA-N	441.438	1.888	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nccnc3C)C[C@@H]21	1790960590	MZTJGBWVOVQGQO-XQLPTFJDSA-N	425.327	1.552	50	20	IDGD	
C=C1C[C@@H](C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](O)CCl)N(C(=O)OC(C)(C)C)C1	1793116167	HJICJVODLMUIPJ-QEOTZNIISA-N	441.956	1.790	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnccc1N(C)C	1794473143	ZORDAEFXUAEKDF-JFILPPLUSA-N	425.327	1.134	50	20	IDGD	
Cn1ccnc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)C2	1794878887	YLNYGJOZRZNAQC-SQABCVSLSA-N	441.438	1.509	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCBr)[C@@H]1CC[C@@H]2CCC(=O)N2C1	1795495558	ZRKFFSYVDOCXGA-DGXTUMSLSA-N	426.355	1.811	50	20	IDGD	
CCc1[nH]nc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CO[Si](C)(C)C)C3)c1Cl	1795905391	YEICQCNDTWDDNY-DRXBFXEBSA-N	428.993	1.680	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(OC3CCOCC3)n1)C2)[C@@H](F)Cl	1796365776	ACEVQWUGIXPIMF-JGTCGTHISA-N	441.887	1.377	50	20	IDGD	
CCn1nc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)c2ccccc21	1796481478	GAVMBWQWEWLRIT-REPLKXPHSA-N	446.316	1.302	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2c(c1)OCO2	1796787436	SBONHGOCKSUVOZ-VFFTVRQLSA-N	425.279	1.402	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc[nH]c3nccc1-3)C2	1796892122	JKQQNHMPIPIRPN-CWNKPHDYSA-N	447.499	1.900	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1scnc1C1CC1)C2	1798440795	SLJLQDGHICFCER-BTTYYORXSA-N	440.529	1.585	50	20	IDGD	
C[C@H](Oc1ccccn1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2	1801366573	JLCGSZDWAZGCLI-QIRZIZBZSA-N	430.274	1.129	50	20	IDGD	
CN(C)C(=O)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](Br)Cc1ccccc1	1801568527	ZGVONNCTCISLBH-YVSFHVDLSA-N	436.350	1.719	50	20	IDGD	
C[C@H](Nc1nccs1)C(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]1c1cccnc1	1803139073	KDFQOYPSFVAIPH-LCGIIJARSA-N	437.953	1.644	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H]2CNc3ccccc32)[C@@H]1c1cccnc1)[C@H](O)CCl	1803139226	VLBCDUXUFLQQFE-JQERWDHBSA-N	428.920	1.896	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cc3cnccc3[nH]2)[C@H]1c1cccnc1)[C@H](O)CCl	1803143254	XVTNNUWBVCTBQR-KYNGSXCRSA-N	427.892	1.877	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(F)cc(F)c1F	1803688606	BUMJBCREAORRAE-CLLJXQQHSA-N	447.417	1.668	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)c2cccc(=O)n2C)[C@H]1c1cccnc1	1805315054	DDOWWGUTLRBGKQ-JCKWVBRZSA-N	447.333	1.883	50	20	IDGD	
Cc1ncccc1C(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1805503880	GCDIPZAWBRTAJI-XMSQKQJNSA-N	438.532	1.478	50	20	IDGD	
CN1CCN(CC(=O)N2CC[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]2c2cccnc2)CC1	1810546146	PFJNRVSJNFPBBV-SIKLNZKXSA-N	447.656	1.186	50	20	IDGD	
Cn1cc(CC(=O)NC[C@H]2CCN(C(=O)CCBr)[C@@H]2c2cccnc2)cn1	1813455574	GBPPWMIZBPKWAJ-VQIMIIECSA-N	434.338	1.849	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1ccccc1O)CC2)c1cccc(B(O)O)c1	1815355105	MXIAEGSVEHAXEH-CQSZACIVSA-N	437.286	1.068	50	20	IDGD	
C[C@H](NC(=O)c1cnccn1)C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](F)Cl)sc2C1	1817125494	PNQUPRJTIBFWIR-MWODSPESSA-N	440.888	1.198	50	20	IDGD	
C[C@H](C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](F)Cl)CC2)[C@H]1SC(=N)NC1=O	1817251441	VTWAQENMKZLNKN-ZRVLKLQWSA-N	433.918	1.392	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCN(C)C)CC2	1817279942	MHYPTGRLMBKJAP-CJCQAYSXSA-N	445.549	1.141	50	20	IDGD	
CCc1nc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)co1	1819895678	GZUJCPNANQHWFE-QGZVFWFLSA-N	437.265	1.260	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@](C)(Cl)CCl)CC2	1820148865	WRXRHFIQBLPIMV-KEYDSSBGSA-N	433.361	1.982	50	20	IDGD	
COC[C@H](NC(C)=O)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CO[Si](C)(C)C)CC2	1820193532	XMYXWGOQYPHLDK-OCCSQVGLSA-N	442.614	1.058	50	20	IDGD	
CS(=O)(=O)CC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](F)Br)n[nH]1	1820932954	WHTYQOSMYDTWLI-BXKDBHETSA-N	425.280	1.137	50	20	IDGD	
O=C1Cc2cccc(C(=O)Nc3cc([C@H]4CCCCN4C(=O)[C@H](O)CCl)[nH]n3)c2N1	1821512768	IJQSVAOIFJQBDJ-HUUCEWRRSA-N	431.880	1.810	50	20	IDGD	
COCCOCCOCCC(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1	1822253592	KBUWSFDLOWAHNW-CVEARBPZSA-N	446.932	1.071	50	20	IDGD	
C[C@@H](NC(=O)OC(C)(C)C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1	1822275359	YHRIXSCXBMPNJB-XBFCOCLRSA-N	443.932	1.915	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H]1CCC(=O)NC1)CC2	1822857173	DBUVWJAMYCMGKD-YMNVWFMLSA-N	433.361	1.818	50	20	IDGD	
Cn1cc(CC(=O)N[C@H]2CCc3nc(NC(=O)[C@H](F)Br)sc3C2)cn1	1823014378	VHSVWVYGRAULLF-ZANVPECISA-N	430.303	1.722	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)Cn2cnnn2)CC1	1824094252	VENZLUWBOJNMLK-UKRRQHHQSA-N	427.347	1.324	50	20	IDGD	
CC[C@H](C)[C@@H](O)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1	1824547685	IASLFZYPVKOUOD-ZLGUVYLKSA-N	430.354	1.007	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)CC(F)(F)F)CC1	1826674973	WUNOECTVWKMOAA-KRWDZBQOSA-N	426.244	1.552	50	20	IDGD	
O=C(CN1CCCCC1)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827051490	ZFKLUZANCDLOEC-JOCHJYFZSA-N	441.381	1.086	50	20	IDGD	
C[C@@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1)n1ccnc1	1827055849	LYRYZQMAZONAOH-UWJYYQICSA-N	438.337	1.057	50	20	IDGD	
CCC(=O)C(=O)N1CCC([C@@H]2CCCCN2C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)CC1	1827679613	LQKLUPIYXDTDDV-WORIPGKHSA-N	429.521	1.719	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(Cl)cnc3O)CCO2)C1	1829564274	MTODDLAVBRCGFT-RDTXWAMCSA-N	432.304	1.528	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(F)ccc3C)CCO2)C1	1830079490	LXCVBLALSUQLON-XLIONFOSSA-N	428.888	1.458	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)C[C@H]2NC(=O)NC2=O)CC1	1830314247	UTLGARPPMCBUMM-TYILLQQXSA-N	447.363	1.441	50	20	IDGD	
CN1N=C(C(=O)N2CCC([C@H]3CCCCN3C(=O)[C@@H](F)Br)CC2)CCC1=O	1830375632	FKXFPNPDCQOALR-GDBMZVCRSA-N	445.333	1.905	50	20	IDGD	
Cc1ccc2cc(C(=O)N3CCOC[C@]4(C3)CN(C(=O)[C@H](O)CCl)CCO4)ccc2n1	1830727815	GMVJNIKUAYMFMG-KNQAVFIVSA-N	447.919	1.213	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3snnc3C3CC3)C2)C1	1831647094	QDGUHRNZFRXIIE-KUHUBIRLSA-N	442.969	1.893	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)C3(C(F)(F)F)CC3)CC2)CC1)[C@H](O)CCl	1833310729	ZCPUBIOKAALXRA-CQSZACIVSA-N	425.879	1.500	50	20	IDGD	
CCc1cnc(C(=O)N2CCC(N3CCC(NC(=O)[C@@H](O)CCl)CC3)CC2)s1	1833312640	UPPMVCPPTKOTNT-INIZCTEOSA-N	428.986	1.490	50	20	IDGD	
COc1ccc(C)c(C(=O)N2CCC(N3CCC(NC(=O)[C@@H](O)CCl)CC3)CC2)c1	1833313896	SEBZMBOUEXPVLO-FQEVSTJZSA-N	437.968	1.789	50	20	IDGD	
COc1cc(C(=O)N2CCC(N3CCC(NC(=O)[C@@H](O)CCl)CC3)CC2)ccc1C	1833313966	WZMUVEUWSHWFAC-IBGZPJMESA-N	437.968	1.789	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(O)nc(Cl)c3)CCO2)C1	1833575212	VDYQLNKHVRMUCC-LJQANCHMSA-N	446.331	1.776	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)c3ccc(Cl)nc3)C2)C1	1834820062	LTVHNRQBVXAYFA-KRWDZBQOSA-N	446.729	1.590	50	20	IDGD	
Cc1cnn(CC(=O)NC2CCN(C3CCN(C(=O)CO[Si](C)(C)C)CC3)CC2)c1	1834894264	ZODQEOLBKMDHTF-UHFFFAOYSA-N	435.645	1.615	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccccc3)CCO2)C1	1835000599	XXMINOMFGDDLLQ-YLJYHZDGSA-N	439.350	1.859	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)COC(=O)C(F)(F)F)CC2)CC1	1835686200	NOWBVRZRQYDECC-AWEZNQCLSA-N	441.878	1.681	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3[nH]nc4ccncc34)CCO2)C1	1836448037	ZTSYTTGRVGZPSE-MGPUTAFESA-N	435.912	1.435	50	20	IDGD	
O=C(c1ccc2c(c1)OCO2)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836718385	WPTPEPPOHATMAQ-QGZVFWFLSA-N	438.908	1.627	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc4cncn4c3)CCO2)C1	1837118203	MKBZZIYVEZENDY-OAQYLSRUSA-N	434.924	1.669	50	20	IDGD	
Cc1nc(C)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)o1	1838004888	NMENAWFONVSTIY-LJQANCHMSA-N	425.558	1.213	50	20	IDGD	
O=C(c1cc(-c2cccnc2)[nH]n1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1838027860	RKEABFCUUJGDLQ-VQIMIIECSA-N	437.859	1.076	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)/C=C\C(=O)NC3CC3)CC2)CC1	1838365104	RUIGZRCRPABYAD-OOFWQKGWSA-N	425.957	1.837	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)/C=C(\C)NC(C)=O)CC2)CC1	1838721523	SSTGLHOCJLMGDU-SZEUEKNRSA-N	429.945	1.279	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(O)c(OC)c3)CCO2)C1	1838972662	OTTZTOYUILYBJQ-IIBYNOLFSA-N	440.924	1.878	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)nc1	1839151082	HOHOMHGWAVXEMF-RBUKOAKNSA-N	430.332	1.696	50	20	IDGD	
C=C(CC(=O)OCC)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](Cl)CCC)C2)C1	1839173316	JWSKCVUIWSZJNF-OXQOHEQNSA-N	430.929	1.360	50	20	IDGD	
Cc1cc(O)c([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1839466711	PQDXWKJCNWBTCF-QAPCUYQASA-N	445.831	1.213	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)Cc3ccco3)C2)C1	1840156132	IXIQXPILGHLUIN-OXFYSEKESA-N	428.913	1.168	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)C(Cl)Cl)CCO2)C1	1840187351	VAZAWNJCAXAFSH-QMTHXVAHSA-N	432.142	1.278	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@]2(C(=O)N3CC4(CCCN4C(=O)[C@H](O)CCl)C3)C[C@H]2C1	1841353499	AHKMOCLQQVVCJT-ZSDSOXJFSA-N	441.956	1.437	50	20	IDGD	
CCN1CCN(c2ccc(C(=O)N3CC4(CCCN4C(=O)[C@@H](O)CCl)C3)cc2)CC1	1841354476	CUYDTSSOUQKBJB-IBGZPJMESA-N	434.968	1.245	50	20	IDGD	
C[C@@H]1CCC[C@@H]1C(=O)N1CC2(CCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)C1	1845038859	BDMLENAHWGKQMY-QUCCMNQESA-N	441.576	1.972	50	20	IDGD	
CCN(C)[C@@H](C)C(=O)N1CCCC12CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2	1845748562	XRBXQIJCZBIJHR-AWEZNQCLSA-N	432.477	1.677	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@H](NC(C)=O)c1ccc(F)cc1)C2	1846363338	CVIASAQYHBAKDM-SJORKVTESA-N	425.888	1.460	50	20	IDGD	
C[C@H](CC(N)=O)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](Br)Cc1ccccc1	1847859265	YAZQSMMDXIPBGF-SIXLDLHFSA-N	436.350	1.706	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCC(C(=O)Nc3ccccc3)CC2)cc1OC	24856731	CURGPJVEJVFZSQ-UHFFFAOYSA-N	440.500	1.816	50	20	IDGD	
Cc1cc(Cl)ccc1O[C@@H](C)C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	104497423	BACIVKZLXHDQOZ-UGSOOPFHSA-N	448.859	1.946	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NNC(=O)Cc1ccc2ccccc2c1	725873239	LVPRMRRSIBKKIK-UHFFFAOYSA-N	425.470	1.235	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2N2CCOCC2)cc1	726276296	PXNJVDRUTSGSLE-UHFFFAOYSA-N	427.417	1.140	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cc(C(=O)NNC(=O)C(=O)NC(C)C)ccc2C)cc1	726614637	ZSUQZNBZXWQYKZ-UHFFFAOYSA-N	448.501	1.090	50	20	IDGD	
CNS(=O)(=O)c1ccc(C)c(C(=O)NNC(=S)Nc2ccc(OC)c(F)c2)c1	727499794	UYGMWARAYLFNOK-UHFFFAOYSA-N	426.495	1.682	50	20	IDGD	
Cc1nc2cc(O)nn2c(C)c1CCC(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	728211008	DAGFXVHCMVHZNP-UHFFFAOYSA-N	444.517	1.568	50	20	IDGD	
O=C(COC(=O)c1ccc2c(c1)CCCC(=O)N2)NNC(=O)[C@@H]1COc2ccccc2O1	728325409	NKMWVRHXUBHZKS-SFHVURJKSA-N	439.424	1.106	50	20	IDGD	
O=C(COC(=O)c1cc(-c2cccc(F)c2)no1)NNC(=O)[C@@H]1COc2ccccc2O1	728329293	VDWLQFXTDWMDLR-SFHVURJKSA-N	441.371	1.625	50	20	IDGD	
O=C(CN1C(=O)NC2(CCCC2)C1=O)NNC(=O)c1cc(F)ccc1Br	728550969	RNYXULCPVDDVCB-UHFFFAOYSA-N	427.230	1.214	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)c1cc(S(=O)(=O)N2CCCCC2)ccc1Cl	728852279	YCXZTODIDKWSRV-UHFFFAOYSA-N	436.921	1.913	50	20	IDGD	
COC(=O)c1ccc(Br)c(S(=O)(=O)NNC(=O)Cc2cccnc2)c1	728856283	MCEVTGMTVSJQJU-UHFFFAOYSA-N	428.264	1.183	50	20	IDGD	
CCN(C)C(=O)c1cccc(C(=O)OCC(=O)NNC(=O)c2ccc(OC)c(OC)c2)c1	729127656	PDHYIPUWCCLMJJ-UHFFFAOYSA-N	443.456	1.414	50	20	IDGD	
O=C(NCc1ccc(CN2CCC(O)CC2)cc1)NNC(=O)c1cccc([N+](=O)[O-])c1	729621345	HSSOAXDHYFVDOA-UHFFFAOYSA-N	427.461	1.696	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)[C@H]3CCC(=O)N3)c2)c(C)c1	729834163	VBQPSHWSTXXVSF-QGZVFWFLSA-N	430.486	1.144	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)CN1C(=O)c2ccc(Br)cc2C1=O	731328642	ABKLVQVOYQNTSZ-UHFFFAOYSA-N	434.221	1.574	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CCNC(=O)OCC(F)(F)F)cc1Br	732033638	TUQMPVHCNIHRAO-UHFFFAOYSA-N	442.188	1.897	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@@H](C)Sc2nnnn2C2CC2)cc1Br	732177170	ZPGQTWXTVZBQIG-MRVPVSSYSA-N	441.311	1.721	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2cc(Br)c3c(c2)OCO3)C[C@@H](C)O1	732263160	LDBTZXVKCKBRMT-PHIMTYICSA-N	428.283	1.438	50	20	IDGD	
O=C(CN1CCN([C@@H]2CCN(c3ccccc3)C2=O)CC1)NNC(=O)c1ccc(F)cc1	732984854	HGOLPHJXDHVPDW-HXUWFJFHSA-N	439.491	1.010	50	20	IDGD	
CC(=O)N1c2ccc(S(=O)(=O)NNC(=O)c3cnn(-c4ccccc4)c3)cc2C[C@H]1C	733123168	VZOAAWGNSBKGKR-CQSZACIVSA-N	439.497	1.793	50	20	IDGD	
CC(C)Oc1ccccc1C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	735117917	JCAFBKXWNUQXGL-UHFFFAOYSA-N	433.534	1.562	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)N[C@H](C)CN2CCN(c3ccccn3)CC2)cc1	735519623	UQHNICKBBFDYOA-GOSISDBHSA-N	440.548	1.564	50	20	IDGD	
CC[C@@H](COC)NC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	739049608	QOHYUSWPAHNCAT-LBPRGKRZSA-N	426.520	1.918	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)[C@@H]2CN(Cc3ccccc3)CCO2)cc1	741174040	YZTUULBWPJCPLK-UWJYYQICSA-N	427.501	1.901	50	20	IDGD	
CC(=NNC(=O)Nc1ccc(N(C)C)cc1)c1ccc(S(=O)(=O)N2CCNCC2)cc1	741764907	FDLBPJSGWSIOJC-UHFFFAOYSA-N	444.561	1.892	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)c2cccc(Br)c2)cc1	742769701	NUKOOGMIIXBKBY-UHFFFAOYSA-N	426.292	1.774	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)c3ncccn3)c2)c(C)c1	743291998	VNWQKCJYDVHRNM-UHFFFAOYSA-N	425.470	1.969	50	20	IDGD	
COc1cccc(C(=O)NCC(=O)NNC(=O)Nc2cc(Cl)c(OC)cc2OC)c1	743834755	SDPDKTWOSNBZNC-UHFFFAOYSA-N	436.852	1.949	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)[C@@H](C)N2C(=O)[C@@H]3[C@H]4CC[C@@H](O4)[C@@H]3C2=O)c1	744352061	ULEMCRIHBIDMSO-JNRNKGNBSA-N	443.500	1.196	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)CN2CCN(c3oc(-c4ccco4)nc3C#N)CC2)cc1	744387063	WDVJIDFEKORBDN-UHFFFAOYSA-N	445.439	1.261	50	20	IDGD	
CCO[C@H](C)c1noc(CN(C)CC(=O)NNC(=O)c2cc(Cl)ccc2OC)n1	744411075	HONYOWNCJXMFTD-LLVKDONJSA-N	425.873	1.722	50	20	IDGD	
CC(=O)N1C=Cc2ccccc2[C@@H]1CC(=O)OCC(=O)NNC(=O)c1cccc(C#N)c1	744522409	GVYVFINZEFIZIF-FQEVSTJZSA-N	432.436	1.827	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)NC[C@@H]2CCC[C@]23NC(=O)NC3=O)c(C)n1C[C@@H]1CCCO1	744630782	VVGINJGSFILOBM-DNXLKHJWSA-N	439.516	1.685	50	20	IDGD	
Cc1ccc(C(=O)N2CCC[C@H](C(=O)OCC(=O)NNC(=O)c3cccc(C#N)c3)C2)cc1	744705800	UGLBKJRMFZODSB-FQEVSTJZSA-N	448.479	1.723	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)[C@H]2CCCN2C(=O)OCC(F)(F)F)c1	744946900	RCVOMZSKQKXWPH-CYBMUJFWSA-N	431.367	1.463	50	20	IDGD	
N=C1NC(=O)[C@H](CC(=O)NNC(=O)c2nc(-c3ccccc3)n(-c3ccccc3)n2)S1	745413692	NGVVEGSATQVPHL-AWEZNQCLSA-N	435.469	1.252	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@@H](C)C(=O)NNC(=O)CCN/C(O)=C1\N=CC=CC1=O	746098631	WJMZWYJXWYYVDN-XXADUYMVSA-N	434.880	1.788	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Cc2cn3ccccc3n2)ccc1OCC(=O)NC(C)C	746555971	JYKTXKGDMOUZFK-UHFFFAOYSA-N	439.472	1.250	50	20	IDGD	
NS(=O)(=O)c1ccc(O)c(C(=O)NNC(=O)c2ccc(-c3ccc(F)cc3)s2)c1	747337980	XRMWNEQKMAOGFF-UHFFFAOYSA-N	435.458	1.982	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)c3ocnc3C)c2)cc1	747348737	QDWRJCRBIFZJAH-UHFFFAOYSA-N	430.442	1.867	50	20	IDGD	
COC(=O)c1cc(C)c(C)c(S(=O)(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c1	747607875	GRTCIVIGBQQRSJ-UHFFFAOYSA-N	440.499	1.117	50	20	IDGD	
CN(CCNC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)Cc1ccc(F)cc1	748976563	JXAVJRKVYOXIRK-UHFFFAOYSA-N	437.497	1.697	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN2CCN(C3CCN(C(C)C)CC3)CC2)cc1C	749461023	SUQUASYBRLEKCP-UHFFFAOYSA-N	435.638	1.870	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN1C(=O)c1ccc2c(c1)OCO2)[C@H]1COc2ccccc2O1	749471929	ZVVJQCAPKOFCTP-AUUYWEPGSA-N	439.424	1.007	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN1C(=O)c1ccc2c(c1)OCO2)[C@@H]1COc2ccccc2O1	749471936	ZVVJQCAPKOFCTP-LIRRHRJNSA-N	439.424	1.007	50	20	IDGD	
CC[C@@H](C)n1c(SCC(=O)NNC(=O)C(=O)N2CCCC2)nnc1-c1ccccc1	749850751	XMVPBEDBEISHFZ-CQSZACIVSA-N	430.534	1.778	50	20	IDGD	
COc1cc(CN2CCN(CC(=O)NNC(=O)c3cccs3)CC2)cc(OC)c1OC	749852841	OUFVKYRQGWSQER-UHFFFAOYSA-N	448.545	1.353	50	20	IDGD	
COC[C@@H](NC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1)C1CC1	750446715	OCKYSFRHHZNXKH-OAHLLOKOSA-N	438.531	1.918	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)[C@H](C)N2CCSCC2)c2ccccc2c1=O	750810755	XLFSYMHDJVZRNE-HNNXBMFYSA-N	431.562	1.785	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)N[C@@H]1CCN(c2ccccn2)C1	753733346	WQIQFISPTVLWOE-LJQANCHMSA-N	437.548	1.203	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)Nc2ccc(S(=O)(=O)N3C[C@H](C)O[C@H](C)C3)cc2)o1	755423855	RDMWDEPYGYWPHF-OKILXGFUSA-N	436.490	1.852	50	20	IDGD	
COc1ccccc1NC(=O)c1ccc(NC(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)cc1	755497664	ZWAMUABRNOPQTA-CQSZACIVSA-N	446.485	1.535	50	20	IDGD	
CC(C)C[C@H](C(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)N1CCCCC1=O	756576248	HQJWOUMQGGESLO-MRXNPFEDSA-N	434.449	1.326	50	20	IDGD	
O=C(CN1CCN(CC(=O)Nc2ccccc2F)CC1)NNC(=O)c1ccccc1Cl	756643261	YZEHVRMPXODAQR-UHFFFAOYSA-N	447.898	1.496	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)CN2C(=O)N[C@]3(C[C@@H](C)C[C@@H](C)C3)C2=O)c1C	756866729	FGTHSTDKROPCMT-QCZOJDQRSA-N	444.532	1.965	50	20	IDGD	
CN(C)c1nnc(-c2ccc(NC(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)cc2)o1	757719060	FBGVBPOMPIVAQV-UHFFFAOYSA-N	448.443	1.516	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)COCc2ccccc2)cc1S(=O)(=O)NC1CC1	757865242	KOCQWOCIEHWGOY-UHFFFAOYSA-N	432.502	1.805	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)c1cnn(CCO[C@H]2CCCCO2)c1C	758138889	CROVNTKQAMSSQN-SFHVURJKSA-N	426.477	1.766	50	20	IDGD	
CN(C(=O)C1CC1)c1ccccc1C(=O)N1CCN(S(=O)(=O)CBr)CC1	758528471	VOIQXZQHVAKHSK-UHFFFAOYSA-N	444.351	1.499	50	20	IDGD	
COc1cccc(-n2ccnc2SCC(=O)NNC(=O)C(=O)Nc2ccccn2)c1	758832289	WPCXODUWIRHJQA-UHFFFAOYSA-N	426.458	1.154	50	20	IDGD	
CCS(=O)(=O)N1CCC(C(=O)NNc2ncccc2[N+](=O)[O-])(c2ccccc2)CC1	759285909	RSDAHKFVRZCGOB-UHFFFAOYSA-N	433.490	1.816	50	20	IDGD	
NC(=O)[C@H]1CC[C@H](CNC(=O)NNC(=O)CCCOc2ccc(Cl)cc2Cl)O1	760204889	VUPYNTIMPWRAPV-BXUZGUMPSA-N	433.292	1.516	50	20	IDGD	
CCCS(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)CCc2ccco2)c(OC)c1	761283471	UKGWETVARTYAMO-UHFFFAOYSA-N	445.519	1.382	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)c1cccc(S(=O)(=O)NC(C)C)c1	761618222	CSORMGAMVBPFOW-UHFFFAOYSA-N	437.543	1.935	50	20	IDGD	
COc1cc(C(=O)NN[C@H](C(N)=O)c2cccc(Br)c2)cc(OC)c1OC	763376696	GQCOITHMZNWLDS-HNNXBMFYSA-N	438.278	1.936	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1ccnn1-c1ccc(Cl)cc1	763472562	YIHHSWRUCQTFBH-UHFFFAOYSA-N	428.792	1.834	50	20	IDGD	
CCCCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2O)cc1	763530142	QSHNCNANXLSGQM-UHFFFAOYSA-N	434.474	1.334	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2c(F)c(F)c(F)c(F)c2F)cc1OC	763550706	QEFRGKSREBKPNX-UHFFFAOYSA-N	433.289	1.799	50	20	IDGD	
CN1CCC(N(C)c2ccc(NC(=O)C(=O)NNC(=O)c3ccccc3F)cc2)CC1	763574638	HOODGGLKRURIIU-UHFFFAOYSA-N	427.480	1.756	50	20	IDGD	
COC(=O)c1csc(NC(=O)C(=O)NNC(=O)COc2cccc(C(F)(F)F)c2)c1	763640271	VBOMIKLWBODBEN-UHFFFAOYSA-N	445.375	1.718	50	20	IDGD	
CC[C@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)cc1	763680158	CVBOPKZVSIMCKJ-AWEZNQCLSA-N	437.456	1.251	50	20	IDGD	
Cc1ccc(C(=O)NC2CC2)cc1NC(=O)C(=O)NNC(=O)COc1ccccc1F	763681809	QSVSXOZNJNMHIG-UHFFFAOYSA-N	428.420	1.191	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(N2CCOC[C@H]2C)cc1	763712072	DGXMMLCDOMXKMV-MRXNPFEDSA-N	440.500	1.639	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cc3c(cc2[N+](=O)[O-])OCCCO3)cc1	763811360	JGDHGOLEITUTNF-UHFFFAOYSA-N	444.400	1.229	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cccc([S@@](C)=O)c2)cc1	763872601	OWNPMOUHZVYKRY-BRRNQIAESA-N	431.470	1.180	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)C(=O)Nc1ncn(C2CCCCC2)n1	763943272	BZRKNWOZUUHQTI-UHFFFAOYSA-N	438.448	1.074	50	20	IDGD	
C[C@H]1C[C@@H](C)CN(C(=O)c2ccccc2NC(=O)C(=O)NNC(=O)c2cccn2C)C1	763999566	VAVGVDPVEBWQQF-GASCZTMLSA-N	425.489	1.543	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(OCc3cccc(C#N)c3)cc2C)n[nH]1	764106376	LPAOUYXFYPDBAU-UHFFFAOYSA-N	432.440	1.877	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc4c(c3)N(C)C(=O)CO4)n[nH]2)cc1	764112313	VPFJTRINEABNGZ-UHFFFAOYSA-N	448.439	1.140	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)ccc1Cl	764151981	BJVNWLBFUKMSTE-INIZCTEOSA-N	431.832	1.606	50	20	IDGD	
O=C(NNC(=O)c1ccoc1)C(=O)Nc1ccc(N2CCOCC2)cc1C(F)(F)F	764162857	FJWFRZQEFDYZQU-UHFFFAOYSA-N	426.351	1.535	50	20	IDGD	
CN1CCC(N(C)c2ccc(NC(=O)C(=O)NNC(=O)CCc3ccco3)cc2)CC1	764176849	HLWAXDMEXIOUSN-UHFFFAOYSA-N	427.505	1.529	50	20	IDGD	
COC(=O)c1cc(OC)c(OC)c(OC)c1NC(=O)C(=O)NNC(=O)CC1CCCC1	764187538	GNWJHBYBBFLPMU-UHFFFAOYSA-N	437.449	1.165	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc(Cl)nc3)n[nH]2)cc1OC	764378771	NMFWPXPXAKZJHI-UHFFFAOYSA-N	444.835	1.542	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1ccnn1Cc1ccccc1	764393941	UPSJGVLYAUSNKZ-UHFFFAOYSA-N	439.497	1.818	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1cc(Cl)ccc1N1CCCCC1	764399621	KYYRNMKBNSHCSG-CYBMUJFWSA-N	426.901	1.468	50	20	IDGD	
Cc1ccc(-n2nc(C(C)(C)C)cc2NC(=O)C(=O)NNC(=O)[C@H]2COCCO2)c(C)c1	764426429	USNMEZYZNXUIFR-MRXNPFEDSA-N	443.504	1.288	50	20	IDGD	
CC(C)NS(=O)(=O)c1cccc(CNC(=O)NNc2ccccc2S(C)(=O)=O)c1	765642133	RZLFKNWTTZLIDE-UHFFFAOYSA-N	440.547	1.603	50	20	IDGD	
CC(=O)N[C@H](C(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1)C1CCCC1	766661512	WQINOIRABJSBMX-NRFANRHFSA-N	449.983	1.300	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)C2CCN(S(=O)(=O)c3ccc(C(=O)O)cc3)CC2)n1	766860799	UVZXGXRNXPLIDV-UHFFFAOYSA-N	433.490	1.336	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCC[C@H]1C[C@@H](O)c1cnn(C)c1	766945450	KNDGPDGJPLJVKS-DOTOQJQBSA-N	435.912	1.431	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNS(=O)(=O)c1ccc(OC[C@@H]2CCOC2)c(F)c1	767438667	XDBKDSSFEQAPPE-CQSZACIVSA-N	448.476	1.820	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3cc(C)nc4cc(C)nn34)n[nH]2)cc1OC	768277742	RUTPVUSCXXUITK-UHFFFAOYSA-N	435.444	1.828	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)c1cc2c(cc1O)OCO2	768291489	RDBLPUSCXFSTHP-UHFFFAOYSA-N	446.891	1.353	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)CN2C(=O)N[C@]3(CCCC(C)(C)C3)C2=O)nc2ccccc21	768566698	UZLZQFBYJNMZFE-QFIPXVFZSA-N	440.504	1.154	50	20	IDGD	
COc1ccc(NNC(=O)CCS(=O)(=O)c2ccc3c(c2)OCCO3)c([N+](=O)[O-])c1	768582716	PKSCPQXBWPZARZ-UHFFFAOYSA-N	437.430	1.682	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)N[C@@H]1CCO[C@@]2(CCSC2)C1	769229332	BRBQXDYZRQZULM-GCJKJVERSA-N	447.605	1.584	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)NCc1ccc(S(N)(=O)=O)s1	770098004	DICONSDPQXELER-VIFPVBQESA-N	432.911	1.347	50	20	IDGD	
CSCCNC(=S)NNC(=O)CS(=O)(=O)Nc1ccc(N2CCCCC2)cc1	770246857	LTZPEIFDPKDUIH-UHFFFAOYSA-N	445.636	1.277	50	20	IDGD	
CS(=O)(=O)c1ccc(C(=O)NNC(=O)CNc2ccccc2)cc1Br	770379891	LOTXBZGYXIAVFX-UHFFFAOYSA-N	426.292	1.726	50	20	IDGD	
Cc1cccc(F)c1NNC(=O)C(=O)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1	770822009	OVEZSJOBQIJMPW-UHFFFAOYSA-N	436.465	1.237	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)N[C@@H]2CCO[C@]3(CCOC3)C2)nc1	771435348	QUYIYOHAUMRTQF-RDTXWAMCSA-N	427.527	1.076	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1cc(C)c(OCC(=O)N2CCCCC2)c(C)c1	772158580	LQTUFYTXXVAMRX-INIZCTEOSA-N	433.505	1.797	50	20	IDGD	
COc1cc(C)c(NC(=O)C(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1C	773626592	FSMZONZNYGTEFT-UHFFFAOYSA-N	433.490	1.005	50	20	IDGD	
COc1ccc(C(=O)N2CCOCC2)cc1NC(=O)C(=O)NNc1ccc([N+](=O)[O-])cc1	773638929	LLLRTVMVYPYOSX-UHFFFAOYSA-N	443.416	1.158	50	20	IDGD	
O=C(NNc1c(Cl)cccc1Cl)C(=O)Nc1ccnn1[C@H]1CCS(=O)(=O)C1	773696535	CRUHGGJEAFYWEH-VIFPVBQESA-N	432.289	1.631	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNc2ccc(C#N)cc2)ccc1S(=O)(=O)N1CCCC1	773701404	RATWRUUDOFVUEZ-UHFFFAOYSA-N	443.485	1.433	50	20	IDGD	
COCCNC(=O)c1ccc(NC(=O)C(=O)NNc2cnc3ccccc3n2)cc1Cl	773722913	PRFALRKPKPRNNP-UHFFFAOYSA-N	442.863	1.741	50	20	IDGD	
O=C(NNc1ncccn1)C(=O)Nc1ccc(CN2CCN(c3ccccn3)CC2)cc1	773724502	PSGXMVXQPQQGBM-UHFFFAOYSA-N	432.488	1.276	50	20	IDGD	
Cc1c(C(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)nnn1-c1ccccc1	776206855	ZVJQXYVBCLTCJJ-UHFFFAOYSA-N	443.508	1.825	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)c2cc(S(=O)(=O)N3CCC3)ccc2Cl)c1	776530629	VZGUBCRTCPPPCG-UHFFFAOYSA-N	443.934	1.895	50	20	IDGD	
O=C(c1ccc(N2CCOC2=O)cc1)N1CCN(S(=O)(=O)CBr)CC1	777835838	DKGDKKURLNGNFU-UHFFFAOYSA-N	432.296	1.083	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)CN2C(=O)NC3(C[C@H](C)C[C@@H](C)C3)C2=O)nc1C	778425292	ONBUJFKVQPUNMJ-VXGBXAGGSA-N	432.481	1.152	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)NNC(=O)CNC(=O)OC(C)(C)C)cc2C1	778589688	SSOADOSTANGRIV-SNVBAGLBSA-N	425.511	1.373	50	20	IDGD	
CC(C)Oc1cc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)ccn1	778713772	MIFLQQBFEIXVOC-UHFFFAOYSA-N	426.408	1.798	50	20	IDGD	
COc1ccc(NNC(=O)Nc2ccc(NC(=O)CCN3C(=O)CNC3=O)cc2)nc1	782065230	OWLZYVSZJNJVFD-UHFFFAOYSA-N	427.421	1.119	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2cc(Cl)ccc2OCCS(C)(=O)=O)nc1	782148355	MWKCYAWCHKGZLF-UHFFFAOYSA-N	442.881	1.249	50	20	IDGD	
CC(C)Cn1ncc(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)c1C(C)C	782884050	FAEZUNWAAHFJDN-UHFFFAOYSA-N	439.520	1.878	50	20	IDGD	
CNC(=O)[C@H]1CN(C(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2O1	784380551	WWLNQHJLEQXPIN-OAHLLOKOSA-N	433.808	1.232	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNc2ccc(F)cc2)ccc1S(=O)(=O)N1CCCC1	784784492	WVNIMVXEHSXPDP-UHFFFAOYSA-N	436.465	1.701	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNc2ccc(Cl)nn2)c2ccccc12	784792897	ZLGUWSWWXRFZLU-UHFFFAOYSA-N	429.820	1.917	50	20	IDGD	
CCNC(=O)N(C)NC(=O)C(=O)Nc1c(C)c(C)nn1-c1ccc(Br)cc1	784915804	OPZABQSQTDTKOU-UHFFFAOYSA-N	437.298	1.883	50	20	IDGD	
O=C(NNC(=O)c1c[nH]nc1-c1ccc2c(c1)OCO2)c1csc(N2CCOCC2)n1	785022353	PWFCZHKBZJZSIP-UHFFFAOYSA-N	442.457	1.173	50	20	IDGD	
CN1CCN(C(=O)Cc2ccc(NC(=O)C(=O)NNc3cc(F)c(F)c(F)c3)cc2)CC1	785087431	RZTYIAIEOGDDGG-UHFFFAOYSA-N	449.433	1.502	50	20	IDGD	
CC(C)Sc1cccc(Cl)c1C=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O	786037221	HTAGYPDHOHBXRZ-UHFFFAOYSA-N	441.966	1.875	50	20	IDGD	
CC(=O)c1cccc(S(=O)(=O)N2CCN(C(=O)COC(=O)/C(C#N)=C/C3CC3)CC2)c1	786668333	FERPQPUFUWXNRY-WOJGMQOQSA-N	445.497	1.125	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)/C(C#N)=C/c3ccc(O)cc3)CC2)cc1	787440839	PELOZYZCDAVLEF-KGENOOAVSA-N	433.512	1.573	50	20	IDGD	
O=C(CCc1cnc[nH]1)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	788625160	QGWAUEMOLDWTDD-UHFFFAOYSA-N	427.486	1.282	50	20	IDGD	
Nc1nc(Cl)cc(NNC(=O)Nc2cccc(S(=O)(=O)NCc3ccco3)c2)n1	789176394	HPHFLQBMUVCRLK-UHFFFAOYSA-N	437.869	1.932	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)N[C@@H]3C[C@H]3c3ccc(F)cc3)nc2)CC1	789305565	ALUZAHGYFZBDGU-ZWKOTPCHSA-N	448.524	1.339	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNS(=O)(=O)CCc2cccs2)cc1	790004124	AJMWWWQQYSWSJX-UHFFFAOYSA-N	437.572	1.976	50	20	IDGD	
COc1cc(OC2CC2)ccc1C(=O)NNC(=O)c1sc(N2CCOCC2)nc1C	790119971	HRKMXCKQEXLHFI-UHFFFAOYSA-N	432.502	1.913	50	20	IDGD	
CCOC(=O)c1csc([C@H]2CCCN2C(=O)NNC(=O)CNC(=O)c2ccco2)n1	791021917	CUTQPERAFILRIL-GFCCVEGCSA-N	435.462	1.221	50	20	IDGD	
COc1ccccc1-n1ncc(C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)c1C	798794407	ZVYOVTCUXBHGJQ-UHFFFAOYSA-N	433.424	1.679	50	20	IDGD	
CN(C)Cc1cc(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)ccc1Cl	799259977	IAAPBEYQBWQTJP-UHFFFAOYSA-N	442.907	1.617	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)N[C@H](Cn1ccccc1=O)c1ccccc1	799856763	FCRJGOGQSVQQKH-LJQANCHMSA-N	444.455	1.210	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1)C(=O)NCCF	799904775	RJTABTWNIDVXOW-OXJNMPFZSA-N	441.507	1.418	50	20	IDGD	
O=C(COC(=O)c1ccncc1C(F)(F)F)NNC(=O)[C@@H]1COc2ccccc2O1	800239803	WGBXPICGNKPZSG-AWEZNQCLSA-N	425.319	1.245	50	20	IDGD	
NC(=O)c1ccc(/C=C/C(=O)N2CCC[C@@H]2C(=O)NNc2nccnc2C2CCC2)cc1	805461503	FZPUETONWDKOFS-VEGGFIAOSA-N	434.500	1.991	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)Nc1cnn(C)c1-c1ccccc1	806977080	UUMBCZOHNXLUPY-UHFFFAOYSA-N	445.277	1.588	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)Cc1csc(NC(=O)c2cccs2)n1	807368744	KPBGKOLWDWHWBF-UHFFFAOYSA-N	426.520	1.936	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)NC2C[C@@H]3CC[C@H](C2)N3CC(=O)N(C)C)c1	807513813	GXSWQTLVWQFZIQ-AYHJJNSGSA-N	431.537	1.096	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)nc2)nn1-c1ccc(F)cc1F	808934368	BWDKQSZUVGVVJP-UHFFFAOYSA-N	434.790	1.907	50	20	IDGD	
COC(=O)c1ccc(Cl)c(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1	809940361	INLYIBPQGJZVAX-UHFFFAOYSA-N	439.877	1.452	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC([C@@H]2C[C@H]2C(=O)NNC(=O)C(=O)Nc2ccccn2)CC1	810528665	WNUKCFYOMSKVPI-LSDHHAIUSA-N	431.493	1.451	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)CNS(=O)(=O)c1ccc(Cl)c(Cl)c1	811399066	KSLWVGBPJBBXOJ-UHFFFAOYSA-N	442.321	1.208	50	20	IDGD	
COCC1(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)CCCCC1	812609928	AXGVENJYHSEDTM-UHFFFAOYSA-N	426.539	1.478	50	20	IDGD	
CC(C)C(=O)Nc1cccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)c1	813033520	XLNLTUJFDMRRAZ-UHFFFAOYSA-N	447.517	1.613	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)NS(=O)(=O)c2cncc(C#N)c2)c(C)n1C[C@@H]1CCCO1	813984906	GEFAXHTTXFNWDO-UUVGHFPGSA-N	439.497	1.963	50	20	IDGD	
CC(=NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)C1CCN(C)CC1	814709622	DGNMLKWONKFPLT-UHFFFAOYSA-N	436.578	1.474	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NN=C1COc2cc(F)ccc21	814710487	OLMROKNSFOVVAB-UHFFFAOYSA-N	447.488	1.692	50	20	IDGD	
O=C(O)c1cc(C=NNC(=O)c2cc(S(=O)(=O)NCc3ccccc3)ccc2O)c[nH]1	814778622	OELMERPFFCWCRS-UHFFFAOYSA-N	442.453	1.661	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)[C@H](NS(=O)(=O)C2CC2)C(C)C)cc1OC	816827755	DBAORGSPKNSEJE-QGZVFWFLSA-N	427.523	1.351	50	20	IDGD	
CSc1ncc(Cl)c(C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)n1	825421036	CKJZALXOXQSITA-UHFFFAOYSA-N	425.810	1.378	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)CNC(=O)c2cccc(Br)c2)c1	825796477	HAYQGRJRFHNFCT-UHFFFAOYSA-N	435.278	1.447	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)CNS(=O)(=O)c2c(F)cccc2F)cc1OC	913068096	SAOGYGMTJNFJRS-UHFFFAOYSA-N	443.428	1.112	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)c1ccc(=O)n(-c2ccccc2)n1	914458893	PMGNKYSIKOAQSU-UHFFFAOYSA-N	443.257	1.835	50	20	IDGD	
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC(=NNC(=O)[C@@H](C)CN2CCC(C)CC2)CC1	914555019	GJAIXNMUAIDHKW-HNNXBMFYSA-N	438.598	1.651	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)CN1C(=O)N[C@]2(CCCC[C@H]2C)C1=O	915775822	PHMJQUQLOLXUIW-PEBXRYMYSA-N	440.504	1.247	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)N[C@@H](CN1CCOCC1)c1ccccc1	916214668	SIQFYUZBXUOIAA-LPHOPBHVSA-N	430.480	1.997	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCc1cccnc1OC(C)C	916511957	KVBDHCCXOJUUGH-UHFFFAOYSA-N	434.522	1.615	50	20	IDGD	
COc1cc(C=NNC(=O)Cc2csc(N3CCOCC3)n2)ccc1OCC(=O)O	917566169	BTFVSEXDISUPMI-UHFFFAOYSA-N	434.474	1.145	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1	918001859	JAQJMKFWGZQXLM-GOSISDBHSA-N	439.516	1.606	50	20	IDGD	
Cc1cc(F)ccc1S(=O)(=O)Nc1ccc(C(=O)NNC(=O)CN2CCCC2=O)cc1	920827359	SYATXQKBLZFZTM-UHFFFAOYSA-N	448.476	1.318	50	20	IDGD	
Cc1cc(N2CCN(C)CC2)ccc1NC(=O)NNC(=O)c1ccc2c(c1)OCCO2	920933385	WDCHTVPQZKJOMZ-UHFFFAOYSA-N	425.489	1.985	50	20	IDGD	
CNS(=O)(=O)c1ccc(Br)c(C(=O)NNc2ccc(C(=O)OC)cn2)c1	1116395036	CITHTIPDIQKTKQ-UHFFFAOYSA-N	443.279	1.296	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)c1ccc(N2CCC[C@@H](C(N)=O)C2)cc1	1253774740	CLCVCPJWOAJSJR-MRXNPFEDSA-N	442.541	1.950	50	20	IDGD	
O=C(CC(F)(F)C(=O)O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCBr)C2	1778011599	UVLJHFJSLGKYJX-IAQYHMDHSA-N	441.269	1.395	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)CS[C@@H]3CCCCO3)C2)C1	1779084972	LBEPKOXRDQZFTM-YSVLISHTSA-N	435.384	1.860	50	20	IDGD	
CCc1cc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](Br)CC)CCO3)n(C)n1	1779625738	BOVJZELXGAWJBV-RDTXWAMCSA-N	427.343	1.600	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3c(-c4ccncn4)noc3C)C2)C1	1780052127	PJISFRFRICKSPP-JLTOFOAXSA-N	449.895	1.137	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCBr)C2)c1ccc([N+](=O)[O-])[nH]1	1780233023	HYXOTWZFJOESKD-CXAGYDPISA-N	443.298	1.835	50	20	IDGD	
N#Cc1ccccc1OCC(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781334335	LDACIXFQEABXNY-WMZOPIPTSA-N	440.269	1.457	50	20	IDGD	
Cc1n[nH]c(C)c1CC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](C)CBr)CCO2	1781424953	AKRVQXAJLRFAOA-XIKOKIGWSA-N	427.343	1.430	50	20	IDGD	
CCc1cc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](C)Br)C2)n(C)n1	1781998215	VPSLQJIHBDNACJ-VVFCZOMOSA-N	441.370	1.893	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C1CCC(O)CC1)C2	1782001127	AMFHTACLEPHLOW-AGHOITTASA-N	431.371	1.835	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc3nn[nH]c3c1)C2	1782179829	NJBNGPCNGLJNJD-JNAXZKDPSA-N	435.912	1.339	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)Cc3c(C)n[nH]c3C)CCO2)C1	1783351442	AVNNNKNHYHRPJZ-QAPCUYQASA-N	427.343	1.572	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc4c(c3C)OCCO4)CCO2)C1	1783874985	JJYFVHYUUYNOOI-IIBYNOLFSA-N	438.908	1.464	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3nc(C)oc3C(F)(F)F)CCO2)C1	1783876504	WVSOLJGGLJXGSI-BDJLRTHQSA-N	439.818	1.699	50	20	IDGD	
Cc1nccn1CCCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](C)Br)CCO2	1784412015	PMSMSEGDFPBZOG-KBXCAEBGSA-N	427.343	1.585	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](O)C(=O)NC1(c2ccc(NC(=O)[C@@H](O)CCl)cc2)CCC1	1786135585	KDZFUNCXWPGNQW-HOCLYGCPSA-N	441.912	1.563	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3=CCCC3)[C@H]2C1	1786327166	WLFLVNCLFWBDHO-QECDCCOMSA-N	427.505	1.210	50	20	IDGD	
Cc1nc(CC(=O)Nc2ccc(C3(NC(=O)c4cnccc4C(=O)NN)CCC3)cc2)no1	1786846089	YAUJYTXCXVDDFH-UHFFFAOYSA-N	449.471	1.367	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3ccc(F)cn3)[C@H]2C1	1787031188	BWIVCWPIAJHZHQ-PYTWLRIVSA-N	442.329	1.774	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)c1cc2cccnc2[nH]1	1788369788	PQQQXGHIHFSFFK-DZKIICNBSA-N	435.322	1.941	50	20	IDGD	
CC(C)OCC(=O)NC1(c2ccc(NC(=O)c3cnccc3C(=O)NN)cc2)CCC1	1789519938	SDSUNWDOBQAOAJ-UHFFFAOYSA-N	425.489	1.858	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC1(c2ccc(NC(=O)c3cc(O)no3)cc2)CCC1	1789836059	ZDIGXRTXRPDNDN-UHFFFAOYSA-N	436.428	1.440	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CC=CC[C@H]3C(=O)OC)C[C@@H]21	1789864599	GSAFVTIIVYTSBT-PCCRXHMLSA-N	426.941	1.739	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC1(c2ccc(NC(=O)c3ccnnc3O)cc2)CCC1	1789969851	BAKNODBPKBENKS-UHFFFAOYSA-N	447.455	1.242	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnn4cccnc34)C[C@@H]21	1791055607	AAIFAXYDCHVTKR-DHMWGJHJSA-N	436.310	1.106	50	20	IDGD	
C[C@H]1CC[C@@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Cl)C3)N1C(=O)OC(C)(C)C	1792429351	JHIXLBRLRJOKFS-KXKVQDCLSA-N	447.935	1.898	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CC[C@@H]1CNc3ccccc3C1)C2)[C@H](O)CCl	1792977113	QNDYGMSYOWASHT-RCJOQXLUSA-N	435.952	1.240	50	20	IDGD	
C=CC[C@@H](C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1793879118	IYRSMYPGVNGUOZ-UHDSXZAQSA-N	443.972	1.920	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CNC(=O)c1ccco1	1796286488	IYTVEIAUHNJMLW-XJFOESAGSA-N	426.311	1.821	50	20	IDGD	
CC(C)(C)OC(=O)N1C(=O)CC[C@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Cl	1796368103	CJRXVDUDYLUSJX-CUZKYEQNSA-N	447.891	1.037	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1Cc2ccccc2O1	1797226865	DPYUQVLVPJPYAJ-DTYCBIMDSA-N	437.334	1.753	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc2cnccc12	1798131679	VUROZVIBFGRSBG-BJWYYQGGSA-N	444.495	1.799	50	20	IDGD	
CN(C)c1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Br)nc1	1799347461	LNMRHEUFTXSVDU-BAESOJJISA-N	429.290	1.041	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnc2c(c1)CCNCC2	1800243112	GQUIDNOYHKIQBE-DMUMMCEESA-N	434.968	1.381	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)Nc1cccnc1)C2	1800640197	YQEUVVMUFQOQKQ-QZLJAVCYSA-N	439.354	1.645	50	20	IDGD	
COc1cc(F)ccc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)Br	1800763158	QMWZMRUKRMHKKD-LSSIXWDNSA-N	429.286	1.821	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1(C(=O)Nc3ccccc3)CC1)C2)C(Cl)Cl	1801015472	MZOVAYGWNLCERE-AGGWBTHJSA-N	440.327	1.799	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cn3ncccc3n2)[C@@H]1c1cccnc1)[C@H](O)CCl	1803142276	CPGSUPDVJOMXTN-YXJHDRRASA-N	428.880	1.044	50	20	IDGD	
CCS(=O)(=O)CC(=O)NC[C@H]1CCN(C(=O)C(C)(C)CCl)[C@H]1c1cccnc1	1803509259	JISQGRKNKFKOMZ-WBVHZDCISA-N	429.970	1.787	50	20	IDGD	
CC(C)NC(=O)OC(C)(C)C(=O)N1CCC2(CCCN(C(=O)[C@@H](O)CCl)C2)CC1	1805525284	MNQLAVIVKPXYEV-HNNXBMFYSA-N	431.961	1.731	50	20	IDGD	
Cc1nc(C(=O)NC[C@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)co1	1805691290	VQCCYELJRWRPKJ-BEFAXECRSA-N	449.471	1.010	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H](CNC(=O)CCBr)[C@@H]1c1cccnc1)n1ccnn1	1806346515	JKYZUZGQQAYRIO-UNEWFSDZSA-N	435.326	1.725	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@H](CNC(=O)CN2CCCC2=O)[C@@H]1c1cccnc1	1806923724	DKFPOTYEKZAAJL-QSFXBCCZSA-N	441.359	1.946	50	20	IDGD	
Cc1nnc(CC(=O)NC[C@@H]2CCN(C(=O)[C@H](F)Br)[C@H]2c2cccnc2)o1	1807478307	GXJZEHDFIOZHJP-RCBQFDQVSA-N	440.273	1.712	50	20	IDGD	
CN[C@H](CC(=O)N1CC[C@H](CNC(=O)CO[Si](C)(C)C)[C@@H]1c1cccnc1)C(=O)O	1810541118	OUDBNAGYTOWMOG-MDZRGWNJSA-N	436.585	1.002	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2ccsc2)[C@@H]1c1cccnc1	1813070927	MKNWRWITNZAUDL-OXQOHEQNSA-N	429.546	1.836	50	20	IDGD	
C[C@H](CBr)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](C)CC(N)=O)[nH]n1	1814779705	VJMCJPLIXPVBGO-NQBHXWOUSA-N	428.331	1.944	50	20	IDGD	
COc1cnc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)[C@H](O)CCl)n[nH]2)c(F)c1	1814869749	ZHXIKOBDDNFNFE-UONOGXRCSA-N	425.848	1.858	50	20	IDGD	
Cc1noc(N)c1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](F)Br)CC2	1814910004	FPDRMPBIDXXKSX-LDWIPMOCSA-N	432.275	1.938	50	20	IDGD	
COC1(CC(=O)N[C@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)CCC1	1815361437	FIZRMKPAWNCTEO-HNNXBMFYSA-N	443.334	1.008	50	20	IDGD	
Cc1nn(C)c(C)c1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1	1815395504	ZYLKBVGUJTVWAW-INIZCTEOSA-N	444.540	1.439	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)CCc2ccccn2)n[nH]1	1816011453	UYFGSSBSWQCRHA-SFHVURJKSA-N	441.536	1.803	50	20	IDGD	
C[C@@]1(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)CC1(F)F	1817480056	XMPVSHFJBYZVKN-KXBFYZLASA-N	432.236	1.441	50	20	IDGD	
Cc1ncc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)s1	1818405767	DCMSCOMWXDIVFS-MRXNPFEDSA-N	439.306	1.474	50	20	IDGD	
CN1CCc2cc(C(=O)Nc3nc4c(s3)C[C@@H](NC(=O)[C@H](O)CCl)CC4)ccc21	1818416114	UQPYOUXQYWXYJV-XJKSGUPXSA-N	434.949	1.961	50	20	IDGD	
Cc1ccn(C)c1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1	1820361099	CJCYCHYSWMUQKY-INIZCTEOSA-N	429.525	1.736	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccnc4c3OCO4)sc2C1	1821235880	VHFNRGXYWPKBTD-MWLCHTKSSA-N	438.893	1.746	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc3n(n2)CCCO3)[nH]n1	1822369810	IUJIULVSWLWHQL-SWLSCSKDSA-N	436.900	1.948	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)C[C@@](C)(O)CC(=O)O)n[nH]1	1822413555	IXZYYRONFXXLNJ-GSDQYQHOSA-N	445.314	1.801	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)N[C@H]1CCc2nc(NC(=O)[C@@](C)(Cl)CCl)sc2C1	1822868125	SDRZHMHJKYJROW-KEYDSSBGSA-N	433.361	1.982	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](N)Cc1cccnc1)CC2	1825999262	SNRSSEGJNMGPNR-IHRRRGAJSA-N	437.953	1.274	50	20	IDGD	
O=C1NCCn2nc(C(=O)N3CCC([C@H]4CCCCN4C(=O)[C@H](F)Cl)CC3)cc21	1827607148	QWVHPTZAQNARDH-ZBFHGGJFSA-N	425.892	1.394	50	20	IDGD	
O=C([C@H]1CCc2ccccc2[C@H]1O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1830824722	NHVVKGJRTUDLOJ-TWFHAPMSSA-N	440.899	1.273	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccnc(F)c2)CC1	1831871329	RTZZCNQCAQAEGA-SFHVURJKSA-N	433.528	1.827	50	20	IDGD	
Cc1ccn(CC(=O)N2CCC([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)n1	1831872094	OBCHTBWWZSOSAS-IBGZPJMESA-N	432.569	1.184	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1	1831875201	VJNRWIMOCLPPMT-IAGOWNOFSA-N	430.977	1.233	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3ccc(Cl)nc3)CC2)CC1)[C@@H](O)CCl	1833306860	IRRYYPWWBWAFAH-INIZCTEOSA-N	429.348	1.520	50	20	IDGD	
Cc1ccc(CC(=O)N2CCOC[C@]3(CN(C(=O)CCBr)CCO3)C2)o1	1834826212	GEFJMEUXABZEAK-SFHVURJKSA-N	429.311	1.372	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)COc3ccc(O)cc3)CC2)CC1)[C@H](F)Cl	1835077663	BSWSRSOAXKBBHS-IBGZPJMESA-N	427.904	1.877	50	20	IDGD	
O=C(Cc1ccsc1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1836102159	LNSLWMGRDGGTKO-HOCLYGCPSA-N	435.315	1.438	50	20	IDGD	
CC(C)Cc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)n(C)n1	1836338373	RBYSXJWUELSIBS-IBGZPJMESA-N	447.363	1.492	50	20	IDGD	
Cc1cnn([C@H](C)C(=O)N2CCC(OC3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)c1	1836720030	HBXYGFQMAUYVDQ-QAPCUYQASA-N	426.945	1.351	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CCC[C@H]1C)CCO2	1836741038	IPZLUTNAPOSCSK-JEWRLFTDSA-N	431.371	1.910	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@H](C)Cn3ccnc3)CC2)CC1	1838786088	KAZCAUAWDYQYEV-VQIMIIECSA-N	440.972	1.772	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(Cl)cc3)CCO2)C1	1838960234	CADIYWVDOBZAGS-APWZRJJASA-N	431.316	1.664	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccnc3)C2)C1	1839963880	ZJMHZEBYAHONJK-YJBOKZPZSA-N	426.311	1.325	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3c(F)cccc3F)C2)C1	1840034432	LAIQXMWBRFGBMT-KZULUSFZSA-N	447.276	1.818	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(F)cc3)C2)C1	1840034817	XWASQYMCHQJBTK-ACJLOTCBSA-N	429.286	1.679	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)[C@@]2(C)CCCN2)C1	1845120088	MBRPOJRKQNCDAI-HXUWFJFHSA-N	430.461	1.479	50	20	IDGD	
CCOC(=O)c1ncn2cc(C(=O)N3CC4(CCCN4C(=O)[C@H](Cl)COC)C3)ccc12	1846361733	MCCFHDQWHFAVQJ-OAHLLOKOSA-N	448.907	1.582	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)[C@H]1C[C@@H]1c1ccc(F)c(F)c1)C2	1846383963	NEORUHGKIGIHAG-CVEARBPZSA-N	434.487	1.645	50	20	IDGD	
COc1ccc(N2C[C@@H](C(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)CC2=O)c(OC)c1	17329723	IOIQOWYBCUIEGB-ZDUSSCGKSA-N	428.401	1.426	50	20	IDGD	
C[C@H]1CC(C)(C)C[C@]2(C1)NC(=O)N(CC(=O)OCC(=O)NNC(=O)c1ccccc1)C2=O	22208581	NHMASVQBISNZDC-FPTDNZKUSA-N	444.488	1.128	50	20	IDGD	
C[C@@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)NNC(=O)c2cc(Cl)ccc2O)C1=O	105545475	FEKCEBINCSBTAF-IBGZPJMESA-N	434.811	1.413	50	20	IDGD	
COc1ccc(C(=O)CCCC(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1	108420207	QLNNZQZPZKUDEH-UHFFFAOYSA-N	432.502	1.803	50	20	IDGD	
C[C@@H]1CCCN(Cc2ccccc2CNC(=O)NNC(=O)CNC(=O)c2ccco2)C1	725870550	KLYOZZAPFQHHOF-MRXNPFEDSA-N	427.505	1.772	50	20	IDGD	
NC(=O)[C@H](NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)c1ccc(F)cc1	727462686	RCFJTARZZXECSB-GOSISDBHSA-N	434.493	1.461	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)NCC(=O)N(C)CCc3ccccn3)n[nH]2)cc1	727608838	XPYYCIKWZCZTOT-UHFFFAOYSA-N	435.488	1.425	50	20	IDGD	
C[C@H]1CCCN(S(=O)(=O)c2ccc(C(=O)N([C@H]3CCS(=O)(=O)C3)N(C)C)cc2)C1	728179348	JTJWKHMQWXOAEQ-RDJZCZTQSA-N	443.591	1.213	50	20	IDGD	
C[C@H]1C[C@@H](C)CN(c2ccc(C(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)cc2[N+](=O)[O-])C1	728369892	WBPFIUUBACUVRE-GUTXKFCHSA-N	438.506	1.273	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cccc(NC(=O)OC)c2)c1	728512426	UVKPPYTZZYFQGK-UHFFFAOYSA-N	448.501	1.970	50	20	IDGD	
COC(=O)c1sc(S(=O)(=O)NNC(=O)c2cccc(C#N)c2)c(C(=O)OC)c1C	728853430	KYRYMDRMPUWYKM-UHFFFAOYSA-N	437.455	1.125	50	20	IDGD	
O=C(NCc1cccc(Br)c1)NNC(=O)C1CCN(c2ncccn2)CC1	728951201	AWVJJSDMLABIDQ-UHFFFAOYSA-N	433.310	1.986	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c(N)c([N+](=O)[O-])c1	729510293	WQUHQDIXLAQQEY-UHFFFAOYSA-N	447.473	1.345	50	20	IDGD	
COCCOc1ccc(C=NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1	730463000	VTNRRQQUWUQLPQ-UHFFFAOYSA-N	447.513	1.497	50	20	IDGD	
CC(=O)N1CCN(C(=O)CCNC(=O)NNC(=O)c2cc3c(s2)CCCCC3)CC1	730828796	XTLVMCCPMHYHIJ-UHFFFAOYSA-N	435.550	1.042	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CCc2nc(-c3ncccn3)no2)cc1Br	732033486	QHCBTNKRDNDKDW-UHFFFAOYSA-N	447.249	1.692	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N(C)CCn2cccn2)cc1	732147949	ZONXMMUAKTYRHS-JXAWBTAJSA-N	447.499	1.696	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)CCn2c(S)nnc2-c2cccs2)C[C@@H](C)O1	732261374	MPVJUGWMZALCGD-CHWSQXEVSA-N	438.579	1.332	50	20	IDGD	
O=C(COC(=O)c1csc(-c2ccccn2)n1)NNC(=O)c1cccc([N+](=O)[O-])c1	732335407	LLJCRBSKLNZMNS-UHFFFAOYSA-N	427.398	1.731	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NN=C1C(=O)Nc2cc(N3CCOCC3)ccc21	734304356	ZCYVXCPQIHWIRE-UHFFFAOYSA-N	432.481	1.003	50	20	IDGD	
CC(=O)N1CCCc2ccc(S(=O)(=O)NNC(=O)c3cc(Br)c[nH]3)cc21	736064669	XKIZVBLQOQZXNH-UHFFFAOYSA-N	441.307	1.700	50	20	IDGD	
CCOC(=O)C(=O)N1CCN(C(=O)/C(C#N)=C/c2cc(C)n(C[C@H]3CCCO3)c2C)CC1	736132096	RYKYGKQDYCDRMM-UMSHPIDHSA-N	442.516	1.425	50	20	IDGD	
CSCCCCC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	739470849	NJQSXWNKYHYZOQ-UHFFFAOYSA-N	443.591	1.321	50	20	IDGD	
CC(C)(C)c1ccc(C(=O)NCC(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)cc1	741839025	RFXIHSGAANFQDG-UHFFFAOYSA-N	436.468	1.590	50	20	IDGD	
CN(C)CCN1C[C@H](C(=O)NNC(=O)c2cc(-c3ccco3)nc3ccccc23)CC1=O	742241509	LACDQZQBKFALDC-OAHLLOKOSA-N	435.484	1.666	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN(C(=O)c2ccncc2)C1)c1nn(-c2ccccc2)cc1O	743292679	ICVWPJPVUAZSMZ-INIZCTEOSA-N	434.456	1.286	50	20	IDGD	
COc1ccc(N2C[C@@H](C(=O)NNC(=O)Nc3ccc(N(C)C)cc3)CC2=O)c(OC)c1	743827785	QMJGGJANTZFTKO-AWEZNQCLSA-N	441.488	1.976	50	20	IDGD	
Cc1ccc(N2CC[C@@H](NC(=O)NNc3ccc(S(=O)(=O)NC(C)C)cn3)C2=O)cc1	745851229	DNIULHOLQXMFFL-QGZVFWFLSA-N	446.533	1.508	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12)[C@@H]1CCOC1	745862315	UZSIZDXMAPFXFZ-NVXWUHKLSA-N	435.484	1.814	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Br)cc2F)CC1)NNC(=O)NCC1CC1	746167464	RIEAKKOLNKGYSG-UHFFFAOYSA-N	442.333	1.446	50	20	IDGD	
O=C(CCSc1ccc(F)cc1)NNC(=O)NCCNS(=O)(=O)c1cccnc1	746325825	HWHSFZGLVPYWRC-UHFFFAOYSA-N	441.510	1.012	50	20	IDGD	
O=C(CCOc1ccccc1)NNC(=O)NCc1cccc(C(=O)N2CCOCC2)c1	747305488	WEDGORCLPBNGCC-UHFFFAOYSA-N	426.473	1.459	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)[C@@H]1CCCN1C(=O)Nc1ccc2c(c1)OCCO2	747429275	KLDZAODWTQUHQX-INIZCTEOSA-N	425.445	1.239	50	20	IDGD	
CN(C)S(=O)(=O)c1c[nH]c(C(=O)NNc2nc(-c3ccccn3)nc3c2CCC3)c1	748339924	RGHVSAFTUKDRSH-UHFFFAOYSA-N	427.490	1.363	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)N[C@H]2CCN(CCCc3ccccc3)C2=O)cc1	750660548	NRWSYHBFYLGCHZ-FQEVSTJZSA-N	440.500	1.638	50	20	IDGD	
C[C@]1(O)CCN(C(=O)/C(C#N)=C/c2cn(CCC(N)=O)nc2-c2ccc(Cl)cc2)C1	754368390	RZOCCOZFDHSCMN-VPFXQZGESA-N	427.892	1.969	50	20	IDGD	
O=C(NCCN1C(=O)[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)NNC(=O)C12CC3CC(CC(C3)C1)C2	755248879	XDNYNESZILESPF-PZPDAFPQSA-N	426.517	1.340	50	20	IDGD	
COc1cc(C=NNC(=O)Cc2nc3ccccc3n2C)c([N+](=O)[O-])cc1OCC(=O)O	755533888	BWENADGGGVKLIT-UHFFFAOYSA-N	441.400	1.646	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(C(=O)NNC(=O)NCc2cccc(C(F)(F)F)c2)co1	755704351	RVUHKDJUKYWLIA-UHFFFAOYSA-N	434.396	1.693	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NN=Cc3cnc4ccccn34)CC2)cc1	755792362	XYAOQYHAQUJZRP-UHFFFAOYSA-N	440.529	1.099	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)Nc1ccc(CC(=O)N2CCOCC2)cc1	755861589	GTOAYTCBAOYXFM-UHFFFAOYSA-N	436.472	1.511	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)[C@@H]1CC(Br)=NN1c1ccc(C)cc1	756098028	DUKFAQOGOFNCBH-AWEZNQCLSA-N	438.326	1.734	50	20	IDGD	
COc1cc(CN2CC[C@@H](NC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)C2)cc(OC)c1	756103122	SBVVVYBYAGBVPH-MRXNPFEDSA-N	443.460	1.831	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccccc2OCCn2ccnc2)c1	756470372	PEZFQJFNPXYUHV-UHFFFAOYSA-N	443.485	1.832	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)NNC(=O)COc2ccccc2C#N)cc1C	756516136	QGJPXWUQSPVUJA-UHFFFAOYSA-N	431.474	1.860	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)Nc2cnn(CC(=O)N(C)C)c2)c1	756800645	BHNOUKVGKVDXOJ-UHFFFAOYSA-N	439.270	1.209	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(NC(=O)CC#N)cc2)cc1OC	757693953	WYKCCWKWJPJVTB-UHFFFAOYSA-N	440.412	1.174	50	20	IDGD	
Cc1nc(N2CCOCC2)ccc1NC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	757734425	WRZAGRZWSDOJMJ-UHFFFAOYSA-N	433.490	1.097	50	20	IDGD	
CS(=O)(=O)CCn1cccc(NC(=O)NNC(=O)c2c(Cl)cccc2Cl)c1=O	757780823	MXPNZLRYFSYCJE-UHFFFAOYSA-N	447.300	1.666	50	20	IDGD	
Cc1cc(CC(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)c(C)n1-c1ccc(Cl)cc1	758036398	RLTZXEUJJMPOOT-GFCCVEGCSA-N	426.926	1.375	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)C(=O)Nc1ccccn1)Oc1ccc(Br)cc1	758814746	GUYDIEXFFNKPRQ-LLVKDONJSA-N	436.266	1.581	50	20	IDGD	
CCc1ccc(S(C)(=O)=O)cc1C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	758969126	IZFDJFXKWYXIGW-UHFFFAOYSA-N	437.543	1.850	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)c1ccc(=O)n(-c2cnn(C)c2)c1	760798811	RZVFKLSCQOVWKU-OAHLLOKOSA-N	431.452	1.953	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H]1CCc2ncc(NC(=O)C(=O)NNC(=O)C(C)(C)C)cc2C1	761068855	BMRYNSOGTNKHIQ-ZDUSSCGKSA-N	433.509	1.596	50	20	IDGD	
CCS(=O)(=O)Nc1cc(OC)ccc1S(=O)(=O)NNC(=O)c1ccc(Cl)nc1	761271621	HZHTZSDYGCQCSC-UHFFFAOYSA-N	448.910	1.129	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)c1cc(Cl)c(-n2cnnn2)cc1OC	761637027	NIKBOKYAAUMZSU-UHFFFAOYSA-N	448.892	1.886	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)NCCC2CC(O)C2)cc1	762720322	QHFHJQLPFMRMDW-ATVHPVEESA-N	437.500	1.618	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N1CCc2ccc(Br)cc21	763472545	XHNYKYMDQRQPAQ-UHFFFAOYSA-N	433.218	1.708	50	20	IDGD	
Cn1ccnc1-c1csc(NC(=O)C(=O)NNC(=O)c2cc3ccccc3cc2O)n1	763527388	NWVCMOMASUAJOJ-UHFFFAOYSA-N	436.453	1.802	50	20	IDGD	
COC(=O)Nc1cc(C(=O)NNC(=O)C(=O)Nc2ccccn2)cc(C(F)(F)F)c1	763562683	OGQPXSJEHLMKBW-UHFFFAOYSA-N	425.323	1.678	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(Cl)c2-n2cncn2)cc1	763660464	AGQMMNKHPVEFPZ-UHFFFAOYSA-N	444.835	1.094	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cc(-c3ccccc3C)nn2C)cc1	763661843	PURJWVQNVSYKMP-UHFFFAOYSA-N	437.456	1.569	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(F)cc1OCC1CC1	763664072	QNGQWWCVAFFKFN-UHFFFAOYSA-N	431.420	1.788	50	20	IDGD	
COc1ccc(OC(F)F)c(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)c1	763675254	UIEASGNPLIVUHT-UHFFFAOYSA-N	434.355	1.333	50	20	IDGD	
COC(=O)c1cc2cc(NC(=O)C(=O)NNC(=O)COc3ccc(C#N)cc3)ccc2o1	763675452	WOBZXUAKXHFZCL-UHFFFAOYSA-N	436.380	1.256	50	20	IDGD	
CCCS(=O)(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2cccc(N(C)C)c2)c1	763759830	CXJSCLUOVUGMSO-UHFFFAOYSA-N	447.517	1.304	50	20	IDGD	
O=C(NNC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1)C(=O)Nc1ccc(F)nc1	763805010	QNXUXFWZBKUYAO-UHFFFAOYSA-N	445.414	1.868	50	20	IDGD	
COC(=O)c1cc(C)ccc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1cccc(C)c1C	763852177	VWOSJKBNOKFINS-HNNXBMFYSA-N	427.457	1.952	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)NNC(=O)C(=O)Nc1ccc(N2C(=O)CCCC2=O)cc1	763857859	PMUGERXKCWMHGW-UHFFFAOYSA-N	447.451	1.540	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccccc2C(=O)N(C)C)cc1	763860753	LIVZNWSSIHUTIJ-CQSZACIVSA-N	442.472	1.341	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)Cc2c[nH]c3ccccc23)ccc1C(=O)NC(C)C	763861252	QBTXZAXBXBXPOD-UHFFFAOYSA-N	435.484	1.943	50	20	IDGD	
Cc1nn(C)c2ncc(NC(=O)C(=O)NNC(=O)CCSc3ccc(F)cc3)cc12	763896654	QEDUTVNWXAGPRS-UHFFFAOYSA-N	430.465	1.684	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccccc2-n2ccc(C)n2)cc1OC	763902857	QZZQUUXFFKLUDI-UHFFFAOYSA-N	437.456	1.988	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)C(=O)Nc1cccc(N2CCCCCC2)c1	763917248	RXPCMOAQUJKXFD-UHFFFAOYSA-N	448.487	1.442	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccccc1I	763921993	ZPESKQTUKQWFAA-UHFFFAOYSA-N	441.200	1.759	50	20	IDGD	
C[S@](=O)Cc1ccccc1NC(=O)C(=O)NNC(=O)c1ccc(Br)s1	763938393	DXWYNMPLXMEJGZ-VWLOTQADSA-N	444.332	1.789	50	20	IDGD	
Cc1nn(C)c(NC(=O)C(=O)NNC(=O)C2=S=C3CC[C@@H](C(C)(C)C)CC3=C2)c1C	763941819	PUMAFKWGWKTCDN-CQSZACIVSA-N	431.562	1.987	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1cccc(-n2nnnc2C)c1	764011655	JXHQXFOVGMSOJY-UHFFFAOYSA-N	429.824	1.032	50	20	IDGD	
COC(=O)c1ccc(F)c(NC(=O)C(=O)NNC(=O)c2cccc(Br)c2)c1	764063015	JAHVTKUPWXEOPH-UHFFFAOYSA-N	438.209	1.775	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)ccc1O)C(=O)Nc1cnc2c(c1)CCCC2	764278674	VUJDRZFMOJUHAI-UHFFFAOYSA-N	433.262	1.828	50	20	IDGD	
Cc1ccc(C(=O)N2C[C@@H](C)C[C@H](C)C2)cc1NC(=O)C(=O)NNC(=O)c1c[nH]nc1C	764298165	PRPBIDLTPVGPSR-STQMWFEESA-N	440.504	1.544	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)C(=O)Nc2cc(C(C)(C)C)nn2-c2cccc(Cl)c2)cn1	764359367	QDABMJNYBQDERH-UHFFFAOYSA-N	443.895	1.956	50	20	IDGD	
CC(C)(C)OC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)COCc2ccccc2)cn1	764362346	DSLOUOOEBDKZSR-UHFFFAOYSA-N	443.460	1.731	50	20	IDGD	
CC(C)S(=O)(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)COCc2ccccc2)c1	764368528	XXMBUSPOFFEFSQ-UHFFFAOYSA-N	447.513	1.313	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cc(C)n(CCC#N)n3)n[nH]2)cc1	764384523	CCUCGDSYTHZCJM-UHFFFAOYSA-N	434.460	1.457	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc(F)c(C(N)=O)c3)n[nH]2)cc1	764385170	UPUZJOLGTWMYRQ-UHFFFAOYSA-N	438.419	1.277	50	20	IDGD	
COc1nccnc1NNC(=O)[C@H](CCSC)NS(=O)(=O)/C=C/c1ccccc1	764465509	YIXARMWOJVJCDB-GLNPCMGASA-N	437.547	1.640	50	20	IDGD	
Cc1c(Br)cc(C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c(=O)n1C	764829121	JZBBPPPRWQUSDM-UHFFFAOYSA-N	430.262	1.717	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CC(NC(=O)c3c(C)nn(CCCl)c3C)C2)cc1	765258479	GQVPWAMIRPJSQW-UHFFFAOYSA-N	426.926	1.550	50	20	IDGD	
COc1ccccc1OCCC(=O)NNC(=O)CN1CCN(Cc2ccc(C)cc2)CC1	765749641	ZTPPEDSRLGMYJN-UHFFFAOYSA-N	440.544	1.738	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1ccc(OCc2noc(C3CC3)n2)cc1	766261181	OSKXYBYEJWEBIA-UHFFFAOYSA-N	425.405	1.406	50	20	IDGD	
CNC(=O)C1CN(C(=O)/C(C#N)=C/c2cn(CCC#N)nc2-c2ccc(OC)c(OC)c2)C1	768647726	SAKOXZVNQYKOLY-CXUHLZMHSA-N	448.483	1.592	50	20	IDGD	
COc1ccc(S(=O)(=O)NCCC(=O)NNc2cc(C#N)cc(Cl)n2)cc1OC	768713839	QOBZBJKEQVZYBQ-UHFFFAOYSA-N	439.881	1.436	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)Nc1ccc(C[C@H]2NC(=O)NC2=O)cc1	770633216	XFFKCKIFSQMDJM-BDJLRTHQSA-N	445.863	1.711	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Cc2ccnc(O)c2Br)c2ccccc2c1=O	770813203	DGOKFYUDUJGQCS-UHFFFAOYSA-N	446.261	1.283	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)[C@@H]3CC(=O)N(c4ccccc4F)C3)nc21	770968544	KPJFSZWJSLOXRS-LLVKDONJSA-N	427.440	1.922	50	20	IDGD	
O=C(NCCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1)NNc1c(F)cccc1Cl	771305400	QZQIZURCQSWHSK-UHFFFAOYSA-N	431.833	1.992	50	20	IDGD	
O=C(NNc1ccc(Br)c(F)c1)C1CCN(c2ccc3nnnn3n2)CC1	771681811	GQXTWXBWRKQKFQ-UHFFFAOYSA-N	435.261	1.781	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)c1cccc(CN2C(=O)CNC2=O)c1	772971248	YQPPIZDLONOEDS-LBPRGKRZSA-N	430.848	1.620	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)CS(=O)(=O)Cc1ccc(C#N)cc1	772994713	LFRSLWWZXLOJKG-ZDUSSCGKSA-N	435.889	1.741	50	20	IDGD	
CCOc1ccc2c(c1)[C@@H](NC(=O)NNC(=O)c1csc(N3CCOCC3)n1)CCO2	773131768	MOJPBSJLOBIQKT-HNNXBMFYSA-N	447.517	1.846	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C2=NN(c3ccc(F)cc3)C(=O)CC2=O)cc1OC	773711503	DXJVIHSJFFBCPO-UHFFFAOYSA-N	442.403	1.356	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(Br)cc1F)c1ccc(-n2cnnn2)cc1	775254992	ZBIMCXQQXNZJOE-UHFFFAOYSA-N	441.242	1.187	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN2CCO[C@H](CNC(=O)OC(C)(C)C)C2)cc1C	775850713	OXSAKYIHQJAJPI-CQSZACIVSA-N	440.566	1.605	50	20	IDGD	
COC(=O)c1ccc(C(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)c(F)c1	776206602	WAJVBAVFJTXVTJ-UHFFFAOYSA-N	438.456	1.862	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)C2CCN(C(=O)COc3ccccc3)CC2)nc1C	778424013	JXEGVUIUTSJQON-UHFFFAOYSA-N	441.488	1.722	50	20	IDGD	
Cc1cc(C[C@H](C)NC(=O)NNC(=O)CNC(=O)OC(C)(C)C)n(-c2ccccc2)n1	778705536	LFPJMLAAWNJESV-AWEZNQCLSA-N	430.509	1.967	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)N[C@@H]1CCN(c2ccc(Cl)c(F)c2)C1	778716269	VOEWSMHKJXNSNU-LLVKDONJSA-N	429.880	1.913	50	20	IDGD	
CCOC(=O)c1cnn(-c2cccc(NC(=O)C(=O)NNc3ccc(OC)cn3)c2)c1C	782145167	GCPRPDQZABYLRW-UHFFFAOYSA-N	438.444	1.843	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)CN2C(=O)COc3ccc([N+](=O)[O-])cc32)cc1Cl	782805210	SERHWMGSKZYFRD-UHFFFAOYSA-N	434.792	1.904	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C(=O)Nc2ccc(F)cc2OCC(F)F)nc2ccccc21	782894102	LHZVLOREVBCTDH-UHFFFAOYSA-N	449.389	1.685	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2ccc(-c3cn4ccccc4n3)cc2)CCS(=O)(=O)C1	783428452	WNBFJGUYFOWPEL-FQEVSTJZSA-N	427.486	1.138	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1ccc(Cl)cc1C(F)(F)F	784004706	JYUCCVVKADUYIE-UHFFFAOYSA-N	448.810	1.936	50	20	IDGD	
O=C(NNC(=O)N1CCCN(c2ncccc2F)CC1)c1csc(N2CCOCC2)n1	784060986	LWBJROZUSJIRBS-UHFFFAOYSA-N	449.512	1.081	50	20	IDGD	
N#Cc1ccc(NNC(=O)C(=O)Nc2ccccc2OCCC(N)=O)cc1C(F)(F)F	784239947	LRVJVWCSNBMYLN-UHFFFAOYSA-N	435.362	1.913	50	20	IDGD	
CS(=O)(=O)CCOc1ccc(Cl)cc1NC(=O)C(=O)NNc1ccc(F)cc1	784783302	AUTXOVKELWTVRK-UHFFFAOYSA-N	429.857	1.984	50	20	IDGD	
COc1ccc(NC(=O)c2ccc(NC(=O)C(=O)NNc3ccnc(N(C)C)n3)cc2)cc1	784970158	SCCBBVGEIGPIGF-UHFFFAOYSA-N	449.471	1.885	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)Cn2c(S)nc3ccccc3c2=O)c1C	785288064	WCIAVDLYSGPXRQ-CQSZACIVSA-N	426.498	1.917	50	20	IDGD	
Cn1nccc1COCC(=O)NNC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1	785688813	JIKDFKDKEZKHSC-UHFFFAOYSA-N	431.456	1.646	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NN=C2CCCc3nc(O)c(C(N)=O)cc32)CC1	789021471	YYPHJLBSYZSROV-UHFFFAOYSA-N	446.508	1.625	50	20	IDGD	
O=C(NNc1nc2ccccn2n1)C(=O)Nc1cc(Br)ccc1-n1cccn1	792393918	HYXUYGUJVYDQAI-UHFFFAOYSA-N	441.249	1.759	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)c1ccc(CSc2nncn2C)cc1)N(C)CC(F)(F)F	792787098	LOQIEIIEFPRARQ-NSHDSACASA-N	430.456	1.751	50	20	IDGD	
CN(CC(N)=O)C(=O)c1cccc(NC(=O)C(=O)NNc2ccc(Cl)cc2Cl)c1	793018625	UZUAJWTXNHLNRW-UHFFFAOYSA-N	438.271	1.633	50	20	IDGD	
COc1cccc(C(=O)NNS(=O)(=O)c2ccccc2S(=O)(=O)C(F)F)c1O	794581155	FMUVTZIFRBNDGP-UHFFFAOYSA-N	436.414	1.020	50	20	IDGD	
Cc1cc([N+](=O)[O-])c(S(=O)(=O)NNC(=O)CNC(=O)OCc2ccccc2)cc1C	794597398	SIJOVDDDSSWIHD-UHFFFAOYSA-N	436.446	1.448	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)[C@@H]2CSCN2C(=O)OC(C)(C)C)cc1	794717274	LELCWWHLJFDEKL-AWEZNQCLSA-N	430.552	1.690	50	20	IDGD	
CCC(=NNC(=O)Cc1cc(O)nc(S)n1)c1ccc(Cl)c(S(=O)(=O)NC)c1	794852332	WPUAXHHILRPZFQ-UHFFFAOYSA-N	443.938	1.505	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(N3CCN(C)CC3)c(Cl)c2)n1	797371142	ZHUFWNQKRPHAEM-UHFFFAOYSA-N	430.896	1.195	50	20	IDGD	
Cc1c(CC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)nnn1-c1ccccc1	802065537	DNGZCQUIEDWHKA-UHFFFAOYSA-N	428.474	1.375	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)c2cn(C)nc2-c2cnn(C)c2)c(OC)cc1Cl	802080352	UZIIXFSVZWOLIN-UHFFFAOYSA-N	433.856	1.958	50	20	IDGD	
CC[C@H](C)NS(=O)(=O)c1ccc(C(=O)NNC(=O)Nc2ccc3c(c2)OCO3)cc1	802102892	FBROEBPSZBQNFX-LBPRGKRZSA-N	434.474	1.959	50	20	IDGD	
O=C(c1cc(=O)c2ccc(F)cc2o1)N1CCN(S(=O)(=O)CBr)CC1	803037391	BNTRPEOLQXIWGQ-UHFFFAOYSA-N	433.255	1.372	50	20	IDGD	
CN(C)C(=O)CN1[C@H]2CC[C@H]1CC(NC(=O)NNC(=O)c1cccc(OC(F)F)c1)C2	805066133	VXKXNMAQXIIXNB-GJZGRUSLSA-N	439.463	1.316	50	20	IDGD	
CCc1nnc(NC(=O)[C@@H](C)[C@@H](C)NC(=O)NNc2ccc(-n3ccnc3)nn2)s1	805881175	XNJOCIDSXATJFQ-WDEREUQCSA-N	430.498	1.366	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)C(=O)Nc1nc(C2CCOCC2)cs1	806978575	GQHJXTPGCOLRPX-UHFFFAOYSA-N	427.486	1.778	50	20	IDGD	
C#CC[C@]1(C(=O)NNC(=O)Cc2cn3ccccc3n2)CCCN1C(=O)OC(C)(C)C	809705331	SOAZYBYPLOGNNB-JOCHJYFZSA-N	425.489	1.817	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN[C@@H](C)c1noc(COC(C)C)n1	810120013	LSIXXUIDBHEIFR-NSHDSACASA-N	425.873	1.768	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccccc1C(F)(F)F)NNC(=O)c1ccc(Cl)nc1	810155022	KJNQVHMDBHXDOQ-UHFFFAOYSA-N	436.799	1.493	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)CNS(=O)(=O)c1c(Cl)cccc1Cl	810356407	RQSZFVBYBKERCB-UHFFFAOYSA-N	446.312	1.758	50	20	IDGD	
CC(C)Nc1ccc(S(=O)(=O)NCC(=O)NNc2nccnc2Cl)cc1[N+](=O)[O-]	810408042	SLYRFUWSUIJBOV-UHFFFAOYSA-N	443.873	1.280	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNS(=O)(=O)CC2(C(=O)OC)CCCC2)cc1	811678752	ZAKLLNBGALVLRA-CQSZACIVSA-N	428.507	1.537	50	20	IDGD	
COC[C@]1(CNC(=O)NNC(=O)Cc2nc3ccccc3n2C)OCCc2ccccc21	812478584	XIXXDYQCXAIRPR-QHCPKHFHSA-N	437.500	1.561	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2cc3c(cc2F)CCC(=O)N3)cc1	813034049	WKASYIFOPNHXQV-UHFFFAOYSA-N	449.464	1.043	50	20	IDGD	
CCOc1ccc(NNC(=O)C(=O)Nc2ccc(C(=O)N3CCOCC3)cc2C)cc1	815815850	VCEBYJOXKFISRC-UHFFFAOYSA-N	426.473	1.948	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)c2ccc3c(c2)SC2=NS(=O)(=O)CCN23)cc1	825606672	JHQHNWMTNDIYHP-UHFFFAOYSA-N	445.526	1.480	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)NC3CCCC3)c2)c1	913465162	JPXQWDYINRIZCA-UHFFFAOYSA-N	447.513	2.000	50	20	IDGD	
CCn1c(=O)nc(O)c2c(C(=O)NNC(=O)Cc3c[nH]c4ccccc34)cc(C3CC3)nc21	914333775	RZUAOEAOZASUCW-UHFFFAOYSA-N	446.467	1.879	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)CCc2c(C)c3c(C)nn(C)c3[nH]c2=O)cc1C	914846279	GECHXBUKQKSQPR-UHFFFAOYSA-N	425.489	1.654	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@@H]2C(=O)NNC(=O)c2ccc3c(c2)OCO3)c(OC)c1	915060139	GYCLADDDJYBLQO-MRXNPFEDSA-N	441.440	1.498	50	20	IDGD	
COc1cccc2cc(C(=O)OCC(=O)NNC(=O)[C@@H]3COc4ccccc4O3)oc12	915243294	ITXHKGNOOVJNLB-KRWDZBQOSA-N	426.381	1.586	50	20	IDGD	
O=C(COC(=O)CCOc1cccc(Cl)c1)NNC(=O)[C@@H]1COc2ccccc2O1	915250749	YBCFXJZQZPAKKD-KRWDZBQOSA-N	434.832	1.640	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NC[C@@H](c2cccs2)N(C)C)c2ccccc2c1=O	915898468	XPKSTQHDZSZSEB-HNNXBMFYSA-N	428.518	1.725	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@@H]2C(=O)NNC(=O)Cc2ccccc2OC)c(OC)c1	919822985	YLWUZBQQVIQMQV-GOSISDBHSA-N	441.484	1.707	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)c2ccc(OC)c(S(=O)(=O)N(C)C)c2)cc1	919835626	LEWHBGUVHLPABM-UHFFFAOYSA-N	435.502	1.348	50	20	IDGD	
Cc1cc(C)c(S(=O)(=O)NCCC(=O)NNC(=O)NCCc2cccs2)c(C)c1	920889395	VOFNWQOSRDLHOG-UHFFFAOYSA-N	438.575	1.915	50	20	IDGD	
Cc1cc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)c3ccccc3)CC2)c(C)s1	921062085	UTMQBZRKMWCEEE-UHFFFAOYSA-N	436.559	1.132	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCN(c2cccc(Br)c2)C1=O)c1n[nH]c2c1CCCC2	1115858434	QQLXJCGUPHVISM-AWEZNQCLSA-N	446.305	1.865	50	20	IDGD	
O=Cc1cccc(OCc2cccc(C(=O)NNC(=O)N[C@@H]3CCS(=O)(=O)C3)c2)c1	1251736881	GLRMKZTVDFDHSS-QGZVFWFLSA-N	431.470	1.209	50	20	IDGD	
O=C(Cn1nc2n(c1=O)CCCCC2)NNC(=O)c1cc(F)ccc1Br	1318476711	NRPBQPSVZXVKAH-UHFFFAOYSA-N	426.246	1.134	50	20	IDGD	
COC(=O)c1cc(C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)n(-c2ccccc2)n1	1322777759	BMIXNHURNILRMC-UHFFFAOYSA-N	430.424	1.919	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)c1nc(-c2ccc(F)cc2)n2c1CCCCC2	1337619882	NXNPRAYOOSQERM-AWEZNQCLSA-N	434.493	1.611	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4c(c3)CC(=O)N4)C2)C1	1778393461	LFQVLDYWNRMPDB-OAQYLSRUSA-N	431.565	1.476	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4nncn4c3)C2)C1	1778596998	VILHOIFLIQDNPF-ROUUACIJSA-N	426.304	1.409	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](C)Nc3ccccn3)C2)C1	1779330697	MVFYNKHXOMLHPB-DEYYWGMASA-N	425.327	1.495	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cccnn2)C1	1779657255	JOYXNMOHGBAFTR-DDUZABMNSA-N	425.327	1.778	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2)c1cc(-c2ccncc2)[nH]n1	1779738395	NVZFDTKGGKKAFA-WAOWUJCRSA-N	447.923	1.199	50	20	IDGD	
Cc1c(C(=O)N2CC[C@@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)cn2[nH]cnc(=O)c12	1780016681	MYLSTXZQIIVHQJ-HXUWFJFHSA-N	435.912	1.040	50	20	IDGD	
C/C=C(\C)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1	1780098075	AXKCHKYTMQXDNV-UQTPNQFZSA-N	431.445	1.930	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2)c1cc(-c2ccccc2)[nH]n1	1780148814	UJYLYMLSWRPNAC-NNMXDRDESA-N	446.935	1.804	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c(C)c1	1780587104	BLQWHHWJZOUIKX-HSZRJFAPSA-N	437.500	1.059	50	20	IDGD	
COc1cc(OC)cc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)c1	1780663038	SHVNWSKUIBPCHH-QAPCUYQASA-N	445.285	1.838	50	20	IDGD	
CN(C)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781327785	AANJRFAXSALCGR-WMLDXEAASA-N	429.290	1.282	50	20	IDGD	
Cn1cc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)c(C(F)F)n1	1781329755	JMFAWOJKXDMKHO-ABAIWWIYSA-N	439.232	1.492	50	20	IDGD	
O=C(c1cn2ccccc2n1)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781329871	MFPPPIADSXFLNU-RHSMWYFYSA-N	425.258	1.468	50	20	IDGD	
O=C(c1cn2c(F)cccc2n1)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781332273	FLNXXPXGFWZTAS-YOEHRIQHSA-N	443.248	1.607	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCc1c(C)noc1C)C2	1782170877	DKMCSXWXBYJZQS-DBXWQHBBSA-N	441.956	1.992	50	20	IDGD	
COc1cc(F)ccc1CC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2	1783305994	LQNPJNYRWFPHTR-HGHGUNKESA-N	442.915	1.490	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(C(F)(F)F)nn3C)CCO2)C1	1783877037	DMDDLTPHRVVQRI-ZBEGNZNMSA-N	438.834	1.136	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H]1CCCCC1(F)F)CCO2	1783933194	DVPYWIMHBDECJR-DNVCBOLYSA-N	430.496	1.015	50	20	IDGD	
CCOC(=O)/C=C/C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]2C1	1783967972	OJCHJZYISKJISW-KHEBKASOSA-N	431.327	1.116	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](C)Cn3ccnc3)C2)C1	1784506038	LSCAHGCTNXJJKT-RVKKMQEKSA-N	427.343	1.523	50	20	IDGD	
O=C(Cc1c(F)ccc(F)c1F)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21	1784832711	RCDBZODSSNQPOQ-LVLWZLKYSA-N	434.842	1.226	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)c1cnnc(Cl)c1	1785446052	MHDUTUVLUURTHG-DRZSPHRISA-N	431.718	1.508	50	20	IDGD	
CCn1nc(C)cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21	1787289539	DKDGGHUDIKJUBW-NZBPQXDJSA-N	431.306	1.495	50	20	IDGD	
O=C(NC1(c2ccc(NC(=O)[C@H](O)c3ccccc3)cc2)CCC1)c1ccc(B(O)O)cc1	1787857548	HYPIWXPXCMGZIX-JOCHJYFZSA-N	444.296	1.848	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc4n(n3)CCCO4)[C@H]2C1	1788352970	WGHPIASCNQVDBV-NGOJXBLDSA-N	445.347	1.495	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccn4cncc4c3)[C@H]2C1	1788404803	KDXSBASBAYHGIS-KCMWZYNZSA-N	449.349	1.959	50	20	IDGD	
CC[S@@](=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)CBr)C[C@@H]21	1788485288	UGTSBUVPHOIQFI-CAVVLOLHSA-N	437.400	1.156	50	20	IDGD	
COc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Cl)C[C@@H]32)c([N+](=O)[O-])cc1O	1789270932	HRXNINGRIQBVKO-PVYXACFKSA-N	445.831	1.437	50	20	IDGD	
Cc1nccn1[C@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]2C1	1789927284	SYZVUAIMMGKVPZ-BFYSQQLMSA-N	431.306	1.423	50	20	IDGD	
CCc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](Br)CC)[C@H]3C2)n(C)n1	1790960643	PITGCWBQDLTVRN-FAYQHZLMSA-N	441.370	1.749	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3n[nH]c4c3CC[C@H]4C)C[C@@H]21	1791055971	LBSBZOCQANBECN-SQLGEJSKSA-N	439.354	1.836	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3c[nH]c4ncccc34)C[C@@H]21	1791256686	VCLFVYHXDADXHX-KANFNMMFSA-N	448.951	1.729	50	20	IDGD	
Cc1cnn([C@@H](C)C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Br)C[C@@H]32)c1	1791597587	QZXIQUPQSNPECR-YYFQZIEXSA-N	431.306	1.423	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc([N+](=O)[O-])o1	1792350978	WHUYLGJUTLNQFV-DYNIEEOBSA-N	430.255	1.422	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(Cl)cnc1O	1792387654	GFQHGZLRJIRMOP-DRXBFXEBSA-N	427.961	1.495	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc3[nH]ncc13)C2	1792867891	KARJFSZFBKNVPM-JRATXPSKSA-N	435.322	1.797	50	20	IDGD	
COc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)CBr)cn1	1792868650	JCAWNRWTTUXFIW-OEYIWLLWSA-N	426.311	1.324	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Oc1ccccn1)C2	1792873112	LWJAADFXWXQRGG-WVCIDPQESA-N	440.338	1.470	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(-c3cccnc3)cc1)C2)[C@H](O)CCl	1792979672	AXEQHGFQMCHLFT-IYWMVGAKSA-N	429.904	1.552	50	20	IDGD	
CC(C)Oc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](O)CCl)cc1Cl	1792980054	KLOASILPAMJCOY-CXHZTBPHSA-N	445.343	1.930	50	20	IDGD	
CS(=O)(=O)c1ccc(F)c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](O)CCl)c1	1793115009	VFNFNECJFAPQRM-BUWBCJGYSA-N	432.901	1.081	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](O)CCl)C2)C1CC1	1793211256	FFLOTHGPRDRDGB-ZHCJQAHYSA-N	443.972	1.918	50	20	IDGD	
COc1ccnc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCBr)c1OC	1795114896	JIWPGYZAQHYXQI-JJLQDPRZSA-N	442.310	1.087	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCc1ccccc1Cl)c1ccc(B(O)O)cc1	1795738329	VUXRMUWUISXRET-ACDBMABISA-N	440.736	1.904	50	20	IDGD	
N=C(N)NCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](Br)Cc1ccccc1)C2	1795985132	BSDYITGGRSIXKE-FZKCQIBNSA-N	436.354	1.114	50	20	IDGD	
C=C[C@@H]1C[C@]1(NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Cl	1796371323	VCSRYHDVGWSAHC-RNCJLBHCSA-N	445.919	1.580	50	20	IDGD	
O=C(CCN1C(=O)Cc2ccccc2C1=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](F)Cl	1796804269	JGEDPABLCUSQED-YGTYGHESSA-N	435.883	1.774	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2cccnc2s1)c1ccc(B(O)O)cc1	1797421443	NUJGGHQCLLOIFY-BCDXTJNWSA-N	435.314	1.542	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)n1ccccc1=O	1797930799	BGUMUAOIFONUDC-SVZOTFJBSA-N	440.338	1.030	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(Cl)nc1)C2	1798440393	ZVXFGFJLHUHMFB-BTTYYORXSA-N	428.880	1.299	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccoc1Cl	1798771544	OXNHAFQMVDGXBG-NNGSTNBRSA-N	447.879	1.270	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CC(C)(C)C(=O)OC(C)(C)C	1799042471	UNSVKFKRGPMJMO-JYYAWHABSA-N	446.972	1.588	50	20	IDGD	
Cn1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@](C)(Cl)CCl)c(C(F)F)n1	1799275434	RVCPZBJWWUNWIW-LLOSTOMTSA-N	439.290	1.797	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1Cc3ccccc3C1)C2)[C@H](F)Br	1799349654	ALXWLBANHAOFFS-YVSFHVDLSA-N	425.298	1.682	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)CN(CC)CC	1800225960	LOBQAKNOQYMMSW-NQNKBUKLSA-N	432.403	1.727	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1cncnc1)C2	1800638999	FYAIOPAHDYUPPQ-IVSAIRAKSA-N	425.327	1.172	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1n[nH]c(C3CC3)c1F)C2	1800639194	JZZVUJAXQARHNS-GFQSEFKGSA-N	443.317	1.803	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccn3cncc13)C2	1800642004	QPMPRIUBCXFEOO-IARIHHJXSA-N	435.322	1.711	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](OC(C)=O)C(C)C)C2	1800642138	YGRHFQXNCBPXOF-XFIYOXNOSA-N	433.343	1.337	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1cc(F)cc(F)c1F	1801769448	XRLIOTIXMXVZHI-NVIQENEESA-N	439.203	1.998	50	20	IDGD	
Cc1nn[nH]c1C(=O)N1CC[C@H](CNC(=O)[C@@H](C)CBr)[C@H]1c1cccnc1	1803009806	XZRKKAULULOHRW-SGIREYDYSA-N	435.326	1.859	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2nnsc2C2CC2)[C@@H]1c1cccnc1)[C@H](O)CCl	1803139487	PZIIXTHFSAGGSW-SQWLQELKSA-N	435.937	1.730	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC2(CCCN(C(=O)c3ccc([N+](=O)[O-])o3)C2)CC1	1804650127	OQYWDZOGOPTXFJ-UHFFFAOYSA-N	441.249	1.026	50	20	IDGD	
CC[C@H](C)[C@@H](O)C(=O)N1CCCC2(CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CC2)C1	1806074284	OXFAJJLGBNKSSC-PQDUPZBMSA-N	445.564	1.759	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)c1cccc2c[nH]nc12	1808056023	XHLLCIWKENYTFC-VDZJLULYSA-N	427.892	1.877	50	20	IDGD	
Cc1cc(C(=O)N2CCCC3(CCN(C(=O)c4cnccc4C(=O)NN)CC3)C2)on1	1808414757	HCNNSIZLJXMZJU-UHFFFAOYSA-N	426.477	1.140	50	20	IDGD	
O=C(c1cc2cccnn2c1)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1	1809980146	JJLMOFWOYOPGON-UHFFFAOYSA-N	446.316	1.173	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)CC(F)(F)F)[C@H]1c1cccnc1	1813071886	VSUSWHCTVNSPPR-KDOFPFPSSA-N	429.443	1.413	50	20	IDGD	
C[C@H](CBr)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN2CCOC2=O)[nH]n1	1814778364	GJFZGMVAQAPMRW-YPMHNXCESA-N	442.314	1.885	50	20	IDGD	
Cc1cc(CC(=O)Nc2cc([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)nn1C	1814990121	AOLGHFMNIMYKTK-QGZVFWFLSA-N	444.540	1.059	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@H]1CCc2nc(NC(=O)c3nc[nH]c3[N+](=O)[O-])sc2C1	1817198733	ISINFLGWLLIJTI-VIFPVBQESA-N	438.542	1.852	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)C2CC(O)C2)[nH]n1	1818110869	REYDWDZZPCSCLT-ASHLQDHDSA-N	441.492	1.307	50	20	IDGD	
CCOC(=O)N[C@H](O)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](C)Br)[nH]n1	1819244453	VDGCKBURINIDOG-DRCTWCGVSA-N	446.302	1.250	50	20	IDGD	
C=CC[C@H](C(=C)C)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2	1819598126	UJSUZKWPHGHIFQ-IAGOWNOFSA-N	439.346	1.817	50	20	IDGD	
Cc1nc(C)c(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)o1	1819799192	ACFRAYGDXRTXSI-KRWDZBQOSA-N	437.265	1.314	50	20	IDGD	
CC(=O)N1CCN(CC(=O)N2CCCC[C@@H]2c2cc(NC(=O)C(Cl)Cl)n[nH]2)CC1	1822422430	VVSVMYDNSUBNIX-CQSZACIVSA-N	445.351	1.370	50	20	IDGD	
CC(C)NC(=O)OC(C)(C)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](O)CCl)CC2	1822574207	FECMDBGTWCIVOV-CMPLNLGQSA-N	446.957	1.568	50	20	IDGD	
CC[C@H](NC(C)=O)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1	1822999604	VENMBKOMVXDLAY-VDDIYKPWSA-N	435.319	1.660	50	20	IDGD	
C[C@]1(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)CC1(F)F	1823393694	KTFNNVFYBNRLIL-DNVCBOLYSA-N	432.236	1.441	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H]1CCc3nc[nH]c3C1)CC2	1826008824	IAJZOVSIXBZKPF-SRVKXCTJSA-N	437.953	1.837	50	20	IDGD	
C[C@@H](C(=O)N[C@@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1)c1ccccn1	1826092181	PUPBAYLTSWGAGI-ZIAGYGMSSA-N	444.561	1.627	50	20	IDGD	
CCC[C@H](NC(C)=O)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](Cl)COC)CC2	1828131441	BZFJYAGRVUOBEJ-DYEKYZERSA-N	430.958	1.614	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2csnn2)CC1	1828923375	GVIMNLJIXJNNQO-KRWDZBQOSA-N	443.533	1.084	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCCn3ccnc3)C2)C1	1830370195	LLXVRFGOYLWGKN-HXUWFJFHSA-N	426.945	1.385	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CN3CCC(C)CC3)CCO2)C1	1831097774	BQXBWSWIVVDPPB-WIYYLYMNSA-N	429.989	1.582	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3c(O)cc(O)cc3O)C2)C1	1831654091	QHKVZOAZAAISPJ-VBKZILBWSA-N	442.896	1.281	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)C34CC(C(=O)OC)(C3)C4)C2)C1	1831657980	RUPCTCJGORSSGE-SDDUFFJTSA-N	442.940	1.194	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccn(C(C)(C)C)n3)CCO2)C1	1833582695	MHOPJDPJUUHCGD-NRFANRHFSA-N	440.972	1.973	50	20	IDGD	
Cc1cc(CCC(=O)NC2CCN(C3CCN(C(=O)[C@H](O)CCl)CC3)CC2)ccn1	1833744119	ADBKXVNAJJDPJV-HXUWFJFHSA-N	436.984	1.494	50	20	IDGD	
CCc1cc(C(=O)NC2CCN(C3CCN(C(=O)[C@H](O)CCl)CC3)CC2)cc(C)n1	1835238059	AEHCOHDIGHNLQR-HXUWFJFHSA-N	436.984	1.737	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(-n4cnnc4)cc3)CCO2)C1	1835498510	JGYQICLGKROEIW-RXVVDRJESA-N	447.923	1.355	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)c1c(F)cncc1F	1835995582	KBGWIEAEYHOUJB-MRXNPFEDSA-N	430.883	1.145	50	20	IDGD	
O=C(CCc1ccc[nH]1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1836015964	NPMBAUYNRLMKGA-RDJZCZTQSA-N	432.290	1.094	50	20	IDGD	
CC(C)(C)[C@@H](O)C(=O)N1CCC(N2CCC(NC(=O)[C@H](F)Br)CC2)CC1	1836413707	MLUQLHNWTOTHEY-GJZGRUSLSA-N	436.366	1.656	50	20	IDGD	
O=C(Cc1cccc(Cl)n1)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836715307	PFGOFOMNJPWAQG-KRWDZBQOSA-N	444.359	1.876	50	20	IDGD	
O=C(CCBr)N1CCC(OC2CCN(C(=O)Cc3cncnc3)CC2)CC1	1837196050	YHJLXYGBWPUSGV-UHFFFAOYSA-N	439.354	1.803	50	20	IDGD	
C/C(=C\c1ccc(C)o1)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1	1837575856	FWQKZHJQUKOHIM-YZDOQNMSSA-N	426.897	1.047	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3n[nH]c4c(F)cccc34)C2)C1	1839145974	SJBFUZTUUJFRMI-VLIAUNLRSA-N	438.887	1.789	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccccc3-n3nccn3)C2)C1	1839147241	KSOZAPVEHILKSA-LAUBAEHRSA-N	447.923	1.355	50	20	IDGD	
O=C(/C=C/c1ccoc1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839199664	ZIKPFFXVAFKHTC-YSCDTDAQSA-N	431.258	1.440	50	20	IDGD	
O=C(c1ccccc1F)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839202254	YQZWSIDXJUGFRZ-PBHICJAKSA-N	433.249	1.586	50	20	IDGD	
CC(C)C1(C(=O)N2CCOC[C@]3(CN(C(=O)[C@@H](F)Br)CCO3)C2)CCC1	1839203659	RKKFWVZBKYJSEH-PBHICJAKSA-N	435.334	1.960	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccc(F)cc3)C2)C1	1840151897	QOQZMCIGFCXVIA-XLIONFOSSA-N	428.888	1.078	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)/C(C)=C/c3ccc(C)o3)C2)C1	1840153171	GQEKLNVICNEGQV-LJGRONJBSA-N	440.924	1.702	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)n1cc(C)cn1)CCO2	1840402497	FYXJDMLSLGUDPM-ABSDTBQOSA-N	426.945	1.616	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](O)[C@@](C)(C(=O)N2CCCC23CN(C(=O)[C@H](F)Cl)C3)C1	1841030577	KOWJTCOTHZOTPO-NJSLBKSFSA-N	447.935	1.732	50	20	IDGD	
O=C(CCBr)N1CC2(CCCN2C(=O)[C@@H]2CC(=O)N(C3CCCC3)C2)C1	1841857700	OUNHIDWDWORCML-CQSZACIVSA-N	426.355	1.766	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1ccc3[nH]ccc3n1)C2	1843416246	OICKFEJYVQVGHN-VULFUBBASA-N	433.472	1.514	50	20	IDGD	
COc1cc(C)c(C(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)c(C)c1	1844265043	OCRKRFMZHIKBPI-UHFFFAOYSA-N	437.500	1.441	50	20	IDGD	
CC(=O)N(C)[C@@H](C)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1848099926	CNGKWPFKFIPFOK-TUUVXOQKSA-N	444.960	1.187	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)[C@@H](NC(C)=O)C1CCCC1	12837575	SQZUZPWJXYRFID-KRWDZBQOSA-N	425.869	1.348	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)[C@H]2CC(=O)N(c3ccc4c(c3)OCCO4)C2)cc1C	15886444	FICVOJMQEAHSIS-INIZCTEOSA-N	439.468	1.654	50	20	IDGD	
COc1ccc2cc(C(=O)NNC(=O)c3csc(N4CCOCC4)n3)c(C)nc2c1	27083951	RAYHJUYCOJTOEN-UHFFFAOYSA-N	427.486	1.920	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1OC(F)F	46900085	QCQGRVFNJBFAAK-UHFFFAOYSA-N	443.428	1.622	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)N2CCN(Cc3cc(=O)n4ccsc4n3)CC2)cc(C#N)n1C	218420744	QWOSJKVIZZMJLF-MFOYZWKCSA-N	447.524	1.526	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NCC1CCN(Cc2cccs2)CC1	726249488	HUHYCUPKVAHJPZ-UHFFFAOYSA-N	435.575	1.782	50	20	IDGD	
COCCCN1CCC(NC(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)CC1	727031374	RAVRPHYLMZXVNL-UHFFFAOYSA-N	444.536	1.422	50	20	IDGD	
COc1ccc(CCNC(=O)NNC(=O)COc2ccccc2C#N)c(OC)c1OC	727946290	VQKXIKJGJGLPJV-UHFFFAOYSA-N	428.445	1.536	50	20	IDGD	
CCn1cc(CC(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c2ccccc21	728340744	PUJXLCLMBZTOHM-FQEVSTJZSA-N	437.452	1.734	50	20	IDGD	
CC(=NNC(=O)C1CCN(c2ncccn2)CC1)c1ccc(S(=O)(=O)N(C)C)cc1	728783292	IGDKTJWYVGGGOW-UHFFFAOYSA-N	430.534	1.484	50	20	IDGD	
COc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NNC(=O)c2cccc3ncccc23)cc1	730226108	CALHCBHTCHAHBU-ZDUSSCGKSA-N	428.470	1.371	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)CS(=O)(=O)Nc1ccc(N2CCCCC2)cc1	731344567	RSVILRRLDDDDFW-UHFFFAOYSA-N	448.520	1.948	50	20	IDGD	
O=C(NCCCCN1C(=O)c2ccccc2C1=O)NNC(=O)c1cc(Br)c[nH]1	732236502	XTEHMTVSEHEUNW-UHFFFAOYSA-N	448.277	1.798	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)NCCC(=O)NNc2nc(-c3ccccc3)no2)cc1	733361186	SWXGRUKSZLURFC-UHFFFAOYSA-N	444.473	1.507	50	20	IDGD	
COc1ccc(C)cc1-n1ccc(C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)n1	734241173	GKKOHRQGBAMSCK-UHFFFAOYSA-N	432.481	1.658	50	20	IDGD	
C[C@H]1CN(Cc2ccc(C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)cc2)C[C@H](C)O1	734241295	MARLRMGHBUXKNU-HOTGVXAUSA-N	449.552	1.765	50	20	IDGD	
COc1ccc(CN2CC[C@@H](NC(=O)NNC(=O)c3ccc4c(c3)OCCO4)C2=O)cc1	734541366	HOZHFDOCJVCZNI-QGZVFWFLSA-N	440.456	1.212	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)n2nc(C)cc2n1	734825519	IWEYKVLNELCYMO-UHFFFAOYSA-N	431.497	1.690	50	20	IDGD	
CC(C)C(=O)N1CCCC[C@@H]1C(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	734826059	VJDLNTIRLIPNPQ-MRXNPFEDSA-N	439.557	1.753	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)C2CCN(S(=O)(=O)c3ccc(F)c(Cl)c3)CC2)cn1	735449058	DPGSIFZRAJVSTJ-UHFFFAOYSA-N	443.888	1.075	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NCC(=O)NNc2ccc(Cl)nn2)c1	735687607	SEKUCIABIPMRAE-UHFFFAOYSA-N	440.913	1.034	50	20	IDGD	
CCc1ccc(O[C@@H](C)C(=O)N2CCN(CC(=O)NNC(=O)c3ccccc3)CC2)cc1	736622019	NKEUMBALNTUPJP-SFHVURJKSA-N	438.528	1.622	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)NCCCCN1CCN(C)CC1	737064117	CZYCVMKYVDDPSC-SFHVURJKSA-N	427.549	1.965	50	20	IDGD	
O=C(Oc1ccc([N+](=O)[O-])cc1Br)[C@@H]1CC(=O)N([C@@H]2CCS(=O)(=O)C2)C1	739311488	QBZMPBOWBZOLSQ-MWLCHTKSSA-N	447.263	1.298	50	20	IDGD	
Cc1nc(S(=O)(=O)N2CCC(C(=O)NNc3cccc(C(F)(F)F)n3)CC2)cn1C	740132623	NVPKOTFWTLEQDF-UHFFFAOYSA-N	446.455	1.686	50	20	IDGD	
CSc1ccc(O[C@@H](C)C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1	740996153	QKZGRCYFRZKTMA-SCLBCKFNSA-N	446.481	1.706	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccc(Cl)cc3)CC2)cc1	744386996	SZVQXZZBKRYLFG-UHFFFAOYSA-N	425.876	1.431	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2ccc(C(=O)NCC(C)(C)C)cc2)n1	745183129	OUSPRUISLVPDMS-UHFFFAOYSA-N	446.529	1.774	50	20	IDGD	
Cc1ccc(N2CCC[C@H](NC(=O)NNC(=O)c3nnc(O)c4ccccc34)C2=O)cc1	745881523	QDLXGNZYLOQUAZ-KRWDZBQOSA-N	434.456	1.783	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)N[C@H]2C[C@H](C)N(c3cnn(C)c3)C2=O)cc1	745919304	SCZYEQNEHCIQCN-IYOUNJFTSA-N	444.492	1.111	50	20	IDGD	
CN(C)[C@H](C(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)c1c(F)cccc1Cl	746096954	SMXWUOJRIDXKLF-KRWDZBQOSA-N	431.855	1.790	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)NCCNS(=O)(=O)c2cccnc2)c1C	746270573	GVLKHKNJRFMRTI-PDGQHHTCSA-N	431.518	1.148	50	20	IDGD	
COC(=O)c1ccsc1N1CC[C@@H](NC(=O)NNC(=O)Cc2ccccc2F)C1=O	746782942	ZQWHRYOKQWQTDZ-CQSZACIVSA-N	434.449	1.352	50	20	IDGD	
Cn1cc(CCNC(=O)NNC(=O)[C@H]2Cc3ccccc3CN2Cc2ccccc2)cn1	747979531	ITFKYFKAORQEIT-JOCHJYFZSA-N	432.528	1.920	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)Cc1ccc(S(N)(=O)=O)s1	748594034	NXWYZGTYMITMEO-UHFFFAOYSA-N	446.576	1.158	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)CNC(=O)CC2CCCCC2)cc1	748696598	MUTISWRFJKSZPJ-UHFFFAOYSA-N	444.561	1.955	50	20	IDGD	
COc1cc(S(=O)(=O)NNC(=O)c2ccc3c(c2)OCCO3)c(Cl)cc1C(=O)O	749144809	YCSSCUSQQUVNMK-UHFFFAOYSA-N	442.833	1.441	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)NC1CCN(c2cc(C)nc(C)n2)CC1	749615725	KXSULDLOFRIPSR-UHFFFAOYSA-N	428.493	1.480	50	20	IDGD	
Cn1cnc2cc(C(=O)NNC(=O)CN3CCN(Cc4ccccc4Cl)CC3)ccc21	753655871	OCEHYIXARHWQRS-UHFFFAOYSA-N	440.935	1.806	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NN=Cc2ccc3c(c2)oc(=O)n3C)c1	754900540	JICXIUZYVASXPO-UHFFFAOYSA-N	430.486	1.926	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)Nc2ccc(S(=O)(=O)C(F)F)cc2)c1	755443638	ILHONYWPFOAWGY-UHFFFAOYSA-N	427.389	1.503	50	20	IDGD	
CCOc1ccc(NC(=O)NNC(=O)c2cnn(C)c2)cc1S(=O)(=O)N1CCCC1	755472886	YVECYKPYJLOPBY-UHFFFAOYSA-N	436.494	1.070	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)Nc1cccn(Cc2ccc(F)cc2)c1=O	755837992	QUHDOMRRFIBVCO-UHFFFAOYSA-N	426.404	1.973	50	20	IDGD	
Cc1cnn(Cc2cc(C(=O)NNC(=O)NC3CCN(C(=O)OC(C)(C)C)CC3)no2)c1	755901571	AUBOKZXJAWVMMC-UHFFFAOYSA-N	447.496	1.571	50	20	IDGD	
CCOc1ccc([C@H](C)NC(=O)CCCNC(=O)NN[C@@]2(C)CCS(=O)(=O)C2)cc1	756127593	ZXRYRWLLZYBLJF-YWZLYKJASA-N	440.566	1.424	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccc(C(N)=O)c(C)c2)c1	756399727	GBAUQSNYDAIHSP-UHFFFAOYSA-N	447.517	1.591	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)cc2)CCO1	756684415	JJSLRJRUYUGIQX-AWEZNQCLSA-N	432.502	1.782	50	20	IDGD	
CCCNS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2cc(OC)cc(OC)c2)cc1	756777098	UUQYWMAGZQDTTH-UHFFFAOYSA-N	436.490	1.859	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)c1cn(-c2ccc(Br)cc2)cn1	756785259	CHWCDLBWQDRCIM-UHFFFAOYSA-N	443.261	1.221	50	20	IDGD	
C[C@](O)(CN1Cc2ccccc2C1=O)C(=O)NNC(=O)CSc1ccc(Cl)cc1	756797616	QOBZLOWOMMXYEU-FQEVSTJZSA-N	433.917	1.987	50	20	IDGD	
CCCOc1cccnc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	757768397	VOTJFNBAXKHXFC-UHFFFAOYSA-N	432.502	1.730	50	20	IDGD	
O=C(Cn1cnc2ccccc21)NNC(=O)c1ccc(Br)cc1-n1cncn1	758069747	WUVOAMLKSPYTOH-UHFFFAOYSA-N	440.261	1.841	50	20	IDGD	
O=C(COC(=O)c1ccc(Br)cc1-n1cncn1)NNC(=O)c1ccccc1	758777443	LGROURWDFOTEFJ-UHFFFAOYSA-N	444.245	1.648	50	20	IDGD	
CO[C@@](C)(C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1)c1ccccc1F	759294928	QLQMLOXNJWNJMU-LAUBAEHRSA-N	432.404	1.218	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)c2ccc(N3CCN(C(C)=O)CC3)c([N+](=O)[O-])c2)nc1	759721320	GZBPNSHYCJXPBJ-UHFFFAOYSA-N	442.432	1.202	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2ccc3c(c2)NC(=O)[C@@H](C)S3)n1	759847820	GJQHHOXYEBEJDV-SNVBAGLBSA-N	434.499	1.431	50	20	IDGD	
NC(=O)[C@H]1CC[C@H](CNC(=O)NNC(=O)COc2ccc(OCc3ccccc3)cc2)O1	760204253	PEULQLWBXWJVRV-RTBURBONSA-N	442.472	1.008	50	20	IDGD	
O=C(NCCOc1ccc(C(F)(F)F)cn1)NNC(=O)[C@@H]1COc2ccccc2O1	760835717	IHPIDOHXAQQEEZ-AWEZNQCLSA-N	426.351	1.650	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)CCc2nc(C3CCCC3)no2)c1	761783765	CBWKULGQPFNPKH-UHFFFAOYSA-N	435.506	1.371	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNS(=O)(=O)c2cc(F)c(C)cc2F)cc1	762600785	ROLFDJIJMGDKSV-UHFFFAOYSA-N	447.485	1.212	50	20	IDGD	
O=C(NNC(=O)c1ccccc1)C(=O)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1	763420640	UXCWHTUBRBBNLE-UHFFFAOYSA-N	430.486	1.261	50	20	IDGD	
O=C(NNC(=O)c1ccncc1)C(=O)Nc1cc(Br)ccc1N1CCOCC1	763464524	PRMOHFNHZIVWFU-UHFFFAOYSA-N	448.277	1.080	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1cccc(OC[C@@H]2CCCO2)c1	763472531	WNYZCIJNGNCEKQ-KRWDZBQOSA-N	428.401	1.552	50	20	IDGD	
CCOc1ccc(OC)cc1NC(=O)C(=O)NNC(=O)c1cc(OC)c(OC)c(OC)c1	763540146	SKCQKFYDTARMTF-UHFFFAOYSA-N	447.444	1.519	50	20	IDGD	
O=C(NNC(=O)C1CC1)C(=O)Nc1cccc(CS(=O)(=O)c2ccc(F)cc2F)c1	763561380	GBRRZDLRVXWWND-UHFFFAOYSA-N	437.424	1.435	50	20	IDGD	
O=C(NNC(=O)c1ccccc1F)C(=O)Nc1ccnc(OCC(F)(F)C(F)F)c1	763569080	WBNSIKDJMXFQCM-UHFFFAOYSA-N	432.305	1.900	50	20	IDGD	
CC(C)CC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1	763572132	PUWYMGCZLHAAKB-GOSISDBHSA-N	440.456	1.597	50	20	IDGD	
CC(=O)Nc1c(C)ccc(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1C	763575571	XPYWACDDGKWWNV-KRWDZBQOSA-N	426.429	1.188	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)COc2cc(C)cc(C)c2)cc1	763648673	GBFQPJDHPNEFJO-UHFFFAOYSA-N	448.501	1.230	50	20	IDGD	
CCNC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)COc2ccc(C)c(C)c2)c1	763679175	HSGZFOJQFDRZDW-UHFFFAOYSA-N	427.461	1.610	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)C(=O)Nc1ccc2c(c1)CC(=O)N2	763695025	NKMVDDXWTDZAKW-UHFFFAOYSA-N	447.245	1.109	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2nnc(O)c3ccccc23)c(Br)c1	763790525	KAYCEYVMXFULMJ-UHFFFAOYSA-N	444.245	1.806	50	20	IDGD	
CCCOc1cc(F)ccc1NC(=O)C(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	763790636	MBWSTJSMUGFUJW-UHFFFAOYSA-N	441.419	1.261	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)C(=O)Nc1cccc(-c2cnco2)c1	763803171	IHMWRWAGAOMPJZ-UHFFFAOYSA-N	425.357	1.415	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(S(=O)(=O)C(F)F)cc2)cc1	763820381	GMNWCAMYTLOYQI-UHFFFAOYSA-N	441.412	1.156	50	20	IDGD	
COC(=O)NCc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)cc1	763847660	DVZOVVDVHXNSQE-OAHLLOKOSA-N	442.472	1.713	50	20	IDGD	
CO[C@H]1Cc2ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc3ccc(C(C)=O)cc3)cc2C1	763871155	DWHBXKKTCTXPHA-XOBRGWDASA-N	439.468	1.556	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cc3c(cc2F)CCC(=O)N3)cc1OC	763901176	GTPFICULXIYBRQ-UHFFFAOYSA-N	444.419	1.517	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc(S(=O)(=O)N(C)C(C)C)cc1	763957643	HYRNNPFBAFHOBI-UHFFFAOYSA-N	432.502	1.424	50	20	IDGD	
O=C(NNC(=O)c1cc(Cl)ccc1O)C(=O)Nc1cccc(N2CCCCC2=O)c1	763973569	BEIZGSAEBYLVPZ-UHFFFAOYSA-N	430.848	1.962	50	20	IDGD	
CC(C)Cn1cc(NC(=O)C(=O)NNC(=O)c2ccc(F)cc2Br)cn1	764084068	DIWHRAAYNJIXJX-UHFFFAOYSA-N	426.246	1.840	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccccc2N2C[C@H](C)O[C@H](C)C2)c(O)c1	764110585	RBYVPCRDRKMARE-GASCZTMLSA-N	426.473	1.714	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)CC(F)(F)F)cc1OCc1cccnc1	764116917	PIAPQWYLCJZSGU-UHFFFAOYSA-N	426.351	1.708	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2cc(N3CCCC3=O)ccc2F)c1O	764132629	OKEWVFPGAULKFL-UHFFFAOYSA-N	430.392	1.066	50	20	IDGD	
Cc1nc(COc2ccc(NC(=O)C(=O)NNC(=O)[C@H]3Cc4ccccc4O3)cc2)no1	764168521	QHOROWIVHKYYAM-QGZVFWFLSA-N	437.412	1.047	50	20	IDGD	
Cc1cc(C(=O)NC2CCCC2)ccc1NC(=O)C(=O)NNC(=O)c1ccc(C#N)cc1	764182671	OPLWWXFDYXUAMN-UHFFFAOYSA-N	433.468	1.939	50	20	IDGD	
O=C(CCc1ccccc1)NNC(=O)C(=O)Nc1cccc(C(=O)NCc2ccccn2)c1	764192888	MHMRGORJXQFYQN-UHFFFAOYSA-N	445.479	1.730	50	20	IDGD	
CCOC(=O)[C@@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)CC(C)(C)C)cc1F	764197502	AZBWBEOZHZNICX-LLVKDONJSA-N	438.456	1.029	50	20	IDGD	
CCCOc1ccccc1NC(=O)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	764266513	KXCCHZGKMMCWFK-UHFFFAOYSA-N	426.477	1.268	50	20	IDGD	
COc1ccc(Cl)c(NC(=O)C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1	764267031	RDINXSGQKBPJRY-UHFFFAOYSA-N	432.868	1.141	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(-c3nnc(C)o3)c2)c(OC)c1	764283831	GOSFCDISZILECN-UHFFFAOYSA-N	425.401	1.462	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)C(=O)Nc1sc2c(c1C(=O)OC(C)C)CC[C@H](C)C2	764297587	CHCVRTFEWWEOSO-JTQLQIEISA-N	447.517	1.869	50	20	IDGD	
O=C(CCCc1cccs1)NNC(=O)C(=O)Nc1ccc2nc3n(c(=O)c2c1)CCC3	764340233	WHGBMPZZRQPRDS-UHFFFAOYSA-N	439.497	1.513	50	20	IDGD	
CSc1nnnn1-c1cccc(NC(=O)C(=O)NNC(=O)CCCc2cccs2)c1	764341591	PJOAATCENMZYHF-UHFFFAOYSA-N	445.530	1.555	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccncc2)cc1OCC(F)(F)F	764352812	BQKVUCMMFUPJHO-UHFFFAOYSA-N	426.351	1.360	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)c2cnn(C)c2)sc2c1CC[C@@H](C)C2	764358250	HVOPWCPPLLQLGZ-SNVBAGLBSA-N	433.490	1.183	50	20	IDGD	
COc1ccc(NC(=O)c2ccc(NC(=O)C(=O)NNC(=O)c3cnn(C)c3)cc2)cc1	764359308	QYXRIGUIJQHNMY-UHFFFAOYSA-N	436.428	1.081	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COCc2ccccc2)ccc1N1CCSCC1	764367365	VPINSVCEPWQBSX-UHFFFAOYSA-N	442.541	1.851	50	20	IDGD	
CCn1ncc2ccc(NC(=O)C(=O)NNC(=O)CSc3ccccc3OC)cc21	764394177	XMJFSMPXSYMGFY-UHFFFAOYSA-N	427.486	1.943	50	20	IDGD	
CCOC(=O)/C=C/c1ccc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)cc1	764404220	GSHOIEFNEVCGNB-FMIVXFBMSA-N	443.481	1.847	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CCC(=O)N2CCN(c3ccccc3)CC2)cc1OC	764514227	LTLZAHACEIUEQE-UHFFFAOYSA-N	440.500	1.594	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)[C@H](C)NS(=O)(=O)c2cccc(C#N)c2)c1C	764553116	RFFJNOYYIMDNFF-HOTGVXAUSA-N	444.513	1.457	50	20	IDGD	
C[C@H]1CCCC[C@@]12NC(=O)N(CC(=O)NNC(=O)c1cc(-c3cccs3)[nH]n1)C2=O	765569420	IOLNRIGYIUVHGO-JEOXALJRSA-N	430.490	1.400	50	20	IDGD	
O=C(Cc1ccc2c(c1)CCCC2)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765737088	VQVVIEFHZWBJIP-UHFFFAOYSA-N	434.540	1.713	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	765754633	MCRYTXQAUBPSPV-UHFFFAOYSA-N	430.936	1.856	50	20	IDGD	
O=C(Cc1cccc([N+](=O)[O-])c1)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	765757948	IHRWCWOGVQCINJ-UHFFFAOYSA-N	445.907	1.756	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)N[C@H]2CCC[C@H]2C(=O)NC)c2ccccc2c1=O	766282906	CKHZUTGERKCVLC-CVEARBPZSA-N	428.493	1.055	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1ccccc1OC(F)F	766641583	HRGJJHVVIHSIDV-UHFFFAOYSA-N	432.427	1.507	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)c3cc(S(=O)(=O)N(C)C)ccc3O)cc2C1	766967832	CSMLKBXMKIASCN-NSHDSACASA-N	437.543	1.904	50	20	IDGD	
CSCCNC(=S)NNC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(F)cc2)C1	769768493	BJCYGCIESKDJPV-LBPRGKRZSA-N	434.584	1.085	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)c2cc(Br)ncc2[N+](=O)[O-])cc1	769825027	IAYVNOHIHDGJMV-UHFFFAOYSA-N	448.189	1.242	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)[C@@H]2CCN(C(=O)OCc3ccccc3)C2)c2ccccc2c1=O	770074037	UCDXPHWFFOFDGF-MRXNPFEDSA-N	449.467	1.353	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1cc(S(=O)(=O)Nc2ccccc2F)c[nH]1	772014933	DJGZBVQPJJEHTC-JTQLQIEISA-N	426.426	1.057	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)C[C@H]2CSCCN2C(=O)OC(C)(C)C)c1	772390581	YUOZBDOKCUNSEU-HNNXBMFYSA-N	438.550	1.997	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)Nc3ccnn3[C@H]3CCS(=O)(=O)C3)cc2C1	776053451	CRBSUIUZLCLOJA-AAEUAGOBSA-N	437.547	1.896	50	20	IDGD	
COc1ccc(C(=O)NNc2cccc(S(C)(=O)=O)c2)nc1I	776527617	OOPOSYKNKYUFGO-UHFFFAOYSA-N	447.254	1.855	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN([C@@H]2CCCN(S(=O)(=O)CBr)C2)C(=O)C1	776788124	JLNBWYORVPVDRA-GFCCVEGCSA-N	440.360	1.212	50	20	IDGD	
COc1cc(OC)cc(N2CC[C@@H](N(C)CC(=O)NNC(=O)c3ccccc3)C2=O)c1	777617074	YUXOXXGTUHTVMM-LJQANCHMSA-N	426.473	1.202	50	20	IDGD	
COc1ccc(N2CCN(C(=O)/C=C\C(=O)NNc3nc(-c4cccnc4)no3)CC2)cc1	778268236	JCCLUECAPYEVAS-HJWRWDBZSA-N	449.471	1.488	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)[C@@H]2CC(=O)N(c3ccc4c(c3)OCCO4)C2)nc1C	778422232	MXFSUQIAZSXAGR-CYBMUJFWSA-N	441.444	1.229	50	20	IDGD	
COc1ccc(Cn2ccc(NC(=O)C(=O)NNC(=O)c3cccc4ncccc34)n2)cc1	778709352	FALJMLMMIRVJEE-UHFFFAOYSA-N	444.451	1.888	50	20	IDGD	
O=C(NNC(=O)[C@H](O)[C@H](O)c1nc2ccccc2s1)c1ccc(Br)s1	779488135	CUGWDESRWKDWKX-NEPJUHHUSA-N	442.316	1.976	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)N1CCN([C@H]2CCCN(Cc3ccccc3)C2=O)CC1	780314662	KDMYWWPOKWAMAW-CTNGQTDRSA-N	443.592	1.377	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)NNC(=O)c2ccccc2O)cc1Br	780365572	NEXFAIQJMGNEKN-UHFFFAOYSA-N	428.264	1.736	50	20	IDGD	
CCc1ccc(C(=O)NNc2cccc(C(=O)OC)c2)cc1S(=O)(=O)N1CCOCC1	780795008	BKBRUHGKSASFJZ-UHFFFAOYSA-N	447.513	1.813	50	20	IDGD	
CC(CCCCN(C)C)=NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	781117014	KOSVTYORBUTFCZ-UHFFFAOYSA-N	438.594	1.864	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2c(C)csc2C(=O)OC)cc1OC	782120368	IQJNYUPZRZTKDN-UHFFFAOYSA-N	435.458	1.650	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)O[C@H](C(=O)N[C@]2(C)CCS(=O)(=O)C2)C(C)C)cc(C#N)n1C	782628190	VUNIRPPFVOMRCZ-NEOMVKBGSA-N	446.529	1.373	50	20	IDGD	
CS(=O)(=O)c1ccccc1-n1cc(NC(=O)C(=O)NNc2ccc(F)cc2F)cn1	783347656	UBVKNWGZTRLHQB-UHFFFAOYSA-N	435.412	1.636	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2cccc(OCc3cccc(F)c3)c2)CCS(=O)(=O)C1	783426590	NWSQDFMINFLRNP-HXUWFJFHSA-N	435.477	1.541	50	20	IDGD	
O=C(Cn1cc(NC(=O)C(=O)NNc2nccc3sccc23)cn1)NC1CCCC1	783435291	AZPUFHCSXVWKLH-UHFFFAOYSA-N	427.490	1.633	50	20	IDGD	
O=C(NNC(=O)C(=O)N1CCCC1)C(=O)Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1	784000080	UOFKWMAVIQWOSY-UHFFFAOYSA-N	440.300	1.433	50	20	IDGD	
CCCc1cc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)NC(C)(C)C)n(C)n1	784834362	YGDLXQLKPLPKRY-UHFFFAOYSA-N	436.538	1.531	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2cc(Cl)ccn2)c(C)c1S(=O)(=O)NC1CC1	784856176	GBBSANYEBYVLEK-UHFFFAOYSA-N	437.909	1.874	50	20	IDGD	
CC[C@]1(C)Oc2ccc(NC(=O)C(=O)NNC(=O)c3nnc(O)c4ccccc34)cc2O1	785990568	IUIOXRCXRZBXFM-OAQYLSRUSA-N	437.412	1.633	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)Nc1ccc(S(=O)(=O)N(C)C(C)C)cc1	787814244	CSMRGPQUGJTUPD-UHFFFAOYSA-N	430.527	1.657	50	20	IDGD	
CCO[C@H]1C[C@](NC(=O)OC(C)(C)C)(C(=O)NNC(=O)N2CCN(C)CC2)C1(C)C	788165595	CXAWCDOZNGSJQP-XOBRGWDASA-N	427.546	1.073	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1cccc(C#N)c1)C(=O)NNc1nnc(-c2ccccn2)s1	788556068	FDNNTPRRJDXPOY-LLVKDONJSA-N	429.487	1.282	50	20	IDGD	
Cn1nc(-c2ccsc2)cc1NC(=O)C(=O)NNC(=O)[C@H]1OCC[C@H]1c1ccccc1	789816929	GXAOVZVPLGYEKP-YJBOKZPZSA-N	439.497	1.807	50	20	IDGD	
CCc1[nH]nc(C(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)c1Br	790012948	RJPCZAKDNNDSDU-UHFFFAOYSA-N	428.674	1.465	50	20	IDGD	
COCCN(C)c1ccc(C=NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cn1	790149083	SNRRKCMBIGNJPY-UHFFFAOYSA-N	433.534	1.243	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)C[C@H](CC#N)c2ccccc2)CC1	795108540	JOBJQNSSLUBWKQ-SFHVURJKSA-N	442.545	1.548	50	20	IDGD	
CCNC(=O)N(C)c1cccc(NC(=O)C(=O)NNC(=O)c2cn(C)c3ccccc23)c1	797000553	SUFLVGQZZFTNBS-UHFFFAOYSA-N	436.472	1.744	50	20	IDGD	
O=C(NNc1nccnc1Cl)C(=O)Nc1ccc(Cl)c(CN2CCOCC2)c1	797539302	WMUZWOYGJWALNM-UHFFFAOYSA-N	425.276	1.697	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)C(=O)Nc1cc(F)c(Br)cc1Cl	799259461	YQXKVKHZHMRHCM-UHFFFAOYSA-N	429.633	1.965	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)CCC[C@]2(C)NC(=O)NC2=O)c(OC)cc1Cl	802079778	AEIBVNRYZXLFRC-KRWDZBQOSA-N	427.845	1.278	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)CN(C)c2ncnc3[nH]cnc23)c(OC)cc1Cl	802084365	UJJXYEJCUVNIRT-UHFFFAOYSA-N	434.844	1.313	50	20	IDGD	
O=C(CCN1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O)NNC(=O)Nc1ccc(Cl)cc1Cl	802086313	AWSMEADTMLMRTD-GBOPCIDUSA-N	441.271	1.699	50	20	IDGD	
CCOC(=O)[C@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)Nc1cc(OC)ccc1Cl	802113015	ADWZZMWGYRKWTN-CYBMUJFWSA-N	444.872	1.958	50	20	IDGD	
COc1ccc(Cl)c(NC(=O)NNC(=O)[C@H](C)N2C(=O)[C@@H]3[C@H]4CC[C@@H](O4)[C@@H]3C2=O)c1	802114070	PJOVEVNLABPGDZ-CELJHQOASA-N	436.852	1.052	50	20	IDGD	
COc1ccc(C2=NO[C@H](CNC(=O)NNC(=O)Cc3ccccc3OC)C2)cc1F	802340276	GZWCKBPTCHFDDW-HNNXBMFYSA-N	430.436	1.909	50	20	IDGD	
C[C@]12CCC(=O)N1c1ccccc1C(=O)N2CC(=O)NNc1ccc2c(=O)[nH]ccc2c1	803437953	XEDUVNUCBUHTDN-HSZRJFAPSA-N	431.452	1.970	50	20	IDGD	
COC(=O)N(C)NC(=O)c1cc(S(=O)(=O)N2CCCCC2)ccc1Br	804122092	WMJNWXKRBWPCKT-UHFFFAOYSA-N	434.312	1.967	50	20	IDGD	
O=C(NCCN1CCN(C(=O)C2CCCCC2)CC1)NNc1ccc(-n2ccnc2)nn1	805111145	QWZGJALCISFFLZ-UHFFFAOYSA-N	441.540	1.013	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)[C@@]1(C(F)(F)F)CCN(C(=O)OC(C)(C)C)C1	805649201	NRXBJAXNSXBYBM-MGPLVRAMSA-N	425.404	1.665	50	20	IDGD	
COc1ccc(CN2CC[C@H](NC(=O)NNC(=O)Cc3ccccc3F)C2=O)c(OC)c1	806027367	JYEQAFQVGXQBON-SFHVURJKSA-N	444.463	1.517	50	20	IDGD	
CCn1c(=O)c(C(=O)/C(C#N)=C/c2cn(C(C)C)nn2)c(N)n(Cc2ccccc2)c1=O	806569637	FFUSWKDXEYEGFE-MHWRWJLKSA-N	433.472	1.623	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(F)c(N3C(=O)CCC3=O)c2)cc1	806974617	PGERWKWJLFVSPO-UHFFFAOYSA-N	426.404	1.441	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)C(=O)Nc1cccc2c1CNC2=O	806975056	LXMLIRCMFCVQBA-ZDUSSCGKSA-N	432.436	1.637	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)nc1)C(=O)Nc1ccc2nccnc2c1Br	806976171	HJSDGMZDCUFNHJ-UHFFFAOYSA-N	449.652	1.840	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)NC2C[C@@H]3CC[C@H](C2)N3CC(=O)N(C)C)c1	807514528	WRSSKWXPSOGCTF-AYHJJNSGSA-N	431.537	1.096	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ccc(OC)c(OC)c2)cc2[nH]ccc12	808934803	VRCXAJXLXFBTEO-UHFFFAOYSA-N	440.412	1.371	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(=NNC(=O)CNC(=O)c2cccnc2)[C@H]([C@@H]2CCOC2)C1	812226803	UDCIOYSADZBLIJ-SJORKVTESA-N	445.520	1.577	50	20	IDGD	
CCOC(=O)c1ccc(NNC(=O)[C@@H](C)NS(=O)(=O)c2ccc(C(N)=O)cc2)cc1C	812719929	SJTPFHKLOGLLOL-CYBMUJFWSA-N	448.501	1.081	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccc(-c3cc[nH]n3)cc2)cc1	813033697	HGGLFQSNRAFLLN-UHFFFAOYSA-N	428.474	1.409	50	20	IDGD	
CCCCn1c(C)cc(/C=C(\C#N)C(=O)NS(=O)(=O)N2CCN(C(C)=O)CC2)c1C	813950121	KEIPTPBTBFDDOG-CPNJWEJPSA-N	435.550	1.337	50	20	IDGD	
COc1cc(NC(=O)NN=Cc2nc3c(c(O)nc(=O)n3C)n2C)c(OC)cc1Cl	814995244	PMRJRCWVOPNQSZ-UHFFFAOYSA-N	435.828	1.199	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1nc(CC(F)(F)F)cs1	815565716	XOKJOFVACPSOSZ-UHFFFAOYSA-N	430.408	1.975	50	20	IDGD	
CCOc1ccc(NNC(=O)c2ccc(OC)c(S(=O)(=O)N3CCOCC3)c2)cc1	817921321	RJJRWCZRMYWYEU-UHFFFAOYSA-N	435.502	1.872	50	20	IDGD	
CC(C)NC(=O)C(=O)NNC(=O)c1cc(-c2cccnc2)nc2c1cnn2Cc1ccco1	841715556	WLCNESBYQHCOAH-UHFFFAOYSA-N	447.455	1.420	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)c2cc(S(N)(=O)=O)ccc2F)cc1	912842661	SPNXXCSVKRYWBQ-LLVKDONJSA-N	425.438	1.100	50	20	IDGD	
O=C(COC(=O)c1csc(Br)c1)NNC(=O)[C@@H]1COc2ccccc2O1	913396054	GGTFWUAHEFFIEI-LBPRGKRZSA-N	441.259	1.655	50	20	IDGD	
CCOc1ccc(OCc2ccc(C(=O)NNC(=O)CN3CCCS3(=O)=O)cc2)cc1	916034442	KOYTVGBQMVBMQL-UHFFFAOYSA-N	447.513	1.461	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccccc2-n2cccn2)c1	916107718	IRDOGJZTJOVEPH-UHFFFAOYSA-N	441.513	1.978	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)c1ccc2c(c1)OCCO2)N1CCN(c2ccccc2)CC1	916515031	YFNFBODIFADPCP-KRWDZBQOSA-N	439.516	1.613	50	20	IDGD	
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)C(=O)Nc1ccc(C)c(C)c1	916561620	AFMVANVSYWOPCU-FQEVSTJZSA-N	435.484	1.618	50	20	IDGD	
CS(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc1	916568178	MYPWHNNZWOCTPP-UHFFFAOYSA-N	429.458	1.126	50	20	IDGD	
CC(C)N1C(=O)c2ccc(C(=O)NNC(=O)c3cc4c(s3)CCC4)cc2S1(=O)=O	916745714	IPRAPXSEZONTOF-UHFFFAOYSA-N	433.511	1.865	50	20	IDGD	
O=C(COC(=O)[C@@H]1CCC[C@@H](C(F)(F)F)C1)NNC(=O)[C@@H]1COc2ccccc2O1	917285855	OLZWWAZBIVIXBV-JMSVASOKSA-N	430.379	1.886	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)n1	918220206	IDEQZQALWFJKHV-HZPDHXFCSA-N	432.500	1.783	50	20	IDGD	
CCNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2ccc(F)cc2Br)cc1	918341349	JASSRGZFAPKENO-UHFFFAOYSA-N	444.282	1.961	50	20	IDGD	
O=C(CCCN1C(=O)c2ccc(Br)cc2C1=O)NNC(=O)CC(F)(F)F	918365560	DKZHTTADMVZMSB-UHFFFAOYSA-N	436.184	1.925	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)[C@H]2CCCN(S(=O)(=O)c3ccc([N+](=O)[O-])cc3)C2)n1	919810179	FDCYYDAJSGXBOZ-AWEZNQCLSA-N	434.478	1.546	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CC(c2ccc(Cl)cc2Cl)=NO1)N[C@@H]1CCS(=O)(=O)C1	919883656	BVOSPUYNAJZYNY-RNCFNFMXSA-N	435.289	1.004	50	20	IDGD	
C[C@H]1CCCC[C@@H]1CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	920241850	HAUMFFZBCRIEAL-DOTOQJQBSA-N	438.550	1.478	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)Nc2ccc3c(c2)C(=O)NC3=O)c2ccccc2c1=O	920930553	PPBXHXOBLHYRBK-UHFFFAOYSA-N	448.439	1.547	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)[C@H](CC(C)C)N2C(=O)[C@@H]3CC=CC[C@H]3C2=O)c1	929085603	GJLIHXQIKJXCGC-QRVBRYPASA-N	443.500	1.831	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)CCn2cnc3ccccc3c2=O)CC1	1318903997	ZFGWGKABLPRHCI-UHFFFAOYSA-N	443.504	1.581	50	20	IDGD	
Cc1n[nH]c(C)c1C[C@@H](C)C(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	1319302997	LPPZYFXLAPLKQA-OAHLLOKOSA-N	446.983	1.824	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc4ccc(OC)cc4[nH]3)C2)C1	1777771311	YKVYOGLPAKNGON-IIBYNOLFSA-N	435.908	1.874	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc4n(n3)CCC4)C2)C1	1778664551	GBTGHMROTGNQJX-ACJLOTCBSA-N	425.327	1.304	50	20	IDGD	
Cn1cc(C(=O)N2CCO[C@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)c(C(F)(F)F)n1	1779298781	NVTRZHWVBZFSEG-KRWDZBQOSA-N	448.518	1.734	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2n[nH]cc2[N+](=O)[O-])C1	1779603027	IBICLBQRPVHFLN-CSMYWGQOSA-N	448.307	1.682	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(C)n(CC)n3)C2)C1	1779718875	LNBLLXSUSDCSBY-KDOFPFPSSA-N	427.343	1.828	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Br)C1)C1(O)CCC1	1780770270	KKGZVVWMVYRQMI-VWPFQQQWSA-N	435.334	1.742	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@](C)(O)C(F)(F)F)CCO2	1783343458	NCNBODYGBCXROC-ZLKJLUDKSA-N	431.249	1.303	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)Cn3nc(C)cc3C)CCO2)C1	1783344095	MZUVKAWHRCALBO-QAPCUYQASA-N	427.343	1.503	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(C(N)=O)cc3)CCO2)C1	1783354171	NRQQRENDVIMERU-HNAYVOBHSA-N	438.322	1.403	50	20	IDGD	
CO[C@@H](C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](C)Br)C2)C1)c1ccccc1	1783532876	ONBHTGVEPRGRHQ-IDHHARJASA-N	425.323	1.987	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1C[C@@H]1c1ccc(OC)cc1)CCO2	1783870514	CSUCJDUWOFLXRF-IWQHBPENSA-N	436.936	1.882	50	20	IDGD	
O=C(CNCP(=O)(O)O)Nc1ccc(C2(NC(=O)CCBr)CCC2)cc1	1787966993	QSJBJNIOTDFPJY-UHFFFAOYSA-N	448.254	1.630	50	20	IDGD	
C=C[C@@H](O)C(C)(C)C(=O)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1	1788145598	GVFROSXQOALRMZ-HXUWFJFHSA-N	436.317	1.687	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(=O)Nc3cccnc3)[C@H]2C1	1788715654	DXMCFAHELFFEJI-VFSPDHHESA-N	443.331	1.236	50	20	IDGD	
COc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)Br)C[C@@H]32)c(O)c1	1789482146	BRBCBICYVYDJRO-HJXMPXNTSA-N	441.322	1.778	50	20	IDGD	
COc1ccc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Cl)C[C@@H]32)c([N+](=O)[O-])c1	1789965797	WWMUBDAECRKCFK-WIRVQXDCSA-N	443.859	1.660	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)Br)[C@H]2C1	1791063644	OMJZYTZUIPVQCG-VLJOUNFMSA-N	440.176	1.923	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1ccc(C2(NC(=O)c3ccnnc3O)CCC2)cc1	1791601144	OTRVCXLRFDDENT-UHFFFAOYSA-N	426.477	1.303	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc3[nH]ncc3c1)C2	1792870749	KJVZTXGMMJYCCQ-QPKOPYBWSA-N	436.310	1.192	50	20	IDGD	
O=C(C#CC1CC1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](Br)Cc1ccccc1)C2	1793261273	FSGUMSPSRIOEBH-RCLSDMTESA-N	445.357	1.996	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(-n3cncn3)c1)C2	1795115319	XUXPPADVXSZJPH-JLVBRIDZSA-N	448.321	1.256	50	20	IDGD	
CCc1[nH]nc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Br)C3)c1Cl	1795904883	BHKMSYMWZUICHM-XXEYQXHCSA-N	437.697	1.519	50	20	IDGD	
Cc1cc(Cl)cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)c1	1796192905	XHLYTUPYGAYDIW-ACDBMABISA-N	426.709	1.894	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2cc(O)ccc2n1	1796864732	CHADQISPUWDMQX-QHHYFVSCSA-N	433.892	1.397	50	20	IDGD	
Cc1nc2ncccn2c1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@](C)(Cl)CCl)C2	1797005328	VPUJCXUWNFHXCR-ZYKCCNLVSA-N	440.331	1.477	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1ccc2nccn2c1	1797081187	KWEWMXRXADQLMG-AYRXBEOTSA-N	425.258	1.228	50	20	IDGD	
Cc1cnc2c(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)CO[Si](C)(C)C)cnn2c1	1797956950	QYDLWOVHFVNIKE-JLVBRIDZSA-N	431.569	1.092	50	20	IDGD	
COc1ccc2[nH]cc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)CCC(=O)NN(C)C)C4)c2c1	1798065523	KPUMYXMXUNDRES-MUJYYYPQSA-N	441.532	1.801	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccnc(Cl)n1	1798078493	SZFJPAZBISBBCX-HNCHTBHHSA-N	431.718	1.364	50	20	IDGD	
COc1cncc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@](C)(Cl)CCl)c1	1799273572	BQNCRAKHTKEYEW-BAAGSCJXSA-N	444.359	1.849	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc3[nH]ncc3c1)C2	1799277571	YIZBOEVRRHYMCD-AHXJXLJNSA-N	426.304	1.397	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nc(Cl)ccc1F)C2)[C@H](F)Br	1799344821	WCHMBXTWZUUCLD-XXEYQXHCSA-N	438.656	1.768	50	20	IDGD	
COc1ccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Cl)C3)c([N+](=O)[O-])c1	1799401603	XJKRKNLXGDZKPW-CZAMWMTLSA-N	429.832	1.270	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1(C#N)CC1)C2	1800332424	KKTGHYAQMWRRCC-AONCJLBWSA-N	426.423	1.765	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c(C(C)C)nn3ccccc13)C2	1800975108	JESCVSLHUPCKKC-QOIOWGMHSA-N	448.951	1.915	50	20	IDGD	
CC#C[C@@H](CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](Cl)COC)c1ccc(O)cc1	1800981814	SGUPVUULPOKUAJ-DCIOMXRHSA-N	448.947	1.733	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@@H]1c1cccnc1)c1ccc[n+]([O-])c1	1804783588	HRMNPJACVHLVJC-IMJJTQAJSA-N	437.269	1.725	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC2(CCN(C(=O)C3=NN(C)C(=O)CC3)CC2)C1	1805383526	NXUJPAFYMASVKC-CQSZACIVSA-N	441.370	1.857	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@H](CNC(=O)CN2CCNC2=N)[C@@H]1c1cccnc1	1807119732	ZVTVHIIQXDFWCX-QOKNQOGYSA-N	441.363	1.164	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)CO[Si](C)(C)C)[C@H]1c1cccnc1	1810237552	ZVFXGFNPIWORHV-AYBZRNKSSA-N	449.628	1.647	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H](CNC(=O)COc2ccc(O)nn2)[C@H]1c1cccnc1	1812349072	AJKXIVCQEBAVIV-DNVCBOLYSA-N	447.923	1.927	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)CN2CCCC2=O)[C@H]1c1cccnc1	1812864908	QSLFVIWIPUVLKE-JOQOYGCGSA-N	437.338	1.493	50	20	IDGD	
CSCC[C@H](O)C(=O)N1CC[C@H](CNC(=O)[C@@H](C)Br)[C@@H]1c1cccnc1	1812868014	RAUKRSFWMZVQQN-OJLVUWQFSA-N	444.395	1.985	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2cnn3cccnc23)[C@@H]1c1cccnc1	1813029940	BGAUPBBIIBNYAJ-BPQIPLTHSA-N	442.907	1.698	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)Cn2ccccc2=O)[C@@H]1c1cccnc1	1813030507	IVGZNUYFRQSNQF-ABSDTBQOSA-N	432.908	1.203	50	20	IDGD	
C[C@H](CBr)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H]2CCC(=O)NC2)[nH]n1	1814776335	MMOOBUKPKFECCY-MBNYWOFBSA-N	440.342	1.959	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)[C@@H](O)CCl)n[nH]2)nc2nccn12	1814874886	IOOXRTBPLWFCLV-GJZGRUSLSA-N	431.884	1.666	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc(O)cc2)[nH]n1)c1cccc(B(O)O)c1	1817476964	UWVLGARISDNMFW-LJQANCHMSA-N	434.261	1.415	50	20	IDGD	
CN1CCc2cc(C(=O)Nc3nc4c(s3)C[C@@H](NC(=O)[C@@H](O)CCl)CC4)ccc21	1818416106	UQPYOUXQYWXYJV-BBRMVZONSA-N	434.949	1.961	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)C[C@@H]2NC(=O)NC2=O)[nH]n1	1820862316	NBCGVNXBNPECOX-RVPKQNPDSA-N	445.307	1.236	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](F)Br)n[nH]1	1820937356	QHXKFTIPOOFINH-NHYWBVRUSA-N	447.309	1.465	50	20	IDGD	
COc1ccc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@H](F)Br)CC3)nn1	1821069390	PJZBGQZGPCRSOK-MADCSZMMSA-N	444.286	1.858	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)Cc2ccccn2)[nH]n1	1822413887	DSQDPOFISOLIJS-QGZVFWFLSA-N	427.509	1.413	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)CCl)CC2)[C@@H]1CC(c2ccccc2)=NN1	1824427938	PYSZKDZWKISXHL-KCXAZCMYSA-N	447.948	1.421	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCC([C@H]2CCCCN2C(=O)C[C@@H]2NC(=O)NC2=O)CC1	1825076519	ORWPULTXRBRPMU-KSMMKXTCSA-N	447.363	1.441	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(OC)nn2C)CC1	1825478594	JRKOSUFWGLGUPS-CVEARBPZSA-N	426.945	1.916	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827052240	QOOQKVBTKSWMRN-FQEVSTJZSA-N	446.429	1.451	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)/C(C)=C/c3cccs3)CCO2)C1	1829706995	ZTCVTWWCLYNVAQ-UNTOAVRTSA-N	442.965	1.862	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4nonc4c3)C2)C1	1830362296	QIYLVHGDOQSZTN-FQEVSTJZSA-N	436.896	1.558	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnn4c3OCCC4)C2)C1	1830365314	CPKSRQZGPFNPHH-FQEVSTJZSA-N	440.928	1.001	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CC=CCC1)CCO2	1830554562	IUILNONXIJMKET-MDZRGWNJSA-N	429.355	1.830	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3noc(C(C)C)n3)C2)C1	1831639565	CJDJIRCOLDVFNF-FOIQADDNSA-N	442.944	1.599	50	20	IDGD	
CC(=O)C[C@H](C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1	1831798430	BVNRTTBNYLTYJG-HRAATJIYSA-N	428.338	1.215	50	20	IDGD	
CCOc1ccsc1C(=O)NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1833020551	VCJNHCOITGEYRA-INIZCTEOSA-N	443.997	1.932	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3ccco3)CCO2)C1	1833052120	ISOOIEWBQFHDAX-RDTXWAMCSA-N	429.311	1.452	50	20	IDGD	
COc1cnc(C(=O)NC2CCN(C3CCN(C(=O)[C@H](F)Cl)CC3)CC2)c(F)c1	1834007132	CJJJZWKLTIYBSY-KRWDZBQOSA-N	430.883	1.949	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)c3ncccn3)CC2)CC1	1834229684	NJHBAHSZAJLBLL-CQSZACIVSA-N	438.370	1.693	50	20	IDGD	
COc1ccc(CC(=O)NC2CCN(C3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)cc1	1834508776	FOLYYUWCXJBLSR-FQEVSTJZSA-N	437.968	1.409	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)CC3CCOCC3)CC2)CC1	1834632012	ZSYOWXQYACBYIG-LJQANCHMSA-N	429.989	1.629	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)c3cccnc3Cl)C2)C1	1834820265	UOQWVVFVVVVORQ-QGZVFWFLSA-N	446.729	1.590	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)COc3ccccc3)CCO2)C1	1834953960	HMLYZXAYLJUVEM-VQTJNVASSA-N	445.343	1.758	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1)c1ccncn1	1835146430	KLWQEOGRCKAJJB-OAHLLOKOSA-N	428.306	1.352	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC1CCN(C2CCN(C(=O)/C=C/c3cnccn3)CC2)CC1	1835837679	MTBSSPQETIMZLP-SNAWJCMRSA-N	445.640	1.913	50	20	IDGD	
C#CCO[C@H](C)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](F)Br)CC2)CC1	1836413382	FBNHHFYWUPMGDP-CZUORRHYSA-N	432.334	1.287	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@H](C)CS(C)(=O)=O)CC2)CC1	1836875791	MGFBDYIBBSYJIY-PBHICJAKSA-N	437.002	1.683	50	20	IDGD	
O=C1Nc2ccccc2/C1=C/C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1837322495	CWPHZWSGRDCCHA-JCHZQONJSA-N	437.855	1.013	50	20	IDGD	
Cn1nc(C(F)(F)F)cc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1838078433	NSXHEBJBCWWLCV-SWLSCSKDSA-N	442.797	1.043	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(OC)cc3C)CCO2)C1	1839026379	WETZQVQBBWKXCA-NQIIRXRSSA-N	440.924	1.327	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4c(c3)OCCO4)C2)C1	1839144603	FWRHNCADNSAKQB-KKSFZXQISA-N	438.908	1.545	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(OC)cc3O)C2)C1	1839145688	CKQSCMUORPRJMB-OXQOHEQNSA-N	426.897	1.488	50	20	IDGD	
Cc1cc(C)n(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)n1	1839150415	LVYOUJGOFCNOMK-RTBURBONSA-N	447.363	1.193	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)c(F)c1	1839261866	ZUUUWSLEUQTTCG-QAPCUYQASA-N	447.276	1.895	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc4ccoc4cn3)CCO2)C1	1839487141	SNTVKMYGQGRQEG-QRWLVFNGSA-N	437.880	1.152	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc4ccnn4c3)CCO2)C1	1839569279	WDZZQJGSOLXRFB-WIYYLYMNSA-N	434.924	1.812	50	20	IDGD	
COCCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)CCO2	1839743389	NGMPGPKXSHVSMW-IHSQGBLNSA-N	449.454	1.365	50	20	IDGD	
C=CCC(F)(F)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H](Br)CC)CCO2)C1	1839966928	UNQJHSSCRWOVTJ-XJKSGUPXSA-N	439.297	1.828	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cncc(F)c3)C2)C1	1840031297	LOKJBFNQVOASGH-PXAZEXFGSA-N	430.274	1.074	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccccc3Cl)C2)C1	1840151512	FFFXLGYGAWXUMY-YLJYHZDGSA-N	445.343	1.593	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc4cc(C)[nH]c34)C2)C1	1840152883	XPDOEIVSHGCQLI-PGRDOPGGSA-N	449.935	1.800	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)Oc1ccccn1)CCO2	1840422718	IBRBGUVURWSQOQ-WWMYMODYSA-N	439.940	1.713	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC12CN(C(=O)/C=C/C(=O)NCc1ccco1)C2	1841287983	REEZONCYPVFRJU-VBROQKIQSA-N	438.322	1.686	50	20	IDGD	
O=C(c1cc(Br)ccc1[N+](=O)[O-])N1CC2(CCCN2C(=O)[C@H](O)CCl)C1	1841352768	MFDPYIYJEVKVBJ-CYBMUJFWSA-N	446.685	1.774	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@H]2CN(C(=O)OC(C)(C)C)CCO2)C1	1841428880	VHVFSOKLJUVSLM-CABCVRRESA-N	445.944	1.080	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@H]2CN(C(=O)OC(C)(C)C)CCO2)C1	1841428881	VHVFSOKLJUVSLM-GJZGRUSLSA-N	445.944	1.080	50	20	IDGD	
CC[C@H](C)[C@@H](N)C(=O)N1CC2(CCCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C1	1841924437	MFROIMPPHLIWQG-SOUVJXGZSA-N	430.977	1.695	50	20	IDGD	
Cc1ccc2c(/C=C/C(=O)N3CC4(CCCN4C(=O)c4ccc(B(O)O)cc4)C3)c[nH]c2c1	1843013007	YSKNWURPDUOLHN-UXBLZVDNSA-N	443.312	1.687	50	20	IDGD	
Cc1n[nH]cc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1848099711	ZAWRVLVKIOGGJR-KKUMJFAQSA-N	425.917	1.666	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@H](C)NC(=O)c2ccc(Cl)cc2)c2ccccc2c1=O	26546465	JIRDHQKOBWIOGZ-LBPRGKRZSA-N	441.875	1.649	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2ccc(Cl)cc2Cl)cc1	26626018	VCHXQIYNFUFJNV-UHFFFAOYSA-N	446.312	1.993	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1OC	26960283	OHIPBSYWLVNPNU-UHFFFAOYSA-N	433.486	1.563	50	20	IDGD	
Cc1ccc(C)c(S(=O)(=O)Nc2cccc(C(=O)NNC(=O)C(=O)NC(C)C)c2)c1	45457598	QVSWWBNXFKOKSR-UHFFFAOYSA-N	432.502	1.390	50	20	IDGD	
COc1cc(-n2cnnn2)c(Cl)cc1C(=O)NNC(=O)c1cc(-c2ccccc2)n[nH]1	107930848	VMKKFTYZMMFHDM-UHFFFAOYSA-N	438.835	1.789	50	20	IDGD	
COCCNC(=O)CSc1ccccc1C(=O)NNC(=O)c1c(C)nc2ccccn12	725910549	XOAFPGKDDKJKDZ-UHFFFAOYSA-N	441.513	1.572	50	20	IDGD	
COc1ccc(CN2C[C@H](C(=O)NNC(=O)c3cc(OC)cc(OC)c3)CC2=O)cc1	726499012	QMPGFMPGEBKKCH-MRXNPFEDSA-N	427.457	1.522	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)C(F)(F)c3ccc(F)cc3)cc2)CC1	728215958	MULAHZFKIVJYEY-UHFFFAOYSA-N	442.463	1.997	50	20	IDGD	
COc1ccc(C(=O)NN=C(C)c2ccc(S(=O)(=O)NCC(=O)O)cc2)c(OC)c1	729938625	VCBJPAPBWVVGCM-UHFFFAOYSA-N	435.458	1.221	50	20	IDGD	
COc1ccccc1N(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)Cc2cc[nH]n2)cc1	730091026	YXMFAGDHLMVYFQ-UHFFFAOYSA-N	443.485	1.247	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C1CCN(C(=O)CCOc2ccccc2)CC1	730777834	FDHYJGUYGBTEEO-UHFFFAOYSA-N	441.484	1.626	50	20	IDGD	
Cc1nc(CN2CCC(CNC(=O)NNC(=O)COc3ccccc3O)CC2)oc1C	732257310	KCWKCYITVROYCC-UHFFFAOYSA-N	431.493	1.618	50	20	IDGD	
Cc1ccc(C)c(S(=O)(=O)NCCC(=O)NNc2ccccc2S(C)(=O)=O)c1	732303054	CQHCEWVYMBDPQC-UHFFFAOYSA-N	425.532	1.519	50	20	IDGD	
O=C(NCC1CCN(S(=O)(=O)C(F)F)CC1)NNC(=O)c1cccc2ncccc12	733046011	ZIXQCLWLSMYWDO-UHFFFAOYSA-N	441.460	1.443	50	20	IDGD	
CCN1CCC[C@H]1CN1C[C@@H](C(=O)NNc2nc3ccccc3c(=O)n2CC)CC1=O	733127764	GEZYESSJIVFSNM-HOTGVXAUSA-N	426.521	1.192	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)N[C@@H]1CCN(c2ccc(C(F)(F)F)cc2)C1	734525499	NNOTXUDXPYJSRD-CYBMUJFWSA-N	439.394	1.638	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)c2ccc(NS(C)(=O)=O)cc2)cc1C	736753055	JSXGRBGEMAKUGW-UHFFFAOYSA-N	439.515	1.608	50	20	IDGD	
CCOc1cc(C(=O)NNc2ncnc3[nH]cnc23)ccc1OCC(=O)N1CCCCC1	740746651	ZXQSZUIPBAMAEK-UHFFFAOYSA-N	439.476	1.900	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)c1ccc(CNS(=O)(=O)CC)cc1	741661168	BVDYSIVZRXEUKD-UHFFFAOYSA-N	443.529	1.499	50	20	IDGD	
CCN1CCC[C@@H]1CN1C[C@@H](C(=O)NNC(=O)c2cccc(Br)c2)CC1=O	742773253	RTFHMOXYGCUWFM-GOEBONIOSA-N	437.338	1.543	50	20	IDGD	
CCO[C@@H](C)c1noc(CN2CCN(C(=O)/C(C#N)=C/c3cc(C#N)n(C)c3C)CC2)n1	742793237	LRUZRWSOMLFAMH-HKJBKDEOSA-N	437.504	1.937	50	20	IDGD	
C[C@H]1CN(C(=O)NNC(=O)Cc2cccnc2)CCN1C(=O)Cc1cccc(Cl)c1	743589314	RPRUMPZIZGHSTP-HNNXBMFYSA-N	429.908	1.794	50	20	IDGD	
CC[C@H](C)NC(=O)[C@@H](C)NC(=O)NNC(=O)[C@H](C)Oc1cccc(Br)c1	744277823	OMUQJMMIRLZREZ-TUAOUCFPSA-N	429.315	1.850	50	20	IDGD	
COc1ccc(OC)c(CC(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)c1	744619789	YPGRAHIQHHAOJR-UHFFFAOYSA-N	435.502	1.411	50	20	IDGD	
CSCC[C@@H](NC(=O)NNC(=O)c1cc([N+](=O)[O-])ccc1O)c1nnc2ccccn12	745392393	ZYJNOICLPVLHRL-CYBMUJFWSA-N	445.461	1.782	50	20	IDGD	
CS(=O)(=O)N1CCC(NC(=O)NNc2c(F)cc(F)cc2Br)CC1	745415916	DFHXGPFCGJDYTE-UHFFFAOYSA-N	427.271	1.777	50	20	IDGD	
Cc1cccc2c(CCNC(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)c[nH]c12	745841635	PVTJAIGUTLTOJA-UHFFFAOYSA-N	443.529	1.913	50	20	IDGD	
COCCNS(=O)(=O)c1c[nH]c(C(=O)NNC(=O)CCSc2ccc(F)cc2)c1	746097183	NMYCEXSUCHOINN-UHFFFAOYSA-N	444.510	1.022	50	20	IDGD	
C[C@@H]1CC(C)(C)C[C@]2(C1)NC(=O)N(CC(=O)NNC(=O)Cc1cn3ccccc3n1)C2=O	746554195	YEDPOXODTDILEM-PEBXRYMYSA-N	440.504	1.161	50	20	IDGD	
O=C(NCCOc1ncccc1C(F)(F)F)NNC(=O)[C@@H]1COc2ccccc2O1	746796585	SGCPKONECRVQPP-AWEZNQCLSA-N	426.351	1.650	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)NCCCN2CCN(c3ccncc3)CC2)c1	748344120	UCIFGBDXCGAZLH-UHFFFAOYSA-N	442.520	1.255	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)N[C@H](C)c1cc(F)ccc1N1CCC(O)CC1	748634492	XJAGTDDGCLYXIK-KGLIPLIRSA-N	426.489	1.230	50	20	IDGD	
O=C(CCn1nc(O)c2ccccc2c1=O)NNc1c(F)cc(C(=O)NC2CC2)cc1F	748830393	ZNFZELRTTZIETP-UHFFFAOYSA-N	443.410	1.806	50	20	IDGD	
O=C(NNC(=O)c1cc2ccccc2o1)c1cc(S(=O)(=O)N2CCSCC2)c[nH]1	749467422	JXTTUWVZLCEZSK-UHFFFAOYSA-N	434.499	1.573	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2cnc(NC(C)=O)s2)ccc1OC(C)C	753015307	CRAAFCYGAAVKPE-UHFFFAOYSA-N	428.492	1.521	50	20	IDGD	
Nc1nc(Cl)cc(NNC(=O)[C@H]2CCCN(S(=O)(=O)c3ccc(F)cc3)C2)n1	753457665	RPOSJEBDDRHAKQ-JTQLQIEISA-N	428.877	1.395	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)Cc1ccc(I)cc1	753458260	IVCOCJQKOLUBDY-NSHDSACASA-N	432.258	1.959	50	20	IDGD	
O=C(CC12CC3CC(CC(C3)C1)C2)NNC(=O)NCCN1C(=O)[C@@H]2[C@@H](C1=O)[C@H]1C=C[C@H]2C1	755254928	DRRFMADQNYFJBH-UWMSUUHGSA-N	440.544	1.730	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)c1csc([C@@H]2CCCO2)n1	755387372	XVECWUJOAPZJJS-SFHVURJKSA-N	429.546	1.968	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NN=Cc1cnc2ccccn12	755488818	BDGALIXCIFTOFJ-UHFFFAOYSA-N	441.513	1.438	50	20	IDGD	
O=C(Cc1cc[nH]n1)NNC(=O)Nc1cccc(S(=O)(=O)NC2=NCCCCC2)c1	755494215	CTBUBPNUDSIRJH-UHFFFAOYSA-N	433.494	1.056	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NN=C(C)c1nccn1C)N(S(C)(=O)=O)CC2	755572633	OKFKVXBIUBFVKD-MRXNPFEDSA-N	449.533	1.227	50	20	IDGD	
CN(C)C(=O)Cc1ccc(NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1	755915763	DCLGTJUJOWTTTD-UHFFFAOYSA-N	425.493	1.177	50	20	IDGD	
COCCOCc1cccc(NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1	755970274	UAPVNIDVUPXZAK-UHFFFAOYSA-N	428.493	1.709	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)c1cccc(I)c1O	756121422	LLTDVTWDFJRYSI-UHFFFAOYSA-N	435.218	1.283	50	20	IDGD	
CCc1cnc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)NC(C)(C)C)s1	756153997	QALXIGNJEZMQDU-UHFFFAOYSA-N	425.536	1.864	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c(OC)n1	756247519	GQEWUMOAWYUKLO-UHFFFAOYSA-N	449.489	1.350	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)Nc1ccc2c(ccn2CCN2CCOCC2)c1	756399470	PQHXZFPVYZAMKI-INIZCTEOSA-N	433.509	1.178	50	20	IDGD	
CN(C1CC1)S(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1	756405227	YBMLIMOPIIDYRD-SFHVURJKSA-N	446.485	1.462	50	20	IDGD	
CS(=O)(=O)CCn1ccc(NC(=O)NNC(=O)c2cccc(Br)c2)n1	756759847	MRZPEJQHIBEUEP-UHFFFAOYSA-N	430.284	1.157	50	20	IDGD	
CCOc1ccc(C(=O)N(C)C)cc1NC(=O)NNC(=O)c1cncc(NC(C)=O)c1	756884336	VLKQDHUTYNDQJO-UHFFFAOYSA-N	428.449	1.607	50	20	IDGD	
CC[C@@H]1CN(CC(=O)NNC(=O)c2ccc(C#N)cc2)CC[C@@H]1NC(=O)OC(C)(C)C	757101264	HFJHUCSATXGXEB-AEFFLSMTSA-N	429.521	1.944	50	20	IDGD	
C[C@@H]1C[C@@H](C)CC2(C1)NC(=O)N(CC(=O)NNC(=O)Nc1ccc(N(C)C)cc1)C2=O	757644910	BBZYKOFQEUHRJW-ZIAGYGMSSA-N	430.509	1.652	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NCCCNC(=O)C(C)C)c2ccccc2c1=O	757662807	HDNVBOHENQTCEY-UHFFFAOYSA-N	430.509	1.303	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@H]2CN(C)Cc3ccccc32)cc1	757736519	YSLMXIJVRYERLM-IBGZPJMESA-N	445.545	1.133	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccccc2CN2CCNC2=O)c1	757925842	XZGMFSVYNFYDRB-UHFFFAOYSA-N	431.474	1.082	50	20	IDGD	
Cc1cc(C)nc(SCC(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)n1	758788147	XCKDRCHRLPNTDI-UHFFFAOYSA-N	438.554	1.821	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)Cn2cnc(-c3ccccc3)n2)c2ccccc2c1=O	761200094	MDJVXEDYPGNHSW-UHFFFAOYSA-N	431.456	1.697	50	20	IDGD	
CCCS(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)NC2CCCC2)c(OC)c1	761281207	KHLDLMIFOXDEFJ-UHFFFAOYSA-N	434.540	1.282	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN(CC(=O)Nc2ccc(F)cc2)C(C)C)cc1OC	762523128	DBFZUVQBTBHBIY-UHFFFAOYSA-N	446.479	1.953	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H]2CCCN(c3ccccc3F)C2)c1	763086182	NBCVXJDCVLUFNP-HNNXBMFYSA-N	434.493	1.842	50	20	IDGD	
O=C(COC/C=C\c1ccccc1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	763105029	AEAKRUIABHVLOJ-YFHOEESVSA-N	443.525	1.962	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc3ccccc3cc2O)cc1C(=O)N(C)C	763518088	PQBQLVYFXFZONF-UHFFFAOYSA-N	434.452	1.955	50	20	IDGD	
Cc1nnc(NNC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)OC(C)(C)C)nc1O	763524876	NUHIBGNDXMDPHY-HNNXBMFYSA-N	427.465	1.946	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cc(Br)ccc2C)cc1	763662059	SVWFCGHKGAZFDS-UHFFFAOYSA-N	436.262	1.931	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)C(=O)Nc1ccc(NC(=O)[C@@H]2CCCO2)cc1	763678558	GBPBOQQOQUFCDD-KRWDZBQOSA-N	444.419	1.108	50	20	IDGD	
CC(C)CC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2F)cc1	763682376	MXYNEXJOVFLNFC-UHFFFAOYSA-N	430.436	1.975	50	20	IDGD	
CCc1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2Cc2ccccc2)n(C)n1	763719065	ULGMJESQUJTKLP-UHFFFAOYSA-N	435.484	1.738	50	20	IDGD	
Cn1c(=O)oc2c(NC(=O)C(=O)NNC(=O)CC34CC5CC(CC(C5)C3)C4)cccc21	763735326	MQXPJBBXPWKINH-UHFFFAOYSA-N	426.473	1.824	50	20	IDGD	
Cc1ccc(Cn2nccc2NC(=O)C(=O)NNC(=O)C2=S=C3CCCC3=C2)s1	763784004	SOHOUGPPXOULMF-UHFFFAOYSA-N	429.527	1.589	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2cc(F)ccc2Cl)c2ccccc2c1=O	763787060	VFVYVOHABSJNFD-UHFFFAOYSA-N	431.811	1.609	50	20	IDGD	
CCCCCn1nc(C)cc1NC(=O)C(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	763790759	OBRHNFPHRUMQFV-UHFFFAOYSA-N	439.476	1.028	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cccc3c2oc(=O)n3C)c1C	763848522	IRCJNEDYZMYSCG-ZDUSSCGKSA-N	426.429	1.302	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1cnn(Cc2ccccc2)c1	763848528	CQDYUXPCBHFLRC-CQSZACIVSA-N	425.420	1.624	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)OC)c(C)c2)cc1OC	763911410	MNHYAGFTZGCGNF-UHFFFAOYSA-N	443.456	1.979	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(C(N)=O)c(Cl)c2)ccc1OC(C)C	763922280	USAUFKZAWGOJAK-UHFFFAOYSA-N	448.863	1.634	50	20	IDGD	
CN1CCC(N(C)c2ccc(NC(=O)C(=O)NNC(=O)Cc3ccc(F)cc3)cc2)CC1	763933381	WKDYLEHIPBCDCR-UHFFFAOYSA-N	441.507	1.685	50	20	IDGD	
C[C@@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)Cc3ccc(Cl)cc3)cc2)CCO1	763936129	FIPQQNHDTUONFT-CQSZACIVSA-N	430.892	1.894	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1ccccc1-n1c(C)cnc1O	764013294	ZBDPPSZROVACSX-UHFFFAOYSA-N	443.847	1.948	50	20	IDGD	
COC(=O)c1cc(F)ccc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccccc2)on1	764016058	DFKUGANDYKGNFE-UHFFFAOYSA-N	426.360	1.667	50	20	IDGD	
CCOc1cc(NC(=O)C(=O)NNC(=O)Cc2ccsc2)c([N+](=O)[O-])cc1OCC	764034900	LNFQCFIFBDMPQS-UHFFFAOYSA-N	436.446	1.782	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc(NC(=O)OC(C)(C)C)nc1	764043948	ZSSMJIFAEAONNC-UHFFFAOYSA-N	429.433	1.837	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2cc(NC(=O)C3CC3)ccc2C)c1O	764131842	SHGCWPLCOGEWTE-UHFFFAOYSA-N	426.429	1.457	50	20	IDGD	
CC[C@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cccc(OC)c2O)cc1	764132664	PFROQSCKHZTBGU-LBPRGKRZSA-N	428.445	1.329	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccccc1OCC(F)(F)F	764136961	XDBXICMQVGNJMD-UHFFFAOYSA-N	425.363	1.965	50	20	IDGD	
Cc1ccc(C(=O)NCC(F)(F)F)cc1NC(=O)C(=O)NNC(=O)CC1CCCC1	764180212	ZBAWOZATMGZDNN-UHFFFAOYSA-N	428.411	1.953	50	20	IDGD	
CN1CCCN(c2ccc(NC(=O)C(=O)NNC(=O)CCCc3ccccc3)cc2)CC1	764225158	ZEOVDMOZQAGKSP-UHFFFAOYSA-N	437.544	1.937	50	20	IDGD	
CC(C)(C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)cc1	764239454	MROZLOQMUPOUTM-UHFFFAOYSA-N	435.484	1.956	50	20	IDGD	
CCOC(=O)c1cc(F)c(F)cc1NC(=O)C(=O)NNC(=O)Cn1ccc2ccccc21	764239483	NCZIYWPGYSPLCX-UHFFFAOYSA-N	444.394	1.882	50	20	IDGD	
O=C(NNC(=O)C1CCC1)C(=O)Nc1ccc(Cl)c(S(=O)(=O)N2CCCCC2)c1	764341626	HCPUJKXJVRFRPC-UHFFFAOYSA-N	442.925	1.401	50	20	IDGD	
Cc1ccc(-c2nnco2)cc1NC(=O)C(=O)NNC(=O)C(F)(F)Oc1ccccc1	764380191	RCGARQPAJMQTJI-UHFFFAOYSA-N	431.355	1.803	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)NC[C@H](NC(=O)OC(C)(C)C)C2CC2)nc2ccccc21	764545799	YPNGXDUREHLDDV-HNNXBMFYSA-N	430.509	1.750	50	20	IDGD	
O=C(CCC(=O)N1CCN(c2ncccn2)CC1)NNC(=O)c1cccc2ccccc12	765644379	UTXSVACHKFOUKX-UHFFFAOYSA-N	432.484	1.520	50	20	IDGD	
CC(=O)c1cc(C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)n(C)c1	766661240	UULJMZZAVYUPMN-UHFFFAOYSA-N	431.924	1.460	50	20	IDGD	
CCC(=O)N1CCCC[C@@H]1C(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	766661907	ZXKILIPOFHLVAT-LJQANCHMSA-N	449.983	1.396	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)N[C@@H]2CC(=O)N(c3ccc(Cl)c(F)c3)C2)cc1	766869683	KDSOJDNJRYOELX-CYBMUJFWSA-N	445.838	1.865	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2cc3c(cc2F)NC(=O)CC3)c2ccccc2c1=O	767792488	NNYFXJYYIGHSIK-UHFFFAOYSA-N	437.431	1.905	50	20	IDGD	
C[C@H]1Cc2ccccc2N1S(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)C(C)(C)O)c1	768255674	NERDNACJOQTQQS-LBPRGKRZSA-N	435.477	1.498	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)c2cc(Br)cc([N+](=O)[O-])c2)c1	770159753	SUDGGEDIXXBSTM-UHFFFAOYSA-N	447.201	1.847	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)NCCn3c(=O)oc4ccccc43)nc21	770384284	HJSYRXKNMXQFSR-UHFFFAOYSA-N	426.437	1.521	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)N[C@@H]1CC(=O)N(c2c(F)cccc2F)C1	770753734	LGZQLZDEQOBQJJ-GFCCVEGCSA-N	428.399	1.670	50	20	IDGD	
C[C@H]1CCCN(C(=O)C(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)C1	771610171	RPLDUGPUYSXTBJ-INIZCTEOSA-N	447.499	1.408	50	20	IDGD	
O=C(NNC(=O)c1ccc(OC(F)F)cn1)c1ccc(S(=O)(=O)N2CCCC2)cc1	771883365	UEUXBIQQJZJBEZ-UHFFFAOYSA-N	440.428	1.542	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)c1ccc(S(=O)(=O)NC(C)(C)C)cc1	771939782	OGYNPRTUDRRMAU-CYBMUJFWSA-N	427.523	1.502	50	20	IDGD	
C[C@@H]1C[C@H](NC(=O)NNC(=O)CNC(=O)c2cccs2)CCN1C(=O)OC(C)(C)C	772357722	OWTPRCFPVAPWOD-CHWSQXEVSA-N	439.538	1.596	50	20	IDGD	
CNS(=O)(=O)c1ccc(-c2ccc(C=NNC(=O)c3cncc(NC(C)=O)c3)o2)cc1	772861978	RLRBHOJDUANPBQ-UHFFFAOYSA-N	441.469	1.972	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)[C@H]1CCCN1C(=O)Cc1ccccc1	772896726	BOAXEZSCXBTJEK-GOSISDBHSA-N	442.903	1.337	50	20	IDGD	
O=C(NNC(=O)c1cccc(OC(F)F)c1)C(=O)Nc1ccc(Br)cn1	773545581	GQQPAYDUOKZYJT-UHFFFAOYSA-N	429.177	1.845	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)cn1C	774008095	FPCDEJHJJOAXHK-LLVKDONJSA-N	436.852	1.409	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)NC[C@@H]2CC[C@H](C(=O)N(C)C)O2)c1	775454860	NWJYLSDCDRWSOB-SMDDNHRTSA-N	443.298	1.038	50	20	IDGD	
CC(=O)c1cc(S(=O)(=O)NNC(=O)COc2ccccc2O)ccc1Br	775698698	QXHJBJOMLDATGL-UHFFFAOYSA-N	443.275	1.746	50	20	IDGD	
CN(NC(=O)c1ccnc(O[C@@H]2CCOC2)c1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776202437	TWUREYJADBFHJP-MRXNPFEDSA-N	449.508	1.499	50	20	IDGD	
COC(=O)C1(c2ccc(S(=O)(=O)NNC(=O)c3cc(OC)cc(OC)c3)cc2)CC1	776271478	DXRDHTVUIOVORK-UHFFFAOYSA-N	434.470	1.532	50	20	IDGD	
COc1cc(C(=O)CCC(=O)NNC(=O)c2ccc3c(c2)OCO3)cc(OC)c1OC	776966801	VRGQYHBIEKWKPP-UHFFFAOYSA-N	430.413	1.865	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)CCNS(=O)(=O)c2c(C)cc(C)cc2C)nc1C	778425341	QRDYAFVGUFXPPI-UHFFFAOYSA-N	449.533	1.699	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)CCCNS(=O)(=O)c2ccc(F)cc2)nc1C	778429773	UFCSLFVZUBIXEV-UHFFFAOYSA-N	439.469	1.303	50	20	IDGD	
COc1cc(C=NNC(=O)N[C@H]2CCS(=O)(=O)C2)c([N+](=O)[O-])cc1OCC(F)F	778540259	MJAYFHPRWZWUTI-JTQLQIEISA-N	436.393	1.068	50	20	IDGD	
O=C(NNc1ccccc1OC(F)(F)F)Nc1cnn(CC(=O)N2CCOCC2)c1	779440519	ZHGICSRVYVXMQA-UHFFFAOYSA-N	428.371	1.789	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)[C@@H](O)[C@@H](O)c1nc2ccccc2s1	779491542	QLKOGMHUPHCYDH-RBUKOAKNSA-N	439.497	1.450	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)c2cc(S(=O)(=O)N3CCOCC3)ccc2F)c1	780795335	HUDTVSPCBPIHMC-UHFFFAOYSA-N	437.449	1.390	50	20	IDGD	
CCNC(=O)N(C)NC(=O)c1ccc(CNS(=O)(=O)c2ccc(NC(C)=O)cc2)cc1	781063889	PLKBNXHFDSXAJJ-UHFFFAOYSA-N	447.517	1.430	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)Cc2ccc(S(=O)(=O)C(C)C)cc2)c1	781308877	LJKNVMUBHNWXAU-UHFFFAOYSA-N	432.498	1.724	50	20	IDGD	
O=C(CCN1C(=O)CNC1=O)Nc1ccc(NC(=O)NNc2ncncc2Cl)cc1	782064225	DSUKZYDNKMRTOL-UHFFFAOYSA-N	432.828	1.159	50	20	IDGD	
Cc1oc(-c2cccc(C(F)(F)F)c2)nc1C(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1	782550819	ROZVOJWIYXGKIH-LBPRGKRZSA-N	446.407	1.800	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(O)cc2)cc1N1CCCCC1=O	782833438	ILQMXZQHQCGVMG-UHFFFAOYSA-N	426.429	1.317	50	20	IDGD	
CC(C)Oc1ccc(C#N)cc1NC(=O)C(=O)NNC(=O)Cc1nc2ccccc2n1C	782883964	CTYSRCLAIBWUMS-UHFFFAOYSA-N	434.456	1.561	50	20	IDGD	
CC1(C)Cc2cc(NC(=O)C(=O)NNC(=O)c3csc(N4CCOCC4)n3)ccc2O1	782897440	OWMRJNVYRZNSSY-UHFFFAOYSA-N	445.501	1.093	50	20	IDGD	
CCN1CCN(C(=O)Cc2ccc(NC(=O)C(=O)NNc3ccc(OC)cc3)cc2)CC1	783021739	HGJAEMLCHYOVFU-UHFFFAOYSA-N	439.516	1.484	50	20	IDGD	
COC[C@H](C)NS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccc(OC)cc2)cc1	783036921	KBFULIHRZUOWBU-ZDUSSCGKSA-N	436.490	1.090	50	20	IDGD	
COc1ccc(Cl)cc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)NC(C)C)cn1	783264844	SEIWPMFUZMFMLE-UHFFFAOYSA-N	441.897	1.512	50	20	IDGD	
COCCOc1ccc(Br)cc1NC(=O)C(=O)NNc1cc(C)nc(C)n1	783324065	CTUFQWRGMSLQDU-UHFFFAOYSA-N	438.282	1.963	50	20	IDGD	
CS(=O)(=O)CCn1cccc(NC(=O)C(=O)NNc2cc(Cl)ccc2Cl)c1=O	783367988	NEDOUQWGGBZHSN-UHFFFAOYSA-N	447.300	1.282	50	20	IDGD	
O=C(NNc1ccc(-n2cccn2)nn1)C(=O)Nc1ccnc(Sc2ccccn2)c1	783433158	LSXNAHFUOZJRPR-UHFFFAOYSA-N	433.457	1.685	50	20	IDGD	
COC(=O)[C@@H]1CN(C(=O)C(=O)NNc2ccc(C#N)c(C(F)(F)F)c2)c2ccccc2O1	784232311	SKDDCPHHVLKEBS-INIZCTEOSA-N	448.357	1.987	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)C1	784580597	RZTKEEXSWOODFC-UHFFFAOYSA-N	431.537	1.213	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)Nc1ccc(F)cc1OCC(F)F	785023379	GUNXAKXIFNWUKY-UHFFFAOYSA-N	442.306	1.483	50	20	IDGD	
COC(=O)Cc1ccccc1NC(=O)C(=O)NNc1c(F)cc(C(=O)NC2CC2)cc1F	785100200	SVESEZIXBXXAIN-UHFFFAOYSA-N	446.410	1.654	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc(-n4nccn4)nc3)n[nH]2)c1	785128732	MRLIMPBRMHJSSH-UHFFFAOYSA-N	445.443	1.069	50	20	IDGD	
O=C(NNc1nc(C(F)(F)F)cs1)C(=O)Nc1ccc(CN2C(=O)CNC2=O)cc1	785147761	RGHLGWDFRHCVSR-UHFFFAOYSA-N	442.379	1.296	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)c2cc([C@H]3CCN(C(=O)OC(C)(C)C)C3)[nH]n2)c1O	787872934	ITCHENJXZHOJBJ-LBPRGKRZSA-N	445.476	1.923	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)c1nn(-c2ccccc2C(F)(F)F)cc1O	789960590	CWWAKZOZYAGMCQ-UHFFFAOYSA-N	427.383	1.663	50	20	IDGD	
CO[C@H]1CCOc2c(NC(=O)C(=O)NNC(=O)Cc3nc4ccccc4n3C)cccc21	790959100	GZSYLQFWWHGDMZ-KRWDZBQOSA-N	437.456	1.372	50	20	IDGD	
COc1cc(Cl)c(Cl)cc1NC(=O)C(=O)NNC(=O)[C@@H]1COc2ccccc2O1	792268502	NCTVZKZPKBRDOH-HNNXBMFYSA-N	440.239	1.928	50	20	IDGD	
COc1cccc(-c2noc(SCC(=O)N([C@H]3CCS(=O)(=O)C3)N(C)C)n2)c1	792849921	MEUQMWFFQKBLKT-ZDUSSCGKSA-N	426.520	1.330	50	20	IDGD	
CC(C)(C)c1cc(NC(=O)C(=O)NNC(=O)c2ccccn2)n(-c2ccc(C#N)cc2)n1	793023593	SEKMPURTYBKOLT-UHFFFAOYSA-N	431.456	1.836	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)NC[C@@H]2CCCN(C(C)=O)C2)cc1Cl	793202095	FEFVSSORPSQDMU-LBPRGKRZSA-N	427.889	1.951	50	20	IDGD	
CN(CC(=O)NNC(=O)c1cccs1)Cc1cn(-c2cccc(Br)c2)nn1	796594039	PUAQVAWCHQSROS-UHFFFAOYSA-N	449.334	1.984	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)[C@H](CC(N)=O)NC(=O)CC(C)C	798153988	PJKLNQOVSILAGE-AWEZNQCLSA-N	431.518	1.286	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@@H]2C(=O)OCC(=O)NNC(=O)c2cccc(C)c2)cc1	798791445	VDDSEDROFPPMCW-LJQANCHMSA-N	439.468	1.613	50	20	IDGD	
Cc1cc(O[C@H]2CCN(C)C2=O)ccc1NC(=O)C(=O)NNc1cnc2ccccc2n1	799259591	CZHCIGAZOUDLBY-SFHVURJKSA-N	434.456	1.630	50	20	IDGD	
CSC[C@H](C)C(=O)N1CCC(C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)CC1	799309537	SDIMSGPWZWFEKF-ZDUSSCGKSA-N	441.575	1.089	50	20	IDGD	
O=S(=O)(Nc1ccc(-n2nnnc2O)cc1)c1ccc(OCCBr)cc1	799925936	FONPXFUVBCLMIF-UHFFFAOYSA-N	440.279	1.942	50	20	IDGD	
CNC(=O)CNC(=O)c1cccc(NC(=O)C(=O)NNc2ccc(Cl)cc2Cl)c1	800625038	XHZJUBIJYUPBIS-UHFFFAOYSA-N	438.271	1.551	50	20	IDGD	
CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)NNC(=O)C(=O)Nc1ccc(C)cc1	801110117	PIVDKYBXBSEHRH-IBGZPJMESA-N	439.447	1.449	50	20	IDGD	
COc1ccccc1[C@]1(C)NC(=O)N(CC(=O)NNC(=O)Nc2ccc(Cl)cc2)C1=O	802017685	WOTAQDCCMJNXIT-FQEVSTJZSA-N	445.863	1.969	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)[C@H]2CCN(c3ccc(C#N)cc3F)C2)c2ccccc2c1=O	804161989	XXTMOPMNQSJSOC-AWEZNQCLSA-N	434.431	1.232	50	20	IDGD	
C[C@@H](Cc1cncc2ccccc12)C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	805682295	RNEQJRASDILNCS-BTYIYWSLSA-N	449.463	1.944	50	20	IDGD	
CCOC(=O)C(C)(C)c1csc(NC(=O)C(=O)NNC(=O)CCc2ccccc2O)n1	806978484	CZJDSGQXPVOANF-UHFFFAOYSA-N	448.501	1.408	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1cnn(CC(C)C)c1C1CC1	807027224	REEWJTZXPVZJRF-UHFFFAOYSA-N	449.533	1.910	50	20	IDGD	
COC(=O)c1cc(C(C)(C)C)sc1NC(=O)C(=O)NNc1ccc(-n2ccnc2)nn1	807428783	GMEBVHNXGYYDQJ-UHFFFAOYSA-N	443.489	1.890	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cnnc(-c3ccccc3)c2)c1	809940554	MUJCJBXQJPIHKV-UHFFFAOYSA-N	425.470	1.469	50	20	IDGD	
Cc1ccc(C)c(S(=O)(=O)NCC(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)c1	810382525	PQYYLMVAQRGZGV-UHFFFAOYSA-N	447.521	1.325	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)NCc2nc(N(C)C)no2)c2ccccc2c1=O	812218336	LKWYFNWRYDMMAF-UHFFFAOYSA-N	442.480	1.180	50	20	IDGD	
COCCN(CC(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1)C(=O)OC(C)(C)C	812728306	JRFMNCJQUIRFRB-UHFFFAOYSA-N	430.527	1.264	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)Nc2ccc(CS(C)(=O)=O)c(F)c2)cc1	812952637	BWWLVLPEVVTYJC-UHFFFAOYSA-N	444.510	1.769	50	20	IDGD	
O=C(NCCc1cccs1)NNC(=O)C1(S(=O)(=O)c2ccccc2)CCOCC1	813424112	HWHFWYVZMWKQTQ-UHFFFAOYSA-N	437.543	1.644	50	20	IDGD	
CCOC(=O)Nc1scnc1C(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	813576528	ULEWIVPLCJBLJK-UHFFFAOYSA-N	427.464	1.582	50	20	IDGD	
Cc1ccc(-c2ccc(Cl)cc2NC(=O)C(=O)NNC(=O)[C@H]2CCc3nncn3C2)o1	815691713	YXFWCXKFKBNSDV-LBPRGKRZSA-N	442.863	1.848	50	20	IDGD	
COC[C@@H](C)n1c(C)cc(/C=C(/C#N)C(=O)NS(=O)(=O)c2cnn3c2OCCC3)c1C	816205301	RGPKILOKXCAVEW-KDVQLTRESA-N	447.517	1.703	50	20	IDGD	
COc1ccc(NNC(=O)[C@@H](C)NS(=O)(=O)c2c(C)nn(C)c2C)c(C(F)(F)F)c1	816703243	VWXZHVKTZKLLHH-SNVBAGLBSA-N	449.455	1.874	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)/C(=C\c1ccc(F)cc1)n1nnnc1C	818023430	IFAYLXNNUVPKJM-SFQUDFHCSA-N	440.435	1.744	50	20	IDGD	
CCOC(=O)c1c[nH]nc1S(=O)(=O)NNC(=O)[C@H](C)Oc1ccc2ccccc2c1	818787348	CCRMGEYZLPXCIC-LBPRGKRZSA-N	432.458	1.517	50	20	IDGD	
CSC[C@@H](C(=O)NNC(=O)COc1cc(C)cc(C)c1)N1C(=O)[C@H]2CCCC[C@H]2C1=O	863998489	YWNTVHYNOKMRHD-KSZLIROESA-N	447.557	1.736	50	20	IDGD	
COc1ccc(C(=O)NCC(=O)NNC(=O)COc2ccc(C)c(C)c2)cc1[N+](=O)[O-]	913450277	QHSJJCAQHNUFRO-UHFFFAOYSA-N	430.417	1.176	50	20	IDGD	
COCCc1ccc(S(=O)(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)cc1	914845686	JMBSPHPMXXYJAG-UHFFFAOYSA-N	440.547	1.100	50	20	IDGD	
C[C@@H]1CN(c2ccccc2C=NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)CCO1	915949894	UQXFOSYIIFISKR-CYBMUJFWSA-N	436.921	1.976	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NC[C@H]2COc3ccccc3C2)cc1	916199970	PTFHSAQXTWCCRF-INIZCTEOSA-N	446.529	1.197	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H](CN2CCOCC2)c2ccccc2)c1	916215008	VSYCEEFCAAAHEO-LJQANCHMSA-N	446.529	1.108	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)NCc1ccnc(OCC(F)(F)F)c1	916397490	STMAUGSHTJHRJU-UHFFFAOYSA-N	428.367	1.941	50	20	IDGD	
CC1CCN([C@H](CNC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)C(C)C)CC1	916439072	NTNCMUWQSZNJDK-GOSISDBHSA-N	428.537	1.634	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)c2ccc3c(=O)n(CC)c(O)nc3c2)cc1OC	916746516	SKXGUGOHFKJAHT-UHFFFAOYSA-N	426.429	1.604	50	20	IDGD	
Cc1ccccc1C[C@H](C)NC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	918222102	CTUKTTACNHPRKF-KRWDZBQOSA-N	446.577	1.583	50	20	IDGD	
Cn1cc(C(=O)NNS(=O)(=O)c2ccc(NS(C)(=O)=O)cc2F)c2ccccc21	919955217	CWMNHKYZTZJVIM-UHFFFAOYSA-N	440.478	1.312	50	20	IDGD	
Cc1cc(OCc2ccc(C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)cc2)ccc1Cl	920297700	DOKXSHNDYPKACT-ZDUSSCGKSA-N	439.921	1.926	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)C3(O)CCCC3)c2)cc1	920431879	VNUNFBCKASLBHJ-UHFFFAOYSA-N	433.486	1.562	50	20	IDGD	
CCCCN1C(=O)CC[C@@H](C(=O)NNC(=O)CN2CCCC2=O)[C@H]1c1ccc(OC)cc1	920436229	ZDZZGTBQBGXAGR-XMSQKQJNSA-N	444.532	1.545	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)c1ccc(F)cc1Br)N1C(=O)[C@H]2CCCC[C@H]2C1=O	920456518	WDTSJKQDVNZFOA-ZMLRMANQSA-N	440.269	1.913	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)Nc2cccc(CN3CCC[C@H]3C(N)=O)c2)c1O	920938949	UGMLIXLXSTZOOR-INIZCTEOSA-N	427.461	1.317	50	20	IDGD	
CS(=O)(=O)Cc1nc2ccccc2n1CC(=O)NNc1cccc(S(C)(=O)=O)c1	1116493154	JSNTUAABDGJQAO-UHFFFAOYSA-N	436.515	1.128	50	20	IDGD	
COc1ccc(C=NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1OCC(N)=O	1317704750	ZCUPAEHNVFZZHK-UHFFFAOYSA-N	439.516	1.222	50	20	IDGD	
O=C([C@@H]1CCCCN1Cc1cccnc1)N1CCN(S(=O)(=O)CBr)CC1	1325375688	FTBOMDLUKRJWLE-INIZCTEOSA-N	445.383	1.263	50	20	IDGD	
CNS(=O)(=O)c1ccc(CC(=O)NNC(=O)[C@H](C)Oc2ccc3ccccc3c2)cc1	1325405630	OTDDHDUOAPBGBA-HNNXBMFYSA-N	441.509	1.905	50	20	IDGD	
O=C(/C=N/O[C@@H]1CCCCO1)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1779104695	FXSOBVGMPJWPFR-JXXCDNMZSA-N	436.278	1.036	50	20	IDGD	
CN1CCC(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CO[Si](C)(C)C)C2)CC1	1779539127	XCYPCHJLWFOQEW-WIYYLYMNSA-N	425.646	1.694	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)ccc1Br	1780869344	NQLRXXLWUOWHBC-QAPCUYQASA-N	445.741	1.801	50	20	IDGD	
Cc1nc(CC(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)c(C)s1	1781326160	KUZRJNDXTLPEEN-ZBFHGGJFSA-N	434.331	1.823	50	20	IDGD	
O=C(c1ccc2cccnc2n1)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781330541	YWDFPYZVCYOIGV-KDOFPFPSSA-N	437.269	1.764	50	20	IDGD	
O=C(c1nc2ccc(F)cn2n1)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781335322	XNRAJCSDQAGNRR-MLGOLLRUSA-N	444.236	1.002	50	20	IDGD	
CC(=O)N[C@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)CBr)C2	1781781904	OOIJVLRXICUZNL-HOPMXRPOSA-N	432.359	1.056	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1ccc(O)cn1)C2	1782178052	GPNZLPNAKKDDSK-MBOZVWFJSA-N	425.913	1.097	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H]3CC(c4ccccc4)=NN3)C2)C1	1782606662	OASHWOPSYYBMNR-GZRFBZBPSA-N	449.349	1.366	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cnn(C(C)(C)C)c3)CCO2)C1	1783532083	ITYFMLPDAPAWKG-ACJLOTCBSA-N	427.343	1.865	50	20	IDGD	
COc1cccc(CC(=O)N2CCO[C@]3(CCN(C(=O)[C@H](C)Br)C3)C2)c1	1783532522	JMKATWMCXDCSKV-IFXJQAMLSA-N	425.323	1.851	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](C)n1ccccc1=O)CCO2	1783534307	SNIXXLMTDIFAQP-DEYYWGMASA-N	426.311	1.023	50	20	IDGD	
CC(C)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4c(n3)NC(=O)CC4)C[C@@H]21	1783850512	JYHHMWWRADRPQX-ZOBUZTSGSA-N	448.951	1.825	50	20	IDGD	
CC(C)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc4snnc4c3)C[C@@H]21	1783852422	ZELREYBBDVWSMM-WHOFXGATSA-N	437.953	1.945	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccnc3OCC3CC3)C[C@@H]21)[C@H](O)CCl	1784087120	YZEXEFUBDQFPRM-OWLYRPNTSA-N	437.924	1.063	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3(N4CCN(C)CC4)CC3)C[C@@H]21	1784620524	CMSSPVNKHJVMRH-VJANTYMQSA-N	441.016	1.154	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)Cc3ccc(O)cn3)C2)C1	1784644577	LENNTVZKLIUCGF-YJBOKZPZSA-N	426.311	1.333	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)Cn3cccn3)[C@H]2C1	1785435862	CJLZKNYBYFUFFN-NRKLIOEPSA-N	441.370	1.530	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(OC)nn3C)[C@H]2C1	1785616937	PGSXJAGXKJJPGP-ABHRYQDASA-N	443.342	1.196	50	20	IDGD	
Cc1c(C(=O)Nc2ccc(C3(NC(=O)c4cnccc4C(=O)NN)CCC3)cc2)cnn1C	1787510173	NGAIPLFNUNGRAS-UHFFFAOYSA-N	447.499	1.789	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3nc4ccccc4[nH]3)[C@H]2C1	1787836794	UYEXIVYCODXSOK-QCQGSNGOSA-N	435.322	1.940	50	20	IDGD	
CC[C@H](Br)C(=O)NC1(c2ccc(NC(=O)[C@@H](N)CCC(N)=O)cc2)CCC1	1787978145	NAILLSVWTDEKSO-GJZGRUSLSA-N	439.354	1.887	50	20	IDGD	
C[C@H](Cn1cncn1)C(=O)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1	1788147959	RJZIUAHDFLTUKE-MRXNPFEDSA-N	447.304	1.042	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccn4cncc34)[C@H]2C1	1788419378	BSVXOXDSSBNOAJ-OAOQPFQOSA-N	449.349	1.959	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)c1cccn2cncc12	1788422501	RGVQGAUZHSVNTL-DLKVLKDVSA-N	439.285	1.618	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CNC(=O)c3cc(C)on3)[C@H]2C1	1788667522	IDCVXGAQGODQRF-JKQORVJESA-N	440.928	1.100	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(Cl)ncn3)C[C@@H]21	1788764628	OYAIBGBPDJAIRG-YDHLFZDLSA-N	426.977	1.575	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](CN)c3ccccc3)C[C@@H]21	1789865675	BDCZMBJIIGWSQI-UONLAYADSA-N	442.387	1.945	50	20	IDGD	
CC(C)n1cnc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]3C2)n1	1789865892	IKYNMOQTFURVSG-WZTLGTBRSA-N	432.352	1.689	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]2C1	1791063972	ZJLZWJBLBSTIIZ-DGTMBMJNSA-N	435.315	1.311	50	20	IDGD	
C[C@H](C(=O)NC1(c2ccc(NC(=O)CCC(=O)NN(C)C)cc2)CCC1)n1ccnn1	1791602502	IIAXDVNKPSPTPP-OAHLLOKOSA-N	427.509	1.346	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(F)cc3OC)[C@H]2C1	1791886782	UQTDXVIQMAINKQ-RPZXMPESSA-N	428.888	1.681	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(N2CCN(C)CC2)cc1	1792458660	WAKMAISEAXHJEN-YHELAOLJSA-N	448.995	1.659	50	20	IDGD	
C#CC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCl	1793117131	AVYOCFWBPXTAPV-XFIYOXNOSA-N	427.929	1.141	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(OC(F)F)cn1	1794459272	QBINSBCEHRBJSX-DYNIEEOBSA-N	448.264	1.670	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cccc(Cl)n1)C2	1795111380	GKOKVYUBJIDIGG-DPIQGUFMSA-N	430.730	1.652	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1	1796191586	AUIQLWOIGZDTEJ-BCDXTJNWSA-N	442.708	1.594	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)c1cc(F)c(F)cc1F	1796191716	QWNLYWJYXLQLJM-QDMKHBRRSA-N	432.207	1.349	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2)c1ncsc1Br	1796494231	AFTMWXRHMNYABF-RNLVFQAGSA-N	443.150	1.913	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2nonc2c1	1796886401	WPZCEFAFKWYDNC-OQMKEHIESA-N	437.294	1.600	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1nc2cc(C)c(C)cc2[nH]1	1797672601	MDGNXMFQTDIHBG-BASYENTBSA-N	434.924	1.637	50	20	IDGD	
CCc1ncsc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)CBr)C2	1798760449	HHZBQOMPKGRADO-FMSGJZPZSA-N	430.368	1.940	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(=O)nc2cccnn12	1799189296	ZMJUKNJJMJUDND-QDMKHBRRSA-N	429.553	1.193	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)c1ccc(-c2cccnc2)cc1	1799430025	IBQHFDCCVMYVPJ-YRPNKDGESA-N	429.904	1.552	50	20	IDGD	
CC[C@@H](NC)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C#N)=C/c1ccc(F)cc1F	1800332983	JTNYOXZMFHFGAP-UHVSXOQYSA-N	432.471	1.459	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Sc1ccccn1)C2	1800763128	PCQYIRBXPVAJSM-QKDZRIPBSA-N	442.379	1.935	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(C)(C)NC(=O)OC(C)(C)C)C2	1800971097	PUDMVGSFNBTPGQ-XGUBFFRZSA-N	447.960	1.133	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@H]2[C@H](C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)[C@H](O)CCl)C4)[C@@H]2C1	1801897947	UHCNPKPDMHQHNB-FPDCHNRVSA-N	441.956	1.337	50	20	IDGD	
COC[C@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H]1CCN1C(=O)OC(C)(C)C)C2	1802269162	DYJPBPAKDWGVTB-XFIYOXNOSA-N	429.945	1.888	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc(CO)c(F)c2)[C@H]1c1cccnc1)[C@@H](O)CCl	1803146784	CZAWOSYBJATMAH-SNRMKQJTSA-N	435.883	1.632	50	20	IDGD	
Cc1csc(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)c1	1803770587	JCFJKXWVQFAECI-RXVVDRJESA-N	449.341	1.765	50	20	IDGD	
Cn1c(C(=O)NC[C@H]2CCN(C(=O)CCBr)[C@@H]2c2cccnc2)cccc1=O	1805311257	VEDCOGIYFOXSIW-DNVCBOLYSA-N	447.333	1.885	50	20	IDGD	
O=C(c1ccc2nc(CO)[nH]c2c1)N1CCC2(CCCN(C(=O)[C@@H](O)CCl)C2)CC1	1805524603	VMLNMYBXENVPAY-KRWDZBQOSA-N	434.924	1.500	50	20	IDGD	
CC(=O)N[C@H](C)C(=O)N1CC[C@@H](CNC(=O)CCBr)[C@H]1c1cccnc1	1806346199	BLYAZAMCOSELPI-ISTRZQFTSA-N	425.327	1.397	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)C(F)F)[C@H]1c1cccnc1	1806431448	JUUGJPZKNVQKQB-KXUNFBHXSA-N	432.431	1.487	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)/C=C/C2CCCC2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1	1807374312	YUFAAFHCVPDRPR-DSQTUEOOSA-N	447.344	1.827	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H](CNC(=O)Cn2ccccc2=O)[C@@H]1c1cccnc1	1807440832	RPJCWLVQBLDIKJ-GCJKJVERSA-N	442.592	1.801	50	20	IDGD	
O=C(O)c1cc(C(=O)N2CCCC3(CCN(C(=O)[C@@H](F)Br)CC3)C2)ncn1	1807579166	VUITZAGZIWQVSZ-CYBMUJFWSA-N	443.273	1.710	50	20	IDGD	
O=C1CC[C@@H](C(=O)N2CC[C@H](CNC(=O)[C@@H](F)Br)[C@@H]2c2cccnc2)N1	1808662288	XHPZADGMAVQGGP-PAPYEOQZSA-N	427.274	1.057	50	20	IDGD	
CCNC(=O)N[C@@H](C)C(=O)N1CCC2(CCCN(C(=O)CCBr)C2)CC1	1809067420	ZLFVYGKNRXPTJZ-AWEZNQCLSA-N	431.375	1.710	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)N1CC[C@H](CNC(=O)CO[Si](C)(C)C)[C@@H]1c1cccnc1	1810546006	KPSCDOVTSHTXIU-SUMDDJOVSA-N	449.628	1.647	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC2(CCCN(C(=O)c3ccc4c(n3)OCCO4)C2)CC1	1810762105	ANTOLUYIKJCXCN-HNNXBMFYSA-N	437.924	1.951	50	20	IDGD	
COc1cc(C#N)cc(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)c1	1811407550	WOJQXVFPBYJMPL-VDGAXYAQSA-N	442.903	1.881	50	20	IDGD	
CCNC(=S)NCC(=O)NC[C@@H]1CCN(C(=O)C(Cl)Cl)[C@@H]1c1cccnc1	1812333406	OGOXXMDDWPAADD-GXTWGEPZSA-N	432.377	1.375	50	20	IDGD	
CC(=O)NCCC(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)CBr)[C@H]1c1cccnc1	1812654532	KTONAXNZOBFDFG-OWQGQXMQSA-N	439.354	1.645	50	20	IDGD	
CCOC(CC(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)OCC	1813201426	HNJSIPCKQQYOCS-BXWFABGCSA-N	427.929	1.476	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)C(=O)C2CC2)n[nH]1	1814808427	NMADZEKNAGSXQP-SOAGAIGUSA-N	439.476	1.515	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](O)CCl)n[nH]1	1814874777	DUHNYVHXYMHXPX-CHWSQXEVSA-N	429.905	1.526	50	20	IDGD	
C[C@H](CS(C)(=O)=O)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCBr)[nH]n1	1815226465	DHTILOJLIMMNIV-YPMHNXCESA-N	449.371	1.868	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CN2CCOCC2)n[nH]1	1817148760	CMOLTXSBKOFPMG-KDOFPFPSSA-N	432.352	1.970	50	20	IDGD	
Cc1ccn(C)c1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1	1817472625	PNSBIXUZHJUCTD-SFHVURJKSA-N	435.293	1.356	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)Cn2cnnn2)n[nH]1	1817617683	YZBLLZCVSKCINI-CMPLNLGQSA-N	425.291	1.262	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)CCl)CC2)c1ccc2cccnc2n1	1818972500	XHISMCLZFDXTEU-RISCZKNCSA-N	431.905	1.912	50	20	IDGD	
O=C(/C=C1\C(=O)Nc2ccccc21)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](O)CCl)CC2	1819617510	FVHHVVDBLJBOCE-OEKJYBHSSA-N	446.916	1.691	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H]2C[C@H](O)CN2)n[nH]1	1820754059	WBDXLSWQSLNRNY-IMIFBBOLSA-N	428.331	1.298	50	20	IDGD	
CC(C)CNC(=O)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](F)Br)n[nH]1	1820931833	AHGVUQPSLYOOIM-AAEUAGOBSA-N	432.294	1.865	50	20	IDGD	
Cc1ncc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)cn1	1822413253	QHZQRMLFOKEHBK-MRXNPFEDSA-N	428.497	1.187	50	20	IDGD	
Cn1ccc(=O)cc1C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1	1823006401	FBNWAIIAEBQYFD-ISVAXAHUSA-N	443.298	1.758	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@H](C)NS(=O)(=O)CC)CC1	1824462709	APVUABBILRPXSM-BHYGNILZSA-N	436.018	1.951	50	20	IDGD	
CC[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)Cn1cncn1)CC2	1825446268	ASYHEMDJKSCOTD-VHSXEESVSA-N	427.328	1.520	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CC(F)(F)C(=O)O)CC2	1825999140	QZWWROZNDCRTDQ-SFYZADRCSA-N	425.841	1.419	50	20	IDGD	
O=C(CCc1ccccn1)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827056571	YSQMJTSFXDLJOH-QHCPKHFHSA-N	449.360	1.628	50	20	IDGD	
Cc1cccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)c1F	1830103853	MHMOJFWVEHOFDR-LIRRHRJNSA-N	443.313	1.988	50	20	IDGD	
CS(=O)(=O)CC(=O)N1CCC([C@H]2CCCCN2C(=O)[C@H](F)Br)CC1	1830374637	KOMDRFTYTOULFA-OCCSQVGLSA-N	427.336	1.341	50	20	IDGD	
CS(=O)(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](F)Br)CC1	1830380903	CADFQSGMOSYFQV-DZGCQCFKSA-N	441.363	1.731	50	20	IDGD	
O=C([C@H](F)Cl)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1C[C@H]1c1ccc(F)cc1)CCO2	1830423049	YTGMZGBTQLGBCM-PFRQMTDMSA-N	428.863	1.920	50	20	IDGD	
CC#CC[C@H](C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1)c1ccccc1	1830732463	YUTMPQXURPDBDP-MIZPHKNDSA-N	448.947	1.240	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)COc2ccc(O)nn2)CC1	1831116335	GXOXTJZBKWVSEV-HOTGVXAUSA-N	440.928	1.435	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(OC)n(C)n2)CC1	1831831654	GGSNLDCHHWRJBK-WBVHZDCISA-N	426.945	1.916	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)CCBr)C3)C2)cnc1C	1833295498	HGFQGSZDGUCNTH-IBGZPJMESA-N	440.338	1.553	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3cscn3)CCO2)C1	1834252509	GXYYGRHBHMVWQI-MLGOLLRUSA-N	432.340	1.244	50	20	IDGD	
O=C(CCBr)NC1CCN(C2CCN(C(=O)c3cnc(O)[nH]3)CC2)CC1	1834423136	HIHTUWWUDVFMCI-UHFFFAOYSA-N	428.331	1.086	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnoc3C3CC3)CCO2)C1	1834616851	YDWZJZGSSVMFML-KPZWWZAWSA-N	442.310	1.405	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC(N2CCC(NC(=O)CN3CCCC3=O)CC2)CC1	1834626634	YFWLDEKBRVWIQL-UHFFFAOYSA-N	438.645	1.032	50	20	IDGD	
Cc1cnn(CC(=O)NC2CCN(C3CCN(C(=O)[C@H](C)Br)CC3)CC2)c1	1834895215	YXNWPGPNANFLCS-HNNXBMFYSA-N	440.386	1.547	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)C(F)(F)C(F)(F)C(=O)O)CC2)CC1)[C@@H](F)Cl	1835079192	NLSJQXGQPUIVKE-LLVKDONJSA-N	449.804	1.448	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3ccc(Cl)nn3)CC2)CC1	1835882726	LFZNTLPOUSSWEU-HNNXBMFYSA-N	444.363	1.569	50	20	IDGD	
CC(=O)C[C@@H](C)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](F)Br)CC2)CC1	1836414324	DUTLYYJWCMGPOA-MLGOLLRUSA-N	434.350	1.864	50	20	IDGD	
CC[C@H](Br)C(=O)NC1CCN(C2CCN(C(=O)Cn3cncn3)CC2)CC1	1836541948	OEKWBWHTYQHNMG-INIZCTEOSA-N	441.374	1.023	50	20	IDGD	
O=C([C@H](F)Br)N1CCOC[C@@]2(C1)CN(C(=O)C1(C(F)(F)F)CC1)CCO2	1836719670	OVEBSRNEFDASNB-GXFFZTMASA-N	447.223	1.476	50	20	IDGD	
O=C(c1cc2n(n1)CCCC2)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1836980613	IENGLTPEKINJIH-GOSISDBHSA-N	431.320	1.093	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(F)nc3)CCO2)C1	1837840080	DUPGDUCFDLSCGZ-ACJLOTCBSA-N	444.301	1.322	50	20	IDGD	
CN1C(=O)CC[C@H]1C(=O)N1CCC(OC2CCN(C(=O)CO[Si](C)(C)C)CC2)CC1	1838430665	QDMCJMGMKRRGRT-SFHVURJKSA-N	439.629	1.457	50	20	IDGD	
O=C(CCn1ccnn1)N1CCC(OC2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1838648134	JVVLUBRJXAIQSE-MRXNPFEDSA-N	446.321	1.357	50	20	IDGD	
Cc1ccccc1C(=O)N1CCO[C@]2(COCCN(C(=O)CCBr)C2)C1	1838898360	MLRYXSXOVKLWQA-IBGZPJMESA-N	425.323	1.850	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(-n4cnnc4)cc3)C2)C1	1839144285	UIIAILVGZNKOPC-WIYYLYMNSA-N	447.923	1.355	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(NC(C)=O)o3)C2)C1	1839146423	ZAGPFLNWMVUDGZ-AUUYWEPGSA-N	427.885	1.325	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(O)c(C)c3)CCO2)C1	1839309774	SGUOYYSDBPZDST-UZLBHIALSA-N	426.897	1.024	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3ccc[nH]3)C2)C1	1839963945	AXEJWOHWXMGJGE-APWZRJJASA-N	442.354	1.577	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cncc(O)c3)CCO2)C1	1840064332	GBYBKBRHQSXQNK-YJBOKZPZSA-N	442.310	1.031	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3sccc3Cl)C2)C1	1840153819	BGOPJWAJXBPXBS-CXAGYDPISA-N	437.345	1.725	50	20	IDGD	
COc1cncc(CCC(=O)N2CCOC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)c1	1840186581	QPVWJTAPYWOCJD-IBGZPJMESA-N	446.331	1.283	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)CSc2ccc(F)cc2F)C1	1841564072	YXUSUOKWAZRNNC-UHFFFAOYSA-N	446.284	1.254	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)c2cncnc2C)C1	1844513753	WACFYGFUASWCNL-UHFFFAOYSA-N	439.428	1.749	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@H]2[C@H]3CN(C(=O)OC(C)(C)C)C[C@H]32)C1	1846134193	OWMUCBONXDVIIH-QKPAOTATSA-N	441.956	1.557	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@H]1CN(C(=O)OC(C)(C)C)CCO1)C2	1846360453	MULLWRJGFIHKNS-GJZGRUSLSA-N	445.944	1.080	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)Cc1cccc(C(F)(F)F)n1)C2	1846384202	PRKDGUGPTYZLNK-UHFFFAOYSA-N	441.454	1.219	50	20	IDGD	
CS(=O)(=O)c1ccc(Cl)c(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](O)CCl)c1	1847568038	LAOLOOKRPPXKIO-SOUVJXGZSA-N	435.329	1.159	50	20	IDGD	
O=C(NNC(=O)c1ccc[n+]([O-])c1)c1cccc(S(=O)(=O)Nc2ccccc2Cl)c1	23710455	LZYAJDPTWNEVDN-UHFFFAOYSA-N	446.872	1.849	50	20	IDGD	
CS(=O)(=O)N1CCCc2cc(C(=O)NNC(=O)Cc3c[nH]c4ccccc34)ccc21	26536378	XTXBKBJVNOEHKE-UHFFFAOYSA-N	426.498	1.884	50	20	IDGD	
Cc1cccc(NC(=S)NNC(=O)CN2C(=O)COc3ccc([N+](=O)[O-])cc32)c1C	28615528	GGDHTUKRTHSULO-UHFFFAOYSA-N	429.458	1.955	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(C(=O)NNC(=O)c2cc(Br)c[nH]2)ccc1Cl	28717714	VXSZJGYFYBYPFN-UHFFFAOYSA-N	449.714	1.756	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)CCCc2nc(C(C)(C)C)no2)c2ccccc2c1=O	31203601	PBSWRYUCBDMQCF-UHFFFAOYSA-N	426.477	1.881	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)c3cnc(C)cn3)c2)cc1	45617023	MMHLTNNODQYKPS-UHFFFAOYSA-N	441.469	1.669	50	20	IDGD	
CC(=O)Nc1cccc(-n2cnnc2SCC(=O)NNC(=O)c2ccc(F)cc2)c1	105809928	KBHXLHCDQQEJLT-UHFFFAOYSA-N	428.449	1.918	50	20	IDGD	
CON(C)S(=O)(=O)c1cc(C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)ccc1Cl	725867938	BKIYFTULJSQWEG-UHFFFAOYSA-N	442.837	1.505	50	20	IDGD	
Cc1ccc([C@@H](CNC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)N2CCCC2)o1	726271020	LNCAIRISUUCYOQ-QGZVFWFLSA-N	438.488	1.616	50	20	IDGD	
COC(=O)N1CCC[C@H](NC(=O)NNC(=O)[C@@H](C)Oc2cccc(Br)c2)C1	726610558	LNYJMCBGJPNTMR-YPMHNXCESA-N	443.298	1.778	50	20	IDGD	
C[C@H](CC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1ccccc1F	726750504	SXPSXMIKHFJBCU-OAHLLOKOSA-N	449.504	1.801	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)/C=C\c2ccccc2Cl)c1	727350747	VCRFDQGQOULRRR-KHPPLWFESA-N	443.934	1.825	50	20	IDGD	
CCOC(=O)C1=NN(c2ccccc2)[C@@H](C(=O)NNC(=O)c2ccc3c(c2)OCCO3)C1	727747978	FQLGZKAWCGPHKA-QGZVFWFLSA-N	438.440	1.417	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(Cl)c(S(=O)(=O)NNC(=O)NCC2CC2)c1	728263126	SCXBBDNPQAKXKC-UHFFFAOYSA-N	438.959	1.273	50	20	IDGD	
O=C(COC(=O)c1cnc(-c2ccccc2)s1)NNC(=O)[C@H]1COc2ccccc2O1	728328074	FLAIYHSFINOILM-MRXNPFEDSA-N	439.449	1.954	50	20	IDGD	
CC(=NNC(=O)C1CCN(c2ncccn2)CC1)c1cccc(S(=O)(=O)N(C)C)c1	728782671	PCVKIEWTQOUXGZ-UHFFFAOYSA-N	430.534	1.484	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(CCC(=O)NNC(=O)c2cccc(C#N)c2)cc1	728828644	UOFBIINCHHLZRL-UHFFFAOYSA-N	428.514	1.983	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCCN1C(=O)c1ccccc1)c1csc(N2CCOCC2)n1	729301023	WCHWQADYNGVFEP-QGZVFWFLSA-N	443.529	1.436	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)c1sccc1S(=O)(=O)N1CCOCC1	729449845	HEVUKBRNEXTIHK-UHFFFAOYSA-N	448.526	1.185	50	20	IDGD	
O=C(CCC/N=C1/NS(=O)(=O)c2ccccc21)NNC(=O)Cn1ccc2ccccc21	729450262	RDIHCGRPMKQZEL-UHFFFAOYSA-N	439.497	1.308	50	20	IDGD	
O=C(O)COc1ccc(S(=O)(=O)NNC(=O)CCc2ccccc2O)cc1Cl	729962925	NVHOUUUUDVWNHT-UHFFFAOYSA-N	428.850	1.451	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)[C@@H]1CC(=O)N(c2ccc3c(c2)OCCO3)C1	730034082	QWATZSJWHFCYRR-OAHLLOKOSA-N	425.441	1.297	50	20	IDGD	
COc1cc(C(=O)NNC(=O)N[C@@H](C)CN2CCN(C)CC2)ccc1OCCC(C)C	730131567	RCKQMLSNSBAECV-KRWDZBQOSA-N	435.569	1.700	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1)c1ccc2c(c1)OCCO2	731964661	LEHGQTKWGOPZBH-LBPRGKRZSA-N	446.441	1.493	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)N1CCN(Cc2csc(-c3ccc(OC)cc3)n2)CC1	732197236	XTRKWEJYJRJXRJ-HNNXBMFYSA-N	431.562	1.882	50	20	IDGD	
CC(C)[C@H](NC(=O)OCc1ccccc1)C(=O)NNC(=O)CCN1C[C@@H](C)O[C@H](C)C1	732261407	MTOTXPSCGVAKRQ-HLIPFELVSA-N	434.537	1.584	50	20	IDGD	
O=C(NNC(=O)C1CCC1)c1cccc(NS(=O)(=O)c2ccc3nnn(O)c3c2)c1	732292329	MJJDBOMDOHLMNV-UHFFFAOYSA-N	430.446	1.031	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NCc1ccc(N(C)S(C)(=O)=O)cc1	732476037	WOVMYMKAAIRQJC-ZDUSSCGKSA-N	438.481	1.519	50	20	IDGD	
CSCC[C@@H](NC(=O)Cc1ccccc1)C(=O)NNC(=O)[C@@H]1COc2ccccc2O1	732749653	CXFXNMZZKKGIAJ-APWZRJJASA-N	443.525	1.454	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(C(=O)NNC(=O)NCc2ccc(Cl)cc2)cc1	733003309	GUFHMRRABMXLSL-UHFFFAOYSA-N	440.909	1.409	50	20	IDGD	
C#CCOc1ccccc1CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	734216081	KGYMFHBGVQHJFL-UHFFFAOYSA-N	430.486	1.093	50	20	IDGD	
CC(=NNC(=O)NCCNC(=O)OC(C)(C)C)c1cccc(S(=O)(=O)N(C)C)c1	734303253	ISKOBXVHPRMXCH-UHFFFAOYSA-N	427.527	1.485	50	20	IDGD	
CCN(C)[C@H](C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1)c1ccccc1	735118398	UGRZXQLXYYAJGA-IBGZPJMESA-N	446.577	1.154	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(O)nc3ccc(F)cc23)c1	737765932	CIEMVLQZLSDJDH-UHFFFAOYSA-N	432.433	1.405	50	20	IDGD	
O=C(COC(=O)c1cc(O)nc2cc(F)ccc12)NNC(=O)c1cccc([N+](=O)[O-])c1	740252081	BHDFUGGDGYQYDS-UHFFFAOYSA-N	428.332	1.606	50	20	IDGD	
CC(=NNC(=O)[C@H](C)CN1C[C@H](C)O[C@H](C)C1)c1cccc(N2CCCS2(=O)=O)c1	741162641	AYEWETSXVQIARR-ZACQAIPSSA-N	436.578	1.812	50	20	IDGD	
CCOC(=O)C1(NCC(=O)NNC(=O)c2cc(Cl)ccc2OC)Cc2ccccc2C1	741795846	ARJPJFCZYWSRHK-UHFFFAOYSA-N	445.903	1.800	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)c1ncoc1-c1ccc2c(c1)OCCO2	742033797	RVXOYLFHOQHBHC-UHFFFAOYSA-N	425.397	1.961	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc(NS(C)(=O)=O)c1OC	742463693	VRWNAAMCJIGIEX-UHFFFAOYSA-N	438.418	1.058	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)c2cn(Cc3ccccn3)nn2)CC1	742681975	MVJFENSJHXKZDV-UHFFFAOYSA-N	444.496	1.065	50	20	IDGD	
CC(C)C(=O)c1ccc(S(=O)(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1	743251893	YJPHVTCPLQTFRM-UHFFFAOYSA-N	438.531	1.442	50	20	IDGD	
COc1cccc(O[C@@H](C)CNC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)c1	743672740	LSGPVLTWPBTSBJ-AWEZNQCLSA-N	425.445	1.998	50	20	IDGD	
C#CCNS(=O)(=O)c1ccc(C(=O)NNC(=O)Nc2ccc(OC(F)F)cc2)cc1	743832944	WHTFGPJTJJPHFE-UHFFFAOYSA-N	438.412	1.666	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1ccnc(-n2ccnc2)c1	744619118	IQDAJILBHJGMBN-UHFFFAOYSA-N	428.474	1.045	50	20	IDGD	
CC(C)NC(=O)NNC(=O)c1ccc(Cl)c(S(=O)(=O)N2C[C@@H](C)O[C@H](C)C2)c1	745146342	LULZXWKMGMVSNI-VXGBXAGGSA-N	432.930	1.490	50	20	IDGD	
COc1cc(C(=O)OCC(=O)NNC(=O)c2ccc(C)cc2)cc(NC(C)=O)c1OC	745438343	AMQCBMFUDASZGD-UHFFFAOYSA-N	429.429	1.589	50	20	IDGD	
CN(C)C(=O)[C@H]1CCC[C@@H](NC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)C1	745824637	KNZXMFVJIHXWOK-GXTWGEPZSA-N	425.511	1.073	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)[C@H]1[C@H](C)OC(C)(C)N1C(=O)OC(C)(C)C	746094170	CPCRBTAPHFQVLV-SUMWQHHRSA-N	437.493	1.982	50	20	IDGD	
C[C@H]1OC(C)(C)N(C(=O)OC(C)(C)C)[C@@H]1C(=O)NNC(=O)COc1ccc(C#N)cc1	746095049	WZNJGLNZEYZAMC-DYVFJYSZSA-N	432.477	1.845	50	20	IDGD	
CC(=O)N1CCN(c2ccccc2CNC(=O)NNC(=O)Cc2cn3ccccc3n2)CC1	746762885	WNFKDIGNFWJLAT-UHFFFAOYSA-N	449.515	1.076	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@H]2CCCN2Cc2ccc(F)cc2)c2ccccc2c1=O	747345244	LFZKPBYLQKWIDO-LJQANCHMSA-N	437.475	1.981	50	20	IDGD	
NC(=O)c1ccc(C(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)o1	747377075	ZDXULYDWULBTLN-UHFFFAOYSA-N	434.455	1.316	50	20	IDGD	
Cc1ccsc1[C@H]1C[C@@H]1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	747693929	RVXCLUPLFSXMPO-IRXDYDNUSA-N	449.554	1.642	50	20	IDGD	
NC(=O)CC[C@@H](C(=O)NNc1cccc(Br)c1)N1C(=O)c2ccccc2C1=O	748020857	RAHYCVWKCFFPAB-HNNXBMFYSA-N	445.273	1.823	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@](F)(C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)C1	748209784	LPGVGHZDWGSUNH-FQEVSTJZSA-N	434.424	1.212	50	20	IDGD	
CCn1cc(CC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c2ccccc21	748213513	ACVJCDVSTSONSI-UHFFFAOYSA-N	428.514	1.915	50	20	IDGD	
C[C@]1(NNC(=O)NCc2cc(Br)ccc2OC(F)F)CCS(=O)(=O)C1	750335388	NVQGRXTYIOJYBF-AWEZNQCLSA-N	442.282	1.932	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)N[C@@H]1CCN(c2cccc(Cl)c2)C1=O	750670505	MECBCQSDVFQTBH-CQSZACIVSA-N	447.835	1.763	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)Cc1csc(NC(=O)c2ccccc2F)n1	751201362	IPOZNSYDEWLDCH-UHFFFAOYSA-N	445.432	1.247	50	20	IDGD	
COc1ccc(CSCC(=O)NNC(=O)CNC(=O)c2cccs2)cc1[N+](=O)[O-]	751209958	ZKSKGKPUMWEAQN-UHFFFAOYSA-N	438.487	1.476	50	20	IDGD	
CCOC(=O)[C@H]1Cc2cc(S(=O)(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)ccc2O1	751538427	JYMAFTQGTXMEIR-MRXNPFEDSA-N	435.414	1.085	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(NC(=O)NNC(=O)COc2ccc(Br)cc2)C1	751802753	AKKZPGQHVVAUKX-UHFFFAOYSA-N	443.298	1.778	50	20	IDGD	
Cc1cc(Cl)c(S(=O)(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1[N+](=O)[O-]	753069935	YTLRCPITUAGWLO-AWEZNQCLSA-N	427.822	1.706	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)Nc1ccc(Br)cc1Cl)S(C)(=O)=O	754128358	DCDSGHIDMSXHEM-SSDOTTSWSA-N	427.708	1.871	50	20	IDGD	
CCc1cc(NNC(=O)c2ccc(S(=O)(=O)CC(N)=O)cc2)nc(-c2ccccn2)n1	754418961	AWVDBEABSDXVTI-UHFFFAOYSA-N	440.485	1.117	50	20	IDGD	
O=C(NNC(=O)c1ccccc1O)Nc1ccc(N2CCOCC2)cc1N1CCOCC1	755453247	JIFGMPSMHPDYQU-UHFFFAOYSA-N	441.488	1.532	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)Nc2cc(C)nn2[C@H]2CCS(=O)(=O)C2)c1	755532823	MJILVFSEEQGRBN-HNNXBMFYSA-N	435.506	1.400	50	20	IDGD	
CC(C)(C)S(=O)(=O)N1CCC(NC(=O)NNC(=O)Cn2ccc3ccccc32)CC1	755885306	FXELEJOMCHNSAF-UHFFFAOYSA-N	435.550	1.564	50	20	IDGD	
COc1ccccc1OCC(=O)Nc1cccc(NC(=O)NNC(=O)c2cnccn2)c1	756092415	BHANHKYWZJNWKU-UHFFFAOYSA-N	436.428	1.969	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)N[C@H]1CCN(C(=O)CCc2ccccc2)C1	756917008	MQSOARWAYRXUMW-KRWDZBQOSA-N	428.464	1.769	50	20	IDGD	
Cc1nc(N2CCOCC2)ccc1NC(=O)NNC(=O)CCCNC(=O)OC(C)(C)C	757733403	MZYNYQICRCVXPA-UHFFFAOYSA-N	436.513	1.684	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2nc(Cl)ccc2F)c1	758044031	UFRDEBRAYQTFAL-UHFFFAOYSA-N	428.873	1.979	50	20	IDGD	
COCCOc1cc(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)nc2ccccc12	758096198	QSCHFGIIPUNAKP-UHFFFAOYSA-N	433.428	1.311	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc(Br)cc2c1OCC2)c1cccc([N+](=O)[O-])c1	758148741	RFPMIAOKXUWSPJ-UHFFFAOYSA-N	442.247	1.916	50	20	IDGD	
COC(=O)C12CCC(C(=O)OCC(=O)NNC(=O)c3ccc(OC)c(OC)c3)(CC1)C2	759261449	BYNNVVCCNDUXDI-UHFFFAOYSA-N	434.445	1.132	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)c1cccc(OCC(F)F)n1	760223927	NREWYTGCELFAPI-UHFFFAOYSA-N	433.459	1.699	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1cc2ccccc2nc1Br	760291900	QSDLUNFJLJQZLG-JTQLQIEISA-N	439.266	1.135	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)NCCN1CCN(c2ccccc2)CC1	763477348	KYKDDSYJZHPROD-UHFFFAOYSA-N	429.546	1.637	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)NC1CCN(c2ccc(C#N)cn2)CC1	763497709	SVSZADQZXJVQKI-UHFFFAOYSA-N	445.524	1.557	50	20	IDGD	
CCOC(=O)c1ccn(-c2ccccc2NC(=O)C(=O)NNC(=O)c2ccccc2O)n1	763531932	UINVVHQOTFJZOT-UHFFFAOYSA-N	437.412	1.154	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2ccc(N3CCOC[C@@H]3C)cc2)c1	763665868	QAOFBGHGCDAUCK-KRWDZBQOSA-N	440.500	1.693	50	20	IDGD	
CCOc1cc(Cl)ccc1NC(=O)C(=O)NNC(=O)c1nnc(O)c2ccccc12	763790700	MYCYGFWHJQBPQH-UHFFFAOYSA-N	429.820	1.787	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(OC2CCC2)c(F)c1	763808684	PBEKALHTWVOQQT-UHFFFAOYSA-N	426.404	1.794	50	20	IDGD	
Cc1nn(-c2ccc(C#N)cc2)c(NC(=O)C(=O)NNC(=O)Cc2ccc(F)cc2)c1C	763920160	GMFFTQMRWHNUJP-UHFFFAOYSA-N	434.431	1.829	50	20	IDGD	
CCOC(=O)c1cc(C)sc1NC(=O)C(=O)NNC(=O)c1cc(Br)c[nH]1	763994956	KFTRDTZOKFRFRG-UHFFFAOYSA-N	443.279	1.724	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(-c3nccs3)cc2)c1	764078410	TWMXOZQTQSTWMG-UHFFFAOYSA-N	444.494	1.613	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(NC(=O)C(=O)NNC(=O)CC2CC2)ccc1Cl	764144199	VROLSXZSGGZCLM-UHFFFAOYSA-N	430.914	1.257	50	20	IDGD	
O=C(NNC(=O)c1cccc(OC(F)F)c1)C(=O)Nc1cccc(Cn2cccn2)c1	764251875	ZYVQKVHVEUXWKB-UHFFFAOYSA-N	429.383	1.933	50	20	IDGD	
CCCOC(=O)c1cc(Br)ccc1NC(=O)C(=O)NNC(=O)COCC	764318362	TUMQZPQLXSAMAG-UHFFFAOYSA-N	430.255	1.138	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C#N)cc2F)cc1Br	764325920	ALISCEXMGVLGBH-UHFFFAOYSA-N	435.209	1.868	50	20	IDGD	
CCOC(=O)N1[C@H](C(=O)NNC(=O)CNC(=O)c2cccnc2)CC[C@@H]1c1ccc(C)o1	764345170	OQWJUWRVAJFWDL-CVEARBPZSA-N	443.460	1.222	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)C(=O)Nc1ccnn1CCc1ccccc1	764351092	OQPWAYIAQSNSDV-UHFFFAOYSA-N	443.467	1.711	50	20	IDGD	
O=C(NNC(=O)C(F)(F)Oc1ccccc1)C(=O)Nc1ccc(CN2CCOC2=O)cc1	764377208	AYFMWPREQIJILY-UHFFFAOYSA-N	448.382	1.397	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc4c(c3)NC(=O)CO4)n[nH]2)cc1C	764389176	YSMNTDLTIOXYRG-UHFFFAOYSA-N	448.439	1.424	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)c1ccc2c(c1)OCCO2	765756776	PRIRRCMINQZPGO-UHFFFAOYSA-N	444.919	1.690	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)NCCOc2ccc(S(=O)(=O)C(F)(F)F)cc2)o1	766547732	ABENTBQHDBWUKN-UHFFFAOYSA-N	435.380	1.905	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@@H](C)Sc3ccccn3)CC2)cc1	766651160	ZZSZCJFOASSQTM-GOSISDBHSA-N	427.574	1.836	50	20	IDGD	
CCOC1CC(CNC(=O)NNC(=O)c2ccc(Cl)cc2OC)(N2CCOCC2)C1	767888296	RTJWYVKGGCNZSU-UHFFFAOYSA-N	440.928	1.563	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)N[C@H]1CC(=O)N(Cc2ccccc2C(F)(F)F)C1	767934398	GKEIRLCMJDLXMS-HNNXBMFYSA-N	435.406	1.774	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3ccc(-n4ccnc4)nc3)n[nH]2)cc1OC	768277604	QMOHOPHOWCJTMA-UHFFFAOYSA-N	433.428	1.749	50	20	IDGD	
N#Cc1cc(Cl)nc(NNC(=O)c2ccc3c(c2)SC2=NS(=O)(=O)CCN23)c1	768713870	SFXDFBCCXLJRIX-UHFFFAOYSA-N	434.890	1.975	50	20	IDGD	
C[C@@H](C(=O)NNc1ncnc2[nH]cnc12)N1C(=O)c2ccc(Br)cc2C1=O	769650187	HSRSQNWJYYBLAZ-ZETCQYMHSA-N	430.222	1.243	50	20	IDGD	
CSCCNC(=S)NNC(=O)c1ccc(S(=O)(=O)N2CCCC[C@H]2C)cc1	769767570	QVRVKZGOOHOFQF-CYBMUJFWSA-N	430.621	1.722	50	20	IDGD	
COCCOc1ccc(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c(Cl)c1	769923049	JKWAAHHEIJQMKZ-UHFFFAOYSA-N	433.896	1.833	50	20	IDGD	
CSCC[C@@H](NC(=O)c1ccccc1Cl)C(=O)NNc1nc(O)c2cnn(C)c2n1	770972192	FYOWDSWITSZJNP-CYBMUJFWSA-N	449.924	1.717	50	20	IDGD	
O=C(NNc1ccnc(Br)c1)c1ccc2c(c1)S(=O)(=O)N(C1CC1)C2=O	771552871	PXUCEURQYZKLHV-UHFFFAOYSA-N	437.275	1.908	50	20	IDGD	
COc1ccc([C@@H]2[C@@H](C(=O)O[C@H](C)C(=O)NNC(=O)CC(C)C)CCC(=O)N2C)cc1	772136629	MWEBIDRJCGMRLJ-CFLQYTFWSA-N	433.505	1.730	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)c1cccc(Oc2cnccn2)c1	772196407	KGCHFARQJGPZCP-UHFFFAOYSA-N	425.832	2.000	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)c1ccc(S(C)(=O)=O)c(Br)c1	772234705	DDAFDXYFMKWSNE-JTQLQIEISA-N	449.323	1.591	50	20	IDGD	
CC(=O)N1CCN(Cc2ccc(NC(=O)C(=O)NNc3ccccc3[N+](=O)[O-])cc2)CC1	773650521	KPDRGFCJCGUVDW-UHFFFAOYSA-N	440.460	1.341	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2cc(C(=O)N3CCCCCC3)ccc2OC)n1	773724659	XZDYYTZTEZENFJ-UHFFFAOYSA-N	442.476	1.592	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)NCc2ccc(S(N)(=O)=O)c(C)c2)c1	775227311	ZLXFYIBVFGJDQC-UHFFFAOYSA-N	448.545	1.984	50	20	IDGD	
Cc1cc(CNC(=O)NNC(=O)Cc2ccc3ccccc3c2)ccc1S(N)(=O)=O	775233073	ZNPLSTWWRBMMRS-UHFFFAOYSA-N	426.498	1.869	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)Nc1ccc(C[C@H]2NC(=O)NC2=O)cc1	775705147	YLMFAOLOUCDQRL-CQSZACIVSA-N	431.836	1.566	50	20	IDGD	
C[C@H]1[C@H](C)N(C(=O)OC(C)(C)C)CCN1C(=O)NNC(=O)CNC(=O)c1cccs1	776322404	ZLAQPYPDYNKMST-STQMWFEESA-N	439.538	1.548	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(OCC(=O)NNc2ccccc2S(C)(=O)=O)CC1	777141551	OVDBJUJCFJOEOF-UHFFFAOYSA-N	427.523	1.949	50	20	IDGD	
CCn1c(SCC(=O)NNC(=O)CNC(=O)OC(C)(C)C)nnc1-c1cccs1	778442913	HVGAYSXAJXZJNN-UHFFFAOYSA-N	440.551	1.791	50	20	IDGD	
O=C(COC(=O)c1ccc(Br)c(O)c1)NNC(=O)c1cccc([N+](=O)[O-])c1	778827693	BEIBKLPHYDNTQO-UHFFFAOYSA-N	438.190	1.681	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)Nc2ccnn2Cc2ccc(F)cc2)c2ccccc2c1=O	779456834	PIOJFWPNCBBISC-UHFFFAOYSA-N	435.419	1.784	50	20	IDGD	
COc1cccc(-n2nc(C)c([C@@H]3COCCN3CC(=O)NNC(=O)C3CC3)c2C)c1	779612338	CZGOITYSSVZXHI-IBGZPJMESA-N	427.505	1.428	50	20	IDGD	
COc1cccc(-c2noc(SCC(=O)NNC(=O)[C@H]3COc4ccccc4O3)n2)c1	781070429	IEWUWIUQZZGSCB-MRXNPFEDSA-N	442.453	1.825	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(N2C[C@@H](C(=O)NNc3ccnc(F)c3)CC2=O)cc1	781366403	DISVPFAWEXEUSX-AWEZNQCLSA-N	449.508	1.747	50	20	IDGD	
CCn1c(=O)n(CC)c2nc(NC(=O)CCC(=O)NNc3ccc(OC)cn3)ccc21	781516185	IZXSLDFDVLCFCL-UHFFFAOYSA-N	427.465	1.503	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)nc1Br	781645772	JNJFPWRFCBOJTP-UHFFFAOYSA-N	435.282	1.320	50	20	IDGD	
COC(=O)COc1ccc(C=NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)cc1	782230046	XFOQYMOAGVRTIU-UHFFFAOYSA-N	438.528	1.815	50	20	IDGD	
COc1ccc2cc(NC(=O)C(=O)NNC(=O)Cc3nc4ccccc4n3C)ccc2n1	782894581	POEHVOKONAIEKU-UHFFFAOYSA-N	432.440	1.459	50	20	IDGD	
Cc1c(C(C)(C)C)nn(-c2ccccc2)c1NC(=O)C(=O)NN[C@@]1(C)CCS(=O)(=O)C1	783428471	WPJQHFAMPAUBHT-NRFANRHFSA-N	447.561	1.615	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNc2ccc(Br)cn2)cc1	784340586	FBVWQQZORSPQII-UHFFFAOYSA-N	442.295	1.688	50	20	IDGD	
Cc1nccc(-c2cccc(NC(=O)C(=O)NNc3cccc(S(C)(=O)=O)c3)c2)n1	784846090	KORKRQNMPYDBIS-UHFFFAOYSA-N	425.470	1.937	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)C(=O)Nc2cccc(CS(=O)(=O)C(C)C)c2)c1	784853451	IYGWVVKMGXSTJL-UHFFFAOYSA-N	433.486	1.878	50	20	IDGD	
COCCOc1ccccc1NC(=O)C(=O)NNc1c(F)cc(C(=O)NC2CC2)cc1F	785099283	COWPZLGHUSPKDQ-UHFFFAOYSA-N	448.426	1.964	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2ccc(OC)c(-n3nnnc3C)c2)cc1Cl	785116201	CDRVJFPPSIQNGF-UHFFFAOYSA-N	431.840	1.723	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2cc(-c3ccc(Cl)s3)nn2C)c1O	787543574	YODSVFWETHKYKG-UHFFFAOYSA-N	449.876	1.916	50	20	IDGD	
Cc1nc(-c2cccnc2)nc(NNC(=O)CCC(=O)Nc2ccc3nc(O)[nH]c3n2)c1C	787894849	PKXLXUKZMXLCDJ-UHFFFAOYSA-N	447.459	1.994	50	20	IDGD	
CCOC(=O)[C@@H](C)NC(=O)c1ccc(NC(=O)NNc2cc(Cl)nc(N)n2)cc1F	789118717	JOVXYTKDMKVJJF-MRVPVSSYSA-N	439.835	1.681	50	20	IDGD	
CCC[C@@H]1CCc2nc(NC(=O)C(=O)NNC(=O)CNC(=O)c3cccs3)sc2C1	789757632	OHDQKJLIKCUWKF-LLVKDONJSA-N	449.558	1.626	50	20	IDGD	
CNS(=O)(=O)c1cccc2c1CCN(C(=O)NNC(=O)Cn1ccc3ccccc31)C2	790713019	UPLQLOJGXHATEM-UHFFFAOYSA-N	441.513	1.349	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2ccc3[nH]c(C(=O)NC)cc3c2)c2ccccc2c1=O	791908231	IONYBMQRBYUBLM-UHFFFAOYSA-N	447.455	1.724	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)CCc2ccccc2O)cccc1NC(=O)N(C)C	792355358	GORDSLMMBBIYGH-UHFFFAOYSA-N	427.461	1.513	50	20	IDGD	
O=C(NC[C@@H]1CCCO1)Nc1ccc(NC(=O)C(=O)NNc2nc3ccccn3n2)cc1	792389362	UAXJUZCXCBPQSW-HNNXBMFYSA-N	438.448	1.112	50	20	IDGD	
C[C@](O)(Cn1cc(C(F)(F)F)ccc1=O)C(=O)NNC(=O)c1cc(Cl)ccc1O	792629549	RXDHRABVBFPOQB-INIZCTEOSA-N	433.770	1.438	50	20	IDGD	
O=C(NNC(=O)c1cccc(NN2C(=O)[C@H]3CC=CC[C@@H]3C2=O)c1)c1ccc([N+](=O)[O-])cc1	792762184	NZOBPQXGAXPQJC-ROUUACIJSA-N	449.423	1.948	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2ccccn2)c(C)n1Cc1ccc(S(N)(=O)=O)cc1	792787700	RDLTWJTXZAZNFJ-UHFFFAOYSA-N	427.486	1.270	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccc(F)cc1-c1cnn(C)c1	796989939	MXUBQLDMWGHYKW-LBPRGKRZSA-N	443.410	1.919	50	20	IDGD	
CN(CCNC(=O)NNC(=O)c1ccc(Cl)cc1F)S(=O)(=O)c1ccc(F)cc1	798098544	KGTGIVJDTPDRQP-UHFFFAOYSA-N	446.863	1.883	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(S(=O)(=O)NNC(=O)c2ccc(Cl)nc2)c1	800833547	FAUMDVWKJHROHH-UHFFFAOYSA-N	446.938	1.389	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2CC(=O)N(C)[C@H]2c2cccc(Cl)c2)cc1	801108370	MJWAMOWYQNBXFU-AEFFLSMTSA-N	428.876	1.954	50	20	IDGD	
CCc1ccccc1-n1cc(O)c(C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)n1	801418471	OYLRHJUDJUZPCD-UHFFFAOYSA-N	433.424	1.630	50	20	IDGD	
CC(C)(C)C(=O)Nc1nccnc1C(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	802064404	PEHBRVFRYNTPAJ-UHFFFAOYSA-N	434.478	1.331	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)CS[C@H]2CCS(=O)(=O)C2)cc1Cl	802076814	XRQPSQQJJKSMIG-VIFPVBQESA-N	437.927	1.430	50	20	IDGD	
Cc1nn(Cc2ccccc2)c(N)c1C(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	803396678	LOBIMAGIKHAZQU-UHFFFAOYSA-N	442.501	1.692	50	20	IDGD	
C[C@@H](Cn1ccc2ccccc21)C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	803794219	AOAOYRTZIPSKSX-MGPUTAFESA-N	437.452	1.808	50	20	IDGD	
O=C(NC[C@@H](c1cccs1)N1CCOCC1)NNC(=O)c1cc(Br)c[nH]1	806994331	TULFZOBVXZQPHX-ZDUSSCGKSA-N	442.339	1.856	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1nc(Cc2ccccc2)cs1	807005838	GAMZLFIPEUJIBN-UHFFFAOYSA-N	443.510	1.311	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNc2nccnc2C2CCC2)cccc1S(=O)(=O)NC1CC1	807461890	ZIGMXEMEZPEQAA-UHFFFAOYSA-N	444.517	1.575	50	20	IDGD	
C[C@@H]1COCC[C@H]1CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	807508586	GWWSRQVSZJBPFO-WBVHZDCISA-N	438.550	1.478	50	20	IDGD	
COC(=O)c1c(F)ccc(NC(=O)C(=O)NNC(=O)c2ccc(OC)c(OC)c2)c1C	810384368	ADGWRTUXZHLIKP-UHFFFAOYSA-N	433.392	1.338	50	20	IDGD	
Cc1nc2ccc(NC(=O)C(=O)NNC(=O)c3cc(C)n(-c4ccccc4)c3C)cn2n1	810384495	DUPLJKBFERDDKU-UHFFFAOYSA-N	431.456	1.845	50	20	IDGD	
N#Cc1cc(Oc2ccc(NC(=O)C(=O)NNC(=O)c3ccc4c(c3)OCO4)cc2)ccn1	810385586	UZKIFDZKBWECKO-UHFFFAOYSA-N	445.391	1.874	50	20	IDGD	
Nc1nc(Cl)cc(NNC(=O)CNS(=O)(=O)c2ccc(Cl)c(Cl)c2)n1	810956725	KSCICHQKFJJEOI-UHFFFAOYSA-N	425.685	1.441	50	20	IDGD	
C[C@H]1CN(C(=O)NNC(=O)[C@@H](C)Oc2cccc(Br)c2)C[C@@H](C)S1(=O)=O	811853253	RRKKYLWNVFTWRH-GRYCIOLGSA-N	448.339	1.465	50	20	IDGD	
CC(C)C(=O)Nc1nc(CC(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)cs1	812731721	RNZILGJCZOEGNW-UHFFFAOYSA-N	425.536	1.674	50	20	IDGD	
Cc1c(S(=O)(=O)NC(=O)/C(C#N)=C\c2cc(C)n(C[C@H]3CCCO3)c2C)cnn1C	813956542	OZMMJSZPWPLURH-ZTXRYZOMSA-N	431.518	1.738	50	20	IDGD	
CC1(C)CN(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)C[C@@H](C(F)(F)F)O1	814295829	HEELAUBZKLQJHB-ZDUSSCGKSA-N	430.431	1.476	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NN=C(C)Cn1cccn1)N(S(C)(=O)=O)CC2	814759230	WBLZKRBYRJULOD-QGZVFWFLSA-N	449.533	1.342	50	20	IDGD	
Cc1nc2c(c(C)nn2C)c(C)c1CC(=O)NNc1ccccc1S(=O)(=O)N(C)C	817052453	BTEGRLIWDXIMLB-UHFFFAOYSA-N	430.534	1.830	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)c1c[nH]nc1-c1ccc2c(c1)OCO2	817055202	QXHYOZLMGYCGNW-UHFFFAOYSA-N	429.458	1.813	50	20	IDGD	
O=C(CSc1nnc(N2CCOCC2)n1Cc1ccco1)NNC(=O)c1cccs1	827060398	VOTAYYKJXSFKDK-UHFFFAOYSA-N	448.530	1.371	50	20	IDGD	
COc1ccc2c(c1)C[C@@H](C(=O)NNC(=O)CCN1CCN(c3ccccc3)CC1)CO2	914774370	FGTLTNGSPMITQL-LJQANCHMSA-N	438.528	1.606	50	20	IDGD	
Cc1nn(-c2ccccc2)c2sc(C(=O)NNC(=O)CN3CCCS3(=O)=O)cc12	915874702	WKFYTTPXXIFFBB-UHFFFAOYSA-N	433.515	1.192	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCCSc2ccccc2)cc1	915925403	NDTMLXXUEQYPIM-UHFFFAOYSA-N	436.559	1.738	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NCc2cc(Br)ccc2F)c2ccccc2c1=O	916568639	VVVFDHIFXIEAFP-UHFFFAOYSA-N	448.252	1.979	50	20	IDGD	
CCS(=O)(=O)N(C)CCCNC(=O)NNC(=O)COc1ccccc1-c1ccccc1	916580427	YDMUPOFRDRBARW-UHFFFAOYSA-N	448.545	1.734	50	20	IDGD	
CCOc1ccc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)c3csnn3)cc2)cc1	917904714	YIRSISUKPBCRHR-UHFFFAOYSA-N	447.498	1.812	50	20	IDGD	
CCn1c(NNC(=O)Cc2c(C)[nH]c(-c3ccncc3)nc2=O)nc2ccccc2c1=O	918016581	JQNBBTNWCMBPJV-UHFFFAOYSA-N	431.456	1.556	50	20	IDGD	
C[C@@]1(NNC(=O)NCc2cccc(NC(=O)c3cccc(F)c3)c2)CCS(=O)(=O)C1	918106251	SRYBRABYXRSDGC-HXUWFJFHSA-N	434.493	1.959	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)NCCC(=O)NC2CCCCC2)c2ccccc2c1=O	918125934	YGRSHYXQLVOXQJ-UHFFFAOYSA-N	442.520	1.760	50	20	IDGD	
CC[C@H](NC(=O)NNC(=O)c1cc(OC)cc(OC)c1)c1ccccc1OCC(=O)NC	918221773	NTQWCKAJUZPFHF-SFHVURJKSA-N	444.488	1.924	50	20	IDGD	
O=C(NNC(=O)c1cn(Cc2ccccc2)c2ccccc12)N[C@@H]1CCS(=O)(=O)C1	919888941	IEYPAEYMEQMCPU-MRXNPFEDSA-N	426.498	1.821	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc2c(c(C(=O)O)c1)OCCO2)c1ccc2ccccc2n1	919955438	ZDMMDWZOQWVSNP-UHFFFAOYSA-N	429.410	1.328	50	20	IDGD	
CS(=O)(=O)NCCCOC(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccccc1	1116479228	OHMLPBNKXOWCSX-GHRIWEEISA-N	427.486	1.853	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NN=C2CCN(CCN3CCOCC3)CC2)CC1	1318905572	ZZBVVNLLZSPLKM-UHFFFAOYSA-N	437.585	1.534	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)NCCNC(=O)c1ccccc1C(F)(F)F	1319054573	ZUPHIBZKXSGRJH-UHFFFAOYSA-N	442.369	1.984	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)N[C@@H]1COc2c(F)cc(F)cc2C1	1356382894	SGISHKWRDFMXSH-LBPRGKRZSA-N	439.444	1.206	50	20	IDGD	
CCCCC[C@H](C)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1	1779033817	FGECGMVKWVPJDP-AOMKIAJQSA-N	431.537	1.345	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2c[nH]c3cnccc23)C1	1779181422	SCLCVJOCBCZZHL-HGHGUNKESA-N	434.924	1.944	50	20	IDGD	
COc1ccccc1OCC(=O)N1CCO[C@]2(CCN(C(=O)CO[Si](C)(C)C)C2)C1	1779294490	JSUVHVIDJUMDJX-NRFANRHFSA-N	436.581	1.755	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCBr)C2)c1cc[n+]([O-])cc1	1779943291	COPDXFPMQWRIFK-CRAIPNDOSA-N	426.311	1.233	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCC(=O)N1CCCC1)C2	1780700759	WGPMPPYBERRFLQ-CSODHUTKSA-N	427.973	1.920	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H]3CC[C@H]4CCC(=O)N4C3)C2)C1	1781059836	TUZQTZHYVFQEPA-XLPNERPQSA-N	442.354	1.001	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(CS(C)(=O)=O)nc3)CCO2)C1	1781219810	WHRWJGZLYHZLOH-QFBILLFUSA-N	443.953	1.087	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)c3cnc(OCF)cn3)CCO2)C1	1781228585	VGOBTKYKXVVAMB-IAGOWNOFSA-N	435.283	1.462	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1csnn1)C2	1781901573	QWMSIDMILXWZPV-NORZTCDRSA-N	431.356	1.839	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C2CCC(O)CC2)C1	1782330850	XRJUGHUCTHZTEQ-YMPMHWPESA-N	426.630	1.903	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)n2ccnc2C)C1	1782632400	VVKBHPAQZSDPOY-XNWPKKHHSA-N	426.945	1.520	50	20	IDGD	
C[C@@H](CC(=O)N1CC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1)c1ccccc1	1783287419	VNGDAEJELJJXKL-FDDCHVKYSA-N	430.549	1.383	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(-c4ccncc4)[nH]n3)CCO2)C1	1783539182	YOWQKEYJIHDJKF-DJJJIMSYSA-N	448.321	1.699	50	20	IDGD	
CCOC(=O)c1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]3C2)cc1	1784092094	GMAWETGDMQCGDW-XSLAGTTESA-N	438.908	1.056	50	20	IDGD	
O=C(CSc1ccncc1)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21	1785159153	AHMAFQGCLWQFIC-BPUTZDHNSA-N	442.379	1.938	50	20	IDGD	
COC(=O)c1ccc(OCC(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](F)Cl)CCO3)cc1	1785720478	YTEIOTUBSLIACQ-APWZRJJASA-N	428.844	1.216	50	20	IDGD	
C#CCO[C@H](C)C(=O)Nc1ccc(C2(NC(=O)c3cnccc3C(=O)NN)CCC2)cc1	1786359981	ZWZQPCJKQWDAQK-OAHLLOKOSA-N	435.484	1.471	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4cccn4cn3)C[C@@H]21	1786406761	BKVDCPLIVSKCKH-QRTARXTBSA-N	435.322	1.713	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(C)(C)NCCC#N)[C@H]2C1	1786859828	IRIRXBDBLFDWIE-VGWMRTNUSA-N	443.386	1.421	50	20	IDGD	
Cc1ncncc1C(=O)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1	1788142138	DONRMIZJXRPWQJ-UHFFFAOYSA-N	430.273	1.526	50	20	IDGD	
C[C@@H](Nc1ccccn1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21	1788781968	QGQUEOGVGBJIDL-XSEXMBABSA-N	443.317	1.552	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21)c1nc2cc([N+](=O)[O-])ccc2[nH]1	1790319948	INAQRMHSIRFWHO-YIVQXAGMSA-N	439.831	1.599	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)N(C)C(C)=O)C[C@@H]21	1790961849	RQDNADPLYQIUMS-WGIXJMRHSA-N	432.359	1.006	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3ncc[nH]3)C[C@@H]21	1790964222	UUABGDZFEKNTLE-AJNGGQMLSA-N	427.343	1.496	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](C)Br)[C@H]3C2)cn1	1791055129	KHRSPWBTPYUXGX-MXAVVETBSA-N	426.311	1.467	50	20	IDGD	
O=C(NC1(c2ccc(NC(=O)[C@@H]3[C@H]4C=CS[C@H]43)cc2)CCC1)c1ccc(B(O)O)cc1	1791087011	JMKRLGNCTAUHSV-VAMGGRTRSA-N	434.326	1.989	50	20	IDGD	
C[C@@H](C(=O)Nc1ccc(C2(NC(=O)c3cnccc3C(=O)NN)CCC2)cc1)n1cncn1	1791857499	CIUAISMOCFDUES-AWEZNQCLSA-N	448.487	1.286	50	20	IDGD	
O=C(/C=C/c1ccccc1[N+](=O)[O-])NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21	1792244952	CNJUONGNIYCQPB-HZJWCDLWSA-N	437.880	1.187	50	20	IDGD	
COc1ccccc1OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2	1792721140	GOCODRKOJZKKRL-CZAMWMTLSA-N	445.285	1.354	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ncc(F)cc1F)C2	1792868861	STWDEDGRNQQVLX-NJBDSQKTSA-N	432.265	1.594	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)Cn1ccnc1)C2	1792873325	SIVLDGAIAJXFEQ-NPJQDHAYSA-N	427.343	1.140	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1ccc(Cl)s1)c1cccc(B(O)O)c1	1794168032	WRUJASFTKYTARL-MUJYYYPQSA-N	432.738	1.576	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccnc1OCC1CC1	1794450299	LVUTWRZYWDJUMI-MVJTYMMSSA-N	437.924	1.327	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnccc1N(C)C	1794471545	VBVOKDVKDDQHFP-ZJOBFFGXSA-N	439.354	1.382	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccon1	1794928810	YHWBDRUYUVEMGT-ODLYAQKHSA-N	428.395	1.763	50	20	IDGD	
COc1ncc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Br)C3)cc1C	1794985611	NGHYGILJUFQWDT-XJFOESAGSA-N	430.274	1.292	50	20	IDGD	
Cc1cccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)c1Cl	1796192890	WCOVCFLISDFIQB-BCDXTJNWSA-N	426.709	1.894	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)Nc1nccs1	1796417566	LLRCYASEBMCKHC-RKQHYHRCSA-N	445.383	1.707	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cn(C)nc1C(F)F	1796700178	SJQLEKVVGNWLTM-HNCHTBHHSA-N	449.296	1.592	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cn1c(=O)n(C)c2ccccc21	1797171360	GFPYQDAJYUKWBU-UIVXKWKOSA-N	448.951	1.337	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1n[nH]c2ccc(F)cc12	1798143256	XSYYCNTVXBQDKY-QDMKHBRRSA-N	430.484	1.327	50	20	IDGD	
CO/C=C(\C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN(C)NC(=O)NCc1ccccc1)C2	1798304835	LINXIVZYBMFHCI-CNPWXLQSSA-N	443.548	1.521	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cncc2cnccc12	1798453544	GSFKSSAIHKVXHI-FRQROOTJSA-N	447.333	1.864	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1nn[nH]c1C(F)(F)F	1798712268	ZFIUUZPIFNOHOL-FJBRNLEUSA-N	444.241	1.263	50	20	IDGD	
C[C@@H](Nc1cnccn1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@](C)(Cl)CCl	1799275817	BYMHAYWNYYCDMO-XPNGNPLTSA-N	430.336	1.103	50	20	IDGD	
CCOc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@](C)(Cl)CCl)nn1	1799276389	DYKDMOQBXLQISE-TYYYEBLRSA-N	431.320	1.315	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccn2nccc12	1799973821	PMGXRZBTQCPBGI-AODNKKSCSA-N	425.316	1.774	50	20	IDGD	
COc1cccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)Br)c1C	1800762567	DJGZSVPUDLUERV-AMVTXUCVSA-N	439.350	1.919	50	20	IDGD	
C[C@@H](Cn1ccnc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)CBr)C2	1801369059	SJDZLKOTKZZSLD-GVRJEKJASA-N	427.343	1.140	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H]1C[C@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Cl)C3)C1	1802083738	HQNUUUNPIAZTTM-QAUDVVSPSA-N	433.908	1.414	50	20	IDGD	
Cc1nc2ncccn2c1C(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]1c1cccnc1	1803142466	DOEBJDXFNYFYSL-NUJGCVRESA-N	442.907	1.352	50	20	IDGD	
C[C@H](C(=O)N1CC[C@@H](CNC(=O)CCBr)[C@H]1c1cccnc1)n1cncn1	1806346151	ALRCTZKYEGASDP-UKPHBRMFSA-N	435.326	1.725	50	20	IDGD	
CN1N=C(C(=O)N2CCCC3(CCN(C(=O)[C@H](F)Br)CC3)C2)CCC1=O	1806623576	ZISVQXTVHYNLIF-AWEZNQCLSA-N	431.306	1.516	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2cc(C(=O)O)ncn2)[C@H]1c1cccnc1	1808249951	HPEBRXXLLXIXTE-KEYYUXOJSA-N	431.880	1.907	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)Cc2c(C)n[nH]c2C)[C@H]1c1cccnc1	1813033502	UDFROWYULQXKHB-QRFRQXIXSA-N	433.940	1.924	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H]2CCCCN2C)n[nH]1	1814889481	UHRJXIAWGSOHNO-DLBZAZTESA-N	433.557	1.259	50	20	IDGD	
O=C(C[C@@H]1CCCCO1)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1	1815336993	IQSGJIPPWJQIEC-HOTGVXAUSA-N	443.334	1.008	50	20	IDGD	
O=C([C@H](O)CCl)N1CCCC[C@@H]1c1cc(NC(=O)C(F)(F)C(F)(F)C(=O)O)n[nH]1	1815563310	KJKCYSFNCWNCOJ-RKDXNWHRSA-N	444.769	1.357	50	20	IDGD	
C=CCSCC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1815654527	UJEBXQRPOWLPTM-QGZVFWFLSA-N	428.323	1.315	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)C13CC(C1)C3)CC2	1819800851	BCQUNYGZRBAEOQ-MRRLMSGDSA-N	426.502	1.168	50	20	IDGD	
O=C(N[C@@H]1CCc2nc(NC(=O)c3ccoc3Cl)sc2C1)c1cccc(B(O)O)c1	1821809096	BJHOMDZQYCZIDO-GFCCVEGCSA-N	445.693	1.609	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1)C1CCC2(CC1)OCCO2	1821819609	RQNGPTSYZZWBIU-CVEARBPZSA-N	440.928	1.935	50	20	IDGD	
C=C(C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1)C(F)(F)F	1821993802	DCZBFOBNEYLUBX-ZDUSSCGKSA-N	430.431	1.893	50	20	IDGD	
C[C@@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1)C1(O)CCC1	1822412593	RRWUJTMBWMDPIN-GOEBONIOSA-N	434.541	1.326	50	20	IDGD	
O=C([C@@H](O)CCl)N1CCC([C@@H]2CCCCN2C(=O)Cn2nnc3ccccc32)CC1	1824849356	BXEDUKQZYFEZNG-HKUYNNGSSA-N	433.940	1.651	50	20	IDGD	
C[C@](O)(CC(=O)O)CC(=O)Nc1nc2c(s1)C[C@H](NC(=O)CO[Si](C)(C)C)CC2	1826073780	IXLLTVMBJMPTNZ-ADLMAVQZSA-N	443.598	1.522	50	20	IDGD	
Cc1ccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)nc1	1826074935	JNCOYZSAUXECCO-FQEVSTJZSA-N	429.565	1.996	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(O)ccc1F)CC2	1826088221	CDKGMWJWSZLUNK-NSHDSACASA-N	449.508	1.587	50	20	IDGD	
C[C@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)CSCC(=O)O)sc2C1	1826119369	WIDPJUDARZLYOG-YUMQZZPRSA-N	436.353	1.656	50	20	IDGD	
O=C(O)CSCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](F)Br)CC2	1826119599	APHYPXNSUBPNJU-KGFZYKRKSA-N	440.316	1.563	50	20	IDGD	
CC[C@H](C)[C@H](O)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827055801	JZGHQRMUIFQNEJ-DQLDELGASA-N	430.354	1.007	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H](COC)NC(C)=O)CC1	1829117353	GVZFCKCXKRRRPX-BZSNNMDCSA-N	431.961	1.011	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)C1(O)CCC1)CCO2	1829746824	TZIULRBJDAKCNU-MPGHIAIKSA-N	447.370	1.167	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc[nH]c4nccc3-4)C2)C1	1830357849	MNFPCIXBXFBWPK-OAQYLSRUSA-N	434.924	1.850	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C[C@H](N)c3cccnc3)C2)C1	1830358899	GIIILZIOJFGKRL-LAUBAEHRSA-N	438.956	1.193	50	20	IDGD	
Cc1cccc2[nH]c(C(=O)N3CCOC[C@]4(C3)CN(C(=O)[C@H](O)CCl)CCO4)cc12	1830731701	OMKKPSQCLUVXAY-NQIIRXRSSA-N	435.908	1.146	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CN(C)C(=O)C(=O)O)CC1	1831160320	GJWSTEWXYBAJME-HOTGVXAUSA-N	429.945	1.557	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CSC3CCCC3)CCO2)C1	1831365129	ZXBFUCXDTUHFDJ-VQIMIIECSA-N	434.986	1.372	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cn(C(C)(C)C)nn3)C2)C1	1831654376	KOCRQQQSHVCTSM-QRWLVFNGSA-N	441.960	1.511	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)COc3ccccc3C#N)C2)C1	1831658751	HNUZOFOEEUYXBM-XMSQKQJNSA-N	449.935	1.801	50	20	IDGD	
CC(C)c1cc(C(=O)N2CCC(N3CCC(NC(=O)[C@H](O)CCl)CC3)CC2)no1	1833309149	PZVKYLBPMFFDNN-QGZVFWFLSA-N	426.945	1.583	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cc4ncccc4[nH]3)CC2)CC1)[C@@H](O)CCl	1833312490	WFLRVPHOOWTGFR-IBGZPJMESA-N	433.940	1.348	50	20	IDGD	
CCc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)cn1	1833893940	SMIXMGBHGSTRTM-LIRRHRJNSA-N	440.338	1.497	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(C)on3)CCO2)C1	1834350489	AKXSBLLBNXIDPE-SUMWQHHRSA-N	430.299	1.227	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)CSC3CCCC3)C2)C1	1834819837	YOXPTSIGEQTDPZ-GOSISDBHSA-N	449.411	1.904	50	20	IDGD	
O=C(Cc1ccc(F)c(F)c1)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1835142392	GXQSODXAAKNLDC-GOSISDBHSA-N	437.270	1.767	50	20	IDGD	
CN1CCC[C@H]1C(=O)N1CCC(OC2CCN(C(=O)[C@H](F)Br)CC2)CC1	1837002300	AOJFVDBTHOTXGI-HOTGVXAUSA-N	434.350	1.770	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccn3nccc3c1)CCO2	1837160271	HZBOUJSWKZQTIK-OAQYLSRUSA-N	446.580	1.256	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)c(O)n1	1837715194	BUGCFBSITNSXTB-HXUWFJFHSA-N	437.569	1.017	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(C)nc3OC)CCO2)C1	1838176387	FMAHFMCNYBWVPX-UZLBHIALSA-N	425.913	1.486	50	20	IDGD	
Cc1nc(F)ccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)CCBr)C2)C1	1838262657	HFXDYJZCKAZYJL-GOSISDBHSA-N	444.301	1.384	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(C#N)cc3)CCO2)C1	1838953212	RQULWHCYKYWKBO-LIRRHRJNSA-N	436.306	1.412	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3c(F)ccc(O)c3F)C2)C1	1839146907	ABCOTTLFWNFVTK-HXPMCKFVSA-N	432.851	1.758	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(O)ccc3F)CCO2)C1	1839296057	GLNOIQXEAAGVPU-MOPGFXCFSA-N	449.306	1.838	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3sccc3F)C2)C1	1840030602	PXIBITZBHRGZTI-BZNIZROVSA-N	435.315	1.741	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cn3cnc4ccccc43)CCO2)C1	1840102807	WMLNUMRAHHEVMV-IIBYNOLFSA-N	434.924	1.510	50	20	IDGD	
CCc1cnc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](Cl)COC)CCO3)s1	1840153191	GZHAQKPEBYNTHW-KSSFIOAISA-N	431.942	1.029	50	20	IDGD	
C[C@@H](Oc1cccnc1)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1840454359	CWGMCOSFRHIEMW-ACJLOTCBSA-N	432.304	1.109	50	20	IDGD	
C[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1)c1ccccn1	1840503525	CSJKTRCUKREIQC-JOQOYGCGSA-N	444.301	1.332	50	20	IDGD	
CCc1nc2ccc(Cl)cn2c1C(=O)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1	1841351644	ZJQSLEIRDNISOF-CQSZACIVSA-N	425.316	1.967	50	20	IDGD	
CC(C)(C)c1cc(C(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)ccn1	1842176275	OOLXTKYQDBUZJM-UHFFFAOYSA-N	436.516	1.508	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC2(CCCN2C(=O)c2ccc(S(C)(=O)=O)cn2)C1	1842254240	RTDLPTHHKNTFQX-LBPRGKRZSA-N	444.351	1.333	50	20	IDGD	
CCOC(=O)c1ncn2c1CC[C@@H](C(=O)N1CCCC13CN(C(=O)[C@H](F)Cl)C3)C2	1845862474	ULUJWUZFPKSRJD-DOMZBBRYSA-N	426.876	1.360	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCCC12CN(C(=O)c1nc(OC)ccc1[N+](=O)[O-])C2	1846070430	JNGAVXUFCLKFCJ-LLVKDONJSA-N	441.282	1.989	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@]23C[C@@H]2CCN3C(=O)OC(C)(C)C)C1	1846192704	PEEHJEJUNUUJNW-GXZWQRSESA-N	441.956	1.843	50	20	IDGD	
COc1cc(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](O)CCl)nn1-c1ccccc1F	1847560489	UCXAIRWIKJLTSQ-ULQDDVLXSA-N	436.871	1.435	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)c1ccc2c(c1)C[C@@H](C)N2S(C)(=O)=O	14939578	KJKRDSAGQSMTMA-CHWSQXEVSA-N	435.477	1.765	50	20	IDGD	
COc1ccc(-c2n[nH]c(=S)n2CC(=O)NNC(=O)Cn2cnc3ccccc32)cc1	17405323	WWHCYRYNKNJGOZ-UHFFFAOYSA-N	437.485	1.814	50	20	IDGD	
C#CCNS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)c1	18103916	FLWMDDMJMKHZTA-INIZCTEOSA-N	429.498	1.443	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCCC(=O)NNC(=O)COc2ccc(C#N)cc2)cc1C	25259822	AXXHEOMYMQUVOH-UHFFFAOYSA-N	430.486	1.070	50	20	IDGD	
CON(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(Br)s2)c1	27319934	WDEOJZGVOYLUBU-UHFFFAOYSA-N	448.320	1.767	50	20	IDGD	
O=C(CCCNS(=O)(=O)c1ccc(F)cc1)NNC(=O)c1cc(Br)c[nH]1	28717672	YZLDIUKHQKBRHJ-UHFFFAOYSA-N	447.286	1.436	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)CCc1nc2c(cnn2C)c(=O)[nH]1	29513699	QQJVUBXTVGJFRU-CYBMUJFWSA-N	434.456	1.357	50	20	IDGD	
CCC[C@](C)(NC(=O)OC(C)(C)C)C(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	727723501	ZPFWLXHZVQIIFR-NRFANRHFSA-N	431.493	1.778	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(Br)cc1[N+](=O)[O-])c1cccc([N+](=O)[O-])c1	728501679	PRCIXJUETLGJOP-UHFFFAOYSA-N	445.207	1.889	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)[C@H]2CS[C@]3(C)CCC(=O)N23)c1	728529876	RNWTYVLLPCFGGQ-MLGOLLRUSA-N	428.308	1.673	50	20	IDGD	
Cn1c(=NNC(=O)NCc2cccnc2N2CCC(C(N)=O)CC2)sc2ccccc21	729231132	VNLZOIWPQSFKBA-UHFFFAOYSA-N	439.545	1.652	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2cccnc2)nc2c1cnn2Cc1ccco1)c1cnn[nH]1	729541297	KJVXGTKVLHVEPJ-UHFFFAOYSA-N	429.400	1.328	50	20	IDGD	
CCN(CCNC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)C(=O)OC(C)(C)C	729617416	NYLONRQQWMUHQR-UHFFFAOYSA-N	432.481	1.135	50	20	IDGD	
C[C@@H]1CC(C)(C)C[C@]2(C1)NC(=O)N(CC(=O)NNC(=O)CCc1ccccc1O)C2=O	730033963	HHEWWKUJHDIZEM-PEBXRYMYSA-N	430.505	1.609	50	20	IDGD	
NC(=O)c1ccc(/C=C/C(=O)N2CCC[C@H]2C(=O)NN=c2cc[nH]c3ccccc23)cc1	730288699	WXKSDXIVUBYXJT-ZRFOIIEFSA-N	429.480	1.903	50	20	IDGD	
CC(=O)Nc1ccc(NS(C)(=O)=O)c(C(=O)NNC(=O)COc2cc(C)cc(C)c2)c1	731435264	ZERKLLIHERSPQM-UHFFFAOYSA-N	448.501	1.473	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)N1CCC(NS(=O)(=O)c2ccc(F)cc2)CC1	731849056	RCGOSFFZBJPFEX-AWEZNQCLSA-N	428.530	1.150	50	20	IDGD	
CCc1cc(N2CCC[C@@H](NC(=O)NNC(=O)[C@@H](C)Oc3ccccc3F)C2)ncn1	732914588	UIXMOBPXKORZFD-GDBMZVCRSA-N	430.484	1.945	50	20	IDGD	
O=C(NCCCCN1C(=O)c2ccccc2C1=O)NNC(=O)c1cnn(-c2ccccc2)c1	733348922	VAEDZJSEVVGVAE-UHFFFAOYSA-N	446.467	1.893	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)N[C@H]2CCN(C3CCN(C)CC3)C2)cc1OC	734281148	BPWJPJVRJDSTIB-KRWDZBQOSA-N	433.553	1.597	50	20	IDGD	
O=C(NCc1nc(-c2ccc(Cl)cc2)no1)NNC(=O)c1ccc(-n2cnnn2)cc1	734515995	CDTACWZHOSISEL-UHFFFAOYSA-N	439.823	1.510	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNS(=O)(=O)c2ccc(F)cc2F)CC1	734806924	AWBKWASRMMGHMB-UHFFFAOYSA-N	434.465	1.857	50	20	IDGD	
COc1ccccc1CCC(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	735117465	ULENVLOFZDKTAX-UHFFFAOYSA-N	433.534	1.102	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2ccc(C)c(NC(C)=O)c2)cc(OC)c1OC	736064717	YSYIHEMKSRXOAU-UHFFFAOYSA-N	437.474	1.603	50	20	IDGD	
Cc1ccc(Nc2cccc(C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)c2)nn1	736074816	IJEYCCNZAIXTLX-UHFFFAOYSA-N	432.488	1.996	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)c2cn(-c3cccc(C(F)(F)F)c3)nn2)cc1	739678891	MSJPKXRHCBXYSW-UHFFFAOYSA-N	430.346	1.998	50	20	IDGD	
CCNS(=O)(=O)c1ccc2c(c1)N(CC(=O)NNC(=O)c1cccc(Cl)c1)CC2	741806398	XMGGNOZDSUJWEX-UHFFFAOYSA-N	436.921	1.462	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)N[C@H](C)CN2CCN(c3ccccc3)CC2)cc1	745838890	NISKOBCBPBASLB-GOSISDBHSA-N	441.532	1.615	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCCc2ccn(-c3ccc(F)cc3)n2)c1	745891893	HWYXZCGVCYPMNL-UHFFFAOYSA-N	445.476	1.602	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)N[C@@H]2C[C@@H](C)N(c3cnn(C)c3)C2=O)c1C	745917070	HINSZLDEUPNDES-FRFSOERESA-N	428.493	1.329	50	20	IDGD	
COc1cc(C)nc(NNC(=O)[C@H](C)N2C(=O)c3ccc(Br)cc3C2=O)n1	746634413	DHAGFOIIQLIEMT-VIFPVBQESA-N	434.250	1.684	50	20	IDGD	
CCN(CC(C)(C)O)C(=O)/C(C#N)=C\c1cn(CCC(N)=O)nc1-c1ccc(OC)cc1	747417395	RSNJJIKLVUITPJ-ATVHPVEESA-N	439.516	1.960	50	20	IDGD	
CC(=NNC(=O)Cc1cn2ccccc2n1)c1ccc(S(=O)(=O)N2CCNCC2)cc1	747636652	NJBZXTSQUQJZEE-UHFFFAOYSA-N	440.529	1.011	50	20	IDGD	
CC(C)c1nc(C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)nn1-c1ccccc1Cl	748171202	CFDJYSYDTVLNFH-LLVKDONJSA-N	425.898	1.240	50	20	IDGD	
CN(C)[C@@H]1CCC[C@H](NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)C1	749591699	QZNUAFHWJOCIRS-DLBZAZTESA-N	437.566	1.288	50	20	IDGD	
O=C(CCOc1ccccc1)NNC(=O)[C@@H]1CCCN1C(=O)c1ccc2c(c1)OCO2	749598505	CAAGMOZEJSOZBM-KRWDZBQOSA-N	425.441	1.636	50	20	IDGD	
C[C@H]1Oc2ccccc2N(CC(=O)NNc2nc(Br)cn3ccnc23)C1=O	750247310	ACXVUFVOONOMJK-SNVBAGLBSA-N	431.250	1.749	50	20	IDGD	
CC(C)(C)OC(=O)NCCCn1ccc2cc(C(=O)NNC(=O)c3cnn[nH]3)ccc21	751375303	BVJLOQUPCDJQSE-UHFFFAOYSA-N	427.465	1.749	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@@H](C)c2ccc(F)cc2F)cc1	753045928	BJLONKFQUQFWMR-ZDUSSCGKSA-N	440.472	1.985	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)N[C@H]2CCCN(Cc3ccccn3)C2=O)c1	753298313	LTMIQCLYONHHDM-IBGZPJMESA-N	425.489	1.599	50	20	IDGD	
Cc1oc(S(=O)(=O)N(C)C)cc1C(=O)OCC(=O)NNC(=O)c1cccc(Cl)c1	753519046	QNXYTHJBWJPXAA-UHFFFAOYSA-N	443.865	1.110	50	20	IDGD	
Cc1cc(Cl)ccc1OCC(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	754156859	WLSVRYNKDAATLT-QGZVFWFLSA-N	434.832	1.558	50	20	IDGD	
CN(C)c1cc(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)c2ccccc2n1	754847373	WIALTRLLHWCBGF-UHFFFAOYSA-N	447.904	1.676	50	20	IDGD	
O=C(Cn1nnc(-c2ccccc2)n1)NN=Cc1cn(-c2ccc(F)cc2Cl)nn1	755491601	RTIHSMNDCQFKRJ-UHFFFAOYSA-N	425.815	1.864	50	20	IDGD	
CN(C1CC1)S(=O)(=O)c1ccc(NC(=O)NNC(=O)COc2ccccc2F)cc1	756405008	WYVBUEXSCWZMOC-UHFFFAOYSA-N	436.465	1.840	50	20	IDGD	
CCn1cc(S(=O)(=O)NNC(=O)[C@H](C)Oc2ccc3ccccc3c2)c([N+](=O)[O-])n1	756929947	NOLJFPVQRBYVRE-LBPRGKRZSA-N	433.446	1.741	50	20	IDGD	
Cc1nc(COc2cccc(C(=O)NNC(=O)c3csc(N4CCOCC4)n3)c2)no1	758078826	BOIWJZFCNOOXMR-UHFFFAOYSA-N	444.473	1.325	50	20	IDGD	
O=C(c1cc2cccc([N+](=O)[O-])c2[nH]1)N1CCN(S(=O)(=O)CBr)CC1	758517241	IGNGRZWZXUBFLI-UHFFFAOYSA-N	431.268	1.516	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(-n3ccnn3)cc2)c1	760245642	BDEHBYWIVKTDGI-UHFFFAOYSA-N	442.501	1.373	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3n2)c(OCC(=O)N(C)C)c1	763453998	DZAOQCNAIAQFHN-UHFFFAOYSA-N	449.467	1.410	50	20	IDGD	
O=C(NNC(=O)c1ccccn1)C(=O)Nc1cc(Br)ccc1N1CCCC1	763467541	QAWGHAMOORLDCG-UHFFFAOYSA-N	432.278	1.844	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)NC1CCN(C[C@H]2CCOC2)CC1	763513931	UINMSIQGFQSRMM-OAHLLOKOSA-N	427.546	1.123	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cc3ccccc3cc2O)ccc1-n1cnnn1	763518204	QQFQGKPYZFRORW-UHFFFAOYSA-N	431.412	1.229	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(C(C)=O)c(Cl)c2)cc(OC)c1OC	763539034	ICULEYJKUFPDNE-UHFFFAOYSA-N	449.847	1.968	50	20	IDGD	
CCOC(=O)c1cn(C)nc1NC(=O)C(=O)NNC(=O)c1sc2ccccc2c1Cl	763579559	YFWLLKIXLMZMJI-UHFFFAOYSA-N	449.876	1.865	50	20	IDGD	
CCOC(=O)N(C)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)cc1	763674046	KIIRMZZILXHAOW-UHFFFAOYSA-N	439.428	1.316	50	20	IDGD	
CCOC(=O)c1cc(CC)sc1NC(=O)C(=O)NNC(=O)COc1ccc(F)cc1	763839252	HQMUMWNWBKXLIB-UHFFFAOYSA-N	437.449	1.791	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2nc(C(C)(C)C)ns2)cc1	763861194	MPKIEIOAYTWDRK-LLVKDONJSA-N	435.506	1.788	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccnn2Cc2ccccc2)cc1OC	763901966	LLEJGGXYTKXGDE-UHFFFAOYSA-N	437.456	1.738	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(NC(=O)OC)cc2)cc1OC	763904442	ZCSREVSJUKHSBB-UHFFFAOYSA-N	430.417	1.672	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cnc3c(c2)c(C)nn3C)cc1OC	763911078	COCPMLXZZLGSOO-UHFFFAOYSA-N	440.460	1.474	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3cccc(CS(C)(=O)=O)c3)cc2C1	763938282	CYSSYNCEMGFDHN-LBPRGKRZSA-N	449.554	1.817	50	20	IDGD	
COC(=O)[C@H](C)Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)cc1	763974149	LVNOMCROVGUCGZ-LLVKDONJSA-N	433.848	1.797	50	20	IDGD	
CCNC(=O)COc1cccc(NC(=O)C(=O)NNC(=O)c2cccc3ccccc23)c1	764050224	DDSGDRRFZBWYKR-UHFFFAOYSA-N	434.452	1.754	50	20	IDGD	
COc1ccc(C(=O)N2CCCCCC2)cc1NC(=O)C(=O)NNC(=O)CC(F)(F)F	764115166	OQRBLANGDUABDC-UHFFFAOYSA-N	444.410	1.750	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(Br)c(F)c2)c1O	764130235	FFBUJKMSTSMTBE-UHFFFAOYSA-N	426.198	1.702	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccc(OC2CCOCC2)c(C)c1	764135202	CANOZXACHUNJBH-UHFFFAOYSA-N	441.484	1.890	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2O1)C(=O)Nc1ccc2oc(C(F)(F)F)nc2c1	764152625	FHQJISIIARJHLG-AWEZNQCLSA-N	434.330	1.936	50	20	IDGD	
Cn1ccnc1Sc1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)cc1	764153639	MZIVAOURJBWXKT-KRWDZBQOSA-N	437.481	1.661	50	20	IDGD	
CCOCCOCc1cccc(NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)c1C	764166308	AXZWTAVFXAQYHM-HXUWFJFHSA-N	441.484	1.638	50	20	IDGD	
Cc1ncc(NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3CN2Cc2ccccc2)cn1	764180224	ZMSJELKBOPPOKE-OAQYLSRUSA-N	444.495	1.498	50	20	IDGD	
NS(=O)(=O)c1cc(F)cc(NC(=O)C(=O)NNC(=O)c2c(Cl)cccc2Cl)c1	764221738	XSQNYKBBIZBPMG-UHFFFAOYSA-N	449.247	1.180	50	20	IDGD	
CC(=NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1)c1sc(C)nc1C	764815516	DGPMCXZXGMWHDW-UHFFFAOYSA-N	449.602	1.915	50	20	IDGD	
COc1cc(C=NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)cc([N+](=O)[O-])c1O	764826590	HCIXQCXPLFXAHC-UHFFFAOYSA-N	441.488	1.885	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNS(=O)(=O)c3cc(F)cc(F)c3)CC2)cc1	765124589	BUOPUCUJIMELPU-UHFFFAOYSA-N	438.500	1.401	50	20	IDGD	
CS(=O)(=O)NCCc1ccc(C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)cc1	765616154	MIUSZMGQLDDSQD-UHFFFAOYSA-N	445.476	1.382	50	20	IDGD	
O=C(COCCc1ccccc1)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	765759857	XVXLMDYRKSCAEN-UHFFFAOYSA-N	444.963	1.864	50	20	IDGD	
CC(C)(C)OC(=O)NCc1cc(C(=O)NNC(=O)c2ccc3c(c2)OCCO3)ccn1	766135723	RPDHHJWHPCFANM-UHFFFAOYSA-N	428.445	1.952	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)cc1C1CC1	766660587	NTMYHKKJMMHTOJ-UHFFFAOYSA-N	430.940	1.530	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)c3ccc(N4NC(=O)CCC4=O)cc3)n[nH]2)c1	768270096	VTVMYPIJRGXZGS-UHFFFAOYSA-N	446.467	1.926	50	20	IDGD	
CC(C)[C@H](NC(=O)OC(C)(C)C)C(=O)NCC(=O)NNC(=O)c1cc2ccccc2o1	768423502	FZCFRDYNENZMEB-KRWDZBQOSA-N	432.477	1.859	50	20	IDGD	
C[C@@H](O)CNC(=O)/C(C#N)=C\c1cn(CCC(N)=O)nc1-c1cccc(Br)c1	769106871	PRZVHJADNUIIQH-AISSWFOISA-N	446.305	1.592	50	20	IDGD	
COc1ccc(C(=O)NNC(=S)NCCSC)nc1I	770239072	FJFSWNJGRPEZHB-UHFFFAOYSA-N	426.305	1.167	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2ccnn2-c2cccc(F)c2)c1	770774495	NXDBNHDQSLWANL-UHFFFAOYSA-N	427.392	1.428	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)[C@H](O)Cc2ccccc2Cl)CC1	773036131	RWXWNYCXFSYTCX-MRXNPFEDSA-N	440.928	1.973	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1)c1cn(C)c2ccccc12	773390108	JMFKSLFCYAVVDQ-GOSISDBHSA-N	447.539	1.887	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)CNC(=O)c2ccc(C#N)cc2)C1	773410573	DHAYFWRROPDHFF-INIZCTEOSA-N	429.477	1.083	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)F)cc1)C(=O)Nc1ccc(Br)cn1	773491758	YUGVSYZDINWFGE-UHFFFAOYSA-N	449.233	1.922	50	20	IDGD	
COc1cc(SC)ccc1NC(=O)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	773546217	JYYAXJKCBXLBCA-UHFFFAOYSA-N	444.517	1.210	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)NCc1ccc(S(N)(=O)=O)cc1C	775211728	IZRKPKAKONKTKV-UHFFFAOYSA-N	426.882	1.449	50	20	IDGD	
COc1ccc(O)c(S(=O)(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)c1	775675327	BCVHRBVOORFLIF-UHFFFAOYSA-N	444.510	1.293	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)[C@@H](C)N2CCN(c3ccc(F)cc3)CC2)nc1C	778430311	RMQGOXCCQQTEHY-OAHLLOKOSA-N	430.484	1.755	50	20	IDGD	
COc1ccc(-c2nn(CCC#N)cc2/C=C(\C#N)C(=O)OCc2nc(O)n[nH]2)cc1OC	781864470	MRGLZGXQOHHFRG-RIYZIHGNSA-N	449.427	1.955	50	20	IDGD	
COc1ccc(-c2nn(CCC#N)cc2/C=C(/C#N)C(=O)OCc2nc(O)n[nH]2)cc1OC	781864481	MRGLZGXQOHHFRG-ZSOIEALJSA-N	449.427	1.955	50	20	IDGD	
COc1ccc(C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)cc1-n1cnnn1	782020062	ZDTAAHMIHXASKS-UHFFFAOYSA-N	429.387	1.598	50	20	IDGD	
CSCc1ccc(NC(=O)C(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1	782897680	SDTXPMWLEMMKFN-UHFFFAOYSA-N	435.531	1.242	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2ccc(S(=O)(=O)N3CCC[C@@H](C)C3)cc2)nc(C)n1	783326382	DDFHZNXMSUMYNU-CYBMUJFWSA-N	446.533	1.596	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNS(=O)(=O)c2ccc(OCC(F)F)cc2)cc1C	783807403	RUHDHRSFDADHCE-UHFFFAOYSA-N	427.429	1.896	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ccc(Br)nc2)cc1-n1nnnc1C	784810031	WTHDVUCYVDBMQB-UHFFFAOYSA-N	447.253	1.219	50	20	IDGD	
O=C1CN(c2ccc(NC(=O)C(=O)NNc3cc(F)c(F)cc3F)cc2Cl)CCN1	784886921	WOKYRLPLFKYLTE-UHFFFAOYSA-N	441.797	1.775	50	20	IDGD	
C[C@@H](c1ccc(NC(=O)C(=O)NNc2ccc(C(F)(F)F)nn2)cc1)N1CCOCC1	784891034	BAOCCZIHTHAFFG-LBPRGKRZSA-N	438.410	1.970	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)c3nnn(Cc4noc(C)n4)c3C)n[nH]2)cc1	785182402	NDTGRLWZVOGASF-UHFFFAOYSA-N	435.448	1.354	50	20	IDGD	
Cc1cn(-c2c(F)cccc2F)nc1C(=O)NNC(=O)c1csc(N2CCOCC2)n1	786688715	RMHUHZVAFDTERB-UHFFFAOYSA-N	448.455	1.827	50	20	IDGD	
CCS(=O)(=O)CCn1cc(C)c(NC(=O)NNC(=O)c2ccc(O)c(Cl)c2)n1	786739442	LXSPOCBOOHKBQO-UHFFFAOYSA-N	429.886	1.452	50	20	IDGD	
COC[C@@H](NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)c1ccc(Cl)cc1	787375300	WLDLSJLDVDICHY-MRXNPFEDSA-N	429.864	1.919	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(Cl)s1)NNC(=O)NCc1ccc(Cl)cc1	787427430	XZFOIFAZRYCULB-UHFFFAOYSA-N	437.330	1.864	50	20	IDGD	
C[C@@]12CCN(C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)C[C@@H]1C2(Cl)Cl	790708968	MDFZDDZIODRVIQ-SUMWQHHRSA-N	427.336	1.950	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc3c2OCC[C@H]3OC)cc1OC	790951924	MRTHUJMMWRTEPU-MRXNPFEDSA-N	443.456	1.964	50	20	IDGD	
Cc1cccnc1NNC(=O)CCC(=O)N1CCN(S(=O)(=O)c2ccccc2)CC1	791214873	HBNASCRXAWPTQO-UHFFFAOYSA-N	431.518	1.146	50	20	IDGD	
CCS(=O)(=O)N1CCC(C(=O)NNC(=O)c2cccc(C)n2)(c2ccccc2)CC1	794080253	IXVBEQYODPUHLU-UHFFFAOYSA-N	430.530	1.535	50	20	IDGD	
COc1cc(Br)c(S(=O)(=O)NNC(=O)c2cccc(C)n2)cc1C(=O)O	794600340	ACXFOOQGQUYWMB-UHFFFAOYSA-N	444.263	1.483	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N[C@@H]2CCCN(C(=O)Cc3ccccc3)C2)cc1OC	800987206	SKYAHKYIQDKXNO-GOSISDBHSA-N	440.500	1.882	50	20	IDGD	
O=C(COC(=O)c1cc(O)ccc1C(F)(F)F)NNC(=O)[C@H]1COc2ccccc2O1	803527518	QZHKLGVOGOJXLG-OAHLLOKOSA-N	440.330	1.555	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)[C@H](C)n2ccc3ccccc3c2=O)n1	805628942	LPNJRVPHWQCGHO-ZDUSSCGKSA-N	428.470	1.261	50	20	IDGD	
CCOC(=O)C(=O)c1cc(S(=O)(=O)NNC(=O)c2ccc(Cl)cc2Cl)cn1C	808069802	AONANKPVJBBSPX-UHFFFAOYSA-N	448.284	1.701	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)c1c(O)cnc2c(Br)cccc12	810309325	SWBQULYQBAXXDP-UHFFFAOYSA-N	449.286	1.955	50	20	IDGD	
N#Cc1ncn(-c2ccccc2NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)on2)n1	810385238	YSRSITFQYQSXBB-UHFFFAOYSA-N	442.395	1.194	50	20	IDGD	
COC(=O)Cc1cc(Br)ccc1S(=O)(=O)NNC(=O)c1ccccc1O	811675668	KMTTYDFIOCYYCO-UHFFFAOYSA-N	443.275	1.494	50	20	IDGD	
COc1ccc(CNC(=O)NNC(=O)Cc2cccc3ccccc23)cc1S(N)(=O)=O	812431307	FLLFZNASBZUPPP-UHFFFAOYSA-N	442.497	1.569	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NC/C=C/CNC(=O)OC(C)(C)C)c2ccccc2c1=O	812464845	CCXHDKZFVCHNJW-CMDGGOBGSA-N	444.492	1.441	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NC/C=C\CNC(=O)OC(C)(C)C)c2ccccc2c1=O	812464846	CCXHDKZFVCHNJW-HJWRWDBZSA-N	444.492	1.441	50	20	IDGD	
Cc1cnc(Br)c(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)c1	812979414	SBFPIAQEUQKWKG-UHFFFAOYSA-N	445.071	1.643	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cccc1-c1ncco1	815567218	RMUMJQVELMOPDZ-UHFFFAOYSA-N	446.423	1.941	50	20	IDGD	
COC(=O)c1ccc(C(=O)NNC(=O)c2cc(-c3ccc(OC)c(OC)c3)[nH]n2)n1C	815886716	GFHIHRWJTGXKIJ-UHFFFAOYSA-N	427.417	1.294	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)c2cnn(C)c2I)nc1C	815980223	DXLURQTZCCYPEB-UHFFFAOYSA-N	430.206	1.057	50	20	IDGD	
Cc1c(/C=C(\C#N)C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)cc(C#N)n1C	823933466	UBEYTPUBXNMDFV-CXUHLZMHSA-N	443.467	1.864	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2Sc2nnnn2C)c1	904222294	REDIEAGCNRNONZ-UHFFFAOYSA-N	442.461	1.410	50	20	IDGD	
Cc1ccc(NC(=O)CS[C@@H](C)C(=O)NNC(=O)CCN2C[C@H](C)O[C@H](C)C2)cc1	912920147	WCVMZUDXSMTXMS-BBWFWOEESA-N	436.578	1.702	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)CNS(=O)(=O)c1ccccc1F	913037050	ZWDCXWOYXBMHFZ-UHFFFAOYSA-N	448.501	1.997	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)Cc2c(C)nn(-c3nc(C)cc(C)n3)c2C)cc1	914465371	WQONDWQKIZGGJP-UHFFFAOYSA-N	437.504	1.707	50	20	IDGD	
Cc1nc2c(C#N)cnn2c(C)c1CCC(=O)NNC(=O)Cc1nc2ccccc2n1C	914781372	AZWXMBAHIRENLG-UHFFFAOYSA-N	430.472	1.427	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CNS(=O)(=O)c2cccs2)ccc1OC(C)C	915189043	XDRXDFNIRSYPOA-UHFFFAOYSA-N	427.504	1.283	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)CCOC[C@H]2CCCO2)c1	915615896	FDUBALONNAGVFM-MRXNPFEDSA-N	427.523	1.064	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NC[C@H]2CN(CC(C)C)CCO2)nc1	915922750	BLGVWZRRYWZDJU-INIZCTEOSA-N	442.586	1.095	50	20	IDGD	
O=C(NNC(=S)NCc1cccs1)c1cccc(S(=O)(=O)N2CCOCC2)c1	916116068	SXSODXULTBRQPK-UHFFFAOYSA-N	440.572	1.078	50	20	IDGD	
COc1ccc(C(=O)NN=Cc2c(C)nn([C@H]3CCS(=O)(=O)C3)c2Cl)cc1OC	916289131	ZZXHYVNUJIPRNC-ZDUSSCGKSA-N	440.909	1.986	50	20	IDGD	
CCCS(=O)(=O)N1CCC(NC(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)CC1	916383531	KZFYUNBQYXIWKN-CYBMUJFWSA-N	430.502	1.128	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)NCc2ccc(OCC(F)(F)F)nc2)nc2ccccc21	916398842	QOEFFDNGGOVULI-UHFFFAOYSA-N	436.394	1.983	50	20	IDGD	
O=C(NCC1(N2CCSCC2)CCCC1)NNC(=O)c1nn(-c2ccccc2)cc1O	916616199	CSUDTKFWSKDTIY-UHFFFAOYSA-N	444.561	1.884	50	20	IDGD	
CCCCn1c(C)cc(/C=C(/C#N)C(=O)NS(=O)(=O)c2cc(C(N)=O)n(C)c2)c1C	916788018	DACPLSSGUSFANM-SXGWCWSVSA-N	431.518	1.755	50	20	IDGD	
O=C(COC(=O)c1cc2cc([N+](=O)[O-])ccc2[nH]1)NNC(=O)[C@@H]1COc2ccccc2O1	917329845	ZNXUZVZZKJKKMB-KRWDZBQOSA-N	440.368	1.220	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@@H](C)COc2ccccc2)cc1	918087588	HUFPGIUGUGPSGK-INIZCTEOSA-N	434.518	1.413	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)N1CCCCC1	918119456	BPDSPRDRKBWAIL-INIZCTEOSA-N	437.566	1.290	50	20	IDGD	
Cc1cnn(CCC(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)c1	918299197	SGLDGCABSIXBQH-UHFFFAOYSA-N	433.515	1.905	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)c2ccc3c(c2)S(=O)(=O)N(C2CC2)C3=O)c1	918541128	IHMITFFLANHBRM-UHFFFAOYSA-N	443.481	1.450	50	20	IDGD	
CNC(=O)NNC(=O)CN(CCc1ccccc1)S(=O)(=O)c1c(C)cc(C)cc1C	919879428	CWGJCSXKIDAPBH-UHFFFAOYSA-N	432.546	1.805	50	20	IDGD	
CCN(CC)CC(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccc(OC)cc2)c1	920431858	SYJNSKAKBTZLSC-UHFFFAOYSA-N	434.518	1.599	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NN=C(C)c1cnn(C)c1)N(S(C)(=O)=O)CC2	920828202	WIXZHYCIWAVRBX-QGZVFWFLSA-N	449.533	1.227	50	20	IDGD	
Cc1nn([C@H]2CCS(=O)(=O)C2)c(Cl)c1C=NNC(=O)CNC(=O)c1cccs1	1115934336	UCQSDRAGBYMRGS-NSHDSACASA-N	443.938	1.146	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)NCCc2cn3ccccc3n2)CC1	1116084070	OGNIMUWLZMYUAP-UHFFFAOYSA-N	430.509	1.854	50	20	IDGD	
CNS(=O)(=O)c1ccc(CC(=O)NNC(=O)Cc2nc(-c3ccccc3)cs2)cc1	1320173788	NQEIVQLFGIOQKC-UHFFFAOYSA-N	444.538	1.651	50	20	IDGD	
CCCNC(=O)[C@H](C)NC(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1	1341770821	YLJMYVSOJLQJHK-LAUBAEHRSA-N	437.544	1.859	50	20	IDGD	
Cc1nc2sccn2c1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1778718773	DBCPIMKHGVDCBL-LRDDRELGSA-N	445.314	1.838	50	20	IDGD	
C[C@H](C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2)n1ccccc1=O	1779266539	AEMVAYFKMGWVTA-MDASCCDHSA-N	430.332	1.476	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@]2(C1)CN(C(=O)c1ccc(OC(F)F)cn1)CCO2	1779296262	MFAREUPZMKYICA-IBGZPJMESA-N	443.523	1.978	50	20	IDGD	
CC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1	1780096675	DITYYVRKXYERBD-NRFANRHFSA-N	447.444	1.333	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)CCN3Cc4ccccc4C3=O)CCO2)C1	1781220259	ZXXVBEKQSHTEBP-XMSQKQJNSA-N	433.936	1.880	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](F)Br)C3)C2)o1	1781330998	CJWWOEDPMAKBKX-BBRMVZONSA-N	432.246	1.372	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)n2ccnn2)C1	1781551726	CUFNCLBQUUZGGI-OIPACUDHSA-N	442.358	1.527	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CSC(=N)N)C2	1781900796	SNCDTQCRIPJHMC-XHBSWPGZSA-N	435.388	1.300	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1nc3ccccn3n1)C2	1782170266	FHFYNYVKUNXZAK-STXHMFSFSA-N	435.912	1.111	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)Cn1cccn1)C2	1782170863	CPMWYPQZSOVLDG-AXVVYFOYSA-N	426.945	1.287	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3nsnc3NC)CCO2)C1	1783339273	QRKXVSKTRUSQAT-ZUZCIYMTSA-N	432.344	1.197	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](O)Cc3ccccc3)C2)C1	1783342053	ZVBWCBGYQVYZBA-UXPWSPDFSA-N	429.344	1.656	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)[C@@H](F)Br)CCO2)C1	1783351549	BTBWSPPOUUJCNR-OPQQBVKSSA-N	430.112	1.680	50	20	IDGD	
O=C(Cc1ccc2c(c1)CCO2)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1783423402	ZSRRNZYEVRNSKX-IEBWSBKVSA-N	441.297	1.684	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cnc(-c4ccccn4)nc3)CCO2)C1	1783873176	LWSFRTUBHZNKHE-IERDGZPVSA-N	445.907	1.236	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1ccc(C3CC3)cc1)CCO2	1783934943	ODSVTVUBPZBQSW-QHCPKHFHSA-N	428.533	1.381	50	20	IDGD	
COc1cc(C)c(C(=O)N2CCO[C@@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)c(C)c1	1783935713	XTLKKKZVJQGTPI-HSZRJFAPSA-N	446.548	1.129	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(=O)c3cccn3C)C[C@@H]21	1783973809	DERJUFJEFZJEGW-HOSILWTGSA-N	440.338	1.219	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc(OCF)cn3)C[C@@H]21	1784615888	CKLZXOPUFSGUEB-AYDFFVQHSA-N	428.892	1.783	50	20	IDGD	
COc1ncccc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)Br)C[C@@H]21	1786013446	WQKUNBKJQIZOAA-JURCDPSOSA-N	426.311	1.467	50	20	IDGD	
Cn1cc(CCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]32)cn1	1787012364	UMIBQEXPUBJBMV-FPXQBCRKSA-N	431.364	1.569	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccs3)C[C@@H]21	1787508643	FBLIBDLHEGPDFM-GLYSVQQSSA-N	443.529	1.475	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21)c1cc(-n2ccnc2)ccn1	1789375873	CZUMJORDAPKODQ-NOLJZWGESA-N	438.315	1.664	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)c3ccccc3)C[C@@H]21	1789866899	ZPHPCOCXPAYXNY-DRCYAFTPSA-N	429.344	1.936	50	20	IDGD	
CCc1[nH]nc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]3C2)c1F	1789868734	KTLBBVNECAGESY-WVPLEHFKSA-N	435.327	1.941	50	20	IDGD	
Cn1cc(CCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]3C2)cn1	1789922328	IFTKNJWOGCYBJL-YXWQFLTLSA-N	431.306	1.023	50	20	IDGD	
CCn1nc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]3C2)cc1C	1789924448	DNZXBHHBGFDUAF-JURCDPSOSA-N	431.306	1.495	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnn4cccc(F)c34)[C@H]2C1	1790521442	ZXRRHFSWMGKWJC-ZVZYQTTQSA-N	448.571	1.918	50	20	IDGD	
CCCCC[C@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21	1790892853	MHEFCKZCNFCMFJ-GIUOSPMZSA-N	430.354	1.176	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]2C1	1791063583	MCIPYGBPJQSTQI-DGORSVRFSA-N	426.149	1.533	50	20	IDGD	
C[C@@H](Cc1ccccn1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21	1791492304	OWQDYNHDPCOBHO-XPYWIHLFSA-N	442.329	1.930	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Cl)C[C@@H]32)C1	1792202894	YSOWNRDYAJFNFL-QBYUYEEZSA-N	447.935	1.758	50	20	IDGD	
CC(C)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1C[C@@]13C(=O)Nc1ccccc13)C2	1792785641	MPNIPFQIHIPZON-IVTYCSMISA-N	445.947	1.751	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3nccn3c1)C2	1792867491	CKYMKYBTWLJZRF-FAYQHZLMSA-N	435.322	1.569	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H]1CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2	1793649713	IRKQKCHMVHKEMH-AUOOEQCUSA-N	447.935	1.900	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1cccnc1	1794429955	WFJBMNOZNMYWEW-SGNWOITLSA-N	434.500	1.867	50	20	IDGD	
Cc1noc(C)c1CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCBr	1795111523	VJYSNJAPTPUNFC-ZSBFGKGUSA-N	428.327	1.599	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2)c1cnc(C(F)(F)F)cn1	1796070280	GXQZYTGIFSZEMT-AKZRSSKFSA-N	427.210	1.502	50	20	IDGD	
C[C@@H](Sc1ccccc1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1	1796187873	IOPPBOJVGKRNFN-GEALJGNFSA-N	438.358	1.799	50	20	IDGD	
CC(C)n1cnc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)CBr)C3)n1	1796629893	PNLPIXRQCZPBPI-FQUUOJAGSA-N	428.331	1.093	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@H](O)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CO[Si](C)(C)C	1798624674	WQEVXPUCTRNPJR-FZKCQIBNSA-N	443.617	1.362	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnccc1C(=O)NN)C2	1800080870	RUBSOMDFVXGHHB-DBYGNECLSA-N	428.320	1.173	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C[C@H](O)CNC(=O)OC(C)(C)C	1800182839	UUGAGHBKQXGDGU-XFIYOXNOSA-N	447.960	1.154	50	20	IDGD	
Cc1cc2cccc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)CCC(=O)NN(C)C)c2[nH]1	1801011174	KYEDWYIIVLEREA-UPHUGPLXSA-N	441.532	1.053	50	20	IDGD	
CCOC(=O)c1ncn2c1CC[C@H](C(=O)N1[C@H]3CC[C@@H]1C[C@H](NC(=O)[C@@H](F)Cl)C3)C2	1801422430	URZKFJQPOLIWRA-JEJJNBGPSA-N	440.903	1.795	50	20	IDGD	
CC[C@@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cn1cc(C)c(O)nc1=O)C2	1801807849	WLAJHFXDQRWQSZ-XJFOESAGSA-N	441.326	1.069	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(C)(C)CCl)C2	1801955172	LPDWPLLIAOCHKN-MIFYACCESA-N	431.961	1.756	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)c2cc(O)n(C)n2)[C@H]1c1cccnc1	1804898312	GMUCKLJGNJHJKA-NORZTCDRSA-N	436.310	1.624	50	20	IDGD	
CN1C(=O)CC[C@H]1C(=O)NC[C@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1	1808757469	KQILIFLWKPHGQF-RVKKMQEKSA-N	437.338	1.493	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2cccc(C#N)c2)[C@H]1c1cccnc1	1811797301	WTMJJKTYPABIML-NFBKMPQASA-N	448.527	1.646	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)C(=O)N(C)C)[C@H]1c1cccnc1	1812775864	CNYSYZIUCVFBDN-ILXRZTDVSA-N	425.327	1.349	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)CCS(C)(=O)=O)[C@@H]1c1cccnc1	1812868194	UFYGDWGALLAJEP-DUVNUKRYSA-N	446.367	1.306	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2ccc(OC)nn2)[C@@H]1c1cccnc1	1813031863	RZCWSKSQDBBROB-RLFYNMQTSA-N	433.896	1.454	50	20	IDGD	
CCOC(CC(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)OCC	1813201432	HNJSIPCKQQYOCS-TXPKVOOTSA-N	427.929	1.476	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(O)cc1)CC2)c1ccc(B(O)O)cc1	1815343902	WAMAAHKGWPNRPY-HNNXBMFYSA-N	437.286	1.068	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H]2CCC(=O)N2)n[nH]1	1816965922	IMMDGECXUCUOAS-GVXVVHGQSA-N	426.315	1.711	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](F)Br)n[nH]1	1820934781	AXCYQBRSBLVNCH-XWIASGKRSA-N	447.309	1.800	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(O)cn2)[nH]n1	1822413302	SDCCCAVJPLIVDX-INIZCTEOSA-N	429.481	1.189	50	20	IDGD	
Cc1ncccc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1	1822413439	WFXVAHSGVJZSLF-QGZVFWFLSA-N	427.509	1.792	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](C)n2cnnn2)n[nH]1	1822858431	AJRLPKWJLSLLBS-GVXVVHGQSA-N	439.318	1.823	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1CCc2nc(NC(=O)Cn3nccn3)sc2C1	1823109657	MNUIPCAPCYFLPW-NXEZZACHSA-N	427.328	1.378	50	20	IDGD	
CC(C)(CCl)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H]3CCCS3(=O)=O)sc2C1	1824925504	JAZLODDWBPDTDF-MFKMUULPSA-N	433.983	1.897	50	20	IDGD	
CCC(=O)N[C@H](C)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](C)Br)sc2C1	1825636236	RXTXPZXECBZWSZ-OPRDCNLKSA-N	431.356	1.753	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCN1CCOC1=O)CC2	1825640031	CUJXBSISNQEJRO-ZJUUUORDSA-N	445.339	1.681	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCSC(=N)N)CC2	1825642977	XMCLNIDPCSJQRI-SFYZADRCSA-N	434.385	1.855	50	20	IDGD	
CNc1nsnc1C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](Cl)COC)sc2C1	1825991302	IRFXUTMCCIXQCG-SFYZADRCSA-N	430.943	1.516	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@@H](O)CCl)CC3)cc1	1827726349	CVPIIIULFSBOHL-ZFWWWQNUSA-N	436.921	1.927	50	20	IDGD	
COc1ccnc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)[C@H](O)CCl)CC2)c1OC	1829852762	DMOHUGAIXAMPGF-JKSUJKDBSA-N	439.940	1.932	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(OC)nc3)C2)C1	1831641199	XCGJEQXSGNQLLU-JXFKEZNVSA-N	425.913	1.568	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)C3CCN(CC)CC3)C2)C1	1831658393	DSFXWJUNNIYXSL-NQIIRXRSSA-N	429.989	1.582	50	20	IDGD	
O=C(CCN1C(=O)C=CC1=O)N1CCC([C@H]2CCCCN2C(=O)C(Cl)Cl)CC1	1831874211	DBOHTJJGRVOOJV-CQSZACIVSA-N	430.332	1.725	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](C)n2cnnn2)CC1	1832290570	PQLGSOYBXBROFV-GUTXKFCHSA-N	427.347	1.637	50	20	IDGD	
Cc1noc(C)c1CC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)Br)C2)C1	1832561049	KJWQAJVCRPHHGM-KZULUSFZSA-N	444.326	1.074	50	20	IDGD	
C[C@@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)c3ccncn3)CC2)CC1	1833263820	UVJZIJDAFQURSL-AWEZNQCLSA-N	438.370	1.693	50	20	IDGD	
C[C@@H](Nc1cccnc1)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)CCl)CC2)CC1	1833308942	FCRSACLERGSIFN-BEFAXECRSA-N	437.972	1.053	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)CCl)CC2)CC1	1833312250	MSDXCGCRYWAIKV-HUUCEWRRSA-N	438.794	1.331	50	20	IDGD	
Cc1ccc(CCC(=O)NC2CCN(C3CCN(C(=O)[C@H](O)CCl)CC3)CC2)cn1	1833804365	VVMFIXAMRLPHNK-HXUWFJFHSA-N	436.984	1.494	50	20	IDGD	
CCc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)cn1	1833895333	VNSITFOFWOSBSM-OAQYLSRUSA-N	435.597	1.566	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cncc(F)c3)CCO2)C1	1834360031	RJPFHPHOLGFIFU-MSOLQXFVSA-N	434.295	1.527	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(CN(C(=O)CCc3ccccc3)CCO2)C1	1834838968	DETPPIUGQKGLDT-QFIPXVFZSA-N	434.609	1.927	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)N1CCC(N2CCC(NC(=O)[C@H](F)Cl)CC2)CC1	1835083711	RKTRYLFVMCYOOI-INIZCTEOSA-N	434.940	1.617	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)c1c[nH]c2ncccc12	1835317231	OIGXFGCRVGXUCY-GOSISDBHSA-N	433.940	1.348	50	20	IDGD	
Cn1ncnc1C(=O)N1CCC(OC2CCN(C(=O)CCBr)CC2)CC1	1837370094	NUHPASLVQZGEOW-UHFFFAOYSA-N	428.331	1.212	50	20	IDGD	
C[C@H]1CCC[C@@H]1C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1	1837919207	QDNYFOANKKRZCJ-JTSKRJEESA-N	442.365	1.415	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@](C)(Cl)CCl)C3)C2)ccn1	1837940477	CJTIBDOGFBHFFP-RTBURBONSA-N	430.332	1.696	50	20	IDGD	
CN1CCN(C2(C(=O)N3CCC(OC4CCN(C(=O)[C@@H](F)Cl)CC4)CC3)CC2)CC1	1838083939	HSIUXPOWQFIMNR-GOSISDBHSA-N	444.979	1.299	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)cc1OC	1838931182	NLDKZPLEHSAUNH-LPHOPBHVSA-N	430.860	1.308	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(O)ccc3F)CCO2)C1	1839296058	GLNOIQXEAAGVPU-OALUTQOASA-N	449.306	1.838	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1[C@H]3SC=C[C@H]31)CCO2	1839694896	VPULATLGUMYYEB-JSEZXORMSA-N	445.379	1.349	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ncc(C)s3)C2)C1	1839963783	VRTDSABSEGWMHC-GUYCJALGSA-N	446.367	1.695	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3sccc3F)C2)C1	1840030603	PXIBITZBHRGZTI-MEDUHNTESA-N	435.315	1.741	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3cccc(O)c3)C2)C1	1840155523	DWUFMDDTUXRGSB-GHTZIAJQSA-N	440.924	1.035	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC12CN(C(=O)[C@H](C)[C@@H]1SC(=N)NC1=O)C2	1841286723	WHRFCXZJXATOPO-MXWKQRLJSA-N	431.356	1.023	50	20	IDGD	
N#C/C(=C\c1ccc(Br)cc1)C(=O)N1CC2(CCCN2C(=O)CNC(=N)N)C1	1842884436	JSRLXQLIIGPXAS-RIYZIHGNSA-N	445.321	1.043	50	20	IDGD	
CC[C@H](C)[C@@H](N)C(=O)N1CCCC12CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1842888739	AEKVNHBLPZNJBX-SOUVJXGZSA-N	430.977	1.695	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)CCCc1cccnc1)C2	1843417218	JJTNDNXEJFLWBS-YZSQISJMSA-N	436.516	1.742	50	20	IDGD	
COc1ccc(CCC(=O)N2CCCC23CN(C(=O)CCC(=O)NN(C)C)C3)c(F)c1	1843930602	ZNPYVMNBZDMUQD-UHFFFAOYSA-N	434.512	1.343	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)CCc1cnc3[nH]ccc3c1)C2	1844265305	PDYPGUGLRWJHKC-UHFFFAOYSA-N	447.499	1.011	50	20	IDGD	
Cc1cnoc1C(=O)N1CC2(CCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)C1	1845039261	YAYPRRIAWOIEDQ-UHFFFAOYSA-N	440.504	1.146	50	20	IDGD	
CCOC(=O)c1ncn2c1CC[C@@H](C(=O)N1CC3(CCCN3C(=O)[C@H](Cl)CC)C1)C2	1845167109	JATODEMPTGAVDF-HUUCEWRRSA-N	436.940	1.843	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)/C=C/c2cc(F)c(F)c(F)c2)C1	1846274385	YTUPRDBNELBOJW-FARCUNLSSA-N	444.218	1.314	50	20	IDGD	
CN(CC(=O)N1CC2(CCCN2C(=O)C2(F)CCC2)C1)NC(=O)NCc1ccccc1	1846753223	IMFZBAZNSUTWQR-UHFFFAOYSA-N	431.512	1.428	50	20	IDGD	
C[C@@H](C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)n1ccnc1	1847673834	CEPQCVYMIVMJPY-VGWMRTNUSA-N	439.944	1.778	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(N2C[C@@H](C(=O)NNC(=O)CC(C)C)CC2=O)cc1	10160610	ZETHAQMKOGUECD-HNNXBMFYSA-N	438.550	1.264	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(OC)cc2OC)c1	15525717	VKBDXDLEWPEORT-UHFFFAOYSA-N	435.502	1.809	50	20	IDGD	
O=C(NNC(=O)c1ccccc1F)c1ccc(F)c(S(=O)(=O)N2CCOCC2)c1	15991489	IBZDFOGXVLTFOQ-UHFFFAOYSA-N	425.413	1.061	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)c2ccc(CCNS(C)(=O)=O)cc2)c1C	18103688	NLZKJDPECBKSAU-INIZCTEOSA-N	433.530	1.624	50	20	IDGD	
Cc1sc2ncn(CCC(=O)NNC(=O)Cc3nc4ccccc4n3C)c(=O)c2c1C	26538800	XYZFGUTUCRKVID-UHFFFAOYSA-N	438.513	1.742	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2cc(Br)ccc2O)n1	105217080	NZGCKDXYESNMRB-UHFFFAOYSA-N	428.264	1.467	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)c2ccnc(-n3cncn3)c2)c2ccccc2c1=O	117496471	LQNNPFUVVZXLCA-UHFFFAOYSA-N	446.471	1.637	50	20	IDGD	
CC(=NNC(=O)c1cccn1C)c1ccc(S(=O)(=O)N2CCCC[C@H]2C(=O)O)cc1	725847700	QSIKXHHORXMVPD-SFHVURJKSA-N	432.502	1.807	50	20	IDGD	
COCC[C@@H](C)NC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	726261220	OPXJEUKNXCXABR-GFCCVEGCSA-N	426.520	1.918	50	20	IDGD	
COc1ccc(C(=O)N[C@H](C(=O)NNC(=O)Cn2nc(C)cc2C)c2ccccc2)cc1	727098771	SITCDHQMYUYFRZ-NRFANRHFSA-N	435.484	1.827	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)CN(C)S(=O)(=O)c2ccccc2)cc1F	727498278	HVBOTPRUIIOBER-UHFFFAOYSA-N	426.495	1.473	50	20	IDGD	
CC(C)NC(=O)C(=O)NNC(=O)CCCCc1ccc(I)cc1	727725747	BJDDASVUGGFTMM-UHFFFAOYSA-N	431.274	1.676	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)Cn2cnc3sccc3c2=O)c1	728529273	XTVKJBQYGTZBDX-UHFFFAOYSA-N	437.275	1.690	50	20	IDGD	
O=C(CN1C(=O)Cn2c(cc3ccccc32)C1=O)NNC(=O)c1cccc(OC(F)F)c1	728543690	CLHNRYAAURFFPC-UHFFFAOYSA-N	442.378	1.686	50	20	IDGD	
O=C(O)c1ccc(Cl)c(S(=O)(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1	728856116	HGOWKBNMGSHGJF-UHFFFAOYSA-N	439.881	1.054	50	20	IDGD	
Cc1ccc2oc(C(=O)NNc3ccc(S(=O)(=O)N4CCN(C)CC4)cc3)cc2n1	729534775	XLJQDEPZNBYGPJ-UHFFFAOYSA-N	429.502	1.829	50	20	IDGD	
CN(C)N(C(=O)c1cnn(-c2cccc(Br)c2)c1)[C@@H]1CCS(=O)(=O)C1	730161525	IJKHTEZEOMRBIV-OAHLLOKOSA-N	427.324	1.741	50	20	IDGD	
COc1ccccc1C/C(C)=C/C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	730206128	JQUGMMKFJOTVSV-FYWRMAATSA-N	431.514	1.896	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)nnn1-c1ccc(OC(C)C)cc1	731343284	IUPOZGKAYJXOMA-UHFFFAOYSA-N	447.459	1.413	50	20	IDGD	
Cc1c(C(=O)OCC(=O)NNC(=O)c2ccccc2)nnn1-c1cccc2ncccc12	731380084	FWHGHNFAYXFJJP-UHFFFAOYSA-N	430.424	1.742	50	20	IDGD	
COc1cc(C=O)c([N+](=O)[O-])cc1OCC(=O)NNC(=O)[C@H](C)Oc1ccccc1F	731596961	NJXJQXPEBIFXSV-NSHDSACASA-N	435.364	1.549	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)N[C@@H]2CCN(c3ccccc3C(N)=O)C2)c1C	732595411	QQIDMQFQHOZRMU-DLBZAZTESA-N	439.516	1.779	50	20	IDGD	
O=C(NNC(=O)c1coc2ccccc12)c1cccc(S(=O)(=O)N2CCOCC2)c1	733211803	FBSDKPSLTPXFTR-UHFFFAOYSA-N	429.454	1.529	50	20	IDGD	
CNS(=O)(=O)c1ccc([C@H](C)NC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1	733343506	QZMPGKLLLOPIFV-AWEZNQCLSA-N	442.501	1.486	50	20	IDGD	
CN1CCC(N2CCC(NC(=O)NNC(=O)c3cnn(-c4ccccc4)c3)CC2)CC1	733347364	VNKKXIIASFUFHY-UHFFFAOYSA-N	425.537	1.375	50	20	IDGD	
O=C(CCCNS(=O)(=O)c1ccc(F)cc1)NNC(=O)c1cnn(-c2ccccc2)c1	733364773	RGJKUSOLPQZYSO-UHFFFAOYSA-N	445.476	1.531	50	20	IDGD	
COc1ccc([C@H]2[C@H](C(=O)OCC(=O)NNC(=O)c3cccs3)CCC(=O)N2C)cc1	734617637	KONCKMRVVUXXAX-BEFAXECRSA-N	445.497	1.671	50	20	IDGD	
CN(CC(=O)NNc1ccc(Cl)nn1)S(=O)(=O)c1ccc(Br)cc1	735688907	FTYYOGQEMQBKMB-UHFFFAOYSA-N	434.703	1.656	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2ccc(C#N)cc2[N+](=O)[O-])cc(OC)c1OC	741203700	GJAFWWWUOIWJSV-UHFFFAOYSA-N	436.402	1.116	50	20	IDGD	
O=C(O)c1cc(C(=O)O)cc(S(=O)(=O)NNC(=O)C(F)(F)Oc2ccccc2)c1	741653678	ZZXFWXRQLKWYHP-UHFFFAOYSA-N	430.341	1.064	50	20	IDGD	
CC(C)c1nn(C)c(Cl)c1C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	741663226	ZZMHYAYWZNNUQD-UHFFFAOYSA-N	434.305	1.573	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C[C@H]2CCCN2C(=O)OC(C)(C)C)c2ccccc2c1=O	742473544	COXHNXRIDUZHGG-CQSZACIVSA-N	443.504	1.967	50	20	IDGD	
CNS(=O)(=O)Cc1ccc(CNC(=O)NNC(=O)Nc2ccc(N(C)C)cc2)cc1	743503238	SFXBJHFCJUWPDW-UHFFFAOYSA-N	434.522	1.338	50	20	IDGD	
CC(C)[C@@H](C(=O)OCC(=O)NNC(=O)c1ccc(C#N)cc1)N1C(=O)c2ccccc2C1=O	744450733	IFQAYEDSQQIWHH-IBGZPJMESA-N	448.435	1.183	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)[C@@H](c2ccccc2)N2CCSCC2)n1	745088933	HQROXWCWGNZNEP-LJQANCHMSA-N	448.570	1.475	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)C[C@@H]2CCCN2C(=O)OC(C)(C)C)n1	745455023	WEYUTDKXPDENHW-ZDUSSCGKSA-N	440.522	1.474	50	20	IDGD	
O=C(CNC(=O)[C@H]1c2ccccc2C(=O)N1Cc1ccccc1)NNC(=O)NCC1CC1	745867648	BNKVMYZCJBXEDS-HXUWFJFHSA-N	435.484	1.240	50	20	IDGD	
CCc1ccc(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-]	746614081	BSSYNDSETPEHIQ-UHFFFAOYSA-N	434.474	1.935	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN1Cc1ccc(F)cc1)c1csc(N2CCOCC2)n1	747200453	WROWDSLKUSLTNG-KRWDZBQOSA-N	433.509	1.544	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1	747726261	CMFRLOHQGHBLCU-JTQLQIEISA-N	439.222	1.134	50	20	IDGD	
Cc1csc(Sc2ccc(C(=O)NNC(=O)C(=O)N3CCCC3)cc2[N+](=O)[O-])n1	748246373	JHMHEZAHPNAZJR-UHFFFAOYSA-N	435.487	1.894	50	20	IDGD	
O=C(CN1CCC[C@H](CNC(=O)c2ccccc2)C1)NNC(=O)c1ccc([N+](=O)[O-])cc1	748835861	MXCPJAXZKBUJAF-MRXNPFEDSA-N	439.472	1.498	50	20	IDGD	
COc1ccccc1NC(=O)CN1CCN(C(=O)NNC(=O)c2ccc(C#N)cc2)CC1	749805770	GNMOALREPCJPGL-UHFFFAOYSA-N	436.472	1.178	50	20	IDGD	
CN1CC[C@@H](C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)c2ccccc21	750778882	ILHRZDJMXMYSEF-QGZVFWFLSA-N	430.530	1.774	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNS(=O)(=O)c2cnn([C@@H]3CCOC3)c2)c1	751547537	KVAMYHQTBPDPFJ-SNVBAGLBSA-N	445.295	1.239	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)NCc1ccc(COC2CCOCC2)cc1	752156129	SPKSLZBSHSWADX-UHFFFAOYSA-N	430.461	1.236	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1	752238543	RRZMDXMHSDTKFN-CQSZACIVSA-N	447.473	1.160	50	20	IDGD	
COCCOc1cc(C)ccc1CNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1	755151758	ZDQPJTFLRZHRBJ-UHFFFAOYSA-N	442.520	1.557	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)Nc2ccc(C)c(S(=O)(=O)N(C)C)c2)cc1	755393988	XBTPBIQWRCBUFE-UHFFFAOYSA-N	436.490	1.486	50	20	IDGD	
COC(=O)c1ccc(N2CCCC2)c(NC(=O)NNC(=O)c2cncc(NC(C)=O)c2)c1	755603489	UEKGTFGNNLYFIN-UHFFFAOYSA-N	440.460	1.893	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)Nc1cccc(CN2CCOC2=O)c1	755827012	IOTKUFMXKYZXRN-UHFFFAOYSA-N	439.476	1.498	50	20	IDGD	
CC(C)(C)OC(=O)N1CCc2cc(NC(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)ccc21	756308733	DPTQCFHMZIKOCI-ZDUSSCGKSA-N	438.506	1.572	50	20	IDGD	
Cc1nc(C)n(-c2ccccc2NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)n1	757709324	CIJAXHXWKYERGK-UHFFFAOYSA-N	435.492	1.743	50	20	IDGD	
Cc1ccc(-n2ncc(C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)c2C2CC2)cc1Cl	758035880	OFIXCBBKIDNFLO-NSHDSACASA-N	439.925	1.410	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)CCCSc1ccc(Br)cc1	758052893	JZPGQSUDGKHDGD-SNVBAGLBSA-N	438.369	1.407	50	20	IDGD	
O=C(NCc1ccc(-n2cnc3ccccc32)cc1)NNC(=O)C(=O)Nc1ccccn1	758731215	YGEHEFHMRBXERB-UHFFFAOYSA-N	429.440	1.890	50	20	IDGD	
O=C(NNC(=O)c1cn(Cc2ccccc2)nc1-c1cccnc1)C(=O)Nc1ccccn1	758840593	KPJNPZCQXPLMOH-UHFFFAOYSA-N	441.451	1.788	50	20	IDGD	
CCC(CC)(C(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1)c1ccc(OC)c(OC)c1	759573074	DMRDQAOJJOQMSY-AWEZNQCLSA-N	427.523	1.279	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccnn2[C@H](C)C2CC2)cc(OC)c1OC	760279831	QQRURSOFMQDHGA-LLVKDONJSA-N	431.449	1.280	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(\C#N)C(=O)NCCNS(=O)(=O)NC(C)C)c1C	760639145	DFGFBYPDUOVZAX-ZNBBLSJYSA-N	425.555	1.168	50	20	IDGD	
CS(=O)(=O)C1CCN(C(=O)NNC(=O)c2ccc(Br)cc2Cl)CC1	760751613	KIGCAMLOLBETFV-UHFFFAOYSA-N	438.731	1.966	50	20	IDGD	
C[C@H]1Cc2ccccc2N1S(=O)(=O)c1cccc(C(=O)NNc2nccn(C)c2=O)c1	761572006	KPEAQLCMMIHGQP-AWEZNQCLSA-N	439.497	1.677	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)Cc1c(C)[nH]c(-c2ccncc2)nc1=O	762408185	IMPQQBYIVIZJDI-UHFFFAOYSA-N	439.497	1.631	50	20	IDGD	
CCCS(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)c2ccccc2O)cc1F	762462535	JHZILAHUTIDBSN-UHFFFAOYSA-N	431.467	1.306	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(\C#N)C(=O)NNc2nccc(N3CCOCC3)n2)c1C	762852076	QTDSVOIFVYYXPL-QUYZQLMHSA-N	439.520	1.989	50	20	IDGD	
Cc1cccc(-n2c(NNC(=O)Cn3cc([C@@H](C)O)nn3)nc3ccccc3c2=O)c1C	763047392	HYWHQDRYONHNHU-OAHLLOKOSA-N	433.472	1.791	50	20	IDGD	
C[C@H](CC(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	763184681	ACKITCJVIAKGGP-RBSFLKMASA-N	431.555	1.242	50	20	IDGD	
NC(=O)[C@@H](NNC(=O)C1CCN(c2ncccn2)CC1)c1cccc(Br)c1	763383632	OJGYLEJCJFUUBA-HNNXBMFYSA-N	433.310	1.303	50	20	IDGD	
O=C(NNC(=O)c1ccc2ccccc2n1)C(=O)Nc1ccc(N2CCCC2=O)c(F)c1	763450851	QXFDQJQVKPDTNX-UHFFFAOYSA-N	435.415	1.900	50	20	IDGD	
O=C(NNC(=O)c1ccncc1)C(=O)Nc1cc(C(=O)N2CCCCC2)ccc1Cl	763463318	FLBDHWIBDQJXIN-UHFFFAOYSA-N	429.864	1.761	50	20	IDGD	
O=C(NNC(=O)c1ccccc1O)C(=O)Nc1ccc(Cl)cc1C(=O)N1CCCC1	763528561	BCYUOKLLSWYEFN-UHFFFAOYSA-N	430.848	1.681	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(OC)c(OC)c2)c(C)c1	763551605	YOTARMWSOBEUOU-UHFFFAOYSA-N	431.445	1.437	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)Nc1ccc(OCC(F)(F)F)cc1	763573682	UFLRJFVNGOHCJK-HNNXBMFYSA-N	439.346	1.554	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1cccc(NC(=O)c2ccoc2)c1	763628631	KXSYIOZXMVVFGQ-UHFFFAOYSA-N	446.423	1.888	50	20	IDGD	
Cc1cc(C(=O)N2CCCC2)ccc1NC(=O)C(=O)NNC(=O)c1c(C)nc2ccccn12	763629063	OBKGYMDIEYIBCP-UHFFFAOYSA-N	448.483	1.587	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2ccc(-c3csnn3)cc2)c1	763648652	FTMABWIMILTPKZ-UHFFFAOYSA-N	425.470	1.987	50	20	IDGD	
COc1cc(C(=O)N(C)C)ccc1NC(=O)C(=O)NNC(=O)COc1ccc(C)c(C)c1	763680636	SFEDXSOJFRMKQR-UHFFFAOYSA-N	442.472	1.179	50	20	IDGD	
CCNC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)cc1	763694459	JMUKTEUFNWXXHW-UHFFFAOYSA-N	448.863	1.020	50	20	IDGD	
COCCOC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2cccc(Cl)c2)c1	763752185	FNHBLYCQZZRUAQ-UHFFFAOYSA-N	434.836	1.935	50	20	IDGD	
O=C(NNC(=O)c1cc2c(s1)CCC2)C(=O)Nc1ccc(-n2cncn2)c(Cl)c1	763781362	JYQHDGYFEAJIFG-UHFFFAOYSA-N	430.877	1.871	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2ccc(Cl)c(F)c2)c2ccccc2c1=O	763785694	LAOXUVHUUFUWDL-UHFFFAOYSA-N	431.811	1.609	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccc(N2CCCC2=O)c(F)c1	763837563	IRKIUZWUQCCOPS-UHFFFAOYSA-N	432.383	1.257	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cnn(-c3ccccc3)c2)cc1	763861855	RGDGYJPUMVXXEJ-OAHLLOKOSA-N	437.456	1.824	50	20	IDGD	
Cc1cc(Br)ncc1NC(=O)C(=O)NNC(=O)Cc1c[nH]c2ccccc12	763865222	LSCITIQDTRRDLD-UHFFFAOYSA-N	430.262	1.962	50	20	IDGD	
COc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccc(F)cc1	763872880	PSIKUMQSTUALPC-LBPRGKRZSA-N	446.435	1.090	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2cc(F)c(Br)c(F)c2)n1	763892692	HSBYDNQHOBUYJB-UHFFFAOYSA-N	430.209	1.327	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)C(=O)Nc1cccc(-n2cccc2)c1	763945042	SKALFVYOJTUBPS-UHFFFAOYSA-N	430.424	1.768	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)C(=O)Nc1ccccc1OCC1CC1	763949069	NEBCDCPONVIBIT-UHFFFAOYSA-N	435.440	1.766	50	20	IDGD	
COc1cccc(-c2nsc(NC(=O)C(=O)NNC(=O)c3cc(Cl)ccc3O)n2)c1	763974720	WNGZUSPSSHUIRD-UHFFFAOYSA-N	447.860	1.972	50	20	IDGD	
C[C@@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3ccc(Cl)nc3)cn2)C[C@@H](C)O1	764100248	KIFLLWDDAHGMHM-VXGBXAGGSA-N	432.868	1.143	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c(C)c1	764267053	SBLLEBAHGDQIAK-UHFFFAOYSA-N	426.477	1.186	50	20	IDGD	
NC(=O)CCSc1ccccc1NC(=O)C(=O)NNC(=O)CCc1ccccc1O	764280528	CCFYQXOMWOGLPT-UHFFFAOYSA-N	430.486	1.078	50	20	IDGD	
O=C(Cc1cc[nH]n1)NNC(=O)C(=O)Nc1ccnn1Cc1ccc(C(F)(F)F)cc1	764286242	QNJJRTICRFPUFV-UHFFFAOYSA-N	435.366	1.002	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)C(=O)Nc1ccc(Br)c(C(F)(F)F)c1	764297753	YICYSWDASBBEBS-UHFFFAOYSA-N	434.172	1.899	50	20	IDGD	
CCOc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NNC(=O)Cc1ccccc1F	764314555	ZEYUVTSFDIWGQF-UHFFFAOYSA-N	430.436	1.255	50	20	IDGD	
CCN(Cc1ccccc1NC(=O)C(=O)NNC(=O)c1ccc(O)c(Cl)c1)C(C)=O	764349121	IYIYHEWHRHTLQY-UHFFFAOYSA-N	432.864	1.814	50	20	IDGD	
COC(=O)c1ccc(-n2cc(C)cn2)c(NC(=O)C(=O)NNC(=O)c2ccc(C)o2)c1	764371667	QZBAKGQRRLFBOL-UHFFFAOYSA-N	425.401	1.268	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)C[C@@H](OC)C3)n[nH]1	764378195	VMFRLLNABNVMCS-INIZCTEOSA-N	449.467	1.599	50	20	IDGD	
COc1ccc(OC)c(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)c1	764386549	AOVOIDGUHOQDEU-UHFFFAOYSA-N	427.392	1.633	50	20	IDGD	
CC(=NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C)c1ccc(OCC(C)C)cc1	764817101	NFDBXWIJMRIWMK-UHFFFAOYSA-N	426.477	1.009	50	20	IDGD	
CC(C)[C@H](C(=O)NNC(=O)CSc1ccccc1O)N1C(=O)c2ccccc2C1=O	765250789	IDTKUVDCJFRBHN-GOSISDBHSA-N	427.482	1.953	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2cc(C)nc(C)n2)c(I)c1	765711353	WDXWMSLKMADNME-UHFFFAOYSA-N	441.229	1.788	50	20	IDGD	
Cc1c(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cnn1-c1ccccc1	765731742	BCENBVDHLVJTIX-UHFFFAOYSA-N	446.511	1.400	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)CCOc3ccc(F)cc3)CC2)cc1	765747062	AVUKUIBZLOJPDK-UHFFFAOYSA-N	428.508	1.868	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](CC(F)F)C(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	766075116	JAJLJDSRFUILET-GFCCVEGCSA-N	439.419	1.887	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)c1csc2cncn12	766664865	WRGZNORBFJTHLE-UHFFFAOYSA-N	432.937	1.628	50	20	IDGD	
CC(C)[C@H](NC(=O)OC(C)(C)C)C(=O)NCC(=O)NNC(=O)Cc1ccc(Cl)cc1	768280740	WMOFJGWUVLBXBN-KRWDZBQOSA-N	440.928	1.695	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)NCCc1ccc(S(N)(=O)=O)cc1	770075523	HDPBMAQBNQIWOP-LBPRGKRZSA-N	440.909	1.328	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)NCC(=O)N3CCC(Cc4ccccc4)CC3)nc21	770403608	YZLZMBASCZDKQW-UHFFFAOYSA-N	438.492	1.176	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)CCc1ccc(S(=O)(=O)N2CCCCC2)cc1	771876755	XVZBAFGUHLACNW-OAHLLOKOSA-N	439.534	1.283	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1ccc(S(=O)(=O)N2CCCCCC2)cc1	771891629	ANPNXZQRFZEABK-AWEZNQCLSA-N	425.507	1.354	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)[C@@H](c1cccc(F)c1)N1CCOCC1	772892026	PYGJDISIXWPACC-GOSISDBHSA-N	448.882	1.316	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NNC(=O)c2ccnc(O[C@@H]3CCOC3)c2)C1	773420775	PLLYNDZICOEPKZ-HZPDHXFCSA-N	434.493	1.657	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNc2nccc(OC)n2)sc2c1CCCS2	773727330	WPRWSGIAWKUBOQ-UHFFFAOYSA-N	437.503	1.844	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccc(-n2cccn2)nc1	774007541	BLYZDVVFWQRJOE-GFCCVEGCSA-N	428.836	1.474	50	20	IDGD	
O=C(NNc1cnc2ccccc2n1)c1cccc(S(=O)(=O)NC[C@H]2CCCO2)c1	774780175	UXNAJFWCBIZGTH-OAHLLOKOSA-N	427.486	1.844	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN[C@H]2CCN(Cc3ccccc3)C[C@@H]2C)cc1OC	775689891	NBWGZQAJDRRAOB-PXNSSMCTSA-N	440.544	1.965	50	20	IDGD	
O=C(CN1CCC(O)(c2c(F)cccc2F)CC1)NNC(=O)c1cccc([N+](=O)[O-])c1	778239880	RSIGOBXDXNGUOM-UHFFFAOYSA-N	434.399	1.618	50	20	IDGD	
COCCN1C(=O)c2ccc(C(=O)NNc3ccccc3C(=O)OC)cc2S1(=O)=O	780738003	QGKXOLXHOWQUCM-UHFFFAOYSA-N	433.442	1.021	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)Cc2ccc(C(=O)NN=Cc3cnc(N)nc3)cc2)cc1	781574923	FQPFNMPMANGIDM-UHFFFAOYSA-N	438.513	1.952	50	20	IDGD	
CNC(=O)c1cc(Oc2ccccc2NC(=O)C(=O)NNc2ncncc2Cl)ccn1	782165725	LFMDVDRXMSRNJL-UHFFFAOYSA-N	441.835	1.759	50	20	IDGD	
O=C(NN=c1cc[nH]cc1)C(=O)Nc1ccc(OCCN2C(=O)c3ccccc3C2=O)cc1	783376171	IJCIOPOCBSXOSR-UHFFFAOYSA-N	445.435	1.260	50	20	IDGD	
C[S@@](=O)c1cccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)c1	783409436	UQGPROCZTWLVHH-MUUNZHRXSA-N	449.432	1.799	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2cc(C3CCC3)nn2-c2ccccc2)CCS(=O)(=O)C1	783424890	GHFJXNUVYHESDS-FQEVSTJZSA-N	431.518	1.276	50	20	IDGD	
Cc1cc(Sc2ccccc2)ccc1NC(=O)C(=O)NNC(=O)C(=O)N1CCCC1	783999612	QFSPHTCNDGNCGU-UHFFFAOYSA-N	426.498	1.855	50	20	IDGD	
O=C(NNc1nccnc1Cl)C(=O)Nc1ccc(F)cc1I	784777996	OYNCUEQNYUMGNC-UHFFFAOYSA-N	435.584	1.956	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)c(C(F)(F)F)c1	785024011	QDHVBVCLVJTPJB-UHFFFAOYSA-N	442.306	1.728	50	20	IDGD	
CCOC(=O)c1c(C)csc1NC(=O)C(=O)NNC(=O)Cc1cn2ccccc2n1	785059904	DDMFXTWLVSWOFG-UHFFFAOYSA-N	429.458	1.210	50	20	IDGD	
CN(Cc1ccccc1NC(=O)C(=O)NNc1nccn(C)c1=O)C(=O)OC(C)(C)C	785085689	COFJQPJDWKZFLH-UHFFFAOYSA-N	430.465	1.229	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CCCN(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)C1	787255209	PAMXBNVSDUXIHP-CQSZACIVSA-N	430.469	1.006	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)cccc1N1CCNC1=O	787541710	VDUIVGZIDMLNCS-UHFFFAOYSA-N	439.516	1.827	50	20	IDGD	
Cc1cc(C)nc(-n2nccc2NC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)n1	789307362	XRYOSESAIOKHLW-UHFFFAOYSA-N	433.432	1.637	50	20	IDGD	
COc1nc(Br)ccc1NC(=O)C(=O)NNc1cccc(S(C)(=O)=O)c1	789585160	VUPISVIYNDHGBN-UHFFFAOYSA-N	443.279	1.338	50	20	IDGD	
CC(C)(C)CC(=O)NNS(=O)(=O)c1cccc(S(=O)(=O)N2CCCCCC2)c1	790389223	LQNHMTXIUQZZIB-UHFFFAOYSA-N	431.580	1.997	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)c(OC2CCCC2)c1	792316603	JRRYLCKNZXTZNP-ZDUSSCGKSA-N	427.523	1.496	50	20	IDGD	
O=C(NNc1nc2ccccn2n1)C(=O)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1	792395934	WGTBBTOBCGYKNB-KRWDZBQOSA-N	445.487	1.455	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3C[C@@H](C)O[C@H](C)C3)cc2)n1	794090361	RRCGTBCPHJOZOF-HUUCEWRRSA-N	432.502	1.263	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H]2CN(CC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)CC[C@H]21	795098636	DXUWYJKSHNYLBC-DOTOQJQBSA-N	447.492	1.687	50	20	IDGD	
CCc1ccc(S(C)(=O)=O)cc1C(=O)NNc1ccccc1S(=O)(=O)N(C)C	795177430	MWQVUJKOPQCIMO-UHFFFAOYSA-N	425.532	1.660	50	20	IDGD	
COC(=O)c1cc(F)c(Br)cc1NC(=O)C(=O)NNC(=O)C1CCCC1	796997827	FAIGKVXBTKFUDD-UHFFFAOYSA-N	430.230	1.651	50	20	IDGD	
CC(C)(C)n1cc(C#N)cc1NC(=O)C(=O)NNC(=O)CNC(=O)OCc1ccccc1	797370087	UFJMQQUPGPFYPF-UHFFFAOYSA-N	440.460	1.127	50	20	IDGD	
O=C1CC(C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)(c2cccc(Cl)c2)C1	798687156	VQJKTXGUJXMQJX-UHFFFAOYSA-N	445.815	1.853	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@H]2C(=O)NNC(=O)CNc2ccccc2OC)cc1	799098372	FQJSDHOEHKJMJW-SFHVURJKSA-N	426.473	1.568	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2c(F)ccc([N+](=O)[O-])c2C)cc1	800621903	BHARXLQUSPINPR-LBPRGKRZSA-N	446.391	1.798	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2nn(-c3ccccc3F)cc2O)cc1	802063577	LDBRGKGIPJXERU-UHFFFAOYSA-N	433.421	1.587	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)c2ccc(S(N)(=O)=O)c(C)c2)c(OC)cc1Cl	802082603	WEKPQEQRTPEUDH-UHFFFAOYSA-N	442.881	1.780	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)[C@H]1CCCN(S(=O)(=O)c2ccc(F)cc2)C1	804956739	WULVOUOWEHOQFY-AWEZNQCLSA-N	445.480	1.345	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(NC(=O)NNC(=O)COc2ccc(C#N)cc2)ccc1F	806543748	GPQYTTAODUICGK-UHFFFAOYSA-N	435.437	1.179	50	20	IDGD	
O=C(NNC(=O)c1cccnc1)C(=O)Nc1cc(C(F)(F)F)cc(Br)n1	806972746	JWSMCTDQAAAHRF-UHFFFAOYSA-N	432.156	1.658	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)N[C@H]1CCCN(C(=O)N2CCCC2)C1	807458087	SITKLLJXOQYFBN-HNNXBMFYSA-N	441.492	1.202	50	20	IDGD	
CCCS(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)c2c(C)nc3ccccn23)cc1	808068683	FLZXBVTZBGCUSC-UHFFFAOYSA-N	436.515	1.450	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3ccnc(C(F)(F)F)c3)CC2)cc1	808408432	PHETYXJFYMLYGA-UHFFFAOYSA-N	435.450	1.988	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)C(=O)Nc2cccc3c2OCC(=O)N3)c1	810384901	KPCIKZXCDFMPPQ-UHFFFAOYSA-N	440.456	1.614	50	20	IDGD	
CC(=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O)c1csc(-c2ccccc2F)n1	812224148	CALSMDNZTUGYQM-UHFFFAOYSA-N	448.505	1.374	50	20	IDGD	
CNC(=O)c1cc(Oc2cccc(NC(=O)C(=O)NNC(=O)OC(C)(C)C)c2)ccn1	815570773	LZBTYZAPZUIULU-UHFFFAOYSA-N	429.433	1.728	50	20	IDGD	
CNC(=O)c1cc(Oc2cccc(NC(=O)C(=O)NNC(=O)c3ncccc3C)c2)ccn1	815571194	XNNIGMRGPKXIFE-UHFFFAOYSA-N	448.439	1.337	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1cn(Cc2ccccc2)nn1	815626217	YXSODEMRTARIQU-CYBMUJFWSA-N	442.863	1.533	50	20	IDGD	
CC(C)CNC(=O)N1CCC[C@@H](C(=O)NNc2ccccc2S(=O)(=O)N(C)C)C1	817053265	KLAIBRAAOJWCIU-OAHLLOKOSA-N	425.555	1.458	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=O)CNc2cccc(OC)c2)ccc1C	825776589	JGTYNIWALZAZFP-UHFFFAOYSA-N	448.545	1.907	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNS(=O)(=O)c2ccc3c(c2)C(=O)N(C)C3=O)cc1	861630557	SQVAKABFGARFAS-GFCCVEGCSA-N	447.469	1.088	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)CN2C(=O)N[C@@]3(C[C@@H](C)CC(C)(C)C3)C2=O)cc1C	864001798	KGLSJDYGXXVFDH-LFVRLGFBSA-N	444.532	1.966	50	20	IDGD	
COc1cccc(C(=O)N2CCN(CC(=O)NNC(=O)c3ccccc3Cl)CC2)c1	912886317	AMVPOVGAJZZMCE-UHFFFAOYSA-N	430.892	1.568	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)CNS(=O)(=O)c2ccc3ccccc3c2)cc1	913455168	OUTGQDACZOIEFK-UHFFFAOYSA-N	438.465	1.216	50	20	IDGD	
COc1cc(OC)cc(C(=O)N2CCN(CC(=O)NNC(=O)c3ccc(F)cc3)CC2)c1	914576038	SGVUGYUCOGKYMB-UHFFFAOYSA-N	444.463	1.062	50	20	IDGD	
O=C(CCNS(=O)(=O)c1cccnc1)NNC(=O)c1ccc(COc2ccccc2)o1	914614290	XVTRHPVNMUZSSL-UHFFFAOYSA-N	444.469	1.383	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NC[C@@H](c2cccs2)N2CCOCC2)cc1	915893241	HDNRLWTVOJWBOP-KRWDZBQOSA-N	434.518	1.539	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)N[C@H](CN1CCOCC1)c1ccccc1	916214620	ROTNEBXQOGAYOG-YLJYHZDGSA-N	426.473	1.230	50	20	IDGD	
Cc1ccc([C@@H](CN2CCOCC2)NC(=O)NNC(=O)COc2ccc(C#N)cc2)cc1	916215123	DCVZGZHAEYESDV-OAQYLSRUSA-N	437.500	1.649	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)N[C@H](CN2CCOCC2)c2ccccc2)nc2ccccc21	916216876	VHTPVLHIVHJDMP-LJQANCHMSA-N	436.516	1.520	50	20	IDGD	
CC(=O)Nc1ccc(CNC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1	916250447	ANWIPRLLFLFMTH-UHFFFAOYSA-N	447.517	1.105	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NCc1ccc(S(=O)(=O)N(C)C)cc1	916646814	PGKUDEDUDKRWGJ-ZDUSSCGKSA-N	438.481	1.374	50	20	IDGD	
CC(=O)Nc1ccc(S[C@@H](C)C(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1	916734416	FUEGCNDXKXJKTQ-LBPRGKRZSA-N	449.558	1.880	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NCc2cc(F)ccc2Br)c2ccccc2c1=O	918104561	RSGALBCVYYNTIH-UHFFFAOYSA-N	448.252	1.979	50	20	IDGD	
O=C(NCc1cccc(CN2CCOCC2)c1)NNC(=O)c1nnc(O)c2ccccc12	918223828	NSNMYXCAMUWTJI-UHFFFAOYSA-N	436.472	1.312	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCN(c2ccc(C#N)cn2)CC1	918739109	XUNHFMATCBFQFY-UHFFFAOYSA-N	428.880	1.198	50	20	IDGD	
Cn1nc(SCC(=O)NN=C2CCOc3c2ccc(Cl)c3Cl)c(=O)n(C)c1=O	920369971	CSTKUWBJRDJJHR-UHFFFAOYSA-N	444.300	1.181	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)C2=S=C(c3ccc(F)cc3)C=C2)cn1	920934179	IIXDTSQYGNCTDX-UHFFFAOYSA-N	434.474	1.473	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCOC1)c1ccc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1	921203312	XZJNJUCOVQZEKJ-CYBMUJFWSA-N	434.430	1.193	50	20	IDGD	
Cc1ccc(NC(=S)NNC(=O)c2ccc(S(=O)(=O)NC[C@@H](C)O)cc2)c(C)c1	1120572907	ZXHQTEQLWDBTAV-CQSZACIVSA-N	436.559	1.594	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)c1ccccc1F)C(=O)NNc1nncc(N)c1Cl	1319406138	OZLIHUAUOXLBLU-NSHDSACASA-N	448.933	1.395	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)NCc2nccc(C(F)F)n2)c2ccccc2c1=O	1323152512	ZEKCRGIVBFUFNB-UHFFFAOYSA-N	431.403	1.849	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4nonc4c3)C2)C1	1777721495	KBAXQKZHKXAWNT-ACJLOTCBSA-N	437.294	1.840	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(Cl)Cl)C2)c1ccc2c(n1)OCCO2	1777956533	UHITXQCAMQVIBJ-AUUYWEPGSA-N	444.315	1.784	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc4cccn4cn3)C2)C1	1778042871	KJXORRLQNQYYSN-LIRRHRJNSA-N	435.322	1.809	50	20	IDGD	
C=CC[C@@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C1	1778092799	QVWYXTGSUMBDSO-NNKDJZKXSA-N	443.548	1.847	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)C#CC3(O)CCCCC3)C2)C1	1779068353	YZWWCAPQBBYAEK-AZUAARDMSA-N	431.360	1.751	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@]2(C1)CN(C(=O)c1ccc(-n3cnnc3)cc1)CCO2	1779296326	OLRMHCGKUKBKBE-NRFANRHFSA-N	443.580	1.562	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc[nH]3)C2)C1	1779374389	HVZCDWNGLKJOOO-OAQYLSRUSA-N	442.428	1.606	50	20	IDGD	
Cc1n[nH]c(C)c1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)Br)C2	1779611356	UMFASWCBQQDHCY-YRILPIOLSA-N	427.343	1.937	50	20	IDGD	
O=C(c1n[nH]c2c1CCc1ncccc1-2)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Cl)CCO2	1780037134	FXFCWDTXXWIJBT-FXAWDEMLSA-N	433.871	1.548	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnc4snnc4c3)C2)C1	1780071809	PLECVNSKRDLWRU-DLBZAZTESA-N	444.344	1.766	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3nccc(Cl)c3OC)C2)C1	1780328441	NNAQFLZCPVEKLV-FZKQIMNGSA-N	432.304	1.441	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(OC)c(OC)c3)C2)C1	1780659497	WUVLHBWANBRTIR-FOIQADDNSA-N	426.897	1.401	50	20	IDGD	
CCS(=O)(=O)CC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@](C)(Cl)CCl)C1	1780705819	AELXODOZPIAICK-KBRIMQKVSA-N	443.393	1.171	50	20	IDGD	
O=C(c1cnc2ccoc2c1)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781332057	YRQZYPSYZURWFM-YOEHRIQHSA-N	426.242	1.962	50	20	IDGD	
O=C([C@H](F)Br)N1CC[C@@]2(C1)CN(C(=O)C(Cl)(Cl)Cl)CCO2	1781332933	GGWOPLKXVQJUNH-OIBJUYFYSA-N	426.497	1.877	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCc1cn[nH]c1)C2	1781997190	JOQFIBOKGDRWCS-DDUZABMNSA-N	427.343	1.640	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)c3cccc4nscc34)C2)C1	1782419937	NEYXSLSOQUNNRH-NRFANRHFSA-N	445.545	1.113	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@]2(C1)CN(C(=O)c1ccncn1)CCO2	1782866239	OEHVVONQFXXCDA-NAVGAYGYSA-N	439.422	1.805	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)CCN3CCCCC3)CCO2)C1	1783343642	WESLGHGQZXKRNU-LPHOPBHVSA-N	430.387	1.866	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc(Cl)nc3)[C@H]2C1	1783379320	YVKAUYNETQWPGR-HTWFXAOOSA-N	435.739	1.960	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)c1c(Cl)cncc1Cl	1783422569	KPBJHLLJQBQNCY-NUZBWSBOSA-N	436.723	1.581	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3n[nH]c4c3CCCC4)CCO2)C1	1783534577	LUUHWBBRJHGVNY-SGTLLEGYSA-N	425.327	1.515	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H]3C[C@@]34C(=O)Nc3ccccc34)C2)C1	1783548086	XNYYESGUNWTTNM-FRMGNDQPSA-N	431.920	1.744	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)/C=C/c3ccccc3[N+](=O)[O-])CCO2)C1	1783884452	SDTWFGSWFXQJHR-OJCVGBIZSA-N	437.880	1.692	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H](C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]3C2)C1	1787447105	LEYFJFWSNFWMTP-OLMNGRFOSA-N	447.935	1.758	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4c(c3)CCN4C)[C@H]2C1	1787998785	KDEDVELLWNUPOF-GNBUJSLZSA-N	435.952	1.526	50	20	IDGD	
CCc1cc(C(=O)NC2(c3ccc(NC(=O)c4cccc(B(O)O)c4)cc3)CCC2)n[nH]1	1788143525	BNNPVWQCBDDNSF-UHFFFAOYSA-N	432.289	1.713	50	20	IDGD	
CCn1nc(C(C)C)cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21	1789381448	RRJUCRMFDDCBMW-USJZOSNVSA-N	426.945	1.219	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4ncccn4n3)C[C@@H]21	1789867987	KOKZPHULYFXPIB-VODUFIJXSA-N	440.331	1.559	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4cccnn4n3)C[C@@H]21	1789870684	ROYLOVZHHSWESW-BCRCDCHUSA-N	440.331	1.559	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)c1cccn2nccc12	1790398714	MSBCHDVIQTUDLV-QRTARXTBSA-N	435.322	1.713	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3cccnc3OC)C[C@@H]21	1791252219	DTOXCPKLSDVUBE-FJIDUMEYSA-N	439.940	1.256	50	20	IDGD	
O=C1CCc2ccc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]4C3)cc2N1	1791296582	ZOMQNMSCFDUHAR-DZKIICNBSA-N	440.327	1.968	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(C=O)s1)C2	1792867853	NCFZRCHLHNVVCG-OHTBPHCPSA-N	429.336	1.795	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1C[C@H]1c1ccc(F)c(F)c1)C2)[C@@H](O)CCl	1792975443	RZJBVWANJIOWPF-SZNCOTQGSA-N	428.863	1.258	50	20	IDGD	
CC(C)(C)OC(=O)NCCCCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCl	1793107818	WTDWKTYSSFLXJJ-QKPAOTATSA-N	431.961	1.919	50	20	IDGD	
COc1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](O)CCl)c([N+](=O)[O-])cc1O	1793113270	GFBKXBYRELBATM-DDIVZENXSA-N	427.841	1.161	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C[C@H]1OCCc2ccccc21	1793274992	VBGKHOMWIRGNPE-BKRRIZPZSA-N	436.936	1.534	50	20	IDGD	
CN(CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1C[C@@H]1F)NC(=O)NCc1ccccc1	1793914459	ZWGPAPRTHSGYQJ-ZRSRNVLSSA-N	431.512	1.329	50	20	IDGD	
O=C(Cn1ccc2sccc2c1=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2	1794045169	LZGUNEMDUVEFMS-OJXGSEEGSA-N	427.885	1.187	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1nc(C)c(C)[nH]c1=O	1794614357	LKAUDGZESSURCV-CRWXNKLISA-N	425.327	1.812	50	20	IDGD	
COc1ncc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@](C)(Cl)CCl)C3)cc1C	1794985647	QVLBSTPGPICTOJ-NXEZDXNNSA-N	430.332	1.838	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCBr	1795113208	NMFNRRICGSYEEV-KQXIARHKSA-N	426.149	1.392	50	20	IDGD	
COc1ccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCBr)cc1O	1795113245	QEFBEEAHANVZIS-HBCWATKFSA-N	441.322	1.318	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccnn1-c1ccccc1)C2	1795114565	WTSSZWZJGQJQGG-CCWDJLKJSA-N	447.333	1.861	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc2sc(N)nc2c1	1796109190	DXMCVGVHDFQWRW-QDMKHBRRSA-N	444.561	1.503	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@](C)(O)C[C@H]1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](F)Cl	1796810229	KHFFJSZLIJKPEU-NMQXAITKSA-N	447.935	1.919	50	20	IDGD	
COc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CO[Si](C)(C)C)C3)cc(Cl)n1	1798290909	QNZIOELGFGRRCZ-ZSBFGKGUSA-N	441.988	1.798	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(C)(C)C#N)C2	1798521385	FNFNOBYXDBFGGI-ZSBFGKGUSA-N	444.444	1.273	50	20	IDGD	
COc1cccc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@](C)(Cl)CCl)n1	1799274253	UBEQXFYHVCCPRM-VLBMKZOESA-N	444.359	1.849	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COc1ccc(O)cc1)C2)[C@H](F)Br	1799343513	ZGPDHHSIZSDLQZ-OJXGSEEGSA-N	431.258	1.051	50	20	IDGD	
Cc1cccn2ncc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@H](F)Br)c12	1799347312	PLBMUQJJBWXIJH-LMWOUKEDSA-N	439.285	1.536	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(F)cc([N+](=O)[O-])c1	1800525883	ULOSTVPBFWPCQE-MUJYYYPQSA-N	435.456	1.359	50	20	IDGD	
Cc1ccc(/C=C/C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCC(=O)NN(C)C)s1	1801012072	AJJVFVDPBAKSAV-IZBNHTFTSA-N	434.562	1.032	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Cl)C3)C1	1801139364	JVYUNGBRBARAIE-BDLOOMQFSA-N	447.935	1.758	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C12CC(C1)C2	1801587258	JQILNVMUUIULTR-OZVZFPLOSA-N	441.956	1.508	50	20	IDGD	
NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](Br)Cc1ccccc1)C2	1801669112	UJJSLGWMBJGOHM-YYIAUSFCSA-N	436.350	1.896	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](NC(C)=O)c1ccc(F)cc1)C2	1802283848	QTQJOULFTWFUQB-ZRSRNVLSSA-N	439.915	1.895	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1CCN(C(=O)Cn2cncn2)[C@@H]1c1cccnc1	1803008214	JIIKONWYJDRRCN-UKPHBRMFSA-N	435.326	1.410	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1CCN(C(=O)CCn2cncn2)[C@H]1c1cccnc1	1803018174	XOBGTFAXCGIKFE-HFTRVMKXSA-N	449.353	1.800	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H](CNC(=O)CC(=O)NC)[C@H]1c1cccnc1	1803483246	ULQYJLSSSLGAJR-JKIFEVAISA-N	425.327	1.397	50	20	IDGD	
Cn1cccc(C(=O)NC[C@@H]2CCN(C(=O)CCBr)[C@H]2c2cccnc2)c1=O	1803829051	DPSJTLKSVDTURC-YJBOKZPZSA-N	447.333	1.885	50	20	IDGD	
O=C(Cc1cccs1)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1807544159	PZTPRXPBHLFMPP-AVRDEDQJSA-N	449.341	1.385	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)CNC(=O)c2ccco2)[C@@H]1c1cccnc1	1807595971	NJGPNCPVCOVJRQ-GJYPPUQNSA-N	448.907	1.364	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@H](CNC(=O)[C@@H]2C[C@H](O)CN2)[C@@H]1c1cccnc1	1807707854	PDGBBLJZPOIJLW-GMHRPJKWSA-N	429.348	1.047	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)c1ccc2nccnc2c1	1809384822	ONACXZXIDSZHNW-DBVUQKKJSA-N	439.903	1.944	50	20	IDGD	
C[C@@H](Nc1ccccc1)C(=O)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1	1809971014	JCJBDDVFKIVZHU-LJQANCHMSA-N	449.360	1.712	50	20	IDGD	
O=C(c1n[nH]c2c1CS(=O)(=O)C2)N1CCCC2(CCN(C(=O)C(Cl)Cl)CC2)C1	1810260081	SKSQTPVLKXNNBE-UHFFFAOYSA-N	449.360	1.487	50	20	IDGD	
C/C=C/C=C\C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1	1812578944	VOUJBGPIQBDFGX-RIBBNGDISA-N	434.500	1.532	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)[C@@H]2CCC(=O)NC2)[C@H]1c1cccnc1	1812862706	CSYQMDZZLXNMRZ-FAYQHZLMSA-N	437.338	1.397	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)/C=C\C(=O)NC2CC2)[C@@H]1c1cccnc1	1813030564	DEVYBKQGUVOZHY-ZLMSYNRNSA-N	434.924	1.176	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)nc1	1813069776	BUPDRRFABVMNHU-GCJKJVERSA-N	438.532	1.478	50	20	IDGD	
O=C(O)c1cnncc1C(=O)N1CC[C@H](CNC(=O)C(Cl)Cl)[C@H]1c1cccnc1	1813078246	GTMJOPGRDMJHDD-BXUZGUMPSA-N	438.271	1.693	50	20	IDGD	
C[C@H](C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)n1cccc1	1813308624	DHBOURODFWJWKF-PIPMEXSNSA-N	446.316	1.144	50	20	IDGD	
CCS(=O)(=O)CC(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](F)Br)[nH]n1	1815174422	RZDUSKABIGGJHU-MFKMUULPSA-N	439.307	1.527	50	20	IDGD	
CC(C)[C@H](S)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1815240154	KPAIWGGBSXNDTL-WMZOPIPTSA-N	430.339	1.350	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)C1=CCCS1	1815268963	NJQLYQWGQYWYQN-MRXNPFEDSA-N	426.307	1.416	50	20	IDGD	
CC(C)[C@H](S)C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1	1815337741	WJWXIYPUVKKJST-CJNGLKHVSA-N	433.364	1.003	50	20	IDGD	
Cc1cccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)n1	1816397886	ZMOFJPMUYHYVLV-KRWDZBQOSA-N	427.509	1.792	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CO[Si](C)(C)C)CC2	1817018099	VPVPFQCZMNVPDW-MNOVXSKESA-N	427.603	1.354	50	20	IDGD	
CCN(C)[C@@H](C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819404104	YMSXZAQSUIDJPR-GUYCJALGSA-N	442.524	1.054	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@H](O)CCl)CC2)c1cc(-c2cccnc2)[nH]n1	1820607201	BLXGSHDVOSYHLC-IAQYHMDHSA-N	446.920	1.754	50	20	IDGD	
Cc1cc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@@H](O)CCl)CC3)nn1C(F)F	1821555548	QYCMSOQZWCKIPT-KCJUWKMLSA-N	433.868	1.869	50	20	IDGD	
COc1cccc(OC)c1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](O)CCl)CC2	1821941734	UGUKLEUKXYFERP-ZYHUDNBSSA-N	439.921	1.986	50	20	IDGD	
Cc1ccccc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2	1822005107	RJFVQOCGKRZKGM-INIZCTEOSA-N	435.314	1.671	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnn3c2OCCC3)[nH]n1	1822375450	DBINIHPPZXAPKK-DZGCQCFKSA-N	436.900	1.948	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)C2CCSCC2)[nH]n1	1822417445	INNNAJFXLQOWSL-MRXNPFEDSA-N	436.582	1.918	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1sc(N)nc1C)CC2	1825998766	JULQGSPFKHORIZ-BDAKNGLRSA-N	429.955	1.970	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CN1CCCCC1=O)CC2	1826003909	AKDXMRMEEYLMRB-RYUDHWBXSA-N	428.942	1.321	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)CC1CCOCC1)CC2	1826085408	RICHPNXYMRNXMG-CQSZACIVSA-N	437.566	1.245	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)CNC(=O)C(F)(F)F)sc2C1	1826144958	ZILIMYAPJZFWKX-SFYZADRCSA-N	426.848	1.751	50	20	IDGD	
CN[C@@H](CC(=O)N1CCCC[C@H]1C1CCN(C(=O)CO[Si](C)(C)C)CC1)C(=O)O	1826947055	SBBBDFFUPMWFBG-IRXDYDNUSA-N	427.618	1.520	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccncc2)CC1	1828926009	XJAJYLYHOIOXRG-HXUWFJFHSA-N	436.516	1.627	50	20	IDGD	
CC(C)(C)c1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)cn1	1829566515	PNZKRLQAOPRUIG-KKSFZXQISA-N	439.940	1.049	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(Cl)cc3F)CCO2)C1	1830090335	SWBFLQHNQSOQFP-KXBFYZLASA-N	449.306	1.803	50	20	IDGD	
COc1cccc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)n1	1830358633	PVZMVTIMTXSDMA-OAQYLSRUSA-N	439.940	1.354	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](NC(C)=O)C(C)(C)C)C2)C1	1831639918	GWUSNOGDKLTFIN-XGHQBKJUSA-N	445.988	1.401	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccn4cncc34)C2)C1	1831650393	HENZZPHSZCBFRV-LAUBAEHRSA-N	434.924	1.812	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)/C=N/N2CCCCC2)CC1	1831873440	LCDSOZVIGLLETI-CTNNYUBMSA-N	448.612	1.451	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@](C)(O)C(F)(F)F)CCO2	1832149603	APPZMHGBYBICOY-MAZHCROVSA-N	430.851	1.164	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3n[nH]c(CC)c3F)CCO2)C1	1833734540	VVXMZEHEWATURO-BFUOFWGJSA-N	430.908	1.589	50	20	IDGD	
O=C(c1ccnc(C(F)(F)F)c1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1833794812	QSZMEJRDBKOXKO-CZUORRHYSA-N	439.793	1.705	50	20	IDGD	
Cc1ncsc1C(=O)N1CCOC[C@@]2(CN(C(=O)CCBr)CCO2)C1	1834819326	NGZFLDARXONKPE-MRXNPFEDSA-N	432.340	1.307	50	20	IDGD	
Cc1occc1C(=O)N1CCC(OC2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1	1837458577	NNHZOBNFRXTKEZ-UHFFFAOYSA-N	434.537	1.573	50	20	IDGD	
CC(C)CNC(=O)C(=O)N1CCC(OC2CCN(C(=O)CCBr)CC2)CC1	1837653474	DIMJABNRUARJKX-UHFFFAOYSA-N	446.386	1.542	50	20	IDGD	
Cc1noc(CC(=O)N2CCC(OC3CCN(C(=O)[C@@H](F)Br)CC3)CC2)n1	1837950980	VLMVXSPOJCWSLW-MRXNPFEDSA-N	447.305	1.610	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccccc3-n3nccn3)C2)C1	1839147242	KSOZAPVEHILKSA-UTKZUKDTSA-N	447.923	1.355	50	20	IDGD	
Cc1nc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)cs1	1839151053	HCHOJUMBGHIKKG-IAGOWNOFSA-N	436.361	1.758	50	20	IDGD	
Cc1cccc(F)c1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2	1840037297	YAJJJSGEDLLFEE-AUUYWEPGSA-N	443.313	1.988	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C)cnc3Cl)C2)C1	1840151261	ZCNMCXSVGBTUQV-HNAYVOBHSA-N	446.331	1.367	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(C)nc3C)C2)C1	1840153930	GDMGUZSCEJHRRJ-PXNSSMCTSA-N	425.913	1.022	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)[C@H](NC(C)C)C(C)C)C1	1842998115	NXSUCZJCZRVMHJ-OAKZWBAKSA-N	430.553	1.346	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)c2ccc3c(c2)CCCC3=O)C1	1843760332	QOSSFSYFYZJGLF-UHFFFAOYSA-N	426.517	1.396	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC2(CCCN2C(=O)c2ccc3c(c2)NC(=O)CO3)C1	1844079006	JRMWCLOQVPFOOJ-LBPRGKRZSA-N	436.306	1.866	50	20	IDGD	
CN(CC(=O)N1CCCC12CN(C(=O)c1ccccn1)C2)NC(=O)NCc1ccccc1	1845038504	KBLVMOMCOXFMKZ-UHFFFAOYSA-N	436.516	1.245	50	20	IDGD	
Cc1ccc(C(=O)NCC(=O)N2CC3(CCCN3C(=O)[C@@H](F)Br)C2)cc1	1845220684	HXHGQYUFTNEAMZ-OAHLLOKOSA-N	426.286	1.619	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC12CN(C(=O)[C@@H](CCO)NC(=O)OC(C)(C)C)C2	1846175159	IGKAERXDPRUUHY-QWHCGFSZSA-N	448.358	1.249	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)cc2Cl)C1	1846299516	UEGKKPVFJHVOMU-WEVVVXLNSA-N	440.692	1.256	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)c1cn(C)cc1C(F)(F)F)C2	1846384927	ZXRZWIHQYUEARV-UHFFFAOYSA-N	429.443	1.234	50	20	IDGD	
COc1cc(Cl)cc(C(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)c1	1846854958	VWQBWHUGXJSENF-UHFFFAOYSA-N	443.891	1.478	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)C(F)(F)C(F)(F)C(=O)O	1848012830	FPNSIQNXEHJIIS-CIUDSAMLSA-N	433.196	1.717	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)/C(=C/c2ccccc2)NC(C)=O)cc1OC	8773923	FVLOZGHFHKRRSU-BOPFTXTBSA-N	441.440	1.185	50	20	IDGD	
Cc1[nH]c(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)c(C)c1C(=O)OC(C)C	12804246	FMBOWXSNWNRHTR-UHFFFAOYSA-N	435.506	1.565	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)CCN2C(=O)NC3(CCCC3)C2=O)cc1OC	21967097	LRQRUAUZPSLQFN-UHFFFAOYSA-N	432.477	1.500	50	20	IDGD	
CCOc1ccc(C(=O)NNS(=O)(=O)c2ccc(OC)cc2[N+](=O)[O-])cc1OC	23393979	FQEAPRGQBMIPLK-UHFFFAOYSA-N	425.419	1.634	50	20	IDGD	
CCOC(=O)c1cc(C(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)cc([N+](=O)[O-])c1	26687966	VNTHNGSUBMJHKQ-UHFFFAOYSA-N	447.400	1.872	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CCNS(=O)(=O)c2ccc(C(C)=O)cc2)cc1OC	26959846	LUSWTXZOBZMDKQ-UHFFFAOYSA-N	449.485	1.036	50	20	IDGD	
CC(C)(C)NC(=S)NNC(=O)CCCNS(=O)(=O)c1ccc2c(c1)OCCCO2	28716655	SXWBEDUVODMGIX-UHFFFAOYSA-N	444.579	1.200	50	20	IDGD	
Cc1ccc(N2C(=O)/C(=C\NNC(=O)[C@@H]3CCS(=O)(=O)C3)c3ccccc3C2=O)cc1	28807381	ZYGKZMXAAZNOCD-VUFYJBQKSA-N	439.493	1.578	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCC(C(=O)NCc3ccc(F)cc3)CC2)n1	108130344	XYXTUYABCGXYDX-UHFFFAOYSA-N	447.536	1.309	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2cccnc2)nnn1C1CCN(C(=O)OC(C)(C)C)CC1	726157132	OQDOWSPJYGBARO-UHFFFAOYSA-N	429.481	1.628	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)NC(C)C)cc1S(=O)(=O)Nc1ccc(F)cc1	726614472	QZBFVCNIPZHQRV-UHFFFAOYSA-N	436.465	1.221	50	20	IDGD	
CCOC(=O)c1ccc(Br)c(S(=O)(=O)NNC(=O)c2cnccn2)c1	728503787	CMHHURGOXWVGBB-UHFFFAOYSA-N	429.252	1.039	50	20	IDGD	
O=C(CNS(=O)(=O)c1cccs1)NNC(=O)c1cc(F)ccc1Br	728548497	FWZLJXZNVWODMS-UHFFFAOYSA-N	436.284	1.389	50	20	IDGD	
CN1CCN(C(=O)CCNC(=O)NNC(=O)c2ccc(Br)cc2Cl)CC1	729047597	SRXGNAQCZMYBAB-UHFFFAOYSA-N	446.733	1.211	50	20	IDGD	
COCCOCC(=O)NC1CCC(C(=O)NNC(=O)Cn2ccc3ccccc32)CC1	729451793	DIXYWJCGJRMUII-UHFFFAOYSA-N	430.505	1.127	50	20	IDGD	
CC(=O)c1cccc(S(=O)(=O)NCCC(=O)NNC(=O)Cn2ccc3ccccc32)c1	729541326	MUGZQGQNZGLIOZ-UHFFFAOYSA-N	442.497	1.360	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)NCc2ccc(CN3CCC(O)CC3)cc2)c1	729621359	IVZXHBPTJSXXFF-UHFFFAOYSA-N	442.516	1.805	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)CSc3nnnn3CC(F)(F)F)cc2C1	729966820	SJGPZVBUSPNUEL-QMMMGPOBSA-N	434.469	1.975	50	20	IDGD	
C[C@@H](CN1CCN(C)CC1)NC(=O)NNC(=O)c1ccc(Br)cc1Cl	730132659	XTCVOJRPADNOMM-NSHDSACASA-N	432.750	1.682	50	20	IDGD	
O=C(NNC(=O)c1ccn(-c2ccc(Cl)c(Cl)c2)n1)N[C@H]1CCS(=O)(=O)C1	730212717	JIHSGKGZWGJOSF-VIFPVBQESA-N	432.289	1.310	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)NCc2nnnn2-c2ccccc2)cc1OC	730582126	IHIFQIMJCUDEQL-UHFFFAOYSA-N	425.449	1.604	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)NCC1(c2ccc3c(c2)OCO3)CCOCC1	730824535	IMPDAGSUTDDLPC-UHFFFAOYSA-N	443.456	1.579	50	20	IDGD	
CCc1nc(CN2CCN(C(=O)/C(C#N)=C/c3cc(C)n(CCOC)c3C)CC2)no1	732087733	CGGWXXVYAYTTSD-CPNJWEJPSA-N	426.521	1.948	50	20	IDGD	
COc1cc(OC)c2cc(C(=O)NNC(=O)CCN3C[C@H](C)O[C@H](C)C3)[nH]c2c1OC	732260570	GGZMNDFCROQMGV-BETUJISGSA-N	434.493	1.454	50	20	IDGD	
Cc1nc(S(=O)(=O)N2CCC(C(=O)NNc3nccc4sccc34)CC2)cn1C	734250359	SYDDUXBHQZYDJM-UHFFFAOYSA-N	434.547	1.882	50	20	IDGD	
CN1CCC(N2CC[C@H](NC(=O)NNC(=O)c3cc(F)ccc3Br)C2)CC1	734284449	VJGPGOQYKQGRSP-ZDUSSCGKSA-N	442.333	1.701	50	20	IDGD	
C[C@H](CN1CCN(c2ccccn2)CC1)NC(=O)NNC(=O)c1cccc(N(C)C)c1	735519071	PNEPDNBXOURSIH-QGZVFWFLSA-N	425.537	1.302	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)N[C@@H](C)CN2CCN(c3ccccn3)CC2)cc1	735585766	HXEPTOYFBCWOFX-SFHVURJKSA-N	426.521	1.310	50	20	IDGD	
CCn1c(NNC(=O)c2ccc3c(c2)CCN3C(=O)CNC(C)=O)nc2ccccc2c1=O	735651121	SPDXOZVANDFERN-UHFFFAOYSA-N	448.483	1.199	50	20	IDGD	
COc1ccc(C(=O)NNc2c(F)cccc2F)cc1S(=O)(=O)N1CCOCC1	735692978	VTMCAAYHTGJZQX-UHFFFAOYSA-N	427.429	1.751	50	20	IDGD	
C[C@@H]1OC(C)(C)N(C(=O)OC(C)(C)C)[C@@H]1C(=O)NNC(=O)[C@H]1COc2ccccc2O1	735837506	OYLXUCAJUYHXCE-MAZHCROVSA-N	435.477	1.734	50	20	IDGD	
CN(CC(=O)NNC(=O)c1ccccc1)C[C@@H](O)COc1ccccc1C(F)(F)F	741800020	SBQFUOWASKVZFU-OAHLLOKOSA-N	425.407	1.838	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN(C(=O)c2ccc(Br)c(F)c2)C1)NC1CC1	742053909	UULCNZIHHGTSEY-NSHDSACASA-N	427.274	1.933	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)c2ccc(C[C@H]3CC(=O)NC3=O)cc2)o1	742246940	IRZGVIJSBSIGMM-INIZCTEOSA-N	426.473	1.401	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@H](C)n2nnc(-c3ccccc3)n2)c2ccccc2c1=O	742473947	LNMCOJDZFOYXKF-ZDUSSCGKSA-N	432.444	1.092	50	20	IDGD	
O=C(CCN1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O)NNc1nc(-c2ccc(Cl)cc2)no1	742668639	AUCTYRWQSUPYKS-GBOPCIDUSA-N	431.836	1.386	50	20	IDGD	
COC(=O)c1ccc(S(=O)(=O)NNC(=O)NCc2ccco2)c(Br)c1	743255843	JNLSETARRHYWDS-UHFFFAOYSA-N	432.252	1.521	50	20	IDGD	
Cc1cc(S(=O)(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)ccc1Br	743268419	QLISPVALAZJVFZ-UHFFFAOYSA-N	430.236	1.995	50	20	IDGD	
O=C(NCc1cccc([N+](=O)[O-])c1)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	743346560	DQTVJRPDYLQPTN-UHFFFAOYSA-N	447.473	1.524	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)CN2CCC[C@H](C(=O)Nc3ccc(Cl)cn3)C2)cc1	744389563	VWKNOJMBQDDSIP-INIZCTEOSA-N	440.891	1.718	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1)[C@H]1CCOC1	745860858	FGKJHGYFIWZORS-KXBFYZLASA-N	435.488	1.757	50	20	IDGD	
NC(=O)c1nccnc1C(=O)NNC(=O)c1cn(-c2ccccc2)nc1-c1ccccc1	746105979	DNXGENLWLPCPTD-UHFFFAOYSA-N	427.424	1.503	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCCOc2ncccc2C(F)(F)F)c1	746796195	PUJGCNQYUBTWGZ-UHFFFAOYSA-N	446.407	1.527	50	20	IDGD	
Cc1c(CC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)cccc1[N+](=O)[O-]	748624766	ZWPLSKSLKPOEST-UHFFFAOYSA-N	447.517	1.525	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)NCC(=O)N(C)C2CCCCC2)c2ccccc2c1=O	748666226	IHNFGYCVTNPXQG-UHFFFAOYSA-N	442.520	1.713	50	20	IDGD	
NS(=O)(=O)c1cccc(N2C[C@H](C(=O)NNc3ccc(Cl)c(F)c3)CC2=O)c1	748899084	TYGVYBYZYOYXJI-SNVBAGLBSA-N	426.857	1.623	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)[C@@H]2CCCN2C(=O)c2ccc3c(c2)OCO3)cc1	749561417	JYSAZTKJDUPHFT-KRWDZBQOSA-N	436.424	1.118	50	20	IDGD	
O=C(CN1CCN(C(=O)NNC(=O)c2cc3ccccc3o2)CC1)NC1CCCCC1	750288404	HVKFCQPPSVMHSA-UHFFFAOYSA-N	427.505	1.854	50	20	IDGD	
C[C@H]1CN(Cc2ccc(C(=O)NNC(=O)CNC(=O)c3cccs3)cc2)C[C@H](C)O1	751208846	IFZMSQMTHHHAJC-GJZGRUSLSA-N	430.530	1.548	50	20	IDGD	
CCOCCCn1c(NNC(=O)CNC(=O)C2CCCCC2)nc2ccccc2c1=O	752037171	AXCQGSBDYTUIGK-UHFFFAOYSA-N	429.521	1.963	50	20	IDGD	
COc1cc(OC)cc(-n2nnnc2CN(C)C(=O)/C(C#N)=C\c2cc(C#N)n(C)c2C)c1	752763911	YVXNQDISCLRFBC-SOFYXZRVSA-N	446.471	1.764	50	20	IDGD	
COc1cccc([C@@H](C)CC(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1	753540218	VUCGZZODIKDKBR-IFXJQAMLSA-N	428.441	1.719	50	20	IDGD	
O=C(NCCN1C(=O)[C@@H]2[C@@H](C1=O)[C@H]1C=C[C@H]2C1)NNC(=O)c1cccc(OC(F)F)c1	755151560	YOHYVXKMPDCJNO-GVARAGBVSA-N	434.399	1.039	50	20	IDGD	
O=C(NN=Cc1c[nH]nc1-c1ccccc1)c1cccc(S(=O)(=O)N2CCOCC2)c1	755466618	ITZPIJGBOKQKRJ-UHFFFAOYSA-N	439.497	1.862	50	20	IDGD	
CCCC[C@@H](NC(=O)[C@@H](C)NC(=O)C(C)(C)C)C(=O)NNC(=O)c1ccc(C)cc1O	755694391	KISJZXMQNIWEPW-GDBMZVCRSA-N	434.537	1.687	50	20	IDGD	
C[C@@H]1CN(c2ccc(NC(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)cn2)C[C@@H](C)O1	755865360	RDPFFRSDGSPOFL-ZIAGYGMSSA-N	437.464	1.137	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)Nc1cc(N2CCCS2(=O)=O)ccc1F	756154270	FIJYTNCAYKWALJ-UHFFFAOYSA-N	440.428	1.736	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)Nc2ccc(N3CCN(S(C)(=O)=O)CC3)nc2)cc1	756547691	GJSRLVCXMMTXCL-UHFFFAOYSA-N	446.533	1.192	50	20	IDGD	
COC(=O)c1ccc(NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1C(=O)OC	756819686	UZLPMSXWBKYUII-UHFFFAOYSA-N	449.441	1.130	50	20	IDGD	
COc1ccccc1N1CC[C@@H](NC(=O)NNC(=O)Nc2ccc(N(C)C)cc2)C1=O	757286122	LHKAGRYOGKLNEQ-MRXNPFEDSA-N	426.477	1.902	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)NCc2ccc3c(c2)CCS3(=O)=O)c1C	757750962	JINFABKCODDGAC-OAHLLOKOSA-N	431.514	1.931	50	20	IDGD	
NC(=O)[C@H](Cc1ccccc1)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	758138594	NPGOEKZWLGRPDM-IBGZPJMESA-N	430.530	1.192	50	20	IDGD	
CN(NC(=O)c1cc(F)cc([N+](=O)[O-])c1N)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758782029	LEPXMOXWTCJPGT-UHFFFAOYSA-N	440.432	1.565	50	20	IDGD	
Cc1ccc(CNC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c(O[C@H]2CCOC2)c1	758834808	RXEXXXQPIFHRAG-SFHVURJKSA-N	437.460	1.283	50	20	IDGD	
Cc1cc(S(C)(=O)=O)cc(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1C	759019689	ITRXMTYCXDNVPB-UHFFFAOYSA-N	431.518	1.175	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)c2cnc(OCc3ccccc3)cn2)cc1	759045362	ZXISLBMOJDGKHO-UHFFFAOYSA-N	431.408	1.545	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1ccnn1-c1cc(C)ccn1	760319482	DHADCPVLLBAPBJ-UHFFFAOYSA-N	444.473	1.070	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)Nc1ccc(CN2C(=O)CCCC2=O)cc1	760955354	ZGOMFWRKRBEMGS-GOSISDBHSA-N	438.440	1.718	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)c1cc(F)ccc1NS(C)(=O)=O	762407288	BJQTYEOSUYKMIS-UHFFFAOYSA-N	427.479	1.759	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)cnn1-c1ccccc1F	763572706	URQJPFUNYWSUMR-GOSISDBHSA-N	439.403	1.246	50	20	IDGD	
Cc1ccc(Cn2nccc2NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)s1	763577029	GDUHTTPTRFSSBX-INIZCTEOSA-N	441.469	1.227	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)[nH]n1)C(=O)Nc1cc(C(F)(F)F)cnc1O	763605406	SAZMWQJGJBRHQP-UHFFFAOYSA-N	434.334	1.596	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2ccc(C)nc2Br)c1	763644815	NDKZAVAMCASGGP-UHFFFAOYSA-N	435.278	1.934	50	20	IDGD	
CC[C@@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(OC)cc2)cc1	763660852	HUVIOKGIOZRCEM-CQSZACIVSA-N	442.472	1.388	50	20	IDGD	
Cc1nc(Br)ccc1NC(=O)C(=O)NNC(=O)COc1ccc(C#N)cc1	763682641	YLOWORDRTSLUCX-UHFFFAOYSA-N	432.234	1.189	50	20	IDGD	
CS(=O)(=O)NCc1ccc(NC(=O)C(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)cc1	763736764	YSKLODDJJGJPCV-UHFFFAOYSA-N	448.545	1.038	50	20	IDGD	
CCOC(=O)N(C)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(OC)cc(OC)c2)cc1	763772929	QKDCMLGUJYUQKF-UHFFFAOYSA-N	444.444	1.696	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc1F	763797122	QQHUUWMAKMXBCF-UHFFFAOYSA-N	448.476	1.318	50	20	IDGD	
CC(C)(C)c1ccc(C(=O)NCCC(=O)NNC(=O)CNC(=O)c2cccnc2)cc1	763819677	FGFSKWKZLIBMBT-UHFFFAOYSA-N	425.489	1.076	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cnn(Cc3ccncc3)c2)c1C	763849742	MQLRPXADIKOAOB-MRXNPFEDSA-N	436.472	1.497	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cnn(CC(F)(F)F)c2)cc1	763861210	MTINUOWRPREUFB-LLVKDONJSA-N	443.382	1.398	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(C)[nH]c2C(=O)OC)cc1OC	763910314	DGNOOEMHRLEQNH-UHFFFAOYSA-N	432.433	1.307	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)c2ccc(Cl)nc2)sc2c1CCC2	764097609	GBYYHVGSZFCUKX-UHFFFAOYSA-N	436.877	1.862	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(-n3cccn3)nc2)o1	764139136	NXTGGZAEVGQAHL-UHFFFAOYSA-N	425.449	1.102	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2O1)C(=O)Nc1cccc(-c2noc(C3CC3)n2)c1	764169055	SPMNCBFIBWKJNM-QGZVFWFLSA-N	433.424	1.704	50	20	IDGD	
CN1CCC/C1=N/S(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)CC(C)(C)C)cc1	764197461	ABCVIWWGHDUNOM-HAHDFKILSA-N	437.522	1.022	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)C(=O)Nc1nnc(C(C)(C)C)s1	764203805	FXEVEWYAABRQIB-UHFFFAOYSA-N	428.515	1.226	50	20	IDGD	
CCN1CCN(c2ccc(NC(=O)C(=O)NNC(=O)c3cccc(C#N)c3)c(C)c2)CC1	764236769	FTJMHAHFLBTMRO-UHFFFAOYSA-N	434.500	1.408	50	20	IDGD	
O=C(Cc1ccccn1)NNC(=O)C(=O)Nc1cccc(C[S@@](=O)c2ccccc2)c1	764267982	XSTKKBQZJSBZHR-WJOKGBTCSA-N	436.493	1.718	50	20	IDGD	
C[C@@H]1CN(c2ccccc2NC(=O)C(=O)NNC(=O)Cc2ccccc2F)C[C@@H](C)O1	764320022	WDCZKWNKEBSOSH-HUUCEWRRSA-N	428.464	1.768	50	20	IDGD	
CCOc1ncccc1NC(=O)C(=O)NNC(=O)c1ccc(OC)c(Br)c1	764327023	TXGKKLAGKAIEHW-UHFFFAOYSA-N	437.250	1.651	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)N2CCc3c(F)cccc32)cc1Br	764327302	WZUGOXCAYVGQJW-UHFFFAOYSA-N	436.237	1.947	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)C(=O)Nc1cc(F)cc(N2CCOCC2)c1	764404306	HTLZASMLOLDBSM-UHFFFAOYSA-N	448.476	1.246	50	20	IDGD	
O=C(CCC(=O)N1CCN(c2ccccc2)CC1)NNC(=O)Cn1cnc2ccccc21	764534002	OAPHLFAFFJUMAO-UHFFFAOYSA-N	434.500	1.313	50	20	IDGD	
Cc1ncc(CO)c(C=NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)c1O	764831890	QYUCVKHMLURJBR-UHFFFAOYSA-N	431.924	1.509	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)CCOc3cccc(C=O)c3)CC2)cc1	766650491	UTLCOQIQDZTLTL-UHFFFAOYSA-N	438.528	1.542	50	20	IDGD	
CC(C)N1CCC(C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)CC1	766663697	LYRYHAXONKNFFZ-UHFFFAOYSA-N	436.000	1.725	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)[C@@H]2CN(Cc3ccccc3)CCO2)n[nH]1	768273262	BIUQUPVWVPUXQU-NRFANRHFSA-N	435.484	1.747	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)[C@H](c1cccc(F)c1)N1CCOCC1	768634026	BABPCJZMJHJICJ-IBGZPJMESA-N	437.493	1.754	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2nnn(Cc3ccc(F)cc3)c2C)n1	769556981	FNRHSTGXFDRSAL-UHFFFAOYSA-N	446.464	1.086	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)C(C)(C)N1C(=O)c2ccccc2C1=O	770640671	AVXIEWYUDDSJOT-UHFFFAOYSA-N	437.452	1.303	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)NNC(=O)Cc1cn2ccccc2n1	770649599	PWKGNUKIASDURC-LBPRGKRZSA-N	430.852	1.359	50	20	IDGD	
Cc1cc2c(N3CCC[C@@H]3C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)ncnc2s1	770747395	FLVUZPGIDCXEDE-MRXNPFEDSA-N	449.500	1.405	50	20	IDGD	
COc1ccc(NNC(=O)CN2C(=O)N[C@](C)(c3ccccc3OC)C2=O)c([N+](=O)[O-])c1	771273330	LXTMPDSYCUDFTJ-HXUWFJFHSA-N	443.416	1.522	50	20	IDGD	
CN(C)c1nccc(NNC(=O)CN2C(=O)N[C@](C)(c3ccc(F)c(Cl)c3)C2=O)n1	771737981	WKVPMKAZJZBTDY-GOSISDBHSA-N	435.847	1.245	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Nc2ccc(-c3ncn(C)n3)cc2)cc(OC)c1OC	771779915	GNBWTHAIVUJDPR-UHFFFAOYSA-N	426.433	1.974	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)CN(C)C(=O)c1ccc(Br)s1	772036219	IIDPSPWWTJUVCR-SNVBAGLBSA-N	448.339	1.708	50	20	IDGD	
COc1ccc(COCCNC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc1	772053071	XYWIELZYAGWEJI-UHFFFAOYSA-N	425.445	1.747	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1)n1nnc(-c2ccccc2)n1	772195367	KPYJUUGEVFTYAV-LBPRGKRZSA-N	427.852	1.018	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])c1	773082516	YENJNBDRTUSUNK-UHFFFAOYSA-N	441.322	1.964	50	20	IDGD	
CC(C)(C)OC(=O)NC1(C(=O)NNC(=O)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)CC1	773411639	OYSRSZRDYWKNKQ-CYBMUJFWSA-N	426.514	1.838	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)CCC(=O)N2CC1CC1	773499046	HGJWXNDKPUIDFN-UHFFFAOYSA-N	436.468	1.784	50	20	IDGD	
O=C(Cc1ccsc1)NNC(=O)C(=O)Nc1ccc2c(c1)CCC(=O)N2CC1CC1	773499835	LZRHXHUHWMPPJP-UHFFFAOYSA-N	426.498	1.766	50	20	IDGD	
O=C1CC(=O)N(c2ccc(F)cc2)N=C1C(=O)NNC(=O)C12CC3CC(CC(C3)C1)C2	773710365	PBXRLIBTKZROSK-UHFFFAOYSA-N	426.448	1.851	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1cc2c(cc1F)CCC(=O)N2	774010213	WIBJDDYAPIGJFW-SNVBAGLBSA-N	448.838	1.917	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)Nc2ccc(C[C@H]3NC(=O)NC3=O)cc2)c1C	775706851	JAIQBSJRHWXTGT-RHSMWYFYSA-N	439.472	1.674	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)NC2CCN(S(=O)(=O)C(F)(F)F)CC2)c1	776627170	GDZKQHRYJJJIBR-UHFFFAOYSA-N	444.457	1.030	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)[C@@H]1CCN(Cc2ccccc2)C1	779413645	UDXXBQIZRFRKHG-SJLPKXTDSA-N	448.527	1.788	50	20	IDGD	
CC(C)(C)OC(=O)N1CC=C(CNC(=O)NNC(=O)c2nnc(O)c3ccccc23)CC1	779679412	GKNHNCSVSFUCCR-UHFFFAOYSA-N	442.476	1.847	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)CCc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])nc2ccccc21	781662296	GJHWMGBSZSXEFR-UHFFFAOYSA-N	426.389	1.712	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)cc1)C(=O)Nc1ccn(-c2ncccc2C(F)(F)F)n1	782833275	DWJFNCHWGMCCCC-UHFFFAOYSA-N	434.334	1.391	50	20	IDGD	
CN(Cc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(O)cc2)c1)Cc1cscn1	782837686	PIULUXOQJXAVQP-UHFFFAOYSA-N	439.497	1.880	50	20	IDGD	
CCOC(=O)c1cn(C)nc1NC(=O)C(=O)NNc1ccc(Br)cc1F	783086198	MDWATTHJENEKSO-UHFFFAOYSA-N	428.218	1.580	50	20	IDGD	
CC[C@H](C)n1nc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)cc1C	783259274	XPCGWJKTZCPRJW-LBPRGKRZSA-N	437.526	1.326	50	20	IDGD	
C[C@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(NC(=O)C(=O)NN=c3cc[nH]cc3)cc2)C1	783379164	XICRXKORJWXZKR-GASCZTMLSA-N	431.518	1.252	50	20	IDGD	
Cc1ccc(COc2cccc(NC(=O)C(=O)NN[C@@]3(C)CCS(=O)(=O)C3)c2)cc1	783426502	MFALSQSCUTUDBI-NRFANRHFSA-N	431.514	1.711	50	20	IDGD	
COC(=O)c1cc(Br)ccc1NC(=O)C(=O)NNc1nccnc1Cl	784777776	KWQDKUFLLYHWQR-UHFFFAOYSA-N	428.630	1.761	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)F)cc1)C(=O)Nc1cnn(-c2ccccc2)c1	784833934	UBDVXSOLYGVEIC-UHFFFAOYSA-N	435.412	1.950	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)C(=O)Nc2ccc(NS(C)(=O)=O)c(Cl)c2)c1	784853263	CIEPHHVISBUJDD-UHFFFAOYSA-N	440.865	1.580	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)c2nccnc2Sc2ccccc2)c2ccccc2c1=O	785013788	LEXAASUXPSCQAC-UHFFFAOYSA-N	432.465	1.950	50	20	IDGD	
CN(NC(=O)Nc1ccc2c(c1)C(=O)NCC2)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	785853459	RUXLWHYKPAXVCU-UHFFFAOYSA-N	446.508	1.614	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)c3occc3C(C)C)CC2)cc1	786390199	HPWJONHEGGECFZ-UHFFFAOYSA-N	448.545	1.479	50	20	IDGD	
Cc1ccc(CNC(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)c(-n2cc(Cl)cn2)n1	786836126	WUOMEWXWZQHKIC-UHFFFAOYSA-N	445.823	1.987	50	20	IDGD	
Cn1cc(-c2ccc(NC(=O)NNC(=O)CCN3CCN(c4ccccc4)CC3)nn2)cn1	788790788	XVGRBKAURYEYSA-UHFFFAOYSA-N	449.519	1.242	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)c1nnn(Cc2ccc(F)cc2F)c1C	790213866	CTOCLESJMOJOFR-UHFFFAOYSA-N	425.399	1.944	50	20	IDGD	
CCN(CC)C(=O)CN1CCN(C(=O)/C(C#N)=C\c2cc(C)n(CCOC)c2C)CC1	790533199	QUQVLEJYGWSYAC-QNGOZBTKSA-N	429.565	1.671	50	20	IDGD	
O=C(CNC(=O)NNc1ncncc1Cl)Nc1ccc(I)cc1	790891311	QIMLVCRPWZIQKK-UHFFFAOYSA-N	446.636	1.999	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)[C@@](C)(O)Cn2cc(C(F)(F)F)ccc2=O)cc1	792629138	OEIHHLPVMIXWBC-SFHVURJKSA-N	426.395	1.186	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NC(=O)NNC(=O)c2cccc(Br)c2)nc1	797653067	BJJAPPQAMZJGSK-UHFFFAOYSA-N	442.295	1.561	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccc(F)c(N3CCOC3=O)c2)c1	797659032	TWAQJTWSPJHBIA-UHFFFAOYSA-N	436.421	1.652	50	20	IDGD	
C=CCNC(=S)NNC(=O)CCCN1C(=O)c2ccc(Br)cc2C1=O	798304940	OIUOMGLUDZGFIA-UHFFFAOYSA-N	425.308	1.507	50	20	IDGD	
CCN=c1nc(NCC)n2c(SCC(=O)NNC(=O)Nc3ccccc3C)n[nH]c2n1	798312942	NPSVUWSTQKEISI-UHFFFAOYSA-N	444.525	1.058	50	20	IDGD	
CC(C)[C@@H](NC(=O)c1ccc(Cl)s1)C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	801106138	ZHTKIHUNINNXRI-OAHLLOKOSA-N	447.908	1.593	50	20	IDGD	
COCc1nnc(-c2cccc(C(=O)NNC(=O)Nc3ccc(S(C)(=O)=O)cc3)c2)o1	802064227	JREXHKFIRGENOT-UHFFFAOYSA-N	445.457	1.753	50	20	IDGD	
O=C(CNS(=O)(=O)c1c[nH]c2ncccc12)NNc1ccc(OC(F)(F)F)cc1	802829163	NSVWAYAFRPUISU-UHFFFAOYSA-N	429.380	1.883	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(C)c(C(=O)NNc2ccc3c(=O)[nH]ccc3c2)c1	803434959	DVVHGCRWEYDMFK-UHFFFAOYSA-N	430.486	1.518	50	20	IDGD	
CC(=O)Nc1ncc(S(=O)(=O)NNC(=O)c2ccc(Br)s2)s1	808069623	CEJYJRLJEKXQJJ-UHFFFAOYSA-N	425.311	1.549	50	20	IDGD	
CC(C)CNC(=O)N1CCC[C@H](CC(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)C1	812732966	WPJSSHKTKCFBCO-MRXNPFEDSA-N	439.582	1.848	50	20	IDGD	
CC(C)N(C)c1cccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)c1	813033750	JVAFYGDYLFDGAV-UHFFFAOYSA-N	433.534	1.863	50	20	IDGD	
CC(Cc1ccc(Br)cc1)=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O	814785557	WROKCNXIAZJSSR-UHFFFAOYSA-N	440.323	1.068	50	20	IDGD	
O=C(CNC1(Cc2cccc(F)c2)CCOCC1)NNC(=O)c1cccc([N+](=O)[O-])c1	815153570	RNVDHAXTPRUGHN-UHFFFAOYSA-N	430.436	1.876	50	20	IDGD	
N#Cc1cc(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)ccc1Br	815607736	HIDRSUIRQIONBH-UHFFFAOYSA-N	441.245	1.297	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)C(=O)Nc2c3c(nn2C)CCC3)c1	815865919	JGGKUGSGMVCLJU-UHFFFAOYSA-N	436.266	1.540	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)c2cc(S(C)(=O)=O)ncc2Cl)c1C	816821375	XRGPKAPFDDFTRO-GFCCVEGCSA-N	425.894	1.984	50	20	IDGD	
CS(=O)(=O)C[C@H](C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1)c1ccccc1	816915869	NNWXFSGCTHOXDB-SFHVURJKSA-N	437.543	1.399	50	20	IDGD	
O=C(O)c1cc(C(=O)O)cc(S(=O)(=O)NNC(=O)c2ccc(Br)s2)c1	832095347	ZSBKMFRACBXHKA-UHFFFAOYSA-N	449.260	1.530	50	20	IDGD	
O=C(NN=Cc1c[nH]nc1-c1ccc2c(c1)OCCO2)c1csc(N2CCOCC2)n1	839398955	GYICYRISGKMPHI-UHFFFAOYSA-N	440.485	1.905	50	20	IDGD	
COCc1c(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)oc2ccccc12	849206868	BBOTYROCLCTDOJ-SFHVURJKSA-N	440.408	1.723	50	20	IDGD	
COC(=O)Nc1ccc(C(=O)OCC(=O)NNC(=O)c2ccc(OC)c(OC)c2)cc1	913305760	JCYMKVXBXCXBFQ-UHFFFAOYSA-N	431.401	1.500	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CNS(=O)(=O)c2c(C)c(C)cc(C)c2C)cc1OC	913415736	YKKMGJOHGOGBKT-UHFFFAOYSA-N	449.529	1.677	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc2c(c1)OCCCO2)NNC(=O)NC1CCCCC1	913450828	BYKIGTKUAOZTLA-UHFFFAOYSA-N	440.522	1.179	50	20	IDGD	
Cc1ccc(C)c2c1NC(=O)C2=NNC(=O)C(=O)NN=C1C(=O)Nc2c(C)ccc(C)c21	914772142	KWMNWJVWSPCFSD-UHFFFAOYSA-N	432.440	1.165	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)[C@@H]2CCCN(S(=O)(=O)c3ccccc3)C2)c1	915059791	VAWKUQHJRXZGBS-QGZVFWFLSA-N	431.514	1.622	50	20	IDGD	
Cc1nnnn1[C@H](Cc1ccc(F)cc1)C(=O)NNC(=O)[C@@H](C)Oc1ccccc1F	915697801	YHBVUZTXOBYFKI-SJKOYZFVSA-N	430.415	1.658	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NC2CCN(Cc3ccccn3)CC2)nc1	916382368	MLNFATQNMKUDRS-UHFFFAOYSA-N	447.565	1.454	50	20	IDGD	
C[C@H](Cc1cccs1)NC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	916509591	JJMGIGXPWMHWHM-CQSZACIVSA-N	438.579	1.337	50	20	IDGD	
Nc1cc(C(F)(F)F)ccc1C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	916539936	BTBZSRVKPYAYLH-OAHLLOKOSA-N	439.346	1.432	50	20	IDGD	
CCCCS(=O)(=O)N1CCC[C@H]1C(=O)NNC(=O)c1ccc(OCCC)c(OC)c1	918690135	NPTPRPAXNSECDM-INIZCTEOSA-N	441.550	1.839	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)N=c2cc[nH]cc2)c1	919896763	HURKWWRBHNQBOP-UHFFFAOYSA-N	441.469	1.779	50	20	IDGD	
COC(=O)N1CCC(NC(=O)NNC(=O)[C@H](C)Oc2cccc(Br)c2)CC1	920052103	YGBDAEHIZFQIOM-NSHDSACASA-N	443.298	1.778	50	20	IDGD	
CCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccc3c(c2)OCO3)c1	921042975	YBMSQJGBXOXUKN-UHFFFAOYSA-N	434.474	1.248	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2cc(Br)cs2)ccc1Cl	921302177	PZUCUKFQOMZLKZ-UHFFFAOYSA-N	438.712	1.886	50	20	IDGD	
Cc1ccc(Cn2ncc3c(C(=O)NNC(=O)[C@H]4CCS(=O)(=O)C4)cc(C)nc32)cc1	1115817514	JCUAXIMHMALYRJ-INIZCTEOSA-N	441.513	1.292	50	20	IDGD	
Cc1noc(-c2ccc(C(=O)NNc3ccccc3S(=O)(=O)N3CCOCC3)cc2)n1	1116166619	JTQLUCIHGQEBGP-UHFFFAOYSA-N	443.485	1.823	50	20	IDGD	
CN(C)C(=O)CS(=O)(=O)c1ccc(C(=O)NNc2cncc(Br)c2)cc1	1324494272	RFRZIBOIEASAJM-UHFFFAOYSA-N	441.307	1.463	50	20	IDGD	
CC(C)CNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cncn2-c2ccccc2)cc1	1337308943	CBXYUDJPWXHGGB-UHFFFAOYSA-N	441.513	1.881	50	20	IDGD	
CCOc1ccc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](Br)CC)CCO3)nn1	1780429099	BLAOIGRGRLXJMO-UGSOOPFHSA-N	441.326	1.492	50	20	IDGD	
C[C@@H](Cn1cncn1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Br)C1	1780774480	BFYATOPDQYZIJO-ZOMKSWQUSA-N	446.321	1.119	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)CN3CCc4sccc4C3)CCO2)C1	1781215428	PSFCHDWFJFPHBG-OXJNMPFZSA-N	425.982	1.954	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(CS(C)(=O)=O)nc3)CCO2)C1	1781219637	WHRWJGZLYHZLOH-LPHOPBHVSA-N	443.953	1.087	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)Cc3cnc4ccccn34)CCO2)C1	1781225497	KSFUFVPGWKXCKO-VQTJNVASSA-N	439.343	1.943	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)C3(Br)CC3)C2)C1	1781347895	NLYFKZHSTWDMQJ-RISCZKNCSA-N	438.160	1.917	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(O)c([N+](=O)[O-])c3)C2)C1	1781543944	VYAMKKJRGCTXOT-APPDUMDISA-N	442.266	1.527	50	20	IDGD	
CCOC(=O)/C=C/C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)Br)C1	1781996746	STOIUYVZQMIXMK-ZBUBLZPGSA-N	431.327	1.403	50	20	IDGD	
Cc1nnsc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)Br)C1	1781999143	RFVYAAQMZXRPAM-KANYHAFZSA-N	431.356	1.757	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(F)cc1)C2	1782212287	PHHAAPKRUZJNSY-XMSQKQJNSA-N	434.512	1.326	50	20	IDGD	
O=C(c1cc[nH]n1)N1CCO[C@]2(CCN(C(=O)[C@@H](Br)Cc3ccccc3)C2)C1	1783018198	IYFPZSIFBXHETF-JXFKEZNVSA-N	447.333	1.859	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ncc(OC)cc3F)CCO2)C1	1783344553	RGIUBECHDNHGLL-ACJLOTCBSA-N	444.301	1.846	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)/C=N/N3CCCCC3)CCO2)C1	1783348827	BIVHKBHUGLQLKO-RLTHDXANSA-N	429.359	1.462	50	20	IDGD	
O=C(CCc1c[nH]c2ccc(F)cc12)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1783671666	IFENAUYXNRPZLS-RXVVDRJESA-N	437.899	1.669	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)CCc3cccc(OC)n3)CCO2)C1	1783873500	PTLUFVHDDPLOIB-OXJNMPFZSA-N	425.913	1.107	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3cnccn3)C[C@@H]21	1783973476	BHXFTMBWFHUJMN-OTRWWLKZSA-N	439.354	1.420	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CNc3ccc(F)cc3)[C@H]2C1	1786813682	DNTGMZUXUBVWFJ-RUGDWHBFSA-N	427.904	1.471	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(C)(C)NCCC#N)[C@H]2C1	1786859783	GZAGDVKTTLCNAE-QPSCCSFWSA-N	429.359	1.031	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)c1cn2ccsc2n1	1788391407	JKFKDNQEWGMGAH-UKJIMTQDSA-N	445.314	1.680	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnn4cccnc34)C[C@@H]21	1788764701	SCAGEPNPIPGJGB-XIRDDKMYSA-N	431.569	1.174	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN(C)C(=O)c3ccccc3)C[C@@H]21	1789858400	XAHWKVRPVGUPCB-VJANTYMQSA-N	435.952	1.756	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(O)c(F)c3)C[C@@H]21)[C@H](F)Br	1789923352	HTMNHCHAJBKRTL-GVARAGBVSA-N	433.249	1.815	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nc4ccccc4[nH]3)C[C@@H]21	1791057191	HUZUPQVPJSSZSK-DVZHBHJUSA-N	435.322	1.940	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(Cl)c(Cl)cc1F)C2)[C@H](O)CCl	1792983554	OSODNADZPSSUDX-WUEYEGCSSA-N	439.698	1.935	50	20	IDGD	
CN(C)c1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCBr)nc1	1795112334	AGKKJDLRDIMDOF-FVCICTRLSA-N	425.327	1.136	50	20	IDGD	
CN(CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CC1CC1)NC(=O)NCc1ccccc1	1795771510	PNJRJKPHJMWEHZ-ACDBMABISA-N	427.549	1.771	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1nc2ccccc2n(C)c1=O	1796998405	VTDULRKUSAUXHX-UMPJEAMMSA-N	432.908	1.154	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CO[Si](C)(C)C	1797956761	YGZXFJKPTMBHBR-FSNPWBFUSA-N	438.597	1.183	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(C(C)(C)C)n[nH]1	1798134575	KTMDOVXQRUCSHW-OHTBPHCPSA-N	427.343	1.694	50	20	IDGD	
COCCOCCOCCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CO[Si](C)(C)C	1798630312	CIUMKRAYQLOMRX-BCDXTJNWSA-N	430.618	1.546	50	20	IDGD	
COc1cc(F)c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)Br)C3)c(F)c1	1799592913	BHJXLSZDXMUXNM-OJLPPKNESA-N	447.276	1.960	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc2ccnn12	1799904265	JARYTRMPUPPGPT-UESRRSCYSA-N	425.316	1.774	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)n1cccc1C=O)C2	1800639812	NRWCQYVHYWQUHL-BDLOOMQFSA-N	440.338	1.625	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1Cc3ccccc3O1)C2	1800640742	GBEBNFGPJBYWEF-DTYCBIMDSA-N	437.334	1.753	50	20	IDGD	
Cc1noc(C)c1CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)Br	1800757015	LPYCDZDLICNDTH-MJRMRKOOSA-N	428.327	1.597	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(-c2ncc[nH]2)cc1	1801820528	ZLHLGVOHLSSQAJ-MHORFTMASA-N	432.908	1.534	50	20	IDGD	
CC[C@H](NC(C)=O)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@@H]1c1cccnc1	1802549467	NOGGUPSJMVHILA-CAOSSQGBSA-N	443.317	1.693	50	20	IDGD	
CN1N=C(C(=O)N2CC[C@H](CNC(=O)C(C)(C)CCl)[C@H]2c2cccnc2)CCC1=O	1802898763	ZHOYXMGCGMLFQT-CRAIPNDOSA-N	433.940	1.961	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2c[nH]c3nccc-3c2)[C@H]1c1cccnc1)[C@@H](O)CCl	1803138425	AGWKWRCLYOJCDX-SZMVWBNQSA-N	427.892	1.829	50	20	IDGD	
Cn1nc(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](F)Br)[C@@H]2c2cccnc2)cc1O	1804898892	VSDMNTLNQJTFPP-NILFDRSVSA-N	440.273	1.531	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCCC2(CCN(C(=O)CN3CCS(=O)(=O)CC3)CC2)C1	1805256689	PUBATSYARIADJD-UHFFFAOYSA-N	448.029	1.213	50	20	IDGD	
CSCC(C)(C)C(=O)N1CCCC2(CCN(C(=O)c3cccc(B(O)O)c3)CC2)C1	1806092960	JFZUDNRHKNGDDO-UHFFFAOYSA-N	432.395	1.600	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CCc2ccc[nH]2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1	1807371084	PGVZTKJWVTUSTH-CVDCTZTESA-N	446.316	1.042	50	20	IDGD	
O=C(CC12CCCN1CCC2)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1	1808020711	BEMKTLXTVAIEBO-NSHGMRRFSA-N	434.968	1.706	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cc(O)ncn2)[C@H]1c1cccnc1)[C@@H](F)Br	1808648879	DROJTHCJUQAUSN-TUKIKUTGSA-N	438.257	1.587	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC2(CCCN(C(=O)c3cn(C)cn3)C2)CC1	1808678113	VFMDIPVCIJKUKE-PCLIKHOPSA-N	439.520	1.399	50	20	IDGD	
CN1C(=O)CC[C@H]1C(=O)NC[C@@H]1CCN(C(=O)[C@](C)(Cl)CCl)[C@H]1c1cccnc1	1808772959	HXAWCOMWXIDWRO-MZRZTIOWSA-N	441.359	1.945	50	20	IDGD	
Cc1cc(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)c[nH]1	1808774190	BQTHDJVKYBZMKB-NQIIRXRSSA-N	432.289	1.031	50	20	IDGD	
CN1CCN(CC(=O)NC[C@H]2CCN(C(=O)C(Cl)Cl)[C@@H]2c2cccnc2)CC1	1809607242	XDSUDZFEJHLYIQ-NVXWUHKLSA-N	428.364	1.139	50	20	IDGD	
Cc1cc(C(=O)N2CCC3(CCCN(C(=O)c4ccc(B(O)O)cc4)C3)CC2)cnc1C	1809969285	NXCUNCZZUSWBFF-UHFFFAOYSA-N	435.333	1.537	50	20	IDGD	
CC(C)N1CCC[C@H]1C(=O)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1	1809978256	OIYNLNSHXKOWRW-NRFANRHFSA-N	441.381	1.084	50	20	IDGD	
O=C1CCc2ccc(C(=O)N3CCCC4(CCN(C(=O)[C@@H](O)CCl)CC4)C3)nc2N1	1810474177	LNDBFYJUQIMMEU-INIZCTEOSA-N	434.924	1.411	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1CCN(C(=O)CCc2nc(N)n[nH]2)[C@H]1c1cccnc1	1810545899	HDHQNXGWNWOJPC-KXBFYZLASA-N	445.600	1.272	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H](CNC(=O)c2cc[n+]([O-])cc2)[C@H]1c1cccnc1	1811193971	QIZLFRWYVLKNIV-UYAOXDASSA-N	428.565	1.886	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)Cn2ccncc2=O)[C@H]1c1cccnc1	1812868739	LEHLSLKTFWFJJW-JOQOYGCGSA-N	448.321	1.128	50	20	IDGD	
C[C@@H](CBr)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H]2CCC(=O)N2)[nH]n1	1814780327	MBAAHPSAFUUWCZ-DMDPSCGWSA-N	426.315	1.711	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CCc2nc(NC(=O)CN)sc2C1	1814785200	HTTIRJSSGNKDIH-JTQLQIEISA-N	433.446	1.161	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)C1(F)CC1)CC2	1817283218	XQTRJNWCZBSEEG-DLDHGHKKSA-N	432.481	1.691	50	20	IDGD	
Cc1cc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@H](O)CCl)CC3)ncc1[N+](=O)[O-]	1817618545	FVMVBRNYMPBJBZ-TVQRCGJNSA-N	439.881	1.580	50	20	IDGD	
Cc1nccnc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819403390	IOAMTTDBFLWUCY-INIZCTEOSA-N	449.475	1.126	50	20	IDGD	
CC(C)O[C@@H](C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1819504102	ODJXHSSFUHJNSY-KBXCAEBGSA-N	428.298	1.209	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)C1CCCC1)CC2	1819795095	HNQTVVALAUGVML-LBPRGKRZSA-N	428.518	1.558	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccnc2C(N)=O)[nH]n1	1822186347	KYXIPJPRBHOPDP-MFKMUULPSA-N	449.309	1.993	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnc(Cl)nc2)[nH]n1	1822412183	LYGKUPGBGSUUGD-AWEZNQCLSA-N	448.915	1.532	50	20	IDGD	
O=C(N[C@@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1)c1cc(CO)on1	1823006413	FGBFNMMIQUAGHD-KSBSHMNSSA-N	433.259	1.540	50	20	IDGD	
Cc1cc(CC(=O)N2CCCC[C@@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)on1	1825017760	DXRUSBHWCMUFRC-LJQANCHMSA-N	433.553	1.518	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](OC(C)=O)C(C)C)CC2	1825999661	BTTOPAVSDNMFGT-TYNCELHUSA-N	431.942	1.897	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](C)N1C[C@H]3C[C@H]3C1)CC2	1826000272	QHADCDKHQQGOII-RGDJUOJXSA-N	426.970	1.649	50	20	IDGD	
Cc1nc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)cs1	1827050777	GBOXEVMLZBGEJI-HXUWFJFHSA-N	441.362	1.678	50	20	IDGD	
CCn1nc(C)cc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1	1827424840	SROOJRXJUYIEPN-IBGZPJMESA-N	446.596	1.818	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H](C)Br)CC1	1827567405	ULVDYIZKISRZNY-AEGPPILISA-N	431.375	1.836	50	20	IDGD	
Cc1nccn1[C@@H](C)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830370234	MUTIRDJKGJZVRI-YWZLYKJASA-N	426.945	1.474	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(F)c3)C2)C1	1830543002	GZMIPNYHDVBOLQ-IFXJQAMLSA-N	443.313	1.927	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(F)cc3)C2)C1	1830543432	RYRAWJTURKTMHY-IFXJQAMLSA-N	443.313	1.927	50	20	IDGD	
O=C(Cc1c(F)cccc1Cl)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1830720002	QQOUPWCRBRSVHV-QFBILLFUSA-N	449.306	1.078	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc4nccn34)C2)C1	1831654079	PYKPEEHDLZSFPA-KKSFZXQISA-N	434.924	1.812	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CN2CCSCC2)CC1	1831827425	XOUVIIGIPPJQJK-QZTJIDSGSA-N	432.030	1.909	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2cnc[nH]2)CC1	1832102407	MZHNRVXFLUTNNB-FNQPIQQGSA-N	430.553	1.416	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1)c1cnsn1	1833979094	PKUKWEQKFBMHKL-ZDUSSCGKSA-N	434.335	1.414	50	20	IDGD	
Cc1cscc1C(=O)N1CCOC[C@]2(CN(C(=O)CCBr)CCO2)C1	1834821398	ICCXMTFHJDIXOP-KRWDZBQOSA-N	431.352	1.912	50	20	IDGD	
CN1CCC[C@H](C(=O)N2CCC(N3CCC(NC(=O)CO[Si](C)(C)C)CC3)CC2)C1	1835836147	NTHHYLHZUQHRSY-SFHVURJKSA-N	438.689	1.751	50	20	IDGD	
COc1nc(C)ccc1C(=O)NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1835999625	WVKQHSLNJUIHFJ-GOSISDBHSA-N	438.956	1.184	50	20	IDGD	
O=C(COC1CCCCC1)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836624462	NTSJTFYYANKHOR-IBGZPJMESA-N	430.973	1.934	50	20	IDGD	
CC[C@H](C(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)N(CC)CC	1836713539	GGBKQERWXSKHJX-MOPGFXCFSA-N	432.005	1.705	50	20	IDGD	
C[C@@H](Cc1ccccn1)C(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836720347	QYYLASVGPKBWBK-OXJNMPFZSA-N	437.968	1.859	50	20	IDGD	
O=C([C@H](F)Cl)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1[C@@H]3Sc4ccccc4[C@H]31)CCO2	1837473901	XSASHSQUPQWACP-SAGLZJIZSA-N	440.924	1.865	50	20	IDGD	
Cc1ccc(CCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)CO[Si](C)(C)C)CCO3)nc1	1837710435	YWNSIGSJWGXDSQ-JOCHJYFZSA-N	449.624	1.631	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccncc3F)C2)C1	1837713289	TVCYBNKSXUWNIB-LJQANCHMSA-N	425.533	1.142	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)[C@@H]3C=CCN3)CC2)CC1	1838065901	TUPRRVNOGHAPAL-IRXDYDNUSA-N	428.371	1.687	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3noc4ccccc34)C2)C1	1839143657	CYONKMJOPQQASR-KKSFZXQISA-N	435.908	1.844	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccnc3SC)C2)C1	1839146877	ZHALLTDTGJDARC-DNVCBOLYSA-N	427.954	1.891	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(NC(C)=O)c3)C2)C1	1839148883	MNBPURZRJBWOLA-WIYYLYMNSA-N	437.924	1.732	50	20	IDGD	
Cc1noc(C)c1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2	1839151421	QWGPICPTOHBXDV-QZTJIDSGSA-N	434.320	1.598	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@]3(C)CC3(F)F)C2)C1	1839156386	NYZQHZNDEYPNOZ-PMPSAXMXSA-N	429.291	1.724	50	20	IDGD	
Cc1cncc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)c1	1839197764	IBDPWZFUEHHHHR-PBHICJAKSA-N	430.274	1.151	50	20	IDGD	
O=C(c1n[nH]c2cccc(F)c12)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1839598367	FZELCICECXXUOK-YJBOKZPZSA-N	428.823	1.306	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CC[C@@H]3CCOC3)C2)C1	1839967701	VGJGLLBYXDYSPX-GJYPPUQNSA-N	447.370	1.433	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3c(F)cccc3F)C2)C1	1840154242	QIRPUYFRRITPFG-DJJJIMSYSA-N	432.851	1.289	50	20	IDGD	
Cc1cc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)no1	1840369101	BAYUQBOAAPJSQI-ROUUACIJSA-N	434.320	1.218	50	20	IDGD	
C[C@H](Br)C(=O)N1CC2(CCCN2C(=O)[C@@H](CCO)NC(=O)OC(C)(C)C)C1	1841431952	UNZBBKKHXYKIGB-QWHCGFSZSA-N	448.358	1.249	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1cc(C(C)C)[nH]n1)C2	1843416475	PBGNRJILRAMEOQ-OEAKJJBVSA-N	425.493	1.484	50	20	IDGD	
C[C@H](NC(=O)c1ccc(F)cc1)C(=O)N1CCCC12CN(C(=O)CCBr)C2	1845002201	DXNMDJWIXLTPAH-ZDUSSCGKSA-N	440.313	1.932	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2cc3ncccc3[nH]2)C1	1845586985	CAZXZTOULYYRPD-VULFUBBASA-N	433.472	1.514	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@H]1CC13CN(C(=O)OC(C)(C)C)C3)C2	1846365020	WJCGUDGBLHVPTD-CABCVRRESA-N	441.956	1.701	50	20	IDGD	
CC(C)(C)OC(=O)N1CC2(CC[C@H](C(=O)N3CC[C@H]4[C@@H]3CCN4C(=O)[C@H](F)Cl)O2)C1	1847286804	IFLGDTMKIAETDA-XQLPTFJDSA-N	445.919	1.891	50	20	IDGD	
CN(C)C(=O)[C@H](NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)c1ccccc1	15474791	NEFIKQQNXUWJEJ-LJQANCHMSA-N	430.530	1.535	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2nc(C)n(-c3ccc(F)cc3)n2)c2ccccc2c1=O	17163645	YMAHMPPWWBEDOA-UHFFFAOYSA-N	449.446	1.910	50	20	IDGD	
O=C(Cn1cc(Br)c(=O)[nH]c1=O)NN=C(c1ccccc1)c1ccccc1	24151960	ROTNQBKZBCERBW-UHFFFAOYSA-N	427.258	1.868	50	20	IDGD	
COc1cc(C(=O)NCC(=O)NNc2nc(-c3ccncc3)no2)ccc1OC(F)F	110329050	YVKBKFJLRSYHPR-UHFFFAOYSA-N	434.359	1.615	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)c2ccc3c(c2)CCCN3S(C)(=O)=O)cc1	725906975	JNXLIRGFOWVEFF-UHFFFAOYSA-N	432.502	1.281	50	20	IDGD	
O=C(NNS(=O)(=O)c1cccc(-n2cnnn2)c1)c1cc(F)ccc1Br	728509829	PGYZWBZWYRNJMT-UHFFFAOYSA-N	441.242	1.187	50	20	IDGD	
CC(=O)NCC(=O)N1CCC[C@H]1C(=O)NNC(=O)c1sc(-c2ccccc2)nc1C	728513018	OTTJDOFMYYWTCV-HNNXBMFYSA-N	429.502	1.007	50	20	IDGD	
O=C(NCc1cccc(Cn2cccn2)c1)NNC(=O)C1CCN(c2ncccn2)CC1	728948822	GLRIKONJGRKHOA-UHFFFAOYSA-N	434.504	1.468	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2sccc2OC(F)F)cc1	729298325	BIRNODZMHBTBGT-UHFFFAOYSA-N	433.458	1.740	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@H]2CCc3ccc(C)cc32)cc1	730133001	YWCVHEVZNPKRSL-IBGZPJMESA-N	430.530	1.942	50	20	IDGD	
CC(C)(C(=O)NNC(=O)c1sccc1S(=O)(=O)N1CCOCC1)c1ccccc1	731175975	AHPIHKXQJBAYNQ-UHFFFAOYSA-N	437.543	1.508	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])o1)c1cc(-c2ccccc2)[nH]n1	731875340	YORGFJILYGPEFR-HNNXBMFYSA-N	438.400	1.644	50	20	IDGD	
Cc1ccc(-n2c(C)cc(/C=C(\C#N)C(=O)N3CCN(S(N)(=O)=O)CC3)c2C)cc1	732065999	BUUMSPPXZZXBSR-CPNJWEJPSA-N	427.530	1.657	50	20	IDGD	
CC(C)c1ccc(-n2ccnc2SCC(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)cc1	732307847	PENIIWJSENTHLT-HNNXBMFYSA-N	436.559	1.670	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)N[C@H](Cc1ccccc1)CN1CCOCC1	732476329	FHERTJYKHPMFOZ-HXUWFJFHSA-N	437.500	1.211	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)NCCN2CCN(C(=O)C3CCCCC3)CC2)c1	733350985	IWKBECAYUXZBRH-UHFFFAOYSA-N	444.580	1.421	50	20	IDGD	
CC(C)[C@@H](CNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)NC(=O)OC(C)(C)C	734526981	JXIKWPHUWDLUBF-MRXNPFEDSA-N	449.556	1.573	50	20	IDGD	
CCCC(=O)N1CSC[C@H]1C(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	734825029	RAFQVDOWRDJCNE-AWEZNQCLSA-N	443.570	1.418	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)c2ccc3c(=O)n(CCc4ccccc4)c(S)nc3c2)cn1	735471119	PDCODPCAFSPBMG-UHFFFAOYSA-N	448.508	1.736	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)CN1C(=O)c2ccc(Br)cc2C1=O	737636409	NCDUNBMTLOVJPE-UHFFFAOYSA-N	446.257	1.409	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)N[C@H]2CCC[C@@H](S(C)(=O)=O)C2)c1	741094277	YKFJVMFXUJUNLV-CMPLNLGQSA-N	448.339	1.758	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Cc2ccn(-c3ccc(F)cc3)n2)c1	742033606	QQCBXOCGYDWWIZ-UHFFFAOYSA-N	445.476	1.265	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)Cc1ccn(-c2ccc(F)cc2)n1	742036450	KTWBXBCWJOODRO-UHFFFAOYSA-N	444.492	1.617	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCN(c2cccc(Cl)c2)C1=O)C1CCN(c2ncccn2)CC1	742067645	UEMHTOYWDVTXSR-KRWDZBQOSA-N	442.907	1.547	50	20	IDGD	
CNS(=O)(=O)c1ccc(Sc2ccccc2C(=O)NNC(=O)c2c[nH]nc2C)cc1	742647262	IXMJYSZAGOBQBN-UHFFFAOYSA-N	445.526	1.852	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NC2CCN(CC(F)(F)F)CC2)cc1	743566876	KKAAJWLAAUTUNX-UHFFFAOYSA-N	437.444	1.453	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)NC[C@](C)(O)C(C)C)cc1	743773879	MPMJIRWOKIDYBX-HZUJZGFBSA-N	439.516	1.864	50	20	IDGD	
Nc1c(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)cc(F)cc1[N+](=O)[O-]	744621164	STNQSIZQIHGEEQ-UHFFFAOYSA-N	439.425	1.094	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2ccc(F)cc2Br)cn1C	745978089	LWOSJLGZUDLCFG-UHFFFAOYSA-N	434.243	1.337	50	20	IDGD	
CS(=O)(=O)Nc1cc2ccccc2cc1C(=O)NNC(=O)Cc1cn2ccccc2n1	746544965	CRHMMCSCELTDTK-UHFFFAOYSA-N	437.481	1.863	50	20	IDGD	
COc1cc(C)nc(NNC(=O)[C@@H](CCSC)NS(=O)(=O)c2ccccc2F)n1	746631386	YYYDUGARUWNUSG-CYBMUJFWSA-N	443.526	1.476	50	20	IDGD	
CC(=NNC(=O)c1ccc(C#N)cc1)c1ccc(S(=O)(=O)NCCCC(=O)O)cc1	747051286	NZLJSVLEFXTGLL-UHFFFAOYSA-N	428.470	1.855	50	20	IDGD	
CC(C)(C)CC(=O)NCC(=O)NNc1ccc(S(=O)(=O)Nc2nccs2)cc1	747942686	JBENDTRXCOFWSU-UHFFFAOYSA-N	425.536	1.939	50	20	IDGD	
CCCCN1C(=O)CC[C@@H](C(=O)NNC(=O)C(=O)N2CCCC2)[C@H]1c1ccccc1OC	748247847	VWLAYLVLDQHWTE-YLJYHZDGSA-N	444.532	1.545	50	20	IDGD	
CC(C)(C)C(=O)Cn1cc(C(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)nn1	748520905	YHKAQDUBYIXMEQ-UHFFFAOYSA-N	433.412	1.944	50	20	IDGD	
CCCCO[C@@H]1C[C@@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)C1(C)C	748970860	POAXBLFHHCYKCQ-IAGOWNOFSA-N	440.566	1.865	50	20	IDGD	
O=C(NNC(=S)NC[C@@H]1CCOC1)c1nn(Cc2ccccc2)c(=O)c2ccccc12	749639183	NKOATIODPHBGQK-INIZCTEOSA-N	437.525	1.590	50	20	IDGD	
O=C(NNC(=O)N1CCN(c2cc(F)ccc2F)CC1)C1CCN(c2ncccn2)CC1	750275853	KVELSSFZTYXTQV-UHFFFAOYSA-N	445.474	1.534	50	20	IDGD	
COC(=O)[C@H](C)NC(=O)/C(C#N)=C/c1cn(CCC(N)=O)nc1-c1ccc(OC)cc1	751315701	KWKHFHIWOXJNAV-LERPTODRSA-N	425.445	1.019	50	20	IDGD	
COC(=O)[C@@H](NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)c1cccc(C#N)c1	751447597	ZZKBHSYCBQAYAA-IBGZPJMESA-N	442.497	1.491	50	20	IDGD	
C[C@@H](NC(=S)NNC(=O)C1CCN(C2=NS(=O)(=O)c3ccccc32)CC1)C1CC1	751619709	WQXZPGMUFMSZQE-GFCCVEGCSA-N	435.575	1.141	50	20	IDGD	
O=C(COC(=O)c1cccnc1I)NNC(=O)c1ccccc1	754941258	FTTDEKYZOCWCCJ-UHFFFAOYSA-N	425.182	1.304	50	20	IDGD	
Cc1ccc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c(Br)c1	754971756	MSCOIEQGMBHPBE-INIZCTEOSA-N	449.257	1.902	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)NNC(=O)c3ccc4c(c3)OCCO4)cn2)C[C@@H](C)O1	755866142	RXVMBPDWMKVOFO-OKILXGFUSA-N	427.461	1.933	50	20	IDGD	
C=CCN(C)S(=O)(=O)c1ccc(NC(=O)NNC(=O)c2cc(OC)cc(OC)c2)cc1	755932170	IQRVJPQLLSORQP-UHFFFAOYSA-N	448.501	1.977	50	20	IDGD	
Cc1cc(C(=O)NC(C)C)ccc1NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1	756167677	ITOJVTSFEWYKJC-UHFFFAOYSA-N	439.520	1.993	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)Nc1ccccc1CN1C(=O)CCC1=O	756223077	XQYZAVSOBUSHLH-UHFFFAOYSA-N	432.440	1.988	50	20	IDGD	
O=C(NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)Nc1cnc(C2CC2)nc1	756371111	LWBKQMVIQLQLBK-UHFFFAOYSA-N	430.490	1.605	50	20	IDGD	
CS(=O)(=O)NCc1ccc(NC(=O)NNC(=O)c2cccc(Br)c2)cc1	756625809	MLGNZSOXEBBSBK-UHFFFAOYSA-N	441.307	1.965	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)Nc2ccc(CS(C)(=O)=O)c(F)c2)cc1	757675515	KVMXVFWWQHRMJC-UHFFFAOYSA-N	425.438	1.611	50	20	IDGD	
Cc1nc2ccccc2c(-c2ccccc2)c1CC(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O	758036627	SUJFVHFYXULNKO-OAHLLOKOSA-N	440.525	1.838	50	20	IDGD	
O=C(CSc1nncn1-c1cccc(Cl)c1)NNC(=O)C(=O)Nc1ccccn1	758831042	NFOLHCAGJCVGGA-UHFFFAOYSA-N	431.865	1.194	50	20	IDGD	
O=C(NC[C@H]1CN(Cc2ccccc2)CCCO1)NNC(=O)c1cc([N+](=O)[O-])ccc1O	759351881	PYQILTOPYLTQQM-KRWDZBQOSA-N	443.460	1.536	50	20	IDGD	
CS(=O)(=O)c1ccc(CNC(=O)NNC(=O)COc2ccc(C#N)cc2)cc1Cl	759388559	LHXNPUYVPYYOPL-UHFFFAOYSA-N	436.877	1.525	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NC[C@H]2CC(=O)N(Cc3ccccc3)C2)cc1	759684631	VNQFATKCRQADSH-QGZVFWFLSA-N	426.473	1.453	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)c1cc(Br)cc2cccnc12	759814342	GTWUBSXTCOOTDG-UHFFFAOYSA-N	428.246	1.583	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)[C@](C)(O)CN1C(=O)C(C)(C)c2ccccc21	760064665	BLNFHGSKLJEKEI-LFVRLGFBSA-N	443.475	1.816	50	20	IDGD	
CC(=NNC(=O)N[C@@H]1CCS(=O)(=O)C1)c1ccc(CNC(=O)OC(C)(C)C)nc1C	760251427	WQHDXIWCXPLWCR-OAHLLOKOSA-N	439.538	1.625	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N[C@H]2CCCN(c3ccccc3F)C2=O)cc1OC	761821554	PEVYSMYPDFYYKR-HNNXBMFYSA-N	430.436	1.983	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)c1cc([N+](=O)[O-])c2nsnc2c1	762974377	FOXHFEJUCYYVAT-UHFFFAOYSA-N	429.414	1.455	50	20	IDGD	
CCCOC(=O)c1cc(Br)ccc1NC(=O)C(=O)NNC(=O)c1ccncc1	763463199	YCZGCNGHFGYBBZ-UHFFFAOYSA-N	449.261	1.811	50	20	IDGD	
COc1ccc(C(=O)N2CCCCCC2)cc1NC(=O)C(=O)NNC(=O)c1ccccn1	763464272	QUBPDERGMKSGAC-UHFFFAOYSA-N	439.472	1.506	50	20	IDGD	
O=C(NNC(=O)c1ccccc1Br)C(=O)Nc1ccccc1N1CCOC1=O	763484240	YPCOKCIUMFCFLR-UHFFFAOYSA-N	447.245	1.805	50	20	IDGD	
CCOc1ccc(C(=O)N2CCCCC2)cc1NC(=O)C(=O)NNC(=O)c1cccnc1	763491823	PHQZFLDJCIRCAS-UHFFFAOYSA-N	439.472	1.506	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2O)c2ccccc12	763528465	ZLFVTBJPPNLAOW-UHFFFAOYSA-N	437.408	1.497	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(C)c(OC)c2C)cc(OC)c1OC	763540026	PPYJRGRMBREXOJ-UHFFFAOYSA-N	431.445	1.738	50	20	IDGD	
C[C@H]1CN(Cc2ccccc2NC(=O)C(=O)NNC(=O)c2ccccc2F)C[C@@H](C)O1	763568458	LDCASLLEFMRAOU-GASCZTMLSA-N	428.464	1.835	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)Nc1ccc(OC(F)(F)F)cc1	763572616	SRFHZCYRWKUQQA-CQSZACIVSA-N	425.319	1.511	50	20	IDGD	
CCN(CC)C(=O)COc1cccc(NC(=O)C(=O)NNC(=O)c2cc(C)oc2C)c1	763585838	HCPUVKBHIICDES-UHFFFAOYSA-N	430.461	1.543	50	20	IDGD	
CC(C)(C)c1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(-n3nccn3)nc2)cc1	763601412	YZFKZXONCQEIAZ-UHFFFAOYSA-N	437.460	1.125	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)NCc2ccc(N3CCCS3(=O)=O)cc2)c1	763641440	GQGQODRUPJQLTL-UHFFFAOYSA-N	432.502	1.444	50	20	IDGD	
CCOC(=O)c1cc(F)c(F)cc1NC(=O)C(=O)NNC(=O)COc1ccc(C)c(C)c1	763678743	BPJQABGOMWFPSP-UHFFFAOYSA-N	449.410	1.923	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(CC(=O)N(C)C)cc1	763716906	OXPGYPXHVJVENQ-UHFFFAOYSA-N	426.473	1.045	50	20	IDGD	
O=C(NNC(=O)C12CC3CC(CC(C3)C1)C2)C(=O)Nc1ccc(N2CCOC2=O)cc1	763722933	LZDXDNZUZCKZMT-UHFFFAOYSA-N	426.473	1.946	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)C(=O)Nc2ccccc2C(C)C)cc1	763732021	CNVZNMTWEDAWJD-UHFFFAOYSA-N	446.529	1.525	50	20	IDGD	
CN(c1ccccc1NC(=O)C(=O)NNC(=O)c1cc2c(s1)CCC2)S(C)(=O)=O	763785801	SDPFBZZBZVOBJV-UHFFFAOYSA-N	436.515	1.032	50	20	IDGD	
Cc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1F	763796409	CTPMJUDXBQLFOT-UHFFFAOYSA-N	448.476	1.318	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cc(F)ccc2OC[C@@H]2CCCO2)cc1	763812114	PUNXITXQPSZOTD-KRWDZBQOSA-N	445.447	1.857	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccnn2-c2ccncc2)cc1	763873823	ZFROHSVOHWLPSC-AWEZNQCLSA-N	436.428	1.023	50	20	IDGD	
O=C(NNC(=O)c1cc(Cl)ccc1O)C(=O)Nc1ccccc1CN1CCOCC1	763979555	XYNYQKAZVYTUNB-UHFFFAOYSA-N	432.864	1.278	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)C(=O)Nc1cccc(NC(=O)C2CC2)c1	763994407	CTZKJBVNBCIBRM-UHFFFAOYSA-N	434.250	1.525	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNC(=O)c2cc(Br)cn2C)cc1F	764004857	PEXZNNOIECGGAR-UHFFFAOYSA-N	427.230	1.725	50	20	IDGD	
COC(=O)c1ccc(OC)cc1NC(=O)C(=O)NNC(=O)c1cccc(C(F)(F)F)c1	764038096	ZLLUGEGPOBRXTI-UHFFFAOYSA-N	439.346	1.900	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)C2CCCC2)c(Br)cc1F	764067875	AOYPPQBOHMJXLV-UHFFFAOYSA-N	430.230	1.651	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(Cl)c2S(C)(=O)=O)c(O)c1	764109992	FDCXISIXEBYNOB-UHFFFAOYSA-N	425.850	1.157	50	20	IDGD	
CCOC(=O)c1c(C)csc1NC(=O)C(=O)NNC(=O)CCc1ccc(OC)cc1	764130691	BZYYLAGJXGBVJT-UHFFFAOYSA-N	433.486	1.961	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2O1)C(=O)N1CCc2ccc(Br)cc21	764155306	YADFWYJMWRXXLY-INIZCTEOSA-N	430.258	1.489	50	20	IDGD	
CN1CCC/C1=N\S(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)CC2CCCC2)cc1	764188132	NYCFFVPCNOZTEG-JJIBRWJFSA-N	449.533	1.166	50	20	IDGD	
COC(=O)c1ccc(-n2cc(C)cn2)c(NC(=O)C(=O)NNC(=O)CCc2ccccc2)c1	764192975	PHHBSFLXKQRVHK-UHFFFAOYSA-N	449.467	1.686	50	20	IDGD	
CNC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cccc(OC(F)F)c2)ccc1Cl	764249849	FOMFZXHAJGOBLJ-UHFFFAOYSA-N	440.790	1.701	50	20	IDGD	
C[C@H]1CN(Cc2ccccc2NC(=O)C(=O)NNC(=O)Cc2ccncc2)C[C@@H](C)O1	764354573	SZIWHCHHPHBIAJ-IYBDPMFKSA-N	425.489	1.019	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)cc1	764387705	MFRNMZQAHWGJPV-UHFFFAOYSA-N	441.419	1.641	50	20	IDGD	
COc1cc(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)cc(OC)c1O	764467957	VWEHNQMWHUVLEM-UHFFFAOYSA-N	437.474	1.187	50	20	IDGD	
Cn1c(=O)c2c(ncn2CC(=O)NN=Cc2ccc(-c3cccs3)cc2F)n(C)c1=O	764812694	OODSAVXXCDAFCY-UHFFFAOYSA-N	440.460	1.452	50	20	IDGD	
CCOCCCn1c(NNC(=O)c2c(C)c(C)nn(C)c2=O)nc2ccccc2c1=O	765046518	UOQMNXCBJRNBNI-UHFFFAOYSA-N	426.477	1.291	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc(F)c(F)c1)NNC(=O)CSc1ccccc1O	765252580	NUOWCULSBVPPAQ-UHFFFAOYSA-N	445.469	1.279	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)CCCNC(=O)C(C)(C)C)n[nH]2)cc1OC	765599029	PIXHNIVKXDMPME-UHFFFAOYSA-N	431.493	1.797	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@@H]3CCCCN3C(=O)C(C)C)CC2)cc1	766642338	RDZXUPXBCAVBHP-NRFANRHFSA-N	443.592	1.297	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)CCC(=O)c2ccc3c(c2)CCC(=O)N3)c1	767248449	ZEOPEUJRFYHWST-UHFFFAOYSA-N	443.481	1.399	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1cc(OC(F)F)n(C)n1	767703304	BHSPJIWIYIHZSM-UHFFFAOYSA-N	432.767	1.302	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)c2ccc3c(c2)NC(=O)CCN3C)n[nH]1	768277887	SYYYHHVIIDTAGP-UHFFFAOYSA-N	434.456	1.939	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2ccc(C(=O)NNC(=O)c3cc(C)[nH]n3)cc2)cc1	768278384	QOYWAUYSRKEFPY-UHFFFAOYSA-N	429.458	1.602	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)CSc3nnnn3CC(F)(F)F)nc21	770965843	GNJOPJHSCZPONQ-UHFFFAOYSA-N	446.419	1.071	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)[C@@H]1CC(=O)N(c2ccc(Cl)cc2)C1	772193315	UQPGYTWQBOZMMC-CYBMUJFWSA-N	449.294	1.810	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1cc(I)c(F)cc1F	772209141	YGRBJKXOIMYJBU-ZCFIWIBFSA-N	426.157	1.672	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)[C@H]1CC(=O)N(c2ccc(Cl)c(F)c2)C1	772235767	NRWZBEAIQRNFRK-RYUDHWBXSA-N	427.860	1.957	50	20	IDGD	
CCC(CC)[C@H](C(=O)NNC(=O)[C@H]1CCCN(C(=O)OC(C)(C)C)C1)N1CCOCC1	773413738	IVBWACMENGACER-ZWKOTPCHSA-N	440.585	1.918	50	20	IDGD	
COc1ccc(C(=O)N2CCN(C)CC2)cc1NC(=O)C(=O)NNc1ccc(C#N)cc1	773708509	GDGKAUVBEIFXOX-UHFFFAOYSA-N	436.472	1.036	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2cc(C(=O)N3CCCCC3)ccc2Cl)n1	773724217	ONRUAUCCFLVVOE-UHFFFAOYSA-N	432.868	1.847	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)[C@@H]1[C@H](C)OC(C)(C)N1C(=O)OC(C)(C)C	776476345	HIPXBLAKSXBUJU-YDHLFZDLSA-N	429.514	1.872	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC2CCN(C(=O)OC(C)(C)C)CC2)cc1OC	777089397	ZIJUTRQXHAJVGU-UHFFFAOYSA-N	437.493	1.881	50	20	IDGD	
Cc1cc(C=NNC(=O)CSc2nn(C)c(=O)n(C)c2=O)c(C)n1-c1ccccc1F	777432248	LEUWNPGTQGIWDK-UHFFFAOYSA-N	444.492	1.268	50	20	IDGD	
COc1ccc(-c2n[nH]cc2C(=O)N2CCN(S(=O)(=O)CBr)CC2)cc1	777831662	GZTVLTPTDCVDMZ-UHFFFAOYSA-N	443.323	1.525	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)Cc1ccc([N+](=O)[O-])cc1Br	778433738	PTDMRQFNFVRCDP-UHFFFAOYSA-N	431.243	1.572	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)NCCc1nc(-c2cccc(Cl)c2)no1	778669930	PFCGDMVCZRHJNQ-UHFFFAOYSA-N	438.872	1.788	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)c1sccc1S(=O)(=O)N1CCCC1	780971848	UCZLOBZNTDNHMZ-UHFFFAOYSA-N	446.551	1.208	50	20	IDGD	
COc1ccc(NNC(=O)c2ccc(Cl)c(S(=O)(=O)NC[C@@H]3CCCO3)c2)nc1	781526945	KWDNUWYUVAFFEQ-AWEZNQCLSA-N	440.909	1.958	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc(C(=O)O)c(Cl)cc1Br)c1ccccn1	782462150	JZMMJJMCKWKEBM-UHFFFAOYSA-N	434.655	1.819	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C(=O)Nc2ccccc2OCC(F)F)nc2ccccc21	782892648	CRNUNLCKSRHBFK-UHFFFAOYSA-N	431.399	1.546	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C(=O)Nc2ccn(Cc3ccccc3)n2)nc2ccccc21	782894156	NHKGYXKJFHMRAR-UHFFFAOYSA-N	431.456	1.147	50	20	IDGD	
O=C(NNc1ncccc1C(F)(F)F)C(=O)Nc1ccc(CN2C(=O)CCC2=O)cc1	783120574	UMIPLLJHNNAPIK-UHFFFAOYSA-N	435.362	1.831	50	20	IDGD	
Cc1nn(CC(C)C)c(C)c1S(=O)(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	783842198	IXPCVCQKXWBJBY-UHFFFAOYSA-N	441.941	1.435	50	20	IDGD	
O=C(NNc1ccc(OC(F)F)cc1)C(=O)Nc1ccc(CC(=O)N2CCOCC2)cc1	784313430	MXENBBMCVMGVFW-UHFFFAOYSA-N	448.426	1.771	50	20	IDGD	
COc1cccc(NNC(=O)C(=O)Nc2ccc(C)c(NC(=O)CN3CCCCC3)c2)n1	784842275	KZNWRBIILOONRY-UHFFFAOYSA-N	440.504	1.905	50	20	IDGD	
CC(=O)N1CCN(Cc2cccc(NC(=O)C(=O)NNc3ccc(Cl)nc3)c2)CC1	784870554	YGAZPDGPNCDFSD-UHFFFAOYSA-N	430.896	1.481	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C)c(C)c(NC(=O)C(=O)NNc2ncc(F)cn2)c1	784955123	BQHJMCLHBYLACC-UHFFFAOYSA-N	438.485	1.345	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1cc(F)ccc1OC(F)F	785338954	PZDBBNIMTGHCFC-UHFFFAOYSA-N	447.391	1.921	50	20	IDGD	
O=C(NNC(=O)c1cc(Cl)cc(F)c1Br)N[C@@H]1CCS(=O)(=O)C1	785951412	VGEXZAATFZAXGZ-SSDOTTSWSA-N	428.667	1.373	50	20	IDGD	
Cc1nc(Cn2nnc(C(=O)NNC(=O)[C@H](C)Oc3ccc4ccccc4c3)c2C)no1	786663122	LNIFMLAEJUECRV-ZDUSSCGKSA-N	435.444	1.708	50	20	IDGD	
O=C(COC(=O)c1ccc(O[C@@H]2CCOC2)cc1)NNC(=O)c1cccc([N+](=O)[O-])c1	789196443	BSYSJSNUYVDDNX-QGZVFWFLSA-N	429.385	1.381	50	20	IDGD	
COc1nn(C)cc1NC(=O)C(=O)NNC(=O)CCCOc1ccc(Cl)cc1Cl	789585765	DSAGPMFKQPYQEV-UHFFFAOYSA-N	444.275	1.681	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cc(-c3ccc(F)cc3F)nn2C)cc1	789732906	RXLZZWJWYHDMKS-UHFFFAOYSA-N	443.410	1.839	50	20	IDGD	
CC(C)(C)n1cc(C#N)cc1NC(=O)C(=O)NNC(=O)c1cc(Br)ccc1O	789734584	KOJBVYCJTFXJTM-UHFFFAOYSA-N	448.277	1.983	50	20	IDGD	
C[S@@](=O)Cc1ccccc1NC(=O)C(=O)NNC(=O)[C@H]1OCC[C@H]1c1ccccc1	789812701	MNRBMYGBXZUOPN-PAGHIRBPSA-N	429.498	1.224	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)[C@H]1CC12CN(C(=O)OC(C)(C)C)C2	789848446	UIACWOXZBYSTAP-GFCCVEGCSA-N	425.507	1.799	50	20	IDGD	
O=C(NNS(=O)(=O)c1cnn(CC(F)F)c1)c1ccc(F)cc1Br	790054968	STRPADYNMZUZID-UHFFFAOYSA-N	427.202	1.673	50	20	IDGD	
CC(C)(C)n1cc(C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)nn1	790783637	GUQTWZFOOJECAT-UHFFFAOYSA-N	433.944	1.265	50	20	IDGD	
CCOc1c(Cl)cccc1CC(=O)OCC(=O)NNC(=O)Cc1nc(C)cs1	791503774	WWKKTKYLOWQRLQ-UHFFFAOYSA-N	425.894	1.979	50	20	IDGD	
Cc1ccc(N2N=C(Br)C[C@H]2C(=O)N([C@H]2CCS(=O)(=O)C2)N(C)C)cc1	792855786	SYWPPRAGYSFPHH-GJZGRUSLSA-N	443.367	1.774	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)[C@H]1N(C(=O)OC(C)(C)C)CC1(C)C	793516929	COOWYSYGJGQLSU-GFCCVEGCSA-N	429.518	1.487	50	20	IDGD	
CC(=O)c1cc(Br)ccc1OCC(=O)NNc1nc(O)c2cnn(C)c2n1	796447296	FHBWGKSSSDVUQG-UHFFFAOYSA-N	435.238	1.556	50	20	IDGD	
O=C(NNC(=O)c1c(F)ccc(O)c1F)c1ccc(S(=O)(=O)N2CCCC2)cc1	798153987	PITDBXXKGZEVBG-UHFFFAOYSA-N	425.413	1.530	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cnn(CCO[C@H]3CCCCO3)c2C)cc1	801105484	FBVSKLWLZXNDOW-SFHVURJKSA-N	429.477	1.443	50	20	IDGD	
O=C(N=c1cc[nH]cc1)NNC(=O)c1cc(I)cc([N+](=O)[O-])c1	802036105	PZHHZURHTVJWQP-UHFFFAOYSA-N	427.158	1.483	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)C2=NN(c3ccc(F)cc3)[C@H](C(N)=O)C2)cc1	802122808	BKAIODCVBNLUMJ-KRWDZBQOSA-N	427.440	1.165	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCOCC2)cc1C(=O)NNc1nccnc1C1CCC1	805459820	BHKBYQJLGDXMEG-UHFFFAOYSA-N	447.517	1.531	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)N[C@@H](CS(=O)(=O)N(C)C)C(F)(F)F	805769137	LGMHTODOFTVZDZ-NSHDSACASA-N	446.835	1.115	50	20	IDGD	
CC[C@@H](C)NS(=O)(=O)c1cccc(NC(=O)NNc2ccc(-n3ccnc3)nn2)c1	806353782	NMQGBFHCJGSYGE-CYBMUJFWSA-N	430.494	1.888	50	20	IDGD	
CC[C@@H](C)C(=O)NNC(=O)C(=O)Nc1cc(OC)c(Br)cc1C(=O)OC	806976085	CYYHRFSQYDWBKZ-MRVPVSSYSA-N	430.255	1.376	50	20	IDGD	
COC(=O)C[C@H](C)CC(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	809559815	BBWLBGLIAYDNPS-OAHLLOKOSA-N	436.472	1.739	50	20	IDGD	
COC(=O)c1c(F)ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)on2)c1F	810385038	VQGIJEPHBMJXKF-UHFFFAOYSA-N	444.350	1.806	50	20	IDGD	
CC(=NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1)[C@@H](C)NC(=O)OC(C)(C)C	811645300	HJZFETWUKRGJGG-MRXNPFEDSA-N	431.537	1.850	50	20	IDGD	
CN(C)CCCOc1cnccc1CNC(=O)NNC(=O)c1nnc(O)c2ccccc12	812396242	NOHWARANYRFLGE-UHFFFAOYSA-N	439.476	1.205	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)NCc1ccc(OC)c(S(N)(=O)=O)c1	812431419	HXKJDWQTOVGCCV-UHFFFAOYSA-N	442.881	1.149	50	20	IDGD	
CC(=O)N[C@@H](CC(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1)c1c(F)cccc1F	812730872	ZSQCRTGBMSMXIF-KRWDZBQOSA-N	440.472	1.926	50	20	IDGD	
C[C@@H](C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1)c1ccc(S(C)(=O)=O)cc1	812733435	RYEIANBQOOFWLH-CYBMUJFWSA-N	425.532	1.587	50	20	IDGD	
COC(=O)c1cn(-c2cccc(NC(=O)C(=O)NNC(=O)c3cccc(Cl)c3)c2)nn1	812979335	OUZSMHUOZSDDRT-UHFFFAOYSA-N	442.819	1.107	50	20	IDGD	
CC(=NNC(=O)[C@@H](C)CN1CCOCC1)c1cc(Br)ccc1OCC(=O)O	814762860	MNTHKBQJHZYHID-LBPRGKRZSA-N	442.310	1.721	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)cc1)C1CC1	815566113	JLFYZJSHGBDPKR-CYBMUJFWSA-N	442.447	1.894	50	20	IDGD	
O=C(NNc1ncncc1F)C(=O)Nc1ccc(CCn2cc(Br)cn2)cc1	815764550	LPNPXUUDUIWSGJ-UHFFFAOYSA-N	448.256	1.899	50	20	IDGD	
CC(C)[C@@H](NS(=O)(=O)c1ccc2c(c1)OCCCO2)C(=O)NCCCSC#N	816538594	XJQFUGFDVMPOBP-QGZVFWFLSA-N	427.548	1.871	50	20	IDGD	
COc1ccc(C(=O)NNc2nc[nH]n2)cc1S(=O)(=O)N1CCCc2ccccc21	816634154	AENBCNIFYMTTKF-UHFFFAOYSA-N	428.474	1.712	50	20	IDGD	
O=C(CC1CC1)NNC(=O)c1cccc(S(=O)(=O)NCc2ccc3c(c2)OCO3)c1	819136034	JNGWLZLTIGFETJ-UHFFFAOYSA-N	431.470	1.455	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)[C@@H]2CCCCN2S(=O)(=O)c2ccccc2)c1	825786168	KAZZWCKFLRFMDF-IBGZPJMESA-N	446.529	1.498	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)c2cc3c(nc2O)CCCC3=O)c2ccccc2c1=O	891693148	AZUMSRWTNJQKHR-UHFFFAOYSA-N	435.440	1.672	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2ccc(COc3ccccc3)o2)cc1	913228597	MTCNVZBBGXTGNV-UHFFFAOYSA-N	443.481	1.907	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)NCC2(NS(C)(=O)=O)CCCCC2)c1	916254090	XYUIAKSCYXMXPB-UHFFFAOYSA-N	426.539	1.265	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2nnn(-c3cccc(C)c3)c2C)cc(OC)c1OC	917388604	OZDHVSDGDHVVCM-UHFFFAOYSA-N	425.445	1.985	50	20	IDGD	
O=C(NCc1nccs1)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	918218766	PRMFQVZNPAURHQ-UHFFFAOYSA-N	445.526	1.766	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1c(C)nn2c(C)cc(C)nc12	919505799	TXDNLKSVOSARGV-UHFFFAOYSA-N	445.863	1.935	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2CCCCN2Cc2cccnc2)c1	1116020680	SLYXYSPNKSUFOJ-IBGZPJMESA-N	445.545	1.148	50	20	IDGD	
C[C@H]1CN(CCCNC(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)C[C@@H](C)O1	1318620640	HTKCEQRSERJWFR-IYBDPMFKSA-N	441.573	1.463	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)c2cc(=NCc3ccccc3)cc[nH]2)c2ccccc2c1=O	1348385566	XZFPZSRHFFDRFK-UHFFFAOYSA-N	428.452	1.437	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3cn4cccnc4n3)C2)C1	1778473927	GFNJVVFUMGOYQE-ACJLOTCBSA-N	436.310	1.204	50	20	IDGD	
Cn1ncc2cc(C(=O)N3CCO[C@]4(CCN(C(=O)CO[Si](C)(C)C)C4)C3)ccc21	1779296858	IRJVOAUQKPPZNB-NRFANRHFSA-N	430.581	1.868	50	20	IDGD	
NC[C@H](N)C(=O)N1CCO[C@@]2(CCN(C(=O)CCCCCCCCCCCl)C2)C1	1781150111	BWIHAQLGYPRMOM-GHTZIAJQSA-N	431.021	1.852	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccccc3C(=O)OCCO)CCO2)C1	1781218445	PBLIEXCQQZEZTG-UWJYYQICSA-N	438.908	1.297	50	20	IDGD	
Cc1cccc(CCC(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](F)Br)C3)C2)n1	1781326699	QZHLVYNMIIBRSP-WMZOPIPTSA-N	428.302	1.843	50	20	IDGD	
O=C([C@@H](F)Br)N1CC[C@]2(C1)CN(C(=O)C1(Br)CC1)CCO2	1781332941	KOMSUEAZWCLYTQ-SKDRFNHKSA-N	428.096	1.434	50	20	IDGD	
CC[C@H](NC(C)=O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)Br)C1	1781995530	OXVDVANMEYBMCX-CTNYNGJSSA-N	432.359	1.198	50	20	IDGD	
COCc1c[nH]c(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](Cl)COC)C2)c1	1782173724	NMQYGUMRNVRFEV-XAUMDUMWSA-N	427.929	1.542	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(OC)cn3)CCO2)C1	1783347982	QZANVRKUCDKQJH-RDTXWAMCSA-N	426.311	1.707	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cc4cccnn4n3)CCO2)C1	1783353713	ZOIZBEWGAGXTNZ-KDOFPFPSSA-N	436.310	1.346	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cc4cccnn4n3)CCO2)C1	1783353715	ZOIZBEWGAGXTNZ-KSSFIOAISA-N	436.310	1.346	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccn(C(C)(C)C)n3)CCO2)C1	1783531713	BURJPVKHFHQNMP-FZKQIMNGSA-N	427.343	1.865	50	20	IDGD	
CCOc1cnc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](C)Br)C3)C2)cn1	1783532557	PQKRQOGUICKJOV-PXAZEXFGSA-N	427.299	1.102	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cc4cnccc4nc3C)CCO2)C1	1783876514	YGRAWYKXRIQHGU-UTKZUKDTSA-N	432.908	1.636	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(OC)cc3OC)CCO2)C1	1783883210	WQGFEKZDBSALMO-OXJNMPFZSA-N	426.897	1.401	50	20	IDGD	
CN(CC(=O)N1CCO[C@]2(CCN(C(=O)C(Cl)Cl)C2)C1)C(=O)c1ccccc1	1783943515	ZGYCWTUYHPHYIY-LJQANCHMSA-N	428.316	1.392	50	20	IDGD	
CC(C)N1CCC[C@H]1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]2C1	1783975854	XSUYGOVYCLKJGF-FPSMNIFISA-N	444.414	1.870	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(Cl)c(F)cc3F)C[C@@H]21)[C@@H](O)CCl	1784092692	MHFZNCGKNZKSJK-JIVACREVSA-N	437.270	1.811	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3n[nH]c4c3CCCC4)C[C@@H]21	1786405846	FUTCHWJMCRTNHE-NOLJZWGESA-N	439.354	1.667	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(C)nc(O)c3)[C@H]2C1	1787457522	NECFXXZNZJZECZ-HNKHHVNMSA-N	440.338	1.862	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccnc(Cl)n3)[C@H]2C1	1788875551	YBSXMEGGYMHORT-MNXVOIDGSA-N	445.745	1.754	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3ON=C(c4ccccc4)O3)C[C@@H]21	1789863356	OQYNVNCGCSSMKX-BWRRFVNYSA-N	435.908	1.718	50	20	IDGD	
COc1cccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]3C2)n1	1789922912	XYKMHYJXEQWVNZ-TZQJONAQSA-N	430.274	1.374	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)[C@@H]1Cc2ccccc2N1	1790683803	VUYRZAUKLYBGFZ-PTTAZLHSSA-N	440.313	1.693	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc(F)cn3)C[C@@H]21	1790962061	VGGFGCTWOYOGFX-STECZYCISA-N	442.329	1.916	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)COc3ccccc3F)C[C@@H]21	1791257493	KAFRWSKZCXERRE-AFIMGQEJSA-N	428.888	1.438	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc3c[nH]nc13)C2	1792868380	WGSZKGKTXVOUSX-ZIEJDFEHSA-N	435.322	1.797	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCCOc1ccc(Cl)cc1)C2)[C@H](O)CCl	1792975829	ZLYODYRYAWNWGC-QOIYZWAUSA-N	445.343	1.688	50	20	IDGD	
COc1ccc2c(/C=C/C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@@H](O)CCl)c[nH]c2c1	1792981515	LTXOYBKZZBASJU-HLUXNRJXSA-N	447.919	1.379	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2)c1cccc(OCC(F)(F)F)n1	1794335335	DCTDOSYYWVVTIH-DJBIQUGXSA-N	439.793	1.760	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccnc3ncccc13)C2	1795115047	BNTGCGBMZZCSLH-FVCICTRLSA-N	433.306	1.618	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](N)CCC(N)=O	1795979610	ZSTGZFJGWCRCNZ-ZPLALWFASA-N	445.470	1.103	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2nccnc2c1	1797054358	HGNVFVKKBFIEQU-FRQROOTJSA-N	447.333	1.864	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCN1Cc2ccccc2C1=O	1797767102	RYGVBZXJCAMNEO-ZMMAXQRCSA-N	433.936	1.925	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1nnc(-c2ccccc2)o1	1797821513	CJPJMMZAVJFMNY-REBRKWNGSA-N	449.305	1.723	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1c[nH]c2cnccc12	1798238439	ZNTIQIDWUUEZPB-CWNKPHDYSA-N	447.499	1.949	50	20	IDGD	
COc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)CBr)C3)ccc1O	1798948048	LSNKRORYMBBHFA-MBMVNNNZSA-N	441.322	1.635	50	20	IDGD	
COc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CO[Si](C)(C)C)C3)cc1N(C)C	1799206829	PTOZCQKKCCNWQI-UPHUGPLXSA-N	449.624	1.816	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1nc[nH]n1)C2	1799218081	WYDBRDMUDUZVBG-CLLJXQQHSA-N	428.405	1.204	50	20	IDGD	
Cn1nc2c(c1C(=O)N[C@@H]1[C@H]3COC[C@@H]1CN(C(=O)[C@@](C)(Cl)CCl)C3)CCC2	1800047743	QHRKHGSMFVNSLE-RHQBZFHZSA-N	429.348	1.348	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CCC[C@H](C(=O)OC)C1	1800964487	OOAFFUUKIATICE-BQULAQKPSA-N	428.957	1.963	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COCc1ccc(OC)cc1)C2	1800981854	VEGWDEMQCBGFRY-WQDJSCAQSA-N	440.924	1.055	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CCCN1Cc1ccccc1	1801192682	FVYNTHWQIXKGCY-VIYGXFRKSA-N	449.979	1.494	50	20	IDGD	
COCCOCCOCCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](C)CBr)C2	1802082045	GKCJWOYUMHXGEX-NXOAAHMSSA-N	449.386	1.725	50	20	IDGD	
C[C@H]1[C@@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Cl)C3)CCN1C(=O)OC(C)(C)C	1802250005	YHVAVXCJFVDUNU-IATJYDTKSA-N	447.935	1.756	50	20	IDGD	
O=C1CC[C@H](C(=O)NC[C@@H]2CCN(C(=O)CCBr)[C@H]2c2cccnc2)CN1	1802609300	JAULJHVHPINOOY-MPGHIAIKSA-N	437.338	1.399	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H](CNC(=O)c2cnc(O)nc2O)[C@H]1c1cccnc1	1808280228	JULOTVLCUXLZNW-RHSMWYFYSA-N	445.552	1.454	50	20	IDGD	
C[C@]1(C(=O)N2CC[C@H](CNC(=O)[C@H](F)Br)[C@H]2c2cccnc2)CCCN1	1808675497	BWKNOWKAJYWJSG-ZXFNITATSA-N	427.318	1.920	50	20	IDGD	
Cc1cc(F)ccc1C(=O)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1	1809972767	PZVUMHXFRPUQBU-UHFFFAOYSA-N	438.308	1.973	50	20	IDGD	
CCc1cc(C(=O)NC[C@@H]2CCN(C(=O)[C@H](Cl)COC)[C@@H]2c2cccnc2)nn1C	1811143194	HEIBZUQSIYUKLI-KVSKMBFKSA-N	433.940	1.951	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H](CNC(=O)[C@@H](C)n2ccnn2)[C@@H]1c1cccnc1	1812394504	AXAGOMYOMPKIAH-SRABZTEZSA-N	449.353	1.971	50	20	IDGD	
C=C(C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)C(F)(F)F	1812677045	NIYJAKNYCSMZJJ-SJLPKXTDSA-N	447.222	1.200	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)N1CC[C@H](CNC(=O)[C@@H](Cl)COC)[C@H]1c1cccnc1	1813030658	FFQRJRVTNLYAPA-MXASKKJJSA-N	439.944	1.049	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CN2CCSCC2)[C@@H]1c1cccnc1)C(Cl)Cl	1813074175	OREJYPOXIKPQLK-GOEBONIOSA-N	431.389	1.940	50	20	IDGD	
C[C@H](CS(C)(=O)=O)C(=O)N1CC[C@H](CNC(=O)C(Cl)Cl)[C@@H]1c1cccnc1	1813075819	JSUWFHRGOVTOKV-BNOWGMLFSA-N	436.361	1.572	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@H]1CCc2nc(NC(=O)CC(C)(C)O)sc2C1	1814336689	VLUNLSYEJZECHA-JBBSTVMTSA-N	446.533	1.350	50	20	IDGD	
COc1ccc(CC(=O)N2CCCC[C@H]2c2cc(NC(=O)[C@H](O)CCl)n[nH]2)cc1O	1814864683	RQITZGMLMJFSCT-GOEBONIOSA-N	436.896	1.958	50	20	IDGD	
Cn1ccc(CC(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@H](F)Br)CC3)n1	1815550103	SSHOPISKHVLOJA-SDBXPKJASA-N	430.303	1.722	50	20	IDGD	
C=C(C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1)C(F)(F)F	1817476944	IJKJVSHGPQMRSL-OAHLLOKOSA-N	436.199	1.514	50	20	IDGD	
C[C@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](F)Cl)n[nH]1)[C@@H]1SC(=N)NC1=O	1818038659	ZLWGWTVBACECAG-MGCVSALHSA-N	430.893	1.739	50	20	IDGD	
CC(C)OCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819400219	FBIFVLYRLIKRJO-MRXNPFEDSA-N	429.481	1.139	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)CO[Si](C)(C)C)n[nH]1	1819597263	OGCCLJALCVKOJE-HNNXBMFYSA-N	438.605	1.626	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](Cl)COC)CC2	1819694965	MYPYAJUXROFJDL-MXWKQRLJSA-N	431.946	1.017	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](O)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)CC1	1824188192	OCPPAUJCVJQFQT-HRCADAONSA-N	447.960	1.049	50	20	IDGD	
C=CCNC(=O)/C=C\C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](C)Br)sc2C1	1825631703	KPYBPBHCUJUMIW-GYHQZXBOSA-N	441.351	1.697	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CC[C@H]1CCOC1)CC2	1826092132	NHENUGJCJHVOAN-KBPBESRZSA-N	437.566	1.245	50	20	IDGD	
CC(C)=NO[C@@H](C)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827052657	VLEPEZWPAQGHLI-LAUBAEHRSA-N	443.353	1.401	50	20	IDGD	
C[C@@]1(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2cccc(B(O)O)c2)CC3)CC=CCC1	1827221480	OSSQJWHJFVBJTR-OPAMFIHVSA-N	439.346	1.795	50	20	IDGD	
COCC(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)[C@H](F)Cl)C2)C1	1828860709	AFDWOCYGZUZPRL-PXNSSMCTSA-N	441.887	1.619	50	20	IDGD	
Cc1ccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)c(C)n1	1829530194	PEUGDKCOVDHXOD-QHCPKHFHSA-N	449.360	1.925	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccnc3S)CCO2)C1	1829800444	YJLAZGZAKVYIQF-SJKOYZFVSA-N	444.351	1.224	50	20	IDGD	
Cc1cnn([C@@H](C)C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)c1	1830370315	QAARBOPFVIJODV-JXFKEZNVSA-N	426.945	1.474	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)CCC(F)(F)F)C2)C1	1830537075	BARCVGFBQZJQBR-WFASDCNBSA-N	445.276	1.816	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)C3CC(C)(C)C3)C2)C1	1830543869	GSELPNDQDVIVFO-IFXJQAMLSA-N	431.371	1.910	50	20	IDGD	
O=C(C(Cl)Cl)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CCc3ccoc3C1)CCO2	1830940300	IDLPITNYJCGJKG-AUUYWEPGSA-N	431.316	1.645	50	20	IDGD	
CN(CC(=O)N1CCCC[C@H]1C1CCN(C(=O)C(C)(C)CCl)CC1)C(=O)C(=O)O	1831159845	ANMAETHMBMRWMD-HNNXBMFYSA-N	429.945	1.414	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](NC(C)C)C(C)C)C2)C1	1831646928	PBNDSIOCJYAKEI-WFXMLNOXSA-N	432.005	1.873	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)CN(CC)CC)C2)C1	1831657066	LEJCDKAWYIJPHJ-BBTUJRGHSA-N	432.005	1.828	50	20	IDGD	
COCCOCCOCCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H](O)CCl)CC1	1831722011	NWYIRBRUIXPADY-MOPGFXCFSA-N	448.988	1.276	50	20	IDGD	
Cc1noc(N)c1C(=O)N1CCC([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1	1831871261	NWQDPGLRRBPOHM-INIZCTEOSA-N	434.541	1.172	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)CCBr)CC1	1831872127	PKXSVBSYJFUEGA-INIZCTEOSA-N	445.402	1.764	50	20	IDGD	
O=C(Cc1cccc(Cl)n1)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1833178511	KMYGKDJOBXRNQJ-KRWDZBQOSA-N	436.723	1.538	50	20	IDGD	
C[C@@H](Nc1cccnc1)C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)CCl)CC2)CC1	1833308943	FCRSACLERGSIFN-DNVCBOLYSA-N	437.972	1.053	50	20	IDGD	
CCc1ncccc1C(=O)N1CCO[C@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1	1833516238	LHXCSXLMHVHJKN-NRFANRHFSA-N	435.597	1.566	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3coc(C)n3)CCO2)C1	1834213984	XQTVKCSRLZJOFO-CXAGYDPISA-N	430.299	1.227	50	20	IDGD	
C[C@@H](C(=O)N1CCOC[C@@]2(CN(C(=O)CCBr)CCO2)C1)c1ccccn1	1834826458	QLWOSIJKNYNPST-DNVCBOLYSA-N	440.338	1.427	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)C#CC3(O)CCCCC3)CC2)CC1)[C@H](F)Cl	1835084327	YIKKSEMIUOHJEA-IBGZPJMESA-N	427.948	1.791	50	20	IDGD	
CC(C)N1CCC(C(=O)N2CCC(OC3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)CC1	1836714393	TYHGSPXVQHAIIQ-FQEVSTJZSA-N	444.016	1.705	50	20	IDGD	
O=C(c1ccc2nccnc2c1)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836717355	USJJBDNKYJFZCJ-HXUWFJFHSA-N	446.935	1.842	50	20	IDGD	
Cc1nc(F)ccc1C(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836717800	CPOUEVQFFWLZJZ-KRWDZBQOSA-N	427.904	1.741	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](C)NC(C)=O)CC2)CC1	1838755841	VEOWOWKPTGOWKL-DYVFJYSZSA-N	446.386	1.683	50	20	IDGD	
O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(O)cc1)CCO2	1838969494	KKRFBMZUILKEMS-GOSISDBHSA-N	427.295	1.247	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4c(c3)NC(=O)CC4)C2)C1	1839147856	FATGXKQBVNKAMU-HTAPYJJXSA-N	449.935	1.659	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C)c4n[nH]cc4c3)C2)C1	1839148221	RMUCDGOHGQWFGC-LAUBAEHRSA-N	434.924	1.959	50	20	IDGD	
Cc1cscc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839200527	JMMORNCBSQPVIV-CJNGLKHVSA-N	435.315	1.817	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1839966328	AUPWNVGPOHVNCG-YGRLFVJLSA-N	432.142	1.420	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@]3(F)CCCC=C3F)C2)C1	1840156855	WGHZXGHUVSLOOP-JVPBZIDWSA-N	436.883	1.442	50	20	IDGD	
O=C(C(Cl)Cl)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CNc4ccccc43)C2)C1	1840188151	QXOOOIFUXDTRSL-KUHUBIRLSA-N	428.316	1.456	50	20	IDGD	
COC1(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)CCC1	1840616956	IGPAATOWYTUQMT-YOEHRIQHSA-N	437.306	1.093	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CCCSC1)CCO2	1840859852	AOBVXDGUPSTVLP-VKJFTORMSA-N	449.411	1.617	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCCC12CN(C(=O)C(=O)c1ccco1)C2	1841924148	BHYKQSRVNTXUJH-ZDUSSCGKSA-N	439.896	1.798	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)/C=C/c1ccccc1N)C2	1843415796	NOEAJEXCNLOZSK-VRESTWFCSA-N	434.500	1.619	50	20	IDGD	
COc1cc(Br)ccc1CC(=O)N1CCCC12CN(C(=O)[C@@H](O)CCl)C2	1846461815	NVLHSDREUZZENM-AWEZNQCLSA-N	445.741	1.803	50	20	IDGD	
O=C(NNC(=O)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1)C(=O)NC1CC1	9889243	MTMILIXPMFSKOT-UHFFFAOYSA-N	431.836	1.900	50	20	IDGD	
Cc1c(/C=C(\C#N)C(=O)OCc2nnc3n(C)c(=O)c4ccccc4n23)cc(C#N)n1C	10197745	AAAGVNAFDOQBHH-OVCLIPMQSA-N	427.424	1.750	50	20	IDGD	
CCn1c(NNC(=O)[C@H](C)NS(=O)(=O)c2ccc(OC)cc2)nc2ccccc2c1=O	11164483	YGNUASUDZRGXFZ-ZDUSSCGKSA-N	445.501	1.235	50	20	IDGD	
O=C(CC[C@H]1Cc2ccccc2NC1=O)NNC(=O)c1csc(N2CCOCC2)n1	11332000	DMYDAXHUJKLNOI-AWEZNQCLSA-N	429.502	1.332	50	20	IDGD	
O=C(CN1CCC(C(=O)Nc2ccccc2O)CC1)NNC(=O)c1cccc([N+](=O)[O-])c1	15045057	BJAJIVUPKBXJFU-UHFFFAOYSA-N	441.444	1.412	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)c3cnn(C)c3)c2)cc1	17396727	YKFRNWFLULYNOB-UHFFFAOYSA-N	429.458	1.304	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2ccc(Br)cc2)cc1	17406311	WSLLMLCBPNOHBV-UHFFFAOYSA-N	440.319	1.839	50	20	IDGD	
CC[C@@H](C)NS(=O)(=O)c1ccc(C(=O)OCC(=O)NNC(=O)c2ccccc2)cc1	24203889	LPCQOJOXLQTFOQ-CQSZACIVSA-N	433.486	1.381	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)N1CCN(Cc2cccc3ccccc23)CC1	725871909	IJARBNGTTZQYKK-UHFFFAOYSA-N	435.484	1.721	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1ccc(CS(C)(=O)=O)o1	726045886	MEFLDIIHJHCTSU-UHFFFAOYSA-N	444.849	1.104	50	20	IDGD	
Cc1nn(-c2ccccc2)cc1C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	726522114	AUWANGWNFCDIMF-UHFFFAOYSA-N	433.877	1.556	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NNC(=O)c2cc(Br)c[nH]2)cc1C(=O)O	727720722	VUDFPHHFSCHCHL-UHFFFAOYSA-N	432.252	1.497	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1)N1C(=O)CCC1=O	727733109	XJBVVJQEGMGKQS-OXJNMPFZSA-N	434.496	1.298	50	20	IDGD	
CN(C)N(C(=O)c1cc(N2CCCC2=O)cc(C(F)(F)F)c1)[C@H]1CCS(=O)(=O)C1	728232830	AAWVVOVKKZFPRO-AWEZNQCLSA-N	433.452	1.938	50	20	IDGD	
Cc1nnnn1[C@@H](Cc1cccc(F)c1)C(=O)NNC(=O)c1cccc(OC(F)F)c1	728485165	QZNFRBOEWGVQKG-INIZCTEOSA-N	434.378	1.967	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cccc(C(=O)N(C)C)c2)c1	728511751	CULIEVISYKZWSM-UHFFFAOYSA-N	446.529	1.494	50	20	IDGD	
CSCC[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)NNC(=O)Cc1cccnc1	728892713	DPFRZTJUYQOUEH-MRXNPFEDSA-N	431.474	1.231	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)NCCCCN2CCN(c3ncccn3)CC2)c1	729232379	FCDAZYUQEJDSPN-UHFFFAOYSA-N	440.552	1.089	50	20	IDGD	
NC(=O)[C@H]1CCCN(CCCNC(=O)NNC(=O)c2ccc(Br)s2)C1	729494844	GOMXEGXBCFSYHY-JTQLQIEISA-N	432.344	1.042	50	20	IDGD	
Cc1nc(-c2ncccn2)nc(O)c1CC(=O)NNC(=O)c1cccc(OC(F)F)c1	729533699	QPBLLFBZMZZZCF-UHFFFAOYSA-N	430.371	1.553	50	20	IDGD	
CC[C@H](NC(=O)NNC(=O)COc1ccc(OC)cc1)c1cccc(S(N)(=O)=O)c1	729612183	BEVZFJHJWPKGBQ-KRWDZBQOSA-N	436.490	1.203	50	20	IDGD	
CC(C)(C)CC(=O)N1CSC[C@H]1C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	730076902	CKVWTMPHVBGBRL-HNNXBMFYSA-N	434.566	1.178	50	20	IDGD	
COc1ccc(CCN2C[C@@H](C(=O)NNC(=O)c3ccccc3OC)CC2=O)cc1OC	731490992	GHMGYQSNOIUXGL-INIZCTEOSA-N	441.484	1.565	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)CN1C(=O)N[C@@](C)(c2ccc(OC)cc2)C1=O)c1ccccc1	731995904	CRZMJHFGBVSBLW-MBSDFSHPSA-N	438.484	1.803	50	20	IDGD	
COc1ccc(-n2c(C)cc(/C=C(\C#N)C(=O)N3CCN(S(N)(=O)=O)CC3)c2C)cc1	732066055	GSOHVKKSKBQOGK-QGOAFFKASA-N	443.529	1.357	50	20	IDGD	
Cc1ccc(-n2nnc(C(=O)OCC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)c2C)cc1	732330851	YJJFWFWYQKDTNZ-UHFFFAOYSA-N	438.400	1.410	50	20	IDGD	
CN(CC(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12)C(=O)C1CC1	733124086	RGDHLJGTVNNNOS-UHFFFAOYSA-N	433.468	1.074	50	20	IDGD	
CCS(=O)(=O)C[C@@H](C)NC(=O)NNC(=O)COc1ccccc1Cc1ccccc1	733660146	MTRYHVDTINQVFJ-MRXNPFEDSA-N	433.530	1.810	50	20	IDGD	
CC(C)C(CNC(=O)c1ccc([N+](=O)[O-])cc1)=NNC(=O)c1ccc(-n2cnnn2)cc1	734745523	NSAYEWFYNVSATL-UHFFFAOYSA-N	436.432	1.742	50	20	IDGD	
C[C@@H](CN1CCN(c2ccccn2)CC1)NC(=O)NNC(=O)c1cccc(N(C)C)c1	735519065	PNEPDNBXOURSIH-KRWDZBQOSA-N	425.537	1.302	50	20	IDGD	
Cc1cc(Br)c2c(c1)C(=NNC(=O)c1ccc(-n3cnnn3)cc1)C(=O)N2	735612654	RWJUQERZISNVMS-UHFFFAOYSA-N	426.234	1.819	50	20	IDGD	
C=CCNC(=S)NNC(=O)[C@H](Cc1c[nH]c2ccc(Br)cc12)NC(C)=O	743819586	AAONNGMULNMPMX-HNNXBMFYSA-N	438.351	1.659	50	20	IDGD	
CCc1ccccc1NC(=O)CN1CCN(CC(=O)NNC(=O)c2cccc(C)c2)CC1	744385901	YWFGKVFHLRDUFP-UHFFFAOYSA-N	437.544	1.575	50	20	IDGD	
CN(C)C(=O)C[C@@H](NC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)c1ccccc1	745771439	AJFBCXGZXURGLO-QGZVFWFLSA-N	447.517	1.645	50	20	IDGD	
COc1cccc(N2CCC[C@H](NC(=O)NNC(=O)c3cc([N+](=O)[O-])ccc3O)C2)c1	745832541	YWBQEONWKAPSED-ZDUSSCGKSA-N	429.433	1.922	50	20	IDGD	
C[C@]1(NNC(=O)NCCOc2ncc(C(F)(F)F)cc2Cl)CCS(=O)(=O)C1	745846164	DRTMVJYMSZTXKS-ZDUSSCGKSA-N	430.836	1.514	50	20	IDGD	
Cc1ccc(N2CCC[C@@H](NC(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)C2)cc1	745887876	LZTZPYMEMPKGKV-MRXNPFEDSA-N	434.500	1.855	50	20	IDGD	
O=C(NCCOC1CCC1)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	745905201	WMBKTVXWKZPWTG-UHFFFAOYSA-N	446.529	1.678	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)[C@@H]2CCCN2Cc2ccccn2)c2ccccc2c1=O	746096472	GRZGBIAQWNQSFA-IBGZPJMESA-N	434.500	1.798	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1ccccc1OCc1cn2ccccc2n1	746367097	HBMHZAVJTVMEBG-CQSZACIVSA-N	428.470	1.109	50	20	IDGD	
COC(=O)c1ccsc1N1CC[C@H](NC(=O)NNC(=O)COc2ccc(C)cc2)C1=O	746779880	LRFFCKIFEIOTMA-HNNXBMFYSA-N	446.485	1.358	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)NC2CCC(C(N)=O)CC2)c2ccccc2c1=O	747584201	RYCQLNFWYLOVAT-UHFFFAOYSA-N	442.520	1.575	50	20	IDGD	
CCc1nc(C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)nn1-c1c(Cl)cccc1Cl	748613257	JKKZCQGXQZQELN-VIFPVBQESA-N	446.316	1.332	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCCNC(=O)Cc2cccc(F)c2)ccc1OC(C)C	749013891	AWTJTOJCIJBNPN-UHFFFAOYSA-N	446.479	1.924	50	20	IDGD	
CCOc1cc(C(=O)NNS(=O)(=O)c2cn(C)c(C)n2)cc(OCC)c1OCC	750569027	RNAQQRPUVCJDEU-UHFFFAOYSA-N	426.495	1.548	50	20	IDGD	
Cc1nc(S(=O)(=O)NCC(=O)NNC(=O)c2cc3c(s2)CCCCCC3)cn1C	750664030	WDZGISJDFNPELI-UHFFFAOYSA-N	439.563	1.189	50	20	IDGD	
Nc1cc(Br)ccc1C(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	751770661	ANOFWWRNUIDVCO-UHFFFAOYSA-N	437.206	1.558	50	20	IDGD	
CC[C@H](NC(=O)/C(C#N)=C/c1cc(C)n(C[C@H]2CCCO2)c1C)C(=O)N1CCOCC1	752480862	BZHDDHUBVQVCMM-DZQQXJBLSA-N	428.533	1.945	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)c2nc(-c3cnn(C)c3)oc2C)cc1C	752600044	PDUQLLNCGAQIGV-UHFFFAOYSA-N	431.474	1.934	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)N[C@@H]1CCN(Cc2ccc(C#N)cc2)C1=O	753034173	UMGJEIMKORDAMT-QGZVFWFLSA-N	437.456	1.077	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)NC[C@H]2CCCN2S(C)(=O)=O)c(C)n1C[C@H]1CCCO1	753144549	RTHZQRCABHCJAA-LDWJFSKOSA-N	434.562	1.731	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2ccc(C(=O)NC3CC3)cc2)c2ccccc2c1=O	755581082	UDLPRQZWFFXLGU-UHFFFAOYSA-N	434.456	1.775	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1csc([C@H]2CCCO2)n1	756003286	MPWCDSRSVBIRHD-QGZVFWFLSA-N	443.529	1.214	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)Nc2ccc(S(=O)(=O)/N=C3/CCCCCN3C)cc2)n[nH]1	756112550	CWQCBUBQNUPSFA-UQQQWYQISA-N	447.521	1.778	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)c2ccc(C#N)cc2)ccc1S(=O)(=O)N1CCCC1	756585381	KGHGOLIZUOKCEW-UHFFFAOYSA-N	443.485	1.818	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)N[C@@H]1CCN(C(=O)CCc2ccccc2)C1	756916450	BZEWFLORCOZQFF-GOSISDBHSA-N	440.500	1.638	50	20	IDGD	
CCS(=O)(=O)N1CCC(CNC(=O)NNC(=O)CSc2ccc(C)cc2)CC1	758746732	YHQXKNKJGRADLJ-UHFFFAOYSA-N	428.580	1.479	50	20	IDGD	
CC[C@H](CN1CCCC1)NC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	758847644	FSFUSZNGHWMFEC-QGZVFWFLSA-N	437.566	1.290	50	20	IDGD	
CC1(C)C(=O)N(C[C@@](C)(O)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c2ccccc21	760036320	GENNVHGNPPSPAR-OAQYLSRUSA-N	426.429	1.431	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)[C@](C)(O)CN2C(=O)C(C)(C)c3ccccc32)c1	760052246	AUKZNMHOZNVNME-XMMPIXPASA-N	439.512	1.905	50	20	IDGD	
C[C@@]1(c2ccc(Br)cc2)NC(=O)N(CC(=O)NNc2ncc(F)cn2)C1=O	760906911	WUXNVHKIGNTYKC-INIZCTEOSA-N	437.229	1.289	50	20	IDGD	
CN(C1CCCCC1)S(=O)(=O)c1ccccc1NC(=O)C(=O)NNC(=O)C(C)(C)C	761071394	FQCQQVRBIKMXBV-UHFFFAOYSA-N	438.550	1.772	50	20	IDGD	
Cc1cn2ccnc(C(=O)NNC(=O)CN3CCN(Cc4ccccc4Cl)CC3)c2n1	762085257	CAVRSNWSIVWVFH-UHFFFAOYSA-N	441.923	1.270	50	20	IDGD	
CC(C)N(CC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)CC(=O)Nc1ccc(F)cc1	762266718	SAUSRIJYOMKYKG-UHFFFAOYSA-N	431.424	1.844	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1cc(F)ccc1OC[C@H]1CCCO1	763467311	BPYAVTJOMNVKMW-OAHLLOKOSA-N	446.391	1.691	50	20	IDGD	
O=C(NNC(=O)c1ccccc1O)C(=O)Nc1cc2c(cc1Br)OCCO2	763527443	JRFZUMWPOZGFAR-UHFFFAOYSA-N	436.218	1.326	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3c(cnn3C(F)F)c2)cc1OC	763550411	LYTSHHPCZLFJLH-UHFFFAOYSA-N	433.371	1.848	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)C(=O)Nc1ncn(Cc2ccc(Cl)cc2)n1	763558967	PBWNNVAEYXSFTN-UHFFFAOYSA-N	442.819	1.108	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1ccc(OCCCN(C)C)cc1	763629174	PKXMEUPBBSCSBN-UHFFFAOYSA-N	438.488	1.373	50	20	IDGD	
COC(=O)[C@@H](C)Cc1ccc(NC(=O)C(=O)NNC(=O)COc2cc(C)cc(C)c2)cc1	763648907	GZOPITSYXCHZNA-INIZCTEOSA-N	441.484	1.820	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccnc(OCC(F)(F)F)c1	763661785	BZPHIAYXJTWIPU-UHFFFAOYSA-N	442.350	1.196	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2ccc(N3CCOCC3)nc2C)c1	763668544	NNYAIKBSABMCHC-UHFFFAOYSA-N	441.488	1.008	50	20	IDGD	
Cc1ccccc1-c1cc(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)n(C)n1	763737163	YMHSORZOPSHCMX-UHFFFAOYSA-N	446.511	1.934	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccccc2C(=O)N2CCCCC2)c1	763754520	TZNJBORRSDSNKQ-UHFFFAOYSA-N	437.500	1.778	50	20	IDGD	
COCc1cccc(NC(=O)C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)c1	763789743	AMOWIXAFRDEMDW-UHFFFAOYSA-N	437.456	1.524	50	20	IDGD	
CC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)cc1C	763790470	JUOCCQHPEKWSIF-UHFFFAOYSA-N	449.467	1.888	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccc(N2CCCCC2=O)c1	763806311	AUUXKJURJNYPQG-UHFFFAOYSA-N	435.440	1.240	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)CNC(=O)c1sc2ccccc2c1Cl	763824309	NEJNZLVQTQLMQH-UHFFFAOYSA-N	445.888	1.257	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cccc(C(=O)OC)c2C)cc1	763861922	TZXYSBYCSYKDNB-CQSZACIVSA-N	443.456	1.734	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)C(=O)Nc2ccn(-c3ncccc3F)n2)cc1	763895839	IGUKVCDBEQYAMX-UHFFFAOYSA-N	428.449	1.593	50	20	IDGD	
O=C(CCSc1ccc(F)cc1)NNC(=O)C(=O)Nc1cnn(Cc2ccncc2)c1	763901534	HSKMRHGAAPVWLS-UHFFFAOYSA-N	442.476	1.734	50	20	IDGD	
O=C1CCc2cc(NC(=O)C(=O)NNC(=O)c3ccc(Br)s3)ccc2N1	763939539	AZVZCTBWPPCOLC-UHFFFAOYSA-N	437.275	1.795	50	20	IDGD	
O=C(NNC(=O)c1ccc(Br)s1)C(=O)Nc1ccn(-c2ccncc2)n1	763940523	SNZUXGUVFVQVQD-UHFFFAOYSA-N	435.263	1.491	50	20	IDGD	
CON(C)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)C2=S=C3CC[C@@H](C)CC3=C2)cc1	763951002	XZZGANBSVQPHDZ-GFCCVEGCSA-N	444.513	1.244	50	20	IDGD	
NC(=O)c1n[nH]c2ccc(NC(=O)C(=O)NNC(=O)c3cc4c(s3)CCCCC4)cc12	763968402	OTPWLDQLASQBQM-UHFFFAOYSA-N	440.485	1.392	50	20	IDGD	
COc1cc(C)c(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)cc1OC	763995179	NUOMWNOXPUUXJZ-UHFFFAOYSA-N	425.239	1.503	50	20	IDGD	
COC(=O)N(C)Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2OC)cc1	764010987	FCCKTQUAQRTBOT-UHFFFAOYSA-N	448.863	1.947	50	20	IDGD	
O=C(NNC(=O)c1ccc(F)cc1Br)C(=O)Nc1ccccc1-n1ccnn1	764086240	POELJJWUPCWYAY-UHFFFAOYSA-N	447.224	1.569	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)CC(F)(F)F)cccc1C(=O)N1CCSCC1	764115591	TXAJHNOHDWDZTK-UHFFFAOYSA-N	432.424	1.222	50	20	IDGD	
CC(C)(C)NC(=O)c1ccccc1NC(=O)C(=O)NNC(=O)COc1ccccc1O	764278038	PIQWFJBRFJEYBL-UHFFFAOYSA-N	428.445	1.085	50	20	IDGD	
Cn1ccnc1Sc1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2O)cc1	764278137	SGXQKXOCGWDRSE-UHFFFAOYSA-N	441.469	1.442	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)C(=O)Nc1ccc(CCN2CCOCC2)cc1)c1ccccc1	764328356	PHSWFKAXBJTUIN-OAQYLSRUSA-N	438.528	1.841	50	20	IDGD	
CN(C)c1ccc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1Cl	764342991	LINHWAIOQVVDIY-UHFFFAOYSA-N	426.864	1.991	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)NC[C@H](c1cccc(F)c1)N1CCOCC1	765702743	FQILEFAVSUMWPK-GOSISDBHSA-N	436.509	1.929	50	20	IDGD	
O=C(CCc1nc2ccccc2o1)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765733622	NYXVJWBXVZWOKZ-UHFFFAOYSA-N	435.484	1.366	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1cccc(-c2nc[nH]n2)c1	767817513	WUKQTQIHHSRIGD-UHFFFAOYSA-N	429.820	1.752	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)CCNS(=O)(=O)c3cccnc3)n[nH]2)c1	768270078	VMPRYYBUHYXHAL-UHFFFAOYSA-N	442.501	1.218	50	20	IDGD	
Cn1ccnc1[C@@](O)(CC(=O)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1)C(F)(F)F	768275803	DKCBOWOTKCJTLX-KRWDZBQOSA-N	440.357	1.551	50	20	IDGD	
COCCn1nc(C(=O)NNC(=O)COc2ccc(-c3ccc(C#N)cc3)cc2)ccc1=O	768289094	SLPDQCNESUUFII-UHFFFAOYSA-N	447.451	1.268	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3ccc([N+](=O)[O-])c(O)c3)CC2)cc1	768292154	WYPJIHPNQZMWSM-UHFFFAOYSA-N	427.461	1.188	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)CN2C(=O)N[C@]3(CCCC(C)(C)C3)C2=O)c(C)c1	768928493	QFYBOJXMHZFNSU-QFIPXVFZSA-N	429.521	1.754	50	20	IDGD	
COCCCS(=O)(=O)N1CCN(S(=O)(=O)c2ccc(CCCCl)cc2)CC1	769930277	OIYYJZHEACNUTJ-UHFFFAOYSA-N	438.999	1.531	50	20	IDGD	
CCN1CCN(c2cccc(NC(=O)C(=O)NNC(=O)Cc3ccc(Cl)cc3)c2)CC1	770771726	NRTFUNUHGNNGJI-UHFFFAOYSA-N	443.935	1.811	50	20	IDGD	
C[C@H]1CN(c2ccnc(C(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)c2)C[C@H](C)O1	770813730	OYYLSTFRQKKZHO-KBPBESRZSA-N	436.472	1.017	50	20	IDGD	
CCOC(=O)CON=C(C(=O)NNC(=O)c1cc2c(s1)CCCCC2)c1cc[nH]n1	770822309	BKHLQKJITMODJM-UHFFFAOYSA-N	433.490	1.485	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)[C@H]1CCCN1C(=O)c1ccccc1OC(F)F	772017786	XMJGMGMVBRLGNE-WCQYABFASA-N	427.404	1.382	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)[C@@H]1CC(=O)N(Cc2ccccc2)C1	772199258	NGZMLEJBKJPZKH-MRXNPFEDSA-N	428.876	1.152	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)c(Cl)c1)Nc1cnn(Cc2nnc3n2CCCC3)c1	772636948	YARBHOHGYAFZSK-UHFFFAOYSA-N	430.856	1.685	50	20	IDGD	
COC(=O)c1ccc(OC)c(S(=O)(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)c1	773264543	KYMYBNRCFOGVNE-NSHDSACASA-N	442.877	1.912	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)C(=O)Nc2cccc(Cn3nc4ccccn4c3=O)c2)n1	773478152	IYGSQQLXVIQOMV-UHFFFAOYSA-N	432.444	1.033	50	20	IDGD	
CCCN1CCN(c2ccc(NC(=O)C(=O)NNc3nccc(OC)n3)cc2Cl)CC1	773725988	FBNXILDKZUCWNR-UHFFFAOYSA-N	447.927	1.752	50	20	IDGD	
CNC(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)cc1	774011337	YAEZQJGYUFGEKD-GFCCVEGCSA-N	432.864	1.182	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)CN[C@@H](C)c1cccc(S(=O)(=O)N(C)C)c1	775341271	XWWKDZXQTWZUDS-INIZCTEOSA-N	432.546	1.286	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cccc(Br)n3)CC2)cc1	775616741	KWSOGIKQFYASBG-UHFFFAOYSA-N	446.349	1.731	50	20	IDGD	
O=C(NCCc1ccc(OCC(F)(F)F)nc1)NNC(=O)c1cc([N+](=O)[O-])ccc1O	776243568	FCZUKODGSHRYDB-UHFFFAOYSA-N	443.338	1.823	50	20	IDGD	
O=C(NNC(=O)N1CC[C@@H](n2cncn2)C1)[C@@H]1Cc2ccccc2CN1Cc1ccccc1	776868443	ZGHDKCRTHUTMEB-YADHBBJMSA-N	445.527	1.893	50	20	IDGD	
COC(=O)c1ccccc1NNC(=O)c1ccc(S(=O)(=O)NC[C@H]2CCCO2)cc1	777773140	UFLXVMBFVQHTTK-OAHLLOKOSA-N	433.486	1.687	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)/C=C/c1ccc(I)o1	778438356	PHZYFZHFLGTAEV-FNORWQNLSA-N	435.218	1.570	50	20	IDGD	
CCOc1ccc(/C=C(/C#N)C(=O)N2CCC[C@@H](S(=O)(=O)N3CCOCC3)C2)cc1	779581858	CIEAIKBCYIOETO-BKHFDQEPSA-N	433.530	1.645	50	20	IDGD	
CCCCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(O)cc2)cc1	782834018	PIBJETWVKRAMCT-UHFFFAOYSA-N	434.474	1.334	50	20	IDGD	
Cc1ccc(Br)cc1NC(=O)C(=O)NNC(=O)Cc1nc2ccccc2n1C	782883503	ANLVZDZBSDPRRM-UHFFFAOYSA-N	444.289	1.973	50	20	IDGD	
Cc1nc2ccc(NC(=O)C(=O)NNc3ccc(S(=O)(=O)NC(C)C)cn3)cc2o1	783264430	PNJOPZVGHBOQOZ-UHFFFAOYSA-N	432.462	1.300	50	20	IDGD	
O=C(NNc1nccc2sccc12)C(=O)Nc1ccccc1C(=O)N1CCOCC1	783445527	QYOYWIAOQVPPJL-UHFFFAOYSA-N	425.470	1.851	50	20	IDGD	
COc1ccc(Cn2nccc2NC(=O)C(=O)NNc2cccc(OC)n2)c(OC)c1	784848593	UHDMNMLIISZHBM-UHFFFAOYSA-N	426.433	1.434	50	20	IDGD	
CCCNC(=O)[C@H]1CN(C(=O)C(=O)NNc2ccc(C#N)c(Cl)c2)c2ccccc2O1	785085679	CGZWQJQSRVPXEV-GOSISDBHSA-N	441.875	1.975	50	20	IDGD	
CN(NC(=O)Nc1ccc(-n2nccn2)nc1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	785839114	OVILREHSVDEISF-UHFFFAOYSA-N	445.484	1.303	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)N[C@H]1CCc2cc(C#N)ccc21	787429844	HLBOBIFOBRBAQH-INIZCTEOSA-N	426.502	1.791	50	20	IDGD	
CCNC(=O)Nc1ccc(C)c(NC(=O)C(=O)NNC(=O)COc2cc(C)ccc2C)c1	787541070	LBZOCRYRCVMRFZ-UHFFFAOYSA-N	441.488	1.918	50	20	IDGD	
C[C@@H]1CCC[C@@H](C)N1C(=O)COc1ccc(C(=O)NNC(=O)N2CCN(C)CC2)cc1	788165563	CPWJBBJGVHWCMK-IAGOWNOFSA-N	431.537	1.457	50	20	IDGD	
CS(=O)(=O)CC[C@H](C(=O)NNC(=O)C1CCN(c2ncccn2)CC1)c1ccccc1	789931111	OKMPCUSCYAHPOM-SFHVURJKSA-N	445.545	1.059	50	20	IDGD	
C[C@H](CN1CCOCC1)N(C)C(=O)CCC(=O)C(C#N)=C1N(C)c2ccccc2N1C	790134848	DCJIHURYUKXNRK-QGZVFWFLSA-N	425.533	1.836	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)[C@H](CNC(=O)OC(C)(C)C)c3ccc(F)cc3)nc21	792181067	WISOJDDWPJBGFM-CYBMUJFWSA-N	445.455	1.960	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)C(=O)Nc1ccc(Cc2nnc3n2CCC3)cc1	792266287	PJUUUYKBKVBYEO-UHFFFAOYSA-N	448.483	1.239	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)nc1Br	793022884	DPVFBDDQAAQPDP-GFCCVEGCSA-N	435.234	1.078	50	20	IDGD	
COc1cc(C=NNC(=O)c2ccc(O)c(O)c2)ccc1OCC(=O)N1CCOCC1	794555583	FEGPQZOFUFHLLM-UHFFFAOYSA-N	429.429	1.108	50	20	IDGD	
COc1ccc(C(=O)N2CCN(C)CC2)cc1NC(=O)NNC(=O)c1cccc(C)n1	797618232	CDIZTGJMBVIADK-UHFFFAOYSA-N	426.477	1.253	50	20	IDGD	
CC(=O)N[C@@](C)(C(=O)NNc1ccc(C(F)(F)F)cn1)c1ccc(S(C)(=O)=O)cc1	797752409	DSNKZLIGXYKYPP-QGZVFWFLSA-N	444.435	1.999	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H](O)[C@H](O)c2nc3ccccc3s2)cc1C	798308366	WWDOWPSIEHCIPC-CVEARBPZSA-N	428.470	1.094	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1ccc(NCC2CC2)nc1	800693531	UWOQOUGRYVPIEO-UHFFFAOYSA-N	436.516	1.123	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)c2cncc(-n3ccnn3)c2)cc1	801797541	JIPCSHGKSALQDO-UHFFFAOYSA-N	435.473	1.158	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)c2ccc(S(=O)(=O)N(C)C)o2)c(OC)cc1Cl	802081994	LNZREZVXQZYWQG-UHFFFAOYSA-N	446.869	1.667	50	20	IDGD	
O=C(CCN1C(=O)[C@H]2[C@H](C1=O)[C@H]1CC[C@H]2O1)NNC(=O)Nc1ccc(Cl)cc1Cl	802086316	AWSMEADTMLMRTD-QHSBEEBCSA-N	441.271	1.699	50	20	IDGD	
Cc1nc(S(=O)(=O)NCCC(=O)NNC(=O)Nc2ccc(Cl)cc2Cl)cn1C	802094588	ZMSMHIYASZPQTM-UHFFFAOYSA-N	449.320	1.557	50	20	IDGD	
COc1ccc(Cl)c(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)OC)c2)c1	802111569	MLTLEHOVLFNMRY-UHFFFAOYSA-N	442.881	1.997	50	20	IDGD	
CS(=O)(=O)CC[C@@H](NC(=O)c1ccc(Cl)cc1)C(=O)NNc1cccc(F)n1	804764645	ZBPBVPJPFJUXHC-CYBMUJFWSA-N	428.873	1.551	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)c2c[nH]c3c(F)cc(F)cc3c2=O)c2ccccc2c1=O	806273240	RNHGJLRQPIZPNS-UHFFFAOYSA-N	425.351	1.128	50	20	IDGD	
Cc1c(C(F)(F)F)nn(C)c1NC(=O)C(=O)NNC(=O)c1cccc(Br)c1	806976878	YSBYIOOEBFUMCY-UHFFFAOYSA-N	448.199	1.910	50	20	IDGD	
Cc1cc([N+](=O)[O-])ccc1NNC(=O)C(=O)Nc1ccc(F)c(N2C(=O)CCC2=O)c1	807456801	UNIKKRYVDJNOSN-UHFFFAOYSA-N	429.364	1.778	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)c1c(F)ccc(O)c1F	809725330	PDLDNTUPWFCHIF-UHFFFAOYSA-N	438.862	1.903	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2cc(F)c(F)cc2OC)c2ccccc2c1=O	810386259	RSKMRYNYOSRIGK-UHFFFAOYSA-N	445.382	1.103	50	20	IDGD	
CCOCC(C)(C)CNC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	812435684	QVRUJRDNOJJDLE-UHFFFAOYSA-N	426.539	1.478	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)N[C@H]2CC(=O)N(c3ccccc3F)C2)cc1	812932218	OHHBODGQVMVBLQ-ZDUSSCGKSA-N	449.464	1.370	50	20	IDGD	
COc1ccccc1SCC(=O)NN=C(C)c1ccc(S(=O)(=O)CC(N)=O)cc1	814889062	FLABRLCSAVPZDN-UHFFFAOYSA-N	435.527	1.587	50	20	IDGD	
CC(=NNC(=O)Nc1ccc(S(N)(=O)=O)cc1)c1ccc(N2C(=O)CCC2=O)cc1	814963845	ITJLPKQSFRTDFZ-UHFFFAOYSA-N	429.458	1.533	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1)C1CC1	815563563	HCNXIYHGYKRBRI-UHFFFAOYSA-N	425.401	1.510	50	20	IDGD	
CNC(=O)Oc1cccc(NC(=O)C(=O)NNC(=O)c2cccc(Br)c2)c1	815567847	NTUNUTAVCWIDIL-UHFFFAOYSA-N	435.234	1.567	50	20	IDGD	
CC(C)(C)Cc1nc2cc(NC(=O)C(=O)NNC(=O)[C@H]3CCc4nncn4C3)ccc2o1	815691279	KTUITLBOWLTBID-LBPRGKRZSA-N	439.476	1.356	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)C1CCC(OC[C@H]2CCCO2)CC1	815933855	CKYZBUSKYACURL-VMWRSERWSA-N	437.924	1.858	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)[C@H]2CCCCN2S(C)(=O)=O)c1	818745525	JJWZLVNFFHZDOK-CYBMUJFWSA-N	434.312	1.493	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(\C#N)C(=O)O[C@H](C)C(=O)N2CCC[C@@H](C(N)=O)C2)c1C	913150254	QQHMEDGSGSJBTA-OLQIEIBPSA-N	444.532	1.875	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCCC3)cc2)cc1	913429696	STBWCFPRLLFKSV-UHFFFAOYSA-N	446.529	1.743	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)c1cccc(S(=O)(=O)NC2CCCC2)c1	913475428	WPHXMNBAXRAYMH-UHFFFAOYSA-N	445.497	1.754	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)c2cccc(S(=O)(=O)NC3CCCC3)c2)cc1	913476949	RLIJEPWADWUPFM-UHFFFAOYSA-N	446.529	1.789	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)[C@@H]1CC(c2cccc(F)c2)=NO1	915132478	CWHCHAYBECGNNJ-NRFANRHFSA-N	439.491	1.678	50	20	IDGD	
CC(C)OCCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	915887834	BMKCZDLCWZRAEL-UHFFFAOYSA-N	426.539	1.620	50	20	IDGD	
CCC(CC)[C@@H](CNC(=O)NNC(=O)c1nnc(O)c2ccccc12)N1CCOCC1	916256122	NGZVIUYGEOQBQB-QGZVFWFLSA-N	430.509	1.416	50	20	IDGD	
C[C@@H]1CN(c2ccc(CNC(=O)NNC(=O)c3cc(Br)c[nH]3)cn2)CCO1	916392673	HIMDOZSOLLIRPC-LLVKDONJSA-N	437.298	1.542	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NC2CCC3(CC2)OCCO3)c2ccccc2c1=O	916412885	QLBMQIZYBANWSQ-UHFFFAOYSA-N	443.504	1.826	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCc2cccc(C(=O)NC3CC3)c2)c2ccccc2c1=O	916648142	BZFCCRASRMBLPZ-UHFFFAOYSA-N	448.483	1.453	50	20	IDGD	
CCc1n[nH]cc1C(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2OC)c1	917899563	HIDRPAMMFCEPAV-UHFFFAOYSA-N	443.485	1.856	50	20	IDGD	
CCN1C(=O)c2ccc(C(=O)NNC(=O)c3cc(-c4ccccc4)on3)cc2S1(=O)=O	917976466	INAZWWHMESOCGG-UHFFFAOYSA-N	440.437	1.581	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NC[C@H](C)CN2CCCC2)c2ccccc2c1=O	918224079	XULVVZUBBZEUTK-INIZCTEOSA-N	428.537	1.873	50	20	IDGD	
COCCOc1ccccc1CNC(=O)NNc1ccc(S(=O)(=O)NC(C)C)cn1	919658206	GWPSWMGRBPYCRX-UHFFFAOYSA-N	437.522	1.620	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)NCCC(=O)N[C@@H]2CCS(=O)(=O)C2)c(C)n1CC(C)C	919715445	VWUGQKMVDXRQCO-XLYVWGIVSA-N	434.562	1.478	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)c1ccc(OC)c(S(=O)(=O)NC2CC2)c1	919820494	ILFXIAXPBHUWMT-UHFFFAOYSA-N	433.486	1.148	50	20	IDGD	
Cc1nn(C)c2nc(Cl)c(C=NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)cc12	920363166	UKXJGLCDCPRWLM-UHFFFAOYSA-N	434.909	1.944	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@@H]2C(=O)NNC(=O)NCCc2cccs2)s1	920859345	GPVWQLPEPVNBRZ-CQSZACIVSA-N	442.588	1.844	50	20	IDGD	
O=C(NCCCCN1C(=O)c2ccccc2C1=O)NNC(=O)c1cncn1-c1ccccc1	1116039541	DSABGTUJUXEANV-UHFFFAOYSA-N	446.467	1.893	50	20	IDGD	
C[C@@]12CCC(=O)N1c1ccccc1C(=O)N2CC(=O)NNC(=O)c1n[nH]c2c1CCCC2	1248613229	YTGRQHYFFHRUKE-QFIPXVFZSA-N	436.472	1.049	50	20	IDGD	
COc1cc(F)c(S(=O)(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)c(F)c1	1318558580	RYUXLLFXNUGWCU-UHFFFAOYSA-N	449.476	1.930	50	20	IDGD	
CCOC(=O)COc1ccc(C=NNC(=O)Cc2csc(N3CCOCC3)n2)cc1	1318945035	CUGJIDQLUHWJTQ-UHFFFAOYSA-N	432.502	1.614	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1sc3nccnc3c1N)CCO2	1779295941	GQSAXNFCFZPIDO-LJQANCHMSA-N	449.609	1.569	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](NC(C)=O)c3ccc(F)cc3)C2)C1	1780915152	LVVHZYLMBYRFCS-UEXGIBASSA-N	439.915	1.850	50	20	IDGD	
O=C([C@H](O)CCl)N1CCO[C@]2(CCN(C(=O)C3(c4ccc(F)c(F)c4)CC3)C2)C1	1780922620	PZASRMSHKXSMEW-VQIMIIECSA-N	428.863	1.426	50	20	IDGD	
C#CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](Cl)CC)C2)C1	1781223285	KSUIHAVLAIXWHF-QYWGDWMGSA-N	441.956	1.750	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@](C)(Cl)CCl)C2)C1	1781231907	GQFJDYYPAUOBEJ-VZJWBNGJSA-N	447.359	1.808	50	20	IDGD	
O=C(c1ccc(Br)c(O)c1)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1781694957	IKHOHIMKRNMNLS-RHSMWYFYSA-N	447.713	1.198	50	20	IDGD	
COC(=O)C1(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](C)Br)C3)CC1	1781813415	GTPBOEZUFVHEBZ-OGHNNQOOSA-N	431.327	1.237	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc([N+](=O)[O-])o1)C2	1782168612	RTNHLKBZNZSXBJ-RVZJWNSFSA-N	429.857	1.569	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)nc2nccn12	1782354342	JEHSRCJIFDSMGA-OALUTQOASA-N	440.331	1.718	50	20	IDGD	
Cc1cc(C)n(CCC(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](O)CCl)C3)n1	1782433832	OTAFHMZXMSTMBR-SQGPQFPESA-N	426.945	1.004	50	20	IDGD	
COc1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](O)CCl)C3)ccc1F	1782916363	PITNZRFVERECAE-XAUMDUMWSA-N	428.888	1.562	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cnc(OC)cn3)CCO2)C1	1783342658	DBWJAYFEGFDSJT-SJCJKPOMSA-N	427.299	1.102	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](C)Nc1cnccn1)CCO2	1783349661	QOYYEZVSKUHDHC-GLJUWKHASA-N	440.342	1.280	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](C)Nc1cccnc1)CCO2	1783532486	IUVPLJYAYGLQFN-DEYYWGMASA-N	425.327	1.495	50	20	IDGD	
COc1cc(F)cc(/C=C/C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)c1	1783692769	MFNVUGFVYIVMTR-VVAQPZBCSA-N	426.872	1.277	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3c[nH]c4ccc(OC)cc34)CCO2)C1	1783877955	SFOHKTKXDITEFW-LAUBAEHRSA-N	435.908	1.874	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3C[C@@H]3C3CC3)[C@H]2C1	1783942435	QSZPYPRIDCAJDN-BJQHLOBUSA-N	441.532	1.146	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]3C2)n(-c2ccccc2)n1	1784091127	VZCPAKDJGSGJLL-UHMOLFJZSA-N	446.935	1.374	50	20	IDGD	
COc1ccc2[nH]cc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]4C3)c2c1	1784093292	TYCHWENEYRJMKQ-DMBMUNPASA-N	435.908	1.370	50	20	IDGD	
Cc1nc(O)c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Br)C[C@@H]32)nc1C	1785575945	XFNVOZSEFITMIV-MNXVOIDGSA-N	445.289	1.083	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CCc4nc[nH]c4C3)C[C@@H]21	1786407721	NTHFYUCKSNZIMU-WSMBLCCSSA-N	439.354	1.279	50	20	IDGD	
Cc1c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Cl)C[C@@H]32)ccc2c1OCCO2	1787360171	ILICIJMKMDGBHI-GKEYINFOSA-N	426.872	1.894	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cn4cccnc4n3)[C@H]2C1	1788311245	OZPDNBCWQVESTJ-VODUFIJXSA-N	440.331	1.559	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc([N+](=O)[O-])[nH]3)[C@H]2C1	1789389256	CQXSTIOOAXCJPX-MNXVOIDGSA-N	443.298	1.547	50	20	IDGD	
COc1cccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Br)C[C@@H]32)c1	1789539974	ZHEQVHQGCBCOBI-QCEMKRCNSA-N	429.286	1.979	50	20	IDGD	
CCOc1cccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]32)c1	1789669698	SWDYQVIWSLCFMG-IHPCNDPISA-N	446.548	1.052	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CC=CC[C@@H]3C(=O)OC)C[C@@H]21	1789864597	GSAFVTIIVYTSBT-COZGXFGHSA-N	426.941	1.739	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CC(F)(F)C(=O)O)C[C@@H]21	1789865978	KBGPGWZTLSNVEH-VEABSNGSSA-N	431.263	1.312	50	20	IDGD	
CSCC[C@H](O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]2C1	1789872281	FVWIXYZUIFPWQF-GGOFEBJYSA-N	427.394	1.316	50	20	IDGD	
CC(C)N1CCC(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]3C2)CC1	1791055226	OUGKXOYKQOYUKK-UBDQQSCGSA-N	444.414	1.870	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C[C@H]3COc4ccccc4O3)C[C@@H]21)C(Cl)Cl	1791292563	KRAMKOUZMJZWIS-WSMBLCCSSA-N	443.327	2.000	50	20	IDGD	
Cc1nc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)CBr)cs1	1792870836	WNIRNHHZMGMFRA-VFFTVRQLSA-N	430.368	1.615	50	20	IDGD	
CCOC(=O)[C@@H]1CCC[C@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](Cl)CC)C3)C1	1792959480	WDEHDYBVGAWIQR-RFSXOUPVSA-N	428.957	1.963	50	20	IDGD	
COC(=O)[C@H]1CC[C@@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CO[Si](C)(C)C)C3)C1	1792969884	RFBHAMRNPKHPKN-RIUYPTKQSA-N	426.586	1.017	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@](C)(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](O)CCl)C1	1793112626	SJQKJXVXXFDVTN-QKQGURCUSA-N	443.972	1.871	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1C[C@@H]1c1ccc(OC)cc1	1793301264	ILVRBQMRWCPLFU-QBUATURESA-N	436.936	1.642	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cncn1-c1ccncc1	1794467284	DHWVVGUSIXUYEZ-VWPFQQQWSA-N	448.321	1.254	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2c(c1)COC2	1797012026	PSTRAYDPCLDTTO-GQAVTEOGSA-N	437.334	1.951	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@](C)(Cl)CCl)C3)o1	1797746426	CVWDUVAKJRNNRS-TYYYEBLRSA-N	432.304	1.678	50	20	IDGD	
Cc1ccc2oc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3cnccc3C(=O)NN)cc2n1	1798440435	QGMLKCUELVGKEH-QDMKHBRRSA-N	448.483	1.700	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(COC)c[nH]1	1798511651	ICLUYDBTPIHRTJ-HLPPOEQASA-N	428.327	1.538	50	20	IDGD	
CC(=O)N[C@@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2)c1cccc(Cl)c1	1799070269	TYVULZNATUAXPM-IMPMIVQMSA-N	446.306	1.641	50	20	IDGD	
Cc1cccn2ncc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@@H](F)Br)c12	1799347310	PLBMUQJJBWXIJH-FAXLKDOZSA-N	439.285	1.536	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(NC(=O)C2CC2)cc1	1799441902	AFBRPKJWVQSCIS-UKBAYJJMSA-N	449.935	1.492	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](F)Br)c1ccc2c(n1)OCCO2	1800159727	ZGDFJLPIZJORMF-MIJXAVMKSA-N	428.258	1.795	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)Cc1ccc(F)cc1	1800373030	YWRVCDCIUDVCGX-OMVTVGPASA-N	426.916	1.848	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(Cl)nc1F)C2	1800757215	BHMCKYHOYVDEAU-XHSYRHOGSA-N	434.693	1.861	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(F)c1[N+](=O)[O-])C2	1800759624	BBSJRIJFBMTDOV-DYNIEEOBSA-N	444.257	1.721	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C[C@H]1COc3ccccc3O1)C2	1800971395	YLFOQXDXHIENJG-MRNSRZSKSA-N	438.908	1.060	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1c[nH]c3ccc(C)cc13)C2	1800973799	HDIQKBZZLSHRBR-VWFIUDSGSA-N	433.936	1.862	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3c(F)cc(F)cc3[nH]1)C2	1800978649	YJJWLRITCJMRQE-WZTYKQCMSA-N	441.862	1.903	50	20	IDGD	
C[C@H](Oc1ccccc1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnccc1C(=O)NN)C2	1801780460	JXWAKBRGMLPAGW-NXOAAHMSSA-N	437.500	1.404	50	20	IDGD	
C=CC[C@H](CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2)NC(=O)OC(C)(C)C	1801931072	ATPMUNFPZFRNNK-QZCUMHFISA-N	447.935	1.970	50	20	IDGD	
COC[C@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](CCO)NC(=O)OC(C)(C)C)C2	1802271189	ZBLOZVCJRDBFKE-XFIYOXNOSA-N	447.960	1.154	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)c2ncn(C)n2)[C@H]1c1cccnc1	1805328574	JSWFTKGZNMYCIC-SOUVJXGZSA-N	435.326	1.703	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC2(CCCN(C(=O)[C@H]3C[C@H]3C3CC3)C2)CC1	1805360334	RWRZCQBUQNXPCW-ROUUACIJSA-N	425.533	1.576	50	20	IDGD	
CCNC(=O)N[C@@H](C)C(=O)N1CCC2(CCCN(C(=O)[C@H](C)CBr)C2)CC1	1805385340	WQTDQZAQELWMEU-CABCVRRESA-N	445.402	1.956	50	20	IDGD	
Cc1csc(C(=O)N2CCCC3(CCN(C(=O)c4ccc(B(O)O)cc4)CC3)C2)c1	1806241213	WHPXPCNVPAZZTL-UHFFFAOYSA-N	426.347	1.895	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)N1CC[C@@H](CNC(=O)CCBr)[C@H]1c1cccnc1	1806340586	GRSPDHBFUNMART-OFQRWUPVSA-N	440.342	1.319	50	20	IDGD	
CC(=O)NC[C@H]1CCN(C(=O)CN(C)NC(=O)NCc2ccccc2)[C@H]1c1cccnc1	1806718587	HNGHDAXCFUNELC-IRLDBZIGSA-N	438.532	1.454	50	20	IDGD	
Nc1ccccc1/C=C/C(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1	1807209725	AKIFRPIYTSYFCJ-HTAMWQEWSA-N	428.920	1.983	50	20	IDGD	
Cc1cnoc1C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1	1810302880	NWICXSIUUBBXPS-CRAIPNDOSA-N	449.471	1.010	50	20	IDGD	
Cc1ccoc1C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1	1810303385	RHNNUVZCGMUXSF-QFBILLFUSA-N	448.483	1.615	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2ccc(F)cn2)[C@H]1c1cccnc1	1813070025	DGACRPZHXXRNNG-IERDGZPVSA-N	442.495	1.308	50	20	IDGD	
Cc1n[nH]c(C)c1C(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1813073313	KZJRLLBEEMTLES-LAUBAEHRSA-N	441.536	1.114	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)C1CC2(CCC2)C1	1813650696	ZMCQHAMKNNKQMQ-KNQAVFIVSA-N	447.344	1.661	50	20	IDGD	
CN(C)C(=O)NCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](F)Br)[nH]n1	1814564164	VWLUHASCGMLXKX-GWCFXTLKSA-N	433.282	1.364	50	20	IDGD	
O=C(CN1CCOC1=O)Nc1cc([C@H]2CCCCN2C(=O)CCBr)[nH]n1	1815023825	PNOBQHQKKVQKHQ-GFCCVEGCSA-N	428.287	1.639	50	20	IDGD	
Cc1cc(C(=O)N[C@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)cn1C	1815340045	CLCBNDZCMUMTQF-INIZCTEOSA-N	438.318	1.009	50	20	IDGD	
Cc1ccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)cc1O	1817472630	PNXSQPNKQRLSJS-LJQANCHMSA-N	448.288	1.723	50	20	IDGD	
Cc1ccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)nc1	1817473525	ZAJOACFMPHUKNY-IBGZPJMESA-N	433.277	1.413	50	20	IDGD	
COCCn1ccc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@H](Cl)COC)CC3)n1	1817618093	KFSSACUFLUSYMX-VXGBXAGGSA-N	441.941	1.466	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cncnc2)[nH]n1	1818111398	IZQGSWDUPGOSRU-ROCQKPIASA-N	449.475	1.640	50	20	IDGD	
Cc1cnc2c(C(=O)Nc3nc4c(s3)C[C@H](NC(=O)[C@@H](O)CCl)CC4)cnn2c1	1819086121	ROIOMAZHNZHQBF-MFKMUULPSA-N	434.909	1.320	50	20	IDGD	
Cc1nc[nH]c1CSCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](O)CCl)CC2	1819627184	KOMMLQORQADHAQ-GWCFXTLKSA-N	443.982	1.620	50	20	IDGD	
C[Si](C)(C)OCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCN1CCOCC1)CC2	1820162514	KMZXEWPRFRFKQQ-AWEZNQCLSA-N	440.642	1.629	50	20	IDGD	
COc1cc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)CCC(=O)NN(C)C)CC3)ccn1	1820545770	CXGJMIIMHAXEFL-CYBMUJFWSA-N	446.533	1.146	50	20	IDGD	
C[C@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1)N1C[C@H]2C[C@@H]2C1	1822416090	NPVBAMIDDNVBNJ-YFHUEUNASA-N	445.568	1.115	50	20	IDGD	
C[C@@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1)n1ccnc1	1824316773	FMUKJPVAIGKCTC-HKUYNNGSSA-N	432.569	1.437	50	20	IDGD	
CCc1nc(C(=O)N[C@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)co1	1826088044	PMEAWULDDWRCSD-NSHDSACASA-N	434.522	1.292	50	20	IDGD	
COc1cnc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)cn1	1826178614	BZHUMAMQMGHKAX-GOSISDBHSA-N	446.552	1.092	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)COC(=O)C(F)(F)F)CC1	1828834248	DIJZPIPOKHGAAB-ZIAGYGMSSA-N	442.862	1.965	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cnc(Cl)nc1)CCO2	1829519749	QEPUYTCXMFNWKP-GOSISDBHSA-N	442.976	1.052	50	20	IDGD	
O=C(Cc1ccc(Cl)c(F)c1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1830719934	PDOBWTZRSASTPY-QFBILLFUSA-N	449.306	1.078	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccn(C(F)F)n3)C2)C1	1831651161	NQTOTLCOIRMCME-FZKQIMNGSA-N	434.871	1.756	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(F)(F)C(F)F)CCO2	1832193636	SQXWBKWBGNJKMY-NOZJJQNGSA-N	435.212	1.127	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2CCCSC2)CC1	1832856363	NAUSIVFBHDYXHQ-CTNGQTDRSA-N	444.406	1.743	50	20	IDGD	
CN(C)c1ccc(C(=O)N2CCC(N3CCC(NC(=O)[C@@H](O)CCl)CC3)CC2)cc1	1833313503	IAQLQFKDTUZFHL-FQEVSTJZSA-N	436.984	1.538	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](F)Cl)CC2)CC1)c1cncn1-c1ccncc1	1834013553	DDBZNJSUFZFKSF-IBGZPJMESA-N	448.930	1.987	50	20	IDGD	
CN(C)c1ccc(C(=O)N2CCC(N3CCC(NC(=O)[C@H](F)Cl)CC3)CC2)cn1	1835084318	XJAGLORAPOVAFW-SFHVURJKSA-N	425.936	1.867	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H]3CNc4ccccc43)CCO2)C1	1835705349	GXWHQQYHRIORMG-HTAPYJJXSA-N	435.952	1.917	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)CCNC(=S)NC)CC2)CC1	1835741925	TVMXOMJKZLNHNF-INIZCTEOSA-N	432.034	1.059	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)c1cc(F)cnc1Cl	1835885594	LNTIOMBUEXFFPD-MRXNPFEDSA-N	447.338	1.659	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](NC(C)C)C(C)C)CCO2	1835893135	ROHIPLYAHLXGJJ-WFXMLNOXSA-N	432.005	1.873	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)/C=C/c3cccs3)CCO2)C1	1835968402	IIEKEFUHYROODZ-HLIGJIKWSA-N	428.938	1.472	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)CCN3CCCC3)CC2)CC1)[C@H](F)Br	1836414695	YLTGANLUEOQLNZ-SFHVURJKSA-N	447.393	1.734	50	20	IDGD	
C[C@@H]1CCc2c(C(=O)N3CCC(OC4CCN(C(=O)[C@@H](O)CCl)CC4)CC3)n[nH]c21	1836717069	GPYJLNQFMIFKFE-DYVFJYSZSA-N	438.956	1.671	50	20	IDGD	
O=C(c1cccc2nccn12)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836718704	AJGKDIGZRRBGKA-SFHVURJKSA-N	434.924	1.546	50	20	IDGD	
Cc1noc(N)c1C(=O)N1CCC(OC2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1837859836	FTVMUKGRZFNXQX-CQSZACIVSA-N	447.305	1.868	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccncc1Cl)CCO2	1837887031	CTDDRWOMBOQKHP-IBGZPJMESA-N	441.988	1.657	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)c(C)n1	1838364237	KQWFXNVGLCWHKJ-LIRRHRJNSA-N	440.338	1.552	50	20	IDGD	
CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)CCO2	1838528261	MZKBMCQFYRIODC-HXUWFJFHSA-N	435.433	1.000	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)N1CCC(OC2CCN(C(=O)[C@H](Cl)COC)CC2)CC1	1838726967	NKDVSCPJNRSFFU-RHSMWYFYSA-N	448.944	1.800	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(F)cc(F)c3)CCO2)C1	1839003388	FJNMPLMGCQGWHI-QFBILLFUSA-N	432.851	1.289	50	20	IDGD	
Cc1nc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)cs1	1839197936	NICBICRHMRSILJ-DOMZBBRYSA-N	436.303	1.212	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](F)Br)CCO2)C1	1839198594	KDEUMIMSMFXRGS-NHYWBVRUSA-N	429.714	1.398	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3n[nH]c(C)c3F)C2)C1	1839962697	OLUGGJZZZUZDMA-PXAZEXFGSA-N	447.305	1.101	50	20	IDGD	
CC(C)c1nc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)co1	1840030947	AXRVHRMGTBVKCC-SCLBCKFNSA-N	444.326	1.651	50	20	IDGD	
O=C(c1cc2cccnc2[nH]1)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840188468	LJMNQPYASIBHES-SFHVURJKSA-N	427.288	1.437	50	20	IDGD	
C[C@H](Oc1cccnc1)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1840454362	CWGMCOSFRHIEMW-UGSOOPFHSA-N	432.304	1.109	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)Cn2ccc3c(F)cccc32)C1	1841323141	FISNCUMDTFMOLL-UHFFFAOYSA-N	429.496	1.357	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)c1ccc(CS(C)(=O)=O)nc1)C2	1841667806	GYBWCBSBAYINOI-MRXNPFEDSA-N	427.954	1.851	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)[C@@H]2Cc3ccccc3CN2)C1	1843341158	FMIVVMCTCVOQBA-BJRSOBTISA-N	448.527	1.038	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)CCc1cncc(C)c1)C2	1843415384	OGTUZSVGXHTZFX-YZSQISJMSA-N	436.516	1.660	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)[C@@H](C)Nc1cccnc1)C2	1843415895	ZXCAGAQTYNSATR-SXJXFNOXSA-N	437.504	1.219	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)c2ccc(Cl)c(Cl)c2)C1	1844905408	YGILOZDTJLVPHX-UHFFFAOYSA-N	433.100	1.804	50	20	IDGD	
Cc1cc2nnc(C(=O)N3CC4(CCCN4C(=O)[C@@H](F)Br)C3)c(C)n2n1	1845217671	ONRVULOCAWVDLV-CYBMUJFWSA-N	425.262	1.249	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)[C@H](c2ccc(Cl)cc2)N(C)C)C1	1845844314	DLPQIIPXFOMVAY-FQEVSTJZSA-N	449.983	1.519	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)[C@@H]2CCc3ccccc3C2)C1	1846092817	ZMWCOIAPYGQWNJ-GOSISDBHSA-N	433.512	1.307	50	20	IDGD	
O=C(COC(=O)/C=C/c1ccc([N+](=O)[O-])cc1)NNC(=O)[C@@H]1COc2ccccc2O1	10757193	INWJYDBGYGCWFH-JEJOPICUSA-N	427.369	1.139	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1	21899692	XHDGUYBAMRCFGJ-UHFFFAOYSA-N	430.424	1.718	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)CN1C(=O)N[C@](C)(c2ccc(C)cc2)C1=O	24627082	ULUKZOWNYTVXMX-OAQYLSRUSA-N	444.875	1.885	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)cc(OC)c1OC	46899008	CITIKDWYCQPBPH-UHFFFAOYSA-N	441.400	1.881	50	20	IDGD	
O=C(NNc1nc(-c2ccncc2)no1)c1cccc(S(=O)(=O)NC[C@@H]2CCCO2)c1	110329039	NEMNBJVOXUBORH-HNNXBMFYSA-N	444.473	1.346	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)c1ccc(-n2cnnc2)cc1	116610028	CIXSYFPKQPKGRB-UHFFFAOYSA-N	440.485	1.127	50	20	IDGD	
CC/C=C(/C)C(=O)N1CSC[C@H]1C(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	728066054	XHNAIHKJXROWDA-QLBUUCPGSA-N	429.502	1.597	50	20	IDGD	
COCCN1C(=O)c2ccc(C(=O)NNc3nc(-c4ccccc4)no3)cc2S1(=O)=O	728081964	UOWVJRHJYUYXEJ-UHFFFAOYSA-N	443.441	1.284	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3cnc4ccccc4n3)cc2)CC1	728213181	GBWGXEANGXFNJM-UHFFFAOYSA-N	426.502	1.323	50	20	IDGD	
NC(=O)C1CCN(c2ncccc2CNC(=O)NNC(=O)c2cccc3cccnc23)CC1	729228089	YZTGVJBDGYKSIH-UHFFFAOYSA-N	447.499	1.476	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)NCCOc1ccc(S(C)(=O)=O)cc1	730066266	FHRHMZMHPCPERE-ZDUSSCGKSA-N	439.465	1.406	50	20	IDGD	
CCS(=O)(=O)N[C@@H](CCSC)C(=O)NNC(=O)c1cc2c(s1)CC[C@H](C)C2	730517002	HGPMLNCJYYQMFM-AAEUAGOBSA-N	433.621	1.695	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)/C(=C\c1ccco1)n1nnnc1-c1ccccc1	730778261	MAGHPYVYCNZUOJ-GHRIWEEISA-N	446.423	1.863	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2cccc(C(=O)NNC(=O)Cc3ccccc3F)c2)C[C@@H](C)O1	731329391	KDTNGZIBKDNUSY-GASCZTMLSA-N	449.504	1.627	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)NCCS(=O)(=O)NCC1CCC1	731760914	HNRFAFNKSKARGZ-OAHLLOKOSA-N	448.545	1.657	50	20	IDGD	
CCOCCCn1c(=O)c2ccccc2n2c(S[C@H](C)C(=O)NNC(=O)CC)nnc12	731905264	YYESXDFYIRDCSX-CYBMUJFWSA-N	446.533	1.509	50	20	IDGD	
COC(=O)c1ccc(S(=O)(=O)NNC(=O)c2ccc(OC)c(Br)c2)o1	732049023	VDXZZCLMIDZXRQ-UHFFFAOYSA-N	433.236	1.461	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N[C@H](CCSC)C(=O)NNC(=O)C2CCC2)cc1	732142319	WIOMPYHRQZTXPR-MRXNPFEDSA-N	429.564	1.433	50	20	IDGD	
O=C(NNc1cccc([N+](=O)[O-])c1)N[C@H]1CCCN(c2cc(N3CCOCC3)ncn2)C1	732914028	JQYLNVQCWQDQRO-INIZCTEOSA-N	442.480	1.517	50	20	IDGD	
CCN(C(=O)NNC(=O)c1ccc(OC)c(Br)c1)[C@H](C)CS(C)(=O)=O	732998412	LFOHSJXGOWKJOU-SNVBAGLBSA-N	436.328	1.567	50	20	IDGD	
CN1C(=O)c2ccc(C(=O)NNc3ccccc3S(=O)(=O)NC(C)(C)C)cc2C1=O	734250906	OUOWMUDFLWVIBZ-UHFFFAOYSA-N	430.486	1.746	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2nc(-c3ccc(F)cc3)n[nH]2)c1	741413558	HFVFSFIJHPXIMD-UHFFFAOYSA-N	432.437	1.159	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)C[C@@H]2CN(Cc3ccccc3)CCO2)c1	743307901	YTYRARPOCJOIKU-GOSISDBHSA-N	431.514	1.142	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NNC(=O)CCCc2cccs2)cc1	743606340	UBKQLIVLSUWBSH-UHFFFAOYSA-N	439.519	1.541	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)N[C@H](C)CN1CCN(c2ccccc2)CC1	743633698	SKFDVLWRCIKVDU-GOSISDBHSA-N	425.533	1.779	50	20	IDGD	
C[C@@H]1Oc2ccccc2N(CC(=O)NNC(=O)c2cc(Br)ccc2O)C1=O	743731915	CXDITUBZNLVAFY-JTQLQIEISA-N	434.246	1.730	50	20	IDGD	
COCCN(CCOC)S(=O)(=O)c1ccc(C(=O)NNc2ccc(Cl)nc2)cc1	743816989	XYAQUNPAJIBPJY-UHFFFAOYSA-N	442.925	1.775	50	20	IDGD	
CON(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccc(OC(F)F)cc2)c1	743833627	ZNTKVDWHKDICBM-UHFFFAOYSA-N	444.416	1.936	50	20	IDGD	
CS(=O)(=O)c1ccc(Cl)c(C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)c1	744459295	XMNWIKYOCQHVTF-UHFFFAOYSA-N	435.845	1.233	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)CCC(=O)N2CCC(c3ccccc3)=N2)c1	744460507	UKHZSEPTIZISSV-UHFFFAOYSA-N	436.468	1.716	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NC[C@H](C)C(=O)OC(C)C)c2ccccc2c1=O	745905766	NFIHHRJOHUQBLS-AWEZNQCLSA-N	431.493	1.728	50	20	IDGD	
O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)NNC(=O)N1CCOCC1	745988170	SXSBXEHDRMTIJH-QBFSEMIESA-N	440.572	1.803	50	20	IDGD	
COc1cc(C)nc(NNC(=O)[C@H](CCSC)NS(=O)(=O)c2ccccc2)n1	746624088	WEYPURXJCYMIQC-AWEZNQCLSA-N	425.536	1.337	50	20	IDGD	
CC(C)c1nnc(CCC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)o1	746883146	QIJVEEDDIDPTNN-UHFFFAOYSA-N	436.538	1.205	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NNC(=O)CCOc2ccccc2)ccc1OC(C)C	747108054	KWRFATZPBKYALG-UHFFFAOYSA-N	430.461	1.927	50	20	IDGD	
O=C(CCc1ccco1)NNC(=O)c1cncc(C(=O)NNC(=O)CCc2ccco2)c1	748353639	CBVZSKONXQJFMJ-UHFFFAOYSA-N	439.428	1.055	50	20	IDGD	
COc1ccccc1[C@H](CNC(=O)NNC(=O)C(=O)N1CCCC1)NC(=O)OC(C)(C)C	748462006	SGCUFWAAVJQQOD-HNNXBMFYSA-N	449.508	1.214	50	20	IDGD	
CN(C)S(=O)(=O)c1c[nH]c(C(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)c1	748518603	MDNDFAXRBNJDOB-UHFFFAOYSA-N	440.425	1.315	50	20	IDGD	
CCC(CC)C(=O)NNC(=O)C[C@@H]1c2cc(OC)c(OC)cc2CCN1S(C)(=O)=O	751363565	PIJUWVZEUMWQCK-MRXNPFEDSA-N	441.550	1.536	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)C(C1CC1)C1CC1	752993336	YKKKCEDADYADHF-UHFFFAOYSA-N	435.546	1.224	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCc1cn(-c2ccccc2)nn1	755083385	BZTPLEFDMAFPAX-UHFFFAOYSA-N	442.505	1.013	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)c2cc(Cl)ccc2O)n([C@@H]2CCS(=O)(=O)C2)n1	755530867	IABXZOCQLUDCAZ-LLVKDONJSA-N	427.870	1.377	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)Nc1cnc(C2CC2)nc1	756373648	YEMYFGOOOHWOGR-UHFFFAOYSA-N	430.490	1.605	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN(CCCO)[C@H]2CCc3ccccc32)cc1OC	756542392	LVHPTLKOMVWXTG-IBGZPJMESA-N	427.501	1.837	50	20	IDGD	
CNC(=O)Cn1ccc2ccc(NC(=O)NNC(=O)COc3ccc(OC)cc3)cc21	756759855	HFRTYKPSHLUDOS-UHFFFAOYSA-N	425.445	1.628	50	20	IDGD	
C[C@](O)(CN1Cc2ccccc2C1=O)C(=O)NNC(=O)c1cccc(Br)c1	756840241	ZEZITAKQJCFDLB-IBGZPJMESA-N	432.274	1.617	50	20	IDGD	
CN(CC(=O)NN=c1cc[nH]cc1Cl)S(=O)(=O)c1ccc(Br)cc1	757421465	CEMIETCZRSWNIC-UHFFFAOYSA-N	433.715	1.683	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)NNC(=O)c2ccc(Cl)nc2)cc(S(C)(=O)=O)c1	757608297	BFYYZLRCCCAJFU-UHFFFAOYSA-N	440.865	1.782	50	20	IDGD	
Cc1nn([C@@H]2CCS(=O)(=O)C2)c(C)c1NC(=O)NNC(=O)c1ccc(Cl)nc1	757872201	WEWDCWITUZHVRD-GFCCVEGCSA-N	426.886	1.374	50	20	IDGD	
O=C(CC1(CC(=O)Nc2nccs2)CCCCC1)NNC(=O)C(=O)Nc1ccccn1	758834317	QZUADIDAPLXSJA-UHFFFAOYSA-N	444.517	1.993	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)CC[C@@H]2CCCN2C(=O)OC(C)(C)C)C[C@@H](C)O1	760119320	FGZKRBRSYQNENE-BBWFWOEESA-N	426.558	1.813	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H](C)C[C@H]2CCOC2)c1	760193328	KCLFNVVHUWYCSY-HUUCEWRRSA-N	426.539	1.476	50	20	IDGD	
Cc1cc(C)nc(SCc2ccc(C(=O)NNC(=O)[C@@H]3CN4CCCN3CC4)cc2)n1	763263592	IPRXWTGQGKJEMK-IBGZPJMESA-N	440.573	1.537	50	20	IDGD	
O=C(NNC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1)c1csc(N2CCOCC2)n1	763459177	WZMUWQSIYJRMDI-UHFFFAOYSA-N	443.445	1.148	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)n(-c2ccccc2F)n1	763549391	ZFMHSWKDXXQIRI-UHFFFAOYSA-N	425.376	1.448	50	20	IDGD	
CCCN1C(=O)CCc2cc(NC(=O)C(=O)NNC(=O)c3ccc4c(c3)OCO4)ccc21	763550799	HAIDUHCMUHNRKL-UHFFFAOYSA-N	438.440	1.504	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)C(=O)Nc2cnc3c(c2)c(C)nn3C)c1	763600109	CWWKGPCOTDWVDS-UHFFFAOYSA-N	438.488	1.873	50	20	IDGD	
COc1cc(OC)c(OC)cc1NC(=O)C(=O)NNC(=O)COc1cc(C)ccc1C	763668088	HZWDYANPUXOWSP-UHFFFAOYSA-N	431.445	1.494	50	20	IDGD	
COC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C)c(C)c2)cc1F	763679188	HXGQGHODXIKTCT-UHFFFAOYSA-N	432.408	1.786	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccnn1Cc1ccccc1	763681042	IZRZQQISWLXTSI-UHFFFAOYSA-N	437.456	1.495	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2cccc(N3CCCNC3=O)c2)c1	763772415	MAYSXOUKFRIZTM-UHFFFAOYSA-N	441.444	1.023	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2ccccc2O[C@@H]2CCOC2)c1	763772632	NXPCOQPHYGYWDX-CQSZACIVSA-N	429.429	1.271	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2cc(NC(=O)C3CC3)ccc2C)c1	763775901	XXVLIQIGAOXAMN-UHFFFAOYSA-N	440.456	1.760	50	20	IDGD	
CC(C)(C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)cc1	763838200	PZUNAMTXVJYZHL-UHFFFAOYSA-N	430.436	1.519	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)COc3ccc(F)cc3)cc2)C[C@@H](C)O1	763840827	YMBNGQDKGMJRTC-GASCZTMLSA-N	444.463	1.604	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(C)nc2N(C)C)cc1	763870649	BICSNIWCUIALIX-CQSZACIVSA-N	427.461	1.212	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)C(=O)Nc2ccc(CS(C)(=O)=O)cc2)cc1	763897039	SVQSBKABJUTHNR-UHFFFAOYSA-N	435.527	1.418	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(-c3ncon3)cc2)cc1OC	763911882	PMOJKJJEWNFZOB-UHFFFAOYSA-N	439.428	1.934	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)CC(=O)N3)cc1OC	763912098	NTWKRSREWDHCNP-UHFFFAOYSA-N	440.456	1.768	50	20	IDGD	
O=C(NNC(=O)c1ccc(Br)s1)C(=O)Nc1ccnn1-c1ccncc1	763942472	ZYZYEKHIYNSOCW-UHFFFAOYSA-N	435.263	1.491	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc(NC(=O)NC[C@H]2CCCO2)cc1	763956429	NTMHUKLOIBBVRY-QGZVFWFLSA-N	439.472	1.695	50	20	IDGD	
COC(=O)c1cc(F)ccc1NC(=O)C(=O)NNC(=O)c1cc(Br)c[nH]1	763995904	RUCBXKZGAALKSW-UHFFFAOYSA-N	427.186	1.103	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2cc(F)c(F)cc2Cl)c1	764077864	OHDGCHHQWOFMNN-UHFFFAOYSA-N	431.804	1.421	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(F)cc2Br)c(C)n1	764085813	OVFBWWFOQIOTGV-UHFFFAOYSA-N	425.214	1.700	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cc(Cl)ccc2C(=O)N2CCCCC2)n[nH]1	764106559	MUERFYXVQBKGSX-UHFFFAOYSA-N	432.868	1.397	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cccnc3N3CCOCC3)n[nH]2)cc1	764110876	MIVSWJMLRHRPLC-UHFFFAOYSA-N	449.471	1.016	50	20	IDGD	
O=C(CC(F)(F)F)NNC(=O)C(=O)Nc1ccc(C(=O)NCc2ccc(F)cc2)cc1	764114971	JAOTUBDQMMDGEU-UHFFFAOYSA-N	440.353	1.794	50	20	IDGD	
CCN1CCN(c2ccc(NC(=O)C(=O)NNC(=O)CCCc3ccccc3)cc2)CC1	764223410	ACYNWRBJYQUEAB-UHFFFAOYSA-N	437.544	1.937	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNC(=O)COC)ccc1Sc1ccccc1	764302251	AMICYGGEBLBERP-UHFFFAOYSA-N	431.470	1.747	50	20	IDGD	
Cn1cc(NC(=O)C(=O)NNC(=O)C(C)(C)c2ccccc2)cc(Br)c1=O	764314242	SJXSJCYDCGIRSM-UHFFFAOYSA-N	435.278	1.212	50	20	IDGD	
COc1cccc(-c2nsc(NC(=O)C(=O)NNC(=O)COCc3ccccc3)n2)c1	764367756	LYJDEFMOUZQMPF-UHFFFAOYSA-N	441.469	1.516	50	20	IDGD	
O=C(NNC(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2)c1cc(-c2ccc(F)cc2)[nH]n1	765607164	LSENMNMWOZOKNM-UHFFFAOYSA-N	427.348	1.970	50	20	IDGD	
Cc1nn(C)c(C)c1CC(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	765755054	CFCNJEMKPZIJHH-UHFFFAOYSA-N	432.956	1.198	50	20	IDGD	
NC(=O)COc1ccc(Cl)cc1S(=O)(=O)NNC(=O)c1ccc(Cl)cc1O	766321182	SOHUMUSCLQKTMV-UHFFFAOYSA-N	434.257	1.186	50	20	IDGD	
CN(C)c1ccc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cc1F	766637174	ZPNPBQSWHCVZEY-UHFFFAOYSA-N	427.480	1.111	50	20	IDGD	
CCn1cc(S(=O)(=O)NNC(=O)c2nc(Cl)c(Cl)c(N)c2Cl)nc1C	768034913	CUOIEYWIRAZSBV-UHFFFAOYSA-N	427.701	1.772	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)CCC(=O)c2ccc3c(c2)CCC(=O)N3)nc1C	768392011	QKNQHWWXIHQOGO-UHFFFAOYSA-N	425.445	1.953	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)c1cccc([C@@]2(C)NC(=O)NC2=O)c1	769048807	MRQGODOCYKQGJM-JOCHJYFZSA-N	434.456	1.115	50	20	IDGD	
CC(=O)N1CCc2c(NC(=O)C(=O)NNC(=O)[C@H](C)Oc3ccc(F)cc3)cccc21	769266716	PTYXYZYVLQXCHW-LBPRGKRZSA-N	428.420	1.288	50	20	IDGD	
CSCCNC(=S)NNC(=O)c1ccc(S(=O)(=O)NCc2ccco2)cc1	769780063	UJEINKRIGIGRMS-UHFFFAOYSA-N	428.561	1.230	50	20	IDGD	
COc1ccccc1[C@@H](CNC(=O)NNc1nc(O)c2cnn(C)c2n1)N1CCCC1	770335531	KGFPYQNNBSMYCQ-OAHLLOKOSA-N	426.481	1.541	50	20	IDGD	
C[C@@H](CCN1CCN(C)CC1)NC(=O)NNC(=O)COc1ccc(Br)cc1	770580648	BHUNIZIIYLRXNT-AWEZNQCLSA-N	442.358	1.184	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)NNC(=O)c1ccc2c(c1)OCCO2	770658661	PBVDXDJKJDCRSA-LLVKDONJSA-N	434.836	1.554	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)N1CCC[C@@H](CNS(C)(=O)=O)C1	770658838	PWWPQQSIAGKQGV-OLZOCXBDSA-N	432.930	1.109	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)N[C@H]1CC(=O)N(c2c(F)cccc2F)C1	770772188	MHEGXPRJEAOBIO-AWEZNQCLSA-N	440.410	1.900	50	20	IDGD	
CC[C@H](C)[C@H](NC(=O)N1CCCC1)C(=O)NNc1nc(O)c2cnn(C(C)(C)C)c2n1	770966820	TXPILZDNNALJPY-JSGCOSHPSA-N	432.529	1.950	50	20	IDGD	
CC(C)(C)CC(=O)NNC(=O)CN1C(=O)N[C@@](C)(c2ccc(Br)cc2)C1=O	771256282	MKQJCWGVBHNVMI-SFHVURJKSA-N	439.310	1.800	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)O[C@@H](C)C(=O)NNC(=O)CC(C)C)c1	771881840	KSTQMDIUCXSVIZ-AWEZNQCLSA-N	427.523	1.456	50	20	IDGD	
CCc1ccc(N2C[C@@H](C(=O)NNC(=O)C(=O)NCc3ccc(Cl)cc3)CC2=O)cc1	772188713	SYPANOHFJBSTGI-INIZCTEOSA-N	442.903	1.719	50	20	IDGD	
CS(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)c1	772885225	WNFXFSDVOIIWLV-UHFFFAOYSA-N	444.296	1.474	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)c1cc(S(=O)(=O)N(C)C)ccc1O	772996258	HHNPHTXFIQUIPD-NSHDSACASA-N	441.893	1.524	50	20	IDGD	
COC(=O)c1ccc(-n2cc(C)cn2)c(NC(=O)C(=O)NNc2cnc3ccccc3n2)c1	773717724	GDMGOYJJZRLEQN-UHFFFAOYSA-N	445.439	1.992	50	20	IDGD	
CCCNS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(C)c(F)c2)cc1	773886547	YSCFOAAFKMGAOR-UHFFFAOYSA-N	436.465	1.222	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN[C@H](C)c2ccc(N3CCOCC3)cc2)cc1OC	775255781	QALHZVVRARLFMU-MRXNPFEDSA-N	442.516	1.652	50	20	IDGD	
C[C@H](NCC(=O)NNC(=O)c1cccc(C#N)c1)c1cc(F)ccc1N1CCC(O)CC1	775355155	ACSSHMSJNIWQGU-HNNXBMFYSA-N	439.491	1.770	50	20	IDGD	
CCCOC[C@H](Cc1cccc(Br)c1)NC(=O)NNC(=O)C(=O)NC1CC1	776185724	UWBRISIWJGRVJV-HNNXBMFYSA-N	441.326	1.396	50	20	IDGD	
CC(C)C[C@@H]1OCCC[C@H]1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	776258233	CRHBVYCRQMSRFV-SJORKVTESA-N	426.539	1.475	50	20	IDGD	
CCOC(=O)N1CCC[C@H]([C@H](C)NC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)C1	776934441	GZJKYOYYUNWHTD-GJZGRUSLSA-N	444.492	1.779	50	20	IDGD	
Cc1nc(O)c(C#N)c(C)c1CCC(=O)N1CCN(S(=O)(=O)CBr)CC1	777778133	YBCHKOLSFPPOBA-UHFFFAOYSA-N	445.339	1.035	50	20	IDGD	
O=C(NNS(=O)(=O)c1c(Cl)ccnc1Cl)c1csc(N2CCOCC2)n1	777910515	CSMYYHQKDNXSKP-UHFFFAOYSA-N	438.318	1.305	50	20	IDGD	
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)CNC(=O)OC(C)(C)C	778434282	XUOXLADOSLFMQY-QGZVFWFLSA-N	445.520	1.523	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)[C@@H](O)[C@H](O)c2nc3ccccc3s2)cc1OC	779473182	KENAYQOKRZQAOG-IRXDYDNUSA-N	431.470	1.559	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2cccc(N3C(=O)c4ccccc4C3=O)c2)nc1	782146073	WHEVUMOKGLWGEK-UHFFFAOYSA-N	431.408	1.973	50	20	IDGD	
COc1ccc(NC(=O)c2cccc(NC(=O)C(=O)NNc3ncncc3Cl)c2)cn1	782165700	KLUCPYDFHXLZMN-UHFFFAOYSA-N	441.835	1.868	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ccccc2Br)cc1-n1nnnc1C	782983898	ITVNRTOVZVXFND-UHFFFAOYSA-N	446.265	1.824	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)NC1CCC(Oc2ncccc2C#N)CC1	783037243	LHWIHFPEMYZGAP-UHFFFAOYSA-N	434.456	1.924	50	20	IDGD	
COc1ccccc1Oc1ccc(NC(=O)C(=O)NN[C@@]2(C)CCS(=O)(=O)C2)cc1	783428460	WONDIJREZSFVPE-FQEVSTJZSA-N	433.486	1.624	50	20	IDGD	
COC[C@@H](C)NS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccc(F)cc2C)cc1	783447749	NERZDZWXJNHYGX-CYBMUJFWSA-N	438.481	1.529	50	20	IDGD	
CC(=NNC(=O)CSc1nnc(O)nc1O)c1c[nH]ccc1=NC(=O)OC(C)(C)C	783514548	NLEIEKXJENKOLN-UHFFFAOYSA-N	435.466	1.079	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)cc1F	784229114	BFDJFHXCHBQSQN-UHFFFAOYSA-N	449.508	1.152	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)NC2CCN(c3cc(C)[nH]n3)CC2)cc1	784661040	HSXFKKJXLCQTGW-HNNXBMFYSA-N	430.509	1.884	50	20	IDGD	
COCC(=O)N1CCc2cc(NC(=O)C(=O)NNc3cccc(C(F)(F)F)n3)ccc21	784951309	JIXBFCCGPQVZMP-UHFFFAOYSA-N	437.378	1.718	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNc2nccn(C)c2=O)sc2c1CCCS2	785086496	QOVPEGMFSADUPF-UHFFFAOYSA-N	437.503	1.139	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)[C@@]1(O)CCc2ccccc2C1	786259342	FSCJKHVFYFVXEF-OAQYLSRUSA-N	431.514	1.071	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(CN(C)C)c(Br)c2)c(O)c1	786417428	PQNSRXXKCAZLKT-UHFFFAOYSA-N	449.305	1.924	50	20	IDGD	
Cn1cc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)c(C(F)(F)F)n1	789817669	ISILLAKUWYIXMP-AAEUAGOBSA-N	425.367	1.098	50	20	IDGD	
O=C(NCc1ccc(S(=O)(=O)NC[C@H]2CCCO2)cc1)NNc1nc2ccccn2n1	790216367	YFZAWCIVMKGZPR-OAHLLOKOSA-N	445.505	1.013	50	20	IDGD	
Cn1nc([C@@H]2CCCOC2)cc1NC(=O)C(=O)NNC(=O)Cc1cccc2ccccc12	790951066	BSWDBXQQRVPTCQ-QGZVFWFLSA-N	435.484	1.796	50	20	IDGD	
CO[C@@H]1CCOc2c(NC(=O)C(=O)NNC(=O)[C@@H]3COc4ccccc4O3)cccc21	790957558	UKHCWQZNWXXNOY-PBHICJAKSA-N	427.413	1.083	50	20	IDGD	
Cc1nc(C#N)c(N2CCC(C(=O)NNC(=O)CNC(=O)OCc3ccccc3)CC2)o1	794063796	LAPGNRHPKARUQC-UHFFFAOYSA-N	440.460	1.145	50	20	IDGD	
Cc1cc(F)c([N+](=O)[O-])cc1S(=O)(=O)NNC(=O)CNC(=O)OCc1ccccc1	794597731	ZCRIWZZEPARERX-UHFFFAOYSA-N	440.409	1.278	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNC(=O)C(=O)Nc1ccc2c(c1)C(=O)CCC2	797369363	TYTMEIDNTNNSIG-UHFFFAOYSA-N	438.440	1.218	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NC(=O)NNC(=O)CCSc2ccc(F)cc2)nc1	797652495	INYCQZTYDFGCTG-UHFFFAOYSA-N	441.510	1.806	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1cc(F)c(Br)cc1Cl	799233308	JCYBINLXLCTUJC-RXMQYKEDSA-N	431.671	1.332	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)CCCN(C)C2=NS(=O)(=O)c3ccccc32)cc1	802060724	KVJXBEXDHRMJHA-UHFFFAOYSA-N	445.501	1.709	50	20	IDGD	
Cc1c(C(=O)NNC(=O)Nc2ccc3c(c2)OCO3)nnn1-c1ccc2c(c1)OCCO2	802101384	MGYGGKAIAZFXFV-UHFFFAOYSA-N	438.400	1.542	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)N[C@H]1CCCN(C(=O)Cc2ccccc2)C1	802475259	GFBSOUXDCTVZSN-HNNXBMFYSA-N	441.444	1.478	50	20	IDGD	
O=C(N[C@H](Cc1ccccc1)C(=O)NNc1ccc(-n2ccnc2)nn1)c1cccnc1	804952079	IHCUCQTZDJUULS-GOSISDBHSA-N	428.456	1.542	50	20	IDGD	
CCOC(=O)C1(S(C)(=O)=O)CCN(C(=O)NNC(=O)c2cc3ccccc3o2)CC1	805171364	LLPRQERHCPFHFJ-UHFFFAOYSA-N	437.474	1.230	50	20	IDGD	
Cc1cc([N+](=O)[O-])ccc1NNC(=O)c1cc(S(=O)(=O)N2CCSCC2)c[nH]1	805384679	COXOABGDYRJKPQ-UHFFFAOYSA-N	425.492	1.726	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)N[C@H](CS(=O)(=O)N(C)C)C(F)(F)F	805769136	LGMHTODOFTVZDZ-LLVKDONJSA-N	446.835	1.115	50	20	IDGD	
COCCn1cc(C(=O)NNC(=O)Cc2nc(-c3ccccc3)cs2)c(=O)cc1C	806354474	BRWPYCJJAUAORQ-UHFFFAOYSA-N	426.498	1.930	50	20	IDGD	
COc1cc(F)cc(NNC(=O)C(=O)N2C[C@@H](C[C@H]3COCC(=O)N3)c3ccccc32)c1	807025812	WKETWBRJIFXZDN-CJNGLKHVSA-N	442.447	1.313	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)[C@H]1CC(=O)N(C)[C@@H]1c1ccc(Cl)c(F)c1	807372116	YTHRVDTWCZNEQM-BLLLJJGKSA-N	429.876	1.935	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)[C@@H](c1ccccc1)N(C)C	807403964	FQPIUPWIJMMBCI-BEFAXECRSA-N	447.561	1.572	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)N[C@@H]1CCCN(C(=O)CCC(F)(F)F)C1	807574248	ORSJJPBYCSLTSE-SNVBAGLBSA-N	447.370	1.578	50	20	IDGD	
C[C@H]1[C@@H](NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)CCN1Cc1ccccc1	807619982	CXXRVLIGWBYGQV-PXNSSMCTSA-N	437.548	1.686	50	20	IDGD	
CC(C)(C)c1n[nH]cc1C=NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	812382452	NGHRSRJOLSYCOL-UHFFFAOYSA-N	447.561	1.811	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccc(OC(F)F)cc2F)cc1	813033153	HFNUOSJGBAANOB-UHFFFAOYSA-N	446.407	1.759	50	20	IDGD	
CC(=NNC(=O)[C@@H](C)Oc1cccc(C)c1C)c1ccc(S(=O)(=O)CC(N)=O)cc1	814748164	IWMWWRBRIGXSFN-MRXNPFEDSA-N	431.514	1.870	50	20	IDGD	
CCOC(=O)c1nc(NC(=O)C(=O)NNC(=O)c2ccc(CC)cc2)sc1C(C)=O	815566424	TVDMLSULKPPZCL-UHFFFAOYSA-N	432.458	1.485	50	20	IDGD	
N#Cc1cc(C(=O)N2CCN(S(=O)(=O)CBr)CC2)cnc1C(F)(F)F	815964263	CPCUDZXBUQACBX-UHFFFAOYSA-N	441.229	1.412	50	20	IDGD	
CCN1CCN(S(=O)(=O)c2ccc(Cl)c(C(=O)NNc3ncncc3F)c2)CC1	817080139	GFSLHRMDESXNAG-UHFFFAOYSA-N	442.904	1.352	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)N[C@H]2CCc3c(nc(C)n3CCO)C2)c1C	819745100	QJJXVHIASCAPAX-RQRMZWKBSA-N	425.533	1.829	50	20	IDGD	
Cn1cc(/C=C/C(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)cn1	877204350	ANDIPULIZKOPTA-FMIVXFBMSA-N	428.456	1.596	50	20	IDGD	
COc1ccc(/C=C\C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)cc1OC	912848160	IOJKUKPYYMQCNE-ALCCZGGFSA-N	432.502	1.780	50	20	IDGD	
NC(=O)c1ncn2c(C(=O)NNC(=O)Cc3c[nH]c4ccccc34)cc(-c3ccco3)nc12	913082551	YJAJPTPZRHZQDJ-UHFFFAOYSA-N	443.423	1.573	50	20	IDGD	
COCCN1C[C@H](C(=O)NNC(=O)COc2ccc(-c3ccc(C#N)cc3)cc2)CC1=O	914459169	IQOCSHXSFQWSMM-LJQANCHMSA-N	436.468	1.246	50	20	IDGD	
COc1nn(C)c2nc(C)c(CCC(=O)NNC(=O)COc3ccc(C#N)cc3)c(C)c12	914748783	GCTCPXDWPSSYRW-UHFFFAOYSA-N	436.472	1.624	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2nc3ccccc3s2)c1	915878018	BNXLMBSNSZFJJC-UHFFFAOYSA-N	433.515	1.691	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCC(=O)Nc2ccc(F)c(F)c2)nc1	915894396	LZBFCLMCYMOWAO-UHFFFAOYSA-N	442.448	1.311	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NC[C@H](c2cccs2)N(C)C)nc1	915897779	KUEYVWNBLMSBDA-CQSZACIVSA-N	426.568	1.759	50	20	IDGD	
O=C(NC[C@H](c1ccc(F)cc1)N1CCOCC1)NNC(=O)[C@@H]1COc2ccccc2O1	915898073	QCRKEAKGDACDOF-XLIONFOSSA-N	444.463	1.369	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)n[nH]1	916095287	UWJLOXHMCXKYIY-UHFFFAOYSA-N	443.485	1.410	50	20	IDGD	
CN1CCN(C(=O)c2ccc(CNC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)cc2)CC1	916390868	SXGVPRCHSIJNBY-UHFFFAOYSA-N	440.460	1.127	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)NCCN2CCN(c3ccccc3)CC2)cc1OC	916515049	YWBXVPVJALLXLQ-UHFFFAOYSA-N	441.532	1.860	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NC[C@H](C)N2CCc3ccccc32)nc1	916622981	UVDDSRMITKNQHZ-HNNXBMFYSA-N	432.550	1.846	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)c2ccc(S(N)(=O)=O)o2)cc(OCC)c1OCC	917905067	BZQQKIBFXYEBKW-UHFFFAOYSA-N	441.462	1.198	50	20	IDGD	
CNS(=O)(=O)c1ccc([C@@H](C)NC(=O)NNC(=O)c2ccc3ccccc3n2)cc1	919779285	PSYBGWBMMSDDLT-CYBMUJFWSA-N	427.486	1.848	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc3nc(O)oc3c2)c1	919807496	RGEGJCTUQNGFSR-UHFFFAOYSA-N	432.458	1.639	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)[C@H]1CS[C@H](Cc2ccccc2F)C(=O)N1	920212944	HORTXOVNFZQFSA-SJLPKXTDSA-N	431.489	1.367	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCc2ccc(-n3ccnc3)cc2)nc1	921244402	CGYANIKNDDPTIF-UHFFFAOYSA-N	429.506	1.780	50	20	IDGD	
COc1ccc([C@@H]2[C@H](C(=O)NNC(=O)c3n[nH]c4c3CCCC4)CCC(=O)N2C)cc1	1251882119	QNRQCGXHSGTBIP-OXQOHEQNSA-N	425.489	1.668	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(F)(F)C(F)(F)C(=O)O)C2)[C@@H](F)Cl	1778023138	WNRSSXMLJIEFRG-JRKPZEMJSA-N	436.761	1.390	50	20	IDGD	
COCc1oncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Br)C2	1778344251	UBLWWXIBVPNCME-JKIFEVAISA-N	448.289	1.639	50	20	IDGD	
CC(=O)O[C@H](C(=O)N1CC[C@]2(CN(C(=O)[C@H](C)CBr)CCO2)C1)C(C)C	1778792329	NSSWZYHCXPMPKQ-QIIPPGSGSA-N	433.343	1.435	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)CSCc3[nH]cnc3C)C2)C1	1778914126	XNRZZZSUKKAGCW-KBXCAEBGSA-N	430.958	1.035	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CO[Si](C)(C)C)C1	1779545819	ZXQMSWDUBPOLED-JXXFODFXSA-N	425.602	1.043	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)n(C(F)F)n1	1780313088	RMKFAACVADQXBD-BZNIZROVSA-N	435.269	1.814	50	20	IDGD	
CCOC(=O)c1cc(C(=O)N2CC[C@@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)ccn1	1780322453	WGOAIBANJVEDOE-OAQYLSRUSA-N	449.580	1.553	50	20	IDGD	
Cn1c(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](F)Br)C2)cccc1=O	1780770828	DXMBFMPXRKGICN-QIIPPGSGSA-N	444.301	1.203	50	20	IDGD	
Cc1nnc(CCC(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)s1	1781325701	HRUCICHDFSCXSV-UKRRQHHQSA-N	435.319	1.300	50	20	IDGD	
Cn1ncc2cc(C(=O)N3CCO[C@]4(CCN(C(=O)[C@H](F)Br)C4)C3)ccc21	1781330169	RXALJFRNVATPRH-YJBOKZPZSA-N	439.285	1.707	50	20	IDGD	
O=C(c1ccc(OC(F)(F)F)cc1)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1781556921	QSMVIIXCDFNTKR-YOEHRIQHSA-N	436.814	1.628	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cccc(-n4cncn4)c3)C2)C1	1782013428	SNIRDVKIYXMRFS-NRFANRHFSA-N	431.924	1.976	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cn(C(C)(C)C)nn1)C2	1782173763	OLWRHZBOGNUZHS-YYFZDKIDSA-N	441.960	1.414	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cn4ncccc4n3)CCO2)C1	1783347995	RHWARAHLDJHPRD-ACJLOTCBSA-N	436.310	1.346	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cnn4c3OCCC4)CCO2)C1	1783353206	NPZPTIRQHHITJU-KBXCAEBGSA-N	441.326	1.283	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H]1CCCN1C(C)C)CCO2	1783354020	LZJOTGPONDPRKO-TXPKVOOTSA-N	430.387	1.863	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)COc3cccc(N(C)C)c3)CCO2)C1	1783873189	LZIZGOVTRGIKHJ-WIYYLYMNSA-N	439.940	1.215	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(-c4ccncc4)[nH]n3)CCO2)C1	1783877470	JCKDUMHUWGYDIA-YWZLYKJASA-N	433.896	1.169	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(Cl)c4nncn4c3)CCO2)C1	1783877652	MQDSQTIZPKLYOJ-KSSFIOAISA-N	442.303	1.080	50	20	IDGD	
O=C(C(Cl)Cl)N1CC[C@]2(C1)CN(C(=O)C1CCN(c3ccccn3)CC1)CCO2	1783948297	IMHNMFJFOVKZSY-FQEVSTJZSA-N	441.359	1.932	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3CC[C@H](C(=O)OC)C3)[C@H]2C1	1784075238	FSOKFFSEGRXXGW-PXOUGSPUSA-N	428.957	1.963	50	20	IDGD	
CC(C)n1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCBr)[C@H]3C2)n1	1786409075	XGNGSUVUICJVHJ-DZKIICNBSA-N	427.343	1.842	50	20	IDGD	
O=Cc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Br)C[C@@H]32)s1	1786990343	GROMJZGKLUXJRX-QVSJOPQTSA-N	433.299	1.844	50	20	IDGD	
Cn1c(=O)n(C)c2cc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]4C3)ccc21	1787447024	IJKBPMMASQVILG-PYTWLRIVSA-N	438.887	1.005	50	20	IDGD	
C#CCCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)[C@H]2C1	1789222159	JYUAKENUJRAHHS-QSFXBCCZSA-N	443.456	1.527	50	20	IDGD	
CN(C)c1ccc([N+](=O)[O-])c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Cl)C[C@@H]32)c1	1789232003	RQXYVZLMCCLPSJ-GQGQLFGLSA-N	442.875	1.789	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC1(c2ccc(NC(=O)c3ccc4nncn4c3)cc2)CCC1	1789321320	CBFHNWMCKWHEGR-UHFFFAOYSA-N	449.515	1.850	50	20	IDGD	
COC[C@@H](NC(C)=O)C(=O)Nc1ccc(C2(NC(=O)[C@@H](F)Br)CCC2)cc1	1789660314	RBJLJTPZPWFTMR-HUUCEWRRSA-N	444.301	1.962	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3CN(C(=O)OC(C)(C)C)C3)C[C@@H]21	1789860013	RKQHZQGEAXQJKX-HJWJTTGWSA-N	443.972	1.850	50	20	IDGD	
CC(C)(NCCC#N)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]2C1	1789866196	LJUUVOYPNYAQSS-XLPNERPQSA-N	433.380	1.484	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CC[C@H](O)CC3)C[C@@H]21	1790963909	OEDKQQIHLHODIK-JNNCMOEMSA-N	431.371	1.691	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3n(n1)CCCC3)C2	1792870713	IYLXPMSMUSNXPK-VWPFQQQWSA-N	439.354	1.454	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(-c3ccccc3)n1)C2)[C@@H](O)CCl	1792978413	UGCFNAJUUZWSRL-JSJNYSNDSA-N	429.904	1.552	50	20	IDGD	
C[C@H](CBr)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](C)N1CCN(C)CC1)C2	1792991664	RFMWQFFIVATLTA-OVYGPGRDSA-N	429.403	1.292	50	20	IDGD	
CC(C)(C)OC(=O)NCC1(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](O)CCl)CC1	1793107210	VKCYAZRQPUMOOG-XGUBFFRZSA-N	429.945	1.529	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CC(c3ccccc3)=NN1)C2	1793453728	UEFGOPXIXIAOPZ-JEIKXUOUSA-N	432.952	1.750	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1C[C@@H]1F	1793669756	WDEVOESRPGKASZ-BYGOPZEFSA-N	433.908	1.066	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Br)C3)c1	1793814370	FKUUVVUUYONHPT-LTCOOKNTSA-N	443.313	1.962	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cn1ccnn1)C2	1794142794	RKUYZIWBQZZFQM-XGUBFFRZSA-N	440.932	1.048	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cn3c(F)cccc3n1)C2	1795115316	XSBFUVXNGBDZJU-DPIQGUFMSA-N	439.285	1.462	50	20	IDGD	
CC(C)c1csc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)n1	1796188287	LWPSPYISDXXUDV-BJWYYQGGSA-N	427.335	1.512	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1(C(C)C)CCC1)C2	1796445558	DOWDKSRVNHWNIB-BRTCSPBQSA-N	443.548	1.536	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@]1(F)CCCCC1(F)F)c1ccc(B(O)O)cc1	1797797643	LUGZJHIFYGAWOV-AXVVYFOYSA-N	438.255	1.536	50	20	IDGD	
CCOc1ccccc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2	1798831893	RYKMFGNCWRREED-NOXHYTERSA-N	429.286	1.979	50	20	IDGD	
Cc1c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CO[Si](C)(C)C)C3)cn2[nH]cnc(=O)c12	1799151881	AFIJZLZBNZOHCN-QDMKHBRRSA-N	431.569	1.434	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1c[nH]c2ccccc12	1799901978	UGJWETWYOLGFMK-BJWYYQGGSA-N	446.511	1.661	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc3n(n1)CCCNC3=O)C2	1800081660	IGVBQQKMKACMHJ-RJAOAUJVSA-N	442.347	1.505	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2)c1cnn2cccc(F)c12	1800121829	HOGDJBCQOJWUOQ-DRXBFXEBSA-N	439.285	1.462	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(F)ccc1Cl)c1ccc(B(O)O)cc1	1800461038	MUXHSTCDGBVUKB-BJWYYQGGSA-N	430.672	1.725	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2	1800642534	NMGFWLPPDZBZGN-RCZSTQMZSA-N	430.112	1.440	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(=O)c1ccc(C)cc1)C2	1800644320	PKPDJWCTWQYSJG-YVSFHVDLSA-N	437.334	1.941	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(Cl)cc3nn[nH]c13)C2)C(Cl)Cl	1801016599	ODGVZYBCTCTICP-IJBDUVHLSA-N	432.695	1.618	50	20	IDGD	
CC[C@@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN1C(=O)CSC1=S)C2	1801806455	KBHHPTRKMCIQCN-WRWGMCAJSA-N	448.408	1.658	50	20	IDGD	
COCCOCCOCCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](C)Br)C2	1802086996	VSUVFEYMIAIHDW-JONQDZQNSA-N	435.359	1.478	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnc3c(Cl)cccn13)C2	1802333297	UDLOGPBFBNBLJV-QDMKHBRRSA-N	446.939	1.613	50	20	IDGD	
N[C@H](CC(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)c1cccnc1	1803139377	XRIKOORMKHUOSS-FTEYMNFISA-N	431.924	1.172	50	20	IDGD	
Cc1cc(NC(=O)CC(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)no1	1803139617	RQLKTXICQBRWDG-CLCXKQKWSA-N	449.895	1.012	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc3[nH]ccc3n2)[C@H]1c1cccnc1)[C@@H](O)CCl	1803142953	PARQYOVBMUVSCG-JVPBZIDWSA-N	427.892	1.877	50	20	IDGD	
O=C(Cn1nnc2ccccc21)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1	1804014797	GNNYUKLWCSNKRI-ZAAXVRCTSA-N	442.907	1.132	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)COc1ccc(C(=O)OC)cc1	1804601929	WAXDEXVIBGTMIJ-KYHPRHEASA-N	438.908	1.744	50	20	IDGD	
Cc1occc1C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1805619154	NVEQAEIIVZLTIM-LAUBAEHRSA-N	427.505	1.676	50	20	IDGD	
Cc1nc(C(=O)NC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)cs1	1805966052	BGWUAQXQZJITIF-JXFKEZNVSA-N	444.561	1.539	50	20	IDGD	
COCCC(=O)NC[C@@H]1CCN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@@H]1c1cccnc1	1806743061	WQTWICFVPBLKHY-YVIKVBFHSA-N	440.504	1.258	50	20	IDGD	
COCCOCC(=O)NC[C@@H]1CCN(C(=O)[C@@](C)(Cl)CCl)[C@H]1c1cccnc1	1806758428	FZBRYGGMSBTKEU-IEZWGBDMSA-N	432.348	1.987	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC2(CCCN(C(=O)c3cccnc3C(N)=O)C2)CC1	1807381495	IOAIKDLFDGCRSF-CYBMUJFWSA-N	437.338	1.809	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)c1cc[nH]c2nccc1-2	1808068059	YAENGZHELIGVNZ-BMGDILEWSA-N	427.892	1.829	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)c3coc(Cl)n3)CC2)C1	1809968914	HJASLMHJPRMREI-UHFFFAOYSA-N	431.685	1.166	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H](CNC(=O)[C@@H]2CNC(=O)C2)[C@@H]1c1cccnc1	1812643544	UZIWFMHSRNKTRR-AESZEHBQSA-N	437.338	1.397	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)COC(=O)C(F)(F)F)[C@@H]1c1cccnc1)C(Cl)Cl	1813077399	ICMGGZBDJOBGCF-CMPLNLGQSA-N	442.221	1.997	50	20	IDGD	
C[C@H](Cn1cncn1)C(=O)N1CC[C@H](CNC(=O)C(Cl)Cl)[C@@H]1c1cccnc1	1813077430	INTAJYASEHCQSL-YUELXQCFSA-N	425.320	1.819	50	20	IDGD	
N[C@@H](Cc1cccnc1)C(=O)N1CC[C@H](CNC(=O)C(Cl)Cl)[C@H]1c1cccnc1	1813080874	ZSDIBAHIUYXVMG-IXDOHACOSA-N	436.343	1.856	50	20	IDGD	
O=C(C#Cc1ccccc1)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2	1814012631	WCIDXEAMIFGAIM-SFHVURJKSA-N	445.309	1.100	50	20	IDGD	
Nc1c(C(=O)N2CCCC[C@H]2c2cc(NC(=O)[C@H](O)CCl)n[nH]2)sc2nccnc12	1814870259	MSVQPFLJROCDNK-WDEREUQCSA-N	449.924	1.902	50	20	IDGD	
C[C@H](NC(=O)c1ccccn1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](O)CCl)n[nH]1	1814875034	MLDACNLAIKXRAL-VBNZEHGJSA-N	448.911	1.215	50	20	IDGD	
CCS(=O)(=O)N[C@H](C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)C(C)(C)CCl)[nH]n1	1815165001	OLGYAXMZCQOPEW-OCCSQVGLSA-N	447.989	1.995	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H]1CC=CCC1)CC2)c1ccc(B(O)O)cc1	1815335684	KFEUQAFXKYTXJO-CZUORRHYSA-N	425.319	1.405	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@](C)(O)C(F)(F)F)n[nH]1	1815533961	UKTKXUOEFBOALA-SJCJKPOMSA-N	448.446	1.088	50	20	IDGD	
O=C(CSc1ncccn1)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](O)CCl)CC2	1815624071	YJGAHIULFYMPQY-GXSJLCMTSA-N	427.939	1.237	50	20	IDGD	
Cc1nn[nH]c1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](C)CBr)CC2	1815931652	JQJYJXYTDDBRSE-IONNQARKSA-N	427.328	1.826	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H]2CCC(=O)N2)n[nH]1	1816965921	IMMDGECXUCUOAS-GMXVVIOVSA-N	426.315	1.711	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc[nH]n1)CC2	1817276503	UIGJAHAORCMJNL-IVWJEFBKSA-N	440.489	1.226	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)Cc2ccccn2)[nH]n1)c1ccc(B(O)O)cc1	1817471434	NQPCQQKBZKUUJA-IBGZPJMESA-N	433.277	1.033	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2sccc2F)[nH]n1)c1cccc(B(O)O)c1	1817474535	UJVLYAHRIDNKCN-MRXNPFEDSA-N	442.281	1.910	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1	1817479363	LLHWFCJJZLMXLI-XHDPSFHLSA-N	449.114	1.179	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](C)Cn3cncn3)sc2C1	1820078497	MSHCIFQROSSFTM-TUAOUCFPSA-N	426.930	1.237	50	20	IDGD	
Cc1ccn(C)c1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1820356388	AHSKESRLIQTGKI-GOSISDBHSA-N	435.293	1.356	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)CCn2cncn2)[nH]n1)[C@H](F)Br	1820936560	BWAVRYXLZBXKLA-FZMZJTMJSA-N	428.266	1.774	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)CC1	1824186038	NTIALDLKPFQDLM-HOTGVXAUSA-N	431.961	1.731	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1c[nH]c(=O)cn1)CC2	1825450697	UEAGUWRPZDOLHH-BDAKNGLRSA-N	440.323	1.626	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccnc3c1OCO3)CC2	1826002820	CUEUQJLEYHZAIC-ONGXEEELSA-N	438.893	1.746	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cnccc2F)CC1	1827326156	ZEWFKAPLKPJOKZ-IBGZPJMESA-N	433.528	1.827	50	20	IDGD	
Cc1[nH]ccc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1	1827880855	OBRNWIIOWQWILL-HXUWFJFHSA-N	438.532	1.869	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830353575	FUGRLDJBTVSLBZ-SUMWQHHRSA-N	439.778	1.739	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)cc1Cl	1830720368	YIYUFJXFPLJMDC-VQIMIIECSA-N	431.316	1.318	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cn3nnc4ccccc43)C2)C1	1831640352	LMUMAWJFZSFWEG-IIBYNOLFSA-N	449.939	1.295	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@](C)(O)C(F)(F)F)CCO2	1832149607	APPZMHGBYBICOY-VBNZEHGJSA-N	430.851	1.164	50	20	IDGD	
C[C@]1(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1(F)F	1832802025	MHGRUPFPMVGMKD-WIYYLYMNSA-N	434.292	1.645	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)/C=C/c3ccco3)CCO2)C1	1833069214	LJNBVJHGVZZCQK-FKXXJOMMSA-N	441.322	1.780	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3ccc(F)nc3F)CC2)CC1)[C@H](O)CCl	1833306858	IQSUKLAVJHMZOF-OAHLLOKOSA-N	430.883	1.145	50	20	IDGD	
CC(=O)C(C)(C)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)Br)CC2)CC1	1833412042	VXKIXOWETWJFGM-CYBMUJFWSA-N	430.387	1.957	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)nc1C	1833692053	JISJEEDKAYIAOM-NRFANRHFSA-N	435.597	1.620	50	20	IDGD	
Cc1ncsc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)CBr)C2)C1	1834261973	OCWBOOFKSQEDTL-SJCJKPOMSA-N	446.367	1.553	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cc(=O)cco3)CC2)CC1	1834345186	OASCWSVFIVALCY-KRWDZBQOSA-N	425.913	1.079	50	20	IDGD	
CCc1ccnc(C(=O)N2CCOC[C@]3(CN(C(=O)CCBr)CCO3)C2)c1	1834822415	MEYLQCIXXOMRFD-IBGZPJMESA-N	440.338	1.499	50	20	IDGD	
Cc1noc(C)c1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839198091	SMTXLKBUEPPUPY-XJKSGUPXSA-N	434.262	1.052	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)cc1O	1839267240	OVIWAVRFILJFQD-YJBOKZPZSA-N	445.285	1.461	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccsc3)C2)C1	1839963413	JKZOVJGKFMLILS-WMLDXEAASA-N	431.352	1.992	50	20	IDGD	
C#CCCCCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](Br)CC)CCO2	1839967759	XXNYVCWSKRDVBL-LPHOPBHVSA-N	429.355	1.810	50	20	IDGD	
Cc1cnc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)s1	1840031182	HYZOISXQYOWWOK-LRDDRELGSA-N	432.340	1.305	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cncc(F)c3)C2)C1	1840031299	LOKJBFNQVOASGH-SJKOYZFVSA-N	430.274	1.074	50	20	IDGD	
COC(=O)c1ccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)cc1	1840278393	GVMVYKYPUDXLTO-YLJYHZDGSA-N	442.871	1.007	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@]1(C)CC1(F)F)CCO2	1840829576	KAYQTAYLZVHVSX-CQDKDKBSSA-N	425.270	1.272	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](CC(=O)N2CC3(CCCN3C(=O)[C@@H](O)CCl)C2)C1	1841354230	OYMRULSTOZMSCZ-CABCVRRESA-N	429.945	1.437	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@H](CC(=O)OC)NC(=O)OC(C)(C)C)C2	1845167446	COBIIULMOBSGSU-ZIAGYGMSSA-N	445.944	1.664	50	20	IDGD	
O=C([C@H]1ON=C(c2ccccc2)O1)N1CC2(CCCN2C(=O)[C@H](F)Br)C1	1845218117	NFGVOJJVHNBYTR-BLLLJJGKSA-N	426.242	1.615	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC2(CCCN2C(=O)[C@H](O)NC(=O)OC(C)(C)C)C1	1845440051	NCBDFMTVUMJWDM-RYUDHWBXSA-N	434.331	1.206	50	20	IDGD	
C[C@H](NC(=O)c1ccccn1)C(=O)N1CCCC12CN(C(=O)[C@H](F)Br)C2	1845770415	UEDXGOYMTFXXIO-AAEUAGOBSA-N	427.274	1.094	50	20	IDGD	
COc1ccc(Cl)cc1CC(=O)N1CCCC12CN(C(=O)c1cccc(B(O)O)c1)C2	1845920805	KMFUOPVQEGONHB-UHFFFAOYSA-N	442.708	1.088	50	20	IDGD	
CC(=O)N[C@@H](C(=O)N1CC2(CCCN2C(=O)[C@H](C)Br)C1)c1ccc(F)cc1	1846178295	PBYTWBGMWWMVHR-BLLLJJGKSA-N	440.313	1.990	50	20	IDGD	
CC(C)C(=O)NNC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(Br)cc2)C1	14350910	GPMORYAFKHLTAI-LBPRGKRZSA-N	432.340	1.653	50	20	IDGD	
COc1ccc(OC)c(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1	18823262	WVEFHHATPCVXNQ-UHFFFAOYSA-N	433.486	1.563	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN(C)CC(=O)Nc2ccccc2SC)cc1OC	31039593	QGJCFNWFIMIDSC-UHFFFAOYSA-N	446.529	1.757	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)c1cccc(CN2CCS(=O)(=O)CC2)c1	725878236	MREIZHZATYKQPW-UHFFFAOYSA-N	445.541	1.319	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(N2CCCS2(=O)=O)cc1)c1ccc(Cl)cc1O	726766871	PPAFCPGKAXANHW-UHFFFAOYSA-N	445.906	1.209	50	20	IDGD	
CCOC(=O)c1sc2ncc(S(=O)(=O)NNC(=O)N3CCOCC3)cc2c1C	726767061	VFWCWJNLAZAZMY-UHFFFAOYSA-N	428.492	1.017	50	20	IDGD	
CCOC(=O)c1c(S(=O)(=O)NNC(=O)[C@@H](C)Oc2ccc3ccccc3c2)n[nH]c1C	728170495	YEZSBRLRLKGJNI-CYBMUJFWSA-N	446.485	1.825	50	20	IDGD	
Cn1cc(S(=O)(=O)NNC(=O)c2ccc(Br)cc2Cl)cc1C(N)=O	728854487	WPQPQBSYLVSKQB-UHFFFAOYSA-N	435.687	1.163	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N(CC(N)=O)C(C)C)cc1	728856930	NPBBWJNMEDVBLI-YBEGLDIGSA-N	438.488	1.063	50	20	IDGD	
CC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	728889622	LFENZKVVDCHVHE-HXUWFJFHSA-N	449.515	1.069	50	20	IDGD	
O=C(NCCc1ccn(-c2ccccc2)n1)NNC(=O)C1CCN(c2ncccn2)CC1	728951141	CTNOBKAMSLLIKL-UHFFFAOYSA-N	434.504	1.452	50	20	IDGD	
CN(Cc1ccc(Br)o1)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	728959975	TZZSNDNSAJUUPH-UHFFFAOYSA-N	437.298	1.921	50	20	IDGD	
CC[C@@H](NC(=O)NNC(=O)COc1ccccc1OC)c1cccc(S(N)(=O)=O)c1	729221228	LFELIBQEKCBVSZ-OAHLLOKOSA-N	436.490	1.203	50	20	IDGD	
CNS(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=S)Nc2ccc(OC)nc2)c1	729692391	SGERTBBFILNKFM-UHFFFAOYSA-N	429.911	1.283	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2cocn2)c1	730912238	PTRRBBGLIRRXBJ-UHFFFAOYSA-N	445.457	1.628	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)[C@@H]1CCCN(S(=O)(=O)Cc2ccccc2)C1	731491136	FVZRPOPIMTZKLU-QGZVFWFLSA-N	431.514	1.698	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)Sc1nnc(-c2ccc(OC(F)F)cc2)n1N	731904695	PHBMCJHEWAKVAA-JTQLQIEISA-N	428.465	1.934	50	20	IDGD	
CS(=O)(=O)c1ccc(OCCNC(=O)NNC(=O)NCc2ccc(Cl)cc2)cc1	733040326	BNFYVLYWZZATOM-UHFFFAOYSA-N	440.909	1.836	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCCOC[C@H]1CCCO1	734518988	MJNBXXXDVIEXGG-SWLSCSKDSA-N	430.299	1.742	50	20	IDGD	
C[C@H]1C[C@H](C)CN(S(=O)(=O)c2cccc(C(=O)NNc3ncnc4[nH]cnc34)c2)C1	740746923	YXJXSRALCRUIEN-STQMWFEESA-N	429.506	1.776	50	20	IDGD	
CCCNC(=O)c1cccc(C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)c1	741206744	FBBBFJDUGUGDRW-UHFFFAOYSA-N	446.529	1.217	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNS(=O)(=O)c1cc(Cl)cc(C(=O)OC)c1	741646974	MEMOFGMVXMBUDK-UHFFFAOYSA-N	442.877	1.914	50	20	IDGD	
COc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NNC(=O)c2cccc3ccccc23)cc1	741700557	FJSJKYIODXNGIE-AWEZNQCLSA-N	427.482	1.976	50	20	IDGD	
CN(C)C(=O)CS(=O)(=O)c1ccc(C(=O)NNc2ncccc2C(F)(F)F)cc1	743483107	SISIKCNIJZTADI-UHFFFAOYSA-N	430.408	1.719	50	20	IDGD	
CC(=NNC(=O)C(=O)NC1CC1)c1ccc(S(=O)(=O)NCc2ccc(F)cc2)cc1	744827991	SNDTUKMDSMOSEQ-UHFFFAOYSA-N	432.477	1.423	50	20	IDGD	
CC(=O)N[C@@H](CC(=O)OCC(=O)NNC(=O)c1cccc(C#N)c1)c1c(F)cccc1F	744939960	ASDHGOWCLXXTSA-KRWDZBQOSA-N	444.394	1.408	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1cn(Cc2ccccn2)nn1	745578088	PARJDHLZSQWKKQ-UHFFFAOYSA-N	444.835	1.001	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)N[C@@H]2CCCN(c3ccn(C)n3)C2=O)c(C)n1-c1ccccc1	745883939	RBPQAUUAAAMNKB-LJQANCHMSA-N	449.515	1.967	50	20	IDGD	
COc1cc(OC)c2cc(C(=O)NNC(=O)c3cncc(NC(C)=O)c3)[nH]c2c1OC	746307326	RBVNUSRGAPXOIC-UHFFFAOYSA-N	427.417	1.622	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NNC(=O)CCOc2ccccc2)cc(OC)c1OC	747107936	FXOLPPRZBVGVHQ-UHFFFAOYSA-N	432.433	1.157	50	20	IDGD	
CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)NNC(=O)COCc1ccccc1	749399733	KOQRERSZTQHRNR-HXUWFJFHSA-N	426.448	1.718	50	20	IDGD	
CC[C@@H](Nc1c([N+](=O)[O-])c(C)nn1C)C(=O)NNC(=O)c1cc(-c2ccc(C)cc2)[nH]n1	749529298	GJNYFPRAMGYIOW-CQSZACIVSA-N	440.464	1.987	50	20	IDGD	
Cc1nn(-c2cncc3nnnn23)c(C)c1CC(=O)NNC(=O)CCCc1ccccc1	749818103	HBQKYKJHQOBNHJ-UHFFFAOYSA-N	433.476	1.035	50	20	IDGD	
CC(C)CCN1CCC(CNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)CC1	751112314	UBRUJNLOONBCCC-UHFFFAOYSA-N	431.585	1.782	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)CNC(=O)CC2CCCC2)cc1	751291580	WSPKJCVONUECFV-UHFFFAOYSA-N	430.534	1.565	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)NNC(=O)Nc2cc(Cl)c(OC)cc2OC)c(C)o1	751616016	AZZYTSZCQZRKLC-UHFFFAOYSA-N	446.869	1.633	50	20	IDGD	
CN1C(=O)c2cccc3c(S(=O)(=O)NNC(=O)[C@@H]4COc5ccccc5O4)ccc1c23	753769054	HXUUCPYBCDRYBB-KRWDZBQOSA-N	439.449	1.579	50	20	IDGD	
COC[C@H](C)n1c(SCC(=O)NNC(=O)Cc2cc[nH]n2)nnc1-c1ccccc1	755285857	WQPYGNWJWZCJHS-ZDUSSCGKSA-N	429.506	1.358	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)Nc1cc(F)ccc1F	755365076	RAYSXCOYHGJAKS-UHFFFAOYSA-N	440.428	1.452	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)Nc1ccc(NC(=O)c2ccco2)c(Cl)c1	756167688	HJZCCBUMBBKKLO-SNVBAGLBSA-N	440.865	1.773	50	20	IDGD	
CNC(=O)CCOc1ccc(NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1	756462931	ZJVJTSKRFKWJMG-UHFFFAOYSA-N	441.492	1.061	50	20	IDGD	
CN(c1ccccc1NC(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)S(C)(=O)=O	757662162	WXPAMMTUAOXWCE-UHFFFAOYSA-N	443.526	1.540	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)Nc2ccc(C)c(S(=O)(=O)NC3CC3)c2)cc1	757873698	KGYDMWSGABUGNQ-UHFFFAOYSA-N	448.501	1.676	50	20	IDGD	
O=C(NNC(=S)NC[C@@H]1CCCCO1)c1cccc(S(=O)(=O)N2CCCC2)c1	758171921	JJCSEHQHIAEBIB-HNNXBMFYSA-N	426.564	1.149	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NN=C2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)c1	760227621	YIWCURBUYFGDPM-INIZCTEOSA-N	434.478	1.943	50	20	IDGD	
Cc1ccnc(-n2nccc2NC(=O)C(=O)NNC(=O)c2cccc(Br)c2)c1	760278352	WNPVPMRUPGDENP-UHFFFAOYSA-N	443.261	1.738	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)[C@H]1CCCN(C(=O)Cc2ccccc2)C1	760438931	AMUSNBRHWBIEQD-KRWDZBQOSA-N	432.521	1.530	50	20	IDGD	
CCOCCOc1ccc(S(=O)(=O)NNC(=O)CSc2ccccc2O)cc1	763410698	OSAOOPRFYKSSBV-UHFFFAOYSA-N	426.516	1.909	50	20	IDGD	
COC(=O)c1ccc(C)c(NC(=O)C(=O)NNC(=O)c2ccccc2Br)c1	763484359	XMMAGOSZHVZPGD-UHFFFAOYSA-N	434.246	1.944	50	20	IDGD	
O=C(NNC(=O)c1cc2ccccc2cc1O)C(=O)Nc1ccc(Cn2cncn2)cc1	763521906	KQIMGEHRECTTRE-UHFFFAOYSA-N	430.424	1.585	50	20	IDGD	
Cc1cc(S(C)(=O)=O)ccc1NC(=O)C(=O)NNC(=O)c1cc2ccccc2cc1O	763522055	MKSRCVZWYOCDTG-UHFFFAOYSA-N	441.465	1.657	50	20	IDGD	
COC(=O)c1ccc(-n2cc(C)cn2)c(NC(=O)C(=O)NNC(=O)c2ccccc2O)c1	763526223	ICIUQKVUMVUZCH-UHFFFAOYSA-N	437.412	1.073	50	20	IDGD	
COC(=O)c1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)[C@H]1COc2ccccc2O1	763571298	LWMDXSBEPAQEKL-OAHLLOKOSA-N	433.804	1.053	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cccc(I)c2)c(C)o1	763576588	OVUQAUBTTPBGFQ-UHFFFAOYSA-N	427.198	1.901	50	20	IDGD	
O=C(COc1cccc(C(F)(F)F)c1)NNC(=O)C(=O)Nc1cnn(-c2ccccc2)n1	763640646	PVSYREXUFJUIOI-UHFFFAOYSA-N	448.361	1.451	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2cccc(-c3nnc(C)n3C)c2)c1	763646032	ALXZQVHLDAHJRT-UHFFFAOYSA-N	436.472	1.572	50	20	IDGD	
COC(=O)c1cc(Cl)ccc1NC(=O)C(=O)NNC(=O)COc1ccc(OC)cc1	763660837	HXXUPIYOAFVQNW-UHFFFAOYSA-N	435.820	1.300	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2F)nn1-c1cccc(F)c1	763681245	NWRBJZXAKZHEAQ-UHFFFAOYSA-N	429.383	1.624	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2c3c(nn2-c2ccccc2)CCC3)c1	763775165	MHEUOFNGWQQBJD-UHFFFAOYSA-N	449.467	1.778	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCC3)cccc1N1CCOC1=O	763785278	NLGGFAXDCDVBTB-UHFFFAOYSA-N	428.470	1.902	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(S(=O)(=O)N(C)C)ccc2F)cc1	763833301	AFHPCYZSTXSFLF-UHFFFAOYSA-N	436.465	1.038	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)n(Cc2ccccc2)n1	763865872	SGBMGMKBQZHSHK-OAHLLOKOSA-N	439.447	1.932	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C)cc2C(=O)OC)cc1OC	763912317	WOWZFPNGWJXSHH-UHFFFAOYSA-N	443.456	1.979	50	20	IDGD	
Cc1ccc([C@@]2(C)NC(=O)N(CC(=O)NNC(=O)CSc3ccccc3O)C2=O)cc1	764048591	BRLZWZXXVYXFRW-OAQYLSRUSA-N	442.497	1.407	50	20	IDGD	
CO[C@@H]1Cc2ccc(NC(=O)C(=O)NNC(=O)c3cccc(Br)c3)cc2C1	764058526	KAEAHPCPOUVOHD-MRXNPFEDSA-N	432.274	1.962	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1c(C)c(C)nn1-c1ccc(C#N)cc1	764133024	SLDOBAJLNWARJC-UHFFFAOYSA-N	446.467	1.698	50	20	IDGD	
C[C@H](c1cccc(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)c1)N1CCOCC1	764152374	DKSRJVHRUOFRMC-QRWLVFNGSA-N	438.484	1.169	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)C(=O)Nc1ccc(OCC(F)F)cc1	764261082	XVLOTZQKOWZCOY-UHFFFAOYSA-N	448.430	1.123	50	20	IDGD	
C[C@@H](NC(=O)OC(C)(C)C)c1ccc(NC(=O)C(=O)NNC(=O)Cc2cc[nH]n2)cc1	764292509	CFMJRZRBPMAJHC-GFCCVEGCSA-N	430.465	1.324	50	20	IDGD	
CC(C)(C(=O)NNC(=O)C(=O)Nc1cnn(CC(=O)NC2CCCC2)c1)c1ccccc1	764314726	YTGXOBIXYMFGDC-UHFFFAOYSA-N	440.504	1.006	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)CNC(=O)c2cccnc2)cc(C)c1OCc1cccnc1	764344559	ZLPUWFSNHATOGF-UHFFFAOYSA-N	433.468	1.863	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)C(=O)Nc1cccnc1OCC(F)F	764392888	AEUPXWHANYHEGA-UHFFFAOYSA-N	426.401	1.309	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2F)cc1S(C)(=O)=O	764410170	INWSQSUMKGQHIO-UHFFFAOYSA-N	427.841	1.591	50	20	IDGD	
CN(C)C(=O)COc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2F)cc1	764413019	LDEMIGDCAGVVOL-UHFFFAOYSA-N	436.827	1.346	50	20	IDGD	
Cc1nc2c(c(O)nn2C)c(C)c1CCC(=O)NNC(=O)CCCNC(=O)OC(C)(C)C	765319116	DJSAZUQXQCZAKZ-UHFFFAOYSA-N	448.524	1.676	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)CCc3nc4ccccc4[nH]3)CC2)cc1	765756423	WKJBKKCJCFLLQI-UHFFFAOYSA-N	434.544	1.769	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)c2ccccc2S(=O)(=O)CCN(C)C)c1C	767161220	FRKVEXODGQBKQU-KRWDZBQOSA-N	447.557	1.867	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCN(c2nccc(C(C)C)n2)CC1	767892946	RDDHEFZCGFKJJO-UHFFFAOYSA-N	446.939	1.845	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2ccc(F)cc2C(=O)N(C)C)c1	768231920	IKASEPXBOCXMAL-UHFFFAOYSA-N	430.436	1.309	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])o1)c1cc(-c2cccs2)[nH]n1	768268723	SSQGXVURNOPUDL-LBPRGKRZSA-N	444.429	1.705	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)[C@@H](C(C)C)N2C[C@H](C)O[C@H](C)C2)n[nH]1	768282076	WBDNNMFCCBSQOQ-QEEYODRMSA-N	429.521	1.980	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)COc1ccc(OCc2ccccc2)cc1)[C@@H]1CN(C)CCO1	770435312	MLEUOVZUWWGRAC-UWJYYQICSA-N	442.516	1.694	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)NC1CCN(C2CCN(C)CC2)CC1	770440844	RSIIENUMYHRHEQ-HNNXBMFYSA-N	437.972	1.996	50	20	IDGD	
CCc1nn(C)cc1C(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	770576199	XCHQHFDYWJYMNE-UHFFFAOYSA-N	430.468	1.816	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)c1cc(S(=O)(=O)N2CCC2)ccc1Cl	772170568	SWQWHDWQCUGEFM-GFCCVEGCSA-N	445.925	1.473	50	20	IDGD	
COCCS(=O)(=O)c1ccc(C(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)cc1	772965744	FNYUNEGZMHREKZ-CYBMUJFWSA-N	440.905	1.989	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)NCCNS(=O)(=O)c3cccnc3)cc2C1	772973364	KBBFVMXHFJZLRJ-GFCCVEGCSA-N	437.547	1.190	50	20	IDGD	
O=C(NNC(=O)c1cccc(Cl)c1)C(=O)Nc1ccc(I)cn1	773524052	KQJPYHMSAMBQJZ-UHFFFAOYSA-N	444.616	1.739	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1cccnc1-c1cnn(C)c1	774007588	CIMJIZUSOLJNII-LBPRGKRZSA-N	442.863	1.689	50	20	IDGD	
O=C(NNc1ncccn1)Nc1cc(S(=O)(=O)N2CCOCC2)ccc1N1CCCC1	775433097	UQAUSRZRMZVEKR-UHFFFAOYSA-N	447.521	1.246	50	20	IDGD	
CO[C@H](c1ccccc1F)[C@H](C)NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1	775736140	NMILLDAQDOONEG-KSSFIOAISA-N	430.484	1.939	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCC(O)(Cc3ccc(F)cc3)CC2)cc1OC	775741889	MFDDZCOWCAJHOR-UHFFFAOYSA-N	445.491	1.674	50	20	IDGD	
Cc1oc(-c2cnn(C)c2)nc1C(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776203047	ZFAFXJJECKZVQD-UHFFFAOYSA-N	447.496	1.633	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN([C@@H]2CCCN(C(=O)NNC(=O)c3ccccc3)C2)C(=O)C1	776846029	HXMWZKVVRGLRNP-QGZVFWFLSA-N	445.520	1.585	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CN(C)[C@H](C)c2cccc(N3CCCS3(=O)=O)c2)c1	778227742	WDBMJOJKJXQYKH-QGZVFWFLSA-N	444.557	1.989	50	20	IDGD	
CN(C)C(=O)COc1ccccc1C(F)(F)C(=O)NNC(=O)COc1ccc(C#N)cc1	778523685	FIRGWDULEPGZQF-UHFFFAOYSA-N	446.410	1.343	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)[C@@H](O)[C@H](O)c3nc4ccccc4s3)n[nH]2)cc1	779499450	HLWSDCNAALTFCU-ROUUACIJSA-N	437.481	1.850	50	20	IDGD	
O=C(NNC(=O)[C@@H](O)[C@H](O)c1nc2ccccc2[nH]1)c1ccc(COc2ccccc2)o1	779582264	NGQZTHUAFAUXMH-OALUTQOASA-N	436.424	1.590	50	20	IDGD	
CC(C)(C)c1ccc(NNC(=O)c2ccc(S(=O)(=O)N3CCNC(=O)C3)cc2)cc1	780806035	RCIBZTNJWMUNOT-UHFFFAOYSA-N	430.530	1.862	50	20	IDGD	
O=C(COC(=O)c1cn(-c2cccc(Cl)c2)nn1)NNC(=O)c1cccc([N+](=O)[O-])c1	781389500	DMTNBKYFRQRDLG-UHFFFAOYSA-N	444.791	1.447	50	20	IDGD	
CCOCc1cccc(NC(=O)C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)c1	782896531	JWIDPCBRISFPCV-UHFFFAOYSA-N	447.517	1.224	50	20	IDGD	
O=C(NNc1ccc(Br)cc1F)C(=O)Nc1cccnc1N1CCOCC1	783086910	WJMBSRSCLZNGLZ-UHFFFAOYSA-N	438.257	1.902	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2cncc3ccccc23)nc1	783263834	LKRBNTLXVBWYAG-UHFFFAOYSA-N	428.474	1.398	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NN=c2cc[nH]cc2)cc1S(=O)(=O)N1CCCCC1	783369872	FNMYOYDSJDVUJP-UHFFFAOYSA-N	447.517	1.159	50	20	IDGD	
Cc1ccccc1NC(=O)NNC(=O)C(=O)Nc1ccc(C(=O)NC2CCOCC2)cc1	783412595	ADKVTCQAOKMRHG-UHFFFAOYSA-N	439.472	1.695	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)N[C@H]1CCCN(Cc2ccccn2)C1=O	784172291	ALTXXZXCUREHLV-ZDUSSCGKSA-N	435.282	1.307	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)C(=O)Nc1ccc(C(F)(F)F)nc1	784213493	OAGGHUAGVODEEW-UHFFFAOYSA-N	443.407	1.623	50	20	IDGD	
O=C(NNc1ccnc(Br)c1)C(=O)Nc1cccc(Cn2cccnc2=O)c1	784837405	QXUMGIXJMYDEAY-UHFFFAOYSA-N	443.261	1.531	50	20	IDGD	
COC(=O)N(C)Cc1ccc(NC(=O)C(=O)NNc2ccc(C(F)(F)F)nn2)cc1	784885920	HALGRYXNOMPVIZ-UHFFFAOYSA-N	426.355	1.775	50	20	IDGD	
CC[C@@]1(C)Oc2ccc(NC(=O)C(=O)NNC(=O)CNC(=O)c3cccs3)cc2O1	785995223	UEOUMTQNZJWNAF-IBGZPJMESA-N	432.458	1.161	50	20	IDGD	
Cn1nc(C(=O)NN=Cc2cn(CCC#N)nc2-c2ccncc2)c2ccccc2c1=O	788415342	NVIBUVRYAJURBP-UHFFFAOYSA-N	426.440	1.870	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)cc1	788914690	DHPSSQINRAJCLL-UHFFFAOYSA-N	442.538	1.883	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)Nc1nc([C@@H]2C[C@H]3CC[C@H]2C3)cs1	789731683	IHCHXPDWVORTTL-JRATXPSKSA-N	442.497	1.973	50	20	IDGD	
CCC[C@H]1CCc2nc(NC(=O)C(=O)NNC(=O)CNC(=O)c3cccs3)sc2C1	789757634	OHDQKJLIKCUWKF-NSHDSACASA-N	449.558	1.626	50	20	IDGD	
CN(C)CCOc1cccc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)c1	789818618	MPRORCRUTWYDGD-PMACEKPBSA-N	440.500	1.286	50	20	IDGD	
O=C(NNC(=O)[C@H]1OCC[C@H]1c1ccccc1)C(=O)Nc1c(F)cccc1-n1cccn1	789821535	UMPGQUWBWLLEGD-KXBFYZLASA-N	437.431	1.670	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2cccc(N3CCC3=O)c2)n[nH]1	790952697	QEDUMQKUKAFBDT-UHFFFAOYSA-N	448.439	1.222	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2cccc(F)c2[N+](=O)[O-])cc1NS(C)(=O)=O	790993234	ANCNFGUJMVQHRC-UHFFFAOYSA-N	441.397	1.196	50	20	IDGD	
O=C(CCc1ncc[nH]1)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	791195865	LFOXEBDVXSNHAH-UHFFFAOYSA-N	427.486	1.282	50	20	IDGD	
O=C(NN=Cc1c(F)ccc(I)c1F)N[C@H]1CCS(=O)(=O)C1	794497680	NQZOAESFHGICRF-ZETCQYMHSA-N	443.213	1.390	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)CCOc2ccc(S(C)(=O)=O)cc2)cc1	794721026	OVJQTGTWLBUYRU-UHFFFAOYSA-N	441.531	1.253	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccc(F)cc1-c1cnn(C)c1	796989938	MXUBQLDMWGHYKW-GFCCVEGCSA-N	443.410	1.919	50	20	IDGD	
CCCc1c(NC(=O)C(=O)NNC(=O)c2ccc[nH]2)cnn1-c1cc(F)c(OC)cc1F	796999478	MXLLNFHRPYFMLP-UHFFFAOYSA-N	446.414	1.839	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)(F)F)cc1)C(=O)Nc1cccc2c1CCO2	797053226	QJIXNZNOTGCLQH-UHFFFAOYSA-N	429.376	1.997	50	20	IDGD	
COC(=O)c1ccc(NC(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)cc1OC	797673997	DSVLJNWCBZDRGS-UHFFFAOYSA-N	433.417	1.974	50	20	IDGD	
CC(C)Oc1ccc(NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1C(N)=O	797675533	ARKAPMTUJJORLK-UHFFFAOYSA-N	441.492	1.432	50	20	IDGD	
CN(CCCOCc1ccccc1)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	798530799	UDOAYAYPRFOKIH-UHFFFAOYSA-N	426.521	1.973	50	20	IDGD	
COC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)nc2)c1OC(C)C	799258846	NQLABXOYUNAHHB-UHFFFAOYSA-N	434.836	1.709	50	20	IDGD	
O=C(CN1C(=O)c2cccc(Cl)c2S1(=O)=O)NNC(=O)c1cccc(Cl)c1	799317913	DMXWBXCRNXBDMH-UHFFFAOYSA-N	428.253	1.599	50	20	IDGD	
CCOC(=O)c1ccccc1S(=O)(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	799538399	DPZSIYFNAQZMGA-UHFFFAOYSA-N	439.877	1.143	50	20	IDGD	
COc1cc(N2C[C@H](C(=O)NNC(=O)Nc3ccccc3)CC2=O)cc(OC)c1OC	801991900	ZWUUJYYIZYFTJI-CYBMUJFWSA-N	428.445	1.918	50	20	IDGD	
Cc1cnc(COCC(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)o1	802763721	ZZUDYBMMHWLTAN-UHFFFAOYSA-N	435.912	1.118	50	20	IDGD	
Cc1cc([N+](=O)[O-])ccc1NNC(=O)[C@@H]1CCCC[C@H]1C(=O)N[C@@H]1CCS(=O)(=O)C1	805386001	CXQTZOCOBOXQJY-FVQBIDKESA-N	438.506	1.456	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc2c(c1)OCCCO2)NNc1nccnc1C1CCC1	805462235	CSHLYLGTENUHTH-UHFFFAOYSA-N	447.517	1.717	50	20	IDGD	
CC1(C)CC(=O)c2cc(NC(=O)C(=O)NNC(=O)[C@H]3COc4ccccc4O3)ccc2O1	806972985	VCDNCVNWEBBNLG-GOSISDBHSA-N	439.424	1.356	50	20	IDGD	
COc1ccc(CS(C)(=O)=O)cc1NC(=O)C(=O)NNc1nc2ccccc2s1	806990882	JPQCWXKPILJZJJ-UHFFFAOYSA-N	434.499	1.931	50	20	IDGD	
CSc1ccc(-c2nsc(NC(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)n2)cc1	809932441	YCNKKOAVBPZHQT-QMMMGPOBSA-N	430.537	1.017	50	20	IDGD	
CCSc1cccc(Br)c1NC(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O	810307051	VSOAIVJNCXUEFP-MRVPVSSYSA-N	439.357	1.652	50	20	IDGD	
CCNC(=O)N(C)NC(=O)[C@H](CCSC)NS(=O)(=O)c1ccc2ccccc2c1	810854225	OSOJUHIOMVDSOM-KRWDZBQOSA-N	438.575	1.932	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCC(=O)NNc2cnc3ccccc3n2)cc1OCC	811460847	BBCVPIVTTPZRFL-UHFFFAOYSA-N	445.501	1.849	50	20	IDGD	
CC(=O)N1c2ccc(S(=O)(=O)NNC(=O)[C@H]3COc4ccccc4O3)cc2C[C@@H]1C	812536324	XVAKLMCZLYRJCG-HXPMCKFVSA-N	431.470	1.134	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2nc3c(s2)CSCC3)cc1	813034048	WKAPMMQCQNEKTD-UHFFFAOYSA-N	441.560	1.265	50	20	IDGD	
Cc1nn(CC(=O)OC(C)C)c(C)c1C=NNC(=O)Nc1ccc(S(N)(=O)=O)cc1	814967266	CYJCHGJHFJIKMX-UHFFFAOYSA-N	436.494	1.255	50	20	IDGD	
O=C(CC1CC1)NNC(=O)C1CCN(S(=O)(=O)c2cccc(OC(F)(F)F)c2)CC1	819110155	VOPPJBOXQYAFRG-UHFFFAOYSA-N	449.451	1.933	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCC(C(=O)c3ccc(O)cc3)CC2)cc1OC	857835928	AHELTAMCDGMXDS-UHFFFAOYSA-N	441.484	1.765	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)c2ccc(F)c(S(=O)(=O)NC(C)C)c2)c1	914748966	QPFUKVYDLCTFRD-UHFFFAOYSA-N	437.493	1.969	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)c1cc(S(=O)(=O)NC(C)C)ccc1F	914751945	QANPEENNHXFGRW-UHFFFAOYSA-N	433.465	1.543	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cnc3nc(C)ccc3c2O)cc1	915109966	SZMIVCMPIIKCRS-UHFFFAOYSA-N	443.485	1.034	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCCCN2CCC(C)CC2)cc1	916194965	IXOXVSFMUFQGGL-UHFFFAOYSA-N	439.582	1.068	50	20	IDGD	
O=C(COc1ccc(OCc2ccccc2)cc1)NNC(=O)NCc1nnc2n1CCC2	916235392	QTNKDQIOKHMRJD-UHFFFAOYSA-N	436.472	1.713	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)NCCNC(=O)c1ccccc1Cl	916263452	DCYDEHSFVOTGCM-UHFFFAOYSA-N	434.880	1.878	50	20	IDGD	
CC[S@](=O)c1ccccc1C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	917510698	IUTSQZRXUOZQPL-PMERELPUSA-N	428.558	1.787	50	20	IDGD	
COCCn1cc(C(=O)NNC(=O)COc2ccc(-c3ccc(C#N)cc3)cc2)ccc1=O	917908203	OFKFWCQMCNEBIC-UHFFFAOYSA-N	446.463	1.873	50	20	IDGD	
CCNS(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)COc2ccccc2OCC)c1	917908559	NFXKKGJYYSNMKN-UHFFFAOYSA-N	439.465	1.363	50	20	IDGD	
COc1cccc(-n2c(CC(=O)NNC(=O)[C@H](C)OC)csc2=NCc2ccco2)c1	917919406	FQKIKKLNXJGDNL-AWEZNQCLSA-N	444.513	1.966	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCc2ccc([C@H]3C[C@@H]3C)o2)cc1	918078532	UTLQTEIESKNGAC-YOEHRIQHSA-N	434.518	1.863	50	20	IDGD	
O=C(COc1ccccc1CNC(=O)NNC(=O)c1ccccc1O)NC[C@@H]1CCCO1	918217525	JHERHOLXASEKDX-INIZCTEOSA-N	442.472	1.210	50	20	IDGD	
COc1cc(CNC(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)ccc1OCCO	918228582	LMIQTMXBNKSNOJ-UHFFFAOYSA-N	430.461	1.152	50	20	IDGD	
N#C/C(=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)NNC(=O)C1CC1	920847508	FONHDYJDNIDNHE-NTEUORMPSA-N	426.864	1.543	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)NNC(=O)N[C@@H]1CCO[C@@]2(CCS(=O)(=O)C2)C1	1319835998	ISVRWBJYGBKOCS-PBHICJAKSA-N	430.914	1.090	50	20	IDGD	
O=C(c1cnc2ccccn12)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1777825202	QWCXCUYTRVTDLU-PBHICJAKSA-N	425.258	1.468	50	20	IDGD	
CN1CCc2cc(C(=O)N3CC[C@]4(CN(C(=O)CCBr)CCO4)C3)ccc21	1777919595	VZDLNFPDPBDRAK-FQEVSTJZSA-N	436.350	1.907	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CC(C)C)C2	1778091161	JMOGTGAPXMNFOD-UPRBLEQPSA-N	431.537	1.680	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2nnsc2C2CC2)C1	1778294990	VSYQDDOUTRFDLG-PJIJBLCYSA-N	442.969	1.797	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2)c1ccnn1-c1ccccc1	1778395791	ORMDJRJWGUMKIZ-WOIUINJBSA-N	446.935	1.600	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4c(c3)NC(=O)CO4)C2)C1	1778570593	CVDCGDFBYJCLJT-VFNWGFHPSA-N	435.908	1.869	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3cn4ccsc4n3)C2)C1	1778623557	IVXJDZYHCUSABC-SJCJKPOMSA-N	441.351	1.870	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cccc3c1NC(=O)C3)CCO2	1779299036	MLTJNXVKMDTUPH-OAQYLSRUSA-N	431.565	1.476	50	20	IDGD	
COC(=O)c1ccc(CC(=O)N2CCO[C@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)cc1	1779301717	UPGNXKFXMYQMGA-QFIPXVFZSA-N	448.592	1.697	50	20	IDGD	
COc1ccnc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)c1OC	1781232475	UYIKHOWCQCIVKS-RBUKOAKNSA-N	446.331	1.779	50	20	IDGD	
CC(=O)N/C(C)=C/C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)Br)C2	1781465337	VWMKIVIDWBUWCC-KUEOTADMSA-N	430.343	1.324	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Cl)C2)C1CCC2(CC1)OCCO2	1781642502	MZXAVBBZOCZENF-JTDSTZFVSA-N	432.920	1.968	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3c(F)ccc(OC)c3OC)C2)C1	1781820810	DYZCDYVTVWUTGP-RNODOKPDSA-N	444.887	1.540	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(=O)cco1)C2	1781900180	MVOZCLGMXUTVSK-IDHHARJASA-N	441.322	1.941	50	20	IDGD	
O=C(c1c(Cl)ccc(Cl)c1O)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1781943787	IHAZAIBAXSJVGW-SJCJKPOMSA-N	437.707	1.742	50	20	IDGD	
CCCC(=O)N[C@@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](Cl)COC)C1	1782176213	YGROYVDOCQUKID-QCBUCWTNSA-N	431.961	1.059	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1783399846	JCIKXMSPWMRFEN-BLLLJJGKSA-N	438.294	1.032	50	20	IDGD	
COc1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](C)Br)C3)C2)cc(Cl)n1	1783538753	VPRXDBWWEDATFT-APPDUMDISA-N	446.729	1.971	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H]2C[C@]21C(=O)N1CC[C@]2(CN(C(=O)[C@H](F)Cl)CCO2)C1	1783684292	FPQQELRLWBKRHZ-WZBLMQSHSA-N	445.919	1.750	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)Cc1ccc(Cl)s1)CCO2	1783933591	RPPOZIZIVJXUPN-IBGZPJMESA-N	442.969	1.147	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(N4CCCCC4)cc3)C[C@@H]21)[C@@H](O)CCl	1784092750	VPTMKEUOFLRWLY-VMXMFDLUSA-N	449.979	1.870	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H]3CC[C@H](C)CC3)C2)C1	1784707058	WOXRBYYZSXFWSE-NGTBQHIZSA-N	443.548	1.777	50	20	IDGD	
Cc1cccc(C(=O)N2CC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)c1Cl	1785028208	JDHBYECLAJBUAU-QFIPXVFZSA-N	442.708	1.086	50	20	IDGD	
COC[C@H](C)C(=O)Nc1ccc(C2(NC(=O)c3cnccc3C(=O)NN)CCC2)cc1	1786436393	BNYHIVRJRYFGTJ-AWEZNQCLSA-N	425.489	1.715	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3nnc4cc(C)nn4c3C)[C@H]2C1	1787911146	HEOSPQHSAXOSET-QAETUUGQSA-N	448.955	1.742	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]2C1)N1C[C@@H]2C[C@H]2C1	1789867844	GZYBEDQBAVMZEX-NHAGCDNQSA-N	432.392	1.543	50	20	IDGD	
CN(C)c1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]3C2)nc1	1789868679	IURGAAFXAACTHH-NUADTHGBSA-N	443.375	1.977	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(C)(C)NC(C)=O)C[C@@H]21	1790958600	VXIBWEYVTUADKQ-AJNGGQMLSA-N	432.359	1.054	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nn(C)c4c3CCC4)C[C@@H]21	1791055819	IYGWPXHYRDYEOO-DSPQJCBJSA-N	439.354	1.286	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cn1cc(Cl)cn1)C2	1792867479	CCKLYQIQLMKVQJ-OHTBPHCPSA-N	433.734	1.157	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1CCN(C(C)C)CC1	1793800014	GUJXMEIAMSGKSO-XMTFNYHQSA-N	444.414	1.870	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cccc(Cl)n1	1794195819	YYWULTJFTODJDD-OVZMXSCWSA-N	430.730	1.651	50	20	IDGD	
Cn1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)/C(C#N)=C/c2ccc(F)cc2F)C3)cn1	1794750934	SSJRLDTUXYVFOG-HTVRTGGUSA-N	441.438	1.509	50	20	IDGD	
COc1ccc(C(=O)CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Cl)C3)cc1	1795136896	XVBGIULZJZUMOY-FTUNRGFVSA-N	426.872	1.782	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)COc1ccccc1	1795190432	DXYMRXBBRCBIBK-KPEUIFRASA-N	425.323	1.829	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](CN)c1ccccc1	1795670476	CPFHWQAEORYDKJ-FWEDZOCSSA-N	438.366	1.350	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)c1ccc(C(F)(F)F)nc1	1796187332	YJSWQQLOWXWILE-BJWYYQGGSA-N	447.222	1.346	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)c1ccc(C(F)(F)F)nc1	1796190863	UTXHYMLHSGRADT-BJWYYQGGSA-N	447.222	1.346	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1	1796935049	RGOUFPPSTSTIPT-ORQFMDKSSA-N	432.908	1.671	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)N1C[C@H]2C[C@H]2C1	1797638899	YBBDTBREBOUBND-PCEZLPAMSA-N	428.371	1.090	50	20	IDGD	
Cn1ncc2cc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3cnccc3C(=O)NN)ccc21	1798440725	XAEQGHBNIFQZRF-BJWYYQGGSA-N	447.499	1.137	50	20	IDGD	
Cc1nccn1CCCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Br	1799352427	WKNCRACRJPHBSL-OCVGTWLNSA-N	431.306	1.252	50	20	IDGD	
CC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN(C)NC(=O)NCc1ccccc1	1799864909	SQNPJYATGABQOT-ACDBMABISA-N	443.548	1.340	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CS(=O)(=O)N1CCCC1)C2	1800078556	ANEPRPPAHRXHPY-UMPJEAMMSA-N	440.393	1.287	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1CCC2(CC1)OCCO2	1800382595	GZRGOSGACVZYKH-YYAJDYIMSA-N	449.375	1.746	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2	1800642532	NMGFWLPPDZBZGN-HPENLJRUSA-N	430.112	1.440	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c(c1)CCCO3)C2	1800763028	MSUMSRUZQBYZND-GMLZMKKNSA-N	437.334	1.998	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)NC(=O)OC(C)(C)C	1800866407	MYZCGIUNPXEWSN-XGFWRYKXSA-N	448.358	1.273	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CCc2nc[nH]c2C1	1801268924	OONWOPIWWCCHDQ-XARJKEAYSA-N	429.348	1.341	50	20	IDGD	
Cc1cc(C(N)=O)cc(C)c1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCC(=O)NN(C)C	1802337964	YJZYRWCYIAJZNX-BCDXTJNWSA-N	443.548	1.027	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc3c(c1)C(=O)CC3)C2	1802338581	POZOBOWJGBEKRF-BCDXTJNWSA-N	426.517	1.440	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)C1CC(F)(F)C1	1802633186	SFAVXNQQULYVGY-APWZRJJASA-N	443.259	1.126	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1CCN(C(=O)C(=O)N(C)C)[C@H]1c1cccnc1	1803009512	WNKIYZUQRSWYRL-SNPRPXQTSA-N	425.327	1.207	50	20	IDGD	
Cn1ncc2cc(C(=O)N3CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]3c3cccnc3)ccc21	1803142864	LICGQBXRXRQMGO-AHRSYUTCSA-N	441.919	1.888	50	20	IDGD	
C[C@H](Oc1ccccn1)C(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1	1803146303	NBAKLDXUTLYYIV-RUENVJTFSA-N	432.908	1.550	50	20	IDGD	
COc1cc(C(=O)NC[C@@H]2CCN(C(=O)CO[Si](C)(C)C)[C@@H]2c2cccnc2)n(C)n1	1804923576	LJKRZDVUFBGJPA-OXJNMPFZSA-N	445.596	1.995	50	20	IDGD	
O=C(CCBr)NC[C@H]1CCN(C(=O)c2ccc[n+]([O-])c2)[C@H]1c1cccnc1	1806339096	IUIKFKJFXYAPET-QAPCUYQASA-N	433.306	1.820	50	20	IDGD	
CCc1oncc1C(=O)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1	1809968348	UTGZSOVRMYUWIL-UHFFFAOYSA-N	425.294	1.075	50	20	IDGD	
O=C(c1ccc2ncoc2c1)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1	1809971859	AFQNUWKVKXLMAK-UHFFFAOYSA-N	447.300	1.666	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1CCN(C(=O)Cn2ccccc2=O)[C@H]1c1cccnc1	1810541490	KMLMRJYFVPANOI-AVRDEDQJSA-N	442.592	1.801	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)N1CC[C@H](CNC(=O)CO[Si](C)(C)C)[C@@H]1c1cccnc1	1810542717	WZSHOFZFLHZTOW-ZTNFWEORSA-N	434.613	1.806	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H](CNC(=O)c2n[nH]cc2[N+](=O)[O-])[C@H]1c1cccnc1	1810640856	VQJHKEOJBQMXPW-RDTXWAMCSA-N	446.540	1.884	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)c1cccn2nccc12	1812150876	CSMWMZLWHLXVBZ-KFKAGJAMSA-N	427.892	1.649	50	20	IDGD	
CC(C)CCC(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1	1812601202	XAZCOUZUTOKHNW-UTKZUKDTSA-N	438.532	1.836	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)C2CC(C)(C)C2)[C@@H]1c1cccnc1	1813074385	QLMDCYUDZSQSQJ-DYESRHJHSA-N	429.565	1.897	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)CC[C@H]2CCOC2)[C@@H]1c1cccnc1	1813629903	KLQPQIRYYWTKRZ-GWJPWWOOSA-N	445.564	1.277	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)cc([N+](=O)[O-])c2)[nH]n1)[C@H](O)CCl	1814873004	QFYJHFOSGOUKDG-HUUCEWRRSA-N	437.840	1.929	50	20	IDGD	
CC(=O)N[C@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1)C(C)(C)C	1815057535	YCBAYMXKMNMNGX-OFQRWUPVSA-N	427.933	1.552	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3c(C)nc4ncccn34)sc2C1	1818395837	MGBDMGKMYYZTDL-NEPJUHHUSA-N	448.936	1.974	50	20	IDGD	
CC(C)=NO[C@@H](C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1	1820977505	ZSPISJJYWNKNQP-GOEBONIOSA-N	435.529	1.576	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](F)Br)CC2)c1ccnnc1O	1821102316	TWJCFGBAPOBFDP-QUBYGPBYSA-N	430.259	1.555	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)Cc2ccccc2O)[nH]n1	1822416991	UTEPJVIHUMXODH-KRWDZBQOSA-N	442.520	1.723	50	20	IDGD	
O=C(CCn1ccnn1)N[C@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1	1823013966	LPXVXXIRMNERON-UFBFGSQYSA-N	431.291	1.427	50	20	IDGD	
CC[C@H](O)C(=O)N1CCCC[C@H]1C1CCN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)CC1	1824080710	SWRABHCNXYXMCL-XPVJKVDVSA-N	431.537	1.511	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC([C@H]2CCCCN2C(=O)CN2CC(=O)NC2=O)CC1	1824972045	MNEIUQOPOKDEKK-MRXNPFEDSA-N	438.601	1.009	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)cnc1C	1825391212	PZXGTGDVRRTDOV-HSZRJFAPSA-N	449.360	1.925	50	20	IDGD	
CC[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CS(C)(=O)=O)CC2	1825445125	NZMXJFOBWVVMIZ-DTWKUNHWSA-N	438.369	1.273	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)Cn1ccccc1=O)CC2	1825640711	CJSPYNGJONBXLR-QWRGUYRKSA-N	439.335	1.700	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)Cc1cnn(C)c1)CC2	1825646873	FMTPICPOORFFNV-MWLCHTKSSA-N	426.340	1.815	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)C[C@@H](N)c1cccnc1)CC2	1825998668	HPCPLRLUFKLPDE-HZSPNIEDSA-N	437.953	1.794	50	20	IDGD	
Cc1ccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)nc1	1826071064	RXRGKEWMZNJCBC-QFIPXVFZSA-N	435.333	1.617	50	20	IDGD	
O=C1NCCn2nc(C(=O)N3CCCC[C@@H]3C3CCN(C(=O)[C@@H](F)Cl)CC3)cc21	1826197047	IRTGFANCGRWXLG-GDBMZVCRSA-N	425.892	1.394	50	20	IDGD	
CC[C@H](C)[C@H](N)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1	1826842868	LNWLXUYPQAJPKY-YSSFQJQWSA-N	444.580	1.292	50	20	IDGD	
O=C(c1ccc(O)cn1)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827054480	BHLUSOHBPWBXSX-NRFANRHFSA-N	437.305	1.014	50	20	IDGD	
Cc1oncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827055771	FDNNJAQGFXRJKQ-HXUWFJFHSA-N	425.294	1.210	50	20	IDGD	
Cc1ncccc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827056041	ONJPEOKHACDSKX-JOCHJYFZSA-N	435.333	1.617	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cn[nH]c2)CC1	1827800348	XHWNBIVIPDAAAD-UAHQCSBISA-N	439.520	1.777	50	20	IDGD	
Cc1ncc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)s1	1827965036	UJLDBPNBJSJYNP-LJQANCHMSA-N	441.362	1.678	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H]2CC2(F)F)CC1	1828924425	SEMVMHOTQFMDCX-DLBZAZTESA-N	435.475	1.574	50	20	IDGD	
CN1CCC(CC(=O)N2CCO[C@@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)CC1	1829995601	AWCROKSKNXYEEL-NRFANRHFSA-N	429.989	1.440	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1	1830307576	HDLDSZFBISISLC-QZTJIDSGSA-N	435.956	1.936	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccn4nccc4c3)C2)C1	1830362398	UZVTUPYHYGFFAX-NRFANRHFSA-N	434.924	1.669	50	20	IDGD	
O=C(C[C@@H]1COc2ccccc2O1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1831236130	WSRQAPGUDSGHEB-WNYOCNMUSA-N	442.871	1.207	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)Oc3cccnc3)C2)C1	1831657841	BREYDIBDIBRJGR-DJPFJPOOSA-N	439.940	1.713	50	20	IDGD	
CC(=O)N/C(C)=C/C(=O)N1CCC([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1	1831874232	DXZBVIRZUUGPOQ-CLHDZIPGSA-N	435.569	1.019	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)[C@H]1CCc2ccoc2C1	1833362386	MVRCTZYMNQWUQP-QFBILLFUSA-N	437.968	1.556	50	20	IDGD	
Cc1ncccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1	1834039664	JQFAVPFRKAIBNK-OALUTQOASA-N	430.332	1.696	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)c3cccs3)CC2)CC1	1834111059	RGOQZNKXNYDFRW-UHFFFAOYSA-N	435.594	1.306	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc4c(s3)CCC4)CCO2)C1	1834547567	BXDVQJGFRFGEEZ-QRWLVFNGSA-N	442.965	1.561	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCBr)CCO2)C1	1834823972	OZSZMBGJMTYQIS-HUUCEWRRSA-N	446.169	1.464	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3ccc4c(n3)OCCO4)CC2)CC1)[C@H](F)Cl	1835079741	PFKLIAWUHYGFTL-KRWDZBQOSA-N	440.903	1.572	50	20	IDGD	
CC(C)CNC(=O)C(=O)NC1CCN(C2CCN(C(=O)C(C)(C)CCl)CC2)CC1	1835127117	KOJWASFZVJYGDE-UHFFFAOYSA-N	429.005	1.595	50	20	IDGD	
CC(C)(C)c1cc(C(=O)NC2CCN(C3CCN(C(=O)[C@H](O)CCl)CC3)CC2)[nH]n1	1835933028	HIVZPSXAWVOCFJ-QGZVFWFLSA-N	439.988	1.492	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC1CCN(C2CCN(C(=O)c3cc(O)no3)CC2)CC1	1836399640	HMEKMPMUTRAHLU-SFHVURJKSA-N	433.336	1.802	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1CCC=CO1)CCO2	1837406187	HFXPIAUSCNEAIX-RVKKMQEKSA-N	431.327	1.167	50	20	IDGD	
NC(=O)c1ccccc1C(=O)N1CCC(OC2CCN(C(=O)[C@@H](F)Cl)CC2)CC1	1838084198	PCCGQGPYPZWSFA-QGZVFWFLSA-N	425.888	1.932	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)CCN3CCCC3)CC2)CC1	1838785488	BNJURBNDFVKITB-LJQANCHMSA-N	429.989	1.725	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3c(F)cccc3F)CCO2)C1	1838864287	XHKWGAVSNQWQKY-XIKOKIGWSA-N	447.276	1.818	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(F)c(C)c3N)C2)C1	1839144304	UQFRARYCLHXLKI-QRWLVFNGSA-N	427.904	1.804	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)C3=NO[C@@H](c4ccccc4)C3)C2)C1	1839144599	FWAYTMXDZQMAIQ-LRXVAGHRSA-N	449.935	1.978	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(OC)c3F)C2)C1	1839149942	WXMIGICHNKSJPJ-QRWLVFNGSA-N	428.888	1.922	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)/C=N/N3CCCCC3)C2)C1	1839153109	BEQLOXPRHSANKY-RCTBGBINSA-N	449.379	1.151	50	20	IDGD	
O=C(CCc1cccnc1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839198675	AHXVYFXHFPKXLS-FUHWJXTLSA-N	444.301	1.161	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3c(O)cc(O)cc3O)CCO2)C1	1839371771	OGPBOCXOYOJOOV-HXUWFJFHSA-N	442.896	1.138	50	20	IDGD	
CCOC(=O)c1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)cc1	1839445527	XQIOHFKAOSRUCB-JXFKEZNVSA-N	442.871	1.468	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccnc(C)n3)C2)C1	1839964014	CORLMJUJDLIHJJ-KDOFPFPSSA-N	441.326	1.029	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3oc(C)nc3C)C2)C1	1839965468	ZIVYRAODLQWLSY-RDTXWAMCSA-N	444.326	1.535	50	20	IDGD	
COc1ccccc1OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840187191	LTSYHCPZSNNDBH-LJQANCHMSA-N	447.315	1.334	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(F)c(OC)c3)CCO2)C1	1840682809	HHYKOLJMZCYNKS-YWZLYKJASA-N	428.888	1.922	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(CO)c(F)c3)CCO2)C1	1840780754	AIJZHTAOIFPTND-NRFANRHFSA-N	442.915	1.653	50	20	IDGD	
CN(CC(=O)N1CC2(CCCN2C(=O)CC(C)(C)C)C1)NC(=O)NCc1ccccc1	1842629438	WJYKWFRUGGQPHJ-UHFFFAOYSA-N	429.565	1.972	50	20	IDGD	
O=C([C@@H](F)Br)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1	1843442310	JOONEHWBZNXMDH-OAHLLOKOSA-N	437.269	1.673	50	20	IDGD	
CCOC(=O)N(CC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl)Cc1ccco1	1847562850	BWAFMIHVLXPZMU-JYJNAYRXSA-N	427.885	1.040	50	20	IDGD	
CN1C(=O)Cc2cc(S(=O)(=O)NNC(=O)c3ccc(Br)s3)ccc21	12969623	YJLFKYSZAZPTKH-UHFFFAOYSA-N	430.305	1.653	50	20	IDGD	
CS(=O)(=O)N1CCC(C(=O)NNC(=O)c2ccc(-c3ccc(F)cc3)s2)CC1	14332051	PZINBKIJDFLFFV-UHFFFAOYSA-N	425.507	1.987	50	20	IDGD	
CSCC[C@@H](NC(=O)c1ccco1)C(=O)NNC(=O)c1cc(-c2ccccc2)n[nH]1	17519530	XRLLHUULDCKFQY-CQSZACIVSA-N	427.486	1.982	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)CCNC(=O)OC(C)(C)C)c1	20901068	UEIKMPHFBDRRBQ-UHFFFAOYSA-N	442.538	1.393	50	20	IDGD	
C[C@H](NC(=O)c1ccccc1)C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	25257954	WEQWTXKIEOJQMR-HNNXBMFYSA-N	444.513	1.051	50	20	IDGD	
COCCN(C)CCNC(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1	727032786	HDIUTXFXXMASDX-JOCHJYFZSA-N	439.560	1.522	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)c2cc([N+](=O)[O-])cc(S(C)(=O)=O)c2)cc1F	727498171	AFDFPFHTNYZRKP-UHFFFAOYSA-N	442.450	1.777	50	20	IDGD	
Cc1ccc(C(=O)N2CCC(NC(=O)NNC(=O)COc3ccc(C#N)cc3)CC2)cc1	727606291	FSZNDHJXASPUJZ-UHFFFAOYSA-N	435.484	1.881	50	20	IDGD	
CN(C)N(C(=O)c1cccc(CN2C(=O)c3ccccc3C2=O)c1)[C@@H]1CCS(=O)(=O)C1	728179588	MKRYPMCDQBRESN-QGZVFWFLSA-N	441.509	1.589	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccccc1OC(F)F)C1CCN(c2ncccn2)CC1	728854357	SPBQLVVUAYYARA-UHFFFAOYSA-N	427.433	1.304	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)c1ccc(S(=O)(=O)NCCc2cccs2)cc1	728891908	KBGMVCMBIJYKJI-UHFFFAOYSA-N	444.538	1.668	50	20	IDGD	
C[C@H](CN1CCN(C)CC1)NC(=O)NNC(=O)[C@@H](C)Oc1cccc(Br)c1	730130847	NMWRXLVXTKTPNR-ZIAGYGMSSA-N	442.358	1.183	50	20	IDGD	
Cc1nc2c(C(N)=O)cnn2c(C)c1CCC(=O)NNC(=O)c1cccc2ncccc12	730228316	IYZAQFGLBVXOQM-UHFFFAOYSA-N	431.456	1.387	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)Nc1cccc(Cn2nc3ccccn3c2=O)c1	730897559	LMYBWBPMTPLNRR-UHFFFAOYSA-N	448.439	1.482	50	20	IDGD	
NC(=O)[C@H]1CCCN(Cc2cccc(CNC(=O)NNC(=O)CCc3ccccc3)c2)C1	731118840	XRDGITRGXRDICP-NRFANRHFSA-N	437.544	1.847	50	20	IDGD	
COc1ccc([C@]2(C)NC(=O)N(CC(=O)NNC(=O)C(C)(C)c3ccccc3)C2=O)cc1	731174618	KQZAZUUPMHLNEY-QHCPKHFHSA-N	438.484	1.587	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)N(C)CC(=O)N1c2ccccc2NC(=O)C[C@H]1C	731500028	XINXWIFJEUASPZ-CQSZACIVSA-N	439.472	1.745	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)nc2)cc1Br	732234992	NKLUGIJRGYYPMW-UHFFFAOYSA-N	443.279	1.723	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2cnc3c(cnn3Cc3ccccc3)c2)C[C@H](C)O1	732261474	CUECQWWYEVAUPQ-IRXDYDNUSA-N	436.516	1.740	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2ccc(CNC(=O)c3cccs3)cc2)C[C@H](C)O1	732264533	VBFDOSORWVANQW-HOTGVXAUSA-N	444.557	1.938	50	20	IDGD	
O=C(NCCCS(=O)(=O)Cc1ccccc1)NNC(=O)c1cnn(-c2ccccc2)c1	733340823	IPCSBTIAOWHNCN-UHFFFAOYSA-N	441.513	1.821	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)CC[C@H]2NC(=O)N(c3ccc(C#N)cc3)C2=O)c1	733775069	XDDQUZSPZXYNFI-LJQANCHMSA-N	449.467	1.607	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)c1cnn2c(-c3ccccc3)ccnc12	734241263	LFNWKAMAPQTWRM-UHFFFAOYSA-N	439.476	1.865	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)CN2C(=O)c3ccccc3C2=O)CC1	734825718	NCMKNJGWMZTGTH-UHFFFAOYSA-N	445.476	1.013	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)[C@@H](NC(=O)N1CCCC1)[C@@H](C)CC	736066847	VUQDDCUOXHPUJX-YWZLYKJASA-N	428.537	1.966	50	20	IDGD	
COC(=O)Nc1ccc(CCNC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc1	738493492	MVGXWJWJGJWMIY-UHFFFAOYSA-N	438.444	1.943	50	20	IDGD	
CCc1cc(NNC(=O)Cc2c(C)nc3[nH]n(C)c(=O)c3c2C)nc(-c2ccccn2)n1	738531232	GKOVVXGRQHOTPU-UHFFFAOYSA-N	432.488	1.979	50	20	IDGD	
CC(=NNC(=O)COCc1ccccc1)c1cccc(S(=O)(=O)N2CCOCC2)c1	739410848	CTMSGPSCZSUOKX-UHFFFAOYSA-N	431.514	1.765	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)c2ncoc2-c2ccc3c(c2)OCCO3)c1	741897160	AUIQAGTZZIUYER-UHFFFAOYSA-N	443.437	1.591	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)c2ccc(Cl)c(N3CCNC3=O)c2)nc2ccccc21	742474746	VALCTUSUDZJXJD-UHFFFAOYSA-N	426.864	1.760	50	20	IDGD	
COc1c(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)sc(C)c1Br	742480418	JZAPGGDLJAEATH-UHFFFAOYSA-N	437.279	1.878	50	20	IDGD	
O=C(NCCCN1C(=O)COc2ccccc21)NNC(=O)c1cc(Br)c[nH]1	743508697	QWVBFEODABKVHN-UHFFFAOYSA-N	436.266	1.537	50	20	IDGD	
CCCS(=O)(=O)N1CCC(NC(=O)NNC(=O)Nc2ccc(N(C)C)cc2)CC1	743535578	PQMGHOWIKKWBRS-UHFFFAOYSA-N	426.543	1.293	50	20	IDGD	
COc1cc(NC(=O)Cc2cccs2)c(C(=O)NNC(=O)C(=O)NC(C)C)cc1OC	744446591	FJSNKWLCOCGARV-UHFFFAOYSA-N	448.501	1.232	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCCN1C(=O)c1ccc(O)nn1)c1cccc(OC(F)F)c1	746214964	HENAHBHIWRYTOB-CQSZACIVSA-N	435.387	1.240	50	20	IDGD	
O=C(CN1CCOC[C@@H]1C[C@H](O)c1ccccc1)NNC(=O)c1cccc([N+](=O)[O-])c1	747655514	CEVVKIBQYIOTKG-OALUTQOASA-N	428.445	1.180	50	20	IDGD	
CN1CCC(N2CCC(NC(=O)NNC(=O)Cc3nc4ccccc4n3C)CC2)CC1	747987163	IIMWFXCHXATDAA-UHFFFAOYSA-N	427.553	1.005	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNS(=O)(=O)C1=Cc2ccc(OC(F)F)cc2CC1	751282533	NCQQVACGLJOINM-UHFFFAOYSA-N	441.412	1.549	50	20	IDGD	
O=C(NC[C@@H](O)CS(=O)(=O)c1cccs1)NNC(=O)c1cccc(OC(F)F)c1	752169141	QMIGPFOABMBIND-LLVKDONJSA-N	449.457	1.128	50	20	IDGD	
CCC1(CNC(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)CC1	753035507	YLASVKWJWTWRBH-UHFFFAOYSA-N	438.550	1.161	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)c3ccnnc3C)c2)cc1	753286483	DBXHFWQMUPNMMV-UHFFFAOYSA-N	441.469	1.669	50	20	IDGD	
CS(=O)(=O)N1CC[C@@H](CNC(=O)NNC(=O)c2cc3c(s2)CCCCCC3)C1	753661680	QTTMJCVETFZERM-ZDUSSCGKSA-N	428.580	1.633	50	20	IDGD	
Cc1oc(S(N)(=O)=O)cc1C(=O)NNC(=O)[C@H](C)Oc1cccc(Br)c1	754179011	DFSWBBJPHJLXPJ-VIFPVBQESA-N	446.279	1.226	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)N[C@@H]2[C@H]3CCO[C@@H]3C23CCC3)c2ccccc2c1=O	754677591	WHSKLUUKWYIWEI-NXHRZFHOSA-N	425.489	1.879	50	20	IDGD	
CCN1CCN(C(=O)c2ccc(NC(=O)NNC(=O)CCc3ccccc3O)cc2)CC1	756253484	SXJOXEZZVXQPJV-UHFFFAOYSA-N	439.516	1.955	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)Nc2ccc(N3CCN(C(=O)C4CC4)CC3)nc2)c1	756294081	FIQYLWMDBYWEMD-UHFFFAOYSA-N	433.472	1.478	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)Nc2cccc(S(=O)(=O)NC(C)(C)C)c2C)n1	756681143	GXVHHXPPRIYZDB-UHFFFAOYSA-N	436.538	1.738	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)Nc1ccc(NS(C)(=O)=O)cc1	756705433	JVVAKBIROWSXQW-UHFFFAOYSA-N	429.499	1.516	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1ccn(-c2ccc(Cl)cc2)n1	756972345	JKBZPZSZSQTRQD-UHFFFAOYSA-N	425.880	1.993	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)Nc2ccc(C(=O)NC3CCOCC3)cc2)c1	757621171	NGRSUPOFLCYEAL-UHFFFAOYSA-N	440.460	1.415	50	20	IDGD	
CC(C)n1nc(C(=O)NNS(=O)(=O)c2c(F)cc(C#N)cc2F)c2ccccc2c1=O	757646356	QOKOMDYGUHSGTQ-UHFFFAOYSA-N	447.423	1.751	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)Nc2ccc(F)cc2CS(C)(=O)=O)cc1	757676625	CAQUMPHQCACJDG-UHFFFAOYSA-N	425.438	1.611	50	20	IDGD	
O=C(c1cnc(Oc2ccccc2)cn1)N1CCN(S(=O)(=O)CBr)CC1	758527954	MWSXPAQVGXVYPN-UHFFFAOYSA-N	441.307	1.709	50	20	IDGD	
CN(NC(=O)c1ccc(N2CCNC2=O)cc1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758786284	LJRSXWLNBUUGAY-UHFFFAOYSA-N	446.508	1.466	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNS(=O)(=O)c2ccc([N+](=O)[O-])c(OC)c2)cc1	759164282	QISZUSRUNTZHIW-LBPRGKRZSA-N	439.446	1.779	50	20	IDGD	
CN(C)C1CCN(CCNC(=O)NNC(=O)COc2ccc(Br)cc2)CC1	759599449	XAIMYSQKNKRSDF-UHFFFAOYSA-N	442.358	1.184	50	20	IDGD	
Cc1c(CCC(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)cnn1C	759607227	YMDBTGCEFBPUDG-UHFFFAOYSA-N	432.956	1.280	50	20	IDGD	
COC[C@H](NC(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccc(Cl)cc1)C(N)=O	760043172	NBXBQHCNSZIGIG-DZXKJOIRSA-N	426.864	1.641	50	20	IDGD	
O=C(NCCOc1ccc(C(F)(F)F)cn1)NNC(=O)c1ccc(-n2cnnn2)cc1	760717940	UMYUQYPARGCPRX-UHFFFAOYSA-N	436.354	1.099	50	20	IDGD	
Cn1c(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)ccc1[N+](=O)[O-]	761396529	FPVIVNVRPFORJS-UHFFFAOYSA-N	435.462	1.183	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccncc3)nc3ccccc23)n(C)n1	763540789	WBYSWZOOJPKAGI-UHFFFAOYSA-N	429.440	1.738	50	20	IDGD	
Cc1ncc(-c2ccccc2)cc1NC(=O)C(=O)NNC(=O)[C@@H]1COc2ccccc2O1	763575003	OESRXDBIAPBPTB-FQEVSTJZSA-N	432.436	1.983	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)Nc1c2c(nn1-c1ccccc1)CCC2	763579550	XZXBMCQPMVXCOD-LJQANCHMSA-N	447.451	1.287	50	20	IDGD	
Cc1ccc(S(C)(=O)=O)cc1NC(=O)C(=O)NNC(=O)COc1ccc(Cl)cc1	763685966	GVXJZVWTXCKUJM-UHFFFAOYSA-N	439.877	1.217	50	20	IDGD	
CN1CCN(c2ccccc2NC(=O)C(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)CC1	763723509	SLBOLPCPUYIGKL-UHFFFAOYSA-N	439.560	1.741	50	20	IDGD	
COCC[S@](=O)Cc1cccc(NC(=O)C(=O)NNC(=O)c2cccc(N(C)C)c2)c1	763757358	HMLMBUJPYUSIHP-HKBQPEDESA-N	446.529	1.047	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2cccc(N(C)C)c2)ccc1N1CCCC1=O	763759859	FFEJUSOLEFDGBD-UHFFFAOYSA-N	439.472	1.288	50	20	IDGD	
CCN(CC)CCNC(=O)c1cc(NC(=O)C(=O)NNC(=O)C(C)C)ccc1Cl	763821654	VUSZHQFKWJTSGF-UHFFFAOYSA-N	425.917	1.154	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(OC)c(OC)cc2C(=O)N(C)C)cc1	763833771	GTCQPDXVIUOIHM-UHFFFAOYSA-N	442.472	1.368	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(OCCN(C)C)cc2)c1C	763849283	KQKGITXFWMJRTR-KRWDZBQOSA-N	442.516	1.797	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccn(Cc2ccccn2)n1	763867947	ZDCLRSQIMADODI-CYBMUJFWSA-N	426.408	1.019	50	20	IDGD	
C[C@@H]1Oc2ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc3ccc(F)cc3)cc2NC1=O	763873523	VEKGBBYUVRTLCV-WDEREUQCSA-N	430.392	1.099	50	20	IDGD	
COCCOc1ccc(F)cc1NC(=O)C(=O)NNC(=O)c1ccc2c(c1)OCCO2	764004957	VHEJDPDBJCJALH-UHFFFAOYSA-N	433.392	1.022	50	20	IDGD	
CCN1CCN(c2ccc(NC(=O)C(=O)NNC(=O)Cc3ccsc3)c(C)c2)CC1	764035316	RMTFGGLCCJJSOI-UHFFFAOYSA-N	429.546	1.527	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc(OCc2noc(C)n2)cc1	764040033	BRMWGNJZZWXPGT-UHFFFAOYSA-N	425.401	1.365	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc(I)cc1	764041105	QRLJWBAJAGSJOO-UHFFFAOYSA-N	439.209	1.700	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(C)cc2O)cc1N1CCCCC1=O	764110701	LQEMQZZJHSODAG-UHFFFAOYSA-N	440.456	1.626	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccccc3-n3ccnn3)n[nH]2)cc1	764112490	YXEZLUWREGUGQF-UHFFFAOYSA-N	430.428	1.366	50	20	IDGD	
Cc1ncsc1C(=O)NNC(=O)C(=O)Nc1ccc(-c2nnnn2C(C)C)c(F)c1	764248144	ZIXYJFCOVCMJKU-UHFFFAOYSA-N	432.441	1.225	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)C(=O)Nc1ccc(C(=O)NCc2ccccc2F)cc1	764269087	URFWRCLWWUSSDY-UHFFFAOYSA-N	449.442	1.479	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)CCc2ccccc2O)cc1C	764280981	IZJMFGJPGXFIPL-UHFFFAOYSA-N	448.501	1.181	50	20	IDGD	
COc1cc(C)ccc1Oc1ccc(F)cc1NC(=O)C(=O)NNC(=O)Cc1cc[nH]n1	764292862	IIKJOGBEDWXTIT-UHFFFAOYSA-N	441.419	1.987	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C(=O)Nc1ccc(CCS(C)(=O)=O)cc1)c1ccccc1	764332428	SZGFTDSADSFESU-SFHVURJKSA-N	431.514	1.553	50	20	IDGD	
C[C@@H]1CN(Cc2cccc(NC(=O)C(=O)NNC(=O)Cc3ccncc3)c2)C[C@@H](C)O1	764354451	RINVCYKWGHHHMA-HZPDHXFCSA-N	425.489	1.019	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2cnn(C)c2)ccc1NC(=O)OC(C)(C)C	764362172	AIBPCMLOMVGPNV-UHFFFAOYSA-N	432.437	1.175	50	20	IDGD	
CN(Cc1ccccc1NC(=O)C(=O)NNC(=O)c1cnn(C)c1)C(=O)OC(C)(C)C	764363936	WZJQYXBEDMXIFV-UHFFFAOYSA-N	430.465	1.187	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)N1C[C@@H]2CCCN2c2ccccc21	764392614	IIXQVPHTHLKIKF-HNNXBMFYSA-N	440.525	1.950	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCCCCC2)cc1C(=O)NNC(=O)c1cc(C)[nH]n1	765584139	ZIQQTLVIWXHSBC-UHFFFAOYSA-N	435.506	1.366	50	20	IDGD	
CNS(=O)(=O)c1ccc(C)c(C(=O)NNc2c(OC)cccc2S(C)(=O)=O)c1	768644706	GPCBSNBYSQRJDT-UHFFFAOYSA-N	427.504	1.072	50	20	IDGD	
CCc1ccc(C(=O)NNc2cc(C#N)cc(Cl)n2)cc1S(=O)(=O)N1CCOCC1	768707885	RERYTIMMCRRQBS-UHFFFAOYSA-N	449.920	1.947	50	20	IDGD	
O=C(C[C@H]1C=CS(=O)(=O)C1)NNC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1	769025673	XAMJRDJYLPDDKA-OAHLLOKOSA-N	437.481	1.644	50	20	IDGD	
CC(C)(C)c1nnc2ccc(C(=O)OCC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)cn12	769203024	BVZAWPCJTYBGFL-UHFFFAOYSA-N	440.416	1.553	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)NCCS(=O)(=O)c1ccccc1	770279050	SINXMXRXUWEBSU-ZDUSSCGKSA-N	425.894	1.912	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)NC[C@]1(N2CCOCC2)CCSC1	770298096	IKVGEBXGJAXEMN-IFXJQAMLSA-N	442.969	1.646	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)N1CCO[C@@H](C(=O)OC(C)(C)C)C1	770659432	SDIDCNZKUYIOGZ-IUODEOHRSA-N	427.885	1.891	50	20	IDGD	
CCN1CCN(c2cccc(NC(=O)C(=O)NNC(=O)c3ccc(Cl)nc3)c2)CC1	770771736	NWZGEMOSUBPXQM-UHFFFAOYSA-N	430.896	1.277	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)c1sccc1S(=O)(=O)N1CCCCC1	771914487	NCNVLMVTUFNEIZ-CYBMUJFWSA-N	445.563	1.662	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)c1cccc(S(=O)(=O)NC2CCCC2)c1	771985801	STDGPMXTTUFAMS-CQSZACIVSA-N	439.534	1.646	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)[C@@H](c1ccccc1F)N1CCOCC1	772898271	OYOVEBFIRYOLTG-GOSISDBHSA-N	448.882	1.316	50	20	IDGD	
CCOC(=O)N1CCC[C@H](C(=O)NNC(=O)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)C1	773413079	ZTDADIACLFSAAR-LSDHHAIUSA-N	426.514	1.649	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NNC(=O)c2cn(Cc3cccs3)nn2)C1	773421682	SPOFSNDRWIOFCC-CYBMUJFWSA-N	434.522	1.796	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(NS(C)(=O)=O)c(Cl)c2)cc1F	773890719	RUJRLUTTYWRHDD-UHFFFAOYSA-N	442.856	1.559	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1cccc2c1OCCC2=O	774010717	YURMNGMQRJVOMX-NSHDSACASA-N	431.832	1.859	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N(C)c2ccn(C)n2)cc1	774158962	XDIFVMSNDKOPAV-FOWTUZBSSA-N	433.472	1.738	50	20	IDGD	
CN(NC(=O)c1ccc(Cn2cccn2)o1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776205465	LVNOVRKXHBRSQR-UHFFFAOYSA-N	432.481	1.774	50	20	IDGD	
COc1ccc(Cl)cc1N1CC[C@H](NC(=O)NNC(=O)CNC(=O)OC(C)(C)C)C1	778646350	JFYCDRPEIIHSFL-ZDUSSCGKSA-N	441.916	1.782	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)CNC(=O)OC(C)(C)C)[C@H]1CN(Cc2ccccc2)CCO1	778673619	BKRRTCYFQAJGOM-NVXWUHKLSA-N	435.525	1.131	50	20	IDGD	
COc1ccc(Cn2ccc(NC(=O)C(=O)NNC(=O)[C@@H]3Cc4ccccc4O3)n2)cc1	778712802	ITLBNGDMCBBBPB-SFHVURJKSA-N	435.440	1.030	50	20	IDGD	
Nc1nc(Cl)cc(NNC(=O)[C@@H]2CC(=O)N(c3cccc(Br)c3)C2)n1	779374796	GDSTVIONZOKUTI-MRVPVSSYSA-N	425.674	1.971	50	20	IDGD	
COC(=O)CC(C)(C)CC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	780477017	SOOMALNFVAWKQO-UHFFFAOYSA-N	426.539	1.045	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1)c1ncn(C)n1	780703873	UUEGTBWZLXWOQD-JXFKEZNVSA-N	433.516	1.834	50	20	IDGD	
COC[C@@H](CNC(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1)OC	781395003	RUYWNKLXDVATMW-NHCUHLMSSA-N	426.517	1.605	50	20	IDGD	
Cc1cc(NNC(=O)CCc2c(C)nn(-c3ccc(S(N)(=O)=O)cc3)c2C)ncn1	781931829	HMIMCVZXVCVARE-UHFFFAOYSA-N	429.506	1.311	50	20	IDGD	
Cc1cnc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(Br)c2)s1	782120198	GTYNILCSOGIRSA-VIFPVBQESA-N	427.280	1.767	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)[C@H]3CC=CC[C@@H]3C(=O)N3CCOCC3)n[nH]2)cc1	784345478	BGZMENPMIYMEON-ROUUACIJSA-N	437.500	1.587	50	20	IDGD	
CN(C)C(=O)c1cc(NC(=O)C(=O)NNc2ccc(OCC(F)(F)F)cc2)ccn1	784368256	GYOCPVGDSGKKLS-UHFFFAOYSA-N	425.367	1.806	50	20	IDGD	
CNS(=O)(=O)CCNC(=O)NNC(=O)CCCOc1ccc(Cl)cc1Cl	784664261	NABBWQNBLKFSEK-UHFFFAOYSA-N	427.310	1.032	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)C(=O)Nc2ccc(C(=O)N3CCOCC3)cc2C)c1	784851540	KIGYOEKYXIHJFK-UHFFFAOYSA-N	440.456	1.336	50	20	IDGD	
COC(=O)c1cc(OC)c(OC)cc1NC(=O)C(=O)NNc1cccc(C(F)(F)F)n1	784951134	DDCXQSROHWCHTI-UHFFFAOYSA-N	442.350	1.986	50	20	IDGD	
Cn1ccnc(NNC(=O)C(=O)Nc2cccc(COCCOc3ccccc3)c2)c1=O	785089586	CJGFVGWTKUCGBC-UHFFFAOYSA-N	437.456	1.458	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@H]2CCN(C(=O)OC(C)(C)C)[C@@H]2C)c2ccccc2c1=O	786252568	IXMYZIYCGOYASS-KGLIPLIRSA-N	443.504	1.823	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)c2cc(N3CCNC(=O)C3)ccn2)cc1OC	786691420	AARFORLZZQKNNU-UHFFFAOYSA-N	441.488	1.280	50	20	IDGD	
COc1cccc(C[C@H](C(=O)NNC(=O)NCc2ccc(Cl)cc2)n2nnnc2C)c1	787436135	NDTOFQKPMNFKPQ-GOSISDBHSA-N	443.895	1.958	50	20	IDGD	
CN(C)CCOCCNC(=O)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1	788014443	RBYLVJADGCQJTC-QFIPXVFZSA-N	439.560	1.522	50	20	IDGD	
CCOC(=O)C1(CC(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)CCC1	789184478	SMAGRCAOIQXWBO-UHFFFAOYSA-N	426.514	1.840	50	20	IDGD	
Cc1c(C(=O)NNC(=O)Cn2cnc3ccccc32)nnn1Cc1ccc(F)cc1F	790114037	QSNZKAFFBBXOJL-UHFFFAOYSA-N	425.399	1.724	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)c2nnn(Cc3ccc(F)cc3F)c2C)nc1C	790858121	ZIAMYQKWWBIZOI-UHFFFAOYSA-N	431.403	1.945	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)ccc1C(F)(F)F	790960681	RRSRMSVXXHJTIN-UHFFFAOYSA-N	449.389	1.929	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc(OC(F)(F)F)cc1)NNc1nc2ccccn2n1	791239153	DUKBJSYXXKGTFP-UHFFFAOYSA-N	444.395	1.440	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1cc(Br)c(N)c(Br)c1	791482508	LRHHBCKEFCYOIG-ZCFIWIBFSA-N	437.088	1.897	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@@](C)(O)Cn2cc(C(F)(F)F)ccc2=O)cc1OC	792013448	WXZUTFIZGIDMEU-SFHVURJKSA-N	443.378	1.097	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NC[C@@H](C)NC(=O)OC(C)(C)C)c2ccccc2c1=O	792250294	JMXUIRNPFQDXBC-GFCCVEGCSA-N	432.481	1.274	50	20	IDGD	
COc1c(NC(=O)C(=O)NNC(=O)c2ccccc2C)cc(Cl)cc1C(=O)N(C)C	793021794	JWYLRAUJYBCHGU-UHFFFAOYSA-N	432.864	1.759	50	20	IDGD	
COc1c(NC(=O)C(=O)NNC(=O)c2cc(C)oc2C)cc(Cl)cc1C(=O)N(C)C	793023339	NTTISQOVFCSRTN-UHFFFAOYSA-N	436.852	1.660	50	20	IDGD	
CSCCNC(=S)NNC(=O)c1cccc(NN2C(=O)[C@H]3CC=CC[C@@H]3C2=O)c1	793764045	FWDWYDYZSMEOFV-GJZGRUSLSA-N	433.559	1.437	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@H](O)c2cccc(C(F)(F)F)c2)c2ccccc2c1=O	794774082	CFNXRHYBQDMYBF-MRXNPFEDSA-N	434.374	1.930	50	20	IDGD	
O=C(NNC(=O)C1(c2cc(F)cc(Br)c2)CC1)N[C@@H]1CCS(=O)(=O)C1	795527559	ONKHAKFCIVFLKD-GFCCVEGCSA-N	434.287	1.137	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCN(c3ccc(C)cc3)C(=O)C2)cc1OC	796086798	METJDNDXHNIFJW-UHFFFAOYSA-N	426.473	1.122	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)Nc2ccc(S(=O)(=O)NCC(F)(F)F)cc2)n1	797628160	UJTDECKGJZJWLL-UHFFFAOYSA-N	431.396	1.697	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)Cc2ccc(S(=O)(=O)N(C)C)cc2)cc1F	798125049	IYKZTZFWXZEDGE-UHFFFAOYSA-N	440.522	1.645	50	20	IDGD	
CCCS(=O)(=O)Nc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)c1	798307697	BYZOYCWPPHHBTL-UHFFFAOYSA-N	432.502	1.855	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CO[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1	801111146	MFDTWAZYARYOLT-MRXNPFEDSA-N	434.493	1.497	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)Nc2ccc(S(=O)(=O)[C@@H](C)C#N)cc2)c1	806459481	VNSMVEOMFGYRKB-LBPRGKRZSA-N	432.458	1.856	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1cnn(C)c1-c1ccccc1	806974643	DYSXQRNSBMEMAD-CYBMUJFWSA-N	425.420	1.780	50	20	IDGD	
O=C(CCCc1ccccc1)NNC(=O)C(=O)Nc1cc(Cl)cc2c1OCC(=O)N2	806978301	VRAWEDKHPXXTEL-UHFFFAOYSA-N	430.848	1.780	50	20	IDGD	
COCCNC(=O)c1ccc(NC(=O)C(=O)NNc2nccnc2C2CCC2)cc1Cl	807461919	AZFKCTFRGMBZSN-UHFFFAOYSA-N	446.895	1.856	50	20	IDGD	
C[C@@H]1CSC[C@H]1NC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	807475609	IBEJPHFXSXAXCA-RDTXWAMCSA-N	448.570	1.861	50	20	IDGD	
CCc1nnc(NC(=O)[C@H](C)[C@@H](C)NC(=O)NNC(=O)COc2ccc(C)cc2)s1	807565562	NHQSZMFYPHJXFN-CHWSQXEVSA-N	434.522	1.781	50	20	IDGD	
CC(C)Nc1ccc(S(=O)(=O)NCC(=O)NNC(=O)CC(C)(C)C)cc1[N+](=O)[O-]	810342847	DPFRYICEFTXIMM-UHFFFAOYSA-N	429.499	1.277	50	20	IDGD	
O=C(Cc1ccsc1)NNC(=O)C(=O)Nc1ccc(Br)c([N+](=O)[O-])c1	810384125	DEMLZPCHGNZXJD-UHFFFAOYSA-N	427.236	1.747	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)CNS(=O)(=O)c1ccccc1C(F)(F)F	810565715	UWENBKDIJIOOGP-UHFFFAOYSA-N	429.420	1.682	50	20	IDGD	
O=C(COC(=O)c1ccc2c(c1)CCCCC2=O)NNC(=O)[C@H]1COc2ccccc2O1	811421480	LRQIFVNTELEGNR-HXUWFJFHSA-N	438.436	1.740	50	20	IDGD	
Cc1cc(=O)oc2cc(OCC(=O)NNc3ccc(S(=O)(=O)N(C)C)cc3)ccc12	812729998	YIYFRGUDWAUYKN-UHFFFAOYSA-N	431.470	1.874	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccc3c(c2)NC(=O)CS3)cc1	813033485	VTUPWLINESGJRA-UHFFFAOYSA-N	449.514	1.063	50	20	IDGD	
CN(C)C(=O)COc1ccc(NC(=O)NNc2ccccc2S(=O)(=O)N(C)C)cc1	814554160	ZKAOJODYJSMDES-UHFFFAOYSA-N	435.506	1.553	50	20	IDGD	
Cn1c2c(ccc1=O)C(=NNC(=O)CN1c3cccc4cccc(c34)S1(=O)=O)CCC2	814765525	IZSVMFOGKAAFEU-UHFFFAOYSA-N	436.493	1.904	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2cc(F)cc(F)c2F)n[nH]1	815570068	PTTDPKWSRVYABO-UHFFFAOYSA-N	433.346	1.902	50	20	IDGD	
CNC(=O)c1cc(Oc2cccc(NC(=O)C(=O)NNc3ncncc3Cl)c2)ccn1	815579087	DVJZBXLTWBLQJZ-UHFFFAOYSA-N	441.835	1.759	50	20	IDGD	
COc1cc2nc(C(=O)NNC(=O)c3cc(-c4ccccc4)[nH]n3)c(=O)n(C)c2cc1OC	816829849	HFYDNFALWXEGRW-UHFFFAOYSA-N	448.439	1.416	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NCC(=O)NNc2ccccc2[N+](=O)[O-])c1	849507275	BUEAFYIAPUPFET-UHFFFAOYSA-N	449.489	1.498	50	20	IDGD	
CC(C)(C)C(=O)NCCC(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	871211834	BWJAXKWCRGZZOU-UHFFFAOYSA-N	449.511	1.758	50	20	IDGD	
CNS(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)c2cc3c(s2)CC[C@@H](C)C3)cc1	906443641	MBGBBVBACPQJRD-LLVKDONJSA-N	443.572	1.404	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)CCC(=O)N1CCOCC1	912886319	ANHSISMDDRLVRW-LBPRGKRZSA-N	428.283	1.003	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)[C@@H]2CC(=O)N(c3ccccc3Br)C2)n1	913898077	PSOKGHSMLMWDMV-CYBMUJFWSA-N	434.294	1.463	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C2CCN(C(=O)COc3ccccc3)CC2)nc2ccccc21	914846707	WCOVAWVJRUVKRL-UHFFFAOYSA-N	449.511	1.581	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)N[C@@H](CN1CCOCC1)c1ccccc1	916216445	JPXSMLZZPLTKML-KRWDZBQOSA-N	443.460	1.378	50	20	IDGD	
CCn1cnc2c1c(=O)n(CC(=O)NN=Cc1cccc(O)c1)c(=O)n2Cc1ccccc1	916331084	DZNVMEIZVJYIOU-UHFFFAOYSA-N	446.467	1.284	50	20	IDGD	
CC1CCN([C@@H](CNC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)C(C)C)CC1	916439073	NTNCMUWQSZNJDK-SFHVURJKSA-N	428.537	1.634	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)c1ccccc1)C(=O)NNC(=O)c1ccc(Cl)nc1	917248962	IJMYDDQFUKJRBC-CQSZACIVSA-N	442.950	1.596	50	20	IDGD	
O=C(NCc1cccc(N2CCOC2=O)c1)NNC(=O)c1csc(N2CCOCC2)n1	918776363	PRDAQHIYKICPNQ-UHFFFAOYSA-N	446.489	1.081	50	20	IDGD	
O=C(CCNC(=O)c1ccc(F)cc1)NNC(=O)COc1ccc(Br)cc1	919679920	RAFWHHYEMXHJBH-UHFFFAOYSA-N	438.253	1.935	50	20	IDGD	
COc1ccccc1NC(=O)COc1ccc(C(=O)NNC(=O)NC2CC2)cc1OC	920822853	ASOOAJYXJQEBRV-UHFFFAOYSA-N	428.445	1.828	50	20	IDGD	
CC(C)n1nc(C(=O)NNS(=O)(=O)c2ccc(CC#N)cc2)c2ccccc2c1=O	1116189390	MGPJNVCGBHAURN-UHFFFAOYSA-N	425.470	1.667	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCc2ccccc2N2CCN(C(C)=O)CC2)cc1	1318310276	DBHJERGVNYUEMP-UHFFFAOYSA-N	425.489	1.508	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2cccc(CN3CCCC3=O)c2)c1	1318350535	GDXFZHBYKFLQKS-UHFFFAOYSA-N	444.513	1.357	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)[C@H]2CC(=O)N(c3ccc(F)cc3)C2)CC1	1318655726	ASDLZVCWEQVLKH-HNNXBMFYSA-N	448.495	1.973	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)N[C@H]1C=CCCC1	1322503316	VFSKEVIOTLHMMB-KRWDZBQOSA-N	436.534	1.079	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)NCCn2c(=O)oc3ccccc32)CC1	1328685657	AAHVMZJUKOZUNP-UHFFFAOYSA-N	447.492	1.572	50	20	IDGD	
CCOC(=O)c1ccc(C)c(S(=O)(=O)NNC(=O)c2cncn2-c2ccccc2)c1	1338873041	RKECJUXBCJXVGM-UHFFFAOYSA-N	428.470	1.981	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H]1CC(c3ccccc3)=NN1)C2)[C@@H](F)Cl	1778027928	CZMCNRHNCFTRCL-NEYJZJCJSA-N	436.915	1.801	50	20	IDGD	
Cc1nc[nH]c1CSCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1778914434	RWKBVOROKJJIEA-ZBFHGGJFSA-N	449.346	1.472	50	20	IDGD	
Cc1nnc(CCC(=O)N2CCO[C@@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)s1	1779293849	FGBNQACILJYJRD-GOSISDBHSA-N	426.615	1.461	50	20	IDGD	
C[C@H](Nc1ccccn1)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1779328186	DAZSVIMPNYZIMN-JDFRZJQESA-N	429.290	1.402	50	20	IDGD	
Cc1ncncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)CBr)C2	1779794851	WCJZKFZRHCPKSV-VVFCZOMOSA-N	439.354	1.944	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(C)cc3-n3nccn3)C2)C1	1780245565	RILSFOSBEJLCAY-UWJYYQICSA-N	447.923	1.273	50	20	IDGD	
CCOc1ccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)nn1	1780429305	GTQOZDYSIGSAIN-SJKOYZFVSA-N	427.299	1.102	50	20	IDGD	
CCOc1cnc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)cn1	1781227898	FVHKRLFVRUDWTR-ZWKOTPCHSA-N	431.320	1.555	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(O)c([N+](=O)[O-])c3)C2)C1	1781539978	FRAGCOWOWQPNHM-QZTJIDSGSA-N	446.287	1.980	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CSCC(=O)O)C1	1782223494	PRUVGJKQFFPKER-RDTXWAMCSA-N	432.615	1.170	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)c3cccc4nscc34)C2)C1	1782419938	NEYXSLSOQUNNRH-OAQYLSRUSA-N	445.545	1.113	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc(C(N)=O)cc2)C1	1782866148	PJNZYCNMOMJREA-CSODHUTKSA-N	437.924	1.167	50	20	IDGD	
COCC(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](Br)Cc3ccccc3)C2)C1	1783024000	SKOZINZGULLQQK-LPHOPBHVSA-N	425.323	1.469	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)CCc3nnc(C)s3)CCO2)C1	1783344121	NGLQFDBXNGWMIW-DYVFJYSZSA-N	445.383	1.783	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cccn(C(F)F)c3=O)CCO2)C1	1783539154	XXWGGALVCOWYEY-APPDUMDISA-N	448.264	1.470	50	20	IDGD	
CCn1nc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](Cl)COC)C3)C2)c2ccccc21	1783874810	HKPKGDQOBLILJE-IIBYNOLFSA-N	434.924	1.754	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cc(F)c(N(C)C)c(F)c3)CCO2)C1	1783882975	RYOVZFDGMSQNDY-VBKZILBWSA-N	445.894	1.728	50	20	IDGD	
C[C@H](C(=O)N1CCO[C@]2(CCN(C(=O)C(Cl)Cl)C2)C1)N1CSCSC1	1783945660	AVBCZRPRONBMQP-ABAIWWIYSA-N	428.407	1.663	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(C(=O)N2CCO[C@@]3(CCN(C(=O)C(Cl)Cl)C3)C2)C1	1783948003	QWAODINOEWNRAG-GOSISDBHSA-N	436.336	1.487	50	20	IDGD	
CC#CC[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]2C1)c1ccccc1	1784091492	VXTKQAXIXBAZFZ-FCMAGTKHSA-N	432.948	1.763	50	20	IDGD	
C[Si](C)(C)C#CCCCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]2C1	1784092547	MROVGCWSDJFOOK-FJIDUMEYSA-N	429.033	1.617	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)C(=O)c3cccn3C)C2)C1	1784610838	IVFCAUYSHGXKQP-ACJLOTCBSA-N	426.311	1.211	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3CCN(C(C)C)CC3)[C@H]2C1	1784996558	MBDAUVMIVXONNV-VJANTYMQSA-N	429.989	1.340	50	20	IDGD	
Cc1nccn1[C@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCBr)[C@H]2C1	1786407675	HHMUQQNPYAMWBS-OEAJRASXSA-N	427.343	1.517	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(-n4cnnc4)cc3)[C@H]2C1	1786769159	CKMDKNGJVFSUGQ-KANFNMMFSA-N	431.924	1.878	50	20	IDGD	
CC(C)(C)OC(=O)N(CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]2C1)C1CC1	1787444600	AQDJDUVFPVTYQX-QEWYBTABSA-N	447.935	1.900	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(C)(C)n3nc(C)ccc3=O)[C@H]2C1	1788731565	PUNBEHQEXHOMOB-QAETUUGQSA-N	438.956	1.284	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)C[C@@H]21	1789865980	KCIMQQKFRHROJI-CNNMYCQVSA-N	432.304	1.322	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4cccnn4n3)C[C@@H]21)[C@H](F)Br	1789924417	CHJCAPWJKGUTEN-LVGORTOPSA-N	440.273	1.013	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CCc4nc[nH]c4C3)C[C@@H]21)[C@H](F)Br	1789926933	LRKJZYUSXZJXQJ-BFPXCNAZSA-N	443.317	1.185	50	20	IDGD	
CC[C@H](Cl)C(=O)Nc1ccc(C2(NC(=O)CN3CCS(=O)(=O)CC3)CCC2)cc1	1790487572	CZKSSACEXFQNHA-KRWDZBQOSA-N	441.981	1.868	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4cncn4c3)C[C@@H]21	1791056371	VYBZTBNJFRADQO-QCPWZWHMSA-N	435.322	1.711	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CC[C@@H]3CCOC3)[C@H]2C1	1791812588	ZVKJEKBWHRDKGI-QEOTZNIISA-N	431.371	1.814	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nnsc1C1CC1)C2	1792868105	PUHNJRNYIWAHTJ-FOUMNBMASA-N	443.367	1.650	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3n(n1)CCCC3)C2	1792870715	IYLXPMSMUSNXPK-ZJOBFFGXSA-N	439.354	1.454	50	20	IDGD	
CC(C)c1nc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)co1	1798440670	IBINWPLKQLSEKH-BTTYYORXSA-N	426.477	1.362	50	20	IDGD	
CCc1noc(C)c1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2	1798859626	ICNMBLNLVRXSAS-XMOXNHLCSA-N	440.504	1.931	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnn2c1OCCC2	1799937634	LJRJAMNRRKWGMD-AYRXBEOTSA-N	441.326	1.042	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)NC(=O)OC(C)(C)C)C2	1800762501	CMNLZTMAYYJMHW-VJTDZRGJSA-N	448.358	1.273	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(S(C)(=O)=O)ccc1F	1800848996	PUIARWFMTWITDM-ZWUHOBOKSA-N	446.928	1.735	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Br)C3)C1	1800967208	BVKKVTZPAYMMRZ-PLJUSGQGSA-N	449.317	1.246	50	20	IDGD	
C/C=C(/C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN(C)NC(=O)NCc1ccccc1)C2	1801617756	DNAVGBKUGRBIJY-PMIWBGAVSA-N	427.549	1.937	50	20	IDGD	
Cc1ccc2c(/C=C/C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@H](O)CCl)C4)c[nH]c2c1	1802182458	BQXCXODTGKTWBZ-IBZOKRPOSA-N	431.920	1.679	50	20	IDGD	
CCc1[nH]nc(C(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)c1Cl	1803139354	XMENLVGWMYGGAY-HACGYAERSA-N	440.331	1.940	50	20	IDGD	
Cc1ccc(C(=O)C(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)cc1	1803146312	NGJNFRYDOXXCBH-CEXWTWQISA-N	429.904	1.878	50	20	IDGD	
CCC(=O)N[C@H](C)C(=O)NC[C@H]1CCN(C(=O)CO[Si](C)(C)C)[C@@H]1c1cccnc1	1803435983	TYNSIYFDGCFSAE-WRWLIDTKSA-N	434.613	1.854	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)[C@H](C)CS(C)(=O)=O)[C@H]1c1cccnc1	1803587591	HZYORIMNCAFXEJ-MXASKKJJSA-N	445.969	1.022	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@@H](CNC(=O)CN)[C@@H]1c1cccnc1	1807041680	IRCZVOIMPLYTJA-DFOJPQRFSA-N	425.439	1.931	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](F)Cl)[C@H]1c1cccnc1)c1cccn2c(O)nnc12	1808189661	WSJRGAVTCIAHIW-AEGPPILISA-N	432.843	1.684	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC2(CCCN(C(=O)CN3CCNC3=N)C2)CC1	1809739874	YIBDXQJLHKPXGN-AWEZNQCLSA-N	428.375	1.089	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)c3cc(F)ccc3F)CC2)C1	1809977588	HXCIKSMQESQGNK-UHFFFAOYSA-N	442.271	1.803	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)Cc2cccc(OC)n2)[C@@H]1c1cccnc1	1813028483	QVIXLIQFMKSAFC-DJPFJPOOSA-N	446.935	1.988	50	20	IDGD	
Cc1[nH]ccc1C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1813071638	VIWGEHXNZUYYPW-DYESRHJHSA-N	426.521	1.411	50	20	IDGD	
C=CCNC(=O)/C=C\C(=O)N1CC[C@@H](CNC(=O)C(Cl)Cl)[C@@H]1c1cccnc1	1813074249	PORGJCLZJHAGLU-DEUPEYTOSA-N	425.316	1.750	50	20	IDGD	
CN(CC(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)CCl)CC2)C(=O)OC(C)(C)C	1814231316	DLUPFGGKJSWKAR-PWSUYJOCSA-N	446.957	1.522	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H]2CNC(=O)O2)n[nH]1	1815276064	XNTIMKMRCXQVAY-DLOVCJGASA-N	428.287	1.541	50	20	IDGD	
Cc1nscc1C(=O)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1	1815355143	OSCRKOFQJZZOFX-ZDUSSCGKSA-N	442.331	1.127	50	20	IDGD	
Cn1ccc(CC(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@@H](F)Br)CC3)n1	1815550095	SSHOPISKHVLOJA-AMIZOPFISA-N	430.303	1.722	50	20	IDGD	
CS(=O)(=O)CC(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](F)Br)[nH]n1	1817057429	VUCUHJLJYRPREJ-BXKDBHETSA-N	425.280	1.137	50	20	IDGD	
Cc1cc(NC(=O)CC(=O)N[C@@H]2CCc3nc(NC(=O)[C@H](F)Cl)sc3C2)no1	1817121461	KARGSKJIJZZCEQ-CLAHSXSESA-N	429.861	1.915	50	20	IDGD	
N[C@@H](Cc1cccnc1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)C(Cl)Cl)CC2	1817192401	IXAAVWIPGJBDNL-MNOVXSKESA-N	428.345	1.824	50	20	IDGD	
Cc1cncc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)c1	1817473073	CEIVKVWEOVPEFR-LJQANCHMSA-N	433.277	1.413	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)C2CC(F)(F)C2)[nH]n1)c1cccc(B(O)O)c1	1817475826	VTBQIFGRMHBQNE-MRXNPFEDSA-N	432.236	1.441	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1	1817479359	LLHWFCJJZLMXLI-IAQYHMDHSA-N	449.114	1.179	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@H](O)CCl)CC2)c1ccc2c(c1)OCCO2	1817977859	MJDWCFDIVCYOEV-DGCLKSJQSA-N	437.905	1.740	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3nc4ncccn4n3)sc2C1	1818310385	NDOAZNOONUGNFV-VHSXEESVSA-N	435.897	1.060	50	20	IDGD	
Cc1ncc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cnccc3C(=O)NN)n[nH]2)cn1	1819402162	QWVGYMPWZRODOD-QGZVFWFLSA-N	449.475	1.126	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H]2CCC(=O)N2C)n[nH]1	1820956764	KZEUUNXVTFTVIH-RTXFEEFZSA-N	426.315	1.806	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1	1822353222	KWDJSEUWLDURKW-XRGAULLZSA-N	438.912	1.757	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(CO)o2)[nH]n1	1822414995	QORMZPDOKRUYQK-HNNXBMFYSA-N	432.481	1.174	50	20	IDGD	
Cc1cc(CC(=O)N2CCCC[C@@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)nn1C	1824301367	HPRKWWWXXKEGGF-HXUWFJFHSA-N	446.596	1.264	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cn(C)nc2OC)CC1	1825734506	JHBQMVSEIJLOGD-DLBZAZTESA-N	426.945	1.916	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1nc[nH]c1[N+](=O)[O-])CC2	1825999476	XAHVQFNLQCDGAT-HTQZYQBOSA-N	428.858	1.254	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](C)n1ccccc1=O)CC2	1826000594	YBYYTDPPPIWHHX-UPJWGTAASA-N	438.937	1.732	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](F)Br)CC2	1826005948	BRBKZBKORCOFPC-FWWHASMVSA-N	428.711	1.999	50	20	IDGD	
Cc1oncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1	1826027053	IXOFSDPOUDDBMR-HXUWFJFHSA-N	425.294	1.210	50	20	IDGD	
Cc1cc(C)nc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)c1	1827317179	LGKRCDLLUAFNTP-QHCPKHFHSA-N	449.360	1.925	50	20	IDGD	
CC(=O)C[C@@H](C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1	1828925275	IFUBXIVDHHMTKT-QRWLVFNGSA-N	443.548	1.534	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccn4nccc34)C2)C1	1830366827	WKRDCZVRUPDHSF-NRFANRHFSA-N	434.924	1.669	50	20	IDGD	
Cc1occc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)CBr)CCO2	1830537775	OEGCCRGOMFKLMK-ACJLOTCBSA-N	429.311	1.689	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)Nc3cccnc3)C2)C1	1831645713	FKILWHJSUATZRS-MMOPVJDHSA-N	438.956	1.746	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnoc3COC)C2)C1	1831647073	OXIWENPILZUNMU-KXBFYZLASA-N	429.901	1.299	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cnc(C)s3)C2)C1	1831656726	IQJUIOFYAKWOOL-APWZRJJASA-N	429.970	1.858	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2nc(C)c(C)[nH]c2=O)CC1	1831828396	RMCIBODJAOKUHD-IRXDYDNUSA-N	438.956	1.874	50	20	IDGD	
O=C([C@H](F)Cl)N1CCOC[C@]2(C1)CN(C(=O)C1(c3cccc(F)c3)CC1)CCO2	1832364539	FPPYTJQJUFLWQR-LPHOPBHVSA-N	428.863	1.848	50	20	IDGD	
O=C(/C=C/c1ccoc1)N1CCO[C@@]2(COCCN(C(=O)CCBr)C2)C1	1832646031	XZDRAIDRWCRHCN-ZMXQLYDGSA-N	427.295	1.534	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)/C=C/c3cccnc3)CCO2)C1	1833103089	NWVMKYKLMDQUQZ-WEPWYQGCSA-N	442.343	1.788	50	20	IDGD	
CC(C)c1nc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)co1	1833348219	MFTIDBBMEXEVKN-SCLBCKFNSA-N	444.326	1.651	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)NC(=O)NCC)CC2)CC1	1833534034	YGOOCAOGXPHVFK-CRAIPNDOSA-N	444.020	1.673	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(O)cn3)CCO2)C1	1834588034	FAFLFYNGORSDEL-MSOLQXFVSA-N	432.304	1.094	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3noc4ccccc34)CCO2)C1	1835982880	YCNLLSRBAFLEIQ-KKSFZXQISA-N	435.908	1.844	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3ccnnc3O)CC2)CC1	1836063533	CNBWUKBLYWOTAG-GFCCVEGCSA-N	440.342	1.151	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccccn3)CCO2)C1	1836191835	YASPQRSWTQLPRI-OALUTQOASA-N	430.332	1.317	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)c3cncs3)CC2)CC1	1837556283	OERQJPBNKLXMLN-UHFFFAOYSA-N	437.566	1.128	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccccc3O)C2)C1	1837715846	MTRGQQFIHOELJH-OAQYLSRUSA-N	436.581	1.243	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)[C@@H]3CCCS3)CC2)CC1	1838788884	CGMLCHIXZFOURE-SFHVURJKSA-N	440.610	1.254	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1839021437	JTMIEFZNRWHCEL-MAUKXSAKSA-N	435.279	1.953	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(Cl)cnc3O)C2)C1	1839141894	WOKLVWMVVNATPJ-KSSFIOAISA-N	432.304	1.528	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnn4ccc(C)cc34)C2)C1	1839144135	RCYQLQFWNQKYTF-UWJYYQICSA-N	434.924	1.730	50	20	IDGD	
COc1c(C)cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)cc1C	1839392222	BCGCMKISOLJYKL-XLIONFOSSA-N	428.888	1.916	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cc3ncccc3[nH]1)CCO2	1839492355	HSSIUCUSPPHCAN-NRFANRHFSA-N	446.580	1.484	50	20	IDGD	
C=CCC(CC=C)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2	1840030489	NYIOGMWKIMZOQG-BEFAXECRSA-N	429.355	1.995	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)c3ccccc3)C2)C1	1840150275	HXPBZIUBJIOOIP-ZWOKBUDYSA-N	428.888	1.407	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCCCn3cccc3)C2)C1	1840153391	MTEKOGHHRZUZJD-RXVVDRJESA-N	441.956	1.369	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)c3ccc(O)cc3)C2)C1	1840154733	FCEKPCSWKRRAJL-XERREHJYSA-N	440.924	1.206	50	20	IDGD	
O=C(Cc1ccc(F)c(F)c1)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840188206	WINCWFGMHSMCMH-SFHVURJKSA-N	437.270	1.767	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](C(=O)N2CCCC23CN(C(=O)[C@@H](F)Cl)C3)[C@H](O)C1	1841026105	VRLPXBPFLSAGKA-BFHYXJOUSA-N	433.908	1.342	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC2(CCCN2C(=O)[C@@H](C)[C@@H]2SC(=N)NC2=O)C1	1843409388	WZWBVFPTMVRLAW-DCAQKATOSA-N	431.356	1.166	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1cccc3c[nH]nc13)C2	1843415764	JWFSUGCVBFYNSD-AFUMVMLFSA-N	433.472	1.514	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)c2cc(Cl)nc3ccccc23)C1	1843708178	WEEHPRYOZLPKAS-UHFFFAOYSA-N	449.703	1.699	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)c1cc(O)nc3ccccc13)C2	1846384727	BDFYTYKTQPVGRV-UHFFFAOYSA-N	425.489	1.130	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)c1ccc(OCC3CC3)cc1)C2	1846386198	MGGQXBFNBSPUQL-UHFFFAOYSA-N	428.533	1.665	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@H](Cc2cccc(F)c2)NC(C)=O)C1	1847014404	LFMJNVRCBWKLTK-MSOLQXFVSA-N	439.915	1.330	50	20	IDGD	
O=C(c1cccc2nc(C(F)(F)F)[nH]c12)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl	1847559754	QIDQOTYQWQAJEO-AVGNSLFASA-N	430.814	1.997	50	20	IDGD	
O=C(c1cc(Br)ccc1[N+](=O)[O-])N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl	1847561856	JDTOCVKUCUQQCU-MELADBBJSA-N	446.685	1.772	50	20	IDGD	
CC[C@H](C)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl	1847565101	HQZFCXLFCXVLJI-UVPYHEFZSA-N	431.961	1.727	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1C(=O)c2ccc([N+](=O)[O-])cc2C1=O	16221126	HAVZEXYNLDJXPM-UHFFFAOYSA-N	432.776	1.314	50	20	IDGD	
CS(=O)(=O)Cc1cccc(C(=O)NNC(=O)COc2ccc(Br)cc2)c1	16508017	NCALDIAFLZEYJW-UHFFFAOYSA-N	441.303	1.834	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)n1)c1ccc(S(=O)(=O)N2CCCC2)cc1	17514348	HPTUOVLMHXWQTE-UHFFFAOYSA-N	440.485	1.127	50	20	IDGD	
C=CCNS(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(Br)c[nH]2)c1	24124315	CCKUKSNPVATOIN-UHFFFAOYSA-N	427.280	1.316	50	20	IDGD	
O=C(CNC1=NS(=O)(=O)c2ccccc21)NNC(=O)c1ccc(Br)s1	24306211	AIGXKYXLRGUMMO-UHFFFAOYSA-N	443.304	1.010	50	20	IDGD	
COC(=O)c1sccc1S(=O)(=O)NNC(=O)c1ccc(Br)s1	28778976	DPIJRHZSIHZPSE-UHFFFAOYSA-N	425.307	1.982	50	20	IDGD	
COc1ccc(CCC(=O)N2CCCN(CC(=O)NNC(=O)c3cccs3)CC2)cc1	725802238	JVLKXJBLTMYVTN-UHFFFAOYSA-N	444.557	1.685	50	20	IDGD	
CC(=NNC(=O)c1cc(Br)c[nH]1)c1ccc(S(=O)(=O)NCC(=O)O)cc1	725840443	FMJFVLBDPJBLEJ-UHFFFAOYSA-N	443.279	1.294	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)N1CCN(C(=O)CCC2CCCCC2)CC1	725874035	VBIWEUVFRZIYFU-UHFFFAOYSA-N	449.577	1.723	50	20	IDGD	
CC(C)NC(=O)C(=O)NNC(=O)[C@@H]1C[C@H]2CCCC[C@@H]2N1C(=O)c1ccc(F)cc1F	726157665	YCWXSJKJRBPDCE-DQYPLSBCSA-N	436.459	1.410	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)c1ccc(S(=O)(=O)C(F)F)cc1	726862627	YCLNVKSXLHRTIZ-UHFFFAOYSA-N	445.469	1.881	50	20	IDGD	
CCOC(=O)C1=NN(c2ccccc2)[C@H](C(=O)NNC(=O)c2cc(Br)c[nH]2)C1	727764958	WXSIAIAWLGFAMK-HNNXBMFYSA-N	448.277	1.736	50	20	IDGD	
CN(C)S(=O)(=O)c1c[nH]c(C(=O)NNC(=O)c2cc(F)ccc2Br)c1	728549429	LIBXWJAIRNNQDP-UHFFFAOYSA-N	433.259	1.241	50	20	IDGD	
CC(=NNC(=O)Cc1cccnc1)c1ccc(S(=O)(=O)N2CCCC[C@@H]2C(=O)O)cc1	728784248	CWODFOBPKXQWSK-LJQANCHMSA-N	444.513	1.792	50	20	IDGD	
CCC[C@@H](C)NC(=O)[C@H]1CCCN(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)C1	728961319	GGYGHLFWUCMBJJ-AEFFLSMTSA-N	445.568	1.451	50	20	IDGD	
O=C(CCN1C(=O)[C@@H]2CCCC[C@H]2C1=O)NNc1ccc(S(=O)(=O)C(F)F)cc1	728976545	VANRZSYVZDSTAO-ZIAGYGMSSA-N	429.445	1.691	50	20	IDGD	
CC[C@@H](N=c1nn[nH]n1-c1ccccc1)C(=O)NNC(=O)[C@@H](C)Oc1ccccc1F	729283509	UARGZZKPSSWQNB-CZUORRHYSA-N	427.440	1.029	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)CCc2c(C)nc3[nH]n(C)c(=O)c3c2C)cc1	729527662	JKSCIJWJMPHEPO-UHFFFAOYSA-N	425.489	1.600	50	20	IDGD	
COc1cccc(/C=C(\C(=O)NNC(=O)c2cccc3ncccc23)n2nnnc2C)c1	730225094	LXLRZXHWIYSESO-DEDYPNTBSA-N	429.440	1.998	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)c1sccc1S(=O)(=O)N(C)C	732053611	FXXHMZYAHOMBRL-UHFFFAOYSA-N	435.531	1.372	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)NCCCCN1C(=O)c2ccccc2C1=O	732235557	DODQUVDZWAJSGB-UHFFFAOYSA-N	434.456	1.663	50	20	IDGD	
O=C(COC(=O)c1cc(Cl)nc(N2CCCC2)c1)NNC(=O)c1cccc([N+](=O)[O-])c1	733019587	QCFWTNUNXYWJBL-UHFFFAOYSA-N	447.835	1.861	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1	737629767	XVBOZPHZXWHFMZ-AWEZNQCLSA-N	432.458	1.625	50	20	IDGD	
CN(C)CCOc1ccccc1N1CCN(C(=O)NNC(=O)c2ccc(C#N)cc2)CC1	738466317	BUSUIPPQXOKBCI-UHFFFAOYSA-N	436.516	1.675	50	20	IDGD	
CC(C)CNC(=O)N1CCC[C@@H](C(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)C1	741360142	UTJXYONIWCMTLP-OAHLLOKOSA-N	438.912	1.722	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNS(=O)(=O)c1cnn(-c2ccccc2F)c1	742025697	QUKUBTXVNBFXHY-UHFFFAOYSA-N	434.449	1.799	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C[C@@H](C)/N=C2/NS(=O)(=O)c3ccccc32)c1	742472015	MEQOMHNLXZUYEJ-OAHLLOKOSA-N	444.513	1.347	50	20	IDGD	
COC(=O)[C@H](C)Sc1ccccc1C(=O)OCC(=O)NNC(=O)c1cccc(C#N)c1	744824043	AXPFXBMLXYUWDA-ZDUSSCGKSA-N	441.465	1.830	50	20	IDGD	
O=C(NNc1nc(-c2ccncc2)no1)c1cc(S(=O)(=O)N2CCCC2)ccc1O	745993306	OSPJYVGUSPZYQJ-UHFFFAOYSA-N	430.446	1.379	50	20	IDGD	
O=C(Cc1ccc(Cl)cc1)NNC(=O)c1cccc(CN2CCS(=O)(=O)CC2)c1	747327722	QHKAKBPNBIIDQI-UHFFFAOYSA-N	435.933	1.574	50	20	IDGD	
CC(=NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)c1nnn(-c2ccccc2)c1C	747606795	AZZZBZJHAXTROX-UHFFFAOYSA-N	426.502	1.980	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(CC(=O)NNc2cccc(Br)c2)C(=O)C1	748019546	HCCCKEPLOMNZIY-UHFFFAOYSA-N	427.299	1.972	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1=O	748632991	FRLPEXSZJGMNPA-SWLSCSKDSA-N	444.435	1.165	50	20	IDGD	
Cc1c(NNC(=O)c2cc(S(=O)(=O)N3CCSCC3)c[nH]2)cccc1[N+](=O)[O-]	748681918	WWXKNQFEMUIHKG-UHFFFAOYSA-N	425.492	1.726	50	20	IDGD	
NS(=O)(=O)c1cccc(N2C[C@H](C(=O)NNc3cc(F)c(F)cc3F)CC2=O)c1	748797519	SMLGEFJWWGTUTQ-SECBINFHSA-N	428.392	1.248	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)c1cc(S(=O)(=O)N2CCC2)ccc1Cl	748852866	ZHJGQYJGESCFFQ-UHFFFAOYSA-N	443.934	1.895	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)C1(C)CCC1)N(S(C)(=O)=O)CC2	750234026	YFTIPBZMIUWMJC-OAHLLOKOSA-N	439.534	1.290	50	20	IDGD	
Cc1nc(C(=O)NNC(=O)CNC(=O)c2cccs2)nn1-c1ccccc1C(C)C	751212949	ZMMJINUMUKXORC-UHFFFAOYSA-N	426.502	1.952	50	20	IDGD	
CC(C)Oc1ccc(S(=O)(=O)NNC(=O)CNC(=O)c2ccco2)c2ccccc12	751282827	QRJOOKSXLLYTKR-UHFFFAOYSA-N	431.470	1.960	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)[C@@H](c1ccccc1)N1CCC(O)CC1	752737533	ZTHFYGARQFKLLO-LJQANCHMSA-N	444.919	1.302	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c(OC)c1	755407223	XYLMHQIOHQDBND-UHFFFAOYSA-N	448.501	1.955	50	20	IDGD	
CC[C@H](C)C(=O)NNC(=O)Nc1ccc(CC(=O)N2CCN(c3ncccn3)CC2)cc1	755690950	HKLXVNBFIDJVPL-INIZCTEOSA-N	439.520	1.567	50	20	IDGD	
NC(=O)CCNC(=O)c1cccc(NC(=O)NNC(=O)c2cccc(OC(F)F)c2)c1	756392856	NZBCSHVGIUMICT-UHFFFAOYSA-N	435.387	1.360	50	20	IDGD	
COC(=O)[C@@H](c1cc(F)c(F)c(F)c1)N(C)CC(=O)NNC(=O)c1cccc(C#N)c1	756613533	PRSSEGAFRLVONN-GOSISDBHSA-N	434.374	1.583	50	20	IDGD	
O=C(CCc1ccncn1)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	756803297	GFAOTMVPVXRIGO-UHFFFAOYSA-N	428.456	1.572	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)Nc2ccc(C[C@@H]3CC(=O)NC3=O)cc2)cc1OC	756817145	WHFRITSTWMEEIJ-OAHLLOKOSA-N	440.456	1.766	50	20	IDGD	
CCOc1ccc(C(=O)N(C)C)cc1NC(=O)NNC(=O)[C@H]1COc2ccccc2O1	756882650	PCOXJSMTDUZUTI-GOSISDBHSA-N	428.445	1.780	50	20	IDGD	
Cc1cc(C#N)ccc1Oc1ccc(C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)cc1	756923304	YDWXLUFBEBZKIC-INIZCTEOSA-N	428.470	1.790	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2cnn(-c3ccccc3)n2)cc1	757830307	XDNSIFJFCSLUHE-UHFFFAOYSA-N	443.489	1.049	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)ccc1Cl	759608690	OJHPTPWAJNXTAD-UHFFFAOYSA-N	430.892	1.568	50	20	IDGD	
CCC(CC)[C@@H](C)C(=O)NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1	761486552	ARTYMHOJRBVTLH-QGZVFWFLSA-N	438.594	1.521	50	20	IDGD	
O=C(NNc1ccc(OC(F)(F)F)cc1)c1ccc2c(c1)S(=O)(=O)N=C1N=CNN12	761588372	INJVVFYQBSRJEA-UHFFFAOYSA-N	440.363	1.753	50	20	IDGD	
Cc1c(C(=O)NNc2nccc(N3CCOCC3)n2)nnn1-c1cccc2ncccc12	762856409	PBQHUWOMFZSESV-UHFFFAOYSA-N	431.460	1.507	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccccc2Br)ccc1C(=O)N(C)C	763484078	WLKGRNWZHSVESK-UHFFFAOYSA-N	447.289	1.859	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)NCCCN1CCN(c2ccncc2)CC1	763488564	WGVJHGBEYWGQHT-UHFFFAOYSA-N	444.561	1.422	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cccc(N3CCCC3)c2)cc(OC)c1OC	763539167	JQKPBSYZDYJNSZ-UHFFFAOYSA-N	442.472	1.712	50	20	IDGD	
CCN1CCN(C(=O)c2ccc(NC(=O)C(=O)NNC(=O)c3ccccc3F)cc2)CC1	763568624	OBAPFDMRSXLRMD-UHFFFAOYSA-N	441.463	1.003	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)Nc1c2c(nn1-c1ccccc1)CCC2	763579549	XZXBMCQPMVXCOD-IBGZPJMESA-N	447.451	1.287	50	20	IDGD	
COC(=O)c1cc(OC)c(OC)c(OC)c1NC(=O)C(=O)NNC(=O)c1cc(C)oc1C	763585870	HSLPRSDGEYKARU-UHFFFAOYSA-N	449.416	1.109	50	20	IDGD	
Cn1cc(NC(=O)C(=O)NNC(=O)c2cn(-c3ccccc3)nc2-c2ccccc2)cn1	763601310	KRMRMJVMGOVZQV-UHFFFAOYSA-N	429.440	1.673	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)[nH]n1)C(=O)Nc1cccc(CN2CCCC2=O)c1	763604928	QBCUYWQFEOSXMT-UHFFFAOYSA-N	446.467	1.599	50	20	IDGD	
CC(C)Cc1cc(NC(=O)C(=O)NNC(=O)COc2cccc(C(F)(F)F)c2)n(C)n1	763640500	ZCAXYXGOEHOLNB-UHFFFAOYSA-N	441.410	1.802	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2ccc(CS(C)(=O)=O)cc2)c1	763649799	KMMGZSKOSZOWOK-UHFFFAOYSA-N	433.486	1.013	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2F)n(Cc2ccccc2)n1	763680023	QYWREIPPVJZQHS-UHFFFAOYSA-N	425.420	1.544	50	20	IDGD	
CCOc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NNC(=O)c1cc2c(s1)CCC2	763784067	UHLOHEQUBWLTDA-UHFFFAOYSA-N	444.513	1.737	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)C(=O)Nc1cccc(CN2CCCCC2)c1	763839259	HVUYGJDKGYYDQZ-UHFFFAOYSA-N	428.464	1.977	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cc(C)nn2C(C)(C)C)cc1	763860717	LEGPGUVYVJTZGJ-AWEZNQCLSA-N	431.493	1.899	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccc(-n2cncn2)c(Cl)c1	763863858	DLYYEUFNCSNNHZ-NSHDSACASA-N	446.826	1.613	50	20	IDGD	
Cc1nnnn1-c1cccc(NC(=O)C(=O)NNC(=O)CCSc2ccc(F)cc2)c1	763894899	FQYGZKXWMFAJAZ-UHFFFAOYSA-N	443.464	1.378	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)C(=O)Nc2cccc(C(=O)NC3CC3)c2)cc1	763896275	LHMSVPNTYTXNIV-UHFFFAOYSA-N	426.498	1.765	50	20	IDGD	
CCNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2ccc(OC(C)C)c(OC)c2)c1	763916234	KDYMBIBAOIYFKA-UHFFFAOYSA-N	442.472	1.632	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)Nc1ccc(S(=O)(=O)NC2CC2)cc1	763968562	XDOHOXRNIYDVOX-UHFFFAOYSA-N	436.515	1.778	50	20	IDGD	
CC(C)CNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)cc1	763973577	BOYRFUPUFYEESY-UHFFFAOYSA-N	432.864	1.831	50	20	IDGD	
O=C(NNC(=O)c1ccc[nH]1)C(=O)Nc1ccc(CC(=O)N2CCCc3ccccc32)cc1	763979207	KHMKWOPWPZUNKN-UHFFFAOYSA-N	445.479	1.936	50	20	IDGD	
C[C@@H](c1ccccc1)n1ccc(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)n1	763994559	DZKAWKYEAZGGSF-NSHDSACASA-N	445.277	1.983	50	20	IDGD	
COc1cc(OC)c(OC)cc1NC(=O)C(=O)NNC(=O)c1ccc(Cl)cc1OC	764012465	QRCPSOQQIUHRQH-UHFFFAOYSA-N	437.836	1.774	50	20	IDGD	
CN(C)c1ccc(NC(=O)C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1Cl	764077259	KQGHSYARTFYCLE-UHFFFAOYSA-N	438.893	1.209	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)CCN3C(=O)OC(C)(C)C)n[nH]1	764100300	ZUQFJGNXHRSWCO-UHFFFAOYSA-N	428.449	1.415	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(F)c(NC(=O)OC)c2)o1	764139081	NQZFWHMCRBYSHP-UHFFFAOYSA-N	449.439	1.839	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(-c3ncon3)cc2)o1	764139337	QXKAESKGRHQRIX-UHFFFAOYSA-N	426.433	1.571	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)N(C)C)c(C)c2)o1	764139739	ZHXCIYRJGWJIRN-UHFFFAOYSA-N	443.504	1.531	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)C(=O)Nc1ccc(-c2ncco2)cc1	764203527	MRIFLWWJHDTODM-UHFFFAOYSA-N	431.449	1.732	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2c[nH]nc2C)ccc1NC(=O)OC(C)(C)C	764296272	XFHZMQYTBUVXSQ-UHFFFAOYSA-N	432.437	1.473	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)C(=O)Nc1ccc([C@H](C)NC(=O)OC(C)(C)C)cc1	764298162	PNOJYWQTYTWQRY-NSHDSACASA-N	430.465	1.704	50	20	IDGD	
CN(C(=O)c1ccccc1NC(=O)C(=O)NNC(=O)Cc1ccncc1)C1CCCCC1	764356514	XRRHHRXFBFDPFX-UHFFFAOYSA-N	437.500	1.815	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(C(F)(F)C(F)(F)F)cc1	764397433	JQWZIXHFLOHOJU-VIFPVBQESA-N	427.326	1.478	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)C(=O)Nc2ccc(Oc3ccncc3)cc2)c1	764430945	SHWLFGFDXKSUSJ-UHFFFAOYSA-N	434.412	1.627	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)C(=O)Nc2cccc(-c3csc(C)n3)c2)c1	764432078	BSVGXWANPHHSMF-UHFFFAOYSA-N	438.469	1.872	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)NC[C@@H](NC(=O)OC(C)(C)C)C2CC2)cc1C	764556697	GCSPYSGONGYNIH-MRXNPFEDSA-N	433.509	1.876	50	20	IDGD	
Cc1nc(S(=O)(=O)N2CCN(S(=O)(=O)c3ccc(CCCl)cc3)CC2)cn1C	765237732	XVLDTFHRHNSDDE-UHFFFAOYSA-N	446.982	1.205	50	20	IDGD	
CCCC[C@H](CC)C(=O)NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1	766635520	AGBCZWTZPKZPLI-SFHVURJKSA-N	438.594	1.665	50	20	IDGD	
CC(C)(Oc1ccc(C#N)cc1)C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	767632072	HXOUBOWBGNERIS-GOSISDBHSA-N	439.424	1.246	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc(Cl)c(F)c(C(=O)O)c1)c1ccc2c(c1)OCCO2	767737935	NXWQZUVNIVAWJX-UHFFFAOYSA-N	430.797	1.572	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccc(F)cc1C(=O)N(C)C	768238734	TYYUEYOYHCMGKL-LLVKDONJSA-N	434.399	1.220	50	20	IDGD	
COc1ccc(NNC(=O)C2CCN(S(=O)(=O)c3cccnc3)CC2)c([N+](=O)[O-])c1	768334931	CDRHNEWJCXOLOX-UHFFFAOYSA-N	435.462	1.542	50	20	IDGD	
CCOc1cc(/C=C/C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)ccc1O	768624011	KMEVQRXKMMEZGG-RQMBKDMJSA-N	442.424	1.335	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)[C@H](C)CS(=O)(=O)c1ccc(F)cc1	768641203	NVDDSGNYTOFKJG-GFCCVEGCSA-N	444.506	1.791	50	20	IDGD	
Cc1nn(C)c(N2CCN(C(=O)NNC(=O)[C@H](C)Oc3cccc(Cl)c3)CC2)c1C#N	770649225	NKLCRPWCIWKBEL-AWEZNQCLSA-N	445.911	1.584	50	20	IDGD	
CSCC[C@@H](NC(=O)c1ccco1)C(=O)NNc1nc(O)c2cnn(C(C)(C)C)c2n1	770958919	SYDSWXOCMYZHTC-GFCCVEGCSA-N	447.521	1.875	50	20	IDGD	
CC(C[C@@H]1CCCN1C(=O)OC(C)(C)C)=NNC(=O)CSc1nnc(O)nc1O	771877523	SBOHZFKNGPPSLT-NSHDSACASA-N	426.499	1.657	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)CCc2ccc(S(=O)(=O)NC3CC3)cc2)nc1C	778422289	ZFXIHWCEORNRAB-UHFFFAOYSA-N	447.517	1.478	50	20	IDGD	
CC[C@]1(O)CCN(C(=O)/C(C#N)=C/c2cn(CCC(N)=O)nc2-c2ccc(OC)cc2)C1	779341817	JBBBEXANSXLMDZ-LVJXIGIWSA-N	437.500	1.714	50	20	IDGD	
CN(C)[C@@H](C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1)c1cccc(Cl)c1	780105407	VXRKTJBAOTXSIC-PKOBYXMFSA-N	447.875	1.473	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)[C@H]1C[C@@]12CCN(C(=O)OC(C)(C)C)C2	781969189	CZELMDGEKZNLIX-ZUOKHONESA-N	426.514	1.696	50	20	IDGD	
Cn1ncc(NC(=O)C(=O)NNC(=O)COc2ccc(C(C)(C)C)cc2)c1C(F)(F)F	782120404	CRZCKLYGSYCYCA-UHFFFAOYSA-N	441.410	1.901	50	20	IDGD	
COCCCS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccc(F)cc2F)cc1	783342858	PGUHYTVMWJIZMW-UHFFFAOYSA-N	427.429	1.857	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1ccnn1-c1cccc(Cl)c1	784003856	PZUCPZIHFOYIKP-UHFFFAOYSA-N	446.876	1.103	50	20	IDGD	
Cc1cc2ccc(Cl)cc2nc1NNC(=O)C(=O)Nc1cnn(CC(=O)N(C)C)c1	785160741	GIWRHAOFVAXZRN-UHFFFAOYSA-N	429.868	1.563	50	20	IDGD	
N#C/C(=C/C1CC1)C(=O)OCC(=O)N1CCN(S(=O)(=O)c2c(F)cccc2F)CC1	786679129	KBNAIJVGOQUMQI-UVTDQMKNSA-N	439.440	1.201	50	20	IDGD	
COC(=O)[C@@](C)(CNC(=O)NNC(=O)c1csc(N2CCOCC2)n1)c1ccccc1	787256185	ZHJSMXZZQYPFEP-FQEVSTJZSA-N	447.517	1.055	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2cccc(N3CCNC3=O)c2C)c1	787540595	BBJSKTFXBPBVAM-UHFFFAOYSA-N	439.472	1.306	50	20	IDGD	
COc1cc(C(F)(F)F)ncc1NC(=O)C(=O)NNC(=O)c1c(C)nc2ccccn12	792266923	BJWBQSMFSYLVLV-UHFFFAOYSA-N	436.350	1.465	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)Nc1nc(C(F)(F)F)cs1	793026076	OTDVETUXOUERRR-UHFFFAOYSA-N	440.201	1.663	50	20	IDGD	
COCc1cc(C=NNC(=O)c2cc(S(=O)(=O)NCc3ccccc3)ccc2O)no1	794889224	QLHBGBFJYHVUDO-UHFFFAOYSA-N	444.469	1.769	50	20	IDGD	
CCS(=O)(=O)c1ccc(CCC(=O)NNc2ccccc2S(=O)(=O)N(C)C)cc1	795168675	BOFBBCVDJQTUJD-UHFFFAOYSA-N	439.559	1.806	50	20	IDGD	
Cc1nn(C(C)C)c(C)c1CC(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	795893768	NQKDBBRAGKHDQL-SFHVURJKSA-N	430.461	1.154	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(-c3ccnn3C)ccc2C)cc1OC	799257939	WXFGJBWHYGUWHG-UHFFFAOYSA-N	437.456	1.812	50	20	IDGD	
COc1ccc(Br)c(CS(=O)(=O)NNC(=O)COc2ccccc2O)c1	800047204	HUAMOSVAOGOIED-UHFFFAOYSA-N	445.291	1.693	50	20	IDGD	
CNC(=O)CNC(=O)c1cccc(NC(=O)NNC(=O)c2cccc(OC(F)F)c2)c1	800594608	DATRRMGQNLZXEB-UHFFFAOYSA-N	435.387	1.230	50	20	IDGD	
Cc1nnnn1[C@H](Cc1ccc(F)cc1)C(=O)NNC(=O)Nc1ccc(N(C)C)cc1	802121367	AFOPQXWDRIGAHD-GOSISDBHSA-N	426.456	1.823	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)NC[C@H]2CC(c3ccc(OC)c(F)c3)=NO2)c1	802349350	ISBZZPZRGOXNHX-MRXNPFEDSA-N	446.435	1.989	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)c1ccc(S(=O)(=O)N=c2cc[nH]cc2)cc1	804956786	YMHHFHPPGPJLNN-UHFFFAOYSA-N	436.457	1.037	50	20	IDGD	
C=CCN(C)S(=O)(=O)c1ccc(NC(=O)NNc2ccc(-n3ccnc3)nn2)cc1	806211050	OPKDPGIHVDUACK-UHFFFAOYSA-N	428.478	1.617	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2[nH]cnc2C(=O)c2ccccc2)ccc1Cl	806341276	DMZPGCRHCYISTC-UHFFFAOYSA-N	447.860	1.016	50	20	IDGD	
O=C(CN1CC[C@](CO)(Cc2ccc(F)cc2)C1)NNC(=O)c1cccc([N+](=O)[O-])c1	808794288	IVZWOWWOFCJBBA-NRFANRHFSA-N	430.436	1.422	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)OCC(=O)N(CCC(N)=O)Cc2ccccc2)cc(C#N)n1C	809303050	PTEKSJHZSUZCQN-GRSHGNNSSA-N	433.468	1.560	50	20	IDGD	
CS(=O)(=O)c1ccc(NNC(=O)CNS(=O)(=O)c2ccc3ccccc3c2)cc1	810681598	SQNCOHMOXLSWRI-UHFFFAOYSA-N	433.511	1.665	50	20	IDGD	
Cn1cc(NC(=O)C(=O)NNC(=O)COc2cccc(C(F)(F)F)c2)c(C2CC2)n1	812980194	NUAQXROAEXNCFJ-UHFFFAOYSA-N	425.367	1.481	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1ncc(C(F)(F)F)s1	815751656	IPDTUNZAFZFNFG-UHFFFAOYSA-N	437.425	1.494	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCO1)C(=O)Nc1cc(Cl)ccc1OC[C@H]1CCCCO1	815779784	VRYBGCUAYDCUEY-CZUORRHYSA-N	425.869	1.553	50	20	IDGD	
CNC(=O)c1cccc(NC(=O)C(=O)NNc2cc(C(=O)OC)ccc2Br)c1	815865680	BNHVJDMQZZQYLU-UHFFFAOYSA-N	449.261	1.677	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)c2cc(S(C)(=O)=O)ncc2Cl)cc1OC	816828226	XDCPSZJWWNMWFM-UHFFFAOYSA-N	427.866	1.621	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)[C@H]2CC(=O)N(c3ccccc3Br)C2)n1	913898078	PSOKGHSMLMWDMV-ZDUSSCGKSA-N	434.294	1.463	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)c2cc(S(=O)(=O)N3CCCCC3)cn2C)c1	914839208	ODYXUIVSHSEAMJ-UHFFFAOYSA-N	433.534	1.341	50	20	IDGD	
Cn1cc(S(=O)(=O)N2CCCCC2)cc1C(=O)NNC(=O)c1c[nH]c2ccccc12	914847033	KGSWDCHCCBGNNT-UHFFFAOYSA-N	429.502	1.756	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)CNS(=O)(=O)c2ccccc2C(F)(F)F)cc1	915774615	XJFAJTHCEXYHQP-UHFFFAOYSA-N	445.419	1.519	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)NCCCN1C(=O)NC2(CCCC2)C1=O	915906213	SBZKPVWEJMXEOR-UHFFFAOYSA-N	447.492	1.049	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)NCc2cccnc2N2CCOCC2)cc1	916400067	OUKPJAZOMRGYAK-MRXNPFEDSA-N	443.504	1.615	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)NCC(=O)N2CCCCC2)c2ccccc2c1=O	916473158	BYMCYNOQBPEYCR-UHFFFAOYSA-N	442.520	1.543	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCc2ccc(Cl)s2)c1	916647400	AYMVKSFFHSTOBC-UHFFFAOYSA-N	430.939	1.839	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2c[nH]c3cc(OC)ccc3c2=O)c2ccccc2c1=O	916728032	HXQFEGYYINDGQM-UHFFFAOYSA-N	447.451	1.731	50	20	IDGD	
Cc1ccc(-n2nnc(C(=O)NNC(=O)c3csc(N4CCOCC4)n3)c2C)cc1	917683206	CRJZKPNZSQNVSX-UHFFFAOYSA-N	427.490	1.252	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)N[C@@H](Cc2ccccc2)CN(C)C)nc1	918131961	QOFGWRAULIPZCE-SFHVURJKSA-N	448.593	1.911	50	20	IDGD	
Cc1ccc([C@H](C)NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1	918233285	BHACODOQCQBRRP-INIZCTEOSA-N	446.529	1.721	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)/C=C/c1ccccc1)C(=O)NNC(=O)CC(F)(F)F	918363653	BJNVSDOFGIQECV-FROQITRMSA-N	439.481	1.798	50	20	IDGD	
CNC(=O)COc1ccc(C(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)cc1OC	919689265	HAGQBHZTSFARAO-OAHLLOKOSA-N	429.473	1.665	50	20	IDGD	
CNS(=O)(=O)c1ccc([C@@H](C)NC(=O)NNC(=O)c2ccc(Cl)cc2OC)cc1	919778644	FXUCYJGIIDGSNW-LLVKDONJSA-N	440.909	1.962	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCC(=O)N2CCCc3ccccc32)cc(OC)c1OC	920045698	UKBKSULRODAYFU-UHFFFAOYSA-N	442.472	1.636	50	20	IDGD	
CS(=O)(=O)Nc1ccc(O)c(C(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)c1	920636670	HIWKNMSKFUPTDZ-UHFFFAOYSA-N	441.849	1.035	50	20	IDGD	
COC(=O)CCNC(=O)/C(C#N)=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	920849823	VIRJLRVTDXMEMJ-GXDHUFHOSA-N	429.864	1.665	50	20	IDGD	
COCCCn1c(S)nc2cc(C(=O)NNc3nncc(N)c3Cl)ccc2c1=O	1116292465	IWKBIOUBLJPMEK-UHFFFAOYSA-N	435.897	1.504	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)N[C@H]2CCO[C@]3(CCOC3)C2)c2ccccc2c1=O	1254071314	YZQQLNPOKFRBGL-LHSJRXKWSA-N	429.477	1.260	50	20	IDGD	
C[C@H]1CN(Cc2csc(NC(=O)NNC(=O)COc3ccccc3O)n2)C[C@H](C)O1	1318326003	GAVIHKAXKQFTRU-STQMWFEESA-N	435.506	1.690	50	20	IDGD	
COc1c(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cnn1-c1ccccc1	1338186788	PVJVCCBDZVSEEJ-UHFFFAOYSA-N	448.527	1.854	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2c[nH]c3nccc-3c2)C1	1777899063	LEWDJSZBAQRANL-CBGDNZLLSA-N	434.924	1.896	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2nccc3nc[nH]c23)C1	1777927087	LBQYHXBYUXPBOM-WAWZGNHOSA-N	435.912	1.339	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccncn2)C1	1778152571	JLEJXAFZKYTTKY-DDUZABMNSA-N	425.327	1.635	50	20	IDGD	
Cc1nc2ncccn2c1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(Cl)Cl)C2	1778634934	YEXCPNNBSOUENR-BFUOFWGJSA-N	440.331	1.969	50	20	IDGD	
COc1ccc2[nH]cc(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)[C@@H](O)CCl)C4)c2c1	1779004633	KFGWVDQTQYSOQZ-NNMXDRDESA-N	449.935	1.904	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc(CO)o2)C1	1779713562	YJMDMENIKCUAMA-WBHUJUFNSA-N	429.311	1.683	50	20	IDGD	
O=C(c1csc(C(F)(F)F)n1)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1779754360	JFSUZZCJHWANHH-YGRLFVJLSA-N	427.832	1.205	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnc4snnc4c3)C2)C1	1780071614	IFTKFPPOIJPJLR-HWPZZCPQSA-N	440.323	1.313	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(CO)on2)C1	1780217899	GMLYSPNOBLRCBN-VQIMIIECSA-N	425.558	1.146	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)[C@@H](C)CNC(=O)OC(C)(C)C)CCO2)C1	1781211275	OOLBDQWYKWVWEF-AVYPCKFXSA-N	431.961	1.995	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)CNC(=O)c3ccco3)CCO2)C1	1781226848	BASXCGVSBUKXIU-ZWKOTPCHSA-N	432.304	1.076	50	20	IDGD	
CO[C@H](C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1)c1ccccc1	1781328587	TVXHLHHTTUHZTN-DAYGRLMNSA-N	429.286	1.895	50	20	IDGD	
O=C(c1cccc(N2CCOCC2)c1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Cl)CCO2	1781736054	ZCJSWEQUVBHQCW-YLJYHZDGSA-N	425.888	1.501	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)Nc1ccccn1)C2	1782176220	YHFJBGZGURQWHW-BZLDKRAPSA-N	438.956	1.650	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(C#N)cc1)C2	1782212275	OQQPUGZTJXMPNY-AUSIDOKSSA-N	441.532	1.059	50	20	IDGD	
COC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1	1782864801	SJUNGPKBBZKZDL-VROYLXGSSA-N	447.438	1.655	50	20	IDGD	
O=C(C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](Br)Cc3ccccc3)C2)C1)C1CC1	1783017831	FXCGLNIIKPJCLG-DYESRHJHSA-N	449.345	1.802	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](C)Nc1cccnc1)CCO2	1783341893	HOMPQUNPLDYODA-QOKNQOGYSA-N	439.354	1.885	50	20	IDGD	
C[C@H](O)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](Br)Cc1ccccc1)CCO2	1783525790	OAIUTVFVMQLQST-GMBSWORKSA-N	425.323	1.203	50	20	IDGD	
O=C(C#Cc1ccc(Cl)cc1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21	1783919011	XOTLVIOMENKIHS-DKIMLUQUSA-N	425.312	1.271	50	20	IDGD	
C[C@@H](CNC(=O)OC(C)(C)C)C(=O)N1CCO[C@@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783940117	QZFBXHIXSNFCNC-KPZWWZAWSA-N	438.352	1.781	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnnc(Cl)c3)[C@H]2C1	1785454982	SAWJNGICJLNEQY-UKJIMTQDSA-N	431.718	1.507	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)C3(NC(=O)OC(C)(C)C)CC3)C2)C1	1785714810	FTVYWQHOQMRDFH-KUHUBIRLSA-N	445.944	1.127	50	20	IDGD	
C=CCCc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](O)CCl)C[C@@H]32)c(O)n1	1785772911	UVLLDYKAUQXLQP-MGHWNKPDSA-N	437.924	1.099	50	20	IDGD	
CCS(=O)(=O)N[C@H](C)C(=O)Nc1ccc(C2(NC(=O)[C@@H](Cl)COC)CCC2)cc1	1786338602	CXEGKRLEFVOBTA-CJNGLKHVSA-N	445.969	1.702	50	20	IDGD	
Cc1cc(CC(=O)Nc2ccc(C3(NC(=O)c4cccc(B(O)O)c4)CCC3)cc2)on1	1786722433	USENFIVBJFLKAL-UHFFFAOYSA-N	433.273	1.653	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1ccc2occc2c1	1788011729	JUBAEUVYRWLCEP-VCOUNFBDSA-N	448.284	1.020	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cn4ncccc4n3)[C@H]2C1	1788015960	MLOPCYGOMNIOJQ-ZOBUZTSGSA-N	431.569	1.174	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)NC(=O)c3ccccn3)C[C@@H]21	1789865527	XEMDTWBUWJVITR-DNCCFGNJSA-N	436.940	1.197	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)Nc1ccc(C2(NC(=O)C[C@H]3NC(=O)NC3=O)CCC2)cc1	1790489778	YQEUWIRUUAOFDK-ACJLOTCBSA-N	441.315	1.955	50	20	IDGD	
C[C@@H](Cc1ccncc1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21	1790579543	ZRPGNTSJWNSSMY-JVNPIMRCSA-N	442.329	1.930	50	20	IDGD	
COCCOCCOCCC(=O)Nc1ccc(C2(NC(=O)[C@H](O)CCl)CCC2)cc1	1791482727	UCSBBEWNTTZSCN-GOSISDBHSA-N	442.940	1.790	50	20	IDGD	
COc1cccc(Cl)c1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21	1792018217	MDIREMVXMRHSRU-GMZLATJGSA-N	431.316	1.542	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3cccn3cn1)C2	1792867613	DFPKDOFFAZJKKE-ZJOBFFGXSA-N	435.322	1.569	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)CNC(=O)OC(C)(C)C	1792993121	NFAFPZUYCNUKSN-IBEHDNSVSA-N	431.961	1.754	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccc(F)c(C#N)c1	1799326968	MTDPNQVTCWDJMB-MKXCTONWSA-N	438.297	1.613	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@](C)(Cl)CCl)C2	1800959107	DMRJOELGLSOABG-BVWVXVDMSA-N	447.359	1.568	50	20	IDGD	
Cc1ccn2c(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)CCC(=O)NN(C)C)C4)cnc2c1	1801134199	QWRXCKZYWALEHB-BJWYYQGGSA-N	426.521	1.268	50	20	IDGD	
C[C@H](Nc1cccnc1)C(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]1c1cccnc1	1803138332	JOTLUOFRZIIVFD-WLWJZTKJSA-N	431.924	1.583	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@@H](CNC(=O)c2cnnn2C)[C@H]1c1cccnc1	1804740584	WMQADRXDKBIOEQ-IVMMDQJWSA-N	435.326	1.561	50	20	IDGD	
O=C(c1ncn(-c2ccccc2)n1)N1CCC2(CCCN(C(=O)[C@H](O)CCl)C2)CC1	1805523820	WEXXEGHSAUIADI-QGZVFWFLSA-N	431.924	1.712	50	20	IDGD	
O=C(Cn1cc([N+](=O)[O-])cn1)N1CCCC2(CCN(C(=O)[C@@H](F)Br)CC2)C1	1806934462	WJTTXCGJDOAXJG-CQSZACIVSA-N	446.277	1.713	50	20	IDGD	
C=CCC(CC=C)C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1807359313	HQHVXSLZTMHETD-GGAORHGYSA-N	447.344	1.849	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)c2ccccc2F)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807359984	FYZZMNRCWIARIX-XMSQKQJNSA-N	447.275	1.534	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)C2CC3(CCC3)C2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807366859	HPZXKBLTMHCIMP-UGKGYDQZSA-N	447.344	1.661	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)CC(F)(F)F)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1	1807370337	ARRJKYITRAVDSI-CRAIPNDOSA-N	435.211	1.033	50	20	IDGD	
C=C(Oc1ccccc1O)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1	1808400857	PGNCENZCENQOTJ-QRFRQXIXSA-N	445.903	1.985	50	20	IDGD	
CC(=O)N[C@H](C)C(=O)N1CC[C@H](CNC(=O)[C@H](F)Br)[C@@H]1c1cccnc1	1808678906	PFWHOAJBLFCQQC-RABLLNBGSA-N	429.290	1.303	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)c1ccc2cnccc2n1	1809140796	MWNDWIFHVWKVHX-DBVUQKKJSA-N	439.903	1.944	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)c1cc2cnccc2[nH]1	1809987756	JCHWWNXFUTVQQZ-GDIGMMSISA-N	427.892	1.877	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)c2ccco2)[C@@H]1c1cccnc1	1810297762	DLPLOYVHLVCIEY-HNAYVOBHSA-N	434.456	1.307	50	20	IDGD	
CCNC(=S)NCC(=O)NC[C@@H]1CCN(C(=O)C(C)(C)CCl)[C@H]1c1cccnc1	1812327988	CIJJUEHUOHCGMX-RDJZCZTQSA-N	440.013	1.836	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)Cn2ccncc2=O)[C@H]1c1cccnc1	1812340670	MEEWQFDSCZLUFH-ABSDTBQOSA-N	431.924	1.752	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)Cc2ccccn2)[C@H]1c1cccnc1	1813070031	CTTINRCEPBLWDU-MBSDFSHPSA-N	438.532	1.098	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CCN2C(=O)C=CC2=O)[C@H]1c1cccnc1)C(Cl)Cl	1813075283	AESXGVPHMUPHJO-GUYCJALGSA-N	439.299	1.206	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)Cn2cc(C)c(O)nc2=O)[C@@H]1c1cccnc1	1814040485	MTTIETCADCLLOK-RYRKJORJSA-N	447.923	1.376	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)C(=O)C2CC2)n[nH]1	1814808428	NMADZEKNAGSXQP-UPVZUOOXSA-N	439.476	1.515	50	20	IDGD	
Cc1ncc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)[nH]n2)cn1	1816289187	HMEYULRQRWCZGM-QGZVFWFLSA-N	449.475	1.126	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cscn2)[nH]n1)c1cccc(B(O)O)c1	1817473398	RNSALJFPXOYXKS-INIZCTEOSA-N	425.279	1.166	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)c3ccncc3F)sc2C1	1817870383	SHQCHHRZIJIVEJ-NSHDSACASA-N	434.497	1.276	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CO)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](F)Cl)n[nH]1	1818037246	HDBSHMKSGODSEU-SGMGOOAPSA-N	447.895	1.822	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CC1CCCC1)CC2	1819794798	DPHWFIBBCHBUBW-CYBMUJFWSA-N	442.545	1.948	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1	1822353219	KWDJSEUWLDURKW-LQKXBSAESA-N	438.912	1.757	50	20	IDGD	
CC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](C)[C@H]1SC(=N)NC1=O)CC2	1822846022	VQMXDOFAZDATRD-KZFFXBSXSA-N	443.982	1.875	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H]1CC[C@@H](C(=O)OC)C1)CC2	1825994415	LEDJWRWIOHJACN-LPWJVIDDSA-N	443.953	1.898	50	20	IDGD	
O=C(C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1)c1ccccc1	1826287953	CXDOGEKGOMJWMN-QFIPXVFZSA-N	448.328	1.483	50	20	IDGD	
CC(=O)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Cl)CCN2C(=O)OCc1ccccc1	1829053036	WKCYJTOZEHBCRK-UZLBHIALSA-N	439.871	1.562	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1CC=CCC1)CCO2	1830568136	NSQDBYFSFAXYFF-GJYPPUQNSA-N	429.355	1.973	50	20	IDGD	
O=C(c1cc(F)ccc1Cl)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1830733362	KLDBDYSBZNJERL-CRAIPNDOSA-N	435.279	1.149	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4c(c3)OCO4)C2)C1	1831645897	FEBUIXBBFOORAN-IERDGZPVSA-N	438.908	1.893	50	20	IDGD	
O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)c1ccccc1)CCO2	1832215065	AOTFNFHBBMZCTN-PKOBYXMFSA-N	443.313	1.939	50	20	IDGD	
C[C@H](C(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)CCl)CC2)CC1)n1cccc1C=O	1833310473	KSGBUHCTXKTEIM-BEFAXECRSA-N	438.956	1.033	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)Cc3ncccn3)CC2)CC1	1833878452	GWIMFIMWLJSEGU-AWEZNQCLSA-N	438.370	1.374	50	20	IDGD	
Cc1ncsc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)CBr)C2)C1	1834261974	OCWBOOFKSQEDTL-SJKOYZFVSA-N	446.367	1.553	50	20	IDGD	
N[C@H](C(=O)NC1CCN(C2CCN(C(=O)C(Cl)Cl)CC2)CC1)c1ccccn1	1834725692	GSTGIOUJJJQYDN-INIZCTEOSA-N	428.364	1.457	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)COc3ccccc3)CCO2)C1	1834954873	BQNKWMNTISTRCC-KXBFYZLASA-N	441.322	1.305	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cccn(C(F)F)c3=O)CC2)CC1)[C@@H](F)Cl	1835083974	CQALFYBVEKSXEK-OAHLLOKOSA-N	448.873	1.963	50	20	IDGD	
O=C(CCc1cccnc1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1836182719	RQCDHBZOHOCGOC-WMZOPIPTSA-N	444.301	1.161	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@H]3CCCN(C)C3)CC2)CC1	1836351654	GIHMDTYPKONXOP-QFBILLFUSA-N	429.005	1.154	50	20	IDGD	
CC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)COC(=O)C(F)(F)F)CC2)CC1	1836396604	DIRKIPHAYMISAQ-AWEZNQCLSA-N	441.878	1.681	50	20	IDGD	
Cc1nc(C)c(C(=O)N2CCC(OC3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)s1	1836714967	GPOFMYYTHCRJBB-INIZCTEOSA-N	429.970	1.972	50	20	IDGD	
CCCC(=O)N[C@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1837668930	BPOHLMJVBQNQPX-FOIQADDNSA-N	431.961	1.013	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)cc1O	1837714611	LREMJFSEPNYTEM-OAQYLSRUSA-N	436.581	1.622	50	20	IDGD	
O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)c1cnccc1Cl)CCO2	1837774765	HJPWWJZFLHNNER-QGZVFWFLSA-N	446.729	1.590	50	20	IDGD	
CCc1noc(C)c1C(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1838052598	FSFXAGAEEPHDFK-FQEVSTJZSA-N	427.929	1.880	50	20	IDGD	
O=C(O)c1cnncc1C(=O)N1CCC(OC2CCN(C(=O)[C@H](F)Cl)CC2)CC1	1838082317	HACQILUYYAYTPR-HNNXBMFYSA-N	428.848	1.321	50	20	IDGD	
N[C@@H](Cc1cccnc1)C(=O)N1CCC(OC2CCN(C(=O)C(Cl)Cl)CC2)CC1	1838093084	XCGLOGJGOIZYGS-KRWDZBQOSA-N	443.375	1.754	50	20	IDGD	
CC(C)c1nc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)co1	1839197606	BUQRVJMTJLOJOM-GUYCJALGSA-N	448.289	1.559	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCCC(F)(F)F)C2)C1	1840030194	CXZJFMCHBIDOQX-IUODEOHRSA-N	445.276	1.959	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C(C)=C/c3ccc(C)o3)C2)C1	1840153172	GQEKLNVICNEGQV-OWDDFCINSA-N	440.924	1.702	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)c3ccccn3)C2)C1	1840156810	ZYDQOIMJIIUSSM-KKSFZXQISA-N	439.940	1.069	50	20	IDGD	
COc1cccc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)c1	1840187908	DPJGBMQCAAZXHI-LJQANCHMSA-N	431.316	1.498	50	20	IDGD	
O=C(c1ccc2cccnc2n1)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840188399	HRQOUXVYJCLESI-IBGZPJMESA-N	439.299	1.504	50	20	IDGD	
N#Cc1cc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)ccc1F	1840189527	WWZSFXPTQBIDQC-IBGZPJMESA-N	444.290	1.500	50	20	IDGD	
COC(=O)c1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)c(C)c1	1840787170	SGKNPSIRRVAKEX-OXQOHEQNSA-N	442.871	1.386	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H]3CCCSC3)CCO2)C1	1840865639	UESCPIMZUMOTIB-FHLIZLRMSA-N	439.405	1.822	50	20	IDGD	
O=C(c1ccc(Br)c([N+](=O)[O-])c1)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1	1841352705	HJJRDPFYEONOLZ-ZDUSSCGKSA-N	446.685	1.774	50	20	IDGD	
COC(=O)CCC(=O)N1CC2(CCCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C1	1841924386	GQRCTMLRPVBUBV-ZDUSSCGKSA-N	431.917	1.275	50	20	IDGD	
CCOC(=O)/C=C/C(=O)N1CC2(CCCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C1	1841924508	UPEPZLDYGUBMIR-NPQIQWPPSA-N	443.928	1.441	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)c2cccnn2)C1	1844438117	LWSBIRVGXDIALP-UHFFFAOYSA-N	425.401	1.441	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)C2(c3ccc(F)c(F)c3)CC2)C1	1845016258	CLVOACBCPXPUHE-UHFFFAOYSA-N	440.255	1.193	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC2(CCCN2C(=O)[C@@H]2CC(c3ccccc3)=NN2)C1	1845741156	ZMCXLUKCFYIABY-YOEHRIQHSA-N	433.350	1.987	50	20	IDGD	
O=C([C@H](F)Br)N1CC2(CCCN2C(=O)[C@H]2C[C@@]23C(=O)Nc2ccccc23)C1	1846153632	BSDHORNTLGQKGS-UHYGZKCKSA-N	436.281	1.790	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)CSc1ccc(F)cc1F)C2	1846383922	ISRPCSXZYNJNOH-UHFFFAOYSA-N	440.516	1.633	50	20	IDGD	
COC(=O)[C@H](F)C(Nc1ccc(SC#N)cc1Cl)=C1C(=O)NC(=S)NC1=O	9864815	FONAHQCKNFKRTQ-SNVBAGLBSA-N	428.854	1.621	50	20	IDGD	
COCCCn1c(=S)[nH]c2cc(C(=O)NNC(=O)Cn3nc(C)cc3C)ccc2c1=O	12666924	MYLNWNATURFYQN-UHFFFAOYSA-N	444.517	1.370	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)c2ccc(S(=O)(=O)N3C[C@@H](C)C[C@H](C)C3)cc2)n1	15462381	RZIUVXYVWCQSJO-GJZGRUSLSA-N	447.561	1.628	50	20	IDGD	
Cc1cc(C(=O)NNS(=O)(=O)c2ccc(S(N)(=O)=O)cc2)c(C)n1-c1ccccc1	18994937	OIDLARGRQVOJBY-UHFFFAOYSA-N	448.526	1.365	50	20	IDGD	
C[S@](=O)Cc1cccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1	26561408	YGFSEFQKOUDBNO-GDLZYMKVSA-N	449.554	1.424	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=O)c2cc(-c3ccccc3)on2)n(C)c1	27264517	JUROUHUUJKNPGZ-UHFFFAOYSA-N	445.501	1.785	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cc(-c3ccccc3)on2)cc1	28793667	HNKCILJQGSGPFO-UHFFFAOYSA-N	444.469	1.341	50	20	IDGD	
C[C@]12CCC(=O)N1c1ccccc1C(=O)N2CC(=O)NNC(=O)c1ccc2c(c1)OCO2	105969289	YRBQXMOLSWHFNF-JOCHJYFZSA-N	436.424	1.175	50	20	IDGD	
O=C(CCCc1ccccc1)NNC(=O)c1ccc(F)c(S(=O)(=O)N2CCOCC2)c1	727717083	UHKDLTAFLCLQSC-UHFFFAOYSA-N	449.504	1.631	50	20	IDGD	
COc1ccccc1C1(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)CC1	728340289	HPZNXIQLODJBAE-GOSISDBHSA-N	426.425	1.257	50	20	IDGD	
C[C@@]1(c2ccc3ccccc3c2)NC(=O)N(CC(=O)NNC(=O)Cc2cccnc2)C1=O	728856705	VPOKKBGDEAZDBW-QHCPKHFHSA-N	431.452	1.392	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNc2nc(-c3ccncc3)no2)sc1Br	729530602	IJKCOHUCZXZXNZ-UHFFFAOYSA-N	445.280	1.360	50	20	IDGD	
Cc1nc2c(c(O)nn2C)c(C)c1CC(=O)NNc1ccc(S(=O)(=O)C(F)F)cc1	729533352	GLVUFDMYXKILLP-UHFFFAOYSA-N	439.444	1.973	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@H]2CSCN2C(=O)CC(C)(C)C)c2ccccc2c1=O	730072938	IKZCKMHNZXGRQN-OAHLLOKOSA-N	445.545	1.515	50	20	IDGD	
C=CCn1c(S)nc2cc(C(=O)NNC(=O)COc3ccccc3O)ccc2c1=O	730780006	NBPYPFHYZYUHLB-UHFFFAOYSA-N	426.454	1.417	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)CCC(=O)c1ccc(I)cc1	732084654	VJLRKZKUZZUALR-UHFFFAOYSA-N	426.214	1.747	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2c[nH]nc2-c2ccc3c(c2)OCCO3)C[C@H](C)O1	732263982	QMNAEHSHJFBJIB-KBPBESRZSA-N	429.477	1.108	50	20	IDGD	
O=C(NCC1CCN(S(=O)(=O)C(F)(F)F)CC1)NNC(=O)c1cccc(Cl)c1	732675840	KBMYPMRXRNFHAF-UHFFFAOYSA-N	442.847	1.846	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)NCc1ccccc1CN1CCCCCC1	732993758	BRRCKUIWNMKCOY-UHFFFAOYSA-N	427.505	1.916	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCOc2cccnc2)c1	734071429	KAVHHIXYEXPVOP-UHFFFAOYSA-N	435.506	1.135	50	20	IDGD	
CCCCS(=O)(=O)N1CCC[C@H]1C(=O)NNC(=O)Cn1c(CC)nc2ccccc21	734119646	GFANHUGISOLAGS-KRWDZBQOSA-N	435.550	1.340	50	20	IDGD	
C[C@]1(C2CC2)NC(=O)N(CC(=O)NNc2cc(C(F)(F)F)nc(-c3ccccn3)n2)C1=O	734258194	FXUVEPKFFUHGLH-GOSISDBHSA-N	449.393	1.721	50	20	IDGD	
COc1ccc(CN2CC[C@H](NC(=O)NNC(=O)COc3cc(C)ccc3C)C2=O)cc1	734684215	MKCCVQMASZMBRO-IBGZPJMESA-N	440.500	1.822	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)CC(=O)NNC(=O)c2c(C)nc3ccccn23)cc1F	734807764	BOKXTEZEWRSKOE-UHFFFAOYSA-N	432.433	1.219	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2cc3ccccc3n2C)CC1	735116854	INFBGNMFUMFBMP-UHFFFAOYSA-N	428.518	1.266	50	20	IDGD	
CS[C@H]1CCC[C@@H](NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)C1	735385450	ZMIGLOQLTSDTRD-CABCVRRESA-N	428.580	1.620	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)[C@@H]1C[C@H]2CCCC[C@@H]2N1C(=O)c1ccccc1	740853076	SVLQJXAQORBAHT-NEWSRXKRSA-N	428.533	1.912	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCCCOC[C@H]1CCOC1	740903209	JMKVVALJJIUIKG-ZIAGYGMSSA-N	444.326	1.990	50	20	IDGD	
C[C@H](CC(=O)NNC(=O)c1cc(Cl)ccc1O)/N=C1/NS(=O)(=O)c2ccccc21	743296967	RRZMVBVUTLYBTK-SNVBAGLBSA-N	436.877	1.324	50	20	IDGD	
CN(C[C@@H]1CCN(Cc2ccccc2)C1)C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	743510588	YXWJVTXRLMGEKZ-SFHVURJKSA-N	434.504	1.471	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)N[C@@H]2CC(=O)N([C@H]3C[C@@H]3c3ccccc3)C2)c1	743702051	NNJKAZSGCSOZRW-AHRSYUTCSA-N	438.484	1.805	50	20	IDGD	
C[C@H](NC(=O)OCc1ccccc1)C(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	743830015	KGBVRQCLXYIFFN-ZDUSSCGKSA-N	434.474	1.558	50	20	IDGD	
CCC(C)(C)CC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	744458504	NYDDUOJDKRAJGY-UHFFFAOYSA-N	425.551	1.614	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)CSCc2cc(=O)n3ccsc3n2)c1	744549336	UYRGEWWCLDOSEM-UHFFFAOYSA-N	446.510	1.302	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)c2oc3ccccc3c2CS(C)(=O)=O)c1	744925608	XPJFUBQDQAZQGM-UHFFFAOYSA-N	444.465	1.904	50	20	IDGD	
COC(=O)c1ccsc1N1CC[C@@H](NC(=O)NNC(=O)c2ccccc2OC)C1=O	746778744	DRPBMMJOGGAPLZ-CYBMUJFWSA-N	432.458	1.293	50	20	IDGD	
O=C(COC(=O)C1CC(OCc2ccccc2)C1)NNC(=O)c1ccc([N+](=O)[O-])cc1	747053032	JIDCRBURUIHIQI-UHFFFAOYSA-N	427.413	1.894	50	20	IDGD	
C[C@H](OC[C@@H]1CCCO1)C(=O)NNc1ccc(S(=O)(=O)Nc2nccs2)cc1	747943494	ZEPIWVBHKADJAV-JSGCOSHPSA-N	426.520	1.971	50	20	IDGD	
O=C(C/N=C1/NS(=O)(=O)c2ccccc21)NNc1ccc(F)cc1Br	748077553	WGECTFFUGUAWCW-UHFFFAOYSA-N	427.255	1.770	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)c1cc(Br)c2c(c1)OCCO2	748601800	NDDFUQZKXGQAOR-HNNXBMFYSA-N	435.230	1.821	50	20	IDGD	
O=C(NCc1ccccc1CN1CCC(O)CC1)NNC(=O)c1cccc([N+](=O)[O-])c1	749590194	LWJWONRKHIKASA-UHFFFAOYSA-N	427.461	1.696	50	20	IDGD	
CCOC(=O)c1sc(CNC(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)nc1C	750672391	QHBHQMCTIDKUCI-UHFFFAOYSA-N	433.490	1.714	50	20	IDGD	
O=C(NNC(=O)N1CCC(OC[C@H]2CCCO2)CC1)C1CCN(c2ncccn2)CC1	751606334	DMJUBKRAUMUUPN-GOSISDBHSA-N	432.525	1.094	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)N[C@H]2CCCN(Cc3ccccn3)C2=O)c1C	753297046	FZYRFCLAQWMZCB-HKUYNNGSSA-N	439.516	1.987	50	20	IDGD	
CC(C)c1c(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)cnn1-c1ccccc1	753852960	MWBACUNKPYWOHE-UHFFFAOYSA-N	445.483	1.972	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)CCCOc1ccc(Cl)cc1Cl)S(C)(=O)=O	754677187	XOQHMIPWWFDZQS-SNVBAGLBSA-N	426.322	1.916	50	20	IDGD	
O=C(NNc1ccc(C(F)(F)F)nn1)c1ccc(S(=O)(=O)NC[C@@H]2CCCO2)cc1	755183244	IMSHTSRKYRIGKE-LBPRGKRZSA-N	445.423	1.710	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)Nc1ccc(N2CCOCC2)cc1N1CCOCC1	755452366	HATIRUAYHQKNJP-UHFFFAOYSA-N	440.504	1.150	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)Nc1ccc(N2CCCS2(=O)=O)cc1	755591487	CSFQBWAXPCURBL-UHFFFAOYSA-N	440.485	1.879	50	20	IDGD	
COC(=O)CCNC(=O)c1ccc(NC(=O)NNC(=O)c2cc(OC)cc(OC)c2)cc1	755603167	IRCRHVJUBSDLAA-UHFFFAOYSA-N	444.444	1.463	50	20	IDGD	
CC(=O)Nc1cccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1C	755625239	OSDSPGOUCFXKJI-UHFFFAOYSA-N	433.490	1.670	50	20	IDGD	
CN(C)CCn1ccc(NC(=O)NNC(=O)COc2ccc(Br)cc2)n1	756764347	GSCUGFCKUICONN-UHFFFAOYSA-N	425.287	1.439	50	20	IDGD	
C[C@@H]1CN(c2nccnc2C#N)CCN1C(=O)NNC(=O)c1cccc(OC(F)F)c1	756932865	OUXGOKHBNDSDMF-GFCCVEGCSA-N	431.403	1.515	50	20	IDGD	
CC(=O)N1CC[C@@H](NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c2ccccc21	757789411	UUALUDPCBSQPTP-QGZVFWFLSA-N	434.456	1.375	50	20	IDGD	
O=C(COCc1nc2ccccc2s1)N1CCN(S(=O)(=O)CBr)CC1	758536440	WKQUKDQLRPLUOV-UHFFFAOYSA-N	448.364	1.639	50	20	IDGD	
CCN(CC)[C@@H](CNC(=O)NNC(=O)C(=O)Nc1ccccn1)c1cccc(OC)c1	758684677	GELQDVADRFTAII-KRWDZBQOSA-N	428.493	1.442	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N[C@@H]2CN(C(=O)OC(C)(C)C)C[C@@H]2C#N)cc1OC	758753114	DHJAMTQBENIGEV-UONOGXRCSA-N	433.465	1.407	50	20	IDGD	
O=C(NNC(=O)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1)C(=O)Nc1ccccn1	758841355	ZBFXPXGOLGGYBJ-LJQANCHMSA-N	435.406	1.622	50	20	IDGD	
Cn1cc(-c2ccccc2CNC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cn1	758935474	LFIFUHMQNHZMOT-UHFFFAOYSA-N	427.486	1.635	50	20	IDGD	
NC(=O)[C@@H]1CC[C@@H](CNC(=O)NNC(=O)c2ccc(COc3ccc(Cl)cc3)cc2)O1	760204226	PCDZNGUCPAYAEW-ROUUACIJSA-N	446.891	1.896	50	20	IDGD	
CC(C)CNC(=O)N1CCC[C@@H](CC(=O)NNC(=O)CCNC(=O)OC(C)(C)C)C1	760440281	ZYCNPDOKVJNCNO-HNNXBMFYSA-N	427.546	1.516	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)NCc1ccccc1Cn1cncn1	761659873	SCBUBIJSLBJUFX-UHFFFAOYSA-N	426.502	1.958	50	20	IDGD	
CCCCS(=O)(=O)N1CCC[C@H]1C(=O)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	763173178	LRZRPWCLIXMRFC-KRWDZBQOSA-N	437.497	1.571	50	20	IDGD	
Cc1ccc(Cl)c(NC(=O)C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c1	763531813	RSTOCELXLZCCRP-UHFFFAOYSA-N	443.935	1.947	50	20	IDGD	
C[C@H]1CN(Cc2cccc(NC(=O)C(=O)NNC(=O)c3ccccc3F)c2)C[C@@H](C)O1	763556136	KZIQVFVQDAQFHQ-GASCZTMLSA-N	428.464	1.835	50	20	IDGD	
C[S@@](=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)cc1F	763604360	JYODRNFDXWZCLK-SSEXGKCCSA-N	429.433	1.353	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(NC(=O)c3ccncc3)c2)cc1	763812852	WMMIWBVLAPSFNI-UHFFFAOYSA-N	447.451	1.807	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)c1ccc(I)c(F)c1	763825638	UBYQCGYAWDPMNF-UHFFFAOYSA-N	442.188	1.016	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)NCC(F)(F)F)cc2)cc1	763834348	MRZWUYBMWHCIDV-UHFFFAOYSA-N	436.390	1.941	50	20	IDGD	
COC(=O)c1cc(OC)ccc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccccc1F	763856806	IEMXAQOKBUGFKX-LLVKDONJSA-N	433.392	1.174	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)OC)cc2F)cc1	763860623	JIMHQFBWEWSXJT-GFCCVEGCSA-N	447.419	1.564	50	20	IDGD	
COCCn1ccc2ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc3ccccc3F)cc21	763865798	QJWIJTGXNHRJAO-CQSZACIVSA-N	442.447	1.980	50	20	IDGD	
COCCCOc1ccccc1NC(=O)C(=O)NNC(=O)c1cc(Br)c[nH]1	763995143	NAORQAADMWZQCA-UHFFFAOYSA-N	439.266	1.592	50	20	IDGD	
COc1cccc(Oc2ccc(NC(=O)C(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)cc2)c1	763997075	IDNOMRBTHTYDRV-ZDUSSCGKSA-N	447.469	1.008	50	20	IDGD	
CNC(=O)[C@@H]1CN(C(=O)C(=O)NNC(=O)c2cccc3ccccc23)c2ccccc2O1	764047836	HZBAXCUANBALLW-IBGZPJMESA-N	432.436	1.141	50	20	IDGD	
CC[C@@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(S(=O)(=O)N(C)Cc2ccccc2)cc1	764080957	ASIRNPUWHQRIDZ-OAHLLOKOSA-N	446.529	1.639	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccc(NC(=O)[C@H]2CCCO2)cc1	764130440	IAKCERLKBXRESP-GOSISDBHSA-N	440.456	1.141	50	20	IDGD	
CC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)c1C	764204515	WXZMLOZQRFYWJC-UHFFFAOYSA-N	435.481	1.344	50	20	IDGD	
COCCOc1ccc(F)cc1NC(=O)C(=O)NNC(=O)Cn1ccc2ccccc21	764243358	VCYJTMJYCJEXNP-UHFFFAOYSA-N	428.420	1.592	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)ccc1O)C(=O)Nc1c(F)cc(F)cc1F	764280265	LUNQTTWPJLLNIH-UHFFFAOYSA-N	432.152	1.972	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)C(=O)Nc1ccccc1CN1CCSCC1	764313361	LPORCRUKNGZQNJ-UHFFFAOYSA-N	430.505	1.703	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1N1CCOC1=O	764345105	ANKQLHVSQQKFGR-UHFFFAOYSA-N	448.439	1.537	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)C[C@H](OC)C3)n[nH]1	764378197	VMFRLLNABNVMCS-MRXNPFEDSA-N	449.467	1.599	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccsc3C(=O)OC)n[nH]2)cc1	764385116	RNZXAHLHIOCOCP-UHFFFAOYSA-N	441.469	1.887	50	20	IDGD	
O=C(COc1ccccc1O)NNS(=O)(=O)c1ccc(Br)c([N+](=O)[O-])c1	765191097	OBBAIMPJZMPYMO-UHFFFAOYSA-N	446.235	1.451	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)c2ccc(C)c(S(N)(=O)=O)c2)n[nH]1	765592212	JOSVFIWIVMAPJD-UHFFFAOYSA-N	429.458	1.116	50	20	IDGD	
COc1ccc(C(C)(C)C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cc1	766635671	CBOLVUOEYCCSKS-UHFFFAOYSA-N	438.528	1.578	50	20	IDGD	
C[C@H](OC[C@H]1CCCO1)C(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	766663374	KGUSZCLQIAQVRT-QFBILLFUSA-N	438.956	1.189	50	20	IDGD	
CC(C)c1nn(C)cc1C(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	766668039	GZSTYXMOQALRGR-UHFFFAOYSA-N	432.956	1.776	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])o1)c1cc(-c2cccs2)[nH]n1	768268721	SSQGXVURNOPUDL-GFCCVEGCSA-N	444.429	1.705	50	20	IDGD	
CC1(C)CCC[C@@]2(C1)NC(=O)N(CC(=O)NNC(=O)Cc1c[nH]c3ccccc13)C2=O	768565234	FRNDPUUZPLBWPQ-QFIPXVFZSA-N	425.489	1.749	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)CNC(=O)N1CCc2ccccc2C1	768635340	YHOSVZOWSCBJKK-UHFFFAOYSA-N	432.502	1.310	50	20	IDGD	
N#Cc1cc(Cl)nc(NNC(=O)[C@@H]2CCCN2C(=O)/C=C\c2ccc(C(N)=O)cc2)c1	768707259	KTQUOMSSKYXNCX-SBSDFTTDSA-N	438.875	1.853	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)NC2CCN(C(=O)CCOC)CC2)cc1	769163496	ABIWEYNODQUBMT-HNNXBMFYSA-N	436.509	1.211	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)Nc1cc(F)cc(S(N)(=O)=O)c1	769231154	ADAYCKJFSUWKJY-UHFFFAOYSA-N	432.455	1.034	50	20	IDGD	
CN(C)C(=O)COc1ccc(C(F)(F)C(=O)NNC(=O)COc2ccccc2F)cc1	769351359	BHTXYDHYESSOBL-UHFFFAOYSA-N	439.390	1.611	50	20	IDGD	
C=C(C)Cn1c(SCC(=O)N([C@@H]2CCS(=O)(=O)C2)N(C)C)nnc1-c1ccco1	769619495	ZAFDFQZBCUNNTJ-CQSZACIVSA-N	439.563	1.699	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)/C=C\c3ccc(NS(C)(=O)=O)cc3)nc21	770957999	GJHOSLSCNFXUHX-YFHOEESVSA-N	445.505	1.815	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)CCN3C(=O)COc4ccccc43)nc21	770964401	ARMZGYUPAIJVPT-UHFFFAOYSA-N	425.449	1.546	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)NC1CCC(O)(c2cccnc2)CC1	771360014	WDSWTGQWNJFHIZ-UHFFFAOYSA-N	429.433	1.529	50	20	IDGD	
O=C(COC(=O)Cc1ccccc1I)NNC(=O)c1ccccc1	771393879	CJROSNLOZPDNMA-UHFFFAOYSA-N	438.221	1.838	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)C1CCN(S(=O)(=O)c2ccc(C)c(C)c2)CC1	771944167	QPHOWIACWBOPTE-HNNXBMFYSA-N	439.534	1.193	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)C1CCN(C(=O)c2cc(Cl)ccc2OC)CC1	771995773	XLIGCVUGYBFRHZ-GFCCVEGCSA-N	439.896	1.690	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)c2cnn(CC(=O)NC3CCCC3)c2)c1C	772043351	RPSLHTOAQUVCQG-MRXNPFEDSA-N	427.505	1.787	50	20	IDGD	
CCS(=O)(=O)c1cccc(S(=O)(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)c1	773252637	VTPCORNVJFDMRN-LBPRGKRZSA-N	446.934	1.911	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2ccc(Cc3nnc4n3CCCCC4)cc2)n1	773723802	FJRDQYISZGMHQG-UHFFFAOYSA-N	436.476	1.476	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)OCC(=O)N2	774002257	PAKVUMJNKOVZPN-JTQLQIEISA-N	432.820	1.224	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)NC[C@@H]2CC[C@@H](C(=O)N(C)C)O2)cc1Cl	774773215	WLHFAGDSYIBSLE-GWCFXTLKSA-N	443.888	1.329	50	20	IDGD	
C[C@H](NS(=O)(=O)c1ccc(C(N)=O)cc1)C(=O)NNc1ncc(Cl)cc1Cl	775271785	QYXPVSCRQQNOOA-QMMMGPOBSA-N	432.289	1.297	50	20	IDGD	
COC(=O)N1CCC([C@H](C)NC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)CC1	776921368	KVBRIMVTKSWPNU-ZDUSSCGKSA-N	430.465	1.389	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)c1ccc(Br)cc1-n1cncn1	778440961	MYDDXQXRTNZGOJ-UHFFFAOYSA-N	439.270	1.316	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)[C@@H](O)Cc1cccc(C(F)(F)F)c1	779047773	FYYSJHCTBMHJAS-HNNXBMFYSA-N	443.809	1.726	50	20	IDGD	
Cc1nn(C)c(-n2cccn2)c1C(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	779414955	XYFMLVVDCCKHAV-UHFFFAOYSA-N	446.512	1.164	50	20	IDGD	
COc1ccc(C)cc1N1C[C@@H](C(=O)NNC(=O)CCNC(=O)OC(C)(C)C)CC1=O	780974356	VKWHTKULTYFJEE-AWEZNQCLSA-N	434.493	1.419	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)N[C@H](C)C2=CCN(C)CC2)c2ccccc2c1=O	781396734	QVADCAZRNWFANN-OAHLLOKOSA-N	426.521	1.791	50	20	IDGD	
CCS(=O)(=O)c1ccc(Br)c(C(=O)NNC(=O)Cn2nc(C)cc2C)c1	781667954	AJNAHWDPLPUXHG-UHFFFAOYSA-N	443.323	1.517	50	20	IDGD	
CS(=O)(=O)CC[C@H](NC(=O)c1ccccc1Cl)C(=O)NNc1ncncc1Cl	781819258	AESXOIQOXCOGPN-ZDUSSCGKSA-N	446.316	1.460	50	20	IDGD	
CCC(CC)NC(=O)[C@H]1CN(C(=O)C(=O)NNc2ccc(OC)cn2)c2ccccc2O1	782145402	HXKBHFZVKDKAEL-GOSISDBHSA-N	441.488	1.632	50	20	IDGD	
CCOc1ccc(/C=C(\C#N)C(=O)O[C@H](C(=O)N[C@H]2CCS(=O)(=O)C2)C(C)C)cc1	782452190	ZXTIAPHVJPXDPF-ZXPBOQFXSA-N	434.514	1.863	50	20	IDGD	
CC(=O)N1CCN(C(=O)[C@H](OC(=O)/C(C#N)=C\c2cc(C#N)n(C)c2C)C(C)C)CC1	782627732	JRECOFGITNOQEJ-JZVSFUAJSA-N	425.489	1.371	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)c(Cl)c1	782897009	LGLJIEQWKBVBLG-UHFFFAOYSA-N	437.909	1.650	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ccc(F)cc2F)cc1-n1nnnc1C1CC1	783339491	DUBBUAQPPIBMPE-UHFFFAOYSA-N	429.387	1.908	50	20	IDGD	
CCN1CCN(Cc2ccc(NC(=O)C(=O)NNC(=O)Nc3ccccc3C)cc2)CC1	783416808	AXGMBQUVLIZRFP-UHFFFAOYSA-N	438.532	1.924	50	20	IDGD	
CC[C@@H](C)NS(=O)(=O)c1cccc(NC(=O)C(=O)NNC(=O)Nc2ccccc2C)c1	783417186	MZPWXXPIRYEKBQ-CQSZACIVSA-N	447.517	1.863	50	20	IDGD	
CCS(=O)(=O)c1cc(F)ccc1NC(=O)C(=O)NNc1ccnc(Br)c1	784837000	GFUWQBRPFARGLR-UHFFFAOYSA-N	445.270	1.859	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)C(=O)Nc2ccc3nc(N4CCOCC4)oc3c2)c1	784851464	BEPPTHWBABKPAI-UHFFFAOYSA-N	439.428	1.533	50	20	IDGD	
Cn1ccnc(NNC(=O)C(=O)Nc2cccc(-c3cn(Cc4ccccc4)nn3)c2)c1=O	785089546	BMKDRAULLKSZLD-UHFFFAOYSA-N	444.455	1.169	50	20	IDGD	
O=C(Cc1cccc(N2CCCC2=O)c1)NNC(=O)C(=O)NCc1ccc(Cl)cc1	785231325	GLBKVDNKTSPJIE-UHFFFAOYSA-N	428.876	1.473	50	20	IDGD	
COC(=O)c1scc(C)c1S(=O)(=O)NNC(=O)c1cc(OC)c(OC)c(OC)c1	785479795	BBALUVAVBJIHOH-UHFFFAOYSA-N	444.487	1.492	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1ccc(Oc2cccc(F)c2F)nc1	786097735	YWPRGCJXWFCBOI-VIFPVBQESA-N	429.405	1.243	50	20	IDGD	
Cc1nn([C@@H]2CCS(=O)(=O)C2)c(C)c1/C=C(\C#N)C(=O)NCc1ccc([N+](=O)[O-])cc1	787148140	RTIIAGDGRUBABT-QJKHOBJASA-N	443.485	1.991	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)C(C)(C)OC(C)=O)c2)cc1	788631306	VSTFEECZVIFHPH-UHFFFAOYSA-N	449.485	1.599	50	20	IDGD	
CS(=O)(=O)c1cc(C(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)ccc1F	792451602	OPZQVHMRCDSWKO-UHFFFAOYSA-N	428.825	1.501	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)C2=CCOCC2)c1	792773728	WOXXUGBEBBIYJF-UHFFFAOYSA-N	431.470	1.604	50	20	IDGD	
COc1ccc(Cn2cc(NC(=O)C(=O)NNC(=O)COc3ccc(F)cc3)cn2)cc1	793021827	LNYHKRUASVYSGD-UHFFFAOYSA-N	441.419	1.244	50	20	IDGD	
CN(CCNC(=O)NNC(=O)c1c[nH]c2ccccc12)S(=O)(=O)c1ccc(F)cc1	798098066	MXZJTMNXNNGKAJ-UHFFFAOYSA-N	433.465	1.572	50	20	IDGD	
CSCC[C@@H](NC(=O)c1ccc2ccccc2n1)C(=O)NNC(=O)NCC(F)(F)F	798315495	VSTNFUGQLHNDCU-CQSZACIVSA-N	443.451	1.979	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)NCC2(OCCO)CCOCC2)N(C)c2ccccc21	800669583	RPLOHJCFICNGLB-UHFFFAOYSA-N	442.516	1.331	50	20	IDGD	
CCOc1ccccc1[C@H](CC(=O)NNC(=O)C(=O)Nc1ccc(C)cc1)NC(C)=O	801110035	LXRSJZYSCXADJD-SFHVURJKSA-N	426.473	1.747	50	20	IDGD	
Cc1c(C(=O)NNC(=O)N=c2cc[nH]cc2)nnn1C1CCN(C(=O)OC(C)(C)C)CC1	802035736	ICOKCHASNOYVOE-UHFFFAOYSA-N	444.496	1.442	50	20	IDGD	
CC(C)(C)OC(=O)N1CSC[C@H]1C(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	802067221	QBZBHXKDZFYLND-ZDUSSCGKSA-N	444.535	1.553	50	20	IDGD	
O=C(CCNS(=O)(=O)/C=C/c1ccccc1)NNC(=O)Nc1ccc2c(c1)OCO2	802100698	YLTWQWRZDNYOIC-PKNBQFBNSA-N	432.458	1.548	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)NC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1	802338166	UKTDBJCPJJFPHD-QGZVFWFLSA-N	428.420	1.663	50	20	IDGD	
O=C(NCCCCN1CCN(Cc2ccccc2)CC1)NNc1ccc(-n2ccnc2)nn1	804967831	JEHRLFRYUMHFNF-UHFFFAOYSA-N	449.563	1.886	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)C(=O)Nc1cccc(-c2ccccc2)c1	806975914	UMXGXVRCWGNCOP-UHFFFAOYSA-N	427.424	1.729	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)C(=O)CC(C)(C)O3)c1O	806977429	JFTOJHHUGGXZCW-UHFFFAOYSA-N	427.413	1.544	50	20	IDGD	
COc1ccc([C@H](CNC(=O)NNC(=O)COc2cccc(C)c2)N2CCOCC2)cc1	806998491	KPWFOILTZILJDC-NRFANRHFSA-N	442.516	1.786	50	20	IDGD	
COc1cc(NNC(=O)C(=O)Nc2cc(CS(C)(=O)=O)ccc2OC)ccc1Cl	807068147	FVBZHPJTKBPYOM-UHFFFAOYSA-N	441.893	1.984	50	20	IDGD	
CC[C@@H](C)N[C@@H](CNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)c1ccco1	807439980	BFFYVFJHRBKZOD-WBVHZDCISA-N	429.525	1.746	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)Nc2cc(N(C)C)ncn2)c2ccccc2c1=O	810219214	OMGDXVHWYJFSGC-UHFFFAOYSA-N	438.492	1.909	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)nn1C1CCCCC1	810384239	HSRVNGLQDOXSFT-UHFFFAOYSA-N	427.461	1.868	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)N[C@@H](C)c2noc(COC(C)C)n2)nc1	812645026	ZRVLBSOKFWNVOZ-LBPRGKRZSA-N	441.514	1.464	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NC[C@H]2CCN(c3ccccc3F)C2)c2ccccc2c1=O	813207213	GKAFWSXGWQSBFU-CQSZACIVSA-N	438.463	1.543	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)CNC(=O)c1ccco1)c1ccc(N2CCCOC2=O)cc1	814294872	OSQAEKYHSSIYMH-ZDUSSCGKSA-N	429.433	1.448	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NN=C(C)c2ccc(S(=O)(=O)CC(N)=O)cc2)cc1	814747080	IGJAKFXNWNXVFP-HNNXBMFYSA-N	447.513	1.652	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NN=C(C)c2ccc(S(=O)(=O)CC(N)=O)cc2)cc1	814747082	IGJAKFXNWNXVFP-OAHLLOKOSA-N	447.513	1.652	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1nc(CC(F)(F)F)cs1	815568172	XINHKKOYICBMOJ-UHFFFAOYSA-N	430.364	1.419	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)N(C(=O)Cc1ccccc1)CC2	815569469	VJQKXHNLPWWLKU-UHFFFAOYSA-N	446.467	1.250	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCc2nncn2C1)C(=O)Nc1ccc(C(F)(F)F)cc1Cl	815691391	OVFYRLNLSMAHTP-MRVPVSSYSA-N	430.774	1.299	50	20	IDGD	
O=C(CNC(=O)[C@H]1c2ccccc2C(=O)N1Cc1ccccc1)NNc1ncncc1F	817077975	VBGRUUTWSRUVIB-LJQANCHMSA-N	434.431	1.572	50	20	IDGD	
O=C(Cc1ccc(Cl)cc1)NNC(=O)[C@@H]1CC(=O)N(c2ccc3c(c2)OCCO3)C1	913156732	FCHZPOBJSMCQAR-CQSZACIVSA-N	429.860	1.854	50	20	IDGD	
COc1ccccc1NC(=S)NNC(=O)CSc1ccc(C(N)=O)cc1[N+](=O)[O-]	913441075	SNHDVHJSVUGEFI-UHFFFAOYSA-N	435.487	1.812	50	20	IDGD	
C=CCNS(=O)(=O)c1ccc(C(=O)NNC(=O)COc2ccccc2OCC)cc1	913455036	DFLOYBITAVRDRL-UHFFFAOYSA-N	433.486	1.390	50	20	IDGD	
O=C(NNc1ncccn1)[C@@H]1Cc2ccccc2CN1S(=O)(=O)c1ccc(F)cc1	914756861	CFNGUTXTSLAPLZ-SFHVURJKSA-N	427.461	1.875	50	20	IDGD	
CC(=O)N1CCN(CCNC(=O)/C(C#N)=C\c2cc(C)n(C[C@H]3CCCO3)c2C)CC1	915624775	QHGBCIRKZLOFJL-ZPWPBLDLSA-N	427.549	1.471	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)ccc1=O	915671290	PBKABRYFJNKYGJ-UHFFFAOYSA-N	429.440	1.162	50	20	IDGD	
CCN(CC)CCCNC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	915888645	FMZNVNVNLAIHKH-UHFFFAOYSA-N	425.555	1.147	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)N[C@H](CN1CCOCC1)c1ccccc1	916214618	ROTNEBXQOGAYOG-XLIONFOSSA-N	426.473	1.230	50	20	IDGD	
CSCC[C@H](NC(=O)NNC(=O)COc1ccccc1C#N)c1nnc2ccccn12	916223749	PYJLGZTZTQIFIX-HNNXBMFYSA-N	439.501	1.805	50	20	IDGD	
CNS(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2cc(C)nc3ccccc23)s1	916232910	OIOKYUAUYOJXQS-UHFFFAOYSA-N	433.515	1.657	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)NCc2ccc(-n3cncn3)nc2)cc1	916395071	AEWHTFNLLMFVSI-AWEZNQCLSA-N	425.449	1.359	50	20	IDGD	
Cc1ccc(C(=O)N2CCN(CC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)CC2)cc1F	917154807	OAOQJDHRKNGBEN-UHFFFAOYSA-N	443.435	1.261	50	20	IDGD	
CCCn1nc(C(=O)NNS(=O)(=O)c2c(C)cccc2[N+](=O)[O-])c2ccccc2c1=O	917721727	FYIGBFBBWBLFHM-UHFFFAOYSA-N	445.457	1.646	50	20	IDGD	
CNC(=O)COc1cccc(CNC(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)c1	918095783	GRJDCOCQSKIWCA-MRXNPFEDSA-N	428.489	1.726	50	20	IDGD	
CNC(=O)NNC(=O)c1cc(S(=O)(=O)N(C)c2ccccc2OC)ccc1Cl	919879918	PBXBHZCXSGBLGI-UHFFFAOYSA-N	426.882	1.748	50	20	IDGD	
NC(=O)c1ccc(/C=C/C(=O)N2CCC[C@H]2C(=O)NNC(=O)NC2CCCCC2)cc1	920029496	DUZRVRCRHVNONN-HGZMWJMZSA-N	427.505	1.453	50	20	IDGD	
C#CCNC(=O)/C(C#N)=C/c1cn(CCC(N)=O)nc1-c1ccc(Br)cc1	920848311	AFNSRUZGXZUNBD-GXDHUFHOSA-N	426.274	1.844	50	20	IDGD	
O=C(CCCNS(=O)(=O)c1ccc(F)cc1)NNC(=O)NCCc1cccs1	920889439	XUOYXZCGTQNBJM-UHFFFAOYSA-N	428.511	1.519	50	20	IDGD	
O=C(CCCNS(=O)(=O)c1ccc2c(c1)CCCC2)NNC(=O)NCc1ccco1	920889639	DPMVBYMFFUFRRD-UHFFFAOYSA-N	434.518	1.748	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2cncn2-c2ccccc2)cnn1CCO[C@H]1CCCCO1	1116388309	GPGMJHBQDUACOE-FQEVSTJZSA-N	438.488	1.995	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2ccc(OC)c(S(=O)(=O)N3CCCC3)c2)cc1	1321342985	FVAHMYAIQQFVMX-UHFFFAOYSA-N	448.501	1.955	50	20	IDGD	
CS(=O)(=O)c1ccc(CNC(=O)NNc2nncc(N)c2Cl)cc1C(F)(F)F	1322129392	HVBZIZZEUUPZMR-UHFFFAOYSA-N	438.819	1.961	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@H]2COc3ccc(F)cc3C2)cc1	1323110425	AXMZICOMFFUPEM-OAHLLOKOSA-N	435.477	1.153	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@H]2CC23CCS(=O)(=O)CC3)cc1Br	1323348429	WYMZLZCDDSDRJI-LLVKDONJSA-N	431.308	1.434	50	20	IDGD	
O=C(NCc1ccccc1CN1CC[C@H](O)C1)NNC(=O)c1cncn1-c1ccccc1	1342097531	GTCAVDWXTGDEHK-FQEVSTJZSA-N	434.500	1.583	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)NCCC(=O)N2CCC[C@H](C)C2)c2ccccc2c1=O	1346759459	DEMDMXPJZNHXPD-HNNXBMFYSA-N	442.520	1.570	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnc4ncccn34)C2)C1	1777930962	BHZAKHYCQWPETG-MSOLQXFVSA-N	426.304	1.409	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(CN(C(=O)CC3CC3)CCO2)C1	1780096709	FVXZDVSNJCJGBS-NRFANRHFSA-N	431.445	1.764	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)n(C(F)F)n1	1780312738	FQUKPJADMFWDPI-IAQYHMDHSA-N	439.232	1.721	50	20	IDGD	
COc1ccc(CCC(=O)N2CCO[C@]3(CCN(C(=O)[C@H](F)Br)C3)C2)cn1	1781325328	BPMICCWYRZLEFL-FUHWJXTLSA-N	444.301	1.543	50	20	IDGD	
O=C(c1ccc2nonc2c1)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781330077	PSVZYZIASOVPOK-CZUORRHYSA-N	427.230	1.357	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(Cl)c(F)c3)C2)C1	1781537498	RNHPCGMTWNTLGA-FQEVSTJZSA-N	440.903	1.296	50	20	IDGD	
CN(C)[C@H](C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2)c1ccccc1Cl	1782829396	IGFQYARQPUUBBA-ABSDTBQOSA-N	444.359	1.372	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)Cc3csc(C)n3)CCO2)C1	1783343881	KGBDXDLKENZCRZ-WMLDXEAASA-N	430.368	1.997	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)C1(Br)CC1)CCO2	1783354203	WNAYVMTZGIQTRF-BXUZGUMPSA-N	438.160	1.917	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)CSc3ncccn3)CCO2)C1	1783533499	YFZREYNJOCZZIX-LRDDRELGSA-N	429.340	1.182	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cc(C)ccc3-n3ccnn3)CCO2)C1	1783883966	XIMCVLLJASVFOZ-DYESRHJHSA-N	447.923	1.273	50	20	IDGD	
O=C(C(Cl)Cl)N1CC[C@@]2(C1)CN(C(=O)[C@@H]1CC(=O)N(C3CCCC3)C1)CCO2	1783942954	QKXFUSUGNNBEOU-BFUOFWGJSA-N	432.348	1.411	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CO[Si](C)(C)C)C[C@@H]21	1783967232	QLXONZXIQIITJO-AJNGGQMLSA-N	435.435	1.849	50	20	IDGD	
O=C(CCCc1ccccc1F)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21	1784063966	XMZNNUPCMJVYHB-CAMMJAKZSA-N	426.916	1.728	50	20	IDGD	
Cc1noc(C)c1CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21	1785361876	JHBSZINIUMMYKT-QEWYBTABSA-N	446.317	1.894	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCO[C@@]2(CCN(C(=O)C3CC(=O)C3)C2)C1	1785408898	ACWYBIQHSKKCIX-QESPPMFYSA-N	429.423	1.681	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)c3ccccc3)[C@H]2C1	1786669162	OMHQXNAZVKZQFU-ATIWLJMLSA-N	439.350	1.873	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCC#N)[C@H]2C1	1786701044	HLIPGRKGGNPLKQ-VGWMRTNUSA-N	442.944	1.402	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4n[nH]cc4c3)[C@H]2C1	1787301767	DDZOJHGYGYENOZ-VXAPYIKBSA-N	435.322	1.940	50	20	IDGD	
CC(C)(C)OC(=O)N1CC=C(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]3C2)C1	1787443620	OXJKMFSTJGHJLC-YHUYYLMFSA-N	445.919	1.678	50	20	IDGD	
O=C(CCN1Cc2ccccc2C1=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21	1788148671	OZSFKRIPJYRJGO-XPYUAMARSA-N	437.899	1.547	50	20	IDGD	
COc1cccc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]3C2)n1	1788765808	SGLNLKYJBXLITF-SZMVWBNQSA-N	435.597	1.464	50	20	IDGD	
CCOC(=O)N[C@@H](O)C(=O)Nc1ccc(C2(NC(=O)[C@@H](Cl)COC)CCC2)cc1	1789408503	HYEXHLINERQWFC-YOEHRIQHSA-N	427.885	1.439	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ncc(Cl)cn3)C[C@@H]21)[C@H](F)Br	1789922525	OISOWKRFHHHGIT-VGDYDELISA-N	435.681	1.414	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C(\C)NC(C)=O)C[C@@H]21	1790964647	VZKLOQPZUIHFDC-XIPWXWJTSA-N	430.343	1.180	50	20	IDGD	
O=C(/C=C/c1ccc(O)c(O)c1O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21	1792219536	XURCUZAGDOYYPZ-FGLOERETSA-N	428.844	1.331	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1n[nH]c3cc(Cl)ccc13)C2)[C@H](O)CCl	1792981841	XPLWTGMYRYXKAB-ANGCBRKESA-N	427.288	1.019	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCNC(=O)OC(C)(C)C)C2	1793456051	WMAOAHKBZVUXCD-JYYAWHABSA-N	431.961	1.898	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](CCN)NC(=O)OC(C)(C)C	1796030812	PDYRFZJOIMHGOP-YIDVYQOGSA-N	430.977	1.884	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCc1cccnc1	1796312158	FWKMASGQDLZVGQ-INZAXJFKSA-N	436.516	1.786	50	20	IDGD	
COc1cc(C#N)cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CO[Si](C)(C)C)c1	1797957550	NAWXTDCNEJGUTP-XEMDLRDOSA-N	431.565	1.622	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2c(s1)CCCC2)c1cccc(B(O)O)c1	1798038413	RKMAUFPEASWTIS-REPLKXPHSA-N	438.358	1.872	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc([N+](=O)[O-])cc1F)C2	1799271748	BELVVFWJUZKWHO-ZFHGCVPZSA-N	427.860	1.883	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)nc(Cl)c1)C2	1799276469	IXONAHVYTOVILD-KOZDUTSQSA-N	436.723	1.880	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@](C)(Cl)CCl)n1	1799277471	SEMCLZUQBAGJMP-UESRRSCYSA-N	443.331	1.480	50	20	IDGD	
Cc1ccc(C)n1-c1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](O)CCl)C3)cc1	1799620543	ZQLMLIVAKUSVRR-KOUHRCEDSA-N	445.947	1.897	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cn1nccn1)[C@H](Br)Cc1ccccc1	1800248461	IBAWORKLIIYIRF-XMTFNYHQSA-N	446.349	1.923	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cnc3ccccn13)C2	1800638025	MBZLKYMGOHGKDS-MVWRLGRASA-N	449.349	1.640	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Oc1cccnc1)C2	1800644241	OUDJCZPGMJCRQM-BIYBGRMPSA-N	440.338	1.612	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](CCO)NC(=O)OC(C)(C)C)C2	1802271185	ZBLOZVCJRDBFKE-JKJDWNRSSA-N	447.960	1.154	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2nc3ccccc3[nH]2)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803139493	PZKYYMRTWDEDRP-JCGIZDLHSA-N	427.892	1.877	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cc3ncsc3[nH]2)[C@@H]1c1cccnc1)[C@H](O)CCl	1803142527	DZLIMJAXQSWTCA-APHBMKBZSA-N	433.921	1.939	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cnc3ccc(F)cn23)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803147450	HTHRTTKAEBZTJH-UCLAIMLFSA-N	445.882	1.788	50	20	IDGD	
Cc1nnc(CCC(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)s1	1804554658	GNZCJKWIKKYLQD-MPGHIAIKSA-N	437.953	1.480	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H]2C[C@H]2C2CC2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807361286	WNPBXWHZADEXJZ-UVUJQTEASA-N	433.317	1.127	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC2(CCCN(C(=O)c3conc3C)C2)CC1	1808544667	MCZDHUDXKGHYDI-LFVJCYFKSA-N	440.504	1.962	50	20	IDGD	
O=C1CC[C@H](C(=O)N2CC[C@H](CNC(=O)[C@H](F)Br)[C@H]2c2cccnc2)CN1	1808648738	BDLWFRYOYVDJGG-CLWVCHIJSA-N	441.301	1.304	50	20	IDGD	
Nc1ccccc1/C=C/C(=O)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1	1809966952	OAEAJZMZOAJRQF-DHZHZOJOSA-N	447.344	1.507	50	20	IDGD	
O=C(C#Cc1ccccc1)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1	1809967692	FMQIRISBFDOJEE-UHFFFAOYSA-N	430.313	1.263	50	20	IDGD	
Cn1ccc(CC(=O)N2CC[C@H](CNC(=O)CO[Si](C)(C)C)[C@@H]2c2cccnc2)n1	1810542740	XPKDPDMTSGCCIZ-UTKZUKDTSA-N	429.597	1.915	50	20	IDGD	
Cc1cc(C(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)nc2nccn12	1812167961	NHSUYODZNFBXRX-CGTJXYLNSA-N	442.907	1.352	50	20	IDGD	
COc1cc(C(=O)N2CC[C@H](CNC(=O)C(Cl)Cl)[C@H]2c2cccnc2)n(C)n1	1813077057	GFEFJBRKIWRSEH-IUODEOHRSA-N	426.304	1.947	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)C2CC(O)C2)n[nH]1	1814800662	UHANOZBSSCHUKA-BKEKHZTHSA-N	441.492	1.307	50	20	IDGD	
CC[C@@H](NC)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1)CC2	1815306649	LIWGXLJWYJNKFI-UZGQRAPBSA-N	445.549	1.187	50	20	IDGD	
COc1ccccc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1820438465	OTHWJZOXGHGXEQ-LJQANCHMSA-N	448.288	1.718	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)c3ccoc3Cl)sc2C1	1821815866	PPMSHAIYSDKVEH-SNVBAGLBSA-N	439.925	1.988	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)CSCC(=O)OC)CC1	1824518139	YUAUGSTVICPFEE-JKSUJKDBSA-N	434.986	1.766	50	20	IDGD	
CC[C@H](C)[C@H](O)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1	1824547683	IASLFZYPVKOUOD-NDXORKPFSA-N	430.354	1.007	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)C2=CCCS2)CC1	1824563929	NTCXAXARZDWTKZ-IBGZPJMESA-N	428.363	1.621	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)COc1cccnn1)CC2	1825648079	XVMAPKZKNPBBBJ-NXEZZACHSA-N	440.323	1.708	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)COc1cccnn1)CC2	1825648082	XVMAPKZKNPBBBJ-ZJUUUORDSA-N	440.323	1.708	50	20	IDGD	
O=C(c1cnc(O)nc1O)N1CCC([C@H]2CCCCN2C(=O)CCBr)CC1	1826357256	SRSLQPFMBBYNTB-CQSZACIVSA-N	441.326	1.906	50	20	IDGD	
CCOCC(=O)N1CCCC[C@H]1C1CCN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)CC1	1826455244	ZIMWQFUEGXFXGX-JWGRYVKWSA-N	431.537	1.777	50	20	IDGD	
C[C@@H](C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCBr)CC2)n1cnnn1	1826971656	ITZSLNUKIDLSMX-DTWKUNHWSA-N	428.316	1.088	50	20	IDGD	
CCC(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)[C@H](O)CCl)C2)C1	1828824079	UENHFXHYPDPXLG-DYESRHJHSA-N	437.924	1.448	50	20	IDGD	
C[C@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1)C1(O)CCC1	1831870173	SDSSEOJFEHGLRY-IEBWSBKVSA-N	436.597	1.530	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1)[C@H]1CCCCO1	1833112967	RJUQKEWKAQKHSD-CVEARBPZSA-N	434.350	1.818	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cccnc3Cl)CC2)CC1)[C@H](O)CCl	1833307391	RULGDTGODHTAQR-MRXNPFEDSA-N	429.348	1.520	50	20	IDGD	
CC(=O)NC(C)(C)C(=O)NC1CCN(C2CCN(C(=O)[C@](C)(Cl)CCl)CC2)CC1	1833486662	QQJANYLXUUMZHW-HXUWFJFHSA-N	449.423	1.709	50	20	IDGD	
CCOC(=O)/C=C/C(=O)NC1CCN(C2CCN(C(=O)[C@@](C)(Cl)CCl)CC2)CC1	1834406924	XLPJVISPMHQEPW-SGSXCFNPSA-N	448.391	1.914	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC1CCN(C2CCN(C(=O)CN3CCCC3=O)CC2)CC1	1835833538	OWWBABDCOIBAFI-UHFFFAOYSA-N	438.645	1.032	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1)c1cc(O)no1	1835975075	RZVYLGXXHXVXMS-UHFFFAOYSA-N	429.315	1.350	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)C(OC)OC)CC2)CC1	1836790515	JGWIVWDFFIAKGQ-OAHLLOKOSA-N	435.359	1.777	50	20	IDGD	
Cc1ccn(CC(=O)N2CCC(OC3CCN(C(=O)[C@H](F)Br)CC3)CC2)n1	1837192065	XLEMNZCHCQHEKQ-KRWDZBQOSA-N	445.333	1.881	50	20	IDGD	
NC(=O)c1ncccc1C(=O)N1CCC(OC2CCN(C(=O)C(Cl)Cl)CC2)CC1	1837249886	ATNRDRAJRALMKY-UHFFFAOYSA-N	443.331	1.596	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc4ccccn34)C2)C1	1837713317	VQNDDRHQNPBVRS-OAQYLSRUSA-N	446.580	1.256	50	20	IDGD	
COC(=O)c1ccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)s1	1839035053	UICDRHHLPPLPMN-QAPCUYQASA-N	448.900	1.068	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3cncc(OC)c3)C2)C1	1839142416	NVHVHPZJFPTDCA-RXVVDRJESA-N	439.940	1.497	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3c(C)nc4ccccn34)C2)C1	1839144444	ACJZHGZMYOPNDC-HRAATJIYSA-N	434.924	1.730	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(NC(C)=O)c3)C2)C1	1839148882	MNBPURZRJBWOLA-RXVVDRJESA-N	437.924	1.732	50	20	IDGD	
Cc1cccc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)n1	1839150791	XQPPGTBALXOPBX-WOJBJXKFSA-N	444.359	1.625	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)/C=C/C3CCCC3)CCO2)C1	1839179487	GRWOEWBNFRNEFJ-YFKVXENWSA-N	429.355	1.973	50	20	IDGD	
C=CC[C@H](C(=C)C)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](F)Br)CCO2)C1	1839201161	YIYCOTHQRKRGCZ-VKJFTORMSA-N	433.318	1.902	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccccc3F)C2)C1	1840151674	KGUGOVCTMYRJCG-OXJNMPFZSA-N	428.888	1.078	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)CC[C@H]3CCOC3)CCO2)C1	1840589855	VPUHULIXPIJHAO-ZYSHUDEJSA-N	437.364	1.496	50	20	IDGD	
C/C(=C\c1cccs1)C(=O)N1CCCC12CN(C(=O)c1cnccc1C(=O)NN)C2	1841038070	CKDYTSYQSLOUGZ-GXDHUFHOSA-N	425.514	1.667	50	20	IDGD	
CC(C)[C@@H](C(=O)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1)N1Cc2ccccc2C1=O	1841348142	LTLPDBLBTJHOIM-ROUUACIJSA-N	433.936	1.470	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@](C)(C(=O)N2CC3(CCCN3C(=O)[C@@H](O)CCl)C2)C1	1841351297	KRQZGXJKBWWBFE-IFXJQAMLSA-N	429.945	1.437	50	20	IDGD	
COc1cnc(C(=O)N2CCCC23CN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C3)c(F)c1	1842272444	ODPDTALLMAYARL-DHRITJCHSA-N	442.451	1.180	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2cc(F)cnc2Cl)C1	1844432721	YYFJIZZLEKJNRC-UHFFFAOYSA-N	432.843	1.003	50	20	IDGD	
Nc1c(C(=O)N2CC3(CCCN3C(=O)[C@@H](F)Br)C2)sc2nccnc12	1845217201	KZXIUUDYOCRFFE-LLVKDONJSA-N	428.287	1.781	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)CCOCCOCCOCCOC)C1	1845246084	GCKCHMPADCBVLR-QGZVFWFLSA-N	434.961	1.294	50	20	IDGD	
Cc1c(C(=O)N2CCCC23CN(C(=O)CCC(=O)NN(C)C)C3)nc2ccc(Cl)cn12	1845699177	CDNUZXJIKFOFIA-UHFFFAOYSA-N	446.939	1.486	50	20	IDGD	
CC(=O)NCC(=O)N1CCCC12CN(C(=O)/C(C#N)=C/c1ccc(Br)cc1)C2	1845992023	YBGYBGACWJEPEP-CXUHLZMHSA-N	445.317	1.696	50	20	IDGD	
Cc1ccc2[nH]cc(CC(=O)N3CC[C@H]4[C@@H]3CCN4C(=O)c3cnccc3C(=O)NN)c2c1	1848143255	KXQCRNICHDWGHN-SFTDATJTSA-N	446.511	1.533	50	20	IDGD	
COc1cc(C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)ccc1OC(F)F	8854237	NZCQBHSTBQQPNA-UHFFFAOYSA-N	439.327	1.823	50	20	IDGD	
O=C(Cn1ccc(=O)[nH]c1=O)NNC(=O)c1cc(-c2ccc(Cl)cc2)nc2ccccc12	17360774	LRZRODPDMQFCON-UHFFFAOYSA-N	449.854	1.866	50	20	IDGD	
Cc1noc(C)c1CC(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	17633379	YQQSHBCPYQWDKL-UHFFFAOYSA-N	431.456	1.997	50	20	IDGD	
Cc1ccc([C@@]2(C)NC(=O)N(CC(=O)NNC(=O)c3cc(-c4ccccc4)on3)C2=O)cc1	27264740	ATSLJTPZIAZJFH-HSZRJFAPSA-N	447.451	1.878	50	20	IDGD	
CC(C)NC(=O)C(=O)NNC(=O)c1ccc(CNC(=O)C23CC4CC(CC(C4)C2)C3)cc1	46773295	JOHAONCSAUVLBV-UHFFFAOYSA-N	440.544	1.805	50	20	IDGD	
O=C(COC(=O)c1cc([N+](=O)[O-])ccc1N1CCOCC1)NNC(=O)c1ccccc1	104588267	GMLXNFLYHRBDQE-UHFFFAOYSA-N	428.401	1.049	50	20	IDGD	
N#Cc1ccc(CS(=O)(=O)CC(=O)NNC(=O)c2ccc(Br)s2)cc1	107920241	WIOWDYIHLBSDQU-UHFFFAOYSA-N	442.316	1.758	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@@H]1CCCN(C(=O)C(C)(C)C)C1	109076314	UJWLLGVFVLWYKQ-CQSZACIVSA-N	437.566	1.334	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2ccc3ccccc3n2)c(C(=O)OC)s1	726522270	UKXFSALAIUMTCL-UHFFFAOYSA-N	449.466	1.493	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)[C@@H]2CCCN2C(=O)c2ccc3c(c2)OCO3)c1	728208513	WLDFJKMDQCALBM-KRWDZBQOSA-N	440.456	1.288	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN1S(=O)(=O)c1cccs1)c1cccc(OC(F)F)c1	728486429	YVXADMLGVPDFPK-CYBMUJFWSA-N	445.469	1.964	50	20	IDGD	
CCn1c(CCNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)nc2ccccc21	728951652	JIBCITPIWJVDRG-UHFFFAOYSA-N	436.520	1.636	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)[C@H]1CCCN1S(=O)(=O)c1cccs1	729451925	JWSWIDILVQHEOI-MRXNPFEDSA-N	432.527	1.704	50	20	IDGD	
CC[C@@H](Nc1ccccc1)C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	729863178	OFWYHXZWDAHQLZ-HXUWFJFHSA-N	431.562	1.957	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)[C@H]1CCN(c2ccc3c(c2)OCCO3)C1=O	730515606	VTPUYSYFTRYTMJ-UKRRQHHQSA-N	443.431	1.565	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)CNC(=O)c2c(F)cccc2Cl)c2ccccc2c1=O	730584644	XPLHTHVPBHFHGT-UHFFFAOYSA-N	445.838	1.400	50	20	IDGD	
O=C(CCCSc1ccc(Br)cc1)NNC(=O)[C@H]1CCS(=O)(=O)C1	730958810	BIVLTTKJFVGEDR-NSHDSACASA-N	435.365	1.904	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])o2)cc1C	731874749	SQFQRXFHPNYEFM-HNNXBMFYSA-N	430.417	1.636	50	20	IDGD	
O=C(NCc1ccc(F)cc1)c1nccnc1C(=O)NNc1nc(-c2cccnc2)no1	732110531	DEQAHMXPSHNTOJ-UHFFFAOYSA-N	434.391	1.748	50	20	IDGD	
CNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2ccc(OC)c(Br)c2)cc1	732174736	CKEMMNJFJDUONM-UHFFFAOYSA-N	442.291	1.441	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)c2nn(-c3ccc(F)cc3)c3c2CCC3)C[C@@H](C)O1	732261656	OECKOHFXYYIMOG-HUUCEWRRSA-N	429.496	1.760	50	20	IDGD	
Cc1cccc(-c2nnc(S)n2CCC(=O)NNC(=O)CCN2C[C@@H](C)O[C@H](C)C2)c1	732261873	GJWUNQLPASRXRJ-HZPDHXFCSA-N	446.577	1.579	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3nnc4ccccc4c3O)cc2)CC1	732285419	FHJPCLOGQFFGTE-UHFFFAOYSA-N	442.501	1.028	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)CC[C@H]2NC(=O)N(c3ccc(C#N)cc3)C2=O)c1	733774092	HGWDENUSJQHODB-GOSISDBHSA-N	449.467	1.607	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)sc1Br)C(=O)N1CCCC1	735039432	HFXYBGOYBLVAQD-UHFFFAOYSA-N	425.102	1.657	50	20	IDGD	
O=C(NCCNS(=O)(=O)c1ccccc1[N+](=O)[O-])NNC(=O)c1cccc(Cl)c1	735190256	LCEOPGJJPLDLCV-UHFFFAOYSA-N	441.853	1.171	50	20	IDGD	
CS[C@@H]1CCC[C@@H](NC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)C1	735385363	YHHQZRQRROAEJJ-HUUCEWRRSA-N	442.611	1.318	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN2Cc3c(OC)ccc(OC)c3[C@H](O)C2)cc1C	736308498	OGRJARXACYBIKG-CQSZACIVSA-N	433.530	1.946	50	20	IDGD	
O=C(COCc1ccccc1)NNS(=O)(=O)c1ccc(Br)c(C(=O)O)c1	737755880	HGONCZLBHOALQP-UHFFFAOYSA-N	443.275	1.674	50	20	IDGD	
C[C@H]1C[C@@H](C)CN(C(=O)CN2CCN(C(=O)NNC(=O)COCc3ccccc3)CC2)C1	738497287	RCZBPRNSSDRUQI-KDURUIRLSA-N	445.564	1.066	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@H]2C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	740843854	YUTIQVQHQMBQBU-INIZCTEOSA-N	441.492	1.461	50	20	IDGD	
COC(=O)c1cc(Cl)cc(S(=O)(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1	741649483	UELMDJKJDFWWLT-HNNXBMFYSA-N	426.834	1.276	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N[C@@H]2CC(=O)N(CCOc3ccccc3)C2)cc1OC	743520142	DMDXBMISCULXJA-MRXNPFEDSA-N	442.472	1.328	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NC[C@@H](O)c1cnn(C)c1	743521627	RCYXDBJYDLPXBN-QMTHXVAHSA-N	426.271	1.014	50	20	IDGD	
O=C(NCCCn1nc2n(c1=O)CCCC2)NNC(=O)Nc1ccc(OC(F)F)cc1	743557014	HZVNOTWMKYFPCN-UHFFFAOYSA-N	439.423	1.409	50	20	IDGD	
Cn1cc([C@@H](O)CNC(=O)NNC(=O)[C@H]2Cc3ccccc3CN2Cc2ccccc2)cn1	743574703	WKSOXADXCCWMOO-YADHBBJMSA-N	448.527	1.411	50	20	IDGD	
COc1ccc(C(C)=O)cc1CC(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	744621284	NQJAMSOFMFULEA-UHFFFAOYSA-N	447.513	1.605	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)c2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)c1	744845772	VOISDZBRFVADNZ-UHFFFAOYSA-N	437.412	1.922	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)[C@@H](c2ccccc2)N2CCSCC2)cc1	745087752	CCIVWPJSNAFPFH-HXUWFJFHSA-N	438.509	1.653	50	20	IDGD	
C[C@H]1C[C@H](NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)C(=O)N1c1ccccc1	745883403	TUNRXOSUPVEKBL-GUYCJALGSA-N	430.486	1.228	50	20	IDGD	
C[C@H]1OC(C)(C)N(C(=O)OC(C)(C)C)[C@H]1C(=O)NNC(=O)Cc1cn2ccccc2n1	746637361	MJDHDTGHOCNIEF-CXAGYDPISA-N	431.493	1.785	50	20	IDGD	
O=C(CCn1nnc2ccccc2c1=O)NNc1nc(-c2ccccn2)nc2c1CCC2	747983771	XOMBDXXMNKOODI-UHFFFAOYSA-N	428.456	1.666	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(C)c(C(=O)NNC(=O)c2cc3ccccc3o2)c1	749477091	QZXLFKAJPCSRNZ-UHFFFAOYSA-N	431.470	1.741	50	20	IDGD	
CC(C)(C)NC(=O)CN1CCC(CNC(=O)NNC(=O)COc2ccc(F)cc2)CC1	751111497	MWUFCXBLTYIMRE-UHFFFAOYSA-N	437.516	1.162	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)[C@@H]1CCCN(C(=O)c2ccc(Cl)cc2)C1	751206289	CCHQLGAINBIXSE-CQSZACIVSA-N	432.864	1.363	50	20	IDGD	
O=C(CCCc1nc(-c2ccc(F)cc2)no1)NNC(=O)CNC(=O)c1cccs1	751206786	UJRQXICWEWUTQS-UHFFFAOYSA-N	431.449	1.837	50	20	IDGD	
Nc1nc(Cl)cc(NNC(=O)[C@@H]2CC(=O)N(CCOc3ccccc3Cl)C2)n1	753454282	QREBHYFWHAHXOW-SNVBAGLBSA-N	425.276	1.736	50	20	IDGD	
CCNC(=O)C1(CNC(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)CCC1	753745048	DTPTZMRDOWCJJJ-UHFFFAOYSA-N	428.493	1.228	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2scnc2Br)cc1OC	754967437	ZPKPIIZVFFVXLG-UHFFFAOYSA-N	444.263	1.541	50	20	IDGD	
O=C(Cc1ccc([N+](=O)[O-])cc1Br)NNC(=O)[C@H]1COc2ccccc2O1	755037998	HWTTUASMIKVQME-OAHLLOKOSA-N	436.218	1.887	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@@H](C)[C@@H](C)NC(=O)OC(C)(C)C	755312373	DMPMXMRWLOZZMI-NWDGAFQWSA-N	441.554	1.598	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1ccnc(O[C@@H]2CCOC2)c1	755435209	QTZFMPITEJWLCN-MRXNPFEDSA-N	448.501	1.027	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)NC1CCN(S(=O)(=O)C(C)(C)C)CC1	755896985	GNNPQNVDBKYQPP-UHFFFAOYSA-N	446.957	1.885	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2ccc(F)c(C(=O)OC)c2)c2ccccc2c1=O	756053664	MRDFGSHYRHQCFV-UHFFFAOYSA-N	427.392	1.809	50	20	IDGD	
COC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2cc(C)oc2C)c1Br	756163087	FUOCPVCCMLKUGL-UHFFFAOYSA-N	438.234	1.845	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2ccc(OCC(=O)NC)cc2)c2ccccc2c1=O	756441071	HKCQUTJJBPAHFD-UHFFFAOYSA-N	438.444	1.008	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)ccc1N1C(=O)CCC1=O	756556349	NTHRBNOWSVUIRZ-UHFFFAOYSA-N	448.439	1.362	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(F)c(NC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1	756684440	OEXHEQMBEJSJJE-MRXNPFEDSA-N	438.437	1.069	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)N[C@H]1CCN(C(=O)CCc2ccccc2)C1	756917084	NJYGDSHBSSZAAD-SFHVURJKSA-N	434.500	1.820	50	20	IDGD	
CCCCN1C(=O)C[C@@H](C(=O)NNc2ccc(C(N)=O)nn2)[C@@H]1c1ccc(OC)cc1	757399202	MYCRRIXLSUAYGV-BEFAXECRSA-N	426.477	1.417	50	20	IDGD	
O=C(NCc1ccc2c(c1)CCS2(=O)=O)NNC(=O)c1cc(Br)c[nH]1	757721172	GBFUJKLIHXCFOW-UHFFFAOYSA-N	427.280	1.251	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)Nc1ccc(F)c(S(=O)(=O)NC2CC2)c1	757873138	HYISTTIRUXHBNP-UHFFFAOYSA-N	447.448	1.370	50	20	IDGD	
Cc1cnn(-c2ccc(C(N)=O)cc2NC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1	757875151	MAKMZNZYSYTQHQ-SFHVURJKSA-N	436.428	1.272	50	20	IDGD	
Cc1nn(CCC#N)c(C)c1CCC(=O)N1CCN(S(=O)(=O)CBr)CC1	758535749	RLTHGCNVUBUFPE-UHFFFAOYSA-N	446.371	1.173	50	20	IDGD	
Cc1nn(C)c2ncc(C(=O)NN(C)C(=O)N3CCN(C(=O)OC(C)(C)C)CC3)cc12	758786924	QLTUNPYPQBTCAI-UHFFFAOYSA-N	431.497	1.526	50	20	IDGD	
COc1cccc2c1CC[C@H]2NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	760207881	SBERKNGYWLQOAD-QGZVFWFLSA-N	432.502	1.577	50	20	IDGD	
CC[C@@H](NC(=O)NNc1ccc(-n2cccn2)nn1)[C@@H]1CN(Cc2ccccc2)CCO1	761795848	XLPDSQUOWWDUJW-MOPGFXCFSA-N	436.520	1.968	50	20	IDGD	
COc1cccc(N2CC[C@H](NC(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)C2)c1	763498549	QOMRCYXMRTXKPD-HNNXBMFYSA-N	435.525	1.909	50	20	IDGD	
COCCn1ncc2ccc(NC(=O)C(=O)NNC(=O)c3cc4ccccc4cc3O)cc21	763524258	YEYFWOYIJMMIDE-UHFFFAOYSA-N	447.451	1.941	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)C(=O)Nc1c(F)cc(Br)cc1F	763550573	FQLNDQROZOYYRH-UHFFFAOYSA-N	442.172	1.856	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)Nc1ccc2c(cnn2C(F)F)c1	763570605	FKOJCTCIILGHHA-OAHLLOKOSA-N	431.355	1.357	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)Nc1ccc(Cc2ccncc2)cc1	763575575	XTCINOGVKQUXMP-FQEVSTJZSA-N	432.436	1.598	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2cc(C)oc2C)cc1-n1nnnc1C1CC1	763584252	XIXXBTHHXJQLPQ-UHFFFAOYSA-N	439.432	1.158	50	20	IDGD	
CNC(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)COc2cc(C)ccc2C(C)C)cc1	763595680	BHCKAPSRHRNRTC-UHFFFAOYSA-N	440.500	1.572	50	20	IDGD	
O=C(NNC(=O)C12CC3CC(CC(C3)C1)C2)C(=O)Nc1ccc(-n2cncn2)c(F)c1	763736573	WLCOOPHYLAJEKF-UHFFFAOYSA-N	426.452	1.709	50	20	IDGD	
Cc1ccnn1-c1ccccc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccccc1F	763851579	UHYUOCQPJYYZIE-CQSZACIVSA-N	425.420	1.873	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccn(-c3ccccc3)n2)cc1	763861375	OSSHZKQRPPXCLE-HNNXBMFYSA-N	437.456	1.824	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)cc1C(=O)N(C)C	763865061	HRJVCBGIZLSCJB-CYBMUJFWSA-N	430.436	1.389	50	20	IDGD	
C=CCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)cc1	763867330	ZWGOEDNLYDOSIS-CYBMUJFWSA-N	428.420	1.295	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccn(-c2ncccc2F)n1	763873320	VNNHQZKOWYMENB-LLVKDONJSA-N	430.371	1.099	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2c[nH]nc2-c2ccccc2)cc1	763875842	BJZUULHVYAQVGQ-CQSZACIVSA-N	435.440	1.833	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(OC(C)C)c(OC)c2)c(OC)n1	763916656	QZGCVPYEOCBGDS-UHFFFAOYSA-N	432.433	1.294	50	20	IDGD	
CC(C)Oc1ccc(NC(=O)C(=O)NNC(=O)c2cc(Br)cn2C)cc1C#N	764005375	ZUSKDYVQGOMLLC-UHFFFAOYSA-N	448.277	1.846	50	20	IDGD	
CCCN1CCN(c2ccc(NC(=O)C(=O)NNC(=O)c3cnccn3)cc2Cl)CC1	764025045	QQXKTXOKFPLEOY-UHFFFAOYSA-N	445.911	1.062	50	20	IDGD	
CCCS(=O)(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)Cc2ccsc2)c1C	764035130	UKZOGOJIYHDUSU-UHFFFAOYSA-N	438.531	1.537	50	20	IDGD	
Cn1c(=O)n(C)c2cc(NC(=O)C(=O)NNC(=O)Cc3cccc4ccccc34)ccc21	764037472	XSNFMYZYSNLWBI-UHFFFAOYSA-N	431.452	1.359	50	20	IDGD	
CCCCOc1ccccc1NC(=O)C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	764077813	NXFOCCRDHJOMBT-UHFFFAOYSA-N	433.486	1.669	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccccc2OC(F)(F)F)c1	764078449	VHFOPBWMYMYSLK-UHFFFAOYSA-N	445.375	1.388	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)n(Cc2ccccc2)n1	764116125	AMOVYJNIAMDKEG-UHFFFAOYSA-N	427.848	1.999	50	20	IDGD	
CCOC(=O)/C=C\c1ccc(NC(=O)C(=O)NNC(=O)c2cccc(OC)c2O)cc1	764131825	SDTQGRLKNSTXTI-XFXZXTDPSA-N	427.413	1.377	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2O1)C(=O)Nc1cccc(-c2n[nH]c(C3CC3)n2)c1	764152562	SNSSNIZGHUULGI-QGZVFWFLSA-N	432.440	1.439	50	20	IDGD	
COC(=O)c1ccc(-n2cc(C)cn2)c(NC(=O)C(=O)NNC(=O)CCc2ccco2)c1	764170114	UXYIGPAAVPCUJN-UHFFFAOYSA-N	439.428	1.279	50	20	IDGD	
CCc1cc(O)nc(-c2cccc(NC(=O)C(=O)NNC(=O)c3ccc(C#N)cc3)c2)n1	764177844	XBMGSFYGXGJKBQ-UHFFFAOYSA-N	430.424	1.683	50	20	IDGD	
O=C(NNC(=O)c1c(Cl)cccc1Cl)C(=O)Nc1ccc2c(c1)S(=O)(=O)CC2	764226685	QHOMMQAFAUFSPE-UHFFFAOYSA-N	442.280	1.723	50	20	IDGD	
NC(=O)CCSc1ccccc1NC(=O)C(=O)NNC(=O)c1cccc2ncccc12	764258326	ZESKMOSTDPOISK-UHFFFAOYSA-N	437.481	1.602	50	20	IDGD	
CN(C)C(=O)COc1ccc(NC(=O)C(=O)NNC(=O)C(C)(C)c2ccccc2)cc1	764301417	DCTQIUHPBCKDGC-UHFFFAOYSA-N	426.473	1.217	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)C(=O)Nc2cc(C(F)(F)F)ccc2N2CCCCC2)cn1	764358234	HCEUNMCEKQPNQJ-UHFFFAOYSA-N	438.410	1.829	50	20	IDGD	
CNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)cc1Cl	764379359	COCSKDCDTMEGGG-UHFFFAOYSA-N	440.790	1.457	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cnn(C)c3C(F)F)n[nH]2)cc1C	764386417	BBHNIYNKKXCEHS-UHFFFAOYSA-N	431.403	1.764	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1cnn(-c2ccccc2)n1	764394617	UNYNBKNVUBKERZ-UHFFFAOYSA-N	426.458	1.154	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNS(=O)(=O)c2cc3c4c(c2)CC(=O)N4CCC3)cc1C	764931226	FWXJPEFMHZTHRZ-UHFFFAOYSA-N	442.497	1.087	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc2c(c1)CCN2C(=O)C(=O)NNC(=O)OC(C)(C)C	765386879	QRCOGIUBOJIOLR-UHFFFAOYSA-N	440.522	1.162	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)CN1CCN(Cc2ccc(C)cc2)CC1	765748353	MJOBQKSGEXFBGI-UHFFFAOYSA-N	426.517	1.348	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)c1ccc(F)c(S(=O)(=O)N2CCCC2)c1	766670608	SMGHZMCLIYGKBP-UHFFFAOYSA-N	441.506	1.771	50	20	IDGD	
Cn1nc(Br)c2c(=O)n(CC(=O)NNc3ncnc4ccsc34)cnc21	766677052	VZMQXTXSFQOCGY-UHFFFAOYSA-N	435.267	1.041	50	20	IDGD	
COC(=O)c1ccccc1-c1ccccc1C(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1	767685463	WAIGIVYWLXVVHE-ZDUSSCGKSA-N	431.470	1.271	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)C(=O)Nc1cnc(Cl)c(Br)c1	768237422	KMRNOJHZNJQYLY-UHFFFAOYSA-N	445.632	1.802	50	20	IDGD	
COC(=O)CNC(=O)c1ccc(NC(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)cc1	770110918	PGXKMGPSFUVYHX-LBPRGKRZSA-N	448.863	1.863	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)NCc3ccc(Cn4cncn4)cc3)nc21	770341147	LIMVYODSODVHIX-UHFFFAOYSA-N	436.480	1.753	50	20	IDGD	
CCc1nc(CN2CCC(CNC(=O)NNc3nc(O)c4cnn(C)c4n3)CC2)cs1	770395259	HLEDKVVGOXWSNV-UHFFFAOYSA-N	445.553	1.626	50	20	IDGD	
CN(C)c1cnc(C(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)cn1	770550238	RXWANNGCIOAVDY-UHFFFAOYSA-N	446.514	1.480	50	20	IDGD	
CCC(=O)Nc1ccc(S(=O)(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)cc1	771607680	QAQALAQGBIXELY-UHFFFAOYSA-N	438.893	1.314	50	20	IDGD	
CCCNS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccc(C(F)(F)F)cn2)cc1	773674058	FKUDQNCWIWLIMU-UHFFFAOYSA-N	445.423	1.871	50	20	IDGD	
O=C(NNc1cnc2ccccc2n1)C(=O)Nc1cccc(S(=O)(=O)N2CCCC2)c1	773716603	LSBUTQQWQXHYKS-UHFFFAOYSA-N	440.485	1.496	50	20	IDGD	
CS(=O)(=O)C[C@@H](NC(=O)NNC(=O)COc1ccccc1[N+](=O)[O-])c1ccccc1	774286075	ZVOYYKVSYDUGJX-CQSZACIVSA-N	436.446	1.090	50	20	IDGD	
O=C(Cc1cccc2ccccc12)NNC(=O)Nc1ccc(C[C@H]2NC(=O)NC2=O)cc1	775704451	FSLDLUVPPDEKFA-LJQANCHMSA-N	431.452	1.986	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)N[C@H]1CCN(c2ccc(Cl)cc2)C1	776316769	LSAUZKDYXVMBTK-HNNXBMFYSA-N	426.868	1.539	50	20	IDGD	
CC(=NNC(=O)CNC(=O)OC(C)(C)C)c1ccc(OCC(=O)N2CCOCC2)cc1	777904657	UKDAEHCDVFAZOD-UHFFFAOYSA-N	434.493	1.289	50	20	IDGD	
Cc1c(C(=O)NNC(=O)CNC(=O)OC(C)(C)C)nnn1-c1ccc(OC(C)C)cc1	778438065	KCQVRSWZZAVBDA-UHFFFAOYSA-N	432.481	1.649	50	20	IDGD	
CC(=O)N1CCN(S(=O)(=O)c2cccc(C(=O)NNc3cc(Cl)ccn3)c2)CC1	778451581	VVDRJJKJAITZDI-UHFFFAOYSA-N	437.909	1.345	50	20	IDGD	
COC[C@@H](C)n1ccc(NC(=O)C(=O)NNC(=O)c2cc(F)ccc2Br)n1	778709887	KCCIGRWGLRIHNC-SECBINFHSA-N	442.245	1.392	50	20	IDGD	
O=C(NNc1ncncc1Cl)Nc1ccc(Cl)c(S(=O)(=O)N2CCOCC2)c1	782006179	CTWWSYUNGHDEOP-UHFFFAOYSA-N	447.304	1.953	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNS(=O)(=O)c2c(C)cc(C)c(CC(=O)O)c2C)cc1C	782249720	LNIVTEGJODDPIT-UHFFFAOYSA-N	447.513	1.804	50	20	IDGD	
COCCn1cc(C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)c(C)n1	782554384	AHPXIDJFSJWVKU-UHFFFAOYSA-N	448.955	1.070	50	20	IDGD	
COCCS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2nccc3sccc23)cc1	783435323	CMFFYDVLNCVTST-UHFFFAOYSA-N	434.499	1.798	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2cc(F)c(S(C)(=O)=O)c(F)c2)n1	785225559	HVCQITJUUKBBCG-UHFFFAOYSA-N	442.448	1.086	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H](CC2CCC2)NC(C)=O)c1	786615887	VHBRTHWDXHAPPN-GOSISDBHSA-N	438.550	1.173	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ccc(Br)cn2)cc1N1CCNC1=O	787555833	PJCBTUPALANRAP-UHFFFAOYSA-N	433.266	1.764	50	20	IDGD	
CC[C@@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(N2CCN(C)CC2)c(Br)c1	787890133	VOVLWEGVRONESI-GFCCVEGCSA-N	440.342	1.333	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(Cl)cc2-n2cccn2)cc1	788329998	AMPDPYFDADRXRS-UHFFFAOYSA-N	427.848	1.999	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(Cl)cc2-n2cccn2)c1O	788332424	FMVYEZVGYWGGSS-UHFFFAOYSA-N	429.820	1.640	50	20	IDGD	
O=C(NNc1nnc(-c2ccccn2)s1)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])o1	788556440	NCITWRKDYUTMTE-LLVKDONJSA-N	429.418	1.849	50	20	IDGD	
COC(=O)COc1ccc(C=NNC(=O)c2csc(N3CCOCC3)n2)cc1[N+](=O)[O-]	788704818	PPNLAGUIHHZDED-UHFFFAOYSA-N	449.445	1.204	50	20	IDGD	
COC(=O)CNC(=O)Cc1ccc(NC(=O)C(=O)NNc2ccc(Cl)c(OC)c2)cc1	789796243	PHWCITNMHYQLEI-UHFFFAOYSA-N	448.863	1.262	50	20	IDGD	
COCCOc1cccc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)c1	789810856	RBJVDIKXALEELY-OALUTQOASA-N	427.457	1.370	50	20	IDGD	
COC(=O)c1csc(-c2cccc(CNC(=O)NNC(=O)Cn3nc(C)cc3C)c2)n1	790620940	IXEZTRWFBNJXRE-UHFFFAOYSA-N	442.501	1.941	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)[C@@H]1CC(=O)N(c2ccc3c(c2)CCC3)C1	795152606	UTKHNHJDHKBDCI-QGZVFWFLSA-N	442.541	1.922	50	20	IDGD	
C[C@H](C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1)[C@@H]1OCCc2sccc21	796495638	RCYCKHVVVTVUOH-MOFZMDFASA-N	446.481	1.529	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)N1C[C@H]2CN(C(=O)OC(C)(C)C)C[C@H]2C1	796503628	HLTJMXOGBYGXTK-GASCZTMLSA-N	428.493	1.796	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2c[nH]c3ccccc23)c(OC)c(C)c1OC	796992424	RAATUEAELLDMKS-UHFFFAOYSA-N	426.429	1.902	50	20	IDGD	
CC(C)Oc1ccc(NC(=O)C(=O)NNc2ccc(Br)nc2)cc1C(N)=O	797078395	WEXBYMLTGWKIEI-UHFFFAOYSA-N	436.266	1.812	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)Nc2cc(S(=O)(=O)N3CCCC3)ccn2)c1	797673453	DZFCJYALWWVWIH-UHFFFAOYSA-N	447.517	1.715	50	20	IDGD	
Cc1cc(O[C@@H]2CCN(C)C2=O)ccc1NC(=O)NNC(=O)c1ccc2c(c1)OCO2	799238273	CCUQVNWRQKIITB-QGZVFWFLSA-N	426.429	1.800	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)[C@@H]2CC(=O)N(Cc3ccccn3)C2)cc1Cl	802072346	MFCLGOLRAXUZIV-GFCCVEGCSA-N	447.879	1.954	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)c2cc(N3CCNC(=O)C3)ccn2)c(OC)cc1Cl	802080667	KRSLGCOKJMQUMV-UHFFFAOYSA-N	448.867	1.155	50	20	IDGD	
COC(=O)N(C)NC(=O)c1cccc(S(=O)(=O)Nc2cc([N+](=O)[O-])ccc2OC)c1	804125038	YVJPSFKMHNJGNL-UHFFFAOYSA-N	438.418	1.747	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NNc2ccc(-n3ccnc3)nn2)cc1	804954500	LDEMRYVKPJIDCS-INIZCTEOSA-N	427.490	1.267	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COCCO1)C(=O)Nc1nc(CC23CC4CC(CC(C4)C2)C3)cs1	806979737	DEZWTTZCSZNKAJ-KQZSUJQPSA-N	448.545	1.403	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)N[C@@H]2CCCN(C(=O)CCC(F)(F)F)C2)cc1	807576024	NPIONLVIFGSHTJ-CQSZACIVSA-N	441.410	1.601	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NCc1ccncc1OC[C@@H]1CCOC1	807614844	ADDDEONDZPJZFT-LSDHHAIUSA-N	432.452	1.934	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CNS(=O)(=O)c2ccc(Br)cc2)c1	810346580	STNWTLCFXBFPPU-UHFFFAOYSA-N	437.275	1.060	50	20	IDGD	
O=C1CC(C(=O)NNC(=O)COc2ccccc2O)(c2cccc(Br)c2)C1	810365459	SEJFNXQODZAHRD-UHFFFAOYSA-N	433.258	1.982	50	20	IDGD	
COC(=O)c1cc(Br)cc(C(=O)NNc2nccc(N3CCOCC3)n2)c1	812532825	IBLNFISUNYWDFP-UHFFFAOYSA-N	436.266	1.619	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)NCc3ccc(S(N)(=O)=O)s3)cc2C1	813497095	YJYGUHOYVRHGCF-SECBINFHSA-N	428.561	1.726	50	20	IDGD	
CC(Cc1c(Cl)cccc1Cl)=NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C	814877655	ULTYJXUPJNBZON-UHFFFAOYSA-N	437.287	1.475	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@@]2(c3ccccc3)CCC(=O)NC2)cc(OC)c1OC	816814389	PHWZMLPZHDUOPF-QFIPXVFZSA-N	427.457	1.321	50	20	IDGD	
CCS(=O)(=O)N[C@H](CCSC)C(=O)NNC(=O)[C@H](C)Oc1cccc(C)c1C	818857719	HEKBCPIAPGRXFE-LSDHHAIUSA-N	431.580	1.279	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1ccccc1	912638398	BORVXVWLVZSCKA-LJQANCHMSA-N	431.514	1.662	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)OCC(=O)N2CCN(Cc3ccccc3)CC2)cc(C#N)n1C	913287134	UNXMNJUWSQCWOW-MTJSOVHGSA-N	431.496	2.000	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)[C@@H]2CCCN(S(=O)(=O)c3ccccc3)C2)cc1	915064728	LCCAUDYZJZVKEP-MRXNPFEDSA-N	446.529	1.355	50	20	IDGD	
CC(=O)N1CCc2ccccc2[C@H]1CC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	915077220	MORGTTMQZPFTHY-LJQANCHMSA-N	429.498	1.387	50	20	IDGD	
O=C(NCCc1ccccc1F)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	915908869	VMJCIABJSAGRDC-UHFFFAOYSA-N	434.493	1.797	50	20	IDGD	
Cc1ccc(C)n1-c1nc(CC(=O)NNC(=O)c2csc(N3CCOCC3)n2)cs1	916136073	GHOAVIIFGXRXLY-UHFFFAOYSA-N	446.558	1.847	50	20	IDGD	
CN(CC(=O)NNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])S(=O)(=O)c1cccnc1	916163874	CHCLINQWKCDOJJ-UHFFFAOYSA-N	433.368	1.772	50	20	IDGD	
CSC[C@H](C(=O)NNC(=O)c1c(C)nc2ccccn12)N1C(=O)[C@H]2CCCC[C@@H]2C1=O	917360468	ZHROOIAYHXADMY-SOUVJXGZSA-N	443.529	1.311	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCc3c(cccc3NC(C)=O)C2)cc1OC	917417493	HZGMALZSCPUVEV-UHFFFAOYSA-N	426.473	1.482	50	20	IDGD	
CC(C)c1ccc(C(=O)O)cc1S(=O)(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	917737847	RPJINIVHZUJAJK-UHFFFAOYSA-N	440.499	1.535	50	20	IDGD	
CCCn1nc(C(=O)NNS(=O)(=O)c2c[nH]c3ncccc23)c2ccccc2c1=O	918754295	SRURMUVLEJRBDB-UHFFFAOYSA-N	426.458	1.306	50	20	IDGD	
CCCC(=O)N1CCC[C@@H](C(=O)OCC(=O)NNC(=O)c2cc(Cl)ccc2OC)C1	919614295	ATLSBQZOYBWBTM-CYBMUJFWSA-N	439.896	1.692	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2ccn(-c3cccc(F)c3)n2)cc1	920284648	DLJSEJFSTIYZGF-UHFFFAOYSA-N	445.476	1.402	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)N2CCC(=NNC(=O)c3ccccc3O)CC2)cc1	920361407	MJQCHYQYHOWKRO-UHFFFAOYSA-N	430.486	1.921	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2nc(C)ncc2Br)c2ccccc2c1=O	1116758868	FRJWLDYOLJQELI-UHFFFAOYSA-N	431.250	1.352	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cn(C3CCN(C(=O)OC(C)(C)C)CC3)nn2)cc1	1318110832	QFSMVPCDCVFTDQ-UHFFFAOYSA-N	444.492	1.934	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)nnc1-c1ccccc1	1329869447	GDVDJEMFMZGCJF-UHFFFAOYSA-N	442.520	1.819	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](CC)NC(N)=O)C1	1777982204	WUWMQQPDCJKTCH-UHQDVWGKSA-N	447.374	1.121	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3c(C)nc4sccn34)C2)C1	1778721973	NAULKMQVPFLSLI-ACJLOTCBSA-N	426.926	1.402	50	20	IDGD	
O=C1NCc2cc(C(=O)N3CC[C@]4(C3)CN(C(=O)[C@H](F)Br)CCO4)ccc21	1778725812	LHPNBQRBSRYGCU-KSSFIOAISA-N	440.269	1.064	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cc(O)cc([N+](=O)[O-])c1)CCO2	1779299461	UXNBFLMFFRTQRL-IBGZPJMESA-N	437.525	1.595	50	20	IDGD	
C[C@H](Nc1ccccn1)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2	1779330207	TXUWNDBCBUJBQG-GDIGMMSISA-N	429.348	1.948	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1cncnc1)C2	1780710459	VXZDSIVUALVLMU-AYOQOUSVSA-N	429.348	1.769	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](O)NC(=O)OC(C)(C)C)C1	1781050711	VISYQEGGKFTZFE-NOAAKOMESA-N	447.960	1.361	50	20	IDGD	
COc1ncc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)cc1F	1781326616	QPKBEYGNGXKWOR-MLGOLLRUSA-N	434.237	1.363	50	20	IDGD	
CCOc1cccc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)c1O	1781334056	UULAZENRRZNUPW-CRAIPNDOSA-N	445.285	1.925	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](O)Cc2ccccc2)C1	1781895876	JUSJFVMQCDMPTN-VQQMMKBISA-N	438.952	1.358	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C2CCSCC2)C1	1783296015	UAYARZWGDCNPPZ-DYESRHJHSA-N	440.610	1.017	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)COc3ccc(O)cc3)CCO2)C1	1783527521	CJMYVUDFXIYPFU-UGSOOPFHSA-N	427.295	1.384	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cccc4c3NC(=O)C4)CCO2)C1	1783538078	VUGJEPQFYFKXHN-CWTRNNRKSA-N	436.306	1.408	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(OC)c(F)c3)[C@H]2C1	1783733389	SEOYRUAPZXMIAR-XSWJXKHESA-N	428.888	1.681	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)CCc3cccc(OC)n3)CCO2)C1	1783873504	PTLUFVHDDPLOIB-UZLBHIALSA-N	425.913	1.107	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ncn(C)c3C(F)(F)F)CCO2)C1	1783876079	URVOHELUOFEIOR-BDJLRTHQSA-N	438.834	1.136	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cn(C)nc3C(F)(F)F)CCO2)C1	1783877900	RKLFMPANGGWJFE-MLGOLLRUSA-N	438.834	1.136	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](C)Sc1ccccn1)CCO2	1783879939	ZXQYTYKZYLMHJA-YZVOILCLSA-N	427.954	1.646	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)Cc3ccc(F)cc3OC)CCO2)C1	1783883788	KDGNRECXYOYLLO-JXFKEZNVSA-N	428.888	1.461	50	20	IDGD	
Cc1ccc([C@H](C)C(=O)N2CCO[C@@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc1	1783936048	BJAASIUDRRNBLT-FDDCHVKYSA-N	430.549	1.301	50	20	IDGD	
CC(C)[C@H]1CC[C@H](C(=O)N2CCO[C@@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)CC1	1783936119	DKOKFDNZHBNCFP-DNVFCKCGSA-N	436.597	1.652	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]2C1)C1(O)CCC1	1783963875	BMOOTZZINSTYKX-QRJUGERDSA-N	431.371	1.548	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]3C2)n(C)n1	1783967107	BLHNTVUPYKVAOY-PCBIJLKTSA-N	427.343	1.353	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cccc(C(F)(F)F)n3)C[C@@H]21)[C@@H](O)CCl	1784086025	ROFNDLJYHZAWOC-MXAVVETBSA-N	449.857	1.222	50	20	IDGD	
Cc1cc(C)n(CCC(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)n1	1784321170	KPCXRDWNIXJPQO-QAPCUYQASA-N	427.343	1.503	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(CCN(C(=O)C34CC(C3)C4)C2)C1	1784835295	XUKNENUHOSJSOD-IVKVDSSUSA-N	443.456	1.764	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3cccc(OC)n3)[C@H]2C1	1785227907	HJILVKOGEHYGLR-OWLYRPNTSA-N	439.940	1.256	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)c1n[nH]c(C2CC2)c1F	1785766468	XNGACQGSARHUGU-USXUVBGUSA-N	447.280	1.710	50	20	IDGD	
Nc1ccccc1/C=C/C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21	1786907154	SEEKJGYSNJBMOU-NJWIJXLQSA-N	440.313	1.952	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@]3(C)C[C@H]3C)C[C@@H]21	1787507560	DOLIQLDBLGRNGN-NNBPNGFISA-N	429.521	1.146	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)c1cc2cccn2cn1	1788076460	HNMQEGNPWQAORR-DLKVLKDVSA-N	439.285	1.618	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)[C@H]1Cc2ccccc2O1	1788182986	PPVRSUSGPJVLCA-ONIAQPFYSA-N	437.334	1.755	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)c1cc2cn[nH]c2cn1	1788467312	SUQPACDYOVOPHY-YIVQXAGMSA-N	440.273	1.242	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(-n4ccnc4)ccn3)C[C@@H]21	1789862030	WHRQLDITCNWUTO-XPYUAMARSA-N	431.924	1.878	50	20	IDGD	
COc1cccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]3C2)c1	1789924483	GSTOGZPZJFYMDA-TUUVXOQKSA-N	429.286	1.979	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)NC(=O)OC(C)(C)C)C[C@@H]21	1791258012	VSHXUGXMTVFPRI-YXMSTPNBSA-N	447.960	1.133	50	20	IDGD	
C[C@@H](CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2C1)c1ccccc1	1791293284	RWZZKXGXXFEVRR-VMXMFDLUSA-N	444.576	1.533	50	20	IDGD	
O=C1COc2ccc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]4C3)cc2N1	1791294862	TVACMEZTPSXNRE-HUBLWGQQSA-N	442.299	1.415	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(F)nc1F)C2	1792867112	XEFVOOXXGPUMNX-NJBDSQKTSA-N	432.265	1.594	50	20	IDGD	
Cc1noc(C)c1CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)CBr	1792868621	GRQKIVTVPQKVSB-MJRMRKOOSA-N	428.327	1.455	50	20	IDGD	
Cc1c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](O)CCl)nc2ccc(Cl)cn12	1792983802	OSMUXSFUXXWNNK-DMVWFOPNSA-N	441.315	1.099	50	20	IDGD	
CC[C@@H](CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCl)NC(=O)OC(C)(C)C	1793115273	GSJGHTGRPGPBCF-QMHWVQJVSA-N	431.961	1.918	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(F)c(C)n1	1794355558	AGOYBMKGOCPSFC-OQMKEHIESA-N	428.302	1.906	50	20	IDGD	
O=C(Cc1cc(F)cc(F)c1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1	1796189241	OWZKSKMJDNDECE-ACDBMABISA-N	428.244	1.139	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2c(c1)OCCO2	1796791887	XSRCRLABOBQGDN-HXFPYSNGSA-N	443.327	1.897	50	20	IDGD	
C[C@@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCBr)C2)[C@H]1SC(=N)NC1=O	1796873450	IDRISUISCIAANX-BZNQNGANSA-N	431.356	1.212	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc3nc[nH]c3c1)C2	1796892508	IXUSXDJXQAQUIK-FKDCUARVSA-N	447.499	1.949	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2ccc(OC)cc2[nH]1	1796918831	YDUZZSGDSOTUIG-MVWRLGRASA-N	435.908	1.634	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)c1cc2c(F)cc(F)cc2[nH]1	1796932848	UGWCSYPIXVJBRT-HPQBHAKGSA-N	427.835	1.249	50	20	IDGD	
Cc1cc2nnc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)[C@H](C)Br)C4)c(C)n2n1	1797441287	XZLKVPJYIMZXBF-DEQVHRJGSA-N	435.326	1.776	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1ON=C(c2ccccc2)O1	1797639505	CRRVVKQAMAOEDD-GSZDEIQRSA-N	435.908	1.718	50	20	IDGD	
O=C(CCCn1c(O)nc2ccccc21)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2	1799062383	NJPDSRSYBRWSPO-JGTCGTHISA-N	438.887	1.646	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1CCN(c3ccccn3)CC1)C2	1799269325	XNKXHSKPZOVHHC-AJYBTWMASA-N	434.968	1.905	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(F)(F)c1ccco1	1800237874	CNTZZJBBFCLAMK-NRWUCQMLSA-N	435.265	1.992	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccccc1O	1800565720	UEXPQMZKYLWMIZ-FRQROOTJSA-N	425.323	1.555	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CCc3ccoc3C1)C2	1800754516	QEURBBHWWKOILC-YIIZKNBGSA-N	425.323	1.758	50	20	IDGD	
Cc1nc2ccncc2cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)Br	1800759576	WTCABBHGXVJASX-ZKRNXSKHSA-N	447.333	1.925	50	20	IDGD	
CC[C@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCN1CCN(C)CC1)C2	1801798876	RSOWXUVPKJPDIE-YVSFHVDLSA-N	429.403	1.436	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1CCN(C(=O)c2ncn(C)n2)[C@H]1c1cccnc1	1803008166	HJWXWEKRWKQDHC-SNPRPXQTSA-N	435.326	1.561	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](C)n1ccnc1C	1803123352	IGMDQRKPEYHFQW-DSUDFGQDSA-N	439.520	1.525	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H]1C[C@H](C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](O)CCl)C3)C1	1804291183	GRWGLNYWXKYQSG-YTQIUSBHSA-N	429.945	1.528	50	20	IDGD	
Cc1cscc1C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1807361149	HLIFWWFCDDRLJG-RXVVDRJESA-N	449.341	1.765	50	20	IDGD	
CCc1cc(C(=O)NC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)n[nH]1	1807776784	WYCSIYAZLBRVQR-KKSFZXQISA-N	441.536	1.060	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)c1cc[nH]c2nccc1-2	1808068062	YAENGZHELIGVNZ-WBAXXEDZSA-N	427.892	1.829	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC2(CCCN(C(=O)c3cncc(F)c3)C2)CC1	1808571780	SBKBKVVBRGYTIZ-UHFFFAOYSA-N	440.479	1.378	50	20	IDGD	
C#CCCCC(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1	1810305944	QXNLRMVISFTKNX-UWJYYQICSA-N	434.500	1.203	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CO)C(=O)N1CCCC2(CCN(C(=O)[C@H](F)Cl)CC2)C1	1810789090	LEVHDAAIBGFHNZ-KBPBESRZSA-N	435.924	1.638	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H](CNC(=O)c2ccnnc2O)[C@@H]1c1cccnc1	1811228300	CPHJYFSNMTVRJT-QAPCUYQASA-N	429.553	1.748	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)COCCOC)[C@@H]1c1cccnc1	1812775035	PCOOBYUMSARMKW-XYJFISCASA-N	442.354	1.924	50	20	IDGD	
O=C(NCC(=O)N1CC[C@H](CNC(=O)C(Cl)Cl)[C@@H]1c1cccnc1)c1ccco1	1813075394	AKEIUYHQEIQJDS-CJNGLKHVSA-N	439.299	1.914	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)C2(C#N)CCC2)[C@H]1c1cccnc1	1814056393	BPDZRKSIJUJQIB-FXAWDEMLSA-N	426.521	1.154	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H]1C[C@H]1C1CC1)CC2)c1ccc(B(O)O)cc1	1815335825	SVULANUYSJUHKY-OWCLPIDISA-N	425.319	1.095	50	20	IDGD	
C[C@]1(C(=O)N[C@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)CC=CCC1	1815347890	VTTVZLPLVIPMNS-AOMKIAJQSA-N	439.346	1.795	50	20	IDGD	
O=C(CCc1ccoc1)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1	1815347908	XCQCAQLJAJWZNP-INIZCTEOSA-N	439.302	1.275	50	20	IDGD	
O=C(Cn1ccccc1=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCBr)CC2	1815442793	BWQXKJMBRWKWLI-NSHDSACASA-N	439.335	1.702	50	20	IDGD	
Cc1[nH]nc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)c1F	1816231515	WVPKCLFEUBPXBY-ZDUSSCGKSA-N	434.476	1.259	50	20	IDGD	
CCOC(=O)N[C@H](O)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCBr)n[nH]1	1816781381	ARUGHKFVWUEXNL-BXUZGUMPSA-N	446.302	1.251	50	20	IDGD	
O=C(CN1C(=O)CSC1=S)N[C@@H]1CCc2nc(NC(=O)[C@@H](F)Cl)sc2C1	1817132776	SCHNZFCUGAVSRN-KSBSHMNSSA-N	436.943	1.450	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(=O)n3[nH]cnc3n2)n[nH]1	1817467409	MYXNBHXNTGBCRV-MFKMUULPSA-N	432.872	1.464	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](O)CCl)CC2)c1snnc1C1CC1	1817831240	CWFUFQCCEPDLCV-WPRPVWTQSA-N	427.939	1.698	50	20	IDGD	
CCC1(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2cccc(B(O)O)c2)CC3)CCC1	1818860845	FPVLZIMYYRVTBH-OAHLLOKOSA-N	427.335	1.629	50	20	IDGD	
COC[C@@H](NC(C)=O)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCBr)[nH]n1	1819607712	KBZPQVNUZICWBI-ZIAGYGMSSA-N	444.330	1.338	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)CN2CCCCC2)[nH]n1	1822413453	WVWIQWPTCAHKJY-QGZVFWFLSA-N	433.557	1.261	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1	1823003016	GLEAIXQEDHLYQL-GMEUVTARSA-N	435.319	1.612	50	20	IDGD	
O=C(N[C@@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1)c1cc(O)nc(O)n1	1823004653	RYNLQRBNROBHJY-GPXNAGAYSA-N	446.258	1.261	50	20	IDGD	
CN(CC(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H](O)CCl)CC1)C(=O)c1ccccc1	1824178175	DMDRMLDECDBCBN-VQTJNVASSA-N	449.979	1.978	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)CN(C)C(=O)C(=O)O)sc2C1	1824668711	ZUGPKOWRFQLZHH-NXEZZACHSA-N	430.914	1.006	50	20	IDGD	
CC[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)Cn1ccnn1)CC2	1825446656	HFYMPINLADANCB-VHSXEESVSA-N	427.328	1.520	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1	1826089692	LTPHGWWTAACDMD-NXEZZACHSA-N	446.371	1.212	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)C1CCSCC1)CC2	1826092098	LUXKKNKLURHLLF-CYBMUJFWSA-N	439.607	1.571	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CCN2CCN(C)CC2)CC1	1826727009	YDSROWSWZASINW-PMACEKPBSA-N	443.032	1.497	50	20	IDGD	
C=CCSCC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827050179	HTWFXPPROGJISP-FQEVSTJZSA-N	430.379	1.519	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)CNC(=O)c2ccco2)CC1	1827185583	RKRUMNNRXFUKMN-DLBZAZTESA-N	439.940	1.883	50	20	IDGD	
Cc1nc(C)c(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)o1	1829295052	RXVQADLIBICZFS-HXUWFJFHSA-N	439.321	1.518	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)Cc1ccc(C#N)cc1)CCO2	1829904640	RPFKOGXSDFVGJB-QFIPXVFZSA-N	445.592	1.409	50	20	IDGD	
COc1ccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)cc1O	1830248661	WVZCCGWYYXPVTC-LJQANCHMSA-N	447.315	1.203	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3nc4ccccn4n3)C2)C1	1830357499	CXBCKHDNROEPNU-FQEVSTJZSA-N	435.912	1.064	50	20	IDGD	
C=CCC(F)(F)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H](C)CBr)CCO2)C1	1830544180	PNCZOWNQNWQCES-XJKSGUPXSA-N	439.297	1.685	50	20	IDGD	
O=C(c1cc(Cl)ccc1F)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1830719406	CSQRLHVURHKXTP-YJBOKZPZSA-N	435.279	1.149	50	20	IDGD	
O=C(c1cc(-c2ccccc2)no1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1830731715	MEVPFEGLEDXRLK-UWJYYQICSA-N	449.891	1.011	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2[C@@H]3C=CS[C@@H]23)CC1	1831159174	HQGGPUQKGGUSFC-ZCLUNYJNSA-N	434.606	1.854	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ncc(F)cc3F)CCO2)C1	1831956680	HCXGGRQBSZTSCG-IBGZPJMESA-N	431.867	1.695	50	20	IDGD	
CC(C)[C@@H](O)C(=O)NC1CCN(C2CCN(C(=O)[C@H](C)CBr)CC2)CC1	1833344043	RWHGJKIFUSUJFR-RHSMWYFYSA-N	432.403	1.606	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)CCS(C)(=O)=O)CC2)CC1	1833534852	LMIMIFSVHJGMFX-KRWDZBQOSA-N	436.018	1.400	50	20	IDGD	
COc1ncc(C(=O)N2CCO[C@@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)cc1C	1834581547	IQODXYZDDVRCOG-SFHVURJKSA-N	432.304	1.272	50	20	IDGD	
CCc1ccc(C(=O)N2CCOC[C@]3(CN(C(=O)CCBr)CCO3)C2)cn1	1834819443	RMEHDCQYSMIETC-IBGZPJMESA-N	440.338	1.499	50	20	IDGD	
CC1=C(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](F)Br)CC3)CC2)CCO1	1834918338	CFVZKQSTZZUEDN-MRXNPFEDSA-N	432.334	1.943	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3nc4ccccn4n3)CC2)CC1	1834970429	XPKJOJWCMDPGQY-KRWDZBQOSA-N	448.955	1.168	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)NC1CCN(C2CCN(C(=O)[C@@](C)(Cl)CCl)CC2)CC1	1835124062	LNFDCXDWCQOCQA-VLIAUNLRSA-N	449.423	1.661	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cnn4cccnc34)CC2)CC1	1835535582	GGEFKXCOSHFTIJ-SFHVURJKSA-N	432.956	1.932	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCC(N2CCC(NC(=O)[C@@]3(C)CCCN3)CC2)CC1	1836384433	NTXGBLVYXWUHIG-VQTJNVASSA-N	433.424	1.936	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3[nH]nc4ncccc34)CCO2)C1	1836451396	WGNBSODIFXRCPX-YWZLYKJASA-N	435.912	1.435	50	20	IDGD	
O=C(CCCn1cccc1)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836720665	ZEFHVNCAUJFVFR-IBGZPJMESA-N	425.957	1.867	50	20	IDGD	
O=C(c1cnccn1)N1CCC(OC2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1837411898	BVEFYGMHAWIOHP-OAHLLOKOSA-N	429.290	1.779	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)Cn3cc(Cl)cn3)CC2)CC1	1837930121	XCAKDWVWGPDEEI-KRWDZBQOSA-N	447.363	1.789	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)Cn3cncn3)CC2)CC1	1837964921	CVHMDYLCXCEFTF-CYBMUJFWSA-N	428.331	1.060	50	20	IDGD	
Cc1ccccc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839202130	VPDCIOOGTQHRJI-CRAIPNDOSA-N	429.286	1.756	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3coc(C)n3)C2)C1	1839963173	CBEDJFZJSRPBFK-CXAGYDPISA-N	430.299	1.227	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3scnc3C)C2)C1	1839963695	SKEHIQQCESPDGN-CXAGYDPISA-N	446.367	1.695	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4ccoc4cn3)C2)C1	1840154717	DPEHCCADKRKMAZ-QRWLVFNGSA-N	437.880	1.152	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(C)cc3Cl)C2)C1	1840155964	GNQMEULQEOGSCP-PXNSSMCTSA-N	445.343	1.972	50	20	IDGD	
O=C(C1CCSCC1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1840925040	JVTBEWADQSNLSF-CJNGLKHVSA-N	439.347	1.277	50	20	IDGD	
O=C([C@H](O)CCl)N1CCOC[C@]2(C1)CN(C(=O)C13CC(c4ccccc4)(C1)C3)CCO2	1840952459	HZSAVUQGGBFZGC-AULURCSPSA-N	448.947	1.164	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)[C@H]2C[C@H]2c2ccc(F)cc2)C1	1841242770	NVBOHZXFSAVRSZ-ROUUACIJSA-N	437.475	1.445	50	20	IDGD	
O=C(c1cc(Br)ncc1Cl)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1	1841350379	YHJONAWCISSNHH-LLVKDONJSA-N	437.121	1.914	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1cc(Cl)c(F)cc1F)C2	1844264813	KOWSZBSZFQNHFR-UHFFFAOYSA-N	449.845	1.748	50	20	IDGD	
CC(C)CNC(=O)C(=O)N1CC2(CCCN2C(=O)/C(C#N)=C/c2ccc(F)cc2F)C1	1845871189	ZJHDXFXJMQRMMK-LZYBPNLTSA-N	430.455	1.847	50	20	IDGD	
CC(C)(C)OC(=O)N1CC2(C[C@H](C(=O)N3CCCC34CN(C(=O)[C@H](F)Cl)C4)CO2)C1	1846120171	GQTMYCLAFAOCMW-KBPBESRZSA-N	445.919	1.750	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@H]1C[C@@H](F)CN1C(=O)OC(C)(C)C)C2	1846362710	SEYSIAVXGDWNFM-KFWWJZLASA-N	447.935	1.791	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)c1ccc([N+](=O)[O-])c3c1OCO3)C2	1846363581	QTQMHDXZLWUTNT-GFCCVEGCSA-N	425.825	1.394	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)c1ccnc3c(O)cccc13)C2	1846385651	FCBPTYNOTKKYLN-UHFFFAOYSA-N	425.489	1.130	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)C1(c3ccc(Cl)cc3)CC1)C2	1846386059	ZCCRQETWNFXJIN-UHFFFAOYSA-N	432.952	1.948	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CCc1c(C)c[nH]c1C	1847650641	QFODFELOXNFMSH-FMEPYYHXSA-N	438.532	1.900	50	20	IDGD	
CC(=O)N1CCN(c2ccc(C(=O)NNC(=O)c3ccccc3F)cc2[N+](=O)[O-])CC1	104851236	YAEYBTFSBAVWOW-UHFFFAOYSA-N	429.408	1.477	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)c1sccc1S(=O)(=O)Nc1cnn(C)c1	725889787	MZKCEUVPSIWJSN-UHFFFAOYSA-N	449.514	1.295	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)c1ccc(OCc2cn3ccccc3n2)cc1	725902366	LSBDNMCTJZGEGR-UHFFFAOYSA-N	433.424	1.697	50	20	IDGD	
COc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NNC(=S)Nc2cccc(C)c2C)cc1	725907571	KDBJNTNCGDVVOG-AWEZNQCLSA-N	436.559	1.997	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)cc1S(=O)(=O)NCC#N	726883862	NFPBWVMBSPONFV-MRXNPFEDSA-N	444.513	1.642	50	20	IDGD	
CC(=O)N[C@@H](CC(=O)NNC(=O)c1nnc(O)c2ccccc12)c1c(F)cccc1F	727364846	FOUVSRGXUPWMOZ-HNNXBMFYSA-N	429.383	1.642	50	20	IDGD	
COc1nc(C)cc(C)c1CNC(=O)NNC(=O)c1sc(N2CCOCC2)nc1C	727482845	WYZRJQPFXXITNX-UHFFFAOYSA-N	434.522	1.453	50	20	IDGD	
Cc1cccc(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)c1[N+](=O)[O-]	728212941	MRMUBLAHUHLZQP-UHFFFAOYSA-N	433.490	1.596	50	20	IDGD	
COc1cc(C=NNC(=O)[C@H](C)NS(C)(=O)=O)cc(Br)c1OC(F)F	728433712	DXYBHGDOXMJMNP-ZETCQYMHSA-N	444.254	1.447	50	20	IDGD	
O=C(CS[C@@H]1CCS(=O)(=O)C1)NNC(=O)c1cc(F)ccc1Br	728549989	UGZYPJXPYCXRCY-SECBINFHSA-N	425.301	1.270	50	20	IDGD	
CCS(=O)(=O)N1CCC(C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)CC1	728974678	XWWQITMPMDTIOI-UHFFFAOYSA-N	425.479	1.188	50	20	IDGD	
N#CCCNS(=O)(=O)c1ccc(C(=O)NNC(=O)Cn2ccc3ccccc32)cc1	729449876	GFRVBJXPNPHGKY-UHFFFAOYSA-N	425.470	1.294	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)Cc2c(C)nc3c(c(O)nn3C)c2C)o1	729527979	LSOBZJNPXWQQFI-UHFFFAOYSA-N	428.493	1.729	50	20	IDGD	
CCOc1cc2c(cc1[C@@H]1C[C@@H]1C(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1)O[C@@H](C)C2	730535484	PSNRMEOCLZVWLJ-AEIGPULVSA-N	437.518	1.030	50	20	IDGD	
Cc1cccc(N2C(=O)N[C@H](CCC(=O)NNC(=O)[C@@H](C)Oc3ccccc3F)C2=O)c1	730739272	BSXZCFYIVIXZAV-RHSMWYFYSA-N	442.447	1.954	50	20	IDGD	
Cc1cccc(N2C(=O)N[C@H](CCC(=O)NNC(=O)c3cc(Br)c[nH]3)C2=O)c1	730770189	YMFGAVCSXZPXRR-CYBMUJFWSA-N	448.277	1.752	50	20	IDGD	
C[C@@H]1CN(S(=O)(=O)c2cccc(C(=O)NNC(=O)Cc3ccccc3F)c2)C[C@@H](C)O1	731329393	KDTNGZIBKDNUSY-HUUCEWRRSA-N	449.504	1.627	50	20	IDGD	
CCNC(=O)NC1(C(=O)NNC(=O)c2ccc(OC)c(Br)c2)CCCC1	732176144	SYXWNPWOZIYZTD-UHFFFAOYSA-N	427.299	1.851	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)NCCCCN2C(=O)c3ccccc3C2=O)nc2ccccc21	732472051	MUSLAPZMBJERFD-UHFFFAOYSA-N	448.483	1.523	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)NCCCCN1C(=O)c2ccccc2C1=O	732472355	QZZHPNWUHLKMNS-AWEZNQCLSA-N	442.447	2.000	50	20	IDGD	
CN(CCNC(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12)C1CC1	732891626	PNTUNMUFMSRHGA-UHFFFAOYSA-N	434.500	1.483	50	20	IDGD	
CC[C@H](C#N)Oc1cccc(CNC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c1	733851905	MPVQKUAUIHYDQR-OAHLLOKOSA-N	434.456	1.759	50	20	IDGD	
O=C(CCN/C(O)=C1/N=CC=CC1=O)NNC(=O)COc1ccccc1-c1ccccc1	733885272	WUXFEEUECNHHSJ-FCQUAONHSA-N	434.452	1.796	50	20	IDGD	
O=C(NNc1nccnc1Cl)c1ccc(Cl)c(S(=O)(=O)NC[C@@H]2CCCO2)c1	734261645	RJQCJYYGTFWCGC-NSHDSACASA-N	446.316	1.998	50	20	IDGD	
COc1ccc(CC(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)cc1OC	734825930	RFLNLLYXHXOSOM-UHFFFAOYSA-N	436.509	1.976	50	20	IDGD	
C[C@@H](CCC(C)(C)C)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	737062004	XSOMDMUPZUWHHE-HNNXBMFYSA-N	440.566	1.866	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)c1sccc1S(=O)(=O)N1CCCCC1	737638155	SIIZNRKJBGNRDP-UHFFFAOYSA-N	437.543	1.901	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)c1ccc(S(=O)(=O)NCc2ccco2)cc1	737922656	ABOJOCJSKURDMR-UHFFFAOYSA-N	443.481	1.736	50	20	IDGD	
Cc1c(/C=C(\C#N)C(=O)N2CCN(c3cc(N4CCOCC4)ncn3)CC2)cc(C#N)n1C	737998621	CAYPWPOVBLOYJB-YBFXNURJSA-N	446.515	1.088	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NN=C2CCN(Cc3ccccc3)C2=O)cc1	743426516	RFWAEPQLJLPEKJ-UHFFFAOYSA-N	428.514	1.520	50	20	IDGD	
CCOc1cn(-c2ccccc2)nc1C(=O)OCC(=O)NNC(=O)c1ccc(C#N)cc1	744954231	JYERTTAEVYDMSW-UHFFFAOYSA-N	433.424	1.761	50	20	IDGD	
C[C@H]1C[C@@H](NC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)C(=O)N1c1ccccc1	745883037	RHVSKZIYWHIFEA-SUMWQHHRSA-N	445.501	1.620	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc2nc(O)[nH]c2cc1Br)c1ccccc1O	745999378	ZIKOBXPCYIJOLY-UHFFFAOYSA-N	427.236	1.360	50	20	IDGD	
COCCNS(=O)(=O)c1c[nH]c(C(=O)NNc2nc(-c3ccc(Cl)cc3)no2)c1	746256118	IIMRHRFLOMVZIQ-UHFFFAOYSA-N	440.869	1.400	50	20	IDGD	
COCCOc1cn(-c2ccccc2)nc1C(=O)NNC(=O)Cc1cn2ccccc2n1	746549854	HRTJPBRXIFKAPP-UHFFFAOYSA-N	434.456	1.549	50	20	IDGD	
Cc1cc(F)cc(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1	747595911	QSVVVGATYKMHOY-UHFFFAOYSA-N	441.506	1.542	50	20	IDGD	
O=C(CN1CCC[C@H](CN2CCN(c3ccccn3)CC2)C1)NNC(=O)c1ccccc1	748319352	UUCRVPHEOYGREN-HXUWFJFHSA-N	436.560	1.377	50	20	IDGD	
COc1ccccc1NC(=O)CN1CCN(C(=O)NNC(=O)c2ccccc2C)CC1	749767979	GKMBEBXSFPYBFX-UHFFFAOYSA-N	425.489	1.614	50	20	IDGD	
CCOCCO[C@H]1CCN(C(=O)NNC(=O)c2ccc(OC)c(Br)c2)C1	749821454	AIJOCMYGOSSATK-ZDUSSCGKSA-N	430.299	1.940	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)c1nn(-c2ccccc2)cc1O)CNC(=O)OC(C)(C)C	749870526	NSURKSMOOVBZCF-CYBMUJFWSA-N	432.481	1.683	50	20	IDGD	
O=C(CNC(=O)c1cc(F)cc(F)c1)NNc1nc(Br)cn2ccnc12	750243739	ORBKRCMBLNDYAF-UHFFFAOYSA-N	425.193	1.643	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(C(=O)NNc2nc(Br)cn3ccnc23)o1	750247333	PFHHGAUDVAYFIY-UHFFFAOYSA-N	429.256	1.092	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)N[C@H]2CCN(CCCc3ccccc3)C2=O)cc1	750661406	QXAFTDPDXCGSAM-FQEVSTJZSA-N	435.484	1.501	50	20	IDGD	
O=C(NCC1(CN2CCOCC2)CCCCC1)NNC(=O)c1nnc(O)c2ccccc12	751820040	YEVBIURCEIHRFG-UHFFFAOYSA-N	442.520	1.562	50	20	IDGD	
O=C(NCC1(C2CC2)CCC1)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	752687554	SCLQMBCRWNYHSQ-UHFFFAOYSA-N	436.534	1.232	50	20	IDGD	
CSCCNC(=S)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	752739379	PYGXWKHFLCHIDG-UHFFFAOYSA-N	438.600	1.637	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN[C@@H](C)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)n1	754319501	QRAOIRGOIIRWRE-LSDHHAIUSA-N	439.582	1.767	50	20	IDGD	
CCc1noc(CC)c1CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	756078202	LMTZWNGLUMUDEP-UHFFFAOYSA-N	449.533	1.728	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)Nc1ccccc1CS(=O)(=O)c1ccccc1	756483726	WPESPHKHJRLATF-HNNXBMFYSA-N	435.502	1.865	50	20	IDGD	
CNC(=O)Cn1ccc2ccc(NC(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)cc21	756766620	XGKILCSKXPYWSY-UHFFFAOYSA-N	443.485	1.257	50	20	IDGD	
C[C@@](O)(CN1Cc2ccccc2C1=O)C(=O)NNC(=O)c1ccc(Br)s1	756798551	YQMJFLOPLLBVQH-QGZVFWFLSA-N	438.303	1.679	50	20	IDGD	
COc1ccccc1N1CC[C@H](NC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)C1=O	756942289	LKPUYXZJYLZRFJ-KRWDZBQOSA-N	434.456	1.630	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N2CC[C@@]3(CCOC3)C2)cc1	757006981	SNOQTUNVIJXUTC-IRUWDQCASA-N	449.511	1.980	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)CN2C(=O)N[C@]3(C[C@@H](C)C[C@@H](C)C3)C2=O)c1	757733117	KTJJLRQXZMYUSK-GFENJXEQSA-N	431.493	1.001	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)nn1C	757753151	JBINFLGHDJFXSP-UHFFFAOYSA-N	442.501	1.674	50	20	IDGD	
CN(C)C(=O)Nc1cccc(C(=O)N2CCN(S(=O)(=O)CBr)CC2)c1	758524627	WZXLDYNFLGAGKT-UHFFFAOYSA-N	433.328	1.220	50	20	IDGD	
CN(NC(=O)c1ccc(CS(C)(=O)=O)o1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758781402	BBJRQUBKBDUHNN-UHFFFAOYSA-N	444.510	1.074	50	20	IDGD	
CCC(=O)c1ccc(C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)cc1	761568121	LBMLPRCFBKZFDS-UHFFFAOYSA-N	431.518	1.367	50	20	IDGD	
Cc1ccc(NC(=O)CS[C@@H](C)C(=O)NNc2nccc(N3CCOCC3)n2)cc1	762860792	JKYOPCXOFJUADY-HNNXBMFYSA-N	430.534	1.825	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(NC(=O)[C@H]2CCCO2)cc1	763466863	NPIFHUNLWCCILF-MRXNPFEDSA-N	441.400	1.112	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(N3CCSCC3)cc2)cc1OC	763544385	XDPURCWQYYKHOI-UHFFFAOYSA-N	444.513	1.657	50	20	IDGD	
COC(=O)c1cc(F)c(F)cc1NC(=O)C(=O)NNC(=O)COc1cc(C)cc(C)c1	763646677	HQDCZHBPZYMGSH-UHFFFAOYSA-N	435.383	1.533	50	20	IDGD	
Cc1nccc(-c2cccc(NC(=O)C(=O)NNC(=O)COc3ccc(C#N)cc3)c2)n1	763680936	RWZKNMJEXWTVNW-UHFFFAOYSA-N	430.424	1.489	50	20	IDGD	
O=C(CSc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1cnn(-c2ncccn2)c1	763733881	JUCLERUTAJTZSJ-UHFFFAOYSA-N	431.865	1.194	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)C(=O)Nc1cc(-c2ccccc2)ns1	763789781	BSYBQTPMMBBJPW-UHFFFAOYSA-N	434.437	1.859	50	20	IDGD	
CCCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)cc1	763841342	QKUPGLQCOAKJLA-MRXNPFEDSA-N	440.500	1.997	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccc(NC(=O)C2CC2)cc1	763849859	LIDNJVWYRWLBEC-GFCCVEGCSA-N	428.420	1.728	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cc(C3CCCC3)nn2C)cc1	763872072	JUTKGWVPTXKLAO-AWEZNQCLSA-N	441.488	1.834	50	20	IDGD	
CC(=O)Nc1cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(C(C)=O)cc2)ccc1F	763873332	VYPMLYMPFJEXNK-GFCCVEGCSA-N	444.419	1.540	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(S(=O)(=O)CC)cc2)cc1OC	763902096	NETYJLCEBGENLW-UHFFFAOYSA-N	449.485	1.287	50	20	IDGD	
Cc1ccc(CN(C)C)cc1NC(=O)C(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	763944562	MXSDUSHWAZRZOY-UHFFFAOYSA-N	436.472	1.348	50	20	IDGD	
CC(C)Oc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)C(=O)NNC(=O)C1CCCC1	764068672	ONCIDHPJJXJEII-UHFFFAOYSA-N	440.522	1.000	50	20	IDGD	
CN1CCC[C@@H](N(C)C(=O)c2ccc(NC(=O)C(=O)NNC(=O)C3CCCC3)cc2)C1	764071037	PKAFPBIDWVZFJX-GOSISDBHSA-N	429.521	1.129	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccccc2C(=O)N2C[C@@H](C)C[C@H](C)C2)n[nH]1	764097530	FJYOSTZCILGKNB-STQMWFEESA-N	426.477	1.236	50	20	IDGD	
CNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)CCc2ccc(OC)cc2)cc1Cl	764126844	KLRSGUISZRDCKR-UHFFFAOYSA-N	432.864	1.427	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccc(-c2nnc(N(C)C)o2)cc1	764137104	ZBKYUZXDHWKAOX-UHFFFAOYSA-N	438.444	1.140	50	20	IDGD	
Cc1nn(-c2ccc(C#N)cc2)c(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)c1C	764154728	UGSWRMNADVZETC-IBGZPJMESA-N	444.451	1.450	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccn(-c3ccc(C#N)cc3Cl)n2)c1	764236165	WPYOBDKBEFKKJW-UHFFFAOYSA-N	433.815	1.669	50	20	IDGD	
CSc1cnn(-c2ccccc2)c1NC(=O)C(=O)NNC(=O)COc1ccccc1O	764277862	JFMCQPHRNFDQPD-UHFFFAOYSA-N	441.469	1.465	50	20	IDGD	
COC(=O)c1cc(Cl)cc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c1	764350364	CYOHNIAORGKLKO-UHFFFAOYSA-N	441.831	1.712	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)COCc2ccccc2)cc1Br	764367303	UWCVXWVFLPWNHZ-UHFFFAOYSA-N	436.262	1.760	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2ccc(C)c([N+](=O)[O-])c2)n[nH]1	764378203	VPYWNIWXRHHVDJ-UHFFFAOYSA-N	438.400	1.702	50	20	IDGD	
O=C(NNC(=O)C(F)(F)Oc1ccccc1)C(=O)Nc1ccnn1Cc1ccccc1	764379408	DVINATKAWDBCTK-UHFFFAOYSA-N	429.383	1.689	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1ccc2nc(-c3ccccn3)oc2c1	764397012	DRCZFOZAJQRADM-LBPRGKRZSA-N	427.417	1.027	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)C[C@H]2COC(=O)C2)c1	764455532	ADWZDOILKUYPNP-CYBMUJFWSA-N	447.469	1.210	50	20	IDGD	
CC(C)(C)OC(=O)NNC(=O)C(=O)Nc1cnc2c(c1)C[C@@H](NC(=O)OC(C)(C)C)CC2	765389579	IUBZUFBONOGNOX-ZDUSSCGKSA-N	449.508	1.958	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CC(F)F)C(=O)NNC(=O)c1nnc(O)c2ccccc12	765530122	IXADDUGQNNEVPW-NSHDSACASA-N	425.392	1.645	50	20	IDGD	
COc1cc(C#N)ccc1NC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	766247173	CTDFFILSGRWEEP-UHFFFAOYSA-N	443.485	1.818	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)CNC(=O)CNC(=O)OC(C)(C)C)c(C)n1-c1ccccc1	766325130	BSQVQJLELSHXNZ-UHFFFAOYSA-N	443.504	1.496	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)CSCc3ccncc3)CC2)cc1	766649526	QKZSCMHDEQHSFA-UHFFFAOYSA-N	427.574	1.588	50	20	IDGD	
Cc1nc(C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)c2ccccn12	766663695	LXFVPAHAHGLYCI-UHFFFAOYSA-N	440.935	1.875	50	20	IDGD	
C[C@@H](OC(=O)[C@H](Br)C(C)(C)C)C(=O)NCCc1ccc(S(N)(=O)=O)cc1	766749728	OLYDYFRMNQQDLY-RISCZKNCSA-N	449.367	1.734	50	20	IDGD	
CCC1(CC)[C@@H](NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)C[C@@H]1OC	767162444	UZXBJYHVRIWKKU-IRXDYDNUSA-N	440.566	1.540	50	20	IDGD	
NC(=O)c1cnn2c(C(=O)NNC(=O)c3cc(-c4ccco4)nc4ccccc34)ccnc12	767191770	HKGUPVBXCUCQAN-UHFFFAOYSA-N	441.407	1.711	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)[C@H]1CC(=O)N(C2CCC(C)CC2)C1	767340845	YXOYQEOLXPZQKT-OBONGRFPSA-N	429.517	1.655	50	20	IDGD	
COc1ccc(CN2CCCN(CC(=O)NNC(=O)c3ccc(C#N)cc3)CC2=O)cc1	767932375	SEWJXCPKQGALMB-UHFFFAOYSA-N	435.484	1.062	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)CSc1nnc(COc2ccc(F)cc2)n1N	768289003	NWJWZJUGURCOPG-UHFFFAOYSA-N	444.492	1.501	50	20	IDGD	
COc1ccc(O)c(C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)c1	768291564	RTTHHFIQJDUTNF-UHFFFAOYSA-N	432.908	1.633	50	20	IDGD	
CN1CCCN(S(=O)(=O)c2cccc(NC(=O)NNc3ccc(Cl)nn3)c2)CC1	770023237	KWYBPKSSZFWVCP-UHFFFAOYSA-N	439.929	1.605	50	20	IDGD	
CCCC[C@H](/N=C1/NS(=O)(=O)c2ccccc21)C(=O)NNC(=S)NCCSC	770247703	QTLGBUNFSKKWNK-ZDUSSCGKSA-N	443.620	1.142	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)c2cnc3c(c2)NC(=O)CO3)cc(OCC)c1OCC	770573549	QDJSGNHIXCULJY-UHFFFAOYSA-N	444.444	1.683	50	20	IDGD	
CCc1nn(C)cc1C=NNC(=O)c1cc(S(=O)(=O)NCc2ccccc2)ccc1O	770597326	VBHZOHUGGROLSM-UHFFFAOYSA-N	441.513	1.931	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)N1CCS(=O)(=O)[C@H]2CCCC[C@@H]21	770649191	MZTYOSNGRLZDNJ-RCBQFDQVSA-N	429.926	1.890	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@H](C(=O)O[C@H](C)C(=O)NNC(=O)CC(C)C)C(C)C)cc1	771847619	UCOSKSTYNJIEBN-QAPCUYQASA-N	441.550	1.423	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1cc(S(=O)(=O)N2CCCC[C@@H]2C)ccc1C	771934921	XAAJQVZSNDHFGZ-GJZGRUSLSA-N	439.534	1.661	50	20	IDGD	
Cc1cc(=O)c(C(=O)O[C@@H](C)C(=O)NNC(=O)CC(C)C)nn1-c1cccc(Cl)c1	772156980	UOKCWBQAUZEPGI-ZDUSSCGKSA-N	434.880	1.933	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2ccc(Cl)cc2OC)c2ccccc2c1=O	773494035	LKQNWGIWPGHTHR-UHFFFAOYSA-N	443.847	1.478	50	20	IDGD	
CCOc1cc(N2CCN(C)CC2)ccc1NC(=O)C(=O)NNc1ccccc1[N+](=O)[O-]	773648939	YAXDOLYYPYLACM-UHFFFAOYSA-N	442.476	1.827	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2cc(C(=O)N3CCSCC3)ccc2C)n1	773731595	SBGFVILGKCVWBU-UHFFFAOYSA-N	430.490	1.064	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1cnn(Cc2ccncc2)c1	774008631	JYMATUZNHWVYJD-CYBMUJFWSA-N	442.863	1.533	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)c2sc(N3CCCC3)nc2Cl)c1	775887190	BQNBWKFOYKLXLJ-UHFFFAOYSA-N	433.877	1.886	50	20	IDGD	
C#CCOc1ccccc1NC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1	776090931	CGZPSDNUQMDRTM-UHFFFAOYSA-N	430.486	1.480	50	20	IDGD	
CCNC(=O)N(C)NC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(Br)cc2)C1	780712368	RFCUBKRSYPDXHU-GFCCVEGCSA-N	447.355	1.542	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NC[C@@H]2CC(=O)N(C3CC3)C2)c2ccccc2c1=O	780892656	NNAJYPMCQLVHMN-AWEZNQCLSA-N	440.504	1.152	50	20	IDGD	
COc1ccc(CN(CC(=O)NNC(=O)c2cccs2)[C@@H]2CCS(=O)(=O)C2)cc1	781349820	ZRNRXKBCHUNWJX-OAHLLOKOSA-N	437.543	1.207	50	20	IDGD	
Cc1n[nH]cc1-c1nnc(NC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)s1	782095351	VDLZHONRJUWJLC-UHFFFAOYSA-N	425.434	1.594	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)c(C)c1	782898088	YLZGNHJNUAUVGS-UHFFFAOYSA-N	447.517	1.395	50	20	IDGD	
Cn1cc(CNC(=O)NNc2ccc(S(=O)(=O)NC3CCCCCCC3)cn2)nn1	783289807	KWCKYXAOFJZWHK-UHFFFAOYSA-N	436.542	1.428	50	20	IDGD	
Cc1[nH]nc(C(F)(F)F)c1C(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	783703706	CGQPAWNBFFENAN-UHFFFAOYSA-N	434.419	1.986	50	20	IDGD	
O=C(NNC(=O)c1cccc(OC(F)F)c1)N[C@H]1CCCN(Cc2ccccn2)C1=O	784282976	QDZOPRMEUIAZCD-INIZCTEOSA-N	433.415	1.818	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2cccc([N+](=O)[O-])c2C)cc1N1CCOC1=O	784357536	BHZYNTODQZVOPM-UHFFFAOYSA-N	429.389	1.950	50	20	IDGD	
CC[C@@H](C)NS(=O)(=O)c1cccc(NC(=O)C(=O)NNc2cccc([N+](=O)[O-])c2)c1	784833152	JNXVIUACTWPJII-GFCCVEGCSA-N	435.462	1.753	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)C(=O)Nc2ccc(C)c(S(=O)(=O)NC3CC3)c2)c1	784851523	KGOBHLVFHDPWMI-UHFFFAOYSA-N	446.485	1.304	50	20	IDGD	
Cc1nn(-c2ccccc2)c(C)c1NC(=O)C(=O)NNC(=O)Cc1cn2ccccc2n1	785061577	YAHANPOLLLLXIU-UHFFFAOYSA-N	431.456	1.465	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ccc(C#N)c(Cl)c2)cc1-n1nnnc1C	785092062	RCDAPNRBQMJHLF-UHFFFAOYSA-N	426.824	1.586	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)cccc1N1CCNC1=O	787542545	AIQDYEOWWOWHKO-UHFFFAOYSA-N	431.836	1.283	50	20	IDGD	
CN1CCN(C(=O)NNC(=O)[C@@H]2CCCN2C(=O)c2cc(Cl)ccc2Cl)CC1	788169078	IEXSJBIWGYQGBC-HNNXBMFYSA-N	428.320	1.586	50	20	IDGD	
CS(=O)(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)ccc1Cl	788330581	JMUVEBIOJHPQBB-UHFFFAOYSA-N	440.821	1.051	50	20	IDGD	
COCCOc1cc(OC)ccc1C(=O)NNC(=O)c1csc(N2CCOCC2)n1	788492902	PXDKVBBURMXGLA-UHFFFAOYSA-N	436.490	1.088	50	20	IDGD	
CCn1cnnc1-c1ccccc1NC(=O)C(=O)NNC(=O)[C@H]1OCC[C@H]1c1ccccc1	789817849	KNQDNPDPSDJQJU-LPHOPBHVSA-N	448.483	1.624	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)[C@@H]3CCC(=O)c4cccn43)cc2)CC1	790001332	WVKKHCOKLXYZNZ-SFHVURJKSA-N	431.518	1.085	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)[C@H]1CCN(c2cccc(Br)c2)C1=O	790063407	JFRCJWINHSKCPG-CQSZACIVSA-N	442.310	1.739	50	20	IDGD	
CCc1c(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cnn1C(CC)CC	791589994	MZIBPYASFALGDK-IBGZPJMESA-N	444.488	1.951	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)N1CCC[C@@H](C=NNC(=O)c2ccc3c(c2)OCCO3)C1	794490358	PZNZXHGNKWLWAM-HNNXBMFYSA-N	446.504	1.937	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2cc(F)c(Br)cc2Cl)CCS(=O)(=O)C1	799260820	ABIRXBNPRXQRIE-CYBMUJFWSA-N	442.694	1.378	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)S(=O)(=O)c1ccc(F)cc1	802063643	NQPFGQKYJBDICV-NSHDSACASA-N	443.478	1.244	50	20	IDGD	
COc1ccc(C2=NO[C@H](CNC(=O)NNc3ccc(-n4cccn4)nn3)C2)cc1F	802342706	MRVFUQCAUKBGOT-ZDUSSCGKSA-N	426.412	1.629	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)C(=O)Nc1ccc(F)cc1OC1CCOCC1	806974058	RRFFJFTXZBNGCE-UHFFFAOYSA-N	449.410	1.688	50	20	IDGD	
CC1(C)CC(=O)c2cc(NC(=O)C(=O)NNC(=O)COCc3ccccc3)ccc2O1	806979479	WUGVOZGOAHHMHN-UHFFFAOYSA-N	425.441	1.733	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C(=O)Nc1cc(Cl)cc2c1OCC(=O)N2)c1ccccc1	806979767	FXLXKKASPBLYGZ-ZDUSSCGKSA-N	430.848	1.951	50	20	IDGD	
Cc1cccn(Cc2c(F)cccc2NC(=O)C(=O)NNC(=O)c2ccc(O)cc2)c1=O	806991973	YZXMXDDLOGXUEA-UHFFFAOYSA-N	438.415	1.449	50	20	IDGD	
COc1cc(Cl)c(NC(=O)C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1C	808934473	GWISIQJQBPCIBO-UHFFFAOYSA-N	429.824	1.032	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)CNS(=O)(=O)c2ccc(OC(F)(F)F)cc2)cc1	810267929	JJDIWTMGHDUVRF-UHFFFAOYSA-N	442.375	1.196	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CNS(=O)(=O)c2cccc(Br)c2)c1	810347254	XPVBLTFFTYNUSS-UHFFFAOYSA-N	437.275	1.060	50	20	IDGD	
O=C(COC(=O)[C@H]1CCN(c2ccccc2F)C1)NNC(=O)c1cccc([N+](=O)[O-])c1	811374641	FXUCPFNGHMXKPU-AWEZNQCLSA-N	430.392	1.565	50	20	IDGD	
O=C(NNS(=O)(=O)CCc1cccs1)c1cccc(S(=O)(=O)N2CCCC2)c1	811676105	QZJJGAWOMQTXHU-UHFFFAOYSA-N	443.572	1.340	50	20	IDGD	
CCC[C@H](C)C(=O)NCCNC(=O)NNC(=O)COc1ccc(Br)cc1	814431499	KOLXDXVLPHIXLN-LBPRGKRZSA-N	429.315	1.711	50	20	IDGD	
O=C(NNC(=O)c1ccccn1)C(=O)Nc1cccc(S(=O)(=O)C2CCCCC2)c1	815563735	MMTNRJUSXROBBT-UHFFFAOYSA-N	430.486	1.588	50	20	IDGD	
COc1c(C)cnc(Cn2cnc(NC(=O)C(=O)NNc3cccc(Cl)n3)n2)c1C	815726175	RRUFJOUXEGPWNY-UHFFFAOYSA-N	430.856	1.477	50	20	IDGD	
O=C1COC[C@@H](C[C@@H]2CN(C(=O)C(=O)NNc3cccc(Cl)n3)c3ccccc32)N1	815729561	ZLVDPDJSJYJHRG-CHWSQXEVSA-N	429.864	1.214	50	20	IDGD	
Cc1nn(C)c(-n2cccn2)c1C(=O)NNC(=O)[C@H]1CCCN(C(=O)OC(C)(C)C)C1	816509985	JIBNKTQUKVJAAR-AWEZNQCLSA-N	431.497	1.322	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@@H]2CSC(c3ccccc3O)=N2)c2ccccc2c1=O	816805578	AQQBZAGYTCQGPF-HNNXBMFYSA-N	437.481	1.445	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NNC(=O)CSc2nnc3ccccn23)C1	819658573	NCVZLQGKVVZDEV-CYBMUJFWSA-N	434.522	1.616	50	20	IDGD	
O=C(NNS(=O)(=O)CCCCF)c1ccccc1NS(=O)(=O)c1cccs1	821127817	NZCAUIVUIQOBDM-UHFFFAOYSA-N	435.524	1.863	50	20	IDGD	
CCn1c(NNC(=O)CCNS(=O)(=O)c2ccc(F)cc2)nc2ccccc2c1=O	823911748	QPQCVYIAFMODHY-UHFFFAOYSA-N	433.465	1.367	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)c2ccc3c(c2)C(=O)N(C[C@H]2CCCO2)C3=O)cc1	825588785	LYTFZVJYMQSNKT-QGZVFWFLSA-N	436.468	1.643	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@@H](B(O)O)C2)cc1S(=O)(=O)N(C)Cc1ccccc1	864232740	BVIBPCYDDIVSAC-QGZVFWFLSA-N	432.307	1.205	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)NN=Cc1c(N2CCOCC2)nc2ccccn2c1=O	874083030	RNNQAVCZUMHRND-UHFFFAOYSA-N	430.468	1.705	50	20	IDGD	
CC(C)CNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cc(Br)c[nH]2)cc1	914751101	DNZQBQHXXMULRG-UHFFFAOYSA-N	443.323	1.786	50	20	IDGD	
CCc1c(C(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)cnn1C	915638512	YXERYSSKWCDPGD-UHFFFAOYSA-N	433.515	1.920	50	20	IDGD	
COc1cccc(C[C@@H](C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)n2nnnc2C)c1	915696726	HYRMQBBWSRXKEF-UGSOOPFHSA-N	442.451	1.528	50	20	IDGD	
CCCCS(=O)(=O)N1CCC(C(=O)NNC(=O)COc2ccc(C)c(C)c2)CC1	916107578	APDYLKSQCWYRBC-UHFFFAOYSA-N	425.551	1.672	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNS(=O)(=O)c1cc(NC(C)=O)ccc1OC	916109870	CROPRMJVDMCXFQ-UHFFFAOYSA-N	437.474	1.441	50	20	IDGD	
CCOc1ccccc1N1CCN(CC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)CC1	916142215	SGOVAWWRWXQAGG-UHFFFAOYSA-N	427.461	1.577	50	20	IDGD	
CNC(=O)CN1CCC(NC(=O)NNC(=O)c2ccc(OCCC(C)C)c(OC)c2)CC1	916516918	PWICUDAENAUZDR-UHFFFAOYSA-N	449.552	1.275	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NN=Cc3c(F)cccc3F)CC2)cc1	916663895	WUBLYFKEWCOPPV-UHFFFAOYSA-N	436.484	1.730	50	20	IDGD	
CCN1C(=O)c2ccc(C(=O)NNC(=O)COc3cc(C)ccc3C)cc2S1(=O)=O	917515340	ARRUTMLAWXYHTR-UHFFFAOYSA-N	431.470	1.308	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@H](C)NS(=O)(=O)c2cccs2)ccc1OC(C)C	917924371	OWZGGACPSRPROK-LBPRGKRZSA-N	441.531	1.672	50	20	IDGD	
COc1cc(C(=O)NNC(=O)N[C@@H](CC(=O)N(C)C)c2ccccc2)cc(OC)c1OC	920047381	RHTIQLYNVPTCAQ-INIZCTEOSA-N	444.488	1.876	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NN=C(C)c1cnn(C)c1)N(S(C)(=O)=O)CC2	920828201	WIXZHYCIWAVRBX-KRWDZBQOSA-N	449.533	1.227	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)NCc1cccc(OCCN2CCOCC2)c1	920920597	OBBDUFFFJHABNY-UHFFFAOYSA-N	446.479	1.446	50	20	IDGD	
C[C@@H](OC[C@@H]1CCCCO1)C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	921166738	NRIQDDCWIYLEKL-WBVHZDCISA-N	439.534	1.206	50	20	IDGD	
O=C(Cc1cccc(F)c1)NCCNC(=O)NNC(=O)c1ccc(Br)cc1	1251417366	ZBMWWRVAACDVDI-UHFFFAOYSA-N	437.269	1.891	50	20	IDGD	
O=C(NCc1ccccc1CN1CCC(O)CC1)NNC(=O)c1cncn1-c1ccccc1	1252598029	RRPNGJUDNBQCFS-UHFFFAOYSA-N	448.527	1.973	50	20	IDGD	
Cc1ncc(Br)c(C(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)n1	1327171528	JTWOANXINHQGHS-UHFFFAOYSA-N	428.268	1.418	50	20	IDGD	
Cn1cccc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](F)Br)C2)c1=O	1780770397	LSYASYYQYJVQLC-QWQRMKEZSA-N	444.301	1.203	50	20	IDGD	
COc1cc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](F)Br)C2)nn1C	1780773690	LZVSQUVULCADTO-HACGYAERSA-N	447.305	1.247	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)/C=C/C(=O)NCc3ccccc3)CCO2)C1	1781211517	WUWCMOSEXNFHDR-PSQWMWCVSA-N	433.936	1.706	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4c(c3)NC(=O)CC4)C2)C1	1782515077	QOOJALLAOUEURY-KKSFZXQISA-N	435.908	1.269	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(CO)c(F)c3)CCO2)C1	1783352773	IFLKSPRQXRIZBU-DNVCBOLYSA-N	443.313	1.935	50	20	IDGD	
COC(=O)C12CC(C(=O)N3CC[C@]4(C3)CN(C(=O)[C@](C)(Cl)CCl)CCO4)(C1)C2	1783444914	KIPWJYSKTYSNSU-UGXKVIGPSA-N	433.332	1.396	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(OC(F)F)cn3)CCO2)C1	1783531900	FJCCFAIWAIAIRQ-PIGZYNQJSA-N	448.264	1.910	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cccc(-n4cncn4)c3)CCO2)C1	1783535299	BHRQYBKYPZDEQS-IFXJQAMLSA-N	448.321	1.494	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)CCN3Cc4ccccc4C3=O)CCO2)C1	1783875546	RNPJAHCJYANYDF-GCJKJVERSA-N	449.935	1.116	50	20	IDGD	
CC#C[C@@H](CC(=O)N1CCO[C@]2(CCN(C(=O)[C@H](Cl)COC)C2)C1)c1ccc(O)cc1	1783879151	PDCQPJHKXULPFL-JXHRLWIKSA-N	448.947	1.973	50	20	IDGD	
Cc1ccc2[nH]c(C(=O)N3CCO[C@]4(CCN(C(=O)CCC(=O)NN(C)C)C4)C3)cc2c1	1783935643	XBRACZTZOGJAEV-QHCPKHFHSA-N	441.532	1.293	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3cnc4[nH]ccc4c3)C[C@@H]21)[C@@H](O)CCl	1784093830	GRGCSZTWZPBOFC-XSLAGTTESA-N	434.924	1.075	50	20	IDGD	
COc1ccc([C@@H]2C[C@@H]2C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](O)CCl)C[C@@H]32)cc1	1784424948	FEBDVBMALBTOFL-YFFHVDCVSA-N	436.936	1.378	50	20	IDGD	
C[C@@H](Cn1cncn1)C(=O)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1	1788142362	TVXPCBQJOWWEQY-INIZCTEOSA-N	447.304	1.042	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)c1cc2cn[nH]c2cn1	1788467311	SUQPACDYOVOPHY-LHAJWOIZSA-N	440.273	1.242	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(=O)ccn3C)[C@H]2C1	1789226129	BEDUFSPYZUEFTH-QEWYBTABSA-N	440.338	1.152	50	20	IDGD	
Cc1ccc([C@@H](C)C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]3C2)cc1	1791293263	QQVHRLLTGZZPEO-HZEGPAAWSA-N	444.576	1.451	50	20	IDGD	
C[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]2C1)[S@@](=O)c1ccccc1	1791295874	JXJQTICQPJNATN-DYFDTACBSA-N	447.384	1.966	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1	1791567866	JGHGMYCMZMWUBJ-SFHVURJKSA-N	430.697	1.368	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccccc3NC(C)=O)[C@H]2C1	1792002994	DTAJPEYRAZAUTC-XPYUAMARSA-N	437.924	1.492	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CNC(=O)c3ccc(C)cc3)[C@H]2C1	1792252262	SQCIZXPRZIXFMY-VJANTYMQSA-N	435.952	1.722	50	20	IDGD	
COc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Br)C3)cc1F	1792678916	NKCUFUVYSMJJQJ-BAESOJJISA-N	433.249	1.728	50	20	IDGD	
Cc1ccc(O)c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)CBr)c1	1792872512	LNNWFZTZNSXGHV-ZJOBFFGXSA-N	425.323	1.935	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(-c3cccs3)on1)C2)[C@@H](O)CCl	1792980776	MYLHQQBGPCOCSI-DZJQYVJYSA-N	425.894	1.206	50	20	IDGD	
CC(C)(C)OC(=O)N1C(=O)CC[C@@H]1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCl	1793116115	GLLHKBAAKHZOSM-XLWJZTARSA-N	443.928	1.150	50	20	IDGD	
C=CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](O)CCl)C2	1793830339	YLOOJVRETHCSOC-XFIYOXNOSA-N	429.945	1.694	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1ccnc(C(F)F)c1	1794273006	UFOQWTWCJUKNQZ-LFSVMHDDSA-N	436.228	1.913	50	20	IDGD	
Cc1ccn2ncc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)CCC(=O)NN(C)C)C4)c2c1	1796708427	FSLYHBHLCPFQNW-BJWYYQGGSA-N	426.521	1.268	50	20	IDGD	
O=C1COc2ccc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)[C@@H](F)Br)C4)cc2N1	1798112224	ZJGUNEAOGWWGLM-AZKPJATDSA-N	440.269	1.960	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cccc(Cl)n1)C2)[C@@H](F)Br	1799344816	WBYONCXDDUDLEZ-ANGCBRKESA-N	434.693	1.558	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccc(Cl)cc1OC	1800356062	RVIZWDXUQUPKQZ-QHHYFVSCSA-N	445.343	1.735	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)NNc1ccccc1)C2	1800754894	YJMYKSUQPVPPAW-SVZOTFJBSA-N	439.354	1.365	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc(OC)c(F)c1)C2	1800982259	ATEFXOLIHZARJY-NXEZDXNNSA-N	428.888	1.220	50	20	IDGD	
Cn1cnc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)/C(C#N)=C/c2ccc(F)cc2F)n1	1801435800	DOPQVSFIYINTCC-RMWXTBGQSA-N	426.427	1.952	50	20	IDGD	
COC(=O)[C@@H](CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](F)Cl)C2)NC(=O)OC(C)(C)C	1802186115	VZWHEQLJEFUERZ-WPLOAARJSA-N	449.907	1.615	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@H](CNC(=O)c2cccc(=O)n2O)[C@H]1c1cccnc1	1804949043	DRVXCNXHURBEBX-OXJNMPFZSA-N	444.564	1.652	50	20	IDGD	
CN1Cc2ccccc2C[C@H]1C(=O)N1CCCC2(CCN(C(=O)[C@@H](O)CCl)CC2)C1	1806680042	LRXCENNTORHDIY-PMACEKPBSA-N	433.980	1.874	50	20	IDGD	
Cc1noc(CC(=O)NC[C@@H]2CCN(C(=O)CO[Si](C)(C)C)[C@@H]2c2cccnc2)n1	1807525940	SNQSLTNGHSUOEX-OXJNMPFZSA-N	431.569	1.873	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)c1ccc2c(n1)OCCO2	1808180302	BPBBPQXQOQLIFU-YXJHDRRASA-N	446.891	1.167	50	20	IDGD	
CN(C)C(=O)NCC(=O)N1CC[C@H](CNC(=O)[C@@H](F)Br)[C@H]1c1cccnc1	1808649258	LYLTWHMPHZLFSH-BPLDGKMQSA-N	444.305	1.049	50	20	IDGD	
N#Cc1ccc(CC(=O)N2CCC3(CCCN(C(=O)c4ccc(B(O)O)cc4)C3)CC2)cc1	1809968417	WOJVDCOVTWYCHE-UHFFFAOYSA-N	445.328	1.326	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)[C@H](C)Br)[C@@H]1c1cccnc1	1810533382	OOOGBMVMIPJRKR-UICACZKSSA-N	437.338	1.562	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)[C@@H]2CCC(=O)N2)[C@@H]1c1cccnc1	1812774699	CWWLAUBMLLZFIH-WBTNSWJXSA-N	437.338	1.540	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)CSCC(=O)O)[C@@H]1c1cccnc1	1813033855	VJEYCMDEUOIGSS-GRDNDAEWSA-N	429.926	1.159	50	20	IDGD	
C[C@]1(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)CC1(F)F	1814073312	AZEMHVZLWCLIOW-YRISNDGFSA-N	443.259	1.126	50	20	IDGD	
O=C(CNc1ccc(F)cc1)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](O)CCl)CC2	1814832080	RJDCNBKGNIEQJT-JSGCOSHPSA-N	426.901	1.906	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](N)CCC(N)=O)n[nH]1	1817246114	WFXMJEQSHJYZEG-MDZLAQPJSA-N	443.346	1.026	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cncs2)[nH]n1	1819402042	KALCLQILXXJIMW-CQSZACIVSA-N	440.489	1.484	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)n2)[nH]n1)[C@H](F)Br	1820931934	BHMOPLOEUSDPOK-SKDRFNHKSA-N	443.233	1.607	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](F)Br)CC2)c1cc(CO)on1	1821704142	OJEJVEBIPPIVHA-KGFZYKRKSA-N	433.259	1.540	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(O)cc2F)[nH]n1	1822415710	RHYDROVBEHNMMC-KRWDZBQOSA-N	446.483	1.933	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cnco2)CC1	1824733798	FTFMHXUZWSXIKE-KRWDZBQOSA-N	426.477	1.220	50	20	IDGD	
Cc1ccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)nc1C	1825620363	QJAHSEGKEDDPOR-HSZRJFAPSA-N	449.360	1.925	50	20	IDGD	
O=C(Cn1cnc2ccccc21)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)CCl)CC2	1825846536	SYGDVOUWGMLPCW-ABAIWWIYSA-N	433.921	1.705	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H]1CCc3nc[nH]c3C1)CC2	1826008825	IAJZOVSIXBZKPF-TUAOUCFPSA-N	437.953	1.837	50	20	IDGD	
Cc1ccn(C)c1C(=O)N[C@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1	1826088853	QPXZBXXDABOMML-ZDUSSCGKSA-N	432.550	1.389	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1	1826089694	LTPHGWWTAACDMD-VHSXEESVSA-N	446.371	1.212	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)c2ccc(F)cn2)CC1	1826138115	AUVRLYSMWNFNBW-OAQYLSRUSA-N	439.296	1.448	50	20	IDGD	
Cc1cc(C)nc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)c1	1827054783	JTWJFZNWCBYMKB-HSZRJFAPSA-N	449.360	1.925	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)CC[C@H]3CCOC3)sc2C1	1827329408	ORYPPIAOSXYITB-UONOGXRCSA-N	437.566	1.245	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CN2CC(=O)NC2=O)CC1	1830313845	ORHYWXNIUUYIFZ-IFXJQAMLSA-N	447.363	1.394	50	20	IDGD	
COc1ccc([C@H](C)C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)cc1	1830450897	USCSGMVPYFYEHT-JNAXZKDPSA-N	428.888	1.790	50	20	IDGD	
O=C1C[C@H](C(=O)N2CCCC[C@H]2C2CCN(C(=O)[C@@H](F)Br)CC2)CCN1	1831942426	VUOJJRMLKLRXIO-IJEWVQPXSA-N	432.334	1.823	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)C2(F)CCC2)CC1	1832504604	NUPWXVFBLCIBBO-SFHVURJKSA-N	431.512	1.811	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)C3CCC(CO)CC3)CCO2)C1	1832513778	AVCILKIBCFMFJA-PKZBPHAMSA-N	430.973	1.649	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3nsnc3NC)CC2)CC1	1833073429	RRGYBFRLJMJIOZ-AWEZNQCLSA-N	428.990	1.782	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(CN(C(=O)/C=C/c3cccnc3)CCO2)C1	1833102325	NPMNGJSHWYKXMT-BXKJMJEDSA-N	433.581	1.403	50	20	IDGD	
CC(C)N1CCC(C(=O)NC2CCN(C3CCN(C(=O)[C@H](O)CCl)CC3)CC2)CC1	1833697434	UUHGGZWNPRWCOV-HXUWFJFHSA-N	443.032	1.278	50	20	IDGD	
Cc1cccc(CCC(=O)NC2CCN(C3CCN(C(=O)[C@H](O)CCl)CC3)CC2)n1	1833743762	TUXZFVHTTBAPGV-HXUWFJFHSA-N	436.984	1.494	50	20	IDGD	
Cc1nocc1C(=O)NC1CCN(C2CCN(C(=O)[C@H](C)Br)CC2)CC1	1834250081	ZZGCNBUEXAJLOF-LBPRGKRZSA-N	427.343	1.952	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3cnc(N)s3)CC2)CC1	1834768511	ZLMKWCYLLJNGGE-NSHDSACASA-N	444.399	1.694	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCC(N2CCC(NC(=O)Cn3ccnn3)CC2)CC1	1834897790	RLAHOLVIAVTESF-SFHVURJKSA-N	431.368	1.086	50	20	IDGD	
C[C@@H](Cn1cncn1)C(=O)NC1CCN(C2CCN(C(=O)C(C)(C)CCl)CC2)CC1	1835805400	FFCSAVKPFQULIL-INIZCTEOSA-N	439.004	1.751	50	20	IDGD	
Cc1ocnc1C(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)Br)CC2)CC1	1836011788	KSUBJOROXIPYGM-GFCCVEGCSA-N	427.343	1.952	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC(N2CCC(NC(=O)c3ccnnc3O)CC2)CC1	1836062647	KGZBZXOMDOOHGP-UHFFFAOYSA-N	435.601	1.219	50	20	IDGD	
C[C@@H](Oc1cccnc1)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836719621	ATCUCDWCMLHQCG-BEFAXECRSA-N	439.940	1.447	50	20	IDGD	
O=C(c1cc2cnccc2[nH]1)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1837105925	GAQXJNODHYSYPI-SFHVURJKSA-N	427.288	1.437	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)CCN3CCN(C)CC3)CC2)CC1	1837806515	RSLXAUINCBLZJQ-HXUWFJFHSA-N	443.032	1.640	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(O)c(OC)c3)CCO2)C1	1838972660	OTTZTOYUILYBJQ-HRAATJIYSA-N	440.924	1.878	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)C(=O)c3ccco3)C2)C1	1839150782	XJXUSSUUHIPFRC-ROUUACIJSA-N	433.288	1.155	50	20	IDGD	
CCc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)no1	1839153256	DKXCSVJBFCCMGD-ROUUACIJSA-N	434.320	1.543	50	20	IDGD	
CCc1noc(C)c1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2	1839153810	SMRFBHSOWCHENN-MOPGFXCFSA-N	448.347	1.852	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCCn3ccnc3)C2)C1	1839154906	BQBPGAVDSWTFLE-MOPGFXCFSA-N	447.363	1.356	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccccc3O)C2)C1	1839155400	SHHQFIZQVJDIBG-UXHICEINSA-N	445.343	1.627	50	20	IDGD	
N#Cc1cccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)c1	1839201600	BVMJQYNWMQLNLE-QAPCUYQASA-N	440.269	1.319	50	20	IDGD	
CCOc1cccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)c1O	1839426476	XIPNSEUUKQQUFW-VQIMIIECSA-N	430.860	1.395	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3c[nH]cc3C)C2)C1	1839964084	FVBAAQHZWMSPDR-YJBOKZPZSA-N	428.327	1.567	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(F)nc3)C2)C1	1839964765	BUQVNONJBQGMGB-KBXCAEBGSA-N	444.301	1.464	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(F)ccc3F)C2)C1	1840154358	VEANBQRPOATYEY-DNVCBOLYSA-N	432.851	1.289	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H](C(=O)N2CC3(CCCN3C(=O)[C@H](O)CCl)C2)C[C@@H]2C[C@@H]21	1841348718	ZNABXKCAYSTELK-ZQDZILKHSA-N	427.929	1.187	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](C(=O)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1)C(C)(C)C	1841351086	LONNVANKKMCHAH-UONOGXRCSA-N	431.961	1.729	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H]1CCC(=O)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1	1841351239	JTOLEULMMUSMDJ-HZPDHXFCSA-N	443.972	1.969	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@H](F)C[C@H]1C(=O)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1	1841354553	GVBSOPFNWYLEDK-MELADBBJSA-N	433.908	1.137	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)Cc2ccc(F)cc2Cl)C1	1841834170	FSGCUWIZQAYJCS-UHFFFAOYSA-N	445.882	1.537	50	20	IDGD	
O=C1CCCc2cc(C(=O)N3CC4(CCCN4C(=O)c4ccc(B(O)O)cc4)C3)ccc21	1843011226	GAXFIZFOPPIJKU-UHFFFAOYSA-N	432.285	1.016	50	20	IDGD	
COc1ccc(/C=C/C(=O)N2CC3(CCCN3C(=O)c3cccc(B(O)O)c3)C2)c(F)c1	1843015092	HKBBMXZFCCNITA-VQHVLOKHSA-N	438.264	1.045	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC12CN(C(=O)CNC(=O)c1cc(C)on1)C2	1846071091	WFDPVDRJGHODLI-LBPRGKRZSA-N	427.299	1.090	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1CNC(=O)NNC(=O)c1cn(C)c2ccccc12	10260237	NQDYZRVZUOUXAW-UHFFFAOYSA-N	429.502	1.573	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)c1cccc(N2CCCS2(=O)=O)c1	21408818	LXTZDUUFQLGNPG-UHFFFAOYSA-N	427.280	1.392	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1cccc(OC[C@@H]2CCCO2)c1	26352588	ZHACBSODOTYAIM-KRWDZBQOSA-N	446.529	1.921	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c(C)n1CC(F)(F)F	27070976	CNYIGJLRIKUWOT-UHFFFAOYSA-N	446.451	1.992	50	20	IDGD	
Cc1nc2ncnn2c(C)c1CCC(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	726867581	OILICDIOEFSNDF-UHFFFAOYSA-N	429.506	1.258	50	20	IDGD	
C#Cc1cccc(NC(=S)NNC(=O)c2cc(Cl)c(-n3cnnn3)cc2OC)c1	727499169	DJVYYHHQLKUUCQ-UHFFFAOYSA-N	427.877	1.937	50	20	IDGD	
CON(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cccc(OC(F)F)c2)c1	728488233	QOVLHDFUIJQXJI-UHFFFAOYSA-N	429.401	1.545	50	20	IDGD	
O=C(COC(=O)CCc1nc(-c2ccsc2)no1)NNC(=O)c1cccc([N+](=O)[O-])c1	729920438	AFRJEHCTFJBJQA-UHFFFAOYSA-N	445.413	1.643	50	20	IDGD	
CCn1nc(C(=O)NN=Cc2ccc(OCC(=O)O)c([N+](=O)[O-])c2)c2ccccc2c1=O	731557140	BCISTPVWHDRUEM-UHFFFAOYSA-N	439.384	1.552	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)[C@H]2CCCN(C(=O)c3ccc(F)cc3)C2)C[C@@H](C)O1	732264805	XAICHVKMPJODRM-JZXOWHBKSA-N	434.512	1.325	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)c1cc(S(N)(=O)=O)ccc1Br	732305220	DKNPLTUPDYUROZ-UHFFFAOYSA-N	448.320	1.257	50	20	IDGD	
COc1ccc2c(c1)C[C@@H](C(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)CO2	732328098	OKVLFGIFLRQORC-CQSZACIVSA-N	429.385	1.159	50	20	IDGD	
Cc1cc(C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)ccc1N1CCNC1=O	732331297	YKRYAFNOGCXSAK-UHFFFAOYSA-N	441.400	1.051	50	20	IDGD	
Cn1c(NNC(=O)CNS(=O)(=O)c2ccc(Cl)s2)nc2ccccc2c1=O	733261573	STYUMSLAGITADE-UHFFFAOYSA-N	427.895	1.070	50	20	IDGD	
CCOCCCn1c(NNC(=O)CN2Cc3ccccc3C2=O)nc2ccccc2c1=O	733267649	AETBFVUGYDXVKY-UHFFFAOYSA-N	435.484	1.922	50	20	IDGD	
CCC[C@@H](C)C(=O)NNC(=O)C[C@H]1c2cc(OC)c(OC)cc2CCN1S(C)(=O)=O	733358190	QDQASAKTUYKPHI-CJNGLKHVSA-N	441.550	1.536	50	20	IDGD	
COc1ccc(S(=O)(=O)NCCC(=O)NNc2cc(F)c(F)cc2F)cc1OC	734551638	KEUJOMIXDXNIDV-UHFFFAOYSA-N	433.408	1.933	50	20	IDGD	
Cn1cccc1C(=O)NNS(=O)(=O)c1cc2c(cc1Br)CCC(=O)N2	734806781	JAOUEEVBUHXDMX-UHFFFAOYSA-N	427.280	1.296	50	20	IDGD	
COc1ccccc1S(=O)(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	734807005	FTBOVGYFYLJLNO-UHFFFAOYSA-N	428.511	1.587	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNS(=O)(=O)c2ccc(F)c(F)c2)CC1	734807176	JFNUQLCKCIHOSJ-UHFFFAOYSA-N	434.465	1.857	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)NC2CCN(S(=O)(=O)C3CCOCC3)CC2)cc(C#N)n1C	736251111	QZJXVBFGHTWRNK-BOPFTXTBSA-N	445.545	1.202	50	20	IDGD	
O=C(NNC(=O)N1CCN(C(=O)N2CCCCC2)CC1)c1cccc(OC(F)F)c1	736662189	LFMIRXHLSNKOGP-UHFFFAOYSA-N	425.436	1.866	50	20	IDGD	
Cc1cc(NNC(=O)c2ccc3c(c2)S(=O)(=O)N(C[C@@H]2CCCO2)C3=O)nc(C)n1	736718581	OWYJYPYEIQZPLA-AWEZNQCLSA-N	431.474	1.174	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)CN2C(=O)[C@@H]3CCCC[C@H]3C2=O)cc1C	736740593	WUSRXPXGBXUFSE-CHWSQXEVSA-N	435.502	1.098	50	20	IDGD	
O=C(CN1CCC(C(=O)Nc2ccc(O)cc2)CC1)NNC(=O)c1ccc([N+](=O)[O-])cc1	741777570	JYSGKUZUIXQIRZ-UHFFFAOYSA-N	441.444	1.412	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)c2ccccc2Cn2cncn2)c2ccccc2c1=O	742474654	JGNOPDIXVNUVIO-UHFFFAOYSA-N	431.456	1.692	50	20	IDGD	
CC(C)(C)OC(=O)NCc1ccc(C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)o1	742535716	VDMYSRGPOLQMKZ-UHFFFAOYSA-N	437.474	1.783	50	20	IDGD	
Cc1ccc(CN2C(=O)CC[C@@H]2C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1	742635506	RVRSPDNMNMIUCV-LJQANCHMSA-N	436.516	1.340	50	20	IDGD	
COc1cc(C(=O)NNc2nc(-c3ccccc3)no2)cc(NS(C)(=O)=O)c1OC	742658026	JDXVPFTYRSOVMC-UHFFFAOYSA-N	433.446	1.882	50	20	IDGD	
COC(=O)c1ccc(S(=O)(=O)NNC(=O)c2ccccc2O)c(Br)c1	743252095	KFRRUTSWUIBQNS-UHFFFAOYSA-N	429.248	1.565	50	20	IDGD	
CNC(=O)COc1cccc(CNC(=O)NNC(=O)Nc2ccc(OC(F)F)cc2)c1	743542980	XKSIYBMLRUKXDC-UHFFFAOYSA-N	437.403	1.949	50	20	IDGD	
C[C@H]1C[C@H](NC(=O)NNC(=O)c2c(Cl)cccc2Cl)C(=O)N1c1cnn(C)c1	743586056	TWZFCZLNMVMIDZ-ZANVPECISA-N	425.276	1.865	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)/C=C\c1ccccc1)C(=O)NNC(=O)NC1CCCC1	744052479	FDZYLEZNRPISGQ-BHEFUSTPSA-N	440.591	1.971	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1cc(Br)c[nH]1	744620989	KFVRDUMHBISFNK-UHFFFAOYSA-N	429.296	1.555	50	20	IDGD	
Cc1ccc([N+](=O)[O-])c(OCCC(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)c1	744721278	BHRVZVLHZJLQDK-UHFFFAOYSA-N	426.385	1.548	50	20	IDGD	
CCS(=O)(=O)c1ccc(C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)cc1	745835471	KFMUGXMBBLOPAO-UHFFFAOYSA-N	438.531	1.157	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNS(=O)(=O)c2ccc(OCc3ncnn3C)cc2)c1	746591024	HQRJOHZGQJUYFV-UHFFFAOYSA-N	447.473	1.035	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCCC[C@@H]2CNC(=O)c2ccccc2)n1	746678847	ZKYQDXVBCLITCS-QGZVFWFLSA-N	429.546	1.426	50	20	IDGD	
CN(C)CCOc1ccccc1CNC(=O)NNC(=O)c1csc(N2CCOCC2)n1	746725559	FUAIPLKXXGCARX-UHFFFAOYSA-N	448.549	1.064	50	20	IDGD	
Cc1nc(C(=O)NNC(=O)Cc2ccc(Cl)cc2)nn1-c1n[nH]c(C(F)(F)F)n1	747348876	XEONPNGWSPBERV-UHFFFAOYSA-N	428.762	1.370	50	20	IDGD	
COC(=O)c1ccc(OC)c(S(=O)(=O)NNC(=O)c2cc(C)nc3ccccc23)c1	747595844	HJEOOZHRWLVHLH-UHFFFAOYSA-N	429.454	1.962	50	20	IDGD	
O=C(COCc1ccccc1)NNS(=O)(=O)c1ccc(C(=O)O)cc1Br	747619184	UGXDZVIIAZAGJH-UHFFFAOYSA-N	443.275	1.674	50	20	IDGD	
Cn1ccnc(NNC(=O)c2sccc2S(=O)(=O)NC2CCCCCC2)c1=O	747942565	XVOUNONZQWVLJL-UHFFFAOYSA-N	425.536	1.600	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)[C@@H]1CCCN1C(=O)c1ccc2c(c1)OCO2	749468446	DIPKVWOMBFRRNK-BBRMVZONSA-N	443.431	1.774	50	20	IDGD	
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)NNC(=O)CNC(=O)c1cccs1	749588902	PDKWJSVPHRSTLL-RDJZCZTQSA-N	429.546	1.719	50	20	IDGD	
O=C(NNC(=O)N1CCOCC1)[C@@H]1CCCN1C(=O)c1ccc(Br)cc1	749598446	AJMOIOQDKYUDDG-AWEZNQCLSA-N	425.283	1.127	50	20	IDGD	
N#C/C=C(/c1cccc([N+](=O)[O-])c1)N1CCN(S(=O)(=O)c2ccc(C(N)=O)o2)CC1	750037341	YRVLHIMGSKPERH-UUASQNMZSA-N	431.430	1.158	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)[C@H]3CCN(C)c4ccccc43)cc2)CC1	750786932	DRKIDJLXQDIMDO-FQEVSTJZSA-N	443.573	1.690	50	20	IDGD	
CCOc1cc(C=NNC(=O)CNC(=O)c2ccco2)ccc1O[C@@H](C)C(=O)N(C)C	750938986	VKHNWSXVAZHGOB-AWEZNQCLSA-N	430.461	1.414	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)c1cn(-c2ccc(C(F)(F)F)cn2)nn1	751301899	BYACLBUQRKRKNG-UHFFFAOYSA-N	430.350	1.712	50	20	IDGD	
C[C@@H](NC(=S)NNC(=O)CCS(=O)(=O)c1ccc2c(c1)OCCCO2)C1CC1	751619885	YHGASSNBFSDWAU-GFCCVEGCSA-N	427.548	1.306	50	20	IDGD	
COc1cc(OC)cc(N2C[C@H](C(=O)NNC(=O)COc3cccc(C)c3)CC2=O)c1	752398288	FSPSZRZSBDWFEA-OAHLLOKOSA-N	427.457	1.592	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)Nc2cccc(S(C)(=O)=O)c2)c2ccccc2c1=O	755559376	ZSGGURRCSVXXCP-UHFFFAOYSA-N	443.485	1.847	50	20	IDGD	
COc1cc(C)ccc1Oc1ccc(NC(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)cn1	755886378	KZRDFHFCNHTSQX-GFCCVEGCSA-N	437.478	1.281	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)Nc2ccc(OCCC(N)=O)cc2)cc1	756509029	JYFUFNMJVMJTTC-AWEZNQCLSA-N	428.445	1.764	50	20	IDGD	
CNC(=O)Cn1ccc2ccc(NC(=O)NNC(=O)c3cc(Br)c[nH]3)cc21	756762125	OUXAULUATKYKPQ-UHFFFAOYSA-N	433.266	1.944	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(NC(=O)NNC(=O)Cn2ccc3ccccc32)cc1	756784582	OKFQDNWVTQFVPP-UHFFFAOYSA-N	445.501	1.419	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)cc1NC(=O)Nc1ccccc1	758034306	FUUCVILWGYVWTB-ZDUSSCGKSA-N	433.490	1.338	50	20	IDGD	
CC(=NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1cc([N+](=O)[O-])ccc1O	758091960	YENOOYFWLUYART-UHFFFAOYSA-N	448.457	1.475	50	20	IDGD	
COc1ccc2c(c1)C[C@H](C(=O)N1CCN(S(=O)(=O)CBr)CC1)CO2	758528366	SLRZOERVKQTIIT-ZDUSSCGKSA-N	433.324	1.073	50	20	IDGD	
CC(C)(C)[C@H](CN1CCc2ccccc2C1)NC(=O)NNC(=O)C(=O)Nc1ccccn1	758792129	VDUNXTIDDMHPBX-SFHVURJKSA-N	438.532	1.824	50	20	IDGD	
CCOC(=O)c1csc(C2CCN(C(=O)NNC(=O)CNC(=O)c3ccco3)CC2)n1	758956640	JWHCELDPATVHMC-UHFFFAOYSA-N	449.489	1.263	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)NCCc2ccn(C)n2)cc1	760967048	SFULKXRDWXOOME-GHRIWEEISA-N	447.499	1.433	50	20	IDGD	
COc1ncc(NC(=O)CCC(=O)C(C#N)=C2N(C)c3ccccc3N2C)cc1C(N)=O	762536542	NHWMSULRWRDWNS-UHFFFAOYSA-N	434.456	1.798	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)C3=NN(c4ccccc4)C(=O)[C@H](C)N3)n[nH]2)c1	763176361	HFXGRRFXJHDGCE-HNNXBMFYSA-N	445.483	1.793	50	20	IDGD	
O=C(NNC(=O)c1ccccn1)C(=O)Nc1cc(Br)ccc1-n1cccn1	763463330	FTXIGYOIFIAXDT-UHFFFAOYSA-N	429.234	1.430	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cnn(-c3ccccc3F)c2)cc1OC	763544578	ZGHWJAYDLUDAHL-UHFFFAOYSA-N	427.392	1.428	50	20	IDGD	
COC(=O)c1cc(Cl)cc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)c1	763606336	YONUZOVWEJMNIH-UHFFFAOYSA-N	441.831	1.916	50	20	IDGD	
CCOC(=O)/C=C\c1ccc(NC(=O)C(=O)NNC(=O)COc2cccc(C)c2)cc1	763631527	YNGIRVPTNLNWOJ-XFXZXTDPSA-N	425.441	1.736	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(N2CCCC2=O)cc1	763679530	AIKJQRLNSQGONS-UHFFFAOYSA-N	440.456	1.377	50	20	IDGD	
O=C(COc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1cccc(Cl)c1-n1cncn1	763694484	KMEBRJXVRNUGDS-UHFFFAOYSA-N	449.254	1.739	50	20	IDGD	
CNC(=O)c1cc(NC(=O)C(=O)NNC(=O)Cc2c[nH]c3ccccc23)ccc1Cl	763861446	RBQGMOOBQNNYLQ-UHFFFAOYSA-N	427.848	1.510	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cnn(-c3ccncc3)c2)cc1	763864364	BQVVLAVUJJKZEF-AWEZNQCLSA-N	438.444	1.219	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccccc2C(=O)N(C)C)cc1	763872014	IWRVWIZZLVNFAA-AWEZNQCLSA-N	440.456	1.144	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccc(N2CCOCC2)c(F)c1	763872274	MZXUGPYCIYPANJ-ZDUSSCGKSA-N	448.426	1.355	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2cccc3c2CN([C@@H](C)C(C)C)C3)n1	763893416	UXROXXFLMSFNJK-INIZCTEOSA-N	426.521	1.646	50	20	IDGD	
COC(=O)Cc1ccccc1NC(=O)C(=O)NNC(=O)c1ccc(Br)s1	763941650	RKSWCOZTBQZKNQ-UHFFFAOYSA-N	440.275	1.626	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)Nc1cccc2c1OCCC2=O	764002811	SSXYNDUFRPFSOQ-UHFFFAOYSA-N	435.234	1.153	50	20	IDGD	
CN1CCC(N(C)c2ccc(NC(=O)C(=O)NNC(=O)Cc3ccsc3)cc2)CC1	764035110	TZBCTFXPGPGECV-UHFFFAOYSA-N	429.546	1.607	50	20	IDGD	
COc1ccc(S(=O)(=O)C[C@H](C)C(=O)NNC(=O)CSc2ccccc2O)cc1	764045121	BRYWJMUBKNDXED-ZDUSSCGKSA-N	438.527	1.750	50	20	IDGD	
O=C(Cc1ccc2ccccc2c1)NNC(=O)C(=O)Nc1cnn(Cc2ccccn2)c1	764083538	DPHQFLXSOAGPNR-UHFFFAOYSA-N	428.452	1.808	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2O1)C(=O)Nc1cc(F)c(Br)cc1F	764167417	JTTUQRFUVVLEGH-CQSZACIVSA-N	440.200	1.817	50	20	IDGD	
O=C(CCc1ccccc1)NNC(=O)C(=O)Nc1ccc(C(=O)NC2CCOCC2)cc1	764193283	YPYGVMMIIMXBHG-UHFFFAOYSA-N	438.484	1.314	50	20	IDGD	
Cc1ncsc1C(=O)NNC(=O)C(=O)Nc1cccc(N2C(=O)c3ccccc3C2=O)c1	764244184	CMTQYYLHWGOUSY-UHFFFAOYSA-N	449.448	1.652	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)CCc3ccccc3O)cc2)CCO1	764281187	LNDFVCHXHXDNTK-HNNXBMFYSA-N	426.473	1.336	50	20	IDGD	
COCC[S@@](=O)Cc1cccc(NC(=O)C(=O)NNC(=O)Cc2ccccc2F)c1	764318254	FNCGMFLOKPRINN-SSEXGKCCSA-N	435.477	1.049	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C(=O)Nc1ccc(S(=O)(=O)N(C)OC)cc1)c1ccccc1	764329916	QUWCJDDETABOBU-KRWDZBQOSA-N	448.501	1.148	50	20	IDGD	
O=C(NNC(=O)c1cc2ccccc2o1)C(=O)Nc1cc2c(cc1[N+](=O)[O-])OCCCO2	764330423	BWIYIUCMNCPJQR-UHFFFAOYSA-N	440.368	1.902	50	20	IDGD	
O=C(CCc1nc(-c2ncccn2)no1)NNc1c(F)cc(C(=O)NC2CC2)cc1F	764333128	FAOKMTNUFRWGCA-UHFFFAOYSA-N	429.387	1.773	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)C2CCC2)c(C(=O)N2CCCCC2)cc1OC	764340044	YTPBKTDSIRAFTL-UHFFFAOYSA-N	432.477	1.216	50	20	IDGD	
CCS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1	764350407	FJZXTEQKXIYQBQ-UHFFFAOYSA-N	441.469	1.066	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2ccc(N(C)C)c(C)c2)n[nH]1	764376275	BBOGFNGVWCTSCX-UHFFFAOYSA-N	436.472	1.859	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2ccnn2-c2ccccc2)n[nH]1	764378248	WVFWYOPAEWSVOH-UHFFFAOYSA-N	445.439	1.671	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)cc1N1CCOC1=O	764404376	JTOBWHGBLJGZAO-UHFFFAOYSA-N	444.469	1.535	50	20	IDGD	
CSc1ccc2c(c1)CCCC2=NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C	764812631	NUZAWOLZDFOPEU-UHFFFAOYSA-N	426.502	1.012	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](OCC(=O)NNC(=O)CNC(=O)c2cccs2)C1	767933424	PPVTWIJZTUMGRT-ZDUSSCGKSA-N	440.522	1.041	50	20	IDGD	
COc1cc2c(cc1NC(=O)C(=O)NNC(=O)c1ccc(Cl)cc1OC)NC(=O)CC2	768239673	MWLDHAGSRKPUCA-UHFFFAOYSA-N	446.847	1.642	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2ccccc2C(=O)c2ccc(N(C)C)c([N+](=O)[O-])c2)n[nH]1	768279161	VLGZGLQNQQKZBW-UHFFFAOYSA-N	436.428	1.998	50	20	IDGD	
C[C@]1(c2cccc(C(=O)NNC(=O)c3cc(F)ccc3Br)c2)NC(=O)NC1=O	769019430	JHLMEVLBUPCGSK-GOSISDBHSA-N	449.236	1.718	50	20	IDGD	
COc1cc(C=NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)ccc1[N+](=O)[O-]	770614945	KIUCWHIUCCJMQU-UHFFFAOYSA-N	425.445	1.512	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)Nc1ccc(C[C@@H]2NC(=O)NC2=O)cc1	770633230	XFFKCKIFSQMDJM-ZBEGNZNMSA-N	445.863	1.711	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)[C@@H]1CCN(c2ccccc2Br)C1=O	772022433	GNMWWOSBKNUEHG-WDEREUQCSA-N	426.267	1.291	50	20	IDGD	
C[C@H]1CN(c2ccnc(C(=O)NNC(=O)C(=O)NCc3ccc(Cl)cc3)c2)C[C@@H](C)O1	772517518	KJBTVDDGUVUCHZ-OKILXGFUSA-N	445.907	1.426	50	20	IDGD	
CC[C@]1(C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)CCCN1C(=O)OC(C)(C)C	772558752	VCIZANXTFWMTSR-JOCHJYFZSA-N	443.504	1.874	50	20	IDGD	
CCC(=O)c1cccc(S(=O)(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)c1	772860440	CZIQJFKJIVQDRY-UHFFFAOYSA-N	445.906	1.203	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)C(=O)Nc2cc(-c3cc(F)cc(F)c3)nn2C)c1	773525570	UNSLPONUTYMKPR-UHFFFAOYSA-N	442.426	1.831	50	20	IDGD	
COCCCS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2c(F)cccc2F)cc1	773713110	BMHGXJMCESZPDH-UHFFFAOYSA-N	427.429	1.857	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccn(Cc2ccccn2)n1	774002531	QZPQCODKXFTMNX-CYBMUJFWSA-N	442.863	1.533	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)NC(=O)CS2	774010279	SFLQKUDRUIPOKF-JTQLQIEISA-N	448.888	1.938	50	20	IDGD	
C#C[C@@H](NC(=O)NNC(=O)c1nn(CCCCC)c(=O)c2ccccc12)[C@@H]1CCCO1	776226200	DWYNFOIKBONMLT-MSOLQXFVSA-N	425.489	1.712	50	20	IDGD	
C[C@H](NS(=O)(=O)c1ccc(Cl)cc1)C(=O)NNc1cccc(S(C)(=O)=O)c1	776534748	SZDDSKPDTXWATO-NSHDSACASA-N	431.923	1.554	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)nn1[C@@H](C)C1CC1	777275123	RFRWISGXZCQWFL-JTQLQIEISA-N	425.898	1.538	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cccc(OC(F)F)c2)c(OC)c1	782116496	BPKPCYYZAQOXMR-UHFFFAOYSA-N	437.355	1.483	50	20	IDGD	
Cc1cc(C)c(S(=O)(=O)NNC(=O)[C@H]2COc3ccccc3O2)c(C)c1CC(=O)O	782248998	GRNNSJUTRYYOJF-QGZVFWFLSA-N	434.470	1.388	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)C(=O)Nc1ccc(OC(C)C)cc1	782897474	PNEFVRXARGXYOV-UHFFFAOYSA-N	447.517	1.475	50	20	IDGD	
CN(C)CCC(=O)Nc1ccc(NC(=O)C(=O)NNc2ncnc3ccsc23)cc1	783255135	QZVBAEVUSVCGTN-UHFFFAOYSA-N	427.490	1.663	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NN/C=C2/C(=O)NC(=O)c3ccccc32)cc1	783679273	LGVRATJAAGCWAS-LICLKQGHSA-N	434.481	1.653	50	20	IDGD	
CCOc1cc(N2CCN(C)CC2)ccc1NC(=O)C(=O)NNc1ccc(Cl)nn1	784786194	IGXKADJHCMQUQR-UHFFFAOYSA-N	433.900	1.362	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNc2ccc(F)c(F)c2F)c(OC)c(OC)c1	784812887	MXQOEWGISKRSQJ-UHFFFAOYSA-N	427.335	1.990	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNc2cc(F)c(F)c(F)c2)cccc1S(=O)(=O)NC1CC1	785088392	LCXOTIVSPVOYQK-UHFFFAOYSA-N	442.419	1.935	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)[C@@H]1[C@H]2CC[C@@H](O2)[C@@H]1C(F)(F)F	785443415	XFBPBXYAXPRRJD-RWQQGDIJSA-N	440.466	1.702	50	20	IDGD	
Cc1ccc(C(=O)NCC2CC2)cc1NC(=O)C(=O)NNC(=O)c1cc(Cl)ccc1O	785991556	SHKJOFHEJZQGNO-UHFFFAOYSA-N	444.875	1.894	50	20	IDGD	
CCS(=O)(=O)CCn1cc(C)c(NC(=O)NNC(=O)c2ccc3ccccc3n2)n1	786713320	PBHNZFBKAGIMJF-UHFFFAOYSA-N	430.490	1.641	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)NNC(=O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])o1	787424669	KYMOWJWBOQBJEZ-CYBMUJFWSA-N	435.824	1.976	50	20	IDGD	
CCOC(=O)[C@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)NCc1ccc(Cl)cc1	787430599	DSOYIFOVYVGETR-CYBMUJFWSA-N	428.873	1.627	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2ccc(Oc3cccc(F)c3F)nc2)CCS(=O)(=O)C1	787561478	YPAIRPLSYSUTQB-SFHVURJKSA-N	440.428	1.289	50	20	IDGD	
COc1cccc(C2=NO[C@@H](C(=O)N3CCN(S(=O)(=O)CBr)CC3)C2)c1	792299172	BGFAWTWCUFDOCI-OAHLLOKOSA-N	446.323	1.015	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ccc3c(=O)[nH]ccc3c2)c(OCC(=O)N(C)C)c1	793070322	PNSNXRGQFHIXDM-UHFFFAOYSA-N	437.456	1.385	50	20	IDGD	
COc1cc(NC(=O)C(=O)NCCSSC)ccc1S(=O)(=O)N1CCCC1	793079022	KMLSPNGWZQMZBQ-UHFFFAOYSA-N	433.577	1.546	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)c2cn3ccc(Br)cc3n2)c2ccccc2c1=O	794774523	HHEOXMLLTDXKOZ-UHFFFAOYSA-N	441.245	1.419	50	20	IDGD	
Cc1nc(O)c(Br)cc1C(=O)NNC(=O)c1csc(N2CCOCC2)n1	794781432	QETUPNCNPAZDAT-UHFFFAOYSA-N	442.295	1.226	50	20	IDGD	
COC(=O)[C@H](CS(=O)(=O)NNC(=O)c1cccc(Br)c1)c1ccccc1	795335083	UJBRJJGZGNVACN-OAHLLOKOSA-N	441.303	1.970	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)c1cc(S(=O)(=O)C2CCCC2)ccc1F	797730973	XLSXKYHOHQXQJW-UHFFFAOYSA-N	427.498	1.608	50	20	IDGD	
COC(=O)Nc1cccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1C	798029985	PDWTUNOMXKABFS-UHFFFAOYSA-N	449.489	1.890	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@H]2C(=O)NNC(=O)CSc2ccccc2O)cc1	798987549	ZKSPFFCHNGILOZ-INIZCTEOSA-N	429.498	1.945	50	20	IDGD	
CCn1ncc(NC(=O)C(=O)NNC(=O)CSc2ccccc2OC)c1C(F)(F)F	799259465	YUXFNGBXKJHLKE-UHFFFAOYSA-N	445.423	1.809	50	20	IDGD	
C[C@@H](c1ccccc1)N(C)C(=O)CN(C)C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	799856774	FJTBLXIBJCIDJV-HNNXBMFYSA-N	436.476	1.168	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(C(=O)NNc2cc([N+](=O)[O-])ccc2Br)co1	800620095	XCNBYVOGGWVNHD-UHFFFAOYSA-N	433.240	1.958	50	20	IDGD	
CN1CCN([C@H](C(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)c2ccccc2)CC1	802063544	JXZLIGNSCPCSQH-IBGZPJMESA-N	445.545	1.232	50	20	IDGD	
COc1ccc(C2=NO[C@H](CNC(=O)NNC(=O)COCc3ccccc3)C2)cc1F	802343059	UYWYHTYVPNXRTC-INIZCTEOSA-N	430.436	1.875	50	20	IDGD	
Cc1nc(C(F)(F)F)ccc1NC(=O)C(=O)NNC(=O)CSc1ccccc1O	802567044	HGJBCYSHZLCQIV-UHFFFAOYSA-N	428.392	1.993	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)Nc2ccc(F)c(S(=O)(=O)N(C)C)c2)c1	806544218	YIRPUXKVBCPMSU-UHFFFAOYSA-N	438.481	1.925	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)C(=O)Nc1nc(C2CC2)cs1	806972829	NIKCCTAKTWPUFM-UHFFFAOYSA-N	442.545	1.319	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3c(C)c(C(F)(F)F)nn3C)n[nH]2)cc1	806976219	JHRPRWFLSWKGHS-UHFFFAOYSA-N	449.393	1.846	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2c(C)c(C(F)(F)F)nn2C)o1	806977380	GTIMRICUUQWPCC-UHFFFAOYSA-N	444.414	1.582	50	20	IDGD	
COCCOc1ccc(S(C)(=O)=O)cc1NC(=O)C(=O)NNc1ccc(C#N)cc1	806984622	ZBIFGPZWQBBNOO-UHFFFAOYSA-N	432.458	1.069	50	20	IDGD	
CCCS(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)c2ccc(OC)cc2OC)cc1	808088126	AHUIGTTVHWYTGH-UHFFFAOYSA-N	442.515	1.511	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)[C@@H](Cc2cnc[nH]2)NC(=O)CC(C)C)c1C	809961303	DAEPOKKJIOJURO-SJLPKXTDSA-N	429.521	1.715	50	20	IDGD	
O=C(NN=C1CCS(=O)(=O)c2ccc(Cl)cc21)c1csc(N2CCOCC2)n1	812434409	RRWPKQHOYLGXHO-UHFFFAOYSA-N	440.934	1.945	50	20	IDGD	
Cc1cnc(Br)c(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)c1	812979484	VVDNZEGOHUHPOG-UHFFFAOYSA-N	435.234	1.323	50	20	IDGD	
Cn1ncc(C(=O)NNC(=O)c2cccc(OC(F)F)c2)c1I	815387117	WEFKGEXNROBZML-UHFFFAOYSA-N	436.156	1.701	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1nc(CC(F)(F)F)cs1	815565899	DCIWCXZDTAESON-MRVPVSSYSA-N	434.371	1.940	50	20	IDGD	
O=C(COC(=O)c1ccc(C(F)(F)F)cn1)NNC(=O)[C@@H]1COc2ccccc2O1	844261417	QZIPKQMUJFBWDI-AWEZNQCLSA-N	425.319	1.245	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)OCC(=O)NCC(=O)N2CCCC2)c(C)n1C[C@@H]1CCCO1	912619751	QHGXLRMQQGLSNX-FHTAPLDASA-N	442.516	1.473	50	20	IDGD	
Cc1cc(Cl)ccc1OCCCC(=O)NNC(=O)CN1C(=O)[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O	913110593	PTHHWOFISCLIFF-AFHBHXEDSA-N	445.903	1.762	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)NCCC(=O)NNC(=S)Nc2cccc(C)c2)cc1	913454669	XDCBUAVSHMXDBB-UHFFFAOYSA-N	449.558	1.640	50	20	IDGD	
CC[C@@H](C)C(=O)NNC(=S)Nc1cc(S(=O)(=O)N2CCOCC2)ccc1Cl	916018433	FWZDZCRYYVHSOH-LLVKDONJSA-N	434.971	1.725	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)NCc1ccc(N2CCN(C)CC2)nc1	916247279	NFQKDCXUTCUYPL-UHFFFAOYSA-N	426.521	1.305	50	20	IDGD	
CC(C)N(C)Cc1ccccc1CNC(=O)NNC(=O)c1csc(N2CCOCC2)n1	916386648	BVCXKAKZCGNMRY-UHFFFAOYSA-N	446.577	1.964	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CN2CCN(C(=O)Cc3ccc(Cl)cc3)CC2)cc1	917129200	YNYYCJDUBOQWHA-UHFFFAOYSA-N	428.920	1.796	50	20	IDGD	
C[C@@H]1C[C@@H](C)CN(C(C)(C)CNC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)C1	919788598	PUGBVSIMIGFKGD-HUUCEWRRSA-N	428.537	1.634	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)NC[C@H](c1ccc(OC)c(OC)c1)N(C)C	919897888	PAPNUCBYGPYREB-QGZVFWFLSA-N	430.505	1.888	50	20	IDGD	
CCCCNC(=O)NNC(=O)c1ccc(Cl)c(S(=O)(=O)N2C[C@H](C)O[C@@H](C)C2)c1	920765082	STGHFEQPNMRXJC-STQMWFEESA-N	446.957	1.882	50	20	IDGD	
COc1ccc(S(=O)(=O)CCC(=O)OCC(=O)NNC(=O)c2ccc(C)cc2)cc1	1317690941	HNQALYNDUYLWIO-UHFFFAOYSA-N	434.470	1.172	50	20	IDGD	
CS(=O)(=O)Nc1ccccc1CNC(=O)NNC(=O)c1ccc(Br)cc1	1317872378	XLLBLHGQJLGTJM-UHFFFAOYSA-N	441.307	1.965	50	20	IDGD	
CN1CCN(c2ccc(C=NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)cc2F)CC1	1317945058	ZOWMGIYECKXREK-UHFFFAOYSA-N	447.536	1.592	50	20	IDGD	
O=C(NCCCN1CCN(c2ccncc2)CC1)NNC(=O)c1cncn1-c1ccccc1	1318077726	KEFSLTSMCUYXCB-UHFFFAOYSA-N	448.531	1.424	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@H]3CC(=O)N(C)c4ccccc43)CC2)cc1	1319208758	MFQODPLBRLCICP-NRFANRHFSA-N	449.555	1.410	50	20	IDGD	
CC(=O)N1CCC[C@H](CNC(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)C1	1326831663	JLFQIEJQSXLXQQ-OAHLLOKOSA-N	428.493	1.180	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)NCCCN2C(=O)NC(C)(C)C2=O)c1	1347994336	MZFOHTFXFMKEEE-UHFFFAOYSA-N	433.509	1.548	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cccn3c(O)nnc23)C1	1777955726	NYURKBCUBSQGIW-GCKMJXCFSA-N	449.939	1.970	50	20	IDGD	
CC[S@@](=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CO[Si](C)(C)C)C2	1779219375	CXRXGSNIGWTAES-OVBXVEMXSA-N	432.659	1.511	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(CCN(C(=O)c3nc(O)n4c3CCCC4)C2)C1	1779346196	HWDZAZJDPUFCIZ-GOSISDBHSA-N	441.326	1.154	50	20	IDGD	
CCOc1ccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)nn1	1780425231	HXOQDEMPLMGRBN-FZKQIMNGSA-N	441.326	1.350	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)c3cnc4snnc4c3)CCO2)C1	1781231085	GHKNRBLLOCSWGQ-DLBZAZTESA-N	444.344	1.766	50	20	IDGD	
O=C(c1nccc2[nH]ccc12)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781332010	YFIQAOFGOFAFSF-YOEHRIQHSA-N	425.258	1.697	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](F)Br)C3)C2)cc1	1781333967	IXSTWWBRKGBZSP-MAUKXSAKSA-N	442.285	1.779	50	20	IDGD	
O=C(c1ccc([N+](=O)[O-])cc1F)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781334076	UURUFOPPYCOKDE-CZUORRHYSA-N	448.220	1.868	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)NC(C)=O)C1	1781789912	VMKDPXKMCFCQQV-SCFUHWHPSA-N	432.359	1.198	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc3n(n1)CCCC3)C2	1782175305	GIPWWIDGMZCPCH-YRISNDGFSA-N	438.956	1.601	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C=C/c1ccco1)C2	1782209059	IVESFBKJTACWCR-FYNYVBPPSA-N	432.521	1.180	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)c1ccccc1)CCO2	1783343919	XAOARCIYVPGEQF-BXWFABGCSA-N	425.323	1.723	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cc4cccn4cn3)CCO2)C1	1783349504	MNZZEVQPQULSJT-HNAYVOBHSA-N	435.322	1.951	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccc4ccnn4c3)CCO2)C1	1783351500	BFBIJZFTKCBFKT-VQIMIIECSA-N	435.322	1.951	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)C#CC3(O)CCCCC3)CCO2)C1	1783533717	GDZCRKRVYNOOFH-KXBFYZLASA-N	427.339	1.298	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)Cc3ccc([N+](=O)[O-])cc3F)CCO2)C1	1783881490	MWHBIYVBEBJCOL-DNVCBOLYSA-N	443.859	1.360	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)C1(c3ccc(F)cc3)CC1)CCO2	1783933327	HOALRNUVANQAEP-QFIPXVFZSA-N	446.523	1.060	50	20	IDGD	
Cc1cc(C)n(CCC(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)n1	1784321801	SRUPMENNKBTWMU-RDJZCZTQSA-N	431.306	1.410	50	20	IDGD	
COc1ccc([C@@H]2C[C@H]2C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](O)CCl)C[C@@H]32)cc1	1784424946	FEBDVBMALBTOFL-MWVHYEFZSA-N	436.936	1.378	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(C(=O)OC)cc3C)C2)C1	1785279202	OWCKQRJLSGCMPH-DYESRHJHSA-N	438.908	1.479	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)CCc3c[nH]c4ncccc34)C2)C1	1785489021	YPURSYOVIDMQTE-UWJYYQICSA-N	434.924	1.579	50	20	IDGD	
CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)NC1(c2ccc(NC(=O)[C@H](O)CCl)cc2)CCC1	1786138603	NKAZVSKYRBCFRN-QZTJIDSGSA-N	447.923	1.191	50	20	IDGD	
C[C@H](CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]2C1)NC(=O)OC(C)(C)C	1787446051	SVALSEGXWZCKGJ-XSEXMBABSA-N	435.924	1.804	50	20	IDGD	
Cc1nccn1CC(=O)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1	1788150485	PWBXVIDFQGFCMS-UHFFFAOYSA-N	432.289	1.319	50	20	IDGD	
O=C(Cc1cscn1)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1	1788202443	IUTBZKJRHNSPMK-UHFFFAOYSA-N	435.314	1.813	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccn4ccnc34)[C@H]2C1	1788364487	VGZXASFFGRHMIZ-OHFALNGGSA-N	449.349	1.959	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)c1ccc(-c2ccccc2)nc1	1789098636	CSGSOMLOPJLTNT-QIJZPMMNSA-N	443.931	1.942	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc4c3NC(=O)C4=O)C[C@@H]21	1789863343	NTYMPPFFASJFRQ-KSYCFECVSA-N	433.892	1.432	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cn4ncccc4n3)C[C@@H]21)[C@H](F)Br	1789926422	XGLDEMPMXZFMGX-UHXUCMFUSA-N	440.273	1.013	50	20	IDGD	
N=C1NCCN1CC(=O)NC1(c2ccc(NC(=O)[C@H](F)Br)cc2)CCC1	1790534791	RXTKPROOJVVSLY-AWEZNQCLSA-N	426.290	1.651	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1ccc(C2(NC(=O)Cc3ccn(C)n3)CCC2)cc1	1791600031	OYSZMNNGOITRAQ-UHFFFAOYSA-N	426.521	1.470	50	20	IDGD	
C#CC[C@H](NC(=O)OC(C)(C)C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21	1792257972	QZCIPHXNJVSVDJ-QXKUPLGCSA-N	445.919	1.417	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccn3ccnc3c1)C2	1796892467	FUAHZJVFOZWIDX-MVUGMWCJSA-N	447.499	1.720	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2nncn2c1	1797464075	PTBLKTKJPJIJRB-ZFHGCVPZSA-N	426.304	1.169	50	20	IDGD	
CC(=O)OC[C@H](OC(C)=O)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@](C)(Cl)CCl)C2	1798475350	ZNAPAVJOGDQJNM-DTFBLWLJSA-N	437.320	1.356	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc3c(c1)OCO3)C2	1799275099	NGPOGGZTJIPBBC-ZZXMYQEDSA-N	443.327	1.784	50	20	IDGD	
Cn1ncc2cc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@H](F)Br)ccc21	1799346757	ABWCVHKOKVORGO-XRGAULLZSA-N	439.285	1.467	50	20	IDGD	
CC(C)Cc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)Br)n(C)n1	1800756194	HBOIFPSLNNVIJR-ZJOBFFGXSA-N	441.370	1.605	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)NC(=O)c1ccccc1	1802111361	FKUPRZRSBBDYIT-UJCHZGTJSA-N	435.952	1.802	50	20	IDGD	
Cn1ncnc1C(=O)NC[C@@H]1CCN(C(=O)[C@@](C)(Cl)CCl)[C@@H]1c1cccnc1	1805279075	IUMOVYGRLHCZJM-IYOUNJFTSA-N	425.320	1.766	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)C2CC3(CCC3)C2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1	1807373291	APVBGBWEFLIGJG-DENIHFKCSA-N	447.344	1.661	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)c2ccc(O)cc2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1	1807374434	HIBLKQCHFHQICM-KNQAVFIVSA-N	445.284	1.100	50	20	IDGD	
C[C@@H](C(=O)NC[C@H]1CCN(C(=O)C(Cl)Cl)[C@@H]1c1cccnc1)N1CCN(C)CC1	1807902779	IWXWYFXLCULJOC-USXIJHARSA-N	442.391	1.527	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)c1ccc2cccnc2n1	1809724051	WRNSZRGZOXBBOZ-QXAKKESOSA-N	439.903	1.944	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2ccc3nncn3c2)[C@@H]1c1cccnc1	1809910285	GZULGIMGMVTEBK-AYBZRNKSSA-N	442.907	1.698	50	20	IDGD	
COC1(CC(=O)N2CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)CCC1	1813072621	BZYIJKXNCCWBCZ-GCJKJVERSA-N	445.564	1.420	50	20	IDGD	
C=CCNC(=O)/C=C\C(=O)N1CC[C@H](CNC(=O)C(Cl)Cl)[C@H]1c1cccnc1	1813074244	PORGJCLZJHAGLU-DETOXJSWSA-N	425.316	1.750	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H](CNC(=O)CCS(C)(=O)=O)[C@H]1c1cccnc1	1813574778	FFPULZTVVHCLBQ-VQIMIIECSA-N	441.626	1.374	50	20	IDGD	
CN1CCCn2nc(C(=O)N3CCCC[C@H]3c3cc(NC(=O)[C@H](O)CCl)n[nH]3)cc2C1	1814875071	NULHBBUGBITKAX-DLBZAZTESA-N	449.943	1.347	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ncc(F)cc2F)n[nH]1	1815448245	MIOLYLRWJRFAPC-OAHLLOKOSA-N	449.462	1.762	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)CNC(=O)c3ccco3)sc2C1	1815655976	IZUQHDWVURJYIX-MNOVXSKESA-N	440.909	1.332	50	20	IDGD	
Cc1nc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)cs1	1816577652	CCZRBYVRBPNHFR-QGZVFWFLSA-N	439.306	1.474	50	20	IDGD	
CCc1oncc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1	1816607513	WAMZISVTNASKTB-OAHLLOKOSA-N	431.497	1.639	50	20	IDGD	
O=C(CN1CCOCC1)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](F)Br)[nH]n1	1817149071	DXERFVUATNZCNO-WFASDCNBSA-N	432.294	1.425	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)cn1C	1817475097	KMMHNXMIZWTJCQ-IBGZPJMESA-N	435.293	1.356	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)C2CC3(CCC3)C2)[nH]n1)c1ccc(B(O)O)cc1	1817475416	NYDJZJZULDZAOT-IBGZPJMESA-N	436.321	1.976	50	20	IDGD	
Cc1cc(C)nc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)c1	1817475560	UGFGMJPNIDMGMA-FQEVSTJZSA-N	447.304	1.721	50	20	IDGD	
Cc1ccn(C)c1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1	1817477053	XLSKLIAVLBMMFV-GOSISDBHSA-N	435.293	1.356	50	20	IDGD	
C[C@@H]1C[C@@]1(C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819403827	HXOJLOXBFWVJEU-YDZGXFTCSA-N	425.493	1.760	50	20	IDGD	
O=C(/C=C\C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1)NC1CC1	1823008985	YGRDQDSTGQBTHJ-VBMBPTLOSA-N	445.314	1.580	50	20	IDGD	
O=C1CCc2ccc(C(=O)Nc3nc4c(s3)C[C@@H](NC(=O)[C@H](O)CCl)CC4)cc2N1	1824329038	FKDDHFRHKAMXRW-SWLSCSKDSA-N	448.932	1.853	50	20	IDGD	
C[C@H](C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(B(O)O)cc1)CC2)n1cccc1	1826589045	SHPSUWGXNKDRBJ-CJNGLKHVSA-N	438.318	1.111	50	20	IDGD	
O=C([C@H](O)CCl)N1CCC([C@@H]2CCCCN2C(=O)[C@H]2ON=C(c3ccccc3)O2)CC1	1828816293	FYOMKLULDNTKAA-NJNPRVFISA-N	449.935	1.941	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccnc3OCC)CCO2)C1	1829535783	BAHZYWWGUHVWEQ-UTKZUKDTSA-N	439.940	1.958	50	20	IDGD	
Cc1noc(C)c1CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830358467	ODVZGPUWICWSAA-HXUWFJFHSA-N	427.929	1.555	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3nc4ccccc4[nH]3)C2)C1	1830362420	WJLRVCDPADOWQA-NRFANRHFSA-N	434.924	1.898	50	20	IDGD	
N=C1NCCN1CC(=O)N1CCC([C@H]2CCCCN2C(=O)[C@H](F)Br)CC1	1830375699	WLXQQLWWJAQTPY-HIFRSBDPSA-N	432.338	1.137	50	20	IDGD	
COc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)c(Cl)c1	1830737982	JMNRCTRMTGIJOU-APWZRJJASA-N	447.315	1.018	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3csc(C)n3)C2)C1	1831640976	UFLGOHUBFNFDCW-VQIMIIECSA-N	429.970	1.858	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3Cc4ccccc4CN3)C2)C1	1831647695	YBHBPFWUXWHXEK-VIZSFHNOSA-N	449.979	1.565	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccn4nccc34)C2)C1	1831653531	HJKXPFDSIBUOHK-UTKZUKDTSA-N	434.924	1.812	50	20	IDGD	
O=C([C@@H](O)CCl)N1CCC([C@@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)CC1	1832896422	HVLZEPWUSPLLBK-KBPBESRZSA-N	448.010	1.066	50	20	IDGD	
Cc1c(F)ccc(C(=O)N2CCC(N3CCC(NC(=O)[C@H](O)CCl)CC3)CC2)c1N	1833310171	ATVZDJFZRODZCS-GOSISDBHSA-N	440.947	1.501	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)[C@H]3CCNC(=O)C3)CC2)CC1	1833534539	CPMSPOJSMMQDMG-YJBOKZPZSA-N	426.989	1.492	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCC(N2CCC(NC(=O)Cc3ncccn3)CC2)CC1	1833876799	RAFKYGYGHAXBLW-HXUWFJFHSA-N	442.391	1.827	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3csc(N)n3)CC2)CC1	1834752820	OQEOFNNCSOWJNA-LLVKDONJSA-N	444.399	1.694	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccccc3)CCO2)C1	1834997805	NYPJUAHCJUVCEG-WOJBJXKFSA-N	429.344	1.922	50	20	IDGD	
CCCC(=O)N1CCC(N2CCC(NC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CC2)CC1	1835118359	TVYDHMTYMNYZSZ-PCLIKHOPSA-N	430.553	1.492	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)c1ccn2cncc2c1	1835604247	IXJOHOMWCCXPLF-IBGZPJMESA-N	433.940	1.119	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3ccsc3)CCO2)C1	1836007356	INABPRWUHQTCHA-KBXCAEBGSA-N	445.379	1.921	50	20	IDGD	
O=C(/C=N/O[C@H]1CCCCO1)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836716966	BAGSSQJWPWTHRO-KNORYGFTSA-N	445.944	1.114	50	20	IDGD	
O=C(c1cc(C(F)(F)F)ccn1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1838084571	HMZMZCLFBBFGKT-CJNGLKHVSA-N	439.793	1.705	50	20	IDGD	
CCc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](C)CBr)C3)C2)no1	1838121965	RLPSFNZSDWYRHD-ACJLOTCBSA-N	444.326	1.338	50	20	IDGD	
O=C(c1cc(Cl)cc2nn[nH]c12)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1838618628	CWBHFCOZXOGQBE-RHSMWYFYSA-N	446.266	1.216	50	20	IDGD	
C[C@H](C(=O)N1CCC(OC2CCN(C(=O)C(Cl)Cl)CC2)CC1)N1CCN(C)CC1	1838627177	NXLNMRODBLADOW-OAHLLOKOSA-N	449.423	1.425	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(NC(C)=O)n3)C2)C1	1839142701	WOBDLZLWSGYABH-YWZLYKJASA-N	438.912	1.127	50	20	IDGD	
O=C([C@H]1CCC(F)(F)C1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839196957	AHTFXENMEPYGEO-SLEUVZQESA-N	443.260	1.569	50	20	IDGD	
COC(=O)Nc1cccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)c1	1839244907	QEMXJYFXFDXZQI-DNVCBOLYSA-N	443.859	1.469	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3noc(C)c3C)C2)C1	1839962640	MJLSVRZDMLOFBI-RDTXWAMCSA-N	444.326	1.535	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CN3CCCCC3)C2)C1	1839963202	DEHBTMKFRDLVGF-LPHOPBHVSA-N	446.386	1.102	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(O)n3)C2)C1	1839963714	SZLPAUAAKNUDDC-UGSOOPFHSA-N	442.310	1.031	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)Nc3ccccc3)C2)C1	1840153684	XRAXPORQZBUKAQ-PLMTUMEDSA-N	439.940	1.197	50	20	IDGD	
O=C([C@@H](F)Cl)N1CC2(CCCN2C(=O)c2ccc3nnc(Br)n3c2)C1	1843126465	NVAKOFBBCGNLPV-LLVKDONJSA-N	430.665	1.843	50	20	IDGD	
COC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)CO[Si](C)(C)C)C2	1843384514	UZCKSZZPVDRORP-HNNXBMFYSA-N	443.617	1.581	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)Cc1cnccn1)C2	1844691966	SWYZPJZROMGSMW-UHFFFAOYSA-N	439.428	1.370	50	20	IDGD	
Cn1c(=O)n(C)c2cc(C(=O)N3CC4(CCCN4C(=O)[C@H](F)Br)C3)ccc21	1845217603	JUTLRKGIHNTKLC-AWEZNQCLSA-N	439.285	1.385	50	20	IDGD	
C[C@@H](NC(=O)c1ccc(F)cc1)C(=O)N1CC2(CCCN2C(=O)[C@H](F)Br)C1	1845219115	VTAYDJYGNVXXNS-RISCZKNCSA-N	444.276	1.838	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)Cc2ccc(OC)cc2[N+](=O)[O-])C1	1845260715	LEMOHQSJOLWZHW-HNNXBMFYSA-N	425.869	1.603	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)Cn2cnc3ccccc32)C1	1846288411	BJASCGRKOAQVJV-WGOQTCKBSA-N	447.499	1.374	50	20	IDGD	
CCS(=O)(=O)c1ccc(CC(=O)N2CC3(CCCN3C(=O)[C@@H](Cl)COC)C2)cc1	1846364293	ILEKFGPRGBJERC-KRWDZBQOSA-N	442.965	1.480	50	20	IDGD	
Cc1ccc(NC(=O)[C@@H]2CCCN(C(=O)NNC(=O)CNC(=O)c3cccs3)C2)nc1	725872562	DPEBULSFQPJULN-CQSZACIVSA-N	444.517	1.273	50	20	IDGD	
CCOc1cc2c(cc1CNC(=O)NNC(=O)CNC(=O)c1cccs1)O[C@H](C)C2	725873226	VBNCUSUGLPYJKP-GFCCVEGCSA-N	432.502	1.731	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)[C@@H]2CC(=O)N(Cc3ccc(OC)cc3)C2)cc1	726502571	IDFOWVSNTVJDBH-GOSISDBHSA-N	425.485	1.833	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNS(=O)(=O)c2c[nH]c3ncccc23)c1	728508313	MXLGNRBCMWFDRZ-UHFFFAOYSA-N	425.264	1.957	50	20	IDGD	
CC(C)[C@@H](CNC(=O)NNC(=O)c1cc(F)ccc1Br)N1CCOCC1	728742745	NJLJHRGMYFAYJS-OAHLLOKOSA-N	431.306	1.889	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)N2CCC(C(=O)Nc3ccc4c(c3)OCO4)CC2)c1	728954860	PZVUGUZFHUXXGL-UHFFFAOYSA-N	435.440	1.992	50	20	IDGD	
C[C@H]1CCCN(S(=O)(=O)c2cc(C(=O)NNC(=O)c3cccc(N(C)C)c3)n(C)c2)C1	730161270	WVFAVAVUFRBSIC-HNNXBMFYSA-N	447.561	1.587	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2ccccc2OC)ccc1Br	731493542	FAPWFRDPCRPYKV-UHFFFAOYSA-N	443.275	1.868	50	20	IDGD	
COc1ccc(-n2c(C)cc(/C=C(/C#N)C(=O)N3CCN(S(N)(=O)=O)CC3)c2C)cc1	732066054	GSOHVKKSKBQOGK-AQTBWJFISA-N	443.529	1.357	50	20	IDGD	
O=C(NNC(=O)C1CCC1)c1cccc(S(=O)(=O)NCc2ccc3c(c2)OCO3)c1	732142639	GECQJGQNKXUEBK-UHFFFAOYSA-N	431.470	1.455	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)ccc1OCC(=O)OC	733110200	GWLBDXQLEPUKNT-UHFFFAOYSA-N	438.440	1.898	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)[C@H]1CC(=O)N(CC(F)(F)F)C1	734251788	MYDZNQQLEOWUOV-NSHDSACASA-N	436.456	1.617	50	20	IDGD	
COc1ccc([C@H]2[C@@H](C(=O)NNC(=O)COc3ccccc3OC)CCC(=O)N2C)cc1	734417676	IQLOKUSPUVLKNG-JTSKRJEESA-N	441.484	1.840	50	20	IDGD	
CC(=O)c1cccc(S(=O)(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)c1	734807404	OCBGEEBSASIBPE-UHFFFAOYSA-N	440.522	1.781	50	20	IDGD	
CCc1ccc([C@@H](C)C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)cc1	735117580	YGBPRJRGWANATQ-MRXNPFEDSA-N	431.562	1.827	50	20	IDGD	
Cc1nc(-c2ccc(S(=O)(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)cc2)co1	735265966	SBOGKVOPJXIETK-UHFFFAOYSA-N	425.430	1.249	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)c2ccc(S(=O)(=O)Nc3ccccc3Cl)cc2)cn1	735473291	RCRDSPYGFQDLCQ-UHFFFAOYSA-N	433.877	1.949	50	20	IDGD	
Cc1cc(Br)c(N)c(C(=O)OCC(=O)NNC(=O)Cc2nc(C)cs2)c1	735719094	TZNRHAACVSTKBX-UHFFFAOYSA-N	441.307	1.652	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)c2cc([N+](=O)[O-])cc3c2OCCO3)cc1C	736816102	HBXOQTQKAGNLCN-UHFFFAOYSA-N	449.441	1.916	50	20	IDGD	
C[C@@H](C(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)N1CCc2ccccc2C1	740988040	UYYQFECJRCGBGC-AWEZNQCLSA-N	426.429	1.346	50	20	IDGD	
CCN(CC)C(=O)c1ccc(S(=O)(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)cc1	743268379	OJJIISLIJDWEJL-UHFFFAOYSA-N	436.446	1.406	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NC[C@@H](O)c1cnn(C)c1	743521296	RCYXDBJYDLPXBN-IINYFYTJSA-N	426.271	1.014	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)NNC(=O)c2cccc(Br)c2)c1	743685354	CAHBAOCHEFSJCS-UHFFFAOYSA-N	437.250	1.755	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)c2ccc(S(=O)(=O)N(C)C)o2)cc1Cl	743834208	VHNKNCRDNFOQQG-UHFFFAOYSA-N	446.869	1.667	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	744403180	MEBVQQJCHDYGBU-CYBMUJFWSA-N	448.867	1.599	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN(C)C[C@@H]2CCN(Cc3ccccc3)C2)cc1OC	744425700	KKHOXWKRKSZWRM-IBGZPJMESA-N	440.544	1.919	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1)[C@H]1CCOC1	745860853	FGKJHGYFIWZORS-BEFAXECRSA-N	435.488	1.757	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1cccc(C(=O)NNC(=O)N2CCOCC2)c1)c1ccccc1	745992823	LEDFPHUBCGLICE-OAHLLOKOSA-N	432.502	1.413	50	20	IDGD	
CCOc1cc(Br)c(CC(=O)NNC(=O)N2CCOCC2)cc1OCC	745992936	OFQJNJUKHSRAJG-UHFFFAOYSA-N	430.299	1.862	50	20	IDGD	
O=C(NNC(=O)[C@@]12CCC(=O)N1c1ccccc1C(=O)N2Cc1ccccc1)c1ccc[nH]1	747663986	VSBDUUJRGIZZJA-XMMPIXPASA-N	443.463	1.955	50	20	IDGD	
Cc1cc(C(=O)NNc2nccn(C)c2=O)cc(S(=O)(=O)N2CCC(C)CC2)c1C	747943486	ZAZWIDDSEOHICR-UHFFFAOYSA-N	433.534	1.575	50	20	IDGD	
O=C(Cc1cccc(F)c1)NCC(=O)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1	748521755	CVBXHDWHHRTGDC-UHFFFAOYSA-N	433.383	1.921	50	20	IDGD	
O=C(NNc1nc(-c2cccnc2)no1)c1cc(S(=O)(=O)N2CCC2)ccc1Cl	748711691	LBWQNYWNGLAGNJ-UHFFFAOYSA-N	434.865	1.936	50	20	IDGD	
CN1C(=C(C#N)C(=O)COC(=O)c2cccc(CS(N)(=O)=O)c2)N(C)c2ccccc21	748970501	RPGLQRMBYXPWAT-UHFFFAOYSA-N	440.481	1.522	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2csc(-c3ccccn3)n2)cc1OC	749411964	OVPDVABPLSEQSO-UHFFFAOYSA-N	442.453	1.840	50	20	IDGD	
Cc1cccc(NC(=O)N2CCC[C@H](C(=O)NNC(=O)CNC(=O)c3ccco3)C2)c1	751204263	YPRUQPCXWHBKAV-HNNXBMFYSA-N	427.461	1.409	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN(C(=O)c2ccc3n[nH]cc3c2)C1)c1ccc([N+](=O)[O-])cc1	751284095	IASCOEHKSLFLEC-OAHLLOKOSA-N	436.428	1.785	50	20	IDGD	
C[C@@H](CC(=O)NNc1ccc(C(F)(F)F)nn1)NS(=O)(=O)c1cccnc1Cl	755191885	SWGLYWMENKBNAU-QMMMGPOBSA-N	438.819	1.744	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@H](C)[C@H](C)NC(=O)OC(C)(C)C)c2ccccc2c1=O	755312486	LAPXXSLIFZHJLA-OLZOCXBDSA-N	431.493	1.727	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)Nc1cccc(S(=O)(=O)N2CCOCC2)c1	755353865	KXCWJXKBENKABZ-UHFFFAOYSA-N	448.501	1.199	50	20	IDGD	
COC(=O)CCNC(=O)c1ccc(NC(=O)NNC(=O)COc2ccccc2F)cc1	755603538	KIWDEKNZSHYJGM-UHFFFAOYSA-N	432.408	1.350	50	20	IDGD	
COc1ccc(-n2c(SCC(=O)NN=Cc3cn(C)nn3)nc3ccccc3c2=O)cc1	755781924	GSGDDPNVUMIMOC-UHFFFAOYSA-N	449.496	1.765	50	20	IDGD	
CCCc1cnc(NC(=O)C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)s1	756163233	GRDZVEIXXNTEAE-UHFFFAOYSA-N	442.501	1.786	50	20	IDGD	
Cc1csc(Sc2ccc(NC(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)cc2)n1	756172431	AGFVJYHUCFBRJK-SNVBAGLBSA-N	429.549	1.693	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)CCc2ccccc2O)cc1S(=O)(=O)NC1CC1	756682643	OPRZIPOSNGSJIX-UHFFFAOYSA-N	448.501	1.627	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)Nc2ccc(C(N)=O)nc2)c2ccccc2c1=O	757701219	XGMRDADJPYMSKT-UHFFFAOYSA-N	437.460	1.547	50	20	IDGD	
Cc1ccc(CNC(=O)NNC(=O)CNC(=O)c2ccco2)c(OC[C@@H]2CCCO2)c1	757733878	RPHUCHHOIGNJAM-INIZCTEOSA-N	430.461	1.406	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)N[C@H]2CN(C3CC3)C[C@H]2C)c2ccccc2c1=O	757789632	IUMJWCLYYOQVMY-KDOFPFPSSA-N	426.521	1.623	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1	758023895	ADVBHQGFKJYTNW-LLVKDONJSA-N	436.877	1.703	50	20	IDGD	
O=C(NNc1nc(O)c2ccccc2n1)c1cccc(CN2CCS(=O)(=O)CC2)c1	758295947	OTAMWLXAJIIEGB-UHFFFAOYSA-N	427.486	1.323	50	20	IDGD	
C[C@]1(CNC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)CCCS1	758862902	ZGQJIGYRVSIDOR-GOSISDBHSA-N	426.564	1.701	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)[C@H](CCSC)NS(=O)(=O)c2ccccc2)nc1	759726359	WOUHNHGTFWFDAU-HNNXBMFYSA-N	438.531	1.412	50	20	IDGD	
COc1cc(N2CCN(CC(=O)NNC(=O)c3ccc(F)cc3)CC2)cc(OC)c1OC	759876929	DCBJOLQXYSOYNK-UHFFFAOYSA-N	446.479	1.435	50	20	IDGD	
O=C(NNC(=O)c1ncc(F)cc1F)c1cccc(S(=O)(=O)NCc2ccccc2)c1	760052786	FPGORUJOUFFGNN-UHFFFAOYSA-N	446.435	1.913	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)Nc1ccc(CN2C(=O)CCCC2=O)cc1	760955357	ZGOMFWRKRBEMGS-SFHVURJKSA-N	438.440	1.718	50	20	IDGD	
Cc1oc2ncnc(O)c2c1C(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	763283176	QTMQVASWIGUXOS-UHFFFAOYSA-N	434.453	1.486	50	20	IDGD	
O=C(CSc1ccccc1O)NNS(=O)(=O)c1cc2c(cc1F)NC(=O)CC2	763411547	HTUODUSLRYMNDX-UHFFFAOYSA-N	425.463	1.518	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)C(=O)Nc1cc(C2CC2)nn1-c1ccccc1	763549400	ZQVVVUYPAUEGNU-UHFFFAOYSA-N	433.424	1.878	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)Nc1csc(-c2ccccn2)n1	763570597	GTWMYHXVCQJWAW-CQSZACIVSA-N	425.426	1.131	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)OCC(=O)N3)c(C)n1-c1ccccc1	763602155	PLHLYMHTTZOQME-UHFFFAOYSA-N	447.451	1.825	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(N3C[C@H](C)O[C@H](C)C3)cc2)c1	763618921	JFBDNMZZESFPIB-CALCHBBNSA-N	440.500	1.774	50	20	IDGD	
CCCNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)COc2ccc(C)c(C)c2)c1	763665511	XFRHOBIOQWKANL-UHFFFAOYSA-N	426.473	1.608	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(C(=O)NC(C)C)cc1	763681518	GLFNGZHXCQHRHH-UHFFFAOYSA-N	442.472	1.388	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)ccc1C(=O)N(C)C	763728215	JMOOAIGOJSGCFW-UHFFFAOYSA-N	437.500	1.236	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2ccnn2-c2ccc(Cl)cc2)c1	763771909	HGGYRHIAGXESAO-UHFFFAOYSA-N	443.847	1.943	50	20	IDGD	
CC(C)N(C)c1cccc(NC(=O)C(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])c1	763807341	AGAHIAUWAZAEOO-UHFFFAOYSA-N	429.433	1.604	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccc(CCN2CCCC2)c1	763814499	VOLFYPRBGHXQOO-UHFFFAOYSA-N	435.484	1.361	50	20	IDGD	
COc1cc(-n2cccc2)c(Cl)cc1C(=O)NNC(=O)CNC(=O)c1cccnc1	763819993	IQJUVONLQQFCFZ-UHFFFAOYSA-N	427.848	1.725	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)ccc1Cl	763839803	MCVYHVZXKUNYMT-UHFFFAOYSA-N	437.811	1.821	50	20	IDGD	
CC(=O)N1CCCc2cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc3ccccc3F)ccc21	763849548	KCBGQSYASGBWPV-CYBMUJFWSA-N	442.447	1.678	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)C(=O)Nc1ccc(C(N)=O)cc1F	763850879	BMYURZAHSZREFF-LBPRGKRZSA-N	438.415	1.631	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)cnn1-c1ccccc1	763865190	JINYYWVVAKFBJY-AWEZNQCLSA-N	425.420	1.873	50	20	IDGD	
COc1ccc2cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc3ccc(F)cc3)ccc2n1	763867879	YMVHVHNEVHHEIB-GFCCVEGCSA-N	426.404	1.936	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)C(=O)Nc1cc(C)c(=O)n(C)c1	763900138	GHDNIJSPHFDMOJ-UHFFFAOYSA-N	425.470	1.525	50	20	IDGD	
O=C(NNC(=O)c1ccc(Br)s1)C(=O)Nc1cccc(Cn2cncn2)c1	763941894	YPYDRKCNUGXNSJ-UHFFFAOYSA-N	449.290	1.550	50	20	IDGD	
Cc1cnc(-c2cccc(NC(=O)C(=O)NNC(=O)c3nn(-c4ccccc4)cc3O)c2)o1	763950169	UKSIEBWEBLQTEK-UHFFFAOYSA-N	446.423	1.941	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1cccc(N2CCN(C(C)C)CC2)c1	764040711	JYIOQLLGQDDAEA-UHFFFAOYSA-N	439.516	1.625	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1cc(N2CCNC2=O)ccc1Cl	764048222	LJQVXYNFGPXZMG-UHFFFAOYSA-N	431.836	1.278	50	20	IDGD	
CCOC(=O)c1cc(Br)ccc1NC(=O)C(=O)NNC(=O)C1CCCC1	764069139	SNUUVRRLXUWRFN-UHFFFAOYSA-N	426.267	1.902	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccccc2OC)cc1C	764135945	KBWHRMCYCPPVLI-UHFFFAOYSA-N	448.501	1.094	50	20	IDGD	
Cc1cc(C(=O)NCC(C)C)ccc1NC(=O)C(=O)NNC(=O)[C@H]1Cc2ccccc2O1	764163343	IUEITKOZAFAILD-LJQANCHMSA-N	438.484	1.470	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)C(=O)Nc1cccc(CN2CCCCC2=O)c1	764243708	WVBMOCAEFFARPY-UHFFFAOYSA-N	447.495	1.940	50	20	IDGD	
CCN1CCN(c2ccc(NC(=O)C(=O)NNC(=O)C(C)(C)c3ccccc3)cc2)CC1	764314780	ZFIKYWPEIVUDSE-UHFFFAOYSA-N	437.544	1.892	50	20	IDGD	
CN(C)CCC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)cc1	764346002	QFTUQWKSDBRTGN-UHFFFAOYSA-N	447.879	1.336	50	20	IDGD	
COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	764387751	MXHJBHNNPAMRMD-UHFFFAOYSA-N	442.363	1.532	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1ccc2nc(Cc3ccccc3)oc2c1	764397157	GKLKMXSGUOQTHW-AWEZNQCLSA-N	440.456	1.556	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2F)c(F)cc1F	764411513	ZMMJKFSCFFNLBS-UHFFFAOYSA-N	429.738	1.944	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H]2CCO[C@H](C3CC3)C2)c1	765921273	ZRHGUFIIJBNWLQ-AEFFLSMTSA-N	438.550	1.619	50	20	IDGD	
O=C(NNc1cnccn1)C(=O)Nc1cccc(Oc2ncc(Br)cn2)c1	766257658	ZIIAYFBNRWJUFF-UHFFFAOYSA-N	430.222	1.903	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)C3=NN(CC(C)C)C(=O)CC3)n[nH]2)cc1OC	766654529	NXQLTMGTLJFIJH-UHFFFAOYSA-N	442.476	1.489	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)c1c[nH]c2ncccc12	766664792	ULEWDUIXBHVZSL-UHFFFAOYSA-N	426.908	1.795	50	20	IDGD	
CC(=NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1)c1cc(C(N)=O)n(C)c1	767060419	PMHCFUFYIGSDIX-UHFFFAOYSA-N	442.483	1.980	50	20	IDGD	
CC(=O)N[C@@H](CC(=O)OCC(=O)NNC(=O)Cc1ccccc1C)c1ccc(F)cc1F	767349486	XNPSVWKYKLAUQM-IBGZPJMESA-N	447.438	1.774	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)NCC1(NS(C)(=O)=O)CCCCC1	770128801	UEGSAVVOBLPHFQ-CYBMUJFWSA-N	446.957	1.690	50	20	IDGD	
CSCCNC(=S)NNC(=O)c1cc(S(=O)(=O)NCc2ccco2)ccc1C	770248679	RJEZQDLDVQCINA-UHFFFAOYSA-N	442.588	1.538	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2CC(=O)N(c3c(F)cccc3F)C2)cc1C	770865894	ZPFFZCKGTRVTDI-CYBMUJFWSA-N	430.411	1.721	50	20	IDGD	
Cn1c(=O)nc(O)c2nc(CCC(=O)NNc3ccc(Br)c(F)c3)[nH]c21	771691277	LTJJQRDXBUWRFT-UHFFFAOYSA-N	425.218	1.340	50	20	IDGD	
COc1ccc(C(=O)O[C@H](C)C(=O)NNC(=O)CC(C)C)cc1S(=O)(=O)NC(C)C	771855244	YMAFHKKLNQARCP-CYBMUJFWSA-N	443.522	1.121	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)CNC(=O)c1ccc(Br)s1	772030928	IGURDDZLOPAATG-VIFPVBQESA-N	434.312	1.366	50	20	IDGD	
Cc1nc(COc2cccc(C(=O)NNC(=O)C(=O)NCc3ccc(Cl)cc3)c2)no1	772188869	ZJAOLRZHJHZPHL-UHFFFAOYSA-N	443.847	1.688	50	20	IDGD	
Cc1cc(S(=O)(=O)NCCNC(=O)NNC(=O)c2cc3c(s2)CCC3)c(C)s1	772623434	FUKIZSDHRXHQOH-UHFFFAOYSA-N	442.588	1.838	50	20	IDGD	
COc1ccc(OC)c(NC(=O)C(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)c1	772964871	KHSDLUZJDZMVJT-UHFFFAOYSA-N	429.437	1.386	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)c2cn(CC(=O)C(C)(C)C)nn2)C1	773418251	SRFZDVLEKQIGIF-ZDUSSCGKSA-N	436.513	1.301	50	20	IDGD	
N#CSCCCNC(=O)C1CCN(S(=O)(=O)c2ccc3c(c2)OCCO3)CC1	774296571	HNQIITPFBJPQPS-UHFFFAOYSA-N	425.532	1.579	50	20	IDGD	
CC(C)CN(CC(=O)NNC(=O)c1cccs1)c1c(O)nc(=O)n(CC(C)C)c1N	777606909	WLDVHSYXLHRPMK-UHFFFAOYSA-N	436.538	1.172	50	20	IDGD	
CC(C)CS(=O)(=O)N1CCC(NC(=O)NNC(=O)c2cccc3ncccc23)CC1	777765609	XECSUPYTGFQWRL-UHFFFAOYSA-N	433.534	1.629	50	20	IDGD	
CC(C)(C)Oc1ccc(CNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cn1	778650358	OLEVQLGKKHZLRI-UHFFFAOYSA-N	427.509	1.796	50	20	IDGD	
Cn1c(=O)c2ccc(C(=O)NNc3ccc([N+](=O)[O-])cc3Br)nc2n(C)c1=O	779141221	ZEUNBQWBKVTIPB-UHFFFAOYSA-N	449.221	1.060	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)c1c[nH]nc1-c1cnn(C)c1	780172329	UFXARRGUTXEGSI-SNVBAGLBSA-N	433.266	1.801	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)Nc2cnn(CC(=O)N3C[C@H](C)O[C@@H](C)C3)c2)c1	780584243	LBZVHSFJPHGVJG-KBPBESRZSA-N	430.465	1.454	50	20	IDGD	
CO[C@]1(C(F)(F)F)CCCN(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)C1	780989316	OLVICCHQMJUQNN-QGZVFWFLSA-N	430.431	1.477	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2ccc(NNC(=O)C3(C)COC3)c([N+](=O)[O-])c2)cc1	782552677	QYOCKJNGWVFIKM-UHFFFAOYSA-N	436.446	1.884	50	20	IDGD	
CSc1ccc(C)c(NC(=O)C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)c1	782897664	RWAJTXMVBLPFJZ-UHFFFAOYSA-N	449.558	1.718	50	20	IDGD	
CC(C)Sc1c(Cl)cccc1NC(=O)C(=O)NNC(=O)CNC(=O)c1ccco1	784002528	ROWKXZCXVIAKEI-UHFFFAOYSA-N	438.893	1.949	50	20	IDGD	
O=C(NNc1ccc(Br)cn1)C(=O)Nc1ccccc1CN1CCNC1=O	784341406	ZYCAJPVIDZXKAM-UHFFFAOYSA-N	433.266	1.451	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2cccc(S(C)(=O)=O)c2)n(Cc2ccccc2)n1	784844859	RIRFTHYSXIBKAH-UHFFFAOYSA-N	427.486	1.725	50	20	IDGD	
O=C(NNc1ccc(C(F)(F)F)nn1)C(=O)Nc1cc(N2CCCC2=O)ccc1F	784885879	GMPSYGSJMHQYLU-UHFFFAOYSA-N	426.330	1.843	50	20	IDGD	
CN(C)c1nccc(NNC(=O)C(=O)Nc2ccc(CNC(=O)OC(C)(C)C)cc2)n1	784968799	FEAQRNKKMPBDFX-UHFFFAOYSA-N	429.481	1.649	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)C(=O)Nc1ccnc(Sc2ccccn2)c1	785060238	HGPKPZFTYHVCNY-UHFFFAOYSA-N	447.480	1.604	50	20	IDGD	
Cc1nn(C)c2ncc(NC(=O)C(=O)NNc3c(F)cc(C(=O)NC4CC4)cc3F)cc12	785103847	ICCORTQNXSGDIK-UHFFFAOYSA-N	443.414	1.529	50	20	IDGD	
Cc1ccc(-n2nc(C)cc2NC(=O)C(=O)NNc2nc(C(F)(F)F)cs2)nn1	785145621	KCIMYSVNKHDOEU-UHFFFAOYSA-N	426.384	1.836	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2cc(C(F)(F)F)ccc2F)cc1OCC(N)=O	785166591	IPLNZVCAWFESAV-UHFFFAOYSA-N	444.341	1.799	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2cccc(OC[C@H]3CCCO3)c2)n1	785226044	DIRHWATVFWZLGB-QGZVFWFLSA-N	428.493	1.962	50	20	IDGD	
CCCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNc2nccc(N(CC)CC)n2)cc1	785237163	VRJHXBVZNLUFDB-UHFFFAOYSA-N	449.537	1.556	50	20	IDGD	
O=C(COC(=O)[C@@H]1CC=CC[C@H]1C(=O)N1CCOCC1)NNC(=O)c1cccc(Cl)c1	785712517	IHUCLHKHPJGJFN-IAGOWNOFSA-N	449.891	1.085	50	20	IDGD	
N#CCCCN1C(=O)CCc2cc(NC(=O)C(=O)NNC(=O)CCc3ccco3)ccc21	787888570	CCFTZUMEJGRWAW-UHFFFAOYSA-N	437.456	1.581	50	20	IDGD	
CN1CCN(C(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2ccc(F)cc2)CC1	788165055	IINQDYIJFMAAFG-UHFFFAOYSA-N	435.481	1.228	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(Cl)cc1-n1cccn1	788330554	IRBCQOHOGKICSW-UHFFFAOYSA-N	443.847	1.699	50	20	IDGD	
COc1ccc(C(=O)N2CCN(S(=O)(=O)CBr)CC2)c(OCC2CC2)c1	788526698	WKIGWIBPGHQJIS-UHFFFAOYSA-N	447.351	1.924	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2nc(C(C)(C)C)cs2)c2ccccc2c1=O	789732928	SWOKBTBHSVFRTF-UHFFFAOYSA-N	442.501	1.570	50	20	IDGD	
CCS(=O)(=O)CCn1cc(C)c(NC(=O)C(=O)NNc2ccc(Cl)c(OC)c2)n1	789796874	MSRJBNXJUNZBTQ-UHFFFAOYSA-N	443.913	1.370	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)CCc2ccccc2C(N)=O)CC1	792188585	SOVMYHDGZJIXHI-UHFFFAOYSA-N	433.509	1.448	50	20	IDGD	
CCc1c(NC(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)cnn1-c1ccc(Cl)cc1	792485499	FTVMFCYTOLHAOX-NSHDSACASA-N	425.898	1.676	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c(F)cc1C	793023515	PHMAIEQRKMLNTN-UHFFFAOYSA-N	432.364	1.619	50	20	IDGD	
CCn1ncnc1CNC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	793459221	YIKMOPYNJPLEPT-UHFFFAOYSA-N	449.518	1.305	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)Cn2cnc3c(oc4ccccc43)c2=O)cc1	794732084	USVZFLAFCOTAPD-UHFFFAOYSA-N	441.469	1.536	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2cncc(Br)c2)cc(OC)c1OC	795281457	WHFFAQDUQUNKMS-UHFFFAOYSA-N	446.279	1.493	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)Cc2c(C)nn(C(C)C)c2C)cc1OC	795885643	NGYZAMRDTIRWMK-UHFFFAOYSA-N	432.477	1.645	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)NNC(=O)CNC(=O)OCc2ccccc2)cc1	797625950	ATPQNWBCBUOQCM-UHFFFAOYSA-N	449.489	1.527	50	20	IDGD	
CCOc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NNC(=O)COc1ccccc1OC	799257908	VSTXCQYFCPBOPD-UHFFFAOYSA-N	432.389	1.167	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)NCCNS(=O)(=O)c1ccc(Cl)cc1F	799353161	BVRVBFSZGXZVQP-UHFFFAOYSA-N	428.873	1.710	50	20	IDGD	
C[C@@H](NC(=O)CCc1ccccc1)C(=O)OCC(=O)NNC(=O)c1cccc(Cl)c1	799547928	ZTXNZOXAKLNOJB-CQSZACIVSA-N	431.876	1.782	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)[C@@H]2CCCCN2S(C)(=O)=O)c(OC)cc1Cl	802084933	PQRUNJZFDBEEHH-LBPRGKRZSA-N	434.902	1.324	50	20	IDGD	
O=C(NC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1)NNC(=O)c1ccc2c(c1)OCCO2	802338319	RDQCMSREKZUQCS-MRXNPFEDSA-N	438.440	1.530	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)OCC(=O)c2ccc(S(C)(=O)=O)nc2)c1C	803216171	KMZYFKVEGOUETQ-ZDLGFXPLSA-N	445.497	1.883	50	20	IDGD	
O=C(COCc1ccccn1)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	805192033	WPWHDHZDFNETAN-UHFFFAOYSA-N	431.924	1.217	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)Nc2ccc(F)c(N3CCCNC3=O)c2)c1	806803968	CFPOUHGFPXEQKA-UHFFFAOYSA-N	429.412	1.565	50	20	IDGD	
COc1cc(F)c(F)cc1NC(=O)C(=O)NNC(=O)c1cc(OC)c(OC)c(OC)c1	810385164	NIBLHPUSPNGTCY-UHFFFAOYSA-N	439.371	1.399	50	20	IDGD	
CCOc1cc(Br)c(F)cc1NC(=O)C(=O)NNC(=O)c1ccccn1	810385366	PKCBXHOGWSKQMV-UHFFFAOYSA-N	425.214	1.782	50	20	IDGD	
COC(=O)Cc1occc1C(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	810593594	CPPUKCYNWJGQQM-UHFFFAOYSA-N	448.907	1.227	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1cc([N+](=O)[O-])ccc1O)c1ccc(N2CCCNC2=O)cc1	813241289	BMYFHVLSTOMAAH-LBPRGKRZSA-N	442.432	1.925	50	20	IDGD	
CC(=NNC(=O)Nc1cc(F)cc(F)c1)c1ccc(S(=O)(=O)NCC(=O)O)cc1	815006600	YDPWOHSHGPRRTO-UHFFFAOYSA-N	426.401	1.873	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCc2nncn2C1)C(=O)Nc1cc(Cl)ccc1Br	815692083	IUZMGNLGNORQHZ-QMMMGPOBSA-N	441.673	1.043	50	20	IDGD	
COc1ccc(C(=O)NNc2nc[nH]n2)cc1S(=O)(=O)NCc1ccc(Cl)cc1	816631392	QATDOSKBXHFMJB-UHFFFAOYSA-N	436.881	1.702	50	20	IDGD	
Cc1sc2ncn(CCC(=O)NNC(=O)[C@@H]3COc4ccccc4O3)c(=O)c2c1C	817999781	XENHQUXWWVYIHX-HNNXBMFYSA-N	428.470	1.452	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)c2ccc3c(c2)C[C@@H](C)N3S(C)(=O)=O)c1	825796707	LKIAISSLCODHOJ-CYBMUJFWSA-N	432.502	1.279	50	20	IDGD	
CSC[C@H](C(=O)NNC(=O)COc1ccc(C)c(C)c1)N1C(=O)[C@@H]2CCCC[C@H]2C1=O	864002567	LQPPFRXMXFDSJX-KZNAEPCWSA-N	447.557	1.736	50	20	IDGD	
COc1ccc(/C=C\C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1	912642955	QXYRNVXJBGPCCG-XFXZXTDPSA-N	429.498	1.954	50	20	IDGD	
C=CCn1c(=O)c2ccccc2n2c(SCC(=O)NNC(=O)c3ccccn3)nnc12	912770583	ZJIZFYTYZJQIKG-UHFFFAOYSA-N	435.469	1.179	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNS(=O)(=O)c2cccc([N+](=O)[O-])c2)c1	913108903	WGUUFJYFUWUCAG-UHFFFAOYSA-N	430.236	1.989	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)c2cc(S(=O)(=O)N3CCCCC3)cn2C)cc1	914857722	UYZZTPFOTMEYGY-UHFFFAOYSA-N	449.533	1.081	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c(C)n1-c1nccs1	915188576	ZPAGCDLMNOJEMW-UHFFFAOYSA-N	447.542	1.876	50	20	IDGD	
COc1c(F)cc(CC(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)cc1S(N)(=O)=O	915593707	HTMIHQIHAPEDTA-UHFFFAOYSA-N	439.509	1.388	50	20	IDGD	
Cn1ccnc1[C@H](NC(=O)NNC(=O)c1nnc(O)c2ccccc12)c1ccc(F)cc1	916221159	RJRVNHOZODKXHU-MRXNPFEDSA-N	435.419	1.942	50	20	IDGD	
NC(=O)COc1cccc(NC(=O)NNC(=O)COc2ccc(Br)cc2)c1	916254964	ZGWRLGUGEJCUME-UHFFFAOYSA-N	437.250	1.545	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)c2ccc(F)c(S(=O)(=O)N(C)C)c2)c1	916345105	VGMKWFHRFZWANN-UHFFFAOYSA-N	425.438	1.168	50	20	IDGD	
CCN(CC)[C@@H](CNC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)Cc1ccccc1	916442232	ITLCNHOSWBUGMP-LJQANCHMSA-N	446.573	1.987	50	20	IDGD	
C[C@H]1CCCC[C@H]1OCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	916514337	MMJPAUZYANSYHK-WMLDXEAASA-N	426.539	1.476	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2cnn(Cc3ccccc3)c2)c1	916579382	BIIVHYJENJFYQK-UHFFFAOYSA-N	427.486	1.479	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(CNC(=O)NNC(=O)Cc2c[nH]c3ccccc23)cc1	916646865	SFFZDMIZTDVXMT-UHFFFAOYSA-N	429.502	1.491	50	20	IDGD	
CCCCn1c(C)cc(/C=C(\C#N)C(=O)NS(=O)(=O)c2cc(C(N)=O)n(C)c2)c1C	916788017	DACPLSSGUSFANM-CXUHLZMHSA-N	431.518	1.755	50	20	IDGD	
CNS(=O)(=O)c1ccc(C)c(C(=O)NNC(=O)c2ccc(F)cc2Br)c1	918341734	ZGKDMEILIMVMSJ-UHFFFAOYSA-N	444.282	1.880	50	20	IDGD	
NS(=O)(=O)c1ccc(OCCSCC(=O)NNc2ccccc2[N+](=O)[O-])cc1	918549723	NASNPCCHPPDUGB-UHFFFAOYSA-N	426.476	1.498	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCc2cccnc2-n2ccnc2C)cc(OC)c1OC	919778804	DYMQLTBBTFOCHO-UHFFFAOYSA-N	440.460	1.746	50	20	IDGD	
CN(C)C(=O)C[C@H](NC(=O)NNC(=O)c1csc(N2CCOCC2)n1)c1ccccc1	920047719	UQODAOSEDMSPRS-HNNXBMFYSA-N	446.533	1.143	50	20	IDGD	
CC(C)(C)C(=O)N1CCC[C@@H](C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)C1	920714941	GZJXOKXIAONMCE-CQSZACIVSA-N	434.449	1.184	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCC2CC2)cc1S(=O)(=O)N1C[C@H](C)C[C@@H](C)C1	920859255	RAXZCNOIEMSTKF-ZIAGYGMSSA-N	438.550	1.716	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)c1ccc(N2CCC[C@H](C(N)=O)C2)cc1	1115885906	JWAXBBHFHSKORG-INIZCTEOSA-N	425.489	1.270	50	20	IDGD	
CS(=O)(=O)Nc1cccc(F)c1CNC(=O)NNC(=O)c1cccc2ncccc12	1252794507	VIQGITJUMOBGIL-UHFFFAOYSA-N	431.449	1.890	50	20	IDGD	
O=C(NNC(=O)[C@H](O)[C@H](O)c1nc2ccccc2s1)c1ccc(Br)cc1	1320031269	OTVPOWSWNMPWCL-KGLIPLIRSA-N	436.287	1.914	50	20	IDGD	
C=CC[C@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C1	1778092796	QVWYXTGSUMBDSO-BKISJYPXSA-N	443.548	1.847	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H]1CC(c3ccccc3)=NO1)CCO2	1779294667	WICQTNPHKPOWHT-SIKLNZKXSA-N	445.592	1.861	50	20	IDGD	
C[C@H](Nc1ccccn1)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2	1779330213	TXUWNDBCBUJBQG-KYNGSXCRSA-N	429.348	1.948	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccnnc2O)C1	1779965496	RKSDWICHMQXUSP-FSPWUOQZSA-N	431.320	1.546	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(COC)c[nH]3)C2)C1	1780079158	NACQAIUIEVCELT-RDTXWAMCSA-N	428.327	1.778	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)N1CCN(C)CC1)C2	1780708677	YBLKERZPLPTQGK-XKGFGPFHSA-N	429.005	1.154	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)C[C@@H](O)CNC(=O)OC(C)(C)C)CCO2)C1	1781216488	JLGUECSZPNNOQU-QEEYODRMSA-N	447.960	1.109	50	20	IDGD	
O=C(c1cccc2c1OCCO2)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781329609	HWPGPAMPEZYDOD-QAPCUYQASA-N	443.269	1.592	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(CCN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)C2)C1	1781938094	BQYRUXZJHIRBLX-LJQANCHMSA-N	437.525	1.595	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C23CC(C(=O)OC)(C2)C3)C1	1781962316	JEWQTZGHQJVISW-GJWIZFIESA-N	442.940	1.097	50	20	IDGD	
C=CCC(CC=C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCC(=O)NN(C)C)C1	1782210278	MGMDUKXQABKQTD-AUSIDOKSSA-N	434.581	1.642	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H]1CC[C@@H](C(=O)OC)C1)CCO2	1783343697	OQUQYJWSZUEGSJ-YGTYGHESSA-N	445.354	1.579	50	20	IDGD	
Cc1nc2ncccn2c1C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](C)Br)C2)C1	1783533640	CNJRXWKILGWENZ-SGTLLEGYSA-N	436.310	1.265	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](C)Br)C3)C2)ncc1[N+](=O)[O-]	1783533969	CGIILLAKWVHKGF-SJKOYZFVSA-N	441.282	1.525	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccn(-c4ccccc4)n3)CCO2)C1	1783880622	FAOKEIJBWVXNMO-LAUBAEHRSA-N	432.908	1.570	50	20	IDGD	
O=C(Cc1cc(F)ccc1[N+](=O)[O-])N1CCO[C@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783952130	OBTXTTHEAWZCJH-QGZVFWFLSA-N	434.251	1.910	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)Cc3ccc(O)cn3)C2)C1	1784637476	GXBZDVDFQVVPEA-FZKQIMNGSA-N	426.311	1.191	50	20	IDGD	
Cc1nc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)Br)C[C@@H]32)ccc1F	1785626817	FAPKFILFOOONER-SDPXSBNPSA-N	428.302	1.906	50	20	IDGD	
COc1cccc(C(=O)NC2(c3ccc(NC(=O)c4ccc(B(O)O)cc4)cc3)CCC2)n1	1788140070	DYZWIUJGOGYLHT-UHFFFAOYSA-N	445.284	1.832	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3COc4ccccc4O3)C[C@@H]21	1788764973	DWCLHVRRUTVOLT-CPLUKWAASA-N	448.592	1.658	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)Br)C[C@@H]21	1790964431	PZKMYZKFNFWAFF-NWBUJAPZSA-N	440.176	1.923	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C=C/c3cnccn3)[C@H]2C1	1791697255	QOGKINRMFDPWSU-SWVGCBKASA-N	437.338	1.501	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC1(c2ccc(NC(=O)CCN3CCCC3)cc2)CCC1	1792368085	JFUIQFZHEYKGIZ-UHFFFAOYSA-N	429.565	1.979	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)c1ccco1	1792593380	ZVXJAUPPAOOZNB-QDGRBWDCSA-N	427.461	1.085	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccncn1	1796985164	ZWWZYHAAMLQJAL-QDMKHBRRSA-N	439.428	1.876	50	20	IDGD	
COC(=O)CCCCCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnccc1C(=O)NN	1798443709	YLQKHFDTCFOSRS-MUJYYYPQSA-N	445.520	1.060	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c(c1)OCO3)C2)[C@H](F)Br	1799347766	RLUQYGNHYTYWIP-JLUCKKNBSA-N	429.242	1.309	50	20	IDGD	
COc1ccc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Br)cc1	1799347942	VDLHXPOZWBEAOJ-LTCOOKNTSA-N	443.313	1.908	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc(Cl)s1)C2)[C@@H](F)Br	1799348637	NVQROGLVMMQQCY-BKFJMODKSA-N	426.695	1.690	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Br)C2	1800960782	JIZLYELZZYYQMJ-BKQXGZDCSA-N	443.338	1.115	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)COc2ccc(O)cc2)[C@H]1c1cccnc1)[C@@H](O)CCl	1803136561	CVAQCZFZBHRXBG-QSFXBCCZSA-N	433.892	1.472	50	20	IDGD	
Cc1cccnc1C(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1803807001	UGZDIOHJOMBJJY-XMSQKQJNSA-N	438.532	1.478	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC2(CCCN(C(=O)c3cccnc3S)C2)CC1	1804868152	NBIXAWRJWMOHTH-UHFFFAOYSA-N	439.346	1.209	50	20	IDGD	
Cc1cc(C(=O)NC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)no1	1805837407	NXGGJFJFPXKZRZ-KXBFYZLASA-N	449.471	1.010	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)C2=CCCC2)[C@@H]1c1cccnc1	1806212084	BOZNIVCCCWJJIP-PXNSSMCTSA-N	434.500	1.510	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)C2CC(F)(F)C2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1	1807364527	JBBJYWAKURQXOB-APWZRJJASA-N	443.259	1.126	50	20	IDGD	
Cn1nc(C(=O)N2CC[C@H](CNC(=O)[C@H](F)Br)[C@@H]2c2cccnc2)cc1O	1808651209	KHUDPXZYQOATQW-UGFHNGPFSA-N	440.273	1.531	50	20	IDGD	
CC[C@H](C)CC(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1	1810295356	SGSOIQOOANZCAH-XPIZARPCSA-N	438.532	1.836	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)CCSC(=N)N)[C@H]1c1cccnc1	1812864810	RLGOBWJYSNSZAZ-WHOFXGATSA-N	442.383	1.888	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)Cc2ccncc2)[C@H]1c1cccnc1	1813073300	OGOIQWXEXJPMQO-XXBNENTESA-N	438.532	1.098	50	20	IDGD	
CO[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@H]1c1cccnc1	1813105348	KFBGGVHDSWIYBO-YKIPVZCFSA-N	440.504	1.256	50	20	IDGD	
O=C(CSc1nc[nH]n1)NC[C@H]1CCN(C(=O)C(Cl)Cl)[C@@H]1c1cccnc1	1813351853	SRWSQLZRCVIJSX-DGCLKSJQSA-N	429.333	1.802	50	20	IDGD	
COC(=O)[C@H]1CC[C@H](C(=O)N2CCCC[C@H]2c2cc(NC(=O)[C@H](O)CCl)n[nH]2)CC1	1814866980	BQKPKRBYLBLMFQ-DARAHFNDSA-N	440.928	1.981	50	20	IDGD	
O=C(CCN1CCOC1=O)Nc1nc2c(s1)C[C@H](NC(=O)CCBr)CC2	1818691302	RHXQDSMXWMRWLO-SNVBAGLBSA-N	445.339	1.682	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3cc4cn[nH]c4cn3)sc2C1	1819453833	LJXPDMIQIYYUIC-WDEREUQCSA-N	434.909	1.894	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccnc(Cl)n2)n[nH]1	1819749455	WHTROYHTKWLIHI-AWEZNQCLSA-N	448.915	1.532	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)C1CCCC1)CC2	1819795091	HNQTVVALAUGVML-GFCCVEGCSA-N	428.518	1.558	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)CCn2ccnn2)[nH]n1)[C@H](F)Br	1820937115	KWIAHETZJQLNFN-FZMZJTMJSA-N	428.266	1.774	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)ccn1	1822415079	RXMWQCXIVINGAJ-QGZVFWFLSA-N	427.509	1.792	50	20	IDGD	
O=C1CC[C@H](C(=O)N[C@H]2CCc3nc(NC(=O)[C@@H](F)Br)sc3C2)CN1	1822999385	PVWQIGFDHPHHFH-YVZVNANGSA-N	433.303	1.272	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](C)Br)sc2C1	1825640471	AQBWGLBBYOPHIP-OPRDCNLKSA-N	446.371	1.546	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnccn2)CC1	1825802049	CMSJCBLXJCLAEK-LJQANCHMSA-N	437.504	1.022	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(C(N)=O)cc3)sc2C1	1827506888	YDTMGGVZOIYZLR-QWHCGFSZSA-N	436.921	1.722	50	20	IDGD	
C=C1CC(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)CC2)C1	1828921748	AITCXBXKRJJAMM-FQEVSTJZSA-N	425.533	1.885	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cocn2)CC1	1828925951	UVSJMNPVDFNJFH-SFHVURJKSA-N	426.477	1.220	50	20	IDGD	
Cc1n[nH]c(C)c1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1	1829165802	CNJLFNONJWDYNZ-FQEVSTJZSA-N	438.337	1.253	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccc(C#N)cc3)C2)C1	1830354043	RAIVTZRBFPOMIJ-QFIPXVFZSA-N	433.936	1.822	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc(OCF)cn3)C2)C1	1830357999	JRKLFAMQPPFWRI-LJQANCHMSA-N	444.891	1.117	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3CNc4ccccc43)C2)C1	1830359083	LIUCBOCXLZJXRG-JTSKRJEESA-N	435.952	1.917	50	20	IDGD	
CN1C(=O)CC[C@H]1C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H](F)Br)CC1	1830380424	NBPWNTDMFITFHW-IJEWVQPXSA-N	432.334	1.917	50	20	IDGD	
O=C(COc1ccc(O)nn1)N1CCC([C@@H]2CCCCN2C(=O)C(Cl)Cl)CC1	1831879887	IPSZXOKVJPMCQR-ZDUSSCGKSA-N	431.320	1.984	50	20	IDGD	
O=C(c1sccc1F)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1831919378	LWHXQHVTNXFXPQ-SWLSCSKDSA-N	439.278	1.648	50	20	IDGD	
O=C(Cc1c(F)ccc(F)c1F)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1832072835	WGHCMRTUMINCKF-WMZOPIPTSA-N	438.805	1.637	50	20	IDGD	
CC(C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1	1832315702	HWVWVBGYEGIRLO-ZWKOTPCHSA-N	425.353	1.494	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)COc3cccnc3)CCO2)C1	1832672063	NJIWRZXLSODEPA-YLJYHZDGSA-N	425.913	1.324	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3cccc(OC)n3)CCO2)C1	1832762756	GHSDOBIBMSFWJE-DYESRHJHSA-N	439.940	1.497	50	20	IDGD	
Cc1ncc(C(=O)N2CCC(N3CCC(NC(=O)[C@H](C)CBr)CC3)CC2)[nH]1	1833264705	IHXRKHDPSLGGGS-CYBMUJFWSA-N	440.386	1.934	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3ccc(O)cc3F)CC2)CC1)[C@@H](O)CCl	1833313522	JCUVWZCZUDYFFY-SFHVURJKSA-N	427.904	1.316	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NC1CCN(C2CCN(C(=O)[C@@H](F)Cl)CC2)CC1	1833836083	DTCYTVRLPWBVFZ-QGZVFWFLSA-N	444.960	1.584	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)COc3ccccc3)CC2)CC1	1834471925	HCTMYDROLAWUHL-FQEVSTJZSA-N	437.968	1.891	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)c3ccc([N+](=O)[O-])o3)C2)C1	1834820226	QTUIUGXHWUJGAR-INIZCTEOSA-N	446.254	1.043	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cnn(-c4cccnc4)c3)CC2)CC1)[C@@H](F)Cl	1835078439	FTAOVGBFMWYIEN-LJQANCHMSA-N	448.930	1.987	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)CC(F)(F)F)CCO2)C1	1835327775	UXUJILHNHKLKFW-BXUZGUMPSA-N	431.249	1.426	50	20	IDGD	
O=C([C@H]1CC[C@H]2CCC(=O)N2C1)N1CCC(OC2CCN(C(=O)[C@H](F)Cl)CC2)CC1	1838083870	CQFPGAFCVQCCFA-DOXZYTNZSA-N	443.947	1.920	50	20	IDGD	
CC(C)n1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@](C)(Cl)CCl)C3)C2)n1	1838788341	UKMAWACHEUAKQV-RTBURBONSA-N	447.363	1.770	50	20	IDGD	
O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(O)cc1F)CCO2	1839315597	ZGYVNWYACODXHK-SFHVURJKSA-N	445.285	1.386	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc4nccn34)CCO2)C1	1839550080	XTACEZXKTBASMJ-NRFANRHFSA-N	434.924	1.669	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccncc3)C2)C1	1839963212	DSTPTYGUVYYOFT-YJBOKZPZSA-N	426.311	1.325	50	20	IDGD	
Cc1ccc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)cc1	1840031877	FSLZELIIUALGJX-JXFKEZNVSA-N	439.350	1.777	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(Cl)cn3)C2)C1	1840033921	UWUNNTAQKSUNCW-SJKOYZFVSA-N	446.729	1.588	50	20	IDGD	
COc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)cc1	1840034616	REDFVGSHDDGPNQ-IFXJQAMLSA-N	441.322	1.549	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4ccccc4o3)C2)C1	1840152693	PWUMMYBWTUMVRZ-HRAATJIYSA-N	436.892	1.757	50	20	IDGD	
O=C(c1cc(Cl)cnc1O)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840187010	HVVKSCNMFLOKNA-MRXNPFEDSA-N	438.695	1.314	50	20	IDGD	
COc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)ccc1C	1840189324	LAJVCBLBDPEDGH-LJQANCHMSA-N	431.316	1.877	50	20	IDGD	
CC(=O)NC(C)(C)C(=O)N1CCCC12CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2	1841622039	JNTLCWXLDXPAIO-UHFFFAOYSA-N	446.460	1.252	50	20	IDGD	
Cc1cccc(C)c1N1C[C@H](C(=O)N2CCCC23CN(C(=O)[C@@H](O)CCl)C3)CC1=O	1841915123	VDMZCARRHZLQCZ-SJORKVTESA-N	433.936	1.459	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCCC12CN(C(=O)c1ccc(=O)oc1)C2	1841924519	VRTPZJWITPPFBE-AWEZNQCLSA-N	439.896	1.589	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)COc2ccc(C)cc2)C1	1842748818	SATSEPLTPUVOPD-KOEQRZSOSA-N	437.500	1.711	50	20	IDGD	
O=C(c1ccc(Cl)c(Cl)c1)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843011723	KGRKBSZJNJWQID-UHFFFAOYSA-N	433.100	1.804	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1cnccc1N(C)C)C2	1843415601	PUSRQMFXDYYWIJ-MFKUBSTISA-N	437.504	1.099	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)c2ccc(-c3cccnc3)cc2)C1	1845278620	UBGHOMPRGDISDP-UHFFFAOYSA-N	435.528	1.939	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)[C@H]2CCc3ccccc3O2)C1	1846334622	GZMAHJNZDUKJSE-RHKYMZEHSA-N	449.511	1.718	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cnn(C(C)(C)C)c1	1848340945	ZVGJJBIBRXWFJL-YKLHELRZSA-N	439.520	1.588	50	20	IDGD	
Cc1nn(C)c2sc(C(=O)NNC(=O)c3ccc(S(=O)(=O)N4CCCC4)cc3)cc12	10124855	BVKGUZKJBLAVIL-UHFFFAOYSA-N	447.542	1.803	50	20	IDGD	
CCCn1c(CCC(=O)NNC(=O)c2ccccc2)nc2cc(S(N)(=O)=O)ccc21	15826457	IQFRGAVAZBELTM-UHFFFAOYSA-N	429.502	1.488	50	20	IDGD	
COC(=O)c1ccccc1-c1ccc(/C=C(\C#N)C(=O)c2c(N)n(C)c(=O)n(C)c2=O)o1	16881360	IHLUEIIPXRDBIA-ZRDIBKRKSA-N	434.408	1.503	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C2CCN(S(=O)(=O)c3ccccc3)CC2)c1	17198681	UNYAECVMJGOAOR-UHFFFAOYSA-N	431.514	1.622	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)OC)c2)cc1OC	28078109	PTMVWPARNKSVMG-UHFFFAOYSA-N	437.474	1.351	50	20	IDGD	
CC(C)(C)NC(=S)NNC(=O)CCNS(=O)(=O)c1ccc(Br)cc1	28716733	INTKJVMRJCBLCM-UHFFFAOYSA-N	437.385	1.411	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCN(CCOc3ccccc3)CC2)cc1OC	29054120	PSYXYLHYEUMEFD-UHFFFAOYSA-N	442.516	1.161	50	20	IDGD	
O=C(COC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)NNC(=O)c1cccs1	33524549	WTECVZXAGYTDAC-UHFFFAOYSA-N	437.499	1.151	50	20	IDGD	
CN1CCN(S(=O)(=O)N2CCN(C(=O)CCCC[C@@H]3CCSS3)CC2)CC1	106141038	WVKDDEVRFFLTIJ-MRXNPFEDSA-N	436.669	1.337	50	20	IDGD	
Cc1sc2[nH]c(CCC(=O)NNC(=O)c3n[nH]c(=O)c4ccccc34)nc(=O)c2c1C	109066636	UJRHPUXGQAHYQP-UHFFFAOYSA-N	438.469	1.232	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NNC(=O)CCCc2ccccc2)cc(OC)c1OC	727843415	JYKAQUYEBMHFCX-UHFFFAOYSA-N	430.461	1.711	50	20	IDGD	
CCOC(=O)C1=NN(c2ccccc2)[C@@H](C(=O)NNC(=O)CCc2ccc(OC)cc2)C1	728471003	VIYMXKQIKJHYSE-HXUWFJFHSA-N	438.484	1.973	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)C2(c3ccccc3C)CCOCC2)n1	728728775	ATFKLAAQGFVXPU-UHFFFAOYSA-N	431.514	1.741	50	20	IDGD	
CCn1c(NNC(=O)[C@H]2CCN(c3ccc4c(c3)OCCO4)C2=O)nc2ccccc2c1=O	730522232	OPVBGLPHQBXETF-MRXNPFEDSA-N	449.467	1.684	50	20	IDGD	
O=C(COC(=O)c1ccccc1S(=O)(=O)CC(F)F)NNC(=O)c1cccs1	731265931	LTJDBNKCYXFDTI-UHFFFAOYSA-N	432.426	1.405	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)[C@H](C)N1C(=O)c2ccc(Br)cc2C1=O	731492341	GWXNRPXBOZKJBZ-JTQLQIEISA-N	446.257	1.903	50	20	IDGD	
CC(C)(C)C(=O)NNC(=O)N1CCCN(S(=O)(=O)c2cccc3cnccc23)CC1	731499389	SDJIYYRRNNRITR-UHFFFAOYSA-N	433.534	1.718	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)N1CCN(S(=O)(=O)c2ccc(Cl)cc2)CC1	732195737	SAMRHXMLYFRFDW-AWEZNQCLSA-N	430.958	1.228	50	20	IDGD	
Cc1ccc(S(=O)(=O)n2ccc(C(=O)NNC(=O)CCN3C[C@H](C)O[C@@H](C)C3)c2)cc1	732263926	PTYAFCBXSIHFFG-IRXDYDNUSA-N	448.545	1.294	50	20	IDGD	
COCCOc1ccc(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)cc1	732285332	BONDGHUSZTVMDK-UHFFFAOYSA-N	448.545	1.405	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Cc2c(C)nc3nc(N)nn3c2C)cc1Br	732306368	ZWIGCYVKPSJLFA-UHFFFAOYSA-N	448.281	1.098	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)NC2CCN(C[C@@H]3CCCO3)CC2)cc1	734280074	DINAMSSOTUMSHN-JXFKEZNVSA-N	434.537	1.826	50	20	IDGD	
COc1ccc(C=O)c(OCC(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)c1	734417112	KJNLUVZKTVCNHU-UHFFFAOYSA-N	438.440	1.639	50	20	IDGD	
Cc1ccc(F)cc1S(=O)(=O)Nc1cccc(C(=O)NNC(=O)c2cnn(C)c2)c1	735521985	JYBIYTRRIJHSST-UHFFFAOYSA-N	431.449	1.743	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)N[C@H]2CCC[C@@H](S(C)(=O)=O)C2)c2ccccc2c1=O	741092351	CLTYKFJESNWRNP-UONOGXRCSA-N	449.533	1.277	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@H](NC(=O)NNC(=O)CNC(=O)c1cccs1)C1CC1	741275328	MNDKOOJFJVIFEK-LBPRGKRZSA-N	425.511	1.112	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)[C@H]1CN(Cc2ccccc2)CCO1	741424276	BMOQLKPEJCVFEI-HNAYVOBHSA-N	427.461	1.828	50	20	IDGD	
NC(=O)c1ccc(SCC(=O)NNC(=O)C(F)(F)Oc2ccccc2)c([N+](=O)[O-])c1	741596534	SCIPGPDMHNYJEK-UHFFFAOYSA-N	440.384	1.605	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)CNC(=O)c1cccs1)c1nc(-c2cccc(F)c2)no1	743577607	DQGOQIUBMOFZBP-JTQLQIEISA-N	432.437	1.759	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2c(C)nn(C)c2C)c1	745913801	DGEFVAPWESUZMP-UHFFFAOYSA-N	436.538	1.212	50	20	IDGD	
Cc1ccsc1[C@@H]1C[C@@H]1C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	747975394	LLGDFBWAGYZNGI-MSOLQXFVSA-N	426.542	1.765	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)(F)F)cc1)c1cn(Cc2ccccn2)nn1	748518507	KLUUMBOYMBWCOQ-UHFFFAOYSA-N	426.380	1.772	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)CNC(=O)CCc2ccc(C)cc2)c2ccccc2c1=O	749161049	UDNHTEPAOZMSHR-UHFFFAOYSA-N	435.484	1.235	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN1S(=O)(=O)c1cccs1)c1cccc2cccnc12	749224284	PUVWPKSIMKMQGQ-OAHLLOKOSA-N	430.511	1.911	50	20	IDGD	
CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)OCC(=O)NNC(=O)c1cccs1	750410597	SOCRQEBTYHRFFB-INIZCTEOSA-N	446.460	1.420	50	20	IDGD	
COc1cc(NC2CCN(CC(=O)NNC(=O)Cc3nc(C)cs3)CC2)cc(OC)c1	751032697	IYZKPEVFOATIGL-UHFFFAOYSA-N	447.561	1.735	50	20	IDGD	
Cc1nccc(NCc2cccc(C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)c2)n1	755250019	XGTLBSGQYHGMEI-UHFFFAOYSA-N	446.515	1.865	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)Nc1ccc(CC(=O)N2CCOCC2)cc1	755862067	MDDRQNMECFWSBG-UHFFFAOYSA-N	440.500	1.882	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)cn2)C[C@H](C)O1	755865353	RDPFFRSDGSPOFL-KBPBESRZSA-N	437.464	1.137	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(C(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)co1	756012391	LUTHYVQSTVBIEB-UHFFFAOYSA-N	441.409	1.580	50	20	IDGD	
CS(=O)(=O)c1ccccc1-n1cc(NC(=O)NNC(=O)Cc2ccc(F)cc2)cn1	756703581	AGNQAQUIDKRTNR-UHFFFAOYSA-N	431.449	1.810	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Nc2ncn(CC(=O)N(C)C)n2)ccc1OCCC(C)C	756770029	IEIJELBFXFBXAC-UHFFFAOYSA-N	447.496	1.266	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1-n1nnnc1C1CC1	757620273	CCCUDVORDCFAKN-UHFFFAOYSA-N	438.404	1.923	50	20	IDGD	
COc1ccc(C(=O)NNc2nc(O)c3ccccc3n2)cc1S(=O)(=O)NC(C)C	758295813	IQZOLBBPQBEQDX-UHFFFAOYSA-N	431.474	1.788	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)[C@H]2CC(=O)N(c3cc(OC)c(OC)c(OC)c3)C2)nc1	759728445	FMMGMRVNGHYOJB-ZDUSSCGKSA-N	444.444	1.390	50	20	IDGD	
CC(=O)c1ccc(Oc2ccc(C(=O)NNC(=O)N[C@@H]3CCS(=O)(=O)C3)cc2)cc1	761145935	KLGROSDSJRRKBN-MRXNPFEDSA-N	431.470	1.813	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCCOc2ccc(Cl)cn2)nc1	761779847	XBZIMGVQEABPLQ-UHFFFAOYSA-N	442.929	1.866	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(OCC(F)(F)F)nc1	763471861	NWYSUUKBDZDXOJ-UHFFFAOYSA-N	427.295	1.331	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2ccccc2O)cccc1C(=O)N1CCSCC1	763529114	IMXUTLBIWUIERP-UHFFFAOYSA-N	442.497	1.289	50	20	IDGD	
O=C(NNC(=O)c1ccccc1F)C(=O)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1	763555443	DXTQCKLPBDOVLG-UHFFFAOYSA-N	448.476	1.400	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2cc(C)nn2-c2ccccc2F)c1	763624163	SKMPTDWZUVGFBG-UHFFFAOYSA-N	425.420	1.793	50	20	IDGD	
CC(=O)N1CCCc2cc(NC(=O)C(=O)NNC(=O)COc3ccc(C#N)cc3)ccc21	763675475	XBGLJMWOKZQABR-UHFFFAOYSA-N	435.440	1.022	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)C(=O)Nc1ccc(CCN2CCCC2)cc1	763678614	IPPASGUGVBIRQF-UHFFFAOYSA-N	428.464	1.629	50	20	IDGD	
Cc1conc1NC(=O)C(=O)NNC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1	763805028	QUGKJZOFFLBQBK-UHFFFAOYSA-N	431.412	1.630	50	20	IDGD	
CC(=O)Nc1cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)c(F)cc1F	763853069	ZPXYKLBUMBDWBK-VIFPVBQESA-N	438.362	1.616	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccn(CC(F)(F)F)n2)cc1	763876451	DCUPFNFUZDBCKZ-LLVKDONJSA-N	441.366	1.201	50	20	IDGD	
CC(C)CCC(=O)NNC(=O)C(=O)Nc1ccc(Br)cc1S(C)(=O)=O	764198707	GEDRNAZZPDICRR-UHFFFAOYSA-N	434.312	1.375	50	20	IDGD	
COC(=O)c1ccccc1NC(=O)C(=O)NNC(=O)c1cc(F)ccc1Br	764270429	MXABGMZPPXOXHJ-UHFFFAOYSA-N	438.209	1.775	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)C(=O)Nc1ccc(C(=O)NCCc2ccccc2)cc1	764385619	FIGQTCNAZDRGBB-UHFFFAOYSA-N	445.479	1.762	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(N2CCc3sccc3C2)cc1	764398492	SRUYWVNDQPXVAZ-AWEZNQCLSA-N	446.529	1.448	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CC[C@@H](N2CCN(C)CC2)[C@@H](C)C1	764470015	RYYWVQNWXRUGQU-MAUKXSAKSA-N	437.972	1.067	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)[C@@H](C)NS(=O)(=O)c3ccc(C#N)cc3)cc2C1	764569986	AGRGJLMUZPEIDD-CHWSQXEVSA-N	446.554	1.873	50	20	IDGD	
C[C@H](NS(=O)(=O)c1ccc(C#N)cc1)C(=O)NNC(=O)c1cc2c(s1)CC[C@@H](C)C2	764569987	AGRGJLMUZPEIDD-OLZOCXBDSA-N	446.554	1.873	50	20	IDGD	
CC(C)(C)OC(=O)NNC(=O)C(=O)Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1	765391353	RLACPSHDXVWHRI-UHFFFAOYSA-N	440.522	1.746	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)NCc2cccc(N3CCCS3(=O)=O)c2)c1	765892042	LWGHMFZTFWGHET-UHFFFAOYSA-N	446.529	1.753	50	20	IDGD	
Cn1c(SCC(=O)NN=C(CNS(C)(=O)=O)c2ccccc2)nc2ccccc21	766711436	IFMXYXXXQRSLDL-UHFFFAOYSA-N	431.543	1.735	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3ccc(-n4cncn4)nc3)n[nH]2)cc1OC	768278335	ZANIATYVJRSLLP-UHFFFAOYSA-N	434.416	1.144	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)Cc1c(C)nc2c(c(O)nn2C)c1C	768638654	LKKDDMOZBAAFNB-UHFFFAOYSA-N	433.490	1.389	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCOCC2)cc1NC(=O)NNc1nc(C)cc(C)n1	769924803	DNEKJVKFGMHURY-UHFFFAOYSA-N	436.494	1.272	50	20	IDGD	
O=C(CCn1c(S)nnc1-c1cccs1)NNC(=O)c1ccc2c(c1)OCCO2	770425846	ZASMRUUWDXULBV-UHFFFAOYSA-N	431.499	1.918	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)N[C@@H]1CC(=O)N(c2c(F)cccc2F)C1	770856347	RFZQGENPNJVRSC-CYBMUJFWSA-N	428.399	1.291	50	20	IDGD	
Cc1cc(CNC(=O)NNC(=O)CCSc2ccc(F)cc2)ccc1S(N)(=O)=O	775227572	GBVHOZHUDGQLNN-UHFFFAOYSA-N	440.522	1.794	50	20	IDGD	
COc1cc(OC)cc(N2CC[C@@H](N(C)CC(=O)NNC(=O)c3cccc(C)c3)C2=O)c1	777615829	IFXOQFLLTHIIIT-HXUWFJFHSA-N	440.500	1.511	50	20	IDGD	
CC(C)CS(=O)(=O)N1CCC(NC(=O)NNC(=O)CSc2ccccc2O)CC1	777766875	CSUKDXDLLAITJT-UHFFFAOYSA-N	444.579	1.265	50	20	IDGD	
CC(C)c1nn(C)c(Cl)c1C(=O)N1CCN(S(=O)(=O)CBr)CC1	777836896	MGTFUCHYZYBXDJ-UHFFFAOYSA-N	427.752	1.637	50	20	IDGD	
O=C(CN1C(=O)[C@H]2CCCC[C@@H]2C1=O)NNc1ccc([N+](=O)[O-])cc1Br	779136888	SBHOKAVLJURQBS-QWRGUYRKSA-N	425.239	1.976	50	20	IDGD	
Cc1onc(CC(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)c1C#N	779384005	FFNBPSRPJKWYJJ-UHFFFAOYSA-N	445.482	1.721	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@H](C(=O)NNC(=O)c2cccc3ncccc23)[C@@H](C)O)cc1	779513704	IJNCXRVVRSXBBW-KUHUBIRLSA-N	442.497	1.032	50	20	IDGD	
Cc1c(/C=C(\C#N)C(=O)O[C@H](C(=O)N2CCC[C@@H](C(N)=O)C2)C(C)C)cc(C#N)n1C	782626971	GYFBWMGTRWHJSW-YAQRSPCLSA-N	425.489	1.404	50	20	IDGD	
O=C(NNc1ccc(Cl)cc1)C(=O)Nc1ccc(C(=O)NCCN2CCOCC2)cc1	783336360	MDHOFJUQTAHISM-UHFFFAOYSA-N	445.907	1.484	50	20	IDGD	
C[C@@H]1C[C@@H](C)CN(C(=O)c2ccccc2NC(=O)C(=O)NNc2ccnc(N(C)C)n2)C1	784969044	HDRAJQZYTXVJJF-HUUCEWRRSA-N	439.520	1.743	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNc3ccnc(N(C)C)n3)cc2F)C[C@H](C)O1	784970795	NEZACLMUJPPXMB-STQMWFEESA-N	431.472	1.377	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2ccc(OC[C@H]3CCCO3)cc2)n1	785227869	YUTFPJUMOAKTJJ-QGZVFWFLSA-N	428.493	1.962	50	20	IDGD	
COCc1ccccc1S(=O)(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	788914151	AYINMLBJDRKAJN-UHFFFAOYSA-N	442.538	1.631	50	20	IDGD	
CC[C@H]1CCc2nc(NC(=O)C(=O)NNC(=O)c3cc([N+](=O)[O-])ccc3O)sc2C1	789768377	MOIOTZPXCZOWDU-VIFPVBQESA-N	433.446	1.672	50	20	IDGD	
O=C(NC[C@@H](Cc1cccc(F)c1)C(=O)N1CCOCC1)NNc1ncncc1Cl	789842027	YWDQLLQRZNQTKV-CQSZACIVSA-N	436.875	1.613	50	20	IDGD	
CN1C(=O)C[C@H](C(=O)NNC(=O)C(=O)N2CCCC2)[C@H]1c1ccc(Cl)c(Cl)c1	790551238	XPTWFFXHGZGNMN-XHDPSFHLSA-N	427.288	1.283	50	20	IDGD	
O=C(CNC(=O)c1ccccc1I)NNc1nc2ccccn2n1	791248682	PENAMRLBRKINOR-UHFFFAOYSA-N	436.213	1.207	50	20	IDGD	
COC(=O)[C@@H](CS(=O)(=O)NNC(=O)c1cccc(OC(F)F)c1)c1ccccc1	795313685	GSQKTHQPOYTQTQ-HNNXBMFYSA-N	428.413	1.809	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCN(c2ccc(C)cc2)C(=O)C1	796087325	MCVHCYOIAYYUQI-UHFFFAOYSA-N	430.892	1.767	50	20	IDGD	
COC(=O)[C@H]1CN(C(=O)OC(C)(C)C)CCCN1CC(=O)NNC(=O)c1cccc(C)c1	796676581	GEZXPPCNQGYNFL-QGZVFWFLSA-N	448.520	1.240	50	20	IDGD	
O=C(NNC(=O)c1cc(Cl)ccc1O)C(=O)Nc1ccc(F)c(N2CCOC2=O)c1	797001066	XHPAMDZPINKPHS-UHFFFAOYSA-N	436.783	1.541	50	20	IDGD	
CCCOc1ccc(C(=O)NNS(=O)(=O)c2cc(Cl)cc(C(N)=O)c2)cc1OC	799120146	JZARYLXTUVSGMC-UHFFFAOYSA-N	441.893	1.860	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)CN(C)C(=O)[C@H](C)n2cccn2)c(OC)cc1Cl	802080075	MXZANZCGPXECRS-NSHDSACASA-N	438.872	1.426	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1)Nc1ccc2c(c1)OCO2	802096501	SJPOKOFNKJCKQJ-NSHDSACASA-N	447.429	1.843	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)N[C@H]1CCCN(C(=O)N2CCCC2)C1	804869030	JPPZWATUTFEPBJ-LBPRGKRZSA-N	427.303	1.401	50	20	IDGD	
CSCC[C@H](NC(=O)Cc1ccccc1)C(=O)NNc1ccc(-n2ccnc2)nn1	804958011	GIVIQSLBBIGBJN-INIZCTEOSA-N	425.518	1.586	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)NC[C@H]2CCCS(=O)(=O)C2)cc1Cl	806040456	ITLKGIVZDBFYEK-SNVBAGLBSA-N	434.902	1.518	50	20	IDGD	
Cc1cccn(Cc2c(F)cccc2NC(=O)C(=O)NNC(=O)CCc2ccco2)c1=O	806977661	TXZPTKXAFJQFNQ-UHFFFAOYSA-N	440.431	1.656	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCc2ccnc(OC(F)F)c2)nc1	807257852	UPAOCVOXKATSOD-UHFFFAOYSA-N	430.437	1.591	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCCn2cc(Br)cn2)nc1	807530324	CTPVGDCAVSNJHQ-UHFFFAOYSA-N	446.331	1.054	50	20	IDGD	
O=C(CN1CCN([C@@H](C(=O)NCc2ccccc2)c2ccccc2)CC1)NNC(=O)C1CC1	812909055	CDGZUCLBCYPNDO-HSZRJFAPSA-N	449.555	1.219	50	20	IDGD	
CCOC(=O)Cc1cccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)c1	813033919	RGQCFTIQGQKYQA-UHFFFAOYSA-N	448.501	1.124	50	20	IDGD	
Cc1cc(CC(C)(C)C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)ccc1Br	814256079	KBZXDRSPPPRMFX-ZDUSSCGKSA-N	431.352	1.908	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCc2nncn2C1)Nc1ccc(OCc2noc(C3CC3)n2)cc1	814640241	XYUKSRCDBKOETG-ZDUSSCGKSA-N	438.448	1.533	50	20	IDGD	
COc1ccc(-n2cnnc2SCC(=O)NNC(=O)COc2ccccc2OC)cc1	818815953	FUAOYDMMNHESJE-UHFFFAOYSA-N	443.485	1.603	50	20	IDGD	
O=C(COC(=O)/C=C/c1nc2ccccc2s1)NNC(=O)[C@@H]1COc2ccccc2O1	849190088	YVPJNEBVTHJHQA-SCOAYWHSSA-N	439.449	1.840	50	20	IDGD	
C[C@H](C(=O)NNC(=O)Cc1ccc(F)cc1)N1C(=O)c2ccc(Br)cc2C1=O	894432460	MBRJMYGHICJEPY-SNVBAGLBSA-N	448.248	1.963	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CC(=O)N(Cc2ccccc2Cl)C1)c1ccc(-n2cnnn2)cc1	913155980	NBWQXXQJAJOHMV-OAHLLOKOSA-N	439.863	1.125	50	20	IDGD	
Cc1ccc(NC(=S)NNC(=O)CNS(=O)(=O)c2c(F)cccc2F)cc1C	913432061	FFORJTBJNXCBSP-UHFFFAOYSA-N	428.486	1.878	50	20	IDGD	
O=C(CCc1ccccc1)NNC(=S)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1	913444468	YBIDMNNYDDTCGB-UHFFFAOYSA-N	448.570	1.658	50	20	IDGD	
C[C@@H]1CC(C)(C)C[C@]2(C1)NC(=O)N(CC(=O)NNC(=O)Cn1cnc3ccccc31)C2=O	913495821	OZNRMSYUCLGFOW-PEBXRYMYSA-N	440.504	1.321	50	20	IDGD	
COc1ccc(-c2nn(CCC#N)cc2/C=C(/C#N)C(=O)NCC(=O)NC2CC2)cc1OC	914464809	WXVXZDNQLXPWTR-YBEGLDIGSA-N	448.483	1.783	50	20	IDGD	
O=C(Cn1cnc2ccccc21)NNC(=O)c1cn(-c2ccccc2Br)nn1	914748175	LLLLWYUJJYBEDN-UHFFFAOYSA-N	440.261	1.841	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)[C@H]2CCCN(S(=O)(=O)c3ccccc3)C2)c1	915059790	VAWKUQHJRXZGBS-KRWDZBQOSA-N	431.514	1.622	50	20	IDGD	
COc1cc(C#N)ccc1OCCCC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	915642534	FYMUFXAECJXUSY-UHFFFAOYSA-N	431.470	1.591	50	20	IDGD	
CCOCCCNC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	915888657	ILFFSQCEZMUNOV-UHFFFAOYSA-N	426.520	1.920	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)NCc2nnc3n2CCCCC3)c2ccccc2c1=O	915915623	GWCUJTMKBCSYNH-UHFFFAOYSA-N	438.492	1.440	50	20	IDGD	
CCS(=O)(=O)N1CCC(NC(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)CC1	916260192	RUXMCKXLLQILJM-OAHLLOKOSA-N	426.539	1.215	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)NCCN2CCc3ccccc3C2)c2ccccc2c1=O	916444447	GHJXCUKWIHQTHH-UHFFFAOYSA-N	448.527	1.980	50	20	IDGD	
CC(C)(C)n1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)cn1	916726673	TWAGTBQMMQXMQF-UHFFFAOYSA-N	433.534	1.888	50	20	IDGD	
CCc1noc(CCCC(=O)NNC(=O)c2ccc(CSc3nncn3C)cc2)n1	917020894	CRDVFVNJBUWVPG-UHFFFAOYSA-N	429.506	1.837	50	20	IDGD	
O=C(CCCS(=O)(=O)N1CCCC1)NNC(=O)COc1ccc(Br)cc1	917388345	WWGXXKHEJYIXLZ-UHFFFAOYSA-N	448.339	1.181	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)N[C@@H](C)c1ccc(S(=O)(=O)NC)cc1	919779374	QZGFANSGSJDILA-AWEZNQCLSA-N	434.518	1.628	50	20	IDGD	
Cc1cc(-c2cc(C(=O)NNC(=O)N[C@H]3CCS(=O)(=O)C3)c3c(C)noc3n2)c(C)o1	919889784	UDTVMXGTLIRFRB-LBPRGKRZSA-N	447.473	1.539	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)N[C@H](C)CN2C[C@@H](C)C[C@@H](C)C2)nc1	919923916	BKLKGUHUNGXAFU-OWCLPIDISA-N	426.587	1.761	50	20	IDGD	
CN1CCN(CCCCNC(=O)CCC(=O)C(C#N)=C2N(C)c3ccccc3N2C)CC1	920457048	HEMGUFPPABJRHW-UHFFFAOYSA-N	438.576	1.801	50	20	IDGD	
C[C@@H](OC[C@@H]1CCCO1)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	921018707	ANYZIMKJHFUDEM-WBVHZDCISA-N	439.534	1.206	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2cnc3c(cnn3C)c2)cc1Br	1116658004	FTWSRMPDYWHAFS-UHFFFAOYSA-N	440.279	1.363	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)C2CCN(C(=O)c3cccnc3)CC2)cc1	1116937110	VIXUYUPRDGUAPZ-UHFFFAOYSA-N	445.501	1.190	50	20	IDGD	
CNC(=O)c1cccc(C(=O)NNC(=O)[C@H]2Cc3ccccc3CN2Cc2ccccc2)n1	1319158309	UXCDYKJDAVAEDW-JOCHJYFZSA-N	443.507	1.829	50	20	IDGD	
CC(C)(C)OC(=O)NCc1ccccc1CNC(=O)NN[C@]1(C)CCS(=O)(=O)C1	1322308926	RRTMYCGTQOAQDR-LJQANCHMSA-N	426.539	1.592	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)NCCN2CC=CC2)cc1	1339863232	XMRGRSGKFKQNRZ-JXAWBTAJSA-N	434.500	1.329	50	20	IDGD	
O=C(c1ccc2ncoc2c1)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1778010311	IUNFDLAQFQXDOS-WMLDXEAASA-N	426.242	1.962	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)CS[C@H]3CCCCO3)C2)C1	1779084969	LBEPKOXRDQZFTM-JLJPHGGASA-N	435.384	1.860	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc3cnccc3[nH]2)C1	1779129216	KNQPOJZVWARCDZ-RRMPHLOHSA-N	434.924	1.944	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(Cl)Cl)C2)c1ccc2c(c1)CNC2=O	1779162789	ZMTHUWPUJNUELO-FOIQADDNSA-N	440.327	1.861	50	20	IDGD	
C[C@@H](C(=O)N1CCO[C@]2(CCN(C(=O)CO[Si](C)(C)C)C2)C1)N1CSCSC1	1779296841	HNIMHFWLJSOUTL-YJBOKZPZSA-N	447.699	1.711	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H]1ON=C(c3ccccc3)O1)CCO2	1779296850	IFILVRZJDJRJLF-LEWJYISDSA-N	447.564	1.403	50	20	IDGD	
CNc1nsnc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CO[Si](C)(C)C)C1	1779539189	ZSTUOZRBTZVQJT-FZKQIMNGSA-N	441.630	1.559	50	20	IDGD	
COc1ccnc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)c1OC	1780452997	SNVJIOKSLILFFL-RHSMWYFYSA-N	446.273	1.233	50	20	IDGD	
CC(C)=CCCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2	1780654838	ZMPOGAWEUMOGAA-NFBKMPQASA-N	428.338	1.240	50	20	IDGD	
C[C@@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Br)C1)C1(O)CCC1	1780770266	KKGZVVWMVYRQMI-QDEZUTFSSA-N	435.334	1.742	50	20	IDGD	
COc1ccc(CC(=O)N2CC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)c(C#N)c1	1781177392	WRPSLIVWGIMXRG-LJQANCHMSA-N	426.300	1.743	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)ncc1[N+](=O)[O-]	1781230214	QNCRFRNBUFRMTR-ROUUACIJSA-N	445.303	1.978	50	20	IDGD	
O=C(c1n[nH]c2ccc(F)cc12)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781332432	YKGKJSFDRFJPAF-YOEHRIQHSA-N	443.248	1.836	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CCC(=O)NN(C)C)C2)ccc1F	1782213611	ZAMAJUZATBPLTD-AUSIDOKSSA-N	448.539	1.635	50	20	IDGD	
CCOC(=O)C(C)(C)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](Br)CC)C2)C1	1783352250	DTQYKURCCJXPNR-FZKQIMNGSA-N	433.343	1.579	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(-c4cccnc4)[nH]n3)CCO2)C1	1783877478	JEVOTKCOMOKNCM-YWZLYKJASA-N	433.896	1.169	50	20	IDGD	
Cn1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)C(Cl)Cl)C3)C2)c(C(F)(F)F)n1	1783946389	MOQSLVDTBRYRLM-CQSZACIVSA-N	429.226	1.686	50	20	IDGD	
O=C(Cc1ccc([N+](=O)[O-])cc1F)N1CCO[C@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783949197	FWNGQQKZNXGJDP-QGZVFWFLSA-N	434.251	1.910	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccncc3O)C[C@@H]21	1783968954	CPZPEGAILRYHQF-DSPQJCBJSA-N	426.311	1.412	50	20	IDGD	
Cc1cc(C)n(CCC(=O)N2CC[C@@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)n1	1784321074	LQQUYSRPYOPOGX-RTBURBONSA-N	431.364	1.956	50	20	IDGD	
Cc1noc(N)c1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)CBr)C[C@@H]21	1786835833	ODJWSGKZFYAJPG-BQUFFADESA-N	429.315	1.190	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]3C2)C1	1787451245	CEYHWMWPQUIGKD-QBYUYEEZSA-N	447.935	1.758	50	20	IDGD	
C[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(C)(C)CCl)C[C@@H]21)[C@H]1SC(=N)NC1=O	1787493365	UFJYGGKOWCHCJI-HTVCTNPSSA-N	444.985	1.034	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3CN(C(=O)OC(C)(C)C)C3)[C@H]2C1	1788118303	RAMZSMFUJIJIJX-LLLHUVSDSA-N	443.972	1.850	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)[C@@H](O)c3ccccc3)CCC2)cc1)c1ccc(B(O)O)cc1	1788140716	NLZMUOQYNKKIBW-QFIPXVFZSA-N	444.296	1.848	50	20	IDGD	
O=C(Cc1cnccn1)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1	1788145193	RMDCYTGTTCBZFU-UHFFFAOYSA-N	430.273	1.147	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3nccc(OC)c3OC)[C@H]2C1	1789412247	IQHICRBKLOCPQC-AYDFFVQHSA-N	425.913	1.710	50	20	IDGD	
CC(=O)c1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]3C2)n[nH]1	1789865981	IOUTXKLPUNFLLB-NZRMSGFPSA-N	431.320	1.442	50	20	IDGD	
C=C(CC(=O)OCC)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)CBr)C[C@@H]21	1789890640	ZWTIAIPXBZNNDB-UGUYLWEFSA-N	445.354	1.507	50	20	IDGD	
COCCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C(C#N)=C/c3ccc(F)cc3F)[C@H]2C1	1790693242	AERMGUABCNRONI-VFIHFLKLSA-N	433.455	1.888	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(Cl)ncn3)C[C@@H]21	1791058889	LHRJKJLSAJLYCC-ZPFDUUQYSA-N	431.718	1.507	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4cccnc4n3)C[C@@H]21	1791254294	NDSDLCGVNOJCGN-OVWQWFNUSA-N	432.908	1.477	50	20	IDGD	
CCOc1cccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](Cl)COC)[C@H]3C2)c1O	1791256568	BSVPQJHUOGPSPZ-MBGYTDRXSA-N	440.924	1.638	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)Oc3cccnc3)C[C@@H]21	1791256914	YNBJUEQQHFAOFT-XWJBARJFSA-N	425.913	1.082	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CC[C@@H]3CCOC3)[C@H]2C1	1791818340	RUEZYRPSIUCKIW-HMDCTGQHSA-N	431.371	1.956	50	20	IDGD	
CC(C)(C)OC(=O)N1CC2(C[C@H]2C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](O)CCl)C1	1793116047	FXMDVBYJODJHCB-QRJUGERDSA-N	441.956	1.481	50	20	IDGD	
COc1ncccc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)CBr)C2	1794727620	VTCKLDGZZYSOKQ-XPCVCDNBSA-N	426.311	1.324	50	20	IDGD	
CC(=O)N[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Cl)c1ccc(F)cc1	1796367512	KFDYRWTVTKVVDS-IEHFGQBSSA-N	429.851	1.127	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CC=CCC1)C2	1796443770	IRNLEMOAAZZPDL-FSWGRJFZSA-N	427.505	1.066	50	20	IDGD	
CCCc1onc(C)c1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Br)C2	1796615091	FKOGQDOPYVQALA-YGSHXTJESA-N	428.327	1.922	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H](O)C[C@H]1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](F)Cl	1796810728	ZCQAHFWUYKHBPA-ZAQNNHEOSA-N	433.908	1.529	50	20	IDGD	
CC(=O)N[C@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2)c1ccc(F)cc1	1799051844	JEAUGPCICSGKFG-XRGAULLZSA-N	446.306	1.396	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nc(OC)ccc1[N+](=O)[O-])C2	1799270134	QINKCQIPOPJOHD-NWJSVONSSA-N	426.857	1.219	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(N3CCOCC3)cc1)C2	1799270254	VMPVZZWQRYKXET-PIKOESSRSA-N	435.952	1.744	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3cncn3c1)C2	1799277577	YPDUMCKEEIQESW-QHHYFVSCSA-N	425.316	1.774	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@]2(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)[C@@H](F)Cl)C4)C[C@H]1CO2	1799936773	QXYZONSMDTUSJE-KNJMQODFSA-N	445.919	1.937	50	20	IDGD	
CC[C@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1nc3c(=O)[nH]c4ccccc4n3n1)C2	1800073858	WXCPVMXWORNXEG-CRWXNKLISA-N	442.907	1.840	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)CN(CC)CC	1800225959	LOBQAKNOQYMMSW-KSWRQPAISA-N	432.403	1.727	50	20	IDGD	
CC(C)(C)[C@H](O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C#N)=C/c1ccc(F)cc1F	1800332639	VZAOZKUEXYWEQK-UHVSXOQYSA-N	447.482	1.868	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(-c3ccccn3)[nH]n1)C2	1800760631	XFGVMVJXJUVJDL-KOFHJDLBSA-N	448.321	1.458	50	20	IDGD	
CC(C)(C)OC(=O)N1CCCC[C@@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2	1800781737	DDBGXLYLOABNIU-YIDVYQOGSA-N	447.935	1.900	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(Cl)c3nncn3c1)C2)C(Cl)Cl	1801016879	APEHJGFIUDNQAF-PEGIJTEDSA-N	432.695	1.390	50	20	IDGD	
CC(C)(C)OC(=O)NC1(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)C(C)(C)CCl)C3)CC1	1802221340	FHJWLTYTPTYBCF-QDMKHBRRSA-N	443.972	1.898	50	20	IDGD	
COC[C@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc3c(c1)NC(=O)[C@H](C)O3)C2	1802279644	YTQIAXGPMUHWNZ-SLZITWOASA-N	435.908	1.912	50	20	IDGD	
CCS(=O)(=O)CC(=O)N1CC[C@@H](CNC(=O)C(C)(C)CCl)[C@@H]1c1cccnc1	1802896609	DFTAVXOKEIILKS-RDJZCZTQSA-N	429.970	1.787	50	20	IDGD	
CC(C)(CCl)C(=O)NC[C@@H]1CCN(C(=O)CCN2C(=O)C=CC2=O)[C@H]1c1cccnc1	1802898554	XTZZKEGZSIUBMB-JXFKEZNVSA-N	446.935	1.668	50	20	IDGD	
CC(C)(CCl)C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1802899499	CZFWXKADXKLDPK-PKOBYXMFSA-N	443.740	1.346	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NC[C@@H]1CCN(C(=O)[C@@H](F)Cl)[C@@H]1c1cccnc1	1804369203	PBNLFDDGENOZTH-BMGDILEWSA-N	433.871	1.447	50	20	IDGD	
CCC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](O)CCl)C2	1804378617	FLTHVZKMOIEXJF-YIDVYQOGSA-N	431.961	1.918	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)n1	1804826300	VKPVIDDPWFMUAJ-IEZWGBDMSA-N	445.907	1.354	50	20	IDGD	
COC(=O)c1ccc(CC(=O)N2CCC3(CCCN(C(=O)[C@H](O)CCl)C3)CC2)s1	1805525127	DASSQGWDVFPLBH-OAHLLOKOSA-N	442.965	1.908	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC2(CCCN(C(=O)c3cccc(=O)n3O)C2)CC1	1807550928	IGEUAZWBXKKNJM-CQSZACIVSA-N	440.338	1.961	50	20	IDGD	
O=C(O)CSCC(=O)N1CC[C@H](CNC(=O)[C@@H](F)Br)[C@@H]1c1cccnc1	1808677944	DZKRDOKEEKVPDG-BYCMXARLSA-N	448.314	1.596	50	20	IDGD	
Cc1ccc(CCC(=O)N2CCC3(CCCN(C(=O)c4cccc(B(O)O)c4)C3)CC2)cn1	1809974883	FZGHHEKAXUZYRE-UHFFFAOYSA-N	449.360	1.547	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2cnn3ccncc23)[C@@H]1c1cccnc1	1813031279	RZFNFCFFBIVVJK-HHXXYDBFSA-N	442.907	1.698	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)[C@@H]1CCC(F)(F)C1	1814386669	FEQTZLBZGGHLLN-RHSMWYFYSA-N	446.263	1.831	50	20	IDGD	
C=CCSCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1815654273	QVHZDPPXCRJGRZ-KRWDZBQOSA-N	428.323	1.315	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)c3[nH]nnc3C)sc2C1	1815944074	MLEAAFZBZUKMLD-DTWKUNHWSA-N	427.328	1.969	50	20	IDGD	
C[Si](C)(C)OCC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(=O)n2O)[nH]n1	1819592233	OBXSFYVDUJQISJ-CQSZACIVSA-N	433.541	1.966	50	20	IDGD	
CN(C)C(=O)NCC(=O)N[C@@H]1CCc2nc(NC(=O)CO[Si](C)(C)C)sc2C1	1820158649	MDLZLYDPUOFDDW-LLVKDONJSA-N	427.603	1.178	50	20	IDGD	
C[Si](C)(C)OCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1n[nH]cc1[N+](=O)[O-])CC2	1820165297	CXOVVZJNPYANTC-SECBINFHSA-N	438.542	1.852	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](O)CCl)CC2)c1cnc2snnc2c1	1821273282	LTGZEDHQCNZQQF-KWQFWETISA-N	438.922	1.368	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)CCc2cnc[nH]2)[nH]n1	1822410120	ALKJTYPNAVVNFD-MRXNPFEDSA-N	430.513	1.131	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)CCc2ccccn2)[nH]n1	1822410144	AQXPJNZGPWSDQE-GOSISDBHSA-N	441.536	1.803	50	20	IDGD	
COc1nn(C)cc1C(=O)N[C@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1	1823001169	BDOVWMZVRKGGLA-CPCISQLKSA-N	446.302	1.802	50	20	IDGD	
C[C@H](NC(=O)c1ccccn1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](F)Cl)CC2	1824548733	KDWBDTCAFNUFMG-BHDSKKPTSA-N	439.900	1.803	50	20	IDGD	
Cc1nnc(CCC(=O)N2CCCC[C@H]2C2CCN(C(=O)[C@H](O)CCl)CC2)s1	1825226021	LVPNTWKDIYELNM-JKSUJKDBSA-N	428.986	1.999	50	20	IDGD	
O=C(NCC(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H](O)CCl)CC1)c1cccs1	1825235078	XAEQIBQRDLDSJE-HOTGVXAUSA-N	441.981	1.697	50	20	IDGD	
C#CC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](Cl)COC)CCN2C(=O)OCc1ccccc1	1829341107	XADVSUTXZKKWPM-AVRDEDQJSA-N	447.919	1.326	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CN2CCN(C(C)=O)CC2)CC1	1830308654	UCTNIYFKYFZDCT-UXHICEINSA-N	441.016	1.788	50	20	IDGD	
Cc1ccc(CCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)s1	1830726053	NXERWZUNBWEJMT-VQIMIIECSA-N	430.954	1.045	50	20	IDGD	
O=C(c1ccc(Cl)c(F)c1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1830732990	CSUVWHNVROBUCE-YJBOKZPZSA-N	435.279	1.149	50	20	IDGD	
CSCC(C)(C)C(=O)N1CCO[C@]2(COCCN(C(=O)CCBr)C2)C1	1831533446	WXIUXDNENYBELW-KRWDZBQOSA-N	437.400	1.617	50	20	IDGD	
Cc1nccnc1C(=O)N1CCC([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1	1831873809	ZBCVSPQFMMLITG-GOSISDBHSA-N	430.553	1.391	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3sccc3F)CCO2)C1	1831922822	OZYYFKZPIKYUGT-BZNIZROVSA-N	435.315	1.741	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)C3CCC(CO)CC3)CCO2)C1	1832523164	NMJHZKJNERDNHG-XTUQQUOLSA-N	447.370	1.025	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)Cn3cnc4ccccc43)CC2)CC1)[C@H](O)CCl	1833312907	LEHCGWGYPHDVOJ-HXUWFJFHSA-N	447.967	1.208	50	20	IDGD	
CCc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)cn1	1833892740	PXGIOKLSIVFDHL-CRAIPNDOSA-N	444.301	1.405	50	20	IDGD	
Cc1ncccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)CCBr)C2)C1	1834037108	JEXVSDZKVMPTLL-GOSISDBHSA-N	426.311	1.245	50	20	IDGD	
O=C(CCBr)NC1CCN(C2CCN(C(=O)CC3(O)CCC3)CC2)CC1	1834423266	AHZWGXXAPNUFMF-UHFFFAOYSA-N	430.387	1.648	50	20	IDGD	
O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(F)cn1)CCO2	1834475441	QSJJNWFESCRQEV-KRWDZBQOSA-N	430.274	1.076	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)CCN(C)C)CC2)CC1	1834616132	BXVVCXIOCGJVPT-QGZVFWFLSA-N	431.419	1.683	50	20	IDGD	
CC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)c3ccc4ncnn4c3)CC2)CC1	1836397238	VHADHDIHEMKJQP-SFHVURJKSA-N	432.956	1.932	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)N1CCC(N2CCC(NC(=O)[C@](C)(Cl)CCl)CC2)CC1	1836399557	DQDVBBSLKUGXBE-JLTOFOAXSA-N	447.407	1.485	50	20	IDGD	
CC(=O)C(C)(C)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](F)Br)CC2)CC1	1836413820	QVHCLJPUMYGNKQ-OAHLLOKOSA-N	434.350	1.864	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](CN)c3ccccc3)C2)C1	1837711878	VDUCDTKWXNDCTD-KNQAVFIVSA-N	449.624	1.037	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)C(=O)N(C)C)CC2)CC1	1837814623	WSSVTBYTGYYJSU-OAHLLOKOSA-N	432.359	1.247	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3nc(C)c(C)s3)CCO2)C1	1838411958	RXFCVYLAFYIKEF-KDOFPFPSSA-N	431.942	1.084	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3ccc(OC)nc3)C2)C1	1839142347	NCLVAJBAKJVJRS-LAUBAEHRSA-N	439.940	1.497	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(OC)c3F)C2)C1	1839149940	WXMIGICHNKSJPJ-FOIQADDNSA-N	428.888	1.922	50	20	IDGD	
Cc1ccc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)cc1	1839199301	MKGXORQREYEMTI-IEBWSBKVSA-N	443.313	1.684	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(O)c(F)c3)CCO2)C1	1839305929	NEMNVVOLAKYAPE-KPZWWZAWSA-N	445.285	1.385	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CNC(=O)OC(C)(C)C)CCO2)C1	1839986012	FLXUCYKDIQMPLT-YWZLYKJASA-N	447.960	1.375	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CCC[C@H](C(=O)OC)C1)CCO2	1840147012	GASXJQZJHLEJRM-NWZZKEMCSA-N	444.956	1.440	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CCCCC3(F)F)C2)C1	1840150123	FRRBJHWNNVNDTJ-MPGHIAIKSA-N	438.899	1.522	50	20	IDGD	
Cc1c[nH]c(C)c1CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840186785	OXGOXWQHEAERSG-LJQANCHMSA-N	432.348	1.824	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(F)(F)Cl)CCO2	1840283213	QEAGSQNSNORKKG-GXFFZTMASA-N	433.677	1.305	50	20	IDGD	
CN(C)c1ccc(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)cc1	1840314960	WUSVORKBUNRZNJ-FPOVZHCZSA-N	441.931	1.676	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC12CN(C(=O)C1(N3CCN(C)CC3)CC1)C2	1841288138	CINHXTVLMBFVAG-HNNXBMFYSA-N	427.387	1.001	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC2(CCCN2C(=O)C(F)(F)C(F)(F)C(=O)O)C1	1841825961	PQUBRRPNNMMKHV-QMMMGPOBSA-N	433.196	1.576	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)CNc1ccc(F)cc1)C2	1843415739	HKRGMEQLXYZVSD-CVKSISIWSA-N	440.479	1.575	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)c1ccnnc1O)C2	1844692897	WIJYCYJUEGGGFA-UHFFFAOYSA-N	441.400	1.147	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@]1(NC(=O)OC(C)(C)C)CCOC1)C2	1845166371	QSFLNPYJMOPSAO-VLIAUNLRSA-N	429.945	1.891	50	20	IDGD	
COc1cc(N2CCC(C(=O)N3CC[C@H]4[C@@H]3CCN4C(=O)[C@H](F)Cl)CC2)ncn1	1847667989	CJXAPBKLNLDODX-ZQIUZPCESA-N	425.892	1.438	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N1CCN(c2ncccn2)CC1	10610180	AIZQTVXYMCXTEV-CYBMUJFWSA-N	449.309	1.569	50	20	IDGD	
COc1cc(OC)c(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1OC	15315122	PMPWWUFVVYUCCH-UHFFFAOYSA-N	442.516	1.686	50	20	IDGD	
Cc1ccc(-n2nnnc2SCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1C	15522053	RCMRJRMAJCTEDX-UHFFFAOYSA-N	427.446	1.741	50	20	IDGD	
CC(=O)Nc1ccc(S[C@H](C)C(=O)NNC(=O)c2n[nH]c(=O)c3ccccc23)cc1	108114167	PGAMLMOYSGQDSM-LLVKDONJSA-N	425.470	1.823	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)NCCN2CCS(=O)(=O)CC2)c(C)n1-c1ccc(F)cc1	725886026	QWKRWUHBJMBCHE-RGEXLXHISA-N	444.532	1.987	50	20	IDGD	
COc1ccccc1[C@H](CNC(=O)NNC(=O)CNC(=O)c1ccco1)N1CCCCC1	726104644	UIOOAQCBJZGPHZ-KRWDZBQOSA-N	443.504	1.576	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)[C@@H]1CC(=O)N(c2ccccc2F)C1	726862369	LIDCDBZGESZBFS-CYBMUJFWSA-N	432.477	1.763	50	20	IDGD	
C#Cc1cccc(NC(=S)NNC(=O)CN2C(=O)N[C@@](C)(c3ccc(F)cc3)C2=O)c1	727500895	AYQJCDNFPKWLNS-NRFANRHFSA-N	439.472	1.592	50	20	IDGD	
CCC[C@](C)(NC(=O)OC(C)(C)C)C(=O)NNC(=O)c1csc(N2CCOCC2)n1	727724342	XZBRYIYRZDJOFJ-IBGZPJMESA-N	441.554	1.824	50	20	IDGD	
COCCn1c(C)c(C)c2cc(C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)ccc21	728513076	QFIMKHLCDAITGE-UHFFFAOYSA-N	433.472	1.955	50	20	IDGD	
Cc1ccc(C(=O)N[C@H](C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)C(C)C)cc1	728845343	HLEILBPKFZKFAH-IBGZPJMESA-N	438.532	1.603	50	20	IDGD	
O=C(NNS(=O)(=O)c1cccc(OC(F)(F)F)c1)C1CCN(c2ncccn2)CC1	728854094	KXTMPNXVZFVRGS-UHFFFAOYSA-N	445.423	1.601	50	20	IDGD	
CC(C)(C)c1ccc(S(=O)(=O)NCCC(=O)NNC(=O)c2cccc(C#N)c2)cc1	728870106	ROCKZIQEKPDPSX-UHFFFAOYSA-N	428.514	1.985	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H](c2ccccc2)N2CCC(O)CC2)c1	729519072	HGPJBYSSPACLEG-LJQANCHMSA-N	431.514	1.049	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)[C@@H](CCSC)NC(=O)c1cccc([N+](=O)[O-])c1	731494366	OJVMPCYWJCWVSC-MRXNPFEDSA-N	446.485	1.916	50	20	IDGD	
CS(=O)(=O)CCN1CCC(NC(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)CC1	731685781	ATOQVPYVJCMEMX-UHFFFAOYSA-N	426.583	1.042	50	20	IDGD	
Cn1ccnc1[C@@](O)(CCNC(=O)NNC(=O)NCc1ccc(Cl)cc1)C(F)(F)F	732996748	OCBUKWWSVIZFMH-INIZCTEOSA-N	448.833	1.927	50	20	IDGD	
O=C(NCc1cccc(CN2CCOCC2)c1)NNC(=O)c1cnn(-c2ccccc2)c1	733340759	HSAIKLAPDNOIHH-UHFFFAOYSA-N	434.500	1.849	50	20	IDGD	
COCCN(CCOC)S(=O)(=O)c1ccc(C(=O)NNc2ncccc2Cl)cc1	734245945	FJIZQQXHUWQZPA-UHFFFAOYSA-N	442.925	1.775	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)CCc2cc(F)ccc2F)CC1	735117093	AZQHBNQVOGGDSK-UHFFFAOYSA-N	439.488	1.372	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)N2CCC[C@H](CNS(N)(=O)=O)C2)c(C)n1C[C@@H]1CCCO1	739699412	QPUMAUBQUNFBKT-QHDZVZEPSA-N	449.577	1.223	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CC[C@H](NC(=O)OC(C)(C)C)[C@H](C)C2)n1	740879007	CUZFJFPIZORYNJ-OCCSQVGLSA-N	425.555	1.377	50	20	IDGD	
CN(C)C(=O)CS(=O)(=O)c1ccc(C(=O)NNc2ccc(Cl)cc2[N+](=O)[O-])cc1	742049611	VPNVJDOQQGHBIY-UHFFFAOYSA-N	440.865	1.867	50	20	IDGD	
O=C(COc1ccccc1-c1ccccc1)NNC(=O)CN1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O	742472890	XHCYNCSYOOBBMC-YHBROIRLSA-N	449.463	1.042	50	20	IDGD	
CC(C)c1nn([C@@H]2CCS(=O)(=O)C2)cc1C(=O)NNC(=O)c1ccc(Cl)nc1	742549155	SDIUSBNCXRVSLQ-GFCCVEGCSA-N	425.898	1.489	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNS(=O)(=O)c2cc3oc(=O)[nH]c3cc2Cl)cc1C	743250804	JNNWNFWGMFMQHB-UHFFFAOYSA-N	438.849	1.340	50	20	IDGD	
O=C(NNC(=O)c1cccc(Br)c1)NNC(=O)c1cnn(-c2ccccc2)c1	743609171	ONGVWAHXANSXBH-UHFFFAOYSA-N	443.261	1.924	50	20	IDGD	
O=C(CNC(=O)c1cccc([N+](=O)[O-])c1)NNC(=O)c1cc(Br)ccc1O	743730110	NAJXXQNIGNQMMG-UHFFFAOYSA-N	437.206	1.254	50	20	IDGD	
CS(=O)(=O)c1ccc(OCCCC(=O)NNC(=O)c2cc(Br)c[nH]2)cc1	743746910	WJVIBVRDNBAHEA-UHFFFAOYSA-N	444.307	1.801	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CN2CCN(Cc3c(F)cccc3Cl)CC2)c1	744385509	PGOIJVZFNLJTMJ-UHFFFAOYSA-N	429.883	1.930	50	20	IDGD	
CCCn1c(=O)n(CCC(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)c2ccccc21	744600191	AGYWAPHPESRYDM-UHFFFAOYSA-N	449.467	1.479	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](CC(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1)c1ccccc1	746139328	OXLHJMWLJNOSML-HUUCEWRRSA-N	440.522	1.160	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)c1ccc(N2CCC(O)CC2)cc1	746200095	DBBVVIPOKFRBEI-UHFFFAOYSA-N	430.530	1.845	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)C1CCN(C(=O)COc2ccccc2)CC1	746545753	UWMDTRBTLWKJKS-UHFFFAOYSA-N	435.484	1.342	50	20	IDGD	
COc1cc(C(=O)NNC(=O)COC2CN(C(=O)OC(C)(C)C)C2)ccc1OC(C)C	748013471	SIVMVRPINZWOKB-UHFFFAOYSA-N	437.493	1.879	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)[C@@]2(F)CCN(C(=O)OC(C)(C)C)C2)c2ccccc2c1=O	748286395	UNPIQXDBHNEGKU-HXUWFJFHSA-N	433.440	1.044	50	20	IDGD	
NS(=O)(=O)c1ccc(CC(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)s1	748522291	PUVMSLJHGIWPJD-UHFFFAOYSA-N	443.450	1.375	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)NO[C@H]2CCCCO2)cc1	749618028	VCIJVCWDYFXUTH-GRFAERAESA-N	439.472	1.915	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)c2cc(S(N)(=O)=O)cc(Cl)c2F)c1	752263359	AISGIWJITORKKT-UHFFFAOYSA-N	429.857	1.583	50	20	IDGD	
COc1cc(OC)cc(N2C[C@@H](C(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)CC2=O)c1	752266333	OZBKKBBMLIZYPR-ZDUSSCGKSA-N	428.401	1.426	50	20	IDGD	
COc1ccc(N2C(=O)CC[C@@H](C(=O)NNC(=O)CO)[C@@H]2c2ccccc2OC)cc1	753452807	SYUPTMLJWZXSSF-UTKZUKDTSA-N	427.457	1.328	50	20	IDGD	
COC[C@@H](C)CC(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccc(OC)cc2)c1	755036453	DTMYAAWCHBUAKY-AWEZNQCLSA-N	435.502	1.930	50	20	IDGD	
O=C(COC(=O)Cc1cc(Cl)cc2c1OCC2)NNC(=O)[C@H]1COc2ccccc2O1	755091491	FKTMBZWKOHIQLL-QGZVFWFLSA-N	446.843	1.348	50	20	IDGD	
CCOCC(=O)NNC(=O)Nc1cc(S(=O)(=O)N(CC)CC)ccc1N1CCCC1	755401940	VUCZRSJFVNBNLH-UHFFFAOYSA-N	441.554	1.507	50	20	IDGD	
C[C@]1(C(=O)NNC(=O)c2ccc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)cc2)CCCO1	755684198	RZOWATPUJJUBPP-LJQANCHMSA-N	448.457	1.726	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3c(F)c(F)cc(F)c3F)cc2)CC1	755777128	RHZGHWAQYMTHKU-UHFFFAOYSA-N	446.426	1.936	50	20	IDGD	
C=CCN(C)S(=O)(=O)c1ccc(NC(=O)NNC(=O)Cc2ccccc2OC)cc1	755932998	QYZRVXWSXGKTNQ-UHFFFAOYSA-N	432.502	1.897	50	20	IDGD	
COC(=O)Nc1ccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1	755965354	YHNDMNZEQOTOCM-UHFFFAOYSA-N	435.462	1.582	50	20	IDGD	
COCCOc1cc(C)ccc1NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	756047152	WWYLVLVKJYUTGW-UHFFFAOYSA-N	425.445	1.734	50	20	IDGD	
C[C@]1(c2cccc(C(=O)OCC(=O)NNC(=O)c3cccc(Cl)c3)c2)NC(=O)NC1=O	756223194	SUSYUXUFYIUIRD-HXUWFJFHSA-N	444.831	1.013	50	20	IDGD	
Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)NNC(=O)[C@H](C)NS(C)(=O)=O	756335600	IXDJJGBQLRFSCA-AWEZNQCLSA-N	445.501	1.536	50	20	IDGD	
CCOC(=O)Cn1cccc(NC(=O)NNC(=O)c2cc(-c3ccc(C)cc3)[nH]n2)c1=O	757761982	CFYXKEACGQHCSU-UHFFFAOYSA-N	438.444	1.576	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)Nc2cnc3c(c2)C[C@@H](NC(=O)OC(C)(C)C)CC3)cn1	757929444	UIAGRSFNXPWESO-AWEZNQCLSA-N	429.481	1.664	50	20	IDGD	
O=C(CN1CC[C@@H](N2CC(=O)Nc3ccccc32)C1)NNC(=O)c1ccccc1Cl	759895621	HCAMXDONDZVAFM-CQSZACIVSA-N	427.892	1.634	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)C(=O)Nc1ccnn1Cc1ccc(F)cc1	760289568	DXVXFUGZQALEDR-UHFFFAOYSA-N	443.460	1.654	50	20	IDGD	
CCc1ccccc1N1C[C@H](C(=O)OCC(=O)NNC(=O)Cc2nc(C)cs2)CC1=O	761415314	CBSSPCZYLQKUBH-OAHLLOKOSA-N	444.513	1.300	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C[C@](O)(c1nccn1C)C(F)(F)F	762360504	DNVUGLPZLRJEQO-INIZCTEOSA-N	432.424	1.508	50	20	IDGD	
O=C(CNC(=O)c1ccc(Br)s1)NNc1nccc(N2CCOCC2)n1	762864739	DWMWZVBVRUUHDG-UHFFFAOYSA-N	441.311	1.010	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)C(=O)Nc1cc(N2CCCC2=O)ccc1Cl	763443387	KVXJCIDVKLMLRH-UHFFFAOYSA-N	445.819	1.775	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1ccnc(OCC(F)(F)F)c1	763467772	HHCIIRTVARIREE-UHFFFAOYSA-N	427.295	1.331	50	20	IDGD	
O=C(NNC(=O)c1ccccc1Br)C(=O)Nc1cnn(-c2ccncc2)c1	763484545	ZXFOJLVWRRBAJZ-UHFFFAOYSA-N	429.234	1.430	50	20	IDGD	
CSc1ccncc1NC(=O)C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	763531552	OVJLYNGVUJADGP-UHFFFAOYSA-N	442.545	1.102	50	20	IDGD	
CCN(Cc1ccccc1NC(=O)C(=O)NNC(=O)c1ccc2c(c1)OCO2)C(C)=O	763550869	IFQLCTUGUJJXTR-UHFFFAOYSA-N	426.429	1.183	50	20	IDGD	
Cc1cn(C2CCCCC2)nc1NC(=O)C(=O)NNC(=O)[C@@H]1COc2ccccc2O1	763574431	BDQDLFRMSGLTEI-KRWDZBQOSA-N	427.461	1.623	50	20	IDGD	
O=C(COc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1ccc(CN2CCOC2=O)cc1	763694431	IUDXFXJPYVREPH-UHFFFAOYSA-N	446.847	1.457	50	20	IDGD	
Cc1cc(C)n(-c2ccc(NC(=O)C(=O)NNC(=O)COc3ccc(F)cc3)cc2F)n1	763842408	ZVRBLQMDJORNQC-UHFFFAOYSA-N	443.410	1.932	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)NNC(=O)C(=O)Nc1ccc2nc3n(c(=O)c2c1)CCC3	763859188	YICAKNMZVADHNI-UHFFFAOYSA-N	444.451	1.153	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2nnc(C(C)(C)C)s2)cc1	763878661	SLIJONPGRPYGQK-LLVKDONJSA-N	433.490	1.592	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccc(CN3CCC[C@@H](C)C3)cc2)n1	763886908	ZVVURYPDCWBCBA-OAHLLOKOSA-N	426.521	1.518	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)NC(=O)CC3)ccc1OC(C)C	763915667	CSOQNNIYXAPZRV-UHFFFAOYSA-N	440.456	1.767	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)on2)c(F)c1	764003792	OOPIBNKVCGQIBT-UHFFFAOYSA-N	426.360	1.667	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc(-n2nnnc2C(C)C)c(C)c1	764039957	ABAVVOQTXGRIBQ-UHFFFAOYSA-N	437.460	1.502	50	20	IDGD	
C[C@H]1C[C@H](C)CN(S(=O)(=O)c2ccc(NC(=O)C(=O)NNC(=O)c3ccoc3)cc2)C1	764163834	MUBLUPBJTJLNJP-KBPBESRZSA-N	448.501	1.346	50	20	IDGD	
Cc1cc(C(=O)N2CCSCC2)ccc1NC(=O)C(=O)NNC(=O)CC1CCCC1	764185064	UTLAXOQBOQICKR-UHFFFAOYSA-N	432.546	1.850	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)cnn1-c1ccccc1	764202557	FDNHYOUWUNZBSZ-UHFFFAOYSA-N	444.492	1.572	50	20	IDGD	
CCn1cnnc1-c1ccccc1NC(=O)C(=O)NNC(=O)Cn1ccc2ccccc21	764239226	HJNVPAPRZUBOQB-UHFFFAOYSA-N	431.456	1.706	50	20	IDGD	
Cc1nnc(-c2cccc(NC(=O)C(=O)NNC(=O)c3cccc4ncccc34)c2)n1C	764257451	GXQMAFAZQMCFCK-UHFFFAOYSA-N	429.440	1.738	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)Cc2cccnc2)sc2c1CC[C@@H](C)C2	764268120	FMYRAEVBWUHASG-GFCCVEGCSA-N	444.513	1.773	50	20	IDGD	
C[C@H]1COCCN1c1ccc(NC(=O)C(=O)NNC(=O)CCc2ccccc2O)cc1	764277410	DIAPBGRRAXSBLJ-HNNXBMFYSA-N	426.473	1.336	50	20	IDGD	
CN1CCN([C@@H](CNC(=O)NNC(=O)CSc2ccccc2O)c2cccs2)CC1	764318924	JKCWQIDDNHHATB-HNNXBMFYSA-N	449.602	1.865	50	20	IDGD	
N#Cc1ccc(Oc2ccc(NC(=O)C(=O)NNC(=O)[C@H]3COCCO3)cc2Cl)cc1	764423513	AZTOPHLXVNCHEF-QGZVFWFLSA-N	444.831	1.505	50	20	IDGD	
CCCn1ncc(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)c1C1CC1	765839452	JTFJVQOTCXJNQE-UHFFFAOYSA-N	433.534	1.948	50	20	IDGD	
O=C(NNc1cnccn1)C(=O)Nc1ccc(CCn2nnc(-c3ccccc3)n2)cc1	766260726	TWJGNXCILPQANI-UHFFFAOYSA-N	429.444	1.455	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)c1ccc2nc(O)oc2c1	766659625	DKMPOUQWSKROES-UHFFFAOYSA-N	443.891	1.766	50	20	IDGD	
O=C(CCOC[C@H]1CCCO1)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	766664823	VJYKEFRFTLVZGU-LJQANCHMSA-N	438.956	1.191	50	20	IDGD	
C[C@@](O)(Cc1ccccc1)C(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	766669101	MUVTVLPDOKQNIT-HSZRJFAPSA-N	444.963	1.599	50	20	IDGD	
O=C(COC(=O)COc1ccc2c(c1)CCCC2)NNC(=O)c1ccc([N+](=O)[O-])cc1	767533491	QSPTXZVDFDKTEZ-UHFFFAOYSA-N	427.413	1.857	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CN2CCNC(=O)[C@@H]2c2ccccc2Br)cc1	767743097	OPTUSCRLNASCPG-SFHVURJKSA-N	445.317	1.692	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(C)(C)O)cc1S(=O)(=O)N[C@H]1CCCC[C@@H]1C	768245764	FXCBCCVKVBNYJQ-JSGCOSHPSA-N	427.523	1.084	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)NCCc1cn2c(n1)SCC2	768529428	NOKBQWFUSSMEPR-UHFFFAOYSA-N	443.577	1.074	50	20	IDGD	
COc1ccc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1C1CC1	769475160	CPRROPNULYSSAE-IBGZPJMESA-N	426.425	1.717	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)CN2CCC(NC(=O)OC(C)(C)C)CC2)cc1	769676375	HNMKBWFWHRGICN-UHFFFAOYSA-N	434.537	1.764	50	20	IDGD	
Cc1cc2c(N3CCC[C@@H]3C(=O)NNC(=O)[C@@H]3COc4ccccc4O3)ncnc2s1	770446071	FJOASENRBHMUBQ-PBHICJAKSA-N	439.497	1.956	50	20	IDGD	
CO[C@@H](c1ccc(F)cc1)[C@@H](C)NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1	770768818	ALOVAWJDVBFVNG-RDTXWAMCSA-N	430.484	1.939	50	20	IDGD	
C[C@H](NS(=O)(=O)c1cccs1)C(=O)NNc1nc(-c2ccccn2)nc2c1CCC2	771026082	SBHWEOKZVUIVOM-LBPRGKRZSA-N	444.542	1.899	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)C(=O)Nc2cccc(S(=O)(=O)NC(C)(C)C)c2C)n1	773478538	ITPCADZFGWKZHS-UHFFFAOYSA-N	434.522	1.560	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NN=C2C(=O)Nc3c(F)cc([N+](=O)[O-])cc32)cc1	774333496	FBFMCWVORPUINZ-UHFFFAOYSA-N	449.420	1.135	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)N2CCN(S(C)(=O)=O)[C@@H](C)C2)c(C)n1C[C@@H]1CCCO1	776438335	AIXYHOCIMDZLAR-DRQYAWCQSA-N	434.562	1.683	50	20	IDGD	
CCOC(=O)N1CCC[C@@H]([C@H](C)NC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])C1	777262390	OBJHSNYEWTUDFY-UONOGXRCSA-N	437.453	1.561	50	20	IDGD	
O=C(Nc1cccc(C(=O)N2CCN(S(=O)(=O)CBr)CC2)c1)NC1CC1	777777092	DRSWLXBFYKTIOE-UHFFFAOYSA-N	445.339	1.411	50	20	IDGD	
O=C(c1ccc(NC2CC2)c([N+](=O)[O-])c1)N1CCN(S(=O)(=O)CBr)CC1	777780205	YCBJTVCRAUUZNR-UHFFFAOYSA-N	447.311	1.609	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)C2(NC(=O)c3c(C)nn(C)c3C)CCCC2)nc1C	778421387	LEYDOSBYGOOSNC-UHFFFAOYSA-N	443.508	1.498	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)COc2ccc([N+](=O)[O-])c3cccnc23)nc1C	778425206	NLADRUHZWONKFC-UHFFFAOYSA-N	426.389	1.940	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)/C=C/c2cc3cnn(C(C)C)c3[nH]c2=O)nc1C	778430277	QZQHHWKUFSWWBM-VOTSOKGWSA-N	425.449	1.737	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCCC2)cc1	778437990	JHYDOPIKIJEYGX-UHFFFAOYSA-N	440.522	1.147	50	20	IDGD	
COC(=O)c1ccccc1NNC(=O)c1cc(Br)cc(S(N)(=O)=O)c1C	780738847	OTDCSOBSBMQAML-UHFFFAOYSA-N	442.291	1.948	50	20	IDGD	
Cc1cccc(Cn2nccc2NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)c1	782894386	SXPDCRKSEMMKPM-UHFFFAOYSA-N	445.483	1.455	50	20	IDGD	
CC(C)c1cc(NC(=O)C(=O)NN=c2sc3ccccc3n2C)n(-c2ncccn2)n1	783351763	KCLYOAAOVUSZNT-UHFFFAOYSA-N	436.501	1.910	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1cccc(COCC2CC2)c1	784003854	PZNWPGICIDLKDB-UHFFFAOYSA-N	430.486	1.191	50	20	IDGD	
COc1ccc(Cl)cc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	784214710	BHCAFBNOIKRYCM-UHFFFAOYSA-N	438.893	1.871	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)F)cc1)C(=O)Nc1c[nH]nc1-c1ccccn1	784833936	UQARIDDEVAUMPY-UHFFFAOYSA-N	436.400	1.550	50	20	IDGD	
O=C1CCc2cc(NC(=O)C(=O)NNc3ccc(S(=O)(=O)C(F)F)cc3)ccc2N1	784835900	ZIQFPTLTPLOZGO-UHFFFAOYSA-N	438.412	1.649	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNc2nccn(C)c2=O)sc2c1CC[C@@H](C)C2	785089614	CVTIQJAYYPJBDX-SNVBAGLBSA-N	433.490	1.225	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc4c(c3)ncn4C)n[nH]2)c1	785127340	GLHQDNQQKBUTJT-UHFFFAOYSA-N	431.456	1.980	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)c1ccc2c(=O)n(C)c(S)nc2c1	788812138	NDYYTFPRVMWEKB-UHFFFAOYSA-N	428.470	1.461	50	20	IDGD	
C[C@H]1CN(c2ccccc2F)CCN1C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	789012255	QUAHHASPHKEHKC-INIZCTEOSA-N	441.511	1.784	50	20	IDGD	
N#Cc1cccc(-c2cc(C(=O)OCC(=O)NNC(=O)[C@H]3COc4ccccc4O3)on2)c1	789127261	LUHRGKWXUCPFJG-LJQANCHMSA-N	448.391	1.357	50	20	IDGD	
CN1C(=O)Cc2cc(NC(=O)C(=O)NNC(=O)c3ccc(Br)s3)ccc21	789731069	ACGRMUYYDIVXRR-UHFFFAOYSA-N	437.275	1.429	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N1CC(=O)N(CC2CC2)C1	789829398	LFGTYGPUDAELFK-NSHDSACASA-N	425.283	1.469	50	20	IDGD	
CCCNC(=O)[C@H]1CN(C(=O)C(=O)NNc2cccc(F)c2[N+](=O)[O-])c2ccccc2O1	790999245	PWEVPVCMYIMAOA-MRXNPFEDSA-N	445.407	1.497	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)Cc2ccc(C(=O)NNC(=O)CC(C)(C)O)cc2)cc1	792015058	SXNAFNNZTPHYJB-UHFFFAOYSA-N	433.530	1.738	50	20	IDGD	
CCn1c(=O)c2ccccc2n(CC(=O)NNC(=O)c2cc3ccccc3cc2O)c1=O	792521879	SPBFLAJESQXGQO-UHFFFAOYSA-N	432.436	1.503	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)c(F)cc1C	793022698	BGJLFLNODIKHLM-UHFFFAOYSA-N	431.376	1.439	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2cc(C)nn2-c2nc3ccccc3s2)n1	793066652	HQKNKTHKVCVDOT-UHFFFAOYSA-N	435.469	1.894	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)[C@H](C)N2C(=O)c3ccc(Br)cc3C2=O)n1	794076013	KYZJBFXLLMREKS-JTQLQIEISA-N	431.246	1.598	50	20	IDGD	
CN(CCN1CCN(Cc2ccccc2)CC1)CC(=O)NNC(=O)c1cccc(Cl)c1	796276182	LIFFHXQBPSMVAQ-UHFFFAOYSA-N	443.979	1.851	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)c(OC)c(C)c1OC	796989290	DSIVKBITFNBKOJ-LBPRGKRZSA-N	449.435	1.713	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)cc1OC	796989585	HZWGEMDDXIHPRM-NSHDSACASA-N	433.392	1.174	50	20	IDGD	
Cn1cc(-c2cc(F)ccc2NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)cn1	796992685	VPFBUEBNMKXPTI-UHFFFAOYSA-N	425.376	1.355	50	20	IDGD	
COc1ccc(Cl)c(NC(=O)NNC(=O)CCc2ccc(S(N)(=O)=O)cc2)c1	802109326	QVADXBUNIFBYMZ-UHFFFAOYSA-N	426.882	1.782	50	20	IDGD	
CC(C)c1nn([C@@H]2CCS(=O)(=O)C2)cc1C(=O)NNC(=O)Nc1ccc(N(C)C)cc1	802121312	YAKIFJVIVSDECK-MRXNPFEDSA-N	448.549	1.899	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)NC2CCC3(CC2)NC(=O)NC3=O)c(C)n1C[C@H]1CCCO1	804730834	DOTOBHOHPCJZDM-QFUSBWQQSA-N	439.516	1.828	50	20	IDGD	
CCc1nnc(NC(=O)[C@@H](C)[C@H](C)NC(=O)NNC(=O)c2cccc(N(C)C)c2)s1	805878241	GRRQULOZILVWPQ-RYUDHWBXSA-N	433.538	1.774	50	20	IDGD	
CNC(=O)c1cccc(NC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1Br	806734138	AYIDRPWBLXDGHU-AWEZNQCLSA-N	449.261	1.801	50	20	IDGD	
CNS(=O)(=O)Cc1ccc(CNC(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)cc1	806970384	JKJZGCGOBOSWHN-ZDUSSCGKSA-N	438.481	1.173	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(Cl)cc3c2OCC(=O)N3)cc1OC	806972465	AEPSYCIUOANHSU-UHFFFAOYSA-N	448.819	1.088	50	20	IDGD	
CN(C(=O)OC(C)(C)C)[C@H](C(=O)NNc1nccc(N2CCOCC2)n1)c1cnn(C)c1	807076229	YMVRJRIRPVMFMB-INIZCTEOSA-N	446.512	1.098	50	20	IDGD	
C[C@H]1[C@@H](NC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])CCN1Cc1ccccc1	807621775	JYAYMDWBJKTBOS-RDJZCZTQSA-N	427.461	1.967	50	20	IDGD	
CCOC(=O)C(=O)c1cc(S(=O)(=O)NNC(=O)c2ccc(Cl)cc2F)cn1C	808096028	DATGBDNEQJKCIR-UHFFFAOYSA-N	431.829	1.187	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc2ccccc2c1)NNC(=O)COc1ccccc1O	810364760	HJPLYXUPOWLRGL-UHFFFAOYSA-N	429.454	1.050	50	20	IDGD	
CC1(C)CCCc2sc(NC(=O)C(=O)NNC(=O)Cc3cn4ccccc4n3)nc21	810398923	QAETZUDNVCQGGS-UHFFFAOYSA-N	426.502	1.733	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)c2cc(S(=O)(=O)NC)ccc2C)cc1	811884168	AXUWGTQDXMSPEQ-CQSZACIVSA-N	435.502	1.530	50	20	IDGD	
O=C(CN1CCC[C@](CO)(Cc2ccccc2)C1)NNC(=O)c1ccc([N+](=O)[O-])cc1	812874224	YNDSOSWZFYSDCL-QFIPXVFZSA-N	426.473	1.673	50	20	IDGD	
COCCOCc1ccc(CNC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc1	812920614	WDROFIFQLILTHB-UHFFFAOYSA-N	439.472	1.885	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccc(-n3cccn3)cc2)cc1	813033636	CSHCDXRONBPEAP-UHFFFAOYSA-N	428.474	1.204	50	20	IDGD	
COC(=O)[C@H](CF)NC(=O)/C(C#N)=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	813690747	NRTUHMFZDASUCN-RQPMMQJISA-N	447.854	1.613	50	20	IDGD	
COc1cnc(C(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)nc1	814874734	BLEWICCGSKPCRD-UHFFFAOYSA-N	430.428	1.262	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NN=C2CCN(CCN3CCOCC3)CC2)C1	814972689	IJURODVVDUZMHM-SFHVURJKSA-N	437.585	1.534	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)C2(c3ccc(N(C)C)cc3)CC2)cc1OC	815305076	XDNWNAINKUXBAF-UHFFFAOYSA-N	441.484	1.806	50	20	IDGD	
CC(C)(C)c1csc(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1C#N	815564565	MMCOCOPCZBBDOI-OAHLLOKOSA-N	428.470	1.843	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)CN2C(=O)[C@@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2=O)c1	861638052	VJWHSZFDWMTLII-VUEDXXQZSA-N	425.485	1.452	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)c3ccncc3)CC2)cc1	865908862	HQEBHWBZBAXOEG-UHFFFAOYSA-N	432.502	1.342	50	20	IDGD	
CC(=O)N1CCC(C(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)CC1	904222042	BLWWDUAZLKZBHZ-UHFFFAOYSA-N	447.495	1.464	50	20	IDGD	
COc1ccc(/C=C(\C#N)C(=O)O[C@H](C(=O)N[C@@]2(C)CCS(=O)(=O)C2)C(C)C)cc1	913229078	FJZPVSNOHXFDJA-DSVFEOKZSA-N	434.514	1.863	50	20	IDGD	
CN1C(=C(C#N)C(=O)COC(=O)Cc2ccc(S(N)(=O)=O)s2)N(C)c2ccccc21	914960361	NXLWJVTVAUVZTN-UHFFFAOYSA-N	446.510	1.372	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@@H](Cc2cccc(F)c2)n2nnnc2C)cc1OC	915685809	LWILIAZHKVFRKV-MRXNPFEDSA-N	428.424	1.383	50	20	IDGD	
CC(C)N(CCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)C(C)C	915891037	CSLDIUFRZYAACS-UHFFFAOYSA-N	439.582	1.534	50	20	IDGD	
CC[C@H](CNC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)N1CCc2ccccc2C1	916448311	IVBBIAUAPKYFPV-LJQANCHMSA-N	434.504	1.443	50	20	IDGD	
C[C@H]1CCCN([C@H](C)CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)C1	916450283	ISDDCAHQNRXAHI-LSDHHAIUSA-N	425.555	1.001	50	20	IDGD	
Cc1ccccc1NC(=O)NNC(=O)NCC(=O)N1CCN(C(=O)OC(C)(C)C)CC1	918135689	SNTRIUBJZCOKFS-UHFFFAOYSA-N	434.497	1.410	50	20	IDGD	
O=C(CCCOc1ccc(Cl)cc1Cl)NNC(=O)CCN1CCCS1(=O)=O	918187082	SQHNAZHIPFPYMO-UHFFFAOYSA-N	438.333	1.725	50	20	IDGD	
O=C(CCNS(=O)(=O)c1cccc(Br)c1)NNC(=O)CC(F)(F)F	918364096	JBNSHIQSLSAJGV-UHFFFAOYSA-N	432.218	1.217	50	20	IDGD	
O=C(Cc1ccc2c(c1)OCO2)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	918548765	KVBLEZYOLTUEOL-UHFFFAOYSA-N	431.470	1.204	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H](C)Cc2cccc(O)c2)c1	919785026	XXGGIFAPTZXGGI-HNNXBMFYSA-N	448.545	1.998	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)CCn2c(S)nc3ccccc3c2=O)cc1	919836383	LAYRWCQWFUFFFT-UHFFFAOYSA-N	426.498	1.864	50	20	IDGD	
Cc1csc(Sc2ccc(C(=O)NNC(=O)CN3CCCC3=O)cc2[N+](=O)[O-])n1	920826553	PBLJVDDIRHZZRC-UHFFFAOYSA-N	435.487	1.894	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2ccc3c(c2)CN(C(C)=O)C3)c2ccccc2c1=O	1116588703	KMQNGTSRTJTANI-UHFFFAOYSA-N	434.456	1.745	50	20	IDGD	
COC(=O)[C@@H](CS(=O)(=O)NNC(=O)c1cncn1-c1ccccc1)c1ccccc1	1257410950	GHZGWQKJJIHOPQ-KRWDZBQOSA-N	428.470	1.393	50	20	IDGD	
CN1CCN(C(=O)c2ccc(CNC(=O)NNC(=O)c3ccccc3Cl)cc2)CC1	1317871516	OVGDAMXFTDGDGE-UHFFFAOYSA-N	429.908	1.872	50	20	IDGD	
CNS(=O)(=O)c1ccc(CC(=O)NNC(=O)CSc2ccc(Cl)cc2)cc1	1320443667	VRLDACHNRSEVMX-UHFFFAOYSA-N	427.935	1.730	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2cc(C(=O)NNc3ccn(C)n3)ccc2Cl)C[C@@H](C)O1	1321105206	MMMQVODHYJLMQS-TXEJJXNPSA-N	427.914	1.628	50	20	IDGD	
Nc1cnnc(NNC(=O)NCCCNC(=O)c2cccc(Br)c2)c1Cl	1324020520	AVHMCINTXULNDO-UHFFFAOYSA-N	442.705	1.921	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2c(C)nc3ncccn23)C1	1778634789	SHWRTMZCXZUTQD-GCKMJXCFSA-N	449.939	1.419	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2n[nH]c3ccccc23)C1	1779018424	ZORJHYJMGKTJPD-LUQKVYGDSA-N	434.924	1.944	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCBr)C2)c1cc2n(n1)CCC2	1779119893	LRRPCTVJMRWLAC-VQIMIIECSA-N	439.354	1.742	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cc(O)nc(Cl)c1)CCO2	1779296625	WPLONWXSPQDKKA-SFHVURJKSA-N	427.961	1.736	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)cc1OC	1779300674	UJELOHFIUVSOOM-OAQYLSRUSA-N	436.581	1.999	50	20	IDGD	
O=C(c1cc(-c2cccs2)on1)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1779563284	GLNUYMXECKMBSP-ACJLOTCBSA-N	425.894	1.446	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H]1C[C@H]3CC[C@@H]1O3)C2)[C@H](F)Br	1780777698	YWJHEENGKCZLLD-WDMREZPVSA-N	433.318	1.758	50	20	IDGD	
CC(=O)N[C@@H](C(=O)N1CC[C@]2(CN(C(=O)[C@@H](F)Cl)CCO2)C1)c1cccc(Cl)c1	1780930257	PRVGXXSQBHQODP-GPMSIDNRSA-N	446.306	1.882	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(Cl)cnc3OC)[C@H]2C1	1783419152	IWTLBENVCOXGLY-KSYCFECVSA-N	446.331	1.591	50	20	IDGD	
O=C(Cc1ccc2c(c1)CCO2)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1783423403	ZSRRNZYEVRNSKX-MJGOQNOKSA-N	441.297	1.684	50	20	IDGD	
COc1ncc(Cl)cc1C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](C)Br)C2)C1	1783527667	FFXKXFKKEXJYBU-APPDUMDISA-N	446.729	1.971	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)C[C@@H]3COc4ccccc4O3)CCO2)C1	1783870852	HIQKPTZCTYNYKB-VWKPWSFCSA-N	438.908	1.300	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3coc([Si](C)(C)C)c3)CCO2)C1	1783877413	IRJNUKLMFWFCAN-DNVCBOLYSA-N	428.989	1.522	50	20	IDGD	
CC1CCN(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)CBr)C[C@@H]32)CC1	1784317371	IEYPOXFQKHKEDP-OWSLCNJRSA-N	444.414	1.729	50	20	IDGD	
N#CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](Br)Cc3ccccc3)C[C@@H]21	1786369113	LHFDLXDUBBLJQL-FJIDUMEYSA-N	434.334	1.886	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc4c[nH]nc34)C[C@@H]21	1786405878	HZNUUMIRQQHALR-BPUTZDHNSA-N	435.322	1.941	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccn4cncc4c3)C[C@@H]21	1786407276	VULLHELYVUXGKK-XIRDDKMYSA-N	435.322	1.713	50	20	IDGD	
C[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)n1cccc1C=O	1786996297	DPHYTLKXTSSRED-YERCRUGSSA-N	444.301	1.532	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]3C2)C1	1787447107	LEYFJFWSNFWMTP-UVPYHEFZSA-N	447.935	1.758	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc[nH]c3C)[C@H]2C1	1787687791	PLVLNIDUQBBHLU-IIYRHJEWSA-N	440.504	1.050	50	20	IDGD	
COc1nn(C)cc1C(=O)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1	1788140082	FSLNENOJQKLAPH-UHFFFAOYSA-N	448.288	1.170	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C=C3\C(=O)Nc4ccccc43)[C@H]2C1	1788533410	DLAXKAUBTDRZJE-XGTSDOITSA-N	447.919	1.256	50	20	IDGD	
C[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]2C1)n1cccc1C=O	1788765085	RFEPLMWAEJOYKT-CAMMJAKZSA-N	435.597	1.693	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc3cc(C)ccn3c1=O)C2	1793449989	XAXUQQAFHLIRAA-HIRMHNASSA-N	446.935	1.614	50	20	IDGD	
Cc1ccc(SCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)cc1	1796189076	SXGYKVMNHMVWTJ-ACDBMABISA-N	438.358	1.719	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C13CC(c4ccccc4)(C1)C3)C2	1796189668	NIMGYQVGTJVKOO-GPCVTYTCSA-N	444.340	1.740	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C=N/N1CCCCC1	1797739774	DJYPLQKSUDCPMJ-OEVURZHNSA-N	429.359	1.079	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc(F)cc1F)C2	1797957476	RORIIGJUYAHIMH-YVWYUNDQSA-N	426.536	1.948	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cn(C(C)(C)C)nn1	1798708439	DYMGGLSQMALOAM-FMSGJZPZSA-N	428.331	1.020	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1(C)COC1)C2	1799219590	VAOXUTCUKYQTMW-QDMKHBRRSA-N	431.445	1.808	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccc([N+](=O)[O-])c(OC)c1	1799249707	BCUIKVTXTVQFKE-NXEZDXNNSA-N	439.896	1.753	50	20	IDGD	
Cc1cnc2c(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@](C)(Cl)CCl)cnn2c1	1799276355	JUCBMBTUPUKYCJ-FCIKYMEBSA-N	440.331	1.477	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc3nccn13)C2	1799279326	IUHFGDFCYKTPNC-UESRRSCYSA-N	425.316	1.774	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnnc3ccccc13)C2)[C@@H](F)Br	1799347803	TUCWUYSYGAHZIK-OXUXUCFPSA-N	437.269	1.524	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnn2c1OCCC2	1799936065	NWVHCOCLGMITFJ-JPVZDGGYSA-N	431.320	1.105	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)COCCO)[C@@H](Br)Cc1ccccc1	1800150118	GMOCVFMGFPDSND-MHORFTMASA-N	439.350	1.640	50	20	IDGD	
CCn1nc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](Cl)COC)c2ccccc21	1800975881	XCAVHRUCCIPBTE-CXHZTBPHSA-N	434.924	1.513	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](N)c1cccc(Cl)c1)C2	1800975950	YSVLZUOIKMPGOB-KUHBDSFDSA-N	430.332	1.183	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/c1cc(F)cc(OC)c1)C2	1800981379	MLPSIQPVNSXYKW-KTTQPEQKSA-N	440.899	1.691	50	20	IDGD	
Cn1ccc2c(O)ncc(C(=O)N3CCC4(CCCN(C(=O)[C@@H](O)CCl)C4)CC3)c21	1805523468	WDGKVCHUBVPZGM-INIZCTEOSA-N	434.924	1.723	50	20	IDGD	
O=C(CC1CCCC1)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1806189705	GUHTUVGHILSKHN-REWPJTCUSA-N	435.333	1.661	50	20	IDGD	
Cc1cc(CCC(=O)N2CCCC3(CCN(C(=O)c4ccc(B(O)O)cc4)CC3)C2)ccn1	1806809236	DTASXLHECCXFOW-UHFFFAOYSA-N	449.360	1.547	50	20	IDGD	
Cc1cc(C)n(CC(=O)N2CCCC3(CCN(C(=O)CCC(=O)NN(C)C)CC3)C2)n1	1807108421	BAQMLMLCFFVZJJ-UHFFFAOYSA-N	432.569	1.104	50	20	IDGD	
CC(C)n1ccc(C(=O)N2CCC3(CCCN(C(=O)c4ccc(B(O)O)cc4)C3)CC2)n1	1809970839	CJOYELIZUBDPHQ-UHFFFAOYSA-N	438.337	1.302	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)c2ccccn2)[C@H]1c1cccnc1	1810297697	CTDXNWQLWLAUSW-UZLBHIALSA-N	445.483	1.109	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)c1ccnc2ncccc12	1812156687	MKSCYUGCKXZPQC-SNRMKQJTSA-N	439.903	1.944	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)c1ccc2nn[nH]c2c1	1812296635	DGIZWKJCIACFIM-QGTPRVQTSA-N	428.880	1.272	50	20	IDGD	
COC(=O)NCC(=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@@H]1c1cccnc1	1813266889	MWMGZDSQRCOGGD-IACUBPJLSA-N	431.262	1.134	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccn3c(O)nnc23)[nH]n1)[C@H](O)CCl	1814870098	IMLHXOQFYBGRPI-QWHCGFSZSA-N	433.856	1.064	50	20	IDGD	
CNCCCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1)CC2	1814962211	QROUISUKAQQFNS-SUZBBLJPSA-N	445.549	1.189	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(C=O)s3)sc2C1	1815376462	DUPHBATWVYUSRA-LLVKDONJSA-N	449.558	1.616	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnc(O)nc3O)sc2C1	1817086663	AAXWCOSRJYLXKA-QZTNRIJFSA-N	446.316	1.806	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H]1CC[C@@H]3CCC(=O)N3C1)CC2)[C@@H](F)Cl	1817128802	QTBSXOUDTHTRFR-UYUMYWFVSA-N	428.917	1.991	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](C)S)CC2	1817282309	BRWNZJOOXWNISG-MRDTYBEOSA-N	434.547	1.507	50	20	IDGD	
Cc1ccncc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1	1817475188	MNDZGFKKFIUHRY-LJQANCHMSA-N	433.277	1.413	50	20	IDGD	
Cc1ccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)c(O)n1	1817477024	WCMRTLBTXZYLKQ-SFHVURJKSA-N	449.276	1.118	50	20	IDGD	
COCCn1ccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)[C@H](Cl)COC)[nH]n2)n1	1818261680	CHTBEZMTLIYIEF-CZUORRHYSA-N	438.916	1.812	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)CCn2cncn2)[nH]n1)[C@H](F)Br	1820936562	BWAVRYXLZBXKLA-RISCZKNCSA-N	428.266	1.774	50	20	IDGD	
C[C@](O)(CC(=O)O)CC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](F)Br)n[nH]1	1820937982	XLUZDBSNCMMRNV-FUEDEBDSSA-N	449.277	1.708	50	20	IDGD	
CC[C@@H](C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1)N(CC)CC	1822410680	ONQUKGWUWIAWLP-ROUUACIJSA-N	449.600	1.895	50	20	IDGD	
CCC[C@@H](NC(C)=O)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1	1823442223	JUKOAJNOLREONN-WBVHZDCISA-N	449.556	1.080	50	20	IDGD	
CC(=O)Nc1cc(C(=O)N2CCC([C@H]3CCCCN3C(=O)[C@@H](O)CCl)CC2)ccn1	1824183303	TVIJGUPWXRETBL-MSOLQXFVSA-N	436.940	1.873	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2CCCCN2C)CC1	1824207111	MOYPZEVYVHSWBW-PMACEKPBSA-N	435.613	1.463	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)Cc1ccc3ncnn3c1)CC2	1826005941	BQLXTLIIQRMFBD-CHWSQXEVSA-N	448.936	1.594	50	20	IDGD	
Cc1ccc(CC(=O)N[C@@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)o1	1826091824	FHTJBXHAFOAEOF-CYBMUJFWSA-N	433.534	1.572	50	20	IDGD	
CC(=O)C[C@H](C)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827055434	WBPPNWQQRLSNNI-HRAATJIYSA-N	428.338	1.215	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H](Cl)COC)CC1	1828876642	UPDCSUOUVGEQBC-HYVNUMGLSA-N	430.977	1.568	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)C(F)(F)C(F)F)C2)C1	1830535136	JUYZETITTOUJTC-QMTHXVAHSA-N	449.239	1.374	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccsc3)C2)C1	1830537423	HQEBASMUFJPWLM-DYVFJYSZSA-N	431.352	1.849	50	20	IDGD	
C=C[C@H](O)C(C)(C)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](C)CBr)CCO2)C1	1830540821	TYBFJXSGRZXDJR-ZRGWGRIASA-N	447.370	1.047	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@]3(C)CC3(F)F)C2)C1	1830545191	HQHPTIMDACNLSK-UHOFOFEASA-N	439.297	1.519	50	20	IDGD	
CCN(C)[C@H](C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1	1831073432	KPKSDBVFFFKDTK-OXQOHEQNSA-N	444.580	1.259	50	20	IDGD	
C=CCOCCCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)Br)C2)C1	1831412792	DLCIEJAEQZKMQR-MAUKXSAKSA-N	433.343	1.209	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1	1831655852	AHHHMYWLNCIFOB-GDBMZVCRSA-N	445.402	1.763	50	20	IDGD	
C#CCCCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1	1831849781	GGXXNAPHWAEXPM-HXUWFJFHSA-N	425.533	1.722	50	20	IDGD	
C[C@@]1(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1(F)F	1832802024	MHGRUPFPMVGMKD-RXVVDRJESA-N	434.292	1.645	50	20	IDGD	
Cc1csc(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)c1	1832976402	PPIXWAJWFIDOAD-LPHOPBHVSA-N	430.954	1.045	50	20	IDGD	
C[C@H](Nc1cccnc1)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)CCl)CC2)CC1	1833308945	FCRSACLERGSIFN-KXBFYZLASA-N	437.972	1.053	50	20	IDGD	
C=CC(=O)N[C@@H](C)C(=O)N1CCC(N2CCC(NC(=O)[C@H](Cl)CCC)CC2)CC1	1833533882	UCTDBHGUJRXUEX-MAUKXSAKSA-N	426.989	1.656	50	20	IDGD	
Cc1oncc1C(=O)NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1	1834240962	YSKSDENHLUPBJU-HNNXBMFYSA-N	431.306	1.859	50	20	IDGD	
CC(C)c1cc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCBr)CCO3)C2)n[nH]1	1834823637	AIVURCDKCIQMJZ-GOSISDBHSA-N	443.342	1.388	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1)c1cc(O)no1	1835976366	YBNLZCPACHAOAQ-AWEZNQCLSA-N	433.278	1.256	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)N1CCC(N2CCC(NC(=O)[C@H](Cl)CC)CC2)CC1	1836397350	XYVOWVRITMKCMB-RHSMWYFYSA-N	429.993	1.283	50	20	IDGD	
CN1CCN(CC(=O)N2CCC(OC3CCN(C(=O)C(C)(C)CCl)CC3)CC2)CC1	1836623387	UTOPWPRXUZEDKI-UHFFFAOYSA-N	443.032	1.497	50	20	IDGD	
Cc1nc(C)c(C(=O)N2CCC(OC3CCN(C(=O)[C@H](O)CCl)CC3)CC2)s1	1836714968	GPOFMYYTHCRJBB-MRXNPFEDSA-N	429.970	1.972	50	20	IDGD	
CCc1[nH]nc(C(=O)N2CCC(OC3CCN(C(=O)[C@H](O)CCl)CC3)CC2)c1F	1836715311	PGCYAQQNNFKHHM-OAHLLOKOSA-N	430.908	1.323	50	20	IDGD	
Cc1cncc(CCC(=O)N2CCC(OC3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)c1	1836715762	YXFRAVZBYXIDHC-FQEVSTJZSA-N	437.968	1.921	50	20	IDGD	
CCCNC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)[C@H](Cl)COC)CC2)CC1	1836821835	JHMDIUYJEZZVFZ-GOSISDBHSA-N	445.988	1.545	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)c3csnn3)CC2)CC1	1836945172	OPWUGRZOYWIHDA-LLVKDONJSA-N	431.356	1.934	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(O)c(OC)c3)CCO2)C1	1838974758	YWGFGCZEXBKMBI-FOIQADDNSA-N	426.897	1.488	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3nccc(OC)c3OC)C2)C1	1839145685	CJXOQOCBMKTWFJ-XOBRGWDASA-N	441.912	1.186	50	20	IDGD	
Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1839427927	AAMJTTMHOANJLM-YJBOKZPZSA-N	447.822	1.647	50	20	IDGD	
O=C(c1cnn2cccc(F)c12)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1839619057	PVKCWNFINYQPJY-YJBOKZPZSA-N	428.823	1.078	50	20	IDGD	
COc1cc(F)ccc1CC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1840934095	CZARCIBZXYGPRR-PKOBYXMFSA-N	432.851	1.368	50	20	IDGD	
CC(C)(C)OC(=O)NCCOCCC(=O)N1CCCC12CN(C(=O)C(Cl)Cl)C2	1841515934	MWBPIDOFDOIVBI-UHFFFAOYSA-N	438.352	1.925	50	20	IDGD	
O=C([C@@H]1C[C@@]12C(=O)Nc1ccccc12)N1CC2(CCCN2C(=O)CCBr)C1	1842639126	HEUKPASJEGJOEX-XOBRGWDASA-N	432.318	1.885	50	20	IDGD	
COc1ccc(C(=O)CCC(=O)N2CCCC23CN(C(=O)CCC(=O)NN(C)C)C3)cc1	1842652636	ZZAYPGOFOXSVFB-UHFFFAOYSA-N	444.532	1.235	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)c2cccc(C(F)(F)F)c2)C1	1844917588	REOWLBFSYGWDGM-UHFFFAOYSA-N	432.207	1.516	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC12CN(C(=O)c1cn3[nH]cnc(=O)c3c1C)C2	1846071475	VQYYVDDVCJGNGO-ZDUSSCGKSA-N	436.310	1.322	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC12CN(C(=O)[C@H](O)NC(=O)OC(C)(C)C)C2	1846071934	WCQXJODHEDBIQA-RYUDHWBXSA-N	434.331	1.206	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)C(C)(C)C	1847525167	GFWNSYWVACJMDD-AJNGGQMLSA-N	431.961	1.727	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)[C@@H](C)Oc2ccc(C#N)cc2)cc1OC	10780543	OTSIKZACLGZIGL-CYBMUJFWSA-N	427.413	1.347	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)CCn2c(=O)n(C)c3ccccc32)cc1	14283992	WMBRVETYRLPXGF-HNNXBMFYSA-N	426.473	1.744	50	20	IDGD	
NC(=O)c1ccc(C(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)cc1	14805722	SFINRACBHJJTRV-UHFFFAOYSA-N	444.494	1.723	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)CCn2ccc3ccccc32)cc1	17407222	DPUUZEJNQHYJDW-UHFFFAOYSA-N	428.514	1.808	50	20	IDGD	
Cc1nc2nc(N)nn2c(C)c1CC(=O)NNC(=O)c1ccc(COc2ccccc2)o1	21970048	XLULJCBRPVVKIF-UHFFFAOYSA-N	435.444	1.499	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NNC(=O)c2cc(-c3ccccc3)on2)cc1	27259561	JZZJRAKCOGPNDD-AWEZNQCLSA-N	428.470	1.778	50	20	IDGD	
O=C(NNC(=O)[C@H]1C[C@H]1c1ccc(Br)cc1)c1ccc(-n2cnnn2)cc1	109764427	SQXBOVWXCMISFV-HOTGVXAUSA-N	427.262	1.990	50	20	IDGD	
COCCS(=O)(=O)c1ccc(C(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)cc1	109995040	YSCQOMVHTBXNSA-INIZCTEOSA-N	434.514	1.952	50	20	IDGD	
C[C@H]1CN(CCNC(=O)NNC(=O)[C@@H](C)Oc2cccc(Br)c2)CCO1	726258560	XJXIZFLBIRVUHD-QWHCGFSZSA-N	429.315	1.268	50	20	IDGD	
CS(=O)(=O)Cc1c(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)oc2ccccc12	726523713	ZXJSJLRSTHALRT-UHFFFAOYSA-N	440.441	1.028	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=S)NCC2CCC2)c1	727866513	LYKMXBZQXNPHDP-UHFFFAOYSA-N	434.971	1.174	50	20	IDGD	
COc1cccc(N2CC[C@H](NC(=O)NNC(=O)c3cc(OC)c(OC)c(OC)c3)C2)c1	728220061	AUAHVLWWRHQNME-HNNXBMFYSA-N	444.488	1.944	50	20	IDGD	
CC(=O)N(c1ccc(F)cc1)c1nc(C=NNC(=O)[C@H](C)NS(C)(=O)=O)cs1	728435252	WFCUSYUQQCZHHR-JTQLQIEISA-N	427.483	1.355	50	20	IDGD	
CC(=NNC(=O)c1cccc(C#N)c1)c1ccc(S(=O)(=O)NCCCN(C)C)cc1	728780893	FMXILAKWIFILFH-UHFFFAOYSA-N	427.530	1.942	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCCC3)cc2)c1	728828418	QBRPOMSWPWLQKQ-UHFFFAOYSA-N	426.498	1.737	50	20	IDGD	
CN(C)c1ccc(NC(=S)NNC(=O)c2ccc(S(N)(=O)=O)c(Cl)c2)cc1	729690019	OHOCPTLGSSGQJD-UHFFFAOYSA-N	427.939	1.685	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)Cc2csc(-c3nc[nH]n3)n2)c2ccccc2c1=O	729856813	ZQLWSGLKFQZJGH-UHFFFAOYSA-N	438.473	1.223	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)[C@H]1CCCN(S(=O)(=O)Cc2ccccc2)C1	730512176	IPFRMAYZPWPEEH-KRWDZBQOSA-N	449.504	1.594	50	20	IDGD	
CN(C)N(C(=O)c1cccc(S(=O)(=O)Cc2ccccc2)c1)[C@H]1CCS(=O)(=O)C1	730741655	QBCIBXJZNFFGGA-SFHVURJKSA-N	436.555	1.766	50	20	IDGD	
COc1ccc(C)cc1N1C[C@H](C(=O)NNC(=O)CCN2C[C@@H](C)O[C@H](C)C2)CC1=O	732261326	MCZIZFJZKNGQDG-BRWVUGGUSA-N	432.521	1.003	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2cc(Cl)nc(N3CCCC3)c2)n1	733022514	XSLXRMDYDQVDLD-UHFFFAOYSA-N	437.909	1.647	50	20	IDGD	
CCOCCCn1c(NNC(=O)Cc2ccc(-n3cnnn3)cc2)nc2ccccc2c1=O	733268819	RXDVHBRIXSWTFV-UHFFFAOYSA-N	448.487	1.485	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCC2(C(=O)N(C)C)CCCC2)nc1	733658162	AEWZUMQMOHURCA-UHFFFAOYSA-N	426.543	1.043	50	20	IDGD	
Cc1noc(C)c1[C@H](C)NC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	733849968	PBWSSHPVTMMOOC-LBPRGKRZSA-N	435.506	1.781	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2c(F)cccc2NC(=O)C(C)C)n1	734037089	BSGXXRVQNQIKOC-UHFFFAOYSA-N	436.465	1.732	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)CCNC(=O)OCC(F)(F)F	734252225	JJZKZBMJEBYFOO-UHFFFAOYSA-N	440.444	1.885	50	20	IDGD	
O=C(CN1C(=O)NC2(CCCC2)C1=O)NNc1cc(C(F)(F)F)nc(-c2ccccn2)n1	734260174	YSCVBALZCKMSOQ-UHFFFAOYSA-N	449.393	1.865	50	20	IDGD	
C[C@@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	734822302	UMBIGWRDEJOLFJ-GFCCVEGCSA-N	429.518	1.630	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)N[C@@H]1CCN(c2cnn(C)c2)C1=O	735584523	WGFOFTBCHOEXFJ-AUUYWEPGSA-N	436.472	1.477	50	20	IDGD	
CC(C)(C)C(=O)NCc1ccc(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1	741661228	CCWBQPBVTSXERX-UHFFFAOYSA-N	445.545	1.717	50	20	IDGD	
CC1(C)NC(=O)N(CCCC(=O)NNC(=O)NCc2cccc(C(F)(F)F)c2)C1=O	742459210	HDGMZHDMJQNIDA-UHFFFAOYSA-N	429.399	1.646	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)c1cn(Cc2ccccn2)nn1	742478281	KHXLJGYZJKNRGY-GFCCVEGCSA-N	445.277	1.712	50	20	IDGD	
C[C@@H]1CN(c2ccc(CNC(=O)NNC(=O)Nc3ccc(N(C)C)cc3)cn2)CCO1	743550700	OEHNBWJVCCXCFD-OAHLLOKOSA-N	427.509	1.909	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)Cn2cc([N+](=O)[O-])ccc2=O)cc1Cl	743834425	FHNPGVCSGACXHV-UHFFFAOYSA-N	425.785	1.280	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)N[C@H]1CCN(Cc2ccccc2)C1=O	744878254	ULZRYORZOVKYAQ-KRWDZBQOSA-N	434.456	1.323	50	20	IDGD	
Cc1ccc(Br)cc1C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	745254214	RUPGPIUJQKMRKB-INIZCTEOSA-N	449.257	1.902	50	20	IDGD	
C[C@@H](CC(=O)c1ccccc1F)C(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	745491526	WPQXEYAIAMEXRA-LBPRGKRZSA-N	431.376	1.947	50	20	IDGD	
Cc1nc(-c2ccc(C(=O)NNC(=O)c3ccc(Cl)c(S(N)(=O)=O)c3)cc2)n[nH]1	746097974	OUMMMQLIQOLAAI-UHFFFAOYSA-N	434.865	1.156	50	20	IDGD	
O=C(Cc1cccc2ccccc12)NNC(=O)NCCNS(=O)(=O)c1cccnc1	746326029	MMKWUPCKKSCJHP-UHFFFAOYSA-N	427.486	1.086	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCN([C@@H](C#N)c2ccccc2)CC1	746448570	GVFAGKBNVDNGIC-IBGZPJMESA-N	441.919	1.992	50	20	IDGD	
Cn1ncnc1COc1ccc(S(=O)(=O)NNC(=O)c2ccc(Cl)cc2O)cc1	746592547	YXOZUPIIJPGFCC-UHFFFAOYSA-N	437.865	1.376	50	20	IDGD	
NS(=O)(=O)c1ccc(O)c(C(=O)NNC(=O)COc2ccccc2-c2ccccc2)c1	747337319	OWQCJKXZTYMJDB-UHFFFAOYSA-N	441.465	1.547	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1)N[C@@H]1CCCCNC1=O	747864916	BDDYTXACGFUGHU-RTWAWAEBSA-N	435.528	1.613	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)N[C@H](C)c1cc(F)ccc1N1CCN(C)CC1	748628032	PHBLYSLSMTXCAI-CABCVRRESA-N	425.505	1.020	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NCCNC(=O)C(C)(C)C)c2ccccc2c1=O	749420824	LVHKEHZPSRIMFJ-UHFFFAOYSA-N	430.509	1.303	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2ccc(NNC(=O)[C@H](C)N(C)C)c([N+](=O)[O-])c2)cc1	750605429	QODMRNDNDBPIPJ-LBPRGKRZSA-N	437.478	1.797	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)NNC(=O)CNC(=O)c2ccco2)c(C)n1C[C@H]1CCCO1	751206480	HSMTYIKEIYQIPO-DAIOKFOQSA-N	439.472	1.361	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)CNC(=O)c1cccs1)n1nnc(-c2ccc(Cl)cc2)n1	751208642	HMDCKFUQYGJQBL-CYBMUJFWSA-N	447.908	1.584	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)C2CCC(NC(=O)C3CCCC3)CC2)c2ccccc2c1=O	751292777	ATGWEPVBEXHJMI-UHFFFAOYSA-N	439.516	1.560	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)NNC(=O)[C@H](C)Oc2cccc(Br)c2)o1	752357522	SZWMBGBMTGJJDS-JTQLQIEISA-N	425.239	1.793	50	20	IDGD	
Cc1cc(=O)c(C(=O)NNc2nc3ccccc3c(=O)n2C)nn1-c1ccccc1[N+](=O)[O-]	752900900	GXWYFVZFCGKBQC-UHFFFAOYSA-N	447.411	1.453	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@H]2COc3cc(F)cc(F)c32)c2ccccc2c1=O	753420524	UMACJUTUGYACAZ-AWEZNQCLSA-N	429.383	1.772	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)c2cccnc2Oc2ccccc2C(N)=O)c1	753515790	KKIYJQSXADMGLA-UHFFFAOYSA-N	448.435	1.899	50	20	IDGD	
O=C(NNc1cnnc2ccccc12)[C@H]1CN(Cc2nc(O)c3ccccc3n2)CCO1	754421539	XAEHZFJIHGYOMW-LJQANCHMSA-N	431.456	1.623	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N[C@@H]2CCN(c3c(F)cccc3F)C2=O)cc1OC	755091158	YNAZCHLYQRYWNL-CQSZACIVSA-N	434.399	1.732	50	20	IDGD	
CN(c1ccccc1)S(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=O)Cc2cc[nH]n2)c1	755287925	AAHJUZWRLKZNAL-UHFFFAOYSA-N	447.904	1.892	50	20	IDGD	
C[C@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)[C@@H](C)NC(=O)OC(C)(C)C	755314717	ZKAOEJNGBXBDPL-QWHCGFSZSA-N	442.538	1.247	50	20	IDGD	
O=C(Cc1cc[nH]n1)NNC(=O)Nc1ccc(S(=O)(=O)NC2=NCCCCC2)cc1	755499835	MOWUXMTXIQQYKM-UHFFFAOYSA-N	433.494	1.056	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)Cc2ccc(Cl)cc2)n([C@H]2CCS(=O)(=O)C2)n1	755536720	UJTPIMCAEXBJGI-AWEZNQCLSA-N	425.898	1.600	50	20	IDGD	
C[C@H]1Oc2ccc(NC(=O)NNC(=O)C3CCN(c4ncccn4)CC3)cc2NC1=O	755558581	OMYMFOFELBCUHL-GFCCVEGCSA-N	425.449	1.265	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)N1CCN(CC(=O)Nc2ccc(Cl)cc2)CC1	756070322	CPVGFZOQNXYQDP-UHFFFAOYSA-N	445.907	1.959	50	20	IDGD	
CCn1cnnc1-c1ccccc1NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	756523433	BIXMEXCYHXYZNI-UHFFFAOYSA-N	432.444	1.678	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)Nc1cc(S(=O)(=O)N(C)C)ccc1F	756683251	KZZDYGWPPXBDCV-NSHDSACASA-N	442.444	1.835	50	20	IDGD	
C[C@H]1CN(C(=O)Cn2cc(NC(=O)NNC(=O)CCc3ccccc3)cn2)C[C@H](C)O1	756838996	OVCAJMNVFCCAGG-HOTGVXAUSA-N	428.493	1.304	50	20	IDGD	
COC(=O)c1cc(NC(=O)NNC(=O)c2ccc(Cl)cc2O)cc(S(C)(=O)=O)c1	757673206	AOJHHIDSPJXTMI-UHFFFAOYSA-N	441.849	1.702	50	20	IDGD	
Cc1cc(S(C)(=O)=O)cc(C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c1C	758070852	HUADGPFLHXKKNA-UHFFFAOYSA-N	428.470	1.029	50	20	IDGD	
COc1ccc(CNC(=O)NNC(=O)C(=O)Nc2ccccn2)c(OC2CCCC2)c1	758824547	XUYFIKJWFDLNRW-UHFFFAOYSA-N	427.461	1.881	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC2(CC1)CC(C(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)=NO2	760039120	PIEAQJPOLORYCY-UHFFFAOYSA-N	447.448	1.902	50	20	IDGD	
NC(=O)CC[C@@H](NC(=O)OCc1ccccc1)C(=O)NNC(=O)c1cc(Cl)ccc1O	760122034	VIBRABZTRHHKLZ-OAHLLOKOSA-N	448.863	1.367	50	20	IDGD	
CC[C@H](OC1CCCCC1)C(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1	760264777	MYAZCDJSWATKHD-SFHVURJKSA-N	425.551	1.891	50	20	IDGD	
O=C(CCc1ccc(O)cc1)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	760802783	OQFKXWHUDPMNDE-UHFFFAOYSA-N	431.514	1.961	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCC2(CCOC)CCC2)c1	761780472	KOXFXMGGNZWBGK-UHFFFAOYSA-N	440.566	1.868	50	20	IDGD	
CC(=O)c1ccc(Cl)c(S(=O)(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1	761894892	NHXGVSVVTKMFMO-UHFFFAOYSA-N	437.909	1.559	50	20	IDGD	
O=C(NNc1nccc(N2CCOCC2)n1)c1ccc(S(=O)(=O)C2CCCC2)cc1	762851285	CMVBOMHKYRRIOK-UHFFFAOYSA-N	431.518	1.786	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)CC[C@H]2NC(=O)N(c3ccc(C#N)cc3)C2=O)n1	762896408	VVDBIFQDDUBXPL-MRXNPFEDSA-N	436.476	1.543	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)[C@@H]3CCCN3C(=O)NC(C)C)n[nH]2)cc1OC	763147979	KRFFZVJAPPTHAN-INIZCTEOSA-N	444.492	1.437	50	20	IDGD	
CCC(=O)Nc1ccc(Cl)c(NC(=O)C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c1	763445525	JGYLNZFRFOPOLX-UHFFFAOYSA-N	433.808	1.996	50	20	IDGD	
CN(C)C(=O)C[C@@H]1CN(C(=O)C(=O)NNC(=O)c2cccnc2)c2ccc(Cl)cc21	763492496	ZTDZPZFNOGLLQB-CYBMUJFWSA-N	429.864	1.105	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2ccccc2O)cnc(Cl)c1Br	763530112	PDJYYUQFLRZSSS-UHFFFAOYSA-N	427.642	1.911	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2c[nH]c3ccccc23)c(OC(F)F)c1	763536447	PZCMIEOCTVWDGD-UHFFFAOYSA-N	446.366	1.956	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)Nc1ccc(Cc2ccncc2)cc1	763575576	XTCINOGVKQUXMP-HXUWFJFHSA-N	432.436	1.598	50	20	IDGD	
CCC[C@@H](C(=O)NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1)C(C)C	763589752	OIZPJEVCDFKUTE-LJQANCHMSA-N	438.594	1.521	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)C(=O)Nc2cccc(S(C)(=O)=O)c2)c1	763597272	NFBSGDIQXLGYPZ-UHFFFAOYSA-N	447.513	1.687	50	20	IDGD	
O=C(COc1cccc(C(F)(F)F)c1)NNC(=O)C(=O)Nc1ccc(-n2cccn2)nc1	763638606	CSBLXACFOITKQP-UHFFFAOYSA-N	448.361	1.451	50	20	IDGD	
COC(=O)N(C)c1ccc(NC(=O)C(=O)NNC(=O)COc2cc(C)cc(C)c2)cc1	763648587	URALFAPCSVBCHV-UHFFFAOYSA-N	428.445	1.671	50	20	IDGD	
COC(=O)[C@H](C)Cc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)cc1	763682188	SCOVNWHKFFUBHI-CQSZACIVSA-N	438.440	1.075	50	20	IDGD	
COc1ncnc(N(C)C)c1NC(=O)C(=O)NNC(=O)CC12CC3CC(CC(C3)C1)C2	763734328	KWOISQMUPKFVQX-UHFFFAOYSA-N	430.509	1.244	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccnc(OCC(F)(F)F)c1	763814142	QJCCOPKBVCZKOM-UHFFFAOYSA-N	437.334	1.059	50	20	IDGD	
Cc1nc(Cc2ccc(F)cc2)sc1C(=O)NNC(=O)CNC(=O)c1cccnc1	763824403	JOWPQPLAPXGZDJ-UHFFFAOYSA-N	427.461	1.767	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccc(Br)nc1	763851647	UTBFLDJODOUDOE-VIFPVBQESA-N	425.214	1.537	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3c2)cc1NS(C)(=O)=O	764067196	QHCXQLPOBARUFN-UHFFFAOYSA-N	440.481	1.919	50	20	IDGD	
CC[C@@H](C)C(=O)NNC(=O)C(=O)Nc1cccc(S(=O)(=O)NC2=NCCCCC2)c1	764081970	LSPNSCNKFIARPN-CYBMUJFWSA-N	437.522	1.069	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)N(CC)CC3)o1	764139469	TVYDMEYIQYXQKD-UHFFFAOYSA-N	427.505	1.904	50	20	IDGD	
O=C(CCc1ccccc1)NNC(=O)C(=O)Nc1cccc(S(=O)(=O)N2CCCC2)c1	764188748	SPGODHBFGUHPBR-UHFFFAOYSA-N	444.513	1.190	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(N3CCc4sccc4C3)nc2)c1	764236188	WUODEPMYFGKKFJ-UHFFFAOYSA-N	446.492	1.977	50	20	IDGD	
COC(=O)c1c(NC(=O)C(=O)NNC(=O)COc2ccccc2O)sc2c1CCCC2	764275481	MFAKEZDUKJAGEJ-UHFFFAOYSA-N	447.469	1.284	50	20	IDGD	
CSc1ccncc1NC(=O)C(=O)NNC(=O)c1cc(Br)ccc1O	764281115	YQCUMSIGBSSVKD-UHFFFAOYSA-N	425.264	1.671	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)C(=O)Nc1ccc(NC(=O)c2ccccc2)nc1	764313890	NZRJIPCVMQQCCB-UHFFFAOYSA-N	435.415	1.802	50	20	IDGD	
COc1cccc(-c2nsc(NC(=O)C(=O)NNC(=O)Cc3ccccc3F)n2)c1	764314563	ZOBUVFWNBHEGHC-UHFFFAOYSA-N	429.433	1.681	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C(=O)Nc1cccc(CN2C(=O)CNC2=O)c1)c1ccccc1	764331889	JOXDCHIQRWGSGY-KRWDZBQOSA-N	437.456	1.018	50	20	IDGD	
O=C(NNC(=O)C1CCC1)C(=O)Nc1ccc(NC(=O)[C@@H]2CCCO2)cc1C(F)(F)F	764341640	HFVWVKUEKHVJDN-AWEZNQCLSA-N	442.394	1.709	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ncccc2C)cc1S(=O)(=O)NC(C)(C)C	764386317	FOWVRFTWIZEMBF-UHFFFAOYSA-N	447.517	1.175	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)CCC(=O)N1CCN(c2ccccc2)CC1	764553108	QWRJATSCSOBBRE-QGZVFWFLSA-N	442.491	1.869	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)Nc2cnn(-c3ncccc3C#N)c2)cc1	764737471	BOLBIKBJUPLZRI-AWEZNQCLSA-N	433.428	1.962	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)[C@H](O)CCc1ccccc1	765175072	HGNFOXXCWRHGAC-OAQYLSRUSA-N	444.963	1.599	50	20	IDGD	
C[C@H](c1ccsc1)N1CCN(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)CC1	765194354	MPEHQCMIKCWNGC-CQSZACIVSA-N	426.506	1.457	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)c1cccc2c1OCCO2	765756795	QBNMSSJHRPXEBW-UHFFFAOYSA-N	444.919	1.690	50	20	IDGD	
C=CCOc1cc(OC)ccc1C(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1	766337320	BQGTVSYULDWVTD-UHFFFAOYSA-N	447.513	1.650	50	20	IDGD	
O=C(COC(=O)c1ccn(-c2ccc(F)cc2F)n1)NNC(=O)c1cccc([N+](=O)[O-])c1	766826084	WDUHBXNNLUBIQV-UHFFFAOYSA-N	445.338	1.677	50	20	IDGD	
CC(C)(C)OC(=O)N1CCO[C@@H](C(=O)NNC(=O)c2cc(Br)ccc2O)C1	768158808	BEEWVPZPGRKBKV-CYBMUJFWSA-N	444.282	1.552	50	20	IDGD	
CC(C)(O)C(=O)NNC(=O)[C@@H](Cc1ccccc1)NC(=O)C12CC3CC(CC(C3)C1)C2	768260320	BAPUQWNHLJALIQ-LAHWMRIESA-N	427.545	1.849	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)[C@H]3CC(=O)N(C(C)(C)C)C3)n[nH]2)cc1OC	768279854	ULYWFMNPFZDUEG-ZDUSSCGKSA-N	429.477	1.502	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)c2nccc3c(S(N)(=O)=O)cccc23)cc1C	768470478	IBVQXVQLPRCDTM-UHFFFAOYSA-N	428.470	1.339	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)[C@H]1CC(=O)N(c2c(F)cccc2F)C1	768634861	QWSMQOUTTPLOEL-NSHDSACASA-N	439.440	1.873	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)CNC(=O)c1ccccc1C(F)(F)F	768639292	OIIVYIBVGYJGTE-UHFFFAOYSA-N	445.419	1.991	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)c2ccnc(CNC(=O)OC(C)(C)C)c2)C[C@@H](C)O1	768687990	NVUFKKCDBIJZLT-HUUCEWRRSA-N	435.525	1.367	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)NC1CCN([C@@H]2CCCC[C@@H]2O)CC1	769158847	ATVSKZBAPXFZLV-MSOLQXFVSA-N	434.537	1.562	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)Cn3cnc4c(oc5ccccc54)c3=O)nc21	770967801	HRRLFHHDRKQYLL-UHFFFAOYSA-N	448.443	1.886	50	20	IDGD	
C[C@@]1(c2ccc(F)c(Cl)c2)NC(=O)N(CC(=O)NN=c2cc[nH]cc2Cl)C1=O	771477669	FJRBYEJEBCSHAI-KRWDZBQOSA-N	426.235	1.860	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2ccn(Cc3ccccc3)n2)cc1	771857222	HKNLECJZAILLFP-UHFFFAOYSA-N	441.513	1.322	50	20	IDGD	
COc1ccc(COCCNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1	771966102	VNONJPZBIBYFTK-UHFFFAOYSA-N	428.493	1.249	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)cc(S(N)(=O)=O)c1C	772951523	CHXSNQAWFPCQEQ-LBPRGKRZSA-N	425.894	1.833	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2cccc(C(=O)N3CCSCC3)c2C)n1	773730596	HGTUDMJLKZOVJT-UHFFFAOYSA-N	430.490	1.064	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1cnn(-c2ccccc2)n1	774001325	DXDSWUBYSGFYGE-LBPRGKRZSA-N	428.836	1.474	50	20	IDGD	
CC[C@@H]1Oc2cc([C@@H](C)NCC(=O)NNC(=O)Cc3nc(C)cs3)ccc2NC1=O	775462935	GPGSJRBUXPORGW-DOMZBBRYSA-N	431.518	1.602	50	20	IDGD	
CCOC(=O)N1CCC[C@@H]([C@@H](C)NC(=O)NNC(=O)Cc2nc3ccccc3n2C)C1	777266719	QHDWVBWJZQJYJS-HUUCEWRRSA-N	430.509	1.703	50	20	IDGD	
C[C@@H]1CCN(S(=O)(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)C1	777913064	HSWCASUYSUXLQZ-OAHLLOKOSA-N	441.513	1.266	50	20	IDGD	
CC(C)(C)Oc1ccc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cn1	778187905	FCWKEEZPOVIRSW-MRXNPFEDSA-N	429.429	1.403	50	20	IDGD	
CC[C@@H](C)n1nc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cc1C	778380310	VVYWVWUMSTXWIV-MRXNPFEDSA-N	426.521	1.382	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)NCC(F)(F)CNC(=O)OC(C)(C)C)nc2ccccc21	779667253	TXLVOQMWGFTPSR-UHFFFAOYSA-N	440.451	1.606	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N2CC[C@H]([C@H](C)O)C2)cc1	781044164	VJFNPMFHFBRZKX-LGDQRBRTSA-N	437.500	1.570	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(OC3COC3)cc2)c1C	782121317	URNLVRQTZNBYLG-HNNXBMFYSA-N	427.457	1.634	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2ccc(F)cc2I)nc1	782140323	GYIZVYVZHGQHKS-UHFFFAOYSA-N	430.177	1.916	50	20	IDGD	
Cc1cnn(-c2ccc(C(N)=O)cc2NC(=O)C(=O)NNc2ncnc3ccsc23)c1	783253696	RCUWFAPZOWWOGI-UHFFFAOYSA-N	436.457	1.366	50	20	IDGD	
Cc1nc2ccc(NC(=O)C(=O)NNc3ccc(S(=O)(=O)NC(C)C)cn3)cc2s1	783263213	IJUXQNQHLSMHNL-UHFFFAOYSA-N	448.530	1.768	50	20	IDGD	
Cc1cc(F)ccc1-n1ccc(C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)n1	783274665	HHOHWCJVWRISFH-UHFFFAOYSA-N	441.375	1.846	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NN=c3sc4ccccc4n3C)cn2)C[C@@H](C)O1	783349377	HWXKRFODIJMHTI-OKILXGFUSA-N	440.529	1.819	50	20	IDGD	
C=CC(=O)NCc1ccc(C(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)cc1	783703919	IVXHHTJXBFXNAZ-UHFFFAOYSA-N	445.520	1.738	50	20	IDGD	
O=C(COCCNC(=O)c1ccccc1)NNC(=O)c1ccc(F)cc1Br	784622541	RLLLCUASPUNDDO-UHFFFAOYSA-N	438.253	1.796	50	20	IDGD	
CN(C)c1ccccc1NC(=O)C(=O)NNc1ccccc1S(=O)(=O)NC(C)(C)C	784833766	NWCIXNPJBHZOHS-UHFFFAOYSA-N	433.534	1.911	50	20	IDGD	
Cc1nc(Cn2nnc(C(=O)NNC(=O)c3ccc(F)cc3Br)c2C)no1	784864480	SRVUSAMEAILOQL-UHFFFAOYSA-N	438.217	1.303	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ccc(Cl)nc2)cc1S(=O)(=O)NC1CC1	784875032	OHUSKHVNYZLMIZ-UHFFFAOYSA-N	439.881	1.266	50	20	IDGD	
CN1CCN(Cc2cccc(NC(=O)C(=O)NNc3cccc(C(F)(F)F)n3)c2)CC1	784951450	LJHKDMBKKQAZMI-UHFFFAOYSA-N	436.438	1.930	50	20	IDGD	
O=C(NNc1nc(C(F)(F)F)cs1)C(=O)Nc1ccc(S(=O)(=O)NC2CC2)cc1	785148040	UAOHMDIJHPLHHL-UHFFFAOYSA-N	449.436	1.684	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1ccc(O[C@@H]2CCOC2)cc1	785331774	ZSNKNFLVNUPUHA-OAHLLOKOSA-N	449.485	1.348	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@H]1[C@H]2CC[C@@H](O2)[C@@H]1C(F)(F)F	785443940	MJQSJECYBCEZRP-WYUUTHIRSA-N	434.440	1.405	50	20	IDGD	
CN(C)[C@H]1CCOc2c(NC(=O)C(=O)NNc3cccc(S(C)(=O)=O)c3)cccc21	789728165	XXGXKFSIIDSFNT-KRWDZBQOSA-N	432.502	1.557	50	20	IDGD	
NC(=O)C1CCN(c2ccccc2NC(=O)C(=O)NNc2cccc(F)c2[N+](=O)[O-])CC1	790997565	AKCNQBZVITWPFH-UHFFFAOYSA-N	444.423	1.517	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)[C@](C)(O)Cn1cc(C(F)(F)F)ccc1=O	792027004	FEFWHOZFGPZWIL-GOSISDBHSA-N	437.378	1.035	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccc(NC(=O)N(C)C)c1C	792352138	BRKLINBHJCAPLL-UHFFFAOYSA-N	441.488	1.816	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)cccc1NC(=O)N(C)C	792352747	IQVQRADFDCZGFT-QGZVFWFLSA-N	425.445	1.178	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCCCC2)cc1NC(=O)C(=O)NNc1ncccc1C	792376095	PZWXRBNSQYVMMC-UHFFFAOYSA-N	447.517	1.655	50	20	IDGD	
CCCCN(C)S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2nc3ccccn3n2)cc1	792391851	KBISHEUOFLYHMU-UHFFFAOYSA-N	445.505	1.232	50	20	IDGD	
COCCN(C)S(=O)(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(CCCl)cc2)C1	792783710	NITDJEATXLCYQA-KRWDZBQOSA-N	438.999	1.529	50	20	IDGD	
CNS(=O)(=O)c1cccc2c1CCN(CC(=O)NNC(=O)c1ccccc1Cl)C2	792921812	OEINWLPUMWGSNX-UHFFFAOYSA-N	436.921	1.067	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNC(=O)NCCc1nnc(-c2ccccc2)o1	793106197	ILKWDBFDTSZBDH-UHFFFAOYSA-N	438.444	1.536	50	20	IDGD	
Cn1ccc(CCC(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)n1	794212803	UVXQQJGPMLOICM-UHFFFAOYSA-N	433.515	1.676	50	20	IDGD	
CC(C)(C(=O)NNS(=O)(=O)c1ccccc1S(=O)(=O)C(F)F)c1ccccc1	794588134	XOVVKMCSDLDYRD-UHFFFAOYSA-N	432.470	1.970	50	20	IDGD	
Cc1cc(S(=O)(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)ccc1C(=O)O	795280903	VFPFHYNGOXZVOZ-UHFFFAOYSA-N	444.469	1.607	50	20	IDGD	
COC(=O)Cn1ncc(NC(=O)C(=O)NNC(=O)CC23CC4CC(CC(C4)C2)C3)c1C	796990938	XJPVSYJFWHBIHY-UHFFFAOYSA-N	431.493	1.057	50	20	IDGD	
CN(NC(=O)Cc1ccc([S@@](C)=O)cc1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	797985175	OZWSUNFIKOULCE-SSEXGKCCSA-N	438.550	1.602	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CNS(=O)(=O)c2ccc(Cl)s2)cc1C	798306942	DESOLSCLTBTZMV-UHFFFAOYSA-N	444.922	1.083	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)CNS(=O)(=O)c2ccc(Cl)s2)c2ccccc2n1	799010109	RAXNZOWXCUELSC-UHFFFAOYSA-N	438.918	1.998	50	20	IDGD	
COC1(C(=O)NNC(=O)C(=O)Nc2ccc(C)cc2)CCN(C(=O)OC(C)(C)C)CC1	801110418	ZTFZOKRUTNHUJV-UHFFFAOYSA-N	434.493	1.497	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)[C@](C)(NC(C)=O)c2ccc(S(C)(=O)=O)cc2)cc1	802052211	LYVJKKKIGUTYSR-HXUWFJFHSA-N	448.501	1.303	50	20	IDGD	
C[C@H]1C[C@H](C)CC2(C1)NC(=O)N(CC(=O)NNC(=O)Nc1ccc3c(c1)OCO3)C2=O	802093698	WXQVGZLQWJBBRN-RYUDHWBXSA-N	431.449	1.315	50	20	IDGD	
COc1ccc(Cl)c(NC(=O)NNC(=O)c2cccc(CN3C(=O)CNC3=O)c2)c1	802107617	FTZZIQBQBNWKBV-UHFFFAOYSA-N	431.836	1.867	50	20	IDGD	
COc1ccc(C2=NO[C@@H](CNC(=O)NNC(=O)CNC(=O)c3cccs3)C2)cc1C	802356464	PESRADBRCFBMHJ-CQSZACIVSA-N	445.501	1.319	50	20	IDGD	
O=C(COC(=O)c1cc(=O)c2ccc(F)cc2o1)NNC(=O)[C@H]1COc2ccccc2O1	803928784	QGRNRQPHFPAKKY-GOSISDBHSA-N	442.355	1.076	50	20	IDGD	
CCC[C@H](NC(=O)NCc1ccc(F)cc1)C(=O)NNc1ccc(-n2ccnc2)nn1	804950794	FPTLSUSZDATUQK-INIZCTEOSA-N	426.456	1.913	50	20	IDGD	
O=C(CS(=O)(=O)c1cccc(Br)c1)NNc1ccc(-n2ccnc2)nn1	804951891	FXZZHECGETYJIH-UHFFFAOYSA-N	437.279	1.342	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2ccc(C(N)=O)c(Cl)n2)cc1Br	806840263	LTVJQVJFFKWQHG-UHFFFAOYSA-N	427.642	1.680	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCc2ccc(C[S@](C)=O)cc2)nc1	807559915	YCVUXGFUMLVPLT-NDEPHWFRSA-N	439.563	1.473	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H](N2CCN(CC(=O)NNC(=O)c3cccs3)CC2)C1	808774556	VUEJYFVTXXWFFS-OAHLLOKOSA-N	437.566	1.136	50	20	IDGD	
Cc1cnc(Br)c(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)c1	812980423	UQLFGMLMTDCIOM-UHFFFAOYSA-N	446.305	1.691	50	20	IDGD	
COCCn1nnc2c1CCN(C(=O)NNC(=O)c1ccc(Br)s1)C2	814358692	RCIGOMUNJVURMN-UHFFFAOYSA-N	429.300	1.161	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCc2nncn2C1)C(=O)Nc1ccccc1SC(F)(F)F	815692546	UGIHDXSZVIIEMM-SECBINFHSA-N	428.396	1.239	50	20	IDGD	
CC(C)(C)OC(=O)N1CCOc2ccc(NC(=O)C(=O)NNc3ncncc3F)cc2C1	815765124	GSHQLFNJFCPQBX-UHFFFAOYSA-N	446.439	1.827	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)CC(C)(C)C3CC3)CC2)cc1	815826772	ACLLDEBIVGEGPZ-UHFFFAOYSA-N	436.578	1.275	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)C(=O)Nc2cc(C)c(=O)n(C)c2)c1	815866589	HMCCXHPGPLXSNZ-UHFFFAOYSA-N	437.250	1.325	50	20	IDGD	
CCCn1c(CCC(=O)NNc2nc[nH]n2)nc2cc(S(=O)(=O)N(CC)CC)ccc21	816632078	SDEJHTHDVPNFBJ-UHFFFAOYSA-N	448.553	1.671	50	20	IDGD	
CNC(=O)[C@H](C)NC(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccc(OC)c(OC)c1	817055497	YMXPXJZZIWHPOA-KNGSKEOJSA-N	436.472	1.639	50	20	IDGD	
Cc1ccc(NC(=S)NNC(=O)CN2C(=O)c3cccc([N+](=O)[O-])c3C2=O)cc1C	913434303	DXRBUOZQFKOOJK-UHFFFAOYSA-N	427.442	1.825	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)o1	914749263	KEIUBJQVZAVTMD-LBPRGKRZSA-N	425.438	1.432	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)NCCCN1C(=O)NC2(CCCCC2)C1=O	916266550	CSRBGCFEXRKENO-CQSZACIVSA-N	449.483	1.568	50	20	IDGD	
Cc1cc(C(=O)N2CCN(CC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)CC2)c(C)o1	917167258	XTPMGGNESWOALA-UHFFFAOYSA-N	429.433	1.024	50	20	IDGD	
CCNS(=O)(=O)c1ccc(F)c(C(=O)NNc2nc3ccccc3c(=O)n2CC)c1	918017469	YAKFSLUUDDLEQS-UHFFFAOYSA-N	433.465	1.611	50	20	IDGD	
O=C(NCc1cccc(Cn2cccn2)c1)NNC(=O)c1nn(-c2ccccc2)cc1O	918131096	DFOJMPSPAFCIBG-UHFFFAOYSA-N	431.456	1.967	50	20	IDGD	
CC(=O)N[C@@H](C)c1ccc(S(=O)(=O)NNC(=O)c2cc(Br)c[nH]2)s1	918398736	FBISAFWIOQREHA-ZETCQYMHSA-N	435.325	1.659	50	20	IDGD	
O=C(NNC(=O)c1ccc(-c2ccc3c(c2)OCCO3)s1)N[C@H]1CCS(=O)(=O)C1	919883105	AJXCISLENMZHLP-LBPRGKRZSA-N	437.499	1.317	50	20	IDGD	
Cc1ccc2c(c1)C(=O)N([C@@H](C)C(=O)OCC(=O)NNC(=O)c1cccc(Cl)c1)C2=O	920058745	HUEFDLRANJKNTN-LBPRGKRZSA-N	443.843	1.637	50	20	IDGD	
O=C(NNC(=O)C(=O)NC1CC1)N[C@@H]1CC(=O)N(c2ccc(Oc3ccccc3)cc2)C1	920243781	VLSFFHIWOKPMNE-OAHLLOKOSA-N	437.456	1.193	50	20	IDGD	
CCNC(=O)NNC(=O)/C(C#N)=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	920857550	OWXNSAYAIYPEOE-UKTHLTGXSA-N	429.868	1.336	50	20	IDGD	
COc1ccc2cc(C(=O)OCC(=O)NNC(=O)[C@H]3COc4ccccc4O3)[nH]c2c1	928989700	DPQMZRPPAGFJIB-GOSISDBHSA-N	425.397	1.321	50	20	IDGD	
O=C(NNC(=O)c1cncn1-c1ccccc1)N[C@H]1CCN(c2c(F)cccc2F)C1=O	1116248861	FJJSKZSBZBQZEU-INIZCTEOSA-N	440.410	1.900	50	20	IDGD	
O=C(Cn1nc2n(c1=O)CCCCC2)NNc1ccc([N+](=O)[O-])cc1Br	1320492651	AIKZMDWNJXYOBM-UHFFFAOYSA-N	425.243	1.585	50	20	IDGD	
COCC(=O)NCCC(=O)NNC(=O)c1ccc(CSc2nc(C)cc(C)n2)cc1	1324231064	MVYGJOCFAFJLEV-UHFFFAOYSA-N	431.518	1.299	50	20	IDGD	
CNS(=O)(=O)c1cccc(CNC(=O)NNC(=O)c2ccc(Br)cc2)c1	1337490596	RHQZORTWTDBWHM-UHFFFAOYSA-N	441.307	1.501	50	20	IDGD	
O=C(CCc1nnc(-c2ccsc2)o1)NNC(=O)C1CCN(c2ncccn2)CC1	1338556982	MCUFHOWTHCFQNY-UHFFFAOYSA-N	427.490	1.585	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2ccc(NC(C)=O)c(F)c2)cc(OC)c1OC	1339507080	UHKBLVMZRJQRLS-UHFFFAOYSA-N	441.437	1.433	50	20	IDGD	
O=C(c1ccn2cncc2c1)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1778658531	QIJAMMKYDSEJID-YOEHRIQHSA-N	425.258	1.468	50	20	IDGD	
O=C(/C=C/C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Cl)C2)NCc1ccco1	1779492279	XLHJKJKSCZTHQL-CFKNTDOYSA-N	441.887	1.500	50	20	IDGD	
COc1nccc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@](C)(Cl)CCl)C3)C2)c1F	1781228131	WZEDOIOUUBQEOY-QZTJIDSGSA-N	434.295	1.909	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)C#CC3(O)CCCCC3)CCO2)C1	1781230712	YDLJYNHNDHYKRQ-ICSRJNTNSA-N	431.360	1.751	50	20	IDGD	
CO[C@@H](C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1)c1ccccc1	1781328594	TVXHLHHTTUHZTN-VKJFTORMSA-N	429.286	1.895	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H]2CCc3nc[nH]c3C2)C1	1782459840	IYTYRIREPPPZSD-GEPFMOHWSA-N	438.956	1.282	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H]3CC(c4ccccc4)=NN3)C2)C1	1782606598	WXMXNFGTBDQKNZ-AVRDEDQJSA-N	432.952	1.848	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cnc4[nH]ncc4c3)CCO2)C1	1783348858	CNHTWYRXPZAECL-KBXCAEBGSA-N	436.310	1.575	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(OC(F)F)cn3)CCO2)C1	1783531897	FJCCFAIWAIAIRQ-APPDUMDISA-N	448.264	1.910	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(-c4ccccn4)[nH]n3)CCO2)C1	1783538061	SKGNYTQVBAZYSO-DJJJIMSYSA-N	448.321	1.699	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cncc(C(F)(F)F)c3)CCO2)C1	1783878235	WSLRJDQVKFPEEB-YOEHRIQHSA-N	435.830	1.798	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](N)c3ccccn3)C[C@@H]21	1783968689	YTXCBZUHWUWZNX-UAHISNFZSA-N	439.354	1.092	50	20	IDGD	
CCOc1ccc(Cl)cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]2C1	1784091954	FWNGPSWYXDKTIE-RPZXMPESSA-N	445.343	1.932	50	20	IDGD	
COc1cc(Cl)cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]3C2)c1	1784096381	VUJSUQFBDWUUJQ-UQCMEYCASA-N	431.316	1.542	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)N1CC[C@@]2(CN(C(=O)CCBr)CCO2)C1	1785336906	BCYFSAAGDPDFMB-SFHVURJKSA-N	448.358	1.516	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC1(c2ccc(NC(=O)c3csnn3)cc2)CCC1	1786477688	VZVRDINHXBSSMM-UHFFFAOYSA-N	437.485	1.598	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)c1ccc2n[nH]cc2c1	1787302972	VOAHNYUDGCWAAL-MZGVZZPPSA-N	439.285	1.847	50	20	IDGD	
CC[C@@H](C)[C@@H](N)C(=O)Nc1ccc(C2(NC(=O)c3cnccc3C(=O)NN)CCC2)cc1	1787990299	PESPAKAMJOMDDX-AUUYWEPGSA-N	438.532	1.806	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(C)nc3OC)[C@H]2C1	1789016411	VLAPIDHVPYDLIK-HJWJTTGWSA-N	425.913	1.246	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3CCCN(C)C3)[C@H]2C1	1789740774	KKPNBLRBLWZIRF-WOYTXXSLSA-N	430.387	1.339	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3CCCN(C)C3)[C@H]2C1	1789744969	KUVOSIPREQSAGK-WOYTXXSLSA-N	430.387	1.481	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3CC=CCC3)[C@H]2C1	1789832465	QNOYNPQWOTXFAW-HQBWOOTPSA-N	441.532	1.456	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CC(=O)N(C4CCCC4)C3)C[C@@H]21	1789859107	YSTSCUMVCUWQAK-JAQSECSASA-N	439.984	1.775	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nccnc3OC)C[C@@H]21	1790960773	DUYDFSIGYYLUEO-XUXIUFHCSA-N	441.326	1.252	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3cncc(OC)c3)C[C@@H]21	1791252939	YZHPERYLDZBATI-KANFNMMFSA-N	439.940	1.256	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)c1ccc(CO)c(F)c1	1792090223	MKQKRJGGHVUEPL-ZOBUZTSGSA-N	443.313	1.696	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(CO)c(F)c3)[C@H]2C1	1792092573	KEEBLRHASXHGDI-SIUGBPQLSA-N	443.313	1.695	50	20	IDGD	
C[C@H](NNc1ccccc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2	1792508410	NAHUKGPTYIYMSD-IGNRKKQASA-N	443.317	1.272	50	20	IDGD	
N#Cc1cccc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Br)C3)c1	1792833600	GYMHANCCVJZHBO-MVJTYMMSSA-N	438.297	1.771	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CC[C@H](C(F)(F)F)CC1)C2)[C@@H](O)CCl	1792983366	JAZMMYZOSULVRP-LOVFCKMRSA-N	426.863	1.544	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CNC(=O)c1ccc(C)cc1)C2	1793456074	WQZOJHNZQXKDJQ-DMUMMCEESA-N	435.952	1.722	50	20	IDGD	
O=C(CCn1c(=O)oc2ccccc21)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2	1793985441	MSUAEZFBQZEXRU-DRXBFXEBSA-N	442.299	1.378	50	20	IDGD	
CC(C)(O)CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1794142676	KOHSTJDHTIANOQ-XGUBFFRZSA-N	431.961	1.918	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)c1cccc(C(F)(F)F)c1F	1799538213	VJWKUFOMPFBNEC-YJKIEOBBSA-N	438.805	1.647	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2	1800785606	HMOLUUUWZLLXGG-KHMAMNHCSA-N	433.908	1.510	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CCC[C@@H]3CCCC[C@@H]31)C2	1801011448	MAVGCRMVFCLXKB-FQOWZCASSA-N	448.608	1.556	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cc([N+](=O)[O-])ccc1F)C2)C(Cl)Cl	1801015276	ATPSMXMWIKQHGZ-QHBPRCKVSA-N	434.251	1.670	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)Sc1ccccn1	1801321995	IMMFFEAHSUPFSB-QKDZRIPBSA-N	442.379	1.935	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN1CCNC1=N)C2	1801437209	KESTUCQJJXNILM-FZBFXSHXSA-N	442.470	1.350	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2nc3ccccn3n2)[C@@H]1c1cccnc1)[C@H](O)CCl	1803139111	KJYCAOSPYFQRPU-ZMSDIMECSA-N	428.880	1.044	50	20	IDGD	
CCS(=O)(=O)CC(=O)NC[C@@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1	1803511434	BAUFERRYSRRPHE-WMLDXEAASA-N	446.367	1.307	50	20	IDGD	
CCN1CCN(c2ccc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)[C@@H](O)CCl)C4)cc2)CC1	1803903196	PKUNKHZFKCZDRH-NRDMVMEKSA-N	448.995	1.680	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC2(CCCN(C(=O)c3ccnc(F)c3)C2)CC1	1806305383	PWWDRDIPQYNOPD-UHFFFAOYSA-N	425.269	1.059	50	20	IDGD	
C=CCC(CC=C)C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1807359316	HQHVXSLZTMHETD-GMAHTHKFSA-N	447.344	1.849	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2cc3n(n2)CCNC3=O)[C@H]1c1cccnc1	1808249332	DYXOJHXYULHKFU-MPGHIAIKSA-N	444.923	1.359	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@H]1CCN(C(=O)Cn2cncn2)[C@@H]1c1cccnc1	1808294907	CRMFDEIMLCQSLX-KYJSFNMBSA-N	425.320	1.615	50	20	IDGD	
Cc1cc(NC(=O)CC(=O)NC[C@@H]2CCN(C(=O)[C@@H](F)Cl)[C@@H]2c2cccnc2)no1	1808394896	RVCIJXVAOZZEKS-MORSLUCNSA-N	437.859	1.947	50	20	IDGD	
Cc1ccn(CC(=O)N2CC[C@H](CNC(=O)[C@@H](F)Br)[C@H]2c2cccnc2)n1	1808650806	FZDNZBYDOSSSSR-DJIMGWMZSA-N	438.301	1.983	50	20	IDGD	
C[C@](O)(CC(=O)O)CC(=O)N1CC[C@H](CNC(=O)C(Cl)Cl)[C@@H]1c1cccnc1	1813081949	HSROTBFHUWDHIH-HNJNHCNJSA-N	432.304	1.507	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)C2(C#N)CCC2)[C@@H]1c1cccnc1	1814056397	BPDZRKSIJUJQIB-XLIONFOSSA-N	426.521	1.154	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(-n3cncn3)c2)[nH]n1)[C@H](O)CCl	1814871726	CHUYHAORONPFOC-DLBZAZTESA-N	443.895	1.896	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cccc(-n3cncn3)c2)[nH]n1)[C@H](O)CCl	1814871728	CHUYHAORONPFOC-IAGOWNOFSA-N	443.895	1.896	50	20	IDGD	
Cn1ccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)[nH]n2)c1	1816307567	OSKUJMYYSVLVCF-KRWDZBQOSA-N	436.476	1.366	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)C[C@@H]2CCCCO2)[nH]n1)c1ccc(B(O)O)cc1	1817470507	SUHCZVNQHJOUSL-PKOBYXMFSA-N	440.309	1.355	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(F)cn2)[nH]n1)c1ccc(B(O)O)cc1	1817470596	FGKOHUJDQYENJW-SFHVURJKSA-N	437.240	1.243	50	20	IDGD	
O=C(Cc1ccsc1)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1817584295	SLOKUAGDZFSAGF-GOSISDBHSA-N	438.318	1.700	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc4n(n3)CCCO4)sc2C1	1819122065	GHSGQYJFKFSDIT-GHMZBOCLSA-N	439.925	1.602	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](Cc2cnc[nH]2)NC(C)=O)n[nH]1	1822704524	ZGRGSIQRHVXXQK-USXIJHARSA-N	449.943	1.890	50	20	IDGD	
CN(C)C(=O)NCC(=O)N[C@H]1CCc2nc(NC(=O)[C@](C)(Cl)CCl)sc2C1	1822858041	TWYXJXUBKLYPII-XXFAHNHDSA-N	436.365	1.563	50	20	IDGD	
O=C1C[C@H](C(=O)N[C@@H]2CCc3nc(NC(=O)[C@@H](F)Br)sc3C2)CCN1	1823014391	VQSAETSQYFHECR-DNSOKLHBSA-N	433.303	1.272	50	20	IDGD	
Cc1ccc(CC(=O)N2CCC([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)o1	1827059776	IWEIQZZLGBTAJC-JOCHJYFZSA-N	438.333	1.744	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)c2ccc(O)cc2)CC1	1830041687	MIHZLISSURSVKD-JOCHJYFZSA-N	436.317	1.619	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4ncncc4c3)C2)C1	1830362424	WVUAIXQXJSAQTR-JOCHJYFZSA-N	446.935	1.965	50	20	IDGD	
CC(C)n1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)n1	1830364151	AJAZHOLPISOZFQ-FQEVSTJZSA-N	426.945	1.799	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C)n(CC)n3)C2)C1	1831652382	ZKHILXGULRAVKW-UZLBHIALSA-N	426.945	1.689	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cncc(F)c2)CC1	1831871997	JTKICJSAYJVRSC-LJQANCHMSA-N	433.528	1.827	50	20	IDGD	
COC1(CC(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CCC1	1832496102	HZQLKLRUWYLCOO-OAQYLSRUSA-N	442.365	1.559	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3c(C)noc3C)CCO2)C1	1832553051	IOOBRPFJSBVDCP-PXNSSMCTSA-N	427.929	1.698	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3c(C)noc3C)CCO2)C1	1832553054	IOOBRPFJSBVDCP-XLIONFOSSA-N	427.929	1.698	50	20	IDGD	
CC(C)(CCl)C(=O)NC1CCN(C2CCN(C(=O)CSCC(=O)O)CC2)CC1	1833215847	CTISIOJEMAQLIM-UHFFFAOYSA-N	434.002	1.641	50	20	IDGD	
CC[C@@H](NC)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](C)CBr)CC2)CC1	1833263168	FGBWPQBIMGCOIK-WMLDXEAASA-N	431.419	1.587	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](F)c3ccccc3)CC2)CC1)[C@@H](O)CCl	1833307970	FPUAFGPYXXOCIS-RBUKOAKNSA-N	425.932	1.869	50	20	IDGD	
COc1ccc(C(=O)N2CCC(N3CCC(NC(=O)[C@@H](O)CCl)CC3)CC2)c(C)c1	1833313272	CUXNIIRPFFLHQK-FQEVSTJZSA-N	437.968	1.789	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(OC)s3)CCO2)C1	1833426236	YULPVYFZZDWEQU-UGSOOPFHSA-N	432.926	1.081	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)C(C)(C)NC(C)=O)CC2)CC1	1833485006	WUHTZCPPDAOLLI-GOSISDBHSA-N	429.005	1.880	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)C(=O)Nc3cccnc3)CC2)CC1	1833533746	OLDSUCVFSYBOPF-IBGZPJMESA-N	449.983	1.999	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)c1n[nH]c(C2CC2)c1F	1834023748	GESKUTZBHRTMLZ-OAHLLOKOSA-N	441.935	1.211	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccnc(Cl)c1)CCO2	1834182711	YNCQEWQOKPMUTB-IBGZPJMESA-N	441.988	1.657	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)c3ccccc3O)C2)C1	1834819537	VGIGUVVCDTYMLU-GOSISDBHSA-N	427.295	1.247	50	20	IDGD	
Cc1cc(F)ccc1C(=O)N1CCOC[C@]2(CN(C(=O)CCBr)CCO2)C1	1834826397	OJPSWAOMMKXGCS-IBGZPJMESA-N	443.313	1.989	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3ccc[nH]3)CCO2)C1	1836010302	IZAGEKQOMBANMJ-KXBFYZLASA-N	442.354	1.435	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836352960	JCEBPJKJBJYUCN-NRFANRHFSA-N	446.979	1.882	50	20	IDGD	
C[C@H](NC=O)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](C)CBr)CC2)CC1	1836672917	GEROJIMRIGGQJZ-KBPBESRZSA-N	432.359	1.151	50	20	IDGD	
CCOc1ccc(C(=O)N2CCC(OC3CCN(C(=O)[C@H](O)CCl)CC3)CC2)nn1	1836718570	SYURBBCLRMMCLT-QGZVFWFLSA-N	440.928	1.087	50	20	IDGD	
Cc1nc(C)c(C(=O)N2CCOC[C@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)o1	1837715549	WQGPCTABCMBVOP-IBGZPJMESA-N	425.558	1.213	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)N1CCC(OC2CCN(C(=O)[C@H](C)Br)CC2)CC1	1838106782	LFMXAHKOVIKQRS-UONOGXRCSA-N	446.386	1.635	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3noc4ccccc34)C2)C1	1839143656	CYONKMJOPQQASR-IIBYNOLFSA-N	435.908	1.844	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3CCC(CO)CC3)C2)C1	1840030470	NDYGAQLBNQJMBZ-QAVIERHMSA-N	447.370	1.025	50	20	IDGD	
Cc1ncsc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2	1840030993	BXSYUUOWFVWKHJ-BDJLRTHQSA-N	432.340	1.305	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4sccc4[nH]3)C2)C1	1840153196	HCBOIOVLASRWLM-YJYMSZOUSA-N	441.937	1.553	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)C3CCC(O)CC3)CCO2)C1	1840274284	BYYVEAUCLLZRGR-NRERDWFFSA-N	437.364	1.230	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)C3CCC(O)CC3)CCO2)C1	1840275388	BDXBIRGPOUWOMT-YBSITQRDSA-N	447.370	1.167	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)n1cccc1)CCO2	1840348336	KHOFLNCIZGHQEG-JTDSTZFVSA-N	442.354	1.537	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CCCS1)CCO2	1840574065	FKYGHFSWFOXTEJ-CPUCHLNUSA-N	435.384	1.369	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(=O)C[C@H]1C(=O)N1CCCC12CN(C(=O)C(Cl)Cl)C2	1841433897	CEFKQZDJZCQJDA-LBPRGKRZSA-N	434.320	1.572	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H]1C(=O)N1CC2(CCCN2C(=O)CCBr)C1	1842637325	BCAPREWQTOFVLG-ZDUSSCGKSA-N	430.343	1.984	50	20	IDGD	
C[C@H](NC(=O)c1ccc(F)cc1)C(=O)N1CC2(CCCN2C(=O)CCBr)C1	1842638760	DOVHHGREBMFCAT-ZDUSSCGKSA-N	440.313	1.932	50	20	IDGD	
Cc1oc2cc(O)ccc2c1C(=O)N1CCCC12CN(C(=O)CCC(=O)NN(C)C)C2	1843742396	OKPDVIIYLHTGPJ-UHFFFAOYSA-N	428.489	1.637	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC2(CCCN2C(=O)c2nc(O)n3c2CCCC3)C1	1844396000	HDJKGKZIOLHOEE-LBPRGKRZSA-N	425.327	1.773	50	20	IDGD	
Cc1cc2[nH]c(C(=O)N3CCCC34CN(C(=O)c3cnccc3C(=O)NN)C4)cc2s1	1845618578	IMNNFGRBSFSHSA-UHFFFAOYSA-N	438.513	1.667	50	20	IDGD	
C[C@@H]1[C@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](O)CCl)CCN1C(=O)OC(C)(C)C	1847568695	ISZDZFIUMHVTAR-RBGFHDKUSA-N	429.945	1.433	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@]1(C)CCCN1	1848099843	RADWVIQAGGBNDN-VPCSNGCSSA-N	428.961	1.462	50	20	IDGD	
CCn1c(NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)nc2ccccc2c1=O	9857267	QYAQRDLTHGFORS-UHFFFAOYSA-N	441.513	1.958	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)Cc2csc(N3CCCC3=O)n2)cc1	18071639	ZBOYGSCXWRFFSX-ZDUSSCGKSA-N	432.502	1.826	50	20	IDGD	
C[C@@H]1C[C@@H](C)CN(C(=O)CN2CCN(CC(=O)NNC(=O)c3ccccc3Cl)CC2)C1	23370327	KAIFSZZCOSZJRJ-IAGOWNOFSA-N	449.983	1.223	50	20	IDGD	
CC(C)(C)c1ccc(C(=O)NCC(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1	24291543	RFEZKKNHFOKZLZ-UHFFFAOYSA-N	445.545	1.468	50	20	IDGD	
Cc1noc(C)c1S(=O)(=O)N1CCC(C(=O)NNC(=O)Cc2ccc(F)cc2)CC1	24303215	BVNGBYCAPSDDQX-UHFFFAOYSA-N	438.481	1.221	50	20	IDGD	
Cc1c(NC(=O)CSCC(=O)NNC(=O)CC(C)C)c(=O)n(-c2ccccc2)n1C	24607542	BEJDXAXRRDTQNY-UHFFFAOYSA-N	433.534	1.350	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)CCN2CCN(C(c3ccccc3)c3ccccc3)CC2)cn1	25972072	KZUDKAGMHZHXBW-UHFFFAOYSA-N	446.555	1.978	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cnc(-c3ccccc3)nc2)cc1	109259201	MWTHVQLFKQVQQH-UHFFFAOYSA-N	439.497	1.534	50	20	IDGD	
Cn1ccnc1[C@H](NC(=O)NNC(=O)CNC(=O)c1cccs1)c1ccccc1F	725872990	IMFDOERUPDJSEC-MRXNPFEDSA-N	430.465	1.471	50	20	IDGD	
CC(C)(C)OC(=O)NNC(=O)[C@@H](CCS(C)(=O)=O)NC(=O)c1ccc(Cl)cc1	725897899	LHHFBZBIVOWUGL-CYBMUJFWSA-N	433.914	1.429	50	20	IDGD	
CCOc1ccc(OCC)c(NC(=S)NNC(=O)C2CCN(S(C)(=O)=O)CC2)c1	727496610	VNVQDQAYDMLKEE-UHFFFAOYSA-N	444.579	1.473	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@H](C)C(=O)NNC(=O)CCc1nc(-c2nc[nH]n2)no1	728203375	IWNWFQQDFFAQJF-LLVKDONJSA-N	433.856	1.672	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)c1cc([N+](=O)[O-])cc2c1OCCO2	728211820	HQHAGOWWLYOFRX-UHFFFAOYSA-N	434.430	1.564	50	20	IDGD	
Cc1cc(C(=O)NNS(=O)(=O)c2cc3c(cc2[N+](=O)[O-])OCCO3)c2ccccc2n1	728261925	ZPXZBQIXSQFJPK-UHFFFAOYSA-N	444.425	1.846	50	20	IDGD	
Cc1nc(C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)nn1-c1c(Cl)cccc1Cl	728269826	YYGFULRIBKTXLL-VIFPVBQESA-N	447.304	1.014	50	20	IDGD	
C[C@@H]1Cc2ccccc2N1Cc1ccoc1C(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1	728518490	UTKZEMYVABFOIZ-CJNGLKHVSA-N	432.502	1.362	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)[C@@H]2CCCN(C(=O)c3ccccc3)C2)c2ccccc2c1=O	731186797	VNJVMZLNJBPUOD-MRXNPFEDSA-N	433.468	1.247	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)c1ccc(S(=O)(=O)N=c2cc[nH]cc2)cc1	731344595	UJHVUZFWTWGBAI-UHFFFAOYSA-N	428.445	1.447	50	20	IDGD	
CC(=O)Nc1ccc(NS(C)(=O)=O)c(C(=O)NN=c2sc3ccccc3n2C)c1	731433424	DGRADQYBMJQCED-UHFFFAOYSA-N	433.515	1.815	50	20	IDGD	
O=C(CN(Cc1ccco1)c1cccc(Cl)c1)NNC(=O)[C@@H]1CCS(=O)(=O)C1	731964547	LTEJVCXVFRJBBI-CYBMUJFWSA-N	425.894	1.522	50	20	IDGD	
CC(C)S(=O)(=O)c1ccccc1C(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	732326043	UZTKTGQYPFJALK-UHFFFAOYSA-N	449.441	1.395	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)N[C@@H]1CCN(c2ccccc2F)C1=O	732892576	DYQXMSLALPLKDX-OAHLLOKOSA-N	438.419	1.467	50	20	IDGD	
Cn1c(NNC(=O)[C@H]2CCCN2C(=O)c2ccc3c(c2)OCO3)nc2ccccc2c1=O	733260337	ALLXHJCRIMKYAE-MRXNPFEDSA-N	435.440	1.410	50	20	IDGD	
CCOCCCn1c(NNC(=O)c2cc([N+](=O)[O-])cnc2O)nc2ccccc2c1=O	733365112	GXNXSLXSOIKPSR-UHFFFAOYSA-N	428.405	1.589	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@@H]2OCCc3ccccc32)c1	733651712	OHFRUUMKBJFQTE-SFHVURJKSA-N	432.502	1.195	50	20	IDGD	
COc1cc(F)c([C@@H](C)NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1OC	734069241	MVZSRZBFDHZJPW-LLVKDONJSA-N	443.435	1.795	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)CC(=O)NNC(=O)NCCc2cccs2)cc1F	734812455	POUGDERKRYFVIG-UHFFFAOYSA-N	427.479	1.437	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCCOC1CCCCCC1	735677812	IDDZZIKLZHWTOG-UHFFFAOYSA-N	425.555	1.972	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)c1cccnc1SCc1ccc(C(N)=O)cc1	740849905	PKORXOHKNCHMJM-UHFFFAOYSA-N	443.529	1.539	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2ccnc(OCC(F)(F)F)c2)c2ccccc2c1=O	741660975	QJWIZDOBWXJMSW-UHFFFAOYSA-N	435.362	1.827	50	20	IDGD	
O=C(NCc1cccc([N+](=O)[O-])c1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	743346540	CYYGLBMWILCNNA-UHFFFAOYSA-N	447.473	1.524	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NCc2ccccc2-n2ccnc2)cc1	743560679	HGWSSEPDCZNKIP-UHFFFAOYSA-N	428.474	1.812	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)N[C@H]1CC(=O)N(CCOc2ccccc2)C1	743591677	QXNRWSNVGJDVAG-SFHVURJKSA-N	435.484	1.652	50	20	IDGD	
Cc1nn(C)c(C)c1C[C@@H](C)C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	744621447	SBEJSXQSZYSZLR-CQSZACIVSA-N	435.550	1.380	50	20	IDGD	
O=C1C[C@@H](C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)c2ccc(F)cc2N1	744622284	ZJYDZXAPDWKCDD-OAHLLOKOSA-N	448.476	1.416	50	20	IDGD	
C[C@@H](CCN(C)C)NC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	744865290	GNIBYVJYNMXECC-INIZCTEOSA-N	447.561	1.449	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)NCCCOC1CCOCC1	745844948	CXBOWCQJYRXQTB-UHFFFAOYSA-N	430.299	1.744	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCC(C)(C)C[C@@H](C)O)c1	745845061	HFINKYWRONRJES-CQSZACIVSA-N	428.555	1.458	50	20	IDGD	
Cc1cc(N2CC[C@@H](NC(=O)NNC(=O)c3ccc(OCCC(C)C)cc3)C2=O)n(C)n1	745904502	BWSCDGHIVNNFGK-GOSISDBHSA-N	442.520	1.903	50	20	IDGD	
O=C(NNC(=O)[C@H]1CN(Cc2nc(O)c3ccccc3n2)CCO1)c1cccc(Cl)c1	746095509	SDRORSSKJXXPFF-QGZVFWFLSA-N	441.875	1.651	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc([N+](=O)[O-])cc1Br)c1cccc([N+](=O)[O-])c1	746591714	PROBQRGQQZNXDG-UHFFFAOYSA-N	445.207	1.889	50	20	IDGD	
Cc1ccc(S(=O)(=O)Nc2ccc(F)cc2)cc1C(=O)NNc1nccn(C)c1=O	747942015	KHFUTJZAEJFTLV-UHFFFAOYSA-N	431.449	1.786	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)C(=O)N1CCCC1)c1cc2c(cc1Br)OCCO2	748462506	UJMBFZDQCAXPPM-JTQLQIEISA-N	441.282	1.234	50	20	IDGD	
CC(C)(C)[C@H]1CCc2sc(C(=O)NNC(=O)Cn3cc(S(N)(=O)=O)cn3)cc2C1	748555337	PDSJUSNATFWSJZ-LBPRGKRZSA-N	439.563	1.204	50	20	IDGD	
C[C@@]1(NNC(=O)NCc2cccc(Cn3cnc4ccccc43)c2)CCS(=O)(=O)C1	749220119	IXPPWDMDSNPRTJ-OAQYLSRUSA-N	427.530	1.966	50	20	IDGD	
C[C@@H](CC(=O)NNC(=O)c1cc2ccccc2o1)/N=C1/NS(=O)(=O)c2ccccc21	749473015	ZXXINXXVLXUINB-LBPRGKRZSA-N	426.454	1.711	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2cc3ccccc3o2)cc1	749552815	BLHNXALVSKWCIJ-UHFFFAOYSA-N	446.485	1.502	50	20	IDGD	
CC[C@H](C)NC(=S)NNC(=O)c1cc(S(=O)(=O)NCc2ccccc2)ccc1O	749760321	BSEQWUMBCAWHFE-ZDUSSCGKSA-N	436.559	1.778	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)c2cccn3c(I)cnc23)c1	750611919	DWTJFLAIXUOGSY-UHFFFAOYSA-N	431.193	1.885	50	20	IDGD	
C[C@@H](NC(=S)NNC(=O)C1CCN(S(=O)(=O)/C=C\c2ccccc2)CC1)C1CC1	751620796	MHTOSURCUXNIGU-QKXCFHHRSA-N	436.603	1.993	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)c1nc(Cc2ccccc2)no1	753041870	ZTJFQJUSFVHOTE-CYBMUJFWSA-N	447.455	1.613	50	20	IDGD	
C[C@@H](CC(=O)OCc1ccccc1)NC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	753128565	RBKPNNCALWLXPA-AWEZNQCLSA-N	433.486	1.556	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)Cc2cc(Cl)cc3c2OCC3)ccc1Cl	754847502	XYNLRBHUVKMNBO-UHFFFAOYSA-N	444.296	1.579	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1cc(-c2cccs2)n(-c2ccccc2)n1	755065529	SFQRUZIKDGYNGG-CYBMUJFWSA-N	430.511	1.797	50	20	IDGD	
CN1C(=O)C[C@@H](NC(=O)NNC(=O)C(=O)Nc2ccccn2)[C@H]1c1ccc(Cl)c(F)c1	755087320	KTSZIZBIBHNIFR-CZUORRHYSA-N	448.842	1.115	50	20	IDGD	
CN(C)c1ccc(S(=O)(=O)N2CCCCC2)cc1NC(=O)NNC(=O)c1cnccn1	755435824	PEBFJTIJCGZBMO-UHFFFAOYSA-N	447.521	1.184	50	20	IDGD	
COC(=O)CNC(=O)Cc1ccc(NC(=O)NNC(=O)COc2ccc(Cl)cc2)cc1	755861957	JYFIUVHTKPFDHC-UHFFFAOYSA-N	448.863	1.403	50	20	IDGD	
COC(=O)CCN(CC(=O)NNC(=O)c1cccc(C#N)c1)Cc1ccc(F)c(F)c1	756531013	VSEJRUSALRFNSZ-UHFFFAOYSA-N	430.411	1.663	50	20	IDGD	
O=C(COC(=O)[C@H](O)c1cc(Cl)cc(Cl)c1)NNC(=O)c1ccc([N+](=O)[O-])cc1	756750177	AYQGKAVBPBALQB-OAHLLOKOSA-N	442.211	1.939	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2cccc3ncccc23)cc1	756782348	AQNGUSZUFTYAHG-UHFFFAOYSA-N	443.485	1.626	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)CN2C(=O)NC3(C[C@@H](C)C[C@H](C)C3)C2=O)cc1C	756866107	WSZGRXFLEHAORR-KBPBESRZSA-N	430.505	1.576	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1cccc(NC(=O)C2CCCCC2)c1	756887975	XPJHDEYDPOIEMW-GFCCVEGCSA-N	425.511	1.296	50	20	IDGD	
NC(=O)c1ccc(NNC(=O)[C@@H]2CC(=O)N(c3ccc4c(c3)Cc3ccccc3-4)C2)nn1	757403258	ZKTGNIYRMWSIGP-OAHLLOKOSA-N	428.452	1.643	50	20	IDGD	
CCN(c1ccccc1)S(=O)(=O)c1ccc(C(=O)NNc2ccc(C(N)=O)nn2)cc1	757407138	GHBBHEJUJPLQBX-UHFFFAOYSA-N	440.485	1.548	50	20	IDGD	
C[C@@H]1C[C@H](NC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])CN1Cc1ccccc1	757769037	VICJQFZCHJUHHS-WBVHZDCISA-N	427.461	1.967	50	20	IDGD	
O=C(NNC(=O)C(=O)Nc1ccccn1)N[C@@H]1CCN(c2ccccc2Br)C1	758766796	PQORYTXCFAJBGL-GFCCVEGCSA-N	447.293	1.392	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)NCc1ccc(S(C)(=O)=O)c(Cl)c1	759299954	SVPZROYBRADSIQ-UHFFFAOYSA-N	434.902	1.099	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H]2Cc3cccc(O)c3C2)c1	759489672	IZCONNMXDUJOQB-INIZCTEOSA-N	446.529	1.534	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@@H]2CC[C@H]3SCCS[C@H]23)c2ccccc2c1=O	763077139	BLXPJMRFDQYETD-IIAWOOMASA-N	433.559	1.740	50	20	IDGD	
CCCCS(=O)(=O)N1CCC[C@@H]1C(=O)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	763173179	LRZRPWCLIXMRFC-QGZVFWFLSA-N	437.497	1.571	50	20	IDGD	
CN(C)C(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2Br)cc1	763482887	MVQBWTCUSQMJQK-UHFFFAOYSA-N	447.289	1.480	50	20	IDGD	
C[C@H]1CN(c2ccccc2NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)C[C@H](C)O1	763548758	PWEDVGXEPMQSRO-KBPBESRZSA-N	440.456	1.429	50	20	IDGD	
COCCOC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)c1	763548807	SBWQHPCAVWRFIP-UHFFFAOYSA-N	444.400	1.010	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)C(=O)Nc1ccc(NC(=O)c2ccccc2)nc1	763552007	VALVIWMCGYKPTB-UHFFFAOYSA-N	447.407	1.462	50	20	IDGD	
C=CCN(C)S(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(C)oc2C)cc1	763576206	IHXORFKSHWTGEV-UHFFFAOYSA-N	434.474	1.103	50	20	IDGD	
COCCCOc1ccccc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccccc2)[nH]n1	763601165	PJWUIDDJKUCZGE-UHFFFAOYSA-N	437.456	1.892	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(C(=O)NC(C)C)cc2C)cc1	763659161	KAVKUOXHGDZSEO-UHFFFAOYSA-N	442.472	1.307	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(OCc3cccnc3)c2)cc1	763674321	OIEMSGGPWMCVNL-UHFFFAOYSA-N	445.435	1.697	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(N3CCOCC3)c(C)c2)cc1C	763681455	XJXFVFVKOIXHOH-UHFFFAOYSA-N	440.500	1.613	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-]	763820657	OVAKAVCQGSKOFN-UHFFFAOYSA-N	441.322	1.122	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(S(=O)(=O)NC3CC3)c2)cc1	763831625	KESDXZWLKAZGHI-UHFFFAOYSA-N	430.486	1.089	50	20	IDGD	
CCCNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)c1	763841211	OWBACSSTJSFAKB-MRXNPFEDSA-N	440.500	1.997	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)COc2ccccc2Br)n1	763858449	BEEVNNYVJMSAEE-UHFFFAOYSA-N	442.291	1.526	50	20	IDGD	
COCCn1ncc2ccc(NC(=O)C(=O)NNC(=O)Cc3c[nH]c4ccccc34)cc21	763861485	REHFMCYPMDHWNL-UHFFFAOYSA-N	434.456	1.493	50	20	IDGD	
COCCOc1cc(NC(=O)C(=O)NNC(=O)Cc2ccc(Cl)cc2)ccc1OC	763936378	ICQFNNXPLPQXEX-UHFFFAOYSA-N	435.864	1.702	50	20	IDGD	
Cc1nc2cc(NC(=O)C(=O)NNC(=O)c3cc(Br)cn3C)ccc2n1C	764004592	INVQGJUGQPWUIC-UHFFFAOYSA-N	433.266	1.382	50	20	IDGD	
CC(C)CNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1	764006057	JPBZKGADIOMHER-UHFFFAOYSA-N	440.456	1.243	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1cnn(-c2ncccc2C#N)c1	764013061	UQKAZTVUTOKFIL-UHFFFAOYSA-N	439.819	1.201	50	20	IDGD	
CCS(=O)(=O)c1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)Cc1ccsc1	764034906	LSZLNFLZYQDPAQ-UHFFFAOYSA-N	429.907	1.524	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccccc1S(=O)(=O)C(F)F	764048608	PZLZUTVTPISNSR-UHFFFAOYSA-N	427.385	1.091	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc4c(c3)N(C)CCO4)n[nH]2)cc1	764111651	QGWSADQPLSITNY-UHFFFAOYSA-N	434.456	1.613	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)cccc1N1CCOC1=O	764117758	RAORUGMZLUTIHF-UHFFFAOYSA-N	432.820	1.710	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)CCc2ccccc2)cc1C	764192852	KYQHGXSVDNADCN-UHFFFAOYSA-N	432.502	1.475	50	20	IDGD	
CC(=O)Nc1cc(NC(=O)C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)ccc1F	764204070	RUQDCVYNUPGLKK-UHFFFAOYSA-N	439.444	1.175	50	20	IDGD	
Cc1cc(Br)c(NC(=O)C(=O)NNC(=O)c2cccc(C#N)c2)cc1[N+](=O)[O-]	764241586	BMLNQOZQMHQJPR-UHFFFAOYSA-N	446.217	1.937	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(N2CCCCCCC2)c(F)c1	764399064	JKRSFTIBYNHAHC-HNNXBMFYSA-N	438.500	1.734	50	20	IDGD	
Cc1cccc(CSCC(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)c1	765732067	FXOPIBNTKYKKOI-UHFFFAOYSA-N	440.569	1.834	50	20	IDGD	
CSCC[C@H](NC(=O)c1ccc2ccccc2n1)C(=O)NNC(=O)c1cc(C)[nH]n1	768274010	MRMWPLGXMGOSLK-INIZCTEOSA-N	426.502	1.579	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)c1ccc(Br)cc1Br	768389647	XYKKVHDWARMMIK-UHFFFAOYSA-N	445.067	1.996	50	20	IDGD	
Cc1ccccc1C(C)(C)C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	769107926	YHHCIICUUJGIIH-UHFFFAOYSA-N	431.562	1.747	50	20	IDGD	
CS(=O)(=O)c1ccc(C(=O)NNC(=O)COc2ccccc2O)cc1Br	769783166	DWESDOHUGJBCPX-UHFFFAOYSA-N	443.275	1.398	50	20	IDGD	
COCCCS(=O)(=O)NCC(=O)NNC(=O)c1cc2c(s1)CC[C@H](C(C)(C)C)C2	770126627	DBTAKQMCCBATIP-AWEZNQCLSA-N	445.607	1.616	50	20	IDGD	
CSCCNC(=S)NNC(=O)c1cc([N+](=O)[O-])ccc1I	770239136	GZCIMFKAYIOCAV-UHFFFAOYSA-N	440.288	1.671	50	20	IDGD	
O=C(NNc1nccc(N2CCOCC2)n1)[C@H]1CCN(C(=O)OCc2ccccc2)C1	770622636	SKHPMKBQQNELHK-KRWDZBQOSA-N	426.477	1.415	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)Nc1ccc(-n2ncn(C)c2=O)cc1	770628955	HRULLXMKIQQFDZ-LBPRGKRZSA-N	430.852	1.845	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccnn2-c2cccc(F)c2)cc1	770774704	RTYWOXMWZYNWJT-UHFFFAOYSA-N	427.392	1.185	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)CN1C(=O)N[C@]2(C[C@@H](C)CC(C)(C)C2)C1=O	771971227	YFWDVPXYDUMRJQ-RXSFTSLZSA-N	438.525	1.248	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)c1ccc([N+](=O)[O-])c2cccnc12	772196877	SOOPIAHHOCAFOP-UHFFFAOYSA-N	427.804	1.874	50	20	IDGD	
Cc1ccc([C@@]2(C)NC(=O)N(CC(=O)NNc3cccc(S(C)(=O)=O)c3)C2=O)cc1	776537275	ANNILIXRBNXZSV-HXUWFJFHSA-N	430.486	1.309	50	20	IDGD	
COCCOc1cc([N+](=O)[O-])c(C(=O)NNc2cccc(S(C)(=O)=O)c2)cc1OC	776715139	QQCOYHWDUBDHFE-UHFFFAOYSA-N	439.446	1.789	50	20	IDGD	
O=C(NC[C@@H]1COC2(CCCCCC2)O1)NNC(=O)c1csc(N2CCOCC2)n1	776885909	XCBYFIFUJPRZCH-CQSZACIVSA-N	439.538	1.390	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CC[C@]2(C1)C(=O)Nc1ccccc12	778205342	AXDREPKQRVRCJY-OAQYLSRUSA-N	428.876	1.705	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)NC[C@H](c1cccc(F)c1)N1CCOCC1	778632537	VSJYNZVMVXUAPW-MRXNPFEDSA-N	439.488	1.054	50	20	IDGD	
CNS(=O)(=O)c1ccc(C(=O)NNc2ccc([N+](=O)[O-])cc2Br)cn1	779146998	QOKSMRNAJBSXBG-UHFFFAOYSA-N	430.240	1.417	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CSc2n[nH]c(-c3ccc4c(c3)OCCO4)n2)c1	779827262	INGJLEWAZHPCPT-UHFFFAOYSA-N	436.453	1.668	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)nn1-c1cccc(C#N)c1	779948012	AMGGDOYXEGGOCJ-UHFFFAOYSA-N	436.859	1.783	50	20	IDGD	
O=C(NN=c1cc[nH]cc1)c1cccc(NS(=O)(=O)c2ccc3nnn(O)c3c2)c1	780762031	VHAXYOWATWCAMC-UHFFFAOYSA-N	425.430	1.043	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCC(=O)NNc2ncncc2Cl)cc1OCC	781824499	SQIZRILJWMPATO-UHFFFAOYSA-N	429.886	1.349	50	20	IDGD	
COc1ccc(NNC(=O)Nc2ccc(F)c(S(=O)(=O)N3CCOCC3)c2)nc1	782018360	IVLYHIGVMJEIQS-UHFFFAOYSA-N	425.442	1.399	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)CNC(=O)c2ccco2)ccc1OCC(F)(F)F	784004127	IIPQIHIBQKPCFM-UHFFFAOYSA-N	442.350	1.045	50	20	IDGD	
CCNC(=O)N(C)NC(=O)C(=O)Nc1ccc(S(=O)(=O)N(C)Cc2ccccc2)cc1	784915272	JBKVMWJQMXGZNA-UHFFFAOYSA-N	447.517	1.138	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)C[C@@H](NC(=O)OC(C)(C)C)C2CC2)c2ccccc2c1=O	785014198	SJABQKVXXTVDSB-OAHLLOKOSA-N	429.477	1.388	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(c2ncc(NC(=O)NNC(=O)c3ccc[nH]3)cn2)CC1	786184035	UDTAZKJJFYMZFH-UHFFFAOYSA-N	430.469	1.328	50	20	IDGD	
COc1cc(C(=O)NNc2nnc(-c3ccccn3)s2)cc(Cl)c1OCC(N)=O	788563523	HYMDJKDZPTUPGE-UHFFFAOYSA-N	434.865	1.883	50	20	IDGD	
Cc1cc(-n2cccn2)ccc1NC(=O)C(=O)NNC(=O)COc1ccccc1[N+](=O)[O-]	789585678	BVAAWBLWXMYIIV-UHFFFAOYSA-N	438.400	1.254	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2cccc3c2OCC3(C)C)CC1	790730710	RIOOUFHSTFFJPK-UHFFFAOYSA-N	445.545	1.445	50	20	IDGD	
Cc1cc(F)c(Br)cc1S(=O)(=O)NNC(=O)COc1ccccc1O	790846918	RPTPASUENKWHQI-UHFFFAOYSA-N	433.255	1.991	50	20	IDGD	
Cn1nc([C@@H]2CCCOC2)cc1NC(=O)C(=O)NNC(=O)c1cc2ccccc2cc1O	790956002	CHLPRBGSHILEES-OAHLLOKOSA-N	437.456	1.573	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc(C)o2)cc(N2CCN(C(C)C)CC2)c1	792265691	HAPQDGUJUVJNQY-UHFFFAOYSA-N	427.505	1.827	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N2CCO[C@@]3(CCO[C@@H]3C)C2)cc1Br	792930805	AZICWKYKBBEBKQ-DIFFPNOSSA-N	428.283	1.692	50	20	IDGD	
O=C(Cc1ccc2n[nH]cc2c1)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	793683802	VECNRRMZFFIVIM-UHFFFAOYSA-N	440.935	1.724	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)CN1C(=O)C(F)(F)Oc2ccccc21	794411293	CULSXJAYEHZERD-UHFFFAOYSA-N	437.424	1.953	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CN2C(=O)c3ccccc3N3C(=O)CC[C@@]23C)cc1	801108596	PJIPYTKFHSZWLP-QHCPKHFHSA-N	449.467	1.080	50	20	IDGD	
CN(C)C(=O)Cn1cc(C(=O)NNc2c(Br)cccc2Br)nn1	801506191	ZGLVGCSCQOVUHD-UHFFFAOYSA-N	446.103	1.648	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NC[C@@H](O)c1ccc(C(F)(F)F)cc1	805044162	ICYXSFXOMBAQMU-GFCCVEGCSA-N	430.408	1.561	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)N[C@@H]1CCCN(C(=O)CCC(F)(F)F)C1	805044410	QYSNIDQFKWVOTL-LLVKDONJSA-N	449.455	1.142	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)C2CCN(c3ccc(C#N)cc3F)CC2)C[C@@H](C)O1	806341042	YKZZQMVXVTYWGD-HZPDHXFCSA-N	431.512	1.560	50	20	IDGD	
O=C(NCc1ccccc1CN1CCOCC1)NNC(=O)[C@H]1COc2ccccc2O1	807025869	DRMMMHWRLUWCLN-HXUWFJFHSA-N	426.473	1.189	50	20	IDGD	
O=C(N[C@@H](C(=O)NNc1nccc(N2CCOCC2)n1)c1ccccc1)c1ccccc1	807076263	ZCFQNVJWKFBERY-HXUWFJFHSA-N	432.484	1.928	50	20	IDGD	
Cc1cc([N+](=O)[O-])ccc1NNC(=O)C(=O)N1CCc2cc(S(=O)(=O)N(C)C)ccc21	807457286	YBRRXOHYLYPQBX-UHFFFAOYSA-N	447.473	1.186	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)CNS(=O)(=O)c3ccccc3F)n[nH]2)c1	810584480	RZTHQVYWJCZYAU-UHFFFAOYSA-N	445.476	1.572	50	20	IDGD	
C[C@H]1CN(C(=O)NNC(=O)c2ccc(Br)cc2Cl)C[C@H](C)S1(=O)=O	811875103	SMSFQEJWVUMQDQ-IUCAKERBSA-N	438.731	1.964	50	20	IDGD	
CC(=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O)c1ccc(F)c(Br)c1	812456688	OEOBVFZGFXYGBK-UHFFFAOYSA-N	444.286	1.013	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccc(N3CCCC3)nc2)cc1	813033334	ODWHMHFSTKEFJR-UHFFFAOYSA-N	432.506	1.014	50	20	IDGD	
CCOC(=O)Nc1scnc1C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	813433096	CTLLQYUQRQSBBP-UHFFFAOYSA-N	425.492	1.909	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NN=Cc3cnn(C)c3N)c2)cc1	814689331	NMYQHBPKSBHLMB-UHFFFAOYSA-N	428.474	1.576	50	20	IDGD	
COCc1cc(NC(=O)C(=O)NNC(=O)c2cccc3ncccc23)cc(C(=O)OC)c1	815569523	XKSSYIPCWHTTNN-UHFFFAOYSA-N	436.424	1.568	50	20	IDGD	
C[C@@H](C(=O)N1CCN(S(=O)(=O)CBr)CC1)[C@H]1OCCc2sccc21	815964990	ZBTLLKLLFPIXKB-BXUZGUMPSA-N	437.381	1.824	50	20	IDGD	
Cc1ccc(N2C[C@H](C(=O)NNC(=O)c3nn(-c4ccccc4)cc3O)CC2=O)cc1F	844265470	ZANVDMZZROEWEJ-CQSZACIVSA-N	437.431	1.840	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)[C@]12CCC(=O)N1CCS2	849201896	CMAHKADKJCLIAG-QLJPJBMISA-N	428.308	1.429	50	20	IDGD	
COc1ccc(NC(=O)COc2ccc(C(=O)N3CC[C@H](B(O)O)C3)cc2OC)cc1	864234912	YTXLIZVLISJAMI-HNNXBMFYSA-N	428.250	1.410	50	20	IDGD	
O=C(Cn1cc([N+](=O)[O-])cn1)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	912984179	NXJUVXNXYPPRKL-UHFFFAOYSA-N	447.411	1.011	50	20	IDGD	
C=CCNC(=S)NNC(=O)c1ccc(F)c(S(=O)(=O)Nc2ccc(OC)cc2)c1	913438019	HKSXGGLSOWNWBB-UHFFFAOYSA-N	438.506	1.930	50	20	IDGD	
CN(C)c1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)ccn1	915635395	MLBZEPBCRYLAMR-UHFFFAOYSA-N	431.518	1.397	50	20	IDGD	
Cc1nn(C(C)(C)C)c2nc(C(C)C)cc(C(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)c12	915831980	DPKWBDQJRPGWHW-ZDUSSCGKSA-N	435.550	1.814	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)cc(OCC)c1OCC	915880344	ITQSYAYIMJBATK-ZDUSSCGKSA-N	429.495	1.014	50	20	IDGD	
Cc1nnnn1[C@@H](Cc1cccc(F)c1)C(=O)NNC(=O)c1nnc(O)c2ccccc12	916124166	BAQYYMMXYYBDBH-INIZCTEOSA-N	436.407	1.014	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)NCCNS(=O)(=O)c3ccccc3)cc2C1	916295110	JBOSDPNKTOFYRB-ZDUSSCGKSA-N	436.559	1.795	50	20	IDGD	
Cc1nn([C@H]2CCS(=O)(=O)C2)c(Cl)c1C=NNC(=O)CCN1CCCCCC1	916356279	ZPPSQJNSLDJIMK-HNNXBMFYSA-N	429.974	1.921	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)CNC(=O)NC2CCCCC2)c2ccccc2c1=O	917914430	DRISCJCYMUVJTN-UHFFFAOYSA-N	428.493	1.370	50	20	IDGD	
CCCCn1c(C)cc(/C=C(\C#N)C(=O)NCCC(=O)N[C@@H]2CCS(=O)(=O)C2)c1C	918569842	LFKZVGQKXOOQNI-TVNWYLLRSA-N	434.562	1.622	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)CSc2ccc(C(N)=O)cc2[N+](=O)[O-])cc1	919836501	VAPUXXYHZXUNLK-UHFFFAOYSA-N	432.458	1.575	50	20	IDGD	
O=C(CSc1nnc(O)nc1O)NN=C1CCOc2c(Br)cccc21	920370864	NFXQTZPFYVAIGP-UHFFFAOYSA-N	426.252	1.440	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)Nc2nc(CN3C[C@@H](C)O[C@H](C)C3)cs2)c1O	920938312	JXRGRJPDRQRSKZ-VXGBXAGGSA-N	435.506	1.933	50	20	IDGD	
O=C(NNC(=O)c1ncoc1[C@H]1CCCO1)c1ccc(S(=O)(=O)N2CCCC2)cc1	1116072057	WFFHQDVCPHXVLK-OAHLLOKOSA-N	434.474	1.385	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)c2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1	1116171320	RKYZDIZVRGPUAH-SFHVURJKSA-N	438.484	1.315	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@H](C(=O)NNc3nncc(N)c3Cl)C2)s1	1116298064	JMKBFTZKYWNCGP-JTQLQIEISA-N	430.943	1.626	50	20	IDGD	
O=C(N[C@H](Cc1ccccc1)C(=O)NNC(=O)c1n[nH]c2c1CCCC2)c1cccnc1	1318018208	YVLQRBFPVBIEBE-LJQANCHMSA-N	432.484	1.486	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)NCCN2C(=O)COc3ccccc32)c1C	1320545172	KZQZUOBAMPAEFH-INIZCTEOSA-N	426.473	1.827	50	20	IDGD	
O=C(c1csc(C(F)(F)F)n1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1779754354	JFSUZZCJHWANHH-IINYFYTJSA-N	427.832	1.205	50	20	IDGD	
O=C(Cc1[nH]nc2c(Cl)cccc12)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1780937088	BEUQJVHCFBSZME-BEFAXECRSA-N	441.315	1.188	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)COCCNC(=O)OC(C)(C)C)CCO2)C1	1781216827	OYBHPBLXWJNVOE-QRWLVFNGSA-N	447.960	1.375	50	20	IDGD	
O=C(c1c[nH]c2ncccc12)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781329885	MQFIBNVINYRLMB-SUMWQHHRSA-N	425.258	1.697	50	20	IDGD	
Cn1nc2c(c1C(=O)N1CCO[C@@]3(CCN(C(=O)[C@H](F)Br)C3)C1)CCC2	1781332796	JICWGQNOXBNKNL-WMLDXEAASA-N	429.290	1.043	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(O)c([N+](=O)[O-])c3)C2)C1	1781543945	VYAMKKJRGCTXOT-DIFFPNOSSA-N	442.266	1.527	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccncc1O)C2	1781998076	SGNXELCNTLQERM-WBHUJUFNSA-N	426.311	1.698	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4c(c3)NC(=O)CC4)C2)C1	1782517050	WIQZGBVGJRMFHZ-QFIPXVFZSA-N	445.592	1.866	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)Cc3c(C)noc3C)CCO2)C1	1783344554	UQAYFHDSOMAUTA-CRAIPNDOSA-N	428.327	1.837	50	20	IDGD	
CCOc1ncccc1C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](C)Br)C2)C1	1783528550	OSKUQJOFUHIUDD-UGSOOPFHSA-N	426.311	1.707	50	20	IDGD	
COc1cc(C#N)cc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](C)Br)C3)C2)c1	1783538394	UOUPUWQWLCRPQI-ORAYPTAESA-N	436.306	1.794	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cc(C)ccc3-n3ccnn3)CCO2)C1	1783883967	XIMCVLLJASVFOZ-LAUBAEHRSA-N	447.923	1.273	50	20	IDGD	
CCCNC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)CBr)C[C@@H]21	1784374268	VLMZWDIPSJULOC-UGUYLWEFSA-N	446.386	1.304	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](NC(C)=O)C(C)(C)C)C[C@@H]21	1784615112	IBFHEBKAVRVAMD-ATIWLJMLSA-N	429.989	1.924	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3ccc(F)nc3)[C@H]2C1	1785236094	ZLMSTWAYGLGWMN-QAETUUGQSA-N	427.904	1.387	50	20	IDGD	
Cc1ccc2c(/C=C/C(=O)N3CC[C@@]4(C3)CN(C(=O)[C@@H](O)CCl)CCO4)c[nH]c2c1	1785664012	PQHQAYHLYRZXPW-SCORFMEWSA-N	431.920	1.919	50	20	IDGD	
CCc1[nH]nc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Br)C[C@@H]32)c1F	1785793978	AQQMULNZFWBMKK-KJWJVKQFSA-N	435.269	1.395	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(Cl)nc4n[nH]cc34)C[C@@H]21)[C@H](F)Cl	1787446254	ZZSPSQSXMHYHHD-FNYBSCSFSA-N	430.267	1.739	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)ccc3O)C[C@@H]21)[C@@H](F)Br	1789923267	BQURCFIJGRQIFL-MOUXYMJCSA-N	431.258	1.382	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3N(C)C)C[C@@H]21	1791056781	BCAFPBXQNLCWEJ-RMRKRWHISA-N	439.354	1.524	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3n[nH]c4ccc(F)cc34)C[C@@H]21	1791254393	RSCFLJJFQBLQJL-RMIITELYSA-N	438.887	1.549	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cccc(F)c1)C2	1792867938	OEDPJRSNFUVZOY-LJGDNWOOSA-N	427.314	1.989	50	20	IDGD	
CCN(CC)C[C@H](C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)CBr	1792872133	NLOIYGPLNYJRSI-VIQHNZTISA-N	432.403	1.585	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CC(=O)N(C2CCCC2)C1	1793777704	ADBQRSWNIOLGIS-DHBZOUTCSA-N	425.957	1.385	50	20	IDGD	
COc1cccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCBr)C3)n1	1793986346	BOGHPIDQIOZCMO-IVWMJMPLSA-N	426.311	1.007	50	20	IDGD	
Cn1cc2cc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)CCBr)ccc2n1	1795115088	HLXOJPZHWARDSG-JLVBRIDZSA-N	435.322	1.562	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)COCc1ccccc1	1795426724	HSFAXEHYVIRNEE-NYCLONFESA-N	425.323	1.576	50	20	IDGD	
CN(CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCC#N)NC(=O)NCc1ccccc1	1795857937	BFQXUPJLECKFFD-REPLKXPHSA-N	426.521	1.275	50	20	IDGD	
Cc1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)nc2ccccc12	1796188974	IJNOHHUTOYKLCM-ACDBMABISA-N	443.312	1.789	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(Cl)c2nncn2c1	1797688391	MKFXEDSQXYMJJT-FQLMCAECSA-N	440.331	1.993	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(C)(C)C)C2	1798522334	PNSBAJIJJXANNS-ZSBFGKGUSA-N	433.461	1.769	50	20	IDGD	
CCCC(=O)N[C@@H](C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](Br)CC	1800641865	KWMZTRIHRQQVPR-JAAXMTQOSA-N	432.359	1.054	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc(C)c([N+](=O)[O-])c1)C2	1800977573	STCXWNPEDFQKQW-YYAJDYIMSA-N	439.896	1.289	50	20	IDGD	
CC[C@@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccn3c(O)nnc13)C2	1801801185	BBDJAMHXOKRWGE-GFQSEFKGSA-N	436.310	1.860	50	20	IDGD	
CC(C)(C)OC(=O)NCCOCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C(Cl)Cl	1802346274	LHZDZAZVAAHKAF-CLLJXQQHSA-N	438.352	1.970	50	20	IDGD	
C=CCNC(=O)/C=C\C(=O)NC[C@@H]1CCN(C(=O)[C@@H](Cl)COC)[C@H]1c1cccnc1	1802499258	ROTJBJHJCXUSJW-XQFGLIHHSA-N	434.924	1.200	50	20	IDGD	
O=C(CCC(=O)N1CCCC1)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1	1804144683	BGZAOWHRUZNPKW-QKLQHJQFSA-N	436.940	1.090	50	20	IDGD	
O=C(CCBr)NC[C@@H]1CCN(C(=O)c2cccc(=O)n2O)[C@H]1c1cccnc1	1806340017	XNBMNVPDGGSHLY-KSSFIOAISA-N	449.305	1.585	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H](CNC(=O)[C@@H]2CCC(=O)N2)[C@H]1c1cccnc1	1806638626	BLOMHALAVBYELF-WBTNSWJXSA-N	437.338	1.540	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)C2CC(F)(F)C2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807360154	OREOTJPPYUASOC-LPHOPBHVSA-N	443.259	1.126	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H]2CC=CCC2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1	1807374080	XGUFMDRFYGLXLO-XJABCFGWSA-N	433.317	1.437	50	20	IDGD	
C=CCC(F)(F)C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1807374491	ZSBJLZJGAKZJRD-HKUYNNGSSA-N	443.259	1.292	50	20	IDGD	
CN1C(=O)CC[C@H]1C(=O)N1CC[C@H](CNC(=O)[C@H](F)Br)[C@@H]1c1cccnc1	1808676007	KDGVCLUOZCFNPO-VRKREXBASA-N	441.301	1.399	50	20	IDGD	
C[C@H](C(=O)N1CCCC2(CCN(C(=O)CCC(=O)NN(C)C)CC2)C1)n1cccc1C=O	1810003377	PJYQRLSAHRXRIW-GOSISDBHSA-N	445.564	1.466	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)[C@H]2C[C@@H]2F)[C@H]1c1cccnc1	1812476280	WAGNJVIXONUZGJ-DSCAVJCTSA-N	440.479	1.579	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H](CNC(=O)[C@H]2CCCS2(=O)=O)[C@H]1c1cccnc1	1812494327	SYZJWIZLEHFWFO-BRWVUGGUSA-N	441.981	1.930	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)C(C)(C)NCCC#N)[C@@H]1c1cccnc1	1813031848	SWDZJUFPXXYYCG-OKZBNKHCSA-N	435.956	1.623	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2ccc(F)nc2)[C@@H]1c1cccnc1	1813074273	SLELNUPTDIEKOX-IIBYNOLFSA-N	442.495	1.308	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)[C@@]2(C)CC2(F)F)[C@@H]1c1cccnc1	1813075192	ZYRRFMPBTUGSDW-QKYXUNIQSA-N	437.491	1.506	50	20	IDGD	
CC[C@H](O)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[nH]n1	1814770858	XSQSTMLZOAYSMA-CCODGHKUSA-N	429.481	1.307	50	20	IDGD	
Cc1noc(N)c1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](F)Br)CC2	1814910009	FPDRMPBIDXXKSX-WKEGUHRASA-N	432.275	1.938	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)C1=CCCS1	1815268669	GWEYUFJWTZBHHE-INIZCTEOSA-N	426.307	1.416	50	20	IDGD	
C[C@@](O)(CC(=O)O)CC(=O)N1CCCC[C@H]1c1cc(NC(=O)CCBr)n[nH]1	1816784226	ARGFOMMTEGIVIH-SJCJKPOMSA-N	445.314	1.803	50	20	IDGD	
C[C@H](NC(=O)c1ccccn1)C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](F)Cl)sc2C1	1817132887	AMWJWQIACSVJPF-PKFCDNJMSA-N	439.900	1.803	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2[nH]cc3c2CCC3)[nH]n1)c1cccc(B(O)O)c1	1817476740	PGGYMFMYXOBHQD-IBGZPJMESA-N	447.304	1.526	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnn4ccncc34)sc2C1	1818507730	WSOXUCWYBVVOIS-PWSUYJOCSA-N	434.909	1.665	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1cccc(F)n1	1819735030	OCAYTOZUFBQENI-QGZVFWFLSA-N	437.240	1.243	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H]3CCC(=O)N3C)sc2C1	1823053915	DMNJPWCAXLTTLF-YWVKMMECSA-N	429.340	1.459	50	20	IDGD	
COc1ccc([C@H](O)C(=O)N2CCC([C@@H]3CCCCN3C(=O)[C@@H](O)CCl)CC2)cc1	1824176445	OENAZFDFMYNUET-UFYCRDLUSA-N	438.952	1.948	50	20	IDGD	
O=C(Cn1cnc2ccccc21)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](O)CCl)CC2	1825846539	SYGDVOUWGMLPCW-XHDPSFHLSA-N	433.921	1.705	50	20	IDGD	
C=CCOCCCC(=O)N[C@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1	1826083700	PTEHUUPOLIBCIX-AWEZNQCLSA-N	437.566	1.411	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(O)ccc1F)CC2	1826088215	CDKGMWJWSZLUNK-LLVKDONJSA-N	449.508	1.587	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)nc2ccccc12	1830728568	UZDSRDLLKAWLGO-SIKLNZKXSA-N	447.919	1.213	50	20	IDGD	
COc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)c(Cl)c1	1830737986	JMNRCTRMTGIJOU-QFBILLFUSA-N	447.315	1.018	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](C)CBr)C3)C2)o1	1831785964	PHQXVILYDLUWRQ-UGSOOPFHSA-N	429.311	1.689	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CCN2CCN(C)CC2)CC1	1831830019	HDDDQXVMDXZQJH-PMACEKPBSA-N	443.032	1.497	50	20	IDGD	
CCn1nccc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1	1831872501	ZLFCWFVSETVQGE-SFHVURJKSA-N	432.569	1.509	50	20	IDGD	
Cc1noc(C)c1CC(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1832552135	XXOYMMBRQZWAQA-FQEVSTJZSA-N	427.929	1.555	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)C2CCSCC2)CC1	1832943402	NGEROPPQSASDSC-NRFANRHFSA-N	444.406	1.743	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)c3ccco3)CC2)CC1	1833088342	MHAOSIFLBQWXFJ-FQEVSTJZSA-N	437.613	1.736	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)Cc3ccc(F)cn3)CC2)CC1	1834838280	LWNJDXBKNDMCDH-LJQANCHMSA-N	440.947	1.589	50	20	IDGD	
COc1ccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)cc1	1835071107	AWCHAQYXAWRVRU-LJQANCHMSA-N	431.316	1.498	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cc4n(n3)CCCO4)CC2)CC1)[C@@H](F)Cl	1835080640	RQEGLEXTQQKEEG-QGZVFWFLSA-N	427.908	1.385	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)c1ccc2cnccc2n1	1835324639	PGWQPMNSCDWZQP-HXUWFJFHSA-N	445.951	1.415	50	20	IDGD	
C=CC(=O)N[C@@H](C)C(=O)NC1CCN(C2CCN(C(=O)[C@H](Cl)CCC)CC2)CC1	1835827821	YSFNHYYWMITEHL-MAUKXSAKSA-N	426.989	1.656	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3nccc4occc34)CCO2)C1	1836295363	JANLLKVWNYUHAX-YWZLYKJASA-N	437.880	1.152	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)[C@](C)(O)C(F)(F)F)CC2)CC1	1836395151	UYTNVSQTJBLLBA-PBHICJAKSA-N	427.895	1.889	50	20	IDGD	
C[C@H](Cn1ccnc1)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836720017	GURBXYZPDFPLRV-QAPCUYQASA-N	426.945	1.118	50	20	IDGD	
CCc1noc(C)c1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1	1838058760	WGCFUWOJTKBQJY-RBUKOAKNSA-N	448.347	1.852	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(C)nc3OC)CCO2)C1	1838176378	FMAHFMCNYBWVPX-JXFKEZNVSA-N	425.913	1.486	50	20	IDGD	
COc1ccsc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)Br)C2)C1	1838299193	GAIZLHGKVQHLRK-PXAZEXFGSA-N	447.351	1.610	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3nccc(OC)c3OC)CCO2)C1	1838841203	KGDXMIOXAGUFKO-XOBRGWDASA-N	441.912	1.186	50	20	IDGD	
CCc1[nH]nc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](Cl)CC)CCO3)c1Cl	1839143743	HATUASJTISOHOK-KZULUSFZSA-N	433.336	1.713	50	20	IDGD	
O=C(Cc1ccccc1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839199899	ZARVQMXXJNSNIE-FUHWJXTLSA-N	429.286	1.376	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C(C)(C)C)n[nH]3)C2)C1	1840153399	NEPBWZMWRHCJKV-VLIAUNLRSA-N	442.944	1.031	50	20	IDGD	
C[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1)n1cccc1	1840353647	PCVIFUJFBBXMQG-AYOQOUSVSA-N	432.348	1.742	50	20	IDGD	
O=C(c1cc(F)cc(Cl)c1)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1	1840708825	DEFLWRVZAARLNS-QAPCUYQASA-N	435.279	1.149	50	20	IDGD	
Cc1ccc(S(=O)(=O)CC(=O)N2CCCC23CN(C(=O)[C@H](F)Br)C3)cc1	1842759275	WMFNSXOMGYRVTB-HNNXBMFYSA-N	447.326	1.663	50	20	IDGD	
C[C@H](NC(=O)c1ccc(F)cc1)C(=O)N1CC2(CCCN2C(=O)[C@@H](F)Br)C1	1845219116	VTAYDJYGNVXXNS-SMDDNHRTSA-N	444.276	1.838	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC12CN(C(=O)c1nc(O)n3c1CCCC3)C2	1846070723	ASMQLGFZVIIVMT-LBPRGKRZSA-N	425.327	1.916	50	20	IDGD	
CC(C)n1nc(C(=O)N2CC3(CCCN3C(=O)[C@@H](C)Br)C2)cc1C(=O)O	1846175947	DIYZKJGQOCYIEI-LLVKDONJSA-N	427.299	1.763	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@H]1C=C[C@H](NC(=O)OC(C)(C)C)C1)C2	1846360774	FOCNQFZEPGDMKZ-OWCLPIDISA-N	441.956	1.913	50	20	IDGD	
O=C(c1cn2cccc(Br)c2n1)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl	1847562522	XPIHBNVEEVPVDQ-MELADBBJSA-N	441.713	1.512	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1ccnc(C(F)F)c1	1848301984	NYNUVKQUSKPCMT-OWOMDRDKSA-N	444.442	1.969	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)[C@@H]2CCCN(S(=O)(=O)c3ccc(F)cc3)C2)c1	14841834	PRWXNIBXVZTFNL-MRXNPFEDSA-N	449.504	1.761	50	20	IDGD	
Cc1ccc(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c(Cl)c1	25366355	SJODRWIOTVRALZ-UHFFFAOYSA-N	431.923	1.522	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCCN(Cc3ccccc3)CC2)cc1OC	105542677	GOLKUQGNWHURBE-UHFFFAOYSA-N	426.517	1.673	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc23)c2ccccc2c1=O	105866816	MHOIICWFQBDRCY-UHFFFAOYSA-N	435.400	1.837	50	20	IDGD	
CC(C)[C@H](NC(=O)NCc1ccccc1)C(=O)NNC(=O)CNC(=O)c1cccs1	725741855	UUGODMBRCJJKEW-KRWDZBQOSA-N	431.518	1.149	50	20	IDGD	
COc1ccc(C2(CNC(=O)NNC(=O)CNC(=O)c3ccco3)CCOCC2)cc1	725871109	GINYNTATRLOGES-UHFFFAOYSA-N	430.461	1.097	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)CC23C[C@H]4C[C@@H](CC(O)(C4)C2)C3)c1	725909508	PEYZZYKRROGOSS-VKFLQFAXSA-N	435.546	1.419	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)C(C)(C)S(=O)(=O)c1ccc(Br)cc1	726156032	FUCHLETXQSYAMP-UHFFFAOYSA-N	428.308	1.801	50	20	IDGD	
COc1ccc(OC)c(-n2nnnc2SCC(=O)NNC(=O)c2ccc(F)cc2)c1	726433054	YOBFQLRXBXYCGH-UHFFFAOYSA-N	432.437	1.372	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)Nc1cccc([N+](=O)[O-])c1	726875356	YXLZIFPVLXHNMR-UHFFFAOYSA-N	449.445	1.082	50	20	IDGD	
O=Cc1ccc(OCC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1	727364013	FNPFQEVFMBYHQL-UHFFFAOYSA-N	431.470	1.124	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)N[C@@H](CN2CCN(C)CC2)c2ccccc2)c1	727945536	LODOTRPWOYLPPD-NRFANRHFSA-N	441.532	1.637	50	20	IDGD	
CC(C)CC(=O)NNS(=O)(=O)c1ccc(S(=O)(=O)N2C[C@@H](C)C[C@H](C)C2)cc1	728261210	OVSCSFNJVUQDIW-GJZGRUSLSA-N	431.580	1.709	50	20	IDGD	
O=C(NCCc1cccs1)NNS(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2	728262559	FZLJHURLYFXPOG-UHFFFAOYSA-N	428.448	1.163	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)CCS(=O)(=O)c2ccc(Cl)cc2)cc1	728315758	PMQYAFQPWWOKJQ-UHFFFAOYSA-N	438.889	1.817	50	20	IDGD	
O=C(NCC(=O)N1CCN(c2ccccc2)CC1)NNC(=O)c1cccc(OC(F)F)c1	728748744	OEFRYDFFGDXZER-UHFFFAOYSA-N	447.442	1.581	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(OC(F)(F)F)cc1)C1CCN(c2ncccn2)CC1	728856617	YKEZRRSHAIXSND-UHFFFAOYSA-N	445.423	1.601	50	20	IDGD	
CC(C)(C)C(=O)N1CSC[C@H]1C(=O)NNC(=O)COc1ccc(Br)cc1	730073913	RGQXDHJBUAFJTP-ZDUSSCGKSA-N	444.351	1.923	50	20	IDGD	
CCCc1n[nH]c(C(=O)NNC(=O)c2ccc(CSc3nncn3C)cc2)c1[N+](=O)[O-]	731781901	UXKFZQDHBVGZHQ-UHFFFAOYSA-N	444.477	1.766	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)/C(=C/c1ccco1)NC(=O)c1ccccc1	732957610	SMCSDOPYNPWJDW-VBKFSLOCSA-N	438.465	1.689	50	20	IDGD	
COc1ccc2c(c1)OC[C@H](C(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1)C2	734826026	UDOKTVIHJINYNS-OAHLLOKOSA-N	448.520	1.976	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)[C@@H]2CCCCN2c2ncccn2)cc1C	736775049	JBTZFCBGTJHJSH-AWEZNQCLSA-N	431.518	1.772	50	20	IDGD	
CC(=NNC(=O)[C@H]1CCS(=O)(=O)C1)c1ccc(S(=O)(=O)CC(F)(F)F)cc1	741758269	BRSKBFNFZXRKCJ-LBPRGKRZSA-N	426.438	1.298	50	20	IDGD	
COc1ccc(-c2nc(SCC(=O)NNC(=O)c3cccc(C#N)c3)n[nH]2)c(OC)c1	741853235	REKBDHNXUYZWBQ-UHFFFAOYSA-N	438.469	1.914	50	20	IDGD	
Cc1cc(Br)ccc1C(=O)N1CCC[C@H](C(=O)NNC(=O)CN(C)C)C1	743333800	ZDHDVEMCALLQPG-ZDUSSCGKSA-N	425.327	1.319	50	20	IDGD	
COc1cccc(N2CC[C@@H](NC(=O)NNC(=O)Nc3ccc(S(C)(=O)=O)cc3)C2)c1	743587085	LNMQYOYSOFPNPH-OAHLLOKOSA-N	447.517	1.713	50	20	IDGD	
CCCC(=O)N1CCCC[C@@H]1C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	744620374	CHGHFIUJADDGNA-QGZVFWFLSA-N	438.550	1.332	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)NC[C@@H]2CCC[C@]23NC(=O)NC3=O)c(C)n1C[C@H]1CCCO1	744630781	VVGINJGSFILOBM-BBSOWBBBSA-N	439.516	1.685	50	20	IDGD	
C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)OCC(=O)NNC(=O)c1cccc(C#N)c1	744870704	ZCSPWXJEUJKUCG-NSHDSACASA-N	446.803	1.892	50	20	IDGD	
CS[C@@H]1CC[C@@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)C1	745896124	GRTXVEYZIDYZEA-HUUCEWRRSA-N	426.564	1.699	50	20	IDGD	
CN(C)C(=O)NNC(=O)/C(C#N)=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	746015110	XDRWEEJJIMAZEQ-LCYFTJDESA-N	429.868	1.288	50	20	IDGD	
CCc1ccccc1-n1cnnc1SCC(=O)NNC(=O)Cc1cn2ccccc2n1	746636826	HDMUWLDSHSVBGX-UHFFFAOYSA-N	435.513	1.960	50	20	IDGD	
COCC(=O)N[C@H](C(=O)NNc1ccc(S(=O)(=O)Nc2nccs2)cc1)C(C)C	747943392	VGCVDKBZCVBBCK-HNNXBMFYSA-N	441.535	1.174	50	20	IDGD	
COc1cc([C@H](C)NC(=O)NNC(=O)C(=O)N2CCCC2)ccc1OCc1ccncc1	748462584	VCZAZTVKDAKPRB-HNNXBMFYSA-N	441.488	1.683	50	20	IDGD	
O=C(Cc1ccc(-n2cnnn2)cc1)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1	748513004	YEPYHSMRMKFKAC-UHFFFAOYSA-N	426.380	1.642	50	20	IDGD	
O=C(COC(=O)[C@H]1CCCN1C(=O)c1ccc2c(c1)OCO2)NNC(=O)c1cccs1	750180651	QVRFEMCVEXMCRK-CYBMUJFWSA-N	445.453	1.086	50	20	IDGD	
O=C1C[C@@H](Cc2ccc(C(=O)NNc3nc(Br)cn4ccnc34)cc2)C(=O)N1	750243952	RBUJXHLLTVHGAV-GFCCVEGCSA-N	443.261	1.454	50	20	IDGD	
COC[C@@H](C)n1c(C)cc(/C=C(\C#N)C(=O)N2CCC(O)(CN3CCOCC3)CC2)c1C	752740560	OLUBVDPCUHCALV-VZMFNRANSA-N	444.576	1.905	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)CNC(=O)c2cccs2)cc(C(F)(F)F)c1	753851488	BCJCBPMIEICXMS-UHFFFAOYSA-N	428.392	1.591	50	20	IDGD	
COCCOc1cc(C)ccc1CNC(=O)NNC(=O)c1csc(N2CCOCC2)n1	755086064	KIOCWFKZCXAVHH-UHFFFAOYSA-N	449.533	1.458	50	20	IDGD	
COCCN(C)S(=O)(=O)[C@@H]1CCCN(C(=O)NNC(=O)C(C)(C)c2ccccc2)C1	755249801	NHZPPRMYOWZISB-QGZVFWFLSA-N	440.566	1.077	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1ccnc(O[C@H]2CCOC2)c1	755435208	QTZFMPITEJWLCN-INIZCTEOSA-N	448.501	1.027	50	20	IDGD	
CON(C)S(=O)(=O)c1ccc(NC(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)cc1	755533441	IMFVMNQDXBHDIT-UHFFFAOYSA-N	444.473	1.725	50	20	IDGD	
COc1ccc(S(=O)(=O)NC2CC2)cc1NC(=O)NNC(=O)COc1cccc(C)c1	755611357	KIDWSURMKCEGCS-UHFFFAOYSA-N	448.501	1.676	50	20	IDGD	
CSc1nnnn1-c1cccc(NC(=O)NNC(=O)c2cc(Br)c[nH]2)c1	755732875	FVRJSGBWCPJYRB-UHFFFAOYSA-N	437.283	1.941	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2cc(C(=O)OC)c(F)cc2F)c2ccccc2c1=O	755849681	OGTDNMGGJBOYJJ-UHFFFAOYSA-N	445.382	1.948	50	20	IDGD	
Cc1cc(C(=O)N2CCC(C)CC2)ccc1NC(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1	756089363	FFXVZWAUZHAIEB-MRXNPFEDSA-N	436.534	1.455	50	20	IDGD	
O=C(Cn1cc(NC(=O)NNC(=O)c2ccc(F)cc2Br)cn1)NC1CC1	756795226	JLKKSBNEZBNQID-UHFFFAOYSA-N	439.245	1.530	50	20	IDGD	
COc1cccc(-n2c(CC(=O)NNC(=O)C(C)(C)O)csc2=NCc2ccco2)c1	756797026	MHNXCSAPHBVBER-UHFFFAOYSA-N	444.513	1.702	50	20	IDGD	
Cc1nc(-c2cccc(C(F)(F)F)c2)[nH]c1C(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1	756951097	YCIOWKJBCNQUFN-GFCCVEGCSA-N	445.423	1.535	50	20	IDGD	
CCS(=O)(=O)NCC(=O)NNC(=O)c1cc(-c2ccc(C)cc2)nc2ccccc12	758060953	QEVSXRLERLAHMZ-UHFFFAOYSA-N	426.498	1.911	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)[C@H](c1ccc(Br)cc1)N1CCCC1	758200409	IVJUSAACYHXIHU-KRWDZBQOSA-N	449.305	1.756	50	20	IDGD	
CCCC[C@H](/N=C1/NS(=O)(=O)c2ccccc21)C(=O)NNc1ccc(C(=O)OC)cn1	759729148	CJEIJSSYHGXQCK-HNNXBMFYSA-N	445.501	1.609	50	20	IDGD	
O=C(Cn1c(C2CCCCC2)nc2ccccc21)NNC(=O)N[C@H]1CCS(=O)(=O)C1	761383208	ULOBRUMCRRKXCU-HNNXBMFYSA-N	433.534	1.602	50	20	IDGD	
CN(C)C(=O)c1cccc(S(=O)(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)c1	763439769	RLDZOYWMLDTRIE-UHFFFAOYSA-N	428.511	1.003	50	20	IDGD	
O=C(NNC(=O)c1ccc2ccccc2n1)C(=O)Nc1ncn(Cc2ccc(Cl)cc2)n1	763467670	VPVKSKLNNXDONO-UHFFFAOYSA-N	449.858	1.928	50	20	IDGD	
Cc1nc2ccc(C(=O)OCC(=O)NNC(=O)[C@@H]3COc4ccccc4O3)cc2s1	763524016	KQOCAWSRGCOMPD-INIZCTEOSA-N	427.438	1.749	50	20	IDGD	
CCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C(C)(C)C)cc2)cc1	763600768	TYUJLXMDGHLOEB-UHFFFAOYSA-N	440.500	1.899	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)NC2=S=NC(c3ccccc3)=C2)c2ccccc2n1	763619358	UNVCIQQBAVDEHI-UHFFFAOYSA-N	431.477	1.871	50	20	IDGD	
CO[C@H](C)C(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)COc2ccc(C)c(C)c2)c1	763666489	GGRPGKMAEAPMSF-OAHLLOKOSA-N	442.472	1.442	50	20	IDGD	
CN1CCCN(c2ccc(NC(=O)C(=O)NNC(=O)c3cc4c(s3)CCC4)cc2)CC1	763782972	JFXNJKOCDQQZIQ-UHFFFAOYSA-N	441.557	1.778	50	20	IDGD	
CCOC(=O)c1cc(CC)sc1NC(=O)C(=O)NNC(=O)COc1ccccc1C#N	763808365	MKGOHAPHGLPHMO-UHFFFAOYSA-N	444.469	1.524	50	20	IDGD	
Cc1ccc(OCc2nc(CC(=O)NNC(=O)CNC(=O)c3cccnc3)cs2)cc1	763818779	OUAZCYMEPDEXQA-UHFFFAOYSA-N	439.497	1.545	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccn(-c3ccccc3Cl)n2)cc1	763822342	YRGJHIUPPQCEMY-UHFFFAOYSA-N	427.848	1.999	50	20	IDGD	
C[C@@H](CC(=O)NNC(=O)CNC(=O)c1cccnc1)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	763824386	OMRYLRBKRPDCTE-DOTOQJQBSA-N	447.536	1.632	50	20	IDGD	
Cc1cc(C)cc(C(=O)N2CCC[C@@H](C(=O)NNC(=O)CNC(=O)c3cccnc3)C2)c1	763825077	VBUPWXCIZNLYKE-GOSISDBHSA-N	437.500	1.128	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)C(=O)Nc1cccnc1OCc1ccccc1	763837209	ABNGUBIQXUQRGA-UHFFFAOYSA-N	438.415	1.965	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)ccc1-n1cnnn1	763840061	HYAWZNBGLWTRMZ-HNNXBMFYSA-N	437.460	1.141	50	20	IDGD	
CNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2sc(-c3ccccc3)nc2C)c1	763899835	CQGGPTJQTPQRLA-UHFFFAOYSA-N	437.481	1.878	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ncn(C3CCCCC3)n2)cc1OC	763903757	SZWFMUJPDYVHHW-UHFFFAOYSA-N	430.465	1.590	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccc(NC(=O)[C@H]2CCCO2)cc1	763921611	UAEWULVRNMIFMX-QGZVFWFLSA-N	428.420	1.272	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)C(=O)Nc1ccc(CCCc2ccccc2)cc1	763999497	XGQDLYVBTCANFF-GOSISDBHSA-N	443.525	1.383	50	20	IDGD	
Cc1cc(OCc2ccccc2)ccc1NC(=O)C(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1	764002190	JVZOQSGUPUXYND-INIZCTEOSA-N	445.497	1.095	50	20	IDGD	
Cc1cc(S(N)(=O)=O)cc(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3c2)c1C	764067747	XMPFSHULEGSEFY-UHFFFAOYSA-N	440.481	1.504	50	20	IDGD	
O=C(CC(F)(F)F)NNC(=O)C(=O)Nc1cccc(CS(=O)(=O)c2ccccc2)c1	764115929	GCRCOQBRIFWBOH-UHFFFAOYSA-N	443.403	1.699	50	20	IDGD	
CCN1CCN(C(=O)Cc2ccc(NC(=O)C(=O)NNC(=O)CC3CCCC3)cc2)CC1	764180230	ZWMRJBGPADSMEC-UHFFFAOYSA-N	443.548	1.059	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)C(=O)Nc1cnn(-c2ccccc2F)c1	764204644	YZOVBANHUYCGND-UHFFFAOYSA-N	448.455	1.402	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)C(=O)Nc1ccc(=O)n(Cc2ccccc2)c1	764243357	VCUWUQUCFZYEQX-UHFFFAOYSA-N	443.463	1.637	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1cccc(OC[C@H]2CCCO2)c1	764277186	IYRGCBZNDDCEDR-MRXNPFEDSA-N	429.429	1.115	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)ccc1O)C(=O)Nc1cc(F)c(F)c(F)c1	764280958	UYLJSQTWFLDVPA-UHFFFAOYSA-N	432.152	1.972	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)C(=O)Nc1cccc(OCCNC(=O)OC(C)(C)C)c1	764297528	AQWDJWJBTYWHOF-UHFFFAOYSA-N	446.464	1.021	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc4c(c3)NC(=O)CO4)n[nH]2)cc1	764384928	NAIOLDCKFZQNNU-UHFFFAOYSA-N	448.439	1.370	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)N[C@@H]1CCO[C@H](c2ccccc2)C1	765192135	FIBJGKVTWQMJSB-WBVHZDCISA-N	431.518	1.844	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ccc(Cl)nn2)c(I)c1	765699482	SMZRGCVUQXQFCX-UHFFFAOYSA-N	447.620	1.825	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)c(OC)c1	765760070	ZDWUQBZSBGCBKX-UHFFFAOYSA-N	446.935	1.936	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1cccc(OCC(=O)Nc2ccccc2)c1	766261287	RTNAIVSIHGBKBZ-UHFFFAOYSA-N	436.428	1.585	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3ccc(-c4n[nH]c(C)n4)cc3)CC2)cc1	766647873	FSFGJOXXTXHURO-UHFFFAOYSA-N	447.543	1.667	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNc1ncnc2ccsc12	766674165	WVOLAWSQFHDYOJ-UHFFFAOYSA-N	447.542	1.788	50	20	IDGD	
COC(=O)C1(C(=O)NNC(=O)c2cccc(S(=O)(=O)Nc3ccc(C)cc3C)c2)CC1	766954786	OVHQTTWANKVZME-UHFFFAOYSA-N	445.497	1.818	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)c2cc(C)ccc2S(N)(=O)=O)cc1C	767709164	WHCJZNQZTUAWAG-UHFFFAOYSA-N	439.515	1.193	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)c2cccc([C@@]3(C)NC(=O)NC3=O)c2)cc1OC	768930480	SPVMBQFQFSPPBX-OAQYLSRUSA-N	426.429	1.223	50	20	IDGD	
CSc1cccc(N2C[C@@H](C(=O)NNC(=O)c3ccc4c(c3)OCCO4)CC2=O)c1	770390207	DBHJEGOOFXNSCS-AWEZNQCLSA-N	427.482	1.994	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)NNC(=O)c1ccc2c(c1)OCCO2	770658667	PBVDXDJKJDCRSA-NSHDSACASA-N	434.836	1.554	50	20	IDGD	
COc1cc(C)nc(NNC(=O)[C@H](C)NS(=O)(=O)c2cccc(C(F)(F)F)c2)n1	771003348	IHHPJSFRECZTIF-JTQLQIEISA-N	433.412	1.623	50	20	IDGD	
O=C(O)COc1ccc(C=NNC(=O)C(=O)NCc2ccc(Cl)cc2)cc1[N+](=O)[O-]	771572417	DCSPXHVTAFTKDU-UHFFFAOYSA-N	434.792	1.478	50	20	IDGD	
CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	771605931	FPBZGBARZNEXDS-UHFFFAOYSA-N	440.865	1.437	50	20	IDGD	
CC(=O)NCc1ccc(S(=O)(=O)NCC(=O)NNc2c(F)cccc2Cl)s1	771673508	CUJWQPYOUTWMER-UHFFFAOYSA-N	434.902	1.598	50	20	IDGD	
COCCS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ncc(Cl)cc2Cl)cc1	773676645	FLTWEKRVPOQFOM-UHFFFAOYSA-N	447.300	1.890	50	20	IDGD	
CC(C)CCNS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2cccc(C#N)c2)cc1	773686392	WCCANICZJGYIHU-UHFFFAOYSA-N	429.502	1.964	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2ccc3c(c2)CCN3C(=O)OC(C)(C)C)n1	773730656	JLNJAIAJLGBXMF-UHFFFAOYSA-N	428.449	1.865	50	20	IDGD	
COCCOc1ccccc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1cccc(Cl)c1	774011484	ZTQZRVXHWPJDLY-ZDUSSCGKSA-N	435.864	1.919	50	20	IDGD	
C[C@H](NS(=O)(=O)c1ccc(NC(=O)NNC(=O)CN(C)C)cc1)[C@@H]1C[C@H]2CC[C@H]1C2	775460099	PCQHJEOGGCXDDC-XSWJXKHESA-N	437.566	1.504	50	20	IDGD	
O=C(NNc1ccc(F)cc1Br)N[C@H]1CCO[C@@]2(CCS(=O)(=O)C2)C1	776077451	SOURRTOUYOILPJ-NHYWBVRUSA-N	436.303	1.951	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NNc2cccc(S(C)(=O)=O)c2)n(C)c1	776527779	ZVOXDUWOKMJUSV-UHFFFAOYSA-N	428.536	1.216	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(SCC(=O)NNC(=O)C(=O)Nc2ccccn2)CC1	777809499	QOKKLBQGRAQMDG-UHFFFAOYSA-N	437.522	1.300	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNS(=O)(=O)c2cn3c(n2)CCCC3)CC1	779837884	XINNIBJHCYAZAP-UHFFFAOYSA-N	442.542	1.111	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)c2cn(C)nc2-c2cnn(C)c2)c2ccccc2c1=O	780171814	QDEDMVHXFIPRSG-UHFFFAOYSA-N	434.460	1.186	50	20	IDGD	
CCOc1cc(/C=C\C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)ccc1O	780848643	QVIDNXHJTWRQFG-LUAWRHEFSA-N	433.486	1.516	50	20	IDGD	
COc1ccc(NNC(=O)CCc2c(C)nn(-c3ccc(S(N)(=O)=O)cc3)c2C)nc1	781536185	TUFJTRSZCIDSAD-UHFFFAOYSA-N	444.517	1.616	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-]	782061799	NNCVHMMNIUHJPH-AWEZNQCLSA-N	433.442	1.370	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(O)cc2)cc1OCc1ccncc1	782833418	HZGNZVGJEZISKW-UHFFFAOYSA-N	436.424	1.775	50	20	IDGD	
O=C(Cc1csc(COc2ccc(Cl)cc2)n1)NNC(=O)[C@H]1CCS(=O)(=O)C1	783645510	KSVZYUSYSGPUHX-NSHDSACASA-N	443.934	1.500	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)N[C@@H]1CCC[C@H]2CN(Cc3ccccc3)C[C@@H]21	784264058	VKSOTRKUJTYVFS-GBESFXJTSA-N	439.516	1.641	50	20	IDGD	
CNC(=O)COc1ccc(NC(=O)C(=O)NNc2ccc(OCC(F)(F)F)cc2)cc1	784370583	WYBMAULDGWQDKM-UHFFFAOYSA-N	440.378	1.834	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)C(=O)Nc1ccnc(Oc2ccccc2)c1	785068139	URXQJYANRIEROW-UHFFFAOYSA-N	430.424	1.850	50	20	IDGD	
Cc1cc(C(=O)NC(C)C)ccc1NC(=O)C(=O)NNC(=O)Cc1cn2ccccc2n1	785068572	XBNQWWBAQMGDTO-UHFFFAOYSA-N	436.472	1.110	50	20	IDGD	
CCCNC(=O)[C@@H]1CN(C(=O)C(=O)NNc2cc(F)c(F)c(F)c2)c2ccccc2O1	785083242	JDIJJAQUGRDFJT-INIZCTEOSA-N	436.390	1.867	50	20	IDGD	
NC(=O)c1ccc(NC(=O)C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)cc1F	785100195	SSDBLCRHKHQDIT-UHFFFAOYSA-N	435.362	1.177	50	20	IDGD	
O=C(NNc1ccc(Cl)c(F)c1)C(=O)Nc1ncn(CC(=O)N2CCCCCC2)n1	785180237	OQEZHKZMMQDZHA-UHFFFAOYSA-N	437.863	1.555	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2ccc(C(=O)N(C)C)cc2OC)n1	785226558	IWGYVCBVOILJNS-UHFFFAOYSA-N	429.481	1.115	50	20	IDGD	
COc1cc(F)cc(NNC(=O)C(=O)Nc2ccc(OCCN3CCN(C)CC3)cc2)c1	785237262	NKBMAHVJXCDQDR-UHFFFAOYSA-N	445.495	1.542	50	20	IDGD	
O=C(COC(=O)c1cc(F)c(Cl)cc1F)NNC(=O)[C@@H]1COc2ccccc2O1	785611181	MXRZUYLCXKUZQS-HNNXBMFYSA-N	426.759	1.762	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)CCCOc2ccc3c(c2)NC(=O)CC3)c2ccccc2c1=O	786650683	HNMJYUVMAAJXBS-UHFFFAOYSA-N	449.467	1.438	50	20	IDGD	
CC[C@@H](N=c1nn[nH]n1-c1ccccc1)C(=O)NNC(=O)NCc1ccc(Cl)cc1	787424701	MIDZPYKCXWBCMH-MRXNPFEDSA-N	428.884	1.459	50	20	IDGD	
Cc1ccc(F)cc1S(=O)(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	788917704	SPBDEILZBHOZLG-UHFFFAOYSA-N	430.502	1.932	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)Nc1nc2c(s1)CCCCCC2	789732649	RWZXZJIQGLCXAG-HNNXBMFYSA-N	430.486	1.728	50	20	IDGD	
N#C/C(=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)N1CCC[C@H](O)C1	790102934	NLTZTLRJVGCJLE-KAPURRDVSA-N	427.892	1.969	50	20	IDGD	
COc1ccc([C@@H](CNC(=O)NNC(=O)c2cccc(C)n2)N2CCOCC2)cc1OC	792788872	GJGLXVSKPJRKFI-GOSISDBHSA-N	443.504	1.425	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)[C@@](C)(O)CN3C(=O)NC4(CCCC4)C3=O)cc2C1	792828778	XOVVFONBBJJXFV-ODXCJYRJSA-N	448.545	1.250	50	20	IDGD	
CN(C)N(C(=O)C1=NOC2(CCN(C(=O)OC(C)(C)C)CC2)C1)[C@H]1CCS(=O)(=O)C1	792850721	QGIJPVDTSIFMCG-AWEZNQCLSA-N	444.554	1.025	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)N1C[C@@H]2CN(Cc3ccccc3)C[C@@H]2C1	792881884	KKXQMEWDUGHXJF-CALCHBBNSA-N	427.530	1.283	50	20	IDGD	
CC(Cn1cc(C(F)(F)F)ccc1=O)=NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	794472383	MHCIIWVRRBPKFZ-UHFFFAOYSA-N	444.435	1.923	50	20	IDGD	
CC(C)(C)c1cnc(NC(=O)C(=O)NNC(=O)CNC(=O)OCc2ccccc2)s1	797368684	FVHTWQAWMUMOCL-UHFFFAOYSA-N	433.490	1.453	50	20	IDGD	
O=C(CSCc1nc(O)c2c3c(sc2n1)CCC3)NNC(=O)N=c1cc[nH]cc1	802026317	VCFUTULEWZCUQA-UHFFFAOYSA-N	430.515	1.789	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)Cc2ccc(-n3cnnn3)cc2)c(OC)cc1Cl	802084954	QVJTZPPONJPLLH-UHFFFAOYSA-N	431.840	1.728	50	20	IDGD	
COCc1nc(Cl)cc(NNC(=O)Nc2c(C)nn([C@@H]3CCS(=O)(=O)C3)c2C)n1	806385087	WIHBNROEKQAICE-LLVKDONJSA-N	443.917	1.598	50	20	IDGD	
COc1ccc(CS(C)(=O)=O)cc1NC(=O)C(=O)NNc1cc(F)c(F)c(F)c1	807021156	XKTVXDGAPQITSI-UHFFFAOYSA-N	431.392	1.739	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)c1ccc2c(=O)n(-c3ccccc3)c(O)nc2c1	807369134	QRNZSNXIJPQRBL-UHFFFAOYSA-N	440.456	1.642	50	20	IDGD	
Cc1ccc(S(=O)(=O)Nc2ccccc2F)cc1C(=O)NNC(=O)N1CCN(C)CC1	807382589	GVFCMCLPDXHNML-UHFFFAOYSA-N	449.508	1.537	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNc2ccc(-n3ccnc3)nn2)cc1Br	807428962	MQBDFZWSULTAAT-UHFFFAOYSA-N	446.265	1.905	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)NC[C@H](N2CCOCC2)C(F)(F)F)c1C	807540558	YCBBRBZKRGTUIX-ZBFHGGJFSA-N	432.443	1.664	50	20	IDGD	
O=C(NCCCn1cc(Br)cn1)NNC(=O)c1cc([N+](=O)[O-])ccc1O	807612212	PKQJWUTYKRIWPV-UHFFFAOYSA-N	427.215	1.294	50	20	IDGD	
CCc1ccccc1NC(=O)CNC(=O)COC(=O)/C(C#N)=C\c1cc(C#N)n(C)c1C	809302921	DTILZIMULNLLLV-NVMNQCDNSA-N	433.468	1.973	50	20	IDGD	
Cc1nsc(N2CCN(C(=O)NNC(=O)c3cnn(-c4ccccc4)c3)CC2)c1C#N	811879254	BKFQEGARVJITTK-UHFFFAOYSA-N	436.501	1.686	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCc2csc(COC)n2)nc1	812552032	RJECPDNYRUZCLC-UHFFFAOYSA-N	428.540	1.541	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)[C@H](c2cccc(F)c2)N2CCOCC2)cc1	812733352	PCYDPOQUCFQRPX-IBGZPJMESA-N	436.509	1.593	50	20	IDGD	
C[C@@H](C(=O)NC1CC1)N1CCN(C(=O)NNC(=O)c2cc3c(s2)CC[C@@H](C)C3)CC1	813496836	SUUIAEDKLYWPEO-KGLIPLIRSA-N	433.578	1.512	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@H]1CCCN(c2ccccc2)C1=O	814365890	YCVXMJJDULRMLM-MRXNPFEDSA-N	443.529	1.492	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCc2nncn2C1)C(=O)Nc1cc(C2CCC2)nn1-c1ccccc1	815691075	DXLLACMKGLCHKG-HNNXBMFYSA-N	448.487	1.080	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)C[C@@H](c2ccccc2)c2ncc[nH]2)c1	816810719	XMPYQJOJGITYMV-SFHVURJKSA-N	441.513	1.643	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)Cn3cccn3)c2)c(C)c1	842471391	UQXAPPOAUWECBB-UHFFFAOYSA-N	427.486	1.762	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(N2CCOCC2)c(C(=O)NNc2ccc(F)cc2F)c1	876984411	HTCLYEVJXMJWQQ-UHFFFAOYSA-N	440.472	1.809	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=S)NC[C@H]2CCCN2CC)c2ccccc2c1=O	884169145	XBRKMMOFKCRMHX-OAHLLOKOSA-N	430.578	1.790	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)CN2C(=O)N[C@]3(C[C@H](C)CC(C)(C)C3)C2=O)cc1	901393857	OWRRXDKIOONUJG-QRQCRPRQSA-N	430.505	1.658	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Cc2ccc(-n3cccn3)cc2)c1	915635934	ZMEZDXJTYNIWQD-UHFFFAOYSA-N	427.486	1.126	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)N[C@@H](C)c2cccc(S(N)(=O)=O)c2)c2ccccc2n1	916196654	CCDITFADELMRFN-ZDUSSCGKSA-N	427.486	1.896	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)NCc2ccnc(N3CCN(C)CC3)c2)c2ccccc2n1	916389794	DZMXVOKENFYKKP-UHFFFAOYSA-N	433.516	1.834	50	20	IDGD	
O=C(NC[C@@H](c1ccccc1)N1CCOCC1)NNC(=O)[C@@H]1COc2ccccc2O1	916510044	ZUPMJPTUXZIIEJ-PXNSSMCTSA-N	426.473	1.230	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)N1CCc2ccccc2C1	916603857	LDJXMBULQHAUSJ-OAHLLOKOSA-N	430.530	1.481	50	20	IDGD	
Cc1ccc(C)n1-c1ccc(C(=O)NNC(=O)NCc2cccc(S(N)(=O)=O)c2)cc1	916623923	DYRAQFVLDROPDK-UHFFFAOYSA-N	441.513	1.886	50	20	IDGD	
C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)NNC(=O)c2csc(N3CCOCC3)n2)C1	919786007	OKYXGMMIVYFVAT-NVXWUHKLSA-N	444.561	1.759	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNS(=O)(=O)c2cc(C(=O)OC)ccc2F)cc1	920309951	GJZSSBRFLZSWCM-GFCCVEGCSA-N	440.449	1.788	50	20	IDGD	
O=C(CCNS(=O)(=O)c1cccc([N+](=O)[O-])c1)NNC(=O)c1ccc2ccccc2n1	920340892	XKBBQYFNKYDNQW-UHFFFAOYSA-N	443.441	1.273	50	20	IDGD	
CCCCNC(=O)NNC(=O)[C@@H](CCS(C)(=O)=O)NC(=O)c1ccc(Cl)cc1	920822890	DCCIYJIFLKTKFY-CQSZACIVSA-N	432.930	1.004	50	20	IDGD	
C=C1c2ccccc2C(=O)N1CC(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1	1318559104	XBWPVSIJJCQKOQ-UHFFFAOYSA-N	428.489	1.908	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H](C)n2ccnc2)c1	1324415138	ZYVZPBQCWXBTGM-CQSZACIVSA-N	443.485	1.715	50	20	IDGD	
C[S@@](=O)Cc1ccc(CNC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)cc1	1326880675	CZBQQOFINLQXNK-MUUNZHRXSA-N	438.531	1.505	50	20	IDGD	
COC(=O)c1cc(C(=O)NNC(=O)CSc2ccccc2O)n(-c2ccccc2)n1	1336533658	JWEQAXNFMAURHW-UHFFFAOYSA-N	426.454	1.918	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)c1ccc(NC(=O)c2ccc(O)nc2)cc1	1337502463	GLXAPWKNUZRNGD-UHFFFAOYSA-N	434.408	1.886	50	20	IDGD	
CNS(=O)(=O)c1ccc(Br)c(C(=O)NNC(=O)CCc2ccccc2)c1	1338140115	AAIKKSPMJQEIOD-UHFFFAOYSA-N	440.319	1.751	50	20	IDGD	
Cc1c(C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)ccc2cncn12	1342119247	OYHBYOBPRYLGEV-UHFFFAOYSA-N	440.935	1.875	50	20	IDGD	
Cc1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](F)Br)C3)cc(O)n1	1778037183	FRVIVDIZAZCMAQ-DDUZABMNSA-N	444.301	1.914	50	20	IDGD	
C[C@@H](C(=O)N1CC[C@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1)N1CSCSC1	1779148302	XSWFJIYJPKWXTN-YJBOKZPZSA-N	447.699	1.711	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3nc(O)n4c3CCCC4)C2)C1	1779349168	STSVCZYFHANKRW-XIKOKIGWSA-N	441.326	1.152	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(OC)ccn3)C2)C1	1779539625	BHNVDZDOPHRUHF-KSSFIOAISA-N	426.311	1.707	50	20	IDGD	
N#Cc1cccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](O)CCl)C3)c1Cl	1780097182	OGPFUZGPCHUBFL-RZQQEMMASA-N	440.327	1.939	50	20	IDGD	
C[C@@H]1Oc2ccc(C(=O)N3CC[C@@]4(C3)CN(C(=O)[C@H](F)Cl)CCO4)cc2NC1=O	1780177959	XCVMMGANGIFWSF-SGJUXQJHSA-N	425.844	1.384	50	20	IDGD	
CN1CCCC[C@H]1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Br)C1	1780770420	NCRYGZDCGHCRES-JTOWHCCKSA-N	434.350	1.675	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1ccncc1)C2)[C@H](F)Br	1780774034	UDBAIXPNTVIZCZ-UWWQBHOKSA-N	428.302	1.829	50	20	IDGD	
Nc1ccccc1/C=C/C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781331035	JMOBSDNGIVWEPL-MMUANNJHSA-N	426.286	1.802	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(OC)c(OC)c3O)C2)C1	1781826965	OCHLBCYAFUCEAX-XOBRGWDASA-N	426.897	1.870	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cncc(O)c2)C1	1782038874	JNXRZYJEPMEDKB-VVFCZOMOSA-N	440.338	1.946	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc3c(c1)CNC3=O)C2	1782175530	MQESZKLKZMTZKW-NJNPRVFISA-N	449.935	1.311	50	20	IDGD	
Cc1cccc(Cl)c1C(=O)N1CCO[C@@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1	1783935011	OQPORBLFZUUYIE-OAQYLSRUSA-N	436.940	1.465	50	20	IDGD	
O=C(C(Cl)Cl)N1CC[C@]2(C1)CN(C(=O)[C@@H]1CCc3ccccc3[C@H]1O)CCO2	1783943324	VTYJBAGMMVVHOP-QINHECLXSA-N	427.328	1.916	50	20	IDGD	
Cc1[nH]nc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]3C2)c1F	1783970292	UXUDTKZHPFZWFY-BQUFFADESA-N	431.306	1.482	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3scnc3C(F)(F)F)C[C@@H]21)[C@H](O)CCl	1784086148	GRMBBPVRZHBWEF-MMWGEVLESA-N	441.859	1.355	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CNC(=O)OC(C)(C)C)C[C@@H]21	1784622733	SEIXBAVSLMQESM-VGWMRTNUSA-N	431.961	1.898	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)cc1	1785106871	PIMAAJBJIQPVRH-CRAIPNDOSA-N	442.285	1.779	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(S(C)(=O)=O)c(F)c3)C2)C1	1785227337	JOGVLDFJVSXJTO-LIRRHRJNSA-N	446.928	1.690	50	20	IDGD	
Cc1nc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)Br)C[C@@H]32)cs1	1785295184	CWLLMKJWUDYRHU-WCUVEOEZSA-N	430.368	1.757	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](F)Cl)CCO3)CC1	1785716637	RWUCREPKBAVGER-YWZLYKJASA-N	447.935	1.998	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3ON=C(c4ccccc4)O3)C[C@@H]21)[C@H](F)Cl	1787446489	MRKIANKMXWAPPZ-OXMIBSBGSA-N	425.844	1.235	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(F)cn3C)[C@H]2C1	1787748350	XOGSKTPRFKQZFZ-PCBIJLKTSA-N	430.318	1.931	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3=NO[C@H](c4ccccc4)C3)[C@H]2C1	1788143299	UVVVECIOTPBSOQ-TXTPUJOMSA-N	449.935	1.738	50	20	IDGD	
CC(C)n1nccc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)Br)C[C@@H]21	1788934007	ZETNEUVNIKYLIS-HOSILWTGSA-N	427.343	1.841	50	20	IDGD	
CC(C)c1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)Br)C[C@@H]32)n[nH]1	1789325775	VVTLWEKSTFRMTA-DVZHBHJUSA-N	427.343	1.910	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(Cl)c4nncn4c3)C[C@@H]21	1789863459	SBOBCULXGHHPLW-PCBIJLKTSA-N	440.331	1.993	50	20	IDGD	
CC(C)c1nc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]3C2)no1	1789922799	TZPDKPXOICMYTQ-JUFZMCDQSA-N	447.305	1.406	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3c[nH]c4nccc-4c3)C[C@@H]21)[C@H](F)Br	1789923229	ZJIZDMTZOYKIPS-MXAVVETBSA-N	439.285	1.798	50	20	IDGD	
C[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]2C1)c1ccccn1	1789926816	GGIOCSQAOQAJLI-VRUQUDLLSA-N	428.302	1.855	50	20	IDGD	
Cc1n[nH]c(C)c1CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21	1789976869	OIPIYRIIDMNGIU-PCBIJLKTSA-N	431.306	1.239	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccnc1Cl	1792403344	DRVHHXOFNCFQRN-CLLJXQQHSA-N	428.880	1.299	50	20	IDGD	
COC(=O)[C@H]1CC[C@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C(C)(C)CCl)CC1	1792782252	LHCSDALDWSBMMY-RDSHKEJNSA-N	428.957	1.820	50	20	IDGD	
COCc1oncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)CBr	1792868391	XDROAQWVVUWMRW-OHTBPHCPSA-N	430.299	1.055	50	20	IDGD	
C[C@@H](CBr)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(=O)nc3cccnn13)C2	1792990302	IAWCCSCLCIDQCE-FQUUOJAGSA-N	448.321	1.372	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1CCc2sccc2C1	1794163822	VCCFJJRPZFOGTL-YYIAUSFCSA-N	425.982	1.998	50	20	IDGD	
CC(C)c1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cccc(B(O)O)c2)cc1	1795739734	HHCQZQHIVCYJMY-VTYHHJSWSA-N	436.317	1.007	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)n1cccc1C=O	1795752599	SJGMSYCPWZGJCH-CTTHAOKLSA-N	440.338	1.625	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1c(C(C)C)nn2ccccc12	1796086205	ZQKYDLQHMHSCTI-QOIOWGMHSA-N	448.951	1.915	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@](C)(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Cl)C1	1796365423	SAMLBXUGWJEXPQ-MTCCJSQRSA-N	447.935	1.758	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnc2ccccc2n1	1796776105	GIPDESMNSGUNAG-ZUMXRPEOSA-N	447.333	1.864	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](O)c1ccccc1)C2	1796892220	OLTQXCKKOCEQKE-BPBAZMLESA-N	437.500	1.492	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2ncncc2c1	1797465659	HEABHJDJVVRIDD-PTOXDTDZSA-N	447.333	1.864	50	20	IDGD	
Cc1c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)ccc(F)c1F	1798443594	LTDCUUSQQUDOLH-BTTYYORXSA-N	443.454	1.837	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccnc2c1OCO2	1798473756	RLASVVCBBNUNOM-ZMJPVWNMSA-N	440.294	1.187	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2)c1ccc(OCCCO)cc1	1798545474	SODUCIQMDVMFHP-MIFYACCESA-N	431.316	1.455	50	20	IDGD	
C[C@@H]1Oc2ccc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)C(C)(C)CCl)C4)cc2NC1=O	1798581621	PKZZTBHBGNJWQK-FRQROOTJSA-N	449.935	1.874	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ncc(OC)cc1F)C2	1800638843	ATXDHKBIVVWFAW-WJNVRWDZSA-N	444.301	1.606	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(OC)cc1O)C2	1800642664	VMKQCTYCVHYCMT-DJZPMSPPSA-N	441.322	1.778	50	20	IDGD	
CCSc1ncccc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](Cl)COC	1800974505	WCJCKYMDLGJBQF-OCVGTWLNSA-N	427.954	1.651	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cc(F)ccc1OC)C2	1800982194	ZHMQKKCNZATATN-MVWRLGRASA-N	428.888	1.220	50	20	IDGD	
Cc1c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCC(=O)NN(C)C)oc2ccccc12	1801011688	ZBGBCIXHSJXXCM-VPTLXERWSA-N	442.516	1.317	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cn1c(=O)n(C)c3ccccc31)C2	1802273259	NAWGYIMTJOPRIZ-QKPAOTATSA-N	434.924	1.232	50	20	IDGD	
COC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](Cl)COC	1802277146	PXOPADMIMQSLGR-JKJDWNRSSA-N	447.960	1.418	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)C(C)(C)CNC(C)=O)[C@@H]1c1cccnc1	1803720282	MMGPEZPHCBCEBC-SQNIBIBYSA-N	438.956	1.504	50	20	IDGD	
CCS(=O)(=O)N[C@H](C)C(=O)N1CCC2(CCCN(C(=O)C(C)(C)CCl)C2)CC1	1805257399	AUEHSSGQDSBEKG-OAHLLOKOSA-N	436.018	1.810	50	20	IDGD	
Cc1cccc(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)c1	1807366582	NGDUIYOFJYDXFN-GGAORHGYSA-N	443.312	1.703	50	20	IDGD	
CC(C)=CCCC(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1807367143	QOVMZVOXDXIPJW-NFBKMPQASA-N	435.333	1.827	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)CCN2CCOC2=O)[C@@H]1c1cccnc1	1809531010	BBVNQLQWERRCTR-RYRKJORJSA-N	438.912	1.184	50	20	IDGD	
Cc1nc(F)ccc1C(=O)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1	1809971000	GXZJLAZOQRPOLS-UHFFFAOYSA-N	439.296	1.368	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)c3cccnc3S)CC2)C1	1809977435	GLRJLZGDLUUUEP-UHFFFAOYSA-N	439.346	1.209	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1CCN(C(=O)[C@H]2CCC(=O)NC2)[C@@H]1c1cccnc1	1810538080	SALNVXXPNKHTEF-ABSDTBQOSA-N	432.597	1.465	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@H]1CCN(C(=O)CCN2CCOCC2)[C@H]1c1cccnc1	1810539614	DOAXSCCCIQGPFD-KNQAVFIVSA-N	448.640	1.661	50	20	IDGD	
NC(=O)c1ccccc1C(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1	1811268572	BJMHGISGCPGKDY-JCGIZDLHSA-N	430.892	1.100	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)c2ccc(O)nn2)[C@@H]1c1cccnc1	1812865622	XKVBTQOXAAZOJE-NORZTCDRSA-N	434.294	1.680	50	20	IDGD	
CC1=C(C(=O)N2CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)CCO1	1813069867	AKQPSPMFBKJFKB-DYESRHJHSA-N	429.521	1.155	50	20	IDGD	
C[C@]1(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)CC1(F)F	1814073367	BWWHZRKHGSNZTH-PLMTUMEDSA-N	443.259	1.126	50	20	IDGD	
CCc1oncc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1816605098	LWXOGFXYLRFBQH-QGZVFWFLSA-N	437.265	1.260	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)[C@@H](O)c1ccccc1	1817075643	LRTDFUAJWXTGRK-FPOVZHCZSA-N	448.288	1.129	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1	1817470420	QRQDQXQQHWDCNQ-MRXNPFEDSA-N	432.717	1.660	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1)[C@@H]1Cc2ccccc2CN1	1817997648	VCJXRMOOJWPYLG-RCCFBDPRSA-N	431.924	1.716	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1	1818110675	NMBAHKREFIUBIC-TYOURTJLSA-N	449.899	1.136	50	20	IDGD	
CCOC(=O)C1(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)[C@H](Cl)COC)[nH]n2)CC1	1821805242	GRSDQSXRLXZMFI-OCCSQVGLSA-N	426.901	1.999	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2[C@H]3C=CS[C@@H]32)[nH]n1	1822416365	BQTFFCONSKBMGX-WQOWLQHVSA-N	432.550	1.650	50	20	IDGD	
C[C@@H](C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)C(Cl)Cl)CC2)N1CCN(C)CC1	1822697114	IXZPZZUWSHBZNA-QWRGUYRKSA-N	434.393	1.495	50	20	IDGD	
C/C=C/C=C\C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnccc1C(=O)NN)CC2	1825107980	YSODIHDSFOPWJH-GSTVFTAWSA-N	426.502	1.500	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccns2)CC1	1825677063	WOVHULPPRCJHMM-KRWDZBQOSA-N	442.545	1.689	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CCN2CCOC2=O)CC1	1828386282	OTXNWHAZDUTWFC-SJORKVTESA-N	429.945	1.702	50	20	IDGD	
CCOC(=O)N[C@@H](O)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)C(C)(C)CCl)CC1	1828760383	OFWJILZAPOTHHQ-CVEARBPZSA-N	431.961	1.936	50	20	IDGD	
N#CCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Cl)CCN2C(=O)OCc1ccccc1	1829052617	PNBXPNGUVNIVMX-FXAWDEMLSA-N	436.871	1.887	50	20	IDGD	
NC(=O)c1nccnc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)C(Cl)Cl)CC1	1829511754	TYDWSDKHWHCEEV-LBPRGKRZSA-N	428.320	1.613	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccs3)C2)C1	1830537856	QRIPQLNFLXDKPD-DYVFJYSZSA-N	431.352	1.849	50	20	IDGD	
O=C(/C=C/c1ccc([N+](=O)[O-])o1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1830908656	RLEVVBSVKGCJFB-LRYYQWQPSA-N	431.804	1.192	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)C2=NN(C)C(=O)CC2)CC1	1831828656	STIUTKAPRGUJDB-RDJZCZTQSA-N	426.945	1.468	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)/C=C/c2cnccn2)CC1	1831876599	LLQUHMWKVKSZFT-IEJURRBGSA-N	442.564	1.483	50	20	IDGD	
N#CCc1ccc(C(=O)N2CCC(N3CCC(NC(=O)[C@@H](O)CCl)CC3)CC2)cc1	1833313765	QDDWWWLPGBCIKD-FQEVSTJZSA-N	432.952	1.538	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)Cc1ccc(F)cc1)CCO2	1835050132	ISVYPUKVEVUYBE-NRFANRHFSA-N	438.572	1.676	50	20	IDGD	
COc1ccc([C@H](O)C(=O)N2CCC(N3CCC(NC(=O)[C@@H](F)Cl)CC3)CC2)cc1	1835078163	TYAGTNDFUZLGAL-RBUKOAKNSA-N	441.931	1.835	50	20	IDGD	
C[C@H](C(=O)NC1CCN(C2CCN(C(=O)[C@@H](F)Cl)CC2)CC1)n1ccccc1=O	1835826539	VIXAPUHRXYESEP-RDTXWAMCSA-N	426.920	1.515	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cn3cc(Cl)cn3)CCO2)C1	1835969420	IAFXIBPAZYCHSB-QAPCUYQASA-N	433.336	1.400	50	20	IDGD	
O=C(C#CC1(O)CCCCC1)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836717187	MJEXGHKPQWODLX-LJQANCHMSA-N	440.968	1.283	50	20	IDGD	
CCN(CC)C[C@H](C)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836718720	ATTREBXMPHTOCX-LPHOPBHVSA-N	432.005	1.563	50	20	IDGD	
O=C(Cn1nnc2ccccc21)N1CCC(OC2CCN(C(=O)[C@@H](F)Cl)CC2)CC1	1837025038	HFCMQZAYKBDKOS-LJQANCHMSA-N	437.903	1.964	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC(OC2CCN(C(=O)c3cccs3)CC2)CC1	1837396994	CVMIMVFFWISFAH-UHFFFAOYSA-N	442.346	1.354	50	20	IDGD	
C[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1)N1CSCSC1	1837573007	SRZSTHSYNGGZIX-IOASZLSFSA-N	441.978	1.020	50	20	IDGD	
Cc1cc(NC(=O)CC(=O)N2CCC(OC3CCN(C(=O)[C@@H](F)Cl)CC3)CC2)no1	1838083610	XZXBORBHWVHDCL-GOSISDBHSA-N	444.891	1.845	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(N(C)C)nc3)CCO2)C1	1838192483	LENKLJSWIFRNKC-DYESRHJHSA-N	438.956	1.625	50	20	IDGD	
O=C(COC(=O)C(F)(F)F)N1CCC(OC2CCN(C(=O)C(Cl)Cl)CC2)CC1	1838376364	NLIOYSWDMWEHFX-UHFFFAOYSA-N	449.253	1.894	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)cc1OC	1838932296	YUSIWMPNJUOYGJ-IBGZPJMESA-N	447.315	1.578	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C=C/c3ccc([N+](=O)[O-])o3)C2)C1	1839141287	DDBUZNVIWDLOHM-LCRPYPQISA-N	441.868	1.675	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ncn(-c4ccccc4)n3)C2)C1	1839144632	HBNPUCZKJWLNBS-DYESRHJHSA-N	447.923	1.355	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1	1839147572	VWYRDEPOEUOUPA-ORAYPTAESA-N	447.315	1.839	50	20	IDGD	
O=C(c1ccc(OC(F)F)cc1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1839331091	RZNXSGXQGJNZGY-KSSFIOAISA-N	436.814	1.892	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnn4cccc(F)c34)CCO2)C1	1839619738	DFKSIKOSOZNKPS-FOIQADDNSA-N	438.887	1.561	50	20	IDGD	
CCN(CC)C[C@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1	1839678454	XZVHIIYJMLVCOT-GHTZIAJQSA-N	443.661	1.272	50	20	IDGD	
N#CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)CCO2	1839743469	SMRROZMLXFJCKX-ZZKIFARHSA-N	430.411	1.242	50	20	IDGD	
O=C([C@@H](O)CCl)N1CCOC[C@]2(C1)CN(C(=O)C1(c3ccccc3)CCC1)CCO2	1840113030	BSDGFMGKDWXSCO-RXVVDRJESA-N	436.936	1.164	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(OC)ccc3C)C2)C1	1840154815	HJONSBULBYHCBI-GHTZIAJQSA-N	440.924	1.327	50	20	IDGD	
O=C(C(Cl)Cl)N1CCO[C@@]2(COCCN(C(=O)[C@H]3Cc4ccccc4O3)C2)C1	1840188650	VYWNBCPLSWWYFP-DNVCBOLYSA-N	429.300	1.250	50	20	IDGD	
Cn1c(=O)c(C(=O)N2CC3(CCCN3C(=O)CCBr)C2)nc2ccccc21	1842638379	UUBIRQDYLIUUJQ-UHFFFAOYSA-N	433.306	1.536	50	20	IDGD	
O=C(c1c[nH]c(-c2ccc(F)cc2)c1)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843010692	SBUAMZLRDRHOEE-UHFFFAOYSA-N	447.275	1.631	50	20	IDGD	
Cc1nc2cccc(C(=O)N3CC4(CCCN4C(=O)c4ccc(B(O)O)cc4)C3)c2s1	1843011280	NWJNJVXKTPDQSH-UHFFFAOYSA-N	435.314	1.415	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1cncc(N(C)C)c1)C2	1843415643	VSGPYJJOFMKCIU-MFKUBSTISA-N	437.504	1.099	50	20	IDGD	
O=C([C@H](O)CCl)N1CC2(CCCN2C(=O)c2cccc3nc(C(F)(F)F)[nH]c23)C1	1843772039	YGZXUEWNJLQRSC-GFCCVEGCSA-N	430.814	1.998	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2cccn3cncc23)C1	1844114520	NBSPHSIGLXFUCJ-MFKUBSTISA-N	433.472	1.285	50	20	IDGD	
C[C@H](NC(=O)c1ccc(F)cc1)C(=O)N1CCCC12CN(C(=O)[C@@H](C)Br)C2	1845004503	POWXTESTGCCKTK-OLZOCXBDSA-N	440.313	1.931	50	20	IDGD	
CN(CC(=O)N1CCCC12CN(C(=O)CC(F)(F)F)C2)NC(=O)NCc1ccccc1	1845038759	QCTNVOWAPOBVQZ-UHFFFAOYSA-N	441.454	1.488	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)c1nc3c(=O)[nH]c4ccccc4n3n1)C2	1845165162	YDLRDORIIVGHRH-GFCCVEGCSA-N	428.880	1.405	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1O	1847235073	SQDVHUNPSVYIMJ-JSRQGNBESA-N	443.972	1.824	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)Cc1csc(C)n1	1848201405	UMKQXBLQEBEQGH-GOVKSTLWSA-N	428.518	1.330	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)Cc2cc(Cl)c3c(c2)OCCO3)c2ccccc2c1=O	10708475	HYYRGQWZCWEOMB-UHFFFAOYSA-N	428.832	1.362	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)[C@H]2Oc3ccccc3O[C@H]2C)cc1OC	10948509	DAKNFVOOLLVJGW-BUXKBTBVSA-N	430.413	1.237	50	20	IDGD	
O=C(NNC(=O)c1csc(S(=O)(=O)N2CCc3ccccc3C2)c1)c1cccnc1	11770903	MBDAJGRTZGXJGR-UHFFFAOYSA-N	442.522	1.965	50	20	IDGD	
CC(=O)N/N=C1\NC(=O)[C@@H](CC(=O)Nc2ccc(I)cc2)S1	15231921	HKALANZXNIKSTN-SNVBAGLBSA-N	432.243	1.259	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CSc2ccc(C)cc2)cc(OC)c1OCC(N)=O	15764098	SFBLENVFFAXXKR-UHFFFAOYSA-N	433.486	1.430	50	20	IDGD	
O=C(COc1ccccc1-c1ccccc1)NNC(=O)CSCC(=O)N1CCOCC1	69090075	FATJNVLKANEDNO-UHFFFAOYSA-N	443.525	1.472	50	20	IDGD	
CCNc1nc(NCC)n2c(SCC(=O)NNC(=O)c3ccccc3F)nnc2n1	104567070	VUKGNLRFVCDUCY-UHFFFAOYSA-N	433.473	1.075	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)c2sccc2S(=O)(=O)N2CCCC2)cc1C	105562401	BXFPKUBGJCSNPW-UHFFFAOYSA-N	437.543	1.989	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)c1ccc2c(=O)n3c(nc2c1)CCCCC3	726084113	OHNOKAGCKVWMGU-UHFFFAOYSA-N	443.504	1.799	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3cncn3-c3ccccc3)cc2)CC1	728214047	WDUCOOQXIJVEJI-UHFFFAOYSA-N	440.529	1.565	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1ccc(C(=O)N(C)C)cc1	728350659	BPYSRJFSNJCNGI-UHFFFAOYSA-N	433.848	1.668	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc2c(c1)OCCCO2)NNc1ccc(F)c(F)c1F	728717352	RHNRRSSZPUMLCQ-UHFFFAOYSA-N	431.392	1.687	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2ccc(-n3nc(C)cc3C)nc2)n1	728722422	OPANULFANFACKH-UHFFFAOYSA-N	428.474	1.196	50	20	IDGD	
O=C(CCCNC(=O)c1ccc(Cl)cc1)NNC(=O)C1CCN(c2ncccn2)CC1	728845989	SSPMETBONQPKKL-UHFFFAOYSA-N	444.923	1.704	50	20	IDGD	
CC(C)c1ccc(C(=O)O)cc1S(=O)(=O)NNC(=O)C1CCN(c2ncccn2)CC1	728854293	PMVRGJZMNVRKBU-UHFFFAOYSA-N	447.517	1.524	50	20	IDGD	
Cc1ccc(-c2nn(-c3ccccc3)cc2C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)o1	729276405	DXGIHFJEUFLYJD-CYBMUJFWSA-N	431.474	1.139	50	20	IDGD	
COc1cc(S(=O)(=O)NNC(=O)c2cccc3ncccc23)cc(C(=O)O)c1OC	730204323	PGCPJUDAGITXEF-UHFFFAOYSA-N	431.426	1.574	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)NCCN2CCSCC2)c2ccccc2c1=O	732891905	KYOCJHCDWVEYJD-UHFFFAOYSA-N	446.577	1.580	50	20	IDGD	
COc1cc(C=O)c([N+](=O)[O-])cc1OCC(=O)NNC(=O)c1cnn(-c2ccccc2)c1	733170479	ZCODWQLKCBJLBF-UHFFFAOYSA-N	439.384	1.442	50	20	IDGD	
Cc1cccnc1[C@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)C(C)C	734676669	VMPHMDYKVRULAH-QGZVFWFLSA-N	433.534	1.982	50	20	IDGD	
COc1ccccc1C(=O)NCC(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	734882342	RXLJAGZRCBOQPT-UHFFFAOYSA-N	449.508	1.155	50	20	IDGD	
Cc1ccccc1NS(=O)(=O)c1ccc(C)c(C(=O)NNC(=O)c2cnn(C)c2)c1	735473507	YVJDSQKTAXMPGY-UHFFFAOYSA-N	427.486	1.913	50	20	IDGD	
CN(CC(=O)NNC(=O)c1cc2c(s1)CCC2)S(=O)(=O)c1cccc([N+](=O)[O-])c1	737766510	OOAOUCOVPFXELN-UHFFFAOYSA-N	438.487	1.227	50	20	IDGD	
CC(=NNC(=O)CCN1CCCCCC1)c1cccc(S(=O)(=O)N2CCOCC2)c1	739414029	UTFDVWHEZSQRQA-UHFFFAOYSA-N	436.578	1.814	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)N[C@@H]1CCN(c2ccc(Cl)cc2)C1=O	740484181	JCFNSSNVKONMPV-OAHLLOKOSA-N	430.848	1.861	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNS(=O)(=O)c1cc(C(=O)O)cc(Cl)c1Cl	740812509	MUKSOVIDEBGOTK-UHFFFAOYSA-N	426.278	1.306	50	20	IDGD	
Cc1cc(N2CCCS2(=O)=O)ccc1C(=O)NNC(=O)[C@H]1COc2ccccc2O1	741515108	SFYAYWOWXJCXAD-GOSISDBHSA-N	431.470	1.136	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2cnn(-c3ccccn3)c2C)ccc1OC(C)C	742231556	KYTGZNATSCKOEI-UHFFFAOYSA-N	445.501	1.995	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)CCN2C(=O)[C@H]3[C@H](C2=O)[C@H]2CC[C@H]3O2)c1	742470964	YPPMQCYKWMNLBV-IMAQQZIHSA-N	443.500	1.197	50	20	IDGD	
CC(C)=CC(=O)NCc1ccc(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1	742478841	RYIKIWWFAJJSJA-UHFFFAOYSA-N	443.529	1.637	50	20	IDGD	
O=C(NNC(=O)N1CCN(Cc2cccc(F)c2)C(=O)C1)c1cc(Br)c[nH]1	743507942	HBLTYTHHAJNSRN-UHFFFAOYSA-N	438.257	1.615	50	20	IDGD	
CC(C)n1cnnc1SCC(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	744619812	ZNYJFSUIVGNQGZ-UHFFFAOYSA-N	440.551	1.115	50	20	IDGD	
CC(C)(C(=O)NNC(=O)c1cc(S(=O)(=O)N2CCCC2)ccc1O)c1ccccc1	745994375	AOTGIKFMOUUBLN-UHFFFAOYSA-N	431.514	1.916	50	20	IDGD	
O=C(NNC(=O)[C@@]1(O)CCN(Cc2ccccc2)C1)c1cc(F)ccc1Br	746215493	ITAZIFTWDHQAAQ-LJQANCHMSA-N	436.281	1.986	50	20	IDGD	
C[C@H](CS(C)(=O)=O)C(=O)NNC(=O)c1cn(-c2ccccc2)nc1-c1ccccc1	746825455	VFTRFSHPMGPQBF-OAHLLOKOSA-N	426.498	1.981	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)NNC(=O)NCCC(=O)N1CCN(c2ccccn2)CC1	748464676	IGSGCQAJTSJTJW-UHFFFAOYSA-N	449.515	1.175	50	20	IDGD	
NS(=O)(=O)c1cccc(N2C[C@H](C(=O)NNc3ccc(OC(F)F)cc3)CC2=O)c1	748661734	ZCTPSNASABAZOM-LLVKDONJSA-N	440.428	1.432	50	20	IDGD	
O=C(NCCc1cccs1)NNC(=O)[C@H]1CCCN1C(=O)c1ccc2c(c1)OCO2	749586634	WJCSFTTXIBMXCA-OAHLLOKOSA-N	430.486	1.655	50	20	IDGD	
O=C(NNC(=O)N1CCC(OC[C@@H]2CCCCO2)CC1)c1ccc(-n2cnnn2)cc1	750268413	SEQWVVJBXCZAIK-SFHVURJKSA-N	429.481	1.067	50	20	IDGD	
Cc1nc(S(=O)(=O)NCCC(=O)NNC(=O)CC23CC4CC(CC(C4)C2)C3)cn1C	750659559	QKHCLEMMFHTVHP-UHFFFAOYSA-N	437.566	1.151	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1Br)C(=O)NNC(=O)CNC(=O)c1cccs1	751206201	GXMNVEHGQMFXAY-VIFPVBQESA-N	444.282	1.994	50	20	IDGD	
CC[C@@H](C)C(=O)N1Cc2ccccc2C[C@@H]1C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	751295081	KRNNRBLAZPEKCA-FOIQADDNSA-N	447.499	1.423	50	20	IDGD	
O=C(NCc1cccc(C(F)(F)F)c1)NNS(=O)(=O)c1cnn([C@@H]2CCOC2)c1	751540684	JZFYSXNLSXIDDL-CYBMUJFWSA-N	433.412	1.556	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)N[C@H]3CCOC3)c2)c(C)c1	752703902	LSUFQZOZZJRYMI-INIZCTEOSA-N	432.502	1.837	50	20	IDGD	
Nc1nc(Cl)cc(NNC(=O)c2cc(S(=O)(=O)Nc3ccccc3F)c[nH]2)n1	753457622	ONCHLAWETKRNBC-UHFFFAOYSA-N	425.833	1.737	50	20	IDGD	
Nc1nc(Cl)cc(NNC(=O)[C@H]2CCN(c3ccccc3Br)C2=O)n1	753458228	XRTWSFOXUUMEMW-MRVPVSSYSA-N	425.674	1.971	50	20	IDGD	
Nc1nc(Cl)cc(NNC(=O)Cc2ccc(S(=O)(=O)N3CCCCC3)s2)n1	753682864	WJGUGXYIEHZVEA-UHFFFAOYSA-N	430.943	1.634	50	20	IDGD	
Cc1cc(C(=O)O)cc(S(=O)(=O)NNC(=O)c2ccc3c(c2)OCCO3)c1Cl	753769642	IRJWROYSTWQNBB-UHFFFAOYSA-N	426.834	1.741	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)COc2ccccc2O)cc1-n1nnnc1C1CC1	753904865	JHAYWACOKYOMMH-UHFFFAOYSA-N	439.432	1.486	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2c([N+](=O)[O-])cccc2C(F)(F)F)n1	755096212	FOXLOPCGRSZGQJ-UHFFFAOYSA-N	446.363	1.925	50	20	IDGD	
O=C(NCCN1C(=O)[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)NNC(=O)c1cc2c(s1)CCCCC2	755248672	WPKWGOBISUFKEN-LBTBCDHLSA-N	442.541	1.768	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)Nc1cccc(CN2CCOC2=O)c1	755826393	CAGUGXXSUOCDAK-UHFFFAOYSA-N	429.389	1.779	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)NNC(=O)c2ccc(OC)c(Br)c2)co1	755883401	RUBYBZPAXPUMKD-UHFFFAOYSA-N	432.252	1.034	50	20	IDGD	
CNC(=O)c1ccc(Cl)c(NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c1	755934309	RCBGTQGHENQKTI-UHFFFAOYSA-N	428.836	1.413	50	20	IDGD	
CN1CCCCC/C1=N\S(=O)(=O)c1cccc(NC(=O)NNC(=O)c2cnccn2)c1	756166494	PIVOAPYTABOYPA-KOEQRZSOSA-N	445.505	1.536	50	20	IDGD	
Cc1cccn2c(NC(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)c(-c3ccccc3)nc12	756285779	CLPYUIQPKBWALM-CYBMUJFWSA-N	430.490	1.400	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)Nc2ccccc2S(=O)(=O)N2CCCCC2)n1	756286678	JQGSTBNJRHFWEU-UHFFFAOYSA-N	434.522	1.527	50	20	IDGD	
CCOC(=O)[C@@H](C)NC(=O)c1ccc(NC(=O)NNC(=O)c2ccc(C#N)cc2)cc1F	756819473	SCYKLHKTJHUAGV-GFCCVEGCSA-N	441.419	1.845	50	20	IDGD	
O=C(Cc1c[nH]c2ncccc12)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	756899472	HVTUGWVOWMKRNX-UHFFFAOYSA-N	427.486	1.351	50	20	IDGD	
CC(C)N(C)S(=O)(=O)c1ccc(Cl)c(C(=O)NNc2ccc(C(N)=O)nn2)c1	757393494	ZECDVGOXUVJSKQ-UHFFFAOYSA-N	426.886	1.015	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)N[C@H](CC(N)=O)C2CCOCC2)c(C)n1C[C@@H]1CCCO1	757694882	ZUBUGRHJJFQDQG-KYGQQNHLSA-N	428.533	1.978	50	20	IDGD	
CCS(=O)(=O)c1ccc(CCC(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)cc1	757783465	MOXQLDDVSXRWQL-UHFFFAOYSA-N	443.481	1.289	50	20	IDGD	
O=C(NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12)C(=O)Nc1ccccn1	758839371	JGWXLSCNYNHQIL-UHFFFAOYSA-N	442.435	1.240	50	20	IDGD	
CNc1nnc(CC(=O)NNC(=O)[C@H]2Cc3ccccc3CN2Cc2ccccc2)s1	759681904	FWDQFHHKJSZXEN-GOSISDBHSA-N	436.541	1.897	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)NC[C@@H]1[C@@H](C)OC(C)(C)N1C(=O)OC(C)(C)C	762332027	UOFLXURSHVEUEI-MGPQQGTHSA-N	432.518	1.129	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1)c1ccc2nnc(O)n2c1	762969314	VHJOZYREXXFFRC-HXUWFJFHSA-N	442.479	1.823	50	20	IDGD	
O=Cc1ccc(OCCn2cc(C(=O)NNC(=O)c3ccc(Cl)nc3)nn2)c(Cl)c1	763275776	OCOVVYNRMHDWQN-UHFFFAOYSA-N	449.254	1.946	50	20	IDGD	
CCc1cc(NC(=O)C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)ccc1C	763531595	PKXDKPABRXHPAB-UHFFFAOYSA-N	437.544	1.856	50	20	IDGD	
CN(C)C(=O)c1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)c1ccc2c(c1)OCO2	763550551	DKQYNSDGFHWBAN-UHFFFAOYSA-N	432.820	1.170	50	20	IDGD	
CC(=O)N(Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)cc1)C1CC1	763550723	FZHUPVXSXWYIKT-UHFFFAOYSA-N	438.440	1.326	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2ccccc2F)c1	763563079	XQQICAIIYYDGNW-UHFFFAOYSA-N	436.465	1.302	50	20	IDGD	
CCOC(=O)/C=C\c1ccc(NC(=O)C(=O)NNC(=O)c2c(C)nc3ccccn23)cc1	763630229	WLFKEWLVFJWMEB-XFXZXTDPSA-N	435.440	1.619	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(C(=O)NCC(C)C)cc2)cc1	763662067	SVMINUHIANXYRI-UHFFFAOYSA-N	442.472	1.246	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)C(=O)Nc2cccc(NC(=O)c3ccoc3)c2)c1	763758080	NCKIXVPNMOCBKJ-UHFFFAOYSA-N	435.440	1.998	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2ccc3c(cnn3C(F)F)c2)c1	763772518	MTTNBCLUHSHZRV-UHFFFAOYSA-N	433.371	1.848	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2ccc(C)nc2Br)c1	763772958	RJKPIWKZWHTHPD-UHFFFAOYSA-N	437.250	1.569	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccc(F)cc1OCC(F)F	763840316	RFMUTZSVBLQYIK-UHFFFAOYSA-N	429.326	1.774	50	20	IDGD	
COc1ccc(CN(C)C)cc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccccc1F	763848989	GMJGLHSKFTWKGH-CYBMUJFWSA-N	432.452	1.449	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cnc(C(C)(C)C)nc2)cc1	763866431	PKKAIBNHTXWVIZ-ZDUSSCGKSA-N	429.477	1.726	50	20	IDGD	
COc1ccc(NC(C)=O)cc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccc(F)cc1	763873072	QHMRKQCUOKOIHE-LLVKDONJSA-N	432.408	1.346	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccc(OC3CCOCC3)c(C)c2)n1	763892940	OEWOTEUVIVECNG-UHFFFAOYSA-N	429.477	1.152	50	20	IDGD	
O=C1C[C@H](c2cccc(NC(=O)C(=O)NNC(=O)CCSc3ccc(F)cc3)c2)CN1	763895245	MVRVMXSFPLFFGD-AWEZNQCLSA-N	444.488	1.698	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)N(CC)CC3)cc1OC	763903957	XAMCRQCOTWPJRF-UHFFFAOYSA-N	426.473	1.876	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cccnc2-n2cccn2)ccc1OC(C)C	763921627	MTAJAWCMGJTYAE-UHFFFAOYSA-N	438.444	1.463	50	20	IDGD	
Cc1cc(C(=O)NC(C)C)ccc1NC(=O)C(=O)NNC(=O)c1ccc2c(c1)OCCO2	764003312	BETBHXHACZXFNF-UHFFFAOYSA-N	440.456	1.304	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccc(OCC(F)(F)F)cc1	764131100	DRJPIHBNCNLJJX-UHFFFAOYSA-N	425.363	1.965	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)C(=O)Nc1cccc(CN2CCOC2=O)c1	764243746	XYBNGQBHOOJRHN-UHFFFAOYSA-N	435.440	1.380	50	20	IDGD	
O=C(Cc1ccccn1)NNC(=O)C(=O)Nc1ccc(-c2noc(C(F)(F)F)n2)cc1	764271123	VOYTUIFZQVFNMZ-UHFFFAOYSA-N	434.334	1.479	50	20	IDGD	
CCOCC(=O)NNC(=O)C(=O)Nc1ccc(Oc2ccc(S(C)(=O)=O)cc2)cc1	764325656	QFMPECDZOROWHA-UHFFFAOYSA-N	435.458	1.005	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1c[nH]nc1-c1ccccn1	764393591	IVXFQHHMUKXKHU-UHFFFAOYSA-N	426.458	1.359	50	20	IDGD	
Cc1cc(-c2nc3cc(F)ccc3n2C(C)C)ccc1NC(=O)C(=O)NNC(=O)CO	764420708	FDBCSGPTTMCQIK-UHFFFAOYSA-N	427.436	1.810	50	20	IDGD	
CCOC(=O)c1cnn2c(C(=O)NNc3nc(Br)cn4ccnc34)ccnc12	764517193	JHOYWEVJOSBEDL-UHFFFAOYSA-N	445.237	1.468	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)Cc3cnn(-c4ccccc4)c3)CC2)cc1	765748474	FJVSUNOMYCYQGN-UHFFFAOYSA-N	446.555	1.688	50	20	IDGD	
COc1ccccc1N(C)S(=O)(=O)c1ccc(C)c(C(=O)NNC(=O)C(C)(C)O)c1	768260514	CQRNJECEZFHPAM-UHFFFAOYSA-N	435.502	1.361	50	20	IDGD	
O=C(Cn1c(S)nc2ccccc2c1=O)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	768289425	ZFOJFRYAAFUULV-UHFFFAOYSA-N	438.444	1.676	50	20	IDGD	
C[C@@]1(c2cccc(C(=O)NNC(=O)c3ccc(Br)s3)c2)NC(=O)NC1=O	768931024	UVCIBSKZLWRFQJ-INIZCTEOSA-N	437.275	1.640	50	20	IDGD	
Cc1cn(-c2ccccc2)nc1C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	770618317	GTVFCIRLWXTVAA-GOSISDBHSA-N	436.424	1.325	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)NNc2nc(O)c3cnn(C)c3n2)c(C)n1C[C@H]1CCCO1	770990166	MCLVLCCQXMPVJV-WPBGYSLVSA-N	436.476	1.717	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)C(=O)c1cnn(-c2ccccc2)c1	772194599	AKXIXEHLWGAZBN-UHFFFAOYSA-N	425.832	1.172	50	20	IDGD	
C[C@@H]1C[C@@H](NC(=O)NNC(=O)CNC(=O)c2cccs2)CCN1C(=O)OC(C)(C)C	772357724	OWTPRCFPVAPWOD-OLZOCXBDSA-N	439.538	1.596	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)Nc1cnn(Cc2nnc3n2CCCC3)c1	772636242	LLVMFOJOFYRIPU-UHFFFAOYSA-N	438.492	1.653	50	20	IDGD	
CCN1CCN(Cc2ccc(NC(=O)C(=O)NNc3nccnc3C(C)C)cc2)CC1	773991545	HVUBWEIQBOBKET-UHFFFAOYSA-N	425.537	1.819	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)N[C@@H]2CC(=O)N([C@@H]3C[C@@H]3c3ccccc3)C2)c1	776623745	PIQTWBDJGGHTEY-BHIYHBOVSA-N	428.514	1.873	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cc(C)cc(Br)c2)cc1	777140704	BEWDLKBZPOONJR-UHFFFAOYSA-N	436.262	1.931	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N2CCC(Cn3cncn3)CC2)cc1Br	777517533	LQLOQGOJQOHWOP-UHFFFAOYSA-N	437.298	1.816	50	20	IDGD	
O=C(c1csc(-c2ccccn2)n1)N1CCN(S(=O)(=O)CBr)CC1	777778154	YYWCYGQLXWAFGF-UHFFFAOYSA-N	431.337	1.645	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)[C@H]1CCCCN1C(=O)OCc1ccccc1	778434272	XLIVPVWFHDDLBJ-MRXNPFEDSA-N	434.493	1.850	50	20	IDGD	
O=C(NNc1ccc([N+](=O)[O-])cc1Br)C(=O)Nc1ccc(-n2cncn2)nc1	778751526	HUVUERQDTKKMGU-UHFFFAOYSA-N	447.209	1.415	50	20	IDGD	
NC(=O)c1coc(CNC(=O)NNC(=O)COc2ccc(OCc3ccccc3)cc2)c1	779674094	VWLTWNYVRHDNIP-UHFFFAOYSA-N	438.440	1.867	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)N2CC[C@H](C(=O)OC)C[C@H]2C(=O)OC)c1C	780138076	URXSQHZJYKXYFZ-XCABNSPFSA-N	431.489	1.612	50	20	IDGD	
CC(C)(C)OC(=O)NCc1cc(C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)co1	780346913	HCDRDOJNXCYUSK-UHFFFAOYSA-N	437.474	1.783	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)c2sccc2S(=O)(=O)N2CCOCC2)c1	780796077	YAZYEAYEZDSHLX-UHFFFAOYSA-N	425.488	1.313	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)NCc2ccc(C(=O)N3CCN(C)CC3)cc2)c1	780818109	QCQYLHWDFIYTRK-UHFFFAOYSA-N	425.489	1.687	50	20	IDGD	
CC(=O)N1CCN(c2cccc(NC(=O)NNC(=O)COc3ccccc3F)c2)CC1	782083563	UFPCHOROZVTIGM-UHFFFAOYSA-N	429.452	1.726	50	20	IDGD	
Cc1ccccc1NC(=O)NNC(=O)C(=O)Nc1cccc(S(=O)(=O)NC2CC2)c1	783415983	NCXFWSHZQRKLDE-UHFFFAOYSA-N	431.474	1.227	50	20	IDGD	
Cc1cc(C)nc(Sc2ccc(NC(=O)C(=O)NN[C@]3(C)CCS(=O)(=O)C3)cc2)n1	783428745	WXAXLTSOMKHUFQ-LJQANCHMSA-N	449.558	1.381	50	20	IDGD	
COc1cccc(NNC(=O)C(=O)Nc2ccc(N3CCC(CN(C)C)CC3)cc2)n1	784846643	UWJPMSZTBUACTD-UHFFFAOYSA-N	426.521	1.950	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2cc(N3CCNC(=O)C3)ccn2)c(C)n1-c1ccccc1	786682633	IVDSVADEWXYPEL-UHFFFAOYSA-N	432.484	1.500	50	20	IDGD	
CCN(C(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cc(C)[nH]n2)ccc1Cl)C(C)C	787542763	QMOYAPTYRVLJQO-UHFFFAOYSA-N	434.884	1.642	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2F)cc1N1CCNC1=O	787548790	HCKHDPWOLGATJL-UHFFFAOYSA-N	433.827	1.717	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1ccc(C(=O)NNC(=O)N2CCN(C)CC2)cc1	788169524	QTXPBAKBYYVABG-UHFFFAOYSA-N	447.517	1.098	50	20	IDGD	
Cc1ccc(C(=O)NNc2ccc(-n3ccnc3)nn2)cc1S(=O)(=O)N1CCCCC1	788174068	CYWONHFARRRSPR-UHFFFAOYSA-N	441.517	1.902	50	20	IDGD	
CCS(=O)(=O)c1ccc([C@H](C)NCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1	792949591	OUVAIGPJLVJRAQ-ZDUSSCGKSA-N	434.474	1.500	50	20	IDGD	
Cc1nc2ccc(NC(=O)C(=O)NNC(=O)CNC(=O)OCc3ccccc3)cc2s1	797368824	HLUOHVBRVSCADY-UHFFFAOYSA-N	441.469	1.617	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)Nc1ccc(F)c(N2CCOC2=O)c1	797658147	DHAMHFBCGXZTIK-UHFFFAOYSA-N	433.352	1.922	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccnc(OCc2ccccc2)c1	800622486	MIRCZFZXYCFGCW-UHFFFAOYSA-N	438.415	1.965	50	20	IDGD	
CNC(=O)CNC(=O)c1cccc(NC(=O)C(=O)NNc2ccc(Br)cc2)c1	800628787	ZNEKEYZHAIDSRA-UHFFFAOYSA-N	448.277	1.007	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)c2cnc(S)[nH]2)c1	800687681	FEFCWPNFKXBIMF-UHFFFAOYSA-N	447.498	1.583	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc(NC(=O)c3cnoc3C)ccc2O)cc1	801106523	XUIIJEMVZSNNHX-UHFFFAOYSA-N	437.412	1.649	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)Cc2cccc(I)c2)cc1	801108332	GOVUSJNLRSETBJ-UHFFFAOYSA-N	437.237	1.928	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)c2cc(C)c3c(O)nc(O)nc3n2)cc1Cl	802074636	TUFKWUBWYDLVOI-UHFFFAOYSA-N	448.823	1.882	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)[C@@H]2CCN(c3ccc4c(c3)OCCO4)C2=O)cc1	802123647	UHCPOTOQDYAQPT-KRWDZBQOSA-N	439.472	1.730	50	20	IDGD	
CS(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)NC2CCCC2)c(Br)c1	802722248	UMKFYBXVMGXMBW-UHFFFAOYSA-N	440.341	1.288	50	20	IDGD	
COc1ccc(CN2CC[C@@H](NC(=O)NNC(=O)c3cccc(C)n3)C2=O)c(OC)c1	805407552	WEIBEADFYCVAHV-QGZVFWFLSA-N	427.461	1.152	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)Nc1cccc(N2CCS(=O)(=O)CC2)c1	806229969	SZALNJIPDJJZSU-UHFFFAOYSA-N	428.478	1.046	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(F)c(N3CCOCC3)cc2F)c(O)c1	806976669	URDIKOQOBBSGLN-UHFFFAOYSA-N	434.399	1.215	50	20	IDGD	
Cc1cccc(F)c1NNC(=O)C(=O)N1C[C@@H](C[C@H]2COCC(=O)N2)c2ccccc21	806982708	CXLOBXWSHCRSIC-CABCVRRESA-N	426.448	1.613	50	20	IDGD	
O=C(NCC1=CCCOC1)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	807592859	HXKPZWUQVDOAAR-UHFFFAOYSA-N	433.468	1.736	50	20	IDGD	
Cc1nc(S(=O)(=O)NNC(=O)c2cc(Br)c[nH]2)c(Br)n1C	808070827	AUFURCOHANGKCG-UHFFFAOYSA-N	441.105	1.205	50	20	IDGD	
CCCS(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)Cn2ccc3ccccc32)cc1	808088930	LNVIPMHGQOKXOO-UHFFFAOYSA-N	435.527	1.835	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNC(=O)C(=O)Nc1ccc(-c2ccccn2)cc1	810408465	HVCKIAJNHFRFTK-UHFFFAOYSA-N	447.451	1.761	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)N(C[C@@H]2CCCO2)[C@H]2CCS(=O)(=O)C2)c1C	811966822	FUOKATWBUGYKPQ-CZONRBCFSA-N	449.573	1.853	50	20	IDGD	
CCCN1C(=O)c2ccccc2N2C(=O)CC[C@]12C(=O)NNc1nc(-c2cccnc2)no1	815547006	CSZVXPZXBVPFTN-QFIPXVFZSA-N	447.455	1.964	50	20	IDGD	
O=C(NNC(=O)c1ccncc1)C(=O)Nc1ccn(-c2ccc(Br)cc2)n1	815563871	QLDOFQGMVWQOJV-UHFFFAOYSA-N	429.234	1.430	50	20	IDGD	
COC(=O)C(C)(C)c1csc(NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)n1	815570276	XYFNBBLZXCWDCJ-UHFFFAOYSA-N	440.865	1.352	50	20	IDGD	
Cc1ccc(Oc2ccc(NC(=O)C(=O)NNC(=O)[C@H]3CCc4nncn4C3)cn2)cc1	815691532	SVTKKFLARZJICO-AWEZNQCLSA-N	435.444	1.122	50	20	IDGD	
O=C(COc1ccc(Cl)c(F)c1)N1CCN(S(=O)(=O)CBr)CC1	815964987	YWUFWTKVJOYMFL-UHFFFAOYSA-N	429.695	1.684	50	20	IDGD	
CS(=O)(=O)C[C@@H](C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1)c1ccccc1	816915868	NNWXFSGCTHOXDB-GOSISDBHSA-N	437.543	1.399	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)[C@@H]1CS[C@H](Cc2ccccc2F)C(=O)N1	892500473	WDIPFONQKAQREU-DLBZAZTESA-N	435.452	1.334	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@@H]1CCCN1C(=O)OC(C)(C)C	892841852	XWSFOFSWHXIRJU-ZDUSSCGKSA-N	439.538	1.449	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)[C@@H]2CCCN2S(=O)(=O)c2ccc(C)s2)cc1	899379126	PIZRJGFAESZPOK-INIZCTEOSA-N	436.559	1.778	50	20	IDGD	
CC[C@H](C)NC(=O)CN1CCN(C(=O)/C(C#N)=C\c2cc(C)n(CCOC)c2C)CC1	913017806	YDWSFUAMIGOSPJ-XESZTULISA-N	429.565	1.717	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCCCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1C	913416547	KGJXJJFQZMUMKI-LJQANCHMSA-N	447.513	1.349	50	20	IDGD	
CNS(=O)(=O)c1ccc(C(=O)NNC(=O)CCCOc2ccc(Cl)cc2C)o1	915063874	PETJXRPBKXUMIZ-UHFFFAOYSA-N	429.882	1.770	50	20	IDGD	
COCC(=O)NC1CCN(C(=O)/C(C#N)=C\c2cc(C)n(C[C@H]3CCCO3)c2C)CC1	915705780	TXBVLWXJIJYMHS-JAORQVBISA-N	428.533	1.945	50	20	IDGD	
Cc1cc(C)n(-c2ccc(CC(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)cc2)n1	916124857	YNGNGALKEKYAPU-UHFFFAOYSA-N	430.468	1.740	50	20	IDGD	
CC(=NNC(=O)[C@H](C)CN1CCCCC1)c1ccc(S(=O)(=O)N2CCOCC2)cc1	916360960	LVWONVBDQOZSST-QGZVFWFLSA-N	436.578	1.670	50	20	IDGD	
CCOC(=O)N1CCC(NC(=O)CCCNC(=O)NNc2cccc([N+](=O)[O-])c2)CC1	916639791	OJMJGMREJLXVHX-UHFFFAOYSA-N	436.469	1.738	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCc2c(F)cccc2F)c1	918227301	CDJXIIPVDGDPSU-UHFFFAOYSA-N	426.445	1.402	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2ccc(Cl)cc2O)cc1	918359126	MXYKOQPTXGQPIX-UHFFFAOYSA-N	427.866	1.045	50	20	IDGD	
CS(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)c2cc3c(s2)CCC3)c(F)c1	919955936	NWBRTUHTEOADGI-UHFFFAOYSA-N	433.508	1.371	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)[C@@H](CCSC)N1C(=O)[C@H]2CCCC[C@H]2C1=O	920006368	JCFOZIUWGLOEQL-IXDOHACOSA-N	447.557	1.682	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)N[C@H](CC(=O)N(C)C)c2ccccc2)cc1C	920046012	GLIOIWFFMKJBHF-GOSISDBHSA-N	425.489	1.792	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2CCCN2C(=O)Cc2ccccc2)c1	920220794	ZJFJWYVNQHDUQX-SFHVURJKSA-N	429.498	1.085	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)Nc2cccc(CN3CCC[C@@H]3C(N)=O)c2)cc1	920930419	LZFOPUUJOFEQSO-LJQANCHMSA-N	425.489	1.676	50	20	IDGD	
CCCN1CCCC[C@H]1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	1318054854	VGAHBSKFZNJOAS-IBGZPJMESA-N	436.578	1.887	50	20	IDGD	
Cc1ccccc1C(F)(F)C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	1319724034	NTPPLYXHAJFFSP-UHFFFAOYSA-N	430.455	1.692	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCc2cccc(CN3CCC[C@@H](C(N)=O)C3)c2)cc1	1321635315	WFNQQLAGOYNPHX-LJQANCHMSA-N	439.516	1.537	50	20	IDGD	
CC(C)(C)OC(=O)NCCCCNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1	1323620327	AQWFETJXMWYZLH-UHFFFAOYSA-N	435.529	1.328	50	20	IDGD	
Cc1c(C(=O)N2CC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)oc2ccccc12	1777746907	DITXGKWEYLNKFM-DEOSSOPVSA-N	448.284	1.178	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc3nc(CO)[nH]c3c1)C2)[C@H](F)Cl	1778025563	DUJOZIAFRCYWRM-OXFYSEKESA-N	438.887	1.717	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)C3CN(C(=O)OC(C)(C)C)C3)C2)C1	1778124408	MIJCJVFOPPCLTH-FOIQADDNSA-N	429.945	1.701	50	20	IDGD	
O=C([C@H](F)Br)N1CCO[C@@]2(CCN(C(=O)[C@H]3Cc4ccccc4O3)C2)C1	1778253243	SWFXHAWJVYWHJR-RVKKMQEKSA-N	427.270	1.511	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@]2(C1)CN(C(=O)Cc1ccc(F)c(C#N)c1)CCO2	1779300231	NLZQLBFTHCOSIH-OAQYLSRUSA-N	433.556	1.921	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)c3sccc3Cl)C2)C1	1779791255	QCUVGWNUWZBPFS-GOSISDBHSA-N	428.942	1.218	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)Cn3nnc4ccccc43)CCO2)C1	1781224701	NFLHHUGFHIGDMG-RBUKOAKNSA-N	440.331	1.498	50	20	IDGD	
C[C@@H](O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1781986786	WFZKXCSRKFRJQV-IGMJJTELSA-N	447.960	1.013	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc3c(n1)OCCO3)C2)C(Cl)Cl	1782217434	IIFWPOKLANDLKB-AUUYWEPGSA-N	444.315	1.784	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cccc4nccn34)C2)C1	1782362933	DRMPQARTVPJLJI-IFXJQAMLSA-N	435.322	1.951	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](O)Cc3ccccc3)C2)C1	1783342049	ZVBWCBGYQVYZBA-LSTHTHJFSA-N	429.344	1.656	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)C(=O)Nc3cccnc3)CCO2)C1	1783350046	ZKFDJSNKMZCDHZ-RDTXWAMCSA-N	439.310	1.024	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(CCN(C(=O)[C@H]3CCc4ccccc4O3)C2)C1	1783838145	GDKDKZHIAWLLCP-YLJYHZDGSA-N	437.334	1.995	50	20	IDGD	
CN1Cc2ccccc2C[C@H]1C(=O)N1CCO[C@@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783942386	NMVUMZVGCKTYAC-OXJNMPFZSA-N	426.344	1.677	50	20	IDGD	
O=C(c1cccc(N2CCOCC2)c1)N1CCO[C@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783947173	OPPAWSGNDDKCME-FQEVSTJZSA-N	442.343	1.770	50	20	IDGD	
CCOC(=O)N1CCC(C(=O)N2CC[C@@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)CC1	1785370797	RANNYSPXTKECDM-OAQYLSRUSA-N	443.972	1.950	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C=N/O[C@H]3CCCCO3)[C@H]2C1	1788653066	SQPGRMYXFHQVKP-CETKDWOKSA-N	429.945	1.760	50	20	IDGD	
CN(C)c1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]3C2)cn1	1788764722	SQVRAPAFXPUGSQ-BZSNNMDCSA-N	434.613	1.592	50	20	IDGD	
O=C(NC1(c2ccc(NC(=O)c3n[nH]cc3[N+](=O)[O-])cc2)CCC1)c1cccc(B(O)O)c1	1789689903	JOHOJTDBEZTCMV-UHFFFAOYSA-N	449.232	1.059	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)c1ccc2ccnn2c1	1790443930	RVUOHSOLMZFZIM-TUUVXOQKSA-N	439.285	1.618	50	20	IDGD	
CCc1[nH]nc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]3C2)c1F	1791057255	RMMKHLPHJUPOMS-BLFANLJRSA-N	431.306	1.488	50	20	IDGD	
C=CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C[C@@H]21	1791272042	NDWOZJWSOJKZLS-VGWMRTNUSA-N	429.945	1.674	50	20	IDGD	
COc1cccc(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)c1	1795644190	JVTDVEAGLMRWNX-BJWYYQGGSA-N	437.500	1.188	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)n[nH]1	1796146861	OJWDZJZZIUEAND-CLLJXQQHSA-N	443.416	1.514	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Br)C3)o1	1797748183	XPJHFMOAKRTPJJ-DJBIQUGXSA-N	432.246	1.132	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1c(O)cc(O)cc1O	1799659310	SSJMKIHPGCRNJU-DXCMXYRUSA-N	443.294	1.180	50	20	IDGD	
C[C@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@](C)(Cl)CCl)[C@@H]1SC(=N)NC1=O	1800078717	JSZYYLZRPXROQY-CTZDEMLISA-N	435.377	1.663	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cc(Cl)ccc1OC	1800407067	VQVGLIXRJGHZHV-MVWRLGRASA-N	445.343	1.735	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(OC(F)F)cn1)C2	1800973974	JQBGGWWUMXGUMD-WJNVRWDZSA-N	433.839	1.140	50	20	IDGD	
NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](Br)Cc1ccccc1	1801570755	VPWAUNFKFMNQDO-YVSFHVDLSA-N	436.350	1.896	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H]2C[C@]21C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](O)CCl)C2	1801980595	YTUQJYYTBSJLSC-VUSYMWPTSA-N	441.956	1.624	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)C(C)(C)C#N)[C@@H]1c1cccnc1	1802686482	LCNNFRKTFYOFSG-CRICWCDVSA-N	449.515	1.771	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1CCN(C(=O)COCCO)[C@H]1c1cccnc1	1803014615	JMHGFASUWZYVFM-KMFMINBZSA-N	428.327	1.127	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2noc3c2CCCC3)[C@H]1c1cccnc1)[C@H](O)CCl	1803139780	VUWPMUMAOWDVBM-GMBSWORKSA-N	432.908	1.868	50	20	IDGD	
Cn1nc2c(c1C(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)CCC2	1803146633	CBGZCBOVUAITDH-FHLIZLRMSA-N	431.924	1.223	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)c2cc(O)ncn2)[C@@H]1c1cccnc1	1803741507	ICVXXFCRSLWNEP-RBOXIYTFSA-N	434.294	1.680	50	20	IDGD	
Cc1cccc(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)n1	1805508510	WAKHIDJQLFHGNL-UGKGYDQZSA-N	444.300	1.098	50	20	IDGD	
Cc1cc(C)n2ncc(C(=O)N3CCC4(CCCN(C(=O)[C@@H](O)CCl)C4)CC3)c2n1	1805524499	QEUNENBOBIXXHF-KRWDZBQOSA-N	433.940	1.791	50	20	IDGD	
O=C(c1cc2cccnc2nc1O)N1CCC2(CCCN(C(=O)[C@H](O)CCl)C2)CC1	1805527274	ZNLYKAQWFUOSME-MRXNPFEDSA-N	432.908	1.780	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)C2CCCC2)[C@@H]1c1cccnc1	1806180582	KAXODGXHGNOQNN-XLIONFOSSA-N	436.516	1.590	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cccc(F)c2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1	1807375266	NOVUSCBNDLKMFX-SIKLNZKXSA-N	447.275	1.534	50	20	IDGD	
Cc1noc(CC(=O)NC[C@@H]2CCN(C(=O)[C@@H](C)Br)[C@@H]2c2cccnc2)n1	1807527705	GXIMNCHLRSCHSE-HYSWKAIVSA-N	436.310	1.805	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)c2cocn2)[C@H]1c1cccnc1	1808414837	MDUDSWSPAZXSBC-VQMZYRHSSA-N	449.471	1.523	50	20	IDGD	
Cn1nc(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)c2c1CCC2	1809359670	HPBOGRDUJPMBNK-UCLAIMLFSA-N	431.924	1.223	50	20	IDGD	
O=C(c1ccc2ccnn2c1)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1	1809980171	NMJWPIAHRXOEOF-UHFFFAOYSA-N	446.316	1.173	50	20	IDGD	
C[C@H](C(=O)NC[C@@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1)n1ccnn1	1812397025	YDBYCEJUSRBDRQ-KMFMINBZSA-N	435.326	1.725	50	20	IDGD	
COc1cnc(C(=O)N2CC[C@H](CNC(=O)[C@@H](C)Br)[C@H]2c2cccnc2)cn1	1812863558	FGTXWGVAXYRUSQ-SUYBPPKGSA-N	448.321	1.983	50	20	IDGD	
C[C@](O)(CC(=O)O)CC(=O)NC[C@@H]1CCN(C(=O)C(Cl)Cl)[C@H]1c1cccnc1	1813066524	BWMOYPDJNLNTMS-XLWVJDPXSA-N	432.304	1.507	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2ccc(F)cc2)[C@H]1c1cccnc1	1813072136	BVEVATKJCKYXAM-AVRDEDQJSA-N	441.507	1.913	50	20	IDGD	
Cc1nnc(CCC(=O)Nc2cc([C@@H]3CCCCN3C(=O)[C@@H](O)CCl)[nH]n2)s1	1815913158	NMVGFXRVBPJHAY-STQMWFEESA-N	426.930	1.794	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(O)cc2)[nH]n1	1819403971	QDMBJOFFYJMDIT-SFHVURJKSA-N	449.471	1.734	50	20	IDGD	
CN(C)C(=O)NCC(=O)N[C@H]1CCc2nc(NC(=O)CO[Si](C)(C)C)sc2C1	1820158651	MDLZLYDPUOFDDW-NSHDSACASA-N	427.603	1.178	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](C)N2CCN(C)CC2)n[nH]1	1820789968	SLEWRZOYISJLBR-YQQAZPJKSA-N	440.976	1.292	50	20	IDGD	
CS(=O)(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](F)Br)n[nH]1	1820936518	BGZICBFMDKPWGU-GWCFXTLKSA-N	439.307	1.527	50	20	IDGD	
O=C(c1nc2ccc(F)cn2n1)N1CCC([C@H]2CCCCN2C(=O)[C@H](O)CCl)CC1	1824187999	MCOYQJISWBHNHA-HZPDHXFCSA-N	437.903	1.701	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)CC(F)(F)F)CC1	1826676271	MJAXLZLSHWKRLF-INIZCTEOSA-N	441.454	1.871	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)Cc3c(C)nn(C)c3C)sc2C1	1826849576	WWDRSQXWCLHZBD-GXTWGEPZSA-N	439.969	1.902	50	20	IDGD	
O=C([C@@H](F)Cl)N1CCC([C@@H]2CCCCN2C(=O)CS(=O)(=O)N2CCCC2)CC1	1827675184	CMUDZDMQWOLFFQ-DOTOQJQBSA-N	437.965	1.566	50	20	IDGD	
CC(=O)N[C@@H](C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2)C(C)(C)C	1830353405	BHLTWXHSIICSHF-KKSFZXQISA-N	445.988	1.259	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(F)(F)C(F)F)C2)C1	1830535128	JUYZETITTOUJTC-HZMBPMFUSA-N	449.239	1.374	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(OC)nn2C)CC1	1831826845	AUZDXMBLTPPZNJ-JKSUJKDBSA-N	426.945	1.916	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3cnc[nH]3)CCO2)C1	1832813092	DTSCJRIEVUCFHB-MSOLQXFVSA-N	433.336	1.035	50	20	IDGD	
Cc1csc(CCC(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)c1	1832976405	PPIXWAJWFIDOAD-QFBILLFUSA-N	430.954	1.045	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CCC(N3CCC(NC(=O)[C@@H](O)CCl)CC3)CC2)o1	1833312606	RVCFEKKBRHEBFU-INIZCTEOSA-N	440.928	1.023	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3scnc3C3CC3)CCO2)C1	1833732260	RHKOVHXZAUGQBV-LIRRHRJNSA-N	443.953	1.344	50	20	IDGD	
O=C(CCBr)NC1CCN(C2CCN(C(=O)c3ccncc3O)CC2)CC1	1834423387	RWQXUBAZNMUFBG-UHFFFAOYSA-N	439.354	1.757	50	20	IDGD	
CO[C@@H](C(=O)NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)c1ccccc1	1834457973	MCWWMLARWIJFID-VQTJNVASSA-N	437.968	1.545	50	20	IDGD	
CO[C@@H](C(=O)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1)c1ccccc1	1834928221	QDZDNDZVRYHMND-DNVCBOLYSA-N	431.316	1.634	50	20	IDGD	
O=C(COc1ccccc1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1834954338	NVIKMIHFVCSIPK-AEFFLSMTSA-N	445.285	1.212	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](F)Cl)CC2)CC1)c1ccc2c(c1)CNC2=O	1835627162	AXMGUNVICWAAQP-GOSISDBHSA-N	436.915	1.650	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3ccc(CO)o3)CC2)CC1	1835928711	KRZSUARMOUJKBF-KRWDZBQOSA-N	427.929	1.211	50	20	IDGD	
O=C(c1cnc2cc(Cl)ccn12)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1836369136	ZIPYAOSZLLONQV-QAPCUYQASA-N	445.278	1.592	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)Cc3cnc[nH]3)CC2)CC1)[C@@H](F)Br	1836412685	QCCWMUQWAVQPJS-MRXNPFEDSA-N	430.322	1.214	50	20	IDGD	
CC[C@@H](NC(C)=O)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](F)Br)CC2)CC1	1836413761	OTDZAAOMMCGBLB-HZPDHXFCSA-N	449.365	1.163	50	20	IDGD	
CC[C@@H](NC(C)=O)C(=O)N1CCC(OC2CCN(C(=O)CCBr)CC2)CC1	1836616830	TWEPLQMGTRFXRS-QGZVFWFLSA-N	446.386	1.685	50	20	IDGD	
Cc1cccc(CCC(=O)N2CCC(OC3CCN(C(=O)[C@H](O)CCl)CC3)CC2)n1	1836715351	RAGXNVKFWXHCCN-HXUWFJFHSA-N	437.968	1.921	50	20	IDGD	
CC[C@H](C)CC(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1	1836792320	UUKOIXYSGXCTHR-KRWDZBQOSA-N	430.354	1.415	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)CSCC(=O)O)CC2)CC1	1838787126	TXPHAIIUHKZQRW-OAHLLOKOSA-N	436.958	1.057	50	20	IDGD	
Cc1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)c1	1838941508	NPIWLNUEQCNGRZ-HNAYVOBHSA-N	425.323	1.848	50	20	IDGD	
CC(C)=NO[C@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)Br)C2)C1	1839228019	QLPREDLLQAGEKN-CKEIUWERSA-N	434.331	1.027	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnn4c3OCCC4)CCO2)C1	1839516519	XFQXJPHJVRHMRG-HXUWFJFHSA-N	440.928	1.001	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccnc4ncccc34)CCO2)C1	1839542626	ADSKEWJJHAZXJC-LAUBAEHRSA-N	432.908	1.717	50	20	IDGD	
C[C@H](CC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1)Oc1ccccc1	1839746977	GBWVJVIVKRDVEL-MOXGXCLJSA-N	428.888	1.835	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccnc3S)C2)C1	1840029975	XARQSWOWFXVEOJ-SJKOYZFVSA-N	444.351	1.224	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CCCn3cccc3)C2)C1	1840036114	FQAAUQGRZXYKQW-LPHOPBHVSA-N	442.354	1.508	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4c(C)cccc4[nH]3)C2)C1	1840153358	LWALBFFTHNMBPT-JTSKRJEESA-N	449.935	1.800	50	20	IDGD	
O=C(CCCc1cccnc1)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840190913	VGRHXOCWFBUCHJ-IBGZPJMESA-N	430.332	1.664	50	20	IDGD	
COc1ccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)cc1F	1840527767	HZCSEOWMNNHQJH-IBGZPJMESA-N	449.306	1.637	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](CC(=O)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1)C1CC1	1841348517	VGDUZNXMXMNFFN-CABCVRRESA-N	429.945	1.483	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC2(CCCN2C(=O)Cn2ccccc2=O)C1	1843036948	LQDPFOGZEYTCGJ-LICLKQGHSA-N	438.434	1.937	50	20	IDGD	
COc1ccsc1C(=O)N1CC2(CCCN2C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C1	1843416403	FKBBJDQBEBGYHL-LPYMAVHISA-N	429.502	1.708	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)c2ccc(-c3ccccc3)nc2)C1	1844601035	VFWJGNUPDMWUIJ-UHFFFAOYSA-N	441.296	1.559	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)[C@@H](c2ccccc2Cl)N(C)C)C1	1845851094	HDYBPKONUIDRSV-HXUWFJFHSA-N	449.983	1.519	50	20	IDGD	
C=CCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl	1847564824	DIBSEFMRRUZXPD-VGWMRTNUSA-N	429.945	1.647	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1	17329582	HUMLEENJDWXMMW-UHFFFAOYSA-N	436.446	1.123	50	20	IDGD	
CC(C)(C)C(=O)NCC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	22259667	POLDLNWYTNWKNP-UHFFFAOYSA-N	438.531	1.472	50	20	IDGD	
O=C(Cn1ccc(=O)[nH]c1=O)NNC(=O)c1ccc(CSc2ccc(Cl)cc2)cc1	24399644	DJXOBDOSACHQGY-UHFFFAOYSA-N	444.900	1.944	50	20	IDGD	
CCCNC(=O)CSc1nnc(SCC(=O)NNC(=O)c2ccccc2)s1	26163271	FGNNEIIPMVXNGG-UHFFFAOYSA-N	425.561	1.710	50	20	IDGD	
COC(=O)c1ccc(C(=O)OCC(=O)NNC(=O)c2cc(Cl)ccc2OC)s1	29041101	LGTSSZNZBOMTEQ-UHFFFAOYSA-N	426.834	1.815	50	20	IDGD	
Cc1cccc(-c2n[nH]c(=S)n2CC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1	105292903	UTEJJZVZXFKRJQ-MRXNPFEDSA-N	425.470	1.904	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNS(=O)(=O)c3ccc4c(c3)n(C)c(=O)n4C)cc2C1	109594808	FPTPSRNBCQSING-LLVKDONJSA-N	434.543	1.687	50	20	IDGD	
Cc1nn(C)cc1CCC(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	261461632	HBLZZWUWXMELGJ-UHFFFAOYSA-N	444.495	1.881	50	20	IDGD	
Cc1nn(CCC(=O)NNC(=O)COc2ccc(Br)cc2)c(C)c1[N+](=O)[O-]	726496641	DCBDRNPWQDUSKC-UHFFFAOYSA-N	440.254	1.787	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCC(c3n[nH]c(-c4ccccc4)n3)CC2)n1	727434893	UJOBPQYVGPVJGY-UHFFFAOYSA-N	439.545	1.806	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)NCc1cccc(C(=O)NCCN(C)C)c1	727480436	ZVPJGKQDXYGXMO-UHFFFAOYSA-N	427.505	1.060	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCc2c(C)cc(C)nc2OC)nc1	727605655	SRZKLFKCHYHHNI-UHFFFAOYSA-N	436.538	1.959	50	20	IDGD	
O=C(CCCc1ccccc1)NNC(=O)c1ccc(S(=O)(=O)NC[C@@H]2CCCO2)cc1	727741256	LKVBBRTXDULRMN-IBGZPJMESA-N	445.541	1.928	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN1C(=O)OCC(F)(F)F)c1nnc(O)c2ccccc12	727798862	DVXDEEOKTDYKKP-NSHDSACASA-N	427.339	1.260	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCc2ccc(OCC#N)cc2)cc1	727942682	XZEYCQHRTGCWLU-UHFFFAOYSA-N	445.501	1.049	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NNc2nc(-c3cccnc3)no2)ccc1OC	728078396	DZDIREQSCCEQGY-UHFFFAOYSA-N	446.489	1.928	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C[C@H](c2ccccc2)N2CCOC2=O)c2ccccc2c1=O	728264154	AIXAYHWQPKZBNV-GOSISDBHSA-N	449.467	1.761	50	20	IDGD	
Cc1oc(-c2cccs2)nc1C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	728327480	BEVJDZJITTZTQH-CQSZACIVSA-N	443.437	1.856	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)[C@@H]1CCCN1c1ncnc2sccc12	728473755	QKBPXNUWEJCBEV-LBPRGKRZSA-N	430.515	1.299	50	20	IDGD	
CN(CC(=O)NNC(=O)c1cccc(OC(F)F)c1)C1=NS(=O)(=O)c2ccccc21	728488008	JKFPQJYMZQUNBE-UHFFFAOYSA-N	438.412	1.130	50	20	IDGD	
CCOC(=O)c1ccc(Br)c(S(=O)(=O)NNC(=O)NCc2ccco2)c1	728506744	CHBBDKRMOCBDGZ-UHFFFAOYSA-N	446.279	1.912	50	20	IDGD	
CC(C)CC(=O)NNC(=O)CN1CCN(Cc2ccc(Br)cc2F)CC1	729512150	BCLAVMRHHFHSSN-UHFFFAOYSA-N	429.334	1.899	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)[C@@H]1CCCN(S(=O)(=O)Cc2ccccc2)C1	730591143	MOSKDAWAVKGTND-LJQANCHMSA-N	445.541	1.714	50	20	IDGD	
COc1cc(C=O)c([N+](=O)[O-])cc1OCC(=O)NNC(=O)Cc1c[nH]c2ccccc12	731596969	NRTNRNNDFMNMCA-UHFFFAOYSA-N	426.385	1.666	50	20	IDGD	
C[C@H](Oc1ccccc1Br)C(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	732750280	LYJZGALPGMAXCM-NSHDSACASA-N	445.273	1.925	50	20	IDGD	
Cc1nn(C)c(C)c1C(=O)C(=O)NNc1nc2ccccc2c(=O)n1CCCOC(C)C	733265613	HPKAEFQYQMLRCK-UHFFFAOYSA-N	440.504	1.888	50	20	IDGD	
C[C@]1(NNC(=O)N[C@H]2CCN(Cc3ccc(C(F)(F)F)cc3)C2)CCS(=O)(=O)C1	734071416	JTXFVEUNKJGEDS-RDJZCZTQSA-N	434.484	1.661	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)N[C@@H](CN1CCCCC1)c1ccccc1	734280561	MVFKWOUCGUSWJR-FQEVSTJZSA-N	434.504	1.834	50	20	IDGD	
COc1ccc(CCC(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)cc1	735117296	PLOUKVXGBBULRG-UHFFFAOYSA-N	433.534	1.102	50	20	IDGD	
COc1ccc(S(=O)(=O)C[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)cc1	735123094	GANJTXMDXRYEFM-HNNXBMFYSA-N	447.513	1.508	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CSc2nnc(O)n2C[C@H]2CCCO2)cc1C	735979351	JMYAJYQQJPRREA-LLVKDONJSA-N	425.536	1.648	50	20	IDGD	
CC(C)CNS(=O)(=O)c1ccc(Br)c(C(=O)NNc2cccnn2)c1	736697254	BNXAEIAMWJUBSX-UHFFFAOYSA-N	428.312	1.930	50	20	IDGD	
CNC(=O)Cn1cnc(NC(=O)/C(C#N)=C\c2cc(C)n(-c3ccc(OC)cc3)c2C)n1	741995975	AEYVYPHQERNCGA-YVLHZVERSA-N	433.472	1.986	50	20	IDGD	
COc1ccc(O[C@@H](C)CNC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc1	743685737	DFENQYNFQJSBAM-AWEZNQCLSA-N	425.445	1.998	50	20	IDGD	
C[C@H](Oc1ccc(F)c(F)c1)C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	743741808	KKAYEQAXIJDLSQ-QMMMGPOBSA-N	433.820	1.494	50	20	IDGD	
O=C(CNc1ccccc1[N+](=O)[O-])NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	743841905	FBNRANMERHFTTG-UHFFFAOYSA-N	447.473	1.252	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)NCCC(=O)NCc2cccnc2)N(C)c2ccccc21	743948928	UDCPWUPNFCZZSE-UHFFFAOYSA-N	446.511	1.875	50	20	IDGD	
CCN(CC(=O)NNC(=O)Cc1nc(C)cs1)CC1CCN(c2ccccn2)CC1	744425165	CTOCBJKDDDMXMR-UHFFFAOYSA-N	430.578	1.775	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)c2cc(S(N)(=O)=O)c(Br)s2)c1	744463104	BCOYANXRMBEOIE-UHFFFAOYSA-N	447.336	1.299	50	20	IDGD	
CC(C)n1ncc2cc(C(=O)NNc3ccccc3S(=O)(=O)N3CCOCC3)cnc21	744622338	SJIFRBTVLCWICL-UHFFFAOYSA-N	444.517	1.790	50	20	IDGD	
O=C(NCCNS(=O)(=O)c1cccs1)NNC(=O)c1cccc(OC(F)F)c1	746721185	HQSGNXJMBKRABC-UHFFFAOYSA-N	434.446	1.272	50	20	IDGD	
C[C@H](CN(C)C(=O)OC(C)(C)C)C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	746823257	XBHBKZOYNCBMOL-SNVBAGLBSA-N	448.929	1.251	50	20	IDGD	
Cc1cc(=O)c(C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)nn1-c1ccccc1[N+](=O)[O-]	748278926	DWMVGBDVLJEBOC-SFHVURJKSA-N	435.396	1.214	50	20	IDGD	
Cc1nc2nc(N)nn2c(C)c1CC(=O)NNc1nc(-c2ccccn2)nc2c1CCC2	748339105	KPWUYACETRMVKF-UHFFFAOYSA-N	430.476	1.350	50	20	IDGD	
C[C@H](c1ccccc1)[C@](C)(O)C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	748620580	RCUHUJHFQKJFGW-VGSWGCGISA-N	446.573	1.621	50	20	IDGD	
CCC[C@H](NC(=O)NNC(=O)[C@H](C)OCCOC)C(=O)N1CCc2sccc2C1	748633478	ZBGNLLOLCFNCRY-ZFWWWQNUSA-N	426.539	1.183	50	20	IDGD	
COCCOCC(=O)NC1CCC(C(=O)NNC(=O)c2cccc3cccnc23)CC1	748733862	WNDAOFALTWRNAN-UHFFFAOYSA-N	428.489	1.334	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)N2CCN(CCn3cncn3)CC2)c(C)n1C[C@@H]1CCCO1	749397658	QKYIQIJGSZCEMH-YRUATGHUSA-N	437.548	1.627	50	20	IDGD	
CC(C)c1nc(C#N)c(NNC(=O)CNS(=O)(=O)c2ccc3c(c2)OCCCO3)o1	749941822	OUHFTDLTOGAWFN-UHFFFAOYSA-N	435.462	1.253	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2ccc(Br)cc2N)n1	751773222	MBQGZONNYBQEJX-UHFFFAOYSA-N	427.280	1.343	50	20	IDGD	
C[C@@H]1C[C@@H](CNC(=O)OC(C)(C)C)CN1C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	752126317	GTZPMMBGRKNTRZ-KGLIPLIRSA-N	444.496	1.252	50	20	IDGD	
CC[C@H](CS(=O)(=O)c1ccccc1)NC(=O)NNC(=O)COc1ccccc1OC	752127843	WQHLCARNQQKWCZ-OAHLLOKOSA-N	435.502	1.657	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2c(F)ccc([N+](=O)[O-])c2F)cc1OC	752566789	FVNOQJNWAQGSLZ-UHFFFAOYSA-N	439.327	1.508	50	20	IDGD	
Cc1ccc(C)n1-c1ccc(C(=O)NNC(=O)NC[C@H]2CCCN2S(C)(=O)=O)cc1	753694912	KQWDSWTURHLFNT-GOSISDBHSA-N	433.534	1.462	50	20	IDGD	
NC(=O)c1ccc(/C=C/C(=O)N2CCC[C@H]2C(=O)NNc2ccc(C(F)(F)F)nn2)cc1	755182622	MVGQFZVRXOEADM-SEIPJRMCSA-N	448.405	1.742	50	20	IDGD	
Cn1cc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)cn1	755492297	CKOJJPCXXIQMEZ-UHFFFAOYSA-N	428.474	1.365	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)Nc2ccc(OCC(=O)N(C)C)cc2)cc1	755646602	NRRPQRNNTMNGIY-OAHLLOKOSA-N	442.472	1.976	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1ccccc1C(=O)N(C)C1CCCCC1	756118718	FZAUNBMTCZQZRP-CYBMUJFWSA-N	439.538	1.182	50	20	IDGD	
CCOc1ccc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)c3ccnnc3)cc2)cc1	756744521	GYQWXSKPFWHFGE-UHFFFAOYSA-N	441.469	1.751	50	20	IDGD	
C[C@](O)(CN1Cc2ccccc2C1=O)C(=O)NNc1c(F)cc(C(=O)NC2CC2)cc1F	756876053	OQIXZSYGCPFIKQ-QFIPXVFZSA-N	444.438	1.707	50	20	IDGD	
NC(=O)c1ccc(NNC(=O)c2cccc(S(=O)(=O)Nc3ccc(Cl)cc3)c2)nn1	757393535	ZYYCBYPCBCUBQN-UHFFFAOYSA-N	446.876	1.787	50	20	IDGD	
Cc1nc(N2CCOCC2)ccc1NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1	757734714	VOUVXJRAQJDTKE-UHFFFAOYSA-N	440.508	1.086	50	20	IDGD	
COc1ccc2c(c1)[C@H](C(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1)CC2	761402762	WBWCHXRMYUMJOW-GOSISDBHSA-N	431.514	1.502	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@@H]2CC[C@H]3SCCS[C@@H]23)c2ccccc2c1=O	763077134	BLXPJMRFDQYETD-FMKPAKJESA-N	433.559	1.740	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cccn(Cc3ccc(F)cc3)c2=O)c(C)o1	763576270	JJYFREDHLDUKMJ-UHFFFAOYSA-N	426.404	1.645	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(-n3cccn3)c(F)c2)cc1C	763665278	RPXKTBHCMCEFOE-UHFFFAOYSA-N	425.420	1.793	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)COc3ccccc3F)cc2)C[C@@H](C)O1	763679863	PTAPOEZHTBHLOI-GASCZTMLSA-N	444.463	1.604	50	20	IDGD	
CC(C)n1cnnc1-c1ccccc1NC(=O)C(=O)NNC(=O)COc1ccccc1F	763680688	VJMNXZRWFQKBOH-UHFFFAOYSA-N	440.435	1.830	50	20	IDGD	
CNC(=O)CCOc1ccc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCC3)cc1	763783075	LCWUPVQOPBMARF-UHFFFAOYSA-N	430.486	1.151	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)C(=O)Nc1cnc(-c2ccccc2)s1	763802326	AYPPLTWJOCXJMT-UHFFFAOYSA-N	441.425	1.883	50	20	IDGD	
COc1cc(OC)c(OC)cc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1cccc(C)c1C	763849700	MFIIQVYZIYHHGA-CQSZACIVSA-N	445.472	1.883	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccn(CC(F)F)n2)cc1OC	763911733	KSYKBSYDOQRBIB-UHFFFAOYSA-N	425.392	1.345	50	20	IDGD	
C[C@H]1CN(Cc2cccc(NC(=O)C(=O)NNC(=O)Cc3ccc(F)cc3)c2)C[C@@H](C)O1	763919796	VOIICZBDMBKKMF-IYBDPMFKSA-N	442.491	1.764	50	20	IDGD	
Cc1cc(C(=O)N2CCC(C)CC2)ccc1NC(=O)C(=O)NNC(=O)c1cccn1C	763995665	KPTXKXMNAMBANW-UHFFFAOYSA-N	425.489	1.605	50	20	IDGD	
CCn1c(=O)n(CC)c2nc(NC(=O)CCC(=O)NNC(=O)CC3CCCC3)ccc21	764067789	HILCOBPJHNNZEK-UHFFFAOYSA-N	430.509	1.684	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1)[C@H]1CN2CCCN1CC2	764074176	DRSKCSCBIKVKEO-DHIUTWEWSA-N	433.556	1.151	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)CC)cc1S(=O)(=O)N1CCCC1	764084664	VPMJLSLWNCLVDS-CYBMUJFWSA-N	440.522	1.002	50	20	IDGD	
COC(=O)c1csc(NC(=O)C(=O)NNC(=O)c2ccc(F)cc2Br)c1	764086495	VDELXLAXMXZGHB-UHFFFAOYSA-N	444.238	1.836	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cccnc3Br)n[nH]2)cc1	764111279	OIWLDJILMWZWIT-UHFFFAOYSA-N	443.261	1.942	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccccc1S(=O)(=O)C(F)F	764138180	ABXLLCICZCBAAS-UHFFFAOYSA-N	441.412	1.020	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)CCc2ccco2)c(OC(F)F)c1	764168331	CSNLIRSLVYBCFA-UHFFFAOYSA-N	425.344	1.386	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2c(Cl)cccc2Cl)cccc1-n1cnnn1	764221769	ZJHKXQMQUXOZGF-UHFFFAOYSA-N	434.243	1.677	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)C(=O)Nc1ccccc1C(=O)N1CCCC1	764350215	AWYSSYMQRVOWNQ-UHFFFAOYSA-N	446.467	1.508	50	20	IDGD	
C[S@@](=O)c1cccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)c1	764388277	QFWDXFWEXZHNFG-SSEXGKCCSA-N	429.433	1.353	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1)C(=O)Nc1ccccc1-n1cccn1	764388356	RDOOAPHPKYXHGY-UHFFFAOYSA-N	433.403	1.801	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2F)cc1-n1nnnc1C	764410326	LDHQLYHOMDMRLL-UHFFFAOYSA-N	447.814	1.172	50	20	IDGD	
O=C(NNC(=O)c1nc2ncc(Br)cn2n1)c1cc(-c2cccs2)[nH]n1	765570183	WEYXBGXSKPXMFH-UHFFFAOYSA-N	433.251	1.413	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3ccc([S@](C)=O)cc3)CC2)cc1	765749359	MEUDHXQUGSKYGM-PMERELPUSA-N	428.558	1.311	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN(C(=O)OCc2ccccc2)C1)C(=O)Nc1ccccn1	766654437	MJCVEDXJUYNBOA-MRXNPFEDSA-N	425.445	1.216	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)CCC(=O)N1CCN(c2ccccn2)CC1	766667722	CJKCEJZBMYGMFR-UHFFFAOYSA-N	431.518	1.057	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1cnn(C2CCOCC2)c1C	766757243	HKKVVTUIAFYRRJ-UHFFFAOYSA-N	434.522	1.219	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NC[C@H]2CCCS2(=O)=O)ccc1OCCC(C)C	767172775	BQGGGHKYSZVTMM-OAHLLOKOSA-N	427.523	1.641	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)N1CCN(Cc2ccccc2Cl)CC1	767941799	CJHMLOHYFJRSNZ-UHFFFAOYSA-N	435.937	1.690	50	20	IDGD	
COC(=O)c1[nH]c(C)c(C(=O)OCC(=O)NNC(=O)c2cc(Cl)ccc2OC)c1C	768664862	LVQGVFLQJAFOID-UHFFFAOYSA-N	437.836	1.698	50	20	IDGD	
C[C@H]1CN(c2ccc(CNC(=O)NNc3nc(O)c4cnn(C)c4n3)cc2F)C[C@H](C)O1	770352085	UEDGOPKJHQYRBW-RYUDHWBXSA-N	444.471	1.648	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)c2cc(Br)cc([N+](=O)[O-])c2)C[C@@H](C)O1	770949676	DJXPGGUTPJSHHM-GHMZBOCLSA-N	429.271	1.618	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)[C@@H]3CCN(C)C3=O)c2)c(C)c1	771853242	RCUYMKOHGYPBSY-KRWDZBQOSA-N	444.513	1.344	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)C(=O)Nc2ccccc2S(=O)(=O)N2CCCCC2)n1	773478825	COKFKZQKASAQSO-UHFFFAOYSA-N	432.506	1.350	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(SC)cc1OC	773525092	JHOHNFFLDLFVGX-UHFFFAOYSA-N	433.486	1.981	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc([C@@H](C)N3CCOCC3)cc2)cc1F	773884867	DCXXXYNFOFHFTB-OAHLLOKOSA-N	428.464	1.927	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1cccc(N2CCNC2=O)c1	774009997	TXFHOSDGUGQBJO-GFCCVEGCSA-N	445.863	1.423	50	20	IDGD	
Cc1cc(S(N)(=O)=O)ccc1CNC(=O)NNC(=O)c1ccc(Br)s1	775203144	SAHFSUYNVCLXDT-UHFFFAOYSA-N	447.336	1.611	50	20	IDGD	
CN(NC(=O)CCc1nc(-c2ccoc2)no1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776201259	HWWNVSNOJGWUJW-UHFFFAOYSA-N	448.480	1.898	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)c2c(C)nn(C)c2-n2cc(C)cn2)cc1	777422301	VRVFDKQKPHSPSA-HNNXBMFYSA-N	426.477	1.850	50	20	IDGD	
COC(=O)c1cc(C(=O)NNC(=O)c2nc(-c3ccccc3)n(-c3ccccc3)n2)on1	777795499	BTSIGMGZQZFPRM-UHFFFAOYSA-N	432.396	1.784	50	20	IDGD	
C[C@@H]1CCN(S(=O)(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)C1	777907356	SBBLJOXHLZINJA-OAHLLOKOSA-N	441.517	1.209	50	20	IDGD	
C[C@H](C1CC1)n1cc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)cn1	778714058	OYZPASFKSXSNOD-LLVKDONJSA-N	425.424	1.783	50	20	IDGD	
CCn1c(NNC(=O)[C@@H](O)[C@H](O)c2nc3ccccc3s2)nc2ccccc2c1=O	779475391	LGRNJZSGQKEGKH-HOTGVXAUSA-N	425.470	1.564	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H]1C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	780157139	IXOXREIYBRYLED-GOSISDBHSA-N	431.537	1.356	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(N2C[C@H](C(=O)NN=c3cc[nH]cc3)CC2=O)cc1	780761908	LIHIXUDLIOMVFS-OAHLLOKOSA-N	431.518	1.030	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C(=O)Nc2ccc(Br)c(F)c2)nc2ccccc21	782885184	FRYDDFGKWPYZQH-UHFFFAOYSA-N	448.252	1.804	50	20	IDGD	
O=C(NCc1ccc(N2CCOC2=O)cc1)NNC(=O)c1csc(N2CCOCC2)n1	782998529	YFFTVDUUGGZTFG-UHFFFAOYSA-N	446.489	1.081	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2ccc(N3CCC(CN(C)C)CC3)cc2)nc(C)n1	783330299	KXQKVQVDCGBPAA-UHFFFAOYSA-N	425.537	1.953	50	20	IDGD	
C[C@@H](c1cccc(NC(=O)C(=O)NNc2ccc(-n3cccn3)nn2)c1)N1CCOCC1	783433653	WXLXDGJIYBKBRI-HNNXBMFYSA-N	436.476	1.137	50	20	IDGD	
Cn1nc(C2CCCCC2)cc1NC(=O)C(=O)NNC(=O)CNC(=O)c1cccs1	784004297	DXKVYBYQRCPWKE-UHFFFAOYSA-N	432.506	1.045	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CCC[C@H]2CN(CC(=O)NNC(=O)c3ccc(C#N)cc3)C[C@H]21	784503845	FRQUIWDNWHWIHW-IPMKNSEASA-N	441.532	1.944	50	20	IDGD	
CCOc1cc(N2CCN(C)CC2)ccc1NC(=O)C(=O)NNc1nccnc1Cl	784782614	ZKCWIZXPAVTBTF-UHFFFAOYSA-N	433.900	1.362	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)C(=O)Nc2ccc(N3CCC(C(N)=O)CC3)cc2)c1	784853876	RBPXQZBRAKKKQX-UHFFFAOYSA-N	439.472	1.257	50	20	IDGD	
CN1CCC[C@@H](N(C)C(=O)c2ccc(NC(=O)C(=O)NNc3cc(Cl)ccn3)cc2)C1	784861132	PYZJGESQOHHOGM-QGZVFWFLSA-N	444.923	1.983	50	20	IDGD	
CCNC(=O)N(C)NC(=O)C(=O)Nc1ccc(Oc2cccc(S(C)(=O)=O)c2)cc1	784917289	JBQXOISZDCYAON-UHFFFAOYSA-N	434.474	1.513	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)C(=O)Nc3cc(C(N)=O)ccc3F)n[nH]2)c1	785126915	UIVGTFOOPAMTQF-UHFFFAOYSA-N	438.419	1.331	50	20	IDGD	
Cc1noc(C)c1S(=O)(=O)N1CCCN(C(=O)/C(C#N)=C\c2ccc(O)cc2)CC1	786784051	PNPXNIYLMZJKGY-ATVHPVEESA-N	430.486	1.827	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cnc1Br	788491972	LFRSJSOLINGBRK-UHFFFAOYSA-N	432.234	1.174	50	20	IDGD	
CN(Cc1cccc(NC(=O)C(=O)NNc2nc3ccccn3n2)c1)C(=O)C(F)(F)F	792393962	KNXANBKQNKOEAM-UHFFFAOYSA-N	435.366	1.332	50	20	IDGD	
O=C(NNc1nc2ccccn2n1)C(=O)Nc1ccc(CCN2CCSCC2)cc1	792393991	JNRYCASVSKIJRX-UHFFFAOYSA-N	425.518	1.402	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNS(=O)(=O)CC2(C(=O)OC)CCCCC2)cc1	793351524	YQBNBGOUZRNVAK-OAHLLOKOSA-N	442.534	1.927	50	20	IDGD	
CC(=O)c1cc(Br)ccc1OCC(=O)NNC(=O)C(=O)Nc1ccccn1	797163156	XOHSSCISYQUVLG-UHFFFAOYSA-N	435.234	1.212	50	20	IDGD	
Cc1ccc(-n2cnnc2)c(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c1	797788686	RTLIQLYGSPPVFF-UHFFFAOYSA-N	433.516	1.549	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)c2nn(-c3cc(C)ccc3F)cc2O)cc1	801414271	IMNGYWJUZXDWJW-UHFFFAOYSA-N	426.404	1.952	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCN(c3cc(C(F)(F)F)ccn3)CC2)n1	801542042	NWFYCOGJKVCDSK-UHFFFAOYSA-N	442.467	1.377	50	20	IDGD	
CN(C)C(=O)Cn1cc(C(=O)NNc2ccc(-c3cccc(C(F)(F)F)c3)nn2)nn1	804209574	FWWMPNILKKSVNH-UHFFFAOYSA-N	434.382	1.599	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)Nc2ccc(F)c(N3C(=O)CCC3=O)c2)cc1	806743440	FBRFPXKREYJPCJ-UHFFFAOYSA-N	425.376	1.582	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2cccc(C(C)(C)O)c2)n[nH]1	806979134	NEDAPNQDONFTOS-UHFFFAOYSA-N	437.456	1.712	50	20	IDGD	
COc1ccc([C@@H](C)NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c(C)c1OC	807599453	MSRJEMQSFJXGPM-CYBMUJFWSA-N	439.472	1.964	50	20	IDGD	
CN(C)c1c(C=NNC(=O)c2ccc(-c3ccc(F)cc3)s2)c(=O)n(C)c(=O)n1C	807958739	DZMSYMDSIYEQRI-UHFFFAOYSA-N	429.477	1.782	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2ccc3c(C)cc(O)nc3c2)cc1OC	808655951	GJKIXBZQNPQJMC-UHFFFAOYSA-N	439.424	1.884	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)N=c1cc[nH]c2ccc(Oc3ccccc3)cc12	809892234	PVYVALZYTPUQDJ-CYBMUJFWSA-N	443.485	1.539	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)[C@H]2CCN(c3ccccc3Cl)C2)c2ccccc2c1=O	809933145	TURPHJLBSMRUOA-ZDUSSCGKSA-N	425.876	1.874	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)NC[C@@H]1CCCCN(Cc2ccccc2)C1	811872898	YLPHIUQJSVRIJD-SFHVURJKSA-N	427.505	1.642	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)Nc2nc(CN3CCOCC3)cs2)cc1	812313707	MQPRUOVBIUWCQS-UHFFFAOYSA-N	440.551	1.374	50	20	IDGD	
COC(=O)c1cn(-c2cccc(NC(=O)NNC(=O)CSc3ccccc3O)c2)nn1	812977853	TXNHNJJFERHAMO-UHFFFAOYSA-N	442.457	1.705	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)c1c(I)cnn1C	814103396	YOWIAGIRHPYMQY-MRVPVSSYSA-N	432.193	1.392	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)cc1)[C@H]1C[C@@H]1C	815568276	BMEGRDCITGFHQF-GMVOTWDCSA-N	436.468	1.538	50	20	IDGD	
C=CCn1c(=O)c2ccccc2n2c(SCC(=O)NNc3ncncc3F)nnc12	817068133	WXDWGXRRJBYZGF-UHFFFAOYSA-N	426.437	1.395	50	20	IDGD	
Cc1nnnn1/C(=C/c1ccc(F)cc1)C(=O)NNC(=O)c1cc(Br)c[nH]1	818071005	IGYXXERJROOHSC-MKMNVTDBSA-N	434.229	1.671	50	20	IDGD	
O=C(CCCNS(=O)(=O)c1cccc(C(F)(F)F)c1)NNC(=O)c1ccncc1	912768511	DPBXSUHVHWXRSN-UHFFFAOYSA-N	430.408	1.620	50	20	IDGD	
CC[C@@H](C)NC(=O)CN1CCN(C(=O)/C(C#N)=C/c2cc(C)n(CCOC)c2C)CC1	913017793	YDWSFUAMIGOSPJ-AQRZYSDFSA-N	429.565	1.717	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)c2cc(S(N)(=O)=O)ccc2F)cc1OC	913069838	PXSGQSGMFNFVNR-UHFFFAOYSA-N	425.438	1.345	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CCN2C(=O)[C@H]3CCCC[C@@H]3C2=O)ccc1OC(C)C	913154138	KWZQATYKNAUGQB-HOTGVXAUSA-N	431.489	1.809	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)CNC(=O)c1cccc(Cl)c1	913391997	RYHCDVSHTAADEF-UHFFFAOYSA-N	443.935	1.430	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)COc2cccc([N+](=O)[O-])c2)c2ccccc2c1=O	914750383	GISJPMUPYPNMFY-UHFFFAOYSA-N	425.401	1.726	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc2c(c1)Cc1ccccc1-2)c1ccc(-n2cnnn2)cc1	915185109	RPMYMXOGQMUTSL-UHFFFAOYSA-N	432.465	1.857	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)CNS(=O)(=O)c2ccc(Cl)cc2)c1C	915787933	NRXAMNMQLHHDSA-CQSZACIVSA-N	439.921	1.850	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=S)Nc2cccc(S(=O)(=O)N(C)C)c2)c1	916117724	JVCRARBXIMFVOE-UHFFFAOYSA-N	437.547	1.375	50	20	IDGD	
CCn1cnc2c1c(=O)n(CC(=O)NN=Cc1ccccc1C)c(=O)n2Cc1ccccc1	916332120	NVWCORNHPHVHNH-UHFFFAOYSA-N	444.495	1.887	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2cccnc2OCC(F)(F)F)c1	916398423	WRJPZCBUTJXXPZ-UHFFFAOYSA-N	446.407	1.570	50	20	IDGD	
CCCCn1c(C)cc(/C=C(\C#N)C(=O)N2CCN(C(=O)C(=O)NC3CC3)CC2)c1C	916409019	MTOYTLLUBWADBA-XMHGGMMESA-N	425.533	1.761	50	20	IDGD	
O=C(CSc1ccc(Cl)cc1)NNC(=O)NCCCn1nc2n(c1=O)CCCC2	916649890	NRNHCMRYJRYLJI-UHFFFAOYSA-N	438.941	1.547	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)c3ccc(S(=O)(=O)NC4CC4)cc3)n[nH]2)cc1	917178289	RFGZWGHHLZNFAN-UHFFFAOYSA-N	439.497	1.901	50	20	IDGD	
O=C(COC(=O)Cc1csc2ccccc12)NNC(=O)[C@H]1COc2ccccc2O1	917285576	OQPQODOFQSIAON-QGZVFWFLSA-N	426.450	1.974	50	20	IDGD	
Cc1cc(C(=O)NNS(=O)(=O)c2cc(S(C)(=O)=O)ccc2C)c2ccccc2n1	917720551	RAQGUNJXIMBEOF-UHFFFAOYSA-N	433.511	1.878	50	20	IDGD	
CCOc1ccc(C(=O)NNS(=O)(=O)c2cc(C(=O)O)cc3c2CCC3)cc1OC	917727395	IUUMQWDIIKCNTM-UHFFFAOYSA-N	434.470	1.904	50	20	IDGD	
Cn1c(=O)nc(O)c2cc(C(=O)NNC(=O)c3ccc(F)cc3Br)cnc21	918641611	JLZVZBKVDVWZIH-UHFFFAOYSA-N	436.197	1.011	50	20	IDGD	
CCc1c(C(=O)OCC(=O)NNC(=O)c2ccc(OC)c(OC)c2)[nH]c(C)c1C(C)=O	919518454	KDSIOHLIPRXUJC-UHFFFAOYSA-N	431.445	1.723	50	20	IDGD	
O=C(CCSc1ccc(Br)cc1)NNC(=O)N[C@H]1CCS(=O)(=O)C1	919887536	ADEHTCLORCESTQ-NSHDSACASA-N	436.353	1.449	50	20	IDGD	
Cc1cccc(NC(=S)NNC(=O)c2cc(S(N)(=O)=O)ccc2N2CCOCC2)c1	920213762	OVMPZAVETNKUKQ-UHFFFAOYSA-N	449.558	1.110	50	20	IDGD	
CCOc1c(Br)cc(C=NNC(=O)N[C@H]2CCS(=O)(=O)C2)cc1OC	920381782	UHWWDZIQDVUPOJ-NSHDSACASA-N	434.312	1.677	50	20	IDGD	
O=C(COC(=O)[C@H]1CCCN(CC(F)(F)F)C1)NNC(=O)c1ccc([N+](=O)[O-])cc1	920647038	XWWSYIIWNXNLLO-LBPRGKRZSA-N	432.355	1.173	50	20	IDGD	
O=C(C[C@@H]1SC(N2CCCC2)=NC1=O)Nc1ccc(C(=O)NNC(=O)NC2CC2)cc1	920766752	HXBUOTBCYRPZGC-HNNXBMFYSA-N	444.517	1.215	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)Nc2cccc(CN3C(=O)CNC3=O)c2)cc1OC	920931995	NEKWIFFCKHYMNS-UHFFFAOYSA-N	441.444	1.612	50	20	IDGD	
C[C@@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)c1ccc(CSc2nncn2C)cc1	921299288	NYYYOQBTSFCJDJ-GFCCVEGCSA-N	434.522	1.782	50	20	IDGD	
O=C(Cn1cc(C2CC2)nn1)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	1116266968	XIWKYXXLXQKORF-UHFFFAOYSA-N	446.514	1.479	50	20	IDGD	
C[C@H](CC(=O)NNC(=O)c1ccccc1Cl)NS(=O)(=O)c1cccnc1Cl	1318359603	NYFVXZPYXNURFF-SNVBAGLBSA-N	431.301	1.907	50	20	IDGD	
CNS(=O)(=O)c1ccc(CC(=O)NNC(=O)c2cc(Br)ccc2O)cc1	1323876710	IIYYEDYSGSEBOG-UHFFFAOYSA-N	442.291	1.067	50	20	IDGD	
COC(=O)c1cc(Cl)cc(S(=O)(=O)NNC(=O)c2ccc(OC)cc2)c1OC	1345173806	PNGJTUGLUJJWEP-UHFFFAOYSA-N	428.850	1.767	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(CCN(C(=O)c3cn4cc(F)ccc4n3)C2)C1	1778541251	KYZBIYALHBFBEI-FQEVSTJZSA-N	434.544	1.768	50	20	IDGD	
COCc1c[nH]c(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](Cl)COC)C3)c1	1780050811	UBHHSUFFTMASMU-XAUMDUMWSA-N	427.929	1.542	50	20	IDGD	
Cc1ccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C3)cc1	1780460556	IJWFMNQQBNFDDF-AUSIDOKSSA-N	430.549	1.496	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)ncn1)C2)[C@@H](F)Br	1780770384	LFURLSSLZIZMBV-AXAPSJFSSA-N	431.262	1.000	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)c3cc4n(n3)CCCC4)CCO2)C1	1781229923	LHVJUMFKLNHGLH-RBUKOAKNSA-N	429.348	1.899	50	20	IDGD	
Cc1cccc(/C=C/C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)n1	1781325057	IIJRYTXVSPTXFS-WXFDERKXSA-N	426.286	1.924	50	20	IDGD	
O=C(Cc1cccnc1Cl)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781325693	HMKNDBMXHZIWKM-CZUORRHYSA-N	434.693	1.798	50	20	IDGD	
O=C(c1nccc2nc[nH]c12)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781331483	QWCHQCOIAYRHNJ-CJNGLKHVSA-N	426.246	1.092	50	20	IDGD	
C=C(Oc1ccccc1O)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781331536	RHQSLWNMNNLVEV-MAUKXSAKSA-N	443.269	1.805	50	20	IDGD	
O=C(c1ccc(O)c([N+](=O)[O-])c1)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1781539964	DLAAXAVPAHMVEY-CJNGLKHVSA-N	446.229	1.434	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc([N+](=O)[O-])cc3F)C2)C1	1781554783	HAFBCPNPXMCVQT-DIFFPNOSSA-N	444.257	1.961	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnn3cccnc13)C2	1782175697	PFKKTIWKDFKTML-JXXFODFXSA-N	435.912	1.111	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4nn(C)cc4c3)C2)C1	1782244730	QKXLLASKEVMJAL-YJYMSZOUSA-N	435.322	1.800	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)CCc3cncnc3)CCO2)C1	1783342924	QHMBDTUYZLFMDO-YJBOKZPZSA-N	425.327	1.413	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cnoc3COC)CCO2)C1	1783348304	XXJOXTFQHFZCBM-SUMWQHHRSA-N	430.299	1.438	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)CCn3nc(C)cc3C)CCO2)C1	1783355428	RNPBPBKHDYRCGH-APWZRJJASA-N	441.370	1.893	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H]1Cc3ccccc3CN1)CCO2	1783534003	CPZPZSOZVLSWHJ-NQYLQCIDSA-N	436.350	1.314	50	20	IDGD	
Cc1ccn2ncc(C(=O)N3CCO[C@@]4(CCN(C(=O)[C@@H](C)Br)C4)C3)c2c1	1783534741	OCBDQEJHWNIAFB-AUUYWEPGSA-N	435.322	1.870	50	20	IDGD	
Cc1c(F)cccc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]21	1783738999	QMJUFIFEASQIGE-IEZWGBDMSA-N	434.512	1.100	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(C(F)(F)F)nc3)CCO2)C1	1783877155	VQRIUJGJXHHTJD-DYVFJYSZSA-N	435.830	1.798	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cccc(-c4cnccn4)c3)CCO2)C1	1783883675	XTYRVQSYCNSYRM-GCJKJVERSA-N	444.919	1.841	50	20	IDGD	
CCSc1ncccc1C(=O)N1CCO[C@@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1	1783932706	AHWYMNYATRMVJP-OAQYLSRUSA-N	449.577	1.010	50	20	IDGD	
CN(C)c1cccc(OCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Cl)C[C@@H]32)c1	1785059477	YRTUQDJFPGMISD-UHEFJODHSA-N	427.904	1.646	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)COc3ccccc3)[C@H]2C1	1786485953	PPMNCITXZSVGQM-OTRWWLKZSA-N	425.323	1.829	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3nc(C)no3)[C@H]2C1	1787053595	REZSUMANCFPMQX-FQUUOJAGSA-N	429.315	1.074	50	20	IDGD	
CN(C)c1ncc(C(=O)Nc2ccc(C3(NC(=O)c4ccc(B(O)O)cc4)CCC3)cc2)o1	1787258321	DYOVUPIKGGUZOU-UHFFFAOYSA-N	448.288	1.482	50	20	IDGD	
CC(C)(C)OC(=O)NC(C)(C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]2C1	1787443600	NESBROJUROMJDG-XUXIUFHCSA-N	435.924	1.804	50	20	IDGD	
Cc1c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]3C2)ccc2c1OCCO2	1787445341	BLUZLYZNFJNKNT-WIRVQXDCSA-N	426.872	1.894	50	20	IDGD	
Cc1c(C(=O)Nc2ccc(C3(NC(=O)CCC(=O)NN(C)C)CCC3)cc2)cnn1C	1787512263	OYADJHWUKYKAOL-UHFFFAOYSA-N	426.521	1.849	50	20	IDGD	
Cn1cnc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Cl)C[C@@H]32)c1C(F)(F)F	1787642862	YSZPGBIGBDKIMT-AVWBDOJWSA-N	426.798	1.567	50	20	IDGD	
C[C@H](Cn1cccn1)C(=O)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1	1788140276	RFOQXIIRGDWVJW-QGZVFWFLSA-N	446.316	1.647	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)c1ccc([N+](=O)[O-])[nH]1	1789390083	LYEASZRAMFYTHM-GVXVVHGQSA-N	429.271	1.301	50	20	IDGD	
CCc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]32)cc1	1789624413	BFLWJVQOIGFEPW-UFYCRDLUSA-N	430.549	1.215	50	20	IDGD	
CC1CCN(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]3C2)CC1	1789868189	SCHYMCMHDZPGME-BOSXTWCSSA-N	434.408	1.934	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C/N=C/c3ccco3)C[C@@H]21	1789870519	LCNNSGMTHYHONB-KTQGASMTSA-N	430.332	1.915	50	20	IDGD	
CC(C)N1CCC[C@H]1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21	1791808609	NTACPBKVCAXXKM-QAETUUGQSA-N	430.387	1.624	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3CCN(CC)CC3)[C@H]2C1	1792297255	QSUGZFBDVGBHNB-FJIDUMEYSA-N	444.414	1.872	50	20	IDGD	
COc1ccc([C@H](O)C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Br)C3)cc1	1792716384	UJLMSFRLXVOCFJ-PTNZTPPNSA-N	445.285	1.009	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(S(C)(=O)=O)c1	1792772290	LYGIBVIBLNFLAF-IVSAIRAKSA-N	428.938	1.596	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccn3cncc13)C2	1792870304	BPKFANOJJHENQK-VWPFQQQWSA-N	435.322	1.569	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3cn[nH]c3cn1)C2	1792870758	KRQBRJGBPIFSAQ-VFFTVRQLSA-N	436.310	1.192	50	20	IDGD	
COc1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)c(Cl)c1	1796190682	YDIQMQIRHUXSBQ-BJWYYQGGSA-N	442.708	1.594	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](Br)Cc1ccccc1)C2)[C@@H]1C=CCN1	1796314589	AZVZTKPYACSDNW-PJVZLEMVSA-N	448.361	1.110	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@H](O)C[C@H]1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](F)Cl)C2	1796335399	GIIOVXXJQBHRCG-JLZCTACVSA-N	433.908	1.529	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2c(c1)NC(=O)CO2	1797449416	RDAMOOMCIVZOAG-NXEZDXNNSA-N	435.908	1.628	50	20	IDGD	
CC(C)c1nc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@](C)(Cl)CCl)no1	1799273602	DAPGBHXBBKMZTJ-ABXQLRGKSA-N	433.336	1.561	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@](C)(Cl)CCl)C1	1799278424	GAXMZPNTTSDWMR-YHEOXHNVSA-N	449.375	1.792	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nc(Cl)ccc1F)C2)[C@@H](F)Br	1799344819	WCHMBXTWZUUCLD-LVNATWPUSA-N	438.656	1.768	50	20	IDGD	
Cc1c(F)ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Br)c1N	1799346580	RWNLZODVWRAJKA-ANGCBRKESA-N	432.265	1.610	50	20	IDGD	
Cc1cccn2ncc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@@H](F)Br)C4)c12	1800106610	RLMPQSKRUNOBAB-FAXLKDOZSA-N	439.285	1.536	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1CCC2(CC1)OCCO2	1800380467	HUOSPYIVLNDEBR-IZZQQSIFSA-N	440.613	1.361	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc3ccccc3n1)C2	1800758281	VQDHLRVOSGXWOI-KOFHJDLBSA-N	433.306	1.616	50	20	IDGD	
CC(=O)Nc1ccccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCC(=O)NN(C)C	1802343735	JIIZYFPBIXAYQN-BJWYYQGGSA-N	429.521	1.270	50	20	IDGD	
CC(C)(CCl)C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1802899413	ARQZMXHPQGGYTD-MJGOQNOKSA-N	443.740	1.346	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CCc2cc(F)ccn2)[C@@H]1c1cccnc1)[C@H](O)CCl	1803140274	CAJFAPGDGQAXRC-QKYXUNIQSA-N	434.899	1.854	50	20	IDGD	
Cn1nc(C(=O)NC[C@@H]2CCN(C(=O)CCBr)[C@H]2c2cccnc2)cc1O	1804895002	RMAQVFZAAGEIRC-GUYCJALGSA-N	436.310	1.625	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)c2cccc(=O)n2O)[C@H]1c1cccnc1	1804952403	QZANHNQMTYOHFJ-RVSPLBMKSA-N	449.305	1.584	50	20	IDGD	
CC(C)(F)C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1	1806982141	MCMRRUHNODIROC-YOEHRIQHSA-N	428.468	1.148	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)C(Cl)Cl)[C@@H]1c1cccnc1)c1nc[nH]c1[N+](=O)[O-]	1808370873	INFOFOYVJJEPAD-CMPLNLGQSA-N	427.248	1.836	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)[C@@H](F)c3ccccc3)CC2)C1	1809974891	GJOZLRFLGGQGRL-NRFANRHFSA-N	438.308	1.922	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)c3cnn4ccccc34)CC2)C1	1809978145	NTQVTWDAENMLNU-UHFFFAOYSA-N	446.316	1.173	50	20	IDGD	
CN1CCN(CC(=O)N2CC[C@@H](CNC(=O)C(Cl)Cl)[C@H]2c2cccnc2)CC1	1813077199	DVPLPULXAVTGHJ-DOTOQJQBSA-N	428.364	1.139	50	20	IDGD	
CCS(=O)(=O)N[C@H](C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)C(C)(C)CCl)n[nH]1	1814695620	ZDTZSMVCWMJODJ-OCCSQVGLSA-N	447.989	1.995	50	20	IDGD	
C[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](O)CCl)n[nH]1	1814878066	SUQPDZOUJFDKIU-KWCYVHTRSA-N	443.932	1.915	50	20	IDGD	
Cc1noc(CC(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@H](C)Br)CC3)n1	1815567676	VLJARBJDOHVDII-IONNQARKSA-N	428.312	1.773	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)CSc3ncccn3)sc2C1	1815635979	ZUKWDBPFEWJSSR-WDEREUQCSA-N	441.966	1.891	50	20	IDGD	
Cc1cc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)cnc1C	1816069873	JEWGJBKSRRTUCW-FQEVSTJZSA-N	447.304	1.721	50	20	IDGD	
Cc1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2	1817766941	GCXUXGRJPZSOIE-HNNXBMFYSA-N	436.302	1.066	50	20	IDGD	
C=C[C@@H](O)C(C)(C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1	1819368589	WFYOGWRWVOKFKV-JKSUJKDBSA-N	434.541	1.348	50	20	IDGD	
C[Si](C)(C)OCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCS(C)(=O)=O)[nH]n1	1819597123	IGKFINKMMXUBFQ-AWEZNQCLSA-N	430.603	1.688	50	20	IDGD	
N#Cc1ccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)cc1	1820550088	ISUIVMPWYXXUKK-FQEVSTJZSA-N	443.272	1.581	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3cn(C(C)(C)C)nn3)sc2C1	1821638391	MVUPMRPRQPMIIR-WDEREUQCSA-N	440.957	1.969	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)Cc2ccncc2)[nH]n1	1822415103	BLAKWFXROOMNPA-KRWDZBQOSA-N	427.509	1.413	50	20	IDGD	
CC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](C)N1CCN(C)CC1)CC2	1822849038	FPSYFAQXXJMBAC-HZSPNIEDSA-N	428.002	1.708	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC([C@H]2CCCCN2C(=O)C2(C)COC2)CC1	1823872454	DYPBLNDCRWCGFA-DUYBAWCLSA-N	443.548	1.777	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)Cn2cncn2)CC1	1824094464	WTRCVKFAVHJXFN-GDBMZVCRSA-N	426.359	1.929	50	20	IDGD	
Cc1cc(CC(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)on1	1825016717	XECGWLSPJJIQSW-NRFANRHFSA-N	439.321	1.139	50	20	IDGD	
C[C@H](Cn1cccn1)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1	1825342325	UQJFDBLIXWTBKP-UYAOXDASSA-N	446.596	1.512	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1nccc3nc[nH]c13)CC2	1825998870	NWVNMTVHNPDCSE-VHSXEESVSA-N	434.909	1.894	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(C)n3ccnc3n1)CC2	1826003860	ADHYPULAUVCDJQ-VXGBXAGGSA-N	448.936	1.974	50	20	IDGD	
O=C(c1ncccc1F)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827052223	FPRWJIZTMRTSLC-HXUWFJFHSA-N	439.296	1.448	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnc(O)nc2O)CC1	1827591835	XWVIJVLXUUCEEN-MRXNPFEDSA-N	436.585	1.973	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(C4CC4)on3)CCO2)C1	1830201316	YELVUOMRPWZENA-SGTLLEGYSA-N	442.310	1.405	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CSC3CCCC3)CCO2)C1	1831363067	ACBFAFBROKEAIV-RDTXWAMCSA-N	449.411	1.902	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)c3csnn3)CC2)CC1	1833556174	IZWWIEYKZWJESS-LBPRGKRZSA-N	444.399	1.754	50	20	IDGD	
CCn1nccc1C(=O)NC1CCN(C2CCN(C(=O)CO[Si](C)(C)C)CC2)CC1	1834277247	HDXRVMPZMPUBBM-UHFFFAOYSA-N	435.645	1.940	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)Cc3ccccc3)CC2)CC1	1834488454	LUWXFQWUIVIHLL-UHFFFAOYSA-N	443.592	1.174	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnoc3C3CC3)CCO2)C1	1834617417	PXTFJLIXPYPITF-OALUTQOASA-N	446.331	1.858	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCBr)CCO3)C2)c(F)c1	1834824145	SUDUQTXLUNSMMV-LJQANCHMSA-N	443.313	1.989	50	20	IDGD	
CCC1(C(=O)NC2CCN(C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)CCC1	1835498461	VWVJDSHOWMUSBY-UHFFFAOYSA-N	441.381	1.132	50	20	IDGD	
C[C@H]1CCC[C@H]1C(=O)NC1CCN(C2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1	1835511409	RRJLVGSPHYWDPB-FXAWDEMLSA-N	435.613	1.367	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](F)Cl)CC2)CC1)c1nn[nH]c1C(F)(F)F	1836176040	DLWGJSDITSBBNN-CYBMUJFWSA-N	440.829	1.543	50	20	IDGD	
O=C(c1ccc(O)cc1F)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836718101	QUULYFZCFATQRO-SFHVURJKSA-N	428.888	1.743	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCC(OC2CCN(C(=O)[C@@H]3CNC(=O)O3)CC2)CC1	1836903144	VJNDFVBUENHRMJ-KBXCAEBGSA-N	436.336	1.330	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)c3ncccn3)CC2)CC1	1837503373	QAVXFKNUMIGWRS-ZDUSSCGKSA-N	425.327	1.872	50	20	IDGD	
Cc1nscc1C(=O)N1CCOC[C@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1837712447	RKPMNGBCQWTIST-SFHVURJKSA-N	427.599	1.373	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnccc3Cl)CCO2)C1	1837780882	QALZIPUTVFNZQK-MAUKXSAKSA-N	432.304	1.059	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccnc(OC)c3)CCO2)C1	1837973991	NTGIHHCYOBAJDU-JXFKEZNVSA-N	425.913	1.568	50	20	IDGD	
Cc1ccnc(C(=O)N2CCC(OC3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)c1	1838122507	IOVWVBSWMFDAHM-UHFFFAOYSA-N	445.564	1.375	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(OC)c3)CCO2)C1	1838929575	VVHYLRSLFWREKJ-XLIONFOSSA-N	426.897	1.019	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(F)cnc3Cl)C2)C1	1839145441	HROLRQMCZZGCMK-RDTXWAMCSA-N	434.295	1.962	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)c3ccco3)C2)C1	1839149348	CLYPOBXQQZMWOZ-JCGIZDLHSA-N	435.304	1.006	50	20	IDGD	
Cc1csc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)c1	1839198766	NOZQGAJIDXBSMR-CJNGLKHVSA-N	435.315	1.817	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccccc3-n3nccn3)CCO2)C1	1839381403	RMDBNHLKEHZAQP-DYESRHJHSA-N	447.923	1.355	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(C)cc(F)c3F)CCO2)C1	1839459389	QGWCYHYUQLLIFZ-YWZLYKJASA-N	446.878	1.597	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)OC(C)C)C2)C1	1839965147	OCYZMWCNFCQUQJ-RVKKMQEKSA-N	435.359	1.430	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C=C/c3cnc(C)s3)C2)C1	1840155623	BTZWBUVCYWBHKA-LUODXLFYSA-N	443.953	1.175	50	20	IDGD	
O=C(Cc1ccc2c(c1)CCO2)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840189649	DSVXOZSXYWFIDT-FQEVSTJZSA-N	443.327	1.424	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](CC(=O)N2CC3(CCCN3C(=O)[C@H](O)CCl)C2)C1	1841354541	GLWNQFOQEASXBC-HZPDHXFCSA-N	443.972	1.827	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2cnnc(Cl)c2)C1	1842124364	GYORNHZYCXJXRE-FSJBWODESA-N	429.868	1.081	50	20	IDGD	
CC#CC[C@H](C(=O)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1)c1ccccc1	1843014323	XKWMLXAGEWWZBB-QFIPXVFZSA-N	430.313	1.381	50	20	IDGD	
COc1ccccc1CC(=O)N1CC2(CCCN2C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C1	1843417065	RUZYLHNAQHRXJY-PCLIKHOPSA-N	437.500	1.575	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)Cc1cc[nH]n1)C2	1844693360	WAUBNFWHKXQXJN-UHFFFAOYSA-N	427.417	1.303	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@]2(C[C@@H]2C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](O)CCl)C1	1847564143	RMAIWOVBFDKKDL-UITRFSOLSA-N	441.956	1.435	50	20	IDGD	
Cc1nn(C)c2sc(C(=O)NNC(=O)CCN3CCN(c4ccccc4)CC3)cc12	22079330	SOERIOZMDWVZRW-UHFFFAOYSA-N	426.546	1.917	50	20	IDGD	
CCOCCO[C@H](C)C(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	109051808	DJLZGWCPEVFCAL-CYBMUJFWSA-N	441.531	1.752	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C1CCN(C(=O)/C=C\c2ccccc2)CC1	214022339	BIADLKCJPZZOLR-KUFMOJEASA-N	435.480	1.926	50	20	IDGD	
COc1ccc(C(=O)Nc2ccccc2C(=O)NNC(=O)CNC(=O)c2ccco2)cc1	725739350	CFIBYQJCCSUPEO-UHFFFAOYSA-N	436.424	1.732	50	20	IDGD	
Cc1cc(C(=O)N2CCC[C@H]2C(=O)NNC(=O)COc2ccc(F)cc2)ccc1[N+](=O)[O-]	726522827	YBKTUIGDMAEHJK-SFHVURJKSA-N	444.419	1.873	50	20	IDGD	
COc1ccc(CN2C[C@@H](C(=O)NNC(=O)C(=O)Nc3ccc(C)c(C)c3)CC2=O)cc1	726631249	TXGOLSYCSKGAHM-KRWDZBQOSA-N	438.484	1.447	50	20	IDGD	
CN(C)C(=O)Cn1cc(NC(=O)CCC(=O)C(C#N)=C2N(C)c3ccccc3N2C)cn1	727387706	DUQGICFMANZDKJ-UHFFFAOYSA-N	435.488	1.580	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=S)NCCc2cccnc2)c1	727691894	FBPAOCMCSPDZJP-UHFFFAOYSA-N	435.575	1.464	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NNC(=O)c2nnc(-c3ccccc3)o2)cc1C(=O)O	727719534	CWEYAGRULPBYOO-UHFFFAOYSA-N	432.414	1.457	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)NCC3(N4CCCC4)CCOCC3)n[nH]2)cc1	729622839	BWFRSYDGHDZJRL-UHFFFAOYSA-N	426.521	1.974	50	20	IDGD	
COc1cc(C(=O)NCC(=O)NNC(=O)Cc2ccccc2F)ccc1OC(F)F	731366485	UFMZTAHPGHEFLW-UHFFFAOYSA-N	425.363	1.556	50	20	IDGD	
CC(C)Oc1ccc(NS(=O)(=O)CC(=O)NNc2nc(-c3cccnc3)no2)cc1	732110463	AGKDHDKSBIGVBZ-UHFFFAOYSA-N	432.462	1.804	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)[C@@H](C)N1CCN(c2ccc(F)cc2)CC1	732257687	YJEYGARWJKYXDJ-MRXNPFEDSA-N	430.480	1.571	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)[C@H]1CCCN(C(=O)Cc2ccccc2)C1	734242182	WODVQMLFXMQZQC-KRWDZBQOSA-N	447.536	1.323	50	20	IDGD	
O=C(C[C@@H]1CCc2ccccc21)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	734387584	QNHZGGLAIJCIAB-KRWDZBQOSA-N	443.525	1.589	50	20	IDGD	
COc1ccc([C@H]2[C@H](C(=O)NNC(=O)c3nnc(O)c4ccccc34)CCC(=O)N2C)cc1	734417004	GPMATRJSVZEYCT-XLIONFOSSA-N	449.467	1.715	50	20	IDGD	
Cc1cccc(OCCCC(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)c1	735117537	WACOHZIXJHJMOT-UHFFFAOYSA-N	447.561	1.628	50	20	IDGD	
CCc1ccc(O[C@H](C)C(=O)N2CCN(CC(=O)NNC(=O)c3ccccc3)CC2)cc1	736622018	NKEUMBALNTUPJP-GOSISDBHSA-N	438.528	1.622	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)[C@H]1CCCN(S(=O)(=O)Cc2ccccc2)C1	737629694	VCXKMECTXBUBPX-FQEVSTJZSA-N	445.541	1.593	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1cccc(N(C)C)c1)[C@@H]1CN(Cc2ccccc2)CCO1	741282482	PSPUHWCHBOIVKL-UWJYYQICSA-N	425.533	1.986	50	20	IDGD	
NS(=O)(=O)c1ccc(NC(=O)NNC(=S)Nc2ccc3c(c2)OCCCO3)cc1	741870138	OOZWHQTZRMFWES-UHFFFAOYSA-N	437.503	1.518	50	20	IDGD	
NC(=O)Cn1cc(C(=O)NNC(=O)c2ccc(COc3ccc(Cl)cc3)cc2)nn1	742472909	WSFVWWAPNVJUDL-UHFFFAOYSA-N	428.836	1.071	50	20	IDGD	
Cc1ccc(S(=O)(=O)NNC(=O)NCC2CC2)cc1S(=O)(=O)N1CCCCC1	743257125	QXMWCPIBDSYIRC-UHFFFAOYSA-N	430.552	1.072	50	20	IDGD	
O=C1Cc2cc(S(=O)(=O)NNC(=O)c3cc([N+](=O)[O-])ccc3O)c(Cl)cc2N1	743268846	NGKDICBQUPCXGK-UHFFFAOYSA-N	426.794	1.072	50	20	IDGD	
CC(C)c1ccc(-n2cc(O)c(C(=O)NNC(=O)CNC(=O)c3cccs3)n2)cc1	743330491	ZDQHTLWTFJEBJE-UHFFFAOYSA-N	427.486	1.954	50	20	IDGD	
COc1ccc(CNC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)cc1[N+](=O)[O-]	743543805	KNWFHYSPYHYMBD-UHFFFAOYSA-N	437.434	1.543	50	20	IDGD	
CCc1ccc(N2C[C@H](C(=O)OCC(=O)NNC(=O)c3ccc(C#N)cc3)CC2=O)cc1	744497122	AQXQVKRABKMRCO-GOSISDBHSA-N	434.452	1.478	50	20	IDGD	
C[S@@](=O)CCNC(=O)NNc1ccc(S(=O)(=O)NC2CCCCCCC2)cn1	745848439	NECLWFLJCYWFRZ-HHHXNRCGSA-N	431.584	1.477	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)c2ccc(C(=O)NNC(=O)N3CCOCC3)cc2)cc1	745996104	MXMROLUZTQUTSW-UHFFFAOYSA-N	432.502	1.507	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)c1cc(S(=O)(=O)N2CCCC2)ccc1O	745999220	YOOKVKDIUOCPGC-UHFFFAOYSA-N	433.486	1.155	50	20	IDGD	
CCCCn1c(CCC(=O)NNC(=O)N(C)C)nc2cc(S(=O)(=O)N(C)C)ccc21	746005892	BFWZLAKMEIKUMB-UHFFFAOYSA-N	438.554	1.322	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)NCc1ccccc1S(=O)(=O)N1CCCCC1	747491091	PMILQDGWZAEGGX-UHFFFAOYSA-N	431.518	1.329	50	20	IDGD	
CC(C)Nc1ccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cn1	748013932	YGOIVWOMWAKVQY-UHFFFAOYSA-N	431.518	1.761	50	20	IDGD	
Cc1nn(-c2ccc(Br)cc2)c(C)c1C(=O)NNC(=O)C(=O)N1CCCC1	748239960	OIEIFDKYAYWWBB-UHFFFAOYSA-N	434.294	1.635	50	20	IDGD	
CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)NNC(=O)COc1ccc(C)cc1	749332856	FNXVWGHNZPAZJR-FQEVSTJZSA-N	426.448	1.889	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)NCC(=O)N2CCN(c3ccc(Cl)cc3)CC2)cc1	750334427	ATJIRBUYRFWNRB-UHFFFAOYSA-N	440.891	1.504	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)c1ccc(Cl)c(I)c1	751202781	WOZWUUJKHICJEI-UHFFFAOYSA-N	447.616	1.729	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)c1cccc(CN2C(=O)c3ccccc3C2=O)c1	751207078	QVHJCBFBAONGKI-UHFFFAOYSA-N	446.419	1.267	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)[C@@H]1CC(=O)N(c2cc(OC)cc(OC)c2)C1	752518331	DVHPQBZSJOANTG-MRXNPFEDSA-N	441.484	1.846	50	20	IDGD	
Cn1c(NNC(=O)[C@@H]2CCCCN2S(=O)(=O)c2ccccc2)nc2ccccc2c1=O	752908734	RNJFKPDVUGRECS-SFHVURJKSA-N	441.513	1.620	50	20	IDGD	
C[C@H](NCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)c1nc(-c2cccc(F)c2)no1	755038386	IQEPMLVLQPABMK-NSHDSACASA-N	428.380	1.896	50	20	IDGD	
COc1cc([N+](=O)[O-])ccc1C(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	755369589	RXNMTXJGEPVYJW-UHFFFAOYSA-N	437.453	1.947	50	20	IDGD	
COC(=O)CNC(=O)c1ccc(NC(=O)NNC(=O)CSc2ccc(C)cc2)cc1	755548098	PETVIYKHTSTGKS-UHFFFAOYSA-N	430.486	1.843	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NN=Cc1c(-n2ccnc2)nc2ccccn12	755562195	CVMHXCUSMDRNQZ-UHFFFAOYSA-N	436.501	1.885	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)Nc1cccc(N2CCCS2(=O)=O)c1	755890792	USWAKTBRIPYODB-UHFFFAOYSA-N	434.474	1.467	50	20	IDGD	
Cc1c(CS(C)(=O)=O)cccc1NC(=O)NNC(=O)COc1ccccc1[N+](=O)[O-]	756598592	ULHYNWJTZYLOMA-UHFFFAOYSA-N	436.446	1.680	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)Nc1nc2c(s1)COCC2	756628331	LFXGHCBTEHTKEP-UHFFFAOYSA-N	430.534	1.581	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)NNC(=O)c2scnc2C)cc(S(C)(=O)=O)c1	757609294	RHYPJPNRXAOTIZ-UHFFFAOYSA-N	426.476	1.498	50	20	IDGD	
Cc1nc(C(F)(F)F)ccc1C(=O)N1CCN(S(=O)(=O)CBr)CC1	758526472	CUVLRCQUFJYJDX-UHFFFAOYSA-N	430.246	1.849	50	20	IDGD	
CN(NC(=O)c1ccc(-n2ccnc2)nc1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758782350	RFHKXRNQEBKFAC-UHFFFAOYSA-N	429.481	1.517	50	20	IDGD	
CC1(C)C(=O)N(C[C@](C)(O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)c2ccccc21	760054823	WXUQTSMMWKWCEH-DEOSSOPVSA-N	447.495	1.913	50	20	IDGD	
COc1ccc(-c2nn(CCC#N)cc2/C=C(\C#N)C(=O)N(C)[C@@H]2CCNC2=O)cc1OC	760103093	HTNYCEKPLDWNTL-QIPHDZALSA-N	448.483	1.735	50	20	IDGD	
NC(=O)CC[C@@H](NC(=O)OCc1ccccc1)C(=O)NNC(=O)c1cccc2ncccc12	760131822	DPCVWLOTHNEXTG-LJQANCHMSA-N	449.467	1.556	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)C(=O)Nc1ccnn1Cc1ccc(F)cc1	760279332	MITSQQAXUXWCSV-UHFFFAOYSA-N	429.383	1.375	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc([N+](=O)[O-])c(C(=O)O)c1)c1cccc(C(F)(F)F)c1	760361896	CRWRGVGDTUWKBI-UHFFFAOYSA-N	433.320	1.935	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=S)NCC2CCN(C)CC2)c2ccccc2c1=O	760466703	SJDLBRSNLPLQKN-UHFFFAOYSA-N	430.578	1.647	50	20	IDGD	
COc1ccc2c(c1)OC[C@@H]2CC(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	760620638	WLSQKCDUOAJGOU-DJJJIMSYSA-N	442.424	1.092	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NN=Cc1cnc(C2OCCO2)s1	761828242	MYMPTJTWOWPCPJ-UHFFFAOYSA-N	429.502	1.097	50	20	IDGD	
CCc1noc2ncc(S(=O)(=O)NNC(=O)C(=O)NCc3ccc(Cl)cc3)cc12	762449329	RIERGZZHXDTUPI-UHFFFAOYSA-N	437.865	1.065	50	20	IDGD	
O=C(NNc1nccc(N2CCOCC2)n1)c1cc(I)ccc1F	762851421	ONDQFERZYVHXTK-UHFFFAOYSA-N	443.220	1.814	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)N[C@@H]1CC[C@@H]2SCCS[C@H]21	763064395	SFUADBXDDVQDTE-HBFSDRIKSA-N	449.646	1.909	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)c3cc(C)c4c(O)nc(O)nc4n3)n[nH]2)cc1	763162088	DMIWFACUOKSRPK-UHFFFAOYSA-N	433.428	1.772	50	20	IDGD	
C[C@@H]1NC(C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)=NN(c2ccccc2)C1=O	763174875	ZDMNPCZTYWLKSD-LBPRGKRZSA-N	435.419	1.315	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)c1cccc(S(N)(=O)=O)c1	763453774	NQIGQWNILCGSGC-GFCCVEGCSA-N	443.526	1.030	50	20	IDGD	
CC(C)(C)OC(=O)Cc1ccccc1NC(=O)C(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	763471523	UWJTWTREGDLUPD-UHFFFAOYSA-N	442.428	1.879	50	20	IDGD	
O=C(NNC(=O)c1ccccc1O)C(=O)Nc1cccc(F)c1I	763530188	SFSJPYCGWKUQDW-UHFFFAOYSA-N	443.172	1.536	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)Nc1ccc(OC2CCCC2)cc1	763575609	ZBBGMTIMDPCMBV-LJQANCHMSA-N	425.441	1.934	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1ccc(C(=O)NC2CCCC2)cc1	763629483	MAARZCSTZVSTCN-UHFFFAOYSA-N	448.483	1.715	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2ccc(N3CCOCC3)c(F)c2)c1	763775480	SLPXUUHWYUGNQA-UHFFFAOYSA-N	446.435	1.079	50	20	IDGD	
Cc1c(Cl)cc(F)c(NC(=O)C(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])c1F	763803198	JCYUWLXRJMHRJZ-UHFFFAOYSA-N	442.762	2.000	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccccc2C[S@](C)=O)cc1	763867180	SLCXEWDRXYZINQ-YSVRNHBLSA-N	447.513	1.517	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cccc(C(=O)N(C)C)c2)cc1	763870644	BGFCXAYVZAHOAA-AWEZNQCLSA-N	440.456	1.144	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1cccc(Cn2cncn2)c1	763873836	ZGXJQXMIDRCVDW-CYBMUJFWSA-N	426.408	1.019	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2sc(-c3ccccc3)nc2C)c(OC)n1	763901327	NUTRLVMEEQTCHY-UHFFFAOYSA-N	441.469	1.930	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cncc(Br)c2)cc1OC	763903804	UIGBIEAZDMCWQX-UHFFFAOYSA-N	437.250	1.651	50	20	IDGD	
COC(=O)c1csc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)on2)c1C	764016256	KJWIPDMOPBOEDW-UHFFFAOYSA-N	428.426	1.898	50	20	IDGD	
CCCCNS(=O)(=O)c1cccc(NC(=O)C(=O)NNC(=O)Cc2ccsc2)c1	764033211	ICHMHERSLYJCOR-UHFFFAOYSA-N	438.531	1.155	50	20	IDGD	
CS(=O)(=O)c1ccccc1NC(=O)C(=O)NNC(=O)c1cccc(Br)c1	764058468	JDWJQUKLPSFGEH-UHFFFAOYSA-N	440.275	1.252	50	20	IDGD	
COc1ccc(Cl)c(NC(=O)C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c1	764076643	CZLKBGUFMQOWHB-UHFFFAOYSA-N	425.850	1.152	50	20	IDGD	
C[C@H](c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)cc1)N1CCOCC1	764127081	SUWLAKVASCYOMW-CYBMUJFWSA-N	446.891	1.839	50	20	IDGD	
COC(=O)c1cc(C(C)(C)C)sc1NC(=O)C(=O)NNC(=O)c1cccc(OC)c1O	764132642	OSLGDUHSXWWQTD-UHFFFAOYSA-N	449.485	1.946	50	20	IDGD	
O=C(NNC(=O)c1ccoc1)C(=O)Nc1cc(C(F)(F)F)ccc1N1CCOCC1	764160287	RNRHITCKIODUMK-UHFFFAOYSA-N	426.351	1.535	50	20	IDGD	
O=C(CCc1ccco1)NNC(=O)C(=O)Nc1ccc(N2CCOCC2)c2ccncc12	764172242	SIBUYDGOJCYGFQ-UHFFFAOYSA-N	437.456	1.383	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)C(=O)Nc2cnn(-c3cnc4ccccc4n3)c2)c1	764236418	YEXZSAPXBDKIHD-UHFFFAOYSA-N	426.396	1.087	50	20	IDGD	
COCCn1ncc2ccc(NC(=O)C(=O)NNC(=O)c3cccc(OC(F)F)c3)cc21	764260127	PIRDKQJZWOBHCD-UHFFFAOYSA-N	447.398	1.684	50	20	IDGD	
C[C@H]1C[C@@H](C)CN(C(=O)c2ccccc2NC(=O)C(=O)NNC(=O)Cc2cccnc2)C1	764268641	OBMZJLWXFIJECC-IYBDPMFKSA-N	437.500	1.528	50	20	IDGD	
CN1CCc2ccc(NC(=O)C(=O)NNC(=O)c3cc(F)ccc3Br)cc21	764276506	FIARJXFWDXLCBB-UHFFFAOYSA-N	435.253	1.980	50	20	IDGD	
COCC(=O)NNC(=O)C(=O)Nc1ccc(COc2ccc(Br)cc2)cc1	764302717	GAZZEBWJBVEBAI-UHFFFAOYSA-N	436.262	1.760	50	20	IDGD	
CN(C)c1nc2cc(NC(=O)C(=O)NNC(=O)c3cnn(-c4ccccc4)c3)ccc2o1	764342157	BKWAIVRVBRFDBM-UHFFFAOYSA-N	433.428	1.479	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)C(=O)Nc1cccc(Cn2cccn2)c1	764345222	CWDFHNZXZOHZFO-UHFFFAOYSA-N	429.440	1.517	50	20	IDGD	
C[C@H](c1cccc(NC(=O)C(=O)NNC(=O)COCc2ccccc2)c1)N1CCOCC1	764362304	DAJNIDXWZBHLSR-QGZVFWFLSA-N	440.500	1.383	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)C(=O)Nc1cc(N2CCCC2=O)ccc1Cl	764363957	XOBZAINLPVPWHV-UHFFFAOYSA-N	444.875	1.770	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1ccccc1-c1cc(F)c(F)c(F)c1	764399296	KFIOUHIPLSESDG-LLVKDONJSA-N	439.390	1.908	50	20	IDGD	
CCC(=O)Nc1ccc(Cl)c(NC(=O)C(=O)NNC(=O)c2cncc(NC(C)=O)c2)c1	764432654	IHAKIULAYCBNND-UHFFFAOYSA-N	446.851	1.442	50	20	IDGD	
O=C(NNC(=O)C1(O)CCSCC1)c1ccccc1NS(=O)(=O)c1cccs1	764632594	MTEHYLFLMDGRBK-UHFFFAOYSA-N	441.556	1.568	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNS(=O)(=O)c3cc(C)ccc3C)CC2)cc1	765128996	ZDFPGXGZRQCKGW-UHFFFAOYSA-N	430.574	1.739	50	20	IDGD	
Cc1cc(=O)c(C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)nn1-c1ccccc1	765318660	KWKRFGVAEOJZQP-UHFFFAOYSA-N	429.477	1.607	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](CC(F)F)C(=O)NNC(=O)c1csc(N2CCOCC2)n1	765530126	IXANYXCYDCKRLU-SNVBAGLBSA-N	449.480	1.289	50	20	IDGD	
NC(=O)c1cccc(C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)c1	766662712	CMMPTWBZWOVLGU-UHFFFAOYSA-N	429.908	1.018	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)/C=C/c1ccccc1)C(=O)NNC(=O)c1cc(C)[nH]n1	768277343	JUQDKCARDVJQIO-GDXASINISA-N	437.547	1.191	50	20	IDGD	
CCc1noc(C)c1C(C)=NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1	769820736	MMZREVNNSVRIBZ-UHFFFAOYSA-N	447.561	1.701	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)c2ncccc12	770771765	ORCOVKUDPOPVPK-UHFFFAOYSA-N	446.423	1.534	50	20	IDGD	
Cc1ccn(CC(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)c(=O)c1	770813759	QEZJXKZWXBEXHV-UHFFFAOYSA-N	443.463	1.376	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)[C@@H]3CSCN3C(=O)c3ccc(Cl)cc3)nc21	770970641	BZUKQYWXJQBXDG-LBPRGKRZSA-N	433.881	1.381	50	20	IDGD	
O=C(Cc1ccccc1I)NNC(=O)c1nnc(O)c2ccccc12	771230323	VRVOQKRMVKYNSU-UHFFFAOYSA-N	448.220	1.944	50	20	IDGD	
CCNS(=O)(=O)[C@@H]1CCN(C(=O)/C(C#N)=C\c2cc(C)n(C[C@H]3CCCO3)c2C)C1	771402388	FEGSYTBUHBBMAZ-LDWJFSKOSA-N	434.562	1.731	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)CNC(=O)c1ccc(Br)cc1	771739268	PTRAPWIXDLWKDF-UHFFFAOYSA-N	443.298	1.241	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)O[C@H](C)C(=O)NNC(=O)CC(C)C)cc1	771844615	FBVSXHBXCGKHNW-WBVHZDCISA-N	439.534	1.273	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)C1(S(=O)(=O)c2ccc(Cl)cc2)CCCC1	771974432	KWILUNRFHHFZNH-GFCCVEGCSA-N	430.910	1.916	50	20	IDGD	
O=C(CNC(=O)c1cc2c(s1)CCCC2)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772195771	QUWSTOQWKYPKMU-UHFFFAOYSA-N	448.932	1.474	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)CNC(=O)c2cccnc2)ccc1NC(=O)OC(C)(C)C	772228187	LBYPXROGPWZJMM-UHFFFAOYSA-N	427.461	1.928	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)CCNC(=O)c1ccc([N+](=O)[O-])cc1	772968279	QKHIRZCOCRBKFK-GFCCVEGCSA-N	434.836	1.983	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)ccc1O	773252667	VXDGWOWNCWMPGD-SNVBAGLBSA-N	428.850	1.609	50	20	IDGD	
O=C(CCC1CCCCC1)NNC(=O)C(=O)Nc1cnn(Cc2nnc3n2CCCC3)c1	773541261	HRQRQKBZGZZHDU-UHFFFAOYSA-N	442.524	1.306	50	20	IDGD	
NC(=O)C1CCN(Cc2cccc(NC(=O)C(=O)NNc3ccccc3[N+](=O)[O-])c2)CC1	773653967	NTWYXYCSMJIQIB-UHFFFAOYSA-N	440.460	1.374	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccccc2S(=O)(=O)C(F)F)cc1F	773888360	GOGMJGLYKBKZHE-UHFFFAOYSA-N	429.376	1.530	50	20	IDGD	
O=C(NNC(=O)c1ccn(C(F)F)n1)c1cccc(S(=O)(=O)NCc2ccccc2)c1	775638229	CWJMOMVCVYVINC-UHFFFAOYSA-N	449.439	1.832	50	20	IDGD	
CN(NC(=O)c1nn(C)c(=O)c2ccccc12)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776204080	BDDGLKNGTBWANL-UHFFFAOYSA-N	444.492	1.183	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)CCC(=O)N2CCN(c3ccccc3)CC2)c1	776541486	ZILLPIUXGQVBFN-UHFFFAOYSA-N	430.530	1.662	50	20	IDGD	
COc1ccc(Cn2ccc(NC(=O)C(=O)NNC(=O)c3cccc(OC)c3O)n2)cc1	778712366	GUWLTUQZFIPSOO-UHFFFAOYSA-N	439.428	1.054	50	20	IDGD	
COc1ccnc(NNC(=O)CCc2c(C)nn(-c3ccc(S(N)(=O)=O)cc3)c2C)n1	781072587	LEOSHIJBJHEVHR-UHFFFAOYSA-N	445.505	1.011	50	20	IDGD	
CCOc1cc(N2CCOC(C)(C)C2)ccc1NC(=O)C(=O)NNC(=O)c1cccnc1	782120980	JCVOPFMZSGQTKI-UHFFFAOYSA-N	441.488	1.495	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)N[C@@H]1CCC[C@@H](NC(=O)OC(C)(C)C)C1	782647238	CQRJVWDXLJDUKK-CHWSQXEVSA-N	429.518	1.677	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)cc1)C(=O)Nc1ccc(-n2cccn2)cc1C(F)(F)F	782833010	AYXMCWYCKZUSJG-UHFFFAOYSA-N	433.346	1.996	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)C(=O)Nc1ccc(F)cc1Cl	782897358	NDXCPUDECDSXDW-UHFFFAOYSA-N	441.872	1.480	50	20	IDGD	
Cc1cc(F)ccc1NNC(=O)C(=O)Nc1ccc(C(=O)NCCN2CCOCC2)cc1	783445950	CKNGVHOMPPRYQT-UHFFFAOYSA-N	443.479	1.278	50	20	IDGD	
CN(C)C(=O)C[C@H]1CN(C(=O)C(=O)NNc2nccnc2Cl)c2ccc(Cl)cc21	784777796	LUCZPZAPCPEFCN-JTQLQIEISA-N	437.287	1.835	50	20	IDGD	
CNC(=O)c1cc(NC(=O)C(=O)NNc2ccnc(Br)c2)ccc1Cl	784829545	BVAAKKUXAAHIRE-UHFFFAOYSA-N	426.658	1.939	50	20	IDGD	
O=C(CN1CCOCC1)Nc1ccc(NC(=O)C(=O)NNc2cccnc2Cl)cc1	784842147	MBCXXQLMEUKKCA-UHFFFAOYSA-N	432.868	1.088	50	20	IDGD	
COc1ccc(C(=O)N2CCOCC2)cc1NC(=O)C(=O)NNc1cccnc1Cl	784843340	HKLQUEARMWXXHS-UHFFFAOYSA-N	433.852	1.298	50	20	IDGD	
COC(=O)CN1CCN(c2ccc(NC(=O)C(=O)NNc3ccc(Cl)nc3)cc2)CC1	784871560	OLQFSNCQRRRTDH-UHFFFAOYSA-N	446.895	1.112	50	20	IDGD	
CS(=O)(=O)CCOc1cccc(NC(=O)C(=O)NNc2cc(F)c(F)cc2F)c1	784893158	JXYKUYJQBKJFHT-UHFFFAOYSA-N	431.392	1.609	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@H]1[C@H](C(F)(F)F)[C@H]2CC[C@H]1O2	785443935	MJQSJECYBCEZRP-DDHJBXDOSA-N	434.440	1.405	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)cc1C	789812954	OWATVSDAURINLE-ROUUACIJSA-N	425.441	1.440	50	20	IDGD	
O=C(NNC(=O)c1ccnn1CC(F)F)c1cccc(S(=O)(=O)N2CCCCC2)c1	789867269	PKDUWSOLUWBIQL-UHFFFAOYSA-N	441.460	1.398	50	20	IDGD	
Cc1ccc(CN2CC[C@@H](NC(=O)NNC(=O)CSc3ccccc3O)C2=O)cc1	790700857	KBGGEBMJLCAHPD-MRXNPFEDSA-N	428.514	1.924	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)[C@@](C)(O)Cn1cc(C(F)(F)F)ccc1=O	792027007	FEFWHOZFGPZWIL-SFHVURJKSA-N	437.378	1.035	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)C(=O)Nc2c3c(nn2-c2ccc(Cl)cc2)CCC3)cn1	792267206	WWFMHMKERITJIF-UHFFFAOYSA-N	427.852	1.148	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)cc(-n2cccn2)c1	792349693	ASHFIXDWNNENNA-UHFFFAOYSA-N	445.439	1.671	50	20	IDGD	
COc1c(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cccc1[N+](=O)[O-]	792777539	OSJLPYVDARADOJ-UHFFFAOYSA-N	427.461	1.577	50	20	IDGD	
CC(C)c1[nH]ccc1C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	794810357	QMSMHTZDJJICAQ-UHFFFAOYSA-N	448.545	1.553	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(-n3cccn3)cc2C(F)(F)F)n1	797370079	UCJMKMGURSXLJG-UHFFFAOYSA-N	432.362	1.994	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2cccc(N(C)C)c2)nnn1CCOc1ccc(F)cc1	799857541	QZADZLHUIJIUDO-UHFFFAOYSA-N	426.452	1.945	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)C[C@@H]2COCCN2C(=O)OC(C)(C)C)cc1	803949298	ZLYSLYJSDDZMLJ-MRXNPFEDSA-N	435.477	1.325	50	20	IDGD	
CC(C)(C)OC(=O)NCCc1nc(C(=O)NNc2ccc(-n3ccnc3)nn2)cs1	804953008	XMGISGMHNSXWOF-UHFFFAOYSA-N	430.494	1.943	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(Br)s1)NNc1nccnc1C1CCC1	805463588	FOLHEVAGHKVUCW-UHFFFAOYSA-N	446.352	1.990	50	20	IDGD	
O=C1COc2c(cc(Cl)cc2NC(=O)C(=O)NNc2ccc3c(=O)[nH]ccc3c2)N1	807080685	XQQCUAWCVBSLPJ-UHFFFAOYSA-N	427.804	1.594	50	20	IDGD	
Nc1nc(C2CCCC2)ncc1C(=O)N1CCN(S(=O)(=O)CBr)CC1	807196956	SLSBXANOSVBNKS-UHFFFAOYSA-N	432.344	1.156	50	20	IDGD	
CN1CCN(C(=O)NNC(=O)COc2ccc(C(=O)c3ccc(Cl)cc3)cc2)CC1	807380985	YXUBOAMBVNVXDD-UHFFFAOYSA-N	430.892	1.938	50	20	IDGD	
COc1ccc(-n2c(C)cc(/C=C(\C#N)C(=O)NNC(=O)N3CCN(C)CC3)c2C)cc1	807383162	MUBQUVTWMMELCO-XMHGGMMESA-N	436.516	1.998	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNc2ccc(-n3ccnc3)nn2)cc(OC)c1C(C)C	807428886	JIGOPWKOZPSUOC-UHFFFAOYSA-N	425.449	1.885	50	20	IDGD	
Cn1c(C(C)(C)C)nc2cc(NC(=O)C(=O)NNc3ccc(-n4ccnc4)nn3)ccc21	807429768	XIKPLHOQKBFXKK-UHFFFAOYSA-N	433.476	1.928	50	20	IDGD	
O=C(NC[C@H]1CCCSC1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	807595493	VFDKZQHRKLEXNB-CQSZACIVSA-N	426.564	1.558	50	20	IDGD	
CCOc1ccc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)c3cn(C)nn3)cc2)cc1	808378449	OYHGDECVTYMJLL-UHFFFAOYSA-N	444.473	1.089	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)[C@H]1C[C@H](c2ccccc2)OC1=O	808589272	CVIPQEGFWAAKFV-NVXWUHKLSA-N	446.843	1.957	50	20	IDGD	
N#Cc1cc(O)cc(C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)c1	809725041	IGWDUYUJCLIDKH-UHFFFAOYSA-N	427.892	1.496	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2c[nH]nc2-c2ccccn2)cc1OC	811365707	XSDITPRZIZWFSB-UHFFFAOYSA-N	425.401	1.107	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(=NNC(=O)Cc2cc(O)nc(O)n2)[C@@H]([C@H]2CCOC2)C1	812226853	VEHFWPLJZHPVAP-GXTWGEPZSA-N	435.481	1.196	50	20	IDGD	
COc1ccc(CNC(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)c(OC)n1	812614551	QTPGXOXICIKROG-UHFFFAOYSA-N	440.460	1.534	50	20	IDGD	
Cc1cc(CNC(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)nc(N2CCCC2)n1	813856524	HQEIWERDWPTPFI-UHFFFAOYSA-N	448.553	1.293	50	20	IDGD	
C[C@H](Cc1cnc2ccccc2n1)C(=O)NNC(=O)c1csc(N2CCOCC2)n1	814736124	NLNXQYDAJKSAQU-CYBMUJFWSA-N	426.502	1.563	50	20	IDGD	
CCOc1ccc(NNC(=O)C(=O)Nc2ccc3oc(=O)n(CCN(C)C)c3c2)cc1	815816556	BSDKSAIQWROMJY-UHFFFAOYSA-N	427.461	1.637	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNc2ccc(OCC)cc2)cc(S(C)(=O)=O)c1	815817042	ZQQHUNKNSNDPNE-UHFFFAOYSA-N	449.485	1.747	50	20	IDGD	
CC(C)CNC(=O)N1CCC[C@H](C(=O)NNc2ccccc2S(=O)(=O)N(C)C)C1	817053264	KLAIBRAAOJWCIU-HNNXBMFYSA-N	425.555	1.458	50	20	IDGD	
COc1cccc(/C=C(\C(=O)NNC(=O)c2ccc(OC)c(OC)c2)n2nnnc2C)c1	818011934	FAZUGTIWCAGXAT-GZTJUZNOSA-N	438.444	1.467	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2cnnn2-c2ccccc2)ccc1OC(C)C	821131786	BWYJMPGXNAILPQ-UHFFFAOYSA-N	431.474	1.686	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(Br)c(C(=O)N2CC[C@H](B(O)O)C2)c1	864233526	IMEHDVVYBNTXCV-NSHDSACASA-N	433.133	1.169	50	20	IDGD	
C=CCNC(=S)NNC(=O)CNS(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1	913435446	ARBIKFSAQMSTLB-UHFFFAOYSA-N	430.861	1.318	50	20	IDGD	
CC(C)Cn1nc(C(=O)NNC(=O)Cc2nc3ccccc3n2C)c2ccccc2c1=O	913534435	BEODCQSGXKJAIS-UHFFFAOYSA-N	432.484	1.943	50	20	IDGD	
Cc1nn(-c2ccccc2)c(C)c1CNC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	914598291	XLESUYXUVHCMFA-UHFFFAOYSA-N	431.460	1.609	50	20	IDGD	
CCCn1nc(C(=O)NNS(=O)(=O)c2ccc(CCOC)cc2)c2ccccc2c1=O	914845708	KRHJMVHEUPDPGW-UHFFFAOYSA-N	444.513	1.619	50	20	IDGD	
CC(=NNC(=O)CNc1ccccc1F)c1ccc(S(=O)(=O)N2CCOCC2)cc1	915919316	RCWJMIAKFLZLEQ-UHFFFAOYSA-N	434.493	1.799	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCCCn2cnc3ccccc32)nc1	915926690	NMFDRMQMFMNGFX-UHFFFAOYSA-N	431.522	1.834	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2ccc(-n3cc(C)cn3)cc2)cc1	916112334	VTLZIEAYHLKGMI-UHFFFAOYSA-N	441.513	1.571	50	20	IDGD	
CC(=NNC(=O)c1ccc2c(c1)OCO2)c1ccc(S(=O)(=O)N2CCOCC2)cc1	916289445	QALDRIBWLQTXCR-UHFFFAOYSA-N	431.470	1.590	50	20	IDGD	
CC(=NNC(=O)COc1cc(C)cc(C)c1)c1ccc(S(=O)(=O)NCCC(=O)O)cc1	916296080	PXUMWNMTGVJYKF-UHFFFAOYSA-N	447.513	1.976	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)NCCCn2cncn2)c2ccccc2c1=O	916376472	MCLLTXYDEGPYAG-UHFFFAOYSA-N	426.481	1.213	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc(C)c(C)c(S(=O)(=O)N(C)C)c2)cc1C	916831005	GDMVWYAVQNJTTH-UHFFFAOYSA-N	446.529	1.570	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCc2cn3ccc(C)cc3n2)cc1	918236047	VXMNHKINJGYGKV-UHFFFAOYSA-N	444.517	1.102	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)c2ccc(CN3CCC(CO)CC3)cc2)c2ccccc2c1=O	918758012	UFBVOHXARRTZOL-UHFFFAOYSA-N	449.511	1.213	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNC(=O)c2cc3c(=O)n(C)c(=O)n(C)c3n2C)cc1	919690373	SGZQKPZEQSQZAD-UHFFFAOYSA-N	441.488	1.075	50	20	IDGD	
CNC(=O)NNC(=O)c1cc(S(=O)(=O)NCCOc2ccccc2)ccc1Cl	919879519	KWBFMWYIJOCIPB-UHFFFAOYSA-N	426.882	1.271	50	20	IDGD	
O=C(COc1ccc(-c2ccccc2)cc1Cl)NNC(=O)N[C@H]1CCS(=O)(=O)C1	919886120	UUSKFIKWCWXYPG-HNNXBMFYSA-N	437.905	1.903	50	20	IDGD	
Cc1ccc(-n2ccnc2SCC(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)cc1C	919886425	WTXQGYPTHCVSBH-CQSZACIVSA-N	437.547	1.099	50	20	IDGD	
CCCCN1C(=O)C[C@H](C(=O)NNC(=O)CN2CCCC2=O)[C@H]1c1ccc(OC)cc1	920436259	ZRQXDEGRUQYBGG-LAUBAEHRSA-N	430.505	1.155	50	20	IDGD	
CN1CCN(Cc2cccc(CNC(=O)NNC(=O)c3cncn3-c3ccccc3)c2)CC1	1115974477	UJTGQPZLOBFUJN-UHFFFAOYSA-N	447.543	1.764	50	20	IDGD	
Cc1cc(C)n2ncc(C(=O)NNc3ccccc3S(=O)(=O)N3CCOCC3)c2n1	1116166898	PKPVIBRNCCLVMI-UHFFFAOYSA-N	430.490	1.124	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)N[C@@H]2CCO[C@@]3(CCOC3)C2)c2ccccc2c1=O	1254071326	YZQQLNPOKFRBGL-SZNDQCEHSA-N	429.477	1.260	50	20	IDGD	
COC(=O)[C@H](NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)c1ccccc1Cl	1322962909	WNAZZBQOINCMDD-MRXNPFEDSA-N	425.894	1.739	50	20	IDGD	
Cn1cc(Br)c(C(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)n1	1324967043	CBJJVKMBPIIPHS-UHFFFAOYSA-N	430.303	1.591	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1)NC(=O)OC(C)(C)C	1344378477	QVBWWMKSWPNBAY-ZDUSSCGKSA-N	443.545	1.877	50	20	IDGD	
CO[C@H]1C[C@H](CO[Si](c2ccccc2)(c2ccccc2)C(C)(C)C)[C@H](O)[C@H](O)[C@H]1O	1772820654	BZXXFGFXPPQZBP-GLBNMMOUSA-N	430.617	1.681	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Cl)C2)c1ncn(-c2ccccc2)n1	1778179602	DSGUSJYEYZCDEG-JXXFODFXSA-N	435.887	1.929	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2)c1ccc2nccnc2c1	1778679073	MAQLWQWNZVCEEI-WAOWUJCRSA-N	432.908	1.357	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4ncnn4c3)C2)C1	1778744339	XZQYNMAEYMXMCM-KSSFIOAISA-N	436.310	1.346	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@]2(C1)CN(C(=O)c1n[nH]c3cccc(F)c13)CCO2	1779299833	ZYYIEPHDKNXJCA-FQEVSTJZSA-N	434.544	1.997	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(CN(C(=O)c3cn[nH]c3)CCO2)C1	1780098035	YZKPUIDEBJLIBM-HXUWFJFHSA-N	443.416	1.001	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3nn(C)c(C)c3Br)CCO2)C1	1781219459	ZIFPJEAARQBFRI-SJKOYZFVSA-N	447.761	1.952	50	20	IDGD	
COc1nccc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)c1F	1781330925	IWHCLSFRFZYJPO-WBMJQRKESA-N	434.237	1.363	50	20	IDGD	
O=C(CC12CCCN1CCC2)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781333011	CUHZAJAYSJNPLZ-MAUKXSAKSA-N	432.334	1.525	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)C[C@H](O)CNC(=O)OC(C)(C)C)C2)C1	1781354413	FAVXBHFZUJSFHI-AUSJPIAWSA-N	447.960	1.109	50	20	IDGD	
CC[C@H](CC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2)NC(=O)OC(C)(C)C	1781358880	ATCZFGMDQFBGAC-STXHMFSFSA-N	447.960	1.109	50	20	IDGD	
O=C(Nc1ccc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)cc1)C1CC1	1781465668	WYWATNWVGXJBDW-UTKZUKDTSA-N	435.908	1.078	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccncn1)C2	1781899914	DGDOXYHHBHZEQA-DDUZABMNSA-N	425.327	1.778	50	20	IDGD	
O=C(C(Cl)Cl)N1CCO[C@@]2(CCN(C(=O)[C@H]3CC(c4ccccc4)=NN3)C2)C1	1782608995	WTGKERAMMNKDNW-DNVCBOLYSA-N	425.316	1.386	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3sc(N)nc3C)CCO2)C1	1783342663	MTVMBLBGNBRVFK-ZBEGNZNMSA-N	431.356	1.651	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3c(F)c(C)nn3C)CCO2)C1	1783343110	FNAZPYPJYISEFV-SJKOYZFVSA-N	431.306	1.485	50	20	IDGD	
CC(C)(C)OC(=O)N1CC2(C[C@@H]2C(=O)N2CC[C@]3(CN(C(=O)[C@@H](F)Cl)CCO3)C2)C1	1783448912	CVHKCEZEJNIWRH-ARGWCVDVSA-N	445.919	1.608	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)COCc3ccccc3)CCO2)C1	1783533427	VKUVRSNZTJLSRZ-DNVCBOLYSA-N	425.323	1.817	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(-c4cccnc4)[nH]n3)CCO2)C1	1783536166	FGHQRGAJXJHULX-YJYMSZOUSA-N	448.321	1.699	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)CC34CCCN3CCC4)CCO2)C1	1783538400	VEFNZXQKWYOLSJ-KXBFYZLASA-N	428.371	1.618	50	20	IDGD	
C=C[C@@H](O)C(C)(C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]2C1	1783966254	BSNLNGWRLCFJHT-UVPYHEFZSA-N	431.371	1.570	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CC(=O)OC(C)(C)C)C[C@@H]21	1783970353	XQSWGQQLIQORAP-AJNGGQMLSA-N	447.370	1.729	50	20	IDGD	
C[C@H](Nc1nccs1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21	1787486288	DOYSLCAFTKVFPL-PJSNJIKXSA-N	449.346	1.614	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)c1cnn2cccnc12	1788290636	OVIBDRPVEMWYTC-QEJZJMRPSA-N	436.310	1.108	50	20	IDGD	
C=C[C@@H](O)C(C)(C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)CBr)C[C@@H]21	1788570268	PRJXMRDJZRVWLW-OLMNGRFOSA-N	431.371	1.570	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnn4c3CCC4)[C@H]2C1	1790391038	ZEHWJYWCYJJTBI-QEWYBTABSA-N	439.354	1.596	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)c1ccc2ccnn2c1	1790443928	RVUOHSOLMZFZIM-QCEMKRCNSA-N	439.285	1.618	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)Nc1ccc(C2(NC(=O)C[C@H]3NC(=O)NC3=O)CCC2)cc1	1790489783	YQEUWIRUUAOFDK-FZKQIMNGSA-N	441.315	1.955	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(OC)c(F)c3)C[C@@H]21	1791250906	QSXHWEMVLKRJGN-XSWJXKHESA-N	428.888	1.681	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccccc3-n3nccn3)C[C@@H]21	1791257179	RYZBETRLFLEBTO-XPYUAMARSA-N	447.923	1.114	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](Cl)COC)[C@H]2C1	1791257365	BZFCOYWUMXRPTD-YHQUGGNUSA-N	425.751	1.393	50	20	IDGD	
COCc1oncc1C(=O)NC1(c2ccc(NC(=O)CCC(=O)NN(C)C)cc2)CCC1	1791601687	OBNSKCHBFYPPKD-UHFFFAOYSA-N	443.504	1.942	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(C(N)=O)cc3)[C@H]2C1	1791897850	UREVLTYSWNZFGY-ZKNHNOBHSA-N	442.343	1.615	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CC1CCN(C)CC1	1792602612	GUGIMSUYEDDJAJ-NYCLONFESA-N	430.387	1.339	50	20	IDGD	
COc1ccc([C@@H](C)C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)cc1	1792934486	WYKQNYBXTRAEDH-HUJKARHJSA-N	436.317	1.431	50	20	IDGD	
C[C@H](Sc1ccccc1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc(B(O)O)c1)C2	1793436468	GHMNWIYNAKCVJT-QLIIJSOBSA-N	438.358	1.799	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnoc1C1CC1	1795385837	CSDXESVPZRMGCL-TWXBYECESA-N	438.488	1.938	50	20	IDGD	
O=C([C@H](F)Br)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1(C(F)(F)F)CCC1	1795480318	PFCWCGKPZICJPM-VLEAKVRGSA-N	431.224	1.999	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](COC)NC(=O)OC(C)(C)C	1796841070	ZDTUBTWDVXHCGI-XFIYOXNOSA-N	447.960	1.418	50	20	IDGD	
CN(C)c1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@](C)(Cl)CCl)C3)cn1	1798262522	SZIDRDJYYAJQBM-MVWRLGRASA-N	429.348	1.587	50	20	IDGD	
CN1CCc2cc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@H](F)Br)ccc21	1799347881	WJHQZROCCKRTCF-FSDCSDTHSA-N	440.313	1.573	50	20	IDGD	
COc1cc(C#N)cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Br)c1	1799349301	WFNJWHULWNTOFD-OCVGTWLNSA-N	440.269	1.461	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c(c1)C(=O)CC3)C2	1800761557	AQZZLFXGMUFWEJ-ZKRNXSKHSA-N	435.318	1.802	50	20	IDGD	
N#Cc1ccccc1OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2	1801991456	VYPUGDOXHPDUML-CCWDJLKJSA-N	436.306	1.312	50	20	IDGD	
CCN1CCN(c2ccc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)[C@H](O)CCl)C4)cc2)CC1	1803903195	PKUNKHZFKCZDRH-GFOJFJKKSA-N	448.995	1.680	50	20	IDGD	
Cc1nnc(CCC(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@H]2c2cccnc2)s1	1804554654	GNZCJKWIKKYLQD-DAYGRLMNSA-N	437.953	1.480	50	20	IDGD	
C[C@H](CS(C)(=O)=O)C(=O)N1CCCC2(CCN(C(=O)[C@H](F)Br)CC2)C1	1806046589	MBEGNDCTQHLOII-OLZOCXBDSA-N	441.363	1.589	50	20	IDGD	
Cc1nnc(CC(=O)N2CC[C@@H](CNC(=O)CCBr)[C@@H]2c2cccnc2)o1	1806340934	RHAHNPNXCDIFIQ-KSSFIOAISA-N	436.310	1.807	50	20	IDGD	
Cc1nnc(CC(=O)N2CC[C@H](CNC(=O)CCBr)[C@H]2c2cccnc2)o1	1806340935	RHAHNPNXCDIFIQ-RDTXWAMCSA-N	436.310	1.807	50	20	IDGD	
O=C(CCBr)NC[C@@H]1CCN(C(=O)c2cc(O)ncn2)[C@H]1c1cccnc1	1806341622	DBVQNWFLNVGPOQ-GUYCJALGSA-N	434.294	1.682	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H]2C[C@]2(F)Cl)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807367057	JLTAJVOFFPJZMG-QUJKESNLSA-N	445.687	1.006	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1807372605	GZTXGLDCIPNYPE-YTQUADARSA-N	429.713	1.098	50	20	IDGD	
Cc1ccncc1C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1808791259	HQEJAVKMONBUGT-AVRDEDQJSA-N	438.532	1.478	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)C(=O)Nc2cccnc2)[C@@H]1c1cccnc1	1810466326	YNSLTASVVBWPCK-NJAFHUGGSA-N	445.907	1.375	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2ncccc2F)[C@@H]1c1cccnc1	1811118764	XKGDKDNSTKZPOB-KKSFZXQISA-N	442.495	1.308	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)Cn2cncn2)[C@@H]1c1cccnc1	1812776846	OAAHKVXKBCSQTK-HLLBOEOZSA-N	435.326	1.553	50	20	IDGD	
C[C@@H]1CC[C@H](C(=O)N2CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)O1	1813070395	IXUWBNQQRRRGBU-HVSHLEFESA-N	431.537	1.028	50	20	IDGD	
Cc1ccnc(C(=O)N2CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)c1	1813071301	QWSKINJLMBTLGL-GCJKJVERSA-N	438.532	1.478	50	20	IDGD	
O=C(CCN1CCOCC1)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](F)Br)CC2	1814643364	BVFBZWPFUOEORF-YGRLFVJLSA-N	449.346	1.468	50	20	IDGD	
COc1nccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)[C@H](O)CCl)n[nH]2)c1F	1814870530	VSMDZBNEPIDVMN-QWHCGFSZSA-N	425.848	1.858	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnc[nH]2)n[nH]1	1816419470	WOTJKXAOERRTSR-KWJLSGNOSA-N	437.464	1.573	50	20	IDGD	
Cc1cccc(CC(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)n1	1817470290	OANNJGYPNHKOOG-HXUWFJFHSA-N	447.304	1.342	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H]2C[C@@H]2F)[nH]n1	1818111009	XZTFQQCCJNJFHE-SGZUGYNTSA-N	429.456	1.894	50	20	IDGD	
C[C@H](NC(=O)c1cnccn1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](F)Cl)CC2	1820023199	SCVXONFPEQKIIF-RWEMILLDSA-N	440.888	1.198	50	20	IDGD	
COCc1c[nH]c(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)c1	1820158082	AQFOZRCUXOOANV-KRWDZBQOSA-N	445.524	1.563	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CC[C@@H](N)C(N)=O)[nH]n1	1822088405	UPOCINVNOHUFEG-LOWVWBTDSA-N	443.346	1.168	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2[C@@H]3C=CS[C@@H]23)[nH]n1	1822416363	BQTFFCONSKBMGX-VBBPLHNESA-N	432.550	1.650	50	20	IDGD	
Cc1cc(CC(=O)Nc2cc([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)no1	1822699626	FNGRWAVXYFGFPQ-MRXNPFEDSA-N	431.497	1.314	50	20	IDGD	
CN(CC(=O)N1CCC([C@H]2CCCCN2C(=O)[C@H](O)CCl)CC1)C(=O)c1ccccc1	1824178176	DMDRMLDECDBCBN-WOJBJXKFSA-N	449.979	1.978	50	20	IDGD	
C[C@H](O)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CC2	1825613122	DMNXWZJHOUHEGD-NHCYSSNCSA-N	446.957	1.568	50	20	IDGD	
O=C1CC[C@H](C(=O)N2CCC([C@@H]3CCCCN3C(=O)CCBr)CC2)CN1	1826354476	IAOHHWIZYWICBK-HOTGVXAUSA-N	428.371	1.917	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC([C@H]2CCCCN2C(=O)CC[C@@H](N)C(N)=O)CC1	1826938285	SPQZQFFOMMEKRI-ARFHVFGLSA-N	445.402	1.372	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc3n(n2)CCNC3=O)CC1	1830305468	QRTWBGHFDAFBNC-NVXWUHKLSA-N	435.956	1.877	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)C3(O)CCC3)C2)C1	1830533453	NTMFMGLEMWAZKB-RVKKMQEKSA-N	447.370	1.025	50	20	IDGD	
Cc1cccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)n1	1830921003	CLYFJTITEMXXFQ-WMZOPIPTSA-N	444.301	1.079	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc4c3NC(=O)C4)C2)C1	1831653279	DFNZENHVQXRFGT-VGSWGCGISA-N	449.935	1.659	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CN2C(=O)C=CC2=O)CC1	1831656018	DDNNDWVJBRBQHC-UKRRQHHQSA-N	440.338	1.315	50	20	IDGD	
CCN1CCC(C(=O)N2CCCC[C@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1	1832952945	XRDKXQCXTZJGJK-NRFANRHFSA-N	449.640	1.711	50	20	IDGD	
CC[C@@H](NC(C)=O)C(=O)NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1	1833094955	ZONCSCNBSKWSFL-QGZVFWFLSA-N	445.402	1.258	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCC(N2CCC(NC(=O)CN3CCCC3)CC2)CC1	1833101399	WHLOCBCXEXSAMN-FQEVSTJZSA-N	433.424	1.890	50	20	IDGD	
Cc1cnc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)s1	1833805293	MJFJEFQOZISUTQ-WBMJQRKESA-N	432.340	1.305	50	20	IDGD	
COc1nn(C)cc1C(=O)NC1CCN(C2CCN(C(=O)C(C)(C)CCl)CC2)CC1	1834080877	OLXGCXWQIZQMDL-UHFFFAOYSA-N	439.988	1.879	50	20	IDGD	
CCOC(=O)/C=C/C(=O)NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1834406860	WEKMSUKEDGPHJZ-REMYHPOOSA-N	448.333	1.368	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)C#Cc3ccccc3)CC2)CC1	1834518708	VXORTJBQYOXWPZ-NRFANRHFSA-N	431.964	1.864	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC(N2CCC(NC(=O)c3cnc(N)s3)CC2)CC1	1834766368	ABOCENZRJOYBAZ-UHFFFAOYSA-N	439.658	1.762	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)Cc3ccsc3)C2)C1	1834822400	LEQYWPJQIPGWRU-QGZVFWFLSA-N	431.352	1.532	50	20	IDGD	
COc1ccc(CCC(=O)N2CCO[C@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)cc1	1834849342	BFOPJCCBIQAJON-HXUWFJFHSA-N	445.343	1.888	50	20	IDGD	
O=C(Cc1ccc2ccccc2c1)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1	1834891258	XGLQABNVKSPHQR-NFBKMPQASA-N	446.931	1.438	50	20	IDGD	
CCCC(=O)N[C@@H](C)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](Cl)CC)CC2)CC1	1835820789	QEJCOEWCOWIJOV-YJBOKZPZSA-N	429.005	1.880	50	20	IDGD	
CC(=O)C(C)(C)C(=O)N1CCC(N2CCC(NC(=O)[C@H](F)Br)CC2)CC1	1836413818	QVHCLJPUMYGNKQ-HNNXBMFYSA-N	434.350	1.864	50	20	IDGD	
C[C@@H](C(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)n1ccccc1=O	1836717623	ZCAXVVZBAAORJM-YJBOKZPZSA-N	439.940	1.008	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)CCc3cccs3)C2)C1	1837710329	VPGZHGUSPXIOQP-FQEVSTJZSA-N	440.638	1.989	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3c(C)n[nH]c3C)CCO2)C1	1837808800	XUMOXASTSWXOSH-KDOFPFPSSA-N	443.342	1.270	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)C[C@@](C)(O)CC(=O)O)CC2)CC1	1838637341	SUJMDARYEOZEAP-OXQOHEQNSA-N	432.945	1.618	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)[C@H]3CCCS3)CC2)CC1	1838788881	CGMLCHIXZFOURE-GOSISDBHSA-N	440.610	1.254	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3nccc(OC)c3OC)CCO2)C1	1838841202	KGDXMIOXAGUFKO-VLIAUNLRSA-N	441.912	1.186	50	20	IDGD	
CN(C)c1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)cc1	1838963828	AZMXMPHVIPSDHT-LJQANCHMSA-N	430.332	1.626	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(F)c(F)c3)CCO2)C1	1839010734	DKQDRSGJZHNCOO-IFXJQAMLSA-N	432.851	1.289	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)/C=C/c3ccoc3)C2)C1	1839150267	HHUNZXKDIUPCPX-XVXNLHAJSA-N	431.316	1.986	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)ON=C(C)C)CCO2	1839228278	YCEADPKGTZSCBB-RLFYNMQTSA-N	448.358	1.417	50	20	IDGD	
C=C(C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)Br)C2)C1)C(F)(F)F	1839894577	GKMOVCAIFLGGFS-RISCZKNCSA-N	429.233	1.345	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cscn3)C2)C1	1839964666	YQRHZQBLDFOXPL-RHSMWYFYSA-N	446.367	1.316	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3CCCOC3)C2)C1	1839967107	ANTWLEIBMZFBOF-MPGHIAIKSA-N	433.343	1.043	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CC[C@H](C(=O)N2CCCC23CN(C(=O)[C@@H](O)CCl)C3)C1	1841477128	XJQFHKSJGJESNC-ZNMIVQPWSA-N	429.945	1.483	50	20	IDGD	
O=C([C@H](F)Br)N1CC2(CCCN2C(=O)CCn2c(=O)oc3ccccc32)C1	1841988178	FHCZMZNLEVWWNO-HNNXBMFYSA-N	440.269	1.879	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)c2cnsn2)C1	1842226112	XWDOAZYGGWMWLT-UHFFFAOYSA-N	431.430	1.502	50	20	IDGD	
C[C@H](C(=O)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1)c1ccc(Cl)cc1	1843010304	BDVSUFUHJBVRAA-HNNXBMFYSA-N	426.709	1.641	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)c2csc(-c3cccnc3)n2)C1	1843443731	BVFFEAMEOPPWMY-UHFFFAOYSA-N	448.313	1.016	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)[C@]2(F)CCCCC2(F)F)C1	1843893002	UAQQXOXGGIIOGO-LJQANCHMSA-N	439.438	1.420	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1cncc(C(F)(F)F)c1)C2	1844264639	SKAJEGBEJWFHCT-UHFFFAOYSA-N	448.405	1.230	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)c1cc(O)n(C)n1)C2	1844692141	LRGITGRNOYAVBV-UHFFFAOYSA-N	443.416	1.090	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)Cc1cc(C)no1)C2	1844692190	RUNTZSOEZFCQEL-UHFFFAOYSA-N	442.428	1.876	50	20	IDGD	
C=CCO[C@H](C)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1847815107	WKVUBNGXSUQUIB-UGUYLWEFSA-N	429.945	1.911	50	20	IDGD	
Cc1cc(NC(=O)[C@H](C)SCC(=O)NNC(=S)NCCc2cccs2)no1	11516805	YNDWCHUQYZZANY-NSHDSACASA-N	427.577	1.843	50	20	IDGD	
CC(=O)N[C@H](CC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)c1cccs1	14057425	KRRUBPQNIHQELE-OAHLLOKOSA-N	438.531	1.027	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)CSc2ccc(F)c(F)c2)c1	14841554	DOKHMRKIUPASSG-UHFFFAOYSA-N	429.470	1.768	50	20	IDGD	
CC(=O)N1CCCc2cc(S(=O)(=O)NNC(=O)[C@H]3COc4ccccc4O3)ccc21	15243868	JCKMYVIUDWPXDQ-LJQANCHMSA-N	431.470	1.135	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCCC3)cc2)cc1	16006638	XXDNEWSPLVFVKS-UHFFFAOYSA-N	442.497	1.573	50	20	IDGD	
CSCC[C@@H](C(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)N1C(=O)c2ccccc2C1=O	17329895	MONKJIXVRPTMPH-INIZCTEOSA-N	442.453	1.774	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)CCn2c(=O)[nH]c(=O)c3ccccc32)cc1	18071867	HWIGFVBGLWXKTH-AWEZNQCLSA-N	440.456	1.094	50	20	IDGD	
COC(=O)N(C)c1ccccc1C(=O)OCC(=O)NNC(=O)c1ccc(OC)c(OC)c1	109435873	DGCIISYWXRRPLC-UHFFFAOYSA-N	445.428	1.524	50	20	IDGD	
CCOc1ccc(OCC)c(NC(=S)NNC(=O)CN2C(=O)[C@@H]3CCCC[C@H]3C2=O)c1	727496107	CSMXPYARIQDTQQ-HUUCEWRRSA-N	448.545	1.977	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)c2sc(-c3ccccc3)nc2C)cc1C(N)=O	728170599	HTPQUMUUCCXIIO-UHFFFAOYSA-N	446.510	1.849	50	20	IDGD	
COc1cccc(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)c1OC	728213049	CKXUSLRILZZIPN-UHFFFAOYSA-N	434.518	1.397	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)C(=O)c3ccc(Cl)cc3)cc2)CC1	728214474	PFMVZCMUZHKKPH-UHFFFAOYSA-N	436.921	1.602	50	20	IDGD	
C[C@H]1CCCC[C@]12NC(=O)N(CC(=O)NNc1ccc(S(=O)(=O)C(F)F)cc1)C2=O	728976147	IJQPOKCPZVXLBP-VOJFVSQTSA-N	444.460	1.627	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCCN(C)C(=O)OC(C)(C)C)nc1	729611248	LKPAZIXTQJVLRN-UHFFFAOYSA-N	444.558	1.605	50	20	IDGD	
CS(=O)(=O)c1cc(S(=O)(=O)NNC(=O)Cn2ccc3ccccc32)ccc1F	729667687	VWZROPDNOQNZTA-UHFFFAOYSA-N	425.463	1.194	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)CCC(=O)N2CCC(c3ccccc3)=N2)cn1	729693402	XAOKPXRHQKYGFM-UHFFFAOYSA-N	426.502	1.825	50	20	IDGD	
Cn1cc(NS(=O)(=O)c2ccsc2C(=O)NNC(=O)CCc2ccccc2O)cn1	730033205	VWRCYQLARZNCAF-UHFFFAOYSA-N	449.514	1.382	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)CSc1nncn1-c1cccc(Cl)c1	730778284	MHFQLWVRWOSZBL-UHFFFAOYSA-N	433.877	1.945	50	20	IDGD	
COc1cc(CNC(=O)NNC(=O)Cc2ccccc2F)ccc1OCC(=O)N(C)C	731362850	PIEMJWPYZAYRLM-UHFFFAOYSA-N	432.452	1.374	50	20	IDGD	
CN(c1ccc(CNC(=O)NNC(=O)c2cc(Br)c[nH]2)cc1)S(C)(=O)=O	732235392	BAIVAECHSNWACJ-UHFFFAOYSA-N	444.311	1.317	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)N[C@@H](Cc2ccccc2)CN2CCOCC2)cc1	732476159	ACQRTNVRISXTRA-NRFANRHFSA-N	440.544	1.902	50	20	IDGD	
C[C@H]1C[C@H](C)CC[C@@H]1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	733651374	MTNQKSCPWQNAIA-VKJFTORMSA-N	438.550	1.476	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)[C@H]1CCCN1C(=O)Cc1ccccc1	734239537	RLTABFLCSCADOQ-MRXNPFEDSA-N	433.509	1.075	50	20	IDGD	
COc1ccc(C=NNC(=O)Cc2csc(N3CCOCC3)n2)c(OCC(=O)O)c1	734363250	HGCYIBQQJFOIFS-UHFFFAOYSA-N	434.474	1.145	50	20	IDGD	
O=C(NCCNS(=O)(=O)c1cccc([N+](=O)[O-])c1)NNc1cc(F)c(F)cc1F	734665591	NQEKLCPTTKPKMP-UHFFFAOYSA-N	433.368	1.617	50	20	IDGD	
CNC(=O)c1cncc(/C=C/C(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)c1	734825139	VVUZUHVVOTYRKE-AATRIKPKSA-N	446.508	1.184	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)C2CCN(S(=O)(=O)c3ccc4ccccc4c3)CC2)cn1	735444737	SLGZHUPLEDJZBD-UHFFFAOYSA-N	441.513	1.435	50	20	IDGD	
Cn1cc(N2CC[C@@H](NC(=O)NNC(=O)c3cc(F)ccc3Br)C2=O)cn1	735584700	YAGVGAWVWDZRHR-CYBMUJFWSA-N	439.245	1.071	50	20	IDGD	
NS(=O)(=O)CCCNC(=O)C(=O)Nc1ccccc1S[C@H](Cl)C(F)(F)F	737254142	KLQOITIVZOUOJK-LBPRGKRZSA-N	433.861	1.639	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)c1ccc(S(=O)(=O)N2CCCCC2)cc1	737636660	VHVWXLJPPNOZIS-UHFFFAOYSA-N	431.514	1.839	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)c1cn(-c2cccc(C(F)(F)F)c2)nn1	739547712	XDUDALYUUZOODY-UHFFFAOYSA-N	438.391	1.539	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2cc(F)ccc2O1)c1cccc(S(=O)(=O)N2CCCC2)c1	740634911	PEHNRNZBZBXRDL-SFHVURJKSA-N	433.461	1.375	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCCN(C)C(=O)/C(C#N)=C/c2cc(C#N)n(C)c2C)cc1	742892501	UCHGSCAFGHCKIQ-WOJGMQOQSA-N	425.514	1.858	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)CC1	743808588	YSFUANFFXTZSLN-UHFFFAOYSA-N	440.522	1.890	50	20	IDGD	
CN(CC(=O)NNC(=O)NC1CCCC1)S(=O)(=O)c1ccc(Br)cc1	744053112	BOSOUMYISWXUKA-UHFFFAOYSA-N	433.328	1.343	50	20	IDGD	
C[C@@H]1Cc2ccccc2N1CCNC(=O)NNC(=O)c1csc(N2CCOCC2)n1	744277704	FMNSXUWEXRCQFE-CQSZACIVSA-N	430.534	1.375	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)N2CCN(CC(=O)NNC(=O)c3cccc(C#N)c3)CC2)c1	744406303	BLJWQXAHWLVJEG-GOSISDBHSA-N	449.511	1.239	50	20	IDGD	
COC(=O)COc1ccc(C(C)=NNC(=O)c2sc(N3CCOCC3)nc2C)cc1	744998852	FJRGTVYAFPTSTC-UHFFFAOYSA-N	432.502	1.994	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H]1CCC[C@@H]1C(=O)OCC(=O)NNC(=O)c1ccc(C#N)cc1	745075486	XOWFNMHHNHAEQC-HOTGVXAUSA-N	430.461	1.556	50	20	IDGD	
C[C@@H](CCOc1ccccc1)C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	745765080	NRSCYAPFYUQTPG-HNAYVOBHSA-N	428.441	1.622	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CN2CCC(C(=O)NCC(C)(C)CN(C)C)CC2)cc1	746478328	UPWUXHBEHLUXQM-UHFFFAOYSA-N	431.581	1.172	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCCc2cn3cccc(C)c3n2)c2ccccc2c1=O	746776740	WIKYAZJVYUVHGR-UHFFFAOYSA-N	433.472	1.559	50	20	IDGD	
COC(=O)Cc1cc(=O)n(-c2ccc(C(=O)NNC(=O)c3cccc4cccnc34)cc2)[nH]1	747425463	IZYIGDOVLLTLHF-UHFFFAOYSA-N	445.435	1.504	50	20	IDGD	
CSCC[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)NNC(=O)Cc1ccncc1	747428699	SKKICTKUXXSAIC-INIZCTEOSA-N	431.474	1.231	50	20	IDGD	
COc1ccc(C(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)cc1N1CCNC1=O	747716219	UDMMUJWVYRCESE-UHFFFAOYSA-N	446.847	1.496	50	20	IDGD	
COc1cc(OC)cc(N2CC[C@H](NC(=O)NNC(=O)COc3ccccc3O)C2)c1	748659654	CPDJWXQEEMMEIR-AWEZNQCLSA-N	430.461	1.398	50	20	IDGD	
O=C(COC(=O)CN1C(=O)CCOc2ccccc21)NNC(=O)c1cccc(Cl)c1	749675646	VYYVPEUQWNPDTD-UHFFFAOYSA-N	431.832	1.460	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)[C@@H]2CCCN2Cc2ccc(F)cc2)n1	750503141	NCEGCUVJHXVDEM-INIZCTEOSA-N	434.493	1.488	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)NNC(=O)c2ccc(F)cc2Br)c(C)o1	751354065	NPTPQMOTHRPTJD-UHFFFAOYSA-N	434.243	1.473	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)[C@@H]1CCC[C@@H](C(=O)NNC(=O)c2ncccc2C)C1	752241256	ALBVSKSRJRFBNN-HZPDHXFCSA-N	438.488	1.122	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)c2cc(Cn3cc(Br)cn3)on2)c1O	752287557	XLLDEWKSQPMEEL-UHFFFAOYSA-N	436.222	1.471	50	20	IDGD	
CON(C)S(=O)(=O)c1ccc(NC(=O)NNC(=O)COc2ccc(C)c(C)c2)cc1	755537214	XZBBHDDQLGCNOV-UHFFFAOYSA-N	436.490	1.717	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)Nc1cc(S(=O)(=O)N(C)C(C)C)ccc1C	755961146	YNROXAVCTHXDLU-CQSZACIVSA-N	430.527	1.228	50	20	IDGD	
CC1CCN(S(=O)(=O)Cc2ccccc2CNC(=O)NNC(=O)c2cnn(C)c2)CC1	756744835	KJRUXIMPUGGXLR-UHFFFAOYSA-N	448.549	1.126	50	20	IDGD	
C[C@H]1C[C@@H](C)C[C@]2(C1)NC(=O)N(CC(=O)NNC(=O)[C@@H](C)Oc1ccc(F)cc1)C2=O	756867090	IQUWPPFHCDOYAH-VJAMOUOBSA-N	434.468	1.487	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N1CCO[C@@H]([C@@H]2CCCO2)C1	756916594	RKQVTAMETXOENN-VBNZEHGJSA-N	442.310	1.837	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)[C@@H]2COc3ccccc3O2)ccc1Cl	757472963	LXCJARSCADNGFH-HNNXBMFYSA-N	426.834	1.276	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)Nc1cccc(Cl)n1	757607757	ZJADEXOUZPYVQR-UHFFFAOYSA-N	439.881	1.222	50	20	IDGD	
COC(=O)c1cc(NC(=O)NNC(=O)COc2ccc(C)cc2)cc(S(C)(=O)=O)c1	757673879	MAHIQYMTMYOCDF-UHFFFAOYSA-N	435.458	1.417	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)CS(=O)(=O)Cc2ccc(Br)cc2)nc1	759725766	VDXVPTZQSJSFGP-UHFFFAOYSA-N	442.291	1.689	50	20	IDGD	
CCOC(=O)C[C@H](C)CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	760874344	FJKPKGBAPHGNCN-AWEZNQCLSA-N	440.522	1.004	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3c(C)nc4ccnn4c3C)n[nH]2)cc1OC	763148703	MSWLIOIWXKNKKM-UHFFFAOYSA-N	435.444	1.828	50	20	IDGD	
CC(C)(C)c1nnc(NC(=O)C(=O)NNC(=O)c2ccccc2Br)s1	763482061	DKGSTKFTEBEXKF-UHFFFAOYSA-N	426.296	1.998	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccccc2C(=O)N2CCCC2)cc1OC	763551705	ZLYQJDWMYPVWMI-UHFFFAOYSA-N	440.456	1.340	50	20	IDGD	
CCc1nnc(-c2cccc(NC(=O)C(=O)NNC(=O)[C@@H]3COc4ccccc4O3)c2)o1	763577597	HZOAREPIWCTLDD-INIZCTEOSA-N	437.412	1.225	50	20	IDGD	
Cc1nc(Br)ccc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccccc2)[nH]n1	763613170	JMHXBRWJEPGXIP-UHFFFAOYSA-N	443.261	1.942	50	20	IDGD	
COC(=O)c1cc2cc(NC(=O)C(=O)NNC(=O)COc3ccccc3OC)ccc2o1	763656894	JBIJDXTUOLKJPW-UHFFFAOYSA-N	441.396	1.393	50	20	IDGD	
COc1ccc(OC(C)C)c(NC(=O)C(=O)NNC(=O)COc2ccccc2OC)c1	763662378	HHSGMFKCFOFMOF-UHFFFAOYSA-N	431.445	1.656	50	20	IDGD	
CCS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C)c(C)c2)cc1	763667844	VYIBVYUVEQBIQJ-UHFFFAOYSA-N	433.486	1.262	50	20	IDGD	
COC(=O)N(C)c1ccc(NC(=O)C(=O)NNC(=O)COc2cc(C)ccc2C)cc1	763668433	MBFUUYZEDQMGDW-UHFFFAOYSA-N	428.445	1.671	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)COc2ccccc2F)cccc1N1CCOC1=O	763678628	FOLBITXZOBDNQS-UHFFFAOYSA-N	430.392	1.256	50	20	IDGD	
COC(=O)[C@H]1CN(C(=O)C(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)c2ccccc2O1	763726828	BEZKHKMFMQHCHC-MRJKMQNQSA-N	441.484	1.317	50	20	IDGD	
CC(=O)N1CCN(Cc2ccc(NC(=O)C(=O)NNC(=O)c3ccccc3C)cc2)CC1	763959812	JRAKSBOTSXMFGL-UHFFFAOYSA-N	437.500	1.059	50	20	IDGD	
O=C(NNC(=O)c1cc2c(s1)CCCCC2)C(=O)Nc1cccnc1N1CCOCC1	763967765	GOMYFNCBOUDCBD-UHFFFAOYSA-N	443.529	1.648	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cccc(OC)c2O)nc1I	763984647	YAWRVYMYNHHROF-UHFFFAOYSA-N	443.197	1.484	50	20	IDGD	
Cc1nnnn1[C@H](Cc1cccc(F)c1)C(=O)NNC(=O)CSc1ccccc1O	764043859	YRPNDILLPLRKEW-OAHLLOKOSA-N	430.465	1.550	50	20	IDGD	
Cc1cn(C2CCCCC2)nc1NC(=O)C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	764076596	CDLDVNYEESJPSN-UHFFFAOYSA-N	447.517	1.500	50	20	IDGD	
CC[C@@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(CN2CCN(c3ccccn3)CC2)cc1	764083375	QYLLWTSJPSOBRZ-QGZVFWFLSA-N	438.532	1.536	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)nc2)cc1N1CCCCC1=O	764099844	UEEAAWFNKOYQNS-UHFFFAOYSA-N	445.863	1.660	50	20	IDGD	
CCN1CCN(c2ccc(NC(=O)C(=O)NNC(=O)c3ccc(Cl)cc3O)cc2)CC1	764126204	FKFLAZYIYAVUDG-UHFFFAOYSA-N	445.907	1.587	50	20	IDGD	
COc1ccc(C(=O)N([C@H]2CCS(=O)(=O)C2)N(C)C)cc1I	764230101	NHFOXFBZENAXOH-NSHDSACASA-N	438.287	1.406	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)C(=O)Nc1cccc(CSC2CCOCC2)c1	764268790	QCZOFLRRBZUPLC-UHFFFAOYSA-N	428.514	1.822	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2O)n(-c2ccc(Cl)cc2)n1	764275763	UBWWQAMQAZKTQJ-UHFFFAOYSA-N	443.847	1.705	50	20	IDGD	
CCCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)Cc2ccccc2F)cc1Cl	764320904	NNBFIGGEGJZIBS-UHFFFAOYSA-N	434.855	1.948	50	20	IDGD	
CCOC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)cc1	764401165	MVSONFIHIBKKHQ-UHFFFAOYSA-N	432.458	1.839	50	20	IDGD	
C=CCNC(=S)NNC(=O)CSc1nnc(-c2cccnc2)n1Cc1ccco1	765383981	BMTFHFIABRYLBT-UHFFFAOYSA-N	429.531	1.755	50	20	IDGD	
COc1ccc(C(=O)NCC(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)cc1OC	765606828	FZWXDSYJWOVIPJ-UHFFFAOYSA-N	441.419	1.424	50	20	IDGD	
CNC(=O)Cn1nc(NC(=O)C(=O)NNc2c(Cl)cc(Cl)cc2Cl)cc1C	766262393	ZGPPUHARHCSZCF-UHFFFAOYSA-N	433.683	1.980	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)CNC(=O)CNC(=O)OC(C)(C)C	766756067	CLFXYBBZUFFNRX-UHFFFAOYSA-N	447.517	1.520	50	20	IDGD	
O=C(NNC(=O)[C@H]1CC(=O)N(c2ccc(Cl)c(F)c2)C1)c1ccc(-n2cnnn2)cc1	766757109	GGADEZZNQMOXSA-LBPRGKRZSA-N	443.826	1.269	50	20	IDGD	
COC(=O)c1ccsc1N1CC[C@@H](NC(=O)NNc2ncnc3ccsc23)C1=O	767067838	WFCYTQFDPPNXSD-LLVKDONJSA-N	432.487	1.971	50	20	IDGD	
CC(C)(C)S(=O)(=O)CC(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1	767353542	VTIDZMYLECZZQJ-HXUWFJFHSA-N	443.569	1.974	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)CSc1nnc(N2CCOCC2)n1CC(C)C	768286303	OPLBOZXXKQCZPJ-UHFFFAOYSA-N	446.577	1.561	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NC[C@@]2(C)CCO[C@H]2C2CC2)cc1	768529183	OPJGOWJTSWHOSP-AZUAARDMSA-N	438.550	1.151	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)[C@@H](C)CS(=O)(=O)c1ccc(F)cc1	768641204	NVDDSGNYTOFKJG-LBPRGKRZSA-N	444.506	1.791	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)c1ccnc(CNC(=O)OC(C)(C)C)c1	768691318	SLXZLAUBEAGQKI-UHFFFAOYSA-N	429.477	1.988	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)[C@H]2CCN(C(=O)OCc3ccccc3)C2)nc2ccccc21	770111973	XEPJWONHCKZYLE-KRWDZBQOSA-N	435.484	1.922	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCN(C(=O)OCc2ccccc2)C1)c1nn(-c2ccccc2)cc1O	770132212	PGLWUADBAFGFAJ-KRWDZBQOSA-N	449.467	1.998	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cc(COC(C)(C)C)on3)CC2)cc1	770248175	XJRMRPYCESUFSP-UHFFFAOYSA-N	443.548	1.877	50	20	IDGD	
COc1ccc(C)cc1N1C[C@@H](C(=O)NNC(=O)c2ccc3c(c2)OCCO3)CC1=O	770406000	DJCRQWDXKJBAIU-HNNXBMFYSA-N	425.441	1.589	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)[C@@H]3CCN(c4cccc(Br)c4)C3=O)nc21	770980560	QSWJKANCFAGJJW-NSHDSACASA-N	446.265	1.328	50	20	IDGD	
COc1ccccc1[C@@]1(C)NC(=O)N(CC(=O)NNC(=O)c2cc3c(s2)CCC3)C1=O	771228601	MUFOKLMREAVSTN-OAQYLSRUSA-N	442.497	1.474	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)N2CCO[C@H](CN3C(=O)c4ccccc4C3=O)C2)cc(C#N)n1C	771790423	HDBPCALQGIIGOS-VZZQTLFRSA-N	443.463	1.636	50	20	IDGD	
O=C(CN1CCC[C@@H](c2nnc3n2CCCCC3)C1)NNC(=O)c1ccc([N+](=O)[O-])cc1	771791512	PUAFIDUKEUGOMQ-MRXNPFEDSA-N	441.492	1.553	50	20	IDGD	
COC(=O)c1ccc(C(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)c(F)c1	773033586	MMIRHLRQUWJVKC-UHFFFAOYSA-N	438.456	1.956	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)C(=O)Nc1ccc(Br)cn1	773553219	RDOCMWWNXMVVRQ-UHFFFAOYSA-N	425.264	1.428	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNc2c(F)cccc2F)ccc1S(=O)(=O)N(C)C	773714116	PVHYDPOCDIXTAH-UHFFFAOYSA-N	428.417	1.306	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)cc1	774010248	WUODQZJKFFSVSF-CYBMUJFWSA-N	435.864	1.919	50	20	IDGD	
Cc1nn(Cc2ccc(C(=O)NNC(=O)CNC(=O)OC(C)(C)C)cc2)c(C)c1[N+](=O)[O-]	778445367	KFVKJPVGTRKFFQ-UHFFFAOYSA-N	446.464	1.742	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@H]1CCN1C(=O)OC(C)(C)C	780174129	VRIRROLWSSNFOP-GFCCVEGCSA-N	425.511	1.059	50	20	IDGD	
COc1ccc(CN(CC(=O)NNC(=O)c2ccc(F)cc2)[C@H]2CCS(=O)(=O)C2)cc1	781349740	XOEWFSHSDHWCQC-SFHVURJKSA-N	449.504	1.285	50	20	IDGD	
O=C(NNc1cncc(Cl)n1)C(=O)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1	783266127	OWUJXONBFVMEDE-OAHLLOKOSA-N	440.895	1.855	50	20	IDGD	
Cn1c(=NNC(=O)C(=O)Nc2ccc(CN3C(=O)CCC3=O)cc2)sc2ccccc21	783350355	XVDQHTLPEYOXRY-UHFFFAOYSA-N	437.481	1.459	50	20	IDGD	
Cc1cc(C)cc(NNC(=O)C(=O)Nc2cc(C3CC3)nn2[C@H]2CCS(=O)(=O)C2)c1	783362045	JSXXSRNTPONWAC-INIZCTEOSA-N	431.518	1.819	50	20	IDGD	
CCOCCOc1c(Cl)cccc1NC(=O)C(=O)NNc1ccc(-n2cccn2)nn1	783437086	SBIWRTLHPFDURU-UHFFFAOYSA-N	445.867	1.813	50	20	IDGD	
CC1(C)CC(C)(C)c2cc(NC(=O)C(=O)NNC(=O)CNC(=O)c3ccco3)ccc21	784002900	WSZZIWXTVNRZHJ-UHFFFAOYSA-N	426.473	1.754	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1cc(Cl)cc2cccnc12	784003301	DQHNSTWQMFHAFV-UHFFFAOYSA-N	431.861	1.466	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)F)cc1)C(=O)Nc1ccccc1-n1cncn1	784836430	XIHUXZCXSBAZQK-UHFFFAOYSA-N	436.400	1.345	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1cccc(N2CCCC2)c1	785330102	DZAWHKGVVWGUGE-UHFFFAOYSA-N	432.502	1.781	50	20	IDGD	
CCOC(CCNC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)OCC	786908137	SSHCLIUYCHKWON-UHFFFAOYSA-N	442.538	1.204	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)NNC(=O)[C@@H]1CCCCN1C(=O)c1ccc(O)nn1	787429091	ORVHLQLGGKOPOP-HNNXBMFYSA-N	432.868	1.361	50	20	IDGD	
CCNC(=O)Nc1ccc(C)c(NC(=O)C(=O)NNC(=O)COc2cc(C)cc(C)c2)c1	787541350	PKRWUQIIZLFLMH-UHFFFAOYSA-N	441.488	1.918	50	20	IDGD	
Cc1ccc(N2CCNC2=O)cc1NC(=O)C(=O)NNC(=O)Cn1ccc2ccccc21	787542584	OGCFRSCSJIBKBG-UHFFFAOYSA-N	434.456	1.265	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2cc(-c3ccc(Cl)s3)nn2C)n1	787543306	HMASACGTSZXYNU-UHFFFAOYSA-N	435.897	1.401	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN(C)[C@H]1CCN(Cc2ccccc2)C1=O	789527719	DWRFRKVBZYLGIM-SFHVURJKSA-N	444.919	1.843	50	20	IDGD	
CCN(C(=O)OC(C)(C)C)[C@H](C)CNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1	792311372	QPCIBCQJZGKOMK-OAHLLOKOSA-N	449.556	1.669	50	20	IDGD	
CC(C)Cc1ncc(NC(=O)C(=O)NNC(=O)c2ccc(F)cc2Br)cn1	792352745	IQSHLZJLJJYDSO-UHFFFAOYSA-N	438.257	1.976	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)N(CC(F)F)CCS2	793024171	CELHXRYRKFKUEB-LLVKDONJSA-N	446.476	1.001	50	20	IDGD	
CC(C)(C)c1ccc(NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)cc1[N+](=O)[O-]	793027274	ZKSZPPJRURXNNS-QGZVFWFLSA-N	426.429	1.982	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)[C@]1(F)CCN(C(=O)OC(C)(C)C)C1	795168047	FWQFYOYBORLVOA-SFHVURJKSA-N	430.502	1.729	50	20	IDGD	
CNC(=O)COc1ccc(NC(=O)C(=O)NNc2ccc(Br)nc2)c(C)c1	797076348	BNWMNABXQQAUQU-UHFFFAOYSA-N	436.266	1.359	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@@H]2C(=O)NNC(=O)CSc2ccccc2O)cc1	798987550	ZKSPFFCHNGILOZ-MRXNPFEDSA-N	429.498	1.945	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)N(C)[C@@H](C)c1ccc(S(N)(=O)=O)cc1	799856494	GKCQWUUVOQUYHA-ZDUSSCGKSA-N	430.490	1.338	50	20	IDGD	
Cc1cn(-c2ccc(F)cc2)nc1C(=O)NNC(=O)c1sc(N2CCOCC2)nc1C	801104250	GNXBGLCLSNAEAC-UHFFFAOYSA-N	444.492	1.996	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN[C@@H]2CCN(C(=O)OC(C)(C)C)CC2(C)C)n1	801584592	FRYDESUGPPPFCA-CQSZACIVSA-N	439.582	1.767	50	20	IDGD	
O=C(CCN1C(=O)[C@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O)NNC(=O)Nc1ccc(Cl)cc1Cl	802086318	AWSMEADTMLMRTD-UXOAXIEHSA-N	441.271	1.699	50	20	IDGD	
NC(=O)c1ccc(/C=C\C(=O)N2CCC[C@@H]2C(=O)NNc2ccc3c(=O)[nH]ccc3c2)cc1	803430886	NJBOAFSYPCOLBP-CSBXVMIQSA-N	445.479	1.775	50	20	IDGD	
O=C(N[C@@H](Cc1ccccc1)C(=O)NNc1ccc(-n2ccnc2)nn1)c1cccnc1	804952080	IHCUCQTZDJUULS-SFHVURJKSA-N	428.456	1.542	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)N2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)c1	805067293	OKMJRTIXEQAVFA-JOCHJYFZSA-N	432.528	1.805	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)Nc2ccc(S(=O)(=O)[C@H](C)C#N)cc2)c1	806459480	VNSMVEOMFGYRKB-GFCCVEGCSA-N	432.458	1.856	50	20	IDGD	
CS(=O)(=O)N1CCc2c(NC(=O)C(=O)NNc3nccnc3C3CCC3)cccc21	807460266	MJBIJWSYQYDEIX-UHFFFAOYSA-N	430.490	1.148	50	20	IDGD	
NS(=O)(=O)c1cc(C=NNC(=O)COc2ccc(Br)cc2)ccc1F	807950581	USWZHNGPVXLITN-UHFFFAOYSA-N	430.255	1.765	50	20	IDGD	
O=C(NNC(=O)N1CCC[C@@H](CNS(=O)(=O)C2CC2)C1)c1cccc2ccccc12	808273685	FLSSXAXJQLCJEB-HNNXBMFYSA-N	430.530	1.988	50	20	IDGD	
O=C(NNC(=O)c1ccc(F)cc1Br)C(=O)Nc1cccc2c1COC2=O	808934589	MKWGZTUQUGYRGK-UHFFFAOYSA-N	436.193	1.658	50	20	IDGD	
N#Cc1ccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1F	810254025	HQCHJJQQRTZXQM-UHFFFAOYSA-N	447.448	1.185	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)CNS(=O)(=O)c1ccccc1F	810793370	WVJQHOLCEUCOBG-UHFFFAOYSA-N	427.479	1.052	50	20	IDGD	
CN1C(=C(C#N)C(=O)COC(=O)c2c(Br)nnn2C)N(C)c2ccccc21	811451129	ZBQPOXRARFUGKM-UHFFFAOYSA-N	431.250	1.625	50	20	IDGD	
CC(=NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1)c1cccc(N2CCOCC2)c1	812395672	FSWFWQLHEHFBGY-UHFFFAOYSA-N	444.557	1.993	50	20	IDGD	
COC(=O)c1cn(-c2cccc(NC(=O)C(=O)NNc3nc4ccccc4cc3C)c2)nn1	812986698	ACFMRJMBKUIDTI-UHFFFAOYSA-N	445.439	1.992	50	20	IDGD	
O=C(CSc1ccccc1O)NN=Cc1c(N2CCOCC2)nc2ccccn2c1=O	814969431	JVYHILLRQVCBQM-UHFFFAOYSA-N	439.497	1.479	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)Cc2ccccc2F)cc1)[C@H]1C[C@H]1C	815569383	QYIHZFQDAVMSMB-YJYMSZOUSA-N	426.448	1.916	50	20	IDGD	
O=C(NNc1ncc(F)cn1)C(=O)Nc1ccc2c(c1)N(C(=O)Cc1ccccc1)CC2	815604665	XEYQOEYYFKCWHR-UHFFFAOYSA-N	434.431	1.829	50	20	IDGD	
CCOc1ccc(-n2c(C)cc(/C=C(\C#N)C(=O)NCC(=O)NCC(=O)OC)c2C)cc1	819577946	VRONKUGJRZLCBP-WOJGMQOQSA-N	438.484	1.805	50	20	IDGD	
C=CCn1c(SCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)nnc1-c1ccncc1	824970271	XYPJHHVFECNLBM-UHFFFAOYSA-N	439.457	1.988	50	20	IDGD	
CN1CC[C@@H](C(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)CC1=O	906969620	KQYWTFATHHOXGZ-GFCCVEGCSA-N	436.515	1.178	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)CN2C(=O)N[C@@]3(CCc4ccccc43)C2=O)c(C)c1	913164903	YVPSGVHPVNKJQK-HSZRJFAPSA-N	435.484	1.256	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)N2CCN(Cc3nc(N)c4ccccc4n3)CC2)cc(C#N)n1C	914503514	RUWBEEUVZUMHFH-WQRHYEAKSA-N	440.511	1.982	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN1C(=O)c1ccc(Cl)c(Cl)c1)[C@@H]1CCS(=O)(=O)C1	914719809	RUWNUORWFTVRAB-BXUZGUMPSA-N	448.328	1.180	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)CN1C(=O)c2ccccc2N2C(=O)CC[C@]12C	914830558	FMAJFCSGUMUZAP-HSZRJFAPSA-N	446.467	1.403	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)[C@@H]2CCCN(C(=O)C3CC3)C2)c2ccccc2c1=O	915263107	OJYZIOOIYOATMP-OAHLLOKOSA-N	425.489	1.216	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCc2ccc(-n3ccnc3)nc2)nc1	916236790	ZAGHAXJPGJLBGK-UHFFFAOYSA-N	444.521	1.519	50	20	IDGD	
Cc1nc2sccn2c1C=NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	916259044	UKPLVADLYGMKCA-UHFFFAOYSA-N	433.515	1.489	50	20	IDGD	
CC(=NNC(=O)COc1ccc(F)cc1)c1ccc(S(=O)(=O)N2CCNCC2)cc1	916331054	DRTYIHWWBGDRGK-UHFFFAOYSA-N	434.493	1.339	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NCc2ccc(N3CCO[C@H](C)C3)nc2)cc1C	916393293	XMKNNDMTOLCQSG-QGZVFWFLSA-N	427.505	1.833	50	20	IDGD	
COc1cc(CNC(=O)NNC(=O)c2ccc(Cl)cc2OC)ccc1OCC(N)=O	916641097	WSXOTWBCFBEEGG-UHFFFAOYSA-N	436.852	1.366	50	20	IDGD	
O=C(NNC(=O)c1cc(F)cc2nccnc12)c1cccc(S(=O)(=O)N2CCCC2)c1	917519524	NEMUSAVUQAWBHQ-UHFFFAOYSA-N	443.460	1.628	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNS(=O)(=O)c2ccc([C@@H](C)NC(C)=O)s2)c1	918399566	QCWSRBJVVIAQTH-SNVBAGLBSA-N	427.504	1.586	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@@H](C)NC(=O)OCc1ccccc1	920259658	KLPQMLLSNYLUDU-CQSZACIVSA-N	447.517	1.364	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)Nc1cccc(CN2C(=O)CNC2=O)c1	920933563	WNWXNWUNPLKKKR-GFCCVEGCSA-N	429.408	1.498	50	20	IDGD	
Cc1ccc(-n2cc(C(=O)NNC(=O)C3CCN(C(=O)OC(C)(C)C)CC3)nn2)cc1	1322956519	CNMVECMAUAKUHV-UHFFFAOYSA-N	428.493	1.984	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCc2cccc(CN3CCN(C)CC3)c2)cc1OC	1338477317	NYMSVEHPSRQRMK-UHFFFAOYSA-N	441.532	1.595	50	20	IDGD	
Cc1ccc2oc(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)[C@H](O)CCl)C4)cc2n1	1777716836	MLCNPOZSOROAPX-FQELHTAISA-N	435.908	1.863	50	20	IDGD	
CCn1nc(C)cc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](Cl)COC)C2	1777845981	OKWFNTFUDFQSTK-WRWLIDTKSA-N	426.945	1.593	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnc4[nH]ncc4c3)C2)C1	1778413319	OYNTWBSSUHWBDW-KPZWWZAWSA-N	436.310	1.432	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)Cc2cc(C)[nH]n2)C1	1779464793	OPDAMINZFKMCEL-FRQCXROJSA-N	441.370	1.948	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(-c4ccncc4)[nH]n3)C2)C1	1779593807	WFUQPAYLWHXWPD-FOIQADDNSA-N	433.896	1.169	50	20	IDGD	
COc1cc(C(=O)N2CC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)c([N+](=O)[O-])cc1O	1780198380	XLHPRGHVSVRYHS-QGZVFWFLSA-N	448.259	1.556	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1ncccn1)C2)[C@H](F)Br	1780770999	OVIVSRXPMJITBS-ISTRZQFTSA-N	429.290	1.224	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)c3cccn4c(O)nnc34)CCO2)C1	1781227572	MUYOQIYCBSIQMF-ROUUACIJSA-N	442.303	1.115	50	20	IDGD	
O=C(COc1ccc(F)cc1)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781328654	VJBZZEAYWAEZEP-WBVHZDCISA-N	433.249	1.725	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(CCN(C(=O)c3c(O)cc(O)cc3O)C2)C1	1781812790	RTYRJQSGQXANKK-KRWDZBQOSA-N	429.267	1.032	50	20	IDGD	
C#CC(=O)N1CC[C@]2(C1)CN(C(=O)/C(C#N)=C/c1ccc(Br)cc1)CCO2	1783055047	LUMQDWGURVNBNC-PRDNPTHXSA-N	428.286	1.819	50	20	IDGD	
Cc1nc(CC(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](C)Br)C3)C2)c(C)s1	1783532182	JUOSBULNACWRHU-DIFFPNOSSA-N	430.368	1.916	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](C)Br)C2)C1	1783539719	MWIUEFKPAWSFGI-XTDOFWJNSA-N	443.338	1.355	50	20	IDGD	
C[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1783709660	DTKMITZMLGWSFB-QRWLVFNGSA-N	443.617	1.581	50	20	IDGD	
O=C(COc1cccc(Cl)c1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21	1783803026	GNXZNHAITVHJDE-SJWGOKEGSA-N	431.316	1.298	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H]1C[C@@H]1c1ccc(F)cc1)CCO2	1783932721	BGRHZQNKDADLCO-MSYCTHLASA-N	446.523	1.132	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccc(Cl)s1)CCO2	1783936818	VAIGZDWHMQVOBT-GOSISDBHSA-N	428.942	1.218	50	20	IDGD	
CC#C[C@@H](CC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2)c1ccc(O)cc1	1784015480	ZAQSCPGNKILMNE-LRXVAGHRSA-N	434.920	1.319	50	20	IDGD	
COC(=O)CCCCCC(=O)N1CC[C@]2(C1)CN(C(=O)CO[Si](C)(C)C)CCO2	1784050565	UQQYOTYGLMROFI-FQEVSTJZSA-N	428.602	1.791	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CC(=O)OC(C)(C)C)[C@H]2C1	1784777329	JAGYFEZIFPQUSS-AJNGGQMLSA-N	447.370	1.729	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCCn3ccnc3)C[C@@H]21	1786407867	YIPCPIBHYOAGNQ-JYJNAYRXSA-N	427.343	1.428	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCSC(=N)N)[C@H]2C1	1786847410	AXTKCVJSBHRHTN-CYDGBPFRSA-N	435.388	1.014	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3nnc(C)o3)[C@H]2C1	1787030443	KPAFBTYYDFKJLL-XUXIUFHCSA-N	429.315	1.074	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3cncnc3)[C@H]2C1	1787044208	PPTYXOPGTHJSCD-NXOAAHMSSA-N	439.354	1.562	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4c(c3)OCCO4)[C@H]2C1	1787812857	LJRLTGSZWHBXAE-ZWOKBUDYSA-N	448.592	1.903	50	20	IDGD	
Nc1ncc(C(=O)Nc2ccc(C3(NC(=O)c4ccc(B(O)O)cc4)CCC3)cc2)s1	1788097315	NOPSVGPEOKKNRF-UHFFFAOYSA-N	436.302	1.467	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)[C@H]1Cc2ccccc2O1	1788184489	AQQCKSLYVKOGCD-LZDOMEQBSA-N	441.297	1.660	50	20	IDGD	
CCn1nc(C)cc1C(=O)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1	1788423434	LGLOTJDBXJEZSP-UHFFFAOYSA-N	446.316	1.953	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc(Cl)nc3)C[C@@H]21	1788762331	SSGKBRLPPFENKI-QEJZJMRPSA-N	426.977	1.575	50	20	IDGD	
Cc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCBr)C[C@@H]32)n(C(F)F)n1	1789330582	QHGZFBJUFBCVLZ-OBJOEFQTSA-N	449.296	1.965	50	20	IDGD	
N#Cc1c[nH]c(C(=O)Nc2ccc(C3(NC(=O)c4cccc(B(O)O)c4)CCC3)cc2)c1	1790144426	JOAFHQOCRITLRZ-UHFFFAOYSA-N	428.257	1.628	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnn4c3CCC4)C[C@@H]21	1790964644	VXDNCCRXPVFXLO-FAYQHZLMSA-N	439.354	1.596	50	20	IDGD	
O=C(CN1CCS(=O)(=O)CC1)NC1(c2ccc(NC(=O)C(Cl)Cl)cc2)CCC1	1791603618	RPCJOSSJHBTTDZ-UHFFFAOYSA-N	448.372	1.655	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c3c(nn1C)CCC3)C2	1792873454	ALUORLMTDGYNOZ-JFILPPLUSA-N	439.354	1.143	50	20	IDGD	
C=C(CC(=O)OCC)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)CBr	1792873618	FMXLPQYNOJWCCA-HGTKMLMNSA-N	431.327	1.116	50	20	IDGD	
CC1(C)CCc2cccc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@H](O)CCl)c2O1	1792978205	KJYQBVCFOKRJEA-CYGHRXIMSA-N	436.936	1.593	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccc2ncccc2c1	1793621473	BTYSRKINXUBPIW-BMQTXXJKSA-N	431.920	1.621	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCc1ccc(F)nc1	1794016224	HHHAPJKZANBRTH-FRQROOTJSA-N	442.329	1.774	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cc1csc(C)n1)C2	1796891025	XUJKYOKVROFCNR-NZPKQRIRSA-N	442.545	1.766	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1n[nH]c2c1CC[C@@H]2C	1796973428	CQXZWQLCDKPIPX-NAYUARGSSA-N	425.327	1.446	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CCC[C@@H]2CCCC[C@H]21	1797266122	REOPKSMCSHLAJO-ZEBPIIIJSA-N	448.608	1.556	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2)c1cc(Br)ccc1O	1798837417	FEOUXFZAYBYBLU-WAYYCVMKSA-N	435.677	1.892	50	20	IDGD	
COc1cccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Br)c1	1799347992	WTHJCCTVQNBGOB-RMHZUWNSSA-N	429.286	1.518	50	20	IDGD	
Cc1n[nH]c(C)c1CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)CBr)C2	1799413608	MQZGWQABGBRZBJ-JAMKOXHTSA-N	427.343	1.190	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCNC(=O)OC(C)(C)C	1800169132	MNPKEXOEIXRLHE-XFIYOXNOSA-N	447.960	1.154	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1Cc3ccccc3O1)C2	1800640748	GBEBNFGPJBYWEF-JAPOXJDPSA-N	437.334	1.753	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c(F)ccnc1Cl)C2	1800757254	BYCYGJIMXLQXGS-XHSYRHOGSA-N	434.693	1.861	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccccc1C1CC1	1801668312	QHVVMUIYQGIXCM-VPTLXERWSA-N	449.511	1.080	50	20	IDGD	
C=CCNC(=O)/C=C\C(=O)N1CCCC2(CCN(C(=O)[C@@H](F)Br)CC2)C1	1804856613	RQWXLHKIRIGGCA-YIEVGGLXSA-N	430.318	1.767	50	20	IDGD	
Cn1ccc(=O)cc1C(=O)N1CC[C@@H](CNC(=O)CCBr)[C@@H]1c1cccnc1	1806343247	OKLXZXXKZACUEL-KXBFYZLASA-N	447.333	1.885	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)C2CCCCC2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807362427	GZJSRWHCRVDWOY-IRLDBZIGSA-N	435.333	1.661	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)NC[C@@H]1CCN(C(=O)CO[Si](C)(C)C)[C@H]1c1cccnc1	1808228124	AFYUJIQGOZFNRK-BQFCYCMXSA-N	435.601	1.386	50	20	IDGD	
CC(=O)NC(C)(C)C(=O)N1CC[C@H](CNC(=O)[C@H](F)Br)[C@H]1c1cccnc1	1808649054	IZSOEYAFKGOYNZ-KFWWJZLASA-N	443.317	1.693	50	20	IDGD	
CC1=CC[C@H](C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)CC1	1809479248	WHDWOXQZQQQRND-ZEYPLWLESA-N	447.344	1.827	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2cccc(F)n2)[C@@H]1c1cccnc1	1810769954	XUQRUZAGRCTMRN-KKSFZXQISA-N	442.495	1.308	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2cccc(C#N)c2)[C@@H]1c1cccnc1	1813073243	ODZMJJDQVKEXGX-NZQKXSOJSA-N	448.527	1.646	50	20	IDGD	
Cc1nccn1CCCC(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1	1813356317	UNJJCZAYVITUCS-BJLQDIEVSA-N	433.940	1.672	50	20	IDGD	
Cc1nn(C)c(C)c1CC(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1	1813415568	MMDCYBXXLZZPFC-ILZDJORESA-N	433.940	1.280	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCc2cnc[nH]2)n[nH]1	1815827456	YUVJAAVSKUBSKH-MRXNPFEDSA-N	430.513	1.131	50	20	IDGD	
C=CCSCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1	1817470283	NYTVKIJTQKTQFM-QGZVFWFLSA-N	428.323	1.315	50	20	IDGD	
COc1ccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)nc1	1822416271	ZHGOLLIGOIWHFZ-KRWDZBQOSA-N	443.508	1.492	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CN1CCOCC1)CC2	1822863469	KVCOFWKNZSSCEK-PIGZYNQJSA-N	435.377	1.624	50	20	IDGD	
CC[C@@H](NC(C)=O)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1	1822999601	VENMBKOMVXDLAY-LNLATYFQSA-N	435.319	1.660	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnco2)CC1	1824733800	FTFMHXUZWSXIKE-QGZVFWFLSA-N	426.477	1.220	50	20	IDGD	
CC[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CS(C)(=O)=O)CC2	1825445127	NZMXJFOBWVVMIZ-RKDXNWHRSA-N	438.369	1.273	50	20	IDGD	
C[C@@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1)C1(O)CCC1	1827056157	UOWWWQUZDHTBLR-UWJYYQICSA-N	442.365	1.151	50	20	IDGD	
Cc1noc(C)c1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827056437	UXKHDVDFVPNKGO-HXUWFJFHSA-N	439.321	1.518	50	20	IDGD	
O=C(c1cc(F)c[nH]1)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827060262	DOOGPCLACNQFJU-HXUWFJFHSA-N	427.285	1.381	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)Cc2cccs2)CC1	1827155218	ZSRHEGJPFYDZFK-OAQYLSRUSA-N	440.374	1.904	50	20	IDGD	
O=C(N[C@H]1CCc2nc(NC(=O)[C@H]3CCCSC3)sc2C1)c1cccc(B(O)O)c1	1828152302	FYGRTEHRBZZFBW-ZFWWWQNUSA-N	445.375	1.192	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)/C=C\C(=O)NC2CC2)CC1	1828794038	AEEPSPGQEZBQSU-BTFXCVNISA-N	425.957	1.695	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4ncccc4[nH]3)C2)C1	1830366907	ZHQGJGSCAFJQNN-OAQYLSRUSA-N	434.924	1.898	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3[nH]nc4ccncc34)C2)C1	1831647145	RAWGFFQGQUXAFN-YWZLYKJASA-N	435.912	1.435	50	20	IDGD	
O=C(CCBr)N1CCC([C@@H]2CCCCN2C(=O)CN2C(=O)C=CC2=O)CC1	1831983760	DOANFNZJDULROV-HNNXBMFYSA-N	440.338	1.316	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CN2C(=O)C=CC2=O)CC1	1831986430	RTXXVFAFOXTGCI-MGPUTAFESA-N	444.359	1.767	50	20	IDGD	
CS(=O)(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)CCBr)CC1	1832394354	BIDFFGDQBUGTRF-HNNXBMFYSA-N	437.400	1.826	50	20	IDGD	
COc1cccc(CCC(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)n1	1832821015	LTGYOKNJYSNBNE-PKOBYXMFSA-N	429.876	1.014	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnnc(Cl)c3)CCO2)C1	1833204821	HPDBYQIDAVXRHS-KSSFIOAISA-N	431.320	1.608	50	20	IDGD	
COC(=O)[C@@H]1CC[C@@H](C(=O)NC2CCN(C3CCN(C(=O)[C@@H](F)Cl)CC3)CC2)C1	1833309741	JDLGIOWTZUGIRF-CKEIUWERSA-N	431.936	1.682	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(O)nc(Cl)c3)CCO2)C1	1833575211	VDYQLNKHVRMUCC-IBGZPJMESA-N	446.331	1.776	50	20	IDGD	
Cc1cc(C(=O)NC2CCN(C3CCN(C(=O)CCBr)CC3)CC2)n(C)n1	1834186735	URPQEMAEMTTWDO-UHFFFAOYSA-N	440.386	1.699	50	20	IDGD	
CC(C)N[C@H](C(=O)NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)C(C)C	1834785411	WTEXPJBBQISFNH-OALUTQOASA-N	431.021	1.180	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3cccc(F)c3)CCO2)C1	1835028883	XZLWIUSPBIWBRU-XLIONFOSSA-N	428.888	1.078	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccc(F)cc3)CCO2)C1	1835052099	QWKPTWKHWPDGEL-FXAWDEMLSA-N	428.888	1.078	50	20	IDGD	
CCN(CC)C[C@H](C)C(=O)N1CCOC[C@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1837716037	YJSMGXDEJVNNBG-RXVVDRJESA-N	443.661	1.272	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)CCBr)C3)C2)cc1	1838981441	FWEVMYMVOLVVIK-IBGZPJMESA-N	425.323	1.850	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)cn1C	1839153458	YWFLPVYOYZNGFW-RTBURBONSA-N	432.348	1.640	50	20	IDGD	
O=C(c1cnoc1C1CC1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839197738	GYUHFRMYELUUAZ-WMLDXEAASA-N	446.273	1.313	50	20	IDGD	
COC1(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)CCC1	1839203534	NVXYEGYOZWRXAM-YOEHRIQHSA-N	437.306	1.093	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3onc4ccccc34)CCO2)C1	1839547604	HIPZKDZDQPYVCD-YWZLYKJASA-N	437.880	1.152	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1[C@H]3C=CS[C@@H]31)CCO2	1839700105	FQSWEAVADVZNAQ-SMRWVPHVSA-N	431.352	1.101	50	20	IDGD	
C=CCO[C@H](C)C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](Br)CC)CCO2)C1	1839962469	GHZISLSWTDWBSN-IIDMSEBBSA-N	433.343	1.207	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccc(C)o3)C2)C1	1839967679	UIZFBWDOSYAXMU-LPHOPBHVSA-N	443.338	1.760	50	20	IDGD	
Cc1nscc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2	1840031510	SBVFELMRZLGTFZ-BZNIZROVSA-N	432.340	1.305	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CCN3CCCCC3)C2)C1	1840032073	NFOKCMINXMDTNK-APWZRJJASA-N	446.386	1.102	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3coc(C(C)C)n3)C2)C1	1840151279	ZIZDDTKDWZCISK-LIRRHRJNSA-N	429.901	1.122	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3sccc3OC)C2)C1	1840153984	HCTDHIKWFOIOJE-UGSOOPFHSA-N	432.926	1.081	50	20	IDGD	
COc1ccc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)cc1	1840188255	ZJVDFZYNOJYVCP-IBGZPJMESA-N	431.316	1.498	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(F)c(F)c3C)CCO2)C1	1840705564	UBKDIVOQPRJAEX-FOIQADDNSA-N	446.878	1.597	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(OC)c3F)CCO2)C1	1840794754	UEZGSJGOHQTQGV-YWZLYKJASA-N	444.887	1.158	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)CCCC(=O)Nc2ccccc2)C1	1841327729	VEQZUYYRXVRMDK-UHFFFAOYSA-N	443.548	1.372	50	20	IDGD	
C[C@@H]1CCCN(C(=O)OC(C)(C)C)[C@@H]1C(=O)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1	1841351629	WGVWPBDLTZUUGF-PMPSAXMXSA-N	443.972	1.825	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCCC12CN(C(=O)CC1(O)CCC1)C2	1841925685	WUHUKKDJWNFTRM-AWEZNQCLSA-N	429.945	1.627	50	20	IDGD	
CC1(C)CCc2cccc(C(=O)N3CC4(CCCN4C(=O)c4ccc(B(O)O)cc4)C3)c2O1	1843011082	NXGCQEIBKYQVOP-UHFFFAOYSA-N	448.328	1.601	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)[C@@H](C)n1ccnc1)C2	1844691948	QZBILRZGAMJDAR-CQSZACIVSA-N	441.444	1.795	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@H]1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](C)CBr	1847499927	RIXPVTBWUGIAOV-OTJKEOIZSA-N	427.339	1.975	50	20	IDGD	
COc1ccc(Cn2cc(CC(=O)N3CC[C@H]4[C@@H]3CCN4C(=O)[C@H](O)CCl)cn2)cc1	1847556379	KRRFXUJSGJCDPX-SLFFLAALSA-N	446.935	1.284	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(C)c(C(=O)NNC(=O)c2cc(Cl)ccc2O)c1	10627298	OHFLPXDKXQNVSD-UHFFFAOYSA-N	441.893	1.354	50	20	IDGD	
COc1ccc2c(C)c(CCC(=O)NNC(=O)c3n[nH]c(=O)c4ccccc34)c(=O)oc2c1	14044524	WTGJQKUPEYNQSP-UHFFFAOYSA-N	448.435	1.740	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)c2cccc(S(=O)(=O)NC[C@@H]3CCCO3)c2)c1	104748012	TVXDTJYBGNCBDY-SFHVURJKSA-N	447.513	1.292	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CCc2ccc(S(=O)(=O)NC3CC3)cc2)cc1OC	105818369	QTESYBAEHVODPI-UHFFFAOYSA-N	447.513	1.538	50	20	IDGD	
COc1cccc(Oc2ccc(CNC(=O)NNC(=O)CNC(=O)c3ccco3)cn2)c1	726093181	XPZLKVUGCKUYII-UHFFFAOYSA-N	439.428	1.736	50	20	IDGD	
Cc1cc(=O)c(C(=O)NNc2nc(-c3ccncc3)no2)nn1-c1ccccc1[N+](=O)[O-]	726370901	RMJMHTCGOSCPRB-UHFFFAOYSA-N	434.372	1.651	50	20	IDGD	
CCn1nc(C)c(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1C	727604778	IWYSYKBJCOSJNO-UHFFFAOYSA-N	448.549	1.449	50	20	IDGD	
O=C(CCCc1ccccc1)NNC(=O)c1cc(S(=O)(=O)N2CCSCC2)c[nH]1	727740694	IGXLOEFEMHHFDQ-UHFFFAOYSA-N	436.559	1.536	50	20	IDGD	
CN1CCN(C[C@H](NC(=O)NNC(=O)Cc2nc3ccccc3n2C)c2ccccc2)CC1	727945549	LVTNHJQDMZXXFP-FQEVSTJZSA-N	449.559	1.435	50	20	IDGD	
CC(=O)N1CCN(CCOc2ccc(CCNC(=O)NNC(=O)CC(C)C)cc2)CC1	728134055	GYDQAVCGAJWZIX-UHFFFAOYSA-N	433.553	1.149	50	20	IDGD	
CN(CCO)S(=O)(=O)c1ccc(C(=O)NNC(=O)Cc2cccc3ccccc23)cc1	728312534	WIYOWPNQXIBRHO-UHFFFAOYSA-N	441.509	1.456	50	20	IDGD	
O=C(CN1C(=O)[C@H]2CCCC[C@@H]2C1=O)NNC(=O)c1cc(F)ccc1Br	728550905	NFZQUIUXMBENHG-QWRGUYRKSA-N	426.242	1.524	50	20	IDGD	
O=C(CCCc1nc(-c2cccs2)no1)NNC(=O)C1CCN(c2ncccn2)CC1	728844918	AUCJLLUXVFOSOR-UHFFFAOYSA-N	441.517	1.975	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)c1cnn(-c2ccc(Cl)nn2)c1C(F)(F)F	728851543	JNFIZJWXUZOKTM-UHFFFAOYSA-N	425.758	1.733	50	20	IDGD	
O=C(NCCCc1nc2c(s1)CCCC2)NNC(=O)C1CCN(c2ncccn2)CC1	728955035	DCURFDFCNCDMTB-UHFFFAOYSA-N	443.577	1.992	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)[C@H]2CC(=O)N(c3ccc4c(c3)CCC4)C2)cn1	729692073	JHNKCADEJJBNOB-HNNXBMFYSA-N	425.514	1.950	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)c2ccc(S(N)(=O)=O)c(C)c2)cc1OC	730842143	XBJLCGICXLZAJM-UHFFFAOYSA-N	435.502	1.905	50	20	IDGD	
Cc1nc(-c2ccc(S(=O)(=O)NNC(=O)c3csc(N4CCOCC4)n3)cc2)co1	731902607	INWCRLTUYDCGIQ-UHFFFAOYSA-N	449.514	1.566	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)Cc2csc(NC(=O)c3ccco3)n2)cc1C	731992491	MTMRCWKPYAUFJW-UHFFFAOYSA-N	441.469	1.934	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2ccc(=O)n(Cc3ccccc3Cl)c2)C[C@@H](C)O1	732261134	KOMORWZDNIJSSH-IYBDPMFKSA-N	446.935	1.810	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)N[C@H]1CCN(c2ccccc2C(N)=O)C1	732595556	RUTCZYNIFYEDCM-HIFRSBDPSA-N	429.452	1.301	50	20	IDGD	
CNS(=O)(=O)Cc1ccc(CNC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1	733334806	FVMWJAARXZJVFI-UHFFFAOYSA-N	442.501	1.066	50	20	IDGD	
Cc1noc(C)c1[C@@H](C)NC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	733849967	PBWSSHPVTMMOOC-GFCCVEGCSA-N	435.506	1.781	50	20	IDGD	
Cc1nn(CCCl)c(C)c1C(=O)NCCNc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-]	733915268	NIMXJTCZNOFLJC-UHFFFAOYSA-N	443.913	1.892	50	20	IDGD	
C=CC(=O)NCc1ccc(C(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)cc1	734825510	IREVAEHODILWNK-UHFFFAOYSA-N	445.520	1.832	50	20	IDGD	
Cc1cc(Br)c2c(c1)C(=NNC(=O)Cn1nnc(-c3ccccc3)n1)C(=O)N2	735610756	WIDGIRJIERMSAY-UHFFFAOYSA-N	440.261	1.884	50	20	IDGD	
O=C(NNS(=O)(=O)C[C@H]1CCCO1)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	735645850	HUNNBRPVWKOMLL-GOSISDBHSA-N	442.501	1.132	50	20	IDGD	
CN(C)c1nccc(NNC(=O)c2cccc(S(=O)(=O)NCc3cccs3)c2)n1	740103635	WLJIRSUVZNOJHZ-UHFFFAOYSA-N	432.531	1.840	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)[C@H]1CCCN(C(=O)COc2ccccc2)C1	741207908	MOEBUCVDGKTSEA-KRWDZBQOSA-N	435.484	1.721	50	20	IDGD	
O=C(COC(=O)[C@@H]1CCCCN1Cc1ccccc1)NNC(=O)c1cccc([N+](=O)[O-])c1	741354679	SPKSCBLYGMGYEE-IBGZPJMESA-N	440.456	1.954	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)[C@@H]1CCCN(C(=O)N2CCc3sccc3C2)C1	741696045	WNASHYQVYAJYKT-OAHLLOKOSA-N	449.577	1.390	50	20	IDGD	
Cn1c(NNC(=O)CN(C[C@H]2CCCO2)C(=O)OC(C)(C)C)nc2ccccc2c1=O	742077507	ZUENFGACPIOGFO-CQSZACIVSA-N	431.493	1.793	50	20	IDGD	
O=C(NCCCN1C(=O)COc2ccccc21)NNC(=O)c1cnn(-c2ccccc2)c1	743609315	UOIVUZUEUUNBEQ-UHFFFAOYSA-N	434.456	1.632	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NN=Cc2cccc(OCCC(=O)O)c2)ccc1Cl	746683078	RFNZLZAVGGJFAN-UHFFFAOYSA-N	425.850	1.605	50	20	IDGD	
O=C(NNC(=O)c1sccc1S(=O)(=O)N1CCOCC1)c1ccc(Cl)cc1F	747329094	BUWVSMVRJMFNKN-UHFFFAOYSA-N	447.897	1.636	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc([C@@H](C)NC(=O)NNC(=O)Cc2ccncc2)cc1	747490016	GJOLBPHZJRQLRB-OAHLLOKOSA-N	433.534	1.746	50	20	IDGD	
NS(=O)(=O)c1ccc(C(=O)NNC(=O)Cc2ccccc2F)cc1Br	748081345	VQPBFDIZHURVBU-UHFFFAOYSA-N	430.255	1.239	50	20	IDGD	
Cc1nc(Cl)cc(NNC(=O)[C@H]2CCCN2C(=O)/C=C/c2ccc(C(N)=O)cc2)n1	748333194	BXUKTKJIMVYYFJ-RZIFZGNASA-N	428.880	1.685	50	20	IDGD	
O=C(CN1C(=O)COc2ccccc21)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1	748523556	VSAFZTSMPNUPIF-UHFFFAOYSA-N	429.376	1.849	50	20	IDGD	
Cc1ccc2ncccc2c1S(=O)(=O)NNC(=O)c1sc(N2CCOCC2)nc1C	748639385	BJZRALADXGWFHS-UHFFFAOYSA-N	447.542	1.768	50	20	IDGD	
Cc1c(NNC(=O)[C@@H]2CCCC[C@H]2C(=O)N[C@H]2CCS(=O)(=O)C2)cccc1[N+](=O)[O-]	748687226	XCWOQGUKJNMCEM-RRFJBIMHSA-N	438.506	1.456	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)CNS(=O)(=O)c1ccc(Br)s1	749838651	SDDGXDNOLVFMDB-UHFFFAOYSA-N	432.321	1.559	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)/C(=C/c1ccco1)n1nnnc1-c1ccccc1	751207001	PIYCYEUWBFUEQO-VBKFSLOCSA-N	447.411	1.102	50	20	IDGD	
Nc1c(Cl)c(Cl)nc(C(=O)NNS(=O)(=O)c2c[nH]c(C(=O)O)c2)c1Cl	751260566	FGHGMXADTVZAHP-UHFFFAOYSA-N	428.641	1.274	50	20	IDGD	
COc1cc(NC(=O)CNC(=O)NNC(=O)c2c(C)nc3ccccn23)cc(OC)c1	752001314	ZLTZDWUABZPCSL-UHFFFAOYSA-N	426.433	1.243	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)NC[C@@H]2CCC[C@]23NC(=O)N(C)C3=O)c1C	753024832	QYZBNVFICDCISC-WIEQDCTASA-N	431.493	1.122	50	20	IDGD	
CC(C)CC(C)(C)C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	753182125	XEOPMKLEXXPGSN-UHFFFAOYSA-N	439.578	1.860	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@@H](CCOC)Cc2ccco2)c2ccccc2c1=O	753279236	LGAQERQYZXWRFU-AWEZNQCLSA-N	427.461	1.601	50	20	IDGD	
Cc1oc(S(=O)(=O)N(C)C)cc1C(=O)NNC(=O)c1cc(Br)ccc1O	753337968	AQRLTPPFRDKULK-UHFFFAOYSA-N	446.279	1.381	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(OC(C)C)c(N)c2)cc1OC	754590501	UXPVTFBNGYAUCS-UHFFFAOYSA-N	431.445	1.691	50	20	IDGD	
N#Cc1cc(F)c(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c(F)c1	755046784	HRJYZMHROLUTAL-UHFFFAOYSA-N	434.424	1.696	50	20	IDGD	
COc1ccc2c(c1)C=C(C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1)CO2	755050032	UWKSTHXVUUAQOV-UHFFFAOYSA-N	437.861	1.233	50	20	IDGD	
CCCCc1nnc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)s1	755424987	YBUFFSPJGHBHMB-UHFFFAOYSA-N	426.524	1.598	50	20	IDGD	
CCOc1ccc(NC(=O)NNC(=O)c2ccncc2)cc1S(=O)(=O)N(CC)CC	755449163	BFFJEECDKNKPEZ-UHFFFAOYSA-N	435.506	1.977	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1ccccc1COc1ccc(CC#N)cc1	756112450	VXDNHWRZORUKBU-CQSZACIVSA-N	445.501	1.422	50	20	IDGD	
CCN(CC(=O)NNC(=O)c1cccc(C#N)c1)CC(=O)Nc1ccc2c(c1)OCCO2	756488856	XSMWLDMFTPRWCK-UHFFFAOYSA-N	437.456	1.051	50	20	IDGD	
Cc1c(NC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cccc1S(=O)(=O)NC1CC1	756707169	VFDMVZLJONNQIN-KRWDZBQOSA-N	446.485	1.428	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)CC[C@@H]2CCCN2C(=O)OC(C)(C)C)C[C@@H](C)O1	760119325	FGZKRBRSYQNENE-ZACQAIPSSA-N	426.558	1.813	50	20	IDGD	
O=C(NCc1nnc(-c2ccccc2)s1)NNC(=O)C1CCN(c2ncccn2)CC1	760192486	OZXKNTJZTUXHBT-UHFFFAOYSA-N	438.517	1.742	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)CN2C(=O)N[C@](C)(c3ccc(C)cc3)C2=O)n1	762901437	LBVIOSNRFPVGOZ-OAQYLSRUSA-N	425.493	1.542	50	20	IDGD	
COC(=O)Nc1cc(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)cc(C(F)(F)F)c1	763303565	QJQOMZXZWBXPHE-SNVBAGLBSA-N	438.384	1.015	50	20	IDGD	
O=C(NNC(=O)c1ccc2ccccc2n1)C(=O)Nc1ccccc1S(=O)(=O)C(F)F	763468059	YWGFSOIEYFLTJJ-UHFFFAOYSA-N	448.407	1.631	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)C(=O)Nc1cccc2[nH]ccc12	763530823	IKBIWULNPSJSRK-UHFFFAOYSA-N	434.500	1.466	50	20	IDGD	
O=C(NNC(=O)c1ccccc1F)C(=O)Nc1cccc(F)c1I	763575503	XHHAEOMDNFKETC-UHFFFAOYSA-N	445.163	1.969	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNC(=O)COc2cccc(C)c2)ccc1Cl	763619066	NHHCBNTUUUDIRU-UHFFFAOYSA-N	433.848	1.990	50	20	IDGD	
CCCCn1nccc1NC(=O)C(=O)NNC(=O)COc1cccc(C(F)(F)F)c1	763640567	OWLBCRRRPBFKDK-UHFFFAOYSA-N	427.383	1.867	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2cc(C#N)ccc2OC(F)F)c1	763647257	LFGLMOFPYBNGHX-UHFFFAOYSA-N	432.383	1.941	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(F)c(NC(=O)OC)c1	763682679	TXMGEGRERMMBAU-UHFFFAOYSA-N	448.407	1.568	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)C(=O)Nc1cnn(-c2ccccc2)n1	763849304	IHGFLRTWUSMBDQ-HNNXBMFYSA-N	444.451	1.974	50	20	IDGD	
O=C(CCSc1ccc(F)cc1)NNC(=O)C(=O)Nc1cnn(C[C@H]2CCCO2)c1	763895760	RWCPJSAXUKRWKK-OAHLLOKOSA-N	435.481	1.470	50	20	IDGD	
CC(C)CCOc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c1	763921666	NMSSWVGBHODSIB-UHFFFAOYSA-N	437.460	1.487	50	20	IDGD	
CCc1nc2cc(NC(=O)C(=O)NNC(=O)c3nn(-c4ccccc4)cc3O)ccc2o1	763943289	CRZDGZNSRIVMSM-UHFFFAOYSA-N	434.412	1.681	50	20	IDGD	
Cc1ccn(-c2ccccc2NC(=O)C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)n1	763944700	OUTDHVYMKQOEAZ-UHFFFAOYSA-N	445.439	1.472	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)cnc1Br	764004089	QQQJFDYZLWGLOD-UHFFFAOYSA-N	435.234	1.323	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)on1)C(=O)Nc1ccc(O[C@@H]2CCOC2)cc1	764004426	VUGAAUWPZZVOGU-QGZVFWFLSA-N	436.424	1.909	50	20	IDGD	
CCOc1c(Br)cc(Cl)cc1NC(=O)C(=O)NNC(=O)c1cc(C)[nH]n1	764097933	HSMWOLOTICWTQF-UHFFFAOYSA-N	444.673	1.932	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2ccc(-n3cccn3)c(F)c2)cc1	764124407	GDALWVUIYYKVQY-UHFFFAOYSA-N	425.420	1.739	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2cc(C)n(-c3cccc(Cl)c3)n2)c1O	764130101	ATDXASBYVAQPFF-UHFFFAOYSA-N	443.847	1.948	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(Oc3nccc(C)n3)cc2)c1O	764131851	SLBVVWMTFYASQX-UHFFFAOYSA-N	437.412	1.691	50	20	IDGD	
O=C(CCCc1ccccc1)NNC(=O)C(=O)Nc1cccc(N2CCCS2(=O)=O)c1	764226201	JLLLVFSLFAGKDH-UHFFFAOYSA-N	444.513	1.335	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)C(=O)Nc2cc(Cl)ccc2C(=O)N2CCCC2)c1	764237718	MXOHUCLZHKMMSI-UHFFFAOYSA-N	439.859	1.847	50	20	IDGD	
COCCOc1ccc(F)cc1NC(=O)C(=O)NNC(=O)c1cccc(OC(F)F)c1	764260472	ZUYBNIQXIFXHGL-UHFFFAOYSA-N	441.362	1.852	50	20	IDGD	
CC(C)(C)c1cc(NC(=O)C(=O)NNC(=O)Cc2cc[nH]n2)n(-c2cccc(Cl)c2)n1	764285547	GJTBWZHYYWMAHZ-UHFFFAOYSA-N	443.895	1.875	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)c2c[nH]nc2C)sc2c1CC[C@H](C)C2	764297211	NBONYZOVGIDJDV-VIFPVBQESA-N	433.490	1.481	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)C(=O)Nc1ccc(OC)c(NS(C)(=O)=O)c1)c1ccccc1	764328277	NTWNPZCLAIOAMR-OAHLLOKOSA-N	448.501	1.346	50	20	IDGD	
CN(C)c1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)c1cnn(-c2ccccc2)c1	764345691	ISHBUOQQYIQPQE-UHFFFAOYSA-N	426.864	1.991	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)C(=O)Nc1ccn(-c2ccc(Cl)cc2Cl)n1	764355467	BHHQRTTUMLZMOK-UHFFFAOYSA-N	433.255	1.903	50	20	IDGD	
C[S@@](=O)Cc1cc(NC(=O)C(=O)NNC(=O)COCc2ccccc2)ccc1Cl	764367121	JLOSTYSEXRIKFH-GDLZYMKVSA-N	437.905	1.521	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)C(=O)Nc1cc2c(cc1[N+](=O)[O-])OCCCO2	764367292	UUMBJGCNGWWMJK-UHFFFAOYSA-N	444.400	1.059	50	20	IDGD	
COCCCOc1ccccc1NC(=O)C(=O)NNC(=O)c1cc(-c2cccs2)[nH]n1	764376819	IKEJGIOBAXOOLD-UHFFFAOYSA-N	443.485	1.953	50	20	IDGD	
CCOCCCN1CCC(=NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)[C@H](C)C1	764826888	CCOMDXYRCLGUBE-HXUWFJFHSA-N	443.592	1.685	50	20	IDGD	
CCN1CCN(c2ccc(S(=O)(=O)N(CC)CC)cc2NC(=O)NNC(C)=O)CC1	765112253	PNEJWRBMXPSRFU-UHFFFAOYSA-N	440.570	1.032	50	20	IDGD	
O=C(CCN1C(=O)NC2(CCCC2)C1=O)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	765606500	ASFIOSILHISPAK-UHFFFAOYSA-N	428.424	1.232	50	20	IDGD	
CC[C@H](CC(=O)NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1)C(C)C	765727840	IXSWRVKXQFATHR-GOSISDBHSA-N	438.594	1.521	50	20	IDGD	
O=C(NNC(=O)c1coc(C2CCC2)n1)c1cccc(S(=O)(=O)N2CCOCC2)c1	766329552	WHSVTKRLYNZKKX-UHFFFAOYSA-N	434.474	1.038	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C[C@@H](CNC(=O)OC(C)(C)C)OC)c2ccccc2c1=O	767430084	DXQIFFFRWIDBPA-ZDUSSCGKSA-N	447.492	1.107	50	20	IDGD	
CSCCNC(=S)NNC(=O)c1ccc(S(=O)(=O)N2C[C@@H](C)C[C@H](C)C2)cc1	769768920	HQTVKVYFIJVMCK-KBPBESRZSA-N	444.648	1.825	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)NCc1ccc(N2CCN(C)CC2)nc1	770129359	WKMAKKNJBVQAMV-HNNXBMFYSA-N	446.939	1.785	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)NCCNS(=O)(=O)c1ccccc1	770129574	RCMZLTWDKNMDFZ-CYBMUJFWSA-N	440.909	1.416	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)NCC3(c4ccc5c(c4)OCO5)CCOCC3)nc21	770356126	PANIGMHVCNTJOK-UHFFFAOYSA-N	441.448	1.172	50	20	IDGD	
CCOc1ccc(NC(=S)NNC(=O)[C@H](C)NS(=O)(=O)c2cccs2)cc1	770956643	ZQILMACUMJISQL-NSHDSACASA-N	428.561	1.831	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)Cc2ccccc2I)C[C@H](C)O1	771534946	FNMVIRVCHOBVLH-STQMWFEESA-N	445.301	1.480	50	20	IDGD	
CN(C)C(=O)CS(=O)(=O)c1ccc(C(=O)NNc2ccnc(Br)c2)cc1	771556140	GCWWFWIXVSJEQT-UHFFFAOYSA-N	441.307	1.463	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2)cc1S(=O)(=O)NC1CC1	773643515	ADVAWUQIKNJXCX-UHFFFAOYSA-N	433.446	1.426	50	20	IDGD	
O=C(NNc1ccccc1[N+](=O)[O-])C(=O)Nc1ccc(C(=O)N2CCOCC2)c(Cl)c1	773651482	ZEXHFEBEDPWSML-UHFFFAOYSA-N	447.835	1.802	50	20	IDGD	
CCN1CCN(Cc2ccc(NC(=O)C(=O)NNc3cnc4ccccc4n3)cc2)CC1	773722251	BQZQXTCCSJFEJB-UHFFFAOYSA-N	433.516	1.849	50	20	IDGD	
CCCCn1cc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c(C)n1	774304652	QVZOPUHJYFVQLH-UHFFFAOYSA-N	436.538	1.386	50	20	IDGD	
COCCN1C(=O)c2ccc(C(=O)NNc3cnc4ccccc4n3)cc2S1(=O)=O	774795004	RUBPNPPYJFQZOJ-UHFFFAOYSA-N	427.442	1.178	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)c2cn(-c3cccc(Cl)c3F)nn2)cc1	776438944	SXKOYUPPGPDCKU-UHFFFAOYSA-N	431.811	1.986	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NN=C3CCO[C@H](C(C)C)C3)CC2)cc1	776777498	SRNVXIJDUOMRSB-FQEVSTJZSA-N	436.578	1.609	50	20	IDGD	
COc1ccc(N2CCN(C(=O)/C=C\C(=O)NNC(=O)c3ccccc3OC)CC2)cc1	778269132	QPFFKQYXURFGHF-QXMHVHEDSA-N	438.484	1.370	50	20	IDGD	
N#Cc1ccc(N2CCC[C@H](NC(=O)NNC(=O)c3cnn(-c4ccccc4)c3)C2=O)cc1	780015532	VKXXUJBGSJADDJ-FQEVSTJZSA-N	443.467	1.884	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@]2(C[C@@H]2C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)C1	780601441	VQRQLDSLWLMOAS-ZHRRBRCNSA-N	444.536	1.488	50	20	IDGD	
Cn1c(=NNC(=O)C(=O)Nc2cc3c(cc2[N+](=O)[O-])OCCCO3)sc2ccccc21	783352088	WUMCQSNKTLBTOA-UHFFFAOYSA-N	443.441	1.880	50	20	IDGD	
CCCCOc1ccc(OC)cc1NC(=O)C(=O)NNc1ccc(-n2cccn2)nn1	783433319	OTRRKKMFDINLRY-UHFFFAOYSA-N	425.449	1.932	50	20	IDGD	
N#CCOc1cc(F)ccc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	784214618	ALGZHPBSYLPRCC-UHFFFAOYSA-N	447.448	1.251	50	20	IDGD	
COCCS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccc(OC(F)F)cc2)cc1	784307650	GKCFWIPWCRIBRA-UHFFFAOYSA-N	443.428	1.790	50	20	IDGD	
Cc1c(NNC(=O)C(=O)Nc2ccc(S(=O)(=O)NC3CC3)cc2)cccc1[N+](=O)[O-]	784354781	NRBXKWYMGJOXKQ-UHFFFAOYSA-N	433.446	1.426	50	20	IDGD	
COc1cccc(NNC(=O)C(=O)Nc2ccc(Br)cc2S(C)(=O)=O)n1	784842896	AYBWTYGTYSJNPE-UHFFFAOYSA-N	443.279	1.338	50	20	IDGD	
O=C(NNc1ccnc(F)c1)C(=O)Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1	784852045	PPTPILDDWURJFX-UHFFFAOYSA-N	435.481	1.867	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc2c(c1)CCN2C(=O)C(=O)NNc1cc(F)c(F)cc1F	784891794	DZNRTLZYKXJUIH-UHFFFAOYSA-N	442.419	1.387	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1ccn(C2CCN(C)CC2)n1	787542569	AUUOZCNEAIUSNQ-UHFFFAOYSA-N	434.884	1.212	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ncc(Br)s2)c1	788619897	XFXHZNSXRDCPJC-UHFFFAOYSA-N	433.309	1.231	50	20	IDGD	
COc1c(O)nc(O)nc1C(=O)NNC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1	788626243	WKNDSUIXUDBUNV-UHFFFAOYSA-N	447.411	1.219	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCC(=O)NNc1cccc(F)c1[N+](=O)[O-]	790588841	PQFWTOJXLRPEMK-ZDUSSCGKSA-N	425.417	1.693	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)[C@@](C)(O)Cn2cc(C(F)(F)F)ccc2=O)cc1	792016416	OPEJEPQPRUEWEX-SFHVURJKSA-N	427.379	1.153	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2cc(C)cc(N3CCN(C(C)C)CC3)c2)n1	792274136	RTZFLPZAZUVIBG-UHFFFAOYSA-N	427.509	1.406	50	20	IDGD	
Cc1nn(-c2ccc(Cl)cc2)c(NC(=O)C(=O)NN[C@@]2(C)CCS(=O)(=O)C2)c1C	792279301	ZNDQBVTZRAJQKE-SFHVURJKSA-N	439.925	1.279	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NCC(=O)NNC(=O)OC(C)(C)C)c1	792597114	MOTPBICWVCTHSE-UHFFFAOYSA-N	428.511	1.003	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)[C@H]2CCC[C@H](C(=O)NNC(=O)c3cccc(C)n3)C2)n1	794081017	YMSWTAWYIRAYEY-HOTGVXAUSA-N	438.488	1.122	50	20	IDGD	
C=C(CBr)COC(=O)CNS(=O)(=O)c1ccc(CNC(C)=O)s1	795526195	WHZPTCTXHBGMHB-UHFFFAOYSA-N	425.326	1.157	50	20	IDGD	
CC(C)c1ncc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)cn1	797051632	GZRPBZHUNAXOIW-UHFFFAOYSA-N	431.396	1.975	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)[C@](C)(NC(C)=O)c2ccc(S(C)(=O)=O)cc2)c1	797750645	FQYPGBJJRDOTDS-HXUWFJFHSA-N	433.486	1.371	50	20	IDGD	
CCOc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NNC(=O)COc1ccccc1CC	799256860	AKAZOYGCAJHYKM-UHFFFAOYSA-N	430.417	1.721	50	20	IDGD	
C[C@]1(c2cccc(C(=O)NNC(=O)Nc3ccc(Br)cc3)c2)NC(=O)NC1=O	801996667	GFFNRVAHAIWTHI-GOSISDBHSA-N	446.261	1.970	50	20	IDGD	
CC(C)(C(=O)NNC(=O)N=c1cc[nH]cc1)S(=O)(=O)c1ccc(Br)cc1	802023594	XUGADSCDEQTMMI-UHFFFAOYSA-N	441.307	1.671	50	20	IDGD	
CCc1c(C(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)cnn1-c1ccccn1	802064131	YHMIKABIPQZKNR-UHFFFAOYSA-N	428.474	1.700	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)N1CC[C@H](N2CCN(C(=O)OC(C)(C)C)CC2)C1	805097547	RTSXIIWLWUKVIM-INIZCTEOSA-N	447.536	1.677	50	20	IDGD	
N[C@](C(=O)NNC(=O)c1nn(-c2ccccc2)cc1O)(c1cccc(F)c1)C(F)(F)F	806346065	GZTFKKBTBDZMBT-SFHVURJKSA-N	437.353	1.895	50	20	IDGD	
COCCOc1ccc(S(C)(=O)=O)cc1NC(=O)C(=O)NNc1c(C)cccc1F	806983106	JGHIBLTVUGHINI-UHFFFAOYSA-N	439.465	1.645	50	20	IDGD	
CN1CCN(C(=O)NNC(=O)CCCOc2ccc(I)cc2)CC1	807380200	CVGRWGGLGHUGKT-UHFFFAOYSA-N	446.289	1.438	50	20	IDGD	
O=C(COc1ccc(OCc2ccccc2)cc1)NNC(=O)NCCC1(O)CCOCC1	807448428	ODJFYEYLALYHQY-UHFFFAOYSA-N	443.500	1.906	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)Nc1ccc2c(c1)C(=O)N(CC1CC1)C2=O	808831787	HPEOSUAMTFSMTG-UHFFFAOYSA-N	446.427	1.135	50	20	IDGD	
CCc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NNC(=O)c1ccc(CN(CC)CC)o1	810386516	DIPGZVPGBHSFEF-UHFFFAOYSA-N	431.449	1.992	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C(=O)Nc2ccc(-c3ccccn3)cc2)nc2ccccc21	810390267	DEJVHDUHGPVNBB-UHFFFAOYSA-N	428.452	1.964	50	20	IDGD	
CC1(C)NC(=O)N(c2cccc(NC(=O)NNC(=O)[C@@H]3COc4ccccc4O3)c2)C1=O	812974906	RMHXNYLVCVZTOB-INIZCTEOSA-N	439.428	1.514	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)ccc1C(=O)N(C)C	813033909	QVRXLFZRRLNQIA-UHFFFAOYSA-N	447.517	1.029	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@@H]2CCN(c3ccccc3F)C2)c2ccccc2c1=O	813853682	KCKMNHLWUGLQQE-CQSZACIVSA-N	438.463	1.778	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2F)cc1)[C@H]1C[C@H]1C	815565175	FIXAAECYSDGNEI-ACJLOTCBSA-N	442.447	1.752	50	20	IDGD	
CS(=O)(=O)CC[C@H](Cc1cccc(Br)c1)C(=O)NNC(=O)CC1CC1	819114712	RLYQUYRRGDGILM-CQSZACIVSA-N	431.352	1.990	50	20	IDGD	
CC[C@]1(C)NC(=O)N(CC(=O)NNC(=O)c2ccccc2OCc2ccc(F)cc2)C1=O	863987337	QZMCPGNYPUAXNV-QFIPXVFZSA-N	442.447	1.886	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)c1ccco1)N(S(C)(=O)=O)CC2	913161087	FFRRXWPPLRPENU-AWEZNQCLSA-N	437.474	1.007	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1)c1ccc(CO)cc1	913430475	CTSFSVIEADBGKU-UHFFFAOYSA-N	439.493	1.732	50	20	IDGD	
C[C@@H]1CN(S(=O)(=O)c2cccc(C(=O)NNC(=O)NC3CCCCC3)c2)C[C@@H](C)O1	913449223	LZBALVVPUKCRQC-HUUCEWRRSA-N	438.550	1.761	50	20	IDGD	
O=C(CN1CCCC1=O)NNC(=O)c1cccc(NC(=O)c2ccc(Br)o2)c1	916147722	ALKYNCJUAYEZKE-UHFFFAOYSA-N	449.261	1.678	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)N[C@H](CN1CCOCC1)c1ccccc1	916216388	HBSQSTCYNDZFLF-LJQANCHMSA-N	442.516	1.868	50	20	IDGD	
CCNC(=O)COc1ccc(C=NNC(=O)c2nn(-c3ccccc3)cc2O)cc1OC	916353640	SGGGRVKYNWKRCL-UHFFFAOYSA-N	437.456	1.865	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NCc2cccc(Cn3ccnc3)c2)c2ccccc2c1=O	916405390	FXMRJKHZQHFSTM-UHFFFAOYSA-N	431.456	1.323	50	20	IDGD	
CS(=O)(=O)NCCc1ccc(C(=O)NNC(=O)Cc2ccc3ccccc3c2)s1	917195566	QBGMFZGJLZRSFM-UHFFFAOYSA-N	431.539	1.997	50	20	IDGD	
CCC(=O)Nc1cccc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1	917311058	YBHNVGKCKWMNTA-QGZVFWFLSA-N	427.413	1.179	50	20	IDGD	
NS(=O)(=O)c1ccc(C(=O)NNC(=O)COc2ccc(OCc3ccccc3)cc2)o1	917908680	QYXFJAFPRWBZFG-UHFFFAOYSA-N	445.453	1.346	50	20	IDGD	
O=C(NCCc1ccc(F)c(Br)c1)NNC(=O)c1ccc(-n2cnnn2)cc1	918002114	RGZUMYNJXJCYSO-UHFFFAOYSA-N	448.256	1.751	50	20	IDGD	
O=C(Cc1ccc(-n2cnnn2)cc1)NNC(=S)Nc1cccc(Br)c1	918681484	JZLDFEGPTFGZOY-UHFFFAOYSA-N	432.307	1.985	50	20	IDGD	
CCCCS(=O)(=O)N1CCC[C@@H]1C(=O)NNC(=O)c1ccc(OCCC)c(OC)c1	918690136	NPTPRPAXNSECDM-MRXNPFEDSA-N	441.550	1.839	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(NC(=S)NNC(=O)c2nnc(-c3ccccc3)o2)c1	920079191	UBYIBNPPMZWRIK-UHFFFAOYSA-N	446.514	1.618	50	20	IDGD	
Cn1cc(CC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c2ccccc21	920768378	LSBCAQRGUILWNM-UHFFFAOYSA-N	440.525	1.967	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N(C)Cc2nccn2C)cc1	920848992	KOCQNMGYTZJMDT-ATVHPVEESA-N	447.499	1.733	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCC[C@@H](C(=O)NNC(=O)c2ccccc2F)C1)c1ccccc1F	921273274	GTVJCSRRRAKOCV-OKILXGFUSA-N	444.438	1.993	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)[C@H](CSC)N2C(=O)[C@H]3CCCC[C@H]3C2=O)c1	929085881	RBZCPXIXOBGLPO-BBWFWOEESA-N	449.529	1.372	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)CN2CCC(CN3C(=O)c4ccccc4C3=O)CC2)cc1	1116339313	BDADPJUWFPLFQU-UHFFFAOYSA-N	445.479	1.327	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)[C@@H]2CC(=O)N(Cc3ccccc3)C2)CC1	1251911939	ZPCJAPJTJUXJFE-GOSISDBHSA-N	444.532	1.830	50	20	IDGD	
Cc1[nH]c(-c2ccncc2)nc(=O)c1CC(=O)NNC(=O)c1cncn1-c1ccccc1	1317898868	IBUBBZGGMSWQAH-UHFFFAOYSA-N	429.440	1.330	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)CN(C)C(=O)OC(C)(C)C	1318409334	GENKPBTVFISFNC-ZDUSSCGKSA-N	442.538	1.537	50	20	IDGD	
CCn1c(=O)n(CC(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)c2ccccc21	1318567276	SARMQTSZHKVMHU-UHFFFAOYSA-N	445.520	1.617	50	20	IDGD	
Cn1c(C(=O)O)cc(Br)c1C=NNC(=O)C1CCN(c2ncccn2)CC1	1318599926	KIXVXUMNDNCVAY-UHFFFAOYSA-N	435.282	1.643	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)c2ccc(S(=O)(=O)N(C)CCO)cc2)c(Cl)c1	1322487539	HOVJEDBDRYAHJZ-UHFFFAOYSA-N	440.909	1.728	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)C3=NO[C@H](c4ccccc4)C3)C2)C1	1778173310	CMPRZOKHSHMKDZ-MDKPJZGXSA-N	435.908	1.588	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(CCN(C(=O)COc3cc(Cl)ccn3)C2)C1	1779229004	HYGYYEILHAJDQE-QGZVFWFLSA-N	446.729	1.729	50	20	IDGD	
O=C(c1n[nH]c2c1CCc1ncccc1-2)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Cl)CCO2	1780037137	FXFCWDTXXWIJBT-YLJYHZDGSA-N	433.871	1.548	50	20	IDGD	
Cc1cnn([C@H](C)C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](F)Br)C2)c1	1780777454	SORMQEASMYLSGF-ATNYBXOESA-N	445.333	1.957	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(CCN(C(=O)[C@@H]3CC[C@H]4CCC(=O)N4C3)C2)C1	1781053131	NMFIGLQTIKOLFQ-ZRGWGRIASA-N	442.354	1.002	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](NC(C)=O)c1ccc(F)cc1)CCO2	1781218947	UHZNXOJRPOJWSH-WAOWUJCRSA-N	439.915	1.850	50	20	IDGD	
N#Cc1ccccc1OCC(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781334325	LDACIXFQEABXNY-AEFFLSMTSA-N	440.269	1.457	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccnn1C)C2	1781900813	SQCOSBATMFVHBO-JCKWVBRZSA-N	427.343	1.721	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cccc(-n4cncn4)c3)C2)C1	1782019402	VBKGREGTCILKKD-IFXJQAMLSA-N	448.321	1.494	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)N1CC[C@@]2(CN(C(=O)[C@@H](F)Br)CCO2)C1	1782706244	HIBGOJXBHWNJFP-HFAKWTLXSA-N	425.251	1.068	50	20	IDGD	
CCN1CCC(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](F)Br)C3)CC1	1783298338	NRRJKSRSWMONFR-JTDSTZFVSA-N	448.377	1.923	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)CCc3ccc(F)nc3)CCO2)C1	1783530468	YWIWWZZMNCMFSG-ACJLOTCBSA-N	428.302	1.767	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)Cc3cccc([N+](=O)[O-])c3)CCO2)C1	1783868280	DXKXTZFJVYWWOI-VQIMIIECSA-N	425.869	1.221	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccnn3-c3ccccc3)CCO2)C1	1783874495	HXPWMUVVNBYVKN-UWJYYQICSA-N	432.908	1.570	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCCCCCCCBr)C[C@@H]21)C(O)O	1783877325	MVDZQOVPOHIIPQ-JYJNAYRXSA-N	449.386	1.402	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(OC)cc3OC)CCO2)C1	1783883207	WQGFEKZDBSALMO-JXFKEZNVSA-N	426.897	1.401	50	20	IDGD	
Cc1ccc(CCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](O)CCl)C[C@@H]32)cc1F	1784433997	VEXUYYXEVKMPOM-DKKFBQAASA-N	426.916	1.646	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(CO)c(F)c3)C2)C1	1785266126	KPKOVUIPQMMPPC-DNVCBOLYSA-N	443.313	1.935	50	20	IDGD	
COc1ncc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)Br)C[C@@H]32)cc1F	1785640598	BZEFVQPODFVVRZ-UHXUCMFUSA-N	444.301	1.606	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1)C(=O)c1ccccc1	1787629027	BLOPHGYIVYIHKZ-UHFFFAOYSA-N	442.280	1.997	50	20	IDGD	
COc1ccc2[nH]cc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)[C@H](O)CCl)C[C@@H]43)c2c1	1788324627	XGZKZCNSXZUHQS-MNXTYGCHSA-N	435.908	1.370	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)N3C[C@H]4C[C@H]4C3)[C@H]2C1	1788515843	DRSCXHZJOIWBRN-XAMOXFFSSA-N	428.371	1.090	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)c1cccc(-c2cnccn2)c1	1789263032	MVVHYMAFVKZARO-XEYPJELSSA-N	444.919	1.337	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3CC[C@@H]4CCC(=O)N4C3)[C@H]2C1	1789766934	RJXRLTZNZIMUNL-JCECYMMASA-N	439.984	1.632	50	20	IDGD	
CC(C)N[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]2C1)C(C)C	1789922673	NVTIKSXXUYATPV-UVPYHEFZSA-N	436.366	1.679	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)c1cccc(-c2cnco2)c1	1790147033	TZWFUHOVFMLJME-BMFAXAFESA-N	433.892	1.535	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccnc3S)C[C@@H]21	1791054735	NLYPXWKXYWJCQY-IMIFBBOLSA-N	428.352	1.747	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3c(F)ccnc3Cl)C[C@@H]21	1791252672	RHEYOCYNSKMXBH-FMSGJZPZSA-N	434.295	1.721	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccnc1S	1792502157	BVDOVRGGZMXDQC-ZMJPVWNMSA-N	428.352	1.747	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CNC(=O)OC(C)(C)C)C2	1792872283	WFZHVEWNGBPMGD-XPCVCDNBSA-N	448.358	1.132	50	20	IDGD	
CC(C)[C@H](O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)C2	1793077446	YEOLAVQGPDMFGN-CCMRJRBYSA-N	433.455	1.478	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1scnc1C(F)(F)F	1794982949	XUKINWBCBWPHII-VLEAKVRGSA-N	441.859	1.619	50	20	IDGD	
CCOc1c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](Cl)CC)C3)cnc2c1cnn2C	1796074300	IPQYVEKDVGSRCK-DLTLXFJOSA-N	449.939	1.588	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cn2ccccc2n1	1797345219	PIPPCYGCYVNXBW-CKFWPPNZSA-N	447.499	1.720	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(C)(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](O)CCl)C3)C1	1797890328	IEZFCMYRHZFCDZ-LXTVHRRPSA-N	429.945	1.481	50	20	IDGD	
COc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)CBr)C3)c(O)c1	1798831392	MOHAWZPVUQBHLU-JRATXPSKSA-N	441.322	1.635	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)ccc1F	1799530988	JAFYIUZADVGAIE-YHYOWMERSA-N	429.286	1.908	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1=COCC1)C2)[C@H](Br)Cc1ccccc1	1800435670	CMDIIWQYGCIMGH-FCGDIQPGSA-N	449.345	1.886	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)Oc1ccccn1	1801368759	IMCHPUONTBKRAJ-OWVAZHOYSA-N	440.338	1.612	50	20	IDGD	
Cc1nccn1[C@H](C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)CBr)C2	1801453594	WVOAWTBUTPCBOU-FSNAAORZSA-N	427.343	1.373	50	20	IDGD	
Cn1cc2cc(C(=O)N3CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]3c3cccnc3)ccc2n1	1803148508	RIZDQYJJDODDBB-AHRSYUTCSA-N	441.919	1.888	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)[C@H](COC)NC(C)=O)[C@@H]1c1cccnc1	1803692706	XBOPGZYQUGIRNA-CADBVGFASA-N	438.956	1.646	50	20	IDGD	
CCS(=O)(=O)CC(=O)N1CC[C@@H](CNC(=O)CCBr)[C@@H]1c1cccnc1	1806342317	MIMLQTWFNKQIJP-YOEHRIQHSA-N	446.367	1.307	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)[C@H]1Cc2ccccc2CN1	1808321788	WNNNOFOEODNIGE-DOIPELPJSA-N	442.947	1.402	50	20	IDGD	
O=C(c1ccn2nccc2c1)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1	1809972607	SNHVOPHSDHXTRX-UHFFFAOYSA-N	446.316	1.173	50	20	IDGD	
O=C(NCC(=O)N1CCCC2(CCN(C(=O)[C@H](F)Br)CC2)C1)c1ccco1	1810144408	UWPMBFOWWDPARZ-HNNXBMFYSA-N	444.301	1.931	50	20	IDGD	
COC(=O)C1(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](C)Br)[C@@H]2c2cccnc2)CC1	1812690286	OOUGJYFJKGIXNA-VHDGCEQUSA-N	438.322	1.824	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1	1812864734	RGRGUNWALGRWCU-XTQGRXLLSA-N	449.305	1.991	50	20	IDGD	
COC(=O)CSCC(=O)N1CC[C@@H](CNC(=O)C(Cl)Cl)[C@H]1c1cccnc1	1813075771	JEYQOUBYFDRVHB-SWLSCSKDSA-N	434.345	1.797	50	20	IDGD	
C[C@H](CBr)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H]2CNC(=O)C2)[nH]n1	1814782841	BGKPTXPVRFXVCI-NQBHXWOUSA-N	426.315	1.569	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)[C@H](O)CCl)n[nH]2)nc2nccn12	1814874887	IOOXRTBPLWFCLV-HUUCEWRRSA-N	431.884	1.666	50	20	IDGD	
Cc1c[nH]cc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnccc1C(=O)NN)CC2	1817527294	BPSSQZLSJOEAKL-NSHDSACASA-N	439.501	1.318	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1)[C@@H]1Cc2ccccc2CN1	1817997645	VCJXRMOOJWPYLG-BZSNNMDCSA-N	431.924	1.716	50	20	IDGD	
Cc1cc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)cn1C	1818298695	OSPLOZVJYXNOCD-LJQANCHMSA-N	435.293	1.356	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2nc3ncccn3n2)n[nH]1	1818621216	URZHEPWJTVDHLC-CMPLNLGQSA-N	447.297	1.937	50	20	IDGD	
Cc1cncc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cnccc3C(=O)NN)n[nH]2)c1	1819402135	PBOOMXMOXKUQTR-GOSISDBHSA-N	448.487	1.731	50	20	IDGD	
Cc1nc(F)ccc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCC(=O)NN(C)C)CC2	1820956317	RVLPIEQCWZTRAS-LBPRGKRZSA-N	448.524	1.584	50	20	IDGD	
C[C@H](Br)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1822185208	YYCGYNYKQNSCLU-XHDPSFHLSA-N	449.114	1.179	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2n[nH]cc2[N+](=O)[O-])[nH]n1	1822372808	NLCYLAZMQHHLDX-KOLCDFICSA-N	425.833	1.601	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCc2cnccn2)[nH]n1	1822416844	RFCGSENCLUCTOA-KRWDZBQOSA-N	442.524	1.198	50	20	IDGD	
Cc1nccn1CC(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1	1823009224	MWCABEHJTLSJNE-TVQRCGJNSA-N	430.303	1.951	50	20	IDGD	
C[C@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H](O)CCl)CC1)[C@@H]1SC(=N)NC1=O	1824183128	PRCPCBQBYHJFPO-MHEUCROKSA-N	444.985	1.008	50	20	IDGD	
CCS(=O)(=O)CC(=O)N1CCCC[C@@H]1C1CCN(C(=O)CO[Si](C)(C)C)CC1	1824468355	MYDHXPMMQRICEJ-QGZVFWFLSA-N	432.659	1.892	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CSc1nc[nH]n1)CC2	1826008898	JUNPPFOFEIZGNF-RKDXNWHRSA-N	430.943	1.219	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(F)cn2)CC1	1826142311	FFDQESGPRPULOL-LJQANCHMSA-N	433.528	1.827	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1CCc2nc(NC(=O)CCn3cncn3)sc2C1	1826608520	NJHXICLQHFVLIV-HWPZZCPQSA-N	431.349	1.973	50	20	IDGD	
O=C(c1ccccc1O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827050687	UAFYKYTZENQLBW-NRFANRHFSA-N	436.317	1.619	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H](Cl)COC)CC1	1828876640	UPDCSUOUVGEQBC-DJIMGWMZSA-N	430.977	1.568	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3cc(F)ccn3)C2)C1	1830358169	MNQHOAVIHMAEPY-OAQYLSRUSA-N	441.931	1.875	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C/N=C/c3ccco3)C2)C1	1831649860	CFFWAWYJXHWHOO-ZQUFOJLJSA-N	425.913	1.562	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ncccc3C)CCO2)C1	1831842198	RGXCVEWHHAQXMC-BEFAXECRSA-N	440.338	1.634	50	20	IDGD	
O=C(Cc1ccc2c(c1)CCC2)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1832508344	IZEJBUPWKJPGIL-NRFANRHFSA-N	441.355	1.978	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cc4cccn4cn3)CC2)CC1)[C@@H](O)CCl	1833310570	RYKNRUBLRDGUPN-IBGZPJMESA-N	433.940	1.119	50	20	IDGD	
C[C@@H](Nc1ccccn1)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)CCl)CC2)CC1	1833312187	JLXSRFKALUJBCX-QAPCUYQASA-N	437.972	1.053	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)CNC(=S)NCC)CC2)CC1	1833534688	LNUYEKOHDHQZJW-QGZVFWFLSA-N	446.061	1.450	50	20	IDGD	
CCc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)cn1	1833893937	SMIXMGBHGSTRTM-AUUYWEPGSA-N	440.338	1.497	50	20	IDGD	
Cc1ncccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)Br)C2)C1	1834042481	AKGNAWGPJRYYAV-SCLBCKFNSA-N	426.311	1.243	50	20	IDGD	
Cc1ccc(C(=O)NC2CCN(C3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)s1	1834116561	HHZAXXGMCXLZRY-UHFFFAOYSA-N	449.621	1.615	50	20	IDGD	
O=C(Cn1cccn1)NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1834884216	PFXSKPBFGJMLAF-MRXNPFEDSA-N	430.322	1.145	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccccc3)CCO2)C1	1835000597	XXMINOMFGDDLLQ-XLIONFOSSA-N	439.350	1.859	50	20	IDGD	
C[C@H](Cn1cncn1)C(=O)NC1CCN(C2CCN(C(=O)C(Cl)Cl)CC2)CC1	1835810703	YKUYAJCHKNDAKH-CYBMUJFWSA-N	431.368	1.290	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CCC[C@H]1C)CCO2	1836741043	IPZLUTNAPOSCSK-NNFUDEMPSA-N	431.371	1.910	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnn4cc(C)cnc34)CCO2)C1	1836949473	NBHUSQHMENRTGU-OXQOHEQNSA-N	435.912	1.125	50	20	IDGD	
COc1ncccc1C(=O)N1CCOC[C@@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1837712201	ISCUEZFAQNPMCC-HXUWFJFHSA-N	437.569	1.012	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccccc3F)C2)C1	1837712244	LLWVFCSQSVFILB-NRFANRHFSA-N	438.572	1.676	50	20	IDGD	
COc1cc(OC)c(F)c(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)c1	1838552367	CHNGRRTUCVIYNM-VQIMIIECSA-N	448.850	1.447	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3nccc(Cl)c3OC)CCO2)C1	1838727558	KDXPRSURXFCDNT-BFUOFWGJSA-N	446.331	1.831	50	20	IDGD	
O=C(C(Cl)Cl)N1CCC(OC2CCN(C(=O)[C@H]3CCCS3(=O)=O)CC2)CC1	1838739863	AUEDRGACWJIJHD-CQSZACIVSA-N	441.377	1.366	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccnc3S)C2)C1	1839149510	JJMKJNWPTCQYFV-QZTJIDSGSA-N	448.372	1.677	50	20	IDGD	
COc1cc(C)c(C)cc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1839464575	UYIZFCHSGUOCFM-YLJYHZDGSA-N	428.888	1.916	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(O)nc3)C2)C1	1839965577	DQVSIMCUSZGETH-KBXCAEBGSA-N	442.310	1.031	50	20	IDGD	
COc1cccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)c1C	1840070505	VVLQHSJHEGATHN-UYAOXDASSA-N	428.888	1.537	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)c(O)c1	1840669530	ATHQECLBMDQMQA-AUUYWEPGSA-N	441.322	1.554	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)COc3ccccc3C#N)CCO2)C1	1840820365	LXGHKIQPLDXUNS-UTKZUKDTSA-N	435.908	1.411	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2ccc(C(F)(F)F)nc2)C1	1842476299	JGAGWAWMMMNVSC-UHFFFAOYSA-N	448.405	1.230	50	20	IDGD	
COc1ccc(C(=O)N2CC3(CCCN3C(=O)c3ccc(B(O)O)cc3)C2)cc1Cl	1843012752	NQZULGKQQZWXBL-UHFFFAOYSA-N	428.681	1.159	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2csc3c2CCCO3)C1	1843225537	CZBKANPZBNTVPH-UHFFFAOYSA-N	441.513	1.202	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)c2cn3cc(Cl)ccc3n2)C1	1843660589	XGYJEKHVACIHGG-UHFFFAOYSA-N	432.912	1.178	50	20	IDGD	
O=C([C@@H](F)Cl)N1CC2(CCCN2C(=O)c2n[nH]cc2I)C1	1844466300	DTRLHBYLURDZEZ-SECBINFHSA-N	426.617	1.366	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC2(CCCN2C(=O)c2cc[n+]([O-])cc2)C1	1844597471	BMRLYOCCTFXOSW-HNNXBMFYSA-N	438.912	1.269	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCCC12CN(C(=O)/C=C/C(=O)NCc1ccco1)C2	1845171009	AXQLECCXTQYZEV-DUMMIQTOSA-N	428.316	1.892	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@]13C[C@@H]1CN(C(=O)OC(C)(C)C)C3)C2	1846365037	XCBQXCYBYINAHO-VTJXTGGHSA-N	441.956	1.701	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)N3CCC(C(=O)N4CCOCC4)CC3)cc2C1	9793553	NWDRFANQBZWZNS-CQSZACIVSA-N	434.562	1.798	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2ccc3c(c2)CC(=O)N3C)ccc1OC(C)C	12969598	JPHOMNFZTJTMAN-UHFFFAOYSA-N	433.486	1.625	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)/C=C/c1ccccc1)C(=O)NNc1nnc(C)c(O)n1	23309537	AGFFDPLQIUFMCH-CFRMROPGSA-N	438.535	1.041	50	20	IDGD	
O=C(CCn1c(=O)[nH]c(=O)c2ccccc21)NNC(=O)c1ccc(COc2ccccc2)o1	26631985	UYKFNYVSOGEWPF-UHFFFAOYSA-N	448.435	1.713	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)c1cccc(S(=O)(=O)NC2CCCC2)c1	45644337	NWBRLKFSXTUNDJ-UHFFFAOYSA-N	431.470	1.711	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)N2CCN(CC(=O)N3CCCCC3)CC2)c1C	302913391	RGYCOTIBCPYPMB-JWGURIENSA-N	441.576	1.815	50	20	IDGD	
C[C@@H](COc1ccccc1C(F)(F)F)NC(=O)NNC(=O)CNC(=O)c1ccco1	726237108	IFJFLHOXZYLAGU-NSHDSACASA-N	428.367	1.826	50	20	IDGD	
NC(=O)CNC(=S)NNC(=O)c1ccc(CN2C(=O)c3cccc4cccc2c34)cc1	727064369	DUCVGNTXKUSFRF-UHFFFAOYSA-N	433.493	1.594	50	20	IDGD	
CCOc1ccc(OCC)c(NC(=S)NNC(=O)c2ccc(S(=O)(=O)NC)o2)c1	727492161	JUZDZDLSKFPYLG-UHFFFAOYSA-N	442.519	1.617	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)[C@@H]1C[C@@H](O)CN1C(=O)OCc1ccccc1	727766629	ZKWHDBUHDPTDPN-LESCRADOSA-N	445.447	1.512	50	20	IDGD	
CCCOC(=O)c1ccc(S(=O)(=O)NNC(=O)CNC(=O)c2cccs2)cc1	727796009	AQEVCCMEDRRKPO-UHFFFAOYSA-N	425.488	1.054	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)N[C@@H](CN2CCN(C)CC2)c2ccccc2)cc1	727946170	SPAHHCFPCAILRF-NRFANRHFSA-N	441.532	1.393	50	20	IDGD	
CN1CCN(C[C@H](NC(=O)NNC(=O)Cn2ccc3ccccc32)c2ccccc2)CC1	729506436	BLUFITVHCPTGDI-NRFANRHFSA-N	434.544	1.960	50	20	IDGD	
Cc1ncsc1C(=O)NNC(=O)N1CCN(c2oc(-c3ccco3)nc2C#N)CC1	729508619	JUKJNJPXUQIZGM-UHFFFAOYSA-N	427.446	1.748	50	20	IDGD	
CCOc1ccc(NC(=S)NNC(=O)Cc2c(C)nc(-c3ncccn3)nc2O)cc1	729516813	FSXWHMRIUGOJQD-UHFFFAOYSA-N	439.501	1.907	50	20	IDGD	
NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NNC(=O)Cc3ccccc3F)cc2)C1	731403777	VRRVGXNWFUHDLM-QGZVFWFLSA-N	427.480	1.601	50	20	IDGD	
Cc1c(CC(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)nnn1-c1ccccc1	732329405	KLEUPSNMQKSUEM-UHFFFAOYSA-N	438.400	1.031	50	20	IDGD	
CC(C)OCCCn1c(NNC(=O)[C@@]23CCC(=O)N2CCS3)nc2ccccc2c1=O	733265993	PDAHSKPWROHRES-NRFANRHFSA-N	445.545	1.720	50	20	IDGD	
O=C(NCc1ccccc1CN1CCOCC1)NNC(=O)c1cnn(-c2ccccc2)c1	733335767	BGERCKQJWQFBRI-UHFFFAOYSA-N	434.500	1.849	50	20	IDGD	
O=C(COC(=O)c1cc(Cl)nc(Cl)c1)NNC(=O)[C@@H]1COc2ccccc2O1	733512393	DSHODEJXTJWCKE-LBPRGKRZSA-N	426.212	1.533	50	20	IDGD	
CC(C)N1CC[C@@H](NC(=O)NNC(=O)COc2ccc(OCc3ccccc3)cc2)C1=O	734218589	JTCPTIPMMVUXMY-HXUWFJFHSA-N	440.500	1.984	50	20	IDGD	
COc1ccc([C@H]2[C@@H](C(=O)NNC(=O)COc3ccc(F)cc3)CCC(=O)N2C)cc1	734418707	HEVZVBAOIJBXEV-RXVVDRJESA-N	429.448	1.970	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)[C@H]2CC(=O)N(Cc3ccco3)C2)CC1	734825461	GKJKTTRKERUJDA-AWEZNQCLSA-N	449.508	1.358	50	20	IDGD	
NC(=O)c1ccc(N2CCN(C(=O)NNC(=O)c3cnn(-c4ccccc4)c3)CC2)cc1	735511625	AJQPLKNCMNIHRF-UHFFFAOYSA-N	433.472	1.148	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)NCCNS(=O)(=O)c1cccc(Cl)c1	738453121	DUVWLXQQWUQYHB-UHFFFAOYSA-N	440.909	1.166	50	20	IDGD	
CC(=O)NC1(c2noc(CCC(=O)NNc3ccnc(N(C)C)n3)n2)CCCCCC1	740103594	ULOXTCCDUMHIAQ-UHFFFAOYSA-N	430.513	1.687	50	20	IDGD	
C[C@@H](C(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)N1CCc2ccccc2C1	740988145	ZYUBTMXNVWRLJF-AWEZNQCLSA-N	426.429	1.346	50	20	IDGD	
Nc1c(C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cccc1C(F)(F)F	741003887	NQAXPXSRXFQXPX-UHFFFAOYSA-N	426.307	1.814	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@H](NC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)C1CC1	741281419	MNQUBSXASRKLEG-HNNXBMFYSA-N	440.522	1.337	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccnc(OCC(F)(F)F)c2)c1	741660322	NJYYNRPYJQAOFW-UHFFFAOYSA-N	446.407	1.348	50	20	IDGD	
CC(=NNC(=O)C[C@H](C(=O)NN=C(C)c1nccs1)N1CCOCC1)c1nccs1	741765802	DZODVFIKRSTMMM-CQSZACIVSA-N	449.562	1.071	50	20	IDGD	
O=C(CN1CCN(c2ncnc3ccsc23)CC1)NNC(=O)c1cccc(Cl)c1	741794453	TYBGHKBTHVONLA-UHFFFAOYSA-N	430.921	1.928	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)[C@@H]2CN(Cc3nc(O)c4ccccc4n3)CCO2)cc1	742241517	LIWZQOQTRGNSEA-IBGZPJMESA-N	435.484	1.560	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cccc(N(C)C)c2)cc(NS(C)(=O)=O)c1OC	742487669	XFDASDILUODLAC-UHFFFAOYSA-N	436.490	1.216	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)N[C@@H]1CCN(c2ccc(Cl)cc2)C1=O	745835112	TZXGPNUQRDCUOB-CQSZACIVSA-N	433.808	1.703	50	20	IDGD	
COC[C@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)c1ccco1	746770345	MTAXMGGFELLOSR-INIZCTEOSA-N	436.490	1.396	50	20	IDGD	
C[C@H](CS(C)(=O)=O)C(=O)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1	746841002	BVLOXGCCXGQTDC-UZLBHIALSA-N	429.542	1.442	50	20	IDGD	
O=C(COC(=O)CC[C@H]1Cc2ccccc2NC1=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	746926274	RGAFBQZPWBIDCL-HNNXBMFYSA-N	440.412	1.490	50	20	IDGD	
Cc1nc(N2CCOCC2)nc(O)c1CCC(=O)NNC(=O)c1ccc(Cl)cc1F	747330367	VPDPRCSMLFUFIE-UHFFFAOYSA-N	437.859	1.514	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NNC(=O)Cc1ccncc1	747491176	PXCFBOFPKSGFFZ-LLVKDONJSA-N	436.266	1.216	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@]2(F)CCN(C(=O)OC(C)(C)C)C2)c2ccccc2c1=O	748285031	GCGBBEMGXVNTEO-NRFANRHFSA-N	447.467	1.527	50	20	IDGD	
COc1ccc(-n2c(C)cc(/C=C(/C#N)C(=O)N3CCN4C(=O)NC(=O)[C@@H]4C3)c2C)cc1	749253154	OIQIYCZVWUJFNA-OWMRDYPQSA-N	433.468	1.772	50	20	IDGD	
CN(C)c1ccnc(C(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)c1	749404219	WSFPXCGUPKDNCC-UHFFFAOYSA-N	442.483	1.924	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NN=C1C(=O)Nc2c(Br)cc(F)cc21	750945254	JLCYTDGUALQLBB-UHFFFAOYSA-N	425.239	1.852	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)[C@@]12CCC(=O)N1c1cc(Cl)ccc1S2	751203187	KNCCFKZSRBWBFU-SFHVURJKSA-N	434.861	1.439	50	20	IDGD	
O=C(C[C@H]1CSCCS1)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	751538721	MLVGZFFVSKKTTO-HNNXBMFYSA-N	443.616	1.861	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)NNC(=O)CSc2ccc(Cl)cc2)ccc1F	752400047	MHHNKCOWHWJZSU-UHFFFAOYSA-N	431.898	1.941	50	20	IDGD	
CCn1nccc1C=NNC(=O)c1cc(S(=O)(=O)NCc2ccccc2)ccc1O	753694804	JIQGMFVTYRRUOT-UHFFFAOYSA-N	427.486	1.851	50	20	IDGD	
CS(=O)(=O)N1CCC[C@@H]1CNC(=O)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1	753695295	OPCIJARAHZWFLO-LLVKDONJSA-N	444.457	1.030	50	20	IDGD	
COC(=O)c1cc2c(cc1NC(=O)C(=O)NNC(=O)c1cccc3cccnc13)OCO2	753841142	PNBLKTZGHMTANM-UHFFFAOYSA-N	436.380	1.150	50	20	IDGD	
O=C(NNc1cccnc1Cl)[C@@H]1CCCN1S(=O)(=O)c1cccc([N+](=O)[O-])c1	754485478	WPHKWZQASXDREZ-AWEZNQCLSA-N	425.854	1.940	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)NCCN2C(=O)[C@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2=O)c(Cl)c1	755245883	CBLSWCOEOGUFIG-GVAFMPQTSA-N	431.880	1.791	50	20	IDGD	
COc1cc(C=NNC(=O)[C@@H](C)CN2CCC(C)CC2)c([N+](=O)[O-])cc1OCC(=O)O	755585498	UYZHORVLNWZOAB-AWEZNQCLSA-N	436.465	1.885	50	20	IDGD	
COC(=O)CCNC(=O)c1ccc(NC(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)cc1	755605050	XZEPNLXRZCTZSN-ZDUSSCGKSA-N	446.435	1.739	50	20	IDGD	
Cc1ccc(C(=O)NC2CC2)cc1NC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	755827374	GHLJFTHPENPXRH-UHFFFAOYSA-N	430.486	1.757	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)Nc1ccc(CCN2CCOCC2)cc1	756166177	WGLUSWXEDFQOPF-UHFFFAOYSA-N	436.476	1.004	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)Nc2ccc3c(ccn3CCN3CCOCC3)c2)n1	756400025	UDAVKWDSPQFOJS-UHFFFAOYSA-N	439.520	1.640	50	20	IDGD	
O=C(NNC(=O)N1CCN(c2ccc(F)cc2Cl)CC1)c1ccc(-n2cnnn2)cc1	757003948	SJAKSNLKNMCUON-UHFFFAOYSA-N	444.858	1.631	50	20	IDGD	
NC(=O)c1ccc(NNC(=O)CSCc2nc(O)c3c4c(sc3n2)CCCC4)nn1	757393520	ZUPSDKABMUZAOF-UHFFFAOYSA-N	445.530	1.541	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2ccn(CCC(C)C)n2)cc1	757716360	XFRMIWGYJMBUAS-UHFFFAOYSA-N	436.538	1.711	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)c1cnc(-c2ccc(C(F)(F)F)cc2)s1	758050824	CSIKSMGCNZQYMU-MRVPVSSYSA-N	436.437	1.528	50	20	IDGD	
CCS(=O)(=O)N1CCC(CNC(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)CC1	758746638	XJXKOAQXXWCRJA-INIZCTEOSA-N	440.566	1.463	50	20	IDGD	
C[C@@H](NC(=O)OC(C)(C)C)[C@@H]1CCCN(CC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)C1	758781151	VWVYSLMUKPQRRK-GDBMZVCRSA-N	449.508	1.981	50	20	IDGD	
O=C(NNC(=O)[C@H](c1ccc(Br)cc1)N1CCCC1)C(=O)Nc1ccccn1	758826775	DXFZWMTXWGJHHQ-INIZCTEOSA-N	446.305	1.767	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H]2Cc3cccc(O)c3C2)c1	759489676	IZCONNMXDUJOQB-MRXNPFEDSA-N	446.529	1.534	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccnn2Cc2ccc(F)cc2)c1O	760276952	HIJUMVCZYOCWRO-UHFFFAOYSA-N	427.392	1.184	50	20	IDGD	
COC[C@H](C)NC(=O)/C(C#N)=C/c1ccc(OCCn2cc(C(=O)O)nn2)c(Cl)c1	763113453	ILCVASQMCYFDMA-FUEWVNAISA-N	433.852	1.767	50	20	IDGD	
O=C(CN1CCCCCC1)Nc1cccc(NC(=O)C(=O)NNC(=O)c2ccccc2)c1	763419346	CMGNWTYTDNRNDC-UHFFFAOYSA-N	437.500	1.901	50	20	IDGD	
CC(C)CNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1	763467764	HDJYPCGZFPGXPV-UHFFFAOYSA-N	427.417	1.380	50	20	IDGD	
CCN(CC)Cc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(OC)c(OC)c2)c1	763543206	MNRGNPZYYHTVMR-UHFFFAOYSA-N	428.489	1.945	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)C(=O)Nc1ccc2oc(C(F)(F)F)nc2c1	763548100	ISDMLJHDXNXUAI-UHFFFAOYSA-N	436.302	1.975	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)C(=O)Nc1cccnc1OCc1ccccc1	763550954	JQHSSHDQNIZFEK-UHFFFAOYSA-N	434.408	1.789	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)Nc1ccnc(Oc2ccccc2)c1	763569699	ATYVUVGFVFIOAV-GOSISDBHSA-N	434.408	1.800	50	20	IDGD	
O=C(COc1cccc(C(F)(F)F)c1)NNC(=O)C(=O)Nc1cnn(CC(F)F)c1	763639987	MXCXXIJGTMFPDG-UHFFFAOYSA-N	435.309	1.332	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1csc(-c2ccccn2)n1	763661816	CSBGUENFZQHTBY-UHFFFAOYSA-N	427.442	1.379	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(C(=O)OC)cc1F	763680607	HFCFMVHSWYNBRE-UHFFFAOYSA-N	433.392	1.176	50	20	IDGD	
COc1ccc(C#N)cc1NC(=O)C(=O)NNC(=O)COc1ccc(Br)cc1	763695800	XROKUSLNYGHSRE-UHFFFAOYSA-N	447.245	1.494	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccc(C(=O)NC(C)(C)C)c1	763710959	DTXNUWHLOOVQEG-UHFFFAOYSA-N	440.500	1.942	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2ccc3ncsc3c2)c2ccccc2c1=O	763787001	ULPXTZYBJDSJGO-UHFFFAOYSA-N	436.453	1.426	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccnc(OCC(F)(F)F)c1	763858667	VQPGMGGEDOUGJC-SNVBAGLBSA-N	444.341	1.715	50	20	IDGD	
COC(=O)c1cc(Cl)cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)c1	763867185	SNJXUMQFDKWEKT-JTQLQIEISA-N	437.811	1.819	50	20	IDGD	
Cc1ccc(C(N)=O)cc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1c(C)cc(Cl)cc1C	763884304	UWQSKUAZRZAMLK-ZDUSSCGKSA-N	446.891	1.918	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)C(=O)Nc1ccccc1Br	763943382	GGHZZLVGZYVZNF-UHFFFAOYSA-N	444.245	1.740	50	20	IDGD	
CCCOC(=O)c1cc(Br)ccc1NC(=O)C(=O)NNC(=O)c1ccc[nH]1	763979752	KYCCSPIDUPLDST-UHFFFAOYSA-N	437.250	1.744	50	20	IDGD	
Cc1cc(Oc2ccccc2)ccc1NC(=O)C(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1	764003119	YUQYNIWDQRYSRT-CQSZACIVSA-N	431.470	1.308	50	20	IDGD	
CCNC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)on2)c1	764017137	RNWYAZKAXCQOCD-UHFFFAOYSA-N	436.428	1.883	50	20	IDGD	
Cc1nn(-c2ccc(Cl)c(Cl)c2)c(NC(=O)C(=O)NNC(=O)c2cnccn2)c1C	764025115	RPWORCUKPYDFSC-UHFFFAOYSA-N	448.270	1.986	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)Cc2cccc3ccccc23)cc1	764035613	GBXMMJCLCNHQEA-UHFFFAOYSA-N	425.466	1.572	50	20	IDGD	
CC(C)(C)OC(=O)N1CCO[C@H](CC(=O)NNC(=O)CSc2ccccc2O)C1	764048494	YSTSDXSHCJICTM-CYBMUJFWSA-N	425.507	1.658	50	20	IDGD	
CCOC(=O)c1cc(F)c(F)cc1NC(=O)C(=O)NNC(=O)c1ccc(Cl)cc1O	764127044	RITUSWOAMGWPOJ-UHFFFAOYSA-N	441.774	1.900	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)c(Br)c1	764164423	PEXOCNUESHJKPK-HNNXBMFYSA-N	434.246	1.547	50	20	IDGD	
Cc1ccc(C(N)=O)cc1NC(=O)C(=O)NNC(=O)c1cc(F)ccc1Br	764270446	NIMSBTUVSDBAOC-UHFFFAOYSA-N	437.225	1.395	50	20	IDGD	
CN(c1ccccc1NC(=O)C(=O)NNC(=O)COc1ccccc1O)C1CCCC1	764275604	OVSORCFOCZOFHJ-UHFFFAOYSA-N	426.473	1.936	50	20	IDGD	
CC(C)OC(=O)NCc1ccc(NC(=O)C(=O)NNC(=O)CCc2ccccc2O)cc1	764277342	CGFRMIATANTJPW-UHFFFAOYSA-N	442.472	1.746	50	20	IDGD	
CC(C)(C)c1ncc(NC(=O)C(=O)NNC(=O)c2cc(Br)ccc2O)cn1	764280381	NXXCIXJPHJFFJL-UHFFFAOYSA-N	436.266	1.642	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)C(=O)Nc1ccccc1S(=O)(=O)C(F)F	764318646	CQPDNSKVJZTHDY-UHFFFAOYSA-N	429.376	1.151	50	20	IDGD	
O=C1CCC(=O)N(c2ccc(C(=O)NNc3c(F)cc(C(=O)NC4CC4)cc3F)cc2)N1	764335237	NIWOXTZTCJMSBB-UHFFFAOYSA-N	443.410	1.772	50	20	IDGD	
COC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)cc1	764387366	KTAAJPXFBYGXHD-UHFFFAOYSA-N	440.391	1.794	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1	765316677	APKDQYWXTCXUSR-UHFFFAOYSA-N	432.437	1.846	50	20	IDGD	
CCOc1ccccc1C(=O)NCC(=O)NNC(=O)c1cc(-c2ccccc2OC)[nH]n1	765591824	CEWCPZQSZBBZFQ-UHFFFAOYSA-N	437.456	1.675	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccccc1F)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	765617873	GOBSOZPYQIFLQZ-UHFFFAOYSA-N	449.439	1.485	50	20	IDGD	
C[C@@H](Cc1cccc(F)c1)C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765738327	JTDNOUDBTGIGIQ-KRWDZBQOSA-N	426.492	1.610	50	20	IDGD	
COc1ccc2c(ccn2CC(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)c1	765739519	WYRHMFWCANJXNZ-UHFFFAOYSA-N	449.511	1.255	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1S(C)(=O)=O	765779438	WHHXZQGMCXOWNJ-UHFFFAOYSA-N	431.518	1.120	50	20	IDGD	
O=C(C[C@H](C(=O)NN=C1CC(C(F)F)C1)N1CCOCC1)NN=C1CC(C(F)F)C1	766024461	FAAXHNHCUOIALF-QIMFLAQGSA-N	435.422	1.372	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1cccc(N2C(=O)c3ccccc3C2=O)c1	766268173	AKQQHHGATMCOGX-UHFFFAOYSA-N	432.396	1.368	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3ccc(Cn4ccnc4)cc3)CC2)cc1	766647236	BSMBAIJYQBFXOU-UHFFFAOYSA-N	446.555	1.819	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3ccc4c(c3)nc(O)n4C)CC2)cc1	766648040	IAMREXADTBRGQZ-UHFFFAOYSA-N	436.516	1.166	50	20	IDGD	
CCn1c(=O)oc2cc(S(=O)(=O)NNC(=O)c3ccc(Cl)cc3OC)ccc21	767445758	PHEPDJOWDPTLNT-UHFFFAOYSA-N	425.850	1.900	50	20	IDGD	
Cc1onc(-c2ccccn2)c1C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	767562470	SMXFYCGVFOXLFW-MRXNPFEDSA-N	438.396	1.189	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](OCC(=O)NNC(=O)CNC(=O)c2cccs2)C1	767933422	PPVTWIJZTUMGRT-CYBMUJFWSA-N	440.522	1.041	50	20	IDGD	
COc1ccc(Cl)cc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)C(C)(C)O)c1	768262959	ZQUYDYGRWHZPMN-UHFFFAOYSA-N	441.893	1.681	50	20	IDGD	
COc1ccc(NNC(=O)CCc2c(C)nc(N3CCOCC3)nc2O)c([N+](=O)[O-])c1	768329177	RLXYFRUQNOTLMA-UHFFFAOYSA-N	432.437	1.320	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=S)Nc3ccccn3)CC2)cc1	768585423	LLCGIDCIBIGLMN-UHFFFAOYSA-N	433.559	1.809	50	20	IDGD	
CCc1c(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cnn1-c1ccccc1OC	769536499	FFHLFLGLQGDZFU-UHFFFAOYSA-N	432.444	1.494	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(-c3nc[nH]n3)cc2)c1	770209529	PEIOFSBRIJQTGX-UHFFFAOYSA-N	442.501	1.577	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@@H](NS(C)(=O)=O)C(C)(C)C)cc1Br	770544982	HMAQLEZPVDZBJP-GFCCVEGCSA-N	436.328	1.183	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)N1CCN(C(=O)c2ccccn2)CC1	770647593	NGYAWOBFMRMRSV-AWEZNQCLSA-N	431.880	1.701	50	20	IDGD	
COCCOC(=O)c1c(C)[nH]c(C(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)c1C	770965501	CGAAMGTURNFABR-UHFFFAOYSA-N	445.480	1.792	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1ccc(C(N)=O)cc1)C(=O)NNc1ccc(Br)cc1	770968071	IXJFBUQOWNHCHH-SNVBAGLBSA-N	441.307	1.358	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)CCNC(=O)c3ccc(Br)cc3)nc21	770973229	ZAEPBMYEFGPNTK-UHFFFAOYSA-N	434.254	1.095	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNS(=O)(=O)c1ccc(Cl)nc1Cl	771604851	MYJZZAPOAAARHZ-UHFFFAOYSA-N	437.692	1.668	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)[C@H]1CCN(c2ccc(Cl)cc2)C1=O	772897895	NJDRCXDZPQTIMX-MRXNPFEDSA-N	449.294	1.810	50	20	IDGD	
O=C(NNC(=O)N1CC[C@@H]2[C@@H](CCCN2C2CC2)C1)c1csc(N2CCOCC2)n1	772973575	RLNYSFKELALDFM-WMLDXEAASA-N	434.566	1.283	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)c1ccn(C(F)F)n1	775780338	IRSGJOOGBSETRP-UHFFFAOYSA-N	426.855	1.510	50	20	IDGD	
O=C(CC12CC3CC(CC(C3)C1)C2)NNC(=O)N[C@H]1CCO[C@]2(CCS(=O)(=O)C2)C1	776075842	HAGLQFIWTKIWJI-LMNOFTHYSA-N	439.578	1.660	50	20	IDGD	
COCCO[C@@H]1COCC[C@@H]1NC(=O)NNC(=O)COc1ccccc1-c1ccccc1	777277774	DCFCDBQMPVFGSV-PZJWPPBQSA-N	443.500	1.883	50	20	IDGD	
C=CCNC(=O)CNC(=O)/C(C#N)=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	777514914	HYRUTTHTRMWGLV-GDNBJRDFSA-N	440.891	1.404	50	20	IDGD	
COc1ccc(CCC(=O)N2CCN(S(=O)(=O)CBr)CC2)cc1OC	777777388	HYZCEIAAZUYTMI-UHFFFAOYSA-N	435.340	1.463	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)c2ccccc2c1=O	778531994	RDAMKNYKNDDJHI-UHFFFAOYSA-N	439.384	1.518	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)c2cc(S(=O)(=O)N3CCC[C@H](C)C3)cn2C)c1	780802112	OMEICWGLVZAOFF-AWEZNQCLSA-N	434.518	1.989	50	20	IDGD	
CCOC(=O)COc1c(Br)cc(C)cc1C=NNC(=O)CN1CCCC1=O	781586817	YZPPOCORPKTVNV-UHFFFAOYSA-N	440.294	1.772	50	20	IDGD	
O=C(NCc1ccccc1CN1CC[C@@H](O)C1)NNC(=O)c1cnn(-c2ccccc2)c1	781803356	DZWQUNWCTIFCLV-OAQYLSRUSA-N	434.500	1.583	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)C(C)C)cc1NC(=O)C(=O)NNC(=O)c1ccc(O)cc1	782833192	YHJHVJMIVLLADJ-UHFFFAOYSA-N	448.501	1.129	50	20	IDGD	
Cc1nc(Cn2cc(C(=O)NNC(=O)c3ccc(Br)cc3Cl)nn2)no1	783262134	IARGCENBBKGIHW-UHFFFAOYSA-N	440.645	1.509	50	20	IDGD	
Cn1c(=NNC(=O)C(=O)Nc2cccc(CN3CCOC3=O)c2)sc2ccccc21	783351789	MEJKYWQMEZHUNV-UHFFFAOYSA-N	425.470	1.763	50	20	IDGD	
O=C(NNc1ccc(-n2cccn2)nn1)C(=O)N1CCc2cc(Br)cc(F)c21	783433517	VCOWULZBFRVLSH-UHFFFAOYSA-N	446.240	1.596	50	20	IDGD	
Cc1cc(F)ccc1NNC(=O)C(=O)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1	783447440	BKVSTBOHDFHQIG-UHFFFAOYSA-N	436.465	1.237	50	20	IDGD	
CC(=NNC(=O)[C@@H](C)CN1CCOCC1)[C@@H]1CN(C(=O)OCc2ccccc2)CCO1	783809190	ZVHRKTBSFAFZRY-PXNSSMCTSA-N	432.521	1.484	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)N1CCc2c1cccc2C(F)(F)F	784003170	AYZJZOLFURIOAH-UHFFFAOYSA-N	440.403	1.233	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NC[C@@H]1CCCCS1(=O)=O	784176313	NMTVYHMAHQACJA-RISCZKNCSA-N	448.339	1.514	50	20	IDGD	
CC(C)c1nnc(NC(=O)CCC(=O)OCC(=O)NNC(=O)c2cccs2)s1	784190033	WHCCTAMBYLHJAZ-UHFFFAOYSA-N	425.492	1.446	50	20	IDGD	
O=C1COc2ccc(NC(=O)C(=O)NNc3ccc(S(=O)(=O)C(F)F)cc3)cc2N1	784835396	NOCJBFUCSCXDRI-UHFFFAOYSA-N	440.384	1.096	50	20	IDGD	
COC(=O)[C@H](C)Cc1ccc(NC(=O)C(=O)NNc2ccc(C(F)(F)F)nn2)cc1	784885844	DKKGIDMQQWIBRG-SNVBAGLBSA-N	425.367	1.929	50	20	IDGD	
CN1C(=C(C#N)C(=O)COC(=O)CCOc2ccc(C(N)=O)cc2)N(C)c2ccccc21	786125621	OEKWZPYXSPDXFH-UHFFFAOYSA-N	434.452	1.988	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)[C@@H]1CC(c2c(F)cccc2F)=NO1	786169435	AIDPCSKOCOQGGE-ZDUSSCGKSA-N	427.408	1.313	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2cc(N3CCNC3=O)ccc2C)c2ccccc2c1=O	786283798	OEFWPMKDDLNUSX-UHFFFAOYSA-N	449.471	1.721	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)C(=O)Nc1ccc(CN(C)C)c(Br)c1	786416217	FICAXNPTYKIKFJ-UHFFFAOYSA-N	434.294	1.614	50	20	IDGD	
N#C/C(=C\C1CC1)C(=O)OCC(=O)N1CCN(S(=O)(=O)c2ccc(Cl)cc2)CC1	786679741	PYJAOOOERKLUSD-RVDMUPIBSA-N	437.905	1.576	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(C(=O)NNc2ccccc2S(N)(=O)=O)cc1	788227487	DYQAGVROTROANH-UHFFFAOYSA-N	426.520	1.121	50	20	IDGD	
CN(NC(=O)CC1CCC2(CC1)OCCO2)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	788531045	QBWQUFOTUAJQPU-UHFFFAOYSA-N	440.541	1.946	50	20	IDGD	
O=C(CNC(=O)NCc1ccc([N+](=O)[O-])cc1)NNc1nnc(-c2ccccn2)s1	788560242	KBDCGWOSQNDASA-UHFFFAOYSA-N	428.434	1.451	50	20	IDGD	
COC(=O)COc1ccc(C=NNC(=O)c2nn(-c3ccccc3)cc2O)cc1[N+](=O)[O-]	788703579	INNGTOPJXUGYPL-UHFFFAOYSA-N	439.384	1.802	50	20	IDGD	
CC(C)(C)C(=O)NC1CCC(C(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)CC1	788761157	ZFIDUTBNMQMNRT-UHFFFAOYSA-N	436.940	1.825	50	20	IDGD	
CC(=NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C)c1ccc(OC(C)C)c(Cl)c1	789039412	ZZOXWOSPBDZBLD-UHFFFAOYSA-N	446.895	1.415	50	20	IDGD	
Cc1cc(F)c(Br)cc1NC(=O)C(=O)NNc1ccc(-n2cccn2)nn1	789590028	PEVRSXKERGNJJO-UHFFFAOYSA-N	434.229	1.954	50	20	IDGD	
O=C(NNC(=O)[C@H]1OCC[C@H]1c1ccccc1)C(=O)Nc1ccc(C(=O)NC2CC2)cc1	789815149	ADZHABICUBCJRB-OALUTQOASA-N	436.468	1.237	50	20	IDGD	
COc1ccc(CC(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)nc1	789887403	GIEILUOMLZZSKH-UHFFFAOYSA-N	443.467	1.796	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)c2cnnn2-c2cccc(F)c2)CC1	789951852	YQDSJYHHIWJCGN-UHFFFAOYSA-N	447.471	1.750	50	20	IDGD	
C[C@](O)(Cn1cc(C(F)(F)F)ccc1=O)C(=O)NNC(=O)c1cnn(-c2ccccc2)c1	792171720	SWBZZWYGFHWNQB-IBGZPJMESA-N	449.389	1.265	50	20	IDGD	
CC[C@H](C)n1ncc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3OC)[nH]n2)c1C	792266254	OXXGZNHOUDCOKL-LBPRGKRZSA-N	439.476	1.961	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)COCc2ccccc2)cccc1NC(=O)N(C)C	792355860	JJOJFJTXPWAHOS-UHFFFAOYSA-N	427.461	1.391	50	20	IDGD	
CN(C)C(=O)c1cc(NC(=O)C(=O)NNc2ccc3c(=O)[nH]ccc3c2)ccc1Cl	793070370	QVTSQKVHXSMDQS-UHFFFAOYSA-N	427.848	1.965	50	20	IDGD	
COCc1cc(C(=O)OC)cc(S(=O)(=O)NNC(=O)c2cn(C)c3ccccc23)c1	793354335	UXYYFFCOPCGDJE-UHFFFAOYSA-N	431.470	1.735	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CCCCC/N=C2/NS(=O)(=O)c3ccccc32)n1	794089117	CEPVWORVCRHLIP-UHFFFAOYSA-N	429.502	1.450	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccc(F)cc1-c1cnn(C)c1	796991047	ZGRJKYAMCTYLGR-GFCCVEGCSA-N	443.410	1.919	50	20	IDGD	
CNC(=O)COc1ccc(NC(=O)C(=O)NNc2ccnc(Br)c2)c(C)c1	797086481	OXVXXCFBIHYDAD-UHFFFAOYSA-N	436.266	1.359	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2ccc(C#N)cc2)cc(Br)cc1[N+](=O)[O-]	797535890	QIZHFESVBDXNNW-UHFFFAOYSA-N	446.217	1.937	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)c2sc(S(N)(=O)=O)c(C)c2Cl)c1	798272512	BIVPYWRTLMSSET-UHFFFAOYSA-N	431.923	1.814	50	20	IDGD	
CS(=O)(=O)NCc1ccc(C(=O)NNc2cc([N+](=O)[O-])ccc2Br)o1	800619701	URCCIWYYYDDMQB-UHFFFAOYSA-N	433.240	1.756	50	20	IDGD	
COc1ccc(-c2nn(CCC#N)cc2/C=C(/C#N)C(=O)NC[C@](C)(O)CO)cc1OC	801976151	PCDQTUSZWVPVIH-NYBOLYEOSA-N	439.472	1.247	50	20	IDGD	
COC(=O)Cc1c(C(=O)OCC(=O)NNC(=O)Cc2nc(C)cs2)[nH]c2ccccc12	803713190	MRBGBYBALRBHQL-UHFFFAOYSA-N	444.469	1.195	50	20	IDGD	
CS(=O)(=O)CC[C@H](NC(=O)c1ccccc1Cl)C(=O)NNc1ncccc1F	804214747	ORYVREYRRJKJAN-AWEZNQCLSA-N	428.873	1.551	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)C(=O)Nc1cccc(F)c1Cl	806993046	NYLFUEIBRPUTJS-UHFFFAOYSA-N	427.845	1.172	50	20	IDGD	
COC(=O)c1cc(OC)c(OC)cc1NC(=O)C(=O)NNc1nccnc1C1CCC1	807461489	GTDRIVQGFMSLTO-UHFFFAOYSA-N	429.433	1.630	50	20	IDGD	
CC(C)n1nc(C(=O)NN=Cc2ccc(F)c(S(N)(=O)=O)c2)c2ccccc2c1=O	807952598	LNVDGHAUSNAYKB-UHFFFAOYSA-N	431.449	1.528	50	20	IDGD	
NC(=O)c1ccc(OCC(F)F)c(NC(=O)NNC(=O)COc2ccccc2F)c1	810343617	MIEIREGNETWQQW-UHFFFAOYSA-N	426.351	1.800	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(F)c(C(=O)OC)c2C)cc1OC	810385903	DPJPPUONGALOOY-UHFFFAOYSA-N	447.419	1.728	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)[C@H]2CCCN(C(=O)Cc3ccccc3)C2)cc1	812732739	AGWQSAMMHJDWBV-SFHVURJKSA-N	444.557	1.861	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)cc1	813033446	SZLXNFYQVXDEKE-UHFFFAOYSA-N	441.853	1.580	50	20	IDGD	
CCCN1C(=O)c2ccccc2N2C(=O)CC[C@@]12C(=O)NNC(=O)c1ccccc1OC	815542566	KOYUOZYIKBQKJR-HSZRJFAPSA-N	436.468	1.845	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1ccc([C@H]2CCOC2)cc1	815613344	LAFHFLSMRGONGT-AWEZNQCLSA-N	433.486	1.684	50	20	IDGD	
CCOc1ccc(NNC(=O)C(=O)N2C[C@@H](C[C@@H]3COCC(=O)N3)c3ccccc32)cc1	815817119	DJKSISWLTMFYLB-NVXWUHKLSA-N	438.484	1.564	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)c1cnn(C)c1I	816505066	LTDNTYPMBIEGEL-QMMMGPOBSA-N	448.648	1.907	50	20	IDGD	
O=C(COC(=O)CSc1cnc2ccccc2n1)NNC(=O)c1cccc([N+](=O)[O-])c1	844255897	URULISCTKRYIBG-UHFFFAOYSA-N	441.425	1.635	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)N2CCN(CC(=O)NCc3ccccc3)CC2)cc(C#N)n1C	914503277	GGDJIJOQAJTVRT-MTJSOVHGSA-N	430.512	1.573	50	20	IDGD	
COC[C@@H](C)n1c(C)cc(/C=C(\C#N)C(=O)N2CCN(S(=O)(=O)N(C)C)CC2)c1C	914504181	QTAWIFHCUHPVIV-PUMYGXPMSA-N	437.566	1.170	50	20	IDGD	
COc1cc(C=NNC(=O)CNc2ccc(C)cc2)ccc1OCC(=O)N1CCOCC1	915922013	VBUUDBYVFZIMEV-UHFFFAOYSA-N	440.500	1.803	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(CNC(=O)NNC(=O)COc2ccc(C)cc2)cc1	915924754	GHULYZZHRLOOKU-UHFFFAOYSA-N	448.545	1.935	50	20	IDGD	
Cn1ccnc1[C@@H](NC(=O)NNC(=O)COc1ccccc1[N+](=O)[O-])c1ccc(F)cc1	916221070	MSNDMRFUZYZCBC-SFHVURJKSA-N	442.407	1.966	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCc2cc(OC)ccc2OC)c2ccccc2c1=O	916261483	IDTAWYJYNJYNOB-UHFFFAOYSA-N	425.445	1.578	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1cccc(N(C)C)c1)c1ccc(S(=O)(=O)N(C)C)cc1	918105371	PRHOCYPLKKHAJT-CQSZACIVSA-N	433.534	1.708	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)COc1ccc(F)cc1)c1ccc(S(=O)(=O)N(C)C)cc1	918105648	SZHNMJIIGSXDTD-CYBMUJFWSA-N	438.481	1.546	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)NCCS(=O)(=O)c1ccc(Cl)cc1	919786630	XXJNNIZZNNLNAU-UHFFFAOYSA-N	435.893	1.714	50	20	IDGD	
O=C(CCSc1ccc(Br)cc1)NNC(=O)N[C@@H]1CCS(=O)(=O)C1	919887535	ADEHTCLORCESTQ-LLVKDONJSA-N	436.353	1.449	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCCNC(=O)c2ccc(F)cc2)cc(OC)c1OC	919916185	DJGACBWRFYHICF-UHFFFAOYSA-N	434.424	1.226	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cc3ccccc3c(OC)n2)cc1OC	920737682	RFBPNMNFTWVUBM-UHFFFAOYSA-N	439.424	1.879	50	20	IDGD	
O=C(O)c1cc(S(=O)(=O)NNC(=O)c2cncn2-c2ccccc2)c(Cl)cc1F	1115916196	XZYFDOMZEZDNBS-UHFFFAOYSA-N	438.824	1.986	50	20	IDGD	
CCS(=O)(=O)c1ccc(C(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1	1251914939	OUMMXQSGWRVKAB-UHFFFAOYSA-N	439.534	1.888	50	20	IDGD	
Cc1nc(N(C)C)sc1C(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	1255215362	AVTOFLVQTGJMKU-UHFFFAOYSA-N	426.543	1.767	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)NCCC(=O)NNc2cncc(Br)c2)cc1	1319644614	BSZYSVXQFHXWIX-UHFFFAOYSA-N	441.307	1.858	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)NCc2c(C)nn(CC(=O)OC)c2C)c1C	1319931711	BVUUGUPMJHNXEG-VXLYETTFSA-N	427.505	1.961	50	20	IDGD	
N#Cc1ccc(N2C[C@H](C(=O)NNC(=O)c3cc(-c4ccc(F)cc4)[nH]n3)CC2=O)cc1	1333548156	HPENDIXFJYPTSO-OAHLLOKOSA-N	432.415	1.902	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(Cl)Cl)C2)c1[nH]nc2ncccc12	1777914067	GQLZPDDHRIZIOA-KZULUSFZSA-N	426.304	1.889	50	20	IDGD	
Cn1cc(CCC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CO[Si](C)(C)C)C2)cn1	1779543590	JMJKVRPILZGWTC-WIYYLYMNSA-N	436.629	1.718	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(C(F)(F)F)nn3C)C2)C1	1779657180	KIGIEPXMCWINRT-MEDUHNTESA-N	438.834	1.136	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(CN(C(=O)CCC#N)CCO2)C1	1780096688	FMPCAAKLWATHEQ-HXUWFJFHSA-N	430.417	1.267	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](NC(C)=O)c3ccc(F)cc3)C2)C1	1780915150	LVVHZYLMBYRFCS-OPYAIIAOSA-N	439.915	1.850	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ncn(-c4cccc(F)c4)n3)CCO2)C1	1781213463	JFNYTYNUUITJHQ-OXJNMPFZSA-N	435.887	1.867	50	20	IDGD	
COC(=O)c1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](F)Br)C3)C2)cn1	1781329345	DWWJKMVUIBMASS-GUYCJALGSA-N	444.257	1.002	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)n2ccnn2)C1	1781545981	BEUSFIRFEDQHFW-LUXYFRNMSA-N	442.358	1.384	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CN1CCCCC1=O)C2	1782002220	OMGGOSJSDWRNDR-QMTMVMCOSA-N	444.370	1.296	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@](C)(Cl)CCl)C2	1782178469	JUWWJSOHXVPJBY-UTJXIGIESA-N	429.772	1.990	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H]1CCCN1C(C)C)C2	1782179175	UYTQCIUYTXODRE-BMQTXXJKSA-N	429.989	1.627	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cn(C(C)(C)C)nn3)CCO2)C1	1783351869	MQTRGIWZMSXUJV-ACJLOTCBSA-N	442.358	1.650	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3csc(C(F)(F)F)n3)CCO2)C1	1783877941	SEAFCSPUMPQQEG-ZUZCIYMTSA-N	441.859	1.859	50	20	IDGD	
CCn1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]3C2)n1	1783967822	MLLPUJHXGKWFEM-HOSILWTGSA-N	427.343	1.527	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C3CCN(c4ccccc4)CC3)C[C@@H]21)[C@@H](O)CCl	1784084600	YTNCHEZLEABSMQ-VMXMFDLUSA-N	449.979	1.482	50	20	IDGD	
C[C@H](Oc1ccccn1)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1784488099	MWLOEJRENXVYKQ-JDFRZJQESA-N	430.274	1.369	50	20	IDGD	
Cc1ccc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)CBr)C[C@@H]32)cn1	1785397298	GZTCSSHPAAVJKE-MGHWNKPDSA-N	438.366	1.943	50	20	IDGD	
CCOC(=O)C(C)(C)C(=O)N1CC[C@]2(CN(C(=O)[C@@H](Br)CC)CCO2)C1	1785525165	KRHRZAVQFMZPSA-UGSOOPFHSA-N	433.343	1.579	50	20	IDGD	
Cn1ccc(CC(=O)NC2(c3ccc(NC(=O)c4cccc(B(O)O)c4)cc3)CCC2)n1	1788143539	CBTLHFIXPAYISY-UHFFFAOYSA-N	432.289	1.090	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Br)C[C@@H]32)o1	1788606969	XIKBFHMTWLGFDP-UHXUCMFUSA-N	446.273	1.522	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc([N+](=O)[O-])[nH]3)[C@H]2C1	1789389257	CQXSTIOOAXCJPX-UHXUPSOCSA-N	443.298	1.547	50	20	IDGD	
O=C(NC1(c2ccc(NC(=O)c3ccc(CO)o3)cc2)CCC1)c1cccc(B(O)O)c1	1789762587	ZNYPFVMHUZZVJP-UHFFFAOYSA-N	434.257	1.513	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)NC(=O)c3ccccn3)C[C@@H]21	1789865529	XEMDTWBUWJVITR-FDPKGLCPSA-N	436.940	1.197	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)COc3cccnc3)C[C@@H]21	1789868897	ROEDOGDKKYWDQX-QBWPOKONSA-N	430.332	1.676	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)c1n[nH]c2c(Cl)cccc12	1790340144	HSDIERJTVQOWOD-LVGORTOPSA-N	441.315	1.409	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)n3cccn3)C[C@@H]21	1790963742	LAPKLXVYIKGKNJ-YXMSTPNBSA-N	427.343	1.597	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C#CC3(O)CCCCC3)C[C@@H]21	1791055785	HXHUWMRBUMHDDV-QAETUUGQSA-N	441.366	1.448	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccn4c(C)cc(C)nc34)C[C@@H]21	1791256566	BSDGMNVUYMJNTN-KANFNMMFSA-N	448.951	1.798	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)c3ccccc3Cl)[C@H]2C1	1791473475	YUVHJGRJJAYUQB-FZGQVQIUSA-N	445.343	1.607	50	20	IDGD	
Cc1cccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)c1F	1792726786	MEMGUTKHBASMHP-QDMKHBRRSA-N	425.464	1.698	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccccc1OC(F)(F)F)C2)[C@H](O)CCl	1792975251	OMTJEZAXHNGVOK-NDPMZMCLSA-N	436.814	1.388	50	20	IDGD	
COc1cc(OC)c(F)c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](O)CCl)c1F	1793110673	XBRNOFGCYYTQPH-USZNOCQGSA-N	432.851	1.834	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCl)c1cc(Br)ncc1F	1793112531	QVYSWDWOKSOFQS-BSTOTGJRSA-N	434.693	1.835	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCl)c1cc(Br)ncc1F	1793112533	QVYSWDWOKSOFQS-WJZNIJOASA-N	434.693	1.835	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@H](F)C[C@H]1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCl	1793117194	GOPMRNILQNSIPV-IATJYDTKSA-N	447.935	1.572	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CC(c2ccccc2)=NO1	1793281247	OWLMZHDTNVCCOK-CTRAYCPCSA-N	435.908	1.023	50	20	IDGD	
COc1ncc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)CBr)C3)cc1F	1794361543	NADSBIDVFWOQQN-IKVITTDRSA-N	444.301	1.464	50	20	IDGD	
CS(=O)(=O)c1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CCBr)C3)nc1	1794746126	MFRQTEHRIQELRS-CLLJXQQHSA-N	444.351	1.522	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)c1	1796190172	XFXAZDLEHMRIAP-WKCHPHFGSA-N	436.317	1.314	50	20	IDGD	
Cc1ccc2[nH]c(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3cccc(B(O)O)c3)cc2c1	1796191082	XATFQEKRERTXLR-ACDBMABISA-N	431.301	1.722	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(OC)cn1	1796730542	CFADVGKVQRDWAD-LMWOUKEDSA-N	426.311	1.467	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnc2ncccn12	1797028535	PECFEPBOIXTMCR-AZGFTEDZSA-N	426.304	1.169	50	20	IDGD	
C[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@](C)(Cl)CCl)n1ccccc1=O	1799277509	WKJOQAVTWVMXTG-WXZWTWHISA-N	430.332	1.235	50	20	IDGD	
Cc1cc(F)cc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Br)c1	1799352396	UHSYOMKATAKBCG-RMHZUWNSSA-N	431.277	1.957	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(C(F)(F)F)c1)c1cccc(B(O)O)c1	1799645190	OGJTWYYZTOTBMM-REPLKXPHSA-N	446.234	1.951	50	20	IDGD	
COCCOCCOCCOCCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](F)Cl)C2	1800204022	FBFQXPIJUIWCNI-KYHPRHEASA-N	438.924	1.245	50	20	IDGD	
CC(C)=NO[C@@H](C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2	1800220068	IPIBBCWHZQJHIM-AECQCBAMSA-N	430.509	1.560	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1noc3ccccc13)C2	1800756980	SJIXVFJWFUCQCK-JWXAPSBJSA-N	436.306	1.743	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C=C/c1cc(F)cc(OC)c1	1800856130	BSITZCZMZCHMNC-JGWYLNEVSA-N	440.899	1.691	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3cc(OC)ccc3n1)C2	1800978260	QHQKTSQICQUJIA-DOHHPOSVSA-N	447.919	1.700	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C=C/c1ccc(O)c(O)c1O	1802079143	UMYQKBQSUKQQDO-AKPDTCSLSA-N	438.908	1.814	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc3c(c2)OCCO3)[C@H]1c1cccnc1)[C@@H](O)CCl	1803138680	DCXDBDSDBVFZMG-ZWOKBUDYSA-N	445.903	1.772	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccn3nccc3c2)[C@H]1c1cccnc1)[C@@H](O)CCl	1803142656	GMPFOOTVRGOCTH-WDSOQIARSA-N	427.892	1.649	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)nc2nccn12	1803148033	NJSXSDYSCKVGQH-NXHRZFHOSA-N	442.907	1.352	50	20	IDGD	
Cn1nc(C(=O)NC[C@@H]2CCN(C(=O)[C@H](F)Br)[C@@H]2c2cccnc2)cc1O	1804898891	VSDMNTLNQJTFPP-GLQYFDAESA-N	440.273	1.531	50	20	IDGD	
COCCOCC(=O)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@H]1c1cccnc1	1806760158	ZTHWBICUOAMQSE-BPUTZDHNSA-N	432.290	1.441	50	20	IDGD	
Cc1csc(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)c1	1807366662	VHAPMXKZBHXENY-GHTZIAJQSA-N	449.341	1.765	50	20	IDGD	
Cc1ccn(C)c1C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1807373451	BCFQIMVGEJBHSA-SIKLNZKXSA-N	446.316	1.042	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@@H](CNC(=O)Cn2ccnn2)[C@H]1c1cccnc1	1807674623	MATLCDVAZVHJNQ-UKPHBRMFSA-N	435.326	1.410	50	20	IDGD	
CCOC(=O)/C=C/C(=O)N1CC[C@H](CNC(=O)[C@H](F)Br)[C@@H]1c1cccnc1	1808662378	YXQBBJNAUMQYGC-WQBNKDABSA-N	442.285	1.897	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC2(CCCN(C(=O)/C=C/c3ccccc3N)C2)CC1	1809854837	HIKKOOQNWYOQMQ-CSKARUKUSA-N	441.576	1.886	50	20	IDGD	
CCN(CC)C[C@H](C)C(=O)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1	1809973300	GNONXPLHGRCLHW-IBGZPJMESA-N	443.397	1.189	50	20	IDGD	
O=C(c1ccc2n[nH]cc2c1)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1	1809978454	UBTHHRUUXDVAKG-UHFFFAOYSA-N	446.316	1.401	50	20	IDGD	
CCNC(=S)NCC(=O)NC[C@@H]1CCN(C(=O)[C@H](Cl)CC)[C@H]1c1cccnc1	1812333185	SUXJOWALOVVHTP-UXLLHSPISA-N	425.986	1.589	50	20	IDGD	
Cc1nocc1C(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1813070575	JONPGKLBCYOIPW-OXJNMPFZSA-N	428.493	1.071	50	20	IDGD	
CC1(C)CC(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)C1	1813126878	YDLQMIYBKGUXRA-NQIIRXRSSA-N	435.333	1.517	50	20	IDGD	
CC(=O)N/C(=C\c1ccco1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](O)CCl)n[nH]1	1814873147	STLNZETUCPRWQI-JWULFMQYSA-N	449.895	1.772	50	20	IDGD	
CCS(=O)(=O)N[C@H](C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)C(C)(C)CCl)[nH]n1	1815165002	OLGYAXMZCQOPEW-TZMCWYRMSA-N	447.989	1.995	50	20	IDGD	
N=C1NCCN1CC(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCBr)n[nH]1	1816782130	KBEUKSPEGOPVIK-GFCCVEGCSA-N	426.319	1.027	50	20	IDGD	
COC[C@@H](NC(C)=O)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCBr)n[nH]1	1816782748	YRSRTOZCEPMTHZ-ZIAGYGMSSA-N	444.330	1.338	50	20	IDGD	
O=C(Cc1ccccc1)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1816889103	KJOWBGAJYCOLLZ-FQEVSTJZSA-N	432.289	1.638	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cncc(F)c2)[nH]n1)c1ccc(B(O)O)cc1	1817470915	MKWFBRXJVJWVQU-SFHVURJKSA-N	437.240	1.243	50	20	IDGD	
N#Cc1ccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)cc1	1820550627	ZOULLTAYXHVBTA-HXUWFJFHSA-N	443.272	1.581	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)C[C@@H](NC)C(=O)O)[nH]n1	1822087146	GOSWZKQVWMMEGH-UHTWSYAYSA-N	444.330	1.638	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](Cl)COC)n[nH]1	1822371077	RDANAKZWAZNXKD-YRGRVCCFSA-N	428.921	1.363	50	20	IDGD	
CCC[C@H](NC(C)=O)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](Cl)COC)n[nH]1	1822376265	FPYZDRPTUWCOAK-IJEWVQPXSA-N	427.933	1.960	50	20	IDGD	
O=C(N[C@@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1)c1cc(O)ncn1	1822999476	SCTVDJSJMCDTAG-KSBSHMNSSA-N	430.259	1.555	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)CCN2CCN(C)CC2)CC1	1826727011	YDSROWSWZASINW-VQTJNVASSA-N	443.032	1.497	50	20	IDGD	
CC(C)(C)[C@H](O)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827048948	DMIHCIZTDDTWNA-WOJBJXKFSA-N	430.354	1.007	50	20	IDGD	
O=C(C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1)c1ccccc1	1827051171	OTYKTEYFZGGVCP-JOCHJYFZSA-N	448.328	1.483	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)[C@]3(C)CC3(F)F)sc2C1	1828054698	JGFAMHLILRGKOQ-QGHHPUGFSA-N	429.493	1.473	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2nccnc2C(N)=O)CC1	1829106024	HMFFCQUSNOXZLJ-INIZCTEOSA-N	447.612	1.660	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)CC[C@H]3CCOC3)C2)C1	1830545001	DLAWPARHIRXPSS-JTDSTZFVSA-N	447.370	1.291	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@](C)(O)C(F)(F)F)C2)C1	1831640527	NDYZLWNRFAXOHN-MAZHCROVSA-N	430.851	1.164	50	20	IDGD	
CCCC(=O)N[C@H](C)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H](Cl)CCC)CCO2)C1	1831651587	RPLCBFGREMDIHH-GQIGUUNPSA-N	431.961	1.155	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2c[nH]c(=O)cn2)CC1	1831661387	QRKGBQYMXASIKL-IUODEOHRSA-N	425.327	1.787	50	20	IDGD	
O=C(/C=C/c1ccc(F)cc1F)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1832136989	IFDCHRUTUAMGPD-CCJIBRKGSA-N	432.826	1.969	50	20	IDGD	
Cc1cc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](C)CBr)C3)C2)on1	1832563790	LAIMFRORITVBLX-UGSOOPFHSA-N	444.326	1.013	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3noc4c3CCCC4)CC2)CC1)[C@@H](O)CCl	1833310986	ZXSVGHWDIHPMGC-KRWDZBQOSA-N	438.956	1.338	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)Cc3cc(C)n(C)n3)CC2)CC1	1833370098	WGWVQBABKFVHCC-IBGZPJMESA-N	439.988	1.096	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ncc(OC)cc3F)CCO2)C1	1833634777	ZVTQGWOHEWLMBZ-LIRRHRJNSA-N	429.876	1.317	50	20	IDGD	
Cc1occc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)CBr)C2)C1	1834134096	VXDDOFDEOGQAES-ACJLOTCBSA-N	429.311	1.689	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)C3CCOCC3)CC2)CC1	1834547499	IEUJCYOBQFGKPC-AWEZNQCLSA-N	430.387	1.768	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)CCC3CCC3)CC2)CC1)c1ccc(B(O)O)cc1	1834798161	YATDIHHMYMSITA-UHFFFAOYSA-N	441.381	1.132	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](NC(C)C)C(C)C)CCO2	1835893132	ROHIPLYAHLXGJJ-BBTUJRGHSA-N	432.005	1.873	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3cnn(C)c3)CCO2)C1	1835985437	OOUHVOYUVCWFTJ-YLJYHZDGSA-N	426.945	1.217	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)CCSC(=N)N)CC2)CC1	1837865034	KOVNAAAMVAXIMZ-GFCCVEGCSA-N	449.415	1.785	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3ccc(Cl)nn3)CC2)CC1	1838449085	RMNDRYWVLCHGCM-OAHLLOKOSA-N	445.347	1.996	50	20	IDGD	
CCc1cc(C(=O)N2CCC(OC3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)no1	1838484996	HKTHVPORHBLMHW-UHFFFAOYSA-N	449.552	1.222	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](C)n3ccnn3)CC2)CC1	1838730507	XKEBBGFLDXNAGE-ZIAGYGMSSA-N	442.358	1.621	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CC=CCC1)CCO2	1839130187	NSQDBYFSFAXYFF-FCEWJHQRSA-N	429.355	1.973	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CSc3ccncc3)C2)C1	1839142204	JHLUIOBYRFWCLZ-QFBILLFUSA-N	427.954	1.648	50	20	IDGD	
O=C(/C=C/c1ccccc1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839198824	CDZAVIBCMIBRPK-BUPXIBQPSA-N	441.297	1.847	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(C)cc(F)c3)CCO2)C1	1839285549	DEZDMEPAXJHQRU-YLJYHZDGSA-N	428.888	1.458	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](Br)CC)CCO2	1839965514	APYGVCNSNCASEL-HEHGZKQESA-N	425.751	1.634	50	20	IDGD	
CC(C)n1nccc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)Br)CCO2	1840033385	BYPJJNRUKHXIDR-KSSFIOAISA-N	443.342	1.317	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3cnccc3C)C2)C1	1840150899	SJTUGYFYDDAXLQ-RXVVDRJESA-N	439.940	1.033	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(F)c(F)c3)C2)C1	1840154312	RWMDDWXCKVGGGZ-LIRRHRJNSA-N	432.851	1.289	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3C[C@@H]3c3ccccc3)C2)C1	1840156556	VEUQFDQICRPXDQ-GHDARCQNSA-N	436.936	1.500	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)C(Cl)Cl)CCO2)C1	1840187352	VAZAWNJCAXAFSH-YGRLFVJLSA-N	432.142	1.278	50	20	IDGD	
Cc1cccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)c1Cl	1840690052	LXQNRVZZKFPGPG-HNAYVOBHSA-N	431.316	1.318	50	20	IDGD	
Cn1nc(C(=O)N2CC3(CCCN3C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)cc1O	1841924151	BREXXJNPUBUBRZ-ZDUSSCGKSA-N	441.916	1.075	50	20	IDGD	
Cc1csc(CCC(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)c1	1842042666	QRBCONJBUDNEER-UHFFFAOYSA-N	427.530	1.505	50	20	IDGD	
O=C(/C=C/c1ccc(F)cc1F)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843013206	UIUYPQAYYNOAGO-SOFGYWHQSA-N	426.228	1.175	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)C1(C(F)(F)F)CC1)C2	1843416309	VMAIBLKWBDWCTB-WYMPLXKRSA-N	425.411	1.666	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@H](O)CCNC(=O)OC(C)(C)C)C1	1845221394	SWZKBVYBBDXMRH-LSDHHAIUSA-N	431.961	1.873	50	20	IDGD	
CC(=O)N(C)CCC(=O)N1CC2(CCCN2C(=O)/C(C#N)=C/c2ccc(F)cc2F)C1	1845870547	YVGINTHZNMXUCY-LICLKQGHSA-N	430.455	1.944	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)CC2CN(C(=O)OC(C)(C)C)C2)C1	1847026736	VYGVBDFLMURHPC-HNNXBMFYSA-N	429.945	1.701	50	20	IDGD	
O=C(Nc1ccc(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](O)CCl)cc1)c1ccco1	1847561866	JOTWKRHEQQVPEI-YESZJQIVSA-N	431.876	1.947	50	20	IDGD	
C=CCC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl	1847564817	DIBSEFMRRUZXPD-UGUYLWEFSA-N	429.945	1.647	50	20	IDGD	
CN(CC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)/C=C/C1CC1)NC(=O)NCc1ccccc1	1847587793	XVMIBNYNUSKMDE-JNTVOPSESA-N	425.533	1.501	50	20	IDGD	
C=CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](Cl)COC	1847942336	SHNXRVIIEKFUKW-VGWMRTNUSA-N	429.945	1.911	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)c([N+](=O)[O-])cc1OC	10159637	BLNGKLFQCVGUMB-UHFFFAOYSA-N	441.400	1.968	50	20	IDGD	
Nc1c(Cl)cc(Cl)cc1C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	10960668	VPSXFLKPDPHMRU-AWEZNQCLSA-N	440.239	1.720	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@H]2CC(=O)N(Cc3ccccc3)C2)cc(OC)c1OC	13623012	JGFULZSACFAUGV-INIZCTEOSA-N	427.457	1.522	50	20	IDGD	
COC(=O)CCCNC(=S)NNC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1	18141305	FQDCNUIDTDKZJJ-UHFFFAOYSA-N	438.513	1.996	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)CN1C(=O)N[C@]2(CCCC[C@H]2C)C1=O	25413510	SWCFVKMZZSYFHM-SZNDQCEHSA-N	432.477	1.112	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](NC(=O)COc2ccccc2)C(C)C)cc1C	726281136	BIBAWPNSAORASD-FQEVSTJZSA-N	440.500	1.609	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])c(C)c2)n1	726522112	ARXGZYWIDSWGAJ-KRWDZBQOSA-N	428.449	1.169	50	20	IDGD	
Cc1nn(CCC(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)c(C)c1[N+](=O)[O-]	726523381	KGDCJJZUGOUIBQ-UHFFFAOYSA-N	441.448	1.550	50	20	IDGD	
CN(C)C(=O)NNC(=O)c1ccccc1COc1ccccc1C(=O)NNC(=O)N(C)C	727736194	JREMWIGTGXTCMO-UHFFFAOYSA-N	442.476	1.098	50	20	IDGD	
CCOc1ccc(C(=O)NNS(=O)(=O)c2cc3c(cc2Cl)NC(=O)C3)cc1OC	728016474	YUZCREHEPXTZFI-UHFFFAOYSA-N	439.877	1.865	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3ccc(N(C)C)c(F)c3)cc2)CC1	728216110	QRYPLYBTRNOCOF-UHFFFAOYSA-N	435.525	1.585	50	20	IDGD	
Cc1nc(-c2ncccn2)nc(O)c1CC(=O)NNC(=O)[C@@H](C)Oc1ccccc1F	729283917	YDOKQVSEGHUPGU-GFCCVEGCSA-N	426.408	1.244	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(C(=O)NNC(=S)NCC2CCC2)cc1Br	729689827	RUJRQEYUUBLVBV-UHFFFAOYSA-N	449.396	1.608	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)[C@H](CCSC)N1C(=O)[C@@H]2CCCC[C@H]2C1=O	731491146	CQHPEWVHFGCDAM-FMKPAKJESA-N	433.530	1.753	50	20	IDGD	
CC(C)c1nc(C#N)c(NNC(=O)[C@@H]2CCCC[C@@H]2C(=O)N[C@@H]2CCS(=O)(=O)C2)o1	731620823	OSCVZBHTPJADLJ-HZSPNIEDSA-N	437.522	1.222	50	20	IDGD	
CCc1nc(C(=O)NNC(=O)CCN2C[C@@H](C)O[C@H](C)C2)nn1-c1ccccc1Cl	732263443	MPUKIBHKRQWWKH-ZIAGYGMSSA-N	434.928	1.743	50	20	IDGD	
C[C@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)NNc2ccc(Br)nc2)C1=O	732835911	BLXXWHVJAOBUGP-QGZVFWFLSA-N	436.241	1.894	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)NCCN1CCN(C(=O)C2CCCCC2)CC1	733351031	LAWQBYUCIINBOG-UHFFFAOYSA-N	433.528	1.423	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc2c(c1)C(=O)NCC2)c1ccc(F)cc1Br	734806769	IQJUHJBBRSYYLX-UHFFFAOYSA-N	442.266	1.497	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)N1CCN(Cc2ccc(Cl)cc2)C(=O)C1	738475962	QWUAOBDDQDKQPN-UHFFFAOYSA-N	449.920	1.217	50	20	IDGD	
CCO[C@@H]1C[C@@H](O)C12CCN(CC(=O)NNC(=O)c1cc(Cl)ccc1OC)CC2	741255357	JGNAOGGNSWUFAK-IAGOWNOFSA-N	425.913	1.362	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCC[S@](=O)C(C)(C)C)c1	741415323	KKCLHOKTPUUQAY-NDEPHWFRSA-N	446.595	1.208	50	20	IDGD	
CCCn1c(C)cc(/C=C(\C#N)C(=O)Nc2cnn(CC(=O)NCCN(C)C)c2)c1C	741608899	WYDLROWIBAWBEL-YBFXNURJSA-N	425.537	1.935	50	20	IDGD	
CS(=O)(=O)c1cccc(S(=O)(=O)NNC(=O)c2cccc(Br)c2)c1	743264550	YIZVPNUINSNHAN-UHFFFAOYSA-N	433.305	1.476	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)c2cccc(I)c2)cc1	744476607	PZSBJAXNGIFOCX-UHFFFAOYSA-N	449.204	1.781	50	20	IDGD	
COc1ccc([C@H](CC(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)NC(C)=O)cc1	744512638	SLNWLRUXJTVHOQ-IBGZPJMESA-N	438.440	1.139	50	20	IDGD	
CC(C)C(=O)N1CCCC[C@H]1C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	744619556	SGDUZNZRXJOMDI-KRWDZBQOSA-N	438.550	1.188	50	20	IDGD	
CC(=O)N[C@H](CC(=O)OCC(=O)NNC(=O)c1ccc(C)cc1)c1ccc(F)cc1F	745141742	PTOUBXLLNNJDEA-GOSISDBHSA-N	433.411	1.845	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)N[C@H]1CC(=O)N(CCOc2ccccc2)C1	745846318	GISGKCNVSJNNPN-HNNXBMFYSA-N	427.417	1.219	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)c2ccc(F)c(S(=O)(=O)Cc3ncon3)c2)cc1	746185727	PYZCHQDTKSILGP-UHFFFAOYSA-N	429.389	1.129	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)c1cccc(S(=O)(=O)NC2CCCC2)c1	746548034	CCASWVKKFAWYCT-UHFFFAOYSA-N	441.513	1.559	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N1CCC[C@@H](CC(N)=O)C1	747491187	QJBNQPIRSBVPBG-RYUDHWBXSA-N	427.299	1.545	50	20	IDGD	
Cn1c(=O)c2cc(NC(=O)C(=O)NNc3ccc(Cl)cc3Cl)cnc2n(C)c1=O	747703797	ZTYKVNPYYXNOOL-UHFFFAOYSA-N	437.243	1.021	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2ccc(Cl)cc2Cl)cnc2c1c(=O)n(C)c(=O)n2C	747724306	CHPGBZNNINHCKM-UHFFFAOYSA-N	436.255	1.322	50	20	IDGD	
C[C@@H](C(=O)N(C)CC(=O)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1)n1cccn1	748522768	FUSIHYPLTATOEF-NSHDSACASA-N	433.412	1.339	50	20	IDGD	
C[C@@H](CC(=O)OCc1ccccc1)NC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	753133203	XLMLOCMCRGFUHW-AWEZNQCLSA-N	448.501	1.948	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)c3cc(OC)no3)c2)cc1	753981496	LSWRFKVLANPBIA-UHFFFAOYSA-N	446.441	1.567	50	20	IDGD	
Cc1c(C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c(=O)oc2ccccc12	754612219	MNNFIFOAIRNSBC-UHFFFAOYSA-N	425.353	1.628	50	20	IDGD	
COCCN(C)S(=O)(=O)[C@H]1CCCN(C(=O)NNC(=O)CCCc2ccccc2)C1	755238416	JSBQVNONQOTZCM-SFHVURJKSA-N	440.566	1.123	50	20	IDGD	
C[C@H](NC(=O)OC(C)(C)C)[C@H](C)C(=O)NNC(=O)c1csc(N2CCOCC2)n1	755327293	UGVXRGYEFVSFCB-RYUDHWBXSA-N	427.527	1.290	50	20	IDGD	
O=C(CCCc1ccccc1)NNC(=O)Nc1cccc(S(=O)(=O)N2CCOCC2)c1	755353426	HJSPWNGQCWIZGZ-UHFFFAOYSA-N	446.529	1.883	50	20	IDGD	
COCC(=O)Nc1ccc(NC(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)cc1	755639752	SFIBCJUBIJNZFK-UHFFFAOYSA-N	432.433	1.764	50	20	IDGD	
COCCOc1ccc(NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1Cl	756166058	PJXGVESSTDXIRF-UHFFFAOYSA-N	431.840	1.807	50	20	IDGD	
COCCS(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)cc1	756556305	WEFUVKJYWRCIGD-CYBMUJFWSA-N	439.465	1.866	50	20	IDGD	
COCCCOc1cccc(NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c1	756895355	UKPHZOLKBMJFMK-UHFFFAOYSA-N	425.445	1.815	50	20	IDGD	
NC(=O)c1ncn2c(C(=O)NNc3nc(O)c4ccccc4n3)cc(-c3ccco3)nc12	758296156	UEXSZSWTZJYVAO-UHFFFAOYSA-N	430.384	1.494	50	20	IDGD	
O=C(NNC(=O)C(=O)Nc1ccccn1)NC1CCN(c2ccc(OC(F)F)cc2)CC1	758741381	SNXJKQRSRPHCGF-UHFFFAOYSA-N	448.430	1.621	50	20	IDGD	
CS(=O)(=O)c1ccc(CNC(=O)NNC(=O)COc2ccc(F)cc2)cc1Cl	759403840	OCCVYWAFMAKBKC-UHFFFAOYSA-N	429.857	1.792	50	20	IDGD	
CCS(=O)(=O)c1cc(F)ccc1NC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	760010108	NUBGBJNQNLWMNP-UHFFFAOYSA-N	443.478	1.489	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)Cc2cccc(I)c2)C[C@H](C)O1	760988089	OGOSYLJRCNPESH-STQMWFEESA-N	445.301	1.480	50	20	IDGD	
Cc1cc(-c2noc([C@@H](C)NC(=O)NNC(=O)C(=O)Nc3ccccn3)n2)ccc1F	761789886	FRRSLRBUVCMIJE-LLVKDONJSA-N	427.396	1.609	50	20	IDGD	
CCc1ccc(S(=O)(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)cc1C(=O)O	763439081	IEYXUPLAUCQQRZ-UHFFFAOYSA-N	429.495	1.562	50	20	IDGD	
O=C(NNC(=O)c1ccccn1)C(=O)Nc1cc(F)c(I)c(F)c1	763467843	TZUMBJWLONGCBW-UHFFFAOYSA-N	446.151	1.364	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(OCC(F)(F)F)cc1	763471075	CGZLYPXWVAHDQO-UHFFFAOYSA-N	426.307	1.936	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccn([C@H](C)c3ccccc3)n2)cc1OC	763544272	UKHQBQYXKBEJCT-CQSZACIVSA-N	437.456	1.909	50	20	IDGD	
CN(C)CCn1ccc(NC(=O)C(=O)NNC(=O)c2sc3ccccc3c2Cl)n1	763579973	ZMQMQQWTCZJRLS-UHFFFAOYSA-N	434.909	1.713	50	20	IDGD	
CC(C)(C)c1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(-n3ccnn3)cc2)cc1	763601397	YPLHLFCOVRKSAT-UHFFFAOYSA-N	436.472	1.730	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(C)n(-c2ccc(C)cc2)n1	763663735	NJBUCIPIZRLUTC-UHFFFAOYSA-N	437.456	1.663	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)C(=O)Nc1ccc(OCc2cccnc2)cc1	763681849	RHUWDKCRONJCQA-UHFFFAOYSA-N	438.415	1.965	50	20	IDGD	
CC(=O)N(Cc1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2F)cc1)C1CC1	763682117	XJSRDPWPYQLCRV-UHFFFAOYSA-N	442.447	1.502	50	20	IDGD	
CNS(=O)(=O)c1cc(NC(=O)C(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)ccc1C	763723015	MXLQGLSYSLOUKQ-UHFFFAOYSA-N	448.545	1.205	50	20	IDGD	
CCCOC(=O)c1ccc(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)cc1	763745713	IXJDDHPLBUEOKY-UHFFFAOYSA-N	438.484	1.792	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2ccnn2Cc2ccccc2F)c1	763771969	JDVAYAQGCSIQNH-UHFFFAOYSA-N	441.419	1.487	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1cncc(Br)c1	763872030	JPCBEVMBLPPVPE-VIFPVBQESA-N	425.214	1.537	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)C(=O)Nc1ccc(Cl)cc1I	763993305	NQIQJNHPJOZEDQ-UHFFFAOYSA-N	446.632	1.683	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2cc(C)nn2-c2ccccc2F)c1O	764132759	QHZOPTSLXQHIMZ-UHFFFAOYSA-N	427.392	1.434	50	20	IDGD	
Cc1ccc(C(=O)NCC(F)(F)F)cc1NC(=O)C(=O)NNC(=O)c1ccc(C#N)cc1	764176240	AGHFRMOKPIRDEN-UHFFFAOYSA-N	447.373	1.559	50	20	IDGD	
C[C@H](C(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)CCc2ccccc2)c1)n1cccn1	764187515	GIBQAXXESSPZPV-MRXNPFEDSA-N	448.483	1.802	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)C(=O)Nc1ccc(-c2ncon2)cc1	764203575	AKGFIPUFCRKQJR-UHFFFAOYSA-N	432.437	1.127	50	20	IDGD	
Cc1cc(C(=O)NC(C)C)ccc1NC(=O)C(=O)NNC(=O)COCc1ccccc1	764362295	CYZGTPKXNCFEHE-UHFFFAOYSA-N	426.473	1.436	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1)C(=O)Nc1cnn(-c2ccncc2)c1	764386862	CYSFUKKHSKRPRV-UHFFFAOYSA-N	434.391	1.196	50	20	IDGD	
CCOC(=O)NNC(=O)C(=O)Nc1ccc(S(=O)(=O)N(C)C2CCCCC2)cc1	765405883	WCNSRCZWWMFFHV-UHFFFAOYSA-N	426.495	1.356	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2cc(C)ncn2)c(I)c1	765708651	LHZBKTCSCYGOJY-UHFFFAOYSA-N	427.202	1.480	50	20	IDGD	
C[C@H](NC(=O)c1ccoc1)C(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	765757800	GKJCFKMAPHMSES-HNNXBMFYSA-N	447.923	1.017	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3c(F)cc(C#N)cc3F)CC2)cc1	766644691	OMRFUBJOHUMJEX-UHFFFAOYSA-N	427.455	1.724	50	20	IDGD	
Cc1ccc(C(C)(C)C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)cc1	769106202	POGKHOCZNPKDRI-UHFFFAOYSA-N	431.562	1.747	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(OC)c(C(=O)NNC(=S)NCCSC)c1	769780060	UHSXSJVBZZAGSV-UHFFFAOYSA-N	434.609	1.198	50	20	IDGD	
C[C@H]1CCCC[C@]12NC(=O)N(CC(=O)NNc1nc(O)c3cnn(C(C)(C)C)c3n1)C2=O	770958077	HMLSLBVHVMKEFX-YBTHPKLGSA-N	444.496	1.231	50	20	IDGD	
O=C(NNC(=O)c1c[nH]c2ccc(I)cc2c1=O)c1ccccn1	771827465	SFTQSHWELNUWLK-UHFFFAOYSA-N	434.193	1.603	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1cccc(S(=O)(=O)N2C[C@@H](C)C[C@H](C)C2)c1	771886858	DRHPAMMPCIXZCQ-KKUMJFAQSA-N	439.534	1.456	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)CNC(=O)NCc1ccc([N+](=O)[O-])cc1	772966033	GLIRRIOGTBTPAX-GFCCVEGCSA-N	449.851	1.662	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCCc2nn(C)c3ccccc23)cc(OC)c1OC	773130499	DSEVJGDRWIVRHQ-UHFFFAOYSA-N	427.461	1.786	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(F)c(S(C)(=O)=O)c(F)c2)cc1F	773888225	GWHWKIFHHCOVMR-UHFFFAOYSA-N	429.376	1.216	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccc(C(N)=O)c(Cl)c1	774010021	UJMOVCUKCXGEEO-VIFPVBQESA-N	439.255	1.646	50	20	IDGD	
CCn1cc(-c2n[nH]cc2C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)cn1	778940285	BFZJNHRZSDQIEL-UHFFFAOYSA-N	445.505	1.071	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(F)(F)c1ccccc1OCC(=O)N(C)C	779179820	BHCIVANVFAMGEF-UHFFFAOYSA-N	435.427	1.644	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2ccc(C(=O)NNc3cc(Cl)nc(N)n3)cc2)C[C@H](C)O1	779375213	MRTZWYQHYUUQAD-QWRGUYRKSA-N	440.913	1.267	50	20	IDGD	
O=C(C[C@H](O)c1ccc(OCc2ccccc2)cc1)NNC(=O)C(=O)Nc1ccccn1	780966326	CIQUIVUSIVLNBD-IBGZPJMESA-N	434.452	1.870	50	20	IDGD	
C[C@@](O)(CC(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1)c1ccccc1	780984797	YRNVXFCSMWDYRM-HSZRJFAPSA-N	444.963	1.903	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2cc(Br)ccc2N2CCOCC2)nc(C)n1	783327193	YROZIBCQLHTNJA-UHFFFAOYSA-N	449.309	1.774	50	20	IDGD	
Cc1cc(OCc2ccccc2)ccc1NC(=O)C(=O)NN[C@@]1(C)CCS(=O)(=O)C1	783428816	XPKGGZDVPXEAQG-NRFANRHFSA-N	431.514	1.711	50	20	IDGD	
Cc1csc(Sc2ccc(NC(=O)C(=O)NNC(=O)C(=O)N3CCCC3)c(C)c2)n1	783997217	NYLJWBGHSXICIW-UHFFFAOYSA-N	447.542	1.619	50	20	IDGD	
Cc1cc2c(cc1NC(=O)C(=O)NNc1ccccc1S(=O)(=O)NC(C)(C)C)OCO2	784833765	NVEDGEPUFPYHKO-UHFFFAOYSA-N	448.501	1.882	50	20	IDGD	
COC(=O)c1cc(Cl)cc(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)c1	785067809	PALJTTDFWQWBCZ-UHFFFAOYSA-N	429.820	1.103	50	20	IDGD	
CC(=O)N(C)c1ccccc1NC(=O)C(=O)NNc1c(F)cc(C(=O)NC2CC2)cc1F	785099273	CCNXFWADXMXJKD-UHFFFAOYSA-N	445.426	1.922	50	20	IDGD	
CCC1(CC)Oc2ccc(NC(=O)C(=O)NNC(=O)[C@@H]3COc4ccccc4O3)cc2O1	787894597	ONRJIAFPRPYARG-SFHVURJKSA-N	441.440	1.900	50	20	IDGD	
Cc1cc(S(=O)(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)sc1Cl	788744153	NNAGMSIQNVETNA-UHFFFAOYSA-N	436.968	1.935	50	20	IDGD	
CCOCC(=O)NNC(=O)C(=O)Nc1ccc(Oc2ncc(Cl)cn2)c(Cl)c1	789734229	HIIRVWXXIIHBLE-UHFFFAOYSA-N	428.232	1.698	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)c(OC2CCCC2)c1	790489330	AFDLQARBRDQWNR-CQSZACIVSA-N	439.534	1.928	50	20	IDGD	
Cc1nc2ccc(C(=O)NNc3ccc(S(=O)(=O)N4CCN(C)CC4)cc3)cc2n1C	793711746	MTURKTYHLRTKSE-UHFFFAOYSA-N	442.545	1.575	50	20	IDGD	
CCn1nc(C)c(CC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)c1C	794197073	ZKMFGADXWCALFD-UHFFFAOYSA-N	447.561	1.698	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NN=C1CCOC[C@@H]1C)N(S(C)(=O)=O)CC2	794485842	LTHAHVUCJNXMFR-SUMWQHHRSA-N	439.534	1.481	50	20	IDGD	
Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C(=O)NNC(=O)CNC(=O)OCc1ccccc1	797369371	UCNNGCJQFWRFBC-UHFFFAOYSA-N	443.416	1.224	50	20	IDGD	
O=C(NNC(=O)N1CCC[C@@H](CN2CCOCC2)C1)c1cccc(Br)c1	799936154	PSJFXIFWRPODEH-AWEZNQCLSA-N	425.327	1.848	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2nnc(OC)s2)c1	801748530	DCFLIJYOMOMLER-UHFFFAOYSA-N	428.496	1.044	50	20	IDGD	
COc1ccc(CCN2C[C@H](C(=O)NNC(=O)Nc3ccccc3)CC2=O)cc1OC	801992083	XVZRLCKGPBKYEA-MRXNPFEDSA-N	426.473	1.948	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)[C@H]2CS[C@@]3(C)CCC(=O)N23)cc1Cl	802077303	QAENEIAVSHNBHC-DIFFPNOSSA-N	428.898	1.964	50	20	IDGD	
NS(=O)(=O)c1ccc(OCCSCC(=O)NNc2nccnc2C2CCC2)cc1	805466547	AFYYMETVRBDVSU-UHFFFAOYSA-N	437.547	1.647	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)Nc1ccc(F)c(N2C(=O)CCC2=O)c1	806745983	ZUAMOZOQQLMAJW-UHFFFAOYSA-N	428.376	1.717	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)c1ccc(N2CCCS2(=O)=O)cc1Cl	807371353	JTCPIVRAFLRAQC-UHFFFAOYSA-N	433.914	1.430	50	20	IDGD	
O=C(NNc1nccnc1C1CCC1)C(=O)Nc1cccc(OCC(=O)N2CCCC2)c1	807462349	WLTAHLJPVPYKFA-UHFFFAOYSA-N	438.488	1.827	50	20	IDGD	
CN(C)C(=O)COc1c(Cl)cc(S(=O)(=O)NNC(=O)c2ccccn2)cc1Cl	808065990	NVUHDUYOSNDCAT-UHFFFAOYSA-N	447.300	1.479	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2cnnn2C)c1	809906900	SIWYTDUOTBDKJZ-UHFFFAOYSA-N	445.461	1.091	50	20	IDGD	
CCc1ccc([N+](=O)[O-])cc1NC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1	810316112	PIBGQPJUYZIOMK-UHFFFAOYSA-N	449.489	1.939	50	20	IDGD	
COC(=O)c1c(F)ccc(NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c1F	810337188	KJLWJOOMQOYQKB-UHFFFAOYSA-N	427.385	1.621	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CCN2C[C@@H](C)O[C@H](C)C2)c([N+](=O)[O-])cc1OC(F)F	813281478	CRZHEJOTRMUOEP-GHMZBOCLSA-N	446.407	1.465	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)N[C@@H]1CCN(c2ccccc2F)C1	813854213	VBUQWTLYIOVCIO-CQSZACIVSA-N	448.524	1.650	50	20	IDGD	
CS(=O)(=O)N1CCN(c2ccc(NC(=O)NNc3cccc(Cl)n3)cn2)CC1	814637397	YHNRBWPXBUVZJV-UHFFFAOYSA-N	425.902	1.360	50	20	IDGD	
CC(=NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1)c1ccccc1C#N	814876793	DABNGAIVDSCMEA-UHFFFAOYSA-N	439.541	1.713	50	20	IDGD	
O=C(NNc1ncncc1F)C(=O)Nc1ccc(Cl)cc1I	815765592	WMGUCHAOHYRXPI-UHFFFAOYSA-N	435.584	1.956	50	20	IDGD	
Cc1cccc2c(=O)n(CC(=O)NNC(=O)[C@@H]3CCCN(C(=O)OC(C)(C)C)C3)cnc12	816509778	BXMQCGDGSWLOOU-OAHLLOKOSA-N	443.504	1.499	50	20	IDGD	
CCCn1c(CCC(=O)NNC(=O)C2CC2)nc2cc(S(=O)(=O)N(CC)CC)ccc21	859369531	HDOKHCWCAYVIJA-UHFFFAOYSA-N	449.577	1.967	50	20	IDGD	
CSc1ncc(Cl)c(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)n1	892680430	YYJDQXYYVRHGEZ-UHFFFAOYSA-N	436.302	1.228	50	20	IDGD	
O=C(NNC(=O)c1cc(=O)c2ccccc2o1)c1cccc(S(=O)(=O)N2CCCC2)c1	912642948	PANVAIRCEJIJMJ-UHFFFAOYSA-N	441.465	1.652	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2ccc(S(=O)(=O)NC(C)(C)C)cc2)C[C@H](C)O1	912921997	XYJUUQWHUQXSBP-GJZGRUSLSA-N	440.566	1.024	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)CSc1cccc[n+]1[O-]	914343896	SJQGAKHLIFIMRW-NSHDSACASA-N	426.292	1.790	50	20	IDGD	
COc1nn(C)c2nc(C)c(CCC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)c(C)c12	914747410	JXERCBGBEAEECS-UHFFFAOYSA-N	426.433	1.896	50	20	IDGD	
CCn1cnc2c1c(=O)n(CC(=O)NN=C[C@@H]1CC=CCC1)c(=O)n2Cc1ccccc1	916331934	MRHBNIWPSRAMFR-QGZVFWFLSA-N	434.500	1.886	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NC[C@H](c1ccccc1)N1CCOCC1	916509519	QUCIMHRYBZFLAD-OXJNMPFZSA-N	430.480	1.997	50	20	IDGD	
Cc1ccc(S(=O)(=O)NNC(=O)c2ccc(F)cc2Br)cc1C(N)=O	917754185	ZUPKFJINRNEXHR-UHFFFAOYSA-N	430.255	1.619	50	20	IDGD	
CC(=O)Nc1ccc(O)c(C(=O)NNC(=O)c2ccc(CSc3nncn3C)cc2)c1	919811463	RVYXBCVWKBGKNI-UHFFFAOYSA-N	440.485	1.846	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)c1ccc2c(c1)S(=O)(=O)N(C(C)C)C2=O	919822407	STRQBLIZICWWQQ-UHFFFAOYSA-N	431.470	1.252	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCC(=NNC(=O)[C@@H]3COc4ccccc4O3)CC2)cc1	920359852	ICHZYYGCRPWAQH-FQEVSTJZSA-N	445.497	1.792	50	20	IDGD	
COC(=O)c1cc(NC(=O)NNC(=O)c2ccc(OC)c(OC)c2)cc(C(=O)OC)c1	920929298	IYKOMGNDLAUVES-UHFFFAOYSA-N	431.401	1.744	50	20	IDGD	
CCCOc1ccc(C(=O)NN/C=C2\C(=O)NC(=S)N(CC(C)C)C2=O)cc1OC	920979557	CDQMAHCOZWJUFZ-GXDHUFHOSA-N	434.518	1.502	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)NCc1cccnc1N1CCN(C)CC1	921247559	HHLDTXHCKWNROU-OAHLLOKOSA-N	430.484	1.270	50	20	IDGD	
CNS(=O)(=O)c1ccc(C(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1	1116092629	QJOYAQRVQYLJOK-UHFFFAOYSA-N	440.522	1.003	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)NCc2cccc(-n3cncn3)c2)CC1	1251922896	GMLLQLNUBAQBGR-UHFFFAOYSA-N	443.508	1.745	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1cccs1)C(=O)NNC(=O)c1ccc(Br)cc1	1317962306	GIFMGKRMBVUSCM-SECBINFHSA-N	432.321	1.639	50	20	IDGD	
COc1cc(Br)c(OC)c(C(=O)NNC(=O)CCN2C[C@H](C)O[C@H](C)C2)c1	1318705406	ZXKNCVRPDNDICU-TXEJJXNPSA-N	444.326	1.727	50	20	IDGD	
CS(=O)(=O)Nc1ccccc1CC(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	1322684711	MAAOEMPXONVJCX-UHFFFAOYSA-N	438.531	1.185	50	20	IDGD	
Cn1c(=O)c(C(=O)N2CC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)nc2ccccc21	1777889139	MYAVVMNEQPMDRI-IBGZPJMESA-N	439.299	1.181	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H]3CN(Cc4ccccc4)CCO3)C2)C1	1778278480	LCDJVLHMQMEPLC-JTAQYXEDSA-N	449.979	1.735	50	20	IDGD	
CC[S@](=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Br)C2	1779219950	FQLOYANWPHIEPG-ILMDJTRDSA-N	441.363	1.350	50	20	IDGD	
Cc1n[nH]cc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)CBr)C2	1780144385	SCPKTQJPBUPCNE-CDHAZOANSA-N	427.343	1.877	50	20	IDGD	
Cc1cnc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](F)Br)C2)cn1	1780771140	SVVJOSYHSDKTNK-CKEIUWERSA-N	429.290	1.603	50	20	IDGD	
Cc1n[nH]c(C)c1CC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](C)CBr)CCO2	1781424947	AKRVQXAJLRFAOA-KZULUSFZSA-N	427.343	1.430	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(C)n3ccnc3n1)C2	1782179166	OZPKWHWBUDGDNH-QLVMHMETSA-N	449.939	1.419	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)C(=O)Nc3cccnc3)CCO2)C1	1783350045	ZKFDJSNKMZCDHZ-KSSFIOAISA-N	439.310	1.024	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccc([N+](=O)[O-])cc3F)CCO2)C1	1783538672	XGKKDVRLPAJTKJ-PIGZYNQJSA-N	444.257	1.961	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ncccc3Br)CCO2)C1	1783877020	DKBQGNHMWLIREP-DYVFJYSZSA-N	446.729	1.541	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1ccc3ncccc3c1)CCO2	1783935229	QWVNTRSLFFEYKO-QHCPKHFHSA-N	439.516	1.051	50	20	IDGD	
Cc1nnc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]3C2)s1	1783965243	DKADGXVGGWHBJS-PYJNHQTQSA-N	445.383	1.400	50	20	IDGD	
CC#C[C@H](CC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2)c1ccc(O)cc1	1784016803	ZAQSCPGNKILMNE-ZWCUEREDSA-N	434.920	1.319	50	20	IDGD	
Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]2C1	1784091930	FCGFMSBHYCIRQL-RKLWJJNISA-N	443.859	1.235	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cn4ncccc4n3)C[C@@H]21	1786406980	LHBUEQDLDBNFIO-YDHLFZDLSA-N	436.310	1.108	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3CNc4ccccc43)[C@H]2C1	1786879328	PLZOTZFOCQMAMP-XRDYDQJJSA-N	436.350	1.959	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CC(=O)Nc3cc(C)on3)[C@H]2C1	1787492656	MAHUZLJXNKOOII-XQLPTFJDSA-N	426.901	1.309	50	20	IDGD	
Cc1nc2ccncc2cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21	1788285892	KNSIQTLCVXPGEE-FDARSICLSA-N	432.908	1.131	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)c1ccc2nncn2c1	1788375254	GWMKTBCCQKZIHQ-ABHRYQDASA-N	440.273	1.013	50	20	IDGD	
C[Si](C)(C)C#CCCCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21	1788592021	JAHHCCBTSJTFFM-XSLAGTTESA-N	429.033	1.617	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3COc4ccccc4O3)C[C@@H]21	1788764977	DWCLHVRRUTVOLT-FVCZOJIISA-N	448.592	1.658	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3c(Br)cnn3C)C[C@@H]21	1789859503	GDPBCSNFDDNELO-IMIFBBOLSA-N	447.761	1.793	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)n3cc(C)cn3)[C@H]2C1	1791599000	GCSQYKNMTTYJBE-WOYTXXSLSA-N	441.370	1.906	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)n3cc(C)cn3)[C@H]2C1	1791599004	GCSQYKNMTTYJBE-XAJHFOFHSA-N	441.370	1.906	50	20	IDGD	
COc1ccc([C@H](O)C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CO[Si](C)(C)C)C3)cc1	1792717412	KRALBYMWQJZQAB-JSJNYSNDSA-N	436.581	1.170	50	20	IDGD	
C[C@H](CBr)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](N)Cc1cscn1)C2	1792987798	BWXYVONUOWYXJM-NXRJPMIISA-N	429.384	1.682	50	20	IDGD	
CCO/C=C/C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1793882327	IHGRPLLQZNAZKC-UMIWNGEVSA-N	445.944	1.258	50	20	IDGD	
CC(C)(C)c1ncccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1	1796189198	JIDRIDXVAZHVAA-REPLKXPHSA-N	435.333	1.625	50	20	IDGD	
Cn1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)c(C(F)(F)F)c1	1796191064	UVYDNJSNAHBVJT-MUJYYYPQSA-N	449.238	1.289	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H]1[C@H]3C=CS[C@@H]31)C2	1796893507	CJJRYQHGPAIRJS-LKINUUATSA-N	427.530	1.634	50	20	IDGD	
C=C(C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C(F)(F)F	1796893565	HTGIAACBTAUDMY-MGGJZVGQSA-N	425.411	1.877	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1[C@H]2c3ccccc3S[C@H]21	1797771864	SUKFITKUHUDSDG-XXBWSCEVSA-N	436.961	1.718	50	20	IDGD	
O=C1CC(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)C(Cl)Cl)C3)=Cc2ccccc2N1	1798437401	ZMMDDZHBIPLWLN-XOIINTDNSA-N	438.311	1.806	50	20	IDGD	
Cc1ccc(=O)n(C(C)(C)C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](C)Br)C3)n1	1798587540	TWIUQDUOBZBWCY-XQLPTFJDSA-N	439.354	1.708	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nc3ccccc3[nH]1)C2)[C@H](F)Br	1799347760	RGVSXODZHXMPPI-DJBIQUGXSA-N	425.258	1.457	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(C)ccc1-n1ccnn1	1799864978	HCLZXDPRRVNTPG-LORHWOILSA-N	447.923	1.033	50	20	IDGD	
O=C1CSc2ncc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)C(Cl)Cl)C4)cc2N1	1800038780	BSFJMTSKRDOVKV-DDFAGTSDSA-N	445.328	1.133	50	20	IDGD	
Cc1cc(NC(=O)CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](F)Br)no1	1800158998	KHXRLLHNVQESCQ-DDIVZENXSA-N	431.262	1.640	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)n1cccc1C=O)C2	1800639813	NRWCQYVHYWQUHL-BIYBGRMPSA-N	440.338	1.625	50	20	IDGD	
COc1cc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)Br)ccn1	1800756737	HLDJJDDDEQQSGM-FRQROOTJSA-N	440.338	1.396	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)n1ccnc1C	1801459164	ZUOFKAKXHZQNQW-YMILTQATSA-N	427.343	1.516	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C[C@H]1CNc3ccccc3O1)C2	1802337931	XLSGRJVCIXBPNP-MHORFTMASA-N	443.548	1.261	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CNC(=O)C(F)(F)F	1802376387	WSCKLUUSSDVOEO-MMWGEVLESA-N	428.249	1.334	50	20	IDGD	
COc1ccc([C@H](O)C(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@H]2c2cccnc2)cc1	1802800272	WMBSCPXCOPFICQ-RNQOJCNYSA-N	447.919	1.429	50	20	IDGD	
C[C@H](Cc1ccncc1)C(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]1c1cccnc1	1803148884	YEAFSKWJNHHQRC-HUYLIWGRSA-N	430.936	1.961	50	20	IDGD	
CC(=O)C(C)(C)C(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1803405166	CRFLATARLIBISU-XLIONFOSSA-N	431.537	1.076	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1803690844	UKKXPUWTQXNUKC-IHPCNDPISA-N	443.740	1.489	50	20	IDGD	
O=C(c1cc(Cl)c2nncn2c1)N1CCC2(CCCN(C(=O)[C@H](O)CCl)C2)CC1	1805523525	WZCSHCJIBMZIHG-OAHLLOKOSA-N	440.331	1.827	50	20	IDGD	
CC(=O)N/C(=C\c1ccco1)C(=O)N1CCC2(CCCN(C(=O)[C@H](O)CCl)C2)CC1	1805526206	GNQSYVAJAYZJAL-XUDLPTGHSA-N	437.924	1.588	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC2(CCCN(C(=O)c3sccc3F)C2)CC1	1806313049	NVGWUNFKXKOMBW-UHFFFAOYSA-N	430.310	1.726	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@@H](CNC(=O)[C@@H]2CCC(=O)N2)[C@H]1c1cccnc1	1806631031	BBKZPLLVOUYEJH-VWNJHIHFSA-N	437.338	1.397	50	20	IDGD	
O=C([C@@H](F)Cl)N1CCC2(CCCN(C(=O)[C@@H]3CCc4nc(O)nc(O)c4C3)C2)CC1	1807088332	HFVWTMQOWSATAQ-IUODEOHRSA-N	440.903	1.758	50	20	IDGD	
C[C@H]1CC[C@H](C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)CC1	1807367859	NMJFCUCDKUNIHQ-JQIPMYIQSA-N	449.360	1.907	50	20	IDGD	
C#CC(=O)N1CC[C@H](CNC(=O)CN(C)NC(=O)NCc2ccccc2)[C@H]1c1cccnc1	1807451835	FRIOJGNKHSNQCB-NFBKMPQASA-N	448.527	1.067	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1CCN(C(=O)Cn2cncn2)[C@H]1c1cccnc1	1808294911	CRMFDEIMLCQSLX-ZVZYQTTQSA-N	425.320	1.615	50	20	IDGD	
Cc1c[nH]cc1C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1808587628	DKLOIMFXTKSADM-LAUBAEHRSA-N	426.521	1.411	50	20	IDGD	
CC(C)=NO[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1808869473	RWOJYLDDROROPM-MMOPVJDHSA-N	446.552	1.261	50	20	IDGD	
O=C(Cn1nccn1)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@@H]1c1cccnc1	1808959304	BYDXXMSYUKRSEZ-CFVMTHIKSA-N	425.262	1.070	50	20	IDGD	
O=C([C@@H](F)Cl)N1CCCC2(CCN(C(=O)[C@@H]3CCc4nc(O)nc(O)c4C3)CC2)C1	1810899829	VWJHNVLMJUWTJY-IUODEOHRSA-N	440.903	1.758	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2cn3cccnc3n2)[C@H]1c1cccnc1	1813029896	ALGZYWVUTLEAOB-BQFCYCMXSA-N	442.907	1.698	50	20	IDGD	
C[C@H](Oc1cccnc1)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1	1813437030	YWGLLACHOCJKRS-OYSPMZIOSA-N	432.908	1.550	50	20	IDGD	
CN(CC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](O)CCl)n[nH]1)C(=O)c1ccccc1	1814865003	VKEOMYASIRQVBN-IAGOWNOFSA-N	447.923	1.774	50	20	IDGD	
C=CCOCCCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1815207248	ZKWLDKRYTWCLJN-IBGZPJMESA-N	440.309	1.378	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc(=O)oc2)n[nH]1	1816645000	AMYMUXNGVFYDOV-HNNXBMFYSA-N	430.465	1.042	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccno2)[nH]n1	1818111430	KMJUVJPELVSEGP-ZWGXDWAISA-N	438.448	1.838	50	20	IDGD	
CN1CCc2cc(C(=O)Nc3nc4c(s3)C[C@H](NC(=O)[C@H](O)CCl)CC4)ccc21	1818416112	UQPYOUXQYWXYJV-CZUORRHYSA-N	434.949	1.961	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@H](O)CCl)CC2)c1cccn(C(F)F)c1=O	1820249538	CAMCKBJSTDCJTI-LDYMZIIASA-N	446.863	1.525	50	20	IDGD	
C[C@](O)(CC(=O)O)CC(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](F)Br)[nH]n1	1822411443	YZMAKEOVHDDDOV-QSGSBWRWSA-N	449.277	1.708	50	20	IDGD	
O=C(CN1CCCC1=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1	1823004047	OWJFSVWDAMXEMA-AMIZOPFISA-N	433.303	1.368	50	20	IDGD	
Cc1cccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)n1	1825855167	YUMTYJJIHZNHKU-HXUWFJFHSA-N	429.565	1.996	50	20	IDGD	
CCn1ccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)n1	1826091858	SHXHWTPSFUNEST-NRFANRHFSA-N	438.337	1.130	50	20	IDGD	
C=C[C@@H](O)C(C)(C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827057601	KZYRPQQTRIWEKN-LEWJYISDSA-N	442.365	1.173	50	20	IDGD	
COC(OC)C(=O)N1CCC([C@@H]2CCCCN2C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)CC1	1827677119	IGWOEFGZWPOBOH-WORIPGKHSA-N	447.536	1.359	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CCc2nc(N)n[nH]2)CC1	1828806518	KZCJIJKCRUFWKC-GJZGRUSLSA-N	426.949	1.193	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H]2CCC=CO2)CC1	1828896534	WRGWJXXXXSLREK-VQTJNVASSA-N	441.532	1.611	50	20	IDGD	
Cc1c(F)cccc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1830161274	VAFSOYGRYVANGQ-MAUKXSAKSA-N	447.276	1.895	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)n3cccc3)C2)C1	1830545895	ODETZOHXUCZMQA-GJYPPUQNSA-N	442.354	1.537	50	20	IDGD	
C[C@H](C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1)c1ccc(Cl)cc1	1830719874	NCOFDMGDMDNAMH-NQYLQCIDSA-N	445.343	1.500	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2CNC(=O)C2)CC1	1831421488	YVKIIPRTTIDUDY-JYJNAYRXSA-N	428.371	1.916	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@](C)(O)C(F)(F)F)C2)C1	1831640531	NDYZLWNRFAXOHN-RCBQFDQVSA-N	430.851	1.164	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CN2CCOCC2)CC1	1831651248	RPMQJTPPXXMRLV-RDJZCZTQSA-N	430.387	1.722	50	20	IDGD	
Cc1cc(C(=O)N2CCC(N3CCC(NC(=O)[C@H](O)CCl)CC3)CC2)n(C(F)F)n1	1833311933	GDYVGUUEHRLAPM-MRXNPFEDSA-N	447.914	1.372	50	20	IDGD	
CC[C@@H](C)[C@H](O)C(=O)NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1	1833496457	BOQXIGSCADZIRF-KDOFPFPSSA-N	432.403	1.750	50	20	IDGD	
Cc1ncc(C(=O)NC2CCN(C3CCN(C(=O)[C@H](C)Br)CC3)CC2)[nH]1	1833580588	OCVLDMKRNANOMP-LBPRGKRZSA-N	426.359	1.687	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ocnc3C)CCO2)C1	1834369336	HPHWXOQFUFOOQU-SUMWQHHRSA-N	430.299	1.227	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnoc3C3CC3)CCO2)C1	1834617418	PXTFJLIXPYPITF-RBUKOAKNSA-N	446.331	1.858	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)C3(F)CCCCC3)C2)C1	1834821738	WDSWEXZIBRXYRA-KRWDZBQOSA-N	435.334	1.900	50	20	IDGD	
Cc1cnn(CC(=O)NC2CCN(C3CCN(C(=O)[C@@H](F)Br)CC3)CC2)c1	1834895327	RQWIMLLQWJSQDN-QGZVFWFLSA-N	444.349	1.454	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)c1cccc2[nH]ncc12	1834998017	SPOZZIYZQLEDQP-LJQANCHMSA-N	433.940	1.348	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)NC(=O)OCC)CC2)CC1	1835642770	QYIRSQIVBHCUPS-WMZOPIPTSA-N	446.976	1.030	50	20	IDGD	
CC[C@H](C)[C@H](N)C(=O)N1CCC(N2CCC(NC(=O)[C@H](F)Br)CC2)CC1	1836412590	NGETXEIQQRUXGR-RCBQFDQVSA-N	435.382	1.622	50	20	IDGD	
CC[C@H](C)CC(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1	1836792899	HQEPYRZVUZQFEU-INIZCTEOSA-N	445.564	1.734	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)CC3CCCC3)CC2)CC1	1837610711	ZDZCJHQLQCEJSZ-UHFFFAOYSA-N	436.597	1.938	50	20	IDGD	
CCOC(=O)C1(C(=O)N2CCC(OC3CCN(C(=O)[C@@H](Cl)COC)CC3)CC2)CC1	1838737694	KHOXCCQTZMLBFR-KRWDZBQOSA-N	444.956	1.582	50	20	IDGD	
COC(=O)C1(C(=O)N2CCC(OC3CCN(C(=O)[C@@H](C)Br)CC3)CC2)CC1	1838758111	SBPMMJFVPJMVOD-CYBMUJFWSA-N	445.354	1.722	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3nc4ccccn4c3C)C2)C1	1839144815	LITKMOJTVZIMSL-KKSFZXQISA-N	434.924	1.730	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CC[C@H]3CCOC3)C2)C1	1839156244	IVMSBKTZZPMCCW-ZYSHUDEJSA-N	437.364	1.496	50	20	IDGD	
O=C(c1ccoc1Cl)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839201651	FBXIKBRJGOCQGQ-IAQYHMDHSA-N	439.665	1.694	50	20	IDGD	
O=C(c1ccc(O)cc1F)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1839316986	CXPXTFCSEOBMAA-WMLDXEAASA-N	449.248	1.292	50	20	IDGD	
COc1cc(F)ccc1CC(=O)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840190155	HSLYDKNLZVPKDD-IBGZPJMESA-N	449.306	1.637	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC2(CCCN2C(=O)[C@@H](O)C(C)(C)C)C1	1841312561	ZXEUQMJPIGFHDF-UONOGXRCSA-N	431.961	1.729	50	20	IDGD	
CC(C)CNC(=O)C(=O)N1CC2(CCCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C1	1841925022	VLISLCBDSFCTJF-AWEZNQCLSA-N	444.960	1.094	50	20	IDGD	
Cn1cnc(C(=O)N2CCCC23CN(C(=O)[C@H](Br)Cc2ccccc2)C3)n1	1842355634	MSFMKDXGZIGWSS-OAHLLOKOSA-N	432.322	1.638	50	20	IDGD	
CS(=O)(=O)Cc1ccc(C(=O)N2CC3(CCCN3C(=O)CCBr)C2)cn1	1842637825	MXCBREFPVMTTEX-UHFFFAOYSA-N	444.351	1.228	50	20	IDGD	
O=C([C@H](O)CCl)N1CC2(CCCN2C(=O)c2cnn3c(-c4cccs4)ccnc23)C1	1843302035	WGMQRHFXPNEZJE-OAHLLOKOSA-N	445.932	1.875	50	20	IDGD	
CC(C)(C)OC(=O)N1CC2(CC(C(=O)N3CC4(CCCN4C(=O)[C@@H](F)Cl)C3)=NO2)C1	1843366836	TXJJYHXTISEZTD-CYBMUJFWSA-N	444.891	1.490	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC2(CCCN2C(=O)[C@@H]2CC[C@@H]3CCC(=O)N3C2)C1	1845074779	FIYIKMBBUAVRKV-KFWWJZLASA-N	426.355	1.764	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCCC12CN(C(=O)c1ccccc1C(=O)OCCO)C2	1845171482	BQWMTYNCIAIBPE-LJQANCHMSA-N	443.327	1.889	50	20	IDGD	
Cc1ccc(CC(=O)N2CCCC23CN(C(=O)CCC(=O)NN(C)C)C3)cc1[N+](=O)[O-]	1845206188	MIZKTIQWBKOEAZ-UHFFFAOYSA-N	431.493	1.022	50	20	IDGD	
CC(=O)N[C@@H](C)C(=O)N1CCCC12CN(C(=O)[C@@H](Br)Cc1ccccc1)C2	1846006262	LKRRZCMEKFENJW-YOEHRIQHSA-N	436.350	1.721	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1ccc(B(O)O)cc1)c1ccc(Cl)cc1	1847409081	LHAAHZDFEQNQQO-GKCIPKSASA-N	426.709	1.639	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1ccc2nc(CO)[nH]c2c1	1847501768	XETJCJRSBVNZHA-RLCCDNCMSA-N	435.322	1.902	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](CC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl)C1CC1	1847557506	DOBIDVZUICRGSU-FXUDXRNXSA-N	429.945	1.481	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)Cc2ccc(C(=O)NNC(=O)[C@H]3CCCO3)cc2)cc1	15797735	OIJFKNJAJOSPCP-LJQANCHMSA-N	431.514	1.756	50	20	IDGD	
CCOc1ccc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)c3cnn(C)c3)cc2)cc1	17399518	YNRBPZSIRYFAFJ-UHFFFAOYSA-N	443.485	1.694	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)CNC(=O)c2ccc3c(c2)OCO3)cc1	18071605	MXZUMKXVPKNNAK-ZDUSSCGKSA-N	429.429	1.159	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2nc3ccccc3o2)CC1)c1ccc(-n2cnnn2)cc1	22193046	PWQGEZSTYAHJDK-UHFFFAOYSA-N	432.444	1.481	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NCC1(c2ccc(F)cc2)CCOCC1	725873744	QDCSPOSIHJXJEP-UHFFFAOYSA-N	434.493	1.696	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)NCc1ccnc(Oc2ccc(F)cc2)c1	726254741	XULPUBZUIJKWHF-UHFFFAOYSA-N	427.392	1.866	50	20	IDGD	
C[C@H](C(=O)NNC(=O)Cc1nc(-c2ccccc2)cs1)N1C(=O)NC2(CCCC2)C1=O	726524946	RFKQXIAWCBEAIX-CYBMUJFWSA-N	441.513	1.753	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](C(=O)NNC(=O)CNC(=O)c1cccs1)c1ccccc1	727156297	CUNYWNVCNSKOGM-INIZCTEOSA-N	432.502	1.891	50	20	IDGD	
O=C(COC(=O)c1cccc(Nc2ncccn2)c1)NNC(=O)[C@H]1COc2ccccc2O1	728324178	XZQXYVINNJRNCB-GOSISDBHSA-N	449.423	1.364	50	20	IDGD	
CC[C@H](NC(=O)NNC(=O)COc1ccccc1OC)c1cccc(S(N)(=O)=O)c1	729221227	LFELIBQEKCBVSZ-HNNXBMFYSA-N	436.490	1.203	50	20	IDGD	
O=C(CCCc1ccccc1)NNC(=O)[C@@H]1C[C@@H](O)CN1C(=O)OCc1ccccc1	729533940	AMVGSKJALPCCGN-UXHICEINSA-N	425.485	1.929	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)NC[C@@H]2CCCN2C(=O)OC(C)(C)C)cc1C	730909865	QUZZINRTDVRLPQ-INIZCTEOSA-N	433.509	1.972	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)C(F)(F)Oc2ccc(C=O)cc2)c1	731597400	QKJJQIZECSEMKW-UHFFFAOYSA-N	441.412	1.182	50	20	IDGD	
COc1cc(C=O)c([N+](=O)[O-])cc1OCC(=O)NNC(=O)Cn1ccc2ccccc21	731634336	RDVJBWUAGUIVJY-UHFFFAOYSA-N	426.385	1.597	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)C1CCN(S(=O)(=O)c2ccc(F)c(Cl)c2)CC1	731879391	PMDXUVRQIADRRQ-UHFFFAOYSA-N	443.888	1.373	50	20	IDGD	
CCC[C@H](NC(=O)Cc1ccccc1)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	732639229	MDFAAKGTYLWIBE-IBGZPJMESA-N	438.532	1.368	50	20	IDGD	
NC(=O)C1(c2ccccc2)CCN(C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)CC1	734531365	JMWGWJAXNAPOCG-UHFFFAOYSA-N	432.484	1.746	50	20	IDGD	
Cc1nn(C)c2ncc(C(=O)NNC(=O)NC3CCN(C(=O)OC(C)(C)C)CC3)cc12	734824926	NHVOBVSMMAUQKF-UHFFFAOYSA-N	431.497	1.620	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)[C@@H]2Cc3ccccc3N2C(C)=O)cc1C	736805641	AMLVHBWXHQDKPG-INIZCTEOSA-N	429.498	1.901	50	20	IDGD	
CSC[C@H](C(=O)NNC(=O)COCc1ccccc1)N1C(=O)[C@@H]2CCCC[C@H]2C1=O	737636618	SYBMWHNPTFSMKS-BRWVUGGUSA-N	433.530	1.257	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)C[C@@H]3CCOC3)c2)cc1	739676652	ZYXIURKREYTGLD-AWEZNQCLSA-N	433.486	1.684	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(F)c(Br)c1)c1ccc2c(c1)OCCO2	743252044	YHRHPZOMEZWGJP-UHFFFAOYSA-N	431.239	1.983	50	20	IDGD	
CC(C)CCOCCNC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	743356415	KRYHZKZWXDNQJZ-UHFFFAOYSA-N	426.539	1.478	50	20	IDGD	
O=C(NNc1ncnc2[nH]cnc12)[C@H]1CCCN(C(=O)N2CCc3sccc3C2)C1	743470545	TVFVANXXJPBKEY-ZDUSSCGKSA-N	426.506	1.748	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNC(=O)[C@@H](C)N2C(=O)[C@@H]3[C@H]4CC[C@@H](O4)[C@@H]3C2=O)cc1	744352683	NTXFFODPQQFSIG-PYJZQUQOSA-N	443.500	1.423	50	20	IDGD	
O=C(NCCCN1C(=O)COc2ccccc21)NNC(=O)c1nnc(O)c2ccccc12	745858167	YCXWWSCYNWDVSS-UHFFFAOYSA-N	436.428	1.095	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)c2cc(S(=O)(=O)N3CCCC3)ccc2O)cc1	745989062	IQDUXKVICRLEPV-UHFFFAOYSA-N	432.502	1.358	50	20	IDGD	
CSCC[C@H](C(=O)NNC(=O)COc1ccc(C)cc1)N1C(=O)[C@@H]2CCCC[C@H]2C1=O	746129374	HXLMXKUEOSNUBE-KZNAEPCWSA-N	447.557	1.818	50	20	IDGD	
COc1ccc(-c2nnc(S)n2CC(=O)NNC(=O)c2cncc(NC(C)=O)c2)cc1	746310082	MSNOMZVTTBOCPC-UHFFFAOYSA-N	441.473	1.057	50	20	IDGD	
CCO[C@H](CCNC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)C(C)C	746420233	JEYZVDXHOOLSCP-GOSISDBHSA-N	440.566	1.866	50	20	IDGD	
CN(C)CCOc1ccccc1CNC(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	746725739	ITVQJZIAKGBYGJ-UHFFFAOYSA-N	438.488	1.663	50	20	IDGD	
N#Cc1ccc(NNC(=O)CCC(=O)N2CCN(S(=O)(=O)c3ccccc3)CC2)cc1	748101895	OWWGGTCOOFHFRE-UHFFFAOYSA-N	441.513	1.315	50	20	IDGD	
CCOC(=O)c1ccc(C=NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)o1	748247621	VPIZWFJFAKKHJI-UHFFFAOYSA-N	435.458	1.241	50	20	IDGD	
CCOCCCn1c(NNC(=O)c2nn(C)c(=O)c3ccccc23)nc2ccccc2c1=O	752037218	CIXVDZMNHRNBIW-UHFFFAOYSA-N	448.483	1.827	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)c1noc(Cc2ccccc2)n1	753038339	NUFORHIDJHBTOR-ZDUSSCGKSA-N	433.432	1.341	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)N[C@@H]3CCCN(Cc4ccccn4)C3=O)n[nH]2)cc1	753289287	KZTYRBFOHORORR-GOSISDBHSA-N	447.499	1.915	50	20	IDGD	
Nc1cc(Br)cc(C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c1	753393370	FXGCESNIFMBGOL-UHFFFAOYSA-N	437.206	1.558	50	20	IDGD	
Cc1oc(C(=O)NNC(=O)Cc2nc(-c3ccccc3)cs2)cc1S(=O)(=O)N(C)C	753578316	YKNMBHIJIRBNNV-UHFFFAOYSA-N	448.526	1.966	50	20	IDGD	
O=C(NNc1cccnc1Cl)c1ccc2c(c1)S(=O)(=O)N(C[C@@H]1CCCO1)C2=O	754488107	RRIMNLLORDSRQU-LBPRGKRZSA-N	436.877	1.815	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc2c(c1)OCCCO2)NNc1ccc(C(F)(F)F)nn1	755293972	NUQWYRJKKIESSZ-UHFFFAOYSA-N	447.395	1.078	50	20	IDGD	
CC(C)N(C)S(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1	755452156	MXXDUQCGUQIUKZ-GOSISDBHSA-N	448.501	1.708	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)Nc1ccccc1C(=O)N1CCOCC1	755624274	RMYPCGFTTDRUDJ-UHFFFAOYSA-N	436.266	1.716	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)cc(C(F)(F)F)c1)N[C@@H]1CCS(=O)(=O)C1	755646687	YHIPDTRMWWTMNT-SNVBAGLBSA-N	444.229	1.599	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)ccc1NC(C)=O	755913535	JKHXMOLYINLQBX-UHFFFAOYSA-N	427.465	1.513	50	20	IDGD	
Cc1ccc(N2N=C(Br)C[C@@H]2C(=O)NNC(=O)CNC(=O)c2ccco2)cc1	756101412	YHPCRRHNJVETGN-CYBMUJFWSA-N	448.277	1.453	50	20	IDGD	
CC[C@H]1CN(CC(=O)NNC(=O)c2ccc(C#N)cc2)CC[C@H]1NC(=O)OC(C)(C)C	757101265	HFJHUCSATXGXEB-FUHWJXTLSA-N	429.521	1.944	50	20	IDGD	
NC(=O)c1ccc(NNC(=O)c2nnn(-c3ccc(Br)cc3)c2C2CC2)nn1	757404512	RAXFMUIOODZXKG-UHFFFAOYSA-N	443.265	1.553	50	20	IDGD	
Cc1csc(SCc2ccc(C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)cc2)n1	758036390	RIVAOPNIFCZPQU-NSHDSACASA-N	428.561	1.443	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)Nc1cccc2c1CCN2S(C)(=O)=O	758296838	ULEGMKDQSIJTMZ-UHFFFAOYSA-N	428.474	1.431	50	20	IDGD	
O=C(c1ccn(-c2ccc(Cl)cc2)n1)N1CCN(S(=O)(=O)CBr)CC1	758522868	KTUIMYGWDKSMBS-UHFFFAOYSA-N	447.742	1.966	50	20	IDGD	
O=C(NNC(=O)[C@@H](c1ccc(Br)cc1)N1CCCC1)C(=O)Nc1ccccn1	758826776	DXFZWMTXWGJHHQ-MRXNPFEDSA-N	446.305	1.767	50	20	IDGD	
O=C(NNC(=O)/C(=C\c1ccco1)n1nnnc1-c1ccccc1)C(=O)Nc1ccccn1	758837376	ABPIALSEGPHZLQ-DTQAZKPQSA-N	444.411	1.112	50	20	IDGD	
CC1(C)C(=O)N(C[C@](C)(O)C(=O)NNC(=O)COc2ccc(F)cc2)c2ccccc21	760065507	GWWCGNPXWWWFPA-QFIPXVFZSA-N	429.448	1.427	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)[C@@](C)(O)CN1C(=O)C(C)(C)c2ccccc21	760073496	IOWGBYIBSCGOOI-QHCPKHFHSA-N	435.484	1.479	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)Cn2cnc(-c3ccccc3)n2)cc1C	761587290	SZYZSVHGUCKTAP-UHFFFAOYSA-N	427.486	1.882	50	20	IDGD	
O=C(NNC(=O)c1ccccc1O)C(=O)Nc1cccc(N2CCN(CC3CC3)CC2)c1	763526243	IIFJQOQNMVVVTA-UHFFFAOYSA-N	437.500	1.324	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)NC[C@H]1CC(=O)N(Cc2ccccc2)C1	763546029	MJIPEPSUAHUUCK-MRXNPFEDSA-N	428.514	1.863	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2ccc(C(=O)N(C)C)c(Cl)c2)c1	763651124	VBTWVUTZLHHXOR-UHFFFAOYSA-N	446.891	1.824	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccnn2-c2cccc(Cl)c2)cc1	763661881	QDJWMKYHERGREL-UHFFFAOYSA-N	443.847	1.699	50	20	IDGD	
CCCN1C(=O)CCc2cc(NC(=O)C(=O)NNC(=O)COc3ccc(C#N)cc3)ccc21	763682591	XETYCRQYMDUBEZ-UHFFFAOYSA-N	449.467	1.412	50	20	IDGD	
Cc1nn(-c2ccccc2)c(C)c1NC(=O)C(=O)NNC(=O)COc1ccccc1F	763683332	YKPORQPIQDKEQN-UHFFFAOYSA-N	425.420	1.793	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)n([C@H]2C[C@H]3CC[C@H]2C3)n1	763839779	LSOIPSMFTDCXKR-ZQIUZPCESA-N	429.452	1.857	50	20	IDGD	
Cc1cccc(C(=O)N2CCCC2)c1NC(=O)C(=O)NNC(=O)COc1ccc(F)cc1	763840020	OSTKWQZJANOZSY-UHFFFAOYSA-N	442.447	1.535	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)N1C[C@@H]2CCCN2c2ccccc21	763873428	STRCMZPJDKQEOW-HOCLYGCPSA-N	426.448	1.756	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)Cn2nc(C)cc2C)c(OC[C@H]2CCCO2)c1	763892794	KTQQATMEDOCOPJ-MRXNPFEDSA-N	429.477	1.152	50	20	IDGD	
C=CCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)CSc2ccc(C)cc2)cc1	763898486	WLOMICDKEXVZJH-UHFFFAOYSA-N	426.498	1.789	50	20	IDGD	
COC(=O)c1ccsc1NC(=O)C(=O)NNC(=O)c1ccc(OC(C)C)c(OC)c1	763921577	MDGCJYFSUQRRPI-UHFFFAOYSA-N	435.458	1.730	50	20	IDGD	
O=C(NNC(=O)c1ccc[nH]1)C(=O)Nc1cc(Br)ccc1Br	763980528	WSFZVHVBSPXREH-UHFFFAOYSA-N	430.056	1.939	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1ccc(N2CCO[C@@H](C)C2)cc1	764012278	NICMICLVKGSPOY-ZDUSSCGKSA-N	446.891	1.973	50	20	IDGD	
O=C(NNC(=O)c1ccc2ccccc2c1)C(=O)Nc1ccc(C(=O)N2CCOCC2)cc1	764067861	ZSCPHAHJPKGCOD-UHFFFAOYSA-N	446.463	1.712	50	20	IDGD	
CC[C@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(Cl)c(S(=O)(=O)N(CC)CC)c1	764086019	SGBACQWDGDFJEY-NSHDSACASA-N	432.930	1.503	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)CC(F)(F)F)n(-c2cccc(Br)c2)n1	764116673	NJIGNMUJYPSPBW-UHFFFAOYSA-N	448.199	1.982	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2ccc3c(c2)CCCN3C(C)=O)cc1	764124035	AJLHYCVIFNPHBV-UHFFFAOYSA-N	438.484	1.713	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccccc2O[C@H](C)C#N)o1	764138627	GVLQPULWDPPXBY-CQSZACIVSA-N	427.461	1.812	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3ccc(C#N)cc3)cc2F)C[C@@H](C)O1	764177327	OOUYIFWVGMCLDW-OKILXGFUSA-N	439.447	1.711	50	20	IDGD	
O=C(COC(=O)COC/C=C\c1ccccc1)NNC(=O)[C@H]1COc2ccccc2O1	764196126	LTUSKTIJOJUHAX-WMHRWZGDSA-N	426.425	1.247	50	20	IDGD	
CC(C)(C)CC(=O)NNC(=O)C(=O)Nc1c(C(=O)N2CCOCC2)oc2ccccc12	764200015	WOLMJPXYSNGLDW-UHFFFAOYSA-N	430.461	1.427	50	20	IDGD	
CN(C)c1ccc(NC(=O)C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1Cl	764259795	JLJJUWWQLWXGJK-UHFFFAOYSA-N	445.911	1.199	50	20	IDGD	
O=C(Cc1ccccn1)NNC(=O)C(=O)Nc1ccc(C(=O)NCc2ccccc2)cc1	764263348	FNRBGTDOLGIQCE-UHFFFAOYSA-N	431.452	1.340	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)ccc1O)C(=O)Nc1cccc2c1OCCC2=O	764276912	IGQMLPLXRXCREL-UHFFFAOYSA-N	448.229	1.520	50	20	IDGD	
O=C(NNC(=O)c1cc2ccccc2o1)C(=O)Nc1ccc2c(c1)C(=O)N(CC1CC1)C2=O	764330480	ABKGASMVRKBOBA-UHFFFAOYSA-N	446.419	1.839	50	20	IDGD	
O=C(NNC(=O)C1CCC1)C(=O)Nc1ccc(Cl)c(S(=O)(=O)N2CCCC2)c1	764338581	IXRCULYXCSYGSL-UHFFFAOYSA-N	428.898	1.011	50	20	IDGD	
C[C@H]1CN(Cc2cccc(NC(=O)C(=O)NNC(=O)Cc3ccncc3)c2)C[C@@H](C)O1	764354452	RINVCYKWGHHHMA-IYBDPMFKSA-N	425.489	1.019	50	20	IDGD	
COc1cc(Br)c(NC(=O)C(=O)NNC(=O)c2ncccc2C)cc1OC	764386586	ZSYAERGCYKUHGC-UHFFFAOYSA-N	437.250	1.569	50	20	IDGD	
COc1nccnc1NNC(=O)c1cccc(S(=O)(=O)N2CCc3ccccc32)c1	764482430	VQFCLFQSUBLZNB-UHFFFAOYSA-N	425.470	1.994	50	20	IDGD	
CC(=NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1)c1cccc(N2CCOC2=O)c1	764830543	KCMZPLQTLJLRSU-UHFFFAOYSA-N	449.511	1.941	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1	765312783	AMBAJXFRZMAVCA-UHFFFAOYSA-N	432.437	1.846	50	20	IDGD	
C[C@@H](NC(=O)OC(C)(C)C)[C@H]1COCCC1=NNC(=O)c1nn(C)c(=O)c2ccccc12	766007133	JYJZCIJEAIPZTN-CZUORRHYSA-N	443.504	1.969	50	20	IDGD	
CC(C)(C)OC(=O)NCC1(CC(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)CCCCC1	766156639	SERMUZZWIWTWTB-CQSZACIVSA-N	446.570	1.369	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1[N+](=O)[O-]	766327285	AIHINTWKQXVWMT-UHFFFAOYSA-N	448.457	1.463	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)/C(=C/c1ccccc1)n1nnnc1C	767261139	CDTKLGLFPAMFPD-UNOMPAQXSA-N	434.456	1.221	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccc(F)cc2)cc1NC(=O)CCN(C)C	768236450	CHUFHZOBQZYARY-UHFFFAOYSA-N	443.479	1.353	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)C(=O)Nc1cc(C2CC2)nn1-c1ncccn1	768239882	QFNUJBAYLROUPM-UHFFFAOYSA-N	444.455	1.281	50	20	IDGD	
CCc1noc(CCCC(=O)NNC(=O)c2cc(-c3ccc(OC)c(OC)c3)[nH]n2)n1	768278241	VTLRXAWNDCOZQK-UHFFFAOYSA-N	428.449	1.823	50	20	IDGD	
Cn1c(S)nc2cc(C(=O)NNC(=O)c3cc(-c4ccc(F)cc4)[nH]n3)ccc2c1=O	768280389	ZOKJOTMRRFRCSJ-UHFFFAOYSA-N	438.444	1.826	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)Cc2c(C)nc3c(c(O)nn3C)c2C)n[nH]1	768281337	IWOLINGIJJYIIN-UHFFFAOYSA-N	449.471	1.693	50	20	IDGD	
O=C(NNC(=O)C1CCN(C(=O)c2cccnc2)CC1)c1cc(-c2ccc(F)cc2)[nH]n1	768288918	IGCUHXIISNXQOB-UHFFFAOYSA-N	436.447	1.924	50	20	IDGD	
COc1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2cccc(Cl)c2)cc1OC	768723865	CKHXHOKGFNMCOX-UHFFFAOYSA-N	427.866	1.097	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)[C@H]2CCN(C(=O)OCc3ccccc3)C2)c2ccccc2c1=O	770074034	UCDXPHWFFOFDGF-INIZCTEOSA-N	449.467	1.353	50	20	IDGD	
CCCS(=O)(=O)NC1CCN(C(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)CC1	770646743	GYEFKCFNIUWVSC-CYBMUJFWSA-N	446.957	1.642	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)NNC(=O)CSc1ccccc1O	770650490	VPUJBWODNRWDFW-LLVKDONJSA-N	438.893	1.967	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)[C@H]1CC(=O)N(c2c(F)cccc2F)C1	770904537	VARRLEZJQNJJPL-LBPRGKRZSA-N	440.447	1.770	50	20	IDGD	
CCN1CCC[C@@H]1CN1C[C@H](C(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)CC1=O	770958115	IPPDWKKYYDRDEX-ZIAGYGMSSA-N	444.540	1.063	50	20	IDGD	
CC(=NNC(=O)C(=O)NCc1ccc(Cl)cc1)c1cccc(S(=O)(=O)N(C)C)c1	771572665	KASKLVXBDMEEMQ-UHFFFAOYSA-N	436.921	1.747	50	20	IDGD	
C[C@H](C(=O)NNc1ccc(Br)c(F)c1)N1C(=O)[C@H]2[C@H](C1=O)[C@H]1CC[C@H]2O1	771691157	PVUXXVJIPSSEHL-ODTJPNJJSA-N	426.242	1.582	50	20	IDGD	
COc1ccc(COCCNC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)cc1	771906106	UTMPSFRZQKTBPO-UHFFFAOYSA-N	449.533	1.458	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)N[C@@H](c1ccc(F)c(Cl)c1)C(F)(F)F	772628404	MVKLLSFJCHCYNT-LDWIPMOCSA-N	434.799	1.351	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)ccc1F	772971902	QGTZIDVUZZRCGJ-JTQLQIEISA-N	429.857	1.616	50	20	IDGD	
N#Cc1cccc(NNC(=O)C(=O)Nc2ccc(S(=O)(=O)N3CCCCC3)cc2)c1	773699316	UCELLKBTPVFHDC-UHFFFAOYSA-N	427.486	1.815	50	20	IDGD	
CSc1nnnn1-c1cccc(NC(=O)C(=O)NNC(=O)c2ccc(C)c(F)c2)c1	773889357	NLBYXKWIUYJJAZ-UHFFFAOYSA-N	429.437	1.231	50	20	IDGD	
NC(=O)NC(=O)CCNC(=O)C(=O)Nc1ccccc1S[C@H](Cl)C(F)(F)F	774489740	QNSQWKHSIOZMRV-LBPRGKRZSA-N	426.804	1.546	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccc(NC(=O)NNC(=O)COc2ccccc2C#N)nc1	776061880	CGVLYTTVDWVZFS-UHFFFAOYSA-N	446.489	1.262	50	20	IDGD	
Cc1cc(C(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)ccc1-n1cnnn1	776200890	CJIJYSZUCCPJMN-UHFFFAOYSA-N	444.496	1.220	50	20	IDGD	
COC(=O)N1CCC[C@@H]([C@H](C)NC(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)C1	776241216	QGPPETGFNDQNSR-UONOGXRCSA-N	442.542	1.261	50	20	IDGD	
CC(=O)N1CCN(Cc2ccccc2NC(=O)C(=O)NNC(=O)CC2CCCC2)CC1	782117481	PHYNGFRQWQHSSQ-UHFFFAOYSA-N	429.521	1.017	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ncnc3ccsc23)c(OCC(=O)N(C)C)c1	783252737	BVYYTDQZYPISDJ-UHFFFAOYSA-N	428.474	1.549	50	20	IDGD	
Cc1ccccc1NC(=O)NNC(=O)C(=O)Nc1cccc(C(=O)N2CCOCC2)c1	783410569	DAQFVKMFSWCORF-UHFFFAOYSA-N	425.445	1.259	50	20	IDGD	
O=C(NNc1ccnc(F)c1)C(=O)N1C[C@H](C(=O)N2CCCCC2)Oc2ccccc21	784851347	AXKXAJJLUHINBW-QGZVFWFLSA-N	427.436	1.471	50	20	IDGD	
O=C(COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CCOCC1)NNC(=O)c1cccc(Cl)c1	785712512	IHUCLHKHPJGJFN-DLBZAZTESA-N	449.891	1.085	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCC(n2ccc([N+](=O)[O-])n2)CC1	785858373	ZZWOCXSBKPCCBR-UHFFFAOYSA-N	436.856	1.551	50	20	IDGD	
O=C(CCOCC(F)(F)C(F)F)NNc1ccccc1S(=O)(=O)N1CCOCC1	790697541	QNVAABNOUNJQMG-UHFFFAOYSA-N	443.419	1.458	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2cnc(C(F)(F)F)cc2OC)c1	792268703	PEISZHQNLDRKDB-UHFFFAOYSA-N	442.350	1.526	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)C(=O)Nc1cccc(-c2cccc(Cl)c2)c1	793024863	GYJGRNJKGZPAPV-LLVKDONJSA-N	438.893	1.031	50	20	IDGD	
C[C@H](C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)c1ccc2c(c1)OCO2	794179780	DJUGBLHYPOMIDM-AWEZNQCLSA-N	445.497	1.765	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)c2nnn(Cc3cc(C)no3)c2C)c1	794288548	MAPNFKPLIQNYRT-UHFFFAOYSA-N	449.265	1.777	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNS(=O)(=O)c3cccc(CC#N)c3)CC2)cc1	794593725	XXWQLJGRTLKXLF-UHFFFAOYSA-N	441.557	1.188	50	20	IDGD	
COc1cc2c(cc1S(=O)(=O)NNC(=O)c1ccc(Cl)cc1Cl)OCC(=O)N2	797428848	HWCLKZBPTWNBJL-UHFFFAOYSA-N	446.268	1.956	50	20	IDGD	
C[S@](=O)c1ccc(CC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1	797787027	XSAORKCYCPOSCY-LJAQVGFWSA-N	449.554	1.212	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H]2CCN(C(=O)Nc3ccccc3)C2)c1	801077909	PCWYQVFLTADEKP-INIZCTEOSA-N	445.501	1.341	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2CCCN(S(=O)(=O)c3ccccc3)C2)cc1	801108862	OVOQCPNTFAYQKS-INIZCTEOSA-N	444.513	1.182	50	20	IDGD	
Cc1nc2cccc(C(=O)NNC(=O)c3cccc(S(=O)(=O)N4CCCC4)c3)c2[nH]1	801796212	HREXKDIDDHZHIQ-UHFFFAOYSA-N	427.486	1.731	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2nc3c(s2)CSCC3)o1	806977426	IWIWINQIDNQRPL-UHFFFAOYSA-N	437.547	1.767	50	20	IDGD	
Cc1cc(=O)c(C(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)cn1C1CC1	807242434	BFKYHRFMWWYYKZ-UHFFFAOYSA-N	433.509	1.741	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc2c(c1)CCN2C(=O)C(=O)NNc1ncccc1F	807301433	IXNQOIBXCIYMQG-UHFFFAOYSA-N	435.481	1.284	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NN=Cc3ccc(F)c(S(N)(=O)=O)c3)n[nH]2)cc1OC	807976019	KAHZQEBLYWXHRD-UHFFFAOYSA-N	447.448	1.644	50	20	IDGD	
CCCNS(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)c2cccc3ncccc23)cc1	808088050	FLYLMZPPPWSFGR-UHFFFAOYSA-N	448.526	1.546	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)C1(c2cccc(Br)c2)CC(=O)C1	810944312	QIVVFCHYDYPICA-UHFFFAOYSA-N	440.294	1.722	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)CCC(=O)N2CC(=O)Nc3ccccc32)cc1	812729330	JQYPNNRHCYBSHY-UHFFFAOYSA-N	445.501	1.146	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)C3(S(=O)(=O)c4ccccc4)CCCCC3)nc21	813451659	BJAVKOUXRIOMAA-UHFFFAOYSA-N	430.490	1.689	50	20	IDGD	
N#Cc1ccc(-c2ccc(OCC(=O)NNC(=O)C[C@H]3CCCS(=O)(=O)C3)cc2)cc1	814721039	VASSYOXDJZVCOK-QGZVFWFLSA-N	441.509	1.966	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C)cc2)cc1)[C@@H]1C[C@@H]1C	815565923	FDNCCHQMZYMQAM-MGPUTAFESA-N	438.484	1.921	50	20	IDGD	
CNS(=O)(=O)c1csc(C(=O)NNc2cc(C(=O)OC)ccc2Br)c1	818767300	GKEDSMIHXXJGTE-UHFFFAOYSA-N	448.320	1.962	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CNc2ccccc2)cc1S(=O)(=O)NC1CCCC1	823327488	NLYYZCFSVTXSHC-UHFFFAOYSA-N	446.529	1.789	50	20	IDGD	
Cc1ccc(-n2cnnc2SCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1C	840512777	RWJXKQXUPYWRML-SFHVURJKSA-N	439.497	1.964	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccccc1	864020343	SOXADWKHOBNQMN-QGZVFWFLSA-N	435.477	1.595	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@]23CCC(=O)N2c2ccccc2S3)c1	915165135	ZHVHHEPQNFLPKO-IBGZPJMESA-N	431.495	1.480	50	20	IDGD	
COc1ccc([C@@H](CNC(=O)NNc2ccc(-n3cccn3)nn2)N2CCOCC2)cc1	915897149	XELYTLCAOVOLQR-GOSISDBHSA-N	438.492	1.371	50	20	IDGD	
Cc1cccc(OCCCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1	916226205	XOWHBAINJDNMJY-UHFFFAOYSA-N	434.518	1.658	50	20	IDGD	
Cn1ncc2c1CCC[C@H]2NC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	916604775	PUWZOQMMAQBGQA-LJQANCHMSA-N	425.537	1.340	50	20	IDGD	
O=C(CN1CCCC1=O)NNC(=O)c1ccccc1NS(=O)(=O)c1ccc(F)cc1	916758505	BQLITTZWSSKTKI-UHFFFAOYSA-N	434.449	1.010	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNS(=O)(=O)c2cc3c(cc2F)NC(=O)CC3)cc1C	917728928	XFCXGJSHTYEKHD-UHFFFAOYSA-N	434.449	1.275	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)CNC(=O)c2ccc(Br)s2)cc1	918678583	KTUHJWWMZPJUCL-UHFFFAOYSA-N	437.275	1.338	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NC1CCN(c2ccccc2)CC1	919783074	DGMTWTFROSBERD-UHFFFAOYSA-N	444.561	1.901	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)NCCS(=O)(=O)c1ccc(Cl)cc1	919911121	SUGFSTZWOBFZHW-UHFFFAOYSA-N	425.894	1.695	50	20	IDGD	
Cn1cc(C(=O)NNS(=O)(=O)c2cc(S(C)(=O)=O)ccc2F)c2ccccc21	921295665	UEWYQPHOMWPLLY-UHFFFAOYSA-N	425.463	1.344	50	20	IDGD	
O=C(NNC(=O)c1cncn1-c1ccccc1)NC1CCN([C@H]2CCCC[C@@H]2O)CC1	1324087206	KAQCANIFWHLUAQ-ICSRJNTNSA-N	426.521	1.584	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cn(C)cc3C(F)(F)F)CC2)cc1	1342427933	YCBSXQIUSQYCAR-UHFFFAOYSA-N	437.466	1.931	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](F)Cl)C2)n1	1778024422	YRSPVAMNPMFETG-IDHHARJASA-N	426.876	1.702	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H]1CC[C@H]3CCC(=O)N3C1)C2)[C@@H](F)Cl	1778025212	NKZXGFNEGSTPOK-ZWBXUGMZSA-N	429.920	1.436	50	20	IDGD	
Cn1ncc2c(C(=O)N3CC[C@@]4(CN(C(=O)CO[Si](C)(C)C)CCO4)C3)cccc21	1778029067	NWHYVVGBOOYWCC-OAQYLSRUSA-N	430.581	1.868	50	20	IDGD	
C[C@@H](Nc1nccs1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2	1778066939	IYJNALQSNCEIAW-KYZVSKTDSA-N	430.958	1.057	50	20	IDGD	
COc1cnc(C(=O)N2CCO[C@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)c(F)c1	1779296598	VDKJBDYHBUREDH-IBGZPJMESA-N	425.533	1.524	50	20	IDGD	
CC(C)NC(=O)OC(C)(C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2	1780583039	IINPGWMDTGEUAI-STXHMFSFSA-N	447.960	1.013	50	20	IDGD	
CN1CCC[C@@H](C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](F)Br)C2)C1	1780773658	KUIJYYGGRCJVFC-ZXFNITATSA-N	434.350	1.533	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)Cc3cnc4ccccn34)CCO2)C1	1781225495	KSFUFVPGWKXCKO-UXHICEINSA-N	439.343	1.943	50	20	IDGD	
O=C(c1cccc2c[nH]nc12)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781330616	CSGCATYWWOFIJT-YOEHRIQHSA-N	425.258	1.697	50	20	IDGD	
O=C(c1cc2cnccc2[nH]1)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781331082	CYUBMGQHQXISQT-RHSMWYFYSA-N	425.258	1.697	50	20	IDGD	
O=C(c1cccn2ccnc12)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781331808	QGUZQZZDMLZVOV-DYVFJYSZSA-N	425.258	1.468	50	20	IDGD	
O=C([C@@H](O)Cc1ccccc1)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781332820	FOHKLVUQVNQVHY-RLFYNMQTSA-N	429.286	1.110	50	20	IDGD	
CCC(=O)N[C@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](Br)CC)C1	1781897637	NGJOYUCYPJOCGM-NXEZDXNNSA-N	446.386	1.589	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(C(F)F)no1)C2	1782170481	MWUIMOLTZADHLR-YRILPIOLSA-N	435.855	1.994	50	20	IDGD	
O=C([C@@H]1Cc2ccccc2N1)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1782841626	FPIXVRICEABZQC-MPGHIAIKSA-N	426.286	1.544	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)[C@@H](F)Br)CCO2)C1	1783351543	BTBWSPPOUUJCNR-CWSCBRNRSA-N	430.112	1.680	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cnn4c3CCC4)CCO2)C1	1783353601	PZCQYEZDECABPQ-RDTXWAMCSA-N	425.327	1.446	50	20	IDGD	
COc1cccc(OC)c1C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](C)Br)C2)C1	1783536257	FRIRDAVGMMNEBO-BFUOFWGJSA-N	441.322	1.931	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3c[nH]c4ccc(OC)nc34)CCO2)C1	1783880588	DKUNRTKHGGPANE-VLIAUNLRSA-N	436.896	1.269	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ncc(Cl)cn3)C[C@@H]21	1783968629	DEGGXAQQTPTCDS-IMIFBBOLSA-N	445.745	1.754	50	20	IDGD	
CCOC(=O)C1(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]3C2)CC1	1783975047	YOONYBVQDMXADL-QPSCCSFWSA-N	445.354	1.340	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]3C2)c(C(F)(F)F)o1	1784087146	ZSAUGSGAYOLNEP-DEQVHRJGSA-N	438.830	1.800	50	20	IDGD	
CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@]2(CN(C(=O)C(Cl)Cl)CCO2)C1	1785348860	UAIBEFXDLNMSAG-KZULUSFZSA-N	438.352	1.923	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)Cn3cccn3)[C@H]2C1	1785445215	WUEIVLJFFIRYLE-YXMSTPNBSA-N	427.343	1.282	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)C3(NC(=O)OC(C)(C)C)CC3)C2)C1	1785711541	FWXMHALZGZQCJR-KUHUBIRLSA-N	429.945	1.891	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(C)cnc3Cl)[C@H]2C1	1786257906	XLQAHOAZPPOGBT-TUUVXOQKSA-N	430.332	1.891	50	20	IDGD	
O=C(CSc1ncccn1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21	1787075215	WYVQHPZQWKYVGT-MNXVOIDGSA-N	447.330	1.239	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(N4C(=O)C=CC4=O)cc3)C[C@@H]21)[C@@H](F)Cl	1787450064	TWZLHQJACPVQNM-QBWPOKONSA-N	449.866	1.244	50	20	IDGD	
COCc1oncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21	1787720678	SWRNABNTUBFUIS-UBHSHLNASA-N	430.299	1.199	50	20	IDGD	
Cc1cc(CC(=O)NC2(c3ccc(NC(=O)c4cccc(B(O)O)c4)cc3)CCC2)no1	1788149484	XMLHSEZYCAXSAH-UHFFFAOYSA-N	433.273	1.653	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(Cl)nn3)C[C@@H]21	1788764632	PLIGTSAVMDEHAF-YDHLFZDLSA-N	426.977	1.575	50	20	IDGD	
CCn1nc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Br)C[C@@H]32)cc1C	1789000545	OQYSUOGHIFYPHQ-JURCDPSOSA-N	431.306	1.495	50	20	IDGD	
CN(C)c1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]32)cn1	1789027375	RCIINKMMDUTNCJ-ZKNHNOBHSA-N	443.375	1.977	50	20	IDGD	
Cc1ncncc1C(=O)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1	1789829224	WPFYNUHORHIPGG-UHFFFAOYSA-N	430.273	1.526	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(O)c([N+](=O)[O-])c3)[C@H]2C1	1790022475	KCXXNLSTTIJCFF-ZJOBFFGXSA-N	441.868	1.148	50	20	IDGD	
Cn1cc2cc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)CCBr)C[C@@H]43)ccc2n1	1790350797	USMURAIBCSBTBV-ZVZYQTTQSA-N	449.349	1.952	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cc(C)on3)C[C@@H]21	1790964288	WNJHHGSKWJQCBZ-TUUVXOQKSA-N	428.327	1.679	50	20	IDGD	
O=C(Cc1ccc2c(c1)CCO2)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21	1791004767	FYQJNZCBUXWLOQ-ZOBUZTSGSA-N	427.328	1.947	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]2C1	1791055245	QANRDALNQFPLGS-BNDIWNMDSA-N	440.176	1.781	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)COc3cccnc3)C[C@@H]21	1791057201	OXLMTVJRXUNALY-VRKREXBASA-N	426.311	1.224	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3c(F)ccc(F)c3F)C[C@@H]21	1791249711	PEAAWJTWJGPCGJ-MJFSBKNWSA-N	448.869	1.880	50	20	IDGD	
O=C(COc1cccc(Cl)c1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2	1792748192	BQRXWZMNSDHFRD-OJXGSEEGSA-N	449.704	1.999	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(CO)c(F)c1)C2	1792873352	VHKUAMTYGYCGMI-FIUQPQMISA-N	443.313	1.552	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc3nccn13)C2	1792873585	DVFYLYNHUHIPSK-VWPFQQQWSA-N	435.322	1.569	50	20	IDGD	
COc1ccc([C@@H](C)C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)cc1	1792933611	BROWSIXFLVBOJS-HUJKARHJSA-N	436.317	1.431	50	20	IDGD	
C[C@@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCl	1793115917	AAFMDFULGLUQRN-SOVHRIKKSA-N	437.924	1.539	50	20	IDGD	
C=CC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2	1793597146	DRBCAHPLYMLVTA-AICCOOGYSA-N	433.908	1.580	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCC(N)=O)C2	1794144174	UDMJWROKTGNIBN-CRWXNKLISA-N	430.933	1.022	50	20	IDGD	
Cc1ccc2oc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)c3cnccc3C(=O)NN)C4)cc2n1	1796400472	LDCVXFDTKXLTMY-QDMKHBRRSA-N	448.483	1.700	50	20	IDGD	
C[C@H](Nc1nccs1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)CBr)C2	1796411123	UBTHCJXBFWRFTB-YHQUGGNUSA-N	445.383	1.564	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2)c1ncsc1Br	1796493113	GYFCGSLEARWKME-FBSDJGSXSA-N	426.695	1.643	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc3cccn3cn1)C2	1796892558	PRLYMVWMALKLKW-SSYSSCGSSA-N	447.499	1.720	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1CCSCC1)C2	1796893149	LPLMKJMOVGYLAF-DZBUXLHASA-N	431.562	1.902	50	20	IDGD	
C[C@@H](Nc1cnccn1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@](C)(Cl)CCl)C2	1797780644	QODCESNFQLNVQT-RWAMIBMJSA-N	430.336	1.103	50	20	IDGD	
COc1ccnc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CO[Si](C)(C)C)C3)c1OC	1798766980	AVRAAIGXWYOCQL-XOIINTDNSA-N	437.569	1.154	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)N(C)C(=O)OC(C)(C)C	1799135596	RFRVDBSAMQNZNC-RBGFHDKUSA-N	431.961	1.849	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc3ncccn13)C2	1799275122	LAOLDPWZSCGLGV-AZGFTEDZSA-N	426.304	1.169	50	20	IDGD	
Cc1ccc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Br)nc1	1799344914	XUMLMNVYRKYHRP-DLTLXFJOSA-N	428.302	1.603	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN(C)NC(=O)NCc1ccccc1	1799870017	XRCDCJZBYOERKG-RDGPPVDQSA-N	449.983	1.988	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2ccnn2c1	1800023368	PTXUZFZSBXUCTO-FAYQHZLMSA-N	435.322	1.569	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ncc(Cl)cn1)C2	1800639438	WJOOAUIAYAIEHG-LYIQGSDWSA-N	431.718	1.507	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c3c(nn1C)CCC3)C2	1800643086	LCFCNGPMCIHRKI-LMWOUKEDSA-N	439.354	1.286	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc3c(c1)CCO3)C2	1800761844	HETGBXFYPNMOBU-XJTZBENFSA-N	437.334	1.537	50	20	IDGD	
CS(=O)(=O)c1ccc(F)c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](O)CCl)C3)c1	1800845479	KXDQJPDXOJKWHF-BUWBCJGYSA-N	432.901	1.081	50	20	IDGD	
CC[C@@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1nc(C)c(C)[nH]c1=O)C2	1801799806	WWHZQVZFBJVBCG-XJFOESAGSA-N	425.327	1.812	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](CC)NC(=O)OC(C)(C)C	1801961041	NMZXLLGMEASTGV-YIDVYQOGSA-N	431.961	1.897	50	20	IDGD	
CC(C)(CCl)C(=O)NC[C@H]1CCN(C(=O)Cn2ccncc2=O)[C@@H]1c1cccnc1	1802904736	NSMDSMIJXIATIM-VQIMIIECSA-N	431.924	1.609	50	20	IDGD	
CC(=O)NCC(=O)N1CC[C@H](CNC(=O)[C@@H](C)CBr)[C@H]1c1cccnc1	1803014547	FXAUYSWBXGSMNV-XGWLTEMNSA-N	425.327	1.255	50	20	IDGD	
Cc1cc(NC(=O)CC(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]2c2cccnc2)no1	1803139618	RQLKTXICQBRWDG-SPYBWZPUSA-N	449.895	1.012	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)[C@@H]2C[C@@H]2F)[C@@H]1c1cccnc1	1803972421	WAGNJVIXONUZGJ-KPLCSCQTSA-N	440.479	1.579	50	20	IDGD	
Cc1cc(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)c(C)o1	1805561514	LNNGZEJISVQISW-UGKGYDQZSA-N	447.300	1.605	50	20	IDGD	
Cn1cc(CC(=O)N2CC[C@@H](CNC(=O)CCBr)[C@@H]2c2cccnc2)cn1	1806346485	IBJQZXIZFFMJFB-LPHOPBHVSA-N	434.338	1.849	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)CNC(=O)c2ccco2)[C@H]1c1cccnc1	1807595973	NJGPNCPVCOVJRQ-TXPKVOOTSA-N	448.907	1.364	50	20	IDGD	
Cc1nn(C)c(C(=O)N2CCCC3(CCN(C(=O)CCC(=O)NN(C)C)CC3)C2)c1F	1807811768	NOVQZHOXWUNYTG-UHFFFAOYSA-N	436.532	1.085	50	20	IDGD	
Cc1[nH]ccc1C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1808750330	OAPOTCWBILLWDH-WIYYLYMNSA-N	432.289	1.031	50	20	IDGD	
Cc1cc[nH]c1C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1	1810298055	GDBSXYAZZOZSJS-JXFKEZNVSA-N	447.499	1.350	50	20	IDGD	
Cc1nc(C(=O)N2CC[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)co1	1810298433	IMAUQPOHUPQFQQ-HNAYVOBHSA-N	449.471	1.010	50	20	IDGD	
CC(C)/C=C/C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1	1810309348	QLHMAZVCUOKPAH-HAYFENEFSA-N	436.516	1.612	50	20	IDGD	
CC[C@@H](NC(C)=O)C(=O)N1CC[C@H](CNC(=O)CO[Si](C)(C)C)[C@@H]1c1cccnc1	1810537862	QHGUOQIJAPXYOY-GGPKGHCWSA-N	434.613	1.854	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@H]1CCN(C(=O)Cn2ccncc2=O)[C@@H]1c1cccnc1	1810543559	BXYAXJHQVZWGTG-DYESRHJHSA-N	443.580	1.196	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2ccsc2)[C@@H]1c1cccnc1	1813070925	MKNWRWITNZAUDL-OXJNMPFZSA-N	429.546	1.836	50	20	IDGD	
CO[C@H](C)C(=O)NC[C@H]1CCN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@H]1c1cccnc1	1813105349	KFBGGVHDSWIYBO-YNZGHISLSA-N	440.504	1.256	50	20	IDGD	
Cc1ccc(CC(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)o1	1813509948	OKGRCIHSTCCPDG-CVDCTZTESA-N	447.300	1.225	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1CCc2nc(NC(=O)CN3CCOCC3)sc2C1	1814567303	TXKWMNOCCBUKHU-CYBMUJFWSA-N	426.615	1.239	50	20	IDGD	
C[C@H](NC(=O)OC(C)(C)C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1	1814674837	YHRIXSCXBMPNJB-YUTCNCBUSA-N	443.932	1.915	50	20	IDGD	
C[C@H](Cn1cccn1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1	1816017347	KWZBHEYZTRUBNE-NVXWUHKLSA-N	444.540	1.308	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)CCBr)n[nH]1	1816784519	HTBABGKOPCNWID-ZDUSSCGKSA-N	443.346	1.560	50	20	IDGD	
O=C(CCNC(=O)c1ccc[nH]1)N[C@@H]1CCc2nc(NC(=O)[C@@H](F)Cl)sc2C1	1817116500	BLVAEQKABGIBRS-YMTOWFKASA-N	427.889	1.738	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H]1CCOC1)CC2	1817282724	LCXJKSAIFKIBFW-PTFKFJSFSA-N	444.517	1.226	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CN2CCNC2=N)n[nH]1	1817292319	SFDZMAWSTQRYCG-DGCLKSJQSA-N	440.346	1.273	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](C)CBr)[nH]n1	1817989130	QEYUIQRGEYTSPO-GMXVVIOVSA-N	443.346	1.880	50	20	IDGD	
CN1CCN(CC(=O)Nc2nc3c(s2)C[C@@H](NC(=O)CCBr)CC3)CC1	1818797075	JBLDFUMFQQCPSZ-LBPRGKRZSA-N	444.399	1.088	50	20	IDGD	
CCNC(=O)N[C@@H](C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCBr)[nH]n1	1819350192	KFDFUECZPIHIRT-AAEUAGOBSA-N	443.346	1.894	50	20	IDGD	
Cc1ncccc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819401845	CECCCHYDSAYNMZ-SFHVURJKSA-N	448.487	1.731	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](C)N3C[C@@H]4C[C@H]4C3)sc2C1	1819579506	FJIKDRJMOGYADN-YHQUGGNUSA-N	426.970	1.649	50	20	IDGD	
CCCC(=O)N[C@H](C)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](Cl)COC)CC2	1820120354	WUUPCAKQCWWUPO-UTUOFQBUSA-N	430.958	1.614	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc([N+](=O)[O-])[nH]2)n[nH]1	1820368506	PFKAMKZXGBCPKI-AWEZNQCLSA-N	446.468	1.325	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)C2=COCCC2)n[nH]1	1822459405	CKCFQLCOGFJVOI-KRWDZBQOSA-N	439.476	1.408	50	20	IDGD	
O=C(CN1CCCC1=O)N[C@@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1	1823004051	OWJFSVWDAMXEMA-OQPBUACISA-N	433.303	1.368	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)Cn2ccnn2)CC1	1824092951	JRXVSHFYMQSOLI-GDBMZVCRSA-N	426.359	1.929	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)C2=NN(C)C(=O)CC2)CC1	1824928436	UCTFEMFFEHWUGT-NVXWUHKLSA-N	426.945	1.468	50	20	IDGD	
CC(=O)c1cc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)n[nH]1	1825709184	ADTGHGVVANJSON-LJQANCHMSA-N	446.552	1.219	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(=O)n3[nH]cnc3n2)CC1	1827049513	OWEXQEFTIRXKOB-GOEBONIOSA-N	434.928	1.668	50	20	IDGD	
O=C([C@@H]1CCCSC1)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827059384	AAVJETXDNIPUAD-CTNGQTDRSA-N	444.406	1.743	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CS(C)(=O)=O)CC1	1830317735	SOWRWGQRLPKLSC-WMLDXEAASA-N	427.394	1.887	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H]2CC[C@H](O)CC2)CC1	1831875479	WCOYIKUHEJNINY-VAMGGRTRSA-N	436.597	1.530	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCC([C@H]2CCCCN2C(=O)CN2C(=O)C=CC2=O)CC1	1831986433	RTXXVFAFOXTGCI-QRWLVFNGSA-N	444.359	1.767	50	20	IDGD	
Cc1noc(C)c1CCC(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1833060692	SLUYLPOOWZVYCH-NRFANRHFSA-N	441.956	1.945	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)C3(C)CCCC3)CC2)CC1	1833127346	GHAARSRQTAQNSW-UHFFFAOYSA-N	435.613	1.511	50	20	IDGD	
CC(C)NCCC(=O)N1CCC(N2CCC(NC(=O)[C@H](C)CBr)CC2)CC1	1833263862	WKIIPLPWVOJGCN-MRXNPFEDSA-N	445.446	1.977	50	20	IDGD	
C[C@@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)C(=O)C3CC3)CC2)CC1	1833264434	BFQANHQCMYQEGZ-ZDUSSCGKSA-N	428.371	1.568	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)Cc3ccc(F)c(F)c3)CC2)CC1)[C@@H](O)CCl	1833309191	RIWKERAUNJKBPG-IBGZPJMESA-N	443.922	1.679	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3ccc(F)c(F)c3)CC2)CC1)[C@@H](O)CCl	1833313923	TYOOWXRYQLMNCN-SFHVURJKSA-N	429.895	1.750	50	20	IDGD	
C#CCO[C@H](C)C(=O)NC1CCN(C2CCN(C(=O)[C@H](Br)CC)CC2)CC1	1833469324	QOVUJZHRVNBGCW-CRAIPNDOSA-N	442.398	1.770	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)CN3CCOC3=O)CC2)CC1	1833529618	DYXVFKOWYVKOCU-KRWDZBQOSA-N	428.961	1.418	50	20	IDGD	
CC(=O)N(C)CCC(=O)NC1CCN(C2CCN(C(=O)[C@@](C)(Cl)CCl)CC2)CC1	1833669742	ADPGVXFQBYHSLG-FQEVSTJZSA-N	449.423	1.663	50	20	IDGD	
O=C(CCc1cn[nH]c1)NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1	1833813337	XSWMHHYWBYVREA-KRWDZBQOSA-N	444.349	1.604	50	20	IDGD	
Cn1nc(C(=O)NC2CCN(C3CCN(C(=O)[C@](C)(Cl)CCl)CC3)CC2)cc1O	1833945565	OOBOEKRVGKQYKY-LJQANCHMSA-N	446.379	1.547	50	20	IDGD	
COc1ncc(C(=O)NC2CCN(C3CCN(C(=O)[C@H](O)CCl)CC3)CC2)cc1F	1833964077	OKPCKBKHAHSPOJ-QGZVFWFLSA-N	442.919	1.014	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)c(C)o1	1834094570	BTRJIPAXJGOFNC-YOEHRIQHSA-N	433.274	1.657	50	20	IDGD	
Cn1cncc1C(=O)NC1CCN(C2CCN(C(=O)[C@@](C)(Cl)CCl)CC2)CC1	1834244808	KXMPKAMIJGCXSF-IBGZPJMESA-N	430.380	1.842	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@]3(CN(C(=O)CCBr)CCO3)C2)cn1	1834819421	QNLRDCQNMZAQEH-SFHVURJKSA-N	426.311	1.245	50	20	IDGD	
CC(C)n1nccc1C(=O)N1CCOC[C@]2(CN(C(=O)CCBr)CCO2)C1	1834823474	WKOUKLRGSKNEDX-SFHVURJKSA-N	443.342	1.319	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3nc4ccccn4n3)CC2)CC1	1834969843	TZVIFNQHVDWQJO-QGZVFWFLSA-N	432.956	1.932	50	20	IDGD	
C[C@@H](Nc1cnccn1)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](F)Cl)CC2)CC1	1835084079	KDUSFERPRIAAHK-CXAGYDPISA-N	426.924	1.383	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC1CCN(C2CCN(C(=O)c3ccc(=O)oc3)CC2)CC1	1835833603	WWENAKJHDKDPJY-UHFFFAOYSA-N	435.597	1.677	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)c3ccc4nncn4c3)CC2)CC1	1836396744	MZZLVVBFUPAKMM-GOSISDBHSA-N	432.956	1.932	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)CNC(C)=O)CC2)CC1	1838752661	TTXNNFMOETWKJW-INIZCTEOSA-N	432.359	1.295	50	20	IDGD	
O=C(c1ccoc1Cl)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1838844811	MEXULBUUOPOXOI-ABAIWWIYSA-N	439.665	1.694	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(OC)cc3O)CCO2)C1	1838887700	RBXJTIOGKZCXNL-LAUBAEHRSA-N	440.924	1.878	50	20	IDGD	
Cc1ccnc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)c1	1839200169	CXYMGLSZRCAYFI-RHSMWYFYSA-N	430.274	1.151	50	20	IDGD	
Cc1nc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)ccc1F	1840031039	DNHRHVKAKPYXBC-SGTLLEGYSA-N	444.301	1.383	50	20	IDGD	
Cc1ccc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)cc1	1840031879	FSLZELIIUALGJX-OXQOHEQNSA-N	439.350	1.777	50	20	IDGD	
O=C(COc1ccc(F)cc1)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840188135	QDLZFLACUSZUFV-GOSISDBHSA-N	435.279	1.465	50	20	IDGD	
O=C(c1ccc2c(c1)CCCO2)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840190891	SXWXCNUXUAXPHV-FQEVSTJZSA-N	443.327	1.885	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3cc(C)cc(F)c3)CCO2)C1	1840241690	RBUAOYKAPHLSRG-WIYYLYMNSA-N	442.915	1.387	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CC[C@H](O)CC1)CCO2	1840270706	BYYVEAUCLLZRGR-LNMJFAINSA-N	437.364	1.230	50	20	IDGD	
O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)CC[C@@H]1CCOC1)CCO2	1840587821	IHCIWXILONLJAR-CRAIPNDOSA-N	433.343	1.045	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(C)c(O)c(C)c3)CCO2)C1	1840677177	SNVMMFXJOCGFBH-UWJYYQICSA-N	440.924	1.333	50	20	IDGD	
CC(C)(C)OC(=O)N1CCCC[C@@H]1C(=O)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1	1841353673	JTMIJNBRJKOJCV-HUUCEWRRSA-N	429.945	1.579	50	20	IDGD	
CC(C)[C@H](C(=O)N1CCCC12CN(C(=O)c1cnccc1C(=O)NN)C2)c1ccccc1	1841406245	JGNABRKELNMESP-FQEVSTJZSA-N	435.528	1.942	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCCC12CN(C(=O)CSCC(=O)O)C2	1841925275	HCKOJNNDSGOHKG-LBPRGKRZSA-N	449.957	1.140	50	20	IDGD	
Cc1csc(CCC(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)c1	1844263831	ZESBYNVUDQHHRE-UHFFFAOYSA-N	427.530	1.505	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](O)[C@@](C)(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](F)Cl)C1	1847238172	VZFYSHDYIIHAGK-MOMPZSSISA-N	447.935	1.731	50	20	IDGD	
CON(C)S(=O)(=O)c1cc(C(=O)NNC(=O)c2cccc(N(C)C)c2)ccc1Cl	14849521	HOENFNUVNWCNEO-UHFFFAOYSA-N	440.909	1.663	50	20	IDGD	
O=C(COC(=O)c1sccc1S(=O)(=O)N1CCCC1)NNC(=O)c1ccccc1	25806776	ILQQQGIWCYQPOD-UHFFFAOYSA-N	437.499	1.151	50	20	IDGD	
O=C(NNC(=O)[C@H]1CC[C@H](C(F)(F)F)NC1=O)c1ccc(F)cc1Br	195571190	ZZYOGDRJNYIGCI-WCBMZHEXSA-N	426.164	1.806	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)CS[C@H]2CCS(=O)(=O)C2)cc1OC	726190612	YXEHETVIXDRUFX-AWEZNQCLSA-N	430.548	1.555	50	20	IDGD	
C[C@H](CC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)NC(=O)C1CCCC1	727096030	HAKVSUHMHUNTMR-GOSISDBHSA-N	429.565	1.431	50	20	IDGD	
Cc1nc2n(n1)C[C@@H](NC(=O)NNC(=O)COc1ccccc1Cc1ccccc1)CC2	727228650	HZTJKEGMKXIVPV-IBGZPJMESA-N	434.500	1.902	50	20	IDGD	
CC(C)[C@H](NC(=O)NNC(=O)c1csc(N2CCOCC2)n1)c1nc(C2CC2)no1	727944315	XRFDBIBFJVHDEV-ZDUSSCGKSA-N	435.510	1.581	50	20	IDGD	
O=C(CN1C(=O)c2ccc(Br)cc2C1=O)NNc1nc(-c2ccncc2)no1	728073325	FVZDAGRBGLKRID-UHFFFAOYSA-N	443.217	1.633	50	20	IDGD	
COc1ccc(-c2nc(CC(=O)N([C@H]3CCS(=O)(=O)C3)N(C)C)cs2)cc1OC	728179044	NRYVRVQAKVDIAP-HNNXBMFYSA-N	439.559	1.862	50	20	IDGD	
CN(C)c1ccc(NC(=S)NNC(=O)CNC(=O)NCc2ccc([N+](=O)[O-])cc2)cc1	729688962	LPLUZHWEZLTFEK-UHFFFAOYSA-N	445.505	1.478	50	20	IDGD	
Cc1cc(S(=O)(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)ccc1F	729836665	KINUNNOUYNYBKU-UHFFFAOYSA-N	441.506	1.542	50	20	IDGD	
Cc1ccc(S(=O)(=O)Nc2ccc(F)cc2)cc1C(=O)NNC(=O)Cc1cc[nH]n1	730090431	ATDQRFOSAKZSOJ-UHFFFAOYSA-N	431.449	1.662	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@H]2CC(=O)N(c3ccc(F)cc3)C2)c2ccccc2c1=O	730204804	DTIUNMWOSXKEPF-ZDUSSCGKSA-N	437.431	1.370	50	20	IDGD	
O=C(NNC(=O)[C@@H](c1ccccc1)N1CCCCC1=O)C1CCN(c2ncccn2)CC1	731228693	LWEYWSXEYUPWFS-HXUWFJFHSA-N	436.516	1.594	50	20	IDGD	
Cc1cc(OCc2ccc(C(=O)NNC(=O)CN3CCC(=O)NC3=O)cc2)ccc1Cl	731865287	ANEQEUKZHGXRIV-UHFFFAOYSA-N	444.875	1.930	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2nnc(-c3ccccc3)o2)c(F)cc1F	732045490	BLCYMYGPHURHHS-UHFFFAOYSA-N	438.368	1.425	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)cc1	732263223	AUVGMKPXOBKBMM-AWEZNQCLSA-N	431.474	1.829	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)NCCC(=O)N1CCN(c2ccccn2)CC1)c1ccccc1	732459326	TUFHWXSTNLSHQK-IBGZPJMESA-N	438.532	1.645	50	20	IDGD	
CCc1nc(CN2CCC(CNC(=O)NNC(=O)Cn3nc(C)cc3C)CC2)cs1	732470818	RDIYEXGVQVFXRD-UHFFFAOYSA-N	433.582	1.761	50	20	IDGD	
CN(C)CCNC(=O)c1cccc(CNC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c1	733346364	QYCFXRJEWWLRMW-UHFFFAOYSA-N	449.515	1.308	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)c1cnc(S)n1-c1ccc(F)cc1	734238905	BNPAMQKFVWZSPN-UHFFFAOYSA-N	438.485	1.769	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NNc2ncccc2Cl)o1	734247654	WFFVQQRGQFLMOU-LBPRGKRZSA-N	442.881	1.801	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)Cn2ncc3ccccc3c2=O)CC1	734826096	WUVLXEBMFPUCIJ-UHFFFAOYSA-N	444.492	1.126	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)COc2cccc(Cl)c2)CC1	735117584	YIGUTTGBMKSWRY-UHFFFAOYSA-N	439.925	1.193	50	20	IDGD	
CC(=O)N1CCCc2ccc(S(=O)(=O)NNC(=O)C(=O)Nc3ccc(C)c(C)c3)cc21	736064682	XVNHICAHRWVOHC-UHFFFAOYSA-N	444.513	1.551	50	20	IDGD	
O=C(N[C@H](C(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1)c1ccccc1)OCc1ccccc1	737778112	GSCBJAFXIPBVFA-ROUUACIJSA-N	445.497	1.236	50	20	IDGD	
CC(=NNC(=O)[C@@H]1COc2ccccc2O1)c1cccc(S(=O)(=O)N2CCOCC2)c1	739399335	CKDXAHWIXPMYHE-FQEVSTJZSA-N	445.497	1.388	50	20	IDGD	
Cc1cc2c(cc1C)O[C@H](C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1)C2	743418263	DWILSJJAZXVZMX-SFHVURJKSA-N	445.545	1.081	50	20	IDGD	
COc1cc(C=NNC(=O)Cc2cc(O)nc(O)n2)c([N+](=O)[O-])cc1OCC(F)(F)F	743447068	BGBMONFOJCSOLL-UHFFFAOYSA-N	445.310	1.439	50	20	IDGD	
CCc1nsc(N2CCN(C(=O)NNC(=O)c3cc(Br)c[nH]3)CC2)n1	743507888	FTXGECJZQDDCLZ-UHFFFAOYSA-N	428.316	1.368	50	20	IDGD	
COc1ccccc1O[C@@H](C)CNC(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	743692369	XYIPYHUPSJCORL-AWEZNQCLSA-N	425.445	1.998	50	20	IDGD	
O=C(Cn1cccc(C(F)(F)F)c1=O)NNC(=O)c1cc(Br)ccc1O	743730185	RBGKEQOLNASPOO-UHFFFAOYSA-N	434.168	1.796	50	20	IDGD	
O=C1C[C@@H](Cc2ccc(C(=O)NNC(=O)c3cccc(Br)c3)cc2)C(=O)N1	743731599	VSZHHCGRJUZPCO-CQSZACIVSA-N	430.258	1.729	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)c2cc(Br)ccc2O)cc1	743732335	QQFHIPIPZNLADD-UHFFFAOYSA-N	442.291	1.480	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)N[C@H](c2ccc(F)cc2)c2cccc(S(C)(=O)=O)c2)cn1	745899449	OXKDZOWLBSQNJM-GOSISDBHSA-N	445.476	1.696	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)c2cccc3cccnc23)cc1	747406987	CSCMAOZTFOCPQO-UHFFFAOYSA-N	434.499	1.108	50	20	IDGD	
CN(C)CCNC(=O)c1cccc(CNC(=O)NNC(=O)c2ccc(Cl)cc2F)c1	747503601	VVPDHVUKNZPQDB-UHFFFAOYSA-N	435.887	1.915	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)Nc2nccs2)cc1)c1ccnc(-n2cncn2)c1	747942772	DHKCFGTUFCKIGL-UHFFFAOYSA-N	442.486	1.677	50	20	IDGD	
COc1cc(OC)cc(N2CC[C@@H](NC(=O)NNC(=O)Cc3ccccc3OC)C2)c1	748660270	DUXLECPGODVJPN-MRXNPFEDSA-N	428.489	1.864	50	20	IDGD	
COc1cc(OC)cc(N2CC[C@@H](NC(=O)NNC(=O)COCc3ccccc3)C2)c1	748662162	QGOXYVRUFKXQOW-QGZVFWFLSA-N	428.489	1.830	50	20	IDGD	
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	749583417	LVXMBHUMHOPOMB-OXJNMPFZSA-N	444.557	1.945	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)oc1C	751142795	QKTGOQYUFKHCEB-UHFFFAOYSA-N	428.419	1.024	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)CCOc2cccc(C(N)=O)c2)c2ccccc2c1=O	751298549	UNKSUURNDVECEN-UHFFFAOYSA-N	437.456	1.136	50	20	IDGD	
COc1cccc([C@@H](C)CC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)c1	753275984	BMFMZYVXBFRQJD-INIZCTEOSA-N	433.530	1.965	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)N[C@@H]1COc2cc(F)cc(F)c21	753419160	KDXUEMQQAJHJCB-GOSISDBHSA-N	445.470	1.941	50	20	IDGD	
COc1ccc([C@@H]2[C@@H](C(=O)NNC(=O)CO)CCC(=O)N2c2ccc(C)cc2)cc1OC	753442277	CVZUUCHDJYJPAN-HTAPYJJXSA-N	441.484	1.636	50	20	IDGD	
CSc1cc(Br)ccc1/C=C(\C#N)C(=O)c1c(N)n(C)c(=O)n(C)c1=O	755032691	SWWDJACNKFDNIR-UXBLZVDNSA-N	435.303	1.940	50	20	IDGD	
CCc1noc(CC)c1CC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	755046762	FZFOQNXSIGOPEU-UHFFFAOYSA-N	434.518	1.588	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(N(C)C)c(NC(=O)NNC(=O)c2cnccn2)c1	755435818	UUIMEOOJXINGNY-UHFFFAOYSA-N	435.510	1.040	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccc(NC(=O)[C@@H]3CCCO3)cc2)c1	755642280	XBBADHZKFPDEAW-KRWDZBQOSA-N	446.485	1.674	50	20	IDGD	
CCOCCOCc1cccc(NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c1	755968697	BTMAEWOPCIECAP-UHFFFAOYSA-N	439.472	1.953	50	20	IDGD	
CN1CCCCC/C1=N/S(=O)(=O)c1ccc(NC(=O)NNC(=O)Cc2cc[nH]n2)cc1	756115262	SXELYNWHSVTUAV-UQQQWYQISA-N	447.521	1.398	50	20	IDGD	
CC(=O)N1CCCc2cc(NC(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)ccc21	756280946	LIWPPCYRLGDRJY-UHFFFAOYSA-N	434.456	1.699	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)Nc1cc(F)c(I)c(F)c1	756280995	NICZJTYJZLWXCL-ZETCQYMHSA-N	443.188	1.774	50	20	IDGD	
Cc1ncc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)cn1	756372751	SXXGSJHVWDLWDE-UHFFFAOYSA-N	440.485	1.730	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1C	756517142	WBEGSHPROUDVII-KRWDZBQOSA-N	434.474	1.749	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)C1CCC1	756733789	LXDPXIXZIBOBKB-HNNXBMFYSA-N	438.550	1.159	50	20	IDGD	
COc1ccc2c(c1)OC[C@H]2CC(=O)N1CCN(S(=O)(=O)CBr)CC1	758514016	XUOGLCJGCIFXGE-GFCCVEGCSA-N	433.324	1.388	50	20	IDGD	
CC(=O)N[C@H](C(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1)C1CCCC1	758785778	FVSFRFNGNJRMIP-INIZCTEOSA-N	425.530	1.317	50	20	IDGD	
CC[C@H]1Oc2cc([C@@H](C)NC(=O)NNC(=O)C(=O)Nc3ccccn3)ccc2NC1=O	758821388	MTZKATHAPUFXQQ-BXUZGUMPSA-N	426.433	1.221	50	20	IDGD	
CCn1c(=O)nc(O)c2c(C(=O)NNc3ccc(C(=O)OC)cn3)cc(C(C)C)nc21	759726320	WJOGOHRGMGUHNQ-UHFFFAOYSA-N	426.433	1.579	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)Cc2ccc(S(=O)(=O)N3CCCCC3)cc2)nc1	759737387	AZWUKVZPNPQNSJ-UHFFFAOYSA-N	432.502	1.729	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)NCc1cccnc1N1CCN(C)CC1	761672602	WUNKHSYZSTXGAK-UHFFFAOYSA-N	444.561	1.465	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N[C@H](C)CCS(C)(=O)=O	761995507	ZEKRMUUJAHXCIL-MNOVXSKESA-N	436.328	1.370	50	20	IDGD	
COc1ccc(NC(C)=O)cc1S(=O)(=O)NNC(=O)CCCNC(=O)OC(C)(C)C	763432642	HSZQOGXDFASHQR-UHFFFAOYSA-N	444.510	1.268	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3ccc4ccccc4n3)cn2)C[C@@H](C)O1	763451343	VCEMUXXGPRHEDT-GASCZTMLSA-N	448.483	1.643	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cccc(N(C)C(C)C)c2)cc(OC)c1OC	763543105	LEQMCFDITBHGOD-UHFFFAOYSA-N	444.488	1.957	50	20	IDGD	
Cc1cc(C(=O)NC(C)C)ccc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccccc2)[nH]n1	763601176	PRCMHKNRCZPSEA-UHFFFAOYSA-N	448.483	1.923	50	20	IDGD	
CCNC(=O)COc1cccc(NC(=O)C(=O)NNC(=O)c2cc(C)nc3ccccc23)c1	763617328	XNGPLZQVEANATM-UHFFFAOYSA-N	449.467	1.458	50	20	IDGD	
N#CCCn1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2Cc2ccccc2)n1	763719471	YPBZUKQMWZBERO-UHFFFAOYSA-N	446.467	1.552	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)c(OCCN(C)C)c1	763870750	CDQKNNYPSKCXDE-OAHLLOKOSA-N	446.479	1.628	50	20	IDGD	
CC(C)CC(=O)NNC(=O)C(=O)Nc1cccc(S(=O)(=O)N(C)c2ccccc2)c1	763888334	JLSFGDPOEDIIPT-UHFFFAOYSA-N	432.502	1.644	50	20	IDGD	
O=C(CCSc1ccc(F)cc1)NNC(=O)C(=O)Nc1cnn(Cc2ccccn2)c1	763894657	DPUKHFCZRVCMCG-UHFFFAOYSA-N	442.476	1.734	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)OC)cc2F)cc1OC	763902160	RIXQVGVLRNZCHS-UHFFFAOYSA-N	433.392	1.419	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)C(=O)Nc1cccc(Cn2cccn2)c1	763945086	VMZOTIPCYSTXLC-UHFFFAOYSA-N	445.439	1.222	50	20	IDGD	
CC(C)Oc1ccc(C#N)cc1NC(=O)C(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	763947525	BUSKVLFYJQZXGG-UHFFFAOYSA-N	448.439	1.636	50	20	IDGD	
COCCn1ccc(NC(=O)C(=O)NNC(=O)c2ccc(COc3ccccc3)o2)n1	763948665	FGQAHEPNYLFUDX-UHFFFAOYSA-N	427.417	1.101	50	20	IDGD	
C[C@@H]1CC(C)(C)C[C@@]2(C1)NC(=O)N(CC(=O)NNC(=O)CSc1ccccc1O)C2=O	764049312	YEVIJJAKJPHEND-LRTDBIEQSA-N	448.545	1.769	50	20	IDGD	
O=C(NNC(=O)c1ccc(F)cc1Br)C(=O)Nc1cccc([N+](=O)[O-])c1	764086911	WEOPXOUAOXGQRA-UHFFFAOYSA-N	425.170	1.896	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cc(C)n(-c3ccc(Cl)c(Cl)c3)n2)n[nH]1	764106709	PYKATRNRVCRJAP-UHFFFAOYSA-N	436.259	1.919	50	20	IDGD	
COCCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(C)cc2O)cc1Cl	764110727	SOEIQMJVIAPGEI-UHFFFAOYSA-N	448.863	1.130	50	20	IDGD	
CNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(C)cc3)[nH]n2)c1C	764112537	ZNPMIKUKGYJRBN-UHFFFAOYSA-N	434.456	1.453	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(-c3n[nH]c(C4CC4)n3)cc2)c1O	764131114	NEQQGJUQBUUFDS-UHFFFAOYSA-N	436.428	1.463	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1cc(F)ccc1OC[C@@H]1CCCO1	764135203	CBSZTYFWWMMKRJ-INIZCTEOSA-N	445.447	1.721	50	20	IDGD	
Cc1ccc(Cn2cccc(NC(=O)C(=O)NNC(=O)CCc3ccccc3)c2=O)cc1	764184697	DDTCWEGEUUJADP-UHFFFAOYSA-N	432.480	1.924	50	20	IDGD	
CN1CCN(c2ccc(NC(=O)C(=O)NNC(=O)CCc3ccccc3)cc2Cl)CC1	764186093	VPXKPHRUJBPEKZ-UHFFFAOYSA-N	443.935	1.811	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)C(=O)Nc1cccc(C[S@@](=O)C2CCCCC2)c1	764269093	VLSHAHRFFFJWDL-WJOKGBTCSA-N	442.541	1.992	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)C(=O)Nc1ccc(Cl)c(C(=O)NC2CC2)c1	764277375	CUBSJKWLJBVNBN-UHFFFAOYSA-N	444.875	1.657	50	20	IDGD	
CCCN1C(=O)CCc2cc(NC(=O)C(=O)NNC(=O)COc3ccccc3O)ccc21	764278446	YXVAMWFFAVRALR-UHFFFAOYSA-N	440.456	1.246	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccnn3C(C)C)n[nH]2)cc1OC	764379360	XGTNCRPARFNIDH-UHFFFAOYSA-N	441.448	1.271	50	20	IDGD	
O=C(CO)NNC(=O)C(=O)Nc1nc(-c2ccc(OCc3ccccc3)cc2)cs1	764422576	XKLCFJPRRCVJTH-UHFFFAOYSA-N	426.454	1.467	50	20	IDGD	
CCn1c(NNC(=O)CCC(=O)N2CCN(c3ccccn3)CC2)nc2ccccc2c1=O	764716065	GVTSGLREXLDCDJ-UHFFFAOYSA-N	449.515	1.384	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNS(=O)(=O)c1cc2c3c(c1)CC(=O)N3CCC2	764932555	OIQCQLHJCOHBDM-UHFFFAOYSA-N	425.470	1.101	50	20	IDGD	
COc1cccc(S(=O)(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)c1	765127255	NPQSOIATGMQBNK-UHFFFAOYSA-N	432.546	1.131	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)NCc1cccc(C(F)(F)F)c1)S(=O)(=O)C1CCOCC1	765308359	PDGDLBHOUNHFHR-NSHDSACASA-N	437.440	1.518	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)CCC(=O)Nc2ccc3nc(O)[nH]c3n2)cc1OC	765469588	RXSDDKCOUXZQSR-UHFFFAOYSA-N	442.432	1.251	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C2CCN(S(=O)(=O)c3ccc(C(C)(C)C)cc3)CC2)n[nH]1	765587092	PIVIOXLJDNQBEP-UHFFFAOYSA-N	447.561	1.878	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)NCCN1CCN(c2ccc(F)cc2)CC1	765683371	PEMADMWNAZQWLQ-UHFFFAOYSA-N	435.525	1.678	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3occc3Br)CC2)cc1	765753092	AWXSBASSMZFVKT-UHFFFAOYSA-N	435.322	1.929	50	20	IDGD	
NC(=O)COc1ccc(Cl)cc1S(=O)(=O)NNC(=O)c1ccc2ccccc2n1	766309510	ZYZYAGAYGYMXDD-UHFFFAOYSA-N	434.861	1.376	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)CCC(=O)c2ccc3c(c2)CCC(=O)N3)cn1	767246132	AZYHHWUAIQHXBI-UHFFFAOYSA-N	427.486	1.956	50	20	IDGD	
COc1ccc(-n2nnc(C(=O)OCC(=O)NNC(=O)Cc3ccccc3C)c2C)cc1	767281919	BVAMAXUHQWETQO-UHFFFAOYSA-N	437.456	1.440	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)C(=O)Nc1cnc(Cl)c(Br)c1	768240882	BRLRLPKTTGZMBB-UHFFFAOYSA-N	441.669	1.800	50	20	IDGD	
CC(C)[C@H](NC(=O)OC(C)(C)C)C(=O)NCC(=O)NNC(=O)Cn1ccc2ccccc21	768392530	RXDOHYCVXVVEDF-IBGZPJMESA-N	445.520	1.454	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)c2nccc3c(S(N)(=O)=O)cccc23)c1C	768465289	ZIALCWLWCDYKIC-AWEZNQCLSA-N	442.497	1.728	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)NCCC(=O)NNc2cc(C#N)cc(Cl)n2)cc1	768700740	IBRWBWYGYZSYAO-UHFFFAOYSA-N	436.881	1.377	50	20	IDGD	
CNS(=O)(=O)c1ccc(C)c(NC(=O)NNc2c(OC)cccc2S(C)(=O)=O)c1	769233553	YXGSRXCXGXWUOS-UHFFFAOYSA-N	442.519	1.464	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H](OC)C(C)C)c1	770209940	QNNKQBBUKRSATD-GOSISDBHSA-N	435.502	1.928	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)N[C@H]3CCN(c4ccccc4Br)C3)nc21	770394017	DWLXRQGYVKIKCB-JTQLQIEISA-N	447.297	1.736	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)N1CCN(c2ccc([N+](=O)[O-])nc2)CC1	770649956	RNCNICBCFZDBSL-ZDUSSCGKSA-N	448.867	1.974	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)NC[C@@H](O)C(C)C)cc1	771601371	IYALJCZPEDPIAL-NXIIHZOPSA-N	425.489	1.474	50	20	IDGD	
Cc1nn(C(C)C)c(C)c1S(=O)(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	771607676	PZQCWXDDECQLNG-UHFFFAOYSA-N	427.914	1.360	50	20	IDGD	
COC(OC)c1ccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)o1	771609942	QAUXKWQUFRKDHT-UHFFFAOYSA-N	437.474	1.430	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)O[C@@H](C)C(=O)NNC(=O)CC(C)C)cc1	771844614	FBVSXHBXCGKHNW-RDJZCZTQSA-N	439.534	1.273	50	20	IDGD	
C=CCNS(=O)(=O)c1cc(C(=O)O[C@H](C)C(=O)NNC(=O)CC(C)C)ccc1F	771995395	RKQLOXIPAARQDA-GFCCVEGCSA-N	429.470	1.029	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccccc1S(C)(=O)=O	774008622	JRZPFMQIQIYFKA-NSHDSACASA-N	439.877	1.297	50	20	IDGD	
COC(=O)Cc1occc1C(=O)NNC(=O)[C@H](C)Oc1cccc(Br)c1	774327464	PKKJABQYJCCNEL-JTQLQIEISA-N	425.235	1.986	50	20	IDGD	
COC(=O)c1cc(Br)c(S(=O)(=O)NNC(=O)NC2CCCC2)s1	777619130	UFEBFBCFVHAUAU-UHFFFAOYSA-N	426.314	1.732	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)N[C@H](CO)Cc1c[nH]c2ccccc12	778589215	PQFXKKHAZLUDRF-AWEZNQCLSA-N	444.517	1.009	50	20	IDGD	
C[C@@H](c1ccccc1)n1ccc(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)n1	782893792	MEJAPKLXSVGXMY-HNNXBMFYSA-N	445.483	1.708	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)C(=O)Nc1ccccc1C(F)(F)F	782896600	KPQOFSMNHOHAJT-UHFFFAOYSA-N	443.407	1.398	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)C(=O)NNc1ccc(F)cc1F	783345084	SEVJQDRIVHYNFO-UHFFFAOYSA-N	442.444	1.696	50	20	IDGD	
COc1cc(C)c(Br)cc1NC(=O)C(=O)NNc1ccc(-n2cccn2)nn1	783432908	HVSYNTOADCFXQY-UHFFFAOYSA-N	446.265	1.824	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2ccc(S(=O)(=O)N3CCC[C@@H](C)C3)cc2)ncn1	783948046	QDJBTAFELKIFSG-CYBMUJFWSA-N	432.506	1.287	50	20	IDGD	
CC1(C)Cc2cc(NC(=O)C(=O)NNc3ccc(S(=O)(=O)NC4CC4)cc3)ccc2O1	784212529	BJEYRBXAQFYKQL-UHFFFAOYSA-N	444.513	1.923	50	20	IDGD	
N#Cc1ccc(Cn2cnc(NC(=O)C(=O)NNc3ccc(OC(F)F)cc3)n2)cc1	784317915	JSQJDOOKJCZPDH-UHFFFAOYSA-N	427.371	1.881	50	20	IDGD	
Cn1ccnc1C(=O)c1ccc(NC(=O)C(=O)NNc2ccc(Br)cn2)cc1	784339977	QMTYVJSHOVRGGE-UHFFFAOYSA-N	443.261	1.890	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ccc(OCC(F)(F)F)cc2)cc1S(N)(=O)=O	784370299	LNFCAOXVYRPVRS-UHFFFAOYSA-N	446.407	1.665	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)C(=O)Nc2ccc([C@H](C)N3CCOCC3)cc2)c1	784855319	XPXJZEZUQWCVKO-HNNXBMFYSA-N	426.473	1.948	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNc2nccn(C)c2=O)sc(C)c1C[C@@H](C)CC	785090099	NBTQLULMFPIRRN-NSHDSACASA-N	449.533	1.997	50	20	IDGD	
COC[C@@H](C)n1ccc(NC(=O)C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)n1	785100203	SVZANLVILKSQPT-SNVBAGLBSA-N	436.419	1.343	50	20	IDGD	
Cc1nn(C)c(N2CCN(C(=O)NNC(=O)c3cccc(Br)c3)CC2)c1C#N	788103647	CBSGIUDUWNEXGA-UHFFFAOYSA-N	446.309	1.539	50	20	IDGD	
Cc1ccc(C)c(-n2cnc3cc(C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)ccc32)c1	788587726	LKUZGTUWSGQCJH-AWEZNQCLSA-N	429.502	1.341	50	20	IDGD	
Cc1ccc(-n2cccn2)cc1NC(=O)C(=O)NNC(=O)COc1ccc(Cl)cc1	789585932	HOEWXTNINIXHFG-UHFFFAOYSA-N	427.848	1.999	50	20	IDGD	
CC(=O)c1cccc(S(=O)(=O)NCC(=O)NNC(=O)c2cc(-c3ccccc3)on2)c1	789899881	YLJZZCOXHURVNX-UHFFFAOYSA-N	442.453	1.284	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)c1cc(I)ccc1O	790091474	RYPZCWIIFCRRIN-CQSZACIVSA-N	440.193	1.598	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)N[C@@H]1CCN(Cc2ccc(C)cc2)C1=O	790698997	UXNDTXMQHOONAC-QGZVFWFLSA-N	426.473	1.514	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(Cc2nnc3n2CCC3)cc1	792264154	KDKPMIBWXSFAQI-UHFFFAOYSA-N	449.427	1.123	50	20	IDGD	
CC(C)c1ccccc1NC(=S)NNC(=O)CCN1CCN(C(=O)[C@@H]2CCCO2)CC1	792491023	PPUPZROZSACZNW-IBGZPJMESA-N	447.605	1.841	50	20	IDGD	
O=C(CN[C@@H](CO)c1ccc(Br)cc1)NNC(=O)c1cccc([N+](=O)[O-])c1	794817341	WRHJZUWIVKPSAL-HNNXBMFYSA-N	437.250	1.442	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNS(=O)(=O)CCc1cccc(Cl)c1	795282215	BWGMZCZETPISJW-UHFFFAOYSA-N	444.966	1.748	50	20	IDGD	
CCOC(=O)c1cc(S(=O)(=O)NNC(=O)c2cnn(C)c2)c(F)cc1Br	795329610	SUTRHESUFUAQGF-UHFFFAOYSA-N	449.258	1.122	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)cc1OC	797009724	BYBVFRLAYPBHSH-UHFFFAOYSA-N	433.442	1.066	50	20	IDGD	
COC(=O)CCSCc1cccc(NC(=O)C(=O)NNC(=O)c2cccc(C)n2)c1	797369898	PICTWIGOMBETKC-UHFFFAOYSA-N	430.486	1.586	50	20	IDGD	
CNC(=O)[C@@]1(C)CCN(C(=O)NNC(=O)[C@H](C)Oc2cccc(Br)c2)C1	797606927	TUCMAHMOYHZAKR-GTNSWQLSSA-N	427.299	1.415	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCc2ncnn2C(C)(C)C)cc1Br	799925608	AFWZEMBWGRGKIA-UHFFFAOYSA-N	425.287	1.948	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(CS(=O)(=O)NC(C)(C)C)c2)cc1	801106369	VLAXASLLALBCOQ-UHFFFAOYSA-N	446.529	1.613	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)c2ccc(F)c(S(=O)(=O)N(C)C)c2)nc1C	801182835	DMZDCKAUFQGKHN-UHFFFAOYSA-N	425.442	1.108	50	20	IDGD	
COCCN(CC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)C(=O)OC(C)(C)C	802068008	WDKCYJSFDBIPCB-UHFFFAOYSA-N	444.510	1.126	50	20	IDGD	
COC(=O)c1c(F)cc(NC(=O)C(=O)NNC(=O)COc2ccc(C)c(C)c2)cc1F	802566467	RAAJGUQYVQADKL-UHFFFAOYSA-N	435.383	1.533	50	20	IDGD	
Cc1cc([N+](=O)[O-])ccc1NNC(=O)Cn1cnc2c(c(Br)nn2C)c1=O	805373204	SWCCFUNFIHVZTA-UHFFFAOYSA-N	436.226	1.252	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)NCCCN2C(=O)c3ccccc3C2=O)cc1OC	805820650	SWYQFEHNAPMEGV-UHFFFAOYSA-N	440.456	1.724	50	20	IDGD	
Cc1ccc([C@H](CNC(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)N2CCOCC2)o1	807023250	GRWWNCCVUVSJSV-YJBOKZPZSA-N	434.468	1.898	50	20	IDGD	
CN1CCN(C(=O)NNC(=O)c2ccc(Br)c(OC(F)(F)F)c2)CC1	807383374	ALGDXNPWWVPJCU-UHFFFAOYSA-N	425.205	1.950	50	20	IDGD	
O=C(CNS(=O)(=O)c1cccc(F)c1)NNc1cc([N+](=O)[O-])ccc1Br	811496621	GMXMPZPMWKOINH-UHFFFAOYSA-N	447.242	1.918	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NN=C1CN(C(=O)OC(C)(C)C)CC[C@@H]1c1ccccc1	814835652	XMQMDWUADSYBJR-GOEBONIOSA-N	438.550	1.821	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2F)cc1)[C@@H]1C[C@@H]1C	815565177	FIXAAECYSDGNEI-SCLBCKFNSA-N	442.447	1.752	50	20	IDGD	
CC(C)(C)[C@@H]1CCC2=S=C(C(=O)NNC(=O)C(=O)Nc3ccc(C#N)cn3)C=C2C1	815567375	WFABENDTSDGOJB-CQSZACIVSA-N	425.514	1.903	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)CCOc2ccccc2)nnn1Cc1ccccc1F	815568529	LIKNIZVYVMXAJQ-UHFFFAOYSA-N	440.435	1.329	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)[C@](C)(O)Cn2ccc(C)cc2=O)c1	818767885	UXRBICVIXOLULO-GOSISDBHSA-N	438.278	1.600	50	20	IDGD	
CC[C@@H](C)NS(=O)(=O)c1ccc(C(=O)NNC(=O)CNc2cccc(OC)c2)cc1	825805711	NPQCGMRFRWLIDC-CQSZACIVSA-N	434.518	1.645	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)CNS(=O)(=O)c1ccc2ccccc2c1	912861136	YMWZWHTWHGNOHW-CQSZACIVSA-N	445.472	1.872	50	20	IDGD	
NS(=O)(=O)N1CCC(C(=O)NNC(=O)c2cc(-c3ccco3)nc3ccccc23)CC1	915188536	VSFCEUPXOQKRHZ-UHFFFAOYSA-N	443.485	1.171	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)NCC(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)cc1	915788120	UUQCQVSKMQZNLN-INIZCTEOSA-N	447.513	1.399	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)CCNS(=O)(=O)/C=C\c1ccccc1	915789080	GLGKIUKPUCZCKR-ZSMUJPCHSA-N	435.477	1.721	50	20	IDGD	
O=C(NC[C@H]1CN(Cc2ccccc2)CCO1)NNC(=O)c1nnc(O)c2ccccc12	915895022	UFNHPGGNMKITBG-INIZCTEOSA-N	436.472	1.180	50	20	IDGD	
COc1ccccc1NCC(=O)NN=Cc1c(C)nn([C@H]2CCS(=O)(=O)C2)c1Cl	915920715	VRRCANHPVDTEOM-ZDUSSCGKSA-N	439.925	1.775	50	20	IDGD	
Cc1ccc([C@H](CN2CCOCC2)NC(=O)NNC(=O)COc2ccc(C#N)cc2)cc1	916215120	DCVZGZHAEYESDV-NRFANRHFSA-N	437.500	1.649	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NCC[C@](O)(c1nccn1C)C(F)(F)F	916378802	UHNNRVLXALWXLY-GTNSWQLSSA-N	447.389	1.497	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)NCc2ccc(CN3CCN(C)CC3)cc2)c1	916388075	SPQOTLGLXCTFLR-UHFFFAOYSA-N	425.533	1.652	50	20	IDGD	
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)NNC(=O)c1sc(N2CCOCC2)nc1C	917723193	APKALHYBDXCAMW-UHFFFAOYSA-N	441.491	1.128	50	20	IDGD	
CC(C)(C)N1CCC(NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)CC1	918094303	GIHXTTMZQIVISB-UHFFFAOYSA-N	430.597	1.792	50	20	IDGD	
C[C@@H](NC(=O)NN[C@]1(C)CCS(=O)(=O)C1)c1cc2c(cc1Br)OCCO2	918097491	QXIUXXVMQAFUDB-QLJPJBMISA-N	448.339	1.662	50	20	IDGD	
Cc1ccc(S(N)(=O)=O)cc1C(=O)NNC(=O)c1ccc(F)cc1Br	918341414	LMOPPBKHFLDWMX-UHFFFAOYSA-N	430.255	1.619	50	20	IDGD	
N#Cc1cnn(-c2ccc(C(=O)OCC(=O)NNC(=O)c3cccc(Cl)c3)cc2)c1N	919548568	FSTVACYLNADGNK-UHFFFAOYSA-N	438.831	1.598	50	20	IDGD	
C[C@H](Cc1cccc(O)c1)NC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	919784612	UMROIVJWROIAHX-GOSISDBHSA-N	425.533	1.866	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N(C)c2ccc(OCC(=O)NNC(=O)NC)cc2)cc1	919879763	FBWAZXTWSBQOHW-UHFFFAOYSA-N	436.490	1.249	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2F)c1C(F)(F)F)N[C@H]1CCS(=O)(=O)C1	919889594	PHDKMKVJKYXRJH-VIFPVBQESA-N	449.386	1.161	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)[C@H](CCSC)N1C(=O)[C@H]2CCCC[C@H]2C1=O	920006367	JCFOZIUWGLOEQL-BBWFWOEESA-N	447.557	1.682	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)[C@H]2CCCN2C(=O)/C=C\c2ccc(C(N)=O)cc2)c1	920019998	FSEQHZRXKIVAAG-KTZABMDBSA-N	449.511	1.317	50	20	IDGD	
Cc1cccc(N2N=C(C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)CCC2=O)c1	1116423065	SSYMVQTVZFESAI-UHFFFAOYSA-N	431.493	1.930	50	20	IDGD	
O=C(NNC(=O)c1csc(Cc2ccc(Cl)cc2)n1)N[C@H]1CCS(=O)(=O)C1	1318049941	XVBAKRUDYDFLPW-LBPRGKRZSA-N	428.923	1.518	50	20	IDGD	
COCCn1cc(NC(=O)NNC(=O)COc2cccc(C(F)(F)F)c2)ccc1=O	1321019826	GPRRDHHRCLYCOH-UHFFFAOYSA-N	428.367	1.745	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnn3ncccc23)C1	1777947403	CLCYNSSHNGWRHZ-WIYYLYMNSA-N	445.596	1.708	50	20	IDGD	
O=C1Cc2cc(C(=O)N3CC[C@@]4(C3)CN(C(=O)[C@@H](F)Br)CCO4)ccc2N1	1778392662	IKIJYWPMAWMGIJ-CRAIPNDOSA-N	440.269	1.315	50	20	IDGD	
O=C(c1n[nH]c2c(F)cccc12)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1778638211	FZQNXASDYSSHEZ-YOEHRIQHSA-N	443.248	1.836	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Cl)CCO2	1780097708	FSWZUOXWHMBSBI-CRAIPNDOSA-N	443.815	1.498	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2c[nH]c(=O)cn2)C1	1780125011	MKNZHTWNLSJUPQ-RVZJWNSFSA-N	441.326	1.071	50	20	IDGD	
Cc1c(Br)c(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](F)Cl)CCO3)nn1C	1780367411	WZBRHECQZKEDOI-WFASDCNBSA-N	437.697	1.469	50	20	IDGD	
Cn1cc2cc(C(=O)N3CCO[C@]4(CCN(C(=O)[C@@H](F)Br)C4)C3)ccc2n1	1781333225	MLWBSHIIILNOPQ-QAPCUYQASA-N	439.285	1.707	50	20	IDGD	
Cc1nc(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](C)Br)C2)no1	1781997068	BBNRWQZWUXVQIZ-CJBNDPTMSA-N	429.315	1.218	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCBr)C2	1782170290	HFGVSERBPDOWTK-XJKCOSOUSA-N	425.751	1.539	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H]3[C@@H](O)CCN3Cc3ccccc3)C2)C1	1782813033	WMQJMDJVZSLVEK-QTDGGUCWSA-N	449.979	1.469	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)Cc3ccccc3O)CCO2)C1	1783354829	GFBSQCPFTKCJPP-BEFAXECRSA-N	425.323	1.938	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)C3CCC4(CC3)OCCO4)CCO2)C1	1783881392	LCDJLMQSXBJBIA-LPHOPBHVSA-N	430.929	1.003	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccnc3ccccc13)CCO2	1783934410	FUKPKKASOBRUQL-HSZRJFAPSA-N	439.516	1.051	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCC(=O)N3CCCC3)[C@H]2C1	1784996191	SQNNBNXMLKCZDT-XSLAGTTESA-N	427.973	1.776	50	20	IDGD	
O=C(Cn1ccc2sccc2c1=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Cl)C[C@@H]21	1785256980	IQMYNNYOVAHEGR-PLNCSYRRSA-N	441.912	1.577	50	20	IDGD	
Cc1cc(C)n(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Br)C[C@@H]32)n1	1785340577	LWYXPFNKEHAPIF-YXWQFLTLSA-N	431.306	1.170	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC1(c2ccc(NC(=O)[C@@H]3CCC(=O)NC3)cc2)CCC1	1785902852	BSECJKZIJBIKIV-OAHLLOKOSA-N	429.521	1.020	50	20	IDGD	
O=C(NC1(c2ccc(NC(=O)c3cc(=O)cco3)cc2)CCC1)c1ccc(B(O)O)cc1	1787592329	JBSKWBZYAZAKHI-UHFFFAOYSA-N	432.241	1.381	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC1(c2ccc(NC(=O)c3csc(N)n3)cc2)CCC1	1788078712	QTEFFHSQGVDMIW-UHFFFAOYSA-N	430.534	1.846	50	20	IDGD	
O=C([C@H](F)Br)N1CC[C@H]2CO[C@@H](CNC(=O)C3(C(F)(F)F)CC3)[C@H]2C1	1788220132	AOYDDXPYBCWKDY-NAKRPEOUSA-N	431.224	1.999	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1ccc(C2(NC(=O)/C=C/c3cnc[nH]3)CCC2)cc1	1789523742	SSJVWTAQJSKKEQ-VOTSOKGWSA-N	445.483	1.869	50	20	IDGD	
O=C(/C=C/C1CCCCC1)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21	1789900555	GPGTXVJREFHSEZ-KDEIEAFCSA-N	440.349	1.096	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(OC)ccc3F)[C@H]2C1	1791949838	KZSHIZYFZBHSJI-RPZXMPESSA-N	428.888	1.681	50	20	IDGD	
C[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(C)(C)CCl)N1CSCSC1	1792783364	VCWXVPTVUFMYRY-XQLPTFJDSA-N	436.043	1.884	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)CBr	1792866554	FZUMVQCFQDGZSR-OFTGVCEQSA-N	440.176	1.638	50	20	IDGD	
COCc1oncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)CBr	1792868389	XDROAQWVVUWMRW-MCYUEQNJSA-N	430.299	1.055	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1c(C)noc1C	1793886918	ICKKIFBSFJOICY-IARIHHJXSA-N	428.327	1.597	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](F)c1ccccc1	1793964099	RGPJFZFZNLOASY-RCJHGTSTSA-N	425.464	1.648	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cn1nccn1)C2	1794142104	BUQBLEXZVBESNQ-XGUBFFRZSA-N	440.932	1.048	50	20	IDGD	
COc1cnc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCBr)C3)c(F)c1	1794451636	QPKSEDWIJMDMQF-QHBPRCKVSA-N	430.274	1.218	50	20	IDGD	
C[C@H](CN)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](Br)Cc1ccccc1)C2	1795514554	DREJJLMTZCVQDL-FWEDZOCSSA-N	438.366	1.177	50	20	IDGD	
Cc1cc2[nH]c(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3ccc(B(O)O)cc3)cc2s1	1796189455	PBFJBIDNIIOAQK-BJWYYQGGSA-N	437.330	1.783	50	20	IDGD	
O=C(Cc1c(F)ccc(F)c1F)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1	1796189829	GBASPFKBOYVYJO-MUJYYYPQSA-N	446.234	1.278	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(F)s1)C2	1796439712	YBVGDMQPBLBUBK-CNKKGNCFSA-N	447.492	1.224	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1nnsc1C1CC1	1796645592	VSXMCSUNFSXLHD-WJZNIJOASA-N	433.303	1.309	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnc2ccccc2n1	1796779735	UQPLOHFUJVTODD-KOFHJDLBSA-N	433.306	1.616	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2	1796835715	WFDGJMCTHOWSFA-XOIINTDNSA-N	435.322	1.631	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc([N+](=O)[O-])[nH]1)C2	1796892646	BDDXKQJBTIVWHW-BQELMUNXSA-N	441.448	1.309	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1c[nH]c2cnccc12	1797565117	SSOMDCPEHJLMBI-DJZPMSPPSA-N	435.322	1.940	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)C1CCC2(CC1)OCCO2	1800382833	QYFDHJYSUXIIJK-LXTVHRRPSA-N	449.317	1.200	50	20	IDGD	
O=C(/C=C/c1ccc(O)cc1Cl)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2	1800900943	VFTLQCCJLKYAJH-PBWHVCGRSA-N	429.300	1.248	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN1CCc3sccc3C1)C2	1802333460	WXYQHKUCEPWCFN-BCDXTJNWSA-N	447.605	1.117	50	20	IDGD	
COc1cc(C)c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CCC(=O)NN(C)C)cc1OC	1802338872	YEYDYAAVIQEWBW-BJWYYQGGSA-N	446.548	1.637	50	20	IDGD	
COC[C@H](NC(C)=O)C(=O)N1CC[C@H](CNC(=O)C(C)(C)CCl)[C@H]1c1cccnc1	1802900941	IEGPZPQEXLTSJX-FGTMMUONSA-N	438.956	1.504	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cc(O)cc([N+](=O)[O-])c2)[C@H]1c1cccnc1)[C@H](O)CCl	1803141279	NWBNZZOKTOAQSC-VHSSKADRSA-N	448.863	1.615	50	20	IDGD	
COC(=O)CCCCCC(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1	1803145673	GPKRGWUVJPUDET-UWVAXJGDSA-N	439.940	1.811	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@@H](CNC(=O)c2ccc(O)nn2)[C@@H]1c1cccnc1	1805263879	ALWDTHPPCUCNBP-IFIJOSMWSA-N	448.321	1.928	50	20	IDGD	
Cc1nc[nH]c1CSCC(=O)N1CCC2(CCCN(C(=O)[C@H](O)CCl)C2)CC1	1805522593	JSQDUOUMGGEOBS-MRXNPFEDSA-N	428.986	1.782	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)C2=CCCC2)[C@H]1c1cccnc1	1806212082	BOZNIVCCCWJJIP-FXAWDEMLSA-N	434.500	1.510	50	20	IDGD	
Cc1onc(C(=O)N2CCCC3(CCN(C(=O)c4ccc(B(O)O)cc4)CC3)C2)c1C	1806347878	IEILRVMSEFBWSS-UHFFFAOYSA-N	425.294	1.130	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)c2cccc(F)c2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807362840	WTNRDCJQBQVNBM-DENIHFKCSA-N	447.275	1.534	50	20	IDGD	
O=C1NCCCn2nc(C(=O)N3CC[C@H](CNC(=O)[C@H](F)Cl)[C@@H]3c3cccnc3)cc21	1808314555	YPVNPPTWIDJICC-COXVUDFISA-N	448.886	1.266	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2nc3ncccn3n2)[C@H]1c1cccnc1	1809236471	JKKHAYWPCWGLCQ-HRCADAONSA-N	443.895	1.093	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1	1812362763	DXJZQBRNOYLGRC-OEAJRASXSA-N	427.885	1.249	50	20	IDGD	
O=C(COc1ccc(F)cc1)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)CCl)CC2	1813717716	ZLQCAAUYGMAKMI-RISCZKNCSA-N	427.885	1.873	50	20	IDGD	
O=C(Cn1nnc2ccccc21)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1	1815546825	WJNQNOOAWBMLQF-GOEBONIOSA-N	431.884	1.446	50	20	IDGD	
O=C1CC[C@H](C(=O)N2CCCC[C@H]2c2cc(NC(=O)CCBr)n[nH]2)CN1	1816779307	FXPODBIIEQYOGO-AAEUAGOBSA-N	426.315	1.713	50	20	IDGD	
O=C(CCBr)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)n2)[nH]n1	1816780636	BGNZOKUEUTZFJW-NSHDSACASA-N	439.270	1.702	50	20	IDGD	
O=C(CCBr)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(CO)on2)[nH]n1	1816782981	AMBUTUULVIUPNF-ZDUSSCGKSA-N	426.271	1.981	50	20	IDGD	
Cc1c(C(=O)N2CCCC[C@H]2c2cc(NC(=O)[C@H](F)Cl)n[nH]2)cn2[nH]cnc(=O)c12	1818041666	UFVGGZQVSQQFHP-WFASDCNBSA-N	435.847	1.894	50	20	IDGD	
C[Si](C)(C)OCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CSc1nc[nH]n1)CC2	1820169513	XCOFACVOLXFWLV-JTQLQIEISA-N	440.627	1.817	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ncc(Cl)cn2)[nH]n1	1822412653	BGODBWUJFWQEQK-AWEZNQCLSA-N	448.915	1.532	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](Cc2cnc[nH]2)NC(C)=O)n[nH]1	1822704523	ZGRGSIQRHVXXQK-UAGQMJEPSA-N	449.943	1.890	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1	1823003793	MEYUFSABDSGNLS-MATHAZKKSA-N	436.307	1.193	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCc1ccc(O)nn1)CC2	1826004852	SMNWQDYXESBWJL-NEPJUHHUSA-N	439.925	1.437	50	20	IDGD	
CNc1ccc(C(=O)N[C@@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)cc1	1826085480	WDIABJZRKBGSLH-OAHLLOKOSA-N	444.561	1.784	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4nncn4c3)C2)C1	1830362265	PHJAKNDUHJOBOB-FQEVSTJZSA-N	435.912	1.064	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4nccnc4c3)C2)C1	1830362527	YPUOIZVLUXFEBB-JOCHJYFZSA-N	446.935	1.965	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)/C=N/O[C@@H]3CCCCO3)C2)C1	1830365396	XFRHZFSNXVDICY-WRJCRLLZSA-N	445.944	1.237	50	20	IDGD	
O=C(CN1C(=O)C=CC1=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H](F)Br)CC1	1830381436	JSIWULLTGXOGNC-GUYCJALGSA-N	444.301	1.222	50	20	IDGD	
Cc1c(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)oc2ccccc12	1830728301	RKMIUYYZVFPXIP-KKSFZXQISA-N	436.892	1.411	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4cccnn4c3)C2)C1	1831654869	YOBDWENNHWCZAQ-GHTZIAJQSA-N	434.924	1.812	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)C2=NN(C)C(=O)CC2)CC1	1831828654	STIUTKAPRGUJDB-NVXWUHKLSA-N	426.945	1.468	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCc2cnc[nH]2)CC1	1831872019	ZBGBOBLRYCNKPN-LJQANCHMSA-N	432.569	1.335	50	20	IDGD	
COc1ccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)cc1C	1832090513	VVEDVIXJRPDIAK-ICSRJNTNSA-N	428.888	1.537	50	20	IDGD	
O=C(CCCc1ccncc1)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1833060047	QFUAVEVCSDUJAE-LJQANCHMSA-N	430.332	1.664	50	20	IDGD	
Cn1cc(C(=O)NC2CCN(C3CCN(C(=O)[C@H](F)Br)CC3)CC2)cn1	1834194471	DUJNQRSYXZVXMJ-HNNXBMFYSA-N	430.322	1.296	50	20	IDGD	
COC(=O)C1(C(=O)N2CCC(N3CCC(NC(=O)CCBr)CC3)CC2)CC1	1834424063	DORYUFAKCHTIGQ-UHFFFAOYSA-N	444.370	1.296	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)c3ccc(O)cc3F)C2)C1	1834823658	BCDAEIDMILRCIO-SFHVURJKSA-N	445.285	1.386	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)Cc1ccccc1F)CCO2	1835005282	VEKGJDKCRCOYOT-OAQYLSRUSA-N	438.572	1.676	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3nc[nH]c3[N+](=O)[O-])CC2)CC1	1835103028	BIFATFNBHBKMOL-AWEZNQCLSA-N	426.905	1.521	50	20	IDGD	
Cc1cccn2ncc(C(=O)N3CCC(OC4CCN(C(=O)[C@H](O)CCl)CC4)CC3)c12	1836719527	VTOFNIBAWQPMPT-LJQANCHMSA-N	448.951	1.855	50	20	IDGD	
O=C(c1n[nH]c2c(F)cccc12)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1837058074	XIMAOBBNVMBWLU-CRAIPNDOSA-N	428.823	1.306	50	20	IDGD	
Cn1cncc1C(=O)N1CCC(OC2CCN(C(=O)CCBr)CC2)CC1	1837511618	DWRAQTSFJZBJAW-UHFFFAOYSA-N	427.343	1.817	50	20	IDGD	
Cc1cc(/C=C/C(=O)N2CCO[C@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)no1	1837555318	LDFHJQHMFRLXMJ-RRFGBZISSA-N	437.569	1.304	50	20	IDGD	
O=C(CCBr)N1CCC(OC2CCN(C(=O)Cn3cccn3)CC2)CC1	1837653696	SPGCEIZBTKSACS-UHFFFAOYSA-N	427.343	1.667	50	20	IDGD	
COC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)[C@H](F)Br)CC2)CC1	1837662417	KAPCZWZDUXEMNB-INIZCTEOSA-N	437.306	1.629	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)ccn1	1837940476	CJTIBDOGFBHFFP-RBUKOAKNSA-N	430.332	1.696	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)c3ccc(F)cc3)CC2)CC1	1838593927	NCCQTIBUXJHUQY-UHFFFAOYSA-N	448.539	1.811	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](C)n3cnnn3)CC2)CC1	1838773351	BZERLZOHXLSHEV-QWHCGFSZSA-N	443.346	1.016	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(OC)c3)CCO2)C1	1838929574	VVHYLRSLFWREKJ-PXNSSMCTSA-N	426.897	1.019	50	20	IDGD	
C=C(CC(=O)OCC)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](Cl)CCC)C2)C1	1839173317	JWSKCVUIWSZJNF-UZLBHIALSA-N	430.929	1.360	50	20	IDGD	
N#Cc1cc(CC(=O)N2CCO[C@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)ccc1F	1839188192	PDNOUOUGVDBPFT-LJQANCHMSA-N	444.290	1.500	50	20	IDGD	
Cc1cccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)n1	1839197746	HLWZYNBKCYBQHM-WMLDXEAASA-N	430.274	1.151	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)cc1F	1839202223	XXAIKURJGGXPPV-MAUKXSAKSA-N	447.276	1.895	50	20	IDGD	
CCC[C@H]1CC[C@H](C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)CC1	1839970556	DWOUQYKYBQWKIB-NTLWEQJWSA-N	430.973	1.649	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(F)cn3C)C2)C1	1840033015	QPBJLEHHJBVSBH-PXAZEXFGSA-N	432.290	1.018	50	20	IDGD	
CC(C)=NO[C@H](C)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H](C)Br)CCO2)C1	1840034420	KVBNOWRXDXOUGX-CPUCHLNUSA-N	434.331	1.027	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)Br)CCO2	1840036418	JSGBXJPVJTYMLW-MJVIPROJSA-N	442.148	1.010	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3cnc(C)s3)CCO2)C1	1840398147	PSPZPVMEXNESGE-VQIMIIECSA-N	429.970	1.858	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)C(=O)OCC)CCO2	1840882483	ONWKGRNURZGHPV-FOIQADDNSA-N	432.945	1.440	50	20	IDGD	
COc1ccc(C(=O)N2CC3(CCCN3C(=O)[C@@H](O)CCl)C2)nc1Br	1841352158	YXMOUICNJWMIOF-NSHDSACASA-N	432.702	1.269	50	20	IDGD	
CC(=O)N(C)CCC(=O)N1CCCC12CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1841835746	HSEWXLVNCWHXGA-HNNXBMFYSA-N	444.960	1.190	50	20	IDGD	
O=C(c1ccc(-c2ccccc2)nc1)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843011695	HFRZPKWDTXXZSY-UHFFFAOYSA-N	441.296	1.559	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)[C@@H]2[C@H]3Sc4ccccc4[C@H]32)C1	1844275956	WHWUREVMCFFAPE-UFYCRDLUSA-N	428.558	1.451	50	20	IDGD	
Cc1ccc(=O)n(C(C)(C)C(=O)N2CC3(CCCN3C(=O)[C@@](C)(Cl)CCl)C2)n1	1845171192	MKJMWFSMOKGTQJ-SFHVURJKSA-N	429.348	1.727	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H]2C[C@]21C(=O)N1CCCC12CN(C(=O)[C@H](O)CCl)C2	1846187589	FZWUGINLYIGDSK-ARGWCVDVSA-N	427.929	1.189	50	20	IDGD	
COc1ccc([C@H]2C[C@H]2C(=O)N2CC3(CCCN3C(=O)CCC(=O)NN(C)C)C2)cc1	1846383872	DDHWCVNZWMXJAJ-RTBURBONSA-N	428.533	1.375	50	20	IDGD	
CC#C[C@@H](CC(=O)N1CCCC12CN(C(=O)c1ccc(B(O)O)cc1)C2)c1ccc(O)cc1	1846413649	AAESZXHZAWWQGF-FQEVSTJZSA-N	446.312	1.086	50	20	IDGD	
Cc1c(C(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)ccc(F)c1F	1846818484	GYTSNXFEZAYIFY-UHFFFAOYSA-N	429.427	1.403	50	20	IDGD	
Cc1onc(-c2ccccc2)c1C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	9457010	OMACHURKUIYNLF-QGZVFWFLSA-N	437.408	1.794	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C1CCN(c2ccccc2[N+](=O)[O-])CC1	15795161	YHUYOYFVUGONRJ-IBGZPJMESA-N	426.429	1.799	50	20	IDGD	
CCOc1ccccc1N1C[C@H](C(=O)NNC(=O)COc2ccccc2OC)CC1=O	15879302	QJHYTJDNULKBEV-OAHLLOKOSA-N	427.457	1.673	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=O)COc2ccc(C)c(C)c2)n(C)c1	16233097	RPFUCGSUBJINMQ-UHFFFAOYSA-N	436.534	1.512	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)SC1=NS(=O)(=O)CCN12)c1cccc([N+](=O)[O-])c1	17908982	SBEIVWIODPOUGQ-UHFFFAOYSA-N	447.454	1.281	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)[C@@H]1CCCN1S(=O)(=O)c1cccs1	109905540	OZHAEYWCLKGEFS-DOMZBBRYSA-N	441.506	1.655	50	20	IDGD	
CCOc1cc(CN(C)C(=O)NNC(=O)CNC(=O)c2ccco2)ccc1OC(F)F	725871824	HEJLGIXQJYNZMW-UHFFFAOYSA-N	440.403	1.882	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)N1CCC(C(=O)Nc2cccc(F)c2)CC1	725872752	GMXZEYWSLZHIMX-UHFFFAOYSA-N	447.492	1.709	50	20	IDGD	
NS(=O)(=O)c1ccc(Br)c(C(=O)NNC(=O)CCCc2ccccc2)c1	727741410	OWTQUUDYENDLHG-UHFFFAOYSA-N	440.319	1.880	50	20	IDGD	
NC(=O)c1cn(CC(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)c2ccccc12	728211254	OJVSTEAQVADWFM-UHFFFAOYSA-N	427.486	1.324	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3cc(-c4cccs4)[nH]n3)cc2)CC1	728216159	TTZBZEUVWAEFBT-UHFFFAOYSA-N	446.558	1.831	50	20	IDGD	
Cc1nc(-c2ccco2)ccc1C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	728341279	BVFREJMNEAEIGD-LJQANCHMSA-N	437.408	1.794	50	20	IDGD	
C#CCNC(=O)CN1CCN(C(=O)/C(C#N)=C/c2cc(C)n([C@H](C)COC)c2C)CC1	728533513	LUVIXAWMLKTGFY-KOMLCTQHSA-N	425.533	1.113	50	20	IDGD	
O=C(NNC(=O)[C@H]1CC(=O)N(c2ccc(F)cc2F)C1)C1CCN(c2ncccn2)CC1	728847389	CQXAVVPMYKSIJQ-AWEZNQCLSA-N	444.442	1.172	50	20	IDGD	
Cc1nc2c(c(O)nn2C)c(C)c1CC(=O)OCC(=O)NNC(=O)c1cccc(Cl)c1	729753448	ICSPWERTJSUGCT-UHFFFAOYSA-N	445.863	1.491	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])o2)cc1	731978370	QMKKXUAVIAXZGG-HNNXBMFYSA-N	430.417	1.581	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)NCCCCN1CCN(c2ncccn2)CC1)c1ccccc1	732245932	KGJNKPOITXDPTH-FQEVSTJZSA-N	439.564	1.903	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)N[C@H](CN1CCCCC1)c1ccccc1	734280563	MVFKWOUCGUSWJR-HXUWFJFHSA-N	434.504	1.834	50	20	IDGD	
CCc1cc(NNC(=O)CCNS(=O)(=O)c2ccccc2)nc(-c2ccccn2)n1	734357198	OFJNHAIVWJBDSO-UHFFFAOYSA-N	426.502	1.913	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=S)Nc2ccc3c(c2)OCO3)ccc1Cl	735234104	BZQFCEQAVNCPRE-UHFFFAOYSA-N	428.879	1.348	50	20	IDGD	
C[C@@H]1CN(S(=O)(=O)c2ccc(C(=O)NNc3ccnc(N(C)C)n3)cc2)C[C@@H](C)O1	740114215	RRBPHTMLHXVVNR-ZIAGYGMSSA-N	434.522	1.097	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCCCOCC1CCOCC1	740902427	CVRPUSGEACJMRS-UHFFFAOYSA-N	441.554	1.065	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(CC(=O)NNC(=O)c2c(Cl)cccc2Cl)C(=O)C1	741185606	YXZCGJQTFLPTAF-UHFFFAOYSA-N	445.303	1.834	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)c1C	741818575	IZXCTLLLBWZRCC-JAIQZWGSSA-N	449.467	1.534	50	20	IDGD	
O=C(Cc1cccc([N+](=O)[O-])c1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	741881220	ZSMPTRVZPJIYOW-UHFFFAOYSA-N	432.458	1.383	50	20	IDGD	
C[C@H](CC(=O)NN=c1sc2ccccc2n1C)/N=C1/NS(=O)(=O)c2ccccc21	742517046	XOQYCXVPGSPRKL-GFCCVEGCSA-N	429.527	1.689	50	20	IDGD	
COC(=O)c1ccc(S(=O)(=O)NNC(=O)c2cccc(C#N)c2)c(Br)c1	743257978	SPTNKJJYRMRZLV-UHFFFAOYSA-N	438.259	1.731	50	20	IDGD	
O=C(NNC(=O)[C@@H](Oc1ccc(Cl)cc1)c1ccccc1)N[C@H]1CCS(=O)(=O)C1	743885375	WBCDELREZCMIHC-RDJZCZTQSA-N	437.905	1.978	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)[C@@H]2CC(=O)N(c3ccc(F)cc3F)C2)c1	744708085	RWUDEFSTPSIPQZ-CQSZACIVSA-N	431.395	1.631	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)c2sccc2S(=O)(=O)C(F)F)c1	744985509	XOZOOUXUQXNDDB-UHFFFAOYSA-N	432.426	1.671	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NC[C@H](C)Oc2cccc(C)c2)cc1	745875571	HOCSJFCZQDOCNF-KRWDZBQOSA-N	448.545	1.722	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)N[C@@H]2C[C@@H](C)N(c3cnn(C)c3)C2=O)cc1	745919303	SCZYEQNEHCIQCN-HBUWYVDXSA-N	444.492	1.111	50	20	IDGD	
COc1cc(OC)cc(N2CC[C@@H](N(C)CC(=O)NNC(=O)c3ccc(C)cc3)C2=O)c1	747967251	QEDFZBIVIOFJCM-HXUWFJFHSA-N	440.500	1.511	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCC(=O)N(Cc2ccccc2)[C@H]1c1ccccc1)C(=O)N1CCCC1	748239986	OSCWIJHAEHVMTA-UNMCSNQZSA-N	448.523	1.936	50	20	IDGD	
O=C(CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@H]12)NNc1ccc(S(=O)(=O)C(F)F)cc1	748610043	IKFGQFSIJMIQKV-YDHLFZDLSA-N	448.517	1.852	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)N[C@H]2CCN(c3cc(OC)cc(OC)c3)C2)cc1	748662780	VVIYWWYJJVIRFF-HNNXBMFYSA-N	444.488	1.701	50	20	IDGD	
O=C(NNC(=O)c1cc(F)ccc1[N+](=O)[O-])c1cccc(S(=O)(=O)N2CCCC2)c1	751044413	XJABKMSWKZJUSO-UHFFFAOYSA-N	436.421	1.593	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C1(c2ccc3c(c2)OCCO3)CCCC1	751209083	KFNTVPWDHMUYNA-UHFFFAOYSA-N	429.498	1.909	50	20	IDGD	
CCOC(=O)[C@@H]1Cc2cc(S(=O)(=O)NNC(=O)c3ccc(Cl)cc3O)ccc2O1	751540952	OMCIUVPVQIRZQA-INIZCTEOSA-N	440.861	1.536	50	20	IDGD	
COc1cc(OC)cc(N2C[C@@H](C(=O)NNC(=O)[C@H](C)Oc3ccccc3F)CC2=O)c1	752270983	NFLYUAXWPIDADQ-KBPBESRZSA-N	445.447	1.811	50	20	IDGD	
COc1cc(OC)cc(N2C[C@H](C(=O)NNC(=O)COc3ccccc3OC)CC2=O)c1	752502891	JCIUYHPLSPEAGV-CQSZACIVSA-N	443.456	1.292	50	20	IDGD	
Cn1c(NNC(=O)[C@@H]2CC(=O)N(c3ccc4c(c3)OCCO4)C2)nc2ccccc2c1=O	752906426	IUDNLCZSVNAYNC-CYBMUJFWSA-N	435.440	1.201	50	20	IDGD	
O=C(NNC(=O)C(=O)Nc1ccccn1)N[C@@H]1CCC[C@@H]2CN(Cc3ccccc3)C[C@H]21	753314978	CUKAZVKKKTZVNX-GUDVDZBRSA-N	436.516	1.651	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2)c(C)c([N+](=O)[O-])c1	753839222	HRVVKHNGPSFNNS-UHFFFAOYSA-N	434.792	1.743	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CN2CCN([C@H](C(N)=O)c3ccc(Cl)cc3)CC2)c1	754235144	GHYAYCQGSXUFMI-FQEVSTJZSA-N	443.935	1.254	50	20	IDGD	
Cc1cc(O)cc(=O)n1CCC(=O)NNC(=O)[C@@H](C)Oc1cccc(Br)c1	754241407	OODWDBDQMPYPHC-GFCCVEGCSA-N	438.278	1.630	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)Nc2ccc(N3CCCS3(=O)=O)cc2)cc1	755591335	BIFDGXCJBNYQEQ-UHFFFAOYSA-N	429.458	1.330	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NC2CCN(S(=O)(=O)C(C)(C)C)CC2)cc1OC	755898243	HKQSSAVXYATRCV-UHFFFAOYSA-N	442.538	1.241	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)Nc2ccccc2S(=O)(=O)NC(C)(C)C)c1	756525915	QURVAMXIXKIOQX-UHFFFAOYSA-N	448.505	1.583	50	20	IDGD	
COc1ccnc(NNC(=O)NCc2ccccc2CS(=O)(=O)N2CCC(C)CC2)n1	756746514	WWUTXYFGCIPCJI-UHFFFAOYSA-N	448.549	1.873	50	20	IDGD	
CNC(=O)c1cc(Oc2cc(NC(=O)NNC(=O)[C@@H](C)OCCOC)ccc2C)ccn1	756860362	UUJSHCGBUFNFJB-CQSZACIVSA-N	445.476	1.746	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)Nc3ccon3)c2)cc1	757851645	OUQAWLBKGZAGGC-UHFFFAOYSA-N	431.430	1.951	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)N[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1C#N	758774000	SZXVBIJDEWKIPD-GJZGRUSLSA-N	447.492	1.554	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)NC[C@H]1CCN(C)[C@H]1c1ccc(Cl)c(F)c1	763090266	BDNMPOTUGUUDSQ-MRRJBJDNSA-N	430.908	1.854	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)Nc1nc(CN2CCOCC2)cs1	763482998	PRZUCBQJSGMLGS-UHFFFAOYSA-N	442.542	1.433	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2O)cc1I	763527726	KXBZYKBYUWOSRM-UHFFFAOYSA-N	439.209	1.705	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2c[nH]c3ccccc23)cc1N1CCOC1=O	763541208	PLZUTSZBWNHWIY-UHFFFAOYSA-N	437.412	1.533	50	20	IDGD	
COC(=O)c1cc(Cl)ccc1NC(=O)C(=O)NNC(=O)[C@@H]1COc2ccccc2O1	763572922	VVZTYDLBCYALCY-HNNXBMFYSA-N	433.804	1.053	50	20	IDGD	
CCN1CCN(c2ccc(NC(=O)C(=O)NNC(=O)c3cc(C)oc3C)c(C)c2)CC1	763576131	FZXDUUYECWOMHD-UHFFFAOYSA-N	427.505	1.746	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)Nc1ccc(Cl)c(OC(F)F)c1	763579569	YVLGKKSIVSHVAK-AWEZNQCLSA-N	441.774	1.867	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2nc(-c3ccccc3)cs2)cc1	763660882	HZSYMAQYTDHGJE-UHFFFAOYSA-N	426.454	1.984	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(C)c(N3CCOC3=O)c2)cc1C	763680055	OIEUGIPAAQGOOF-UHFFFAOYSA-N	440.456	1.733	50	20	IDGD	
CN1C(=O)COc2ccc(NC(=O)C(=O)NNC(=O)CSc3ccc(Cl)cc3)cc21	763734560	LOPJLCMVYNBWCR-UHFFFAOYSA-N	448.888	1.573	50	20	IDGD	
NC(=O)C1CCN(c2ccc(NC(=O)C(=O)NNC(=O)c3cccc(Cl)c3)cc2)CC1	763750293	MQQOEPDMFDHANM-UHFFFAOYSA-N	443.891	1.441	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)OCC(=O)N3)cc1	763766687	BXLGIPYIWADQJL-UHFFFAOYSA-N	440.456	1.842	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)C(=O)Nc2cc(C)nn2C)c2ccccc2c1=O	763821564	SYPYMHQRPCWBKO-UHFFFAOYSA-N	439.476	1.028	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccnn2-c2ccccc2)cc1	763877434	JJVRKWCIVYEUIZ-OAHLLOKOSA-N	435.440	1.628	50	20	IDGD	
CCCN(C(=O)c1ccccc1NC(=O)C(=O)NNC(=O)Cn1nc(C)cc1C)C(C)C	763881236	MJSHYHIPIXXSOF-UHFFFAOYSA-N	442.520	1.547	50	20	IDGD	
O=C(NNC(=O)c1cc2c(s1)CCCCCC2)C(=O)Nc1ccc(-n2cncn2)nc1	763910792	GDTXCXCQGDRBSQ-UHFFFAOYSA-N	439.501	1.783	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)on2)cc1S(C)(=O)=O	764016102	GJNOVANSKCYFNQ-UHFFFAOYSA-N	442.453	1.453	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cc(C)[nH]n2)n(-c2cccc(C(F)(F)F)c2)n1	764097405	DCTYYJWSYVEDRO-UHFFFAOYSA-N	435.366	1.631	50	20	IDGD	
CC(=O)Nc1cc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)c(F)cc1F	764117699	PIWDDEBACVMAIC-UHFFFAOYSA-N	426.763	1.682	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccc(CN(C(C)=O)C2CC2)cc1	764136383	PQZWFTAUJFYNBC-UHFFFAOYSA-N	438.484	1.535	50	20	IDGD	
Cc1cc(I)ccc1NC(=O)C(=O)NNC(=O)CCc1ccco1	764170929	CLPSVRNOTBJVEI-UHFFFAOYSA-N	441.225	1.911	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(C#N)c2)cc1I	764231909	JUWDWODNWGAVIL-UHFFFAOYSA-N	448.220	1.871	50	20	IDGD	
COc1ccc(CN(C)C)cc1NC(=O)C(=O)NNC(=O)c1cccc(OC(F)F)c1	764260366	WLKZFHWPLLPMMI-UHFFFAOYSA-N	436.415	1.758	50	20	IDGD	
O=C(CCCc1cccs1)NNC(=O)C(=O)Nc1cccc(CN2CCCC2=O)c1	764342541	ZSYOTTICSZMTIP-UHFFFAOYSA-N	428.514	1.979	50	20	IDGD	
CCOC(=O)/C=C\c1ccc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1	764345936	MRVQFJJPDMNUKZ-RAXLEYEMSA-N	447.451	1.848	50	20	IDGD	
CN(C(=O)c1ccc(NC(=O)C(=O)NNC(=O)Cc2ccncc2)cc1)C1CCCCC1	764352919	FCTKCKIGHQSWKB-UHFFFAOYSA-N	437.500	1.815	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cnn(C)c2)n(-c2cccc(C(F)(F)F)c2)n1	764358797	OBCSDJPWVZBUIX-UHFFFAOYSA-N	435.366	1.333	50	20	IDGD	
COc1cccc(Cn2nccc2NC(=O)C(=O)NNC(=O)c2ccc(C)o2)c1OC	764371734	KKHWSTXJJQCUMR-UHFFFAOYSA-N	427.417	1.250	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@](C)(O)[C@H](C)c3ccccc3)CC2)cc1	766644025	OCIDGJVNBISBIX-CJFMBICVSA-N	438.572	1.815	50	20	IDGD	
CC(C)(O)C(=O)NNC(=O)c1cccnc1N1CCN(Cc2cccc(Cl)c2)CC1	768261011	JWQPUGMGFWPVJA-UHFFFAOYSA-N	431.924	1.589	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CSc2nnc(-c3cc(-c4ccccc4)[nH]n3)n2N)cc1	768438133	SGPFYGTVNJZLIK-UHFFFAOYSA-N	448.512	1.911	50	20	IDGD	
COC(=O)c1cc(F)c(C)c(S(=O)(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)c1	769859068	LUXOQWBDKYAIBA-UHFFFAOYSA-N	437.449	1.486	50	20	IDGD	
CCN1CCN(Cc2ccccc2CNC(=O)NNc2nc(O)c3cnn(C)c3n2)CC1	770343038	WOZJMQQUJQNHIH-UHFFFAOYSA-N	439.524	1.033	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)N[C@H]3CCN(c4ccccc4OC(F)F)C3)nc21	770402514	XXPIQEPMRMWUCL-JTQLQIEISA-N	434.407	1.575	50	20	IDGD	
O=C(CCCNS(=O)(=O)c1ccc(F)cc1)NNC(=O)c1ccc2c(c1)OCCO2	770426901	KFZRGEVZZZZCJV-UHFFFAOYSA-N	437.449	1.117	50	20	IDGD	
C[C@@H]1CN(C(=O)NNC(=O)c2cccc(OC(F)F)c2)CCN1c1nccn2cnnc12	771214422	JMGUFGJOEKTQML-GFCCVEGCSA-N	446.418	1.291	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1ccc(C)c(S(=O)(=O)NC2CCCC2)c1	772181388	MCLIJNHZVDTMNQ-CYBMUJFWSA-N	425.507	1.319	50	20	IDGD	
O=C1CN(c2ccc(NC(=O)C(=O)NNc3cnc4ccccc4n3)cc2Cl)CCN1	773717646	DHRCFSNFAHPTAW-UHFFFAOYSA-N	439.863	1.301	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccc(S(C)(=O)=O)cc1	774008395	HNMBTXDLXJKYOI-LLVKDONJSA-N	439.877	1.297	50	20	IDGD	
O=C(NNC(=O)c1cccc(OC(F)F)c1)Nc1ccc(C[C@H]2NC(=O)NC2=O)cc1	775708611	PKYVRMSUAYZHOF-CQSZACIVSA-N	433.371	1.505	50	20	IDGD	
CN(NC(=O)C[C@H]1OC(=O)c2ccccc21)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776201289	IDDSMBGOLMUVCA-MRXNPFEDSA-N	432.477	1.924	50	20	IDGD	
CC(C)(C)OC(=O)NCC(F)(F)CNC(=O)NNC(=O)c1cc(Br)c[nH]1	777412456	VGLLUGBFBCCYJF-UHFFFAOYSA-N	440.245	1.881	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)c2cnc(C(F)(F)F)nc2)cc1	777762969	VGIXSPAJQJYPCK-UHFFFAOYSA-N	437.407	1.991	50	20	IDGD	
NS(=O)(=O)c1cc(F)cc(NC(=O)C(=O)NNc2ccccc2OC(F)(F)F)c1	778798204	BLZYCIFXTMQUOA-UHFFFAOYSA-N	436.343	1.454	50	20	IDGD	
C[C@@H]1CCCN(S(=O)(=O)c2ccc(CNS(=O)(=O)CBr)cc2)C1	782421608	SBUDKBMNDQWWGO-GFCCVEGCSA-N	425.370	1.879	50	20	IDGD	
Cc1cc(F)ccc1NNC(=O)C(=O)Nc1cccc(S(=O)(=O)N2CCN(C)CC2)c1	783444462	FRKXROZHHXRURD-UHFFFAOYSA-N	449.508	1.152	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1ccc(F)cc1OCC1CC1	784003282	CZVRSNSBAKSCDP-UHFFFAOYSA-N	434.449	1.192	50	20	IDGD	
CN(C)CCc1ccccc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	784212692	FHTMTROKFLQAPA-UHFFFAOYSA-N	445.545	1.313	50	20	IDGD	
COCCn1ccc(C(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)n1	784293901	HOHJGWRLPUXIPH-UHFFFAOYSA-N	446.467	1.363	50	20	IDGD	
Cn1cnn(-c2ccc(NC(=O)C(=O)NNc3ccc([N+](=O)[O-])cc3Cl)cc2)c1=O	784383956	OAZKXXLOJGPACL-UHFFFAOYSA-N	431.796	1.214	50	20	IDGD	
O=C(CN1CCOCC1)Nc1ccc(NC(=O)C(=O)NNc2ccc(Cl)nc2)cc1	784869857	PYMNAUMDLKHOBY-UHFFFAOYSA-N	432.868	1.088	50	20	IDGD	
CCNC(=O)N(C)NC(=O)C(=O)Nc1cccc(S(=O)(=O)N(C)c2ccccc2)c1	784917235	HSXXBBBRTUXSCX-UHFFFAOYSA-N	433.490	1.143	50	20	IDGD	
CC1CCN(Cc2ccc(NC(=O)C(=O)NNC(=O)Cc3cn4ccccc4n3)cc2)CC1	785060610	ISIAFTQKUQPHHL-UHFFFAOYSA-N	448.527	1.895	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1cn(-c2ccccc2)nc1C	785330523	JOXCZMCQPWHYDD-UHFFFAOYSA-N	443.485	1.675	50	20	IDGD	
O=C(NNc1ccc(-n2cccn2)nn1)N[C@H]1CCCN(Cc2ccc(F)cc2F)C1=O	786973197	OVOYAOLSXXMLTP-INIZCTEOSA-N	442.430	1.758	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)cc1N1CCNC1=O	787544752	XPHFTPGIKINWAM-ZDUSSCGKSA-N	443.435	1.217	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@H]2C[C@H]2c2cc(OC)ccc2OC)c2ccccc2c1=O	788084138	YTKHYYOTAZUABK-WMZOPIPTSA-N	436.468	1.998	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(C)c(C(=O)Nc2cccc(NC(=O)NN(C)C)c2)c1	788259771	ZAPDFNNNRGLCBY-UHFFFAOYSA-N	449.533	1.770	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(N3CCC3=O)c2)cc1OC	790951191	DTNVXIODLOZXPV-UHFFFAOYSA-N	440.456	1.620	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNc2ccc3c(=O)[nH]ccc3c2)c(OC)c(OC)c1	793071007	WHXWCFVVVYSPKC-UHFFFAOYSA-N	440.412	1.414	50	20	IDGD	
COCc1cc(C(=O)OC)cc(S(=O)(=O)NNC(=O)c2nnc(-c3ccccc3)o2)c1	793379411	AZHVQYXKDYQRLT-UHFFFAOYSA-N	446.441	1.293	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNS(=O)(=O)c1cccc(OC(F)(F)F)c1F	793388742	PYDDENLSZGRIIV-UHFFFAOYSA-N	441.384	1.525	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)c2cc([N+](=O)[O-])ccc2SCCO)cc1	794722292	VENUKXRVQZNWRC-UHFFFAOYSA-N	440.503	1.686	50	20	IDGD	
COc1ccccc1-n1nccc1C=NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	797400834	QTVUTBHGLFYIKN-UHFFFAOYSA-N	433.877	1.946	50	20	IDGD	
COC(=O)c1cc(Cl)c(Cl)cc1NC(=O)C(=O)NNC(=O)c1ncccc1C	797535637	PFQBRJCBUOFDEQ-UHFFFAOYSA-N	425.228	1.883	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CCc2c(C)nc(-c3cccnc3)nc2O)cc1C	798310801	WEZTVJIUSFJMMC-UHFFFAOYSA-N	448.483	1.888	50	20	IDGD	
O=C(NCc1ccncc1OCC(F)(F)F)NNC(=O)c1ccc(-n2cnnn2)cc1	798509699	VYLRWKQBECUFRL-UHFFFAOYSA-N	436.354	1.143	50	20	IDGD	
CN(C)C(=O)c1ccc(S(=O)(=O)NNC(=O)c2cc(F)ccc2Br)cc1	799529367	HWCXWTNBDRFVKL-UHFFFAOYSA-N	444.282	1.913	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2ccc(C(F)(F)F)c(C#N)c2)c1	799915315	DNDMJDJPKSETJE-UHFFFAOYSA-N	447.416	1.604	50	20	IDGD	
CC(C)c1nc(C#N)c(NNC(=O)c2ccc(F)c(S(=O)(=O)N3CCOCC3)c2)o1	801143362	CFFLOXWQPLIPFU-UHFFFAOYSA-N	437.453	1.587	50	20	IDGD	
COC(=O)N(C)NC(=O)CS[C@H](C)C(=O)Nc1c(C)n(C)n(-c2ccccc2)c1=O	804124250	HTLGGDGAXJBDBL-CYBMUJFWSA-N	435.506	1.274	50	20	IDGD	
CSc1cccc(F)c1CNC(=O)NNC(=O)c1csc(N2CCOCC2)n1	804867653	HQLNIXLZPZFPQF-UHFFFAOYSA-N	425.511	1.985	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)N1CC[C@]2(CCN(Cc3ccccc3)C2)C1	805044161	IBSJFTWAOLWHIZ-QFIPXVFZSA-N	441.557	1.817	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N2C[C@@H](N3CCOCC3)C[C@@H]2C)cc1Br	805104229	NRULXXGMPIDTRX-JSGCOSHPSA-N	441.326	1.607	50	20	IDGD	
CCOC(=O)C(C)(C)CC(=O)NNC(=O)c1cccc(S(=O)(=O)N(CC)CC)c1	805154185	JNXCWWPHWRAQID-UHFFFAOYSA-N	427.523	1.458	50	20	IDGD	
CCOC(=O)C(C)(C)c1csc(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)n1	806977655	SXNQUCWGKGYFSX-ZDUSSCGKSA-N	446.485	1.073	50	20	IDGD	
O=C1COC[C@H](C[C@@H]2CN(C(=O)C(=O)NNc3cc(Cl)ccn3)c3ccccc32)N1	807013230	LPYXHYQAEQNHGF-OCCSQVGLSA-N	429.864	1.214	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@@H]2C[C@H](c3ccccc3)OC2=O)cc1	809557827	HOSQFLQECQJYOV-ZWKOTPCHSA-N	445.497	1.067	50	20	IDGD	
CC(C)Nc1ccc(S(=O)(=O)NCC(=O)NNC(=O)C2CCCC2)cc1[N+](=O)[O-]	810098631	WDMCLWSMMKCBKC-UHFFFAOYSA-N	427.483	1.031	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)Nc1ccc(C(N)=O)cc1OCC(F)F	810305872	WJLRBPKFMNTOPF-UHFFFAOYSA-N	432.387	1.852	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)c1ccc(N2CCNC2=O)cc1	812499031	CYCKDHKWERWKAU-UHFFFAOYSA-N	436.516	1.190	50	20	IDGD	
Cc1c([N+](=O)[O-])ccc(F)c1NC(=O)C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	813033493	WDPMQCHEVNCABO-UHFFFAOYSA-N	439.425	1.374	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2ccc3c(c2)CCCC3=O)cc1	814724027	OMLAWHRDUGJLKR-UHFFFAOYSA-N	429.498	1.596	50	20	IDGD	
O=C(Cc1ccccn1)NNC(=O)C(=O)Nc1ccn(-c2ccc(Br)cc2)n1	815569576	ZFNKBPCRJWXIAQ-UHFFFAOYSA-N	443.261	1.358	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1ccc(N2CCCC2)c(F)c1	815752445	SLAQHKSYIRPNTN-UHFFFAOYSA-N	449.508	1.758	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)[C@@H]1CCCN(C(=O)NC2CCCC2)C1	817052909	VVXGTUVRKUMXLW-OAHLLOKOSA-N	437.566	1.744	50	20	IDGD	
CCCCCn1nc(C(=O)NNS(=O)(=O)c2cnc(O)s2)c2ccccc2c1=O	821127694	LHQOKZJESYITNO-UHFFFAOYSA-N	437.503	1.372	50	20	IDGD	
CC(=O)c1cccc(S(=O)(=O)NCC(=O)NNC(=S)Nc2ccc(C)cc2C)c1	913428363	IDILFSHTKXBTNA-UHFFFAOYSA-N	434.543	1.802	50	20	IDGD	
COc1ccc(S(=O)(=O)N[C@H](C)C(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)cc1	913489405	NJHMHQGXKRSIPA-BUBBNXEVSA-N	435.546	1.726	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)[C@H]2CC[C@@H](C(F)(F)F)NC2=O)c2ccccc2c1=O	915190999	ZFNUKXDPDRZZBU-STQMWFEESA-N	439.394	1.025	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@@H]2CCCO2)c1	915879575	ZBQLPCYBTZCWFG-HNNXBMFYSA-N	448.501	1.619	50	20	IDGD	
COc1ccc([C@H](CNC(=O)NNC(=O)COc2ccc(F)cc2)N2CCOCC2)cc1	915896757	JUQMOEBYDWSYOI-FQEVSTJZSA-N	446.479	1.617	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)NC[C@@H](c1ccc(F)cc1)N1CCOCC1	915898023	OOGDEIBNSUOCET-IBGZPJMESA-N	434.443	1.748	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCCC(=O)N2CCOCC2)ccc1OCCC(C)C	916251353	HKYALDFSCDYCCA-UHFFFAOYSA-N	436.509	1.313	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCc2ccnc(N3CCCCC3)c2)nc1	916254262	AAYNRRHWZXSPMW-UHFFFAOYSA-N	447.565	1.980	50	20	IDGD	
CCc1ccccc1OCC(=O)NN=C(C)c1ccc(S(=O)(=O)NCCC(=O)O)cc1	916304133	ZPEJVYRNSHEMKL-UHFFFAOYSA-N	447.513	1.921	50	20	IDGD	
CN(C)CCOc1cccc(CNC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c1	916387389	NDXLUHFCIUOKFX-UHFFFAOYSA-N	434.518	1.175	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NCc2ccc(OCC(F)(F)F)nc2)cc1	916398028	JLIKFTQPMIQTAY-UHFFFAOYSA-N	428.367	1.941	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCc2cccc(C(=O)N(C)C)c2)nc1	916483619	JRZQDVLPGLYQMA-UHFFFAOYSA-N	448.549	1.640	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)CC1	916519901	NMZRIXCBRRDVKS-UHFFFAOYSA-N	430.469	1.006	50	20	IDGD	
COc1ccc(OC2CCN(CC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)CC2)cc1	917139310	SYUFVRMZXWUUFP-UHFFFAOYSA-N	428.445	1.908	50	20	IDGD	
O=C(COC(=O)[C@@H]1CCC[C@H](C(F)(F)F)C1)NNC(=O)[C@@H]1COc2ccccc2O1	917285860	OLZWWAZBIVIXBV-XUJVJEKNSA-N	430.379	1.886	50	20	IDGD	
CCC[C@@H](C)N1C[C@H](C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)CC1=O	917515358	COQUEUBWRFLDMT-HUUCEWRRSA-N	427.505	1.776	50	20	IDGD	
CC(=NNC(=O)Cc1csc(N2CCOCC2)n1)c1ccc(N2CCOCC2)cc1	917565309	ZISYVNQTXKSDPS-UHFFFAOYSA-N	429.546	1.899	50	20	IDGD	
CN(C)N(C(=O)C1CCN(C(=O)CCOc2ccccc2)CC1)[C@@H]1CCS(=O)(=O)C1	917621662	HNDPATJSQVZGMA-GOSISDBHSA-N	437.562	1.186	50	20	IDGD	
CN(C(=O)c1cccs1)c1ccccc1C(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1	919888931	IASJESBZPVISLD-LBPRGKRZSA-N	436.515	1.156	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@@H](C)NC(=O)OCc2ccccc2)cc(OC)c1OC	920213268	SDYPCJSVKVFSIJ-CYBMUJFWSA-N	431.445	1.788	50	20	IDGD	
C[C@H]1CN(Cc2cccc(CNC(=O)NNC(=O)COc3ccc(F)cc3)c2)CCO1	920238371	WERDJFISUNLVPR-INIZCTEOSA-N	430.480	1.956	50	20	IDGD	
CN(CCCOc1ccc(S(C)(=O)=O)cc1)CC(=O)NNC(=O)c1ccc(F)cc1	920835643	IUSVTYWYZXZRIA-UHFFFAOYSA-N	437.493	1.391	50	20	IDGD	
C=C(Br)CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	921125038	AMDGBDVOFXMWNS-UHFFFAOYSA-N	445.339	1.714	50	20	IDGD	
CN1CC(=O)N(CCCC(=O)NNC(=O)CCCOc2ccc(Cl)cc2Cl)C1=O	921233429	ZPYWKOKYDGDDJO-UHFFFAOYSA-N	445.303	1.974	50	20	IDGD	
Cc1nc(CSCC(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)cs1	1116166985	RQVZOYUFMNUVBP-UHFFFAOYSA-N	442.588	1.849	50	20	IDGD	
O=C(NCc1cccc(C(=O)N2CCOCC2)c1)NNC(=O)c1cncn1-c1ccccc1	1320317151	MFONGHAQXNQNLV-UHFFFAOYSA-N	448.483	1.489	50	20	IDGD	
O=C(Cn1cc(C(F)(F)F)ccc1=O)NNC(=O)c1cc(Br)ccc1O	1322155807	AYDYMAPMXVWPAJ-UHFFFAOYSA-N	434.168	1.796	50	20	IDGD	
NS(=O)(=O)c1ccc(CCNC(=O)NNC(=O)c2ccc(Br)cc2)cc1	1337447126	VDUFBLHJTNAIDW-UHFFFAOYSA-N	441.307	1.283	50	20	IDGD	
C[C@@H]1CCc2c(C(=O)N3CC[C@@]4(C3)CN(C(=O)[C@H](F)Br)CCO4)n[nH]c21	1777851826	BUKIOLRIAXGOQF-OVWKYPIYSA-N	429.290	1.593	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)N(C)C(C)=O)C1	1778104982	ORLFHFINRXDRKG-PSFFPDNBSA-N	446.386	1.541	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc4n(n3)CCCC4)C2)C1	1778564138	GQHQEIHKMNTXRI-UGSOOPFHSA-N	425.327	1.446	50	20	IDGD	
O=C1COc2ccc(C(=O)N3CC[C@]4(C3)CN(C(=O)C(Cl)Cl)CCO4)cc2N1	1778577264	ICSPGTLQNDTHNL-SFHVURJKSA-N	428.272	1.265	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@H]1C(=O)N1CCO[C@]2(CCN(C(=O)CO[Si](C)(C)C)C2)C1	1779301101	KNZASLCRFZBWRV-LZJOCLMNSA-N	438.597	1.423	50	20	IDGD	
O=C(c1cc(=O)nc2sccn12)N1CC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1779955714	HBQXDCVSBIWBJZ-MRXNPFEDSA-N	431.301	1.003	50	20	IDGD	
CC(=O)Nc1cc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)ccn1	1781229760	LODFRTGAEOLOLV-RBUKOAKNSA-N	443.331	1.720	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](O)CCNC(=O)OC(C)(C)C)C2)C1	1781340918	UBBUHRDPTLELDJ-AUSJPIAWSA-N	447.960	1.109	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccn(C(C)C)n1)C2	1782173850	SAZDGBONFCEXMW-WRWLIDTKSA-N	426.945	1.845	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccnc4c3OCO4)CCO2)C1	1783352811	SWTVTKBNCNJVTJ-SCLBCKFNSA-N	440.294	1.427	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3nsnc3NC)[C@H]2C1	1783527699	YFCLPPYTOMRYJK-YFKTTZPYSA-N	446.371	1.347	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(OC)cc(OC)c3F)CCO2)C1	1783881028	INKNBAGVFHRDAD-QRWLVFNGSA-N	444.887	1.540	50	20	IDGD	
O=C(C[C@@H]1CNc2ccccc2O1)N1CCO[C@@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783946178	JIUIEDUJCIMCFH-YJYMSZOUSA-N	428.316	1.883	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc([N+](=O)[O-])[nH]3)C[C@@H]21	1783970740	ZTUAABMRIHYJKA-MNXVOIDGSA-N	443.298	1.547	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nc(O)n4c3CCCC4)C[C@@H]21	1784617330	FHWCFCBYLBJILV-MPTYRVRUSA-N	438.956	1.926	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)c3ccccc3C3CC3)C2)C1	1784951536	FZSYAOZXHPEPCX-HSZRJFAPSA-N	428.533	1.381	50	20	IDGD	
Cc1nnc(CCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)Br)C[C@@H]32)s1	1785326746	LFNAIQKKOLYAJI-SAXRGWBVSA-N	445.383	1.542	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(-n4cnnc4)cc3)[C@H]2C1	1786769737	RPKVANMVNHRNST-KANFNMMFSA-N	447.923	1.114	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc4[nH]ncc4c3)[C@H]2C1	1788274651	ZTHUUSXZOFZZLL-MBIOBJJBSA-N	440.331	1.788	50	20	IDGD	
CCCC(=O)N[C@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](Br)CC)C[C@@H]21	1788743991	OSXRRXQOWVBWNB-CWVYHPPDSA-N	446.386	1.444	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)c1ccccc1C(F)(F)F	1789490852	WCDZCHVLCCUVDQ-MZGVZZPPSA-N	434.842	1.898	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/C(=O)NCc3ccco3)C[C@@H]21	1789863412	RGDOORYDQIXEQC-VWCDTKFZSA-N	437.924	1.449	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CCc4nc[nH]c4C3)C[C@@H]21	1789872963	MKAJSJWXDWTOFL-WNFKFRIASA-N	443.375	1.731	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3Cc4ccccc4O3)C[C@@H]21)[C@H](F)Br	1789925680	HHFLZHXTOFLYLU-PTTAZLHSSA-N	441.297	1.660	50	20	IDGD	
CSCC[C@H](O)C(=O)Nc1ccc(C2(NC(=O)CCC(=O)NN(C)C)CCC2)cc1	1791618603	UVLUIRHDADCWRW-KRWDZBQOSA-N	436.578	1.608	50	20	IDGD	
CC(C)(C)OC(=O)NCC1(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Cl)C3)CC1	1792546924	ITYRREQVUNNBQB-CRWXNKLISA-N	433.908	1.415	50	20	IDGD	
COc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Br)C3)cc1F	1792678917	NKCUFUVYSMJJQJ-JLUCKKNBSA-N	433.249	1.728	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)COc1cccc(Cl)c1)c1ccc(B(O)O)cc1	1792832264	TZUKBNWSCJXXKU-REPLKXPHSA-N	442.708	1.351	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccn3ccnc3c1)C2	1792870862	LWNJTTNQEVRSNZ-JJAZEVLHSA-N	435.322	1.569	50	20	IDGD	
COc1cccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)CBr)c1	1792872592	QAUUAPPIGVYHSO-JJAZEVLHSA-N	425.323	1.929	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCl)[C@H](O)c1cccc(Br)c1	1793115799	ZGYGVRZUWLFHOO-YIDVYQOGSA-N	445.741	1.720	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](O)CCl)C1	1793118067	SQDDNEHLEIVLDL-FZKCQIBNSA-N	429.945	1.481	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(-n3cncn3)c1)C2	1793451969	PRGLNICSFXVVSL-UKBAYJJMSA-N	431.924	1.878	50	20	IDGD	
O=C(Cc1cccnc1Cl)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2	1793954393	NIXNDZKZDDVKHZ-XCCSTKFXSA-N	434.693	1.558	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cn[nH]c1)C2	1794142409	ZIXXBKVGZBXWAT-XGUBFFRZSA-N	425.917	1.794	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1n[nH]c(C2CC2)c1F	1794481918	WTNYSNWUGFVVDK-VKZHRDFRSA-N	433.253	1.320	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C[C@H](N)c1cccnc1	1795677749	DLDVCZGKVRPIDA-BHOIQGAFSA-N	439.354	1.092	50	20	IDGD	
C[C@@H](Nc1nccs1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2	1796412148	HSWGLSSEKLCOKB-NRWUCQMLSA-N	431.356	1.318	50	20	IDGD	
Cn1c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)cc2ccccc21	1797274873	HFIXUZHIPMLFSF-ACDBMABISA-N	431.301	1.424	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)nc(Cl)c1)C2	1799276470	IXONAHVYTOVILD-UOHMRFDXSA-N	436.723	1.880	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)c1ccc(O)cc1	1799301641	VYVUOKSFJOYWQY-YTHJTJSOSA-N	425.323	1.869	50	20	IDGD	
Cc1c(Br)c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](O)CCl)C3)nn1C	1799442859	AXPWQOAJPFCHOX-WRWGMCAJSA-N	433.734	1.343	50	20	IDGD	
C[C@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@](C)(Cl)CCl)[C@H]1SC(=N)NC1=O	1800078718	JSZYYLZRPXROQY-IBDUMEDKSA-N	435.377	1.663	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2	1800642533	NMGFWLPPDZBZGN-QGKZMRNZSA-N	430.112	1.440	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(-c3ccco3)no1)C2	1800756063	FJDTWHQULJOKKR-LSSIXWDNSA-N	438.278	1.921	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](N)c1cccc(Cl)c1)C2	1800757069	UETQQYFAZIIMJH-GIRXQMHSSA-N	444.757	1.713	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2n(n1)CCCN(C)C2	1801186948	NERHVUNHBQLWMA-APIJFGDWSA-N	438.370	1.754	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cncc3cnccc23)[C@H]1c1cccnc1)[C@H](O)CCl	1803139999	AYTMBVAXKKFUTH-BEVDRBHNSA-N	439.903	1.944	50	20	IDGD	
C[C@H]1[C@@H](C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](O)CCl)C3)CCN1C(=O)OC(C)(C)C	1804632976	CJJBSWCOZHZTBA-WBAHDQRJSA-N	443.972	1.870	50	20	IDGD	
O=C(c1cc(O)cc([N+](=O)[O-])c1)N1CCC2(CCCN(C(=O)[C@H](O)CCl)C2)CC1	1805527211	VCDIOGYKTDHKOK-MRXNPFEDSA-N	425.869	1.745	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@@H](CNC(=O)C(=O)N(C)C)[C@@H]1c1cccnc1	1806936753	RBWFJCUHKYZGCS-SNPRPXQTSA-N	425.327	1.207	50	20	IDGD	
CC(C)C1(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)CCC1	1807364231	CXEBEELAXDULAN-UNMCSNQZSA-N	449.360	1.907	50	20	IDGD	
Cn1nc(C(=O)N2CC[C@H](CNC(=O)[C@@H](F)Br)[C@@H]2c2cccnc2)cc1O	1808651204	KHUDPXZYQOATQW-BYCMXARLSA-N	440.273	1.531	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)c3nccc4[nH]ccc34)CC2)C1	1809966538	APCOFDVNMHDOFH-UHFFFAOYSA-N	446.316	1.401	50	20	IDGD	
Cc1ccc(CCC(=O)N2CCC3(CCCN(C(=O)c4cccc(B(O)O)c4)C3)CC2)nc1	1809975269	YYTGUWGDJXXRLV-UHFFFAOYSA-N	449.360	1.547	50	20	IDGD	
Cc1nc(C(=O)N2CC[C@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)co1	1810298430	IMAUQPOHUPQFQQ-DNVCBOLYSA-N	449.471	1.010	50	20	IDGD	
CC(C)(F)C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1	1810302443	KFJWUXILOBCJOQ-RHSMWYFYSA-N	428.468	1.148	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)c1cccc2ccnn12	1812084453	DCYPITSGJKYIEW-ZYSHUDEJSA-N	427.892	1.649	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H](CNC(=O)CCNC(C)=O)[C@H]1c1cccnc1	1812662735	CHHLUCJPNBMNGW-SOLBZPMBSA-N	439.354	1.787	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)Cn2cc(Cl)cn2)[C@H]1c1cccnc1	1813030862	MXEFDHIWTQNSQO-ZVZYQTTQSA-N	440.331	1.891	50	20	IDGD	
CSCC[C@H](O)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)Br)[C@@H]1c1cccnc1	1813095718	OCIAUTQNNBKCBO-SYAUCNOPSA-N	444.395	1.985	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)CN2C(=O)C=CC2=O)[C@H]1c1cccnc1	1813175655	LTSGLAGVKVZVBD-TWOQFEAHSA-N	432.908	1.420	50	20	IDGD	
C[C@H](CBr)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](C)CC(N)=O)[nH]n1	1814779704	VJMCJPLIXPVBGO-LOWVWBTDSA-N	428.331	1.944	50	20	IDGD	
Cc1ccc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)nc1	1815339974	YOVIWNSAHAYUMJ-OAHLLOKOSA-N	436.302	1.066	50	20	IDGD	
N#Cc1ccc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)cc1	1815360354	GMDPERPQHRKNGQ-QGZVFWFLSA-N	446.297	1.234	50	20	IDGD	
O=C(CCN1C(=O)C=CC1=O)Nc1cc([C@H]2CCCCN2C(=O)C(Cl)Cl)[nH]n1	1815476338	KDDPQRJLAFKJKZ-LLVKDONJSA-N	428.276	1.521	50	20	IDGD	
Cc1cc(C(=O)NCC(=O)N[C@@H]2CCc3nc(NC(=O)[C@H](F)Cl)sc3C2)no1	1817125163	GKEVAGDWVAQZTM-OQPBUACISA-N	429.861	1.316	50	20	IDGD	
O=C(CCN1CCOCC1)Nc1cc([C@@H]2CCCCN2C(=O)CCBr)[nH]n1	1817178519	OSDBEUMVSTVLCS-HNNXBMFYSA-N	442.358	1.909	50	20	IDGD	
Cc1cc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)cn1C	1818302535	IBBQSNOLROPRHX-KRWDZBQOSA-N	429.525	1.736	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)/C=N/N2CCCCC2)n[nH]1	1819396433	SWXXJAPQYQQXEW-HRKXOBMBSA-N	446.556	1.247	50	20	IDGD	
Cc1cc(C(=O)NCC(=O)Nc2cc([C@H]3CCCCN3C(=O)[C@@H](F)Cl)[nH]n2)no1	1819466899	IAZSLTWSSSEVBR-IUODEOHRSA-N	426.836	1.663	50	20	IDGD	
CC(=O)N(C)[C@@H](C)C(=O)N[C@@H]1CCc2nc(NC(=O)CO[Si](C)(C)C)sc2C1	1820164727	GFURLKFEYHYXPV-WCQYABFASA-N	426.615	1.773	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@H]1CCc2nc(NC(=O)c3c[nH]c(=O)cn3)sc2C1	1821464132	XGZLZRXKSZUOQJ-BDAKNGLRSA-N	440.323	1.483	50	20	IDGD	
Cc1ccc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2ccc(B(O)O)cc2)CC3)cc1	1822265386	KCUDPJPTRRXHEA-QGZVFWFLSA-N	435.314	1.671	50	20	IDGD	
O=C(C(Cl)Cl)N1CCC([C@H]2CCCCN2C(=O)CCN2C(=O)C=CC2=O)CC1	1824774103	MVFCJKGEDSFNOR-CQSZACIVSA-N	430.332	1.725	50	20	IDGD	
CCc1cc(C(=O)N[C@@H]2CCc3nc(NC(=O)[C@@H](Cl)COC)sc3C2)n(C)n1	1826003933	VFIHYKUQGSYVRW-NEPJUHHUSA-N	425.942	1.919	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCCn1ccnc1)CC2	1826092167	OXJSMRZPFCFMKH-CQSZACIVSA-N	447.565	1.105	50	20	IDGD	
O=C1NCCn2nc(C(=O)N3CCCC[C@@H]3C3CCN(C(=O)[C@H](F)Cl)CC3)cc21	1826197050	IRTGFANCGRWXLG-ZBFHGGJFSA-N	425.892	1.394	50	20	IDGD	
O=C(CCn1cncn1)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](F)Br)CC2	1826608632	OVGQUPYVYBXUPR-QPUJVOFHSA-N	431.291	1.427	50	20	IDGD	
CC(=O)OC[C@H](OC(C)=O)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H](F)Cl)CC1	1828954399	XUAZLJZOAAFBBP-IXDOHACOSA-N	434.892	1.635	50	20	IDGD	
CC(=O)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Cl)CCN2C(=O)OCc1ccccc1	1829053035	WKCYJTOZEHBCRK-OXQOHEQNSA-N	439.871	1.562	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)cc1F	1830151302	ATGYLBZMHROVER-GOSISDBHSA-N	435.279	1.708	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3c(C)nc4ncccn34)C2)C1	1831647065	OUYMBASNCZJBNH-KKSFZXQISA-N	449.939	1.515	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(OC)n(C)n2)CC1	1831831651	GGSNLDCHHWRJBK-DOTOQJQBSA-N	426.945	1.916	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)C3CCN(C(C)C)CC3)CCO2)C1	1832415013	GUZKJFQTHIPRQK-RXVVDRJESA-N	429.989	1.581	50	20	IDGD	
Cc1nc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)cs1	1832972286	HYAVAHDRVBBQLG-PXAZEXFGSA-N	446.367	1.234	50	20	IDGD	
C[C@@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)c3cn[nH]c3)CC2)CC1	1833263121	BBJFBMKDONMNEC-ZDUSSCGKSA-N	426.359	1.626	50	20	IDGD	
Cc1ccc(CCC(=O)N2CCC(N3CCC(NC(=O)[C@@H](O)CCl)CC3)CC2)nc1	1833308209	LIWBOCWQEFNOPT-FQEVSTJZSA-N	436.984	1.494	50	20	IDGD	
C[C@H](Cc1ccco1)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)CCl)CC2)CC1	1833313148	XTSCALFSGZDTJI-BEFAXECRSA-N	425.957	1.630	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)[C@H](CC)NC(C)=O)CC2)CC1	1833529952	KGOFBSNPJKMPRP-OALUTQOASA-N	429.005	1.880	50	20	IDGD	
Cc1cc(CC(=O)NC2CCN(C3CCN(C(=O)CCBr)CC3)CC2)on1	1833731010	DQWOTVFJVLPGMJ-UHFFFAOYSA-N	441.370	1.882	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(Cl)s3)CCO2)C1	1834059311	UIHANLNILAKOMU-SJKOYZFVSA-N	437.345	1.725	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1)c1cccc(O)n1	1834200292	WFMGZUXATJXJBD-INIZCTEOSA-N	443.317	1.663	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)[C@@H]3CCCN(C)C3)CC2)CC1	1836352542	YUIJWACJFYEKFJ-HZPDHXFCSA-N	443.430	1.683	50	20	IDGD	
CN1CCCC[C@@H]1C(=O)N1CCC(N2CCC(NC(=O)[C@@H](F)Br)CC2)CC1	1836413585	KKRNEQMXXUXYPH-IAGOWNOFSA-N	447.393	1.733	50	20	IDGD	
C[C@@H](Oc1ccccn1)C(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836720368	RTBUBDWLDCEXCW-CRAIPNDOSA-N	439.940	1.447	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)CNC(=S)NCC)CC2)CC1	1836923086	WPOJZNHRFODRGV-QGZVFWFLSA-N	447.045	1.877	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)C[C@@H]3CCCCO3)C2)C1	1837709930	BBRSAMGPPIULQA-FXAWDEMLSA-N	428.602	1.254	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C#N)ccc3F)C2)C1	1837714377	AYXTZNXBXQDBSR-NRFANRHFSA-N	449.555	1.619	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc4nccn34)C2)C1	1837715634	BJQYEGZDDBBFPO-OAQYLSRUSA-N	446.580	1.256	50	20	IDGD	
CCCc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](Cl)COC)C3)C2)cc1	1839016771	ZHZFTQAKRPRFMF-SIKLNZKXSA-N	438.952	1.963	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(CO)c(F)c3)C2)C1	1839149681	OFUSCFMHLOOOHL-JXFKEZNVSA-N	428.888	1.405	50	20	IDGD	
Cc1ccc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)cn1	1839150324	JJKIHHKTTQPFRD-PMACEKPBSA-N	444.359	1.625	50	20	IDGD	
Cc1ncc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)cn1	1839151367	PDMIHQOMVGGIAM-ZWKOTPCHSA-N	431.320	1.091	50	20	IDGD	
COc1ccc(/C=C/C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)c(F)c1	1840074898	CSBQKORTYIESQV-GFLQFSHBSA-N	444.862	1.838	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3Cl)C2)C1	1840153583	UPMPTOYQOPKCNL-QAPCUYQASA-N	432.304	1.059	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(OC)ccc3C)C2)C1	1840154817	HJONSBULBYHCBI-RXVVDRJESA-N	440.924	1.327	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3cc(C)on3)CCO2)C1	1840369668	KJTDBOHQUZZERJ-CRAIPNDOSA-N	444.326	1.155	50	20	IDGD	
COc1ccc(Cl)c(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)c1	1840653076	NRDOBQWTNRASRN-QFBILLFUSA-N	447.315	1.018	50	20	IDGD	
O=C(c1csc(-n2ncc3ccccc32)n1)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1	1841349589	BUYYZWVCXMVHFG-INIZCTEOSA-N	445.932	1.899	50	20	IDGD	
C#CCO[C@H](C)C(=O)N1CCCC12CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2	1841601107	FTIXDXVEMZNKLC-CQSZACIVSA-N	429.429	1.375	50	20	IDGD	
CO[C@@H](C(=O)N1CCCC12CN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2)c1ccccc1	1842669373	UIQVDNQXPNIGAK-DUYBAWCLSA-N	437.500	1.712	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1nc(Cl)ccc1F)C2	1843415459	JMTFFWMRXQMMJC-BRJLIKDPSA-N	446.870	1.825	50	20	IDGD	
Cc1ccc2nc(C(=O)N3CCCC34CN(C(=O)c3ccc(B(O)O)cc3)C4)ccc2c1	1843663412	KYDUHOWNOAYYPK-UHFFFAOYSA-N	429.285	1.354	50	20	IDGD	
O=C1CCCc2cc(C(=O)N3CCCC34CN(C(=O)c3cccc(B(O)O)c3)C4)ccc21	1843759460	WLFNHNMXNFDXOK-UHFFFAOYSA-N	432.285	1.016	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2ccc3nccn3c2)C1	1843794277	YJSNJMCAISTRLG-MFKUBSTISA-N	433.472	1.285	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCCC12CN(C(=O)[C@@H]1[C@@H](O)CCN1Cc1ccccc1)C2	1844379239	HZMGRRSIGMUXCA-FPOVZHCZSA-N	445.636	1.677	50	20	IDGD	
C#CCCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)[C@@H](O)CCl)C2	1845130164	LPQKWBULIYGUBI-HOTGVXAUSA-N	441.956	1.486	50	20	IDGD	
Cn1c(=O)c(C(=O)N2CC3(CCCN3C(=O)[C@@H](F)Br)C2)nc2ccccc21	1845217648	NGIZZJNZJBPFBX-CQSZACIVSA-N	437.269	1.441	50	20	IDGD	
C[C@](O)(CC(=O)O)CC(=O)N1CC2(CCCN2C(=O)/C(C#N)=C/c2ccc(F)cc2F)C1	1845871905	COIXCKOBZCPILQ-JMDQKNPTSA-N	447.438	1.691	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)/C(C#N)=C/c2ccc(F)cc2F)C1	1845871931	FXYLIODGNVEYGZ-MHWRWJLKSA-N	445.470	1.448	50	20	IDGD	
Cc1ccn2c(=O)c(C(=O)N3CC4(CCCN4C(=O)[C@H](C)Br)C3)cnc2c1	1846176772	CGJWPIDUMCLDRW-ZDUSSCGKSA-N	433.306	1.603	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC2(CCCN2C(=O)[C@@H]2C[C@@]23C(=O)Nc2ccccc23)C1	1846182976	LXQQKEJNEROOJN-AOMKIAJQSA-N	427.577	1.951	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@H]2C[C@](C)(O)CN2C(=O)OC(C)(C)C)C1	1846231266	KCVXDMSFJLSJJC-SIFCLUCFSA-N	443.972	1.968	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)C1CCN(c3ccc(F)cn3)CC1)C2	1846364484	RJPSZDBJFNKIRG-QGZVFWFLSA-N	438.931	1.894	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)[C@@H]1[C@@H]3Sc4ccccc4[C@H]31)C2	1846385110	TWLFVLPNRWDVBM-SLFFLAALSA-N	428.558	1.451	50	20	IDGD	
O=C1NC[C@@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](Br)Cc2ccccc2)O1	1847852016	ZBKFMRHHENUJDU-UGUYLWEFSA-N	436.306	1.303	50	20	IDGD	
C=C1c2ccccc2C(=O)N1[C@@H](C)C(=O)NNC(=O)c1nn(CC)c(=O)c2ccccc12	14044380	QRDSSYONQOCBLU-AWEZNQCLSA-N	431.452	1.693	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(C)c(C(=O)NNC(=O)COc2ccccc2OC)c1	15879598	HMJAPJPXJSREJS-UHFFFAOYSA-N	449.529	1.874	50	20	IDGD	
O=C(CC[C@@H]1Cc2ccccc2NC1=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	23684121	LTNHHAGFKTWEIX-HXUWFJFHSA-N	449.555	1.937	50	20	IDGD	
CN(CC(=O)NNC(=O)c1cc2c(s1)CCCCC2)C1=NS(=O)(=O)c2ccccc21	23789015	OQWKSEOSEMJKEY-UHFFFAOYSA-N	446.554	1.859	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCCN(Cc3ccc(C#N)cc3)CC2)n1	28962106	ADQAXVGRIUADEG-UHFFFAOYSA-N	426.546	1.221	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN(Cc2ccccc2)C1)c1csc(N2CCOCC2)n1	108710211	BXKIQWBSCDRNCU-KRWDZBQOSA-N	429.546	1.653	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCc3sccc3C2)c1	116819430	JHMXIDXHMMDDQX-UHFFFAOYSA-N	444.538	1.908	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CC[C@@H](C(F)(F)F)NC1=O)c1ccc(F)cc1Br	195571185	ZZYOGDRJNYIGCI-SCZZXKLOSA-N	426.164	1.806	50	20	IDGD	
COC[C@H](C)n1c(SCC(=O)NNC(=O)C(=O)N2CCCC2)nnc1-c1ccccc1	725713737	UPCDISSXEDNFEK-AWEZNQCLSA-N	446.533	1.014	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=S)NCc3ccc(S(N)(=O)=O)cc3)cc2C1	726442348	ZLBHBCHRXVHPEK-LLVKDONJSA-N	438.600	1.829	50	20	IDGD	
Cc1oc(-c2ccsc2)nc1CC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	726929147	NTUWDZVOZJVWMA-UHFFFAOYSA-N	448.526	1.966	50	20	IDGD	
CC[C@H](C)N(C)CCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	727227504	AOHXEIRMSAQGMA-INIZCTEOSA-N	439.582	1.536	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)N2CCCN(S(=O)(=O)c3ccccc3)CC2)c1	728952875	GTBSIFCFHKTNKO-UHFFFAOYSA-N	427.486	1.309	50	20	IDGD	
CCOc1ccc(-c2nnc(S)n2CCC(=O)NNC(=O)Cc2cccnc2)cc1	728981563	AWAHPXKRZJPEQV-UHFFFAOYSA-N	426.502	1.808	50	20	IDGD	
O=C(CCNS(=O)(=O)c1cccc(Cl)c1)NNC(=O)Cn1ccc2ccccc21	729450152	NOHXWEAHOWOJFT-UHFFFAOYSA-N	434.905	1.811	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)N1CCC[C@@H](NS(=O)(=O)c2cccc(F)c2)C1	729494870	IFLCROKWJGQESI-MRXNPFEDSA-N	434.493	1.931	50	20	IDGD	
CC(=NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1ccc(S(=O)(=O)NCc2ccco2)cc1	730577413	SLIKRTJMQGLCFK-OAHLLOKOSA-N	439.515	1.033	50	20	IDGD	
Cc1cccc2nc(CNC(=O)NNC(=O)CCN3CCN(c4ccccc4)CC3)cn12	731761889	MCWOYKBTSPKDMK-UHFFFAOYSA-N	435.532	1.685	50	20	IDGD	
C[C@@H]1CN(Cc2ccccc2)CCN1C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	732246674	WXWVRDOBJBTHRD-GOSISDBHSA-N	437.548	1.640	50	20	IDGD	
O=C(CCN1CCN(C(c2ccccc2)c2ccccc2)CC1)NNC(=O)[C@@H]1CCC(=O)N1	732264563	FGUYLJVGIKTHJT-NRFANRHFSA-N	449.555	1.210	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)NNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1	732995004	HIYSECVYYZSCDS-UHFFFAOYSA-N	446.899	1.091	50	20	IDGD	
CC(C)OCCCn1c(NNC(=O)[C@]23CCC(=O)N2CCS3)nc2ccccc2c1=O	733265994	PDAHSKPWROHRES-OAQYLSRUSA-N	445.545	1.720	50	20	IDGD	
O=C(CCN/C(O)=C1\N=CC=CC1=O)NNC(=O)COc1ccccc1-c1ccccc1	733885273	WUXFEEUECNHHSJ-GHVJWSGMSA-N	434.452	1.796	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@@H]2CCCc3nc(C)ncc32)cc1	734953526	JNWDBUBSQSWCNH-GOSISDBHSA-N	446.533	1.122	50	20	IDGD	
COc1ccccc1-c1nn(C)cc1C(=O)NNC(=O)c1csc(N2CCOCC2)n1	740813760	UHIRBYBFNPJXRP-UHFFFAOYSA-N	442.501	1.464	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1cc(N2CCOC2=O)ccc1F	741558456	FYMFNZHPIUHEOE-UHFFFAOYSA-N	428.424	1.250	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)[C@@H](c1ccccc1F)N1CCOCC1	742223357	BSDVHRJOEATKTM-OAQYLSRUSA-N	431.464	1.824	50	20	IDGD	
CC(C)NC(=O)C(=O)NNC(=O)c1ccccc1SCC(=O)Nc1cccc(C#N)c1	744446608	FWABUXVTFDDBOF-UHFFFAOYSA-N	439.497	1.575	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)c2cccc(S(=O)(=O)N(C)C(C)C)c2)c1	744458559	GVEBQMQLNUKCIL-UHFFFAOYSA-N	447.513	1.642	50	20	IDGD	
COC(=O)c1cn(CC(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)c2ccccc12	744586777	FJJAGTWIOPQXCU-UHFFFAOYSA-N	434.408	1.304	50	20	IDGD	
Cc1c(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)nnn1-c1ccccc1	744619924	ABAZNXAJIHERKB-UHFFFAOYSA-N	442.501	1.354	50	20	IDGD	
CCN(CC)CCN1C(=O)C(=NNC(=O)c2ccc(-n3cnnn3)cc2)c2ccccc21	744756095	MVNXUCYKIMOOQT-UHFFFAOYSA-N	432.488	1.485	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)c2c[nH]cc2-c2ccc3c(c2)OCCO3)c1	745299518	JGPWVRZWBPKGHZ-UHFFFAOYSA-N	446.419	1.943	50	20	IDGD	
O=C(NCc1cccc(CN2CCOCC2)c1)NNC(=O)c1cc([N+](=O)[O-])ccc1O	745650421	QPNVEVNPOAGREN-UHFFFAOYSA-N	429.433	1.277	50	20	IDGD	
CN1CCN(C[C@@H](NC(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)c2ccccc2)CC1	745799248	PHCKLFLKTYKGKB-GOSISDBHSA-N	442.476	1.233	50	20	IDGD	
O=C(NCCc1ccc(S(=O)(=O)N2CCCCC2)s1)NNC(=O)c1ccc[nH]1	745890309	RMUPFRFHMUOYJY-UHFFFAOYSA-N	425.536	1.438	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1csc(N2CCOCC2)n1)c1cccc(-n2cccn2)c1	745933070	PZCICDBACNANLH-AWEZNQCLSA-N	441.517	1.871	50	20	IDGD	
CN(C)C(=O)NNC(=O)c1cccc(NC(=O)C[C@H]2SC(N3CCCCC3)=NC2=O)c1	746005974	GDHSSLVGLIQSCM-OAHLLOKOSA-N	446.533	1.415	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)c2c(C)cc(=O)n(CC(=O)NC(C)C)c2C)c1	746093658	UWFYKCLCJQGEIG-UHFFFAOYSA-N	442.516	1.447	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)Nc2nccs2)cc1)c1ccc(-n2ccnc2)nn1	747943669	LHOUHMWQAJZRQM-UHFFFAOYSA-N	442.486	1.677	50	20	IDGD	
COc1cc(C(=O)NNC(=O)COC2CN(C(=O)OC(C)(C)C)C2)cc(OC)c1OC	748014933	YNCYZGAEDPAWOD-UHFFFAOYSA-N	439.465	1.109	50	20	IDGD	
Cc1ccc(N2C(=O)C[C@H](C(=O)NNC(=O)C(=O)N3CCCC3)[C@H]2c2cccs2)cc1	748246589	CXQKLMVSNMDPPH-LPHOPBHVSA-N	440.525	1.921	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)N[C@H](C)c1cc(F)ccc1N1CCC(O)CC1	748634494	XJAGTDDGCLYXIK-ZIAGYGMSSA-N	426.489	1.230	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)CNC(=O)c1ccco1)Oc1ccccc1Br	748979457	WLCICBYAQCOXGG-NSHDSACASA-N	439.266	1.570	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NCC(=O)NNc2ccc(OC(F)F)cc2)c1	749280714	FCOPWBXYWQXPLN-UHFFFAOYSA-N	442.444	1.411	50	20	IDGD	
O=C(COC(=O)Cc1csc(N2CCCC2=O)n1)NNC(=O)c1cccc(Cl)c1	749980697	UYZPKDKYMJWYBF-UHFFFAOYSA-N	436.877	1.470	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2ccccc2OCC2CC2)cc1	750717081	XQGBTEKZCDBPBV-UHFFFAOYSA-N	431.514	1.866	50	20	IDGD	
CCOCCNC(=S)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	750989982	ISKVOVKNQIQGBP-UHFFFAOYSA-N	436.559	1.311	50	20	IDGD	
Cc1cccc(-n2ncc(C(=O)NNC(=O)CNC(=O)c3ccco3)c2C(F)(F)F)c1	751204382	HODRZLVWNLTSSV-UHFFFAOYSA-N	435.362	1.984	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)c2ccc(=O)n(CCOc3ccccc3Cl)c2)n1	751556058	VEBLUWHNIOHNQO-UHFFFAOYSA-N	443.891	1.855	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NC[C@H]2CCC[C@]23NC(=O)N(C)C3=O)ccc1OC(C)C	752023261	KIVCHLGIFPDWLG-SZNDQCEHSA-N	447.492	1.147	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3cccc4nc(O)oc34)cc2)CC1	752143661	IZVKCFOYHZILMJ-UHFFFAOYSA-N	431.474	1.226	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CNC(=O)c2ccccc2I)o1	752528535	XFRVTLHNTHZQOC-UHFFFAOYSA-N	427.198	1.384	50	20	IDGD	
O=C(COCCNC(=O)c1ccccc1)NNc1nc(-c2ccccn2)nc2c1CCC2	753422643	JJGUZYSAQLVERF-UHFFFAOYSA-N	432.484	1.917	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1)c1ccc([N+](=O)[O-])cc1F	754846796	ULQCHEZMYNTNJI-MRVPVSSYSA-N	444.828	1.599	50	20	IDGD	
CN(C)C(=O)CS(=O)(=O)c1ccc(C(=O)NNc2ccc(C(F)(F)F)nn2)cc1	755182470	JQTVRDZEPUEPNC-UHFFFAOYSA-N	431.396	1.114	50	20	IDGD	
C[C@H](CN1CCOCC1)C(=O)NN=Cc1cc(C(F)(F)F)ccc1N(C)CC(=O)O	755585965	XGXXIMCVSLJRTR-CYBMUJFWSA-N	430.427	1.645	50	20	IDGD	
O=C(NN=Cc1ccc(O)cn1)c1cc(S(=O)(=O)NCc2ccccc2)ccc1O	755607897	CLHVBJOCVXXGFL-UHFFFAOYSA-N	426.454	1.735	50	20	IDGD	
CC(C)n1ncc2cc(NC(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)cnc21	755847712	UXMFRENAVPZVSZ-UHFFFAOYSA-N	445.505	1.729	50	20	IDGD	
CS(=O)(=O)NCc1ccc(NC(=O)NNC(=O)COc2ccc(Cl)cc2)cc1	756629837	SGESRRFGTUENCS-UHFFFAOYSA-N	426.882	1.621	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)Nc1cccc(S(=O)(=O)NC(C)(C)C)c1C	756672452	OWYOZYJIMZEBBX-CYBMUJFWSA-N	430.527	1.276	50	20	IDGD	
Cc1cccc(-n2ncc(C(=O)NNC(=O)C(=O)Nc3ccccn3)c2C(F)(F)F)c1	758830590	BALRAUJUAICEHK-UHFFFAOYSA-N	432.362	1.994	50	20	IDGD	
C[C@H](CC(=O)c1cccc(Br)c1)C(=O)NNC(=O)C(=O)Nc1ccccn1	758832122	TUYNBJKTADWDNC-LLVKDONJSA-N	433.262	1.839	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)CN2CCO[C@@H](c3cccc(OC(F)F)c3)C2)cc1	759357438	AJDNEKOUYZXUGA-GOSISDBHSA-N	430.411	1.994	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)C2CCN(C3=NS(=O)(=O)c4ccccc43)CC2)nc1	759724689	CQGWHKULDRDVMZ-UHFFFAOYSA-N	443.485	1.172	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)N[C@@H]2CCOC[C@H]2OCC)c2ccccc2c1=O	760132129	OWNKPWHFFMZISQ-QZTJIDSGSA-N	445.520	1.725	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2ccnn2Cc2ccc(F)cc2)c1	760280669	WPQJHIKXNIPUNI-UHFFFAOYSA-N	439.447	1.852	50	20	IDGD	
CCCCS(=O)(=O)NCC(=O)NNC(=O)[C@@H](C)Oc1cccc(Br)c1	761121183	SMHFTQCULXBSJD-LLVKDONJSA-N	436.328	1.083	50	20	IDGD	
CC[C@@H](NC(=O)NNC(=O)C(=O)Nc1ccccn1)[C@H]1CN(Cc2ccccc2)CCO1	761789383	HKCJYQQBKQSCOZ-QZTJIDSGSA-N	440.504	1.030	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)[C@H](C)S(=O)(=O)c1ccc(F)cc1	762362137	URYCPBUXBXTVPQ-LBPRGKRZSA-N	426.491	1.936	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)CCn1nc(O)c2ccccc2c1=O	762408264	KDZORNZWSHJERV-UHFFFAOYSA-N	428.470	1.441	50	20	IDGD	
CCOC(=O)C(C)(C)C(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	762942879	JRVDNKLOWJFQDL-UHFFFAOYSA-N	436.472	1.739	50	20	IDGD	
O=C(CSc1nnnn1CC(F)(F)F)NNC(=O)c1cc(-c2cccs2)[nH]n1	763166850	LMXRLQAOGUMGMX-UHFFFAOYSA-N	432.413	1.240	50	20	IDGD	
O=C(NNC(=O)c1ccncc1)C(=O)Nc1cccc(COc2ccc3c(c2)OCO3)c1	763463805	JRLOWZQZNVXCJY-UHFFFAOYSA-N	434.408	1.789	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)N[C@@H]1CCN(c2ccc(Cl)c(F)c2)C1	763487203	ZOPNCUCYYRSDFG-LLVKDONJSA-N	439.900	1.880	50	20	IDGD	
O=C(NNC(=O)c1cc2ccccc2cc1O)C(=O)Nc1cccnc1OCC(F)F	763517122	FSLJRLMPQKAODZ-UHFFFAOYSA-N	430.367	1.984	50	20	IDGD	
NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc3ccccc3cc2O)cc1Cl	763527504	OOKALUJEIZXGNY-UHFFFAOYSA-N	426.816	1.697	50	20	IDGD	
Cc1cccc(NC(=O)C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c1F	763530879	KEMPFKHATJOMNZ-UHFFFAOYSA-N	427.480	1.432	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)NC(C)(C)C)cc2)cc1OC	763551251	USBVGWXYDJGFQI-UHFFFAOYSA-N	442.472	1.632	50	20	IDGD	
CC(C)(C)c1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(F)c(C(N)=O)c2)cc1	763594587	KHJBTTLATGVZGS-UHFFFAOYSA-N	430.436	1.387	50	20	IDGD	
CNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)COc2cc(C)ccc2C(C)C)c1C	763600761	IJJVOQRCVOSCDY-UHFFFAOYSA-N	440.500	1.951	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(C)c(C(=O)NC(C)C)c2)c1	763625415	QUUZZYZTSOWSNX-UHFFFAOYSA-N	426.473	1.607	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1ccc(F)cc1OCC(F)F	763627749	DILDGOHTLPFDJV-UHFFFAOYSA-N	435.362	1.825	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(C(=O)N(C)C)c(Cl)c2)cc1C	763680552	RAAAKXJPYKRTMT-UHFFFAOYSA-N	446.891	1.824	50	20	IDGD	
O=C(COc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1ccc(N2CCCC2=O)c(F)c1	763687117	ZQLQPKMHIKVWCW-UHFFFAOYSA-N	448.838	1.771	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(N2CCCC2)c(Cl)c1	763806337	BJLVKYUYJIEDLQ-UHFFFAOYSA-N	441.875	1.977	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccccc1C(=O)N1CCCCC1	763808360	MBJIGWFYSBDYBK-UHFFFAOYSA-N	449.467	1.349	50	20	IDGD	
Cc1ccc(O[C@H](C)C(=O)NNC(=O)CNC(=O)c2cccnc2)c(Br)c1	763818993	UHBJJXVHEGQBJI-GFCCVEGCSA-N	435.278	1.497	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)C(=O)Nc1ccnn1-c1ccncc1	763853569	MEARJLIHBVBDDO-HNNXBMFYSA-N	444.451	1.974	50	20	IDGD	
COC(=O)c1c(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)sc(C)c1C	763865001	NAAAJHIQIAHWNK-JTQLQIEISA-N	437.449	1.844	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)N(C)CCO3)cc1	763877234	ITLRZMVTEGAITK-CQSZACIVSA-N	440.456	1.271	50	20	IDGD	
COC(=O)c1sccc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccc(C(C)=O)cc1	763877464	KGNIOHDJRSFCEA-LLVKDONJSA-N	433.442	1.291	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(-c3nncn3C)c2)cc1OC	763902935	ZINZKNCRVXGUJS-UHFFFAOYSA-N	438.444	1.289	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)NC)cc2)cc1OC	763910921	HUSVPVKUANJMKZ-UHFFFAOYSA-N	428.445	1.243	50	20	IDGD	
CC(C)(C)OC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccc(F)cc2)cn1	763920451	KFIHFHKDBMWAJJ-UHFFFAOYSA-N	431.424	1.896	50	20	IDGD	
CNS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cccc3ccccc23)cc1	764051626	MVNZBPJJGBIBOC-UHFFFAOYSA-N	426.454	1.148	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccc3ccccc3c2)cc1S(C)(=O)=O	764085675	RVOHFCUOMPVRCT-UHFFFAOYSA-N	439.493	1.880	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2cccc(Cl)c2-n2cncn2)c1O	764130373	FWNWIWVMVRESLA-UHFFFAOYSA-N	430.808	1.035	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1cccc([C@H](C)N2CCOCC2)c1	764131072	DKEBUGCARHLVPN-INIZCTEOSA-N	440.500	1.417	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccoc2)nn1CCCOc1ccc(F)cc1	764159346	ARPPHUDPFJGZRM-UHFFFAOYSA-N	429.408	1.792	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)C(=O)Nc2cnc3c(c2)COCC3)c1	764233735	YCWXGZKXKWIFBV-UHFFFAOYSA-N	449.261	1.325	50	20	IDGD	
COCCOC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2cccc(C#N)c2)c1	764237555	IUNRAICBKDXSIM-UHFFFAOYSA-N	425.401	1.153	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(I)cc2C)o1	764366919	CFGSNXYDJRKDOS-UHFFFAOYSA-N	427.198	1.901	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)[C@H](C)S(=O)(=O)C1CCOCC1	764553094	QHHDRFYUHDRQSY-GJZGRUSLSA-N	434.514	1.737	50	20	IDGD	
CC(=NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1)c1ccc(C)cc1O	764820491	ZLHYGJTWKHWSJL-UHFFFAOYSA-N	444.557	1.856	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)[C@H](c1ccccc1)N1CCC(O)CC1	765417935	KKLJKXPWUTUOGY-IBGZPJMESA-N	434.537	1.637	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NN=Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-]	766024948	FGGMFKUZNIYYQY-UHFFFAOYSA-N	440.416	1.411	50	20	IDGD	
O=C(NN=Cc1cc(Cl)cc(F)c1O)c1cccc(S(=O)(=O)N2CCOCC2)c1	768357892	PSCJFDHTSXMNEA-UHFFFAOYSA-N	441.868	1.970	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)CN2C(=O)N[C@]3(CCCC(C)(C)C3)C2=O)c1	768566611	UKJOKYZTLLWDPX-NRFANRHFSA-N	432.477	1.356	50	20	IDGD	
CCNS(=O)(=O)c1ccc(F)c(C(=O)NNc2c(OC)cccc2S(C)(=O)=O)c1	768629838	NEGZRFCJYZIBBP-UHFFFAOYSA-N	445.494	1.293	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)C[C@H]3CCC[C@H]3C)CC2)cc1	769008975	XLOLZQYCNCOROB-QZTJIDSGSA-N	436.578	1.275	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ccc(Br)c(F)c2)cc1-n1cnnn1	770816030	QAIAKUISBFZKHW-UHFFFAOYSA-N	434.229	1.954	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNS(=O)(=O)c1ccc(C(=O)O)cc1Cl	771604385	JUTIQNNBUHKXMQ-UHFFFAOYSA-N	446.268	1.318	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O	771884055	WDXJBCBJJGFTIR-JTQLQIEISA-N	439.380	1.473	50	20	IDGD	
COC(=O)[C@H](NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)c1cccnc1	771897582	GPMFYRHFQCWCPD-GOSISDBHSA-N	432.502	1.405	50	20	IDGD	
Cc1ccc(S(=O)(=O)NC(C)(C)C)cc1C(=O)O[C@H](C)C(=O)NNC(=O)CC(C)C	771932899	CISGCFWFDBMFPB-CQSZACIVSA-N	441.550	1.811	50	20	IDGD	
CCOc1cccc2c1OCC(C(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1)=C2	772193275	STJPFIRWKRGLNE-UHFFFAOYSA-N	429.860	1.978	50	20	IDGD	
Cc1ccc(S(=O)(=O)C[C@H](C)NC(=O)NNC(=O)c2cc(Br)c[nH]2)cc1	773137031	XJBRAFSMOCGLOM-NSHDSACASA-N	443.323	1.892	50	20	IDGD	
CS[C@@H](C)CCC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	773208058	QDNRHVMHTVKLTQ-HNNXBMFYSA-N	443.591	1.319	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNc2cnc3ccccc3n2)cccc1S(=O)(=O)NC1CC1	773722816	KGVXGHQMUVPVAH-UHFFFAOYSA-N	440.485	1.461	50	20	IDGD	
O=C(NNc1ncccn1)C(=O)Nc1cccc(Oc2ncc(Br)cn2)c1	773724238	NAPQIJVBHVYGSI-UHFFFAOYSA-N	430.222	1.903	50	20	IDGD	
O=C(NNC(=O)[C@H]1COCCN1CC(F)(F)F)c1ccc(F)cc1Br	773840882	GRBRGJRYBNPGSK-LLVKDONJSA-N	428.180	1.612	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)Nc3ccc(F)c(Cl)c3)nc2)CC1	775373776	LMNXCTMGMHWLGS-UHFFFAOYSA-N	442.904	1.959	50	20	IDGD	
C#C[C@H](NC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1)[C@@H]1CCCO1	776228642	AWLPHMDKZPFDKH-HOCLYGCPSA-N	448.526	1.674	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)c1cccc([N+](=O)[O-])c1N1CCOCC1	776285281	KRLOJVQPBPSUDZ-KRWDZBQOSA-N	428.401	1.032	50	20	IDGD	
COc1ccc(C(=O)NNc2cccc(S(C)(=O)=O)c2)cc1S(=O)(=O)NC(C)C	776534671	OTGZZRMKNCVNNJ-UHFFFAOYSA-N	441.531	1.542	50	20	IDGD	
COc1cccc(NNC(=O)C2CCN(S(=O)(=O)c3ccc(C(C)=O)cc3)CC2)n1	780769069	AZFMIXBTHGGUGO-UHFFFAOYSA-N	432.502	1.837	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccc(OC3COC3)cc2)c1	782093055	LOGBMDCTCVCILZ-UHFFFAOYSA-N	434.474	1.181	50	20	IDGD	
C[C@H]1CN(C)C(=O)CN1C(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1	782564228	YEPBTAJKXFXOKO-LAUBAEHRSA-N	435.528	1.517	50	20	IDGD	
CCCN1Cc2cccc(NC(=O)C(=O)NNC(=O)Cc3nc4ccccc4n3C)c2C1	782888261	WANDWHPDALEJSJ-UHFFFAOYSA-N	434.500	1.628	50	20	IDGD	
COc1cc(NC(=O)C(=O)NN(C)c2ccccc2)ccc1S(=O)(=O)N1CCCC1	783431090	AXSHILDIGMEZNC-UHFFFAOYSA-N	432.502	1.586	50	20	IDGD	
O=C(NNc1nccnc1Cl)C(=O)Nc1ccc(CC(=O)N2CCSCC2)cc1	784780950	VFSYNHJCGQUGDX-UHFFFAOYSA-N	434.909	1.330	50	20	IDGD	
O=C(NNc1ccc(F)cc1)C(=O)Nc1ccc2c(ccn2CC(=O)N2CCOCC2)c1	784786148	GEILLPSFVLOODO-UHFFFAOYSA-N	439.447	1.721	50	20	IDGD	
CCNC(=O)N(C)NC(=O)C(=O)Nc1ccc(-c2csc(N3CCOCC3)n2)cc1	784915290	JZFQCLRDOJQWIE-UHFFFAOYSA-N	432.506	1.278	50	20	IDGD	
CN(C)c1nccc(NNC(=O)C(=O)Nc2ccc(Cc3nnc4n3CCCCC4)cc2)n1	784970431	HGIMQCOVLKTLPO-UHFFFAOYSA-N	449.519	1.533	50	20	IDGD	
Cc1cc(Br)ccc1NC(=O)C(=O)NNC(=O)c1cc([N+](=O)[O-])ccc1O	785024363	UKHJLVJINIHZLI-UHFFFAOYSA-N	437.206	1.771	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2ccc(C(C)(C)C(=O)OC)cc2)n1	785226823	VQEMBRFZTLWYEE-UHFFFAOYSA-N	428.493	1.855	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)CC(=O)N3C)ccc1OC(C)C	789741296	SDUYFBCTCBWWIA-UHFFFAOYSA-N	440.456	1.401	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cccc(N3CCC3=O)c2)ccc1OC(C)C	790951528	ICHLNHRIVTWSEI-UHFFFAOYSA-N	440.456	1.619	50	20	IDGD	
COc1ccc(OC)c(C2=NO[C@H](C(=O)NNC(=O)c3cnn(-c4ccccc4)c3)C2)c1	791589918	TZQLLVSIZMOPHR-FQEVSTJZSA-N	435.440	1.844	50	20	IDGD	
CCS(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)s1	792212466	QATLEWUVPXHFKE-UHFFFAOYSA-N	433.515	1.872	50	20	IDGD	
C[C@](O)(Cn1cc(C(F)(F)F)ccc1=O)C(=O)NNc1ccnc(Br)c1	792334906	FNPRRUZWEDNNLA-AWEZNQCLSA-N	435.200	1.919	50	20	IDGD	
NC(=O)CCSc1ccccc1NC(=O)C(=O)NNc1ccc2c(=O)[nH]ccc2c1	793066295	VBNHXBWWBZWJFG-UHFFFAOYSA-N	425.470	1.577	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCc2ccc(NC(=O)N(C)C)cc2)nc1	793497670	JLKMYJLFARWNPP-UHFFFAOYSA-N	449.537	1.688	50	20	IDGD	
Cc1cccc(C(=O)NNS(=O)(=O)c2c(C)cc(C)c(NS(C)(=O)=O)c2C)n1	794599477	FUVJCIDMCNMFCW-UHFFFAOYSA-N	426.520	1.310	50	20	IDGD	
N#Cc1ccc(N2CCC(C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)CC2)c(F)c1	794785384	USJSSZRZKAQUOS-UHFFFAOYSA-N	434.435	1.351	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)COc2ccccc2O)c(Br)c1	795098734	AEOJLVZMYOCXLB-UHFFFAOYSA-N	431.264	1.552	50	20	IDGD	
CNC(=O)c1cc(Cl)cc(S(=O)(=O)NNC(=O)c2ccccc2OC)c1OC	795318935	XFVMFHWKFQHBRD-UHFFFAOYSA-N	427.866	1.340	50	20	IDGD	
COc1ccc(Cn2nccc2NC(=O)C(=O)NNC(=O)c2cccc(C)n2)c(OC)c1	797370769	UKOZOKALSBXTAV-UHFFFAOYSA-N	438.444	1.052	50	20	IDGD	
C[C@@H]1CCC[C@@H](CNC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)[C@@H]1C	797541828	AGWFLYMALCMOQC-ZACQAIPSSA-N	438.598	1.716	50	20	IDGD	
Cc1ccccc1NC(=O)NNC(=O)C[C@@H](C)NS(=O)(=O)c1cccnc1Cl	798313818	VZTVNCJMFKQIQQ-GFCCVEGCSA-N	425.898	1.953	50	20	IDGD	
CSC[C@@H](C)C(=O)N1CCC(C(=O)NNC(=O)Cc2nc3ccccc3n2C)CC1	799407632	BMIWKDCFDYPOCR-CQSZACIVSA-N	431.562	1.501	50	20	IDGD	
CCS(=O)(=O)N1CCC[C@H](C(=O)NNc2cc([N+](=O)[O-])ccc2Br)C1	800620253	HYEKXFOELJDRFH-JTQLQIEISA-N	435.300	1.862	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)N[C@H](C)CCNS(=O)(=O)c2ccccc2)cc(C#N)n1C	802323696	LTTOBSTXPZVJDM-JQFNYASXSA-N	425.514	1.985	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)NC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1	802336132	WITHVKQXKHDDTN-QGZVFWFLSA-N	434.456	1.335	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N2CCn3nccc32)cc1	803660081	RPXZXOKJHIEMAA-FOWTUZBSSA-N	431.456	1.584	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cc3ccccc3c(=O)n2C)cc1OC	803870920	UMWPDFFZBHFOCV-UHFFFAOYSA-N	439.424	1.174	50	20	IDGD	
COc1ccc(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)c(C)c1OC	804469245	YKFJMCASXGJTEI-UHFFFAOYSA-N	448.545	1.705	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)c1ccc2ncn(-c3ccc(Cl)cc3)c2c1	806327005	YEEGKKNYVNMRNB-ZDUSSCGKSA-N	432.889	1.875	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(NC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)ccc1F	806543488	YCMYQSFLAJZMRL-HNNXBMFYSA-N	438.437	1.069	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1O)C(=O)Nc1ccc(F)c(N2CCCNC2=O)c1	806977634	RWIZHYWORKFNQR-UHFFFAOYSA-N	449.826	1.504	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)NCc1cnc2n1CCCC2	807264213	HLAXNJQYKMEYPF-UHFFFAOYSA-N	425.537	1.262	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNc2nccnc2C2CCC2)c(C)c([N+](=O)[O-])c1	807462414	ZLVZMPTZRLGCAD-UHFFFAOYSA-N	428.405	1.829	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccc(C(N)=O)cc1OCC(F)F	810389389	FCIQBMXVNQZEFO-UHFFFAOYSA-N	434.399	1.066	50	20	IDGD	
Cc1cc(C(F)(F)F)ncc1NC(=O)C(=O)NNC(=O)Cc1nc2ccccc2n1C	810391026	QZNBYNVOTCMOBL-UHFFFAOYSA-N	434.378	1.624	50	20	IDGD	
COCc1nc(CNC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cs1	812551788	MOWSVNXKYAMVOU-UHFFFAOYSA-N	432.550	1.332	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)C(=O)Nc1ncc(C(F)(F)F)s1	812979415	SEUCZYKHRPQWAN-UHFFFAOYSA-N	433.324	1.235	50	20	IDGD	
COC(=O)c1csc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)c1C	813033965	SZFKSMCUYRJJJQ-UHFFFAOYSA-N	440.503	1.175	50	20	IDGD	
Cn1cccc1C(=O)C(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	813367389	YRNFAXVAPBMQIJ-UHFFFAOYSA-N	429.436	1.427	50	20	IDGD	
CNS(=O)(=O)c1ccc(C)c(NC(=O)NNc2ccccc2S(=O)(=O)N(C)C)c1	814636773	JZGBFRBUQUKYLA-UHFFFAOYSA-N	441.535	1.302	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)nnn1Cc1ccccc1F	815564140	YTPXTGHYSZNIBG-UHFFFAOYSA-N	441.379	1.082	50	20	IDGD	
CO[C@@H]1CCOc2c(NC(=O)C(=O)NNc3ccccc3S(=O)(=O)N(C)C)cccc21	815751697	KNPRRFWQSSEAOF-MRXNPFEDSA-N	448.501	1.489	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NNC(=O)CNC(=O)c2ccc(F)c(F)c2)C1	816511020	MIOHGNJHDUTYCQ-CYBMUJFWSA-N	440.447	1.489	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCOCC2)cc1C(=O)NNc1nc2ccccc2n1C	816579400	OUVQYGPABINWQN-UHFFFAOYSA-N	445.501	1.360	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2cc(C(=O)NNC(=O)CC3CC3)ccc2Cl)C[C@@H](C)O1	819104986	VCQLXYJYBWBTMT-TXEJJXNPSA-N	429.926	1.699	50	20	IDGD	
O=C(CC1CC1)NNC(=O)c1ccc(NC(=O)C[C@@H]2SC(N3CCCC3)=NC2=O)cc1	819109946	QMXKPBRABUXMSB-INIZCTEOSA-N	443.529	1.670	50	20	IDGD	
C=CCn1c(S)nc2cc(C(=O)NNC(=O)CNc3ccc(OC)cc3)ccc2c1=O	825536013	KCHYQPHTAZQWKQ-UHFFFAOYSA-N	439.497	1.753	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)Cn2c3ccccc3c(=O)c3ccccc32)C[C@H](C)O1	844263646	BVZIFNRNYBZLEK-IRXDYDNUSA-N	436.512	1.801	50	20	IDGD	
CS(=O)(=O)CC[C@@H](NS(=O)(=O)c1ccccc1)C(=O)NNc1cccc(Cl)c1	849928976	LGJDCIHPXKKOBI-MRXNPFEDSA-N	445.950	1.565	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)CN2C(=O)[C@@H]3[C@@H](C2=O)[C@H]2C=C[C@H]3C2)c1	861638051	VJWHSZFDWMTLII-PBFVBANWSA-N	425.485	1.452	50	20	IDGD	
NS(=O)(=O)c1ccc(Br)c(C(=O)NNC(=O)c2ccc3ccccc3n2)c1	912766840	XECCIZMWJGLFHH-UHFFFAOYSA-N	449.286	1.720	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)CNS(=O)(=O)c2ccccc2F)cc1	912839910	OVQRYAJNNRIROP-ZDUSSCGKSA-N	439.465	1.118	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)c1ccc(CS(=O)(=O)c2ccccc2)o1	913471315	YUZOWFBFSJJAHB-UHFFFAOYSA-N	438.465	1.905	50	20	IDGD	
CCN(CC(=O)Nc1ccc(N2CCOCC2)cc1)C(=O)NNC(=O)c1ccccc1	913632584	FXAQLIOAAQOFBX-UHFFFAOYSA-N	425.489	1.838	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Cc2ccc(-n3cccn3)cc2)cc1	915616644	OKAXXMQRPGAFNW-UHFFFAOYSA-N	441.513	1.191	50	20	IDGD	
O=C(Cc1ccc2ccccc2c1)NNC(=O)NCCCN1C(=O)NC2(CCCC2)C1=O	915906015	CERSPOYKVFJPJI-UHFFFAOYSA-N	437.500	1.967	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NN=Cc2c[nH]nc2-c2ccc3c(c2)OCO3)ccc1Cl	917537380	JMNUWPWMIHJBSQ-UHFFFAOYSA-N	447.860	1.870	50	20	IDGD	
CN(C)N(C(=O)C1CCN(C(=O)CCOc2ccccc2)CC1)[C@H]1CCS(=O)(=O)C1	917621664	HNDPATJSQVZGMA-SFHVURJKSA-N	437.562	1.186	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNS(=O)(=O)c2ccc(C(=O)OC)s2)cc1	917723443	FIRVLSYIUORFBL-LLVKDONJSA-N	428.488	1.710	50	20	IDGD	
Cc1ccc(C(=O)NNS(=O)(=O)c2cc(Br)ccc2[N+](=O)[O-])c(O)c1	917753675	MBIZZARIWATABW-UHFFFAOYSA-N	430.236	1.995	50	20	IDGD	
O=C(CN1C(=O)N[C@@]2(CCc3ccccc32)C1=O)NNC(=O)c1ccc(Cl)cc1O	918357597	KGBNFAHQUZLKCW-HXUWFJFHSA-N	428.832	1.200	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@H](C)Cc2ccccc2F)cc1	919782565	ZBTSIWIZJSPXDJ-OAHLLOKOSA-N	436.509	1.716	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1	919810472	HLLXNAYVJPKIAL-HNNXBMFYSA-N	446.485	1.765	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)c1ccc(S(=O)(=O)NC[C@H]2CCCO2)cc1	919822705	BJCRUINAYPGREV-QGZVFWFLSA-N	447.513	1.156	50	20	IDGD	
CN1CCC(N2CCC(NC(=O)NNC(=O)c3ccc(Br)cc3)CC2)CC1	1318094993	LDNXCPJAZDOHIR-UHFFFAOYSA-N	438.370	1.952	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)c1ccc([S@](C)=O)cc1	1319501105	ISBKTXURARWGLA-WYIRRWHOSA-N	430.534	1.522	50	20	IDGD	
CCn1cc(-c2n[nH]cc2C(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)cn1	1321491264	ITHFQFJWGFQDKP-UHFFFAOYSA-N	431.497	1.701	50	20	IDGD	
Cc1cccc(-n2c(NNC(=O)[C@@H](C)N3C(=O)CCC3=O)nc3ccccc3c2=O)c1C	1322793396	BAVXARYCEFQPEO-OAHLLOKOSA-N	433.468	1.983	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2ncc(C(N)=O)cc2Cl)cc1Br	1322893579	IYQZIKUCWDMQRZ-UHFFFAOYSA-N	427.642	1.680	50	20	IDGD	
CSC1(CNC(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)CCOCC1	1323370767	VOTADDNBQZPGAJ-UHFFFAOYSA-N	430.571	1.876	50	20	IDGD	
COCc1nocc1C(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	1327650845	WHHPYGHFZVJYQN-UHFFFAOYSA-N	433.424	1.654	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(C(C)(C)C)n[nH]3)C2)C1	1779574447	FLTQTBYADXFTGU-KZULUSFZSA-N	427.343	1.934	50	20	IDGD	
Cc1ncncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCBr)C2	1779796828	OYSYQULBGGVLEI-CRAIPNDOSA-N	425.327	1.698	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccccc2F)C1	1780276608	ARWZBTWMJPVNRX-XMSQKQJNSA-N	434.512	1.326	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)Cc3ccc4ncnn4c3)C2)C1	1780951803	DMHZUAJWCUKMKM-RTBURBONSA-N	440.331	1.338	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](F)Br)C3)C2)n(C(F)F)n1	1781333132	DCSDLCCAATVXQU-NHYWBVRUSA-N	439.232	1.721	50	20	IDGD	
Cc1nn(C)c(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](C)Br)C2)c1F	1781996218	FBSZECJPOJYTNO-AEDCBLDQSA-N	445.333	1.779	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4ccnn4c3)C2)C1	1782404993	OVUMQLZBDKGWBV-LPHOPBHVSA-N	435.322	1.951	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cnccc3C(F)(F)F)CCO2)C1	1783877453	YTTVDJJSQJGOHD-RHSMWYFYSA-N	435.830	1.798	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(=O)cco3)C[C@@H]21	1783968551	WUGFHJRGEIJGQV-DUPGQFARSA-N	427.295	1.264	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(C(F)(F)F)n3)C[C@@H]21)[C@@H](O)CCl	1784091033	HHFRNUXYHBSMCQ-IMIFBBOLSA-N	435.830	1.293	50	20	IDGD	
COC(OC)C(=O)Nc1ccc(C2(NC(=O)c3cnccc3C(=O)NN)CCC2)cc1	1786251561	FJMHJCNEXVYDBD-UHFFFAOYSA-N	427.461	1.052	50	20	IDGD	
CC(C)N[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)C(C)C	1786959549	CLVOIVJIPUPHAT-OVWQWFNUSA-N	432.403	1.774	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnn4ncccc34)[C@H]2C1	1787378899	XEHJGVJPQCXXJP-HAHWVIBASA-N	440.331	1.559	50	20	IDGD	
CC(C)(C)OC(=O)NC(C)(C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]2C1	1787443599	NESBROJUROMJDG-XDQVBPFNSA-N	435.924	1.804	50	20	IDGD	
Cc1[nH]nc(C(=O)NC2(c3ccc(NC(=O)c4cccc(B(O)O)c4)cc3)CCC2)c1F	1788146059	XYEVWSMVHJACRE-UHFFFAOYSA-N	436.252	1.599	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCNC(=O)c3ccccc3)C[C@@H]21	1789863992	ALQJTPRHENEUHJ-VJANTYMQSA-N	435.952	1.804	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc[nH]c4nccc3-4)C[C@@H]21)[C@@H](F)Br	1789923224	YVOUVHGNMFHDEK-FBUXBERBSA-N	439.285	1.798	50	20	IDGD	
CC(C)n1cnc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](C)Br)[C@H]3C2)n1	1791058029	WHQWXHNYGQOXBJ-XUXIUFHCSA-N	428.331	1.236	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3CCc4ccccc4O3)[C@H]2C1	1791231225	ZOZWXAFDFMKNPT-TXTPUJOMSA-N	436.936	1.614	50	20	IDGD	
COC(=O)C1(C(=O)Nc2ccc(C3(NC(=O)c4ccc(B(O)O)cc4)CCC3)cc2)CC1	1791309493	DNYIRBHUSAZVOH-UHFFFAOYSA-N	436.273	1.067	50	20	IDGD	
COc1cccc(N2C[C@H](C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)[C@@H](O)CCl)C4)CC2=O)c1	1792483462	HJIBKVCCIIEZMD-IIZUFCTNSA-N	449.935	1.286	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=N/O[C@H]1CCCCO1)C2	1792870278	BECAOWXPMHYXPQ-PKFJTPLDSA-N	446.342	1.136	50	20	IDGD	
Cc1nc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](C)CBr)c(=O)[nH]c1C	1792988978	MWQCHWPUVUFBRS-WTDIUWLJSA-N	425.327	1.670	50	20	IDGD	
O=C(C(Cl)Cl)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1(C(=O)Nc2ccccc2)CC1	1793403856	CDBHXVWKCJVUPT-AGGWBTHJSA-N	440.327	1.799	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2	1793631649	HSGWVZHNJVHTCK-RNJOBUHISA-N	436.336	1.389	50	20	IDGD	
CCc1[nH]nc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)c1Cl	1796345115	DHVMIEGUXOBYRW-ZSBIGDGJSA-N	445.911	1.190	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@](C)(O)C[C@H]1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](F)Cl	1796810230	KHFFJSZLIJKPEU-RTDPWRILSA-N	447.935	1.919	50	20	IDGD	
COc1ccnc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@](C)(Cl)CCl)c1OC	1799277999	ZZWONBWUINSTHU-NMRSOGARSA-N	446.331	1.538	50	20	IDGD	
N#Cc1ccccc1OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Br	1799350593	ZCTBHTUCYDJTKC-RMHZUWNSSA-N	440.269	1.217	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(NC(C)=O)c(O)c1	1799846974	KSIFDANGGLZUIG-RCJHGTSTSA-N	437.924	1.961	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccn(C(F)F)c1=O)C2	1800759539	ULJIVZVWBMVIQX-HNCHTBHHSA-N	448.264	1.230	50	20	IDGD	
CN[C@@H](CC(=O)N1CCC2(CCCN(C(=O)[C@@H](C)CBr)C2)CC1)C(=O)O	1805384075	YOAIIGYQIKWOLE-KBPBESRZSA-N	432.359	1.311	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H](CNC(=O)[C@@H](C)NC=O)[C@H]1c1cccnc1	1808345703	NRMZYWKASKQUHI-RRCSTGOVSA-N	425.327	1.253	50	20	IDGD	
O=C(CSc1nc[nH]n1)N1CCC2(CCCN(C(=O)CCBr)C2)CC1	1809069704	GCUQRHYTJPUSQX-UHFFFAOYSA-N	430.372	1.913	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)c1ccn2nccc2c1	1810045604	TZJYZBCFGYDZNQ-UHOSZYNNSA-N	427.892	1.649	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)CCn2ccnn2)[C@@H]1c1cccnc1	1812867489	IYCSAWVDPUGRNT-JLJPHGGASA-N	435.326	1.553	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)c[nH]1	1813070868	NFLXACROGIOBFX-UWJYYQICSA-N	426.521	1.411	50	20	IDGD	
C[C@H](Oc1ccccn1)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1	1813407243	SUEWWNJLHCNOSS-PCODUJHASA-N	432.908	1.550	50	20	IDGD	
CC(C)[C@H](S)C(=O)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1	1815350255	MCOGZASEGOOKNJ-BBRMVZONSA-N	433.364	1.003	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1)c1cnc(OCF)cn1	1816181468	ALJRFJJDESCYBJ-STQMWFEESA-N	426.836	1.411	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](F)Cl)CC2)c1cc2n(n1)CCCNC2=O	1818913243	HFIXZYPMPYOAMH-ISVAXAHUSA-N	440.888	1.233	50	20	IDGD	
CC[S@](=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](F)Br)CC2	1819517783	XCUDULBLUPDUKT-VCYSJNDCSA-N	440.360	1.904	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2c[nH]c(=O)cn2)n[nH]1	1820248018	GKAWUWQVZBKNBV-GXFFZTMASA-N	437.298	1.972	50	20	IDGD	
C=C(CC(=O)OCC)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1	1820897076	CTKLEOYSJBGHTN-INIZCTEOSA-N	448.524	1.284	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2c[nH]c(=O)cn2)[nH]n1	1822089588	DLSDWYJHAFPMTN-GXFFZTMASA-N	437.298	1.972	50	20	IDGD	
C[C@H](Br)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CNC(=O)N(C)C)[nH]n1	1822185757	PTGOGCXHERDCMV-JQWIXIFHSA-N	429.319	1.456	50	20	IDGD	
Cc1nc(F)ccc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1	1822414391	DKZCGRKTUUUATE-MRXNPFEDSA-N	445.499	1.931	50	20	IDGD	
CC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(=O)nc3cccnn13)CC2	1822850135	PETRMNFXTFVAQK-GHMZBOCLSA-N	446.920	1.789	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CCN2C(=O)C=CC2=O)CC1	1824773533	GANOGPJTLBBIBJ-SJORKVTESA-N	439.940	1.175	50	20	IDGD	
Cc1nocc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1	1828925222	IJAZMFLZIABRNP-LJQANCHMSA-N	440.504	1.529	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)C(=O)Nc2cccnc2)CC1	1829045310	UOSVZXLETSXVNU-ROUUACIJSA-N	436.940	1.894	50	20	IDGD	
C[C@H](Nc1cccnc1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830359694	SWZNJSSFAVFYJK-HRAATJIYSA-N	438.956	1.603	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)cn1C	1830538268	AFJBBPKWPXNJJF-IFXJQAMLSA-N	442.354	1.435	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CCCN3C(C)C)C2)C1	1831659787	VQLTXZALKNKXEB-LVCYWYKZSA-N	429.989	1.723	50	20	IDGD	
O=C(Cc1ccc2ncccc2c1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1832031223	JVMTVAQZSXGSPG-PZJWPPBQSA-N	435.883	1.768	50	20	IDGD	
Cc1noc(C)c1CC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1	1832559237	KQOZDLREUIBZPY-MOPGFXCFSA-N	448.347	1.527	50	20	IDGD	
O=C(/C=C\c1c[nH]c2ccccc12)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1	1832732701	VTBLRBWIDCDDCG-LNGTVFGOSA-N	447.919	1.237	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3nsnc3NC)CC2)CC1	1833073430	RRGYBFRLJMJIOZ-CQSZACIVSA-N	428.990	1.782	50	20	IDGD	
O=C([C@H](O)CCl)N1CCC(N2CCC(NC(=O)C3(c4ccccc4)CC3)CC2)CC1	1833090518	KDTBLVBHUICKLH-HXUWFJFHSA-N	433.980	1.890	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3cccs3)CCO2)C1	1833160758	ZHDHHXBSRKMSST-KBXCAEBGSA-N	445.379	1.921	50	20	IDGD	
Cc1nc(F)ccc1C(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)CCl)CC2)CC1	1833312680	WVIVKLKVYHPHQG-KRWDZBQOSA-N	426.920	1.314	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)C[C@@H](NC)C(=O)O)CC2)CC1	1834740678	QFFANBLOXFZEHD-DLBZAZTESA-N	430.977	1.028	50	20	IDGD	
CN(C)c1ccc(C(=O)N2CCC(N3CCC(NC(=O)[C@@H](F)Cl)CC3)CC2)nc1	1835078846	YPYXFHIINBGUMW-GOSISDBHSA-N	425.936	1.867	50	20	IDGD	
N[C@@H](Cc1cccnc1)C(=O)N1CCC(N2CCC(NC(=O)[C@H](F)Cl)CC2)CC1	1835079519	CHMRSFGKQPPUOQ-ROUUACIJSA-N	425.936	1.057	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)NC2CCN(C3CCN(C(=O)[C@H](F)Cl)CC3)CC2)o1	1835735901	FIIYRCHFZANNKA-KRWDZBQOSA-N	428.892	1.958	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)Cc1ccsc1)CCO2	1836099613	JHQVKUINFJNIFV-IBGZPJMESA-N	426.611	1.599	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)c1cc(F)cc(F)c1	1836317235	VEMZRSSHKOGOIR-SFHVURJKSA-N	429.895	1.750	50	20	IDGD	
CC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)Cn3cc([N+](=O)[O-])cn3)CC2)CC1	1836394935	KCWNMDJRVKQZCZ-KRWDZBQOSA-N	440.932	1.380	50	20	IDGD	
Nc1ncc(C(=O)N2CCC(N3CCC(NC(=O)[C@H](F)Br)CC3)CC2)s1	1836412505	KDZXWWAXYKXVQD-ZDUSSCGKSA-N	448.362	1.601	50	20	IDGD	
O=C(COc1cccnc1)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836715717	XDKDESQBJWIESD-GOSISDBHSA-N	425.913	1.059	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)Cc3cnccn3)CC2)CC1	1836776073	YSRGYCXGNTYODV-AWEZNQCLSA-N	439.354	1.801	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccncc3O)CCO2)C1	1837820842	DHOLYJJTPCNYFW-KSSFIOAISA-N	442.310	1.031	50	20	IDGD	
C#CCCCC(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1	1838395330	DAJJPFBMFCYGFO-UHFFFAOYSA-N	441.532	1.101	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)CCC(N)=O)CC2)CC1	1838753532	FERVHLCNLYFSBO-HNNXBMFYSA-N	432.359	1.424	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)[C@]3(C)CC3(F)F)CC2)CC1	1838789414	OZNSWSWTWLVJFC-FQEVSTJZSA-N	444.523	1.403	50	20	IDGD	
O=C(/C=C/c1ccco1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839197662	DUEAVQCMPBMMPU-PIXXYMSQSA-N	431.258	1.440	50	20	IDGD	
COc1ccccc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839201952	OMXMHDFGXBAUPD-QAPCUYQASA-N	445.285	1.456	50	20	IDGD	
C[C@]1(C(=O)N2CCOC[C@]3(CN(C(=O)[C@@H](F)Br)CCO3)C2)CC=CCC1	1839203889	ZQLSHTUKWHVGGC-JLSDUUJJSA-N	433.318	1.880	50	20	IDGD	
CCOCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)CCO2	1839743188	ANGBUUJTPUJFKQ-CQTHNFAISA-N	449.454	1.365	50	20	IDGD	
C=CCC(F)(F)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCBr)C2)C1	1839887717	GRWQULXOMCXBCD-OAHLLOKOSA-N	425.270	1.439	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(F)(F)Cl)C2)C1	1839967143	CAVRQPOSKNIONF-MFKMUULPSA-N	433.677	1.448	50	20	IDGD	
CCC[C@H]1CC[C@H](C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)CC1	1839970557	DWOUQYKYBQWKIB-RYLXDESZSA-N	430.973	1.649	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CCC(F)(F)F)C2)C1	1840032330	VNCBPTQENYDKIM-FZMZJTMJSA-N	431.249	1.569	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cncc(O)c3)CCO2)C1	1840063119	QCMPWNPUDOXXSX-ZWKOTPCHSA-N	432.304	1.094	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(OC)cc3F)C2)C1	1840154680	CMWHRYCCQPNRAI-OXJNMPFZSA-N	444.887	1.158	50	20	IDGD	
Cc1cc(C)n(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)n1	1840345571	VHLKVUKBMVATLJ-NRFANRHFSA-N	440.972	1.611	50	20	IDGD	
COc1ccc(CC(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)cc1C	1841780476	AKGHFNYQKOSTBJ-UHFFFAOYSA-N	437.500	1.062	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC2(CCCN2C(=O)c2ccc(S(C)(=O)=O)cn2)C1	1842255821	HUHLBVRGSSASBC-LLVKDONJSA-N	430.324	1.086	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)Cc1ccc3c(c1)CCC3)C2	1844263449	GRUOOWDHJKJWBT-UHFFFAOYSA-N	433.512	1.234	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2n[nH]c3c(C)cccc23)C1	1845690539	AKZCRXPLMDTVCY-MFKUBSTISA-N	447.499	1.822	50	20	IDGD	
O=C(Cn1ccnn1)N1CC2(CCCN2C(=O)[C@@H](Br)Cc2ccccc2)C1	1845941314	SDPVQVWEQLMSQN-INIZCTEOSA-N	432.322	1.488	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)C1(C)CN(C(=O)OC(C)(C)C)C1)C2	1846362735	SYXVPTYHHUOCFA-AWEZNQCLSA-N	429.945	1.701	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)c1cnc3cc(Cl)ccn13)C2	1846384698	XPDGWBGPAQPREO-UHFFFAOYSA-N	432.912	1.178	50	20	IDGD	
CCOc1ccc(S(=O)(=O)Nc2cccc(C(=O)NNc3nnc(C)c(=O)[nH]3)c2)cc1	11266145	GBDVARWBGSTLQO-UHFFFAOYSA-N	444.473	1.430	50	20	IDGD	
O=C(C[C@H](C(=O)O)c1ccccc1)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	13254462	QXJGEWIJUMJXTB-SFHVURJKSA-N	445.497	1.491	50	20	IDGD	
Cc1cc(=O)oc2cc(OCc3ccc(C(=O)NNC(=O)C(=O)NC4CC4)cc3)ccc12	17805949	PHGCDFXNCNCHFG-UHFFFAOYSA-N	435.436	1.720	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)[C@H]1CC(=O)N(Cc2ccc(C)cc2)C1	25413224	VEHDRRMMFMIHND-SFHVURJKSA-N	425.485	1.969	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CCNC(=O)c2ccc([N+](=O)[O-])cc2)cc(OC)c1OC	26687986	WLZVYSSJSPNCIG-UHFFFAOYSA-N	446.416	1.202	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2ccc(-n3c(C)c[nH]c3=O)cc2)c2ccccc2c1=O	108935019	CKGSAWVMKVDZMS-UHFFFAOYSA-N	446.467	1.669	50	20	IDGD	
CC(C)[C@H](C(=O)NNC(=O)CNC(=O)c1cccs1)S(=O)(=O)C1CCCCC1	728474290	YCBSIVUKXDOLCX-MRXNPFEDSA-N	429.564	1.397	50	20	IDGD	
CNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cc(OC)ccc2Br)o1	728527217	CBIZYPOJOLXIHO-UHFFFAOYSA-N	432.252	1.034	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2ccc(N3C[C@H](C)O[C@H](C)C3)nc2)n1	728722272	OCFQNVOBRJYYIP-OKILXGFUSA-N	447.517	1.007	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NC[C@H]2CCN(CCc3ccccc3)C2)c2ccccc2c1=O	728754682	QHCJPLLQVQDMBK-GOSISDBHSA-N	448.527	1.442	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)N[C@H]1CCCN(Cc2ccccc2)C1	728948151	GBFRCOYLZGGCSK-FQEVSTJZSA-N	437.548	1.688	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2ccc3c(c2)NC(=O)CCN3)cc1OC	729717430	BCUMGFNRYGIAHR-UHFFFAOYSA-N	442.428	1.076	50	20	IDGD	
CC(C)[C@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1)N(C)C	730104324	RARFVFJMKIKQSV-LJQANCHMSA-N	432.546	1.512	50	20	IDGD	
C#CCN1CCC[C@H]1C(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	730104381	SGODSJMZAJRGIU-FQEVSTJZSA-N	440.525	1.024	50	20	IDGD	
COc1ccccc1C/C(C)=C\C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	730343106	CXFSLFOICRZGSH-LFDGNKEFSA-N	440.452	1.715	50	20	IDGD	
Cc1sc(=O)n(CC(=O)NNC(=O)COc2ccccc2O)c1-c1ccc(F)cc1	730778295	FNMPKQLTHSHOTH-UHFFFAOYSA-N	431.445	1.956	50	20	IDGD	
O=C(NNC(=O)N1CCC([C@H](O)c2ccc(F)cc2)CC1)c1ccc(-n2cnnn2)cc1	731043157	DPTKKYVGTSZGQZ-LJQANCHMSA-N	439.451	1.601	50	20	IDGD	
Cc1c(/C=C(\C#N)C(=O)N2CCN(CCNC(=O)c3ccccc3F)CC2)cc(C#N)n1C	731201617	BRUZKIYRHDOGDG-CPNJWEJPSA-N	448.502	1.825	50	20	IDGD	
O=C(NNc1nc(-c2ccncc2)no1)[C@H]1CS[C@H](Cc2ccccc2F)C(=O)N1	732065629	RVYDHPVHNNOJTE-HUUCEWRRSA-N	428.449	1.557	50	20	IDGD	
C[C@]1(NNC(=O)N[C@H]2CCN(c3ccccc3Br)C2)CCS(=O)(=O)C1	732476172	AFLHVGLNIMNBDX-LRDDRELGSA-N	431.356	1.409	50	20	IDGD	
CC(C)OCCCn1c(NNC(=O)[C@@H](C)N2CCN(C)CC2)nc2ccccc2c1=O	733266268	TYPAPZHEEPTIFC-QGZVFWFLSA-N	430.553	1.291	50	20	IDGD	
Cc1cc(NNC(=O)C2CCN(S(=O)(=O)c3ccc4c(c3)OCCO4)CC2)ncn1	734255175	IPZDWIUDMNIZJU-UHFFFAOYSA-N	433.490	1.100	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)c2ccc(Cl)cc2NS(=O)(=O)c2ccccc2)cn1	735473099	MXNALUULJRIJSU-UHFFFAOYSA-N	433.877	1.949	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2csc(Nc3ccccn3)n2)n1	736902805	YQPIMTMZBDAJLT-UHFFFAOYSA-N	432.487	1.594	50	20	IDGD	
C[C@H]1C[C@H](C)CN(C(=O)CN2CCN(C(=O)NNC(=O)COCc3ccccc3)CC2)C1	738497288	RCZBPRNSSDRUQI-OALUTQOASA-N	445.564	1.066	50	20	IDGD	
O=C(NNc1ncnc2[nH]cnc12)[C@@H]1CCCN1C(=O)c1ccc(Br)cc1	740746578	QVNUYKIWWVUCAS-LBPRGKRZSA-N	430.266	1.863	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NCc2cc(F)ccc2N2CCOCC2)cc1	741092551	GIQPDCGVUMEFRI-UHFFFAOYSA-N	432.452	1.580	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)N[C@H](C)[C@H]2CN(Cc3ccccc3)CCO2)cc1	741437275	XVLCNAVKCUVRQZ-WIYYLYMNSA-N	426.517	1.994	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)[C@H](c1cccc(F)c1)N1CCOCC1	742061453	GIQPJZNNOWXXJB-FQEVSTJZSA-N	448.520	1.783	50	20	IDGD	
NC(=O)CNS(=O)(=O)c1ccc(C(=O)NNc2c(Cl)cc(Cl)cc2Cl)o1	742241330	ZKBNEEBDQJHFFG-UHFFFAOYSA-N	441.680	1.760	50	20	IDGD	
O=C(NNC(=O)N1CC[C@H](COCc2ccccc2)C1)c1csc(N2CCOCC2)n1	743509929	NGEQHIQCJPRBTN-KRWDZBQOSA-N	445.545	1.873	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)[C@@H]2CCN(c3cccc(Cl)c3)C2=O)cc1	745432161	IWEOIROUZMYNEP-QGZVFWFLSA-N	440.843	1.569	50	20	IDGD	
C[C@@H](CCc1ccccc1F)C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	745575433	GMCGDQBZTBDYDD-IFXJQAMLSA-N	430.432	1.925	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)[C@H](C)n2nnc(-c3ccccc3)n2)cc1C	745683643	HGYUEYAPKKIRHL-ZDUSSCGKSA-N	442.501	1.838	50	20	IDGD	
O=C(NNC(=O)N1CCOCC1)C1CCN(C(=O)c2ccc(C(F)(F)F)cc2)CC1	745988080	PSZSMJTZCSJCGC-UHFFFAOYSA-N	428.411	1.631	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)CC1CN(C(=O)OC(C)(C)C)C1	746097373	HBZHZGBXLNREQV-UHFFFAOYSA-N	439.538	1.306	50	20	IDGD	
CC[C@@H](Nc1c([N+](=O)[O-])c(C)nn1C)C(=O)NNC(=O)c1cccc(OC(F)F)c1	746215091	HPPURKAIPPWVLD-GFCCVEGCSA-N	426.380	1.890	50	20	IDGD	
COc1cc2cc(C(=O)NNC(=O)c3cncc(NC(C)=O)c3)[nH]c2c(OC)c1OC	746307561	YFKIOQKNXYAMIL-UHFFFAOYSA-N	427.417	1.622	50	20	IDGD	
COC(=O)COc1c(C)cc(C=NNC(=O)c2csc(N3CCOCC3)n2)cc1C	746486093	WPCABALWBIYBRF-UHFFFAOYSA-N	432.502	1.912	50	20	IDGD	
O=C(Nc1ccccc1)Nc1ccc(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)s1	747364938	CYQVYCMOKVPSQY-GFCCVEGCSA-N	437.503	1.523	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)COC1CN(C(=O)OC(C)(C)C)C1	748517302	SRSKIVYLUBWAFZ-UHFFFAOYSA-N	431.493	1.382	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)NCCC(=O)Nc1cc(Br)ccc1C	748623644	KNRCPRGFZRGZCU-LBPRGKRZSA-N	445.314	1.468	50	20	IDGD	
CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)NNC(=O)COc1ccc(C#N)cc1	749330746	TWIAFQIPOWGTGP-FQEVSTJZSA-N	437.431	1.452	50	20	IDGD	
COC(=O)[C@H]1CCC[C@H](C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)C1	751060717	KRSZZCBDTPTHGX-HOTGVXAUSA-N	438.550	1.045	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2ccc(NC(=O)NNC(=O)Cc3cccnc3)cc2)C[C@@H](C)O1	755425012	YHVIPKBSFHAVPE-GASCZTMLSA-N	447.517	1.275	50	20	IDGD	
CCc1nc(C=NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)cs1	755491370	XXWLXPOOUQKFDD-UHFFFAOYSA-N	436.559	1.809	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)Nc1ccccc1C(=O)N1CCN(C)CC1	755622210	IARKNHDKDGZYBC-UHFFFAOYSA-N	425.489	1.478	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)Nc2ccc(OCC(=O)N(C)C)cc2)cc1	755646599	NRRPQRNNTMNGIY-HNNXBMFYSA-N	442.472	1.976	50	20	IDGD	
C[C@H](NS(=O)(=O)c1cnn(C)c1)C(=O)NNc1ccc(C(F)(F)F)cc1[N+](=O)[O-]	755682349	NDRQGCWYYRLBME-QMMMGPOBSA-N	436.372	1.157	50	20	IDGD	
CCN(Cc1ccccc1NC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)C(C)=O	755757330	FPKOBJHPNPJRQU-UHFFFAOYSA-N	432.502	1.925	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)Nc1ccc(CC(=O)N2CCOCC2)cc1	755861951	JWHQRMHLUUDZHT-LJQANCHMSA-N	440.456	1.081	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)Nc1cccc(N2C(=O)CN(C)C2=O)c1	755989848	BWSGIVXUQSVEPS-UHFFFAOYSA-N	441.444	1.715	50	20	IDGD	
CCOc1ccc([C@H](C)NC(=O)CCCNC(=O)NN[C@]2(C)CCS(=O)(=O)C2)cc1	756127589	ZXRYRWLLZYBLJF-MGPUTAFESA-N	440.566	1.424	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccn(Cc3ccccn3)n2)c1	756646431	MGJADNQQXRVUGU-UHFFFAOYSA-N	443.489	1.043	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)Nc2ccc(OC)c(-n3cnnn3)c2)cc1	756747471	PDDMAAPMXXKJIC-ZDUSSCGKSA-N	441.448	1.690	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)N[C@H]2CCN(C(=O)CCc3ccccc3)C2)c1	756979832	JKZBFDVNIJTTFM-SFHVURJKSA-N	440.500	1.882	50	20	IDGD	
Cc1onc(-c2cccc(Br)c2)c1C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O	758033915	AYHJZQCJRJQPRX-MRVPVSSYSA-N	445.295	1.111	50	20	IDGD	
Cc1onc(-c2ccccn2)c1C(=O)N1CCN(S(=O)(=O)CBr)CC1	758512169	ISLQGHVMGMAGIL-UHFFFAOYSA-N	429.296	1.485	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)N[C@@H]2CN(C(=O)OC(C)(C)C)C[C@@H]2C#N)cc1C	758751652	KIJGGLCJWWDFPD-DOTOQJQBSA-N	431.493	1.772	50	20	IDGD	
Cc1nc2ccccc2n1CC(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758782673	WGWOXYVGGLBRCS-UHFFFAOYSA-N	430.509	1.980	50	20	IDGD	
CC(C)(C)OC(=O)NCC1(C(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)CC1	759649642	OBRAVZMDUXOSNK-UHFFFAOYSA-N	425.869	1.949	50	20	IDGD	
O=C(N=c1cc[nH]cc1I)NNC(=O)c1cnn(-c2ccccc2)c1	760029836	NVOMVYAUTRMEQW-UHFFFAOYSA-N	448.224	1.760	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)c2cnn(CCO[C@@H]3CCCCO3)c2C)c1	760123536	OOABYPHRPNGXSP-HXUWFJFHSA-N	431.493	1.616	50	20	IDGD	
C[C@@H](NC(=O)OC(C)(C)C)[C@@H]1CN(CC(=O)NNC(=O)c2cccc(Cl)c2)CCO1	760975431	QVZOLVXVYJEFOV-CJNGLKHVSA-N	440.928	1.715	50	20	IDGD	
O=C(NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)N[C@@H]1CCC[C@H]2OCC[C@@H]12	761795579	WIBKRWDAOCHIQD-RCCFBDPRSA-N	436.534	1.373	50	20	IDGD	
CSc1cccc(N2C[C@H](C(=O)NNc3nccc(N4CCOCC4)n3)CC2=O)c1	762853070	PWKGRSJOETUUOR-CQSZACIVSA-N	428.518	1.531	50	20	IDGD	
O=C(NNc1nccc(N2CCOCC2)n1)c1cc(F)ccc1I	762862499	URGSFRKHOURDET-UHFFFAOYSA-N	443.220	1.814	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3ccccc3S(C)(=O)=O)n[nH]2)cc1OC	763146702	FFFIBDSUCSDLIH-UHFFFAOYSA-N	444.469	1.572	50	20	IDGD	
COC(=O)[C@@H](C)Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1	763441254	AGVCLSMQAIPTLR-LBPRGKRZSA-N	428.401	1.346	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)ccc1Br	763453832	BHBGIUNXRAYILA-UHFFFAOYSA-N	437.206	1.766	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2ccccc2S(=O)(=O)C(C)C)c1	763619275	QBJMDONNVSWPKJ-UHFFFAOYSA-N	433.486	1.342	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccccc2O[C@@H]2CCOC2)cc1C	763667013	OCGULLPTNGPKDA-QGZVFWFLSA-N	427.457	1.636	50	20	IDGD	
C[C@H]1Oc2ccc(NC(=O)C(=O)NNC(=O)COc3ccc(Cl)cc3)cc2NC1=O	763686939	XGYOMTICZZMNOQ-SNVBAGLBSA-N	432.820	1.224	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2cc(Cl)ccc2C(=O)N(C)C)c1	763775916	YRGMNXRMUZNUMA-UHFFFAOYSA-N	448.863	1.459	50	20	IDGD	
COCCOc1ccc(C#N)cc1NC(=O)C(=O)NNC(=O)COc1ccc(C)cc1	763822040	UVMJKFISJFWEQP-UHFFFAOYSA-N	426.429	1.057	50	20	IDGD	
CCOc1cc2c(cc1[C@@H]1C[C@H]1C(=O)NNC(=O)CNC(=O)c1cccnc1)O[C@H](C)C2	763825423	WVLJRWFGOKTUOO-RPVQJOFSSA-N	438.484	1.485	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(-n3ccnn3)cc2)cc1	763859732	FPALCULQMLENFP-CQSZACIVSA-N	438.444	1.219	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccn(Cc2ccncc2)n1	763864433	JEXXXYALMINDDW-CYBMUJFWSA-N	426.408	1.019	50	20	IDGD	
C[C@@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc3ccccc3F)cc2)CCO1	763864885	LTNHPYNWENEPKW-HUUCEWRRSA-N	444.463	1.604	50	20	IDGD	
CCOc1cc(NC(=O)C(=O)NNC(=O)c2ccc(C)cc2O)c([N+](=O)[O-])cc1OCC	764104515	AAPCUXIGXCLCBD-UHFFFAOYSA-N	446.416	1.806	50	20	IDGD	
CCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)CCc2ccc(OC)cc2)c(C)c1	764125309	TUWNTLXJRCGAFX-UHFFFAOYSA-N	426.473	1.472	50	20	IDGD	
O=C(CCc1ccco1)NNC(=O)C(=O)Nc1cnn(-c2ccccc2Br)c1	764177076	JXBZEKOCPHKERQ-UHFFFAOYSA-N	446.261	1.947	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CC2CCCC2)c(C)c1S(=O)(=O)NC1CC1	764178816	KHOKKVHKBPZELC-UHFFFAOYSA-N	436.534	1.410	50	20	IDGD	
CCOCc1cccc(NC(=O)C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1	764265927	HKMYQCUUBXSYEO-UHFFFAOYSA-N	426.477	1.016	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)Cc2ccccn2)cccc1-c1nnc2n1CCCCC2	764270597	PSWCABFVLMRUON-UHFFFAOYSA-N	447.499	1.704	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)C(C)(C)c2ccccc2)cc1C(=O)OC	764314876	ZTFXEJYDGPOSDI-UHFFFAOYSA-N	441.440	1.324	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)C(=O)Nc1ccc(N2CCOCC2)nc1C)c1ccccc1	764327516	AECFPDHFJRLXKS-QGZVFWFLSA-N	425.489	1.506	50	20	IDGD	
Cc1cccc(Oc2ccc(Cl)cc2NC(=O)C(=O)NNC(=O)[C@H]2COCCO2)c1	764434008	PJPXRBOJUWQDGS-QGZVFWFLSA-N	433.848	1.942	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2c3c(nn2C)CCCC3)c1	764461286	CJTQCWHFBPKAJK-UHFFFAOYSA-N	433.534	1.404	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)[C@@H](C)NS(=O)(=O)c2cccc(C#N)c2)cc1C	764525558	VSBMAZVQEHHZFR-OAHLLOKOSA-N	430.486	1.068	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNC(=O)[C@H](C)S(=O)(=O)C2CCOCC2)cc1	764543340	LYOOHILIYDRAGM-HNNXBMFYSA-N	426.535	1.855	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NN=Cc1cnc(N2CCCC2)nc1	764839771	LEAJKOLLAVQKJV-UHFFFAOYSA-N	441.967	1.998	50	20	IDGD	
C[C@H](Cc1ccc(F)c(Br)c1)C(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1	765070415	IYJQDWQMKVUAEL-MWLCHTKSSA-N	436.303	1.284	50	20	IDGD	
C[C@@H](Oc1cccc(F)c1)C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765735353	KJSWCVGAMFYSHW-MRXNPFEDSA-N	428.464	1.198	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)c1ccc2c(c1)OCO2	765755283	FDPLLQIXLQANIB-UHFFFAOYSA-N	430.892	1.648	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)c2ccn(-c3ccc(F)cc3F)n2)cc1	766813714	HDRGQKONBKFCMQ-UHFFFAOYSA-N	425.351	1.640	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)[C@@H](c1ccccc1)N1CCC(O)CC1	767336065	JHPOXEFMEXYTAW-HSZRJFAPSA-N	439.512	1.426	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)CCC(=O)N2CCN(c3ccccc3)CC2)n1	768244898	UJZCMCRUFDAJST-UHFFFAOYSA-N	425.537	1.895	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)[C@H]3CC(=O)N(C4CCCC4)C3)n[nH]2)cc1OC	768275309	ALXMFGTZWCVITF-AWEZNQCLSA-N	441.488	1.646	50	20	IDGD	
C[C@H](C(=O)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1)N1C(=O)[C@H]2CCCC[C@H]2C1=O	768280408	ZXSWNTHWZIRGAO-DFBGVHRSSA-N	427.436	1.541	50	20	IDGD	
COCCN(CCOC)S(=O)(=O)c1ccc(C(=O)NNc2nc3ccccc3[nH]2)cc1	768514257	DEDIBJZRIUSFAQ-UHFFFAOYSA-N	447.517	1.603	50	20	IDGD	
COc1ccccc1[C@]1(C)NC(=O)N(CC(=O)NNC(=O)c2c[nH]c3ccccc23)C1=O	771237317	YVEDXEMADAPXKK-QFIPXVFZSA-N	435.440	1.405	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1ccc(NC2=NS(=O)(=O)c3ccccc32)cc1	771854129	MNCIVABTNRGYGU-LBPRGKRZSA-N	444.469	1.350	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)cc1CC(=O)O	773264985	PMOSQLMPIIWNLH-LLVKDONJSA-N	442.877	1.753	50	20	IDGD	
CCOc1cc(C(=O)N(C)C)ccc1NC(=O)C(=O)NNC(=O)c1ccc(C)c(F)c1	773888355	GKIBVCIISJFFRN-UHFFFAOYSA-N	430.436	1.634	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)cn1	774008615	JGULBDNTXMLSOB-GFCCVEGCSA-N	436.852	1.314	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(N2CCOCC2)c(NC(=O)NNc2ncccn2)c1	775432338	ACQUQBFSAGLQCL-UHFFFAOYSA-N	449.537	1.492	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)CN(C)C)c(C(=O)N2[C@@H](C)CCC[C@@H]2C)cc1OC	775481470	KOTMJYAZLCASCR-KBPBESRZSA-N	435.525	1.821	50	20	IDGD	
COC(=O)C1(c2ccc(S(=O)(=O)NNC(=O)Cn3ccc4ccccc43)cc2)CC1	776280658	KZBVQWRJOWZGEA-UHFFFAOYSA-N	427.482	1.856	50	20	IDGD	
COCc1nnc(-c2cccc(C(=O)OCC(=O)NNC(=O)c3ccc(C#N)cc3)c2)o1	776456493	XLDMPOKIQRFQKA-UHFFFAOYSA-N	435.396	1.373	50	20	IDGD	
CCS(=O)(=O)N1CCC[C@@H](C(=O)NNc2ccc([N+](=O)[O-])cc2Br)C1	779142669	BLLDXZCSMMCJIN-SNVBAGLBSA-N	435.300	1.862	50	20	IDGD	
CN(C)[C@@H](C(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)c1cccc(Cl)c1	780106364	SRBQJTVAHYGACA-QGZVFWFLSA-N	434.836	1.855	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)Nc2cnn(CC(=O)N3C[C@@H](C)O[C@H](C)C3)c2)c1	780584253	LBZVHSFJPHGVJG-ZIAGYGMSSA-N	430.465	1.454	50	20	IDGD	
CC(C)CNS(=O)(=O)c1ccc(Br)c(C(=O)NN=c2cc[nH]cc2)c1	780761441	ZYPKDIGEFDTIQN-UHFFFAOYSA-N	427.324	1.957	50	20	IDGD	
O=C(C[C@H](O)c1ccc(OCc2ccccc2)cc1)NNC(=O)[C@@H]1CCS(=O)(=O)C1	780860069	JSSMYVOJRRXRGR-MJGOQNOKSA-N	432.498	1.271	50	20	IDGD	
CC(=O)Nc1ccc(C)c(C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)c1	781932337	OYDZDRBTGHYWDS-UHFFFAOYSA-N	446.533	1.041	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)[C@H]3CC(c4ccccc4[N+](=O)[O-])=NO3)nc21	781969316	IDTOKFOGRVXLJG-CQSZACIVSA-N	440.420	1.831	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)[C@H]1CCCN(S(=O)(=O)CBr)C1	782434344	VOYUOVYFHVQCOB-NSHDSACASA-N	428.349	1.022	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)C(=O)Nc1cccc(CSC2CCCC2)c1	784005088	ZKPSFQDYNUXKKF-UHFFFAOYSA-N	444.513	1.971	50	20	IDGD	
Cc1cc(C(=O)N2CCOCC2)ccc1NC(=O)C(=O)NNc1ccc(F)c(F)c1F	784815096	NTFAVPFPFNVRKK-UHFFFAOYSA-N	436.390	1.967	50	20	IDGD	
O=C(NNc1ccnc(Br)c1)C(=O)Nc1ccc(CN2CCOC2=O)cc1	784836970	DVCQJVOJFLJQPT-UHFFFAOYSA-N	434.250	1.878	50	20	IDGD	
CN(C)CCCOc1ccc(NC(=O)C(=O)NNc2cccc(S(C)(=O)=O)c2)cc1	784838934	AIJFQSOTMMDFTG-UHFFFAOYSA-N	434.518	1.502	50	20	IDGD	
COCCCS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2cc(Cl)ccn2)cc1	784856675	RACPSISMYKBFOR-UHFFFAOYSA-N	426.882	1.627	50	20	IDGD	
NC(=O)c1ccc(NC(=O)C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)c(F)c1	785099894	MRPILHCGILCEIE-UHFFFAOYSA-N	435.362	1.177	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(Cl)c(S(C)(=O)=O)c2)c1	788330107	DVACBOPJNVQHBD-UHFFFAOYSA-N	439.877	1.217	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccc(Cl)c(S(C)(=O)=O)c1	788332926	ICLGGEOCXVZHFW-UHFFFAOYSA-N	439.877	1.081	50	20	IDGD	
CS(=O)(=O)[C@H]1CCCC(=NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)C1	788418814	BFKQKZLXQRUOGY-KRWDZBQOSA-N	427.548	1.544	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1nc2c(s1)CCCCC2	789775313	JSUXWKMVNGUOFE-UHFFFAOYSA-N	438.531	1.906	50	20	IDGD	
COc1cc(NNC(=O)C(=O)Nc2ccccc2C(=O)N2CCN(C)CC2)ccc1Cl	789798230	KKVIPCKFXFGYQE-UHFFFAOYSA-N	445.907	1.818	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNS(=O)(=O)c1ccc(C(F)(F)F)c(F)c1	790340513	QGPAQQJYZIIQSD-UHFFFAOYSA-N	425.385	1.646	50	20	IDGD	
CSSCCNC(=O)N1CCCN(S(=O)(=O)c2ccc3c(c2)OCCO3)CC1	790878069	GZLIBWOWNUKWNU-UHFFFAOYSA-N	447.604	1.875	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2cccc(F)c2[N+](=O)[O-])cc1-n1nnnc1C	790998608	JWSGSOOEGNXWKX-UHFFFAOYSA-N	430.356	1.108	50	20	IDGD	
C[C@@H]1CC(=O)C[C@H](C(=O)NNC(=O)OC(C)(C)C)[C@H]1C(=O)NNC(=O)OC(C)(C)C	791123805	KFWDIJCLQMYZHE-WXHSDQCUSA-N	428.486	1.330	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(CCC(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)CC1	792280160	CXEHNXWMXNLWQP-UHFFFAOYSA-N	448.549	1.842	50	20	IDGD	
CC(=O)NC[C@H]1CCn2ncc(C(=O)NNC(=O)c3cc4c(s3)CCCCC4)c2C1	792736805	TUDCJAVMUFMBEW-AWEZNQCLSA-N	429.546	1.987	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)NNC(=O)CNC(=O)OCc1ccccc1	793227356	RTTGUZBMKSQOQD-UHFFFAOYSA-N	449.851	1.250	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccsc1)c1cccc(S(=O)(=O)N2CCCCC2)c1	795276708	SWEWRBZQXQBYBI-UHFFFAOYSA-N	429.545	1.546	50	20	IDGD	
C[C@H](C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1)c1ccc2c(c1)OCO2	795922700	PAFRZQJFFKPEQN-SGTLLEGYSA-N	428.397	1.049	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(F)c(N3CCOC3=O)c2)cc1OC	796992373	PAERZTYBHIGDIY-UHFFFAOYSA-N	446.391	1.199	50	20	IDGD	
COc1cc(Br)c(NC(=O)C(=O)NNC(=O)c2cccc(C)n2)cc1OC	797370356	ZVCAHRJRKHWWFW-UHFFFAOYSA-N	437.250	1.569	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)N3CCc4ccccc43)cc2)n1	797371112	YNPRPGAVJUCNHM-UHFFFAOYSA-N	443.463	1.993	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc(Cl)c(CN2CCOCC2)c1	797535608	OYNAASGRLBSIIX-UHFFFAOYSA-N	430.892	1.880	50	20	IDGD	
COC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)COc2ccc(OC)cc2)c1C	798042531	VQLCBFHODFVWDK-UHFFFAOYSA-N	430.417	1.347	50	20	IDGD	
CCn1ncc(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)c1C(F)(F)F	799257583	MVBMBMVUYSEZQI-UHFFFAOYSA-N	438.410	1.461	50	20	IDGD	
CSC[C@H](C)C(=O)N1CCC(C(=O)OCC(=O)NNC(=O)Cc2ccccc2C)CC1	799542309	QIDNDNMUMLODJZ-INIZCTEOSA-N	449.573	1.466	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc(C)c1Cl	799834450	NCURAJWZOZPNQK-UHFFFAOYSA-N	427.848	1.603	50	20	IDGD	
CNC(=O)CNC(=O)c1cccc(NC(=O)NNC(=O)c2c(Cl)cccc2Cl)c1	800595275	XAQBJZZPHYJACW-UHFFFAOYSA-N	438.271	1.936	50	20	IDGD	
O=C(NNC(=O)C(=O)Nc1ccccn1)N[C@@H]1COc2cc(F)c(Br)cc21	800748556	ZCZNIUJJONLSNC-LLVKDONJSA-N	438.213	1.386	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)ccc1F	801179963	LJMRCDISAKVOKC-UHFFFAOYSA-N	446.501	1.142	50	20	IDGD	
O=C(NCCNS(=O)(=O)c1ccc(F)cc1Cl)NNC(=O)c1ccccc1O	802433037	MZKOOARLPHEUES-UHFFFAOYSA-N	430.845	1.107	50	20	IDGD	
COc1ccc(S(=O)(=O)NCCC(=O)NNc2nccnc2C2CCC2)cc1OC	805472340	HBZXXAWGPFXSSY-UHFFFAOYSA-N	435.506	1.573	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cccc(C(C)(C)O)c2)cc1	806975266	SEPLYQHFZUXMSM-AWEZNQCLSA-N	429.473	1.866	50	20	IDGD	
COCCCOc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(C#N)c2)cc1OC	806979181	UYEDMAJHYBMHAS-UHFFFAOYSA-N	426.429	1.382	50	20	IDGD	
O=C1COc2c(cc(Cl)cc2NC(=O)C(=O)NNc2ccc(C(F)(F)F)nn2)N1	807013803	GOLQFYZCBUTJQT-UHFFFAOYSA-N	430.730	1.562	50	20	IDGD	
CNS(=O)(=O)c1cc(NC(=O)C(=O)NNc2ccc(C#N)c(Cl)c2)ccc1F	807020236	IZLSFTVEGDNUPJ-UHFFFAOYSA-N	425.829	1.341	50	20	IDGD	
CC[C@@H](C)C(=O)NNS(=O)(=O)c1cc(Cl)c(OCC(=O)N(C)C)c(Cl)c1	808076901	CFSSNIVOIBBAPA-SECBINFHSA-N	426.322	1.816	50	20	IDGD	
Cc1nc2ccc(NC(=O)NN(C)C(=O)N3CCN(C(=O)OC(C)(C)C)CC3)cn2n1	809896601	CBKHWSVTOSFTOO-UHFFFAOYSA-N	432.485	1.679	50	20	IDGD	
CCOc1ccc(OCc2ccc(C(=O)NNC(=O)C(=O)Nc3cnnn3C)cc2)cc1	810384929	LMCOWWRQIBFGSW-UHFFFAOYSA-N	438.444	1.193	50	20	IDGD	
O=C1CC(C(=O)NNc2nccc(N3CCOCC3)n2)(c2cccc(Br)c2)C1	810559339	RSZCAZWFZWXNCZ-UHFFFAOYSA-N	446.305	1.820	50	20	IDGD	
O=C(CNC(=O)NNC(=O)c1cc2c(s1)CCCCC2)NCCN1CCCCCC1	814424876	PTFOCNKNUIEQLC-UHFFFAOYSA-N	435.594	1.953	50	20	IDGD	
Cc1nn(C(C)C)c(C)c1CC(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	815734775	ZCSPFJQWIXZBLC-UHFFFAOYSA-N	435.550	1.788	50	20	IDGD	
Cc1nc(-c2ccc(NC(=O)C(=O)NNc3ccccc3S(=O)(=O)N(C)C)cc2)n[nH]1	815751653	IMXIZXSOTPHFLD-UHFFFAOYSA-N	443.489	1.112	50	20	IDGD	
CCCOc1cc(F)ccc1NC(=O)C(=O)NNc1ccccc1S(=O)(=O)N(C)C	815752110	CMOOXDKPORPIAH-UHFFFAOYSA-N	438.481	1.947	50	20	IDGD	
CCOC(=O)c1cnc(C)c(C(=O)NNC(=O)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)c1	816511041	NAIRNFCRJYKQNA-CQSZACIVSA-N	434.493	1.975	50	20	IDGD	
CC(C)S(=O)(=O)c1ccccc1C(=O)NNc1ccccc1S(=O)(=O)N(C)C	817053658	AZZJRWXTQZSHHJ-UHFFFAOYSA-N	425.532	1.876	50	20	IDGD	
C[C@@H]1Cc2ccccc2N1C(=O)[C@H]1CCCC[C@H]1C(=O)NNC(=O)N1CCN(C)CC1	819721450	TXINQOMXOSXXOX-QRQLOZEOSA-N	427.549	1.759	50	20	IDGD	
O=C(NCC1(N2CCOCC2)CCCCC1)NNC(=O)c1nn(-c2ccccc2)cc1O	838511963	ASTQVWYWHZQUAD-UHFFFAOYSA-N	442.520	1.557	50	20	IDGD	
COc1ccccc1N1C[C@H](C(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)CC1=O	849206061	AFQMOZSLPVJRNV-CQSZACIVSA-N	445.859	1.706	50	20	IDGD	
Cc1ccc(N(CCC(=O)N2CC[C@H](B(O)O)C2)S(=O)(=O)c2ccc(C)cc2)cc1	864234885	XVQBFEOHKAUFFY-SFHVURJKSA-N	430.335	1.964	50	20	IDGD	
Cc1ccc(NCC(=O)NN=Cc2c(N3CCOCC3)nc3ccccn3c2=O)c(C)c1	874087324	SHVFVALGGCCOSQ-UHFFFAOYSA-N	434.500	1.710	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)c2c(N)n(C)c(=O)n(C)c2=O)c(C)n1-c1cccc([N+](=O)[O-])c1	884100403	SZJGIJHZAITJCC-DHDCSXOGSA-N	448.439	1.772	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)Cc2ccc(S(=O)(=O)N3CCCC3)s2)cc1	901431111	GKVKQBVHBAGWGP-UHFFFAOYSA-N	437.543	1.610	50	20	IDGD	
COc1cccc(/C=C(\C#N)C(=O)OCC(=O)Nc2ccc(C)c(S(N)(=O)=O)c2)c1	913264139	ZWBFLNNVKNTWCG-OVCLIPMQSA-N	429.454	1.740	50	20	IDGD	
N#Cc1ccc(S(=O)(=O)NCC(=O)NNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1	913412907	GUHCWUPLSKCPQJ-UHFFFAOYSA-N	443.363	1.907	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)C1=NN(Cc2ccc(F)cc2)C(=O)CC1	916044714	LWTHJNJIQPNPDJ-UHFFFAOYSA-N	426.404	1.537	50	20	IDGD	
COc1cc(-n2cnnn2)c(Cl)cc1C(=O)NNC(=O)c1cn(C)c2ccccc12	916147094	QZLQVLLKULPFML-UHFFFAOYSA-N	425.836	1.891	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)NCc1ccccc1S(=O)(=O)N(C)C	916237880	SFTYUFHHWFKWIS-ZDUSSCGKSA-N	438.481	1.374	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)NC2CCN(CC(=O)Nc3ccccc3)CC2)c1	916240089	NZWFQVSVAHALTM-UHFFFAOYSA-N	438.532	1.800	50	20	IDGD	
O=C(NN=Cc1cc2ccccc2nc1O)c1cccc(S(=O)(=O)N2CCOCC2)c1	916258497	YGXDPVPKUJFKLD-UHFFFAOYSA-N	440.481	1.725	50	20	IDGD	
Cc1ncc(CO)c(C=NNC(=O)CN2c3cccc4cccc(c34)S2(=O)=O)c1O	916368766	ZXHIDSKXMFOLDV-UHFFFAOYSA-N	426.454	1.400	50	20	IDGD	
O=C(COC(=O)c1cncn1-c1ccc(F)cc1)NNC(=O)[C@H]1COc2ccccc2O1	917248137	HRZDQRWTBHJXQV-GOSISDBHSA-N	440.387	1.156	50	20	IDGD	
COc1ccc([N+](=O)[O-])cc1CNC(=O)NNc1ccc(S(=O)(=O)NC(C)C)cn1	918115063	VPEJNHCOACFAAA-UHFFFAOYSA-N	438.466	1.511	50	20	IDGD	
O=C(NCCOC1CCCCC1)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	918134154	HKHWXMXOWUCIQF-UHFFFAOYSA-N	438.550	1.764	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc(F)c(F)c1)NNC(=O)c1ccc(Cl)cc1O	918357811	AJTJLQCJSQSFBN-UHFFFAOYSA-N	433.820	1.453	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)c3cc(C)c(C)c(S(N)(=O)=O)c3)n[nH]2)cc1	918695489	XCFWTCZBOVVBEN-UHFFFAOYSA-N	427.486	1.724	50	20	IDGD	
COc1ccccc1/C=C(\C(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1)c1ccccc1	919889349	LJPXGJYOYLOFAB-XIDKLXSXSA-N	429.498	1.753	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)NC[C@@]2(N3CCOCC3)CCSC2)c1C	919980814	RKQOYECKNNVTOG-WLJFKGHSSA-N	432.590	1.982	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)CN1C(=O)Cn2c(cc3ccccc32)C1=O	920274086	KLASDCJAKPZBBZ-ZDUSSCGKSA-N	438.415	1.378	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1)NNC(=O)c1ccc2ccccc2n1	920429917	DNWLCLCCNHEEMU-UHFFFAOYSA-N	443.441	1.273	50	20	IDGD	
C[C@@H](Cc1cccc(Br)c1)NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	920811267	FNPRCJRSTCKJEA-LBPRGKRZSA-N	444.293	2.000	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)NCc2ccnn2C)cc1	920852852	AEEXJBLCCCFAGS-LFIBNONCSA-N	433.472	1.391	50	20	IDGD	
NC(=O)[C@H]1CCCN1Cc1cccc(NC(=O)NNC(=O)c2ccc3c(c2)OCO3)c1	920929171	AEFNCHKHBMLEHK-MRXNPFEDSA-N	425.445	1.332	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)Nc1ccc(S(C)(=O)=O)nc1	920940788	ZUQGJEDFRHTQFO-UHFFFAOYSA-N	441.535	1.711	50	20	IDGD	
C[C@@H](COCC(F)(F)F)NC(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1	1116093288	QGRZMKSZYISFMD-NSHDSACASA-N	426.436	1.931	50	20	IDGD	
CCO[C@@H](C)c1noc(CN(C)C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)n1	1116155939	KKHRRRDPEJHYTL-ZDUSSCGKSA-N	432.485	1.046	50	20	IDGD	
CN(NC(=O)c1ncc(C(N)=O)cc1Cl)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	1320573802	DHRZMYVTOJERBM-UHFFFAOYSA-N	440.888	1.083	50	20	IDGD	
CN(CCO)S(=O)(=O)c1ccccc1CNC(=O)NNc1ccc(C(C)(C)C)nn1	1321940770	CMPNZXOILQPGNE-UHFFFAOYSA-N	436.538	1.213	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)c2n[nH]c3c2CCCC3)cc1S(=O)(=O)NC1CCCC1	1331500322	WYXJQDDIRPAQQJ-UHFFFAOYSA-N	445.545	1.893	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnc3snnc3c1)C2)[C@@H](F)Cl	1778029961	JROUPFHHGABFAO-PBFPGSCMSA-N	427.889	1.748	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3nnc(-c4ccccc4)o3)C2)C1	1779113691	AXHIHSRBZRUKRJ-MGPUTAFESA-N	434.880	1.434	50	20	IDGD	
COc1ccc(CC(=O)N2CCO[C@@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)c(C#N)c1	1779300692	VIKYJIPUMGYWJN-JOCHJYFZSA-N	445.592	1.791	50	20	IDGD	
Cc1cc(C)n(CCC(=O)N2CCO[C@]3(CCN(C(=O)[C@](C)(Cl)CCl)C3)C2)n1	1781233878	OCTPISGOBBMUPF-RTBURBONSA-N	431.364	1.956	50	20	IDGD	
Cc1ccccc1OCC(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781327905	DGAZMAJTCIDDOH-SJLPKXTDSA-N	429.286	1.894	50	20	IDGD	
CC1(C)CCC(CC(=O)N2CC[C@@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)CC1	1781404531	YRJUXOHSISHAGW-XMMPIXPASA-N	442.365	1.416	50	20	IDGD	
O=C(c1n[nH]c2cccc(F)c12)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1782486444	SKOOCZLJRPWWHZ-WMLDXEAASA-N	443.248	1.836	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3[nH]nc4ncccc34)CCO2)C1	1783347251	CWPYPTSUEJLYHV-UGSOOPFHSA-N	436.310	1.575	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)Cc3noc4ccccc34)CCO2)C1	1783532318	HCQWNEIQIUCRRC-DJJJIMSYSA-N	436.306	1.984	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(N(C)C)nc3)CCO2)C1	1783536704	ILFFIAROJYLNET-UGSOOPFHSA-N	425.327	1.375	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)C3CCC4(CC3)OCCO4)CCO2)C1	1783537150	QIXSDPINPAGLCU-KSSFIOAISA-N	445.354	1.533	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](O)c1ccccc1Cl)CCO2	1783539453	JHATWVIGELCQHS-DWQUBVKVSA-N	445.741	1.987	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)CCc3cccc(OC)n3)CCO2)C1	1783873502	PTLUFVHDDPLOIB-OXQOHEQNSA-N	425.913	1.107	50	20	IDGD	
CCOC(=O)O[C@@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]2C1	1783973859	DLXOCFJYDGBGFL-QTVXIADOSA-N	449.342	1.559	50	20	IDGD	
Cc1ccc(S(=O)(=O)CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]3C2)cc1	1787445755	NYUGTJATHWXYHX-OWIUFQIYSA-N	446.928	1.283	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc([N+](=O)[O-])cc3F)C[C@@H]21)[C@H](F)Cl	1787450636	REOPIOOKFBPDFA-ONQXIZJVSA-N	431.823	1.791	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccccc3C(N)=O)C[C@@H]21	1788763440	GZIYEEIDUWLXTB-WBAXXEDZSA-N	433.581	1.230	50	20	IDGD	
CC(=O)c1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]3C2)n[nH]1	1789865977	IOUTXKLPUNFLLB-LLXPTAGJSA-N	431.320	1.442	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C3\C(=O)Nc4ccccc43)C[C@@H]21	1791255372	OUQNMAFOOWMDGS-MSBMTRHWSA-N	447.919	1.256	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)n3ccnc3C)[C@H]2C1	1791707478	DQUXSMURHZYHNC-VFTHGPRRSA-N	441.370	1.906	50	20	IDGD	
C[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)c1ccccn1	1791715614	CITSUKAKZZQOKT-FDICVXPISA-N	428.302	1.855	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)Cc1ccccc1)C2	1792871977	GPBOCIJCABIOKU-JFMONLCZSA-N	439.350	1.211	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCc1ccc(F)nc1	1794021242	JPQKTJKJYCYHSY-BASYENTBSA-N	442.329	1.916	50	20	IDGD	
Cn1cncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1795202765	VQJAMCODGOADOC-XGUBFFRZSA-N	439.944	1.804	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](NC(C)C)C(C)C	1795718643	KGQLHUQBJZUMMX-ZHCJQAHYSA-N	432.403	1.772	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccnn1-c1ccccc1)c1ccc(B(O)O)cc1	1797234940	BVHODVLPYMWINJ-NUZGMZIFSA-N	444.300	1.118	50	20	IDGD	
COc1ccccc1CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnccc1C(=O)NN	1798442834	INSQYAQLYVNMAI-BJWYYQGGSA-N	437.500	1.188	50	20	IDGD	
COc1cnc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Br)c(F)c1	1799347415	KIIDZKQUCXLZPH-XSPYEYLBSA-N	434.237	1.123	50	20	IDGD	
NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](Br)Cc1ccccc1)C2	1801669109	UJJSLGWMBJGOHM-YVSFHVDLSA-N	436.350	1.896	50	20	IDGD	
CC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2	1801964316	MQKLHQGHQBKMOR-RNJOBUHISA-N	438.352	1.683	50	20	IDGD	
COc1ccccc1OCC(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1	1802801995	AUPLNIGYMRHQJC-XGHQBKJUSA-N	447.919	1.775	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]1c1cccnc1	1803139273	NGQQMDINDJBWJB-FUHIMQAGSA-N	441.919	1.957	50	20	IDGD	
Cn1ncc2c(C(=O)N3CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]3c3cccnc3)cccc21	1803142794	JINLZUVRFVNDIL-XPGWFJOJSA-N	441.919	1.888	50	20	IDGD	
CN(CCCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](O)CCl)C2)C(=O)OC(C)(C)C	1804390269	OXIIURAQQUVDTH-FZKCQIBNSA-N	431.961	1.871	50	20	IDGD	
C=CCNC(=O)/C=C\C(=O)N1CC[C@H](CNC(=O)CCBr)[C@H]1c1cccnc1	1806337186	GTWDTXPMKPMHAH-AQZVRURSSA-N	449.349	1.731	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cccs2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807364963	VJSMKQGXXSACHU-PXNSSMCTSA-N	435.314	1.456	50	20	IDGD	
Cc1ccc(C(=O)N2CCCC3(CCN(C(=O)c4cnccc4C(=O)NN)CC3)C2)cn1	1808139354	YRXJIOQJODSPJO-UHFFFAOYSA-N	436.516	1.547	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)CCNC(=S)NC)[C@H]1c1cccnc1	1808263183	DCAYJGLITPJJSN-ZOBUZTSGSA-N	425.986	1.589	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@H]1CCN(C(=O)[C@H]2CCC(=O)N2)[C@@H]1c1cccnc1	1808296574	SCGWNIVGEBFRFR-UMHPPVOVSA-N	427.332	1.602	50	20	IDGD	
O=C(CCc1cccs1)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1	1809968960	HWIYSSDGTAIHFK-UHFFFAOYSA-N	440.374	1.906	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)[C@@H]2C[C@]2(F)Cl)[C@H]1c1cccnc1	1813159610	NPKNGEAEPJEQPE-BAAGSCJXSA-N	439.919	1.385	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)CC3CCOCC3)sc2C1	1814617014	ZKLYSJBFRIQQQR-AWEZNQCLSA-N	437.566	1.245	50	20	IDGD	
Cc1cc(CC(=O)Nc2cc([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)on1	1815716056	NNWXMTGAIUSDGM-MRXNPFEDSA-N	431.497	1.314	50	20	IDGD	
Cc1ccc(CC(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)cc1	1816944564	VDUGMYZDFOQCGM-OAQYLSRUSA-N	446.316	1.947	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CC[C@@H](N)C(N)=O)n[nH]1	1817359977	SNAKHXZXEXVWGD-MOCULFSLSA-N	433.340	1.231	50	20	IDGD	
CN[C@@H](CC(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCBr)[nH]n1)C(=O)O	1817362851	CFPSFXFMONAQPB-RYUDHWBXSA-N	430.303	1.250	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](F)Cl)[nH]n1)c1n[nH]c2c1CS(=O)(=O)C2	1817684047	WUNPLHZXIUWNFR-SMDDNHRTSA-N	444.876	1.402	50	20	IDGD	
Cc1cc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2ccc(B(O)O)cc2)CC3)cn1C	1817695162	BJDXYHCALGLFIX-MRXNPFEDSA-N	438.318	1.009	50	20	IDGD	
Cc1nc2sccn2c1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](O)CCl)CC2	1819352176	XBLUYBJCOWEROZ-MWLCHTKSSA-N	439.950	1.986	50	20	IDGD	
CC(C)O[C@@H](C)C(=O)N[C@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1	1819798121	WNZOEVFQVHFMDA-RYUDHWBXSA-N	446.533	1.181	50	20	IDGD	
CC[C@@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc3n(n2)CCNC3=O)[nH]n1	1820854263	PPTDCQPTCHFTHS-RISCZKNCSA-N	433.900	1.673	50	20	IDGD	
COc1cc(C#N)cc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@H](O)CCl)CC3)c1	1821383948	LEJORLANRVDAMV-SWLSCSKDSA-N	434.905	1.849	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CN2CCNC2=N)CC1	1824092894	IFGBVGYKJHXXFJ-GOEBONIOSA-N	442.402	1.477	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(C)n4ccnc4n3)sc2C1	1824118853	KEHRPNXJQMKKOW-VXGBXAGGSA-N	448.936	1.974	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc4nn[nH]c4c3)sc2C1	1824416711	XWGGIGUSJAEXRF-MNOVXSKESA-N	434.909	1.894	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CSC(=N)N)CC2	1825447169	QSHWTZLBYVLBQS-YUMQZZPRSA-N	434.385	1.855	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1n[nH]cc1[N+](=O)[O-])CC2	1825642109	NZLQIONNMIINTN-RQJHMYQMSA-N	443.283	1.784	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3noc(C(C)C)n3)C2)C1	1831639567	CJDJIRCOLDVFNF-QRWLVFNGSA-N	442.944	1.599	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CSc3ncccn3)C2)C1	1831646548	MMULEGYTPIKEMR-DNVCBOLYSA-N	442.969	1.433	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccn(C(C)C)n3)C2)C1	1831653859	FXBCNLCQFKRXFI-OXQOHEQNSA-N	426.945	1.942	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccnc(F)c3)CCO2)C1	1831907189	IWFDWWFXWUEHJG-KSSFIOAISA-N	444.301	1.464	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)c1	1832436902	DIOCOCQBHNWARG-ICSRJNTNSA-N	428.888	1.673	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cccn4nccc34)CC2)CC1)[C@H](O)CCl	1833312191	KSESHNUHTZUHDW-LJQANCHMSA-N	433.940	1.119	50	20	IDGD	
COc1ccc(F)cc1C(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)CCl)CC2)CC1	1833312751	BBSFZBWWJOKWKF-SFHVURJKSA-N	441.931	1.619	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccns3)CCO2)C1	1833769980	ATTRIXPCOPAHSW-MLGOLLRUSA-N	432.340	1.244	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](F)Cl)CC2)CC1)c1cnn(-c2cccnc2)c1	1834002989	AHKPZYGXUWLHTB-IBGZPJMESA-N	448.930	1.987	50	20	IDGD	
Cc1cncc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](C)CBr)C3)C2)c1	1834277871	GVGQOKIDYUJRMY-KXBFYZLASA-N	440.338	1.491	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3nccs3)CCO2)C1	1834431308	KVUIWQUICCMHLT-WBMJQRKESA-N	432.340	1.244	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCBr)CCO3)C2)cc1	1834823706	DWWGSIWJGCNSIW-LJQANCHMSA-N	425.323	1.850	50	20	IDGD	
CCOc1ccc(C(=O)N2CCC(N3CCC(NC(=O)[C@H](F)Cl)CC3)CC2)nn1	1835081973	JABWEVWLEXBCFT-KRWDZBQOSA-N	427.908	1.595	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3ccn(CCOC)n3)CC2)CC1	1835186162	MHAKEEDREQWXIE-SFHVURJKSA-N	439.988	1.732	50	20	IDGD	
C[C@@H]1CCc2c(C(=O)NC3CCN(C4CCN(C(=O)[C@H](O)CCl)CC4)CC3)n[nH]c21	1835358959	FRPKEFGMCAOUOW-CXAGYDPISA-N	437.972	1.244	50	20	IDGD	
O=Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)s1	1835946085	FAKQDVDEUXHLJM-CJNGLKHVSA-N	449.298	1.321	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3cccnc3)CCO2)C1	1836152534	LXVUHNTYTSCNSZ-KXBFYZLASA-N	440.338	1.112	50	20	IDGD	
CCc1ccnc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)c1	1836360823	JXRDCBYYWLAIIN-OAQYLSRUSA-N	435.597	1.566	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC(OC2CCN(C(=O)Cn3ccnc3)CC2)CC1	1836669744	CMDZZXGCSQKCST-HNNXBMFYSA-N	441.370	1.913	50	20	IDGD	
O=C([C@H](O)CCl)N1CCC(OC2CCN(C(=O)[C@@H](O)Cc3ccccc3)CC2)CC1	1836719193	PERIFSFSJIAESQ-VQTJNVASSA-N	438.952	1.188	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cn4cc(F)ccc4n3)CCO2)C1	1836961364	BWWYIPZUCBZXRO-FOIQADDNSA-N	438.887	1.561	50	20	IDGD	
C[C@@H](Nc1cnccn1)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](F)Cl)CC2)CC1	1838082058	DDFVJLFAINDDCE-CXAGYDPISA-N	427.908	1.810	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnn(C)c3Cl)CCO2)C1	1838305625	OCMYXAPHAXIBFN-KSSFIOAISA-N	433.336	1.551	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3ccc([N+](=O)[O-])[nH]3)CC2)CC1	1838558884	AZOYJTDTHYYYBM-HNNXBMFYSA-N	442.900	1.789	50	20	IDGD	
O=C1C[C@@H](C(=O)N2CCC(OC3CCN(C(=O)[C@@H](F)Br)CC3)CC2)CCN1	1838648230	NIRKGFOCUIWOPB-BLLLJJGKSA-N	448.333	1.202	50	20	IDGD	
N#Cc1cccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)c1	1838907935	XDJONTJMCNHMHQ-CRAIPNDOSA-N	440.269	1.319	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(-c4cccnc4)[nH]n3)C2)C1	1839145361	FISAZFRAEKNPQB-KKSFZXQISA-N	447.923	1.559	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)/C=C/c3ccco3)C2)C1	1839150396	LMXLIGQEQWVQGC-HKVCONOFSA-N	431.316	1.986	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc4ccnn4c3)CCO2)C1	1839569276	WDZZQJGSOLXRFB-GHTZIAJQSA-N	434.924	1.812	50	20	IDGD	
CCN(CC)C[C@@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1839674862	LEWCFMVFQHPPFF-DYESRHJHSA-N	432.005	1.686	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CCC(F)(F)F)C2)C1	1839963349	IIHJKBKWEQFMJH-DOMZBBRYSA-N	445.276	1.959	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cncc(O)c3)CCO2)C1	1840064331	GBYBKBRHQSXQNK-QAPCUYQASA-N	442.310	1.031	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cscc3OC)C2)C1	1840152336	FSWHCEYAEHYNDF-KDOFPFPSSA-N	432.926	1.081	50	20	IDGD	
CC(C)Cc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)n(C)n1	1840187435	ANBKBGFSZGUBAY-IBGZPJMESA-N	447.363	1.492	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2cc(F)ccc2F)C1	1844855027	UTAMYYYCDWEQHU-DHRITJCHSA-N	429.427	1.916	50	20	IDGD	
Cn1c(=O)n(CC(=O)N2CC3(CCCN3C(=O)[C@](C)(Cl)CCl)C2)c2ccccc21	1845170910	WFZSERQTLDCOTR-LJQANCHMSA-N	439.343	1.780	50	20	IDGD	
COc1cc(/C=C/C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](O)CCl)cc(OC)c1OC	1847563861	RAFQDEVGAMKBLI-GHNZZDGLSA-N	438.908	1.527	50	20	IDGD	
Cc1cc(C)c(OCC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)CCC(=O)NN(C)C)c(C)c1	1847736441	GMIXABBJARGXNY-OALUTQOASA-N	430.549	1.565	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)c1ccc(S(=O)(=O)N2CCCC2)cc1	14847388	IOFUQWMCNFVNSN-UHFFFAOYSA-N	439.497	1.732	50	20	IDGD	
O=C(NNC(=O)c1cc(S(=O)(=O)N2CCOCC2)ccc1Cl)c1ccccc1F	15794774	YVMKIUUHGZMHDJ-UHFFFAOYSA-N	441.868	1.575	50	20	IDGD	
C[C@@H]1Cc2cc(C(=O)NNC(=O)Cc3nc4ccccc4n3C)ccc2N1S(C)(=O)=O	17411327	CEDJUMNZIFSEMB-CYBMUJFWSA-N	441.513	1.288	50	20	IDGD	
COc1cc(CC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)ccc1C	28028390	DBPNEACRFOQMAS-UHFFFAOYSA-N	447.513	1.028	50	20	IDGD	
Cc1cccc(N2CCN(S(=O)(=O)CC(=O)NNC(=O)c3ccccc3F)CC2)c1	108811396	VUPFQFGLKGHRBZ-UHFFFAOYSA-N	434.493	1.047	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)C[C@@](O)(c2nc(C)cs2)C(F)(F)F)cc1	725928842	CWFLYBGKIRVJFD-QGZVFWFLSA-N	445.419	1.904	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)c1ccc(F)cc1Br)N1C(=O)NC2(CCCC2)C1=O	726526986	ZIBWUPQTDUQQOQ-VIFPVBQESA-N	441.257	1.602	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)NCCc2ccc(OC)c(OC)c2OC)c1	727846526	NBKKISIJHCDJJC-UHFFFAOYSA-N	433.461	1.916	50	20	IDGD	
Cc1nc2ccccc2c(=O)n1CC(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	728209636	KACZHZBPBCVFLR-UHFFFAOYSA-N	427.486	1.289	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)[C@H]3CCOc4ccccc43)cc2)CC1	728213933	HJGWDOBOFXJGFO-IBGZPJMESA-N	430.530	1.632	50	20	IDGD	
O=C1CCC(=O)N(c2ccc(C(=O)NNc3ccc(S(=O)(=O)C(F)F)cc3)cc2)N1	728972363	UDNCSNRTOCZHCT-UHFFFAOYSA-N	438.412	1.598	50	20	IDGD	
CN(CC(=O)NNc1ccc(S(=O)(=O)C(F)F)cc1)S(=O)(=O)c1ccccc1	728975288	JETAQSHJRVNYLP-UHFFFAOYSA-N	433.458	1.447	50	20	IDGD	
NC(=O)c1cccc(C(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)c1	729298847	VOSUGQWRFUYPIZ-UHFFFAOYSA-N	441.447	1.619	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)COc1ccc(Br)cc1)[C@H](C)N1CCOCC1	729624505	XIWHDWIANWLHMP-STQMWFEESA-N	429.315	1.268	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)CCNC(=O)N1CCc2ccccc2C1	732263616	IACSUVVFLZWORE-UHFFFAOYSA-N	425.489	1.413	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)o1	733004711	RUEGDLIFPHHOBQ-UHFFFAOYSA-N	426.882	1.862	50	20	IDGD	
C[C@H]1Oc2ccccc2O[C@H]1C(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	734824501	AQPNNDKBPWTOTL-CXAGYDPISA-N	434.493	1.945	50	20	IDGD	
O=C(NCC1Cc2ccccc2C1)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	735385673	JYLBHTQBNGYISA-UHFFFAOYSA-N	442.541	1.830	50	20	IDGD	
CCOc1ccccc1OS(=O)(=O)c1cccc(C(=O)NNC(=O)c2cnn(C)c2)c1	735446408	VSSJCSVYVYCPNL-UHFFFAOYSA-N	444.469	1.661	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)[C@H]1CCCN(C(=O)COc2ccccc2)C1	741172008	GKEMDZXUNYRXDM-OXJNMPFZSA-N	439.468	1.291	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)[C@@H]1COc2ccccc2O1)[C@@H]1CN(Cc2ccccc2)CCO1	741280947	KPFNEWKEIMAZNT-NDXORKPFSA-N	440.500	1.446	50	20	IDGD	
O=C(NNC(=O)c1cccc2ccccc12)c1cc(S(=O)(=O)N2CCSCC2)c[nH]1	741693257	ABGJFQIPICSUAU-UHFFFAOYSA-N	444.538	1.980	50	20	IDGD	
C[C@]1(C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)CCCN(C(=O)c2ccccc2)C1	741898211	LMEYSEDEZXKTEG-QFIPXVFZSA-N	443.525	1.794	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)[C@H](C)NC(=O)c1cc2c(C)nn(C)c2s1	742036086	DJBRLHUUUDPMQL-LBPRGKRZSA-N	439.501	1.479	50	20	IDGD	
O=C(CCCOc1cccnc1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	742468255	RBJHVCULNGUUDY-UHFFFAOYSA-N	432.502	1.486	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)[C@@H](C)n2nnc(-c3ccccc3)n2)c2ccccc2c1=O	742475014	SCCKYCPHRKHQGV-CQSZACIVSA-N	446.471	1.653	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)c1ccc(NC(=O)OCC(F)(F)F)cc1	742612882	NKIGYLBQEIJJAC-UHFFFAOYSA-N	428.323	1.581	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)N1CCCCCC1	743286343	YIWHTBJRJTVAGZ-KRWDZBQOSA-N	436.578	1.887	50	20	IDGD	
Cc1nc2ccccc2n1CCNC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	743516394	FSVYWBFYJVTZCP-UHFFFAOYSA-N	430.490	1.784	50	20	IDGD	
Cc1ccc(N2CCC[C@@H](NC(=O)NNC(=O)CNC(=O)c3cccs3)C2=O)cc1	743579343	QBUWYAGFVFZAQC-OAHLLOKOSA-N	429.502	1.312	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)c2ccc(N3CCCS3(=O)=O)cc2C)cn1	743823704	WFJHBPUGQDHPCB-UHFFFAOYSA-N	435.531	1.570	50	20	IDGD	
COC[C@@H](C)n1c(C)cc(/C=C(\C#N)C(=O)OCCNS(=O)(=O)c2cnn(C)c2)c1C	744459966	HISGBUOHGDKFOI-QANDDYDISA-N	449.533	1.475	50	20	IDGD	
C[C@@H](CC(=O)c1cccc(F)c1)C(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	745396164	GCCZFIJGHUCQQQ-LBPRGKRZSA-N	431.376	1.947	50	20	IDGD	
CCN1CCN(C[C@H](C)CNC(=O)NNC(=O)CCSc2ccc(F)cc2)CC1	745862471	JZBVMSZRWVEWAG-MRXNPFEDSA-N	425.574	1.912	50	20	IDGD	
Cc1nn(C)c(C)c1CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	745913549	PFRZCCCPGSYMLC-UHFFFAOYSA-N	448.549	1.356	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H]2C[C@](C)(OC)C2(C)C)c1	745932140	KMTBMEAEEOSCAY-UZLBHIALSA-N	440.566	1.865	50	20	IDGD	
O=C(NNC(=O)c1cc(S(=O)(=O)N2CCCC2)ccc1O)c1ccc2c(c1)OCCO2	745991498	VRGBMIXRCWVHDS-UHFFFAOYSA-N	447.469	1.023	50	20	IDGD	
NC(=O)CC[C@H](C(=O)NNC(=O)c1cccc(Cl)c1)N1C(=O)c2ccccc2C1=O	746094719	DCPVCEQOZNBKLZ-OAHLLOKOSA-N	428.832	1.031	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)Cc1csc(NC(=O)c2cccc(O)c2)n1	746885130	BCSFHKYPWBPPRU-UHFFFAOYSA-N	442.453	1.576	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)CN1CCN(C(=O)OCc2ccccc2)CC1	747348199	MACRTZIZYJUHON-UHFFFAOYSA-N	444.463	1.306	50	20	IDGD	
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC(=NNC(=O)Cc2cn3ccccc3n2)CC1	747638259	OLHJGCPMNVJEFM-UHFFFAOYSA-N	429.506	1.174	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)NCC(=O)Nc1ccc(Br)cc1C	748613945	FQQHJIYUBAFHNG-NSHDSACASA-N	431.287	1.078	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)N[C@H]1CCN(c2ccccc2Br)C1	748629009	CLNULRLAEZAADD-OLZOCXBDSA-N	429.315	1.410	50	20	IDGD	
NS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccc(Br)cc2F)cc1	749267524	FNYDMFIVJCCCST-UHFFFAOYSA-N	431.243	1.317	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)c2cc(S(=O)(=O)NC)oc2C)cc1	751297971	NWMTUWFQDAUOIA-GFCCVEGCSA-N	425.463	1.123	50	20	IDGD	
COc1ccc(C(=O)NNC(=S)N[C@H](C)C2CC2)cc1S(=O)(=O)NC(C)(C)C	751621130	QSNBMQVMJWEQIS-LLVKDONJSA-N	428.580	1.679	50	20	IDGD	
C[C@H]1C[C@@H](CNC(=O)OC(C)(C)C)CN1C(=O)NNC(=O)CNC(=O)c1cccs1	752153631	GBGNXIAUPZPPLN-STQMWFEESA-N	439.538	1.454	50	20	IDGD	
COC(=O)C[C@H]1CN(C(=O)CCC(=O)C(C#N)=C2N(C)c3ccccc3N2C)CCO1	752747364	KUWLPIWJNHDMGO-HNNXBMFYSA-N	426.473	1.448	50	20	IDGD	
CNC(=O)CCCN(C)C(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1	753042524	RWMNDUBACOKYFE-OAQYLSRUSA-N	437.544	1.812	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)NNC(=O)c2cc(C)nc3ccccc23)ccc1OC	754777782	QBGMJWRAZCLWPE-UHFFFAOYSA-N	428.470	1.535	50	20	IDGD	
O=C(CC12CC3CC(CC(C3)C1)C2)NNC(=O)Nc1ccn(CC(=O)N2CCOCC2)n1	756661134	YEHJEJGNGMAKGW-UHFFFAOYSA-N	444.536	1.501	50	20	IDGD	
CCC1(C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)CCCC1	756904437	DHUQCBYFFMEOOJ-UHFFFAOYSA-N	437.562	1.758	50	20	IDGD	
CC[C@H]1CN(CC(=O)NNC(=O)Cc2nc(C)cs2)CC[C@@H]1NC(=O)OC(C)(C)C	757110294	MJTVAMOIWRYPDG-GJZGRUSLSA-N	439.582	1.767	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)N[C@H]1CCN(C(=O)CCc2ccccc2)C1	757276759	XGFOGCLZBCKLIU-INIZCTEOSA-N	448.483	1.513	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)CN1C(=O)N[C@]2(C[C@@H](C)C[C@@H](C)C2)C1=O	757629186	QBBRIHWVEQTSTB-YEZVWNJWSA-N	430.505	1.522	50	20	IDGD	
C[C@@H]1C[C@@H](C)CC2(C1)NC(=O)N(CC(=O)NNC(=S)NCCc1cccs1)C2=O	757634625	WFMPPEZTJAFUBM-CHWSQXEVSA-N	437.591	1.533	50	20	IDGD	
Cn1[nH]cnc1=NC(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2Cl)c1	757760878	JSJBTYSYMUGIMX-UHFFFAOYSA-N	449.880	1.158	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccc(C(F)(F)F)nc2)c1	757792643	CTGHLJOHGVWJSQ-UHFFFAOYSA-N	431.396	1.817	50	20	IDGD	
C[C@@H](CC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1ccncc1	759038589	DSPYJLFZSLFQRP-HNNXBMFYSA-N	432.502	1.057	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)NCc1cn2cc(Br)cc(C)c2n1	760145827	ZRJRYCCYFGXGIV-LLVKDONJSA-N	428.287	1.287	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)C(=O)Nc2ccnn2Cc2ccc(F)cc2)c1	760279491	ALJLPRNQLWDETF-UHFFFAOYSA-N	431.449	1.556	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)c1csc(S(N)(=O)=O)c1	761415752	ORMZZFKPQQHMBK-QMMMGPOBSA-N	448.320	1.387	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NN=C3C(=O)Nc4cc(N(C)C)ccc43)CC2)cc1	761829569	UXGKQUSTEITQLG-UHFFFAOYSA-N	434.544	1.651	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)N[C@@H]2CC[C@@H]3SCCS[C@H]32)cc1	762636199	YKLTZPPUYCLGTB-RDBSUJKOSA-N	430.577	1.805	50	20	IDGD	
O=C(CCCC[C@@H]1SC[C@H]2NC(=O)N[C@@H]21)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	763175068	BBAWZGDOVDJMLA-RYRKJORJSA-N	446.508	1.703	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ccccc2)ccc1C	763431299	QCKVWSALEGADGA-UHFFFAOYSA-N	432.502	1.425	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)NC[C@@H](c1ccccc1)N1CCOCC1	763461130	ZFEAJEQKDWJATL-KRWDZBQOSA-N	430.530	1.888	50	20	IDGD	
C[C@@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3ccc4c(c3)OCO4)cc2)C[C@@H](C)O1	763548119	JLZNONAGNJLLEF-ZIAGYGMSSA-N	440.456	1.429	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(C)nn2[C@H]2C[C@H]3CC[C@H]2C3)cc1OC	763551342	VPBMVEWKGCUVIU-DZKIICNBSA-N	441.488	1.970	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2F)c2ccccc12	763567698	ALHZLNZPJCUUQY-UHFFFAOYSA-N	439.399	1.930	50	20	IDGD	
Cc1nn(CC(F)(F)F)c(C)c1CC(=O)NNC(=O)NCCNC(=O)OC(C)(C)C	763580512	OKZCIKBMFDILGM-UHFFFAOYSA-N	436.435	1.460	50	20	IDGD	
Cc1ccc(C)c(NC(=O)C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1	763797535	VHCDBLKIWFOGRL-UHFFFAOYSA-N	444.513	1.488	50	20	IDGD	
CCn1cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2c(C)cc(Cl)cc2C)ccc1=O	763884367	VNWYQNMATOMYNU-CYBMUJFWSA-N	434.880	1.692	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(NC(=O)C3CC3)nc2)cc1OC	763900164	BELZOOCQLMMKHY-UHFFFAOYSA-N	441.444	1.237	50	20	IDGD	
O=C(NNC(=O)c1ccc(Br)s1)C(=O)Nc1cnn(-c2ccccn2)c1	763939696	BXCVIYYNBAEBRZ-UHFFFAOYSA-N	435.263	1.491	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)C(=O)Nc1ccc2oc(C3CC3)nc2c1	763947878	CXKXFGAHOCHGTB-UHFFFAOYSA-N	446.423	1.996	50	20	IDGD	
Cc1nc2ccc(NC(=O)C(=O)NNC(=O)c3nn(-c4ccccc4)cc3O)cc2s1	763950026	RWQQQJMEFOCJGG-UHFFFAOYSA-N	436.453	1.896	50	20	IDGD	
CN(C)C(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)ccc1Cl	763978314	ICOZBPDPJZTNRC-UHFFFAOYSA-N	439.255	1.801	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)C(=O)Nc1cc(F)ccc1Oc1ccccc1	763999517	XMZUFPFOJIYAAH-GFCCVEGCSA-N	435.433	1.139	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2cccc(N3CCOC3=O)c2)cc1	764126528	IPAGPPVAFTXEMY-UHFFFAOYSA-N	426.429	1.371	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccccc1C(=O)N1CCCCC1	764132411	NRUAELFHMHKNRA-UHFFFAOYSA-N	438.484	1.650	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(Sc3nccn3C)cc2)c1O	764132855	RPJOSIQOCVQVTQ-UHFFFAOYSA-N	441.469	1.685	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccccc2O[C@@H](C)C#N)o1	764138625	GVLQPULWDPPXBY-AWEZNQCLSA-N	427.461	1.812	50	20	IDGD	
O=C1CCCc2cc(NC(=O)C(=O)NNC(=O)c3cccc(OC(F)F)c3)ccc2N1	764250810	NYFGFLZXJRGSSB-UHFFFAOYSA-N	432.383	1.963	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)C(=O)Nc1ccc(Cl)cc1I	764297598	DAEWBGRBVGQMSC-UHFFFAOYSA-N	447.620	1.376	50	20	IDGD	
CCc1ccc(NC(=O)C(=O)NNC(=O)[C@H](CC)c2ccccc2)cc1S(N)(=O)=O	764329438	MOHWGZNGPGPIHH-MRXNPFEDSA-N	432.502	1.176	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)nc(C)n3C)n[nH]1	764377862	RIQQJCFLAMORHY-UHFFFAOYSA-N	447.455	1.680	50	20	IDGD	
C[S@](=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)cc1F	764381945	CQBNLNLVVWIXQS-LJAQVGFWSA-N	435.462	1.414	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cccc(-n4cnnn4)c3)n[nH]2)cc1C	764389197	ZMZHGDSVDLJQDR-UHFFFAOYSA-N	445.443	1.069	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1cccc(-c2noc(C)n2)c1	764393051	NOMUMHBJJIAGCV-UHFFFAOYSA-N	441.469	1.932	50	20	IDGD	
COc1cc(OC)c(NC(=O)C(=O)NNC(=O)c2cncc(NC(C)=O)c2)cc1Cl	764432030	AJCJMOBVHQMFCE-UHFFFAOYSA-N	435.824	1.110	50	20	IDGD	
Cn1c(=O)c2c(ncn2CC(=O)NN=C(CCc2ccccc2)c2ccccc2)n(C)c1=O	764817189	JVPNZLMYFCAFGX-UHFFFAOYSA-N	444.495	1.587	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)[C@H](O)c3ccccc3Cl)cc2)CC1	765198743	NNVOMLZHWNDIAK-GOSISDBHSA-N	438.937	1.453	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)COc3ccccc3Cl)CC2)cc1	765753945	GCRLOXQEJPGVIG-UHFFFAOYSA-N	430.936	1.992	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)[C@@H]2CC(=O)N(c3ccc(Cl)c(F)c3)C2)C[C@@H](C)O1	767148480	VBJOECOMKZONBY-MGPQQGTHSA-N	440.903	1.479	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)[C@@H]1CC(=O)N(c2ccc(F)cc2F)C1	767282867	YVRDSSBBTAHXRE-OAHLLOKOSA-N	445.422	1.559	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)CCc1c(C)nc2c(C#N)cnn2c1C	768645044	KJSVHJXFQQULGW-UHFFFAOYSA-N	442.501	1.706	50	20	IDGD	
COc1ccc(Cl)cc1N1C[C@H](C(=O)NNC(=O)C(=O)Nc2ccc(C)cc2)CC1=O	769686042	WGSPHDSNHAYDET-CYBMUJFWSA-N	444.875	1.796	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)c2ccc(Br)s2)cn1	770212376	BZCXRZQFTMUTMZ-UHFFFAOYSA-N	433.309	1.231	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)N[C@@H]3CCN(Cc4ccccc4)C3=O)nc21	770369342	YKYKOUKSEKLUIU-OAHLLOKOSA-N	438.492	1.714	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2CC(=O)N(c3c(F)cccc3F)C2)c1	770645652	QGUMEPKVOHXPHE-GFCCVEGCSA-N	437.424	1.182	50	20	IDGD	
COc1ccc(C(=O)NCCCC(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)cc1	770955758	OMOAPEYXCGOWRP-UHFFFAOYSA-N	441.492	1.949	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1cccs1)C(=O)NNc1nc(-c2ccccn2)nc2c1CCC2	771026081	SBHWEOKZVUIVOM-GFCCVEGCSA-N	444.542	1.899	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)c1cccc(S(=O)(=O)N(C)C(C)C)c1	771860178	SLVXJONIUVXLTA-AWEZNQCLSA-N	427.523	1.454	50	20	IDGD	
COC(=O)C[C@@H]1CCCN1C(=O)NNC(=O)[C@H](C)Oc1cccc(Br)c1	771954761	RBWQIYBWDRSJSK-AAEUAGOBSA-N	428.283	1.985	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)[C@@H]1CC(=O)N(c2ccc(Cl)c(F)c2)C1	772235765	NRWZBEAIQRNFRK-NWDGAFQWSA-N	427.860	1.957	50	20	IDGD	
O=C(CCCC(=O)c1ccc(Br)cc1)NNC(=O)C(=O)Nc1ccccn1	772355220	KBEGWMZHHNSMRU-UHFFFAOYSA-N	433.262	1.983	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)c1cccc(CN2C(=O)CNC2=O)c1	772971246	YQPPIZDLONOEDS-GFCCVEGCSA-N	430.848	1.620	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NNC(=O)c2ccc(N3CCOCC3)cc2)C1	773421681	SPETYOQKQZBNLH-QGZVFWFLSA-N	432.521	1.931	50	20	IDGD	
NC(=O)CC[C@@H](NS(=O)(=O)c1cccc(C(F)(F)F)c1)C(=O)NNc1ccccn1	773621489	AUQDZEFDIHBLSK-CYBMUJFWSA-N	445.423	1.156	50	20	IDGD	
Cc1nccn1-c1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)cn1	774010202	VWTMAZWDWYYSIO-GFCCVEGCSA-N	442.863	1.783	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)N[C@@H](CNC(=O)OC(C)(C)C)C3CCCC3)nc21	775127216	YJQGFBVPXVPKPX-ZDUSSCGKSA-N	434.501	1.779	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)CN(C)C)c(C(=O)N2[C@H](C)CCC[C@H]2C)cc1OC	775481472	KOTMJYAZLCASCR-ZIAGYGMSSA-N	435.525	1.821	50	20	IDGD	
CCOc1cccc([C@@H]2C[C@@H]2NC(=O)NNC(=O)c2csc(N3CCOCC3)n2)c1	775715217	UNVQUAIJMOBVMZ-HOTGVXAUSA-N	431.518	1.879	50	20	IDGD	
Cc1ccc(S(=O)(=O)C[C@H](C)NC(=O)NNC(=O)COc2ccc(C#N)cc2)cc1	776197394	ZMDXKBZWUZDZJI-HNNXBMFYSA-N	430.486	1.438	50	20	IDGD	
CN(NC(=O)c1nn(-c2ccccc2)cc1O)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776202352	SCUWCOOEYAUTLA-UHFFFAOYSA-N	444.492	1.827	50	20	IDGD	
O=C(CO)NNC(=O)c1cccc(S(=O)(=O)Nc2ccc(Br)cc2)c1	777781797	KDLNROWYGDPJMB-UHFFFAOYSA-N	428.264	1.003	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNS(=O)(=O)c1cc(Br)cc(C#N)c1	777940053	VFPVWCDRQXMMSH-UHFFFAOYSA-N	433.284	1.155	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)NNC(=O)COc2ccccc2O)c2ccccc12	777992947	SCQNZEFETWZXHQ-UHFFFAOYSA-N	429.454	1.892	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)c1ccc(F)cc1I	778443273	OIQVVGUULWNYMD-UHFFFAOYSA-N	437.209	1.716	50	20	IDGD	
O=C(CSc1ccccc1O)NNS(=O)(=O)[C@H]1CCCN(C(=O)c2ccccc2)C1	779631479	IZINQQUZSKLGMJ-INIZCTEOSA-N	449.554	1.740	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1)c1ncn(C)n1	780689955	HFUIJDWGOVLMMD-NSHDSACASA-N	449.518	1.383	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)c2cc(S(=O)(=O)N3CCC[C@@H](C)C3)cn2C)c1	780802114	OMEICWGLVZAOFF-CQSZACIVSA-N	434.518	1.989	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1)C(=O)Nc1ccc(OC2COC2)cc1	782124008	KPLQBBODTUPMNZ-UHFFFAOYSA-N	439.403	1.393	50	20	IDGD	
CC(=O)N1CCN(C(=O)[C@@H](OC(=O)/C(C#N)=C\c2cc(C#N)n(C)c2C)C(C)C)CC1	782627730	JRECOFGITNOQEJ-JYWRCUDFSA-N	425.489	1.371	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C(=O)Nc2cccnc2N2CCCCC2)nc2ccccc21	782885863	LIRMSJRDLYUCDQ-UHFFFAOYSA-N	435.488	1.287	50	20	IDGD	
CN(C)CC(=O)Nc1ccc(NC(=O)C(=O)NN=c2sc3ccccc3n2C)cc1	783352102	XRYKTRKVIBARPF-UHFFFAOYSA-N	426.502	1.311	50	20	IDGD	
CCCS(=O)(=O)Nc1cccc(NC(=O)C(=O)NNc2ccc(Cl)nn2)c1C	784792651	UIXUGVQGOBMZIS-UHFFFAOYSA-N	426.886	1.672	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1ccc2c(c1)CCO2	784833901	RYYYVNXBXXALCN-UHFFFAOYSA-N	432.502	1.780	50	20	IDGD	
COc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NNc1cccc(C(F)(F)F)n1	784951795	UHQCQIQASQTEOB-UHFFFAOYSA-N	425.367	1.893	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2cc(F)cc(F)c2Br)n1	785990004	BNGYRVXHFPREMO-UHFFFAOYSA-N	430.209	1.327	50	20	IDGD	
CCc1c(C(=O)NNc2nccc(N3CCOCC3)n2)nnn1Cc1ccc(F)cc1	787900697	YWKZRWBMPBJHLK-UHFFFAOYSA-N	426.456	1.411	50	20	IDGD	
CC(C)c1cc(NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)n(-c2ncccn2)n1	789257839	LMTGZJOJHWNFNZ-UHFFFAOYSA-N	433.436	1.228	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)C(=O)Nc2nc(CC)cs2)c2ccccc2c1=O	789732399	OYGGDTKTLWFSPF-UHFFFAOYSA-N	442.501	1.615	50	20	IDGD	
Cn1nc([C@H]2CCCO2)cc1NC(=O)C(=O)NNC(=O)CCSc1ccc(F)cc1	789740940	KVUOQKSHXOQTAM-OAHLLOKOSA-N	435.481	1.679	50	20	IDGD	
O=C(NNS(=O)(=O)c1c(Cl)ccc(F)c1F)C1CCN(c2ncccn2)CC1	790052742	IPPAPUGXUPVTJR-UHFFFAOYSA-N	431.852	1.634	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)[C@@H]1CC(c2cccnc2)=NO1	790120287	CZEVHCUQRIWRIP-BZNIZROVSA-N	433.262	1.952	50	20	IDGD	
CSCC[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)NNc1nc2ccccn2n1	791240197	WANSOBPUYVQSRA-CQSZACIVSA-N	429.462	1.632	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1nnc(-c2ccc(Cl)cc2F)s1	791900893	VBIDNAOKKMEBIK-ZCFIWIBFSA-N	436.878	1.088	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)c2cc(NS(C)(=O)=O)cc(C(F)(F)F)c2)n1	792024003	YBMRBJGLMGCOQX-UHFFFAOYSA-N	433.412	1.351	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cc3ccccc3cc2O)cc(OC)c1OCC(N)=O	792520869	IYKBDSDGQFLISA-UHFFFAOYSA-N	439.424	1.502	50	20	IDGD	
Cc1ccn(-c2ccc(NC(=O)C(=O)NNC(=O)c3cnn(-c4ccccc4)c3)cc2)n1	793027005	USHZXDMJDKQHCH-UHFFFAOYSA-N	429.440	1.766	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)c2cc(S(=O)(=O)N3CCOCC3)ccc2Cl)n1	794084713	UUHOKQZYIDCTBZ-UHFFFAOYSA-N	438.893	1.139	50	20	IDGD	
COC[C@@H](CO)NC(=O)/C(C#N)=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	794144331	DUTZUEUJQUNEBE-XMCSSRMMSA-N	431.880	1.109	50	20	IDGD	
CC(=NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1)c1ccnc(F)c1	794920649	RPPTUTSJPSALOJ-UHFFFAOYSA-N	433.509	1.376	50	20	IDGD	
CCOC(=O)c1ccc(F)c(S(=O)(=O)NNC(=O)c2nnc(-c3ccccc3)o2)c1	795303471	PFVDIPURCDROOF-UHFFFAOYSA-N	434.405	1.676	50	20	IDGD	
CCOC(=O)c1ccc(F)c(S(=O)(=O)NNC(=O)CSc2ccccc2O)c1	795902979	VMLUBEMMICTWAU-UHFFFAOYSA-N	428.463	1.810	50	20	IDGD	
COC(=O)[C@H](C)S(=O)(=O)NC(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccccc1	797282551	HLBXRNSMYKNKNU-LUYJPIOASA-N	441.469	1.378	50	20	IDGD	
CCCCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(C)n2)cc1	797370543	FMQWVHFIMHDVQJ-UHFFFAOYSA-N	433.490	1.332	50	20	IDGD	
C=CCNC(=S)NNC(=O)[C@@H]1Cc2ccccc2CN1S(=O)(=O)c1ccc(F)cc1	798304457	STCRSJRVBZQJAR-SFHVURJKSA-N	448.545	1.623	50	20	IDGD	
CC(=NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1ccc(N)c([N+](=O)[O-])c1	799105157	NHYFKQRHMINGBR-UHFFFAOYSA-N	447.473	1.352	50	20	IDGD	
CCOC(=O)[C@@]1(COC)CCCN(CC(=O)NNC(=O)c2cc(C)c(CC)s2)C1	799198255	FASXBXMBQCBONA-FQEVSTJZSA-N	425.551	1.672	50	20	IDGD	
N#Cc1cc(NC(=O)C(=O)NNc2ccc(-n3cccn3)nn2)ccc1OC(F)(F)F	799836132	XYXLYTRVNYWQFX-UHFFFAOYSA-N	432.322	1.514	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)c1nnn(CCOc2ccc(F)cc2)c1C	800323676	ZDFZMMMYCLWXIW-UHFFFAOYSA-N	443.435	1.653	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1ccnc(OCc2ccccc2)c1	800622691	OYLIAHJMJKWRCJ-UHFFFAOYSA-N	435.396	1.969	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCCCN2C(=O)c3ccccc3C2=O)cc1OC	804891478	CLWJPVXROFSOMU-UHFFFAOYSA-N	426.429	1.334	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)NCC(=O)NNc2nccnc2C2CCC2)cc1	805462180	BBYSHEUADFEBRJ-UHFFFAOYSA-N	433.490	1.342	50	20	IDGD	
CCN(C)C(=O)c1cccc(NC(=O)C(=O)NNC(=O)COc2ccc(C)c(C)c2)c1	806973226	FSMAPXXHRJLWGU-UHFFFAOYSA-N	426.473	1.560	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2cccc(Cl)c2OCC(F)F)CCS(=O)(=O)C1	807000721	HMJSAEUWVSOZJF-OAHLLOKOSA-N	425.841	1.120	50	20	IDGD	
O=C(NNS(=O)(=O)c1c(F)cccc1OC(F)(F)F)c1cc([N+](=O)[O-])ccc1O	808096256	FIXYYBBFXATYDX-UHFFFAOYSA-N	439.299	1.961	50	20	IDGD	
CCN(C)C(=O)c1cccc(S(=O)(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)c1	808100621	KPZVDHAZDYKPIR-UHFFFAOYSA-N	442.538	1.393	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CNS(=O)(=O)c2c(Cl)cccc2Cl)c(O)c1	810172757	OQVRITKOLZPQKV-UHFFFAOYSA-N	432.285	1.747	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)c1nnc2ccccc2n1	810593991	PJFJAWNQIIQUAE-UHFFFAOYSA-N	439.907	1.257	50	20	IDGD	
O=C(COC(=O)c1ccc2c(c1)CCCCC2=O)NNC(=O)[C@@H]1COc2ccccc2O1	811421479	LRQIFVNTELEGNR-FQEVSTJZSA-N	438.436	1.740	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NN=C[C@H]1CCOC1)N(S(C)(=O)=O)CC2	812438776	PVTJOSOTXLSYOQ-CJNGLKHVSA-N	425.507	1.091	50	20	IDGD	
CCn1ccnc1C(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2OC)c1	813363034	BHRTZCBJXZLBKZ-UHFFFAOYSA-N	443.485	1.787	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCc2nncn2C1)c1ccccc1NS(=O)(=O)c1cccs1	814255436	OCITUSIUYULJQB-LBPRGKRZSA-N	446.514	1.164	50	20	IDGD	
COC(=O)C(C)(C)c1csc(NC(=O)C(=O)NNC(=O)CCOc2ccccc2)n1	815568397	GHWJBNJGGGHULA-UHFFFAOYSA-N	434.474	1.149	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNc2cccc(Cl)n2)cc1OC	815725863	DTUNJIAXKLMUJE-UHFFFAOYSA-N	427.870	1.587	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)CN2C(=O)N[C@@](C)(C3CC3)C2=O)c1	816717599	JDTDVXNTBAODDT-KRWDZBQOSA-N	439.266	1.399	50	20	IDGD	
CCN(CC)C(=O)N1CCC(C(=O)NNc2ccccc2S(=O)(=O)N(C)C)CC1	817054642	RHMFLSTVLWTCCE-UHFFFAOYSA-N	425.555	1.554	50	20	IDGD	
CCC1(CC)NC(=O)N(CC(=O)NNc2cc(C(=O)OC)ccc2Br)C1=O	818750373	ISIKILOJTLHLPU-UHFFFAOYSA-N	441.282	1.789	50	20	IDGD	
CCn1c(NNC(=O)CNC(=O)c2ccc(OC)c([N+](=O)[O-])c2)nc2ccccc2c1=O	823905486	YMGAGDBQWFAXPU-UHFFFAOYSA-N	440.416	1.206	50	20	IDGD	
CSC[C@H](C(=O)NNC(=O)COc1ccc(F)cc1)N1C(=O)[C@H]2CCCC[C@@H]2C1=O	910865618	WYNGJOISGFUNCR-HRCADAONSA-N	437.493	1.259	50	20	IDGD	
CCCn1c(C)cc(/C=C(/C#N)C(=O)N(CC)CC(=O)N[C@@H]2CCS(=O)(=O)C2)c1C	912663585	JUGPCUKJIVQCHC-ZYNFKGNASA-N	434.562	1.574	50	20	IDGD	
CC(C)C[C@H](C(=O)NNC(=O)Cn1cnc2ccccc21)N1C(=O)[C@H]2CC=CC[C@H]2C1=O	913496620	CCVMDYCKYKOVDS-JTDSTZFVSA-N	437.500	1.550	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)CN1C(=O)N[C@@]2(CCCC[C@H]2C)C1=O	915775815	PHMJQUQLOLXUIW-JLCFBVMHSA-N	440.504	1.247	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C2=NN(Cc3ccc(F)cc3)C(=O)CC2)cc1OC	915874631	RJZXKYZDDGBKGK-UHFFFAOYSA-N	428.420	1.783	50	20	IDGD	
CCOc1ccccc1OCC(=O)NN=C(C)c1ccc(S(=O)(=O)NCC(=O)O)cc1	916301373	IEFLPEGYZSJPTK-UHFFFAOYSA-N	449.485	1.367	50	20	IDGD	
COc1cc(OC)cc(C(=O)NN=Cc2c(C)nn([C@H]3CCS(=O)(=O)C3)c2Cl)c1	916312872	UBPYDWCLICQAEV-ZDUSSCGKSA-N	440.909	1.986	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NC2CCN(Cc3ccccn3)CC2)cc(OC)c1OC	916382600	QPHHXJBLMSNWLQ-UHFFFAOYSA-N	443.504	1.716	50	20	IDGD	
C[C@H]1CCCCN1[C@H](C)CNC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	916446915	DGQBXASUKSZGQP-VQTJNVASSA-N	430.597	1.792	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NN=Cc1c(C)nn([C@H]2CCS(=O)(=O)C2)c1C	917027753	MNLNTPSPYYZVIY-INIZCTEOSA-N	442.545	1.922	50	20	IDGD	
C=CCNS(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(-c3ccc(C)cc3)[nH]n2)c1	917177993	CGSUNFHFBTVPBL-UHFFFAOYSA-N	439.497	1.924	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)CCn3c(=O)nc(O)c4ccccc43)n[nH]2)cc1	917178126	MHBXMDQIQQCJTR-UHFFFAOYSA-N	432.440	1.652	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)CCn2cc(Br)cn2)c2ccccc2c1=O	917564742	GSKFSPPATONCOB-UHFFFAOYSA-N	447.293	1.617	50	20	IDGD	
CCCCS(=O)(=O)N1CCC[C@H]1C(=O)NNC(=O)c1ccc(OC(C)C)c(OC)c1	918689545	XAHWZRMSICBBCC-INIZCTEOSA-N	441.550	1.838	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)OCC(=O)N2CCN(C(=O)C3CC3)CC2)c1C	918809744	JTLXZDGYCGXYEE-DEDYPNTBSA-N	442.516	1.282	50	20	IDGD	
O=C(COC(=O)c1cnn(-c2ccccn2)c1C(F)(F)F)NNC(=O)c1ccccc1	919123729	BYGKGIXOPDBGDR-UHFFFAOYSA-N	433.346	1.904	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)CN(C)C(=O)c2ccc(Br)o2)cc1	919835936	WRCQUGAJJUYUQK-UHFFFAOYSA-N	438.278	1.903	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)c1ccc(NC(=O)c2ccc(O)nc2)cc1	1116187645	RHZLVBVRLFOIBV-UHFFFAOYSA-N	430.424	1.691	50	20	IDGD	
Cc1c(C(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)cnn1C1CCOCC1	1116432142	PMAXZPLQQXPRCA-UHFFFAOYSA-N	435.525	1.951	50	20	IDGD	
N#Cc1ccc(N2C[C@@H](C(=O)NNc3ccc(S(=O)(=O)NC4CC4)cc3)CC2=O)cc1	1251585729	FXZSOYVROPOVKE-HNNXBMFYSA-N	439.497	1.495	50	20	IDGD	
O=C(CN1C(=O)N[C@@]2(CCc3ccccc32)C1=O)NNc1cncc(Br)c1	1320252691	UNAGLNHFGLSIDZ-GOSISDBHSA-N	430.262	1.681	50	20	IDGD	
CCOC(=O)c1ccc(C(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)nc1C	1328653309	KGBAGZYPMZVDBX-UHFFFAOYSA-N	434.493	1.975	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(CNC(=O)NNc2ccc(C(C)(C)C)nn2)cc1	1328714323	HSIUPBJKWHBNHY-UHFFFAOYSA-N	436.538	1.525	50	20	IDGD	
CC(=O)N(C)[C@@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)Br)C2	1778107206	DAAWYTPFUYYOQK-FHKFTOANSA-N	432.359	1.151	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4c(c3)CC(=O)N4)C2)C1	1778391837	DDHQYCXPHYKTIC-BLVKFPJESA-N	436.306	1.408	50	20	IDGD	
O=C(/C=N/O[C@@H]1CCCCO1)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1779104699	FXSOBVGMPJWPFR-LMHHVVARSA-N	436.278	1.036	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cnc3ccc(F)cn13)CCO2	1779299431	TXGQFEUKVAGDLN-FQEVSTJZSA-N	434.544	1.768	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](C)NC(=O)c1ccc(F)cc1)CCO2	1781218280	OMHUQYJPMYOSMT-XXHMAFKTSA-N	439.915	1.791	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cccc(N4CCOCC4)n3)CCO2)C1	1781219234	SSGVFHOETPXCKM-IERDGZPVSA-N	436.940	1.379	50	20	IDGD	
COC(=O)[C@@H]1CC[C@H](C(=O)N2CCO[C@@]3(CCN(C(=O)[C@](C)(Cl)CCl)C3)C2)C1	1781225581	MZIYVJBTXVDSFO-RAKLQZGLSA-N	435.348	1.642	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)c3cc4cn[nH]c4cn3)CCO2)C1	1781229246	AYPDJBXYPZPRLY-ROUUACIJSA-N	426.304	1.638	50	20	IDGD	
CC(=O)N[C@H](C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1)C(C)(C)C	1781324996	HKEMSIPWNFBRAT-IGCXYCKISA-N	436.322	1.058	50	20	IDGD	
CC(C)Cc1cc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](F)Br)C3)C2)n(C)n1	1781331264	NCRGSKKUOJKQJL-YJBOKZPZSA-N	445.333	1.753	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)n[nH]1)C2	1781900838	ULHXUKANQBXWOT-CJBNDPTMSA-N	429.315	1.416	50	20	IDGD	
Cc1[nH]nc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](C)Br)C2)c1F	1781996860	WFIRLIJJIULRQG-ILMHXZGMSA-N	431.306	1.768	50	20	IDGD	
COC(=O)C1(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](C)Br)C2)CC1	1782002129	MTELLJDOSBNHLD-PBFPGSCMSA-N	431.327	1.237	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CC1CCN(C)CC1)C2	1782167350	MCDQYVXZEADXHH-DBXWQHBBSA-N	429.989	1.486	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1snnc1C1CC1)C2	1782172537	GFRYVGQZVHVOSK-IQUTYRLHSA-N	442.969	1.797	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)Nc1cnccn1)C2	1782176023	URUPTVSLWHMHGO-AXHMDWHKSA-N	439.944	1.045	50	20	IDGD	
CSCC[C@@H](O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Br)C2	1782232270	DXAWIKVRGKNDKT-BRXULGCHSA-N	441.363	1.305	50	20	IDGD	
C#CC(=O)N1CCO[C@@]2(CCN(C(=O)/C(C#N)=C/c3ccc(Br)cc3)C2)C1	1782869912	LIXGITAFTVOIMW-PRDNPTHXSA-N	428.286	1.819	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(CCN(C(=O)[C@H]3C[C@@H]3F)C2)C1	1782934335	CFWJAZJEAKUOHN-UVFQYZLESA-N	435.408	1.322	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3nc4cc(C)c(C)cc4[nH]3)CCO2)C1	1783877454	IZOIEDVSTZVDNN-QVKFZJNVSA-N	434.924	1.877	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(CCN(C(=O)[C@H]3CCc4nc[nH]c4C3)C2)C1	1784346410	WYKRFMIGBPDZEX-UGSOOPFHSA-N	425.327	1.130	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)ccc3O)C[C@@H]21	1786407044	CRDYNVMSESWDCI-PJODQICGSA-N	427.295	1.476	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4c(c3)CC(=O)N4)[C@H]2C1	1788263816	XAVUIKCIKSPOJP-SCNOPHJPSA-N	435.908	1.028	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1ccc(C2(NC(=O)CCc3cnc[nH]3)CCC2)cc1	1789521344	YNDZBTSJJDDVAK-UHFFFAOYSA-N	447.499	1.789	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(Cl)nn3)C[C@@H]21	1790960309	ACPBIJUUTUGQID-MNXVOIDGSA-N	445.745	1.897	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3Cc4ccccc4O3)C[C@@H]21	1791055946	KXVFEVLFTXTPSN-FUXXODJASA-N	437.334	1.753	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/c3cnc(C)s3)C[C@@H]21	1791256028	CZNPAWDFBIODBU-KOJYPYIBSA-N	427.954	1.698	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1ccc(C2(NC(=O)c3cc(=O)n4[nH]cnc4n3)CCC2)cc1	1791568094	VIKSCGOSNPASNJ-CQSZACIVSA-N	444.879	1.419	50	20	IDGD	
CSCC[C@H](O)C(=O)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1	1791616300	LKJSUJSXLMAGGP-IBGZPJMESA-N	442.346	1.228	50	20	IDGD	
CC(C)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CC(c3ccccc3)=NN1)C2	1792784671	OJFXLQXGLHSYKC-NBMJBFSESA-N	432.952	1.607	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c[nH]c3cccc(Cl)c13)C2)[C@H](O)CCl	1792981396	KTMOGEIJGFTGJB-VODVUFLWSA-N	426.300	1.624	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nc(OC)ccc1[N+](=O)[O-])C2	1793449948	VCSHBWYXSXBAJY-ZWUHOBOKSA-N	440.884	1.609	50	20	IDGD	
COC(C)(C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1793880125	UVOIJGVCOUJWBJ-XGUBFFRZSA-N	447.960	1.133	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)Nc1cccnc1	1795610920	HRGVIDKGPKYZPB-CTTHAOKLSA-N	439.354	1.645	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2)c1nc2ccc(C(F)(F)F)cn2n1	1795969521	NNMFLMCEDKAVME-FQPOAREZSA-N	449.792	1.486	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnc2ncccn12	1797028536	PECFEPBOIXTMCR-JPVZDGGYSA-N	426.304	1.169	50	20	IDGD	
Cc1cccn2ncc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)CO[Si](C)(C)C)c12	1797957517	UQNASBFOXMBSDQ-HGKCTWBKSA-N	430.581	1.697	50	20	IDGD	
Cc1cc(C(N)=O)cc(C)c1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCC(=O)NN(C)C)C2	1798426193	XJHPRZNOFHJPFA-BCDXTJNWSA-N	443.548	1.027	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CNc3ccccc31)C2)[C@@H](F)Br	1799346441	QRHUIOXBVFQNEM-AREYPJKDSA-N	426.286	1.476	50	20	IDGD	
CC(C)(CCl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1cn2c(nc1=O)SCC2	1799838950	GQHVTQDWYMGHEC-QDMKHBRRSA-N	438.981	1.795	50	20	IDGD	
COc1ncc(Cl)cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)Br	1800754531	QXUGSIPLAPLOGN-DYNIEEOBSA-N	446.729	1.730	50	20	IDGD	
C[C@@H](Sc1ccccn1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2	1801314289	NAFOLOYIDQBUMV-VWPFQQQWSA-N	442.379	1.937	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@](O)(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](F)Cl)C3)C1	1802413451	NNQASKYHQPPKMM-QEAYJNAZSA-N	433.908	1.531	50	20	IDGD	
Cn1cnc(C(=O)NC[C@@H]2CCN(C(=O)[C@@](C)(Cl)CCl)[C@H]2c2cccnc2)n1	1805327632	XUYGNWXLWOIDHN-DEYYWGMASA-N	425.320	1.766	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)s1	1807363698	PPWPKVMVMBRKLD-NQIIRXRSSA-N	449.341	1.765	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)CN2CCN(C(C)=O)CC2)[C@H]1c1cccnc1	1808264728	BXIUZXIOTQGMEG-DYXWJJEUSA-N	449.983	1.269	50	20	IDGD	
Cc1cnn(CC(=O)N2CC[C@H](CNC(=O)[C@H](F)Br)[C@H]2c2cccnc2)c1	1808662887	SKRWQWQPCVKGPO-OIISXLGYSA-N	438.301	1.983	50	20	IDGD	
C[C@@H](C(=O)N1CCCC2(CCN(C(=O)CCC(=O)NN(C)C)CC2)C1)n1cccc1C=O	1810003879	PJYQRLSAHRXRIW-SFHVURJKSA-N	445.564	1.466	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@H](CNC(=O)c2n[nH]cc2[N+](=O)[O-])[C@@H]1c1cccnc1	1810640855	VQJHKEOJBQMXPW-KSSFIOAISA-N	446.540	1.884	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC2(CCCN(C(=O)c3nccc4[nH]ccc34)C2)CC1	1810649144	SYPFNSYROUASIS-UHFFFAOYSA-N	446.316	1.401	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)CCC(N)=O)[C@H]1c1cccnc1	1812634731	ZFWBCCYXLXMRBC-GRDNDAEWSA-N	425.327	1.526	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2ccc3nncn3c2)[C@@H]1c1cccnc1	1813030686	LJVWXPCHPNCQKN-HHXXYDBFSA-N	442.907	1.698	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)CSCC(=O)O)[C@H]1c1cccnc1	1813088365	BCHAZFZDEOIVRM-JKIFEVAISA-N	429.926	1.159	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)[C@H](O)CCl)n[nH]2)cc1O	1814874738	CCTQZCVJYQPEOX-NVXWUHKLSA-N	449.895	1.979	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cnc(O)nc2O)[nH]n1)[C@@H](F)Br	1820932960	WKZJJDRIVQNQDS-MWLCHTKSSA-N	443.233	1.607	50	20	IDGD	
CCN(CC)C[C@H](C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1	1821680138	OEGIXWLFKIPROW-WMZOPIPTSA-N	449.600	1.753	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](F)Br)CC2)c1cc(CO)on1	1821704144	OJEJVEBIPPIVHA-UPONEAKYSA-N	433.259	1.540	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN2CCSCC2)[nH]n1	1822367129	NOKVGEKYPZMRJR-HIFRSBDPSA-N	429.974	1.704	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccncc2O)[nH]n1	1822414626	JFQKSPMFEXQZCF-HNNXBMFYSA-N	429.481	1.189	50	20	IDGD	
O=C(NCC(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)CC1)c1ccco1	1824182178	VPSFVDBPRBMQOB-HOTGVXAUSA-N	425.913	1.229	50	20	IDGD	
O=C(CN1C(=O)CSC1=S)N1CCC([C@@H]2CCCCN2C(=O)[C@H](O)CCl)CC1	1824186710	AVVQSZUHUFIUFJ-UONOGXRCSA-N	448.010	1.066	50	20	IDGD	
C[C@@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1)n1ccnc1	1824316780	FMUKJPVAIGKCTC-PKOBYXMFSA-N	432.569	1.437	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(O)n[nH]1)CC2	1825447437	XBHFNNGAFBVWBN-YUMQZZPRSA-N	428.312	1.971	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)c2cscn2)CC1	1825985958	JZPTUZZBQMQUMC-IBGZPJMESA-N	427.335	1.370	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccnc(F)c1)CC2	1826082933	GPWUYFNTTTWNGD-GFCCVEGCSA-N	434.497	1.276	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)Cc2cccnc2)CC1	1827205354	JUFQHNHRFUMQDG-HXUWFJFHSA-N	429.565	1.617	50	20	IDGD	
CCOCCC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1	1828925569	LSCTZNIYTMTAPC-IBGZPJMESA-N	431.537	1.345	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H](O)N2CCOCC2)CC1	1829102636	BQYYGEDFGYKACT-NQIIRXRSSA-N	441.645	1.108	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)CC(F)(F)F)C2)C1	1830537357	DXKLKBOBRKBDOF-SMDDNHRTSA-N	431.249	1.426	50	20	IDGD	
C=CCOCCCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1	1831412050	BGOZYQWLYHUOCR-RBUKOAKNSA-N	437.364	1.662	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc([N+](=O)[O-])o3)C2)C1	1831639145	MMHOHQPNVYAVJR-UGSOOPFHSA-N	429.857	1.665	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)[C@H]2CCCSC2)CC1	1832856365	NAUSIVFBHDYXHQ-PZJWPPBQSA-N	444.406	1.743	50	20	IDGD	
C[C@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)C3CN(C)C3)CC2)CC1	1833266130	RDPIARGEZZVFBU-CQSZACIVSA-N	429.403	1.151	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cncc4cnccc34)CC2)CC1)[C@H](O)CCl	1833312531	QKVKDTCRNHOABK-HXUWFJFHSA-N	445.951	1.415	50	20	IDGD	
C#CCO[C@@H](C)C(=O)NC1CCN(C2CCN(C(=O)[C@H](Br)CC)CC2)CC1	1833469325	QOVUJZHRVNBGCW-MAUKXSAKSA-N	442.398	1.770	50	20	IDGD	
CCn1nccc1C(=O)N1CCC(N2CCC(NC(=O)CCBr)CC2)CC1	1834421183	OEVSBGPTMKPTQM-UHFFFAOYSA-N	440.386	1.873	50	20	IDGD	
O=C(CCN1CCCCC1)NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1834528431	ZMNQBKCRLVLYKF-IBGZPJMESA-N	429.005	1.034	50	20	IDGD	
C[C@@H]1CC[C@H](C(=O)NC2CCN(C3CCN(C(=O)CCBr)CC3)CC2)O1	1835464349	AEHWRJISEUHLDE-RHSMWYFYSA-N	430.387	1.911	50	20	IDGD	
Cc1ccn2ncc(C(=O)N3CCC(OC4CCN(C(=O)[C@@H](O)CCl)CC4)CC3)c2c1	1836718416	XHCWQAMAUSPHDN-FQEVSTJZSA-N	448.951	1.855	50	20	IDGD	
O=C(c1cc2sccc2s1)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1	1836857190	BYYAJBWQUJMADN-KZULUSFZSA-N	444.962	1.633	50	20	IDGD	
COc1cc(C(=O)N2CCC(OC3CCN(C(=O)C(Cl)Cl)CC3)CC2)nn1C	1838561925	JFNOSGNEGSIHAR-UHFFFAOYSA-N	433.336	1.845	50	20	IDGD	
O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(F)c1)CCO2	1838910109	UUAYUYQUKKGWDJ-GOSISDBHSA-N	429.286	1.681	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(NC(C)=O)cc3)C2)C1	1839148645	FIYBCHHYVQJVOH-GHTZIAJQSA-N	437.924	1.732	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(=O)c3ccccc3)C2)C1	1840031956	HRGHVRAMQUZMQC-LIRRHRJNSA-N	439.306	1.109	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4cc(C)ccc4[nH]3)C2)C1	1840152814	UVKDOCNTXIFQRB-JTSKRJEESA-N	449.935	1.800	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(OC)cc3)C2)C1	1840153804	AXKWCRXHQZTNQZ-FXAWDEMLSA-N	426.897	1.019	50	20	IDGD	
COc1ccccc1CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840187134	XMGUJAYBAMXYHP-HXUWFJFHSA-N	445.343	1.888	50	20	IDGD	
C[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1)c1ccccn1	1840503930	PHSIEEBNJVGJSJ-RYGJVYDSSA-N	444.359	1.878	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)N2CC3(CCCN3C(=O)[C@@H](O)CCl)C2)CC1	1841351362	MKGJRKIPOBBPNJ-HOTGVXAUSA-N	443.972	1.827	50	20	IDGD	
COC(OC)C(=O)N1CCCC12CN(C(=O)[C@H](Br)Cc1ccccc1)C2	1841488156	XXRBIYLDNXULCC-OAHLLOKOSA-N	425.323	1.815	50	20	IDGD	
O=C(c1nc(-c2ccccc2)ns1)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843010982	BYXWXJZXTCFKPL-UHFFFAOYSA-N	448.313	1.016	50	20	IDGD	
O=C(c1c(Cl)cccc1Cl)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843014567	ZPUDJVSHDZLPMD-UHFFFAOYSA-N	433.100	1.804	50	20	IDGD	
O=C([C@@H](O)CCl)N1CC2(CCCN2C(=O)c2n[nH]c3ccc(Br)cc23)C1	1843262233	RSRDFHIKCXJIFP-ZDUSSCGKSA-N	441.713	1.742	50	20	IDGD	
Cn1ncc(I)c1C(=O)N1CC2(CCCN2C(=O)[C@@H](F)Cl)C1	1843364055	OCHFWOOYCGSGOP-SNVBAGLBSA-N	440.644	1.376	50	20	IDGD	
CC(=O)C[C@H](C)C(=O)N1CC2(CCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)C1	1845039319	FGAGCABCRGMQRG-KRWDZBQOSA-N	443.548	1.151	50	20	IDGD	
COC(=O)c1ccc(CC(=O)N2CC3(CCCN3C(=O)[C@H](F)Br)C2)s1	1845219054	SMMSWLQRFGMMAZ-ZDUSSCGKSA-N	433.299	1.971	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)C2(c3ccc(Cl)cc3)CC2)C1	1845916641	ZBBJCFSECBXDON-UHFFFAOYSA-N	438.720	1.569	50	20	IDGD	
C[C@@H](CC(N)=O)C(=O)N1CC2(CCCN2C(=O)[C@H](Br)Cc2ccccc2)C1	1845940583	YJIPSOUVIGYFGU-GOEBONIOSA-N	436.350	1.708	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC12CN(C(=O)[C@H]1CC[C@@H]3CCC(=O)N3C1)C2	1846071975	ZKSYQOSYROIORM-ZNMIVQPWSA-N	426.355	1.764	50	20	IDGD	
O=C(NCc1ccc(Cn2cccn2)cc1)NNC(=O)c1csc(N2CCOCC2)n1	9790395	FHWQOJYGPLMXIE-UHFFFAOYSA-N	441.517	1.369	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)NC3CC3)c2)cc1OC	12696731	UKXAJOZUKYWPDL-UHFFFAOYSA-N	447.513	2.000	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)c2ccc3c(c2)CCN3S(C)(=O)=O)cc1OC	14936245	ZUAGXQOAYKZMHF-UHFFFAOYSA-N	447.513	1.881	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2nc(Cl)ccc2Cl)cc1	15709768	UHWTVXWVWAHLPZ-UHFFFAOYSA-N	431.301	1.779	50	20	IDGD	
O=C(CCN1C(=O)CCC1=O)NNC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1	20911628	HKYIIQTWKHWXBW-UHFFFAOYSA-N	432.440	1.234	50	20	IDGD	
COc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NNC(=O)c2ccc(Cl)cc2OC)cc1	24630875	VTYDVVBULRXJIT-NSHDSACASA-N	441.893	1.485	50	20	IDGD	
C[C@@H]1CCCC[C@]12NC(=O)N(CC(=O)NNC(=O)c1cc(-c3ccccc3)on1)C2=O	28792812	BTSWNCMCQWLISQ-ASSNKEHSSA-N	425.445	1.603	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NN=Cc3ccccc3[N+](=O)[O-])CC2)cc1	254392572	RNDARPDABDYPSW-UHFFFAOYSA-N	445.501	1.360	50	20	IDGD	
Cc1cccc2c(=O)n(CC(=O)NNc3ccc(S(=O)(=O)NC4CC4)cc3)cnc12	726862590	VLSFFZYYUUSRDM-UHFFFAOYSA-N	427.486	1.289	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N2CCCO[C@@H](C)C2)cc1	727400023	SNACCCKXZXDBRE-JIHKLPAASA-N	437.500	1.978	50	20	IDGD	
CCNS(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(F)ccc2Br)c1	728550751	FHCRTBNKLLKKGR-UHFFFAOYSA-N	444.282	1.961	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)Cc2ccc(S(N)(=O)=O)cc2)c1	728612078	KBMINJNUQSSHOJ-UHFFFAOYSA-N	442.291	1.109	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)c1cc(S(C)(=O)=O)ccc1Br	728815932	DPBUBKAVDPDMNM-UHFFFAOYSA-N	441.303	1.865	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)CN1C(=O)c2ccc(Br)cc2C1=O	730034216	CCESMKYXYZAYFC-UHFFFAOYSA-N	446.257	1.531	50	20	IDGD	
O=C(NCCCCN1CCN(c2ncccn2)CC1)NNC(=O)c1cccc2ncccc12	730126727	ROJQAOFAWLUGKK-UHFFFAOYSA-N	448.531	1.571	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)N1CCC[C@H](CN2CCN(c3ccccn3)CC2)C1	731849619	AQNBPZWUEKSPGK-VQTJNVASSA-N	430.597	1.498	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)ccc1=O	732055697	VQCYRIDZFFKVMH-UHFFFAOYSA-N	444.455	1.040	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)N[C@H](Cc1ccccc1)CN1CCOCC1	732476280	CPFVLONUOVFZQU-OAQYLSRUSA-N	440.544	1.902	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)[C@H](C)Oc2ccccc2Br)C[C@@H](C)O1	732828909	WJTKJXZSBKZBIE-MJBXVCDLSA-N	428.327	1.863	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)N[C@@H]2CCN(CCN3CCOCC3)C2)c1C	734467999	NTGRJDIJTVEZFF-PHCAOYFPSA-N	429.565	1.181	50	20	IDGD	
C[S@](=O)CCNC(=O)/C(C#N)=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	735045865	KQTRPYZTOHRCAA-LVPXNJDFSA-N	433.921	1.481	50	20	IDGD	
CCOc1ccc(CCC(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)cc1	735117307	QAKMEWFYHKEPQY-UHFFFAOYSA-N	447.561	1.492	50	20	IDGD	
C[C@@H](CN1CCN(c2ccccn2)CC1)NC(=O)NNC(=O)c1cccc(OC(F)F)c1	735518830	MOIJMJJENVQYRB-HNNXBMFYSA-N	448.474	1.838	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)Cc2ccc(S(=O)(=O)CC(F)(F)F)cc2)c1	736479075	OTJRTTWCIWKADH-UHFFFAOYSA-N	425.388	1.898	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)COc2ccc3c(c2)CCC(=O)N3)cc1C	736770881	JSQFDKMZNGSNLD-UHFFFAOYSA-N	445.497	1.887	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2cc(O)nc3ccc(F)cc23)ccc1Cl	737765203	BTMRKQNDJGMDAW-UHFFFAOYSA-N	438.824	1.455	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNc3ncnc4[nH]cnc34)c2)cc1	740746787	NHZVOCNMVUIHMY-UHFFFAOYSA-N	439.457	1.919	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)c2cc(=O)n(-c3nc(C)cc(C)n3)[nH]2)cc1OC	741741306	UKEXVCPRIBHQKS-UHFFFAOYSA-N	440.460	1.445	50	20	IDGD	
CC(C)c1nn([C@H]2CCS(=O)(=O)C2)cc1C(=O)NNC(=O)c1ccc(Cl)nc1	742549156	SDIUSBNCXRVSLQ-LBPRGKRZSA-N	425.898	1.489	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CN2CCC(c3nc(-c4ccccn4)no3)CC2)c1	744393330	JLEOSWKIUTWOIZ-UHFFFAOYSA-N	431.456	1.644	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)NC2CCCCC2)sc1Br	744464203	XWQOZJRKDHZXDI-UHFFFAOYSA-N	425.330	1.435	50	20	IDGD	
O=C(COC(=O)[C@H]1C[C@H]1c1ccc2c(c1)OCCO2)NNC(=O)c1ccc([N+](=O)[O-])cc1	745285883	LVNALPGZFRTKGC-HOTGVXAUSA-N	441.396	1.474	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@H]2C[C@@]2(C)c2ccccc2)cc1	745858142	XYOAIDZFFDRZEW-RXVVDRJESA-N	430.530	1.676	50	20	IDGD	
COc1cc(C)nc(NNC(=O)C2CCN(S(=O)(=O)/C=C/c3ccccc3)CC2)n1	746623151	DQBCLWCAHJIJFJ-JLHYYAGUSA-N	431.518	1.949	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NC[C@@H](c2ccccc2)C(C)(C)CO)c2ccccc2c1=O	747455694	HRJPEHZIDAHTQZ-SFHVURJKSA-N	437.500	1.680	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)N2CCN(C(C)(C)C(N)=O)CC2)c(C)n1C[C@@H]1CCCO1	747921610	ZFDCRGIURLOTHC-DTBYZMGXSA-N	427.549	1.599	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)CNC(=O)NCc2ccc([N+](=O)[O-])cc2)cc1C	748213959	HSFGFSNVRPELCT-UHFFFAOYSA-N	429.433	1.237	50	20	IDGD	
CCn1c(NNC(=O)CNC(=O)NCc2ccc([N+](=O)[O-])cc2)nc2ccccc2c1=O	748219881	SIXROVGHPQQMGD-UHFFFAOYSA-N	439.432	1.267	50	20	IDGD	
C[C@H](C(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1)c1cnn(C)c1	749874701	SJWQJTBDNMJHSR-LBPRGKRZSA-N	433.515	1.847	50	20	IDGD	
Cc1cc(C)cc(C(=O)N2CCC[C@@H](C(=O)NNC(=O)CNC(=O)c3cccs3)C2)c1	751206442	MZIHGIPWFJFZGK-MRXNPFEDSA-N	442.541	1.795	50	20	IDGD	
CN1C(=O)N[C@@]2(CCC[C@H]2CNC(=O)NNC(=O)c2ccc(Cl)cc2Cl)C1=O	753020249	PWCJMWMAYQJQOJ-HUTHGQBESA-N	428.276	1.658	50	20	IDGD	
CCn1cc([C@@H]2C[S@](=O)CCN2C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cn1	753134494	FQTHQNYTMDPEPJ-FZEVHQGJSA-N	441.517	1.249	50	20	IDGD	
CO[C@@H]1C[C@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)C1(C)C	753554934	FEDNZTKRJZIOGN-DLBZAZTESA-N	438.550	1.619	50	20	IDGD	
O=C(Cc1cc[nH]n1)NNC(=O)c1ccc2c(=O)n(-c3ccccc3F)c(S)nc2c1	755284341	RYSLNXBPPVHNAP-UHFFFAOYSA-N	438.444	1.540	50	20	IDGD	
CC(=O)c1ccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1	755316884	LNVDAHBEVKSZRX-UHFFFAOYSA-N	446.485	1.377	50	20	IDGD	
CCOc1ccc(NC(=O)NNC(=O)c2cnccn2)cc1S(=O)(=O)N1CCCCC1	755474794	TTYLNCGPWHZNGT-UHFFFAOYSA-N	448.505	1.516	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2ccc(OC)c(NC(C)=O)c2)c2ccccc2c1=O	755622185	HTXZBKNTWZKHMM-UHFFFAOYSA-N	438.444	1.850	50	20	IDGD	
COc1ccc(C#N)cc1NC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1	756278758	MYFXCJMFBSPOKE-UHFFFAOYSA-N	431.474	1.349	50	20	IDGD	
COC(=O)c1cc(NC(=O)NNC(=O)COc2ccc(C#N)cc2)c(OC)c(OC)c1	756741068	BADSRJHGWITVMV-UHFFFAOYSA-N	428.401	1.594	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)cc1-n1cnnn1	756748471	YGROMMAKHKDRND-UHFFFAOYSA-N	437.395	1.667	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)C(F)(F)c1nccs1	756859656	BXDOJUULQVBFOZ-UHFFFAOYSA-N	443.907	1.854	50	20	IDGD	
C[C@](O)(CN1Cc2ccccc2C1=O)C(=O)NNc1ccc(S(=O)(=O)C(F)F)cc1	756875349	JQNNMQYJBPRHJM-IBGZPJMESA-N	439.440	1.533	50	20	IDGD	
COc1ccc(S(=O)(=O)NCCC(=O)NNc2nc(O)c3ccccc3n2)cc1OC	758298925	OOBHDJAXVBACHH-UHFFFAOYSA-N	447.473	1.164	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)Nc2cccc3c2CCN3S(C)(=O)=O)c1	758303620	YLMPZIWOWVBHMB-UHFFFAOYSA-N	432.502	1.857	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NC[C@@H](C)c2ncc(C)s2)cc1	758744044	GRVOHWZNWAIHJV-CYBMUJFWSA-N	439.563	1.515	50	20	IDGD	
Cc1ccnc(-n2nccc2NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)c1	760292376	UPUBTLUVOHQETQ-UHFFFAOYSA-N	448.418	1.505	50	20	IDGD	
COc1ccc(C(=O)C(=O)N2CCN(S(=O)(=O)CBr)CC2)cc1Cl	760930556	LYACPZDPUWPPHW-UHFFFAOYSA-N	439.715	1.358	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H]1[C@H]1COCCC1=NNC(=O)C(=O)Nc1ccccn1	762434536	QANXSKOOQVKALS-HOCLYGCPSA-N	431.493	1.928	50	20	IDGD	
O=C(NNC(=O)c1ccc2ccccc2n1)C(=O)Nc1ccc(CN2C(=O)CCC2=O)cc1	763450981	RXHAGSNWBBQEKZ-UHFFFAOYSA-N	445.435	1.284	50	20	IDGD	
Cc1nc2ccc(C(=O)OCC(=O)NNC(=O)[C@H]3COc4ccccc4O3)cc2s1	763524020	KQOCAWSRGCOMPD-MRXNPFEDSA-N	427.438	1.749	50	20	IDGD	
CCOc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NNC(=O)COc1cccc(C)c1	763631123	VANPFKPFFRMPJM-UHFFFAOYSA-N	442.472	1.260	50	20	IDGD	
O=C(COc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1ccccc1N1CCOC1=O	763684222	HNJRXFYHJYTYBE-UHFFFAOYSA-N	432.820	1.462	50	20	IDGD	
CS(=O)(=O)c1ccc(F)c(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)c1	763684410	LCNSYDPTOOMJQX-UHFFFAOYSA-N	443.840	1.048	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cc(C(F)(F)F)cnc2O)c1C	763851083	QHULLWKSHGOXFH-LLVKDONJSA-N	440.378	1.976	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)NNC(=O)C(=O)Nc1ccc(N2CCCC2=O)c(F)c1	763862046	ZVANKWJMGFUIPD-UHFFFAOYSA-N	437.431	1.762	50	20	IDGD	
COC(=O)Nc1cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)ccc1F	763864260	HOPONCRZCQATRM-SNVBAGLBSA-N	436.371	1.697	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(C(=O)NC)ccc2Cl)cc1OC	763902863	YSAYVHKKBRSYHI-UHFFFAOYSA-N	448.863	1.507	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)C(=O)Nc1cnn(-c2ccccc2Br)c1	763996252	NMCUJTOJFUKYRI-UHFFFAOYSA-N	431.250	1.373	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CC(F)(F)F)cc1S(=O)(=O)NC(C)(C)C	764111888	HVDUNCADDPZLME-UHFFFAOYSA-N	438.428	1.110	50	20	IDGD	
CC(C)(C)CC(=O)NNC(=O)C(=O)Nc1cnc2c(c1)C[C@H](NC(=O)OC(C)(C)C)CC2	764199858	YDCJWRCUVZVUCW-CQSZACIVSA-N	447.536	1.986	50	20	IDGD	
C[C@@H]1CCCC[C@]12NC(=O)N(CC(=O)NNc1c(F)cc(C(=O)NC3CC3)cc1F)C2=O	764332068	BVDHGVIETJLUKW-FIKIJFGZSA-N	449.458	1.801	50	20	IDGD	
COc1ccc(I)c(NC(=O)C(=O)NNC(=O)c2ccc(C)o2)c1	764368001	QXYPVWFIHGWRGQ-UHFFFAOYSA-N	443.197	1.601	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1cccc(C#N)c1)C(=O)NNC(=O)CC12CC3CC(CC(C3)C1)C2	764533940	PRAUVFCOHVWDSD-YMXMSLLWSA-N	444.557	1.979	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)c1ccc(F)c(NS(C)(=O)=O)c1	765310969	ORZVUNHCBDQEAB-UHFFFAOYSA-N	432.474	1.263	50	20	IDGD	
CCOC(=O)N1CCC(C(=O)NNC(=O)c2cc(-c3ccc(OC)c(OC)c3)[nH]n2)CC1	765599041	PUTHUVFZYJYVKI-UHFFFAOYSA-N	445.476	1.723	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2cccn2C)c(I)c1	765698583	PBBLAKWETIXMRC-UHFFFAOYSA-N	442.213	1.038	50	20	IDGD	
CC(=NNC(=O)c1cc(S(=O)(=O)NCc2ccccc2)ccc1O)c1ccnn1C	766002317	MYIRSHAMILVLPE-UHFFFAOYSA-N	427.486	1.758	50	20	IDGD	
COc1ccccc1-c1nn(C)cc1C(=O)OCC(=O)NNC(=O)Cc1ccccc1C	767350793	XNCBQQCWGNRMRK-UHFFFAOYSA-N	436.468	1.951	50	20	IDGD	
COc1ccc(-c2cc(C(=O)OCC(=O)NNC(=O)Cc3nc(C)cs3)n[nH]2)cc1	767573436	RLRCLBNLCJGPSA-UHFFFAOYSA-N	429.458	1.397	50	20	IDGD	
CS(=O)(=O)N1CCN(CCNC(=O)NNc2c(Cl)cc(F)cc2Cl)CC1	768059377	AQENQXSVYMGMQJ-UHFFFAOYSA-N	428.317	1.336	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)c3cc(NC(=O)OCC(F)(F)F)ccc3O)nc21	769857179	DNCGUMVOZFOGRZ-UHFFFAOYSA-N	441.326	1.642	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)c3nn(-c4ccc(F)cc4)ccc3=O)nc21	770957790	FOEFNYYWJNFULU-UHFFFAOYSA-N	438.423	1.729	50	20	IDGD	
Cc1nn(CCCl)c(C)c1C(=O)N1CCO[C@H](CN2C(=O)c3ccccc3C2=O)C1	771491417	HFTWOUFHJAMQPL-HNNXBMFYSA-N	430.892	1.876	50	20	IDGD	
Cc1nc2c(C(N)=O)cnn2c(C)c1CCC(=O)NNc1ccnc(Br)c1	771553224	KAMVDCCNSDYNIJ-UHFFFAOYSA-N	432.282	1.678	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@](F)(C(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)C1	772195991	VRSSQSQOGPYHDC-IBGZPJMESA-N	442.875	1.453	50	20	IDGD	
Cc1nc(-c2ncccn2)nc(O)c1CC(=O)NNC(=O)[C@H](C)Oc1cccc(Cl)c1	772993514	CBWJXUHBZGOIPP-LBPRGKRZSA-N	442.863	1.758	50	20	IDGD	
Cn1c(=O)n(CCC(=O)NNC(=O)[C@H]2CCCN(C(=O)OC(C)(C)C)C2)c2ccccc21	773419410	VRDZIKFHRGQWGG-HNNXBMFYSA-N	445.520	1.525	50	20	IDGD	
CC(C)N(C)S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2)cc1	773642793	BIJMXWFNDYATLP-UHFFFAOYSA-N	435.462	1.706	50	20	IDGD	
O=C(NNc1ccccc1[N+](=O)[O-])C(=O)Nc1ccc(F)c(-n2nnnc2C2CC2)c1	773653674	GNVFASAOUGTGOT-UHFFFAOYSA-N	426.368	1.669	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccnn1-c1ccncc1	774009166	NYQDHDMPWFEMTA-GFCCVEGCSA-N	428.836	1.474	50	20	IDGD	
Cn1c(CNC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)nc2cc(Cl)ccc21	777690790	QZSAKUYXXWELQK-UHFFFAOYSA-N	435.893	1.774	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)nc(C(F)(F)F)n1	778292395	QXBGSTJVVSCFJE-UHFFFAOYSA-N	437.787	1.179	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)Cc2c(C)nn(-c3nc(C)cc(C)n3)c2C)nc1C	778427428	XMWUCKGKFYFBDY-UHFFFAOYSA-N	438.492	1.857	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)C[C@@H]2CCN(C(=O)OC(C)(C)C)C2)n1	778440263	JNKJBSQYZKDAMZ-ZDUSSCGKSA-N	440.522	1.332	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)N1CCC[C@H](S(=O)(=O)N2CCc3ccccc32)C1	779624676	QLOZTHZRZNYOGJ-WMZOPIPTSA-N	436.578	1.425	50	20	IDGD	
O=C(C[C@H](O)c1ccc(OCc2ccccc2)cc1)NNC(=O)N[C@@H]1CCS(=O)(=O)C1	780906655	FKKQZSSVLRFKTR-MJGOQNOKSA-N	447.513	1.207	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N2CC[C@H]([C@H](C)O)C2)cc1	781044163	VJFNPMFHFBRZKX-KVEBRJTLSA-N	437.500	1.570	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C)c(C)c2)c(OC)c1	782120570	GGEZZEOSGYLCGI-UHFFFAOYSA-N	429.429	1.264	50	20	IDGD	
O=C(NNc1ncncc1Cl)C(=O)Nc1ccc(CC(=O)N2CCSCC2)cc1	782159454	RFOGZNBITUHZAA-UHFFFAOYSA-N	434.909	1.330	50	20	IDGD	
COc1cccc(/C=C(/C#N)C(=O)O[C@H](C(=O)N[C@@]2(C)CCS(=O)(=O)C2)C(C)C)c1	782445004	BNIBDXBDQNJBHP-DHFSLWQTSA-N	434.514	1.863	50	20	IDGD	
COC(=O)[C@H]1CN(C(=O)C(=O)NNc2ccccc2Br)c2ccccc2O1	782983793	QSWKMEZOJQEJRB-OAHLLOKOSA-N	434.246	1.859	50	20	IDGD	
COC(=O)CNC(=O)c1ccc(NC(=O)C(=O)NNc2ccc(Br)cc2)cc1	783009490	PQADASHIPPVQMZ-UHFFFAOYSA-N	449.261	1.434	50	20	IDGD	
CCCCn1ncc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)c1C	783265661	WJUHSMRKJTZEQC-UHFFFAOYSA-N	437.526	1.155	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2ccc(SCc3cccnc3)cc2)CCS(=O)(=O)C1	783426845	OXHHRWXBAWDBAN-IBGZPJMESA-N	434.543	1.510	50	20	IDGD	
Cc1ccc(NNC(=O)C(=O)Nc2ccc(NC(=O)CN3CCCCCC3)cc2)nn1	783953636	TUAURQBNVPFIKX-UHFFFAOYSA-N	425.493	1.681	50	20	IDGD	
CC(C)(C)OC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)CNC(=O)c2ccco2)cc1	784003485	XOJJJYVJXZNHHR-UHFFFAOYSA-N	445.432	1.143	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2ccc(OCC(F)(F)F)cc2)ccc1-n1cnnn1	784369187	VHACWPXLILLRAD-UHFFFAOYSA-N	435.366	1.994	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)Cc2ccccc2S(C)(=O)=O)c1	786080951	BPEUVWLHRWWEBJ-UHFFFAOYSA-N	441.303	1.865	50	20	IDGD	
N#Cc1ccc(N2C(=O)N[C@H](CCC(=O)NNc3nnc(-c4ccccn4)s3)C2=O)cc1	788565660	TZOWTPRILPEUJV-OAHLLOKOSA-N	448.468	1.820	50	20	IDGD	
COc1c(C(=O)N(C)C)cc(Cl)cc1S(=O)(=O)NNC(=O)c1ccccc1O	790050186	NGBORNMIEKZSHT-UHFFFAOYSA-N	427.866	1.379	50	20	IDGD	
O=C(CCn1c(S)nc2ccccc2c1=O)NNC(=O)[C@H]1COc2ccccc2O1	790092319	ZRCKYUAKRUHGQN-MRXNPFEDSA-N	426.454	1.063	50	20	IDGD	
Cc1cccc2c(=O)n(CCC(=O)OCC(=O)NNC(=O)c3cccc(Cl)c3)cnc12	792694671	WEIONNJQQQGOBE-UHFFFAOYSA-N	442.859	1.753	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)Cc3ccc4c[nH]nc4c3)cc2)CC1	793710316	KVKCLDQWEKRFSV-UHFFFAOYSA-N	428.518	1.185	50	20	IDGD	
C[C@](O)(CN1C(=O)NC2(CCCC2)C1=O)C(=O)NNc1ccc(Br)c(F)c1	793838556	LTWUQYDWKSZRRJ-INIZCTEOSA-N	443.273	1.647	50	20	IDGD	
Cc1c(C(=O)NNc2ccccc2S(=O)(=O)N(C)C)sc2nc3n(c(=O)c12)CCC3	795169065	IKIAIXUCRGCSPD-UHFFFAOYSA-N	447.542	1.720	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)[C@H]1CCCN(C(=O)Cc2ccccc2)C1	795181750	OIDZKJMURNQGJY-SFHVURJKSA-N	444.557	1.861	50	20	IDGD	
CNS(=O)(=O)c1ccccc1S(=O)(=O)NNC(=O)c1cc2c(s1)CC[C@@H](C)C2	799519942	AUFABRKNNQDNPP-LLVKDONJSA-N	443.572	1.404	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N(C)[C@H](C)c2cccc(S(N)(=O)=O)c2)c(OC)c1	799920107	BLXTWILVKIBAGK-GFCCVEGCSA-N	436.490	1.399	50	20	IDGD	
Cc1c([N+](=O)[O-])ccc(F)c1NC(=O)C(=O)NNC(=O)Cc1nc2ccccc2n1C	800628651	XBBHYJVZXKKTNK-UHFFFAOYSA-N	428.380	1.258	50	20	IDGD	
COc1ccc(-n2cc(O)c(C(=O)OCC(=O)NNC(=O)c3cccc(Cl)c3)n2)cc1	801366750	XICUQQJMPKRHGX-UHFFFAOYSA-N	444.831	1.858	50	20	IDGD	
Cc1nc(N2CCOCC2)nc(O)c1CCC(=O)NNC(=O)Nc1cc(F)cc(F)c1	802001389	TYNNAMGBMMCQKQ-UHFFFAOYSA-N	436.419	1.391	50	20	IDGD	
CCC(C)(C)C1CCC2(CC1)NC(=O)N(CC(=O)NNC(=O)N=c1cc[nH]cc1)C2=O	802025538	BCSOROMRDFPUIA-UHFFFAOYSA-N	430.509	1.573	50	20	IDGD	
O=C(COC(=O)c1ccc(C(F)(F)F)s1)NNC(=O)[C@@H]1COc2ccccc2O1	803864074	NGHHLDRJDHGYIG-NSHDSACASA-N	430.360	1.911	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N[C@@H](c2nncn2C)C(C)C)cc1Br	805103694	AONKMDANILDJGG-CYBMUJFWSA-N	425.287	1.928	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2c(C)c(C(F)(F)F)nn2C)cc1OC	806972894	QFOSFOLWMGYKKG-UHFFFAOYSA-N	429.355	1.164	50	20	IDGD	
CCOC(=O)c1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)cc1	813033109	FQMIWDCGTOZOIO-UHFFFAOYSA-N	434.474	1.195	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccc(OC(F)(F)F)cc2)cc1	813033280	MFAZIPADUNCODC-UHFFFAOYSA-N	446.407	1.917	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2cccc(COCC3CC3)c2)cc1	813033662	FGALGKPQKIXOTF-UHFFFAOYSA-N	446.529	1.945	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)NCc2snnc2C)c2ccccc2c1=O	813848395	AUKPPXXTLOCABD-UHFFFAOYSA-N	429.506	1.891	50	20	IDGD	
CC(C)c1cccc(-n2cc(O)c(C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)n2)c1	814760357	KYBFCDZYYAAOLC-UHFFFAOYSA-N	432.444	1.752	50	20	IDGD	
COCCOc1cccc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)N(C)C)c1	815751604	GKDASJLBYDNZOR-UHFFFAOYSA-N	436.490	1.044	50	20	IDGD	
Cn1c(NNC(=O)c2ccc(S(=O)(=O)NC[C@@H]3CCCO3)cc2)nc2ccccc21	816577358	JFORFVNFMQVDSC-HNNXBMFYSA-N	429.502	1.788	50	20	IDGD	
Cc1nnc(NNC(=O)c2cccc(S(=O)(=O)N3c4ccccc4C[C@@H]3C)c2)nc1O	817281618	NIUWZNZAJKQFOJ-LBPRGKRZSA-N	440.485	1.782	50	20	IDGD	
CCOc1cc(C(=O)NNS(=O)(=O)N2C[C@H]3CC[C@H]2C3)cc(OCC)c1OCC	821124349	TXIJPFSTPRMRDN-ZFWWWQNUSA-N	427.523	1.846	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cnn(C)c2-n2cccc2)c1	879395152	ZXORFCLAWSJJPW-UHFFFAOYSA-N	444.517	1.316	50	20	IDGD	
C[C@@H](OCc1ccccc1)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	915062966	LZPVZCAZGTYYCR-MRXNPFEDSA-N	431.514	1.837	50	20	IDGD	
O=C(COC(=O)C1(c2ccccc2)CCOCC1)NNC(=O)[C@@H]1COc2ccccc2O1	915255935	DULLSXKADNKYNN-IBGZPJMESA-N	440.452	1.265	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)N2CCN(C(=O)CN(C)C)CC2)c(C)n1C[C@@H]1CCCO1	915267772	RZJMSYPEPSECJC-MSTPFNHUSA-N	427.549	1.423	50	20	IDGD	
CC(C)NS(=O)(=O)Cc1ccccc1CNC(=O)NNc1ccc(-n2cccn2)nn1	916229243	WOMLSOGASWFMRX-UHFFFAOYSA-N	444.521	1.316	50	20	IDGD	
O=C(NNC(=O)c1ccc(NC(=O)c2ccc(Br)cc2)cc1)C(=O)NC1CC1	916374288	QNAKWCQHNKRKKS-UHFFFAOYSA-N	445.273	1.741	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)NCc1ccc(N2CCO[C@H](C)C2)nc1	916392731	JHHFVODNVQSAPY-MRXNPFEDSA-N	443.504	1.615	50	20	IDGD	
CN(Cc1ccccc1)C(=O)N1CCN(CC(=O)NNC(=O)c2ccc(F)cc2)CC1	917136877	NZFVOIJTAHXVHJ-UHFFFAOYSA-N	427.480	1.456	50	20	IDGD	
Cc1cc(C(=O)N2CCN(CC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)CC2)c(C)o1	917167201	QAYWKHFMWIDRGV-UHFFFAOYSA-N	429.433	1.024	50	20	IDGD	
COc1ccc(C(=O)N2CCN(CC(=O)NNC(=O)c3ccc(C)cc3)CC2)c(OC)c1	917836717	QYSNKHFTTZWVMQ-UHFFFAOYSA-N	440.500	1.231	50	20	IDGD	
O=C(NC[C@@H]1CCCOC1)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	918123914	DUXRHWPBZMLGLI-KRWDZBQOSA-N	435.488	1.759	50	20	IDGD	
COCCCn1c(S)nc2cc(C(=O)NNC(=O)c3ccc(C)cc3O)ccc2c1=O	918337379	KFDNEISLEXTELF-UHFFFAOYSA-N	442.497	1.811	50	20	IDGD	
CCCCS(=O)(=O)N1CCC[C@H]1C(=O)NNC(=O)[C@H](C)Oc1cccc(C)c1C	918690696	ONLPLWTVRDCGHK-IRXDYDNUSA-N	425.551	1.812	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)NCCc1ccc([N+](=O)[O-])cc1	919780762	MPRYCJILUHFHDT-UHFFFAOYSA-N	440.504	1.680	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@@H]2CCc3cc(C)ccc32)cc1	919920187	MGWIFQGLICRBMX-LJQANCHMSA-N	430.530	1.942	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N[C@H](C)Cn2ccnc2)cc1	920850652	CIXFYOHNSJJISP-CJMVGXJBSA-N	447.499	1.742	50	20	IDGD	
Cc1ccc(S(=O)(=O)c2ccc(NNC(=O)CCSc3nnnn3C)cc2)cc1	921202627	WGIDABOIMWDSAW-UHFFFAOYSA-N	432.531	1.977	50	20	IDGD	
CCOC(=O)c1ccc(F)c(S(=O)(=O)NNC(=O)c2cncn2-c2ccccc2)c1	1257411037	HHAYGLAAVFNQDQ-UHFFFAOYSA-N	432.433	1.811	50	20	IDGD	
C[C@H]1Oc2ccccc2N(CC(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)C1=O	1318657223	YTODSHIQRBKGJH-CQSZACIVSA-N	446.504	1.595	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H]2CCCc3nn(C)cc32)c1	1326996082	WAOFSRQEWFGHSQ-INIZCTEOSA-N	433.534	1.332	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnc4ncccn34)C2)C1	1777935872	GPCAKHWBBJPWKJ-ACJLOTCBSA-N	436.310	1.346	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc3c(c2)CNC3=O)C1	1779162079	JKLSSFKUSSAWKI-NJNPRVFISA-N	449.935	1.311	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccnc3c2OCO3)C1	1780025655	PTSMKCGTQSDYBJ-BXTJHSDWSA-N	439.896	1.192	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)nn1C(F)F	1780305767	BTBWRJVVBZDIDH-ABAIWWIYSA-N	439.232	1.721	50	20	IDGD	
CC(=O)NC(C)(C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@](C)(Cl)CCl)C1	1780708003	ZWGRQKNSSMRLHU-MDASCCDHSA-N	436.380	1.651	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C=C/c1cnccn1)C2)[C@@H](F)Br	1780776596	ACJCNUPDCNFBPF-KHFHEFGLSA-N	441.301	1.694	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Br)C1)n1cncn1	1780776876	HMOISIVHRIDZFJ-NFFDBFGFSA-N	432.294	1.044	50	20	IDGD	
Cc1ccc(OCC(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)cc1	1781328783	ZJXNVHNMEKCRTD-AEFFLSMTSA-N	429.286	1.894	50	20	IDGD	
O=C(c1cccn2cncc12)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781331153	DTPPENMMPCDIOR-PBHICJAKSA-N	425.258	1.468	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)C(Cl)Cl)C2)nc2nccn12	1782221383	SPJZKBOJDGFHGY-AUUYWEPGSA-N	440.331	1.969	50	20	IDGD	
O=C1CSc2ncc(C(=O)N3CC[C@@]4(C3)CN(C(=O)[C@H](F)Cl)CCO4)cc2N1	1782425875	UNCKFJATGUDLOV-SUMWQHHRSA-N	428.873	1.104	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)/C=C/c3cc(C)on3)CCO2)C1	1783349933	WKMXIBDWDFAABP-CHABLROBSA-N	426.311	2.000	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)Cc3ccc4c(c3)CCO4)C2)C1	1783422486	ZFHQJEFYBQVJSH-VBKZILBWSA-N	437.334	1.777	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cc(Cl)c4nncn4c3)CCO2)C1	1783877649	MQDSQTIZPKLYOJ-KBXCAEBGSA-N	442.303	1.080	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(C(F)(F)F)ccn3)CCO2)C1	1783877767	PMKKBTUWLWIWRB-DYVFJYSZSA-N	435.830	1.798	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(OCCCO)cc3)CCO2)C1	1783883151	VILHJBBRKDAAAO-NQIIRXRSSA-N	440.924	1.145	50	20	IDGD	
Cc1nnc(CCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)Br)C[C@@H]32)s1	1785326743	LFNAIQKKOLYAJI-PYJNHQTQSA-N	445.383	1.542	50	20	IDGD	
Cc1noc(N)c1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)CBr)C[C@@H]21	1786835834	ODJWSGKZFYAJPG-IXOXFDKPSA-N	429.315	1.190	50	20	IDGD	
CC(C)n1nc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]3C2)cc1C(=O)O	1787444187	RGGPEZOGWIOEIK-LWWSYDQCSA-N	430.864	1.290	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(OC)nn3)[C@H]2C1	1789105051	DKBIKJANVFYVNY-XPCVCDNBSA-N	441.326	1.252	50	20	IDGD	
CCOC(=O)N[C@@H](O)C(=O)Nc1ccc(C2(NC(=O)[C@H](C)Br)CCC2)cc1	1789409785	UJEKNMLXSKUUQU-ZBEGNZNMSA-N	442.310	1.968	50	20	IDGD	
O=C(Cc1ccncc1)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1	1790385859	HOULRNQLIGRZRV-UHFFFAOYSA-N	429.285	1.752	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1ccc(C2(NC(=O)CN3C(=O)C=CC3=O)CCC2)cc1	1791436653	VWZBXMQJNVHBJJ-GFCCVEGCSA-N	434.290	1.829	50	20	IDGD	
CCOc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)CBr)nn1	1792872403	FHUMMJIHQFAOHD-JFILPPLUSA-N	441.326	1.110	50	20	IDGD	
Cc1ccc(S(=O)(=O)CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](O)CCl)cc1	1793109581	BXMVASLZVAVEMK-IVSAIRAKSA-N	428.938	1.007	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2	1795115082	GLMWQQUZZXVBNJ-QHBPRCKVSA-N	447.713	1.739	50	20	IDGD	
Cn1c(=O)c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CCBr)nc2ccccc21	1795492535	PCKVEAPVNVMTBN-BTTYYORXSA-N	447.333	1.970	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Cl)C1	1796364460	GBFWSDVHSNTKMF-RMEBNNNOSA-N	433.908	1.367	50	20	IDGD	
C=C(Oc1ccccc1O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2	1796431516	MEBSZTFRAYLFHZ-ZSBFGKGUSA-N	439.306	1.659	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnc(C(C)(C)C)cn1	1796761562	YKHPEJMLDLLEOB-NFFDBFGFSA-N	439.354	1.761	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccn3nccc13)C2	1796893782	SOFKCIGMKHGBTB-CKFWPPNZSA-N	447.499	1.720	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CN(Cc2ccccc2)CCO1	1797248132	JFEGVRHOLBUUED-LUYSREMJSA-N	449.979	1.494	50	20	IDGD	
C[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2	1797302505	MPMBQNSPECPJHO-IATJYDTKSA-N	447.935	1.613	50	20	IDGD	
Cc1ccc2cc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)c3cccc(B(O)O)c3)C4)ccc2n1	1797534350	CRYLCNDDTZXWIJ-KOUNCHBCSA-N	443.312	1.789	50	20	IDGD	
O=C(CS[C@@H]1CCCCO1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2	1797799844	TVBLRNPXZPUDSP-BJBXXJATSA-N	439.347	1.526	50	20	IDGD	
O=C(Cc1cc2cccnc2cc1F)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2	1799240873	GLJGTYGSNVZDTC-BAAGSCJXSA-N	435.883	1.106	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CS(=O)(=O)c1ccc(C)cc1)C2	1799266117	WKYQJNUQWZACRH-HIRMHNASSA-N	442.965	1.376	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1[nH]nc3ncccc13)C2	1799275096	KNCVBMBVUOGRJD-ZSMOCIRGSA-N	426.304	1.397	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1ccc2ncnn2c1	1799850546	BNPCTIKFEBASOK-DMRZNYOFSA-N	434.338	1.941	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)NC(=O)c1ccccn1	1800201422	PBHVNSWSSXTIBW-UJHHCITNSA-N	436.940	1.197	50	20	IDGD	
CC[C@@H](NC(C)=O)C(=O)NC[C@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1	1802879771	IQKDSNQHSSNKDD-JFIYKMOQSA-N	439.354	1.787	50	20	IDGD	
COc1cc(C#N)cc(C(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)c1	1803141586	QDBJHXXAYGAYPP-UXPWSPDFSA-N	442.903	1.881	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cccn3cncc23)[C@H]1c1cccnc1)[C@@H](O)CCl	1803142685	GYGBYHLTQKJTFI-SNRMKQJTSA-N	427.892	1.649	50	20	IDGD	
CN1CCc2cc(C(=O)N3CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]3c3cccnc3)ccc21	1803143161	VVIMBDIPIOYXJD-HLAWJBBLSA-N	442.947	1.993	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cnn3ccncc23)[C@@H]1c1cccnc1)[C@H](O)CCl	1803143236	XPPIUDYEENJUHH-BMGDILEWSA-N	428.880	1.044	50	20	IDGD	
Cc1ncsc1C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1805756915	ZIDKVWTWRHNPME-LPHOPBHVSA-N	444.561	1.539	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)C2(C#N)CC2)[C@H]1c1cccnc1	1806849667	DQDXFQXJGCOXFH-HMDFAQMRSA-N	447.499	1.525	50	20	IDGD	
Cc1ccncc1C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1807361943	JYLXLFXPJUNCON-KNQAVFIVSA-N	444.300	1.098	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2nccc3nc[nH]c23)[C@@H]1c1cccnc1	1808138623	LBWNFORODWZYPU-VCBZYWHSSA-N	442.907	1.926	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@H]1CCN(C(=O)Cn2ccnn2)[C@H]1c1cccnc1	1808302041	ASBRYSORSMINFA-HFTRVMKXSA-N	425.320	1.615	50	20	IDGD	
CC[C@H](NC(C)=O)C(=O)N1CC[C@H](CNC(=O)[C@@H](F)Br)[C@@H]1c1cccnc1	1808649489	SIAMPOJQHKGDSD-FXUDXRNXSA-N	443.317	1.693	50	20	IDGD	
O=C(CCN1CCOC1=O)NC[C@H]1CCN(C(=O)C(Cl)Cl)[C@@H]1c1cccnc1	1809532089	JTLQCEXXDOLSAY-UKRRQHHQSA-N	429.304	1.733	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)c3ccc([N+](=O)[O-])o3)CC2)C1	1809972851	SGDQBMNULKUSTJ-UHFFFAOYSA-N	441.249	1.026	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2c(O)cc(O)cc2O)[C@H]1c1cccnc1	1811433537	MKTMZAJRKLAPOA-ZUEVXXBESA-N	449.891	1.772	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H](CNC(=O)c2c[nH]c(=O)cn2)[C@H]1c1cccnc1	1811458031	FJTPXWTXYCRCJH-JKIFEVAISA-N	448.321	1.658	50	20	IDGD	
CCS(=O)(=O)CC(=O)N1CC[C@H](CNC(=O)[C@@H](C)Br)[C@@H]1c1cccnc1	1812863945	FCKOBMIJGFAYEE-XPKDYRNWSA-N	446.367	1.306	50	20	IDGD	
CC1(C)CC(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)C1	1813125545	BDUVOQHNGYVDEJ-WIYYLYMNSA-N	435.333	1.517	50	20	IDGD	
O=C(CCc1ccoc1)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1813522575	FLOFUFYFOZILKG-REWPJTCUSA-N	447.300	1.307	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@@H](F)Br)[nH]n1)c1cccc(=O)n1O	1816148880	NHPNVIFFNIBSJN-QMTHXVAHSA-N	442.245	1.805	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC[C@H]1c1cc(NC(=O)Cn2cnnn2)n[nH]1	1817613556	RYBRGLAWZBYUEQ-JQWIXIFHSA-N	425.291	1.120	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@H](F)Cl)[nH]n1)c1n[nH]c2c1CS(=O)(=O)C2	1817684045	WUNPLHZXIUWNFR-RISCZKNCSA-N	444.876	1.402	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc(C#N)cc2)n[nH]1	1820551151	GDZRMRYRXBPHBB-GOSISDBHSA-N	437.504	1.960	50	20	IDGD	
CC[C@@H](Br)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN2CCNC2=N)[nH]n1	1822088161	QHEKWNXBLJBYOM-YPMHNXCESA-N	440.346	1.415	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2)c1ccc(F)cc1	1822178245	NNNHVABFLFUJHE-MRXNPFEDSA-N	439.277	1.502	50	20	IDGD	
CCn1nc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)cc1C	1822414352	CCKUJTDTMHGHEE-QGZVFWFLSA-N	444.540	1.613	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3C[C@@]3(F)Cl)C2)C1	1830543818	DSUARFABGFSCRP-KOZAUXTDSA-N	441.725	1.398	50	20	IDGD	
C[C@]1(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1(F)F	1832801657	DKOTZRUQHOGYLO-WIYYLYMNSA-N	434.292	1.645	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cncc(F)c3)CCO2)C1	1834360034	RJPFHPHOLGFIFU-ZWKOTPCHSA-N	434.295	1.527	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)COc3ccc(F)cc3)CCO2)C1	1834964218	QFWCHVUZRFUCJY-XLIONFOSSA-N	428.888	1.678	50	20	IDGD	
Nc1ccccc1/C=C/C(=O)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1835781543	QTYUYTOENSTWEQ-UEKDZROGSA-N	428.316	1.542	50	20	IDGD	
CSCC[C@@H](O)C(=O)N1CCC(N2CCC(NC(=O)CO[Si](C)(C)C)CC2)CC1	1835837415	GSUIRQBAFXKWPX-GOSISDBHSA-N	445.702	1.524	50	20	IDGD	
CCc1cc(C(=O)NC2CCN(C3CCN(C(=O)[C@H](Cl)COC)CC3)CC2)n(C)n1	1835958061	PNFPZLDQXBYISJ-GOSISDBHSA-N	439.988	1.422	50	20	IDGD	
CC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)[C@H](C)CS(C)(=O)=O)CC2)CC1	1836394738	FHUXLTDHUGSVGO-PBHICJAKSA-N	436.018	1.256	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836717750	IWRLSSANOSXOQO-GOSISDBHSA-N	448.951	1.855	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)/C(C)=C/c3ccc(C)o3)CCO2)C1	1837582531	OUBDJAIQUGTTTH-BFRZJPPNSA-N	440.924	1.702	50	20	IDGD	
Cc1n[nH]c(C)c1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)CBr)C2)C1	1837801563	WHGXQTCJSWDBBN-KZULUSFZSA-N	443.342	1.128	50	20	IDGD	
Cc1c[nH]cc1C(=O)N1CCC(OC2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1	1838127734	IKLMBPSCUMNLBC-UHFFFAOYSA-N	433.553	1.308	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(Cl)cnc3O)C2)C1	1839141895	WOKLVWMVVNATPJ-RDTXWAMCSA-N	432.304	1.528	50	20	IDGD	
O=C(c1n[nH]c2c(Cl)cccc12)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1839495753	WFHMZTLDUOQULS-CRAIPNDOSA-N	445.278	1.821	50	20	IDGD	
O=C(c1cccc2[nH]ncc12)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840187748	UBXJLMVCLYAKEQ-SFHVURJKSA-N	427.288	1.437	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCn3nc(C)cc3C)CCO2)C1	1840345180	BCQBCFYEHRJIQJ-WIYYLYMNSA-N	440.972	1.754	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1[C@@H](C(=O)N1CC3(CCCN3C(=O)[C@H](O)CCl)C1)C2	1841354664	NDYZHUSLLIQMLK-YHUYYLMFSA-N	441.956	1.578	50	20	IDGD	
COc1ccc([C@@H]2C[C@H]2C(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)cc1	1841573398	AFAIMWQREMAYKB-RBUKOAKNSA-N	449.511	1.314	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2cccc3[nH]ncc23)C1	1843260465	LPGOYJNMPPHVPC-AFUMVMLFSA-N	433.472	1.514	50	20	IDGD	
COc1cc(N2CCC(C(=O)N3CC4(CCCN4C(=O)[C@@H](F)Cl)C3)CC2)ncn1	1843361426	GCDQXDZRKYACLA-MRXNPFEDSA-N	425.892	1.439	50	20	IDGD	
CC(C)(C)OC(=O)NC1(C(=O)N2CCCC23CN(C(=O)[C@@H](F)Br)C3)CC1	1847144609	NSYHLWWMJHLGLK-LLVKDONJSA-N	434.306	1.938	50	20	IDGD	
O=C(Cn1c(=O)ccn(Cc2ccccc2)c1=O)NNC(=O)C12CC3CC(CC(C3)C1)C2	14843315	QVMQPXHSHLKFAA-UHFFFAOYSA-N	436.512	1.422	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCOCC2)cc1C(=O)NNC(=O)c1ccccc1C	15812649	OGVYSBRTUSEZSR-UHFFFAOYSA-N	433.486	1.099	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc(F)c(F)c1)NNC(=O)Cc1c[nH]c2ccccc12	21969842	RAQXVKFIJVRGJG-UHFFFAOYSA-N	436.440	1.505	50	20	IDGD	
COc1ccc(N2C[C@@H](C(=O)NNC(=O)[C@@H]3COc4ccccc4O3)CC2=O)c(OC)c1	27068324	ZITCOWSZGRNCKN-DJJJIMSYSA-N	441.440	1.044	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)N1CCC(CC(=O)NC2CCCC2)CC1	725873872	RRUXFNMALJQIPV-UHFFFAOYSA-N	435.550	1.380	50	20	IDGD	
C[C@@H](CC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)NC(=O)C1CCCCC1	727364180	NRCIHOUTTXARSZ-AWEZNQCLSA-N	438.550	1.173	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)c1ccccc1)C(=O)NNc1nc(-c2cccnc2)no1	728079031	HNRIMTHCIWYTNJ-HNNXBMFYSA-N	448.530	1.675	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)C[C@@H](c2ccccc2)N2CCOC2=O)c1	728240907	VCGQNSPONVBBCL-KRWDZBQOSA-N	431.470	1.435	50	20	IDGD	
Cc1nnnn1[C@H](Cc1cccc(F)c1)C(=O)NNC(=O)c1cccc(OC(F)F)c1	728485166	QZNFRBOEWGVQKG-MRXNPFEDSA-N	434.378	1.967	50	20	IDGD	
C[C@]1(c2ccc(CNC(=O)NNC(=O)c3cccc(OC(F)F)c3)cc2)NC(=O)NC1=O	728751309	QAUFMFSDVSXXIN-HXUWFJFHSA-N	447.398	1.487	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCCC[C@H]2C)cc1C(=O)NNC(=O)Cc1cccnc1	728852135	NHOGAOSIBCXYIC-MRXNPFEDSA-N	430.530	1.957	50	20	IDGD	
COc1cc(Br)c(S(=O)(=O)NNC(=O)c2cccc(C#N)c2)cc1OC	728853566	SQOUUMUYBIXAEZ-UHFFFAOYSA-N	440.275	1.961	50	20	IDGD	
CN(Cc1cnn(-c2ccccc2)n1)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	728959789	PSDSJTMJOCCWHY-UHFFFAOYSA-N	435.492	1.147	50	20	IDGD	
COc1cccc(/C=C(\C(=O)NNC(=O)Cn2ccc3ccccc32)n2nnnc2C)c1	729451426	URDGEGVMOGYNAN-DEDYPNTBSA-N	431.456	1.791	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CCc2ccccc2O)cc1S(=O)(=O)NC(C)C	730034054	PECLVTXQICOASD-UHFFFAOYSA-N	435.502	1.481	50	20	IDGD	
O=C(CSc1nnc(O)nc1O)NN=Cc1ccccc1I	730556533	NMOAREQQPSKZLR-UHFFFAOYSA-N	431.215	1.130	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2ccc3c(c2)OCO3)nnn1-c1ccc(OC(F)F)cc1	731186755	SHRDYWMGAQGAQW-UHFFFAOYSA-N	431.355	1.981	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)c3ccccc3OC)CC2)cc1	731493449	YQFRZVMLUQERHG-UHFFFAOYSA-N	447.513	1.566	50	20	IDGD	
N#Cc1ccc(N2C(=O)N[C@@H](CCC(=O)NNC(=O)c3cc4c(s3)CCC4)C2=O)cc1	733774997	WBVHIXRRKIPMBA-HNNXBMFYSA-N	437.481	1.775	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1	734241230	JGQKHRIAJWTAMX-UHFFFAOYSA-N	433.425	1.249	50	20	IDGD	
COc1ccc(CN2CC[C@H](NC(=O)NNC(=O)COc3ccccc3F)C2=O)cc1	734516010	CQWPKTOOBMHAME-KRWDZBQOSA-N	430.436	1.345	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cnn(C)c2)cc1S(=O)(=O)N[C@@H]1CCCC[C@@H]1C	735446113	WYNZSFQAVHDDKC-XJKSGUPXSA-N	449.533	1.361	50	20	IDGD	
O=C(CN1C(=O)[C@@H]2[C@@H](C1=O)[C@H]1C=C[C@H]2C1)NNc1c(F)cc(F)cc1Br	741978480	JOSYZSSWILVQMJ-MQXWNXJFSA-N	426.217	1.978	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCc2c[nH]nc2C1)c1ccccc1NS(=O)(=O)c1cccs1	742489031	JNIAFANEZQWTBJ-GFCCVEGCSA-N	445.526	1.838	50	20	IDGD	
COCCOC[C@H]1CCN(C(=O)NNC(=O)c2ccc(OC)c(Br)c2)C1	743604080	JKZIBADPXPTALG-LBPRGKRZSA-N	430.299	1.797	50	20	IDGD	
O=C(NNC(=O)c1cc(S(=O)(=O)NC2CC2)ccc1Br)NC1CCCC1	744059541	RCKWMWYPVAILNS-UHFFFAOYSA-N	445.339	1.776	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)OCc2nc(CS(C)(=O)=O)no2)c(C)n1C[C@H]1CCCO1	744553007	XVMOMQZQGIZBPF-QLGNDSFESA-N	448.501	1.862	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)[C@@]23CCC(=O)N2c2ccccc2S3)cc1	744618994	WZXVUDKNILPZBB-NRFANRHFSA-N	436.449	1.491	50	20	IDGD	
CCN(CC)CCN1C(=O)C(=NNC(=O)[C@H](C)CN2C[C@H](C)O[C@@H](C)C2)c2ccccc21	744762188	OPHMFWSNNSFYIX-QYZOEREBSA-N	443.592	1.941	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)N[C@H]2C[C@H](C)N(c3cnn(C)c3)C2=O)c1C	745917071	HINSZLDEUPNDES-LXZKKBNFSA-N	428.493	1.329	50	20	IDGD	
CC(C)c1nc(C#N)c(NNC(=O)[C@H]2CN(Cc3nc(O)c4ccccc4n3)CCO2)o1	746185543	RTLXLQXIZOOHJZ-MRXNPFEDSA-N	437.460	1.663	50	20	IDGD	
O=C(NNc1ccccc1Br)c1ccc(S(=O)(=O)N2CCOCC2)o1	748069220	YAIDWCIOZOORNP-UHFFFAOYSA-N	430.280	1.820	50	20	IDGD	
O=C(NNc1ccc(OCC(F)(F)F)cc1)c1ccc(S(=O)(=O)N2CCOCC2)o1	748702009	HSDPSVCYGBOIGL-UHFFFAOYSA-N	449.407	1.999	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1ccc(-c2n[nH]c(C3CC3)n2)cc1	748849317	IDQMFBSHJILZGV-UHFFFAOYSA-N	432.488	1.817	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)[C@H]2CCc3nnc(C)n3C2)cc(OCC)c1OCC	750715209	QQXFVXXSMUPPCM-AWEZNQCLSA-N	431.493	1.806	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)Cc1csc(NC(=O)c2cccs2)n1	751209301	NIXJURHIHACVJB-UHFFFAOYSA-N	449.539	1.638	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNS(=O)(=O)c1ccc(F)c(C(F)(F)F)c1	751282908	RHYGLUUYLHAYPZ-UHFFFAOYSA-N	425.385	1.646	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)[C@@H]2CC(=O)N(CCOc3ccccc3Cl)C2)c1O	752286980	RYNVCMFTXVXJNG-CYBMUJFWSA-N	447.875	1.743	50	20	IDGD	
Cc1nnccc1C(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	753277874	ALOARXQCMZIAKX-UHFFFAOYSA-N	425.470	1.338	50	20	IDGD	
CC[C@@]1(c2ccccc2)NC(=O)N(NC(=O)COC(=O)/C(C#N)=C\c2ccc(O)cc2)C1=O	754538575	UWUCEGJZHSLQLR-RUCLTWSYSA-N	448.435	1.731	50	20	IDGD	
C[C@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(NC(=O)NNC(=O)c3cnn(C)c3)cc2)C1	755419295	BTPQOGAAYDKISC-OKILXGFUSA-N	434.522	1.553	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)[C@H]1CCC(=O)N1Cc1ccc(Br)cc1	756724187	KOQKHDUMOOWEIG-MRXNPFEDSA-N	431.290	1.725	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1N1CCOC1=O	756843735	IERZNSPYHJVDMG-UHFFFAOYSA-N	436.428	1.665	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Nc2ccn(-c3ncccc3F)n2)cc(OC)c1OC	757783062	QMZBWAVEPXJYBW-UHFFFAOYSA-N	430.396	1.899	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1)c1ccc2nnnn2c1	758204340	WRUQLTDQANWTQS-FQEVSTJZSA-N	427.468	1.512	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)NC[C@@H]1CC(=O)N(Cc2ccccc2)C1	758651065	AUCPAKFCCPDHGF-KRWDZBQOSA-N	426.473	1.453	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2cc(Br)ccc2N)n1	759998234	AQVQQQLPUJFTPQ-UHFFFAOYSA-N	427.280	1.343	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)CN(CCc2ccccc2)C(C)=O)c2ccccc2c1=O	761197453	DCXPFIKTYSNMSG-UHFFFAOYSA-N	449.511	1.659	50	20	IDGD	
Cc1cc(OCc2ccc(C(=O)NNC(=O)CN3CCN(C)C(=O)C3)cc2)ccc1Cl	763283910	LYSCYAJLBFHTEJ-UHFFFAOYSA-N	444.919	1.762	50	20	IDGD	
COc1cc(/C=C(\C#N)C(=O)Nc2ccc(S(N)(=O)=O)cc2)ccc1OCCC(=O)O	763370377	SDJGDFUHYQAQLG-GXDHUFHOSA-N	445.453	1.742	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc([S@@](=O)C(F)(F)F)cc1	763468933	YOOXRRCMWSGPEV-SSEXGKCCSA-N	444.347	1.622	50	20	IDGD	
COc1ncnc(N(C)C)c1NC(=O)C(=O)NNC(=O)c1sc2ccccc2c1Cl	763578718	PVGSXMYDCHDHTF-UHFFFAOYSA-N	448.892	1.819	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C(C)(C)C)cc2)cc1	763594019	FWQXJXJXBAEMAE-UHFFFAOYSA-N	427.457	1.936	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2c(C)c(C)nn2-c2ccc(C#N)cc2)c1	763619289	QNZJFGYCNNSUIJ-UHFFFAOYSA-N	446.467	1.834	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)C(=O)Nc2ccc(OC(F)F)c(F)c2)c2ccccc2c1=O	763790846	QFDQGYOMTCJROO-UHFFFAOYSA-N	449.345	1.074	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(C(=O)N3CCOCC3)ccc2C)cc1	763833822	ILLHJBGLQIGTNQ-UHFFFAOYSA-N	438.484	1.430	50	20	IDGD	
Cc1noc(COc2ccc(NC(=O)C(=O)NNC(=O)Cc3c[nH]c4ccccc34)cc2)n1	763861960	XFTHVHYMWMISPA-UHFFFAOYSA-N	448.439	1.767	50	20	IDGD	
COc1ncccc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1cccc(Br)c1	763882766	LPQUJUCZHPMIGQ-SNVBAGLBSA-N	437.250	1.406	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(-c3n[nH]c(C)n3)cc2)cc1OC	763903947	WXMDUZBGGUNHDU-UHFFFAOYSA-N	438.444	1.587	50	20	IDGD	
O=C(NNC(=O)c1ccc(Br)s1)C(=O)Nc1ccn(CC(F)(F)F)n1	763941419	QBHWLLRVRFOTJK-UHFFFAOYSA-N	440.201	1.669	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)C(=O)N1C[C@H]2CCCN2c2ccccc21	763951098	YVZYZPJRDJKACD-MRXNPFEDSA-N	446.467	1.355	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc[nH]2)n([C@H]2CCN(Cc3ccccc3)C2)n1	763979190	JWJXCJUUKRVRSS-KRWDZBQOSA-N	435.488	1.366	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cccn2C)nn1CCCOc1ccc(F)cc1	763993258	NBKUYHKJKVWEAP-UHFFFAOYSA-N	442.451	1.538	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)C(=O)Nc1ccc(C(=O)NCc2ccc(F)cc2)cc1	763995336	GTZOSZAXWYCIPI-UHFFFAOYSA-N	437.431	1.494	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)nn1-c1cccc(F)c1	763996113	VHZNPJPQFYEWSO-UHFFFAOYSA-N	449.240	1.810	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)C(=O)Nc1ccc(Oc2cccc(F)c2)cc1	763996973	HPAXPJZLKHVNRC-GFCCVEGCSA-N	435.433	1.139	50	20	IDGD	
O=C1CSc2ccc(NC(=O)C(=O)NNC(=O)c3cc(-c4ccccc4)on3)cc2N1	764017528	ZGTRYCHURUXVEK-UHFFFAOYSA-N	437.437	1.786	50	20	IDGD	
O=C(Cc1ccsc1)NNC(=O)C(=O)Nc1cccc(C(=O)NCc2ccccn2)c1	764034798	KGURVWJGXKUKNW-UHFFFAOYSA-N	437.481	1.402	50	20	IDGD	
CNC(=O)[C@@H]1CN(C(=O)C(=O)NNC(=O)c2ccc3ccccc3c2)c2ccccc2O1	764061369	CWEBYVQFEQCSDW-IBGZPJMESA-N	432.436	1.141	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)C2CCCC2)cc1NC(=O)CN1CCCCC1	764067078	WUYPGJPGNGJPTL-UHFFFAOYSA-N	429.521	1.696	50	20	IDGD	
CCCc1c(NC(=O)C(=O)NNC(=O)c2ccc(C#N)cc2)cnn1-c1cc(C)ccn1	764180175	XRBXXYDGHXLEGF-UHFFFAOYSA-N	431.456	1.800	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)C(=O)N1C[C@@H]2CCCN2c2ccccc21	764204135	SNMIHXKFEZWCER-HNNXBMFYSA-N	445.520	1.454	50	20	IDGD	
O=C(Cc1ccccn1)NNC(=O)C(=O)Nc1ccc(-c2n[nH]c(-c3ccccc3)n2)cc1	764263608	HEFJZTBESNPUFZ-UHFFFAOYSA-N	441.451	1.862	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1ccc(OCc2ccccc2)nc1	764275013	HMBZHWYQROOQNF-UHFFFAOYSA-N	436.424	1.531	50	20	IDGD	
C#CCOc1cccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3OC)[nH]n2)c1	764377988	UPKQWZUBAMHBCP-UHFFFAOYSA-N	433.424	1.497	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)C(=O)Nc1cnc(Cl)c(Br)c1C	764386290	WBJLEJADQWLDHM-UHFFFAOYSA-N	426.658	1.909	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)cc(OC)c1	764386597	BPQIDFOVEYOHRM-UHFFFAOYSA-N	427.392	1.633	50	20	IDGD	
CCN1CCc2ccc(NC(=O)C(=O)NNC(=O)CSc3ccccc3OC)cc21	764392871	ABAWIZZZSKFSAF-UHFFFAOYSA-N	428.514	1.956	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3csc(N4CCOCC4)n3)n[nH]2)cc1	764558006	FCYOLOUOAWXKFT-UHFFFAOYSA-N	428.474	1.453	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNc2ccc(Cl)nn2)cc(Br)c1F	764661503	CQTDIZJAPFHSKB-UHFFFAOYSA-N	446.620	1.900	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NN=Cc3csc(C4CC4)n3)CC2)cc1	764819003	NVMPIYFCTWZLBC-UHFFFAOYSA-N	447.586	1.786	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C3CCN(S(=O)(=O)CC)CC3)n[nH]2)cc1	765577126	XFUHBJFNDWNNLS-UHFFFAOYSA-N	433.534	1.462	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)CCn2cnc3c(C)cccc3c2=O)n[nH]1	765592700	PIMSHADZXPDJPC-UHFFFAOYSA-N	446.467	1.955	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)N1CCN(c2ccc(NS(C)(=O)=O)cc2)CC1	767187435	QRWWCOLQZVNGFC-UHFFFAOYSA-N	431.518	1.543	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)c1ccccc1S(=O)(=O)CCN(C)C	767204157	IBICROBZGGOBEC-UHFFFAOYSA-N	439.921	1.759	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)O[C@@H]2CCCNC2=O)cc1	767268587	QVYOIUYHZSZDIX-HAZIXKIPSA-N	437.456	1.163	50	20	IDGD	
COC(=O)c1ccc(C(C)=NNC(=O)C(=O)NN=C(C)c2ccc(C(=O)OC)cc2)cc1	767744166	YHWWACLDSJXFSB-UHFFFAOYSA-N	438.440	1.640	50	20	IDGD	
COc1ccccc1NC(=S)NNC(=O)CN1C(=O)N[C@]2(CCCC(C)(C)C2)C1=O	768559558	CZQNLLZCPJHXOO-FQEVSTJZSA-N	433.534	1.904	50	20	IDGD	
CCCn1nc(C(=O)NNS(=O)(=O)c2ccc(C)nc2Cl)c2ccccc2c1=O	769651915	UYQQJEMGLJVWLT-UHFFFAOYSA-N	435.893	1.787	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)[C@H](C)NS(=O)(=O)c3ccc(C)cc3)n[nH]2)cc1	770991810	JPGDFRBHXIDRIN-HNNXBMFYSA-N	441.513	1.822	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccccc1	771848547	BTUFBXLGPKOCPO-NVXWUHKLSA-N	439.534	1.355	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)c1cn(-c2ccc(C(F)(F)F)cn2)nn1	772069503	QMHBWNYFDDEQDK-SNVBAGLBSA-N	428.371	1.420	50	20	IDGD	
O=C(NNC(=O)c1ccn(-c2ccc(Cl)cc2Cl)n1)N[C@@H]1CCS(=O)(=O)C1	772159035	UKDKDYBHBXHZGN-SNVBAGLBSA-N	432.289	1.310	50	20	IDGD	
CCOC(=O)c1cnc(C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c(Cl)c1	772707778	UBAKTDRZZVPGJE-UHFFFAOYSA-N	429.820	1.233	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)C[C@@H](O)c3cccc(F)c3)CC2)cc1	772809144	DKDZFMRISWRULG-OAQYLSRUSA-N	428.508	1.523	50	20	IDGD	
CCOC(=O)c1c(NC(=O)NNC(=O)c2ccc(Cl)nc2)c(C#N)cn1CCOC	775766306	XRSWQURCHGFYRQ-UHFFFAOYSA-N	434.840	1.698	50	20	IDGD	
CN(NC(=O)c1ncn(-c2ccccc2)n1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776201227	GYHBZIQKVIXFJQ-UHFFFAOYSA-N	429.481	1.517	50	20	IDGD	
Cc1cccc(N2C(=O)N[C@H](CCC(=O)NNc3cccc(S(C)(=O)=O)c3)C2=O)c1	776534076	BWLAHCYDKGYQOT-QGZVFWFLSA-N	430.486	1.747	50	20	IDGD	
CC(C)(C)OCc1cc(CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)no1	776844768	LXLFWWKVGZEQPQ-UHFFFAOYSA-N	438.510	1.427	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)nn1-c1ccc(F)cc1	777275662	VUHGPOKAPKRZLA-UHFFFAOYSA-N	430.465	1.688	50	20	IDGD	
COc1ccc(N2CCN(C(=O)/C=C/C(=O)NNC(=O)c3ccccc3F)CC2)cc1	778218787	ZNUGDYBDUJKNJF-ZHACJKMWSA-N	426.448	1.500	50	20	IDGD	
N#Cc1ccc(-c2ccc(OCC(=O)NNC(=O)CNC(=O)c3cccc(O)c3)cc2)cc1	778291632	XNBPMSYOTACNJJ-UHFFFAOYSA-N	444.447	1.887	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)c2cccc(S(=O)(=O)NCC3CC3)c2)nc1C	778427006	SVJQVNOOIPLSMB-UHFFFAOYSA-N	433.490	1.407	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)NC2CCN(S(=O)(=O)C3CCOCC3)CC2)c1	780832566	KMYBIPCOQYMGEM-UHFFFAOYSA-N	440.522	1.073	50	20	IDGD	
COc1ccc(NNC(=O)C2CCN(c3ccc4nnc(C(F)(F)F)n4n3)CC2)nc1	781534266	HPDHQTKRJQNIDY-UHFFFAOYSA-N	436.398	1.906	50	20	IDGD	
C[C@H]1Oc2ccc(C(=O)C3CCN(S(=O)(=O)CBr)CC3)cc2NC1=O	782433888	KJAFTGJZXXUJQG-SNVBAGLBSA-N	431.308	1.983	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C(=O)Nc2ccc(-c3csnn3)cc2)nc2ccccc21	782888407	XDNHKNPTPHZTQW-UHFFFAOYSA-N	435.469	1.420	50	20	IDGD	
COc1cc(C(=O)N(C)C)ccc1NC(=O)C(=O)NNc1ncccc1C(F)(F)F	783113351	XEYWBKDAGKDYHR-UHFFFAOYSA-N	425.367	1.893	50	20	IDGD	
Cc1ccccc1NC(=O)NNC(=O)C(=O)Nc1ccc(NC(=O)CCN(C)C)cc1	783413795	JNTWVPATSASLNF-UHFFFAOYSA-N	426.477	1.677	50	20	IDGD	
O=C(Nc1ccccc1)Nc1cccc(NC(=O)C(=O)NNC(=O)C(=O)N2CCCC2)c1	783999506	PAOLTFPVSBQHOW-UHFFFAOYSA-N	438.444	1.039	50	20	IDGD	
Cc1ccc(-c2csc(NC(=O)C(=O)NNC(=O)CNC(=O)c3ccco3)n2)cc1C	784001655	ADWJHJILZSMYAJ-UHFFFAOYSA-N	441.469	1.536	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1cccc(-c2noc(C)n2)c1	785340172	XHUVFZIIGMSLSM-UHFFFAOYSA-N	445.457	1.539	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)N[C@H]1CCCN(C2CCCCC2)C1=O	785924959	QSHAFGSWOXJXCY-INIZCTEOSA-N	426.477	1.603	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)NCc1ncnn1-c1ccccc1	787349287	YCRAEQZLQXPLFI-UHFFFAOYSA-N	445.277	1.939	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(C)c(C(=O)NNc2ccc(-n3ccnc3)nn2)c1	788180567	AGQOHMRDGGXCSO-UHFFFAOYSA-N	429.506	1.758	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)c2cnn(CCN(C)C)c2-c2ccccc2)cc1	788271976	PIQOVRHZAWLYMW-UHFFFAOYSA-N	436.516	1.993	50	20	IDGD	
O=C(NNc1nnc(-c2ccccn2)s1)c1cccc(S(=O)(=O)N2CCOCC2)c1	788563568	LEXNYTNNXJZVSH-UHFFFAOYSA-N	446.514	1.378	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C2CCC(NC(=O)C(C)(C)C)CC2)c2ccccc2c1=O	788721449	UVFFGWOPPICVSS-UHFFFAOYSA-N	441.532	1.899	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(C#N)cn1C(C)(C)C	789731947	LHSDLDMFJJNTDF-UHFFFAOYSA-N	427.461	1.678	50	20	IDGD	
O=C(NCCCN(C1CC1)S(=O)(=O)c1cccc(F)c1)NNc1nc2ccccn2n1	790436384	ADVLIGJCPQPVBW-UHFFFAOYSA-N	447.496	1.738	50	20	IDGD	
O=C(N[C@H]1CCS(=O)(=O)C1)[C@H]1CCCC[C@H]1C(=O)NNc1cccc(F)c1[N+](=O)[O-]	791150292	LLVKJQGTMXDIFZ-RWMBFGLXSA-N	442.469	1.287	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccc(OC(F)F)c(C(F)(F)F)c2)n1	797001202	ZEFCBOODYOAJQO-UHFFFAOYSA-N	449.336	1.906	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNc2ccnc(N(C)C)n2)cc(Br)cc1[N+](=O)[O-]	797538991	SIEVRDSJLLYYCP-UHFFFAOYSA-N	438.242	1.604	50	20	IDGD	
CCn1ncc2cc(C(=O)NNC(=O)CCN3CCN(c4ccccc4)CC3)c(C)nc21	799294007	TXAATGAGPKDZDD-UHFFFAOYSA-N	435.532	1.733	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)c1nn(-c2ccc(F)cc2F)cc1O	801413179	JAXUJCCEXRAMII-UHFFFAOYSA-N	444.394	1.711	50	20	IDGD	
COCCNS(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccc(Cl)cc2)c1	802023812	VKATXHQVFIYEGS-UHFFFAOYSA-N	426.882	1.731	50	20	IDGD	
O=C1CN(c2ccc(NC(=O)NNc3ccc(-n4ccnc4)nn3)cc2Cl)CCN1	806210121	FDAKGGCPDIKKOQ-UHFFFAOYSA-N	427.856	1.401	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1ccc2ncn(-c3ccc(Cl)cc3)c2c1	806327004	YEEGKKNYVNMRNB-CYBMUJFWSA-N	432.889	1.875	50	20	IDGD	
CC(C)Oc1ccc([C@@H](CNC(=O)NNC(=O)CNC(=O)c2cccs2)N(C)C)cc1	807591944	JTHAMKCVUPQSTF-QGZVFWFLSA-N	447.561	1.898	50	20	IDGD	
CCCCOc1ccc(C(=O)NN=Cc2c(N(C)C)n(C)c(=O)n(C)c2=O)cc1OC	807956179	JPEUZBRIBFJWBZ-UHFFFAOYSA-N	431.493	1.101	50	20	IDGD	
Cc1cc(C(F)(F)F)nn1CC(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12	809932787	DXKLVJNULGKYGA-UHFFFAOYSA-N	436.394	1.962	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)c1cn(C2CCOCC2)nn1	809981468	LZWQJOFINXBURD-LLVKDONJSA-N	438.282	1.621	50	20	IDGD	
COc1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2ccc3ccccc3c2)cc1OC	810164345	FJFRCXGKCYQCOE-UHFFFAOYSA-N	443.481	1.597	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)Nc2cc(C(N)=O)ccc2OCC(F)F)c1	810341421	JTPPOVPSHTZZEP-UHFFFAOYSA-N	428.417	1.982	50	20	IDGD	
CC(C)(C(=O)NNC(=O)C(=O)Nc1cc(C(N)=O)ccc1OCC(F)F)c1ccccc1	810387000	ATEPVDLPQVLBII-UHFFFAOYSA-N	448.426	1.493	50	20	IDGD	
N#Cc1ncn(-c2ccccc2NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2Cl)n1	810391541	GUTMPBXTFMJRQH-UHFFFAOYSA-N	444.238	1.845	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(OCCCCl)cc2)CC1)N[C@H]1CCS(=O)(=O)C1	811465451	FNEMKYILNXYDKM-SFHVURJKSA-N	443.997	1.115	50	20	IDGD	
CC(C)(C)OC(=O)NC/C=C/CNC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	812466196	KQEDQPDSWKYHMH-AATRIKPKSA-N	441.510	1.507	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)N[C@H]2c3ccccc3CC23CCOCC3)c2ccccc2c1=O	812562367	RKGKGKQNBDWMIB-FQEVSTJZSA-N	447.495	1.972	50	20	IDGD	
CC(=NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1)c1cccc(O[C@H](C)C(=O)O)c1	814746382	FNOKSRIJPVCMGM-LLVKDONJSA-N	439.877	1.993	50	20	IDGD	
N#Cc1cccc(COc2ccc(NC(=O)C(=O)NNC(=O)[C@H]3CCCO3)cc2F)c1	815778917	KAABPCCJWJXTEZ-GOSISDBHSA-N	426.404	1.541	50	20	IDGD	
Cc1ccc(NC(=S)NNC(=O)CCc2c(C)nc(N3CCOCC3)nc2O)cc1C	836476078	GBRDQKAWPPSKND-UHFFFAOYSA-N	444.561	1.894	50	20	IDGD	
COc1ccc(-c2nnc(SCC(=O)NNC(=O)COc3ccc(C#N)cc3)o2)cc1	864016373	QNIYDOQDFDDPRH-UHFFFAOYSA-N	439.453	1.935	50	20	IDGD	
CC(=O)Nc1cccc(NC(=S)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)c1	913143467	CRMRZEZGQCYFKN-UHFFFAOYSA-N	449.558	1.592	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)CCNS(=O)(=O)c2cccc(Cl)c2)c(C)c1	913164866	VUTZLWBONMYYDN-UHFFFAOYSA-N	438.937	1.885	50	20	IDGD	
C[C@@H]1CC(C)(C)C[C@@]2(C1)NC(=O)N(CC(=O)NNC(=O)Cn1cnc3ccccc31)C2=O	913495820	OZNRMSYUCLGFOW-JLCFBVMHSA-N	440.504	1.321	50	20	IDGD	
CN1CCN([C@H](CNC(=O)NNC(=O)COc2ccccc2F)c2cccs2)CC1	915901527	JHTYWBBFJPRPBA-MRXNPFEDSA-N	435.525	1.585	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)N[C@@H](C)c2nnc3ccccn23)c2ccccc2c1=O	916222224	XKYJMKUPRHMOTQ-AWEZNQCLSA-N	448.487	1.945	50	20	IDGD	
CCOc1ccc(CNC(=O)NNC(=O)c2nn(CC)c(=O)c3ccccc23)cc1OC	916391317	HOMNNGZSNIKUHA-UHFFFAOYSA-N	439.472	1.968	50	20	IDGD	
COc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NNC(=O)c2ccc3ccccc3c2)cc1	918111704	DWTGQGNXXNXLJK-AWEZNQCLSA-N	427.482	1.976	50	20	IDGD	
C[C@H]1CN(c2ccc(CNC(=O)NN[C@@]3(C)CCS(=O)(=O)C3)cc2F)C[C@@H](C)O1	918219032	CACYKQBPVJITGK-KSMMKXTCSA-N	428.530	1.320	50	20	IDGD	
CC(=O)N[C@H](CC(=O)NNC(=O)NCC(F)(F)F)c1ccc(Br)cc1	918707097	QYYIIQRUWNRPKN-LLVKDONJSA-N	425.205	1.909	50	20	IDGD	
CC(C)(C)C(=O)N1CCC[C@@H](C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)C1	920338646	VCDYEAAIZVOKMV-LJQANCHMSA-N	443.592	1.631	50	20	IDGD	
CCCNC(=O)NNC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(Br)cc2)C1	921040951	QWQDNGFOTFIOMX-LBPRGKRZSA-N	447.355	1.590	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)Cc2ccccc2NS(C)(=O)=O)cc1	1251761837	QQOFLZNHMOKOEO-AWEZNQCLSA-N	435.502	1.614	50	20	IDGD	
CN1C(=O)c2ccc(S(=O)(=O)NNC(=O)c3ccc(Br)cc3)cc2C1=O	1317787217	JVKJRZJAIWPZFB-UHFFFAOYSA-N	438.259	1.298	50	20	IDGD	
COc1cccc(C[C@@H](C(=O)NNC(=O)c2cncn2-c2ccccc2)n2nnnc2C)c1	1317886604	UPFDWAVUHVVHKZ-IBGZPJMESA-N	446.471	1.421	50	20	IDGD	
NC(=O)C1CCN(c2ncccc2CNC(=O)NNC(=O)c2ccccc2Cl)CC1	1318550876	IIBDSBFGKZQYDW-UHFFFAOYSA-N	430.896	1.581	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)c1cncc(OCC(F)F)c1	1319373579	HQFSVOWFEZGLHV-UHFFFAOYSA-N	433.459	1.699	50	20	IDGD	
COc1cccc(CCC(=O)N2CCO[C@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)n1	1779293788	BYMKWIJERILLGI-NRFANRHFSA-N	435.597	1.704	50	20	IDGD	
COc1ccnc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)c1OC	1780452700	KNVIQEZKAIHJEI-OALUTQOASA-N	446.331	1.779	50	20	IDGD	
CC(=O)NC(C)(C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Br)C1	1780770220	IMISUJKSUSEIAE-IIYDPXPESA-N	436.322	1.106	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](F)Br)C2)nn1C	1780771075	RWMVFXBGDGOBFJ-CKEIUWERSA-N	431.306	1.547	50	20	IDGD	
CC(C)NC(=O)OC(C)(C)C(=O)N1CC[C@@]2(CN(C(=O)C(C)(C)CCl)CCO2)C1	1781017132	FORIJXKFFHNRTR-FQEVSTJZSA-N	431.961	1.995	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)nc2nccn12	1781234126	IQYIRQLWWLMDNM-RBUKOAKNSA-N	440.331	1.718	50	20	IDGD	
COc1ccc(OCC(=O)N2CCO[C@]3(CCN(C(=O)[C@H](F)Br)C3)C2)cc1	1781324616	BAMXOXOPMLBTLC-FUHWJXTLSA-N	445.285	1.594	50	20	IDGD	
Cc1nccn1CC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)CBr)C2	1781553507	FFOKCMJFKZTLJC-IDHHARJASA-N	441.370	1.736	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1c(C)noc1N)C2	1781899743	FJLVPCWSXXGITR-SNUQEOBHSA-N	443.342	1.866	50	20	IDGD	
O=C(c1cn[nH]c1)N1CCO[C@]2(CCN(C(=O)[C@@H](Br)Cc3ccccc3)C2)C1	1783022565	JYVXPVGESFTHPT-PXNSSMCTSA-N	447.333	1.859	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)CNC(=O)c3cccs3)CCO2)C1	1783532623	QEGMRWLOWBKQMF-SJCJKPOMSA-N	444.351	1.091	50	20	IDGD	
COC(=O)c1ccc(CC(=O)N2CCO[C@]3(CCN(C(=O)C(Cl)Cl)C3)C2)s1	1783948274	HKBDMMDEITUTGD-QGZVFWFLSA-N	435.329	1.711	50	20	IDGD	
Cc1nccn1[C@@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]2C1	1783975033	YKTSSMQYOXNANW-PTTAZLHSSA-N	441.370	1.763	50	20	IDGD	
COc1ccc([C@@H]2C[C@@H]2C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](O)CCl)C[C@@H]32)cc1	1784424949	FEBDVBMALBTOFL-ZXIXUEFNSA-N	436.936	1.378	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](CN)c3ccccc3)[C@H]2C1	1786924613	MDYQCWUGZGTFSF-QSGXVVIFSA-N	438.366	1.492	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3Cc4ccccc4CN3)[C@H]2C1	1787412188	UHRLWQCFRXUNCY-MUGJNUQGSA-N	433.980	1.946	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3c(F)cncc3F)[C@H]2C1	1789011523	BFIYPIFAVWLQQC-ZHPDPMBESA-N	432.265	1.737	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(C)(C)NC(C)=O)C[C@@H]21	1790958602	VXIBWEYVTUADKQ-XQLPTFJDSA-N	432.359	1.054	50	20	IDGD	
O=C(/C=C/c1cnccn1)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1	1791925004	PRWVRUFHFHVILY-ZHACJKMWSA-N	442.284	1.618	50	20	IDGD	
CCC[C@@H](NC(C)=O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]21	1792184689	HQSYPQUORSPBMN-KSPMYQCISA-N	436.380	1.507	50	20	IDGD	
C[C@@H](NNc1ccccc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CO[Si](C)(C)C)C2	1792507186	YXJKTBYIJOTBLP-PDOICOKGSA-N	434.613	1.433	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccccc1O)C2	1792872276	VWNJWKJDVYYWGF-FRQROOTJSA-N	425.323	1.555	50	20	IDGD	
COCCCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN(C)NC(=O)NCc1ccccc1)C2	1792950125	NUKCKXSKLVEBHF-ACDBMABISA-N	445.564	1.397	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCl)c1ccc(CCN2CCCC2)nc1	1793112149	GAQJJJBRIAGWNP-IYWMVGAKSA-N	434.968	1.571	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc3cc(C)ccn3c1=O)C2	1793449990	XAXUQQAFHLIRAA-LORHWOILSA-N	446.935	1.614	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3cnccc3n1)C2	1795114419	GQHRWVNJVYOPIF-ZSBFGKGUSA-N	433.306	1.618	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCN1CCN(C)CC1	1795886524	HACKBEHAWKPFTL-YYIAUSFCSA-N	429.403	1.436	50	20	IDGD	
COc1cccc(/C=C/C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)c1	1796190450	YPECVBILFICNDK-UKGLUTESSA-N	434.301	1.340	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)[C@H]1CCc2ccccc2O1	1796192114	JZERBEYABIFNBP-XAPVIXHLSA-N	434.301	1.012	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1nnc2cc(C)nn2c1C	1796924017	RSNXRQQNMZNBCC-BASYENTBSA-N	434.928	1.352	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(-c2cccnc2)[nH]n1	1798160597	XLOPWDVDMFZOPW-DPYKFYPSSA-N	448.321	1.458	50	20	IDGD	
Cc1cc(F)cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)c1	1798442070	UUTAPJBLJCVEAL-BJWYYQGGSA-N	425.464	1.698	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc(-c3ccccn3)nc1)C2	1799264800	VRMBHGXVTGSLDF-KYHPRHEASA-N	429.908	1.759	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@](C)(Cl)CCl	1799279369	LIVSUSKTEQUZFF-IXRFVVGDSA-N	430.170	1.986	50	20	IDGD	
Cc1cccc2c(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)CO[Si](C)(C)C)C4)n[nH]c12	1800071044	LHIOMVOPUJXOOA-CCWDJLKJSA-N	430.581	1.926	50	20	IDGD	
CC(C)=NO[C@H](C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2	1800220069	IPIBBCWHZQJHIM-CXRKSGDCSA-N	430.509	1.560	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)[C@@H]1Cc2ccccc2N1	1800318843	TVSHBIJWJFENMO-PTNZTPPNSA-N	426.286	1.303	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3nc[nH]c3c1)C2	1800640647	CYHXNWQVYOFVLE-LOUJCGABSA-N	435.322	1.940	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3nccn3c1)C2	1800640848	ISJDSRHRILSGRE-JYYAWHABSA-N	435.322	1.711	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)NNc1ccccc1)C2	1800754901	YJMYKSUQPVPPAW-WVCIDPQESA-N	439.354	1.365	50	20	IDGD	
CC[C@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](C)[C@H]1SC(=N)NC1=O)C2	1801801977	QIRPFGXSZGZVJC-HTXLXMOSSA-N	445.383	1.601	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1n[nH]c3cc(Cl)ccc13)C2	1802337215	KPVCCYYJFFJHFE-QDMKHBRRSA-N	446.939	1.841	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1CCN(C(=O)c2ccc(O)nn2)[C@@H]1c1cccnc1	1803009498	RFCQUPOGRBETEQ-HACGYAERSA-N	448.321	1.928	50	20	IDGD	
COc1cccc(CCC(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)n1	1803135893	KAKDOJWRQOYBMR-PLMTUMEDSA-N	446.935	1.724	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@@H](O)C(=O)N1CCCC2(CCN(C(=O)[C@H](F)Cl)CC2)C1	1805408805	UTOSVVXLIJBYRZ-KGLIPLIRSA-N	435.924	1.638	50	20	IDGD	
Cc1cncc(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)c1	1805768201	ZQGVCIIDTXHFQB-UGKGYDQZSA-N	444.300	1.098	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)Br)[C@@H]1c1cccnc1	1808435847	ZQFSUPHKJGASFK-UTJXIGIESA-N	439.354	1.738	50	20	IDGD	
Cc1[nH]ccc1C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1	1808751084	HBHFOWYMPJIOGI-OXQOHEQNSA-N	447.499	1.350	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)c2ccncc2)[C@H]1c1cccnc1	1810299179	NXFKWJNDXRGWRY-PXNSSMCTSA-N	445.483	1.109	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1CCN(C(=O)CCc2nc(N)n[nH]2)[C@@H]1c1cccnc1	1810545898	HDHQNXGWNWOJPC-HNAYVOBHSA-N	445.600	1.272	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)C(Cl)Cl)[C@H]1c1cccnc1)[C@H]1CCCS1(=O)=O	1812497862	CAJSRVQOOITSIH-MJBXVCDLSA-N	434.345	1.468	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H](CNC(=O)CCC(N)=O)[C@H]1c1cccnc1	1812625959	CRMWWVUIRGMRTN-SUYBPPKGSA-N	425.327	1.384	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1	1813016919	IILYRIBFMKXYFZ-QXCZDIPSSA-N	449.935	1.443	50	20	IDGD	
C[C@H](CS(C)(=O)=O)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CO[Si](C)(C)C)[nH]n1	1815229394	GZDDNUSDVRCETH-HIFRSBDPSA-N	444.630	1.934	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@H]1CCC(F)(F)C1)CC2)c1ccc(B(O)O)cc1	1815335999	WFEXGUVERWEOCF-GXTWGEPZSA-N	449.288	1.484	50	20	IDGD	
Cc1nc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)cs1	1815354725	BYARGYFINCLIOE-ZDUSSCGKSA-N	442.331	1.127	50	20	IDGD	
O=C(/C=C/c1ccoc1)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1815749353	LSPIGARXBKJKGT-IHHMQQGQSA-N	434.261	1.702	50	20	IDGD	
O=C(CS(=O)(=O)N1CCCC1)N[C@@H]1CCc2nc(NC(=O)[C@@H](F)Cl)sc2C1	1817121257	DHBXELKMEZLSGG-NOZJJQNGSA-N	438.934	1.015	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(F)n2)[nH]n1)c1cccc(B(O)O)c1	1817476967	UZQMMGVQEGSRLP-KRWDZBQOSA-N	437.240	1.243	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@@H]2CCCS2)[nH]n1)c1cccc(B(O)O)c1	1817479940	VZFSZTKJCIOGLO-SJORKVTESA-N	428.323	1.291	50	20	IDGD	
Cc1cc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2cccc(B(O)O)c2)CC3)cn1C	1817695282	IUYBACDAQFZHTR-MRXNPFEDSA-N	438.318	1.009	50	20	IDGD	
COCCCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819401866	WHRICQWSRWBXJJ-MRXNPFEDSA-N	429.481	1.141	50	20	IDGD	
CNC(=S)NCCC(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](F)Br)[nH]n1	1819408039	VZIPLHPHQNYQBC-MFKMUULPSA-N	449.350	1.576	50	20	IDGD	
Cc1nc[nH]c1CSCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](O)CCl)CC2	1819627187	KOMMLQORQADHAQ-ZWNOBZJWSA-N	443.982	1.620	50	20	IDGD	
COc1ccc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@H](C)Br)CC3)nn1	1821073132	NDKYXZXYWCRLBI-DTWKUNHWSA-N	440.323	1.951	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)c3cc(=O)ccn3C)sc2C1	1821318523	CSZWNCZIPJMFPQ-ZJUUUORDSA-N	439.335	1.851	50	20	IDGD	
C[C@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1)C1(O)CCC1	1822412575	RRWUJTMBWMDPIN-GDBMZVCRSA-N	434.541	1.326	50	20	IDGD	
N#Cc1ccc2[nH]nc(C(=O)Nc3nc4c(s3)C[C@@H](NC(=O)[C@@H](O)CCl)CC4)c2c1	1823888769	OMJOFBCBEXEGKO-HZMBPMFUSA-N	444.904	1.717	50	20	IDGD	
C=CCO[C@@H](C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1	1824507246	KCPFUVCYWYAZGD-OXJNMPFZSA-N	443.548	1.510	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1CCc2nc(NC(=O)Cn3ccncc3=O)sc2C1	1824536701	VOMQJPBZDIKRQF-GFCCVEGCSA-N	435.582	1.164	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)CCNC(C)=O)sc2C1	1825246960	VRWZQXISJLAHIE-WDEREUQCSA-N	431.356	1.755	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnc(O)nc1O)CC2	1825640904	KWLWJPKNFJDLBZ-RNFRBKRXSA-N	442.295	1.354	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)C1CCSCC1)CC2	1826092099	LUXKKNKLURHLLF-ZDUSSCGKSA-N	439.607	1.571	50	20	IDGD	
COC[C@@H](NC(C)=O)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CCBr)CC1	1826358616	JDZVVANGAWCWCE-SJORKVTESA-N	446.386	1.542	50	20	IDGD	
Cc1nccc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)n1	1827052946	POFZIYRCMPJIFB-NRFANRHFSA-N	436.321	1.012	50	20	IDGD	
O=C(c1cccnc1S)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1829798925	RZGBUOXSZNIBKQ-WBMJQRKESA-N	448.314	1.131	50	20	IDGD	
CN1CCC(CC(=O)N2CCO[C@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)CC1	1829995605	AWCROKSKNXYEEL-OAQYLSRUSA-N	429.989	1.440	50	20	IDGD	
CC(C)(C)OC(=O)CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830353967	QDYOIXWXPKAJLL-HXUWFJFHSA-N	432.945	1.440	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cncs3)C2)C1	1830537559	KFDRJGJMKBIDLN-WBMJQRKESA-N	432.340	1.244	50	20	IDGD	
O=C(C(Cl)Cl)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1CCc3ccoc3C1)CCO2	1830940302	IDLPITNYJCGJKG-KUHUBIRLSA-N	431.316	1.645	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)CBr)C2)C1	1831639342	QOHVKBFMBKLKAL-KEYYUXOJSA-N	439.778	1.881	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CNC(=O)OC(C)(C)C)C2)C1	1831657995	RVIWUNWHWINIIQ-YWZLYKJASA-N	447.960	1.375	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](CC)N(CC)CC)CCO2	1831662172	NMNWFNFXOWNSKG-WFXMLNOXSA-N	432.005	1.971	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@H](C)CS(C)(=O)=O)CC1	1831827740	JLHMQLITXCRJFD-PVAVHDDUSA-N	437.002	1.541	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)/C=C/c3cccnc3)CCO2)C1	1833103086	NWVMKYKLMDQUQZ-IKLBINMZSA-N	442.343	1.788	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3nccc4occc34)CC2)CC1)[C@H](O)CCl	1833310178	AVYAGQNBCDDHPY-QGZVFWFLSA-N	434.924	1.613	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)c3cn(C)cn3)CC2)CC1	1834284645	DMZCVBCVNSGBIC-AWEZNQCLSA-N	440.386	1.636	50	20	IDGD	
CC(=O)N(C)CCC(=O)N1CCC(N2CCC(NC(=O)CCBr)CC2)CC1	1834422698	YERZKQMOMNIIQB-UHFFFAOYSA-N	445.402	1.211	50	20	IDGD	
Cc1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)CCBr)CCO2)C1	1834821413	ISOWQKMSMUOPTQ-SFHVURJKSA-N	426.311	1.245	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CCC(N2CCC(NC(=O)[C@@H](F)Cl)CC2)CC1	1835083930	ZUTGQDLZADUQBR-RCCFBDPRSA-N	443.947	1.848	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)Nc1cccnc1)CCO2	1835684059	CDTMDMDXPDTGPJ-PLMTUMEDSA-N	438.956	1.746	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)c1cc(F)ccc1F	1836220974	KYUHVXRWFBYHTJ-SFHVURJKSA-N	429.895	1.750	50	20	IDGD	
O=C(c1cccc2ncsc12)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1837070669	MWTDZZZSQCNMLB-YJBOKZPZSA-N	427.885	1.901	50	20	IDGD	
O=C(c1ccnnc1)N1CCC(OC2CCN(C(=O)[C@H](F)Br)CC2)CC1	1837427826	IDUZULMLPWLIBS-HNNXBMFYSA-N	429.290	1.779	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)/C=N/O[C@H]3CCCCO3)CCO2)C1	1837525403	NWUZCSBHBBGPDH-VRFIZVPASA-N	445.944	1.237	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3c(F)cncc3F)CCO2)C1	1838168153	BXLBWTYTCAQBQW-PIGZYNQJSA-N	448.264	1.213	50	20	IDGD	
Cc1nc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)sc1C	1838409660	JOSZSMPDUBYNRZ-LJQANCHMSA-N	441.626	1.681	50	20	IDGD	
Cc1cnc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)s1	1839198071	RPACUJIYJOJXLC-XHDPSFHLSA-N	436.303	1.212	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(O)c([N+](=O)[O-])c3)CCO2)C1	1839274599	HKILQNFAIYULOG-IFXJQAMLSA-N	441.868	1.388	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccs3)C2)C1	1839963193	CXTMGFIEPMKARF-CXAGYDPISA-N	431.352	1.992	50	20	IDGD	
Cc1ccncc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2	1840032792	KFXQYYUSZUTCHO-KDOFPFPSSA-N	426.311	1.243	50	20	IDGD	
Cc1ccnc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)c1	1840033249	YPDQLJRLENAXBR-KSSFIOAISA-N	426.311	1.243	50	20	IDGD	
O=C(c1cnc2ccccn12)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840188499	NCRKSKYIGSFMGX-GOSISDBHSA-N	427.288	1.208	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CCCn3cccc3)CCO2)C1	1840463261	YXJQWJUOIUYADC-LPHOPBHVSA-N	442.354	1.508	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3cc(F)ccc3F)CCO2)C1	1840810877	IGRBJFRCPMGXOW-UZLBHIALSA-N	430.879	1.981	50	20	IDGD	
O=C([C@@H]1C[C@H]1c1ccc(F)c(F)c1)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843010439	PVRKOFIAAWCTML-ZWKOTPCHSA-N	440.255	1.265	50	20	IDGD	
CCOC(=O)c1ncn2cc(C(=O)N3CCCC34CN(C(=O)[C@H](Cl)COC)C4)ccc12	1843125256	JFWUPURVECGOLU-OAHLLOKOSA-N	448.907	1.582	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1ccc(OCC3CC3)cc1)C2	1844265541	NBSZPPYVPSKKNY-UHFFFAOYSA-N	449.511	1.605	50	20	IDGD	
O=C1CCCN1CC(=O)N1CC2(CCCN2C(=O)[C@H](Br)Cc2ccccc2)C1	1845940917	QOUKDLIMIIQSOW-QGZVFWFLSA-N	448.361	1.818	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@H]2[C@H]3CN(C(=O)OC(C)(C)C)C[C@H]32)C1	1846155834	OWMUCBONXDVIIH-XUWVNRHRSA-N	441.956	1.557	50	20	IDGD	
C#CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)[C@H](Cl)COC)C2	1847068920	IXPHXGQFBPXVLW-CABCVRRESA-N	427.929	1.360	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H]1CN(C(=O)OC(C)(C)C)CCO1	1847640070	VNTWFTKFPTXZQO-VGWMRTNUSA-N	445.944	1.078	50	20	IDGD	
Cc1ccc([C@@]2(C)NC(=O)N(CC(=O)NNC(=O)c3cc(Cl)ccc3O)C2=O)cc1	10600869	ORQBJKYQAAMCFK-HXUWFJFHSA-N	430.848	1.582	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2cccc(C(=O)NNC(=O)Cc3ccc(F)cc3)c2)C[C@H](C)O1	15529022	RWCLXCQIMZZUOJ-GJZGRUSLSA-N	449.504	1.627	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)c1cccc(F)c1	25166151	AMJNZAQDCUEHAR-UHFFFAOYSA-N	435.477	1.240	50	20	IDGD	
O=C(CCc1nc2c(cnn2-c2ccccc2)c(=O)[nH]1)NNC(=O)c1ccc2c(c1)OCO2	27601230	ZVQGOECQLOFOGV-UHFFFAOYSA-N	446.423	1.231	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)CNS(=O)(=O)c2ccc(Cl)s2)c1	116461569	GSISQDSTDGEQCL-UHFFFAOYSA-N	431.923	1.523	50	20	IDGD	
C[C@@H](NC(=S)NNC(=O)N[C@@H]1CCS(=O)(=O)C1)c1ccc(Cl)cc1Cl	726476199	GXIBCPVXQULOPU-PSASIEDQSA-N	425.363	1.920	50	20	IDGD	
CC(C)CCC(=O)NCC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	727481236	AADPHLMGTISNMH-UHFFFAOYSA-N	438.550	1.175	50	20	IDGD	
C[C@]12CCC(=O)N1c1ccccc1C(=O)N2CC(=O)NNc1nc(-c2cccnc2)no1	728077036	RULCRCJUJCTHMP-OAQYLSRUSA-N	433.428	1.574	50	20	IDGD	
CCn1c(SCC(=O)N([C@@H]2CCS(=O)(=O)C2)N(C)C)nnc1-c1ccccc1C	728180000	PJFZNHKLUFNWHE-OAHLLOKOSA-N	437.591	1.858	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@H](C)C(=O)NNC(=O)Cc1ccc(S(N)(=O)=O)cc1	728312304	LUZXBXQLZHIZHK-CYBMUJFWSA-N	439.921	1.762	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NN=Cc1cn(Cc2ccccc2)nc1-c1cccnc1	728436504	GSUMFGQQLWDGMP-HNNXBMFYSA-N	426.502	1.381	50	20	IDGD	
COc1ccc(CCC(=O)N2CCN(C(=O)NNC(=O)Cc3cccnc3)CC2)cc1	728957176	LGFWOYRLVWFFJQ-UHFFFAOYSA-N	425.489	1.151	50	20	IDGD	
NC(=O)[C@@H]1CC(C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)=NN1c1ccccc1	728975838	VUGHZOAMBPRNCM-HNNXBMFYSA-N	437.428	1.246	50	20	IDGD	
COCCOc1cn(-c2ccccc2)nc1C(=O)NNC(=O)[C@H]1COc2ccccc2O1	729297154	XAXVCDGYXBCMES-LJQANCHMSA-N	438.440	1.499	50	20	IDGD	
O=C(NCc1ccc(OCCN2CCCC2)cc1)NNC(=O)[C@H]1COc2ccccc2O1	732253086	CWSAROOHPYOKIF-OAQYLSRUSA-N	440.500	1.832	50	20	IDGD	
CCCS(=O)(=O)Nc1ccc(C(=O)NNC(=O)CCN2C[C@H](C)O[C@@H](C)C2)cc1	732262747	WAFHRLIPWASPAU-GJZGRUSLSA-N	426.539	1.099	50	20	IDGD	
COc1ccc(Cl)c(S(=O)(=O)NNC(=O)c2csc(N3CCOCC3)n2)c1	732747649	TZHITYPEPLOGKQ-UHFFFAOYSA-N	432.911	1.265	50	20	IDGD	
O=C(CC/N=C1/NS(=O)(=O)c2ccccc21)NNc1nc(-c2ccc(Cl)cc2)no1	732976981	WEKUCTXYLMMUCR-UHFFFAOYSA-N	446.876	1.962	50	20	IDGD	
Cc1oc(C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1S(=O)(=O)N1CCCC1	733106831	MGXAOUDWOBIMCA-UHFFFAOYSA-N	443.485	1.633	50	20	IDGD	
CC(=O)N1c2ccccc2C[C@H]1C(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	734821973	QMOJAELPKOZNHB-SFHVURJKSA-N	445.520	1.694	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)NCCSCCOc2cccc(Br)c2)cn1	735512730	KDKQALJLYXWFQB-UHFFFAOYSA-N	442.339	1.939	50	20	IDGD	
CCCn1c(C)cc(/C=C(/C#N)C(=O)N[C@@H]2CC(=O)N(CCN3CCOCC3)C2)c1C	735822631	FYRGBHULZNRNFI-DMMSUNFISA-N	427.549	1.471	50	20	IDGD	
COc1ccc([N+](=O)[O-])cc1NS(=O)(=O)c1cccc(C(=O)NNc2cccnn2)c1	736703956	AQHCNBLGJDVSQY-UHFFFAOYSA-N	444.429	1.951	50	20	IDGD	
CN(CC(=O)NNC(=O)c1ccc2ccccc2n1)S(=O)(=O)c1cccc([N+](=O)[O-])c1	737763837	VGIFHIDXRLIBED-UHFFFAOYSA-N	443.441	1.225	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)CC[S@](=O)c1ccc2c(c1)OCCO2	740697349	FVJGOQJMKJOBRT-HKBQPEDESA-N	448.497	1.581	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)[C@@H]1CCCN(C(=O)NCC(C)C)C1	741206697	CRKBUEPSLRZYPR-MRXNPFEDSA-N	428.537	1.824	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2ccccc2Cn2cccn2)cc1OC	741347139	VPTWZLONSBXAIS-UHFFFAOYSA-N	438.440	1.567	50	20	IDGD	
O=C(NNS(=O)(=O)N1CCCC1)c1nn(Cc2ccccc2)c(=O)c2ccccc12	742025449	NCYKKDOYEKSJDQ-UHFFFAOYSA-N	427.486	1.020	50	20	IDGD	
Cc1ccc(S(C)(=O)=O)cc1S(=O)(=O)NNC(=O)c1cccc(Br)c1	743263999	MSEUMYXTBSTATM-UHFFFAOYSA-N	447.332	1.784	50	20	IDGD	
CC(=O)Nc1nc(C)c(S(=O)(=O)NNC(=O)c2cccc(Br)c2)s1	743264442	UAZPKCUPMAYXMQ-UHFFFAOYSA-N	433.309	1.796	50	20	IDGD	
CC(=O)N[C@H](CC(=O)OCC(=O)NNC(=O)c1cccc(C#N)c1)c1c(F)cccc1F	744939964	ASDHGOWCLXXTSA-QGZVFWFLSA-N	444.394	1.408	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)[C@@H]1CCCN1C(=O)NCc1cccc(Br)c1	746103535	OQKINARYIPJEPR-INIZCTEOSA-N	448.321	1.923	50	20	IDGD	
CC(C)c1nc(C#N)c(NNC(=O)c2cc(S(=O)(=O)N3CCOCC3)ccc2F)o1	746524891	ISQSSYHCONHCBB-UHFFFAOYSA-N	437.453	1.587	50	20	IDGD	
COc1ccc(S(=O)(=O)C[C@H](C)C(=O)NNC(=O)Cc2cn3ccccc3n2)cc1	746547988	AVYYIGPLPFPLTM-AWEZNQCLSA-N	430.486	1.143	50	20	IDGD	
COC(=O)c1ccsc1N1CC[C@H](NC(=O)NNC(=O)Cc2ccc(F)cc2)C1=O	746781271	RRGCXTDNJYHJBW-AWEZNQCLSA-N	434.449	1.352	50	20	IDGD	
COC[C@@H](Cc1ccccc1)NC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1	746781685	HOYCLDNHOHKDOW-GOSISDBHSA-N	448.545	1.204	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc2c(cc1Br)OCCO2)c1ccc(Cl)nc1	747606719	ULTQQETUAXCUIQ-UHFFFAOYSA-N	448.682	1.892	50	20	IDGD	
N#Cc1ccc(NNC(=O)c2cc(I)ccc2-n2cnnn2)cc1	748113239	NXSGHQPYGVOOOI-UHFFFAOYSA-N	431.197	1.895	50	20	IDGD	
NC(=O)c1ccc(OCCC(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)cc1	748520890	XQZKIJYVBJTGAW-UHFFFAOYSA-N	431.392	1.991	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2cc(F)cc(C(=O)O)c2)ccc1OC(C)C	749144731	WUZKRTAWDVAMTD-UHFFFAOYSA-N	426.422	1.943	50	20	IDGD	
CSCC[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)NNC(=O)c1ncccc1C	752228109	UDVJPAVVRWFYMF-HNNXBMFYSA-N	431.474	1.611	50	20	IDGD	
C[C@H](NC(=O)/C(C#N)=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)c1nc[nH]n1	752637671	LINHKLVBFWRALQ-ACLQVGRQSA-N	438.879	1.981	50	20	IDGD	
Cc1cc(C)c(S(=O)(=O)NCCC(=O)NNc2nc3ccccc3c(=O)n2C)c(C)c1	752910839	YDEGMFJRXKMDSO-UHFFFAOYSA-N	443.529	1.670	50	20	IDGD	
CC[C@@H](NC(=O)NNC(=O)[C@H](C)Oc1ccc2ccccc2c1)C(=O)N1CCOCC1	753057046	KOABKBXOCICDOC-HNAYVOBHSA-N	428.489	1.575	50	20	IDGD	
CCn1c(=O)nc(O)c2c(C(=O)NNC(=O)c3ccc(Cl)cc3O)cc(C3CC3)nc21	754425327	TZLDLQWVQBIGGP-UHFFFAOYSA-N	443.847	1.828	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NN=Cc3cc(C)n(C)c3C)CC2)cc1	754964380	MHMFLURNXOUHFO-UHFFFAOYSA-N	431.562	1.407	50	20	IDGD	
Cc1ccc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c(Br)c1	754971757	MSCOIEQGMBHPBE-MRXNPFEDSA-N	449.257	1.902	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)Nc1ccc2c(c1)NC(=O)CO2	755515254	QUCQJIZTWFTPBD-UHFFFAOYSA-N	438.488	1.383	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)Nc1ccc(N2CCCS2(=O)=O)cc1	755593463	LEVWPBLDBSNKDT-CYBMUJFWSA-N	436.465	1.986	50	20	IDGD	
COC(=O)CNC(=O)Cc1ccc(NC(=O)NNC(=O)C(C)(C)c2ccccc2)cc1	755861148	BKMKWFCNHNWKBV-UHFFFAOYSA-N	426.473	1.649	50	20	IDGD	
COC(=O)CNC(=O)Cc1ccc(NC(=O)NNC(=O)c2ccc(Cl)cc2O)cc1	755863689	UFMNFSUYJVHWMX-UHFFFAOYSA-N	434.836	1.344	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)N[C@@H]2CCN(c3c(F)cccc3F)C2=O)c1	756211508	MYGLCLDAPPQUKQ-MRXNPFEDSA-N	434.399	1.732	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2ccccc2OCCOC)c2ccccc2c1=O	756213207	VAXFTSXGHKBZFS-UHFFFAOYSA-N	425.445	1.908	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)Nc2ccc(S(=O)(=O)NCC3CC3)cc2)cc1	756784478	NQQPAFJESZBOPQ-UHFFFAOYSA-N	443.485	1.478	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2cccnn2)c1	757661103	MOCJLIJLXMYUFV-UHFFFAOYSA-N	442.457	1.753	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)ccc1S(=O)(=O)N(C)C	757775369	JPALGRBRJNIABX-UHFFFAOYSA-N	437.434	1.320	50	20	IDGD	
Cc1ccc(NC(=O)NNc2cccc(S(C)(=O)=O)c2)cc1S(=O)(=O)NC1CC1	757867818	WIOPDKRUUNTDFG-UHFFFAOYSA-N	438.531	1.988	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)NC[C@@H]1CN(Cc2ccccc2)CCCO1	759214487	OHDDKQQVWDKVQE-HXUWFJFHSA-N	426.517	1.859	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)cc1	759788627	IHIRYDZJGNJQON-UHFFFAOYSA-N	431.430	1.875	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)CC[C@@H]2CCCN2C(=O)OC(C)(C)C)C[C@H](C)O1	760119323	FGZKRBRSYQNENE-ULQDDVLXSA-N	426.558	1.813	50	20	IDGD	
Cc1cc(C)nc(-n2nccc2NC(=O)C(=O)NNC(=O)Cc2ccc3ccccc3c2)n1	760276196	ABJCUKJPBNIURY-UHFFFAOYSA-N	443.467	1.761	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)c2ccc(S(=O)(=O)N=c3cc[nH]cc3)cc2)n1	762897842	IHUIVMBUDUANLU-UHFFFAOYSA-N	441.517	1.697	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)c3cc(F)ccc3NS(C)(=O)=O)n[nH]2)cc1	762953140	GTMIARHTANPJNC-UHFFFAOYSA-N	431.449	1.971	50	20	IDGD	
Cc1nn(-c2ccc(Br)cc2)cc1C=NNC(=O)[C@@H](C)NS(C)(=O)=O	763362250	GZKAKJPGVSLMLQ-LLVKDONJSA-N	428.312	1.331	50	20	IDGD	
COC(=O)c1c(NC(=O)C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)sc2c1CCCC2	763441434	DOCUQKAOGPOHOI-UHFFFAOYSA-N	446.441	1.721	50	20	IDGD	
CN1CCN(C[C@H](NC(=O)NNC(=O)CSc2ccccc2O)c2ccccc2)CC1	763527678	YMTFSQYSXJNFMG-SFHVURJKSA-N	443.573	1.803	50	20	IDGD	
Cc1cc(C(=O)NC(C)C)ccc1NC(=O)C(=O)NNC(=O)c1ccc2c(c1)OCO2	763548076	IBUQFPWTDYGSQV-UHFFFAOYSA-N	426.429	1.262	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)Nc1cccc(OC[C@@H]2CCCO2)c1	763570163	DALBHSKSVVZLRH-QFBILLFUSA-N	441.440	1.170	50	20	IDGD	
C=CCNC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2OC)cc1	763647870	RNNXLMDTHSWVJU-UHFFFAOYSA-N	441.444	1.168	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(OC[C@H]2CCCO2)cc1	763808709	PPXIYBJLXHGXQD-GOSISDBHSA-N	438.440	1.281	50	20	IDGD	
CNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)cc1Cl	763848432	HNPCSRYVVVIGKK-ZDUSSCGKSA-N	446.891	1.870	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)cc1NC(C)=O	763849140	HXYIIIJJGOONCS-LLVKDONJSA-N	432.408	1.346	50	20	IDGD	
CCOC(=O)c1cc(C)sc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccc(F)cc1	763867498	VVQWRPYZPTWIQO-LLVKDONJSA-N	437.449	1.926	50	20	IDGD	
COC(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(OC(C)C)c(OC)c2)c1	763916847	WBOSEJQDTUXBNL-UHFFFAOYSA-N	443.456	1.598	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccc3nc(C)cn3c2)ccc1OC(C)C	763916863	WQXJEKFVJWWDKI-UHFFFAOYSA-N	425.445	1.838	50	20	IDGD	
O=C(NNC(=O)c1cccc(Br)c1)C(=O)Nc1ccccc1-n1cncn1	764059028	NJBDTCDVEDEQAS-UHFFFAOYSA-N	429.234	1.430	50	20	IDGD	
C[C@@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)[C@H]3Cc4ccccc4O3)cc2)C[C@@H](C)O1	764155228	WZXDRMMYRXJSBF-STXHMFSFSA-N	438.484	1.390	50	20	IDGD	
O=C(CC1CCCC1)NNC(=O)C(=O)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1	764189129	WLLOJJXPZWJEAD-IBGZPJMESA-N	438.532	1.996	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2cc(Br)ccc2O)c(Cl)n1	764277388	LOCPTPIGNQPYFI-UHFFFAOYSA-N	443.641	1.611	50	20	IDGD	
CCOCC(=O)NNC(=O)C(=O)Nc1cc(C(F)(F)F)ccc1-n1nc(C)cc1C	764325371	LNYNLLDMTWVKNW-UHFFFAOYSA-N	427.383	1.630	50	20	IDGD	
CN(C)CC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)CCCc2cccs2)cc1	764342016	RYTAKYUOWKKREH-UHFFFAOYSA-N	431.518	1.357	50	20	IDGD	
Cc1nc(-c2cccc(NC(=O)C(=O)NNC(=O)c3cnn(-c4ccccc4)c3)c2)no1	764352062	YWKAWCHUTDBIRE-UHFFFAOYSA-N	431.412	1.630	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1)C(=O)Nc1cnn(Cc2ccccn2)c1	764387002	FUULWYOMCNBZDG-UHFFFAOYSA-N	448.418	1.255	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1cccc(N2CCCC2=O)c1	764392240	CWODKJIGWADIAV-UHFFFAOYSA-N	442.497	1.700	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1ccccc1Oc1cc(F)cc(F)c1	764397050	FHIRULOWPAZOLW-GFCCVEGCSA-N	437.399	1.895	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)C(=O)Nc1cccc(OC[C@H]2CCCO2)c1	764400813	IBTCCVMNLMXIPX-MRXNPFEDSA-N	445.497	1.828	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2c(Br)ccc(C)c2N)n1	764591332	JECRJMNBPZVRJW-UHFFFAOYSA-N	441.307	1.652	50	20	IDGD	
CC(=NNC(=O)c1nn(C)c(=O)c2ccccc12)c1ccc(Cl)c(S(N)(=O)=O)c1	764667955	SYGARTDEONTHBI-UHFFFAOYSA-N	433.877	1.388	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NN=C3C[C@H](C)N(C4CC4)C3)CC2)cc1	764819980	URCJVSKRZZMOHT-KRWDZBQOSA-N	433.578	1.030	50	20	IDGD	
CCN(CC)c1ncc(C=NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)s1	764828226	QRASIGWECVWSMK-UHFFFAOYSA-N	428.562	1.897	50	20	IDGD	
C[C@@H](NC(=O)c1ccc(Cl)cc1)C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C	765310119	ADHKQYHPKNBSPJ-GFCCVEGCSA-N	426.901	1.911	50	20	IDGD	
CN1CCC[C@@H](N(C)C(=O)c2ccc(NC(=O)C(=O)NNC(=O)OC(C)(C)C)cc2)C1	765398008	BQFOMTTWMGPTOB-MRXNPFEDSA-N	433.509	1.347	50	20	IDGD	
CCS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cc(-c3ccccc3OC)[nH]n2)cc1	765593181	TYGJWYHORFQUDZ-UHFFFAOYSA-N	428.470	1.954	50	20	IDGD	
Cc1c(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)oc2c1C(=O)CCC2	766651892	ONHIZKZGMFAFND-UHFFFAOYSA-N	438.484	1.326	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)c1ccc2nccnc2c1	766660770	RLVIKWOPJHLOEW-UHFFFAOYSA-N	438.919	1.862	50	20	IDGD	
CC(C)(C)[C@H](Br)C(=O)OCc1nnnn1-c1ccc(S(C)(=O)=O)cc1	766745501	FXEVCIPRNYGCAD-CYBMUJFWSA-N	431.312	1.919	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2cn(-c3ccc(F)cc3C)nn2)c2ccccc2c1=O	767191968	OOYFIKJFTLROGA-UHFFFAOYSA-N	435.419	1.519	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1ccco1	767298872	RGFHBPXCASCGLU-KRWDZBQOSA-N	427.457	1.516	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)CCC(=O)N2CCN(c3ccccc3)CC2)cc1	767893439	OAPSCCLBDAHBKW-UHFFFAOYSA-N	438.528	1.904	50	20	IDGD	
O=C(NNC(=O)c1ccccc1)C(=O)Nc1ccc(Cc2nnc3n2CCCCC3)cc1	768229433	UCJWMEGWJLLYKY-UHFFFAOYSA-N	432.484	1.995	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)NCCCNC(=O)c3ccccc3)nc21	770372642	YCGRRNIBMUVLHS-UHFFFAOYSA-N	426.481	1.733	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)c3cc4ccccc4cc3NS(C)(=O)=O)nc21	770971160	IGZJMEJLRSIEKL-UHFFFAOYSA-N	427.446	1.351	50	20	IDGD	
CC(=NNC(=O)C(=O)NCc1ccc(Cl)cc1)c1ccc(S(=O)(=O)N(C)C)cc1	771562064	OTQXLWDGDWSYEY-UHFFFAOYSA-N	436.921	1.747	50	20	IDGD	
Cc1cc(C(=O)O[C@@H](C)C(=O)NNC(=O)CC(C)C)cc(S(=O)(=O)N(C)C)c1C	771953384	WGDNRWHCKBVMRJ-AWEZNQCLSA-N	427.523	1.293	50	20	IDGD	
CC(C)(C)OC(=O)N1CCSC[C@H]1CC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	772632179	XCEZPNOEZAKKMV-OAHLLOKOSA-N	447.521	1.166	50	20	IDGD	
COc1ccc(/C=C/C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cc1O	773389050	DRRDLFLGEKHJTC-CSKARUKUSA-N	438.484	1.019	50	20	IDGD	
O=C(COC(=O)c1ccoc1Br)NNC(=O)[C@H]1COc2ccccc2O1	773543921	WOCBGLGMDOYZRE-GFCCVEGCSA-N	425.191	1.186	50	20	IDGD	
COC(=O)CCc1cccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)c1	774010606	YJHRVKACTNCIPG-CYBMUJFWSA-N	447.875	1.999	50	20	IDGD	
N#C/C(=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)NNc1cnccn1	775280665	JZJJLXXQIVUFCP-ZROIWOOFSA-N	436.863	1.919	50	20	IDGD	
CN(NC(=O)CCNC(=O)c1ccsc1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776205086	JQUPMMFHDWUAOA-UHFFFAOYSA-N	439.538	1.504	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1N1CCOCC1)c1cc(-c2cccs2)[nH]n1	776712202	ZOZJDXRERSLJMG-UHFFFAOYSA-N	442.457	1.958	50	20	IDGD	
COc1nc(C)c(Br)cc1C(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	777086526	QQTWDRLNDKQNPT-UHFFFAOYSA-N	446.261	1.483	50	20	IDGD	
CCOC(=O)N1CCC([C@H](C)NC(=O)NNC(=O)c2cc(Br)c[nH]2)CC1	777411776	FOSNWESCOHCKDW-JTQLQIEISA-N	430.303	1.978	50	20	IDGD	
CC(C)Cc1cc(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)cc(O)n1	777425746	INIZWUOUFHNPLM-UHFFFAOYSA-N	447.561	1.679	50	20	IDGD	
Cc1cc2ccccc2nc1NNC(=O)c1ccc(S(=O)(=O)N2CCNC(=O)C2)cc1	777482145	BCWPPYBVAUSYSE-UHFFFAOYSA-N	439.497	1.421	50	20	IDGD	
Cc1ccccc1-n1ncc(C(=O)N2CCN(S(=O)(=O)CBr)CC2)c1C	777831483	BBKGRBHWYVACDK-UHFFFAOYSA-N	441.351	1.929	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)c1cc(Cl)ccc1Cl)C(=O)NN(C)C(N)=O	778415122	QPFYPBMPEQFMES-JTQLQIEISA-N	429.351	1.435	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cc([N+](=O)[O-])ccc3O)CC2)cc1	779675492	DWOMDLCTCXEUHF-UHFFFAOYSA-N	427.461	1.188	50	20	IDGD	
Cc1cc(N2C[C@H](C(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)CC2=O)ccc1F	780314512	DNDDKGUNANULHW-CYBMUJFWSA-N	437.431	1.195	50	20	IDGD	
CCOC(C)(C)CNC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	780822872	DEJUQTMWXVNWCZ-UHFFFAOYSA-N	448.545	1.924	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)Nc1cc(Br)cnc1-n1cccn1	782064232	DWZDSFWXGIBMNA-UHFFFAOYSA-N	447.249	1.967	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2ccc(S(=O)(=O)NCCC(C)C)cc2)nc1	782145482	LOHMXUQZDOQDNH-UHFFFAOYSA-N	435.506	1.496	50	20	IDGD	
CCCC(=O)Nc1ccc(Cl)c(NC(=O)C(=O)NN[C@@]2(C)CCS(=O)(=O)C2)c1	783424485	FALIHHWAQFWFDG-KRWDZBQOSA-N	430.914	1.215	50	20	IDGD	
Cc1ccc(NNC(=O)C(=O)Nc2ccc(CN3CCN(c4ccccn4)CC3)cc2)nn1	783951440	BHYBVSYWEGFHBG-UHFFFAOYSA-N	446.515	1.584	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1ccc(OCC(C)C)nc1	785339243	SAAWIUHSMPMHQG-UHFFFAOYSA-N	436.490	1.610	50	20	IDGD	
C[C@H]1CCC[C@@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)CC1	785945411	BRXBZJARONKOEQ-DOTOQJQBSA-N	438.550	1.620	50	20	IDGD	
Cc1nc(Cn2nnc(C(=O)NNC(=O)[C@@H](C)Oc3ccc4ccccc4c3)c2C)no1	786663119	LNIFMLAEJUECRV-CYBMUJFWSA-N	435.444	1.708	50	20	IDGD	
CCS(=O)(=O)CCn1cc(C)c(NC(=O)NNC(=O)c2c(C)nc3ccccn23)n1	786713971	WITCMKURYFBQHT-UHFFFAOYSA-N	433.494	1.049	50	20	IDGD	
CCOc1ccccc1[C@@](N)(C(=O)NNC(=O)c1ccc2c(c1)OCO2)C(F)(F)F	787993488	XRYJJSSTQOIXGM-GOSISDBHSA-N	425.363	1.992	50	20	IDGD	
COc1ccc(-c2nnc(S)n2CCC(=O)NNc2ccc(-n3ccnc3)nn2)cc1	788181512	UCHSSGXLKRYRJY-UHFFFAOYSA-N	437.489	1.752	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)NC[C@@H]2CC[C@H](O)C2)cc1	789856766	BRYMGRHRTBZYOX-NNIDDDDPSA-N	437.500	1.618	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)[C@H]1CC(=O)N(Cc2cccc(C(F)(F)F)c2)C1	790063569	MLRKJAFKABRFLT-AWEZNQCLSA-N	445.438	1.991	50	20	IDGD	
CC(C)(COc1cc(Cl)cc(Cl)c1)C(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1	790489359	BQFAVVHMVXYSDW-GFCCVEGCSA-N	438.333	1.916	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1	793027047	WVJXFFBDFOOVLH-UHFFFAOYSA-N	437.206	1.766	50	20	IDGD	
CC(=O)N1CCCC[C@@H]1C(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	794766292	DZKPMSUMPUNHDN-HXUWFJFHSA-N	447.495	1.607	50	20	IDGD	
CCn1cnc2c1c(=O)n(CC(=O)NN=C1CSC[C@@H]1C)c(=O)n2Cc1ccccc1	794879957	NZBYNFBKEFKRBC-AWEZNQCLSA-N	440.529	1.283	50	20	IDGD	
Cc1nc([C@H]2CCCOC2)sc1C(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	796246392	LYJBADVGNKFWDI-ZDUSSCGKSA-N	448.457	1.872	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)N1CCNC(=O)[C@@H]1c1ccc(Br)cc1	796577983	ZHNHMDSJAQHNMR-WBMJQRKESA-N	425.327	1.504	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1Sc1nc[nH]n1)c1ccc2c(c1)OCCO2	797606873	PZXNBSFOZMNASD-UHFFFAOYSA-N	442.413	1.710	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2nn(-c3ccc(Cl)cc3)cc2C)c1O	799258576	GMJNZKCOKSXLFC-UHFFFAOYSA-N	443.847	1.948	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)C2CCN(C(=O)COc3ccccc3)CC2)cc1	801105473	FTQAXWGWGQFYHH-UHFFFAOYSA-N	438.484	1.399	50	20	IDGD	
COc1cccc(C[C@H](C(=O)NNC(=O)Nc2cc(F)cc(F)c2)n2nnnc2C)c1	801999454	AXGFGVFSNLRFKF-QGZVFWFLSA-N	431.403	1.905	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)CCNS(=O)(=O)c2ccc([N+](=O)[O-])cc2)cc1	802052730	DSTDEBLIRJGKDM-UHFFFAOYSA-N	437.434	1.125	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2cn([C@@H]3CCS(=O)(=O)C3)nc2C(C)C)cc1	802056431	NREZKISCRTYXSR-CQSZACIVSA-N	435.506	1.841	50	20	IDGD	
CCCN(NC(=O)[C@H](NS(=O)(=O)c1ccc(C)cc1)[C@H](C)O)C(=O)OC(C)(C)C	804592167	AQGHEPUZSUFMLX-GOEBONIOSA-N	429.539	1.701	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(C#N)c(Br)c2)c1	806973547	QVPXVHVWTNIUCK-UHFFFAOYSA-N	431.246	1.794	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCc2ccc(N3CCCC3=O)cc2)cc(OC)c1OC	807104660	KFCIUOLFEJYJFX-UHFFFAOYSA-N	442.472	1.983	50	20	IDGD	
Cn1nc(C(=O)NN=C2CCS(=O)(=O)c3ccc(Cl)cc32)c2ccccc2c1=O	812416817	ARPLUIHISDYZFD-UHFFFAOYSA-N	430.873	1.898	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)NNC(=O)[C@@H]2CCc3nncn3C2)cc(C(=O)OCC)c1	814585561	SXXMYEHSHUQENO-GFCCVEGCSA-N	444.448	1.047	50	20	IDGD	
O=C(NNc1ncncc1F)C(=O)Nc1ccnn1Cc1cccc(Br)c1	815763921	IBERNADYWMOWPI-UHFFFAOYSA-N	434.229	1.705	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)CN2C(=O)[C@H]3CC=CC[C@H]3C2=O)c(OC)cc1Cl	816597468	SONOWEGJFCEQMM-PHIMTYICSA-N	436.852	1.461	50	20	IDGD	
COc1ccc(C(=O)NNc2cnnn2C)cc1S(=O)(=O)N1CCCc2ccccc21	816772260	SQGQFUIKSKNEMS-UHFFFAOYSA-N	442.501	1.722	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H](C)NC(=O)C(C)(C)C)c1	875538003	CMQVDYWNXJGTRX-ZDUSSCGKSA-N	426.539	1.029	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C2CCN(c3ccc4nnnn4n3)CC2)c2ccccc2n1	897171532	COABFSNHPWCZEZ-UHFFFAOYSA-N	431.460	1.054	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)CNS(=O)(=O)c2cccc(F)c2)cc1	912839849	IAZDBBPTMLQLMB-ZDUSSCGKSA-N	439.465	1.118	50	20	IDGD	
CN(CC(=O)NNC(=O)Cc1nc(-c2ccccc2)cs1)S(=O)(=O)c1ccccc1	914783012	LOLTXNQVZMKCJB-UHFFFAOYSA-N	444.538	1.821	50	20	IDGD	
O=C(NNC(=O)[C@H]1CC(=O)N(c2ccc(F)cc2F)C1)c1nn(-c2ccccc2)cc1O	914830818	ZMSNMTURBZBZQG-LBPRGKRZSA-N	441.394	1.670	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2ccc(N3CCOC3=O)cc2)c2ccccc2c1=O	915274706	MEHUQEPHZKPIQG-UHFFFAOYSA-N	435.440	1.838	50	20	IDGD	
CC(=NNC(=O)[C@@H]1COc2ccccc2O1)c1ccc(S(=O)(=O)NCCC(=O)O)cc1	916291762	GNZKQQSJFKDIGW-SFHVURJKSA-N	447.469	1.120	50	20	IDGD	
CCOc1ccc(C(=O)NN=C(C)c2ccc(S(=O)(=O)NCC(=O)O)cc2)cc1OC	916347785	LZIIMIHHTJGBMD-UHFFFAOYSA-N	449.485	1.611	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)NCc2cccc(OCC(=O)N(C)C)c2)c1	918223579	JUNBENMOWUUTFC-UHFFFAOYSA-N	430.461	1.315	50	20	IDGD	
CCC(=O)N1CCC[C@H](C(=O)OCC(=O)NNC(=O)c2cc(Cl)ccc2OC)C1	919457360	SLZYTRBJWNGVGS-LBPRGKRZSA-N	425.869	1.301	50	20	IDGD	
CC(C)[C@@H](Oc1ccccc1C#N)C(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	919636870	BYFNCECEVJDVAC-LJQANCHMSA-N	440.412	1.874	50	20	IDGD	
CC(=NNC(=O)c1nnc(-c2ccccc2)o1)c1ccc(S(=O)(=O)NCC(=O)O)cc1	920382429	ZZIMKORZYBZVCW-UHFFFAOYSA-N	443.441	1.254	50	20	IDGD	
COc1ccccc1-c1noc([C@@H](C)NCC(=O)NNC(=O)Cc2nc(C)cs2)n1	1254686366	PLSFQLWYYRNSGN-GFCCVEGCSA-N	430.490	1.551	50	20	IDGD	
CN1CCN(C[C@@H](NC(=O)NNC(=O)c2cncn2-c2ccccc2)c2ccccc2)CC1	1318269559	CEAVUCFXFYLKGT-OAQYLSRUSA-N	447.543	1.805	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCc2ccc(S(C)(=O)=O)s2)c2ccccc2c1=O	1320700770	VDCRWMMZLLARNO-UHFFFAOYSA-N	449.514	1.026	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2C(=O)N[C@](C)(c3ccc(F)c(Cl)c3)C2=O)cc1	1324050388	XLXRFNFUBFTMAR-HXUWFJFHSA-N	448.838	1.716	50	20	IDGD	
O=C(/C=C/C(=O)c1cccs1)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2	1778095859	LNHPXFPICAAFIG-NDKKJBSDSA-N	440.949	1.601	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(C)nc4ccc(O)cc34)C2)C1	1778429208	HPKQWSZAPBKUIG-PGRDOPGGSA-N	447.919	1.946	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccn4ccnc4c3)C2)C1	1778570002	JKNNGBGQAXJCEN-DNVCBOLYSA-N	435.322	1.951	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cccn4cncc34)C2)C1	1778680641	JENAACOLDXXAIN-AUUYWEPGSA-N	435.322	1.809	50	20	IDGD	
O=C1NCc2cc(C(=O)N3CC[C@]4(C3)CN(C(=O)[C@@H](F)Br)CCO4)ccc21	1778725811	LHPNBQRBSRYGCU-KDOFPFPSSA-N	440.269	1.064	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Br)C2)c1ccnc(Cl)n1	1779682171	PBXKFLGQUYHFIW-XHBSWPGZSA-N	449.708	1.948	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccccc3C(=O)OCCO)CCO2)C1	1781218435	PBLIEXCQQZEZTG-DYESRHJHSA-N	438.908	1.297	50	20	IDGD	
COc1ncc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)cc1F	1781227506	AMLKHFPIUCNXEU-ROUUACIJSA-N	434.295	1.909	50	20	IDGD	
O=C(c1cccc2c[nH]nc12)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781330609	CSGCATYWWOFIJT-PBHICJAKSA-N	425.258	1.697	50	20	IDGD	
O=C(c1ccc(O)c([N+](=O)[O-])c1)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781332909	KKUDPYFPXQCWPE-BBRMVZONSA-N	446.229	1.434	50	20	IDGD	
C[C@H](NC(=O)c1ccccn1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Cl)C2	1781489626	ISJLJNBTZHAWFM-NCLAMWEWSA-N	440.903	1.248	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc3c1cnn3C)C2	1782176054	WRQDWGMCIRISHQ-LRXVAGHRSA-N	448.951	1.955	50	20	IDGD	
C[C@@H](C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)C2)c1ccccn1	1782645703	JXOFJJGWCNNIDB-LYHRCORUSA-N	445.564	1.072	50	20	IDGD	
O=C(CCc1ccccc1F)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2	1782709429	XGEQVNBRQQOXOF-DBXWQHBBSA-N	426.916	1.872	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccc4nncn4c3)CCO2)C1	1783349523	MXQLPAWFAXLAEL-KBXCAEBGSA-N	436.310	1.346	50	20	IDGD	
Cc1ccc(C(=O)C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)cc1	1783743387	LXZGZUYFUUNALF-YJBOKZPZSA-N	427.270	1.698	50	20	IDGD	
Cc1ncc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]3C2)cn1	1783970213	TUMUDGIJWIWHME-XTBFLFJDSA-N	425.327	1.409	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)CCc3cnccn3)C2)C1	1784552307	LCEUHNMCCNGWHM-RDTXWAMCSA-N	425.327	1.270	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3n[nH]c4ccccc34)[C@H]2C1	1788334448	LKJYZSDOQJAQDG-DSPQJCBJSA-N	435.322	1.940	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3cc(C)[nH]n3)[C@H]2C1	1788693388	NMQMYLWARYCTEC-HNKHHVNMSA-N	427.343	1.414	50	20	IDGD	
C[C@@H](C(=O)NC1(c2ccc(NC(=O)c3cnccc3C(=O)NN)cc2)CCC1)n1cccn1	1789523706	OJOIZHOTHMVHOG-HNNXBMFYSA-N	447.499	1.891	50	20	IDGD	
Cc1nc(N)sc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]2C1	1789866603	UXYMDLWGOBZAMN-GUUCOKDPSA-N	435.377	1.863	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccccc3C(N)=O)[C@H]2C1	1790128379	HZKMHFHJLKSWHL-JPZWVBCYSA-N	442.343	1.615	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnn(C)c3C)C[C@@H]21	1790960765	DFRUQZXCGDKYKM-TUUVXOQKSA-N	427.343	1.495	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]21	1791060346	BNFSUOHBMXYFBT-JLPNCARGSA-N	430.170	1.986	50	20	IDGD	
C[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Br)C2	1792761766	MYZCGIUNPXEWSN-XHJNMGKDSA-N	448.358	1.273	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(C#N)ccc1F)C2	1792874652	WFORYHUSKRRWFB-DPYKFYPSSA-N	438.297	1.932	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CCC[C@H](C(=O)OC)C1)C2	1793453430	ZPUWINAAODZQJE-BQULAQKPSA-N	428.957	1.963	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CNC(=O)c1cccs1	1794119077	WOKMLWQUVOPVFZ-TYYYEBLRSA-N	448.372	1.304	50	20	IDGD	
COc1nc(C)ccc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCBr	1795115857	OKOOFOHOBUUVIN-YWVIFJGQSA-N	426.311	1.387	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCBr)c1cc2n(n1)CCCNC2=O	1795493462	RKXFTZSIZYMGQR-CLLJXQQHSA-N	438.326	1.053	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ncn(C(C)C)n1)C2	1796892443	CLCQTBKJACSYNF-BDHJUDLHSA-N	440.508	1.245	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)c1cc2cccc(F)c2s1	1796929377	MAKINSSBTDBJMW-FAXLKDOZSA-N	426.897	1.843	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3cc(O)ccc3n1)C2	1797955884	NPIRBCSKDFUISE-VPTLXERWSA-N	443.576	1.995	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnnc3ccccc13)C2	1798440157	DSRMBSQRJXPERN-QDMKHBRRSA-N	445.483	1.194	50	20	IDGD	
COc1ccc(C)c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)c1	1798442021	RRUHZEFKOYRGCH-MUJYYYPQSA-N	437.500	1.568	50	20	IDGD	
O=C(Cc1ccc(Br)nc1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2	1799031217	JHQBPLUPOQEVPJ-JLUCKKNBSA-N	434.693	1.511	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccnc2c(O)cccc12	1800097468	TWATWLRVFHWNFS-VLWCASSMSA-N	433.892	1.397	50	20	IDGD	
CC[C@H](O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](Br)Cc1ccccc1	1800433387	IVUPHIMRJJZLGZ-MDMSPXHWSA-N	439.350	1.353	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(-n3cccn3)nc1)C2	1800760133	CNHZDTFWPBIHQJ-FAYQHZLMSA-N	448.321	1.254	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCc1cnccn1	1801408826	PGVDRQUUZVMFJR-IARIHHJXSA-N	425.327	1.172	50	20	IDGD	
COc1cc(F)ccc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2	1801646513	NVFOHEDUIJTQAU-OWLDWWDNSA-N	433.249	1.728	50	20	IDGD	
CC[C@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CNC(=O)c1cc(C)on1)C2	1801802571	XKAYBMAXHTXXDV-CRWXNKLISA-N	441.326	1.525	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H](CNC(=O)[C@@H]2CCC(=O)NC2)[C@H]1c1cccnc1	1802611317	SUFXWOWAGQYYPA-YVTWGWGSSA-N	441.359	1.850	50	20	IDGD	
CC[C@@H](NC(C)=O)C(=O)NC[C@@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1	1802879775	IQKDSNQHSSNKDD-LZLYRXPVSA-N	439.354	1.787	50	20	IDGD	
Cc1cc[nH]c1C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1	1805010022	SVRLORFOCGDHHO-UZLBHIALSA-N	447.499	1.350	50	20	IDGD	
C[C@H](C(=O)N1CC[C@@H](CNC(=O)CCBr)[C@@H]1c1cccnc1)n1ccnn1	1806346513	JKYZUZGQQAYRIO-KMFMINBZSA-N	435.326	1.725	50	20	IDGD	
COCCOCC(=O)NC[C@@H]1CCN(C(=O)[C@](C)(Cl)CCl)[C@@H]1c1cccnc1	1806758433	FZBRYGGMSBTKEU-KVSKMBFKSA-N	432.348	1.987	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)[C@H](N)c2ccccn2)[C@H]1c1cccnc1	1807166013	AELKPBNZCDAEBU-UKBAYJJMSA-N	431.924	1.436	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)[C@@H]1CNc2ccccc21	1807173031	WWTGRILYFVVBBX-ZSXHRAQDSA-N	428.920	1.896	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)nc1	1807361640	BYJJPFCRCQKPCI-UGKGYDQZSA-N	444.300	1.098	50	20	IDGD	
C=CCSCC(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1807369865	XKFDZDAKZORBKI-NQIIRXRSSA-N	439.346	1.000	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC2(CCCN(C(=O)c3ccsc3)C2)CC1	1808106269	RVPKIEDYZNXLLQ-UHFFFAOYSA-N	427.530	1.905	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2cnn3ncccc23)[C@H]1c1cccnc1	1808175825	PTJAQNDGOFKCIS-HHXXYDBFSA-N	442.907	1.698	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2cnn3ncccc23)[C@H]1c1cccnc1	1808175827	PTJAQNDGOFKCIS-VDZJLULYSA-N	442.907	1.698	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)N1CC[C@H](CNC(=O)[C@@](C)(Cl)CCl)[C@@H]1c1cccnc1	1808302935	MXHZKSCIYMPBLB-QZNHQWIBSA-N	444.363	1.771	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)c1cccc2c1OCC2	1808998504	PCAFYDFYRVDRGJ-WDSOQIARSA-N	429.904	1.936	50	20	IDGD	
Cc1ncccc1CCC(=O)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1	1809969665	ZWQSKIVLJRVULR-UHFFFAOYSA-N	449.360	1.547	50	20	IDGD	
Cn1cc(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)c2cccnc21	1810081695	QCSRBAONLONNAN-ZYSHUDEJSA-N	441.919	1.888	50	20	IDGD	
C[C@H](Cn1cncn1)C(=O)NC[C@H]1CCN(C(=O)C(Cl)Cl)[C@@H]1c1cccnc1	1810480024	LWVYWRZTIPWUNY-BPLDGKMQSA-N	425.320	1.819	50	20	IDGD	
C#CC(=O)NC[C@H]1CCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)[C@H]1c1cccnc1	1812525347	SFDLCZREQKZKBM-RYRKJORJSA-N	434.924	1.853	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)/C=C\C(=O)NC2CC2)[C@@H]1c1cccnc1	1812866088	HILQDQRDPRMFRX-DVOQEUAYSA-N	449.349	1.706	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@H](CNC(=O)[C@H](C)Br)[C@H]2c2cccnc2)nn1	1812866864	MJMJQEYUEGUBTK-DXCKQFNASA-N	448.321	1.983	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2c(F)c(C)nn2C)[C@@H]1c1cccnc1	1813029529	OPWDWCMGSVDFPI-YQQAZPJKSA-N	437.903	1.836	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(Cl)o1)CC2)c1cccc(B(O)O)c1	1815356726	NLNOWDQPUFDIIO-LBPRGKRZSA-N	445.693	1.609	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CN2CCS(=O)(=O)CC2)n[nH]1	1815672979	NKMCQORXVQGRCC-ZFWWWQNUSA-N	445.973	1.150	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(O)cc2)[nH]n1)c1cccc(B(O)O)c1	1817476960	UWVLGARISDNMFW-IBGZPJMESA-N	434.261	1.415	50	20	IDGD	
Cc1c[nH]cc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1818217726	BUWMARABNVVTMR-KRWDZBQOSA-N	436.476	1.664	50	20	IDGD	
CS(=O)(=O)N1CCC(C(=O)Nc2cc([C@H]3CCCCN3C(=O)[C@@H](F)Cl)[nH]n2)CC1	1818815060	NZQOAMGHEQTMAU-UKRRQHHQSA-N	449.936	1.608	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1cc(F)c[nH]1	1822236443	NNEHSBYQGOEANX-KRWDZBQOSA-N	425.229	1.176	50	20	IDGD	
C[C@H](NC(=O)c1ccccc1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1	1823503641	WASFVFRNVZYTFW-RRQGHBQHSA-N	447.923	1.820	50	20	IDGD	
CC(C)c1nc(CC(=O)N2CCCC[C@@H]2C2CCN(C(=O)[C@@H](O)CCl)CC2)no1	1825119005	WQXRXCCOKDABCP-CVEARBPZSA-N	426.945	1.955	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CSCC(=O)O)CC2	1825647018	HRFIARWETHAOTA-YUMQZZPRSA-N	436.353	1.656	50	20	IDGD	
CNc1nsnc1C(=O)N[C@H]1CCc2nc(NC(=O)[C@H](Cl)COC)sc2C1	1825991300	IRFXUTMCCIXQCG-JGVFFNPUSA-N	430.943	1.516	50	20	IDGD	
O=C(CNC(=O)C(F)(F)F)N[C@@H]1CCc2nc(NC(=O)C(Cl)Cl)sc2C1	1826103715	YMYAAFNQWGIHGV-RXMQYKEDSA-N	433.239	1.537	50	20	IDGD	
C=CCO[C@H](C)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827049187	PKYHIXYSDVTSMS-DYESRHJHSA-N	428.338	1.191	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC([C@@H]2CCCCN2C(=O)Cn2nccn2)CC1	1830428011	XDRRZXNKAMAELA-ZBFHGGJFSA-N	426.359	1.929	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3C[C@H]3C3CC3)C2)C1	1830533133	GIUJBXIJZVPWQP-PSFFPDNBSA-N	429.355	1.520	50	20	IDGD	
CSc1ccc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)cc1	1830738652	RNAZGFSJXKJBGJ-XLIONFOSSA-N	442.965	1.007	50	20	IDGD	
O=C([C@@H](O)CCl)N1CCC([C@@H]2CCCCN2C(=O)c2cnc3c(c2)CCNCC3)CC1	1831148266	UWLBHNLECSDCFP-SFTDATJTSA-N	448.995	1.603	50	20	IDGD	
O=C(C[C@@H]1OCCc2ccccc21)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1831246755	YYZKPJDZSNUFSE-FBBABVLZSA-N	440.899	1.681	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccn4ccnc34)C2)C1	1831651185	NTJMOVAEFLNJSF-DYESRHJHSA-N	434.924	1.812	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CCCN3C(C)C)C2)C1	1831659785	VQLTXZALKNKXEB-BBTUJRGHSA-N	429.989	1.723	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3cccnc3C)CCO2)C1	1832640217	NWPFBWZIPADBGZ-NQIIRXRSSA-N	439.940	1.033	50	20	IDGD	
COc1ncccc1C(=O)N1CCO[C@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1	1834128469	DQQSJPYHZMNBQH-FQEVSTJZSA-N	437.569	1.012	50	20	IDGD	
Cc1ncsc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)Br)C2)C1	1834269449	ZNFBXIWTNWVRHS-BDJLRTHQSA-N	432.340	1.305	50	20	IDGD	
Cc1cc(/C=C/C(=O)N2CCOC[C@]3(C2)CN(C(=O)CCBr)CCO3)no1	1834823025	FEEKHTNFLHBOPL-DCKQQPRJSA-N	442.310	1.238	50	20	IDGD	
CC[C@@H](NC(N)=O)C(=O)NC1CCN(C2CCN(C(=O)C(C)(C)CCl)CC2)CC1	1835052540	DKXYPRJQUKQVAI-MRXNPFEDSA-N	429.993	1.270	50	20	IDGD	
COC(=O)c1ccc(C(=O)NC2CCN(C3CCN(C(=O)[C@H](F)Cl)CC3)CC2)cn1	1835167879	PDMJXGGFIJHFQF-KRWDZBQOSA-N	440.903	1.588	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CC3CCOCC3)CCO2)C1	1835424576	SAJKHOXNQNIJNE-KSSFIOAISA-N	433.343	1.043	50	20	IDGD	
O=C(Nc1cccnc1)C(=O)NC1CCN(C2CCN(C(=O)C(Cl)Cl)CC2)CC1	1835804849	PCMDBHAGFUTRLY-UHFFFAOYSA-N	442.347	1.395	50	20	IDGD	
Cc1cnn(CC(=O)N2CCC(N3CCC(NC(=O)[C@](C)(Cl)CCl)CC3)CC2)c1	1836398604	OPIPXDNJHPWQQX-HXUWFJFHSA-N	444.407	1.999	50	20	IDGD	
O=C(c1cnccc1Cl)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836718687	ZUJCPTLFBWAAGS-KRWDZBQOSA-N	430.332	1.947	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccnc(Cl)n3)CCO2)C1	1837919884	SKUVBCJKGCEGMH-FZKQIMNGSA-N	431.320	1.608	50	20	IDGD	
CNC(=S)NCCC(=O)N1CCC(OC2CCN(C(=O)C(Cl)Cl)CC2)CC1	1838395645	IMYLXCURUWLPSJ-UHFFFAOYSA-N	439.409	1.273	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1	1839020774	URYXWVFEPZMSIE-HNAYVOBHSA-N	447.315	1.018	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cnc4ccccn34)C2)C1	1839141687	QBDXTNVUJAXGGK-UWJYYQICSA-N	434.924	1.351	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3coc(Cl)n3)C2)C1	1839151550	WAEFDVZONJSBGP-HZPDHXFCSA-N	440.711	1.634	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc4cccnc4nc3O)CCO2)C1	1839514140	XMVVUSIFIVRQKR-IERDGZPVSA-N	448.907	1.423	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ncccc3F)C2)C1	1839965771	KEJKEQTUTKEUJK-SCLBCKFNSA-N	444.301	1.464	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(O)cc3)C2)C1	1839966104	VEPISTLWYXAUJU-VQIMIIECSA-N	441.322	1.636	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccnc3Cl)C2)C1	1840029710	NEXANHYUGNMUQE-PXAZEXFGSA-N	446.729	1.588	50	20	IDGD	
CC[C@H]1CC[C@H](C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](Cl)COC)C3)C2)CC1	1840059202	XHQIHZKPRYIBDK-RYLXDESZSA-N	430.973	1.913	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3cccs3)C2)C1	1840151215	XUFMSGIWZYWAST-APWZRJJASA-N	430.954	1.391	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc4cc(C)[nH]c34)C2)C1	1840152882	XPDOEIVSHGCQLI-GCJKJVERSA-N	449.935	1.800	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(Cl)c3)C2)C1	1840154130	MCGZQNGUGIWKPG-LPHOPBHVSA-N	431.316	1.664	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)/C=C/c3cnc(C)s3)CCO2)C1	1840519612	OSXYPDLTVQYLQE-LUODXLFYSA-N	443.953	1.175	50	20	IDGD	
Cn1ncnc1C(=O)N1CCCC12CN(C(=O)[C@H](Br)Cc1ccccc1)C2	1842343307	FWBISIQKXGGGMI-OAHLLOKOSA-N	432.322	1.638	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1cc(F)cc(F)c1F)C2	1844265526	LPMWNHJMAXWCDP-UHFFFAOYSA-N	433.390	1.233	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1O)C2	1845162933	VXTVYYVCKKJXFF-OWCLPIDISA-N	443.972	1.825	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC2(CCCN2C(=O)c2cnc3c(c2)CCNCC3)C1	1845797799	WPGRWYLHRRUJPA-LJQANCHMSA-N	425.360	1.823	50	20	IDGD	
C=CC(=O)N[C@@H](C)C(=O)N1CC2(CCCN2C(=O)/C(C#N)=C/c2ccc(F)cc2F)C1	1845871366	RPESDSKCBMOXBK-FSEGOYHTSA-N	428.439	1.766	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)[C@@H]2C[C@H]3CC[C@@H]2O3)C1	1846205422	QCUOULURLRHSAE-SUMDDJOVSA-N	443.456	1.905	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)c1nn(C)c(C)c1Br)C2	1846363453	KLXALGORBVOWKN-LLVKDONJSA-N	433.734	1.562	50	20	IDGD	
O=C(Cc1ccc(Cl)c(F)c1)N1CC[C@H]2[C@@H]1CCN2C(=O)c1ccc(B(O)O)cc1	1847419695	YCKUFCSJRFKVGW-OALUTQOASA-N	430.672	1.217	50	20	IDGD	
CO[C@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)C(Cl)Cl	1847944069	DRLYESFISRPZGX-VOAKCMCISA-N	438.352	1.920	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccccc1Cl)NNC(=O)c1cc(Cl)ccc1O	10627313	NGKVACSEEOAZFI-UHFFFAOYSA-N	432.285	1.829	50	20	IDGD	
Cc1csc(=O)n1CCC(=O)NNC(=O)[C@@H](C)Oc1cccc(Br)c1	14937233	DOSDNUOORJMXAP-LLVKDONJSA-N	428.308	1.986	50	20	IDGD	
CS(=O)(=O)N1CCc2cc(C(=O)NNC(=O)c3cc(Br)c[nH]3)ccc21	23915075	QVLATQSLFTWEGM-UHFFFAOYSA-N	427.280	1.174	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)c1cc(NC(C)=O)cc(NC(C)=O)c1	24351156	HGKWTIQXGVQGDW-UHFFFAOYSA-N	428.445	1.842	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=O)Cc2c[nH]c3ccccc23)n(C)c1	26536485	SCEJSWAITTUCAQ-UHFFFAOYSA-N	431.518	1.541	50	20	IDGD	
Cn1ccnc1[C@H](NC(=O)NNC(=O)CNC(=O)c1cccs1)c1ccc(Cl)cc1	725871042	BQCFZOKVFPLXLU-MRXNPFEDSA-N	446.920	1.985	50	20	IDGD	
COCCCNC(=S)N(C)NC(=O)c1ccc(S(=O)(=O)NCc2ccco2)cc1	726075935	JQELHFUBJBJLOW-UHFFFAOYSA-N	440.547	1.246	50	20	IDGD	
CCN1CCC(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(CC)CC)c2)CC1	726279630	QKRRZHYPTKSYJW-UHFFFAOYSA-N	439.582	1.393	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2cc3c(s2)CCC3)c(C(=O)OC)s1	726519089	BPFWDZLXFXAJSJ-UHFFFAOYSA-N	444.512	1.495	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)c2ccc(-n3ncc(C#N)c3N)cc2)cc1	727241307	SIIKRDJRJFDIMU-AWEZNQCLSA-N	434.456	1.953	50	20	IDGD	
C#Cc1cccc(NC(=S)NNC(=O)CCNS(=O)(=O)c2ccc([N+](=O)[O-])cc2)c1	727499329	YBQQJHLLYCEFFI-UHFFFAOYSA-N	447.498	1.262	50	20	IDGD	
CCC[C@@](C)(NC(=O)OC(C)(C)C)C(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	727723502	ZPFWLXHZVQIIFR-OAQYLSRUSA-N	431.493	1.778	50	20	IDGD	
CCS(=O)(=O)CCNC(=O)NNC(=O)c1cc2c(C)nn(-c3ccccc3)c2s1	727944300	XGRVUEQLHHWXTQ-UHFFFAOYSA-N	435.531	1.774	50	20	IDGD	
CN1CCN(C[C@H](NC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c2ccccc2)CC1	727945138	IYYUZCQUCBBKMB-RXVVDRJESA-N	439.516	1.146	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@@H](NC(=O)NC(C)(C)C)C(C)C)c2ccccc2c1=O	729282183	ZHCYDDFSFSIGCF-HNNXBMFYSA-N	430.509	1.300	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cc3ccccc3n2CC#N)cc1OC	729767408	HWUOCLSKBMPUKQ-UHFFFAOYSA-N	436.424	1.800	50	20	IDGD	
C[C@H]1CC(C)(C)C[C@@]2(C1)NC(=O)N(CC(=O)NNC(=O)CCc1ccccc1O)C2=O	730033964	HHEWWKUJHDIZEM-RCDICMHDSA-N	430.505	1.609	50	20	IDGD	
COc1ccc(C(C)=NNC(=O)CSc2nn(C)c(=O)n(C)c2=O)c2ccccc12	730570817	LODRXBQNIWBYEU-UHFFFAOYSA-N	427.486	1.273	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H]1CNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1	730825660	RNTDWOKQQKNNIQ-INIZCTEOSA-N	447.540	1.423	50	20	IDGD	
Cc1c(C(=O)NNC(=O)[C@H]2COc3ccccc3O2)nnn1-c1ccc(OC(F)F)cc1	731165421	SYROFIIWAQGZMM-MRXNPFEDSA-N	445.382	1.778	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)c1nnn(-c2ccc3c(c2)OCCO3)c1C	731453993	YDFPKHIKFATWDO-UHFFFAOYSA-N	439.428	1.196	50	20	IDGD	
CCc1ccc(C(=O)NNS(=O)(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1	733122093	TWLNUMWBMSNEMX-UHFFFAOYSA-N	437.543	1.657	50	20	IDGD	
CCOCCCN1CC[C@H](NC(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)[C@H](C)C1	734685805	IBYIVEIBZBCCFD-MJGOQNOKSA-N	433.553	1.709	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H]2C[C@H]2c2c(F)cccc2F)c1	734947727	YWJXLXXSTPVHSA-CJNGLKHVSA-N	438.456	1.715	50	20	IDGD	
Cc1cc(NNC(=O)c2ccc(S(=O)(=O)N(C)C)c(Br)c2)nc(C)n1	736711932	SQGZZGDUINBBGR-UHFFFAOYSA-N	428.312	1.863	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@H](Cc2ccccc2)C2CC2)cc1	737065703	CJXPTXKJBFSLLA-HXUWFJFHSA-N	444.557	1.967	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)N[C@H](C)[C@@H]2CN(Cc3ccccc3)CCO2)c1	741277696	CPAGXCRWNYCIJU-IERDGZPVSA-N	442.516	1.937	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1c[nH]c2c(C)cccc2c1=O	741740759	GKRXYBJUBISEKE-UHFFFAOYSA-N	427.486	1.513	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H](c2cccc(F)c2)N2CCOCC2)c1	741897225	CENWZOWMOVJXOM-GOSISDBHSA-N	435.477	1.064	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NC[C@H]2CCN(CC(F)(F)F)C2)cc1	743552745	WMUPWDWKEJAFJM-LLVKDONJSA-N	437.444	1.310	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1=O	743588543	BJLZDCDJVVCUJU-MRXNPFEDSA-N	433.415	1.752	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)CCCN2C(=O)c3ccccc3C2=O)cc1	743830385	TWMDABAZGWHTQH-UHFFFAOYSA-N	444.469	1.319	50	20	IDGD	
CCCc1ccc(N2C[C@@H](C(=O)OCC(=O)NNC(=O)c3ccc(C#N)cc3)CC2=O)cc1	744683038	QHYGBGVBUASXEG-IBGZPJMESA-N	448.479	1.868	50	20	IDGD	
N#Cc1ccc(F)c(CNC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1	745892931	JMGRKDCCZMHGOJ-UHFFFAOYSA-N	445.476	1.626	50	20	IDGD	
CC[C@@H]1Oc2cc([C@@H](C)NC(=O)NNC(=O)COc3ccccc3O)ccc2NC1=O	745934070	YMBGBMHKCMXORW-WBMJQRKESA-N	428.445	1.972	50	20	IDGD	
CCN1CCN(S(=O)(=O)c2ccc(Cl)c(C(=O)NNC(=O)c3ccc[nH]3)c2)CC1	747662920	BFZYMXTWDHLZEL-UHFFFAOYSA-N	439.925	1.069	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NN=C1CCO[C@@H]1C)N(S(C)(=O)=O)CC2	747743037	ZKNFNGZTMBJTAV-WBMJQRKESA-N	425.507	1.234	50	20	IDGD	
CC(C)[C@@H](C(=O)NNc1ccccc1S(=O)(=O)NC(C)(C)C)N1CCCS1(=O)=O	748601376	BQXSWPOLLQVPOP-INIZCTEOSA-N	446.595	1.267	50	20	IDGD	
Cc1nccn1CCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	749214890	JQCHZXBGEVNFLV-UHFFFAOYSA-N	434.522	1.010	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)NO[C@H]2CCCCO2)cc1	749618041	VCIJVCWDYFXUTH-WNJRYGEDSA-N	439.472	1.915	50	20	IDGD	
Cc1ccccc1CC(=O)N1CCN(C(=O)NNC(=O)c2c(C)nc3ccccn23)CC1	749918554	VRGLGBAVGKUNBB-UHFFFAOYSA-N	434.500	1.692	50	20	IDGD	
Cc1nc2cc(O)nn2c(C)c1CC(=O)NNc1nc(Br)cn2ccnc12	750249331	FOFNTUDCDXQQCD-UHFFFAOYSA-N	431.254	1.543	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1	751211164	CYHNXAANRXDMOQ-UHFFFAOYSA-N	431.455	1.971	50	20	IDGD	
O=C(NCCN1C(=O)[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)NNC(=O)C12CC3CC(CC(C3)C1)C2	755248878	XDNYNESZILESPF-OUDNAHMCSA-N	426.517	1.340	50	20	IDGD	
CS(=O)(=O)Cc1cccc(NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c1	756268929	FZBVDUMYOGBXCM-UHFFFAOYSA-N	425.488	1.101	50	20	IDGD	
COC(=O)Cn1ccc(NC(=O)NNC(=O)c2ccc(Br)cc2Cl)n1	756648489	XEFVQLCUJFAIJF-UHFFFAOYSA-N	430.646	1.939	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(F)c(NC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c1	756683335	MCXYCFYIPKVOMB-UHFFFAOYSA-N	425.398	1.451	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)Nc2c(C)nn([C@@H]3CCS(=O)(=O)C3)c2C)c1	757871253	HFJPDKOKXYMAAZ-OAHLLOKOSA-N	435.506	1.400	50	20	IDGD	
O=C(NCC1CC1)NNC(=O)[C@]12CCC(=O)N1c1ccccc1C(=O)N2Cc1ccccc1	759591192	LMIWJOASDZSQRL-DEOSSOPVSA-N	447.495	1.906	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCc2nn(C)c3ccccc23)cc1	760175309	RTXVPSVPRIBORJ-UHFFFAOYSA-N	444.517	1.033	50	20	IDGD	
Cc1c(I)cccc1C(=O)NNC(=O)CNC(=O)c1cccs1	760493895	TYPVXVCHMQRXDJ-UHFFFAOYSA-N	443.266	1.852	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cnc(-c3cccnc3)s2)c1	761196835	MYIJQJLONKEUAF-UHFFFAOYSA-N	431.499	1.530	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)nc2ccccc21	761806592	QCMBLFQATSJEPN-GOSISDBHSA-N	434.500	1.637	50	20	IDGD	
CC(=NNC(=O)[C@@H](C)CN1C[C@H](C)O[C@H](C)C1)c1c(C)nn(CCS(C)(=O)=O)c1C	763155223	IWJCDFAADNOWGF-SOUVJXGZSA-N	441.598	1.130	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccccn2)n(-c2ccccc2C(F)(F)F)n1	763467672	SCZFWFVUDHCHDL-UHFFFAOYSA-N	432.362	1.994	50	20	IDGD	
Cn1cc(Br)cc(NC(=O)C(=O)NNC(=O)c2c[nH]c3ccccc23)c1=O	763534936	MUCYTBZBDRCSPE-UHFFFAOYSA-N	432.234	1.029	50	20	IDGD	
C=CCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(OC)c(OC)c2)cc1	763551435	XBEPHCTVFDJIMS-UHFFFAOYSA-N	426.429	1.019	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)Nc1ccc(F)cc1OC(F)F	763572505	RVHSDWPLIKKYRV-CQSZACIVSA-N	425.319	1.353	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccc(N2CCCCC2=O)c1	763656601	DLUGHJAEWCGBOE-UHFFFAOYSA-N	440.456	1.377	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc3nc4n(c(=O)c3c2)CCC4)cc1C	763664900	MOVDXEMIGBFFOP-UHFFFAOYSA-N	449.467	1.124	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccccc2SCCC(N)=O)c1	763757130	DHBQKMVBQHMWTL-UHFFFAOYSA-N	429.502	1.120	50	20	IDGD	
O=C(NNC(=O)C1=S=C2CCCC2=C1)C(=O)Nc1ccnn1Cc1ccccc1F	763786145	WAFZJWROIJGMTJ-UHFFFAOYSA-N	427.461	1.358	50	20	IDGD	
CCCCN(C)c1ccc(NC(=O)C(=O)NNC(=O)c2nnc(O)c3ccccc23)cc1	763790588	LSXMQILSBLITBX-UHFFFAOYSA-N	436.472	1.971	50	20	IDGD	
CCc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(C(C)(C)C)cc2)cc1S(N)(=O)=O	763796431	DKYHQFFXMVFYCX-UHFFFAOYSA-N	446.529	1.594	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccnn2Cc2ccccn2)c1C	763840224	JMUHZVOALRTILL-INIZCTEOSA-N	436.472	1.497	50	20	IDGD	
COC(=O)c1cc2cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc3ccccc3F)ccc2o1	763848588	DFOGJKCSZAQSDD-NSHDSACASA-N	443.387	1.912	50	20	IDGD	
COc1ccc(NC(C)=O)cc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1cccc(C)c1C	763851054	QEBCRKDECXXRQQ-AWEZNQCLSA-N	442.472	1.824	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc3ccccc3F)cc2)CCO1	763864887	LTNHPYNWENEPKW-LSDHHAIUSA-N	444.463	1.604	50	20	IDGD	
CC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)cc1Cl	763865533	LFXDOINTXJSCGZ-SNVBAGLBSA-N	436.827	1.991	50	20	IDGD	
Cc1ccc(C(=O)NC2CC2)cc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccccc1F	763866573	WHVVJMRZAFLHKR-ZDUSSCGKSA-N	442.447	1.580	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(C#N)cc2Cl)cc1	763872288	NJZHELPHMJKXAE-GFCCVEGCSA-N	428.832	1.968	50	20	IDGD	
CC(C)CC(=O)NNC(=O)C(=O)Nc1ccc(CCn2nnc(-c3ccccc3)n2)cc1	763889026	UPXHHODJFDGVDJ-UHFFFAOYSA-N	435.488	1.715	50	20	IDGD	
CC(C)(C)Sc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1	763917588	YSSBXVXAZXQKAQ-UHFFFAOYSA-N	439.501	1.953	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cccn2C)cc1I	763998437	HZASAHHTZAXYKG-UHFFFAOYSA-N	426.214	1.338	50	20	IDGD	
O=C(Cc1ccc2ccccc2c1)NNC(=O)C(=O)Nc1ccnn1Cc1ccccn1	764080867	BOWRUDDURJLBGI-UHFFFAOYSA-N	428.452	1.808	50	20	IDGD	
CC[C@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(-c2csc(N3CCOCC3)n2)cc1	764084870	PCLAHOKVKYHOST-ZDUSSCGKSA-N	431.518	1.779	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1cnn(-c2ccccc2F)c1C	764136419	QGBAVGYDBSRWOE-UHFFFAOYSA-N	425.420	1.657	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)CCc2ccco2)cc1OCC(F)(F)F	764176408	AZFFUGDDUVLVKW-UHFFFAOYSA-N	429.351	1.948	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)CC(C)(C)C)ccc1NC(=O)c1cccnc1	764198649	IRVUKCAQLNOZHE-UHFFFAOYSA-N	427.461	1.865	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)Cc2cccnc2)sc2c1CC[C@H](C)C2	764268123	FMYRAEVBWUHASG-LBPRGKRZSA-N	444.513	1.773	50	20	IDGD	
COC(=O)c1cc(C(C)(C)C)sc1NC(=O)C(=O)NNC(=O)COc1ccccc1O	764276062	YDGKHTBOIPAKRI-UHFFFAOYSA-N	449.485	1.703	50	20	IDGD	
CN(C)c1nc2cc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc3ccccc3)ccc2o1	764370136	NIRIFGRIAXXDJN-UHFFFAOYSA-N	433.371	1.652	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)[C@@H](C)NS(=O)(=O)c3cccc(C#N)c3)cc2C1	764571798	KLSOKKLEIDGWLY-QWHCGFSZSA-N	446.554	1.873	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)C[C@@H]2CN(C(=O)OC(C)(C)C)CCO2)cc1C	765384167	GWHVAXLVNZYWBY-MRXNPFEDSA-N	434.493	1.415	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1cc2ccccc2c(O)n1	765733878	SBHYOGIFZSNWAT-UHFFFAOYSA-N	433.468	1.159	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)CN1CCN(C(=O)c2ccc(F)cc2F)CC1	766878713	QKHPARGFDHIMPH-UHFFFAOYSA-N	430.455	1.421	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)[C@@H](O)c1ccc(Br)cc1	767356386	VYQUNBVMIAIOJC-SFHVURJKSA-N	435.274	1.724	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](OCC(=O)NNC(=O)c2nnc(O)c3ccccc23)C1	767730095	VIGSRZRLJDWYDY-ZDUSSCGKSA-N	445.476	1.513	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(O)c(C(=O)NNC(=O)c2cccc(OC(F)F)c2)c1	767954254	IIZGXIRDIIJRJY-UHFFFAOYSA-N	429.401	1.319	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccccc1OCC(=O)Nc1cccnc1	768237332	JOCFJJLGXVQTRM-UHFFFAOYSA-N	447.451	1.807	50	20	IDGD	
Cc1ccc([C@H](CN2CCOCC2)NC(=O)NNc2nc(O)c3cnn(C)c3n2)cc1	770343648	NWYLHCMZXAUAFI-INIZCTEOSA-N	426.481	1.077	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)N[C@H]3CCN(c4ccc(C(F)(F)F)cc4)C3)nc21	770394603	CYLHLGBJIWVJRN-NSHDSACASA-N	436.398	1.993	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)[C@@H](C)NS(=O)(=O)c2cccc(C(F)(F)F)c2)c(O)c1	770989458	GHRQANZNKYZCKF-LLVKDONJSA-N	445.419	1.847	50	20	IDGD	
NS(=O)(=O)c1cccc(N2C[C@H](C(=O)NNc3c(F)cccc3Cl)CC2=O)c1	771674090	LCMZDOWHIIEWOB-SNVBAGLBSA-N	426.857	1.623	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C1=NN(c2ccccc2)C(=O)[C@@H](C)N1	772963967	MSONKTFETDDOCF-OLZOCXBDSA-N	429.864	1.593	50	20	IDGD	
Cc1cc(C(=O)O)c(O)c(S(=O)(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)c1	773264902	NLTBBNCIGUETNQ-JTQLQIEISA-N	428.850	1.829	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNc2ccc3ccccc3n2)cc(S(C)(=O)=O)c1	773655887	UEYSUJLUZFNGGT-UHFFFAOYSA-N	442.453	1.507	50	20	IDGD	
CC(=O)N1CCc2cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc3cccc(Cl)c3)ccc21	774009417	PKAZYNBTMQFGEE-LBPRGKRZSA-N	444.875	1.802	50	20	IDGD	
Cc1ccc(C)n1-c1ccc(C(=O)NNC(=O)NC[C@H]2CC[C@H](C(=O)N(C)C)O2)cc1	775460841	MJSUBTMCJDYWDL-RTBURBONSA-N	427.505	1.674	50	20	IDGD	
CCOC(=O)c1c(NC(=O)NNC(=O)[C@H]2Cc3ccccc3O2)c(C#N)cn1CCOC	775765449	KWPXMLBVXVJKBT-MRXNPFEDSA-N	441.444	1.339	50	20	IDGD	
COCCO[C@H]1COCC[C@H]1NC(=O)NNC(=O)c1ccc(COc2ccccc2)o1	776845249	UMMCLLGNVDAEJI-MJGOQNOKSA-N	433.461	1.623	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cc(C(C)=O)c(C)nc2C)cc1OC	777110267	XNMSDGBFPBVORH-UHFFFAOYSA-N	429.429	1.536	50	20	IDGD	
O=C(Cc1csc(-c2cccnc2)n1)N1CCN(S(=O)(=O)CBr)CC1	777778161	ZJPHFYZWIUVGNM-UHFFFAOYSA-N	445.364	1.574	50	20	IDGD	
O=C(CCc1nnc(-c2ccsc2)o1)N1CCN(S(=O)(=O)CBr)CC1	777779447	LFJRKPISSBMPBC-UHFFFAOYSA-N	449.352	1.557	50	20	IDGD	
Cc1c(I)cccc1C(=O)NNC(=O)CNC(=O)OC(C)(C)C	778445795	QYVBIBZFQSKOBQ-UHFFFAOYSA-N	433.246	1.885	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNS(=O)(=O)c2cccc(C)c2F)cc1	781558124	MONPYYCPBMFFGH-UHFFFAOYSA-N	429.495	1.073	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NNc2ncncc2Cl)o1	781835653	FRPMLVUNBNOKEQ-NSHDSACASA-N	443.869	1.196	50	20	IDGD	
CNS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccc(Cl)cc2[N+](=O)[O-])cc1	783290777	FTCJPRQUYSSBRI-UHFFFAOYSA-N	427.826	1.238	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)C(=O)Nc2cccc(C#Cc3ccccn3)c2)c1	784846064	JZJCFBQRRSWLKB-UHFFFAOYSA-N	434.477	1.967	50	20	IDGD	
Cn1cc(NC(=O)C(=O)NNc2cccc(C(F)(F)F)n2)cc(Br)c1=O	784957065	CEFFZFDSPMWBLX-UHFFFAOYSA-N	434.172	1.643	50	20	IDGD	
Cc1ccc(C(=O)N2C[C@H](C)C[C@@H](C)C2)cc1NC(=O)C(=O)NNc1nccn(C)c1=O	785090144	ODDFIXHSCZACTM-ZIAGYGMSSA-N	440.504	1.289	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1ccccc1-n1ccc(C)n1	785330077	CUTNZZIPAVEQKA-UHFFFAOYSA-N	443.485	1.675	50	20	IDGD	
Cc1ccc(C)c(-n2cnc3cc(C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)ccc32)c1	788587727	LKUZGTUWSGQCJH-CQSZACIVSA-N	429.502	1.341	50	20	IDGD	
Cn1nc([C@H]2CCCO2)cc1NC(=O)C(=O)NNC(=O)CSc1ccc(Cl)cc1	789732000	KBMALUOPTGDOCE-CQSZACIVSA-N	437.909	1.803	50	20	IDGD	
COC(=O)c1cc(C)ccc1NC(=O)C(=O)NNC(=O)[C@H]1OCC[C@H]1c1ccccc1	789813792	WAHBMVAIJWRZJK-YJBOKZPZSA-N	425.441	1.440	50	20	IDGD	
COCC1(C)CN(C(=O)/C(C#N)=C\c2cn(CCC(N)=O)nc2-c2ccc(OC)cc2)C1	790423605	XODOHCBFKRTIJZ-YVLHZVERSA-N	437.500	1.836	50	20	IDGD	
O=C(NNc1cccc(F)c1[N+](=O)[O-])c1cccc(S(=O)(=O)NC[C@@H]2CCCO2)c1	790588372	VSJDMMMDFAIXMX-ZDUSSCGKSA-N	438.437	1.948	50	20	IDGD	
Cc1noc(C)c1S(=O)(=O)N1CCC[C@@H](C(=O)NNc2cccc(F)c2[N+](=O)[O-])C1	791069513	MPWBSWDYFNTBMA-GFCCVEGCSA-N	441.441	1.883	50	20	IDGD	
CC(C)c1c(NC(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)cnn1-c1ccccc1Cl	792498487	GPCSEIVACMIOPB-NSHDSACASA-N	442.929	1.740	50	20	IDGD	
NC(=O)CSc1ccccc1NC(=O)NNC(=O)CNC(=O)OCc1ccccc1	792794364	WLPJKNZIXQIART-UHFFFAOYSA-N	431.474	1.343	50	20	IDGD	
CC(C)(C)OC(=O)NCCc1nc(C(=O)NNC(=O)COc2ccc(C#N)cc2)cs1	792802088	UZYSUZOJROOXPR-UHFFFAOYSA-N	445.501	1.922	50	20	IDGD	
CC(=O)N[C@@H](CC(=O)N([C@H]1CCS(=O)(=O)C1)N(C)C)c1ccc(Br)cc1	792855831	URDXSHICDUMNFP-HOTGVXAUSA-N	446.367	1.509	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NN=C(c2ccc(Cl)c(S(N)(=O)=O)c2)C2CC2)c1	794522618	AINZZEWIDRMWSO-UHFFFAOYSA-N	435.893	1.885	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H](C)Oc2ccc(C=O)cc2)c1	794740839	ISJIZUZBKGFMEY-OAHLLOKOSA-N	447.513	1.758	50	20	IDGD	
Cc1oc(C(C)C)cc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	794743324	YHQYSNUMKUYVPJ-UHFFFAOYSA-N	435.502	1.807	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C[C@@H]1COCCN1C(=O)OC(C)(C)C	795168220	JYSXFTDLZQVFSB-CQSZACIVSA-N	442.538	1.406	50	20	IDGD	
CO[C@@H](CNC(=O)OC(C)(C)C)CC(=O)NNc1ccccc1S(=O)(=O)N(C)C	795169274	LCTTXQOOLBVLNQ-CYBMUJFWSA-N	430.527	1.310	50	20	IDGD	
O=C(CNS(=O)(=O)c1cccs1)NNc1cc([N+](=O)[O-])ccc1Br	800620596	VWVIZDOLXSXSBN-UHFFFAOYSA-N	435.281	1.840	50	20	IDGD	
C[C@H]1C[C@H](C)CN(S(=O)(=O)c2cccc(C(=O)NNC(=O)N=c3cc[nH]cc3)c2)C1	802030294	YDQLLCZTVKQDDE-GJZGRUSLSA-N	431.518	1.637	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(\C#N)C(=O)NS(=O)(=O)c2cnc3n2CCC3)c1C	802208939	DEZJAMRMOCIVAO-VEJKBTLKSA-N	431.518	1.867	50	20	IDGD	
NC(=O)CC[C@@H](NC(=O)CCC1CCCC1)C(=O)NNc1ccc2c(=O)[nH]ccc2c1	803431873	HYJDGGJWJJILBV-GOSISDBHSA-N	427.505	1.692	50	20	IDGD	
O=C(NCc1ccc(N2CCCS2(=O)=O)c(F)c1)NNc1ccc(-n2ccnc2)nn1	805309261	MUIXUYTUSLKAHQ-UHFFFAOYSA-N	446.468	1.168	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccc(F)c(N3C(=O)CCC3=O)c2)c1	806743337	DDAAJOSOKSXZBR-UHFFFAOYSA-N	448.432	1.349	50	20	IDGD	
CC1(C)CC(=O)c2cc(NC(=O)C(=O)NNC(=O)COc3ccc(F)cc3)ccc2O1	806974618	PHKINJLWIYZILP-UHFFFAOYSA-N	429.404	1.734	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)nc1)C(=O)Nc1ccc(F)c(N2CCCNC2=O)c1	806976059	BTXUMJVSNRGVGX-UHFFFAOYSA-N	434.815	1.194	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)C(=O)Nc1ccc(F)c(N2C(=O)CCC2=O)c1)c1ccccc1	806979564	AAXXXBOWWAFUTB-OAHLLOKOSA-N	440.431	1.759	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)cc2C1	807134549	BMIUXRXOJYHESP-NSHDSACASA-N	440.489	1.138	50	20	IDGD	
O=C(COc1ccccc1-c1ccccc1)NNC(=O)NC[C@@H]1CCCS(=O)(=O)C1	807581007	JVTGPQKQAMOCFC-INIZCTEOSA-N	431.514	1.888	50	20	IDGD	
NS(=O)(=O)c1ccccc1CNC(=O)NNC(=O)CCSc1ccc(F)cc1	807605986	UQWSYDKOBRKHNF-UHFFFAOYSA-N	426.495	1.486	50	20	IDGD	
CN(C)c1c(C=NNC(=O)COc2ccccc2Cc2ccccc2)c(=O)n(C)c(=O)n1C	807950947	ZTJVMWLSHDTUJL-UHFFFAOYSA-N	449.511	1.270	50	20	IDGD	
Cc1ccc(NNC(=O)C(=O)Nc2cc(C)c(F)cc2C(=O)NCC(F)(F)F)nn1	810394864	DNUQNRAENVJALW-UHFFFAOYSA-N	428.346	1.606	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)c2ccc(N3CCCS3(=O)=O)cc2)cc1	812731677	QLGCFSYULXMFRG-UHFFFAOYSA-N	438.531	1.234	50	20	IDGD	
O=C(CN1CCC[C@@](CO)(Cc2ccccc2)C1)NNC(=O)c1ccc([N+](=O)[O-])cc1	812874223	YNDSOSWZFYSDCL-JOCHJYFZSA-N	426.473	1.673	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccnn2-c2cccc(F)c2)cc1	813033888	PZYIUJYLDHSVCY-UHFFFAOYSA-N	446.464	1.344	50	20	IDGD	
CC(C)C(=O)Nc1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)ccn1	814722389	XNAZMVZPVUIGPW-UHFFFAOYSA-N	433.490	1.001	50	20	IDGD	
CCCN1C(=O)c2ccccc2N2C(=O)CC[C@]12C(=O)NNC(=O)Cc1ccccc1F	815539660	UGSADLSWYXZGEK-QHCPKHFHSA-N	438.459	1.905	50	20	IDGD	
Cc1cc(Oc2ccccc2)ccc1NC(=O)C(=O)NNC(=O)[C@@H]1CCc2nncn2C1	815690949	APRHYHSQYDFOMA-OAHLLOKOSA-N	434.456	1.727	50	20	IDGD	
CCN(CC)C(=O)COc1ccc(NC(=O)C(=O)NNc2ncncc2F)cc1Cl	815764188	WBVFCKNSGABYKK-UHFFFAOYSA-N	438.847	1.598	50	20	IDGD	
O=C(COC(=O)CCn1cnc2sccc2c1=O)NNC(=O)c1cccc(Cl)c1	830383734	ODOZCSZVLSATMV-UHFFFAOYSA-N	434.861	1.506	50	20	IDGD	
O=C(c1cc(S(=O)(=O)N2CCc3ccccc3C2)ccc1Cl)N1CC[C@@H](B(O)O)C1	864234059	ORXVMEJGUCATIG-MRXNPFEDSA-N	448.737	1.776	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H](C)n2cccn2)c1	913471021	CIZKNSVOKVMUQV-AWEZNQCLSA-N	443.485	1.715	50	20	IDGD	
O=C(CNS(=O)(=O)c1cccc(Br)c1)NNC(=O)c1cccc(Cl)c1	913509755	ANLGEZZCBDCZRB-UHFFFAOYSA-N	446.710	1.842	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)NCCCN1CCN(c2ncccn2)CC1	913638270	CZVOCGSBCMHRRK-UHFFFAOYSA-N	447.927	1.295	50	20	IDGD	
Cc1nn(-c2ccccc2)c2sc(C(=O)NNC(=O)NCCN3CCOCC3)cc12	915884974	XKGCXNLYVJRFCR-UHFFFAOYSA-N	428.518	1.672	50	20	IDGD	
CC(=NNC(=O)[C@@H]1COc2ccccc2O1)c1ccc(S(=O)(=O)N2CCOCC2)cc1	916293304	IWCRORXWVPQLFV-FQEVSTJZSA-N	445.497	1.388	50	20	IDGD	
Cc1cccc([C@H](CNC(=O)NNC(=O)c2ccc3c(c2)OCCO3)N2CCOCC2)c1	916437427	JRUFFMOZBCTKGQ-IBGZPJMESA-N	440.500	1.784	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCCN2CCc3ccccc3C2)c2ccccc2c1=O	916444480	HOQSWSPCCHPXAR-UHFFFAOYSA-N	434.500	1.419	50	20	IDGD	
C[C@@H](CN1CCCCC1)NC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	916462113	QXRWXGNKSWUXJW-INIZCTEOSA-N	437.566	1.290	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)c1cnc2nc(O)nc(O)c2c1	916735538	YXGGCCSFQXHJTC-MRVPVSSYSA-N	448.233	1.427	50	20	IDGD	
CCC(=O)Nc1cccc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1	917311057	YBHNVGKCKWMNTA-KRWDZBQOSA-N	427.413	1.179	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)c2csc(N3CCOCC3)n2)c2ccccc12	917723729	KNXPGCSJXKQINQ-UHFFFAOYSA-N	448.526	1.765	50	20	IDGD	
CNS(=O)(=O)c1ccc([C@H](C)NC(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)cc1	919779410	RLKVRHBOSJSOGB-STQMWFEESA-N	438.481	1.593	50	20	IDGD	
O=C(CCNC(=O)OCC(F)(F)F)NNC(=O)COc1ccc(Br)cc1	919972104	XTXJKGRIRVTVSP-UHFFFAOYSA-N	442.188	1.654	50	20	IDGD	
CCCCN1C(=O)CC[C@@H](C(=O)NNC(=O)CN2CCCC2=O)[C@H]1c1ccccc1OC	920435575	JXHILNPIXQHTPD-VGOFRKELSA-N	444.532	1.545	50	20	IDGD	
COc1ccc(-c2nn(CCC#N)cc2C(=O)NNC(=O)NCC2CC2)cc1[N+](=O)[O-]	920858775	ANHQRKUFAMWQKP-UHFFFAOYSA-N	427.421	1.735	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)c3nnn(-c4cccc(F)c4)c3C(F)(F)F)nc21	1116317081	DIJOIWZSNIEALE-UHFFFAOYSA-N	437.317	1.564	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)CNS(=O)(=O)c1ccccc1	1317736786	YSEUALPVYVKBNT-OAHLLOKOSA-N	427.482	1.733	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)NCCc2ccc3c(c2)OCCO3)CC1	1318620189	GMXKXSKJVILMIX-UHFFFAOYSA-N	448.520	1.978	50	20	IDGD	
O=C(CCc1nc2cccnc2[nH]1)NNc1ccccc1S(=O)(=O)N1CCOCC1	1318806804	CEEGFKUTXIOQSS-UHFFFAOYSA-N	430.490	1.055	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)c1nc(-c2ccc(F)cc2)n2c1CCCCC2	1320140137	RSOIFHLQUUKNRY-GFCCVEGCSA-N	437.497	1.114	50	20	IDGD	
O=C(N=c1cc[nH]cc1I)NNC(=O)c1n[nH]c2c1CCCC2	1320171160	ANCYUIPXCUEGGX-UHFFFAOYSA-N	426.218	1.177	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)CN2CCc3ccccc3C2=O)CC1	1321144777	ZNRQLEAHAVWDSF-UHFFFAOYSA-N	430.505	1.479	50	20	IDGD	
CN1CCN(C(=O)c2ccccc2NC(=O)NNC(=O)c2n[nH]c3c2CCCC3)CC1	1342390243	YWBAZDJQNANVBT-UHFFFAOYSA-N	425.493	1.143	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2)c1cncc2cnccc12	1780013870	GXEHPNRVAPQQFV-WAOWUJCRSA-N	432.908	1.357	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3nn[nH]c3C(F)(F)F)C2)C1	1780364330	KOUUWPGIZNTFOV-ZIAGYGMSSA-N	444.241	1.503	50	20	IDGD	
C=CCNC(=O)/C=C\C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@](C)(Cl)CCl)C1	1780705702	IMNZJIDCKIEYLV-NQOROCTESA-N	446.375	1.595	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc[n+]([O-])cc1)C2	1780715364	QWLYEQJRLADWTD-AYOQOUSVSA-N	430.332	1.684	50	20	IDGD	
COc1ccc(C2(C(=O)N3CC[C@@]4(CN(C(=O)[C@H](O)CCl)CCO4)C3)CCC2)cc1	1781204195	HBKWJUAAHLISFQ-WIYYLYMNSA-N	436.936	1.547	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)c3cnn4ncccc34)CCO2)C1	1781227337	JKGYRXGHQSHZLU-MSOLQXFVSA-N	426.304	1.409	50	20	IDGD	
CN(C)c1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@](C)(Cl)CCl)C3)C2)cn1	1781229607	GNSZBFOSHLZBOP-MOPGFXCFSA-N	429.348	1.827	50	20	IDGD	
O=C(c1n[nH]c2cccc(F)c12)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781332433	HNOKLMBQWYYNSF-WMLDXEAASA-N	443.248	1.836	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cn3ncccc3n1)C2	1782173130	YFPAPOUUHRWFJG-YYFZDKIDSA-N	435.912	1.111	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1c[nH]c3cnccc13)C2	1782176021	UOKJWXPTSHXZSP-HGHGUNKESA-N	434.924	1.944	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CCC(=O)NN(C)C)C2)c(C)n1C	1782212366	XOKUNHSHIJLVGD-AUSIDOKSSA-N	447.580	1.142	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](O)Cc3ccccc3)C2)C1	1783344150	PJDJAMSUZFGSHX-SQGPQFPESA-N	439.350	1.593	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](C)n1ccnc1C)CCO2	1783352912	JJYYXZIMEXESRO-QIIPPGSGSA-N	427.343	1.756	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cnc(OCF)cn3)CCO2)C1	1783533245	YIXNRRKNLVMVLZ-BZNIZROVSA-N	431.262	1.009	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cc3c(s1)CCCC3)CCO2	1783935304	PSQLVIDBMLAMEN-JOCHJYFZSA-N	448.589	1.443	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(O)nc(O)c3)[C@H]2C1	1787295011	KXYUIWHRYDXTQT-PYJNHQTQSA-N	442.310	1.260	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCNC(=O)OC(C)(C)C)C[C@@H]21	1789864151	LRNAQNNYMRXBEQ-VGWMRTNUSA-N	431.961	1.898	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)COc3cccnn3)C[C@@H]21	1789872215	DMCXDYHDYRCUEF-WZTLGTBRSA-N	431.320	1.071	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccn4ccnc34)C[C@@H]21)[C@H](F)Br	1789926168	PNFIKAVVSBPKAQ-MXAVVETBSA-N	439.285	1.618	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](CN)c3ccccc3)C[C@@H]21	1791057945	LXKDIUDHHRDDGN-JFMONLCZSA-N	438.366	1.492	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc(OC)c(F)c3)C[C@@H]21	1791256873	YFKUEYKMEVGVGR-GGXPGOJBSA-N	442.915	1.610	50	20	IDGD	
C[C@H]1CC[C@H](C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)CC1	1791747126	FDQBSRMZUMYMMS-UKSSEWCLSA-N	443.548	1.105	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN(C(=O)OC(C)(C)C)C1CC1	1792637554	VIJWVTJZXGNATN-CXHZTBPHSA-N	443.972	1.993	50	20	IDGD	
C[C@@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(C)(C)CCl	1792785545	FCJBRTCTWYPYSG-APIJFGDWSA-N	431.961	1.754	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2)[C@@H]1CC(=O)N(Cc2cccs2)C1	1793974549	SUVKGAZDFVDFDF-XRQSXFTLSA-N	443.928	1.221	50	20	IDGD	
COc1cccc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CO[Si](C)(C)C)C3)n1	1794014843	QTTWVRXKIUDVLG-VPTLXERWSA-N	435.597	1.464	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnn3cccc(F)c13)C2	1799279283	GMWCAEBEBKYRCJ-CVGJEZRXSA-N	443.306	1.913	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2ccnn2c1	1800028068	HMXQOWACRQONNF-YALNPMBYSA-N	435.322	1.711	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nc[nH]n1)C2)[C@@H](Br)Cc1ccccc1	1800436099	QUINBXPHKBNZCM-FZKCQIBNSA-N	448.321	1.014	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CNc3ccccc31)C2	1800639864	PNEQQFWWCPSVMI-IJHJFAERSA-N	436.350	1.959	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc(Cl)c(Cl)c1)C2	1800977213	UOGLUSVTVFNVPK-ZMJPVWNMSA-N	436.723	1.845	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c(F)ccc(OC)c1OC)C2	1800977770	XTJXHEPXQYITSP-IPJQOSJUSA-N	444.887	1.300	50	20	IDGD	
Cc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCC(=O)NN(C)C)c(Cl)c1	1801012117	FOXPAGLKHMDLAL-YVWYUNDQSA-N	436.940	1.225	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCc1ccc(N(C)C)cc1	1801194591	CKSVFQVIRNKIAG-SHJAMOMRSA-N	437.968	1.529	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CO[Si](C)(C)C)C3)c1	1801787511	DVAAZHHPWLOGRW-XEMDLRDOSA-N	433.581	1.700	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cc1cn3nc(C)sc3n1)C2	1802270466	RLEQKWARPOLGPC-FAAHXZRKSA-N	425.942	1.534	50	20	IDGD	
Cc1occc1C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1	1805613596	HNGYMMDXEYOFLB-OXJNMPFZSA-N	448.483	1.615	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCC2(CCCN(C(=O)CN3CC(=O)NC3=O)C2)CC1	1806695761	DCFQJNWSKLUBCQ-QGZVFWFLSA-N	433.336	1.006	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@@H](CNC(=O)CS(C)(=O)=O)[C@H]1c1cccnc1	1806763385	DAUQSMBHWDUVSY-IVMMDQJWSA-N	446.367	1.163	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)CCC(F)(F)F)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1	1807370555	GSAZJZOQLDVHMZ-VQIMIIECSA-N	449.238	1.424	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC2(CCCN(C(=O)c3cnccc3N(C)C)C2)CC1	1807763520	DMGKEYYYRUYMIV-UHFFFAOYSA-N	444.580	1.365	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@H]1CCN(C(=O)CCn2cncn2)[C@H]1c1cccnc1	1810547386	FQHXXLTXRLSXED-XLIONFOSSA-N	430.585	1.621	50	20	IDGD	
Cc1ccn(C)c1C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1	1815343653	HFZKINAGFVVPMY-OAHLLOKOSA-N	438.318	1.009	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1sccc1F	1815428055	ZOCRZLJTFQNBDH-INIZCTEOSA-N	442.281	1.910	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)Cc3cccs3)sc2C1	1815596132	QMAKAPNDUQPVBD-GFCCVEGCSA-N	435.575	1.732	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccno2)n[nH]1	1816440395	LNQOCZOGYOEPGI-ZIFAQYRBSA-N	438.448	1.838	50	20	IDGD	
O=C(CCBr)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2CCCS2(=O)=O)[nH]n1	1816784191	DBNOCDLVKBCDHN-STQMWFEESA-N	447.355	1.764	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H]1CCOC1)CC2	1817282723	LCXJKSAIFKIBFW-GNZFJNCUSA-N	444.517	1.226	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](F)Br)CC2	1817305906	ZTAFTVIANLVBOM-FDOIEUKUSA-N	435.319	1.612	50	20	IDGD	
Cc1nc(C)c(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)o1	1817472671	ZFQWVPMWMDNNLZ-KRWDZBQOSA-N	437.265	1.314	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnc4ncccn34)sc2C1	1818439752	ARGVNRKHBCSATK-MNOVXSKESA-N	434.909	1.665	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3ccc4ncnn4c3)sc2C1	1819402819	QGGADOCFRDJJKC-RYUDHWBXSA-N	434.909	1.665	50	20	IDGD	
CC(C)/C=C/C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819404410	JCXSIVANHOQXHR-LXXRFIIISA-N	425.493	1.926	50	20	IDGD	
C=C[C@@H](O)C(C)(C)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCC(=O)NN(C)C)CC2	1819720265	DVPWMAVYCHOWEP-SWLSCSKDSA-N	437.566	1.001	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)C1=COCCC1)CC2	1819800487	PESVTUDRLUDJFD-GFCCVEGCSA-N	442.501	1.062	50	20	IDGD	
Cc1ccc(O)c(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)c1	1820463478	QQWJWIRBBOPNGF-IBGZPJMESA-N	448.288	1.723	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H]2CCNC(=O)C2)n[nH]1	1822476507	CPBCUVQSSHIGLS-DYEKYZERSA-N	440.342	1.959	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)c2ccnc(F)c2)CC1	1824720069	INTQKZGVNPHMFX-HXUWFJFHSA-N	439.296	1.448	50	20	IDGD	
C=CCC(F)(F)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2	1825250435	MMXQQIRIGYRNTR-CYBMUJFWSA-N	435.261	1.260	50	20	IDGD	
O=C(Cn1cnc2ccccc21)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](O)CCl)CC2	1825846538	SYGDVOUWGMLPCW-NHYWBVRUSA-N	433.921	1.705	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnc(N)s2)CC1	1826998616	PSKNQEAHRUADCL-OAHLLOKOSA-N	436.582	1.332	50	20	IDGD	
Cc1cc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)on1	1827055681	CFSBUJBJYVTKKR-LJQANCHMSA-N	425.294	1.210	50	20	IDGD	
COC[C@@H](C)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1	1828923719	VUUIPNPIXVZMIY-DNVCBOLYSA-N	431.537	1.201	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3CCC[C@@H]3C)C2)C1	1830539418	GQDSOJUZEBQXGU-CYJAXWMASA-N	431.371	1.910	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1830732829	BMLSOYGUAIRSHA-DNVCBOLYSA-N	447.315	1.018	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccn(CCOC)n3)C2)C1	1831647873	ZTYFFZQZOVRQSW-JXFKEZNVSA-N	442.944	1.007	50	20	IDGD	
O=C([C@@H](F)Br)N1CCC([C@H]2CCCCN2C(=O)CCn2cncn2)CC1	1832119360	ICDLITPEMGUFAZ-GDBMZVCRSA-N	430.322	1.978	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(C)no3)CCO2)C1	1834227463	GHUGTTIPURZMGI-SUMWQHHRSA-N	430.299	1.227	50	20	IDGD	
Cn1cccc1C(=O)N1CCC(N2CCC(NC(=O)CCBr)CC2)CC1	1834421269	ZJNATJWWMKTFQH-UHFFFAOYSA-N	425.371	1.995	50	20	IDGD	
Cc1nc(CC(=O)N2CCC(N3CCC(NC(=O)CCBr)CC3)CC2)no1	1834422532	UBZLFUCTGPAWIS-UHFFFAOYSA-N	442.358	1.277	50	20	IDGD	
Cc1ncc(C(=O)N2CCOC[C@]3(CN(C(=O)CCBr)CCO3)C2)s1	1834821626	QKGOGFLTVYNSTI-INIZCTEOSA-N	432.340	1.307	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)c1ccncc1Cl	1835899119	PEIDZWQIDMWWPB-KRWDZBQOSA-N	429.348	1.520	50	20	IDGD	
Cc1nn(C)c(C(=O)N2CCC(OC3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)c1F	1836715127	JWHHYLVJKCPNCR-HNNXBMFYSA-N	430.908	1.080	50	20	IDGD	
O=C(c1c[nH]c2nccc-2c1)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836718046	QRNHHTHIZAGDOL-GOSISDBHSA-N	434.924	1.726	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc4ncccn4n3)CCO2)C1	1836866218	BAIOKIVOOPFBRQ-YWZLYKJASA-N	435.912	1.207	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@H](COC)NC(C)=O)CC2)CC1	1836923483	ZJPPEGYRZXNONP-OALUTQOASA-N	445.988	1.544	50	20	IDGD	
Cc1ccc(C(=O)N2CCC(OC3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)nc1	1837532769	SXBRAXQODTYQAY-UHFFFAOYSA-N	445.564	1.375	50	20	IDGD	
CCn1nc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@](C)(Cl)CCl)C3)C2)cc1C	1838152051	BVBMVNLADLFVLT-MOPGFXCFSA-N	447.363	1.518	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)N1CCC(OC2CCN(C(=O)[C@H](Cl)CC)CC2)CC1	1838383018	VOXTUTJLPMQRDJ-RHSMWYFYSA-N	430.977	1.710	50	20	IDGD	
C/C=C(/C)C(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1	1838394481	AEYDRKHFLPUBDJ-CQPUUCJISA-N	429.521	1.264	50	20	IDGD	
O=C(CC12CCCN1CCC2)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1839119019	COPVSYQTNNKEKN-LJQANCHMSA-N	434.364	1.265	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(OC)cc3OC)C2)C1	1839146646	RJWQGGSXYBLMAD-DYESRHJHSA-N	440.924	1.791	50	20	IDGD	
Cc1cc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)no1	1839155114	JNZQOTOJHMDOSJ-MSOLQXFVSA-N	434.320	1.218	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cscn3)C2)C1	1839963483	LRJHINQNYGXXOH-BLLLJJGKSA-N	432.340	1.387	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(C4CC4)cc3)C2)C1	1840155103	PXBVIWHHFMGSDO-DENIHFKCSA-N	436.936	1.888	50	20	IDGD	
COC1(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](C)CBr)C3)C2)CCC1	1840615182	ALCCWYUDYDEMEB-HNAYVOBHSA-N	447.370	1.433	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3c[nH]c4ncccc34)CCO2)C1	1840870521	NHFAILKWAWQNHX-PGRDOPGGSA-N	448.951	1.969	50	20	IDGD	
CN(CC(=O)N1CC2(CCCN2C(=O)COC(C)(C)C)C1)NC(=O)NCc1ccccc1	1841845126	UBHZIACOPPDSDI-UHFFFAOYSA-N	445.564	1.351	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)Cc2ccccc2C(F)(F)F)C1	1842704187	XZIMCANAGPYMPZ-UHFFFAOYSA-N	446.234	1.445	50	20	IDGD	
CS(=O)(=O)CC(=O)N1CCCC12CN(C(=O)[C@@H](Br)Cc1ccccc1)C2	1842780118	BLBJOQFBQWKLPD-HNNXBMFYSA-N	443.363	1.241	50	20	IDGD	
O=C(CCc1c[nH]c2ccccc12)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843011118	SNTXNHALFOPAMB-UHFFFAOYSA-N	431.301	1.298	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1ccncc1Cl)C2	1843416242	NXHWLBKDUHZFBP-ZMOGYAJESA-N	428.880	1.686	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)[C@H]1C[C@H]1c1ccc(F)c(F)c1)C2	1846383964	NEORUHGKIGIHAG-HOTGVXAUSA-N	434.487	1.645	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)[C@H](C)Oc2ccccn2)C1	1846604560	GTIDLPXISVSKLC-JZCUADNKSA-N	438.488	1.186	50	20	IDGD	
CC[C@@H](C)[C@H](O)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1847838654	WUWSBNHOGDFCFB-YXMSTPNBSA-N	431.961	1.727	50	20	IDGD	
CCC1CCC2(CC1)NC(=O)N(CC(=O)NNc1nc3ccccc3c(=O)n1CC)C2=O	10681816	MNVCHMAXIDBHKE-UHFFFAOYSA-N	440.504	1.750	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)c3ccccn3)c2)cc1	17329223	CIHUFDJHBGTJMW-UHFFFAOYSA-N	426.454	1.966	50	20	IDGD	
C[C@H](c1ccc(-n2cncn2)cc1)N(C)C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	22878059	ONAXZKWWVFQAGN-CQSZACIVSA-N	432.448	1.290	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1OCC	26319091	IJWNNDMPIDBZKX-UHFFFAOYSA-N	432.462	1.083	50	20	IDGD	
O=C(CN1C(=O)N[C@@]2(CCc3ccccc32)C1=O)NNC(=O)C12CC3CC(CC(C3)C1)C2	196398666	WGYZZRTZFJXEHW-HITZELJQSA-N	436.512	1.744	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NC[C@H]1CCCN(Cc2cccs2)C1	726250060	QVRWLRHXZWMYTI-CQSZACIVSA-N	435.575	1.782	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1ccc2c(c1)NC(=O)CN2	727525361	WWCVZHSMOSBDQQ-UHFFFAOYSA-N	432.820	1.331	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1)N1C(=O)CCC1=O	727723492	PSTYTGAMYNWVDB-AWEZNQCLSA-N	432.440	1.233	50	20	IDGD	
CC(C)(C)CC(=O)N1CSC[C@H]1C(=O)NNC(=O)c1csc(N2CCOCC2)n1	728151533	JZQHBZRCBUFRRM-ZDUSSCGKSA-N	441.579	1.078	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)NCc2cccc(S(=O)(=O)N3CCCCC3)c2)c1	728951352	HGAKOTWVEUTGCL-UHFFFAOYSA-N	441.513	1.877	50	20	IDGD	
CCC[C@H](C)NC(=O)[C@H]1CCCN(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)C1	728961325	GGYGHLFWUCMBJJ-WMZOPIPTSA-N	445.568	1.451	50	20	IDGD	
C[C@H]1Oc2ccccc2N(CC(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)C1=O	728974396	MYQPEFQGHUMRIO-LLVKDONJSA-N	425.413	1.940	50	20	IDGD	
O=C(NNC(=O)[C@@H]1C[C@@H](O)CN1C(=O)OCc1ccccc1)c1ccc([N+](=O)[O-])cc1	729512224	FLUZEDYWWXTFDP-SJORKVTESA-N	428.401	1.128	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)N[C@H]1CCN(c2ccc(F)cc2F)C1	730140044	NQSCYOPHSSXNGW-ZDUSSCGKSA-N	435.387	1.861	50	20	IDGD	
Cc1cccc(N2C(=O)N[C@@H](CCC(=O)NNC(=O)[C@@H](C)Oc3ccc(F)cc3)C2=O)c1	730769357	SVFIRIGRZDVRFE-KDOFPFPSSA-N	442.447	1.954	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNS(=O)(=O)c2cccc(C(=O)OC)c2C)cc1	731181634	URTYNOGUZCINOT-AWEZNQCLSA-N	436.486	1.957	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)NNC(=O)COc1ccc(Br)cc1	731500786	NIEBXYNLXJZGQG-UHFFFAOYSA-N	437.250	1.512	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)NC3CCN(CCS(C)(=O)=O)CC3)cc2C1	731679819	XBPYZJRNPKIZNM-CYBMUJFWSA-N	442.607	1.326	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)c3cnc(C)[nH]3)c2)cc1	731865644	OPZHKUHLPZSGBI-UHFFFAOYSA-N	429.458	1.602	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)CCc1nc(-c2cc(Br)cs2)no1	732084438	HHKJCTQVKHBCSJ-UHFFFAOYSA-N	425.268	1.986	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)Cc2cn3cc(Cl)cc(Cl)c3n2)C[C@@H](C)O1	732259024	JXPKSUNNUKLBSX-TXEJJXNPSA-N	428.320	1.830	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)c2ccc(CNC(=O)C3CCCC3)cc2)C[C@@H](C)O1	732263036	YYRPQCADMIFJHV-IAGOWNOFSA-N	430.549	1.753	50	20	IDGD	
COC(=O)c1ccccc1-c1ccc(/C=C(/C#N)C(=O)c2c(N)n(C)c(=O)n(C)c2=O)o1	732578257	IHLUEIIPXRDBIA-BENRWUELSA-N	434.408	1.503	50	20	IDGD	
CCC[C@@H](NC(=O)Cc1ccccc1)C(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	732653604	CUYAMNZVRSZZND-GOSISDBHSA-N	435.484	1.222	50	20	IDGD	
N#CCCNS(=O)(=O)c1ccc(C(=O)NNC(=O)NCc2ccc(Cl)cc2)cc1	733003938	VGGFQMKXZAZSDF-UHFFFAOYSA-N	435.893	1.676	50	20	IDGD	
Cc1cccc(-n2c(NNC(=O)Cn3cnc([N+](=O)[O-])n3)nc3ccccc3c2=O)c1C	733264766	RJTONQJEPUZWHQ-UHFFFAOYSA-N	434.416	1.646	50	20	IDGD	
CN(CC(=O)NNC(=O)c1cccs1)C[C@@H](O)COc1ccc(C(F)(F)F)cc1	733997937	WVKTWDBXFQBJGG-CYBMUJFWSA-N	431.436	1.900	50	20	IDGD	
Cc1nc(-c2cnn(C)c2)sc1C(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	734607569	MLHDITJRHYYQGC-UHFFFAOYSA-N	444.429	1.378	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)c2ccc(N3CCOCC3)nc2)CC1	734825223	WDWLFTPTTUCQEN-UHFFFAOYSA-N	448.524	1.262	50	20	IDGD	
CCCCN1C(=O)CC[C@H](C(=O)NNC(=O)c2cnn(C)c2)[C@H]1c1ccccc1OC	735445951	KVIBKLDOSAGDIT-FXAWDEMLSA-N	427.505	1.970	50	20	IDGD	
O=C(CN[C@H](c1ccccc1)C(F)(F)F)NNC(=O)c1csc(N2CCOCC2)n1	740739740	HYQKIWAYBLXVII-OAHLLOKOSA-N	443.451	1.634	50	20	IDGD	
Cc1cccc(C)c1NCC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	742032196	AKWMDZSAZPFDFT-UHFFFAOYSA-N	430.530	1.961	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NN=Cc1ccc(C#N)o1)N(S(C)(=O)=O)CC2	743428779	LMJLESZWLACZPV-KRWDZBQOSA-N	446.485	1.568	50	20	IDGD	
Cn1cccc1C(=O)N1CCN(C(=O)NNC(=O)c2cccc(Br)c2)CC1	743685256	BHVDYBQELJWFKC-UHFFFAOYSA-N	434.294	1.600	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2ccc(N3C(=O)CCC3=O)cc2)cc1	743830449	FJYQIGGJGVWZLF-UHFFFAOYSA-N	430.442	1.210	50	20	IDGD	
COc1ccccc1NC(=O)C1CCN(CC(=O)NNC(=O)c2cccc(C#N)c2)CC1	744386965	JJMLSANFHBQHEF-UHFFFAOYSA-N	435.484	1.679	50	20	IDGD	
CC(C)CNC(=O)N1CCC[C@H](CC(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)C1	745112913	WGLMQOYWWSVXQW-QGZVFWFLSA-N	443.504	1.330	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCCN1C(=O)c1ccc(O)nn1)c1cccc(Br)c1	746316650	OHDMMCMJCGBVOM-AWEZNQCLSA-N	448.277	1.401	50	20	IDGD	
Cc1ccc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1Br	747048966	XXRZPWHDHIAJCT-MRXNPFEDSA-N	449.257	1.902	50	20	IDGD	
NC(=O)c1ccc(C(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)o1	747374307	XVJDEKZPHKMNSS-UHFFFAOYSA-N	431.408	1.212	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cccn2C)cc1S(=O)(=O)N1C[C@H](C)C[C@@H](C)C1	747599133	NSJZZCPPQRBOEZ-HUUCEWRRSA-N	448.545	1.775	50	20	IDGD	
Cc1cccc(NS(=O)(=O)c2ccc(C)c(C(=O)NNc3nccn(C)c3=O)c2)c1	747938379	UQAJFZAHZQSRNN-UHFFFAOYSA-N	427.486	1.955	50	20	IDGD	
O=C(CCN1C(=O)[C@@H]2CCCC[C@H]2C1=O)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1	748512677	SNOMOKHNXGGPFR-ZIAGYGMSSA-N	447.435	1.989	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2c(Cl)ccc(OC)c2N)cc1OC	750236949	RMVSXSNOPSHETJ-UHFFFAOYSA-N	437.836	1.566	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)N[C@H]2CC(=O)N(C(C)(C)C)C2)c2ccccc2c1=O	750659625	IVKCTOYUEARLAF-ZDUSSCGKSA-N	428.493	1.321	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)[C@@H]1CCCN(c2nc3ccccc3s2)C1	751201930	NGTPVPSYPUWJQY-CYBMUJFWSA-N	427.486	1.683	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)c1cc(Cn2cc(Br)cn2)on1	752035130	MEEDNKNOUFSWEP-UHFFFAOYSA-N	444.249	1.333	50	20	IDGD	
CCOc1ccc(NC(=S)NNC(=O)c2ccc(F)c(S(=O)(=O)NC)c2)cc1	752520038	LMJYDMGPJFHVEC-UHFFFAOYSA-N	426.495	1.764	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCc2ccnc(OC(C)C)c2)cc1	752697675	QYLBNOXZZYTVRM-UHFFFAOYSA-N	449.533	1.328	50	20	IDGD	
CC(C)CCn1ncc(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1C(C)C	753839522	LGUKSLXZRNKSLV-GOSISDBHSA-N	443.504	1.979	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)N3CCN([C@H](C)C(=O)N4CCCC4)CC3)cc2C1	755086055	JVTYTSUBKBNWAS-JKSUJKDBSA-N	447.605	1.856	50	20	IDGD	
CCN(c1ccccc1)S(=O)(=O)c1ccc(OC)c(NC(=O)NNC(=O)COC)c1	755409919	CFZMOFVGWPHVRN-UHFFFAOYSA-N	436.490	1.710	50	20	IDGD	
COc1cc(C=NNC(=O)c2c(C)nc3ccccn23)c([N+](=O)[O-])cc1OCC(=O)O	755507250	RLKFLPZRXGMVQQ-UHFFFAOYSA-N	427.373	1.787	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2cccc(OCCOC)c2)c2ccccc2c1=O	756010600	WQTLIPPSSZWIEX-UHFFFAOYSA-N	425.445	1.908	50	20	IDGD	
CN1CCC/C1=N/S(=O)(=O)c1cccc(NC(=O)NNC(=O)Cc2ccncc2)c1	756028239	CEBKAHNXHYOHIU-ULJHMMPZSA-N	430.490	1.290	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)Nc1ccc(C(=O)NCc2ccc(F)cc2)cc1	756061435	IDLTVSRYXHACCR-AWEZNQCLSA-N	432.452	1.960	50	20	IDGD	
NS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ncc(C(F)(F)F)cc2Cl)cc1	756175491	VOYNIUOORBQSIA-UHFFFAOYSA-N	437.787	1.483	50	20	IDGD	
O=C(CSc1ccc(Cl)cc1)NNC(=O)Nc1ccn(CCN2CCOCC2)n1	756646183	MAXFJJLJIZLNCR-UHFFFAOYSA-N	438.941	1.814	50	20	IDGD	
Cn1cccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)c1=O	756685970	PFYIDFLXWWGZHE-UHFFFAOYSA-N	433.490	1.026	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2ccc(Br)s2)cc1-n1cnnn1	756746949	KSWXMLKWTWFFCZ-UHFFFAOYSA-N	438.267	1.961	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)Nc3cnn(CC(=O)N4CCOCC4)c3)cc2C1	756833849	BIVSJQUJOMQXHK-CYBMUJFWSA-N	446.533	1.395	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)c1cncc(I)c1	757732095	GTKYOUCUGLVSJP-UHFFFAOYSA-N	426.214	1.568	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)nn1-c1ccc(Cl)cc1Cl	757930621	RCVWVKRCOUHHRW-SECBINFHSA-N	449.320	1.578	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)c1cccnc1Oc1ccc(Cl)cc1Cl	758048369	SHHKNZUFABRZPB-SECBINFHSA-N	447.300	1.879	50	20	IDGD	
COc1ccc(C[C@@H](C)C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1	758067161	HCPYTVBLEMEOOH-MRXNPFEDSA-N	433.530	1.650	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)NC[C@H]3CSCCN3Cc3ccccc3)nc21	759321597	MXYZLJPVWRCCAK-AWEZNQCLSA-N	428.522	1.313	50	20	IDGD	
C[C@@H]1Cc2cc(C(=O)NNC(=O)CCNC(=O)OC(C)(C)C)ccc2N1S(C)(=O)=O	760437615	IIBDYEGZEFCEDL-GFCCVEGCSA-N	440.522	1.073	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)CCNC(=O)C12CC3CC(CC(C3)C1)C2	760440091	WNWXTCVWXHLCMG-UHFFFAOYSA-N	436.553	1.771	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CCc2ncc(NC(=O)C(=O)NNC(=O)C(C)(C)C)cc2C1	761068853	BMRYNSOGTNKHIQ-CYBMUJFWSA-N	433.509	1.596	50	20	IDGD	
CCc1csc(-n2cc(C(=O)OCC(=O)NNC(=O)Cc3ccccc3C)cn2)n1	762882411	LFBORFQNQUPWKS-UHFFFAOYSA-N	427.486	1.747	50	20	IDGD	
O=C(NNS(=O)(=O)c1c(Br)cc2nc(O)oc2c1Cl)c1cnccn1	763416620	JVCNTRCTUHPMDL-UHFFFAOYSA-N	448.642	1.363	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)ccc1N1CCOCC1	763454946	KPIBOXIPLSBKNU-UHFFFAOYSA-N	427.417	1.140	50	20	IDGD	
O=C(NNC(=O)c1cccnc1)C(=O)Nc1ccc(C(=O)NCCc2ccccc2)cc1	763494783	JNYNFCMYBHGAHK-UHFFFAOYSA-N	431.452	1.454	50	20	IDGD	
C[S@](=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc3ccccc3cc2O)cc1F	763523557	UHZDOIQBSYLLCV-PMERELPUSA-N	429.429	1.822	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccccc2OC(C)C)cc(OC)c1OC	763539215	KEYFCCRHYDHBJL-UHFFFAOYSA-N	431.445	1.899	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)Nc1ccc(Br)c(F)c1	763573358	ZLRQXLKZKVMQJF-CQSZACIVSA-N	438.209	1.514	50	20	IDGD	
COCCc1cc(NC(=O)C(=O)NNC(=O)COc2ccc(C(C)(C)C)cc2)n(C)n1	763599550	IZIXGOCTSFSHFN-UHFFFAOYSA-N	431.493	1.071	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2ccccc2N2CCOC2=O)c1	763645272	SUCZADXMDUEOIV-UHFFFAOYSA-N	426.429	1.425	50	20	IDGD	
CCCC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)COc2ccccc2OC)c1C	763646323	FRIULZZXRIRTOY-UHFFFAOYSA-N	442.472	1.907	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccccc2OCC(F)(F)F)cc1	763680813	GWQMNHOQKQZRDT-UHFFFAOYSA-N	436.346	1.664	50	20	IDGD	
CCS(=O)(=O)c1cccc(CC(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)c1	763764581	RFVKOJMKHRZDTG-UHFFFAOYSA-N	437.905	1.140	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2ccc(OC)c(OC(C)C)c2)c1	763773063	UEGVSCQAWWGGRI-UHFFFAOYSA-N	431.445	1.899	50	20	IDGD	
CCNC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)c1	763849763	MVFUSWGUEZQFTO-HNNXBMFYSA-N	441.488	1.998	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)C(=O)Nc1ccc(C(F)(F)F)cc1	763944705	OVHYADSQICVFQR-UHFFFAOYSA-N	433.346	1.996	50	20	IDGD	
Cc1nnc(-c2ccc(NC(=O)C(=O)NNC(=O)C3=S=C4CC[C@H](C)CC4=C3)cc2)o1	763947308	AYLQAJHQUZJVJP-NSHDSACASA-N	439.497	1.969	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)C(=O)Nc1cccc(NC(=O)CN2CCCCCC2)c1	763998451	IRKJSLBEBXQTLJ-UHFFFAOYSA-N	440.504	1.239	50	20	IDGD	
CC(C)Cn1ncc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)c1C(F)F	764004715	RZGOCOSCTKPDQS-UHFFFAOYSA-N	437.403	1.648	50	20	IDGD	
CO[C@H]1Cc2ccc(NC(=O)C(=O)NNC(=O)c3cccc(Br)c3)cc2C1	764058524	KAEAHPCPOUVOHD-INIZCTEOSA-N	432.274	1.962	50	20	IDGD	
CCNC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2cccc(Br)c2)c1	764062707	ATTRKRDMOHBBQI-UHFFFAOYSA-N	448.277	1.990	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(OC)c(NC(=O)C(=O)NNC(=O)C2CCCC2)c1	764069592	YKVZLPQDMRHLFV-UHFFFAOYSA-N	440.522	1.002	50	20	IDGD	
O=C(Cc1ccc2ccccc2c1)NNC(=O)C(=O)Nc1cccc(Cn2cncn2)c1	764092159	OGIFCEJYPVRLBW-UHFFFAOYSA-N	428.452	1.808	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cccc3c2CCN3C(=O)OC(C)(C)C)n[nH]1	764098058	JLQVJMCZAJGIFU-UHFFFAOYSA-N	428.449	1.415	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3cnn(CC)c3c2)o1	764138736	JAVDRRODIJEOSK-UHFFFAOYSA-N	426.477	1.891	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(N3CCOCC3)c3ccncc23)c1	764236057	AVZJDUHSXBCBRR-UHFFFAOYSA-N	444.451	1.343	50	20	IDGD	
COC(=O)[C@H](C)Cc1ccc(NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)cc1	764239758	SFWPHVUUTOYWBS-OAHLLOKOSA-N	436.468	1.779	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)C(=O)Nc1ccc(C(=O)N2CCCCC2)c(Cl)c1	764263335	CYAQAKSCWYUECH-UHFFFAOYSA-N	443.891	1.690	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)C(=O)Nc1ccc(N2CCc3sccc3C2)nc1	764268226	MNRFAIUOVCRESS-UHFFFAOYSA-N	436.497	1.429	50	20	IDGD	
O=C1CCCc2cc(NC(=O)C(=O)NNC(=O)c3cnn(-c4ccccc4)c3)ccc2N1	764351997	VVONTKGGSAFOHN-UHFFFAOYSA-N	432.440	1.547	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1ccc2c(c1)C(=O)N(C)CC2	764392355	DZCMFXYXDPQTKW-UHFFFAOYSA-N	442.497	1.202	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1ccccc1N(C)C(C)=O	764394047	VMQROUUSFPRXST-UHFFFAOYSA-N	430.486	1.556	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)Cn1nc(-c2ccccc2)ccc1=O	765313437	MOJRJUWQTIASMC-UHFFFAOYSA-N	429.477	1.363	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)c1ccc2c(c1)OCCO2	765757950	IHWYSICFNBZTJY-UHFFFAOYSA-N	444.919	1.690	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)[C@H]1SCCc2ccccc21	766642274	LIMVXXQQRSUIGZ-NRFANRHFSA-N	438.553	1.622	50	20	IDGD	
CC(=O)N[C@H](C(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1)C1CCCC1	766664845	WBLFUAZCTZMNBC-NRFANRHFSA-N	449.983	1.300	50	20	IDGD	
COc1ccc(NNC(=O)[C@H](CSC)N2C(=O)[C@H]3CCCC[C@H]3C2=O)c([N+](=O)[O-])c1	768332284	RXTDOZRDJLZZCE-ZENOOKHLSA-N	436.490	1.953	50	20	IDGD	
CSCCNC(=S)NNC(=O)c1cc(Br)cc(S(C)(=O)=O)c1F	770245416	CSJYTFSAHRBVCU-UHFFFAOYSA-N	444.373	1.464	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(C(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)cc1	770966272	PKTCTUWXFQJUHC-UHFFFAOYSA-N	447.521	1.731	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1nn(-c2ccccc2C(F)(F)F)c(C)cc1=O	771914718	GYSVALLBMADAMZ-NSHDSACASA-N	440.378	1.662	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1ccccc1-n1ncc(Cl)c(Cl)c1=O	771964917	ASGGKUMAVRRQGA-SECBINFHSA-N	427.244	1.642	50	20	IDGD	
Cc1c(C(=O)NNC(=O)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)cnn1-c1ccc(O)nn1	773413149	GTESRQSAPHNBIO-CYBMUJFWSA-N	445.480	1.084	50	20	IDGD	
COC(=O)c1c(F)cccc1NNC(=O)c1cc(Cl)c(OCC(N)=O)c(OC)c1	773639314	VUTUXIIIXFHVHJ-UHFFFAOYSA-N	425.800	1.895	50	20	IDGD	
CC[C@@H]1Oc2cc([C@@H](C)NCC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)ccc2NC1=O	775463338	KHRQQOFPLOKEBV-PXAZEXFGSA-N	441.444	1.816	50	20	IDGD	
CN(NC(=O)C[C@H]1Oc2ccccc2NC1=O)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776200754	AHUBPEWFKBYOTB-MRXNPFEDSA-N	447.492	1.412	50	20	IDGD	
Cc1cc(NC(=O)NNc2cccc(S(C)(=O)=O)c2)n([C@@H]2CCS(=O)(=O)C2)n1	776466369	QIXSKZCPRHMCNL-CYBMUJFWSA-N	427.508	1.103	50	20	IDGD	
C[C@H]1OC(C)(C)N(C(=O)OC(C)(C)C)[C@H]1C(=O)OCC(=O)NNC(=O)c1ccccc1	776477904	LGJGPUKWZDWZQM-CZUORRHYSA-N	435.477	1.751	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)NCc2cccnc2N2CCC(C(N)=O)CC2)c1	776619802	VBHBNPCHVQDOFH-UHFFFAOYSA-N	446.533	1.013	50	20	IDGD	
O=C(NC[C@H]1COC2(CCOCC2)O1)NNC(=O)c1cc(F)ccc1Br	777758850	OXHPZCXCXSTTEK-NSHDSACASA-N	432.246	1.454	50	20	IDGD	
O=C(c1ccc(Br)s1)N1CCN(S(=O)(=O)CBr)CC1	777833659	YJJNEVXTQBSHAB-UHFFFAOYSA-N	432.159	1.951	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)[C@H]2CCCCN2S(=O)(=O)c2ccccc2)nc1C	778421616	OMXFLOHLNHZJMD-QGZVFWFLSA-N	447.517	1.648	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc2c(c1)OCCCO2)NNc1cc(Cl)ccn1	778449772	DFXOLRGCKFOBOO-UHFFFAOYSA-N	426.882	1.708	50	20	IDGD	
CCn1cc(-c2n[nH]cc2C(=O)OCC(=O)NNC(=O)c2cc(Cl)ccc2OC)cn1	778504515	ZUCFSHFZZXFXHI-UHFFFAOYSA-N	446.851	1.573	50	20	IDGD	
COc1ccc(Cn2ccc(NC(=O)C(=O)NNC(=O)Cc3ccccc3F)n2)cc1	778714518	RFMWNXAOQKOPND-UHFFFAOYSA-N	425.420	1.408	50	20	IDGD	
COC(=O)c1cnc(C(=O)NNC(=O)[C@@H]2Cc3ccccc3CN2Cc2ccccc2)cn1	779661634	WEYIIOLQXXSCBC-NRFANRHFSA-N	445.479	1.651	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)c1cnc2ncc(Br)cc2c1	780159195	NCPSJIFLPDFSNV-OAHLLOKOSA-N	429.230	1.993	50	20	IDGD	
C[C@]1(c2ccc(F)c(Cl)c2)NC(=O)N(CC(=O)NNc2ncncc2Cl)C1=O	781834434	ZGVXGVSHKBZAKP-MRXNPFEDSA-N	427.223	1.833	50	20	IDGD	
C[C@@H]1CN(C)C(=O)CN1C(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1	782564226	YEPBTAJKXFXOKO-DYESRHJHSA-N	435.528	1.517	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2Cl)cc1	782926373	SIZKXRLKHLXEOV-UHFFFAOYSA-N	440.239	1.945	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)c(Cl)c1	783262320	CKQBWYZKCHBRGP-UHFFFAOYSA-N	425.898	1.812	50	20	IDGD	
CCC(CC)NC(=O)[C@@H]1CN(C(=O)C(=O)NNc2cc(C)ccn2)c2ccccc2O1	783928964	IGTUBTTVVCSWPQ-SFHVURJKSA-N	425.489	1.932	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)CNC(=O)c2cccs2)cc1OC(C)C	784004891	LQVFUJIMESABJW-UHFFFAOYSA-N	434.474	1.060	50	20	IDGD	
CCOc1cc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)ccc1OC	784215210	GDWXQYOGFURUTP-UHFFFAOYSA-N	448.501	1.616	50	20	IDGD	
CN(C)CCC(=O)Nc1ccc(NC(=O)C(=O)NNc2ccc(Br)cn2)cc1	784341048	VHAQMAJEDCLYOS-UHFFFAOYSA-N	449.309	1.816	50	20	IDGD	
CC(C)C[C@@H](C(=O)OCC(=O)NNC(=O)c1cccs1)N1C(=O)[C@H]2CC=CC[C@H]2C1=O	784474087	FGCJYQTZHKVNLK-ZNMIVQPWSA-N	447.513	1.418	50	20	IDGD	
COc1ccc(S(=O)(=O)NC2CC2)cc1NC(=O)C(=O)NNc1cccnc1Cl	784841932	BHWZEWZZLLDIRR-UHFFFAOYSA-N	439.881	1.266	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)Nc1ccc(OC(F)F)c(Cl)c1	785023614	MBSVURUZEQMAOK-UHFFFAOYSA-N	444.734	1.955	50	20	IDGD	
COCCOc1ccc(F)cc1S(=O)(=O)NNC(=O)CSc1ccccc1O	786856391	HULFFOHTTVMOTK-UHFFFAOYSA-N	430.479	1.658	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N2CCc3nn[nH]c3C2)cc1	787077103	GQGFSIDCRPUTHE-XNTDXEJSSA-N	446.471	1.044	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)C(=O)Nc2ccc(Oc3ccncc3)c(C)c2)c1	787549608	OCKOGVAOULSGFV-UHFFFAOYSA-N	448.439	1.935	50	20	IDGD	
COC[C@H](c1ccc(Cl)cc1)N(C)C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	787737168	GIXKKZXLOWZFOA-QGZVFWFLSA-N	429.868	1.990	50	20	IDGD	
CCCCN1C(=O)CC[C@H](C(=O)NNC(=O)N2CCN(C)CC2)[C@@H]1c1ccccc1OC	788169521	QQPCZXJMOYYQPI-RXVVDRJESA-N	445.564	1.763	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)cnc1Br	788526727	YLXWAGBZBSEJDB-UHFFFAOYSA-N	441.669	1.584	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)C(=O)Nc1nc(C2CCC2)cs1	789734884	IKCKNRSPYRASKP-UHFFFAOYSA-N	425.511	1.801	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)Cn2c(CS(C)(=O)=O)nc3ccccc32)cc1	789750184	WNUKKYUFAGAJIR-UHFFFAOYSA-N	430.486	1.116	50	20	IDGD	
Cc1ccn(C[C@@](C)(O)C(=O)NNC(=O)c2cc(F)ccc2Br)c(=O)c1	790643698	OSKLJWZLHSEYIX-QGZVFWFLSA-N	426.242	1.271	50	20	IDGD	
CC(=O)N1CCN(c2cccc(NC(=O)C(=O)NNc3cccc(F)c3[N+](=O)[O-])c2)CC1	790994106	PKRWNLZOADLIFL-UHFFFAOYSA-N	444.423	1.484	50	20	IDGD	
CN(C)c1cccc(CCC(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)c1	792209187	KZJUZQKKAYDHKX-UHFFFAOYSA-N	432.546	1.849	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NC[C@H]2CCN(Cc3ccccc3)C2)c2ccccc2c1=O	792227488	MTXKEJRXXKJXQA-QGZVFWFLSA-N	434.500	1.400	50	20	IDGD	
COc1ccccc1NC(=S)NNC(=O)CN1C(=O)N[C@](C)(c2ccccc2)C1=O	792951478	AVTNMMAHZWVLAH-HXUWFJFHSA-N	427.486	1.480	50	20	IDGD	
CN1CCN(Cc2cccc(NC(=O)C(=O)NNc3ccc4c(=O)[nH]ccc4c3)c2)CC1	793069314	ALBXUBCVFJVAAO-UHFFFAOYSA-N	434.500	1.357	50	20	IDGD	
CSSCCNC(=O)C(=O)Nc1cc(F)ccc1N1CCCN(C(C)=O)CC1	793078016	AIOWVSBNSADOCD-UHFFFAOYSA-N	428.555	1.950	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(CC(=O)NNC(=O)c2cccc(OC(F)F)c2)cc1	793416502	MXOPGCKLGVCEGW-UHFFFAOYSA-N	427.429	1.542	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)c2cn(CCOc3ccc(C=O)cc3Cl)nn2)n1	794084291	QRBZCWKQRBOXSS-UHFFFAOYSA-N	428.836	1.601	50	20	IDGD	
Cc1ccc(-c2ccc(C)c(NC(=O)C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)c2)o1	797000125	RETVCRUXDBOTHD-UHFFFAOYSA-N	445.439	1.939	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(I)cc2C)n1	797370057	FSDVUNGDNRJZHK-UHFFFAOYSA-N	438.225	1.703	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NC[C@@H]2CCCN2C2CCCCC2)c2ccccc2c1=O	798118708	BYPWZAVUNJRKNK-INIZCTEOSA-N	426.521	1.675	50	20	IDGD	
Cc1cc(F)ccc1-n1cc(O)c(C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)n1	801427292	NHVLUXPOJZMNLO-UHFFFAOYSA-N	437.387	1.515	50	20	IDGD	
COC(=O)c1c(F)cc(NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1F	801836410	ZLZKSKZYPYWLLP-UHFFFAOYSA-N	427.385	1.621	50	20	IDGD	
O=C(CCC(=O)N1CCN(c2ccccc2)CC1)NNC(=O)Nc1ccc2c(c1)OCO2	802095037	NMBVUFYLANGXBH-UHFFFAOYSA-N	439.472	1.697	50	20	IDGD	
CCOC(=O)C1=NN(c2ccccc2)[C@@H](C(=O)NNC(=O)Nc2ccc3c(c2)OCO3)C1	802105846	IPIKAIBBKCNMOY-MRXNPFEDSA-N	439.428	1.766	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)NC[C@@H]2CC(c3ccc4c(c3)CCO4)=NO2)c1	802337274	HVXDPFRXJKSFRL-SFHVURJKSA-N	440.456	1.776	50	20	IDGD	
O=C(NNc1nccnc1C1CCC1)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(F)cc1	805463198	NHLXWKPKJMRLRV-ZBFHGGJFSA-N	435.481	1.150	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)Nc1cc(F)c(F)cc1N1CCOCC1	806714720	HHVKWNRFNOPIRW-UHFFFAOYSA-N	444.402	1.244	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc2nccnc2c1Br	806976353	BCOYOJDKHWCAAK-UHFFFAOYSA-N	444.245	1.801	50	20	IDGD	
COC(=O)Cc1cc(Br)ccc1S(=O)(=O)NNC(=O)NC1CCCC1	811684279	YLGPIYFECQIMAH-UHFFFAOYSA-N	434.312	1.600	50	20	IDGD	
CC(C)(C)OC(=O)NCCC[C@@H](NC(=O)NNC(=O)C(=O)N1CCCC1)c1ccccc1	812702693	JJVTUHSOCFDEBT-QGZVFWFLSA-N	447.536	1.985	50	20	IDGD	
Cc1ccc(N2CCNC2=O)cc1NC(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	812971992	ZIUVCTVRGSDYQM-UHFFFAOYSA-N	432.506	1.924	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)C(=O)Nc1ncc(C(F)(F)F)s1	812980308	OXNWYRBZUDXQNR-UHFFFAOYSA-N	439.416	1.553	50	20	IDGD	
CC(C)(C(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1)c1csc(-c2ccccc2F)n1	814380912	VUJMIKDUZZVBFQ-NSHDSACASA-N	425.507	1.809	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)Nc1ccccc1CN1C(=O)CCC1=O	814621998	FZYGZGUNLZRFNC-UHFFFAOYSA-N	445.501	1.735	50	20	IDGD	
COC(=O)c1cnn(C)c1NC(=O)C(=O)NNC(=O)c1cc(C)n(-c2ccccc2)c1C	815564429	IQBKJIDQFUSKIQ-UHFFFAOYSA-N	438.444	1.014	50	20	IDGD	
COC(=O)N1CCN(c2ccc(NC(=O)C(=O)NNc3ccc(Cl)cc3)cn2)CC1	815588452	OXGGWAXGUKCJIZ-UHFFFAOYSA-N	432.868	1.705	50	20	IDGD	
O=C(CC1CC1)NNC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(Br)cc2)C1	819123111	PULMECKCHUKDIK-ZDUSSCGKSA-N	444.351	1.797	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)CSc2nnnn2C2CCCC2)cc1	906487188	WCNAHTVHRQUMAF-ZDUSSCGKSA-N	434.522	1.894	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)/C=C\c1ccccc1)C(=O)NNC(=O)c1cccnc1	912628605	PBJNEGWDFPMXST-QFSNBGPKSA-N	434.543	1.555	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)CNS(=O)(=O)c2c(F)cccc2F)cc1C	913450239	HWTDWVYFKPHLHH-UHFFFAOYSA-N	427.429	1.086	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc2nc(O)cc(C(=O)NNc3nccc(OC)n3)c2c1	914762543	NHCFEOHGCHYYJL-UHFFFAOYSA-N	446.489	1.526	50	20	IDGD	
Cc1ccc(C)c(NC(=S)NNC(=O)c2ccc(S(=O)(=O)N3CCOCC3)o2)c1	914881813	NCABCXGCDPRVNY-UHFFFAOYSA-N	438.531	1.549	50	20	IDGD	
O=C(COC(=O)c1cn(-c2ccc(Cl)cc2)nn1)NNC(=O)c1ccc([N+](=O)[O-])cc1	914990739	CFVBEOKHHHZZOX-UHFFFAOYSA-N	444.791	1.447	50	20	IDGD	
C[C@H]1C[C@@H](C)CN(CCCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)C1	916460309	HIJGUXKOXMWIGK-IYBDPMFKSA-N	439.582	1.249	50	20	IDGD	
Cc1ccc(CNC(=O)C2CCN(CC(=O)NNC(=O)c3ccccc3)CC2)cc1F	917116554	SYUMNSDFOUXBTR-UHFFFAOYSA-N	426.492	1.924	50	20	IDGD	
O=C(CN1CCN(C(=O)c2cccc(C(F)(F)F)c2)CC1)NNC(=O)c1cccs1	917124009	AXFFJWAEKNWQMI-UHFFFAOYSA-N	440.447	1.986	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@H](C(=O)NNC(=O)c3ccc(Cl)nc3)C2)s1	917253334	DQWKMHGXUCNZCT-ZDUSSCGKSA-N	442.950	1.967	50	20	IDGD	
O=C(NN=C1CCN(C2CCCC2)CC1)c1cccc(S(=O)(=O)N2CCOCC2)c1	917532891	VMMDKYUORYVQBH-UHFFFAOYSA-N	434.562	1.832	50	20	IDGD	
Cc1ccc2nc(CNC(=O)NNC(=O)CCN3CCN(c4ccccc4)CC3)cn2c1	918129708	RRFYVQYCWCIAQN-UHFFFAOYSA-N	435.532	1.685	50	20	IDGD	
O=C(NNC(=O)c1cc(S(=O)(=O)N2CCSCC2)c[nH]1)c1ccc2ccccc2c1	921032209	XGCVPQKIOMRKBB-UHFFFAOYSA-N	444.538	1.980	50	20	IDGD	
Cc1nc([N+](=O)[O-])cn1CCC(=O)NNC(=O)[C@H](C)Oc1cccc(Br)c1	921059379	VHVCOJUOAKFVKK-JTQLQIEISA-N	440.254	1.867	50	20	IDGD	
CC(C)(C)OC(=O)N1CCCC[C@H]1CNC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	921070704	BEMCXZGJENOHNF-INIZCTEOSA-N	444.496	1.396	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2ccccc2Cl)cc1	1320129284	BXKNZJHSCYQEHZ-UHFFFAOYSA-N	426.882	1.731	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(O)nc(O)c2)C1	1777851374	YUFKZQXBQFIASW-WHWRDJHUSA-N	442.310	1.404	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C#CC1CC1)C2	1778091915	ZCBRDQDLBBBDQY-LVGVVDSRSA-N	439.516	1.048	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccn4ccnc4c3)C2)C1	1778570004	JKNNGBGQAXJCEN-KXBFYZLASA-N	435.322	1.951	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cn(C(C)(C)C)nn3)C2)C1	1780355930	CJNOUQGXUYPWDQ-PXAZEXFGSA-N	428.331	1.260	50	20	IDGD	
CN(C)C(=O)NCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@](C)(Cl)CCl)C1	1780706572	LDFRBHYZVAPMQF-JEBQAFNWSA-N	437.368	1.008	50	20	IDGD	
O=C(c1cnc2ccccc2n1)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781329962	OSWWUDLEQNFCCQ-CRAIPNDOSA-N	437.269	1.764	50	20	IDGD	
O=C(c1cn2ccsc2n1)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781331713	PZHJIWMWGLGYBE-IAQYHMDHSA-N	431.287	1.530	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C=C/c1ccsc1)C2	1782209052	IMDSVZDQZRCNMZ-ZJHAOYMUSA-N	448.589	1.648	50	20	IDGD	
CN(C)[C@H](C(=O)N1CC[C@@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1)c1ccccc1Cl	1782829401	IGFQYARQPUUBBA-UWVAXJGDSA-N	444.359	1.372	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cc4n(n3)CCC4)CCO2)C1	1783349347	KSBGJJRWFUYEOF-RDTXWAMCSA-N	425.327	1.446	50	20	IDGD	
C=C(Oc1ccccc1O)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](C)Br)C2)C1	1783533899	BBGJOKXIGYSGSY-DJJJIMSYSA-N	439.306	1.898	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](CC)NC(C)=O)[C@H]2C1	1783582761	XZHPZSPLFJNTMN-GVRJEKJASA-N	432.359	1.054	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccn4c(C)cc(C)nc34)CCO2)C1	1783880861	HWNCBYZUYKZZQD-DYESRHJHSA-N	434.924	1.648	50	20	IDGD	
CC[S@](=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]2C1	1783966296	DMAVUYXXCGIYKM-SHNGGNKPSA-N	437.400	1.156	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4ccnn4c3)C[C@@H]21	1783973299	XXDQTJATIPMYTG-IKICRFKJSA-N	449.349	1.959	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)CCCn3ccnc3)C2)C1	1784397672	VLNNNKSXBBFPIS-CRAIPNDOSA-N	427.343	1.524	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](O)C(=O)NC1(c2ccc(NC(=O)[C@H](O)CCl)cc2)CCC1	1786135582	KDZFUNCXWPGNQW-GDBMZVCRSA-N	441.912	1.563	50	20	IDGD	
COC(=O)[C@H]1CC[C@H](C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCBr)[C@H]3C2)C1	1786404445	IVNAJCKKPYEKNM-QXKUPLGCSA-N	445.354	1.340	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)c1ccc2nonc2c1	1787882148	NXLJDVJDQXCPTQ-LWWSYDQCSA-N	441.257	1.507	50	20	IDGD	
CCCC(=O)N[C@@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21	1788738591	DEECFENACRJDSF-AJNGGQMLSA-N	432.359	1.056	50	20	IDGD	
CCn1nc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)CBr)C[C@@H]32)cc1C	1788998060	MMFHQZRWZCJMLG-DYWXZXKOSA-N	441.370	1.836	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc4cccnn4n3)[C@H]2C1	1789142604	WUOSZGWFJJVJNW-DUPGQFARSA-N	436.310	1.106	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4n(n3)CCCN(C)C4)C[C@@H]21	1789865304	QSJZVWOUTRVNLD-RMRDIRSESA-N	437.972	1.329	50	20	IDGD	
CC(C)c1nc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]3C2)no1	1789868681	IZPWYWXMRHRTNU-MNUAXYBXSA-N	447.363	1.952	50	20	IDGD	
C=C(CC(=O)OCC)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CO[Si](C)(C)C)C[C@@H]21	1789891093	AZQBUBDDELHVNY-ULQDDVLXSA-N	426.586	1.327	50	20	IDGD	
CC(C)=NO[C@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)CBr)C[C@@H]21	1789952755	RASZFFDTPVGXIH-OWYFMNJBSA-N	432.359	1.798	50	20	IDGD	
CCOC(=O)C1(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)Br)C[C@@H]32)CC1	1790720533	BCEVDOQAOWUUIF-XUXIUFHCSA-N	431.327	1.093	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccnc4c(O)cccc34)C[C@@H]21	1791256639	FQUGRHVTBKHOOH-UHEFJODHSA-N	447.919	1.788	50	20	IDGD	
O=C(/C=C/c1cnc[nH]1)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1	1791776066	SBIDTOKSDWJUFU-ZHACJKMWSA-N	430.273	1.551	50	20	IDGD	
COC(C)(C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2	1792573347	QUUGLGYJGZQASA-ZSBFGKGUSA-N	449.460	1.148	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)n1ccccc1=O)C2	1792870364	FPJJZIVCGUFKKW-SVZOTFJBSA-N	440.338	1.030	50	20	IDGD	
COc1ccc(Cl)c(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](O)CCl)c1F	1792982572	IXDXSSQTPQYPND-WZTYKQCMSA-N	449.306	1.220	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1(c3ccc(Cl)cc3)CC1)C2)[C@H](O)CCl	1792984347	YHNAYXBCRUIOQW-DLTLXFJOSA-N	427.328	1.561	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCC(=O)N1CCCC1	1793803723	VSXOTCGBOCEYJD-KRXQYRFLSA-N	444.370	1.152	50	20	IDGD	
COc1cc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)Br)C3)ccn1	1793903114	SSQYRRGUHGRTFB-LJGDNWOOSA-N	440.338	1.396	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](Br)Cc1ccccc1)C2)c1cnc[nH]1	1794716585	JQVUEVKCZSIHHS-DFGXFYAUSA-N	447.333	1.619	50	20	IDGD	
Cn1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCBr)C3)c(C(F)F)n1	1796700066	FNAPTRRVEKDTSQ-DDFAGTSDSA-N	435.269	1.346	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1nc2ccccc2[nH]1	1796823140	PHLWPTXFVGHPDG-ZWUHOBOKSA-N	435.322	1.940	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc2c(c1)CCCC2=O)c1ccc(B(O)O)cc1	1797548172	CYODEGWARQGVOI-WKCHPHFGSA-N	446.312	1.451	50	20	IDGD	
Cc1c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](F)Br)C3)cn2[nH]cnc(=O)c12	1799155096	ZZGGDBHGRKFRMY-MIJXAVMKSA-N	440.273	1.273	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COc1ccc(O)cc1)C2	1799273693	NAZHCRVAYYPCBD-OESLAJAZSA-N	431.316	1.597	50	20	IDGD	
C[C@@H](Nc1nccs1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Br	1799347574	QFSMBMAQIVJKLM-RMPHRYRLSA-N	435.319	1.224	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Oc1ccccc1)C2	1800759889	OHSONAPGPNFUBY-SVZOTFJBSA-N	425.323	1.827	50	20	IDGD	
CC1(C(=O)NC[C@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)CCC1	1802422910	MEVZKMPTJLXGIC-VQIMIIECSA-N	436.516	1.590	50	20	IDGD	
N#Cc1ccc(CC(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)cc1	1802573262	JYUJQEOZJJWGOG-QKNQBKEWSA-N	426.904	1.801	50	20	IDGD	
COC(=O)NCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1802697885	ZNFWEOOBXIYKQG-CRWXNKLISA-N	446.932	1.113	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cnc3ccccc3n2)[C@H]1c1cccnc1)[C@@H](O)CCl	1803139253	MYEBTVZQGJEKMN-YSSFQJQWSA-N	439.903	1.944	50	20	IDGD	
CN(C)c1ccc(C(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)cn1	1803139994	AVVZKAIHXQMYCP-SUMDDJOVSA-N	431.924	1.462	50	20	IDGD	
CN(C)c1ccncc1C(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]1c1cccnc1	1803140527	FDXAXAYRQYOHFS-ATZDWAIDSA-N	431.924	1.462	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cn3cc(F)ccc3n2)[C@H]1c1cccnc1)[C@H](O)CCl	1803143259	XXBCSTIQQOSUGS-YJLNNSPDSA-N	445.882	1.788	50	20	IDGD	
Cc1c(F)cccc1C(=O)N1CCCC2(CCN(C(=O)c3cccc(B(O)O)c3)CC2)C1	1805110002	MVWTXZAHNSNILD-UHFFFAOYSA-N	438.308	1.973	50	20	IDGD	
C[C@H](CC(N)=O)C(=O)N1CC[C@@H](CNC(=O)CCBr)[C@H]1c1cccnc1	1806341709	FKRLJPOEWLYBIH-HACGYAERSA-N	425.327	1.384	50	20	IDGD	
O=C(CCBr)NC[C@H]1CCN(C(=O)c2ccnnc2O)[C@H]1c1cccnc1	1806342532	KJBMNEYYXOUEFX-CJNGLKHVSA-N	434.294	1.682	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccccc2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807360203	IEEJNJYXIHGKNQ-RBBKRZOGSA-N	429.285	1.395	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)c2ccc(F)cc2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1	1807373431	BCDSSKIHGKTIST-DENIHFKCSA-N	447.275	1.534	50	20	IDGD	
COCCOCCOCCC(=O)N1CC[C@H](CNC(=O)[C@@H](F)Cl)[C@H]1c1cccnc1	1808320237	IHNZHHFLYQUZOS-BHIYHBOVSA-N	445.919	1.692	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)c1cnc2ccccc2n1	1808966097	YUANNMYVHXFZPN-CWFSZBLJSA-N	439.903	1.944	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)[C@@H](C)Cn2cncn2)[C@H]1c1cccnc1	1810479873	HQUZIUZCEHRENY-XOYOTBSWSA-N	434.928	1.269	50	20	IDGD	
CCC[C@H](NC(C)=O)C(=O)N1CC[C@H](CNC(=O)[C@@H](Cl)COC)[C@H]1c1cccnc1	1813037360	FSFLTTZXUFUNEI-YDZRNGNQSA-N	438.956	1.646	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)[C@@H]2C[C@H]2C2CC2)[C@@H]1c1cccnc1	1813067844	GGXMRZXCWZIMRH-PSHVLCQKSA-N	427.549	1.507	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)CNC(=O)OC)[C@@H]1c1cccnc1	1813270088	YYVIDIMPQUUIEQ-DZKIICNBSA-N	441.326	1.617	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](O)CCl)n[nH]1	1814875680	GPGSNCLAIHPIBR-UONOGXRCSA-N	443.932	1.916	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3cc(=O)n4[nH]cnc4n3)sc2C1	1815323162	AUGXMKQSJPDZLO-UWVGGRQHSA-N	449.924	1.507	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(O)n(C)n2)n[nH]1	1816125185	VPVIEXMXDRZDHS-CABZTGNLSA-N	425.287	1.938	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)C(C)(C)C#N)CC2	1817276484	TZHFFNODHSEIAE-ZVYABZQBSA-N	441.517	1.739	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc(F)cc2)[nH]n1)c1ccc(B(O)O)cc1	1817472287	DFZKHSFFTMCJCL-LJQANCHMSA-N	436.252	1.848	50	20	IDGD	
Cc1noc(C)c1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1	1817473225	MSCHLCALOWQZCU-KRWDZBQOSA-N	437.265	1.314	50	20	IDGD	
Cc1cc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cccc(B(O)O)c2)CC3)cn1C	1817695281	IUYBACDAQFZHTR-INIZCTEOSA-N	438.318	1.009	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2n[nH]c3c2CS(=O)(=O)C3)[nH]n1)[C@@H](F)Cl	1818037481	KCZPGUWLFURKTB-SMDDNHRTSA-N	444.876	1.402	50	20	IDGD	
CS(=O)(=O)N1CCC(C(=O)Nc2cc([C@H]3CCCCN3C(=O)[C@H](F)Cl)[nH]n2)CC1	1818815059	NZQOAMGHEQTMAU-HIFRSBDPSA-N	449.936	1.608	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3ccc4nncn4c3)sc2C1	1819180985	PQKQMWZFXAWUNB-RYUDHWBXSA-N	434.909	1.665	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](O)N2CCOCC2)n[nH]1	1819441866	OJJCZIGFOKSQLK-PBHICJAKSA-N	427.933	1.317	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)CCNC(=S)NC)sc2C1	1819802368	MMQOKPKBOCSPIN-MNOVXSKESA-N	432.015	1.947	50	20	IDGD	
Cc1ccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)c(O)n1	1820264756	XADKUCSPVREUTC-SFHVURJKSA-N	449.276	1.118	50	20	IDGD	
CN1C(=O)CC[C@H]1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](F)Br)[nH]n1	1820955331	LCBQONABUHXGTC-MJVIPROJSA-N	430.278	1.713	50	20	IDGD	
COc1cc(C(=O)N[C@@H]2CCc3nc(NC(=O)[C@H](F)Br)sc3C2)n(C)n1	1823001864	MBXHFTSCCDVJQV-KRTXAFLBSA-N	446.302	1.802	50	20	IDGD	
O=C(N[C@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1)c1cnc(O)nc1O	1823005419	ZWJOOWXHYMVTGX-CDUCUWFYSA-N	446.258	1.261	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H]2C[C@@H]2C2CC2)CC1	1824070640	RUSRWQMTSOMKHK-DYXWJJEUSA-N	439.560	1.965	50	20	IDGD	
O=C(CSc1ncccn1)N1CCC([C@@H]2CCCCN2C(=O)[C@H](O)CCl)CC1	1824182326	XXXYHYCVXXEGTH-JKSUJKDBSA-N	426.970	1.788	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)CCl)CC2)C1CCC2(CC1)OCCO2	1824896541	MHOVSDXVHWRRKD-OCCSQVGLSA-N	443.953	1.588	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccnc2C(N)=O)CC1	1825400757	DXUOOKBYLABEIK-SJORKVTESA-N	436.940	1.668	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnc3ncccn13)CC2	1826000192	OCFKFFZPPYHDRY-QWRGUYRKSA-N	434.909	1.665	50	20	IDGD	
COc1ccc(C(=O)N[C@@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)cn1	1826083903	VFIRIQMQTHVSBW-CYBMUJFWSA-N	446.533	1.146	50	20	IDGD	
C[C@@H](C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(B(O)O)cc1)CC2)n1cccc1	1826589044	SHPSUWGXNKDRBJ-BBRMVZONSA-N	438.318	1.111	50	20	IDGD	
CCOC(=O)N[C@@H](O)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CO[Si](C)(C)C)CC1	1829102896	QWGIXQCLMQNILN-WMZOPIPTSA-N	443.617	1.522	50	20	IDGD	
C[C@H](Nc1ccccn1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830364301	FIYFKOPPRSFSNR-KKSFZXQISA-N	438.956	1.603	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCCc3ccncc3)CCO2)C1	1833060107	UHAUVVIHFDAGDA-NQIIRXRSSA-N	439.940	1.115	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)N1CCC(N2CCC(NC(=O)C(C)(C)CCl)CC2)CC1	1833215150	BWIXHVFARTUNIS-OAHLLOKOSA-N	429.005	1.690	50	20	IDGD	
C[C@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1833264852	MLNAYERZVFLNOD-DOMZBBRYSA-N	438.794	1.189	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(C)on3)CCO2)C1	1834350485	AKXSBLLBNXIDPE-DYVFJYSZSA-N	430.299	1.227	50	20	IDGD	
Cc1ccc(CC(=O)N2CCOC[C@@]3(CN(C(=O)CCBr)CCO3)C2)o1	1834826211	GEFJMEUXABZEAK-GOSISDBHSA-N	429.311	1.372	50	20	IDGD	
C[C@@H](Oc1cccnc1)C(=O)N1CCC(N2CCC(NC(=O)[C@H](F)Cl)CC2)CC1	1835082722	DGIWOLZAQDJVDW-KDOFPFPSSA-N	426.920	1.955	50	20	IDGD	
COc1ccc(CCC(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)c(F)c1	1836692857	CGRMSWNAMAUUOU-AZUAARDMSA-N	446.878	1.758	50	20	IDGD	
O=C(c1cc2cccn2cn1)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836717172	LLQPZMWWTYMYAB-IBGZPJMESA-N	434.924	1.546	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cc(=O)cco3)CC2)CC1	1837592659	BDGUCKAKWYFVFN-KRWDZBQOSA-N	426.897	1.506	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3c(F)ccnc3Cl)C2)C1	1839142022	BTYNEDOBIJQLCS-SGTLLEGYSA-N	434.295	1.962	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)C(=O)c3ccco3)C2)C1	1839150780	XJXUSSUUHIPFRC-MSOLQXFVSA-N	433.288	1.155	50	20	IDGD	
Cc1ncccc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2	1839151559	WDPQEARAXAUBIY-RTBURBONSA-N	430.332	1.696	50	20	IDGD	
Cc1ccnc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)c1	1839152450	ZUGBMOMDCUMRRH-MOPGFXCFSA-N	430.332	1.696	50	20	IDGD	
Cc1cc(F)cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)c1	1839284660	FMAMCISKJMVCTJ-YJBOKZPZSA-N	447.276	1.895	50	20	IDGD	
O=C(c1nccc2occc12)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840188146	QIVKSCJHFGPPNC-SFHVURJKSA-N	428.272	1.702	50	20	IDGD	
C[C@H]1CCc2c(C(=O)N3CCOC[C@]4(C3)CN(C(=O)C(Cl)Cl)CCO4)n[nH]c21	1840188503	NGMYNXMMDHGBCT-VOJFVSQTSA-N	431.320	1.333	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)c2ccnn2C)C1	1842464247	BRFZTQQHIMXERC-UHFFFAOYSA-N	427.417	1.384	50	20	IDGD	
CC(C)(C)OC(=O)NCC[C@H](O)C(=O)N1CC2(CCCN2C(=O)CO[Si](C)(C)C)C1	1844378820	MJQDERXATBLNIV-HNNXBMFYSA-N	443.617	1.317	50	20	IDGD	
COC(=O)NCC(=O)N1CC2(CCCN2C(=O)[C@H](Br)Cc2ccccc2)C1	1845942379	CBXADKLILOLLCQ-OAHLLOKOSA-N	438.322	1.552	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)C(C)(C)CNC(=O)OC(C)(C)C)C2	1846365721	QVGBGNOXQJZQIH-CQSZACIVSA-N	431.961	1.995	50	20	IDGD	
O=C([C@H](F)Br)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1	1847038188	FMSUOHCLIGEMNW-UJAVWCLSSA-N	429.242	1.711	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](O)CCl)CC1	1847558306	BMALSZLYGZEOIL-QZWWFDLISA-N	443.972	1.825	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2c[nH]nc2-c2ccc(OC)cc2)c2ccccc2c1=O	11553284	MRWRNTJZWYPOHS-UHFFFAOYSA-N	432.440	1.890	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccccc1	105480117	TZZGSJLVHKFUQC-SFHVURJKSA-N	446.529	1.498	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)C2CCN(S(=O)(=O)c3cccnc3)CC2)cc1	110886741	AMVSBGYITXBCDI-UHFFFAOYSA-N	431.518	1.050	50	20	IDGD	
CC(C)[C@@H](NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)c1nc(C2CC2)no1	727943771	OOBOLYKFKZECLF-CQSZACIVSA-N	425.449	1.535	50	20	IDGD	
CSCC[C@H](C(=O)NNc1nc(-c2cccnc2)no1)N1C(=O)c2ccccc2C1=O	728078512	IKVJOTZICYCXLV-OAHLLOKOSA-N	438.469	1.993	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN1c1ncnc2sccc12)c1nnc(O)c2ccccc12	728511776	BITPNQYVGINTHK-CQSZACIVSA-N	435.469	1.770	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)[C@H]2CC(=O)N(Cc3ccccn3)C2)c1	728528036	ZBFJODJJNTUGNW-LBPRGKRZSA-N	447.289	1.662	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)[C@H]2CC(=O)N(C[C@H]3CCCN3CC)C2)cc1OC	729627778	UVQIBQNSGAGRFB-ZWKOTPCHSA-N	446.548	1.578	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)c2cccc3ncccc23)cc1	730203497	BEBUDALYTLNGBH-UHFFFAOYSA-N	434.499	1.108	50	20	IDGD	
CCCS(=O)(=O)c1ccccc1S[C@@H](C)C(=O)N([C@@H]1CCS(=O)(=O)C1)N(C)C	730452060	VNXBFBVMDPLBOP-LSDHHAIUSA-N	448.632	1.843	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)[C@@H]1CCN(c2ccc3c(c2)OCCO3)C1=O	730589639	LKTLOUBXWAIXLI-INIZCTEOSA-N	425.441	1.209	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H]1CNC(=O)NNC(=O)COc1ccccc1[N+](=O)[O-]	730908911	ISPWWAIVMIBLAJ-ZDUSSCGKSA-N	437.453	1.704	50	20	IDGD	
COc1ncnc(OC)c1C(=O)NNC(=O)COc1ccc(OCc2ccccc2)cc1	731956719	FWHIKXCRLKKXNJ-UHFFFAOYSA-N	438.440	1.913	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N2CCC[C@@H](N3CCCC3=O)C2)cc1Br	732256246	ZXNJQYWWEGOSFA-CYBMUJFWSA-N	439.310	1.899	50	20	IDGD	
COc1cccc(C[C@]2(C(=O)NNC(=O)N[C@H]3CCS(=O)(=O)C3)C[C@H]3CC[C@H]2C3)c1	735468084	CYVHZJXINIGKQY-IAGYGMIVSA-N	435.546	1.562	50	20	IDGD	
CCc1cc(NNC(=O)CCc2c(C)nc3nc(N)nn3c2C)nc(-c2ccccn2)n1	738538746	QVPUATFWISACAF-UHFFFAOYSA-N	432.492	1.814	50	20	IDGD	
O=C(NNc1ncccc1C(F)(F)F)c1cc(S(=O)(=O)N2CCSCC2)c[nH]1	740091562	NEPCUOGSWOMNNI-UHFFFAOYSA-N	435.453	1.923	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1	740851620	OJVBEAGDUFPDNR-LJQANCHMSA-N	428.455	1.893	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)CCN2CCN(c3ccccn3)CC2)c1C	741144150	GYIKMCOHMFKLQL-LJQANCHMSA-N	425.533	1.825	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NN=C2CCCC[C@H]2S(C)(=O)=O)c1	741451134	CKTNLPCPZKCWGP-QGZVFWFLSA-N	429.564	1.790	50	20	IDGD	
CCS(=O)(=O)NCc1ccc(C(=O)NNC(=O)c2ccc(Cl)cc2OC)cc1	741664032	BGSIRYGEPWFGHK-UHFFFAOYSA-N	425.894	1.863	50	20	IDGD	
O=C(CCN1C(=O)[C@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O)NNc1c(F)cc(F)cc1Br	742707664	CDFLUQBXIZIODO-RFHZTLPTSA-N	444.232	1.723	50	20	IDGD	
CC(C)C(=O)NNC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc(Br)s1	743737968	MTDJVECWYOPYGG-SNVBAGLBSA-N	438.369	1.857	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)NCC2(O)CCS(=O)(=O)CC2)c(C)n1C[C@H]1CCCO1	743756747	QTVHOWGJBALNDQ-WAGPWIPHSA-N	435.546	1.247	50	20	IDGD	
CC(=O)N[C@H](CC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)c1ccc(C)cc1	743831308	VGMQFWCKJWFLGV-GOSISDBHSA-N	432.502	1.819	50	20	IDGD	
COc1ccccc1[C@H](NC(=O)NNC(=O)c1cc([N+](=O)[O-])ccc1O)c1nccn1C	745400136	LMSXHLNBSUPBGT-KRWDZBQOSA-N	440.416	1.776	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2ccc(Br)c(C)c2N)n1	745453435	WJRQLBOFLPHMNM-UHFFFAOYSA-N	441.307	1.652	50	20	IDGD	
O=C(NCCS(=O)(=O)c1ccc(Cl)cc1)NNC(=O)c1cc([N+](=O)[O-])ccc1O	745738039	RXXDXVZMATVXBB-UHFFFAOYSA-N	442.837	1.372	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)NCc2nnnn2C2CC2)c2ccccc2c1=O	745909914	HCSNVVFZFFMLGK-UHFFFAOYSA-N	439.480	1.052	50	20	IDGD	
CO[C@]1(C)C[C@H](NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)C1(C)C	745930211	BMRLATROQSDYRZ-HNAYVOBHSA-N	426.539	1.150	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)N[C@@H]2CCN(c3sccc3C(=O)OC)C2=O)cc1	746781748	UQPVEFIXPMPPSD-OAHLLOKOSA-N	430.486	1.847	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)c2n[nH]c(C)c2[N+](=O)[O-])c2ccccc2c1=O	747337547	SWXMHXDNMZHQCD-UHFFFAOYSA-N	427.421	1.601	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2cccnc2)nc2c1cnn2Cc1cccnc1)c1cnn[nH]1	747381289	TUFHVCQHILTOFV-UHFFFAOYSA-N	440.427	1.130	50	20	IDGD	
O=C(CNC(=O)c1ccc(O)cc1)NNc1ccc(S(=O)(=O)Nc2nccs2)cc1	747943695	LRIWDKBTTIYVNS-UHFFFAOYSA-N	447.498	1.523	50	20	IDGD	
O=C(CCN1CCN(C(=O)[C@H]2CCCO2)CC1)NNc1ccc([N+](=O)[O-])cc1Cl	748726629	MHKUDAHBRKFMGN-MRXNPFEDSA-N	425.873	1.405	50	20	IDGD	
CNS(=O)(=O)c1csc(C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)c1	748849027	CVHORWPRVBHFNQ-UHFFFAOYSA-N	425.460	1.409	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2ccc(Br)c(O)c2)c2ccccc2c1=O	750815436	ZXIQSVAMRQWHPJ-UHFFFAOYSA-N	431.246	1.959	50	20	IDGD	
O=C(NN=Cc1cnn(-c2ccccc2)c1)C(=O)NN=Cc1cnn(-c2ccccc2)c1	751382484	RALJQRHCEFYJDT-UHFFFAOYSA-N	426.440	1.658	50	20	IDGD	
Cc1n[nH]c(C)c1[C@H](C)C(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	752576734	AOEJIXPHKQFWGJ-AWEZNQCLSA-N	432.956	1.749	50	20	IDGD	
CC[C@@H](CS(=O)(=O)c1ccccc1)NC(=O)NNC(=O)c1cc([N+](=O)[O-])ccc1O	752706202	SFXBGDSDAHDKHR-LBPRGKRZSA-N	436.446	1.497	50	20	IDGD	
N#Cc1ccc(CN2CC[C@H](NC(=O)NNC(=O)CSc3ccccc3O)C2=O)cc1	753288788	LPFXIIFADVXCFY-INIZCTEOSA-N	439.497	1.487	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)c2cccnc2I)c1	754940192	WZECPZNMGTXREM-UHFFFAOYSA-N	439.209	1.613	50	20	IDGD	
COc1ccc2c(c1)C=C(C(=O)NNC(=O)CCN1CCN(c3ccccc3)CC1)CO2	755059909	GKOOVJPACLPEAX-UHFFFAOYSA-N	436.512	1.831	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)NC1CCN(S(=O)(=O)C(F)(F)F)CC1	755153935	ROCVPIHQVLJNKP-UHFFFAOYSA-N	447.439	1.286	50	20	IDGD	
O=C(NNC(=O)c1cnccn1)Nc1ccc(S(=O)(=O)NC2=NCCCCC2)cc1	755498981	INVHQVVRGJKPKP-UHFFFAOYSA-N	431.478	1.194	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2nnc(-c3ccccc3)o2)ccc1Cl	757475510	YRWGUDYJHRWKTF-UHFFFAOYSA-N	436.833	1.800	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)Nc2ccc3c(c2)S(=O)(=O)CC3)cc1	757707924	CMMMPMYZPKRMCG-ZDUSSCGKSA-N	431.470	1.839	50	20	IDGD	
COc1ccc(C(=O)NNc2nc(O)c3ccccc3n2)cc1S(=O)(=O)N1CCCC1	758299448	KKAUGVOAEQSCQA-UHFFFAOYSA-N	443.485	1.885	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H](C)c2nnc(C)s2)c1	760142440	PRTHSAADEMKPOH-LLVKDONJSA-N	440.551	1.582	50	20	IDGD	
CCn1c(S)nc2cc(C(=O)NNC(=O)CCNC(=O)OC(C)(C)C)ccc2c1=O	760449352	CRSLKWXVXYACSP-UHFFFAOYSA-N	435.506	1.381	50	20	IDGD	
O=C(NNC(=O)c1ccccc1F)C(=O)Nc1cccc(OCC(=O)N2CCCC2)c1	763568943	QBSQDSJQMJRMBB-UHFFFAOYSA-N	428.420	1.227	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(C(=O)N3CCCC3)c2C)c1	763631589	ZPJYZFYPZWFGBW-UHFFFAOYSA-N	438.484	1.704	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccc(N2CCOC2=O)c1	763682219	POZJLDAKCOCXMG-UHFFFAOYSA-N	442.428	1.207	50	20	IDGD	
O=C(NNC(=O)C12CC3CC(CC(C3)C1)C2)C(=O)Nc1cccc(-c2nnnn2C2CC2)c1	763733939	INAODSMOFNIQIJ-UHFFFAOYSA-N	449.515	1.977	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2cccc(SC)c2)c2ccccc2c1=O	763786934	RJGYHZBDMDLUKD-UHFFFAOYSA-N	425.470	1.538	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)c1cnn(-c2ccc(Br)cc2)c1	763825609	SOOQBIPZTSMDFK-UHFFFAOYSA-N	443.261	1.221	50	20	IDGD	
COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1cccc(C)c1C	763852045	UJXVOHDFJZGHHU-CYBMUJFWSA-N	430.417	1.774	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)c(C)c1	763858707	WGVVHPVBVFWWOY-CYBMUJFWSA-N	447.419	1.239	50	20	IDGD	
O=C(CCSc1ccc(F)cc1)NNC(=O)C(=O)Nc1cnn(-c2ccccn2)c1	763895983	VTLIYDWLHLPXEA-UHFFFAOYSA-N	428.449	1.675	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)C(=O)Nc1ccn(-c2ccccc2)n1	763943318	FIWJRTHJEWTWFE-UHFFFAOYSA-N	431.412	1.163	50	20	IDGD	
CN1CCc2ccc(NC(=O)C(=O)NNC(=O)Cc3cccc4ccccc34)cc2C1=O	764035133	FLYMFEDEKYBRBM-UHFFFAOYSA-N	430.464	1.797	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cccc(N4CCOC4=O)c3)n[nH]2)cc1	764109930	DPMQVKBOCFDOEU-UHFFFAOYSA-N	448.439	1.741	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2cc(CC3CC3)nn2-c2ccccc2)c1O	764132455	XAGNMCIYGHQAHQ-UHFFFAOYSA-N	449.467	1.939	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccn(-c3ccc(C#N)cc3Cl)n2)cc1	764177551	QTSOFOKCMQUEMA-UHFFFAOYSA-N	433.815	1.669	50	20	IDGD	
CCOC(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)c2cccc(OC(F)F)c2)c1	764259437	HPBSRNYNZAIIBD-UHFFFAOYSA-N	435.383	1.793	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)c2cccc3ncccc23)c(C)c1	764259457	HYSZCTOMXPYMIV-UHFFFAOYSA-N	436.424	1.495	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)C(=O)Nc1ccc(C(=O)NCc2ccc(F)cc2)cc1	764296127	VCQUQXZCLLLNMW-UHFFFAOYSA-N	438.419	1.187	50	20	IDGD	
CC(C)(C(=O)NNC(=O)C(=O)Nc1ccc(C(=O)N2CCOCC2)cc1)c1ccccc1	764313585	MBMUYYLIJUSBCP-UHFFFAOYSA-N	438.484	1.223	50	20	IDGD	
O=C(CN1C(=O)[C@@H]2[C@@H](C1=O)[C@H]1C=C[C@H]2C1)NNc1c(F)cc(C(=O)NC2CC2)cc1F	764329221	FHXSYPAZZXXHAW-QEWLZKHVSA-N	430.411	1.107	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)C(=O)Nc1cccc(Oc2cnccn2)c1	764345155	BFWFKYSBSJGHQN-UHFFFAOYSA-N	443.423	1.854	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccncc2)cc1NC(=O)OC(C)(C)C	764352914	DZIAKOFIGVHGFV-UHFFFAOYSA-N	443.460	1.766	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNS(=O)(=O)c1ccc(F)cc1	765118954	JLJAUUUYDSQXIX-UHFFFAOYSA-N	440.928	1.606	50	20	IDGD	
COc1cccc([C@H](O)C(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)c1	765176802	OACKASLTCICYCZ-QFIPXVFZSA-N	426.517	1.002	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)C1(S(=O)(=O)c2ccccc2)CC1	765310196	CLXRRCXVDUXMCS-UHFFFAOYSA-N	425.507	1.445	50	20	IDGD	
Cc1ccc(-c2nnc(S)n2CC(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)cc1	765312870	FLJLOYKCPMPTQA-UHFFFAOYSA-N	448.549	1.995	50	20	IDGD	
CCOC(=O)NNC(=O)C(=O)Nc1cccc(S(=O)(=O)N(C)C2CCCCC2)c1	765414389	SJJHFJCZIWXRAP-UHFFFAOYSA-N	426.495	1.356	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NN=Cc1n[nH]c2cc(C(=O)O)ccc12	765583957	MNLKZFOXWYSCDK-UHFFFAOYSA-N	434.456	1.169	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)N[C@H](c1ccc(Cl)cc1)[C@@H]1CN(C)CCO1	766317850	GDRRGXQAEMVTRA-XOKHGSTOSA-N	428.917	1.094	50	20	IDGD	
CC(C)(Oc1ccc(C#N)cc1)C(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	767631985	FJBHNWLSYJBICI-UHFFFAOYSA-N	426.385	1.628	50	20	IDGD	
CCN1CCC[C@H]1CN1C[C@H](C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)CC1=O	768261849	XIHAGUQLKYWAOH-KGLIPLIRSA-N	430.534	1.232	50	20	IDGD	
CSCCNC(=S)NNC(=O)Cc1csc(NC(=O)Cc2cccs2)n1	769764418	BSAYVUNSUICNLX-UHFFFAOYSA-N	429.618	1.787	50	20	IDGD	
CCCOc1cccc(CC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)c1	770131569	PEJBUCXYQHCFOI-UHFFFAOYSA-N	433.530	1.794	50	20	IDGD	
C[C@H]1C[C@H](NC(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)CCO1	770354494	HJTSPDFFUTXIHP-DOTOQJQBSA-N	435.484	1.956	50	20	IDGD	
CC[C@@H](C)NC(=O)CN1CCN(C(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)CC1	770650436	VIWIYWONHZABBN-HUUCEWRRSA-N	439.944	1.380	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)[C@@]3(C(F)(F)F)CCN(Cc4ccccc4)C3)nc21	770992929	XVLTWLISRLUMPK-GOSISDBHSA-N	435.410	1.967	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)CSCC(=O)Nc1cccc(Br)c1	772041995	OJBQDFURBLWJIY-SNVBAGLBSA-N	446.323	1.610	50	20	IDGD	
CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O[C@@H](C)C(=O)NNC(=O)CC(C)C	772166853	HBGZOQJQTGXNTE-KPZWWZAWSA-N	434.468	1.479	50	20	IDGD	
O=C(NNC(=O)c1csc2ccccc12)c1cccc(S(=O)(=O)N2CCOCC2)c1	775198514	QDNRGUACEQTIJC-UHFFFAOYSA-N	445.522	1.997	50	20	IDGD	
CCc1ccc(C(=O)NNS(=O)(=O)c2ccccc2S(=O)(=O)N2CCCC2)cc1	775251922	FYNBOIWLCGQWMX-UHFFFAOYSA-N	437.543	1.657	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)Nc1ccnn1[C@H]1CCS(=O)(=O)C1	776054474	GLKJMSZQAOMCQF-LBPRGKRZSA-N	439.519	1.196	50	20	IDGD	
CC(C)c1cccc(CNC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)c1	776198964	ZSIFBCCYLCNMCK-UHFFFAOYSA-N	446.577	1.967	50	20	IDGD	
CCOC(=O)C1=NN(c2ccccc2)[C@@H](C(=O)NNc2cccc(S(C)(=O)=O)c2)C1	776534702	QDMWEFKNIXUNHD-GOSISDBHSA-N	430.486	1.731	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNS(=O)(=O)c1cc(C(=O)O)cc2c1CCCC2	777940063	VLQPKODXIWKHFW-UHFFFAOYSA-N	427.479	1.098	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)C1CCN(C(=O)c2ccc(F)cc2F)CC1	778432949	DQXMVVZTVPSDCU-UHFFFAOYSA-N	440.447	1.489	50	20	IDGD	
COCCN1C(=O)CCc2cc(NC(=O)C(=O)NNC(=O)Cc3ccsc3)ccc21	778710200	OSNDHXJLGUEJCK-UHFFFAOYSA-N	430.486	1.002	50	20	IDGD	
COc1ccc(CN2C[C@H](C(=O)NNC(=O)CCNC(=O)OC(C)(C)C)CC2=O)cc1	780973855	IBZNUVRZLUKXRK-OAHLLOKOSA-N	434.493	1.106	50	20	IDGD	
O=C(CSc1nnc(O)nc1O)NN=C1CCC[C@@H]2CN(Cc3ccccc3)C[C@H]12	781123787	JMZCQSRPRPLMQH-CABCVRRESA-N	428.518	1.779	50	20	IDGD	
COc1ccc(C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)nc1Br	781753897	JQLLGIWBDOQXMH-UHFFFAOYSA-N	433.218	1.342	50	20	IDGD	
CC(C)(C=NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1)N1C(=O)c2ccccc2C1=O	782159566	SENYDMRWBGTTGO-UHFFFAOYSA-N	448.888	1.778	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)cc1)C(=O)Nc1ccc(I)cc1	782832940	ANCMFFCBJBWRAQ-UHFFFAOYSA-N	425.182	1.397	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C(=O)Nc2cc(F)ccc2OC(F)F)nc2ccccc21	782886537	PLUODXBNOPDFLN-UHFFFAOYSA-N	435.362	1.642	50	20	IDGD	
COC(=O)CCNC(=O)c1ccc(NC(=O)C(=O)NNc2cccc([N+](=O)[O-])c2C)cc1	784353140	COPQIQLRVLBIOU-UHFFFAOYSA-N	443.416	1.278	50	20	IDGD	
O=C(NNc1cc(F)c(F)cc1F)C(=O)Nc1cccc(S(=O)(=O)N2CCCC2)c1	784891032	BABGWZDNSVYBTA-UHFFFAOYSA-N	442.419	1.970	50	20	IDGD	
NC(=O)C1CCN(c2ccc(NC(=O)C(=O)NNc3cc(F)c(F)cc3F)cc2)CC1	784893243	ORWGTOUNXDGEOT-UHFFFAOYSA-N	435.406	1.887	50	20	IDGD	
C[C@@H]1CN(Cc2ccccc2NC(=O)C(=O)NNc2ccnc(N(C)C)n2)C[C@@H](C)O1	784969878	RSGRSAKYQDAJMS-HUUCEWRRSA-N	427.509	1.234	50	20	IDGD	
Cc1cnn(-c2ccc(NC(=O)C(=O)NNC(=O)Cc3cn4ccccc4n3)cc2F)c1	785067875	QTTLZDVFGFMNBC-UHFFFAOYSA-N	435.419	1.296	50	20	IDGD	
Cc1cc2ccccc2nc1NNC(=O)C(=O)Nc1cnn(CC(=O)NC2CCCC2)c1	785154885	RVCWZZVLTBKCEO-UHFFFAOYSA-N	435.488	1.880	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2cccc(NC(=O)[C@@H](C)OC)c2)n1	785231901	HYJKWJIHNZXSJG-CYBMUJFWSA-N	429.481	1.378	50	20	IDGD	
Cc1ccc(-n2cccn2)cc1NC(=O)C(=O)NNC(=O)c1cc(Br)c[nH]1	789584574	OCPSNMMUDWXBME-UHFFFAOYSA-N	431.250	1.671	50	20	IDGD	
CN(NC(=O)CN1CCc2ccccc2C1=O)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	790019927	KYAKDLPPFGXHEE-UHFFFAOYSA-N	445.520	1.321	50	20	IDGD	
CC(C)N(C)c1ccc(C=NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cn1	790141912	XSKQUHKCCLWGLW-UHFFFAOYSA-N	445.545	1.711	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)c(O)c1	790772817	RQBITMMEMDNNBW-UHFFFAOYSA-N	433.486	1.650	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Cc2ccc3n[nH]cc3c2)c1	792772826	CAEZVVBXYQVIAY-UHFFFAOYSA-N	429.502	1.597	50	20	IDGD	
CN(C)N(C(=O)c1ccc(S(=O)(=O)Nc2nccs2)cc1)[C@H]1CCS(=O)(=O)C1	792851278	UYRBSDHQYKIFCL-ZDUSSCGKSA-N	444.560	1.050	50	20	IDGD	
COc1ccc2nc(NNC(=O)[C@](C)(O)CN3C(=O)NC4(CCCC4)C3=O)c(C)cc2c1	793780999	OHOBBGPTUIQCGE-OAQYLSRUSA-N	441.488	1.611	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)NCc3cccc(CS(N)(=O)=O)c3)cc2C1	799856811	FWVUBTSWBVIBFL-GFCCVEGCSA-N	436.559	1.806	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@H](C)C(=O)NNC(=O)c1sccc1S(N)(=O)=O	800577244	LSPQOWMTAVUSJR-SNVBAGLBSA-N	431.923	1.894	50	20	IDGD	
COc1ccc(-c2nn(CCC#N)cc2/C=C(\C#N)C(=O)NC[C@](C)(O)CO)cc1OC	801976150	PCDQTUSZWVPVIH-NAVGAYGYSA-N	439.472	1.247	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNc2cc(Cl)nc(N)n2)(n2cccn2)CC1	803097372	XZQCDGPESCUKIK-UHFFFAOYSA-N	436.904	1.778	50	20	IDGD	
Cc1nn(C)c2sc(C(=O)N[C@@H](C)C(=O)NNc3ccc(-n4ccnc4)nn3)cc12	804954653	MMBSTNJLAIKEGV-NSHDSACASA-N	425.478	1.181	50	20	IDGD	
CC[C@@H](NC(=O)NNc1ccc(-n2ccnc2)nn1)[C@H]1CN(Cc2ccccc2)CCO1	805203703	QOUBMNNYQZQZKC-RTBURBONSA-N	436.520	1.968	50	20	IDGD	
CCS(=O)(=O)c1ccc([C@@H](C)NC(=O)NNC(=O)COc2ccccc2C#N)cc1	807269097	AGLVXURVRLPVCT-CQSZACIVSA-N	430.486	1.822	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)OCc2cc(=O)n(C)c(=O)n2C)c(C)n1C[C@H]1CCCO1	808423544	QIRGRHULQKBVHR-IISPMBILSA-N	426.473	1.332	50	20	IDGD	
COC(=O)c1c(F)ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)c1F	810386056	KLJQQTZXBOORLQ-SECBINFHSA-N	439.346	1.444	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)NCC(=O)NNc2cnnc3ccccc23)cc1	810404758	XIWKLMUPNAWATI-UHFFFAOYSA-N	429.458	1.228	50	20	IDGD	
COC(C)(C)c1nc(C)c(C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)s1	811241659	PJCXPIVTXSDORK-UHFFFAOYSA-N	436.446	1.859	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(=NNC(=O)CNC(=O)c2ccco2)[C@@H]([C@H]2CCOC2)C1	812227253	WHQGXUPFEIOCKU-LSDHHAIUSA-N	434.493	1.775	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)Cn2c(S)nnc2-c2cccs2)cc1	812733414	QYQUXUUNNVPPAZ-UHFFFAOYSA-N	438.560	1.689	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)CNC(=O)c1ccco1)c1ccc(N2CCCNC2=O)cc1	812881935	HOKDUNBXHMNYCF-ZDUSSCGKSA-N	428.449	1.021	50	20	IDGD	
Cc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	813033611	BKMLJSFINQIQFV-UHFFFAOYSA-N	447.517	1.029	50	20	IDGD	
CN(C/C=C\C(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1)CC(F)(F)F	815634638	OHTFYBDQFJUXJZ-WAYWQWQTSA-N	437.463	1.767	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1NC(=O)C(=O)NNC(=O)[C@@H]1CCc2nncn2C1	815692080	IUSLLUXNZAPGBP-CYBMUJFWSA-N	425.474	1.059	50	20	IDGD	
CCOC(=O)c1cnc(C)c(C(=O)NNC(=O)[C@H]2CCCN(C(=O)OC(C)(C)C)C2)c1	816511040	NAIRNFCRJYKQNA-AWEZNQCLSA-N	434.493	1.975	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)CN2C(=O)[C@H]3CC=CC[C@H]3C2=O)cc1Cl	816596804	RHRJTJKBGISKCS-PHIMTYICSA-N	436.852	1.461	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CCn2cnc3sc(C)c(C)c3c2=O)cc1	818327203	CNGNAFXNZUHDSD-UHFFFAOYSA-N	427.486	1.559	50	20	IDGD	
Cn1c(CC(=O)NN=Cc2c(Cl)nc(N)nc2N2CCOCC2)nc2ccccc21	874068106	NOEHPAGSQRQOLB-UHFFFAOYSA-N	428.884	1.128	50	20	IDGD	
Cc1nc(C(C)C)nc(O)c1C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	885804257	IDHRGVZOIYWYPW-UHFFFAOYSA-N	426.521	1.587	50	20	IDGD	
CCCCn1c(=O)nc(O)c2c1nc(COC(=O)/C(C#N)=C\c1cc(C#N)n(C)c1C)n2C	913286878	MHHRFJPDZWNICW-NVNXTCNLSA-N	449.471	1.805	50	20	IDGD	
O=C(COC(=O)CCOc1ccccc1Cl)NNC(=O)[C@H]1COc2ccccc2O1	914812653	DVMFFOXRIXABMD-QGZVFWFLSA-N	434.832	1.640	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)CCc2c(C)nc3c(C#N)cnn3c2C)cc1	914993202	BVKBRHWVIXYIBV-UHFFFAOYSA-N	434.456	1.463	50	20	IDGD	
Cc1nn(-c2ccccc2)c2sc(C(=O)NNC(=O)NC[C@@H]3CCS(=O)(=O)C3)cc12	916375349	WLZGPRJNOKHEQD-ZDUSSCGKSA-N	447.542	1.774	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)NC[C@@H](c1cccc(C)c1)N1CCOCC1	916436192	XETKHNAABPOMCK-IBGZPJMESA-N	442.516	1.786	50	20	IDGD	
CC(=O)NCCc1ccc(S(=O)(=O)NNC(=O)c2cc(C)nc3ccccc23)cc1	917719865	CHVHPQGYVUHYHJ-UHFFFAOYSA-N	426.498	1.845	50	20	IDGD	
CCNC(=O)COc1cccc(CNC(=O)NNC(=O)COc2ccc(C)c(C)c2)c1	918091504	VSTSAGFODLJNOW-UHFFFAOYSA-N	428.489	1.728	50	20	IDGD	
C[C@]1(NNC(=O)NCc2cccc(NC(=O)c3cccc(F)c3)c2)CCS(=O)(=O)C1	918106250	SRYBRABYXRSDGC-FQEVSTJZSA-N	434.493	1.959	50	20	IDGD	
CCN(CCCNC(=O)NNC(=O)c1ccc(OC(C)C)c(OC)c1)S(C)(=O)=O	918118769	ANBQSGHSDAMVMA-UHFFFAOYSA-N	430.527	1.098	50	20	IDGD	
C[C@H]1CN(Cc2ccc(C(=O)OCC(=O)NNC(=O)c3ccccc3)cc2)C[C@@H](C)O1	919264185	IOXFYBWQMLPNDV-CALCHBBNSA-N	425.485	1.914	50	20	IDGD	
O=C(COC(=O)CCN1CCCS1(=O)=O)NN=C(c1ccccc1)c1ccccc1	919435974	KOKAEUUMPCWSJH-UHFFFAOYSA-N	429.498	1.524	50	20	IDGD	
O=C(Nc1ccccc1)Nc1ccc(C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)cc1	919883176	BKAGORIWFXJHDT-INIZCTEOSA-N	431.474	1.462	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)NC[C@H]2CCCOC2)cc1	920855278	ZWDTUAWRSFQARL-YCPFAOKUSA-N	437.500	1.884	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)Nc1ccccc1CN1C(=O)CNC1=O	920928623	WQJRLAKGBDTSSZ-UHFFFAOYSA-N	449.427	1.096	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)NCc2cccnc2N2CCN(C)CC2)cc1	921199725	OKYCEQPPZMZNJW-UHFFFAOYSA-N	426.521	1.305	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NC[C@@H](c2cccc(F)c2)N2CCOCC2)cc1	921247575	HRZSSELPXXXUHL-FQEVSTJZSA-N	430.480	1.917	50	20	IDGD	
O=C(CCCC[C@@H]1SC[C@H]2NC(=O)N[C@@H]21)NNC(=O)c1ccc(Br)s1	921303229	UOAWMUONAKTGFX-ZDMBXUJBSA-N	447.380	1.997	50	20	IDGD	
COc1cccc(N2CCC(NC(=O)NNC(=O)c3nnc(O)c4ccccc34)CC2)c1	1318032280	LRPMNBFSEUSBJS-UHFFFAOYSA-N	436.472	1.957	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)[C@@H]2CCCCCN2C(=O)OC(C)(C)C)c2ccccc2c1=O	1321484654	WJFUXQXCOCRRAO-INIZCTEOSA-N	443.504	1.874	50	20	IDGD	
CCS(=O)(=O)c1cccc(NC(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)c1	1324047186	JOMOOEQDSPKTOJ-UHFFFAOYSA-N	426.520	1.879	50	20	IDGD	
CN(C)N(C(=O)c1cc(=O)c2cc(Br)ccc2[nH]1)[C@@H]1CCS(=O)(=O)C1	1324348975	TYDLCNZCLDEECQ-LLVKDONJSA-N	428.308	1.397	50	20	IDGD	
Cc1nc2ncccn2c1C(=O)N1CC[C@@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1777900818	LWPPLHWHXAKYGJ-HXUWFJFHSA-N	431.569	1.333	50	20	IDGD	
O=C(C(Cl)Cl)N1CCO[C@@]2(CCN(C(=O)[C@H]3ON=C(c4ccccc4)O3)C2)C1	1778874396	JTCVQWQNBREASD-QZTJIDSGSA-N	428.272	1.355	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2)c1n[nH]c2ccc(F)cc12	1779085438	PWQVGPJYXHMECD-RZQQEMMASA-N	438.887	1.429	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@]2(C1)CN(C(=O)c1ccc(-n3cccn3)nc1)CCO2	1779297832	ATKDUWHKOKOCKV-NRFANRHFSA-N	443.580	1.562	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2)c1cc(-c2ccccn2)[nH]n1	1779766762	YNKAQRUIXIBRIV-DBXWQHBBSA-N	447.923	1.199	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cnc4c(c3)NC(=O)CS4)CCO2)C1	1781219991	UHCBXOAHMWQCBJ-ORAYPTAESA-N	438.937	1.587	50	20	IDGD	
O=C(c1cccc(F)c1[N+](=O)[O-])N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781334313	XTMISFGUMQOAMS-CZUORRHYSA-N	448.220	1.868	50	20	IDGD	
COC(=O)CCCCCC(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781335245	WQHNQINAHBGCMD-RDJZCZTQSA-N	437.306	1.630	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)C3(Br)CC3)C2)C1	1781347893	NLYFKZHSTWDMQJ-BXUZGUMPSA-N	438.160	1.917	50	20	IDGD	
CC(=O)N[C@@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)CBr)C2	1781781912	OOIJVLRXICUZNL-ZFHGCVPZSA-N	432.359	1.056	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc3[nH]ncc13)C2	1782173049	VDHOBSGVRMITKG-HGHGUNKESA-N	434.924	1.944	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCCn1cccc1)C2	1782214761	ZEBYHBFGJNGAAK-AUSIDOKSSA-N	447.580	1.155	50	20	IDGD	
O=C(C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](Br)Cc3ccccc3)C2)C1)C1CC1	1783017834	FXCGLNIIKPJCLG-UTKZUKDTSA-N	449.345	1.802	50	20	IDGD	
C[C@H](C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)C2)c1ccccc1	1783244677	LRYYORDZFJWYPZ-MFSJNOQSSA-N	444.576	1.677	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)Cc3c(C)noc3C)CCO2)C1	1783344564	UQAYFHDSOMAUTA-YJBOKZPZSA-N	428.327	1.837	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)CNC(=O)OC(C)(C)C)CCO2)C1	1783538427	CQXZNOFDKFYMMK-SJCJKPOMSA-N	434.331	1.124	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)CCc3cnc4[nH]ccc4c3)C2)C1	1783679117	YEBGYCCTHNTPQD-DYESRHJHSA-N	434.924	1.579	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(CCN(C(=O)c3ccccc3C3CC3)C2)C1	1784949608	YTZMMTPKYWQJMM-XMMPIXPASA-N	434.301	1.001	50	20	IDGD	
Cc1nc(F)ccc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCBr)[C@H]2C1	1786406078	HDCFYMPYIMYRQL-QEJZJMRPSA-N	428.302	1.907	50	20	IDGD	
CCn1nc(C)cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)CBr)C[C@@H]21	1787286221	JTBUAMPWGPQTDM-QEWYBTABSA-N	441.370	1.836	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21)[C@H]1Cc2ccccc2CN1	1787453885	AFRVPMMWVLVKOE-NXOAAHMSSA-N	426.344	1.484	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1)c1cncc(F)c1	1787470569	INSAHPQPCOITDV-UHFFFAOYSA-N	433.248	1.962	50	20	IDGD	
O=C(CCBr)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1	1787672767	AVGUXVYIXIRPAL-UHFFFAOYSA-N	445.122	1.899	50	20	IDGD	
Cc1nn(C)c(C)c1C(=O)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1	1788140569	YTWWSFROEMZVSU-UHFFFAOYSA-N	446.316	1.778	50	20	IDGD	
CN[C@@H](CC(=O)NC1(c2ccc(NC(=O)[C@H](F)Br)cc2)CCC1)C(=O)O	1790534947	XSXSTMPEJKDRFO-JSGCOSHPSA-N	430.274	1.874	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](CC)NC(C)=O)C[C@@H]21	1790958101	INRSOUKKOBDDJC-GVRJEKJASA-N	432.359	1.054	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccnc(C(F)F)c3)C[C@@H]21	1791252223	DTUHBICDXJJJCH-AYDFFVQHSA-N	431.867	1.866	50	20	IDGD	
Cc1ccccc1CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2C1	1791293318	UWULVOLRTQXSGG-ACRUOGEOSA-N	444.576	1.280	50	20	IDGD	
CC(C)(C)OC(=O)NCC1(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Cl)C3)CC1	1792546926	ITYRREQVUNNBQB-XJFOESAGSA-N	433.908	1.415	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCOc1ccc(F)cc1	1792736650	BIFMZXXYMOUSTB-FLTUCWPJSA-N	443.313	1.968	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)CBr	1792867672	FUPLCGVWBRVONY-JJAZEVLHSA-N	449.349	1.877	50	20	IDGD	
CC1(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](O)CCl)CN(C(=O)OC(C)(C)C)C1	1793117455	MDLAPAJROLJSMV-FZKCQIBNSA-N	443.972	1.871	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1CCCC1	1795022355	QHDUEQCVMDBPLV-YVSFHVDLSA-N	443.972	1.898	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CS[C@@H]1CCCCO1)C2	1795115923	VEUFUIQSMIDTKE-DLTLXFJOSA-N	435.384	1.621	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCc1ccc2c(c1)OCO2	1795745864	RRFGCYWSWANNSU-BCDXTJNWSA-N	444.532	1.359	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccncc1C(F)(F)F	1797098681	IWFYDPJAWYYYGB-BTTYYORXSA-N	441.454	1.725	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)c1cc2cc(F)c(F)cc2[nH]1	1797336218	FOFHJKURVMIKPK-YNHQPCIGSA-N	427.835	1.249	50	20	IDGD	
Cn1c(=O)n(C)c2cc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)CO[Si](C)(C)C)C4)ccc21	1797503041	NWTARIOHRLPNAE-BJWYYQGGSA-N	444.608	1.980	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cn(C)c2ncccc12	1797577625	RECKHBJXZNQPOC-JFILPPLUSA-N	435.322	1.560	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C[C@@H]1C[C@@H]3CC[C@H]1C3)C2	1798442761	CHLWZWDSYHSUMT-CMURFVSUSA-N	425.533	1.763	50	20	IDGD	
O=C(Cc1ccc(F)cc1F)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2	1800659316	IAUXZTBDARNDEK-IVWMJMPLSA-N	431.277	1.882	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)[C@H]1CCc2ccccc2O1	1800954598	WIKXBQOENACJRQ-IEHFGQBSSA-N	441.297	1.660	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CO[Si](C)(C)C)C3)C1	1800966169	NQPHMTAGGGTADI-ZQOJQMTGSA-N	440.613	1.407	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN1CCc3sccc3C1)C2)C(Cl)Cl	1801015452	DSOWCVHXSYAMJD-YWVIFJGQSA-N	432.373	1.500	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1ccc(O)cn1	1803134164	DVRHOILDOREFEQ-FWKYCFCSSA-N	438.488	1.102	50	20	IDGD	
CN1CCc2cc(C(=O)N3CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]3c3cccnc3)ccc21	1803143162	VVIMBDIPIOYXJD-HMXCVIKNSA-N	442.947	1.993	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)CSC1=S	1804336381	SFDATWKGEDAMBC-USZNOCQGSA-N	448.408	1.658	50	20	IDGD	
Cc1ccc(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)cn1	1805455573	UTVIGRXQXPQRLZ-KNQAVFIVSA-N	444.300	1.098	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC2(CCCN(C(=O)Cn3cc([N+](=O)[O-])cn3)C2)CC1	1806936849	JZSUPOMFEYRTGB-UHFFFAOYSA-N	437.573	1.874	50	20	IDGD	
Cc1ccc(CCC(=O)N2CCCC3(CCN(C(=O)c4cccc(B(O)O)c4)CC3)C2)cn1	1806995708	VNODXIDFPBTKRZ-UHFFFAOYSA-N	449.360	1.547	50	20	IDGD	
CC(C)CNC(=O)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)Br)[C@@H]1c1cccnc1	1808453376	UYQWDOOUCAUZEE-VNQPRFMTSA-N	439.354	1.643	50	20	IDGD	
CCC(=O)N[C@H](C)C(=O)N1CC[C@H](CNC(=O)[C@H](F)Br)[C@H]1c1cccnc1	1808649190	LFOGALZYQKSXHE-CUBALJKWSA-N	443.317	1.693	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)c1cc2ccccn2n1	1809053003	FUMQITXLZQJFAI-SNRMKQJTSA-N	427.892	1.649	50	20	IDGD	
CCC(=O)N1CCCC2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)CC2)C1	1809059391	CEIKWLNLICPSOD-UHFFFAOYSA-N	429.565	1.974	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)c1ccc2ncncc2c1	1809916036	VAZHMSDDUGCBNM-PWIZWCRZSA-N	439.903	1.944	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)N1CC[C@@H](CNC(=O)CO[Si](C)(C)C)[C@@H]1c1cccnc1	1810542713	WZSHOFZFLHZTOW-BPAFIMBUSA-N	434.613	1.806	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC2(CCCN(C(=O)[C@@H](F)Cl)C2)CC1	1810901499	UAIZWOVIVLRWRI-LJGKHRNASA-N	425.892	1.886	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)c1ccc2ccnn2c1	1812201016	COIDHZDSYBLLIA-KFKAGJAMSA-N	427.892	1.649	50	20	IDGD	
CC(=O)N[C@H](C)C(=O)N1CC[C@H](CNC(=O)[C@@H](C)Br)[C@@H]1c1cccnc1	1812867195	GBNCRUBMZKVSPE-BHTHQVBYSA-N	425.327	1.395	50	20	IDGD	
CC(=O)N[C@H](C)C(=O)N1CC[C@H](CNC(=O)[C@@H](C)Br)[C@H]1c1cccnc1	1812867196	GBNCRUBMZKVSPE-CZPYZCIJSA-N	425.327	1.395	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1	1813030535	IZMGQTIBTBBFSR-YEWWUXTCSA-N	434.880	1.461	50	20	IDGD	
O=C(CCn1cncn1)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@H]1c1cccnc1	1813319943	CBNKVAWQVWROSY-BPUTZDHNSA-N	439.289	1.460	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CNC(=O)N(C)C)n[nH]1	1814562332	LURCENQDPLKKEG-WCQYABFASA-N	443.346	1.704	50	20	IDGD	
CC(=O)c1cc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)n[nH]1	1816295124	NMYKDGJSDJCPBV-MRXNPFEDSA-N	444.496	1.014	50	20	IDGD	
Nc1c(C(=O)Nc2cc([C@H]3CCCCN3C(=O)[C@@H](O)CCl)[nH]n2)sc2nccnc12	1817433732	IWPNTGQDZIPMIP-MNOVXSKESA-N	449.924	1.902	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)/C=C/c2ccco2)[nH]n1)c1ccc(B(O)O)cc1	1817471177	SIKYOGFTAWOZML-GNISGLHKSA-N	434.261	1.702	50	20	IDGD	
Cc1cccc(CC(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)n1	1817473818	BLUOHURGLDRFCX-HXUWFJFHSA-N	447.304	1.342	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)/C=C/C1CC1)CC2	1819792777	AJPCXBSNQIOARY-UXONFWTHSA-N	426.502	1.334	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)[C@H](COC)NC(C)=O)sc2C1	1820184870	XDADYSFKDFZXSU-OBJOEFQTSA-N	430.958	1.614	50	20	IDGD	
Nc1n[nH]c(CCC(=O)N2CCCC[C@H]2c2cc(NC(=O)[C@H](F)Br)n[nH]2)n1	1820935789	SXUGYHBFFQZKOY-ZANVPECISA-N	443.281	1.425	50	20	IDGD	
CCNC(=S)NCC(=O)Nc1cc([C@H]2CCCCN2C(=O)CO[Si](C)(C)C)[nH]n1	1821645531	PMMNBVANJCOPRZ-CQSZACIVSA-N	440.646	1.737	50	20	IDGD	
CCC[C@H](NC(C)=O)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](Cl)COC)n[nH]1	1822376262	FPYZDRPTUWCOAK-DZKIICNBSA-N	427.933	1.960	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)/C=C/c2cnccn2)[nH]n1	1822416823	QHQVNZXXBKGKJU-RCMYXZNBSA-N	440.508	1.278	50	20	IDGD	
CC(=O)N[C@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@H](O)CCl)CC1)C(C)(C)C	1824179551	TYVYXFNVUHKUPR-KZNAEPCWSA-N	429.989	1.757	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H]1CCC(=O)NC1)CC2	1825440292	OCQAHBKUQYEJQX-MXWKQRLJSA-N	443.367	1.755	50	20	IDGD	
COCCOCCOCCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](F)Cl)CC2	1825773094	MCEWOIUHEHJTIB-IAQYHMDHSA-N	437.921	1.659	50	20	IDGD	
Cc1cncc(C(=O)N[C@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)c1	1826080736	VQJIVVRYIBOPOH-AWEZNQCLSA-N	430.534	1.445	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(O)cc1F)CC2	1826088745	MVGYFTMGRGJOGB-LLVKDONJSA-N	449.508	1.587	50	20	IDGD	
Cc1cc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)ccn1	1827052100	OUVYWOQUHGVFQD-JOCHJYFZSA-N	435.333	1.617	50	20	IDGD	
CC(=O)N1CCN(CC(=O)N2CCC([C@H]3CCCCN3C(=O)[C@@H](F)Cl)CC2)CC1	1827607911	BOPMUZGTCBNKAZ-IEBWSBKVSA-N	430.952	1.305	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3Cc4ccccc4CN3)C2)C1	1830358800	ZVTDFEJXIILHBU-CVDCTZTESA-N	449.979	1.422	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnn(C)c3Cl)C2)C1	1831654976	PFSVULWDVTVGLO-KSSFIOAISA-N	433.336	1.551	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3sccc3F)CCO2)C1	1831910961	YYCQUEUFORXHIQ-SJKOYZFVSA-N	449.342	1.988	50	20	IDGD	
C[C@@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)Cc3cc[nH]n3)CC2)CC1	1833265138	WWBVQAAUXDJBBM-AWEZNQCLSA-N	440.386	1.555	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)CCc3nc(N)n[nH]3)CC2)CC1	1833533955	VNKJOASIUUYVJW-MRXNPFEDSA-N	439.992	1.299	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)CCN(C)C(C)=O)CC2)CC1	1833668697	YUBCSRLODVVLBA-LJQANCHMSA-N	429.005	1.834	50	20	IDGD	
Cn1nc(C(=O)NC2CCN(C3CCN(C(=O)CCBr)CC3)CC2)cc1O	1833944454	FXFDEKLEQVXKKD-UHFFFAOYSA-N	442.358	1.096	50	20	IDGD	
CCc1[nH]nc(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)c1Cl	1834903625	CSSZWSACOJSFCI-HNNXBMFYSA-N	446.379	1.410	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1)c1cc[n+]([O-])cc1	1836049939	QMGVHDYMBVNPQC-UHFFFAOYSA-N	439.354	1.290	50	20	IDGD	
O=C(c1cnc2[nH]ncc2c1)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836717290	RZRRAOZHSHEDCD-QGZVFWFLSA-N	435.912	1.170	50	20	IDGD	
O=C(c1cccc2[nH]ncc12)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836717831	KVSLSWJSKYCUET-IBGZPJMESA-N	434.924	1.775	50	20	IDGD	
O=C(COc1ccccc1F)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836719066	KVZMDWCVULEQNH-GOSISDBHSA-N	442.915	1.803	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cn4ccsc4n3)CCO2)C1	1837045073	PXBRGQVGVSWGQA-IBGZPJMESA-N	440.953	1.731	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3coc(Cl)n3)C2)C1	1837712132	GKMOBTXMVVYCGJ-QGZVFWFLSA-N	431.949	1.250	50	20	IDGD	
N#Cc1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCBr)C3)C2)c1	1838906670	YDRNIUIVEWBVLI-LJQANCHMSA-N	436.306	1.413	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3COc4ccccc4O3)C2)C1	1839142462	PWPRNDSWAKPYSO-KLHJMIIUSA-N	438.908	1.300	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(C(C)(C)C)n[nH]3)C2)C1	1839145434	HPMKWSSRTMYMEN-JLTOFOAXSA-N	426.945	1.795	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(C)ccc3F)CCO2)C1	1839314082	QBIBBQQVXBRUQS-JXFKEZNVSA-N	428.888	1.458	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(C)n4ccnc4n3)CCO2)C1	1839550329	CGBGHKGHCQXGSB-QRWLVFNGSA-N	435.912	1.125	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3CC[C@@H](C)O3)C2)C1	1839965374	WXJHPTIQRLTVOR-ATNYBXOESA-N	433.343	1.184	50	20	IDGD	
O=C(Cc1c(F)cccc1F)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840189208	CQUQRLCWHOVBQL-SFHVURJKSA-N	437.270	1.767	50	20	IDGD	
COc1cc(F)ccc1C(=O)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1840641539	LRDUQGYHTJBMGU-GOSISDBHSA-N	435.279	1.708	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)COc3ccccc3C#N)CCO2)C1	1840818782	WYFOIDFICMAMEU-XMSQKQJNSA-N	449.935	1.801	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H](CC(=O)N2CC3(CCCN3C(=O)[C@@H](O)CCl)C2)C1	1841354231	OYMRULSTOZMSCZ-GJZGRUSLSA-N	429.945	1.437	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC2(CCCN2C(=O)c2cncc(S(C)(=O)=O)c2)C1	1842189228	GWOPJQYQZNGQQS-UHFFFAOYSA-N	425.583	1.154	50	20	IDGD	
CC(C)(C)OC(=O)N1CC2(C[C@H](C(=O)N3CC4(CCCN4C(=O)[C@H](F)Cl)C3)CO2)C1	1843366826	SIHPYMFFIVAHPZ-KBPBESRZSA-N	445.919	1.750	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(CC(=O)N2CC3(CCCN3C(=O)[C@H](F)Cl)C2)CC1	1843367683	VXDODPCBZKPOIA-HNNXBMFYSA-N	432.924	1.277	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)c2n[nH]c3cc(Cl)ccc23)C1	1844107734	RLMJJXHVBUWLML-UHFFFAOYSA-N	432.912	1.406	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1ccc3c(c1)CCCC3=O)C2	1844264269	ACPDRBZUPOMPAH-UHFFFAOYSA-N	447.495	1.335	50	20	IDGD	
Cc1cnoc1C(=O)N1CCCC12CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2	1844618686	BRQNFSGTFINKMT-UHFFFAOYSA-N	440.504	1.146	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)c1cnsn1)C2	1844692176	QCQILCWJLVKEBU-UHFFFAOYSA-N	431.430	1.502	50	20	IDGD	
CC(=O)N[C@H](Cc1cccc(F)c1)C(=O)N1CCCC12CN(C(=O)CO[Si](C)(C)C)C2	1847013480	LWPHBXGXNPWVJC-LJQANCHMSA-N	449.599	1.928	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1nc(Cl)ccc1F	1848283903	BVRBFDSGRGZVCT-KBPBESRZSA-N	432.843	1.002	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(C(=O)NNC(=S)NCCc2cccs2)cc1	11517403	XFSQJWJWUGZJLK-UHFFFAOYSA-N	426.589	1.786	50	20	IDGD	
COc1ccc(C(=O)NNC(=S)NC(C)(C)C)cc1S(=O)(=O)NC1CCCC1	14894982	XRSOEWYSBNMRJO-UHFFFAOYSA-N	428.580	1.824	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c(OC)c1	15526035	IENUTDUFIMAOOT-UHFFFAOYSA-N	433.486	1.563	50	20	IDGD	
C=CCNS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H](C)Oc2ccc(OCC)cc2)c1	18071945	VQRZQNOPAKBXBW-HNNXBMFYSA-N	447.513	1.778	50	20	IDGD	
CCCS(=O)(=O)N1CCCC[C@@H]1C(=O)NNC(=O)[C@@H](C)Oc1cccc(C)c1C	108753705	SJIQMCAUVNXQNG-IAGOWNOFSA-N	425.551	1.812	50	20	IDGD	
COc1cccc(C(C)=NNC(=O)CN2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)c1	254307716	NHOAFQYZLHRXEC-UHFFFAOYSA-N	444.557	1.850	50	20	IDGD	
CC[C@H](NC(=O)NNC(=O)CNC(=O)c1cccs1)c1ccccc1OCC(=O)NC	725872573	DYCOKORIYNJIFF-AWEZNQCLSA-N	447.517	1.084	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)C[C@H](C)N3S(C)(=O)=O)cc1C	726281451	SGKICSWWHNGPMU-AWEZNQCLSA-N	444.513	1.414	50	20	IDGD	
Cc1ccc(S(=O)(=O)Nc2ccccc2F)cc1C(=O)NNC(=O)C(=O)NC(C)C	726612324	BBMIBNXHSGFHDM-UHFFFAOYSA-N	436.465	1.221	50	20	IDGD	
COc1ccccc1CN1CCN(CC(=O)NNC(=O)c2cc(Cl)ccc2OC)CC1	728055643	BQZXSECGARGHPV-UHFFFAOYSA-N	446.935	1.936	50	20	IDGD	
COc1ccc(-c2nn(-c3ccccc3)cc2C=NNC(=O)[C@@H](C)NS(C)(=O)=O)cc1	728436707	IGNSCNPUQHJJNR-OAHLLOKOSA-N	441.513	1.936	50	20	IDGD	
COc1cc(C=NNC(=O)[C@H](C)NS(C)(=O)=O)ccc1OC(=O)c1ccc(F)cc1	728436905	UWKWNHKDLYVJQI-LBPRGKRZSA-N	437.449	1.441	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)NC[C@@H]1CN2CCC[C@@H]2CO1	729507773	VTUUIZWZZSWAHS-UKRRQHHQSA-N	427.299	1.022	50	20	IDGD	
CCN1CCC[C@@H]1CN1C[C@@H](C(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)CC1=O	729626371	CZLGNFNYPAZTHA-GBESFXJTSA-N	430.549	1.551	50	20	IDGD	
Cc1cc(S(C)(=O)=O)c(C)c(S(=O)(=O)NNC(=O)NCCc2cccs2)c1	730203412	OYBDMXCVERYCHL-UHFFFAOYSA-N	431.561	1.504	50	20	IDGD	
CCCC(=O)N1CCCC[C@H]1C(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12	730205734	PNCRIVUIBQZAED-KRWDZBQOSA-N	427.505	1.920	50	20	IDGD	
COc1ccccc1C/C(C)=C\C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	730206129	JQUGMMKFJOTVSV-SQFISAMPSA-N	431.514	1.896	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)c1ccc(N2CCOCC2)c(F)c1	730218815	QJCYFUBCRYLLTO-UHFFFAOYSA-N	434.493	1.860	50	20	IDGD	
O=C(CC[C@@H]1NC(=O)N(c2ccc(Cl)c(Cl)c2)C1=O)NNC(=O)N1CCOCC1	730532402	FJPOPAJQYWBLHU-ZDUSSCGKSA-N	444.275	1.271	50	20	IDGD	
C[C@@]1(NNC(=O)NCCCN2CCN(c3cccc(Cl)c3)CC2)CCS(=O)(=O)C1	730672713	KGPNZSFYLHFPPE-LJQANCHMSA-N	444.001	1.233	50	20	IDGD	
Cc1cccc([C@@H](CNC(=O)NNC(=O)COc2ccccc2O)N2CCOCC2)c1	730819514	FMCYECIVMYYWKH-GOSISDBHSA-N	428.489	1.483	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)c1nnn(-c2cccc3cnccc23)c1C	731186119	JNNKQTDVKIOOMT-UHFFFAOYSA-N	432.440	1.973	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cc3c(nc2O)CCCC3)cc1OC	731737490	KAESWMAFFXLIJN-UHFFFAOYSA-N	429.429	1.301	50	20	IDGD	
Cc1c(C(=O)NNc2nc(-c3cccnc3)no2)nnn1-c1cccc2c1CCN(C)C2	731809837	SEJYKADJEXJPSS-UHFFFAOYSA-N	431.460	1.766	50	20	IDGD	
Cc1ccc(S(=O)(=O)NC[C@@H]2CCCN([C@@H](C)C(=O)NNC(=O)CC(C)C)C2)cc1	731850177	PZNVVOABHZTUMI-ROUUACIJSA-N	438.594	1.567	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCCN1CCSCC1	732892198	VHAXPAZXEANNDU-LBPRGKRZSA-N	431.356	1.596	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c1	733170454	YMKJPMQKNQNTMK-UHFFFAOYSA-N	431.449	1.337	50	20	IDGD	
CC(C)c1c(C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)cnn1-c1ccccn1	734241358	CCSRQBSEDODOME-UHFFFAOYSA-N	431.497	1.859	50	20	IDGD	
CCCC(=O)N1CCCC[C@@H]1C(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	734824585	DVYXZMRORUORSO-MRXNPFEDSA-N	439.557	1.898	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCC(NC(=O)NNc3ccccn3)CC2)cc1OC	735519295	SMTRCZZEEABRTC-UHFFFAOYSA-N	435.506	1.578	50	20	IDGD	
CSCC[C@H](C(=O)NNC(=O)COCc1ccccc1)N1C(=O)c2ccccc2C1=O	737629362	NUHURYRENNMBJK-GOSISDBHSA-N	441.509	1.769	50	20	IDGD	
Cc1cc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)n[nH]1	739022062	ZFNCUFJJSKHWMB-UHFFFAOYSA-N	442.501	1.341	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NCC(=O)NNc2cccc(C(F)(F)F)n2)c1	740142376	PCWZTOFAOBSBCT-UHFFFAOYSA-N	445.423	1.224	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)CCCN(C)C2=NS(=O)(=O)c3ccccc32)cc1	743294284	UXQFQKRGFIQTBA-UHFFFAOYSA-N	443.529	1.415	50	20	IDGD	
C[C@@H](CC(=O)NNC(=O)c1ccc(Cl)cc1O)/N=C1/NS(=O)(=O)c2ccccc21	743317093	DQZBOVCWDDBERY-JTQLQIEISA-N	436.877	1.324	50	20	IDGD	
CC(=NNC(=O)Nc1ccc(C(=O)O)cc1)c1cccc(S(=O)(=O)N2CCOCC2)c1	743444085	BCIGHSFZWLQLLU-UHFFFAOYSA-N	446.485	1.951	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1	743828562	SNXGCHITBRXRKA-UHFFFAOYSA-N	447.517	1.240	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CN2CCN(CC(=O)N[C@@H]3CCC[C@@H](C)C3)CC2)c1	744402045	HSPDXLUCAJRZAQ-UYAOXDASSA-N	429.565	1.069	50	20	IDGD	
C[C@H]1Oc2ccccc2N(CCC(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)C1=O	744531205	MKSXKEGOKXXJIF-CQSZACIVSA-N	436.424	1.067	50	20	IDGD	
Cn1cc(CC(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)c2ccccc21	744622009	LZXOLTYGXWMXBO-UHFFFAOYSA-N	428.514	1.885	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(CC(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)CC1	744879194	RQORTZMFQYDRAU-UHFFFAOYSA-N	444.488	1.900	50	20	IDGD	
COc1ccccc1-c1nn(C)cc1C(=O)OCC(=O)NNC(=O)c1ccc(C#N)cc1	745076262	NAODXOVDHYIROH-UHFFFAOYSA-N	433.424	1.585	50	20	IDGD	
CCc1nc(C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)nn1-c1ccccc1F	745240687	XYBGOJSXMJEGGI-UHFFFAOYSA-N	436.403	1.458	50	20	IDGD	
CN(C)C(=O)[C@@H]1CCC[C@@H](NC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)C1	745824641	KNZXMFVJIHXWOK-TZMCWYRMSA-N	425.511	1.073	50	20	IDGD	
COCCOC[C@@H](C)NC(=O)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1	745863257	CRIYPFKSRGMZMG-GCJKJVERSA-N	440.544	1.995	50	20	IDGD	
COc1cc(C=NNC(=O)Cn2nnc(-c3ccccc3)n2)cc(Cl)c1OCC(N)=O	745984425	SMUXNEYDDPCXSB-UHFFFAOYSA-N	443.851	1.017	50	20	IDGD	
O=C(NNC(=O)N1CCOCC1)/C(=C\c1cccs1)n1nnnc1-c1ccccc1	745987679	DYXLGZDSZXRACI-DTQAZKPQSA-N	425.474	1.473	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNC(=O)NCCNS(=O)(=O)c2cccnc2)cc1	746326134	NHAMDFQWBZEIER-UHFFFAOYSA-N	449.533	1.429	50	20	IDGD	
O=C(NNC(=O)N1CCC(N2CCCNC2=O)CC1)c1ccc(Br)s1	747939577	DHLCYODFJRYMHR-UHFFFAOYSA-N	430.328	1.745	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@@H]2CC(=O)N(c3cn[nH]c3)C2)ccc1OCCC(C)C	748527555	VZQXIQNQXPIDDK-OAHLLOKOSA-N	429.477	1.657	50	20	IDGD	
Cc1cc(NNC(=O)c2cnc3c(c2C)c(=O)n(C)c(=O)n3C)ccc1Br	748605911	BEDVKKXGFMIUFT-UHFFFAOYSA-N	432.278	1.768	50	20	IDGD	
O=C(O)COc1ccc(S(=O)(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1Cl	748690449	BOACAAGLKBEZKD-UHFFFAOYSA-N	442.833	1.198	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCCN2CCCc3ccccc32)nc1	749213242	GDSKAOHYUVLWNK-UHFFFAOYSA-N	432.550	1.847	50	20	IDGD	
COC(=O)c1cc(C(=O)NNc2nc(Br)cn3ccnc23)cc([N+](=O)[O-])c1	750247188	LWZUCXYHIUMHDS-UHFFFAOYSA-N	435.194	1.944	50	20	IDGD	
C[C@@H]1Oc2ccccc2N(CC(=O)NNc2nc(Br)cn3ccnc23)C1=O	750247306	ACXVUFVOONOMJK-JTQLQIEISA-N	431.250	1.749	50	20	IDGD	
O=C(NCc1ccco1)NNC(=O)c1cccn2c(I)cnc12	750610047	FHIJMBUHEOBSPM-UHFFFAOYSA-N	425.186	1.676	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)/C(=C\c1ccco1)n1nnnc1-c1ccccc1	751207000	PIYCYEUWBFUEQO-FOWTUZBSSA-N	447.411	1.102	50	20	IDGD	
C[C@@H](NC(=S)NNC(=O)C1CCN(S(=O)(=O)c2ccccc2F)CC1)C1CC1	751619404	UZVDKSQKHDOBKQ-GFCCVEGCSA-N	428.555	1.520	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)NCC2(CS(C)(=O)=O)CC2)cc1Cl	752023544	LFISNVRSGOFJDP-UHFFFAOYSA-N	434.902	1.518	50	20	IDGD	
N#CCCn1cc(/C=C(\C#N)C(=O)NCCOCC(N)=O)c(-c2ccc(Cl)cc2)n1	752082776	HSNHRKJGRPHPBL-XNTDXEJSSA-N	426.864	1.642	50	20	IDGD	
Cn1c(=O)oc2cc(C=NNC(=O)c3ccc(S(=O)(=O)N4CCCC4)cc3)ccc21	754913311	BPGYALJUBIZQKY-UHFFFAOYSA-N	428.470	1.680	50	20	IDGD	
CCc1cnc(NC(=O)C(=O)NNC(=O)c2cc(OC)ccc2Br)s1	756155388	PLYJSCFOMNDFHU-UHFFFAOYSA-N	427.280	1.876	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)Nc1cccc(NC(=O)c2ccoc2)c1	756276353	GHNCYVISYQVXJQ-UHFFFAOYSA-N	432.400	1.974	50	20	IDGD	
COC(=O)CN1CCN(c2ccc(NC(=O)NNC(=O)c3ccc(C#N)cc3)cc2)CC1	756394755	WZARTNPXHMDTHA-UHFFFAOYSA-N	436.472	1.320	50	20	IDGD	
COC(=O)c1cc(NC(=O)NNC(=O)c2ccc(OC)c(OC)c2)c(OC)c(OC)c1	756742338	KPBOPDQFDBHGHZ-UHFFFAOYSA-N	433.417	1.974	50	20	IDGD	
C[C@@](O)(CN1Cc2ccccc2C1=O)C(=O)NNC(=O)c1cccc(Br)c1	756840243	ZEZITAKQJCFDLB-LJQANCHMSA-N	432.274	1.617	50	20	IDGD	
CCS(=O)(=O)c1ccc(CCC(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)cc1	757633055	GFKJPBYXJOKRHL-UHFFFAOYSA-N	431.514	1.816	50	20	IDGD	
COC(=O)c1c(F)cccc1S(=O)(=O)NNC(=O)c1cc(OC)c(OC)c(OC)c1	757645528	MZWOVZWRCFPDIG-UHFFFAOYSA-N	442.421	1.261	50	20	IDGD	
Cc1ccc(CNC(=O)NNC(=O)CNC(=O)c2cccs2)c(OC[C@@H]2CCCO2)c1	757730714	AOICKXGFZVBTKH-INIZCTEOSA-N	446.529	1.875	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1cccc(-n2nccc2-c2ccccc2)c1	758030366	QAVFFSXRKDYNRU-AWEZNQCLSA-N	427.486	1.238	50	20	IDGD	
CCCCn1ncc(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)c1CC	760067516	VLGGCBMRBMTIAU-UHFFFAOYSA-N	427.914	1.621	50	20	IDGD	
O=C(NCCOc1ccc(C(F)(F)F)cn1)NNC(=O)c1ccc2c(c1)OCCO2	760835663	HDFKFXBHMXQYDY-UHFFFAOYSA-N	426.351	1.895	50	20	IDGD	
COc1ccc(C(=O)NNc2nc(-c3cccnc3)no2)nc1I	761158426	LBNNQKDBVVQZRL-UHFFFAOYSA-N	438.185	1.897	50	20	IDGD	
O=C(Cn1c2ccccc2c(=O)c2ccccc21)NNc1nccc(N2CCOCC2)n1	762851167	BTGBPZYNQOLASO-UHFFFAOYSA-N	430.468	1.925	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1ccc(C(N)=O)cc1)C(=O)NNC(=O)c1ccc2ccccc2c1	763025582	UHOMVHADAWCXDP-CYBMUJFWSA-N	440.481	1.067	50	20	IDGD	
C[C@@H](CC(=O)NNC(=O)CNC(=O)c1ccco1)[C@H]1CCCN(C(=O)OC(C)(C)C)C1	763325231	YXDMSGOQBRZCTB-GJZGRUSLSA-N	436.509	1.830	50	20	IDGD	
Cc1c(C(=O)O)cc(Cl)cc1S(=O)(=O)NNC(=O)[C@@H]1COc2ccccc2O1	763417527	XSRFNEJEECVDMC-AWEZNQCLSA-N	426.834	1.496	50	20	IDGD	
CCS(=O)(=O)c1cc(F)ccc1NC(=O)C(=O)NNC(=O)c1ccc2ccccc2n1	763455038	MOZPDDHEWULGSX-UHFFFAOYSA-N	444.444	1.567	50	20	IDGD	
N#Cc1cccc(-c2csc(NC(=O)C(=O)NNC(=O)[C@@H]3COc4ccccc4O3)n2)c1	763569709	AMAPNKXQMFXBJE-KRWDZBQOSA-N	449.448	1.608	50	20	IDGD	
CC(C)(C)c1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc3c(c2)NC(=O)CO3)cc1	763596677	XYXJZEPUGBEAQH-UHFFFAOYSA-N	440.456	1.480	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(NC(C)=O)c(OC)c1	763681388	KZYQQPBXFKYOKH-UHFFFAOYSA-N	444.444	1.217	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2F)ccc1Br	763682871	QHCMKXMFRXOTEU-UHFFFAOYSA-N	440.225	1.762	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2csc(-c3ccccn3)n2)c1	763773391	XBZYPJQDWFAKBZ-UHFFFAOYSA-N	427.442	1.622	50	20	IDGD	
COC(=O)c1c(NC(=O)C(=O)NNC(=O)Cc2c[nH]c3ccccc23)sc(C)c1C	763860062	ANOVYPXHFWABCH-UHFFFAOYSA-N	428.470	1.961	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)Cc2c[nH]c3ccccc23)ccc1N1CCOCC1	763865063	HZDDAHUUNIKDQI-UHFFFAOYSA-N	435.484	1.642	50	20	IDGD	
CNC(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(OC(C)C)c(OC)c2)cc1	763916280	LILNJWRGJUWQJB-UHFFFAOYSA-N	442.472	1.171	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)Cc2ccc(F)cc2)cccc1C(=O)N1CCCC1	763919445	TYOAEESQWSRHBY-UHFFFAOYSA-N	426.448	1.699	50	20	IDGD	
O=C(NNC(=O)c1cc(Cl)ccc1O)C(=O)Nc1ccc(N2CCSCC2)cc1	763978481	JSMLILANYCPGIP-UHFFFAOYSA-N	434.905	1.999	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cn(C)c3ccccc23)cc1S(C)(=O)=O	763981640	MJQKKIVBIPBZAT-UHFFFAOYSA-N	428.470	1.290	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1ccc(Br)c(F)c1	764006256	NMCIAJZEGOXLQO-UHFFFAOYSA-N	438.209	1.759	50	20	IDGD	
COc1cc(OC)c(OC)cc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccccc2)on1	764016021	CLBAPCMGPNEKKY-UHFFFAOYSA-N	440.412	1.767	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2c(C)c(C)nn2-c2ccc(C#N)cc2)c1O	764132949	YVMNDMPHHFUNGO-UHFFFAOYSA-N	448.439	1.475	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1cc(N2CCNC2=O)ccc1Cl	764136907	VYCOYAQQWVXIDY-UHFFFAOYSA-N	445.863	1.207	50	20	IDGD	
C[C@@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)CCc3ccco3)cc2F)C[C@@H](C)O1	764168346	DIFQJNZGDJTSEI-ZIAGYGMSSA-N	432.452	1.751	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)C[C@H](C)O1	764319422	DYLHBJLKBXRSNL-LNLFQRSKSA-N	432.521	1.434	50	20	IDGD	
CCOCC(=O)NNC(=O)C(=O)Nc1c(C)c(C)nn1-c1ccc(Cl)c(Cl)c1	764325353	KURXZXHWXYSNQP-UHFFFAOYSA-N	428.276	1.918	50	20	IDGD	
CCc1ncsc1NC(=O)C(=O)NNC(=O)c1ccc(OC)c(Br)c1	764326436	IIMBGYYFIMFMQN-UHFFFAOYSA-N	427.280	1.876	50	20	IDGD	
COc1cc(OC)cc(OCCNC(=O)NNC(=O)Cc2nc3ccccc3n2C)c1	764374307	PEQURITZWMQDRH-UHFFFAOYSA-N	427.461	1.542	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)C(=O)Nc1ccc(C(=O)NCc2ccc(F)cc2)cc1	764385919	PPVFCKQHDPNQOM-UHFFFAOYSA-N	449.442	1.859	50	20	IDGD	
CC[C@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)cc1	764400656	FYJPEPGFKUNYDR-ZDUSSCGKSA-N	444.513	1.799	50	20	IDGD	
CNS(=O)(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2F)c1C	764409952	CKTFLCYSUNWWTD-UHFFFAOYSA-N	442.856	1.095	50	20	IDGD	
O=C(NNC(=O)c1ccnn1C1CCCC1)c1cccc(S(=O)(=O)N2CCCC2)c1	764462156	FHEWVRXEESNWFG-UHFFFAOYSA-N	431.518	1.858	50	20	IDGD	
CO[C@@]1(CNC(=O)NNC(=O)COc2ccc(OCc3ccccc3)cc2)CCOC1	764811950	VBVALSDXSPOMHR-JOCHJYFZSA-N	429.473	1.780	50	20	IDGD	
Cc1nc(-c2ncccn2)nc(O)c1CC(=O)NNC(=O)CSc1ccccc1O	765248187	OTPCUQFOFGLYIX-UHFFFAOYSA-N	426.458	1.135	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2NC)c1	765364381	CIDMUCFFNBZAHF-UHFFFAOYSA-N	449.489	1.742	50	20	IDGD	
CC(C)(C)OC(=O)NNC(=O)C(=O)Nc1c(C(=O)N2CCOCC2)oc2ccccc12	765390937	CLGWFXROELYFCP-UHFFFAOYSA-N	432.433	1.400	50	20	IDGD	
C[C@H](CCC(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1)NC(=O)OC(C)(C)C	765483838	WWXSTCCILJCXOQ-GFCCVEGCSA-N	426.901	1.797	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3ccc(C(=O)N(C)C)cc3)n[nH]2)cc1OC	765596977	CLFJKTWIYHYIOS-UHFFFAOYSA-N	437.456	1.871	50	20	IDGD	
CCc1nc(CC(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)cs1	765753433	YCLZXCDOWVSSBZ-UHFFFAOYSA-N	435.981	1.867	50	20	IDGD	
O=C(CC1CCCC1)NNC(=O)C(=O)Nc1ccccc1OCC(=O)Nc1cccnc1	768238800	FDSDJFSWPFUVNE-UHFFFAOYSA-N	439.472	1.765	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)CCc1c(C)c2c(C)nn(C)c2[nH]c1=O	768611633	ILJWZTSQMZCREL-UHFFFAOYSA-N	447.517	1.366	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)c1ccc(C[C@H]2CC(=O)NC2=O)cc1	768628517	AIOKURGAUVLHDA-AWEZNQCLSA-N	431.470	1.061	50	20	IDGD	
COC(=O)CCCc1nnc(NC(=O)NNc2c(OC)cccc2S(C)(=O)=O)s1	769242242	USOJXUCMZPTAND-UHFFFAOYSA-N	443.507	1.595	50	20	IDGD	
O=C(COC(=O)C1CCC(C(F)(F)F)CC1)NNC(=O)[C@H]1COc2ccccc2O1	769439856	LWEYSORKSIKEDU-KOHJWAIASA-N	430.379	1.886	50	20	IDGD	
C[S@@](=O)c1cccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1	770210013	XWCNUQLJEMRPRO-MUUNZHRXSA-N	435.527	1.283	50	20	IDGD	
Cc1cc(Br)c(F)cc1NC(=O)C(=O)NNC(=O)COc1ccccc1O	770772282	UUJPSWOOMATOCN-UHFFFAOYSA-N	440.225	1.767	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1cccc(C(F)(F)F)c1)C(=O)NNC(=O)CNc1ccccc1	770952146	KIGHPILGOMENCK-GFCCVEGCSA-N	444.435	1.632	50	20	IDGD	
Cc1cccc(S(=O)(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c1Br	771898799	SERWRUJPGDEYKI-UHFFFAOYSA-N	437.279	1.357	50	20	IDGD	
O=C(COc1ccc2c(c1)CCC(=O)N2)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772188330	KXHQYIGJTRYCTO-UHFFFAOYSA-N	430.848	1.067	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C1=NN(c2ccccc2)[C@H](C(N)=O)C1	772970347	BVMZEROGIHFZGH-PXAZEXFGSA-N	429.864	1.375	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)[C@@H](C)NC(=O)c1n[nH]c2ccccc12	772991621	WPDGOWDKJUJICZ-NEPJUHHUSA-N	429.864	1.950	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)c1ccc2c(c1)CCN2S(C)(=O)=O	772991955	YLTBSWYQBIBCAQ-LBPRGKRZSA-N	437.905	1.891	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)C(=O)Nc2ccc(N3CCC(CN(C)C)CC3)cc2)n1	773484057	ZUFIDQKUJPXVIV-UHFFFAOYSA-N	425.537	1.953	50	20	IDGD	
COc1ccc(S(=O)(=O)NC2CC2)cc1NC(=O)C(=O)NNc1cccc(C#N)c1	773698243	APVAYHQNPYBAPZ-UHFFFAOYSA-N	429.458	1.089	50	20	IDGD	
CN(C)C(=O)[C@@H]1CC[C@H](CNC(=O)NNC(=O)c2cc(F)ccc2Br)O1	775455516	VCGNIVOVMMSUMI-MFKMUULPSA-N	431.262	1.168	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cc(Br)ccc2O)cc1-n1cnnn1	776156172	BQIGONKFWOXESR-UHFFFAOYSA-N	433.222	1.214	50	20	IDGD	
COc1cc(C(=O)CCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc(OC)c1OC	776966093	IUWQHBHERADLAN-LJQANCHMSA-N	444.440	1.663	50	20	IDGD	
COc1ccc(CN(CC(=O)NNC(=O)c2cccc(C)c2)[C@H]2CCS(=O)(=O)C2)cc1	777542815	UXSQJIKHBLXXAW-IBGZPJMESA-N	445.541	1.454	50	20	IDGD	
CC(C)N1CC[C@@H](NC(=O)NNC(=O)C(=O)NC2CC2)[C@@H]1c1ccc(Cl)c(F)c1	777750536	PYVSITGMBBZSIR-CVEARBPZSA-N	425.892	1.612	50	20	IDGD	
COc1cc(C(C)=NNC(=O)CN2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)ccn1	782251993	IUMXHKFLWSHZEW-UHFFFAOYSA-N	445.545	1.245	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ncc(C(F)(F)F)cc2Cl)cn1	782853652	FTPXIAJIZVGHEF-UHFFFAOYSA-N	437.787	1.634	50	20	IDGD	
COc1cccc(Cn2nccc2NC(=O)C(=O)NNc2cncc(Cl)n2)c1OC	783258172	CCSHSNBCEBQRTK-UHFFFAOYSA-N	431.840	1.474	50	20	IDGD	
Cc1ccccc1NC(=O)NNC(=O)C(=O)Nc1ccc(S(=O)(=O)NC2CC2)cc1	783416904	GWIOURRGEDXNFY-UHFFFAOYSA-N	431.474	1.227	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)CNC(=O)c2ccco2)ccc1C(=O)OC(C)(C)C	784001669	APUNGKYNHVCWHB-UHFFFAOYSA-N	444.444	1.059	50	20	IDGD	
CC(C)Cn1ncc(NC(=O)C(=O)NNC(=O)CNC(=O)c2cccs2)c1C(C)C	784005351	WVRQWKZVUTYJGZ-UHFFFAOYSA-N	434.522	1.240	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)C(=O)Nc1ccccc1C(=O)N1CCCCC1	785067806	OWTLWCQHDRLDLJ-UHFFFAOYSA-N	448.483	1.289	50	20	IDGD	
O=C(NNc1c(F)cc(C(=O)NC2CC2)cc1F)C(=O)Nc1ccccc1-n1ccnn1	785110077	XPIXEWVSUNMDHK-UHFFFAOYSA-N	441.398	1.520	50	20	IDGD	
COc1cc(F)cc(NNC(=O)C(=O)Nc2ccc(S(=O)(=O)N(C)C)c(OC)c2)c1	785235345	XMQIIFVMHRBDMU-UHFFFAOYSA-N	440.453	1.175	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)[C@@H]1CC(c2c(F)cccc2F)=NO1	786496758	KRQOHUVCGWLCKO-AWEZNQCLSA-N	426.420	1.910	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1)[C@@H](C)S(C)(=O)=O	788265460	LQNZKMDVTDDMIH-HUUCEWRRSA-N	441.513	1.765	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2nc3c(s2)CCCCC3)cc(OC)c1OC	789729684	FIMKLIMJQPVTSF-UHFFFAOYSA-N	448.501	1.838	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1cccc2c1OCC[C@H]2N(C)C	789733046	GFKTVGSHAVMOMV-QGZVFWFLSA-N	426.473	1.409	50	20	IDGD	
COc1cc(NNC(=O)C(=O)Nc2ccc(CN3C(=O)CNC3=O)cc2)ccc1Cl	789799186	VFQNKAGVRFINHO-UHFFFAOYSA-N	431.836	1.482	50	20	IDGD	
CCNC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)c1	789812724	NAIHFZXUBXUZQF-ROUUACIJSA-N	439.472	1.487	50	20	IDGD	
COC(=O)c1ccc(S(=O)(=O)NNC(=O)c2cccc(OC)c2O)cc1C(F)(F)F	790053238	FWEPJVSUVZCSEG-UHFFFAOYSA-N	448.375	1.830	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1)C(=O)OC	790114835	WIQZKTSRNMGYTB-QGZVFWFLSA-N	433.486	1.125	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc([C@@H]2CCCOC2)nn1C	790952744	UNKWLPSAOVVXFX-OAHLLOKOSA-N	429.477	1.041	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)c(OCc2ccccc2)c1	792317226	PIOCWVQABPAPQH-OAHLLOKOSA-N	449.529	1.753	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)C(C)(C)COc1cc(Cl)cc(Cl)c1	792317489	VENBXLRPLVISOA-SECBINFHSA-N	426.322	1.484	50	20	IDGD	
CN(C)N(C(=O)c1cc(NC(=O)OCC(F)(F)F)ccc1O)[C@@H]1CCS(=O)(=O)C1	792853273	CWNVFWSLNJUOTA-LLVKDONJSA-N	439.412	1.609	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc(OC(C)C)nn3)n[nH]2)c1	793049836	IJHXRAKGFHBNCF-UHFFFAOYSA-N	437.460	1.670	50	20	IDGD	
CN(C(=O)OC(C)(C)C)[C@H](C(=O)NNC(=O)COc1ccccc1F)c1cnn(C)c1	794761825	XZIRMBRINVHRTD-KRWDZBQOSA-N	435.456	1.694	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)[C@H]1CC(=O)N(c2ccc(F)cc2F)C1	795177417	MQJZUZVRRUUQKR-LBPRGKRZSA-N	438.456	1.711	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)c1ccc(C)cc1)C(=O)NNC(=O)NCC(F)(F)F	798314968	JCDWSMSOOAWDBR-GFCCVEGCSA-N	442.485	1.288	50	20	IDGD	
CC(C)(C)Nc1ccccc1NC(=O)C(=O)NNC(=O)COc1ccccc1[N+](=O)[O-]	799258398	BLZMAKGBYHLBLS-UHFFFAOYSA-N	429.433	1.970	50	20	IDGD	
N#Cc1cc(NC(=O)C(=O)NNC(=O)COCc2ccccc2)ccc1OC(F)(F)F	799835378	PYZHEJCESJPSHQ-UHFFFAOYSA-N	436.346	1.760	50	20	IDGD	
Cc1c(C)c(O)c(C=NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c(C)c1O	799864632	POUFVJAJMQOKQU-UHFFFAOYSA-N	447.513	1.808	50	20	IDGD	
CC(=NNC(=O)[C@H](C)NS(C)(=O)=O)c1c[nH]c2ccc(Br)cc2c1=O	799878623	BWBMLFORCCOXRA-VIFPVBQESA-N	429.296	1.069	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NN=C(Cn3cccn3)C(C)C)CC2)cc1	802713031	ZLBORNBNMHDKJB-UHFFFAOYSA-N	446.577	1.326	50	20	IDGD	
Cc1nc2c3cccnc3nn2c(C)c1CCC(=O)O[C@H](C)C(=O)NNC(=O)CC(C)C	803761286	JUVHWIBCDCZMKJ-OAHLLOKOSA-N	440.504	1.952	50	20	IDGD	
Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCC(C(=O)NNc2cccc(F)n2)CC1	804768405	BBPXXSIYPYBKKY-UHFFFAOYSA-N	437.453	1.981	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc2c(c1)C(=O)CC(C)(C)O2	806973741	VFINASLIMLJDNG-UHFFFAOYSA-N	441.440	1.604	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)N2CCN(C)CC2)cc(C)c1OCC(=O)N1CCCCC1	807382800	PXWRDIQZBJADEB-UHFFFAOYSA-N	431.537	1.297	50	20	IDGD	
CCc1nnc(NC(=O)[C@H](C)[C@@H](C)NC(=O)NNc2cccc(S(C)(=O)=O)c2)s1	807566534	XRXVGXSWMIEOJR-GHMZBOCLSA-N	440.551	1.793	50	20	IDGD	
O=C(Cc1cc(O)nc(O)n1)NN=Cc1cc(I)cc([N+](=O)[O-])c1	811642657	BCOTYINDYXPXBK-UHFFFAOYSA-N	443.157	1.093	50	20	IDGD	
COC(=O)c1cn(-c2cccc(NC(=O)NNC(=O)c3ccc4c(c3)OCCO4)c2)nn1	812977690	NZXPGEAHRVXSLE-UHFFFAOYSA-N	438.400	1.292	50	20	IDGD	
CN(C)CCc1ccccc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	813033789	LJKKAYPYEHGXJX-UHFFFAOYSA-N	433.534	1.123	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)[C@H](O)c1ccc(Cl)cc1	813467407	GOLUHPRMLPHMOZ-QGZVFWFLSA-N	425.894	1.538	50	20	IDGD	
COC(=O)c1ccc(C(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)[nH]1	814266451	JVKSICUJRDADHF-UHFFFAOYSA-N	445.439	1.578	50	20	IDGD	
CCOC(=O)c1cc(COC)cc(NC(=O)C(=O)NNC(=O)c2cccc(N(C)C)c2)c1	815565511	QZQISHWXLNNXFB-UHFFFAOYSA-N	442.472	1.475	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cc(OC)c(C)c(OC)c2)cc1	815566247	NEXITJRNCZKEAM-AWEZNQCLSA-N	445.472	1.964	50	20	IDGD	
CC(=O)N1CCN(Cc2ccc(NC(=O)C(=O)NNc3cccc(Cl)n3)cc2)CC1	815727397	WOZRDQBNBBFYOX-UHFFFAOYSA-N	430.896	1.481	50	20	IDGD	
COC(=O)c1cc(NNC(=O)CCNS(=O)(=O)c2ccc(C(C)=O)cc2)ccc1C	816688599	XZBYICUYWGUIDU-UHFFFAOYSA-N	433.486	1.796	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)[C@@H]1CSCN1C(=O)OC(C)(C)C	817054184	XLKCWPNILBMIMF-ZDUSSCGKSA-N	430.552	1.690	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C[C@@](O)(c2nccn2C)C(F)(F)F)cc1	818649173	LPWFCRQSQQRTPU-KPZWWZAWSA-N	444.410	1.574	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCC[C@@H](c3nnc4n3CCCCC4)C2)n1	911584050	RTDJXIMKRBNFMF-OAHLLOKOSA-N	431.566	1.339	50	20	IDGD	
O=C(NNC(=O)C1(c2ccc3c(c2)OCCO3)CCCC1)c1ccc(-n2cnnn2)cc1	914406139	PJBGPEGVFIFTLW-UHFFFAOYSA-N	434.456	1.707	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)NCC(=O)Nc2ccc3nc(O)[nH]c3c2)c1C	914757431	NQMXOCARTNLCGB-CXUHLZMHSA-N	436.472	1.995	50	20	IDGD	
O=C(NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)Nc1ccc([N+](=O)[O-])cc1	915876717	JREJRWZNKQCUDZ-UHFFFAOYSA-N	433.446	1.846	50	20	IDGD	
NS(=O)(=O)c1ccc(CCNC(=O)NNC(=O)CC23CC4CC(CC(C4)C2)C3)cc1	915883595	AYIHIZVDUFDVRP-UHFFFAOYSA-N	434.562	1.813	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NC[C@@H](c2cccc(F)c2)N(C)C)nc1	915901093	NJHWJJMDKKUTJZ-KRWDZBQOSA-N	438.529	1.836	50	20	IDGD	
CCN(CC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)CC(=O)Nc1c(F)cccc1F	916145442	OUIANPIYKDZUFZ-UHFFFAOYSA-N	435.387	1.595	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)N[C@H](CN2CCOCC2)c2ccccc2)cc1C	916216866	UKAZKCMXPZNRPC-HXUWFJFHSA-N	439.516	1.646	50	20	IDGD	
CCN(CC)[C@@H](CNC(=O)NNC(=O)c1sc(N2CCOCC2)nc1C)CC(C)C	916258588	GMQPHONHGOFELA-MRXNPFEDSA-N	440.614	1.989	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)NC[C@H](c1cccc(C)c1)N1CCOCC1	916436193	XETKHNAABPOMCK-LJQANCHMSA-N	442.516	1.786	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)CCCc2nc(-c3cccs3)no2)c2ccccc2c1=O	917387264	JPQADBNHMBLKGF-UHFFFAOYSA-N	438.469	1.829	50	20	IDGD	
CCOC(=O)c1c(S(=O)(=O)NNC(=O)c2ccc(F)cc2Br)n[nH]c1C	917753769	OWCSUIKISRWPJD-UHFFFAOYSA-N	449.258	1.420	50	20	IDGD	
O=C(CCN1CCOCC1)Nc1cccc(CNC(=O)NNC(=O)c2ccccc2)c1	918092349	VLGCGRYGOCGLJO-UHFFFAOYSA-N	425.489	1.492	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCc2cn3cc(C)ccc3n2)nc1	918129426	FRYUAAALRWXNOS-UHFFFAOYSA-N	431.522	1.895	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21	919820617	SWIIZIPDPSDTEU-UHFFFAOYSA-N	428.401	1.682	50	20	IDGD	
C=CCOc1c(Br)cc(C=NNC(=O)N[C@@H]2CCS(=O)(=O)C2)cc1OC	920383539	FQMQZGDUDDHEKM-GFCCVEGCSA-N	446.323	1.843	50	20	IDGD	
C[C@H](CO)NC(=O)/C(C#N)=C/c1cn(CCC(N)=O)nc1-c1ccc(Br)cc1	920853206	LOMUULVLRCGNJU-ZBQKXELDSA-N	446.305	1.592	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2ccc(C(=O)NNC(=O)NCc3ccco3)cc2)C[C@H](C)O1	920857420	JVPQZIAZRMSEBK-KBPBESRZSA-N	436.490	1.222	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)Nc2cccc(CN3C(=O)CNC3=O)c2)c1	920930531	NZLNBOUPMRXRLY-UHFFFAOYSA-N	425.445	1.587	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cc(Br)cs2)cc1	921301912	OAXDWXLXJLPLSL-UHFFFAOYSA-N	446.348	1.901	50	20	IDGD	
CSCC[C@H](C(=O)NNc1nncc(N)c1Cl)N1C(=O)[C@@H]2CCCC[C@H]2C1=O	1116297420	MXBJDHLKAYFDLT-CKYFFXLPSA-N	426.930	1.452	50	20	IDGD	
NC(=O)c1ccc(/C=C\C(=O)N2CCC[C@H]2C(=O)NNC(=O)c2ccccc2Cl)cc1	1317965709	XONLAZDFNJQGBE-DVESRUBUSA-N	440.887	1.904	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=S)Nc2ccccn2)sc1Br	1332496482	GPFCPNQCMVIAMH-UHFFFAOYSA-N	436.338	1.184	50	20	IDGD	
Cc1cc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c(C)n1CC1CC1	1338575911	UZKSLKUCUAYDGX-LJQANCHMSA-N	427.457	1.659	50	20	IDGD	
O=C(NC[C@H]1CC(=O)N(Cc2ccccc2)C1)NNC(=O)c1nnc(O)c2ccccc12	1341214132	FOHGQNCOVDEYMC-OAHLLOKOSA-N	434.456	1.328	50	20	IDGD	
Cn1ncc2cc(C(=O)N3CC[C@]4(C3)CN(C(=O)[C@@H](F)Br)CCO4)ccc21	1778021555	UFFPGBGEMPPBIY-QAPCUYQASA-N	439.285	1.707	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H]3CCC[C@@H]3C)C2)C1	1778337306	FMEZPRHIWQHCLV-YWVMQHCTSA-N	429.521	1.387	50	20	IDGD	
COCc1oncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCBr)C2	1778342597	UZMHHFLOGZBUCN-CRAIPNDOSA-N	444.326	1.734	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4c(c3)CC(=O)N4)C2)C1	1778391841	DDHQYCXPHYKTIC-BUXKBTBVSA-N	436.306	1.408	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CO[Si](C)(C)C)C2)nn1	1779545289	AQXBKRDQYLDHCR-OXQOHEQNSA-N	436.585	1.464	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3c(F)cncc3F)C2)C1	1779731707	FJIRPANFPRPYTP-GTNSWQLSSA-N	432.265	1.977	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc([N+](=O)[O-])[nH]1)C2)[C@@H](F)Br	1780773668	LKSTVOSNBTXLFP-AXAPSJFSSA-N	447.261	1.741	50	20	IDGD	
C[C@@H](Oc1ccccc1)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781332660	ISKPXSFQJWMJAW-QIIPPGSGSA-N	429.286	1.974	50	20	IDGD	
O=C(c1cncc2cnccc12)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781334154	MNUKKXZCZKSFFP-QAPCUYQASA-N	437.269	1.764	50	20	IDGD	
COc1cc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](C)Br)C2)n(C)n1	1781996185	DPVDEULBTJMLIO-RVZJWNSFSA-N	443.342	1.340	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)n2cncn2)C1	1782526017	LPARNAGFURCRDA-BASYENTBSA-N	442.358	1.384	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cc(O)nc(O)c3)CCO2)C1	1783343518	VBOPSTWKFDAGDL-SJKOYZFVSA-N	428.283	1.110	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1CCN1C(=O)OC(C)(C)C)CCO2	1783871951	XAMSFKFQBAAPHL-AVYPCKFXSA-N	445.944	1.080	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(F)n3)C[C@@H]21	1783969478	GQDFKYWZARFYFW-OSFYFWSMSA-N	428.302	1.845	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc(O)cn3)C[C@@H]21	1783974275	KILXMRRDJUPTFU-PYTWLRIVSA-N	440.338	1.340	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21)c1ncn(-c2ccccc2)n1	1787586230	KHVSRIHBUIVBIH-QEJZJMRPSA-N	438.315	1.664	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)C(Cl)Cl)CCC2)cc1)c1cc(=O)n2[nH]cnc2n1	1788139802	ZSQVCAKFBXIJJA-UHFFFAOYSA-N	435.271	1.969	50	20	IDGD	
O=C(CCc1cnccn1)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1	1788149502	ZVHQAEYWICWCPZ-UHFFFAOYSA-N	444.300	1.537	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4nncn4c3)C[C@@H]21	1788764566	NWWAEORTHBDODK-ULQDDVLXSA-N	431.569	1.174	50	20	IDGD	
C[C@H](C(=O)Nc1ccc(C2(NC(=O)CCC(=O)NN(C)C)CCC2)cc1)N1C[C@H]2C[C@@H]2C1	1789446111	YSLGNZIEDVMAMJ-KZNAEPCWSA-N	441.576	1.834	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1ccc(C2(NC(=O)c3ncccn3)CCC2)cc1	1789521358	ZRGKLPQGCONKSG-UHFFFAOYSA-N	431.456	1.537	50	20	IDGD	
C[C@H](Cc1ccncc1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21	1790579545	ZRPGNTSJWNSSMY-VFTHGPRRSA-N	442.329	1.930	50	20	IDGD	
Cc1cc(/C=C/C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](C)Br)[C@H]3C2)no1	1791056355	VGEOQSBJSOUGFN-HGHKQEFQSA-N	426.311	1.759	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)CBr)C[C@@H]21	1791249120	FIPQKUXTHBCVTK-QMVSFRDZSA-N	425.751	1.251	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C[C@@H]3COc4ccccc4O3)C[C@@H]21)C(Cl)Cl	1791292561	KRAMKOUZMJZWIS-LOUJCGABSA-N	443.327	2.000	50	20	IDGD	
COc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)CBr)c(O)c1	1792872364	BFIRYTOYUNVSFF-KOFHJDLBSA-N	441.322	1.635	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCl)c1ccc([N+](=O)[O-])c2c1OCO2	1793113432	JIRMKGYPRJRXLX-MIJXAVMKSA-N	425.825	1.175	50	20	IDGD	
COc1ncccc1CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)Br)C2	1794098397	ZSJMSIAFDQSVPM-FAYQHZLMSA-N	440.338	1.396	50	20	IDGD	
Cc1ccc(CCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)cn1	1794322725	VXMLBFWBHDIAOG-BCDXTJNWSA-N	436.516	1.273	50	20	IDGD	
CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCBr)C(=O)OC(C)(C)C	1795112535	NBCHUOGUDHQMMX-YWVIFJGQSA-N	448.358	1.228	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CO)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCBr	1795492758	YNLHWSJZSKPYGO-CRWXNKLISA-N	448.358	1.295	50	20	IDGD	
Cc1ccccc1NCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2	1795698000	VCYAUMZJAQSHJI-RMHZUWNSSA-N	428.302	1.687	50	20	IDGD	
CC(C)(O)CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1795793074	ODTJEEXPUIDZKL-XGUBFFRZSA-N	431.961	1.918	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cscc1C)C2	1796440610	UWKABOUDBYVDKU-SNOXVSQISA-N	443.529	1.394	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1Cc2ccccc2O1	1797226864	DPYUQVLVPJPYAJ-CRCOGDFISA-N	437.334	1.753	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(C)nc1OC	1798248630	QZDLJLFIPHTNOB-OCVGTWLNSA-N	440.338	1.775	50	20	IDGD	
C[C@H]1CCc2c(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3cnccc3C(=O)NN)n[nH]c21	1798440719	WFZHAYPWYLYADX-FQUUOJAGSA-N	437.504	1.024	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc(S(C)(=O)=O)cc1)C2	1799266089	UOHGWDVSVIBVMJ-HIRMHNASSA-N	442.965	1.240	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(Cl)c(F)cc1F)c1ccc(B(O)O)cc1	1800317615	XGDRKMAERRIPOT-QDMKHBRRSA-N	448.662	1.864	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccnc(OC)c1F)C2	1800639688	MDBPQAGGOSQLOC-NDPMZMCLSA-N	444.301	1.606	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccc2c(c1)CCO2	1800688272	XZNHZEURKRDRIY-OPMZPASUSA-N	432.593	1.605	50	20	IDGD	
COc1cc(OC)cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)Br)c1	1800760664	ZHASRXFVGBQCTB-DPYKFYPSSA-N	441.322	1.690	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Br)C3)C1	1800967209	BVKKVTZPAYMMRZ-ZLCQRPCESA-N	449.317	1.246	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1(c3ccc(F)c(F)c3)CC1)C2	1800977380	NRQFTJDSUHSDGA-ZFHGCVPZSA-N	442.890	1.840	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)Oc1cccnc1	1801396578	WKLTTWUTNWATMU-WVCIDPQESA-N	440.338	1.470	50	20	IDGD	
CN(C)C(=O)NCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C(C#N)=C/c1ccc(F)cc1F	1801432216	HVZMYROXCFVSJK-FZBFXSHXSA-N	445.470	1.781	50	20	IDGD	
COC[C@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCn1c(=O)oc3ccccc31)C2	1802273866	NRTPQLMKCMVMMT-FZKCQIBNSA-N	435.908	1.877	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@@H](CNC(=O)c2cnnn2C)[C@@H]1c1cccnc1	1804740583	WMQADRXDKBIOEQ-INWMFGNUSA-N	435.326	1.561	50	20	IDGD	
O=C1COc2ccc(C(=O)N3CCC4(CCCN(C(=O)[C@H](O)CCl)C4)CC3)cc2N1	1805524612	VVHAQIRUAAZYIB-MRXNPFEDSA-N	435.908	1.462	50	20	IDGD	
CN1N=C(C(=O)N2CCCC3(CCN(C(=O)[C@@H](F)Br)CC3)C2)CCC1=O	1806623577	ZISVQXTVHYNLIF-CQSZACIVSA-N	431.306	1.516	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)S)[C@H]1c1cccnc1	1808416872	SFSSNBWMGZMURH-BZFSXQLWSA-N	442.545	1.540	50	20	IDGD	
C[C@H](C(=O)N1CCC2(CCCN(C(=O)CCBr)C2)CC1)N1CCN(C)CC1	1809070336	ZWGYXRMGNHOSPU-QGZVFWFLSA-N	443.430	1.639	50	20	IDGD	
C[C@@H]1CCC[C@@H]1C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1809656109	HXGKUWTZKQPILH-MWRLGJARSA-N	435.333	1.517	50	20	IDGD	
CC(C)N[C@@H](C(=O)N1CCCC2(CCN(C(=O)c3ccc(B(O)O)cc3)CC2)C1)C(C)C	1809941148	BSZAQDUAZGANIQ-OAQYLSRUSA-N	443.397	1.234	50	20	IDGD	
CCc1cc(C(=O)NC[C@@H]2CCN(C(=O)[C@H](Cl)COC)[C@@H]2c2cccnc2)n(C)n1	1810922405	SGQJTVWANPJHFD-KVSKMBFKSA-N	433.940	1.951	50	20	IDGD	
Cc1cccc(CC(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2ccc(B(O)O)cc2)CC3)c1	1813907201	VSQIDMIXXZYNIX-GOSISDBHSA-N	449.341	1.600	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1	1817470155	KXKVLLPPADBXNW-NVXWUHKLSA-N	432.717	1.803	50	20	IDGD	
CC(C)[C@H](S)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1	1817470235	MYWMFPDAPLODTH-WMZOPIPTSA-N	430.339	1.350	50	20	IDGD	
CC1=C(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)[nH]n2)CCO1	1817696599	QAOONNUTROQRFT-KRWDZBQOSA-N	439.476	1.408	50	20	IDGD	
CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](F)Cl)n[nH]1	1818044193	VEUDZJKSFXICCU-YCPHGPKFSA-N	439.879	1.407	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2nc[nH]c2[N+](=O)[O-])n[nH]1	1818078944	RQVMHDZMCKQTNI-KOLCDFICSA-N	425.833	1.601	50	20	IDGD	
COC(C)(C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)n[nH]1	1818110867	REMKFUPXZWYRJJ-ANDSAHIGSA-N	443.508	1.961	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCN2CCOC2=O)n[nH]1	1818850382	TWOVKHQDQRIDAL-JSGCOSHPSA-N	427.889	1.498	50	20	IDGD	
Cc1cnc2c(C(=O)Nc3nc4c(s3)C[C@@H](NC(=O)[C@@H](O)CCl)CC4)cnn2c1	1819086119	ROIOMAZHNZHQBF-GWCFXTLKSA-N	434.909	1.320	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ncccc2F)[nH]n1	1822415211	WVQYTPVLHGFKGR-HNNXBMFYSA-N	431.472	1.623	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(O)nc(O)n1)CC2	1822863067	FRQLIIBPDZHTBB-VGDKGRGNSA-N	446.316	1.806	50	20	IDGD	
CCOC(=O)C1(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@H](Cl)COC)CC3)CC1	1824869651	YBNPZDGVRLQNGL-WDEREUQCSA-N	429.926	1.652	50	20	IDGD	
CC[S@](=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](C)Br)sc2C1	1825643055	XSCPBHCPHBLTDY-MZEXLTETSA-N	436.397	1.997	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnn3ccncc13)CC2	1826000636	ZFQKKUFOOFVQPE-CMPLNLGQSA-N	434.909	1.665	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)CCn3cncn3)sc2C1	1826611224	QMUMHNQRFJPHJX-ZJUUUORDSA-N	427.328	1.520	50	20	IDGD	
O=C(/C=C/c1cccnc1)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827056573	YTQPKUPNBUMSMR-ZUTVHTERSA-N	447.344	1.708	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)C2=COCCC2)CC1	1828926082	YAJBMQYHTCIKHR-HXUWFJFHSA-N	441.532	1.613	50	20	IDGD	
C#CC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](Cl)COC)CCN2C(=O)OCc1ccccc1	1829341109	XADVSUTXZKKWPM-PGRDOPGGSA-N	447.919	1.326	50	20	IDGD	
C[C@@H](Cc1ccncc1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830365184	BHFFBAPFJPEVFS-JTSKRJEESA-N	437.968	1.982	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)[C@@H](O)CCl)CC2)nc2nccn12	1830925810	CVIXWSYWQYPALY-MSOLQXFVSA-N	433.940	1.871	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(CC)n(C)n3)C2)C1	1831653709	CXNVYJCKEMYQQD-JXFKEZNVSA-N	426.945	1.460	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H](C)CS(C)(=O)=O)CC1	1831827735	JLHMQLITXCRJFD-BHYGNILZSA-N	437.002	1.541	50	20	IDGD	
CN(C)c1cccc(OCC(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)c1	1832526931	GVQBQONRMVXVAI-UYAOXDASSA-N	443.903	1.122	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3cccc(OC)n3)CCO2)C1	1832762759	GHSDOBIBMSFWJE-UWJYYQICSA-N	439.940	1.497	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)[C@H]2CCCOC2)CC1	1832868690	VJWTWMGMVIWSOE-FPOVZHCZSA-N	428.338	1.026	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H]3CCc4ccoc4C3)CC2)CC1)[C@H](O)CCl	1833305856	AFZSUAMKVFOOLL-VQIMIIECSA-N	437.968	1.556	50	20	IDGD	
Cc1nc(C(=O)N2CCO[C@@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)ccc1F	1833459340	STKMCPHERLPRDS-FQEVSTJZSA-N	427.904	1.864	50	20	IDGD	
C=CCO[C@H](C)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)Br)CC2)CC1	1833477103	UJDFKOAANCZYAN-HUUCEWRRSA-N	430.387	1.933	50	20	IDGD	
CC[C@H](C)[C@@H](O)C(=O)NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1	1833496456	BOQXIGSCADZIRF-KBXCAEBGSA-N	432.403	1.750	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)c3ccccc3F)C2)C1	1834824162	UHBRBXNSIDPCFY-GOSISDBHSA-N	429.286	1.681	50	20	IDGD	
CC(=O)N[C@H](C(=O)N1CCC(N2CCC(NC(=O)[C@@H](F)Cl)CC2)CC1)C(C)(C)C	1835079380	VIHKNXMPABQZER-IAGOWNOFSA-N	432.968	1.643	50	20	IDGD	
Cc1ocnc1C(=O)NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1836008873	COHIOVQBGLLAOL-OAHLLOKOSA-N	431.306	1.859	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C1(C(F)(F)F)CC1)CCO2	1836720872	WLBCUMJPVUTYIU-BXUZGUMPSA-N	443.260	1.569	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)C(OC)OC)CC2)CC1	1836790513	JGWIVWDFFIAKGQ-HNNXBMFYSA-N	435.359	1.777	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)C#CC3(O)CCCCC3)CCO2)C1	1837486594	KKWSHWWEKDYLJE-JOCHJYFZSA-N	440.968	1.406	50	20	IDGD	
O=C(c1ccc(=O)oc1)N1CCC(OC2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1837589052	DOKSTSXVXFOOCU-MRXNPFEDSA-N	445.285	1.943	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccnc(Cl)c3)C2)C1	1837712444	RJRJJEKENLDFEJ-IBGZPJMESA-N	441.988	1.657	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccccc3)CCO2)C1	1838852441	LTJSMHXOXPSHQI-LPHOPBHVSA-N	425.323	1.930	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(C)ccc3O)CCO2)C1	1838894428	SIYCHQDHQOTTCJ-UZLBHIALSA-N	426.897	1.024	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C(C)(C)C)n[nH]3)C2)C1	1839145437	HPMKWSSRTMYMEN-XOBRGWDASA-N	426.945	1.795	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3c(OC)cccc3OC)C2)C1	1839145838	FMLMHPKMTFMAEW-BTYIYWSLSA-N	440.924	1.791	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(O)cn3)C2)C1	1839151125	IVNDYTNGKRNXFE-QZTJIDSGSA-N	432.304	1.094	50	20	IDGD	
Cc1nc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)ccc1F	1839151384	PNLMPVZRXKCHRG-MOPGFXCFSA-N	448.322	1.835	50	20	IDGD	
C=C(C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)CBr)C2)C1)C(F)(F)F	1839891071	JWVPBXUNUNFCGL-IAQYHMDHSA-N	443.260	1.592	50	20	IDGD	
Cc1noc(C)c1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)Br)CCO2	1840031653	YHKHAGRLIQOIMR-APPDUMDISA-N	430.299	1.145	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3c(F)cccc3F)C2)C1	1840034433	LAIQXMWBRFGBMT-SGTLLEGYSA-N	447.276	1.818	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(F)c3F)C2)C1	1840154070	KLBUHOSBANLVLP-IFXJQAMLSA-N	432.851	1.289	50	20	IDGD	
CCc1[nH]nc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)c1Cl	1840188007	JSYJONSCDCOJQH-INIZCTEOSA-N	439.727	1.499	50	20	IDGD	
COc1ccc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)cc1	1840188256	ZJVDFZYNOJYVCP-LJQANCHMSA-N	431.316	1.498	50	20	IDGD	
C[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1)n1cccc1	1840353488	KEFYJEPOWQEFSM-JKIFEVAISA-N	432.290	1.196	50	20	IDGD	
C[C@H](Sc1ccccn1)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1840390668	FKFZOFRXGZRTIE-DHSIGJKJSA-N	431.917	1.553	50	20	IDGD	
C=CCC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1	1841352980	XOGVEUMZCUUFAY-CABCVRRESA-N	429.945	1.649	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2ccc3c(c2)COC3)C1	1843753964	IULONESFJDAXAC-MFKUBSTISA-N	435.484	1.668	50	20	IDGD	
CCOC(=O)c1ncn2c1CC[C@H](C(=O)N1CCCC13CN(C(=O)[C@H](F)Cl)C3)C2	1845862477	ULUJWUZFPKSRJD-WFASDCNBSA-N	426.876	1.360	50	20	IDGD	
O=C1COc2ccc(Cl)cc2N1CC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](F)Cl	1848034840	RWZGHIGJDKMRFA-PRXAMGSTSA-N	430.263	1.802	50	20	IDGD	
O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)NNC(=O)C(=O)NC1CC1	10214953	CVJRFAZCESJKNN-UHFFFAOYSA-N	448.439	1.416	50	20	IDGD	
CC1(C)CC(=O)c2cc(C(=O)NNC(=O)c3nn(-c4ccccc4)cc3O)c(=O)[nH]c2C1	111162862	IUZBLHWJMDNHSZ-UHFFFAOYSA-N	435.440	1.496	50	20	IDGD	
CN(C(=O)OC(C)(C)C)[C@H]1CCCN(CC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)C1	725815198	ZVAJMNDLVDNQMM-INIZCTEOSA-N	435.481	1.687	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)cc1S(=O)(=O)NCC#N	726883903	OKKDEJYTJPGQGA-CYBMUJFWSA-N	434.449	1.165	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCO[C@@H](c3ccc(F)c(F)c3)C2)cc1OC	727438241	YNNZUIOTZQCPPZ-LJQANCHMSA-N	435.427	1.817	50	20	IDGD	
CNS(=O)(=O)c1cccc([C@H](C)NC(=O)NNC(=O)c2cc(Br)c[nH]2)c1	727608369	PCCNRDKCLMEHST-VIFPVBQESA-N	444.311	1.391	50	20	IDGD	
CNS(=O)(=O)c1cccc([C@@H](C)NC(=O)NNC(=O)COc2cc(C)cc(C)c2)c1	727608566	AFLYNRSCICVGEI-OAHLLOKOSA-N	434.518	1.682	50	20	IDGD	
Cn1c(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc(Cl)c1Cl	728322538	JDMQHHIDYFWEKN-ZDUSSCGKSA-N	428.228	1.476	50	20	IDGD	
COC(=O)c1cccc(S(=O)(=O)NNC(=O)c2cc(OC)ccc2Br)c1	728508391	PJTGIRFZLWJEOX-UHFFFAOYSA-N	443.275	1.868	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)Cc2c(C)nc3c(c(C)nn3C)c2C)n1	728728694	ZOQVVXGRGPMNDL-UHFFFAOYSA-N	444.517	1.134	50	20	IDGD	
CCCS(=O)(=O)Nc1ccc(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1	728890398	PAWGZSOSFIRYDU-UHFFFAOYSA-N	446.533	1.306	50	20	IDGD	
CC(C)[C@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)N1CCCCC1	729295118	BRRNUZCJPRRETB-LJQANCHMSA-N	436.578	1.743	50	20	IDGD	
O=C(CSc1nnnn1CC(F)(F)F)NNC(=O)c1ccc(Br)s1	729966846	UKCCYCSPAJFDPC-UHFFFAOYSA-N	445.246	1.613	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2cc(Cl)ccc2O)nnn1-c1ccc2c(c1)OCCO2	731454256	ZEFGZDPOIXZCMP-UHFFFAOYSA-N	429.820	1.781	50	20	IDGD	
Cc1c(C(=O)NNc2nc(-c3ccncc3)no2)nnn1-c1cccc2c1CCN(C)C2	731809215	RAIRGBPSKXZHKU-UHFFFAOYSA-N	431.460	1.766	50	20	IDGD	
O=C(COC[C@H]1CCCO1)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	733251508	XLYYXIAPQRHDNL-QGZVFWFLSA-N	436.468	1.401	50	20	IDGD	
CN(C)N(C(=O)c1nn(-c2ccccc2C(F)(F)F)cc1O)[C@@H]1CCS(=O)(=O)C1	733371358	WUEHLUZDZSBTAZ-LLVKDONJSA-N	432.424	1.703	50	20	IDGD	
COc1ccccc1C1(C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)CC1	735117674	FSQCZWULSMCCND-UHFFFAOYSA-N	445.545	1.201	50	20	IDGD	
CCc1cc(CNC(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)n[nH]1	739023538	GJNAISIVRNBJAG-UHFFFAOYSA-N	448.530	1.979	50	20	IDGD	
Cc1noc(C)c1C[C@@H](C)NC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	739050739	YCBHMYAGSKTXGK-CYBMUJFWSA-N	449.533	1.651	50	20	IDGD	
COc1ccc(S(=O)(=O)CCC(=O)NNC(=O)c2c(C)nc3ccccn23)cc1OC	740815519	OSSADDRGUOTNMK-UHFFFAOYSA-N	446.485	1.285	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)N[C@@H](Cn2cccn2)c2ccccc2)c2ccccc2c1=O	741426872	QWXAWRAQIZGARV-SFHVURJKSA-N	431.456	1.516	50	20	IDGD	
O=C(CN1C(=O)[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)NNc1c(F)cc(F)cc1Br	741978481	JOSYZSSWILVQMJ-WKYFLPQNSA-N	426.217	1.978	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)[C@H](C(CC)CC)N2CCOCC2)c2ccccc2c1=O	742034232	GKRKYWWRCVSESH-FQEVSTJZSA-N	443.548	1.705	50	20	IDGD	
CC(C)c1ccc(-n2cc(O)c(C(=O)NNC(=O)CCN3C[C@H](C)O[C@@H](C)C3)n2)cc1	743292060	WHOOFWLCHSYDGE-HOTGVXAUSA-N	429.521	1.962	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)Nc3ccc(S(C)(=O)=O)cc3)n[nH]2)cc1	743805140	JCPMOKAYDCGNKT-UHFFFAOYSA-N	429.458	1.955	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@H]2CC(=O)N(c3ccc(F)cc3)C2)cc1	743830895	MMTUWFVDRGPVDM-LBPRGKRZSA-N	434.449	1.435	50	20	IDGD	
CCN(CC(=O)NNC(=O)c1cccc(C#N)c1)CC(=O)Nc1ccc(NC(C)=O)cc1	744384276	LESFTQPTBVSLTN-UHFFFAOYSA-N	436.472	1.238	50	20	IDGD	
Cn1cc(N2CC[C@@H](NC(=O)NNc3c(F)cc(F)cc3Br)C2=O)cn1	745830545	AZJQXISCUQHEOT-GFCCVEGCSA-N	429.225	1.892	50	20	IDGD	
CCO[C@@H]1C[C@H](NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)C12CCC2	745851333	OVLVBSUVSLIKEX-VQTJNVASSA-N	429.565	1.877	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1)[C@@H]1CCOC1	745861043	HXFJAZCNCCVHAL-CRAIPNDOSA-N	446.529	1.534	50	20	IDGD	
CC[C@@H]1Oc2cc([C@H](C)NC(=O)NNC(=O)CNC(=O)c3ccco3)ccc2NC1=O	745933197	UUJWFELGHFXJDF-FZMZJTMJSA-N	429.433	1.211	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)NCC(=O)N2CCC(Cc3ccccc3)CC2)cc1	746775020	BLTIFABYUIEYPJ-UHFFFAOYSA-N	449.511	1.749	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2ccc(Cl)cc2F)cc1	747489527	NZMWIRZTAGFBHJ-UHFFFAOYSA-N	428.873	1.874	50	20	IDGD	
Cc1nc(Cl)cc(NNC(=O)C2CCN(C3=NS(=O)(=O)c4ccccc43)CC2)n1	748335591	PEZPFKMAJMICOL-UHFFFAOYSA-N	434.909	1.743	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)NCCCN1CCN(c2ccncc2)CC1	748466485	ZCXFGMOOQWCVHZ-UHFFFAOYSA-N	440.548	1.566	50	20	IDGD	
O=C(CN1CCC[C@@H](CNC(=O)c2ccccc2)C1)NNC(=O)c1ccc([N+](=O)[O-])cc1	748835859	MXCPJAXZKBUJAF-INIZCTEOSA-N	439.472	1.498	50	20	IDGD	
COc1ccc([C@@H](C)CC(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1	749867126	ZPJIEEMJZALQSC-NSHDSACASA-N	425.894	1.951	50	20	IDGD	
CCN(CC)C(=O)[C@H](NNC(=O)Cc1csc(N2CCOCC2)n1)c1ccccc1	750198694	UWWWGIMOLZIWPD-LJQANCHMSA-N	431.562	1.753	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)CCC(=O)c2ccc(OC)c(F)c2)c2ccccc2c1=O	751296829	BRWLEDYDERETCL-UHFFFAOYSA-N	440.431	1.988	50	20	IDGD	
COC(=O)C1(CNC(=O)NNC(=O)COc2ccc(Br)cc2)CCCC1	752021856	VYUWUEMTOLPQON-UHFFFAOYSA-N	428.283	1.892	50	20	IDGD	
COc1cc(OC)cc(N2C[C@@H](C(=O)OCC(=O)NNC(=O)c3cccs3)CC2=O)c1	752581166	QGHOXUBTNMJYEZ-LBPRGKRZSA-N	447.469	1.123	50	20	IDGD	
CCc1cc(Br)ccc1NNC(=O)C1=CC=CN2CCS(=O)(=O)N=C12	753184436	HHYWZNCKESXDNW-UHFFFAOYSA-N	425.308	1.952	50	20	IDGD	
COc1ccc2c(c1)CC[C@@H](NC(=O)NNc1ccc(S(=O)(=O)NC(C)C)cn1)C2	753284668	IAJZTBGSPLISNZ-MRXNPFEDSA-N	433.534	1.961	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)Nc1ccc(N2CCCS2(=O)=O)cc1	755593466	LEVWPBLDBSNKDT-ZDUSSCGKSA-N	436.465	1.986	50	20	IDGD	
NC(=O)COc1cccc(NC(=O)NNC(=O)COc2cccc(C(F)(F)F)c2)c1	755801092	MZINREZHKHEFPS-UHFFFAOYSA-N	426.351	1.801	50	20	IDGD	
CCN1CCN(C(=O)c2ccc(NC(=O)NNC(=O)COCc3ccccc3)cc2)CC1	756254057	ZXXSICTXKHGTIG-UHFFFAOYSA-N	439.516	1.834	50	20	IDGD	
CNS(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@@H](C)Oc2ccc(C(C)=O)cc2)cc1	756639668	BWGAOLHMIUMMKD-CYBMUJFWSA-N	434.474	1.418	50	20	IDGD	
CCCNS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2cncc(NC(C)=O)c2)cc1	756783744	IMEYQNSPTWEUQB-UHFFFAOYSA-N	434.478	1.195	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)c1cncc(N2CCOCC2)c1	756866306	ACIMTPUVBXRAHO-ZDUSSCGKSA-N	449.305	1.909	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)COc2ccc(C#N)cc2)cc1-n1nnnc1C1CC1	757620399	FOLWEMVDLIXYPQ-UHFFFAOYSA-N	448.443	1.652	50	20	IDGD	
COC(=O)c1cc(NC(=O)NNC(=O)c2cccc(Cl)c2)cc(S(C)(=O)=O)c1	757673449	GJLUAZJHUZZRSH-UHFFFAOYSA-N	425.850	1.997	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)N[C@H](CC(N)=O)C2CCOCC2)c(C)n1C[C@@H]1CCCO1	757694883	ZUBUGRHJJFQDQG-LOXQGIHKSA-N	428.533	1.978	50	20	IDGD	
COc1ccc(COCC(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)cc1	758787600	UGCOHFMKPYYICM-UHFFFAOYSA-N	436.509	1.848	50	20	IDGD	
COc1ccc(C(=O)C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1Cl	760454343	LUKXHDYGOIQLPN-UHFFFAOYSA-N	444.919	1.891	50	20	IDGD	
CC(C)(C)C(=O)NNC(=O)C(=O)Nc1ccnn1Cc1ccc(OC(F)(F)F)cc1	761064040	RSVXXLLFSQNDBR-UHFFFAOYSA-N	427.383	1.962	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)NCCOc1ncccc1Cl	761779915	ANVOPWHHEBFJDH-UHFFFAOYSA-N	446.939	1.657	50	20	IDGD	
O=C(NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)N[C@@H]1CCC[C@H]2OCC[C@H]12	761795575	WIBKRWDAOCHIQD-KZNAEPCWSA-N	436.534	1.373	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)N[C@H]1CCCN(c2ccccc2F)C1=O	761816402	MWRPATRVMZNXFL-AWEZNQCLSA-N	431.380	1.579	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(F)cc1OCC(F)F	763471251	FZDZPLYUIMJTSE-UHFFFAOYSA-N	426.307	1.778	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)[nH]n1)C(=O)Nc1ccc(N2CCOC2=O)cc1	763600502	KANKLTSZHTXVDU-UHFFFAOYSA-N	434.412	1.433	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)[nH]n1)C(=O)Nc1cc2c(cc1Cl)OCO2	763601171	PPSZKGMMSBMPHN-UHFFFAOYSA-N	427.804	1.859	50	20	IDGD	
CSc1cnn(-c2ccccc2)c1NC(=O)C(=O)NNC(=O)COc1ccccc1F	763681043	FNRCXWWZNBDLOV-UHFFFAOYSA-N	443.460	1.898	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)C(=O)Nc1ccccc1OC[C@H]1CCCCO1	763681537	VJGQBBKEGATMFC-OAHLLOKOSA-N	445.447	1.939	50	20	IDGD	
Cc1ccnc(-c2cccc(NC(=O)C(=O)NNC(=O)COc3ccc(C#N)cc3)c2)n1	763681940	PUNMGGVWOUMJSL-UHFFFAOYSA-N	430.424	1.489	50	20	IDGD	
CCCN1Cc2cccc(NC(=O)C(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)c2C1	763791464	SKHGRZFYFJYSPX-UHFFFAOYSA-N	448.483	1.059	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)C(=O)N(C)C3=O)c1C	763848439	HSDCTDLKJMIWOG-CYBMUJFWSA-N	438.440	1.083	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1cccnc1OCC(F)F	763867490	VSLIZQGCRAOCNE-JTQLQIEISA-N	426.351	1.418	50	20	IDGD	
CCN1CCc2ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc3ccc(C(C)=O)cc3)cc21	763879590	YYZQMCIAYFWDAS-OAHLLOKOSA-N	438.484	1.825	50	20	IDGD	
COCCn1cc(NC(=O)C(=O)NNC(=O)c2sc(-c3ccccc3)nc2C)cn1	763901273	MNJOVNXXCAOQMV-UHFFFAOYSA-N	428.474	1.361	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(F)c(NC(C)=O)c2)cc1OC	763910965	AMHSMHYWYJRDMD-UHFFFAOYSA-N	446.435	1.981	50	20	IDGD	
COC(=O)c1sccc1NC(=O)C(=O)NNC(=O)c1ccc(OC(C)C)c(OC)c1	763916332	MPQISVXITJQPDG-UHFFFAOYSA-N	435.458	1.730	50	20	IDGD	
N#Cc1ccc(Cn2cnc(NC(=O)C(=O)NNC(=O)Cc3ccc(Cl)cc3)n2)cc1	763932772	TWPBDLBPVHXIJW-UHFFFAOYSA-N	437.847	1.180	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3ccc(CC(=O)N(C)C)cc3)cc2C1	763940716	HSSZCSCKPQSPHI-ZDUSSCGKSA-N	442.541	1.903	50	20	IDGD	
Cn1ncc(NC(=O)C(=O)NNC(=O)c2ccc(COc3ccccc3)o2)c1C(F)F	763956167	WRELSAMLOKRSRA-UHFFFAOYSA-N	433.371	1.929	50	20	IDGD	
CN(C)c1nnc(-c2ccc(NC(=O)C(=O)NNC(=O)c3cc(Cl)ccc3O)cc2)o1	763974549	RXWCFHDEKQYOPQ-UHFFFAOYSA-N	444.835	1.561	50	20	IDGD	
COC(=O)c1ccc(OC(C)C)c(NC(=O)C(=O)NNC(=O)c2ccc(C)cc2O)c1	764111206	VHQFLVLNZRKHHE-UHFFFAOYSA-N	429.429	1.674	50	20	IDGD	
CC(C)(C)NC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)c1	764126207	FNEZETVVKVOFBL-UHFFFAOYSA-N	432.864	1.974	50	20	IDGD	
Cc1ccc(NC(=O)C(C)C)cc1NC(=O)C(=O)NNC(=O)COc1ccccc1O	764277032	GHQMQIFQEOWXQH-UHFFFAOYSA-N	428.445	1.460	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)C(=O)Nc1cc(Cl)ccc1C(=O)N1CCCCC1	764298011	LUAUFLYCAIUVJB-UHFFFAOYSA-N	432.868	1.397	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C(=O)Nc1ccc(OC)c(NS(C)(=O)=O)c1)c1ccccc1	764328275	NTWNPZCLAIOAMR-HNNXBMFYSA-N	448.501	1.346	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1ccc2nc(-c3ccccn3)oc2c1	764397010	DRCZFOZAJQRADM-GFCCVEGCSA-N	427.417	1.027	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1cccc(NC(=O)c2ccccc2)c1	764397591	AKRGBGRXKSNMCG-CQSZACIVSA-N	428.445	1.076	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C[C@H]2CN(C(=O)OC(C)(C)C)CCO2)o1	765099601	WFMPVNPVVFYKDP-INIZCTEOSA-N	438.525	1.908	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNS(=O)(=O)c3ccc(F)cc3F)CC2)cc1	765124475	AUWXHIIKKJZKTC-UHFFFAOYSA-N	438.500	1.401	50	20	IDGD	
Cc1nnnn1/C(=C\c1ccccc1)C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C	765313309	KJIIKHNCBWHVQC-SSZFMOIBSA-N	429.481	1.432	50	20	IDGD	
CCC[C@@H]1CN(CC(=O)NNC(=O)c2cc(Cl)ccc2OC)CCN1CCOC	766966478	DMHOAJGXZVBLIN-MRXNPFEDSA-N	426.945	1.542	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)c2ccccc2COC2CCOCC2)cc1	768119152	GAWHCDMADSVORY-UHFFFAOYSA-N	437.452	1.872	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(C)c(NC(=O)CCN(C)C)c2)c(C)o1	768233917	PCDCVPZEGFPEHT-UHFFFAOYSA-N	429.477	1.495	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2cncc(NC(C)=O)c2)ccc1OC(C)C	768241268	FQMYDHIGDHLZLF-UHFFFAOYSA-N	429.433	1.236	50	20	IDGD	
CCOc1ccc(CN2C(=O)c3ccccc3C2=O)cc1C(=O)NNC(=O)C(C)(C)O	768243155	FJTYYRTZYWQVRK-UHFFFAOYSA-N	425.441	1.413	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)c1nc(N2CCCC2)ncc1Cl	768630538	TYLADLFRUMSLJY-UHFFFAOYSA-N	425.898	1.899	50	20	IDGD	
O=C(C[C@@H]1C=CS(=O)(=O)C1)NNC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1	769025670	XAMJRDJYLPDDKA-HNNXBMFYSA-N	437.481	1.644	50	20	IDGD	
CC(C)C[C@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	769119664	FWGIHRKSDCJLKR-HNNXBMFYSA-N	427.523	1.791	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)[C@@H]2CC(=O)N(c3c(F)cccc3F)C2)nc2ccccc21	770579351	RVOQXMHWTXZPQD-GFCCVEGCSA-N	427.411	1.595	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)CCC(=O)Nc3nnc(C4CC4)o3)nc21	770966830	BQNATEGLFLXSOE-UHFFFAOYSA-N	429.441	1.409	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)O[C@@H](C)C(=O)NNC(=O)CC(C)C)ccc1C	771931283	FKQHELWODPTLER-HNNXBMFYSA-N	441.550	1.764	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1cc(S(=O)(=O)N2CCCC2)ccc1Cl	771934562	ULAVLWOMAMVDAB-LLVKDONJSA-N	431.898	1.227	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)C1=NN(c2ccccc2)[C@@H](C(=O)OC(C)(C)C)C1	772086107	ADIBSUMHCGKPEM-XJKSGUPXSA-N	432.477	1.452	50	20	IDGD	
C[C@@H]1CN(c2ccnc(C(=O)NNc3ccc(S(=O)(=O)NC4CC4)cc3)c2)C[C@@H](C)O1	772174492	CGFNPYMODQIDDP-HUUCEWRRSA-N	445.545	1.893	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)[C@H]2CCCN(C(=O)OC(C)(C)C)C2)ccc1-n1cncn1	773419057	LVUCHSGTNYOQKZ-INIZCTEOSA-N	428.493	1.984	50	20	IDGD	
C[C@H]1CCCCN1CC(=O)Nc1ccc(F)c(NC(=O)C(=O)NNc2ncccn2)c1	773720399	YATJATLTOXCZGY-ZDUSSCGKSA-N	429.456	1.510	50	20	IDGD	
COC(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)cc1	774001025	DCDGCQICWFIICP-GFCCVEGCSA-N	433.848	1.609	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)NCCC(C)(C)O)cc1	775967250	GJOFZECZDCOQJV-FOWTUZBSSA-N	425.489	1.618	50	20	IDGD	
Cn1cc([C@@H](NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c2ccc(F)cc2)cn1	776194645	ARAVCNGGNBBHBN-SFHVURJKSA-N	449.446	1.540	50	20	IDGD	
CN(NC(=O)c1cc(-c2ccccn2)no1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776201700	LCHUSIHYHDZTPX-UHFFFAOYSA-N	430.465	1.986	50	20	IDGD	
COc1ccc2c(c1)C[C@H](C(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1)CO2	776202748	WRDYMATWFZWCHW-INIZCTEOSA-N	448.520	1.882	50	20	IDGD	
O=C(NCC(=O)N1CCOCC1)NNC(=O)c1ccc(COc2ccc(Cl)cc2)cc1	776638956	BRBRSZDPXIPRKD-UHFFFAOYSA-N	446.891	1.722	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(OCC(=O)OCC(=O)NNC(=O)c2cccs2)CC1	777125479	MUKCDCGRMHVOBP-UHFFFAOYSA-N	441.506	1.468	50	20	IDGD	
CN1CCc2cc(C(=O)NNC(=O)CN3CCN(Cc4ccccc4Cl)CC3)ccc21	778997802	JECUDVINFSDGDO-UHFFFAOYSA-N	441.963	1.911	50	20	IDGD	
CCC1(C(=O)NNC(=O)CCN2C[C@H](C)O[C@H](C)C2)CCN(C(=O)c2ccccc2)CC1	781415067	DTJHPRGEGKEMGU-KDURUIRLSA-N	444.576	1.966	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)[C@@H]1CC(c2ccccc2[N+](=O)[O-])=NO1	781932803	HYUJLOZJKPKKDB-SFHVURJKSA-N	436.428	1.848	50	20	IDGD	
COC(=O)c1ccc(NC(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)c(OC)c1	782079430	CLRHAIUCLCKUGC-UHFFFAOYSA-N	433.417	1.974	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)c2n[nH]c3c2CN(C(=O)OC(C)(C)C)CC3)c1O	782668124	LBQZESNSCUFKEK-UHFFFAOYSA-N	431.449	1.492	50	20	IDGD	
Cc1ccn(-c2ccccc2NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)n1	782884580	COXWNWOQVWFHMA-UHFFFAOYSA-N	431.456	1.396	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1Cl)C(=O)Nc1ccc2c(c1)S(=O)(=O)CC2	782927249	RDFDPQBQKCOBME-UHFFFAOYSA-N	442.280	1.723	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cnc(NC(=O)OC(C)(C)C)cn2)cc1C	783026787	GFFRHVWCYBZNGT-UHFFFAOYSA-N	428.449	1.840	50	20	IDGD	
COc1c(NC(=O)C(=O)NNc2ccc(Br)cc2F)cccc1C(N)=O	783085216	FTDGKIROCKHMKB-UHFFFAOYSA-N	425.214	1.778	50	20	IDGD	
COc1c(Cl)cccc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)NC(C)C)cn1	783264972	VAGCWHUTBNROPF-UHFFFAOYSA-N	441.897	1.512	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2cccc(N3C(=O)c4ccccc4C3=O)c2)nc(C)n1	783327076	XMFRYJGWCOGANC-UHFFFAOYSA-N	430.424	1.976	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2ccc(-c3ncc4n3CCCC4)cc2)CCS(=O)(=O)C1	783428420	VGMFHYMBUZLFCO-HXUWFJFHSA-N	431.518	1.023	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)C(=O)Nc1cccc(Cl)c1SC(F)F	784005072	YXYOWNMWYDSMCR-UHFFFAOYSA-N	446.819	1.764	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)[C@H](F)C(C)C)N(S(C)(=O)=O)CC2	784145065	MWEPGIZTWDXCJH-KBXCAEBGSA-N	445.513	1.094	50	20	IDGD	
N#Cc1ccc(NNC(=O)C(=O)Nc2cc(F)cc(S(N)(=O)=O)c2)cc1C(F)(F)F	784236140	FBMSMDQCPRTORX-UHFFFAOYSA-N	445.354	1.445	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNc2cccc([N+](=O)[O-])c2C)c(C(=O)N(C)C)cc1OC	784358200	REVDSPPUKSCUMA-UHFFFAOYSA-N	445.432	1.704	50	20	IDGD	
CC(=O)N1CCN(Cc2ccc(NC(=O)C(=O)NNc3cccnc3Cl)cc2)CC1	784842441	VPHJKRWIJKNYKX-UHFFFAOYSA-N	430.896	1.481	50	20	IDGD	
COc1cc(OC)c(Cn2nccc2NC(=O)C(=O)NNc2ccnc(F)c2)c(OC)c1	784848629	IPNQWNXLZYNQNX-UHFFFAOYSA-N	444.423	1.573	50	20	IDGD	
Cn1ccnc(NNC(=O)C(=O)Nc2ccc(Br)cc2Br)c1=O	785089523	ANDOWMQFKDJTDY-UHFFFAOYSA-N	445.071	1.387	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNc2nccn(C)c2=O)sc(C)c1C[C@H](C)CC	785090097	NBTQLULMFPIRRN-LLVKDONJSA-N	449.533	1.997	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)C(=O)Nc3nc4c(s3)COCC4)n[nH]2)c1	785125885	IDRZYBDWUQARNT-UHFFFAOYSA-N	440.485	1.622	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)C1CCN(C2CC2)CC1	787438829	FMTAKGRPKRSHEV-UHFFFAOYSA-N	433.984	1.479	50	20	IDGD	
C[C@H]1C[C@@H](C)CN(S(=O)(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)C1	788918728	ZSNOHIHQXAGYOK-GASCZTMLSA-N	433.575	1.318	50	20	IDGD	
CN1C(=O)Cc2cc(NC(=O)C(=O)NNC(=O)c3ccc(F)cc3Br)ccc21	789733839	VJMANKFIAITQRZ-UHFFFAOYSA-N	449.236	1.507	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)Cn2ccc3ccccc3c2=O)CC1	790553081	AVBNFTRMQICMOG-UHFFFAOYSA-N	443.504	1.731	50	20	IDGD	
COc1ccc(OC)c(C2=NO[C@H](C(=O)NNC(=O)[C@H](C)Oc3ccc(F)cc3)C2)c1	792020007	CJBTYGNRXJYWRI-BUXKBTBVSA-N	431.420	1.951	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2OC)c2ccccc2c1=O	792805613	LRJATMMKGPVLOL-UHFFFAOYSA-N	425.401	1.798	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(C)(C)[C@H]1C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	793032970	RRZGMKMOVDETBE-CQSZACIVSA-N	425.507	1.497	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)CCN(C)C(=O)OC(C)(C)C)c2ccccc2c1=O	794776495	XWOKRJXYPKYQLR-UHFFFAOYSA-N	431.493	1.825	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)c2cn3ccc(Br)cc3n2)c1	795195261	GTTQXHMBTZJQAG-UHFFFAOYSA-N	437.275	1.575	50	20	IDGD	
CC(C)c1ncc(NC(=O)C(=O)NNC(=O)COc2ccc(Br)cc2)cn1	796992993	ZQCVTGRRZLZGRP-UHFFFAOYSA-N	436.266	1.527	50	20	IDGD	
N#Cc1cccc(NNC(=O)C(=O)Nc2cnc(N3CCOCC3)c(Br)c2)c1	799260390	UITFJJPFHKIIQX-UHFFFAOYSA-N	445.277	1.634	50	20	IDGD	
CCOC(=O)c1cc(C=NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)[nH]c1C	799465022	WGNUWBOWMLFPFD-UHFFFAOYSA-N	448.501	1.285	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)NCCN2CCN(C)C(C)(C)C2)N(C)c2ccccc21	799743440	GVTLVMJPIXUQJL-UHFFFAOYSA-N	438.576	1.799	50	20	IDGD	
CS(=O)(=O)N1CCC[C@@H]1C(=O)NNC(=O)Nc1ccc(Br)cc1Cl	802042183	NJNSLQAMKRMPQA-LLVKDONJSA-N	439.719	1.679	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)N[C@@H](C)CCNS(=O)(=O)c2ccccc2)c1	802527212	XPHBCUYVRCLSNF-KRWDZBQOSA-N	448.545	1.770	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N(C)[C@H]2CCCOC2)cc1	804287792	OYASXOUCJXOVPK-GTVARFKMSA-N	437.500	1.978	50	20	IDGD	
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC[C@H](C(=O)NNc2nccnc2C2CCC2)C1	805468894	JDWSCAYOVDWBAL-HNNXBMFYSA-N	433.538	1.628	50	20	IDGD	
C[C@@]1(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)CC(c2ccccc2Cl)=NO1	806339350	YGECNKYBYKBDSQ-IBGZPJMESA-N	449.920	1.977	50	20	IDGD	
O=C1COC[C@H](C[C@H]2CN(C(=O)C(=O)NNc3ccccc3Cl)c3ccccc32)N1	806967405	KSDWQIFEQZPFNF-KBPBESRZSA-N	428.876	1.819	50	20	IDGD	
CCOC(=O)C(C)(C)c1csc(NC(=O)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)n1	806972315	QJNRKHRMXGNMIH-UHFFFAOYSA-N	449.445	1.292	50	20	IDGD	
CNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2cc(C)oc2C)c1Br	806973319	KPBWRFJQVDISFI-UHFFFAOYSA-N	437.250	1.418	50	20	IDGD	
Cc1cc(I)cc(NC(=O)C(=O)NNC(=O)c2cccn2C)c1	806976374	BTNOGPTZNVOPDN-UHFFFAOYSA-N	426.214	1.338	50	20	IDGD	
COC(=O)[C@@H]1CCCCN1C(=O)c1cccc(NC(=O)C(=O)NNc2ncccc2F)c1	807302226	PCYQRFZCJBKNRS-INIZCTEOSA-N	443.435	1.470	50	20	IDGD	
COC(=O)c1c(C2CC2)csc1NC(=O)C(=O)NNc1ccc(-n2ccnc2)nn1	807429367	QMUWYWDXAOAAEU-UHFFFAOYSA-N	427.446	1.470	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)F)cc1)C(=O)Nc1cccc2c1COC2=O	808933794	ULSFHCFEMWLFEV-UHFFFAOYSA-N	425.369	1.435	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)CNS(=O)(=O)c1ccc2ccccc2c1	810355391	ATYLZAVYGGSGEX-UHFFFAOYSA-N	427.482	1.604	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccc(Br)c([N+](=O)[O-])c1	810390448	TUBYDOXPODSSSM-UHFFFAOYSA-N	435.234	1.994	50	20	IDGD	
O=C(COC(=O)c1cc(O)cc(C(F)(F)F)c1)NNC(=O)c1cccc([N+](=O)[O-])c1	811307821	BQJJRFSCHXAVFE-UHFFFAOYSA-N	427.291	1.937	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccccc1C(F)(F)F)NNc1ccc2c(=O)[nH]ccc2c1	811507513	FGVNJSCFGOMGNC-UHFFFAOYSA-N	440.403	1.969	50	20	IDGD	
CC(C)OCc1nc([C@H](C)NC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)no1	811971872	HFCIQKPJZRFAKC-LBPRGKRZSA-N	429.437	1.591	50	20	IDGD	
CC(=O)N1C[C@@H]2[C@@H](CCC[C@H]2NC(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)C1	812432101	BLVZPBKQJCMOTD-USXIJHARSA-N	438.554	1.041	50	20	IDGD	
COC[C@@]1(CNC(=O)NNC(=O)Cc2nc3ccccc3n2C)OCCc2ccccc21	812478583	XIXXDYQCXAIRPR-HSZRJFAPSA-N	437.500	1.561	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNc2cccc([N+](=O)[O-])c2)nnn1CCOc1ccc(F)cc1	815558678	KTWKEBAGTZNMCY-UHFFFAOYSA-N	443.395	1.795	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccc(N(C(C)=O)[C@H]2C[C@H]2C)cc1	815568551	MHMNDBCGZXJGJS-KUHUBIRLSA-N	438.484	1.785	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCc2nncn2C1)C(=O)Nc1ccc(OC2CCCC2)c(Cl)c1	815692738	ZUNPIJOLFFUHMS-LBPRGKRZSA-N	446.895	1.601	50	20	IDGD	
CN1CCN(C(=O)Cc2ccc(NC(=O)C(=O)NNc3cccc(Cl)n3)cc2)CC1	815726758	SNLVBFJBDDWJMM-UHFFFAOYSA-N	430.896	1.133	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)/C(=C\c2ccc(F)cc2)n2nnnc2C)cc1	818184436	IZZBZAZREYQGBC-WOJGMQOQSA-N	438.419	1.432	50	20	IDGD	
CCOC(=O)NN=Cc1c(Sc2nnnn2-c2ccccc2)nc2ccccn2c1=O	818203268	GKUPORGKNPJORE-UHFFFAOYSA-N	436.457	1.901	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)c1cc(S(=O)(=O)N(C)C)ccc1F	869774083	PVODINCAEJFUKR-UHFFFAOYSA-N	439.465	1.315	50	20	IDGD	
COc1ccc(OC)c(CNC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)c1	890242618	RSQOJIXZGDPODW-UHFFFAOYSA-N	435.506	1.450	50	20	IDGD	
C=CCNC(=S)NNC(=O)c1ccc(OC)c(S(=O)(=O)N2C[C@H](C)C[C@@H](C)C2)c1	913435835	YQVIUIDRWUAAEH-ZIAGYGMSSA-N	440.591	1.657	50	20	IDGD	
Cc1ccn2c(=O)c(C(=O)NNC(=O)[C@H](C)Oc3cccc(Br)c3)cnc2c1	915638485	WOEABSQGJOBBMF-LBPRGKRZSA-N	445.273	1.994	50	20	IDGD	
CC(=NNC(=O)COc1cccc(C)c1)c1ccc(S(=O)(=O)N2CCNCC2)cc1	915928592	JHIRTTKRHHJJAO-UHFFFAOYSA-N	430.530	1.508	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)CCCS(=O)(=O)N2CCCC2)cc1	917390170	CNLBTAWIXMKMQR-HNNXBMFYSA-N	427.523	1.206	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN(c2nc3ccccc3s2)C1)c1ccc(-n2cnnn2)cc1	917925926	RTBXMMAZBJYEMO-HNNXBMFYSA-N	448.512	1.950	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)N[C@@H](C)c2ccc(S(=O)(=O)N(C)C)cc2)cc1	918103133	AHXVZFPFCJGYFK-HNNXBMFYSA-N	434.518	1.716	50	20	IDGD	
C[C@H](Cc1ccsc1)NC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	919658190	FYFHEGNUBBSILX-CQSZACIVSA-N	438.579	1.337	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCc2ccc(N3CCOCC3)cc2)cc(OC)c1OC	919790523	KKHJHZYBCKOOJH-UHFFFAOYSA-N	444.488	1.693	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2cc(-n3cnnn3)ccc2C)c2ccccc2c1=O	919896894	MUVWETZNAPCIEI-UHFFFAOYSA-N	433.432	1.167	50	20	IDGD	
CS(=O)(=O)c1ccc(Br)c(S(=O)(=O)NNC(=O)c2ccccc2)c1	919954624	OBLUZDZKWKIQRA-UHFFFAOYSA-N	433.305	1.476	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN(C(=O)COc2ccccc2)C1)c1n[nH]c2c1CCCC2	1116117155	JLUSXPIMCAIZRX-HNNXBMFYSA-N	425.489	1.367	50	20	IDGD	
C[C@H](Sc1ncccc1C(=O)NNc1ccc(-n2ccnc2)nn1)C(=O)N1CCCC1	1258219413	CAWBVMFMLBHMGX-AWEZNQCLSA-N	438.517	1.917	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)Cc1nc2ccccc2n1C)CN(C)C(=O)OC(C)(C)C	1318427325	RIJXADASVKJXBQ-CQSZACIVSA-N	432.525	1.949	50	20	IDGD	
COCCCOc1ccc(Cl)cc1S(=O)(=O)NNC(=O)c1n[nH]c2c1CCCC2	1320403985	QRVKSSJZZIHSMU-UHFFFAOYSA-N	442.925	1.981	50	20	IDGD	
O=C(NNC(=O)c1cnn2ccncc12)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	1320805232	BWUWQGTVLKXPNQ-UHFFFAOYSA-N	439.439	1.506	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2ccccc2OCC(=O)N2CCOCC2)cc1	1337801793	XNYJQNUILAIHHC-UHFFFAOYSA-N	428.445	1.399	50	20	IDGD	
CC(C)(C)c1ccc(NNC(=O)CNS(=O)(=O)c2ccc(Br)cc2)nn1	1347352499	XQMZRCDUQUPJEK-UHFFFAOYSA-N	442.339	1.958	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](F)Cl)C2)C1	1778026323	RVZJMWMTLUGRRM-QEEYODRMSA-N	447.935	1.902	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](OC(C)=O)C(C)C)C1	1779207366	FENVYVHNSPVAGZ-TVKQPGBESA-N	432.945	1.342	50	20	IDGD	
COc1cc(OC)cc(C(=O)N2CCO[C@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)c1	1779299915	HBYDCZXKNADRNW-NRFANRHFSA-N	436.581	1.999	50	20	IDGD	
C[C@H](Cn1cncn1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Br)C2	1779500506	OWICPJFKTYGXNW-VMUDFCTBSA-N	446.321	1.119	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1ncccn1)C2	1780709999	AUXXKSFPUMFQOQ-NIKGAXFTSA-N	429.348	1.769	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)[C@H](C)CNC(=O)OC(C)(C)C)CCO2)C1	1781211280	OOLBDQWYKWVWEF-STXHMFSFSA-N	431.961	1.995	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)C[C@H](O)CNC(=O)OC(C)(C)C)CCO2)C1	1781216487	JLGUECSZPNNOQU-AVYPCKFXSA-N	447.960	1.109	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781330329	WITAKTNYZNIARV-QAPCUYQASA-N	439.285	1.777	50	20	IDGD	
O=C(c1c[nH]c2cnccc12)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781331938	SIBQDIBYDTZXOR-RHSMWYFYSA-N	425.258	1.697	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)Cn1cncn1)C2	1781997615	DSUORMDOOGYUOA-OIPACUDHSA-N	442.358	1.212	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cn1cc(Cl)cn1)C2	1781997972	LRFOWHZTQFDHSW-DXCKQFNASA-N	447.761	1.834	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cnc4ncccn34)CCO2)C1	1783348019	SBHMECWNEONFKY-ACJLOTCBSA-N	436.310	1.346	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3nsnc3NC)[C@H]2C1	1783527696	YFCLPPYTOMRYJK-BJDJZHNGSA-N	446.371	1.347	50	20	IDGD	
O=C(c1ccc(C(F)(F)F)cc1F)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1785198749	HMSWFWBZTKGRHI-YOEHRIQHSA-N	438.805	1.888	50	20	IDGD	
COc1cc(F)ccc1CC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1785657135	JWUHQAMOMJYFQB-AEFFLSMTSA-N	447.276	1.897	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(O)cn3)[C@H]2C1	1786272372	YOWHPCYKLSJICI-DUPGQFARSA-N	426.311	1.412	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccn4c(O)nnc34)[C@H]2C1	1787385015	SRMYFFHRDPMMJZ-HNKHHVNMSA-N	435.912	1.436	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]3C2)c1	1787444828	KCBNBXBJAVEWIV-QCEMKRCNSA-N	432.901	1.218	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)c1ccc2nncn2c1	1788374657	ZIIDWXYQRSBDLY-KKUMJFAQSA-N	436.310	1.108	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(F)n3)[C@H]2C1	1788869427	YCNPEDFWGURUFO-XPCVCDNBSA-N	428.302	1.988	50	20	IDGD	
CN(CC(=O)NC1(c2ccc(NC(=O)CO[Si](C)(C)C)cc2)CCC1)C(=O)C(=O)O	1789649606	VRDARAJSOPTOSF-UHFFFAOYSA-N	435.553	1.515	50	20	IDGD	
C[C@H](Br)C(=O)NC1(c2ccc(NC(=O)CN(C)C(=O)C(=O)O)cc2)CCC1	1791097425	AXXZGXMYFGQFIS-NSHDSACASA-N	440.294	1.447	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/c3ccc([N+](=O)[O-])o3)C[C@@H]21	1791249187	FROZKAOUJJENPL-ODNVVZAYSA-N	441.868	1.435	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(O)c([N+](=O)[O-])c1)C2	1793451892	KZJOBIJVDSGXSZ-UMPJEAMMSA-N	425.869	1.911	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)nc3ccccc13)C2	1795114435	ITBODNZUPYCQGT-DBWKPXFBSA-N	448.317	1.929	50	20	IDGD	
CN(C)c1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](O)CCl)C3)c2ccccc12	1796946970	GAKNNSVTQCWRBR-IALDWUNLSA-N	445.947	1.709	50	20	IDGD	
CN1Cc2ccccc2C[C@@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CO[Si](C)(C)C	1797953064	ZXWRIRHANFIKHY-XAPVIXHLSA-N	445.636	1.484	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccnc(Cl)n1	1798083146	WTMSIBILOXDJEA-LSCVPOLPSA-N	431.718	1.507	50	20	IDGD	
C[C@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CO[Si](C)(C)C)[C@H]1SC(=N)NC1=O	1798625925	RSRRKROTGXHWGN-DKBOKBLXSA-N	426.615	1.279	50	20	IDGD	
CCSc1cccnc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](Cl)COC)C2	1798778899	NURKIZPOAHASRJ-HLPPOEQASA-N	427.954	1.651	50	20	IDGD	
C=CCC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2	1799321515	CYJQJDMUNLGFSR-XFIYOXNOSA-N	447.935	1.970	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2ncccc2[nH]1	1799895177	KISWZYGSKIOCOT-IPJQOSJUSA-N	435.322	1.940	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)c1cnc2cccc(Cl)c2c1	1800090645	YJKHPKVAUQGKCM-JGTCGTHISA-N	438.311	1.691	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc3ccc(F)cn13)C2	1800762408	RVHAMPZSCGFOBJ-LSSIXWDNSA-N	439.285	1.460	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc([N+](=O)[O-])cc1F)C2	1800977849	ZMILVCSRQRKXMZ-YHYOWMERSA-N	429.832	1.191	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cc1ccc(F)c(C#N)c1)C2	1802338857	WSKAZERVUJFRSF-BCDXTJNWSA-N	429.496	1.251	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccnc3c2OCO3)[C@@H]1c1cccnc1)[C@H](O)CCl	1803140807	IHNCYMFLBQCEDX-NUEKZKHPSA-N	432.864	1.125	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2cccn(C)c2=O)[C@H]1c1cccnc1	1803835121	HYTRYAZLMZANEZ-RYQLBKOJSA-N	432.908	1.354	50	20	IDGD	
CN1N=C(C(=O)NC[C@H]2CCN(C(=O)C(C)(C)CCl)[C@@H]2c2cccnc2)CCC1=O	1804116167	YPUSBZRSXYWUGQ-CRAIPNDOSA-N	433.940	1.961	50	20	IDGD	
Cc1cscc1C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1807361140	HLIFWWFCDDRLJG-GHTZIAJQSA-N	449.341	1.765	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H](CNC(=O)Cn2ccnn2)[C@@H]1c1cccnc1	1807674624	MATLCDVAZVHJNQ-UNEWFSDZSA-N	435.326	1.410	50	20	IDGD	
C[C@]1(C(=O)NC[C@@H]2CCN(C(=O)[C@H](F)Br)[C@@H]2c2cccnc2)CCCN1	1808088620	OMMWQHMFOCVETB-JTOWHCCKSA-N	427.318	1.920	50	20	IDGD	
O=C(CCBr)N1CCCC2(CCN(C(=O)[C@H]3CCCS3(=O)=O)CC2)C1	1809070372	MNDSCXYGGIVXJZ-CQSZACIVSA-N	435.384	1.580	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)C(Cl)Cl)[C@@H]1c1cccnc1)[C@H]1CCCS1(=O)=O	1812497859	CAJSRVQOOITSIH-BFHYXJOUSA-N	434.345	1.468	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)CN2CCOCC2)[C@@H]1c1cccnc1	1812863957	JCFAYUITXSNBCU-QILLFSRXSA-N	439.354	1.203	50	20	IDGD	
CC(C)CNC(=O)C(=O)N1CC[C@H](CNC(=O)[C@H](C)Br)[C@H]1c1cccnc1	1812864873	SMYQMHWWOHBOFQ-NUEKZKHPSA-N	439.354	1.643	50	20	IDGD	
C#CCCCCC(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1	1813227815	XXOHFRDPLOGNDZ-GCJKJVERSA-N	448.527	1.593	50	20	IDGD	
Cc1cccc(C(=O)N[C@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)c1	1815343898	VTAHKJNMZAMPDD-KRWDZBQOSA-N	435.314	1.671	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(F)s1)CC2)c1cccc(B(O)O)c1	1815354670	ADWQFMNFXINUMQ-LBPRGKRZSA-N	445.306	1.563	50	20	IDGD	
CCc1[nH]nc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@H](O)CCl)CC3)c1Cl	1815804658	JJKKVHUAZFJPQO-OIBJUYFYSA-N	432.333	1.908	50	20	IDGD	
CCc1cc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)no1	1819887215	OSQVZDMLKVPIQL-GOSISDBHSA-N	437.265	1.260	50	20	IDGD	
C[Si](C)(C)OCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCSC(=N)N)CC2	1820162706	MUTIWLDPFYJYKB-JTQLQIEISA-N	429.644	1.923	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@H]1CCc2nc(NC(=O)c3c[nH]c(=O)cn3)sc2C1	1821471937	BOWHGEQIEDXEIH-PWJLMRLQSA-N	430.317	1.689	50	20	IDGD	
O=C(CN1CCCCC1=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1	1823013742	IHJZGXUEOTVEJT-YMTOWFKASA-N	447.330	1.758	50	20	IDGD	
C[C@@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1)C1(O)CCC1	1823733458	WNUPRKXZKBZYFB-UWJYYQICSA-N	442.365	1.151	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H]3CNC(=O)C3)sc2C1	1825203199	HRWFKEGQURBDPP-AEJSXWLSSA-N	429.340	1.365	50	20	IDGD	
Cc1nnc(CC(=O)N[C@H]2CCc3nc(NC(=O)[C@H](C)Br)sc3C2)o1	1825640457	AHYMHRKUIWVICE-CBAPKCEASA-N	428.312	1.773	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@H]1CCc2nc(NC(=O)C(Cl)Cl)sc2C1	1826099786	QXCVSDLDJMKIKD-ZETCQYMHSA-N	443.316	1.171	50	20	IDGD	
CCO/C=C/C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1)CC2	1826464890	XQBNRLLDUAZXBB-KOGZKQLOSA-N	444.517	1.739	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@H]1CCc2nc(NC(=O)CSc3nc[nH]n3)sc2C1	1826671965	SECMZLVCEGOVPS-JTQLQIEISA-N	440.627	1.817	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(Cl)cc3F)CCO2)C1	1830090320	SWBFLQHNQSOQFP-BEFAXECRSA-N	449.306	1.803	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cccc(Cl)n3)C2)C1	1830357606	BHBDEQGMLDTWEU-FQEVSTJZSA-N	444.359	1.999	50	20	IDGD	
C[C@H](Sc1cccs1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1830730543	BFQYKAPLEBLJOX-DEYYWGMASA-N	448.994	1.285	50	20	IDGD	
CC(C)(C)OC(=O)CCCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1830800418	FBSWRXHXOUHFSP-LPHOPBHVSA-N	436.908	1.489	50	20	IDGD	
CNC(=S)NCCC(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](Cl)COC)CC1	1831830478	CYEFATFVODUMLO-HOTGVXAUSA-N	433.018	1.344	50	20	IDGD	
Cc1ccc(CCC(=O)N2CCO[C@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)cn1	1832912109	DQNQCPGJAYWSNF-LJQANCHMSA-N	430.332	1.583	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H](C)Cn3cccn3)CCO2)C1	1833191692	RSXMRHLCWQXNLM-ZWOKBUDYSA-N	426.945	1.383	50	20	IDGD	
O=C(C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1)c1ccccc1	1834706378	IBMOSRPEWOATDV-YJBOKZPZSA-N	443.269	1.016	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3cc(O)n[nH]3)CC2)CC1	1834772450	FRGPKWKAPGEKAO-CQSZACIVSA-N	442.358	1.474	50	20	IDGD	
Cc1nccc(C(=O)N2CCC(N3CCC(NC(=O)CO[Si](C)(C)C)CC3)CC2)n1	1835837388	GOLTUNKLHKBKNX-UHFFFAOYSA-N	433.629	1.822	50	20	IDGD	
CC(C)(C)c1cc(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)[nH]n1	1835933027	HIVZPSXAWVOCFJ-KRWDZBQOSA-N	439.988	1.492	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)[C@H](C)n3ccccc3=O)CC2)CC1	1836396876	ODEWGYGPCKYJCN-QFBILLFUSA-N	436.984	1.998	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccncc3F)C2)C1	1837713288	TVCYBNKSXUWNIB-IBGZPJMESA-N	425.533	1.142	50	20	IDGD	
CCc1cc(C(=O)N2CCC(OC3CCN(C(=O)[C@@H](Cl)COC)CC3)CC2)n[nH]1	1837997578	KDPOQOVBQKFKQT-KRWDZBQOSA-N	426.945	1.838	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)C/N=C/c3ccco3)CC2)CC1	1838409364	LUPPQGFXPBGWGB-QMFLXTPQSA-N	439.940	1.951	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccccc3-n3nccn3)C2)C1	1839147243	KSOZAPVEHILKSA-UWJYYQICSA-N	447.923	1.355	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCCCCC(=O)OC)C2)C1	1839149020	QICUPYAVKYXYDF-JXFKEZNVSA-N	432.945	1.584	50	20	IDGD	
O=C(C#Cc1ccccc1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839199522	PIWRDYACWGAUGX-MJGOQNOKSA-N	439.281	1.185	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)ccc1O	1839309915	UZIDPNNAINPGNL-KUHUBIRLSA-N	441.322	1.554	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(F)nc3)C2)C1	1839964767	BUQVNONJBQGMGB-KSSFIOAISA-N	444.301	1.464	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1C[C@H]3CC[C@@H]1O3)CCO2	1840051423	ZSZLGMGOAWXCDF-CLLBMXBRSA-N	445.354	1.184	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3cccc(C)c3)C2)C1	1840149996	DKXDOHRKINSAPH-KNQAVFIVSA-N	438.952	1.638	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C)ccc3O)C2)C1	1840154294	RITSLCYELFYYFS-OXJNMPFZSA-N	426.897	1.024	50	20	IDGD	
C[C@H](Cc1ccncc1)C(=O)N1CCOC[C@]2(CN(C(=O)C(Cl)Cl)CCO2)C1	1840189831	OASLNMSTGNIGLM-AUUYWEPGSA-N	430.332	1.520	50	20	IDGD	
Cc1ccc(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)c(C)n1	1840338939	GOIYVDSAHOIISU-FQEVSTJZSA-N	444.359	1.891	50	20	IDGD	
Cc1cc(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)no1	1840369102	BAYUQBOAAPJSQI-ZWKOTPCHSA-N	434.320	1.218	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)/C=C/c3cnccn3)CCO2)C1	1840488185	XFIDJYSJYXCVPW-CJIROOEOSA-N	443.331	1.183	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC12CN(C(=O)[C@H]1CC(c3ccccc3)=NN1)C2	1841289383	XWIKDNAWKPEMQZ-RHSMWYFYSA-N	433.350	1.987	50	20	IDGD	
O=C(c1cc(Br)cs1)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843011318	RMRHUEZDGMPVEQ-UHFFFAOYSA-N	449.135	1.321	50	20	IDGD	
O=C(c1cnc2cccc(Cl)c2c1)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843012167	LFBQYVLBFSTGMG-UHFFFAOYSA-N	449.703	1.699	50	20	IDGD	
CCn1c(-n2nc(C(=O)N3CC4(CCCN4C(=O)[C@@H](F)Cl)C3)cc2C)cccc1=O	1843363405	CBTFEJXHDWFXSY-QGZVFWFLSA-N	435.887	1.714	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@]2(NC(=O)OC(C)(C)C)CCOC2)C1	1845208651	RAIHCVWIVNYXKC-VLIAUNLRSA-N	429.945	1.891	50	20	IDGD	
CCS(=O)(=O)CC(=O)N1CC2(CCCN2C(=O)/C(C#N)=C/c2ccc(F)cc2F)C1	1845870348	FDJUFALWOVHZBO-OVCLIPMQSA-N	437.468	1.510	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CCC[C@H](C(=O)N2CCCC23CN(C(=O)[C@@H](O)CCl)C3)C1	1846355774	GWBYXPKVHKHQHA-XHSDSOJGSA-N	443.972	1.873	50	20	IDGD	
O=C(c1cnc2ccc(Br)cn12)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl	1847563694	OUUAWGFBFCKUHF-SGMGOOAPSA-N	441.713	1.512	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)COCCOCCOCCOC	1847868230	XDYCYMBZJNCBCY-SQNIBIBYSA-N	434.961	1.292	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)C[C@H]2Sc3ccc(Cl)cc3NC2=O)C[C@@H](C)O1	10889304	BPIMBZACMJBXRL-XHBSWPGZSA-N	440.953	1.790	50	20	IDGD	
Cc1noc(C)c1S(=O)(=O)N1CCC(C(=O)NNC(=O)c2c[nH]c3ccccc23)CC1	17524176	HKCXKGVLKFKJNL-UHFFFAOYSA-N	445.501	1.635	50	20	IDGD	
Cc1ccc([C@H](CNC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)N2CCCC2)o1	725871671	KCFNORMRGZNMJX-KRWDZBQOSA-N	434.518	1.773	50	20	IDGD	
O=C(NNC(=O)N1CCO[C@@H](c2ccc(F)c(Cl)c2)C1)c1ccc(-n2cnnn2)cc1	727474114	YPHGYGCOTOSHEK-QGZVFWFLSA-N	445.842	1.883	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3ccc4ccccc4n3)cc2)CC1	728213278	IDEIVSJQDYDNPP-UHFFFAOYSA-N	425.514	1.928	50	20	IDGD	
O=C(NCCNS(=O)(=O)Cc1ccccc1)NNC(=O)c1cccc(OC(F)F)c1	728598997	UPJAQEZZIBLCQM-UHFFFAOYSA-N	442.444	1.352	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)CCCCN(C)C)c1	729512981	ZRJAXAOTTJWXMZ-UHFFFAOYSA-N	448.545	1.989	50	20	IDGD	
COc1cc(S(=O)(=O)NNC(=O)Cn2ccc3ccccc32)cc(C(=O)O)c1OC	729667679	VIIMZKFTSJUISK-UHFFFAOYSA-N	433.442	1.366	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)c1sccc1S(=O)(=O)Nc1cnn(C)c1	731493660	BOLHOOUVWKTDKC-UHFFFAOYSA-N	435.487	1.366	50	20	IDGD	
N#CCCn1cc(/C=C(\C#N)C(=O)N2CCO[C@H](c3nn[nH]n3)C2)c(-c2ccccc2)n1	732089820	NGRNTVSSWFBKCL-FYXHJSOBSA-N	429.444	1.484	50	20	IDGD	
Cc1cccc(-n2c(C)cc(/C=C(/C#N)C(=O)NCC(=O)NCCN3CCOCC3)c2C)c1	732157778	GRUHVVHHUWHBFV-JCMHNJIXSA-N	449.555	1.874	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCCCN2C[C@@H](C)O[C@H](C)C2)cc1Br	732237353	BVIQGNDTRNHPEZ-CHWSQXEVSA-N	443.342	1.901	50	20	IDGD	
Cc1occc1C(=O)Nc1nc(CC(=O)NNC(=O)CCN2C[C@@H](C)O[C@H](C)C2)cs1	732261217	BMCKNLAXPOVHEX-CHWSQXEVSA-N	449.533	1.486	50	20	IDGD	
CC(C)(C)CC(=O)N1CCC[C@@H]1C(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	732332216	HNQATIWYCQZNJG-OAHLLOKOSA-N	434.449	1.326	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cnn(-c3ccccc3C)c2)cc1	732653844	LROKUOGUWYOBTC-UHFFFAOYSA-N	441.513	1.571	50	20	IDGD	
N#CCCn1cc(/C=C(/C#N)C(=O)OCCCN2C(=O)CNC2=O)c(-c2ccccc2)n1	733378365	SXABUOTXDKARDK-ATVHPVEESA-N	432.440	1.856	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)CNC(=O)Cc1cccc(F)c1	734249723	IWHWHARPTNRZEQ-UHFFFAOYSA-N	436.509	1.705	50	20	IDGD	
CS(=O)(=O)Cc1ccc(S(=O)(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)cc1	734807318	ZOUXMPNLPBYKLW-UHFFFAOYSA-N	426.560	1.757	50	20	IDGD	
C[C@H](CN1CCN(c2ccccn2)CC1)NC(=O)NNC(=O)c1cc2c(s1)CCC2	735518360	IWRPNIOXXBCOAK-OAHLLOKOSA-N	428.562	1.787	50	20	IDGD	
O=C(NNc1cccnn1)[C@@H]1CCCN(S(=O)(=O)c2ccc(Br)s2)C1	736698280	HLPZSYNHYLJJIF-SNVBAGLBSA-N	446.352	1.845	50	20	IDGD	
Cc1ccc2c(c1)C(=O)N(CC(=O)NNc1ccccc1S(=O)(=O)NC(C)(C)C)C2=O	740086159	RSRFPZLRFKBWFF-UHFFFAOYSA-N	444.513	1.811	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)[C@H]1COc2ccccc2O1)[C@@H]1CN(Cc2ccccc2)CCO1	741280948	KPFNEWKEIMAZNT-ORYQWCPZSA-N	440.500	1.446	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@H]2C[C@H]2c2cccc(F)c2F)cc1	741660775	OAHOYGQCHGMRSR-HOTGVXAUSA-N	437.468	1.845	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N[C@H](C)c2cnn(C)c2)cc1	741700058	DUJXNCYDJCAFFX-ZXMBATIKSA-N	447.499	1.952	50	20	IDGD	
O=C(CN1CCn2c(Cc3ccccc3)nnc2C1)NNC(=O)c1ccc([N+](=O)[O-])cc1	741796164	VVPLAEGNGIICGP-UHFFFAOYSA-N	435.444	1.054	50	20	IDGD	
COC(=O)c1ccc(S(=O)(=O)NNC(=O)c2ccc(C#N)cc2)c(Br)c1	743255715	ILHDDJBHFZFEKY-UHFFFAOYSA-N	438.259	1.731	50	20	IDGD	
CN(C)CCNC(=O)c1cccc(CNC(=O)NNC(=O)Nc2ccc(N(C)C)cc2)c1	743584155	PJDVOWFVCAUFJZ-UHFFFAOYSA-N	441.536	1.580	50	20	IDGD	
COCCCNC(=O)[C@H](C)N1CCN(C(=O)NNC(=O)c2cccc3ccccc23)CC1	743630232	QFOVCRCNKHOMTA-KRWDZBQOSA-N	441.532	1.353	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1nnc2ccccc2c1O	744620280	HQAHGCRVVHUONL-UHFFFAOYSA-N	429.458	1.113	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cccc(-c3cnn(C)c3)c2)cc1OC	745221643	PONQYBUPPGEQTA-UHFFFAOYSA-N	438.440	1.722	50	20	IDGD	
C[C@H]1CCC[C@@](CNC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)(N(C)C)C1	745720152	KKTYTJGAOJYQSV-IFXJQAMLSA-N	425.555	1.936	50	20	IDGD	
CC(C)OC(=O)N1CCC(NC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)CC1	745816647	BBNJFPHTRBHDPU-UHFFFAOYSA-N	441.510	1.435	50	20	IDGD	
Cc1ccc(N2CCC[C@@H](NC(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)C2=O)cc1	745885368	QVTGZCNIBVPEEQ-GOSISDBHSA-N	444.513	1.538	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1ccccc1Cn1cccn1	746098104	RJJZVCZRYNTBOB-UHFFFAOYSA-N	426.502	1.608	50	20	IDGD	
O=C(CCN1CCN(c2ccccn2)CC1)NNC(=O)c1cccc(Br)c1	746317351	QUUATOQXJKWHQT-UHFFFAOYSA-N	432.322	1.817	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)Cc3ccncc3)CC2)cc1	747322978	GBGYWSBIKORZPE-UHFFFAOYSA-N	446.529	1.271	50	20	IDGD	
CSc1nc(O)nc(C)c1C(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	747392418	DIRJBESTXPNPNI-UHFFFAOYSA-N	440.526	1.556	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2ccc(OCC3CC3)nc2)c1	749187290	GMLJGLLDGPNROT-UHFFFAOYSA-N	447.517	1.265	50	20	IDGD	
CCOC(=O)c1sc(CNC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])nc1C	750670544	HWXOWISLULHESK-UHFFFAOYSA-N	437.434	1.446	50	20	IDGD	
O=C(NCCn1cccc1)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	753050414	ULRWLRWORYDHQF-UHFFFAOYSA-N	430.468	1.891	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)NC[C@@H]2CCN(S(C)(=O)=O)C2)cc1OC	753097317	ZIBVIDDFKNEHDJ-AWEZNQCLSA-N	442.538	1.100	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)N[C@@H]2CCCN(Cc3ccccn3)C2=O)c1	753289172	JYDPVQFVJJUWHH-GOSISDBHSA-N	427.461	1.234	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CN2CCN([C@@H](C(N)=O)c3ccc(Cl)cc3)CC2)cc1	754238917	NOGQWXBCWGZSOJ-HXUWFJFHSA-N	443.935	1.254	50	20	IDGD	
Cc1nccc(NCc2cccc(C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)c2)n1	754873225	PUMDTOPXIWRRPZ-UHFFFAOYSA-N	429.444	1.448	50	20	IDGD	
O=C(NNc1ccc(C(F)(F)F)nn1)[C@H]1CS[C@@H](Cc2ccccc2F)C(=O)N1	755183553	YJRBGKNXVDMFEL-NEPJUHHUSA-N	429.399	1.921	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCOCC2)cc1NC(=O)NNC(=O)c1ccc(C)o1	755408029	ILWWTAQZPJKPRD-UHFFFAOYSA-N	438.462	1.084	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)Nc2ccc(-n3cnnn3)cc2)c1	755438124	GOCCCOGPNUUXMG-UHFFFAOYSA-N	432.238	1.900	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)Nc2ccc(C(=O)N3CCOCC3)cc2)c1	755933399	LKOQBUUHJNFVMI-UHFFFAOYSA-N	428.445	1.643	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)Nc1ccccc1CN1CCOCC1	756114094	HCPDBPMKIXBJIT-UHFFFAOYSA-N	439.520	1.378	50	20	IDGD	
C[C@]1(c2cccc(C(=O)OCC(=O)NNC(=O)c3ccc(Cl)cc3)c2)NC(=O)NC1=O	756222202	AOFYDYOREMZXHD-HXUWFJFHSA-N	444.831	1.013	50	20	IDGD	
CCOc1ccc(OC)cc1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	756433319	XLJCPMSBINGRGF-UHFFFAOYSA-N	436.490	1.811	50	20	IDGD	
COC(=O)c1cc(Cl)cc(NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1	756676339	KWOCSOAQJATFBQ-UHFFFAOYSA-N	432.868	1.986	50	20	IDGD	
CCOc1ccc(C(=O)N(C)C)cc1NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	756879186	HCLQUOIQLNOVLO-UHFFFAOYSA-N	438.448	1.229	50	20	IDGD	
Cn1c(C(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)cccc1=O	756906192	YMRGVIYUXOGWHR-UHFFFAOYSA-N	429.440	1.162	50	20	IDGD	
CCOc1cccc(CNC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c1OC(F)F	756914075	NALPIPPKJBYBLL-UHFFFAOYSA-N	447.402	1.807	50	20	IDGD	
CCOC(=O)c1cc(Br)cc(S(=O)(=O)NNC(=O)c2cccn2C)c1	756929342	BYQZVBDMKJZEKN-UHFFFAOYSA-N	430.280	1.588	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)c1cccc([N+](=O)[O-])c1Br	758203405	DMLSRRZMXJTMDB-UHFFFAOYSA-N	427.236	1.610	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC2(CC1)CC(C(=O)NNC(=O)c1cccc(C#N)c1)=NO2	760263914	ZKIQNKRLHNJKAZ-UHFFFAOYSA-N	427.461	1.865	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)N[C@@H]2CCCN(c3ccccc3F)C2=O)cc1	761819908	XJZSAEZTDDBJRK-QGZVFWFLSA-N	425.420	1.602	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)NC[C@@H]1CCN(C)[C@H]1c1ccc(Cl)c(F)c1	763090265	BDNMPOTUGUUDSQ-IFIJOSMWSA-N	430.908	1.854	50	20	IDGD	
COC(=O)c1c(C2CC2)csc1NC(=O)C(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	763444012	PQOFJKCNKVYMII-UHFFFAOYSA-N	432.414	1.720	50	20	IDGD	
CCOc1cc2c(cc1NC(=O)C(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)O[C@H](C)C2	763466539	JEPRYGAQVFKMJV-LLVKDONJSA-N	428.401	1.717	50	20	IDGD	
CCOC(=O)c1cc(C)sc1NC(=O)C(=O)NNC(=O)c1ccc(OC)c(OC)c1	763544258	TYRIFNYTXXRIRA-UHFFFAOYSA-N	435.458	1.650	50	20	IDGD	
COC(=O)c1ccc(F)c(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)c1	763612269	FIADRSUOSDJXCF-UHFFFAOYSA-N	425.376	1.402	50	20	IDGD	
Cc1cccc(C(=O)N2CCCC2)c1NC(=O)C(=O)NNC(=O)c1c(C)nc2ccccn12	763627583	BQUUILUOVKMJJG-UHFFFAOYSA-N	448.483	1.587	50	20	IDGD	
O=C(CSc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1ccn(Cc2ccccn2)n1	763733784	HIWBOFBGOIZZSE-UHFFFAOYSA-N	444.904	1.858	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2ccc(OCCN(C)C)cc2)c1	763775866	WRIDXMXLKRXFNB-UHFFFAOYSA-N	430.461	1.044	50	20	IDGD	
O=C(CCCc1ccc(Br)s1)NNC(=O)CNC(=O)c1cccnc1	763826278	YBXVCCUCIFHVGE-UHFFFAOYSA-N	425.308	1.806	50	20	IDGD	
CCn1cnnc1-c1cccc(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)c1	763837429	FRBJGLQKNINGER-UHFFFAOYSA-N	426.408	1.269	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)C(=O)Nc1cccnc1-n1cncn1	763853595	MUCPZYLECCTDDF-AWEZNQCLSA-N	445.439	1.369	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc3ccccc3F)cc2)CCO1	763864882	LTNHPYNWENEPKW-GJZGRUSLSA-N	444.463	1.604	50	20	IDGD	
O=C(CCSc1ccc(F)cc1)NNC(=O)C(=O)Nc1c[nH]nc1-c1ccccn1	763901686	JPFLYAXXZWUQEC-UHFFFAOYSA-N	428.449	1.879	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(-c3nccn3C)c2)cc1OC	763901877	KSRPXLMEFIOPHX-UHFFFAOYSA-N	437.456	1.894	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3oc(N(C)C)nc3c2)cc1OC	763902625	VPCMKPKECLPADO-UHFFFAOYSA-N	441.444	1.701	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccn(-c3ccncc3)n2)ccc1OC(C)C	763922139	SKCFQUFFNRXFHQ-UHFFFAOYSA-N	438.444	1.463	50	20	IDGD	
Cn1nc2c(c1NC(=O)C(=O)NNC(=O)C1=S=C3CC[C@@H](C(C)(C)C)CC3=C1)CCC2	763942312	UMHKGTMABKZBQV-CYBMUJFWSA-N	443.573	1.859	50	20	IDGD	
COCCn1ncc2ccc(NC(=O)C(=O)NNC(=O)c3cc(Br)c[nH]3)cc21	763994514	DRLMXRQNJYJXIY-UHFFFAOYSA-N	449.265	1.173	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cccn2C)c(OCC(F)(F)F)c1	763999095	NFUMCOVHYSRJPD-UHFFFAOYSA-N	442.350	1.153	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2cccc3ccccc23)c1	764048446	LYYMVURXWZXISX-UHFFFAOYSA-N	440.481	1.490	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)C(=O)Nc1cc(C(C)(C)C)nn1-c1ccc(F)cc1	764298006	LOKVBGMAUQJJEI-UHFFFAOYSA-N	427.440	1.740	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)C(=O)Nc1ccc(-c2n[nH]c(-c3ccccc3)n2)cc1	764355942	NCBIWOGAQWOMTG-UHFFFAOYSA-N	441.451	1.862	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)C(=O)Nc2ccn(-c3ccccc3Cl)n2)c1	764430747	OCENTJMSBARSKW-UHFFFAOYSA-N	441.835	1.279	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)C(F)(F)C1(O)CCC1	764753075	QWUJVWKJGXIUFL-UHFFFAOYSA-N	430.883	1.155	50	20	IDGD	
CCOC(=O)NNC(=O)C(=O)Nc1ccc(=O)n(Cc2ccc(Cl)c(Cl)c2)c1	765410345	VJPFWLMMNRZEFU-UHFFFAOYSA-N	427.244	1.919	50	20	IDGD	
O=C(Cc1cccc(C(F)(F)F)c1)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765737083	VPGGPZBOZWAVKR-UHFFFAOYSA-N	448.445	1.853	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1cc2c(s1)CCOC2	765738835	OXFWEJLZGTZWIG-UHFFFAOYSA-N	428.514	1.040	50	20	IDGD	
COc1cc(C)nc(NNC(=O)CCC(=O)N2CCc3cc(OC)c(OC)cc3C2)n1	765754847	SPNAFJAMYJLSHR-UHFFFAOYSA-N	429.477	1.619	50	20	IDGD	
C[C@H](O)C(=O)N1CCN(C(=O)/C(C#N)=C\c2cn(CCC#N)nc2-c2ccccc2)CC1	766017218	ZQBXNDOIUOPTOL-FJSNCCPHSA-N	432.484	1.422	50	20	IDGD	
COc1c(F)ccc(F)c1C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	766650292	JVMZSGOLBYZRHA-UHFFFAOYSA-N	432.427	1.192	50	20	IDGD	
O=C(O)CC1(CC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)CCCC1	767139901	LTFOZKMVKLDMIZ-UHFFFAOYSA-N	437.518	1.657	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)[C@H]1CC(=O)N(c2ccc(F)cc2F)C1	767282866	YVRDSSBBTAHXRE-HNNXBMFYSA-N	445.422	1.559	50	20	IDGD	
CS(=O)(=O)c1ccc(C(=O)NNC(=O)c2ccc(Cl)nc2)cc1Br	769711749	SOLMPXUKKAKQFG-UHFFFAOYSA-N	432.683	1.976	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)N1CC[C@@H](C(=O)NCC(F)(F)F)C1	770646488	FKULJLBAMFAFQR-GHMZBOCLSA-N	436.818	1.849	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CNC(C)(C)c2nc3ccccc3n2C)cc1OC	770664599	TZNSBRZYNVWNNX-UHFFFAOYSA-N	425.489	1.876	50	20	IDGD	
COc1ccccc1[C@]1(C)NC(=O)N(CC(=O)NNC(=O)c2cc3c(s2)CCC3)C1=O	771228599	MUFOKLMREAVSTN-NRFANRHFSA-N	442.497	1.474	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)c1ccc(I)c(N)c1	772183443	XYXPDIWLZRPAQI-VIFPVBQESA-N	433.246	1.612	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NNC(=O)CNC(=O)NC2CCCCC2)C1	773416935	DPTKSQFBKIAQNG-CQSZACIVSA-N	425.530	1.413	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)CNC(=O)c2cccc(Cl)c2)C1	774245303	KZXUTTGMZRWQJB-AWEZNQCLSA-N	438.912	1.864	50	20	IDGD	
O=C(NCCc1ccc(OCCN2CCCC2)cc1)NNC(=O)C(=O)Nc1ccccn1	775456410	WVFGKPOJNHRPTI-UHFFFAOYSA-N	440.504	1.068	50	20	IDGD	
COc1cc([C@H](NC(=O)NNC(=O)c2cc(C)[nH]n2)C(F)(F)F)cc(OC)c1OC	776002968	UTNNOMFZXVOZOY-AWEZNQCLSA-N	431.371	1.992	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)c2cn(-c3cccc(Cl)c3F)nn2)c1	776300649	LDAWOTBDPJTEHB-UHFFFAOYSA-N	437.840	1.538	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)N[C@@H]1CCO[C@@H](CC(C)C)C1	776885647	OEBRQFVZTSWDQN-CABCVRRESA-N	425.555	1.826	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)NC[C@H]2COC3(CCOCC3)O2)cc1Cl	776946487	SGOJORJKCMMZIZ-NSHDSACASA-N	444.872	1.615	50	20	IDGD	
CC[C@@H](C)Oc1cc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)ccn1	777182813	IUYATOGXDIGZIF-DYVFJYSZSA-N	429.429	1.403	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H](C)NC(=O)CC(C)(C)C)c1	778282135	FABZUEVQRFSHDV-CQSZACIVSA-N	440.566	1.419	50	20	IDGD	
N#CCCn1cc(/C=C(/C#N)C(=O)N2CC(n3cc(C(N)=O)nn3)C2)c(-c2ccccc2)n1	779548335	CSDSGJHXDPZVMC-SXGWCWSVSA-N	441.455	1.145	50	20	IDGD	
Cc1cccc(-c2nnc(S)n2CC(=O)NNC(=O)CCNC(=O)OC(C)(C)C)c1	780971840	UCJQWAQCLFKRCM-UHFFFAOYSA-N	434.522	1.604	50	20	IDGD	
COCCn1ccc2ccc(NC(=O)C(=O)NNC(=O)Cc3nc4ccccc4n3C)cc21	782894359	RYMBAANTYULQBA-UHFFFAOYSA-N	448.483	1.503	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)C(=O)Nc1ccc2ccccc2c1	782897256	MRVQGBXMJDDSNG-UHFFFAOYSA-N	425.470	1.533	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)Nc2ccccc2C)c(OCC(=O)N(C)C)c1	783410451	BDHNOFBWJRQBAR-UHFFFAOYSA-N	427.461	1.562	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2ccccc2Nc2ccc(F)cc2F)CCS(=O)(=O)C1	783425709	CXVHCPILPOQIQW-IBGZPJMESA-N	438.456	1.845	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)C(=O)Nc1ccccc1CCC(F)(F)F	784001651	ACQKXTOQMOQRBR-UHFFFAOYSA-N	426.351	1.290	50	20	IDGD	
CCOC(=O)Cn1cccc(NC(=O)C(=O)NNc2ccc(OC(F)(F)F)cc2)c1=O	784801061	LQZKNFUMJHMOIM-UHFFFAOYSA-N	442.350	1.392	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(NC(=O)C(=O)NNc2cc(Cl)ccn2)ccc1Cl	784856180	GFOZDTGANVUEHE-UHFFFAOYSA-N	432.289	1.721	50	20	IDGD	
CN(C1CCCCC1)S(=O)(=O)c1cccc(NC(=O)C(=O)NNc2cccnn2)c1	784858031	DBIGPSLDRBTYBS-UHFFFAOYSA-N	432.506	1.512	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNc2ccnc(N(C)C)n2)cnc(Cl)c1Br	784971049	RFJDSILJPLPKCF-UHFFFAOYSA-N	428.678	1.744	50	20	IDGD	
O=C(NNc1cc(F)c(F)c(F)c1)C(=O)Nc1ccc(F)c(N2CCCS2(=O)=O)c1	785087406	RIZDWXRKSMKWNY-UHFFFAOYSA-N	446.382	1.865	50	20	IDGD	
CNC(=O)c1ccc(NC(=O)C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)cc1	785100141	RMQNECNMSWDNAZ-UHFFFAOYSA-N	431.399	1.298	50	20	IDGD	
COc1ccc(NNC(=O)Cc2c(C(=O)NNc3ccc(OC)cn3)c(C)cn2C)nc1	787558708	IWSVGLBNXVLVJR-UHFFFAOYSA-N	439.476	1.583	50	20	IDGD	
CC(C)[C@@H](NC(=O)Cc1ccc2ccccc2c1)C(=O)NNC(=O)N1CCN(C)CC1	788166156	IWAVXBSXEJBZRN-OAQYLSRUSA-N	425.533	1.511	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)c2ccc(C(=O)NNC(=O)N3CCN(C)CC3)cc2)cc1	788166956	SPXUNVKEGIKACT-UHFFFAOYSA-N	445.545	1.422	50	20	IDGD	
CN1C(=O)Cc2cc(NC(=O)C(=O)NNC(=O)c3cc(F)ccc3Br)ccc21	789734074	ANDKVPGTRNLPFO-UHFFFAOYSA-N	449.236	1.507	50	20	IDGD	
CN(C)[C@@H]1CCOc2c(NC(=O)C(=O)NNC(=O)CCOc3ccccc3)cccc21	789735106	KGCJLQYWKQCVTO-GOSISDBHSA-N	426.473	1.627	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)c2ccccc21)c1cc(-c2ccc(F)cc2)[nH]n1	791054069	MUPKNSBFBZXKHJ-HNNXBMFYSA-N	428.445	1.938	50	20	IDGD	
CC[C@H](C)n1ncc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(C(C)=O)cc2)c1C	792267841	DITFWZVZURHZOH-SWLSCSKDSA-N	429.477	1.919	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)Cc1ccc(I)cc1	792597840	OVWNYTXNEDKZCZ-UHFFFAOYSA-N	443.266	1.473	50	20	IDGD	
O=C(COc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1cccc(Br)n1	793023721	UUCVMIKVWCLTPA-UHFFFAOYSA-N	427.642	1.662	50	20	IDGD	
CC(C)(C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1)c1ccc2c(c1)OCO2	796536790	OHRBQAFASUCONH-GOSISDBHSA-N	442.424	1.224	50	20	IDGD	
CNC(=O)[C@]1(C)CCN(C(=O)NNC(=O)[C@@H](C)Oc2cccc(Br)c2)C1	797606928	TUCMAHMOYHZAKR-PIGZYNQJSA-N	427.299	1.415	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)Nc2ccc(S(=O)(=O)/N=C3/CCCN3C)cc2)n1	797617010	GOECYWCXFMYUFE-ULJHMMPZSA-N	430.490	1.669	50	20	IDGD	
O=C(NNC(=O)c1cc2ccccc2c(=O)o1)c1cccc(S(=O)(=O)N2CCCC2)c1	797701128	CDOLLAMTNMLXEA-UHFFFAOYSA-N	441.465	1.652	50	20	IDGD	
NS(=O)(=O)Cc1cccc(CNC(=O)NNC(=O)c2ccc(Br)s2)c1	799857931	IFGCSWYRPMHQTH-UHFFFAOYSA-N	447.336	1.443	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2cc(S(C)(=O)=O)ccc2Cl)cc1	802064460	RGVUHYIINWZXIL-UHFFFAOYSA-N	445.906	1.614	50	20	IDGD	
O=C(COC(=O)[C@@H](O)c1cccc(C(F)(F)F)c1)NNC(=O)c1ccc([N+](=O)[O-])cc1	803811606	UNKKKOYOLKEOFT-HNNXBMFYSA-N	441.318	1.651	50	20	IDGD	
C[C@@H](Cc1cncc2ccccc12)C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	805682298	RNEQJRASDILNCS-YCRPNKLZSA-N	449.463	1.944	50	20	IDGD	
CCN1CCN(C(=O)Cc2ccc(NC(=O)NNc3ccc(-n4ccnc4)nn3)cc2)CC1	806335213	PETQFTKIQAHISO-UHFFFAOYSA-N	449.519	1.518	50	20	IDGD	
CCN(C)C(=O)c1cccc(NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1	806777301	AZTCUKXPWOBBRT-UHFFFAOYSA-N	425.493	1.638	50	20	IDGD	
Cc1cc(Sc2ncccn2)ccc1NC(=O)C(=O)NNc1ccc(-n2ccnc2)nn1	807429888	YMMPBTJHOHNAPV-UHFFFAOYSA-N	447.484	1.994	50	20	IDGD	
CNC(=O)c1cc(Oc2ccc(NC(=O)C(=O)NNC(=O)C(C)(C)C)cc2F)ccn1	810380282	UYNRNBKQNNGOEZ-UHFFFAOYSA-N	431.424	1.505	50	20	IDGD	
COc1cccc(C(=O)NNS(=O)(=O)CCc2ccccc2Br)c1O	812270133	XANZUPVWVCOWPT-UHFFFAOYSA-N	429.292	1.970	50	20	IDGD	
C#CCOc1ccc(F)cc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	813033208	JSWNMEZXQXFFAS-UHFFFAOYSA-N	434.449	1.170	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1nnc(O)c2ccccc12)c1ccc(N2CCCNC2=O)cc1	813239476	KWLVYPNDJUKEHE-ZDUSSCGKSA-N	449.471	1.960	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc([C@@H]3CCOC3)cc2)cc1OC	815567430	XYGQSAJOZARLJU-MRXNPFEDSA-N	427.457	1.998	50	20	IDGD	
COc1ccc(-c2ccc(C)c(NC(=O)C(=O)NNC(=O)[C@H]3CCc4nncn4C3)c2)cn1	815691433	PWORYGJQXLSALN-INIZCTEOSA-N	449.471	1.006	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)CNC(=O)Cc2ccc(O)cc2)c1	818756959	MZASSYXDWKHRQK-UHFFFAOYSA-N	436.262	1.743	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)c2cn(Cc3ccccc3)nn2)cc1	818812809	RPZFVIWAIKPUOI-UHFFFAOYSA-N	448.512	1.822	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)CSCC(=O)N1CCOCC1	912601280	MOEGYZJTLKHDBT-OAHLLOKOSA-N	431.514	1.347	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	912643228	KJZFOJOAZVXGPY-UHFFFAOYSA-N	433.486	1.407	50	20	IDGD	
COCCNS(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(C(C)(C)C)cc2)c1	913055351	UPHQXAWWTAPDSY-UHFFFAOYSA-N	433.530	1.984	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)c2cnn3c(-c4ccccc4)ccnc23)c2ccccc2c1=O	916123916	RLDKKYRHILAPJS-UHFFFAOYSA-N	439.435	1.718	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)NCc2nnc3n2CCC3)c2ccccc2c1=O	916235116	AKCSAJYZEKBKBO-UHFFFAOYSA-N	438.492	1.269	50	20	IDGD	
CNC(=O)CN1CCC(NC(=O)NNC(=O)c2cc(C)n(-c3ccccc3)c2C)CC1	916517157	UYISPGOVPAFJQO-UHFFFAOYSA-N	426.521	1.249	50	20	IDGD	
C[C@H](NC(=O)c1ccoc1)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	916726664	SPXZAHKQHMJPIQ-AWEZNQCLSA-N	448.501	1.034	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(NC(=O)C(F)(F)F)cc1)c1ccc([N+](=O)[O-])cc1	917713111	FYEXEIYTIFWVTP-UHFFFAOYSA-N	432.336	1.719	50	20	IDGD	
O=C(CC(F)(F)F)NNC(=O)c1cccc(S(=O)(=O)Nc2ccc3c(c2)OCO3)c1	918366089	SXXKXDNIKUIICT-UHFFFAOYSA-N	445.375	1.930	50	20	IDGD	
COCCOc1ccccc1CNC(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	918780443	KJRZERCZPXEGJN-UHFFFAOYSA-N	425.445	1.747	50	20	IDGD	
COc1ccc(/C=C(/C#N)C(=O)OCC(=O)NCc2ccc(S(C)(=O)=O)cc2)cc1	918864217	MQSHZPCVBZTWRZ-BOPFTXTBSA-N	428.466	1.865	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)c1nn(-c2ccccc2[N+](=O)[O-])c(C)cc1=O	920006217	BLSPJXTVPILABZ-UHFFFAOYSA-N	437.412	1.461	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@@H]2C(=O)NNC(=O)NCc2ccco2)cc1	920857701	MYKLWFWSGABRDS-GOSISDBHSA-N	448.501	1.556	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)[C@H]2CC(=O)N(C3CCCCC3)C2)CC1	1116083992	MTGFXRXAFQJSBF-INIZCTEOSA-N	436.553	1.962	50	20	IDGD	
CCS(=O)(=O)Nc1cccc(C(=O)OCC(=O)NNC(=O)Cc2ccccc2C)c1	1116298058	XLPYKNMBDPISMV-UHFFFAOYSA-N	433.486	1.304	50	20	IDGD	
CC1CCN(CCC(=O)NN=C[C@@H]2CCCN(C(=O)CNC(=O)OC(C)(C)C)C2)CC1	1116873839	LGHDAOLOXXFXNP-SFHVURJKSA-N	437.585	1.974	50	20	IDGD	
O=C(CNS(=O)(=O)c1cccc(Br)c1)NNC(=O)c1ccccc1Cl	1317702463	DXYFIXBWJRBVCA-UHFFFAOYSA-N	446.710	1.842	50	20	IDGD	
Cc1cc(OCc2ccc(C(=O)NNC(=O)CN3C(=O)CNC3=O)cc2)ccc1Cl	1317707778	OFTAPJRUETZXKS-UHFFFAOYSA-N	430.848	1.540	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)[C@H]2CCCN2Cc2ccccn2)CC1	1318925521	XRAPSBFBFACRIQ-GOSISDBHSA-N	431.537	1.841	50	20	IDGD	
COCCOc1ccc(S(=O)(=O)NNC(=O)c2cncn2-c2ccccc2)cc1C	1321621327	PRGYXYCARNFXEF-UHFFFAOYSA-N	430.486	1.829	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCCC(=O)N2CCC[C@@H](C)C2)nc1	1351925109	SKEUAFPEQGUNDN-OAHLLOKOSA-N	440.570	1.387	50	20	IDGD	
O=C(c1cc(Cl)nc2ccccc12)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1777803900	CEDZMNVIYQBXAP-OXQOHEQNSA-N	438.311	1.931	50	20	IDGD	
CCCC(=O)N[C@H](C)C(=O)N1CC[C@@]2(CN(C(=O)[C@H](C)CBr)CCO2)C1	1779250232	QLWAYXXMTJGOMN-LBTNJELSSA-N	432.359	1.152	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1CC(c3ccccc3)=NO1)CCO2	1779294669	WICQTNPHKPOWHT-UGKGYDQZSA-N	445.592	1.861	50	20	IDGD	
N[C@H](C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1)c1cccc(Cl)c1	1781331395	QATRHFKRLFUJGL-GRDNDAEWSA-N	448.720	1.860	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CC(F)(F)C(=O)O)C2	1781998393	SFEVAXNFMGTYQB-UEKVPHQBSA-N	441.269	1.394	50	20	IDGD	
CN(C)[C@H](C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2)c1ccccc1Cl	1782829403	IGFQYARQPUUBBA-ZWOKBUDYSA-N	444.359	1.372	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cccn4cncc34)CCO2)C1	1783349438	LVHQROCNBJEHQI-BEFAXECRSA-N	435.322	1.951	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](C)Br)C3)C2)nn1C(F)F	1783539225	ZIYRELXQRPCQLA-BZNIZROVSA-N	435.269	1.814	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccc3scnc3c1)CCO2	1783934704	KXSPDTJFGLDNNR-OAQYLSRUSA-N	445.545	1.113	50	20	IDGD	
O=C(CN1CCc2sccc2C1)N1CCO[C@@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783943389	IFDHTERUMLIHED-SFHVURJKSA-N	432.373	1.740	50	20	IDGD	
Cc1cc(C)n(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]32)n1	1785340889	YZIWVZVUBLYLSZ-IUVQAAGXSA-N	431.364	1.716	50	20	IDGD	
CN(C)c1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCBr)[C@H]3C2)nc1	1786400818	ADWRAKAKJZMKOE-QRTARXTBSA-N	439.354	1.526	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)c1ccc2c[nH]nc2c1	1787320847	XWZQSNXKESJOJK-SDADXPQNSA-N	439.285	1.847	50	20	IDGD	
C[C@H](C(=O)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1)n1ccnc1	1788140108	IKJUUIAQLQEYBW-MRXNPFEDSA-N	432.289	1.572	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)c1ccn2nccc2c1	1788448027	QQOZOEMKETXMEQ-TUUVXOQKSA-N	439.285	1.618	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)c1c[nH]c2cnccc12	1788455991	RMBYVEQYGGOSLM-NZBMOFRJSA-N	439.285	1.847	50	20	IDGD	
COc1ccnc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]3C2)c1	1789924673	SGFRNEFEWRRKKG-LVGORTOPSA-N	430.274	1.374	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(=O)C3CC3)C[C@@H]21	1790693563	KELSBEUNNWPUQT-TYDTZWSASA-N	443.450	1.831	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)COc3ccc(O)cc3)C[C@@H]21	1791055344	UJPMAHUCDVYBHT-PYTWLRIVSA-N	441.322	1.534	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)NNc3ccccc3)C[C@@H]21	1791250275	CLKOKRQXGHHTDE-QDSNELGPSA-N	438.956	1.225	50	20	IDGD	
C[C@@H](Oc1ccccn1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21	1791622098	UDWGKJCIKDFZDF-BLDNINTCSA-N	444.301	1.519	50	20	IDGD	
C[C@@H](Oc1cccnc1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21	1791655289	MTEIMRXABZTXFF-MLEONAHRSA-N	444.301	1.519	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCNC(=O)OC(C)(C)C)[C@H]2C1	1792125241	GYOTZZDELNYDKP-VGWMRTNUSA-N	447.960	1.135	50	20	IDGD	
O=C(CCc1c[nH]c2ncccc12)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21	1792205707	YAGILLMJRILIOV-DKIMLUQUSA-N	434.924	1.075	50	20	IDGD	
CC(C)[C@@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](O)CCl)C2)N1Cc2ccccc2C1=O	1793542517	OSROPRDBTKJCFN-VYMYIBDJSA-N	447.963	1.905	50	20	IDGD	
COc1cccc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@](C)(Cl)CCl)C3)n1	1794015129	JXZNIOWUXZIZIZ-VLBMKZOESA-N	444.359	1.849	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)COc1ccc(F)cc1	1795198527	LOSXPYJORIQGRF-ZDFLXESQSA-N	443.313	1.968	50	20	IDGD	
C[C@@H]1Oc2ccc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@@H](F)Cl)cc2NC1=O	1796366130	NMEDJUKOXMYWHS-QUEVIFFYSA-N	425.844	1.144	50	20	IDGD	
C=C(Oc1ccccc1O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CO[Si](C)(C)C)C2	1796432496	BBNSNKJIQVNTNE-CWPLJXCYSA-N	434.565	1.726	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CCN(C(=O)OC(C)(C)C)C1	1797221946	MCVDGKMMHOVKLX-KSWRQPAISA-N	443.972	1.850	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnc(O)[nH]1	1798866449	SFKHRYJCXADMIV-CLLJXQQHSA-N	443.416	1.514	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@](C)(Cl)CCl)C1	1799278422	GAXMZPNTTSDWMR-HLROQWKMSA-N	449.375	1.792	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CCc3ccccc3O1)C2)[C@H](F)Br	1799352397	UPTLVQFQIMHWFG-IEHFGQBSSA-N	441.297	1.660	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)Br)n1	1800757155	AHGUBHXCAPFKMO-VFFTVRQLSA-N	439.310	1.027	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)Br)C1	1800762853	HHDOQUULAYPDJF-KLOLGFOXSA-N	445.354	1.339	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CC(c3ccccc3)=NO1)C2	1800971258	SPCKGVKWOQBTKB-NZKYLMMGSA-N	435.908	1.023	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1nnc(-c3ccccc3)o1)C2	1802337001	DNQJTWDVCHZQBF-BJWYYQGGSA-N	440.504	1.361	50	20	IDGD	
C[C@@H](C(=O)N1CCC2(CCCN(C(=O)[C@H](O)CCl)C2)CC1)N1CSCSC1	1805522794	LBVTZVSOXKVWSH-LSDHHAIUSA-N	436.043	1.860	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)C(F)F)[C@@H]1c1cccnc1	1806431444	JUUGJPZKNVQKQB-DVGSEWNHSA-N	432.431	1.487	50	20	IDGD	
O=C(CCC(F)(F)F)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1806825184	HFLXCMNENQXYTB-VQIMIIECSA-N	449.238	1.424	50	20	IDGD	
C[C@](O)(CC(=O)O)CC(=O)N1CCC2(CCCN(C(=O)CCBr)C2)CC1	1809070557	UTVJJKAIEFVTBQ-QGZVFWFLSA-N	433.343	1.618	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)c1c[nH]c2ncccc12	1809120817	XYXNIYCJUPGEGA-QGTPRVQTSA-N	427.892	1.877	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC2(CCCN(C(=O)CCN3CCN(C)CC3)C2)CC1	1809554977	UWHKKNGZRUOZPD-GOSISDBHSA-N	429.005	1.109	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)c1ccn2cncc2c1	1809965793	FIZTWSMWJFBPEI-UHOSZYNNSA-N	427.892	1.649	50	20	IDGD	
CN(C)c1ccc(C(=O)N2CCC3(CCCN(C(=O)c4cccc(B(O)O)c4)C3)CC2)cc1	1809978188	ZSGFSANQBNSBCG-UHFFFAOYSA-N	449.360	1.591	50	20	IDGD	
CC(=O)N/C(=C\c1ccco1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](O)CCl)n[nH]1	1814873144	STLNZETUCPRWQI-DKJKAOOUSA-N	449.895	1.772	50	20	IDGD	
CCC[C@@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1815318307	SCENXCCZYGJLNT-WBVHZDCISA-N	432.717	1.803	50	20	IDGD	
CCc1ccc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)cc1	1815343586	BLPPZEWPXPCAMW-GOSISDBHSA-N	449.341	1.925	50	20	IDGD	
O=C(CCNC(=O)c1ccc[nH]1)N[C@H]1CCc2nc(NC(=O)[C@@H](F)Cl)sc2C1	1817116497	BLVAEQKABGIBRS-LKFCYVNXSA-N	427.889	1.738	50	20	IDGD	
CCc1ncccc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1	1817471297	UGVNENISZZGZSD-HXUWFJFHSA-N	447.304	1.667	50	20	IDGD	
COc1cccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)c1	1817472587	NUVHGEVTTBFKRL-HXUWFJFHSA-N	448.288	1.718	50	20	IDGD	
CC(=O)C[C@H](C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1	1817474836	HJPRWACBHXKDBN-SCLBCKFNSA-N	426.282	1.011	50	20	IDGD	
O=C(CCc1cccnc1)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1817631333	YVGRABWGYOFDCV-HXUWFJFHSA-N	447.304	1.423	50	20	IDGD	
Cc1nc[nH]c1CSCC(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1	1819320918	VIWGBMCDYLCJPC-CABCVRRESA-N	440.957	1.966	50	20	IDGD	
C=CCSCC(=O)N[C@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1	1819793159	LLAZIZCXGFGJBO-NSHDSACASA-N	446.558	1.287	50	20	IDGD	
CC(C)O[C@H](C)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1	1819798122	WNZOEVFQVHFMDA-VXGBXAGGSA-N	446.533	1.181	50	20	IDGD	
C[C@H](NC(=O)c1ccccn1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1	1821662986	XGVIHYUJAWHQGM-RCBQFDQVSA-N	448.911	1.215	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)C(=O)Nc2cccnc2)[nH]n1	1822368656	CAYHEGUNLUJEOO-HIFRSBDPSA-N	434.884	1.689	50	20	IDGD	
C[C@](O)(CC(=O)O)CC(=O)Nc1cc([C@H]2CCCCN2C(=O)CO[Si](C)(C)C)[nH]n1	1822410437	PQVYFTUPVLFTAF-AUUYWEPGSA-N	440.573	1.869	50	20	IDGD	
O=C(/C=C/C1CCCC1)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2	1822936254	JKMLTJDAICLADP-YRYLYKBFSA-N	439.346	1.795	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H]2CCC(=O)N2)CC1	1824094681	XUWGCYFLWBBGRZ-NUEKZKHPSA-N	428.371	1.916	50	20	IDGD	
CCNC(=S)NCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)C(C)(C)CCl)CC2	1824492898	PLRSSQUOBPHVMC-JTQLQIEISA-N	432.015	1.804	50	20	IDGD	
C=CCC(F)(F)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCC(=O)NN(C)C)CC2	1825257958	YFDXSYPINCWIOA-NSHDSACASA-N	429.493	1.640	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1c(F)c(C)nn1C)CC2	1825993576	KUIDAHLNKIRURF-UWVGGRQHSA-N	429.905	1.804	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cn(C)nc1OC)CC2	1825994445	ULTFQFMPEWUWEY-GXSJLCMTSA-N	427.914	1.365	50	20	IDGD	
CNC(=S)NCCC(=O)N1CCC([C@@H]2CCCCN2C(=O)CCBr)CC1	1826359043	UGCHETVYJHGGPY-HNNXBMFYSA-N	447.443	1.875	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@H](Cl)COC)CC1	1828876644	UPDCSUOUVGEQBC-OIISXLGYSA-N	430.977	1.568	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccnc3Cl)CCO2)C1	1829501731	QWDRRRVEGJZACQ-PXAZEXFGSA-N	446.729	1.588	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(F)c3)C2)C1	1830543001	GZMIPNYHDVBOLQ-AUUYWEPGSA-N	443.313	1.927	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)cc1Cl	1830720366	YIYUFJXFPLJMDC-QFBILLFUSA-N	431.316	1.318	50	20	IDGD	
O=C(c1csc2c1CCCC2)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1830731071	HPVLYFSNQHKIDA-OXJNMPFZSA-N	442.965	1.297	50	20	IDGD	
CC(C)Cc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)cc1	1830733700	RIMNHDKAFTVEJK-DENIHFKCSA-N	438.952	1.555	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C1(COC)CC1)CCO2	1831383208	KPSZSJBLRCGINX-KDOFPFPSSA-N	433.343	1.043	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)COc3ccccc3C#N)C2)C1	1831658738	HNUZOFOEEUYXBM-AVRDEDQJSA-N	449.935	1.801	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)C(Cl)Cl)CC1	1831878290	CKQJKNIGNANTEI-HNNXBMFYSA-N	442.347	1.722	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)/C=C/c3ccoc3)CCO2)C1	1832652348	FUVXRNUTYRHZQA-IMBDGTDHSA-N	427.295	1.533	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3nnc(C)s3)CCO2)C1	1833020880	QNIWHSCXMFQBLP-RDTXWAMCSA-N	430.958	1.253	50	20	IDGD	
COc1ccc(C(=O)N2CCC(N3CCC(NC(=O)C(C)(C)CCl)CC3)CC2)nn1	1833214569	YFSRWYMNBOAJDI-UHFFFAOYSA-N	437.972	1.935	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3c(F)ccnc3Cl)CC2)CC1)[C@@H](O)CCl	1833307850	AQENISDRETZPRY-HNNXBMFYSA-N	447.338	1.659	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)[C@H](O)NC(=O)OCC)CC2)CC1	1833533755	ORXBZENTNQNUHC-WMZOPIPTSA-N	446.976	1.030	50	20	IDGD	
CCOc1cnc(C(=O)NC2CCN(C3CCN(C(=O)[C@H](F)Cl)CC3)CC2)cn1	1833950942	ORPPSPNCXNTYOM-KRWDZBQOSA-N	427.908	1.595	50	20	IDGD	
Cc1cc(C(=O)NC2CCN(C3CCN(C(=O)[C@H](C)Br)CC3)CC2)on1	1834209984	QOCRKBGHYXHMAZ-ZDUSSCGKSA-N	427.343	1.952	50	20	IDGD	
Cc1cc(C)nc(C(=O)N2CCOC[C@]3(CN(C(=O)CCBr)CCO3)C2)c1	1834822537	UDCCIDWECGMIIK-IBGZPJMESA-N	440.338	1.553	50	20	IDGD	
C[C@@H](Oc1ccccn1)C(=O)N1CCC(N2CCC(NC(=O)[C@H](F)Cl)CC2)CC1	1835082767	DYJORTSVKYGIEH-KDOFPFPSSA-N	426.920	1.955	50	20	IDGD	
Cc1nc(F)ccc1C(=O)NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836028263	NWGYRBIZRGMHOA-QGZVFWFLSA-N	426.920	1.314	50	20	IDGD	
C#CCO[C@H](C)C(=O)N1CCC(N2CCC(NC(=O)[C@H](F)Br)CC2)CC1	1836413381	FBNHHFYWUPMGDP-CJNGLKHVSA-N	432.334	1.287	50	20	IDGD	
CC(C)N[C@H](C(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)C(C)C	1836716709	KQLLIOLOOPFPTF-OALUTQOASA-N	432.005	1.607	50	20	IDGD	
Cc1c(F)ccc(C(=O)N2CCC(OC3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)c1N	1836716811	RLIGRSVMNJUZAK-SFHVURJKSA-N	441.931	1.928	50	20	IDGD	
O=C(c1cc2ncccc2[nH]1)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836719327	PWHMULOVKCSZBG-IBGZPJMESA-N	434.924	1.775	50	20	IDGD	
Cc1cc(C(N)=O)cc(C)c1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1837435820	DTKXXADZCXQGDV-JXFKEZNVSA-N	441.887	1.007	50	20	IDGD	
COCCC(=O)N1CCC(OC2CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CC2)CC1	1837764330	XOFBNKIXMCINTH-LFVJCYFKSA-N	447.536	1.156	50	20	IDGD	
CC(C)/C=C/C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1	1837920786	FIVHDLXTYYFLRW-FPYGCLRLSA-N	428.338	1.191	50	20	IDGD	
C[C@H](C(=O)N1CCC(OC2CCN(C(=O)[C@@H](F)Cl)CC2)CC1)[C@H]1SC(=N)NC1=O	1838083512	UPALSBYHBUCGAF-ZLKJLUDKSA-N	448.948	1.322	50	20	IDGD	
CN(C)c1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)cc1	1838963827	AZMXMPHVIPSDHT-IBGZPJMESA-N	430.332	1.626	50	20	IDGD	
O=C(c1cc(C2CC2)on1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839197266	OHUSHIVVJPEQAB-PBHICJAKSA-N	446.273	1.313	50	20	IDGD	
O=C(C(Cl)Cl)N1CCOC[C@]2(C1)CN(C(=O)C1(Br)CC1)CCO2	1839208567	VFBOZNHKWNLZJL-ZDUSSCGKSA-N	430.126	1.174	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccn4nccc34)CCO2)C1	1839538185	XNBOCDXPEXRCNP-DYESRHJHSA-N	434.924	1.812	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3c(C)ccn3C)C2)C1	1839965758	JTTCGWAVEDBUGQ-DNVCBOLYSA-N	442.354	1.577	50	20	IDGD	
Cc1nc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)c(C)s1	1840186839	WKSMFBZHMVQPEJ-KRWDZBQOSA-N	436.361	1.563	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](CCN)C(=O)N1CC2(CCCN2C(=O)C(C)(C)CCl)C1	1841225901	WQKXNDGMBIUYHP-CQSZACIVSA-N	430.977	1.697	50	20	IDGD	
COCCOCCOCCOCC(=O)N1CC2(CCCN2C(=O)C(C)(C)CCl)C1	1841227463	LCOMTBTXJXKJFI-UHFFFAOYSA-N	434.961	1.151	50	20	IDGD	
O=C(c1cn2c(C(F)(F)F)cccc2n1)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1	1841353190	JRISQHDIJKKWAA-GFCCVEGCSA-N	430.814	1.770	50	20	IDGD	
COCCOCC(=O)N1CCCC12CN(C(=O)[C@@H](Br)Cc1ccccc1)C2	1842777129	KZBWEWMUEAYGIL-KRWDZBQOSA-N	439.350	1.859	50	20	IDGD	
O=C(Cc1cccc(C(F)(F)F)c1)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843014926	QPNJJEDIYYQVKS-UHFFFAOYSA-N	446.234	1.445	50	20	IDGD	
O=C(CN1C(=O)COc2ccc(Cl)cc21)N1CC2(CCCN2C(=O)[C@H](F)Cl)C1	1843362152	GANVVYRHXOFVTM-INIZCTEOSA-N	430.263	1.803	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC12CN(C(=O)[C@@H]1C[C@@]13C(=O)Nc1ccccc13)C2	1846178973	DCRYWFQGEGQMHV-VQZRKKFQSA-N	432.318	1.883	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)CCn2cncn2)C1	1846546551	GXZXQYJPLBZBFW-UHFFFAOYSA-N	442.432	1.019	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H]1CN(C(=O)OC(C)(C)C)CCO1	1847640236	FDUYURYHXTUBNG-UGUYLWEFSA-N	429.945	1.842	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)[C@@H]2CCCN(S(=O)(=O)c3ccc(F)cc3)C2)cc1	17113314	LLDYJFKJRSVDJU-MRXNPFEDSA-N	449.504	1.761	50	20	IDGD	
CN(CC(=O)NNC(=O)CCNC(=O)OC(C)(C)C)S(=O)(=O)c1ccc(Cl)cc1	17408005	QCODKSSFIOCTKR-UHFFFAOYSA-N	448.929	1.023	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CCn2cnc3ccccc3c2=O)cc(OC)c1OC	27068004	NPJPRAXNBLSSQQ-UHFFFAOYSA-N	426.429	1.274	50	20	IDGD	
COc1ccc(CN(C)C(=O)NNC(=O)CNC(=O)c2cccs2)cc1OC(F)F	725872203	BOEJAXGOEGJUKR-UHFFFAOYSA-N	442.444	1.961	50	20	IDGD	
O=C(NNC(=O)c1ccc(NS(=O)(=O)/C=C\c2ccccc2)cc1)C(=O)NC1CC1	726619376	NNNJAHICVIROEZ-SEYXRHQNSA-N	428.470	1.139	50	20	IDGD	
O=C(NNc1nc(-c2ccccc2)no1)c1ccc2c(c1)S(=O)(=O)N(C1CC1)C2=O	728081814	RNSIYVMQNOXZIY-UHFFFAOYSA-N	425.426	1.800	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)COc3cccc([N+](=O)[O-])c3)cc2)CC1	728213709	HLMVPQLWPRHTIA-UHFFFAOYSA-N	449.489	1.053	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)N2CCC[C@@H]2C(=O)NNC(=O)CC(C)(C)C)o1	728609832	IZPHSKYWIWGJEL-GFCCVEGCSA-N	429.495	1.193	50	20	IDGD	
CSCC[C@H](C(=O)NNC(=O)c1cccc(C#N)c1)N1C(=O)[C@@H]2CCCC[C@H]2C1=O	728828189	KMWGUUSYVSPLCK-BRWVUGGUSA-N	428.514	1.616	50	20	IDGD	
CSCC[C@H](NC(=O)COc1ccccc1)C(=O)NNC(=O)c1cccc(C#N)c1	728872663	PPHLZSVKSGHRFC-SFHVURJKSA-N	426.498	1.636	50	20	IDGD	
CS(=O)(=O)CCNC(=S)NNC(=O)COc1ccc(OCc2ccccc2)cc1	729157735	HQPQXNSXALVIHC-UHFFFAOYSA-N	437.543	1.184	50	20	IDGD	
Cc1ccc(-c2nn(-c3ccccc3)cc2C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)o1	729276406	DXGIHFJEUFLYJD-ZDUSSCGKSA-N	431.474	1.139	50	20	IDGD	
CCOC(=O)C1=NN(c2ccccc2)[C@@H](C(=O)NNC(=O)Cn2ccc3ccccc32)C1	729540652	JODLGJSZDQNUKL-HXUWFJFHSA-N	433.468	1.987	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(C)c(C(=O)NNC(=O)CCc2ccccc2O)c1	730034099	RVWAYMFDMPUSEC-UHFFFAOYSA-N	435.502	1.019	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)C1CCN(C(=O)COc2ccccc2)CC1	730034206	BBOAGHGLZFVVIG-UHFFFAOYSA-N	425.485	1.790	50	20	IDGD	
O=C(O)c1cc(S(=O)(=O)NNC(=O)c2cccc3ncccc23)cc2c1OCCO2	730204456	WSUBEWAVLAQURZ-UHFFFAOYSA-N	429.410	1.328	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)[C@@H]1CCN(c2ccc3c(c2)OCCO3)C1=O	730514872	NSHVXLKZJTVKMY-DYVFJYSZSA-N	443.431	1.565	50	20	IDGD	
CCOC(=O)c1ccn(-c2ccccc2NC(=O)NNC(=O)COc2ccccc2O)n1	731110027	WTUYECGUHVWLMJ-UHFFFAOYSA-N	439.428	1.986	50	20	IDGD	
CC(C)(C(=O)NNC(=O)NCCCN1C(=O)NC2(CCCCC2)C1=O)c1ccccc1	731218555	DMOKTNWLLYRJDB-UHFFFAOYSA-N	429.521	1.939	50	20	IDGD	
CCCc1ccc(S(=O)(=O)N2CCN([C@H](C)C(=O)NNC(=O)CC(C)C)CC2)cc1	732196628	DPBDIFTZAHQBPD-QGZVFWFLSA-N	438.594	1.527	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)c1ccc2c(c1)S(=O)(=O)N(C1CC1)C2=O	732301898	MOVFJUGLGIEWCN-UHFFFAOYSA-N	435.483	1.154	50	20	IDGD	
O=C(NCCCC(=O)N1CCc2ccccc21)NNC(=O)c1nnc(O)c2ccccc12	732476154	ZZIQLUTUCAGENY-UHFFFAOYSA-N	434.456	1.649	50	20	IDGD	
O=C(CCc1ccco1)NNC(=O)[C@@H]1CCCN1S(=O)(=O)c1cccc([N+](=O)[O-])c1	732956203	GCKQXLHRWGNOSE-INIZCTEOSA-N	436.446	1.121	50	20	IDGD	
Cc1ccc([C@@]2(C)NC(=O)N(CC(=O)NNC(=O)c3cnn(-c4ccccc4)c3)C2=O)cc1	733107217	WDHYHQQVDMQZNS-HSZRJFAPSA-N	446.467	1.409	50	20	IDGD	
Cn1c(NNC(=O)[C@@H]2CS[C@H](Cc3ccccc3F)C(=O)N2)nc2ccccc2c1=O	733261489	CNYKYSZCULRAQF-DLBZAZTESA-N	441.488	1.359	50	20	IDGD	
O=C(CCCc1ccccc1)NNC(=O)NCCNS(=O)(=O)c1ccccc1[N+](=O)[O-]	735098745	ABPJKPXLMWCYAX-UHFFFAOYSA-N	449.489	1.226	50	20	IDGD	
CN(CC(=O)NNC(=O)C(C)(C)c1ccccc1)S(=O)(=O)c1cccc([N+](=O)[O-])c1	737555548	VEARGWOOJIUDSP-UHFFFAOYSA-N	434.474	1.341	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)CN(C)S(=O)(=O)c1cccc([N+](=O)[O-])c1)c1ccccc1	737557653	KIRXXHGDIIXLFC-KRWDZBQOSA-N	434.474	1.557	50	20	IDGD	
CN(CC(=O)NNC(=O)Cc1c[nH]c2ccccc12)S(=O)(=O)c1cccc([N+](=O)[O-])c1	737766836	TVRVYCRRXLYHFI-UHFFFAOYSA-N	445.457	1.087	50	20	IDGD	
C[C@@H](CN1CCN(c2ccccn2)CC1)NC(=O)NNC(=O)COCc1ccccc1	738485072	UHRFVLHKFFWTSA-SFHVURJKSA-N	426.521	1.139	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCCN1Cc1ccccc1)c1csc(N2CCOCC2)n1	741144225	LFSNQTYTMNHVJJ-GOSISDBHSA-N	429.546	1.795	50	20	IDGD	
CCc1nc(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)nn1-c1ccccc1F	741662082	KLYHIYGBFMYTAA-UHFFFAOYSA-N	445.480	1.337	50	20	IDGD	
Cc1nn(C)c(C)c1C[C@H](C)C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	741880520	KSSGLLDIHRKRFI-KRWDZBQOSA-N	426.565	1.575	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NC[C@@H](c2ccco2)N2CCCC2)cc1	742710448	DGEQOGHKIBFKOM-INIZCTEOSA-N	435.506	1.856	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CN(C)CCCOc2cccc(S(C)(=O)=O)c2)c1	744395410	SUJHTRYGVBGCAB-UHFFFAOYSA-N	433.530	1.560	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)N2CCN(CC(=O)NNC(=O)c3ccc(C#N)cc3)CC2)c1	744406828	KACNTVNZGIXCOE-SFHVURJKSA-N	449.511	1.239	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N2CCN(CC#N)CC2)cc1	744554321	GCVNJVSDSLCXQT-JXAWBTAJSA-N	447.499	1.009	50	20	IDGD	
CCN(C)S(=O)(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccc(C)cc2C)c1	746054077	MGVFDIHQSSHBLP-UHFFFAOYSA-N	440.547	1.535	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)CSc2nnc(S)s2)CC1	747393970	WKKWSANDJSFLSH-UHFFFAOYSA-N	448.596	1.649	50	20	IDGD	
COc1ccc(C(=O)NNc2nccn(C)c2=O)cc1S(=O)(=O)N[C@@H]1CCCC[C@H]1C	747941470	GMQDDGJJBCHAII-UKRRQHHQSA-N	449.533	1.403	50	20	IDGD	
CC(=O)N1CCN(c2ccc(C(=O)NNc3cccc([N+](=O)[O-])c3)cc2[N+](=O)[O-])CC1	748000660	RPBFXSRYWVNGAM-UHFFFAOYSA-N	428.405	1.928	50	20	IDGD	
NC(=O)CC[C@H](C(=O)NNc1ccc([N+](=O)[O-])cc1Cl)N1C(=O)c2ccccc2C1=O	748711110	OXEILRALQZEWMM-OAHLLOKOSA-N	445.819	1.622	50	20	IDGD	
CN1CCN(C(=O)CN2CCC(N(C)C(=O)/C(C#N)=C/c3ccc(F)cc3)CC2)CC1	752057282	LJXKFDKMNWPPNQ-XDJHFCHBSA-N	427.524	1.429	50	20	IDGD	
COc1ccc(C(=O)NNc2cccnc2Cl)cc1S(=O)(=O)N1CCOCC1	754480530	WOYHPONKSGFHOV-UHFFFAOYSA-N	426.882	1.521	50	20	IDGD	
Cc1ccc(S(C)(=O)=O)cc1NC(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	755533605	CLNYNNPPDLYSMN-UHFFFAOYSA-N	429.458	1.756	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2ccc(OCCOC)cc2)c2ccccc2c1=O	755692234	OMYZXSYMENCLBL-UHFFFAOYSA-N	425.445	1.908	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)Nc1cccc(-n2nnnc2SC)c1	755735615	YGXGBRTYKSLESN-UHFFFAOYSA-N	429.462	1.625	50	20	IDGD	
COc1cc(C)ccc1Oc1ccc(NC(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)cn1	755884794	CGXQYXGAWFFAEI-ZDUSSCGKSA-N	434.474	1.778	50	20	IDGD	
C[C@H](C(=O)N1CCN(S(=O)(=O)CBr)CC1)c1ccc([N+](=O)[O-])cc1F	755894203	MYUZTLNRSYZXCG-JTQLQIEISA-N	438.275	1.664	50	20	IDGD	
O=C(NNC(=O)c1c(O)cccc1O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	756768338	YZROESOYBKXMGP-UHFFFAOYSA-N	430.424	1.874	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)[C@@](C)(O)CN1Cc2ccccc2C1=O	756882739	ZKBYOVZQFIRHKI-NRFANRHFSA-N	429.498	1.342	50	20	IDGD	
C[C@@H]1C[C@@H](C)CC2(C1)NC(=O)N(CC(=O)NNC(=O)c1cc(-c3cccs3)[nH]n1)C2=O	757650981	QKKPQGUEXDSMMG-VXGBXAGGSA-N	444.517	1.646	50	20	IDGD	
C[C@H]1C[C@@H](NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)CN1Cc1ccccc1	757773558	PIJHNSULYFWWBQ-MAUKXSAKSA-N	430.530	1.697	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)Nc1cccc(F)c1I	757779259	CTJBGTLQWXAGOV-QMMMGPOBSA-N	425.198	1.635	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCC(=O)NNc1nc(O)c2ccccc2n1	758325050	NGVPNJYSRZFGQK-AWEZNQCLSA-N	430.465	1.294	50	20	IDGD	
N#CCCn1cc(/C=C(\C#N)C(=O)NS(=O)(=O)c2cnccn2)c(-c2ccccc2)n1	758579969	YSDYTXPVJQTAIB-LFIBNONCSA-N	433.453	1.666	50	20	IDGD	
CCCN(CCC)S(=O)(=O)c1ccc(C(=O)NNC(=O)C(=O)Nc2ccccn2)cc1	758834059	OYDZCKNLCTVFFT-UHFFFAOYSA-N	447.517	1.292	50	20	IDGD	
CN(C(=O)/C(C#N)=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)[C@@H]1CCNC1=O	760118868	MPUGXAHNDZGKNK-OOXMNIKJSA-N	440.891	1.333	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)N2CC[C@@H](NC(=O)NC3CC3)C2)N(C)c2ccccc21	761023967	IZCGAEBSMZMXGZ-MRXNPFEDSA-N	436.516	1.720	50	20	IDGD	
CN(C)CC(=O)NNC(=O)c1cccc(Br)c1I	761543108	FLQSOUFREZFCAT-UHFFFAOYSA-N	426.052	1.376	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)Cn3cnc(-c4ccccc4)n3)n[nH]2)cc1OC	763147441	HIUDSKTUMOIOLA-UHFFFAOYSA-N	447.455	1.814	50	20	IDGD	
O=C(Cc1cccnc1)NN=Cc1ccc(OCCn2cc(C(=O)O)nn2)c(Cl)c1	763172519	PIAJPUAXMXVACM-UHFFFAOYSA-N	428.836	1.797	50	20	IDGD	
O=C(NNC(=O)c1cc2ccccc2cc1O)C(=O)Nc1cccc(Cn2cncn2)c1	763526430	GEJXUIKDECSBEZ-UHFFFAOYSA-N	430.424	1.585	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2ccc(N3CCOC[C@H]3C)cc2)c1	763665869	QAOFBGHGCDAUCK-QGZVFWFLSA-N	440.500	1.693	50	20	IDGD	
CC[C@@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C)c(C)c2)cc1	763667088	POARSZQWYCXXNV-MRXNPFEDSA-N	440.500	1.997	50	20	IDGD	
C[S@@](=O)Cc1ccccc1NC(=O)C(=O)NNC(=O)CN1CCCc2ccccc21	763734920	NVIXPJAWIGKTQG-SSEXGKCCSA-N	428.514	1.104	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)cc(OC)c1OC	763746448	WKGLMZGTKKKYEX-UHFFFAOYSA-N	442.472	1.251	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2cnc3ccccc3c2)c2ccccc2c1=O	763785598	JPETXNJDNYMDES-UHFFFAOYSA-N	430.424	1.364	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)OC)c(C)c2)cc1	763861540	QPZPCQMWWIENIY-AWEZNQCLSA-N	443.456	1.734	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)NNC(=O)C(=O)Nc1cccc(CN2CCCC2=O)c1	763864576	DUUFTPGQXYRSOH-UHFFFAOYSA-N	433.468	1.619	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cnn(CC(F)F)c2)ccc1OC(C)C	763922165	SZWARZRMYAZWMO-UHFFFAOYSA-N	425.392	1.344	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)C(=O)Nc1ccc(-n2cccn2)cc1	763947969	HXXQFMWNQULRAC-UHFFFAOYSA-N	431.412	1.163	50	20	IDGD	
CC(C)Oc1ccc(C#N)cc1NC(=O)C(=O)NNC(=O)c1cc(Br)c[nH]1	763996448	QREBEUKXISONOA-UHFFFAOYSA-N	434.250	1.836	50	20	IDGD	
CN(C)c1nc2cc(NC(=O)C(=O)NNC(=O)c3cc(Br)cn3C)ccc2o1	764003089	YBSOCFCZMGTIDP-UHFFFAOYSA-N	449.265	1.395	50	20	IDGD	
O=C(NNC(=O)c1cccc(Br)c1)C(=O)Nc1ccccc1-n1ccnn1	764058963	LGWDUWZVAAQWEZ-UHFFFAOYSA-N	429.234	1.430	50	20	IDGD	
O=C(Cc1cc[nH]n1)NNC(=O)C(=O)Nc1nc(-c2ccccc2OC(F)F)cs1	764286526	WYTINVQGOBMBLX-UHFFFAOYSA-N	436.400	1.463	50	20	IDGD	
Cc1ccc(-c2nc3cc(F)ccc3n2C)cc1NC(=O)C(=O)NNC(=O)Cc1cc[nH]n1	764292535	DIKHCHDHSSMOEL-UHFFFAOYSA-N	449.446	1.740	50	20	IDGD	
O=C(NNC(=O)c1cc2ccccc2o1)C(=O)Nc1ccccc1S(=O)(=O)C(F)F	764342486	OVVMVJPYFFNKJG-UHFFFAOYSA-N	437.380	1.829	50	20	IDGD	
Cc1nnc(-c2ccc(NC(=O)C(=O)NNC(=O)c3cnn(-c4ccccc4)c3)cc2)o1	764345696	IUWFXMVCPMEFHM-UHFFFAOYSA-N	431.412	1.630	50	20	IDGD	
Cc1cc(C(=O)N2CCC[C@H](C)C2)ccc1NC(=O)C(=O)NNC(=O)c1ncccc1C	764386305	FCENXONRRZZZTI-AWEZNQCLSA-N	437.500	1.970	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(C)c(C)c3)[nH]n2)c(OC)n1	764389049	WBMPIWYNHRZGDX-UHFFFAOYSA-N	438.444	1.505	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H](O)c2cccc(OC)c2)c1	764584063	FQWSDUPNWIWIAU-SFHVURJKSA-N	435.502	1.220	50	20	IDGD	
CC(=NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C)c1ccc(SC(F)F)cc1	764812687	OJDYRYOGUOUHIH-UHFFFAOYSA-N	436.444	1.289	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)CNC(=O)c2cccc(Cl)c2)n[nH]1	765595595	NJXRQSQPJCAORU-UHFFFAOYSA-N	427.848	1.930	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)CN2C(=O)[C@H]3CCCC[C@H]3C2=O)n[nH]1	765603734	SQNMSKSCFQVLPP-BETUJISGSA-N	425.445	1.022	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)CN1CCN([C@H]2CCN(c3ccccc3)C2=O)CC1	766890153	XXVJMXOQGOOJLZ-QFIPXVFZSA-N	449.555	1.108	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)CN1CCO[C@@H]([C@@H](C)NC(=O)OC(C)(C)C)C1	766946067	XERJTOPNKQWIQJ-SJLPKXTDSA-N	434.537	1.299	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)c1ccc(F)cc1NS(C)(=O)=O	767288070	NMLPCARDUCERNY-UHFFFAOYSA-N	437.449	1.053	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)C(C)(C)c1ccc2c(c1)OCCO2	767308967	OCBNFDYXMBLVIJ-UHFFFAOYSA-N	426.469	1.977	50	20	IDGD	
CC(C)c1ccc2c(c1)C(=NNC(=O)Cn1cnc3c1c(=O)n(C)c(=O)n3C)CCCO2	767791912	YYSCBINCTSRLSR-UHFFFAOYSA-N	438.488	1.250	50	20	IDGD	
CC(C)N1CCc2c(c3ccccc3n2CC(=O)NNC(=O)C(=O)Nc2ccccn2)C1	768031771	NIYWWTCXUSPHOX-UHFFFAOYSA-N	434.500	1.589	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)[C@H](C)N2C(=O)NC3(CCCC3)C2=O)n[nH]1	768274034	NYIIROMLUWQRCX-LBPRGKRZSA-N	440.460	1.099	50	20	IDGD	
COc1ccc(CCN2C[C@@H](C(=O)NNC(=S)Nc3ccccn3)CC2=O)cc1OC	768581846	VYIIHFYNWICJMA-HNNXBMFYSA-N	443.529	1.508	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)[C@@H]1c2ccccc2CCN1C(=O)OC(C)(C)C	769231002	UVHMEXMVARWQSC-KRWDZBQOSA-N	432.521	1.973	50	20	IDGD	
Cn1ncc(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)c1Cc1ccccc1	770109190	AVIIFNMXPTXJRZ-UHFFFAOYSA-N	447.904	1.387	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)NCCCS(=O)(=O)c3ccccc3)nc21	770361501	GGOPCXMADGUEHK-UHFFFAOYSA-N	447.521	1.777	50	20	IDGD	
O=C(NNC(=O)N1CCC(Cc2cccnc2)CC1)c1csc(N2CCOCC2)n1	770754998	YZSBQWVQQMQJEI-UHFFFAOYSA-N	430.534	1.684	50	20	IDGD	
O=C(NNC(=O)C(F)(F)Oc1ccccc1)C(=O)Nc1ccnn1-c1cccc(F)c1	770770613	AJARRSLLFMSOKI-UHFFFAOYSA-N	433.346	1.769	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNS(=O)(=O)c1ccc(OCC(=O)O)cc1	773263812	HXZGYTIRKODDQD-LLVKDONJSA-N	428.850	1.580	50	20	IDGD	
Cc1cnn(-c2ccc(C(N)=O)cc2NC(=O)C(=O)NNc2ccc3ccccc3n2)c1	773662509	WWWFXGNSNVBMTO-UHFFFAOYSA-N	429.440	1.910	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)NCCOc1ccc(NS(C)(=O)=O)cc1	773778528	GOWCIJPFVAHPHT-UHFFFAOYSA-N	436.490	1.019	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)c2ccc(S(=O)(=O)N[C@H](C)CC)cc2)nc1C	778428939	FWBGDJPJMSWXKO-GFCCVEGCSA-N	435.506	1.795	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)c1ccc(=O)n(Cc2ccccc2Cl)c1	778436680	NNWNGALJRAEEBW-UHFFFAOYSA-N	434.880	1.836	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)N[C@H](CO)c1ccc(C(F)(F)F)cc1	778641700	RVLLIWIZDKTFRQ-GFCCVEGCSA-N	430.408	1.561	50	20	IDGD	
COC(=O)c1ccccc1NNC(=O)C1CCN(S(=O)(=O)c2ccc(C#N)cc2)CC1	780730890	SPZCIGXDMKYYBB-UHFFFAOYSA-N	442.497	1.889	50	20	IDGD	
CCC1(C=NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)CCOCC1	781117373	QKBMAXICFJOKPT-UHFFFAOYSA-N	437.562	1.949	50	20	IDGD	
CC[C@@H]1C[C@@H](CC(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)CCO1	782118801	WHRZZLWOOIYENO-JKSUJKDBSA-N	425.555	1.056	50	20	IDGD	
Cc1coc2ccc(NC(=O)C(=O)NNc3ccc(S(=O)(=O)NC(C)C)cn3)cc12	783265164	VXZMAUXVGRKOTJ-UHFFFAOYSA-N	431.474	1.905	50	20	IDGD	
CNC(=O)c1ccc(OC)c(NC(=O)C(=O)NNc2nc(-c3ccc(Cl)cc3)no2)c1	784795756	UQCQKNVKYBQVJA-UHFFFAOYSA-N	444.835	1.840	50	20	IDGD	
CS(=O)(=O)CCOc1ccc(Cl)cc1NC(=O)C(=O)NNc1ncccc1Cl	784815360	VEPKRSADEVZMNE-UHFFFAOYSA-N	447.300	1.894	50	20	IDGD	
C[C@@H](NC(=O)OC(C)(C)C)c1ccc(NC(=O)C(=O)NNc2nccn(C)c2=O)cc1	785090583	TXAGUWNARDAEDA-GFCCVEGCSA-N	430.465	1.448	50	20	IDGD	
CC(C)(C)n1cc(C#N)c(NC(=O)C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)n1	785100173	SKUJXBVIVAGMLX-UHFFFAOYSA-N	445.430	1.762	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2O1)C(=O)Nc1cc(F)cc(Br)c1F	787542132	GLZCZOJJEQDZLL-CYBMUJFWSA-N	440.200	1.817	50	20	IDGD	
COc1ccc(C(=O)Nc2cccc(NC(=O)NN(C)C)c2)cc1S(=O)(=O)N(C)C	788253383	GPXJGGPNPXJRRU-UHFFFAOYSA-N	435.506	1.796	50	20	IDGD	
C[C@@H](CC(=O)NNc1nnc(-c2ccccn2)s1)/N=C1/NS(=O)(=O)c2ccccc21	788556315	IQIFSYSXNAKFOV-NSHDSACASA-N	443.514	1.561	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1nc([C@H]2C[C@H]3CC[C@H]2C3)cs1	789756902	HVIFHBIZCUYJOW-SRVKXCTJSA-N	447.542	1.624	50	20	IDGD	
CCOc1ccc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)c3[nH]nnc3C)cc2)cc1	789866775	CALJHIZMLBPQNA-UHFFFAOYSA-N	444.473	1.387	50	20	IDGD	
COc1cc(NNC(=O)c2ccc(S(=O)(=O)CC(=O)N(C)C)cc2)ccc1Cl	790169035	UMUSJCRVCYKSHU-UHFFFAOYSA-N	425.894	1.967	50	20	IDGD	
CCc1ccccc1OCC(=O)NNS(=O)(=O)c1cc(C(=O)O)c(OC)cc1Cl	790387756	UJDJGEDCVISWHQ-UHFFFAOYSA-N	442.877	1.998	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)NCc2cccc(N3C(=O)N[C@](C)(C4CC4)C3=O)c2)n1	790846646	NTXUOMYPPNCOMX-JOCHJYFZSA-N	436.472	1.759	50	20	IDGD	
CO[C@H]1CCOc2c(NC(=O)C(=O)NNC(=O)c3ccc4c(c3)OCCO4)cccc21	790952104	ODPWSKDXQJJSIF-HNNXBMFYSA-N	427.413	1.328	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2cc(F)ccc2N2CCCN(C(C)=O)CC2)cc1	790955001	OYAFFKMTQWHRLS-UHFFFAOYSA-N	443.479	1.975	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)c2cnn3c2C[C@@H](CNC(C)=O)CC3)cc1OC	792736331	KMMVPHAMCHSLQL-HNNXBMFYSA-N	443.504	1.454	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)C1(COC)CCN(C(=O)OC(C)(C)C)CC1	793552829	CDCLCHAYZRCMQX-UHFFFAOYSA-N	428.530	1.102	50	20	IDGD	
CNS(=O)(=O)N1CCC(C(=O)NNC(=O)c2cc(C)n(-c3ccccc3)c2C)CC1	794756990	IHJNJCSXGCYPGD-UHFFFAOYSA-N	433.534	1.031	50	20	IDGD	
Cc1nn(Cc2ccccc2)c(N)c1C(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	794776597	ZKOCKEPAGIKPLC-UHFFFAOYSA-N	431.456	1.144	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)c(OC)c(C)c1OC	796989612	IMOKKWBXYXFJDN-UHFFFAOYSA-N	442.428	1.057	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)CNC(=O)OCc2ccccc2)cc1Cl	797369422	VYWSVLOILPRDQM-UHFFFAOYSA-N	434.836	1.361	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2ccc(C(=O)OC)c(OC)c2)c2ccccc2c1=O	797674690	PRROMIZURFNSBZ-UHFFFAOYSA-N	439.428	1.678	50	20	IDGD	
Cc1csc([C@](O)(CC(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)C(F)(F)F)n1	798308422	ZFFHVODPIFJYNR-QGZVFWFLSA-N	444.435	1.994	50	20	IDGD	
C[C@@H]1[C@@H](NC(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)CC(=O)N1Cc1ccccc1	798532286	PDNQYMFTIJTBPM-WBMJQRKESA-N	427.417	1.434	50	20	IDGD	
O=C(COc1ccc(OCc2ccccc2)cc1)NNC(=O)C(=O)Nc1cncc(F)c1	799256991	DQGRRAPYGZYSGX-UHFFFAOYSA-N	438.415	1.965	50	20	IDGD	
O=C(COC(=O)c1nn(-c2ccccc2F)cc1O)NNC(=O)c1cccc(Cl)c1	801380175	ROHOSHBOLQYVNP-UHFFFAOYSA-N	432.795	1.988	50	20	IDGD	
O=C(N=c1cc[nH]cc1)NNC(=O)[C@H]1CCCN(C(=O)N2CCc3sccc3C2)C1	802031220	FKYVLSBIZKDSKM-HNNXBMFYSA-N	428.518	1.608	50	20	IDGD	
O=C(NC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1)NNC(=O)c1cc([N+](=O)[O-])ccc1O	802337756	LAVUMKCLSYBNHS-CQSZACIVSA-N	441.400	1.373	50	20	IDGD	
CCCN(NC(=O)[C@@H](C)NS(=O)(=O)c1ccc(C(N)=O)cc1)C(=O)OC(C)(C)C	804594628	JCNSJVVSUCFRMX-GFCCVEGCSA-N	428.511	1.131	50	20	IDGD	
CC(C)(CNC(=O)NNC(=O)COc1ccc(Br)cc1)N1CCOCC1	807002401	XGBCWXVIOOWAHD-UHFFFAOYSA-N	429.315	1.269	50	20	IDGD	
O=C(NNc1nc(Br)cn2ccnc12)[C@@H]1CCS(=O)(=O)c2ccccc21	807014422	FPYKQESFNGOAJR-LLVKDONJSA-N	436.291	1.896	50	20	IDGD	
CCNC(=O)N(C)NS(=O)(=O)c1cc(Cl)c(OCC(=O)N(C)C)c(Cl)c1	808306796	DJBCPENUEUZIES-UHFFFAOYSA-N	427.310	1.315	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc(S(=O)(=O)NC3CC3)ccc2C)cc1	811904594	IBRAPXGLTAYNMS-UHFFFAOYSA-N	430.486	1.144	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccc(Br)cn2)cc1	813033838	NOJPNQHDEOROCW-UHFFFAOYSA-N	442.295	1.176	50	20	IDGD	
CC(C)(c1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2CCc3nncn3C2)cc1)C(F)(F)F	815692312	OGQKCGSCIOUYDF-LLVKDONJSA-N	438.410	1.467	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2cccc(Cl)n2)c(C)c1S(=O)(=O)NC1CC1	815727390	WEBCZWMWQUBJMM-UHFFFAOYSA-N	437.909	1.874	50	20	IDGD	
CC(=O)Nc1ccc(C)c(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)N(C)C)c1	815751904	UCMAETAPKQMGEY-UHFFFAOYSA-N	433.490	1.286	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)CNC(=O)OCC(F)(F)F)c1	818767896	VIDPVWPZEXPFFP-UHFFFAOYSA-N	428.161	1.967	50	20	IDGD	
O=C(CC1CC1)NNC(=O)[C@@H]1Cc2ccccc2CN1S(=O)(=O)c1ccc(F)cc1	819136559	ZYCQRHODXBVTJP-IBGZPJMESA-N	431.489	1.889	50	20	IDGD	
O=C(CNC(=O)Nc1cccc(Cl)c1)NNC(=O)C(=O)NCc1ccc(Cl)cc1	857479667	NQMDWQBKZBQUHR-UHFFFAOYSA-N	438.271	1.579	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)NC2CCN(S(C)(=O)=O)CC2)c(C)n1C[C@H]1CCCO1	913086883	DGJHHTVSLFTOOG-VOMPUTFMSA-N	434.562	1.731	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CCN2CCN(c3cccc(C)c3)CC2)cc1OC	914684490	UOKTUTBZMAHUHC-UHFFFAOYSA-N	426.517	1.986	50	20	IDGD	
COCCOc1ccc(S(=O)(=O)NNC(=O)c2cc(Br)c[nH]2)cc1C	914877354	VXIFEDKZRFIAQG-UHFFFAOYSA-N	432.296	1.734	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc3c(c2)CCCC(=O)N3)c1	915059894	CYKAMWQACHBQOL-UHFFFAOYSA-N	430.486	1.287	50	20	IDGD	
Cc1nn(C(C)(C)C)c2nc(C(C)C)cc(C(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)c12	915831979	DPKWBDQJRPGWHW-CYBMUJFWSA-N	435.550	1.814	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1	915925777	XACXMQVBQGQFQM-UHFFFAOYSA-N	449.489	1.770	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCc1ccc(OC(C)C)nc1	916511947	JCXXYOOIQBIWQO-UHFFFAOYSA-N	434.522	1.615	50	20	IDGD	
CC(C)NC(=O)Nc1ccc(CNC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1	916601130	BKLJXGNWJBRINL-UHFFFAOYSA-N	447.517	1.764	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)c2ccc3c(c2)S(=O)(=O)N(C2CC2)C3=O)cc1	916746332	LQTWXLZLKYVJIK-UHFFFAOYSA-N	445.522	1.855	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCC[C@@H](C(=O)Nc3ccccn3)C2)cc1OC	917400623	XHXGIMGDTPCTSQ-MRXNPFEDSA-N	441.488	1.211	50	20	IDGD	
Cn1c(=O)oc2cc(S(=O)(=O)NNC(=O)c3ccc(F)cc3Br)ccc21	917754625	DKUXJRMLFHQHRF-UHFFFAOYSA-N	444.238	1.656	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2cc(C(=O)O)ccc2F)ccc1OC(C)C	918063389	VZEHSWFOPPKWPL-UHFFFAOYSA-N	426.422	1.943	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)[C@@H]1CC(=O)N(c2ccc3c(c2)OCCO3)C1	919819972	CRLJYTAUWNQPQA-OAHLLOKOSA-N	425.441	1.209	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)NCc1cccc(CN2CCN(C)CC2)c1	1251577160	NOXGZNTVHGPZKO-UHFFFAOYSA-N	441.532	1.352	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)[C@@H]1COc2ccc(F)cc2C1	1253774981	GVOJHFHLOIEGTJ-HNNXBMFYSA-N	435.477	1.541	50	20	IDGD	
Cn1cc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c(C(F)(F)F)c1	1254676773	YREXTNUFSXGACI-AWEZNQCLSA-N	427.335	1.188	50	20	IDGD	
Nc1cnnc(NNC(=O)CNC(=O)c2ccccc2I)c1Cl	1324057855	KIHOQZCZLYFEQD-UHFFFAOYSA-N	446.636	1.190	50	20	IDGD	
O=C(c1cncc(OCC(F)F)c1)N1CCN(S(=O)(=O)CBr)CC1	1325377791	PPLCDXWNGVKZBA-UHFFFAOYSA-N	428.255	1.166	50	20	IDGD	
CN1CCN(Cc2cccc(CNC(=O)NNC(=O)COc3ccccc3F)c2)CC1	1326131182	YZHQJHZNLWRNFH-UHFFFAOYSA-N	429.496	1.483	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNS(=O)(=O)CCOCC(F)(F)F)CC1	1330029227	NABNQCHMGIYEED-UHFFFAOYSA-N	433.449	1.163	50	20	IDGD	
CC(=O)N[C@@H](C)c1ccc(S(=O)(=O)NNC(=O)c2cncn2-c2ccccc2)s1	1337637675	IXNOBWQUOBESRI-LBPRGKRZSA-N	433.515	1.754	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(O)nc(O)c2)C1	1777852765	SRRGNDLFOOTFQZ-ZNZDAUKMSA-N	446.331	1.857	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc3n(n2)CCCC3)C1	1779038506	BYBJBAAQWSMFAF-YRISNDGFSA-N	438.956	1.601	50	20	IDGD	
Cc1cccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C3)c1	1780395932	BTWZATDYONHGJU-AUSIDOKSSA-N	430.549	1.496	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](NC(=O)OC)c1ccccc1)CCO2	1781211052	HGAKQDJZOXSVHA-CBGDNZLLSA-N	437.924	1.931	50	20	IDGD	
COC(=O)C12CC(C(=O)N3CCO[C@@]4(CCN(C(=O)[C@](C)(Cl)CCl)C4)C3)(C1)C2	1781232578	KTEBOCUZNGBCJP-LWSMDNFKSA-N	433.332	1.396	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc4nn[nH]c4c3)CCO2)C1	1781233222	RKJDRKWSJWGKOG-ZWKOTPCHSA-N	426.304	1.638	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Br)C2)c1cnn2c1CCC2	1781287195	GWEOVLQVXZKONQ-RVKKMQEKSA-N	443.317	1.647	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](Cl)COC)C1	1782178573	AVTWWQZLTXGXDW-DEXNDLTESA-N	434.917	1.316	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(CCN(C(=O)[C@H]3CC(c4ccccc4)=NN3)C2)C1	1782601009	GAIFJXDBTZYZKW-DENIHFKCSA-N	444.608	1.434	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cn(C)nc3OC)CCO2)C1	1783344994	VQLZOVOFWKPXRA-CXAGYDPISA-N	429.315	1.046	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)C#CC3(O)CCCCC3)CCO2)C1	1783349644	QBADVMNWOOACEJ-JXFKEZNVSA-N	441.366	1.688	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)Cc3ccc(Cl)cc3OC)CCO2)C1	1783880175	CRTFHIBJCOPDTM-UZLBHIALSA-N	445.343	1.975	50	20	IDGD	
COc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]3C2)nn1C	1783969351	GMWHWMPMKFXGIJ-ABHRYQDASA-N	443.342	1.053	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnnc(Cl)c3)C[C@@H]21	1783969358	LMUNKKDVPGCMMS-XWUBHJNHSA-N	445.745	1.754	50	20	IDGD	
O=C(/C=C/c1cccnc1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21	1785377839	XIZRPNNVBJYCIU-FFWQDODQSA-N	426.286	1.765	50	20	IDGD	
COc1cnc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)Br)C[C@@H]32)c(F)c1	1785738634	CATFPZOBIWKUMS-UHXUCMFUSA-N	444.301	1.606	50	20	IDGD	
CCOC(=O)/C=C/C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](Br)CC)C[C@@H]21	1786375885	KNPOEWAVWFXMGZ-HTKIHOTJSA-N	431.327	1.259	50	20	IDGD	
Cn1cc(CCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCBr)[C@H]3C2)cn1	1786405850	GAOIGQMMNCFAPA-JYJNAYRXSA-N	427.343	1.117	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC1(c2ccc(NC(=O)CNCP(=O)(O)O)cc2)CCC1	1787967408	QGHOXDRNNIVIOP-UHFFFAOYSA-N	443.513	1.697	50	20	IDGD	
Cc1c(C(=O)NC2(c3ccc(NC(=O)c4cccc(B(O)O)c4)cc3)CCC2)cnn1C	1788146047	XALOIGZNCCOLNH-UHFFFAOYSA-N	432.289	1.470	50	20	IDGD	
C[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]21)n1ccccc1=O	1788750080	XODGIYHSJZLRAJ-UHMUHUCWSA-N	444.359	1.625	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC1(c2ccc(NC(=O)[C@@H](O)N3CCOCC3)cc2)CCC1	1789555466	MCGDQTVMZKYTCR-HXUWFJFHSA-N	435.597	1.623	50	20	IDGD	
C[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Cl)C[C@@H]21)N(C)C(=O)OC(C)(C)C	1789758598	YYEYHLZQVRVSDY-CAEXGNQWSA-N	435.924	1.756	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(C)(C)n3nc(C)ccc3=O)C[C@@H]21	1789863367	PEOQKTUWTHCJBD-QAETUUGQSA-N	438.956	1.284	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]2C1)N1C[C@H]2C[C@@H]2C1	1789867840	GZYBEDQBAVMZEX-MDYYIRAXSA-N	432.392	1.543	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3c(O)cc(O)cc3O)[C@H]2C1	1790156628	IUZVWBPVHSNLEW-AVGHVZBRSA-N	447.315	1.633	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3c(C)nn(C)c3C)C[C@@H]21	1790958067	GPLXDJVGPPRFPO-VGWMRTNUSA-N	441.370	1.804	50	20	IDGD	
O=C1Cc2cc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]4C3)ccc2N1	1791294868	UJTUQYKSDFJTEK-WHOFXGATSA-N	426.300	1.578	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4cccnc4nc3O)C[C@@H]21)C(Cl)Cl	1791296594	BUTKMLOSFXESJJ-UBHSHLNASA-N	439.299	1.732	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1ccc(C2(NC(=O)CN(CCO)CCO)CCC2)cc1	1791435247	AOJMTOLCFQQRTP-CQSZACIVSA-N	442.354	1.191	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21	1792256351	LJXYPSCPCIRQLR-YXWQFLTLSA-N	435.924	1.805	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1n[nH]c3c1CC[C@H]3C)C2	1792867886	JQPKFEPEBYNHDP-ZRTFPUAOSA-N	439.354	1.694	50	20	IDGD	
Cc1ccc(C(=O)C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)CBr)cc1	1792872265	UJDSDVCYDXLPCW-MXASKKJJSA-N	437.334	1.798	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1C[C@@H]1c1ccc(F)cc1)c1ccc(B(O)O)cc1	1792910593	YWADVTCRFXBBCC-PVIWCNJMSA-N	436.292	1.561	50	20	IDGD	
CCOc1c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](O)CCl)cnc2c1cnn2C	1793109599	BNHHGAKVZHSDMO-ZWUHOBOKSA-N	435.912	1.219	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3nc(CO)[nH]c3c1)C2	1793449528	DMKDHDNVHXECCJ-NXEZDXNNSA-N	434.924	1.666	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CC(=O)N(C2CCCC2)C1	1793775390	GKBRQTZSVASSEU-DAQZSUFXSA-N	439.984	1.775	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnn(C(C)(C)C)c1	1794348329	WRWNNFKSELREJF-HNKHHVNMSA-N	441.370	1.872	50	20	IDGD	
CC(C)[C@H]1CC[C@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cccc(B(O)O)c2)CC1	1795741441	YYAVRYPNTSMBIT-IIHZSMLWSA-N	442.365	1.032	50	20	IDGD	
CC(C)OC(=O)c1ncccc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Cl	1796361359	FERYVTMJPROPPV-FAXLKDOZSA-N	427.860	1.384	50	20	IDGD	
CC(C)OC(=O)c1ncccc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Cl	1796361361	FERYVTMJPROPPV-LMWOUKEDSA-N	427.860	1.384	50	20	IDGD	
Cc1nc2ncccn2c1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2	1797004804	UDPYWFHMQPHZAA-AGGWBTHJSA-N	436.310	1.026	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnc2[nH]ncc2c1	1797349582	JBJODQLGHDNMAF-XGUBFFRZSA-N	436.310	1.335	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1nc(Cl)ccc1F)C2	1798440592	DGJTXRDBIRUNGS-ZSBIGDGJSA-N	446.870	1.438	50	20	IDGD	
CN(CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc[nH]1)NC(=O)NCc1ccccc1	1798678769	QFLGDGXTQRGXPB-REPLKXPHSA-N	438.532	1.613	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnn3ncccc13)C2	1799275000	GJAZNKVKYAQKFZ-TYYYEBLRSA-N	426.304	1.169	50	20	IDGD	
Cc1ncc(/C=C/C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Br)s1	1799352279	NULQFGCCQMBCDU-PLADZIDJSA-N	432.315	1.745	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CSC(=N)N)C2	1800332583	QXPRKCYEZPJPSW-XSDCOXNMSA-N	449.483	1.088	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc3c[nH]nc13)C2	1800640099	UYZOPJXJPDPPCI-XRGAULLZSA-N	435.322	1.940	50	20	IDGD	
Cc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)Br)ncc1[N+](=O)[O-]	1800756732	DFBBHQAWUSNWEF-OHTBPHCPSA-N	441.282	1.285	50	20	IDGD	
Cc1cc2[nH]c(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)c3ccc(B(O)O)cc3)C4)cc2s1	1800956339	ZETMPJBNGHVZQY-BJWYYQGGSA-N	437.330	1.783	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](C)NC(=O)c1ccccn1	1801263863	MECDSULOIHOGMV-LXFSFDBISA-N	437.338	1.622	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)Sc1ccccn1	1801323107	RKJOMNDWZWQTHO-LFYQSXPISA-N	427.954	1.406	50	20	IDGD	
C[C@H](NNc1ccccc1)C(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1	1803138100	WJBFIPGPQVLNNY-RKOGWWSCSA-N	445.951	1.692	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC2(CCCN(C(=O)c3cc(O)n[nH]3)C2)CC1	1809903317	SVHCYDIAJZCBJV-OEAKJJBVSA-N	441.492	1.094	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)CCn2cncn2)[C@H]1c1cccnc1	1812778767	LNDPVOICOGEKQA-RYRKJORJSA-N	449.353	1.943	50	20	IDGD	
O=C(C#Cc1ccccc1)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2	1814012447	OKKHDMZUOLTCID-GOSISDBHSA-N	445.309	1.100	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)C#CC2CC2)n[nH]1	1815117428	ANVLSYPOBVURKK-VBYICHLGSA-N	435.488	1.949	50	20	IDGD	
Cc1ccc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)cc1	1815360211	BSFFALZSZICLBG-QGZVFWFLSA-N	435.314	1.671	50	20	IDGD	
Cc1ccccc1C(=O)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1	1815361082	WJRJZHDCYCOKKB-INIZCTEOSA-N	435.314	1.671	50	20	IDGD	
Cn1cccc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1816332895	ZMKIBIJWEVSQEB-INIZCTEOSA-N	436.476	1.366	50	20	IDGD	
CC(=O)C(C)(C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1	1817473889	FIGIGRDQBZSGIS-QGZVFWFLSA-N	426.282	1.011	50	20	IDGD	
O=C(COc1cc(Cl)ccn1)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](O)CCl)CC2	1820080514	RTJGAJNKBNRFLE-CMPLNLGQSA-N	445.328	1.782	50	20	IDGD	
Cn1cccc(C(=O)N[C@H]2CCc3nc(NC(=O)CO[Si](C)(C)C)sc3C2)c1=O	1820160294	IOYPTPUOIXJHOR-LBPRGKRZSA-N	434.594	1.919	50	20	IDGD	
Cc1cc(C)cc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2ccc(B(O)O)cc2)CC3)c1	1822155013	GHEVYHMHHPFKIL-SFHVURJKSA-N	449.341	1.979	50	20	IDGD	
CC(=O)C[C@@H](C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1822335446	JKFSMCPCXRTOOM-FZKQIMNGSA-N	426.282	1.011	50	20	IDGD	
CCNC(=S)NCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](Cl)COC)n[nH]1	1822377509	XFWFJEJDRHICMU-DGCLKSJQSA-N	430.962	1.140	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H]2CCCS2(=O)=O)[nH]n1	1822377678	YLSLSHQAXRIHAP-FPMFFAJLSA-N	432.930	1.233	50	20	IDGD	
Cc1cnc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)cn1	1822413194	OBPDLFVYIXGALO-INIZCTEOSA-N	428.497	1.187	50	20	IDGD	
Cc1nc(F)ccc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1	1822414390	DKZCGRKTUUUATE-INIZCTEOSA-N	445.499	1.931	50	20	IDGD	
CC(=O)N/C(C)=C/C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1	1823008833	HROUCFWFAARHNT-XDVGGKMYSA-N	433.303	1.786	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](OC(C)=O)C(C)C)CC2	1825999659	BTTOPAVSDNMFGT-SLEUVZQESA-N	431.942	1.897	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@H]1CCc2nc(NC(=O)C3=COCCC3)sc2C1	1826174695	APFZLDGPNNSDLD-LBPRGKRZSA-N	442.501	1.062	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)CC(F)(F)F)CC1	1826676272	MJAXLZLSHWKRLF-MRXNPFEDSA-N	441.454	1.871	50	20	IDGD	
O=C(COc1cccnn1)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](F)Br)CC2	1826762999	VMKMPIBDPCHONB-SDBXPKJASA-N	444.286	1.615	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H]2CCCO2)CC1	1828925095	DHKOKLBFNCUWSV-OALUTQOASA-N	429.521	1.097	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)nc1	1830537372	FWNJSNDOPRGUNP-HNAYVOBHSA-N	440.338	1.491	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)cc1Cl	1830720364	YIYUFJXFPLJMDC-LPHOPBHVSA-N	431.316	1.318	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](OC(C)=O)C(C)C)C2)C1	1831651205	NTYKEMHLIIZXQB-SQGPQFPESA-N	432.945	1.438	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4ccnn4c3)C2)C1	1831654029	PNKKQIQJTMTVML-GHTZIAJQSA-N	434.924	1.812	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccnc4c3OCO4)C2)C1	1831654111	IKOPRORINWFCPA-QRWLVFNGSA-N	439.896	1.288	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)C3(C)COC3)CC2)CC1	1833140791	COEPQZQHRFYCGD-MRXNPFEDSA-N	430.387	1.768	50	20	IDGD	
C[C@@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)[C@@H]3CCCN3C)CC2)CC1	1833265496	YXEKJQLDFUHTCK-YJBOKZPZSA-N	443.430	1.683	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)C(C)(C)C)CC2)CC1	1833282764	HJRXLXAKIHQKAA-WMLDXEAASA-N	446.430	1.996	50	20	IDGD	
Cc1cccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)n1	1834051591	VDSWUHZJPLJGFE-WMLDXEAASA-N	430.274	1.151	50	20	IDGD	
Cc1ccnc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCBr)CCO3)C2)c1	1834821702	USFBPPYECSRMJW-GOSISDBHSA-N	426.311	1.245	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3csc(N)n3)CCO2)C1	1835796654	BDLKBABCCRGAMR-HOTGVXAUSA-N	437.349	1.032	50	20	IDGD	
CC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)c3cc4n(n3)CCCO4)CC2)CC1	1836396658	FZJBBMHMSTUAHA-KRWDZBQOSA-N	437.972	1.868	50	20	IDGD	
CC[C@H](Br)C(=O)NC1CCN(C2CCN(C(=O)Cc3cnc[nH]3)CC2)CC1	1836541926	NLDODSGOZKYVGU-KRWDZBQOSA-N	440.386	1.697	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccn4nccc4c3)CCO2)C1	1837155770	PHZHQDACNWINDS-NRFANRHFSA-N	434.924	1.669	50	20	IDGD	
CC[C@@H](C(=O)N1CCOC[C@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1)N(CC)CC	1837710157	LNMKUTVNQRTQMN-RXVVDRJESA-N	443.661	1.415	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@H]3CCCN(C)C3)CC2)CC1	1838617700	ZTYYVUVRGDULHA-QFBILLFUSA-N	429.989	1.581	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cccnc3Cl)C2)C1	1839142488	QGSFYECMYAYZGZ-HNAYVOBHSA-N	430.332	1.751	50	20	IDGD	
CCn1nc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)cc1C	1839153827	SWDIKGNKCYHXLX-OALUTQOASA-N	447.363	1.518	50	20	IDGD	
O=C(c1ccc(-n2cccn2)cc1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1839336979	CCTHRKHQIUUYKY-FXAWDEMLSA-N	436.871	1.477	50	20	IDGD	
O=C(/C=C/c1cccc(O)c1)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1839926005	FMZLDEIKIZYGBU-VZSQWMKGSA-N	429.300	1.666	50	20	IDGD	
CC(C)c1ccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)cc1	1839999971	CTPNGJFMJBIEQR-SIKLNZKXSA-N	438.952	1.409	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)C(F)(F)C(F)F)C2)C1	1840030393	KMQMKTOXVVOOHO-NOZJJQNGSA-N	435.212	1.127	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)n3cccc3)C2)C1	1840036348	IVVQQQBEBZDOTO-DAYGRLMNSA-N	428.327	1.289	50	20	IDGD	
Cc1ncc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)s1	1840036495	LPIXXBFBCGPKBJ-SJKOYZFVSA-N	446.367	1.234	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cc(C)cc(F)c3)C2)C1	1840156383	RLBAZPLKWMAEPH-RXVVDRJESA-N	442.915	1.387	50	20	IDGD	
O=C(C(Cl)Cl)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CCc4ccoc4C3)C2)C1	1840186745	OBLBCUZGBYOSID-KUHUBIRLSA-N	431.316	1.645	50	20	IDGD	
O=C(c1cc(F)c(F)cc1F)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840189360	NFQGDONEJOLASN-QGZVFWFLSA-N	441.233	1.978	50	20	IDGD	
CCOC(CC(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1)OCC	1840280132	VTZUPUMTUXOCDL-HXUWFJFHSA-N	434.961	1.497	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H](C)Cc3ccco3)CCO2)C1	1840472528	JRAWYGHSOASWBB-RIFZZMRRSA-N	428.913	1.168	50	20	IDGD	
CC[C@H](NC(C)=O)C(=O)N1CC2(CCCN2C(=O)c2cc([N+](=O)[O-])ccc2OC(C)=O)C1	1844691953	SBSPNFAFDZBVTE-KRWDZBQOSA-N	446.460	1.252	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@H]1CN(C(=O)OC(C)(C)C)CCO1)C2	1845163320	QEQREPJFAJWVTE-CABCVRRESA-N	429.945	1.843	50	20	IDGD	
C[C@H](NC(=O)c1ccccn1)C(=O)N1CC2(CCCN2C(=O)[C@](C)(Cl)CCl)C1	1845172633	VWFOCCJIXZIZTG-SCLBCKFNSA-N	427.332	1.640	50	20	IDGD	
CS(=O)(=O)Cc1ncccc1C(=O)N1CC2(CCCN2C(=O)[C@H](F)Br)C1	1845216438	QNKUNVOPBQOFOD-ZDUSSCGKSA-N	448.314	1.134	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1ccc(N2CCN(C)CC2)cc1	1847243369	REMIMXKIDFMNOY-UFYCRDLUSA-N	434.968	1.508	50	20	IDGD	
C[C@H](NC(=O)c1ccccn1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](C)CBr	1847502355	OXKKEEXEWMABHV-SDADXPQNSA-N	437.338	1.433	50	20	IDGD	
COc1ccc(CCC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)CCC(=O)NN(C)C)cc1OC	1847974403	KFYRUWHFALBUEK-ROUUACIJSA-N	446.548	1.211	50	20	IDGD	
N#C/C(=C\c1cn(CCC(N)=O)nc1-c1cccc(Br)c1)C(=O)OCC(N)=O	10238028	GORKNDVYSDNICQ-WUXMJOGZSA-N	446.261	1.123	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COc2ccc(F)cc2)cc1S(=O)(=O)NC(C)C	16069270	AIVJFXGVCFAENY-UHFFFAOYSA-N	439.465	1.361	50	20	IDGD	
COc1ccc(-c2nnc(SCC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)n2C)cc1	21366511	GQCQZLLKONAKKN-UHFFFAOYSA-N	442.457	1.952	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNS(=O)(=O)c2ccc3c(c2)NC(=O)CO3)cc1	24259977	UMFFWPLINMSVFX-GFCCVEGCSA-N	435.458	1.193	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)c2nnn(-c3cccc([N+](=O)[O-])c3)c2C)c1	24356296	IOSOHLBASVWUGG-UHFFFAOYSA-N	426.389	1.576	50	20	IDGD	
O=C(Cn1cc(Br)c(=O)[nH]c1=O)NNC(=O)c1cc2c(s1)CCCCC2	24474599	PRZHXFMSNDKUOJ-UHFFFAOYSA-N	441.307	1.091	50	20	IDGD	
O=C(NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1)c1ccc2[nH]nnc2c1	45621997	HGKXJWCILMOJLO-UHFFFAOYSA-N	442.482	1.895	50	20	IDGD	
CCn1c(NNC(=O)c2ccc(C)c(S(=O)(=O)NCC#N)c2)nc2ccccc2c1=O	726879937	DHDOBRSALITXOE-UHFFFAOYSA-N	440.485	1.284	50	20	IDGD	
CS(=O)(=O)NCCNC(=S)NNC(=O)CCCOc1ccc(Cl)cc1Cl	727065589	MZKMURQDCSGYRB-UHFFFAOYSA-N	443.378	1.197	50	20	IDGD	
Cc1c(/C=C(\C#N)C(=O)N2CCN(CC(=O)NC3CCC(C)CC3)CC2)cc(C#N)n1C	728281707	OKRJROMMNSWNID-UDWIEESQSA-N	436.560	1.951	50	20	IDGD	
Cc1ccc(C(=O)N[C@@H](C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)C(C)C)cc1	728845344	HLEILBPKFZKFAH-LJQANCHMSA-N	438.532	1.603	50	20	IDGD	
Cc1cc(=O)c(C(=O)NNC(=O)Cc2cccnc2)nn1-c1cccc(C(F)(F)F)c1	728852526	DQJSKHTVMIBSDU-UHFFFAOYSA-N	431.374	1.958	50	20	IDGD	
O=C(CCCNc1ccc([N+](=O)[O-])cc1)NNC(=O)C1CCN(c2ncccn2)CC1	728889897	SLBKEONCONERKD-UHFFFAOYSA-N	427.465	1.641	50	20	IDGD	
CN(CCNC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)C1CCCC1	729622658	SSAKPMVZMMRJBG-UHFFFAOYSA-N	437.566	1.290	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(C(=O)NNC(=S)Nc2ccc(OC)nc2)cc1	729692640	MVILWECIEAHXNT-UHFFFAOYSA-N	437.547	1.752	50	20	IDGD	
N#Cc1c(F)cccc1Oc1ccc(C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)cc1	730213517	NORNHSVDYZMHQC-ZDUSSCGKSA-N	432.433	1.621	50	20	IDGD	
C[C@@H]1CCC[C@@H](NC(=O)CN2CCN(CC(=O)NNC(=O)c3cccc(Cl)c3)CC2)C1	731214311	CLNWYFDEGAWYEE-VQIMIIECSA-N	449.983	1.414	50	20	IDGD	
CCn1c(S[C@@H](C)C(=O)NNC(=O)CC(C)C)nc2cc(S(N)(=O)=O)ccc21	731904002	BPHXQBARENPOIF-NSHDSACASA-N	427.552	1.378	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNS(=O)(=O)c1cc(C(=O)OC)c(F)cc1F	732045321	HMFLOGZTGAEMBC-UHFFFAOYSA-N	444.412	1.539	50	20	IDGD	
C[C@@H](NC(=O)CCC(=O)NNC(=O)NCC1CC1)C(=O)c1ccc(Br)cc1	732062686	HHKQGJCHONUADN-LLVKDONJSA-N	439.310	1.657	50	20	IDGD	
Cc1ccc(-n2c(C)cc(/C=C(/C#N)C(=O)NCC(=O)NCCN3CCOCC3)c2C)cc1	732155414	CJEIVRFTMVRAQE-JCMHNJIXSA-N	449.555	1.874	50	20	IDGD	
COc1ccc(-c2noc(CCCC(=O)NNC(=O)CCN3C[C@H](C)O[C@H](C)C3)n2)cc1	732262892	XAJZTDQMMFJJDH-IYBDPMFKSA-N	445.520	1.715	50	20	IDGD	
CC(C)(C)OC(=O)NCc1nc(C(=O)NNC(=O)Cn2cnc3ccccc32)cs1	732750096	IXAPOVBOQYMQCB-UHFFFAOYSA-N	430.490	1.979	50	20	IDGD	
COc1ccc(C)cc1N1C[C@@H](C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)CC1=O	734241870	LJPYCHWWAJPAHS-AWEZNQCLSA-N	449.508	1.212	50	20	IDGD	
COc1ccc([C@H]2[C@@H](C(=O)OCC(=O)NNC(=O)c3ccccc3)CCC(=O)N2C)cc1	734618261	TYYVSNYKBAGTIC-RXVVDRJESA-N	439.468	1.609	50	20	IDGD	
Cc1ncc2c(n1)CCC[C@@H]2NC(=O)NNC(=O)c1sc(N2CCOCC2)nc1C	734855946	TVPDGUQBNHHHEX-HNNXBMFYSA-N	431.522	1.408	50	20	IDGD	
COc1ccc(N(C)S(=O)(=O)c2cccc(C(=O)NNC(=O)c3cnn(C)c3)c2)cc1	735445056	CHKNUOKYDDOENH-UHFFFAOYSA-N	443.485	1.329	50	20	IDGD	
COc1ccc([N+](=O)[O-])cc1NS(=O)(=O)c1ccc(C(=O)NNc2cccnn2)cc1	736698124	AEDSNWJVWNBKRA-UHFFFAOYSA-N	444.429	1.951	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCc2cccc([N+](=O)[O-])c2)cc1	743346552	DKEANYKIZNTMAK-UHFFFAOYSA-N	435.462	1.054	50	20	IDGD	
Cn1ccnc1[C@@H](NC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)c1ccccc1	743527217	MUCPAHJKMHWDKA-KRWDZBQOSA-N	442.501	1.949	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NCCCN2CCc3ccccc3C2)cc1	743531893	JGYOZGWKBFUBFV-UHFFFAOYSA-N	445.545	1.874	50	20	IDGD	
CN(C[C@H]1CCCN1C(=O)NNC(=O)CNC(=O)c1cccs1)C(=O)OC(C)(C)C	743577285	DFHUVVQGBYDMPL-CYBMUJFWSA-N	439.538	1.550	50	20	IDGD	
CCN(CC)S(=O)(=O)N1CCN(C(=O)NNC(=O)c2cccc3ccccc23)CC1	743630666	YRWGJBJQPJLZSG-UHFFFAOYSA-N	433.534	1.398	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)CN2CCC(C(=O)NCCc3cccs3)CC2)cc1	744390334	DZYXEZUNWVHTHY-UHFFFAOYSA-N	439.541	1.452	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)c2ccc(CN3CCCCC3=O)cc2)c1	744726852	VVLVBOMFMJUQSJ-UHFFFAOYSA-N	434.452	1.689	50	20	IDGD	
C[C@@H]1C[C@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)CCN1C	745859289	ZZCPLWUAMVMZEO-NVXWUHKLSA-N	437.566	1.288	50	20	IDGD	
O=C(NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1)N[C@@H]1CCSC1	745899243	JBUZGXALRUOZRE-LLVKDONJSA-N	426.545	1.998	50	20	IDGD	
C[C@@H](CCc1ccc2c(c1)OCO2)NC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	746232482	QCLBQZILFJECDN-ZDUSSCGKSA-N	433.486	1.784	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CN2CCn3c(CCc4ccccc4)nnc3C2)c1	746472634	IXZQERRWIQGKJQ-UHFFFAOYSA-N	429.484	1.212	50	20	IDGD	
CCc1ccc(C(=O)NNc2nc(C)cc(OC)n2)cc1S(=O)(=O)N1CCOCC1	746630763	NROUDTZTSRFLAV-UHFFFAOYSA-N	435.506	1.134	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)c2ccc(Cl)c(N3CCNC3=O)c2)c1	747722392	JZKRPELOLPGKTN-UHFFFAOYSA-N	430.848	1.796	50	20	IDGD	
Cn1ccnc(NNC(=O)c2cccc(S(=O)(=O)Nc3cccc(Cl)c3)c2)c1=O	747938108	QIAJMVUCBSNGER-UHFFFAOYSA-N	433.877	1.991	50	20	IDGD	
C[C@H](Sc1nnnn1C1CC1)C(=O)NNc1ccccc1S(=O)(=O)NC(C)(C)C	748593378	IFWHRCWEROHNSH-NSHDSACASA-N	439.567	1.709	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)c1ccc2[nH]c(=O)c(=O)[nH]c2c1	748594088	PAMJOMBWRJOHJF-UHFFFAOYSA-N	431.474	1.050	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)c2cc(S(=O)(=O)N3CCC3)ccc2Cl)n1	748688828	ARSQIQSBOMTXCQ-UHFFFAOYSA-N	425.898	1.009	50	20	IDGD	
C[C@@H](O)c1ccc(CNC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1	749348592	RNMPXVDGUBMNBA-GOSISDBHSA-N	425.533	1.783	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCOCC2)cc1C(=O)NNC(=O)CCc1ccccc1	749804363	VQVLOVLRTARADI-UHFFFAOYSA-N	447.513	1.110	50	20	IDGD	
O=C(Cc1csc(-c2ccc3c(c2)OCO3)n1)NNC(=O)c1ccc(-n2cnnn2)cc1	751295791	WGISFVKYOJHWCF-UHFFFAOYSA-N	449.452	1.518	50	20	IDGD	
O=C(NN=Cc1cnn(-c2ccccc2)c1)c1cccc(S(=O)(=O)N2CCOCC2)c1	751364094	OGQIEMKKKJNOJC-UHFFFAOYSA-N	439.497	1.657	50	20	IDGD	
COc1cc(OC)cc(OCCCNC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c1	753801698	KVZHASCKOLLTOI-UHFFFAOYSA-N	441.448	1.093	50	20	IDGD	
Cc1nc(Cl)cc(NNC(=O)[C@H]2CN(Cc3nc(O)c4ccccc4n3)CCO2)n1	754421660	XXEADOFDCBNLBJ-CQSZACIVSA-N	429.868	1.431	50	20	IDGD	
C[C@@H](CS(=O)(=O)c1ccc(F)cc1)C(=O)NNC(=O)[C@@H](C)Oc1ccccc1F	755050040	VENMMQCECYAGAJ-QWHCGFSZSA-N	426.441	1.990	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N(CC)CC)cc1NC(=O)NNC(=O)c1cccnc1	755441148	IMFHGLGQRNVPTD-UHFFFAOYSA-N	435.506	1.977	50	20	IDGD	
Cc1ccc(C(=O)Nc2ccccc2)cc1NC(=O)NNC(=O)[C@H](C)NS(C)(=O)=O	755826971	QUWZDJWMOLVAJP-ZDUSSCGKSA-N	433.490	1.338	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ncc(Cc2ccccc2)s1	756162589	DCSPQCQYKNRNBS-UHFFFAOYSA-N	435.465	1.770	50	20	IDGD	
O=C(NNC(=O)c1cccc(Br)c1)Nc1cnn(CCN2CCOCC2)c1	756826193	BRIYKZWWKCXNCE-UHFFFAOYSA-N	437.298	1.444	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)Nc2cnn(CC(=O)N3C[C@H](C)O[C@@H](C)C3)c2)cc1	756836678	CTRWUBDYAWBIPP-GJZGRUSLSA-N	428.493	1.548	50	20	IDGD	
Cn1cnn(-c2ccc(NC(=O)NNC(=O)c3cccc(Br)c3)cc2)c1=O	757864391	YEALMNRNFSNFRJ-UHFFFAOYSA-N	431.250	1.800	50	20	IDGD	
CCOc1cc(C=NNC(=O)C(=O)Nc2ccccn2)ccc1O[C@@H](C)C(=O)N(C)C	758386875	CQVNBMBGNJHWIJ-AWEZNQCLSA-N	427.461	1.425	50	20	IDGD	
COc1ccc(C[C@H](C)CNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1	758770544	SOLBYJFDHRRISB-INIZCTEOSA-N	426.521	1.911	50	20	IDGD	
O=C(Cn1cnc2sc(-c3ccccc3)cc2c1=O)NNC(=O)C(=O)Nc1ccccn1	758829322	YASCFBIZNFWFGC-UHFFFAOYSA-N	448.464	1.306	50	20	IDGD	
Cc1c(C(=O)NNC(=O)C(=O)Nc2ccccn2)c(=O)oc2ccc(Br)cc12	758832563	HBTUVMXJABDINX-UHFFFAOYSA-N	445.229	1.659	50	20	IDGD	
O=C(NCCCc1ccc2c(c1)OCCO2)NNC(=O)C1CCN(c2ncccn2)CC1	758865483	DTXIFXZIOXMSOF-UHFFFAOYSA-N	440.504	1.427	50	20	IDGD	
CCc1ccc(-c2noc([C@@H](C)NC(=O)NNC(=O)CNC(=O)c3ccco3)n2)cc1	760753187	XQMIHBWXJAOAMX-GFCCVEGCSA-N	426.433	1.713	50	20	IDGD	
CN(C)C1CCN(c2ccc(NC(=O)C(=O)NNC(=O)c3ccccc3)cc2F)CC1	763430789	NHDWLVPWCWKBDV-UHFFFAOYSA-N	427.480	1.756	50	20	IDGD	
CCCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1Cl	763446335	RBKJZVOTAGWWSX-UHFFFAOYSA-N	447.835	1.788	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2Br)cc1	763484103	XDANHMMMBPKWIK-UHFFFAOYSA-N	436.262	1.874	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(N3CCOCC3)c3ccncc23)c(C)o1	763583366	OQWDKLUYDFKEDZ-UHFFFAOYSA-N	437.456	1.681	50	20	IDGD	
NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)cc1Cl	763613373	NFCZCTBHWJNQIL-UHFFFAOYSA-N	426.820	1.229	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1cccc(-c2noc(C3CC3)n2)c1	763629127	OWISRPDQXYIUSI-UHFFFAOYSA-N	445.439	1.970	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2ccnc(OCC(F)(F)F)c2)c1	763650700	PIZAGUOTIMYXRB-UHFFFAOYSA-N	440.378	1.804	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccn([C@H](C)c3ccccc3)n2)cc1	763659025	HGAFCSSPUYFCGG-OAHLLOKOSA-N	437.456	1.666	50	20	IDGD	
CN(C)C(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)cc1	763686838	VTMVCKWISVLEBC-UHFFFAOYSA-N	432.864	1.136	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2cccc(-c3noc(C)n3)c2)c1	763773541	ZEERJHQAAULXRD-UHFFFAOYSA-N	425.401	1.462	50	20	IDGD	
COC(=O)[C@@H](C)Cc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)cc1	763839205	ZROSXIRRDTUZOQ-ZDUSSCGKSA-N	431.420	1.342	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(-c3ncon3)cc2)cc1	763859484	CHEXYBFHFHCQCV-CYBMUJFWSA-N	439.428	1.689	50	20	IDGD	
O=C(CCSc1ccc(F)cc1)NNC(=O)C(=O)Nc1cnn(-c2ccncc2)c1	763903973	VFKSVAJOPGAOTQ-UHFFFAOYSA-N	428.449	1.675	50	20	IDGD	
Cc1cn(-c2ccc(C#N)cn2)nc1NC(=O)C(=O)NNC(=O)c1cc(Cl)ccc1O	763976538	AHYUAZVDNMTCFZ-UHFFFAOYSA-N	439.819	1.206	50	20	IDGD	
C[C@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(NC(=O)C(=O)NNC(=O)c3ccc[nH]3)cc2)C1	763980814	NGMLRLHNYARPPA-OKILXGFUSA-N	447.517	1.081	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)C(=O)Nc1cc(I)ccc1Cl	763995632	JVFOQSIXXMSQJS-UHFFFAOYSA-N	446.632	1.683	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2cc(C#N)ccc2OC(F)F)cc1	764127150	PCFODMGQRKSOHU-UHFFFAOYSA-N	432.383	1.887	50	20	IDGD	
O=C(CC1CCCC1)NNC(=O)C(=O)Nc1cccc(N2CCN(CC3CC3)CC2)c1	764185961	XWONQCQIRDLUJV-UHFFFAOYSA-N	427.549	1.885	50	20	IDGD	
Cc1cc(I)ccc1NC(=O)C(=O)NNC(=O)c1cccc(C#N)c1	764230650	DKTUIESJBFSDSS-UHFFFAOYSA-N	448.220	1.871	50	20	IDGD	
O=C(Cc1ccccn1)NNC(=O)C(=O)Nc1ccc(-c2nnc3n2CCCCC3)cc1	764266313	ANCNGHQRBLGSIK-UHFFFAOYSA-N	433.472	1.395	50	20	IDGD	
C[S@@](=O)Cc1cc(NC(=O)C(=O)NNC(=O)CCc2ccccc2O)ccc1Cl	764288476	HLWWIFXKFQVZAN-GDLZYMKVSA-N	437.905	1.643	50	20	IDGD	
C#CCOc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(OC)c(Br)c2)cc1	764326422	HTCJCKWUAKFUOB-UHFFFAOYSA-N	446.257	1.869	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(OCC(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)C1	764333444	JBEIIPQKVJJPBB-UHFFFAOYSA-N	440.447	1.936	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)C(=O)Nc1cccc(Cl)c1N1CCOCC1	764367046	IDTHUXKNLLRAGJ-UHFFFAOYSA-N	446.891	1.479	50	20	IDGD	
O=C(NNC(=O)C(F)(F)Oc1ccccc1)C(=O)Nc1cccnc1Br	764369425	FAHZXWYCTFMPJH-UHFFFAOYSA-N	429.177	1.602	50	20	IDGD	
Cc1nc2cc(NC(=O)C(=O)NNC(=O)c3cc(-c4ccc(F)cc4)[nH]n3)ccc2n1C	764387202	GUCZSCOXVQFQKV-UHFFFAOYSA-N	435.419	1.811	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cnn(-c4ccccc4)n3)n[nH]2)cc1C	764387463	SXDUSMUYDSGHAY-UHFFFAOYSA-N	444.455	1.674	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2cncc(NC(C)=O)c2)c(OC)cc1Cl	764430561	JPUVWLDBHCEVNL-UHFFFAOYSA-N	435.824	1.110	50	20	IDGD	
N#Cc1cccc(S(=O)(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)c1	765118998	KBVVYIZOVIUCME-UHFFFAOYSA-N	447.948	1.339	50	20	IDGD	
COCCOc1ccc(Br)cc1NC(=O)C(=O)NNc1nccnc1OC	766265169	XRAHRBPKNPMDOE-UHFFFAOYSA-N	440.254	1.355	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCc2cccnc21)c1cccc(S(=O)(=O)N2CCCC2)c1	766329532	VYQQGXICSPEMEM-GOSISDBHSA-N	428.514	1.747	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)C3CCN(C(=O)N(C)C)CC3)n[nH]2)cc1OC	768277086	PQEUBUYFOHULNT-UHFFFAOYSA-N	444.492	1.249	50	20	IDGD	
CCOC(=O)c1[nH]c(C)c(S(=O)(=O)NNC(=O)c2cc(OC)cc(OC)c2)c1C	768497904	TYVMZFSBPSJZPD-UHFFFAOYSA-N	425.463	1.449	50	20	IDGD	
COc1ccccc1[C@H](CNC(=O)NNc1nc(O)c2cnn(C)c2n1)N1CCCCC1	770349548	JUXYNRRZFQUWAE-INIZCTEOSA-N	440.508	1.931	50	20	IDGD	
CCN1CCN(c2cccc(NC(=O)NNC(=O)c3nnc(O)c4ccccc34)c2)CC1	771275522	CRLYYHARADMQML-UHFFFAOYSA-N	435.488	1.944	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)CC1	772202105	XYOKNUKFGRTUGW-UHFFFAOYSA-N	438.912	1.751	50	20	IDGD	
COc1cc(Br)c(S(=O)(=O)NNC(=O)Cc2cccnc2)cc1C(=O)O	772865054	RKFRHPQGLHBIQM-UHFFFAOYSA-N	444.263	1.103	50	20	IDGD	
COc1cc2c(cc1CNC(=O)NNC(=O)c1csc(N3CCOCC3)n1)O[C@@H](C)C2	772973383	KTIRCXRAVKBXAW-LBPRGKRZSA-N	447.517	1.456	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)C(=O)Nc2ccc(C(=O)N3C[C@@H](C)O[C@H](C)C3)cc2)n1	773483291	UGWUGBBLUBKOSK-HUUCEWRRSA-N	426.477	1.425	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2cc(Br)cn2C)cnn1C1CCCC1	773531101	WHZXGISZEZPGMZ-UHFFFAOYSA-N	437.298	1.807	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ccc(C(F)(F)F)cn2)cc1S(=O)(=O)N(C)C	773669485	NAUYVEHXGHUIQD-UHFFFAOYSA-N	445.423	1.741	50	20	IDGD	
CC[C@@H](NCC(=O)NNC(=O)c1ccc(F)cc1)c1ccccc1OCC(=O)N(C)C	775061423	VVKPLVOIJIKEHD-GOSISDBHSA-N	430.480	1.795	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)c1cc2ccccc2cc1NS(C)(=O)=O	778441246	QJXCICWHRUZMDF-UHFFFAOYSA-N	436.490	1.497	50	20	IDGD	
CC[C@H](NC(=O)NNC(=O)CNC(=O)OC(C)(C)C)[C@@H]1CN(Cc2ccccc2)CCO1	778699334	FIGKFSJEMOYVHM-ROUUACIJSA-N	449.552	1.521	50	20	IDGD	
COC[C@H](CNC(=O)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1)OC	781395006	RUYWNKLXDVATMW-SFTDATJTSA-N	426.517	1.605	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)nc1Br	782041896	MFRKCJSAMYDPJG-UHFFFAOYSA-N	441.669	1.584	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cnn(C)c2C(F)(F)F)ccc1OC(C)C	782120739	KNEZLKMWQUTHJF-UHFFFAOYSA-N	443.382	1.634	50	20	IDGD	
O=C(NNc1nc2ccccc2s1)C(=O)Nc1cccc(C(=O)N2CCOCC2)c1	782813473	JUMFVYLUBLNRLJ-UHFFFAOYSA-N	425.470	1.851	50	20	IDGD	
Cc1nc(-c2ccccc2NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)no1	782894607	QJBXCRDVFXUURE-UHFFFAOYSA-N	433.428	1.260	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNc2nccc3sccc23)cc1C(=O)OC	783436110	STHRERDBVLWPPK-UHFFFAOYSA-N	428.426	1.951	50	20	IDGD	
NC(=O)CCOc1ccc(NC(=O)C(=O)NNc2nc(-c3ccc(Cl)cc3)no2)cc1	784794381	CYJCSQSXGVEVRL-UHFFFAOYSA-N	444.835	1.726	50	20	IDGD	
CO[C@H](C)C(=O)Nc1cccc(NC(=O)C(=O)NNc2ccnc(Br)c2)c1	784836783	AEYYWTAEBCVLPC-SNVBAGLBSA-N	436.266	1.899	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNc2ccnc(Br)c2)cc(OC)c1OC	784836866	DXQBKNXYUCQPKM-UHFFFAOYSA-N	425.239	1.952	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1ccc(C(F)(F)F)nc1	785340134	WVVOQCJEBSLTAJ-UHFFFAOYSA-N	432.380	1.594	50	20	IDGD	
CC(=O)N1CCN(C(=O)COC(=O)/C(C#N)=C/c2cc(C)n(C[C@H]3CCCO3)c2C)CC1	786313117	MBPKLVGRAZUQSJ-FVIRYLMMSA-N	442.516	1.425	50	20	IDGD	
CCS(=O)(=O)CCn1cc(C)c(NC(=O)NNC(=O)c2cc3ccccc3cc2O)n1	786725055	NBAJVAIFKWNPCU-UHFFFAOYSA-N	445.501	1.952	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2ccc(Oc3cccc(F)c3F)nc2)CCS(=O)(=O)C1	787561477	YPAIRPLSYSUTQB-GOSISDBHSA-N	440.428	1.289	50	20	IDGD	
O=C(NNC(=O)N1CCC[C@@H](Oc2ncccc2F)C1)c1ccc(-n2cnnn2)cc1	787734584	CQEJILNYKZENPS-OAHLLOKOSA-N	426.412	1.094	50	20	IDGD	
C[C@@H]1CCc2c(sc3nc(CCC(=O)NNC(=O)CN4CCCC4=O)nc(O)c23)C1	789857694	JNZODUBPYDJBLK-LLVKDONJSA-N	431.518	1.224	50	20	IDGD	
COCCN(C)c1ccc(C=NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cn1	790145528	FZBBEVHLBRAVFO-UHFFFAOYSA-N	445.545	1.713	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2cc(OC)c(OC)cc2Cl)cc1OC	790340718	MVAKFJNWCJKMPV-UHFFFAOYSA-N	430.866	1.998	50	20	IDGD	
NC(=O)C1CCN(c2ccc(NC(=O)C(=O)NNc3cccc(F)c3[N+](=O)[O-])cc2)CC1	790993533	GITPLLVWMKRLMD-UHFFFAOYSA-N	444.423	1.517	50	20	IDGD	
COc1ccc(OC)c(C2=NO[C@H](C(=O)NNC(=O)CSc3ccccc3O)C2)c1	792286156	IULPUJYEJRDANB-KRWDZBQOSA-N	431.470	1.842	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)C(=O)Nc1ccc(N2CCCCC2)c2ncccc12	792356789	UBZDHOZAXJNSQG-UHFFFAOYSA-N	432.484	1.949	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)N2CCCN(c3nnc(C(F)(F)F)s3)CC2)n1	793220833	RQTPRJCIXGBBDQ-UHFFFAOYSA-N	429.428	1.827	50	20	IDGD	
C[C@]1(C(=O)NNC(=O)CNC(=O)c2cccs2)CCN(C(=O)OCc2ccccc2)C1	793335262	DAMJGHOLCDJKQA-NRFANRHFSA-N	444.513	1.674	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNS(=O)(=O)c2cccc(CC#N)c2)CC1	794591425	ZMTCZNWOPPBVTO-UHFFFAOYSA-N	437.522	1.645	50	20	IDGD	
Cc1ccc(CN2C[C@H](C(=O)NNc3ccccc3S(=O)(=O)N(C)C)CC2=O)cc1	795169061	IGPTUBMSFAGWQK-QGZVFWFLSA-N	430.530	1.737	50	20	IDGD	
COCCNC(=O)c1cccc(S(=O)(=O)NNC(=O)CC23CC4CC(CC(C4)C2)C3)c1	795280954	VOVCYLHQKSCRRC-UHFFFAOYSA-N	449.573	1.979	50	20	IDGD	
Cc1ccc(C)c(SCC(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1	797610573	SEMHZUIBJWEIRO-QGZVFWFLSA-N	430.482	1.926	50	20	IDGD	
O=C(NCC(F)(F)F)NNC(=O)c1cccc(NN2C(=O)[C@H]3CC=CC[C@@H]3C2=O)c1	798315125	ATYDVHBPLGIMJI-STQMWFEESA-N	425.367	1.471	50	20	IDGD	
C[C@H]1[C@H](NC(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)CC(=O)N1Cc1ccccc1	798532283	PDNQYMFTIJTBPM-BLLLJJGKSA-N	427.417	1.434	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2nn(-c3ccc(Cl)cc3)cc2C)n1	799258772	LGTXVDOVXXNHOL-UHFFFAOYSA-N	429.868	1.434	50	20	IDGD	
Cc1ccc(S(=O)(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)c(Cl)n1	800836629	OOPVVGKRXRQSIM-UHFFFAOYSA-N	447.945	1.935	50	20	IDGD	
Cn1ncnc1COC(=O)/C(C#N)=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	801192131	MGIPNISVLHDFGG-RIYZIHGNSA-N	439.863	1.858	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)CCc2c(C)nc(N3CCOCC3)nc2O)cc1	802052552	OEAVXWVNCCMOLI-UHFFFAOYSA-N	430.465	1.121	50	20	IDGD	
CC(=O)c1cccc(S(=O)(=O)NCCC(=O)NNC(=O)Nc2ccc3c(c2)OCO3)c1	802097621	XNRPRHLOWXGSFP-UHFFFAOYSA-N	448.457	1.139	50	20	IDGD	
Cc1c(C(=O)NNC(=O)Nc2ccc3c(c2)OCO3)cnn1CCO[C@H]1CCCCO1	802104555	FWVAKBPBIFEXIX-SFHVURJKSA-N	431.449	1.930	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@H]2CCc3ccccc3OC2)cc1	802409112	QKTDSSQVNKTSLH-KRWDZBQOSA-N	446.529	1.340	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@@H]2CCc3ccccc3OC2)cc1	802409114	QKTDSSQVNKTSLH-QGZVFWFLSA-N	446.529	1.340	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)NCC(=O)NNc2ccc3c(=O)[nH]ccc3c2)cc1	803431510	AZNRMVVTUUNOGO-UHFFFAOYSA-N	444.469	1.126	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)[C@@H](c2cnn(C)c2)N(C)C(=O)OC(C)(C)C)c1O	806550437	FIVQXBBPZVAMAZ-OAHLLOKOSA-N	433.465	1.504	50	20	IDGD	
CN(C(=O)OC(C)(C)C)[C@H](C(=O)NNC(=O)CCc1ccccc1O)c1cnn(C)c1	806806193	KKMGLJCSDZOPAH-SFHVURJKSA-N	431.493	1.814	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2ccc3c(c2)C(=O)CC(C)(C)O3)c1	806973732	UTQCLWISMVSCMY-UHFFFAOYSA-N	425.441	1.904	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNc2ccc(-n3ccnc3)nn2)ccc1Br	807428711	IWYUCMDMHVTYGP-UHFFFAOYSA-N	432.238	1.515	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)NCc1ccncc1OC[C@H]1CCOC1	807614858	ALFQTNCHFKMOHP-CABCVRRESA-N	432.452	1.934	50	20	IDGD	
CCCCNC(=O)NNS(=O)(=O)c1cc(Cl)c(OCC(=O)N(C)C)c(Cl)c1	808080713	ITRMZYDDOFLCMW-UHFFFAOYSA-N	441.337	1.753	50	20	IDGD	
CN(CCn1cc(Br)cn1)C(=O)NNC(=O)c1cnn(-c2ccccc2)c1	808271564	VQXUNOAEWWBEPH-UHFFFAOYSA-N	432.282	1.818	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2ncncc2Cl)c(C(=O)NCC(F)(F)F)cc1F	810390615	IDWYEGPEEJUAQM-UHFFFAOYSA-N	448.764	1.951	50	20	IDGD	
CNS(=O)(=O)c1ccc(-c2ccc(C=NNC(=O)[C@@H](C)CN3CCOCC3)o2)cc1	812440709	GYCCWFHAZUPKMY-HNNXBMFYSA-N	434.518	1.273	50	20	IDGD	
O=C(COC(=O)[C@@H]1CCCCN1C1CCCC1)NNC(=O)[C@H]1COc2ccccc2O1	815444971	PEAHCBZVRXJVSO-QFBILLFUSA-N	431.489	1.314	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@@H](NC(=O)COc2ccccc2)C(C)C)c(OC)c1	815467225	SRXKPXNRSLULFS-FQEVSTJZSA-N	429.473	1.685	50	20	IDGD	
O=C(NNC(=O)c1ccncc1)C(=O)Nc1cccc(S(=O)(=O)C2CCCCC2)c1	815564086	XBPNKLXGUFXMLN-UHFFFAOYSA-N	430.486	1.588	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccn(-c3ccc(Br)cc3)n2)n[nH]1	815567942	QPRLCJNIWPIJCM-UHFFFAOYSA-N	432.238	1.066	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1ccc(OC(F)F)nc1	815752124	DGMIOLUSSUPOKL-UHFFFAOYSA-N	429.405	1.015	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)C[C@H](c1ccccc1)c1ncc[nH]1	816828847	RPQVQEGGORYZSY-MRXNPFEDSA-N	440.529	1.994	50	20	IDGD	
CS(=O)(=O)CC[C@H](NS(=O)(=O)/C=C\c1ccccc1)C(=O)NNc1ccccc1	821694141	XCLQENQKLMISJZ-NZHZHZHDSA-N	437.543	1.523	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)[C@@H]2CC(=O)N(c3cc(Cl)ccc3OC)C2)c1	825781920	LCBJEQGDRGHIMN-CYBMUJFWSA-N	446.891	1.970	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)COc2ccc3c(c2)CCC(=O)N3)c2ccccc2c1=O	871266565	YNJOLHGMVZNCLI-UHFFFAOYSA-N	435.440	1.141	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)sc(C)c1C	913055110	GYLRXMPRNUYPEQ-CQSZACIVSA-N	447.469	1.468	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2ccccc2C)cc1S(=O)(=O)N1CCOCC1	913265609	AQQOCFFAKQCPMN-UHFFFAOYSA-N	433.486	1.099	50	20	IDGD	
O=C(COC(=O)CCOc1ccccc1Cl)NNC(=O)[C@@H]1COc2ccccc2O1	914812652	DVMFFOXRIXABMD-KRWDZBQOSA-N	434.832	1.640	50	20	IDGD	
CN(C)N(C(=O)c1cccc(NC(=O)[C@H]2Cc3ccccc3O2)c1)[C@H]1CCS(=O)(=O)C1	916373909	RZGGOGQOPAZPRG-AZUAARDMSA-N	443.525	1.735	50	20	IDGD	
CCN1CCN(CCCCNC(=O)NNC(=O)c2cc(-c3ccc(C)cc3)[nH]n2)CC1	916503675	FPBBHGOHBCNDKD-UHFFFAOYSA-N	427.553	1.747	50	20	IDGD	
CCCNC(=O)CN1CCC(NC(=O)NNC(=O)Cc2cccc3ccccc23)CC1	916518953	QNGMAVWVCCRKBT-UHFFFAOYSA-N	425.533	1.703	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N1CCC(CC(N)=O)CC1	916571532	IXAHLHOBEZJXLB-NSHDSACASA-N	427.299	1.545	50	20	IDGD	
CC(=NNC(=O)Cc1csc(N2CCOCC2)n1)c1ccc(OCC(=O)N(C)C)cc1	917566345	JCUNURFLQHWVJF-UHFFFAOYSA-N	445.545	1.530	50	20	IDGD	
CCc1noc2ncc(C(=O)NNC(=O)c3cccc(S(=O)(=O)N(CC)CC)c3)cc12	918398078	YVRFJBBICGLXDN-UHFFFAOYSA-N	445.501	1.891	50	20	IDGD	
O=C(CSCc1cccnc1)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	919692861	YOWVIZNWZZLMBE-UHFFFAOYSA-N	434.543	1.561	50	20	IDGD	
O=C(CN1C(=O)Cn2c(cc3ccccc32)C1=O)NNC(=O)c1cc(-c2ccccc2)on1	920253223	VARXUZFUVFGLPT-UHFFFAOYSA-N	443.419	1.740	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)Nc2ccccc2CN2C(=O)CNC2=O)cc1C	920930292	DTVOUESCYIHSEB-UHFFFAOYSA-N	425.445	1.587	50	20	IDGD	
CS(=O)(=O)Cc1nc2ccccc2n1CC(=O)NNc1ccccc1S(C)(=O)=O	1319207227	DQKSRFZBLIZUDI-UHFFFAOYSA-N	436.515	1.128	50	20	IDGD	
Cc1nc2ccncc2cc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2	1778950747	IDHILCOZONCAFX-WOIUINJBSA-N	446.935	1.665	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)/C=C/c3cc(C)on3)C2)C1	1779132943	YSVBIPLFWNEGDN-PUBSZHEZSA-N	426.311	2.000	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H]1Cc3ccccc3CN1)CCO2	1779295258	CLKCPEWSZMKHMB-DENIHFKCSA-N	431.609	1.382	50	20	IDGD	
COc1cc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](F)Br)C2)ccn1	1780774448	ARVIETRJANZOCV-DDUZABMNSA-N	444.301	1.908	50	20	IDGD	
CCOC(=O)O[C@@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](Cl)COC)C2	1781516470	NHQAJRHJERSGPG-XTDOFWJNSA-N	434.917	1.316	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccnn1C(C)C)C2	1782176020	UNQRCXVOXVQRQK-XAUMDUMWSA-N	426.945	1.845	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)Oc1ccccn1)C2	1782179461	XSSHRWOASCORAI-BZLDKRAPSA-N	439.940	1.617	50	20	IDGD	
C[C@@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCC(=O)NN(C)C)C1)c1ccccn1	1782214648	XSKDCHSBVAJTSJ-LYHRCORUSA-N	445.564	1.072	50	20	IDGD	
Cc1c(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)nc2ccc(Cl)cn12	1782493696	VHSYSLFLGUROEU-IFXJQAMLSA-N	441.315	1.339	50	20	IDGD	
COC(=O)NCC(=O)N1CCO[C@@]2(CCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1	1782867159	PVAUVFSMOGVMKI-OMKLEDIQSA-N	448.426	1.058	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)C3CCC4(CC3)OCCO4)C2)C1	1782944275	RKNGMAYGKYFOFN-KSSFIOAISA-N	445.354	1.533	50	20	IDGD	
Cc1cc(F)c(F)c(C(=O)N2CCO[C@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)c1	1783935127	PSOVPJSTASSJER-NRFANRHFSA-N	438.475	1.090	50	20	IDGD	
O=C(c1cc(N2CCCC2)ccn1)N1CCO[C@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783945618	QCJFDICRAMNZQI-IBGZPJMESA-N	427.332	1.929	50	20	IDGD	
O=C(Nc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]3C2)cc1)C1CC1	1784093259	TYIKAYCVIBZUJZ-KANFNMMFSA-N	449.935	1.228	50	20	IDGD	
C[C@H](Oc1cccnc1)C(=O)N1CC[C@]2(CN(C(=O)[C@@H](F)Br)CCO2)C1	1784549153	YTEBPGGOCZLKLD-DXCKQFNASA-N	430.274	1.369	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccn(C)c3=O)[C@H]2C1	1784728284	AQCBRLOLTFSVEG-SDADXPQNSA-N	440.338	1.010	50	20	IDGD	
C[C@@H](C#N)c1cccc(C(=O)N2CC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c1	1785084758	WXXQRHASLCQOCM-SBUREZEXSA-N	441.532	1.130	50	20	IDGD	
O=C(c1ccc(OCC2CC2)c(F)c1)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1785254071	SAKGEBSNJAPJRS-UTKZUKDTSA-N	440.899	1.658	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cnc4ccccn34)C[C@@H]21	1786404901	YRRDOGPSRHOOFA-XIRDDKMYSA-N	449.349	1.642	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3sccc3Cl)[C@H]2C1	1789042006	IVMZRIYXDSQTMV-YDHLFZDLSA-N	442.969	1.368	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nc(OC)ccc3[N+](=O)[O-])C[C@@H]21	1789859456	CNOHKONLKTYTQM-XPCVCDNBSA-N	440.884	1.609	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nccc4nc[nH]c34)C[C@@H]21	1789865860	HKTOYOHWWWRLEB-SWDXJLKVSA-N	440.331	1.788	50	20	IDGD	
Cc1ccc(O)c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]3C2)c1	1789924572	MRBKISBKLCWWDQ-DLKVLKDVSA-N	429.286	1.984	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)Cc3ccccc3)C[C@@H]21	1791063589	MFHDHKCRQVRCNX-FUJDEKNSSA-N	439.350	1.353	50	20	IDGD	
Cc1ccc(C(=O)C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Br)C[C@@H]32)cc1	1791173443	CJWBVYKZNYTTNN-QBYUYEEZSA-N	441.297	1.848	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CNc3ccc(F)cc3)C[C@@H]21	1791251257	CFHWQQCBNFVMJV-RUGDWHBFSA-N	427.904	1.471	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3ccc(F)cc3)C[C@@H]21	1791257443	GZUCBBRLTKQDNW-KANFNMMFSA-N	426.916	1.992	50	20	IDGD	
Cc1cc(NC(=O)CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C(C)(C)CCl)no1	1792781807	ALSFXHSEJNMYSC-FVCICTRLSA-N	426.901	1.166	50	20	IDGD	
CN1Cc2ccccc2C[C@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(C)(C)CCl	1792782060	AHAJPSZSVYZTAR-YRPNKDGESA-N	433.980	1.898	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1snnc1C1CC1)C2	1795114409	FPUKJGSJIQYNGT-PTEHBNRSSA-N	429.340	1.404	50	20	IDGD	
Cn1cnc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C3)c1	1795276747	MKTYRRHXWLJSAC-XGUBFFRZSA-N	439.944	1.804	50	20	IDGD	
CC1(C)CCc2cccc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@H](O)CCl)C4)c2O1	1796253488	TYBYFANDMZEKEV-CYGHRXIMSA-N	436.936	1.593	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2ccccn2n1	1796834144	MECJLDUJNXIYGC-IARIHHJXSA-N	435.322	1.711	50	20	IDGD	
Cc1ccc2nc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)c3cccc(B(O)O)c3)C4)ccc2c1	1797375807	WICLUYIJVDLUQF-WKCHPHFGSA-N	443.312	1.789	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1cccc(C#N)c1)C2	1797953861	KUEPHHGARODHAW-HATOLVCRSA-N	429.593	1.932	50	20	IDGD	
CCOC(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@](C)(Cl)CCl)OCC	1799278851	YZMABRRHYUVKEM-VLWCASSMSA-N	425.353	1.602	50	20	IDGD	
COC(=O)C12CC(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@@](C)(Cl)CCl)(C1)C2	1799279310	HOCBYGWWHBEXDI-NKUQNZOUSA-N	433.332	1.156	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1cc(F)ccn1)C2)[C@@H](F)Br	1799344249	DURPLCLGSOZIEJ-OXUXUCFPSA-N	432.265	1.433	50	20	IDGD	
CN(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnoc1)C2)NC(=O)NCc1ccccc1	1799871451	GUKWVFAXWZWCLL-REPLKXPHSA-N	440.504	1.273	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(=O)nc3cccnn13)C2	1800081200	DKPGYMKCGNBLTN-JHXTVGTDSA-N	438.315	1.578	50	20	IDGD	
C[C@H](S)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](Br)Cc1ccccc1	1800437423	YAKFQJXYNDPKLL-RDDKANTKSA-N	441.391	1.901	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CNC(=O)OC(C)(C)C	1800673966	JIDHXUJAJDGOBC-XPCVCDNBSA-N	448.358	1.132	50	20	IDGD	
CSc1ncccc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)Br	1800760640	XVNSCVKPAISOCY-FMSGJZPZSA-N	428.352	1.790	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COc1ccc(Cl)c(F)c1)C2	1800970419	DHPIGIDDMDZCQY-TYYYEBLRSA-N	449.306	1.701	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1[C@H]3c4ccccc4S[C@H]31)C2	1800976977	MWEQKLDFZDUCGW-XXBWSCEVSA-N	436.961	1.718	50	20	IDGD	
Cc1cc(Cl)cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCC(=O)NN(C)C)c1	1801012158	JHTXZUROVNGFSM-CWPLJXCYSA-N	436.940	1.225	50	20	IDGD	
Cc1nccn1[C@@H](C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)CBr)C2	1801453592	WVOAWTBUTPCBOU-AMSCCUFHSA-N	427.343	1.373	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(Cl)c1OC	1801808457	YCHBQBTVEYGCMC-VZAMPYOESA-N	431.316	1.806	50	20	IDGD	
CCC(=O)N[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)Br)[C@H]1c1cccnc1	1803436562	GEZJTTVJKMHSJU-LGWLGOQQSA-N	439.354	1.786	50	20	IDGD	
O=C1Nc2ccccc2/C1=C/C(=O)N1CCC2(CCCN(C(=O)[C@H](O)CCl)C2)CC1	1805522362	HBBMZDUUXVAKSK-XSVZSIDJSA-N	431.920	1.853	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H](CNC(=O)CCBr)[C@H]1c1cccnc1)n1cnnn1	1806347381	WGCNLAFVPNWIMY-XNRPHZJLSA-N	436.314	1.120	50	20	IDGD	
O=C(CN1CCOCC1)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@@H]1c1cccnc1	1806908441	HDQCCDGYAPKSBI-USXIJHARSA-N	443.317	1.110	50	20	IDGD	
NC(=O)c1ncccc1C(=O)N1CCCC2(CCN(C(=O)CCBr)CC2)C1	1807371980	CVTAEQMBZGULSL-UHFFFAOYSA-N	437.338	1.810	50	20	IDGD	
N[C@@H](Cc1cscn1)C(=O)NC[C@@H]1CCN(C(=O)[C@H](F)Cl)[C@@H]1c1cccnc1	1808204456	CZCIMBSCLCUZDQ-HNKHHVNMSA-N	425.917	1.648	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)N1CC[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]1c1cccnc1	1810542714	WZSHOFZFLHZTOW-MOXGXCLJSA-N	434.613	1.806	50	20	IDGD	
Cc1ccn2c(C(=O)NC[C@@H]3CCN(C(=O)[C@@H](O)CCl)[C@H]3c3cccnc3)cnc2c1	1812252653	OPAGWPHBWAYWOE-QRFRQXIXSA-N	441.919	1.957	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)CSCC(=O)OC)[C@H]1c1cccnc1	1813028523	RVRXEDAEEFZTRN-MPGHIAIKSA-N	443.953	1.247	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)CCc2cnn(C)c2)[C@H]1c1cccnc1	1813032892	ZBVDGEXZNDEDSQ-BJLQDIEVSA-N	433.940	1.708	50	20	IDGD	
C[C@H](C(=O)NC[C@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1)n1cncn1	1813400087	KVWBHSRXQXYKQT-UNEWFSDZSA-N	435.326	1.725	50	20	IDGD	
CC(=O)Nc1cc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)[C@H](O)CCl)n[nH]2)ccn1	1814871040	IEUJIIYIJYNVDK-HUUCEWRRSA-N	434.884	1.669	50	20	IDGD	
CC1=CC[C@@H](C(=O)N[C@@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)CC1	1815344215	OJTULCVYHIXIHP-RHSMWYFYSA-N	439.346	1.795	50	20	IDGD	
COCCCC(=O)N[C@H]1CCc2nc(NC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)sc2C1	1817276124	MBPBJWSEVVGQNH-XIXVAHAYSA-N	446.533	1.616	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1	1817471990	AMFBPPIJVRKYHO-KRWDZBQOSA-N	444.373	1.247	50	20	IDGD	
CCc1ncccc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1	1817473374	PUIQYMKMGUKMTJ-FQEVSTJZSA-N	447.304	1.667	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(F)c[nH]2)[nH]n1)c1ccc(B(O)O)cc1	1817475337	OAQBFBRIGQGPNE-KRWDZBQOSA-N	425.229	1.176	50	20	IDGD	
CN1CCN(CC(=O)Nc2cc([C@@H]3CCCCN3C(=O)[C@H](F)Br)[nH]n2)CC1	1818913886	SZTHEPOBUJKXJH-BBRMVZONSA-N	445.337	1.340	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2C[C@H]2C2CC2)[nH]n1	1819401675	NOBBSRINFJUCCU-DAYGRLMNSA-N	437.504	1.760	50	20	IDGD	
O=C(/C=C/C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1)NCc1ccco1	1819532267	KFNSFGCFWVPHPB-ZWOPJXCPSA-N	449.895	1.467	50	20	IDGD	
C[C@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)[C@H](C)Cn3cncn3)sc2C1	1820077587	TVSVBASGHQICFH-VWYCJHECSA-N	441.355	1.766	50	20	IDGD	
COc1nn(C)cc1C(=O)N[C@H]1CCc2nc(NC(=O)CO[Si](C)(C)C)sc2C1	1820161101	PNJWTPVICDZCFR-NSHDSACASA-N	437.598	1.963	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](O)CCl)CC2)c1[nH]cnc1-c1cccnc1	1821257470	YSCBJKUFBYNWFT-WCQYABFASA-N	446.920	1.754	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@](C)(O)C(F)(F)F)[nH]n1	1822369977	KQKDZOXEJYLWMQ-CCUNJIBTSA-N	426.823	1.969	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ncc(F)cc2F)[nH]n1	1822410207	BQRLQENBLXDRLW-OAHLLOKOSA-N	449.462	1.762	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)CN2C(=O)C=CC2=O)n[nH]1	1822529980	PQYIALJDKIXLHG-CQSZACIVSA-N	433.541	1.178	50	20	IDGD	
Cc1ncc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)cn1	1825699956	NECVXWDCJQUUQF-OAQYLSRUSA-N	436.321	1.012	50	20	IDGD	
C[C@H](C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCBr)CC2)n1cncn1	1826787325	UOUXRCWBKWPBPO-ZJUUUORDSA-N	427.328	1.693	50	20	IDGD	
CN1CCN(CC(=O)N2CCCC[C@H]2C2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1828442344	JUFGQIPPYVUUQZ-FUHWJXTLSA-N	447.393	1.544	50	20	IDGD	
O=C1Nc2c(cccc2C(=O)N2CCCC[C@@H]2C2CCN(C(=O)[C@H](O)CCl)CC2)C1=O	1828716221	CNGFRQIUCCIAFL-IAGOWNOFSA-N	447.919	1.654	50	20	IDGD	
CCOC(=O)N[C@@H](O)C(=O)N1CCCC[C@H]1C1CCN(C(=O)C(C)(C)CCl)CC1	1828760387	OFWJILZAPOTHHQ-HOTGVXAUSA-N	431.961	1.936	50	20	IDGD	
C=C[C@@H](O)C(C)(C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1	1828881412	CXQJPIFAXDQSLK-NHCUHLMSSA-N	442.365	1.173	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(Cl)cnc3O)CCO2)C1	1829557983	YOVGJYZHIDESLR-LJQANCHMSA-N	446.331	1.776	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)NNc1ccccc1)CCO2	1829809460	WCANCMSNEXFJEN-MMOPVJDHSA-N	438.956	1.465	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)Cc1ccc(C#N)cc1)CCO2	1829904634	RPFKOGXSDFVGJB-JOCHJYFZSA-N	445.592	1.409	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)c1ccc(OC)cc1)CCO2	1830216504	DYUHQSXNAQXJJB-UEXGIBASSA-N	440.924	1.202	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)n1ccnc1)CCO2	1830985813	RUJKACVRVKHHPN-MPGHIAIKSA-N	443.342	1.074	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@H](C)Cn2cncn2)CC1	1831830792	ILAMAGBEIDQZKL-NJAFHUGGSA-N	425.961	1.788	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2nc3ncccn3n2)CC1	1831832286	FTZJFRDFAMPDQR-HZPDHXFCSA-N	434.928	1.611	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CCc2ccc(O)nn2)CC1	1831834968	LSVOFMLZXQRKNG-ROUUACIJSA-N	438.956	1.988	50	20	IDGD	
Cc1noc(C)c1CC(=O)N1CCC([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1	1831870469	CTUMLWQCXPESOL-HXUWFJFHSA-N	447.580	1.827	50	20	IDGD	
CC1CCN(CC(=O)N2CCC([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)CC1	1831871571	UTSRVEVRKDQMLD-OAQYLSRUSA-N	449.640	1.711	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)C3CCN(C(C)C)CC3)CCO2)C1	1832407190	AMCOQXVUSYUKBV-DENIHFKCSA-N	444.016	1.971	50	20	IDGD	
Cc1cc(C)n(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)n1	1833040294	CCLWAYGQMBQETP-OALUTQOASA-N	447.363	1.193	50	20	IDGD	
Cc1nn[nH]c1C(=O)N1CCC(N2CCC(NC(=O)[C@@H](C)CBr)CC2)CC1	1833263697	REKOFPZTLZRQMG-LBPRGKRZSA-N	441.374	1.329	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3ncc(F)cc3F)CC2)CC1)[C@@H](O)CCl	1833306552	VGVYFXXDYUDNON-INIZCTEOSA-N	430.883	1.145	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3sc(C)nc3C)CCO2)C1	1834079408	KEBHEQPOLYAZNB-KDOFPFPSSA-N	431.942	1.084	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)c3ccn(C)n3)CC2)CC1	1834215025	DDVDGTZJLIWJMQ-AWEZNQCLSA-N	440.386	1.636	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(C(C)C)on3)CCO2)C1	1834500204	GJTQXVJXQHXPCF-AUUYWEPGSA-N	429.901	1.122	50	20	IDGD	
O=Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)CCBr)C3)C2)s1	1835941188	WNUGKVJPIRMIFL-KRWDZBQOSA-N	445.335	1.416	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)/C=C/C3CC3)CC2)CC1	1836732007	NZKIIUBQQYTQAI-ONEGZZNKSA-N	441.532	1.264	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)/C=N/N3CCCCC3)CCO2)C1	1837440704	UXTVZYHCKIAZPJ-ALQCXSEESA-N	428.961	1.322	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(CC)nn3C)CCO2)C1	1838038915	LKGWDIJIFSBPFR-JXFKEZNVSA-N	426.945	1.460	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccn(-c4ccccc4)n3)CCO2)C1	1838746693	JFVUKIILWYWRHE-XMSQKQJNSA-N	446.935	1.960	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(OC)c(OC)c3)C2)C1	1839146696	SUPKNUKKEHFFSZ-HRAATJIYSA-N	440.924	1.791	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(-n4cncn4)c3)C2)C1	1839147577	VYKUGVBMQDYOJT-WIYYLYMNSA-N	447.923	1.355	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc([N+](=O)[O-])cc3F)CCO2)C1	1839278383	ONNYJJYSYHTUOQ-DNVCBOLYSA-N	443.859	1.821	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(CC#N)cc1)CCO2	1839363060	GMYPASYJTBWRCV-JOCHJYFZSA-N	445.592	1.674	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc4c(c3)NC(=O)CC4)CCO2)C1	1839609267	ATTXUKGYKCLCGC-HTAPYJJXSA-N	449.935	1.659	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4ncoc4c3)C2)C1	1840152627	NZADTGYJGOXRIK-QRWLVFNGSA-N	437.880	1.152	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3onc4ccccc34)C2)C1	1840154763	FSPGQTFLWOFWKR-FOIQADDNSA-N	437.880	1.152	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3ccccc3C)C2)C1	1840155426	BPKLZGZPQHBWMO-KNQAVFIVSA-N	438.952	1.638	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)c3ccccn3)C2)C1	1840156803	ZYDQOIMJIIUSSM-IERDGZPVSA-N	439.940	1.069	50	20	IDGD	
CCCCC[C@@H](C)C(=O)N1CCOC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1	1840185440	QEVADOUYIHVDGS-XMSQKQJNSA-N	440.585	1.032	50	20	IDGD	
Cc1ccccc1OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840188177	SPKVKSQWBJRXPI-IBGZPJMESA-N	431.316	1.634	50	20	IDGD	
C[C@@H](Cc1ccncc1)C(=O)N1CCOC[C@]2(CN(C(=O)C(Cl)Cl)CCO2)C1	1840189832	OASLNMSTGNIGLM-IFXJQAMLSA-N	430.332	1.520	50	20	IDGD	
Cc1cc(C(=O)N2CCCC23CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C3)n[nH]1	1844768004	YKVSKPOUTRPUJV-AWEZNQCLSA-N	425.917	1.667	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)C1CN(C(=O)c3ccccc3OC)C1)C2	1845162732	LGHUGOBENGYMAA-QGZVFWFLSA-N	433.936	1.988	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC2(CCCN2C(=O)[C@H](O)CCNC(=O)OC(C)(C)C)C1	1845224067	WQKGQAKPEPEORC-CHWSQXEVSA-N	448.358	1.249	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)CCc2c[nH]c3ccc(F)cc23)C1	1846252224	RGFLAUUUISYQLS-UHFFFAOYSA-N	449.291	1.437	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc3c(c2)OCCO3)c1	15525769	YAXKTOFBVHJREF-UHFFFAOYSA-N	433.486	1.563	50	20	IDGD	
N#Cc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)Cc3ccc(F)cc3)CC2)cc1	16065242	KJYLQFPGVQZTSE-UHFFFAOYSA-N	444.488	1.488	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=O)CSc2ccc(C)cc2)n(C)c1	16201108	WKCJEVQCWUWSQA-UHFFFAOYSA-N	438.575	1.917	50	20	IDGD	
Cc1nn(-c2ccccc2)c(C)c1C(=O)C(=O)OCC(=O)NNC(=O)c1cccs1	16546365	AQLPFVZRILIWAH-UHFFFAOYSA-N	426.454	1.738	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)c1ccc2c(c1)CCCN2S(C)(=O)=O	27199671	IOODIVKLNLDIPO-ZDUSSCGKSA-N	435.477	1.766	50	20	IDGD	
O=C(CNC(=O)c1ccc(C(F)(F)F)cc1)NNC(=O)c1cc(Br)c[nH]1	28717413	IVCWHRGJXFPQAD-UHFFFAOYSA-N	433.184	1.987	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)CCNS(=O)(=O)c1ccc(C)c(C)c1	69157972	ZKIHGGCSEHPHAI-UHFFFAOYSA-N	433.530	1.761	50	20	IDGD	
Cn1c(=O)n(C)c2cc(S(=O)(=O)NNC(=O)c3cc4c(s3)CCCCC4)ccc21	109593566	GJBJTCZPMJKTIZ-UHFFFAOYSA-N	434.543	1.831	50	20	IDGD	
CCn1c(SCC(=O)NN(C)C(=S)NCCCOC)nnc1-c1cccs1	726076832	GKQNPMKHEWQYFU-UHFFFAOYSA-N	428.609	1.993	50	20	IDGD	
CC(C)(C)[C@@H]1CCc2sc(C(=O)NNC(=S)NCCNS(C)(=O)=O)cc2C1	727066209	IYCQQQOKYCZKRN-GFCCVEGCSA-N	432.637	1.557	50	20	IDGD	
CN1CCN(C[C@@H](NC(=O)NNC(=O)Cc2nc3ccccc3n2C)c2ccccc2)CC1	727945750	LVTNHJQDMZXXFP-HXUWFJFHSA-N	449.559	1.435	50	20	IDGD	
CC(C)C[C@@H](NC(=O)c1ccc(Cl)cc1)C(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1	728370795	CEIIMSRFLTWCHK-UKRRQHHQSA-N	429.926	1.067	50	20	IDGD	
O=C(COc1cccc(NC(=O)C2CC2)c1)NNC(=O)C1CCN(c2ncccn2)CC1	728846538	ZEGZIZSSESSYOH-UHFFFAOYSA-N	438.488	1.268	50	20	IDGD	
Cc1cccc(N2CCN(C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)CC2)c1C	728958628	CAIKGVUNWUWORK-UHFFFAOYSA-N	437.548	1.873	50	20	IDGD	
CC(=O)Nc1cc(F)c(S(=O)(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1Cl	729666295	YVOKHLXREZSVFA-UHFFFAOYSA-N	430.801	1.969	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NN=Cc1cc(OC)c(OCC(N)=O)c(OC)c1	730547711	ANOSQLADIONNBC-UHFFFAOYSA-N	439.472	1.630	50	20	IDGD	
C[S@@](=O)CCCNC(=O)/C(C#N)=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	732111970	BWQMYGQSFCWDBP-YTCNQMHGSA-N	447.948	1.871	50	20	IDGD	
COCCOc1cn(-c2ccccc2)nc1C(=O)NNC(=O)CCN1C[C@H](C)O[C@H](C)C1	732264660	WFRWWURVAITTDX-CALCHBBNSA-N	445.520	1.158	50	20	IDGD	
O=C(CN1C(=O)N[C@]2(CCc3ccccc32)C1=O)NNC(=O)c1cnn(-c2ccccc2)c1	733108468	JSUQWCCNCPNHSY-QHCPKHFHSA-N	444.451	1.027	50	20	IDGD	
CC(C)OCCCn1c(NNC(=O)Cc2nc3ncccn3n2)nc2ccccc2c1=O	733265334	BQUAWKXKPNTORJ-UHFFFAOYSA-N	436.476	1.335	50	20	IDGD	
CCOC(=O)C(=O)N1CCN(C(=O)/C(C#N)=C\c2cc(C)n([C@H](C)COC)c2C)CC1	736130205	DBGGIPIDYYMKJK-BKAYVGFPSA-N	430.505	1.453	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)c1cccc(S(=O)(=O)NCc2ccco2)c1	738560578	PAZXJXDOELHGBJ-UHFFFAOYSA-N	443.481	1.736	50	20	IDGD	
CCc1nc(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)nn1-c1ccccc1F	741558805	MFXDETJYIMCRRP-UHFFFAOYSA-N	438.467	1.436	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Cc2c[nH]c3ccccc23)cc(NS(C)(=O)=O)c1OC	742478392	OVEXCTZUFBOUOV-UHFFFAOYSA-N	446.485	1.560	50	20	IDGD	
COc1ccc(C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)cc1N1CCNC1=O	743335471	RVAUKAKBBUATQP-UHFFFAOYSA-N	440.428	1.978	50	20	IDGD	
CN(CCCC(=O)NNC(=O)CCc1ccccc1O)C1=NS(=O)(=O)c2ccccc21	743338746	RCTRGYCPYIQKMO-UHFFFAOYSA-N	444.513	1.333	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)N[C@H]1CCCN(c2ccc(C)cc2)C1=O	743509587	HQIGXUUVYKQURK-KRWDZBQOSA-N	426.473	1.908	50	20	IDGD	
CN(C)C(=O)c1cccc(CCNC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)c1	743634985	KCSNTLWOYWWODH-UHFFFAOYSA-N	436.472	1.466	50	20	IDGD	
CCOC(=O)N1CCC(NC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)CC1	745241084	HEBNVEVCLAWYLF-UHFFFAOYSA-N	427.483	1.047	50	20	IDGD	
Cc1ccc(-c2ocnc2C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1	745357682	LYSKIZQKJDQQOZ-KRWDZBQOSA-N	437.408	1.794	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Cc2ccncc2)cc1S(=O)(=O)Cc1cc(C)no1	747323683	HUYKMXPALATODT-UHFFFAOYSA-N	444.469	1.364	50	20	IDGD	
Cc1nc([N+](=O)[O-])cn1CC(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1	747778852	AYUFWOWZAGCWAY-HXUWFJFHSA-N	448.483	1.874	50	20	IDGD	
O=C(NNC(=O)c1ccc(NS(=O)(=O)/C=C/c2ccccc2)cc1)C(=O)N1CCCC1	748245996	CANJANQAQHUTQD-NTCAYCPXSA-N	442.497	1.483	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H]2OCCc3ccccc32)c1	749889194	VPYONUHTWGTXQW-IBGZPJMESA-N	431.514	1.792	50	20	IDGD	
O=C(CCc1ccccc1)NNC(=O)c1cccc(S(=O)(=O)NC[C@H]2CCCO2)c1	749958155	HITAVRXRCJHHBZ-GOSISDBHSA-N	431.514	1.538	50	20	IDGD	
COc1ccc([C@H](C)CC(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)cc1	750243079	WQZALIXZYMKFBT-MRXNPFEDSA-N	447.561	1.663	50	20	IDGD	
O=C(CCN1C(=O)[C@H]2CCCC[C@H]2C1=O)NNc1nc(Br)cn2ccnc12	750244115	VXKSUKLZGITCPU-PHIMTYICSA-N	435.282	1.500	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)c1cnn(-c2ccc(Br)cc2)c1	751204256	YKTWCANIHLZWBN-UHFFFAOYSA-N	432.234	1.419	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ccc3nncn3n2)CC1)c1cc(-c2ccccc2)on1	751303541	CMFVUDHYYDGFPO-UHFFFAOYSA-N	432.444	1.457	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)C[C@@H]2CSCCS2)c1	751539701	WUIKXRSQPFKOQZ-CQSZACIVSA-N	431.605	1.717	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1O)c1ccc(S(=O)(=O)N2CCCC2)cc1	753981758	RUPLZDYBQMNYLX-UHFFFAOYSA-N	434.430	1.160	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2ccc(N(C)C)cc2C)cc1	755808582	AUPIGYDZDYAOHH-UHFFFAOYSA-N	433.534	1.843	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccc(NC(=O)NNC(=O)c3ccccc3F)c2)CC1	756213529	WNGONYBEZQAZPR-UHFFFAOYSA-N	435.481	1.228	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)Nc1ccc(N2CCCC2=O)c(F)c1	756547660	FEEXIIPKLIQNQB-UHFFFAOYSA-N	441.467	1.812	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(NC(=O)NNC(=O)Cc2ccccc2OC)cc1	756785522	VRSNKOAFJOHEPP-UHFFFAOYSA-N	436.490	1.015	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Nc2cc(C(N)=O)ccc2CN(C)C)cc(OC)c1OC	756827231	QTLRESPGYUVBSG-UHFFFAOYSA-N	445.476	1.339	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)Nc1cnc(Br)c(Br)c1	757673240	AUYSOQKEOZOKDB-SSDOTTSWSA-N	440.092	1.811	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Nc2ccccc2CN2CCNC2=O)cc(OC)c1OC	757926006	IMXBGYUEJCHORC-UHFFFAOYSA-N	443.460	1.704	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)sc1Br	758079474	KQGHQEPSSCOKAK-UHFFFAOYSA-N	447.336	1.887	50	20	IDGD	
Cc1nc(SCC(=O)NNC(=O)C(=O)Nc2ccccn2)c2c(C)c(C)sc2n1	758818842	AYEUMQHMZRARHD-UHFFFAOYSA-N	430.515	1.890	50	20	IDGD	
C[C@H](Nc1ccc(C(=O)NNC(=O)C(=O)Nc2ccccn2)cc1[N+](=O)[O-])c1ccccn1	758833678	OMQSMVDKZLMKCZ-ZDUSSCGKSA-N	449.427	1.958	50	20	IDGD	
Cc1noc(C[C@H](NC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])c2ccccc2)n1	759864774	AGKNFJVACDPXTI-HNNXBMFYSA-N	440.416	1.979	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)C1CCN(C(=O)CCc2ccccc2)CC1	760440405	XGZNOKXGDAVNEA-UHFFFAOYSA-N	446.548	1.920	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)[C@H]2CN(C(=O)OC(C)(C)C)CCC2(F)F)C[C@@H](C)O1	760787639	LNNCNCKPIAVKMO-QLFBSQMISA-N	448.511	1.525	50	20	IDGD	
COc1ccc(Cl)cc1N1C[C@H](C(=O)NNc2nccc(N3CCOCC3)n2)CC1=O	762857024	QKKHWEWGCMKPPE-CYBMUJFWSA-N	446.895	1.471	50	20	IDGD	
CS(=O)(=O)Nc1ccc(F)cc1C(=O)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	763173920	QZNNAQZDOCGHQX-UHFFFAOYSA-N	435.412	1.801	50	20	IDGD	
CN(C)CCCOc1ccc(NC(=O)C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1	763445544	JPWABGIAQQKPHM-UHFFFAOYSA-N	429.433	1.325	50	20	IDGD	
C[C@H]1COCCN1c1ccc(NC(=O)C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1	763445953	NAEXMYXYVASEMU-ZDUSSCGKSA-N	427.417	1.220	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)NCc1ccc(C(=O)N2CCOCC2)cc1	763459167	WSHIFPSJSRWJOZ-UHFFFAOYSA-N	444.513	1.487	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)N[C@@H]1CCN(C2CCCCC2)C1=O	763528386	TYLKTOLVKBBDCI-OAHLLOKOSA-N	425.530	1.555	50	20	IDGD	
COC(=O)N(C)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(OC)c(OC)c2)cc1	763550780	RNPAJMOHCRRYLX-UHFFFAOYSA-N	430.417	1.306	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)C(=O)Nc2ccc(C(N)=O)cc2F)c1	763595697	BOIAVQRBGPSTLA-UHFFFAOYSA-N	430.436	1.521	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)[nH]n1)C(=O)Nc1cnn(Cc2ccccc2)c1	763600428	HBFXWNVEDPFMOQ-UHFFFAOYSA-N	429.440	1.721	50	20	IDGD	
CCOc1ccc(OCc2ccc(C(=O)NNC(=O)C(=O)Nc3ccn(C)n3)cc2)cc1	763600531	KNSWEAFBIHQISR-UHFFFAOYSA-N	437.456	1.798	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)C(=O)Nc1ccc(-c2n[nH]c(C3CC3)n2)cc1	763680783	BMGPZLPWZCSDGV-UHFFFAOYSA-N	438.419	1.653	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(C(=O)N(C)C)ccc1C	763716184	BSVXZFFEERQCDG-UHFFFAOYSA-N	426.473	1.424	50	20	IDGD	
CSc1cnn(-c2ccccc2)c1NC(=O)C(=O)NNC(=O)COc1ccc(F)cc1	763842333	YUOPZVFPICABTR-UHFFFAOYSA-N	443.460	1.898	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccnn1Cc1ccccn1	763865125	ISEJYGAXHDZWQI-CYBMUJFWSA-N	426.408	1.019	50	20	IDGD	
Cc1nc(-c2ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc3ccc(F)cc3)cc2)n[nH]1	763871901	IOPFANCCJDWFEM-LLVKDONJSA-N	426.408	1.473	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C)cc2C(=O)OC)cc1OC	763902059	MRGBBOHZWPDLGC-UHFFFAOYSA-N	429.429	1.589	50	20	IDGD	
Cc1nc(COc2ccc(NC(=O)C(=O)NNC(=O)c3cn(C)c4ccccc34)cc2)no1	763975843	RMAQPOZIPQQDNW-UHFFFAOYSA-N	448.439	1.848	50	20	IDGD	
CCOc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NNC(=O)c1ccccc1OC	764047239	FWTFUFAGFGMEFO-UHFFFAOYSA-N	428.445	1.195	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(I)cc2Cl)n[nH]1	764105898	BKQOSLRCGVQHCS-UHFFFAOYSA-N	447.620	1.376	50	20	IDGD	
O=C(CC(F)(F)F)NNC(=O)C(=O)Nc1ccc(Cl)cc1I	764116721	OYHDXGAYANZTBJ-UHFFFAOYSA-N	449.554	1.983	50	20	IDGD	
CCOC(=O)COc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)c1	764117965	WITDJKKEHKQHCY-UHFFFAOYSA-N	435.820	1.387	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1O)C(=O)Nc1cccc(CN2CCCCC2=O)c1	764127056	RRXZZRKZKPKZND-UHFFFAOYSA-N	444.875	1.958	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2cc(C)nn2-c2ccc(Cl)cc2)c1O	764132720	QAXORHMEDZSFPH-UHFFFAOYSA-N	443.847	1.948	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccc(-n2cc(C)cn2)c(F)c1	764135994	LAUPSNJEEQBJBN-UHFFFAOYSA-N	425.420	1.657	50	20	IDGD	
COc1cc(Br)cc(C)c1NC(=O)C(=O)NNC(=O)[C@H]1Cc2ccccc2O1	764152789	GEIVACVVBRBBLL-OAHLLOKOSA-N	448.273	1.856	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(I)cc2)cc1	764176947	IEGZUURHQDNLAZ-UHFFFAOYSA-N	434.193	1.563	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)CCCc2ccccc2)cc1C	764225063	WVJGEVCKTRKAHO-UHFFFAOYSA-N	446.529	1.865	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)C(=O)Nc2cccc(-c3nnc4n3CCCCC4)c2)c1	764236425	YGMBTYYSDCLQKM-UHFFFAOYSA-N	443.467	1.943	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1cc(F)c(N2CCCC2)c(F)c1	764275703	QXTDCEVRFHLJLQ-UHFFFAOYSA-N	434.399	1.436	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)c(Cl)c1)C(=O)Nc1ccc(N2CCCC2=O)c(F)c1	764349566	OWQIHIOKQNXWAY-UHFFFAOYSA-N	434.811	1.711	50	20	IDGD	
COCCCn1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(C)c(C)c3)[nH]n2)n1	764388136	ZCIYUOMGFZAHII-UHFFFAOYSA-N	439.476	1.326	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(C)c(Oc2cc(C)ccn2)c1	764401882	YVEJIKYHNYLHLA-OAHLLOKOSA-N	430.461	1.628	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COCCO1)C(=O)Nc1cc(C(F)(F)F)ccc1N1CCCCC1	764423608	CJTRYRLISQCSEL-HNNXBMFYSA-N	444.410	1.197	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)CCC(=O)N1CCN(c2ccccn2)CC1	764553146	RYVWHJDXGZSVSB-MRXNPFEDSA-N	443.479	1.264	50	20	IDGD	
C[C@H](NS(=O)(=O)c1cccc(C#N)c1)C(=O)NNC(=O)Cc1cccc2ccccc12	764643567	ZIJRYKWHORSASV-HNNXBMFYSA-N	436.493	1.768	50	20	IDGD	
O=C(NNC(=O)c1cnn2ncccc12)c1nn(Cc2ccccc2)c(=O)c2ccccc12	765186356	RUZPQCFXBMXZEM-UHFFFAOYSA-N	439.435	1.562	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cc(C)[nH]n2)cc1S(=O)(=O)Nc1ccc(C)cc1	765583309	KWXJOKUNHFIJPD-UHFFFAOYSA-N	443.485	1.911	50	20	IDGD	
O=C(CSCc1cccnc1)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	766660752	RFELNRGBDANIOJ-UHFFFAOYSA-N	447.992	1.933	50	20	IDGD	
Cc1nn(C)c(C)c1[C@@H](C)C(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	766662762	GDNWCDNYRKWJBC-OAHLLOKOSA-N	446.983	1.759	50	20	IDGD	
COc1ccc2c(c1)OC[C@@H](NC(=O)NNC(=O)C1CCN(c3ncccn3)CC1)C2	768111535	HKDMUEFGFDBTEB-INIZCTEOSA-N	426.477	1.036	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2ccc(S(N)(=O)=O)cn2)ccc1OCCC(C)C	769737648	DXQRDKLKTSJHQL-UHFFFAOYSA-N	436.490	1.237	50	20	IDGD	
CCNS(=O)(=O)[C@@H]1CCN(C(=O)/C(C#N)=C/c2cc(C)n(C[C@@H]3CCCO3)c2C)C1	771402386	FEGSYTBUHBBMAZ-FPZBBQJASA-N	434.562	1.731	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)[C@H](CC(C)C)N1C(=O)[C@@H]2CC=CC[C@H]2C1=O	771851706	CJMJQHVOSRDNNX-HZMVEIRTSA-N	435.521	1.478	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1cc(OC)c(OC)cc1NC(=O)c1ccco1	771875933	XDSHUXMANFPVIG-LLVKDONJSA-N	433.417	1.652	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)c1ccc(Br)c(S(C)(=O)=O)c1	772066540	WQGNYPZHGZKZRM-JTQLQIEISA-N	449.323	1.591	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)c1cccnc1Oc1ccccc1C(N)=O	772183488	MYFBNKKDRSBROA-CYBMUJFWSA-N	428.445	1.712	50	20	IDGD	
CCOC(=O)CON=C(C(=O)NNc1ccc(Br)cc1F)c1cc[nH]n1	772427341	MUYGRNJOPDJDHH-UHFFFAOYSA-N	428.218	1.738	50	20	IDGD	
COc1ccc(COCCNC(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)cc1	772558253	QNRUZKIMTWWJJA-UHFFFAOYSA-N	437.522	1.620	50	20	IDGD	
CC[C@]1(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)CCCN1C(=O)OC(C)(C)C	772563986	IAGUHBOLWGGJES-HXUWFJFHSA-N	429.481	1.603	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2cnc3ccccc3n2)cc1NS(C)(=O)=O	773719778	ZJONVBGOBSUGGU-UHFFFAOYSA-N	430.446	1.092	50	20	IDGD	
CC[C@H](NC(=O)NNc1cccc(S(C)(=O)=O)c1)c1ccccc1OCC(=O)NC	776612927	KMOMGHHGNYOIDT-KRWDZBQOSA-N	434.518	1.992	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccnc(OC(C)C)c2)cc(OC)c1OC	778706601	XOTGBMDDGDMCIL-UHFFFAOYSA-N	432.433	1.294	50	20	IDGD	
O=C1CN(c2ccc(NC(=O)C(=O)NNc3ccccc3OC(F)(F)F)cc2)CCN1	778801912	TWUIWJZWCWBSAP-UHFFFAOYSA-N	437.378	1.603	50	20	IDGD	
Cc1cc(Br)cc(S(=O)(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1	780366763	XZXJSKGSBRNSOF-HNNXBMFYSA-N	427.276	1.907	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)CNC(=O)CC12CC3CC(CC(C3)C1)C2	780974482	YIZYDSRTZKVKEF-UHFFFAOYSA-N	436.553	1.771	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ccc(Br)cc2)cc1-n1cnnn1	783010208	ZLIDEDFNTUYXHC-UHFFFAOYSA-N	432.238	1.515	50	20	IDGD	
COC(=O)CSCc1cccc(NC(=O)C(=O)NNc2ccc(-n3cccn3)nn2)c1	783432710	CFYLWPYNKGUYIF-UHFFFAOYSA-N	441.473	1.150	50	20	IDGD	
Cc1cnn(-c2ccc(C(N)=O)cc2NC(=O)C(=O)NNc2nccc3sccc23)c1	783435658	KBGKKZPGUZGEFI-UHFFFAOYSA-N	435.469	1.971	50	20	IDGD	
O=C(NNC(=O)N1CCCN(c2ncccc2F)CC1)c1cc(Br)c[nH]1	784062140	YLUKHUMJWXGFCT-UHFFFAOYSA-N	425.262	1.878	50	20	IDGD	
Cc1c(NNC(=O)C(=O)Nc2ccc(NC(=O)CCN(C)C)cc2)cccc1[N+](=O)[O-]	784351199	LNTSLGNTDOAQRZ-UHFFFAOYSA-N	428.449	1.875	50	20	IDGD	
NS(=O)(=O)c1cccc(NC(=O)C(=O)NNc2ccc(OCC(F)(F)F)cc2)c1	784370445	SYHCQZUYQUAGNK-UHFFFAOYSA-N	432.380	1.357	50	20	IDGD	
CN1CCC/C1=N\S(=O)(=O)c1cccc(NC(=O)C(=O)NNc2ccc(F)cc2)c1	784782305	BYKZHEHVQGMJPM-JJIBRWJFSA-N	433.465	1.720	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNc2ccnc(N(C)C)n2)sc2c1CC[C@@H](C)C2	784969869	AUUXZBXHMOVKKU-LLVKDONJSA-N	446.533	1.987	50	20	IDGD	
Cc1cn(-c2c(F)cccc2F)nc1C(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	786686817	BZNLKRURJZCENE-UHFFFAOYSA-N	438.394	1.781	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)[C@@H]1CCc2nccn2C1	787127078	QILZSBJODJIXDR-QGZVFWFLSA-N	430.940	1.064	50	20	IDGD	
Cc1ccc(CNC(=O)NNC(=O)[C@H](C)Oc2cccc(Br)c2)c(=O)n1C	787339244	GWTAPANTNDAFNL-LBPRGKRZSA-N	437.294	1.754	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@@H](C(=O)NNc3ccc(-n4ccnc4)nn3)C2)s1	788177091	IBWGNISHOLWSBN-CQSZACIVSA-N	447.546	1.576	50	20	IDGD	
NS(=O)(=O)c1ccccc1NNC(=O)[C@@H]1CCCN(C(=O)c2ccc(Cl)cc2)C1	788232489	SWTSKCDXVVFABX-CQSZACIVSA-N	436.921	1.983	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)[C@@H](C)[C@@H](C)S(C)(=O)=O)c2ccccc2c1=O	788266539	XERBFJVUBLDQHO-UONOGXRCSA-N	436.534	1.417	50	20	IDGD	
CCN(C)C(=O)[C@H](C)NC(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1	788896897	RSAAVWUGPYKQAE-LAUBAEHRSA-N	437.544	1.811	50	20	IDGD	
Cc1ccc(-n2cccn2)cc1NC(=O)C(=O)NNC(=O)Cc1nc2ccccc2n1C	789590255	VNLKMDBYBNWDHB-UHFFFAOYSA-N	431.456	1.396	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2cccc3c2OCC[C@@H]3N(C)C)c1	789731973	LYQQNHVLRTWZTG-IBGZPJMESA-N	440.500	1.854	50	20	IDGD	
CN(C)[C@H]1CCOc2c(NC(=O)C(=O)NNC(=O)CCc3ccccc3O)cccc21	789734252	IEPWKDHZGGRJNV-KRWDZBQOSA-N	426.473	1.496	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c(-c2ccc(Cl)s2)n1	789734573	GDQCJVMCOWQEAL-UHFFFAOYSA-N	428.865	1.853	50	20	IDGD	
O=C(CCC(=O)Nc1ccc2nc(O)[nH]c2n1)NNC(=O)[C@H]1OCC[C@H]1c1ccccc1	790324420	SDSRUZJOIMAWFX-UGSOOPFHSA-N	438.444	1.102	50	20	IDGD	
CCC(CC)NC(=O)[C@@H]1CN(C(=O)C(=O)NNc2ncccc2C)c2ccccc2O1	792379263	CCDXNGUVCMRBKC-SFHVURJKSA-N	425.489	1.932	50	20	IDGD	
Cc1nc2cc(F)c(F)cc2n1CC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	792812419	UTQZFSAAXYKNFQ-UHFFFAOYSA-N	426.383	1.331	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)C(=O)Nc2cc(C(C)(C)C)nn2-c2ccc(C#N)cc2)cn1	793024207	CZQFCCRZHGMYKF-UHFFFAOYSA-N	434.460	1.175	50	20	IDGD	
CCn1nc(C)c(CC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1C	794181065	QZHYHKMFVREKSS-UHFFFAOYSA-N	433.534	1.308	50	20	IDGD	
O=C(CCn1cnccc1=O)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1	794260097	CUJQVEQQESHZKU-NRFANRHFSA-N	431.496	1.408	50	20	IDGD	
Cc1ccc(F)c(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)c1Br	796989919	LUFRBQFXQSCAOG-UHFFFAOYSA-N	449.236	1.933	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cc(OC)c(OC)c(C)c2OC)cc1	796992575	SRUNXDGQSDKTIM-UHFFFAOYSA-N	447.444	1.194	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNC(=O)C(=O)Nc1ccccc1N1CCCC1	797370188	VMRRRMRKXKJSKI-UHFFFAOYSA-N	439.472	1.299	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(CNC(=O)OC(C)(C)C)cc2)n1	797370358	ZXFSQSWCJHSIFE-UHFFFAOYSA-N	427.461	1.814	50	20	IDGD	
COC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)c1C	798041981	JGCCGELPFKVMEV-UHFFFAOYSA-N	432.458	1.757	50	20	IDGD	
C[C@@H](NC(=O)CCc1ccccc1)C(=O)NNc1nc(O)c2cnn(C(C)(C)C)c2n1	799626953	KXXXTWSSSYMTNS-CYBMUJFWSA-N	425.493	1.868	50	20	IDGD	
NS(=O)(=O)Cc1cccc(CNC(=O)NNC(=O)CSc2ccc(Cl)cc2)c1	800719023	QPVRJPBSTGPALN-UHFFFAOYSA-N	442.950	1.751	50	20	IDGD	
C[C@]1(CCCC(=O)OCC(=O)NN=C(c2ccccc2)c2ccccc2)NC(=O)NC1=O	801434192	YULDZVCKGYGWSU-HSZRJFAPSA-N	436.468	1.867	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2ccc3c(c2)CCN3C(=O)CNC(C)=O)cc1	802062056	XOSRGFVBNOKFIZ-UHFFFAOYSA-N	425.445	1.187	50	20	IDGD	
CCc1ccccc1OCC(=O)NNS(=O)(=O)c1cc(S(C)(=O)=O)ccc1OC	802721383	XNTVDDVUGGXMJM-UHFFFAOYSA-N	442.515	1.050	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNc2cnc3ccccc3n2)(S(C)(=O)=O)CC1	803108651	FJLGUXQLZKJGNJ-UHFFFAOYSA-N	449.533	1.887	50	20	IDGD	
CS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2cc(Cl)cc3c2OCC(=O)N3)cc1	806995029	MRMCLHQKWPWLRB-UHFFFAOYSA-N	438.849	1.156	50	20	IDGD	
O=C(NNc1cccc(F)n1)C(=O)Nc1cccc(S(=O)(=O)NC2=NCCCCC2)c1	807392943	PMQCNMZIGRXTIM-UHFFFAOYSA-N	448.480	1.553	50	20	IDGD	
Cc1cc(O)nc2cc(C(=O)N3CCN(S(=O)(=O)CBr)CC3)ccc12	809750185	QKTNIAKSXCNQPL-UHFFFAOYSA-N	428.308	1.689	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CNS(=O)(=O)c2ccc(Cl)c(Cl)c2)c(O)c1	810173211	ZRTAPNVVHXNJFR-UHFFFAOYSA-N	432.285	1.747	50	20	IDGD	
CN(C)c1cccnc1CNC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	812535761	FWPRZVJEGZMHPF-UHFFFAOYSA-N	425.537	1.190	50	20	IDGD	
COC(=O)c1cc(Br)cc(C(=O)NNC(=O)CCNC(=O)OC(C)(C)C)c1	812545831	FZZRUMWXBOXXFH-UHFFFAOYSA-N	444.282	1.912	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)NC[C@@H]2C[C@H](F)CN2C(=O)OC(C)(C)C)nc2ccccc21	813816492	YEDDGNOHNUJPGM-KBPBESRZSA-N	448.499	1.794	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCc2nncn2C1)C(=O)Nc1nc2c3c(ccc2s1)CCCC3	815692710	ZCNNMXUMKAVDKK-GFCCVEGCSA-N	439.501	1.115	50	20	IDGD	
CC(C)c1c(Cl)ncnc1NNC(=O)CCC(=O)Nc1ccc2c(n1)n(C)c(=O)n2C	816485960	IEONOCOBHZMICO-UHFFFAOYSA-N	446.899	1.701	50	20	IDGD	
O=C(Cn1cc(C(=O)NNC(=S)NCCc2cccs2)cn1)NC1CCCCC1	819427683	QHJIUOXJOYEXAW-UHFFFAOYSA-N	434.591	1.745	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1ccc(Cl)cc1)C(=O)OCC(=O)NNC(=O)c1cccs1	834694871	LDBDUEIAAONYIP-SNVBAGLBSA-N	445.906	1.073	50	20	IDGD	
O=C(c1ccc(NS(=O)(=O)c2ccc3c(c2)OCCCO3)cc1)N1CC[C@H](B(O)O)C1	864234920	ZFVVYWFYIZJWEG-HNNXBMFYSA-N	446.290	1.338	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)[C@@H]2CCCN2c2ncccn2)c2ccccc2c1=O	912864328	DDSJYQPHLPKOHI-SFHVURJKSA-N	449.515	1.807	50	20	IDGD	
O=C(COC(=O)c1ccc(=O)n(-c2ccccc2)n1)NNC(=O)c1cccc(Cl)c1	914667933	ATSPBAMWXAIKJK-UHFFFAOYSA-N	426.816	1.504	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)NC[C@@H]1CN(Cc2ccccc2)CCO1	915894809	PWFKBCJMCVQMMN-SJLPKXTDSA-N	430.480	1.824	50	20	IDGD	
O=C(COc1ccc2cc(Br)ccc2c1)NNC(=O)[C@H]1CCS(=O)(=O)C1	916041825	KTJZWYRAULSKQJ-ZDUSSCGKSA-N	441.303	1.563	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)CS(=O)(=O)C1CCCC1	916141542	GTJYOKQOTHJOOZ-NSHDSACASA-N	433.324	1.721	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)N[C@H](C)Cn2cccn2)c2ccccc2c1=O	916464804	YPTVCAPAGOJSRG-OAHLLOKOSA-N	425.493	1.816	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)NCCC(=O)Nc2ccc(Br)cc2)n1	918126744	IZOHJVJNSSSVIR-UHFFFAOYSA-N	437.298	1.622	50	20	IDGD	
COCCn1cc(NC(=O)NNC(=O)[C@@H](C)Oc2cccc(Br)c2)cn1	918542694	FQLOPJWYAAFNTP-LLVKDONJSA-N	426.271	1.912	50	20	IDGD	
O=C(CC(F)(F)F)NNC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1	919816994	MDBBMMDSSFXKBG-JTQLQIEISA-N	438.384	1.095	50	20	IDGD	
Cc1nc(CSc2ccccc2C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)cs1	919889586	PAFYZAUFNROWDV-LBPRGKRZSA-N	440.572	1.875	50	20	IDGD	
CN(C)[C@@H](C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)c1ccccc1	920275548	ZMKGHHMCSFBKAX-LJQANCHMSA-N	430.530	1.535	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc(NC(C)=O)c1OC	1116142581	GWJCKCAJOMHTDX-UHFFFAOYSA-N	442.476	1.130	50	20	IDGD	
O=C(CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@@H]12)NNC(=O)c1ccc(Br)cc1	1318053825	CUNFBZYMOUPTGF-KCQAQPDRSA-N	441.351	1.936	50	20	IDGD	
N#Cc1ccc(N2C[C@@H](C(=O)OCC(=O)NNC(=O)c3cccc(Cl)c3)CC2=O)cc1	1318156794	LHZGKPLMMNNESF-HNNXBMFYSA-N	440.843	1.569	50	20	IDGD	
COC(=O)c1cc(C(=O)NNC(=O)Cc2nc3ccccc3n2C)n(-c2ccccc2)n1	1318306716	IOJMXONJMQFLFF-UHFFFAOYSA-N	432.440	1.549	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)c2nnc(O)c3ccccc23)ccc1N1CCN(C)CC1	1321009697	GJYQQORFUQVSRA-UHFFFAOYSA-N	435.488	1.862	50	20	IDGD	
COC(=O)Cc1cccc(NC(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)n1	1321071631	ABTKFNNCCUWJNW-UHFFFAOYSA-N	435.481	1.597	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)[C@]2(O)CCN(Cc3ccccc3)C2)CC1	1322233974	RDPAQROLAGVRGD-QHCPKHFHSA-N	446.548	1.418	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)COc3cc(Cl)ccn3)C2)C1	1779231719	FFLRNZRNZBOLIG-KBXCAEBGSA-N	432.304	1.198	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](C)n3ccccc3=O)C2)C1	1779272524	WNLKVBYVZYPVEC-ZRGWGRIASA-N	440.338	1.413	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc(NC(C)=O)o2)C1	1779371825	RIHCXFZMABSSNT-AKCHCHLHSA-N	441.912	1.619	50	20	IDGD	
Cc1nccnc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)Br)C2	1779874708	HMMMCPKFKAZTSG-WPKBUWHJSA-N	425.327	1.696	50	20	IDGD	
Cc1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](O)CCl)C3)n(C(F)F)n1	1780164279	ZVGASCVTGGEPLT-HBUWYVDXSA-N	434.871	1.314	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)c(O)c1	1780555423	GERXZXTUIALKEC-XIKOKIGWSA-N	427.295	1.628	50	20	IDGD	
Cc1nc(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@](C)(Cl)CCl)C2)no1	1780710011	BJMPIERHCUNGEN-JEBQAFNWSA-N	433.336	1.671	50	20	IDGD	
C[C@H](Cn1cccn1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Br)C1	1780770995	OTEQXYNIAUHOBK-ATNYBXOESA-N	445.333	1.724	50	20	IDGD	
C[C@@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Br)C1)n1ccnn1	1780776591	HRDUIRAHGJMUCW-RSUWNVLCSA-N	432.294	1.044	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)c3cnc4snnc4c3)CCO2)C1	1781231089	GHKNRBLLOCSWGQ-SJORKVTESA-N	444.344	1.766	50	20	IDGD	
COc1cnc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](C)Br)C2)cn1	1781996127	BHHHLKFZJRIFMJ-WPKBUWHJSA-N	441.326	1.396	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C1CCC(O)CC1)C2	1782001132	AMFHTACLEPHLOW-IWJNZZSASA-N	431.371	1.835	50	20	IDGD	
CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Cl)CCO2	1782049622	MRXNXHVVKAYESY-MAUKXSAKSA-N	428.848	1.639	50	20	IDGD	
Cc1cccn2ncc(C(=O)N3CC[C@]4(CN(C(=O)CO[Si](C)(C)C)CCO4)C3)c12	1782519713	CHHXOEWXUBTSID-NRFANRHFSA-N	430.581	1.938	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc(Cl)nc3)[C@H]2C1	1783379322	YVKAUYNETQWPGR-PYERRIOISA-N	435.739	1.960	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3c4c(nn3C)CCC4)CCO2)C1	1783538040	VMOHBGCIDYAOEJ-SGTLLEGYSA-N	425.327	1.136	50	20	IDGD	
N#Cc1ccc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Br)C[C@@H]32)cc1	1783605262	OCQKLHBGSPXJTB-OVWQWFNUSA-N	438.297	1.771	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cc(C)nc4ccc(O)cc34)CCO2)C1	1783875346	PVPSVHWBGAFXIK-XMSQKQJNSA-N	447.919	1.946	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)c1ccccc1Cl)CCO2	1783878194	BSBSAMNDNVCNNJ-FRQCXROJSA-N	431.316	1.457	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccnc4c(O)cccc34)C[C@@H]21)[C@@H](O)CCl	1784092264	LYMGXVSIEKPPBX-FRJURHEUSA-N	433.892	1.133	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@](C)(O)C(F)(F)F)[C@H]2C1	1784877652	RKFNTXUKDPQAPO-SEKJGCFDSA-N	431.249	1.063	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc4ccccn34)[C@H]2C1	1787932464	RMOXGGVRHHDTLY-AESZEHBQSA-N	449.349	1.959	50	20	IDGD	
CN1CCC[C@H](C(=O)NC2(c3ccc(NC(=O)c4ccc(B(O)O)cc4)cc3)CCC2)C1	1788144297	GNFUSZOKWKCRAV-SFHVURJKSA-N	435.333	1.456	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)c1ccc2cncn2c1	1788429324	XZUBYNNVMWDFFE-QCEMKRCNSA-N	439.285	1.618	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CSCc3[nH]cnc3C)[C@H]2C1	1788538164	PXPPKJHOVLFEQK-JKQORVJESA-N	428.986	1.948	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(=O)ccn3C)[C@H]2C1	1789226128	BEDUFSPYZUEFTH-FAYQHZLMSA-N	440.338	1.152	50	20	IDGD	
COc1cccc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]3C2)c1	1789922163	DRVSDZCMDSHHDG-OWIUFQIYSA-N	443.313	1.908	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)[C@@H](O)Cc1ccccc1	1790956234	GHWGZRKVKBJVFL-WOYTXXSLSA-N	443.313	1.260	50	20	IDGD	
Cc1ccc(C(=O)C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)Br)C[C@@H]32)cc1	1791173960	BLASVICXCDQBJC-HJWJTTGWSA-N	437.334	1.941	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@H](O)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C(C)(C)CCl	1792880148	YLYKALFBACQMPU-XGUBFFRZSA-N	431.961	1.775	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccnc1-c1ccc(F)cc1)C2)[C@@H](O)CCl	1792978579	HBCFWIMSJNIZTB-QXGSTGNESA-N	447.894	1.691	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1=CCN(C(=O)OC(C)(C)C)C1	1793224944	GTMRUBHRKCDZNN-YVSFHVDLSA-N	441.956	1.771	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN(C)C(=O)c1ccccc1	1793227794	IHFLWUHFEBLSOB-AJYBTWMASA-N	435.952	1.756	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)C1=NO[C@@H](c2ccccc2)C1	1796189014	MQOSIGOCIJDSHE-XAPVIXHLSA-N	447.300	1.136	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCc1cn[nH]c1)C2	1796890689	FJBUBMRGRXHWCA-FWKYCFCSSA-N	425.493	1.115	50	20	IDGD	
COC(=O)c1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](F)Br)C3)cn1	1797032527	HFDSNAKOESNEPM-OPDFLTKYSA-N	428.258	1.811	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2c(cnn2C)c1	1797085644	DLSNKOZUNQCJSS-KYHPRHEASA-N	449.349	1.950	50	20	IDGD	
CN(C)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@](C)(Cl)CCl	1799276475	JKANGURDHTVRKM-AODNKKSCSA-N	429.348	1.587	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)cc([N+](=O)[O-])c1)C2)[C@@H](F)Br	1799348153	ARROQAGVTOREJP-RDBQEKCUSA-N	446.229	1.194	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1nn[nH]c1C(F)(F)F)[C@@H](F)Br	1799441328	SDSQKVLFFQHNKV-JTGULSINSA-N	428.184	1.766	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)c1c(F)cc(Cl)cc1Cl	1799666273	GNBCZSWPBZTJRS-NWIKQPOISA-N	439.698	1.935	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)nc(Cl)c1)C2	1800758286	RUUBFXJDWXNCOL-GCDPNZCJSA-N	432.702	1.427	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCCc1ccccc1F)C2	1800971292	UPHMBFFVPBSNMP-CLWJZODNSA-N	426.916	1.992	50	20	IDGD	
Cc1nccn1CCCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)CBr)C2	1801309644	JJVZLKBLYJFDGV-NYCLONFESA-N	441.370	1.592	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)C1=CCCS1	1803631953	BOYLYKNZVUBGTK-XLIONFOSSA-N	437.330	1.102	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2ccns2)[C@@H]1c1cccnc1	1805220727	JVYFCBWFPHLBFV-KXBFYZLASA-N	430.534	1.231	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H](CNC(=O)[C@H]2CCC(=O)N2)[C@H]1c1cccnc1	1806814503	FQRVGPKBTWEIPF-UMHPPVOVSA-N	427.332	1.602	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)c2ccccc2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1	1807376052	SPVJLTAQAWWVRK-IRLDBZIGSA-N	429.285	1.395	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H](CNC(=O)COCCO)[C@@H]1c1cccnc1	1808626979	APVLVHOAEMRUPW-VYDXJSESSA-N	428.327	1.270	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2cnn3ccncc23)[C@H]1c1cccnc1	1809390161	WVHRTSHJNSMKFJ-VDZJLULYSA-N	442.907	1.698	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1)c1cc(CO)on1	1811589579	JYXFCRPXAVLSLC-GUYCJALGSA-N	437.294	1.667	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)Cn2ccncc2=O)[C@@H]1c1cccnc1	1812340672	MEEWQFDSCZLUFH-UWVAXJGDSA-N	431.924	1.752	50	20	IDGD	
COC(=O)C1(C(=O)NC[C@@H]2CCN(C(=O)CCBr)[C@@H]2c2cccnc2)CC1	1812685638	YNWYWKYTPYQHNK-GOEBONIOSA-N	438.322	1.826	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1	1812773757	IZERXCZMQNCLTQ-AJNGGQMLSA-N	432.746	1.861	50	20	IDGD	
C[C@H](C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)n1cccc1	1813308623	DHBOURODFWJWKF-NQSCKRDGSA-N	446.316	1.144	50	20	IDGD	
COC[C@H](NC(C)=O)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)C(C)(C)CCl)n[nH]1	1814697003	HSSKMMPFLFBGKS-LSDHHAIUSA-N	427.933	1.818	50	20	IDGD	
Cc1noc(C)c1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1816402323	VUVRXASWILERGC-KRWDZBQOSA-N	437.265	1.314	50	20	IDGD	
CC[C@@H](NC(N)=O)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCBr)CC2	1817017379	XGLNZVKNRRLFJX-RKDXNWHRSA-N	432.344	1.287	50	20	IDGD	
CS(=O)(=O)c1cncc(C(=O)N[C@H]2CCc3nc(NC(=O)[C@@H](F)Cl)sc3C2)c1	1817116862	GPXZPEFIFVCPIS-TVQRCGJNSA-N	446.913	1.702	50	20	IDGD	
Cc1ccnc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2ccc(B(O)O)cc2)CC3)c1	1817469220	LTLOUKYXUXEWCY-OAHLLOKOSA-N	436.302	1.066	50	20	IDGD	
Cc1nscc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1	1817473542	ZQWMIZMOQOZJET-KRWDZBQOSA-N	439.306	1.474	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](N)Cc2cscn2)n[nH]1	1817980469	MEBYQAPEDAJCJC-YDHLFZDLSA-N	440.957	1.682	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccnn2)[nH]n1	1818112701	HLXGFIAIJGBWHU-GDQCRLHRSA-N	449.475	1.640	50	20	IDGD	
CC1=CC[C@@H](C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2cccc(B(O)O)c2)CC3)CC1	1818622622	RLLPMVLFHVOBOP-RHSMWYFYSA-N	439.346	1.795	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)Cc2ccncc2)[nH]n1	1819404109	YUAAPSCSCVIUQD-SFHVURJKSA-N	448.487	1.352	50	20	IDGD	
CC[C@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](COC(C)=O)OC(C)=O)[nH]n1	1820856537	PKUYPRAPQVMFMT-NUEKZKHPSA-N	442.900	1.914	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)CCc2cnn(C)c2)[nH]n1	1822414257	OUIVGARJINJLSJ-QGZVFWFLSA-N	444.540	1.141	50	20	IDGD	
COC(=O)C1(C(=O)N[C@@H]2CCc3nc(NC(=O)[C@@H](F)Br)sc3C2)CC1	1823009015	JGDMTTODKIDWBJ-GMSGAONNSA-N	434.287	1.699	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(=O)n2O)CC1	1825494184	BZDZJIIPZWYXDV-HZPDHXFCSA-N	425.913	1.573	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCC(F)(F)F)CC2	1826085439	UBHMMJRJWVCBNX-JTQLQIEISA-N	435.472	1.771	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)CC[C@@H]1CCOC1)CC2	1826092135	NHENUGJCJHVOAN-ZIAGYGMSSA-N	437.566	1.245	50	20	IDGD	
CN[C@H](CC(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H](C)Br)CC1)C(=O)O	1826947937	HEZZRRPQDAKTDC-NWANDNLSSA-N	432.359	1.452	50	20	IDGD	
O=C([C@H]1CCCCO1)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827049363	RZRHSSMVUJRTSC-NHCUHLMSSA-N	428.338	1.169	50	20	IDGD	
O=C([C@H](O)CCl)N1CCC([C@@H]2CCCCN2C(=O)CSc2ncccn2)CC1	1827170397	JVDRUTXSHXNMAE-JKSUJKDBSA-N	426.970	1.788	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H]2C[C@H]2C2CC2)CC1	1828923670	RZMQCZFUIFCGQJ-IRFCIJBXSA-N	439.560	1.965	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@H]2CC2(F)F)CC1	1828924430	SEMVMHOTQFMDCX-SJORKVTESA-N	435.475	1.574	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830353574	FUGRLDJBTVSLBZ-GUYCJALGSA-N	439.778	1.739	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3snnc3C3CC3)C2)C1	1830357864	MWVSNPONMVVVFS-IBGZPJMESA-N	442.969	1.751	50	20	IDGD	
CC(C)(Cc1ccccc1)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H](O)CCl)CCO2)C1	1830719684	HIZVAYNZFPLTDB-AVRDEDQJSA-N	438.952	1.311	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)c1	1832436907	DIOCOCQBHNWARG-UYAOXDASSA-N	428.888	1.673	50	20	IDGD	
COC(=O)C1(C(=O)N2CCC(N3CCC(NC(=O)C(C)(C)CCl)CC3)CC2)CC1	1833216207	YLXAJWDNJPAKTR-UHFFFAOYSA-N	427.973	1.776	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3nccc4[nH]ccc34)CC2)CC1)[C@@H](O)CCl	1833310876	XENYEXDXPNFZHZ-SFHVURJKSA-N	433.940	1.348	50	20	IDGD	
COC(=O)CCC(=O)NC1CCN(C2CCN(C(=O)[C@H](C)CBr)CC2)CC1	1834431520	JKLOERLUKWUKHT-CQSZACIVSA-N	446.386	1.542	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(F)cn3)CCO2)C1	1834481392	OCMNZKDWLFTJRU-MSOLQXFVSA-N	434.295	1.527	50	20	IDGD	
Cc1noc(CC(=O)NC2CCN(C3CCN(C(=O)[C@@](C)(Cl)CCl)CC3)CC2)n1	1834851956	ZPAQEYGGISKAAO-IBGZPJMESA-N	446.379	1.728	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(CN(C(=O)CCN3CCCCC3)CCO2)C1	1835134894	PMBHQBUECHTUST-OAQYLSRUSA-N	441.645	1.170	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC1CCN(C2CCN(C(=O)Cc3cncnc3)CC2)CC1	1835834959	IYRBYAHZFCCCQZ-UHFFFAOYSA-N	433.629	1.442	50	20	IDGD	
O=C(CCc1cccnc1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1836182717	RQCDHBZOHOCGOC-SJLPKXTDSA-N	444.301	1.161	50	20	IDGD	
Cc1nnc(CC(=O)N2CCC(N3CCC(NC(=O)[C@](C)(Cl)CCl)CC3)CC2)o1	1836398804	VXBVXOGWVRIJMO-LJQANCHMSA-N	446.379	1.728	50	20	IDGD	
O=C([C@H](O)CCl)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CCC[C@@H]3CCCC[C@H]31)CCO2	1836697297	KSGNXZQFCSETDC-CPYOPQHUSA-N	442.984	1.649	50	20	IDGD	
O=C(c1cnsn1)N1CCC(OC2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1837298147	KBMKESRCYSNULF-CYBMUJFWSA-N	435.319	1.841	50	20	IDGD	
CSCC(C)(C)C(=O)N1CCOC[C@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1837710339	WPJPTGYZIDPKLV-IBGZPJMESA-N	432.659	1.684	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(Cl)ccn3)C2)C1	1837715594	ZOLKYBGJNVALRM-LJQANCHMSA-N	441.988	1.657	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCC(OC2CCN(C(=O)c3cnc(O)[nH]3)CC2)CC1	1838477069	AHGXCUNDTYXJIU-GOSISDBHSA-N	433.336	1.964	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3CC[C@H](C(=O)OC)CC3)C2)C1	1839142018	BQSSVPNMZNIADC-LHUKNYEISA-N	444.956	1.440	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cn(C)nc3C(F)F)C2)C1	1839144826	LKAZZQMKTBIKHO-SCLBCKFNSA-N	434.871	1.445	50	20	IDGD	
Cc1cnc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)s1	1839151531	VEWOPFVKPPIWNL-SJORKVTESA-N	436.361	1.758	50	20	IDGD	
CCc1noc(C)c1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839200897	RSYISEHBFIUHPU-YOEHRIQHSA-N	448.289	1.306	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3c(C)n[nH]c3C)CCO2)C1	1839238316	GMPFMQIBGOGBKL-YLJYHZDGSA-N	426.945	1.433	50	20	IDGD	
CC[C@H](O)C(=O)N1CCOC[C@@]2(CN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)CCO2)C1	1839741800	BNYBLHWVBYOCMK-IVXLGNKDSA-N	449.454	1.099	50	20	IDGD	
Cc1c(F)cccc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)Br)CCO2	1840030404	KPWWKQCLTPCCNP-LIRRHRJNSA-N	443.313	1.988	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)/C=C/c3cnc[nH]3)CCO2)C1	1840343785	ZVOXWODWOUCIMU-QBAOTHAWSA-N	431.320	1.116	50	20	IDGD	
COC1(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)CCC1	1840618417	GOKWFGVDILJWLM-RDTXWAMCSA-N	433.343	1.185	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2cc3ccoc3s2)C1	1843240096	QTRGNHVWUFORKI-UHFFFAOYSA-N	425.470	1.624	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)N2CCCC23CN(C(=O)[C@@H](O)CCl)C3)CC1	1843931118	LJMIVWJOFLSRAW-HOTGVXAUSA-N	443.972	1.827	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2ccc(N(C)C)nc2)C1	1844551662	JAUCGKKBCREBEC-MFKUBSTISA-N	437.504	1.099	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)c2ccc(OC(F)F)cc2F)C1	1844711843	AFLYZCQVAJQBFY-UHFFFAOYSA-N	448.206	1.238	50	20	IDGD	
CC(C)O[C@@H](C)C(=O)N1CC2(CCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)C1	1845039013	UMGGRCDHQVSBCI-SFHVURJKSA-N	445.564	1.350	50	20	IDGD	
CCN(CC)[C@H](C(=O)N1CCCC12CN(C(=O)CCC(=O)NN(C)C)C2)c1ccccc1	1845840583	SHVIFFJFIGERQE-QFIPXVFZSA-N	443.592	1.646	50	20	IDGD	
C=C[C@@H]1C[C@]1(NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)[C@H](Cl)COC)C2	1847084267	NHVWUQRUGXDVPF-VTJXTGGHSA-N	441.956	1.913	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@](C)(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](O)CCl)C1	1847559492	NHGZAUORKYOVHU-VPCSNGCSSA-N	429.945	1.435	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H]1C[C@H]2C[C@H]2N1C(=O)OC(C)(C)C	1847574238	SOMLPQKCCAMGMA-UTQGOSHXSA-N	441.956	1.840	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1O	1847868443	BKVZEWPHMJRBBE-XAJHFOFHSA-N	443.972	1.824	50	20	IDGD	
Cc1cccc(C)c1NC(=O)CN(C)C(=O)NNC(=O)c1csc(N2CCOCC2)n1	9755812	RDZPVGIJXQRBRS-UHFFFAOYSA-N	446.533	1.521	50	20	IDGD	
CCNS(=O)(=O)c1ccc(C)c(C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)c1	10160015	RVRILNCRFPKTQB-UHFFFAOYSA-N	443.485	1.259	50	20	IDGD	
COc1ccc([N+](=O)[O-])c(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1	60064509	JCXUVAVSZAQVNA-UHFFFAOYSA-N	448.457	1.463	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)OCC(=O)NC(=O)NCc2ccco2)c1C	206252095	RFGOJTDBKZEOJE-YVLHZVERSA-N	428.445	1.821	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NC[C@@H]1CCN(c2ccc(F)c(F)c2)C1	726243585	AZFVVINVVLNLMQ-LBPRGKRZSA-N	437.472	1.613	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)N[C@H]2CCc3nc(C)nn3C2)c2ccccc2c1=O	727229757	VJYOFJPXILWWNA-AWEZNQCLSA-N	438.492	1.056	50	20	IDGD	
NC(=O)c1ccc(/C=C\C(=O)N2CCC[C@H]2C(=O)NNC(=O)CCCc2ccccc2)cc1	727715512	RANLPHSMTMEKKJ-XHVGKJTDSA-N	448.523	1.960	50	20	IDGD	
O=C(NNC(=S)NC1CCOCC1)c1cccc(S(=O)(=O)N2CCCCC2)c1	727781150	BEXYRJCSANOMHO-UHFFFAOYSA-N	426.564	1.149	50	20	IDGD	
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC[C@H](C(=O)NNC(=O)c2c[nH]c3ccccc23)C1	728203109	FWSHTNZQWANGPI-AWEZNQCLSA-N	444.517	1.370	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3ccc4c(c3)OCCO4)cc2)CC1	728213972	SXBOOKXEJGJMTJ-UHFFFAOYSA-N	432.502	1.151	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3cc(-c4ccncc4)on3)cc2)CC1	728216223	VAJHLTCRYXYRDA-UHFFFAOYSA-N	442.501	1.430	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)[C@@H]2CS[C@]3(C)CCC(=O)N23)c1	728529874	RNWTYVLLPCFGGQ-BLLLJJGKSA-N	428.308	1.673	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NC[C@@H]2CN3CCC[C@@H]3CO2)ccc1OCCC(C)C	729619388	PPMKKGPNZLLPJX-QZTJIDSGSA-N	434.537	1.927	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2ccc(C)cc2F)c1	729663115	ULCFRINIQJZTIX-UHFFFAOYSA-N	443.522	1.788	50	20	IDGD	
COC1CCN(C2(CNC(=O)NNC(=O)CNC(=O)c3cccs3)CCCC2)CC1	730914172	MFQNXMQRFSGXNN-UHFFFAOYSA-N	437.566	1.232	50	20	IDGD	
CCN(Cc1nc(O)c2cc(OC)c(OC)cc2n1)[C@@H](C)C(=O)NNC(=O)CC(C)C	732194895	DHLYKUVDEVYIKX-ZDUSSCGKSA-N	433.509	1.757	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCCCCCN1CCCCC1	732236152	QWQQRHPWRRXSOC-UHFFFAOYSA-N	438.598	1.888	50	20	IDGD	
O=C(CS(=O)(=O)CCCc1ccccc1)NNC(=O)c1cnn(-c2ccccc2)c1	733108339	NBNKEYNCJYRKSB-UHFFFAOYSA-N	426.498	1.681	50	20	IDGD	
O=C(NNC(=O)N1CCN(C(=O)c2cccc(O)c2)CC1)c1cnn(-c2ccccc2)c1	733349719	FJIHCWBDGXWMRQ-UHFFFAOYSA-N	434.456	1.390	50	20	IDGD	
C[C@](O)(CNC(=O)NNC(=O)c1csc(N2CCOCC2)n1)c1ccc(F)cc1F	734007692	YPIIBYLCBNOVKX-SFHVURJKSA-N	441.460	1.110	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2cnn(-c3ccc(F)cc3)n2)c2ccccc2c1=O	737469164	HNEXLNHCLYRQFI-UHFFFAOYSA-N	435.419	1.601	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)c1cccc(CN2C(=O)c3ccccc3C2=O)c1	740850912	FKYHCTZIQCHFMA-UHFFFAOYSA-N	436.468	1.549	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)CCCN1C(=O)c2cccc3cccc(c23)C1=O	740851581	MRHUYHZVKBQYGK-UHFFFAOYSA-N	438.484	1.668	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)C1CCN(c2oc(-c3ccco3)nc2C#N)CC1	740852112	LEGXROHXNPYNFT-UHFFFAOYSA-N	442.476	1.475	50	20	IDGD	
CCO[C@@H](C)c1ncc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)s1	742470261	CDKJVBYQRQORKH-NSHDSACASA-N	426.520	1.566	50	20	IDGD	
CC(C)c1nn([C@H]2CCS(=O)(=O)C2)cc1C(=O)NNC(=O)c1c[nH]c2ccccc12	742487412	PVCGINVGMNCNLS-ZDUSSCGKSA-N	429.502	1.922	50	20	IDGD	
O=C(NNC(=O)[C@H](c1ccc(Cl)cc1Cl)N1CCOCC1)C(=O)N1CCCC1	742601443	JSAWBTIGYVHTHH-HNNXBMFYSA-N	429.304	1.137	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)NC2CCN(S(C)(=O)=O)CC2)cc1Cl	743529060	ULFWYMIAUIZLCZ-UHFFFAOYSA-N	449.917	1.117	50	20	IDGD	
C[C@H](CN1CCN(c2ccccc2)CC1)NC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	743632429	GRGUGXRNNNZEON-UTKZUKDTSA-N	439.516	1.368	50	20	IDGD	
Cc1cccc([C@@H](CNC(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)N2CCOCC2)c1	745489637	RTYNDVHZEMEQLI-GOSISDBHSA-N	443.460	1.626	50	20	IDGD	
CCc1ccc([C@H](COC)NC(=O)NNC(=O)c2nn(CC)c(=O)c3ccccc23)o1	745847375	PEUBOZSGXGWGRG-INIZCTEOSA-N	427.461	1.904	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)N[C@H]1CCN(c2ccccc2Cl)C1=O	746765620	RWYRLABUGCTYNL-HNNXBMFYSA-N	426.864	1.666	50	20	IDGD	
C[C@@]1(c2ccc(CNC(=O)NNC(=O)c3ccc(Cl)cc3F)cc2)NC(=O)NC1=O	747585761	KAUYEIXSXGPMEU-IBGZPJMESA-N	433.827	1.678	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN1C(=O)c1cc(Cl)cc(Cl)c1)C(=O)N1CCCC1	748240980	NABNGNJENIYUIT-CQSZACIVSA-N	427.288	1.368	50	20	IDGD	
O=C(CCc1ccco1)NNC(=O)[C@@H]1CCC[C@@H](C(=O)NNC(=O)CCc2ccco2)C1	748260973	CBIXKRVBJPIYHF-HZPDHXFCSA-N	444.488	1.539	50	20	IDGD	
COc1cc(OC)cc(N2CC[C@H](NC(=O)NNC(=O)Cc3cn4ccccc4n3)C2)c1	748663037	ZFMVJWBICLSXSG-HNNXBMFYSA-N	438.488	1.503	50	20	IDGD	
CS(=O)(=O)c1cc(Br)cc(C(=O)NNC(=O)NCc2ccco2)c1F	748717341	GIVGVSSZFPQJBC-UHFFFAOYSA-N	434.243	1.729	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCCc2nnc(-c3ccccc3)o2)c2ccccc2c1=O	749205141	YCZHGHKQCCBMLO-UHFFFAOYSA-N	447.455	1.653	50	20	IDGD	
CCCn1c(=O)n(CCC(=O)NNC(=O)CNC(=O)c2cccs2)c2ccccc21	751210046	YGCFYDOICAKCBZ-UHFFFAOYSA-N	429.502	1.242	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)C1	751795205	NHHVONOMVKBCGJ-UHFFFAOYSA-N	446.552	1.148	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)[C@H]1CC(=O)N(CCOc2ccccc2Cl)C1	751993132	GFNOEKJSFFXOLB-ZDUSSCGKSA-N	438.912	1.020	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)N[C@@H]1CCCN(Cc2ccccn2)C1=O	753287199	AKZZDVJPZFMDQP-MRXNPFEDSA-N	431.880	1.879	50	20	IDGD	
COc1c(C)c2c(c(O)c1C/C=C(/C)CCC(=O)NNC(=O)Cc1cc[nH]n1)C(=O)OC2	755260984	HNTZJMFRLLOVJD-QCDXTXTGSA-N	442.472	1.762	50	20	IDGD	
O=C(CCCS(=O)(=O)c1ccc(Br)cc1)NNC(=O)Cc1cc[nH]n1	755284588	TZHHLFFIPLVIDI-UHFFFAOYSA-N	429.296	1.116	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)Nc1nnc(SCc2ccccc2)s1	755417257	KLDHVGYYWGNYLF-NSHDSACASA-N	427.533	1.418	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)Nc1cccc(S(=O)(=O)NC2CC2)c1	755586281	UBUXNAXVCJOSCU-LBPRGKRZSA-N	436.465	1.887	50	20	IDGD	
CCOC(=O)COc1cccc(NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1	755646063	JKERSUVQCDEPLC-UHFFFAOYSA-N	442.476	1.488	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)Nc1ccc(N2C[C@H](C)O[C@@H](C)C2)nc1	755864356	HYSSQKBYZPWGOS-GJZGRUSLSA-N	429.477	1.936	50	20	IDGD	
CN1CCCCC/C1=N\S(=O)(=O)c1ccc(NC(=O)NNC(=O)Cc2cc[nH]n2)cc1	756115259	SXELYNWHSVTUAV-KOEQRZSOSA-N	447.521	1.398	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)Nc1cccc(C[S@](=O)Cc2ccccc2)c1	756595833	ZEOTTWHXMRQPLD-CQGGRAHPSA-N	449.554	1.723	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)c1ccc(C(=O)NC2CC2)cc1	756853630	IAKPXLOAPXPSQO-UHFFFAOYSA-N	435.528	1.552	50	20	IDGD	
CC(=O)N1CC[C@H](NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c2ccccc21	757021573	ARBFCQLREAVNAB-SFHVURJKSA-N	437.504	1.521	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N[C@H](C)c2cn[nH]c2)cc1	757573390	DANIOWCUXCAIQU-BRYYZUPOSA-N	433.472	1.942	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)Nc1cccc(S(=O)(=O)NCc2ccco2)c1	757862200	GBLXJQSCLMLRCN-UHFFFAOYSA-N	429.458	1.549	50	20	IDGD	
O=C(NNC(=O)C(=O)Nc1ccccn1)NC1CCN(Cc2ccc(F)c(F)c2)CC1	758700895	LTIRTCSHNZCJEZ-UHFFFAOYSA-N	432.431	1.293	50	20	IDGD	
Cc1ccc(S(N)(=O)=O)cc1NC(=O)COC(=O)/C(C#N)=C/c1cc(C#N)n(C)c1C	759879732	ZFHBYHNQXPTPBF-GIDUJCDVSA-N	441.469	1.250	50	20	IDGD	
CC1(C)C(=O)N(C[C@](C)(O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)c2ccccc21	760084329	GSOUZFGDQDGRRZ-QHCPKHFHSA-N	439.468	1.294	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)c1nc(-c2ccccc2)no1	760330797	DALSNFQUBXNNQK-CYBMUJFWSA-N	443.485	1.888	50	20	IDGD	
CCCOc1cccnc1C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	760451201	ZQPRHVZEUDCNJF-UHFFFAOYSA-N	425.489	1.089	50	20	IDGD	
Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCC(C(=O)NNc2ncc(F)cn2)CC1	760906874	LEXXQRGJAICFPU-UHFFFAOYSA-N	438.441	1.376	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)NCc1cccnc1N1CCOCC1	761658971	DMPDOQQFECLZDS-UHFFFAOYSA-N	431.518	1.550	50	20	IDGD	
CC(C)(C)c1ccccc1S(=O)(=O)N1CCN(S(=O)(=O)CBr)CC1	763206143	OJUBJLMKYPVVSW-UHFFFAOYSA-N	439.397	1.973	50	20	IDGD	
CCC(=O)NNC(=O)C(=O)Nc1cc(S(=O)(=O)N2CCCCC2)ccc1OC(C)C	763431286	RNPIZXREHUMNJV-UHFFFAOYSA-N	440.522	1.144	50	20	IDGD	
COc1cc(Br)c(NC(=O)C(=O)NNC(=O)c2ccccc2O)cc1OC	763529798	NGYHWRGVAIVSBV-UHFFFAOYSA-N	438.234	1.572	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)C(=O)Nc1ccc(F)cc1Br	763679074	AWJGCAIUJKRWDH-UHFFFAOYSA-N	428.189	1.892	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2cccc([C@@H](C)OC)c2)c2ccccc2c1=O	763786980	TXUYMZSUOAYORO-CYBMUJFWSA-N	437.456	1.524	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(OC(C)C)c(NC(=O)C(=O)NNC(=O)C(C)C)c1	763816427	GZLAEXMNUKQCGQ-UHFFFAOYSA-N	442.538	1.246	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)C(=O)Nc2nocc2C)c2ccccc2c1=O	763820106	FXCSZKDDERPXLD-UHFFFAOYSA-N	426.433	1.283	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)ccc1C(=O)N(C)C	763841899	UYZWJFDNPSQKPU-INIZCTEOSA-N	440.500	1.867	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)C(=O)Nc1cnn(-c2ccccn2)c1	763850851	BDAKIUVJLKFRGQ-HNNXBMFYSA-N	444.451	1.974	50	20	IDGD	
COc1c(F)cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(C(C)=O)cc2)cc1F	763871141	DVWSXCRDHFVPCF-LLVKDONJSA-N	435.383	1.729	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2cccn2C)cc1NC(=O)C1CCCCC1	763998180	GWKJSWGCFFFQSY-UHFFFAOYSA-N	441.488	1.952	50	20	IDGD	
CC(C)(C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1	764006148	LDOWQKGTWQHIIV-UHFFFAOYSA-N	440.456	1.386	50	20	IDGD	
COCCOc1ccc(C#N)cc1NC(=O)C(=O)NNC(=O)c1ccc(Cl)cc1OC	764012935	VCUVVPSSXVBZHH-UHFFFAOYSA-N	446.847	1.645	50	20	IDGD	
CC(C)(C)OC(=O)NCCOc1ccc(NC(=O)C(=O)NNC(=O)C2CCCC2)cc1	764066941	UYKIUVVWRPATTO-UHFFFAOYSA-N	434.493	1.866	50	20	IDGD	
CCn1nc(C)c(NC(=O)C(=O)NNC(=O)c2ccc(F)cc2Br)c1C	764083734	AOZAQFUDZRNBPH-UHFFFAOYSA-N	426.246	1.821	50	20	IDGD	
CCCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)CCOc2ccccc2)cc1	764160983	MHXSQYUYRLYLIS-UHFFFAOYSA-N	448.501	1.393	50	20	IDGD	
CC[C@@H](C)NS(=O)(=O)c1cccc(NC(=O)C(=O)NNC(=O)CCc2ccco2)c1	764177223	KRYYQSARBKOCNG-CYBMUJFWSA-N	436.490	1.075	50	20	IDGD	
CC(C)n1nnnc1-c1ccccc1NC(=O)C(=O)NNC(=O)Cn1ccc2ccccc21	764244248	DYJZFABPWUEQDO-UHFFFAOYSA-N	446.471	1.662	50	20	IDGD	
Cc1ncsc1C(=O)NNC(=O)C(=O)Nc1ccc(-c2nnc3n2CCCCC3)cc1	764247638	VNBXMSYTGSWYQC-UHFFFAOYSA-N	439.501	1.836	50	20	IDGD	
CC(C)(C)c1ccc(Cn2nccc2NC(=O)C(=O)NNC(=O)Cc2ccccn2)cc1	764270079	DZEPTVPIBCPFOU-UHFFFAOYSA-N	434.500	1.953	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)C(=O)Nc1ccc(-n2cnc3ccccc32)nc1	764278984	VOCBGCZJPJWFAI-UHFFFAOYSA-N	444.451	1.845	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)C(=O)Nc1ccc(NC(=O)c2ccccc2)nc1	764281511	YKUJSLBALXLRNR-UHFFFAOYSA-N	447.451	1.758	50	20	IDGD	
O=C(Cc1cc[nH]n1)NNC(=O)C(=O)Nc1cc(C(F)(F)F)ccc1N1CCCCC1	764285333	AKGLEZJZBYKMKJ-UHFFFAOYSA-N	438.410	1.747	50	20	IDGD	
COC(=O)c1cc(OC)c(OC)cc1NC(=O)C(=O)NNC(=O)C(C)(C)c1ccccc1	764308942	JETANUUKLWMYRQ-UHFFFAOYSA-N	443.456	1.554	50	20	IDGD	
COC(=O)c1cc(F)c(F)cc1NC(=O)C(=O)NNC(=O)c1ccc(O)c(Cl)c1	764349166	GRDCDEGTGAKLAA-UHFFFAOYSA-N	427.747	1.510	50	20	IDGD	
CCCCn1ncc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3OC)[nH]n2)c1C	764377403	PAQPZVIAJMCJDF-UHFFFAOYSA-N	439.476	1.790	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1cc(C2CCCC2)nn1-c1ccccc1	764398120	OTPULXYYFXGYMK-OAHLLOKOSA-N	443.504	1.667	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)c2cc([N+](=O)[O-])cc3c2OCCO3)n[nH]1	765593297	WAYMNWMGTOODMU-UHFFFAOYSA-N	439.384	1.840	50	20	IDGD	
O=C(Cc1ccc2ccccc2c1)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765737179	XDBYFTNUXQCKEG-UHFFFAOYSA-N	430.508	1.988	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)[C@H]1C[C@@]12CCCc1ccccc12	765738797	OMKOZKXVNSFSIX-ATIYNZHBSA-N	446.551	1.886	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)Cc3ccc4c(c3)OCCO4)CC2)cc1	765748413	DACNXLSVAKLXNS-UHFFFAOYSA-N	438.528	1.274	50	20	IDGD	
O=C(CCN1CCN(C(c2ccccc2)c2ccccc2)CC1)NNC(=O)Cn1cccn1	765975587	XRFDMLDARSLFSG-UHFFFAOYSA-N	446.555	1.828	50	20	IDGD	
C[C@@H](CC(=O)NNc1ccccc1S(C)(=O)=O)NS(=O)(=O)c1cccnc1Cl	766667746	CUOPYSSHMSTXFU-NSHDSACASA-N	446.938	1.339	50	20	IDGD	
Cc1cn2c(C=NNC(=O)C(=O)NN=Cc3c(C)nc4sc(C)cn34)c(C)nc2s1	767037114	LPYTZCSGMWURJO-UHFFFAOYSA-N	442.530	1.939	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)c2ccccc2S(=O)(=O)CCN(C)C)c1	767191472	AODXUJBRZNDXCF-UHFFFAOYSA-N	435.502	1.114	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2cnc(Cl)c(Br)c2)n1	768237715	NJLBYOQLCKEXCY-UHFFFAOYSA-N	429.662	1.097	50	20	IDGD	
O=C(NNC(=O)[C@H]1CC(=O)N(c2c(F)cccc2F)C1)c1nn(-c2ccccc2)cc1O	771302713	LMUULVQXDUERFC-LBPRGKRZSA-N	441.394	1.670	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)[C@@H]1CC(=O)N(c2ccccc2Cl)C1	772191128	BMMINELBNPARKH-CYBMUJFWSA-N	449.294	1.810	50	20	IDGD	
CCCS(=O)(=O)c1ccccc1C(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772893410	WURLORFFVMVMMP-UHFFFAOYSA-N	437.905	1.601	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)[C@@H](C)c3ccccc3)CC2)cc1	773389811	HAHSOKKYUNUKCU-SFHVURJKSA-N	444.557	1.252	50	20	IDGD	
O=C(NNc1cccc(C(F)(F)F)c1)C(=O)Nc1cnn(Cc2nnc3n2CCCC3)c1	773583186	WCIORVROIIZERW-UHFFFAOYSA-N	448.409	1.960	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2ccc(OC(F)F)cn2)c1	775221364	QFOVMZNHJUZONV-UHFFFAOYSA-N	443.432	1.078	50	20	IDGD	
O=C(NNS(=O)(=O)c1cnn(CC(F)(F)F)c1)c1ccc(Br)s1	775254889	WYSILUQGCYYBNY-UHFFFAOYSA-N	433.231	1.893	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)Nc2ccc(C[C@H]3NC(=O)NC3=O)cc2)cc1	775699390	AQTBKCGTOWGJAO-QGZVFWFLSA-N	425.445	1.231	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NCC(=O)Oc1ccc([N+](=O)[O-])cc1Br	777321177	GTCRBMVMACWJJV-UHFFFAOYSA-N	432.227	1.904	50	20	IDGD	
O=C(CCC(=O)N1CCN(S(=O)(=O)CBr)CC1)c1ccc2c(c1)CCC2	777777876	RDLIQBYCCDTZEN-UHFFFAOYSA-N	443.363	1.965	50	20	IDGD	
COc1cc(OC)c(NC(=O)C(=O)NNC(=O)c2ccc(C)o2)cc1Br	778710948	BGRTXAQNZHVFCM-UHFFFAOYSA-N	426.223	1.767	50	20	IDGD	
O=C(CN1CCC[C@@H](S(=O)(=O)N2CCc3ccccc32)C1)NNC(=O)c1ccccc1	779624984	SKLJUYBDDXYHEB-LJQANCHMSA-N	442.541	1.305	50	20	IDGD	
Cn1nncc1S(=O)(=O)NC(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccccc1	781738040	LNAVKNHXVXUGQS-GDNBJRDFSA-N	436.457	1.004	50	20	IDGD	
CC(C)C(=O)Nc1nc(CC(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)cs1	782354160	ZBCLPGFGERHMER-UHFFFAOYSA-N	429.458	1.156	50	20	IDGD	
O=C(NNc1ccccc1Br)C(=O)Nc1cnn(CCN2CCOCC2)c1	782989379	ZUBUOGZVUZWZHI-UHFFFAOYSA-N	437.298	1.060	50	20	IDGD	
CCS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccc(Br)cn2)cc1	784341499	OVPIBHVMGNWJMZ-UHFFFAOYSA-N	427.280	1.720	50	20	IDGD	
CNC(=O)Cn1ccc2ccc(NC(=O)C(=O)NNc3ccc(Br)nc3)cc21	784809112	LWPNHXHOUJSMFL-UHFFFAOYSA-N	445.277	1.627	50	20	IDGD	
O=C(NNc1ncccc1Cl)C(=O)Nc1cc(N2CCCS2(=O)=O)ccc1F	784817147	UWAHMOWDLNXFBW-UHFFFAOYSA-N	427.845	1.496	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)C(=O)Nc2cccc(Cl)c2-n2cncn2)c1	784841581	VXTFVHQYIUKKCO-UHFFFAOYSA-N	434.865	1.406	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C2CCN(c3oc(C)nc3C#N)CC2)cc1OC	788629766	BOYWDOMIEPLNTI-UHFFFAOYSA-N	427.461	1.940	50	20	IDGD	
CC(C)(C)OC(=O)N1CC2(C[C@H]2C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)C1	789292688	MRYCWJMAINMKRG-AWEZNQCLSA-N	448.432	1.156	50	20	IDGD	
O=C(NNC(=O)[C@H]1OCC[C@H]1c1ccccc1)C(=O)Nc1cccnc1OCC(F)F	789809743	FQCZNCRXFZHMMF-BBRMVZONSA-N	434.399	1.384	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)N2CCN(CC(=O)N3CCCc4ccccc43)CC2)n1	793221532	WWHNATNTCBUVCK-UHFFFAOYSA-N	436.516	1.341	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)NCC2(S(C)(=O)=O)CCC2)c1	793275870	QEWBDLIEFHJNPS-UHFFFAOYSA-N	434.312	1.369	50	20	IDGD	
COC(=O)C[C@@H]1CCC(=NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)[C@H]1C	794452728	BKIBUGDDWFAPCA-GJZGRUSLSA-N	437.518	1.403	50	20	IDGD	
Cc1cc(F)c(S(=O)(=O)NNC(=O)CNC(=O)OCc2ccccc2)cc1[N+](=O)[O-]	794598363	DVJYOGHXGUKVRR-UHFFFAOYSA-N	440.409	1.278	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)c1cccc(NC(=O)[C@H]2CCCO2)c1	795169877	ZSILADALYFMMHN-QGZVFWFLSA-N	432.502	1.811	50	20	IDGD	
COC(=O)c1cc(F)cc(NC(=O)C(=O)NNC(=O)COc2cc(C)cc(C)c2)c1F	796991203	AGYDEUOGFCDYQZ-UHFFFAOYSA-N	435.383	1.533	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NC(=O)NNC(=O)COc2ccc(C(C)(C)C)cc2)nc1	797653771	LCVIFOCJKRFUPK-UHFFFAOYSA-N	449.533	1.861	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)Nc1cc(S(=O)(=O)N2CCCC2)ccn1	797673340	AIURFQHKZYSPAH-UHFFFAOYSA-N	447.473	1.104	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)Nc1cc(S(=O)(=O)N2CCCC2)ccn1	797674094	QMGGRXMTEZQWAU-UHFFFAOYSA-N	434.434	1.241	50	20	IDGD	
C=CCNC(=S)NNC(=O)Cc1csc(NC(=O)c2ccc(Br)o2)n1	798306276	CLZIYODMBYJYRJ-UHFFFAOYSA-N	444.336	1.975	50	20	IDGD	
COc1cc(OC)cc(C(=O)N2CCC(C(=O)NNC(=O)NCC(F)(F)F)CC2)c1	798314869	DRLOVNGUNOPHJR-UHFFFAOYSA-N	432.399	1.449	50	20	IDGD	
CCOc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NNC(=O)Cc1c[nH]c2ccccc12	799258653	JNHNEYSTXRYGFX-UHFFFAOYSA-N	425.401	1.803	50	20	IDGD	
CCCCNS(=O)(=O)c1ccc(C)c(NC(=O)C(=O)NNc2nc(C)cc(C)n2)c1	799834798	SWQCSGOBBBSFES-UHFFFAOYSA-N	434.522	1.562	50	20	IDGD	
CNC(=O)CNC(=O)c1cccc(NC(=O)NNC(=O)CCSc2ccc(F)cc2)c1	800596899	QHWADCYMQBVDNM-UHFFFAOYSA-N	447.492	1.637	50	20	IDGD	
CC(C)[C@@H](NC(=O)c1ccc(Cl)s1)C(=O)NNC(=O)CNC(=O)c1cccs1	800873892	XRAJERDHCIXPRM-CQSZACIVSA-N	442.950	1.795	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)Cn2c(=O)cnc3ccccc32)c(OC)cc1Cl	802079517	OTXOAQNVXBKSSH-UHFFFAOYSA-N	431.836	1.920	50	20	IDGD	
O=C(CN1C(=O)N[C@]2(CCc3ccccc32)C1=O)NNC(=O)c1cc(Cl)ccc1O	802586162	WCHAMPRYUIKUSI-FQEVSTJZSA-N	428.832	1.200	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNc2ccc3c(=O)[nH]ccc3c2)sc1Br	803430307	ZEPBNVFZQOSHMC-UHFFFAOYSA-N	443.304	1.756	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)C[C@H]2COCCN2C(=O)OC(C)(C)C)c1	803946798	FYUOHEWZJFPWDF-INIZCTEOSA-N	435.477	1.325	50	20	IDGD	
O=C(NC[C@H](O)c1ccc(C(F)(F)F)cc1)NNC(=O)c1ccc(-n2cnnn2)cc1	804867871	NBQJGOUFWJPRGL-HNNXBMFYSA-N	435.366	1.359	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2cc(Br)ccc2O)nnn1Cc1ccncc1	806947423	HRDRWVLQDMVYHE-UHFFFAOYSA-N	431.250	1.573	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)C(=O)Nc1nc(Cc2ccccc2)cs1	806975681	KNBODZTWTUHYHN-UHFFFAOYSA-N	448.468	1.109	50	20	IDGD	
Cc1cc(C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c2cnn(C(C)C)c2n1	809109086	LKFJUGVHHVAQIF-UHFFFAOYSA-N	440.416	1.847	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1)NNc1nc2ccccc2[nH]1	810794059	OIUNFXAQRLKMTO-UHFFFAOYSA-N	429.380	1.883	50	20	IDGD	
Cc1cc(C(F)(F)F)nn1CC(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	811243510	JYAOEZBBPGHQIV-UHFFFAOYSA-N	429.311	1.123	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)NCC[C@@]2(O)C[C@H]3CC[C@H]2C3)c2ccccc2c1=O	813786432	OLSLIOCJUVTKIM-AYSMAOOMSA-N	427.505	1.863	50	20	IDGD	
CNC(=O)c1cc(Oc2cccc(NC(=O)C(=O)NNC(=O)c3ccncc3)c2)ccn1	815563838	PTFFTDHLOAPSLS-UHFFFAOYSA-N	434.412	1.028	50	20	IDGD	
CNC(=O)c1cc(Oc2cccc(NC(=O)C(=O)NNC(=O)C3CCCC3)c2)ccn1	815568041	SWAWKWYDNSMYTJ-UHFFFAOYSA-N	425.445	1.510	50	20	IDGD	
CNC(=O)c1cc(Oc2cccc(NC(=O)C(=O)NNc3ccc(OC)cn3)c2)ccn1	815579090	DWYGONKRQCHSPM-UHFFFAOYSA-N	436.428	1.719	50	20	IDGD	
O=C(NNc1ncncc1F)C(=O)Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1	815765073	FETPXNQHVWOGMH-UHFFFAOYSA-N	436.469	1.262	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)c2nnn(-c3ccn(C)n3)c2C)c(OC)cc1Cl	816597635	ZWTSHUNPGUHLRL-UHFFFAOYSA-N	434.844	1.446	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@H](CN1CCCC1)c1ccccc1	816828963	WMCLBJGYWQJSFH-GOSISDBHSA-N	443.573	1.929	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)[C@@H]2CC(=O)N(c3cc(Cl)ccc3OC)C2)cc1	825529981	PMEXWVRKFMBGRQ-CYBMUJFWSA-N	446.891	1.970	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](NC(=O)NCc2ccc(F)cc2)C(C)C)cc1	893072315	ILZWQEMBESNHDG-SFHVURJKSA-N	443.479	1.744	50	20	IDGD	
Cc1ccc(S(N)(=O)=O)cc1C(=O)NNC(=O)COc1ccc(Br)cc1	913457398	CKXZIVPFZIWBCA-UHFFFAOYSA-N	442.291	1.245	50	20	IDGD	
Cc1ccn(-c2ccc(C(=O)NNC(=O)c3sc(N4CCOCC4)nc3C)cc2)n1	915636289	FGJGBESCURPWFQ-UHFFFAOYSA-N	426.502	1.857	50	20	IDGD	
O=C(NCCN1CCN(Cc2ccccc2)CC1)NNC(=O)c1cc2c(s1)CCC2	915902370	SJKPBLUYJLOVHT-UHFFFAOYSA-N	427.574	1.999	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CCc2c(C)nc3ccnn3c2C)cc(OC)c1OC	916725775	WRWDXHGCIRWKJK-UHFFFAOYSA-N	427.461	1.766	50	20	IDGD	
O=C(CCCNC(=O)OCc1ccccc1)NNC(=O)c1csc(N2CCOCC2)n1	916746358	NLEJOJSIFSIELC-UHFFFAOYSA-N	447.517	1.447	50	20	IDGD	
COc1cccc(CCC(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1OC	917288705	BAQHTJOZFKDALM-GOSISDBHSA-N	444.440	1.167	50	20	IDGD	
O=C(Cc1csc(-c2ccc(Cl)cc2)n1)NNC(=O)N[C@@H]1CCS(=O)(=O)C1	919884643	JGBVLRQGMDWOIR-GFCCVEGCSA-N	428.923	1.524	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)[C@@H]2CS[C@H](Cc3ccccc3F)C(=O)N2)cc1	920212650	FRSXQOLFAXJPBL-RBUKOAKNSA-N	445.516	1.757	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2cccc(CN3CCC[C@H]3C(N)=O)c2)cc1OC	920929265	FMRPJCPTLFEAPE-KRWDZBQOSA-N	441.488	1.620	50	20	IDGD	
CC(=O)NCCc1ccc(S(=O)(=O)NNC(=O)c2cncn2-c2ccccc2)cc1	1317918212	QZLZMONVODHCCX-UHFFFAOYSA-N	427.486	1.174	50	20	IDGD	
O=C(NCCNC(=O)c1ccccc1Cl)NNC(=O)c1cncn1-c1ccccc1	1319025619	NAJAALXEDXZDNA-UHFFFAOYSA-N	426.864	1.900	50	20	IDGD	
O=C(CNc1ccccc1)NNC(=O)c1cccc(NN2C(=O)[C@@H]3CC=CC[C@H]3C2=O)c1	1344716701	CBYPNDHYKCIQNG-RTBURBONSA-N	433.468	1.838	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4nccnc4c3)C2)C1	1777980989	PADDQYABXJDIKK-YJYMSZOUSA-N	433.306	1.857	50	20	IDGD	
O=C(c1cc2ncsc2[nH]1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1779338467	OBAKQJLZGCVKPY-IAQYHMDHSA-N	431.287	1.758	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnn3ccncc13)C2	1779544358	YCBKBOWLCAFXQP-WIYYLYMNSA-N	445.596	1.708	50	20	IDGD	
CCc1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](Cl)COC)C3)n(C)n1	1779768483	PGCGSDCRVZBJRY-WRWLIDTKSA-N	426.945	1.364	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2)c1cncc(C(F)(F)F)c1	1779852910	NTEAXRSBHSSJJM-IIDMSEBBSA-N	449.857	1.828	50	20	IDGD	
COc1c(Cl)ccnc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2	1780171752	NCQCAWDSGVVGLR-PJIJBLCYSA-N	446.331	1.471	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C=N/N1CCCCC1)C2)[C@H](F)Br	1780774763	LNEBBOINUNINIW-GXTSNSKESA-N	447.349	1.663	50	20	IDGD	
C[C@H](NC(=O)c1ccc(F)cc1)C(=O)N1CC[C@@]2(CN(C(=O)[C@@H](F)Cl)CCO2)C1	1780901613	LYRMYRBPCFMWTA-HGQUKEQDSA-N	429.851	1.308	50	20	IDGD	
COc1cc(F)ccc1C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781333898	HLXXFZTYIWIARH-YOEHRIQHSA-N	433.249	1.968	50	20	IDGD	
O=C(c1c(Cl)ccc(Cl)c1O)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1781943788	IHAZAIBAXSJVGW-SJKOYZFVSA-N	437.707	1.742	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3c(F)ccc([N+](=O)[O-])c3C)C2)C1	1781987944	YXCODNKFTPLZOK-ORAYPTAESA-N	443.859	1.740	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(CCN(C(=O)c3ccc(C4CC4)cc3)C2)C1	1782020261	CUQWVSFZABBWTM-DEOSSOPVSA-N	434.301	1.001	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)C3(O)CCC3)[C@H]2C1	1783516161	MNEBOFRANQXWQZ-GVRJEKJASA-N	431.371	1.691	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](C)Oc1cccnc1)CCO2	1783540625	ZVKNLLKOKIOMRC-SUNYJGFJSA-N	426.311	1.462	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C[C@H]3OCCc4ccccc43)C[C@@H]21)[C@H](O)CCl	1784085831	PQCANAROVOJUOT-FLNBYBTLSA-N	436.936	1.270	50	20	IDGD	
C[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCBr)[C@H]2C1)n1ccccc1=O	1786406494	WNCUEHFFBXQIIH-VGWMRTNUSA-N	440.338	1.174	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3cscn3)[C@H]2C1	1787041425	NGXKSHUQNZQNPK-MXAVVETBSA-N	430.368	1.839	50	20	IDGD	
COc1ccc(C(=O)NC2(c3ccc(NC(=O)c4cccc(B(O)O)c4)cc3)CCC2)cn1	1788144951	HFDQKTNSAYBHGQ-UHFFFAOYSA-N	445.284	1.832	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)COC(=O)C(F)(F)F)[C@H]2C1	1788528497	USTAMACNFWPUSQ-SRVKXCTJSA-N	428.835	1.337	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc(OCF)cn3)C[C@@H]21	1788761015	ILQSVBQVHFLOPQ-DZKIICNBSA-N	440.548	1.227	50	20	IDGD	
COC(=O)CSCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]2C1	1789867675	IBLNDKALMXNLFW-MRHIQRDNSA-N	441.377	1.109	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4nn[nH]c4c3)C[C@@H]21	1791063995	ZRXSDSCILIXOFZ-SDPXSBNPSA-N	436.310	1.335	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3C[C@@H]3c3ccccc3)C[C@@H]21	1791293323	VOIYRUUBHVACHW-SSTJLMRISA-N	442.560	1.143	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1(c2ccc(O)cc2)CC1)c1ccc(B(O)O)cc1	1793168585	TXLWVYJFOKOTEL-ACDBMABISA-N	434.301	1.056	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CC[C@H](C(=O)OC)CC1)C2	1793447662	LYHMNUZEGAYNOG-WJWMFLMHSA-N	428.957	1.963	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccc(F)cc1Cl	1793743344	IFUIFDKWFOSNMX-ZDFLXESQSA-N	433.307	1.865	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1CC(=O)N(C2CCCC2)C1	1794030877	FKQHQKZOTUWAFJ-ABJHKEKUSA-N	425.957	1.670	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1(c3ccccc3F)CC1)C2	1796192895	WQIQVZRBTWISOX-REPLKXPHSA-N	436.292	1.489	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H]1C=C[C@@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Cl)C1	1796365105	TWOGBFFKYFLKKO-XMEMRUQMSA-N	445.919	1.580	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](C)[C@@H]1SC(=N)NC1=O	1796879720	WYIAGMSQNLYVQP-OWSRUXPGSA-N	431.356	1.210	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc3cnccc3[nH]1)C2	1796892570	RAUJCNQVQWTKHL-FKDCUARVSA-N	447.499	1.949	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)N1C[C@@H]2C[C@H]2C1	1797638902	YBBDTBREBOUBND-XAMOXFFSSA-N	428.371	1.090	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccnc(Br)c1	1798020832	CMJCWODBFXGPNF-XFMPKHEZSA-N	446.729	1.301	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2c(c1)NC(=O)[C@@H](C)O2	1798582528	GKTWJCYKZYAOLY-UDUPSFLGSA-N	435.908	1.627	50	20	IDGD	
CC(C)Cc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCC(=O)NN(C)C)C3)cc1	1799719517	GJECUWXZFBFUKF-JHDGKUDLSA-N	444.576	1.461	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccn3ccnc13)C2	1800641773	KCGLSAVZQZNMLZ-OCVGTWLNSA-N	435.322	1.711	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)Br	1800763203	STGOABNDRPUEGO-IJOLSIAMSA-N	443.338	1.115	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cc(F)ccc1Cl)C2	1800974315	SAOCIYGYEHBTBC-VLWCASSMSA-N	433.307	1.865	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c[nH]c3cccc(OC)c13)C2	1800979393	DIFDOWBGIOFLPP-QPWUGHHJSA-N	435.908	1.634	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@]1(C)CC=CCC1	1801537094	TZWQZTIYAOZNOO-MRGAGSPKSA-N	441.532	1.456	50	20	IDGD	
COc1ccc(CCC(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]2c2cccnc2)cn1	1803136394	QALMOVVEFBSLPL-DBXWQHBBSA-N	446.935	1.724	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)C2(Br)CC2)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803141285	NYDXMTKIFTXPRX-MELADBBJSA-N	430.730	1.615	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@H](CNC(=O)Cc2cnccn2)[C@H]1c1cccnc1	1803300231	IUNISJKBVNZPRR-LAUBAEHRSA-N	427.581	1.972	50	20	IDGD	
Cc1noc(CC(=O)N2CC[C@H](CNC(=O)CCBr)[C@@H]2c2cccnc2)n1	1806340773	MZFKBDLNKWLCGG-KDOFPFPSSA-N	436.310	1.807	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)c1ccc2c(c1)OCO2	1808981087	DXULSJVLOCAIMO-FCEWJHQRSA-N	431.876	1.730	50	20	IDGD	
CC[C@H](C)[C@@H](N)C(=O)N1CCCC2(CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CC2)C1	1809706890	GWDPDUBRGMLZRL-YTZQZUSESA-N	444.580	1.725	50	20	IDGD	
CN(C)c1cccc(C(=O)N2CCC3(CCCN(C(=O)c4cccc(B(O)O)c4)C3)CC2)c1	1809978078	VBCKQEKNFCFLSO-UHFFFAOYSA-N	449.360	1.591	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)CN(C)C(=O)C(=O)O)[C@H]1c1cccnc1	1812389033	WXGIXRAJOQJDNL-HLLBOEOZSA-N	438.912	1.038	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)c2ncn(C)n2)[C@@H]1c1cccnc1	1812774826	IGNXOUZNIXILTK-QLFBSQMISA-N	435.326	1.703	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)[C@H]2CCNC(=O)C2)[C@H]1c1cccnc1	1813136926	PWWMOXVIWSIUNS-YOKBYHGQSA-N	437.338	1.397	50	20	IDGD	
CN(C)C(=O)NCC(=O)Nc1cc([C@H]2CCCCN2C(=O)CCBr)[nH]n1	1814561002	LBDKYRFABJODNV-GFCCVEGCSA-N	429.319	1.458	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@H]2COc3ccccc3O2)[nH]n1)[C@H](O)CCl	1814867140	GOQFOECDBOVKCL-JJRVBVJISA-N	434.880	1.842	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@H]1C[C@H]1C1CC1)CC2)c1ccc(B(O)O)cc1	1815335826	SVULANUYSJUHKY-PMPSAXMXSA-N	425.319	1.095	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CN2CC(=O)NC2=O)n[nH]1	1815668306	YCGBSWUBPZAQLD-DIFFPNOSSA-N	445.307	1.190	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](C)CBr)CC2	1817010543	JXORKYZHEITJHQ-GUBZILKMSA-N	446.371	1.533	50	20	IDGD	
Cc1ncsc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1	1817470438	BHNRWKBGJPPBAM-MRXNPFEDSA-N	439.306	1.474	50	20	IDGD	
Cc1ncc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cnccc3C(=O)NN)n[nH]2)cn1	1819402161	QWVGYMPWZRODOD-KRWDZBQOSA-N	449.475	1.126	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](O)N2CCOCC2)n[nH]1	1819448346	OAUAVAXGNDTKBU-OWQGQXMQSA-N	448.351	1.289	50	20	IDGD	
CCc1cc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)no1	1822414329	AZUXDXLQSUXSRH-INIZCTEOSA-N	431.497	1.639	50	20	IDGD	
Cc1cc(/C=C/C(=O)N2CCCC[C@@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)no1	1822414865	MFUKZIRZARTASH-PYUISTEWSA-N	443.508	1.785	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCCn1ccnc1)CC2	1826008716	GCRBNELMOXQTTO-OLZOCXBDSA-N	425.942	1.986	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc3n(n2)CCNC3=O)CC1	1826197241	HJFUKECRGZKDJX-DOTOQJQBSA-N	435.956	1.877	50	20	IDGD	
CN[C@H](CC(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H](C)CBr)CC1)C(=O)O	1826938466	AAOFAWVIOFSYEG-NUEKZKHPSA-N	446.386	1.700	50	20	IDGD	
O=C([C@H](O)CCl)N1CCC([C@@H]2CCCCN2C(=O)/C=N/O[C@@H]2CCCCO2)CC1	1828971005	AGEMTEBFWGLUBT-MXWPQOHSSA-N	429.945	1.735	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](C)N2CCN(C)CC2)CC1	1830242890	UHZDNFWJALHNQB-HOJAQTOUSA-N	443.032	1.496	50	20	IDGD	
Cc1ccn2c(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)C(C)(C)CCl)CCO4)cnc2c1	1830365701	FOTVOQQLHZFMMB-JOCHJYFZSA-N	448.951	1.978	50	20	IDGD	
CC(C)(C)[C@H](O)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1	1830631564	YVLAQXPZNBSWQB-JEBQAFNWSA-N	425.353	1.086	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(OCC)nn3)C2)C1	1831654963	PEKPCASWGUFMKN-FOIQADDNSA-N	440.928	1.353	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1)[C@@H]1CCCCO1	1833112973	RJUQKEWKAQKHSD-HOTGVXAUSA-N	434.350	1.818	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)[C@@H]3CCCCO3)CC2)CC1	1833113619	ONVYSQCZGRTETN-PBHICJAKSA-N	430.387	1.911	50	20	IDGD	
Cc1cc(C(=O)N2CCC(N3CCC(NC(=O)CCBr)CC3)CC2)nn1C	1834421207	QOZHEHIFLPBPCA-UHFFFAOYSA-N	440.386	1.699	50	20	IDGD	
Cc1ccccc1C(=O)N1CCOC[C@]2(CN(C(=O)CCBr)CCO2)C1	1834824156	UENWQFDSBBMBJI-IBGZPJMESA-N	425.323	1.850	50	20	IDGD	
COc1cccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)c1	1835026618	VCXIGLDKAIRBRB-JOCHJYFZSA-N	438.952	1.959	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)CN3CCCCC3)CCO2)C1	1835378022	LHCMGRPMSALCEP-RBUKOAKNSA-N	436.380	1.165	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3ccc[nH]3)CCO2)C1	1836010301	IZAGEKQOMBANMJ-HNAYVOBHSA-N	442.354	1.435	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)CN3CCCCC3)CC2)CC1)[C@H](F)Br	1836412598	NKJMKIFPCFLMOS-SFHVURJKSA-N	447.393	1.734	50	20	IDGD	
O=C(COCc1ccccc1)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836716760	ORKISMXJOMBDAQ-FQEVSTJZSA-N	438.952	1.802	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836717276	AAPPWIMLFJFQTM-RHSMWYFYSA-N	429.772	1.821	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc4nc[nH]c4c3)CCO2)C1	1836926663	KPRMLSFJSVBBHK-NRFANRHFSA-N	434.924	1.898	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)CC(=O)OC(C)(C)C)CC2)CC1	1836991190	BWISFNFFMAOMCX-KRWDZBQOSA-N	446.972	1.971	50	20	IDGD	
O=C(c1ccccc1)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1	1837921147	GCZAHGJAACTYPE-UHFFFAOYSA-N	436.317	1.292	50	20	IDGD	
O=C(c1cc(-c2cccnc2)[nH]n1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1838027857	RKEABFCUUJGDLQ-APWZRJJASA-N	437.859	1.076	50	20	IDGD	
CCc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCBr)C3)C2)no1	1838123784	CXVHUFNWNDHDHL-QGZVFWFLSA-N	430.299	1.092	50	20	IDGD	
Cc1cc(C(=O)N2CCC(OC3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)ccn1	1838460792	OKCSFYSPEAMUNK-UHFFFAOYSA-N	445.564	1.375	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)[C@@H]3CCC(=O)N3C)CC2)CC1	1838651217	ZWVIXVJJHFUZOV-BBRMVZONSA-N	444.370	1.389	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)C2)C1	1839147334	NEXRHOJHTPEMCB-QFBILLFUSA-N	443.859	1.821	50	20	IDGD	
Cc1cncc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)c1	1839151011	FKAGBDPZGDDAIA-RTBURBONSA-N	430.332	1.696	50	20	IDGD	
Cc1ncc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)s1	1839152598	FMWQHZQKWFLJMW-DLBZAZTESA-N	436.361	1.758	50	20	IDGD	
O=C(Cc1ccccc1F)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839199079	IJCWLLRQDWVTQO-WMZOPIPTSA-N	447.276	1.515	50	20	IDGD	
O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(O)c(F)c1)CCO2	1839303970	GOWHSULTECVCCN-GOSISDBHSA-N	445.285	1.386	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3ccc(C)cc3)CCO2)C1	1839939391	QWADPFGFHOVOMW-DENIHFKCSA-N	438.952	1.638	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccc(OC)c(F)c3)CCO2)C1	1840526129	ABHFJHLQBKIHQM-IERDGZPVSA-N	442.915	1.851	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1ccnc(Cl)c1)C2	1843415624	SICIGFGFIOXKFL-ZMOGYAJESA-N	428.880	1.686	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2ccc(-n3cccn3)cc2)C1	1845384568	NEIOTGRUNJPUAA-UHFFFAOYSA-N	445.483	1.002	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCCC12CN(C(=O)c1ccc(O)nn1)C2	1845870664	NLNUQGAHJOIRCE-RIYZIHGNSA-N	425.395	1.885	50	20	IDGD	
C[C@@H](C(=O)N1CC2(CCCN2C(=O)[C@H](Br)Cc2ccccc2)C1)n1cnnn1	1845943053	QJXVRLYLBHOQNJ-GOEBONIOSA-N	447.337	1.444	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC12CN(C(=O)c1cncc(S(C)(=O)=O)c1)C2	1846069090	GZDZSMIZZYUJGA-AWEZNQCLSA-N	444.351	1.476	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC12CN(C(=O)[C@H](C)[C@@H]1SC(=N)NC1=O)C2	1846070073	MYIBRVCVEWHIED-VWYCJHECSA-N	431.356	1.166	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2nc3ccccc3o2)CC1)c1n[nH]c(=O)c2ccccc12	14222050	NKMFBDNYWZADKR-UHFFFAOYSA-N	432.440	1.742	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(=O)n(-c3ccccc3)c(=O)[nH]c2c1)c1cccc([N+](=O)[O-])c1	17330330	XOGIUHPNGBYLJB-UHFFFAOYSA-N	445.391	1.662	50	20	IDGD	
Nn1c(SCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)nnc1-c1ccccc1F	20889538	JBHZMGJIOQVWMT-UHFFFAOYSA-N	431.409	1.260	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](CNC(=O)NNC(=O)COc2ccc(C#N)cc2)C1	726264948	BTHLYQUWPGDLCM-INIZCTEOSA-N	431.493	1.915	50	20	IDGD	
CC[C@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)c1sc(N2CCOCC2)nc1C	727115423	KQVBEEKWMVKZML-LBPRGKRZSA-N	427.527	1.352	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)COc1ccccc1[N+](=O)[O-])c1ccc2c(c1)CC(=O)N2C	728401274	POECJNCXOSFJEO-GFCCVEGCSA-N	427.417	1.584	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)CCc1c(C)nc2[nH]n(C)c(=O)c2c1C	729283052	MAVHSPOWNQLPHI-UHFFFAOYSA-N	441.488	1.436	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)Cc2c(C)nc(-c3ncccn3)nc2O)c1C	729283109	OMOUDQHYWBHROV-HNNXBMFYSA-N	436.472	1.722	50	20	IDGD	
CCN(CCNC(=O)NNc1ccc(S(=O)(=O)NC(C)C)cn1)C(=O)OC(C)(C)C	729616969	IIPJHNZGNPLBQW-UHFFFAOYSA-N	444.558	1.651	50	20	IDGD	
Cc1cc(C)c(S(=O)(=O)NCCC(=O)NNC(=O)COc2ccccc2O)c(C)c1	730782145	IICIGEJYTAGAJW-UHFFFAOYSA-N	435.502	1.212	50	20	IDGD	
Cc1ccc([C@H](CNC(=O)NNC(=O)COc2ccccc2O)N2CCOCC2)cc1	730905418	XPTPJMKSVSLIGZ-SFHVURJKSA-N	428.489	1.483	50	20	IDGD	
CC[C@@H](N=c1nn[nH]n1-c1ccccc1)C(=O)NNC(=O)c1cc(-c2ccccc2)on1	731471068	QIRQHCBVTBUYSF-MRXNPFEDSA-N	432.444	1.391	50	20	IDGD	
CCS(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=O)CNC(=O)c2ccco2)c1Cl	731987722	VVTIWSKZEIEBGQ-UHFFFAOYSA-N	448.284	1.571	50	20	IDGD	
COC(=O)c1ccc(S(=O)(=O)NNC(=O)c2ccc(OC)c(Br)c2)s1	732048747	ROYJEWQLSIMURF-UHFFFAOYSA-N	449.304	1.929	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)c2ccn(S(=O)(=O)c3ccc(C)cc3)c2)c1	732263215	ASKBVMOHJOHZNT-UHFFFAOYSA-N	442.497	1.915	50	20	IDGD	
C[C@H]1CC(C)(C)C[C@@]2(C1)NC(=O)N(CC(=O)NNc1ccccc1S(C)(=O)=O)C2=O	732302886	SQQBCMURRHWYHW-RNODOKPDSA-N	436.534	1.670	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)NCCN(C)CC(F)(F)F)c1	732703217	BRGUVHLILKYDGJ-UHFFFAOYSA-N	427.221	1.896	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](NC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])C1	734217219	GAJYDNBISGXUFX-ZDUSSCGKSA-N	437.453	1.704	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)N[C@@H]2CCN(C(C)C)C2=O)c2ccccc2c1=O	734218301	IRABDDOSLGLSQN-MRXNPFEDSA-N	428.493	1.150	50	20	IDGD	
C[C@H]1[C@@H](C)S(=O)(=O)CCN1C(=O)NNC(=O)c1ccc(Br)cc1Cl	736386381	DWMJEICEEWYMMI-DTWKUNHWSA-N	438.731	1.964	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)c2cnn(-c3ccc(F)cc3)n2)c2ccccc2c1=O	737766227	NHLPWBLBMBTRJM-UHFFFAOYSA-N	435.419	1.772	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc2ccccc2c1)NNC(=O)COCc1ccccc1	737923753	XYWIQTGRFBTVFO-UHFFFAOYSA-N	441.509	1.872	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	740852399	YPEDTZRUBALUCT-UHFFFAOYSA-N	435.484	1.511	50	20	IDGD	
CCNC(=O)COc1ccc(C=NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)cc1OC	741769779	AULWJNRUPQXDAO-UHFFFAOYSA-N	448.501	1.769	50	20	IDGD	
CCNS(=O)(=O)c1cccc(C(=O)NNC(=O)c2cccc(Br)c2)c1	742771792	BKCXVNVFZNWMLL-UHFFFAOYSA-N	426.292	1.822	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)[C@@H]2CS[C@H](Cc3ccccc3F)C(=O)N2)cc1	743828831	JHRMJZQZFAENRY-ZWKOTPCHSA-N	445.520	1.887	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)CCOc2ccc(S(C)(=O)=O)cc2)c1	744888903	JGELYSYKZSKEPF-UHFFFAOYSA-N	434.470	1.172	50	20	IDGD	
COc1ccc(O[C@@H](C)CNC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1	745898926	FWVIGSJSKHMTMC-ZDUSSCGKSA-N	425.445	1.354	50	20	IDGD	
Cc1cc(N2CC[C@H](NC(=O)NNC(=O)CC34CC5CC(CC(C5)C3)C4)C2=O)n(C)n1	745907102	YLUFXQSQQUVRMT-ATFGOMPUSA-N	428.537	1.771	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2cccc(C(F)(F)F)c2)cc(S(N)(=O)=O)cc1[N+](=O)[O-]	746229790	TXUYNUXBAVBIKJ-UHFFFAOYSA-N	446.363	1.644	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3O)CC2)cc1C	746453663	JOQKDERDXHGUBO-UHFFFAOYSA-N	430.530	1.544	50	20	IDGD	
COC(=O)c1ccsc1N1CC[C@H](NC(=O)/C(C#N)=C/c2cc(C#N)n(C)c2C)C1=O	746642285	XUVSOEUTNGHCCD-AAKUMTKESA-N	437.481	1.882	50	20	IDGD	
COC[C@@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)c1ccco1	746770348	MTAXMGGFELLOSR-MRXNPFEDSA-N	436.490	1.396	50	20	IDGD	
O=C(Cc1cccc2ccccc12)NNC(=O)NCCNS(=O)(=O)c1cccs1	747438477	WRTWBKGEJCLGFC-UHFFFAOYSA-N	432.527	1.753	50	20	IDGD	
N#Cc1ccc(NNC(=O)CCCNS(=O)(=O)c2ccc3c(c2)OCCCO3)cc1	748126409	NWZATGHOEIXWAX-UHFFFAOYSA-N	430.486	1.921	50	20	IDGD	
O=C(COC(=O)C1(S(=O)(=O)c2ccccc2)CC1)NNC(=O)c1cccc(Cl)c1	748137254	WYQQMDZOZWKDQS-UHFFFAOYSA-N	436.873	1.651	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1	748619617	TYBBWMZKXLCDTF-ZNMIVQPWSA-N	426.489	1.321	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1	748627086	GFQSVHKPKTXVIW-CYBMUJFWSA-N	430.452	1.639	50	20	IDGD	
CCOCCCn1c(NNC(=O)[C@@H]2CS[C@]3(C)CCC(=O)N23)nc2ccccc2c1=O	752048442	UGXFRLBSEODYJZ-HRAATJIYSA-N	445.545	1.720	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)C(C)(C)CN(C)C	754378640	OVSMZTDNNWMZJF-HNNXBMFYSA-N	439.582	1.391	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)[C@@H](NC1CCOCC1)C(C)C	754502509	AMELANMCGPPLAU-SFHVURJKSA-N	441.912	1.446	50	20	IDGD	
O=C(NNC(=O)c1c[nH]c2ccccc12)NC1CCN(S(=O)(=O)C(F)(F)F)CC1	755304735	IJXKEUPKZZTEAJ-UHFFFAOYSA-N	433.412	1.426	50	20	IDGD	
CC[C@H](C)C(=O)NNC(=O)Nc1ccc(S(=O)(=O)N2CCC[C@@H](C(=O)OC)C2)cc1	755559295	SJBBNOFIWPCXCR-UONOGXRCSA-N	440.522	1.459	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)Nc2cccc(CN3C(=O)CNC3=O)c2)o1	755989761	USIZGENTXOPZAY-UHFFFAOYSA-N	442.476	1.640	50	20	IDGD	
Cc1cc(Cl)ccc1OCCCC(=O)NNC(=O)Nc1ccn(CC(=O)N(C)C)n1	756311052	KXUVKMPXRHTGCW-UHFFFAOYSA-N	436.900	1.945	50	20	IDGD	
NC(=O)CCNC(=O)c1cccc(NC(=O)NNC(=O)CCSc2ccc(F)cc2)c1	756391069	JXCVFQBBPYYUFD-UHFFFAOYSA-N	447.492	1.766	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(F)c(NC(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)c1	756687227	XVWGZWPLHGCVPB-UHFFFAOYSA-N	446.464	1.933	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)NNC(=O)COCc2ccccc2)cc(S(C)(=O)=O)c1	757609500	VPMIZGOJTCHWKS-UHFFFAOYSA-N	449.485	1.636	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)Nc2ccc(-n3ncn(C)c3=O)cc2)n[nH]1	757862458	IJUXBGJEXOHAHD-UHFFFAOYSA-N	448.443	1.436	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)[C@@H](Sc1ccc(F)cc1)c1ccccc1	758049237	YRIJIAOGNVMTIY-WBMJQRKESA-N	425.507	1.744	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@@H]1CCCC[C@@H]1NC(=O)NNC(=O)C(=O)Nc1ccccn1	758814265	YZLBAFPBELSYCM-KBPBESRZSA-N	434.497	1.434	50	20	IDGD	
CO[C@](C)(C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)c1ccccc1F	760065916	KHKSTKGROHRTBU-NRFANRHFSA-N	449.504	1.933	50	20	IDGD	
CC(=O)N[C@H](CC(=O)NNC(=O)CCNC(=O)OC(C)(C)C)c1ccc(F)cc1F	760437201	DDAYMWXSXNHUJO-OAHLLOKOSA-N	428.436	1.594	50	20	IDGD	
CCn1c(=O)n(CC)c2nc(NC(=O)CCC(=O)NNC(=O)c3ncccc3C)ccc21	762023193	KUFJQAZRRKHPJP-UHFFFAOYSA-N	439.476	1.121	50	20	IDGD	
CCN1CCC[C@@H]1CN1C[C@H](C(=O)NNC(=O)CSc2ccccc2OC)CC1=O	762361629	PHURTORJYDDFRF-HZPDHXFCSA-N	434.562	1.268	50	20	IDGD	
O=C(NNc1nccc(N2CCOCC2)n1)[C@H]1CC(=O)N(Cc2ccccc2Cl)C1	762851752	FMYBTYOBPCDCAC-HNNXBMFYSA-N	430.896	1.458	50	20	IDGD	
C[C@H]1COCCN1c1ccc(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3n2)cc1	763450569	QDXIDNKTQDRMQJ-HNNXBMFYSA-N	433.468	1.860	50	20	IDGD	
Cc1ccc(NC(=O)C(C)C)cc1NC(=O)C(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	763471810	LMHJLCPCYFLSRM-UHFFFAOYSA-N	427.417	1.897	50	20	IDGD	
COC(=O)c1sccc1NC(=O)C(=O)NNC(=O)c1ccccc1Br	763482513	HHYOKELJWKFUPL-UHFFFAOYSA-N	426.248	1.697	50	20	IDGD	
O=C(NNC(=O)c1ccccc1O)C(=O)Nc1ccc(OCCN2CCCCC2)cc1	763529124	IQKOASOXXNIHPS-UHFFFAOYSA-N	426.473	1.657	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(-c3n[nH]c(C4CC4)n3)cc2)c1	763625873	ZJWQYYVGEIWBDE-UHFFFAOYSA-N	434.456	1.822	50	20	IDGD	
CCNC(=O)N1CCc2ccc(NC(=O)C(=O)NNC(=O)c3c(C)nc4ccccn34)cc21	763627580	BPLXMBFMEVIOBK-UHFFFAOYSA-N	449.471	1.134	50	20	IDGD	
COc1ncnc(N(C)C)c1NC(=O)C(=O)NNC(=O)CSc1ccc(Cl)cc1	763732647	DDHPTBFGFHZVEK-UHFFFAOYSA-N	438.897	1.083	50	20	IDGD	
CN(C)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)CSc2ccc(Cl)cc2)cc1	763732833	DTYPHNMHESIOKB-UHFFFAOYSA-N	434.905	1.920	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(F)cc1OCC1CC1	763814200	RRVQJWVPZKXTKD-UHFFFAOYSA-N	426.404	1.651	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1cccc(N2CCCCC2=O)c1	763864597	DGSZOYAPUXXNRV-CQSZACIVSA-N	442.447	1.896	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccc(O[C@H]2CCOC2)cc1	763868010	ZQPAKNVFXREBDS-ACJLOTCBSA-N	431.420	1.547	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(CN(C)C)c2)cc1OC	763911917	RQJQIQAKWWRXBH-UHFFFAOYSA-N	428.489	1.945	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)C(=O)Nc1cccc(OCC(F)(F)F)c1	763921537	LYXSOEYRXOAROF-UHFFFAOYSA-N	449.349	1.003	50	20	IDGD	
Cc1cc(S(C)(=O)=O)ccc1NC(=O)C(=O)NNC(=O)C1=S=C2CC[C@H](C)CC2=C1	763941265	KELYZQCSIRMALY-NSHDSACASA-N	449.554	1.322	50	20	IDGD	
COC(=O)c1cc(F)ccc1NC(=O)C(=O)NNC(=O)c1cc(Br)cn1C	764004578	HTWXDYGHJPVKCJ-UHFFFAOYSA-N	441.213	1.113	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)Nc1cccc(Cn2cccn2)c1	764005281	XBGFUDFBOCCFGI-UHFFFAOYSA-N	445.277	1.432	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2O1)C(=O)Nc1cnn(Cc2ccc(Cl)cc2)c1	764154718	UCTPRZOQVPTGGJ-SFHVURJKSA-N	439.859	1.674	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cccc(OC(F)F)c2)ccc1N1CCOCC1	764250102	JHJDOTQQPMFLEY-UHFFFAOYSA-N	448.426	1.833	50	20	IDGD	
O=C(NNC(=O)c1cccc(OC(F)F)c1)C(=O)Nc1cccc(CN2CCCC2=O)c1	764251832	ZJDMQUZOVVBGHX-UHFFFAOYSA-N	446.410	1.810	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@@H]2C)ccc1NC(=O)C(=O)NNC(=O)Cc1ccccn1	764263441	FXZFVBRXNNVNBV-INIZCTEOSA-N	437.500	1.733	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)ccc1O)C(=O)Nc1ccc2c(c1)OCCO2	764279680	BUJZMGCGCPLGHR-UHFFFAOYSA-N	436.218	1.326	50	20	IDGD	
COCCOc1ccc(C#N)cc1NC(=O)C(=O)NNC(=O)c1ccc(OC)cc1OC	764287223	XKJJNTQYLZRURY-UHFFFAOYSA-N	442.428	1.000	50	20	IDGD	
CCN(Cc1cccc(NC(=O)C(=O)NNC(=O)c2c[nH]nc2C)c1)C(=O)OC(C)(C)C	764296261	XCAPYRNGZYQFOD-UHFFFAOYSA-N	444.492	1.875	50	20	IDGD	
CO[C@@H](C)C(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)C(C)(C)c2ccccc2)c1	764313077	IMPFTXRPAFNINH-AWEZNQCLSA-N	426.473	1.724	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)C(=O)Nc2ccc(I)cc2Cl)cn1	764359233	NOIKRQSEMOOYQF-UHFFFAOYSA-N	447.620	1.078	50	20	IDGD	
CC(C)(C)NC(=O)c1cccc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)c1	764379331	BUDNPGGGJRFTAE-UHFFFAOYSA-N	448.426	1.973	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1	764401883	YWTHSMPZRLUEQL-MRVPVSSYSA-N	445.316	1.862	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)C(=O)Nc1cccc(N2CCCC2=O)c1	764405361	SDFLMLWASGJQBL-UHFFFAOYSA-N	428.470	1.397	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)[C@H](C)NS(=O)(=O)c2ccc(C#N)cc2)c1	764523448	HKKJRGCUBSYWOC-HNNXBMFYSA-N	430.486	1.068	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NN=C3C[C@@H](C)N(C4CC4)C3)CC2)cc1	764819999	URCJVSKRZZMOHT-QGZVFWFLSA-N	433.578	1.030	50	20	IDGD	
Cc1ccc([N+](=O)[O-])cc1C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765738209	JFJXAVHJPKQQOS-UHFFFAOYSA-N	425.445	1.122	50	20	IDGD	
N#C/C(=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)O[C@H]1CCCNC1=O	767234394	BVHLNFVXSZEUGZ-SHRNQRGKSA-N	441.875	1.808	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)NC1CCN([C@@H]2CCCC[C@@H]2O)CC1	767946902	HQISUCYLOFZSIV-UXHICEINSA-N	426.521	1.584	50	20	IDGD	
O=C(NNc1ncnc2ccsc12)c1cccc(S(=O)(=O)NC[C@@H]2CCCO2)c1	768290291	GJBFVWXIXOEMIW-ZDUSSCGKSA-N	433.515	1.906	50	20	IDGD	
COc1cc(O)c(C=NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1OC	768357005	FSALCKOQZWGGHF-UHFFFAOYSA-N	449.485	1.194	50	20	IDGD	
CCNC(=O)N(C)NC(=O)[C@@]12CCC(=O)N1c1ccccc1C(=O)N2Cc1ccccc1	768412998	NBLYQQIMHQMMGU-HSZRJFAPSA-N	435.484	1.858	50	20	IDGD	
COCCn1nc(C(=O)NNC(=O)c2cc(-c3ccco3)nc3ccccc23)ccc1=O	768793309	WLBNHVRCXLGCMG-UHFFFAOYSA-N	433.424	1.773	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)CN2C(=O)N[C@@]3(CCCC(C)(C)C3)C2=O)c1	768929048	UFMBXFILCFDVTA-OAQYLSRUSA-N	431.493	1.145	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NC2CCC(O)(c3cccnc3)CC2)cc(OC)c1OC	770305072	DDQVXBPUXQSIMI-UHFFFAOYSA-N	444.488	1.882	50	20	IDGD	
COc1ncnc(N(C)C)c1NC(=O)C(=O)NNc1ccc(Br)c(F)c1	770815869	MJNMWZJEPWTYLY-UHFFFAOYSA-N	427.234	1.535	50	20	IDGD	
CN(CCNC(=O)NNC(=O)c1cc2c(s1)CCC2)S(=O)(=O)c1cccs1	772016512	OZIFPPKBCPLFIC-UHFFFAOYSA-N	428.561	1.563	50	20	IDGD	
CC(C)(C)OC(=O)N1CCSC[C@H]1CC(=O)NNC(=O)c1ccc2c(c1)OCCO2	772029258	JZSGNBNVTOZFHK-CQSZACIVSA-N	437.518	1.961	50	20	IDGD	
Cc1ccccc1[C@H](CC(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1)NC(N)=O	772195600	AADVDRPCCNXANJ-INIZCTEOSA-N	431.880	1.212	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)c1cc(S(=O)(=O)N(C)C)ccc1F	772955606	SFKHALPVEBVIRG-LLVKDONJSA-N	443.884	1.958	50	20	IDGD	
O=C(NNc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(S(=O)(=O)N2CCCC2)cc1	773657203	ZOJZRKMDRLJECB-UHFFFAOYSA-N	433.446	1.461	50	20	IDGD	
Cc1ccc(I)cc1NC(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1	775863275	PGSZUFBUJXTOMB-VIFPVBQESA-N	437.259	1.187	50	20	IDGD	
O=C(Cc1cccc2ccccc12)NNC(=O)Nc1ccnn1[C@@H]1CCS(=O)(=O)C1	776058493	CGXZERQXVKEMKG-MRXNPFEDSA-N	427.486	1.791	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)N[C@H]1CCO[C@H](CC(C)C)C1	776885650	OEBRQFVZTSWDQN-LSDHHAIUSA-N	425.555	1.826	50	20	IDGD	
CCOC(=O)N1CCC[C@@H]([C@@H](C)NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)C1	776929912	GXDVKUQJXBPHAU-UKRRQHHQSA-N	440.522	1.291	50	20	IDGD	
O=C1CN(S(=O)(=O)c2ccc(C(=O)NNc3ccc4ccccc4n3)cc2)CCN1	777465874	SMWPMKAQSVTILX-UHFFFAOYSA-N	425.470	1.112	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)NC1CCN(S(=O)(=O)CC(C)C)CC1	777765431	QFCDWEFQAHQPGJ-UHFFFAOYSA-N	440.566	1.408	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)[C@@H](O)[C@@H](O)c2nc3ccccc3s2)cc1OC	779489818	UUERKDMFZIODFR-ZWKOTPCHSA-N	445.497	1.949	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)NCc2cccnc2N2CCC(C(N)=O)CC2)c1	780833285	YSBMIGIZSOAMAC-UHFFFAOYSA-N	426.477	1.396	50	20	IDGD	
COc1cccc(NNC(=O)[C@@H]2CCCCN2S(=O)(=O)c2ccc(C(C)=O)cc2)n1	781024684	FSGDRMCHXHBHPW-KRWDZBQOSA-N	432.502	1.979	50	20	IDGD	
Cc1cc(C(=O)NCC(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)ccc1[N+](=O)[O-]	782755956	CHOMZSCLEYDOFI-UHFFFAOYSA-N	440.391	1.623	50	20	IDGD	
C[C@@H](Oc1ccccc1NC(=O)C(=O)NN[C@]1(C)CCS(=O)(=O)C1)c1ccccc1	783426004	LANKPRXJHMUGLW-QVKFZJNVSA-N	431.514	1.963	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1ccc(N2CCCC2)c(F)c1	784004533	GZDKACAMGMUSDV-UHFFFAOYSA-N	433.465	1.003	50	20	IDGD	
CN1CCN(C(=O)c2ccc(NC(=O)C(=O)NNc3ccc(F)c(F)c3F)cc2)CC1	784820033	IRUFFYLBDVDMNB-UHFFFAOYSA-N	435.406	1.573	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNc2cc(F)c(F)cc2F)cc1C(=O)OC	784886460	LZNGJNYXAVIQFY-UHFFFAOYSA-N	425.319	1.759	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(F)c(NC(=O)C(=O)NNc2cccc(C(F)(F)F)n2)c1	784952547	JUZOMCFJSAARIY-UHFFFAOYSA-N	449.386	1.572	50	20	IDGD	
COc1ccc2nc(NNC(=O)C(=O)Nc3ccc4[nH]nc(C(N)=O)c4c3)c(C)cc2c1	785162358	CAUBCBNOOKGDCE-UHFFFAOYSA-N	433.428	1.609	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cccc(NC(C)=O)c2C)cc1OC	785758261	ARBLTKSCFSHXQN-UHFFFAOYSA-N	429.429	1.589	50	20	IDGD	
Cc1ncsc1C(=O)NNC(=O)C(=O)Nc1ccc(CN(C)C)c(Br)c1	786417160	NGCBPIZMIGZQNJ-UHFFFAOYSA-N	440.323	1.675	50	20	IDGD	
Cc1cn(-c2c(F)cccc2F)nc1C(=O)OCC(=O)NNC(=O)c1cccc(C#N)c1	787830655	JPGWWFXXKIEHSW-UHFFFAOYSA-N	439.378	1.949	50	20	IDGD	
COC(=O)c1sc(S(=O)(=O)NNC(=O)COc2ccccc2O)c(C)c1Cl	788625297	OKGSNFKNEGURCB-UHFFFAOYSA-N	434.879	1.591	50	20	IDGD	
CNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)cc1Cl	789811330	YYNAHPRHSIHHFH-YOEHRIQHSA-N	444.875	1.358	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)ccc1NC(C)=O	789819807	QVWFMCKHXBITKY-LPHOPBHVSA-N	440.456	1.312	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)[C@@H](CCS(C)(=O)=O)c1ccccc1	790024615	SBOFUURSHGWBRY-HNNXBMFYSA-N	440.543	1.760	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)CN2C(=O)N[C@](C)(c3ccc(C)cc3)C2=O)cc1	792946700	HXKMLUSTODSBGD-JOCHJYFZSA-N	439.472	1.030	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)c(F)cc1C	793026857	UJAWGEVDHBJTFA-UHFFFAOYSA-N	445.403	1.482	50	20	IDGD	
Cc1ccn(-c2ccc(NC(=O)C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)cc2)n1	793027280	ZLMBXTDJKTVETI-UHFFFAOYSA-N	444.492	1.572	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2ccc(C)nc2)c1	795275467	DIRRQQIJJWOQIL-UHFFFAOYSA-N	426.520	1.044	50	20	IDGD	
CCOC(=O)c1cc(S(=O)(=O)NNC(=O)NC(C)C)c(F)cc1Br	795307293	ZSHIXKWPGCEEAX-UHFFFAOYSA-N	426.264	1.666	50	20	IDGD	
CC(C)Oc1ccc(NC(=O)C(=O)NNC(=O)CCCc2ccccc2)cc1C(N)=O	797005602	SNFJMFPMMMLECM-UHFFFAOYSA-N	426.473	1.682	50	20	IDGD	
CC(=NNC(=O)c1sc(N)nc1C)c1ccc(Br)c(S(N)(=O)=O)c1	797402079	TWSDQBXOZHNXSV-UHFFFAOYSA-N	432.325	1.598	50	20	IDGD	
CC(=O)N[C@@](C)(C(=O)NNC(=O)CCc1ccccc1)c1ccc(S(C)(=O)=O)cc1	797442477	FGGWISWDUFAQCA-OAQYLSRUSA-N	431.514	1.222	50	20	IDGD	
Cc1oc(C)c(S(N)(=O)=O)c1C(=O)NNC(=O)Nc1ccc(Br)cc1	801994270	CZLJSSUWMQOFEJ-UHFFFAOYSA-N	431.268	1.773	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)[C@H]2CC[C@H](C(F)(F)F)NC2=O)cc1Cl	802074591	RYOUSZDZEWBIQZ-JVXZTZIISA-N	438.790	1.967	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)CCc2cccc(N(C)C)c2)CC1	802544249	WGFKTHXSIWIISN-UHFFFAOYSA-N	446.577	1.160	50	20	IDGD	
O=C(Cc1csc(NC(=O)c2cccc(O)c2)n1)NNc1ccc(-n2ccnc2)nn1	804953165	FAOSGWLOPLTXDD-UHFFFAOYSA-N	436.457	1.763	50	20	IDGD	
COC[C@]1(C(=O)NNC(=O)CNc2ccc(OC)cc2)CCN(C(=O)OC(C)(C)C)C1	810007795	QPOGOQGJPRCEQD-NRFANRHFSA-N	436.509	1.528	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc(S(=O)(=O)NC3CC3)ccc2C)cc1C	811904803	NHUJFQQARDNHII-UHFFFAOYSA-N	444.513	1.452	50	20	IDGD	
CSCC[C@H](NC(=O)c1ccco1)C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	812727154	OSZUIXSGMMKYOR-HNNXBMFYSA-N	440.547	1.525	50	20	IDGD	
COCc1cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)cc(C(=O)OC)c1	815566624	ZLMMUAPMQHPEAO-GFCCVEGCSA-N	447.419	1.312	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)cc1)[C@@H]1C[C@H]1C	815568279	BMEGRDCITGFHQF-YHBQJITHSA-N	436.468	1.538	50	20	IDGD	
CN(Cc1ccccc1NC(=O)C(=O)NNC(=O)[C@H]1CCc2nncn2C1)c1ccccc1	815691194	IAZYVHFUCXFKEJ-KRWDZBQOSA-N	447.499	1.263	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCc2nncn2C1)C(=O)Nc1ccccc1C#Cc1ccccc1	815691785	BIYSKMJHRHQRKV-GOSISDBHSA-N	428.452	1.026	50	20	IDGD	
CC(C)(C)c1nc2ccc(NC(=O)C(=O)NNC(=O)[C@@H]3CCc4nncn4C3)cc2s1	815693211	PCPOTSCXOIELSZ-LLVKDONJSA-N	441.517	1.534	50	20	IDGD	
O=C(NCc1ccc(COCC(F)(F)F)cc1)NNC(=O)c1ccc(-n2cnnn2)cc1	838693333	ITNUVGARNDPIAR-UHFFFAOYSA-N	449.393	1.885	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)CCS(=O)(=O)c1ccc2c(c1)CCC2	915273827	CFWHWVLRPVKVDD-UHFFFAOYSA-N	446.525	1.964	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2cccc(C(N)=O)c2)c1	915906467	NHZUIXLOJYTOCA-UHFFFAOYSA-N	433.490	1.283	50	20	IDGD	
CC[C@H](CNC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)N1CCc2ccccc2C1	916447628	BBNQKDRZPODVDC-GOSISDBHSA-N	448.527	1.714	50	20	IDGD	
CCCNC(=O)c1cccc(CNC(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)c1	916478629	NBUACIBXPORQLH-UHFFFAOYSA-N	444.488	1.996	50	20	IDGD	
O=C(CSc1nncs1)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	916726374	MFQSWALDFFLKIY-UHFFFAOYSA-N	441.560	1.266	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)c2ccc3c(c2)S(=O)(=O)N(C2CC2)C3=O)c1	916741323	WDYGQGZOQDOWKK-UHFFFAOYSA-N	428.470	1.134	50	20	IDGD	
COc1ccc([N+](=O)[O-])cc1CNC(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	918018105	ONLNXVNGYBKWET-UHFFFAOYSA-N	426.389	1.639	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)NCC(=O)N2CCN(C(=O)OC(C)(C)C)CC2)cc1	918137689	ACYZIXBRYCHDIN-UHFFFAOYSA-N	433.509	1.272	50	20	IDGD	
COc1ccc(CNC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])c(OC)c1OC	918227125	SYEWLODKRXTUPO-UHFFFAOYSA-N	434.405	1.530	50	20	IDGD	
CCCCS(=O)(=O)N1CCC[C@H]1C(=O)NNC(=O)c1ccc(OCC)c(OC)c1	918690305	WQGORIVZWNHAQU-HNNXBMFYSA-N	427.523	1.449	50	20	IDGD	
CCOc1ccccc1C(=O)N1CCC[C@H]1C(=O)NNC(=O)c1cccc(OC)c1O	919756153	XVVLMZMEVUCFCJ-INIZCTEOSA-N	427.457	1.865	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NC[C@@H]2CCN(CCC)C2)c2ccccc2c1=O	919797763	VJQBJGABHLWEDR-INIZCTEOSA-N	428.537	1.873	50	20	IDGD	
CC(=O)N1CCCc2cc(S(=O)(=O)NNC(=O)c3nnc(-c4ccccc4)o3)ccc21	919961436	HLPSNMPEJBQSNY-UHFFFAOYSA-N	441.469	1.659	50	20	IDGD	
C[C@H](OCC1CC1)C(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	920806144	ZEDMOGIJCQNPEZ-HNNXBMFYSA-N	431.514	1.741	50	20	IDGD	
C[C@@H]1CC(C)(C)C[C@@]2(C1)NC(=O)N(CC(=O)NNC(=O)NCCc1cccs1)C2=O	920861367	YALSHDTULJZSQN-ZUOKHONESA-N	435.550	1.758	50	20	IDGD	
Cc1cc(C)c(C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)[nH]1	1116270973	WNYHRZLSILHVMF-UHFFFAOYSA-N	434.518	1.046	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@@H](C)C(=O)NNC(=O)Cn1nc2n(c1=O)CCCCC2	1318364248	PVFDSWAZZAMVFE-AWEZNQCLSA-N	435.912	1.656	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)CNC(=O)c1cccs1)CN(C)C(=O)OC(C)(C)C	1321741852	BISVXZDRINBFMK-LBPRGKRZSA-N	427.527	1.311	50	20	IDGD	
COCc1cc(C(=O)OC)cc(S(=O)(=O)NNC(=O)c2cncn2-c2ccccc2)c1	1324804030	WBAXSRALOSETRQ-UHFFFAOYSA-N	444.469	1.429	50	20	IDGD	
CC(=O)Nc1ccc(CC(=O)N2CC[C@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)cc1	1778255971	CJIIEIWRIBUYOQ-JOCHJYFZSA-N	447.608	1.869	50	20	IDGD	
O=C(c1cnc2[nH]ncc2c1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1778416552	OBGBQSRFWLCYKZ-MLGOLLRUSA-N	426.246	1.092	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cccn4ccnc34)C2)C1	1778588457	UOICTKLTTCAQTB-KXBFYZLASA-N	435.322	1.951	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1C	1779032128	ACGXTIXESUHNHQ-QHCPKHFHSA-N	437.500	1.059	50	20	IDGD	
C[C@H](C(=O)N1CCO[C@@]2(CCN(C(=O)CO[Si](C)(C)C)C2)C1)N1CSCSC1	1779296838	HNIMHFWLJSOUTL-CRAIPNDOSA-N	447.699	1.711	50	20	IDGD	
CC1(C)CC(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cnccc3C(=O)NN)C2)C1	1779376053	VFQBXTJJNFQHHG-WZONZLPQSA-N	443.548	1.249	50	20	IDGD	
CC(C)(C)n1cc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)nn1	1780354215	FELHCDWECHCRIO-MSOLQXFVSA-N	432.352	1.713	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)c3nn[nH]c3C(F)(F)F)C2)C1	1780364324	KOUUWPGIZNTFOV-KBPBESRZSA-N	444.241	1.503	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(CO)on1)C2	1780715113	MWSSQKKBWRSMDP-FHLIZLRMSA-N	434.320	1.531	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H]3CC[C@@H]4CCC(=O)N4C3)C2)C1	1781054829	XOWOXPSCYDTFQG-DLRJPAPCSA-N	425.957	1.625	50	20	IDGD	
COc1cc(OC)cc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](F)Br)C3)C2)c1	1781332912	CKIKRBAUQLUNOF-MAUKXSAKSA-N	445.285	1.838	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2)c1cnc2ccc(F)cn12	1781381788	XGFFHIYBMBVUPL-JXXFODFXSA-N	438.887	1.201	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnc(OC)c(C)c1)C2	1782171091	NVWXZFWXXSPIKO-CSODHUTKSA-N	439.940	1.780	50	20	IDGD	
O=C(C1CCN(c2ccc(F)cn2)CC1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Cl)CCO2	1782797926	SEOGUCAUKUCSDO-YLJYHZDGSA-N	442.894	1.801	50	20	IDGD	
CCOC(=O)C(C)(C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](Cl)COC)C2	1783228997	UACMHDPQTRUSGG-BXTJHSDWSA-N	432.945	1.343	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)CC(F)(F)C(=O)O)CCO2)C1	1783348000	RLRQSQYDWABXGQ-IINYFYTJSA-N	427.242	1.100	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cc(Cl)cnc3O)CCO2)C1	1783528419	NRUPLHCTLRJVON-MGPLVRAMSA-N	432.702	1.668	50	20	IDGD	
COc1cc(OC)cc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](C)Br)C3)C2)c1	1783538811	XPPHEYSQNFFKBU-ORAYPTAESA-N	441.322	1.931	50	20	IDGD	
Cc1cccc(CCC(=O)N2CCO[C@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)c1	1783933653	UBWXDGYVEOXLCL-QHCPKHFHSA-N	430.549	1.131	50	20	IDGD	
CCC[C@H](C(=O)N1CCO[C@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1)n1cccc1	1783934319	DJPDSTRPFVFYAN-GCJKJVERSA-N	433.553	1.032	50	20	IDGD	
CC#C[C@H](CC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](Cl)COC)CCO2)c1ccc(O)cc1	1784019192	CCPHBQRMBSJCPM-XQFWAAQXSA-N	448.947	1.973	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)COC(=O)C(F)(F)F)C[C@@H]21	1784618027	QZUWIFKRMNFGFM-RVMXOQNASA-N	428.835	1.479	50	20	IDGD	
COc1cccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Br)C[C@@H]32)n1	1785811722	NIOVUKFQBISWCA-TZQJONAQSA-N	430.274	1.374	50	20	IDGD	
CCCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C[C@@H]21	1786442735	XNCXYBFBVBLOBA-FNHZYXHNSA-N	433.461	1.914	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4nc(CO)[nH]c4c3)[C@H]2C1	1787873554	SJSRLJFBWSMRFX-AFIMGQEJSA-N	434.924	1.666	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1	1788142480	ZFTSXGYJCKFGHR-UHFFFAOYSA-N	440.381	1.966	50	20	IDGD	
CC(C)=NO[C@H](C)C(=O)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1	1788144252	AEOSTTYQULLVCG-MRXNPFEDSA-N	437.305	1.915	50	20	IDGD	
COc1ccc(CCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](O)CCl)C[C@@H]32)c(F)c1	1788204381	FPFVEYIZLNAEQY-CBVHJVASSA-N	442.915	1.346	50	20	IDGD	
Cc1cnn(CC(=O)Nc2ccc(C3(NC(=O)c4cccc(B(O)O)c4)CCC3)cc2)c1	1788286109	GUWGNLHFBFWQNH-UHFFFAOYSA-N	432.289	1.319	50	20	IDGD	
Cn1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Cl)C[C@@H]32)c(C(F)(F)F)n1	1788896438	DJRHHCTVGUHLGU-PZEZNAACSA-N	426.798	1.567	50	20	IDGD	
Cn1ncc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]3C2)c1Cl	1789870812	XNOWMDRNPQKZJN-PYERRIOISA-N	437.755	1.903	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CCCN(C)C3)C[C@@H]21	1790962794	BCHJPLBWIWWQMY-HMDCTGQHSA-N	430.387	1.481	50	20	IDGD	
Cc1cccc(/C=C/C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Br)C3)n1	1792472815	PGLMWFYLAFWHLT-YBWDHYDSSA-N	426.286	1.683	50	20	IDGD	
CSc1ncccc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCBr	1795115936	WQZIFAVKSZSPRK-JJLQDPRZSA-N	428.352	1.792	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCc1ccc2c(c1)OCO2	1795321422	ZIVBODKCDCNYAD-FAQVEIGNSA-N	448.592	1.789	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cn1cc(Cl)cn1	1795761277	FYQAYAPYJFSCCN-WJNVRWDZSA-N	433.734	1.300	50	20	IDGD	
CCn1nc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](Cl)COC)C3)c2ccccc21	1796023549	SNJJJFGDIWNROV-CXHZTBPHSA-N	434.924	1.513	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(N2CCOCC2)n1	1797092388	WZQQHJYPYGJYDW-YVSFHVDLSA-N	436.940	1.424	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CSCc1[nH]cnc1C	1797662566	JDXVAQKFQGPBOE-BASYENTBSA-N	428.986	1.948	50	20	IDGD	
Cc1ccc(=O)n(C(C)(C)C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)C(C)(C)CCl)C3)n1	1797910902	FSBHEKUDYZFBOI-SCAQPMJSSA-N	438.956	1.141	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc3[nH]ccc3n1)C2	1798440459	LQPOJMDCJDNXJS-BTTYYORXSA-N	433.472	1.127	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c(c1)CNC3=O)C2	1799277249	UNRRTVMRYDVWAQ-IDLUEMFASA-N	440.327	1.370	50	20	IDGD	
Cc1nccn1CCCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Br	1799352428	WKNCRACRJPHBSL-XRGAULLZSA-N	431.306	1.252	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(OC)c(OC)cc1C	1799706281	IOJSAKNMGRBXOK-MVWRLGRASA-N	440.924	1.469	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2)c1ccc2c(c1)C(=O)CC2	1799959259	UWYBQQYRISUUAG-CCWDJLKJSA-N	435.318	1.804	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(=O)c3ccccc3o1)C2	1800754241	KUQJAHJUWDOZDN-JWXAPSBJSA-N	449.301	1.780	50	20	IDGD	
Cc1nccn1CCCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)CBr)C2	1801309645	JJVZLKBLYJFDGV-SCNOPHJPSA-N	441.370	1.592	50	20	IDGD	
CC(=O)NCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](Br)Cc1ccccc1	1801570659	QRKGWOAQAJYWAW-XMTFNYHQSA-N	436.350	1.767	50	20	IDGD	
CC(C)(CCl)C(=O)NC[C@H]1CCN(C(=O)c2cnc(O)nc2O)[C@H]1c1cccnc1	1802899514	QLKKWPSUXCIYDZ-HIFRSBDPSA-N	433.896	1.867	50	20	IDGD	
COc1ccc(CCC(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)cn1	1803136402	QALMOVVEFBSLPL-OPYAIIAOSA-N	446.935	1.724	50	20	IDGD	
CC(=O)Nc1cc(C(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]2c2cccnc2)ccn1	1803139365	ONEJGDFHGWJILE-ZHALLVOQSA-N	445.907	1.354	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2n[nH]c(C3CC3)c2F)[C@H]1c1cccnc1)[C@H](O)CCl	1803141270	MLLFOKHGQKJYCI-IYOUNJFTSA-N	435.887	1.741	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cccn3ccnc23)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803142545	FBGQQRQPYXXZLP-RYQLBKOJSA-N	427.892	1.649	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)C#Cc2ccccc2)[C@@H]1c1cccnc1	1806621513	ADBACZSLBQBLCO-OFVILXPXSA-N	447.539	1.512	50	20	IDGD	
Cc1ccn(C)c1C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1807373445	BCFQIMVGEJBHSA-DENIHFKCSA-N	446.316	1.042	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)[C@H]2CC=CCC2)[C@@H]1c1cccnc1	1808137186	ZBZSHTYDUZRINX-CDXJDZJCSA-N	448.527	1.756	50	20	IDGD	
O=C1NCCCn2nc(C(=O)N3CC[C@H](CNC(=O)[C@@H](F)Cl)[C@H]3c3cccnc3)cc21	1808314557	YPVNPPTWIDJICC-KBRIMQKVSA-N	448.886	1.266	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)[C@@H](N)Cc2cccnc2)[C@H]1c1cccnc1	1808362586	GXIYUBOCCODDLO-FUMNGEBKSA-N	445.951	1.306	50	20	IDGD	
Cn1cc(C(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@H]2c2cccnc2)c(C(F)F)n1	1808840978	CJYCIQTYOYAANO-BJJXKVORSA-N	441.866	1.672	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)C(F)(F)C(F)F)CC2)C1	1809975221	YCIQBQMXIBJZHG-UHFFFAOYSA-N	430.207	1.112	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2ccc3nn[nH]c3c2)[C@@H]1c1cccnc1	1812302070	QJZHQRHFSZCMKS-BXWFABGCSA-N	442.907	1.926	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1	1812864731	RGRGUNWALGRWCU-PLQHRBFRSA-N	449.305	1.991	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)C(C)(C)NCCC#N)[C@H]1c1cccnc1	1813031851	SWDZJUFPXXYYCG-SQNIBIBYSA-N	435.956	1.623	50	20	IDGD	
C=CCOCCCC(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1813069542	ZRDPRNLDIMOVLB-XXBNENTESA-N	445.564	1.443	50	20	IDGD	
COCCOCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](C)CBr)CC2	1814299770	IWVABRSCUWXZGR-MNOVXSKESA-N	434.356	1.749	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)CN3CCNC3=N)sc2C1	1814927975	QDFXBFCWHYNPJS-UWVGGRQHSA-N	443.371	1.069	50	20	IDGD	
CN[C@H](CC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](C)CBr)CC2)C(=O)O	1815073854	YCOFHKACXONGCG-WCABBAIRSA-N	447.355	1.149	50	20	IDGD	
Cc1ccc(C(=O)N[C@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)cc1C	1815343629	FOCSYYWVWHTCAX-SFHVURJKSA-N	449.341	1.979	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)Cc2ccccn2)n[nH]1	1817639686	URRVCEDZNJDLET-SFHVURJKSA-N	448.487	1.352	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)COC(=O)C(F)(F)F)n[nH]1	1819315882	BZJNIMJNIJVZPF-GXSJLCMTSA-N	440.806	1.761	50	20	IDGD	
C[Si](C)(C)OCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1819593686	QFHVBFLCFXFIEI-KRWDZBQOSA-N	444.373	1.247	50	20	IDGD	
CC[C@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)Cn2cc(C)c(O)nc2=O)[nH]n1	1820861301	WWSCAQFBXUQVCZ-GXTWGEPZSA-N	436.900	1.690	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](C)N2CCN(C)CC2)[nH]n1	1822374638	YLGZGVCMSNDDGA-VYDXJSESSA-N	440.976	1.292	50	20	IDGD	
Cc1ncncc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1	1822414980	PVQFEMAIRLNGJK-INIZCTEOSA-N	428.497	1.187	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1	1822417007	VONNHZRVNAMKLJ-GXTWGEPZSA-N	428.921	1.029	50	20	IDGD	
C[C@H](C(=O)N1CCCC[C@H]1c1cc(NC(=O)C(Cl)Cl)n[nH]1)N1CCN(C)CC1	1822420948	GPUTWFPZHQAKSK-OCCSQVGLSA-N	431.368	1.841	50	20	IDGD	
CN1CCN(C2(C(=O)Nc3nc4c(s3)C[C@H](NC(=O)[C@@H](F)Cl)CC4)CC2)CC1	1822716059	VPWHJIXZFUNSAB-BXUZGUMPSA-N	429.949	1.370	50	20	IDGD	
O=C(CCN1CCOCC1)N[C@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1	1823002795	GJFOZCMPDUMOBG-HZMBPMFUSA-N	449.346	1.468	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ncn(C)n1)CC2	1825445260	QUBICBANUOFYQS-BDAKNGLRSA-N	427.328	1.671	50	20	IDGD	
CCC(=O)N[C@H](C)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](C)Br)sc2C1	1825636233	RXTXPZXECBZWSZ-IVZWLZJFSA-N	431.356	1.753	50	20	IDGD	
CNC(=S)NCCC(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](C)Br)sc2C1	1825640601	DEBOPWNLXAPUQB-BDAKNGLRSA-N	448.412	1.323	50	20	IDGD	
CCc1ccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)cn1	1825748755	DXPXMRVHRORYLR-QHCPKHFHSA-N	449.360	1.871	50	20	IDGD	
Cc1ncoc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1	1826064164	YSVHBNSVJSLREN-LJQANCHMSA-N	425.294	1.210	50	20	IDGD	
COCCC(=O)N1CCCC[C@H]1C1CCN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)CC1	1826611064	LFFBNFZJADLPNT-JWGRYVKWSA-N	431.537	1.777	50	20	IDGD	
Cc1ccc(CC(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)cn1	1827056565	YMDSHICPXCWHOE-QHCPKHFHSA-N	449.360	1.546	50	20	IDGD	
O=C([C@@H]1CCC=CO1)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827057590	KPQDSNSCYHCAHS-SFTDATJTSA-N	426.322	1.292	50	20	IDGD	
CNC(=S)NCCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H](C)Br)CC1	1828931597	SFYLWGAGCZMXGA-DZGCQCFKSA-N	447.443	1.874	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1830543767	CLDZDVWEMXHRKL-YGRLFVJLSA-N	432.142	1.278	50	20	IDGD	
CC(C)[C@H](C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2)c1ccccc1	1830719356	CCEBJYLCKCCYMV-IPJJNNNSSA-N	438.952	1.482	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(OCC)nn3)C2)C1	1831654969	PEKPCASWGUFMKN-YWZLYKJASA-N	440.928	1.353	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CN2C(=O)C=CC2=O)CC1	1831656016	DDNNDWVJBRBQHC-HIFRSBDPSA-N	440.338	1.315	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)s1	1833422484	VJQRWWUUUTWPCA-LJQANCHMSA-N	442.610	1.678	50	20	IDGD	
Cc1[nH]nc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@](C)(Cl)CCl)C3)C2)c1F	1833675425	SWSYSYBZQYHLTF-SJORKVTESA-N	437.299	1.164	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)C3=NN(C)C(=O)CC3)CC2)CC1	1833688462	PBDMZWYMPOZGEZ-KRWDZBQOSA-N	439.988	1.574	50	20	IDGD	
Cc1nscc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)Br)C2)C1	1833748704	IMDOMBDOYWUEIS-BDJLRTHQSA-N	432.340	1.305	50	20	IDGD	
Cc1cccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)n1	1834051588	VDSWUHZJPLJGFE-RHSMWYFYSA-N	430.274	1.151	50	20	IDGD	
Cc1ncsc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)Br)C2)C1	1834269455	ZNFBXIWTNWVRHS-MEDUHNTESA-N	432.340	1.305	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](OC)c1ccccc1)CCO2	1834928134	NUWWGHNNQDZAOA-OPYAIIAOSA-N	440.924	1.084	50	20	IDGD	
C=C[C@@H](O)C(C)(C)C(=O)NC1CCN(C2CCN(C(=O)[C@H](Cl)COC)CC2)CC1	1835718181	WCDYCKXUJABDMX-QZTJIDSGSA-N	429.989	1.385	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)N3CCOCC3)CC2)CC1	1836922867	QNCKUPYOHUNCBT-WIYYLYMNSA-N	445.988	1.043	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)/C=N/N3CCCCC3)CCO2)C1	1837445319	PNELIUCGLKYBDU-DNYNIURUSA-N	449.379	1.151	50	20	IDGD	
Cc1nnc(CC(=O)N2CCC(OC3CCN(C(=O)CCBr)CC3)CC2)o1	1837653659	NHRURJIPQBAAPB-UHFFFAOYSA-N	443.342	1.704	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(OC2CCN(C(=O)C(F)F)CC2)CC1	1837677515	JGOIEYUIGKLTAW-ZMOGYAJESA-N	439.463	1.384	50	20	IDGD	
O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(Cl)cn1)CCO2	1837894537	OSTOZQFUZQTWKW-KRWDZBQOSA-N	446.729	1.590	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccn(-c4ccccc4)n3)CCO2)C1	1838746686	JFVUKIILWYWRHE-AVRDEDQJSA-N	446.935	1.960	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](C)n3cccn3)CC2)CC1	1838786812	QWRCDRZKFYSZQT-CRAIPNDOSA-N	426.945	1.697	50	20	IDGD	
COc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)nc1	1839153023	RUYYRBPCHNFNLY-OALUTQOASA-N	446.331	1.397	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2	1839155381	RXHQLKZWPUPSLY-NILFDRSVSA-N	446.169	1.463	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(OC)cc3F)CCO2)C1	1839292131	SWIWYDHNDQMKKE-UZLBHIALSA-N	428.888	1.922	50	20	IDGD	
Cc1cc(O)c([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1839466710	PQDXWKJCNWBTCF-MAUKXSAKSA-N	445.831	1.213	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CC3(OC)CCC3)C2)C1	1839967585	QXHWKOKFJZIDCF-HNAYVOBHSA-N	447.370	1.576	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(F)c[nH]3)CCO2)C1	1840068344	ZBRFXWOLMHAZMH-DYVFJYSZSA-N	432.290	1.397	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C=C/c3ccc(C)s3)C2)C1	1840156731	YIMNMSPHILBJGJ-YWFTZVROSA-N	442.965	1.780	50	20	IDGD	
O=C(c1nccc2[nH]ccc12)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840187792	WYPNHSFDQJRQJE-SFHVURJKSA-N	427.288	1.437	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)[C@H](C)Nc2nccs2)C1	1843394918	CEUUXOBGPCFQJR-NYATXJBFSA-N	443.533	1.281	50	20	IDGD	
C[C@H](NC(=O)c1ccc(F)cc1)C(=O)N1CCCC12CN(C(=O)[C@H](F)Br)C2	1845004051	NHEHQCQKBVYNCL-FZMZJTMJSA-N	444.276	1.838	50	20	IDGD	
COc1cc(F)c(C(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)c(F)c1	1845380357	WMULMIGRAGDEHA-UHFFFAOYSA-N	445.426	1.103	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)c2ccc(C(=O)OC)cc2[N+](=O)[O-])C1	1845537007	ZLBJQULMXUAYFF-AWEZNQCLSA-N	439.852	1.452	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC2(CCCN2C(=O)c2cnc3c(c2)CCNCC3)C1	1845797859	DVPFPWHQZKQDQV-MRXNPFEDSA-N	435.366	1.760	50	20	IDGD	
CCN(CC)[C@H](C(=O)N1CCCC12CN(C(=O)c1cccc(B(O)O)c1)C2)c1ccccc1	1845838827	TWNPOOYKQYIODD-QFIPXVFZSA-N	449.360	1.267	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C2=NN(c3ccc(F)cc3)[C@H](C(N)=O)C2)o1	109422246	UYOXBTRETHKDIA-KRWDZBQOSA-N	444.467	1.142	50	20	IDGD	
CS(=O)(=O)Cc1c(C(=O)NNC(=O)c2ccc3c(c2)OCCO3)oc2ccccc12	110327265	JOTLLDNGWKRAIK-UHFFFAOYSA-N	430.438	1.823	50	20	IDGD	
Cc1cc(S(=O)(=O)NNC(=O)c2c(C)nc3ccccn23)ccc1OCCCC(=O)O	726155258	GPMUQTSLOFZQJK-UHFFFAOYSA-N	446.485	1.818	50	20	IDGD	
O=C(NNC(=O)c1cccc(F)c1F)c1cccc(S(=O)(=O)N2CCOCC2)c1	726495164	IKXTUJHEKRIGPB-UHFFFAOYSA-N	425.413	1.061	50	20	IDGD	
O=C(NNC(=O)c1c(Cl)cccc1Cl)c1ccc(S(=O)(=O)N2CCOCC2)o1	727792445	TWYUIPDJXGQDOR-UHFFFAOYSA-N	448.284	1.682	50	20	IDGD	
O=C(NNC(=S)Nc1ccc2c(c1)OCCCO2)C1CCN(c2ncccn2)CC1	728798717	YTZUUVUQTYZWNA-UHFFFAOYSA-N	428.518	1.872	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)[C@@H]3CCN(C)C3)c2)cc1	729282409	WCXRKHYMXSXKGF-OAHLLOKOSA-N	432.502	1.209	50	20	IDGD	
COc1ccc2c(C)c(CCC(=O)NNC(=O)CCN3C[C@H](C)O[C@@H](C)C3)c(=O)oc2c1	732259538	GRZKBUBYRJXKGI-GJZGRUSLSA-N	445.516	1.689	50	20	IDGD	
CCC[C@@H](NC(=O)Cc1ccccc1)C(=O)NNC(=O)c1csc(N2CCOCC2)n1	732653942	QDLPYRVHAHNWRT-MRXNPFEDSA-N	445.545	1.268	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCC[C@@H](c3nncn3C(C)C)C2)cc1OC	735872436	DIQICNOBCCVHHC-MRXNPFEDSA-N	430.509	1.517	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)CC2(N3CCOCC3)CCCC2)c2ccccc2c1=O	735875961	LFGFCGUAWFHIFV-UHFFFAOYSA-N	441.532	1.603	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)ccc1Cl	736065732	PDNCHCJXNNVVRO-UHFFFAOYSA-N	433.229	1.624	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N1CCS(=O)(=O)[C@H](C)[C@@H]1C	736372210	DTAXGZSASRPYCW-SDDRHHMPSA-N	448.339	1.465	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NNC(=O)COCc2ccccc2)s1	737636987	JEGXQDNODNEDHW-INIZCTEOSA-N	437.543	1.574	50	20	IDGD	
O=C(C[C@H](C(=O)NN=C/C=C\c1ccco1)N1CCOCC1)NN=C/C=C\c1ccco1	741767190	RPYGMPFOANMKKB-ZPZGLJRDSA-N	439.472	1.894	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)NCCNC(=O)c2ccco2)cc1Cl	743529515	IUQMEZRJBCBBDO-UHFFFAOYSA-N	425.829	1.716	50	20	IDGD	
CN1CCN(c2cc(CNC(=O)NNC(=O)Nc3ccc(N(C)C)cc3)ccn2)CC1	743536169	FIJLRFUSOGZICN-UHFFFAOYSA-N	426.525	1.435	50	20	IDGD	
CN(C)CCOc1ccccc1CNC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	743571958	SMFAUGAJLGEDMW-UHFFFAOYSA-N	449.533	1.566	50	20	IDGD	
CCCCc1ccc(NC(=S)NNC(=O)CN2C(=O)[C@@H]3[C@H]4CC[C@@H](O4)[C@@H]3C2=O)cc1	743821305	LWRNHHNWSAPAEM-AHCXZYCDSA-N	430.530	1.509	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2ccc(N)c(Br)c2)n1	745463187	KPCJKEISNAQVMO-UHFFFAOYSA-N	427.280	1.343	50	20	IDGD	
O=C(COc1ccc(OCc2ccccc2)cc1)NNC(=O)NCc1nnnn1C1CC1	745911569	YPMJGFJCMFMGER-UHFFFAOYSA-N	437.460	1.496	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)N[C@@H]2CCCN(CC(F)(F)F)C2=O)cc1OC	746340477	ZRDGIPRWRVGIHP-CYBMUJFWSA-N	446.426	1.981	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(CNC(=O)NNC(=O)Cc2ccncc2)s1	747490877	NHCBTJRQUZDYAH-UHFFFAOYSA-N	425.536	1.247	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NN=C1CCO[C@H]1C)N(S(C)(=O)=O)CC2	747743034	ZKNFNGZTMBJTAV-BLLLJJGKSA-N	425.507	1.234	50	20	IDGD	
CC(=O)N1CCC(NC(=O)NNC(=O)[C@H]2Cc3ccccc3CN2Cc2ccccc2)CC1	747866293	PILDTJIWKMMTME-HSZRJFAPSA-N	449.555	1.955	50	20	IDGD	
O=C(NCCC(=O)N1CCN(c2ccccn2)CC1)NNC(=O)c1c[nH]c2ccccc12	748467945	WPPLOQVTHANTHM-UHFFFAOYSA-N	435.488	1.246	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)NCC2CCOCC2)cc1	749230906	UWVWZJNNOJQXJK-PDGQHHTCSA-N	437.500	1.884	50	20	IDGD	
CCC[C@H](O)CC(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccc(OC)cc2)c1	750057513	KHVBKYHQNXJPAJ-INIZCTEOSA-N	435.502	1.808	50	20	IDGD	
CCOC(=O)[C@H](NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1ccccc1	750141372	BEASPMGNDVMQBB-LJQANCHMSA-N	447.513	1.246	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NC[C@H](C)CNC(=O)OC(C)(C)C)c2ccccc2c1=O	750440177	KCYSKORULUXSJP-ZDUSSCGKSA-N	446.508	1.521	50	20	IDGD	
CC[C@@H](NC(=O)NNC(=O)c1ccc(-n2c(C)ccc2C)cc1)C(=O)N1CCOCC1	753057187	LUFILZZXGNSDNR-LJQANCHMSA-N	427.505	1.676	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)NC[C@@H]2CCN(S(C)(=O)=O)C2)c(C)n1C[C@@H]1CCCO1	753130436	YVCKRQHWKOLYRF-AKYASHOOSA-N	434.562	1.589	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H]2COc3cc(F)cc(F)c32)c1	753420463	RCNDUHBOABWYHX-AWEZNQCLSA-N	440.428	1.293	50	20	IDGD	
CCOc1ccc(NC(=O)NNC(=O)CC(C)(C)C)cc1S(=O)(=O)N1CCOCC1	755548167	CKBRUNSXGWRWKT-UHFFFAOYSA-N	442.538	1.695	50	20	IDGD	
COC(=O)CCNC(=O)c1ccc(NC(=O)NNC(=O)c2cccc3ncccc23)cc1	755605030	XEMJEOFXKWXTMM-UHFFFAOYSA-N	435.440	1.994	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)Nc1cccc(C(=O)N2CCOCC2)c1	755935180	ZPRILCKQDQBEAS-AWEZNQCLSA-N	430.436	1.918	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)Nc2cccc(S(=O)(=O)N3CCN(C)CC3)c2)cc1	756212156	JIPSFDXQERRDBJ-UHFFFAOYSA-N	445.545	1.652	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(F)c(NC(=O)NNC(=O)COc2ccccc2C#N)c1	756685678	RYNKOIFHSRVKDF-UHFFFAOYSA-N	435.437	1.179	50	20	IDGD	
CC(C)CN1CC[C@H](CNC(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)C1	757291296	SOGBUKXAIDFWMK-MRXNPFEDSA-N	428.537	1.899	50	20	IDGD	
COc1cc(I)c(Cl)cc1C(=O)NNc1ccc(C(N)=O)nn1	757393149	SWSPIKGFHQYOGJ-UHFFFAOYSA-N	447.620	1.599	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNS(=O)(=O)c1ccc(Br)o1	758944916	KNPYWYCMDZCKOC-UHFFFAOYSA-N	426.289	1.657	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H](CCC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)C1	759020456	NNFMGOWBILLZCX-MRXNPFEDSA-N	446.552	1.878	50	20	IDGD	
CCOc1ccc(C(=O)NNS(=O)(=O)c2ccc([N+](=O)[O-])c(OC)c2)cc1OC	759163345	CBPNDDPRDKZKIU-UHFFFAOYSA-N	425.419	1.634	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H]2CCC[C@@H]3OCC[C@@H]32)c1	761789338	GJBLNFVETMHOEC-KURKYZTESA-N	438.550	1.619	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1csc(N2CCOCC2)n1)c1noc(-c2ccccc2)n1	761800496	RUHHYNWYPLEUPS-LBPRGKRZSA-N	443.489	1.735	50	20	IDGD	
CCOc1cc(C(=O)NNc2nccc(N3CCOCC3)n2)ccc1OCC(=O)OC	762861816	QCCUROVSJGEIFD-UHFFFAOYSA-N	431.449	1.021	50	20	IDGD	
COc1ccc(I)c(NC(=O)C(=O)NNC(=O)c2ccccc2)c1	763419310	BVASJKIJKBKELS-UHFFFAOYSA-N	439.209	1.700	50	20	IDGD	
CCCNC(=O)NNS(=O)(=O)c1c(Br)cc2nc(O)oc2c1Cl	763421897	POGSDIADWBBMMI-UHFFFAOYSA-N	427.664	1.852	50	20	IDGD	
COc1ccc(NC(=O)c2cccc(NC(=O)C(=O)NNC(=O)c3ccccc3)c2)cn1	763424487	BJDOMIXZQCJHDE-UHFFFAOYSA-N	433.424	1.742	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(-c3nnc4n3CCCC4)cc2)c1	763631571	YXRREYCYTWLQBE-UHFFFAOYSA-N	448.483	1.755	50	20	IDGD	
CCC(=O)Nc1ccc(Cl)c(NC(=O)C(=O)NNC(=O)COc2ccccc2OC)c1	763657418	LWIUBLDKXVLFBL-UHFFFAOYSA-N	448.863	1.862	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cc(C(=O)NC3CC3)ccc2C)cc1C	763666487	GFMKTGURODQPPZ-UHFFFAOYSA-N	438.484	1.669	50	20	IDGD	
CCN(CC)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)cc1	763674664	OZLGYHHCLWMFAU-UHFFFAOYSA-N	437.456	1.205	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(-n3cncn3)c(Cl)c2)cc1C	763681223	UGHWOLJCKVCSIQ-UHFFFAOYSA-N	442.863	1.702	50	20	IDGD	
CN(C)c1nnc(-c2ccc(NC(=O)C(=O)NNC(=O)c3cccc(Cl)c3)cc2)o1	763747573	BAIXDSQYVYIDJP-UHFFFAOYSA-N	428.836	1.856	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)cnn1-c1ccccc1F	763838323	SMGZGFHEPIHIKN-UHFFFAOYSA-N	429.383	1.624	50	20	IDGD	
CCNC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)c1	763849765	MVFUSWGUEZQFTO-OAHLLOKOSA-N	441.488	1.998	50	20	IDGD	
O=C(CCSc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccn(-c2ccncc2)n1	763900662	AXHUERLFFRKCSK-UHFFFAOYSA-N	428.449	1.675	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(C)nc2O)ccc1OCCC(C)C	763914877	SSFZXZOBUQWPBQ-UHFFFAOYSA-N	430.461	1.929	50	20	IDGD	
C[C@H]1CC(C)(C)C[C@]2(C1)NC(=O)N(CC(=O)NNC(=O)CSc1ccccc1O)C2=O	764049323	YEVIJJAKJPHEND-ZSEKCTLFSA-N	448.545	1.769	50	20	IDGD	
CCNC(=O)COc1cccc(NC(=O)C(=O)NNC(=O)Cc2ccc3ccccc3c2)c1	764092247	PNPQKOCTSSZVMB-UHFFFAOYSA-N	448.479	1.683	50	20	IDGD	
CC[C@@H](C)NS(=O)(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2ccc(C)cc2O)c1	764104522	AAXYFCBTWYCSGX-CYBMUJFWSA-N	448.501	1.177	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ncn(Cc4ccccc4)n3)n[nH]2)cc1	764110299	HQTVKYFMWVBVGI-UHFFFAOYSA-N	444.455	1.425	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc(C(=O)N(C)C)c(C)c3)n[nH]2)cc1	764111705	PIWBGUJQKZFXBL-UHFFFAOYSA-N	448.483	1.795	50	20	IDGD	
COC(=O)c1c(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)sc(C)c1C	764127037	QWOCIYDXZDZVEB-UHFFFAOYSA-N	425.850	1.910	50	20	IDGD	
CC(C)n1nnnc1-c1ccc(NC(=O)C(=O)NNC(=O)CCc2ccccc2)cc1F	764193022	VILQYMHICMEZKJ-UHFFFAOYSA-N	439.451	1.779	50	20	IDGD	
CC(C)n1ncc2cc(NC(=O)C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)cnc21	764202944	GDDOJJHQTUXUML-UHFFFAOYSA-N	447.496	1.403	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)C(=O)Nc1ncn(C2CCCCC2)n1	764204150	JTMSATIMKVZQTM-UHFFFAOYSA-N	437.501	1.174	50	20	IDGD	
O=C(NNC(=O)C(F)(F)Oc1ccccc1)C(=O)Nc1ccc(N2CCCC2=O)cc1	764380329	WCFCOBOPQNKLBE-UHFFFAOYSA-N	432.383	1.571	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)CSc1nnc(-c2ccco2)n1Cc1ccco1	765441059	HYQHTWPDYWQGJT-UHFFFAOYSA-N	427.446	1.764	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)Cn3ncc4ccccc4c3=O)n[nH]2)cc1OC	765595689	CGQNSMLKEBKAGD-UHFFFAOYSA-N	448.439	1.265	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN(C(=O)c2ccncc2)C1)c1cc(-c2ccc(F)cc2)[nH]n1	765621549	VAHGGWUZKIPHRB-INIZCTEOSA-N	436.447	1.924	50	20	IDGD	
Cc1noc(C(F)(F)F)c1C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	766640318	CUGDYZHFEJVUDE-UHFFFAOYSA-N	439.394	1.221	50	20	IDGD	
COCc1c(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cnn1-c1ccccc1	767086413	JKYOCECQSXKOAE-UHFFFAOYSA-N	435.488	1.486	50	20	IDGD	
CS(=O)(=O)CC[C@H](NC(=O)c1ccc(Cl)cc1)C(=O)NN=c1cc[nH]cc1Cl	768448738	QJXYLPMNOMCXCM-HNNXBMFYSA-N	445.328	1.487	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(F)(F)c1ccc(OCC(=O)N(C)C)cc1	769542109	WYKAEJPEVKLCEZ-UHFFFAOYSA-N	445.426	1.663	50	20	IDGD	
CC(C)(C)C(=O)Nc1nccnc1C(=O)NNc1nc(O)c2cnn(C(C)(C)C)c2n1	770968240	UBDCJZDMZOWQID-UHFFFAOYSA-N	427.469	1.818	50	20	IDGD	
CSCC[C@@H](NC(=O)c1cccc(C)c1)C(=O)NNc1nc(O)c2cnn(C)c2n1	770973422	MSQDNLOGPQHRRJ-CQSZACIVSA-N	429.506	1.372	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)CSc3nnc(-c4cccs4)n3C3CC3)nc21	770974241	KIRAGKCKAMUXIU-UHFFFAOYSA-N	443.518	1.959	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)c1ccc(N)cc1I	772187627	VVEJGRJJGRAEMO-VIFPVBQESA-N	433.246	1.612	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)Cc2ccnc(O)c2Br)n[nH]1	772493488	VEQRAWHPBBXBKX-UHFFFAOYSA-N	446.261	1.952	50	20	IDGD	
CC(=O)CCc1ccc(OCC(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)cc1	772898905	VWTJWGUMLVRKNP-UHFFFAOYSA-N	431.876	1.704	50	20	IDGD	
CC[C@@H](C)Oc1cc(C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)ccn1	777273989	GLQRWIJHGDEOSV-OAHLLOKOSA-N	434.518	1.649	50	20	IDGD	
C[C@H]1CCN(C(=O)OC(C)(C)C)[C@@H](C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)C1	778298902	DBJQFNPCOPKJTI-XJKSGUPXSA-N	429.481	1.459	50	20	IDGD	
COC(=O)CNC(=O)NN=Cc1ccc(OS(=O)(=O)c2cc(C)ccc2C)c(OC)c1	779823860	UXZSSCZCMFJBEN-UHFFFAOYSA-N	449.485	1.886	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)N[C@@H]1CCc2nnc(-c3ccc(F)cc3)n2C1	780907468	VNQOFMHQPQJTOK-OAHLLOKOSA-N	439.407	1.951	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(O)cc2)cc1OCC1CCOCC1	782837480	LSRYPXZNQQNBHZ-UHFFFAOYSA-N	427.457	1.906	50	20	IDGD	
CC[C@H](C)NS(=O)(=O)c1cccc(NC(=O)C(=O)NNc2cncc(Cl)n2)c1	783260046	UQFHVJSXCVVQFM-JTQLQIEISA-N	426.886	1.289	50	20	IDGD	
CN(NC(=O)[C@H]1CCCN1c1ncccn1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	783704249	MSXMWUVUFUAKAI-OAHLLOKOSA-N	433.513	1.081	50	20	IDGD	
COc1ccc(S(=O)(=O)C(F)(F)F)cc1NC(=O)C(=O)NNc1cc(C)ncn1	783944133	FWUCSPRLEGWQDO-UHFFFAOYSA-N	433.368	1.169	50	20	IDGD	
Cc1c(NNC(=O)C(=O)Nc2ccc(C(=O)N3CCOCC3)cc2)cccc1[N+](=O)[O-]	784353170	XYVLCFKAGKKPES-UHFFFAOYSA-N	427.417	1.457	50	20	IDGD	
O=C(NNc1cccnc1Cl)C(=O)Nc1ccc(F)c(N2CCCS2(=O)=O)c1	784843765	RRZYLNRJLUDDJR-UHFFFAOYSA-N	427.845	1.496	50	20	IDGD	
O=C(NNc1cccnn1)C(=O)Nc1ccc(CCn2nnc(-c3ccccc3)n2)cc1	784858269	HEJUSFAXANZBTI-UHFFFAOYSA-N	429.444	1.455	50	20	IDGD	
COC(=O)CCc1cccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)c1	786414698	QFOGABPMCPSSKZ-CYBMUJFWSA-N	431.420	1.485	50	20	IDGD	
Cc1nn([C@H]2CCS(=O)(=O)C2)c(C)c1/C=C(\C#N)C(=O)NCc1ccc([N+](=O)[O-])cc1	787148147	RTIIAGDGRUBABT-WBNHJWIASA-N	443.485	1.991	50	20	IDGD	
CN(NS(=O)(=O)Cc1ccccc1F)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	788915410	KQHJJFKJWAPRIX-UHFFFAOYSA-N	430.502	1.765	50	20	IDGD	
COc1nc(Br)ccc1NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	789388798	REHAUSQFGZIPCK-UHFFFAOYSA-N	433.226	1.295	50	20	IDGD	
CO[C@H]1CCOc2c(NC(=O)C(=O)NNC(=O)[C@H]3OCC[C@H]3c3ccccc3)cccc21	790965288	LJAIFKUSYZXKQS-QSFXBCCZSA-N	439.468	1.815	50	20	IDGD	
CCS(=O)(=O)c1ccc(CNC(=O)NNC(=O)COc2ccc(OC)cc2)s1	792221603	BQYDITUYXGPWIF-UHFFFAOYSA-N	427.504	1.460	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NN=C1CCCc2c1cnn2-c1ncccn1	792926381	FRIRVKAYAYTIFO-UHFFFAOYSA-N	438.517	1.734	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)on1)C(=O)Nc1ccc2c(c1F)CCNC2=O	793025212	IWSLGNONKMUGLI-UHFFFAOYSA-N	437.387	1.166	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNS(=O)(=O)c1cccc(OC(F)(F)F)c1F	793415406	KDVXXGKJFOXWCN-UHFFFAOYSA-N	431.364	1.559	50	20	IDGD	
C[C@]1(C(=O)NNC(=O)COc2ccccc2O)CCN(C(=O)OCc2ccccc2)C1	793458846	KQEIKJBCNKDBTD-QFIPXVFZSA-N	427.457	1.967	50	20	IDGD	
O=S(=O)(CBr)N1CCN(S(=O)(=O)c2csc3ccccc23)CC1	795926436	QQPFXRQJOSQTAA-UHFFFAOYSA-N	439.378	1.890	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)C(=O)Nc2cccc3c2CCO3)c2ccccc2c1=O	796990227	PENZFHYKCIWRPT-UHFFFAOYSA-N	435.440	1.312	50	20	IDGD	
CN(C(=O)[C@H]1CCN(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)C1)c1ccccc1	797606468	BVODXNGGFGGGKX-INIZCTEOSA-N	434.460	1.002	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)Cc1ccc([S@@](C)=O)cc1	797924639	YRLQZNMEXGLMBL-GDLZYMKVSA-N	438.889	1.633	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)[C@H](C)NS(=O)(=O)c2c(C)nn(C)c2C)c2ccccc2n1	799007789	HPHIVHJACXGBOX-ZDUSSCGKSA-N	444.517	1.022	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)NCc2cccc(CS(N)(=O)=O)c2)c1	800716785	AFIHKJZEUISHET-UHFFFAOYSA-N	448.545	1.816	50	20	IDGD	
O=C(COC(=O)c1nn(-c2ccc(F)cc2)cc1O)NNC(=O)c1ccc(Cl)cc1	801325960	KTUAVIXTBYQAFK-UHFFFAOYSA-N	432.795	1.988	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2c(OC)cnc3ccccc23)cc1OC	801901746	ONVFNLCORVPNRY-UHFFFAOYSA-N	439.424	1.879	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2ccccc2CN2CCOCC2)cc1	802067860	ORVBBCQLYREDKP-UHFFFAOYSA-N	432.502	1.389	50	20	IDGD	
O=C(NNc1ccc2c(=O)[nH]ccc2c1)[C@H]1CS[C@@H](Cc2ccccc2F)C(=O)N1	803428135	SGCCXYJHCUVTRR-MSOLQXFVSA-N	426.473	1.953	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN([C@@H]2CCN(C(=O)NNC(=O)c3ccc(C#N)cc3)C2)CC1	805026189	GIFMARJQKZDWKU-GOSISDBHSA-N	442.520	1.540	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)COc2ccc(Br)cc2C(C)=O)c1	807116476	LWKUQYKLRDORJP-UHFFFAOYSA-N	449.261	1.845	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)NCC2(S(C)(=O)=O)CCCC2)c2ccccc2c1=O	807537625	NQZFUWBCMXJGKJ-UHFFFAOYSA-N	449.533	1.279	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC([C@@H]2C[C@H]2C(=O)NNC(=O)CNC(=O)c2ccco2)CC1	810308134	RBUWTWWUWRJEJF-LSDHHAIUSA-N	434.493	1.440	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)CNS(=O)(=O)c1cccc(Br)c1	810565360	PRTBNIQTOVNAGX-UHFFFAOYSA-N	440.319	1.426	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)NC[C@]1(COC)OCCc2ccccc21	812478385	TYNRMHPESQOMNS-HSZRJFAPSA-N	443.500	1.909	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NN=Cc2ccc(F)c(S(N)(=O)=O)c2)C1	814974636	XPZQOMHUGQCOAC-ZDUSSCGKSA-N	428.486	1.570	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1nc(CC(F)(F)F)cs1	815565074	BPAWRDDDKHELJX-UHFFFAOYSA-N	432.380	1.421	50	20	IDGD	
COCCn1nc(C(=O)NNc2cc(C(=O)OC)ccc2Br)ccc1=O	816717282	VOGGWSGNMJTXOF-UHFFFAOYSA-N	425.239	1.196	50	20	IDGD	
Cc1nn(C)c2[nH]c(=O)c(CCC(=O)NNc3ccccc3S(=O)(=O)N(C)C)c(C)c12	817052937	XBKUXBKJVYSGRM-UHFFFAOYSA-N	446.533	1.205	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1	817053360	OAUBZRBNCWENST-UHFFFAOYSA-N	430.446	1.788	50	20	IDGD	
CNS(=O)(=O)NC1CCN(C(=O)/C(C#N)=C/c2cc(C)n(C[C@H]3CCCO3)c2C)CC1	819579691	GYWHHEYNUCKNKD-VOMPUTFMSA-N	449.577	1.236	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2cccc(C(=O)NNC(=O)CNc3ccccc3)c2)C[C@@H](C)O1	823327780	FPSLKNDPCDKJTE-IYBDPMFKSA-N	446.529	1.358	50	20	IDGD	
CCN1CCC[C@H]1CNC(=S)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	884157299	XGXFQWTUUWFUFI-INIZCTEOSA-N	439.607	1.064	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)NC2CCN(S(C)(=O)=O)CC2)c(C)n1C[C@@H]1CCCO1	913086884	DGJHHTVSLFTOOG-YWFITGJYSA-N	434.562	1.731	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2ccc(Cl)cc2Cl)cc1	913215959	FQKLRPFPCGQVDG-UHFFFAOYSA-N	444.296	1.936	50	20	IDGD	
COc1ccc(-c2nn(CCC#N)cc2/C=C(\C#N)C(=O)N2CCNC(=O)C2)cc1OC	914749282	LRBMHRGQYOOHAR-MHWRWJLKSA-N	434.456	1.346	50	20	IDGD	
COc1ccc(-c2noc(CCC(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)n2)cc1	915077174	HHFOWKNAIBICIX-UHFFFAOYSA-N	444.469	1.543	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)c1ccc(N2CCOC2=O)cc1	915274781	GPHFAAQSHAHEGQ-UHFFFAOYSA-N	437.500	1.617	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)N[C@H](C)c1cccc(S(N)(=O)=O)c1	916197380	RUWKTGIDOKRTBN-SNVBAGLBSA-N	426.882	1.701	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)NCc2nnc3ccc(C(F)(F)F)cn23)c1	916222394	BTIDEIWRFDUKTI-UHFFFAOYSA-N	438.366	1.910	50	20	IDGD	
CC(=NNC(=O)c1ccncc1)c1ccc(S(=O)(=O)N2CCC(C(=O)O)CC2)cc1	916243203	NHVOTMVZHQFVBS-UHFFFAOYSA-N	430.486	1.721	50	20	IDGD	
Cc1cc(C)nc(SCC(=O)NN=Cc2c(C)nn([C@@H]3CCS(=O)(=O)C3)c2C)n1	917025498	YGGCBNSUKOEUJY-OAHLLOKOSA-N	436.563	1.509	50	20	IDGD	
CCOC(=O)c1c(S(=O)(=O)NNC(=O)c2ccc(OCCC(C)C)cc2)n[nH]c1C	917720742	LESNYSJYLVYYHJ-UHFFFAOYSA-N	438.506	1.943	50	20	IDGD	
CCn1c(NNC(=O)[C@@H](Cc2ccc(F)cc2)n2nnnc2C)nc2ccccc2c1=O	918016103	DTIPLEHTSDFBKY-GOSISDBHSA-N	436.451	1.778	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)NCc2ccc(C(=O)NNC(=O)C(C)(C)C)cc2)cc1	918585015	QWKFOTSAJLGMKT-UHFFFAOYSA-N	446.529	1.931	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)c(C)n1CCC(C)C	919889207	KDOZBIAZSOCIMD-WAFWZSCLSA-N	435.550	1.576	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)Nc1cccc(CN2CCC[C@H]2C(N)=O)c1	920933375	NOXIWTRYKLLSFE-KSSFIOAISA-N	443.479	1.896	50	20	IDGD	
CCCNC(=O)NNC(=O)c1cc(C2CC2)nc2c1c(C)nn2[C@H]1CCS(=O)(=O)C1	921042176	DCGHPTYIULDLGF-ZDUSSCGKSA-N	434.522	1.331	50	20	IDGD	
O=C(NCc1nc(Cc2ccccc2)no1)NNC(=O)c1csc(N2CCOCC2)n1	921124046	DOHFUKNCOHWCJI-UHFFFAOYSA-N	443.489	1.098	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)[C@@H]2CS[C@@]3(C)CCC(=O)N23)CC1	1116088801	ZQRURQQCSUDYAN-DJJJIMSYSA-N	426.539	1.235	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cc(Br)cc(S(N)(=O)=O)c2C)cc1	1318951716	FSIGMJDWAJXDRD-UHFFFAOYSA-N	442.291	1.488	50	20	IDGD	
COc1ccccc1[C@]1(C)NC(=O)N(CC(=O)NNC(=O)c2ccccc2Cl)C1=O	1319390574	CIWZHUUEBCTRGS-FQEVSTJZSA-N	430.848	1.577	50	20	IDGD	
O=C(NNC(=O)c1cncn1-c1ccccc1)c1nc2ncc(Br)cn2n1	1319844674	XXMYORBNJLLQGZ-UHFFFAOYSA-N	427.222	1.147	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1csc(N2CCOCC2)n1)c1ccc([S@@](C)=O)cc1	1323013855	ARTSHUOXWHHYAA-WUTCKBNWSA-N	437.547	1.422	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@H]2CC(=O)N(Cc3ccccc3)C2)c1	1335908024	WMFYEEWOKQWXQV-MRXNPFEDSA-N	444.513	1.083	50	20	IDGD	
O=C(CC(F)(F)C(=O)O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Br)C2	1778013276	OINTVMAMUNBSNC-GLXFQSAKSA-N	445.232	1.301	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cccc4c3cnn4C)C2)C1	1778031225	AZRMMICAQGSDKH-DJJJIMSYSA-N	435.322	1.800	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)CBr)C2	1778099829	PKNYEYVGALCJLC-XWESNNAXSA-N	446.386	1.398	50	20	IDGD	
C[C@@H]1CCC[C@@H]1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnccc1C(=O)NN)C2	1778896260	CRNSMHPBOWKCOA-QIEVIBBNSA-N	443.548	1.249	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H]3[C@@H]4Sc5ccccc5[C@H]43)C2)C1	1779049032	MPZHKZBUNIWQFN-GQXXFKRGSA-N	436.961	1.958	50	20	IDGD	
O=C(C#CC1(O)CCCCC1)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1779066983	KEIGKWLRNMSDII-MAUKXSAKSA-N	431.302	1.205	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2)c1cccc2cnccc12	1779078542	QPBQCLAHQZCSNX-WOIUINJBSA-N	431.920	1.962	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)C/N=C/c3ccco3)C2)C1	1779137740	DOPSQCMAVCIFCM-HOTAGGJMSA-N	426.311	1.702	50	20	IDGD	
CSc1ncccc1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1779838712	FAYBTLQEYMREOK-WBMJQRKESA-N	432.315	1.938	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc3ncccc3[nH]2)C1	1781211914	AVHKNBDARABXNQ-CFCCAZDESA-N	434.924	1.944	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)c3nc4ccccn4n3)CCO2)C1	1781227450	MBZZRTXKTMXFFG-MSOLQXFVSA-N	426.304	1.409	50	20	IDGD	
CN(C)c1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)nc1	1781328374	PFASUPCMTVEDHL-RHSMWYFYSA-N	429.290	1.282	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(OC)c(OC)cc3C)C2)C1	1781895021	WLIMFYODNSWEAZ-IERDGZPVSA-N	440.924	1.710	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1nc3ccccc3[nH]1)C2	1782172755	NBPMVQNBMBTDSG-SOIKWTOOSA-N	434.924	1.944	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cn4ncccc4n3)CCO2)C1	1783347998	RHWARAHLDJHPRD-UGSOOPFHSA-N	436.310	1.346	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](C)Oc1cccnc1)CCO2	1783353993	LAAZJBDDSZLTOE-QOKNQOGYSA-N	440.338	1.852	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc4c(c3)CNC4=O)CCO2)C1	1783533850	KVDROMYGEQNANN-BLVKFPJESA-N	436.306	1.157	50	20	IDGD	
C[C@H](CNC(=O)OC(C)(C)C)C(=O)N1CCO[C@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783940120	QZFBXHIXSNFCNC-XIKOKIGWSA-N	438.352	1.781	50	20	IDGD	
CCOC(=O)N1CCC(C(=O)N2CCO[C@@]3(CCN(C(=O)C(Cl)Cl)C3)C2)CC1	1783951874	LCJNOBINTWYDQX-GOSISDBHSA-N	436.336	1.489	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnn4ccccc34)C[C@@H]21	1783965782	RKKNKIUZQLQFAH-DNUAJFIVSA-N	449.349	1.959	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3coc(Cl)n3)C[C@@H]21	1783970445	ZSVOICDFBLATEG-ZPFDUUQYSA-N	434.718	1.952	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc(O)cn3)C[C@@H]21	1783974273	KILXMRRDJUPTFU-OQUILHJVSA-N	440.338	1.340	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3c(F)ccc(F)c3F)C[C@@H]21)[C@H](O)CCl	1784086623	YVJLZWZNCMDJAW-SPGJAERMSA-N	434.842	1.226	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4c(n3)NC(=O)CC4)C[C@@H]21	1784618652	OUGXMEMULUWJIK-OVWQWFNUSA-N	448.951	1.967	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nc4ccc(F)cn4n3)C[C@@H]21	1784622032	DMZOGEHIYHCBHK-TUUVXOQKSA-N	437.903	1.869	50	20	IDGD	
CC(C)n1cnc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)CBr)C[C@@H]32)n1	1787665824	APGGAFPJPJBGOU-AJNGGQMLSA-N	442.358	1.483	50	20	IDGD	
CN(C)c1ncc(C(=O)NC2(c3ccc(NC(=O)c4cccc(B(O)O)c4)cc3)CCC2)o1	1788145903	CXEVJOLYERBPPT-UHFFFAOYSA-N	448.288	1.482	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cn(C)c4ncccc34)[C@H]2C1	1788465042	VMABYGWABUNLSK-IKICRFKJSA-N	434.924	1.420	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc4ncsc4[nH]3)[C@H]2C1	1788787208	NDILZSGUJPEXKI-OHTBPHCPSA-N	426.926	1.472	50	20	IDGD	
COCc1c[nH]c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)Br)C[C@@H]32)c1	1789213592	WGVOWYTVDUFRSJ-DSRCVFDASA-N	428.327	1.538	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CCC[C@@H](C(=O)OC)C3)C[C@@H]21	1791257386	CPYNVTLPAINZSM-COZGXFGHSA-N	444.956	1.199	50	20	IDGD	
Cc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)CBr)c(O)n1	1792872693	WSFVOEHIGOCUSL-DNVSUFBTSA-N	426.311	1.330	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1cn2nc(C)sc2n1	1793905575	ZOCJHTKKHNGLLL-FAAHXZRKSA-N	425.942	1.534	50	20	IDGD	
O=C(CCc1ccc(F)nc1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2	1794021279	ZOAVBQBUHQAFLS-NOXHYTERSA-N	432.265	1.433	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnccc1C(F)(F)F)c1cccc(B(O)O)c1	1795076990	ZCLUBRPVTYGUMC-MUJYYYPQSA-N	447.222	1.346	50	20	IDGD	
COc1cc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCBr)ccn1	1795111461	PMWFBTYIYKSZPG-CCWDJLKJSA-N	440.338	1.397	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(=O)c3ccccc3o1)C2	1795113323	XXVLYBNNJISYPF-DBWKPXFBSA-N	449.301	1.781	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2)c1ccc2nc(CO)[nH]c2c1	1796872071	NORXBVMWRDHYNR-QHBPRCKVSA-N	427.288	1.062	50	20	IDGD	
COc1ncccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C(C)=N/NC(=O)c1ccc[nH]1	1796889942	PGUFSHFIGRBGTO-MVRRYPJTSA-N	438.488	1.476	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CS[C@H]1CCCCO1	1797794133	XJHGEXSHZKJOTR-QXGSTGNESA-N	430.643	1.687	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc2nncn2c1	1798123809	TVIBABUNIDRYAP-FWKYCFCSSA-N	448.487	1.115	50	20	IDGD	
COc1cc(C#N)cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)c1	1799284517	HXWIHJFTBSLQKW-BJWYYQGGSA-N	448.483	1.131	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C[C@@H](O)CNC(=O)OC(C)(C)C	1800182834	UUGAGHBKQXGDGU-JKJDWNRSSA-N	447.960	1.154	50	20	IDGD	
COc1ccccc1OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)Br	1800754135	GIGVULXHXRXSON-FLTUCWPJSA-N	441.322	1.447	50	20	IDGD	
COc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)Br)cc1F	1800754535	QYNVJNRYVIMFBZ-VFFTVRQLSA-N	429.286	1.821	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(=O)c1ccc(C)cc1	1800884996	KOCMAGKLKPQQQK-YYIAUSFCSA-N	437.334	1.941	50	20	IDGD	
CC#C[C@@H](CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)c1ccc(O)cc1	1801051821	UXJCJZMYSZTCDB-DNMVWIPKSA-N	434.920	1.079	50	20	IDGD	
C[C@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C(C#N)=C/c1ccc(F)cc1F)n1cnnn1	1801439012	RTSCLUGTTUBKPM-TYVRSOFJSA-N	441.442	1.758	50	20	IDGD	
COCCOCCOCCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](C)CBr)C2	1802082047	GKCJWOYUMHXGEX-WCXIOVBPSA-N	449.386	1.725	50	20	IDGD	
COC[C@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C=C/C(=O)NCc1ccccc1)C2	1802269049	DELJZOCCKCBNCM-KTPFRNPESA-N	433.936	1.751	50	20	IDGD	
CC[C@H](NC(C)=O)C(=O)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@@H]1c1cccnc1	1802549470	NOGGUPSJMVHILA-JONQDZQNSA-N	443.317	1.693	50	20	IDGD	
COc1cccc(Cl)c1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc(B(O)O)c1)C2	1803748056	UAFVFRDZOJJQSD-BJWYYQGGSA-N	442.708	1.594	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H](CNC(=O)Cc2cncnc2)[C@@H]1c1cccnc1	1804649267	QJIOGLHIRFXRDV-NQIIRXRSSA-N	427.581	1.972	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC2(CCCN(C(=O)c3cnc(C)[nH]3)C2)CC1	1806277805	KILGZRUFMAHTDR-CVKSISIWSA-N	439.520	1.697	50	20	IDGD	
O=C(NCC(=O)N1CC[C@H](CNC(=O)[C@@H](F)Cl)[C@H]1c1cccnc1)c1cccnc1	1808308332	JCQVUIHVAJRLFD-ZTFGCOKTSA-N	433.871	1.447	50	20	IDGD	
O=C(c1cncc(F)c1)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1	1809967727	IVAZTLBJKNDPGD-UHFFFAOYSA-N	425.269	1.059	50	20	IDGD	
Cc1ncc(CC(=O)N2CCC3(CCCN(C(=O)c4cccc(B(O)O)c4)C3)CC2)s1	1809980611	XUYINQFLBXAEJU-UHFFFAOYSA-N	441.362	1.219	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)Cn2ccncc2=O)[C@H]1c1cccnc1	1812344929	GADDPGSMHPBREF-JCKWVBRZSA-N	448.321	1.128	50	20	IDGD	
CCC(C)(C)C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1	1812611544	VDDLGFDAJKKGTG-VQIMIIECSA-N	438.532	1.836	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)CCC(N)=O)[C@@H]1c1cccnc1	1812634735	ZFWBCCYXLXMRBC-ZQIUZPCESA-N	425.327	1.526	50	20	IDGD	
CN(C)C(=O)NCC(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](F)Br)[nH]n1	1814564166	VWLUHASCGMLXKX-MFKMUULPSA-N	433.282	1.364	50	20	IDGD	
C[C@@H](CBr)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN2CCOCC2)[nH]n1	1814780802	TUPCNWMVYSPCQQ-ZFWWWQNUSA-N	442.358	1.765	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CO[Si](C)(C)C)CC2	1817301120	BLXUUTAABFJXNH-YPMHNXCESA-N	426.615	1.773	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2CCCS2)[nH]n1)c1cccc(B(O)O)c1	1817479872	VZFSZTKJCIOGLO-IRXDYDNUSA-N	428.323	1.291	50	20	IDGD	
O=C(N[C@@H]1CCc2nc(NC(=O)c3ccc(Cl)o3)sc2C1)c1cccc(B(O)O)c1	1817918363	FUCKHBVLULXUII-GFCCVEGCSA-N	445.693	1.609	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccncc2O)n[nH]1	1819676635	JCZZGZCMWOMYAD-HNNXBMFYSA-N	429.481	1.189	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1)c1ccc(-n2cccn2)nc1	1819882178	RCFGARVOLLKNHJ-HOTGVXAUSA-N	443.895	1.896	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2)c1cccc(F)c1	1822042310	JCEQWYIPQZXXEV-MRXNPFEDSA-N	439.277	1.502	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)CCc2ncc[nH]2)[nH]n1	1822416854	RKOCOVAZWBXBFP-OAHLLOKOSA-N	430.513	1.131	50	20	IDGD	
O=C(CN1C(=O)C=CC1=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](F)Br)[nH]n1	1822529557	CIAUBILLNSTHKK-ZUZCIYMTSA-N	442.245	1.017	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](C)n2cnnn2)n[nH]1	1822858433	AJRLPKWJLSLLBS-NTZNESFSSA-N	439.318	1.823	50	20	IDGD	
C[C@H](Cn1cncn1)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1	1823008808	WRQRGEHICYTIOO-KBVBSXBZSA-N	445.318	1.673	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H](O)CCl)CC1	1824185989	NLZPQRQBRCGYKI-MANSERQUSA-N	440.968	1.961	50	20	IDGD	
COC(=O)C1(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@@H](F)Br)CC3)CC1	1825280757	PYMNYLMQUPHDGW-GMSGAONNSA-N	434.287	1.699	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CNC(=O)N(C)C)CC2	1825632116	PKINLGAOEKBSBX-DTWKUNHWSA-N	432.344	1.110	50	20	IDGD	
Cc1cc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)no1	1827051068	MLDYECBDUPBMNN-FQEVSTJZSA-N	425.294	1.210	50	20	IDGD	
O=C([C@H]1CCCS1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827055168	QXFJTESARNVVRT-VQTJNVASSA-N	430.379	1.495	50	20	IDGD	
Cc1cc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)ccn1	1827058223	SNEYGXBYBGEKKL-QFIPXVFZSA-N	435.333	1.617	50	20	IDGD	
CCc1ccnc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)c1	1827356060	BCPCYHJUWZMPBM-QHCPKHFHSA-N	449.360	1.871	50	20	IDGD	
O=C([C@@H](F)Br)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)n2)CC1	1827601730	OLMROZXDJRCGNQ-GXTWGEPZSA-N	445.289	1.812	50	20	IDGD	
CCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCN2C(=O)OCc1ccccc1	1828547902	BAKLQYMVDBGWAE-UWJYYQICSA-N	437.924	1.448	50	20	IDGD	
NCC(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1828961162	JXUWHBPCGUIMPK-LJQANCHMSA-N	443.331	1.201	50	20	IDGD	
Cc1cc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)no1	1830545786	MQXDLIDIWQRJHI-UGSOOPFHSA-N	444.326	1.013	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3c(C)nn(C)c3C)C2)C1	1831639838	DXRRJGRGAYKHCB-OXQOHEQNSA-N	426.945	1.514	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3nnc(C)s3)C2)C1	1831645577	DTURCQVPGBUYBC-KDOFPFPSSA-N	430.958	1.253	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(F)cn2)CC1	1831872504	ZLHFVEJXNBXVME-LJQANCHMSA-N	433.528	1.827	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(F)s1)CCO2	1833215930	JIWHKYUIPQFSET-SFHVURJKSA-N	430.574	1.809	50	20	IDGD	
CC(C)(C)n1cc(C(=O)N2CCC(N3CCC(NC(=O)[C@H](O)CCl)CC3)CC2)cn1	1833308300	QIRDNVAYJBDDSY-GOSISDBHSA-N	439.988	1.423	50	20	IDGD	
Cc1ncccc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)CBr)C2)C1	1834035381	NUIPPTBNLFBQKW-KUHUBIRLSA-N	440.338	1.491	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)Cn3ccnc3)CC2)CC1	1834267581	ZTXBYRNXRFBUSA-CQSZACIVSA-N	426.359	1.238	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC(N2CCC(NC(=O)c3ccc(O)cn3)CC2)CC1	1834336694	VSUUUBCGOBZZGS-UHFFFAOYSA-N	434.613	1.824	50	20	IDGD	
CC(C)c1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)no1	1834499828	GAFMRTVWKHYMSG-ACJLOTCBSA-N	444.326	1.651	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)c3ccc(O)c(F)c3)C2)C1	1834823713	DYJTZAQAPHMNDY-GOSISDBHSA-N	445.285	1.386	50	20	IDGD	
Cc1nnc(CC(=O)NC2CCN(C3CCN(C(=O)CO[Si](C)(C)C)CC3)CC2)o1	1834834301	RSEDKXLAHOLMQO-UHFFFAOYSA-N	437.617	1.344	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)CC1CCOCC1)CCO2	1835422221	RVECQIUQDLHVRF-HXUWFJFHSA-N	428.602	1.111	50	20	IDGD	
Cc1cccc(CCC(=O)N2CCOC[C@]3(C2)CN(C(=O)CO[Si](C)(C)C)CCO3)n1	1837710040	DRWPZVBKGOGTJG-QFIPXVFZSA-N	449.624	1.631	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCC(OC2CCN(C(=O)Cn3cncn3)CC2)CC1	1837965330	LPIPVXFQWXAUSR-SFHVURJKSA-N	432.352	1.513	50	20	IDGD	
Cc1ccccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)CCBr)C2)C1	1838898361	MLRYXSXOVKLWQA-LJQANCHMSA-N	425.323	1.850	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)OC(=O)NC(C)C)C2)C1	1839146996	DGPNGCGHQRNPQD-FOIQADDNSA-N	447.960	1.373	50	20	IDGD	
C=CCC(F)(F)C(=O)N1CCO[C@]2(COCCN(C(=O)CCBr)C2)C1	1839887713	GRWQULXOMCXBCD-HNNXBMFYSA-N	425.270	1.439	50	20	IDGD	
C=CCSCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](Br)CC)CCO2	1839962777	QTESHQUKBYTRAO-PBHICJAKSA-N	435.384	1.536	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(F)c3F)C2)C1	1840034568	PRYKNDOLOKUYHG-KZULUSFZSA-N	447.276	1.818	50	20	IDGD	
O=C(c1cc(O)nc(Cl)c1)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840186336	JOOWGBDAAHLOQI-MRXNPFEDSA-N	438.695	1.314	50	20	IDGD	
COc1cccc(CCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)n1	1840186602	RBKDSZMYQWWYHY-LJQANCHMSA-N	446.331	1.283	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(F)(F)Cl)CCO2	1840286612	GFTVLGCQOAMHPK-GXFFZTMASA-N	433.677	1.448	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3ncc[nH]3)CCO2)C1	1840325782	SKASLRXQEDSDNX-MSOLQXFVSA-N	433.336	1.035	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC2(CCCN2C(=O)[C@@H](O)c2ccco2)C1	1841068673	UENYWHHHVDPOEI-ZFWWWQNUSA-N	441.912	1.649	50	20	IDGD	
CC[C@@H](C)[C@H](O)C(=O)N1CCCC12CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1841630075	NTPQVGPWKFRJFM-ILXRZTDVSA-N	431.961	1.729	50	20	IDGD	
Cc1cc(C(=O)N2CCCC23CN(C(=O)CN(C)NC(=O)NCc2ccccc2)C3)no1	1842497441	PXGFQGCRAUDHFQ-UHFFFAOYSA-N	440.504	1.146	50	20	IDGD	
Cc1ccc2nc(C(=O)N3CC4(CCCN4C(=O)c4ccc(B(O)O)cc4)C3)sc2c1	1843010939	WZMFLJHEJFUFSW-UHFFFAOYSA-N	435.314	1.415	50	20	IDGD	
O=C(c1ccc(OCC2CC2)cc1)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843012932	YRJWYYNUGUGFSM-UHFFFAOYSA-N	434.301	1.286	50	20	IDGD	
CC(C)Oc1ccc(C(=O)N2CC3(CCCN3C(=O)c3cccc(B(O)O)c3)C2)c(F)c1	1843014610	FRRVZGBCZKKTLM-UHFFFAOYSA-N	440.280	1.424	50	20	IDGD	
CCSc1ncccc1C(=O)N1CC2(CCCN2C(=O)c2cnccc2C(=O)NN)C1	1844263257	KPNFUBQLOUYOGY-UHFFFAOYSA-N	440.529	1.323	50	20	IDGD	
CN(CC(=O)N1CC2(CCCN2C(=O)c2ccccc2)C1)NC(=O)NCc1ccccc1	1844849864	JNYLDTZDXDZNGV-UHFFFAOYSA-N	435.528	1.850	50	20	IDGD	
O=C(CCn1cnc2ccc(Br)cc2c1=O)NNC(=O)c1ccccc1O	23449592	CXLOTAFZFDEYKR-UHFFFAOYSA-N	431.246	1.716	50	20	IDGD	
CN(CC(=O)NNC(=O)c1cn(-c2ccccc2)nc1-c1ccccc1)S(C)(=O)=O	106008425	XUALEAKXDVOYAS-UHFFFAOYSA-N	427.486	1.192	50	20	IDGD	
COc1ccc(CN2C[C@H](C(=O)NNC(=O)C(=O)Nc3ccc(C)c(C)c3)CC2=O)cc1	726631250	TXGOLSYCSKGAHM-QGZVFWFLSA-N	438.484	1.447	50	20	IDGD	
CCS(=O)(=O)CCNC(=O)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1	727943780	OSOYUNPGDICBQT-FQEVSTJZSA-N	444.557	1.379	50	20	IDGD	
CN(C)N(C(=O)[C@@H]1CS[C@@]2(c3ccc(F)cc3)CCC(=O)N12)[C@@H]1CCS(=O)(=O)C1	728179664	NPSRBDHVQQXGRY-JTDSTZFVSA-N	441.550	1.209	50	20	IDGD	
COC(=O)c1ccc(COc2ccc(C=NNC(=O)[C@H](C)NS(C)(=O)=O)cc2)cc1	728437971	ZATHLWYSFUFUBJ-AWEZNQCLSA-N	433.486	1.440	50	20	IDGD	
CCN1C(=O)C(=CNNC(=O)c2cc(F)ccc2Br)C(=O)N(CC)C1=S	728610574	ISYSFTMQFVQDMS-UHFFFAOYSA-N	443.298	1.702	50	20	IDGD	
CCCCN(C)C(=O)C1CCN(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)CC1	728961154	ALUPQVYOJHRRLW-UHFFFAOYSA-N	445.568	1.404	50	20	IDGD	
Cc1nc2[nH]n(C)c(=O)c2c(C)c1CCC(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	729512371	GVFJFCSGPFBPEQ-UHFFFAOYSA-N	449.471	1.164	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)NCCOc2ccc(S(C)(=O)=O)cc2)c1C	730066546	LLVXJPCAXILBEQ-MRXNPFEDSA-N	449.529	1.884	50	20	IDGD	
CN(C(=O)c1ccco1)c1ccccc1C(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	730998290	SEEYMIODDGCUTO-UHFFFAOYSA-N	445.435	1.878	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(=O)n(CC(=O)NNC(=O)C(C)(C)c2ccccc2)c1	731178050	UWIZUDGVBNRFEB-UHFFFAOYSA-N	448.545	1.004	50	20	IDGD	
CC(C)(C(=O)NNS(=O)(=O)c1ccc(C(=O)N2CCOCC2)cc1)c1ccccc1	731180008	MZJWMUQGDNYRDZ-UHFFFAOYSA-N	431.514	1.446	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)N1CCN(C(=O)COc2ccc(C)cc2)CC1	731500889	SGRFWFFWJMWPLM-UHFFFAOYSA-N	426.473	1.581	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Cc2ccc(S(N)(=O)=O)s2)cc1Br	732175052	GUXYNIANQPVSOX-UHFFFAOYSA-N	448.320	1.170	50	20	IDGD	
Cc1occc1C(=O)Nc1nc(CC(=O)NNC(=O)CCN2C[C@H](C)O[C@H](C)C2)cs1	732261189	BMCKNLAXPOVHEX-BETUJISGSA-N	449.533	1.486	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)N[C@@H]2CCN(c3ccccc3C(N)=O)C2)cc1C	732595375	PKTPRINHTXKQHF-MRXNPFEDSA-N	425.489	1.390	50	20	IDGD	
O=C(NNc1cncc(Cl)n1)N[C@@H]1CCCN(c2cc(N3CCOCC3)ncn2)C1	732913601	AWZLILUPXBTZPY-CYBMUJFWSA-N	433.904	1.052	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCC(C)(C)c2cccs2)cc1	734071608	KGYXAAIIGMCJJZ-UHFFFAOYSA-N	438.575	1.985	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NCc1nc(-c2cccc(Cl)c2)no1	734525522	NTDNEVFMEZLEKF-UHFFFAOYSA-N	434.865	1.712	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)N[C@H]2CCCc3nc(C)ncc32)nc1	734950548	MBOZWXMZBLUCCQ-KRWDZBQOSA-N	433.538	1.914	50	20	IDGD	
COc1ccc(S(=O)(=O)C[C@H](C)C(=O)NNC(=O)COc2ccc(C)c(C)c2)cc1	735029349	VFXTWCWESVWVFX-INIZCTEOSA-N	434.514	1.948	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNc3ncccc3S(=O)(=O)N3CCN(C)CC3)cc2C1	735117554	WYWKSGGFUUDSEZ-AWEZNQCLSA-N	449.602	1.961	50	20	IDGD	
CS[C@H](C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1)c1ccccc1	740085828	NVAWVBCXXXBCTQ-KRWDZBQOSA-N	435.575	1.565	50	20	IDGD	
C[C@H](C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)c1ccco1	741514355	KGGFTVRLQINECB-HNNXBMFYSA-N	435.502	1.184	50	20	IDGD	
CC(C)CC(=O)Nc1ccc(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1F	742035557	QMDHAUAWTSAJTF-UHFFFAOYSA-N	425.424	1.861	50	20	IDGD	
C[C@H](C(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1)[C@H](NC(=O)OC(C)(C)C)c1ccccc1	742489402	BKYFFNNGAJPNRT-BPUTZDHNSA-N	439.534	1.471	50	20	IDGD	
CCOc1ccc(C(=O)NCC(=O)NNC(=O)c2cc(Br)ccc2O)cc1	743730647	BZIVZELFNQGYAI-UHFFFAOYSA-N	436.262	1.744	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)[C@H]2CCN(c3ccc(Cl)cc3)C2=O)c1	744842740	QTNHNSNZUUZIBQ-KRWDZBQOSA-N	440.843	1.569	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)NC[C@H](C)CN1CCN(C)CC1	745859859	FSCBHTUCYVRHAZ-HNNXBMFYSA-N	430.578	1.946	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)[C@@H]1[C@H](C)OC(C)(C)N1C(=O)OC(C)(C)C	746094169	CPCRBTAPHFQVLV-GUYCJALGSA-N	437.493	1.982	50	20	IDGD	
O=C(NNC(=O)c1ccc(Sc2ccccc2Cl)nn1)N[C@H]1CCS(=O)(=O)C1	746164618	YTZKBSIQKJGILY-JTQLQIEISA-N	441.922	1.412	50	20	IDGD	
CC(C)(C)OC(=O)NC1(CC(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)CCC1	747057744	WFPPYZBATWSOTD-UHFFFAOYSA-N	430.461	1.700	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1)NNC(=O)c1ccc(Cl)cc1F	747431393	LVHHCIMEWFYJRJ-UHFFFAOYSA-N	444.828	1.517	50	20	IDGD	
O=C(CNC(=O)c1cccc([N+](=O)[O-])c1)NNc1nc(-c2ccccn2)nc2c1CCC2	747987041	GCCAFBRSJZBGQR-UHFFFAOYSA-N	433.428	1.809	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN1C(=O)c1ccc(Cl)c(Cl)c1)C(=O)N1CCCC1	748241257	QUCUGPPEGWOWSQ-AWEZNQCLSA-N	427.288	1.368	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)N2CCC[C@H](N3CCNC3=O)C2)N(C)c2ccccc21	748722155	OXPVZUCWKDLORM-INIZCTEOSA-N	436.516	1.673	50	20	IDGD	
Cn1c(N)c(C=NNC(=O)c2cn(-c3ccccc3)nc2-c2ccccc2)c(=O)n(C)c1=O	749813416	ZTGBTNIPLTZIAR-UHFFFAOYSA-N	443.467	1.283	50	20	IDGD	
Cc1nn(-c2cncc3nnnn23)c(C)c1CC(=O)NNC(=O)c1ccc(Cl)cc1F	749855250	GDYKLXLKOZXAFA-UHFFFAOYSA-N	443.830	1.118	50	20	IDGD	
CN(C)C(=O)[C@H](NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)c1ccccc1	750155747	SJZRKGQHARINAH-HXUWFJFHSA-N	444.557	1.925	50	20	IDGD	
CC[C@H](C)C(=O)N1CCC[C@H](C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)C1	751292812	BCLMJXRNBZTLIJ-AAEUAGOBSA-N	444.941	1.033	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)[C@H]2CN(Cc3nc(O)c4ccccc4n3)CCO2)c(O)c1	754424570	QCDISTNDNVJHNC-GOSISDBHSA-N	437.456	1.011	50	20	IDGD	
COc1cccc2c1CCC(=NNC(=O)c1cccc(S(=O)(=O)N3CCOCC3)c1)C2	754900946	MVIXXXKFCVUHEG-UHFFFAOYSA-N	443.525	1.991	50	20	IDGD	
C[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	755314715	ZKAOEJNGBXBDPL-CHWSQXEVSA-N	442.538	1.247	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c(Cl)c1	755316662	AEAAGFVABPNALU-UHFFFAOYSA-N	437.905	1.744	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)Nc2ccc(Cl)c(S(=O)(=O)N3CCOCC3)c2)o1	755360735	GOWGGXAAEOJUFF-UHFFFAOYSA-N	442.881	1.729	50	20	IDGD	
C[C@H](C(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1)[C@@H](C)NC(=O)OC(C)(C)C	755381299	FFFGEQXQHBBOMW-NWDGAFQWSA-N	426.901	1.653	50	20	IDGD	
COC(=O)CNC(=O)c1ccc(NC(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)cc1	755552237	ZMMPRZZUWCLOKY-UHFFFAOYSA-N	442.457	1.508	50	20	IDGD	
COCCOc1ccc(NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1F	756204275	VZPCQXLYNYSJIN-UHFFFAOYSA-N	429.408	1.564	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)Nc2cnn(CC(=O)NC3CC3)c2)n[nH]1	756795187	IWRTXWMNXMZWLF-UHFFFAOYSA-N	438.448	1.027	50	20	IDGD	
CC[C@@H](C)NS(=O)(=O)c1cccc(NC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1	757709631	OOSLEWBMLXYTFS-ACJLOTCBSA-N	448.501	1.756	50	20	IDGD	
O=C(COC(=O)C(F)(F)c1c(F)cccc1F)NNC(=O)c1cccc([N+](=O)[O-])c1	757824330	BKFXDEJKBZSQCS-UHFFFAOYSA-N	429.282	1.969	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)Nc1ccccc1CN1CCNC1=O	757926814	OWJTTZIJRVNNMZ-UHFFFAOYSA-N	427.461	1.842	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@H](C)OC2CCCCCC2)cc1	760266177	YPYUCNDVKUHLHZ-INIZCTEOSA-N	425.551	1.891	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N[C@H](CCSC)C(=O)NNc2ncc(F)cn2)cc1	760920895	RNFDDSLJLCTQGD-OAHLLOKOSA-N	443.526	1.558	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)c1cccc(N2CCCS2(=O)=O)c1	761633104	HNWPJQUKTITFBC-UHFFFAOYSA-N	435.527	1.788	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)C(C)C)cc1NC(=O)C(=O)NNC(=O)c1ccccc1O	763529727	LNTYBVGUDCDNTK-UHFFFAOYSA-N	448.501	1.129	50	20	IDGD	
COC(=O)C(C)(C)c1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1	763570741	FPYFWIBUVIOCBQ-KRWDZBQOSA-N	441.440	1.063	50	20	IDGD	
CN(C)c1nc2cc(NC(=O)C(=O)NNC(=O)c3cc(-c4ccccc4)[nH]n3)ccc2o1	763600483	JONQVDAXHXYKBJ-UHFFFAOYSA-N	433.428	1.684	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2c(C)nn(-c3ccccc3)c2C)cc1	763660630	DMWPAASQWXWPCX-UHFFFAOYSA-N	437.456	1.663	50	20	IDGD	
C[C@@H]1CN(C(=O)C(=O)NNC(=O)COc2ccc(Br)cc2)c2ccccc2O1	763693581	DYWWEJVZJWUSHU-GFCCVEGCSA-N	448.273	1.789	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2cccc3ccsc23)c1	763718090	HEOKMMMPGUYBSV-UHFFFAOYSA-N	446.510	1.551	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)c1	763761010	YCALIIGHVSKNBS-UHFFFAOYSA-N	437.359	1.662	50	20	IDGD	
C[C@@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3cc4c(s3)CCC4)cc2)CCO1	763781273	HXHHWQVHIGOYMC-CYBMUJFWSA-N	428.514	1.862	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2ccc(CSC)cc2)c2ccccc2c1=O	763786348	MLWQEGKXGWAHNV-UHFFFAOYSA-N	439.497	1.679	50	20	IDGD	
CC(=O)Nc1cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)c(F)cc1F	763853062	ZPXYKLBUMBDWBK-SECBINFHSA-N	438.362	1.616	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cc(C)[nH]c2C(=O)OC)cc1	763860627	JKLRSWQALYJXPR-GFCCVEGCSA-N	432.433	1.062	50	20	IDGD	
CCc1cc(NC(=O)C(=O)NNC(=O)C2=S=C3CC[C@@H](C(C)(C)C)CC3=C2)n(C)n1	763941434	NJFKPUCNMTUVRJ-CYBMUJFWSA-N	431.562	1.933	50	20	IDGD	
COC(=O)c1cc(Cl)ccc1NC(=O)C(=O)NNC(=O)c1ccc2c(c1)OCCO2	764003646	KXWIUZRZZIJXKD-UHFFFAOYSA-N	433.804	1.298	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1cccc(Oc2cnccn2)c1	764004120	RXSIUSRYALMSHJ-UHFFFAOYSA-N	435.396	1.440	50	20	IDGD	
CCOC(=O)COc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2OC)c1	764013489	YKIPCLSXMDZECV-UHFFFAOYSA-N	449.847	1.690	50	20	IDGD	
CCCNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(C)cc3)[nH]n2)c1	764112286	VDSMFESRLKPVSK-UHFFFAOYSA-N	448.483	1.925	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(N3CCCC3=O)ccc2Cl)cc1	764176343	CGHWLEIMQUAWEA-UHFFFAOYSA-N	425.832	1.738	50	20	IDGD	
O=C(CCCc1ccccc1)NNC(=O)C(=O)Nc1ccc2nc3n(c(=O)c2c1)CCC3	764226202	JOBHWDYXYLKEQS-UHFFFAOYSA-N	433.468	1.452	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)C(=O)Nc2ccc(F)cc2C#N)c1	764231278	GKAOGHVIDZXXQM-UHFFFAOYSA-N	435.209	1.868	50	20	IDGD	
CC(C)CNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)Cc2cccnc2)cc1Cl	764269133	XNTPXWFNVFDWSO-UHFFFAOYSA-N	431.880	1.449	50	20	IDGD	
CN(Cc1cccc(NC(=O)C(=O)NNC(=O)Cc2cc[nH]n2)c1)C(=O)OC(C)(C)C	764286523	WWOQYWATZYDXLZ-UHFFFAOYSA-N	430.465	1.105	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)C(=O)Nc2ccc(Br)c(Cl)c2Cl)cn1	764363182	LMCXHIBUXVSNJB-UHFFFAOYSA-N	435.065	1.889	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)N[C@@H]3CCCC[C@H]3N3CCOCC3)n[nH]2)cc1	764374947	MMXCSYUOCIQVBL-YLJYHZDGSA-N	426.521	1.973	50	20	IDGD	
Cc1nc(-c2cccc(NC(=O)C(=O)NNC(=O)c3cc(-c4cccs4)[nH]n3)c2)no1	764382632	NRJCBKFNDLLEMV-UHFFFAOYSA-N	437.441	1.896	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)cc1[N+](=O)[O-]	764388552	UEKDMVQKFZVVNM-UHFFFAOYSA-N	426.364	1.832	50	20	IDGD	
CC(C)(C)c1nnc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)s1	764389069	XRMBJRRQTRGFFS-UHFFFAOYSA-N	431.453	1.765	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1ccc(N2CCCC2=O)cc1	764392966	MYZQZCDSWWSLRC-UHFFFAOYSA-N	442.497	1.700	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)CCC(=O)N1CCN(c2ccccn2)CC1	764636398	SDMYIHHULNGAGA-UHFFFAOYSA-N	445.907	1.634	50	20	IDGD	
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1C	765073315	HHYXNIMOHBNQKY-UHFFFAOYSA-N	434.478	1.228	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)c1cccc(N2CCCS2(=O)=O)c1	765311547	XYEBQVRQBXCQKJ-UHFFFAOYSA-N	440.522	1.292	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)OC(C)(C)C)c(I)c1	765697699	JJKJNXCMQTWSMK-UHFFFAOYSA-N	435.218	1.794	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)NCc1ccccc1OCCN1CCOCC1	765715782	KORREWPMJQTYPN-UHFFFAOYSA-N	448.545	1.627	50	20	IDGD	
CC[C@H](Oc1ccccc1F)C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765737542	GIDDXBNILJHFBD-IBGZPJMESA-N	442.491	1.589	50	20	IDGD	
CCc1noc(CC)c1CC(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	765756792	PZIBEQYLPAVTMX-UHFFFAOYSA-N	447.967	1.961	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)CN1CCCN(C(=O)c2ccc(F)cc2)CC1	766848314	DSANKNPYHYKISU-UHFFFAOYSA-N	426.492	1.672	50	20	IDGD	
CCOc1cc(C(=O)NNS(=O)(=O)c2cc(C)cnc2N)cc(OCC)c1OCC	766892810	VXSQYJGPTOLGPJ-UHFFFAOYSA-N	438.506	1.792	50	20	IDGD	
O=C(CSc1nnc(-c2ccncc2)n1Cc1ccco1)NNc1ncnc2[nH]cnc12	768139965	ZOQQBKZTPLWTLT-UHFFFAOYSA-N	448.472	1.883	50	20	IDGD	
CSCCNC(=S)NNC(=O)[C@@H](C)NC(=O)c1ccc(Br)s1	769769516	VDAHYYHRHDRWNA-SSDOTTSWSA-N	425.399	1.487	50	20	IDGD	
CCC(C)(C)C1CCC2(CC1)NC(=O)N(CC(=O)NNC(=S)NCCSC)C2=O	770239101	GDLVBBRFCUUMNE-UHFFFAOYSA-N	443.639	1.762	50	20	IDGD	
CN1CCN(c2ccc(/C=C(\C#N)C(=O)Nc3ccc(S(N)(=O)=O)cc3)cc2)CC1	771518962	BNEZNCFOZRVXAL-SAPNQHFASA-N	425.514	1.631	50	20	IDGD	
O=C(CSc1ccccc1O)NNS(=O)(=O)CCNC(=O)OCc1ccccc1	771786762	YJMPTTLYIRYHBF-UHFFFAOYSA-N	439.515	1.361	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	771884182	YSISKCOINOOVBE-CQSZACIVSA-N	433.486	1.268	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(C(=O)O[C@H](C)C(=O)NNC(=O)CC(C)C)cc1	771894060	MCLXWXKHWZDKJE-CQSZACIVSA-N	427.523	1.456	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N2CCC(Oc3ccnc(C(N)=O)c3)CC2)c(OC)c1	771977486	JVFQMQALGQQNKC-UHFFFAOYSA-N	443.460	1.096	50	20	IDGD	
CCOC(=O)CNC(=O)C1CCN(C(=O)/C(C#N)=C/c2cc(C)n(CCOC)c2C)CC1	772567707	CCGMZMSQCDSWRV-DEDYPNTBSA-N	444.532	1.576	50	20	IDGD	
CCn1c(SCC(=O)NN=C(C)c2cn(CC(=O)OC)nn2)nnc1-c1ccccc1	772845306	WFFYGSBLLNYNQH-UHFFFAOYSA-N	442.505	1.362	50	20	IDGD	
COC[C@@H](NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)c1ccc(F)c(F)c1	773541895	SFYCYFHQWRLDJA-QGZVFWFLSA-N	434.447	1.689	50	20	IDGD	
CCOC(=O)Cn1cccc(NC(=O)C(=O)NNc2ncc(Cl)cc2Cl)c1=O	773676045	BFTURXJKELNEFV-UHFFFAOYSA-N	428.232	1.195	50	20	IDGD	
COc1ccccc1C(=O)NNS(=O)(=O)c1cc(Cl)ccc1CS(C)(=O)=O	774617560	AOHMLIYYJLMBME-UHFFFAOYSA-N	432.907	1.517	50	20	IDGD	
CN(C)C(=O)[C@H]1CC[C@@H](CNC(=O)NNC(=O)c2cc(F)ccc2Br)O1	775455515	VCGNIVOVMMSUMI-GXFFZTMASA-N	431.262	1.168	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@@H](C)c2ccc(N(C)C)cc2)cc1	776248346	YOAKKOVOFVWWBL-INIZCTEOSA-N	447.561	1.773	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)c2cn(-c3cccc(Cl)c3F)nn2)c1	776437662	JDECJJSRVLSEHV-UHFFFAOYSA-N	431.811	1.986	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)N[C@@H]2C[C@H](OCC)[C@@H]2OC)c2ccccc2c1=O	776519624	ANGYGHOOJXEQAS-SOLBZPMBSA-N	431.493	1.333	50	20	IDGD	
O=C(Cc1ccc(Br)cc1)N1CCN(S(=O)(=O)CBr)CC1	777779053	CNKZYYHQKNLXKY-UHFFFAOYSA-N	440.157	1.818	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)[C@@H](C)Oc1cccc(Br)c1)n1nnnc1C(C)(C)C	777796134	UJKMWAFWUROCQV-WDEREUQCSA-N	439.314	1.909	50	20	IDGD	
C[C@H]1CCN(C(=O)OC(C)(C)C)[C@H](C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)C1	778420677	UIVFDWOTCVPVRO-YOEHRIQHSA-N	444.488	1.898	50	20	IDGD	
CC(C)C[C@@H](C(=O)NNC(=O)CNC(=O)OC(C)(C)C)N1C(=O)[C@H]2CC=CC[C@H]2C1=O	778445874	VIQADZOWKGLKAM-ZNMIVQPWSA-N	436.509	1.024	50	20	IDGD	
CC(C)N1CC[C@@H](NC(=O)NNC(=O)C(=O)Nc2ccccn2)[C@@H]1c1ccc(F)c(F)c1	779416946	JEBFSAJMNWJTSN-AEFFLSMTSA-N	446.458	1.853	50	20	IDGD	
COc1cccc(NNC(=O)[C@H]2CCCCN2S(=O)(=O)c2ccc(C(C)=O)cc2)n1	781024687	FSGDRMCHXHBHPW-QGZVFWFLSA-N	432.502	1.979	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)N2CCC[C@H](S(=O)(=O)NC3CCCC3)C2)cc(C#N)n1C	781524249	SAWMQALAQPNNAY-PSXSOWLISA-N	429.546	1.965	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)NCc2ccc(N3CCOC3=O)cc2)cc1C	783313138	OTTXLJCDVOMDLL-UHFFFAOYSA-N	425.445	1.729	50	20	IDGD	
CCCc1c(NC(=O)C(=O)NN[C@@]2(C)CCS(=O)(=O)C2)cnn1-c1cccc(F)c1	783427280	QZSMAGFBPWJWLV-IBGZPJMESA-N	437.497	1.100	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2cnn(-c3ccc(C(F)(F)F)cc3)c2)CCS(=O)(=O)C1	783427359	RQCHSJWWJOEWKF-MRXNPFEDSA-N	445.423	1.028	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2ccn(-c3cccc(C(F)(F)F)c3)n2)CCS(=O)(=O)C1	783427717	PULDVUUITNPEML-MRXNPFEDSA-N	445.423	1.028	50	20	IDGD	
O=C(NNc1ccc(-n2cccn2)nn1)C(=O)Nc1cccc2c1CN(c1ccccn1)C2	783432774	CNWMQTSANVKTJK-UHFFFAOYSA-N	441.455	1.659	50	20	IDGD	
COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	784216216	OUISSTNKLQMMDV-UHFFFAOYSA-N	449.445	1.126	50	20	IDGD	
COC(=O)C(C)(C)c1ccc(NC(=O)C(=O)NNc2cccc(S(C)(=O)=O)c2)cc1	784844161	IGZVIEDRWLUHPR-UHFFFAOYSA-N	433.486	1.623	50	20	IDGD	
CN(Cc1cccc(NC(=O)C(=O)NNc2ccnc(N(C)C)n2)c1)C(=O)OC(C)(C)C	784970725	YZFAORXCUIWYBB-UHFFFAOYSA-N	443.508	1.991	50	20	IDGD	
COc1cc(Br)cc(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)c1	785067829	PQZOOPQLNADCON-UHFFFAOYSA-N	446.261	1.434	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2cccc(N3CCCCC3=O)c2)n1	785226502	IABWYFKQBMQNCI-UHFFFAOYSA-N	425.493	1.922	50	20	IDGD	
O=C(NC[C@H](C(=O)OCc1ccccc1)c1ccccc1)NNC(=O)C(=O)N1CCCC1	786890724	LXYUQQPEIMQNGZ-IBGZPJMESA-N	438.484	1.466	50	20	IDGD	
Cn1nc(-c2ccsc2)cc1NC(=O)C(=O)NNC(=O)[C@@H]1COc2ccccc2O1	787541435	RZUAUTDCCJNXTC-HNNXBMFYSA-N	427.442	1.075	50	20	IDGD	
CN1CCN(C(=O)NNC(=O)[C@@H]2CC(=O)N(Cc3cccc(C(F)(F)F)c3)C2)CC1	788166551	PRDMFXFZCOFVNT-CQSZACIVSA-N	427.427	1.042	50	20	IDGD	
CCCc1csc(NC(=O)C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)n1	789730629	VESLJPFGMHWXFK-UHFFFAOYSA-N	444.561	1.394	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)c1ccc(OC)c(S(=O)(=O)N(C)C)c1	789912881	VMVJKELPUKBXBZ-UHFFFAOYSA-N	441.893	1.682	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)CNC(=O)c2cccnc2)cc(Cl)c1Br	791054022	MAYYAJPBILHNND-UHFFFAOYSA-N	425.670	1.997	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(CCC(=O)NNC(=O)c2ccc3c(c2)OCCO3)CC1	792032860	DVHCVGFYQZPVDY-UHFFFAOYSA-N	434.493	1.162	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)cc(Cl)c1F	792268581	NXNJHVVDSZJXHK-UHFFFAOYSA-N	448.794	1.302	50	20	IDGD	
CC[C@H](C)n1ncc(NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)c1C	792483226	UVFPGEGQVFHGPA-AWEZNQCLSA-N	436.538	1.944	50	20	IDGD	
CC(=O)NC[C@@H]1CCn2ncc(C(=O)NNC(=O)c3cc4c(s3)CCCCC4)c2C1	792736808	TUDCJAVMUFMBEW-CQSZACIVSA-N	429.546	1.987	50	20	IDGD	
O=C(COC(=O)CCCN1C(=O)c2ccccc2C1=O)NNC(=O)c1cccc(Cl)c1	792894827	FGLMFRZXBXIPBR-UHFFFAOYSA-N	443.843	1.721	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)[C@@H]2CCCCN2Cc2ccccn2)n1	795607455	OXNWGMFTIUHPFA-INIZCTEOSA-N	431.518	1.134	50	20	IDGD	
CNC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)CCCc2ccccc2)c(C)c1	797003421	AFIRSKVYFKIJEB-UHFFFAOYSA-N	426.473	1.229	50	20	IDGD	
CN1C(=O)COc2cc(NC(=O)C(=O)NNC(=O)CCSc3ccc(F)cc3)ccc21	799259348	ZEDRKVLHFCSMEE-UHFFFAOYSA-N	446.460	1.449	50	20	IDGD	
Cc1c(/C=C(\C#N)C(=O)NCCNS(=O)(=O)c2ccc(Cl)cc2F)cc(C#N)n1C	799740815	DPFQOTVOWXDKLP-VGOFMYFVSA-N	449.895	1.999	50	20	IDGD	
COCC[C@H]1CCCC1=NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1	799883368	ZISHCFJAZIVAPM-GOSISDBHSA-N	436.578	1.610	50	20	IDGD	
C[C@@H]1CN(S(=O)(=O)c2ccc(C(=O)NNC(=O)Nc3ccccc3)cc2)C[C@@H](C)O1	801984631	FQGHWSJLSICMFX-HUUCEWRRSA-N	432.502	1.951	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)[C@@H](Cc2cccc(OC)c2)n2nnnc2C)cc1	802055475	RHWZUOCKRCSWAR-GOSISDBHSA-N	425.449	1.635	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)[C@H](C(C)C)N2CCCS2(=O)=O)c(OC)cc1Cl	802086317	VSNIPQOHHZACGG-HNNXBMFYSA-N	448.929	1.570	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)Nc3cccc4c3CNC4=O)n[nH]2)cc1OC	806754403	RZMGKZRDUSWUCS-UHFFFAOYSA-N	436.428	1.804	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(NC(=O)C(=O)NNc2ccc3ccccc3n2)ccc1F	806983895	CIPORORLALXSBT-UHFFFAOYSA-N	431.449	1.706	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)Cn1cc(Cl)cn1	807094543	ZBZZWJOBOFKJFU-UHFFFAOYSA-N	425.320	1.155	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN2CCC[C@H](CNC(=O)C(F)(F)F)C2)cc1C	810073045	ZGGZRSWXQNCCHP-GFCCVEGCSA-N	434.484	1.770	50	20	IDGD	
CCOc1ccc(N2C[C@@H](C(=O)NNc3ccc(S(=O)(=O)N(C)C)cc3)CC2=O)cc1	812728685	VKEKKVHZLMXOIA-HNNXBMFYSA-N	446.529	1.832	50	20	IDGD	
Cc1cnc(Br)c(NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)c1	812979507	WCOAMCWVVQLYMV-UHFFFAOYSA-N	427.642	1.911	50	20	IDGD	
O=C(NNC(=O)c1ccccn1)C(=O)Nc1ccc2c(c1)N(C(=O)Cc1ccccc1)CC2	815563667	KMHHOZFDVOJEKO-UHFFFAOYSA-N	443.463	1.613	50	20	IDGD	
O=C(CCSc1ccc(F)cc1)NNC(=O)C(=O)Nc1cn(Cc2ccccc2)nn1	815567243	RYKKAHABXZKVNV-UHFFFAOYSA-N	442.476	1.734	50	20	IDGD	
COC(=O)N1CCN(c2ccc(NC(=O)C(=O)NNc3c(F)cccc3F)cn2)CC1	815574039	BITUTSOUYKURJZ-UHFFFAOYSA-N	434.403	1.330	50	20	IDGD	
Cc1ccc(-c2csc(NC(=O)C(=O)NNC(=O)[C@H]3CCc4nncn4C3)n2)s1	815691510	SEQRJVYOFORCMT-JTQLQIEISA-N	431.503	1.120	50	20	IDGD	
C[C@@H](NC(=O)CCC(=O)NNc1ncncc1F)C(=O)c1ccc(Br)cc1	817080380	LYBDJRCKIWTZCB-SNVBAGLBSA-N	438.257	1.989	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)NNC(=O)CC2CC2)cc1	819126380	NINSFHGIOXKLJA-WJDWOHSUSA-N	436.472	1.289	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)CCC(=O)N1CC(=O)Nc2ccccc21	825630701	NXYUWRHIZOHYIN-UHFFFAOYSA-N	425.445	1.020	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)c2nn(-c3ccccc3F)c(C)cc2=O)c1	825802305	ZUQILDLGRLQAHN-UHFFFAOYSA-N	425.420	1.562	50	20	IDGD	
CC[C@H](C)[C@H](C(=O)OCC(=O)NNC(=O)c1ccccc1)N1C(=O)c2ccccc2C1=O	844204245	MQQUXLPUAWXCHA-IFXJQAMLSA-N	437.452	1.702	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)CN2C(=O)N[C@]3(CCc4ccccc43)C2=O)cc1C	864001990	ZQYWUZWQGOXDGD-QHCPKHFHSA-N	436.468	1.223	50	20	IDGD	
Cn1cc(/C=C(\C#N)C(=O)Nc2nc(-c3ccc(O)c(O)c3)cs2)c(=O)n(C)c1=O	884183246	HBESASMNOIYYPQ-VZUCSPMQSA-N	425.426	1.164	50	20	IDGD	
CSc1ccc(N2C[C@H](C(=O)NNC(=O)C(=O)Nc3ccc(C)cc3)CC2=O)cc1	893070936	ZPRHZYQGNFJSNW-CQSZACIVSA-N	426.498	1.856	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)c3ccc(C)o3)CC2)cc1	913475391	QNDFREQBPBJQFN-UHFFFAOYSA-N	435.502	1.849	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C[C@@H](NC(N)=O)c2ccccc2C)cc(OC)c1OC	913660908	OZWBDPCYZOEUBZ-OAHLLOKOSA-N	430.461	1.582	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1cc(C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)ccc1F	914601232	LJWFJZUWCJYHRR-UHFFFAOYSA-N	438.437	1.886	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)N2CCN(C(=O)CN(C)C)CC2)c(C)n1C[C@@H]1CCCO1	915267775	RZJMSYPEPSECJC-OABJIQBASA-N	427.549	1.423	50	20	IDGD	
COC(=O)c1cc(CNC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)ccc1OC	915890769	FQVBAGWRSCLCRT-UHFFFAOYSA-N	435.458	1.030	50	20	IDGD	
C[C@H]1C[C@H](C)CN(CCCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)C1	916460307	HIJGUXKOXMWIGK-HOTGVXAUSA-N	439.582	1.249	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(CCCNC(=O)NNc2ccc(-n3cccn3)nn2)CC1	916638287	CYGWUDXOTYNWIG-UHFFFAOYSA-N	445.528	1.231	50	20	IDGD	
COc1ccc(CCN2C[C@@H](C(=O)NNC(=O)c3ccc(Cl)nc3)CC2=O)cc1OC	917248769	DILBWONMXVOFSR-HNNXBMFYSA-N	446.891	1.604	50	20	IDGD	
O=C(COC(=O)c1cc2cc([N+](=O)[O-])ccc2o1)NNC(=O)[C@H]1COc2ccccc2O1	917263875	UUJVWHKKZGANSL-QGZVFWFLSA-N	441.352	1.485	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NCc2cccc(CN3CCOCC3)c2)cc1	918223181	FEMRQBIINGEYDR-UHFFFAOYSA-N	428.489	1.437	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2cc(F)cc([N+](=O)[O-])c2N)c2ccccc2c1=O	918409482	MKBHNYRCPLCKLX-UHFFFAOYSA-N	428.380	1.511	50	20	IDGD	
CCC(=O)N1CCC[C@H](C(=O)NNC(=O)c2ccc(CSc3nncn3C)cc2)C1	919690428	OEAZEDWWFUBXSP-INIZCTEOSA-N	430.534	1.517	50	20	IDGD	
O=C(CCCOc1ccccc1Br)NNC(=O)N[C@H]1CCS(=O)(=O)C1	919886658	SZRMJFTXNQMNJZ-NSHDSACASA-N	434.312	1.126	50	20	IDGD	
N#Cc1ccccc1COc1cccc(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)c1	919887934	IORZRLNOBTVUAJ-QGZVFWFLSA-N	428.470	1.268	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)CN2C(=O)N[C@@](C)(c3ccccc3)C2=O)c2ccccc2n1	920429239	WAYOMJKPYYTSME-QHCPKHFHSA-N	431.452	1.771	50	20	IDGD	
Cc1nc(O)cc(-c2ccc(NC(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)cc2)n1	920836650	LCBFXFBXYWKQDT-UHFFFAOYSA-N	431.416	1.600	50	20	IDGD	
CCNC(=O)NNC(=O)c1cc(S(=O)(=O)N(CC)CC)ccc1N1CCC(C)CC1	920858203	LSEUUUIOVGEPOH-UHFFFAOYSA-N	439.582	1.917	50	20	IDGD	
O=C(NCCCn1cc(Br)cn1)NNC(=O)c1cncn1-c1ccccc1	1261106312	HJNNXWYVLYVSLG-UHFFFAOYSA-N	432.282	1.866	50	20	IDGD	
Cc1cc(C)nc(SCc2ccc(C(=O)NNC(=O)CN3CCC(CO)CC3)cc2)n1	1262596023	PASXZUSFCVWUMI-UHFFFAOYSA-N	443.573	1.851	50	20	IDGD	
COc1ccc(-c2nnc(S)n2CC(=O)NNC(=O)c2cncn2-c2ccccc2)cc1	1318870669	QLHDRZOBKUTLSA-UHFFFAOYSA-N	449.496	1.889	50	20	IDGD	
COc1ccc2[nH]c(C)c(C(=O)NNC(=O)CN3CCN(C(=O)c4ccccc4)CC3)c2c1	1319371458	PVJJBGCOJYBDPC-UHFFFAOYSA-N	449.511	1.704	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1ccnc(OC2CCC2)c1	1319656559	NSANVDQWMBMJIJ-UHFFFAOYSA-N	432.502	1.791	50	20	IDGD	
O=C(CCn1c(S)nc2ccccc2c1=O)NNC(=O)c1cncn1-c1ccccc1	1321527192	OXWALHGZZSLINU-UHFFFAOYSA-N	434.481	1.722	50	20	IDGD	
COCCNS(=O)(=O)c1cccc(CNC(=O)NNc2ccc(C(C)(C)C)nn2)c1	1321937271	LSDGNRRFFKUCGK-UHFFFAOYSA-N	436.538	1.525	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)Cn2c(=O)cnc3ccccc32)CC1	1322958231	UVHRLDWZGPZJHO-UHFFFAOYSA-N	429.477	1.191	50	20	IDGD	
O=C1Nc2c(cccc2C(=O)N2CC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)C1=O	1778714349	PZRBRLYZBAEEML-SFHVURJKSA-N	426.256	1.069	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)nn1C(F)F	1780307590	PWUBCHBRRHNMKQ-SFHVURJKSA-N	430.528	1.882	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCn1cncn1)C2	1780715534	RFZXMFGFQFHPJJ-FHLIZLRMSA-N	432.352	1.418	50	20	IDGD	
Cc1nc(N)sc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Br)C1	1780771197	HAHMYKSXKAVSED-NSODJVPESA-N	449.346	1.852	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)c3[nH]nc4ccncc34)CCO2)C1	1781228184	YYEQMOCEDPEANC-ROUUACIJSA-N	426.304	1.638	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc4nonc4c3)CCO2)C1	1781229317	GHDWJLGBKIXILX-ZWKOTPCHSA-N	427.288	1.903	50	20	IDGD	
Cc1nnc(CCC(=O)N2CCO[C@]3(CCN(C(=O)[C@H](F)Br)C3)C2)s1	1781325697	HRUCICHDFSCXSV-DZGCQCFKSA-N	435.319	1.300	50	20	IDGD	
COc1cccc(CC(=O)N2CCO[C@]3(CCN(C(=O)[C@H](F)Br)C3)C2)c1	1781328424	PTUHKXSULBZVGE-FUHWJXTLSA-N	429.286	1.758	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc3nn[nH]c3c2)C1	1781442547	FCNYLGQFTHQLAH-WIBUTAKZSA-N	435.912	1.339	50	20	IDGD	
COC(=O)c1ccc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](F)Cl)CCO3)c([N+](=O)[O-])c1	1782090120	NOXUSAYFLNELQW-KDOFPFPSSA-N	443.815	1.359	50	20	IDGD	
Cc1ncc(/C=C/C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](O)CCl)C3)s1	1782663734	JCNCINWESWMOSJ-FALIZWMGSA-N	427.954	1.578	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc(C(N)=O)cc2)C1	1782866147	PJNZYCNMOMJREA-CBGDNZLLSA-N	437.924	1.167	50	20	IDGD	
CO[C@H](C)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](Br)Cc3ccccc3)C2)C1	1783021739	GMTZVGBWWDAEDQ-WRWLIDTKSA-N	439.350	1.857	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cnn4ccncc34)CCO2)C1	1783347991	RBDBWYKUCAACKE-KBXCAEBGSA-N	436.310	1.346	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H]1Cc3ccccc3CN1)CCO2	1783534006	CPZPZSOZVLSWHJ-WIBUTAKZSA-N	436.350	1.314	50	20	IDGD	
CC(=O)Nc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)C(C)(C)CCl)[C@H]3C2)ccn1	1783849801	JDCBBZGDABMYCP-ULQDDVLXSA-N	436.940	1.898	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(Cl)cc4nn[nH]c34)CCO2)C1	1783880963	HHFGJAAUBJUNAE-ACJLOTCBSA-N	442.303	1.309	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)C3CCC4(CC3)OCCO4)CCO2)C1	1783881391	LCDJLMQSXBJBIA-APWZRJJASA-N	430.929	1.003	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cccc(SC)c3O)CCO2)C1	1783883181	VTZKYJHAQBXUQO-LIRRHRJNSA-N	428.938	1.811	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)N3C[C@H]4C[C@H]4C3)C[C@@H]21	1783967814	XOEUVPVPTMJBDQ-QWRIQZTRSA-N	442.398	1.337	50	20	IDGD	
O=C(C[C@@H]1COc2ccccc2O1)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21	1784395390	SUFINTRDXFUYMO-LOUJCGABSA-N	443.327	2.000	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](S)C(C)C)[C@H]2C1	1784531332	GTZCYVBIKOJVBM-WMDQAJGNSA-N	449.577	1.055	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(CO)c(F)c3)C2)C1	1785266072	IGKJQKISKBPXNP-KPZWWZAWSA-N	429.286	1.545	50	20	IDGD	
O=C(NC1(c2ccc(NC(=O)[C@@H](O)c3ccco3)cc2)CCC1)c1cccc(B(O)O)c1	1785855665	ZOILPSRJYSERCG-FQEVSTJZSA-N	434.257	1.441	50	20	IDGD	
COc1nccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Br)C[C@@H]32)c1F	1787139671	KDIHTPFWTKGIAB-QVSJOPQTSA-N	448.264	1.513	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN(C)C(=O)c3ccccc3)C[C@@H]21	1789858399	XAHWKVRPVGUPCB-OKYOBFRVSA-N	435.952	1.756	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc4cccnn4c3)[C@H]2C1	1790432915	GSJGMXZZZQBGSL-PYTWLRIVSA-N	435.322	1.711	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3nc4ccc(F)cn4n3)[C@H]2C1	1790526852	ILIQKGAMPNNZLY-HNKHHVNMSA-N	437.903	1.869	50	20	IDGD	
CC[C@H](NC(C)=O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](Br)CC)[C@H]2C1	1790961214	INRSOUKKOBDDJC-QMHWVQJVSA-N	432.359	1.054	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)COc3ccc(O)cc3)C[C@@H]21	1791055342	UJPMAHUCDVYBHT-OQUILHJVSA-N	441.322	1.534	50	20	IDGD	
C[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]2C1)n1cccc1C=O	1791058444	YUFPPRHUEGPTLQ-HZRXROBNSA-N	440.338	1.625	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1ccc(C2(NC(=O)CNCP(=O)(O)O)CCC2)cc1	1791434304	QKGWPBBEKTYCOF-LLVKDONJSA-N	448.254	1.629	50	20	IDGD	
COc1ccc([C@H](O)C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@](C)(Cl)CCl)C3)cc1	1792715643	JIFSDVOTALNITD-BXNDMCELSA-N	445.343	1.555	50	20	IDGD	
CCOC(=O)[C@@H]1CCC[C@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](Cl)CC)C3)C1	1792959483	WDEHDYBVGAWIQR-ZKZVPCBQSA-N	428.957	1.963	50	20	IDGD	
C[C@H](CBr)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CNC(=O)C(F)(F)F)C2	1792993494	KYGQJBQVVZBSCU-CHWFTXMASA-N	428.249	1.334	50	20	IDGD	
O=C(CCCn1c(O)nc2ccccc21)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCl	1793115505	PTZYPPRURUCFAC-BASYENTBSA-N	434.924	1.760	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](C)n1ccnc1	1793319475	NXKHDSYBRQNMHW-UFYZLLATSA-N	425.493	1.216	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cc([N+](=O)[O-])ccc1F	1793810163	XWDZTVBKWHFZKY-HRJSJKBJSA-N	427.860	1.883	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@](C)(Cl)CCl)C3)n1	1794280401	KBIHSOWTMRRMNS-AODNKKSCSA-N	443.331	1.480	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)nc2ccccc12	1796915813	CQYKAVKQDBPUQF-JWXAPSBJSA-N	448.317	1.927	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@]1(F)CCCCC1(F)F)c1cccc(B(O)O)c1	1797797850	NJUXIBKLNWZPNV-AXVVYFOYSA-N	438.255	1.536	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnc(Cl)s1)C2	1798439885	MYWWRYWZNQJVHL-JGPRNRPPSA-N	434.909	1.361	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CCCN(C)C1	1799892754	BREQVCPQROYSEK-UONOVLGTSA-N	428.537	1.100	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](CCN)NC(=O)OC(C)(C)C)C2	1800070334	CUYDLQLACFDQIO-YIDVYQOGSA-N	430.977	1.884	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nnc(-c3ccccc3)o1)C2	1800759541	UPOJIIXRKBJUOR-MHEUCROKSA-N	449.305	1.723	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H]2Cc3ccccc3N2)[C@@H]1c1cccnc1)[C@H](O)CCl	1803148647	VUMSNSTYJYCXDN-IJXRJRJASA-N	428.920	1.724	50	20	IDGD	
Cc1cc(C(=O)NC[C@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)cn1C	1808731143	SAEOOZJINIVZPV-GCJKJVERSA-N	440.548	1.421	50	20	IDGD	
Cc1cccc(CCC(=O)N2CCC3(CCCN(C(=O)c4cccc(B(O)O)c4)C3)CC2)n1	1809975013	NQGJWEGUNLAJOB-UHFFFAOYSA-N	449.360	1.547	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)c3cccn4ccnc34)CC2)C1	1809978667	JQOIMIASLMJJOZ-UHFFFAOYSA-N	446.316	1.173	50	20	IDGD	
C[C@H](Cn1cncn1)C(=O)NC[C@H]1CCN(C(=O)C(Cl)Cl)[C@H]1c1cccnc1	1810480027	LWVYWRZTIPWUNY-YUELXQCFSA-N	425.320	1.819	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc3nc(CO)[nH]c3c2)[nH]n1)[C@@H](O)CCl	1814871244	LLPSAQYSJFFNGV-CVEARBPZSA-N	446.895	1.684	50	20	IDGD	
CC(C)Cc1cc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@H](O)CCl)CC3)n(C)n1	1815992831	GNJSCAQRXOXQCV-IAQYHMDHSA-N	439.969	1.901	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)CS(=O)(=O)N2CCCC2)[nH]n1)[C@H](F)Cl	1818037151	GDSVIKHLMDFUDO-DOMZBBRYSA-N	435.909	1.362	50	20	IDGD	
O=C(CS[C@@H]1CCCCO1)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)CCl)CC2	1819860235	DXNYYJXKRQOPHQ-IFUGULHKSA-N	433.983	1.915	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1)c1nc2ccc(F)cn2n1	1821595179	AJADXGSEGIBLPW-CHWSQXEVSA-N	435.847	1.497	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(OC)n(C)n3)sc2C1	1821777615	GEWUERLJMKQQOI-NXEZZACHSA-N	427.914	1.365	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(=O)oc2)[nH]n1	1822412959	LRFIKGOANXKGAM-HNNXBMFYSA-N	430.465	1.042	50	20	IDGD	
COC(=O)NCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](C)CBr)[nH]n1	1822620458	WHRBUERJJBXFGG-PWSUYJOCSA-N	430.303	1.789	50	20	IDGD	
Cc1nnc(CC(=O)N[C@H]2CCc3nc(NC(=O)[C@@H](C)Br)sc3C2)o1	1825640454	AHYMHRKUIWVICE-APPZFPTMSA-N	428.312	1.773	50	20	IDGD	
C[C@@H](NC(=O)OC(C)(C)C)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](O)CCl)CC2	1825810367	QAFXXFZWXGGBBG-SCVCMEIPSA-N	446.957	1.568	50	20	IDGD	
CSCC[C@H](O)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](F)Br)CC2	1826134306	ZKGGVHZGPDUCIV-ARENWVFISA-N	440.360	1.860	50	20	IDGD	
CN[C@H](CC(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@H](F)Br)CC1)C(=O)O	1826946776	ZFYYDGQIFQYNQB-IPYPFGDCSA-N	436.322	1.359	50	20	IDGD	
O=C(/C=C/c1ccco1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827049953	AFSSYTJCBKFLQA-NEQMZLFVSA-N	436.317	1.906	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)n2)CC1	1827600941	HGVHGCMEMTZKJF-MRXNPFEDSA-N	436.585	1.973	50	20	IDGD	
N#Cc1ccccc1OCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](O)CCl)CC2	1828025771	STQRKWROECHSLI-JSGCOSHPSA-N	434.905	1.605	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(C)=O)CCN2C(=O)OCc2ccccc2)C1	1828894062	BMMRRNXSPTULBR-NQIIRXRSSA-N	437.924	1.712	50	20	IDGD	
CC(C)O[C@@H](C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1	1829021487	KBBZRQVSYQJEKY-OXJNMPFZSA-N	445.564	1.732	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(Cl)nc3)CCO2)C1	1829511788	FOEPRJKJRYYNGH-PXAZEXFGSA-N	446.729	1.588	50	20	IDGD	
O=C([C@H]1CCC(F)(F)C1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1829654813	AIPSCNBUSDCWID-SLEUVZQESA-N	443.260	1.569	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830366505	RFYUUUXGLZOTHM-DYVFJYSZSA-N	439.778	1.881	50	20	IDGD	
Cc1cnc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)s1	1830535976	WANHKYKVQZXWEC-SJKOYZFVSA-N	446.367	1.553	50	20	IDGD	
Cc1ncc(CC(=O)N2CCCC[C@@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)s1	1832180605	YJGJXBMIBASXCZ-LJQANCHMSA-N	449.621	1.987	50	20	IDGD	
O=C([C@@H](F)Br)N1CCOC[C@]2(C1)CN(C(=O)C(F)(F)C(F)F)CCO2	1832190360	VYFIATIQDPSREL-PELKAZGASA-N	439.175	1.034	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)Cc3cnc4ccccn34)CC2)CC1)[C@@H](O)CCl	1833306002	IQOYQLFAAJDOHQ-IBGZPJMESA-N	447.967	1.048	50	20	IDGD	
Cc1c(F)cccc1C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)CCl)CC2)CC1	1833306452	RSFQFFOIPLTFMP-LJQANCHMSA-N	425.932	1.919	50	20	IDGD	
C[C@@H]1CCc2c(C(=O)N3CCC(N4CCC(NC(=O)[C@H](O)CCl)CC4)CC3)n[nH]c21	1833310291	PDDFLIWDGVPOMU-CXAGYDPISA-N	437.972	1.244	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)[C@H](C)Cn3cncn3)CC2)CC1	1833534067	ZYJVAGNVYUWWIV-VQIMIIECSA-N	439.004	1.893	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccccc3O)CCO2)C1	1833758148	OOHVDXFXCGFRCR-OALUTQOASA-N	431.316	1.699	50	20	IDGD	
Cc1cc(C(=O)N2CCC(N3CCC(NC(=O)CCBr)CC3)CC2)on1	1834421055	AYPSKAWQBMNNEE-UHFFFAOYSA-N	427.343	1.953	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)C(=O)c3ccccc3)CCO2)C1	1834708246	YECZLQSKORPZLH-KUHUBIRLSA-N	439.306	1.109	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)CCc3cncnc3)CC2)CC1	1834845024	BOEZTOOFGSJXKJ-IBGZPJMESA-N	437.972	1.235	50	20	IDGD	
N#CCCC(=O)N1CCO[C@@]2(COCCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1	1835361977	ASJFGNZWVAZMPP-BPNKPRMTSA-N	444.438	1.632	50	20	IDGD	
C=CC(=O)N[C@@H](C)C(=O)NC1CCN(C2CCN(C(=O)CO[Si](C)(C)C)CC2)CC1	1835830841	RGZLTTYEYZVRNV-INIZCTEOSA-N	438.645	1.100	50	20	IDGD	
Cc1cc(C(=O)NC2CCN(C3CCN(C(=O)[C@H](O)CCl)CC3)CC2)n(C(F)F)n1	1836163043	ADAYDTIQZKIENN-MRXNPFEDSA-N	447.914	1.372	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccn4ccnc4c3)CCO2)C1	1836982774	RXRNQXXNNXOVGR-UTKZUKDTSA-N	434.924	1.812	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)Nc1cnccn1)CCO2	1837477961	TZEHTRGTRSZGMI-TWOQFEAHSA-N	439.944	1.141	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4c(c3)NC(=O)CC4)C2)C1	1839147857	FATGXKQBVNKAMU-JTSKRJEESA-N	449.935	1.659	50	20	IDGD	
Cc1onc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)c1C	1839150341	JQZUFFXHEJQWCE-QZTJIDSGSA-N	434.320	1.598	50	20	IDGD	
CN1CCC[C@H](C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)C1	1839154283	JEHSDCJYCKDNPH-KFKAGJAMSA-N	436.380	1.021	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3n[nH]c4cccc(F)c34)CCO2)C1	1839599643	VXDBZLPBAHDSHJ-ZUOKHONESA-N	438.887	1.789	50	20	IDGD	
Cc1nc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)ccc1F	1840031038	DNHRHVKAKPYXBC-KZULUSFZSA-N	444.301	1.383	50	20	IDGD	
O=C(c1ccc2c(c1)CCCO2)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1840659761	KVVQFNWRDJNKTR-FXAWDEMLSA-N	426.872	1.616	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC2(CCCN2C(=O)c2cnc3cc(C)ccn3c2=O)C1	1843788070	SSBNXTUMYLWGLY-HNNXBMFYSA-N	447.333	1.993	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](C(=O)N2CCCC23CN(C(=O)C(Cl)Cl)C3)C1	1845108865	VOLYMNSQYRBTFM-NWDGAFQWSA-N	436.336	1.221	50	20	IDGD	
O=C(COCCO)N1CC2(CCCN2C(=O)[C@H](Br)Cc2ccccc2)C1	1845942191	QMERQQOQDKRFKN-MRXNPFEDSA-N	425.323	1.205	50	20	IDGD	
CC(C)(NC(=O)c1ccc(Cl)s1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl	1847565056	GUIZPZJWQSKMNR-SDDRHHMPSA-N	448.372	1.711	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)Cc1ccc2ncccc2c1	1847953607	QYNZRNCDVRHOEN-SFTDATJTSA-N	444.495	1.291	50	20	IDGD	
Cc1cc(CC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)on1	1848095681	MPSIPLFPBCGMIQ-JYJNAYRXSA-N	440.928	1.859	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)[C@@H]1CC(=O)Nc2cc(F)ccc21	12936224	YJCHRMGYLKKCIH-CYBMUJFWSA-N	449.822	1.918	50	20	IDGD	
CS(=O)(=O)Nc1cccc(C(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)c1	21167063	UAWSAXJRZNGXME-UHFFFAOYSA-N	425.850	1.330	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2ccc(OC(C)C)c(OC)c2)ccc1OCC(N)=O	24154534	PMMYPLKCDZIZJI-UHFFFAOYSA-N	431.445	1.430	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)c(C)c1	105662265	LKXCRYGQQRWFPA-UHFFFAOYSA-N	433.530	1.713	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(C(=O)CNC(=O)NNC(=O)CCCc2ccccc2)CC1	727843545	DMIYSIIVPMXVIX-UHFFFAOYSA-N	447.536	1.419	50	20	IDGD	
CC(C)Oc1cccc(CC(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1	728334695	ZZBWORXXYSOGTI-IBGZPJMESA-N	428.441	1.547	50	20	IDGD	
C[C@@]1(C2CC2)NC(=O)N(CC(=O)NNC(=O)c2cc(F)ccc2Br)C1=O	728548548	IITZHZNVWWBMAT-INIZCTEOSA-N	427.230	1.070	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CS(=O)(=O)Nc2ccc(N3CCCCC3)cc2)c1	728871035	MYNSYICVDBMFFQ-UHFFFAOYSA-N	441.513	1.751	50	20	IDGD	
CS(=O)(=O)c1ccc(OCCNC(=O)NNC(=O)c2cccc(OC(F)F)c2)cc1	730066026	BPYQVSBJTLTPDT-UHFFFAOYSA-N	443.428	1.715	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCCC2)cc1)NNC(=O)COc1ccccc1O	730780967	ABXAQOGOKZRTGW-UHFFFAOYSA-N	447.513	1.336	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NC[C@H]2CCCN2C(=O)OC(C)(C)C)c2ccccc2c1=O	730908666	FCKJCAFNCLSQAZ-CYBMUJFWSA-N	444.492	1.277	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CCN2C[C@H](C)O[C@H](C)C2)ccc1OCc1cscn1	732263997	QSDOUDAMEDMWLN-GASCZTMLSA-N	448.545	1.991	50	20	IDGD	
Cc1ccc(-n2c(NNC(=O)CC[C@H]3NC(=O)NC3=O)nc3ccccc3c2=O)c(C)c1	733264886	GHGDARKGXZITHF-MRXNPFEDSA-N	434.456	1.434	50	20	IDGD	
O=C(NCCN1C(=O)CNC1=O)C(=O)Nc1ccccc1S[C@H](Cl)C(F)(F)F	733671446	VEZRHLTXHFRCOE-ZDUSSCGKSA-N	438.815	1.512	50	20	IDGD	
CC(=O)NCC(=O)N1CCc2cc(C(=O)NNC(=S)Nc3ccc(C)cc3C)ccc21	735704353	YTISPJFOTOTWPH-UHFFFAOYSA-N	439.541	1.960	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cc(N3CCNC3=O)ccc2F)cc(OC)c1OC	737767064	PVUWMXRDGXQDOM-UHFFFAOYSA-N	432.408	1.456	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccccc2CSc2nc[nH]n2)c1	737792534	OPBVZGITOJDRQZ-UHFFFAOYSA-N	431.499	1.575	50	20	IDGD	
N#Cc1ccc(C(=O)NNS(=O)(=O)c2cccc(I)c2)cc1	739668836	UEOGLKZCPUTWNN-UHFFFAOYSA-N	427.223	1.786	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1cc(O)nc2cc(F)ccc12	739681069	SRQPPXQYOYBLFM-UHFFFAOYSA-N	431.449	1.756	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1cccc(NC(=O)N(C)C)c1	739681121	UHONKCPYZACYHP-UHFFFAOYSA-N	432.506	1.456	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2cnc(-c3ccncc3)s2)ccc1Cl	741661726	GIGYVVTXVKEZJI-UHFFFAOYSA-N	437.890	1.581	50	20	IDGD	
Cc1ccc(S(=O)(=O)NNC(=O)c2ccccc2)cc1S(=O)(=O)N1CCCCC1	743252292	VGHCOLVGZYWNGG-UHFFFAOYSA-N	437.543	1.793	50	20	IDGD	
COC(=O)c1cn(CC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c2ccccc12	743900903	ODGFNYWLEZRGHC-UHFFFAOYSA-N	433.424	1.136	50	20	IDGD	
O=C(NCCN1CCN(c2ccc(F)cc2)CC1)NNC(=O)c1cc([N+](=O)[O-])ccc1O	745520156	XNQYFHSEPMTWOR-UHFFFAOYSA-N	446.439	1.206	50	20	IDGD	
COc1cc(C)nc(NNC(=O)[C@H](CCSC)NS(=O)(=O)c2ccc(C)cc2)n1	746630116	FOZNWDKRRRPCLK-HNNXBMFYSA-N	439.563	1.645	50	20	IDGD	
O=C(CCOc1ccccc1)NNS(=O)(=O)c1cc(C(=O)O)sc1Br	747076351	BWOVUFPBCIZEEP-UHFFFAOYSA-N	449.304	1.987	50	20	IDGD	
O=C(Cn1c(=O)nc(O)c2ccccc21)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1	749283942	JWLYIVFIDHIPJK-UHFFFAOYSA-N	442.375	1.539	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)CCN2CCN(CC)CC2)c2ccccc2c1=O	750663068	LGTPUBMMHUQOKS-UHFFFAOYSA-N	442.564	1.375	50	20	IDGD	
Cc1oc(S(=O)(=O)N(C)C)cc1C(=O)NNC(=S)Nc1ccc(N(C)C)cc1	753427218	BJIHKNQWNGENLA-UHFFFAOYSA-N	425.536	1.536	50	20	IDGD	
O=C(NNc1ccc(C(F)(F)F)nn1)c1ccc(S(=O)(=O)N2CCOCC2)cc1	755181533	VVYGJDGRLVXWRB-UHFFFAOYSA-N	431.396	1.273	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCCCC2)cc1NC(=O)NNC(=O)c1ccncc1	755413776	YWUGNADGNOHSIV-UHFFFAOYSA-N	433.490	1.731	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)Nc1ccccc1CN1C(=O)CCC1=O	756221812	QSHVALPVMJQCNV-UHFFFAOYSA-N	440.456	1.966	50	20	IDGD	
CCOC(=O)C1CCN(C(=O)c2ccc(NC(=O)NNC(=O)c3ccc[nH]3)cc2)CC1	756681408	IYVBNXSAFAGFOL-UHFFFAOYSA-N	427.461	1.897	50	20	IDGD	
COC(=O)c1cc(NC(=O)NNC(=O)c2ccc3ccccc3n2)cc(S(C)(=O)=O)c1	757674367	SCVBFSWDUTUKJT-UHFFFAOYSA-N	442.453	1.891	50	20	IDGD	
Cc1nc(C(=O)N2CCN(S(=O)(=O)CBr)CC2)nn1-c1ccc(F)cc1	758526320	BJXUWWRBNBTNMH-UHFFFAOYSA-N	446.302	1.155	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1cc2ccccc2nc1Br	760152969	MTZZRWPIGXJREO-MRVPVSSYSA-N	430.284	1.088	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)NCCNS(=O)(=O)NC(C)C)c(C)n1C[C@H]1CCCO1	760641241	NTRVYTCNEQWQPH-WAGPWIPHSA-N	437.566	1.140	50	20	IDGD	
O=C(NN=C1CCOc2c1cc(Br)cc2[N+](=O)[O-])N[C@@H]1CCS(=O)(=O)C1	761811962	KNLRTUJJEHEAEN-SECBINFHSA-N	447.267	1.330	50	20	IDGD	
CN1CCC(=O)Nc2cc(C(=O)OCC(=O)NNC(=O)c3ccc(Cl)cc3)ccc21	762902634	FXOCHJADPJCMTQ-UHFFFAOYSA-N	430.848	1.736	50	20	IDGD	
CCOC(=O)N1CCN(C(=O)COC(=O)/C(C#N)=C/c2cc(C)n(CCOC)c2C)CC1	763282337	CAKIKXAFRLHALL-CPNJWEJPSA-N	446.504	1.502	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(-c2nnc3n2CCCC3)cc1	763442161	MWXLBRHFXKPCKG-UHFFFAOYSA-N	449.427	1.589	50	20	IDGD	
Cc1cccc(NC(=O)C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c1Cl	763528773	AASIIEWBWJZSJI-UHFFFAOYSA-N	443.935	1.947	50	20	IDGD	
COCCOc1cc(NC(=O)C(=O)NNC(=O)c2c(C)nc3ccccn23)ccc1OC	763628350	IUTLXERPCKMEKA-UHFFFAOYSA-N	441.444	1.076	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1ccc(N2CCOC[C@H]2C)cc1	763628729	LVOBFMZJFIWPIF-CQSZACIVSA-N	436.472	1.268	50	20	IDGD	
CN1CCc2ccc(NC(=O)C(=O)NNC(=O)COc3ccc(Cl)cc3)cc2C1=O	763686763	TXOINZDKARMSJZ-UHFFFAOYSA-N	430.848	1.133	50	20	IDGD	
CCn1ncc2ccc(NC(=O)C(=O)NNC(=O)COc3ccccc3[N+](=O)[O-])cc21	763803974	QBOLADWPOHEXNX-UHFFFAOYSA-N	426.389	1.129	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccc(C(=O)N2CCCC2)cc1	763865034	HMKCOBMZUANGQO-CQSZACIVSA-N	442.447	1.615	50	20	IDGD	
Cc1cccc(Cn2nccc2NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)c1	763872560	OJWOHJRQVGDEFM-HNNXBMFYSA-N	439.447	1.932	50	20	IDGD	
CS(=O)(=O)c1ccc(OCCCC(=O)NNC(=O)CSc2ccccc2O)cc1	764045862	UBSUTQAXRYTZCU-UHFFFAOYSA-N	438.527	1.894	50	20	IDGD	
CC(C)n1nnnc1-c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)nc2)cc1F	764091384	DDGLEGYGOUBMGA-UHFFFAOYSA-N	446.830	1.508	50	20	IDGD	
CC(C)n1nnnc1-c1ccccc1NC(=O)C(=O)NNC(=O)c1ccc(Cl)cc1O	764124443	HHFCZFOKVFLRJX-UHFFFAOYSA-N	443.851	1.680	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2ccc(C)c(S(C)(=O)=O)c2)cc1	764127414	SXJHKPKBZSWQDW-UHFFFAOYSA-N	433.486	1.126	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(F)c(C(=O)OC)c2)o1	764139476	UGIABICCAUWRTR-UHFFFAOYSA-N	434.424	1.447	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)NCc3ccccc3)cc2)c1	764238582	WMPJFAMHIRHEQW-UHFFFAOYSA-N	441.447	1.888	50	20	IDGD	
Cc1ncsc1C(=O)NNC(=O)C(=O)Nc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1	764246833	ROHQUBKNQKHGKX-PHIMTYICSA-N	435.481	1.604	50	20	IDGD	
Cc1ncsc1C(=O)NNC(=O)C(=O)Nc1cc(Br)ccc1-n1cccn1	764247087	UIEOSPBZMYHSQT-UHFFFAOYSA-N	449.290	1.799	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)C(=O)Nc1ccc(N2CCCC2=O)c(F)c1	764280856	GWXAPBKKVWRJOX-UHFFFAOYSA-N	428.420	1.377	50	20	IDGD	
CC(C)OC(=O)NCc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccccc2F)cc1	764319855	BZSXUPLKKIOYFS-UHFFFAOYSA-N	430.436	1.789	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1cc(Br)cc(OC(C)C)c1	764398087	CQPPIPFRPUJUQF-LLVKDONJSA-N	446.298	1.374	50	20	IDGD	
O=C(CSc1nnc(O)nc1O)NN=Cc1cc(Br)cc2c1OCC2	764905231	JGBCHUGRHLXHIY-UHFFFAOYSA-N	426.252	1.223	50	20	IDGD	
Cc1oc(C(=O)NNC(=O)CSc2ccccc2O)cc1S(=O)(=O)N1CCCC1	765247899	DEHRACBPZDAQOQ-UHFFFAOYSA-N	439.515	1.631	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)CCn3nnc4ccccc4c3=O)n[nH]2)c1	765577973	ZIZRCQBSRNEIMR-UHFFFAOYSA-N	431.456	1.650	50	20	IDGD	
O=C(CN1C(=O)NC2(CCCCC2)C1=O)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	765607408	NRFJHGMMISEECL-UHFFFAOYSA-N	428.424	1.232	50	20	IDGD	
O=C(NCCc1nc2c(s1)CCCC2)NNC(=O)c1csc(N2CCOCC2)n1	765642659	INRPPUAFXYNBSB-UHFFFAOYSA-N	436.563	1.502	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NCc1ccc(O)c(Br)c1	765733656	OXVHYRQZFAZKKI-UHFFFAOYSA-N	427.280	1.477	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)c1n[nH]c2ccccc12	765758712	PCIMLIKFVUSHJH-UHFFFAOYSA-N	426.908	1.795	50	20	IDGD	
CN1CCO[C@H]([C@@H](NC(=O)NN[C@]2(C)CCS(=O)(=O)C2)c2ccc(Cl)cc2)C1	766319481	LVDVNCZDFSOVHJ-XYJFISCASA-N	430.958	1.093	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)N2CCN(C(=O)[C@H]3CCCN3C)CC2)c1C	766345249	HXQYBRYXWRATJF-LSSXRZCCSA-N	427.549	1.423	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(F)cc2C(=O)N(C)C)c1C	768237521	MBSYGEQKXNZTIN-AWEZNQCLSA-N	444.463	1.698	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](OCC(=O)NNc2nccc(N3CCOCC3)n2)C1	768242297	ANCUTUBQFWNXOQ-HNNXBMFYSA-N	436.513	1.172	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)[C@@H]3CCCN(C(=O)C4CC4)C3)n[nH]2)cc1OC	768278482	HJRHVRCXTFMMNX-OAHLLOKOSA-N	441.488	1.504	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)CNC(=O)c1ccc([N+](=O)[O-])c(C)c1	768635109	VOIAYEXIGXVORH-UHFFFAOYSA-N	436.446	1.188	50	20	IDGD	
CCOc1ccccc1N1C[C@@H](C(=O)NNc2c(OC)cccc2S(C)(=O)=O)CC1=O	768640174	XSUSXIFITZLMSG-AWEZNQCLSA-N	447.513	1.994	50	20	IDGD	
CN(CCCC(=O)NNc1cc(C#N)cc(Cl)n1)C1=NS(=O)(=O)c2ccccc21	768700526	AWFZXTSBCPHGKU-UHFFFAOYSA-N	432.893	1.911	50	20	IDGD	
CC(=NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1ccccc1N(C)C	769567155	ODFQUGQHIBKJCQ-UHFFFAOYSA-N	430.530	1.928	50	20	IDGD	
CCS(=O)(=O)N1CCC(C(=O)NNC(=S)NCCSC)(c2ccccc2)CC1	770245471	OBSYIGMDCFALBY-UHFFFAOYSA-N	444.648	1.228	50	20	IDGD	
Cc1cccc([C@H](CNC(=O)NNc2nc(O)c3cnn(C)c3n2)N2CCOCC2)c1	770342679	VLWAYADGXLXIMV-INIZCTEOSA-N	426.481	1.077	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)CCn1c(C)nc2ccccc21	771887076	ALKGFJBVYWVZGQ-UHFFFAOYSA-N	428.518	1.798	50	20	IDGD	
Cc1ccc(S(=O)(=O)n2ccc(C(=O)O[C@H](C)C(=O)NNC(=O)CC(C)C)c2)cc1	772138487	VOAIWVXGQQCHDD-OAHLLOKOSA-N	435.502	1.772	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)[C@@H](C(C)C)N2CCCS2(=O)=O)cc1	772631413	RIZQCXCIWHJASP-WMLDXEAASA-N	427.523	1.060	50	20	IDGD	
N#Cc1ccc(NNC(=O)C(=O)Nc2cccc(S(=O)(=O)N3CCCCC3)c2)cc1	773702577	WKERJIVKWQMJNC-UHFFFAOYSA-N	427.486	1.815	50	20	IDGD	
CS(=O)(=O)Nc1ccc(OCCNC(=O)NNC(=O)Cc2ccc(Cl)cc2)cc1	773779586	LSXNMHXKWQTOFN-UHFFFAOYSA-N	440.909	1.663	50	20	IDGD	
CC(C)c1nccnc1NNC(=O)C(=O)Nc1ccc(C(=O)N2CCOCC2)c(Cl)c1	774000481	WRWCXUGZMKWCTJ-UHFFFAOYSA-N	446.895	1.808	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccc([S@](C)=O)c(F)c1	774010414	VJMPZNBCXLBBLN-UIHBWLLHSA-N	441.868	1.770	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)NCc2cnn(-c3ccc(Br)cc3)c2)n1	775207669	WDIPXABNFYSKNW-UHFFFAOYSA-N	446.309	1.979	50	20	IDGD	
Cc1nc(C)c(CCC(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)c(O)n1	776205081	JKHGAKWTCNIZLU-UHFFFAOYSA-N	436.513	1.367	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)NCCc2ccc(OCC(=O)NC3CC3)cc2)c1	776612152	FVYBBKIPNVATTE-UHFFFAOYSA-N	446.529	1.616	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)CC(=O)NNc2cccc(S(C)(=O)=O)c2)cc1F	776714364	AIYRQWCACUBROK-UHFFFAOYSA-N	428.463	1.349	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)CCc2c(C)nc(-c3cccnc3)nc2O)nc1C	778430298	ZDIDJIUKSUGOJO-UHFFFAOYSA-N	437.460	1.904	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)CN2C(=O)Cn3c(cc4ccccc43)C2=O)nc1C	778430644	WTEKCDWWPGSQFX-UHFFFAOYSA-N	436.428	1.042	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNS(=O)(=O)c1ccc(NC(=O)c2ccncc2)cc1	779843748	JRIXEWMXNCBJST-UHFFFAOYSA-N	449.489	1.168	50	20	IDGD	
N#Cc1ccc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)nc1	780654483	HBRRHGWVOXTFMB-UHFFFAOYSA-N	442.501	1.272	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2cc(S(=O)(=O)C(F)(F)F)ccc2OC)nc1	782145260	OXSUUWWNQLYCNY-UHFFFAOYSA-N	448.379	1.474	50	20	IDGD	
CCCCNS(=O)(=O)c1cccc(NC(=O)C(=O)NNc2ncncc2Cl)c1	782165332	GXQKKAAJVQXUCD-UHFFFAOYSA-N	426.886	1.290	50	20	IDGD	
O=C(NNc1cccc(F)c1)C(=O)Nc1ccc(N2CCN(C(=O)C3CC3)CC2)nc1	783042517	BHUUUZZVGXWUSM-UHFFFAOYSA-N	426.452	1.361	50	20	IDGD	
O=C(NNc1ncccc1C(F)(F)F)C(=O)Nc1cccc(N2CCCS2(=O)=O)c1	783119871	LVVLCEZSNQXDBC-UHFFFAOYSA-N	443.407	1.722	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(NC(=O)C(=O)NNc2ccc(C)nn2)ccc1Cl	783953785	ZRKPGJHQYKMPJU-UHFFFAOYSA-N	440.913	1.551	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)C(=O)Nc1ccc(OCc2cccnc2)cc1	785068563	WZSBSIRTJCBJAN-UHFFFAOYSA-N	444.451	1.637	50	20	IDGD	
Cc1cc(-c2nc3cc(F)ccc3n2C)ccc1NC(=O)C(=O)NNc1nccn(C)c1=O	785089896	IABYDUXHXIOVBZ-UHFFFAOYSA-N	449.446	1.863	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNc2c(OC)cccc2S(C)(=O)=O)ccc1F	785330139	FESIRDXHWXEJHX-UHFFFAOYSA-N	439.421	1.106	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCOCC2)cc1NS(=O)(=O)CCCCCl	788048178	XRCKZOIVVYPIHR-UHFFFAOYSA-N	426.944	1.477	50	20	IDGD	
COc1ccc(C(=O)NNc2ccccc2S(N)(=O)=O)c(I)c1	788229143	UARJHQPHIGUMJH-UHFFFAOYSA-N	447.254	1.704	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1)NOC[C@H]1CCOC1	788326955	UYMOHLDZSQEWLN-INIZCTEOSA-N	448.501	1.077	50	20	IDGD	
CCc1c(C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cnn1C1CCCC1	789734948	JYRRRJFXCQVWLJ-UHFFFAOYSA-N	447.561	1.951	50	20	IDGD	
COC(=O)c1c(F)cccc1NC(=O)C(=O)NNC(=O)[C@H]1OCC[C@H]1c1ccccc1	789810213	LEJPZILTFVFCMM-GUYCJALGSA-N	429.404	1.271	50	20	IDGD	
Cn1ccnc1-c1cccc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)c1	789813155	QMJSLBRPKTXFQA-OALUTQOASA-N	433.468	1.746	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)N[C@@H](CO)c1ccc(Cl)cc1C(F)(F)F	792886194	YXKZBWXNDAIQDL-LBPRGKRZSA-N	448.785	1.746	50	20	IDGD	
O=C(COc1cccc(C(F)(F)F)c1)NNC(=O)C(=O)Nc1cnc(CC2CC2)nc1	793023300	LMIPZALRDYOWHX-UHFFFAOYSA-N	437.378	1.613	50	20	IDGD	
C[C@H](C(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)[C@H]1OCCc2sccc21	796509267	UFDNTVQSCDIDMQ-APPDUMDISA-N	433.442	1.911	50	20	IDGD	
O=C(COC(=O)c1ccc(Br)cc1)NNC(=O)[C@@H]1COc2ccccc2O1	797606149	BOPLTYYBKCONGP-HNNXBMFYSA-N	435.230	1.593	50	20	IDGD	
Cc1ccc(N2CCOCC2)cc1NC(=O)NNC(=O)COc1ccccc1[N+](=O)[O-]	797689226	LXEQCHNUTYBFCI-UHFFFAOYSA-N	429.433	1.972	50	20	IDGD	
O=C(NCC(F)(F)F)NNC(=O)[C@@H]1CCCN1C(=O)c1ccc(Br)cc1	798313581	JLRBAOQCZSGPOX-NSHDSACASA-N	437.216	1.946	50	20	IDGD	
COc1ccccc1-n1ncc(C(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)c1C	798990542	XGEDPMDDHOMLFN-UHFFFAOYSA-N	441.875	1.920	50	20	IDGD	
COc1nccnc1NNC(=O)Nc1cc2c(cc1N1CCCCC1)n(C)c(=O)n2C	800593263	YOIFVECPFUAZTK-UHFFFAOYSA-N	426.481	1.815	50	20	IDGD	
CN(CCc1cccc([N+](=O)[O-])c1)C(=O)NNC(=O)CNC(=O)OCc1ccccc1	801060054	WCWFDAZTBCUFRX-UHFFFAOYSA-N	429.433	1.736	50	20	IDGD	
O=C(Cn1c(=O)ccn(Cc2ccccc2)c1=O)NNC(=O)Nc1ccc(Cl)cc1	802023417	MHNDJDKZCRGDGN-UHFFFAOYSA-N	427.848	1.565	50	20	IDGD	
Cc1cc(C)c(S(=O)(=O)N2CCC(C(=O)NNC(=O)N=c3cc[nH]cc3)CC2)c(C)c1	802026666	UVSBYWUCOZQFOB-UHFFFAOYSA-N	445.545	1.682	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H]2CCc3ccccc3OC2)c1	802403159	CIOPLALXVHNFHQ-MRXNPFEDSA-N	432.502	1.275	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)C(=O)Nc1ccc(OC(F)F)c2ncccc12	807429271	QUOIRYWBONSQEY-UHFFFAOYSA-N	440.370	1.894	50	20	IDGD	
CCCNC(=O)[C@@H]1CN(C(=O)C(=O)NNc2nccnc2C2CCC2)c2ccccc2O1	807460163	LGIXYDQVIBHJHI-KRWDZBQOSA-N	438.488	1.508	50	20	IDGD	
CC(C)c1ccc(S(=O)(=O)c2ccc(NNC(=O)NCC(=O)NCC#N)cc2)cc1	807553065	LKRVKRRLNSHKBR-UHFFFAOYSA-N	429.502	1.909	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NCc1ccncc1OC[C@H]1CCOC1	807614842	ADDDEONDZPJZFT-GJZGRUSLSA-N	432.452	1.934	50	20	IDGD	
CC(=O)N1CCc2ccccc2[C@@H]1CC(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	812728405	LGQFDBKXNPNSBP-FQEVSTJZSA-N	430.530	1.916	50	20	IDGD	
Cc1c(C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)nnn1Cc1ccc(F)cc1	812728762	YODFOCXUVYRCFD-UHFFFAOYSA-N	432.481	1.781	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)NC[C@@H]1CCN(c2ccccc2F)C1	813206019	ZMOBIIXDZJPWGZ-AWEZNQCLSA-N	431.424	1.970	50	20	IDGD	
Cc1cc(OCc2ccc(C(=O)NNC(=O)C(=O)Nc3cn(C)nn3)cc2)ccc1Cl	815564614	NZWRPCNSLZISAY-UHFFFAOYSA-N	442.863	1.756	50	20	IDGD	
COC[C@H](C)NS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2cccc(Cl)n2)cc1	815726939	AVASJOILXDRBDI-NSHDSACASA-N	441.897	1.130	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1ccccc1O[C@H]1CCOC1	815752115	CYZUEWCNGDIBKU-AWEZNQCLSA-N	448.501	1.186	50	20	IDGD	
CCOc1ccc(NNC(=O)C(=O)Nc2ccc(OC)c(S(=O)(=O)NC3CC3)c2)cc1	815817287	LTYKVIXRFHVJGX-UHFFFAOYSA-N	448.501	1.616	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)[C@@H](CC(N)=O)NC(=O)CC(C)C)c1	818750033	BMVYQTCMFNTGNE-CYBMUJFWSA-N	443.298	1.085	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)Cc1cnn(-c2ccccc2)c1	818806957	IEKSJMVFLMLCEH-UHFFFAOYSA-N	432.528	1.775	50	20	IDGD	
O=C(COC(=O)c1ccc(NC(=O)C2CC2)cc1)NNC(=O)c1cccc([N+](=O)[O-])c1	819512399	QNNLHPYHPWQCMW-UHFFFAOYSA-N	426.385	1.561	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)C[C@H](NC(C)=O)c1ccc(Br)cc1	819727810	LDYKXNIEBCUKSF-HNNXBMFYSA-N	444.326	1.953	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)c2cc(Cl)c(OCC(N)=O)c(OC)c2)c1	825810167	IHJHQTJZCQIWKJ-UHFFFAOYSA-N	436.852	1.094	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cccc1[N+](=O)[O-]	912642949	QECOBNIBEWEVNS-UHFFFAOYSA-N	432.458	1.763	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)[C@@H]1CCCN(C(=O)Cc2ccccc2)C1	914880805	YIGLBOZSVJDXCB-GOSISDBHSA-N	425.485	1.703	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)NCc1ccccc1CN1CCOCC1	915926752	BWRWZOJXPHDFQC-UHFFFAOYSA-N	426.517	1.991	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(Cl)cc1C(F)(F)F)c1ccc(-n2cnnn2)cc1	916105933	XCTGHMFMONFHJK-UHFFFAOYSA-N	446.798	1.958	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NCC[C@](O)(c2nccn2C)C(F)(F)F)cc1C	916378646	RMNPEYFZPCBJSP-SFHVURJKSA-N	443.426	1.586	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)N(C)CC(=O)N2CCN(C)CC2)c(C)n1C[C@H]1CCCO1	916558346	LHYCMMCJUYYSEC-NNVROAHOSA-N	427.549	1.423	50	20	IDGD	
CCNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cc(-c3ccc(C)cc3)[nH]n2)cc1	917178029	FTBLEWPGAHLMPH-UHFFFAOYSA-N	427.486	1.758	50	20	IDGD	
Cc1c(NC(=O)[C@H](C)SCC(=O)NNC(=O)C(C)(C)C)c(=O)n(-c2ccccc2)n1C	917180099	DCGWFNSUPNOXIP-AWEZNQCLSA-N	447.561	1.738	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)c1ccnc(-n2cncn2)c1	917500920	AHWBFWBMJKSZBN-LLVKDONJSA-N	431.250	1.653	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc2c(c1)OCCO2)c1ccc(F)cc1Br	917754658	GBSMHEJGDRFHEJ-UHFFFAOYSA-N	431.239	1.983	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)CS(=O)(=O)C1CCCC1	919283023	YPFDZQQJJMZQNW-UHFFFAOYSA-N	432.882	1.010	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)[C@H]2CCCN2C(=O)/C=C\c2ccc(C(N)=O)cc2)cc1	920023253	YMBYYNOFTCXRCO-KRBJHKROSA-N	434.496	1.813	50	20	IDGD	
Nc1cnnc(NNC(=O)[C@H]2CCCN(S(=O)(=O)c3ccc(F)cc3)C2)c1Cl	1253123998	NRUJGNQAIKTHPR-JTQLQIEISA-N	428.877	1.395	50	20	IDGD	
CCC(CC)[C@@H](CNC(=O)NNC(=O)c1cncn1-c1ccccc1)N1CCOCC1	1317889124	JTRDXASBTDRTHO-LJQANCHMSA-N	428.537	1.953	50	20	IDGD	
COc1ccccc1C1(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)CCC1	1318296352	XLJQLHFVRHDCNH-LJQANCHMSA-N	440.452	1.648	50	20	IDGD	
Cn1c(C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)cc(Br)c1C=O	1319237249	YALFUDVOATUFCW-UHFFFAOYSA-N	433.218	1.090	50	20	IDGD	
COC(=O)c1ccc(C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)o1	1319390605	DXIGEWVYTRNZIJ-UHFFFAOYSA-N	434.880	1.298	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2COc3ccc(F)cc3C2)c1	1319556152	DGFDEQKMOROKTF-INIZCTEOSA-N	449.504	1.869	50	20	IDGD	
CS(=O)(=O)CC[C@@H](NS(=O)(=O)c1ccc(Cl)cc1)C(=O)N1CC=C(C#N)CC1	1319941025	WTCVASTYYCGBKM-MRXNPFEDSA-N	445.950	1.104	50	20	IDGD	
Cn1cc(N2CC[C@H](NC(=O)NNc3ccc(S(=O)(=O)C(F)(F)F)cc3)C2)cn1	1322976229	RDNYAUFBIFHMOY-LBPRGKRZSA-N	432.428	1.619	50	20	IDGD	
CC(C)C[C@H](C(=O)NNC(=O)c1n[nH]c2c1CCCC2)N1C(=O)[C@H]2CC=CC[C@H]2C1=O	1337139589	GQSZNCSTEMPIBI-JKIFEVAISA-N	427.505	1.415	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](C)n3ccccc3=O)C2)C1	1779267625	AKVOMYPAFRLDHH-IYOUNJFTSA-N	426.311	1.023	50	20	IDGD	
CC(=O)Nc1ccccc1C(=O)N1CCO[C@]2(CCN(C(=O)CO[Si](C)(C)C)C2)C1	1779300177	PPENQUPOAIXEKQ-NRFANRHFSA-N	433.581	1.940	50	20	IDGD	
Cc1cc(CC(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)CCBr)C3)n[nH]1	1779459246	WVCOBRSGSWRBGW-CRAIPNDOSA-N	427.343	1.560	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3csc(C(F)(F)F)n3)C2)C1	1779758655	MRUFPHHRPGRLBG-ZUZCIYMTSA-N	441.859	1.859	50	20	IDGD	
C[C@H](NNc1ccccc1)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781326612	ZDAANVAMZKJQAL-DHSIGJKJSA-N	443.317	1.512	50	20	IDGD	
O=C(c1nnsc1C1CC1)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781329921	NSSTZRIYDCLQRS-WFASDCNBSA-N	433.303	1.550	50	20	IDGD	
Cc1c(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)nc2ccccn12	1781330488	YAFRKOAMXJIQRW-QAPCUYQASA-N	439.285	1.777	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnoc1C1CC1)C2	1782170953	JDWADYDNEUFPSR-JXXFODFXSA-N	425.913	1.933	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)CCO2)C1	1783537985	VDEAYCOSYHKGEI-PIGZYNQJSA-N	442.266	1.527	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H]2C[C@]21C(=O)N1CC[C@]2(CN(C(=O)[C@@H](F)Cl)CCO2)C1	1783684289	FPQQELRLWBKRHZ-FOEVPDMQSA-N	445.919	1.750	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(C)nn3-c3ccccc3)CCO2)C1	1783875501	MXHJYXGUFYIYPO-AVRDEDQJSA-N	446.935	1.878	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnnc(Cl)c3)[C@H]2C1	1785452309	MGNYKQIGMLURIJ-PYJNHQTQSA-N	445.745	1.897	50	20	IDGD	
O=C(C1Cc2ccccc2C1)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1785683397	DSSLKNWQLSQPNP-APWZRJJASA-N	425.298	1.922	50	20	IDGD	
COc1ccc(COCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]3C2)cc1	1787450146	VMWQRVCZBJVHIA-XPYUAMARSA-N	428.888	1.726	50	20	IDGD	
NC(=O)CC[C@H](N)C(=O)Nc1ccc(C2(NC(=O)[C@@H](F)Br)CCC2)cc1	1787980126	YTZUGCPYGXGUDL-GXTWGEPZSA-N	429.290	1.404	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3C[C@@H](O)C3)[C@H]2C1	1788123590	KHROYGQMSMMBCU-MWGRTOOISA-N	445.466	1.622	50	20	IDGD	
Cc1noc(N)c1C(=O)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1	1788140775	VMJTWNGGQODFDX-UHFFFAOYSA-N	434.261	1.307	50	20	IDGD	
CC(=O)O[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)CBr)C[C@@H]21)C(C)C	1788477289	QQSZIQFDQCDPLB-VFTHGPRRSA-N	447.370	1.585	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)N3C[C@H]4C[C@H]4C3)[C@H]2C1	1788507413	VVFJTUMCKVZANU-QWRIQZTRSA-N	442.398	1.337	50	20	IDGD	
O=C(C[C@@H]1CNc2ccccc2O1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Cl)C[C@@H]21	1788552038	OEPCXWHGXYZBRU-HIQFYHPCSA-N	425.888	1.764	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CNC(=O)c3cccs3)C[C@@H]21	1789858668	IOVVEEOAVKBLES-AJNGGQMLSA-N	427.954	1.475	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccnc(Cl)n3)C[C@@H]21	1790960881	SRDTZCCDEPTUOJ-FMSGJZPZSA-N	445.745	1.897	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)nc(Cl)c3)C[C@@H]21	1791056807	CJHIITFKRZZXAQ-URBCHYCLSA-N	446.729	1.817	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4nn(C)cc4c3)C[C@@H]21	1791061075	QDQPPTGYZMCCOJ-GKEYINFOSA-N	449.349	1.950	50	20	IDGD	
CN(CC(=O)Nc1ccc(C2(NC(=O)CCBr)CCC2)cc1)C(=O)C(=O)O	1791093387	YAISOFXIAKFFKX-UHFFFAOYSA-N	440.294	1.449	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(=O)nc4sccn34)C[C@@H]21)C(Cl)Cl	1791298220	JFCYTDWOGHWGMW-NHCYSSNCSA-N	445.328	1.153	50	20	IDGD	
Cc1nn(C)c(C)c1CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CO[Si](C)(C)C)C[C@@H]21	1791636082	WVUBXIRSRKXALI-WDSOQIARSA-N	436.629	1.411	50	20	IDGD	
C=CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCl	1793107131	NROONNGNIXEVFF-YIDVYQOGSA-N	429.945	1.694	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)NC(=O)c1ccccc1)C2	1793455170	CVRWAHYKDDUZIQ-NLNMYJFZSA-N	435.952	1.802	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C[C@@H](N)c1cccnc1	1795679834	RCHWUOGFHNSDJR-VLKZTRAZSA-N	429.348	1.297	50	20	IDGD	
CC(C)(C)OC(=O)N1CCOC[C@H]1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](F)Cl)C2	1796776424	VPJTZKGFYKKJKJ-AICCOOGYSA-N	433.908	1.795	50	20	IDGD	
CC(C)(C)OC(=O)N1CCO[C@@H](C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](F)Cl)C1	1796811890	YUGMNISGNLSEMO-KHMAMNHCSA-N	433.908	1.795	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2ncccn2n1	1797380565	WUDYDERGLAEFBM-ABXQLRGKSA-N	426.304	1.169	50	20	IDGD	
CCCC(=O)N[C@H](C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](Br)CC)C2	1797929625	PLDNXQKUPCEBKW-USRAEIGSSA-N	432.359	1.054	50	20	IDGD	
COc1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)c(C)c1	1798442075	VLRMOVSVEIKPFX-MUJYYYPQSA-N	437.500	1.568	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(C)(F)F)C2	1798522417	WOIRCYVAFCIORS-DRXBFXEBSA-N	441.387	1.379	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CC12CCCN1CCC2	1799213980	YCHFUCQBDLKNMA-MPTYRVRUSA-N	428.371	1.378	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)C(Cl)Cl)C3)cc1O	1799847615	JRNSDTPTEMCFAF-JJLQDPRZSA-N	430.288	1.358	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2)c1nc2cc([N+](=O)[O-])ccc2[nH]1	1799877570	VAQCPICEQDOHSN-HZZFPTLFSA-N	425.804	1.209	50	20	IDGD	
CCN(C)[C@H](C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C#N)=C/c1ccc(F)cc1F	1800334662	ROFKANYJEODBAT-ILCOLZDNSA-N	446.498	1.802	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CNc3ccccc31)C2	1800639861	PNEQQFWWCPSVMI-HYUSYPKPSA-N	436.350	1.959	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1ccc(C#N)cc1)C2	1800754229	KAELDQUWBVAEHS-KUZCPNRJSA-N	434.334	1.864	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COc1c(C)cc(C)cc1C)C2	1800970692	HHCDZIGQWNKRQP-AJYBTWMASA-N	438.952	1.834	50	20	IDGD	
CC#C[C@H](CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)c1ccc(O)cc1	1801055968	UXJCJZMYSZTCDB-GOBLKYCHSA-N	434.920	1.079	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](O)CCl)C2	1801995532	WWKZQQZAZFPDEX-YIDVYQOGSA-N	429.945	1.624	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H]1[C@@H]3Sc4ccccc4[C@H]31)C2	1802337490	MSNRWVQYJZMUEJ-CHDRMWHRSA-N	442.585	1.886	50	20	IDGD	
CC(C)(CCl)C(=O)NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)n2)[C@@H]1c1cccnc1	1802899006	HRVPKJBDCXEAMO-XJKSGUPXSA-N	433.896	1.867	50	20	IDGD	
Cc1cc[nH]c1C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1	1805010020	SVRLORFOCGDHHO-OXJNMPFZSA-N	447.499	1.350	50	20	IDGD	
COC(=O)NCC(=O)N1CC[C@H](CNC(=O)CCBr)[C@H]1c1cccnc1	1806347078	SGFGRODXBWCSDV-CZUORRHYSA-N	427.299	1.228	50	20	IDGD	
Cc1n[nH]c(C)c1C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1810652073	KPVLOFGRSJQDLC-LAUBAEHRSA-N	441.536	1.114	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)c1c(F)ccc(O)c1F	1811655709	GSAHWEUQBWHPQS-XLWVJDPXSA-N	439.846	1.985	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)c1ccc2nn[nH]c2c1	1812296637	DGIZWKJCIACFIM-WBAXXEDZSA-N	428.880	1.272	50	20	IDGD	
CC(=O)N[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1	1812649024	WWQUNTYPRSDINQ-ISTRZQFTSA-N	425.327	1.397	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](N)c2ccccn2)[C@@H]1c1cccnc1	1812864348	OIFWPJOHOLPCAV-QXRTWZOPSA-N	446.349	1.966	50	20	IDGD	
O=C(CCBr)Nc1cc([C@@H]2CCCCN2C(=O)Cn2ccncc2=O)[nH]n1	1816784985	UGUUKNAOKHQSJQ-ZDUSSCGKSA-N	437.298	1.444	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H]2CCC=CO2)[nH]n1	1819403447	MFUVVIOSCQTZRA-SJORKVTESA-N	439.476	1.407	50	20	IDGD	
C[C@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1)c1ccccn1	1822417100	ZTTJACAILHAEKY-MAUKXSAKSA-N	441.536	1.974	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1	1824011723	ZIWHNBPZWGEXQK-IBGZPJMESA-N	434.773	1.865	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1nc[nH]c1[N+](=O)[O-])CC2	1825999478	XAHVQFNLQCDGAT-JGVFFNPUSA-N	428.858	1.254	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCC(F)(F)F)CC2	1826085440	UBHMMJRJWVCBNX-SNVBAGLBSA-N	435.472	1.771	50	20	IDGD	
CS(=O)(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](F)Br)CC2	1827211284	DKOLROSJWXEIHG-RDDDGLTNSA-N	442.332	1.180	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@H]1CCc2nc(NC(=O)[C@H]3CCCS3)sc2C1	1827290439	XLXGLOJCAVTERO-IINYFYTJSA-N	446.558	1.263	50	20	IDGD	
CNC(=S)NCCC(=O)N1CCC([C@@H]2CCCCN2C(=O)CO[Si](C)(C)C)CC1	1829102675	DLWWCUUAPFKLDJ-KRWDZBQOSA-N	442.702	1.942	50	20	IDGD	
Cc1cc(Cl)ccc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1	1830117110	XCMOQTHGLRFQIB-VQIMIIECSA-N	431.316	1.318	50	20	IDGD	
Cc1cc[nH]c1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)CBr)CCO2	1830535502	PHAUCYSTQPRYTP-KDOFPFPSSA-N	428.327	1.424	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3cnc4ccccn34)CCO2)C1	1830663860	NQVFXCSIHKVAKZ-UWJYYQICSA-N	434.924	1.351	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4nonc4c3)C2)C1	1831645623	CTGCDBONIWQUTL-MGPUTAFESA-N	436.896	1.700	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3n[nH]c4c3CC[C@@H]4C)C2)C1	1831646854	NKRFXFSNCGOTFC-HTZUNMPGSA-N	438.956	1.937	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ncn(C(C)C)n3)C2)C1	1831647372	UNOJHQLUJKRVAR-HNAYVOBHSA-N	427.933	1.337	50	20	IDGD	
Cc1ccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)cn1	1833132873	OCFGVJFYCXPTMY-FUHWJXTLSA-N	444.301	1.079	50	20	IDGD	
COc1ccsc1C(=O)N1CCOC[C@@]2(CN(C(=O)CCBr)CCO2)C1	1834823358	PSYIMYGTGBOFMD-QGZVFWFLSA-N	447.351	1.612	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CNC(C)(C)C)CCO2)C1	1835619593	FBWVTASLCINLAM-RDTXWAMCSA-N	434.375	1.004	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)[C@H](C)Nc3cnccn3)CC2)CC1	1836397210	UIRCOUDLSVKADU-MAUKXSAKSA-N	436.988	1.866	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)CCN3CCOC3=O)CC2)CC1	1836397406	ZOUPHGXTAJRSHY-QGZVFWFLSA-N	428.961	1.418	50	20	IDGD	
O=C(c1ccc([N+](=O)[O-])[nH]1)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836718580	ULMCCFHAGBJUKO-OAHLLOKOSA-N	428.873	1.135	50	20	IDGD	
Cc1noc(CC(=O)N2CCC(OC3CCN(C(=O)[C@@H](C)Br)CC3)CC2)n1	1837951499	VKMRBWUMPPAAGI-GFCCVEGCSA-N	443.342	1.703	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)Cc3ccc(O)cn3)CC2)CC1	1838786271	MPDYEWXNIBNLLD-LJQANCHMSA-N	439.940	1.582	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnnc4ccccc34)C2)C1	1839145200	YPWFXAVYTINBRO-UTKZUKDTSA-N	432.908	1.717	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)ccc1F	1839321828	WQKICTWMPXYMIK-KUHUBIRLSA-N	443.313	1.988	50	20	IDGD	
C[C@@H](Oc1ccccn1)C(=O)N1CCOC[C@]2(CN(C(=O)C(Cl)Cl)CCO2)C1	1840190601	DFIHYXWKBPRWBP-FZKQIMNGSA-N	432.304	1.109	50	20	IDGD	
O=C(Cc1cc(F)ccc1[N+](=O)[O-])N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1840887229	BJKHEFUJHJRXTG-SJLPKXTDSA-N	447.822	1.267	50	20	IDGD	
COc1cc(C(=O)N2CC3(CCCN3C(=O)[C@@H](O)CCl)C2)nn1-c1ccccc1F	1841350759	WGCGTQGQEQMCQX-INIZCTEOSA-N	436.871	1.437	50	20	IDGD	
Cc1nccn1CC(=O)N1CC2(CCCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C1	1841925448	WVPLPWAPNQJGLC-HNNXBMFYSA-N	439.944	1.527	50	20	IDGD	
CCn1ccc(C(=O)N2CCCC23CN(C(=O)c2cc([N+](=O)[O-])ccc2OC(C)=O)C3)n1	1842515354	GBTLDLTXEDSDTO-UHFFFAOYSA-N	441.444	1.867	50	20	IDGD	
Cc1nc2cc(C(=O)N3CCCC34CN(C(=O)CCC(=O)NN(C)C)C4)ccc2s1	1843766291	UAXLVBUEADUZPL-UHFFFAOYSA-N	429.546	1.795	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@H]1CC(=O)CN1C(=O)OC(C)(C)C)C2	1845163097	FMJWHPZCLXUCLK-GJZGRUSLSA-N	427.929	1.786	50	20	IDGD	
O=C(COC(=O)CSc1ncnc2sccc12)NNC(=O)c1ccc([N+](=O)[O-])cc1	9719120	JZFMJXRAUXKBGH-UHFFFAOYSA-N	447.454	1.696	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@H](C(=O)NNC(=O)C(=O)NC3CC3)C2)c2ccccc12	10215153	DMEUCHJACSLNSY-AWEZNQCLSA-N	438.484	1.127	50	20	IDGD	
Cc1ccc(CC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1C	23710464	JKYCYLCADWCBGL-UHFFFAOYSA-N	431.514	1.328	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)c1ccc(Cl)c(NS(C)(=O)=O)c1	109523933	LNNSGYQBVQAYHB-UHFFFAOYSA-N	426.882	1.593	50	20	IDGD	
CC(=O)N1CCN(c2ccccc2CNC(=O)NNC(=O)COc2ccccc2F)CC1	726274271	OPRJWASRVKVBDH-UHFFFAOYSA-N	443.479	1.404	50	20	IDGD	
COC(=O)CCn1nc(C)c(C=NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)c1C	727059691	UVXBCBXISUZJJK-UHFFFAOYSA-N	449.533	1.142	50	20	IDGD	
C[C@@]12CCC(=O)N1c1ccccc1C(=O)N2CC(=O)NNc1nc(-c2cccnc2)no1	728077035	RULCRCJUJCTHMP-NRFANRHFSA-N	433.428	1.574	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1)C1CCN(c2ncccn2)CC1	728890610	XSRQNAGKADILQO-LJQANCHMSA-N	440.523	1.892	50	20	IDGD	
Cc1ccc2oc(C(=O)NNC(=O)c3cccc(S(=O)(=O)N4CCCC4)c3)cc2n1	729164820	ADXCHZJDBSBYNH-UHFFFAOYSA-N	428.470	1.996	50	20	IDGD	
O=C(Cc1cc[nH]n1)NNC(=O)c1cc(S(=O)(=O)N2CCCCC2)ccc1Cl	730102441	CVMWHAJXHXZSEY-UHFFFAOYSA-N	425.898	1.241	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCCn2c(=O)oc3ccccc32)cc(OC)c1OC	730127400	AHOIHXHNSDWCNW-UHFFFAOYSA-N	430.417	1.265	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)NCCCN2CCCCC2=O)c2ccccc2c1=O	730129183	IPSZSQLUDBTIPN-UHFFFAOYSA-N	428.493	1.324	50	20	IDGD	
Cc1ccc(Cn2nc(C)c(CCC(=O)NNC(=O)N[C@@H]3CCS(=O)(=O)C3)c2C)cc1	730212662	HVCGTDGGSNAROF-GOSISDBHSA-N	447.561	1.307	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)NCc1ccccc1OCCN1CCOCC1	730824710	KMOQKFUGDAZHAC-UHFFFAOYSA-N	444.488	1.013	50	20	IDGD	
CC(C)(C(=O)NNC(=O)N1CCN(S(=O)(=O)c2ccc(F)cc2)CC1)c1ccccc1	731222717	VDZYXGAXXBAPSG-UHFFFAOYSA-N	448.520	1.851	50	20	IDGD	
Cc1cc(S(=O)(=O)N2CCN([C@H](C)C(=O)NNC(=O)CC(C)C)CC2)c(C)s1	731849885	JVDDRELKNIZNOR-CQSZACIVSA-N	430.596	1.253	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C[C@H](C)O1	732265073	YSRJZVPTMSYKEU-KBPBESRZSA-N	430.465	1.256	50	20	IDGD	
Cc1cnc(O)n1-c1ccc(C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1	732329267	JVOHPRCLRSTDQD-UHFFFAOYSA-N	439.384	1.413	50	20	IDGD	
O=C(Cn1c(=O)ccn(Cc2ccccc2)c1=O)NNc1ccc(Br)nc1	732837074	TWEMFNOGIMAQRL-UHFFFAOYSA-N	430.262	1.359	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)c1cnc2nc(O)nc(O)c2c1	734252890	LKDKUMIGIXSDLV-UHFFFAOYSA-N	432.462	1.270	50	20	IDGD	
Cc1noc(Cl)c1CCC(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	735117544	WOCBDHRMGFTGNO-UHFFFAOYSA-N	442.929	1.043	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N(C)Cc2cnccn2)cc1	735483581	UYJSGKBQOUUYGK-BOPFTXTBSA-N	445.483	1.790	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)[C@@H](Cc2ccccc2)n2nnnc2C)cc1	735630505	ILXWNUZJTFKPNZ-FOIQADDNSA-N	438.488	1.779	50	20	IDGD	
COc1ccc(C(=O)NNc2ccc(Cl)nn2)cc1S(=O)(=O)NCc1ccccn1	735689243	PUVLBUMEHVHSLP-UHFFFAOYSA-N	448.892	1.769	50	20	IDGD	
O=C(COCc1ccccc1)NNS(=O)(=O)c1ccc([N+](=O)[O-])c(Br)c1	737755559	GCDVMZYIBKLPIG-UHFFFAOYSA-N	444.263	1.884	50	20	IDGD	
O=C(NCc1cc(F)ccc1N1CCOCC1)NNC(=O)[C@H]1COc2ccccc2O1	740921243	YIDQEQYHPHTBRB-LJQANCHMSA-N	430.436	1.333	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2ccc3c(c2)NC(=O)CCN3C)c2ccccc2c1=O	741745249	YJESHMDGHYRCAS-UHFFFAOYSA-N	434.456	1.270	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NN=Cc2c(N3CCOCC3)nc3ccccn23)c1	741806796	PKPQSCVQPHORSX-UHFFFAOYSA-N	427.486	1.338	50	20	IDGD	
CN(CCCC(=O)NNC(=O)CCc1ccccc1)C1=NS(=O)(=O)c2ccccc21	741916698	CDLPZJXQVTUNDY-UHFFFAOYSA-N	428.514	1.628	50	20	IDGD	
COCCCOc1cccc(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)c1	742036327	ITQLIPAGMAZUSC-UHFFFAOYSA-N	441.893	1.478	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)C[C@@H]2CCCN2C(=O)OC(C)(C)C)c2ccccc2c1=O	742474248	PIJDVFSOIILOIY-ZDUSSCGKSA-N	429.477	1.484	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NCCC(=O)NC2CCCCC2)cc1	743559190	YTFKPWIVZGTYTD-UHFFFAOYSA-N	425.511	1.265	50	20	IDGD	
C[C@@]1(C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)CCCN(C(=O)c2ccccc2)C1	745345969	AGVWYQNHBAUFGV-XMMPIXPASA-N	448.479	1.805	50	20	IDGD	
CCCCOc1ccc(C(=O)NNS(=O)(=O)c2cc(C(=O)OC)n(C)c2)cc1OC	745976622	ICLCXTURLXQORT-UHFFFAOYSA-N	439.490	1.623	50	20	IDGD	
O=C(NNC(=O)N1CCOCC1)[C@H]1CCCN(C(=O)c2ccc(Cl)c(Cl)c2)C1	745992298	ZBAYXLMPZGCQDQ-ZDUSSCGKSA-N	429.304	1.919	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(N2CCCCC2)c(C(=O)NNC(=O)Cc2ccncc2)c1	747322916	CJVZBANEYVOBTP-UHFFFAOYSA-N	445.545	1.326	50	20	IDGD	
CCCNC(=O)CCNC(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1	747984511	XHYOSFQUQRDYGI-OAQYLSRUSA-N	437.544	1.860	50	20	IDGD	
Cc1cc(F)ccc1NNC(=O)CCC(=O)N1CCN(S(=O)(=O)c2ccccc2)CC1	748548975	COGNUOQCVRUNIO-UHFFFAOYSA-N	448.520	1.891	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)CCOc1ccc(C(N)=O)cc1	748601847	HMPICHBZGAIYBD-UHFFFAOYSA-N	434.518	1.775	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)Cn1nnc(-c2ccccc2)n1	748601939	JFTDVRKHKRLCAZ-UHFFFAOYSA-N	429.506	1.560	50	20	IDGD	
COc1ccc([C@]2(C)NC(=O)N(CC(=O)NNC(=O)c3cc4ccccc4o3)C2=O)cc1	749468522	YRDZPTMPPHPULM-QFIPXVFZSA-N	436.424	1.670	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN1C(=O)c1ccc2c(c1)OCO2)c1cc(Br)c[nH]1	749562515	KCXZWWKKYQEOEZ-CYBMUJFWSA-N	449.261	1.572	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@](C)(C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)C1	751769098	KRKUNIUQVBMHLI-JOCHJYFZSA-N	444.488	1.900	50	20	IDGD	
Cc1cc(S(N)(=O)=O)cc(C(=O)NNC(=O)c2cccc(Br)c2)c1C	752014084	BRZJVZBJQRLHEI-UHFFFAOYSA-N	426.292	1.788	50	20	IDGD	
O=C(NNC(=O)c1ncccc1OCC(F)(F)F)c1csc(N2CCOCC2)n1	752504193	XZZUDXVFWRJVNV-UHFFFAOYSA-N	431.396	1.391	50	20	IDGD	
COc1cc(OC)cc(N2C[C@@H](C(=O)NNC(=O)CNc3ccccc3OC)CC2=O)c1	752791825	KDWMYLDQMIMGBS-AWEZNQCLSA-N	442.472	1.325	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)NCc1ccc(C)cc1N1CCOCC1	753798664	NFHPJGPNCFZJHR-UHFFFAOYSA-N	428.489	1.750	50	20	IDGD	
Cc1ccc(CNC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])c(N2CCOCC2)c1	753945397	BESKVIABVRWHRU-UHFFFAOYSA-N	443.460	1.649	50	20	IDGD	
C#CCOCCC(=O)NNC(=O)c1ccc(NS(=O)(=O)c2ccc(OCC)cc2)cc1	755385504	LNRYKFOGZCZOCG-UHFFFAOYSA-N	445.497	1.687	50	20	IDGD	
O=C(NNC(=O)c1ccncc1)Nc1ccc(N2CCOCC2)cc1N1CCOCC1	755453265	JMRFTOPZPRZSSJ-UHFFFAOYSA-N	426.477	1.221	50	20	IDGD	
COC(=O)CCNC(=O)c1ccc(NC(=O)NNC(=O)c2cccc(OC)c2O)cc1	755602901	GPKQVIIAUOABCR-UHFFFAOYSA-N	430.417	1.160	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)Nc1cc(S(=O)(=O)NC2CC2)ccc1OC	755616970	YSDHBESISYBHBS-UHFFFAOYSA-N	448.501	1.540	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2ccc(C(=O)N3CCOCC3)cc2)cc1OC	755933103	FHPLGVGDNRLVIZ-UHFFFAOYSA-N	428.445	1.643	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)Nc1ccc(N2CCN(C(=O)C3CC3)CC2)nc1	756294446	IFJFFPCKGDRWFX-UHFFFAOYSA-N	438.488	1.615	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN(C)[C@H](C)c2ccc([S@@](C)=O)cc2)cc1OC	756550707	MBFFKYMZJFJKEO-ILHIWHGASA-N	433.530	1.895	50	20	IDGD	
CCCS(=O)(=O)Nc1cccc(NC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1	756683690	GVEQXDAAYIWXGG-KRWDZBQOSA-N	434.474	1.831	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2cc(C)cn(C)c2=O)c1	757714568	ARHYULLMVOINIE-UHFFFAOYSA-N	435.506	1.191	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)Nc1ccnn1Cc1ccccn1	757785355	DBHWMMLVTFUJAX-UHFFFAOYSA-N	448.531	1.691	50	20	IDGD	
CC(C)CCSc1ccc(C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)cc1[N+](=O)[O-]	758030621	RNCYTYYUOQGPNC-NSHDSACASA-N	432.524	1.432	50	20	IDGD	
CC(C)C[C@@H](Cc1cccc(Br)c1)C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O	758043061	DOINZSALRIGZEN-OCCSQVGLSA-N	448.383	1.739	50	20	IDGD	
O=C(c1noc(-c2cccc(F)c2)n1)N1CCN(S(=O)(=O)CBr)CC1	758521962	BKESRXLVNFNELO-UHFFFAOYSA-N	433.259	1.316	50	20	IDGD	
O=C(CCn1cnc2ccc(Br)cc2c1=O)NNc1ncccc1[N+](=O)[O-]	759293756	DLELWVHKRIQKAD-UHFFFAOYSA-N	433.222	1.996	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2ccc3c(c2)NC(=O)[C@H](C)O3)c1	763649811	YLOZGSVHZBGNPQ-ZDUSSCGKSA-N	426.429	1.188	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2F)c(F)cc1F	763682041	VQDSYGMGROXUEO-UHFFFAOYSA-N	425.319	1.055	50	20	IDGD	
Cn1nc(CC(C)(C)C)cc1NC(=O)C(=O)NNC(=O)CN1CCCc2ccccc21	763728193	JBTNXXWSMMPEBG-UHFFFAOYSA-N	426.521	1.547	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1cccc(N2CCCC2=O)c1	763865838	RIKCUGKXXNIOBN-ZDUSSCGKSA-N	428.420	1.506	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)NC(=O)[C@@H](C)O2	763873516	VEKGBBYUVRTLCV-GHMZBOCLSA-N	430.392	1.099	50	20	IDGD	
Cc1ccc(-c2nc3cc(F)ccc3n2C)cc1NC(=O)C(=O)NNC(=O)c1cnccn1	764023949	GWBCBMRMNYBXJT-UHFFFAOYSA-N	447.430	1.878	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)Cc3ccsc3)cc2F)C[C@@H](C)O1	764034647	SUWMCOSBRKOZTM-BETUJISGSA-N	434.493	1.829	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccccc3O[C@H]3CCOC3)n[nH]2)cc1	764109771	BMFIFTJXCYCNKP-INIZCTEOSA-N	449.467	1.953	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(F)c(NC(=O)C3CCCCC3)c2)n[nH]1	764110050	WFZYKTHCEBFFLC-UHFFFAOYSA-N	430.440	1.776	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2O1)C(=O)Nc1cccc(C(=O)N2CCCCC2)c1	764150765	BBGSGUFFHKSQIP-LJQANCHMSA-N	436.468	1.402	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)CCC(C)C)ccc1S(=O)(=O)N1CCCC1	764199728	QQCSAHBKHBRCHW-UHFFFAOYSA-N	440.522	1.002	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)C(=O)Nc2ccc(Oc3ccccn3)cc2)c1	764432086	BTKZEAYOEVFESQ-UHFFFAOYSA-N	434.412	1.627	50	20	IDGD	
CCN1CCC[C@H]1CNC(=S)NNC(=O)c1cc(-c2ccc(OC)c(OC)c2)[nH]n1	764500034	JIVUWOCCUVALLJ-AWEZNQCLSA-N	432.550	1.687	50	20	IDGD	
CC(C)[C@@H](C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)N1C(=O)c2ccccc2C1=O	765313644	SDXYQJIOVFAQPN-KRWDZBQOSA-N	446.504	1.760	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)CCC(=O)c3cccs3)CC2)cc1	765748746	GNWLQQXNDHJBQL-UHFFFAOYSA-N	428.558	1.985	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H]2CCO[C@@H](C3CC3)C2)c1	765921275	ZRHGUFIIJBNWLQ-SJLPKXTDSA-N	438.550	1.619	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)c1cc2c(nc1O)CCC2	766661524	WRKJIONQOJTTPR-UHFFFAOYSA-N	443.935	1.508	50	20	IDGD	
Cc1cc(C)cc(N2CC[C@@H](C(=O)OCC(=O)NNC(=O)Cc3ccccc3C)C2=O)c1	767304751	CIKICOIDZPWRPZ-HXUWFJFHSA-N	437.496	1.898	50	20	IDGD	
Cc1ccc(OCCCC(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c(C)c1	767464662	HJIUCNKQSRWUEG-FQEVSTJZSA-N	442.468	1.993	50	20	IDGD	
COC(=O)[C@@H](NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1ccccc1C	767554423	JPUOFHDSFQOPAN-IBGZPJMESA-N	447.513	1.165	50	20	IDGD	
CC(C)(CNC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)c1ccncc1	768981283	NGTRRLGWCJMYET-UHFFFAOYSA-N	445.545	1.788	50	20	IDGD	
CC(C)c1nnc(NC(=O)CCC(=O)NNC(=O)c2cc(Br)c[nH]2)s1	769464919	DXTKQWJLMXUEOA-UHFFFAOYSA-N	429.300	1.932	50	20	IDGD	
C[C@@H](NC(=S)NNC(=O)CN1C(=O)N[C@](C)(c2ccc(F)c(Cl)c2)C1=O)C1CC1	770247415	WTJSYIXUFUUHIW-DYBLOJMWSA-N	441.916	1.540	50	20	IDGD	
COC(=O)c1c(OC)ccc(S(=O)(=O)NNC(=O)c2ccc(Cl)cc2O)c1OC	771599127	FWQZJDWIGDTHGV-UHFFFAOYSA-N	444.849	1.473	50	20	IDGD	
O=C(COCc1nc2ccccc2s1)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772196382	YNIMUGHVVQUEIP-UHFFFAOYSA-N	432.889	1.930	50	20	IDGD	
O=C(NNc1ccccc1[N+](=O)[O-])C(=O)Nc1ccc(CN2C(=O)CSC2=O)cc1	773650141	DGVWRDODYHLSIZ-UHFFFAOYSA-N	429.414	1.872	50	20	IDGD	
O=C(NNc1cnc2ccccc2n1)C(=O)Nc1ccc2nc(N3CCOCC3)oc2c1	773717403	ZRYWMAYGCXVYFM-UHFFFAOYSA-N	433.428	1.689	50	20	IDGD	
COC(=O)c1ccc(F)c(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)c1	774008322	GESDMYABOAXOTA-SNVBAGLBSA-N	437.811	1.819	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)Nc1ccnn1[C@H]1CCS(=O)(=O)C1	776053578	DCZQUXXRSDNPDJ-YPMHNXCESA-N	425.442	1.002	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)NCc2nc(C(F)(F)F)n[nH]2)c1	776255163	RVGSAIMDQWYHIA-UHFFFAOYSA-N	437.176	1.739	50	20	IDGD	
COCCO[C@H]1COCC[C@H]1NC(=O)NNC(=O)c1sc(-c2ccccc2)nc1C	776845936	IWMSHVXVJYBWME-CVEARBPZSA-N	434.518	1.883	50	20	IDGD	
C[C@H]1C(=O)N(C)CCN1C(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1	777485670	MRVUKCGKJARNOZ-LAUBAEHRSA-N	435.528	1.517	50	20	IDGD	
Cc1cc(F)c2nc(O)cc(C(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)c2c1	778529916	JLEHTSSJWQLHNP-UHFFFAOYSA-N	446.460	1.713	50	20	IDGD	
COC[C@H](C)n1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)n1	778715465	XUBCWQDTPSBSOT-NSHDSACASA-N	429.412	1.019	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)N[C@@H]1CCCN(c2ccc(C#N)cc2)C1=O	780893997	IHYJWMCAVJXLPT-RDTXWAMCSA-N	439.447	1.991	50	20	IDGD	
COc1ccc(C[C@@H](C)C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)cc1OC	781322379	NOFIGJNKRAEHKO-CQSZACIVSA-N	425.441	1.758	50	20	IDGD	
O=C(CN1CCNC(=O)[C@H]1c1ccccc1C(F)(F)F)NNC(=O)c1cccs1	782102343	SMIDEDHUIKQINU-OAHLLOKOSA-N	426.420	1.701	50	20	IDGD	
COCCOc1cc(C)ccc1NC(=O)C(=O)NNC(=O)Cc1nc2ccccc2n1C	782895043	WSXUSPMECURLTP-UHFFFAOYSA-N	439.472	1.236	50	20	IDGD	
CCCNS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ncccc2C(F)(F)F)cc1	783118379	PVDNTDFLALKQCQ-UHFFFAOYSA-N	445.423	1.871	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2cc(C3CCCC3)nn2C)nc1	783264387	OLZYBTYDJHANNL-UHFFFAOYSA-N	449.537	1.241	50	20	IDGD	
CN1CCN(c2ccccc2NC(=O)C(=O)NNc2ccnc(Br)c2)CC1	784828581	KQOOUEPEFULWAB-UHFFFAOYSA-N	433.310	1.678	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2ccc(C(F)(F)F)nn2)ccc1-n1nnnc1C(C)C	784886235	MRZCEPMCAWWZAM-UHFFFAOYSA-N	449.397	1.985	50	20	IDGD	
COC(=O)c1[nH]c(C)cc1NC(=O)C(=O)NNC(=O)c1cc(-c2cc(C)ccc2C)[nH]n1	785126618	ATDOYMPYRAAYKV-UHFFFAOYSA-N	438.444	1.516	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2ccn(-c3cccc(F)c3C#N)n2)n1	785227458	SCNPTUFCZOEPKK-UHFFFAOYSA-N	437.439	1.601	50	20	IDGD	
CCNC(=O)c1ccc(C)c(NC(=O)C(=O)NNc2c(OC)cccc2S(C)(=O)=O)c1	785329983	AYZSPMMQLBEKQW-UHFFFAOYSA-N	448.501	1.239	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1ccc(NC(=O)C2CC2)cc1	785331319	TZKPCCVTGRXNKT-UHFFFAOYSA-N	446.485	1.529	50	20	IDGD	
Cc1ccc(CNC(=O)NNC(=O)Cc2cn3ccccc3n2)c(-n2cc(Cl)cn2)n1	786830908	GSASZOBMADMMMX-UHFFFAOYSA-N	438.879	1.950	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1ccn(C2CCN(C)CC2)n1	787550596	VYYJVKNQFNNGLS-UHFFFAOYSA-N	446.533	1.037	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2nc(C(C)C)cs2)c2ccccc2c1=O	789733315	ZKJMBZVAMUQQJI-UHFFFAOYSA-N	428.474	1.396	50	20	IDGD	
Cn1nc(-c2ccc(F)cc2F)cc1NC(=O)C(=O)NNC(=O)[C@H]1Cc2ccccc2O1	789733401	LLEAKJMEJSOOOJ-QGZVFWFLSA-N	441.394	1.455	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1cccc2c1OCC[C@H]2N(C)C	789740867	JWJMVQCQQBGDPR-FZKQIMNGSA-N	444.463	1.764	50	20	IDGD	
O=C(CSCc1nc(O)c2c3c(sc2n1)CCCC3)NNC(=O)CN1CCCC1=O	789857515	WNSFWFDXQJCMOB-UHFFFAOYSA-N	449.558	1.279	50	20	IDGD	
O=C(NNc1cccc(F)c1[N+](=O)[O-])C(=O)Nc1ccccc1CN1C(=O)CCC1=O	791000703	OOQRWNDPQVLLIH-UHFFFAOYSA-N	429.364	1.465	50	20	IDGD	
O=C(NNC(=O)c1cc2nccnc2cc1F)c1ccc(S(=O)(=O)N2CCCC2)cc1	792016408	OMJCIWKUSHTFFI-UHFFFAOYSA-N	443.460	1.628	50	20	IDGD	
CNS(=O)(=O)c1ccc(NC(=O)NNc2ccc([N+](=O)[O-])cc2Br)nc1	792398318	TXPQHOYTRTUFJE-UHFFFAOYSA-N	445.255	1.809	50	20	IDGD	
CCCS(=O)(=O)Nc1cccc(C(=O)NNC(=O)CNC(=O)OCc2ccccc2)c1	794065864	QRBVHFFBXPSXPG-UHFFFAOYSA-N	448.501	1.526	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)COCc2ccccc2)c(OC)c(C)c1OC	797006742	MKTFXVSGYCVHRA-UHFFFAOYSA-N	431.445	1.324	50	20	IDGD	
C[S@@](=O)c1ccc(CC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1	797787026	XSAORKCYCPOSCY-GDLZYMKVSA-N	449.554	1.212	50	20	IDGD	
O=C(O)Cn1cc(C=NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)c2ccccc21	799883056	OICLNFPLYWPIAT-UHFFFAOYSA-N	447.495	1.634	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)NCCS(=O)(=O)CCc1ccccc1	800066834	KYFOFYPCUWEEKY-UHFFFAOYSA-N	437.543	1.472	50	20	IDGD	
N#Cc1ccc(N2C(=O)N[C@@H](CCC(=O)NNC(=O)Nc3cc(F)cc(F)c3)C2=O)cc1	802000707	XWTCLLQLXZKZLB-INIZCTEOSA-N	442.382	1.894	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)CN2C(=O)N[C@@](C)(c3ccc(OC)cc3)C2=O)cc1	802062190	ZVAFGQBQGIFRRI-NRFANRHFSA-N	441.444	1.324	50	20	IDGD	
C=CCN1C(=O)C(=O)N(CC(=O)NNC(=O)Nc2c(Cl)cc(Cl)cc2Cl)C1=O	802070991	LTKFWXBUHYPDKJ-UHFFFAOYSA-N	448.650	1.776	50	20	IDGD	
COc1ccc(Cl)c(NC(=O)NNC(=O)CS(=O)(=O)Cc2ccc(C#N)cc2)c1	802111183	FGGZPWLUOAVPTF-UHFFFAOYSA-N	436.877	1.988	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)Cc2ccccc2F)nn1-c1ccc(F)cc1F	808935065	HNAKBQIPPFHHAE-UHFFFAOYSA-N	431.374	1.927	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cncnc2-c2ccccc2)cc1	809983522	JUOSZHQJKWOUEO-UHFFFAOYSA-N	439.497	1.534	50	20	IDGD	
Cc1ccc(C)c(S(=O)(=O)NCC(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)c1	810346048	AYBZHNKOXPCWMD-UHFFFAOYSA-N	447.485	1.721	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)Nc2cccc(N3C(=O)N[C@@](C)(C4CC4)C3=O)c2)n1	812987008	IXKQXBMFOAVPDM-NRFANRHFSA-N	439.476	1.578	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)cc1OC(F)F	813034143	YZEDCHNITLKKKB-UHFFFAOYSA-N	442.444	1.929	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)Nc1ccc(CS(C)(=O)=O)cc1	814626497	PAVFOYPOYHPKIW-UHFFFAOYSA-N	426.520	1.630	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(OC)c2ncccc2c1	815565486	PYGFOUGZRZLPNI-UHFFFAOYSA-N	438.440	1.807	50	20	IDGD	
CCCC(=O)Nc1ccc(Cl)c(NC(=O)C(=O)NNC(=O)[C@@H]2CCc3nncn3C2)c1	815692410	QJZRAGDWFZRKCJ-LLVKDONJSA-N	447.883	1.019	50	20	IDGD	
O=C(NNc1cccc(Cl)n1)C(=O)Nc1ccc(S(=O)(=O)C[C@H]2CCCO2)cc1	815726869	YBFXJSATGMPIGW-CYBMUJFWSA-N	438.893	1.770	50	20	IDGD	
CCCc1nnc(SCC(=O)NNc2cc(C(=O)OC)ccc2Br)n1N	818767913	VWXXADKKAIGRKP-UHFFFAOYSA-N	443.327	1.729	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(\C#N)C(=O)O[C@H](C)C(=O)N2CCC(C(N)=O)CC2)c1C	913150537	WWTBYVVQDDUZID-SAHHGKCQSA-N	444.532	1.875	50	20	IDGD	
COc1ccc(S(=O)(=O)N[C@H](C)C(=O)NNC(=O)COc2cc(C)cc(C)c2)cc1	913446116	OPBUNFONCLXOPA-OAHLLOKOSA-N	435.502	1.205	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c1C	914751889	RDUIICSGRVKLEG-WQRHYEAKSA-N	434.460	1.095	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)c1ccn(-c2ccccc2F)n1	915132516	GIWJMSNZABPMCF-UHFFFAOYSA-N	436.491	1.985	50	20	IDGD	
CCCS(=O)(=O)N1CCC(NC(=O)NNC(=O)c2ccc(OCC)c(OC)c2)CC1	916383806	TVQABWKNTWIEPC-UHFFFAOYSA-N	442.538	1.242	50	20	IDGD	
C[C@@H]1CN(c2ccc(CNC(=O)NNC(=O)[C@@H](C)Oc3ccc(F)cc3)cn2)CCO1	916392944	QCBRYMLLGUOVFT-HUUCEWRRSA-N	431.468	1.744	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NCc2ccc(Br)s2)c2ccccc2c1=O	916593977	FQYHTFNRQSRSQY-UHFFFAOYSA-N	436.291	1.902	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)NCCS(=O)(=O)NC(C)(C)C	916622240	BNGTVRHZHAVUKC-CQSZACIVSA-N	436.534	1.655	50	20	IDGD	
O=C(NCc1ccc(S(=O)(=O)NC[C@H]2CCCO2)cc1)NNc1ccc(Cl)nn1	916648884	DSQNRFOLRWWDCL-CYBMUJFWSA-N	440.913	1.414	50	20	IDGD	
O=C(CN1CCCN(C(=O)c2ccsc2)CC1)NNC(=O)c1cccc([N+](=O)[O-])c1	917409575	SMIGKBYNGYUJRU-UHFFFAOYSA-N	431.474	1.265	50	20	IDGD	
O=C(NNC(=O)c1ccc(Br)s1)NNC(=O)[C@H]1COc2ccccc2O1	918778452	FTPYSCVRTHYFMS-SNVBAGLBSA-N	441.263	1.326	50	20	IDGD	
O=C(N[C@@H](Cc1ccccc1)C(=O)NNC(=O)[C@@H]1COc2ccccc2O1)c1cccnc1	921299406	RNBQCNVCEBMPOR-RXVVDRJESA-N	446.463	1.410	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)c1ccc(NC(=O)c2ccc(O)nc2)cc1	1115990962	ACTMVCXTYGFHIT-UHFFFAOYSA-N	436.424	1.888	50	20	IDGD	
Cc1nn(C)c(C)c1-c1cc(C(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)n[nH]1	1318951909	UXWCNGIWXVVBPQ-UHFFFAOYSA-N	445.524	1.835	50	20	IDGD	
Cc1cccc(NC(=O)NCC(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)c1	1339205101	RZRVZDWAYONNMX-UHFFFAOYSA-N	433.509	1.911	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnn4c(C)cc(C)nc34)C2)C1	1777779822	MRRPEYPFYDPWGQ-JXFKEZNVSA-N	435.912	1.043	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)c3cc4[nH]ccc4s3)C2)C1	1778072230	PYANEYJVGZGZSX-HXUWFJFHSA-N	433.534	1.046	50	20	IDGD	
C=CC[C@@H](C(=C)C)C(=O)N1CC[C@]2(CN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CCO2)C1	1778882133	RPNRWAHHHIPPRV-KTDDNLLNSA-N	441.532	1.719	50	20	IDGD	
COc1ccccc1OCC(=O)N1CCO[C@@]2(CCN(C(=O)CO[Si](C)(C)C)C2)C1	1779294491	JSUVHVIDJUMDJX-OAQYLSRUSA-N	436.581	1.755	50	20	IDGD	
O=C(/C=N/O[C@H]1CCCCO1)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(Cl)Cl)C2	1779427788	AKFSKFZKDUMAIF-USJDNNDHSA-N	436.336	1.833	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Br)C2)c1ccncc1O	1779623083	VHVDSTWITNUHRU-JKIFEVAISA-N	430.274	1.605	50	20	IDGD	
COc1cc(C#N)cc(C(=O)N2CC[C@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)c1	1780175496	NLPUXYFFCOUJDV-NRFANRHFSA-N	431.565	1.862	50	20	IDGD	
C[C@](O)(C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Br)C1)C(F)(F)F	1780771304	ZJXHFSPDFZRBHI-XXSPCDMZSA-N	449.239	1.504	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3nn(C)c(C)c3Br)CCO2)C1	1781219457	ZIFPJEAARQBFRI-SJCJKPOMSA-N	447.761	1.952	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(-c4cc[nH]n4)cc3)C2)C1	1781882473	FBEQSYAJZMEZSQ-DYESRHJHSA-N	432.908	1.774	50	20	IDGD	
C[C@H](CN)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](Br)Cc3ccccc3)C2)C1	1783022938	MZFVQSWFVFVPEJ-WRWLIDTKSA-N	438.366	1.417	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cccc(OC)n3)CCO2)C1	1783344807	UIEZVCFLPWIDJL-ACJLOTCBSA-N	426.311	1.707	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)CCc3cnc4[nH]ccc4c3)C2)C1	1783679118	YEBGYCCTHNTPQD-LAUBAEHRSA-N	434.924	1.579	50	20	IDGD	
CC(C)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CNC(=O)c3cccnc3)C[C@@H]21	1783846533	XUMOIOALKAZVGC-ULQDDVLXSA-N	436.940	1.056	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccn4cncc4c3)C[C@@H]21	1783966712	KTVMWJNAGZBMAR-IKICRFKJSA-N	449.349	1.959	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(O)cn3)C[C@@H]21	1783967377	GKOPUDHDWKLORK-DSPQJCBJSA-N	426.311	1.412	50	20	IDGD	
CC(=O)O[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]2C1)C(C)C	1783967783	WUARXWGJHSKWJJ-VFTHGPRRSA-N	447.370	1.585	50	20	IDGD	
COC(=O)[C@@H]1CC[C@@H](C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCBr)C[C@@H]32)C1	1784081956	OSGGLQIMPYEXBY-OWYFMNJBSA-N	445.354	1.340	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCNC(=O)c3ccc[nH]3)[C@H]2C1	1785246993	DFVBVVRIMAZETM-CUSZFKRNSA-N	438.956	1.522	50	20	IDGD	
N=C1NCCN1CC(=O)Nc1ccc(C2(NC(=O)[C@H](F)Br)CCC2)cc1	1788014615	XWNVAXRXBGPEQB-AWEZNQCLSA-N	426.290	1.651	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnn(C)c3Cl)[C@H]2C1	1789083556	PLAUTNVAXRPWNG-PYJNHQTQSA-N	447.761	1.840	50	20	IDGD	
N#Cc1ccc(F)c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]3C2)c1	1789923254	AUBWRRQMNIEDJD-DLKVLKDVSA-N	442.260	1.981	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CCc3nc[nH]c3C1)C2	1792871955	FSUBJIYHEXBVSG-XKSGDERDSA-N	439.354	1.135	50	20	IDGD	
C[C@H](CBr)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccn3c(O)nnc13)C2	1792987886	HJCLKSHVOPOXBE-FVCCEPFGSA-N	436.310	1.718	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CCc2ccccc2[C@H]1O	1793036103	FYZARSHLCVTREI-ZLKCZHQWSA-N	436.936	1.126	50	20	IDGD	
COc1ncccc1CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Br)C2	1794098400	ZSJMSIAFDQSVPM-JJAZEVLHSA-N	440.338	1.396	50	20	IDGD	
COc1nccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCBr)C3)c1F	1795907995	QPSYIZKIUSQART-QHBPRCKVSA-N	430.274	1.218	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc(Br)cn1)C2)[C@H](F)Cl	1796361607	LAIBNZIMUBFJPU-OWLDWWDNSA-N	434.693	1.511	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(N3CCOCC3)c1)C2)[C@H](F)Cl	1796366938	OWMUSRQQBCRREZ-MVJTYMMSSA-N	425.888	1.261	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1nc2ccccn2n1	1796563978	GGWGAGXLCFZXLJ-MVRRYPJTSA-N	448.487	1.115	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1=NO[C@H](c2ccccc2)C1	1797176141	DTZDUGVPVLNGRM-NZGUISNBSA-N	445.592	1.945	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc3c(c1)CCCO3)C2	1797956809	DTYKRQLWAXEDRZ-BBIADKPPSA-N	446.620	1.995	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H]1C[C@@H]1c1ccccc1)C2	1798443499	CJXZCAGDZITJJP-JEIKXUOUSA-N	433.512	1.741	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCNC(=O)OC(C)(C)C	1800170567	SUIKZHKLCFJPEY-YIDVYQOGSA-N	431.961	1.918	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1c(F)ccc(F)c1F)C2	1800971043	OOFPGZTZUGBDAZ-ZSMOCIRGSA-N	434.842	1.490	50	20	IDGD	
COc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)Br)C3)ccc1F	1801712062	MDKBEBRUNINASB-VFFTVRQLSA-N	429.286	1.821	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1C[C@@]12C(=O)Nc1ccccc12	1801972113	FKOLJBMYAZPZPM-BIHDVVPSSA-N	431.920	1.788	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnn(C)c1C(F)(F)F)C2	1802333236	OJVPBOYMDNTYMT-CLLJXQQHSA-N	444.458	1.064	50	20	IDGD	
C[C@H](Cc1ccccn1)C(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1	1803146253	MMFQHLVMDMJUNK-BEKAIBRUSA-N	430.936	1.961	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1)c1ccc[n+]([O-])c1	1804778716	AECZIWWKZSFWQS-MAUKXSAKSA-N	433.306	1.820	50	20	IDGD	
C[C@H](NC(=O)c1ccccn1)C(=O)N1CCC2(CCCN(C(=O)[C@H](O)CCl)C2)CC1	1805525655	CSYVPWPXYMJSKV-DOTOQJQBSA-N	436.940	1.031	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H](CNC(=O)CCN2CCOCC2)[C@@H]1c1cccnc1	1806951896	ISRJOEOCCAJQBK-KNQAVFIVSA-N	448.640	1.661	50	20	IDGD	
O=C(NCC(=O)N1CCCC2(CCN(C(=O)[C@@H](O)CCl)CC2)C1)c1cccs1	1807093605	UXSYUMBQHDJHDB-AWEZNQCLSA-N	427.954	1.309	50	20	IDGD	
Cc1ccoc1C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1808502353	WYBHNQGMOAGZQJ-PXNSSMCTSA-N	427.505	1.676	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H](CNC(=O)COCCO)[C@@H]1c1cccnc1	1808601243	IVUGZBBBROMGEL-UNEWFSDZSA-N	428.327	1.127	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)Cc2ncccn2)[C@H]1c1cccnc1)[C@H](F)Br	1808651107	IIUPVSGZKLAFCT-JQFCIGGWSA-N	436.285	1.811	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H](CNC(=O)[C@@H](F)Br)[C@H]1c1cccnc1)n1ccnn1	1808679348	WKSSZMJLMKZYSZ-NMFUWQPSSA-N	439.289	1.631	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2cnncc2C(=O)O)[C@H]1c1cccnc1	1810806483	SKRIKXCLJCCBTQ-RRQGHBQHSA-N	431.880	1.907	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC2(CCCN(C(=O)c3cnc(O)nc3O)C2)CC1	1810873890	XKAGTOWURNLFJN-ZDUSSCGKSA-N	441.326	1.906	50	20	IDGD	
CCOc1ccc(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](Cl)COC)[C@H]2c2cccnc2)nn1	1811625633	ACFAFOUNNOFDQI-BXWFABGCSA-N	447.923	1.844	50	20	IDGD	
Cc1nc(C)c(C(=O)N2CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)o1	1813073870	PKQBHDBTKNIPQY-PXNSSMCTSA-N	442.520	1.379	50	20	IDGD	
Cc1cc2nnc(C(=O)N3CCCC[C@@H]3c3cc(NC(=O)[C@@H](O)CCl)n[nH]3)c(C)n2n1	1814870744	BMCZMFVFJDCUEN-KGLIPLIRSA-N	446.899	1.370	50	20	IDGD	
CCC[C@@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN(CCO)CCO)[nH]n1	1815323076	YSALMPHUNDAILI-ZBFHGGJFSA-N	429.949	1.096	50	20	IDGD	
O=C(/C=C/C1CCCC1)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1	1815360688	XKNMRQNPRUXENK-VGMNTSGFSA-N	439.346	1.795	50	20	IDGD	
Cc1cc(/C=C/C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)no1	1817476318	QAEGJFWEYVESMW-SGQUHAKNSA-N	449.276	1.405	50	20	IDGD	
CNC(=S)NCCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)CO[Si](C)(C)C)[nH]n1	1819407573	QUEVEDWTYDJPRE-AWEZNQCLSA-N	440.646	1.737	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](COC(C)=O)OC(C)=O)sc2C1	1819861393	FIJTZEBAIAFRKQ-MBNYWOFBSA-N	445.925	1.567	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H]2CCC(=O)N2C)n[nH]1	1820956765	KZEUUNXVTFTVIH-UHTWSYAYSA-N	426.315	1.806	50	20	IDGD	
CC(C)CNC(=O)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](C)Br)n[nH]1	1822187669	YPPWADNVRQKLJU-AAEUAGOBSA-N	428.331	1.957	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@H]1CCc2nc(NC(=O)[C@H]3C[C@H]3F)sc2C1	1822667769	XTPDNAMCJGTFIE-WRCWPPDXSA-N	432.481	1.547	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1	1823006376	ACADTCOYSDNXGP-RGNHYFCHSA-N	433.303	1.436	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CSCC(=O)OC)CC2	1825994108	HVEJHVVPVJMZAM-UWVGGRQHSA-N	435.955	1.215	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CC1CCOCC1)CC2	1826085407	RICHPNXYMRNXMG-AWEZNQCLSA-N	437.566	1.245	50	20	IDGD	
CCc1oncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1	1826171250	PNIGCNZGLNJTCT-HXUWFJFHSA-N	439.321	1.464	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)Cc3c(C)nn(C)c3C)sc2C1	1826849578	WWDRSQXWCLHZBD-JSGCOSHPSA-N	439.969	1.902	50	20	IDGD	
CCn1nccc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827051167	OSDYIVUMGQDYRL-HXUWFJFHSA-N	438.337	1.130	50	20	IDGD	
CCc1ccc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)cn1	1827055904	JGYBFWLBBTVCAU-QHCPKHFHSA-N	449.360	1.871	50	20	IDGD	
CN[C@H](CC(=O)N1CCC([C@H]2CCCCN2C(=O)CO[Si](C)(C)C)CC1)C(=O)O	1829102473	RPNRZBHFQDOZDC-IAGOWNOFSA-N	427.618	1.520	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)COc3ccc(OC)cc3)CCO2)C1	1830243458	CIHCKBUIFHYVIS-RXVVDRJESA-N	440.924	1.548	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)[C@H](F)Br)CC1	1830381003	DJKMZLWRMUNFEC-PBHICJAKSA-N	449.365	1.670	50	20	IDGD	
O=C(c1c(F)cccc1Cl)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1830731202	HTXUFHGKFLIZBP-KSSFIOAISA-N	435.279	1.149	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)n3cccc3C=O)C2)C1	1831647794	YYKNTRUOSSXMDU-DJPFJPOOSA-N	439.940	1.726	50	20	IDGD	
Cc1cc(CCC(=O)N2CCO[C@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)ccn1	1832626453	OISKFIHYIAVVGG-JOCHJYFZSA-N	449.624	1.631	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3ccc(F)nc3)CCO2)C1	1832831531	XHGJEYOKBBBTTI-NRFANRHFSA-N	441.931	1.875	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)C3(Br)CC3)CC2)CC1)[C@@H](O)CCl	1833313584	MBWAGSZDGCALHY-AWEZNQCLSA-N	436.778	1.085	50	20	IDGD	
CCc1cc(C(=O)N2CCOC[C@]3(CN(C(=O)CCBr)CCO3)C2)no1	1834822971	BLHCXSLEPLVHHA-KRWDZBQOSA-N	430.299	1.092	50	20	IDGD	
Cc1nnc(CC(=O)NC2CCN(C3CCN(C(=O)CCBr)CC3)CC2)o1	1834832452	GGCUPSQQQLEWNJ-UHFFFAOYSA-N	442.358	1.277	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC1CCN(C2CCN(C(=O)CCc3cncnc3)CC2)CC1	1835837761	UPSAOJGWNCKITM-UHFFFAOYSA-N	447.656	1.832	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cc(C(=O)O)ncn3)CC2)CC1	1837289956	FPFOWBSJWVGLNT-OAHLLOKOSA-N	438.912	1.804	50	20	IDGD	
O=C1Nc2ccccc2/C1=C/C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1837322494	CWPHZWSGRDCCHA-FSBBVQABSA-N	437.855	1.013	50	20	IDGD	
Cc1nn[nH]c1C(=O)N1CCC(OC2CCN(C(=O)[C@H](F)Br)CC2)CC1	1838001566	UMRFBTMFNGRCPQ-AWEZNQCLSA-N	432.294	1.416	50	20	IDGD	
O=C(Nc1cccnc1)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](F)Cl)CC2)CC1	1838082048	DAGIMEHYRZIBSF-MRXNPFEDSA-N	426.876	1.553	50	20	IDGD	
O=C(COc1ccc(O)nn1)N1CCC(OC2CCN(C(=O)C(Cl)Cl)CC2)CC1	1838724703	QPOALSVYHRBXCT-UHFFFAOYSA-N	447.319	1.363	50	20	IDGD	
Cc1ccn(C)c1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)CBr)C2)C1	1838815502	HOSWSYSFRVCNEC-BEFAXECRSA-N	442.354	1.435	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CSc3ncccn3)C2)C1	1839143671	DTOGPWNMWQDGKM-KDOFPFPSSA-N	428.942	1.043	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CNc3ccc(F)cc3)C2)C1	1839143924	MBPKUSFOXHDFGT-FXAWDEMLSA-N	427.904	1.711	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4c(c3)NC(=O)CC4)C2)C1	1839147858	FATGXKQBVNKAMU-VGOFRKELSA-N	449.935	1.659	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)c3ccccc3)C2)C1	1839152349	WUPWJQYPBJMBKE-VDGAXYAQSA-N	445.343	1.413	50	20	IDGD	
O=C(/C=C/c1ccccc1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839198827	CDZAVIBCMIBRPK-XZJTZLQGSA-N	441.297	1.847	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)c1ccc(C)cc1)CCO2	1839949039	OKYCXEASKXHZPR-ZWCUEREDSA-N	438.952	1.809	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc(C)nc3)C2)C1	1839963530	NJULPEQPWRHGBO-YJBOKZPZSA-N	441.326	1.029	50	20	IDGD	
O=C(c1ccnc(C(F)F)c1)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840186308	HWYHZWKWZMTUKO-QGZVFWFLSA-N	438.258	1.893	50	20	IDGD	
CC(=O)Nc1ccccc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1840724260	UDNFUGKGERJTLE-QFBILLFUSA-N	427.860	1.249	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)CCN3CCCC3)CCO2)C1	1840940463	KOKCXAKKGJQEAU-MOPGFXCFSA-N	436.380	1.165	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1n[nH]c3c1CCCC3)C2	1843415876	XFDJFGXXKFVTGS-ZVHZXABRSA-N	437.504	1.240	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC2(CCCN2C(=O)/C=C\C(=O)NC2CC2)C1	1844178503	SVNMAWFSEGBOGW-XVRBRGRQSA-N	440.450	1.910	50	20	IDGD	
CC(C)O[C@H](C)C(=O)N1CCCC12CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2	1844329794	ZNUKYTZUJADPND-GOSISDBHSA-N	445.564	1.350	50	20	IDGD	
COC(=O)C1(C(=O)N2CC3(CCCN3C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)CC1	1844693181	GHTCDDLYRHDIAG-UHFFFAOYSA-N	445.428	1.290	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H]1C(=O)N1CC2(CCCN2C(=O)[C@H](F)Br)C1	1845216239	DHWWHHBXKWSDMF-RYUDHWBXSA-N	434.306	1.890	50	20	IDGD	
CC(C)c1ccc(CC(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)cc1	1846100924	NOKOVSFVWXDCQY-UHFFFAOYSA-N	435.528	1.868	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1ccc(CO)o1	1848099328	JGLHAQRZBLLFQM-KKUMJFAQSA-N	441.912	1.719	50	20	IDGD	
C#CCNS(=O)(=O)c1cccc(C(=O)NNc2nc3ccccc3c(=O)n2CC)c1	11164790	MEVBAIRIYDVGIP-UHFFFAOYSA-N	425.470	1.085	50	20	IDGD	
O=C(Cn1cnc2c(oc3ccccc32)c1=O)NNC(=S)NCCc1cccs1	11522637	APJBBTZNLAIXHQ-UHFFFAOYSA-N	427.511	1.942	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2ccc(-n3nccc3C)cc2)cc1	21779030	BNDKJQOBQYKITP-UHFFFAOYSA-N	441.513	1.571	50	20	IDGD	
COCCCNC(=S)N(C)NC(=O)c1ccc(OC)c(S(=O)(=O)NC(C)(C)C)c1	726077558	ZFNJUXQOAJQICT-UHFFFAOYSA-N	446.595	1.260	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)[C@@H]1CC(=O)N(Cc2ccc(OC)cc2)C1	726522490	MPCUHISSLAQGJE-QGZVFWFLSA-N	449.511	1.803	50	20	IDGD	
COC(=O)CCn1nc(C)c(C=NNC(=O)Cc2csc(N3CCOCC3)n2)c1C	727061063	BIZYAZQLXDYOPA-UHFFFAOYSA-N	434.522	1.049	50	20	IDGD	
CCCCNC(=O)NNS(=O)(=O)c1ccc(S(=O)(=O)N2C[C@H](C)C[C@@H](C)C2)cc1	728263262	WIFWXMQRJDLCRW-HUUCEWRRSA-N	446.595	1.646	50	20	IDGD	
Cc1sc(-c2ccco2)nc1C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	728323859	SXJHLVGGQCLDGA-OAHLLOKOSA-N	443.437	1.856	50	20	IDGD	
COc1ccc(S(N)(=O)=O)cc1C(=O)NNc1ccc(S(=O)(=O)C(F)F)cc1	728974498	QTBBZRALCYARID-UHFFFAOYSA-N	435.430	1.096	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2cccc(CO)c2)c1	729622008	WHRDETKYUFWAHN-UHFFFAOYSA-N	434.518	1.354	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)c2cc(S(=O)(=O)N3CCCC3)c(C)o2)cn1	729692158	MRXTZRYUENGRRA-UHFFFAOYSA-N	439.519	1.408	50	20	IDGD	
CC(C)n1nc(C(=O)NNS(=O)(=O)c2ccc3c(c2)C[C@H](C)O3)c2ccccc2c1=O	729964537	DMAODSXDYUBUTM-ZDUSSCGKSA-N	442.497	1.924	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2c[nH]nc2-c2cccnc2)c1	730419937	AOXAXMREWIPTTM-UHFFFAOYSA-N	442.501	1.577	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2ccc(OC)c(OC)c2)c(F)cc1F	732045105	CDOSCPDRBDCYAQ-UHFFFAOYSA-N	430.385	1.392	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)NCCN/C(O)=C1\N=CC=CC1=O	732467898	YNDJANGPWBQSAJ-WDWGUKLMSA-N	437.456	1.464	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1CNC(=O)NNC(=O)NCc1ccc(Cl)cc1	732990819	SZPWAMURZWFRLW-UHFFFAOYSA-N	439.925	1.804	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)NCc1ccccc1S(=O)(=O)N(C)CCO)c1ccccc1	733041645	ZSFUUEUJCRFNKY-SFHVURJKSA-N	448.545	1.324	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)N[C@@H]2CCC[C@H](C(=O)N(C)C)C2)nc1	734221607	NMSUMDQSNIBJEX-LSDHHAIUSA-N	440.570	1.385	50	20	IDGD	
COc1ccc([N+](=O)[O-])cc1NS(=O)(=O)c1cccc(C(=O)NNc2cnccn2)c1	734245193	LOCUCHASWKECHF-UHFFFAOYSA-N	444.429	1.951	50	20	IDGD	
C[C@@H]1CN(S(=O)(=O)c2ccc(C(=O)NNc3nccnc3Cl)cc2)C[C@@H](C)O1	734260757	LPXJBSVEGVEFHS-VXGBXAGGSA-N	425.898	1.685	50	20	IDGD	
CCOC(=O)c1cc(S(=O)(=O)NNC(=O)NCc2ccco2)cc([N+](=O)[O-])c1C	734806881	NVTYSBCNHYJHEK-UHFFFAOYSA-N	426.407	1.366	50	20	IDGD	
CC(=O)NCC(=O)N1CCc2cc(C(=O)NNC(=O)CNc3ccc(C)cc3C)ccc21	735688445	VLZONTHSVLTVLU-UHFFFAOYSA-N	437.500	1.202	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)c2cccc(N3C(=O)CCC3=O)c2)cc1C	736730661	QOQBIVLVENTFLH-UHFFFAOYSA-N	443.481	1.890	50	20	IDGD	
CCOC(=O)N1CCC[C@H](C(=O)OCC(=O)NNC(=O)c2cc(C)c(CC)s2)C1	736772844	UOBFELURAJCYME-ZDUSSCGKSA-N	425.507	1.792	50	20	IDGD	
CCCNC(=O)c1cccc(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c1	741171146	PEYPTTAKOKOPDC-UHFFFAOYSA-N	437.544	1.800	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCC[S@@](=O)C(C)(C)C)c1	741415320	KKCLHOKTPUUQAY-MUUNZHRXSA-N	446.595	1.208	50	20	IDGD	
Cc1ccc(S(=O)(=O)NNC(=O)NC2CCCC2)cc1S(=O)(=O)N1CCCCC1	743255490	DBQDXWQLFYZHPD-UHFFFAOYSA-N	444.579	1.605	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)N[C@@H]1CC(=O)N([C@H]2C[C@@H]2c2ccccc2)C1	743508949	VIWTURGORWRGNF-FMKPAKJESA-N	446.305	1.878	50	20	IDGD	
C[C@@H]1C[C@H](NC(=O)NNC(=O)c2csc(N3CCOCC3)n2)C(=O)N1c1ccccc1	743510014	OOQBLOWCDNMSRH-HIFRSBDPSA-N	444.517	1.118	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c(Cl)c1	743589699	WGTAQDKVQJAXJL-UHFFFAOYSA-N	446.899	1.722	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)ccc1O)c1cn(-c2cccc([N+](=O)[O-])c2)nn1	743733045	ADCZRJACTZYSFL-UHFFFAOYSA-N	447.205	1.718	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)c2cc(Br)ccc2O)cc1S(C)(=O)=O	743733137	CNUIMWODRXEQEO-UHFFFAOYSA-N	427.276	1.941	50	20	IDGD	
O=C(CCCNC(=O)c1ccccc1)NNc1ccccc1S(=O)(=O)N1CCOCC1	744620008	DHGNNPGPJNEZGH-UHFFFAOYSA-N	446.529	1.361	50	20	IDGD	
CC(=O)N1CCN(C(=O)CCNC(=O)NNc2c(F)cc(F)cc2Br)CC1	745828902	ASJHZHHCGRCDOC-UHFFFAOYSA-N	448.268	1.434	50	20	IDGD	
O=C(CSc1nnc(-c2ccco2)n1Cc1ccccc1)NNC(=O)N1CCOCC1	745992666	HRFJZCRGPUDSTF-UHFFFAOYSA-N	442.501	1.752	50	20	IDGD	
Cc1ccc(C(=O)NNS(=O)(=O)c2ccc([N+](=O)[O-])cc2Br)c(O)c1	746591017	HHXFANNZHBIYBF-UHFFFAOYSA-N	430.236	1.995	50	20	IDGD	
O=C(Cn1cc(C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cn1)NC1CCCCC1	746602356	AFTKZMVDJZIEJP-UHFFFAOYSA-N	435.488	1.593	50	20	IDGD	
O=C(CCN1CCN(C(=O)[C@@H]2CCCO2)CC1)NNc1ccccc1Br	748066144	LAMUMYAMORPLFN-INIZCTEOSA-N	425.327	1.606	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2cc(C(=O)O)cc(F)c2C)cc(OC)c1OC	751266328	AOKKWFWSBKMJDE-UHFFFAOYSA-N	442.421	1.481	50	20	IDGD	
COc1ccc(C(=O)NNC(=S)N[C@@H](C)C2CC2)cc1S(=O)(=O)NC1CCCC1	751618326	GNBUCPPQFBKKQM-LBPRGKRZSA-N	440.591	1.824	50	20	IDGD	
C[C@@H](NC(=S)NNC(=O)c1ccc(S(=O)(=O)NC[C@@H]2CCCO2)cc1)C1CC1	751620655	XOEXWZWFYNTERH-DOMZBBRYSA-N	426.564	1.051	50	20	IDGD	
Cc1cc(O)cc(=O)n1CC(=O)NNC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1	753076095	IQZFYKHMQSZIKX-UHFFFAOYSA-N	444.451	1.571	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNS(=O)(=O)c2cc3ccccc3o2)ccc1Cl	753981085	IFXRFZLTAVJWIB-UHFFFAOYSA-N	429.863	1.357	50	20	IDGD	
CC(=O)N[C@H](Cc1c[nH]c2ccc(Br)cc12)C(=O)NNC(=O)Cc1cc[nH]n1	755282723	PVCSUYRJDGCAOY-MRXNPFEDSA-N	447.293	1.091	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(NC(=O)NNC(=O)[C@@H](C)OCCOC)ccc1C	755395023	XWFNLBBOERCSNU-CQSZACIVSA-N	430.527	1.230	50	20	IDGD	
CN1CCN(c2ncc(C=NNC(=O)NC3CCN(C(=O)OC(C)(C)C)CC3)cn2)CC1	755730655	MQCMGHAOXBUIHY-UHFFFAOYSA-N	446.556	1.261	50	20	IDGD	
COC(=O)c1ccccc1S(=O)(=O)N1CCC(C(=O)NNc2cc(C)ccn2)CC1	755853999	LHEGRDUJPWXXPP-UHFFFAOYSA-N	432.502	1.721	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2ccn(CCN(C)C)n2)cc1Br	756765035	MNVGKDMILLRQML-UHFFFAOYSA-N	425.287	1.682	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)Nc1ccc(C[C@@H]2CC(=O)NC2=O)cc1	756814358	FRKNGJUJEBWYKB-CYBMUJFWSA-N	441.400	1.032	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N[C@@H]2CCCC[C@H]2O)cc1	757098725	DXJPDAJFSBJKFD-SQHFCFANSA-N	437.500	1.761	50	20	IDGD	
COc1ccccc1NC(=S)NNC(=O)CN1C(=O)NC2(C[C@@H](C)C[C@H](C)C2)C1=O	757635841	ZSVNEVXHBZENKZ-STQMWFEESA-N	433.534	1.760	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)Nc1ccccc1O[C@@H]1CCOC1	757677011	DQKWHZUWQVIZLG-MRXNPFEDSA-N	426.477	1.714	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)Nc2cncc(C(=O)OC)c2)c2ccccc2c1=O	757722321	YGZSFKIXFGSCQL-UHFFFAOYSA-N	438.444	1.845	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)[C@H](Sc1ccc(F)cc1F)c1ccccc1	758028009	BFVUHNPURAUOIG-BDJLRTHQSA-N	443.497	1.883	50	20	IDGD	
CCc1cccc2c3c([nH]c12)[C@@](CC)(CC(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1)OCC3	758145280	YQSROEFLOREUFI-OYHNWAKOSA-N	447.557	1.881	50	20	IDGD	
CC(C)(C)OC(=O)NCC(C)(C)C(=O)N1CCN(S(=O)(=O)CBr)CC1	758512483	MLTDUQDAMSIQPS-UHFFFAOYSA-N	442.376	1.364	50	20	IDGD	
O=C(Cn1cnc2ccccc21)NNC(=O)c1ccc(I)c(O)c1	760798560	AVYGXHKHGIVQLU-UHFFFAOYSA-N	436.209	1.808	50	20	IDGD	
COc1ccc2c(c1)[C@@H](C(=O)NNc1ccc(S(=O)(=O)N3CCN(C)CC3)cc1)CC2	762142206	KQEKHBDCHOCSSG-FQEVSTJZSA-N	444.557	1.804	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)NC[C@@H](O)c2ccco2)cc1	762314717	VTHMTKDEPNGDJW-JVCXIRSZSA-N	449.467	1.784	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H]2CC[C@@H]3SCCS[C@H]32)c1	763061432	GCZIKLKWQQFHNC-ILXRZTDVSA-N	444.604	1.261	50	20	IDGD	
Cc1ccc(C(=O)N2C[C@@H](C)C[C@H](C)C2)cc1NC(=O)C(=O)NNC(=O)c1ccncc1	763464942	REJQHHPDVRPYAL-GJZGRUSLSA-N	437.500	1.908	50	20	IDGD	
CCCC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)c1C	763549340	YCROPXDIWIFLHD-UHFFFAOYSA-N	426.429	1.862	50	20	IDGD	
COC(=O)c1ccsc1NC(=O)C(=O)NNC(=O)COc1ccc(C(C)(C)C)cc1	763599143	AVCICLMMYZXMNU-UHFFFAOYSA-N	433.486	1.997	50	20	IDGD	
CNC(=O)c1cc(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)ccc1Cl	763746264	RHVKOSVCZCXUTE-UHFFFAOYSA-N	443.891	1.238	50	20	IDGD	
COC(=O)CCCOc1ccc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCC3)cc1	763784763	HSIUXBNIACKBPH-UHFFFAOYSA-N	445.497	1.969	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2ccc(-n3cccn3)cc2)c2ccccc2c1=O	763785074	CXNSBYSCEOTDGB-UHFFFAOYSA-N	445.439	1.002	50	20	IDGD	
CO[C@@H](C)C(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)COc2ccc(C)cc2)c1	763811770	MUQNKGQFGJIDQT-AWEZNQCLSA-N	428.445	1.133	50	20	IDGD	
COC(=O)[C@@H](C)Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)cc1	763858492	SYJCOKNRASVAGZ-UONOGXRCSA-N	445.447	1.731	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccccc2S(C)(=O)=O)cc1	763860997	LOSXTQOVKXXEDT-CYBMUJFWSA-N	449.485	1.042	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1cccc(OC[C@H]2CCCO2)c1	763863766	BVIBNOBRVRTUOV-WMLDXEAASA-N	445.447	1.937	50	20	IDGD	
CO[C@H](C)C(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)c1	763871488	HBZBXGCUKDQVIB-CHWSQXEVSA-N	446.435	1.353	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)C(=O)Nc1cc(F)ccc1OC(F)F	763944737	OZIJYUMEOBEDKQ-UHFFFAOYSA-N	449.345	1.718	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)C(=O)Nc1ccc(OCC(F)F)cc1	763945079	UXWAWVTVESUMSU-UHFFFAOYSA-N	445.382	1.622	50	20	IDGD	
CC(=O)Nc1cc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)on2)c(F)cc1F	764003725	LSCSKTCSQLKHTH-UHFFFAOYSA-N	443.366	1.978	50	20	IDGD	
O=C(Cc1ccc2ccccc2c1)NNC(=O)C(=O)Nc1cccc(N2CCNC2=O)c1	764085699	SBSIULWFSJCJRY-UHFFFAOYSA-N	431.452	1.698	50	20	IDGD	
C[S@](=O)Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)ccc1Cl	764125080	RBLXCEYFSAYTMW-NDEPHWFRSA-N	444.296	1.977	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)ccc1O)C(=O)Nc1ccc(-n2ccnc2)nc1	764279992	KFXMODDHWWOCNX-UHFFFAOYSA-N	445.233	1.135	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)Cc2cc[nH]n2)sc2c1CC[C@@H](C)C2	764285804	MIJKEQXYDHURPA-SNVBAGLBSA-N	433.490	1.101	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)C(=O)Nc1ccccc1C(=O)N(C)C1CCCCC1	764297717	WEGHDMIUSYLTPM-UHFFFAOYSA-N	426.477	1.523	50	20	IDGD	
COCCNS(=O)(=O)c1c[nH]c(C(=O)NNc2nc(-c3cccnc3)nc(C)c2C)c1	764323486	CBNLBOPKGMZSNH-UHFFFAOYSA-N	445.505	1.165	50	20	IDGD	
O=C(NNC(=O)c1cc2ccccc2o1)C(=O)Nc1cnn(-c2cnc3ccccc3n2)c1	764330468	DTOSXDFYKQUNHX-UHFFFAOYSA-N	441.407	1.961	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)c(OCC(=O)N(C)C)c1	764345083	AAYVVSISXHRRPK-UHFFFAOYSA-N	448.863	1.221	50	20	IDGD	
CCNS(=O)(=O)c1ccc(CNC(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)cc1	764373662	LLLYAXRVKNBYJC-CYBMUJFWSA-N	438.481	1.422	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1)C(=O)Nc1ccn(CC(F)(F)F)n1	764387368	KUOKOYCJIHABSH-UHFFFAOYSA-N	439.329	1.374	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(-n2cccn2)cc1C(F)(F)F	764399603	KVPXHBXJLIRZBS-NSHDSACASA-N	443.382	1.029	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)[C@@H]2CN(C(=O)OC(C)(C)C)CCO2)cc1OC	764572227	LVCJUUQXYILNPA-KRWDZBQOSA-N	437.493	1.881	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNS(=O)(=O)c3ccc(C)c(F)c3)CC2)cc1	765124592	BWLRPUISKVSVNC-UHFFFAOYSA-N	434.537	1.570	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNc2nccnc2OC)c(Br)cc1F	766272382	ULUHTLHCSRHNLH-UHFFFAOYSA-N	442.201	1.255	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)C1	767778922	FPMNVXHSAWDPLI-RHSMWYFYSA-N	435.477	1.390	50	20	IDGD	
COc1ccc(NNC(=O)CNC(=O)[C@@H]2c3ccccc3C(=O)N2C2CC2)c([N+](=O)[O-])c1	768335198	HIRTXJXEHLZQGI-IBGZPJMESA-N	439.428	1.522	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)Cn1c(-c2cccc(Br)c2)noc1=O	768352525	YOAQUYZEEQKWAY-UHFFFAOYSA-N	445.273	1.964	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(=O)n(CC(=O)NNc2c(F)cccc2Cl)c1	770190339	GMPHAXJXQDSRMM-UHFFFAOYSA-N	430.889	1.815	50	20	IDGD	
C[C@H]1CN(Cc2cccc(CNC(=O)NNc3nc(O)c4cnn(C)c4n3)c2)CCO1	770355285	KNIBNZLXNAPWFE-ZDUSSCGKSA-N	426.481	1.116	50	20	IDGD	
CCOC(=O)N1CC[C@H](NC(=O)NNC(=O)c2ccc(OC)c(Br)c2)C1	770402968	HEWPEBYQSNECRQ-NSHDSACASA-N	429.271	1.633	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)[C@H]3CCN(c4cccc(Br)c4)C3=O)nc21	770980559	QSWJKANCFAGJJW-LLVKDONJSA-N	446.265	1.328	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1cccc(C(F)(F)F)c1)C(=O)NNC(=O)Cc1cccnc1	771012405	KXYAKOVYHONDIK-LLVKDONJSA-N	430.408	1.157	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1ccccc1S(C)(=O)=O	771427375	JYASXKDXHHCSOL-UHFFFAOYSA-N	440.861	1.370	50	20	IDGD	
O=C(CCn1cc(Br)cn1)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772195680	CWDAZLAROIAMSF-UHFFFAOYSA-N	428.674	1.153	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NCCN(C)S(=O)(=O)c1cccs1	772623667	HVLGDKNNVFZALT-LBPRGKRZSA-N	444.510	1.306	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)c1cccnc1OCC(F)(F)F	772899014	XZRLLQMPRVSYJN-UHFFFAOYSA-N	430.770	1.754	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)[C@H]2CCN(C(=O)CC)C2)c2ccccc2c1=O	773051138	TUMIFFQLFNGDLP-HNNXBMFYSA-N	427.505	1.606	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(I)ccc2C)o1	773497604	VRXIMGGGBBWJTE-UHFFFAOYSA-N	427.198	1.901	50	20	IDGD	
Cn1nc(-c2cc(F)cc(F)c2)cc1NC(=O)C(=O)NNc1ccc(-n2cccn2)nn1	773642971	DCUPTVVIEXOWDU-UHFFFAOYSA-N	439.386	1.423	50	20	IDGD	
CCCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNc2cnc3ccccc3n2)cc1	773718122	KTZLHAZDEVZURK-UHFFFAOYSA-N	428.474	1.863	50	20	IDGD	
Cc1ocnc1CNC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	775453579	HOMBRSSICIRBJZ-UHFFFAOYSA-N	435.487	1.990	50	20	IDGD	
O=C(NNc1ncccn1)Nc1ccc(CC(=O)N2CCN(c3ncccn3)CC2)cc1	775479867	KKSDTQYAYQFTGN-UHFFFAOYSA-N	433.476	1.307	50	20	IDGD	
CN(C)C(=O)[C@H]1CC[C@H](CNC(=O)CCC(=O)C(C#N)=C2N(C)c3ccccc3N2C)O1	775576726	NDPIEPZHRBDLHS-FOIQADDNSA-N	439.516	1.409	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)c2cc(-c3ccco3)nc3c(C(N)=O)ncn23)c1	776528593	QNNKDKAPPHSRNO-UHFFFAOYSA-N	440.441	1.249	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)NCc2cccc(O)n2)cc1	777460091	DKXYGHPSOVUIBQ-LFIBNONCSA-N	446.467	1.758	50	20	IDGD	
COc1ccc2nc(NNC(=O)[C@@H]3CC(=O)N([C@H]4CCS(=O)(=O)C4)C3)c(C)cc2c1	778482361	XQSPWQVERNTCQB-CABCVRRESA-N	432.502	1.031	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@@H](C(=O)NNc2ccccc2Br)[C@H](C)O)cc1	779537045	OBUKMINNCHAGPF-BLLLJJGKSA-N	442.335	1.929	50	20	IDGD	
CN1C[C@H](C(=O)NNC(=O)COc2ccc(Br)cc2)c2ccccc2C1=O	781855408	KAIZUSIAQOCPJA-INIZCTEOSA-N	432.274	1.845	50	20	IDGD	
Cc1ccccc1NC(=O)NNC(=O)C(=O)Nc1cccc(C(=O)N2CCSCC2)c1	783413284	GTPVXTLNCOYUPQ-UHFFFAOYSA-N	441.513	1.975	50	20	IDGD	
Cc1cc(C(=O)NCC(C)C)ccc1NC(=O)C(=O)NNc1ccc(-n2cccn2)nn1	783436298	KAURAPAGOHTKHM-UHFFFAOYSA-N	436.476	1.438	50	20	IDGD	
CN(NC(=O)CSc1nnc(S)s1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	783703584	AFACONGIVIRUAX-UHFFFAOYSA-N	448.596	1.555	50	20	IDGD	
CCc1nc2cc(NC(=O)C(=O)NNc3ccc(S(=O)(=O)NC4CC4)cc3)ccc2o1	784214418	WVNXDLZZYHXDIP-UHFFFAOYSA-N	443.485	1.913	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNc2cc(Cl)ccn2)ccc1S(=O)(=O)N(C)C	784856327	MKBRROMIDBPXPC-UHFFFAOYSA-N	427.870	1.076	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2ncc(F)cn2)n([C@H]2CCN(Cc3ccccc3)C2)n1	784957772	SEVZJABOPCIPNH-KRWDZBQOSA-N	438.467	1.649	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2ccc(Cl)c(C[S@](C)=O)c2)n1	785225106	CXUJBJNCENJJOU-LJAQVGFWSA-N	438.941	1.937	50	20	IDGD	
COCCOc1ccc(F)cc1S(=O)(=O)NNC(=O)c1cc([N+](=O)[O-])ccc1O	786727531	PZPXJVFXAPUDJE-UHFFFAOYSA-N	429.382	1.088	50	20	IDGD	
N#C/C(=C/c1ccc(O)cc1)C(=O)NCc1ccccc1CS(=O)(=O)N1CCOCC1	786785684	DBBVNWYVKWXWMT-MOSHPQCFSA-N	441.509	1.778	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1cnc(O)c2ccccc12	787125884	LEGJFYNQUMMTFN-UHFFFAOYSA-N	433.468	1.159	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NN=C2CCOC[C@H]2CN2CCCCC2)cc1	787155172	QCAIXOKVTQRZJX-GOSISDBHSA-N	436.578	1.610	50	20	IDGD	
CN(NS(=O)(=O)c1ccc(F)cc1C#N)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	788916558	PXYFNVZCFPUGRU-UHFFFAOYSA-N	441.485	1.495	50	20	IDGD	
COc1ccc(C(=O)CCCCCC(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)cc1	789173190	SWIFTXVJFYPFQN-OAHLLOKOSA-N	425.507	1.346	50	20	IDGD	
Cc1ccc(C)c(S(=O)(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1[N+](=O)[O-]	790390392	PNMCGNLZOJSSJK-UHFFFAOYSA-N	434.478	1.228	50	20	IDGD	
CCOC(=O)c1ncn(C2CCN(C(=O)/C(C#N)=C/c3cc(C#N)n(C)c3C)CC2)c1N	791236698	RAUWEGGLIADQRU-CXUHLZMHSA-N	435.488	1.931	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(CCC(=O)NNC(=O)c2cc(Br)c[nH]2)CC1	792025207	LBTWIBULWPWGHT-UHFFFAOYSA-N	444.330	1.481	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CN2CCc3c(cccc3S(=O)(=O)N(C)C)C2)cc1	792892837	RVYAPFGCUICMQX-UHFFFAOYSA-N	430.530	1.065	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccccc1S(=O)(=O)C(F)F)c1ccc2c(c1)OCCO2	794576022	DDYPLMKZIFGQQZ-UHFFFAOYSA-N	448.425	1.077	50	20	IDGD	
COC(=O)[C@@H]1CN(C(=O)OC(C)(C)C)CCCN1[C@H](C)C(=O)NNC(=O)CC(C)C	796682703	KVKLZEZVAAWVDW-CABCVRRESA-N	428.530	1.053	50	20	IDGD	
COC(=O)[C@H]1CN(C(=O)OC(C)(C)C)CCCN1[C@@H](C)C(=O)NNC(=O)CC(C)C	796682709	KVKLZEZVAAWVDW-LSDHHAIUSA-N	428.530	1.053	50	20	IDGD	
CCNC(=O)N(C)c1cccc(NC(=O)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c1	796990948	IWADYRAJEGSCTL-UHFFFAOYSA-N	428.405	1.160	50	20	IDGD	
CCNC(=O)N(C)c1cccc(NC(=O)C(=O)NNC(=O)COc2ccc(C)c(C)c2)c1	796991194	ACNIEJNOYOBWBG-UHFFFAOYSA-N	441.488	1.634	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)[C@](C)(O)Cn2c(C)cccc2=O)cc1Cl	802071651	JFAAXUWOSVSXSV-LJQANCHMSA-N	438.868	1.431	50	20	IDGD	
N#CCCNS(=O)(=O)c1ccc(C(=O)NNC(=O)Nc2ccc3c(c2)OCO3)cc1	802095922	FSSATCRWGLSMPC-UHFFFAOYSA-N	431.430	1.074	50	20	IDGD	
O=C(CNS(=O)(=O)c1cccc(F)c1)NNC(=O)Cc1nc(-c2ccccc2)cs1	802580003	ZPWGFAGGRPMLPW-UHFFFAOYSA-N	448.501	1.618	50	20	IDGD	
O=C(NNc1nccnc1C1CCC1)[C@@H]1CCCN1S(=O)(=O)c1cccc([N+](=O)[O-])c1	805463691	HCLIFSJMAONGOR-INIZCTEOSA-N	446.489	1.949	50	20	IDGD	
Cc1c(NC(=O)NNc2ccc(-n3ccnc3)nn2)cccc1S(=O)(=O)NC1CC1	806295315	ORJQWKWGNHISAB-UHFFFAOYSA-N	428.478	1.560	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2nc(-c3ccc(F)cc3)cs2)cc1	806973822	LCFPVBGOPQZQIS-UHFFFAOYSA-N	439.428	1.986	50	20	IDGD	
Cc1c(C(F)(F)F)nn(C)c1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1cccc(Cl)c1	807065354	JGPISYSQOWWMQQ-SECBINFHSA-N	447.801	1.954	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)[C@@H]1CCCC12OCCO2	807092279	BSIOFLIJCSPHRF-SFHVURJKSA-N	436.940	1.148	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NN=Cc1ccc(N)nc1)N(S(C)(=O)=O)CC2	807955989	KDSGKUSGJGESQX-INIZCTEOSA-N	447.517	1.080	50	20	IDGD	
CCS(=O)(=O)N1CCC([C@H](C)N(C)C(=O)NNC(=O)c2ccccc2OC)CC1	808268295	JCXMVVCGMGCECW-AWEZNQCLSA-N	426.539	1.432	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)ccc1O)C(=O)Nc1ccc2c(c1)C(=O)OC2	808935390	VMJTXGCUBJXSMA-UHFFFAOYSA-N	434.202	1.225	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CNS(=O)(=O)c2ccc(Cl)c(Cl)c2)c1	810347294	ZJQIZQYCBLVHHP-UHFFFAOYSA-N	427.269	1.605	50	20	IDGD	
COC(=O)c1c(F)ccc(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)c1F	810384957	LZOMUEZFPSXMEN-UHFFFAOYSA-N	446.410	1.290	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(C(N)=O)ccc2OCC(F)F)cc1	810386069	LATHAKIDNZMILN-UHFFFAOYSA-N	434.399	1.392	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCc2cc(C)nc(N3CCCC3)c2)c2ccccc2c1=O	812537903	JMGMCGBTJADKOI-UHFFFAOYSA-N	449.515	1.864	50	20	IDGD	
Cc1ccc(CN2C[C@H](C(=O)NNc3ccc(S(=O)(=O)N(C)C)cc3)CC2=O)cc1	812730908	FNSDAOMIJBROJV-QGZVFWFLSA-N	430.530	1.737	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)nnn1Cc1ccccc1F	815563805	OLZCDCIZFONJGU-UHFFFAOYSA-N	441.379	1.082	50	20	IDGD	
O=C(NNc1cccc(F)n1)C(=O)Nc1ccc([N+](=O)[O-])c(I)c1	815647381	IUDINKDQVIIWPH-UHFFFAOYSA-N	445.148	1.815	50	20	IDGD	
Cc1nn(C)c(C)c1S(=O)(=O)N[C@@H](C)C(=O)NNc1ncnc(Cl)c1C(C)C	816486206	TVJKLUUZRIDBMG-JTQLQIEISA-N	429.934	1.414	50	20	IDGD	
CC(=NNC(=O)c1cnccn1)c1ccc(S(=O)(=O)N2CCCC[C@H]2C(=O)O)cc1	818286068	OYDCZJBLQRNCKO-KRWDZBQOSA-N	431.474	1.258	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)CCC(=O)N2CC(=O)Nc3ccccc32)cc1	825537030	YFOGQZNKGRZGKO-UHFFFAOYSA-N	425.445	1.020	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)CN1C(=O)N[C@](C)(c2ccc(C)cc2)C1=O	825615420	VUICFTBRTYKCHL-JOCHJYFZSA-N	439.472	1.030	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)c2ccccc2-n2cnnn2)c2ccccc2c1=O	849201965	HQPKSMIXNICUHG-UHFFFAOYSA-N	446.471	1.637	50	20	IDGD	
CSC[C@H](C(=O)NNC(=O)COc1ccc(C)c(C)c1)N1C(=O)[C@H]2CCCC[C@@H]2C1=O	864002568	LQPPFRXMXFDSJX-OKZBNKHCSA-N	447.557	1.736	50	20	IDGD	
C[C@H]1CN(c2ccccc2C=NNC(=O)Cc2csc(N3CCOCC3)n2)CCO1	915953771	BJGZCSMOKXUNEU-INIZCTEOSA-N	429.546	1.898	50	20	IDGD	
COc1cc(-n2cnnn2)c(Cl)cc1C(=O)NNC(=O)[C@H](C)Oc1ccccc1F	916037534	RTWQODNXHSBOHF-JTQLQIEISA-N	434.815	1.692	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NCC3(c4ccccc4)CC3)nc2)CC1	916234711	OPQMLYNXTVWXHN-UHFFFAOYSA-N	444.561	1.376	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NCCCN1C(=O)NC2(CCCCC2)C1=O	916268747	MGYOKYFPAONYCJ-AWEZNQCLSA-N	449.483	1.568	50	20	IDGD	
CC(=NNC(=O)CCN1CCCCCC1)c1ccc(S(=O)(=O)NCCC(=O)O)cc1	916355963	RMEHYZKLRMQXGN-UHFFFAOYSA-N	438.550	1.546	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NN=C1CCSCC1)N(S(C)(=O)=O)CC2	916356292	QDSKFXLKDNEYBU-MRXNPFEDSA-N	441.575	1.952	50	20	IDGD	
CCOC(=O)c1cc(C(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)cc([N+](=O)[O-])c1	916563035	YKONMRRJKFNLHJ-UHFFFAOYSA-N	428.401	1.788	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)N[C@@H](C)Cn2ccnc2)c2ccccc2c1=O	916623195	IZKXWBHISHJTGB-HNNXBMFYSA-N	425.493	1.816	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc(C(=O)O)sc1Br)c1ccc(Cl)nc1	917746522	IZGRBRKVQMQLOO-UHFFFAOYSA-N	440.684	1.881	50	20	IDGD	
CC(C)C(=O)N1CCCC[C@@H]1C(=O)NNC(=O)c1ccc(CSc2nncn2C)cc1	917793632	YSOJSJURCFFNFR-QGZVFWFLSA-N	444.561	1.906	50	20	IDGD	
CCCC(=O)N1CCCC[C@H]1C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	918142612	IQKRHALRJGUHKA-FQEVSTJZSA-N	429.565	1.527	50	20	IDGD	
CC(C)n1nc(C(=O)NNS(=O)(=O)c2cccc(F)c2[N+](=O)[O-])c2ccccc2c1=O	918399405	NJZCSICZGUZGNA-UHFFFAOYSA-N	449.420	1.648	50	20	IDGD	
O=C(NNC(=O)c1cn(-c2ccccc2)nc1-c1cccnc1)N[C@H]1CCS(=O)(=O)C1	919885367	OVCNXIMNGLZGOL-HNNXBMFYSA-N	440.485	1.065	50	20	IDGD	
Cc1ccc(-n2c(N(C)C)nc(C=NNC(=O)N[C@H]3CCS(=O)(=O)C3)c2Cl)cc1	920384003	ILUXQCBVXSOMOA-ZDUSSCGKSA-N	438.941	1.720	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)c2cc(F)ccc2NS(C)(=O)=O)cc1OC	920425576	MYSCKHRJZWJQNS-UHFFFAOYSA-N	425.438	1.679	50	20	IDGD	
O=C(CN1CCCC1=O)NNC(=O)C1CCN(c2ncc(C(F)(F)F)cc2Cl)CC1	920827419	YHCJFBUMVOZZRN-UHFFFAOYSA-N	447.845	1.740	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)c1ccc(NC(=O)c2ccc(O)nc2)cc1	1115856789	HKSRLTAAPAMMER-GOSISDBHSA-N	434.408	1.641	50	20	IDGD	
COc1cc(Cl)c(Br)cc1C(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1	1116767145	WIJALGHTMDZNPE-SSDOTTSWSA-N	440.703	1.242	50	20	IDGD	
Cc1ccn(-c2cccc(C(=O)OCC(=O)NNC(=O)[C@@H]3COc4ccccc4O3)c2)n1	1318263804	LWNDHRZCDFFKPY-IBGZPJMESA-N	436.424	1.325	50	20	IDGD	
CNS(=O)(=O)c1cccc([C@H](C)NC(=O)NNC(=O)c2cncn2-c2ccccc2)c1	1321475308	VKBQMYKVVPPUHA-AWEZNQCLSA-N	442.501	1.486	50	20	IDGD	
C[C@H](CS(=O)(=O)c1ccc(F)cc1)C(=O)NNC(=O)c1cncn1-c1ccccc1	1323703374	BCQGBQQWTBKAKK-CQSZACIVSA-N	430.461	1.882	50	20	IDGD	
CNS(=O)(=O)c1ccc(CC(=O)NNC(=S)Nc2ccc(OC(C)C)cc2)cc1	1329899757	HCVBXVKSDHHIBB-UHFFFAOYSA-N	436.559	1.942	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c([N+](=O)[O-])c1	1344512027	LFPOAXSWSJKXMT-UHFFFAOYSA-N	442.476	1.968	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc4n(n3)CCCC4)C2)C1	1778564137	GQHQEIHKMNTXRI-SCLBCKFNSA-N	425.327	1.446	50	20	IDGD	
O=C(c1ccn2nccc2c1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1778734183	GDKONMIEGOIBQH-RHSMWYFYSA-N	425.258	1.468	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cnccc3C(=O)NN)C2)o1	1779371554	ZFJNGOOPEILCEA-XMSQKQJNSA-N	441.488	1.028	50	20	IDGD	
CCCC(=O)N[C@@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](Cl)COC)C2	1779519707	HSIPSXBVDLYUHH-QCBUCWTNSA-N	431.961	1.059	50	20	IDGD	
O=C(c1ncon1)N1CC[C@]2(C1)CN(C(=O)[C@H](Br)Cc1ccccc1)CCO2	1779871725	GGGOTPVPQQHUFF-BEFAXECRSA-N	449.305	1.519	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(Cl)ncn2)C1	1779898865	UOMZJEMZKJBANP-RVZJWNSFSA-N	431.320	1.511	50	20	IDGD	
COCc1c[nH]c(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)c1	1780073460	HNVABTAKIRWQIL-FZKQIMNGSA-N	428.327	1.636	50	20	IDGD	
COc1ccnc(C(=O)N2CC[C@]3(CN(C(=O)CCBr)CCO3)C2)c1OC	1780447004	ZZXQIIIEXXTSIL-SFHVURJKSA-N	442.310	1.327	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccccc2C(N)=O)C1	1780992382	FLARERJSZQYNLF-CSODHUTKSA-N	437.924	1.167	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3c(-c4ccncn4)noc3C)CCO2)C1	1781221094	JKWLGHHDDVWPIE-XOBRGWDASA-N	433.896	1.901	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781325259	LPYIZTVDTHUEHZ-BREBYQMCSA-N	430.112	1.538	50	20	IDGD	
Cn1cc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](F)Br)C3)C2)c2cccnc21	1781331852	QZWCDLHAVWHPFW-KSSFIOAISA-N	439.285	1.707	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781335495	ZXNAUAWCQHEMTL-WBMJQRKESA-N	438.294	1.032	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1	1782008999	NOAIKXZCZUJKAY-ACJLOTCBSA-N	433.288	1.449	50	20	IDGD	
COc1cccc(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)C(Cl)Cl)C2)n1	1782214619	LRTZUCVEUHVPSJ-AUUYWEPGSA-N	430.332	1.950	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CNC(=O)OC)C1	1782395967	MPOKSRXAPMMUIN-PBFPGSCMSA-N	434.331	1.030	50	20	IDGD	
CCOC(=O)C(C)(C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCBr)C2	1783226726	SRSWQEIDCBRGKW-AUUYWEPGSA-N	447.370	1.875	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H]3CCCN3C(C)C)C2)C1	1784806797	KXAUJTRDRHTGNU-GJYPPUQNSA-N	430.387	1.863	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3csc(N)n3)[C@H]2C1	1786912835	MCPJQLLFTPZGSQ-KQXIARHKSA-N	431.356	1.492	50	20	IDGD	
CCOC(=O)[C@@H]1CCC[C@H](C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]3C2)C1	1787443360	GODMLDSIXJPPRC-FQMQPWHVSA-N	432.920	1.870	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]2C1)C1CC1	1787446234	ZPBRVILMTPMPNA-QXKUPLGCSA-N	447.935	1.804	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cn4ccccc4n3)[C@H]2C1	1787842027	SLBSKEMSGZQHIQ-HOSILWTGSA-N	435.322	1.711	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C[C@H](N)c3cccnc3)C[C@@H]21	1788764099	LCTCNXSMTLVDBP-VJANTYMQSA-N	434.613	1.303	50	20	IDGD	
C[Si](C)(C)OCC(=O)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1	1789648915	REJKTBAWHDSOKD-UHFFFAOYSA-N	440.381	1.966	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3CC(O)C3)C[C@@H]21	1790693580	KXBBVEJUHGRBQL-CMYREYTMSA-N	445.466	1.622	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4nn(C)cc4c3)C[C@@H]21	1791256876	KWWOSDSNSQITDF-XPYUAMARSA-N	434.924	1.420	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3CCC(O)CC3)[C@H]2C1	1791410294	PZSWYQXHNKGDHX-NMUJTLPQSA-N	431.371	1.691	50	20	IDGD	
Cn1cc(CC(=O)Nc2ccc(C3(NC(=O)c4ccc(B(O)O)cc4)CCC3)cc2)cn1	1791905095	OGKCBIAJALHLQE-UHFFFAOYSA-N	432.289	1.090	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4c(c3)CCCO4)[C@H]2C1	1791914469	NILHGZAPPJMYBR-JPLJXNOCSA-N	436.936	1.859	50	20	IDGD	
CCOc1ncccc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)CBr)C2	1792378229	LKLNTMDWAQRRRJ-HGTKMLMNSA-N	440.338	1.715	50	20	IDGD	
CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(C)(C)CCl)C2)C(=O)c1ccccc1	1793227508	AMWFKORCHVJDJE-IZZQQSIFSA-N	435.952	1.613	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@](C)(O)C(F)(F)F	1793693892	AWFRQWMSVFVSQB-AYDOGRCQSA-N	431.249	1.063	50	20	IDGD	
COc1ccc([C@H](C)C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)cc1	1796187890	JKUCADAVWHBQRL-KQLYMOGASA-N	436.317	1.431	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)[C@H]1C[C@H]1c1ccc(F)cc1	1796189570	DMXFZZKAFICUPS-WIYBCGNWSA-N	436.292	1.561	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CN(Cc3ccccc3)CCO1)C2)[C@H](F)Cl	1796365056	PPOUQXKWMMADCH-PJVZLEMVSA-N	439.915	1.011	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(O)(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](F)Cl)CC1	1796802933	IUGAPEKQCKFBMR-XGUBFFRZSA-N	447.935	1.921	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccn(C(F)F)n1)C2	1796891946	QGOHPOFGXMHGGO-MGGJZVGQSA-N	447.446	1.664	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1=COCC1)C2	1798522974	KUNGYBUPMJEBQH-CCWDJLKJSA-N	445.428	1.028	50	20	IDGD	
Cc1nn(C)c(C)c1CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@](C)(Cl)CCl	1799278513	LMYXJQSZARYVDN-CSHUHZATSA-N	431.364	1.405	50	20	IDGD	
Cc1ccc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Br)cn1	1799344204	BXUDZTAWJYYGLR-YALNPMBYSA-N	428.302	1.603	50	20	IDGD	
CC(=O)N[C@@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](O)CCl)C2)c1cccc(Cl)c1	1799836518	OZMNEKRSPVKQJQ-CWQOZTLDSA-N	442.343	1.755	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1n[nH]c3c1CCCC3)C2	1800639634	KXNRKVVYCDYSDH-FAXLKDOZSA-N	439.354	1.665	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1Cc3ccccc3O1)C2	1800640745	GBEBNFGPJBYWEF-FZMWSMFESA-N	437.334	1.753	50	20	IDGD	
CNc1nsnc1C(=O)NC[C@@H]1CCN(C(=O)[C@@H](Cl)COC)[C@@H]1c1cccnc1	1802477820	LXXFKGRGUSCZHQ-KCQAQPDRSA-N	438.941	1.548	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@H]1CCN(C(=O)c2ccnnc2O)[C@@H]1c1cccnc1	1803013564	DZHZMRKEWZZHHX-XNRPHZJLSA-N	448.321	1.928	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)Cc2cnc3ccccn23)[C@H]1c1cccnc1)[C@H](O)CCl	1803137766	RNBNUKWQRXKGIP-CDXJDZJCSA-N	441.919	1.578	50	20	IDGD	
O=C(CN1CCOC1=O)NC[C@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1	1803340877	ZZKUFMJLVMCCFT-PBHICJAKSA-N	439.310	1.325	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)N1CC[C@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]1c1cccnc1	1808302930	MXHZKSCIYMPBLB-GJRWTSMGSA-N	444.363	1.771	50	20	IDGD	
O=C(CCCC(F)(F)F)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1	1809974910	HGRPYQYHILFIPP-UHFFFAOYSA-N	440.271	1.944	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)on1	1810300385	YDGHUJCXMYBISS-DNVCBOLYSA-N	449.471	1.010	50	20	IDGD	
Cc1nc(C)c(C(=O)NC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)o1	1810876384	HJXYGWJCTDGBTR-FXAWDEMLSA-N	442.520	1.379	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2nccnc2C(N)=O)[C@@H]1c1cccnc1	1811191966	UHKBLGSRAUZEEI-KEYYUXOJSA-N	430.896	1.308	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)[C@H](C)CS(C)(=O)=O)[C@@H]1c1cccnc1	1813028507	RLVDATHFAAPVLN-BSWAZPDLSA-N	445.969	1.022	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2nc[nH]c2[N+](=O)[O-])[C@@H]1c1cccnc1	1813030204	FDYXRFBMKVPVGY-KCQAQPDRSA-N	436.856	1.286	50	20	IDGD	
Cn1nc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)[C@H](F)Br)[nH]n2)cc1O	1816123235	LUQPEFWOXCNXFZ-MFKMUULPSA-N	429.250	1.845	50	20	IDGD	
O=C(CCBr)Nc1cc([C@@H]2CCCCN2C(=O)CCN2CCOCC2)[nH]n1	1816782500	RCBBOLYXRKHTBP-HNNXBMFYSA-N	442.358	1.909	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)CCCn2cccc2)[nH]n1)c1ccc(B(O)O)cc1	1817475271	NACKWLIXQZQUNZ-HXUWFJFHSA-N	449.320	1.677	50	20	IDGD	
CC(C)O[C@@H](C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1	1817476141	HHKSOKZRHHEZBI-KSSFIOAISA-N	428.298	1.209	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@H](O)CCl)CC2)c1ccc2cnccc2n1	1818189257	RESQAYRNZJMRIP-IAQYHMDHSA-N	431.905	1.912	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccncc2F)n[nH]1	1818397571	JOJUJQMMGOLJOB-MRXNPFEDSA-N	431.472	1.623	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H]1CCC=CO1)CC2	1819797838	MBNYZIDGICJIND-XHDPSFHLSA-N	442.501	1.060	50	20	IDGD	
O=C1Cc2cccc(C(=O)Nc3cc([C@@H]4CCCCN4C(=O)[C@H](O)CCl)[nH]n3)c2N1	1821512771	IJQSVAOIFJQBDJ-LSDHHAIUSA-N	431.880	1.810	50	20	IDGD	
C[C@H](Br)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](C)CS(C)(=O)=O)[nH]n1	1822183669	GIOPZFDJLXOLHZ-GMXVVIOVSA-N	449.371	1.866	50	20	IDGD	
Cc1cc(CC(=O)N2CCCC[C@@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)on1	1822410369	ICQFARFVOHOZAU-MRXNPFEDSA-N	431.497	1.314	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(F)nc2)[nH]n1	1822415273	XQHXQPMJJQDERX-HNNXBMFYSA-N	431.472	1.623	50	20	IDGD	
N#Cc1cc(CC(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@H](O)CCl)CC3)ccc1F	1822960428	VMNMNVXQICKCIB-SWLSCSKDSA-N	436.896	1.908	50	20	IDGD	
O=C(N[C@@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1)c1ccc(O)nn1	1823001683	JBJWWQDLQUKSSO-KSBSHMNSSA-N	430.259	1.555	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3ccc4nn[nH]c4c3)sc2C1	1824416717	XWGGIGUSJAEXRF-WDEREUQCSA-N	434.909	1.894	50	20	IDGD	
O=C(Cn1cccc([N+](=O)[O-])c1=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](F)Cl)CC2	1824720947	GIFNBOXTLULIPV-ISVAXAHUSA-N	443.844	1.360	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)CC2CCOCC2)CC1	1826733144	VYDVUWGXEQNACT-QFIPXVFZSA-N	442.365	1.416	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H](N)CCC(N)=O)CC1	1826821091	SQDRPECCUSSYMJ-KHYOSLBOSA-N	435.396	1.435	50	20	IDGD	
O=C(CS(=O)(=O)N1CCCC1)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](F)Cl)CC1	1827613953	WLJOBICATMKXKG-DOTOQJQBSA-N	437.965	1.566	50	20	IDGD	
CC(=O)C[C@@H](C)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1	1828925273	IFUBXIVDHHMTKT-FOIQADDNSA-N	443.548	1.534	50	20	IDGD	
Cc1nc(C)c(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)o1	1829295161	YVRRKAJKISQSHK-FQEVSTJZSA-N	439.321	1.518	50	20	IDGD	
C[C@@H]1C[C@@]1(C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1	1830218847	HOWVJTTUOGOVJB-NFHUAXAMSA-N	427.549	1.965	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1830533154	GZOFBCITQUNYGR-CXAGYDPISA-N	439.778	1.739	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)C3=COCCC3)C2)C1	1830544464	YWWUJVFGQGODQB-RDTXWAMCSA-N	431.327	1.168	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cn4ncccc4n3)C2)C1	1831646433	JYDGGVHLHAATLS-YWZLYKJASA-N	435.912	1.207	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnn4cccnc34)C2)C1	1831651249	OEUZFLCSKCTMKN-UZLBHIALSA-N	435.912	1.207	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccn3c(O)nnc23)CC1	1831832715	HHTNUKYWHCAULD-IRXDYDNUSA-N	449.939	1.922	50	20	IDGD	
Cc1cccnc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)Br)C2)C1	1831840364	AREROODRMHCBKV-KSSFIOAISA-N	426.311	1.243	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc([N+](=O)[O-])[nH]2)CC1	1831873848	APNXTHSKBLRVGT-QGZVFWFLSA-N	448.524	1.529	50	20	IDGD	
NC(=O)c1nccnc1C(=O)N1CCC([C@H]2CCCCN2C(=O)C(Cl)Cl)CC1	1831879771	ZWDDMLSOFGCBEI-GFCCVEGCSA-N	428.320	1.613	50	20	IDGD	
C[C@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)c3cnn(C)c3)CC2)CC1	1833262607	YCWRASGHWALCSC-CQSZACIVSA-N	440.386	1.636	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3ccc4c(c3)OCO4)CC2)CC1)[C@@H](O)CCl	1833310556	RLTWTZSSBDGLAL-KRWDZBQOSA-N	437.924	1.200	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)CCl)CC2)CC1	1833310721	YYSIMCRZNKUZFL-SFHVURJKSA-N	447.967	1.428	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnoc3C)CCO2)C1	1834319275	QCKRIVVMPAZOCM-RHSMWYFYSA-N	430.299	1.227	50	20	IDGD	
COc1ncc(C(=O)N2CCO[C@@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)cc1C	1834575641	YBMNUVUACQQDKX-NRFANRHFSA-N	439.940	1.734	50	20	IDGD	
Cc1ccc(CC(=O)N2CCOC[C@]3(CN(C(=O)CCBr)CCO3)C2)cc1	1834822365	JLUMHHSJUSWYAI-FQEVSTJZSA-N	439.350	1.779	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NC1CCN(C2CCN(C(=O)[C@@H](F)Cl)CC2)CC1	1834869021	QMZRQEHHIWAMNN-QGZVFWFLSA-N	428.892	1.115	50	20	IDGD	
C/C=C(\C)C(=O)NC1CCN(C2CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CC2)CC1	1836525234	ASOOBUCSCHWYKH-AKIMIPFTSA-N	442.564	1.658	50	20	IDGD	
COC(=O)CSCC(=O)N1CCC(OC2CCN(C(=O)C(Cl)Cl)CC2)CC1	1836873443	VNXURVSGWRDWFS-UHFFFAOYSA-N	441.377	1.695	50	20	IDGD	
O=C(c1cccn2cncc12)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1837114046	YQABEHGWGGADBF-SFHVURJKSA-N	427.288	1.208	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)c3cncnc3)CC2)CC1	1837509454	BQJWQYJUZYMCSU-CYBMUJFWSA-N	425.327	1.872	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)ccn1	1837940674	LTJVUUYFVYVQIG-RHSMWYFYSA-N	430.274	1.151	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc(C(C)(C)C)cn3)C2)C1	1839144505	CDNUSIPHHANCIX-QVKFZJNVSA-N	438.956	1.862	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccnn3-c3ccccc3)C2)C1	1839145063	SIBZCUIQJAZJJA-GCJKJVERSA-N	446.935	1.960	50	20	IDGD	
O=C(Cc1ccccc1O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1839908900	GAJWAOCLRGULPC-AEFFLSMTSA-N	445.285	1.082	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ncccc3F)C2)C1	1839965770	KEJKEQTUTKEUJK-FZKQIMNGSA-N	444.301	1.464	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccc(F)c(F)c3)C2)C1	1840151458	BZFRZYFOQZTIKZ-MGPUTAFESA-N	446.878	1.218	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccc(F)cc3F)C2)C1	1840155546	DZHPWVZJUQEPSP-OXJNMPFZSA-N	446.878	1.218	50	20	IDGD	
O=C(CC12CCCN1CCC2)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840189436	QKNDOFBAAZELMS-LJQANCHMSA-N	434.364	1.265	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3ncc[nH]3)CCO2)C1	1840325783	SKASLRXQEDSDNX-QZTJIDSGSA-N	433.336	1.035	50	20	IDGD	
CC[C@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1	1841354774	VSZXRIUBOZKWIW-KKUMJFAQSA-N	431.961	1.729	50	20	IDGD	
O=C([C@@H](F)Br)N1CC2(CCCN2C(=O)Cn2ccc3sccc3c2=O)C1	1842020325	ICOKYDFJUZCIGD-CQSZACIVSA-N	442.310	1.957	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2cnc3ccccn23)C1	1843715906	SQWCQULDOXJDCM-MFKUBSTISA-N	433.472	1.285	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@](C)(C(=O)N2CCCC23CN(C(=O)[C@H](O)CCl)C3)C1	1843867222	HZLRFWBXSQWJJQ-AUUYWEPGSA-N	429.945	1.437	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)c2cccc(C(F)(F)F)c2)C1	1844917567	OWBLRWODMRLJIH-UHFFFAOYSA-N	432.207	1.516	50	20	IDGD	
CC(=O)N[C@@H](C)C(=O)N1CC2(CCCN2C(=O)[C@H](Br)Cc2ccccc2)C1	1845942422	FKKCMAIYSRMUTM-WMLDXEAASA-N	436.350	1.721	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC12CN(C(=O)c1cc(S(C)(=O)=O)ccc1F)C2	1846178652	KVWPVULZVNPLDM-NSHDSACASA-N	447.326	1.830	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H]1CC(=O)N(c2cccc(OC)c2)C1	1847218856	DFXSJEYURXTBRI-OAOYMFHYSA-N	449.935	1.504	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1[C@H](C(=O)N1CC[C@H]3[C@@H]1CCN3C(=O)[C@@H](O)CCl)C2	1847568112	BGBBOBBLZDVLLS-FQMQPWHVSA-N	441.956	1.576	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)nc2ccccc21	6153514	TWNGTVWFXBBRMH-UHFFFAOYSA-N	441.513	1.362	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)[C@H]1CCCN(C(=O)c2ccc(F)cc2)C1	12611126	ONTCYAXFCYEPHC-INIZCTEOSA-N	429.448	1.913	50	20	IDGD	
Cc1ccc(C)c(NC(=S)NNC(=O)Cn2c(=O)ccn(Cc3ccccc3)c2=O)c1	14806283	RYCFDTMNCREXRH-UHFFFAOYSA-N	437.525	1.693	50	20	IDGD	
CCCn1c(=O)n(CCC(=O)OCC(=O)NNC(=O)c2ccc(C)cc2)c2ccccc21	16541647	AZZQMABPEGGZJJ-UHFFFAOYSA-N	438.484	1.916	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)CCNC(=O)c2ccc([N+](=O)[O-])cc2)c1C	196399351	VFCXQVNEMAQZSR-OAHLLOKOSA-N	428.445	1.946	50	20	IDGD	
O=C(CCCCC/N=C1/NS(=O)(=O)c2ccccc21)NNC(=O)NC1CCCCC1	725988404	SRDYUUJUMODFQK-UHFFFAOYSA-N	435.550	1.949	50	20	IDGD	
COCCCNC(=S)N(C)NC(=O)CSc1nnc(C)n1-c1ccc(OC)cc1	726076968	KACZOQGCOZMPET-UHFFFAOYSA-N	438.579	1.550	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)NCc2ccc([C@]3(C)NC(=O)NC3=O)cc2)c1	726283098	WOEVTNBGBIANNG-QFIPXVFZSA-N	439.472	1.267	50	20	IDGD	
O=C(NCCCn1nc2n(c1=O)CCCC2)NNC(=O)c1c(Cl)cccc1Cl	727842080	OQFGIKVRMZYCNO-UHFFFAOYSA-N	427.292	1.722	50	20	IDGD	
CCOc1ccc(C(=O)CCC(=O)N([C@@H]2CCS(=O)(=O)C2)N(C)C)cc1OCC	728179620	NFCYONMZBWHUDF-MRXNPFEDSA-N	426.535	1.939	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)c2cccc(CN3CCS(=O)(=O)CC3)c2)cc1	728204574	XRFIQOIKZQLENK-UHFFFAOYSA-N	430.530	1.099	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NCc3cc(F)ccc3F)nc2)CC1	729622298	WIXXOQVCBMOZBT-UHFFFAOYSA-N	440.476	1.122	50	20	IDGD	
C[C@H]1CCCCN1S(=O)(=O)c1cccc(C(=O)NNC(=O)COc2ccccc2O)c1	730782513	OUIYBHFGJDIDHM-HNNXBMFYSA-N	447.513	1.795	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)Nc1cccc(S(=O)(=O)N2CCCCC2)c1	730893822	QGVUXTXACMKPIT-UHFFFAOYSA-N	448.501	1.799	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)[C@H]2CCCN2S(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1	732932836	PVYNVTKFSPPMNR-GOSISDBHSA-N	446.485	1.772	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)NNC(=O)[C@@H]1CC(=O)N(c2ccc3c(c2)OCCO3)C1	733004688	PXVSOYUILHRHAW-CQSZACIVSA-N	444.875	1.995	50	20	IDGD	
CN(C)C(=O)c1cccc(C(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)c1	734824942	OEIKOHVLJDOOAO-UHFFFAOYSA-N	433.509	1.732	50	20	IDGD	
CCOC(=O)N1CCC[C@H](C(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)C1	734824955	OOAKNRHORSVCSD-AWEZNQCLSA-N	441.529	1.585	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2cc(C(=O)NNc3cccnn3)ccc2Cl)C[C@@H](C)O1	736701762	DEPVJRJNKYATRX-TXEJJXNPSA-N	425.898	1.685	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)c2ccc(CS(C)(=O)=O)cc2)cc1C	736735816	QSAYZRNWGWQMGM-UHFFFAOYSA-N	438.527	1.782	50	20	IDGD	
CSC[C@H](C)NC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	737060987	DTLUQKGVXAEDSS-AWEZNQCLSA-N	436.559	1.861	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2ccc(Cl)cc2Cl)nc2c1c(=O)n(C)c(=O)n2C	737768284	OWOMSYFRBMZJRO-UHFFFAOYSA-N	436.255	1.322	50	20	IDGD	
CN(C)c1nccc(NNC(=O)CCNS(=O)(=O)c2ccc(OC(F)(F)F)cc2)n1	740102151	CZVHSUINXFIAND-UHFFFAOYSA-N	448.427	1.253	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)[C@H]2CCCN(C(=O)COc3ccccc3)C2)cc1	741284398	PPOZUVVUCDYTDP-KRWDZBQOSA-N	440.500	1.572	50	20	IDGD	
O=C(NCc1cccc(C(F)(F)F)c1)NNC(=O)[C@H]1CC(=O)N(CC(F)(F)F)C1	742453842	ZZRTZBABLQUSTH-JTQLQIEISA-N	426.317	1.947	50	20	IDGD	
C[C@@H](CC(=O)NNC(=O)C(C)(C)c1ccccc1)/N=C1/NS(=O)(=O)c2ccccc21	742656637	DAOQXSKRVKYHFP-AWEZNQCLSA-N	428.514	1.629	50	20	IDGD	
CCS(=O)(=O)c1ccccc1C(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	742709335	CPURXUUUIIHDQJ-UHFFFAOYSA-N	435.414	1.006	50	20	IDGD	
O=C(NNC(=O)c1cccc(CN2C(=O)CNC2=O)c1)c1cccc(Br)c1	742771160	FEUXICYKTCENLX-UHFFFAOYSA-N	431.246	1.576	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=S)N[C@@H]1CCc2ccccc2C1	742977751	HOARFKODSGQAAN-MRXNPFEDSA-N	431.587	1.955	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2cccc(Br)c2)ccc1O	743263307	BSBKNQHCBGOQNC-UHFFFAOYSA-N	429.248	1.565	50	20	IDGD	
C[C@@H]1CN(C(=O)NNC(=O)CNC(=O)c2cccs2)CCN1C(=O)OC(C)(C)C	743576602	HBTQGIMABOFFFC-GFCCVEGCSA-N	425.511	1.160	50	20	IDGD	
CCc1cccc(C)c1NC(=S)NNC(=O)CCN1C(=O)[C@H]2[C@H](C1=O)[C@H]1CC[C@H]2O1	743820495	DOMOYVIJXVRRNJ-MUIFIZLQSA-N	430.530	1.428	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)CN2C(=O)Cn3c(cc4ccccc43)C2=O)c1	743841898	DQVOSQZJTFNNKP-UHFFFAOYSA-N	434.452	1.467	50	20	IDGD	
O=C(NCc1ccccc1CN1CCCC1=O)NNC(=O)c1cc([N+](=O)[O-])ccc1O	745477601	MMMXBXWPHISESK-UHFFFAOYSA-N	427.417	1.567	50	20	IDGD	
COc1ccc(N(C)S(=O)(=O)c2cccc(C(=O)NNC(=O)c3cccn3C)c2)cc1	747597303	MESIFVGLYNZNIE-UHFFFAOYSA-N	442.497	1.934	50	20	IDGD	
O=C(CNC(=O)c1cccc(F)c1)NNc1ccc(S(=O)(=O)Nc2nccs2)cc1	747942524	HTUXAXHYUFMTKE-UHFFFAOYSA-N	449.489	1.956	50	20	IDGD	
N#CCCCS(=O)(=O)c1ccc(C(=O)NNC(=O)Cn2cnc3ccccc32)cc1	748214872	WWGCBGNJPPRNFH-UHFFFAOYSA-N	425.470	1.575	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)[C@H](C(C)C)N2CCCC2=O)c2ccccc2c1=O	748546737	OMRRZPXRMBRFFY-FQEVSTJZSA-N	441.532	1.995	50	20	IDGD	
COc1ccc(C(=O)NCC(=O)NNc2nc(Br)cn3ccnc23)cc1OC	750247559	DVTNAYFAHPRZAK-UHFFFAOYSA-N	449.265	1.382	50	20	IDGD	
O=C(Cn1cc(Br)c(O)nc1=O)NNC(=O)c1ccc(Cl)cc1Cl	751619256	UYZYPAHXZHQEIN-UHFFFAOYSA-N	436.049	1.479	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)C1CC1	752004117	NVAZJNGXHGBKJF-INIZCTEOSA-N	432.525	1.534	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)N[C@@H]3CCOC3)c2)c(C)c1	752703904	LSUFQZOZZJRYMI-MRXNPFEDSA-N	432.502	1.837	50	20	IDGD	
CCn1cc([C@@H]2C[S@@](=O)CCN2C(=O)NNC(=O)c2cc(Br)c[nH]2)cn1	753035438	ZIZVWRDDKNNFNK-NRRJATNASA-N	443.327	1.154	50	20	IDGD	
O=C(NNC(=O)C(=O)Nc1ccccn1)N[C@@H]1CCC[C@H]2CN(Cc3ccccc3)C[C@H]21	753314981	CUKAZVKKKTZVNX-IPMKNSEASA-N	436.516	1.651	50	20	IDGD	
C[C@H](C[S@@](C)=O)NC(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	753359665	RJIKPOZLXIWXMV-JKGBWWFKSA-N	441.513	1.156	50	20	IDGD	
COc1ccc(CCCC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c(OC)c1	754014675	MPGLYAQCMWIGIB-UHFFFAOYSA-N	427.505	1.881	50	20	IDGD	
O=C(NCCNS(=O)(=O)Cc1ccon1)NNc1cc(C(F)(F)F)ccc1F	754653665	PCRYXDQQFKQJCS-UHFFFAOYSA-N	425.364	1.578	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2ccc(C)o2)cc1S(=O)(=O)N1CCOCC1	755414487	WUAZUPKOQKBYBW-UHFFFAOYSA-N	438.462	1.084	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)Nc1ccc(CCN2CCOCC2)cc1	756165951	SCGAMPPJNNURIU-HXUWFJFHSA-N	426.473	1.554	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccc(NC(=O)NNC(=O)CCc3ccccc3)c2)CC1	756213241	VLZWPJRQGUJCSU-UHFFFAOYSA-N	445.545	1.408	50	20	IDGD	
CCN1CCN(C(=O)c2ccc(NC(=O)NNC(=O)c3cccc(N(C)C)c3)cc2)CC1	756252619	IEFWZNPHHUBMQY-UHFFFAOYSA-N	438.532	1.997	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)Nc1ccccc1CN1CCSCC1	756270122	MJCCLLQVJRYTDV-UHFFFAOYSA-N	438.517	1.678	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)Nc1cc(OC)ccc1I	756278080	FKRCSNUILLGEOU-VIFPVBQESA-N	437.234	1.504	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)Nc1cccc(OCCS(C)(=O)=O)c1	756297526	KGJDDOHPNYBKKE-UHFFFAOYSA-N	435.502	1.904	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NCc1cc2c(cc1OC(F)F)OCO2	756932037	VRUZTNJDVVGSQC-UHFFFAOYSA-N	442.400	1.339	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)CCCCOc1ccc(Br)cc1	758027210	VICUDFXWVNKBOL-NSHDSACASA-N	436.328	1.083	50	20	IDGD	
C[C@@H](C1CC1)n1nccc1NC(=O)C(=O)NNC(=O)c1cc(Br)ccc1O	760277448	LKGIJUTZABLTQD-VIFPVBQESA-N	436.266	1.722	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)NCCOc1ccc(Cl)cn1	761779973	BROYJHKNJZCYHH-UHFFFAOYSA-N	446.939	1.657	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCCCN(C)C)cc1C(=O)NNC(=O)NC1CCCCC1	761783968	KICKVJCQRSIXTA-UHFFFAOYSA-N	439.582	1.502	50	20	IDGD	
O=C(NNc1nccc(N2CCOCC2)n1)[C@H]1CCCN1c1ncnc2sccc12	762869339	WLFCQLUISJSZAN-CQSZACIVSA-N	426.506	1.430	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)c3c(C)oc(C)c3S(N)(=O)=O)n[nH]2)cc1C	763175555	FERZKASZEALEIC-UHFFFAOYSA-N	431.474	1.626	50	20	IDGD	
Cc1cc(S(=O)(=O)N2CCN(S(=O)(=O)CBr)CC2)c(F)cc1F	763205762	FHKCAMQBJDUAOT-UHFFFAOYSA-N	433.296	1.262	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)c2ccnc(Cl)c2I)n1	763270026	DUASGRBDTAXIRU-UHFFFAOYSA-N	433.637	1.614	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)CCC(=O)N3C)c2ccccc2n1	763616647	XBBYGXJVLSTYTK-UHFFFAOYSA-N	431.452	1.852	50	20	IDGD	
COC(=O)N(C)Cc1ccc(NC(=O)C(=O)NNC(=O)c2c(C)nc3ccccn23)cc1	763628838	GPRJWXVJJWXORC-UHFFFAOYSA-N	438.444	1.241	50	20	IDGD	
COC(=O)Nc1cc(NC(=O)C(=O)NNC(=O)c2c(C)nc3ccccn23)ccc1F	763629092	OHAAJMWELDGCNO-UHFFFAOYSA-N	428.380	1.360	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(C)nn1-c1ccc(F)cc1	763664258	TUVSJIPRXMSZTJ-UHFFFAOYSA-N	441.419	1.493	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(-n3cncn3)c(F)c2)cc1C	763667039	OIXRUZUPPSNVGE-UHFFFAOYSA-N	426.408	1.188	50	20	IDGD	
COCCOc1ccc(C#N)cc1NC(=O)C(=O)NNC(=O)C12CC3CC(CC(C3)C1)C2	763733454	GKUMDZUFHLEZEL-UHFFFAOYSA-N	440.500	1.886	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2cc(OC)c(OC)cc2OC)c1	763771965	JDBKLGFRJJSJSA-UHFFFAOYSA-N	433.417	1.129	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2cc(F)ccc2OC(F)F)c1	763774928	KMIPWNFAIXFQAS-UHFFFAOYSA-N	427.335	1.844	50	20	IDGD	
O=C(NNC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1)C(=O)Nc1cccnc1	763805685	VPQKCRFUTUOSHD-UHFFFAOYSA-N	427.424	1.729	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)c(OCCN(C)C)c1	763855755	BABLFIHDQNQDQN-OAHLLOKOSA-N	446.479	1.628	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(O[C@H]3CCOC3)cc2)cc1OC	763899827	CJBILCKXEJRHQW-KRWDZBQOSA-N	443.456	1.661	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(O[C@@H]3CCOC3)cc2)cc1OC	763899830	CJBILCKXEJRHQW-QGZVFWFLSA-N	443.456	1.661	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)C(=O)Nc1ccc2c(cnn2C(F)F)c1	763995327	PZEFJMIGLJTXLD-UHFFFAOYSA-N	441.192	1.922	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cnccn2)nn1-c1ccc(Cl)cc1Cl	764025872	ZQAAZITXIBENTL-UHFFFAOYSA-N	434.243	1.677	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(Cl)c2N2CCOCC2)c(O)c1	764104644	CIGVPPKUOBZZFS-UHFFFAOYSA-N	432.864	1.590	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cccnc2N2CCCCC2)o1	764138129	CHZIINSQCSQNBL-UHFFFAOYSA-N	442.520	1.906	50	20	IDGD	
O=C(CCOc1ccccc1)NNC(=O)C(=O)Nc1cccc(-c2nnnn2C2CC2)c1	764167189	VMCNIHHFKPVYLU-UHFFFAOYSA-N	435.444	1.230	50	20	IDGD	
O=C(Cc1ccccn1)NNC(=O)C(=O)Nc1nc2cc3c(cc2s1)OC(F)(F)O3	764264097	NASIGBPGFQYNLQ-UHFFFAOYSA-N	435.368	1.341	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)Cc2cccnc2)cc1OCC1CCOCC1	764268437	SRENKLSNJWOIEM-UHFFFAOYSA-N	426.473	1.524	50	20	IDGD	
CC(C)(C(=O)NNC(=O)C(=O)Nc1ccc(NC(=O)[C@@H]2CCCO2)cc1)c1ccccc1	764302630	OJLQMLUXLDUNGB-SFHVURJKSA-N	438.484	1.868	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)C(=O)Nc1cccc(NC(=O)C2CC2)c1	764351504	SGJDKWVAGPLMJL-UHFFFAOYSA-N	432.440	1.621	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(CS(=O)(=O)NC(C)(C)C)c2)o1	764372281	SLYMAJVWOVZGMG-UHFFFAOYSA-N	436.490	1.206	50	20	IDGD	
CN(C)c1nc2cc(NC(=O)C(=O)NNC(=O)CSc3ccccc3O)ccc2o1	764394110	NVWJPNDTUKDGKG-UHFFFAOYSA-N	429.458	1.478	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1F)C(=O)Nc1ccc(N2CCOCC2)c(F)c1	764411369	VYARALHMLYBKJO-UHFFFAOYSA-N	438.818	1.855	50	20	IDGD	
Cc1noc(C)c1S(=O)(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	765119045	LMCUEADKUKFKHT-UHFFFAOYSA-N	441.941	1.072	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)c1ccc(F)c(S(=O)(=O)NC2CC2)c1	765247828	CDZAVBBISBUJFO-UHFFFAOYSA-N	439.490	1.525	50	20	IDGD	
CCCS(=O)(=O)N1CCCC[C@@H]1C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C	765323059	NDXIZLFTQSEXOG-CQSZACIVSA-N	434.559	1.033	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)COCc2ccccc2)cc1F	765646661	CDRBZYBSHRVKRT-UHFFFAOYSA-N	445.494	1.114	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)[C@H](C)C3CCCC3)CC2)cc1	765730238	VYEYAOJMBQJAGW-QGZVFWFLSA-N	436.578	1.275	50	20	IDGD	
Cn1c(C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)ccc1[N+](=O)[O-]	765753461	ZKFWZYRNMBFFFK-UHFFFAOYSA-N	434.884	1.166	50	20	IDGD	
CC(C)(C(=O)NNS(=O)(=O)c1cc(Cl)ccc1OCC(N)=O)c1ccccc1	766318896	RTWVZKIKTVBNQL-UHFFFAOYSA-N	425.894	1.491	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2ccc([N+](=O)[O-])c3cccnc23)c(OC)c1	766361161	OQONKKLSEYOYQF-UHFFFAOYSA-N	432.414	1.784	50	20	IDGD	
COc1ccc(-c2ncc(C(=O)N([C@H]3CCS(=O)(=O)C3)N(C)C)s2)cc1OC	766369047	QMAPRXWHOHWULP-ZDUSSCGKSA-N	425.532	1.933	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)c1cc(F)ccc1NS(C)(=O)=O	767281733	FHZGVQUGFOYYAI-UHFFFAOYSA-N	437.449	1.053	50	20	IDGD	
CCOc1ccc(NC(=S)NNC(=O)[C@@H](C)NS(=O)(=O)c2ccc(C#N)cc2)cc1	767855558	YRIIOWACANPCDJ-CYBMUJFWSA-N	447.542	1.642	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)CCNC(=O)c2ccc(C)cc2O)n[nH]1	768274453	TUBCCXCCJSSVJA-UHFFFAOYSA-N	437.456	1.680	50	20	IDGD	
N#Cc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=S)Nc3ccccn3)CC2)cc1	768585426	LREFNDKKEUSGHN-UHFFFAOYSA-N	444.542	1.372	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NC2CCN([C@H]3CCC[C@@H]3O)CC2)ccc1OC(C)C	769152363	DTGLIZPUFMEBON-ROUUACIJSA-N	434.537	1.804	50	20	IDGD	
COC(=O)c1ccc2c(c1)CN(C(=O)NNC(=O)C1CCN(c3ncccn3)CC1)CC2	770769900	MVLYTZGJQQIZDD-UHFFFAOYSA-N	438.488	1.279	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)Cn3cccc(C(F)(F)F)c3=O)nc21	770967594	XSOUQFOMGMWUJI-UHFFFAOYSA-N	425.371	1.611	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)CNC(=O)c1ccc(Cl)c([N+](=O)[O-])c1	771944399	WEZNWTIDOASGIT-SNVBAGLBSA-N	428.829	1.103	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)CS(=O)(=O)c1cccc(Br)c1	772014937	DNYOFMKGSNMDHJ-LLVKDONJSA-N	449.323	1.348	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)[C@@H]1CCCN1C(=O)c1ccc(Br)cc1	772066654	ZRWCSRPDRLJWNT-RISCZKNCSA-N	440.294	1.543	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)[C@@H]1CCc2[nH]nc(C(F)(F)F)c2C1	772884394	KRQDHQAPULPDBK-SNVBAGLBSA-N	443.813	1.651	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2cc(C)c(Br)cn2)cc1	773542307	VZCHMFVHJWWYEZ-UHFFFAOYSA-N	435.278	1.880	50	20	IDGD	
O=C(NNc1cnc2ccccc2n1)C(=O)Nc1ccc(CN2C(=O)CCCC2=O)cc1	773719197	SCXYTVGUGVBPCN-UHFFFAOYSA-N	432.440	1.751	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNc2nccnc2C(C)C)cc1OC	773991657	JNJOTBYNWWXFDR-UHFFFAOYSA-N	436.494	1.452	50	20	IDGD	
Cc1ccc(-n2nccc2NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)nn1	774010223	WOINKTYNULCMMT-LBPRGKRZSA-N	443.851	1.178	50	20	IDGD	
C[C@H](NCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)c1cccc(N2CCOC2=O)c1	775269920	TURKIAPAFLMDOA-ZDUSSCGKSA-N	427.417	1.663	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)Nc1ccc(C[C@@H]2NC(=O)NC2=O)cc1	775705995	LHRRIJBJOUQUIT-NHYWBVRUSA-N	429.408	1.196	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)NCc2cccc(O)n2)cc1	777460093	DKXYGHPSOVUIBQ-WJDWOHSUSA-N	446.467	1.758	50	20	IDGD	
CCc1cccnc1C(C)=NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1	779777031	MRUBAXNIGVQBBE-UHFFFAOYSA-N	443.573	1.799	50	20	IDGD	
COC(=O)c1ccccc1NNC(=O)[C@@H]1CCCN(S(=O)(=O)c2c(C)n[nH]c2C)C1	780737635	OSDKTIHBJSFTCJ-CQSZACIVSA-N	435.506	1.357	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)cc1	781715721	MLNWNVRRMRNNGE-UHFFFAOYSA-N	434.311	1.686	50	20	IDGD	
CC(=NNC(=O)Cc1csc(N2CCOCC2)n1)c1ccc(N2CCNC2=O)cc1	782177663	RTBPYVZFUZHULX-UHFFFAOYSA-N	428.518	1.592	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2nc3ccccc3s2)cc1S(=O)(=O)N(C)C	782816246	TXBOCTSBMBFUBU-UHFFFAOYSA-N	433.515	1.937	50	20	IDGD	
C[C@@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3ccc(O)cc3)cc2F)C[C@@H](C)O1	782833048	BQGBDHUVYHIUJI-CHWSQXEVSA-N	430.436	1.545	50	20	IDGD	
O=C(NNC(=O)C(=O)NC1CC1)C(=O)Nc1ccc(F)cc1-c1nc2ccccc2s1	782968101	XLQOFLSRYFUKJZ-UHFFFAOYSA-N	441.444	1.467	50	20	IDGD	
COCCCS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)Nc2ccccc2C)cc1	783410766	IIXHSPLGYDPVCG-UHFFFAOYSA-N	448.501	1.597	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CCOCC1	784456784	OVEYSGFDTCNBKG-CVEARBPZSA-N	433.530	1.376	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H]1CCc2ncc(NC(=O)C(=O)NNc3ccccn3)cc2C1	784791975	QOBFPOSLSYTCFQ-AWEZNQCLSA-N	426.477	1.940	50	20	IDGD	
O=C(NNc1ccc(C(F)(F)F)nn1)C(=O)Nc1ccc(N2CCCC2=O)c(F)c1	784886783	XEOALDCXUSVWDO-UHFFFAOYSA-N	426.330	1.843	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)c(OC)c1	785099189	ABDRDNJHTUOQAD-UHFFFAOYSA-N	434.399	1.956	50	20	IDGD	
Cc1ccc(Br)nc1C(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	786391509	YERNOLDIZGRVQC-UHFFFAOYSA-N	437.206	1.679	50	20	IDGD	
Cc1ccc(N2CCNC2=O)cc1NC(=O)C(=O)NNC(=O)CSc1ccccc1O	787548367	DPSOCMUQURRIAJ-UHFFFAOYSA-N	443.485	1.108	50	20	IDGD	
COc1nc(Br)ccc1NC(=O)C(=O)NNC(=O)Cc1c[nH]c2ccccc12	789585158	ZSRDXPWEHLISNR-UHFFFAOYSA-N	446.261	1.663	50	20	IDGD	
Cc1ccc(C)c(S(=O)(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c1[N+](=O)[O-]	790394903	XRSNIJVNJHGMDJ-UHFFFAOYSA-N	427.460	1.238	50	20	IDGD	
CO[C@@H]1CCOc2c(NC(=O)C(=O)NNC(=O)CN3CCCc4ccccc43)cccc21	790951492	GQRPHEWPVQBMSB-LJQANCHMSA-N	438.484	1.695	50	20	IDGD	
Cc1cccnc1NNC(=O)CCc1c(C)nn(-c2ccc(S(N)(=O)=O)cc2)c1C	791224200	CKWYINYBHHIVSI-UHFFFAOYSA-N	428.518	1.916	50	20	IDGD	
CCn1cc([C@@H](O)CN(CC(=O)NNC(=O)c2cccc(C#N)c2)Cc2ccccc2)cn1	792364526	GADQXBDQOBSUSG-QFIPXVFZSA-N	446.511	1.771	50	20	IDGD	
O=C(NNc1nc2ccccn2n1)c1ccc(C(=O)NNc2nc3ccccn3n2)cc1	792513777	UUEAPVOSGLNXRS-UHFFFAOYSA-N	428.416	1.286	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N2CCO[C@]3(CCO[C@@H]3C)C2)cc1Br	792930809	AZICWKYKBBEBKQ-PIGZYNQJSA-N	428.283	1.692	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)N2CCN(c3ccccc3OCCN(C)C)CC2)n1	793228758	QCKKQWZAAUPAIV-UHFFFAOYSA-N	426.521	1.507	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(C)(C)[C@H]1C(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	793770299	BATLRTMGDHAYPI-CQSZACIVSA-N	438.912	1.749	50	20	IDGD	
O=C(NN=Cc1c(F)ccc(I)c1F)[C@H]1CCS(=O)(=O)C1	794488424	NLBGJQVHWISKFV-ZETCQYMHSA-N	428.198	1.454	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)[C@@H](C)c2ccc3c(c2)OCO3)cc1OC	795912915	WADKMCCJBXWMKI-LBPRGKRZSA-N	430.413	1.540	50	20	IDGD	
COC(=O)[C@@]1(C(F)(F)F)CCN(CC(=O)NNC(=O)c2cc(Cl)ccc2OC)C1	796301772	WTLAWLCMDZVSJY-MRXNPFEDSA-N	437.802	1.537	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)c2[nH]nnc2-c2ccccc2)CC1	797728545	IJYKLXRJOAUQRW-UHFFFAOYSA-N	429.481	1.815	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2[nH]nnc2-c2ccccc2)cc1OC	798193737	YIFZFBBKRFYEBK-UHFFFAOYSA-N	425.401	1.107	50	20	IDGD	
C=CCNC(=S)NNC(=O)[C@H]1Cc2ccccc2CN1S(=O)(=O)c1ccc(C)cc1	798306589	MQLVCMSFPLPTIM-LJQANCHMSA-N	444.582	1.792	50	20	IDGD	
Cc1ccccc1NC(=O)NNC(=O)[C@@H]1CCCN1C(=O)/C=C/c1ccc(C(N)=O)cc1	798313725	SNASZHRISBHIJI-QHSLDKKCSA-N	435.484	1.951	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNS(=O)(=O)c2cc(Cl)cc(C(N)=O)c2)cc1	799120178	KOYVAINRJUFYHD-LLVKDONJSA-N	441.893	1.615	50	20	IDGD	
Cc1cc(O[C@@H]2CCN(C)C2=O)ccc1NC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	799239023	RJTBJYTXUOYOFI-QGZVFWFLSA-N	427.417	1.979	50	20	IDGD	
C=CCn1c(S)nc2cc(C(=O)NNC(=O)C(=O)Nc3ccc(C)cc3)ccc2c1=O	801109182	HFDOBKVMBTVWBT-UHFFFAOYSA-N	437.481	1.579	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2ccc(Cl)c(S(=O)(=O)N(C)OC)c2)cc1	802063051	RPSBWBPUHAOLJH-UHFFFAOYSA-N	442.881	1.997	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)C(=O)N1CCc2cc(F)ccc21	802566120	AGRUXIXKKQRZFO-UHFFFAOYSA-N	436.237	1.704	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)c1cc(F)c(Br)c(Cl)c1	803203240	BTTOKULBRRTSBR-UHFFFAOYSA-N	429.633	1.828	50	20	IDGD	
CCOc1ccc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)[C@](C)(O)C3CC3)cc2)cc1	804146807	GIRHMHZAUFHMPM-OAQYLSRUSA-N	447.513	1.808	50	20	IDGD	
O=C1COC[C@H](C[C@H]2CN(C(=O)C(=O)NNc3ccc([N+](=O)[O-])cc3)c3ccccc32)N1	806984540	LWHXHCWLHRABCW-ZFWWWQNUSA-N	439.428	1.073	50	20	IDGD	
CCOC(=O)c1cccc(NC(=O)c2cccc(NC(=O)C(=O)NNC(=O)C(C)C)c2)c1	810385855	CIJQOVDCEWVSNH-UHFFFAOYSA-N	440.456	1.858	50	20	IDGD	
O=C(COC(=O)[C@@H](O)c1ccc(Cl)cc1F)NNC(=O)[C@H]1COc2ccccc2O1	811369522	JAKIKEMUCXHYHV-WBVHZDCISA-N	438.795	1.043	50	20	IDGD	
CC(C)n1ncc2cc(NC(=O)C(=O)NNc3ccc(S(=O)(=O)N(C)C)cc3)ccc21	813033865	ORKINXJXZTVWLY-UHFFFAOYSA-N	444.517	1.949	50	20	IDGD	
COCc1cc(NC(=O)C(=O)NNc2ccc(Br)nc2)cc(C(=O)OC)c1	815600025	JKVRGTYNTBTOOH-UHFFFAOYSA-N	437.250	1.859	50	20	IDGD	
Cc1nc2c(C#N)cnn2c(C)c1CCC(=O)NNc1ccccc1S(=O)(=O)N(C)C	817054709	VEMXZVKMAMYLLX-UHFFFAOYSA-N	441.517	1.544	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)CCn2cnc3sc(C)c(C)c3c2=O)c1	818051269	HJCOHFKVWKVGBF-UHFFFAOYSA-N	429.502	1.733	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)[C@@]12CCC(=O)N1CCS2	849201895	CMAHKADKJCLIAG-QFYYESIMSA-N	428.308	1.429	50	20	IDGD	
Cc1cc(Cl)ccc1OCCCC(=O)NNC(=O)[C@H]1CCCCN1S(C)(=O)=O	886895509	YHZXBMLDWPEGBW-OAHLLOKOSA-N	431.942	1.769	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)/C(=C\c2ccccc2)n2nnnc2C)cc1	912608308	ZQVUKDFNJLAHJJ-NPQOUYBPSA-N	436.472	1.993	50	20	IDGD	
COc1cccc(OC)c1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	912643294	QFYXVRMWEJUFDG-UHFFFAOYSA-N	447.513	1.953	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)[C@@H](CC(C)C)N2C(=O)[C@H]3CC=CC[C@H]3C2=O)cc1	913429577	JPGKMFFGFIGOPB-CEXWTWQISA-N	442.516	1.620	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)NC1CCN(CC(=O)Nc2ccccc2)CC1	914543243	NUABSGLXIXULML-UHFFFAOYSA-N	449.515	1.690	50	20	IDGD	
O=C(COC(=O)[C@H]1CCCN(C(=O)Cc2ccccc2)C1)NNC(=O)c1cccs1	914943181	PLTYHDHBDHFIPY-INIZCTEOSA-N	429.498	1.534	50	20	IDGD	
COc1cc(OC)c(OC)cc1CNC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	915919109	LGZHXTAHMDULHU-UHFFFAOYSA-N	441.444	1.104	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)NC1CCN(C(=O)c2ccoc2)CC1	916261699	XHPBXQHPSODBQN-UHFFFAOYSA-N	438.444	1.420	50	20	IDGD	
CC(=NNC(=O)COc1cc(C)cc(C)c1)c1ccc(S(=O)(=O)NCC(=O)O)cc1	916295730	AUHLJCJYBHRHMU-UHFFFAOYSA-N	433.486	1.586	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NC[C@@H](c2ccsc2)N(C)C)nc1	916449958	UTLXPHBNDBKBMN-HNNXBMFYSA-N	426.568	1.759	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)COc2ccccc2F)sc(C)c1C	916562073	KCRWNYLKYUZSBY-UHFFFAOYSA-N	437.449	1.846	50	20	IDGD	
C[C@H]1CC(C)(C)C[C@@]2(C1)NC(=O)N(CC(=O)NNC(=O)c1ccc(Cl)cc1O)C2=O	918358030	UDBKCFSNVUAUKY-PRWKNARSSA-N	436.896	1.943	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)c2cc(S(=O)(=O)N3CCCC3)c(C)o2)cc1	919836199	CUAMSZYRHZIZER-UHFFFAOYSA-N	435.502	1.775	50	20	IDGD	
C[C@@H](NC(=O)OCc1ccccc1)C(=O)OCC(=O)NNC(=O)c1ccc(Cl)cc1	919866930	IATAHDSQEHJCOF-CYBMUJFWSA-N	433.848	1.959	50	20	IDGD	
CC(C)C[C@@H](NC(=O)c1ccc(Cl)cc1)C(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1	919885917	PQSURZUHDUXPRQ-LSDHHAIUSA-N	444.941	1.002	50	20	IDGD	
CN(C)C(=O)C[C@@H](NC(=O)NNC(=O)c1csc(N2CCOCC2)n1)c1ccccc1	920047721	UQODAOSEDMSPRS-OAHLLOKOSA-N	446.533	1.143	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CN2CCCN(S(=O)(=O)c3ccccc3)CC2)cc1	920087503	CULAVEWROJWWBY-UHFFFAOYSA-N	430.530	1.153	50	20	IDGD	
COc1ccc(CCC(=O)N2CCN(CC(=O)NNC(=O)c3ccc(C)cc3)CC2)cc1	921061725	OFIUZCFVFKKNOZ-UHFFFAOYSA-N	438.528	1.542	50	20	IDGD	
CS(=O)(=O)c1ccc(Br)c(C(=O)NNc2ccc(-n3ccnc3)nn2)c1	1117324153	QGSGBLQVGQZADG-UHFFFAOYSA-N	437.279	1.585	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)Cc3ccc(S(=O)(=O)NC)cc3)n[nH]2)cc1	1254794128	OUVJAJYVSAALRF-UHFFFAOYSA-N	441.513	1.551	50	20	IDGD	
O=C(NNC(=O)c1cncn1-c1ccccc1)C1=NN(Cc2ccc(F)cc2)C(=O)CC1	1317907712	ZAELXCIOBKDJOK-UHFFFAOYSA-N	434.431	1.951	50	20	IDGD	
NC(=O)[C@@H]1CCCN(c2ccc(C(=O)NNC(=O)c3cc(-c4ccccc4)[nH]n3)cc2)C1	1317985993	YVLUCQWTBHMBME-QGZVFWFLSA-N	432.484	1.853	50	20	IDGD	
O=C(CCCC[C@@H]1SC[C@H]2NC(=O)N[C@@H]21)NNC(=O)c1cncn1-c1ccccc1	1318054449	LVIXWYOQZNCAOD-HFTRVMKXSA-N	428.518	1.359	50	20	IDGD	
CN(C)[C@H]1CCCC[C@@H]1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	1318405523	BSKQDLKTKZXDRC-ROUUACIJSA-N	437.566	1.288	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCCCCOc2ccccc2)cc1	1321724979	KLRJMEIJQCMMGR-UHFFFAOYSA-N	448.545	1.805	50	20	IDGD	
COc1cc(OC)cc(OCCNC(=O)NNC(=O)c2cncn2-c2ccccc2)c1	1322618333	YBYXJQUPFRBGQN-UHFFFAOYSA-N	425.445	1.913	50	20	IDGD	
COC(=O)c1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@](C)(Cl)CCl)C3)C2)cn1	1781229853	MXBIYQQRPSUZIT-MOPGFXCFSA-N	444.315	1.548	50	20	IDGD	
O=C(c1cccc(Br)c1F)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1781559543	NVZMHIFNXICDRY-GUYCJALGSA-N	449.704	1.631	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2)c1ccc2c(c1)CCCO2	1782883197	BNFHAHPUSIPKCA-LRXVAGHRSA-N	436.936	1.739	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cnccc3N(C)C)CCO2)C1	1783343462	JGICSASMBLHOJT-KXBFYZLASA-N	439.354	1.765	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)c1ccccc1Cl)CCO2	1783539452	JHATWVIGELCQHS-CDHAZOANSA-N	445.741	1.987	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(C(F)(F)F)n3C)CCO2)C1	1783874836	LUGXNUXJFVGEFY-SJCJKPOMSA-N	437.846	1.741	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cc4cccnc4nc3O)CCO2)C1	1783880974	IVSYJGMVHLMPEB-QRWLVFNGSA-N	434.880	1.033	50	20	IDGD	
C/C(=C\c1ccc(C)o1)C(=O)N1CCO[C@@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1	1783935012	MYZHMQKUALTMLE-FOYQMUPJSA-N	432.521	1.194	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(=O)c3ccco3)[C@H]2C1	1785141721	XGBKCLQPTSJMNA-ABHRYQDASA-N	427.295	1.616	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CSc3ccncc3)[C@H]2C1	1785162387	QCEWURWHDJDBBQ-LLLHUVSDSA-N	427.954	1.407	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3sc(N)nc3C)[C@H]2C1	1786919155	LZQIDSPEKRKIIJ-CYDGBPFRSA-N	445.383	1.801	50	20	IDGD	
CCOC(=O)c1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]3C2)ccn1	1787447888	ILPKBVRBFSGBNC-SDADXPQNSA-N	427.860	1.386	50	20	IDGD	
C=C[C@H](O)C(C)(C)C(=O)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1	1788142107	AQHXLPWHIVLONP-FQEVSTJZSA-N	436.317	1.687	50	20	IDGD	
CC(C)=NO[C@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)CBr)C[C@@H]21	1789952756	RASZFFDTPVGXIH-QRJUGERDSA-N	432.359	1.798	50	20	IDGD	
N#Cc1ccc(F)c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Br)C[C@@H]32)c1	1790227628	JHKUNZFXMCAQNL-MZGVZZPPSA-N	442.260	1.981	50	20	IDGD	
CCc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](Br)CC)[C@H]3C2)nn1C	1790960727	QZNXFCLERNXPTM-FAYQHZLMSA-N	441.370	1.749	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21	1790960981	DHMHAGUNUSXTJK-RVMXOQNASA-N	440.176	1.925	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(COC)c[nH]3)C[C@@H]21	1790962966	HCXBLICJIOJSEV-MPTYRVRUSA-N	442.354	1.928	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnn(C)c3Cl)C[C@@H]21	1791059146	ORRPKZHXQKGJBB-URBCHYCLSA-N	433.734	1.450	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(C(F)(F)F)cc1F)C2)[C@H](O)CCl	1792983977	WHMVNLKWVPSUSY-ANGCBRKESA-N	438.805	1.647	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C=C/c1ccc([N+](=O)[O-])o1	1793109803	VPLHHUIXBOXXHH-BLFFOYFLSA-N	427.841	1.044	50	20	IDGD	
CCOC(=O)c1ncn2cc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)[C@H](O)CCl)ccc12	1793110939	YXYXFRZULXRZLO-JYYAWHABSA-N	448.907	1.363	50	20	IDGD	
CCn1nc(C(C)C)cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2	1798740044	LOKVWYRTEKOEGS-NOXHYTERSA-N	445.333	1.920	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)cc([N+](=O)[O-])c1)C2	1799276646	OOQRXKDCMMPSSX-TYYYEBLRSA-N	446.287	1.740	50	20	IDGD	
N[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Br)c1cccc(Cl)c1	1799346593	SFYRDNJBOAPANA-HZZBMVKVSA-N	448.720	1.620	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nc3ccccc3o1)C2)[C@H](F)Br	1799348487	JDPRNFOKCTWEFK-DJBIQUGXSA-N	426.242	1.722	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CCc3ccccc31)C2)[C@H](F)Br	1799352315	PQRQZAMUAGRJQZ-IEHFGQBSSA-N	425.298	1.997	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cn3ccsc3n1)C2	1800641764	KAIMNLLPYFDMJC-GFQSEFKGSA-N	441.351	1.773	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc(OC)cc1Cl)C2	1800973827	HYMOLXSEHSBKIP-CSHUHZATSA-N	445.343	1.735	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cc3ccccn3n2)[C@H]1c1cccnc1)[C@H](O)CCl	1803140112	YHKCJEOKFIHHMY-IPELMVKDSA-N	427.892	1.649	50	20	IDGD	
Cc1ncccc1C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1805496019	OUZONPQMWPAXBK-KNQAVFIVSA-N	444.300	1.098	50	20	IDGD	
N[C@H](C(=O)N1CC[C@@H](CNC(=O)CCBr)[C@@H]1c1cccnc1)c1ccccn1	1806341168	ZIZUVDQUKGEYKQ-SNRMKQJTSA-N	446.349	1.967	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H](CNC(=O)CS(C)(=O)=O)[C@@H]1c1cccnc1	1806772981	WUJZCKSPCAUQKL-YCPHGPKFSA-N	446.367	1.306	50	20	IDGD	
C=C(C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)C(F)(F)F	1807368151	PQQVZLJTHMRTIS-AEFFLSMTSA-N	447.222	1.200	50	20	IDGD	
Cc1cc(NC(=O)CC(=O)N2CC[C@H](CNC(=O)[C@H](F)Cl)[C@@H]2c2cccnc2)no1	1808312964	NXFYBAIVLAGJOS-BVGQSLNGSA-N	437.859	1.947	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H](CNC(=O)[C@H](F)Br)[C@@H]1c1cccnc1)n1cnnn1	1808681497	UNTHHFVOXYEJDQ-ZZVYKPCYSA-N	440.277	1.026	50	20	IDGD	
O=C(c1ccnc(F)c1)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1	1809977292	DNSJTWCBWWILNX-UHFFFAOYSA-N	425.269	1.059	50	20	IDGD	
NC(=O)c1nccnc1C(=O)NC[C@H]1CCN(C(=O)C(Cl)Cl)[C@H]1c1cccnc1	1811188826	MWUGCQAXYRBLFM-RISCZKNCSA-N	437.287	1.094	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1ccccc1F	1811673530	PFOIPAQGIYJATK-XMSQKQJNSA-N	447.275	1.534	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)[C@@H]2C[C@@H]2C2CC2)[C@H]1c1cccnc1	1813067842	GGXMRZXCWZIMRH-JYLXEMOASA-N	427.549	1.507	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)C2(C)COC2)n[nH]1	1814558947	ZFLVQWWLDOTPHZ-ANDSAHIGSA-N	441.492	1.572	50	20	IDGD	
Cc1nc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)[nH]n2)co1	1816465706	HANYZICPAZIKSR-MRXNPFEDSA-N	438.448	1.324	50	20	IDGD	
CCc1oncc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1816605359	MOJSDYFQVVBZTB-QGZVFWFLSA-N	437.265	1.260	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3nc4ccccn4n3)sc2C1	1816659300	AYKAYJFCKPAPRY-MNOVXSKESA-N	434.909	1.665	50	20	IDGD	
Cc1cc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)[nH]n2)c[nH]1	1818329703	XZHTZMRYETXGOL-KRWDZBQOSA-N	436.476	1.664	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](O)NC(=O)OCC)sc2C1	1819458119	IBOFLJSTFKPTIN-FTGAXOIBSA-N	432.930	1.527	50	20	IDGD	
CC(=O)N(C)CCC(=O)N[C@@H]1CCc2nc(NC(=O)CO[Si](C)(C)C)sc2C1	1820160634	UIYXZTQADKDYBV-CYBMUJFWSA-N	426.615	1.775	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)C2=NN(C)C(=O)CC2)[nH]n1	1822185580	YXLKLHDFUSRKRL-MFKMUULPSA-N	439.314	1.793	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCN2CCOCC2)[nH]n1	1822369239	NRTFDRVVSSCKOB-GDBMZVCRSA-N	427.933	1.378	50	20	IDGD	
C[C@H](C(=O)N[C@H]1CCc2nc(NC(=O)[C@@](C)(Cl)CCl)sc2C1)n1cnnn1	1822869930	PAJLWAIZJTZCPR-OLBFVZFUSA-N	432.337	1.539	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnn3cc(C)cnc13)CC2	1826000072	JZQXKPRSNGRLAO-WCQYABFASA-N	448.936	1.974	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc3nn[nH]c3c1)CC2	1826004948	WGOVQMAIQFWTCL-GHMZBOCLSA-N	434.909	1.894	50	20	IDGD	
O=C(Cc1ccc(Cl)c(F)c1)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1	1830291306	QUZKEGKGSJRDMU-APWZRJJASA-N	449.306	1.078	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830366511	RFYUUUXGLZOTHM-SUMWQHHRSA-N	439.778	1.881	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)C(C)=O)CCO2	1831130975	RMOKEWJFIWFYII-KSSFIOAISA-N	433.343	1.232	50	20	IDGD	
Cc1cccnc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1831834838	IPSJNZHYIRTZEW-WMLDXEAASA-N	430.274	1.151	50	20	IDGD	
C[C@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1)n1cccn1	1831876920	MHLVEZNQWDIJHC-MJGOQNOKSA-N	432.569	1.437	50	20	IDGD	
O=C(Cc1ccc(Cl)s1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1832602807	HIOITCACRLIVDG-ZBFHGGJFSA-N	425.309	1.935	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)CCl)CC2)CC1	1833306679	WZNAMHUVZJSJNW-SWLSCSKDSA-N	438.794	1.189	50	20	IDGD	
Cn1cc(C(=O)N2CCC(N3CCC(NC(=O)[C@H](O)CCl)CC3)CC2)c2cccnc21	1833310541	RJLJCNQNZZQBMJ-LJQANCHMSA-N	447.967	1.358	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCC(N2CCC(NC(=O)c3cnsn3)CC2)CC1	1833979022	IADFFJNKKSUIAB-QGZVFWFLSA-N	434.393	1.960	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3cnc(N)s3)CC2)CC1	1834768510	ZLMKWCYLLJNGGE-LLVKDONJSA-N	444.399	1.694	50	20	IDGD	
Cc1cccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)CCBr)C3)C2)c1	1835038367	DECOJXICWQNPGF-FQEVSTJZSA-N	439.350	1.779	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cc4cccnn4n3)CC2)CC1	1836078511	KIRBHVUIXBPVJD-GOSISDBHSA-N	432.956	1.932	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)c1cccc2ccnn12	1836479504	KFJHATOJSAKJNS-IBGZPJMESA-N	433.940	1.119	50	20	IDGD	
C[C@@H]1C[C@]1(C)C(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1	1837921586	RCWPCKOKHPOJJS-MWTRTKDXSA-N	428.338	1.025	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3ccnnc3O)CC2)CC1	1838515768	FWAGIIYJBAEXQG-MRXNPFEDSA-N	426.901	1.048	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3c(C)nn(C)c3C)C2)C1	1839148777	JOKQMVIGYMRFGD-FXAWDEMLSA-N	426.945	1.053	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(O)ccc3F)C2)C1	1839154768	XKPMNTOSFJKORZ-RBUKOAKNSA-N	449.306	1.838	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)CC[C@@H]3CCOC3)C2)C1	1839156242	IVMSBKTZZPMCCW-MNEFBYGVSA-N	437.364	1.496	50	20	IDGD	
CNc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)cc1	1839198890	FHLMZORBKHYOPC-QAPCUYQASA-N	444.301	1.489	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C=C/c3ccsc3)C2)C1	1840150265	IJOSKJYNFRCXKJ-BAXQNQMVSA-N	428.938	1.472	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc4cnccc34)C2)C1	1840153188	GXTDSENFVCXVEO-UGKGYDQZSA-N	447.919	1.559	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccccc3Cl)C2)C1	1840154192	OWXOIXYPYBIQTC-VQIMIIECSA-N	431.316	1.664	50	20	IDGD	
O=C(c1ccc2sccc2c1O)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843012177	MAGLTHSURJWDNJ-UHFFFAOYSA-N	436.298	1.418	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)[C@@H]1Cc3ccccc3O1)C2	1843416261	PTMWUJVVAIQNMG-QVWJKXSPSA-N	435.484	1.328	50	20	IDGD	
O=C([C@@H](F)Br)N1CC2(CCCN2C(=O)c2cc(=O)nc3sccn23)C1	1844625265	ULKVBBQODLERJX-LLVKDONJSA-N	429.271	1.264	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)c2ccc(OC(F)F)cc2)C1	1845377633	VIAFCGSQYGZQSP-UHFFFAOYSA-N	430.216	1.099	50	20	IDGD	
O=C([C@H](O)CCl)N1CC2(CCCN2C(=O)c2cn3c(C(F)(F)F)cccc3n2)C1	1845589017	YBVYBUNHUJDJEM-GFCCVEGCSA-N	430.814	1.770	50	20	IDGD	
O=C1CC[C@H](C(=O)N2CC3(CCCN3C(=O)[C@H](Br)Cc3ccccc3)C2)CN1	1845939922	IAFQTZYAWCNYMH-DLBZAZTESA-N	448.361	1.722	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCCC12CN(C(=O)/C=C/C(=O)NCc1ccco1)C2	1846070843	HVBROTASNPBKBN-LQYUOIDQSA-N	438.322	1.829	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H]1CCc2nc(O)nc(O)c2C1	1848212565	BUNOACJPFDQDRP-RCBQFDQVSA-N	434.569	1.046	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)CCc2nc3ccccc3[nH]2)cc1	16971238	ZZDDMUGYVFTEDW-UHFFFAOYSA-N	429.502	1.272	50	20	IDGD	
COCCOc1ccc(S(=O)(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)cc1	23143916	PHZRPFWWYRZLEF-UHFFFAOYSA-N	440.474	1.361	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(C(=O)NNC(=O)CC23CC4CC(CC(C4)C2)C3)cc1	26772900	QHVFAPXSMVGXRX-UHFFFAOYSA-N	449.573	1.979	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1cnc(-c2ccccn2)s1	727671884	URXYQQPAPWNNSD-UHFFFAOYSA-N	430.515	1.881	50	20	IDGD	
C[C@H](Oc1ccccc1Cc1ccccc1)C(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1	728188828	PQRQSRYDLPKKEA-YJBOKZPZSA-N	431.514	1.562	50	20	IDGD	
CC[C@@H](NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)c1ccc2c(c1)OCCO2	728959290	JHNJASNVSVSKSL-QGZVFWFLSA-N	440.504	1.946	50	20	IDGD	
CC[C@@H](NC(=O)NNC(=O)c1cccc2ncccc12)c1cccc(S(N)(=O)=O)c1	730126063	MCVHIYCJFUHYRJ-QGZVFWFLSA-N	427.486	1.978	50	20	IDGD	
CCc1ccccc1O[C@H](C(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1)c1ccccc1	730535534	QHRQKHRACMSECI-HKUYNNGSSA-N	431.514	1.887	50	20	IDGD	
CC(C)(C(=O)NNC(=O)N1CCN(CC(=O)NC2CCCCC2)CC1)c1ccccc1	731222934	ZIZKMKJIRGWLCY-UHFFFAOYSA-N	429.565	1.772	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc3c(nc2O)CCCC3)c1	731596100	SLDBNVPSNWFWHV-UHFFFAOYSA-N	446.529	1.771	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)Cn1cc(S(=O)(=O)N(CC)CC)ccc1=O)c1ccccc1	731996832	FXWKVITWGZMXCF-GOSISDBHSA-N	448.545	1.220	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)c1cc(C2CC2)nc2c1c(O)nc(=O)n2CC(C)C	732084256	UQEZEQFDJUPFQD-UHFFFAOYSA-N	425.449	1.137	50	20	IDGD	
CC(C)(C)C(=O)N1CCC[C@@H](C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)C1	732333494	XKARTXXIWPYIJY-CQSZACIVSA-N	434.449	1.184	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)N2CCC(C(=O)NNc3cnccn3)CC2)cc1	734242447	HHCZBRRDSURJAQ-UHFFFAOYSA-N	433.490	1.197	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)c1ccc(C)cc1)C(=O)NNc1nccnc1Cl	734261803	HWDRDFIGZZNDQN-CYBMUJFWSA-N	429.955	1.982	50	20	IDGD	
Cc1cc(C=NNC(=O)NCCNC(=O)OC(C)(C)C)c(C)n1CCN1CCOCC1	734302498	GSPGUYQVCOFHOZ-UHFFFAOYSA-N	436.557	1.595	50	20	IDGD	
C[C@@H](OC[C@H]1CCCCO1)C(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	734824839	JYVAKZZCVDDILW-GDBMZVCRSA-N	428.530	1.691	50	20	IDGD	
CC(C)Cn1c(=O)nc(O)c2c(C(=O)NNC(=O)c3cnn(C)c3)cc(C(C)C)nc21	735470776	HZXNTLHSKQSWSH-UHFFFAOYSA-N	427.465	1.085	50	20	IDGD	
O=C(NNc1ccc(Cl)nn1)c1ccc(Cl)c(S(=O)(=O)NC[C@@H]2CCCO2)c1	735687713	VXKXJWIRGSSACM-NSHDSACASA-N	446.316	1.998	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCOCC2)cc1C(=O)NNc1c(F)cccc1F	735700328	KOANNJGMRXGZAF-UHFFFAOYSA-N	427.429	1.751	50	20	IDGD	
O=C(NNC(=O)c1cnc(-c2ccccc2)[nH]1)c1cccc(S(=O)(=O)N2CCCC2)c1	736064801	UUMBVEBYJHCJMO-UHFFFAOYSA-N	439.497	1.936	50	20	IDGD	
COc1ccc(COCCC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1	736066729	SHCAJGXBXDDQGN-UHFFFAOYSA-N	435.502	1.313	50	20	IDGD	
O=C(NCc1cc(F)ccc1N1CCOCC1)NNC(=O)[C@@H]1COc2ccccc2O1	740921239	YIDQEQYHPHTBRB-IBGZPJMESA-N	430.436	1.333	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)NCc2nc(-c3ccccc3)n[nH]2)c2ccccc2c1=O	741418002	LZPBKVBUFGIYRV-UHFFFAOYSA-N	446.471	1.907	50	20	IDGD	
CC(=NNC(=O)c1csc(N2CCOCC2)n1)c1ccc(S(C)(=O)=O)c(F)c1	741756042	MWIJKPGRMIBFAT-UHFFFAOYSA-N	426.495	1.676	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)c1ccc(OC2CCOCC2)cc1	742036892	PZUWVYCKVPFEHX-UHFFFAOYSA-N	432.502	1.612	50	20	IDGD	
O=C1C[C@H](Cc2ccc(C(=O)NNC(=O)c3cc(Br)ccc3O)cc2)C(=O)N1	743732175	NKDHQGMMVGTQSZ-LBPRGKRZSA-N	446.257	1.435	50	20	IDGD	
NC(=O)N[C@H](CC(=O)NNC(=O)[C@H]1COCCO1)c1cccc(Oc2ccccc2)c1	744645632	AKFIEUAEGGTDDN-QZTJIDSGSA-N	428.445	1.141	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)N[C@H]2CCN(Cc3ccccc3)C2)cc1	745299965	JECSJSZMGHEHAW-KRWDZBQOSA-N	431.518	1.700	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCC(C)(C)NC(=O)OC(C)(C)C)cc(OC)c1OC	745926416	FYJOIFXFCVHGCU-UHFFFAOYSA-N	440.497	1.960	50	20	IDGD	
Cc1noc(C)c1S(=O)(=O)N1CCC(C(=O)NNc2oc(C(C)C)nc2C#N)CC1	746340103	YSYITSVOACBNMP-UHFFFAOYSA-N	436.494	1.819	50	20	IDGD	
C[C@H](NS(=O)(=O)c1cccc(C(=O)NNc2nccn(C)c2=O)c1)c1ccccc1	747942230	OZNDDCLAASSKGH-AWEZNQCLSA-N	427.486	1.577	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3cc4ccccc4c(O)n3)cc2)CC1	748619936	NCEVUASQSUFKNE-UHFFFAOYSA-N	441.513	1.633	50	20	IDGD	
O=C(COC(=O)c1cccc(Cl)c1[N+](=O)[O-])NNC(=O)[C@@H]1COc2ccccc2O1	750533286	PXJYOYPTNRSULX-AWEZNQCLSA-N	435.776	1.392	50	20	IDGD	
Cn1cc(NS(=O)(=O)c2ccsc2C(=O)NNC(=O)c2c[nH]c3ccccc23)cn1	750718247	QXRAMRDWAGRPGU-UHFFFAOYSA-N	444.498	1.839	50	20	IDGD	
Cc1oc(S(=O)(=O)N(C)C)cc1C(=O)NNc1ccc(S(=O)(=O)C(F)F)cc1	753340567	FIQSJQKFBAIDJU-UHFFFAOYSA-N	437.446	1.592	50	20	IDGD	
CC(=O)N1CC[C@@H](CN(C)C(=O)NNC(=O)[C@H](C)Oc2cccc(Br)c2)C1	754837851	GWYMUBSOWMWJII-JSGCOSHPSA-N	441.326	1.757	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N(CC)CC)cc1NC(=O)NNC(=O)c1cc(C)[nH]n1	755442139	QTOMFTZDCNZUSK-UHFFFAOYSA-N	438.510	1.614	50	20	IDGD	
CNC(=O)c1cccc(NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)c1C	755656327	GNHVUXIJYCHROJ-UHFFFAOYSA-N	447.517	1.136	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(OCC(=O)NNc2cc(C)ccn2)c([N+](=O)[O-])c1	755850715	PJPVIUQEBPUEOU-UHFFFAOYSA-N	437.478	1.851	50	20	IDGD	
CCN1CCN(C(=O)c2ccc(NC(=O)NNC(=O)c3cccc(OC)c3O)cc2)CC1	756252347	DMSHYLJLVDZAFN-UHFFFAOYSA-N	441.488	1.645	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CN2CCCC[C@@H]2C(=O)Nc2ccc3c(c2)CCO3)c1	756601617	PZCZMCMMOLHRKA-HXUWFJFHSA-N	447.495	1.747	50	20	IDGD	
CCOCC(=O)NNC(=O)NCc1ccccc1CS(=O)(=O)N1CCC(C)CC1	756744765	JJMCWMLYAPUACN-UHFFFAOYSA-N	426.539	1.115	50	20	IDGD	
O=C1C[C@H](Cc2ccc(NC(=O)NNC(=O)c3cc(-c4cccs4)[nH]n3)cc2)C(=O)N1	756814850	IEEOFCOYXLPVOA-LBPRGKRZSA-N	438.469	1.810	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)Nc1ccc(C[C@@H]2CC(=O)NC2=O)cc1	756817251	WXXRKHRMQVBMCL-GXTWGEPZSA-N	428.420	1.651	50	20	IDGD	
CN1C(=O)C[C@H](C(=O)NNC(=O)[C@H]2COc3ccccc3O2)[C@@H]1c1ccc(Cl)c(F)c1	758055891	UCHMMEIPARHPRB-WILYLXEWSA-N	447.850	1.986	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)Cc2ccc(C(=O)NNC(=O)c3cnco3)cc2)cc1	758058629	NBDGJMKCPUEVKB-UHFFFAOYSA-N	428.470	1.879	50	20	IDGD	
C[C@@H]1CC[C@@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)C[C@H]1C	758717659	GRFCKRQKXOWOII-BFYDXBDKSA-N	438.550	1.476	50	20	IDGD	
Cc1nn(Cc2ccccc2Cl)c(C)c1C(=O)NNC(=O)C(=O)Nc1ccccn1	758833686	OTYWJVUROXYNBB-UHFFFAOYSA-N	426.864	1.996	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)NC[C@@H]2CN(Cc3ccccc3)CCCO2)c1	758856263	VWBUBKKADNOKJE-OAQYLSRUSA-N	426.517	1.995	50	20	IDGD	
CCc1nnc(C)cc1C(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	759392157	OMHHBHMSRWGXSF-UHFFFAOYSA-N	430.940	1.580	50	20	IDGD	
CC(C)CNS(=O)(=O)c1ccc(CNC(=O)NNc2ccc(-n3cccn3)nn2)cc1	759663377	XVZGZZMOZISJOW-UHFFFAOYSA-N	444.521	1.423	50	20	IDGD	
COCCOc1ccc(CC(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)cc1	760393104	KDMABTSENZPNTB-UHFFFAOYSA-N	449.529	1.419	50	20	IDGD	
CC[C@@H](C)n1ncc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1C1CC1	760627909	SSBWYMDJMKERSD-ACJLOTCBSA-N	442.472	1.876	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)C(=O)c2ccc(Cl)s2)CC1	760831622	LTZSARONNQKYOV-UHFFFAOYSA-N	443.938	1.059	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCCOc2ncccc2Cl)nc1	761781886	YDOUJBNYUOQFKZ-UHFFFAOYSA-N	442.929	1.866	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)c2cccc(CN3CCN(C)CC3)c2)n[nH]1	763155361	ROEXTIBWGHVZKF-UHFFFAOYSA-N	448.527	1.908	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(NC(=O)[C@@H]2CCCO2)cc1	763444584	VDKHSFGOQIHQTG-INIZCTEOSA-N	441.400	1.112	50	20	IDGD	
CC(=O)Nc1cc(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3n2)c(F)cc1F	763456047	VQGJSCUTNXTPPF-UHFFFAOYSA-N	427.367	1.871	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccccc2OC(F)F)cc(OC)c1OC	763540138	RXEXXKYZFIUHEZ-UHFFFAOYSA-N	439.371	1.714	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)c(C(F)(F)F)c1	763559020	QAZHBPRJGKQTKU-UHFFFAOYSA-N	425.319	1.842	50	20	IDGD	
Cc1conc1NC(=O)C(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	763614544	SOSAHWULLXUWMO-UHFFFAOYSA-N	446.427	1.085	50	20	IDGD	
O=C(COc1cccc(C(F)(F)F)c1)NNC(=O)C(=O)Nc1cnn(CC2CC2)c1	763639761	RODOLALSFFZIAA-UHFFFAOYSA-N	425.367	1.477	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3cccc(Cl)c3)cn2)C[C@H](C)O1	763748609	VTAZVMWHDCZNQO-STQMWFEESA-N	431.880	1.748	50	20	IDGD	
O=C(NNC(=O)c1cc2c(s1)CCC2)C(=O)Nc1cccc(Cl)c1-n1cncn1	763783894	QIYVZHSFOOVSGU-UHFFFAOYSA-N	430.877	1.871	50	20	IDGD	
CC(=O)Nc1cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)ccc1F	763838808	CCFJBJWZJWPQCE-ZDUSSCGKSA-N	430.436	1.954	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccc(F)c(C(=O)N(C)C)c1	763850917	QSBMMOXPZGPZHR-NSHDSACASA-N	434.399	1.220	50	20	IDGD	
COC(=O)c1cc(F)c(F)cc1NC(=O)C(=O)NNC(=O)Cc1c[nH]c2ccccc12	763861106	OIWZEDOAKFYOOE-UHFFFAOYSA-N	430.367	1.561	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(N(C)C(C)=O)cc2)cc1OC	763900124	FYSINCOPNNIFNP-UHFFFAOYSA-N	428.445	1.476	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)C(=O)Nc1ccc(-n2nccn2)nc1	763902673	WDKCVDUWBYGRMV-UHFFFAOYSA-N	448.468	1.494	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(F)c(C(N)=O)c2)ccc1OC(C)C	763916149	JNAKBSGXERQLCB-UHFFFAOYSA-N	432.408	1.120	50	20	IDGD	
O=C(Cc1cccc2ccccc12)NNC(=O)C(=O)Nc1cc(-n2cnnn2)ccc1F	764019275	JMDBVXCHROZBBB-UHFFFAOYSA-N	433.403	1.283	50	20	IDGD	
O=C(NNC(=O)C1CCCC1)C(=O)N1C[C@@H](C(=O)N2CCCCC2)Oc2ccccc21	764066669	QUAFUZITLYZBRI-SFHVURJKSA-N	428.489	1.131	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(F)cc2OCC2CC2)c1	764085710	NTABXLOXDHTIMR-UHFFFAOYSA-N	449.460	1.418	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(-n3cc(C)cn3)c(F)c2)c1O	764132661	ZSPBKGWLEXOVCU-UHFFFAOYSA-N	427.392	1.434	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)sc(C)c1CC	764166860	FRNQXUUANMCQRP-OAHLLOKOSA-N	445.497	1.885	50	20	IDGD	
COc1ccc(Oc2ccc(NC(=O)C(=O)NNC(=O)[C@@H]3Cc4ccccc4O3)cn2)cc1	764167389	JKKPYUFTGJVTPK-IBGZPJMESA-N	448.435	1.972	50	20	IDGD	
O=C(Cc1ccccn1)NNC(=O)C(=O)Nc1cc(Br)c(F)cc1Cl	764270731	SBOIMIAOWIPXMD-UHFFFAOYSA-N	429.633	1.965	50	20	IDGD	
CC(C)Cn1cc(NC(=O)C(=O)NNC(=O)c2cc(F)ccc2Br)cn1	764271119	VNQBBRMPPFENGY-UHFFFAOYSA-N	426.246	1.840	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1cccc(Cl)c1SC(F)F	764401805	XMEJYBOBDRTSES-MRVPVSSYSA-N	425.841	1.792	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)NCc1cccc(N2CCCS2(=O)=O)c1	765255666	NOCICIFOKJQIRL-UHFFFAOYSA-N	441.513	1.712	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cc1[N+](=O)[O-]	765738235	JFURTYRSQXVVJH-UHFFFAOYSA-N	425.445	1.122	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@@H](C)Oc3ccc(C#N)cc3)CC2)cc1	765749647	ZUGSMBPTTJGWAS-LJQANCHMSA-N	435.528	1.599	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)N[C@@H]2CN(Cc3ccccc3)C[C@H]2C)nc1	765892758	MNZXEFXJRDKJLW-VQIMIIECSA-N	446.577	1.915	50	20	IDGD	
CCCn1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)nn1	766556277	SQAYQKUDCZMCGR-UHFFFAOYSA-N	442.501	1.241	50	20	IDGD	
COc1cc(C=NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)c([N+](=O)[O-])cc1O	767034469	VLDLUAMLIZNMPP-UHFFFAOYSA-N	436.446	1.388	50	20	IDGD	
CC(C)NC(=O)c1ccc(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1	767188558	AFKMNFPTBWCIBE-UHFFFAOYSA-N	437.544	1.798	50	20	IDGD	
CCOc1cc(NC2CCN(C(=O)NNC(=O)c3c(C)nc4ccccn34)CC2)ncn1	767294720	BBGKLIBKAFGBLB-UHFFFAOYSA-N	438.492	1.762	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)CCC(=O)N2CCN(c3ccccc3)CC2)c(C)c1	767853059	MFIJDLBCAAXKJG-UHFFFAOYSA-N	437.544	1.992	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2F)cc1NC(=O)CCN(C)C	768233201	LCFFSOJURNNYPC-UHFFFAOYSA-N	429.452	1.424	50	20	IDGD	
CC[C@@H]1CCCC[C@H]1OCC(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	768712312	PNQQEQAVFFHEMG-IAGOWNOFSA-N	439.582	1.446	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCc1nnnn1CC1CC1	770324312	LMAAMAAWPWGJPQ-JTQLQIEISA-N	438.286	1.144	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)NC1CCC(O)(c2cccnc2)CC1	771371647	JQAMWQAIQOPUMS-UHFFFAOYSA-N	436.472	1.747	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N[C@@H]2CCO[C@]3(CCOC3)C2)cc1Br	771444771	POLKEEOUGJGQMY-SJKOYZFVSA-N	428.283	1.740	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)[C@H]1CN(C(=O)OC(C)(C)C)CCO1	772964045	OHXAKOCGTFNZKC-SWLSCSKDSA-N	427.885	1.891	50	20	IDGD	
Cc1ccc(I)cc1NC(=O)C(=O)NNC(=O)c1scnc1C	773497482	UNKDBRBNTWZWLQ-UHFFFAOYSA-N	444.254	1.764	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2cnc(Oc3ccccc3)cn2)n1	773666331	KCNHQCFCLFTUBI-UHFFFAOYSA-N	427.442	1.581	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccn(-c2ccncc2)n1	774009434	PPQKZABLQQAMKL-GFCCVEGCSA-N	428.836	1.474	50	20	IDGD	
Cc1csc2ncc(C(=O)NNc3ccccc3S(=O)(=O)NC(C)(C)C)c(=O)n12	776477368	UYCUFTMFEXLWHP-UHFFFAOYSA-N	435.531	1.898	50	20	IDGD	
NS(=O)(=O)c1cccc(NS(=O)(=O)c2ccc(OCCBr)cc2)c1	777743267	DLAQUXUSRFYFAL-UHFFFAOYSA-N	435.321	1.909	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)CCc2c(C)nn(-c3ccc(S(N)(=O)=O)cc3)c2C)n1	781068574	LVLYXOSQPZYEOO-UHFFFAOYSA-N	443.533	1.619	50	20	IDGD	
COc1ccc(NNC(=O)CN(C)S(=O)(=O)c2ccc(Br)cc2)nc1	781525704	TVGDUYOEUOBTFE-UHFFFAOYSA-N	429.296	1.617	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NN=C1COCc2ccccc21	782127200	KVRTYNUDVCMZGR-UHFFFAOYSA-N	443.525	1.691	50	20	IDGD	
CC[C@@H](C)Oc1cccc(NC(=O)C(=O)NNC(=O)c2csc(N3CCOCC3)n2)c1	782898019	WKMXDKZOOHFFLI-CYBMUJFWSA-N	447.517	1.557	50	20	IDGD	
O=C(NNc1ccc(-n2cccn2)nn1)C(=O)Nc1cc(F)c(Br)c(F)c1	783432878	GXBXGXCVZUAVSW-UHFFFAOYSA-N	438.192	1.785	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2nccc3sccc23)cc1NS(C)(=O)=O	783445095	NQFLHJVGSWYUBA-UHFFFAOYSA-N	435.487	1.758	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)N[C@@H]1CCC[C@@H]2CN(Cc3ccccc3)C[C@H]21	784264059	VKSOTRKUJTYVFS-GUDVDZBRSA-N	439.516	1.641	50	20	IDGD	
CSc1ccncc1NC(=O)C(=O)NNc1ccccc1S(=O)(=O)NC(C)(C)C	784833904	SBBNJKHKCAIION-UHFFFAOYSA-N	437.547	1.962	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)ccc1OC(C)C	785024485	ZWZSVMWQMOLRBJ-UHFFFAOYSA-N	432.389	1.496	50	20	IDGD	
CCNC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)c1C	789733841	VNNTZFVIKSGHFE-QGZVFWFLSA-N	425.445	1.226	50	20	IDGD	
O=C(NNC(=O)c1c[nH]c2ccccc12)C(=O)Nc1ccc(Cc2nnc3n2CCC3)cc1	792264553	SIXXHHNYYUTXGO-UHFFFAOYSA-N	443.467	1.696	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(Cc3nnc4n3CCC4)cc2)c(O)c1	792269453	VERFIPNONQUBLV-UHFFFAOYSA-N	434.456	1.229	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)Cc2ccc(NC(=O)OC(C)(C)C)cn2)C[C@@H](C)O1	792628365	HRWHRHBTYBWUHX-GASCZTMLSA-N	435.525	1.618	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc2c(c1)CCN2C(=O)C(=O)NCCSSC	793079421	PGWJWXKKPDTGPF-UHFFFAOYSA-N	431.605	1.734	50	20	IDGD	
COCc1cc(C(=O)OC)cc(S(=O)(=O)NNC(=O)c2cccc3cccnc23)c1	793386262	YKBCUHOOEOOQSO-UHFFFAOYSA-N	429.454	1.791	50	20	IDGD	
C[C@@H](C(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)[C@@H]1OCCc2sccc21	796509268	UFDNTVQSCDIDMQ-DIFFPNOSSA-N	433.442	1.911	50	20	IDGD	
Cc1noc(C)c1C(C)(C)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	797401872	QMBVLSSLSZWBBD-UHFFFAOYSA-N	434.518	1.815	50	20	IDGD	
Cc1ccc(N2CCOCC2)cc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccccc1F	797534600	AWBVPNXFRMHKCG-HNNXBMFYSA-N	444.463	1.524	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2ccccc2O)cc(Br)cc1[N+](=O)[O-]	797535409	MMUXELQWJSAQCN-UHFFFAOYSA-N	437.206	1.771	50	20	IDGD	
CN(CCNC(=O)NNc1cccc(S(C)(=O)=O)c1)S(=O)(=O)c1ccc(F)cc1	798117940	FDDVNAMMHIHJGT-UHFFFAOYSA-N	444.510	1.176	50	20	IDGD	
C[C@@H](c1cccc(S(N)(=O)=O)c1)N(C)C(=O)NNC(=O)c1cccc(OC(F)F)c1	799916858	PXYSYQHEZOQEGI-NSHDSACASA-N	442.444	1.983	50	20	IDGD	
Cc1ccc(-n2c(C)cc(/C=C(/C#N)C(=O)NCCC(=O)NS(C)(=O)=O)c2C)cc1	800551070	OMCKOYFPGXUVCM-PDGQHHTCSA-N	428.514	1.892	50	20	IDGD	
Cc1c(C(=O)NNC(=O)CCN2C[C@H](C)O[C@H](C)C2)nnn1CCOc1ccc(F)cc1	800688273	SGSNIJHMHOGUKL-GASCZTMLSA-N	448.499	1.065	50	20	IDGD	
COc1ccc(C2=NO[C@@H](CNC(=O)NNC(=O)COc3ccccc3C#N)C2)cc1F	802344859	YJSAYALVFDRKAZ-OAHLLOKOSA-N	441.419	1.608	50	20	IDGD	
COc1ccc(N2CCN(C(=O)/C=C/C(=O)NNc3ccc4c(=O)[nH]ccc4c3)CC2)cc1	803428034	OCWZMPMXAVRMKN-CMDGGOBGSA-N	447.495	1.885	50	20	IDGD	
CCOC(=O)C1(S(C)(=O)=O)CCN(C(=O)/C(C#N)=C\c2cc(C#N)n(C)c2C)CC1	804717800	XQXVRTUKVUFQCF-YBEGLDIGSA-N	432.502	1.081	50	20	IDGD	
CN(C)C(=O)CN1[C@H]2CC[C@H]1CC(NC(=O)NNC(=O)Cn1ccc3ccccc31)C2	805079764	PQZICFRMGARKPW-ROUUACIJSA-N	426.521	1.055	50	20	IDGD	
Cn1[nH]cc2c(=NC(=O)C(=O)NNC(=O)c3sc4ccccc4c3Cl)ccnc1-2	806973490	PIRGUTWEJITSQV-UHFFFAOYSA-N	428.861	1.610	50	20	IDGD	
CCNS(=O)(=O)c1ccc2c(c1)N(C(=O)C(=O)NNc1ccc([N+](=O)[O-])cc1C)CC2	807455747	RYVDHTGIOZRSLZ-UHFFFAOYSA-N	447.473	1.234	50	20	IDGD	
CN(NC(=O)Nc1cccc2c1COC2=O)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	808913397	OLUZLFFEYDOODA-UHFFFAOYSA-N	433.465	1.998	50	20	IDGD	
NC(=O)c1ccc(OCC(F)F)c(NC(=O)C(=O)NNC(=O)CCC2CCCCC2)c1	810386874	VOZCLTMEIVAMEX-UHFFFAOYSA-N	440.447	1.876	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](C(=O)OCC(=O)NNC(=O)c1cccc(C#N)c1)C(F)(F)F	811423960	YYOGPQVFWIJPNH-ZDUSSCGKSA-N	444.366	1.318	50	20	IDGD	
COC(=O)c1cn(-c2cccc(NC(=O)C(=O)NNC(=O)CCC3CCCCC3)c2)nn1	812979604	CEDUJSQJHOGCCN-UHFFFAOYSA-N	442.476	1.500	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)[C@@H]1OCCc2sccc21	813866259	NFXPUWPHKWETKX-DIFFPNOSSA-N	427.486	1.642	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNS(=O)(=O)c3sc(C)cc3C)CC2)cc1	814211372	BBQITDMVVXEHRE-UHFFFAOYSA-N	436.603	1.801	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CSc2nnc(CCC(N)=O)n2Cc2ccco2)cc1	817853212	LCBZQMDUKQGYGL-UHFFFAOYSA-N	442.501	1.199	50	20	IDGD	
O=C(COC(=O)C1(c2cccc(F)c2)CCC1)NNC(=O)[C@H]1COc2ccccc2O1	875614386	QVMABJXGMQVJAZ-GOSISDBHSA-N	428.416	1.778	50	20	IDGD	
COc1ccccc1NC(=S)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)c(C)c1	879706729	RVAPSALBFRPDLV-UHFFFAOYSA-N	436.559	1.950	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)c1csc(N2CCOCC2)n1)N1CCc2ccccc21	914828103	PQQPYAGQURSGCF-AWEZNQCLSA-N	430.534	1.375	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NN=C1C(=O)Nc2cc(N3CCOCC3)ccc21	915947504	BJKIZPCMGFGNGD-UHFFFAOYSA-N	432.484	1.908	50	20	IDGD	
CCOCCNC(=O)NNC(=O)c1ccc(CN(C)S(=O)(=O)c2ccc(C)cc2)cc1	916374448	CFYDHYJEWGSNBY-UHFFFAOYSA-N	448.545	1.796	50	20	IDGD	
COc1ccc(Cl)cc1CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	916647008	BWZRNKQDNVEIIL-UHFFFAOYSA-N	440.909	1.743	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCN(C(=O)CCC3CCCCC3)CC2)n1	917406097	DFJFLVJKMXIPEW-UHFFFAOYSA-N	435.594	1.646	50	20	IDGD	
CCS(=O)(=O)N1CCC[C@@H](C(=O)NNC(=O)COc2ccccc2-c2ccccc2)C1	918552481	UYNRFSWMRPWBFZ-GOSISDBHSA-N	445.541	1.942	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)CCNS(=O)(=O)c2cccc(Cl)c2)cc1	919835928	WHCVTSSPMHWFOT-UHFFFAOYSA-N	439.921	1.797	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@H]2C(=O)NNC(=O)OC(C)(C)C)cc1	920402461	YUZRHYMESQNGDJ-INIZCTEOSA-N	425.507	1.988	50	20	IDGD	
NC(=O)[C@H]1CCCN1Cc1cccc(NC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1	920932457	LLUXVHYRWQCYMT-VQIMIIECSA-N	439.472	1.129	50	20	IDGD	
CCCNC(=O)NNC(=O)c1cc(S(=O)(=O)N(CC)CC)ccc1N1CCCC1	921042480	XXNZKNWTOQUSJB-UHFFFAOYSA-N	425.555	1.671	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)CCCC[C@@H]2SC[C@H]3NC(=O)N[C@@H]32)c1C	921302586	ZTTUUNFKJQFOAP-RRIFGTCXSA-N	434.562	1.944	50	20	IDGD	
O=C(NC[C@H](c1cccs1)N1CCOCC1)NNC(=O)c1cncn1-c1ccccc1	1115850947	XFZFHJLJRRDVMQ-QGZVFWFLSA-N	440.529	1.951	50	20	IDGD	
CO[C@@H](CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)c1ccc(F)cc1	1116227921	YTYXETDAWCDSHA-KRWDZBQOSA-N	438.481	1.408	50	20	IDGD	
CCS(=O)(=O)c1cccc(NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c1	1323832580	YWFULYFZNGGKHE-UHFFFAOYSA-N	429.458	1.194	50	20	IDGD	
COC(=O)c1ccsc1N1CC[C@@H](NC(=O)NNC(=O)c2ccc(OC)cc2)C1=O	1339818876	NBUCNXQKOUXDHH-CQSZACIVSA-N	432.458	1.293	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)[C@H]1CC12CCS(=O)(=O)CC2	1340640291	ZGUBPAUQLAWSKE-CYBMUJFWSA-N	431.308	1.190	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](F)Cl)C2)ncc1[N+](=O)[O-]	1778025667	GAYCLLBFUWQKSI-IIDMSEBBSA-N	428.848	1.960	50	20	IDGD	
Cc1nnsc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Br)C2	1778238978	PNVYQGLTRQOWPN-IXPVHAAZSA-N	435.319	1.665	50	20	IDGD	
C[C@H](C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Br)C2)N1C[C@H]2C[C@@H]2C1	1779252727	GWDGZBONZBFREA-BJDQLAMTSA-N	446.361	1.531	50	20	IDGD	
CCC[C@@H](NC(C)=O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CO[Si](C)(C)C)C1	1779546613	ZDQZVQUMCQXKPM-DBXWQHBBSA-N	441.645	1.657	50	20	IDGD	
CCn1nc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)cc1C	1779713665	CXKBQGNSJOVXIL-ACJLOTCBSA-N	427.343	1.686	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(CO)o1)C2)[C@@H](F)Br	1780774653	GPUGWRMBPJDHQM-CKEIUWERSA-N	433.274	1.590	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2c(O)cc(O)cc2O)C1	1781028535	PYALSTWRZGPXRS-OWDMVUQNSA-N	426.897	1.948	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)C[C@H](O)CNC(=O)OC(C)(C)C)CCO2)C1	1781216486	JLGUECSZPNNOQU-AUSJPIAWSA-N	447.960	1.109	50	20	IDGD	
Cc1nnc(CCC(=O)N2CCO[C@]3(CCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)s1	1781224087	HHRIHUCVIODSAZ-DLBZAZTESA-N	435.377	1.845	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCc1cnn(C)c1)C2	1781998019	MSKDCNLSCJKHML-IDHHARJASA-N	441.370	1.650	50	20	IDGD	
Cn1nc2c(c1C(=O)N1CC[C@]3(C1)CN(C(=O)[C@@H](F)Br)CCO3)CCC2	1782439778	MCFYGRUJJXYOLY-PBHICJAKSA-N	429.290	1.043	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H]1C=CCN1)CCO2	1782864824	VFEJNKZCAZPDGD-ODXUAPNFSA-N	428.439	1.230	50	20	IDGD	
COc1ccc(Cl)cc1CC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1782976545	RMXKDUVITWDQHP-BEFAXECRSA-N	431.316	1.321	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H]3CCCO3)C2)C1	1783491109	PQWLMURGAZLKDH-BYCJELGNSA-N	431.439	1.881	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3csc4c3CCCO4)CCO2)C1	1783874241	AYJBGOKRIYDXAW-KXBFYZLASA-N	428.938	1.770	50	20	IDGD	
O=C(C(Cl)Cl)N1CC[C@@]2(C1)CN(C(=O)[C@H]1CC(c3ccccc3)=NO1)CCO2	1783942053	GUMOQXZBELSTQW-DNVCBOLYSA-N	426.300	1.813	50	20	IDGD	
O=C1CSc2ncc(C(=O)N3CCO[C@]4(CCN(C(=O)C(Cl)Cl)C4)C3)cc2N1	1783949874	NJOSWXLAUONCAT-KRWDZBQOSA-N	445.328	1.373	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnn4ccccc34)C[C@@H]21	1783965783	RKKNKIUZQLQFAH-OAOQPFQOSA-N	449.349	1.959	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)N3C[C@H]4C[C@H]4C3)C[C@@H]21	1783967812	XOEUVPVPTMJBDQ-MRMCGTTGSA-N	442.398	1.337	50	20	IDGD	
CCn1nc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]3C2)cc1C	1783970560	WMDKQCJNFBNSJP-DYWXZXKOSA-N	441.370	1.836	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H]3CCc4nc[nH]c4C3)C2)C1	1784353049	SJDWSQPWYODPJH-BIENJYKASA-N	439.354	1.518	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC1(c2ccc(NC(=O)Cc3ccn(C)n3)cc2)CCC1	1788218379	MCCOQMVNRSNOQB-UHFFFAOYSA-N	426.521	1.470	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)c1cnc2[nH]ncc2c1	1788274427	KVDUKOWCTKWYIW-NZPIUUIZSA-N	440.273	1.242	50	20	IDGD	
CCOc1ncccc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]2C1	1788762256	QVNUYXPDIORTFS-SZMVWBNQSA-N	435.597	1.925	50	20	IDGD	
Cc1onc(-c2ccncn2)c1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Cl)C[C@@H]21	1789191912	FCUCWYWRLDCDJB-MYLCLEHYSA-N	437.859	1.568	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CC(=O)OC(C)(C)C)C[C@@H]21	1790958319	OZYZLBKNARNONW-XQLPTFJDSA-N	447.370	1.871	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3CCN(C)CC3)C[C@@H]21	1790962233	RESFNPJVNNMDKZ-NXOAAHMSSA-N	430.387	1.481	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CC3CCC3)[C@H]2C1	1792178244	TUBUGIPEQCQOCI-QECDCCOMSA-N	429.521	1.290	50	20	IDGD	
COc1ncc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)CBr)cc1F	1792870394	NFWYBZDJTXNZHE-DNVSUFBTSA-N	444.301	1.464	50	20	IDGD	
CC(C)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CNC(=O)c1cccs1	1794115472	YWQSCUSVBQBQLO-YWVIFJGQSA-N	427.954	1.333	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cn1ccnc1)C2	1794141004	BYDNXBUWQMZIGP-FZKCQIBNSA-N	439.944	1.653	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)nc(Cl)c1	1794415428	HSUDGCSHEJRQAC-FVCICTRLSA-N	427.961	1.495	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1cccc(Cl)n1	1794483990	GUPCISRDNCYTFO-QDMKHBRRSA-N	442.907	1.228	50	20	IDGD	
CC(C)(C)OC(=O)CCCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1	1796188022	VVMVDQHGERDWCO-REPLKXPHSA-N	444.337	1.130	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Br)C2	1796838774	XAWODRIRASRBEL-OEYIWLLWSA-N	435.322	1.629	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](OC(C)=O)C(C)C	1797596963	WGMUPKMTVMDINE-QRJUGERDSA-N	433.343	1.337	50	20	IDGD	
Cn1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CO[Si](C)(C)C)c(C(F)F)n1	1797955829	HHHPTEPNSCPLCU-JJLQDPRZSA-N	430.528	1.412	50	20	IDGD	
CC(C)(C)n1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)cn1	1798440646	GIIJUPMQXSNZMK-MUJYYYPQSA-N	439.520	1.202	50	20	IDGD	
CCS(=O)(=O)N[C@H](C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@](C)(Cl)CCl	1800076151	BQEDJWUAEIQJQH-GUYIQFIESA-N	428.382	1.189	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCCn1ccnc1C	1801310497	BQEGYJXKBBWBCW-KYHPRHEASA-N	441.370	1.735	50	20	IDGD	
CC(C)c1ccc(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)cc1	1801857552	VSGDWSXPOCDFQJ-NUNAXRQHSA-N	434.345	1.984	50	20	IDGD	
COC[C@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1(NC(=O)OC(C)(C)C)CC1)C2	1802283712	XNRMKOLYGTVJCL-XGUBFFRZSA-N	429.945	1.936	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc3cc(F)ccc3[nH]1)C2	1802336657	SFOMFSIGDVJPKT-BJWYYQGGSA-N	429.496	1.932	50	20	IDGD	
C[C@@H]1CCc2c(C(=O)N3CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]3c3cccnc3)n[nH]c21	1803138431	ARHLHPGZNDSCPL-OZSDWXKXSA-N	431.924	1.774	50	20	IDGD	
C=CCOCCCC(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1803560692	OGDKNODPHKWBFG-AUSIDOKSSA-N	445.564	1.443	50	20	IDGD	
C=CCNC(=O)/C=C\C(=O)N1CCCC2(CCN(C(=O)[C@@H](C)Br)CC2)C1	1804857948	SJNPGNFPJKFSGE-IYKSTZQJSA-N	426.355	1.859	50	20	IDGD	
Cc1ncccc1C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1807365668	ZJTGDAAPAXPTIZ-DENIHFKCSA-N	444.300	1.098	50	20	IDGD	
C=CCSCC(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1807369864	XKFDZDAKZORBKI-GHTZIAJQSA-N	439.346	1.000	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)C(Cl)Cl)[C@H]1c1cccnc1)c1nc[nH]c1[N+](=O)[O-]	1808370882	INFOFOYVJJEPAD-PWSUYJOCSA-N	427.248	1.836	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2cccn(C)c2=O)[C@H]1c1cccnc1	1813028950	ZBRAELSAUAZSFM-NJAFHUGGSA-N	432.908	1.354	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)Cc2c(C)nn(C)c2C)[C@H]1c1cccnc1	1813033128	IQFXJKBNVFDRKF-LMNJBCLMSA-N	447.967	1.934	50	20	IDGD	
C[C@H](CS(C)(=O)=O)C(=O)N1CC[C@@H](CNC(=O)C(Cl)Cl)[C@H]1c1cccnc1	1813075825	JSUWFHRGOVTOKV-KWCYVHTRSA-N	436.361	1.572	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)CSCC(=O)O)[C@@H]1c1cccnc1	1813088366	BCHAZFZDEOIVRM-KEYYUXOJSA-N	429.926	1.159	50	20	IDGD	
O=C(CCc1ccoc1)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1813522574	FLOFUFYFOZILKG-OFNKIYASSA-N	447.300	1.307	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CN2CCSCC2)n[nH]1	1814416752	FCPHZJHLXHAOAX-ZFWWWQNUSA-N	429.974	1.704	50	20	IDGD	
Cc1cc(NC(=O)CC(=O)N2CCCC[C@H]2c2cc(NC(=O)[C@H](O)CCl)n[nH]2)no1	1814871409	OKEANOIXAISLAN-QWHCGFSZSA-N	438.872	1.327	50	20	IDGD	
Cn1nc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)[C@H](F)Br)[nH]n2)cc1O	1816123232	LUQPEFWOXCNXFZ-GWCFXTLKSA-N	429.250	1.845	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(O)nc(O)n3)sc2C1	1817109056	UYGKYFLPYNFNAZ-NKWVEPMBSA-N	442.295	1.354	50	20	IDGD	
CC(C)(C)OCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819401662	NCEYINVGYPFPSM-MRXNPFEDSA-N	443.508	1.529	50	20	IDGD	
Cc1ccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cnccc3C(=O)NN)n[nH]2)nc1	1819402258	XEWUHYKCMKUJPA-SFHVURJKSA-N	448.487	1.731	50	20	IDGD	
CCCC(=O)N[C@H](C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1	1819565510	MTUQIXFXRRIOAD-ZBFHGGJFSA-N	449.556	1.080	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(C#N)c[nH]2)n[nH]1	1820310474	SIXWVGWTNHLLPD-INIZCTEOSA-N	426.481	1.288	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1)[C@@H]1CC[C@@H]2CCC(=O)N2C1	1820758039	VXRSSSAMTXKJEY-LUYZLQTOSA-N	437.928	1.403	50	20	IDGD	
Cc1cc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@@H](O)CCl)CC3)nn1C(F)F	1821555550	QYCMSOQZWCKIPT-KWQFWETISA-N	433.868	1.869	50	20	IDGD	
O=C1C[C@H](C(=O)N[C@H]2CCc3nc(NC(=O)[C@H](F)Br)sc3C2)CCN1	1823014392	VQSAETSQYFHECR-LWINAJNOSA-N	433.303	1.272	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CSc1ncccn1)CC2	1825998927	KFOJWYMXWXCCQV-MNOVXSKESA-N	441.966	1.891	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(Cl)o1)CC2	1826085762	BPJUTFSZLNUDKT-SNVBAGLBSA-N	439.925	1.988	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccccc1F)CC2	1826088374	FFQLACSTTNLHOP-GFCCVEGCSA-N	433.509	1.881	50	20	IDGD	
CCn1nc(C)cc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1	1827424846	SROOJRXJUYIEPN-LJQANCHMSA-N	446.596	1.818	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H](C)Cn2cncn2)CC1	1829056991	DUVSZJZPFXEDKG-RYQLBKOJSA-N	425.961	1.788	50	20	IDGD	
Cn1ncc2cc(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)C(C)(C)CCl)CCO4)ccc21	1830362117	LSRZQFPXGLKPHP-JOCHJYFZSA-N	448.951	1.908	50	20	IDGD	
O=C(C[C@@H]1CCCCO1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1832346044	HXJHTNOINMRVQR-LXZKKBNFSA-N	437.306	1.093	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)CN3CCCC3)CC2)CC1	1833102733	CVHHOFPYHXCFAN-GOSISDBHSA-N	443.430	1.827	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3ccnc(C(F)F)c3)CC2)CC1)[C@@H](O)CCl	1833307992	GKVDLRIIAIOQDP-KRWDZBQOSA-N	444.910	1.804	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCC(N2CCC(NC(=O)CN3CCOC3=O)CC2)CC1	1833384922	VBRXVDRHIUNEQP-UHFFFAOYSA-N	428.961	1.275	50	20	IDGD	
O=C(c1cccnc1OCC1CC1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1833625336	PVPALVNGVGSVKR-OXQOHEQNSA-N	441.887	1.475	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3cncnc3)CC2)CC1	1834237832	FQEDHRYXIMWZQE-QGZVFWFLSA-N	438.370	1.835	50	20	IDGD	
Cc1nc[nH]c1C(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)Br)CC2)CC1	1835193182	HKUSXZONUDZGJA-GFCCVEGCSA-N	426.359	1.687	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)c1ccc2nonc2c1	1835320380	NPESWAVCSMQSMQ-SFHVURJKSA-N	435.912	1.008	50	20	IDGD	
O=C(Nc1cccnc1)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](F)Cl)CC2)CC1	1835802803	KCCAAZSMYOTWLW-MRXNPFEDSA-N	425.892	1.126	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1Cc3ccccc3O1)CCO2	1836643781	KXFJFDWJWLWZPB-LQBOVUBWSA-N	436.936	1.854	50	20	IDGD	
O=C(c1n[nH]c2cc(Cl)ccc12)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1837085295	LNVLIMXNBQFAKA-YJBOKZPZSA-N	445.278	1.821	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4cccnc4[nH]3)C2)C1	1837713263	RIVLVXXWMOGWEM-OAQYLSRUSA-N	446.580	1.484	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnccc3Cl)CCO2)C1	1837780383	FFZCUTBGTFJUMT-YVEFUNNKSA-N	446.729	1.588	50	20	IDGD	
C[C@H](C(=O)N1CCC(OC2CCN(C(=O)[C@H](F)Cl)CC2)CC1)[C@H]1SC(=N)NC1=O	1838083510	UPALSBYHBUCGAF-GDLCADMTSA-N	448.948	1.322	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(C#N)c[nH]3)CCO2)C1	1838740190	HCUHCWBXOHXPJF-RDTXWAMCSA-N	439.310	1.130	50	20	IDGD	
O=C(O)CSCC(=O)N1CCC(OC2CCN(C(=O)C(Cl)Cl)CC2)CC1	1838788940	DVHKKNKWARDGJF-UHFFFAOYSA-N	427.350	1.607	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3nc(Cl)ccc3F)C2)C1	1839142411	NSBYPXRUHGIULR-KZULUSFZSA-N	434.295	1.962	50	20	IDGD	
CC(C)N[C@H](C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2)C(C)C	1840032127	OEMDIVRHGIINLV-JTDSTZFVSA-N	448.402	1.249	50	20	IDGD	
Cc1cccc(F)c1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)Br)CCO2	1840037303	YAJJJSGEDLLFEE-LIRRHRJNSA-N	443.313	1.988	50	20	IDGD	
O=C(C#Cc1ccc(Cl)cc1)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840187245	OWRKKTRNWQOMAP-IBGZPJMESA-N	445.730	1.952	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H]1CC(=O)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1	1841350108	IPLNDSRCVFKQBE-GJZGRUSLSA-N	429.945	1.579	50	20	IDGD	
O=C(NNC(=O)c1cccnc1S)c1cccc(S(=O)(=O)NCc2ccccc2)c1	10125181	CFOLYNXDDWDCOR-UHFFFAOYSA-N	442.522	1.924	50	20	IDGD	
Cc1cccc(NS(=O)(=O)c2ccc(C(=O)NNc3nnc(C)c(=O)[nH]3)cc2)c1C	11266058	XAFMAMAMOTYQSX-UHFFFAOYSA-N	428.474	1.648	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CCc2c(C)nc(SC)[nH]c2=O)cc(OC)c1OC	14289030	SLIKWZUFICYJBI-UHFFFAOYSA-N	436.490	1.220	50	20	IDGD	
CCOC(=O)Nc1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1	14841572	IQRANEDGCMZJQU-UHFFFAOYSA-N	434.474	1.580	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)ccc1OC(F)F	15379436	WQACENGEKXTGKM-UHFFFAOYSA-N	442.444	1.973	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)c3ccncc3)c2)cc1	17396469	IBZRRBFHTAZVOR-UHFFFAOYSA-N	426.454	1.966	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)n[nH]1)c1cccc(S(=O)(=O)N2CCCC2)c1	17519129	YYNNCVVHWDGURD-UHFFFAOYSA-N	439.497	1.936	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)c2cn(C3CCN(C(=O)OC(C)(C)C)CC3)nn2)c(O)c1	725888251	LUGTWPIHMCCMEF-UHFFFAOYSA-N	444.492	1.939	50	20	IDGD	
COCCCNC(=S)N(C)NC(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc(C)cc1	726075868	IICSOIPWDIERJX-INIZCTEOSA-N	428.580	1.022	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NCCc1cc(Br)ccc1F	726244609	DXBBLEGBAGYJHZ-UHFFFAOYSA-N	443.298	1.953	50	20	IDGD	
CNS(=O)(=O)c1cccc([C@H](C)NC(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)c1	727609323	JLWFXRBCJRBFQT-QWHCGFSZSA-N	438.481	1.593	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)c1	728213370	YYXXQBABHFXXKY-QGZVFWFLSA-N	432.546	1.842	50	20	IDGD	
CCOC(=O)C1=NN(c2ccccc2)[C@@H](C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)C1	728712705	BJQTUGJZEOYCFN-QGZVFWFLSA-N	425.401	1.554	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)CS(=O)(=O)Cc1cccc(Br)c1	728850394	PMRLMIQTOJGQRJ-UHFFFAOYSA-N	426.292	1.149	50	20	IDGD	
O=C(NNC(=O)N1CCN(c2ccccc2Cl)CC1)C1CCN(c2ncccn2)CC1	728959803	QJUDJGVSTFXVFX-UHFFFAOYSA-N	443.939	1.909	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)c1cc(S(=O)(=O)N2CCSCC2)c[nH]1	729453917	DKOLFAJROZOTMG-UHFFFAOYSA-N	447.542	1.168	50	20	IDGD	
CC(C)C[C@H](C(=O)NNC(=O)CCc1ccccc1O)N1C(=O)[C@@H]2CC=CC[C@H]2C1=O	730034042	OIYSRVARBQNMPU-KZNAEPCWSA-N	427.501	1.838	50	20	IDGD	
O=C(CC[C@@H]1NC(=O)N(c2ccc(Cl)c(Cl)c2)C1=O)NNC(=O)NCC1CC1	730531809	BAUBTLJIZRVUOH-ZDUSSCGKSA-N	428.276	1.939	50	20	IDGD	
CC(C)C[C@H](C(=O)NNC(=O)COc1ccccc1O)N1C(=O)[C@H]2CC=CC[C@@H]2C1=O	730778493	IYGLNETWKHDVHH-HRCADAONSA-N	429.473	1.284	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2nnc(O)c3ccccc23)nnn1-c1cccc2ncccc12	731341323	AWACSGRAPQVDCO-UHFFFAOYSA-N	440.423	1.848	50	20	IDGD	
CC(=O)Nc1ccc(NS(C)(=O)=O)c(C(=O)NNC(=O)c2c[nH]c3ccccc23)c1	731434611	OXUVEXHMLFFLRT-UHFFFAOYSA-N	429.458	1.573	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc2c(c1)C(=O)NC2=O)c1ccc(F)cc1Br	731596559	PVLNRVZJEITEJP-UHFFFAOYSA-N	442.222	1.095	50	20	IDGD	
Cc1nc(-c2c[nH]c(C(=O)NNC(=O)c3ccc(Cl)c(S(N)(=O)=O)c3)c2)cs1	731785215	SWJYYTGPNFMBJU-UHFFFAOYSA-N	439.906	1.822	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)N1CCC[C@H](C(=O)Nc2ccc(Br)cn2)C1	731849087	RIVFVQPETPRUBT-RYUDHWBXSA-N	426.315	1.441	50	20	IDGD	
O=C(CCN1CCN(C(=O)[C@@H]2CCCO2)CC1)NNc1ccc(Cl)cc1[N+](=O)[O-]	732057543	IKVAOMQVXNWYJO-INIZCTEOSA-N	425.873	1.405	50	20	IDGD	
C[C@@]1(c2ccccc2)NC(=O)N(CC(=O)NNC(=O)NCc2ccc(Cl)cc2)C1=O	733004475	JXISKUYOPBBLMS-FQEVSTJZSA-N	429.864	1.638	50	20	IDGD	
CCOCCCn1c(NNC(=O)CNC(=O)c2ccoc2C)nc2ccccc2c1=O	733365107	GNGAKDUTGJCLBL-UHFFFAOYSA-N	427.461	1.598	50	20	IDGD	
Cc1cc(C=NNC(=O)N[C@H]2CCS(=O)(=O)C2)c(C)n1-c1ccc2c(c1)OCCO2	734296473	SWLKSESHKIUPPN-INIZCTEOSA-N	432.502	1.686	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)N[C@H]1CCN(c2ccccc2OC(F)F)C1	735112739	IKAVREGUMHDNPS-ZDUSSCGKSA-N	436.415	1.982	50	20	IDGD	
C[C@@H]1OC(C)(C)N(C(=O)OC(C)(C)C)[C@@H]1C(=O)NNC(=O)c1ccc2c(c1)OCCO2	735839694	FGQMTOPKOAYHOG-LRDDRELGSA-N	435.477	1.979	50	20	IDGD	
CCc1cc(CNC(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)n[nH]1	739020671	PEKMFEQYTBWSEA-UHFFFAOYSA-N	445.483	1.875	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)NCCNc2nccc(C(F)(F)F)n2)c1	739046817	WPLWTHGRIIYGNU-UHFFFAOYSA-N	426.399	1.934	50	20	IDGD	
COCCN1C(=O)c2ccc(C(=O)NNc3cccc(C(F)(F)F)n3)cc2S1(=O)=O	740141421	CGYWZRBXNJKVDK-UHFFFAOYSA-N	444.391	1.648	50	20	IDGD	
COc1ccc(-c2n[nH]c(CNC(=O)NNC(=O)[C@@H](C)Oc3ccccc3F)n2)cc1	741420366	ZKWRGXIPGSNLBJ-GFCCVEGCSA-N	428.424	1.917	50	20	IDGD	
Cc1nn(C)c2sc(C(=O)N[C@@H](C)C(=O)NNC(=O)NCCc3cccs3)cc12	742053117	DJARDFKWUPAEGJ-NSHDSACASA-N	434.547	1.696	50	20	IDGD	
C[C@H]1C[C@@H](NC(=O)NNC(=O)c2ccc(Br)s2)C(=O)N1c1cnn(C)c1	743518787	UJZFPLOPIBYLDO-WCBMZHEXSA-N	441.311	1.382	50	20	IDGD	
COc1ccccc1N1C[C@H](C(=O)NNC(=O)c2cc(Br)ccc2O)CC1=O	743731877	BHQCBXWQQWNOSH-LLVKDONJSA-N	448.273	1.977	50	20	IDGD	
N#Cc1ccc(SCC(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)cc1	744622257	YPQMXEPXLVWFES-UHFFFAOYSA-N	432.527	1.815	50	20	IDGD	
CCCS(=O)(=O)Nc1ccccc1C(=O)OCC(=O)NNC(=O)c1cccc(C#N)c1	744829548	QBLCDIFWEMHIHZ-UHFFFAOYSA-N	444.469	1.328	50	20	IDGD	
O=C(COC(=O)[C@@H]1CCSc2ccccc21)NNC(=O)[C@H]1COc2ccccc2O1	745427543	MHGQLPUDIODANH-RHSMWYFYSA-N	428.466	1.797	50	20	IDGD	
O=C(CN1CCN(C(=O)OCc2ccccc2)CC1)NNC(=O)c1c[nH]c2ccccc12	747350113	OHVJPVWLCTWUMM-UHFFFAOYSA-N	435.484	1.883	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@@H](C)C(=O)NNC(=O)CNS(=O)(=O)CCOC(C)C	747905524	DELQVUYCZVOJCD-AWEZNQCLSA-N	449.957	1.216	50	20	IDGD	
Cc1cc(NNC(=O)CCN2CCN(C(=O)[C@H]3CCCO3)CC2)ccc1Br	748607944	XJBUNZUTJCRRNO-QGZVFWFLSA-N	439.354	1.914	50	20	IDGD	
COC[C@@H](C)n1c(C)cc(/C=C(/C#N)C(=O)N2CCN(CCn3cncn3)CC2)c1C	749397994	XGHCLGRQHDCUAN-UZQMFHLOSA-N	425.537	1.655	50	20	IDGD	
Cc1cc(NC(=O)CN2CCN(C(=O)NNC(=O)c3cc4ccccc4o3)CC2)no1	750285228	ZEHRVUBEICEGIW-UHFFFAOYSA-N	426.433	1.340	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)c2ccc(CS(C)(=O)=O)o2)c2ccccc2c1=O	751293277	IFGSQTLUCWQGAS-UHFFFAOYSA-N	432.458	1.190	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Cc2cc(=O)n(CC(C)C)[nH]2)cc1Br	752097501	UACCPFDOHHYHNT-UHFFFAOYSA-N	425.283	1.607	50	20	IDGD	
CC[C@H](CS(=O)(=O)c1ccccc1)NC(=O)NNc1ccccc1S(C)(=O)=O	752702158	ADJIMZJMFYEQCX-CQSZACIVSA-N	425.532	1.969	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)N[C@@H]2CCCN(Cc3ccccn3)C2=O)cc1C	753289204	KOXMSHAXKZEBEI-LJQANCHMSA-N	425.489	1.599	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(NC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])c1	755368478	XEMHDUZINOAMGM-UHFFFAOYSA-N	437.434	1.077	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNS(=O)(=O)c2cc(F)cc(Cl)c2)cc1	755407001	HOCUDIXOTXDMIP-UHFFFAOYSA-N	449.913	1.418	50	20	IDGD	
COC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2ncccc2C)c1Br	756169128	GVZALZSVHCISTO-UHFFFAOYSA-N	435.234	1.339	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1ncc(C2CCCCC2)s1	756190449	SBFSBIPWVSIPMX-UHFFFAOYSA-N	435.531	1.768	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)Nc1ccc(N2CCOCC2)c(F)c1	756335197	AQHGLQQQRPHLIR-UHFFFAOYSA-N	426.412	1.105	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)Nc2cc(Cl)ccc2OCCS(C)(=O)=O)n1	756813975	WCYOOHLSORCMPU-UHFFFAOYSA-N	443.913	1.430	50	20	IDGD	
O=C(Cc1cccc2ccccc12)NNC(=O)Nc1cnn(CC(=O)N2CCOCC2)c1	756834263	DGUZVOQVRPWUHW-UHFFFAOYSA-N	436.472	1.291	50	20	IDGD	
C[C@H]1C[C@@H](C)C[C@]2(C1)NC(=O)N(CC(=O)NNC(=O)c1cc(-c3ccccc3)on1)C2=O	756901054	HWJPQXGFEZMTDG-HSAQVAQVSA-N	439.472	1.849	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])c(OC)c1	757188585	ORMPDQZCDCAHMX-UHFFFAOYSA-N	436.808	1.917	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)N[C@H]1CCN(C(=O)CCc2ccccc2)C1	757273064	IJXLICDYPSMJSK-KRWDZBQOSA-N	425.445	1.773	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)c(=O)n(C)c1	757716515	VKDJBBBQNQYFLR-UHFFFAOYSA-N	447.517	1.335	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)Nc2ccc(C(=O)N3CCOCC3)cc2C)c1O	757830993	OGTNKLKLWQBYTO-UHFFFAOYSA-N	428.445	1.648	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN(c2ncccc2C(F)(F)F)C1)C(=O)Nc1ccccn1	758835915	YOHXVURGSRFJNB-LBPRGKRZSA-N	436.394	1.498	50	20	IDGD	
CN(c1ccccc1)S(=O)(=O)c1cccc(NC(=O)C(=O)NNC(=O)C(C)(C)C)c1	761064390	XZPLTWKGAQVPSC-UHFFFAOYSA-N	432.502	1.644	50	20	IDGD	
CCc1csc(-n2cc(C(=O)OCC(=O)NNC(=O)Cc3nc(C)cs3)cn2)n1	762885606	QXZSSUPWSMVMDJ-UHFFFAOYSA-N	434.503	1.203	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)c1cn(C2CC2)c2cc(Cl)c(F)cc2c1=O	763038540	AONBAEGDSZFPRV-UHFFFAOYSA-N	446.822	1.913	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1cc(F)ccc1OC[C@@H]1CCCO1	763467310	BPYAVTJOMNVKMW-HNNXBMFYSA-N	446.391	1.691	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccc(C#Cc2ccccn2)c1	763648806	XEHPZPXIFQKYMD-UHFFFAOYSA-N	444.447	1.655	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc2c(c1)CCC(=O)N2C	763682872	QJVKGUJOVVPEAV-UHFFFAOYSA-N	440.456	1.159	50	20	IDGD	
CSc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(Br)cc2)cn1	763695947	ZIRUHSFIUKWKNZ-UHFFFAOYSA-N	439.291	1.731	50	20	IDGD	
N#Cc1cccnc1-n1cc(NC(=O)C(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)cn1	763728285	QJTIIJDPTJJVNY-UHFFFAOYSA-N	433.472	1.441	50	20	IDGD	
CCOC(=O)N(C)c1ccc(NC(=O)C(=O)NNC(=O)c2cccc(N(C)C)c2)cc1	763754135	MIFKIOWQDDPNKC-UHFFFAOYSA-N	427.461	1.745	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2ccccc2OC(C)C)c2ccccc2c1=O	763786942	RPSONEGVNYSJMY-UHFFFAOYSA-N	437.456	1.603	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1Br)C(=O)NNC(=O)CNC(=O)c1cccnc1	763825487	YNSNFZJLTQGMIA-SNVBAGLBSA-N	439.241	1.328	50	20	IDGD	
COC(=O)c1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)Cc1c[nH]c2ccccc12	763860624	KLBCMMNBSZQANZ-UHFFFAOYSA-N	428.832	1.937	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cc(C#N)ccc2Cl)cc1	763871048	CZQWGJMFXDQWBF-GFCCVEGCSA-N	428.832	1.968	50	20	IDGD	
CC(=O)Nc1ccc(C)c(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(C(C)=O)cc2)c1	763872121	KLJRXQCSJHJZLE-AWEZNQCLSA-N	440.456	1.709	50	20	IDGD	
COC(=O)c1ccc(OC)cc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccc(F)cc1	763872754	OOMATMXENJKEPT-NSHDSACASA-N	433.392	1.174	50	20	IDGD	
COc1ccncc1NC(=O)C(=O)NNC(=O)c1ccc(OCCC(C)C)c(OC)c1	763914464	MDAGQNUFFQGOHO-UHFFFAOYSA-N	430.461	1.923	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)C(=O)Nc1cccc2c1CCN2C(=O)OC(C)(C)C	763998048	DYQPWMVFGFAANJ-UHFFFAOYSA-N	427.461	1.722	50	20	IDGD	
CSc1cc2c(cc1NC(=O)C(=O)NNC(=O)c1ccc3c(c1)OCCO3)OCCO2	764003482	DWKBNAOAXSOAKD-UHFFFAOYSA-N	445.453	1.351	50	20	IDGD	
CCN1CCC(n2nccc2NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2OC)CC1	764012536	RXAYIVFKVNQQBV-UHFFFAOYSA-N	448.911	1.602	50	20	IDGD	
COCc1cc(NC(=O)C(=O)NNC(=O)c2ccc(Br)cc2Cl)ncn1	764059017	MVDVHORYLBFIEH-UHFFFAOYSA-N	442.657	1.439	50	20	IDGD	
CNC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)ccc1Cl	764127035	QSCJODNDBDSJSL-UHFFFAOYSA-N	425.228	1.458	50	20	IDGD	
COCCOc1ccc(C#N)cc1NC(=O)C(=O)NNC(=O)c1cccc2cccnc12	764151563	JLOYSDZTDUKCBB-UHFFFAOYSA-N	433.424	1.531	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccccc2I)cc1	764177432	NOANDMAVFUBOKA-UHFFFAOYSA-N	434.193	1.563	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc(Br)ccc2O)c(N(C)C)n1	764277343	KVFNERDATBXJJH-UHFFFAOYSA-N	436.266	1.324	50	20	IDGD	
CC(C)n1nnnc1-c1ccc(NC(=O)C(=O)NNC(=O)Cc2ccccc2F)cc1F	764318666	HILUSSFENBUSHN-UHFFFAOYSA-N	443.414	1.528	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2scnc2C2CC2)n[nH]1	764377359	OCDQNHCEAAZHNF-UHFFFAOYSA-N	426.458	1.819	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)Cc3ccc(OCC#N)cc3)CC2)cc1	765754505	LTUCYCIHEJIBHB-UHFFFAOYSA-N	435.528	1.405	50	20	IDGD	
Cn1cc([N+](=O)[O-])c(C(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)n1	767163071	BKXVHDGZLZWHEN-UHFFFAOYSA-N	447.415	1.105	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2ccc(F)cc2C(=O)N(C)C)c1	768232045	JKEYIIXNFAPXMN-UHFFFAOYSA-N	430.436	1.309	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2ccc(F)cc2C(=O)N(C)C)cc1	768238845	GEUGQRQDEIXDJZ-UHFFFAOYSA-N	430.436	1.255	50	20	IDGD	
O=C(CSCc1cc(=O)n2ccsc2n1)NNC(=O)c1cc(-c2cccs2)[nH]n1	768263676	YJWFHJXEMOCFFQ-UHFFFAOYSA-N	446.539	1.902	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2O)c1	768918284	HPASMECXGLHRMU-UHFFFAOYSA-N	436.446	1.406	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2ccnn2-c2cccc(F)c2)c1	770773401	IUNOTVXFHBCGHR-UHFFFAOYSA-N	425.420	1.793	50	20	IDGD	
CSc1nc(C)c(CCC(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)c(O)n1	770965703	JXJXULIORHDRML-UHFFFAOYSA-N	432.510	1.889	50	20	IDGD	
Cn1c(O)nc2ncc(-c3cccc(C(=O)NNC(=O)[C@@H]4COc5ccccc5O4)c3)cc21	771823003	YHCGNIMGZSHNFK-IBGZPJMESA-N	445.435	1.942	50	20	IDGD	
CCCCn1ncc(C(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)c1C	772476838	MMDJVLCWBRHCRG-UHFFFAOYSA-N	426.565	1.879	50	20	IDGD	
COC(=O)Cn1cc(C(C)=NNC(=O)c2cc(-c3ccc(OC)c(OC)c3)[nH]n2)nn1	772842896	DTFHXHPKGVTUMK-UHFFFAOYSA-N	427.421	1.012	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc2c(c1)CCN2C(=O)C(=O)NNc1ccc(C#N)cc1	773696408	AJDFGFULEAMCSX-UHFFFAOYSA-N	441.513	1.621	50	20	IDGD	
O=C(NNc1ncccn1)C(=O)Nc1ccc(CCn2cc(Br)cn2)cc1	773718890	HXZJNXPPLGGHQA-UHFFFAOYSA-N	430.266	1.760	50	20	IDGD	
CCc1ccc(NC(=O)C(=O)NNc2cccc(C(F)(F)F)c2)cc1S(N)(=O)=O	773740087	MHYGDPXCTZLDAL-UHFFFAOYSA-N	430.408	1.997	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ccc(C)c(F)c2)c(OC)c(OC)c1	773889054	LTQDAWODXZBHMS-UHFFFAOYSA-N	433.392	1.338	50	20	IDGD	
CC(C)c1nccnc1NNC(=O)C(=O)Nc1ccc(NS(C)(=O)=O)c(Cl)c1	774000257	REFRJRIKCUXLDR-UHFFFAOYSA-N	426.886	1.707	50	20	IDGD	
CC(=O)NCc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)cc1	774007549	BQFWKYYNBXWXLH-GFCCVEGCSA-N	432.864	1.530	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1cccc(C(=O)NC2CC2)c1	774009505	POGMJJBVNCCQGA-GFCCVEGCSA-N	444.875	1.786	50	20	IDGD	
COC(=O)Cc1ccccc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1cccc(Cl)c1	774010193	VTDVBLODUIIRKL-GFCCVEGCSA-N	433.848	1.609	50	20	IDGD	
O=C(CN1CCCN(c2nc3ccc([N+](=O)[O-])cc3[nH]2)CC1)NNC(=O)c1cccs1	775673920	SMIPHFUHZZPHEA-UHFFFAOYSA-N	443.489	1.506	50	20	IDGD	
C[C@@H]1C[C@H](C(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)CCO1	776338946	PZQSQAUJZPQUMT-CRAIPNDOSA-N	431.514	1.741	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)N[C@@H]3CCN(c4ccc(F)c(Cl)c4)C3=O)nc21	777751419	DJWVOLIOPMAJTM-GFCCVEGCSA-N	434.819	1.293	50	20	IDGD	
COC[C@H](C)C(C)=NNC(=O)C[C@H]1c2cc(OC)c(OC)cc2CCN1S(C)(=O)=O	777876670	BAJPSYYLZZNSAO-GUYCJALGSA-N	441.550	1.727	50	20	IDGD	
CN(NC(=O)c1cc(I)ccc1I)C(N)=O	778417621	WGKRKYLLMSARNW-UHFFFAOYSA-N	444.998	1.551	50	20	IDGD	
COc1ccc(Cn2ccc(NC(=O)C(=O)NNC(=O)c3cc(Cl)ccc3O)n2)cc1	778709561	IKSQCWVNLBOXHS-UHFFFAOYSA-N	443.847	1.699	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1	781687780	VZIUEQHYQITSGM-UHFFFAOYSA-N	433.368	1.665	50	20	IDGD	
O=C(NNc1ncncc1Cl)C(=O)N1C[C@H](C(=O)N2CCCCC2)Oc2ccccc21	782158789	CLOAXERNKWDUQE-MRXNPFEDSA-N	444.879	1.380	50	20	IDGD	
CC[C@@H](C)Oc1ccc(NC(=O)C(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1	782897177	LXYUFTGUJXYFHP-CYBMUJFWSA-N	447.517	1.557	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)C(=O)Nc2cc(C(=O)OC)cc(OC)c2OC)c1	784850736	BOIUIRWXQAPQGX-UHFFFAOYSA-N	431.401	1.359	50	20	IDGD	
C[C@@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(NC(=O)C(=O)NNc3cccnn3)cc2)C1	784858386	LEEQHOJGUKBLNC-ZIAGYGMSSA-N	432.506	1.225	50	20	IDGD	
COC(=O)CNC(=O)Cc1ccc(NC(=O)C(=O)NNc2ccc(Cl)c(F)c2)cc1	785179661	MVORZIBQIXUYBJ-UHFFFAOYSA-N	436.827	1.393	50	20	IDGD	
COc1cc(NNC(=O)c2ccc(S(=O)(=O)N3CCNC(=O)C3)cc2)ccc1Cl	790181789	YZFPEBYAIPGRKT-UHFFFAOYSA-N	438.893	1.226	50	20	IDGD	
Cc1ccn(C[C@@](C)(O)C(=O)OCC(=O)C(C#N)=C2N(C)c3ccccc3N2C)c(=O)c1	790687073	GDCIPJPHWDNSHH-HSZRJFAPSA-N	436.468	1.341	50	20	IDGD	
COc1ccc(OC)c(C2=NO[C@H](C(=O)NNC(=O)[C@@H]3COc4ccccc4O3)C2)c1	791450961	ZOJWGNLJLSJYGB-OALUTQOASA-N	427.413	1.184	50	20	IDGD	
Cc1sc2ncn(CC(=O)NNc3ccccc3S(=O)(=O)N(C)C)c(=O)c2c1C	795160584	DVWMAJRYFWXACT-UHFFFAOYSA-N	435.531	1.468	50	20	IDGD	
O=C(CN1CCCC[C@H]1COC(=O)N[C@H]1CCOC1)NNC(=O)c1ccccc1Cl	796549599	OORJRSSJRVZHHI-GJZGRUSLSA-N	438.912	1.471	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CN2CCC[C@@H]2COC(=O)NC2CCCCC2)c1	796681459	FOWCFAYEYBUHPF-LJQANCHMSA-N	427.505	1.843	50	20	IDGD	
C[C@@H]1CN(S(=O)(=O)c2ccc(C(=O)NNC(=O)CNc3ccccc3)cc2)C[C@@H](C)O1	799380848	MUPVZQNYJHIVAK-HZPDHXFCSA-N	446.529	1.358	50	20	IDGD	
COc1ccc(-c2nc(C)c(C(=O)NNC(=O)N[C@@H]3CCS(=O)(=O)C3)s2)c(F)c1	800328328	LJTUBGFAJRYJKG-SNVBAGLBSA-N	442.494	1.397	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2CCCN(C(=O)COc3ccccc3)C2)cc1	801107213	QHYLRLXMELWLFJ-QGZVFWFLSA-N	438.484	1.399	50	20	IDGD	
CS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)cc1[N+](=O)[O-]	801180548	IQRKGJXVASATHL-UHFFFAOYSA-N	435.443	1.525	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)CN(C)C2=NS(=O)(=O)c3ccccc32)c(Cl)c1	802050853	HWTDKDWVLPAHMF-UHFFFAOYSA-N	435.893	1.882	50	20	IDGD	
O=C(CNC(=O)c1ccc(Br)o1)NNC(=O)Nc1ccc2c(c1)OCO2	802106225	XESVKLGXSKSETG-UHFFFAOYSA-N	425.195	1.354	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)N[C@H]1CCCN(C(=O)Cc2ccccc2)C1	802472220	HXKIZKHTXFPFKU-KRWDZBQOSA-N	430.530	1.950	50	20	IDGD	
Cc1cccc(C(=O)NNS(=O)(=O)c2ccc(S(C)(=O)=O)cc2Br)n1	802721957	CTWNOYWRFDLRCD-UHFFFAOYSA-N	448.320	1.179	50	20	IDGD	
CC(C)(C)OC(=O)N1CCOC[C@@H]1CC(=O)NNC(=S)NCCc1cccs1	803159944	UKIYKLJNMOGLEC-ZDUSSCGKSA-N	428.580	1.812	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)N=c2cc[nH]cc2)(n2cccn2)CC1	803393988	GQDKWRBBRIOGIT-UHFFFAOYSA-N	429.481	1.279	50	20	IDGD	
COC(=O)N(C)NC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(Br)s2)C1	804121414	GUDQWHOHGYKPPF-VIFPVBQESA-N	440.341	1.641	50	20	IDGD	
CCCN(NC(=O)[C@H](NS(=O)(=O)c1ccc(C)cc1)[C@@H](C)O)C(=O)OC(C)(C)C	804592166	AQGHEPUZSUFMLX-GDBMZVCRSA-N	429.539	1.701	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(=O)n(CC(=O)NNc2ccc([N+](=O)[O-])cc2C)c1	805380945	JAKHEKXWXKJNPK-UHFFFAOYSA-N	437.478	1.239	50	20	IDGD	
COC(=O)CC[C@H](NC(=O)OC(C)(C)C)C(=O)NNc1nc2ccccc2c(=O)n1C	806853132	RCMMBMRTSQTPKX-AWEZNQCLSA-N	433.465	1.223	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc3c2CNC3=O)cc1Br	806980064	MQLMRXHJWCVYMO-UHFFFAOYSA-N	447.245	1.101	50	20	IDGD	
Cc1cc(O[C@H]2CCN(C)C2=O)ccc1NC(=O)C(=O)NNc1nccnc1C1CCC1	807462026	GSXLPISHDGIKJV-KRWDZBQOSA-N	438.488	1.744	50	20	IDGD	
CC(=O)N1C[C@H]2[C@@H](NC(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)CCC[C@H]2C1	808357625	LKPCGGFRQBOYNC-XHSDSOJGSA-N	425.530	1.269	50	20	IDGD	
O=C(CNS(=O)(=O)c1c(F)cccc1F)NNC(=O)c1cccc(Br)c1	810448873	XVTCMINCYUDABJ-UHFFFAOYSA-N	448.245	1.467	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1)NNc1cnc2ccccc2n1	811461212	HTYSKQVPPPYJOF-UHFFFAOYSA-N	441.391	1.950	50	20	IDGD	
O=C(COc1ccccc1O)NNS(=O)(=O)CCc1ccccc1Br	812498424	UIASZUHOJNJMDH-UHFFFAOYSA-N	429.292	1.727	50	20	IDGD	
CN1CCN(c2ccccc2NC(=O)NNc2ccccc2S(=O)(=O)N(C)C)CC1	813837848	YHJFGLNDLHOXHV-UHFFFAOYSA-N	432.550	1.837	50	20	IDGD	
Cn1ncc(C=NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1Cl	814710966	VMAWXOLBFSAPEL-UHFFFAOYSA-N	439.925	1.177	50	20	IDGD	
Cc1cc(Br)c2c(c1)C(=NNC(=O)CSc1nnc(O)nc1O)CO2	814784407	MMDMJQFYNQBBSO-UHFFFAOYSA-N	426.252	1.359	50	20	IDGD	
CC(=NNC(=O)Nc1ccc(S(N)(=O)=O)cc1)c1cccc(OCC(=O)N(C)C)c1	814967588	QSXLJMVUOGRBQK-UHFFFAOYSA-N	433.490	1.347	50	20	IDGD	
CCN(CC)Cc1cccc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)N(C)C)c1	815751469	AKPIXTCDKNHMPH-UHFFFAOYSA-N	447.561	1.861	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1ccc(N2CCCC2=O)cc1	815751740	MXNLXQUOFZAJFD-UHFFFAOYSA-N	445.501	1.146	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@]2(c3ccccc3)CCC(=O)NC2)c2ccccc2c1=O	816805695	GASASUSUDSMNKA-HSZRJFAPSA-N	433.468	1.025	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)c1cc(Br)cc2nc(O)[nH]c12	816814418	QCLFURQDWFPJIT-CYBMUJFWSA-N	433.218	1.632	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NN=Cc1c(N2CCOCC2)nc2ccccn2c1=O	864237003	GYHCDYXDKRJZDQ-UHFFFAOYSA-N	431.456	1.251	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NNC(=O)COc2ccc(C#N)cc2)s1	887923937	SGUSKCHXDNTQIV-INIZCTEOSA-N	448.526	1.308	50	20	IDGD	
COc1ccc(N2C[C@H](C(=O)OCC(=O)NNC(=O)c3ccc(C)cc3)CC2=O)cc1	913319738	MVIHOTPNKQKORD-MRXNPFEDSA-N	425.441	1.361	50	20	IDGD	
O=C(NNC(=O)c1cccc(NC(=O)c2cccnc2)c1)c1ccc(-n2cnnn2)cc1	914846846	XADMKQXPULYHPL-UHFFFAOYSA-N	428.412	1.384	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2CCCCN2C(=O)c2ccccc2)c1	915165526	HZZJQOKKJKQNDV-SFHVURJKSA-N	429.498	1.546	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NC[C@H](c2cccs2)N2CCN(C)CC2)cc1OC	915901310	HCDCYZSYXDXASC-MRXNPFEDSA-N	447.561	1.698	50	20	IDGD	
N#CCOc1cccc(C=NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c1	915939489	RKKSFVNBVKNEIH-UHFFFAOYSA-N	428.470	1.374	50	20	IDGD	
Cn1ccnc1[C@H](NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)c1ccccc1	916220432	GUQRTTOYUBKDDZ-QGZVFWFLSA-N	431.456	1.401	50	20	IDGD	
CCS(=O)(=O)N1CCC(NC(=O)NNC(=O)c2cc(C)n(-c3ccccc3)c2C)CC1	916260275	VXHQCBRHGFGUCH-UHFFFAOYSA-N	447.561	1.852	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NC[C@H](c2ccccc2)N2CCOCC2)cc1OC	916508600	AXDSQWHJKZGTSC-GOSISDBHSA-N	428.489	1.721	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)NCCN1CCN(c2ccc(F)cc2)CC1	916513610	GXBDACBNPGLPBW-MRXNPFEDSA-N	447.486	1.885	50	20	IDGD	
COc1ccc(C)cc1CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	916601232	NHALVOIRYKKPBS-UHFFFAOYSA-N	446.529	1.932	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)CN(C)C(=O)[C@@H](C)n1cccn1	917496108	MYVSRQWUMSBEPB-CQSZACIVSA-N	426.502	1.796	50	20	IDGD	
CC(=NNC(=O)Cn1nc(C)cc1C)c1ccc(S(=O)(=O)NCCCN(C)C)cc1	917540804	VGDDFTOKERIGIN-UHFFFAOYSA-N	434.566	1.270	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc([N+](=O)[O-])c(Br)c1)c1ccc([N+](=O)[O-])cc1	918142753	IKFYYMSTZGNPSX-UHFFFAOYSA-N	445.207	1.889	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)c2ccc(F)cc2Br)o1	918341999	NYAKSZKYCARGMD-UHFFFAOYSA-N	434.243	1.506	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)Cn1cccn1	919779197	OPMSSQOBEPJLPH-INIZCTEOSA-N	448.549	1.338	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2ccncc2)cc1S(=O)(=O)Cc1cc(C)no1	919805296	KWCFZSBWLCVQCU-UHFFFAOYSA-N	430.442	1.435	50	20	IDGD	
COc1ccc(Br)cc1S(=O)(=O)NNC(=O)c1cccc(OC)c1O	919958168	FESNCFWLJNEXGU-UHFFFAOYSA-N	431.264	1.795	50	20	IDGD	
O=C(NCc1ccc(-n2ccnc2)cc1)NNC(=O)c1csc(N2CCOCC2)n1	921199365	IPMMRNHEEQETJB-UHFFFAOYSA-N	427.490	1.310	50	20	IDGD	
O=C(NNC(=O)[C@H]1Nc2ccccc2S(=O)(=O)N1)c1cc(F)ccc1Br	1252614383	HTIILRQEEPTLSP-ZDUSSCGKSA-N	443.254	1.079	50	20	IDGD	
CC(C)(C)OC(=O)N1CCO[C@H](CC(=O)NNC(=O)c2cncn2-c2ccccc2)C1	1253079826	FRQCGYPLJBAJTO-MRXNPFEDSA-N	429.477	1.659	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)c1ccc([S@](C)=O)cc1	1253663492	VFKYXVSRNZACRC-JNFKXCBWSA-N	438.531	1.924	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(OCC3CC3)nc2)c1	1318221005	DPXDGNYBOAHUOK-UHFFFAOYSA-N	446.529	1.976	50	20	IDGD	
CCS(=O)(=O)N1CCC(C(=O)NNc2nncc(N)c2Cl)(c2ccccc2)CC1	1319303329	PNOXVYNBGURFHX-UHFFFAOYSA-N	438.941	1.539	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)NCCCN1C(=O)NC(C)(C)C1=O	1340511750	UEXZYUQRNSWQGF-LLVKDONJSA-N	425.873	1.158	50	20	IDGD	
Cc1c(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](O)CCl)C3)nc2ccccn12	1778493890	RRTMKZBIRCUOND-WHSLLNHNSA-N	434.924	1.370	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Cl)C2)c1cccn(C(F)F)c1=O	1779584003	WKXFMZKJFXVIJC-SNUQEOBHSA-N	435.830	1.905	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(CN(C(=O)c3cocn3)CCO2)C1	1780097209	SFLRVXBXXAFQPM-HXUWFJFHSA-N	444.400	1.265	50	20	IDGD	
Cc1cccc(C)c1NC(=O)C(=O)N1CC[C@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1781238674	GQICAKPQIXUXRK-QFIPXVFZSA-N	447.608	1.923	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc([N+](=O)[O-])cc3F)C2)C1	1781554782	HAFBCPNPXMCVQT-APPDUMDISA-N	444.257	1.961	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3c(F)ccc([N+](=O)[O-])c3C)C2)C1	1781987945	YXCODNKFTPLZOK-YJYMSZOUSA-N	443.859	1.740	50	20	IDGD	
Cc1cccc(C)c1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCC(=O)NN(C)C)C1	1782213585	XOKSMERXJOYJBH-NTKDMRAZSA-N	444.576	1.804	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CSc2nc[nH]n2)C1	1782476764	VRYCITHEWCFPFP-FZKQIMNGSA-N	429.974	1.676	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)CCc3cncnc3)CCO2)C1	1783342919	QHMBDTUYZLFMDO-QAPCUYQASA-N	425.327	1.413	50	20	IDGD	
CCOC(=O)C(C)(C)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](Br)CC)C2)C1	1783352257	DTQYKURCCJXPNR-UGSOOPFHSA-N	433.343	1.579	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)COc3ccccc3C#N)CCO2)C1	1783535920	BUWYPPSIUHIIFM-AUUYWEPGSA-N	436.306	1.550	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cc(-n4ccnc4)ccn3)CCO2)C1	1783537551	OMTNUJNWRUWYJK-IFXJQAMLSA-N	448.321	1.494	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)COc3cccc(N(C)C)c3)CCO2)C1	1783873183	LZIZGOVTRGIKHJ-GHTZIAJQSA-N	439.940	1.215	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)C(=O)Nc3c(C)cccc3C)CCO2)C1	1783880576	KGZUMBKCHKQEOC-IERDGZPVSA-N	437.924	1.326	50	20	IDGD	
Cc1ccc([C@H](C)C(=O)N2CCO[C@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc1	1783936050	BJAASIUDRRNBLT-MBSDFSHPSA-N	430.549	1.301	50	20	IDGD	
Cc1cnn([C@H](C)C(=O)N2CC[C@]3(CN(C(=O)[C@@H](C)CBr)CCO3)C2)c1	1784442198	LWPVFNHNMCYATQ-HDMKZQKVSA-N	427.343	1.613	50	20	IDGD	
O=C(COc1ccc(F)cc1)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21	1786488904	NUEKMPMOCZEOQH-JQFCIGGWSA-N	443.313	1.969	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3C[C@@]34C(=O)Nc3ccccc34)C[C@@H]21)[C@H](F)Cl	1787448730	ACWHGFOOFVMHQL-ZTSZXRIDSA-N	435.883	1.411	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CC(=O)Nc3cc(C)on3)[C@H]2C1	1787489493	KFAKJIJORFYSAU-VGWMRTNUSA-N	440.928	1.699	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc4cccn4cn3)[C@H]2C1	1788078992	KHKIOBBFKUZIKD-HPZZRFSDSA-N	435.322	1.711	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3C[C@@H]3F)C[C@@H]21	1789220718	HDZIIIRXUFOOTO-XHFQCFGWSA-N	449.435	1.471	50	20	IDGD	
CC(=O)O[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]2C1)C(C)C	1789925712	HQFFTDKZJIUIAJ-YYFQZIEXSA-N	437.306	1.244	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)c1ccc(OC(F)F)cc1	1790099321	HRVFKDWPOQJXPJ-TUUVXOQKSA-N	432.851	1.481	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)c1cc2ncccc2[nH]1	1790336009	MJDQIWIYIOCEEM-GREKMHCPSA-N	439.285	1.847	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCC(N)=O)C[C@@H]21	1790695801	VPQKOWZYWMXFAU-DKQAGWEXSA-N	446.454	1.117	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3CCC[C@@H](C(=O)OC)C3)[C@H]2C1	1791247590	LPKHKTYUHMIZBN-ZMSHIADSSA-N	444.956	1.199	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(=O)c1ccc(Cl)cc1	1792947510	SXJZYFWZAHXJBP-JLVBRIDZSA-N	438.984	1.964	50	20	IDGD	
C[C@@H](CC(N)=O)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1793659877	OHRYUZZEEGJDNF-RMEBNNNOSA-N	444.960	1.268	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1scnc1C1CC1	1794509855	QPLXYXCJWNABDN-MIJXAVMKSA-N	432.315	1.914	50	20	IDGD	
CO[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCBr)c1ccccc1	1795112772	UCECYUMUSONUNV-MVJTYMMSSA-N	425.323	1.749	50	20	IDGD	
CC(C)N[C@@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)CBr)C2)C(C)C	1795713177	FRKWLEXTWLSTKN-NQNKBUKLSA-N	432.403	1.630	50	20	IDGD	
CC(=O)Nc1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)ccc1C	1796189386	GQHZIXJPPPDKDU-WKCHPHFGSA-N	449.316	1.199	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cn[nH]c1	1797037773	MGAOUCYEGNLLIP-XGUBFFRZSA-N	425.917	1.794	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnc(C)s1	1797232071	ZANGNQHIECHLFA-LSOZKBPJSA-N	428.518	1.837	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1cc(C)[nH]n1	1798535568	DXBFCVQFZRHBEJ-YVLAOCGESA-N	425.493	1.033	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(F)cnc1Cl)C2)[C@@H](F)Br	1799350138	RTCCGERVWRIWKJ-IWXIMVSXSA-N	438.656	1.768	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(-c2cc[nH]n2)cc1	1799698732	XHVKYHFWHNHMAS-ZMMAXQRCSA-N	432.908	1.534	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](O)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@](C)(Cl)CCl	1800081674	AQJDLWKYPSVARN-MNXLVCHVSA-N	438.352	1.704	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccon1)C2)[C@H](Br)Cc1ccccc1	1800435328	DXGOJZVXAZVIHL-KYHPRHEASA-N	448.317	1.884	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc(OC)c(C)c1)C2	1800638958	DQAKEMXJYQDZIB-FZKCQIBNSA-N	440.338	1.775	50	20	IDGD	
COc1cccc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)Br)n1	1800757925	WPHRLALABXKPAN-FLTUCWPJSA-N	440.338	1.396	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1nc2cc([N+](=O)[O-])ccc2[nH]1	1800867506	VPRVJDYYXIKFGV-OPDFLTKYSA-N	435.868	1.977	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnc2c(c1)CCNCC2	1801310948	CQVRTUGPNOQURA-VDNDLQMASA-N	435.366	1.805	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)C1Cc2ccccc2C1	1802198012	DZAHFJPMUWWDRI-YYIAUSFCSA-N	425.298	1.682	50	20	IDGD	
COc1ccc(CCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CCC(=O)NN(C)C)cc1	1802332795	DXUQMXLHAJNANK-REPLKXPHSA-N	430.549	1.639	50	20	IDGD	
C=CCNC(=O)/C=C\C(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)Br)[C@H]1c1cccnc1	1802491248	XKRAUDMQUUHFQT-ONVCPAIOSA-N	449.349	1.729	50	20	IDGD	
CC(C)(CCl)C(=O)NC[C@H]1CCN(C(=O)C[C@@](C)(O)CC(=O)O)[C@H]1c1cccnc1	1802901252	APUDBLXXDAQNCR-FYINFDKHSA-N	439.940	1.968	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)CN2CCCC2=O)[C@@H]1c1cccnc1	1806926350	QOJCQXGGOIIWMN-YEWWUXTCSA-N	437.338	1.493	50	20	IDGD	
C=CCC(CC=C)C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1807365419	OWFFIWAKVGTNSN-GMAHTHKFSA-N	447.344	1.849	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)/C=C/C2CC2)[C@@H]1c1cccnc1	1810296038	ZQGITIJHSIXBHF-DFUKUNQBSA-N	434.500	1.366	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC2(CCCN(C(=O)c3ccc4c[nH]nc4c3)C2)CC1	1810605352	XQTPJOQWZYGLPJ-UHFFFAOYSA-N	446.316	1.401	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC2(CCCN(C(=O)c3cnc4ccoc4c3)C2)CC1	1810681969	FUTDIEADAXIEGJ-UHFFFAOYSA-N	447.300	1.666	50	20	IDGD	
Cc1cc(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)ccn1	1810788233	VKIBWBVFHLFSFQ-RBBKRZOGSA-N	444.300	1.098	50	20	IDGD	
O=C(O)c1cnncc1C(=O)NC[C@@H]1CCN(C(=O)C(Cl)Cl)[C@@H]1c1cccnc1	1810804781	UZMKOMRUECFQDE-SMDDNHRTSA-N	438.271	1.693	50	20	IDGD	
O=C(O)c1cnncc1C(=O)N1CC[C@@H](CNC(=O)C(Cl)Cl)[C@@H]1c1cccnc1	1813078249	GTMJOPGRDMJHDD-FZMZJTMJSA-N	438.271	1.693	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)cc1	1813888038	JWMIRLQSXFWYBE-DFQSSKMNSA-N	444.919	1.959	50	20	IDGD	
O=C(C#Cc1ccccc1)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2	1814012629	WCIDXEAMIFGAIM-GOSISDBHSA-N	445.309	1.100	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1CCc2nc(NC(=O)CS(C)(=O)=O)sc2C1	1814314724	JAJPZITZCKJGCK-RKDXNWHRSA-N	438.369	1.131	50	20	IDGD	
C=CCNC(=O)/C=C\C(=O)N[C@H]1CCc2nc(NC(=O)CO[Si](C)(C)C)sc2C1	1820158290	JGTZXPDSNRJTOL-YXVBKTCISA-N	436.610	1.765	50	20	IDGD	
C[C@H](Cn1cncn1)C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1	1823008814	WRQRGEHICYTIOO-VDDIYKPWSA-N	445.318	1.673	50	20	IDGD	
Cc1c(C(=O)N2CCC([C@H]3CCCCN3C(=O)[C@@H](O)CCl)CC2)cn2[nH]cnc(=O)c12	1824186615	UGUKORUIZSCDAS-SJORKVTESA-N	449.939	1.164	50	20	IDGD	
O=C([C@@H](O)CCl)N1CCC([C@@H]2CCCCN2C(=O)Cn2cc([N+](=O)[O-])cn2)CC1	1825125821	XVQNGZVWEVYMDX-HOTGVXAUSA-N	427.889	1.011	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H]1CCC(=O)NC1)CC2	1825631171	CSGYLWMZKUNOHF-AEJSXWLSSA-N	429.340	1.365	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)Cc1cc(C)n(C)n1)CC2	1825995170	UIGZFZPJLONJLN-WCQYABFASA-N	425.942	1.594	50	20	IDGD	
O=C(c1cnccc1F)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827052859	KTCCXKGKNHSLHO-OAQYLSRUSA-N	439.296	1.448	50	20	IDGD	
O=C(CCOc1ccc(F)cc1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1830254177	DZKCRVLGODABHF-PKOBYXMFSA-N	432.851	1.585	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3n[nH]c4ccccc34)C2)C1	1830362380	UCLBRKWSEHDGNI-NRFANRHFSA-N	434.924	1.898	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3C[C@@]3(F)Cl)C2)C1	1830543816	DSUARFABGFSCRP-BHTHQVBYSA-N	441.725	1.398	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H]3CC=CCC3)CCO2)C1	1830554559	IUILNONXIJMKET-FCEWJHQRSA-N	429.355	1.830	50	20	IDGD	
Cc1c(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)oc2ccccc12	1830728298	RKMIUYYZVFPXIP-IIBYNOLFSA-N	436.892	1.411	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)Cc3ccc(C#N)cc3)CC2)CC1	1833107953	BNBCJBCAYVBFQI-OAQYLSRUSA-N	446.979	1.926	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H]3Cc4ccccc4CN3)CC2)CC1)[C@@H](F)Cl	1835079762	QCOZWCFJYVHDPG-WOJBJXKFSA-N	436.959	1.807	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)C#Cc3ccccc3)CCO2)C1	1835103231	YULPODUHXNZRGE-WIYYLYMNSA-N	449.345	1.668	50	20	IDGD	
O=C(CCCn1ccnc1)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836720297	OESJIZRXCPEPTF-GOSISDBHSA-N	426.945	1.262	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc4cn[nH]c4cn3)CCO2)C1	1837193562	SOOWMFCVGSCNRL-FOIQADDNSA-N	435.912	1.435	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)C#CC3(O)CCCCC3)CCO2)C1	1837486346	BYOSRVMIDNEKNJ-AVRDEDQJSA-N	440.968	1.549	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC(OC2CCN(C(=O)[C@H]3CCNC(=O)C3)CC2)CC1	1838432113	VDDYUKHTJSAQST-INIZCTEOSA-N	439.629	1.363	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)c3cc[n+]([O-])cc3)CC2)CC1	1838510897	MGWLVTHWVSYGAT-CQSZACIVSA-N	440.338	1.716	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccccc3Cl)CCO2)C1	1838866948	UYYSTTUMCQXJHA-LPHOPBHVSA-N	431.316	1.664	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)c(OC)c1	1838879865	MAPLUTZZJQLPDC-QFBILLFUSA-N	430.860	1.308	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCBr)C3)C2)cc1F	1838914093	PTDQFZMNYPKMQJ-LJQANCHMSA-N	443.313	1.989	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(OC)cc3OC)C2)C1	1839146647	RJWQGGSXYBLMAD-LAUBAEHRSA-N	440.924	1.791	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3c(O)cc(O)cc3O)CCO2)C1	1839371760	NZKYOIHCMARBRQ-VLIAUNLRSA-N	442.896	1.281	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(C)nc3)C2)C1	1839963596	PQALPYDHFZGBIU-LPHOPBHVSA-N	440.338	1.634	50	20	IDGD	
CCN(CC)C[C@H](C)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](C)Br)CCO2)C1	1840034975	CAIXFLHHQRHTSC-BXWFABGCSA-N	448.402	1.204	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(OC)c(F)c3)C2)C1	1840149164	GOMLGHQPBHBWOV-MGPUTAFESA-N	444.887	1.158	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc(C)c(C)c3)C2)C1	1840149833	BEFPCCMMXNHGDH-XLIONFOSSA-N	425.913	1.022	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)n1cccc1)CCO2	1840348334	KHOFLNCIZGHQEG-GJYPPUQNSA-N	442.354	1.537	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(OC)c3F)CCO2)C1	1840794292	WHEQZTKRNXLHLD-FOIQADDNSA-N	428.888	1.922	50	20	IDGD	
CC[C@H](C)[C@H](O)C(=O)N1CCCC12CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2	1841635279	MPJRQAVOHWTERB-UGSOOPFHSA-N	433.461	1.744	50	20	IDGD	
CCOC(=O)c1ncn2c1CC[C@@H](C(=O)N1CC3(CCCN3C(=O)[C@H](F)Cl)C1)C2	1843365924	SAQHIQILBNKLEC-DOMZBBRYSA-N	426.876	1.360	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2ccc3c(c2)OCO3)C1	1843625645	RAUMRANHQIANSU-ZVHZXABRSA-N	437.456	1.366	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)COc2ccccc2F)C1	1846074317	HBYYOEBXWPIAPF-MFKUBSTISA-N	441.463	1.542	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@@H](O)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@](C)(Cl)CCl	1847512620	QYXIQWBOZPRISB-JWXAPSBJSA-N	438.352	1.310	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)OCC(=O)NNC(=O)c2ccccc2)c1	3387458	HAECICZNUYPKAV-UHFFFAOYSA-N	433.486	1.335	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)cc(OC)c1OCc1ccccc1	10213621	GYGNJEOFRZCUPJ-OAHLLOKOSA-N	448.497	1.479	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)Cn2c(=O)[nH]c(=O)c3ccccc32)cc1OC	10288271	IALOHZWKLDOOLE-UHFFFAOYSA-N	440.456	1.339	50	20	IDGD	
O=C(COC(=O)/C=C/c1ccc([N+](=O)[O-])cc1)NNC(=O)[C@H]1COc2ccccc2O1	10757181	INWJYDBGYGCWFH-PYUISTEWSA-N	427.369	1.139	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)c2ccc3c(c2)C[C@@H](C)N3S(C)(=O)=O)cc1OC	14936154	BMZFCKQDYWGZPX-CYBMUJFWSA-N	447.513	1.879	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NNC(=O)c2cccc(N(C)C)c2)cc1	17250807	FZEBTABXWPDPIZ-IBGZPJMESA-N	430.530	1.675	50	20	IDGD	
CCCCNC(=S)NNC(=O)c1cc(S(=O)(=O)NCc2ccccc2)ccc1O	18138968	VWPUNYLSPUGAFV-UHFFFAOYSA-N	436.559	1.780	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)CNC(=O)c2ccccc2I)n1	22235127	VPUPEJTYMSENJZ-UHFFFAOYSA-N	425.230	1.571	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)N1CCC(Cc2ccccc2)CC1	97569840	BEPVMKJDAWLMEP-KRWDZBQOSA-N	433.516	1.767	50	20	IDGD	
COCCCNC(=S)N(C)NC(=O)CCCN(C)S(=O)(=O)c1ccc(F)cc1	726076231	TWYYJOPEFSQGMK-UHFFFAOYSA-N	434.559	1.100	50	20	IDGD	
COc1ccc(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)c(OC)c1	728213546	NRPYFTBOFUMKIT-UHFFFAOYSA-N	434.518	1.397	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)CNc3ccc(C#N)cc3)cc2)CC1	728216352	XLPSLXRFJOBBHW-UHFFFAOYSA-N	428.518	1.050	50	20	IDGD	
CC(=O)NCCc1ccc(S(=O)(=O)NNC(=O)c2cccc(OC(F)F)c2)cc1	728510558	NVBVJHJFQVSDNX-UHFFFAOYSA-N	427.429	1.590	50	20	IDGD	
CC(C)(C)C(=O)N1CSC[C@@H]1C(=O)OCC(=O)NNC(=O)c1ccc(Cl)cc1	730322324	AGOBBQVMKPMJFS-CYBMUJFWSA-N	427.910	1.592	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1	732049940	FPWOUMJCSBYAAY-LBPRGKRZSA-N	448.457	1.496	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)C[C@@H](C)C(=O)c2ccccc2)cc1	732749852	ICBQBDMCAYHQSZ-MRXNPFEDSA-N	431.514	1.672	50	20	IDGD	
O=C(NC[C@H](c1cccs1)N1CCOCC1)NNC(=O)c1cnn(-c2ccccc2)c1	733350355	VNANRDSQOIGRFE-GOSISDBHSA-N	440.529	1.951	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2cc3c(F)cccc3[nH]2)CC1	735116802	GKBXIPPRDHQCCN-UHFFFAOYSA-N	432.481	1.395	50	20	IDGD	
CC(C)c1cccc(OCC(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)c1	735117571	XXJHTYBGOAWKHC-UHFFFAOYSA-N	447.561	1.663	50	20	IDGD	
O=C(NNS(=O)(=O)C[C@@H]1CCCO1)c1nn(Cc2ccccc2)c(=O)c2ccccc12	735646851	VROBFHLZQRBHIN-INIZCTEOSA-N	442.497	1.188	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2cccc(C(=O)NNc3ccc(Cl)nn3)c2)C[C@H](C)O1	735688794	VPSADJZAFMLOAH-RYUDHWBXSA-N	425.898	1.685	50	20	IDGD	
CCc1ccccc1O[C@H](C)C(=O)N1CCN([C@@H](C)C(=O)NNC(=O)CC(C)C)CC1	736622806	CMOWULRMBVYUTG-ZWKOTPCHSA-N	432.565	1.743	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)N1CCCN(C(=O)c2ccccc2F)CC1	738495043	CFGMWSCHUAAOIE-UHFFFAOYSA-N	428.464	1.931	50	20	IDGD	
O=C(Cc1cccc([N+](=O)[O-])c1)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	742032391	GBAJNICUHKJEPG-UHFFFAOYSA-N	446.485	1.773	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@H](c2ccccc2F)N2CCOCC2)cc(OC)c1OC	742241493	JRRDZPWMAKNOTA-IBGZPJMESA-N	447.463	1.686	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NNC(=O)CCC2CCCCC2)cc1	743583479	RJZMHXXVYRHMLG-UHFFFAOYSA-N	425.511	1.818	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NCCOc2ccc(F)c(F)c2)cc1	743596468	RWJRNPJJUNNLFE-UHFFFAOYSA-N	428.417	1.783	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)Cc2cc(Cl)c3c(c2)OCCO3)cc1	743830007	JUGKMTOJMLKLBO-UHFFFAOYSA-N	439.877	1.910	50	20	IDGD	
NC(=O)[C@H]1CCCN(CCCNC(=O)NNC(=O)CCSc2ccc(F)cc2)C1	745830246	MYCKPFHBKDBQDS-AWEZNQCLSA-N	425.530	1.226	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NC[C@@H](C)Oc2ccccc2F)c2ccccc2c1=O	745891559	CXPKCLBXZRCEON-CYBMUJFWSA-N	427.436	1.967	50	20	IDGD	
CC[C@](C)(CNC(=O)OC(C)(C)C)C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	747791213	SVZINTYEJWNBFI-LJQANCHMSA-N	427.523	1.792	50	20	IDGD	
C[C@@H](C(=O)NNc1nc(-c2ccccn2)nc2c1CCC2)N1C(=O)NC2(CCCC2)C1=O	748337227	BSJHEYMXBDYPTE-ZDUSSCGKSA-N	435.488	1.724	50	20	IDGD	
CC(=O)NCc1ccc(S(=O)(=O)NCC(=O)NNc2cccc3c2CCCC3)s1	748573589	DMIGDBKUVHCXJT-UHFFFAOYSA-N	436.559	1.685	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN1S(=O)(=O)c1cccs1)c1cc2c(s1)CCC2	749161235	VXGHHDYLFPDWGF-GFCCVEGCSA-N	425.557	1.913	50	20	IDGD	
O=C(NCc1ccc(NC(=O)c2ccc(F)cc2)cc1)NNC(=O)C(=O)N1CCCC1	749185389	ZMDKHUJAUNGKRL-UHFFFAOYSA-N	427.436	1.531	50	20	IDGD	
CCCCN1CCC(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)CC1	749213069	XKAYZDISRSCDOT-UHFFFAOYSA-N	425.555	1.145	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(Br)s1)NNC(=O)NC1CCCCC1	749839128	ZJXLXQXFDAESIG-UHFFFAOYSA-N	439.357	1.452	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)NCC1CCN(CC(=O)NC(C)(C)C)CC1	751112602	YQBGFILOHIJTPF-UHFFFAOYSA-N	449.552	1.031	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)[C@]12CCC(=O)N1c1cc(Cl)ccc1S2	751203185	KNCCFKZSRBWBFU-GOSISDBHSA-N	434.861	1.439	50	20	IDGD	
COc1ccc(C(=O)CNC(=O)CCC(=O)NN=c2sc3ccccc3n2C)cc1	751314552	DTXXAGYXMLPVDX-UHFFFAOYSA-N	426.498	1.960	50	20	IDGD	
N#Cc1ccc(S(=O)(=O)NNC(=O)CNC(=O)c2cccs2)cc1C(F)(F)F	751516510	CRBUYICOHLNLSA-UHFFFAOYSA-N	432.405	1.378	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NC[C@@H]1CCCO[C@@H]1C(C)C	752001282	ZDFICYCUDOQANW-LSDHHAIUSA-N	425.555	1.683	50	20	IDGD	
Cc1ccc(C(=O)NNS(=O)(=O)c2cc(S(C)(=O)=O)ccc2Br)o1	753086947	YDMITTJCCIIARM-UHFFFAOYSA-N	437.293	1.377	50	20	IDGD	
CCOC(=O)c1ccc(N2CC(NC(=O)NNC(=O)c3cccc4ncccc34)C2)nc1	753278150	BEOJOJJZSSHODR-UHFFFAOYSA-N	434.456	1.639	50	20	IDGD	
C[C@]1(c2ccc3ccccc3c2)NC(=O)N(CC(=O)NNc2cc(Cl)nc(N)n2)C1=O	753449283	CTXMIIXOSNEFQD-HXUWFJFHSA-N	439.863	1.776	50	20	IDGD	
O=C(CCCc1cccs1)NNC(=O)NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1	754199846	GIBNQDOEZKFYNX-UHFFFAOYSA-N	440.503	1.783	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)C2(O)CCCCC2)c1	754974175	NATBHQFMFYNZCM-UHFFFAOYSA-N	447.513	1.952	50	20	IDGD	
C[C@H]1C[C@H](C)CN(S(=O)(=O)c2ccc(NC(=O)NNC(=O)c3cnccn3)cc2)C1	755419411	CZYSFKPFGQJPGY-KBPBESRZSA-N	432.506	1.610	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1cc(Br)cc(C(F)(F)F)c1	756788290	CHGCKXDFWUWOAR-ZCFIWIBFSA-N	447.233	1.558	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2cccnc2Br)c1	757732449	HMUPEEBBMVIETJ-UHFFFAOYSA-N	442.295	1.561	50	20	IDGD	
Cc1nn(C)c(N2CCOCC2)c1C=NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758139096	PNAKBSPQYPIEGI-UHFFFAOYSA-N	449.556	1.504	50	20	IDGD	
CCOCCS(=O)(=O)NCC(=O)NNC(=O)c1cc2c(s1)CC[C@@H](C(C)(C)C)C2	758156741	CLKJOPLUCRGYDA-CQSZACIVSA-N	445.607	1.616	50	20	IDGD	
Cc1ccc(Br)cc1NC(=O)CNC(=O)NNC(=O)C(=O)Nc1ccccn1	758740093	XUZIRFMOVFCPRM-UHFFFAOYSA-N	449.265	1.060	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)C(=O)Nc2ccccn2)ccc1OCc1cccnc1	758839131	BHONITAWTAQASR-UHFFFAOYSA-N	435.440	1.854	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNS(=O)(=O)c2ccc(F)cc2C(=O)OC)cc1	759093978	GFVSREVDAIDKGQ-LBPRGKRZSA-N	440.449	1.788	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)CCCNS(=O)(=O)c2ccc3c(c2)CCCC3)nc1	759729440	KWFKLYYLPRQUEO-UHFFFAOYSA-N	446.529	1.949	50	20	IDGD	
C[C@H](CC(=O)NNC(=O)NCCc1cccs1)NS(=O)(=O)c1cccnc1Cl	760449282	DZPAOVWKEAOQGQ-LLVKDONJSA-N	445.954	1.427	50	20	IDGD	
COC(=O)c1ccc(OC(C)C)c(NC(=O)C(=O)NNC(=O)COc2ccccc2F)c1	763679839	PJFSGZOTBGPLLN-UHFFFAOYSA-N	447.419	1.564	50	20	IDGD	
CCCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(Cl)c2)cc1	763747870	PWCAJCJYUNYGFM-UHFFFAOYSA-N	438.893	1.891	50	20	IDGD	
CCOC(=O)c1c(C)csc1NC(=O)C(=O)NNC(=O)c1cc(OC)cc(OC)c1	763774835	HFBYDPZUCBRANA-UHFFFAOYSA-N	435.458	1.650	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)ccc1Cl	763814399	SUCSZRWTBDOWIT-UHFFFAOYSA-N	430.804	1.163	50	20	IDGD	
CC(=O)N(Cc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C)cc2)cc1)C1CC1	763820946	NSNYNDMWUJNGFU-UHFFFAOYSA-N	438.484	1.671	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cccc(S(C)(=O)=O)c2)cc1	763859300	AHSDBYPPIGHNSK-ZDUSSCGKSA-N	449.485	1.042	50	20	IDGD	
CC(=O)Nc1cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)c(F)cc1F	763866420	PDOQSARKILKEHI-VIFPVBQESA-N	438.362	1.616	50	20	IDGD	
CC(C)CC(=O)NNC(=O)C(=O)Nc1ccc(-c2csc(N3CCOCC3)n2)cc1	763888344	JTZJDNIROAWQFU-UHFFFAOYSA-N	431.518	1.779	50	20	IDGD	
COC(=O)c1ccc(N2CCCC2)c(NC(=O)C(=O)NNC(=O)Cc2ccc(F)cc2)c1	763918414	GLQRTMQIYXKJAO-UHFFFAOYSA-N	442.447	1.541	50	20	IDGD	
Cc1nc(C)n(-c2ccccc2NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)n1	763995075	LRPXAMWFLSPHAT-UHFFFAOYSA-N	446.265	1.374	50	20	IDGD	
O=C1CCc2ccc(NC(=O)C(=O)NNC(=O)c3ccc(F)cc3Br)cc2N1	764086400	SMPJHNBIXWZRSJ-UHFFFAOYSA-N	449.236	1.873	50	20	IDGD	
CC[C@H](C)C(=O)NNC(=O)C(=O)Nc1cc(S(=O)(=O)N2CCCCC2)ccc1OC	764086737	VUWXJYYCJNEYSB-ZDUSSCGKSA-N	440.522	1.002	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)nc1)C(=O)Nc1cccc(-c2n[nH]c(C3CC3)n2)c1	764092268	IHVVROFSDAPRSD-UHFFFAOYSA-N	425.836	1.797	50	20	IDGD	
CN(C)C1CCN(c2ccc(NC(=O)C(=O)NNC(=O)c3ccc(Cl)nc3)cc2)CC1	764093327	SZHUYXNNLBDQDY-UHFFFAOYSA-N	444.923	1.665	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(CC(=O)N(C)c3ccccc3)cc2)n[nH]1	764110093	XYXGBQVJTNPPPJ-UHFFFAOYSA-N	434.456	1.323	50	20	IDGD	
CC[C@@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)cc1	764242619	JPGSHKRASPQTEP-OAHLLOKOSA-N	435.484	1.956	50	20	IDGD	
CCOCC(=O)NNC(=O)C(=O)Nc1ccnn1[C@@H](C)c1cc(Cl)ccc1Cl	764317270	HWUQCKLABXYNTE-JTQLQIEISA-N	428.276	1.922	50	20	IDGD	
CN(C)CCCOc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)cc1	764349154	FYSZNAUCFJNKBI-UHFFFAOYSA-N	434.880	1.776	50	20	IDGD	
COC(=O)c1cc(C(C)C)ccc1NC(=O)C(=O)NNC(=O)COCc1ccccc1	764367406	WIKGTYNTTHCOJT-UHFFFAOYSA-N	427.457	1.899	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2ccc(OC(C)C)nc2)n[nH]1	764376738	GVFUIKUJXGFMST-UHFFFAOYSA-N	438.444	1.667	50	20	IDGD	
C#CCOc1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3OC)[nH]n2)cc1	764377322	NFNFBTSFTAPZNC-UHFFFAOYSA-N	433.424	1.497	50	20	IDGD	
O=C(NNC(=O)C(F)(F)Oc1ccccc1)C(=O)Nc1cccc(C(=O)NC2CC2)c1	764378784	OANWVJGJKOYUDZ-UHFFFAOYSA-N	432.383	1.337	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)n(Cc2ccccc2)n1	764379257	AJUBUIBHVLAKNP-UHFFFAOYSA-N	443.410	1.998	50	20	IDGD	
CCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(CC)cc3)[nH]n2)cc1	764385179	VFAKXCNEFBWTNK-UHFFFAOYSA-N	448.483	1.789	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(N2CCOCC2)c(NC(=O)NNC(=O)C2CC2)c1	764597374	RBGDBGHWNFHHGQ-UHFFFAOYSA-N	439.538	1.116	50	20	IDGD	
C[C@@H](SCc1ccccc1)C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765738854	PFBNKQVOECSVDF-GOSISDBHSA-N	440.569	1.914	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)C[C@@H]3OCCc4ccccc43)CC2)cc1	765749623	ZIANSIAFTAYWTK-QHCPKHFHSA-N	436.556	1.964	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)N[C@@H]1CC(=O)N(c2ccc(Cl)c(F)c2)C1	766555327	YDJMEWXLSHCCIR-PIGZYNQJSA-N	448.838	1.755	50	20	IDGD	
CC(C)(C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1)c1ccc(F)cc1	766636453	OPWGSBZPIYCPOQ-UHFFFAOYSA-N	426.492	1.709	50	20	IDGD	
CC(C)[C@@H](C(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1)N1CCCC1=O	766659483	BPCRDWGQLCZHLQ-NRFANRHFSA-N	449.983	1.252	50	20	IDGD	
O=C(CCOCC(F)(F)F)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	766659628	DOCIFKBIKWHQHC-UHFFFAOYSA-N	436.862	1.574	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)c1ccc(N2CCC(O)CC2)cc1	767342135	LFQFVXVFUQTOKR-UHFFFAOYSA-N	425.485	1.503	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cc(C)ccc2S(N)(=O)=O)cc1Br	767459599	IVDVCIVGMSRMOH-UHFFFAOYSA-N	442.291	1.488	50	20	IDGD	
O=C(CSc1ccccc1O)NNS(=O)(=O)CCCN1C(=O)c2ccccc2C1=O	767829570	CGPSMWQXYJOJPV-UHFFFAOYSA-N	449.510	1.121	50	20	IDGD	
CSCC[C@H](NC(=O)c1ccccc1Br)C(=O)NNC(=O)C(C)(C)O	768260928	INPCNBKILWSNCX-LBPRGKRZSA-N	432.340	1.219	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2cccc(C(=O)NNC(=S)Nc3ccccn3)c2)C[C@@H](C)O1	768585447	MOSRABIAFISVPT-OKILXGFUSA-N	449.558	1.511	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)c1ccc(S(=O)(=O)NC2CC2)cc1	768629765	LWKMLZLCNSFNRQ-UHFFFAOYSA-N	439.515	1.296	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)Cn1nc(-c2ccccc2)ccc1=O	768630743	WGZGMGRLKGAWLO-UHFFFAOYSA-N	428.470	1.466	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@H]2CCO[C@@]3(CCSC3)C2)c2ccccc2c1=O	769235872	RLMAUMPGADJGND-RBZFPXEDSA-N	431.518	1.415	50	20	IDGD	
O=C(Cc1cccc(OCC(F)(F)F)c1)NNC(=O)c1csc(N2CCOCC2)n1	770141487	LYBFLJNEYPVAMR-UHFFFAOYSA-N	444.435	1.925	50	20	IDGD	
COc1cc2c(c(OC)c1OC)CCN(CC(=O)NNC(=O)c1cccc(C)c1)CC2	770254207	WNXXMFIDEJHTJS-UHFFFAOYSA-N	427.501	1.883	50	20	IDGD	
COC(=O)N1CC(NC(=O)NNC(=O)[C@@H]2Cc3ccccc3CN2Cc2ccccc2)C1	770427176	HBSOGTFZRRFAOP-FQEVSTJZSA-N	437.500	1.395	50	20	IDGD	
C[C@H](NS(=O)(=O)c1ccc(C(N)=O)cc1)C(=O)NNc1ncccc1C(F)(F)F	771022308	LNFCIXNQNAUMQY-VIFPVBQESA-N	431.396	1.009	50	20	IDGD	
Cc1cc(S(=O)(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)sc1C(=O)O	771609264	ZAFOSJALFPCWEQ-UHFFFAOYSA-N	431.879	1.034	50	20	IDGD	
C[C@H]1C[C@@H](NC(=O)NNC(=O)CNC(=O)c2cccs2)CCN1C(=O)OC(C)(C)C	772357728	OWTPRCFPVAPWOD-STQMWFEESA-N	439.538	1.596	50	20	IDGD	
O=C(NNc1ccc(C(F)(F)F)cn1)c1ccc2c(c1)S(=O)(=O)N=C1N=CNN12	775265811	TUBOXXYVLFFLAL-UHFFFAOYSA-N	425.352	1.269	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2ccccc2)cc1S(=O)(=O)N1CCOCC1	775280823	PLRUTKIACMEJHD-UHFFFAOYSA-N	434.474	1.183	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2[nH]cnc2C(=O)c2ccccc2)c2ccccc2c1=O	776596173	HCLOYIZQHKXQKO-UHFFFAOYSA-N	444.451	1.835	50	20	IDGD	
O=C(N1CCN(S(=O)(=O)CBr)CC1)C1(c2cccc(F)c2)CCOCC1	777832585	NUQQBIOMYIJFDH-UHFFFAOYSA-N	449.342	1.700	50	20	IDGD	
CSc1nc(C(=O)N2CCN(S(=O)(=O)CBr)CC2)c2ccccn12	777837617	PDOIWSLULDZZHI-UHFFFAOYSA-N	433.353	1.496	50	20	IDGD	
CSCC[C@H](NCC(=O)NNC(=O)Cc1nc(C)cs1)c1nnc2ccccn12	778107616	KWURRUDMSKWSDT-ZDUSSCGKSA-N	433.563	1.268	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1	778420128	QWRKEBRLAMAIKB-UHFFFAOYSA-N	426.763	1.804	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)C1=Cc2cc(Br)ccc2OC1	778445281	HAZLIHFZWFIVAB-UHFFFAOYSA-N	426.267	1.897	50	20	IDGD	
O=C(CN1C(=O)NC2(CCCC2)C1=O)NNc1ccc([N+](=O)[O-])cc1Br	779145164	RODUJSXEMYRCHH-UHFFFAOYSA-N	426.227	1.665	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@H](C(=O)NNc2ccc(Cl)cc2[N+](=O)[O-])[C@@H](C)O)cc1	779501924	TXCWXMBONCGXMK-BZNIZROVSA-N	442.881	1.728	50	20	IDGD	
Cn1nc(Br)cc1C=NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	782251778	FVOITPUZJWSVDP-UHFFFAOYSA-N	433.310	1.091	50	20	IDGD	
Cc1cc(Br)c(NC(=O)C(=O)NNC(=O)c2ccc(O)cc2)cc1[N+](=O)[O-]	782834416	VIXUUZUIEDLKJR-UHFFFAOYSA-N	437.206	1.771	50	20	IDGD	
Cc1cc(C)c(NNC(=O)C(=O)Nc2ccccc2OCC(=O)N2CCOCC2)c(C)c1	783366487	BINZPEYBWZTKDA-UHFFFAOYSA-N	440.500	1.931	50	20	IDGD	
O=C(NNc1ccc(OC(F)F)cc1)C(=O)Nc1ccc(N2CCCS2(=O)=O)cc1	784308405	PKLKZXBVQKXSON-UHFFFAOYSA-N	440.428	1.910	50	20	IDGD	
COc1cc2c(cc1NC(=O)C(=O)NNc1ccc(Br)cn1)NC(=O)CC2	784341411	KTTLXQCXRQOEDZ-UHFFFAOYSA-N	434.250	1.819	50	20	IDGD	
CCNC(=O)N(C)NC(=O)C(=O)Nc1ccc(Cl)c(S(=O)(=O)N(CC)CC)c1	784915258	IABUUXCUWMDDAK-UHFFFAOYSA-N	433.918	1.002	50	20	IDGD	
CCCN1CCN(c2ccc(NC(=O)C(=O)NNc3ncc(F)cn3)cc2Cl)CC1	784949942	RBILXWWTPJRMTC-UHFFFAOYSA-N	435.891	1.883	50	20	IDGD	
CCN(CC)C(=O)c1ccc(NC(=O)C(=O)NNc2ccnc(N(C)C)n2)cc1Cl	784970190	TXDDENCNUVQOKG-UHFFFAOYSA-N	433.900	1.760	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)Nc1ccc(F)cc1OCC1CC1	785024412	YWLSHQJENMNQJH-UHFFFAOYSA-N	432.364	1.628	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)C(F)(F)c3ncccc3C)CC2)cc1	787438494	CVOCMZQFLFYHML-UHFFFAOYSA-N	431.487	1.755	50	20	IDGD	
COC[C@H](C)Oc1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)c1scnc1C	787889038	HQCLZFZBXDWNGD-VIFPVBQESA-N	426.882	1.918	50	20	IDGD	
CN1CCN(C(=O)NNC(=O)[C@H]2CC(=O)N(Cc3cccc(C(F)(F)F)c3)C2)CC1	788166550	PRDMFXFZCOFVNT-AWEZNQCLSA-N	427.427	1.042	50	20	IDGD	
CN1CCN(C(=O)NNC(=O)c2ccc(Cl)c(S(=O)(=O)N3CCCCC3)c2)CC1	788168861	GPRFKGZEDFCTLN-UHFFFAOYSA-N	443.957	1.116	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NC[C@@H]2CCCN(c3ccccc3)C2)c2ccccc2c1=O	789313480	CQZAWBBVRWNFNR-INIZCTEOSA-N	434.500	1.794	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1cnnn1-c1cccc(F)c1	789971564	VHVXMYHKAJBVAF-UHFFFAOYSA-N	446.464	1.184	50	20	IDGD	
CNC(=O)Cn1ccc2ccc(NC(=O)C(=O)NNc3cccc(F)c3[N+](=O)[O-])cc21	790999607	VDRZFVKZAKZDPW-UHFFFAOYSA-N	428.380	1.516	50	20	IDGD	
NC(=O)c1ccc(/C=C/C(=O)N2CCC[C@H]2C(=O)NNc2cccc(F)c2[N+](=O)[O-])cc1	791067400	SJGAIRIRVQZUFS-YRYLYKBFSA-N	441.419	1.980	50	20	IDGD	
CC(C)(C)OC(=O)Nc1ncccc1CC(=O)OCC(=O)NNC(=O)c1ccccc1	791756493	ICBZJHJAGDCTJH-UHFFFAOYSA-N	428.445	1.976	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)[C@@](C)(O)Cn2cc(C(F)(F)F)ccc2=O)c1	792014855	ODXSOOZRXLBVSP-SFHVURJKSA-N	427.379	1.153	50	20	IDGD	
COc1cc(C(F)(F)F)ncc1NC(=O)C(=O)NNC(=O)Cc1cn2ccccc2n1	792285186	FAMSMXITYQNNCB-UHFFFAOYSA-N	436.350	1.085	50	20	IDGD	
O=C(NNc1nc2ccccn2n1)C(=O)Nc1ccc2c(c1)N(CC(F)F)CCS2	793056249	TUZBFCLEGGPCSS-UHFFFAOYSA-N	433.444	1.988	50	20	IDGD	
Cc1ccc(CN2C[C@@H](C(=O)NNc3ccccc3S(=O)(=O)N(C)C)CC2=O)cc1	795169055	IGPTUBMSFAGWQK-KRWDZBQOSA-N	430.530	1.737	50	20	IDGD	
Cc1ccccc1NC(=O)NNC(=O)CSCCOc1ccc(S(N)(=O)=O)cc1	798311086	FBDYTDURAFNBDY-UHFFFAOYSA-N	438.531	1.607	50	20	IDGD	
Cc1cc(O[C@@H]2CCN(C)C2=O)ccc1NC(=O)NNC(=O)COc1ccc(C#N)cc1	799238700	FFVLXNQLWOLALN-LJQANCHMSA-N	437.456	1.708	50	20	IDGD	
O=C(NCCNS(=O)(=O)c1ccc(F)cc1F)NNC(=O)c1ccc2ccccc2n1	799673741	NCZNJMLFTIJACC-UHFFFAOYSA-N	449.439	1.436	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN1S(=O)(=O)c1cccc([N+](=O)[O-])c1)Nc1ccccc1	801989559	CTXQPGRZTOLBPL-INIZCTEOSA-N	433.446	1.601	50	20	IDGD	
CCS(=O)(=O)N1CCN(C(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)[C@H](C)C1	805369225	PVEGVQXAPMFHMB-CHWSQXEVSA-N	432.930	1.204	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)c2cnn(CCN(C)C)c2-c2ccccc2)c1	806364677	DPISMILHSKTOAQ-UHFFFAOYSA-N	436.516	1.993	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)c1c(O)cnc2c(Br)cccc12	810572982	XNKBVVQCAGQWMS-UHFFFAOYSA-N	444.245	1.289	50	20	IDGD	
COC(=O)Cc1cc(Br)ccc1S(=O)(=O)NNC(=O)NC1CCCCC1	811676726	HJZXIXBFYJBACE-UHFFFAOYSA-N	448.339	1.990	50	20	IDGD	
O=C(NCc1cccc(C(F)(F)F)c1)NNC(=O)C(=O)N1CCN(c2ccccc2)CC1	813425718	RDWWUPAWEZFKRO-UHFFFAOYSA-N	449.433	1.885	50	20	IDGD	
COC(=O)C[C@H]1COCCN1C(=O)CCC(=O)C(C#N)=C1N(C)c2ccccc2N1C	813664948	CSIDTDGXQBCQQE-HNNXBMFYSA-N	426.473	1.448	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCc2nncn2C1)C(=O)Nc1cc(F)ccc1SCC(F)F	815692138	JYHIDBYLQMWROZ-VIFPVBQESA-N	442.423	1.123	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C[C@](O)(c2nccn2C)C(F)(F)F)cc1OC	818652763	MMRGOZNYHXWZMG-KRWDZBQOSA-N	430.383	1.429	50	20	IDGD	
O=C(CC1CC1)NNC(=O)c1ccc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1O	819131536	HYLZPIDPIYHTHB-UHFFFAOYSA-N	434.430	1.662	50	20	IDGD	
C[C@@H]1CC(C)(C)C[C@]2(C1)NC(=O)N(CC(=O)NNC(=O)COc1ccccc1F)C2=O	864019973	WUAFJPMHFPHIQW-ASSNKEHSSA-N	434.468	1.489	50	20	IDGD	
CSC[C@H](C(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)N1C(=O)[C@H]2CCCC[C@@H]2C1=O	866751506	YREJYEYVYHOOOM-SOUVJXGZSA-N	434.474	1.263	50	20	IDGD	
O=C(CNC(=O)c1ccc(Cl)c(Cl)c1)NNC(=O)c1ccc(-n2cnnn2)cc1	913155903	BWHRWWXJODSNCY-UHFFFAOYSA-N	434.243	1.160	50	20	IDGD	
CCCCOc1ccc(C(=O)NNS(=O)(=O)c2cc(C(=O)NC)n(C)c2)cc1OC	914688947	OWIDUBKCENNJQT-UHFFFAOYSA-N	438.506	1.196	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)[C@@H]2CC(=O)N(c3ccccc3)C2)c2ccccc2c1=O	914728141	GQAVXXXINQUHAG-OAHLLOKOSA-N	433.468	1.621	50	20	IDGD	
COc1ccc2c(ccn2CC(=O)OCC(=O)NNC(=O)c2ccc(OC)c(OC)c2)c1	915589145	KJXXKDCXXDDFOK-UHFFFAOYSA-N	441.440	1.672	50	20	IDGD	
COc1cccc(C[C@H](C(=O)NNC(=O)COc2ccc(C)c(C)c2)n2nnnc2C)c1	915695581	TXSLTQQTSXLPAU-HXUWFJFHSA-N	438.488	1.617	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)[C@H]2CCCCN2S(=O)(=O)c2cccs2)c1	915808659	KIAPUWBFLMLPGV-MRXNPFEDSA-N	436.559	1.819	50	20	IDGD	
CN(C)[C@@H](CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)Cc1ccccc1	915900877	IOYQPMZWRWWFMG-GOSISDBHSA-N	447.561	1.054	50	20	IDGD	
O=C(NCCCN1CCN(c2ncccn2)CC1)NNC(=O)c1ccc2ccccc2n1	916266838	IMBKWAKZVGNWHK-UHFFFAOYSA-N	434.504	1.181	50	20	IDGD	
Cc1cccc([C@H](CNC(=O)NNC(=O)COc2ccccc2F)N2CCOCC2)c1	916435407	BZMDHDWXEOZBIE-IBGZPJMESA-N	430.480	1.917	50	20	IDGD	
CN(CC(=O)NNC(=O)COc1ccc(F)cc1)C(=O)c1ccc(Br)s1	917916355	HGWBJPRGGGUFIG-UHFFFAOYSA-N	444.282	1.948	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCc2ccc([C@@H]3C[C@H]3C)o2)cc1	918078530	UTLQTEIESKNGAC-RHSMWYFYSA-N	434.518	1.863	50	20	IDGD	
CC[C@@H](C)NC(=O)CCNC(=O)NNC(=O)[C@@H](C)Oc1cccc(Br)c1	918085419	VEIAYOUSLBDJLD-VXGBXAGGSA-N	429.315	1.852	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)c2ccc(F)c(S(=O)(=O)N(C)C)c2)c1C	918673945	RYWPCUFAYJVPPJ-CQSZACIVSA-N	437.493	1.921	50	20	IDGD	
O=C(NNC(=O)C1(c2cccc(F)c2)CCOCC1)c1csc(N2CCOCC2)n1	919972647	IRWBPFMVGZKICL-UHFFFAOYSA-N	434.493	1.628	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCC(=NNC(=O)c3ccc4c(c3)OCO4)CC2)cc1	920359811	HBSWPLXKTIODAB-UHFFFAOYSA-N	431.470	1.994	50	20	IDGD	
O=C(NC[C@H](c1cccc(F)c1)N1CCOCC1)NNC(=O)c1cccc([N+](=O)[O-])c1	921248364	WQFPHJASYOUXLZ-GOSISDBHSA-N	431.424	1.751	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)[C@H]2CCCCN2Cc2cccnc2)n1	1321701672	UJSKDCMFOPWEJX-MRXNPFEDSA-N	431.518	1.134	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4nccnc4c3)C2)C1	1777980987	PADDQYABXJDIKK-DJJJIMSYSA-N	433.306	1.857	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](N)Cc2cccnc2)C1	1778054124	XGPNYCPSJNQYRU-NJNPRVFISA-N	436.984	1.730	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccco1)C2	1778091190	KOEVUGIRKITIQO-UYVYXKLWSA-N	441.488	1.541	50	20	IDGD	
Cn1cc(C(=O)N2CCO[C@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)c(C(F)F)n1	1779295498	PJUBAXWYBJLGOP-SFHVURJKSA-N	430.528	1.653	50	20	IDGD	
O=C(CS[C@@H]1CCCCO1)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2	1779403816	MEFIMLBFGXWZGW-FXRXJOCMSA-N	434.986	1.360	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)CCC(=O)N3CCCC3)CCO2)C1	1781224718	NJHNOUHLMSGQJE-RBUKOAKNSA-N	434.364	1.455	50	20	IDGD	
COC(=O)[C@H]1CC[C@H](C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)CC1	1781326985	VWBFCCAGBSBAGT-UHQDVWGKSA-N	449.317	1.486	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(Cl)c(O)cc3O)C2)C1	1781472360	FSBKNAUTIVOFLW-FZKQIMNGSA-N	433.288	1.449	50	20	IDGD	
C#CCO[C@@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](Br)CC)C1	1781897099	AMKFGYRTXPNWSN-WFXMFSGNSA-N	429.355	1.712	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H]1CC[C@H](C(=O)OC)C1)C2	1782171798	GILXNVCYUMXFBY-VLJBJNFASA-N	444.956	1.343	50	20	IDGD	
O=C(c1ccc2nn[nH]c2c1)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1782582375	BGFSQMAUCMQSEI-BBRMVZONSA-N	426.246	1.092	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H]2[C@H]3COC[C@H]32)C1	1782796654	YJQSKWXNUIZHEK-FQSXLPAHSA-N	429.355	1.424	50	20	IDGD	
C[C@H](O)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](Br)Cc3ccccc3)C2)C1	1783023273	VXIRPFZGRXHSJN-URLQWDBASA-N	425.323	1.203	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cnn4c3OCCC4)CCO2)C1	1783353215	NPZPTIRQHHITJU-KSSFIOAISA-N	441.326	1.283	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H]3CCC[C@@H](C(=O)OC)C3)C2)C1	1783869879	XDHUXPBJDMBLHO-DICRZQGBSA-N	430.929	1.050	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(F)(F)C(F)(F)C(=O)O)[C@H]2C1	1784912010	CILAMLNJNYJQGK-YFKTTZPYSA-N	446.825	1.729	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cn3cc([N+](=O)[O-])cn3)[C@H]2C1	1785214023	IJUOXWVTEUEHQN-QEJZJMRPSA-N	427.889	1.036	50	20	IDGD	
Cc1nnc(CCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Br)C[C@@H]32)s1	1785325561	OQIHPEVTNITUMO-JUFZMCDQSA-N	449.346	1.449	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)c1cc(O)nc(Cl)c1	1785694177	ZADMRUIBPXEVPT-DRZSPHRISA-N	446.729	1.819	50	20	IDGD	
Cc1nccnc1C(=O)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1	1788147780	DZKUVVARKMXJED-UHFFFAOYSA-N	430.273	1.526	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cn4cc(F)ccc4n3)[C@H]2C1	1788344796	NRBXMPWBPBCQNV-ZVZYQTTQSA-N	448.571	1.918	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)c1cccn2ccnc12	1788366446	SWAAMRKZUKPVNH-MXAVVETBSA-N	439.285	1.618	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)COC(=O)C(F)(F)F)[C@H]2C1	1788528913	FNNKVBYNCOCRNQ-CYDGBPFRSA-N	428.835	1.479	50	20	IDGD	
COC(=O)[C@@H]1CC[C@@H](C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]3C2)C1	1789921162	ADRUUHHAIPBTKR-SPJHXALWSA-N	449.317	1.246	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)Nc1ccc(C2(NC(=O)CN3CC(=O)NC3=O)CCC2)cc1	1790488953	HSKNVMCXVSSDSU-SFHVURJKSA-N	441.315	1.909	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](CC)NC(C)=O)C[C@@H]21	1790961216	INRSOUKKOBDDJC-QXKUPLGCSA-N	432.359	1.054	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3nn[nH]c3c1)C2	1792871845	AGWZDSAYVRHKOU-YGSHXTJESA-N	436.310	1.192	50	20	IDGD	
Cc1cccc(C)c1SCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](O)CCl	1792981264	RZEOQDXNZFELEK-KYHPRHEASA-N	426.966	1.585	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CCc3cccc(Cl)c31)C2)[C@@H](O)CCl	1792984084	SDJQUNMPUFHXGR-TWTQLAGVSA-N	427.328	1.559	50	20	IDGD	
C[C@@H](CBr)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)COc1ccc(O)nn1)C2	1792990857	OCGFBSHWSQLMGX-RVMXOQNASA-N	427.299	1.230	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CCc2ccccc2[C@@H]1O	1793036102	FYZARSHLCVTREI-YSDUZXLGSA-N	436.936	1.126	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCCc1ccccc1F)c1cccc(B(O)O)c1	1793086554	LACFZNQMFNZBIJ-WKCHPHFGSA-N	438.308	1.780	50	20	IDGD	
CCOC(=O)c1c(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Cl)c[nH]c1C	1796364320	HLGHARGMSSRMJR-DACLVMHWSA-N	443.903	1.556	50	20	IDGD	
Cc1c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CO[Si](C)(C)C)C3)nc2ccccn12	1796845960	AYUAZKWWMIHNTK-CWPLJXCYSA-N	430.581	1.697	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H]1[C@H]3SC=C[C@H]31)C2	1796893505	CJJRYQHGPAIRJS-BXXVXSLGSA-N	427.530	1.634	50	20	IDGD	
COC(=O)C12CCC(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@H](F)Cl)C4)(CC1)CC2	1797265223	ZKJCULXWCPHKFW-UQPGURTASA-N	430.904	1.624	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccn2ccnc2c1	1797448472	BCUQLWOSKLSECJ-IVSAIRAKSA-N	435.322	1.711	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1c(C)nc2sccn12	1797546081	IEYQUCYWYKQKQF-CRWXNKLISA-N	426.926	1.161	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1cnc(Cl)s1	1798236071	UVRJWHDCJUAXGA-BKFJMODKSA-N	426.695	1.690	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCN(C)C)C2	1799218168	ZVSZBLAVJYKJLQ-MUJYYYPQSA-N	432.477	1.724	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnn3ccccc13)C2	1799275032	INBPOQUFMOGWEI-UESRRSCYSA-N	425.316	1.774	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(Cl)cnc1O)C2)[C@H](F)Br	1799342019	CXVNOVCVTAYKDS-VVJJBPBLSA-N	436.665	1.334	50	20	IDGD	
COc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)Br)C3)c(F)c1	1799521881	YITUIUNRBXGMMO-OVZMXSCWSA-N	429.286	1.821	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(C)ccc1-n1ccnn1	1799865410	OPTAHMCPKZEWIO-LORHWOILSA-N	431.924	1.796	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2n(n1)CCCN(C)C2	1800128529	RNSOIHPFSDOSRA-HIRMHNASSA-N	437.972	1.329	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(C)nc(O)c1)C2	1800639610	KJBCXVJSQQRMNE-HLPPOEQASA-N	426.311	1.472	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccn3nccc13)C2	1800642929	CMHDCWMMFIRTEG-IARIHHJXSA-N	435.322	1.711	50	20	IDGD	
CN(CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1CCOC1)NC(=O)NCc1ccccc1	1803235976	WSHXBZIGOFPOOO-HAGHYFMRSA-N	443.548	1.007	50	20	IDGD	
CN1CC(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C3)C1	1803303698	KAULKOCSEIZOAH-FZKCQIBNSA-N	428.961	1.318	50	20	IDGD	
Cn1nc(C(=O)NC[C@H]2CCN(C(=O)CCBr)[C@@H]2c2cccnc2)cc1O	1804894998	RMAQVFZAAGEIRC-CXAGYDPISA-N	436.310	1.625	50	20	IDGD	
O=C(c1cnc(-c2ccccn2)nc1)N1CCC2(CCCN(C(=O)[C@H](O)CCl)C2)CC1	1805518167	NDDNPSGRBQASCD-GOSISDBHSA-N	443.935	1.983	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H](CNC(=O)CCBr)[C@H]1c1cccnc1)n1ccnn1	1806346512	JKYZUZGQQAYRIO-FRFSOERESA-N	435.326	1.725	50	20	IDGD	
O=C(Cn1cncn1)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@@H]1c1cccnc1	1807602738	HNEDZBXEYMCNMU-NWANDNLSSA-N	425.262	1.070	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2ccc3nncn3c2)[C@@H]1c1cccnc1	1809910287	GZULGIMGMVTEBK-IEZWGBDMSA-N	442.907	1.698	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@H]1CCN(C(=O)c2nc[nH]c2[N+](=O)[O-])[C@@H]1c1cccnc1	1810539929	ADSXWTLJSOQRBM-RHSMWYFYSA-N	446.540	1.884	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2cccc(=O)n2O)[C@H]1c1cccnc1	1813029506	ODMGEIYPSKFOHY-VKJFTORMSA-N	434.880	1.054	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](C)CN)n[nH]1	1817223740	OJQOCVVSKWNMBG-ROSSUFOISA-N	428.497	1.131	50	20	IDGD	
COc1ccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)cc1	1817472395	HETNNFYZHBIIJK-HXUWFJFHSA-N	448.288	1.718	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](O)CCl)CC2)c1nnsc1C1CC1	1817702205	MZNWBTMVMJAKBP-WCBMZHEXSA-N	427.939	1.698	50	20	IDGD	
CC(C)[C@H](S)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819401707	PGLHCJQUJBBZEU-RDJZCZTQSA-N	445.549	1.669	50	20	IDGD	
COc1cc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)ccn1	1819782290	CQKPOUDCXLLBGG-GOSISDBHSA-N	449.276	1.113	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)Cc2ccc3ncnn3c2)n[nH]1	1820703265	XMQNBDAMFRHFNO-GDBMZVCRSA-N	445.911	1.941	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccncc2F)[nH]n1	1822415793	INIJHJWANANHHC-MRXNPFEDSA-N	431.472	1.623	50	20	IDGD	
O=C(CCCn1cccc1)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1822826858	HEUMCFJXLXVERH-FQEVSTJZSA-N	449.320	1.677	50	20	IDGD	
CN1C(=O)CC[C@H]1C(=O)N[C@H]1CCc2nc(NC(=O)[C@](C)(Cl)CCl)sc2C1	1822870540	SYPDBTMHWLRQCN-LTHLMHMASA-N	433.361	1.912	50	20	IDGD	
O=C(CN1CCOCC1)N[C@@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1	1823002249	BZFYGLMEDILFFK-RNCFNFMXSA-N	435.319	1.078	50	20	IDGD	
Cc1cc2nnc(C(=O)N3CCC([C@H]4CCCCN4C(=O)[C@H](O)CCl)CC3)c(C)n2n1	1824187961	WGFNUGXJSVMLMY-IAGOWNOFSA-N	448.955	1.574	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CNC(=O)OC(C)(C)C)CC2	1826004922	UYQGFHBGCLIDAP-QWRGUYRKSA-N	446.957	1.834	50	20	IDGD	
Cc1ccc(C(=O)N[C@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)nc1C	1826080532	PLAGPGQAIYJOOV-AWEZNQCLSA-N	444.561	1.754	50	20	IDGD	
O=C1C[C@@H](C(=O)N2CCC([C@H]3CCCCN3C(=O)CCBr)CC2)CCN1	1826360783	VIICEMJXQNFIKO-JKSUJKDBSA-N	428.371	1.917	50	20	IDGD	
O=C(C1CC(F)(F)C1)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827055964	PNGZUQRBMYVSGK-IBGZPJMESA-N	434.292	1.645	50	20	IDGD	
CCC(=O)C(=O)N1CCC([C@H]2CCCCN2C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)CC1	1827679612	LQKLUPIYXDTDDV-LSPPGFKNSA-N	429.521	1.719	50	20	IDGD	
CNC(=S)NCCC(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@H](Cl)COC)CC1	1828931299	GVCJYYAAUYMBNO-CVEARBPZSA-N	433.018	1.344	50	20	IDGD	
Cc1c(C(=O)N2CCCC[C@H]2C2CCN(C(=O)[C@@H](O)CCl)CC2)cn2[nH]cnc(=O)c12	1829598060	QLRSAYAEKOHYQB-IRXDYDNUSA-N	449.939	1.164	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3nccs3)CCO2)C1	1834437682	HONJKWPWLNLCJX-LRDDRELGSA-N	432.340	1.387	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)c1ccc2ncoc2c1	1835409175	JIGQYGWUKATTTB-SFHVURJKSA-N	434.924	1.613	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)C3CCCC3)CC2)CC1	1835737036	SQZKLDZEAICIGV-UHFFFAOYSA-N	442.564	1.061	50	20	IDGD	
C[C@@H](C(=O)N1CCC(N2CCC(NC(=O)CO[Si](C)(C)C)CC2)CC1)n1ccnn1	1835837334	HTKJSSMSEVZYIU-INIZCTEOSA-N	436.633	1.262	50	20	IDGD	
C=CCO[C@H](C)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](F)Br)CC2)CC1	1836413394	FJSVQBHUFRNDSL-CZUORRHYSA-N	434.350	1.840	50	20	IDGD	
O=C(COCc1ccccc1)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836716761	ORKISMXJOMBDAQ-HXUWFJFHSA-N	438.952	1.802	50	20	IDGD	
COc1nccc(C(=O)N2CCC(OC3CCN(C(=O)[C@H](O)CCl)CC3)CC2)c1F	1836718039	QJBOLMMKTPYFKA-MRXNPFEDSA-N	443.903	1.441	50	20	IDGD	
Cc1cc(/C=C/C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)no1	1837557285	GVDRSKSOZPEHAO-QGBYBWSUSA-N	446.273	1.143	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc4ncsc4[nH]3)CCO2)C1	1837752759	FEKHROILYQBXLM-SGTLLEGYSA-N	426.926	1.712	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnccc3Cl)CCO2)C1	1837780381	FFZCUTBGTFJUMT-SJCJKPOMSA-N	446.729	1.588	50	20	IDGD	
CCCCC[C@@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1	1839905810	XXJDALJXVPXVGW-GCJKJVERSA-N	440.585	1.032	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(OC)ccc3C)C2)C1	1840154816	HJONSBULBYHCBI-NQIIRXRSSA-N	440.924	1.327	50	20	IDGD	
CN(C)c1ccc(CCC(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)cc1	1840314962	WUSVORKBUNRZNJ-TZIWHRDSSA-N	441.931	1.676	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CC[C@@H]3CCOC3)CCO2)C1	1840590556	SKVRSCPSGBAKAX-HDMKZQKVSA-N	433.343	1.043	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(F)cc3C)CCO2)C1	1840778465	BRVYBRVMXJOGPU-FXAWDEMLSA-N	428.888	1.458	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC12CN(C(=O)c1ccc3nc(CO)[nH]c3c1)C2	1841287521	SDVJIWZYMBEAJW-LBPRGKRZSA-N	435.322	1.903	50	20	IDGD	
COc1ccc(/C=C/C(=O)N2CCCC23CN(C(=O)[C@@H](O)CCl)C3)c(OC)c1OC	1841435081	HOEUSNMZVTVSJR-VFADXPBXSA-N	438.908	1.529	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)OC)C1	1841750232	XEYMGAJJESVLGR-ILXRZTDVSA-N	447.960	1.372	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)c1nc3ccc(C(F)(F)F)cn3n1)C2	1846361915	WNIXZOVNBQKSBQ-LBPRGKRZSA-N	445.829	1.819	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H]2C[C@]21C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl	1847563606	LENMHVRVNKMPIV-BINAMKIQSA-N	427.929	1.187	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1csc(N)n1	1848099190	HQUDSMQFMIRXKT-DRZSPHRISA-N	443.957	1.673	50	20	IDGD	
Cc1c([N+](=O)[O-])cc(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1[N+](=O)[O-]	12803771	ZVMCYPZPOGGZKU-UHFFFAOYSA-N	436.406	1.179	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1[N+](=O)[O-]	15315114	XWLVPGZOXJCWNZ-UHFFFAOYSA-N	427.461	1.577	50	20	IDGD	
CN(CC(=O)NNC(=O)COc1ccc(C#N)cc1)S(=O)(=O)c1ccc(Cl)cc1	15888891	AKWSKZFWNNTOSJ-UHFFFAOYSA-N	436.877	1.059	50	20	IDGD	
COc1cc(CCC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)cc(OC)c1	16053101	FFGXMERWSXILTF-UHFFFAOYSA-N	434.518	1.699	50	20	IDGD	
COc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NNC(=O)COc2cc(C)ccc2C)cc1	17203432	IGHLJVVMKGAMFO-HNNXBMFYSA-N	435.502	1.205	50	20	IDGD	
CC(C)(C)NC(=S)NNC(=O)CCCNS(=O)(=O)c1ccc2c(c1)CCCC2	28716508	KOIUAHXNNHSNKY-UHFFFAOYSA-N	426.608	1.918	50	20	IDGD	
Cc1sc2ncnc(SCCC(=O)NNC(=O)CNC(=O)c3ccco3)c2c1C	725740202	CTZQNBXTQRXKQS-UHFFFAOYSA-N	433.515	1.961	50	20	IDGD	
COc1ccc([C@H](CNC(=O)NNC(=O)CNC(=O)c2cccs2)N(C)C)cc1OC	726084738	STLHXZVAHSFCDQ-AWEZNQCLSA-N	449.533	1.128	50	20	IDGD	
Cc1noc([C@H](C)NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)n1	726277724	DORKBMVORSQXFA-LBPRGKRZSA-N	436.494	1.258	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(C)c(C(=O)NNc2nc(-c3ccncc3)no2)c1	726376800	CKOMFDMNGBVCCO-UHFFFAOYSA-N	432.462	1.122	50	20	IDGD	
CC(C)CC(=O)N[C@H](C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)c1ccccc1	727368558	BBYFFYPXHHWHFL-IBGZPJMESA-N	431.514	1.755	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)CCc2c(C)c3c(C)nn(C)c3[nH]c2=O)c1	728205898	KQMSSHQNPWDIDA-UHFFFAOYSA-N	426.477	1.079	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)c2c(C)nc3ccccn23)ccc1OCC(=O)OC	728513926	ZTCCMRCSWHQTNO-UHFFFAOYSA-N	426.429	1.668	50	20	IDGD	
Cc1ccc(-n2nc(C(=O)NNC(=O)N[C@H]3CCS(=O)(=O)C3)c3c2CCCC3)cc1	731003840	OWBNTCIESAGSPG-AWEZNQCLSA-N	431.518	1.191	50	20	IDGD	
O=C(CCCN1CCN(c2ccccc2)CC1)NNC(=O)c1ccc(-n2cnnn2)cc1	731890473	BHVHPVLXDMPVGX-UHFFFAOYSA-N	434.504	1.026	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)[C@@H]2CCCN(C(=O)Cc3ccccc3)C2)C[C@@H](C)O1	732260870	IPDAANRZRYNFJF-WSTZPKSXSA-N	430.549	1.114	50	20	IDGD	
Cc1nn(-c2ccccc2)c2nc(C(=O)NNC(=O)CCN3C[C@H](C)O[C@H](C)C3)ccc12	732261166	BBZLHEAFYLUMLN-IYBDPMFKSA-N	436.516	1.989	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)ccc1Cl	733110331	IWRIXJLQBPYRDU-UHFFFAOYSA-N	447.904	1.851	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)C[C@@H]2CCc3ccccc3C2)CC1	735118029	NEMPZVWPPNGRAL-QGZVFWFLSA-N	443.573	1.656	50	20	IDGD	
Cc1c(/C=C(\C#N)C(=O)NC2CCN(S(=O)(=O)C3CCOCC3)CC2)cc(C#N)n1C	736251114	QZJXVBFGHTWRNK-GZTJUZNOSA-N	445.545	1.202	50	20	IDGD	
CCc1cc(NNC(=O)c2ccc(OCC(=O)NC)c(OC)c2)nc(-c2ccccn2)n1	738531145	WINXQEDZPNXINK-UHFFFAOYSA-N	436.472	1.991	50	20	IDGD	
CCc1cc(NNC(=O)C2=CC=CN3CCS(=O)(=O)N=C23)nc(-c2ccccn2)n1	738538182	GFXUWRCUFJBGBK-UHFFFAOYSA-N	425.474	1.042	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)N[C@H]2CCN(c3ccc(Cl)cc3)C2=O)cc1	740484519	XEABFFUCRCLQHD-KRWDZBQOSA-N	427.848	1.726	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)c2cc(N3CCNC3=O)ccc2Cl)c2ccccc2c1=O	742033826	GIBNXLRGRZNNSV-UHFFFAOYSA-N	440.847	1.191	50	20	IDGD	
Cc1nn(C)c(C)c1S(=O)(=O)N[C@H](C)C(=O)NNC(=O)C12CC3CC(CC(C3)C1)C2	742034349	XYNZFKUZRCPRIT-GZXIDGMPSA-N	437.566	1.068	50	20	IDGD	
C[C@@H](CCc1ccccc1F)C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	743418925	IJQQECZNIXLILB-INIZCTEOSA-N	449.552	1.869	50	20	IDGD	
COc1ccc(O[C@H](C)CNC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)cc1	743509629	IQJJHKVAQJWTOY-CYBMUJFWSA-N	449.533	1.708	50	20	IDGD	
O=C(NNC(=O)c1cc2c(s1)CCC2)N[C@H]1CC(=O)N(CCOc2ccccc2)C1	743639577	WJQZKWOOHAOWSF-HNNXBMFYSA-N	428.514	1.861	50	20	IDGD	
Cc1nn(-c2ccc(S(N)(=O)=O)cc2)c(C)c1CCC(=O)NNC(=O)NC1CCCC1	744469671	AVZLBUWWJMUMKM-UHFFFAOYSA-N	448.549	1.342	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1cccnc1N1CCCCC1	744621501	ZJWJMIRCVMMQAX-UHFFFAOYSA-N	445.545	1.850	50	20	IDGD	
Cc1nc(N2CCOCC2)nc(O)c1CCC(=O)NNc1ccc([N+](=O)[O-])cc1Cl	748726386	BZLWRDWZPDABRH-UHFFFAOYSA-N	436.856	1.965	50	20	IDGD	
CN(C)C(=O)CN1C(=O)C(=NNC(=O)c2cccn2C)c2cc(Br)ccc21	750933317	CSIJRPYSTVAYFD-UHFFFAOYSA-N	432.278	1.357	50	20	IDGD	
CC(C)c1ccc(C(=O)O)cc1S(=O)(=O)NNC(=O)CNC(=O)c1cccs1	751282225	KKOJPOVSUZFNDU-UHFFFAOYSA-N	425.488	1.309	50	20	IDGD	
CCOCCCn1c(NNC(=O)[C@H]2CS[C@]3(C)CCC(=O)N23)nc2ccccc2c1=O	752048444	UGXFRLBSEODYJZ-IIBYNOLFSA-N	445.545	1.720	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2ccc(Cl)c(C(=O)NNC(=O)CO)c2)cc1Cl	753445598	PTLUDRSSFNXBIC-UHFFFAOYSA-N	432.285	1.856	50	20	IDGD	
Cc1c(Br)cc(C(=O)NNC(=O)CCN2C[C@@H](C)O[C@H](C)C2)cc1[N+](=O)[O-]	753767377	HAGUGPICZYKFCU-GHMZBOCLSA-N	443.298	1.926	50	20	IDGD	
CC(C)(C)CC(=O)NNC(=O)Nc1ccc(Cl)c(S(=O)(=O)N2CCOCC2)c1	755361709	OBZPHLNXOSZEKF-UHFFFAOYSA-N	432.930	1.950	50	20	IDGD	
C[C@@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(NC(=O)NNC(=O)Cc3cc[nH]n3)cc2)C1	755421052	QQDMMQHJSYFBBG-ZIAGYGMSSA-N	434.522	1.472	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2ccc3c(c2)OCO3)c(Cl)cc1F	755957030	LBQAQCYFKXVOID-UHFFFAOYSA-N	430.797	1.618	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCC2CCS(=O)(=O)CC2)cc1Br	756071175	HEWICIVUPQYWOH-UHFFFAOYSA-N	434.312	1.227	50	20	IDGD	
CCS(=O)(=O)N1CCC(CNC(=O)NNC(=O)c2cc(-c3ccc(C)cc3)[nH]n2)CC1	758742805	LLDULJQZYIWDGB-UHFFFAOYSA-N	448.549	1.391	50	20	IDGD	
Cc1cc(C)nc(-n2nccc2NC(=O)C(=O)NNC(=O)COc2ccc(C)c(C)c2)n1	760280300	USERBWGQSKVOPQ-UHFFFAOYSA-N	437.460	1.061	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cccc(OCC(F)F)n3)CC2)cc1	760737173	TUKPHBLMYIXUOP-UHFFFAOYSA-N	447.486	1.613	50	20	IDGD	
O=C(c1c[nH]c2cc([N+](=O)[O-])ccc12)N1CCN(S(=O)(=O)CBr)CC1	761165942	IIUHJYUCWYQEIW-UHFFFAOYSA-N	431.268	1.516	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)CCc2nnc(-c3ccc(Cl)cc3)o2)C[C@@H](C)O1	762444551	RDGPPDLIUFJGAD-ZIAGYGMSSA-N	435.912	1.969	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)NCCCN1C(=O)COc2ccccc21	763518867	WKGOLCLYONNGNT-UHFFFAOYSA-N	430.486	1.630	50	20	IDGD	
O=C(NNC(=O)c1ccccc1F)C(=O)Nc1ccc(N2CCOCC2)c2ccncc12	763556828	RSLKVUDBNJOQPB-UHFFFAOYSA-N	437.431	1.610	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)Nc1cccc(OC[C@H]2CCCO2)c1	763570175	DALBHSKSVVZLRH-VQIMIIECSA-N	441.440	1.170	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2cc(C)nc3ccccc23)ccc1NC(C)=O	763613743	CGTWHQGXHJXRNO-UHFFFAOYSA-N	435.440	1.910	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(N3CCOCC3)nc2C)cc1C	763680017	NVDCQGDWFZZWPK-UHFFFAOYSA-N	441.488	1.008	50	20	IDGD	
COC(=O)C(C)(C)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2F)cc1	763680125	RSTJTPBQKFWWSJ-UHFFFAOYSA-N	431.420	1.441	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(N3C[C@@H](C)O[C@H](C)C3)nc2)cc1	763832564	XYVWQGJMWMSSSJ-HUUCEWRRSA-N	425.489	1.657	50	20	IDGD	
COc1cc(OC)c(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)cc1Cl	763837269	DARJVPCKCMHNSG-UHFFFAOYSA-N	425.800	1.661	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)NC(=O)CS3)c1C	763849822	NIYUPXKMOVZCFY-ZDUSSCGKSA-N	442.497	1.901	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(NC(C)=O)cc2)cc1OC	763911367	LGZXINSANAWDSQ-UHFFFAOYSA-N	428.445	1.842	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)C(=O)Nc1cccc(COc2ccc3c(c2)OCO3)c1	763997070	VASVLXLMOVVQRH-UHFFFAOYSA-N	436.424	1.733	50	20	IDGD	
COC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2cc(Br)cn2C)c1	764002828	SUDJBWWXWDVDDA-UHFFFAOYSA-N	438.238	1.366	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(C(=O)NNC(=O)CSc2ccccc2O)ccc1Cl	764045511	MTWOJBBALLVPKG-UHFFFAOYSA-N	443.934	1.849	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2cccc(N3CCCCC3=O)c2)c1O	764132094	JKUUPZOHFDINFM-UHFFFAOYSA-N	426.429	1.317	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2O1)C(=O)Nc1ccccc1CN1CCSCC1	764162683	DTWWPJRFHHHPJG-IBGZPJMESA-N	440.525	1.325	50	20	IDGD	
Cc1nnnn1-c1cccc(NC(=O)C(=O)NNC(=O)c2c(Cl)cccc2Cl)c1	764220653	BUVFILIOTATCKO-UHFFFAOYSA-N	434.243	1.677	50	20	IDGD	
O=C(NNC(=O)c1cccc(OC(F)F)c1)C(=O)Nc1ccccc1O[C@@H]1CCOC1	764260182	RZBHZGUCQPOVPX-CQSZACIVSA-N	435.383	1.855	50	20	IDGD	
Cc1cnn([C@@H]2CCCc3ccccc32)c1NC(=O)C(=O)NNC(=O)Cc1cccnc1	764267848	AZOFJBHQTMNHCW-LJQANCHMSA-N	432.484	1.841	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)C(=O)Nc1cnn(-c2ccccc2F)c1	764342133	AXOBWKCOTAHMAM-UHFFFAOYSA-N	433.403	1.597	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)C(=O)Nc1cc2c(cc1Cl)OCCO2	764343637	UHOQAVAZFYIZOK-UHFFFAOYSA-N	441.831	1.697	50	20	IDGD	
N#Cc1c(F)cccc1-n1ccc(NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)n1	764345232	DBLNXBGREYHYMQ-UHFFFAOYSA-N	442.794	1.642	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)cc1C(=O)N(C)C	764369309	CJNVTRCUVIOWOR-UHFFFAOYSA-N	434.399	1.455	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1ncn(Cc2ccccc2)n1	764392395	FGABXGDWUZJTRR-UHFFFAOYSA-N	440.485	1.213	50	20	IDGD	
Cc1cnn(-c2ccc(NC(=O)C(=O)NNC(=O)CSc3ccccc3O)cc2F)c1	764403790	BHEVCCKHJHFYIX-UHFFFAOYSA-N	443.460	1.904	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)[C@H]1CC(=O)N(c2ccc3c(c2)CCC3)C1	765311328	VDVYUNBUYDNEJY-KRWDZBQOSA-N	444.532	1.981	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)NCCc3ccc(F)cc3)CC2)cc1	765312222	AKIQBNITQOQYRU-UHFFFAOYSA-N	427.524	1.825	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)C2CCCC2)c(I)c1	765697283	HQURXNXONDQQML-UHFFFAOYSA-N	431.230	1.576	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)N[C@H]1C[C@@H](OC(C)C)C1(C)C	766086239	VWPJOJBZBNCWCL-UONOGXRCSA-N	425.555	1.824	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3c(C)nn4c(C)cc(C)nc34)CC2)cc1	766649574	RBVNSQPVTSPKIM-UHFFFAOYSA-N	449.559	1.542	50	20	IDGD	
C[C@@H](C(=O)NNc1ccnc(N(C)C)n1)N1C(=O)c2ccc(Br)cc2C1=O	769649808	GEAITGQGGNOZFC-VIFPVBQESA-N	433.266	1.433	50	20	IDGD	
COc1ccc(CNC(=O)CNC(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)cc1	770327729	ORYBNGUSZHVDTG-CYBMUJFWSA-N	434.880	1.763	50	20	IDGD	
Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	771607306	LSDHLIOUCYQJBU-UHFFFAOYSA-N	426.838	1.183	50	20	IDGD	
O=C(Cc1ccnc(O)c1Br)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772518679	UDSZJAUHKRLTGZ-UHFFFAOYSA-N	441.669	1.209	50	20	IDGD	
CC(C)COc1cccc(OCC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1	772788654	DYKKDPRUPIVDIE-UHFFFAOYSA-N	449.529	1.812	50	20	IDGD	
Cc1sc2ncc(C(=O)NNC(=O)[C@H]3CCCN(C(=O)OC(C)(C)C)C3)c(=O)n2c1C	773412485	WCXVWJHOPXAPSA-ZDUSSCGKSA-N	449.533	1.781	50	20	IDGD	
O=C(NNc1nc2ccccc2s1)Nc1ccc(S(=O)(=O)N2CCOCC2)cn1	776061595	LTXAVEQFBVPMBS-UHFFFAOYSA-N	434.503	1.861	50	20	IDGD	
CN(NC(=O)c1cccnc1N1CCOCC1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776201150	FTKUHRITXVZVMZ-UHFFFAOYSA-N	448.524	1.168	50	20	IDGD	
CN(NC(=O)C[C@@H](NC(N)=O)c1ccccc1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776206090	OYPVZGWFAQDXSY-MRXNPFEDSA-N	448.524	1.422	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2N2CCOCC2)cc1OC	776560798	RUPANEVEOAJSKH-UHFFFAOYSA-N	444.444	1.914	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(N2CCOC2=O)c([N+](=O)[O-])c1)c1ccc(Cl)cc1	777594078	NXAXDAXSBFMOQP-UHFFFAOYSA-N	440.821	1.828	50	20	IDGD	
C#CCN1C(=O)C(=NNC(=O)CNC(=O)OC(C)(C)C)c2cc(Br)ccc21	777903872	CZXFZYAGRHTIGG-UHFFFAOYSA-N	435.278	1.774	50	20	IDGD	
COc1ccc(CNC(=O)NNC(=O)CNC(=O)OC(C)(C)C)cc1Br	778639326	BWNRNVBHQNHQTM-UHFFFAOYSA-N	431.287	1.813	50	20	IDGD	
C[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1NC(=O)NNC(=O)c1cc([N+](=O)[O-])ccc1O	779704499	LREZQZDMZJZMCH-RISCZKNCSA-N	437.453	1.890	50	20	IDGD	
Cc1cc(N2C[C@H](C(=O)NNC(=O)c3csc(N4CCOCC4)n3)CC2=O)ccc1F	779877942	SXVPPWZWCZDCSI-CYBMUJFWSA-N	447.492	1.241	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)NCc1ccccc1CN1CC[C@@H](O)C1	781954202	LOJUUIQKQWQYKZ-MAUKXSAKSA-N	430.480	1.690	50	20	IDGD	
CC(=O)N1CCN(Cc2ccccc2NC(=O)NNC(=O)COc2ccccc2F)CC1	782077495	MHOWRQPZCNMWPC-UHFFFAOYSA-N	443.479	1.722	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ncncc2Cl)cc1	782158679	HHUFHKMKITXAAC-UHFFFAOYSA-N	426.886	1.242	50	20	IDGD	
O=C(NNc1ccc(-n2cccn2)nn1)C(=O)Nc1ccc(OCCc2ccccc2)nc1	783432576	AMVKISKREZVYLO-UHFFFAOYSA-N	444.455	1.761	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)C(=O)Nc1c(F)cc(F)cc1F	784213433	NBHLUHVDTJAAQD-UHFFFAOYSA-N	428.392	1.626	50	20	IDGD	
COC[C@H](C)NS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ncccc2Cl)cc1	784815966	HSGMYDRORQAFFK-NSHDSACASA-N	441.897	1.130	50	20	IDGD	
CCCNS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2cc(F)c(F)cc2F)cc1	784895137	FCKYMRCDIDEVGD-UHFFFAOYSA-N	430.408	1.874	50	20	IDGD	
C[C@@H](OC(=O)/C(C#N)=C/C1CC1)C(=O)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1	786680079	GNBPOICCTDHYCH-RGHBXIHOSA-N	433.486	1.438	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cn(C)nc2-c2ccoc2)cc1OC	789264662	OPMMGAFHSBGAJB-UHFFFAOYSA-N	428.401	1.315	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)C(=O)Nc1nc2c(s1)CCCCCC2	789732082	LMPGWIJSIHDKOY-UHFFFAOYSA-N	447.473	1.875	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)c1cc(S(=O)(=O)N(C)C)ccc1F	794717011	WGGKWRXXERSUFH-UHFFFAOYSA-N	429.857	1.813	50	20	IDGD	
CCC(=NNC(=O)[C@@H](C)CN1CCOCC1)c1ccc(Cl)c(S(=O)(=O)NC)c1	794851181	PJHFFQQNHOTRDA-ZDUSSCGKSA-N	430.958	1.447	50	20	IDGD	
CCOc1ccccc1C(=O)NCCCC(=O)NNc1ccccc1S(=O)(=O)N(C)C	795168002	FBZZYAGXEWXMHP-UHFFFAOYSA-N	448.545	1.989	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)[C@H]2CCc3cc(C)ccc3O2)cc1OC	796296224	BMUPXLRKAQGIAS-GOSISDBHSA-N	428.441	1.710	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c(OC)c(C)c1OC	796990807	FBYQGLCUUXZILQ-UHFFFAOYSA-N	432.389	1.329	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNC(=O)C(=O)Nc1ccc(C(F)(F)F)nc1	797368379	AQRFGAUCCHWSSI-UHFFFAOYSA-N	439.350	1.113	50	20	IDGD	
CC(=NNC(=O)N[C@H]1CCS(=O)(=O)C1)c1c[nH]c2ccc(Br)cc2c1=O	799877129	NVQLHSOCCJZHFE-NSHDSACASA-N	441.307	1.501	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)c2nnn(CCOc3ccc(F)cc3)c2C)c1O	800328007	DNUTUZRSQWOZOG-UHFFFAOYSA-N	429.408	1.594	50	20	IDGD	
O=C(NNC(=O)C(=O)Nc1ccccn1)N[C@H]1COc2cc(F)c(Br)cc21	800748557	ZCZNIUJJONLSNC-NSHDSACASA-N	438.213	1.386	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)c1ccc(S(C)(=O)=O)c([N+](=O)[O-])c1	801196465	VEFPQUBUWHUSQD-UHFFFAOYSA-N	443.459	1.167	50	20	IDGD	
CC(C)CSc1ccc(S(=O)(=O)NCC(=O)NNc2cccnn2)cc1[N+](=O)[O-]	802547769	FJQYFFDFABVHEP-UHFFFAOYSA-N	440.507	1.555	50	20	IDGD	
C[C@@H]1CCCN(S(=O)(=O)c2cc(C(=O)NNc3ccc(-n4ccnc4)nn3)n(C)c2)C1	804958916	RXEGPHNIXFZPHQ-CQSZACIVSA-N	444.521	1.178	50	20	IDGD	
COCCNC(=O)c1cccc(NC(=O)C(=O)NNc2ccc(C(F)(F)F)cn2)c1	806984228	HBMZBJYOMFSREV-UHFFFAOYSA-N	425.367	1.558	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)C(=O)N1CCc2cc(Br)cc(F)c21	807428258	BHDVGOOOAIJGFF-UHFFFAOYSA-N	446.240	1.596	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1	807429253	QGXIYDSLPAEKSG-UHFFFAOYSA-N	447.209	1.415	50	20	IDGD	
CCCS(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)c2ccc(Cl)cc2O)cc1	808079518	ILDXAYDVSNFQLO-UHFFFAOYSA-N	432.907	1.853	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)CNS(=O)(=O)c2c(C)c(C)cc(C)c2C)c1O	810191105	ODTWDJWGENVAMO-UHFFFAOYSA-N	435.502	1.374	50	20	IDGD	
Cc1nsc(N2CCN(C(=O)NNC(=O)c3cc(Br)c[nH]3)CC2)c1C#N	811852901	XGCGDLGMUZUTOS-UHFFFAOYSA-N	438.311	1.590	50	20	IDGD	
COc1cc(C=NNC(=O)COc2ccccc2O)ccc1OCC(=O)N1CCOCC1	814951540	IRPPUYKORIOPGM-UHFFFAOYSA-N	443.456	1.168	50	20	IDGD	
CCOC(=O)c1cc(COC)cc(NC(=O)C(=O)NNc2cccc(S(C)(=O)=O)c2)c1	815559028	VKUSUFWMKXQDCD-UHFFFAOYSA-N	449.485	1.495	50	20	IDGD	
CC(=O)N1CCN(Cc2ccccc2NC(=O)C(=O)NNc2cccc(Cl)n2)CC1	815728470	DYFPLJJCRNMSPL-UHFFFAOYSA-N	430.896	1.481	50	20	IDGD	
Cc1ccc(C(=O)N2C[C@@H](C)C[C@@H](C)C2)cc1NC(=O)C(=O)NNC(=O)[C@H]1CCCO1	815778946	KTLDWQHQKUDIOK-QWQRMKEZSA-N	430.505	1.378	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)N2CCS(=O)(=NS(C)(=O)=O)CC2)c(C)n1CC(C)C	816716083	WGEGFGIDRAPARB-WQRHYEAKSA-N	440.591	1.938	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)/C(=C\c2cccc(F)c2)n2nnnc2C)cc1	818195335	UIKYEHWMUMGCHB-WOJGMQOQSA-N	438.419	1.432	50	20	IDGD	
COc1ccc([C@@]2(C)NC(=O)N(NC(=O)/C(C#N)=C\c3cc(C#N)n(C)c3C)C2=O)cc1	906491628	JYXXNNBLSOLJLE-JBOCTPFWSA-N	432.440	1.619	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2cc3c(s2)CCCCC3)cc1	913404316	WPTDMPCLRVCRFO-UHFFFAOYSA-N	449.554	1.959	50	20	IDGD	
CCOc1ccc(NC(=S)NNC(=O)C2CCN(c3ccc4nnnn4n3)CC2)cc1	913479010	GZSKAMSLGFKGSC-UHFFFAOYSA-N	441.521	1.152	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)[C@H]2CC(=O)N(c3ccccc3)C2)c2ccccc2c1=O	914728140	GQAVXXXINQUHAG-HNNXBMFYSA-N	433.468	1.621	50	20	IDGD	
CCOc1ccccc1C(=O)N1CCC[C@H]1C(=O)OCC(=O)NNC(=O)c1cccs1	915007338	NDFGBCAPAUHJDP-HNNXBMFYSA-N	445.497	1.756	50	20	IDGD	
COCCN(CCOC)S(=O)(=O)c1ccc(C(=O)NNC(=O)c2ccccc2)cc1	916031863	HRVILUKTFNWTEZ-UHFFFAOYSA-N	435.502	1.045	50	20	IDGD	
O=C(NNC(=O)c1c[nH]nc1-c1ccncc1)c1ccc(S(=O)(=O)N2CCCC2)cc1	916145187	CKRMHRNFOPHFHP-UHFFFAOYSA-N	440.485	1.331	50	20	IDGD	
O=C(NCCCN1C(=O)NC2(CCCCC2)C1=O)NNC(=O)c1cc2c(s1)CCC2	916268716	IOTBNVWHAWBHMW-UHFFFAOYSA-N	433.534	1.826	50	20	IDGD	
O=C(Cc1ccc2ccccc2c1)NNC(=O)NCCNS(=O)(=O)c1ccccc1	916294075	WEUIPITZAIKLJZ-UHFFFAOYSA-N	426.498	1.691	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)NCc2ccc(S(=O)(=O)N(C)C)cc2)c1C	916646709	JILXTTWFLPZWTJ-MRXNPFEDSA-N	448.545	1.852	50	20	IDGD	
CCN(CCCNC(=O)NNC(=O)COc1cc(C)ccc1C(C)C)S(C)(=O)=O	918119348	SXKAVOPHLCYHOO-UHFFFAOYSA-N	428.555	1.499	50	20	IDGD	
CCCCNC(=O)NNC(=O)c1ccc(Cl)c(S(=O)(=O)NC[C@@H]2CCCO2)c1	920764883	QTENBMPPCBBRSW-ZDUSSCGKSA-N	432.930	1.541	50	20	IDGD	
CSCC[C@H](NC(=O)c1ccc([N+](=O)[O-])o1)C(=O)NNC(=O)NCc1ccco1	920856007	XKZBXLWNYVRSKG-NSHDSACASA-N	425.423	1.163	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)CNC(=O)c2ccc(F)cc2F)CC1	1318671264	JHWYGGRRKQIHDZ-UHFFFAOYSA-N	440.447	1.489	50	20	IDGD	
O=C(NNC(=O)c1ccccc1Cl)c1ccc(F)c(S(=O)(=O)Cc2ncon2)c1	1318721515	SJUMPLLUZUAWTK-UHFFFAOYSA-N	438.824	1.911	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)NCc1c(F)cccc1NS(C)(=O)=O	1319548595	MXEKVBCFLSVIJA-UHFFFAOYSA-N	434.453	1.298	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)NC[C@H]3CCOC3)c2)cc1	1323296460	HASYVAOXLHDCDJ-CQSZACIVSA-N	448.501	1.477	50	20	IDGD	
Cc1ccc(C)n1-c1ccc(C(=O)NNC(=O)NCCCN2C(=O)NC(C)(C)C2=O)cc1	1347996701	YZBRSZXGFWPKHV-UHFFFAOYSA-N	440.504	1.759	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(-c4ccccn4)[nH]n3)C2)C1	1779632290	ZOKRKRIWSIBGHW-BFUOFWGJSA-N	448.321	1.699	50	20	IDGD	
CCS(=O)(=O)CC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@](C)(Cl)CCl)C1	1780705822	AELXODOZPIAICK-XOKHGSTOSA-N	443.393	1.171	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CNC(=O)OC)C2	1781903891	GLUVJUYZSZHCLQ-OGHNNQOOSA-N	434.331	1.030	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CC1(O)CCC1)C2	1781904366	QCDDUQPRAMUCMY-IIDMSEBBSA-N	431.371	1.979	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnn3ccccc13)C2	1782172745	MKMZHEZRXSOZKU-HGHGUNKESA-N	434.924	1.716	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cn(C)nc1C(F)F)C2	1782173186	ZPZMNUQQRPHDDC-PJIJBLCYSA-N	448.898	1.739	50	20	IDGD	
Cc1nccn1[C@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Br)C2	1782626180	IVCVIOZXMZSPDH-SCFUHWHPSA-N	445.333	1.957	50	20	IDGD	
CN(C)[C@H](C(=O)N1CC[C@@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1)c1ccc(Cl)cc1	1782820626	MQYYQSFFUDNDKH-UWVAXJGDSA-N	444.359	1.372	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)CN3CCSCC3)CCO2)C1	1783339541	SLNDANBGGFGQQS-WMLDXEAASA-N	434.400	1.039	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(C(C)=O)[nH]n3)CCO2)C1	1783343438	IYTXZRSGTHVFSR-SJCJKPOMSA-N	427.299	1.229	50	20	IDGD	
CCOC(=O)C1(C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](Br)CC)C3)C2)CC1	1783355853	YQYDEHAHZAOWGN-DYVFJYSZSA-N	431.327	1.333	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](C)Br)C3)C2)o1	1783533749	GVPHXNMSNAPOPK-PIGZYNQJSA-N	428.283	1.465	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H]1CCc3ccccc3O1)CCO2	1783539241	GYVZSZIPBAMJQA-NQYLQCIDSA-N	437.334	1.994	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cc(O)nc4ccccc34)CCO2)C1	1783875167	OIISYECQWLQRMK-IIBYNOLFSA-N	433.892	1.638	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)Cc3ccc(C(=O)OC)cc3)C2)C1	1784162272	YUXJVHHIKVSAQW-LAUBAEHRSA-N	438.908	1.099	50	20	IDGD	
Cc1nc(N)sc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)CBr)C[C@@H]21	1786916677	WCNNZZWYQQSBHI-BQUFFADESA-N	445.383	1.658	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3cnn(C)c3)[C@H]2C1	1787012429	MHKNLEVIWDQDQA-QAETUUGQSA-N	441.370	1.506	50	20	IDGD	
COc1ccc2nc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)[C@@H](O)CCl)C[C@@H]43)ccc2c1	1787977699	WTNQRHYEJFMPHD-QHERXFFYSA-N	447.919	1.436	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccncc3O)[C@H]2C1	1788823442	AKGMCPVQIYTILZ-DSPQJCBJSA-N	426.311	1.412	50	20	IDGD	
C/C(=C/C(=O)NC1(c2ccc(NC(=O)c3cnccc3C(=O)NN)cc2)CCC1)C(=O)O	1789523755	UVBAJCJWKUEMOI-QBFSEMIESA-N	437.456	1.464	50	20	IDGD	
C=C(CC(=O)OCC)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](Br)CC)C[C@@H]21	1789891621	KDBDXDKBWLMQGO-JONQDZQNSA-N	445.354	1.649	50	20	IDGD	
CCC[C@H](NC(C)=O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](Br)CC)[C@H]2C1	1790963256	ARRUPZVZMLKXLP-KSWRQPAISA-N	446.386	1.444	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(F)ccc3OC)[C@H]2C1	1791954859	MFFWTLRVWVSTLK-RPZXMPESSA-N	428.888	1.681	50	20	IDGD	
C[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2	1792759097	HTSRUEYTOHBPNM-XPCVCDNBSA-N	448.358	1.274	50	20	IDGD	
COc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)CBr)C3)s1	1794329110	QUYCJBKSILPRCK-MCYUEQNJSA-N	431.352	1.991	50	20	IDGD	
CS(=O)(=O)c1cncc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CCBr)c1	1795491166	UZWBZDNJQRVEDX-BTTYYORXSA-N	444.351	1.522	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CC[C@H](N)C(N)=O	1796087356	WRBCIPRZUUJPJP-ZPLALWFASA-N	445.470	1.103	50	20	IDGD	
C=C(Oc1ccccc1O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2	1796432347	RJJVMSQICZODTI-VZAMPYOESA-N	443.269	1.565	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@]1(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](F)Cl)CCOC1	1796812189	YKICAYNXPPKZOP-ZRKYPZEGSA-N	433.908	1.843	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cc1cc(C)[nH]n1)C2	1796891895	NJJHQDZXVYLMJK-YVLAOCGESA-N	425.493	1.033	50	20	IDGD	
Cc1nc[nH]c1CSCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@](C)(Cl)CCl)C2	1797663698	CACFEGNQPKACEC-VLWCASSMSA-N	449.404	1.777	50	20	IDGD	
Cn1c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Cl)C3)cc2c[nH]c3nccc-3c21	1798482535	PXASBPPWQAVLBU-DJZPMSPPSA-N	433.871	1.744	50	20	IDGD	
Cc1ccc(O)c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)CBr)C3)c1	1798839747	XRVRJWWESFOYNM-ZJOBFFGXSA-N	425.323	1.935	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1csc3c1CCCO3)C2)[C@@H](F)Br	1799346698	WVOWGEGMECINRE-RDBQEKCUSA-N	447.326	1.967	50	20	IDGD	
CN1CCC[C@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C#N)=C/c1ccc(F)cc1F	1800332200	GUJIFCHKVMCHMB-NWLQTXJVSA-N	444.482	1.556	50	20	IDGD	
COC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C#N)=C/c1ccc(F)cc1F	1800332375	FFNIUKVKAISXGV-JXOOJLASSA-N	447.438	1.415	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(C)c(NC(C)=O)c1)C2	1800976887	CMCKBZUQQAWAFS-SFNKJDCFSA-N	437.924	1.410	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(-c3ncc[nH]3)cc1)C2	1800982346	DPKPYWMMGRJRHW-XMTFNYHQSA-N	432.908	1.534	50	20	IDGD	
Cc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C(Cl)Cl)c(-n2nccn2)c1	1801016396	IOANGFUKRAPABY-YWVIFJGQSA-N	438.315	1.583	50	20	IDGD	
Cc1ccc(=O)n(C(C)(C)C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](C)Br)n1	1801963426	JMFPYECWMWKJGE-XQLPTFJDSA-N	439.354	1.708	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H]2CCc3nc[nH]c3C2)[C@@H]1c1cccnc1)[C@H](O)CCl	1803147119	TUIZXYHFWVTUGC-ALQDCCJHSA-N	431.924	1.215	50	20	IDGD	
Cc1ccc(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)cn1	1805453567	CGYJIUZKGQKUAS-DENIHFKCSA-N	444.300	1.098	50	20	IDGD	
Cc1ccc(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)cn1	1805453575	CGYJIUZKGQKUAS-UGKGYDQZSA-N	444.300	1.098	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)CC2CCCC2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1	1807371561	WZEHDWOOKWAIJA-NFBKMPQASA-N	435.333	1.661	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)[C@H]2CC=CCC2)[C@H]1c1cccnc1	1808147778	LQRQSEMEHOUECY-LQBOVUBWSA-N	427.549	1.817	50	20	IDGD	
Cn1ncnc1C(=O)N1CC[C@H](CNC(=O)[C@H](F)Br)[C@@H]1c1cccnc1	1808650889	GZHOZAFMCSGDEQ-AGIUHOORSA-N	425.262	1.220	50	20	IDGD	
CN1CCC[C@H]1C(=O)N1CC[C@H](CNC(=O)[C@H](F)Br)[C@@H]1c1cccnc1	1808652654	YWHQOSJVPHOMEL-UGUYLWEFSA-N	427.318	1.872	50	20	IDGD	
Cc1cc(C(=O)N2CCC3(CCCN(C(=O)c4ccc(B(O)O)cc4)C3)CC2)ccc1F	1809969307	CGHZTFOKOAHCGV-UHFFFAOYSA-N	438.308	1.973	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1CCN(C(=O)c2cnc(O)nc2O)[C@H]1c1cccnc1	1810540587	FQNDBKLXGYQFSA-YOEHRIQHSA-N	445.552	1.454	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2cc(C(=O)O)ncn2)[C@@H]1c1cccnc1	1813029828	YXQVUDXALMDDKS-JKIFEVAISA-N	447.879	1.143	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)Cn2cncn2)[C@@H]1c1cccnc1	1813030514	CWWAEQGEVPJESM-LEUOFYLZSA-N	434.928	1.269	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)C(F)(F)C(F)F)[C@@H]1c1cccnc1	1813068430	MLGMWZPAXFDFDJ-XJKSGUPXSA-N	447.433	1.361	50	20	IDGD	
Cc1cnc(C(=O)N2CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)s1	1813070585	JYRXBRVQQRASIF-LPHOPBHVSA-N	444.561	1.539	50	20	IDGD	
O=C1COc2ccc(C(=O)N3CCCC[C@@H]3c3cc(NC(=O)[C@H](O)CCl)n[nH]3)cc2N1	1814873325	PIYWGRNUAKCSEN-HUUCEWRRSA-N	447.879	1.646	50	20	IDGD	
Cc1noc(C)c1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1816402324	VUVRXASWILERGC-QGZVFWFLSA-N	437.265	1.314	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](C)[C@H]3SC(=N)NC3=O)sc2C1	1817249522	DZZLWUXHUMXOKJ-KZFFXBSXSA-N	443.982	1.875	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cncs2)[nH]n1)c1cccc(B(O)O)c1	1817473377	QFCACCKQJMKKCG-OAHLLOKOSA-N	425.279	1.166	50	20	IDGD	
Cc1cscc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2	1817568606	PTADJVGLIVUBOU-CQSZACIVSA-N	441.343	1.732	50	20	IDGD	
Cn1cc(F)cc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1818385015	GUGYGOVJPPGENB-QGZVFWFLSA-N	439.256	1.187	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cn4ncccc4n3)sc2C1	1818466504	QVTUIZOGXRJQJW-MNOVXSKESA-N	434.909	1.665	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CC[C@@H](N)C(N)=O)[nH]n1	1820864508	BUTQAEGWWGMLFE-HSOHIQCKSA-N	433.340	1.231	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)CCn2ccnn2)[nH]n1)[C@@H](F)Br	1820937117	KWIAHETZJQLNFN-SMDDNHRTSA-N	428.266	1.774	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(C#N)cc2)[nH]n1	1822414746	LGMVDDXNWLICSC-GOSISDBHSA-N	437.504	1.960	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(O)c(F)c2)[nH]n1	1822415988	VYSQGWNQTYRXCJ-MRXNPFEDSA-N	446.483	1.933	50	20	IDGD	
COCCn1ccc(C(=O)N[C@H]2CCc3nc(NC(=O)[C@@H](Cl)COC)sc3C2)n1	1825997854	DDVGWROIIVFEDQ-RYUDHWBXSA-N	441.941	1.466	50	20	IDGD	
Cc1cc(C(=O)N[C@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)cc(O)n1	1826086253	OKDQOCKLFNYMOA-ZDUSSCGKSA-N	446.533	1.151	50	20	IDGD	
CC(C)(CCl)C(=O)N[C@H]1CCc2nc(NC(=O)CNC(=O)C(F)(F)F)sc2C1	1826139432	QSOZGEYIFZEZLL-QMMMGPOBSA-N	440.875	1.999	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC([C@H]2CCCCN2C(=O)CN2CCN(C)CC2)CC1	1828444731	YLBGBFFOUXWJPM-FUHWJXTLSA-N	443.430	1.637	50	20	IDGD	
C=CCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCN2C(=O)OCc1ccccc1	1828551978	YLTSHQAEMJHEIF-XMSQKQJNSA-N	449.935	1.614	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(C#N)c[nH]2)CC1	1829778610	MPUIYKVBZZANMR-LJQANCHMSA-N	428.537	1.493	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H](C)NS(=O)(=O)CC)CC1	1830302877	JXNLGYOGCPKBCC-PVAVHDDUSA-N	436.018	1.951	50	20	IDGD	
O=C(CN1CCCC1=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](F)Br)CC1	1830374589	IZPFDCJXSLXLLJ-WMLDXEAASA-N	432.334	1.919	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3nccs3)C2)C1	1830537084	BFNGRCBQGBSRCQ-LRDDRELGSA-N	432.340	1.244	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3C[C@]3(F)Cl)C2)C1	1830543819	DSUARFABGFSCRP-NOXHYTERSA-N	441.725	1.398	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(OC)n3)C2)C1	1831644487	YPWGWUKOBIUPET-MGPUTAFESA-N	425.913	1.568	50	20	IDGD	
CCN1CCC(C(=O)N2CCC([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)CC1	1831876355	FMRHVFRIDKYEHH-OAQYLSRUSA-N	449.640	1.711	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)/C=C/c3ccsc3)CCO2)C1	1833142819	QJIOZMFXJBDWLY-IOWAXEIUSA-N	428.938	1.472	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3ccncc3Cl)CC2)CC1)[C@H](O)CCl	1833311683	AACJUYKXABIJHS-QGZVFWFLSA-N	429.348	1.520	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1)c1cc(O)ncn1	1833553100	QOMXCNYRGSSLTR-UHFFFAOYSA-N	440.342	1.152	50	20	IDGD	
Cc1noc(C)c1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)Br)C2)C1	1834067912	AHJXYPROEHKGBY-PIGZYNQJSA-N	430.299	1.145	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1)c1cccc(O)n1	1834198325	NCSHMCYYCAZCCW-UHFFFAOYSA-N	439.354	1.757	50	20	IDGD	
Cc1nc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)cs1	1834456945	FKEAYUAKQASGPF-IRXDYDNUSA-N	436.361	1.758	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)C3(C#N)CC3)CC2)CC1	1834599628	PATVCEMFNWBMLN-AWEZNQCLSA-N	425.371	1.893	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(F)c(C)c3N)CCO2)C1	1835873166	NQKFCESQGBCRJZ-QRWLVFNGSA-N	427.904	1.804	50	20	IDGD	
CCc1ccnc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)c1	1836359980	MXTLGKJCVIDHMW-PMACEKPBSA-N	444.359	1.950	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)Cc3ccccn3)CC2)CC1)[C@@H](F)Br	1836412336	FLXUUUHHOAJAEN-GOSISDBHSA-N	441.345	1.886	50	20	IDGD	
C[C@@H](C(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1)n1cccc1C=O	1836716548	BELFDURXMPKCLY-HNAYVOBHSA-N	439.940	1.460	50	20	IDGD	
C[C@H](Nc1cccnc1)C(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836716556	BLPGNPQKTVDXKO-HNAYVOBHSA-N	438.956	1.480	50	20	IDGD	
Cc1noc(C)c1C(=O)N1CCC(OC2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1	1837439295	OJSNUJTWRKQUJA-UHFFFAOYSA-N	449.552	1.277	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(F)c(C)c3N)C2)C1	1839144305	UQFRARYCLHXLKI-YWZLYKJASA-N	427.904	1.804	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(C#N)ccc1F)CCO2	1839421532	WXIFJZZGTYTOCT-OAQYLSRUSA-N	449.555	1.619	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc4ccncc34)CCO2)C1	1839509087	KGBCGFPIANNPHX-DENIHFKCSA-N	447.919	1.559	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3nc(C)c(C)s3)C2)C1	1840154050	JJFDCYODJYGIID-KDOFPFPSSA-N	431.942	1.084	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@]2(C(=O)N3CC4(CCCN4C(=O)[C@@H](O)CCl)C3)C[C@H]2C1	1841353496	AHKMOCLQQVVCJT-GXZWQRSESA-N	441.956	1.437	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)CCCN2C(=O)c3ccccc3C2=O)C1	1841914731	VNFVIMHOERJNMT-QGZVFWFLSA-N	447.919	1.520	50	20	IDGD	
CN(CC(=O)N1CC2(CCCN2C(=O)c2cccnc2)C1)NC(=O)NCc1ccccc1	1842393401	ZFIMKQFUIJMOBH-UHFFFAOYSA-N	436.516	1.245	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CO)C(=O)N1CCCC12CN(C(=O)[C@](C)(Cl)CCl)C2	1843326048	PUIDDEDSQIKJPW-YVEFUNNKSA-N	438.352	1.312	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1cc(Cl)ncn1)C2	1843416371	ANJVOFANCALGAQ-WYMPLXKRSA-N	429.868	1.081	50	20	IDGD	
C[C@H](Br)C(=O)N1CC2(CCCN2C(=O)C2CN(C(=O)OC(C)(C)C)C2)C1	1843842497	YQLWGOZSXIWYGD-LBPRGKRZSA-N	430.343	1.840	50	20	IDGD	
COC1(CC(=O)N2CCCC23CN(C(=O)[C@@H](F)Cl)C3)CN(C(=O)OC(C)(C)C)C1	1843847029	RKRQAJQSEPMFLE-CQSZACIVSA-N	433.908	1.750	50	20	IDGD	
C[C@@H](Sc1ccccc1)C(=O)N1CC2(CCCN2C(=O)c2cnccc2C(=O)NN)C1	1844263459	HGBJLUHHOJBAMR-OAHLLOKOSA-N	439.541	1.683	50	20	IDGD	
O=C([C@H](O)CCl)N1CC2(CCCN2C(=O)Cc2cc(Br)ccc2O)C1	1845149295	SPLKPBBTSDVZSD-CQSZACIVSA-N	431.714	1.500	50	20	IDGD	
O=C(c1cnc(O)[nH]1)N1CC2(CCCN2C(=O)[C@@H](Br)Cc2ccccc2)C1	1845941754	QWGOBZIMKMXSHI-AWEZNQCLSA-N	433.306	1.939	50	20	IDGD	
CCC(C)(C)C(=O)N1CCCC12CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2	1845988161	HANXGZJGQHCOFJ-UHFFFAOYSA-N	429.565	1.972	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)c1nc3ccc(C(F)(F)F)cn3n1)C2	1846361914	WNIXZOVNBQKSBQ-GFCCVEGCSA-N	445.829	1.819	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC2(CCCN2C(=O)[C@@H]2[C@H]3COC[C@H]32)C1	1846742738	OSPBSTJWSDLVNX-LJISPDSOSA-N	427.929	1.214	50	20	IDGD	
CC(C)(C)OC(=O)N1CC2(CC2)C[C@H]1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl	1847558325	KQAMBEOTZIZUQF-YHUYYLMFSA-N	441.956	1.578	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](O)CCl)C1	1847565176	KQCMWFXLFCPTRO-YHUYYLMFSA-N	429.945	1.435	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H]1CCN1C(=O)OC(C)(C)C	1847957152	BZDZSLVMJZBPDV-ZOBORPQBSA-N	430.343	1.981	50	20	IDGD	
COc1ccc2c(C)c(CCC(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)c(=O)oc2c1	27093907	WQSMMVPIZPHIJH-UHFFFAOYSA-N	448.439	1.480	50	20	IDGD	
Cn1ccnc1[C@@H](NC(=O)NNC(=O)CNC(=O)c1ccco1)c1ccc(Cl)cc1	725871538	DBWHBPPHDOMAHC-INIZCTEOSA-N	430.852	1.516	50	20	IDGD	
Cc1cccn2cc(CC(=O)NNC(=O)c3cccc(S(=O)(=O)N4CCCC4)c3)nc12	725879141	XYDFTQAMOJQCSH-UHFFFAOYSA-N	441.513	1.431	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)Cn1c(S)nnc1-c1ccc(Cl)cc1	725902032	FOCURXGCGAYNCF-UHFFFAOYSA-N	434.865	1.058	50	20	IDGD	
COCCCNC(=S)N(C)NC(=O)Cc1ccc(S(=O)(=O)N2CCCCC2)cc1	726075895	PTKHZJVAASTYLC-UHFFFAOYSA-N	442.607	1.278	50	20	IDGD	
COc1ccccc1N1C[C@@H](C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)CC1=O	726863344	OEUBKKQKRYMYMI-AWEZNQCLSA-N	444.513	1.632	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)CCNS(=O)(=O)c2ccc(F)cc2)cc1F	727499688	NQDVIBYKRRKAMN-UHFFFAOYSA-N	444.485	1.660	50	20	IDGD	
COc1ccccc1C(=O)N[C@@H](CCS(C)(=O)=O)C(=O)NNc1cc(C)cc(C)c1	728056458	WHVPJHRMXVAIOD-SFHVURJKSA-N	433.530	1.988	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NN=Cc1sc(N2CCOCC2)nc1-c1ccccc1	728437982	ZDMDSJPDVWCVMH-ZDUSSCGKSA-N	437.547	1.035	50	20	IDGD	
O=C(CCCNS(=O)(=O)c1cccc(C(F)(F)F)c1)NNC(=O)Cc1cccnc1	728892400	XXZCBHWMIZRMTM-UHFFFAOYSA-N	444.435	1.549	50	20	IDGD	
C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)C1	728949837	VSJBPBKOROAGTG-FXAWDEMLSA-N	437.548	1.859	50	20	IDGD	
O=C(CCCc1ccc2c(c1)CC(=O)N2)NNC(=O)c1csc(N2CCOCC2)n1	729300981	UVQUDXVTZFWUSY-UHFFFAOYSA-N	429.502	1.258	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(CCNC(=O)NNC(=O)Cn2ccc3ccccc32)CC1	729607647	STSNBBSDBTXCBG-UHFFFAOYSA-N	444.536	1.524	50	20	IDGD	
Cc1ccc(S(=O)(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c(F)c1	729663150	WMLUDMLUBDOGNO-UHFFFAOYSA-N	441.506	1.542	50	20	IDGD	
CN(C)c1ccc(NC(=S)NNC(=O)CCNS(=O)(=O)c2cccs2)cc1	729689280	QTJXPVCRVXLETH-UHFFFAOYSA-N	427.577	1.500	50	20	IDGD	
CC(=NNC(=O)CNc1ccccc1)c1cccc(N(S(C)(=O)=O)S(C)(=O)=O)c1	729818582	YJUCYWJGVBWDAH-UHFFFAOYSA-N	438.531	1.365	50	20	IDGD	
CCCn1c(S[C@@H](C)C(=O)NNC(=O)CC(C)C)nc2cc(S(N)(=O)=O)ccc21	731904897	UJVPRBFCMZGSQQ-LBPRGKRZSA-N	441.579	1.768	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)c2nc(NCc3ccco3)ncc2Cl)C[C@@H](C)O1	732263493	NJKYCOLUENFXDQ-CHWSQXEVSA-N	436.900	1.595	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)N[C@@H]2CCN(C3CCN(C)CC3)C2)cc1	734284065	PVFSAWHJZUKAOT-IAGOWNOFSA-N	433.553	1.352	50	20	IDGD	
O=C1CCc2cc(Br)c(S(=O)(=O)NNC(=O)NC3CCCC3)cc2N1	734807009	FVIOICVFIYJBAL-UHFFFAOYSA-N	431.312	1.769	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)COc1ccc(C#N)cc1)N1CCN(c2ccc(F)cc2)CC1	735460467	XOOWMJKKJRBNRS-INIZCTEOSA-N	425.464	1.434	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)NCc2ccc(C(=O)NNc3cccnn3)cc2)cc1	736704413	XSSULSDPUGHMMU-UHFFFAOYSA-N	425.470	1.915	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)c1cc([N+](=O)[O-])ccc1I	740851001	KTFMOZJSIBNMIE-UHFFFAOYSA-N	448.217	1.265	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)[C@@H](CC)N2CCCC2=O)c2ccccc2c1=O	741746062	KAJNAVMOHBCXRP-QGZVFWFLSA-N	427.505	1.749	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@@H](c2cccc(F)c2)N2CCOCC2)cc(OC)c1OC	741881349	MNLRVEOLUVWXRA-LJQANCHMSA-N	447.463	1.686	50	20	IDGD	
NC(=O)c1cc(S(=O)(=O)NCC(=O)NNc2c(Cl)cc(Cl)cc2Cl)c[nH]1	742239561	CGHJSJTWSXWZTO-UHFFFAOYSA-N	440.696	1.495	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)NCCCCN2CCN(C)CC2)cc1Cl	743537917	VEBSPQFFMJQYCU-UHFFFAOYSA-N	442.948	1.721	50	20	IDGD	
C[C@@H]1CCCC[C@@]12NC(=O)N(CC(=O)NNC(=O)Nc1ccc(OC(F)F)cc1)C2=O	743832638	XQYDXBVBCFPFLG-NSPYISDASA-N	439.419	1.941	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1ccn(-c2cccc(F)c2)n1	744620629	LQQJREUEKAEBRF-UHFFFAOYSA-N	445.476	1.789	50	20	IDGD	
C[C@@H](c1ccc([S@](C)=O)cc1)N(C)C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	747491352	UAKGIYVPGATPST-FZPQWHJUSA-N	427.490	1.447	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1	748633125	HMDWJEPMRREQRV-KBPBESRZSA-N	430.452	1.639	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2c(C)c3ccccc3oc2=O)cc1	750607664	XBKRUTGPGIBCKV-UHFFFAOYSA-N	443.481	1.492	50	20	IDGD	
COc1cc(OC)cc(N2C[C@H](C(=O)NNC(=O)c3cnn(-c4ccccc4)c3)CC2=O)c1	752312782	SYNGGGUJHVHAQV-OAHLLOKOSA-N	449.467	1.704	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccccc2CNC(=O)/C(C#N)=C/c2ccc(F)cc2)CC1	752407002	NBWYUMVOJHGPCQ-XMHGGMMESA-N	442.516	1.985	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NCc2ccc(C(N)=O)o2)c2ccccc2c1=O	753023430	WDLZAUKGJVXSKH-UHFFFAOYSA-N	426.433	1.033	50	20	IDGD	
CCOC(=O)c1ccc(N2CC(NC(=O)NNC(=O)Nc3ccc(N(C)C)cc3)C2)nc1	753278661	FMSWJVCVRHQMSM-UHFFFAOYSA-N	441.492	1.549	50	20	IDGD	
C[C@@H]1CC/C(=C/C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)C1	753573658	QOZXZFXAQMZYTR-BJYOTHFNSA-N	435.546	1.534	50	20	IDGD	
C#Cc1cccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c1	755603145	ILTLQICQEQHQQU-UHFFFAOYSA-N	428.470	1.155	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2cnn(-c3ccccn3)c2)cc1	756704477	FLZZGRXTABPRPY-UHFFFAOYSA-N	443.489	1.049	50	20	IDGD	
COCc1nc2n(n1)C[C@@H](NC(=O)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1)CC2	757789940	SVMBYZKFVJLVFU-NSHDSACASA-N	448.427	1.359	50	20	IDGD	
CC(=O)N1CC[C@H](NC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)c2ccccc21	757795015	NZCNNNIIBUHIKE-KRWDZBQOSA-N	445.501	1.924	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)c1cc(NCc2ccccc2)nc2ccccc12	758051124	FEBFTBFKICWVCD-CQSZACIVSA-N	441.513	1.546	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3ccc4c(c3)CCC(=O)N4C)CC2)cc1	759606547	QKDXPYGQBHWKEQ-UHFFFAOYSA-N	449.555	1.483	50	20	IDGD	
COc1ccc2c(c1)OC[C@@H]2CC(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	760613565	PCDCXJQZEVEVIV-ZDUSSCGKSA-N	429.385	1.474	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)/C=C/c1ccccc1)C(=O)NNc1ncc(F)cn1	760921240	UBDYFZGVFTYERT-TUPIDYKKSA-N	425.511	1.771	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)c1	761803435	UQYNJILFFVPYHL-SFHVURJKSA-N	444.513	1.225	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NCC2(c3ccc(F)cc3F)CC2)c2ccccc2c1=O	761815589	DJUQFVUIYIYEEF-UHFFFAOYSA-N	427.411	1.888	50	20	IDGD	
COc1ccc(C)cc1N1C[C@H](C(=O)NNc2nccc(N3CCOCC3)n2)CC1=O	762860670	GLPQHVBTUVECKA-OAHLLOKOSA-N	426.477	1.126	50	20	IDGD	
Cc1nn(CC(F)(F)F)cc1C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	763140453	HTKHUQVJODQEDV-UHFFFAOYSA-N	439.803	1.129	50	20	IDGD	
CC(=O)NCCc1ccc(S(=O)(=O)NNC(=O)CSc2ccccc2O)s1	763409773	JPNMGMSRLWQEND-UHFFFAOYSA-N	429.545	1.234	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccccc1C(=O)N1CCCCC1	763446613	VDDCIYLEAQOBHG-UHFFFAOYSA-N	439.428	1.621	50	20	IDGD	
COc1cc(OC)c(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1Cl	763570843	IUZLLHFNXLOEQR-MRXNPFEDSA-N	435.820	1.283	50	20	IDGD	
CC(C)(C)c1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(-n3cnnn3)c2)cc1	763596706	YOIWNLWVKHPXOG-UHFFFAOYSA-N	437.460	1.125	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)C(=O)Nc2ccc(C3CC3)cc2)cc1	763732190	DRPQQUCMCONQRT-UHFFFAOYSA-N	444.513	1.279	50	20	IDGD	
COC(=O)c1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccccc1F	763864443	JKMSOXLDHVCHOJ-SNVBAGLBSA-N	437.811	1.819	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3cccc(N4CCNC4=O)c3)cc2C1	763943911	VTWUFDBFKMYSCV-LBPRGKRZSA-N	441.513	1.802	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1cccc(C#Cc2ccccn2)c1	764003435	DDYSXCCPKIMMBA-UHFFFAOYSA-N	442.431	1.652	50	20	IDGD	
COC(=O)c1cc(F)c(F)cc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccccc2)on1	764003634	KIGMMELUYJCLGT-UHFFFAOYSA-N	444.350	1.806	50	20	IDGD	
Cn1ccnc1-c1csc(NC(=O)C(=O)NNC(=O)c2cccc(C(F)(F)F)c2)n1	764037671	SPLXWNRBDWRXAX-UHFFFAOYSA-N	438.391	1.962	50	20	IDGD	
COC(=O)c1c(NC(=O)C(=O)NNC(=O)c2cccc(OC)c2O)sc2c1CCCC2	764131130	NLEZVLXPEWFMLD-UHFFFAOYSA-N	447.469	1.527	50	20	IDGD	
CCOCCOc1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)[C@H]1Cc2ccccc2O1	764169418	VZVHKWJLSMKPPS-GOSISDBHSA-N	447.875	1.845	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(OCC(F)(F)C(F)F)nc2)cc1	764182438	MUPLAYGHEZMKBW-UHFFFAOYSA-N	439.325	1.632	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)c2c[nH]nc2C)sc2c1CCCCC2	764297408	RFDKBOOUEYBAGL-UHFFFAOYSA-N	433.490	1.625	50	20	IDGD	
Cc1ccc(C(=O)N2C[C@H](C)C[C@@H](C)C2)cc1NC(=O)C(=O)NNC(=O)c1c[nH]nc1C	764298164	PRPBIDLTPVGPSR-CHWSQXEVSA-N	440.504	1.544	50	20	IDGD	
Cc1cnn(Cc2cc(F)ccc2F)c1NC(=O)C(=O)NNC(=O)Cc1ccccc1F	764319818	TZJONYAIYURWFL-UHFFFAOYSA-N	445.401	1.986	50	20	IDGD	
CCOC(=O)N1[C@H](C(=O)NNC(=O)CNC(=O)c2cccnc2)CC[C@H]1c1ccc(C)o1	764345173	OQWJUWRVAJFWDL-HOTGVXAUSA-N	443.460	1.222	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCc2cnn(CC(F)(F)F)c2)nc1	764376283	UDEPCEHEPPVARP-UHFFFAOYSA-N	449.459	1.697	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1)C(=O)Nc1ccnn1Cc1ccccn1	764388486	SVYCPVNYIQONLW-UHFFFAOYSA-N	448.418	1.255	50	20	IDGD	
CN1CCN(c2ccccc2NC(=O)C(=O)NNC(=O)CSc2ccccc2O)CC1	764392967	BCFFYRVKDNXDBN-UHFFFAOYSA-N	443.529	1.022	50	20	IDGD	
COCCOc1ccc(C#N)cc1NC(=O)C(=O)NNC(=O)c1ccc(Cl)cc1F	764410648	LTAZREUKHPGZQO-UHFFFAOYSA-N	434.811	1.776	50	20	IDGD	
N#C[C@H](c1ccccc1)c1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2COCCO2)cc1Cl	764427436	ZSOIZPFLRJDDDS-AEFFLSMTSA-N	442.859	1.497	50	20	IDGD	
CN(C)c1cccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)n1	764724645	JMUKFBIAEBQNBE-UHFFFAOYSA-N	432.506	1.399	50	20	IDGD	
CCOC(=O)c1cnn2c(C(=O)NNC(=O)c3cc(-c4cccs4)[nH]n3)ccnc12	764753003	AEJNKHZAYIILNP-UHFFFAOYSA-N	425.430	1.432	50	20	IDGD	
COc1ccc2c(c1)C(=NNC(=O)CN1CCN(Cc3ccc(Cl)cc3)CC1)C(=O)N2	764828330	RCXGENRIUYOSAL-UHFFFAOYSA-N	441.919	1.939	50	20	IDGD	
CC(C)(C)OC(=O)NNC(=O)C(=O)Nc1cc(Br)ccc1N1CCOCC1	765391964	ZBMMMMWABOZBLA-UHFFFAOYSA-N	443.298	1.780	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)[C@@]3(O)CCSC3)c2)c(C)c1	765507378	JEUMUEMJIVWERP-HXUWFJFHSA-N	449.554	1.733	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)/C=C/c3cccs3)CC2)cc1	765727961	KDMIWCCXUOOJHT-RMKNXTFCSA-N	448.570	1.224	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1nc(Cl)ccc1Cl	765737673	HZALEAAQMUCZRL-UHFFFAOYSA-N	436.299	1.607	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3ccc(Cn4cccn4)o3)CC2)cc1	766642350	REAMCMDGDAFQDA-UHFFFAOYSA-N	436.516	1.412	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(N2C[C@H](C(=O)N3CC=C(C#N)CC3)CC2=O)cc1	767160442	QEVAKIDEIOJRTA-QGZVFWFLSA-N	430.530	1.752	50	20	IDGD	
CCc1ccccc1N1C[C@H](C(=O)OCC(=O)NNC(=O)Cc2ccccc2C)CC1=O	767268797	YAIXZVIKNDUOKS-LJQANCHMSA-N	437.496	1.844	50	20	IDGD	
CC1CCN(C(=O)C(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)CC1	767419719	HNTFFLAEVCFXHG-UHFFFAOYSA-N	447.495	1.464	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)CS(=O)(=O)NC2CCC(C)CC2)n[nH]1	768280615	BIBQPRGIRHDRHH-UHFFFAOYSA-N	449.533	1.344	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)c2ccc(S(C)(=O)=O)c(Br)c2)n1	769617412	QQHRLFOGRGPRQA-UHFFFAOYSA-N	429.296	1.127	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)c1ccc(S[C@H]2CCOC2=O)cc1	770644021	LJTLEMOOMCAZDX-HNNXBMFYSA-N	448.526	1.462	50	20	IDGD	
CC[C@@H](C(=O)NNc1nc(O)c2cnn(C)c2n1)n1nnc(-c2ccc(Cl)cc2)n1	770973633	NZCVUEONWXENKS-LBPRGKRZSA-N	428.844	1.470	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1cccc(S(=O)(=O)NCc2cccs2)c1	771901247	HOCUDNFPZBTWQZ-LBPRGKRZSA-N	439.515	1.329	50	20	IDGD	
CON(C)S(=O)(=O)c1cc(C(=O)O[C@H](C)C(=O)NNC(=O)CC(C)C)ccc1Cl	771955623	WITQDQPCKNWMRA-LLVKDONJSA-N	449.913	1.261	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)N[C@H](c1ccc(F)c(Cl)c1)C(F)(F)F	772628406	MVKLLSFJCHCYNT-LHLIQPBNSA-N	434.799	1.351	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3ccn(Cc4ccccc4)n3)CC2)cc1	773390679	AJQWKJQFGZNOGY-UHFFFAOYSA-N	446.555	1.819	50	20	IDGD	
O=C(Cc1ccccn1)NNC(=O)C(=O)Nc1cccc2cncc(Br)c12	773548272	WMINTFYSYKRNHC-UHFFFAOYSA-N	428.246	1.721	50	20	IDGD	
CS(=O)(=O)Nc1ccc(OCCNC(=O)NNC(=O)c2cc3ccccc3o2)cc1	773601475	VASJEBHJGPAXOS-UHFFFAOYSA-N	432.458	1.827	50	20	IDGD	
CN1CCC/C1=N/S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2cccc(C#N)c2)cc1	773688309	IIZIOZSWTPRWNF-BWAHOGKJSA-N	440.485	1.453	50	20	IDGD	
COCCOc1ncccc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1cccc(Cl)c1	774009615	RKQLQXLHSRGZHK-LBPRGKRZSA-N	436.852	1.314	50	20	IDGD	
CC(C)(C)CC(=O)N1CCC[C@H]1C(=O)N1CCN(S(=O)(=O)CBr)CC1	777833265	WDGBIOWTBVVNDM-ZDUSSCGKSA-N	438.388	1.240	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)[C@H](C)n2nnnc2C(C)(C)C)c2ccccc2c1=O	777840832	MZVZRGZVCQXUFM-LBPRGKRZSA-N	426.481	1.113	50	20	IDGD	
Cc1c(Br)ccc(N)c1C(=O)OCC(=O)NNC(=O)c1cccc(C#N)c1	778352676	XKNJTFXRZMCPQM-UHFFFAOYSA-N	431.246	1.829	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cnn([C@@H](C)C3CC3)c2)cc1	778708343	YXRXDRHVKFJUJA-KBPBESRZSA-N	429.477	1.806	50	20	IDGD	
COc1ccc(Cn2cc(C(=O)NNc3nccc(N4CCOCC4)n3)cn2)cc1OC	779390728	BAJTYWMAKBZXNR-UHFFFAOYSA-N	439.476	1.332	50	20	IDGD	
O=C(CCCOc1ccc(Cl)cc1Cl)NNC(=O)NCCNC(=O)c1cc[nH]n1	780877068	IHNSNGYSQWUIDC-UHFFFAOYSA-N	443.291	1.636	50	20	IDGD	
CC(C)[C@@H]1C[C@@H](CC(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)CCO1	781708535	DSYLVHASKVTESJ-ICSRJNTNSA-N	430.549	1.433	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C(=O)Nc2ccnn2CCc2ccccc2)nc2ccccc21	782885729	HKSCUZYTKKOWAZ-UHFFFAOYSA-N	445.483	1.341	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)C(=O)Nc1cccc(Cl)c1F	782896342	FXPSHJRDPSIQAS-UHFFFAOYSA-N	427.845	1.172	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)cc1	784215492	JQCNEPSXCGDARD-UHFFFAOYSA-N	448.501	1.234	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)C(=O)Nc2ccc(N3CCCC3=O)c(F)c2)c1	784841145	FIAQTFFKVXXSOH-UHFFFAOYSA-N	434.449	1.438	50	20	IDGD	
CS(=O)(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)ccc1Cl	788333893	QGRWQZIZCAFXMZ-UHFFFAOYSA-N	446.268	1.502	50	20	IDGD	
CCOC[C@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)C(C)C	788875877	HAXOTIRVCQCBFQ-SFHVURJKSA-N	440.566	1.866	50	20	IDGD	
CC(=O)NCCCCCC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	790771473	HFBYYJXPMDAXTJ-UHFFFAOYSA-N	438.550	1.319	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NC[C@H]2CCCN(C(C)=O)C2)c2ccccc2c1=O	793310243	YKNRDZXRRJYDRM-MRXNPFEDSA-N	442.520	1.399	50	20	IDGD	
N#Cc1cccc(C(=O)NNS(=O)(=O)c2cc(Br)c(F)cc2[N+](=O)[O-])c1	795313681	GRVKOCIQTJRLRR-UHFFFAOYSA-N	443.210	1.991	50	20	IDGD	
CN(C(=O)OC(C)(C)C)[C@@H](C(=O)NNC(=O)NCCc1cccs1)c1cnn(C)c1	795588338	NZTFWJAFJRYIAF-OAHLLOKOSA-N	436.538	1.963	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(OC)c(OC)c(C)c2OC)cc1OC	796991229	BCBFZZXSZAHOCK-UHFFFAOYSA-N	447.444	1.438	50	20	IDGD	
C=C(C)[C@H]1OCC[C@H]1CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	798117290	WXRGZZAHALYRIL-FUHWJXTLSA-N	436.534	1.396	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNS(=O)(=O)c1cc(NC(C)=O)ccc1OC	798164242	HYFACIPRDCAQEB-UHFFFAOYSA-N	427.866	1.939	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CCN2CCN(C(=O)OC(C)(C)C)CC2)cc1C	798307404	SGXOCINDNDIMPN-UHFFFAOYSA-N	447.536	1.332	50	20	IDGD	
CSC[C@H](C)C(=O)N1CCC(C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)CC1	799539187	DFDLDUSBLYYLMD-AWEZNQCLSA-N	446.529	1.100	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C2(c3ccc(I)cc3)CC2)n1	800380334	PMQYSOSPBXBCCQ-UHFFFAOYSA-N	438.269	1.984	50	20	IDGD	
Cc1c(C(=O)NNc2nc3ccccc3c(=O)n2C)nnn1CCOc1ccc(F)cc1	800492897	GUGUUALZFUYCGM-UHFFFAOYSA-N	437.435	1.808	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)c2ccc(S(N)(=O)=O)cc2F)c(OC)cc1Cl	802081397	OELOAKQDVGOGFN-UHFFFAOYSA-N	446.844	1.610	50	20	IDGD	
C[C@@H]1CC(C)(C)C[C@]2(C1)NC(=O)N(CC(=O)NNC(=O)Nc1ccc3c(c1)OCO3)C2=O	802100870	AVWFDIZBGPJHMZ-GTJPDFRWSA-N	445.476	1.705	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)N[C@H]1CCCN(C(=O)Cc2ccccc2)C1	802475208	DXNNSRUDKJEJKF-SFHVURJKSA-N	428.464	1.769	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)C[C@H]2COCCN2C(=O)OC(C)(C)C)cc1	803949297	ZLYSLYJSDDZMLJ-INIZCTEOSA-N	435.477	1.325	50	20	IDGD	
O=C(NCCNC(=O)c1cc[nH]n1)NNc1ccc(-c2cccc(C(F)(F)F)c2)nn1	805273794	ZIMCZWJMEZHJQV-UHFFFAOYSA-N	434.382	1.942	50	20	IDGD	
CNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)Cc2ccsc2)c1Br	806976909	OFESEMVIAYCOKJ-UHFFFAOYSA-N	439.291	1.199	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C2(S(=O)(=O)c3ccccc3)CCOCC2)c(OC)c1	808373973	YMIOXEVNTZDDJN-UHFFFAOYSA-N	448.497	1.488	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(C(=O)NNC(=S)Nc2cc(C)ccc2C)cc1	811256235	FYIGJAATXHICAV-UHFFFAOYSA-N	436.559	1.860	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCc2ccc3cnn(C)c3c2)cc1	813176494	XGYSHFRROXQGLA-UHFFFAOYSA-N	444.517	1.033	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2cc(F)cc(Br)c2N)n1	815249827	PMQFPSKSXRNSLZ-UHFFFAOYSA-N	445.270	1.482	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCc2nncn2C1)c1cc([N+](=O)[O-])ccc1NCc1ccccc1	816879226	KKDGNJRUNIRWMG-HNNXBMFYSA-N	435.444	1.822	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)CNS(=O)(=O)c2ccc(C)cc2)cc1	912839828	BEHFLNGKTCPGTC-OAHLLOKOSA-N	435.502	1.287	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)CNS(=O)(=O)c2c(C)c(C)cc(C)c2C)cc1	913429638	OUUMHDKPBNRPAW-UHFFFAOYSA-N	448.545	1.467	50	20	IDGD	
C=CCNC(=S)NNC(=O)c1cccc(S(=O)(=O)NCc2ccc3c(c2)OCO3)c1	913435776	QVDKPCCKTDDXGS-UHFFFAOYSA-N	448.526	1.189	50	20	IDGD	
COc1ccccc1NC(=S)NNC(=O)CNC(=O)c1cc(OC)c(OC)c(OC)c1	913441028	RHHHHQMEYOAELD-UHFFFAOYSA-N	448.501	1.469	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)[C@H](Cc1ccc(F)cc1)n1nnnc1C	915684805	GKELPRAZGBKKKB-KRWDZBQOSA-N	442.451	1.530	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)[C@H](Cc2ccc(F)cc2)n2nnnc2C)cc1OC	915690453	QPLRLEZMRLQVSX-KRWDZBQOSA-N	442.451	1.773	50	20	IDGD	
CCO[C@H]1C[C@H]1C(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccc(OC)cc2)c1	916095739	QPEDUSWQZKCDJL-MSOLQXFVSA-N	433.486	1.682	50	20	IDGD	
CC(C)NS(=O)(=O)Cc1ccc(CNC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1	916227859	NUGLBNIOBUXHEP-UHFFFAOYSA-N	449.489	1.567	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2ccc(F)c(S(=O)(=O)N(C)C)c2)cc1OC	916301486	OZGKPDIVCDYXGQ-UHFFFAOYSA-N	425.438	1.168	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)NCc2ccnc(N3CCOCC3)c2)cc1	916388988	MNCHJFJPRMJDQU-MRXNPFEDSA-N	443.504	1.615	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)NCCN2CCN(c3ccc(F)cc3)CC2)c1	916513972	YCIBMNSYKVUBBJ-UHFFFAOYSA-N	443.523	1.974	50	20	IDGD	
CCCCN(C(=O)COC(=O)/C(C#N)=C/c1cccc(OC)c1)[C@H]1CCS(=O)(=O)C1	916599477	RQAZKGLHDGZPAF-RLGUWMIQSA-N	434.514	1.961	50	20	IDGD	
COC(=O)c1cc(C(=O)OC)cc(S(=O)(=O)NNC(=O)c2ccc(Cl)cc2O)c1	917758103	PAZLWCUAXQJAEQ-UHFFFAOYSA-N	442.833	1.242	50	20	IDGD	
Cc1ccc([C@H](CNC(=O)NNC(=O)COc2ccc(F)cc2)N2CCOCC2)cc1	918099625	WVGCZPBCHKNQRG-FQEVSTJZSA-N	430.480	1.917	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Cn2nc(C)c(Cl)c2C)c1	918278575	CINOPDWNWRMLOX-UHFFFAOYSA-N	441.941	1.645	50	20	IDGD	
CC(C)N(C)S(=O)(=O)c1ccc(CNC(=O)NNC(=O)Cc2ccc(F)cc2)cc1	920235641	SNYAUDKTASZRNV-UHFFFAOYSA-N	436.509	1.928	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@@H](C)C(=O)NN=Cc1nc2c(c(O)nc(=O)n2C)n1C	920364404	RHFIWSRUBLMUKQ-NSHDSACASA-N	432.868	1.560	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)NCc2cccc(C(=O)N3CCOCC3)c2)c1	920421775	DFABGCGSJBEJGQ-UHFFFAOYSA-N	426.473	1.377	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)Nc2cccc(CN3CCC[C@@H]3C(N)=O)c2)cc1	920940698	VJZSBADPWQOOOU-HXUWFJFHSA-N	439.516	1.930	50	20	IDGD	
Cc1ccc2ncc(C(=O)NNC(=O)C3CCN(C(=O)OC(C)(C)C)CC3)c(=O)n2c1	1318667487	GROPVNMMCVXFLV-UHFFFAOYSA-N	429.477	1.411	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)Cn2cc(C(F)(F)F)ccc2=O)n[nH]1	1319235579	CFDGLWDXYPOULI-UHFFFAOYSA-N	435.362	1.727	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)NCc2cccc(CN3CCN(C)CC3)c2)c1	1322424315	CKYBBZDKRLTSHH-UHFFFAOYSA-N	439.560	1.960	50	20	IDGD	
Cc1cc(NNC(=O)c2ccc3c(c2)S(=O)(=O)N=C2N=CNN23)ccc1Br	1334938049	ZSFXTFOMQNHHJE-UHFFFAOYSA-N	449.290	1.926	50	20	IDGD	
O=C(NNC(=O)c1cc(=NCc2ccccc2)cc[nH]1)c1csc(N2CCOCC2)n1	1348384514	JJQXKJWLIYDXAH-UHFFFAOYSA-N	438.513	1.484	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)c2ccc(S(=O)(=O)NC[C@H](C)O)cc2)cc1	1353486882	VLWZPSCOLAYJFD-AWEZNQCLSA-N	437.543	1.207	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cccn4ccnc34)C2)C1	1778588454	UOICTKLTTCAQTB-DNVCBOLYSA-N	435.322	1.951	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc3ncccn3n2)C1	1778978981	XFNYXUHEPGCQEJ-YYFZDKIDSA-N	435.912	1.111	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccs1)C2	1779371278	ZKHIFKIWROPLTD-DYESRHJHSA-N	443.529	1.188	50	20	IDGD	
C[C@H](Nc1cnccn1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(Cl)Cl)C2	1779394817	SNQRWNGYDFQXMS-VEVIJQCQSA-N	430.336	1.595	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cncc4cnccc34)C2)C1	1780014867	UHKVOZGYASZAPC-YJYMSZOUSA-N	433.306	1.857	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccnc4c3OCO4)C2)C1	1780030141	SOBIWHWSIBIRAZ-GTNSWQLSSA-N	426.267	1.037	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Br)C1)n1ccnn1	1780776587	HRDUIRAHGJMUCW-BRXULGCHSA-N	432.294	1.044	50	20	IDGD	
CCOc1cccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](O)CCl)C3)c1O	1781108840	HGUBDSPVQNTAIW-LUQKVYGDSA-N	440.924	1.518	50	20	IDGD	
COc1nccc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)c1F	1781228132	WZEDOIOUUBQEOY-ROUUACIJSA-N	434.295	1.909	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc4nncn4c3)CCO2)C1	1781229899	KPRQHCQNISULLV-ROUUACIJSA-N	426.304	1.409	50	20	IDGD	
O=C(c1ccc2c(c1)OCO2)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781330468	XRWJJFZXQQHXRN-PBHICJAKSA-N	429.242	1.549	50	20	IDGD	
O=C(c1cc(F)cc(C(F)(F)F)c1)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1781607823	APTPNVQEDKRRSE-PBHICJAKSA-N	438.805	1.888	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C=N/O[C@@H]1CCCCO1)C2)C(Cl)Cl	1782217950	DOQSGUNUQAGBHS-MHDHHDOHSA-N	436.336	1.833	50	20	IDGD	
Cc1ccc(CC(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C3)o1	1782654457	UCYHQUSUIUHXMF-XMSQKQJNSA-N	434.537	1.017	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H]3C[C@@]34C(=O)Nc3ccccc34)C2)C1	1783496619	XNYYESGUNWTTNM-AJAKECSLSA-N	431.920	1.744	50	20	IDGD	
O=C(C(Cl)Cl)N1CCO[C@]2(CCN(C(=O)[C@@H]3C[C@@]34C(=O)Nc3ccccc34)C2)C1	1783545216	GLOIBTYAPYUGCL-MRFFXTKBSA-N	438.311	1.530	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccccc1C1CC1)CCO2	1783938245	WMIYPYGEVJGACV-HSZRJFAPSA-N	428.533	1.381	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@](C)(O)C(F)(F)F)C[C@@H]21	1783969883	QUHVCTPRXWPNCR-IAGXKZSMSA-N	445.276	1.310	50	20	IDGD	
Cc1nccn1CCCC(=O)N1CC[C@]2(CN(C(=O)CCBr)CCO2)C1	1784404699	JFOFUDPOHDAHIM-GOSISDBHSA-N	427.343	1.587	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3C[C@@H]3F)C[C@@H]21	1785079615	RSEKHSFIJXHZCR-QNILMXGZSA-N	447.935	1.456	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3[nH]cnc3-c3cccnc3)[C@H]2C1	1789194865	IZUJJLBRBIWCID-QAETUUGQSA-N	447.923	1.319	50	20	IDGD	
Cc1cc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]3C2)nn1C	1789867531	FDARGOBFZWGIGJ-FJXLLPKBSA-N	431.364	1.487	50	20	IDGD	
Cc1nn(C)c(C)c1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]2C1	1789921432	IRPNUHMCWDHVTH-PWNZVWSESA-N	431.306	1.321	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(-c4cc[nH]n4)cc3)[C@H]2C1	1790189044	XYSJXRWTUKTTFT-GNBUJSLZSA-N	446.935	1.924	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1(c2ccc(NC(=O)[C@H](C)NC=O)cc2)CCC1	1790499319	DMIFNZRFNQDLEO-TXLFSUKISA-N	438.488	1.389	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)COc3ccc(O)cc3)C[C@@H]21	1791249584	MJXTXYSFRRXUFM-MGHWNKPDSA-N	426.897	1.005	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc(C(F)(F)F)cn3)C[C@@H]21)C(Cl)Cl	1791295530	LNADLRSTGLPYPS-QXEWZRGKSA-N	441.237	1.892	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)NC1(c2ccc(NC(=O)CCC(=O)NN(C)C)cc2)CCC1	1791600982	CHQMCQKGUNPFRH-OAHLLOKOSA-N	446.552	1.201	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1C[C@H]1c1ccc(Cl)cc1)C2)[C@@H](O)CCl	1792981380	KSYUBYSISVLINL-BONHGPHZSA-N	427.328	1.633	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCl	1793110213	CMLBVPKFRGOFRH-NDKCEZKHSA-N	438.352	1.356	50	20	IDGD	
CC(C)(C)OC(=O)NCC(C)(C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCl	1793117650	VRTHTOFKVAVXTC-XGUBFFRZSA-N	431.961	1.775	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](O)CCl)C1	1793118068	SQDDNEHLEIVLDL-QKPAOTATSA-N	429.945	1.481	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C(F)(F)C(F)(F)C(=O)O	1793974601	HRSQZOVZWOQKBV-JGPRNRPPSA-N	428.455	1.831	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cncc(S(C)(=O)=O)c1	1794625688	RLXBPIJUQZPUNX-AHXJXLJNSA-N	448.372	1.973	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)c1ccc(OCC2CC2)cc1	1796192381	FXLLKPAZPVXAEU-KOUNCHBCSA-N	448.328	1.721	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cn1cnnn1)[C@H](Br)Cc1ccccc1	1796297954	LTBOMLCEWOGZEN-YYIAUSFCSA-N	447.337	1.318	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1nc2c(=O)[nH]c3ccccc3n2n1)C(Cl)Cl	1797660398	MNAXIMOWBOICAZ-JGPRNRPPSA-N	449.298	1.626	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H]1CCc3ccccc3O1)C2	1798443617	NYZQMUSEWNSRPF-KYFSNAEOSA-N	449.511	1.331	50	20	IDGD	
CC(C)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CC[C@H]2CCC(=O)N2C1	1799144780	SIADJNVYHWUOKF-RPUYLAQPSA-N	425.957	1.242	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C[C@H](N)c1cccnc1)C2	1799275033	LTTBBJMGLRMUGM-AMILPRIGSA-N	429.348	1.297	50	20	IDGD	
COc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Br)ccc1F	1799352420	WHJCKYCIVFWWTO-JLUCKKNBSA-N	433.249	1.728	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1cc(F)cc([N+](=O)[O-])c1	1799631086	NXRKYHHKGDHHCA-RDBQEKCUSA-N	448.220	1.628	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)c1cc(Cl)c(F)c(Cl)c1	1799760040	GEVMFVUYQYFYDY-YJKIEOBBSA-N	439.698	1.935	50	20	IDGD	
C[C@H](NC(=O)c1ccccn1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](F)Br)C2	1801262425	TZMFIPDJRSGWCC-DKBOKBLXSA-N	441.301	1.529	50	20	IDGD	
CC[C@@H](NC(C)=O)C(=O)NC[C@@H]1CCN(C(=O)CO[Si](C)(C)C)[C@H]1c1cccnc1	1802879260	HHSXBRODLKQMMF-NSHGMRRFSA-N	434.613	1.854	50	20	IDGD	
COc1nccc(C(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)c1F	1803139087	SLEPOVSRXLVVOO-UNEWFSDZSA-N	436.871	1.544	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2cncs2)[C@@H]1c1cccnc1	1805977195	PSXNDKVNMZDYKE-KXBFYZLASA-N	430.534	1.231	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)C(C)(F)F)[C@H]1c1cccnc1	1808414480	JESIEOUDLIHSPO-MNTZXMNTSA-N	446.458	1.877	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](CCN)C(=O)N1CCC2(CCCN(C(=O)[C@@H](F)Cl)C2)CC1	1810901089	BWVACCKKXJHTSI-HUUCEWRRSA-N	448.967	1.994	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)CSc2nc[nH]n2)[C@H]1c1cccnc1	1813032793	GLHALPJVFUOSJA-YCPHGPKFSA-N	438.941	1.252	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCSC)[C@H]1c1cccnc1	1813094657	BZMMZTBSJOOFGY-LTIDMASMSA-N	429.970	1.455	50	20	IDGD	
Cc1noc(CC(=O)Nc2nc3c(s2)C[C@H](NC(=O)CCBr)CC3)n1	1815560612	MJOURGBPDITIGI-SECBINFHSA-N	428.312	1.774	50	20	IDGD	
N[C@@H](Cc1cscn1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)C(Cl)Cl)CC2	1816990039	XOZGLNMFKHDZTK-APPZFPTMSA-N	434.374	1.885	50	20	IDGD	
CC[C@H](NC)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[nH]n1	1817462578	FRICTEQCTYHBBD-UIVFFXIBSA-N	442.524	1.534	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H]2C[C@@H](O)C2)n[nH]1	1818824439	UHANOZBSSCHUKA-UITOYEBDSA-N	441.492	1.307	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2n[nH]cc2[N+](=O)[O-])n[nH]1	1819659752	BEKSNOHYLMDROG-ONGXEEELSA-N	425.833	1.601	50	20	IDGD	
COC(=O)C1(C(=O)N[C@@H]2CCc3nc(NC(=O)CO[Si](C)(C)C)sc3C2)CC1	1820168965	NTSYTODNQIRHHS-LLVKDONJSA-N	425.583	1.860	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)Cc2ccncc2)n[nH]1	1820717671	DSOURAUGNFNDLL-SFHVURJKSA-N	448.487	1.352	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc(O)nn2)[nH]n1)[C@@H](F)Br	1820930834	DKCIYDKGYCUXON-ZWNOBZJWSA-N	427.234	1.902	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](F)Cl)CC2)c1cc(=O)nc2cccnn12	1821265402	XTBUEYCHAKROGS-XLKFXECMSA-N	436.856	1.306	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnccc2F)[nH]n1	1822414233	NEKOYBFZKWBYED-MRXNPFEDSA-N	431.472	1.623	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)Cn3ccncc3=O)sc2C1	1824542216	KZBPXXHKBRONLX-ZJUUUORDSA-N	440.323	1.095	50	20	IDGD	
Cc1cc(C(=O)N[C@@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)cn1C	1826085897	FENIQVZBLMXNFT-CQSZACIVSA-N	432.550	1.389	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)Cc3c(C)nn(C)c3C)sc2C1	1826849582	WWDRSQXWCLHZBD-TZMCWYRMSA-N	439.969	1.902	50	20	IDGD	
CNc1ccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)cc1	1826849834	ADJMBMGVSMVBIG-QHCPKHFHSA-N	449.360	1.955	50	20	IDGD	
O=C(C1CC1)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCN2C(=O)OCc1ccccc1	1828551998	ZJSZZAQDJXYXQU-AVRDEDQJSA-N	449.935	1.448	50	20	IDGD	
CC(=O)C(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)[C@H](F)Cl)C2)C1	1828792140	MLBVFPXEERKBSM-JXFKEZNVSA-N	439.871	1.562	50	20	IDGD	
N#Cc1ccc(CCC(=O)N2CCO[C@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)cc1	1829635814	QFLUMPLLTATASK-HXUWFJFHSA-N	440.327	1.751	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)NNc1ccccc1)CCO2	1829809461	WCANCMSNEXFJEN-PLMTUMEDSA-N	438.956	1.465	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccnc3)C2)C1	1830537705	MKOKEZJHDBFKKN-KDOFPFPSSA-N	426.311	1.183	50	20	IDGD	
CCC[C@H]1CC[C@H](C(=O)N2CCOC[C@]3(CN(C(=O)[C@H](O)CCl)CCO3)C2)CC1	1830736001	OWVTUATUHLVOTC-NEYJZJCJSA-N	430.973	1.649	50	20	IDGD	
CC(C)(CCl)C(=O)NC1CCN(C2CCN(C(=O)Cn3ccccc3=O)CC2)CC1	1833214118	CQGSGCXXSZIBEE-UHFFFAOYSA-N	436.984	1.685	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3nc(Cl)ccc3F)CCO2)C1	1833242196	ADLZUIMCGMSXKU-SGTLLEGYSA-N	434.295	1.962	50	20	IDGD	
CC(C)c1nc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCBr)C3)C2)co1	1833343027	KIEYWRXHCFLBSZ-GOSISDBHSA-N	444.326	1.653	50	20	IDGD	
Cc1ncoc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)CBr)C2)C1	1834363330	ZMXUKCICTCIFMK-SJKOYZFVSA-N	430.299	1.084	50	20	IDGD	
O=C(C#Cc1ccccc1)N1CCOC[C@]2(C1)CN(C(=O)CCBr)CCO2	1834822319	HHHVTTCPKJVACP-FQEVSTJZSA-N	435.318	1.280	50	20	IDGD	
O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)CCN1CCCCC1)CCO2	1835132439	ZOAUUMMNRKOBMM-LJQANCHMSA-N	446.386	1.104	50	20	IDGD	
CC(C)(C)n1cc(C(=O)NC2CCN(C3CCN(C(=O)[C@H](F)Cl)CC3)CC2)nn1	1836174653	HKBNFOHTWHXZHT-INIZCTEOSA-N	428.940	1.753	50	20	IDGD	
C[C@@H](C(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)n1cccc1C=O	1836716549	BELFDURXMPKCLY-KXBFYZLASA-N	439.940	1.460	50	20	IDGD	
CCc1[nH]nc(C(=O)N2CCC(OC3CCN(C(=O)[C@H](Cl)COC)CC3)CC2)c1F	1837344827	MYSHRQBSYLGELK-OAHLLOKOSA-N	444.935	1.977	50	20	IDGD	
Cn1cnc(C(=O)N2CCC(OC3CCN(C(=O)[C@@H](F)Br)CC3)CC2)c1	1837549828	WWOWMMKAAHDRHX-OAHLLOKOSA-N	431.306	1.723	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccsc3)C2)C1	1837711664	NBBXIEFPZRWNGD-LJQANCHMSA-N	426.611	1.599	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4c(c3)COC4)C2)C1	1837713315	VOGFBCAAALJAEZ-QFIPXVFZSA-N	448.592	1.638	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccn(C(F)F)n3)CCO2)C1	1838031135	ZJUIXRAXZPNRJZ-GOSISDBHSA-N	434.871	1.613	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)N1CCC(OC2CCN(C(=O)[C@](C)(Cl)CCl)CC2)CC1	1838427814	IISGEAJRCGVZNW-JLTOFOAXSA-N	448.391	1.912	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(F)c(C)c3N)C2)C1	1839144302	UQFRARYCLHXLKI-FOIQADDNSA-N	427.904	1.804	50	20	IDGD	
CCn1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)n1	1839150969	DJKYYPWTAGGPEH-QZTJIDSGSA-N	433.336	1.209	50	20	IDGD	
CSCC(C)(C)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H](F)Br)CCO2)C1	1839198550	HWAOUORUDKDGDH-MLGOLLRUSA-N	441.363	1.523	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)c(C)n1	1839200871	RERLJOAVZBVUPN-MAUKXSAKSA-N	444.301	1.459	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3nc4ccccc4o3)CCO2)C1	1839503828	ZGDXEEBRICBIKT-JLTOFOAXSA-N	437.880	1.152	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccncc3F)C2)C1	1840032757	JNKOCJMFUSZYOX-SJKOYZFVSA-N	430.274	1.074	50	20	IDGD	
CCN(CC)C[C@H](C)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2	1840034976	CAIXFLHHQRHTSC-FCEWJHQRSA-N	448.402	1.204	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3ccc(C)nc3)C2)C1	1840149937	CDINNEUEUKLCNP-RXVVDRJESA-N	439.940	1.033	50	20	IDGD	
C[C@H](Nc1cccnc1)C(=O)N1CCOC[C@]2(CN(C(=O)C(Cl)Cl)CCO2)C1	1840188069	MBCWYYORQRLHHC-SCLBCKFNSA-N	431.320	1.142	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCCn3ccnc3C)CCO2)C1	1840386396	YMMLPBHQCLDZIU-NQIIRXRSSA-N	440.972	1.836	50	20	IDGD	
Cc1cnn([C@@H](C)C(=O)N2CCO[C@@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)c1	1840400723	DOMDLYARZCHFPG-JXFKEZNVSA-N	426.945	1.474	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)/C=C/c3cnccn3)CCO2)C1	1840488188	XFIDJYSJYXCVPW-XVXNLHAJSA-N	443.331	1.183	50	20	IDGD	
COc1cccc(C(=O)N2CCO[C@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)c1F	1840794506	JPXUUMHXFIJVDG-GOSISDBHSA-N	435.279	1.708	50	20	IDGD	
O=C([C@H](F)Cl)N1CC2(CCCN2C(=O)CN2C(=O)COc3ccc(Cl)cc32)C1	1841855658	SCGAGHVRKSOHEX-INIZCTEOSA-N	430.263	1.803	50	20	IDGD	
COC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)CCBr)C2	1843383715	AHPARTUSPNJUMJ-ZDUSSCGKSA-N	448.358	1.515	50	20	IDGD	
COc1ccc(C(=O)N2CC3(CCCN3C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)c(F)c1	1843416668	LBWFDLKCKNDWPZ-AFUMVMLFSA-N	441.463	1.785	50	20	IDGD	
CC(C)(C)OC(=O)NCC[C@H](O)C(=O)N1CCCC12CN(C(=O)CO[Si](C)(C)C)C2	1845222995	NBYHZPAFBRPEGJ-HNNXBMFYSA-N	443.617	1.317	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)c2ccccc2N2CCCCC2)C1	1845511167	JSHODGXHZAZFRP-UHFFFAOYSA-N	447.344	1.488	50	20	IDGD	
CS(=O)(=O)CCC(=O)N1CCCC12CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)C2	1846701379	MIAMAYOLUPKWRT-OQLLNIDSSA-N	437.468	1.510	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cccnc1CS(C)(=O)=O	1847865397	QYUHCLDBZIQYSC-PVAVHDDUSA-N	427.954	1.849	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)Cc1noc(C)n1	1848190105	TYTOVQRAXYLEDY-HOTGVXAUSA-N	443.416	1.270	50	20	IDGD	
CCn1c(NNC(=O)CN2C(=O)N[C@@]3(CCCC[C@@H]3C)C2=O)nc2ccccc2c1=O	10681428	OBOBGUGMVNKDRU-YEJXKQKISA-N	426.477	1.360	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)Cn1cnc2sc(C)c(C)c2c1=O	16205294	MBXBCYBJEAQUSB-UHFFFAOYSA-N	438.513	1.835	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)OCc2nc(N)nc(N(C)C)n2)c(C)n1C[C@@H]1CCCO1	24897891	MFMSJFKAFZYSAQ-NDCSFFLDSA-N	425.493	1.768	50	20	IDGD	
CS(=O)(=O)CC[C@H](NS(=O)(=O)c1ccc(Cl)cc1)C(=O)NNc1ccccc1	727861395	AKLRCOHUHVGGQX-INIZCTEOSA-N	445.950	1.565	50	20	IDGD	
CN1CCN(C[C@@H](NC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c2ccccc2)CC1	727945134	IYYUZCQUCBBKMB-NQIIRXRSSA-N	439.516	1.146	50	20	IDGD	
COc1ccccc1C(=O)N[C@@H](CCS(C)(=O)=O)C(=O)NNc1cc(C)ccc1C	728058811	ONWCICSMPDEMAW-KRWDZBQOSA-N	433.530	1.988	50	20	IDGD	
Cc1c(/C=C(\C#N)C(=O)OCC(=O)c2ccc(NS(C)(=O)=O)cc2)cc(C#N)n1C	728322226	QCYRQRQYHDXEIG-LZYBPNLTSA-N	426.454	1.910	50	20	IDGD	
O=C(NNC(=O)[C@H]1CC(=O)N(c2ccc3c(c2)OCCO3)C1)c1cccc(OC(F)F)c1	728487782	ANHVRAONOMTUIN-ZDUSSCGKSA-N	447.394	1.873	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NCC(=O)NNc2ccc(OC)cc2)c1	729273175	JJQZAHIIJUJJTJ-UHFFFAOYSA-N	434.518	1.599	50	20	IDGD	
Cn1cc(S(=O)(=O)N2CCCCC2)cc1C(=O)NNC(=O)c1cccc2ncccc12	730226405	KHBZPZTVOYEZBA-UHFFFAOYSA-N	441.513	1.823	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)[C@H]1CCCN(C(=O)CCOc2ccccc2)C1	730779986	HIFGTFLRJXQOCQ-KRWDZBQOSA-N	441.484	1.626	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)CCNC(=O)c2ccc3ccccc3c2)C[C@@H](C)O1	732261204	LKPINKBYCHTMMJ-IAGOWNOFSA-N	426.517	1.606	50	20	IDGD	
CCCOc1cn(-c2ccccc2)nc1C(=O)NNC(=O)CCN1C[C@@H](C)O[C@H](C)C1	732263127	KHDWMXPDMSKRFJ-IAGOWNOFSA-N	429.521	1.921	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)c1ccc(N2CCCS2(=O)=O)cc1	733108139	HSOWJEADYJQAIZ-UHFFFAOYSA-N	425.470	1.487	50	20	IDGD	
CC(C)OCCCn1c(NNC(=O)c2ccnc(-n3cncn3)c2)nc2ccccc2c1=O	733265807	LKINWXCOMIJWSB-UHFFFAOYSA-N	448.487	1.944	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)Cn1c(=O)nc(O)c2ccccc21	734250968	RGBQPEIZJLEBGP-UHFFFAOYSA-N	445.501	1.322	50	20	IDGD	
C#CCNS(=O)(=O)c1cccc(C(=O)NNc2cc(CC)nc(-c3ccccn3)n2)c1	734357138	SKFBOCPPQCNYGR-UHFFFAOYSA-N	436.497	1.769	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)CC(=O)NNC(=O)COc2ccc(F)cc2)cc1F	734808513	APVXHHZKULJWIM-UHFFFAOYSA-N	426.397	1.168	50	20	IDGD	
C[C@@H]1[C@@H](C)S(=O)(=O)CCN1C(=O)NNC(=O)c1ccc(Br)cc1Cl	736386383	DWMJEICEEWYMMI-RKDXNWHRSA-N	438.731	1.964	50	20	IDGD	
CCOC(=O)N1[C@H](C(=O)NNC(=O)CNC(=O)c2ccco2)CC[C@@H]1c1ccc(C)o1	736483290	ZBHMVQZKJZSGSC-KGLIPLIRSA-N	432.433	1.420	50	20	IDGD	
O=C(CCc1nc(-c2nc[nH]n2)no1)NN=c1cc(C(F)(F)F)[nH]c(-c2ccncc2)n1	736707594	FGINICIXVBQMKH-UHFFFAOYSA-N	446.353	1.223	50	20	IDGD	
COc1cccc2c1OCC[C@@H]2NC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	743578007	GTOHGSRXNWTWPG-HNNXBMFYSA-N	434.474	1.958	50	20	IDGD	
COc1cc(CNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c2ccccc2n1	743588795	JOQKHEDZMSWNTF-UHFFFAOYSA-N	435.488	1.780	50	20	IDGD	
CNS(=O)(=O)c1ccc(C(=O)NNC(=O)Nc2cc(Cl)c(OC)cc2OC)cc1	743833899	LOXCMSDWFCFKRW-UHFFFAOYSA-N	442.881	1.732	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN(C)[C@@H](C)c2ccc(S(N)(=O)=O)cc2)cc1C	744385761	VPIDTXZEJMGFPU-ZDUSSCGKSA-N	438.575	1.720	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)CN2CCN(C(=O)CCCc3ccccc3)CC2)cc1	744393567	PYXLECJEDAUNPY-UHFFFAOYSA-N	433.512	1.486	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)c1	744705275	PNLVBEUDISXJAJ-UHFFFAOYSA-N	447.513	1.547	50	20	IDGD	
COC(=O)[C@H](C)Sc1ccccc1C(=O)OCC(=O)NNC(=O)c1ccc(C#N)cc1	744823981	ACQCGANYLNIKKG-ZDUSSCGKSA-N	441.465	1.830	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)N[C@H](Cc1ccccc1)CN1CCOCC1	745815140	DVYYJHIXUYNTBD-MRXNPFEDSA-N	443.460	1.188	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2CCCN(C(=O)NC3CCCC3)C2)c1	746123962	VFRSTPDXLIANJV-OAHLLOKOSA-N	436.534	1.215	50	20	IDGD	
CC(C)(C)[C@@H]1CCc2sc(C(=O)NNC(=O)Cn3cc(S(N)(=O)=O)cn3)cc2C1	748555333	PDSJUSNATFWSJZ-GFCCVEGCSA-N	439.563	1.204	50	20	IDGD	
O=C(NNC(=O)C1(C(=O)NC2CC2)CC1)[C@H]1Cc2ccccc2CN1Cc1ccccc1	749942394	XUEPNCSTCNDQGE-OAQYLSRUSA-N	432.524	1.820	50	20	IDGD	
CC(=NNC(=O)CNC(=O)c1cccs1)c1ccc(OCC(=O)N2CCOCC2)cc1	750948806	WVNQJCIANZHKFS-UHFFFAOYSA-N	444.513	1.256	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)CSc1nnc(-c2ccc(Cl)cc2)o1	751206377	GDNGRNLLRCPMAH-UHFFFAOYSA-N	435.849	1.653	50	20	IDGD	
C[C@H]1CCCCN1S(=O)(=O)c1cccc(C(=O)NNC(=O)CNC(=O)c2ccco2)c1	751206825	NXMISINNEVNXJW-AWEZNQCLSA-N	448.501	1.034	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)NC[C@@H]3CCC[C@]34NC(=O)N(C)C4=O)cc2C1	752000098	PWIIVWGVBMQRAP-RZZGRXHGSA-N	433.534	1.537	50	20	IDGD	
C[C@]1(NNC(=O)N[C@H]2CC(=O)N(c3cccc(C(F)(F)F)c3)C2)CCS(=O)(=O)C1	753035439	WORMUMUQLPKBKH-LRDDRELGSA-N	434.440	1.192	50	20	IDGD	
Cc1oc(S(=O)(=O)N(C)C)cc1C(=O)NNC(=O)c1ccc(Br)s1	753280647	WHGHXGWBAYKRKP-UHFFFAOYSA-N	436.309	1.737	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)N[C@H]2COc3cc(F)cc(F)c32)nc1	753417527	BSEYLIUIPMDWBG-ZDUSSCGKSA-N	427.433	1.806	50	20	IDGD	
Nc1nc(Cl)cc(NNC(=O)c2ccc3ncc(I)n3c2)n1	753454789	KZFWGBDHWFNMKL-UHFFFAOYSA-N	429.609	1.721	50	20	IDGD	
O=C(NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1)c1ccc2nn[nH]c2n1	753984669	AVVMIFNLTSIHAM-UHFFFAOYSA-N	443.470	1.290	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1c[nH]nc1-c1ccccc1F	755050346	XJENXRKZBVCCIL-UHFFFAOYSA-N	430.465	1.892	50	20	IDGD	
O=C(NNC(=O)c1cccnc1)Nc1ccc(S(=O)(=O)NC2=NCCCCC2)cc1	755498937	HXQQTMIVPAXDHD-UHFFFAOYSA-N	430.490	1.799	50	20	IDGD	
CCNC(=O)c1ccc(C)c(NC(=O)NNC(=O)c2nn(CC)c(=O)c3ccccc23)c1	755831532	XXLGLYZJOSLGGO-UHFFFAOYSA-N	436.472	1.941	50	20	IDGD	
COC(=O)c1cc(NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)ccc1Cl	755849234	GTUGBJSLNRSHFV-UHFFFAOYSA-N	429.820	1.840	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)Nc1cccc(C(=O)N2CCOCC2)c1	755934326	RUORUOVFERPVFJ-UHFFFAOYSA-N	426.429	1.397	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)Nc2cccc(S(=O)(=O)/N=C3/CCCN3C)c2)c(O)c1	756028567	FRYHIHVYLSWGDV-MOHJPFBDSA-N	445.501	1.980	50	20	IDGD	
CCc1c(C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cnn1CCC(C)C	756407442	JMMZRSIDUGEJMX-UHFFFAOYSA-N	449.577	1.882	50	20	IDGD	
CON(C)C(=O)c1ccc(NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1	756503891	NSPUGOMTXNFKKL-UHFFFAOYSA-N	427.465	1.179	50	20	IDGD	
COC(=O)c1ccc(NC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1C(=O)OC	756818685	UDHOATQOKRHLDD-INIZCTEOSA-N	429.385	1.253	50	20	IDGD	
COc1ncc(C)cc1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	756847744	HHNMVZHFYZOIST-UHFFFAOYSA-N	433.490	1.650	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NC[C@H]2CC(=O)N(Cc3ccccc3)C2)cc1OC	758655903	VJANCYDYCSWEJV-MRXNPFEDSA-N	426.473	1.697	50	20	IDGD	
CCNS(=O)(=O)c1ccc(CC(=O)NNC(=O)c2cc(Br)c[nH]2)cc1	759356284	MCMGMLGVYJZNGL-UHFFFAOYSA-N	429.296	1.079	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)NC[C@H]1CN(Cc2ccccc2)CCCO1	759361016	IPRLQMVJFKNHOX-FQEVSTJZSA-N	430.480	1.826	50	20	IDGD	
CCc1ccc(C=NNC(=O)C[C@H](C(=O)NN=Cc2ccc(CC)o2)N2CCOCC2)o1	760260512	PKIACOKUSVTLTL-HXUWFJFHSA-N	443.504	1.689	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2ccc(OC)c(OC)c2)c(OC)cc1Cl	763550611	HOQHKPYDKAAKKK-UHFFFAOYSA-N	437.836	1.774	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1ccnn1Cc1ccccc1F	763627851	DVQXUQXHJOTUHI-UHFFFAOYSA-N	435.419	1.426	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1ccccc1C(=O)N1CCCCC1	763630386	ZSWZSHRKEUYLGP-UHFFFAOYSA-N	448.483	1.669	50	20	IDGD	
CC[C@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2cc(C)cc(C)c2)cc1	763646746	JAYPPDAXBMIDCX-INIZCTEOSA-N	440.500	1.997	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)NC(C)C)c(C)c2)c1	763772994	RYDDZXYFFSJNLW-UHFFFAOYSA-N	442.472	1.550	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2ccc3ccccc3c2)c2ccccc2c1=O	763787340	XRQYQMWPUBMYRY-UHFFFAOYSA-N	429.436	1.969	50	20	IDGD	
COC(=O)Nc1cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)ccc1F	763872035	JQEBHUGTHMTLKX-JTQLQIEISA-N	436.371	1.697	50	20	IDGD	
Cc1nccn1-c1ccc(NC(=O)C(=O)NNC(=O)CCSc2ccc(F)cc2)cn1	763895712	QEHFISFEWLJDPM-UHFFFAOYSA-N	442.476	1.983	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(F)c(C(=O)N(C)C)c2)cc1OC	763901211	MIKDCCWOXWOPHQ-UHFFFAOYSA-N	446.435	1.335	50	20	IDGD	
O=C(Cc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1cc(N2CCCC2=O)ccc1F	763930747	BLHMGMXFLFTXFT-UHFFFAOYSA-N	432.839	1.935	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)C(=O)Nc1cccc(OCCF)c1	763944660	OLPZLNIODBASAC-UHFFFAOYSA-N	427.392	1.326	50	20	IDGD	
CS(=O)(=O)c1ccccc1NC(=O)C(=O)NNC(=O)c1cc2c(s1)CCCCC2	763962169	MSSYCNOBLJKWFO-UHFFFAOYSA-N	435.527	1.820	50	20	IDGD	
COC(=O)c1sccc1NC(=O)C(=O)NNC(=O)c1cc(Br)cn1C	764005044	SSHCSVXFBREJQA-UHFFFAOYSA-N	429.252	1.035	50	20	IDGD	
COc1cccc(C[C@@H](C(=O)NNC(=O)CSc2ccccc2O)n2nnnc2C)c1	764045952	VKMQARXOQWZFCR-INIZCTEOSA-N	442.501	1.419	50	20	IDGD	
Cc1nn(C)c(NC(=O)C(=O)NNC(=O)c2ccc(Br)cc2Cl)c1C	764059076	ZDFHBCSBFGQGEV-UHFFFAOYSA-N	428.674	1.853	50	20	IDGD	
CCCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(C)cc2O)cc1Cl	764108045	AZEURFLNBWJDIG-UHFFFAOYSA-N	432.864	1.894	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(NC(C)=O)c2C)o1	764139324	SDFUNLRZESJNOP-UHFFFAOYSA-N	429.477	1.788	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cccc(OC(F)F)c2)ccc1C(=O)N(C)C	764259372	FXPMXYXVJAQDKM-UHFFFAOYSA-N	434.399	1.698	50	20	IDGD	
COC(=O)CCOc1ccc(NC(=O)C(=O)NNC(=O)C(C)(C)c2ccccc2)cc1	764312655	DLEMCAZXUPPTKI-UHFFFAOYSA-N	427.457	1.692	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CNC(=O)c2cccnc2)cc1NC(=O)c1ccccc1F	764341866	MCFHRZJVADOURT-UHFFFAOYSA-N	449.442	1.972	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COCCO1)C(=O)Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1	764434017	PMSDFSVDCDNRAJ-JTQLQIEISA-N	429.273	1.226	50	20	IDGD	
CC(C)c1nn(C)cc1C(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	766664907	XLSGGLKKQLMDLN-UHFFFAOYSA-N	432.956	1.776	50	20	IDGD	
CC(C)n1ncc2cc(S(=O)(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)ccc21	768496839	FRNAHYCQCRYOCR-UHFFFAOYSA-N	436.515	1.644	50	20	IDGD	
Cc1noc(C)c1S(=O)(=O)NC1(C(=O)NNc2cc(C#N)cc(Cl)n2)CCCC1	769062130	HXDWRLQXPSCGTB-UHFFFAOYSA-N	438.897	1.946	50	20	IDGD	
COc1ccccc1[C@@]1(C)NC(=O)N(CC(=O)NNC(=S)Nc2cccc(C)c2)C1=O	771253794	ZQHSSIKXFSNFJF-OAQYLSRUSA-N	441.513	1.788	50	20	IDGD	
O=C(CCN1CCN(C(=O)[C@H]2CCCO2)CC1)NNc1ccnc(Br)c1	771542569	YXKNAEBNQUKVPR-CQSZACIVSA-N	426.315	1.001	50	20	IDGD	
Cc1nc(S(=O)(=O)N2CCC(C(=O)NNc3ccc(F)c([N+](=O)[O-])c3)CC2)cn1C	771591422	YXKSQHUFDXNNLF-UHFFFAOYSA-N	440.457	1.320	50	20	IDGD	
CC(C)(C)OC(=O)N1CCSC[C@H]1CC(=O)NNC(=O)[C@H]1COc2ccccc2O1	772009837	KEFMSEGMGNAVBT-CZUORRHYSA-N	437.518	1.716	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCCNC(=O)NNC(=O)NCc2ccc(Cl)cc2)s1	772631047	OYVBPSCXFPBQFQ-UHFFFAOYSA-N	445.954	1.702	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)c2occc2CS(=O)(=O)c2ccccc2)c1	773072118	KJOKOHVMAKJFRY-UHFFFAOYSA-N	442.453	1.682	50	20	IDGD	
CN1CCN(CCOc2ccc(NC(=O)C(=O)NNc3ccccc3[N+](=O)[O-])cc2)CC1	773656158	ZBWPEPJTCSKCEM-UHFFFAOYSA-N	442.476	1.303	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)Nc1ccc(C[C@H]2NC(=O)NC2=O)cc1	775705152	YMHGNQGTKCZDJV-BDJLRTHQSA-N	429.408	1.196	50	20	IDGD	
Cc1cc2ccccc2nc1NNC(=O)CNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	777531367	IGRLIVZLCZAOBK-UHFFFAOYSA-N	441.513	1.667	50	20	IDGD	
O=C([C@H]1CCCCN1C(=O)c1ccco1)N1CCN(S(=O)(=O)CBr)CC1	777832589	NZZIIKNNRKJPIE-CYBMUJFWSA-N	448.339	1.101	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)[C@H]1CCN(Cc2ccccc2)C1	778806105	KWPVSIMNZYYMLP-LPHOPBHVSA-N	444.557	1.945	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc(C(=O)O)c(F)c(Cl)c1F)c1ccc([N+](=O)[O-])cc1	779825467	UJRGMAXCOCEOHW-UHFFFAOYSA-N	435.748	1.848	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)N2C[C@@H](C(=O)N3CCCCC3)Oc3ccccc32)nc1	782141561	OCQZXPRTEBSOSR-SFHVURJKSA-N	439.472	1.340	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C(=O)Nc2ccccc2N2CCCCC2)nc2ccccc21	782892240	AJUJRWZFAPRMGG-UHFFFAOYSA-N	434.500	1.892	50	20	IDGD	
Cc1ccc(NC(=O)C2CC2)cc1NC(=O)C(=O)NNC(=O)Cc1nc2ccccc2n1C	782892592	DWEBBKZPWHTQBD-UHFFFAOYSA-N	448.483	1.559	50	20	IDGD	
C[C@@H]1CN(C(=O)c2ccc(NC(=O)C(=O)NNc3cncc(Cl)n3)cc2)C[C@@H](C)O1	783259433	FEPOAJXIHGTDFM-VXGBXAGGSA-N	432.868	1.461	50	20	IDGD	
Cn1c(=NNC(=O)C(=O)Nc2ccc3nc4n(c(=O)c3c2)CCC4)sc2ccccc21	783351776	LOUFXGDULWXIEK-UHFFFAOYSA-N	434.481	1.467	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)[C@H]1CC=CC[C@H]1C(=O)N1CCOCC1	784395085	XIZOZBXTCGSXCP-RBUKOAKNSA-N	448.545	1.012	50	20	IDGD	
COc1ncc(NC(=O)C(=O)NNc2c(F)cc(F)cc2Br)cc1C(N)=O	785010787	ITVGQFWDYUQJLA-UHFFFAOYSA-N	444.192	1.312	50	20	IDGD	
Cc1cccc(C(=O)N2CCCC2)c1NC(=O)C(=O)NNC(=O)Cc1cn2ccccc2n1	785067131	HMGXJDNYKZTDSN-UHFFFAOYSA-N	448.483	1.207	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1cnc2c(cnn2C(C)C)c1	785330478	IRLIEORMOHUJDD-UHFFFAOYSA-N	446.489	1.506	50	20	IDGD	
CO[C@H]1CCOc2c(NC(=O)C(=O)NNC(=O)CN3CCCc4ccccc43)cccc21	790951491	GQRPHEWPVQBMSB-IBGZPJMESA-N	438.484	1.695	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)Cn2c(CS(C)(=O)=O)nc3ccccc32)cc1C	791816532	VNOOKTJQNRIQNW-UHFFFAOYSA-N	444.513	1.424	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)[C@@](C)(O)Cn2cc(C(F)(F)F)ccc2=O)c1	792018089	PEJMJXCBAOTMAP-SFHVURJKSA-N	443.378	1.097	50	20	IDGD	
CNC(=O)c1cc(Cl)cc(S(=O)(=O)NNC(=O)c2ccc3ccccc3n2)c1OC	795276870	DKQDSEQVZXVOFX-UHFFFAOYSA-N	448.888	1.880	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)cc1OC	796989871	JSXATQIKSQJNFY-AWEZNQCLSA-N	443.456	1.652	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2cccc(C(=O)N3CCSCC3)c2C)n1	797371514	WMWDPPMPUXQDMK-UHFFFAOYSA-N	441.513	1.287	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)CNC(=O)OCc2ccccc2)cc1NC(C)=O	797612199	TYNHTWQFKRCCPH-UHFFFAOYSA-N	429.433	1.733	50	20	IDGD	
CNC(=O)COc1ccc(NC(=O)NNC(=O)[C@@H](C)Oc2ccc(C(C)=O)cc2)c(C)c1	797680445	IFDWGYJVCNMFJB-OAHLLOKOSA-N	442.472	1.943	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)NCCCNS(=O)(=O)c2ccccc2Cl)n1	798493505	UYXPANNYJWSWAA-UHFFFAOYSA-N	425.898	1.356	50	20	IDGD	
CNC(=O)NNC(=O)c1ccc(I)c(I)c1	798929124	LQGDVYPXLBEBOQ-UHFFFAOYSA-N	444.998	1.470	50	20	IDGD	
CC[C@](O)(C(=O)N1CCN(S(=O)(=O)CBr)CC1)c1cccc(Cl)c1	800530749	PGRANBPIVAYFTG-OAHLLOKOSA-N	439.759	1.764	50	20	IDGD	
CC(C)(C)OC(=O)N(CC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)C1CC1	802066513	XWZUMUMTIJPDQV-UHFFFAOYSA-N	426.495	1.642	50	20	IDGD	
COc1cc(OC)cc(N2C[C@H](C(=O)NNC(=O)Nc3ccc4c(c3)OCO4)CC2=O)c1	802102221	IBNHQIUEMDKRPX-GFCCVEGCSA-N	442.428	1.638	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NC2CC(NS(C)(=O)=O)C2)ccc1OCCC(C)C	802421824	ZGGKLTYIIZLWMM-UHFFFAOYSA-N	442.538	1.144	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NN=Cc2ccc(S(N)(=O)=O)c(Cl)c2)cc1	807973620	GZIHVWLEWXCPTD-UHFFFAOYSA-N	430.895	1.547	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2cc(C)n(-c3ccc(F)cc3F)n2)c1O	808934626	ODKPFDDLJQMNDP-UHFFFAOYSA-N	445.382	1.573	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(Br)c([N+](=O)[O-])c2)c(C)o1	810384861	JIZGXVMDSMPUEU-UHFFFAOYSA-N	425.195	1.967	50	20	IDGD	
CC(=NNC(=O)Cc1nc(O)c2c(C)c(C)sc2n1)c1ccc2[nH]c(=O)c(=O)[nH]c2c1	811633345	OYOYHXCKBFDDDY-UHFFFAOYSA-N	438.469	1.626	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(S(=O)(=O)N(C)C(C)C)cc2)cc1	811846016	KPKMIKACGIMWNL-UHFFFAOYSA-N	447.513	1.642	50	20	IDGD	
Cc1cc(CC(C)(C)C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)ccc1Br	814620523	UZGWZINNAHXPPC-CYBMUJFWSA-N	446.367	1.844	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NN=C(C)c2cnnn2C)c1	814688730	KHTAGLXARPVWCL-UHFFFAOYSA-N	428.474	1.779	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3sccc3C#N)n[nH]2)cc1OC	815570150	TVKWXCUSTVFZCD-UHFFFAOYSA-N	440.441	1.427	50	20	IDGD	
O=C(NNc1ncccn1)C(=O)Nc1ccc([N+](=O)[O-])c(I)c1	815574528	TXTCNFJEULAKCN-UHFFFAOYSA-N	428.146	1.071	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCc2nncn2C1)C(=O)Nc1cccc(Sc2ccccc2)c1	815691944	GFEWSRKSZHDDSP-CQSZACIVSA-N	436.497	1.778	50	20	IDGD	
CC(C)C(=O)Nc1ccc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)N(C)C)cc1	815752051	ZVXOOYBIYDQTKD-UHFFFAOYSA-N	447.517	1.613	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)C(=O)Nc2ccn(CCC#N)n2)c1	815866252	VBHSQPREOAMWTB-UHFFFAOYSA-N	435.238	1.428	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)[C@@H](C(C)C)N2CCCS2(=O)=O)c1	816716857	DXERZDVIKJHNKP-CQSZACIVSA-N	448.339	1.739	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)Cc1csc(NC(=O)c2ccco2)n1	817055254	TVESHMVQTJXWLU-UHFFFAOYSA-N	449.514	1.925	50	20	IDGD	
O=C(COC(=O)CCNS(=O)(=O)c1ccccc1)NNC(=O)c1cccc(Cl)c1	849199310	RRRYDVQVOVOQDT-UHFFFAOYSA-N	439.877	1.013	50	20	IDGD	
O=C(NN=Cc1ccc(-n2cncn2)cc1)c1cccc(S(=O)(=O)N2CCOCC2)c1	863950884	TTXRGHUOLPIWPG-UHFFFAOYSA-N	440.485	1.052	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)/C(=C\c2ccco2)n2nnnc2-c2ccccc2)n1	893369203	FVDCAMMZVRBBGN-LDADJPATSA-N	432.444	1.592	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)[C@@H]1CC(=O)N(c2ccc(F)c([N+](=O)[O-])c2)C1	913123288	GNMSVFPBOFDIRZ-NWDGAFQWSA-N	448.382	1.841	50	20	IDGD	
CCOC(=O)c1ccc(N2CCN(CC(=O)NNC(=O)c3cccc(Cl)c3)CC2)nc1	914788383	KJHGSUFSHTYSID-UHFFFAOYSA-N	445.907	1.495	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCN(C(C)C)C(C)C)c1	915891229	MBZAIPRLUFJRAC-UHFFFAOYSA-N	441.598	1.780	50	20	IDGD	
CNS(=O)(=O)c1ccc(CNC(=O)NNC(=O)[C@H](C)Oc2ccccc2F)s1	916232111	FUDDDDFUXPTFFL-JTQLQIEISA-N	430.483	1.093	50	20	IDGD	
CCNC(=O)c1ccc(CNC(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)cc1	916392466	XSBBRHNSYUCCGT-UHFFFAOYSA-N	434.522	1.344	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)N[C@@H]2CCN3CCC[C@@H]3C2)c2ccccc2c1=O	916573079	HJWDPCWEHMJZDU-HZPDHXFCSA-N	426.521	1.767	50	20	IDGD	
CCCCOc1ccc(C(=O)NCC(=O)NNC(=O)C(=O)Nc2ccc(C)cc2)cc1	916830346	OAYICOPSVAHWFA-UHFFFAOYSA-N	426.473	1.690	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)CNC(=O)c2ccc(Br)s2)cc1	916986731	JUHQUYLXQDAIKN-UHFFFAOYSA-N	441.307	1.509	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)CCNC(=O)c2cc(F)ccc2Br)n1	917391891	LTBSVYHKGWRONT-UHFFFAOYSA-N	440.273	1.369	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2cccc(Cl)c2F)c1	917720036	QPPBDKNWKJSNET-UHFFFAOYSA-N	435.886	1.353	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)c1cccc(S(=O)(=O)NC2CCCC2)c1	919822950	WUASSYOYBJMKMQ-UHFFFAOYSA-N	431.514	1.920	50	20	IDGD	
O=C(CCc1ncc(-c2ccc(F)cc2F)o1)NNC(=O)N[C@@H]1CCS(=O)(=O)C1	919889310	KTWMRGQTEJYGTO-LLVKDONJSA-N	428.417	1.070	50	20	IDGD	
O=C1CCCc2cc(S(=O)(=O)NNC(=O)c3nnc(-c4ccccc4)o3)ccc2N1	919961585	DQMCFJCSSZENLX-UHFFFAOYSA-N	427.442	1.635	50	20	IDGD	
COCCN1CCC(NC(=O)CCC(=O)C(C#N)=C2N(C)c3ccccc3N2C)CC1	920821651	IFXFUKFGERHGLD-UHFFFAOYSA-N	425.533	1.884	50	20	IDGD	
Cc1cc(C)n2ncc(C(=O)NNc3ccc(S(=O)(=O)N4CCN(C)CC4)cc3)c2n1	1115975266	FDMDCHNNGPNOQW-UHFFFAOYSA-N	443.533	1.039	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(O)nc(O)c2)C1	1777851062	NGKZJQZXSHLEMP-FOIQADDNSA-N	437.569	1.472	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](F)Cl)C3)C1	1778758219	FWBWKVRJZVVIEE-STXHMFSFSA-N	447.935	1.902	50	20	IDGD	
CC[S@](=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)Br)C2	1779223831	HLJPIELZOXROJP-DQMDSTQDSA-N	437.400	1.442	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)N1CCO[C@@]2(CCN(C(=O)CO[Si](C)(C)C)C2)C1	1779295243	BWDCKEPNCBIGCV-OAQYLSRUSA-N	430.581	1.938	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H]1CC[C@H]3CCC(=O)N3C1)CCO2	1779300726	WGZGELGNVYUZAC-FIKGOQFSSA-N	437.613	1.069	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(N(C)C)nc3)C2)C1	1779764578	JRUKNZFDIJIFRW-SCLBCKFNSA-N	425.327	1.375	50	20	IDGD	
O=C(Cc1ccncc1)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Br)C2	1780565640	IBARFUKRUIFIRW-UWWQBHOKSA-N	428.302	1.829	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)CN1CCCCC1)C2)[C@H](F)Br	1780771989	YFNBEZICUVOPOV-UWWQBHOKSA-N	434.350	1.677	50	20	IDGD	
O=C(c1ccc2ncoc2c1)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781330139	RCBIMIGXZNNKBS-RHSMWYFYSA-N	426.242	1.962	50	20	IDGD	
O=C([C@H](F)Br)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)Cc1ccccc1)CCO2	1781332822	FOHKLVUQVNQVHY-RVKKMQEKSA-N	429.286	1.110	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H]2CC[C@H](O)CC2)C1	1782326453	NCQCTGHIUUERLY-XHWCBRGXSA-N	431.371	1.835	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cncc(N(C)C)c3)CCO2)C1	1783343997	LZNXUTHYNMEIAW-APWZRJJASA-N	439.354	1.765	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cc4cn[nH]c4cn3)CCO2)C1	1783349862	USBLLVNZPJNGAB-SCLBCKFNSA-N	436.310	1.575	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)Cc3ccc4c(c3)CCO4)C2)C1	1783422485	ZFHQJEFYBQVJSH-JLTOFOAXSA-N	437.334	1.777	50	20	IDGD	
Cc1ccccc1OCC(=O)N1CCO[C@]2(CCN(C(=O)[C@H](C)Br)C2)C1	1783532404	HPJKERUMIIAFSG-HNAYVOBHSA-N	425.323	1.987	50	20	IDGD	
COCCOCCOCCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(C)(C)CCl)[C@H]2C1	1783852746	LYFLNCBRXHAFTH-BZSNNMDCSA-N	448.988	1.301	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CSc3ncccn3)C[C@@H]21	1784617815	DRZIEDVJKSIIBY-VGWMRTNUSA-N	426.970	1.956	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)c1	1785112409	HPZFCGWCCNJXRU-DJJJIMSYSA-N	438.322	1.872	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc(OCF)cn3)[C@H]2C1	1785692726	NEBMQSMONHJKSE-UHXUPSOCSA-N	445.289	1.159	50	20	IDGD	
C[C@@H](C(=O)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1)C1(O)CCC1	1785829596	MGUBGOUDVVERSD-INIZCTEOSA-N	436.317	1.665	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(O)nc(O)c3)[C@H]2C1	1787295391	LXIOAEDNKVBRTH-CNNMYCQVSA-N	432.304	1.322	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)C1=NO[C@H](c2ccccc2)C1	1788141519	KORFJGMLYGQIPN-AEIBSFOJSA-N	435.908	1.083	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc4[nH]ncc4c3)[C@H]2C1	1788274920	HUJSUQFBZJGSTM-JQFCIGGWSA-N	431.569	1.403	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)c1cncc(C(F)(F)F)c1	1789016721	LQDARZADGQRHDF-HJPIBITLSA-N	435.830	1.293	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccccc3-n3nccn3)C[C@@H]21	1789866511	LUZLJPYJYQNKJO-XPYUAMARSA-N	431.924	1.878	50	20	IDGD	
COc1ncccc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]2C1	1789866800	YOTZPBPDIZTJPG-VFSPDHHESA-N	430.332	1.920	50	20	IDGD	
C=C(CC(=O)OCC)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]21	1789892379	WKFXTELZDILBDP-XLPNERPQSA-N	435.348	1.712	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nnsc3C3CC3)C[C@@H]21	1791254401	LVCABZJNACIVQZ-XUXIUFHCSA-N	428.942	1.263	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)c1c(F)ccc(Cl)c1F	1792039046	OWZRNIKWVBOVCH-ZNIXKSQXSA-N	437.270	1.811	50	20	IDGD	
COc1ccc(C2(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@H](O)CCl)CCC2)cc1	1792978522	FKZGERVDBJWTFH-WTLGNFPFSA-N	436.936	1.306	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1CCc2sccc2C1	1794163817	VCCFJJRPZFOGTL-YVSFHVDLSA-N	425.982	1.998	50	20	IDGD	
C[C@H](NC(=O)c1ccccn1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCBr	1795494807	CKYHGYAUQCVXRU-XQLPTFJDSA-N	437.338	1.623	50	20	IDGD	
COc1nccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Br)C3)c1F	1795910304	CHEPOWZTVOTQTF-OTMMVIPVSA-N	434.237	1.123	50	20	IDGD	
CC#CC[C@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)c1ccccc1	1796191579	ZZMPWQFHLYYJMJ-KIHHCIJBSA-N	444.340	1.815	50	20	IDGD	
CCOC(=O)c1ncn2cc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)[C@@H](O)CCl)C4)ccc12	1796374581	WGEOGKMAHKBRIE-IVSAIRAKSA-N	448.907	1.363	50	20	IDGD	
CC(C)Cc1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CCC(=O)NN(C)C)C3)n(C)n1	1796479554	HJSSDZYDUYHZEF-VBUUOAMHSA-N	432.569	1.243	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H](C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](F)Cl)[C@@H](O)C1	1796812219	ZYGCTUBYVNMHCZ-JLZCTACVSA-N	433.908	1.387	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C[C@H]1CNc2ccccc2O1	1797677627	JLWKRZQREMAMGF-MRNSRZSKSA-N	437.924	1.093	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C/N=C/c1ccco1	1797835977	TWZITHOWSRGEQX-UEDKOZLFSA-N	426.311	1.319	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1ccc3c(c1)OCO3)C2	1797954357	APTRLODUWMBVAL-FAQVEIGNSA-N	448.592	1.789	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1c(F)cncc1F	1798238813	UOKKPUOMOZXXGZ-YYHMBLRTSA-N	432.265	1.594	50	20	IDGD	
CCn1nc(C(C)C)cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](Cl)COC)C2	1798737892	BBOKNQHKLNLQTD-KRXQYRFLSA-N	426.945	1.483	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(S(C)(=O)=O)c(F)c1)C2	1799271538	QWKMUIJICWEQHY-LOUJCGABSA-N	446.928	1.450	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc2occc2c1O)c1ccc(B(O)O)cc1	1801048968	YAWJWAFBMLPTIU-BJWYYQGGSA-N	434.257	1.384	50	20	IDGD	
Cc1nn(C)c(C)c1CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)CBr)C2	1801375442	WAJFKZVRWRROLL-ZKRNXSKHSA-N	441.370	1.200	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc(C(F)(F)F)n1)C2	1802337170	IJFSRMJGHGLSIO-BTTYYORXSA-N	441.454	1.725	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)CNC(=O)N(C)C)[C@H]1c1cccnc1	1802681435	AJVRZXKMAFOZSU-DUVNUKRYSA-N	440.342	1.142	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](C)n1cccn1	1803008144	IGPKKMHFQSTZBV-UFYZLLATSA-N	425.493	1.216	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cc(O)nc(Cl)c2)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803142508	XOHVGBIQQCYPFT-RVSPLBMKSA-N	439.299	1.755	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc3nn[nH]c3c2)[C@@H]1c1cccnc1)[C@H](O)CCl	1803148500	RDFZBEWJTMVHRJ-BMGDILEWSA-N	428.880	1.272	50	20	IDGD	
Cc1noc(CC(=O)NC[C@@H]2CCN(C(=O)[C@H](C)Br)[C@@H]2c2cccnc2)n1	1807527707	GXIMNCHLRSCHSE-PZSREKOKSA-N	436.310	1.805	50	20	IDGD	
Cc1nn[nH]c1C(=O)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@@H]1c1cccnc1	1807804663	KEMAGDNJFTVREG-YUTCNCBUSA-N	425.262	1.518	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)C(Cl)Cl)[C@H]1c1cccnc1)c1cnc(O)nc1O	1808283028	ZAQPCMSUMGJCNU-PWSUYJOCSA-N	426.260	1.406	50	20	IDGD	
Cc1ccnc(C(=O)NC[C@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)c1	1808540465	YKFOIXWCUNGGLU-GCJKJVERSA-N	438.532	1.478	50	20	IDGD	
CC(=O)N(C)CCC(=O)N1CC[C@H](CNC(=O)[C@H](C)Br)[C@@H]1c1cccnc1	1812864176	GBSNJCYCWYORMS-XCRHUMRWSA-N	439.354	1.739	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)[C@@H]2CC=CCC2)[C@@H]1c1cccnc1	1813068406	MJXGRSSFJUYNMK-SFGWALBWSA-N	427.549	1.817	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)C1CC2(CCC2)C1	1813650097	UXGBXHCVLFBEQY-DENIHFKCSA-N	447.344	1.661	50	20	IDGD	
C[C@@H](CS(C)(=O)=O)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCBr)[nH]n1	1815226463	DHTILOJLIMMNIV-WCQYABFASA-N	449.371	1.868	50	20	IDGD	
Cc1cccc(CC(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)c1	1816921725	HKGIUXJIWNJCMQ-NRFANRHFSA-N	446.316	1.947	50	20	IDGD	
O=C(N[C@H]1CCc2nc(NC(=O)[C@@H]3Cc4ccccc4CN3)sc2C1)[C@H](O)CCl	1817030340	IJGAYUNCBOMFBI-CWRNSKLLSA-N	434.949	1.369	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CS(C)(=O)=O)n[nH]1	1817057442	WISQECHDYDTUJR-IAQYHMDHSA-N	425.338	1.683	50	20	IDGD	
CCC1(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cnccc2C(=O)NN)CC3)CCC1	1818864244	OTDXGTBHNRDDNE-LBPRGKRZSA-N	442.545	1.948	50	20	IDGD	
O=C(COC(=O)C(F)(F)F)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1	1819311482	AXRNCGLTKQYANV-VHSXEESVSA-N	426.779	1.107	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc(CO)o2)n[nH]1	1819780167	XQWNTLSVPGDOEB-OAHLLOKOSA-N	432.481	1.174	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1[nH]cc2c1CCC2	1820103748	FQPOMSFZXRVBSX-IBGZPJMESA-N	447.304	1.526	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](C)CBr)CC2	1820134011	CQFJSVYMUOUXAU-MXWKQRLJSA-N	443.367	1.777	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)nn1C	1822413407	URLXMHNHYPSPHH-MRXNPFEDSA-N	430.513	1.131	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)CC[C@H]2CCOC2)n[nH]1	1823035385	PXSYLWBPJYQTNH-DOTOQJQBSA-N	434.541	1.592	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(OC)nn2C)CC1	1825478595	JRKOSUFWGLGUPS-HOTGVXAUSA-N	426.945	1.916	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](N)c1ccccn1)CC2	1825640613	BSUFLFOUVPMGCN-IMSIIYSGSA-N	438.351	1.934	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](C)Cn1cccn1)CC2	1825994032	OLZMQQSOTJCGLA-AVGNSLFASA-N	425.942	1.842	50	20	IDGD	
CSCC[C@H](O)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCBr)CC2	1826125098	UGVIHGKHXJKOBK-KOLCDFICSA-N	436.397	1.954	50	20	IDGD	
CC(=O)C(C)(C)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827049074	JLDHYXPWKVNZSN-HXUWFJFHSA-N	428.338	1.215	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](O)CCl)CC2)c1ccc(CO)c(F)c1	1827903026	RWANKYMWIBSEPB-SMDDNHRTSA-N	427.885	1.600	50	20	IDGD	
COC(=O)[C@@H]1CC[C@H](C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)C1	1830353610	GOKILIYJHXAYQI-MRUHUIDDSA-N	444.956	1.297	50	20	IDGD	
COc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)nc1	1830362429	WXYHEDULJJDFPM-FQEVSTJZSA-N	425.913	1.425	50	20	IDGD	
Cc1ccc(C(=O)C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)cc1	1830369826	CAHXKCCPOWSNOV-JOCHJYFZSA-N	436.936	1.899	50	20	IDGD	
O=C(c1cc(-c2ccccc2)no1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1830731709	MEVPFEGLEDXRLK-DYESRHJHSA-N	449.891	1.011	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@H]2CNC(=O)C2)CC1	1831421490	YVKIIPRTTIDUDY-OWCLPIDISA-N	428.371	1.916	50	20	IDGD	
CCN1CCC(C(=O)N2CCC([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)CC1	1831876353	FMRHVFRIDKYEHH-NRFANRHFSA-N	449.640	1.711	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3cnc[nH]3)CCO2)C1	1832813095	DTSCJRIEVUCFHB-QZTJIDSGSA-N	433.336	1.035	50	20	IDGD	
O=C(/C=C/c1cccnc1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1833103610	WSGFITGTPGWATM-SCQSPADBSA-N	442.285	1.242	50	20	IDGD	
C[C@@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)C3CC(=O)C3)CC2)CC1	1833266264	XGIZJNYVFUFSRT-ZDUSSCGKSA-N	428.371	1.568	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cccc4c[nH]nc34)CC2)CC1)[C@H](O)CCl	1833310197	BRYZUQAWUAPHJQ-GOSISDBHSA-N	433.940	1.348	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)C[C@@H](NC)C(=O)O)CC2)CC1	1833532481	REJGGRZFNUZKMC-DLBZAZTESA-N	430.977	1.028	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCC(N2CCC(NC(=O)c3cc(O)ncn3)CC2)CC1	1833554699	FRJLUTSGUQVZTK-LJQANCHMSA-N	444.363	1.604	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCC(N2CCC(NC(=O)CN3CCCC3=O)CC2)CC1	1834626748	AVMMQVPNNLTMEX-HXUWFJFHSA-N	447.407	1.417	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccccc3Cl)CCO2)C1	1835013670	FMIJLGQOSFPYMM-PXNSSMCTSA-N	445.343	1.593	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)C#Cc3ccccc3)CCO2)C1	1835096911	NXBASIIXJORIKV-UWJYYQICSA-N	449.345	1.526	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3[nH]nc4ccncc34)CCO2)C1	1836448039	ZTSYTTGRVGZPSE-YWZLYKJASA-N	435.912	1.435	50	20	IDGD	
COc1ccc(C(=O)N2CCC(OC3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)nc1	1836718366	WIFUGESAYHZSTL-SFHVURJKSA-N	425.913	1.302	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)c3cccn3C)CC2)CC1	1837390498	HVERXRONBVLQMT-UHFFFAOYSA-N	433.553	1.010	50	20	IDGD	
O=C(CCBr)N1CCC(OC2CCN(C(=O)c3cc(O)n[nH]3)CC2)CC1	1837653830	ZVCDTBSMIDXPDK-UHFFFAOYSA-N	429.315	1.513	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccnc(C)c3)CCO2)C1	1837941484	LHTMDONIMDGAMM-QFBILLFUSA-N	440.338	1.634	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3c(F)cncc3F)CCO2)C1	1838168150	BXLBWTYTCAQBQW-APPDUMDISA-N	448.264	1.213	50	20	IDGD	
CCc1ncsc1C(=O)N1CCO[C@@]2(COCCN(C(=O)CCBr)C2)C1	1838836952	PPGCJPWLUYHUPY-QGZVFWFLSA-N	446.367	1.561	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)COc3ccccc3OC)C2)C1	1839141517	KJKVWEXMMOWESX-KKSFZXQISA-N	440.924	1.548	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CN(C)C(=O)OC(C)(C)C)C2)C1	1839143979	NFOKSEKXFUWWJH-YWZLYKJASA-N	447.960	1.327	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C)c([N+](=O)[O-])cn3)C2)C1	1839144567	FFIWOGHMHAIBQY-LIRRHRJNSA-N	440.884	1.386	50	20	IDGD	
Cc1cccc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)n1	1839150788	XQPPGTBALXOPBX-PMACEKPBSA-N	444.359	1.625	50	20	IDGD	
COC(=O)Nc1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)c1	1839244906	QEMXJYFXFDXZQI-BEFAXECRSA-N	443.859	1.469	50	20	IDGD	
Cc1ccc(F)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)c1	1839314159	TUZMLMYTFPABLW-IFXJQAMLSA-N	443.313	1.988	50	20	IDGD	
O=C(C(Cl)Cl)N1CCOC[C@@]2(C1)CN(C(=O)C(F)(F)c1ccco1)CCO2	1839691620	DDPJAIRJRCZJJV-OAHLLOKOSA-N	427.231	1.632	50	20	IDGD	
CCC(=O)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1	1839831846	SEOGFWBPWJRHKZ-KYIYGJGQSA-N	447.438	1.307	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(F)c3Cl)C2)C1	1840155030	NMYJPKQAJPADEF-LIRRHRJNSA-N	449.306	1.803	50	20	IDGD	
CC[C@H]1CC[C@H](C(=O)N2CCOC[C@@]3(CN(C(=O)[C@@H](Cl)COC)CCO3)C2)CC1	1840156503	TZUGTTBCXOSHAQ-NTLWEQJWSA-N	430.973	1.913	50	20	IDGD	
COc1ncc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)cc1C	1840188011	JVHBWPVDTCBHSD-GOSISDBHSA-N	432.304	1.272	50	20	IDGD	
C[C@H](Sc1ccccn1)C(=O)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1840393050	FFEWHFTYTSMJCV-SCLBCKFNSA-N	448.372	1.822	50	20	IDGD	
COc1ccc(Cl)c(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)c1	1840653550	GHNLUYBWHJSHIS-CRAIPNDOSA-N	435.279	1.953	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCCC12CN(C(=O)[C@@]1(C)CCCN1)C2	1841925169	STACQFGPLPDADF-IFXJQAMLSA-N	428.961	1.464	50	20	IDGD	
N=C(N)SCC(=O)N1CCCC12CN(C(=O)[C@H](Br)Cc1ccccc1)C2	1842865176	GNVZFQIBEBWRCG-CQSZACIVSA-N	439.379	1.823	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H]2OC[C@H](C(=O)N3CC4(CCCN4C(=O)[C@@H](F)Cl)C3)[C@H]2C1	1843366536	DHLKDQUZQLZYBT-LXTVHRRPSA-N	445.919	1.606	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1ccc(Cl)cn1)C2	1843416181	ILUDJSGHVWEDOA-ZMOGYAJESA-N	428.880	1.686	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC2(CCCN2C(=O)c2nc3ccccc3n(C)c2=O)C1	1843744269	JEOVOQDENKCWTK-CYBMUJFWSA-N	447.333	1.924	50	20	IDGD	
O=C([C@H](O)CCl)N1CC2(CCCN2C(=O)c2cc(-c3cc[nH]n3)n3ccccc23)C1	1843995632	BAPURGCXWPJPAZ-GOSISDBHSA-N	427.892	1.746	50	20	IDGD	
Cc1cc(C(N)=O)cc(C)c1C(=O)N1CCCC12CN(C(=O)[C@@H](F)Br)C2	1844255446	DALSZVSMEYIVBM-CQSZACIVSA-N	426.286	1.910	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H]2C[C@]21C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl	1847563604	LENMHVRVNKMPIV-AUQLDDPISA-N	427.929	1.187	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cccc(O)n1	1848095648	IZEIUJIJZULXHL-KKUMJFAQSA-N	438.912	1.735	50	20	IDGD	
O=C(NNC(=O)c1ccc(F)cc1F)c1cccc(S(=O)(=O)N2CCOCC2)c1	14907277	WNKHOPHNRQDOMC-UHFFFAOYSA-N	425.413	1.061	50	20	IDGD	
C[C@@H]1CN(S(=O)(=O)c2ccc(C(=O)NNC(=O)Cc3ccc(F)cc3)cc2)C[C@@H](C)O1	15528892	DISUHPAGOQWASB-HUUCEWRRSA-N	449.504	1.627	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)c2ccccc2c1=O	17189065	SYCIKMHMEFUYNC-UHFFFAOYSA-N	436.428	1.974	50	20	IDGD	
Cc1cc(Cl)ccc1OCCCC(=O)NNC(=O)c1cc(S(N)(=O)=O)cn1C	21438826	NMJOBJIHCHYXAM-UHFFFAOYSA-N	428.898	1.255	50	20	IDGD	
O=C(CCn1nnc2ccccc2c1=O)NNC(=O)c1ccc(COc2ccccc2)o1	26632490	LVEYETKCMMOTAZ-UHFFFAOYSA-N	433.424	1.815	50	20	IDGD	
CS(=O)(=O)c1nc(C(=O)NNC(=O)CSc2ccc(Cl)cc2)c2ccccn12	109251875	QPNRCFGUJNURGK-UHFFFAOYSA-N	438.918	1.945	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)NCCCN2CCC[C@H]2C(=O)N(C)C)c1	726277365	MOTUZDYDFIEZAL-IBGZPJMESA-N	447.580	1.770	50	20	IDGD	
CC(C)CNS(=O)(=O)c1ccc(Br)c(C(=O)NNC(=O)c2ccc[nH]2)c1	726630109	HTTZEKJGZVRBSC-UHFFFAOYSA-N	443.323	1.786	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccc(F)cc2F)CC1)NNC(=O)c1cccc([N+](=O)[O-])c1	726971476	KWVUOLFUUTWQBL-UHFFFAOYSA-N	447.398	1.092	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cc(C(=O)NNC(=O)CN(C)C)ccc1Cl	727367210	DSXGXTKOUXMEDJ-UHFFFAOYSA-N	440.909	1.472	50	20	IDGD	
NC(=O)c1ccc(/C=C/C(=O)N2CCC[C@@H]2C(=O)NNc2nc(-c3cccnc3)no2)cc1	728075045	QXLKYCGWYZBBRI-PYUISTEWSA-N	447.455	1.378	50	20	IDGD	
CN(CC1CCN(CC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)CC1)C(=O)OC(C)(C)C	728933936	OBTBICYXBJYCNM-UHFFFAOYSA-N	449.508	1.935	50	20	IDGD	
O=C(NCCCCN1CCN(c2ncccn2)CC1)NNC(=O)c1cc2c(s1)CCC2	729233037	LPXYDDZFXOJINF-UHFFFAOYSA-N	443.577	1.573	50	20	IDGD	
CC1CCC(N2C[C@@H](C(=O)NNC(=O)c3csc(N4CCOCC4)n3)CC2=O)CC1	731343771	RSKWMVTWKBLYQY-SLTAFYQDSA-N	435.550	1.168	50	20	IDGD	
CCCCn1c(C)cc(/C=C(/C#N)C(=O)N[C@@H](C)C(=O)N2CCS(=O)(=O)CC2)c1C	731476643	GXMVOZRUBBAGKM-UEIJICEPSA-N	434.562	1.574	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1	731499720	CCHPLJIPQUCDDT-INIZCTEOSA-N	425.489	1.541	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NN=C2CCS(=O)(=O)c3cc(F)c(F)cc32)c1	731925852	ZCGBFMHXCWNNLY-UHFFFAOYSA-N	428.438	1.680	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@H]2CC[C@H](C(F)(F)F)NC2=O)cc1Br	732175247	IFMSKRAHBIGAHK-GZMMTYOYSA-N	438.200	1.676	50	20	IDGD	
O=C(Cn1ncn2nccc2c1=O)NNc1ccc(Br)cc1C(F)(F)F	732765893	PNAMIJUIYVUNHJ-UHFFFAOYSA-N	431.172	1.816	50	20	IDGD	
Cc1nn(C)c(C(=O)NNc2nc3ccccc3c(=O)n2CCCOC(C)C)c1[N+](=O)[O-]	733266133	QHTSKRJSSVPZHF-UHFFFAOYSA-N	443.464	1.919	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCCc2ccc(O)c(OC)c2)c2ccccc2c1=O	734216591	WIXDEFDRRHRWKS-UHFFFAOYSA-N	425.445	1.317	50	20	IDGD	
CC(C)(C)[C@H]1OCCC[C@H]1CNC(=O)NNC(=O)c1csc(N2CCOCC2)n1	735677371	DZCHZMSIWRIMEA-ZFWWWQNUSA-N	425.555	1.765	50	20	IDGD	
O=C(CNS(=O)(=O)c1cccc(C(F)(F)F)c1)NNC(=O)COCc1ccccc1	737923749	XIKHLNXDDOWDSE-UHFFFAOYSA-N	445.419	1.348	50	20	IDGD	
CSc1ccc(O[C@H](C)C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1	740813339	DPPWQEXARALQOR-CYBMUJFWSA-N	437.543	1.887	50	20	IDGD	
Cc1cc(Br)c(S(=O)(=O)NNC(=O)CNC(=O)c2cccs2)s1	742029706	HGEUFZNSTROPBF-UHFFFAOYSA-N	438.350	1.620	50	20	IDGD	
COCCCOc1cccc(C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)c1	742035974	CIMKWVGGILAGRU-UHFFFAOYSA-N	434.518	1.778	50	20	IDGD	
CN(CC1CCN(CC(=O)NNC(=O)c2cccc(C#N)c2)CC1)C(=O)OC(C)(C)C	744398999	VQLHYZAPGCIJDV-UHFFFAOYSA-N	429.521	1.898	50	20	IDGD	
CCOc1cc(C(=O)OCC(=O)NNC(=O)c2cccc(C)c2)c([N+](=O)[O-])cc1OC	744518541	UAMXRJXTJRXBRA-UHFFFAOYSA-N	431.401	1.929	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NCCCCCC(=O)OC(C)(C)C)c2ccccc2c1=O	745912156	PLMVZQOVINGKRR-UHFFFAOYSA-N	431.493	1.780	50	20	IDGD	
Cc1nc(SCC(=O)NNC(=O)c2nc(-c3ccccc3)n(-c3ccccc3)n2)n[nH]1	746013657	IMHXGYWRRNKTAC-UHFFFAOYSA-N	434.485	1.914	50	20	IDGD	
Cc1nc(SCC(=O)NNC(=O)[C@@H]2Cc3ccccc3CN2Cc2ccccc2)n[nH]1	746185488	MPIYNYGVJJLKLZ-IBGZPJMESA-N	436.541	1.980	50	20	IDGD	
O=C(NNC(=S)Nc1cc(S(=O)(=O)N2CCOCC2)ccc1Cl)c1ccc[nH]1	747768262	VIBZRYCAEQBGAY-UHFFFAOYSA-N	443.938	1.320	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)(F)F)cc1)[C@H]1CC[C@@H](C(F)(F)F)NC1=O	748517976	BWQKXFONBODJDU-UWVGGRQHSA-N	433.330	1.880	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)[C@H]2CCCN2S(=O)(=O)c2cccs2)cc1C	749160262	IJBHPSHPPAUVLS-MRXNPFEDSA-N	437.543	1.744	50	20	IDGD	
Cc1ccc(F)c2c1NC(=O)C2=NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	750911883	HNZRLPSFGCDRQK-UHFFFAOYSA-N	446.460	1.241	50	20	IDGD	
COc1ccc(C(=O)CNC(=O)CCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1	751284555	NTXQWVRUALYDPU-UHFFFAOYSA-N	428.401	1.144	50	20	IDGD	
CCC(=O)NCc1cc(S(=O)(=O)NNC(=O)c2cccc(OC)c2O)ccc1OC	751540751	KTBDWDLCVNRFPW-UHFFFAOYSA-N	437.474	1.059	50	20	IDGD	
CSCC[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)NNC(=S)N[C@@H](C)C1CC1	751618662	IUXFBKNLRZDEOE-NHYWBVRUSA-N	439.563	1.740	50	20	IDGD	
CCn1c(NNC(=O)CNC(=O)c2ccccc2OC(F)F)nc2ccccc2c1=O	751883571	JEEXFEPHAZBKGD-UHFFFAOYSA-N	431.399	1.891	50	20	IDGD	
CCSc1ccc(CC(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1	751918606	YCJMUHUJCWCFPJ-GOSISDBHSA-N	430.482	1.872	50	20	IDGD	
NC(=O)c1cc(CNC(=O)NNC(=O)[C@@H]2Cc3ccccc3CN2Cc2ccccc2)on1	752157325	ZDTLMJATQCREAL-FQEVSTJZSA-N	448.483	1.231	50	20	IDGD	
COCCCn1c(S)nc2cc(C(=O)NNc3cc(Cl)nc(N)n3)ccc2c1=O	753453186	AZCMTMYAFVLCMH-UHFFFAOYSA-N	435.897	1.504	50	20	IDGD	
CN1C(=O)c2cccc3c(S(=O)(=O)NNC(=O)[C@H]4COc5ccccc5O4)ccc1c23	753769061	HXUUCPYBCDRYBB-QGZVFWFLSA-N	439.449	1.579	50	20	IDGD	
Cc1ccc(CNC(=O)NNC(=O)CNC(=O)c2ccco2)c(OCC(F)(F)F)c1	755138226	DGTRVADQTDRLQP-UHFFFAOYSA-N	428.367	1.790	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1S(=O)(=O)N(C)C	755391874	FAKTVNAWEWSJLW-MRXNPFEDSA-N	434.474	1.238	50	20	IDGD	
CON(C)S(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)cc1	755537261	YNRWQGLFHCGWMC-GFCCVEGCSA-N	440.453	1.628	50	20	IDGD	
CN1CCN(C(=O)c2ccccc2NC(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)CC1	755623378	OJOPURXJBJWPEY-UHFFFAOYSA-N	447.499	1.931	50	20	IDGD	
COC(=O)c1ccc(NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1	755829278	VBWNSJFNOSTCEW-UHFFFAOYSA-N	434.474	1.255	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)Nc2cc(F)cc(S(N)(=O)=O)c2)cc1OC	756517599	XZKAXEXWPCZXTK-UHFFFAOYSA-N	440.453	1.737	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)Nc2cnn(C[C@@H]3CCCO3)c2)n[nH]1	756737632	WZHSKXUKZMEHSI-AWEZNQCLSA-N	425.449	1.927	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)Nc1cc(C(N)=O)ccc1CN(C)C	756827028	NHGJMFJQPHBGAG-UHFFFAOYSA-N	431.518	1.801	50	20	IDGD	
COC(=O)CCc1csc(NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)n1	757734692	LPGQGPHOXUBBOE-UHFFFAOYSA-N	426.476	1.119	50	20	IDGD	
COCCOc1ccc(C#N)cc1NC(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	758013474	DXBSKJANDUXDKP-UHFFFAOYSA-N	436.428	1.941	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2ccc(NNC(=O)c3ccnnc3)c([N+](=O)[O-])c2)cc1	761179315	CKMNASWEDAXEGZ-UHFFFAOYSA-N	444.429	1.951	50	20	IDGD	
COc1cc(C(C)=NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)c(OC)cc1O	763127732	IQUXHKCTMCGWDX-UHFFFAOYSA-N	435.502	1.879	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)C(=O)Nc2ccc(S(C)(=O)=O)nc2)c1	763595674	BDFUTYFJNMDJJQ-UHFFFAOYSA-N	448.501	1.082	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(-c2nnc(C)o2)cc1	763662974	CUGOZJDVAQMFHU-UHFFFAOYSA-N	425.401	1.219	50	20	IDGD	
COC(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)COc2cc(C)ccc2C)c1	763666065	WFJQLLJBQWAMRU-UHFFFAOYSA-N	433.848	1.908	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2cccc(-c3ncco3)c2)c2ccccc2c1=O	763785583	JBTNQTABLXRTOT-UHFFFAOYSA-N	446.423	1.471	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(OCC(F)(F)F)cc1	763809156	RWUVWKZMRYVXLL-UHFFFAOYSA-N	436.346	1.664	50	20	IDGD	
CCOC(=O)/C=C/c1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)cc1	763812019	BEXTUDYQROWKKK-FMIVXFBMSA-N	436.424	1.299	50	20	IDGD	
C[C@H](C#N)CSc1ccccc1NC(=O)C(=O)NNC(=O)COc1ccccc1C#N	763814964	XYANMXNSAHIIPL-CQSZACIVSA-N	437.481	1.975	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cccc([S@@](C)=O)c2)cc1	763872603	OWNPMOUHZVYKRY-GNDSEDMPSA-N	431.470	1.180	50	20	IDGD	
Cc1cc(Br)ncc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccc(F)cc1	763873649	WXBFMFUIWSBGMX-SNVBAGLBSA-N	439.241	1.845	50	20	IDGD	
COC(=O)c1c(F)cccc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccc(C(C)=O)cc1	763878684	SPWPSYBFEPWIDJ-GFCCVEGCSA-N	445.403	1.368	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)C(=O)Nc1ccc(-c2n[nH]c(-c3ccccc3)n2)cc1	764000107	ZUKRQNXBKDMDEE-UHFFFAOYSA-N	429.440	1.877	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1ccnn1Cc1ccccn1	764012070	NDDLUSBGWHSWAM-UHFFFAOYSA-N	428.836	1.388	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1ccc(Cl)c(C(N)=O)c1	764012922	UXFBMJQILMPSJR-UHFFFAOYSA-N	425.228	1.501	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2cccc(OCc3cccnc3)c2)c1O	764131658	JBPKHWXGRRCWIM-UHFFFAOYSA-N	436.424	1.775	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)C(=O)Nc1cc2c(cc1Cl)OCO2	764204482	VPAMMIKXQXRZFL-UHFFFAOYSA-N	442.856	1.460	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)c2cccnc12	764204621	YUSWWJAABFVUFJ-UHFFFAOYSA-N	429.477	1.934	50	20	IDGD	
COCCn1ccc2ccc(NC(=O)C(=O)NNC(=O)c3cnn(-c4ccccc4)c3)cc21	764352006	WJJMBAKBOXQCPX-UHFFFAOYSA-N	446.467	1.873	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)C(=O)Nc2cccc(COCCOc3ccccc3)c2)cn1	764363031	KDUWWPFSCOOZIE-UHFFFAOYSA-N	437.456	1.415	50	20	IDGD	
Cn1cnnc1-c1cccc(NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)c1	764382652	OMKBZXXIKHWLEW-UHFFFAOYSA-N	436.457	1.333	50	20	IDGD	
CCOc1ccc(Oc2ccc(C(F)(F)F)cc2NC(=O)C(=O)NNC(=O)CO)cc1	764428199	CRXPBKROZXGDJV-UHFFFAOYSA-N	441.362	1.975	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)c2cccc(N3C(=O)CCC3=O)c2)n[nH]1	765596043	PMAAFINKPDFYMG-UHFFFAOYSA-N	433.424	1.814	50	20	IDGD	
CSc1ncc(Cl)c(C(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)n1	765748686	OFKYWVUXVQLNKD-UHFFFAOYSA-N	448.980	1.739	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)cc1OC	765756302	TVFIFXVALTYBBD-UHFFFAOYSA-N	440.544	1.981	50	20	IDGD	
CCc1noc(CC)c1CC(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	765758449	NKZQEUJWQARVJU-UHFFFAOYSA-N	447.967	1.961	50	20	IDGD	
Cc1ccc(S(N)(=O)=O)c(C(=O)NNc2ccccc2S(=O)(=O)NC(C)(C)C)c1	767846051	AJOKXRRUTUWHQE-UHFFFAOYSA-N	440.547	1.476	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NC[C@]2(C)CCO[C@@H]2C2CC2)cc1	768529188	OPJGOWJTSWHOSP-QUCCMNQESA-N	438.550	1.151	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)c2ccnc(Br)c2N)cc1C	768586735	CEIPSCKCMDWENP-UHFFFAOYSA-N	441.307	1.977	50	20	IDGD	
COc1ccc2c(c1)nc(CNC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)n2C	770560511	IXPFNYRJHPXGDS-UHFFFAOYSA-N	446.489	1.521	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)CCN3C(=O)[C@H]4CCCC[C@@H]4C3=O)nc21	770958844	PWJJUORSTGCICY-RYUDHWBXSA-N	429.481	1.295	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)[C@@H]3CCCN3C(=O)OCC(F)(F)F)nc21	770965719	KRLJALVQFXDXFQ-JTQLQIEISA-N	445.402	1.893	50	20	IDGD	
Cn1c(O)nc2ncc(-c3cccc(C(=O)NNC(=O)Cc4cn5ccccc5n4)c3)cc21	771826272	NBTXACYEVYWBPF-UHFFFAOYSA-N	441.451	1.992	50	20	IDGD	
Cc1cc(C)cc(C(=O)NCC(=O)NNC(=O)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)c1	773417814	IFFHLTXYDGLQNY-MRXNPFEDSA-N	432.521	1.828	50	20	IDGD	
Cc1cc(C(=O)N2CCOCC2)ccc1NC(=O)C(=O)NNc1ccccc1[N+](=O)[O-]	773656077	IDLRIVOJSCNWLO-UHFFFAOYSA-N	427.417	1.457	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCCCC(=O)OC(C)(C)C)c1	774339357	VGBOZEOIHYXFNR-UHFFFAOYSA-N	442.538	1.393	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)NC[C@@H]1CC[C@H](C(=O)N(C)C)O1	775460341	INSZFVXJOZOCKI-ZOCIIQOWSA-N	428.489	1.573	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)NCCOCc1ccc(Cl)cc1Cl	776322308	YWSIKYVZOGEUHR-UHFFFAOYSA-N	429.260	1.863	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)c1cccc([N+](=O)[O-])c1N1CCOCC1	776558944	RIQGWYOYNAFJFS-CYBMUJFWSA-N	432.408	1.799	50	20	IDGD	
CN(C1CCCCC1)S(=O)(=O)N1CCN(C(=O)/C(C#N)=C\c2ccc(O)cc2)CC1	776623542	KGGALURJBZHJLV-SDXDJHTJSA-N	432.546	1.953	50	20	IDGD	
COCc1nnc(-c2cccc(C(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)c2)o1	776701256	CYZNHBRMTYIUKM-UHFFFAOYSA-N	434.412	1.205	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNS(=O)(=O)c1cc(C(=O)O)c(F)cc1Cl	777941931	ZGIJFHRSNXXNPB-UHFFFAOYSA-N	425.822	1.012	50	20	IDGD	
COC[C@H](C)n1ccc(NC(=O)C(=O)NNC(=O)CSc2ccc(Cl)cc2)n1	778706975	JJYCZDNNMSIDLG-NSHDSACASA-N	425.898	1.622	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2Br)n(CCC#N)n1	778750822	CWNNXFPKWKNDRO-UHFFFAOYSA-N	436.226	1.858	50	20	IDGD	
COc1ccccc1[C@](N)(C(=O)NNC(=O)[C@@H]1COc2ccccc2O1)C(F)(F)F	782161554	BHRZPCGYGIFIGS-YJBOKZPZSA-N	425.363	1.399	50	20	IDGD	
O=C(NNc1ccccc1F)C(=O)Nc1ccc(N2CCN(C(=O)C3CC3)CC2)nc1	782708874	UMDYVHLHXAPFJR-UHFFFAOYSA-N	426.452	1.361	50	20	IDGD	
COCCOc1ccc(Br)cc1NC(=O)C(=O)NNc1cncc(Cl)n1	783258264	FTZMIEKQSDGCFT-UHFFFAOYSA-N	444.673	2.000	50	20	IDGD	
Cn1c(=NNC(=O)C(=O)Nc2cc(N3CCNC3=O)ccc2Cl)sc2ccccc21	783349509	KJWHBZFGKXMGLZ-UHFFFAOYSA-N	444.904	1.993	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNc3ccc(Br)nc3)cn2)C[C@H](C)O1	784808830	GPWAQKKZZCWBOS-RYUDHWBXSA-N	449.309	1.935	50	20	IDGD	
CS(=O)(=O)CCn1ccc(NC(=O)C(=O)NNc2c(Cl)cc(F)cc2Cl)n1	784878184	LSAODFNGKKYLJQ-UHFFFAOYSA-N	438.268	1.455	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1ccc(OC)c2cccnc12	785331692	YMUWFSWPAVZYQW-UHFFFAOYSA-N	444.469	1.737	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)[C@@H](CC(N)=O)NC(=O)c2ccccc2Cl)cc1C	786084464	FBGGPRQRLQLVQT-QGZVFWFLSA-N	446.891	1.157	50	20	IDGD	
C[C@H]1[C@@H](C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)CCN1C(=O)OC(C)(C)C	786686841	CBLZEQBYDDKHCL-STQMWFEESA-N	429.477	1.340	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1ccc(Oc2ccccc2F)nc1	787541857	FHXBYZKGNJQKNV-UHFFFAOYSA-N	440.387	1.884	50	20	IDGD	
O=C(COC(=O)CCCc1ccc(O)c(F)c1)NNC(=O)[C@H]1COc2ccccc2O1	787847506	GTFFKANGJOOFOV-GOSISDBHSA-N	432.404	1.385	50	20	IDGD	
CC(C)CN1C[C@H]2CN(C(=O)NNC(=O)[C@H](C)Oc3cccc(Cl)c3)CCN2C1=O	787872200	GMCFIVYKFSAXLF-GOEBONIOSA-N	437.928	1.926	50	20	IDGD	
COc1ccc(OC)c([C@H]2C[C@H]2C(=O)NNC(=O)c2csc(N3CCOCC3)n2)c1	788092800	RYDDFEWFASYKPC-UKRRQHHQSA-N	432.502	1.562	50	20	IDGD	
CCNC(=O)Nc1cccc(NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c1C	788728552	OGVDKENAUPJSNF-UHFFFAOYSA-N	437.460	1.850	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(C#N)cn2C(C)(C)C)o1	789733724	TZLVBGGCZMEWCZ-UHFFFAOYSA-N	428.493	1.949	50	20	IDGD	
CCc1c(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)cnn1CC(C)C	789809625	CEFHFQOKLCLHBY-LPHOPBHVSA-N	427.505	1.760	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)c1ccc2c(c1)C(=O)N(C[C@@H]1CCCO1)C2=O	790065427	NPTRYACUONAJEG-AWEZNQCLSA-N	433.461	1.012	50	20	IDGD	
COc1cc(NNC(=O)[C@@H]2CC(=O)N(c3cccc(S(N)(=O)=O)c3)C2)ccc1Cl	790180757	VKMQELIKLDKJIC-LLVKDONJSA-N	438.893	1.492	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cc(F)cc(Cl)c2N)cc1OC	791480353	XKSVISMHIFOGNA-UHFFFAOYSA-N	425.800	1.697	50	20	IDGD	
O=C(CCc1ccccc1)NNC(=O)C(=O)Nc1ccc(Cc2nnc3n2CCC3)cc1	792268149	JIXMNNBLUQNSSG-UHFFFAOYSA-N	432.484	1.534	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)Cc1ccc(S(=O)(=O)N(C)C)cc1	792800891	JXBNCBVNXQXIGC-UHFFFAOYSA-N	435.502	1.105	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cnc(CC3CC3)nc2)cc1	793021366	CTMGXMKSMSKXFP-ZDUSSCGKSA-N	425.445	1.185	50	20	IDGD	
CC(=NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)C(C)(C)n1cncn1	794465897	QFTDVHBQBODONP-UHFFFAOYSA-N	448.549	1.159	50	20	IDGD	
Cc1cc2c(cc1S(=O)(=O)NNC(=O)c1nn(C(C)C)c(=O)c3ccccc13)OCO2	794866426	NJDFJIYXDHZBOE-UHFFFAOYSA-N	444.469	1.638	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc([N+](=O)[O-])cc(Cl)c1F)[C@H]1COc2ccccc2O1	795280160	DEBACDLHOJEOFS-GFCCVEGCSA-N	431.785	1.537	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccc(F)c(N2CCOC2=O)c1	796989563	HJQHLLKYUGLLBZ-NSHDSACASA-N	448.382	1.475	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)c1cc([N+](=O)[O-])cnc1O	798353693	MTUFZROKCBTFNX-MRVPVSSYSA-N	425.195	1.686	50	20	IDGD	
O=C(CCOc1cccc(I)c1)NNC(=O)N=c1cc[nH]cc1	802031864	LTUXWSUKCVXRQK-UHFFFAOYSA-N	426.214	1.730	50	20	IDGD	
O=C(CC[S@@](=O)c1ccc2c(c1)OCCO2)NNC(=O)Nc1ccc2c(c1)OCO2	802096366	NKYBLDQWZNKJRE-SSEXGKCCSA-N	433.442	1.537	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)[C@@](C)(O)CSc2cccc(F)c2)n1	803802105	MXMOKWSYCLRRGX-SFHVURJKSA-N	441.506	1.367	50	20	IDGD	
O=C(COc1ccc(CCNC(=O)NNc2ccc(-n3ccnc3)nn2)cc1)NC1CC1	804938218	TWPOWGFCGIWQDM-UHFFFAOYSA-N	436.476	1.189	50	20	IDGD	
O=C1COC[C@@H](C[C@@H]2CN(C(=O)C(=O)NNc3cc(F)c(F)c(F)c3)c3ccccc32)N1	807020807	RNTGKJOEVGZBAK-DGCLKSJQSA-N	448.401	1.583	50	20	IDGD	
COCCn1cc(C(=O)NNC(=O)c2cc(-c3ccccc3OC)[nH]n2)c(=O)cc1C	807084071	HUDOHMQXRKDFGE-UHFFFAOYSA-N	425.445	1.277	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NN=C[C@@H]1CCOC1)N(S(C)(=O)=O)CC2	812438779	PVTJOSOTXLSYOQ-XJKSGUPXSA-N	425.507	1.091	50	20	IDGD	
CC1(C)NC(=O)N(c2cccc(NC(=O)NNC(=O)COCc3ccccc3)c2)C1=O	812975373	JZJOCRSZEZAENY-UHFFFAOYSA-N	425.445	1.891	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2c(F)cccc2-n2cccn2)cc1	813033271	LUKBNRBWRAHBET-UHFFFAOYSA-N	446.464	1.344	50	20	IDGD	
CC(=NNC(=O)N[C@@H]1CCS(=O)(=O)C1)c1cc(Br)ccc1OCC(=O)O	814814303	GSWWNCMOYRIQKO-LLVKDONJSA-N	448.295	1.123	50	20	IDGD	
Cn1cnc(S(=O)(=O)NCC(=O)NNc2cc(C(F)(F)F)cc(C(F)(F)F)c2)c1	817016671	GNIHVYFCYKKPFJ-UHFFFAOYSA-N	445.345	1.879	50	20	IDGD	
CC(C)C(=O)NN=Cc1c(Sc2nnnn2-c2ccccc2)nc2ccccn2c1=O	818238069	GAAFDPKRKOTFDN-UHFFFAOYSA-N	434.485	1.928	50	20	IDGD	
O=C(CCNS(=O)(=O)/C=C\c1ccccc1)NNC(=S)NCCc1cccs1	849366705	YNNUPQXLWIMXLS-UVTDQMKNSA-N	438.600	1.766	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)c([N+](=O)[O-])cc1OC	859237317	FDUROOCESDFJKC-UHFFFAOYSA-N	435.389	1.713	50	20	IDGD	
COC(=O)c1cccc(NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1	861732751	OFGYMJXMVQKVMH-UHFFFAOYSA-N	446.485	1.724	50	20	IDGD	
COCCN1C[C@@H](C(=O)NNC(=O)c2cn(-c3ccccc3)nc2-c2ccccc2)CC1=O	914457764	LQVALQJBGBAIAJ-SFHVURJKSA-N	447.495	1.795	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)NCc1ccc(-n2ccnc2)nc1	914535166	NYMMQYXUUBJNQH-UHFFFAOYSA-N	445.277	1.939	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@H]2C(=O)NNC(=O)COc2ccc(F)cc2)c(OC)c1	915188653	IKNUIWKUUUXSAV-SFHVURJKSA-N	445.447	1.674	50	20	IDGD	
O=C(NC[C@@H](c1ccc(F)cc1)N1CCOCC1)NNC(=O)c1ccc2c(c1)OCCO2	915897377	DWNHBUMFDKTDJT-SFHVURJKSA-N	444.463	1.614	50	20	IDGD	
O=C(NC[C@H](c1ccc(F)cc1)N1CCOCC1)NNC(=O)c1cccc([N+](=O)[O-])c1	915897749	JOBAXUQYQBAKMV-GOSISDBHSA-N	431.424	1.751	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)ccc1OCC(=O)NC(C)C	916032110	PAQKTNCKHGTTHW-UHFFFAOYSA-N	430.417	1.582	50	20	IDGD	
Cn1ccnc1[C@@](O)(CCNC(=O)NN=c1sc2ccccc2n1C)C(F)(F)F	916380877	SCZABQNYXBDDSQ-INIZCTEOSA-N	428.440	1.928	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H]2CCN3CCC[C@H]3C2)c1	916573269	JTOOQHRIPJXYIZ-IRXDYDNUSA-N	437.566	1.288	50	20	IDGD	
CC[C@H]1CCCC[C@@H]1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	916634851	RKICFJKDQULNGO-YJBOKZPZSA-N	438.550	1.620	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)c2cccc(NC(=O)[C@H]3Cc4ccccc4O3)c2)n1	917392142	RPNIDFWGTXHJLE-HXUWFJFHSA-N	433.468	1.903	50	20	IDGD	
CC(C)C(=O)N1CCCC[C@@H]1C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	917532358	UCSVFXWUMKIJSI-HXUWFJFHSA-N	429.565	1.383	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)NCCS(=O)(=O)NCc2ccccc2)cc1	919907409	UTSIGJINFQXRHB-UHFFFAOYSA-N	434.518	1.078	50	20	IDGD	
COc1ccc(CCC(=O)N2CCN(CC(=O)NNC(=O)c3ccc(F)cc3)CC2)cc1	921061888	SXNZQAWKKWJADE-UHFFFAOYSA-N	442.491	1.372	50	20	IDGD	
CCNC(=O)COc1cccc(CNC(=O)NNC(=O)c2cncn2-c2ccccc2)c1	1319491884	IIEMCILNSSSVDE-UHFFFAOYSA-N	436.472	1.531	50	20	IDGD	
Cn1ccc2c(O)ncc(C(=O)N3CC[C@H]4OCCC[C@@]4(CNC(=O)[C@H](F)Cl)C3)c21	1778030837	NCRPMSONIFRJNT-PTSWNOGYSA-N	438.887	1.941	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@](C)(Cl)CCl)C2	1778105629	FDTMTYPAKITNBE-SVYNMNNPSA-N	436.380	1.603	50	20	IDGD	
COc1nc(C)ccc1C(=O)N1CC[C@]2(CN(C(=O)CCBr)CCO2)C1	1779738275	PXTYRHACLGAZFD-SFHVURJKSA-N	426.311	1.627	50	20	IDGD	
Cn1ccc(=O)cc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCBr)C2	1780055481	XPEWWKGEIXLKOH-VQIMIIECSA-N	440.338	1.298	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)nn1C(F)F	1780305769	BTBWRJVVBZDIDH-IAQYHMDHSA-N	439.232	1.721	50	20	IDGD	
CCc1cc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](F)Br)C2)n[nH]1	1780773048	BFNXWVBJPMIMIS-CKEIUWERSA-N	431.306	1.790	50	20	IDGD	
O=C(CCc1noc(-c2ccccc2)n1)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1780894352	KTQQBRZFXRVYRR-KKSFZXQISA-N	448.907	1.099	50	20	IDGD	
O=C(c1ccc([N+](=O)[O-])cc1F)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781334080	UURUFOPPYCOKDE-XJKSGUPXSA-N	448.220	1.868	50	20	IDGD	
COC(=O)CCCCCC(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781335247	WQHNQINAHBGCMD-WBVHZDCISA-N	437.306	1.630	50	20	IDGD	
N#Cc1cc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)cc(C(F)(F)F)c1	1782031022	QOEWCNAVVDOHRP-MAUKXSAKSA-N	445.825	1.620	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cccc4c3NC(=O)C4)C2)C1	1782411980	MNODMKXDJXHLLB-UXHICEINSA-N	440.327	1.861	50	20	IDGD	
CN1CCC(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CO[Si](C)(C)C)C[C@@H]32)CC1	1783654823	YYGCGJMIEIYVJN-FHWLQOOXSA-N	425.646	1.550	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc4cc(OC)ccc4n3)CCO2)C1	1783875359	QCNIJYDONJGHBY-HTAPYJJXSA-N	447.919	1.941	50	20	IDGD	
CO[C@H](C)C(=O)N1CC[C@@]2(CN(C(=O)[C@@H](Br)Cc3ccccc3)CCO2)C1	1783993730	FZHNSOHGIWBGJJ-SYNHAJSKSA-N	439.350	1.857	50	20	IDGD	
O=C(Cc1ccc2ccccc2c1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21	1786447520	ORLHJPJHVUFWKI-BURNTYAHSA-N	430.932	1.962	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)Nc3nccs3)[C@H]2C1	1787490072	YXIBSRHQCHJCNJ-NDKCEZKHSA-N	445.383	1.707	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CC[C@H]4CCC(=O)N4C3)C[C@@H]21	1789867066	WSCLHUNIDPPLEV-PXOUGSPUSA-N	425.957	1.385	50	20	IDGD	
Cc1noc(C)c1CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]2C1	1789922898	XIILOASSCUSNRE-PCBIJLKTSA-N	432.290	1.504	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccnc(Cl)n3)C[C@@H]21)[C@H](F)Br	1789924445	DLBDQMKXALAUPM-QSFUFRPTSA-N	435.681	1.414	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc4[nH]ncc4c3)C[C@@H]21)[C@H](F)Br	1789926441	YEXOHWBAJXGCSH-HBEIAFGSSA-N	440.273	1.242	50	20	IDGD	
O=C1Cc2cccc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)C(Cl)Cl)C[C@@H]43)c2N1	1790448432	BNRGCLQWGACNRL-UBHSHLNASA-N	426.300	1.578	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ncccc3F)C[C@@H]21	1790960599	NIEOMPCMTLRGCY-ABHRYQDASA-N	428.302	1.988	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnn4ccccc34)C[C@@H]21	1791057207	IQOZCNIABGMSJR-HPZZRFSDSA-N	435.322	1.711	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)NNc3ccccc3)C[C@@H]21	1791250276	CLKOKRQXGHHTDE-UYKLPWQDSA-N	438.956	1.225	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccnc(C(F)(F)F)c3)C[C@@H]21	1791252408	KPKJNUOSCKWELC-XQLPTFJDSA-N	449.857	1.948	50	20	IDGD	
COc1ccccc1OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2	1792719141	JFOIGEOEICLCTL-HBCWATKFSA-N	441.322	1.449	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(=O)c2ccccc2o1)c1ccc(B(O)O)cc1	1792849911	AKSXTPGEDMFUSH-BCDXTJNWSA-N	446.268	1.038	50	20	IDGD	
Cc1cc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)CBr)ccn1	1792868824	QRLFXWDDAOXPSF-KUZCPNRJSA-N	438.366	1.943	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccnc1OCC1CC1	1794450296	LVUTWRZYWDJUMI-CYGHRXIMSA-N	437.924	1.327	50	20	IDGD	
COc1ncc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCBr)C3)cc1C	1794984451	WIDHGJBZVKLRFS-MIFYACCESA-N	426.311	1.387	50	20	IDGD	
Cc1cc2nnc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)CCBr)c(C)n2n1	1795492312	IFQPRNLLYDPMNA-BTTYYORXSA-N	435.326	1.778	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)c1cc(F)cc(F)c1F	1796190577	NPAZBNITZQNVQT-MUJYYYPQSA-N	432.207	1.349	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Cl	1796371439	YQEHHGAOKKUWRC-FJFWCWKTSA-N	427.810	1.996	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1Cc2ccccc2O1	1797226727	HFMXMQPTDCQTOS-QUYZETPZSA-N	427.328	1.816	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(OC)ccn1	1798108868	LQBNXRZWQISKBW-LMWOUKEDSA-N	426.311	1.467	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CC[C@@H]3CCC(=O)N3C1)C2	1799277394	YQJFMWDDFWALAT-XIRVDMFSSA-N	446.375	1.213	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(-n2cccn2)cc1	1799600687	ALUJJJKHPMESDT-NYCLONFESA-N	447.333	1.859	50	20	IDGD	
C[C@H](Oc1cccnc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)Br	1800762892	JITNZMGHSKIRTE-YMSVYLFOSA-N	426.311	1.222	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(=O)Nc1c(C)cccc1C)C2	1800976974	FEGGOHMDSQDBNF-KYHPRHEASA-N	437.924	1.085	50	20	IDGD	
CN1Cc2ccccc2C[C@@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(Cl)Cl	1801015961	SKGVRRHUQDIESP-YYIAUSFCSA-N	426.344	1.436	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCNC(=O)OC(C)(C)C	1801958115	KLVBRWLBHODATH-XPCVCDNBSA-N	448.358	1.274	50	20	IDGD	
CC1(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Cl)C3)CN(C(=O)OC(C)(C)C)C1	1802220871	NIMQZCVBZRBSBJ-XRGAULLZSA-N	447.935	1.758	50	20	IDGD	
Cc1cc(C)cc(CCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)c1	1802656553	CXKIXBUGTIMAHG-NUNAXRQHSA-N	434.345	1.868	50	20	IDGD	
C[C@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnccc1C(=O)NN)C2)c1cccs1	1802852884	YZRJMZFOMJACLM-XQLPTFJDSA-N	427.530	1.802	50	20	IDGD	
CCC(=O)N[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@H]1c1cccnc1	1803434956	YPAXBTBTKZADRO-XTBFLFJDSA-N	443.317	1.693	50	20	IDGD	
COc1nn(C)cc1C(=O)NC[C@@H]1CCN(C(=O)C(Cl)Cl)[C@H]1c1cccnc1	1805308504	QUTGJNFUUCZTTA-JSGCOSHPSA-N	426.304	1.947	50	20	IDGD	
Cn1c(C(=O)NC[C@@H]2CCN(C(=O)CO[Si](C)(C)C)[C@@H]2c2cccnc2)cccc1=O	1805313996	ADRAEQBNGBDLKE-LAUBAEHRSA-N	442.592	1.951	50	20	IDGD	
Cc1nc(C(=O)NC[C@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)co1	1805694517	OXYGNMMJURAYTC-UZLBHIALSA-N	428.493	1.071	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)CCSC(=N)N)[C@@H]1c1cccnc1	1807127977	YFPZQVGPVISVKY-WHOFXGATSA-N	442.383	1.888	50	20	IDGD	
O=C(/C=C/c1cccnc1)N1CCCC2(CCN(C(=O)c3ccc(B(O)O)cc3)CC2)C1	1807162560	GOYYXXPSZJIZFD-RUDMXATFSA-N	433.317	1.320	50	20	IDGD	
O=C(CCc1ccccn1)N1CCCC2(CCN(C(=O)c3cccc(B(O)O)c3)CC2)C1	1807253621	UPIHGWHXEAMNOM-UHFFFAOYSA-N	435.333	1.239	50	20	IDGD	
Cc1occc1C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1807363999	RQCWOYVFSVKKJX-GHTZIAJQSA-N	433.273	1.296	50	20	IDGD	
Cc1cc(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)cn1C	1808724676	WGJYHEXFTOAPBZ-KNQAVFIVSA-N	446.316	1.042	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)c1ccc2cncn2c1	1810007405	UUIDWUVLEVGUGL-IPELMVKDSA-N	427.892	1.649	50	20	IDGD	
Cc1c[nH]cc1C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1	1810301944	DYPSUDSADNXTRV-UZLBHIALSA-N	447.499	1.350	50	20	IDGD	
C[C@H](Cn1cncn1)C(=O)NC[C@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1	1810474624	DVBLILLJMFWZKS-KYJSFNMBSA-N	449.353	1.800	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)CCc2cncnc2)[C@H]1c1cccnc1	1813030770	KZCWDUGFOQYPDM-HBFSDRIKSA-N	431.924	1.764	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)COc2ccc(O)nn2)[C@H]1c1cccnc1)C(Cl)Cl	1813081154	JHCVLCDITRBVQB-WBMJQRKESA-N	440.287	1.466	50	20	IDGD	
COc1ccc([C@H](O)C(=O)Nc2cc([C@@H]3CCCCN3C(=O)[C@H](O)CCl)[nH]n2)cc1	1814632433	HJKSSSAYZHOMRI-JZXOWHBKSA-N	436.896	1.744	50	20	IDGD	
Nc1c(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)[C@@H](O)CCl)n[nH]2)sc2nccnc12	1814870257	MSVQPFLJROCDNK-MNOVXSKESA-N	449.924	1.902	50	20	IDGD	
C[C@H](CS(C)(=O)=O)C(=O)Nc1cc([C@H]2CCCCN2C(=O)C(Cl)Cl)[nH]n1	1815232696	PQMPDXGZDDZECI-MWLCHTKSSA-N	425.338	1.886	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)C(=O)Nc3cccnc3)sc2C1	1820052618	UKYLSCDVPLHZAC-PWSUYJOCSA-N	437.909	1.343	50	20	IDGD	
Cc1c(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@@H](F)Cl)CC3)cn2[nH]cnc(=O)c12	1821220540	CCFUOWIOIHHPPM-AMIZOPFISA-N	438.872	1.548	50	20	IDGD	
CN1CCC(CC(=O)N2CCCC[C@@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)CC1	1822412795	TUMMANOHSXDJJY-GOSISDBHSA-N	447.584	1.507	50	20	IDGD	
O=C(N[C@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1)c1cc(O)nc(O)c1	1823003383	ILTMEPXELZKPPK-MADCSZMMSA-N	445.270	1.866	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC([C@H]2CCCCN2C(=O)CNC(=O)N(C)C)CC1	1823881409	AVCRCGMICUVWKG-UKRRQHHQSA-N	431.375	1.661	50	20	IDGD	
C=CCO[C@@H](C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1	1824504926	VZRCKGFTWUOMED-LAUBAEHRSA-N	428.338	1.191	50	20	IDGD	
Cc1cnc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)cn1	1825873465	RYFLZEJQEGYIDC-NRFANRHFSA-N	436.321	1.012	50	20	IDGD	
CN1CCN(CC(=O)N2CCC([C@@H]3CCCCN3C(=O)CCBr)CC2)CC1	1826358823	MHJHZCIOKLPDAS-SFHVURJKSA-N	443.430	1.639	50	20	IDGD	
C[C@@H](C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCBr)CC2)n1cncn1	1826787322	UOUXRCWBKWPBPO-VHSXEESVSA-N	427.328	1.693	50	20	IDGD	
CCc1cc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)no1	1827057948	OGPGSRMJKPSMQO-NRFANRHFSA-N	439.321	1.464	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCN2C(=O)C=CC2=O)CC1	1829099438	KSDLZQWGUYBZHJ-GOSISDBHSA-N	449.624	1.773	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(OC)n(C)n2)CC1	1829847170	ZLTSMBUXWVCHSQ-DOTOQJQBSA-N	426.945	1.916	50	20	IDGD	
CN1N=C(C(=O)N2CCC([C@@H]3CCCCN3C(=O)[C@@H](F)Br)CC2)CCC1=O	1830375637	FKXFPNPDCQOALR-GOEBONIOSA-N	445.333	1.905	50	20	IDGD	
C[C@H](C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1)c1ccc(Cl)cc1	1830719873	NCOFDMGDMDNAMH-JNAXZKDPSA-N	445.343	1.500	50	20	IDGD	
C[Si](C)(C)C#CCCCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1830731593	MTODHJWHIBPDLF-XLIONFOSSA-N	445.032	1.094	50	20	IDGD	
CC[C@H](C)[C@H](O)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1	1831517008	LJWKFOZMVXVBEF-LBTBCDHLSA-N	425.353	1.086	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc(OC)c(C)c3)C2)C1	1831643966	MHZCDSPHXXABOP-UWJYYQICSA-N	439.940	1.876	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3sc(N)nc3C)C2)C1	1831647200	SFYYJWNZWGJFKQ-UGSOOPFHSA-N	430.958	1.511	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc([N+](=O)[O-])[nH]3)C2)C1	1831653707	CWYVAORDUMWZSM-SCLBCKFNSA-N	428.873	1.400	50	20	IDGD	
Cc1cccnc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1	1831835364	UUCYEJCZIARKCR-OALUTQOASA-N	430.332	1.696	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)C[C@@H]3CCCCO3)CCO2)C1	1832351499	PDCBUTGLTFVNON-TXPKVOOTSA-N	447.370	1.576	50	20	IDGD	
C=CCSCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1832458703	WRNYXFFHSFSRGW-UKRRQHHQSA-N	425.320	1.053	50	20	IDGD	
Cc1cn(CC(=O)N2CCCC[C@H]2C2CCN(C(=O)[C@@H](F)Cl)CC2)c(=O)nc1O	1832772930	HBLOVFUEFYMNBY-GOEBONIOSA-N	428.892	1.411	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)/C=C/c3cccs3)CC2)CC1)[C@H](O)CCl	1833310873	WZJURDOPRYUGOM-OAJJDEHYSA-N	425.982	1.933	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccncc3)CCO2)C1	1834012273	WKBXSTWLAIPUDA-KBXCAEBGSA-N	426.311	1.183	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)[C@@H]3[C@@H]4C=CS[C@@H]34)C2)C1	1834825478	YIMXLIOHNAQMTE-DPAVQSFQSA-N	431.352	1.103	50	20	IDGD	
CCCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)C1	1834877385	NOUMFUAXFADHFW-YWZLYKJASA-N	447.960	1.375	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccsc3)CCO2)C1	1836102035	ZVNUOOAFCVYJHJ-CRAIPNDOSA-N	445.379	1.921	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)c1cccc2ccnn12	1836479505	KFJHATOJSAKJNS-LJQANCHMSA-N	433.940	1.119	50	20	IDGD	
CC(=O)NCCC(=O)N1CCC(OC2CCN(C(=O)[C@@H](C)CBr)CC2)CC1	1836673643	INJZOMOPUHRITI-AWEZNQCLSA-N	446.386	1.542	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cccn3ccnc13)CCO2	1837000188	HTLJGCXUZGMVQX-OAQYLSRUSA-N	446.580	1.256	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(F)s3)C2)C1	1837709906	AHECQGJRFJSSOJ-GOSISDBHSA-N	430.574	1.809	50	20	IDGD	
N[C@H](C(=O)N1CCC(OC2CCN(C(=O)C(Cl)Cl)CC2)CC1)c1ccccn1	1837875642	HCDWUHCSNXCESU-INIZCTEOSA-N	429.348	1.884	50	20	IDGD	
Cc1cc(C(=O)NCC(=O)N2CCC(OC3CCN(C(=O)[C@@H](F)Cl)CC3)CC2)no1	1838083150	ZZIPIRLLADMBJI-QGZVFWFLSA-N	444.891	1.246	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3n[nH]cc3[N+](=O)[O-])CC2)CC1	1838443841	LMLUUHNKRZBSPS-CQSZACIVSA-N	443.888	1.184	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cnn(C)c3Cl)CC2)CC1	1838507254	QAUAYLHXNXKKCX-MRXNPFEDSA-N	447.363	1.940	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)CSCC(=O)O)CC2)CC1	1838787121	TXPHAIIUHKZQRW-HNNXBMFYSA-N	436.958	1.057	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3c(F)cccc3F)CCO2)C1	1838864285	XHKWGAVSNQWQKY-KZULUSFZSA-N	447.276	1.818	50	20	IDGD	
CCn1nccc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2	1839151359	PCXURXMMYRGJAN-ZWKOTPCHSA-N	433.336	1.209	50	20	IDGD	
CCc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)no1	1839153258	DKXCSVJBFCCMGD-ZWKOTPCHSA-N	434.320	1.543	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc4ccnn4c3)CCO2)C1	1839569278	WDZZQJGSOLXRFB-RXVVDRJESA-N	434.924	1.812	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc4c(c3)NC(=O)CC4)CCO2)C1	1839609269	ATTXUKGYKCLCGC-VGOFRKELSA-N	449.935	1.659	50	20	IDGD	
Cc1cccn2ncc(C(=O)N3CCO[C@]4(COCCN(C(=O)C(C)(C)CCl)C4)C3)c12	1839610634	VIHMBXJBYNZZMA-JOCHJYFZSA-N	448.951	1.978	50	20	IDGD	
O=C(C(Cl)Cl)N1CCO[C@]2(COCCN(C(=O)C(F)(F)c3ccco3)C2)C1	1840189766	KXVVIEFLAJIBEG-OAHLLOKOSA-N	427.231	1.632	50	20	IDGD	
COc1ccc(F)c(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)c1	1840190790	MXBOSQDPPNOFNW-SFHVURJKSA-N	435.279	1.708	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H](CC(=O)N2CC3(CCCN3C(=O)[C@H](O)CCl)C2)C1	1841354233	OYMRULSTOZMSCZ-LSDHHAIUSA-N	429.945	1.437	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2n[nH]c3c2CCCC3)C1	1843264395	FJUIUZYPIJSPJG-ZVHZXABRSA-N	437.504	1.240	50	20	IDGD	
CCOC(=O)c1ncn2c1CC[C@H](C(=O)N1CC3(CCCN3C(=O)[C@H](F)Cl)C1)C2	1843365927	SAQHIQILBNKLEC-WFASDCNBSA-N	426.876	1.360	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)[C@H](F)Br)C2	1843416640	IVXQXFTVYSYVGI-QDBSGRMGSA-N	428.262	1.014	50	20	IDGD	
O=C([C@H](F)Br)N1CC2(CCCN2C(=O)c2cc(=O)nc3sccn23)C1	1844625266	ULKVBBQODLERJX-NSHDSACASA-N	429.271	1.264	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)c2nn(C)c(C)c2Br)C1	1844810715	PKONEYZFXBZDLA-LLVKDONJSA-N	433.734	1.562	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC12CN(C(=O)CCN1C(=O)c3ccccc3C1=O)C2	1846175676	LZZCIFXVZPRTBR-ZDUSSCGKSA-N	448.317	1.660	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC12CN(C(=O)c1ccc(S(C)(=O)=O)cn1)C2	1846175916	BMWPMOHNFGPPRU-NSHDSACASA-N	430.324	1.086	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@](C)(NC(C)=O)c1ccccc1F)C2	1846363826	GTQPMQLUTIZWIS-OXQOHEQNSA-N	439.915	1.634	50	20	IDGD	
CCn1c(NNC(=O)CN2C(=O)N[C@](C)(c3ccc(C)cc3)C2=O)nc2ccccc2c1=O	10681803	ZXXYFZCJFASNPB-HSZRJFAPSA-N	448.483	1.635	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)[C@H](NC(C)=O)C1CCCC1	12837576	SQZUZPWJXYRFID-QGZVFWFLSA-N	425.869	1.348	50	20	IDGD	
O=C(COc1ccc(Br)cc1F)NNC(=O)[C@@H]1COc2ccccc2O1	15794919	RPCVUXDSUXGBBH-HNNXBMFYSA-N	425.210	1.954	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)c1cc(Br)sc1Br	303607485	BBFXSHULNMQRJD-YFKPBYRVSA-N	446.142	1.469	50	20	IDGD	
C#Cc1cccc(NC(=S)NNC(=O)c2cc(S(=O)(=O)N(CC)CC)cn2C)c1	727497609	AQHDQNIKXAGEMO-UHFFFAOYSA-N	433.559	1.668	50	20	IDGD	
C#Cc1cccc(NC(=S)NNC(=O)CCNS(=O)(=O)c2ccc(C)c(C)c2)c1	727501542	YUDUBIRRXHXZIL-UHFFFAOYSA-N	430.555	1.971	50	20	IDGD	
CCC(=O)N[C@@H](CCSC)C(=O)NNC(=O)c1cc(OC)ccc1Br	728526484	WVMPBNJPRVQNQU-ZDUSSCGKSA-N	432.340	1.867	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc(Cl)ccc1[N+](=O)[O-])C1CCN(c2ncccn2)CC1	728854321	QVPFMHUZMAVFRE-UHFFFAOYSA-N	440.869	1.264	50	20	IDGD	
C[C@H]1CCCC[C@@]12NC(=O)N(CC(=O)NNc1ccc(S(=O)(=O)C(F)F)cc1)C2=O	728976143	IJQPOKCPZVXLBP-BBATYDOGSA-N	444.460	1.627	50	20	IDGD	
CC(C)n1ncc2c(C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)cc(-c3ccccc3)nc21	729275257	MUNLJPKSNGJSEB-ZDUSSCGKSA-N	444.517	1.378	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NC[C@@H]1CN2CCC[C@H]2CO1	729494866	HYGORQCHTFDODB-DUVNUKRYSA-N	441.326	1.410	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)c2ccc3c(c2)CCCN3S(C)(=O)=O)cn1	729693208	NSCSJAXRMFWTDD-UHFFFAOYSA-N	435.531	1.434	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@@H]2CCc3ccc(C)cc32)cc1	730133002	YWCVHEVZNPKRSL-LJQANCHMSA-N	430.530	1.942	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)NNC(=O)[C@H]1CCN(c2ccc3c(c2)OCCO3)C1=O	730515144	PUBCKROQPYRTQJ-QGZVFWFLSA-N	434.452	1.682	50	20	IDGD	
COc1ccc(-n2cnnc2SCC(=O)NNC(=O)COc2ccccc2O)cc1	730779499	BNIBAMNVDXDVGJ-UHFFFAOYSA-N	429.458	1.300	50	20	IDGD	
NC(=O)[C@H]1CCCN(Cc2cccc(CNC(=O)NNC(=O)c3ccccc3O)c2)C1	731116621	CNLQNYIWTYHDDS-KRWDZBQOSA-N	425.489	1.234	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)NCc1cccc(OCCN2CCOCC2)c1	731499534	ZWKMMWNCXAJRGO-UHFFFAOYSA-N	428.489	1.550	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)N[C@@H]1CCN(c2ccccc2Cl)C1=O	732469134	ABWCQPLMGRXHRA-CQSZACIVSA-N	430.848	1.861	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)NCC(=O)NNc2ccc(Br)nc2)cc1	732837388	ZCBNEGURZJJQMO-UHFFFAOYSA-N	427.280	1.468	50	20	IDGD	
Cc1ccc(S(=O)(=O)c2ccc(NNC(=O)[C@@H]3CCCN3S(C)(=O)=O)cc2)cc1	733040217	INOUPIQBCIBKQX-SFHVURJKSA-N	437.543	1.695	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN(C)C)cc1S(=O)(=O)N1CCCc2ccccc21	733359911	VENANZSYPVLZFW-UHFFFAOYSA-N	446.529	1.159	50	20	IDGD	
O=C(CN1C(=O)NC2(CCCC2)C1=O)NNc1cc(C(F)(F)F)nc(-c2cccnc2)n1	734257965	ZJDPSHQWSZZINQ-UHFFFAOYSA-N	449.393	1.865	50	20	IDGD	
CCc1nc(COc2ccc(C(=O)NNC(=O)CCN3C[C@H](C)O[C@@H](C)C3)cc2)no1	734541577	AXARRUDOSZIACT-GJZGRUSLSA-N	431.493	1.471	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCc4ccccc43)c2)cn1	735445976	NAIAHCRKOBYBGD-UHFFFAOYSA-N	425.470	1.246	50	20	IDGD	
Cc1ccsc1C(Cc1ccccc1)=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O	735972934	ZDWDMSHGBRPVFG-UHFFFAOYSA-N	443.554	1.704	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)[C@H](Cc1ccccc1)NC(=O)c1cccnc1	737926934	PRHLQCYAMUTLBT-NRFANRHFSA-N	432.480	1.787	50	20	IDGD	
CN(CCN1CCN(c2ccccc2)CC1)CC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	738339209	HKTKWWLNINKPJR-UHFFFAOYSA-N	440.504	1.110	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NNC(=O)COCc2ccccc2)ccc1OC(C)C	738497183	NDAHLYIBSMDVSW-UHFFFAOYSA-N	430.461	1.674	50	20	IDGD	
COC(=O)c1ccc(N2CCN(C(=O)NNC(=O)COCc3ccccc3)[C@H](C)C2)cc1	738497441	VHSDKOJPIYMENG-QGZVFWFLSA-N	440.500	1.941	50	20	IDGD	
C#Cc1cccc(NC(=S)NNC(=O)CN(C)S(=O)(=O)c2cccc([N+](=O)[O-])c2)c1	738561409	SWYYSBDBWUGNJH-UHFFFAOYSA-N	447.498	1.214	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(=O)n(CC(=O)NNc2ncccc2C(F)(F)F)c1	740093667	SNRKLHSYQMAGTB-UHFFFAOYSA-N	447.439	1.436	50	20	IDGD	
C[C@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(C(=O)NNc3ccnc(N(C)C)n3)cc2)C1	740105026	USLWCIWXZCTETC-GASCZTMLSA-N	432.550	1.966	50	20	IDGD	
C#CCSCCNC(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	740487765	MAZPXYKNRDNTSM-UHFFFAOYSA-N	435.509	1.755	50	20	IDGD	
O=C(COC(=O)c1ccc(N2CCC(O)CC2)cc1)NNC(=O)c1ccc(Cl)cc1	740963285	WAKFDFFXSPONQV-UHFFFAOYSA-N	431.876	1.919	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)NCC1(c2ccccc2Br)CC1	741275978	OPBOJYCCWAURHV-UHFFFAOYSA-N	435.278	1.834	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)n1	741330737	RVACEOBHBAXQKE-MRXNPFEDSA-N	448.520	1.736	50	20	IDGD	
CC(=O)N[C@H](Cc1c[nH]c2ccc(Br)cc12)C(=O)NNc1nnc(C)c(O)n1	743295653	QCIHMICQIHGAQL-CQSZACIVSA-N	448.281	1.320	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)Cn2cc([N+](=O)[O-])nc2C)c2ccccc2c1=O	743737904	IPCPWEJIEBLXOQ-UHFFFAOYSA-N	441.448	1.461	50	20	IDGD	
COc1cc(C(=O)NCC(=O)NNC(=O)Nc2ccc(N(C)C)cc2)cc(OC)c1OC	743827279	CMUDXAAAHLJOKS-UHFFFAOYSA-N	445.476	1.361	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)[C@@H](C)Cc2c(C)nn(C)c2C)cc1OC	745274801	GHRUUVLYVZOGIV-LBPRGKRZSA-N	432.477	1.237	50	20	IDGD	
C[C@@H]1CN(Cc2cccc(CNC(=O)NNC(=O)c3cc([N+](=O)[O-])ccc3O)c2)CCO1	745775318	DIZZBNYUUUUQKV-CQSZACIVSA-N	443.460	1.665	50	20	IDGD	
COc1cc(S(=O)(=O)NNC(=O)[C@@H]2COc3ccccc3O2)ccc1Br	747596703	QXXRHGZWAGJFRM-HNNXBMFYSA-N	443.275	1.607	50	20	IDGD	
O=C(CCN1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O)NNc1ccc(F)cc1Br	748074133	PMUBGKUWHNSPHN-GBOPCIDUSA-N	426.242	1.584	50	20	IDGD	
CCCCO[C@H]1C[C@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)C1(C)C	748970862	POAXBLFHHCYKCQ-IRXDYDNUSA-N	440.566	1.865	50	20	IDGD	
O=C(NCC(F)(F)F)NN=C1C(=O)N(Cc2ncon2)c2ccc(Br)cc21	750934767	QACGSJRCIUUNLH-UHFFFAOYSA-N	447.171	1.945	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)[C@@H]1CCCN(C(=O)Cc2ccccc2)C1	751208567	GZZDCSZTCPIWOB-MRXNPFEDSA-N	428.514	1.107	50	20	IDGD	
Cc1cccc(-n2cc(C(=O)NNC(=O)c3nn(C(C)C)c(=O)c4ccccc34)nn2)c1	751293555	JYFWRIHTWFFXJI-UHFFFAOYSA-N	431.456	1.941	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(C(F)(F)F)cc1Cl)c1ccc(-n2cnnn2)cc1	751539479	ZGQCBLWFRMVHKS-UHFFFAOYSA-N	446.798	1.958	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NN=C1CN(C)C[C@H]1C)N(S(C)(=O)=O)CC2	752163332	VGKIQOKNGQPFPJ-DYVFJYSZSA-N	438.550	1.006	50	20	IDGD	
COC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2ccc(C#N)cc2)c1Br	756154994	KOQPANWSXPDHAI-UHFFFAOYSA-N	445.229	1.507	50	20	IDGD	
O=C1C[C@@H](Cc2ccc(NC(=O)NNC(=O)c3cc(Br)c[nH]3)cc2)C(=O)N1	756817634	XZUMKXPYNMAFES-SNVBAGLBSA-N	434.250	1.449	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)CN2C(=O)NC3(C[C@H](C)C[C@@H](C)C3)C2=O)c1	756863297	IEAHUOQUUMWEDV-HUUCEWRRSA-N	430.505	1.576	50	20	IDGD	
CCOc1cc(C(=O)N(C)C)ccc1NC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	756870742	HGHMDPPRLYOJEY-UHFFFAOYSA-N	448.501	1.657	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)c2nc(C)n(-c3n[nH]c(C(F)(F)F)n3)n2)c(OC)c1	757181006	JFIBIAODJYJIOB-UHFFFAOYSA-N	440.342	1.265	50	20	IDGD	
Cc1cc(C(=O)NNc2ccc(C(N)=O)nn2)cc(S(=O)(=O)N2CCC(C)CC2)c1C	757402253	LSNSVUMFUIITCF-UHFFFAOYSA-N	446.533	1.370	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2cncc(Br)c2)c1	757777242	MXNLYLBLFUHLAX-UHFFFAOYSA-N	442.295	1.561	50	20	IDGD	
Cc1nn(C)c(C)c1[C@@H](NC(=O)NNC(=O)COc1ccccc1[N+](=O)[O-])C(F)(F)F	757885734	KLXWZDRODDSQEI-OAHLLOKOSA-N	444.370	1.958	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2csc(-c3ccc(C)n3C)n2)n1	758570092	BYJSCHIKMYPLNM-UHFFFAOYSA-N	433.515	1.769	50	20	IDGD	
CCS(=O)(=O)N1CCC(CNC(=O)NNC(=O)COc2cc(C)ccc2C)CC1	758746666	XQEMTFOLJJBVFV-UHFFFAOYSA-N	426.539	1.074	50	20	IDGD	
Cc1ccccc1C(=O)NNS(=O)(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	760340572	SJAHKLXEVJTYDX-UHFFFAOYSA-N	437.543	1.793	50	20	IDGD	
CCOC(=O)C1CCN(C(=O)c2ccc(NC(=O)C(=O)NNC(=O)C(C)(C)C)cc2)CC1	761063706	LJHQQLFWPJEBBT-UHFFFAOYSA-N	446.504	1.234	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)NCc1cccc(NS(C)(=O)=O)c1	761654160	QSPVGTBQAGVREK-UHFFFAOYSA-N	438.531	1.689	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)N[C@@H]2CCN(C(=O)C3CCCC3)C2)cc1	762377928	GZIFQWLVQDACJE-DOTOQJQBSA-N	432.521	1.974	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1F	762604471	HTGLBTMHIFNUNT-UHFFFAOYSA-N	427.433	1.867	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNS(=O)(=O)c1ccc2c(c1)C(C)(C)C(=O)N2	763438823	FIGATNWKEQYMJH-UHFFFAOYSA-N	440.522	1.531	50	20	IDGD	
Cc1ccnc(-c2ccc(NC(=O)C(=O)NNC(=O)[C@@H]3COc4ccccc4O3)cc2)n1	763571039	KEXKNQYRZMFQNU-SFHVURJKSA-N	433.424	1.378	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cccc(NC(=O)[C@@H](C)n3cccn3)c2)c(C)o1	763576823	FZAAMKAVTRWOPP-CYBMUJFWSA-N	438.444	1.692	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2cccc(-c3nnnn3C3CC3)c2)c1	763668355	LFPPZUZUKXPINN-UHFFFAOYSA-N	449.471	1.457	50	20	IDGD	
C[C@H](c1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2F)cc1)N1CCOCC1	763682053	VXWSMQNRFFIHOB-OAHLLOKOSA-N	444.463	1.384	50	20	IDGD	
O=C(COc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1cc(N2CCCC2=O)ccc1F	763685609	DKNCGPUWJJOWSU-UHFFFAOYSA-N	448.838	1.771	50	20	IDGD	
O=C(CN1CCCc2ccccc21)NNC(=O)C(=O)Nc1cc2c(cc1Cl)OCO2	763729334	WCDKMXDOSSDZCJ-UHFFFAOYSA-N	430.848	1.607	50	20	IDGD	
CCOC(=O)/C=C/c1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C)cc2)cc1	763820400	GTABGAIHMJCMPU-MDWZMJQESA-N	425.441	1.736	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccc(N2CCSCC2)cc1	763842050	AHHRJROUZPELOG-UHFFFAOYSA-N	432.477	1.544	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cccc(C(=O)N(C)C)c2)cc1	763861909	TVOWEVJIBALGDV-AWEZNQCLSA-N	442.472	1.341	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc([S@](C)=O)c(F)c2)cc1	763873011	REXHVEFPKMIKID-ICNDJQDOSA-N	449.460	1.319	50	20	IDGD	
Cc1nc(Br)ccc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccc(F)cc1	763874007	YQFHZJLGEYLHPN-JTQLQIEISA-N	439.241	1.845	50	20	IDGD	
CCOC(=O)c1cn(C)nc1NC(=O)C(=O)NNC(=O)c1cc2c(s1)CC[C@H](C)C2	763938118	AMEDBZCXOXQRQF-JTQLQIEISA-N	433.490	1.183	50	20	IDGD	
CNC(=O)c1ccc(C)c(NC(=O)C(=O)NNC(=O)c2ccc(Br)s2)c1	763941699	RTXPYVCDYDXXMV-UHFFFAOYSA-N	439.291	1.578	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Br)s2)c(F)c1	763942113	ULNAELYWWXJUCE-UHFFFAOYSA-N	444.238	1.836	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)C(=O)Nc1ccnn1-c1ccccc1	763944074	LIUPHLFODJJMOX-UHFFFAOYSA-N	431.412	1.163	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)nc1)C(=O)Nc1ccc2c(c1)C(=O)N(CC1CC1)C2=O	764093749	XLKHCJQFBVZAIW-UHFFFAOYSA-N	441.831	1.141	50	20	IDGD	
Cc1noc(COc2ccc(NC(=O)C(=O)NNC(=O)c3cccc4cccnc34)cc2)n1	764148940	OMXLARFJKGPTCT-UHFFFAOYSA-N	446.423	1.905	50	20	IDGD	
CCC(CC)NC(=O)[C@@H]1CN(C(=O)C(=O)NNC(=O)c2ccoc2)c2ccccc2O1	764163283	IGMBIOYYKGUNMW-KRWDZBQOSA-N	428.445	1.140	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)CCc2ccccc2O)cnn1-c1ccccc1F	764281347	SXLNIBCBCITLNT-UHFFFAOYSA-N	425.420	1.744	50	20	IDGD	
NC(=O)C1CCN(c2ccc(NC(=O)C(=O)NNC(=O)c3cc4ccccc4o3)cc2)CC1	764330704	GVGHQOQWOCQPHD-UHFFFAOYSA-N	449.467	1.534	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)c(Cl)c1)C(=O)Nc1ccnn1CCc1ccccc1	764350007	XHSVROJZYIOREF-UHFFFAOYSA-N	427.848	1.885	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)C(=O)Nc1ccc(O[C@@H]2CCOC2)cc1	764350720	IXWKAAHDQMIMOL-LJQANCHMSA-N	435.440	1.440	50	20	IDGD	
C[C@H](NS(=O)(=O)c1ccc(C#N)cc1)C(=O)NNC(=O)c1ccc(Cl)cc1Cl	764573001	NERLATGFQORBFZ-JTQLQIEISA-N	441.296	1.993	50	20	IDGD	
CCn1nc(C(=O)NN=C(C)c2ccc(Cl)c(S(N)(=O)=O)c2)c2ccccc2c1=O	764665877	GRIVILVJVNYOND-UHFFFAOYSA-N	447.904	1.871	50	20	IDGD	
C[C@H](NS(=O)(=O)c1cccc(C#N)c1)C(=O)NNC(=O)c1c(Cl)cccc1Cl	765413524	ZRSIXDGVZGTTKV-JTQLQIEISA-N	441.296	1.993	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)CCC(=O)Nc2ccc3nc(O)[nH]c3n2)c1C	765469610	UIHGRHXFYBWSPU-ZDUSSCGKSA-N	440.460	1.614	50	20	IDGD	
COC[C@H](C)n1c(SCC(=O)NNC(=O)c2cc(C)[nH]n2)nnc1-c1ccccc1	765587227	RBOFYIIVHUJQLW-ZDUSSCGKSA-N	429.506	1.737	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)NC[C@H](c1ccc(F)cc1)N1CCOCC1	765626610	LVYSIJZLOMTEQX-GOSISDBHSA-N	436.509	1.929	50	20	IDGD	
Cc1ccc(Br)c(S(=O)(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c1	765641797	KAJMONSRYUGIRQ-UHFFFAOYSA-N	437.279	1.357	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@H](C)OC[C@H]3CCCCO3)CC2)cc1	766650953	YCIGFBPABCGNNV-PZJWPPBQSA-N	432.565	1.234	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)CCC(=O)c2ccc3c(c2)CCC(=O)N3)c1	767607248	GVRSQVYRBMSOQQ-UHFFFAOYSA-N	448.435	1.410	50	20	IDGD	
CC(C)(O)C(=O)NNC(=O)c1ccc(Br)cc1I	768261076	ZRTQRKQVUIUDJC-UHFFFAOYSA-N	427.036	1.586	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)c2cc(C(N)=O)n(-c3ccccc3)n2)n[nH]1	768274531	UBQFOILSGJTKEA-UHFFFAOYSA-N	445.439	1.445	50	20	IDGD	
COc1ccc(Br)c(CC(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)c1	768568359	DCVOLNOKQCOKNK-UHFFFAOYSA-N	445.314	1.855	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)Nc2ccc(N(C)C(=O)CN3CCN(C)CC3)cc2)n1	770023975	QNKOUSAFSTXVQH-UHFFFAOYSA-N	426.525	1.452	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)N[C@H](C)c1cccc(S(N)(=O)=O)c1	770102902	MJBRWKRUUZTWIZ-VXGBXAGGSA-N	440.909	1.846	50	20	IDGD	
COc1ccccc1[C@@]1(C)NC(=O)N(CC(=O)NNC(=O)Cc2ccc(Cl)cc2)C1=O	771232191	RETYOGGEVNSWFZ-OAQYLSRUSA-N	444.875	1.506	50	20	IDGD	
C[C@]1(c2ccc(F)c(Cl)c2)NC(=O)N(CC(=O)NNc2ncnc3[nH]cnc23)C1=O	771737446	QFICSMUHLPVHDB-QGZVFWFLSA-N	432.803	1.056	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)c1ccccc1CN1CCOCC1	772883482	ATRFNZHNXFJOCI-UHFFFAOYSA-N	430.892	1.250	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)C(=O)Nc1cc(C(F)(F)F)ccn1	773524487	ISZDCTJOFHYUOI-UHFFFAOYSA-N	427.295	1.174	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)[C@](N)(c2ccccc2OC)C(F)(F)F)cc1	776106862	CUVAUKFKKOVNCL-GOSISDBHSA-N	426.395	1.680	50	20	IDGD	
CCO[C@@H]1C[C@H](NC(=O)NNC(=O)CNC(=O)c2cccs2)[C@@H]1Oc1ccccc1	776476696	KWSHAWGQVWZVOU-DAYGRLMNSA-N	432.502	1.433	50	20	IDGD	
C[C@@H]1CC(C)(C)C[C@@]2(C1)NC(=O)N(CC(=O)NNc1cccc(S(C)(=O)=O)c1)C2=O	776528791	XBTZVCQMGBHCRW-ZUOKHONESA-N	436.534	1.670	50	20	IDGD	
C[C@H](NC(=O)CC1CCCCC1)C(=O)N1CCN(S(=O)(=O)CBr)CC1	777833127	SHIBPUOOZWAAIM-ZDUSSCGKSA-N	438.388	1.288	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2Br)ccc1C(N)=O	778759759	QDBJEKBDIRJRSR-UHFFFAOYSA-N	436.222	1.846	50	20	IDGD	
CC(C)(C)OC(=O)N1CC=C(CNC(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)CC1	779676757	LFJJYXSTVZKDRH-UHFFFAOYSA-N	435.437	1.812	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2c[nH]nc2-c2ccsc2)cc1OC	781319424	IWFOSTSOXKPROY-UHFFFAOYSA-N	430.442	1.773	50	20	IDGD	
COc1ccc(NNC(=O)C2CCN(S(=O)(=O)c3cccc(C(C)=O)c3)CC2)nc1	781525233	ICRMZDYNLXTFGB-UHFFFAOYSA-N	432.502	1.837	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(O)cc2)cc1I	782832700	RSCUEYCDLVVVSP-UHFFFAOYSA-N	439.209	1.705	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C(=O)Nc2cccc(Oc3cnccn3)c2)nc2ccccc21	782895288	ZOVYGZOPYUGELT-UHFFFAOYSA-N	445.439	1.484	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)C(=O)Nc1ccc(F)c(Cl)c1	782897548	QPPNDGAAMZSDON-UHFFFAOYSA-N	427.845	1.172	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)c2cnc(NC(=O)OC(C)(C)C)cn2)nc2ccccc21	783030837	KVMXYMBCZMMQIL-UHFFFAOYSA-N	425.449	1.714	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2ccc(N3CCC(N(C)C)CC3)c(F)c2)nc(C)n1	783330962	NZHVFLDCZHPVMB-UHFFFAOYSA-N	429.500	1.845	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2ccnn2Cc2cccc3ccccc23)CCS(=O)(=O)C1	783426487	HMNATRFRNKNZKT-OAQYLSRUSA-N	441.513	1.221	50	20	IDGD	
CN1CCN(C(=O)c2ccccc2NC(=O)C(=O)NNc2ccc(OC(F)F)cc2)CC1	784310735	NNLHFFLVYLOLKK-UHFFFAOYSA-N	447.442	1.757	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNc3cccc(S(C)(=O)=O)c3)cn2)C[C@H](C)O1	784841411	IRGIZYPRVWVOJY-KBPBESRZSA-N	447.517	1.181	50	20	IDGD	
COC(=O)CCOc1ccc(NC(=O)C(=O)NNc2ccc(C(F)(F)F)nn2)cc1	784886060	LCMLWIFHVMFUQY-UHFFFAOYSA-N	427.339	1.519	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)C(=O)Nc1nc(-c2ccccc2F)cs1	785066541	DHAHIFFIRLYKET-UHFFFAOYSA-N	438.444	1.926	50	20	IDGD	
CCCCCn1nc(C)cc1NC(=O)C(=O)NNc1c(OC)cccc1S(C)(=O)=O	785331610	WZIHCTTZOMUTRY-UHFFFAOYSA-N	437.522	1.876	50	20	IDGD	
COc1cccc([C@@H]2[C@H](C(=O)NNc3ccccc3S(N)(=O)=O)CC(=O)N2C2CC2)c1	788223954	QHHIQSLZXCEYLY-OXQOHEQNSA-N	444.513	1.538	50	20	IDGD	
NS(=O)(=O)c1ccccc1NNC(=O)[C@H]1CCCN(C(=O)CCOc2ccccc2)C1	788229097	SAYMGRRCXSBJMA-INIZCTEOSA-N	446.529	1.485	50	20	IDGD	
O=C(CCCCC/N=C1/NS(=O)(=O)c2ccccc21)NNc1nc2ccccn2n1	791259854	DQFXSYZYORNCDL-UHFFFAOYSA-N	427.490	1.472	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NC[C@@H]2CCN(Cc3ccccc3)C2)c2ccccc2c1=O	792226512	QZZYHCOVRQCPKV-SFHVURJKSA-N	448.527	1.883	50	20	IDGD	
CSc1nc(C2CC2)cc(C(=O)OCC(=O)NNC(=O)Cc2nc(C)cs2)c1C#N	792734253	ZDVOXUCPEHOHDH-UHFFFAOYSA-N	445.526	1.864	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)c1ccc(F)c(S(=O)(=O)Cc2ncon2)c1	792798928	SWRZRIDGDZPJAC-UHFFFAOYSA-N	448.432	1.195	50	20	IDGD	
CC(=O)N[C@@H](CC(=O)N([C@@H]1CCS(=O)(=O)C1)N(C)C)c1ccc(Br)cc1	792855829	URDXSHICDUMNFP-CVEARBPZSA-N	446.367	1.509	50	20	IDGD	
O=C(NNc1ccc2c(=O)[nH]ccc2c1)C(=O)Nc1cc(N2CCNC2=O)ccc1Cl	793065142	JDBURYFHVLBEKR-UHFFFAOYSA-N	440.847	1.793	50	20	IDGD	
CN(C)C(=O)c1ccc(NC(=O)C(=O)NNc2ccc3c(=O)[nH]ccc3c2)cc1Cl	793066070	RJUPKMKULIGCQQ-UHFFFAOYSA-N	427.848	1.965	50	20	IDGD	
CCn1cc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c(C(F)(F)F)n1	797935427	HWYYOKDQMBCJFC-CYBMUJFWSA-N	442.350	1.066	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N2CC[C@@H]3NC(=O)OC[C@H]3C2)cc1Br	798530481	BYBBBFVTDXMUOU-PWSUYJOCSA-N	427.255	1.242	50	20	IDGD	
Cc1cc(O[C@@H]2CCN(C)C2=O)ccc1NC(=O)NNC(=O)COCc1ccccc1	799239580	ZYDUWZJJACWNLR-LJQANCHMSA-N	426.473	1.974	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)[C@H]2CS[C@]3(C)CCC(=O)N23)cc1Cl	802077305	QAENEIAVSHNBHC-PIGZYNQJSA-N	428.898	1.964	50	20	IDGD	
COC(=O)c1c(F)cc(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)cc1F	802566379	MIJIZUFGYHSIBB-UHFFFAOYSA-N	445.176	1.242	50	20	IDGD	
O=C(NNc1nccnc1C1CCC1)[C@@H]1CN(Cc2nc(O)c3ccccc3n2)CCO1	805463928	OEOUQHUTNOHGEV-KRWDZBQOSA-N	435.488	1.737	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2N2CCOCC2)cc1	806363496	BLUYSIYZYUUTQF-UHFFFAOYSA-N	429.433	1.313	50	20	IDGD	
Cc1c(C(F)(F)F)nn(C)c1NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1	806423140	CQCPSIJNFKHDJI-UHFFFAOYSA-N	426.403	1.607	50	20	IDGD	
O=C(NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)Nc1cc2n(n1)CCCC2	806720290	YWEJRCUJBSXDQS-UHFFFAOYSA-N	432.506	1.470	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)Nc1cc(F)c(Br)c(Cl)c1	806720904	ARRMJTKWWSGYNN-LURJTMIESA-N	428.667	1.829	50	20	IDGD	
O=C1COC[C@@H](C[C@H]2CN(C(=O)C(=O)NNc3ccc(Cl)nc3)c3ccccc32)N1	807014302	UNTSJDXUEGCJAR-GXTWGEPZSA-N	429.864	1.214	50	20	IDGD	
C[C@@H]1CCCN(S(=O)(=O)c2ccc(NC(=O)C(=O)NNc3cccc(F)n3)cc2)C1	807392084	FVZXBJYIQUWEGE-CYBMUJFWSA-N	435.481	1.723	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)N2CCC[C@@H](CNS(=O)(=O)C3CC3)C2)c1C	807900231	UTFYKIDKNRGZDP-TYJAPOHBSA-N	448.589	1.979	50	20	IDGD	
Cc1cc(C(=O)NNS(=O)(=O)c2nc(C)n(C)c2Br)c2ccccc2n1	808069033	MBBSWUJHJJBCRN-UHFFFAOYSA-N	438.307	1.971	50	20	IDGD	
O=C(NNC(=O)C(=O)N1CCN(c2ccccc2)CC1)Nc1ccc(Br)cc1	813574096	WOSVLZSNHVHMLW-UHFFFAOYSA-N	446.305	1.951	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@@H]2C[C@H]3C[C@H]3N2C(=O)OC(C)(C)C)cc(OC)c1OC	814100723	SWGDHJXJCJHVJT-BNOWGMLFSA-N	435.477	1.871	50	20	IDGD	
Cc1nnsc1C=NNC(=O)c1cc(S(=O)(=O)NCc2ccccc2)ccc1O	814217248	YMHZBAFQPSCHRU-UHFFFAOYSA-N	431.499	1.795	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)CNC(=O)OC(C)(C)C)c1ccc(N2CCCOC2=O)cc1	814449147	HFKINFVJDWBANU-CYBMUJFWSA-N	435.481	1.949	50	20	IDGD	
Cc1ccc2snc(C(=O)OCC(=O)NNC(=O)[C@H]3COc4ccccc4O3)c2c1	815506283	RYNJASBEHZPYFP-OAHLLOKOSA-N	427.438	1.749	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)cc1)C1CC1	815565932	FFSBBBRQHFRVJN-UHFFFAOYSA-N	435.440	1.238	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(C)c3nccn3c2)cc1OC	815566965	KTLZVGPUTWGPML-UHFFFAOYSA-N	425.445	1.840	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)N(C)C)cc1OC	815751575	FKJHVEFSQWFEAR-UHFFFAOYSA-N	436.490	1.426	50	20	IDGD	
O=C(NNC(=O)c1cccc2ncccc12)c1cccc(S(=O)(=O)N2CCOCC2)c1	821699051	ZZHMMTZHPSHYAK-UHFFFAOYSA-N	440.481	1.331	50	20	IDGD	
COc1ccc(-c2noc(CCC(=O)NNC(=O)CNc3cccc(OC)c3)n2)cc1	825810613	PEACZPYLEXBSBD-UHFFFAOYSA-N	425.445	1.946	50	20	IDGD	
O=C(NCCc1ccc(F)cc1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	903960980	KCUWARNIOCIJRH-UHFFFAOYSA-N	434.493	1.797	50	20	IDGD	
COc1cccc(/C=C(/C#N)C(=O)OCC(=O)Nc2ccc(C)c(S(N)(=O)=O)c2)c1	913264138	ZWBFLNNVKNTWCG-NVNXTCNLSA-N	429.454	1.740	50	20	IDGD	
CCn1c(NNC(=O)c2cc(S(=O)(=O)NC(C)C)ccc2F)nc2ccccc2c1=O	914756346	OQYOWZGRHHWQEK-UHFFFAOYSA-N	447.492	1.999	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2ccc(C(=O)NNC(=O)c3cc(C)oc3C)nc2)c(C)o1	915807676	AGHYHWJWIWLEQN-UHFFFAOYSA-N	439.428	1.651	50	20	IDGD	
CN(C)[C@H](CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)c1ccccc1	915891198	KTEUXQBNFGSKOD-GOSISDBHSA-N	433.534	1.184	50	20	IDGD	
CN1CCN(c2ccc(CNC(=O)NNC(=O)c3cc(Br)c[nH]3)cn2)CC1	916247316	PELYRPNZIDXXMH-UHFFFAOYSA-N	436.314	1.068	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CC(=O)N(c2ccc3c(c2)OCCO3)C1)c1ccc(Cl)cc1O	918358004	SUEGGLJEHXSHTP-LLVKDONJSA-N	431.832	1.631	50	20	IDGD	
O=C(CC(F)(F)F)NNC(=O)C1CCN(S(=O)(=O)c2ccc3c(c2)CCC3)CC1	918366016	QAIWCXDVYLCDLN-UHFFFAOYSA-N	433.452	1.676	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)[C@H](C)Sc2nnnn2C2CC2)c2ccccc2c1=O	918410405	YTAXUAZBYNZJLX-NSHDSACASA-N	442.505	1.241	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)c1ccc2c(c1)C(=O)N(Cc1ccncc1)C2=O	919820323	SWWKLBDRCFKHQG-UHFFFAOYSA-N	444.447	1.890	50	20	IDGD	
O=C(/C=C/c1cc(C(F)(F)F)ccc1Cl)NNC(=O)N[C@@H]1CCS(=O)(=O)C1	919885721	QYJPEARSVXJHST-CLUFZFBRSA-N	425.816	1.890	50	20	IDGD	
Cc1nc(CSc2ccccc2C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)cs1	919889585	PAFYZAUFNROWDV-GFCCVEGCSA-N	440.572	1.875	50	20	IDGD	
COc1ccc(-c2nn(CCC#N)cc2C(=O)NNC(=O)c2ccncc2)cc1[N+](=O)[O-]	920848027	NFDZUDIVSPHMHB-UHFFFAOYSA-N	435.400	1.850	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)NC1CCN([C@@H]2CCCC[C@H]2O)CC1	1319252862	QBEMRGNPOBXFOB-IAGOWNOFSA-N	428.493	1.047	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2ccc(-n3cccn3)c(F)c2)cc1	1321575093	BYVGCICAYPJSBO-UHFFFAOYSA-N	445.476	1.402	50	20	IDGD	
CN(CC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Cl)C1)C(=O)c1ccccc1	1778023257	ZZBUHHGIOLVSQL-HGHGUNKESA-N	439.915	1.807	50	20	IDGD	
O=C1Cc2cc(C(=O)N3CC[C@]4(CN(C(=O)CCBr)CCO4)C3)ccc2N1	1778389502	LACJFYYPBHZMDC-IBGZPJMESA-N	436.306	1.410	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H]1COc3ccccc3O1)CCO2	1779293755	BOWKFVKZGJHSDC-WIYYLYMNSA-N	434.565	1.508	50	20	IDGD	
COc1ccnc(C(=O)N2CCO[C@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)c1OC	1779300750	XTZAEGMCYZYIPZ-FQEVSTJZSA-N	437.569	1.394	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccoc2Cl)C1	1780257306	LUVUBBICHMIUHY-FOIQADDNSA-N	440.928	1.434	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccn3c(O)nnc13)C2	1780702535	KEEOLMCXFLHJSJ-STXHMFSFSA-N	435.912	1.580	50	20	IDGD	
C[C@@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@](C)(Cl)CCl)C1)n1cncn1	1780715192	MDXORIJVYYVADL-IHETXDGRSA-N	432.352	1.589	50	20	IDGD	
Cn1cc(F)cc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Br)C1	1780773538	OEXBNEZITLZUCN-JKIFEVAISA-N	434.281	1.982	50	20	IDGD	
O=C(Cc1[nH]nc2c(Cl)cccc12)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1780937091	BEUQJVHCFBSZME-DNVCBOLYSA-N	441.315	1.188	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)Cc3ccc(OC)cc3[N+](=O)[O-])CCO2)C1	1781216568	LRCIBEAFESQRQN-OXQOHEQNSA-N	439.896	1.993	50	20	IDGD	
Cc1ccc(OCC(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](F)Br)C3)C2)cc1	1781328786	ZJXNVHNMEKCRTD-WMZOPIPTSA-N	429.286	1.894	50	20	IDGD	
Cc1ccn2c(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)[C@H](O)CCl)C4)cnc2c1	1781398618	ZZNRNNPODGGFKJ-CBGDNZLLSA-N	434.924	1.370	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(-c4cc[nH]n4)cc3)C2)C1	1781882475	FBEQSYAJZMEZSQ-UTKZUKDTSA-N	432.908	1.774	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(S(C)(=O)=O)ccc3F)C2)C1	1782151673	SXPPNOKQIPRZAZ-KXBFYZLASA-N	446.928	1.690	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C1(F)CCCCC1)C2	1782215161	UHQAXRUQDZKJLZ-DYESRHJHSA-N	440.560	1.546	50	20	IDGD	
O=C(c1cnc2cccc(Cl)c2c1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1782497922	XZHONVDCFMOVHX-FXAWDEMLSA-N	438.311	1.931	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@]2(CCN(C(=O)C3(F)CC3)C2)C1	1782904691	PVJOGKJOACCFIH-SCLBCKFNSA-N	433.908	1.451	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](C)Br)C3)C2)nc2nccn12	1783537460	SJLBHQIHZOIPAK-SCLBCKFNSA-N	436.310	1.265	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cnccc3C(F)(F)F)CCO2)C1	1783877455	YTTVDJJSQJGOHD-WMLDXEAASA-N	435.830	1.798	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(-c4ccccc4)[nH]n3)CCO2)C1	1783882329	QEOSRAJMUJPWML-KKSFZXQISA-N	432.908	1.774	50	20	IDGD	
Cc1ccc(C(=O)NCC(=O)N2CCO[C@]3(CCN(C(=O)C(Cl)Cl)C3)C2)cc1	1783952128	NYNZNCNNUBNETC-LJQANCHMSA-N	428.316	1.358	50	20	IDGD	
CC(=O)O[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]2C1)C(C)C	1783967786	WUARXWGJHSKWJJ-YYESSZKYSA-N	447.370	1.585	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(=O)n3C)C[C@@H]21	1783969028	IHVBNYRIZQIAGU-YXWQFLTLSA-N	440.338	1.010	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nn[nH]c3C(F)(F)F)C[C@@H]21	1784620429	AMOVSBBFPIBASU-YFKTTZPYSA-N	437.850	1.824	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc(OC)c(C)c3)[C@H]2C1	1786271163	FLHPQJPIVCIPIL-HJWJTTGWSA-N	425.913	1.246	50	20	IDGD	
COC(=O)[C@@H]1CC[C@@H](C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCBr)[C@H]3C2)C1	1786404442	IVNAJCKKPYEKNM-OWYFMNJBSA-N	445.354	1.340	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC1(c2ccc(NC(=O)C[C@H]3NC(=O)NC3=O)cc2)CCC1	1786762905	ZQPWRPIADNSIAK-ACJLOTCBSA-N	441.315	1.955	50	20	IDGD	
CC(C)N[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)C(C)C	1786962146	HYPDIDWKGLEMLB-GVRJEKJASA-N	436.366	1.679	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)[C@H]3CC[C@H](O)CC3)CCC2)cc1)c1ccc(B(O)O)cc1	1788143423	CQCYOCBKIUQFOY-CYWCHRQTSA-N	436.317	1.665	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](OC(C)=O)C(C)C)[C@H]2C1	1788479645	LOBZBBJEGXPGLJ-QUSNUVHPSA-N	447.370	1.727	50	20	IDGD	
CC(C)(C)n1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCBr)C[C@@H]32)nn1	1789355296	MMPKPFHUEDGQPK-YDHLFZDLSA-N	442.358	1.411	50	20	IDGD	
C[C@@H](C(=O)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1)N1C[C@H]2C[C@H]2C1	1789440683	GCUJJSBAQFKLNE-YTQUADARSA-N	447.344	1.454	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4ncnn4c3)C[C@@H]21)[C@H](F)Br	1789925280	CYMNQDNMEZFRAR-ABHRYQDASA-N	440.273	1.013	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc4ccoc34)[C@H]2C1	1790466408	RUCDPZBWXOMLHW-WDSOQIARSA-N	442.516	1.399	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc4c(c3)CCNCC4)[C@H]2C1	1790618181	XHHFKHFBAFPMLZ-ROPHOZQPSA-N	448.995	1.771	50	20	IDGD	
CCCC(=O)N[C@@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](Br)CC)[C@H]2C1	1790961120	WZRNCNNFAXXFLK-QXKUPLGCSA-N	446.386	1.444	50	20	IDGD	
COc1ccc([C@@H](O)C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CO[Si](C)(C)C)C3)cc1	1792717413	KRALBYMWQJZQAB-WOUAJJJCSA-N	436.581	1.170	50	20	IDGD	
CC(C)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CC[C@@H]3CCC(=O)N3C1)C2	1792784320	DNAQTWXKWGKLME-XLKGFZLASA-N	425.957	1.242	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CCc2ccccc2[C@@H]1O	1793036104	FYZARSHLCVTREI-ZNRYJCSXSA-N	436.936	1.126	50	20	IDGD	
CCC[C@H](NC(=O)c1ccccc1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](O)CCl)C2	1793217001	KRSGJYILRBCCCS-PJVZLEMVSA-N	435.952	1.823	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CNC(=O)c1cccnc1	1794222647	QSKRMOAPACHTFL-DMRZNYOFSA-N	437.338	1.481	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cn1ccnc1	1794869811	FEUVSRIFMSYFEN-IBMUYAKESA-N	441.438	1.358	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)nc(Cl)c1)C2	1795111503	UINATTWGFLAVRT-QHBPRCKVSA-N	432.702	1.429	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCBr)C1	1795116899	DSYRHTWMBPHHQQ-WVCIDPQESA-N	445.354	1.340	50	20	IDGD	
COCCOCCOCCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCBr	1795496170	UCNUDVAUFSQMIN-MUJYYYPQSA-N	435.359	1.479	50	20	IDGD	
Cc1cc(C)n2ccc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3ccc(B(O)O)cc3)c2n1	1796189994	GXQAWHXPZUQPAS-ACDBMABISA-N	446.316	1.197	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnn2ncccc12	1796276733	CQNIRSBYYXKAEU-LMWOUKEDSA-N	436.310	1.106	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccnn1-c1ccccc1	1796739020	PLGRFJJNOJJVDJ-HIRMHNASSA-N	432.908	1.329	50	20	IDGD	
Cc1ccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CO[Si](C)(C)C)cc1[N+](=O)[O-]	1797956203	JWCUWYZPHIKSET-UPHUGPLXSA-N	449.580	1.887	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)c1cccnc1-c1ccc(F)cc1	1798703455	SEDBMAODZIOWCS-QXGSTGNESA-N	447.894	1.691	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(-c3ccco3)no1)C2)[C@@H](F)Br	1799346254	MGXKOMWGHNZVJA-ANGCBRKESA-N	442.241	1.828	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1nc3c(=O)[nH]c4ccccc4n3n1)C2	1800073859	WXCPVMXWORNXEG-XJFOESAGSA-N	442.907	1.840	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](O)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](F)Br)C2	1800599650	ARCRZRMMSOTYRB-UYNYGYNWSA-N	438.294	1.158	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1c(C)noc1C)C2	1800640467	ZJEKURXOFGPFQE-YXPYIKCWSA-N	428.327	1.597	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ncc(Cl)cc1Cl)C2	1800974232	ROBVAJOLQZJBNT-RDBQEKCUSA-N	436.723	1.845	50	20	IDGD	
C[C@@H](NC=O)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](Br)Cc1ccccc1	1801570297	IEECOAQXPLEUAW-LHKMKVQPSA-N	436.350	1.765	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc3c(c2)OCCO3)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803138674	DCXDBDSDBVFZMG-ABSDTBQOSA-N	445.903	1.772	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2nccc3[nH]ccc23)[C@@H]1c1cccnc1)[C@H](O)CCl	1803139242	MTOLNBKEQRRZMA-POZUXBRTSA-N	427.892	1.877	50	20	IDGD	
Cc1ccc(C(=O)N2CCCC3(CCN(C(=O)c4cnccc4C(=O)NN)CC3)C2)o1	1806252196	AHXUZRCJTCIRGQ-UHFFFAOYSA-N	425.489	1.745	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H](CNC(=O)Cn2ccnn2)[C@H]1c1cccnc1	1807681889	NIBYWSOGNVYXQM-KYJSFNMBSA-N	425.320	1.615	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC2(CCCN(C(=O)c3ccc(F)cn3)C2)CC1	1808715029	VSLAWTPLNVCCNL-UHFFFAOYSA-N	440.479	1.378	50	20	IDGD	
CC(C)/C=C/C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1	1810309345	QLHMAZVCUOKPAH-DFUKUNQBSA-N	436.516	1.612	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)[C@H](COC)NC(C)=O)[C@H]1c1cccnc1	1810560324	YTRMALSQGIPCDT-YDZRNGNQSA-N	438.956	1.646	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2cc3ncccn3n2)[C@@H]1c1cccnc1	1813031460	VMYNLBXZYXUVEO-TXPKVOOTSA-N	442.907	1.698	50	20	IDGD	
Cc1ccn(C)c1C(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1813072375	GRQPQMSNKKVVIO-PGRDOPGGSA-N	440.548	1.421	50	20	IDGD	
CN1CCN(CC(=O)N2CC[C@H](CNC(=O)C(Cl)Cl)[C@H]2c2cccnc2)CC1	1813077200	DVPLPULXAVTGHJ-NVXWUHKLSA-N	428.364	1.139	50	20	IDGD	
Cc1cc(C)n(CCC(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)n1	1813303122	DYOVUANLYOTOQI-NLWGTHIKSA-N	433.940	1.591	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1ccccc1O)CC2)c1ccc(B(O)O)cc1	1815336750	BTHARUOLHCBPSE-CQSZACIVSA-N	437.286	1.068	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H]1C[C@H]1F)CC2	1817281961	ULTRZHXYZMOCGU-WRCWPPDXSA-N	432.481	1.547	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CN2CCNC2=N)n[nH]1	1817292320	SFDZMAWSTQRYCG-WCQYABFASA-N	440.346	1.273	50	20	IDGD	
Cc1cncc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)c1	1817473072	CEIVKVWEOVPEFR-IBGZPJMESA-N	433.277	1.413	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)COc2ccccc2)[nH]n1)c1cccc(B(O)O)c1	1817473087	DSBIUBPCBPCNBN-HXUWFJFHSA-N	448.288	1.474	50	20	IDGD	
Cc1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(B(O)O)cc1)CC2	1817766967	HXWOHZISGNYJAV-HNNXBMFYSA-N	436.302	1.066	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3cc4n(n3)CCCO4)sc2C1	1819122068	GHSGQYJFKFSDIT-WDEREUQCSA-N	439.925	1.602	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1)c1ccc2c(c1)CNC2=O	1819201781	JIRQFHXAHXVQKF-CVEARBPZSA-N	431.880	1.559	50	20	IDGD	
COC(C)(C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819400327	GEXLEECFBXDMEU-OAHLLOKOSA-N	429.481	1.139	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)C13CC(F)(C1)C3)CC2	1819794055	XCWRNNPSNLBBLV-SYQJXSBHSA-N	444.492	1.260	50	20	IDGD	
COC[C@@H](NC(C)=O)C(=O)N[C@H]1CCc2nc(NC(=O)CO[Si](C)(C)C)sc2C1	1820165588	KNOXNEMDAFXRBB-GXTWGEPZSA-N	442.614	1.058	50	20	IDGD	
COC[C@H](NC(C)=O)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@](C)(Cl)CCl)n[nH]1	1820866738	SAIXINFPZPVVHP-DEYYWGMASA-N	448.351	1.789	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1)[C@@H]1CC(c2ccccc2)=NN1	1821611734	XUSYDHSZJLJDCD-BZSNNMDCSA-N	444.923	1.768	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc3n(n2)CCCO3)[nH]n1	1822369812	IUJIULVSWLWHQL-WFASDCNBSA-N	436.900	1.948	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)/C=N/N2CCCCC2)[nH]n1	1822416186	UIRRXDDHFCNEBA-HRKXOBMBSA-N	446.556	1.247	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)N[C@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1	1823006373	ACADTCOYSDNXGP-LWINAJNOSA-N	433.303	1.436	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CC[C@@H](N)C(N)=O)CC1	1824094391	VOLYHPWOCYWJFJ-FVQBIDKESA-N	445.402	1.230	50	20	IDGD	
CCS(=O)(=O)N[C@H](C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)C(Cl)Cl)CC1	1824461605	HKLJFIAJIOHVDD-OCCSQVGLSA-N	442.409	1.738	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1CCc2nc(NC(=O)Cn3ccncc3=O)sc2C1	1824536943	YJEVHBAGKKZRHH-BMLIUANNSA-N	444.344	1.548	50	20	IDGD	
CC[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(O)n[nH]1)CC2	1825447435	XBHFNNGAFBVWBN-JGVFFNPUSA-N	428.312	1.971	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](C)Cn1ccnc1)CC2	1826008706	GAKSCWBCYZECDH-AGIUHOORSA-N	425.942	1.842	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1CCc2nc(NC(=O)CC3CCC3)sc2C1	1828109430	QPQGGFIPEVHFCA-GFCCVEGCSA-N	428.518	1.558	50	20	IDGD	
CCc1nc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)co1	1829383903	MWLBLBQGCBYICN-HXUWFJFHSA-N	439.321	1.464	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C1(c3ccccc3)CC1)CCO2	1829843056	DWTCTSDQSNPYJR-NQIIRXRSSA-N	436.936	1.428	50	20	IDGD	
O=C(Cc1ccc(Cl)c(F)c1)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1	1830291309	QUZKEGKGSJRDMU-QFBILLFUSA-N	449.306	1.078	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCc2cnccn2)CC1	1831877180	SZASOBOXEVMWET-HXUWFJFHSA-N	444.580	1.402	50	20	IDGD	
Cc1cccc(F)c1C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)CCl)CC2)CC1	1833312942	MXFSFWBSYWRHAE-GOSISDBHSA-N	425.932	1.919	50	20	IDGD	
CC(=O)N(C)CCC(=O)NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1	1833669764	LEKHVEUWQZARSO-UHFFFAOYSA-N	445.402	1.211	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3ccn(C)n3)CC2)CC1	1834218680	HKDYXHQBNKTRMS-ZDUSSCGKSA-N	426.359	1.389	50	20	IDGD	
O=C(Cc1cc(F)cc(F)c1)NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1834865494	YXBHFANTYJNKGE-LJQANCHMSA-N	443.922	1.679	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)c1cnccc1Cl	1835857711	NVNVPYHYGGJWLE-KRWDZBQOSA-N	429.348	1.520	50	20	IDGD	
COCc1c[nH]c(C(=O)NC2CCN(C3CCN(C(=O)[C@H](Cl)COC)CC3)CC2)c1	1836105365	AAFBOXWELKLIDO-GOSISDBHSA-N	440.972	1.600	50	20	IDGD	
N#CC1(C(=O)N2CCC(N3CCC(NC(=O)[C@H](F)Br)CC3)CC2)CCC1	1836414698	YWDLPSNPACDHJZ-HNNXBMFYSA-N	429.334	1.942	50	20	IDGD	
O=C(/C=N/O[C@@H]1CCCCO1)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836716964	BAGSSQJWPWTHRO-CPQSRKOASA-N	445.944	1.114	50	20	IDGD	
O=C(c1ccc(O)c(F)c1)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836717876	LIKUZJJUQXRWJJ-GOSISDBHSA-N	428.888	1.743	50	20	IDGD	
Cc1ccc(O)c(C(=O)N2CCOC[C@@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)c1	1837714862	QHTIEZDKQCHLEG-OAQYLSRUSA-N	436.581	1.622	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3onc4ccccc34)C2)C1	1837715888	QAVMFONVODGCJO-OAQYLSRUSA-N	447.564	1.749	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3nc(O)n4c3CCCC4)CCO2)C1	1837759126	QSZMROHDWSFJDA-VLIAUNLRSA-N	440.928	1.012	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccncc3Cl)CCO2)C1	1837890656	CSLSLQVOABLCRR-PXAZEXFGSA-N	446.729	1.588	50	20	IDGD	
N#Cc1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)c1	1838907937	XDJONTJMCNHMHQ-QAPCUYQASA-N	440.269	1.319	50	20	IDGD	
COc1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)c1	1838929396	LOFCQVRXZZVBML-AUUYWEPGSA-N	441.322	1.549	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccc4ncnn4c3)CCO2)C1	1839047535	UIIWNACHBLBXMI-UTKZUKDTSA-N	449.939	1.136	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(OC)c(OC)c3)C2)C1	1839146699	SUPKNUKKEHFFSZ-KKSFZXQISA-N	440.924	1.791	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccccc3-n3nccn3)C2)C1	1839147240	KSOZAPVEHILKSA-DYESRHJHSA-N	447.923	1.355	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3ccccn3)C2)C1	1839150802	XUZDGDPDCRJAAK-VQTJNVASSA-N	444.359	1.707	50	20	IDGD	
CC(C)c1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)n[nH]1	1839199957	ASYVQVLPBDCZLY-YOEHRIQHSA-N	447.305	1.294	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(C)cc(OC)c3)CCO2)C1	1839256790	PSPULRHCVQGYEJ-NQIIRXRSSA-N	440.924	1.327	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccns3)C2)C1	1839962360	BRHJUYNHLYZWRB-WBMJQRKESA-N	432.340	1.387	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)cc2c[nH]nc12	1840189691	HIXMQUZLJBTIQH-IBGZPJMESA-N	441.315	1.745	50	20	IDGD	
O=C(CCN1C(=O)c2ccccc2C1=O)N1CC2(CCCN2C(=O)CCBr)C1	1842637386	KHMUZMDKMGMQBO-UHFFFAOYSA-N	448.317	1.661	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H]2COC[C@@]2(C(=O)N2CC3(CCCN3C(=O)[C@H](F)Cl)C2)C1	1843361470	JJTPNVRIJGGITA-YRVVQQKDSA-N	445.919	1.608	50	20	IDGD	
Cn1cc(-n2cc(C(=O)N3CCCC34CN(C(=O)[C@H](O)CCl)C4)c3ccccc32)cn1	1843461427	CVQRDHMYCGYKMM-LJQANCHMSA-N	441.919	1.781	50	20	IDGD	
COCCOCCOCCOCCC(=O)N1CCCC12CN(C(=O)C(C)(C)CCl)C2	1845244935	LGFILZDXJCIMAT-UHFFFAOYSA-N	448.988	1.541	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC2(CCCN2C(=O)Cn2cccc([N+](=O)[O-])c2=O)C1	1845825002	CWWSRCRYIMQBCJ-INIZCTEOSA-N	431.276	1.196	50	20	IDGD	
COc1ccc(/C=C(\C)C(=O)N2CC3(CCCN3C(=O)CCC(=O)NN(C)C)C2)cc1	1846385917	KRYICWOAWFERIU-SAPNQHFASA-N	428.533	1.675	50	20	IDGD	
C[C@H](NC(=O)c1ccccc1)C(=O)N1CCCC12CN(C(=O)[C@H](F)Br)C2	1847063307	QIRXKVVZJMUEPN-JSGCOSHPSA-N	426.286	1.699	50	20	IDGD	
CC(C)[C@H](CC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl)NC(=O)OC(C)(C)C	1847563428	IMGZZXCGVJOHBZ-VGWMRTNUSA-N	431.961	1.727	50	20	IDGD	
Cc1ccn(CC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)n1	1848095672	MEJROLZFPIDHBW-JYJNAYRXSA-N	439.944	1.525	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2[nH]c(CC)c(C(=O)OC)c2C)c2ccccc2c1=O	17162981	CGFSYQXRLZGKJK-UHFFFAOYSA-N	439.472	1.867	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)c2ccccc2c1=O	17190286	VGFGSOZATLJGOZ-UHFFFAOYSA-N	443.504	1.825	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)CN2C(=O)CCOc3ccccc32)c2ccccc2c1=O	28580867	IVFAUNIPWCRHAP-UHFFFAOYSA-N	449.467	1.554	50	20	IDGD	
COc1cc(C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)c([N+](=O)[O-])cc1OC	110884062	ZQIRGQPOADIVOT-UHFFFAOYSA-N	436.446	1.810	50	20	IDGD	
Cc1nn(Cc2ccccc2Cl)c(C)c1C(=O)NNC(=O)CNC(=O)c1ccco1	725740838	ZLRKXKUTCHZKGX-UHFFFAOYSA-N	429.864	1.986	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)c1cc2c(C(F)(F)F)cc(O)nc2o1	725741761	SOAMTMATWCWJDY-UHFFFAOYSA-N	428.348	1.805	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)NCC1(c2cccc(Cl)c2)CCOCC1	725871191	HKQQFJVREBSSHV-UHFFFAOYSA-N	434.880	1.742	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NNC(=O)CC12CC3CC(CC(C3)C1)C2	725872753	GPDRIZVULNQCFX-UHFFFAOYSA-N	433.534	1.446	50	20	IDGD	
COc1cccc(C(=O)NNS(=O)(=O)c2ccc(OCCCC(=O)O)c(C)c2)c1O	726155537	SCJHIFFCLSRWTD-UHFFFAOYSA-N	438.458	1.576	50	20	IDGD	
CCC[C@@H](NC(=O)NNC(=O)CNC(=O)c1ccco1)C(=O)N1CCc2sccc2C1	727230525	XRKCFODJBLRNGG-CQSZACIVSA-N	447.517	1.155	50	20	IDGD	
CCCCn1c(C)cc(/C=C(/C#N)C(=O)N2CCN(CC(=O)NCCOC)CC2)c1C	728197791	CGXPQUUFZRMDNT-QNGOZBTKSA-N	429.565	1.719	50	20	IDGD	
C[C@@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(S(=O)(=O)NNC(=O)C(C)(C)C)cc2)C1	728260822	SYSLHHLBSYYGFG-ZIAGYGMSSA-N	431.580	1.709	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cccc(OC(F)F)c2)cc(OC)c1OCC(N)=O	728486385	BGCLMYGKULFNEW-UHFFFAOYSA-N	439.371	1.244	50	20	IDGD	
CCn1c(=O)c2ccccc2n(CC(=O)NNC(=O)c2cccc(OC(F)F)c2)c1=O	728487106	STTFFIHVKHALLI-UHFFFAOYSA-N	432.383	1.246	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(-n2cnnn2)cc1)c1cc(F)ccc1Br	728509710	LQPYUMOGQNYJCI-UHFFFAOYSA-N	441.242	1.187	50	20	IDGD	
NC(=O)C1CCN(c2ncccc2CNC(=O)NNC(=O)CCCc2ccccc2)CC1	729230433	XMYSYZLYKRDTTQ-UHFFFAOYSA-N	438.532	1.637	50	20	IDGD	
CSCC[C@H](C(=O)NNC(=O)CCc1ccccc1O)N1C(=O)c2ccccc2C1=O	730034139	VLNRDKVMDYMTMB-QGZVFWFLSA-N	441.509	1.890	50	20	IDGD	
Cc1nn(-c2ccc(F)cc2)c(Cl)c1C=NNC(=O)CSc1nnc(O)nc1O	730556283	KOZRXJDFBCCFPA-UHFFFAOYSA-N	437.844	1.812	50	20	IDGD	
O=C(CNC(=O)c1ccc(Br)s1)NNC(=O)COc1ccccc1O	730835773	LMUQXMRXBCVISZ-UHFFFAOYSA-N	428.264	1.172	50	20	IDGD	
CC1CCC(N2C[C@H](C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)CC2=O)CC1	731328266	CEQUPOCHHDJHDZ-IIIMJFFVSA-N	428.537	1.268	50	20	IDGD	
CC(C)N(C)S(=O)(=O)c1ccc(CNC(=O)NNC(=O)Cc2ccccc2F)cc1	731361540	MVOKCHBGUSGRGX-UHFFFAOYSA-N	436.509	1.928	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2ccc3ccccc3n2)nnn1-c1ccc2c(c1)OCCO2	731454151	TZLGYWPEFFHPIH-UHFFFAOYSA-N	430.424	1.970	50	20	IDGD	
CCCn1c(S[C@H](C)C(=O)NNC(=O)CC(C)C)nc2cc(S(N)(=O)=O)ccc21	731904895	UJVPRBFCMZGSQQ-GFCCVEGCSA-N	441.579	1.768	50	20	IDGD	
CC(CS(C)(=O)=O)=NNC(=O)c1cc(S(=O)(=O)NCc2ccccc2)ccc1O	732528600	QTJDZXNNBHKIIR-UHFFFAOYSA-N	439.515	1.021	50	20	IDGD	
CC(C)CNC(=O)N1CCC[C@H](CC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)C1	741178777	OORSQOZZAPYCTG-OAHLLOKOSA-N	438.550	1.319	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2nc(C)n3ccccc23)c1	741207023	LZXUKCHVLUPJNJ-UHFFFAOYSA-N	429.502	1.748	50	20	IDGD	
O=C(COC(=O)[C@H]1CCCN(Cc2ccccc2)C1)NNC(=O)c1ccc([N+](=O)[O-])cc1	741326576	LTSIYFZTPLACMA-SFHVURJKSA-N	440.456	1.811	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)n1nnc(-c2ccccc2)n1	742468127	BSKAOENDRGEUEE-SFHVURJKSA-N	448.531	1.261	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)[C@H](c2ccccc2F)N2CCOCC2)nc2ccccc21	742474201	NGGNUZDANNCURL-NRFANRHFSA-N	425.464	1.476	50	20	IDGD	
CCOc1ccc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)c3ncccn3)cc2)cc1	743288973	LZTAGYUNLSYGNK-UHFFFAOYSA-N	441.469	1.751	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NC[C@@H](C)N2CCC(C)CC2)cc1	743340869	MXCRULLCPCEREJ-QGZVFWFLSA-N	439.582	1.066	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCCN1c2ccccc2C[C@@H]1C	744277808	NSHFUHLDWJBYOP-AWEZNQCLSA-N	444.561	1.683	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)cc1	744491012	IBKBLQWOFHEYRU-UHFFFAOYSA-N	437.412	1.685	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)C2CCN(c3nc4ccccc4o3)CC2)cc1	744531368	GZVUHIGBSGYFCV-UHFFFAOYSA-N	447.451	1.920	50	20	IDGD	
O=C(NNc1c(F)cc(F)cc1Br)N[C@@H]1CCN(CCN2CCOCC2)C1	745827512	LAXPOLRYBFRTCF-CYBMUJFWSA-N	448.312	1.760	50	20	IDGD	
COc1cc(C=NNC(=O)[C@H](C)CN2C[C@H](C)O[C@@H](C)C2)cc(Cl)c1OCC(N)=O	745986569	LHQIKEKCTVVOHU-RDBSUJKOSA-N	440.928	1.408	50	20	IDGD	
Cc1cc(=O)n(CC(=O)NC(C)C)c(C)c1C(=O)NNC(=O)Cc1c[nH]c2ccccc12	746098614	WDXUSEBICNVRTB-UHFFFAOYSA-N	437.500	1.475	50	20	IDGD	
Cc1ccccc1NS(=O)(=O)c1ccc(C)c(C(=O)NNC(=O)C(=O)N2CCCC2)c1	748246485	AHFFGPATLNWROO-UHFFFAOYSA-N	444.513	1.488	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)N2CCC([C@@]3(C)NC(=O)NC3=O)CC2)c1C	748376046	RKFPLRFOMPXZFD-YAECTWJJSA-N	427.505	1.495	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)CCN/C(O)=C1\N=CC=CC1=O	748593670	JNJSJDSRPZVBPF-ISLYRVAYSA-N	435.506	1.123	50	20	IDGD	
COC(=O)c1c(CC(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)[nH]c(C(C)=O)c1C	748611921	UVDFPPJRIGESOD-UHFFFAOYSA-N	443.428	1.994	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)c2ccc(F)c(NS(C)(=O)=O)c2)o1	751364119	PIEYBFLZYCXVID-UHFFFAOYSA-N	426.470	1.707	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)c3ccc(C#N)[nH]3)c2)cc1	751539056	OLTUOKAVMDRIGB-UHFFFAOYSA-N	439.453	1.771	50	20	IDGD	
C[C@H](C[S@](C)=O)NC(=O)NNc1ccc(S(=O)(=O)NC2CCCCCCC2)cn1	753358463	JUGWNQTVHIMNHB-SUMNFNSASA-N	445.611	1.866	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3ccc4c(c3)ncn4C)cc2)CC1	753655184	ALHCPDICLVSWFO-UHFFFAOYSA-N	428.518	1.266	50	20	IDGD	
Cc1ccccc1-n1c(C)cc(/C=C(/C#N)C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)c1C	754753605	GJEJGTZBYNCCTK-BEWREHSGSA-N	440.525	1.892	50	20	IDGD	
CN1C(=O)C[C@H](NC(=O)NNC(=O)C(=O)Nc2ccccn2)[C@H]1c1ccc(Cl)c(F)c1	755087328	KTSZIZBIBHNIFR-XJKSGUPXSA-N	448.842	1.115	50	20	IDGD	
O=C(NNc1ccc(C(F)(F)F)nn1)[C@H]1CS[C@H](Cc2ccccc2F)C(=O)N1	755183556	YJRBGKNXVDMFEL-VXGBXAGGSA-N	429.399	1.921	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)Cc1ccc([N+](=O)[O-])cc1Br	755268849	VYVAKFJRFXBFMO-UHFFFAOYSA-N	441.263	1.539	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2ccc(-n3cccn3)cc2)cc1	755609520	NDRWQMQOVREXGS-UHFFFAOYSA-N	442.501	1.654	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2cc(OC)cc(OC)c2)cc(F)c1F	755959273	YZZGJGVJPZYQCA-UHFFFAOYSA-N	430.385	1.392	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCN(Cc3ccccc3)C[C@H]2C)cc1OC	756530135	SLQPEBNLHLHAAO-QGZVFWFLSA-N	426.517	1.671	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)Nc1ccc(S(=O)(=O)CCOC)cc1	756557039	ZNSKQCQJCZOSAL-UHFFFAOYSA-N	435.502	1.901	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)NCc2ccc3c(c2)C(=O)NCC3)cc1	758682578	HYVJILYQNBTRID-AWEZNQCLSA-N	426.473	1.669	50	20	IDGD	
Cc1nn(C)c(C)c1C[C@H](C)C(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758786561	NMXIYCJDUIPEIO-AWEZNQCLSA-N	436.557	1.851	50	20	IDGD	
O=C(NNC(=O)c1nc(-c2cccs2)n(-c2ccccc2)n1)C(=O)Nc1ccccn1	758827327	JSSUCUIJKGTEOO-UHFFFAOYSA-N	433.453	1.791	50	20	IDGD	
CCc1ccc(C=NNC(=O)Cn2c(=O)c3c(ncn3CC)n(Cc3ccccc3)c2=O)o1	760233898	MQVNNAYXVBHBCU-UHFFFAOYSA-N	448.483	1.734	50	20	IDGD	
NS(=O)(=O)c1ccc(C(=O)OCC(=O)NN=C(c2ccccc2)c2ccccc2)cn1	762873828	AQUUQQRPIGQNOB-UHFFFAOYSA-N	438.465	1.455	50	20	IDGD	
CNS(=O)(=O)c1ccc([C@@H](C)NC(=O)NNC(=O)CSc2ccccc2O)cc1	763476705	AYGPWWOFHLRMTL-GFCCVEGCSA-N	438.531	1.484	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2cccnc2)cccc1-c1nnc2n1CCCCC2	763494757	IRGOFIDWCBBEID-UHFFFAOYSA-N	433.472	1.775	50	20	IDGD	
CC(C)(C)OC(=O)N1CCc2ccc(NC(=O)C(=O)NNC(=O)c3cccnc3)cc2C1	763495352	RGOMGVZOZVLDPP-UHFFFAOYSA-N	439.472	1.775	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)N[C@H]1CC(=O)N(CCOc2ccccc2)C1	763507400	AUQBLHSCQRZHQP-HNNXBMFYSA-N	444.513	1.495	50	20	IDGD	
CC[C@@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(OC)c(OC)c2)cc1	763549880	AZGHTOMYLGTIOX-CYBMUJFWSA-N	442.472	1.632	50	20	IDGD	
CCN1CCN(C(=O)c2ccc(NC(=O)C(=O)NNC(=O)c3cc(C)oc3C)cc2)CC1	763586766	QTFHYPRWTCVKOG-UHFFFAOYSA-N	441.488	1.074	50	20	IDGD	
CCN1CCC(n2nccc2NC(=O)C(=O)NNC(=O)COc2cccc(C)c2)CC1	763624195	KXFPVSWGURGAKK-UHFFFAOYSA-N	428.493	1.013	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(N3CCSCC3)cc2)cc1	763674978	RXHKTHMYNBMZOG-UHFFFAOYSA-N	439.497	1.276	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc2c(c1)C(=O)CCC2	763684812	OAGDXAFGLNQJES-UHFFFAOYSA-N	425.441	1.769	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(OC)c(OC)c(OC)c1	763717286	VDAZBXBAVIDRSI-UHFFFAOYSA-N	431.445	1.440	50	20	IDGD	
Cn1cc(Br)cc(NC(=O)C(=O)NNC(=O)c2cccc(Cl)c2)c1=O	763748112	WVEJUIRKNHPEOU-UHFFFAOYSA-N	427.642	1.201	50	20	IDGD	
CC(C)Oc1cc(F)ccc1NC(=O)C(=O)NNC(=O)c1nnc(O)c2ccccc12	763790835	PYXPBVZBUZGJKN-UHFFFAOYSA-N	427.392	1.661	50	20	IDGD	
Cc1ccc(NC(=O)C(C)C)cc1NC(=O)C(=O)NNC(=O)COc1ccc(F)cc1	763837254	CIZURQXKBJQVTM-UHFFFAOYSA-N	430.436	1.894	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccnn2C2CCCC2)cc1	763862542	XXWXOGNLBRSMDW-CQSZACIVSA-N	429.477	1.950	50	20	IDGD	
Cc1ccc(C(=O)NC2CC2)cc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccc(F)cc1	763871325	FUQJGMUYHXTNDP-CYBMUJFWSA-N	442.447	1.580	50	20	IDGD	
Cc1nc(Br)ccc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccc(F)cc1	763874010	YQFHZJLGEYLHPN-SNVBAGLBSA-N	439.241	1.845	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cccc(OCC#N)c2)ccc1OC(C)C	763916630	PZBRMIMYXCINFS-UHFFFAOYSA-N	426.429	1.784	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)C(=O)Nc1ccccc1-n1cccn1	763944745	PBIGQTIFGIQUDA-UHFFFAOYSA-N	431.412	1.163	50	20	IDGD	
O=C(NNC(=O)c1cc(Cl)ccc1O)C(=O)Nc1cc2c(cc1Cl)OCCO2	763979017	QMXYEPDMDOXEPT-UHFFFAOYSA-N	426.212	1.870	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)C(=O)Nc1cccc(COC2CCCCC2)c1	763996919	HBOSDIGCGPLVIU-HNNXBMFYSA-N	437.518	1.057	50	20	IDGD	
COCC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)Cc2cccc3ccccc23)cc1	764035790	IFTLVAMJFOVMTJ-UHFFFAOYSA-N	434.452	1.753	50	20	IDGD	
O=C(NNC(=O)c1cccc(Br)c1)C(=O)Nc1ccc(NC(=O)C2CC2)nc1	764062923	FWBMEYRKKOIKSQ-UHFFFAOYSA-N	446.261	1.592	50	20	IDGD	
CC[C@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(S(=O)(=O)N2C[C@@H](C)C[C@H](C)C2)cc1	764084767	WGHFSCQSFUNIDP-KKUMJFAQSA-N	438.550	1.485	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2ccc(Cl)nc2)cccc1C(=O)N1CCCC1	764099861	DHYZSIPHBCUHNP-UHFFFAOYSA-N	429.864	1.679	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cc(-c3nnc4n3CCCCC4)ccc2F)n[nH]1	764100116	VQFJZNXYQOQYTG-UHFFFAOYSA-N	440.439	1.242	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1cc(C)nn1-c1ccccc1F	764131679	KBFLCUQXWJBNSU-UHFFFAOYSA-N	425.420	1.657	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(O[C@@H]3CCOC3)cc2)o1	764139033	NHFSDDZSFJKTAB-GOSISDBHSA-N	444.488	1.689	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2O1)C(=O)Nc1cccc(C#Cc2ccccn2)c1	764151036	DUGIQVPBAITRBY-NRFANRHFSA-N	426.432	1.571	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)nn1-c1cccc(Cl)c1	764164851	UMKNKNXIJFPJOZ-KRWDZBQOSA-N	439.859	1.924	50	20	IDGD	
O=C(CCc1ccco1)NNC(=O)C(=O)Nc1cccc(-c2nnc3n2CCCCC3)c1	764169740	RFJKGPGTBPEGDT-UHFFFAOYSA-N	436.472	1.983	50	20	IDGD	
Cc1ccc(C(=O)NCC(F)(F)F)cc1NC(=O)C(=O)NNC(=O)c1scnc1C	764247986	XJQLXPKKYNHKSQ-UHFFFAOYSA-N	443.407	1.452	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2cc(Br)ccc2O)cccc1[N+](=O)[O-]	764278022	PYVGYDUKLFGZCG-UHFFFAOYSA-N	437.206	1.771	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)C(=O)Nc1ccc(I)cc1Cl	764298013	LZXBWJFVXOIZBR-UHFFFAOYSA-N	447.620	1.376	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2cccs2)[nH]n1)C(=O)Nc1ccc2c(c1)OC(F)(F)O2	764376433	DGDSYAULVGFSJA-UHFFFAOYSA-N	435.368	1.859	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cnn(-c4ccncc4)c3)n[nH]2)cc1	764387321	JSIUBOODAMDYTA-UHFFFAOYSA-N	444.455	1.620	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)C(=O)Nc1cc(C(F)(F)F)cnc1O	764402373	ZRHMHXCEBSXJGD-UHFFFAOYSA-N	430.364	1.390	50	20	IDGD	
COc1ccccc1-c1ccc(C=NNC(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)cc1	764817254	OPXWSSOZLNISKU-UHFFFAOYSA-N	446.467	1.260	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)c3ccc(S(=O)(=O)N(C)C)o3)n[nH]2)c1	765575447	IOFXPZIJIXQQAS-UHFFFAOYSA-N	431.474	1.612	50	20	IDGD	
CN1CCN(C(=O)c2ccc(CNC(=O)NNc3ncnc4ccsc34)cc2)CC1	765674864	DEURNEQIYTWAAC-UHFFFAOYSA-N	425.518	1.905	50	20	IDGD	
COC(=O)[C@@H](NNC(=O)CNC(=O)c1cccs1)c1cccc(Br)c1	766732084	COETYQZTKASUBW-AWEZNQCLSA-N	426.292	1.776	50	20	IDGD	
O=C(CSc1nnc(-c2cnccn2)n1Cc1ccco1)NNC(=O)c1ccccc1	768415788	SPPQYBXHGAJBFA-UHFFFAOYSA-N	435.469	1.930	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)N[C@@H]1CC(=O)N(Cc2ccccc2C(F)(F)F)C1	768519493	VADMYALOXBCGAK-GXTWGEPZSA-N	446.426	1.188	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)NCc3ccc(N4CCOCC4)nc3)nc21	769934157	LGUREBCDLCDVNO-UHFFFAOYSA-N	441.496	1.345	50	20	IDGD	
C[C@@H](CBr)COC(=O)CNS(=O)(=O)c1ccc(N2CCCC2=O)cc1	770316578	GJSCNBCQAXKNSM-LBPRGKRZSA-N	433.324	1.666	50	20	IDGD	
CCc1nn(C)cc1C(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	770629000	UGAGDGKJQOYQGX-UHFFFAOYSA-N	430.472	1.759	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2ccc3nc(C)ccc3c2)cc1	773253301	XPCDNVFAUJWCMM-UHFFFAOYSA-N	426.498	1.933	50	20	IDGD	
Cc1ccc(-n2nc(C)cc2NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2F)nn1	773497706	ZBTMNFRFEJPQFK-UHFFFAOYSA-N	431.815	1.471	50	20	IDGD	
O=C(NNc1ncc(Cl)cc1Cl)C(=O)Nc1ccc(C(=O)N2CCOCC2)cc1	773672583	FIJKUUPEGGOKLG-UHFFFAOYSA-N	438.271	1.943	50	20	IDGD	
CSCC[C@H](C(=O)NNc1cc(Cl)nc(N)n1)N1C(=O)[C@H]2CCCC[C@H]2C1=O	773860933	KBEBFYWBUIQTML-OUAUKWLOSA-N	426.930	1.452	50	20	IDGD	
Cc1cccc(F)c1S(=O)(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	775247856	CZUPQZKGTQBVSY-UHFFFAOYSA-N	441.506	1.542	50	20	IDGD	
CN(C)C(=O)[C@@H]1CC[C@@H](CNC(=O)NNC(=O)c2cc(F)ccc2Br)O1	775455514	VCGNIVOVMMSUMI-GWCFXTLKSA-N	431.262	1.168	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)NCC[C@@H]1CCN(C(=O)OC(C)(C)C)C1	778663183	SHYDXMYPDHZFHC-CYBMUJFWSA-N	429.518	1.489	50	20	IDGD	
COCCO[C@@H]1CCN(C(=O)NNC(=O)[C@H](C)Oc2cccc(Br)c2)C1	780951967	MHJQQVZUOUSJIX-SWLSCSKDSA-N	430.299	1.695	50	20	IDGD	
C[C@H]1CN(C)C(=O)CN1C(=O)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1	782564230	YEPBTAJKXFXOKO-UWJYYQICSA-N	435.528	1.517	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NN=c2sc3ccccc3n2C)cc1N1CCOC1=O	783349500	KCSUAFZMYOQJFR-UHFFFAOYSA-N	441.469	1.776	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](n2cc(C(=O)NNC(=O)Cc3ccncc3)cn2)C1	784681377	ZSEVQQAMZNJCIX-KRWDZBQOSA-N	428.493	1.854	50	20	IDGD	
COc1ccc2nc(NNC(=O)C(=O)Nc3ccc(C)c(-n4cnnn4)c3)c(C)cc2c1	785166279	LBZJPCORYHELCJ-UHFFFAOYSA-N	432.444	1.918	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)cc1	785676012	OCOKPGBOZMMIOK-UHFFFAOYSA-N	434.368	1.270	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)[C@@H](C)C2CN(C(=O)OC(C)(C)C)C2)n1	786984790	KBAZXNWZKQMSEN-LBPRGKRZSA-N	440.522	1.188	50	20	IDGD	
NS(=O)(=O)c1ccccc1NNC(=O)c1ccc(F)cc1I	788229100	SCFOSGPZDUNTJX-UHFFFAOYSA-N	435.218	1.835	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)N[C@H]1CCN(Cc2ccc(C)cc2)C1=O	790700888	KMLKPMVFFVSYSP-SFHVURJKSA-N	440.500	1.904	50	20	IDGD	
C[C@@](O)(Cn1cc(C(F)(F)F)ccc1=O)C(=O)NNc1ccccc1S(C)(=O)=O	792238889	YLUHNZLSCYHWPI-MRXNPFEDSA-N	433.408	1.165	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc2c(c1)nc(CCC(=O)NNC(=O)OC)n2CC	792606674	ZYNPLJKLAZKHCK-UHFFFAOYSA-N	425.511	1.407	50	20	IDGD	
CC(=O)NC[C@H]1CCn2ncc(C(=O)NNC(=O)CC34CC5CC(CC(C5)C3)C4)c2C1	792734725	AFPKOLJRIUBLOJ-SCUMNGBJSA-N	427.549	1.949	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)F)cc1)C(=O)Nc1cccc(Br)n1	793017936	MHSYJVAXLPYJGW-UHFFFAOYSA-N	449.233	1.922	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)C(=O)Nc1cccc(-c2cccc(Cl)c2)c1	793022351	VZSQEOBFJUIMQW-CQSZACIVSA-N	435.889	1.528	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)C1CC(c2ccc(F)cc2)C1	794393451	PQWBTNSHMDMALW-UHFFFAOYSA-N	438.503	1.925	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccn(S(=O)(=O)c3ccc(C)cc3)c2)cc1	801109430	NDHKFAIFJHIPBK-UHFFFAOYSA-N	440.481	1.742	50	20	IDGD	
CN(CC(=O)NNC(=O)Nc1c(Cl)cc(Cl)cc1Cl)[C@@H]1CCS(=O)(=O)C1	802069339	HDUMKJBFOKETQA-SECBINFHSA-N	443.740	1.918	50	20	IDGD	
CS(=O)(=O)CC[C@H](NC(=O)c1ccccc1Cl)C(=O)NNc1cccc(F)n1	804767203	ZGJWBMXFKOCJBA-ZDUSSCGKSA-N	428.873	1.551	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)(F)F)cc1)C(=O)Nc1cc2n(n1)CCCC2	807001029	MWSLROIMKYDVRH-UHFFFAOYSA-N	431.396	1.595	50	20	IDGD	
CN1CCN(C(=O)NNC(=O)CCc2nc3cc(Br)ccc3s2)CC1	807381832	KPNLFCUQFQDWKN-UHFFFAOYSA-N	426.340	1.980	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)N1CCN([C@H]2CCN(C(=O)OC(C)(C)C)C2)CC1	808769882	DONPPBYXSMOYSX-SJORKVTESA-N	425.574	1.195	50	20	IDGD	
COC(=O)Cc1occ(C)c1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	809957091	IYUWLCKOLWGOTH-UHFFFAOYSA-N	449.485	1.163	50	20	IDGD	
C=C[C@](C)(O)CC(=O)NNC(=O)c1ccc(NS(=O)(=O)c2ccc(OCC)cc2)cc1	809982092	IINTXRRGOALIHK-NRFANRHFSA-N	447.513	1.974	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CNS(=O)(=O)c2ccc3ccccc3c2)c(OC)c1	810355517	GJBKRCWIEAWPJM-UHFFFAOYSA-N	443.481	1.597	50	20	IDGD	
O=C1COc2c(cccc2NC(=O)C(=O)NNC(=O)c2ccc(Br)s2)N1	810384100	CIPWSPKVPJRWGP-UHFFFAOYSA-N	439.247	1.241	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1)NNc1nc2ccccn2n1	811440165	PNTKWOSYBBZKCR-UHFFFAOYSA-N	448.814	1.823	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(=NNC(=O)C(=O)Nc2ccccn2)[C@H]([C@@H]2CCOC2)C1	812226310	KVBPIBFYZBDEMM-CABCVRRESA-N	431.493	1.786	50	20	IDGD	
COCc1nc(CNC(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)cs1	812551949	LLIGBHGIYHNPSV-UHFFFAOYSA-N	430.490	1.725	50	20	IDGD	
COc1ccc(CNC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c(OC)n1	812616199	UPSQUVHRHZALNG-UHFFFAOYSA-N	442.520	1.142	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)Nc2cc(Br)c(=O)n(C)c2)cc1	812953604	HACXYSGGGKPLBK-UHFFFAOYSA-N	444.311	1.547	50	20	IDGD	
COC(=O)c1cc(C(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)c[nH]1	814211820	RJQOIPDHRWYVJK-UHFFFAOYSA-N	445.435	1.634	50	20	IDGD	
Cn1ccc(CCC(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)n1	814266676	VPMFBJOEGBJPKN-UHFFFAOYSA-N	430.472	1.516	50	20	IDGD	
CCn1ncc(C(=O)NNC(=O)c2cccc(S(=O)(=O)Nc3ccc(OC)cc3)c2)n1	814698327	ZKXBDBXKBKJRBQ-UHFFFAOYSA-N	444.473	1.182	50	20	IDGD	
O=C(NNc1c(F)cccc1F)C(=O)Nc1cccc(S(=O)(=O)C2CCOCC2)c1	815574496	RUHGJGGZFBPYOU-UHFFFAOYSA-N	439.440	1.999	50	20	IDGD	
Cc1ccc(NNC(=O)C(=O)Nc2ccc([N+](=O)[O-])c(I)c2)nn1	815593458	MOEJOOSGZQFOOB-UHFFFAOYSA-N	442.173	1.380	50	20	IDGD	
CCOc1ccc(NNC(=O)C(=O)Nc2ccc(C(=O)N3CCOCC3)c(F)c2)cc1	815817376	PGKKLPLZPFWDEG-UHFFFAOYSA-N	430.436	1.779	50	20	IDGD	
O=C([C@H]1CCCN(c2ccccc2)C1=O)N1CCN(S(=O)(=O)CBr)CC1	815964339	FLUYNONITUSOBG-OAHLLOKOSA-N	444.351	1.256	50	20	IDGD	
COc1ccc(-n2nnc(C(=O)NNc3ccccc3S(=O)(=O)N(C)C)c2C)cc1	817054318	DSXZUTUFGXUAQC-UHFFFAOYSA-N	430.490	1.592	50	20	IDGD	
O=C(CC1CC1)NNC(=O)c1ccc(NC(=O)C[C@H]2SC(N3CCCC3)=NC2=O)cc1	819109947	QMXKPBRABUXMSB-MRXNPFEDSA-N	443.529	1.670	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)NC2CCN([C@H]3CCN(C)C3=O)CC2)c1C	819805337	XSCCNUPSKBDRTG-PHJXOXRPSA-N	427.549	1.470	50	20	IDGD	
O=C(COC(=O)[C@H]1CCCN1C(=O)c1ccccc1)NNC(=O)c1ccc([N+](=O)[O-])cc1	912682372	VBHMVCYVMWRYMK-QGZVFWFLSA-N	440.412	1.204	50	20	IDGD	
O=C(Cn1c(COc2ccc(Cl)cc2)nc2ccccc21)NNC(=O)[C@H]1CCC(=O)N1	913055112	HGYKCJIMOHDSBK-MRXNPFEDSA-N	441.875	1.695	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)CNS(=O)(=O)c3cccc(F)c3)cc2C1	913162348	BLBLUYJRWPNMRM-NSHDSACASA-N	425.507	1.752	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)[C@H]2CC(=O)N(C(C)(C)C)C2)cc1	914747673	CZSXEBUOGDSZNX-HNNXBMFYSA-N	430.534	1.515	50	20	IDGD	
COc1cccc(C[C@@H](C(=O)NNC(=O)COc2cc(C)ccc2C)n2nnnc2C)c1	915695544	PLUSCTYFHAOXCZ-IBGZPJMESA-N	438.488	1.617	50	20	IDGD	
COc1ccc([C@@H](CNC(=O)NNC(=O)c2ccc3c(c2)OCCO3)N(C)C)cc1OC	915893794	BXZUNFXZLNYVIU-MRXNPFEDSA-N	444.488	1.722	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1ccccc1	915903818	GVYQJNADFKBAJU-INIZCTEOSA-N	446.529	1.455	50	20	IDGD	
COc1cc(C(=O)NNC(=O)COc2cccc(C)c2)ccc1OCC(=O)NC(C)C	916092867	LUVACNCHINKVPL-UHFFFAOYSA-N	429.473	1.747	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CS(=O)(=O)Cc2ccc(C#N)cc2)ccc1OC(C)C	916143517	MVROTQYETJSFME-UHFFFAOYSA-N	445.497	1.730	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)NCCc2cc(OC)c(OC)cc2[N+](=O)[O-])c1	916219620	IHTMRYDFOMOEFP-UHFFFAOYSA-N	448.432	1.816	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)NCc1ccnc(N2CCN(C)CC2)c1	916390452	RCXUKOUVZKYIIV-OAHLLOKOSA-N	430.484	1.270	50	20	IDGD	
COc1ncccc1CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	916398623	BPZRQTPWBHXUDZ-UHFFFAOYSA-N	447.517	1.409	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)COCc2ccccc2)sc(C)c1C	916563036	PUDUJMHODQUSLE-UHFFFAOYSA-N	433.486	1.844	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCCCN(C)CC(F)(F)F	916581154	NQVRPNBSPPQGOO-UHFFFAOYSA-N	438.476	1.116	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2ccccc2F)ccc1Br	918146022	LNKQRJNHMXJHJF-UHFFFAOYSA-N	431.239	1.998	50	20	IDGD	
O=C(NNC(=O)c1cc2ccccc2cc1O)c1ccc(S(=O)(=O)N2CCCC2)o1	918781391	ZLAMXNOPSBJVHF-UHFFFAOYSA-N	429.454	1.998	50	20	IDGD	
O=C(COC(=O)Cn1nc(-c2ccccc2)ccc1=O)NNC(=O)c1cccc(Cl)c1	919545999	MVOVSVUSNGRMCH-UHFFFAOYSA-N	440.843	1.568	50	20	IDGD	
C[C@@H]1CCC[C@H](CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)C1	919916148	PLJGJVPEJYVRSM-CVEARBPZSA-N	438.550	1.478	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cnn(C)c2-n2c(C)ccc2C)cc(OC)c1OC	919976596	PCOHMJCRRYQGAR-UHFFFAOYSA-N	427.461	1.928	50	20	IDGD	
CC(=O)N1C[C@H](C(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)Oc2ccccc21	920057610	LMKKHIVFWJJIAL-QGZVFWFLSA-N	431.832	1.458	50	20	IDGD	
C[C@@H](Sc1ccccc1C(=O)NNC(=O)C1CCN(c2ncccn2)CC1)C(N)=O	1116938634	RNRONWYBZHZQMT-CYBMUJFWSA-N	428.518	1.120	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCC(=O)NNC(=O)Cn2ccc3ccccc32)cc1	1117676249	XBGOGOLDBBMKCT-UHFFFAOYSA-N	430.486	1.166	50	20	IDGD	
COc1ccc(/C=C(/C#N)C(=O)N2CCN(c3ccccc3F)CC2)cc1OCC(N)=O	1317700789	SJKGTZAKFVWDIP-ATVHPVEESA-N	438.459	1.954	50	20	IDGD	
NC(=O)c1ccc(/C=C/C(=O)N2CCC[C@@H]2C(=O)NNC(=O)c2ccccc2Cl)cc1	1317965718	XONLAZDFNJQGBE-ZPHJMFTNSA-N	440.887	1.904	50	20	IDGD	
O=C(NCc1cccc(CN2CCCC2=O)c1)NNC(=O)c1nnc(O)c2ccccc12	1318390584	IDCMFODDVJZLQH-UHFFFAOYSA-N	434.456	1.602	50	20	IDGD	
Cn1c(C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc(Br)c1C=O	1318860611	VGUQBPIKISJMBK-UHFFFAOYSA-N	428.264	1.078	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)[C@@H]2CC23CCS(=O)(=O)CC3)c1	1325208331	CQUCZWRFYRVWQG-NSHDSACASA-N	431.308	1.894	50	20	IDGD	
CCOC(=O)c1cc(COC)cc(S(=O)(=O)NNC(=O)c2n[nH]c3c2CCCC3)c1	1326113061	TVKUCHUQZLISKM-UHFFFAOYSA-N	436.490	1.235	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4nncn4c3)C2)C1	1778593201	FVNGDJFIAQSQJJ-SCLBCKFNSA-N	436.310	1.204	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1n[nH]c3cccc(F)c13)CCO2	1779299838	ZYYIEPHDKNXJCA-HXUWFJFHSA-N	434.544	1.997	50	20	IDGD	
CCc1noc(C)c1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](Cl)COC)C2	1779776989	QCIAGDJTPPFFQU-YYFZDKIDSA-N	427.929	1.927	50	20	IDGD	
C=CCNC(=O)/C=C\C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@](C)(Cl)CCl)C1	1780705700	IMNZJIDCKIEYLV-CTFNTZBASA-N	446.375	1.595	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(CCN(C(=O)c3ccccc3-n3nccn3)C2)C1	1781836726	WEXGAUGQNMQXHJ-IBGZPJMESA-N	448.321	1.496	50	20	IDGD	
COc1cc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)c(F)c(OC)c1F	1781946265	FZRPRFKMTDFBFJ-HXPMCKFVSA-N	448.850	1.025	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)Cn1ccnc1)C2	1782002729	UYZUFDDNCLVGOH-YYAJDYIMSA-N	441.370	1.817	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CC[C@@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)cc1O	1782127325	SVWPFQJWTFORDL-OAQYLSRUSA-N	449.580	1.646	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CCC(=O)NN(C)C)C2)cnc1C	1782209521	XJLYZYLHTOMIMK-AUSIDOKSSA-N	445.564	1.199	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnn3c1OCCC3)C2)C(Cl)Cl	1782221498	WYHSDJCNKAHRDM-FZKQIMNGSA-N	431.320	1.597	50	20	IDGD	
O=C(c1n[nH]c2cccc(F)c12)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1782486443	SKOOCZLJRPWWHZ-RHSMWYFYSA-N	443.248	1.836	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1CCOC1)CCO2	1782867628	MPVAVKPTKGCBOJ-RQXWEQLASA-N	431.439	1.738	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cccc4c3cnn4C)CCO2)C1	1783534753	YSOQCYWLXWDDGB-BFUOFWGJSA-N	435.322	1.800	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)COc3ccc(O)cc3)[C@H]2C1	1783842529	JFZOBSKMIBVYHP-RUGDWHBFSA-N	426.897	1.005	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(C(F)(F)F)n3C)CCO2)C1	1783874843	LUGXNUXJFVGEFY-YVEFUNNKSA-N	437.846	1.741	50	20	IDGD	
CC(C)c1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc1	1783935391	PKEGHLRYMBYYMF-HSZRJFAPSA-N	430.549	1.627	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C[C@@H]3OCCc4ccccc43)C[C@@H]21)[C@H](O)CCl	1784085837	PQCANAROVOJUOT-UVBQOVKKSA-N	436.936	1.270	50	20	IDGD	
C[C@H](Sc1ccccn1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]2C1	1784096276	VARZOQCAZNXXNM-QXKUPLGCSA-N	427.954	1.142	50	20	IDGD	
O=C(Cc1cccc(Cl)n1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21	1785430849	PZXVWIIGCVAAQN-SDPXSBNPSA-N	448.720	1.948	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)CN3C(=O)CSC3=S)C2)C1	1785540541	YFJQRFVFIVADBY-YVEFUNNKSA-N	433.983	1.084	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NC1(c2ccc(NC(=O)[C@@H](O)CCl)cc2)CCC1	1786129291	KGCFWBZHXRHJIQ-KRWDZBQOSA-N	430.892	1.545	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)c1cnoc1C1CC1	1786291121	HYUGHTJLEGLTSC-NHULGOKLSA-N	430.274	1.836	50	20	IDGD	
Cc1cnc(C(=O)Nc2ccc(C3(NC(=O)c4ccc(B(O)O)cc4)CCC3)cc2)cn1	1787336926	UHAGWCFTOQBSTR-UHFFFAOYSA-N	430.273	1.526	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1	1788147787	FYWPJMKWCVTLJU-UHFFFAOYSA-N	440.381	1.966	50	20	IDGD	
C[C@@H](Cn1cccn1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]2C1	1789869081	XDMOSNSHQFVMLD-SIBFUHKCSA-N	431.364	1.735	50	20	IDGD	
COc1cnc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]3C2)c(F)c1	1789922119	HTQOFSAWJUDXTK-PBLBJHRBSA-N	448.264	1.513	50	20	IDGD	
CCOC(=O)O[C@@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](Br)CC)C[C@@H]21	1790609789	ILKIZGOSGXUIOO-LXFSFDBISA-N	449.342	1.701	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)C[C@@H]21	1791256578	CLGJJZZMOYRUHX-SPOWBLRKSA-N	441.868	1.148	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cn3nnc4ccccc43)C[C@@H]21)C(Cl)Cl	1791292299	AKGCZZUPWBKICU-HUBLWGQQSA-N	426.304	1.215	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN3C(=O)CSC3=S)[C@H]2C1	1792237822	TZFHUQCEABEUJO-AVGNSLFASA-N	448.010	1.091	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc([N+](=O)[O-])o1	1792356989	RNBUAUACXIZLSO-MIJXAVMKSA-N	430.255	1.565	50	20	IDGD	
C[C@@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](C)CBr)N1CCN(C)CC1	1792991665	RFMWQFFIVATLTA-VIQHNZTISA-N	429.403	1.292	50	20	IDGD	
CC(C)N(CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCl)C(=O)OC(C)(C)C	1793106682	QASSYBUHDFUALU-QKPAOTATSA-N	431.961	1.870	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2)C1CCN(Cc2ccccn2)CC1	1794160283	VRTPAPPKZXQYCK-NBMJBFSESA-N	438.931	1.418	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CC(=O)N(Cc2cccs2)C1)[C@H](O)CCl	1794239449	GXPUQWDRVXUYQK-OWVAZHOYSA-N	439.965	1.335	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CCC(=O)N1	1795700178	LAQHWSPTYBCCKK-AICCOOGYSA-N	442.944	1.035	50	20	IDGD	
COc1ccc(/C=C(\C)C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)cc1	1796190336	PFZMPIUDVDITGZ-FSTFLSAYSA-N	448.328	1.730	50	20	IDGD	
Cn1c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)ccc1C(F)(F)F	1796190950	HXEYSAZMCDOYAE-MUJYYYPQSA-N	449.238	1.289	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)C1=NO[C@H](c2ccccc2)C1	1796191570	YOZQQAGMJFRQDX-IIZPIQPGSA-N	447.300	1.136	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1snnc1C1CC1	1796704452	CMVLOUSNWSAIGR-SYEHKZFSSA-N	443.367	1.650	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](C)[C@@H]1SC(=N)NC1=O	1796879723	WYIAGMSQNLYVQP-UQPICLANSA-N	431.356	1.210	50	20	IDGD	
Cc1cccc2[nH]c(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)CCC(=O)NN(C)C)C4)cc12	1797404331	NLNLPXKKBGUCOO-MFKICJERSA-N	441.532	1.053	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc3nc[nH]c13)C2)[C@H](F)Br	1799346272	OAQUXLWLNVJAEI-FJHTZYQYSA-N	425.258	1.457	50	20	IDGD	
O=C1COc2ccc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)[C@H](F)Br)cc2N1	1800158486	NNINZLNZRCSILR-BUWBCJGYSA-N	440.269	1.960	50	20	IDGD	
CCOC(=O)C1(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](Br)CC)C3)CC1	1800367406	KGIHVLOFZHBRGF-CRWXNKLISA-N	431.327	1.093	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3cccnc3nc1O)C2	1800762684	YEYFDQRFSXFTIW-IKVITTDRSA-N	449.305	1.322	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c(c1)NC(=O)CC3)C2	1800979623	RVGOCQUAUHFKBW-YYAJDYIMSA-N	435.908	1.028	50	20	IDGD	
CCO/C=C/C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2	1801187668	WJHLHLHDRRHRMS-OZAHNZTQSA-N	447.444	1.274	50	20	IDGD	
C[C@H](Cn1ccnc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)CBr)C2	1801369060	SJDZLKOTKZZSLD-NPJQDHAYSA-N	427.343	1.140	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)Cc2ccc3c(c2)OCO3)[C@@H]1c1cccnc1)[C@H](O)CCl	1803137990	GHHHAHPADLNZAU-CSODHUTKSA-N	445.903	1.659	50	20	IDGD	
CC(C)(C)n1cc(C(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)nn1	1803141365	NKDKFIJHCGIOKO-PVAVHDDUSA-N	434.928	1.347	50	20	IDGD	
COC(=O)C1(C(=O)N2CC[C@@H](CNC(=O)CCBr)[C@@H]2c2cccnc2)CC1	1806346522	KADLHEXDWGDVFL-HOCLYGCPSA-N	438.322	1.826	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)C(C)(F)F)[C@@H]1c1cccnc1	1806961709	MORFHRSPFFZUOX-MNTZXMNTSA-N	446.458	1.877	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cccn3c(O)nnc23)[C@@H]1c1cccnc1)[C@H](F)Cl	1808308176	BOFZFTYNYRSMDY-CFVMTHIKSA-N	432.843	1.684	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cnc(O)[nH]2)[C@@H]1c1cccnc1)[C@@H](F)Br	1808668137	IZTBQIGETLLISS-CYZMBNFOSA-N	426.246	1.520	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)c1cn2ccccc2n1	1809048460	PRRHGCDSMCMRPL-VDZJLULYSA-N	427.892	1.649	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1	1809063453	VPYVWWFOZSEDNE-SQGPQFPESA-N	441.919	1.957	50	20	IDGD	
O=C(CCBr)N1CCC2(CCCN(C(=O)c3cnc(O)nc3O)C2)CC1	1810867795	UQYLGCUCJWKOAZ-UHFFFAOYSA-N	427.299	1.518	50	20	IDGD	
O=C(Cn1cccc([N+](=O)[O-])c1=O)N1CCC2(CCCN(C(=O)[C@H](F)Cl)C2)CC1	1810913148	LJFPYJPCBRHZAC-HNNXBMFYSA-N	428.848	1.522	50	20	IDGD	
Cc1ccn(C)c1C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1811607594	UJPGOOVNIKOLNW-UGKGYDQZSA-N	446.316	1.042	50	20	IDGD	
CC(=O)N[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@H]1c1cccnc1	1812657035	DKGJNAHSLFFGCN-SDJAHQOYSA-N	429.290	1.303	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)c2nc3ncccn3n2)[C@@H]1c1cccnc1)C(Cl)Cl	1813078785	AFSCRPRQHQCNNB-CHWSQXEVSA-N	434.287	1.643	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)Cc2ccc3c(c2)OCO3)[nH]n1)[C@@H](O)CCl	1814868578	ALERXDZCJPKDIK-CABCVRRESA-N	434.880	1.973	50	20	IDGD	
CCC[C@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](O)NC(=O)OCC)[nH]n1	1815320156	VYJFYTJVCXHDJD-GHJWDPDVSA-N	429.905	1.874	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)C(F)(F)Cl)[nH]n1)c1ccc(B(O)O)cc1	1817475473	PLCXIKMYSPAGIN-CYBMUJFWSA-N	426.616	1.227	50	20	IDGD	
O=C(Cc1ccccn1)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1817637438	RPZDLLOXJNELHZ-IBGZPJMESA-N	433.277	1.033	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1ccncc1F	1818393791	KBPAIEHBEGNQBU-GOSISDBHSA-N	437.240	1.243	50	20	IDGD	
Cc1ccn(C)c1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1820356396	AHSKESRLIQTGKI-SFHVURJKSA-N	435.293	1.356	50	20	IDGD	
CC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CNC(=O)C(F)(F)F)CC2	1822856858	WHHDSSFIGTZFSU-YUMQZZPRSA-N	426.848	1.751	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1c3c(nn1C)CCC3)CC2	1826004647	PXCCGMHKJFZNLA-CMPLNLGQSA-N	437.953	1.845	50	20	IDGD	
Cc1nn(C)c(C)c1CC(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)CCl)CC2	1826836025	CTJOULXDUFBREY-RISCZKNCSA-N	425.942	1.248	50	20	IDGD	
O=C(CCn1ccnn1)Nc1nc2c(s1)C[C@H](NC(=O)CCBr)CC2	1826871143	GNEWZOIIQYXGGN-SNVBAGLBSA-N	427.328	1.522	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)CCS(C)(=O)=O)sc2C1	1827215496	ZWTQLBLXDNDFBY-RKDXNWHRSA-N	438.369	1.273	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC([C@H]2CCCCN2C(=O)C2=NNC(=O)C2)CC1	1828863083	HLCNIUUZKQJLNV-UKRRQHHQSA-N	427.343	1.656	50	20	IDGD	
CC(C)(C)OC(=O)CC(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830353966	QDYOIXWXPKAJLL-FQEVSTJZSA-N	432.945	1.440	50	20	IDGD	
C[C@H](Sc1ccccc1)C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1	1830725245	IFGBNUCLNYCIBK-XAUMDUMWSA-N	442.965	1.223	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](NC(C)=O)C(C)(C)C)CCO2	1831095072	FZNMAMVMIQBVOJ-TWOQFEAHSA-N	431.961	1.011	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CN2CCOC2=O)CC1	1831649541	VTVBBMHMUWCYQS-ZFWWWQNUSA-N	430.343	1.842	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)C23CC(C2)C3)CC1	1832468843	BAHSUQYGGKESJY-HVWVKJRRSA-N	425.533	1.719	50	20	IDGD	
COc1cccc(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)n1	1832826024	KQGLZDDNCRFGBJ-IBGZPJMESA-N	446.331	1.283	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3cncc(C)c3)CCO2)C1	1832962052	DNRUZYUMYUOJMU-RXVVDRJESA-N	439.940	1.033	50	20	IDGD	
Cc1nc(C(=O)N2CCC(N3CCC(NC(=O)[C@H](O)CCl)CC3)CC2)sc1C	1833312537	QUJVMZAQWBPCPK-MRXNPFEDSA-N	428.986	1.545	50	20	IDGD	
O=C(CSc1ccncc1)NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1833765875	WGQXZSRAUKYTPC-GOSISDBHSA-N	440.997	1.345	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)C(=O)Nc3cccnc3)CC2)CC1	1835802594	VRNXRACQFQFBBB-LJQANCHMSA-N	449.983	1.999	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccncc3)CCO2)C1	1839060218	VBQNIQRDBQBSHG-RBUKOAKNSA-N	430.332	1.317	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4cnccc4n3)C2)C1	1839144549	DUESOHCXALVQLM-IERDGZPVSA-N	432.908	1.717	50	20	IDGD	
CCn1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)n1	1839150968	DJKYYPWTAGGPEH-MSOLQXFVSA-N	433.336	1.209	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)Oc1ccccc1)CCO2	1839219828	XIGSHMMXYYPVKI-MMOPVJDHSA-N	440.924	1.164	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](O)Cc3ccccc3)CCO2)C1	1839956313	MGQDIOOMESJPKO-GCJKJVERSA-N	438.952	1.311	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3ccccn3)C2)C1	1840031659	YUAQRPGMKBCRNY-HNAYVOBHSA-N	440.338	1.254	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccccc3F)C2)C1	1840151675	KGUGOVCTMYRJCG-OXQOHEQNSA-N	428.888	1.078	50	20	IDGD	
Cn1ncc2c(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)C(Cl)Cl)CCO4)cccc21	1840188688	XFNYGVJWJIECBE-LJQANCHMSA-N	441.315	1.447	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3ccoc3)CCO2)C1	1840516344	KHPIEZQEHYPIPP-OALUTQOASA-N	433.332	1.905	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(CN(C(=O)CC[C@@H]3CCOC3)CCO2)C1	1840588769	POYLOXYERGRJMJ-XLIONFOSSA-N	428.602	1.111	50	20	IDGD	
C[C@@H](O)[C@H](NC(=O)c1ccccc1)C(=O)N1CCCC12CN(C(=O)C(C)(C)CCl)C2	1841223258	OAGCLDAXZLVNRZ-WBVHZDCISA-N	435.952	1.634	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC12CN(C(=O)CN1C(=O)CSC1=S)C2	1841290152	QRENAPJNWBZOHK-JTQLQIEISA-N	434.381	1.081	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H]2C[C@@]21C(=O)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1	1841353950	ZIDRASVRBULKRJ-JZKQVHKSSA-N	427.929	1.189	50	20	IDGD	
C[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1C(=O)N1CCCC12CN(C(=O)[C@@H](O)CCl)C2	1841794046	YOZUHKXASFAWOQ-OAGGEKHMSA-N	443.972	1.683	50	20	IDGD	
CC[C@@H](C)[C@H](N)C(=O)N1CC2(CCCN2C(=O)c2cc([N+](=O)[O-])ccc2OC(C)=O)C1	1844692301	JLHWPHMVXMOAKY-ACJLOTCBSA-N	432.477	1.711	50	20	IDGD	
COC(=O)N[C@@H](C(=O)N1CC2(CCCN2C(=O)[C@H](F)Br)C1)c1ccccc1	1845215717	ADBSOPMBLAJGQM-KGLIPLIRSA-N	442.285	1.978	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H]1CCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl	1847559036	IYNUBWZMRQICKF-LTIDMASMSA-N	443.972	1.968	50	20	IDGD	
CCOC(=O)c1c(C)[nH]c(C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c1C	9158515	MVQWCCSOVZJTJG-UHFFFAOYSA-N	432.389	1.334	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2cccc(CS(C)(=O)=O)c2)c2ccccc2c1=O	14887841	AUDDPHXWHYQTEM-UHFFFAOYSA-N	428.470	1.036	50	20	IDGD	
Cc1ccc(S(=O)(=O)Nc2ccc(F)cc2)cc1C(=O)NNC(=O)C(=O)NC(C)C	46773293	ZCWBLFFXTRGGKI-UHFFFAOYSA-N	436.465	1.221	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)N2CCN(c3ncnc4c3cnn4C)CC2)c1C	302978096	SOIAEKDPMGAFQP-XDHOZWIPSA-N	448.531	1.684	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)c2oc3ccccc3c2CS(C)(=O)=O)cc1	726619918	PYDUFEFRLYBPTK-UHFFFAOYSA-N	431.470	1.859	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@H]2CCCC[C@H]2C(=O)N2CCCC2)cc(OC)c1OC	726864975	NCGASQXTOKKELA-JKSUJKDBSA-N	433.505	1.902	50	20	IDGD	
CCOc1ccc(OCC)c(NC(=S)NNC(=O)CN2C(=O)[C@H]3CCCC[C@@H]3C2=O)c1	727496106	CSMXPYARIQDTQQ-GJZGRUSLSA-N	448.545	1.977	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)c2cc(S(N)(=O)=O)ccc2OC)cc1F	727499616	MVMQKPOIOOFVHM-UHFFFAOYSA-N	428.467	1.122	50	20	IDGD	
O=C(CCCc1ccccc1)NNS(=O)(=O)c1ccc(S(=O)(=O)NC2CC2)cc1	727721887	YDMAVPPOUSDEOI-UHFFFAOYSA-N	437.543	1.460	50	20	IDGD	
CC(=O)c1cccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)Cc3cccnc3)CC2)c1	728852165	PQQFDYXMYFONBK-UHFFFAOYSA-N	444.513	1.075	50	20	IDGD	
NS(=O)(=O)c1ccc(C(=O)NNC(=O)c2ccc(Br)cc2Cl)s1	729372779	REPOSCDHTWGOON-UHFFFAOYSA-N	438.712	1.886	50	20	IDGD	
COC(=O)c1sc(S(=O)(=O)NNC(=O)c2scnc2C)c(C(=O)OC)c1C	729667295	ARBLUKXWPWGRNR-UHFFFAOYSA-N	433.489	1.018	50	20	IDGD	
O=C1CN(c2ccc(NC(=O)NNC(=O)COc3ccccc3O)cc2Cl)CCN1	730895241	DXVGVPFXMVZZCC-UHFFFAOYSA-N	433.852	1.214	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)c1sccc1S(=O)(=O)N1CCSCC1	731328681	CBNHJUKQJINHPF-UHFFFAOYSA-N	443.547	1.628	50	20	IDGD	
COCCOc1ccc(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1	731956902	ZYLMOWNPPYUUOV-UHFFFAOYSA-N	426.517	1.685	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)NCCCCN2C(=O)c3ccccc3C2=O)cc1	732470826	CLHQHJRCSSWBRD-UHFFFAOYSA-N	435.440	1.344	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NCCCC(=O)N2Cc3ccccc3C2)cc1	732474438	MRKAIAJAQULQRD-UHFFFAOYSA-N	426.473	1.727	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)NCCN1CCN(C(=O)C2CCCCC2)CC1	733336062	IVJFZNKRNLEGQN-UHFFFAOYSA-N	449.527	1.259	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)Cc2cnn(-c3ccccc3)n2)CC1	734825502	IHEJREMIDJEPPY-UHFFFAOYSA-N	443.508	1.540	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cnn(C)c2)cc1S(=O)(=O)N1C[C@H](C)C[C@@H](C)C1	735445449	VKWQIFTVRYNHJQ-ZIAGYGMSSA-N	449.533	1.170	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)[C@H]1CC(=O)N(c2ccccc2Br)C1	740850040	RHUPNEAENYXSJJ-NSHDSACASA-N	439.310	1.254	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(CC(=O)NNC(=O)c2cc(-c3ccccc3)on2)C(=O)C1	741213384	YXJXOZOFVVKJJL-UHFFFAOYSA-N	443.460	1.182	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)N[C@@H](Cn1cccn1)c1ccccc1	741280485	YXHQMONQJFGFIZ-IBGZPJMESA-N	434.504	1.661	50	20	IDGD	
O=C(CN1C(=O)[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)NNC(=O)NCc1cccc(C(F)(F)F)c1	742458115	UGRJAZVCMGYXGC-YXAMBPQSSA-N	436.390	1.343	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CCN2C[C@@H](C)O[C@H](C)C2)cc(OC)c1OC(F)F	743289512	XJDPMKKJVQLSLZ-VXGBXAGGSA-N	431.436	1.566	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1	743578429	KUAATKNIFZGTFV-UHFFFAOYSA-N	447.473	1.670	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)cc1S(C)(=O)=O	743829106	AGNUOVGVUKICAW-UHFFFAOYSA-N	425.488	1.269	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)cc1	745094732	SLSBBWYWIFGOTI-IBGZPJMESA-N	438.459	1.914	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1cc([N+](=O)[O-])ccc1O)c1ccc(N2CCOC2=O)cc1	745779321	CKEHFRANTRUNQA-LLVKDONJSA-N	429.389	1.962	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2Cc3ccccc3C[C@H]2C(=O)NNC(=O)c2ccc[nH]2)cc1	747663520	VSOAJHDUWOSDHU-FQEVSTJZSA-N	438.509	1.900	50	20	IDGD	
O=C(NN=Cc1ccc([N+](=O)[O-])c(O)c1)c1cccc(S(=O)(=O)N2CCOCC2)c1	748131623	LHOFVOQBDLZXJZ-UHFFFAOYSA-N	434.430	1.085	50	20	IDGD	
CCOCCCn1c(NNC(=O)[C@@H]2CC(=O)N(c3cn[nH]c3)C2)nc2ccccc2c1=O	748851742	LHFIYUKJZBUXAU-CQSZACIVSA-N	439.476	1.042	50	20	IDGD	
O=C(NCC(=O)N1CCN(c2ccccc2)CC1)NNC(=O)C12CC3CC(CC(C3)C1)C2	749220900	MTERLDNZFFILQI-UHFFFAOYSA-N	439.560	1.882	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)[C@H]1CCCN1S(=O)(=O)c1cccs1	749262604	XERAPLCUEIXIIF-CYBMUJFWSA-N	439.515	1.136	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CNS(=O)(=O)c2ccc(Cl)s2)cc1OC	749837699	GMGDUENILZHJTR-UHFFFAOYSA-N	433.895	1.158	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)NC[C@H]3CCC[C@]34NC(=O)N(C)C4=O)cc2C1	752000100	PWIIVWGVBMQRAP-YZRASEIHSA-N	433.534	1.537	50	20	IDGD	
CC(C)(C)OC(=O)N(CC(=O)NNC(=O)c1csc(N2CCOCC2)n1)C1CC1	753391737	IFVPAYQOFBIXKT-UHFFFAOYSA-N	425.511	1.140	50	20	IDGD	
COc1ccc(-n2c(SCC(=O)NNC(=O)CO)nnc2-c2ccc(C)cc2)cc1	753444959	SIOMCEBGHOOTHU-UHFFFAOYSA-N	427.486	1.483	50	20	IDGD	
O=C(NNC(=O)N1CCS(=O)(=O)[C@@H]2CCCC[C@@H]21)c1ccc(Br)s1	753811325	SSJUKALNEVDBKX-GXSJLCMTSA-N	436.353	1.907	50	20	IDGD	
COc1ccccc1-c1noc([C@H](C)NCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)n1	755039066	HWGGJYDFOLMQGI-LBPRGKRZSA-N	440.416	1.765	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)NCCN3C(=O)[C@@H]4[C@H]5C=C[C@@H](C5)[C@H]4C3=O)cc2C1	755082150	KTRHRGBVKNGJCV-RDLJHEDLSA-N	442.541	1.624	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1ccc(Br)c(C(F)(F)F)c1	755425366	PMZOZMJXHGEYEC-LURJTMIESA-N	447.233	1.558	50	20	IDGD	
CN1CCC/C1=N/S(=O)(=O)c1ccc(NC(=O)NNC(=O)c2cccc(C#N)c2)cc1	756073761	SJTACBXXUCROSC-BWAHOGKJSA-N	440.485	1.838	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)Nc2ccc(OC)c(-n3nnnc3C)c2)o1	756317720	AFHHDTZUUGQBIU-UHFFFAOYSA-N	442.480	1.881	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)Nc1nc2cc3c(cc2s1)OC(F)(F)O3	756505965	YXLHWCSHMNYXTK-ZCFIWIBFSA-N	434.402	1.205	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)Nc2cccc(S(=O)(=O)Nc3nccs3)c2)n1	756872103	AWCXAOGXKUMBQL-UHFFFAOYSA-N	449.518	1.610	50	20	IDGD	
C#Cc1cccc(NC(=S)NNC(=O)CN2C(=O)NC3(C[C@@H](C)C[C@H](C)C3)C2=O)c1	757642570	UBBOYDOQXVSASV-KBPBESRZSA-N	427.530	1.732	50	20	IDGD	
COc1ncncc1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	757690794	QQTQVAGBVHDYNB-UHFFFAOYSA-N	434.478	1.126	50	20	IDGD	
O=C(c1ccc(N=c2cc[nH]cc2)cc1)N1CCN(S(=O)(=O)CBr)CC1	758522001	CJRBJPLZTHUZQO-UHFFFAOYSA-N	439.335	1.687	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2ccnn2Cc2ccc(F)cc2)c1	760278387	CIQZVUFYWGPZPV-UHFFFAOYSA-N	425.420	1.544	50	20	IDGD	
Cn1cc(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)c2ccccc2c1=O	760391319	AQVKCQLKZXQVDP-UHFFFAOYSA-N	442.497	1.316	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3sccc3-n3cnnn3)n[nH]2)cc1OC	763148426	LMZVSNDDHPQHGM-UHFFFAOYSA-N	440.445	1.206	50	20	IDGD	
Cc1cc(Cl)ccc1OCCCC(=O)NNC(=O)c1ccnc2c(C(N)=O)cnn12	763458019	LNVMSHHLZRZZOY-UHFFFAOYSA-N	430.852	1.410	50	20	IDGD	
O=C(NNC(=O)c1ccccn1)C(=O)Nc1cc(Br)ccc1N1CCOCC1	763463450	JEEJRWDHPAATMZ-UHFFFAOYSA-N	448.277	1.080	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2ccncc2)cc1NC(=O)OC(C)(C)C	763465429	ZXLODYNKKWUYFJ-UHFFFAOYSA-N	429.433	1.837	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)S(=O)(=O)CC3)c2ccccc2n1	763618841	FZXQXEPFMCOLPY-UHFFFAOYSA-N	438.465	1.273	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(O[C@@H]3CCOC3)cc2)cc1	763661392	OSJOFBPOQSWIAP-GOSISDBHSA-N	429.429	1.028	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(OCC(F)(F)F)cc2)cc1	763675365	VHBVIYSDWZMYPG-UHFFFAOYSA-N	436.346	1.664	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccccc1N1CCOC1=O	763682622	SCCQMWZAQUZTIZ-UHFFFAOYSA-N	442.428	1.207	50	20	IDGD	
O=C(NNC(=O)c1cccc(Cl)c1)C(=O)Nc1ccc(CN2C(=O)CCCC2=O)cc1	763748059	VLUAWFFZEVTQIH-UHFFFAOYSA-N	442.859	1.779	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)C(=O)Nc1cccc(CN2CCCCC2)c1	763789766	CIDGKEQRQYBCSP-UHFFFAOYSA-N	448.483	1.721	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)cc1	763791753	WNTKSGFZKNJGQQ-UHFFFAOYSA-N	437.456	1.776	50	20	IDGD	
CC[C@@H](C)n1ncc(NC(=O)C(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])c1C1CC1	763802382	DJPJTTUVNRXRSP-GFCCVEGCSA-N	444.448	1.805	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)C(=O)Nc2cnn(C)c2C)c2ccccc2c1=O	763820703	NDBBVTWQWZSGHZ-UHFFFAOYSA-N	439.476	1.028	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccc(C(=O)NC2CCCC2)cc1	763841488	RPHVHJRBHONJGV-UHFFFAOYSA-N	442.447	1.663	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccc(OC[C@@H]2CCCO2)cc1	763848535	CRGSZHPOEWCSLS-YOEHRIQHSA-N	445.447	1.937	50	20	IDGD	
CCc1onc(C)c1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1cccc(Br)c1	763883475	OMFPVHYMKRUDKA-SNVBAGLBSA-N	439.266	1.861	50	20	IDGD	
CCn1nc(NC(=O)C(=O)NNC(=O)c2ccc(OC(C)C)c(OC)c2)cc1C1CC1	763916066	HIAJHTLHDHHADA-UHFFFAOYSA-N	429.477	1.976	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2ccc(OC(C)C)c(OC)c2)cc(OC)c1	763916275	LAWXRSBERWGBFV-UHFFFAOYSA-N	431.445	1.899	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Br)s2)cc1	763942316	XSQYCOGXPWOHTN-UHFFFAOYSA-N	426.248	1.697	50	20	IDGD	
NC(=O)CCOc1ccc(NC(=O)C(=O)NNC(=O)Cc2cccc3ccccc23)cc1	764019217	ILXMYBPIJASQLM-UHFFFAOYSA-N	434.452	1.423	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1ncn(Cc2ccc(Cl)cc2)n1	764049289	XMAVWGFPNDFWRR-UHFFFAOYSA-N	428.836	1.388	50	20	IDGD	
O=C(NNC(=O)c1cccc2ccccc12)C(=O)Nc1ccccc1CN1C(=O)CCC1=O	764058750	VMMOGHVHLXXUQW-UHFFFAOYSA-N	444.447	1.889	50	20	IDGD	
Cc1nc(-c2ccc(NC(=O)C(=O)NNC(=O)c3cccc(Br)c3)cc2)n[nH]1	764063715	WQJXBXGHRWJIKT-UHFFFAOYSA-N	443.261	1.942	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccccc2O[C@@H]2CCOC2)o1	764138097	AYYUGTCGXPZZIC-MRXNPFEDSA-N	444.488	1.689	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(F)cc2C(=O)OC)o1	764139715	ZVSYNHVUHVVWSY-UHFFFAOYSA-N	434.424	1.447	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)NCc3ccccc3)cc2)cc1	764177921	UZWXVXABZAXJRO-UHFFFAOYSA-N	441.447	1.888	50	20	IDGD	
CC(C)(C)CC(=O)NNC(=O)C(=O)Nc1cc(Br)ccc1N1CCOCC1	764200026	WUNFLMCUUBIDGJ-UHFFFAOYSA-N	441.326	1.808	50	20	IDGD	
Cc1nc(N2CCOCC2)ccc1NC(=O)C(=O)NNC(=O)c1cccc2ncccc12	764257301	BQOILMZICVAMLB-UHFFFAOYSA-N	434.456	1.175	50	20	IDGD	
CC(=O)N(Cc1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2O)cc1)C(C)C	764279235	ZOVSATPRSWWQPA-UHFFFAOYSA-N	442.472	1.314	50	20	IDGD	
CCN1CCC(n2nccc2NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)CC1	764349092	HKNHBCLEULRQIT-UHFFFAOYSA-N	434.884	1.299	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccccc3-n3ccnn3)n[nH]2)cc1	764384971	PFYJODZGCQXZKD-UHFFFAOYSA-N	444.455	1.620	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1cccc(N2CCOC2=O)c1	764392654	JXXCGTVTBFTOSL-UHFFFAOYSA-N	444.469	1.530	50	20	IDGD	
CCOC(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)c1	764393659	KUAAIMAYNSVUNP-UHFFFAOYSA-N	431.470	1.376	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)ncn2-c1ccccc1	764397067	FKFBMRGBTNPABE-CQSZACIVSA-N	425.445	1.163	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)NCCCCN1C(=O)c2ccccc2C1=O	764409839	WPRXJAAUMNMZSF-UHFFFAOYSA-N	442.497	1.891	50	20	IDGD	
COc1ccc(C)cc1C=NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1	764819610	SDAQUXJOZAJAIZ-UHFFFAOYSA-N	444.557	1.769	50	20	IDGD	
O=C(CCOc1ccc(F)cc1)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765731973	DNFJPZGVUJXTCJ-UHFFFAOYSA-N	428.464	1.200	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)COc3cc(C)ccc3F)CC2)cc1	765749517	XXSKUTXVJUVTCA-UHFFFAOYSA-N	428.508	1.787	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@@H]3Cc4ccccc4C(=O)O3)CC2)cc1	765749710	QYHCHSGYUUMDRB-NRFANRHFSA-N	436.512	1.042	50	20	IDGD	
Cc1cc(N(C)C)cc(C)c1NC(=O)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	766260218	PKJBVZIJLOTZMC-UHFFFAOYSA-N	439.520	1.162	50	20	IDGD	
CC(C)C[C@H](NC(=O)OCc1ccccc1)C(=O)NNc1nc(O)c2cnn(C)c2n1	767476334	UPXHTNPAFCYCDT-HNNXBMFYSA-N	427.465	1.853	50	20	IDGD	
CC(C)Oc1cccc(-c2nnc(SCC(=O)NNC(=O)c3ccccc3)n2N)c1	768452467	XGDOZSJBGXJRKH-UHFFFAOYSA-N	426.502	1.999	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NCC(=O)NNc2nc3ccccc3[nH]2)c1	768504656	MOHASRHHXMHCNE-UHFFFAOYSA-N	444.517	1.467	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)CCC(=O)c1ccc(Cl)cn1	768966210	MRPSPDZCDCQNRV-UHFFFAOYSA-N	437.909	1.761	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1c(C)cnn1Cc1ccccc1F	769268320	YHBJIAVGOJMBGF-UHFFFAOYSA-N	439.447	1.716	50	20	IDGD	
CS(=O)(=O)c1ccc(C(=O)NNC(=O)CCc2ccccc2O)cc1Br	769741494	DARMKSGMWDXGGU-UHFFFAOYSA-N	441.303	1.952	50	20	IDGD	
CSCCNC(=S)NNC(=O)[C@@H]1CCCN(C(=O)N2CCc3sccc3C2)C1	769768195	GWVZNNRAOWLUTE-CQSZACIVSA-N	441.648	1.797	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)[C@@H]2CCN(C(=O)OCc3ccccc3)C2)nc2ccccc21	770111976	XEPJWONHCKZYLE-QGZVFWFLSA-N	435.484	1.922	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)NC[C@@H](c3ccccc3Cl)N3CCOCC3)nc21	770343482	ZBCDCXZPEYHEHF-HNNXBMFYSA-N	446.899	1.422	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNc2ccc(Br)c(F)c2)cccc1-n1cnnn1	770815451	HJIBUFKHQXISMH-UHFFFAOYSA-N	434.229	1.954	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)nn1C	771931749	UBSNTKZYQBKOGB-UHFFFAOYSA-N	435.487	1.366	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)CCC(=O)N1CCN(c2ccccc2)CC1	772194019	YGOWARHDCFTOSN-QGZVFWFLSA-N	432.521	1.241	50	20	IDGD	
O=C(NCCNS(=O)(=O)c1cccnc1)NNC(=O)c1c(Cl)cccc1Cl	773004461	IZVFOQXOPGXVNX-UHFFFAOYSA-N	432.289	1.311	50	20	IDGD	
CNS(=O)(=O)c1cccc(NC(=O)C(=O)NNc2ccc(C(F)(F)F)cn2)c1C	773667883	ULJNAFREFGOSCY-UHFFFAOYSA-N	431.396	1.399	50	20	IDGD	
O=C(NNC(=O)c1ccc(-c2cncnc2)cc1F)c1csc(N2CCOCC2)n1	773779461	DEXJAEVNPIRRGX-UHFFFAOYSA-N	428.449	1.651	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)c2cnc3sc(C)c(C)n3c2=O)n[nH]1	775797716	AFNHIOIIAGMVDP-UHFFFAOYSA-N	438.469	1.846	50	20	IDGD	
COc1cc([C@@H](NC(=O)NNC(=O)c2cnccn2)C(F)(F)F)cc(OC)c1OC	776001589	QIPOZOZOTYIJET-CQSZACIVSA-N	429.355	1.750	50	20	IDGD	
CCOc1ccc(C(=O)NNS(=O)(=O)c2cc(F)c(OC)c([N+](=O)[O-])c2)cc1OC	777597649	WAYFLPITIQRLJB-UHFFFAOYSA-N	443.409	1.773	50	20	IDGD	
COC[C@@H](C)n1c(C)cc(/C=C(/C#N)C(=O)NNC(=O)CNC(=O)OC(C)(C)C)c1C	778437214	ZETLZQUXTPWBIB-KDVQLTRESA-N	433.509	1.891	50	20	IDGD	
O=C(CCCc1ccccc1)NNS(=O)(=O)c1ccccc1S(=O)(=O)NC1CC1	780387381	MXRGPYYXACXDJI-UHFFFAOYSA-N	437.543	1.460	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)c2sccc2S(=O)(=O)Nc2cnn(C)c2)c1	780791423	KAVUCLGIBZLZFG-UHFFFAOYSA-N	435.487	1.826	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)NCc2cccc(S(=O)(=O)N(C)C)c2)cc1	782536914	KNBSGRJTVBDRAY-UHFFFAOYSA-N	434.522	1.539	50	20	IDGD	
Cc1cc(C)cc(NNC(=O)C(=O)Nc2ccccc2OCC(=O)N2CCOCC2)c1	783362305	QBMWDPUWKWFYMO-UHFFFAOYSA-N	426.473	1.623	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2cc(C)ccc2C)cc1S(=O)(=O)NC1CC1	783369103	KLPZUOPSDVHDQL-UHFFFAOYSA-N	432.502	1.835	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2cccnc2-c2ccc(Cl)s2)CCS(=O)(=O)C1	783428637	XVFQMSFJQJCAKE-MRXNPFEDSA-N	428.923	1.600	50	20	IDGD	
CCOc1cc2c(cc1NC(=O)C(=O)NNc1cccc(S(C)(=O)=O)c1)O[C@@H](C)C2	784843553	ANQZSNXQQULWSB-LBPRGKRZSA-N	433.486	1.894	50	20	IDGD	
COCCn1ccc2ccc(NC(=O)C(=O)NNc3cccc(S(C)(=O)=O)c3)cc21	784844822	PTQVSSKWCSDOGD-UHFFFAOYSA-N	430.486	1.773	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2ccc3c(c2)CCCN3C(C)=O)n1	785226266	SJTIWCTYMAFTTM-UHFFFAOYSA-N	425.493	1.704	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1ccc(S(=O)(=O)Nc2ccccc2OC)cc1	785456418	ORURIHIHVQOVGY-CYBMUJFWSA-N	449.485	1.599	50	20	IDGD	
COc1cc(NNC(=O)NC2CCN(S(=O)(=O)C3CCOCC3)CC2)ccc1Cl	789032500	WXXNSXFDFSJKSJ-UHFFFAOYSA-N	446.957	1.948	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)Nc1ccc(N2CCCCC2)c2ncccc12	791946463	NYABLCINBMBBRV-CQSZACIVSA-N	431.518	1.813	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)[C@](C)(O)Cn2cc(C(F)(F)F)ccc2=O)cc1	792022404	NPWRHPNZRDPMAV-GOSISDBHSA-N	443.447	1.866	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(CCC(=O)NNc2ccccc2S(C)(=O)=O)CC1	792236971	DKCURANKTGZGPU-UHFFFAOYSA-N	426.539	1.476	50	20	IDGD	
COc1ccc(S(=O)(=O)NC(C)(C)C)cc1NC(=O)NNc1nc2ccccn2n1	792312752	JEOFGJGUKCPLAQ-UHFFFAOYSA-N	433.494	1.963	50	20	IDGD	
CC(=O)NC[C@@H]1CCn2ncc(C(=O)NNC(=O)COc3cc(C)ccc3C(C)C)c2C1	792732636	LDFIISDNOVCIKD-QGZVFWFLSA-N	441.532	1.853	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@H]2C[C@@]2(C=NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)C1	792928569	QNVZDQNVSRBTJF-KPZWWZAWSA-N	442.925	1.960	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)[C@@H]1[C@H]2[C@H]3C[C@@H]4[C@H]5[C@@H](C[C@H]42)[C@@H]1[C@@H]53	793591957	NYGXRDJTPGVMEZ-LKJFCDDOSA-N	429.542	1.545	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C2CCN(c3ccc4nnc(C(F)(F)F)n4n3)CC2)n1	794090612	XVYFSSURPRKQGE-UHFFFAOYSA-N	448.409	1.524	50	20	IDGD	
CC[C@H](C)n1nc(NC(=O)C(=O)NNC(=O)CNC(=O)OCc2ccccc2)cc1C	797369377	UFHXHXMQZRUASI-ZDUSSCGKSA-N	430.465	1.175	50	20	IDGD	
O=C(NCC(F)(F)F)NNC(=O)c1ccc2ncc(I)n2c1	798314688	WYOXETLFAUGGKI-UHFFFAOYSA-N	427.124	1.445	50	20	IDGD	
CSC[C@H](C)C(=O)N1CCC(C(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)CC1	799627358	WUFPENOGEOEFQS-LBPRGKRZSA-N	449.581	1.968	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)NCCS(=O)(=O)CCc1ccccc1	799921136	NIMVGCARBBGNKR-UHFFFAOYSA-N	428.514	1.629	50	20	IDGD	
CC1(C)CN(Cc2ccccc2)CC[C@H]1NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	800983858	WTBGIKYXGIRSNX-HXUWFJFHSA-N	448.531	1.907	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CO[C@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1	801111144	MFDTWAZYARYOLT-INIZCTEOSA-N	434.493	1.497	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)C2CCN(S(=O)(=O)c3cccnc3)CC2)cc1	802058493	HOKHLUXKKXNZDL-UHFFFAOYSA-N	433.490	1.344	50	20	IDGD	
COc1ccc(C2(C(=O)NNC(=O)Nc3ccc(S(C)(=O)=O)cc3)CCOCC2)cc1	802064695	XSCUUOFFHHNZPW-UHFFFAOYSA-N	447.513	2.000	50	20	IDGD	
O=C(Cn1cc(C(=O)NNC(=O)Nc2ccc3c(c2)OCO3)cn1)NC1CCCCC1	802100468	PSXDABMQYMFCAK-UHFFFAOYSA-N	428.449	1.527	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CCN2C[C@H](C)O[C@@H](C)C2)cc(Br)c1OC	806339495	GKUFOJBRABXRBF-RYUDHWBXSA-N	444.326	1.727	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1cc(Cl)cc2c1OCC(=O)N2	806973298	JNVMRORMWTXJCL-UHFFFAOYSA-N	442.819	1.027	50	20	IDGD	
COCc1cnc(NC(=O)C(=O)NNC(=O)COc2cccc(C(F)(F)F)c2)s1	806973793	WNAKQTUBXOYNKO-UHFFFAOYSA-N	432.380	1.473	50	20	IDGD	
CC[C@H]1[C@H](C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)CCN1C(=O)OC(C)(C)C	809932947	KRMDGPOQVNMROV-CVEARBPZSA-N	443.504	1.730	50	20	IDGD	
COC(=O)c1c(F)ccc(NC(=O)C(=O)NNC(=O)CCCc2cccs2)c1F	810387117	GWRYUKDQCXTXNW-UHFFFAOYSA-N	425.413	1.922	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)NCC(=O)NNc2cc(Cl)nc(C)n2)cc1	810438501	WEUWJFLQGMGHRZ-UHFFFAOYSA-N	427.870	1.037	50	20	IDGD	
COC(=O)Nc1cccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)c1C	813033154	HKAMAYJCVYDOBN-UHFFFAOYSA-N	449.489	1.505	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)cc1)[C@H]1C[C@@H]1C	815565938	FINJGSSHDWENKK-DJJJIMSYSA-N	442.447	1.752	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1c(Cl)cncc1Cl	815827150	NXRISDWDZILMST-UHFFFAOYSA-N	436.299	1.607	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1cccc([N+](=O)[O-])c1Cl	816827915	KFAQFKSQBRBRMX-UHFFFAOYSA-N	425.854	1.925	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCCCC(=O)OCC(=O)NNC(=O)c2ccccc2)cc1C	825198657	SVGWSLANBMHMOM-UHFFFAOYSA-N	447.513	1.366	50	20	IDGD	
Cc1cccn2cc(COc3ccccc3C(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)nc12	841751067	WCLRDCJMVBNSQG-HNNXBMFYSA-N	442.497	1.417	50	20	IDGD	
C[C@@H]1CC(C)(C)C[C@@]2(C1)NC(=O)N(CC(=O)NNC(=O)[C@H]1COc3ccccc3O1)C2=O	859428145	BUPOMHVJDZLSPD-GGRMYQCBSA-N	444.488	1.111	50	20	IDGD	
O=C(COC(=O)C1(c2ccc(F)cc2)CCC1)NNC(=O)[C@@H]1COc2ccccc2O1	875612894	CTRHQTZKQVVPAL-SFHVURJKSA-N	428.416	1.778	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)C2CCN(C(=O)/C=C/c3ccccc3)CC2)C[C@@H](C)O1	912921731	UQXLQCOJCDDLCD-DVMSICGOSA-N	442.560	1.585	50	20	IDGD	
O=C(CSC(F)(F)F)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	915063291	ZOSLBNSDJRIIBY-UHFFFAOYSA-N	425.454	1.875	50	20	IDGD	
O=C(COC(=O)c1ccn(-c2ccc(F)cc2)n1)NNC(=O)c1ccc([N+](=O)[O-])cc1	915413552	YGYDNPRKPDJROS-UHFFFAOYSA-N	427.348	1.538	50	20	IDGD	
C[C@H]1[C@H](C)CCC[C@H]1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	915890580	WUPAHFFWSCGKDK-RVKKMQEKSA-N	438.550	1.476	50	20	IDGD	
CC(=O)N1CCC(NC(=O)NNC(=O)COc2ccc(OCc3ccccc3)cc2)CC1	915931717	PTBZSYJORMJYLD-UHFFFAOYSA-N	440.500	1.986	50	20	IDGD	
CNS(=O)(=O)c1ccc(CNC(=O)NNC(=O)CCSc2ccc(F)cc2)s1	916233096	PIBOACWSFDMJFW-UHFFFAOYSA-N	446.551	1.808	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)NC2CCN(C(=O)c3ccco3)CC2)cc1OC	916243954	FFSWZLFUOUOJEE-UHFFFAOYSA-N	430.461	1.936	50	20	IDGD	
Cc1c(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)oc2ccc(Br)cc12	919885016	MFXFJVXPUYRRQW-SNVBAGLBSA-N	430.280	1.635	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccc(F)cc2)c1C(F)(F)F)N[C@@H]1CCS(=O)(=O)C1	919889550	OBKBFDBYNIRNRX-SNVBAGLBSA-N	449.386	1.161	50	20	IDGD	
COc1ccc([C@H](CNC(=O)NNC(=O)Cc2ccccc2OC)N2CCOCC2)cc1	919898090	WHSRUJAISJDPJR-FQEVSTJZSA-N	442.516	1.650	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCCNC(=O)c2ccc(Br)cc2)cc1	1251150832	RZQGOBGORMJBPV-UHFFFAOYSA-N	435.278	1.832	50	20	IDGD	
CNS(=O)(=O)c1ccc(Br)c(C(=O)NNC(=O)c2ccccc2OC)c1	1338766224	UOIWNYFHUVSHQX-UHFFFAOYSA-N	442.291	1.441	50	20	IDGD	
O=C(c1cnc2ccccn12)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1777825212	QWCXCUYTRVTDLU-YOEHRIQHSA-N	425.258	1.468	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(O)nc(O)c2)C1	1777852763	SRRGNDLFOOTFQZ-UPRAQXHNSA-N	446.331	1.857	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3nn(C)c4c3CCC4)C2)C1	1777959801	ZDOPYQLAFOYOJR-YJYMSZOUSA-N	439.354	1.383	50	20	IDGD	
CC(=O)O[C@@H](C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CO[Si](C)(C)C)C2)C(C)C	1779208361	QJSIYVZXKIKWCI-YFVAEKQCSA-N	442.629	1.940	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)C(=O)Nc3c(C)cccc3C)C2)C1	1781242429	NTHPFEYGDAZQRY-KKSFZXQISA-N	437.924	1.326	50	20	IDGD	
COc1ccccc1OCC(=O)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781324935	FVENLHHBYQIWQI-FUHWJXTLSA-N	445.285	1.594	50	20	IDGD	
Cc1cccnc1CCC(=O)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781326338	NNFYIVYXGYQWJR-FUHWJXTLSA-N	428.302	1.843	50	20	IDGD	
O=C(/C=N/O[C@@H]1CCCCO1)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781331182	GECXQGMWDUYLNH-AUGFZUQUSA-N	436.278	1.036	50	20	IDGD	
COc1cccc(CC(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](O)CCl)C3)c1C	1782051929	FDHZTIZJULRSCZ-LRXVAGHRSA-N	438.952	1.660	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc3nn[nH]c3c1)C2)C(Cl)Cl	1782221470	VBNNVKQXKXSGDU-RDTXWAMCSA-N	426.304	1.889	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)Cc3ccc([N+](=O)[O-])cc3F)C2)C1	1782973853	LCTKQTNBIADWNM-BEFAXECRSA-N	443.859	1.360	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H]1CCc3nc[nH]c3C1)CCO2	1783355003	GVZQWZIHUIPECZ-BIENJYKASA-N	439.354	1.518	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1CCc3ccoc3C1)CCO2	1783530163	UIBZTHADXUYHII-OHNRDTAOSA-N	425.323	1.998	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3n[nH]c(C4CC4)c3F)CCO2)C1	1783532519	PATHLGHNSOUWPB-DYZYQPBXSA-N	429.290	1.653	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3c4c(nn3C)CCC4)CCO2)C1	1783538043	VMOHBGCIDYAOEJ-XIKOKIGWSA-N	425.327	1.136	50	20	IDGD	
CC[C@H]1CC[C@H](C(=O)N2CC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)CC1	1783606011	VTDBFRSOPCZOQK-PMAPCBKXSA-N	428.338	1.026	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CC[C@@]2(CN(C(=O)[C@@H](F)Br)CCO2)C1	1783854201	JTTMXBGMYIYKRD-LWGWVAHUSA-N	447.301	1.262	50	20	IDGD	
CC(C)Oc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]3C2)c(F)c1	1784091871	BGMZNUGNLXSCDW-IVJVFBROSA-N	442.915	1.806	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]3C2)c(Cl)c1	1784095568	LLKHGRAKVQGEHO-WPUCRFQZSA-N	431.316	1.542	50	20	IDGD	
C[C@@H](CNC(=O)OC(C)(C)C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21	1784098070	VMUJSPYJYVXRSS-YTFOTSKYSA-N	435.924	1.661	50	20	IDGD	
C[C@H](C(=O)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1)C1(O)CCC1	1785829604	MGUBGOUDVVERSD-MRXNPFEDSA-N	436.317	1.665	50	20	IDGD	
C[C@H](Br)C(=O)NC1(c2ccc(NC(=O)CC[C@@H](N)C(N)=O)cc2)CCC1	1788058826	HPLHDFDYGYQUSR-SMDDNHRTSA-N	425.327	1.497	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)c3cncc(O)c3)CCC2)cc1)c1cccc(B(O)O)c1	1788149358	LPSARIRFQHKKAI-UHFFFAOYSA-N	431.257	1.529	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cn4ccsc4n3)[C@H]2C1	1788392781	LLYNQTAVEUZDGS-ABHRYQDASA-N	426.926	1.243	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C=N/O[C@H]3CCCCO3)[C@H]2C1	1788658714	MRUJGYOHWXHDGI-IQHHBFBMSA-N	441.601	1.347	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cn(C(C)(C)C)nn3)[C@H]2C1	1789356666	IUFSIOOQXWUQIS-ABHRYQDASA-N	442.358	1.410	50	20	IDGD	
CCc1[nH]nc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]3C2)c1F	1789922025	BXUNNLTWOSOFBE-FIRSBJHFSA-N	435.269	1.395	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cn4ccccc4n3)C[C@@H]21)[C@H](F)Br	1789922627	JWBHISBLWZBMAF-DUPGQFARSA-N	439.285	1.618	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cn3ccnc3C)C[C@@H]21	1790964424	PXLCBRAHNAYJGC-JONQDZQNSA-N	427.343	1.345	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(N(C)C)nc3)C[C@@H]21	1791058722	CUMHKFKOUPEDGM-OEAJRASXSA-N	439.354	1.524	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](C)Br)[C@H]3C2)nn1C(F)F	1791059108	OBPGPTWZJDOGLD-MNXVOIDGSA-N	449.296	1.963	50	20	IDGD	
COC(=O)c1ccc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)C(Cl)Cl)C[C@@H]32)cc1	1791418909	XCDCSBWNDZMPNY-JYJNAYRXSA-N	443.327	1.799	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCNC(=O)OC(C)(C)C)[C@H]2C1	1792124592	OANHQBOAJMMXAW-VGWMRTNUSA-N	431.961	1.898	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cccc(C(F)(F)F)c1)C2)[C@H](O)CCl	1792983849	QVOOQFSVQQAINR-IARIHHJXSA-N	434.842	1.437	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCl)C1CC1	1793107053	MXQMCQOCJJUZEN-QEOTZNIISA-N	443.972	1.918	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1sc2nccnc2c1N	1795705777	KWZHOXDHMVRKQH-JJLQDPRZSA-N	449.609	1.328	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1ccc2c[nH]nc2c1	1796168272	LCRGVSQCLDJEBY-AYRXBEOTSA-N	425.258	1.457	50	20	IDGD	
CN(CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1CCCO1)NC(=O)NCc1ccccc1	1796340948	SIQJBFHXEGXZJA-IYWMVGAKSA-N	443.548	1.150	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2cccn2cn1	1797097486	YORPNIGAPMZZPI-VWPFQQQWSA-N	435.322	1.569	50	20	IDGD	
COC(=O)[C@@H]1CC[C@@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@](C)(Cl)CCl)C1	1799273262	ATSXTEWATNFJFG-GPPYEEBYSA-N	435.348	1.402	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1Cc3ccccc3O1)C2	1799275934	DNKGTDNVCHFXMT-AENLNBOZSA-N	427.328	1.816	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2)c1ccc(-n2cccn2)cc1	1799598398	OUYVSRZUYDMPNF-HGKCTWBKSA-N	447.333	1.861	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc[nH]n1)C2)[C@@H](Br)Cc1ccccc1	1800435660	LFSFESYHRFJKIX-DFGXFYAUSA-N	447.333	1.619	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cnn3ncccc23)[C@H]1c1cccnc1)[C@H](O)CCl	1803139535	QMFQBQLFJWMTGJ-QGTPRVQTSA-N	428.880	1.044	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H](CNC(=O)CN2CCOCC2)[C@H]1c1cccnc1	1806905411	MPVZUGCHTQELLB-WIYYLYMNSA-N	434.613	1.271	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)nc1	1807369660	RKHQVXLTIGSPJB-SIKLNZKXSA-N	444.300	1.098	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)c3nc4ccccc4[nH]3)CC2)C1	1809977872	KNGUEQVJUPUMHF-UHFFFAOYSA-N	446.316	1.401	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)c1cc2cnccc2[nH]1	1809987759	JCHWWNXFUTVQQZ-JVPBZIDWSA-N	427.892	1.877	50	20	IDGD	
Cc1cccn2ncc(C(=O)NC[C@@H]3CCN(C(=O)[C@@H](O)CCl)[C@H]3c3cccnc3)c12	1812268222	XKKUFHNNJDUEOL-QRFRQXIXSA-N	441.919	1.957	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)CN2CCSCC2)[C@@H]1c1cccnc1)C(Cl)Cl	1813074167	OREJYPOXIKPQLK-GDBMZVCRSA-N	431.389	1.940	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)[C@H]1CCc2nc[nH]c2C1	1813322588	JJUUUSOIBAVHON-JOQQVMPUSA-N	431.924	1.215	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@@H](CNC(=O)CCn2ccnn2)[C@H]1c1cccnc1	1813428360	YPYNUVREWZXMCA-UWWQBHOKSA-N	449.353	1.800	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)/C=C/c2cnccn2)[C@@H]1c1cccnc1	1813486767	LZWWJNKJQAHMKH-WJTBJXONSA-N	429.908	1.845	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)Cc3ccccc3)sc2C1	1813816883	MUTRLNSIFDLYBK-HNNXBMFYSA-N	429.546	1.671	50	20	IDGD	
CC(=O)Nc1ccccc1C(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1	1813883994	UFLSJUPZSHQYGC-DBVUQKKJSA-N	444.919	1.959	50	20	IDGD	
CC(=O)Nc1ccccc1C(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1	1813883998	UFLSJUPZSHQYGC-FFZOFVMBSA-N	444.919	1.959	50	20	IDGD	
Cc1ccc(C(=O)N[C@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)nc1	1815339973	YOVIWNSAHAYUMJ-HNNXBMFYSA-N	436.302	1.066	50	20	IDGD	
C[C@]1(C(=O)N[C@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)CC1(F)F	1815362031	ZGYKWIMQORDDJY-KPZWWZAWSA-N	435.261	1.094	50	20	IDGD	
CN1CCN(CC(=O)Nc2nc3c(s2)C[C@H](NC(=O)CO[Si](C)(C)C)CC3)CC1	1818801108	ZDRBKVXMSGJQFH-CQSZACIVSA-N	439.658	1.154	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](F)Br)n[nH]1	1820932766	PGYKXCRYLGXAHX-MKPLZMMCSA-N	433.282	1.539	50	20	IDGD	
O=C1CC[C@H](C(=O)N2CCCC[C@@H]2c2cc(NC(=O)[C@H](F)Br)n[nH]2)CN1	1820934701	OZOSRMWCYJEETO-PXWWUCIGSA-N	430.278	1.619	50	20	IDGD	
COc1ccc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@H](C)Br)CC3)nn1	1821073134	NDKYXZXYWCRLBI-IUCAKERBSA-N	440.323	1.951	50	20	IDGD	
O=C(O)CSCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](F)Br)[nH]n1	1822428105	YXVMRBPIDGHCGN-ZANVPECISA-N	437.291	1.910	50	20	IDGD	
Cc1oncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1	1826026644	ARCBXAXLEOQPDY-FQEVSTJZSA-N	425.294	1.210	50	20	IDGD	
C[C@H](C(=O)N[C@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1)n1cccc1	1826092123	MWCWXICODIZAON-KGLIPLIRSA-N	432.550	1.491	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)CCS(C)(=O)=O)sc2C1	1827215493	ZWTQLBLXDNDFBY-BDAKNGLRSA-N	438.369	1.273	50	20	IDGD	
C[C@@H]1C[C@]1(C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1	1828924012	IBUAIHAAZFMGQQ-VVWXKSFDSA-N	427.549	1.965	50	20	IDGD	
CC(C)O[C@H](C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1	1829021489	KBBZRQVSYQJEKY-UZLBHIALSA-N	445.564	1.732	50	20	IDGD	
Cc1cnoc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1	1829548770	BANMOFOCFBQOQN-LJQANCHMSA-N	425.294	1.210	50	20	IDGD	
O=C(CCBr)N1CCC([C@@H]2CCCCN2C(=O)c2c[nH]c(=O)cn2)CC1	1829713737	RNYJRLGRHFKVGC-HNNXBMFYSA-N	425.327	1.788	50	20	IDGD	
O=C([C@H](F)Br)N1CCC([C@@H]2CCCCN2C(=O)c2c[nH]c(=O)cn2)CC1	1829717012	WBWOSVUIMISFPL-ZFWWWQNUSA-N	429.290	1.694	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)C3CC(F)(F)C3)CCO2)C1	1829992318	FDPRNZKBMXJAEP-ABAIWWIYSA-N	425.270	1.272	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C=N/O[C@H]3CCCCO3)C2)C1	1830365399	XFRHZFSNXVDICY-ZQUFOJLJSA-N	445.944	1.237	50	20	IDGD	
Cc1nc(C)c(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)o1	1830540838	TZKANPCUUVUTHZ-XIKOKIGWSA-N	444.326	1.392	50	20	IDGD	
C=CCC(CC=C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1830642388	AGCCUJFARHNTBW-YJBOKZPZSA-N	433.318	1.902	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)C[C@H]2CCCCO2)CC1	1831871669	WAOMKGBDJDENHV-WOJBJXKFSA-N	436.597	1.938	50	20	IDGD	
O=C(c1cc(=O)n2[nH]cnc2n1)N1CCC([C@H]2CCCCN2C(=O)C(Cl)Cl)CC1	1831879541	YHRWPOJXVHVHHR-CYBMUJFWSA-N	441.319	1.455	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)CNC(=O)C(F)(F)F)CC1	1831900663	TWGPFBWUBFDTAL-ZIAGYGMSSA-N	441.878	1.538	50	20	IDGD	
CC(=O)N(C)CCC(=O)NC1CCN(C2CCN(C(=O)C(C)(C)CCl)CC2)CC1	1833668631	RQNKRGBKIRDPEA-UHFFFAOYSA-N	429.005	1.691	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3csc(C)n3)CC2)CC1	1834292864	CKUKZWIRJVGOFI-INIZCTEOSA-N	428.986	1.891	50	20	IDGD	
O=C(CCBr)NC1CCN(C2CCN(C(=O)Cn3ccnc3)CC2)CC1	1834421160	MDCPYLVXIJCVCX-UHFFFAOYSA-N	426.359	1.240	50	20	IDGD	
CCc1ncsc1C(=O)N1CCOC[C@@]2(CN(C(=O)CCBr)CCO2)C1	1834823750	IGHWKOLHQBSLCP-QGZVFWFLSA-N	446.367	1.561	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)c1cccc2[nH]ncc12	1834998015	SPOZZIYZQLEDQP-IBGZPJMESA-N	433.940	1.348	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)C3CCOCC3)CCO2)C1	1835193495	GQRDUHIXWRIUFN-MAUKXSAKSA-N	433.343	1.043	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC(OC2CCN(C(=O)Cn3ccccc3=O)CC2)CC1	1837933894	BGNDZQPFLDNPSR-UHFFFAOYSA-N	449.624	1.698	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCC(OC2CCN(C(=O)CCn3ccnn3)CC2)CC1	1838638120	PZPFEGJLHCJCNS-LJQANCHMSA-N	446.379	1.903	50	20	IDGD	
CC(=O)N[C@H](C)C(=O)N1CCC(OC2CCN(C(=O)[C@H](C)Br)CC2)CC1	1838753845	DPPYLGPKYRHTCO-QWHCGFSZSA-N	432.359	1.293	50	20	IDGD	
C[C@](O)(CC(=O)O)CC(=O)N1CCC(OC2CCN(C(=O)C(Cl)Cl)CC2)CC1	1838791249	LGRYJZZPXKYNLP-GOSISDBHSA-N	439.336	1.405	50	20	IDGD	
Cc1ccc(O)c(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)c1	1838894449	TYGQIGPFZFFZLX-KUHUBIRLSA-N	441.322	1.554	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(F)c1F)CCO2	1838998503	DLEVPNRBPWLNHG-FQEVSTJZSA-N	442.535	1.886	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3c(F)ccnc3Cl)C2)C1	1839142020	BTYNEDOBIJQLCS-KPZWWZAWSA-N	434.295	1.962	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc4c3NC(=O)C4)C2)C1	1839148194	QGEXSRALYIQYQI-IIBYNOLFSA-N	435.908	1.269	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CCC[C@@H](C(=O)OC)C3)C2)C1	1839149097	SZHKPUOZWFYVEY-VWXURSGXSA-N	444.956	1.440	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)ccn1	1839201131	WULCHWZBLFWILD-RHSMWYFYSA-N	430.274	1.151	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(Cl)nc3)C2)C1	1840029333	AVUSVDPFSWPHHM-PXAZEXFGSA-N	446.729	1.588	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(F)ccc3C)C2)C1	1840149349	MHSTXZRLCWVNBO-XLIONFOSSA-N	428.888	1.458	50	20	IDGD	
O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)C1CCSCC1)CCO2	1840924117	RNKPOYXZHVHHQJ-QGZVFWFLSA-N	435.384	1.371	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)Cn1ccnc1C)C2	1844693370	WQZSSLMAZACXNN-UHFFFAOYSA-N	441.444	1.542	50	20	IDGD	
COc1ccc(C(=O)N2CC3(CCCN3C(=O)[C@@H](F)Br)C2)c(O)c1OC	1845219538	VJNUAYPIGKROTN-CQSZACIVSA-N	431.258	1.917	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)c1cccc(-c3cnco3)c1)C2	1846385688	JPHZFOIZDKSNJU-UHFFFAOYSA-N	425.489	1.532	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](C)C1(O)CCC1	1847255505	FCQDXRPJBLCOCI-BVGQSLNGSA-N	445.472	1.887	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)cc1OC	16148438	VOWWTCOBQZVIPJ-UHFFFAOYSA-N	426.447	1.353	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)CN1C(=O)N[C@](C)(c2ccc(F)cc2)C1=O	23754162	GAQRYCCBHPRTRF-HXUWFJFHSA-N	448.838	1.716	50	20	IDGD	
O=C(CCCCCNC1=NS(=O)(=O)c2ccccc21)NNC(=O)c1ccccc1F	26971603	VHTKYODJCYGLAX-UHFFFAOYSA-N	432.477	1.886	50	20	IDGD	
CC[C@H](C)N(C)CCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(CC)CC)c1	727227546	BHODNSZABAAPCY-HNNXBMFYSA-N	427.571	1.391	50	20	IDGD	
C#Cc1cccc(NC(=S)NNC(=O)CCNS(=O)(=O)/C=C/c2ccccc2)c1	727501109	HRBNTYGVAKKECZ-WYMLVPIESA-N	428.539	1.966	50	20	IDGD	
C=CCc1ccc(OCC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c(OC)c1	728846006	UDNDYOSHLKREOK-UHFFFAOYSA-N	425.489	1.657	50	20	IDGD	
Cc1ccc(Cn2nc(C)c(CCC(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)c2C)cc1	730164976	DRCWJNYULZZUHD-GOSISDBHSA-N	432.546	1.371	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)NCCCN1CCN(c2cccc(Cl)c2)CC1	730581887	TVHZBUPOSQULTO-UHFFFAOYSA-N	430.940	1.820	50	20	IDGD	
Cc1c(C=NNC(=O)Cc2cc(O)nc(S)n2)c(=O)n2c([nH]c3ccccc32)c1C#N	730586964	RUCLCIDTAURZMS-UHFFFAOYSA-N	433.453	1.438	50	20	IDGD	
Cc1cccc(N2C(=O)N[C@H](CCC(=O)NNC(=O)[C@H]3COc4ccccc4O3)C2=O)c1	730740298	BVUFKHVYAHLMQV-CRAIPNDOSA-N	438.440	1.187	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)COc1ccccc1O)c1cc(F)ccc1N1CCC(O)CC1	730909315	ADBGYFMZCOAHFE-AWEZNQCLSA-N	446.479	1.963	50	20	IDGD	
O=C(CN1CCC([C@H](O)c2ccc(F)cc2)CC1)NNC(=O)c1ccc([N+](=O)[O-])cc1	731035010	OJKNFSUORSHDHE-HXUWFJFHSA-N	430.436	1.941	50	20	IDGD	
CC(C)(C(=O)NNS(=O)(=O)c1ccc(S(=O)(=O)NC2CC2)cc1)c1ccccc1	731177535	GNKGDKGDTWIQRR-UHFFFAOYSA-N	437.543	1.415	50	20	IDGD	
Cn1ccnc1[C@@](O)(CCNC(=O)NNC(=O)C(C)(C)c1ccccc1)C(F)(F)F	731221111	BYBLYDZIIDEMDY-SFHVURJKSA-N	427.427	1.868	50	20	IDGD	
CCCCn1c(CCC(=O)NNC(=O)C2CCC2)nc2cc(S(=O)(=O)N(C)C)ccc21	732143121	SLJBZQFXFQXKDY-UHFFFAOYSA-N	449.577	1.967	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)CC2CCN(C(=O)OC(C)(C)C)CC2)C[C@@H](C)O1	732259262	BNQSMOOKLDWNQN-IYBDPMFKSA-N	426.558	1.670	50	20	IDGD	
CCOc1ccccc1[C@H](CC(=O)NNC(=O)CCN1C[C@H](C)O[C@@H](C)C1)NC(C)=O	732259607	IHEZXHMAGZBYFE-BXWFABGCSA-N	434.537	1.299	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN1S(=O)(=O)c1cccc([N+](=O)[O-])c1)NC1CCCCC1	732950032	PPBAGNIZBHKBOZ-INIZCTEOSA-N	439.494	1.411	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)NCCNC(=O)c2c(F)cccc2F)nc2ccccc21	733043260	SYJZICATCIIGEC-UHFFFAOYSA-N	430.415	1.154	50	20	IDGD	
NC(=O)c1ccc(SCC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c([N+](=O)[O-])c1	733109731	BYCCHVAUANCACP-UHFFFAOYSA-N	440.441	1.433	50	20	IDGD	
Cc1nc(-c2ncccn2)nc(O)c1CC(=O)NNC(=O)c1cnn(-c2ccccc2)c1	733170002	NGPWKKIPSZLJQN-UHFFFAOYSA-N	430.428	1.137	50	20	IDGD	
CNc1ccc(C(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)cc1[N+](=O)[O-]	734824505	ASXVRTASZFDUPR-UHFFFAOYSA-N	436.469	1.980	50	20	IDGD	
CCO[C@H](C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1)c1ccccc1	735117111	BMBOXJHTLLLYAN-SFHVURJKSA-N	433.534	1.239	50	20	IDGD	
COc1ccc(C(=O)NNc2cc(C)nc(C)n2)cc1S(=O)(=O)NCc1ccccn1	736716918	PDXOEOGIGMXXPT-UHFFFAOYSA-N	442.501	1.732	50	20	IDGD	
C[C@H]1CCC[C@@H](NC(=O)CN2CCN(C(=O)NNC(=O)COCc3ccccc3)CC2)C1	738497448	VUXMJQBRPYORBN-AZUAARDMSA-N	445.564	1.257	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)N[C@@H]2CCN(c3ccc(Cl)cc3)C2=O)nc2ccccc21	740483956	FSLHLZBNEJAKMQ-MRXNPFEDSA-N	440.891	1.905	50	20	IDGD	
CC(=O)N[C@@H](Cc1c[nH]c2ccc(Br)cc12)C(=O)NNC(=O)c1cccn1C	742036047	BKWYWNPGWJJNKW-INIZCTEOSA-N	446.305	1.777	50	20	IDGD	
COc1ccc([C@H](Cc2ccccc2C)NC(=O)NNC(=O)C(=O)NC2CC2)cc1OC	743341994	YEWXGRDOTWDKOW-SFHVURJKSA-N	440.500	1.905	50	20	IDGD	
NC(=O)CS(=O)(=O)c1ccc(C(=O)Oc2ccc([N+](=O)[O-])cc2Br)cc1	744169521	XOBJOOSVMKRHSY-UHFFFAOYSA-N	443.231	1.836	50	20	IDGD	
CC(=O)N[C@H](CC(=O)OCC(=O)NNC(=O)c1cccc(C#N)c1)c1ccc(Cl)cc1	744511933	HNBWDIPMCQQSTI-GOSISDBHSA-N	442.859	1.783	50	20	IDGD	
CC(=O)Nc1ccc(F)c(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)c1	744621578	UIPJQDZCSDCEEU-UHFFFAOYSA-N	436.465	1.562	50	20	IDGD	
Cc1ccnn1-c1ccc(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)cc1	744622505	WBBYUVPGIMDLJL-UHFFFAOYSA-N	441.513	1.959	50	20	IDGD	
Cc1ccc(F)c(NC(=S)NNC(=O)CN2C(=O)N[C@@]3(CCc4ccccc43)C2=O)c1	745195376	CXBXDGVCFFOSGJ-OAQYLSRUSA-N	441.488	1.845	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)N[C@@H](C)CN2CCN(c3ccccc3)CC2)cc1	745838892	NISKOBCBPBASLB-SFHVURJKSA-N	441.532	1.615	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H]2CCN(C)[C@@H](C)C2)c1	745855746	YIEHYBMVWUFNEQ-HOCLYGCPSA-N	425.555	1.144	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)N[C@H]1CCN(c2ccc(C)cc2)C1=O	745855977	BWMPDTILKVMEQN-KRWDZBQOSA-N	426.473	1.908	50	20	IDGD	
COc1ccc(C(=O)NCCN2CCN(C(=O)c3c(C)nn(CCCl)c3C)CC2)cc1	746239050	AUBXTFSPGMHNPY-UHFFFAOYSA-N	447.967	1.935	50	20	IDGD	
N#Cc1ccc(NNC(=O)[C@H]2CC(=O)N([C@@H]3CCS(=O)(=O)C3)C2)cc1C(F)(F)F	746894712	ODBXZAZDWZMCMR-WCQYABFASA-N	430.408	1.056	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)NC1CCN(Cc2coc(-c3ccccc3)n2)CC1	748627960	NGMKKROAUBSYCL-MRXNPFEDSA-N	445.520	1.688	50	20	IDGD	
O=C(CN1C(=O)c2ccccc2S1(=O)=O)NNc1ccc(OCC(F)(F)F)cc1	748704707	NXTSANUEWGYUPO-UHFFFAOYSA-N	429.376	1.916	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)NC1CCN(C2CCCC2)CC1	748982702	KEMNZFIJXIQXDA-UHFFFAOYSA-N	442.608	1.936	50	20	IDGD	
O=C(CCS(=O)(=O)c1ccc2c(c1)OCCO2)NNC(=O)c1cc2ccccc2o1	749475049	VNMDRKNNMLBNHY-UHFFFAOYSA-N	430.438	1.829	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)[C@@H]1CCCN1C(=O)c1ccc2c(c1)OCO2	749715650	XRZSCEINNVGRQQ-HNNXBMFYSA-N	441.440	1.255	50	20	IDGD	
C[C@@]1(NNC(=O)NCc2cc(Br)ccc2OC(F)F)CCS(=O)(=O)C1	750335391	NVQGRXTYIOJYBF-CQSZACIVSA-N	442.282	1.932	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1Br)C(=O)NNC(=O)CNC(=O)c1ccco1	751201291	GVISVTSGICZVLT-VIFPVBQESA-N	428.214	1.526	50	20	IDGD	
CN(C)C(=O)CS(=O)(=O)c1ccc(C(=O)NNc2ccc(-c3ccccc3)nn2)cc1	754471115	SMKUXEONHQNCMT-UHFFFAOYSA-N	439.497	1.762	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1ncc(Cc2ccccc2Cl)s1	755475584	SYDATKWQNVFDDP-VIFPVBQESA-N	431.927	1.478	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2ccc(-n3nccn3)nc2)cc1Br	755948040	UDMTVVZOVCMUIJ-UHFFFAOYSA-N	432.238	1.900	50	20	IDGD	
Cc1sc(Br)cc1S(=O)(=O)NNC(=O)[C@H]1COc2ccccc2O1	755960394	YKQJKOJUHDKEON-LLVKDONJSA-N	433.305	1.969	50	20	IDGD	
O=C(CN(CC(=O)NNc1ccnc(F)c1)Cc1ccccc1)NNc1ccnc(F)c1	756184206	USHCIZVTFSRAPL-UHFFFAOYSA-N	441.442	1.843	50	20	IDGD	
CCN(CC(=O)NC)C(=O)/C(C#N)=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	756994400	PUUYXIPDHCSIDR-XNTDXEJSSA-N	442.907	1.580	50	20	IDGD	
Cn1cnn(-c2ccc(NC(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)cc2)c1=O	757864245	XDBLZVMZUKNUIN-UHFFFAOYSA-N	433.469	1.029	50	20	IDGD	
O=C(NNC(=O)c1cccc(CN2C(=O)c3ccccc3C2=O)c1)C(=O)Nc1ccccn1	758820348	GMSUESCXBNQFFE-UHFFFAOYSA-N	443.419	1.278	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)[C@@H]2CCCN2C(=O)NC(C)C)c2ccccc2c1=O	760281739	YQEQRKLBTJHQHA-INIZCTEOSA-N	428.493	1.150	50	20	IDGD	
CC1(Cn2cc(C(=O)NNc3cc(C(F)(F)F)nc(-c4ccccn4)n3)nn2)COC1	760285323	YHRLBXYIPCOMQV-UHFFFAOYSA-N	434.382	1.942	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)Cc2cccc(OCC#N)c2)CC1	760386335	QIEFXQIHTDHWTD-UHFFFAOYSA-N	431.493	1.861	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)CCNC(=O)[C@@H]1CCCN1C(=O)OC(C)(C)C	760812306	BAWBSDZKNGSNQC-HNNXBMFYSA-N	434.493	1.362	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)/C=C\c1ccccc1)C(=O)NNc1ncc(F)cn1	760921242	UBDYFZGVFTYERT-WKTRQSJXSA-N	425.511	1.771	50	20	IDGD	
CNC(=O)c1cc(Oc2ccccc2NC(=O)C(=O)NNC(=O)c2ccccn2)ccn1	763463442	JBCIUBTYAZBIGL-UHFFFAOYSA-N	434.412	1.028	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)C(=O)Nc1ccnn1-c1ccc(Cl)cc1	763547571	FBHCIZTYQCOAIY-UHFFFAOYSA-N	427.804	1.654	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1C(=O)NC(C)C	763578867	RBRWPVGTKNNCNA-GOSISDBHSA-N	440.456	1.059	50	20	IDGD	
C[C@H]1COCCN1c1ccc(NC(=O)C(=O)NNC(=O)c2cccc(N(C)C)c2)cc1	763754533	UTXIFCKMYLADBH-HNNXBMFYSA-N	425.489	1.377	50	20	IDGD	
Cc1ccc(C(F)(F)F)cc1NC(=O)C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	763917550	XBEZPBKJHWAUDO-UHFFFAOYSA-N	433.350	1.389	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)C(=O)Nc1cccc(S(=O)(=O)N2CCCC2)c1	763951174	RILDKGDGYBYRPK-UHFFFAOYSA-N	430.486	1.179	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3cc(-c4ccccc4)on3)cc2)CCO1	764017467	YLRNVDBWFKSTOD-HNNXBMFYSA-N	449.467	1.966	50	20	IDGD	
COC(=O)c1cc(OC)ccc1NC(=O)C(=O)NNC(=O)Cc1cccc2ccccc12	764028781	PAMAYTYZGLAZJK-UHFFFAOYSA-N	435.436	1.964	50	20	IDGD	
CC[C@@H](C)C(=O)NNC(=O)C(=O)Nc1ccnn1Cc1ccc(OC)c(OC)c1OC	764081895	LRJZWGPSGHPEJH-GFCCVEGCSA-N	433.465	1.089	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccc(N2CCSCC2)c(C)c1	764137009	YFQWZXKSTLKNPS-UHFFFAOYSA-N	442.541	1.885	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccccc2-n2cncn2)o1	764139492	UZTZHGKXHRHJOM-UHFFFAOYSA-N	425.449	1.102	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2O1)C(=O)Nc1cc(F)ccc1N1CCCCC1	764162800	GHWRHMZRBZXERH-IBGZPJMESA-N	426.448	1.906	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CCc2ccccc2)cc1S(=O)(=O)NC1CC1	764192168	KROLGCSFGPCUEJ-UHFFFAOYSA-N	444.513	1.154	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)C(=O)Nc1ccc(-c2csnn2)cc1	764203792	DZJKAHWBMJCSEE-UHFFFAOYSA-N	448.505	1.596	50	20	IDGD	
C[C@H](c1cc(Cl)ccc1Cl)n1nccc1NC(=O)C(=O)NNC(=O)CN(C)C	764204235	PHSWVELCEGUSDD-SNVBAGLBSA-N	427.292	1.447	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1cc(F)ccc1OC[C@H]1CCCO1	764274680	AUGJQSBUVBRPMR-CQSZACIVSA-N	447.419	1.254	50	20	IDGD	
C[C@@H]1CN(c2ccccc2NC(=O)C(=O)NNC(=O)COc2ccccc2O)C[C@@H](C)O1	764278122	RNAPBVJILLJPJH-HUUCEWRRSA-N	442.472	1.171	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(OC)c(OC)c2OC)c(OC)c1	764289877	ZDROMZAODGSGEE-UHFFFAOYSA-N	433.417	1.129	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)C(=O)Nc1ccc(OCC(F)(F)C(F)F)nc1	764319151	KNLGXFOAKYBPLL-UHFFFAOYSA-N	446.332	1.829	50	20	IDGD	
C[C@H]1CCCCN1CC(=O)Nc1ccc(F)c(NC(=O)C(=O)NNC(=O)C2CCC2)c1	764341082	DKOOFCOZKBOWJU-ZDUSSCGKSA-N	433.484	1.525	50	20	IDGD	
CCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)c(C)c1	764371086	WWAVXCNCKIBVLB-UHFFFAOYSA-N	434.399	1.502	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1cncc(Br)c1	765738872	PPFWZIZERNCWGM-UHFFFAOYSA-N	446.305	1.063	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@@H]12	768636869	YZSRCDCCQPPSHP-DETPVDSQSA-N	442.563	1.268	50	20	IDGD	
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC[C@@H](C(=O)NNc2cc(C#N)cc(Cl)n2)C1	768695844	RMDPXASIEVLLIM-CYBMUJFWSA-N	437.913	1.491	50	20	IDGD	
COc1cccc([C@H](CNC(=O)NNc2nc(O)c3cnn(C)c3n2)N2CCCC2)c1	770343617	NBBNVEYNEDKGHZ-INIZCTEOSA-N	426.481	1.541	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)COc3ccc(N4CCCC4=O)cc3)nc21	770967168	ZGBAFUUWCCUETG-UHFFFAOYSA-N	439.476	1.936	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)CN2C(=O)N[C@](C)(c3ccc(F)c(Cl)c3)C2=O)nc1	771437162	MZJLIGXJEFIBPD-LJQANCHMSA-N	449.826	1.571	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	771880667	ADZGCUSZXMAZSZ-OAHLLOKOSA-N	439.534	1.600	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1cccc(S(=O)(=O)N[C@@H](C)c2ccccc2)c1	771936824	BRKDWAJWLUVFKN-LSDHHAIUSA-N	447.513	1.829	50	20	IDGD	
O=C(CCc1nc(O)c2ccccc2n1)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772888880	NMILIDUWTUWQES-UHFFFAOYSA-N	427.848	1.385	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(Br)cn2)cc1	773531521	ZLOWQBNTBOBSFI-LLVKDONJSA-N	449.261	1.600	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2ccc(I)cc2C)n1	773730812	MMNRWNDUPBZLOI-UHFFFAOYSA-N	427.202	1.480	50	20	IDGD	
NC(=O)CC[C@H](C(=O)NNc1ccc(C(F)(F)F)cn1)N1C(=O)c2ccccc2C1=O	775261616	MGEZJVXXTLZZMY-CYBMUJFWSA-N	435.362	1.474	50	20	IDGD	
CC(C)C[C@H](C(=O)NNc1cccc(S(C)(=O)=O)c1)N1C(=O)[C@@H]2CC=CC[C@H]2C1=O	776540885	DCNSOYSCAGQEBQ-KZNAEPCWSA-N	433.530	1.899	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)NCc2nnc3ccc(C(F)(F)F)cn23)c1	776611176	TYHUHBACGUSSMX-UHFFFAOYSA-N	428.396	1.978	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)CCC(=O)c2cc(OC)c(OC)c(OC)c2)c1O	776972012	JERPSAASFPMNMF-UHFFFAOYSA-N	432.429	1.851	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)CN2C(=O)NC3(CCC(CC)CC3)C2=O)nc1C	778425799	XMJRDBKIIPHSMI-UHFFFAOYSA-N	432.481	1.296	50	20	IDGD	
COC[C@@H](C)n1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc3ccccc3c2)n1	778707188	HVTSULUCTCTNFM-CABCVRRESA-N	439.472	1.797	50	20	IDGD	
C=CC[C@H](C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1)c1ccccc1	779380615	XESBPDTUAVCYDV-SFHVURJKSA-N	429.546	1.821	50	20	IDGD	
COc1ccc(NNC(=O)[C@@H](CCSC)NS(=O)(=O)c2ccccc2F)nc1	781516961	ZNMKVVYJJOSGGP-CQSZACIVSA-N	428.511	1.773	50	20	IDGD	
NC(=O)c1cccc(C(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)n1	781930691	RTRYLVMSXNBTSE-UHFFFAOYSA-N	442.435	1.014	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)ccc1Br	782894175	OMRGQBGDAGMVHM-UHFFFAOYSA-N	444.289	1.973	50	20	IDGD	
COC(=O)[C@H]1CN(C(=O)C(=O)NNc2ccc(Br)cc2)c2ccccc2O1	783006131	OCSVGFWUPZZFRC-OAHLLOKOSA-N	434.246	1.859	50	20	IDGD	
Cc1cc(C)cc(NNC(=O)C(=O)Nc2cnn(CC(=O)N3C[C@H](C)O[C@@H](C)C3)c2)c1	783356438	IYSNVULHMAHGTK-HOTGVXAUSA-N	428.493	1.218	50	20	IDGD	
CCNS(=O)(=O)c1ccc2c(c1)N(C(=O)C(=O)NNC(=O)Nc1ccccc1C)CC2	783416862	DSULRJBPZQESMS-UHFFFAOYSA-N	445.501	1.035	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCOCC2)cc1NC(=O)C(=O)NN(C)c1ccccc1	783434432	MUOXYVJICFEGEY-UHFFFAOYSA-N	432.502	1.122	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)C(=O)Nc1ccccc1-c1c(F)cccc1F	784004721	QJCMGSXAIYBLFK-UHFFFAOYSA-N	442.378	1.741	50	20	IDGD	
COC(=O)c1cc(N2CCOCC2)ccc1NC(=O)C(=O)NNc1cccc([N+](=O)[O-])c1	784831738	PXKKQKIHKSXCSM-UHFFFAOYSA-N	443.416	1.300	50	20	IDGD	
O=C(CN1CCOCC1)Nc1ccc(NC(=O)C(=O)NNc2cc(Cl)ccn2)cc1	784856657	QNSPOWBCTFHKBT-UHFFFAOYSA-N	432.868	1.088	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)cc1OCC	785024075	RZWAKGRLVVZALM-UHFFFAOYSA-N	432.389	1.498	50	20	IDGD	
COc1ccc(NC(=O)NNc2cc(Cl)nc(N)n2)cc1S(=O)(=O)N1CCCC1	786128237	VWKYPYAUTOYYPA-UHFFFAOYSA-N	441.901	1.654	50	20	IDGD	
CC[C@H](Oc1ccccc1F)C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	786535415	QUICPIQXENCJHD-KSSFIOAISA-N	432.404	1.514	50	20	IDGD	
CSCC[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)NNC(=O)NCc1ccccc1	787372410	JCVFQPGXRFFLTP-KRWDZBQOSA-N	445.501	1.977	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)ccc1C(=O)N(C)C	789811133	VGKIRKMHLCWMPI-OALUTQOASA-N	438.484	1.355	50	20	IDGD	
CC(C)(C)OC(=O)Nc1ccccc1CCC(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1	790545811	GAYPIVWWTLUDCP-AWEZNQCLSA-N	440.522	1.484	50	20	IDGD	
Cc1cccc(=O)n1C[C@](C)(O)C(=O)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1	792266468	BEGYLMJMGCWYQR-INIZCTEOSA-N	433.408	1.345	50	20	IDGD	
Cc1ccc(C(=O)NNS(=O)(=O)c2ccc(C(=O)O)cc2OC(F)(F)F)c(O)c1	792698261	MIIUMXPFIKWEHN-UHFFFAOYSA-N	434.348	1.921	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)C(=O)Nc2cc(Cl)cc(C(=O)N(C)C)c2OC)c1	793018633	VKOXRXIKKNPJBT-UHFFFAOYSA-N	448.863	1.919	50	20	IDGD	
COc1c(NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)cc(Cl)cc1C(N)=O	793026612	SKIGWCVTIFFCJO-UHFFFAOYSA-N	441.227	1.206	50	20	IDGD	
COc1nc(Br)ccc1NC(=O)C(=O)NNc1ccc2c(=O)[nH]ccc2c1	793065322	KLXORVSNFIJFGC-UHFFFAOYSA-N	432.234	1.776	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNS(=O)(=O)CCc1ccccc1[N+](=O)[O-]	794599039	TVLXKFOQQSUPNZ-UHFFFAOYSA-N	436.446	1.014	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2ccc(NNC(=O)[C@H](O)C(C)C)c([N+](=O)[O-])c2)cc1	794682587	XMEHYKKEXLFCQL-QGZVFWFLSA-N	438.462	1.864	50	20	IDGD	
CCOc1ccccc1N1C[C@H](C(=O)NNc2ccccc2S(=O)(=O)N(C)C)CC1=O	795177009	IFOZPOHACPWZOQ-OAHLLOKOSA-N	446.529	1.832	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)[C@H]1CCCN1C(=O)c1ccc(OC)cc1	798351098	QCACOLKOEJVXDG-GOSISDBHSA-N	441.484	1.925	50	20	IDGD	
Cc1ccc(-c2ccnn2C)cc1NC(=O)C(=O)NNC(=O)COc1ccccc1C#N	799258592	GXCZQIFOUUBKAS-UHFFFAOYSA-N	432.440	1.432	50	20	IDGD	
CNC(=O)CNC(=O)c1cccc(NC(=O)C(=O)NNc2c(Cl)cccc2Cl)c1	800625989	DNLHDSBKSLVCHH-UHFFFAOYSA-N	438.271	1.551	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H](NCC(=O)NNC(=O)c2cccc(C#N)c2)C(C)(C)C1	801588008	ZJLNBVZHLYWFQU-QGZVFWFLSA-N	429.521	1.944	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)CN2CCOc3ccc(Br)cc3C2)cc1	801968087	SPWKXMSEXKWXFE-UHFFFAOYSA-N	429.274	1.976	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1ccc(OC(F)F)cc1F	802571188	NWXPNHAPLAMWKL-UHFFFAOYSA-N	430.364	1.005	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)[C@H]1CCCN(C(=O)c2ccncc2)C1	803489952	NSCURVFEKFTJRB-IBGZPJMESA-N	438.484	1.176	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN([C@H]2CCN(C(=O)NNC(=O)c3cccc(C#N)c3)C2)CC1	805067251	MWKZIPFCOSYCQB-SFHVURJKSA-N	442.520	1.540	50	20	IDGD	
COCCOc1ccc(S(C)(=O)=O)cc1NC(=O)C(=O)NNc1cccc(C#N)c1	806984761	TXNARDVRSWLAGF-UHFFFAOYSA-N	432.458	1.069	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)[C@@H]1CC(c2ccc(Cl)cc2Cl)=NO1	807082395	PINSAXVKFNLEJU-HNNXBMFYSA-N	436.255	1.459	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2cnc3n2CCCC3)c1	807261687	GWHVCWQTMMKAAD-UHFFFAOYSA-N	448.549	1.394	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)NC[C@@H](N3CCOCC3)C(F)(F)F)nc21	807539741	KDEYMYKBFFMMET-LLVKDONJSA-N	446.434	1.176	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)C1(NC(=O)OC(C)(C)C)Cc2ccccc2C1	808045150	DIUDEBGCEBDHKQ-UHFFFAOYSA-N	435.521	1.985	50	20	IDGD	
Cc1noc(C)c1S(=O)(=O)NCC(=O)NNc1cc([N+](=O)[O-])ccc1Br	811496871	OLXULZXXISAHGY-UHFFFAOYSA-N	448.255	1.384	50	20	IDGD	
COC(=O)Cc1cccc(S(=O)(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)c1	811700344	JTFYADKTEMFOPT-GFCCVEGCSA-N	426.878	1.833	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)[C@@H]2C[C@H]3C[C@H]3N2C(=O)OC(C)(C)C)c2ccccc2c1=O	814215613	UFHCAXMYHFEEAP-DFBGVHRSSA-N	427.461	1.092	50	20	IDGD	
CCOc1ccc(NNC(=O)C(=O)Nc2ccc(N3CCOCC3)cc2C(=O)OC)cc1	815817488	VIUFWWVZTMDOFO-UHFFFAOYSA-N	442.472	1.790	50	20	IDGD	
O=C(NNc1nc[nH]n1)[C@@H]1CCCN(S(=O)(=O)c2ccc(Br)s2)C1	816634039	WTBAUXSRUAZOSA-MRVPVSSYSA-N	435.329	1.173	50	20	IDGD	
COCCN(CC(=O)NNc1ccccc1S(=O)(=O)N(C)C)C(=O)OC(C)(C)C	817053782	GECRUFKKLKMCRH-UHFFFAOYSA-N	430.527	1.264	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@H]2CS[C@H](Cc3ccccc3F)C(=O)N2)cc1OC	886540034	VOBHWLFNRBKOOF-CRAIPNDOSA-N	447.488	1.447	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccc(Cl)cc2)CC1)NNC(=O)c1cccc([N+](=O)[O-])c1	897624201	BNRBPIFTGQWFJA-UHFFFAOYSA-N	445.863	1.467	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2c(OC)cccc2OC)c1	912643124	YTRNAWPUQTXAPH-UHFFFAOYSA-N	435.502	1.809	50	20	IDGD	
NC(=O)c1ncn2c(C(=O)NNC(=O)c3ccc4ccccc4n3)cc(-c3ccco3)nc12	913081355	KMCLMQNGPFWASF-UHFFFAOYSA-N	441.407	1.711	50	20	IDGD	
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC(=NNC(=O)[C@@H]2COc3ccccc3O2)CC1	914554628	OCHYVHUSOSXJCH-KRWDZBQOSA-N	433.490	1.123	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)NCCNS(=O)(=O)c2ccccc2)c1C	914723494	XDONHFJYITUSQE-RGEXLXHISA-N	430.530	1.753	50	20	IDGD	
O=C(NCCc1ccccn1)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	915884997	AACXJLQOCXYBQW-UHFFFAOYSA-N	431.518	1.443	50	20	IDGD	
CC(=NNC(=O)CNc1ccccc1F)c1ccc(S(=O)(=O)NCCC(=O)O)cc1	915920210	PTYZLXGEGXIZOY-UHFFFAOYSA-N	436.465	1.531	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCC(C)(C)N2C[C@@H](C)O[C@H](C)C2)c2ccccc2c1=O	916234461	GKEZAJUBLNMROP-HUUCEWRRSA-N	444.536	1.248	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)N[C@H](CN2CCCC2=O)c2ccccc2)nc2ccccc21	916459951	SAAIHYCNBGIWCH-GOSISDBHSA-N	434.500	1.810	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NCc3ccc(Cl)s3)nc2)CC1	916594438	CAMBEAAHVIICTR-UHFFFAOYSA-N	444.970	1.559	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)CCCS(=O)(=O)N2CCCC2)cc1	917390171	CNLBTAWIXMKMQR-OAHLLOKOSA-N	427.523	1.206	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)[C@@H](C)NS(=O)(=O)c2cccs2)cc1OC	917924666	GKBIYAFBNIJWNV-LLVKDONJSA-N	427.504	1.283	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1	918118535	UCKVACMVQJJRBL-SFHVURJKSA-N	439.516	1.606	50	20	IDGD	
C[C@@H](NC(=O)C1CCCCC1)C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	918398600	CLKSXTYGKPXKSQ-GOSISDBHSA-N	429.565	1.431	50	20	IDGD	
COCCOc1ccccc1C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	919689744	CRGXZWVOWUKEIA-UHFFFAOYSA-N	427.866	1.087	50	20	IDGD	
CCCc1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1	920215020	WKLSBRDROOTEDQ-UHFFFAOYSA-N	431.514	1.735	50	20	IDGD	
C[C@H]1CN(C(=O)c2ccc(CNC(=O)NNC(=O)c3ccccc3O)cc2)C[C@@H](C)O1	920347501	FRQRCIIVHMRYSL-GASCZTMLSA-N	426.473	1.786	50	20	IDGD	
CCNC(=O)NNC(=O)c1cc(S(=O)(=O)N2CCCCC2)ccc1Br	920858781	ASJPOTGLVUVUTA-UHFFFAOYSA-N	433.328	1.588	50	20	IDGD	
O=C(CCOc1ccc(Cl)cc1Br)NNC(=O)[C@H]1CCS(=O)(=O)C1	921275341	BZECZWIPHGHTNI-VIFPVBQESA-N	439.715	1.454	50	20	IDGD	
Cc1ccc2c(c1)S[C@H](C(=O)OCC(=O)NNC(=O)[C@H]1COc3ccccc3O1)C2	1317766404	SPXHTNIYVFQBOM-AEFFLSMTSA-N	428.466	1.542	50	20	IDGD	
CS(=O)(=O)Nc1ccccc1CNC(=O)NNC(=O)c1cc(Br)c[nH]1	1319054294	XHSWGGCSADYBNU-UHFFFAOYSA-N	430.284	1.293	50	20	IDGD	
COC(=O)[C@@H](NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)c1ccccc1Cl	1322962908	WNAZZBQOINCMDD-INIZCTEOSA-N	425.894	1.739	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)[C@@H]2CC(=O)N(C)c3ccccc32)cc1OC	1328227278	ZOJAMFDLQXRAGO-OAHLLOKOSA-N	441.440	1.158	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)[C@@H]2CC(=O)N(c3ccc(C#N)cc3)C2)cc1	1343636110	UHIJLGICDFRFBE-OAHLLOKOSA-N	427.486	1.305	50	20	IDGD	
O=C(NCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Cl)C1)c1cccs1	1778024215	SJZRKLKTIYDPOA-QIIPPGSGSA-N	431.917	1.526	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H]3ON=C(c4ccccc4)O3)C2)C1	1778871615	MZPQBLADALUZTL-NQIIRXRSSA-N	435.908	1.816	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)cc1O	1779298702	HZLSBYXZGDFLIT-OAQYLSRUSA-N	449.580	1.646	50	20	IDGD	
CCSc1cccnc1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](Cl)COC)CCO2	1780465330	LNMJSTNEHAWYSR-KUHUBIRLSA-N	427.954	1.891	50	20	IDGD	
C[C@@H]1C[C@@]1(C)C(=O)N1CC[C@]2(CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2)C1	1781064995	JSPIAJOXZFTRQV-CALQCPNCSA-N	443.972	1.995	50	20	IDGD	
O=C([C@H](F)Br)N1CC[C@@]2(C1)CN(C(=O)C(F)(F)c1ccco1)CCO2	1781334667	QIXXSSRTQZCARP-SMDDNHRTSA-N	425.201	1.892	50	20	IDGD	
O=C(c1ccc(C(F)(F)F)c(F)c1)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1781619500	DWRRLICADNQWPC-YOEHRIQHSA-N	438.805	1.888	50	20	IDGD	
O=C(c1n[nH]c2cccc(F)c12)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1782486442	SKOOCZLJRPWWHZ-PBHICJAKSA-N	443.248	1.836	50	20	IDGD	
O=C(CCc1ccccc1F)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2	1782709430	XGEQVNBRQQOXOF-WAOWUJCRSA-N	426.916	1.872	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccn4cncc4c3)CCO2)C1	1783349971	XKRYBARUVUIMQF-VQIMIIECSA-N	435.322	1.951	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cn4cc(F)ccc4n3)CCO2)C1	1783533612	BMKRHJRSMFNMQK-SGTLLEGYSA-N	439.285	1.700	50	20	IDGD	
CC(C)[C@H](C(=O)N1CC[C@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1)c1ccc(F)cc1	1783732381	XDKXMQLHWWIPIA-LVCYWYKZSA-N	426.916	1.995	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cnn(C)c3C(F)(F)F)CCO2)C1	1783873314	NTUSDEJSDDBSEG-LRDDRELGSA-N	438.834	1.136	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccnc(C(C)(C)C)c1)CCO2	1783936358	MFQPNNNIACAUCU-HSZRJFAPSA-N	445.564	1.196	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4ccoc4c3)C[C@@H]21)c1cccc(B(O)O)c1	1786984938	BOEGFFGCMFZNES-VCOUNFBDSA-N	448.284	1.020	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4cncn4c3)[C@H]2C1	1788428326	NTDAEESLSGGAAG-CSFVBSKPSA-N	435.322	1.711	50	20	IDGD	
C[C@H](Nc1ccccn1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]2C1	1788764280	JMJNCJHZKZIETC-XSLAGTTESA-N	434.613	1.713	50	20	IDGD	
CCn1nc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Br)C[C@@H]32)cc1C	1789000546	OQYSUOGHIFYPHQ-NZBPQXDJSA-N	431.306	1.495	50	20	IDGD	
C[C@H](C(=O)NC1(c2ccc(NC(=O)c3cnccc3C(=O)NN)cc2)CCC1)n1cncn1	1789523710	OOEBTYAJEXDWTC-CQSZACIVSA-N	448.487	1.286	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnn4c3CCC4)[C@H]2C1	1790390546	RSIAJYASCBEMBH-BCRCDCHUSA-N	429.348	1.659	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCSC(=N)N)C[C@@H]21	1790961077	GGBRCVRREZKAFL-RVMXOQNASA-N	435.388	1.156	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21	1790963194	OAQRZLNMTGLGJJ-HTFCKZLJSA-N	444.139	1.830	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)NC(=O)OC(C)(C)C)[C@H]2C1	1791156690	NSMWFVQZISNHCY-YXMSTPNBSA-N	447.960	1.133	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)(Cl)Cl)C2	1792872221	SCLKFRKEPXQFTL-QEYWKRMJSA-N	436.561	1.977	50	20	IDGD	
CC(=O)N[C@@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCl)c1ccc(F)cc1	1793115371	LRPLWASDMYYWEQ-CWQOZTLDSA-N	425.888	1.241	50	20	IDGD	
CN(C)c1cncc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCBr)C3)c1	1794294280	FCWIUOCSEVIPRN-XOIINTDNSA-N	425.327	1.136	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(N2CCOCC2)cc1	1796490839	CDNPWHBAWPGIOQ-HNJRGHQBSA-N	435.952	1.744	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(-n2c(O)nnc2O)cc1)C(Cl)Cl	1799313600	SAESYQITYVGBCV-LMKPVCQUSA-N	440.287	1.734	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cncn1-c1ccncc1)C2	1800758337	SZFNTPUWUCHRQS-VWPFQQQWSA-N	448.321	1.254	50	20	IDGD	
COC(=O)c1ccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)C(C)(C)CCl)C3)cc1	1801142518	QKAFVLYMCUEOEJ-IZZQQSIFSA-N	436.936	1.870	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccnc3c(O)cccc13)C2	1802338015	HNOMJOZQLIDIRD-MUJYYYPQSA-N	439.516	1.565	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cn1cc(C)c(O)nc1=O	1804097578	UKWXRYPUZBVYPT-CRWXNKLISA-N	441.326	1.069	50	20	IDGD	
Cc1nn2cc(CC(=O)N3CCC4(CCCN(C(=O)[C@H](O)CCl)C4)CC3)nc2s1	1805518203	PVHUMCWMEYNQKI-OAHLLOKOSA-N	439.969	1.473	50	20	IDGD	
CC(F)(F)C(C)(C)C(=O)N1CCCC2(CCN(C(=O)c3ccc(B(O)O)cc3)CC2)C1	1806179164	VFPNZSQPJNYQMX-UHFFFAOYSA-N	436.308	1.893	50	20	IDGD	
O=C(CCBr)NC[C@@H]1CCN(C(=O)Cc2cncnc2)[C@@H]1c1cccnc1	1806341917	IGZQCBJMJRZRDF-QFBILLFUSA-N	432.322	1.905	50	20	IDGD	
CCC(=O)N[C@H](C)C(=O)N1CC[C@@H](CNC(=O)CCBr)[C@@H]1c1cccnc1	1806343338	UZXDCVRLTGAORV-XUWXXGDYSA-N	439.354	1.787	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cccs2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807364960	VJSMKQGXXSACHU-FXAWDEMLSA-N	435.314	1.456	50	20	IDGD	
CC1(C)CC(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)C1	1807375771	VMPXZRJWNKWDQB-GHTZIAJQSA-N	435.333	1.517	50	20	IDGD	
C[C@H](C(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)n1cccc1C=O	1807392058	UKADXWCMEBPUHD-IWKCEXAMSA-N	432.908	1.562	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CCn2cncn2)[C@@H]1c1cccnc1)[C@@H](F)Br	1808681830	VYKBGEHRLGLUAT-NUEKZKHPSA-N	439.289	1.460	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)c1ccc2c(c1)OCO2	1808981088	DXULSJVLOCAIMO-FRQCXROJSA-N	431.876	1.730	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)c3nccc4occc34)CC2)C1	1809977791	HIDNUBOJCZSTPZ-UHFFFAOYSA-N	447.300	1.666	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](O)c3ccccc3)sc2C1	1814378097	JXZBYCBZGRJRRV-KUHUBIRLSA-N	445.545	1.162	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc(O)c([N+](=O)[O-])c2)[nH]n1)[C@H](O)CCl	1814872766	NSDBGDUFEOAMSO-IUODEOHRSA-N	437.840	1.929	50	20	IDGD	
C=CC[C@H](C(=C)C)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1	1815356531	IWXIZZJPCIOZPG-IAGOWNOFSA-N	439.346	1.817	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](C)Br)CC2	1817023494	DZFBNTYILSLQIE-VGMNWLOBSA-N	432.344	1.285	50	20	IDGD	
C=C(Oc1ccccc1O)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](O)CCl)CC2	1817258157	RRLXOYCHKOPDGK-BXUZGUMPSA-N	437.905	1.953	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](O)CCl)CC2)c1cnc2ccccc2n1	1817952266	AKFDXTTYLGFLAQ-BONVTDFDSA-N	431.905	1.912	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CN2CCN(C(C)=O)CC2)n[nH]1	1818966417	FRVZLCCCNNXHOF-NVXWUHKLSA-N	438.960	1.583	50	20	IDGD	
COC[C@H](NC(C)=O)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](C)Br)n[nH]1	1822189233	QNRGSJJHIWYDJF-BPNCWPANSA-N	444.330	1.336	50	20	IDGD	
O=C(N[C@@H]1CCc2nc(NC(=O)[C@@H]3CC[C@H]4CCC(=O)N4C3)sc2C1)[C@H](F)Cl	1822624191	XWKYQSFXRGXJDE-OZWUEAAUSA-N	428.917	1.991	50	20	IDGD	
CC(C)=NO[C@H](C)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCC(=O)NN(C)C)CC2	1823088405	BVSPAEICWQAJRI-OLZOCXBDSA-N	438.554	1.229	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCc1nc(N)n[nH]1)CC2	1825642627	SARSNIQRQYGMGI-YUMQZZPRSA-N	442.343	1.172	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1nc3ncccn3n1)CC2	1826000312	RPRQFBFMWIUISU-VHSXEESVSA-N	435.897	1.060	50	20	IDGD	
C=CCO[C@H](C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827049189	PKYHIXYSDVTSMS-UTKZUKDTSA-N	428.338	1.191	50	20	IDGD	
Cc1cc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)cn1C	1827052817	HSPVQYDWANJSJO-QFIPXVFZSA-N	437.349	1.560	50	20	IDGD	
O=C(CC[C@@H]1CCOC1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827054406	DKUWGIKIHZCGLB-GCJKJVERSA-N	442.365	1.416	50	20	IDGD	
O=C([C@H]1CCCCO1)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827056020	QLGQXTNURLFVTR-LEWJYISDSA-N	428.338	1.169	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(O)cc2)CC1	1830045304	FJFHWOBTUODTHB-FQEVSTJZSA-N	430.549	1.999	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(=O)c4ccccc4o3)CCO2)C1	1830312976	VFGIANSQOXIZGR-KSFYIVLOSA-N	448.903	1.880	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cnn3c2CCC3)CC1	1830904211	FMCTYEFPLNHDDR-IBGZPJMESA-N	444.580	1.436	50	20	IDGD	
O=C(CCBr)N1CCC([C@H]2CCCCN2C(=O)Cn2ccncc2=O)CC1	1831104049	NHBCELIESCHRFI-MRXNPFEDSA-N	439.354	1.648	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H](O)CCl)CC1	1831578704	SBRYIFHBKNXPQW-HOTGVXAUSA-N	431.961	1.731	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccc(F)cn3)C2)C1	1831645985	HQDYGCYSHZBHHZ-FXAWDEMLSA-N	427.904	1.627	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H](C)N2CCN(C)CC2)CC1	1831833391	NMMXEEFPKZKOLK-RLLQIKCJSA-N	443.032	1.496	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3ccc(C)cn3)CCO2)C1	1832995361	IUFUIYABSLGUNS-NQIIRXRSSA-N	439.940	1.033	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3ccco3)CCO2)C1	1833052119	ISOOIEWBQFHDAX-KSSFIOAISA-N	429.311	1.452	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3c[nH]c4cnccc34)CC2)CC1)[C@H](O)CCl	1833310144	KVWKNOIVHMITQQ-LJQANCHMSA-N	433.940	1.348	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1	1833534545	DHKFGKBUKQIOOS-SFHVURJKSA-N	444.020	1.339	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1)c1csnn1	1833557597	GWNNCFCTRIJFOC-UHFFFAOYSA-N	430.372	1.508	50	20	IDGD	
CN(C)c1ncc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@](C)(Cl)CCl)C3)C2)o1	1833900839	CWGKZMFJCYUODV-QZTJIDSGSA-N	449.335	1.047	50	20	IDGD	
O=C(CCBr)NC1CCN(C2CCN(C(=O)Cc3ccccn3)CC2)CC1	1834421904	SMMSWNOJAJUCBX-UHFFFAOYSA-N	437.382	1.981	50	20	IDGD	
Cc1noc(C)c1C(=O)N1CCOC[C@@]2(CN(C(=O)CCBr)CCO2)C1	1834819440	RBTIFCPSTNRBTO-QGZVFWFLSA-N	430.299	1.146	50	20	IDGD	
C[C@@H](C(=O)N1CCOC[C@@]2(CN(C(=O)CCBr)CCO2)C1)n1cccc1	1834826834	YDGIGTZXASTIFK-MAUKXSAKSA-N	428.327	1.291	50	20	IDGD	
O=C(c1n[nH]c2c1CCCC2)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836717828	KTLHEBHZXWLXGO-SFHVURJKSA-N	438.956	1.500	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)c3ccns3)CC2)CC1	1837355604	BMAYOWZMSVQIQN-UHFFFAOYSA-N	437.566	1.128	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccn(C(F)F)c3=O)CCO2)C1	1837772113	LJXADDYIPZHNGZ-IFXJQAMLSA-N	447.866	1.331	50	20	IDGD	
Cc1nn[nH]c1C(=O)N1CCC(OC2CCN(C(=O)[C@@H](C)Br)CC2)CC1	1838002310	SNLYJZVKDWUXTR-LLVKDONJSA-N	428.331	1.509	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(OCC)nn3)CCO2)C1	1838829483	AXSGPKVIAURFAA-MGPUTAFESA-N	440.928	1.353	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3ccc(OC)nc3)C2)C1	1839142346	NCLVAJBAKJVJRS-DYESRHJHSA-N	439.940	1.497	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccccc3O)C2)C1	1839151533	VQHYLBRJXFURQZ-OALUTQOASA-N	431.316	1.699	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C/N=C/c3ccco3)C2)C1	1839153650	NHJXQHJYNCMMRY-BVWGDMACSA-N	446.331	1.391	50	20	IDGD	
COc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)ccn1	1839153691	ONZWMGPNRFRYQZ-OALUTQOASA-N	446.331	1.397	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)cn1C	1840032805	KNQQDFFPTFEATF-KSSFIOAISA-N	428.327	1.187	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)Cc3ccco3)C2)C1	1840036880	RNMQRIRQIFPOEN-ZRGWGRIASA-N	443.338	1.698	50	20	IDGD	
CCC[C@H](C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](Cl)COC)CCO2)C1)n1cccc1	1840152483	JMXGROVJJWTFMV-DBXWQHBBSA-N	441.956	1.540	50	20	IDGD	
COc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)ccc1[N+](=O)[O-]	1840757999	LHBYYIRSSHAAJN-QAPCUYQASA-N	445.831	1.208	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H]2O[C@H](C[C@@H]2C(=O)N2CC3(CCCN3C(=O)[C@H](F)Cl)C2)C1	1843365392	NOWCHEWIOASAIE-BARDWOONSA-N	445.919	1.749	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)c1cc(-c3ccccc3)no1)C2	1846385348	SQPVSEPCKIJJHY-UHFFFAOYSA-N	425.489	1.532	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)c2cc(S(N)(=O)=O)ccc2C)cc1OC	12695849	ONLLFJCUIHVEQN-UHFFFAOYSA-N	435.502	1.905	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)NC)cc2)cc1OC	12695931	MFHIPYLJFHNXSS-UHFFFAOYSA-N	435.502	1.857	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccccc1F)NNC(=O)c1cc(Br)c[nH]1	24122982	MJARZJOWCZZFOC-UHFFFAOYSA-N	433.259	1.046	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=O)c2cc(Br)c[nH]2)n(C)c1	24124165	QUJUPMZTECRDEA-UHFFFAOYSA-N	446.327	1.221	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)NCCCN3CCC[C@H]3C(=O)N(C)C)n[nH]2)cc1	726277231	JTZDUQVXRPHAEX-IBGZPJMESA-N	441.536	1.272	50	20	IDGD	
C#CCNS(=O)(=O)c1ccc(C(=O)NNC(=S)Nc2ccc(OC)c(F)c2)cc1	727497946	CJMAGOPGJYKHNG-UHFFFAOYSA-N	436.490	1.377	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3cc(-c4ccccc4)[nH]n3)cc2)CC1	728213213	GSYSXAQRGCBZJL-UHFFFAOYSA-N	440.529	1.770	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)C[C@H]3OC(=O)c4ccccc43)cc2)CC1	728213693	GSCCXLHXGPFFKB-LJQANCHMSA-N	444.513	1.368	50	20	IDGD	
C[C@@H](Oc1cccc(F)c1)C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	728214900	UQGFYVNLAQHTCB-OAHLLOKOSA-N	436.509	1.672	50	20	IDGD	
CC(C)Oc1ccccc1CC(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	728341396	XIYICZZCWJGRTF-LJQANCHMSA-N	428.441	1.547	50	20	IDGD	
COc1cc(CNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc(OC)c1OC	728942239	MVUDVPNRXUZEGV-UHFFFAOYSA-N	444.492	1.249	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)N1CCc2ccccc2C1	728943953	FMAANXHTBSQFAD-KRWDZBQOSA-N	437.548	1.470	50	20	IDGD	
NC(=O)C1CCN(c2ncccc2CNC(=O)NNC(=O)c2cc3c(s2)CCC3)CC1	729231075	SYYYBLCYSGDSIL-UHFFFAOYSA-N	442.545	1.478	50	20	IDGD	
Cc1nn(-c2ccc(F)cc2)c2sc(C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)cc12	729275325	NHFGXFSSKUCGQL-SNVBAGLBSA-N	439.494	1.233	50	20	IDGD	
C[C@H]1CCCC[C@]12NC(=O)N(CC(=O)NNC(=S)Nc1ccc(N(C)C)cc1)C2=O	729689921	WPGKWFGINYYCIB-RBZFPXEDSA-N	432.550	1.571	50	20	IDGD	
O=C(CNC(=O)c1c(Cl)cccc1[N+](=O)[O-])NNC(=O)c1cccc2cccnc12	731051113	GRXHOSMGPMDWMK-UHFFFAOYSA-N	427.804	1.987	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCCc2sc(C)nc2C)cc1	731124409	WWFFRHNSZSCWHR-UHFFFAOYSA-N	439.563	1.262	50	20	IDGD	
O=Cc1cccc(OCc2ccccc2C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)c1	731617074	KKZUWPGCFAHFEL-MRXNPFEDSA-N	431.470	1.209	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)N1CCN([C@H](C)c2nc(-c3ccccc3)no2)CC1	731848301	HTQXZNHDPUUAOD-IAGOWNOFSA-N	428.537	1.997	50	20	IDGD	
O=C(NCCN1CCN(C(=O)C2CCCCC2)CC1)NNC(=O)c1c[nH]c2ccccc12	733350988	IYNWAAFVVKONDO-UHFFFAOYSA-N	440.548	1.836	50	20	IDGD	
Cn1cc(NS(=O)(=O)c2ccsc2C(=O)NNc2cnnc3ccccc23)cn1	733812045	RQIJCLVGJWAGHM-UHFFFAOYSA-N	429.487	1.983	50	20	IDGD	
C[C@@]1(NNC(=O)N[C@H]2CCN(c3ccc(C(F)(F)F)cc3)C2=O)CCS(=O)(=O)C1	733851464	ZNUBBGQESIDRNW-XJKSGUPXSA-N	434.440	1.192	50	20	IDGD	
Cc1nc2c(C#N)cnn2c(C)c1CCC(=O)NNC(=O)NCCNC(=O)OC(C)(C)C	734240789	TZNNKBVDZCTFJO-UHFFFAOYSA-N	444.496	1.006	50	20	IDGD	
O=C(COC1CCOCC1)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	735270890	XTCJHPJEUUNLTD-UHFFFAOYSA-N	436.468	1.401	50	20	IDGD	
Cc1ccc(N(CCC(=O)NNC(=O)c2cnn(C)c2)S(=O)(=O)c2ccccc2)cc1	735444136	PJVALAUPDLBPPM-UHFFFAOYSA-N	441.513	1.775	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccc([N+](=O)[O-])c2)cn1	735471133	QKLWJAJCGHUOLN-UHFFFAOYSA-N	444.429	1.204	50	20	IDGD	
CCc1cccc(CC)c1S(=O)(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	736064365	SFRLQGCPDSBLRN-UHFFFAOYSA-N	445.950	1.736	50	20	IDGD	
C[C@]12CCC(=O)N1c1ccccc1C(=O)N2CC(=O)NNC(=O)COCc1ccccc1	737634606	IVJHYWJABJJKQH-HSZRJFAPSA-N	436.468	1.350	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)NCCc2cccc(C(=O)NC)c2)cc1	741091990	NNELSEHJBYKKDM-OAHLLOKOSA-N	428.489	1.785	50	20	IDGD	
CC(=NNC(=O)[C@H](C)CN1C[C@@H](C)O[C@H](C)C1)c1cccc(N2CCCS2(=O)=O)c1	741162634	AYEWETSXVQIARR-BRWVUGGUSA-N	436.578	1.812	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)Cn2nnc(-c3ccc(C(=O)OC)cc3)n2)cc1C	741857277	XFPISSOADLMDJM-UHFFFAOYSA-N	428.474	1.520	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc(OC)c1OC(F)F	742480709	NCZRIXQZLURVGW-UHFFFAOYSA-N	434.359	1.356	50	20	IDGD	
O=C(CCN1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O)NNC(=O)c1c(Cl)cccc1Cl	742626879	ALYSDQQNRGOLHC-FKGLVLAHSA-N	426.256	1.307	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNS(=O)(=O)c1cnn(-c2ccccc2OC)c1	743249457	CHZTWMLTXPWXIB-UHFFFAOYSA-N	446.485	1.668	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@@H]2C[C@]23CCc2ccccc23)cc1	743288321	AZELBVVAUNEZFO-UGKGYDQZSA-N	427.526	1.667	50	20	IDGD	
C[C@H]1C[C@@H](NC(=O)NNC(=O)c2csc(N3CCOCC3)n2)C(=O)N1c1ccccc1	743510012	OOQBLOWCDNMSRH-DZGCQCFKSA-N	444.517	1.118	50	20	IDGD	
CN1CCN(c2cc(CNC(=O)NNC(=O)c3cccc(Br)c3)ccn2)CC1	743537674	QEAVNJMZBVGIIG-UHFFFAOYSA-N	447.337	1.740	50	20	IDGD	
O=C(Cn1c(=O)oc2cc([N+](=O)[O-])ccc21)NNC(=O)c1cccc(Br)c1	744372532	ZPRRPAWHKDRKNP-UHFFFAOYSA-N	435.190	1.726	50	20	IDGD	
O=C(NCCS(=O)(=O)N1CCOCC1)NNc1c(F)cc(F)cc1Br	745790189	VKMKHODNBHJUBC-UHFFFAOYSA-N	443.270	1.015	50	20	IDGD	
C[C@@H](CCOc1ccccc1)C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	745994651	JXBQQABPPPGTKY-KRWDZBQOSA-N	447.561	1.566	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2cccc3cnccc23)CC1	745994789	UIWJTHVUEQBXFW-UHFFFAOYSA-N	426.502	1.323	50	20	IDGD	
Cc1ncsc1C(=O)NNC(=O)C1(NS(=O)(=O)c2c(C)noc2C)CCCC1	746223305	IPRULBMNNASYOF-UHFFFAOYSA-N	427.508	1.109	50	20	IDGD	
COc1cc(C)nc(NNC(=O)CCCn2cnc3cc(OC)c(OC)cc3c2=O)n1	746628112	UJWWFEXCPOJSSS-UHFFFAOYSA-N	428.449	1.444	50	20	IDGD	
Cn1cc(S(=O)(=O)N2CCC(NC(=O)NNc3cc(F)c(F)c(F)c3)CC2)cn1	746765956	BFKNHUZSJRTJBS-UHFFFAOYSA-N	432.428	1.317	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)NCCNS(=O)(=O)c2cccs2)c1	747437371	IWKSPZHWQQVUFU-UHFFFAOYSA-N	426.520	1.053	50	20	IDGD	
C[C@H](C(=O)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1)N1C(=O)[C@H]2CCCC[C@H]2C1=O	748519936	FTSXDIBBDUPHKA-HONMWMINSA-N	447.435	1.987	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)C2(S(C)(=O)=O)CCCC2)cc1	749838235	NDFOYTKFMZSJJJ-UHFFFAOYSA-N	437.547	1.226	50	20	IDGD	
CC[C@H](C)c1ccccc1N1C[C@H](C(=O)NNC(=O)CNC(=O)c2ccco2)CC1=O	751206801	NONXJXNKMZSDNQ-LSDHHAIUSA-N	426.473	1.723	50	20	IDGD	
CN1C(=O)N[C@@]2(CCC[C@H]2CNC(=O)NNC(=O)Nc2ccc(OC(F)F)cc2)C1=O	752022630	HJTCACACMZDNCS-XTZNXHDOSA-N	440.407	1.344	50	20	IDGD	
Cc1cc(C=NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)c(C)n1C	754910212	JVNONBSLISNAKN-UHFFFAOYSA-N	432.546	1.746	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)Nc1ccc(-n2cnnn2)cc1	755434603	JJZMWWRRJRAPLI-UHFFFAOYSA-N	432.238	1.657	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCC1CCS(=O)(=O)CC1	756051198	STTNIXNLEKLMTQ-LLVKDONJSA-N	448.339	1.372	50	20	IDGD	
O=C(CSc1ccc(Cl)cc1)NNC(=O)NCCN1C(=O)[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O	756092098	CVDIFEAGXBWNQD-IYVPYFHTSA-N	448.932	1.570	50	20	IDGD	
CCc1c(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cnn1CC(C)C	756364652	DRTRROGLMHXERB-SFHVURJKSA-N	430.461	1.246	50	20	IDGD	
NC(=O)CN(Cc1ccccc1)c1cccc(NC(=O)NNC(=O)Cc2cccnc2)c1	756393376	NOGGPAZSZZGQJC-UHFFFAOYSA-N	432.484	1.969	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)Nc2ccn(CCN(C)C)n2)c2ccccc2c1=O	756764882	LMLKIHPGNGACFS-UHFFFAOYSA-N	440.508	1.421	50	20	IDGD	
Cc1nn(C)c(OCC(F)(F)F)c1C=NNC(=O)Cc1csc(N2CCOCC2)n1	756822986	FFGSKKATRWFLSM-UHFFFAOYSA-N	446.455	1.656	50	20	IDGD	
CCCCN1C(=O)CC[C@H](C(=O)NNc2ccc(C(N)=O)nn2)[C@@H]1c1ccccc1OC	757400146	PRSDAMGNIAJHGB-YWZLYKJASA-N	440.504	1.807	50	20	IDGD	
CCOC(=O)Cc1nnc(NC(=O)NNC(=O)c2cc(Br)ccc2O)s1	757754062	JGBFRNHJZBZDNO-UHFFFAOYSA-N	444.267	1.578	50	20	IDGD	
COc1ccc(C[C@H](C)C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1	758076350	SPTOLJCGRPBZNU-NSHDSACASA-N	425.894	1.636	50	20	IDGD	
O=C(NNC(=O)c1cn(-c2ccccc2)nc1-c1cccnc1)C(=O)Nc1ccccn1	758822298	PRESPCAEIAIAPI-UHFFFAOYSA-N	427.424	1.729	50	20	IDGD	
CC(C)[C@H](NC(=O)Cc1ccc2ccccc2c1)C(=O)NNC(=O)C(=O)Nc1ccccn1	758831297	FGSCFQJJHDIRNO-NRFANRHFSA-N	447.495	1.704	50	20	IDGD	
Cc1onc(-c2ccncc2)c1C(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	759576779	YOUKJESGVCVGTA-UHFFFAOYSA-N	425.357	1.571	50	20	IDGD	
O=C(Cc1cccc(I)c1)NNC(=O)[C@H]1COc2ccccc2O1	760242104	PZDVEIDHOORVCB-OAHLLOKOSA-N	438.221	1.821	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C[C@H](C)NS(=O)(=O)c1cccnc1Cl	760562449	UUYABBXZBNROMB-NSHDSACASA-N	426.882	1.262	50	20	IDGD	
CCc1ccc(C(=O)NNS(=O)(=O)c2ccc(NS(=O)(=O)CC)cc2OC)cc1	761266489	HVRYCOSZTHWHKJ-UHFFFAOYSA-N	441.531	1.643	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)[C@@H]1CC(=O)N(c2ccccc2OC)C1	761633876	OGYLJELXHCRVMC-CQSZACIVSA-N	429.498	1.996	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NN=Cc1cc(Br)c2c(c1)OCCCO2	763196871	UMDSFIHBZPCTKO-UHFFFAOYSA-N	433.262	1.886	50	20	IDGD	
CS(=O)(=O)c1ccccc1NC(=O)C(=O)NNC(=O)c1ccccc1Br	763482751	KWMFTUJMKFHAMX-UHFFFAOYSA-N	440.275	1.252	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)C(=O)Nc1ccc2c(c1)nc1n2CCCCC1	763550502	BDJXRZLVLPORDV-UHFFFAOYSA-N	435.440	1.891	50	20	IDGD	
N#Cc1ccc(Oc2ccc(NC(=O)C(=O)NNC(=O)c3ccc4c(c3)OCO4)cn2)cc1	763551400	PGZBXOPHLMNMAQ-UHFFFAOYSA-N	445.391	1.874	50	20	IDGD	
Cc1cc(C)n(-c2cccc(NC(=O)C(=O)NNC(=O)c3c(C)nc4ccccn34)c2)n1	763629758	SHFOFMQPUBVXSP-UHFFFAOYSA-N	431.456	1.845	50	20	IDGD	
COC(=O)c1c(NC(=O)C(=O)NNC(=O)COc2cccc(C)c2)sc2c1CCCC2	763630435	LFWWVGWGBGLQKU-UHFFFAOYSA-N	445.497	1.887	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(NC(=O)c3ccccc3)nc2)c1	763631086	UTOSLYKZMXRZSE-UHFFFAOYSA-N	447.451	1.807	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2cccc(N3CCCNC3=O)c2)c1	763646667	GVJYTDSSMNZHKX-UHFFFAOYSA-N	439.472	1.388	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(Cl)c(NC(C)=O)c1	763656583	DDRNVSIDPMIJRK-UHFFFAOYSA-N	434.836	1.472	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2cccc(C(=O)NC(C)(C)C)c2)c1	763771946	IMJYGCRGHAYXLZ-UHFFFAOYSA-N	442.472	1.632	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2cccc(Oc3cnccn3)c2)c1	763775459	RGBFKUUEIFPLPA-UHFFFAOYSA-N	437.412	1.686	50	20	IDGD	
Cc1ccnc(-c2cccc(NC(=O)C(=O)NNC(=O)COc3ccccc3C#N)c2)n1	763814191	RJPBPNLTOSRFHU-UHFFFAOYSA-N	430.424	1.489	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)ccc1C	763842227	XMOBLVUGKYXCRN-OAHLLOKOSA-N	427.457	1.952	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccc2oc(N(C)C)nc2c1	763849904	MFHAMUWGEBRKAX-NSHDSACASA-N	429.408	1.586	50	20	IDGD	
CCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(OCC)cc2)cc1	763861851	REPKGOBBCKEVKN-CQSZACIVSA-N	442.472	1.388	50	20	IDGD	
Cc1ccn(-c2ccccc2NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)n1	763864497	JWKUOEXSZAYAMC-CQSZACIVSA-N	425.420	1.873	50	20	IDGD	
O=C(NNC(=O)c1ccc(Br)s1)C(=O)Nc1ccc2c(c1)C(=O)NCC2	763940650	MKIAOBDWGZDICX-UHFFFAOYSA-N	437.275	1.196	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc(-c2nnnn2C(C)C)c(F)c1	763956421	NRWHUTOSNCYFSM-UHFFFAOYSA-N	425.424	1.768	50	20	IDGD	
O=C(NNC(=O)c1cc2c(s1)CCCCC2)C(=O)Nc1ccc2c(c1)S(=O)(=O)CC2	763967776	HEONRZUUUMPGLT-UHFFFAOYSA-N	447.538	1.747	50	20	IDGD	
COC(=O)C(C)(C)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)cc1	763979445	VWBFPHWAOTUOSN-UHFFFAOYSA-N	433.848	1.896	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)C(=O)Nc1ccc(N=Nc2ccccc2)cc1	763996983	HRCYFGIKFXLWED-CYBMUJFWSA-N	429.458	1.623	50	20	IDGD	
CCOc1c(Br)cc(Cl)cc1NC(=O)C(=O)NNC(=O)c1cnccn1	764032577	SESGCFYRJIWFPS-UHFFFAOYSA-N	442.657	1.691	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc(N2CCSCC2)c(C)c1	764040818	MWBYRSXIDLDUNO-UHFFFAOYSA-N	428.514	1.957	50	20	IDGD	
NC(=O)c1n[nH]c2ccc(NC(=O)C(=O)NNC(=O)c3c(Cl)cccc3Cl)cc12	764226661	PYAYSGUOBGGLEN-UHFFFAOYSA-N	435.227	1.368	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)C(=O)Nc2ccc(F)c(C#N)c2)c1	764233263	UEWLFUBILOLSNH-UHFFFAOYSA-N	435.209	1.868	50	20	IDGD	
Cc1ncsc1C(=O)NNC(=O)C(=O)N1C[C@H](CC(=O)N(C)C)c2cc(Cl)ccc21	764248079	YVBJPOGMXLRSTR-NSHDSACASA-N	449.920	1.475	50	20	IDGD	
O=C(NNC(=O)c1cccc(OC(F)F)c1)C(=O)Nc1ccn(Cc2ccccc2)n1	764250131	KGFNBAJQZNYKQG-UHFFFAOYSA-N	429.383	1.933	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(-c3nnco3)ccc2C)c(OC)c1	764285930	DWHKOLVJTUNZDV-UHFFFAOYSA-N	425.401	1.462	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3[nH]ncc3c2)cc1Br	764326835	OWLPJUPZKRBRAD-UHFFFAOYSA-N	432.234	1.734	50	20	IDGD	
C[C@H](C(=O)NNc1c(F)cc(C(=O)NC2CC2)cc1F)N1C(=O)[C@@H]2CCCC[C@H]2C1=O	764335378	UTIUEVRRWHDWQC-LERXQTSPSA-N	434.443	1.864	50	20	IDGD	
CCOc1cc(C(=O)N(C)C)ccc1NC(=O)C(=O)NNC(=O)CCCc1cccs1	764339251	HWSNHDUOAARORU-UHFFFAOYSA-N	446.529	1.957	50	20	IDGD	
O=C(NNC(=O)C1CCC1)C(=O)Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1	764339573	UMBRGRNISXAYPZ-UHFFFAOYSA-N	449.555	1.937	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)C(=O)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1	764354291	PHYYUKUDKKWOHZ-IBGZPJMESA-N	447.499	1.054	50	20	IDGD	
CCN(CC)C(=O)N1CCC(C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)CC1	765313919	QOPNCAGBJLUBCQ-UHFFFAOYSA-N	427.546	1.613	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)[C@@H](C)n2nnc(-c3ccccc3)n2)n[nH]1	765591928	DYTXRBLNWBBIOI-CYBMUJFWSA-N	432.444	1.761	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)Cc3ccc(-n4cccn4)cc3)CC2)cc1	765753932	FMKQFDMUCMGPNO-UHFFFAOYSA-N	446.555	1.688	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)[C@@H](c2ccccc2)C2CC2)CC1	766190515	DXMGSJIJLVTAFK-IBGZPJMESA-N	429.546	1.655	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)C1(c2ccc(F)cc2)CCC1	766640744	FSTNPVIULAKTEA-UHFFFAOYSA-N	438.503	1.853	50	20	IDGD	
CCCC(=O)N1CCC[C@H]1C(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	766660634	QCLMHVFENJBBHQ-IBGZPJMESA-N	449.983	1.396	50	20	IDGD	
CC(C)(C)NC(=O)CN1CCN(C(=O)COC(=O)[C@@H](Br)C(C)(C)C)CC1	766749404	LGNJGRDDCLXLOD-OAHLLOKOSA-N	434.375	1.398	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)[C@H]1CN(Cc2ccccc2)CCO1	767343244	FZRPFDGEBGYDLZ-HXUWFJFHSA-N	425.485	1.129	50	20	IDGD	
CC(C)(C)[C@@H](Br)C(=O)N(CCCN1CCOCC1)[C@@H]1CCS(=O)(=O)C1	768032462	BCOGPKZLKODBHG-CABCVRRESA-N	439.416	1.534	50	20	IDGD	
O=C(COc1ccccc1NC(=O)C(=O)NNC(=O)C1CCCC1)Nc1cccnc1	768240386	VZCWPEZBMVQAFC-UHFFFAOYSA-N	425.445	1.375	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(C)=O	768634715	ODWGBUBOVIIDAU-KRWDZBQOSA-N	444.513	1.771	50	20	IDGD	
C[C@@H](O)CNC(=O)/C(C#N)=C\c1cn(CCC(N)=O)nc1-c1ccc(Br)cc1	769106460	NCIPFPMHZKVUOX-UGMNDJHYSA-N	446.305	1.592	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)Nc1ccc(OCC(=O)N(C)C)cc1	769224626	ZMSFKLILWORTJC-UHFFFAOYSA-N	436.490	1.714	50	20	IDGD	
COc1ccc(C2(CNC(=O)NNc3nc(O)c4cnn(C)c4n3)CCOCC2)cc1	770356685	SUGXZRHHZUZXKV-UHFFFAOYSA-N	427.465	1.452	50	20	IDGD	
CC[C@@H]1Oc2cc([C@H](C)NC(=O)NNc3nc(O)c4cnn(C)c4n3)ccc2NC1=O	770402043	NWFMTKSMFFSREN-ZANVPECISA-N	426.437	1.566	50	20	IDGD	
Cc1cc2c(N3CCC[C@H]3C(=O)NNc3nccc(N4CCOCC4)n3)ncnc2s1	771048736	UYZUSOBAUDOMHR-HNNXBMFYSA-N	440.533	1.738	50	20	IDGD	
CN(C)c1nccc(NNC(=O)CN2C(=O)N[C@@](C)(c3ccc(F)c(Cl)c3)C2=O)n1	771737982	WKVPMKAZJZBTDY-SFHVURJKSA-N	435.847	1.245	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)N2CCC(C(=O)NCCO)CC2)N(C)c2ccccc21	771771388	SALJOIFARTZXBZ-UHFFFAOYSA-N	439.516	1.004	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1ncccc1OCc1cccc(Cl)c1	771822137	PRGWBWWWNHDLNH-LLVKDONJSA-N	441.897	1.404	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1ccccc1OCC(=O)Nc1ccccc1F	771856370	STSWAEXYBLWULR-CYBMUJFWSA-N	431.420	1.946	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)[C@]12CCC(=O)N1c1ccccc1S2	772889976	URWONEMEQINSJG-HXUWFJFHSA-N	444.900	1.733	50	20	IDGD	
CC[C@@H](C)C(=O)N1CSC[C@H]1C(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772898557	SACHQJKNRNDDBJ-RISCZKNCSA-N	426.926	1.051	50	20	IDGD	
CC(C)Oc1ccc(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1	773225169	BRJDVELAFGVTKB-UHFFFAOYSA-N	441.531	1.347	50	20	IDGD	
Cn1c(=O)n(C)c2nc(NC(=O)CCC(=O)NNc3ncc(Cl)cc3Cl)ccc21	775275738	OCBYELDAMSHVHN-UHFFFAOYSA-N	438.275	1.836	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)[C@@H](c2cnn(C)c2)N(C)C(=O)OC(C)(C)C)c1	776314615	LLEBQFGKDJYITN-GOSISDBHSA-N	431.493	1.863	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)N[C@H]1CCN(c2ccc(F)c(Cl)c2)C1=O	777751781	GKDMQQUOJQFMCI-INIZCTEOSA-N	445.838	1.865	50	20	IDGD	
CCCCN(C)C(=O)c1ccccc1S(=O)(=O)NNC(=O)CNC(=O)OC(C)(C)C	777938766	GQZSBNOZPGSUQP-UHFFFAOYSA-N	442.538	1.393	50	20	IDGD	
COc1ccc(N2CCN(C(=O)/C=C\C(=O)NNc3ccc([N+](=O)[O-])cc3)CC2)cc1	778391708	POXMTYZTJWXTNY-KHPPLWFESA-N	425.445	1.952	50	20	IDGD	
Cc1ccc(C[C@H](C)C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1	778522337	RTMDFIAKSAONRT-KRWDZBQOSA-N	445.541	1.656	50	20	IDGD	
COc1ccc(S(N)(=O)=O)cc1C(=O)NNc1ccc([N+](=O)[O-])cc1Br	779145681	NMVCBZMHTHSKMN-UHFFFAOYSA-N	445.251	1.770	50	20	IDGD	
Nc1nc(Cl)cc(NNC(=O)CN2C(=O)COc3cc(Br)ccc32)n1	779374795	FZZBJQGKHNGCJA-UHFFFAOYSA-N	427.646	1.343	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(F)cc1)c1ccccc1	780654450	GAJPYCGIWGHTQK-NEWSRXKRSA-N	449.504	1.291	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NN=Cc1ncccc1C)N(S(C)(=O)=O)CC2	781587658	QWNDTLPUSXLRNA-SFHVURJKSA-N	446.529	1.806	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cnn(C)c2C(F)(F)F)cc1OC	782121386	WUDJQGABFITICA-UHFFFAOYSA-N	429.355	1.246	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)C(=O)Nc1cccc2c1CCCC2	782897978	UFRJMSVMQUILPU-UHFFFAOYSA-N	429.502	1.258	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2ccc(S(=O)(=O)N3CCC(C)CC3)cc2)nc(C)n1	783323904	BVEDJXZGHIWHEZ-UHFFFAOYSA-N	446.533	1.596	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2ccc(Cl)c(S(=O)(=O)N(C)C)c2)nc(C)n1	783326661	ZOKJGTXNFHGBAQ-UHFFFAOYSA-N	426.886	1.079	50	20	IDGD	
Cn1c(=NNC(=O)C(=O)Nc2ccccc2SCCC(N)=O)sc2ccccc21	783352412	SCOVHEUKSXUTJO-UHFFFAOYSA-N	429.527	1.778	50	20	IDGD	
N#Cc1ccc(Oc2ccc(NC(=O)C(=O)NNc3ccc(-n4cccn4)nn3)cn2)cc1	783432914	HFSVLCHHDXOQEK-UHFFFAOYSA-N	441.411	1.803	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N[C@H](C)C[C@H](C)O)cc1	783628428	JDVIOJLABWXJPS-NIRMRBTQSA-N	425.489	1.617	50	20	IDGD	
CC(C)(C)OC(=O)N[C@]1(C(=O)NNc2ccc(C(N)=O)nn2)[C@H]2CCCO[C@@H]2C1(C)C	783902267	XNWBJOTZNVJLFO-YZIJFISFSA-N	434.497	1.117	50	20	IDGD	
CC[C@H](C)NS(=O)(=O)Cc1cccc(NC(=O)C(=O)NNc2nccnc2Cl)c1	784778030	PPEUWRUQKVGMCD-NSHDSACASA-N	440.913	1.430	50	20	IDGD	
COc1cccc(NNC(=O)C(=O)Nc2ccc3nc(N4CCOCC4)sc3c2)n1	784847121	ZVTIXUSSGZIHDY-UHFFFAOYSA-N	428.474	1.618	50	20	IDGD	
CCN1CCCN(C(=O)NNC(=O)[C@@H](C)Oc2cccc(Br)c2)CC1=O	787256066	XGKKHJKKLIPLOX-GFCCVEGCSA-N	427.299	1.511	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)N[C@H]2CCN(c3cccc(Br)c3)C2)n1	787372171	YRSGRLVAMPHYKX-HNNXBMFYSA-N	435.326	1.872	50	20	IDGD	
COc1c(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)oc2ccccc12	788859792	BIPHDHIJESXGAX-UHFFFAOYSA-N	446.485	1.836	50	20	IDGD	
O=C(NNC(=O)C(=O)NC1CC1)N[C@H](Cc1ccccn1)c1ccc(Br)cc1	788872974	UFMJKYHZEDHRHD-MRXNPFEDSA-N	446.305	1.737	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)N1CCC[C@@H](N2CCCS2(=O)=O)C1	789842010	SQWZBFWMCXKCAM-DZGCQCFKSA-N	444.941	1.348	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c1C	790060713	JQLQHCANMVSHKS-ATVHPVEESA-N	448.483	1.366	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)Nc1ccccc1N1C[C@H]2CC[C@H]1C2	790958449	DECOHIYYZOTEDH-STQMWFEESA-N	439.428	1.689	50	20	IDGD	
CN(c1ccccc1NC(=O)C(=O)NNc1cccc(F)c1[N+](=O)[O-])S(C)(=O)=O	790997493	PRAMUEXQXCKBBB-UHFFFAOYSA-N	425.398	1.212	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)Cc2cc(Cl)c3c(c2)OCCO3)n1	792752923	LSZFPNOIYHVOID-UHFFFAOYSA-N	439.877	1.352	50	20	IDGD	
O=C(NNc1ccc2c(=O)[nH]ccc2c1)C(=O)Nc1cccn(Cc2ccccc2)c1=O	793069164	HFSULZNYFAHHOL-UHFFFAOYSA-N	429.436	1.820	50	20	IDGD	
N#CCc1cccc(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1	794579115	PKKUDBGYKVDRJC-UHFFFAOYSA-N	448.526	1.160	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNS(=O)(=O)C1=Cc2cc(Br)ccc2OC1	794868200	SOTJBDNHXGQKRF-UHFFFAOYSA-N	446.323	1.438	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c(F)cc1Cl	795278427	YIBFJYZBWUGRFC-UHFFFAOYSA-N	431.785	1.797	50	20	IDGD	
COC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)c1C	798041740	FIQJMNNBUOFREE-GFCCVEGCSA-N	432.408	1.866	50	20	IDGD	
Cc1nc(Cn2nnc(C(=O)NNc3cc([N+](=O)[O-])ccc3Br)c2C)no1	800617152	ZXYQNLAHXFOFTO-UHFFFAOYSA-N	437.214	1.754	50	20	IDGD	
COc1ccc(-c2n[nH]cc2C(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)cc1	802067882	PNZJBFHGQQVDES-UHFFFAOYSA-N	429.458	1.955	50	20	IDGD	
CC(C)N1C(=O)c2ccc(C(=O)NNC(=O)Nc3ccc4c(c3)OCO4)cc2S1(=O)=O	802101909	XTBKUMPCRDMPDV-UHFFFAOYSA-N	446.441	1.435	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(OC)c(NC(=O)C(=O)NNc2ncccc2F)c1	807300786	KJUZJDDVLRVYGN-UHFFFAOYSA-N	439.469	1.342	50	20	IDGD	
C[C@H]1CCCN(S(=O)(=O)c2ccc(NC(=O)C(=O)NNc3cccc(F)n3)cc2)C1	807392086	FVZXBJYIQUWEGE-ZDUSSCGKSA-N	435.481	1.723	50	20	IDGD	
CSc1cccc(F)c1CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	807426432	PQVVZURUKLCQRE-UHFFFAOYSA-N	440.522	1.942	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)C(=O)Nc1cc(F)c(Br)c(F)c1	807428435	DSBQYQDOOJZUNR-UHFFFAOYSA-N	438.192	1.785	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ccc(-n3ccnc3)nn2)c(OC[C@@H]2CCCO2)c1	807429482	SFYOHKPQMLFVNH-HNNXBMFYSA-N	437.460	1.610	50	20	IDGD	
CCc1nnc(NC(=O)[C@H](C)[C@H](C)NC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)s1	807565531	MYRPJLBSKYHCHR-ZJUUUORDSA-N	435.466	1.616	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)NCc1ccncc1OC[C@H]1CCOC1	807616114	OEAMENODMDSNNQ-HNNXBMFYSA-N	425.445	1.278	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NN=Cc1ccc(N)nc1)N(S(C)(=O)=O)CC2	807955992	KDSGKUSGJGESQX-MRXNPFEDSA-N	447.517	1.080	50	20	IDGD	
C=C[C@](C)(O)CC(=O)NNC(=O)c1ccc(CN(C)S(=O)(=O)c2ccc(C)cc2)cc1	809983977	YHSNTZBSZQPVEF-QFIPXVFZSA-N	445.541	1.904	50	20	IDGD	
O=C(CNS(=O)(=O)c1c[nH]c2ncccc12)NNC(=O)c1cc2ccccc2cc1O	809985808	UYSXDYYPOPQULD-UHFFFAOYSA-N	439.453	1.161	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCC(=O)NNc2nccnc2Cl)cc1OCC	810408934	XLJJZDVVSVGZTL-UHFFFAOYSA-N	429.886	1.349	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1)NNc1ncccc1[N+](=O)[O-]	810529023	ZMSQADGSUBCJLV-UHFFFAOYSA-N	435.340	1.310	50	20	IDGD	
COC(=O)Cc1cccc(S(=O)(=O)NNC(=O)c2ccc(F)cc2Br)c1	811683857	ZXZLPBLQGSHWDB-UHFFFAOYSA-N	445.266	1.927	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NCCc2c[nH]c3ccc([N+](=O)[O-])cc23)c2ccccc2c1=O	812442114	PYCKICOHROCLGL-UHFFFAOYSA-N	449.427	1.510	50	20	IDGD	
O=C(NC[C@H]1COc2ccccc21)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	812443463	SWZXUPRYMJYJIV-INIZCTEOSA-N	444.513	1.591	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)COc2cccc(N3CCCC3=O)c2)cc1	812732581	MILVUABARHSWBM-UHFFFAOYSA-N	432.502	1.586	50	20	IDGD	
O=C(CN1CCC[C@](CO)(Cc2ccccc2)C1)NNC(=O)c1cccc([N+](=O)[O-])c1	812872996	YCWAWKZKXSMGBD-QFIPXVFZSA-N	426.473	1.673	50	20	IDGD	
CCOc1cc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)ccc1OC	813033327	NVZQLOQJWHOLJT-UHFFFAOYSA-N	436.490	1.426	50	20	IDGD	
O=C(NNC(=O)c1ccn(-c2ccc(Br)cc2)n1)C(=O)Nc1ccccn1	814317275	QGTWJHZBTNHQNK-UHFFFAOYSA-N	429.234	1.430	50	20	IDGD	
NS(=O)(=O)c1ccc(NC(=O)NN=C2C(=O)Nc3ccc(C(F)(F)F)cc32)cc1	814967875	DIZZBEXSNIHVLK-UHFFFAOYSA-N	427.364	1.831	50	20	IDGD	
O=C(COc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1cn(Cc2ccccc2)nn1	815565158	FABYKJFJCUDEKX-UHFFFAOYSA-N	428.836	1.145	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cccc1-c1ncco1	815567402	XBUWZPLGWGLNPF-UHFFFAOYSA-N	432.400	1.025	50	20	IDGD	
N#Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)ccc1Br	815567728	JMJMSFNQAYTEKN-UHFFFAOYSA-N	445.229	1.492	50	20	IDGD	
C[C@H]1CCCCN1C(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@H]2CCCO2)cc1Cl	815778169	FTAVGXUDWKGFJA-BLLLJJGKSA-N	436.896	1.620	50	20	IDGD	
CSc1ncc(Cl)c(C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)n1	828746260	UEXDECVUZUFGEU-UHFFFAOYSA-N	428.927	1.528	50	20	IDGD	
O=C(COC(=O)COc1ccc(F)c(Cl)c1)NNC(=O)c1ccc([N+](=O)[O-])cc1	912692106	NXNXLTKIMGXRHQ-UHFFFAOYSA-N	425.756	1.771	50	20	IDGD	
Cc1c(/C=C(\C#N)C(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)cc(C#N)n1C	913287152	UZRCQXFTKBFFII-VIZOYTHASA-N	425.832	1.770	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C[C@@H](NC(N)=O)c2cccc(C)c2)cc(OC)c1OC	913660844	LEUOYNFWWBAESQ-OAHLLOKOSA-N	430.461	1.582	50	20	IDGD	
O=C(NCc1ccnc(OCc2ccccc2)c1)NNC(=O)c1ccc(-n2cnnn2)cc1	916397768	OVJZZTNAUHVLHS-UHFFFAOYSA-N	444.455	1.781	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)NCCNS(=O)(=O)Cc1ccccc1	916516025	BWSASWYVLZOBOZ-UHFFFAOYSA-N	440.909	1.412	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCc1ccc(C(N)=O)cc1	916530931	SPFPYOQGNIWOSJ-LLVKDONJSA-N	435.278	1.846	50	20	IDGD	
CCN1C(=O)c2ccc(C(=O)NNC(=O)COc3cc(C)cc(C)c3)cc2S1(=O)=O	917546380	XBMLQFMRTORPKH-UHFFFAOYSA-N	431.470	1.308	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)N[C@@H](c2ccc(F)cc2)[C@@H]2CCCO2)c2ccccc2c1=O	918126115	GNFOGXZPDJTCMZ-ROUUACIJSA-N	439.447	1.937	50	20	IDGD	
Cc1ccccc1OCCNC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	918129156	QUACWLDNKACOEI-UHFFFAOYSA-N	448.549	1.031	50	20	IDGD	
O=C(COC(=O)c1nc(N2CCCC2)ncc1Cl)NNC(=O)c1ccc([N+](=O)[O-])cc1	919346593	YMLUXOKQTCVPAA-UHFFFAOYSA-N	448.823	1.256	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)NCC2(C(N)=O)CCOCC2)N(C)c2ccccc21	919712759	OQEOUWKZKSCPLK-UHFFFAOYSA-N	425.489	1.055	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCCN(C(=O)c3cccc(Cl)c3)CC2)n1	920090631	GTUCLJUOGBFLIZ-UHFFFAOYSA-N	449.964	1.643	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CN(C)CCCOc2ccc(S(C)(=O)=O)cc2)cc1	920835665	KOOFLFCPKNLKJS-UHFFFAOYSA-N	433.530	1.560	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N[C@H](C)Cn2cncn2)cc1	920851667	MSCDOGSYNPWODE-GFHWABCWSA-N	448.487	1.137	50	20	IDGD	
O=C(COc1ccc(Cl)cc1)NNC(=O)Nc1nc(CN2CCOCC2)cs1	920931197	GXILVDNZDCPMHJ-UHFFFAOYSA-N	425.898	1.860	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)[C@@H](C(C)C)N2C[C@H](C)O[C@H](C)C2)c2ccccc2c1=O	921202717	BGLDJYUGXAYEQJ-GQIGUUNPSA-N	443.548	1.701	50	20	IDGD	
Cc1ccc([C@@H](CNC(=O)NNC(=O)c2cncn2-c2ccccc2)N2CCOCC2)o1	1323179345	ARIPOQGBYDXUIL-GOSISDBHSA-N	438.488	1.791	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCC(=O)NNc2ccnc(Br)c2)cc1	1327560408	UCXKUNGCIRCXCU-UHFFFAOYSA-N	429.296	1.664	50	20	IDGD	
CC1=CC[C@H](C(=O)N2CC[C@]3(CN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)CCO3)C2)CC1	1778103071	XYZJIBOXALUOGH-KTDDNLLNSA-N	441.532	1.697	50	20	IDGD	
O=C1Cc2cc(C(=O)N3CC[C@@]4(C3)CN(C(=O)[C@H](F)Br)CCO4)ccc2N1	1778392666	IKIJYWPMAWMGIJ-MAUKXSAKSA-N	440.269	1.315	50	20	IDGD	
O=C(c1cccn2ccnc12)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1778580915	HRZRDSGEPNMEKV-CXAGYDPISA-N	425.258	1.468	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4ncncc4c3)C2)C1	1778605457	UEAHWPWNVNDMTO-ORAYPTAESA-N	433.306	1.857	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(C(C)C)[nH]n2)C1	1780155182	HIYQRZGSZZGIBP-JNAXZKDPSA-N	426.945	1.914	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1nc[nH]c1[N+](=O)[O-])C2	1780712222	XKHRLHAJUQMPCU-ZTFRIQLXSA-N	448.307	1.682	50	20	IDGD	
N#Cc1c[nH]c(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](F)Br)C2)c1	1780773331	AEDJYHFJIZZXTN-JKIFEVAISA-N	427.274	1.704	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](COC)NC(=O)OC(C)(C)C)CCO2	1781217088	FFTSEKQPBZAUFL-AVYPCKFXSA-N	447.960	1.373	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)n(C(F)F)n1	1781333130	DCSDLCCAATVXQU-IAQYHMDHSA-N	439.232	1.721	50	20	IDGD	
CCCCC[C@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2	1781816481	AQXGTPGFBAVGSK-SNYIIPAISA-N	444.381	1.710	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H]1CCCO1)CCO2	1782866865	LINKCCBSSGJOOD-ODXUAPNFSA-N	431.439	1.881	50	20	IDGD	
C[C@@H](CC(=O)N1CC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2)c1ccccc1	1783278810	ADKTUHJWYQVATM-UUOWRZLLSA-N	436.317	1.004	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cnn(C)c3Cl)CCO2)C1	1783350743	BLXUEIOUVCHHST-WBMJQRKESA-N	433.734	1.691	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cccc(F)c3[N+](=O)[O-])CCO2)C1	1783538093	SZDUODLXWZLDHE-PIGZYNQJSA-N	444.257	1.961	50	20	IDGD	
CN1CCC(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]32)CC1	1783656569	ILNFLXSZIUDJLG-BOSXTWCSSA-N	434.408	1.934	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3c(Cl)ccc4c3OCO4)CCO2)C1	1783876248	XSLUCOPZUICARX-BFUOFWGJSA-N	445.299	1.766	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc([N+](=O)[O-])cc3F)CCO2)C1	1783881328	RPBXTRUDMYJKCC-KBXCAEBGSA-N	429.832	1.431	50	20	IDGD	
C[C@@H](Cc1ccc(F)cc1)C(=O)N1CCO[C@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1	1783937004	MUYKLIDKCONHBO-SBUREZEXSA-N	448.539	1.207	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21	1783968701	ZHFMDTWHCQMKBE-CYDGBPFRSA-N	440.176	1.782	50	20	IDGD	
COc1ccc(CCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)C(Cl)Cl)C[C@@H]32)cn1	1785097501	OQYHSGYVVDDKFN-KKUMJFAQSA-N	430.332	1.806	50	20	IDGD	
CN1CCC(CC(=O)Nc2ccc(C3(NC(=O)c4cccc(B(O)O)c4)CCC3)cc2)CC1	1785913631	QYNYESNONCDEOY-UHFFFAOYSA-N	449.360	1.846	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccn4ccnc4c3)C[C@@H]21	1786407075	OEVNPTMRLIPZFV-JYJNAYRXSA-N	435.322	1.713	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3[nH]nc4ccncc34)[C@H]2C1	1787341524	PAZRBOWUJDSDGJ-DCFBYQPESA-N	440.331	1.788	50	20	IDGD	
COCc1oncc1C(=O)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1	1788145673	NJGIZRYPENCVTP-UHFFFAOYSA-N	449.272	1.562	50	20	IDGD	
COc1ncccc1CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]2C1	1788765010	FKKHICFUBUAWOA-FHWLQOOXSA-N	449.624	1.854	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3c[nH]c4ccccc34)[C@H]2C1	1789749340	AADADNFRXQLPJG-RNVRALISSA-N	433.936	1.944	50	20	IDGD	
CCS(=O)(=O)c1ccc(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](O)CCl)cc1	1793113004	YJTMMNFBOKVUOF-DFGXFYAUSA-N	442.965	1.261	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H](C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](O)CCl)C[C@H]2C[C@H]21	1793117666	XDXDPANEWCGADG-WWDRVWNISA-N	441.956	1.622	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c(c1)NC(=O)CO3)C2	1793449316	TUUUSJRNCYBCAK-YGTYGHESSA-N	435.908	1.628	50	20	IDGD	
Cc1noc(C)c1CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)CBr)C2	1793882671	RNDLNLLHPJYJKB-MJRMRKOOSA-N	428.327	1.455	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(C(=O)O)n(C(C)C)n1	1794432114	NAFAAKSYPXCVJR-LOUJCGABSA-N	440.928	1.773	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1n[nH]c(C2CC2)c1F	1794481917	WTNYSNWUGFVVDK-SZRLZVLASA-N	433.253	1.320	50	20	IDGD	
O=C1Nc2c(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)CCBr)cccc2C1=O	1795493381	KHEGGFRBMLVAFQ-ZSBIGDGJSA-N	434.290	1.858	50	20	IDGD	
COc1ccc([C@H]2C[C@H]2C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)cc1	1796189949	NRQFBBWTROKSBN-QGAVKGNSSA-N	448.328	1.431	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](C)C1(O)CCC1)C2	1796889557	CNQFGSDMSRCLIK-LFKSASQSSA-N	429.521	1.310	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc2c1cnn2C	1797089759	LUZYPUKXGNIIEA-KOFHJDLBSA-N	435.322	1.560	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2nc[nH]c2c1	1797407989	YJPHEPZCFOXAND-DPYKFYPSSA-N	435.322	1.797	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1c(-c2ccncn2)noc1C	1798488851	DDWWJDIOHCHYDB-UMPJEAMMSA-N	433.896	1.661	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ncccc1C(F)(F)F)c1ccc(B(O)O)cc1	1798913725	WRMIZNNLDZQOMU-MUJYYYPQSA-N	447.222	1.346	50	20	IDGD	
COc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)Br)C3)ccc1O	1798953828	INHXMBUZCGDMCO-VFFTVRQLSA-N	427.295	1.387	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(=O)nc2cccnn12	1799187760	ARBGVARXKSPNCF-YIYPIFLZSA-N	448.321	1.372	50	20	IDGD	
Cc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@](C)(Cl)CCl)nc2nccn12	1799279215	CBQLBOPSQCUMQR-QPWUGHHJSA-N	440.331	1.477	50	20	IDGD	
Cc1cccc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Br)n1	1799344737	UNNQBLVHZBZWQP-DLTLXFJOSA-N	428.302	1.603	50	20	IDGD	
N[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Br)c1cccc(Cl)c1	1799346595	SFYRDNJBOAPANA-OBRUSBNWSA-N	448.720	1.620	50	20	IDGD	
COc1cccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Br)c1	1799347991	WTHJCCTVQNBGOB-DLTLXFJOSA-N	429.286	1.518	50	20	IDGD	
COc1ccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)C(Cl)Cl)C3)c([N+](=O)[O-])c1	1799404619	XGVYNNXNAFLBCS-DRXBFXEBSA-N	446.287	1.539	50	20	IDGD	
O=C(/C=C/C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](F)Br)NCc1ccco1	1800158497	NSHKSINJJMUGCR-HHNUNDILSA-N	442.285	1.781	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](F)Br)c1cc(=O)nc2cccnn12	1800160756	HAFPASIIBSDDNT-JNIYBQFBSA-N	438.257	1.032	50	20	IDGD	
CN(C)[C@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)c1ccc(Cl)cc1	1800303992	LUWXTHXCXDOJKY-YFUQURRKSA-N	444.359	1.132	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)n1cc(C)cn1)C2	1800644328	PNKJZFQYNFDGSR-RBZJEDDUSA-N	427.343	1.516	50	20	IDGD	
Cc1noc(C)c1CCC(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]1c1cccnc1	1803141327	MUDAZWFEEQNPBI-IMFGXOCKSA-N	434.924	1.925	50	20	IDGD	
CN1CCC[C@H]1C(=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@@H]1c1cccnc1	1803944282	YKMBMHODPSFYDR-CAOSSQGBSA-N	427.318	1.872	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC2(CCCN(C(=O)[C@@H]3CCCN3C)C2)CC1	1806414207	UUHGQJLCRCWGEZ-HLNOYYKJSA-N	442.564	1.446	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)[C@H](N)c2ccccn2)[C@@H]1c1cccnc1	1807166003	AELKPBNZCDAEBU-JFRXWTBNSA-N	431.924	1.436	50	20	IDGD	
O=C(Cn1ccnn1)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@H]1c1cccnc1	1807683306	ZZKXREURMUVNGJ-AEGPPILISA-N	425.262	1.070	50	20	IDGD	
N[C@@H](Cc1cccnc1)C(=O)NC[C@H]1CCN(C(=O)C(Cl)Cl)[C@@H]1c1cccnc1	1808365289	WRQOUMKFCCTMDV-IXDOHACOSA-N	436.343	1.856	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)c2ccon2)[C@@H]1c1cccnc1	1808414897	PDNIPJDUVXEZPD-JMBUVSEHSA-N	449.471	1.523	50	20	IDGD	
Cc1ccc(CC(=O)N2CCCC3(CCN(C(=O)c4ccc(B(O)O)cc4)CC3)C2)cc1	1809279562	NNRRELGEWMDPOH-UHFFFAOYSA-N	434.345	1.762	50	20	IDGD	
C[C@@H]1C[C@]1(C)C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1	1810305316	KBSHRZREMXGMRM-GTXMHPBVSA-N	436.516	1.446	50	20	IDGD	
CCc1cc(C(=O)NC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)no1	1811002620	UVYNKKPFWIQUOK-HRAATJIYSA-N	442.520	1.325	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)COc3ccccc3)sc2C1	1813710449	QZYGDBGTLFGHSF-AWEZNQCLSA-N	445.545	1.507	50	20	IDGD	
Cc1cnc(C(=O)N[C@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)s1	1815337073	LCTUFNZNZAYVQB-ZDUSSCGKSA-N	442.331	1.127	50	20	IDGD	
COCCC(=O)N[C@H]1CCc2nc(NC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)sc2C1	1817279752	BZMRUXWEYTXLPW-ZFILKEQLSA-N	432.506	1.226	50	20	IDGD	
Cc1cc(NC(=O)CC(=O)Nc2cc([C@H]3CCCCN3C(=O)[C@@H](O)CCl)[nH]n2)no1	1818092395	ZNLQUTGTGKCMLC-OLZOCXBDSA-N	438.872	1.327	50	20	IDGD	
CCOC(=O)N[C@H](O)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CO[Si](C)(C)C)n[nH]1	1819595089	AMAQRAQOUWZANI-CZUORRHYSA-N	441.561	1.318	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@H](F)Br)[nH]n1)c1ccnnc1O	1820054209	VWYKTCHDWWVUIK-JQWIXIFHSA-N	427.234	1.902	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)C23CC(C(=O)OC)(C2)C3)n[nH]1	1822148998	XXUYAHCHYGCXHF-DVJGTGJLSA-N	438.912	1.999	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)CCn3cncn3)sc2C1	1826611218	QMUMHNQRFJPHJX-NXEZZACHSA-N	427.328	1.520	50	20	IDGD	
CN[C@H](CC(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCBr)CC1)C(=O)O	1826941152	NKJZZPIPPTUSLF-HUUCEWRRSA-N	432.359	1.454	50	20	IDGD	
Cc1n[nH]c(C)c1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827051911	JRXUSQABJJHUPV-HXUWFJFHSA-N	438.337	1.253	50	20	IDGD	
Cc1cc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)cnc1C	1827056339	SHZGMDPTAMWEAL-QHCPKHFHSA-N	449.360	1.925	50	20	IDGD	
Cc1cc(C(=O)NCC(=O)N2CCC([C@H]3CCCCN3C(=O)[C@@H](F)Cl)CC2)no1	1827608957	MUCNLQVXEXHAPO-NVXWUHKLSA-N	428.892	1.867	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(OC)c(F)c3)CCO2)C1	1830151703	NPZHENVOTOOWOO-FOIQADDNSA-N	444.887	1.158	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ncc(Cl)cn3)C2)C1	1830357596	AWHVBQUQUDFASA-GOSISDBHSA-N	431.320	1.465	50	20	IDGD	
CN1C(=O)CC[C@H]1C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@H](F)Br)CC1	1830400545	GJUCKXKQLJKZGX-DZKIICNBSA-N	432.334	1.917	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccccc3O)C2)C1	1830535862	VKWSKOZGGJRPOX-IFXJQAMLSA-N	441.322	1.493	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3nnc(C)s3)C2)C1	1831641343	YEBDMNPDXXSQIK-KXBFYZLASA-N	444.985	1.643	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccn(C(C)C)n3)C2)C1	1831653861	FXBCNLCQFKRXFI-UZLBHIALSA-N	426.945	1.942	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)[C@@H]2C[C@H]3CC[C@@H]2O3)CC1	1831680467	KBKIAZZUYHRTBH-YSFYHYPLSA-N	440.349	1.167	50	20	IDGD	
Cc1nccc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)n1	1831873068	HZMIFDIOVSDNHP-IBGZPJMESA-N	430.553	1.391	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)[C@H]2C[C@@]2(F)Cl)CC1	1831957867	BGLKPFNAFJITLN-LQWHRVPQSA-N	436.720	1.524	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2CCCS2)CC1	1832435195	YROXQWCAHDWTNB-PMACEKPBSA-N	430.379	1.495	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3ccc(Cl)cn3)CC2)CC1)[C@H](O)CCl	1833312599	RIHNUBRHMNJOMS-QGZVFWFLSA-N	429.348	1.520	50	20	IDGD	
C[C@H](Nc1cccnc1)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1834718490	IQYJJZWTZLWYMO-KXBFYZLASA-N	437.972	1.053	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@H](NC(C)C)C(C)C)CC2)CC1	1834787864	OPUVQOVIEYTTPC-VQTJNVASSA-N	445.048	1.834	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@H](C)Nc3cnccn3)CC2)CC1	1835748205	TWFWJYNUPFMRCK-MAUKXSAKSA-N	436.988	1.866	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)C34CC(C(=O)OC)(C3)C4)CC2)CC1	1836397595	JSPNYIQQRRVNHO-PPNDLDFTSA-N	439.984	1.919	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC1CCN(C2CCN(C(=O)c3ccncn3)CC2)CC1	1836398550	UBWWPWHCLAXELH-IBGZPJMESA-N	428.364	1.898	50	20	IDGD	
CC(=O)Nc1ccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)cc1	1836661077	CANBFCWEAJWAMY-UYAOXDASSA-N	441.887	1.178	50	20	IDGD	
O=C(CCc1ccc(F)nc1)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836714890	AJOAPZYKUXHYAG-SFHVURJKSA-N	441.931	1.752	50	20	IDGD	
O=C(c1ncc(Cl)cn1)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836715120	JUBIRKDIJWLNFN-HNNXBMFYSA-N	431.320	1.342	50	20	IDGD	
O=C(c1cc2ncsc2[nH]1)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836718521	QQZHQOILKQEFCM-INIZCTEOSA-N	440.953	1.836	50	20	IDGD	
C[Si](C)(C)C#CCCCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1	1837426998	ISXNTUIYACRJQV-XLIONFOSSA-N	445.032	1.094	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(NC(C)=O)o3)CCO2)C1	1837448419	LGQYDEWFDUJFNH-YWZLYKJASA-N	441.912	1.716	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3nc4ccccc4[nH]3)C2)C1	1837713170	LMSHUHOMBKVFRB-NRFANRHFSA-N	446.580	1.484	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(Cl)ncn1)CCO2	1838257692	NJKZGRQHVIGDGH-GOSISDBHSA-N	442.976	1.052	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3oncc3C)CCO2)C1	1838400201	QIQCAKFGALDIEI-SUMWQHHRSA-N	430.299	1.227	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc4cccnn4n3)CCO2)C1	1838422317	XXOJPHGRYGERRJ-FQEVSTJZSA-N	435.912	1.064	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3[nH]cnc3-c3cccnc3)CCO2)C1	1838498407	MKOQDADVMCSQRM-IIBYNOLFSA-N	447.923	1.559	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(F)c3)CCO2)C1	1838909216	RVDYGEZECQJQIW-KUHUBIRLSA-N	443.313	1.927	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)c3ccccc3)C2)C1	1839152348	WUPWJQYPBJMBKE-UXPWSPDFSA-N	445.343	1.413	50	20	IDGD	
CCc1nc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)co1	1839153753	QUZBTWUAYMZOCF-ZWKOTPCHSA-N	434.320	1.543	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2	1839155380	RXHQLKZWPUPSLY-GLQYFDAESA-N	446.169	1.463	50	20	IDGD	
CC(C)=NO[C@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)CBr)C2)C1	1839222542	QVTOSTHPWZCBLU-DAYGRLMNSA-N	448.358	1.275	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccc(F)cn3)C2)C1	1840031916	GTGZDJDCFLAZJJ-UGSOOPFHSA-N	444.301	1.003	50	20	IDGD	
O=C(CSC1CCCC1)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840186274	FGEXJKDSOQXNPJ-QGZVFWFLSA-N	425.378	1.922	50	20	IDGD	
O=C(CS[C@H]1CCCCO1)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840188594	RYQPWOXXQJUAMS-YOEHRIQHSA-N	441.377	1.506	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H](C)Cc3ccccc3)CCO2)C1	1840301116	DDCKOMOEJLHVKQ-LQBOVUBWSA-N	438.952	1.575	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)CCc2ccc(F)c(F)c2)C1	1841201946	UVMTXZFACQQFLJ-UHFFFAOYSA-N	443.454	1.413	50	20	IDGD	
CC(C)(C)NCC(=O)N1CC2(CCCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C1	1841924358	BWWITDNJOXGTIY-AWEZNQCLSA-N	430.977	1.710	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)c2c(C)nn(-c3ccccc3)c2O)C1	1842194958	ZKIWVRXNZLGZKZ-MRXNPFEDSA-N	432.908	1.957	50	20	IDGD	
O=C(c1ccccc1OC(F)(F)F)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843009889	SYXCWIHTOVVBQN-UHFFFAOYSA-N	448.206	1.396	50	20	IDGD	
O=C(NCCC(=O)N1CC2(CCCN2C(=O)[C@@H](F)Br)C1)c1ccccc1	1845220964	YCKCSUSHYOKYPG-OAHLLOKOSA-N	426.286	1.700	50	20	IDGD	
O=C(CCn1ccnn1)N1CC2(CCCN2C(=O)[C@@H](Br)Cc2ccccc2)C1	1845943157	WGSJIDVVKPKOPL-KRWDZBQOSA-N	446.349	1.878	50	20	IDGD	
COC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)[C@H](C)Br)C1	1846176740	AEJMGPSGRCVTEW-STQMWFEESA-N	448.358	1.513	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC12CN(C(=O)[C@H](O)CCNC(=O)OC(C)(C)C)C2	1846178209	KSRGKGYAJJULEC-CHWSQXEVSA-N	448.358	1.249	50	20	IDGD	
C[C@@H](Sc1ccccn1)C(=O)N1CCCC12CN(C(=O)c1cnccc1C(=O)NN)C2	1846577309	DHBBKVQGNGKTBS-CQSZACIVSA-N	440.529	1.078	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H]1CC(=O)N(Cc2ccccc2)C1	1847715659	DLDNYGUEJSQWBQ-XWSJACJDSA-N	433.936	1.491	50	20	IDGD	
O=C(COC(=O)CCCn1c(=O)oc2ccccc21)NNC(=O)c1cccc([N+](=O)[O-])c1	9843252	RFSZPRXGUQANRW-UHFFFAOYSA-N	442.384	1.287	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)c2ccc(CCNS(C)(=O)=O)cc2)c1C	18103687	NLZKJDPECBKSAU-MRXNPFEDSA-N	433.530	1.624	50	20	IDGD	
COc1cc(F)c(S(=O)(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)cc1OC	23143921	IJNFAHCZDDFQEK-UHFFFAOYSA-N	444.437	1.492	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN(Cc2ccccc2)C1)c1csc(N2CCOCC2)n1	108710214	BXKIQWBSCDRNCU-QGZVFWFLSA-N	429.546	1.653	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCN(C(=O)CC3CCCCC3)CC2)cc1OC	725802858	NFKRVKGVHSNWHO-UHFFFAOYSA-N	446.548	1.579	50	20	IDGD	
Cc1ccc([C@H](CN2CCOCC2)NC(=O)NNC(=O)CNC(=O)c2cccs2)cc1	725873187	UTZQPVHBQFZPMV-KRWDZBQOSA-N	445.545	1.190	50	20	IDGD	
CC(C)c1ccccc1NC(=S)NNC(=O)c1ccc2c(=O)n(C)c(=O)n(C)c2n1	727171504	ITUWFRDRNBYUDQ-UHFFFAOYSA-N	426.502	1.387	50	20	IDGD	
CC/C=C(/C)C(=O)N1CSC[C@H]1C(=O)NNC(=O)c1nn(CC)c(=O)c2ccccc12	728018982	ZBKDGDMQMDHBNO-RQPMMQJISA-N	443.529	1.435	50	20	IDGD	
CC1CCN(Cc2cccc(CNC(=O)NNC(=O)CNC(=O)c3ccco3)c2)CC1	728068128	MDFCIGGXVVJYSJ-UHFFFAOYSA-N	427.505	1.772	50	20	IDGD	
Cn1cc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c(C2CCCCC2)n1	728341877	JRXSCGMAAQNYOW-GOSISDBHSA-N	442.472	1.612	50	20	IDGD	
COc1cccc(C[C@@H](C(=O)NNC(=O)c2cccc(OC(F)F)c2)n2nnnc2C)c1	728485257	UEJYBJYJQDBQBT-KRWDZBQOSA-N	446.414	1.837	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)c2cccc(OC(F)F)c2)cc1NC(C)=O	728510666	PUUMEHVUJNDQJM-UHFFFAOYSA-N	429.401	1.878	50	20	IDGD	
O=C1CCC(=O)N(c2ccc(C(=O)NNC(=O)c3cc(F)ccc3Br)cc2)N1	728546278	QAMQMPMYOGSYSA-UHFFFAOYSA-N	449.236	1.821	50	20	IDGD	
O=C(NC[C@@]1(N2CCOCC2)CCSC1)NNC(=O)c1cccc(OC(F)F)c1	728596647	GSTCVPFXXHYARQ-SFHVURJKSA-N	430.477	1.440	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)NOCc1ccccc1	728752486	NFZWCPMSXVFROB-UHFFFAOYSA-N	432.502	1.937	50	20	IDGD	
Cc1cc(S(=O)(=O)NNC(=O)C2CCN(c3ncccn3)CC2)ccc1OC(C)C	728853899	GPRCAZCQWCOSJZ-UHFFFAOYSA-N	433.534	1.798	50	20	IDGD	
CC[C@@H](C)NC(=O)CN1CCN(C(=O)NNC(=O)c2cc3c(s2)CC[C@H](C)C3)CC1	728944632	IADXJPAQQGXGEW-LSDHHAIUSA-N	435.594	1.760	50	20	IDGD	
CN(C[C@H]1COc2ccccc2O1)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	728958967	HRXFBZIZVJBJAG-INIZCTEOSA-N	426.477	1.206	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)F)cc1)c1cccc(N2CCCS2(=O)=O)c1	728975842	VVYRGGNFQFCABO-UHFFFAOYSA-N	445.469	1.980	50	20	IDGD	
CCN(CC)C(=O)c1ccc(C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)cc1	729301001	VNXPICCICFQIMC-UHFFFAOYSA-N	445.545	1.845	50	20	IDGD	
Cc1ccc([C@]2(C)NC(=O)N(CC(=O)NNC(=O)Cn3ccc4ccccc43)C2=O)cc1	729449752	DKBTWDAJPAJFCS-QHCPKHFHSA-N	433.468	1.564	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)[C@@H]2C[C@@H](O)CN2C(=O)OCc2ccccc2)c1	729510570	AEYUIQQVNLJEGG-APWZRJJASA-N	443.456	1.237	50	20	IDGD	
O=C(NCCOc1cccnc1)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	734067067	GQMUAHWUCFNRPQ-UHFFFAOYSA-N	447.517	1.279	50	20	IDGD	
Cc1cc(=O)c(C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)nn1-c1ccccc1F	734239566	SBCZPHILASZTTL-UHFFFAOYSA-N	448.455	1.149	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=S)Nc2ccc(C(N)=O)cc2)CC1	734767189	SSLIWLFWMOVSAA-UHFFFAOYSA-N	436.538	1.686	50	20	IDGD	
CC(=O)N/C(=C\c1ccccc1)C(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	734821931	PBWADXVNUJSAAF-JXAWBTAJSA-N	445.520	1.894	50	20	IDGD	
CC(C)(C)c1ccc([C@H](O)CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1	734853930	DOFPKYDQDSXOAT-QGZVFWFLSA-N	447.561	1.955	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)[C@H]2CCC[C@H](C(F)(F)F)C2)CC1	735118887	ZKTBRYIYKRFSOG-KBPBESRZSA-N	449.499	1.830	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(C(=O)NNC(=O)COCc2ccccc2)ccc1Cl	737634413	CHASOJWJWVDFME-UHFFFAOYSA-N	425.894	1.568	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCc2n[nH]cc2Br)nc1	739020069	JCTKJBOTFVCXGQ-UHFFFAOYSA-N	432.304	1.080	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=S)N[C@@H]2CCOc3ccccc32)cc1	741478345	XRYMFHPTHDHGDO-QGZVFWFLSA-N	448.570	1.635	50	20	IDGD	
CN(C)C(=O)CS(=O)(=O)c1ccc(C(=O)NNC(=O)c2ccc3ccccc3c2)cc1	742049087	XKUNEALIYAATHW-UHFFFAOYSA-N	439.493	1.777	50	20	IDGD	
Cn1c(N)c(C(=O)/C(C#N)=C/c2cc(Cl)ccc2OC[C@@H]2CCCO2)c(=O)n(C)c1=O	743248504	VTNJVDNFZVMTSJ-NRUITVPNSA-N	444.875	1.667	50	20	IDGD	
CC(C)c1ccccc1NC(=S)NNC(=O)CCN1C(=O)[C@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O	743329773	WQCPZEPLXDPPDM-LMSBXDPUSA-N	430.530	1.680	50	20	IDGD	
O=C(CSc1nnc(O)nc1O)NN=Cc1cc(Cl)ccc1OC[C@@H]1CCCO1	743433871	NJZDVEZAYCIXBJ-LBPRGKRZSA-N	439.881	1.736	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)NCCN2CCN(c3ccccc3)CC2)cc1	743551454	OEFDPYUBSNHQOJ-UHFFFAOYSA-N	425.537	1.911	50	20	IDGD	
COCCN(CC(=O)NNC(=O)c1cc(Br)ccc1O)C(=O)OC(C)(C)C	743730942	IVRYRXUWUNOYKR-UHFFFAOYSA-N	446.298	1.799	50	20	IDGD	
Cn1c(=O)n(CCC(=O)NNC(=O)c2cc(Br)ccc2O)c2ccccc21	743731066	KXBRZWMLYYDBDB-UHFFFAOYSA-N	433.262	1.659	50	20	IDGD	
Cc1ccccc1O[C@@H](C)C(=O)N1CCN(CC(=O)NNC(=O)c2cccc(C#N)c2)CC1	744406574	FUOLVASJFIWICB-SFHVURJKSA-N	449.511	1.239	50	20	IDGD	
CCCCN1C(=O)CC[C@@H](C(=O)NNC(=O)C(=O)NC(C)C)[C@H]1c1ccc(OC)cc1	744447096	XGBRQTGQOPFGFF-IEBWSBKVSA-N	432.521	1.447	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)c1C	744456479	FSGORPSQUQWOIH-JAIQZWGSSA-N	449.467	1.534	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(CCNC(=O)NNC(=O)c2c[nH]c3ccccc23)CC1	744896271	WDZDEBZPMHZNDE-UHFFFAOYSA-N	430.509	1.665	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)C[C@@H](c2ccccc2)N2CCOC2=O)c1	744949719	AOZSJTNOMQURDN-SFHVURJKSA-N	436.424	1.446	50	20	IDGD	
CC/C=C(/C)C(=O)N1CSC[C@@H]1C(=O)OCC(=O)NNC(=O)c1cccc(C#N)c1	744973902	QIVUADPVPUFOAJ-AKOROQJMSA-N	430.486	1.120	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NN=Cc2cccc(OCCC(=O)O)c2)cc1	746679865	WITCXOKVKUOGIF-UHFFFAOYSA-N	433.486	1.619	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@H]1CCCN1Cc1ccc(F)cc1	747348869	XAJMLBSSJAUKTB-QGZVFWFLSA-N	447.536	1.853	50	20	IDGD	
CCC(=O)Nc1ccc(S(=O)(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1	747407470	ZDSREURTIIPGOZ-UHFFFAOYSA-N	425.488	1.062	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCn2ccnc2C1)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	747649846	VKUGPFLPBCCYRF-IBGZPJMESA-N	442.483	1.609	50	20	IDGD	
O=C(NNc1ccc(Br)cc1F)c1ccc(S(=O)(=O)N2CCOCC2)o1	748203437	DVNTWRVFXMVLLX-UHFFFAOYSA-N	448.270	1.959	50	20	IDGD	
Cc1c(NNC(=O)[C@@H]2CCCC[C@@H]2C(=O)N[C@H]2CCS(=O)(=O)C2)cccc1[N+](=O)[O-]	748687230	XCWOQGUKJNMCEM-SOUVJXGZSA-N	438.506	1.456	50	20	IDGD	
CCCCO[C@H]1C[C@H](NC(=O)NNC(=O)c2csc(N3CCOCC3)n2)C1(C)C	748968894	JBBBCKOTFDAMHD-GJZGRUSLSA-N	425.555	1.908	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)[C@H]2CCCN(C(=O)C3CC3)C2)cc1	749562217	NYLUWWZRODSIDP-KRWDZBQOSA-N	442.545	1.517	50	20	IDGD	
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	749581708	BNELUMJIIQWAJF-OXJNMPFZSA-N	448.527	1.788	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2cccc(F)c2I)C[C@@H](C)O1	750530815	WGZBQIOLAGCAOP-PHIMTYICSA-N	449.264	1.691	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)c2ccnc(C(=O)OC)c2)c2ccccc2c1=O	751199321	WRQBTMAXESWDEN-UHFFFAOYSA-N	437.456	1.843	50	20	IDGD	
C[C@@H]1C[C@@H](CNC(=O)OC(C)(C)C)CN1CC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	752071984	GHJCLGHIUFVAOA-KGLIPLIRSA-N	435.481	1.591	50	20	IDGD	
CCOC(=O)c1ccc(N2CC(NC(=O)NNC(=O)NCc3ccc(Cl)cc3)C2)nc1	753281288	WQFYPPJDZWIHOJ-UHFFFAOYSA-N	446.895	1.814	50	20	IDGD	
O=C(Cc1ccc([N+](=O)[O-])cc1Br)NNC(=O)c1ccc(-n2cnnn2)cc1	755056880	VNKHHFYFIMXDIH-UHFFFAOYSA-N	446.221	1.337	50	20	IDGD	
C[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)C(=O)NNC(=O)c1csc(N2CCOCC2)n1	755327294	UGVXRGYEFVSFCB-VXGBXAGGSA-N	427.527	1.290	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)Cc2c[nH]c3ccccc23)n([C@H]2CCS(=O)(=O)C2)n1	755537565	WJTJDXFWZVMKIV-AWEZNQCLSA-N	430.490	1.428	50	20	IDGD	
COC(=O)c1cccc2c1CCCN2CC(=O)NNC(=O)c1ccc(OC)c(OC)c1	756574347	SVFMCNSWQIXBSK-UHFFFAOYSA-N	427.457	1.704	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1ccc([C@H](C)NC(=O)OC(C)(C)C)cc1	756813749	CIXKEKDOXONCCX-RYUDHWBXSA-N	443.526	1.363	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2cccn(Cc3ccccc3)c2=O)c1	757659175	UTAYQYLFFRAWLU-UHFFFAOYSA-N	440.481	1.767	50	20	IDGD	
CC[C@@H](C)NS(=O)(=O)c1cccc(NC(=O)NNC(=O)c2cccc(OC)c2O)c1	757711840	UKPANOGFSCTDSS-GFCCVEGCSA-N	436.490	1.944	50	20	IDGD	
Cc1nn([C@H]2CCS(=O)(=O)C2)c(C)c1NC(=O)NNC(=O)Cn1ccc2ccccc21	757871262	HUMOJNJSBGCRDS-INIZCTEOSA-N	444.517	1.667	50	20	IDGD	
CN(NC(=O)[C@H]1CS[C@@]2(C)CCC(=O)N12)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758786771	NVIXTLHMQPIUTP-YJYMSZOUSA-N	441.554	1.076	50	20	IDGD	
COc1cc(Br)cc(S(=O)(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c1	760509311	JHZBEHRWSIIFEF-UHFFFAOYSA-N	430.236	1.989	50	20	IDGD	
C#CCNS(=O)(=O)c1ccc(C(=O)NNC(=O)CSc2ccccc2OC)cc1	761624633	AVUDYCQVCBGWGI-UHFFFAOYSA-N	433.511	1.160	50	20	IDGD	
CCCNC(=O)CN1CCC(NC(=O)NNC(=O)CSc2ccccc2OC)CC1	761658970	OWWFSXWHVRMMFP-UHFFFAOYSA-N	437.566	1.108	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCCOc2ncc(Cl)cc2Cl)c1	762055837	HSDSWILQRDMCTD-UHFFFAOYSA-N	447.300	1.815	50	20	IDGD	
CS(=O)(=O)N1CCN(C(=O)NNC(=O)COCc2ccccc2)Cc2ccccc21	763510245	RJLHCVITRVJQTK-UHFFFAOYSA-N	432.502	1.226	50	20	IDGD	
O=C(NNC(=O)c1ccccc1F)C(=O)Nc1ccc(C(=O)NCC(F)(F)F)cc1	763575440	VDXTYWAVOSNCTA-UHFFFAOYSA-N	426.326	1.518	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)N[C@@H]2CCCC[C@H]2N2CCOCC2)cc1	763656594	OQHQOIQGNFCRQL-IAGOWNOFSA-N	439.538	1.069	50	20	IDGD	
COC(=O)c1cc(C(C)C)ccc1NC(=O)C(=O)NNC(=O)COc1ccccc1F	763681152	LAPMHSHOIILCFJ-UHFFFAOYSA-N	431.420	1.901	50	20	IDGD	
Cc1nn(-c2ccccc2)cc1NC(=O)C(=O)NNC(=O)COc1ccc(Cl)cc1	763694033	DLDRVUCKNDZPAH-UHFFFAOYSA-N	427.848	1.999	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(OCc2cccnc2)cc1	763814518	WBIZKTXQBAKDJK-UHFFFAOYSA-N	445.435	1.697	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccnn1Cc1ccccc1F	763863563	AHSFEHMQNOJLTI-ZDUSSCGKSA-N	443.410	1.763	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)CN(C)C3)ccc1OC(C)C	763920747	CIADREWXTVPPQB-UHFFFAOYSA-N	426.473	1.828	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccc2nc(N3CCOCC3)oc2c1	763933395	WZHAQDZJLYDTKO-UHFFFAOYSA-N	441.419	1.132	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccsc2)cc1N1CCCCC1=O	764035538	YVPOQPFVLVUZIY-UHFFFAOYSA-N	430.486	1.602	50	20	IDGD	
N#Cc1cccnc1-n1cc(NC(=O)C(=O)NNC(=O)c2cccc3ccccc23)cn1	764052837	XSWUAKGYNZKXBD-UHFFFAOYSA-N	425.408	1.692	50	20	IDGD	
O=C(NNC(=O)c1cccc(Br)c1)C(=O)Nc1ccc(-c2ncon2)cc1	764063740	XJFDTYVRWPGBMA-UHFFFAOYSA-N	430.218	1.899	50	20	IDGD	
CN(C)Cc1cccc(NC(=O)C(=O)NNC(=O)c2cc(Br)ccc2O)c1	764279911	HSNYIIPGJAMERZ-UHFFFAOYSA-N	435.278	1.616	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)C(=O)Nc1ccc([S@](=O)C(F)(F)F)cc1	764313825	MZHMYKDGNQAEJC-LJAQVGFWSA-N	431.367	1.782	50	20	IDGD	
CCOc1ccc(Nc2ncccc2C(=O)NNC(=O)CNC(=O)c2cccnc2)cc1	764345849	ZAGAMUNHWYPMIX-UHFFFAOYSA-N	434.456	1.810	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(N3CCOCC3)cc2C(F)(F)F)o1	764371769	LEKHNGVHTBWSQM-UHFFFAOYSA-N	440.378	1.843	50	20	IDGD	
C#CCOc1cc(F)ccc1NC(=O)C(=O)NNC(=O)c1cc(-c2cccs2)[nH]n1	764383039	VAWMKKGTZGROJX-UHFFFAOYSA-N	427.417	1.689	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1c(C)cc(Br)cc1Cl	764397155	GJXYSWHOEYDFOW-VIFPVBQESA-N	436.690	1.548	50	20	IDGD	
C[C@H]1CN(Cc2ccccn2)CCC1=NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	764827882	LHSSXDPVLFNSEF-FQEVSTJZSA-N	448.571	1.854	50	20	IDGD	
CCCCS(=O)(=O)c1ccc(C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1	765185811	OJXVJCDXVZYPDP-UHFFFAOYSA-N	442.497	1.582	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1ccccc1-n1cc(Br)cn1	766261448	ZWQVZNYXEWZSNT-UHFFFAOYSA-N	432.238	1.515	50	20	IDGD	
Cc1c(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)[nH]c2c1C(=O)CCC2	766647695	VFGGCHRSDNZLAE-UHFFFAOYSA-N	437.500	1.061	50	20	IDGD	
O=C(CCOC1CCOCC1)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	766664844	VZVJWEOTIGUWIX-UHFFFAOYSA-N	438.956	1.191	50	20	IDGD	
CC(C)(C)OC(=O)N1CCO[C@H](C(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)C1	767449092	UCNSEQLGEHZZSD-AWEZNQCLSA-N	441.868	1.280	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3cccc(-c4nc[nH]n4)c3)n[nH]2)cc1OC	767887946	ZEYXNELOHSQOGO-UHFFFAOYSA-N	433.428	1.954	50	20	IDGD	
Cc1nc2c(c(O)nn2C)c(C)c1CC(=O)NNC(=O)c1cc(-c2cccs2)[nH]n1	768263656	XOXVMOZPSDISSQ-UHFFFAOYSA-N	425.474	1.746	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C3=NN(c4ccccc4)C(=O)[C@@H](C)N3)n[nH]2)cc1	768848025	MAPBFLSAGDBZME-CQSZACIVSA-N	431.456	1.485	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)N1CCN(c2ccc(C(N)=O)cn2)CC1	770188793	NKMJOTCPRVOUBQ-CYBMUJFWSA-N	446.895	1.164	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2cccc(S(=O)(=O)C(C)C)c2)c2ccccc2c1=O	770211719	IVMDZQIZNCJAMD-UHFFFAOYSA-N	442.497	1.673	50	20	IDGD	
C=CCNc1ncc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)s1	770955002	NNIXJZZHLXJQSO-UHFFFAOYSA-N	449.558	1.990	50	20	IDGD	
COCCn1nc(C(=O)NNC(=S)Nc2cccc(Br)c2)ccc1=O	770992315	RBXAHKFFDICJBY-UHFFFAOYSA-N	426.296	1.284	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)[C@H]2CC(=O)N(c3c(F)cccc3F)C2)c1	771152652	BEJAKKCHMJEFET-AWEZNQCLSA-N	442.378	1.194	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)[C@H]2CC(=O)N(c3c(F)cccc3F)C2)cc1	771153458	ZKKFDUIXKSILIC-AWEZNQCLSA-N	442.378	1.194	50	20	IDGD	
COC(=O)c1c(OC)ccc(S(=O)(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c1OC	771590037	TUEWCTWMNJRTQS-UHFFFAOYSA-N	439.402	1.022	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)CS(=O)(=O)c1cccc(Br)c1	772014938	DNYOFMKGSNMDHJ-NSHDSACASA-N	449.323	1.348	50	20	IDGD	
Cc1nnnn1/C(=C/c1ccccc1)C(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772883555	CVFBAXRMPUALTD-GZTJUZNOSA-N	439.863	1.097	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CC(F)F)C(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772896980	DUWJJEZAWAQTQS-LBPRGKRZSA-N	448.854	1.652	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)C2CCN(c3cnccn3)CC2)C1	773414364	KJSBCGNUNYJNLG-INIZCTEOSA-N	432.525	1.488	50	20	IDGD	
O=C(COC(=O)[C@@H]1CC(=O)N(Cc2ccccc2)C1)NNC(=O)c1cccc(Cl)c1	775494900	QMCNZWLVCAUHIK-MRXNPFEDSA-N	429.860	1.693	50	20	IDGD	
Cc1cc(C(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)c2c(C)n[nH]c2n1	776204592	DLEWNNMVEDMOEV-UHFFFAOYSA-N	431.497	1.824	50	20	IDGD	
C[C@@H](NC(=O)C1CCCC1)C(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776206295	SFNBCQQCAVYGCT-CQSZACIVSA-N	425.530	1.317	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)[C@@H]1CC(=O)N(C2CC2)[C@H]1c1cccc(OC)c1	776707757	UNDIFDCSUIBNMZ-MJGOQNOKSA-N	430.505	1.199	50	20	IDGD	
C[C@H]1CN(Cc2ccc(CNC(=O)NNC(=O)CNC(=O)OC(C)(C)C)cc2)C[C@@H](C)O1	778614657	UPABKSFUQCDZEC-IYBDPMFKSA-N	449.552	1.651	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)N[C@@H](CO)c1ccc(Br)cc1	778639299	BAISFBBVWLJHKL-LBPRGKRZSA-N	441.307	1.304	50	20	IDGD	
Cc1cnc(NC(=O)C(=O)NNC(=O)c2nn(CCC(C)C)c(=O)c3ccccc23)s1	782121444	YXNXPKFTURJEDU-UHFFFAOYSA-N	442.501	1.607	50	20	IDGD	
CC(C)(C)OC(=O)Nc1cnc(C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cn1	783038636	WBXOIHMOVFLVDX-UHFFFAOYSA-N	435.462	1.302	50	20	IDGD	
CCCNC(=O)[C@@H]1CN(C(=O)C(=O)NNC(=O)Nc2ccccc2C)c2ccccc2O1	783410675	FJNSNAZOGMBLTF-SFHVURJKSA-N	439.472	1.468	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2cc(Cl)ccc2OC[C@@H]2CCCO2)CCS(=O)(=O)C1	783427616	PFRJVSSPAPAZHZ-UGSOOPFHSA-N	445.925	1.034	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2ccc(CCn3nnc(-c4ccccc4)n3)cc2)ncn1	783946224	WPUWFTCRSCACLX-UHFFFAOYSA-N	443.471	1.763	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)C(=O)N2CCCC2)cc1OCC1CCCCC1	783999461	OMIVNDVVEFJXBM-UHFFFAOYSA-N	430.505	1.662	50	20	IDGD	
CSc1nc2ccc(NC(=O)C(=O)NNC(=O)CNC(=O)c3ccco3)cc2s1	784001908	GDUSQAYPJFRBAX-UHFFFAOYSA-N	433.471	1.127	50	20	IDGD	
CCc1cc(NNC(=O)[C@H]2CC=CC[C@H]2C(=O)N2CCOCC2)nc(-c2ccccn2)n1	784782623	ZLUHIXDSQUEINF-ZWKOTPCHSA-N	436.516	1.985	50	20	IDGD	
NS(=O)(=O)[C@H]1CCN(C(=O)C(=O)Nc2ccccc2S[C@H](Cl)C(F)(F)F)C1	784793757	QQCFTBNBJQMSFK-SDBXPKJASA-N	445.872	1.734	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1cc(C)nn1-c1ccccc1	785331103	OTUZRKBNVXGPKS-UHFFFAOYSA-N	443.485	1.675	50	20	IDGD	
Cn1ncc2c(N3CCN(C(=O)COC(=O)/C(C#N)=C/c4ccccc4)CC3)ncnc21	785352028	SHTWDBXNZDOOKG-GZTJUZNOSA-N	431.456	1.162	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)[C@H]1[C@H]2CC[C@@H](O2)[C@@H]1C(F)(F)F	785597102	GIRWAIJTYADEMW-VDERGJSUSA-N	449.451	1.507	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(N2CCOCC2)c(NS(=O)(=O)CCCCCl)c1	788061395	FKQCMVRSFMYPNU-UHFFFAOYSA-N	439.987	1.534	50	20	IDGD	
COc1cccc([C@@H]2[C@H](C(=O)NNc3ccc(-n4ccnc4)nn3)CC(=O)N2C2CC2)c1	788178348	NMDSXBIUUKPGPP-DYESRHJHSA-N	433.472	1.866	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2OC)c1)C(=O)OC	790105145	ZWNCOLVHURCGFW-HNNXBMFYSA-N	449.485	1.456	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(NC(=O)NNc2cccc(F)c2[N+](=O)[O-])cc1	790508574	LHCDZLQWFABUQZ-UHFFFAOYSA-N	427.414	1.807	50	20	IDGD	
C[C@H]1CN(C(=O)Cn2cc(NC(=O)NNc3cccc(F)c3[N+](=O)[O-])cn2)C[C@H](C)O1	790512206	MYPPIDRZOXWKNT-RYUDHWBXSA-N	435.416	1.715	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1cnn(-c2cccnc2)c1	792220185	YFBYDMJXTFRXLO-UHFFFAOYSA-N	429.820	1.547	50	20	IDGD	
CNC(=O)c1cc2cc(NC(=O)C(=O)NNC(=O)c3ccc(Cl)cc3F)ccc2[nH]1	792355542	ITYFMCJDVHZALH-UHFFFAOYSA-N	431.811	1.720	50	20	IDGD	
COCc1cc(C(=O)OC)cc(S(=O)(=O)NNC(=O)c2cccc(OC(F)F)c2)c1	793392610	PDCCLZBDSAXVFO-UHFFFAOYSA-N	444.412	1.844	50	20	IDGD	
CCCC[C@@H](/N=C1/NS(=O)(=O)c2ccccc21)C(=O)NNC(=O)c1cccc(C)n1	794076321	XEFONWRDTAHDON-MRXNPFEDSA-N	429.502	1.449	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c(F)cc1Cl	795277725	MWASFUBWROILFF-UHFFFAOYSA-N	431.785	1.797	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)C(=O)Nc2ccc(-c3csc(C(F)(F)F)n3)cc2)cn1	797007253	PHRYUKLNSGNOJA-UHFFFAOYSA-N	438.391	1.962	50	20	IDGD	
Cc1c(Cl)cccc1NNC(=O)C(=O)Nc1cc(S(=O)(=O)N2CCCC2)ccn1	797022138	ZRXHEUWSOMLFMB-UHFFFAOYSA-N	437.909	1.910	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2cc(C(=O)N3CCSCC3)ccc2C)n1	797369927	QOYZTMKCWJWRTO-UHFFFAOYSA-N	441.513	1.287	50	20	IDGD	
CCc1cccc(C)c1NNC(=O)C(=O)Nc1ccc(C(=O)NCCC(=O)OC)cc1	799844386	PWPBYSOBHBBCBU-UHFFFAOYSA-N	426.473	1.932	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@H]2CCCN(Cc3cccnc3)C2)cc1	802063830	DBNRGMVSNICVOH-INIZCTEOSA-N	431.518	1.550	50	20	IDGD	
COc1cccc(C[C@@H](C(=O)NNC(=O)Nc2ccc3c(c2)OCO3)n2nnnc2C)c1	802098462	QWQDSLMRKSWRPD-INIZCTEOSA-N	439.432	1.356	50	20	IDGD	
COc1ccc(Cl)c(NC(=O)NNC(=O)CS(=O)(=O)NC2CCC(C)CC2)c1	802112102	ZNQFBJOJMWKJPZ-UHFFFAOYSA-N	432.930	1.999	50	20	IDGD	
CCNC(=O)N(C)NC(=O)CNS(=O)(=O)c1ccc(SCC(C)C)c([N+](=O)[O-])c1	802571638	JHVPPMAFVMQADO-UHFFFAOYSA-N	447.539	1.314	50	20	IDGD	
CCc1nnc(NC(=O)[C@H](C)[C@@H](C)NC(=O)NNC(=O)[C@H]2COc3ccccc3O2)s1	805880948	SNVZBNXDLJLOPG-JTNHKYCSSA-N	448.505	1.234	50	20	IDGD	
COCCNC(=O)c1cccc(NC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])c1	806626216	OGDPFGLSFQPYPS-UHFFFAOYSA-N	431.405	1.203	50	20	IDGD	
CC(C)CC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)NNc1nc(-c2ccccn2)nc2c1CCC2	810442303	OGRPHSYEHAMNMS-IBGZPJMESA-N	448.531	1.967	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2cccc(Br)c2)cc1C	810448770	SWVQRTDLOSXHHC-UHFFFAOYSA-N	440.319	1.805	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)CNC(=O)c1cccs1)c1ccc(N2CCCNC2=O)cc1	812882669	UGNLRNZRZNALLG-ZDUSSCGKSA-N	444.517	1.489	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)NCc1ccc(S(N)(=O)=O)cc1	813543695	DROVBMDQHPBBBK-UHFFFAOYSA-N	445.526	1.910	50	20	IDGD	
Cn1ncc(I)c1C(=O)NNC(=O)c1cc(-c2ccccc2)[nH]n1	814205858	RHOKIYDTGLNLDX-UHFFFAOYSA-N	436.213	1.490	50	20	IDGD	
CCn1c(SCC(=O)NN=Cc2cc(C(=O)OC)no2)nnc1-c1ccc(OC)cc1	814875062	PORMFWWEWFWUJT-UHFFFAOYSA-N	444.473	1.991	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNc2cccc(Cl)n2)ccc1S(=O)(=O)N(C)C	815726729	RMHBXEIPCWUTNN-UHFFFAOYSA-N	427.870	1.076	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3ccccc3NC(=O)C3CC3)CC2)cc1	815826897	FBAXMTVNOGVUIJ-UHFFFAOYSA-N	449.555	1.922	50	20	IDGD	
C[C@H](C(=O)NNc1ccccc1S(=O)(=O)N(C)C)N1CCN(c2ccc(F)cc2)CC1	817053401	PUKSYDSRZKZIMV-MRXNPFEDSA-N	449.552	1.730	50	20	IDGD	
CCCCn1c(C)cc(/C=C(/C#N)C(=O)N2CCN(C(=O)CN3CCOCC3)CC2)c1C	827873499	WDBFWPXJMSNWPV-JWGURIENSA-N	441.576	1.815	50	20	IDGD	
CCS(=O)(=O)N1CCC(C(=O)NNC(=O)CNc2ccccc2)(c2ccccc2)CC1	849212000	KLTQVUKHVWUDNF-UHFFFAOYSA-N	444.557	1.629	50	20	IDGD	
O=C(NNC(=O)c1cnn2cccnc12)c1ccccc1NS(=O)(=O)c1cccs1	897620508	QZKZEYKXIDYIQM-UHFFFAOYSA-N	442.482	1.666	50	20	IDGD	
COc1ccc2c(c1)C[C@H](C(=O)NNC(=O)c1sc(N3CCOCC3)nc1C)CO2	914781910	VVOLLIYDWVOMCO-AWEZNQCLSA-N	432.502	1.309	50	20	IDGD	
O=C(COC(=O)c1cc(Cl)ccc1-n1cnnn1)NNC(=O)c1cccc(Cl)c1	915414119	JSRMGDQNTGDIPU-UHFFFAOYSA-N	435.227	1.587	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)c2nc(NCc3ccco3)ncc2Cl)c1	915857621	KFFQSKHZOVYEAT-UHFFFAOYSA-N	449.876	1.813	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NCCN2CCN(Cc3ccccc3)CC2)cc1	915901057	DLDCVBPLAJAXGI-UHFFFAOYSA-N	441.532	1.222	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NC[C@H](c2cccs2)N2CCN(C)CC2)cc1	915901645	KGHZQONVEQRPNJ-GOSISDBHSA-N	447.561	1.455	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)NCCNC(=O)C2CC2)c2ccccc2c1=O	915906496	PJJZRFMQBHHBAQ-UHFFFAOYSA-N	428.493	1.057	50	20	IDGD	
CCN(CC)[C@@H](CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)CC(C)C	916258651	HLXDHGATIYNEPM-QGZVFWFLSA-N	441.598	1.637	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)NCc1ccc(OCC(F)(F)F)nc1	916397453	BLQSBPODNMODDG-UHFFFAOYSA-N	443.338	1.840	50	20	IDGD	
CCN(CCNC(=O)NNC(=O)c1csc(N2CCOCC2)n1)c1ccccc1C	916513667	KDUFBKSXKULICB-UHFFFAOYSA-N	432.550	1.759	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)c2ccc(S(C)(=O)=O)cc2)CC1	916519047	VGWZVTGRRRCMDE-UHFFFAOYSA-N	440.522	1.434	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)NCC2(N3CCSCC3)CCCC2)nc2ccccc21	916616296	PPUJVJJUHXVFCB-UHFFFAOYSA-N	430.578	1.808	50	20	IDGD	
CC[C@@H]1CCCC[C@H]1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	916634848	RKICFJKDQULNGO-CRAIPNDOSA-N	438.550	1.620	50	20	IDGD	
Cc1ccc(NC(=O)[C@H]2CCCN(C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)C2)nc1	918001905	JOZISHWPEFQVTO-INIZCTEOSA-N	449.475	1.071	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)NCCCN2C(=O)NC3(CCCC3)C2=O)cc1	919897836	HOQDASKMGUNZSU-UHFFFAOYSA-N	431.493	1.213	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCC2(c3ccc(F)cc3)CCOCC2)c1	919917878	HIIKKCOVJILMLD-UHFFFAOYSA-N	449.504	1.922	50	20	IDGD	
O=C(NCc1cccc(NC(=O)[C@H]2CCCO2)c1)NNC(=O)[C@@H]1COc2ccccc2O1	920236305	AJDMGGLVIHXXEU-MOPGFXCFSA-N	440.456	1.475	50	20	IDGD	
CC(=O)c1cccc(S(=O)(=O)NCCC(=O)NNC(=O)NCCc2cccs2)c1	920889460	ZXKWIRKBCBLGAU-UHFFFAOYSA-N	438.531	1.192	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc2c(c1)OCCCO2)NNC(=O)c1ccccc1Cl	1115818816	CDOVPPNKPYIZIF-UHFFFAOYSA-N	439.877	1.241	50	20	IDGD	
CC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)c1cncn1-c1ccccc1	1248428234	JQGCAUUCXFSIOV-HXUWFJFHSA-N	430.468	1.862	50	20	IDGD	
COC(=O)COc1ccc(S(=O)(=O)NNC(=O)c2ccc(Br)cc2)cc1	1251126991	WOLAHMFWQOTLFF-UHFFFAOYSA-N	443.275	1.624	50	20	IDGD	
Cc1cccc(NC(=S)NNC(=O)c2ccc(S(=O)(=O)NC[C@H](C)O)cc2)c1C	1262596170	UXTHPZSCFPZRQQ-ZDUSSCGKSA-N	436.559	1.594	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2n[nH]c3c2CCCC3)c(Cl)cc1F	1319127695	QSYDUMWUEMIQAV-UHFFFAOYSA-N	430.845	1.491	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)c1ccc(N2CCC[C@H](C(N)=O)C2)cc1	1324034113	NFAFRJNBAZBSNY-KRWDZBQOSA-N	448.527	1.762	50	20	IDGD	
O=C(NNC(=O)N1Cc2ccc(O)cc2C2(CC2)C1)c1csc(N2CCOCC2)n1	1324278418	ODWZHPIQMCWUCV-UHFFFAOYSA-N	429.502	1.587	50	20	IDGD	
CCOC(=O)COc1ccc(C=NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1	1339964725	KHGCPNUDPMZAIZ-UHFFFAOYSA-N	439.877	1.693	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)nc2ccccc12	1340526351	HETXYYZVHAHQFF-UHFFFAOYSA-N	431.496	1.762	50	20	IDGD	
CC(=O)O[C@H](C(=O)N1CC[C@@]2(CN(C(=O)[C@H](C)CBr)CCO2)C1)C(C)C	1778792332	NSSWZYHCXPMPKQ-XUWXXGDYSA-N	433.343	1.435	50	20	IDGD	
C=C(C)CC(C)(C)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1	1779032629	VSVZDIAEWPZRTQ-QFIPXVFZSA-N	429.521	1.121	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)/C=N/O[C@H]3CCCCO3)C2)C1	1779106318	OAGYJWONUPQRRW-UUVPFUHKSA-N	432.315	1.129	50	20	IDGD	
Cc1nnc(CCC(=O)N2CCO[C@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)s1	1779293853	FGBNQACILJYJRD-SFHVURJKSA-N	426.615	1.461	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cn(C)nc3C(F)(F)F)C2)C1	1779544845	VXCYLEYFAYCWPO-BLLLJJGKSA-N	438.834	1.136	50	20	IDGD	
COc1cccc(OC)c1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1780541621	ANJJNKRHAUGMIJ-YJBOKZPZSA-N	445.285	1.838	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Cl)C2)[C@H]1CC[C@@H]2CCC(=O)N2C1	1780612175	VMXLOZASOSKPRO-JEWUNAPFSA-N	429.920	1.436	50	20	IDGD	
Cc1nnsc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Br)C1	1780773910	ZEQMVHQGLHBHFN-IXPVHAAZSA-N	435.319	1.665	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)CNC(=O)c3cccs3)CCO2)C1	1781225253	UTVRRRHXPSATPD-ROUUACIJSA-N	448.372	1.544	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)C(=O)Nc3cccnc3)CCO2)C1	1781229782	JLFLZCMGYXCVDM-QZTJIDSGSA-N	429.304	1.086	50	20	IDGD	
O=C(C#CC1(O)CCCCC1)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781331582	NHQGCXUQLAHWAA-MAUKXSAKSA-N	431.302	1.205	50	20	IDGD	
N#Cc1ccc(F)c(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)c1	1781331919	BGCOKXLWPYHOOT-PBHICJAKSA-N	428.233	1.831	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2)c1ccc2occc2c1O	1781336777	RHKWZBROXPCTBK-LUQKVYGDSA-N	436.892	1.866	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc([N+](=O)[O-])cc3F)C2)C1	1781554785	HAFBCPNPXMCVQT-PIGZYNQJSA-N	444.257	1.961	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)ncn1)C2	1781901574	RADLBRGRTAIVOZ-RVZJWNSFSA-N	441.326	1.483	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cn1nc(C)cc1C)C2	1782171314	ZQMGKHKJKKFNOG-SQGPQFPESA-N	426.945	1.268	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@](C)(O)C(F)(F)F)C2	1782172034	LQAXKEBLXCNHJT-CZPYZCIJSA-N	430.851	1.067	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCc1ccc(O)nn1)C2)C(Cl)Cl	1782221523	YBTDUQZCWMUXGY-FZKQIMNGSA-N	431.320	1.432	50	20	IDGD	
Cc1cc(F)cc(CC(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](O)CCl)C3)c1	1782279568	BATKHIZTSLDKHQ-WAOWUJCRSA-N	426.916	1.790	50	20	IDGD	
C[C@@H](CC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2)c1ccccc1	1783280588	OPOQXIPUIUAYOL-MHECFPHRSA-N	436.317	1.004	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccc4nccn4c3)CCO2)C1	1783347134	ACFQCORSYXBCMV-HNAYVOBHSA-N	435.322	1.951	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](C)Br)C3)C2)ncc1[N+](=O)[O-]	1783533967	CGIILLAKWVHKGF-SJCJKPOMSA-N	441.282	1.525	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cnnc4ccccc34)CCO2)C1	1783534571	LRKGVHMUFWDCRI-YJYMSZOUSA-N	433.306	1.857	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc4cc(O)ccc4n3)CCO2)C1	1783874273	FXUWOMPJIJYOPO-HRAATJIYSA-N	433.892	1.638	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(C(F)(F)F)nc3)CCO2)C1	1783877154	VQRIUJGJXHHTJD-CXAGYDPISA-N	435.830	1.798	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cn(C)nc3C(F)(F)F)CCO2)C1	1783877901	RKLFMPANGGWJFE-WBMJQRKESA-N	438.834	1.136	50	20	IDGD	
CCOC(=O)c1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](Cl)COC)C3)C2)cc1	1783879722	AEEHEDQINMKLCY-UTKZUKDTSA-N	438.908	1.561	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)COCc3ccc(OC)cc3)C2)C1	1784098350	IZXPQGHNMKBUDN-NQIIRXRSSA-N	440.924	1.296	50	20	IDGD	
C[C@H](Cc1ccccn1)C(=O)N1CC[C@@]2(CN(C(=O)[C@@H](F)Br)CCO2)C1	1784287621	XNLUJFLBVLNAEC-SIIHOXLZSA-N	428.302	1.781	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3ccnc(OC)c3)[C@H]2C1	1785104804	DAZLTFKZIVQSOZ-XSLAGTTESA-N	439.940	1.256	50	20	IDGD	
Cc1ccncc1CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21	1785321061	CZCPSMGFYQAQLC-NBOOPKSLSA-N	442.329	1.993	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]3C2)c(O)c1OC	1787449938	PAOWFVKDNIIRRM-ZIYPJXPISA-N	430.860	1.537	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1)C(=O)c1ccccc1	1787629692	UOFIOTOTOZZUAG-UHFFFAOYSA-N	442.280	1.997	50	20	IDGD	
Cn1ncc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]32)c1Cl	1789083840	BIFJUNQAFIAZLP-PYERRIOISA-N	437.755	1.903	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CC34CCCN3CCC4)[C@H]2C1	1789823058	QEFIWRWDKSTMLC-XSLAGTTESA-N	427.973	1.238	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc4ccccc4n3)C[C@@H]21	1791254947	XIFRFXMRSOPSPX-ZTENYAIWSA-N	432.908	1.477	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1ccc(C2(NC(=O)CCSC(=N)N)CCC2)cc1	1791600230	VEJUMNGKOCRWAN-UHFFFAOYSA-N	434.566	1.510	50	20	IDGD	
Cc1ccccc1-c1ncccc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](O)CCl	1792976278	BNKGXEUHUQVCRT-JSJNYSNDSA-N	443.931	1.860	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCl)c1cccc(OCC(F)(F)F)n1	1793111001	VYKAPCIGSNQUAW-OPDFLTKYSA-N	435.830	1.874	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1C[C@@]13C(=O)Nc1ccccc13)C2	1793452725	HVLVGUSOXISVGX-OORABABHSA-N	445.947	1.894	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(N(C)C)cn1	1794462435	LRKQGJFLIRDSGS-NFFDBFGFSA-N	425.327	1.134	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)c1cc2cccnc2s1	1796189115	XPTHTNHNPNESLA-BCDXTJNWSA-N	435.314	1.542	50	20	IDGD	
COc1cccc(Cl)c1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1	1796192383	GAOXCDWHRJZHRV-BJWYYQGGSA-N	442.708	1.594	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)c1cc2cccc(F)c2s1	1796929378	MAKINSSBTDBJMW-LMWOUKEDSA-N	426.897	1.843	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnn(Cc2ccccc2)c1	1798150760	VILXSQUYPWWWAK-YRPNKDGESA-N	446.935	1.388	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1(C(F)(F)F)CCC1)C2	1798439272	UBEAKAHVSKRRNI-CLLJXQQHSA-N	439.438	1.670	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(=O)nc2cccnn12)[C@@H](F)Br	1799189165	HWHRNCIEQSBQOO-JNIYBQFBSA-N	438.257	1.032	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cn(C)cc1C(F)(F)F)C2	1800978232	OVWOESHTNFLVFT-JLUCKKNBSA-N	437.846	1.501	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(C(=O)OC)cc1C)C2	1800983276	VKYIVIZWRAQSIE-CYGHRXIMSA-N	438.908	1.239	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C[C@H]1CNc3ccccc3O1)C2)C(Cl)Cl	1801016884	ASEPJKCSYPGZRH-LKQDWFRTSA-N	428.316	1.643	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)Oc1ccccn1	1801368756	IMCHPUONTBKRAJ-LFYQSXPISA-N	440.338	1.612	50	20	IDGD	
Nc1ccccc1/C=C/C(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]1c1cccnc1	1803138908	PJPCSMUSBBXNEI-QKCAPUDGSA-N	428.920	1.983	50	20	IDGD	
COc1ncc(C(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)cc1F	1803140180	BCYHWAMIKPFBHQ-XOKHGSTOSA-N	436.871	1.544	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)N1CC[C@H](CNC(=O)CCBr)[C@H]1c1cccnc1	1806340585	GRSPDHBFUNMART-IJEWVQPXSA-N	440.342	1.319	50	20	IDGD	
O=C(CCBr)NC[C@@H]1CCN(C(=O)COc2cccnn2)[C@H]1c1cccnc1	1806347107	SXJCTPZIQDNVLY-KXBFYZLASA-N	448.321	1.741	50	20	IDGD	
O=C(O)CSCC(=O)N1CC[C@H](CNC(=O)CCBr)[C@H]1c1cccnc1	1806347392	WUFAAFIRIDYONA-CXAGYDPISA-N	444.351	1.690	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H]2CC=CCC2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1	1807367108	XGUFMDRFYGLXLO-PIPMEXSNSA-N	433.317	1.437	50	20	IDGD	
Cc1ccc(O)c(C(=O)N2CCC3(CCCN(C(=O)c4ccc(B(O)O)cc4)C3)CC2)c1	1809969280	BQDDCJBQWOBUCQ-UHFFFAOYSA-N	436.317	1.539	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)/C=C\C(=O)NC2CC2)[C@H]1c1cccnc1	1810137523	XCWYVOICPIKPRN-DVOQEUAYSA-N	449.349	1.706	50	20	IDGD	
C#CCCCC(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1	1810305941	QXNLRMVISFTKNX-DYESRHJHSA-N	434.500	1.203	50	20	IDGD	
CCC[C@H](NC(C)=O)C(=O)NC[C@@H]1CCN(C(=O)[C@H](Cl)COC)[C@@H]1c1cccnc1	1814132144	SZUBTGAODXXZER-ZSYWTGECSA-N	438.956	1.646	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)Cc2cnc3ccccn23)[nH]n1)[C@@H](O)CCl	1814863738	BDULPYUNQNRBAZ-CVEARBPZSA-N	430.896	1.892	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(-n3cncn3)c2)[nH]n1)[C@@H](O)CCl	1814871731	CHUYHAORONPFOC-IRXDYDNUSA-N	443.895	1.896	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(F)cc1)CC2)c1cccc(B(O)O)c1	1815360213	BTSOVAQOKJLLGL-INIZCTEOSA-N	439.277	1.502	50	20	IDGD	
COc1cnc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)[C@@H](O)CCl)[nH]n2)c(F)c1	1816212526	SKJKATNLTLRBPQ-KGLIPLIRSA-N	425.848	1.858	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnoc1)CC2	1817279745	BGSSQQLCMYMZKA-LPUHGPTISA-N	441.473	1.491	50	20	IDGD	
CO[C@H](C)C(=O)N[C@H]1CCc2nc(NC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)sc2C1	1817283023	QFEGUCPQFTWZED-TUECAUIESA-N	432.506	1.224	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)Cc2ccncc2)[nH]n1)c1cccc(B(O)O)c1	1817476674	NHSSBRGJFOJUHQ-IBGZPJMESA-N	433.277	1.033	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)CCC(F)(F)F)CC1	1826668414	HAVYSHASHJWMPN-GOSISDBHSA-N	440.271	1.942	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@H]2CCC=CO2)CC1	1828896537	WRGWJXXXXSLREK-WOJBJXKFSA-N	441.532	1.611	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(C4CC4)on3)CCO2)C1	1830201309	YELVUOMRPWZENA-KPZWWZAWSA-N	442.310	1.405	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H](C)Cn2cncn2)CC1	1831830796	ILAMAGBEIDQZKL-SZMVWBNQSA-N	425.961	1.788	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccnc(F)c3)CCO2)C1	1831905042	OTHCXRVSAKASKV-ROUUACIJSA-N	434.295	1.527	50	20	IDGD	
O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)c1sccc1F)CCO2	1831914268	ZPXRWYFSWJQZDC-INIZCTEOSA-N	435.315	1.742	50	20	IDGD	
C[C@@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)Cn3ccnc3)CC2)CC1	1833261978	GIZNNSRUGNJBRC-HNNXBMFYSA-N	440.386	1.486	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)Cc3cccnc3Cl)CC2)CC1)[C@@H](O)CCl	1833308270	NYXHBWMQNZOYDM-KRWDZBQOSA-N	443.375	1.449	50	20	IDGD	
Cc1c(F)cccc1C(=O)N1CCOC[C@]2(CN(C(=O)CCBr)CCO2)C1	1834819142	HDAQEHXEMDBLFO-IBGZPJMESA-N	443.313	1.989	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)c3ccc(Cl)o3)C2)C1	1834821795	YTQZTSDSWJQVCG-MRXNPFEDSA-N	435.702	1.788	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)c3ccc(Cl)cn3)C2)C1	1834823084	HZRMJJHFCGTEHD-QGZVFWFLSA-N	446.729	1.590	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)CCC(=O)N3CCCC3)CC2)CC1)[C@H](F)Cl	1835078946	GJCVAAVHKAJXJZ-IBGZPJMESA-N	430.952	1.495	50	20	IDGD	
Cc1nnsc1C(=O)NC1CCN(C2CCN(C(=O)CO[Si](C)(C)C)CC2)CC1	1835182998	OOBNYPGNFAUCFJ-UHFFFAOYSA-N	439.658	1.883	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC(OC2CCN(C(=O)Cc3cc[nH]n3)CC2)CC1	1836674128	ODYJXUXWAMIEJK-CQSZACIVSA-N	441.370	1.982	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4ncoc4c3)C2)C1	1837712995	CCUYEVQTIXVPSS-OAQYLSRUSA-N	447.564	1.749	50	20	IDGD	
O=C(c1cnc(O)[nH]1)N1CCC(OC2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1838477338	QAFCLGUGQLOWLN-CYBMUJFWSA-N	433.278	1.418	50	20	IDGD	
O=C(c1cccc(-c2cnccn2)c1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1838592230	XBUBOSXJZMJLOW-NQIIRXRSSA-N	448.882	1.748	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(C#N)c[nH]3)CCO2)C1	1838740186	HCUHCWBXOHXPJF-KDOFPFPSSA-N	439.310	1.130	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(C(C)(C)C)n[nH]3)C2)C1	1839145435	HPMKWSSRTMYMEN-VBKZILBWSA-N	426.945	1.795	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnn4cc(C)cnc34)C2)C1	1839146352	XKMRGADFUSHRHZ-OXQOHEQNSA-N	435.912	1.125	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)/C=C/c3cccnc3)C2)C1	1839150741	WHKMSHMCFDDFBT-UHDDOPSISA-N	442.343	1.788	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3CCCCN3C)C2)C1	1839961871	LQOWFKDNTUNWQT-GPMSIDNRSA-N	446.386	1.101	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(C4CC4)on3)C2)C1	1840030349	JINWJOZCLHWKLX-KPZWWZAWSA-N	442.310	1.405	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CSC3CCCC3)C2)C1	1840030682	SUJKPZBRBGEMCE-KDOFPFPSSA-N	449.411	1.902	50	20	IDGD	
O=C(c1cccc2c1CCCC2)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1	1840719605	CUDRQTHCXQJNAG-KNQAVFIVSA-N	436.936	1.235	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(NC(C)=O)cc3)CCO2)C1	1840727400	FDJKYLFWHTVHET-NQIIRXRSSA-N	437.924	1.732	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H]1CC(=O)N1CCCC12CN(C(=O)[C@H](O)CCl)C2	1841777161	ZENMSCUFWJGCEC-LSDHHAIUSA-N	429.945	1.579	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)c2cc3c(F)cc(F)cc3[nH]2)C1	1843703835	BZIGUFVYVRHSKS-UHFFFAOYSA-N	439.227	1.257	50	20	IDGD	
Cc1cc(C(N)=O)cc(C)c1C(=O)N1CCCC12CN(C(=O)[C@H](F)Br)C2	1844255445	DALSZVSMEYIVBM-AWEZNQCLSA-N	426.286	1.910	50	20	IDGD	
Cn1c(=O)n(C)c2cc(C(=O)N3CC4(CCCN4C(=O)CO[Si](C)(C)C)C3)ccc21	1844378197	QONGSUOEQDFMHM-UHFFFAOYSA-N	430.581	1.546	50	20	IDGD	
C#CCCC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)[C@H](O)CCl)C2	1845131528	LPQKWBULIYGUBI-HZPDHXFCSA-N	441.956	1.486	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)C1CCN(c3cc(OC)ncn3)CC1)C2	1845163420	WHVBSMFZJLHJLO-INIZCTEOSA-N	435.956	1.922	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@H]2[C@@H](O)CCN2Cc2ccccc2)C1	1845836995	ASMZMLANMXLRPV-FHWLQOOXSA-N	435.952	1.079	50	20	IDGD	
COC(=O)c1ccc(OCC(=O)N2CC3(CCCN3C(=O)[C@H](C)Br)C2)cc1	1846180217	UEHCRURLQSGHOD-ZDUSSCGKSA-N	439.306	1.839	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)[C@@H]1Oc2ccccc2O[C@H]1C	10948615	RIXARGIGHGCMMD-BBATYDOGSA-N	434.832	1.881	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1	15525069	RUCVFCHHNHRCHB-UHFFFAOYSA-N	433.486	1.181	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCOCC2)cc1C(=O)NNc1ccccc1[N+](=O)[O-]	15631799	WZGGIXNKIBOANM-UHFFFAOYSA-N	436.446	1.381	50	20	IDGD	
CS(=O)(=O)NCCc1ccc(C(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)s1	17159107	NJNYIVVRENYTNP-UHFFFAOYSA-N	425.576	1.817	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2ccc3ccccc3c2O)cc1	17406738	HJZQYVOHOFNBAZ-UHFFFAOYSA-N	427.482	1.936	50	20	IDGD	
O=C(NNC(=O)[C@H](c1ccccc1)N1CCCCC1=O)c1csc(N2CCOCC2)n1	110946869	BMTPKZWLXVGWNL-SFHVURJKSA-N	443.529	1.495	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)NCc2ccc([C@@]3(C)NC(=O)NC3=O)cc2)c2ccccc2n1	726283423	ZNVZLSMNKIHISN-HSZRJFAPSA-N	446.467	1.742	50	20	IDGD	
COc1ccc(-c2nn(CCC#N)cc2/C=C(\C#N)C(=O)N[C@@H]2CC(=O)N(C)C2)cc1OC	726537029	IVPGYNUJMOWQJY-QJKHOBJASA-N	448.483	1.735	50	20	IDGD	
O=C(CCCNC(=O)OCc1ccccc1)NNC(=O)C1CCN(c2ncccn2)CC1	728846114	RXGMDTRYBZJUAQ-UHFFFAOYSA-N	440.504	1.547	50	20	IDGD	
CCCCNC(=O)[C@H]1CCCN(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)C1	728961656	KGZABNMJLANWLN-KRWDZBQOSA-N	431.541	1.062	50	20	IDGD	
Nn1c(COc2ccccc2)nnc1SCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	729032264	AUDQBTPCXHXUBX-UHFFFAOYSA-N	443.445	1.032	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)CCc2c(C)nc3[nH]n(C)c(=O)c3c2C)cc1	729516681	XEOMMBRPGOOGBB-UHFFFAOYSA-N	426.477	1.079	50	20	IDGD	
COC(=O)CCOc1ccc(S(=O)(=O)NNC(=O)Cn2ccc3ccccc32)cc1	729667054	FGLAKXNVVHWWQE-UHFFFAOYSA-N	431.470	1.593	50	20	IDGD	
COc1ccc(S(=O)(=O)NCCC(=O)NN=c2cc[nH]c3ccccc23)cc1OC	730289406	UBLFKIJOZNWBKR-UHFFFAOYSA-N	430.486	1.486	50	20	IDGD	
O=C(CSc1nnc(O)nc1O)NN=Cc1c(-c2ccccc2)nc2sccn12	730559519	FFXJBSYFYIQELC-UHFFFAOYSA-N	427.471	1.901	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CC[C@@H]2NC(=O)N(c3ccc(Cl)cc3)C2=O)c1	730752921	VMLMCLIZIYIACT-INIZCTEOSA-N	425.832	1.878	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2nn(-c3ccc(F)cc3)ccc2=O)c2ccccc2c1=O	731593888	FFBZKGWXJRBXNH-UHFFFAOYSA-N	448.414	1.176	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)C[C@H](C)O1	732261365	CGPDOEOARMOTLP-STQMWFEESA-N	433.490	1.979	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)N(C)Cc1ccccc1	732470316	YMGKGJVXILWLFO-MRXNPFEDSA-N	447.561	1.401	50	20	IDGD	
N#CCCNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1	733110686	OBZKOEWWQGNDPE-UHFFFAOYSA-N	438.469	1.139	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NC[C@H]2CCCN2Cc2ccccc2)c2ccccc2c1=O	734217893	NRJMFUMOLNTSPK-QGZVFWFLSA-N	434.500	1.542	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)c1cccc(NC(=O)[C@@H]2CCCO2)c1	734241541	PRJGIYCOQGAKEF-HNNXBMFYSA-N	435.481	1.273	50	20	IDGD	
CCCCn1c(CCC(=O)NNc2cnccn2)nc2cc(S(=O)(=O)N(C)C)ccc21	734244524	LTYLYGSMAXOHDC-UHFFFAOYSA-N	445.549	1.953	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)CC(=O)NNC(=O)c2cccc3ncccc23)cc1F	734812929	MYPOVXBZPLMQGF-UHFFFAOYSA-N	429.429	1.811	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)c2cnn(-c3ccccc3)n2)CC1	734822406	UXWCIWGNTVDMIH-UHFFFAOYSA-N	429.481	1.611	50	20	IDGD	
CC(C)(CNC(=O)NNC(=O)c1ccc[nH]1)S(=O)(=O)c1ccc(Br)cc1	735761975	BEVLZNMAOWTZEX-UHFFFAOYSA-N	443.323	1.974	50	20	IDGD	
Cc1cc(NNC(=O)[C@H]2CCCN(S(=O)(=O)c3ccc([N+](=O)[O-])cc3)C2)nc(C)n1	736710837	WVJQOVBZFLEKNM-AWEZNQCLSA-N	434.478	1.546	50	20	IDGD	
Cc1c(Cl)cccc1OCC(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	736905327	HTTRGCMWXYHEPM-QGZVFWFLSA-N	434.832	1.558	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C[C@H]2CN(Cc3ccccc3)CCO2)c2ccccc2c1=O	740748834	AFBIWAQQHZJADX-SFHVURJKSA-N	449.511	1.469	50	20	IDGD	
CS(=O)(=O)CC[C@@H](Cc1cccc(Br)c1)C(=O)NNC(=O)NC1CC1	741211055	BAYBTBFXPKSKKH-LBPRGKRZSA-N	432.340	1.535	50	20	IDGD	
COc1ccc(C=NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1C#N	741759132	GQBUOXFQWAUHLS-UHFFFAOYSA-N	428.470	1.352	50	20	IDGD	
O=C(CCNS(=O)(=O)c1cccnc1)NNC(=O)NCc1cccc(C(F)(F)F)c1	742453087	MPBIKCQQXYAQJK-UHFFFAOYSA-N	445.423	1.299	50	20	IDGD	
C[C@H](CC(=O)NNC(=O)c1cccc2ncccc12)/N=C1/NS(=O)(=O)c2ccccc21	742646886	VCXHHLSWIQIOGY-CYBMUJFWSA-N	437.481	1.513	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)N[C@@H]2CCN(Cc3ccccc3)C2=O)cc1	744878514	ZCHMUIRNKMLRLB-OXQOHEQNSA-N	440.500	1.984	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNS(=O)(=O)c2ccc(C)c(C(=O)OC)c2)cc1	745976669	JANHAVVCUDFRJE-AWEZNQCLSA-N	436.486	1.957	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@H](C(=O)NNC(=O)Cc2cn3ccccc3n2)C(C)C)cc1	746641629	QQCVRVQLHQSJNS-FQEVSTJZSA-N	443.529	1.336	50	20	IDGD	
Cc1ccc([C@@H](CNC(=O)NNC(=O)Cc2cn3ccccc3n2)N2CCOCC2)o1	746739970	FVZSRSLGNADPGF-QGZVFWFLSA-N	426.477	1.182	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)Cc2ccc(C(=O)NNC(=O)c3ccon3)cc2)cc1	747144445	FGHTWTVBZMOAKV-UHFFFAOYSA-N	428.470	1.879	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)CS(=O)(=O)Cc1cccc(Br)c1	747324897	QCUZVUYCEXCLNA-UHFFFAOYSA-N	426.292	1.149	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc2c(c1)COC2)NNc1ccc(Br)cc1	748079985	IKGYMLLDTGNXFQ-UHFFFAOYSA-N	426.292	1.901	50	20	IDGD	
COc1ccccc1NC(=S)NNC(=O)CNC(=O)NCc1ccc([N+](=O)[O-])cc1	748360778	UWWAVDQWVXJYBS-UHFFFAOYSA-N	432.462	1.420	50	20	IDGD	
C[C@]1(c2ccc(C(=O)NNC(=O)CCSc3ccc(F)cc3)cc2)NC(=O)NC1=O	748517351	WBGVTVSAAVCDSX-HXUWFJFHSA-N	430.461	1.824	50	20	IDGD	
COc1ccccc1N1CC[C@@H](CNC(=O)NNC(=O)c2ccc3c(c2)OCCO3)C1	749929958	AEFXQXOWSXAGOQ-HNNXBMFYSA-N	426.473	1.937	50	20	IDGD	
O=C(NCC(=O)N1CCN(c2ccc(Cl)cc2)CC1)NNC(=O)c1ccccc1F	750334461	BRODWMFVRZROTG-UHFFFAOYSA-N	433.871	1.772	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)c2cn(-c3ccc(C(F)(F)F)cn3)nn2)nc2ccccc21	751289376	CJYKABQOPSEXAO-UHFFFAOYSA-N	444.377	1.572	50	20	IDGD	
N#Cc1ccc(NNC(=O)c2cc(S(N)(=O)=O)ccc2N2CCOCC2)cc1Cl	753303678	NIPJQLSLALYWPG-UHFFFAOYSA-N	435.893	1.453	50	20	IDGD	
O=C(COc1ccc(OCc2ccccc2)cc1)NNC(=O)[C@@H]1CCCCS1(=O)=O	753614551	UQDXGSYGSAEHFI-IBGZPJMESA-N	432.498	1.759	50	20	IDGD	
N#Cc1ccc(CN2CC[C@H](NC(=O)NNC(=O)Cc3c[nH]c4ccccc34)C2=O)cc1	753722818	LAPADXIFQMWSKY-FQEVSTJZSA-N	430.468	1.714	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])c[nH]1)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	754802412	ZEXIHYGGBGVDSD-UHFFFAOYSA-N	432.400	1.700	50	20	IDGD	
O=C(CN1CCOCC1)Nc1ccc(NC(=O)NNC(=O)c2ccc3c(c2)OCO3)cc1	755600750	VKZHGLIJFVSXSF-UHFFFAOYSA-N	441.444	1.153	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)N[C@@H]2CCN(c3c(F)cccc3F)C2=O)cc1	756212873	SLQAIXJCIWINJU-MRXNPFEDSA-N	434.399	1.488	50	20	IDGD	
O=C(CCc1ccccc1)NNC(=O)Nc1ccc(N2CCN(C(=O)C3CC3)CC2)nc1	756296183	XDIAAYQPYCRFJG-UHFFFAOYSA-N	436.516	1.926	50	20	IDGD	
C[C@H](c1cccc(NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c1)N1CCOCC1	756420327	IQDMSHYJHCRXCN-OAHLLOKOSA-N	446.529	1.950	50	20	IDGD	
O=C(COC(=O)c1ncccc1OCC(F)(F)F)NNC(=O)c1cccc([N+](=O)[O-])c1	756465115	SGXDKIUITWECDV-UHFFFAOYSA-N	442.306	1.549	50	20	IDGD	
CCCS(=O)(=O)Nc1ccc(NC(=O)NNC(=O)c2cncc(NC(C)=O)c2)cc1	756571687	JDGWQBRKQHFUIW-UHFFFAOYSA-N	434.478	1.658	50	20	IDGD	
CCc1c(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cnn1CCC(C)C	756797884	TWEIOBMUGFNPLJ-UHFFFAOYSA-N	441.941	1.867	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)ncn1	757759397	ZNRMGHVGGMCKNI-UHFFFAOYSA-N	434.478	1.126	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCC(=O)NNc1nc(O)c2ccccc2n1	758325054	NGVPNJYSRZFGQK-CQSZACIVSA-N	430.465	1.294	50	20	IDGD	
C[C@@H](O)C[C@@H](CNC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)c1ccccc1	759610940	MWEAVGGZSLHMAI-ZBFHGGJFSA-N	434.518	1.981	50	20	IDGD	
CCOC(=O)c1cc(S(=O)(=O)NNC(=O)c2cc(F)ccc2Br)cn1C	760515754	MEHOJYDNQXEGPQ-UHFFFAOYSA-N	448.270	1.727	50	20	IDGD	
COc1cc(Br)cc(S(=O)(=O)NNC(=O)COc2ccccc2O)c1	760559937	HFTQCEPYADXAJX-UHFFFAOYSA-N	431.264	1.552	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)c1ccc(I)c(O)c1	760888350	UBWVYRYGITXJNN-UHFFFAOYSA-N	426.210	1.975	50	20	IDGD	
CCNS(=O)(=O)c1ccc(C)c(C(=O)NNC(=O)CSc2ccccc2OC)c1	762349202	FUMQBRHNUJYYEZ-UHFFFAOYSA-N	437.543	1.855	50	20	IDGD	
O=C(NNc1nccc(N2CCOCC2)n1)c1ccc(OCC(F)(F)C(F)F)nc1	762865656	KBKOYOUQJCLDBM-UHFFFAOYSA-N	430.362	1.744	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c(OC[C@H]2CCCO2)c1	763468992	ZKIXQWUUWZOBNT-MRXNPFEDSA-N	442.428	1.861	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2F)cc1N1CCCS1(=O)=O	763557214	XXAHTKNGENPQNR-UHFFFAOYSA-N	434.449	1.074	50	20	IDGD	
C[C@H](C(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2ccccc2F)c1)n1cccn1	763561383	ISAPJZJIJWRQEH-CYBMUJFWSA-N	438.419	1.622	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1ccnn1CCc1ccccc1	763628282	IIPNIDNNHKVQDH-UHFFFAOYSA-N	431.456	1.482	50	20	IDGD	
Cc1cnn(-c2ccc(NC(=O)C(=O)NNC(=O)c3c(C)nc4ccccn34)cc2F)c1	763629075	OERWFMPTVKMADI-UHFFFAOYSA-N	435.419	1.676	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2nc(-c3nccn3C)cs2)c1	763648906	GYLXNTUOYXOUAU-UHFFFAOYSA-N	428.474	1.325	50	20	IDGD	
O=C(COc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1ccn(Cc2ccccn2)n1	763684294	IYHAZFJPQCZIQS-UHFFFAOYSA-N	428.836	1.145	50	20	IDGD	
CCCc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1	763718858	OZTNBRZXJVAGMT-UHFFFAOYSA-N	432.502	1.289	50	20	IDGD	
COc1ccc(C(=O)N2CCCC2)cc1NC(=O)C(=O)NNC(=O)c1cccc(Cl)c1	763748400	ZQPALYVVAJSMEB-UHFFFAOYSA-N	444.875	1.984	50	20	IDGD	
CCCOc1ccc(NC(=O)C(=O)NNC(=O)c2nn(CC)c(=O)c3ccccc23)cc1	763785683	KZIHRMKCQMRZMT-UHFFFAOYSA-N	437.456	1.605	50	20	IDGD	
CCOC(=O)/C=C/c1ccc(NC(=O)C(=O)NNC(=O)c2nnc(O)c3ccccc23)cc1	763789727	AFIOZYSJPIKTHX-FMIVXFBMSA-N	449.423	1.311	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(CS(=O)(=O)C(C)C)c2)cc1	763829681	FAIYAABPHBMYQT-UHFFFAOYSA-N	431.514	1.972	50	20	IDGD	
Cc1ccc(S(C)(=O)=O)cc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccc(F)cc1	763872256	LUMMDHYMOKYCRD-GFCCVEGCSA-N	437.449	1.091	50	20	IDGD	
CCc1ncc(NC(=O)C(=O)NNC(=O)c2ccc(OCCC(C)C)c(OC)c2)cn1	763914080	LARUEBLKJRYDMK-UHFFFAOYSA-N	429.477	1.872	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(-n3nnnc3C(C)C)c(C)c2)c(O)c1	764109171	HXKYPBPDNCEZNI-UHFFFAOYSA-N	437.460	1.508	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1cccc(OCc2cccnc2)c1	764130985	BZHQGMNLPUVARY-UHFFFAOYSA-N	434.452	1.998	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccc(N2CCOC[C@H]2C)cc1	764132215	LTWXUQJEIAIXMJ-OAHLLOKOSA-N	426.473	1.249	50	20	IDGD	
CS(=O)(=O)c1c(F)cc(NC(=O)C(=O)NNC(=O)CCCc2ccccc2)cc1F	764225120	YHUPIEWKHFKUMN-UHFFFAOYSA-N	439.440	1.477	50	20	IDGD	
CCc1noc(C)c1NC(=O)C(=O)NNC(=O)c1cc(OC)ccc1Br	764230621	CMPUETATELQEHI-UHFFFAOYSA-N	425.239	1.716	50	20	IDGD	
CCc1cc(Br)ccc1NC(=O)C(=O)NNC(=O)COc1ccccc1O	764279980	JWHYDGDAQORTRC-UHFFFAOYSA-N	436.262	1.882	50	20	IDGD	
COC(=O)c1cc(Br)ccc1NC(=O)C(=O)NNC(=O)c1ncccc1C	764385590	CWUOWGNNIRMYLV-UHFFFAOYSA-N	435.234	1.339	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1ccccc1-c1noc(C)n1	764393629	SAKMRUUFRBIDFW-UHFFFAOYSA-N	441.469	1.932	50	20	IDGD	
CC(=NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1)c1ccc(N)cc1	764818982	YGZOLHLEICMDNX-UHFFFAOYSA-N	429.546	1.424	50	20	IDGD	
CC(C)(C)OC(=O)NNC(=O)C(=O)Nc1cnc2c(c1)C[C@H](NC(=O)OC(C)(C)C)CC2	765389572	IUBZUFBONOGNOX-CYBMUJFWSA-N	449.508	1.958	50	20	IDGD	
C[C@@H](CNC(=O)NNc1ccccc1S(C)(=O)=O)N1CCN(c2ccccc2)CC1	765656880	HNSLBGQYIRMVQR-KRWDZBQOSA-N	431.562	1.927	50	20	IDGD	
C[C@@H](CC(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1)c1cccc(F)c1	765738538	LLHGYPGBIHOFSS-KRWDZBQOSA-N	426.492	1.925	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	765756636	ZZXWWPRTJZIGEL-UHFFFAOYSA-N	434.899	1.823	50	20	IDGD	
CO[C@H](CNC(=O)OC(C)(C)C)CC(=O)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	768133103	RLEKCUKINNBLQC-AWEZNQCLSA-N	435.456	1.907	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2cc(C3CC3)nn2-c2ncccn2)c1	768229244	ALZRJYBLYGLXBG-UHFFFAOYSA-N	449.471	1.321	50	20	IDGD	
CC(C)(O)C(=O)NNC(=O)C1CCN(S(=O)(=O)c2ccccc2C(F)(F)F)CC1	768261006	ZDBHAHHXNJLWHY-UHFFFAOYSA-N	437.440	1.024	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)C3=NN(c4ccccc4)[C@H](C(N)=O)C3)n[nH]2)c1	768265134	UBEYBILTIIWSIA-FQEVSTJZSA-N	445.483	1.575	50	20	IDGD	
COc1ccccc1C(=O)NNS(=O)(=O)c1cc2nc(O)[nH]c2cc1Br	768500663	UZOHLHRVARGQQY-UHFFFAOYSA-N	441.263	1.663	50	20	IDGD	
CCc1ccc(C(=O)NNC(=S)Nc2ccccn2)cc1S(=O)(=O)N1CCOCC1	768584367	MTAWYFFXSMRIOZ-UHFFFAOYSA-N	449.558	1.296	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)CCNS(=O)(=O)c3ccc(C(C)(C)C)cc3)nc21	770971878	BOZAGVBHNIBLOD-UHFFFAOYSA-N	447.521	1.178	50	20	IDGD	
Cc1cccc(F)c1NNC(=O)Nc1cc(C(N)=O)ccc1CN1C(=O)CN(C)C1=O	771175036	KGDVCSDZQSAXRP-UHFFFAOYSA-N	428.424	1.776	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C1=NN(c2ccccc2)[C@H](C(N)=O)C1	772970394	BVMZEROGIHFZGH-SJCJKPOMSA-N	429.864	1.375	50	20	IDGD	
Cc1nc(NC(=O)C(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)ccc1Br	773686053	VIIWIOFITOKOAF-UHFFFAOYSA-N	438.194	1.166	50	20	IDGD	
COc1cc([C@H](C)NCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc(OC)c1OC	774961058	GRPUKZMATJJFFB-LBPRGKRZSA-N	432.433	1.732	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccc(NC(=O)NNc3ccccc3[N+](=O)[O-])c2)CC1	775561852	FUIJLEXLCQRCLM-UHFFFAOYSA-N	434.478	1.680	50	20	IDGD	
CO[C@@H](c1ccccc1F)[C@@H](C)NC(=O)NNC(=O)c1csc(N2CCOCC2)n1	775712560	CZJBMCZATGWUFM-MLGOLLRUSA-N	437.497	1.839	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@@H]1CN(CC(=O)NNC(=O)c2cccc(Cl)c2)CCO1	775850552	NBNCHHQVTTYVEP-OAHLLOKOSA-N	426.901	1.327	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)Nc2ccc(OCCN3C(=O)c4ccccc4C3=O)cc2)n[nH]1	775872522	SMOMCLOXWYYDCD-UHFFFAOYSA-N	448.439	1.860	50	20	IDGD	
CC[C@H](C)Oc1cc(C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)ccn1	777523359	KVEIHFCGRQOXTB-HNNXBMFYSA-N	448.549	1.347	50	20	IDGD	
CCc1ccc(C(=O)NNS(=O)(=O)c2ccc(N3CCOC3=O)c([N+](=O)[O-])c2)cc1	777596825	BNPQGMOXWNBESH-UHFFFAOYSA-N	434.430	1.737	50	20	IDGD	
CN(CC(=O)NNC(=O)CNC(=O)OC(C)(C)C)c1ccc(C(F)(F)F)cc1C=O	778434288	YAEQIRLMJGVJIE-UHFFFAOYSA-N	432.399	1.626	50	20	IDGD	
COC[C@H](C)n1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(C)c(C)c3)[nH]n2)n1	778712772	IECFKWKAMCBWMT-AWEZNQCLSA-N	439.476	1.497	50	20	IDGD	
C[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1NC(=O)NNC(=O)c1nnc(O)c2ccccc12	779715455	ZJVBIAHVHVWPJI-IUODEOHRSA-N	444.492	1.925	50	20	IDGD	
CN(C)[C@H](C(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)c1cccc(Cl)c1	780106363	SRBQJTVAHYGACA-KRWDZBQOSA-N	434.836	1.855	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cn(-c3cccc(Cl)c3)nn2)c1	780156390	NWFAGMUUAXVCBU-UHFFFAOYSA-N	448.892	1.246	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)c1cn(-c2cccc(Cl)c2)nn1	780989813	HFDDWAWMWRSTGC-UHFFFAOYSA-N	433.255	1.652	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)NCc1ccccc1CN1CC[C@@H](O)C1	781783532	YSMJAHOWPRVWLN-GOSISDBHSA-N	428.489	1.171	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)C(=O)Nc2cccc(C(C)(F)F)c2)c2ccccc2c1=O	782121037	PNRLRCDHPLCWBV-UHFFFAOYSA-N	429.383	1.445	50	20	IDGD	
CNS(=O)(=O)c1ccc(C)c(NC(=O)C(=O)NNc2ccc(Br)cc2)c1	783008895	AVHNVZWPJOWMGH-UHFFFAOYSA-N	441.307	1.747	50	20	IDGD	
Cc1ccccc1NC(=O)NNC(=O)C(=O)Nc1ccc(F)c(-n2nnnc2C2CC2)c1	783416795	AKEYCYZYZUDIAX-UHFFFAOYSA-N	438.423	1.779	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)C(=O)Nc1ccc(N2CCCCC2)c(Cl)c1	784001942	GQDFGQPDSQEOFY-UHFFFAOYSA-N	447.879	1.439	50	20	IDGD	
COC(=O)[C@@H]1CN(C(=O)C(=O)NNc2ccc(Br)cn2)c2ccccc2O1	784339068	FQPBCVDWJLDATC-ZDUSSCGKSA-N	435.234	1.254	50	20	IDGD	
O=C(NNc1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(F)c(-n2nnnc2C2CC2)c1	784827707	HWBAWTDWOUZMKH-UHFFFAOYSA-N	426.368	1.669	50	20	IDGD	
O=C(NNc1cc(Cl)ccn1)C(=O)Nc1ccc(F)c(S(=O)(=O)NC2CC2)c1	784861519	LPIJKONOODOGNZ-UHFFFAOYSA-N	427.845	1.397	50	20	IDGD	
O=C(NNc1cc(F)c(F)cc1F)C(=O)Nc1ccc(S(=O)(=O)NC2CC2)cc1	784892164	WILLADBGRZKMHO-UHFFFAOYSA-N	428.392	1.626	50	20	IDGD	
CNS(=O)(=O)c1cc(NC(=O)C(=O)NNc2nc(C(F)(F)F)cs2)ccc1C	785143429	DCKSGTAVNFDMDA-UHFFFAOYSA-N	437.425	1.460	50	20	IDGD	
O=C(CN1CCCN(c2nnc(C(F)(F)F)s2)CC1)NNC(=O)c1ccccc1	786445521	VBPIILOIOREGGR-UHFFFAOYSA-N	428.440	1.530	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)NNC(=O)C1CCN(c2ccc3nncn3n2)CC1	787436330	XDODHSWFJODPEP-UHFFFAOYSA-N	428.884	1.525	50	20	IDGD	
Cc1cc(-n2cccn2)ccc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccccc1F	789584295	GRZATOOTHQWXTJ-CQSZACIVSA-N	425.420	1.873	50	20	IDGD	
COC(=O)c1ccc(/C=C(/C#N)C(=O)c2c(N)n(C)c(=O)n(C)c2=O)c(Br)c1	790587073	PCTYINHAWFDTOR-WDZFZDKYSA-N	447.245	1.005	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(CCC(=O)NNC(=O)NCCc2cccs2)CC1	792084423	JYGDWFIDJDRRGQ-UHFFFAOYSA-N	425.555	1.564	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2ccc(NC(=O)NNc3nc4ccccn4n3)cc2)C[C@H](C)O1	792204775	CJBMEBVXABGBBP-KBPBESRZSA-N	445.505	1.676	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@H]2C[C@]2(C=NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)C1	792928576	QNVZDQNVSRBTJF-SGTLLEGYSA-N	442.925	1.960	50	20	IDGD	
COc1c(NC(=O)C(=O)NNc2cccc(F)c2[N+](=O)[O-])cc(Cl)cc1C(N)=O	793068863	ORKZHNJQIMIWJF-UHFFFAOYSA-N	425.760	1.577	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)N2CCN(S(=O)(=O)c3c(F)cccc3F)CC2)n1	793226640	MDAVNJRKCUSYAF-UHFFFAOYSA-N	439.444	1.029	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)[C@@H](CC(C)C)/N=C2/NS(=O)(=O)c3ccccc32)n1	794079835	CTXYFSDTWCPYEJ-MRXNPFEDSA-N	429.502	1.304	50	20	IDGD	
CC(C)O[C@@H](C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1)c1ccccc1	794180697	OIAXKFSIMSNIDF-MRXNPFEDSA-N	425.894	1.915	50	20	IDGD	
Cc1nn(C(C)C)c(C)c1CC(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	795893766	NQKDBBRAGKHDQL-GOSISDBHSA-N	430.461	1.154	50	20	IDGD	
C[C@H](Oc1ccc(C=O)cc1)C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	796835893	DXMGMOOGGSBHIN-HNNXBMFYSA-N	433.486	1.431	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)Cc2ccncc2)cc(Br)cc1[N+](=O)[O-]	797536249	XQIVSZGRXWYZDN-UHFFFAOYSA-N	436.222	1.389	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N1CC[C@@H](S(C)(=O)=O)C1	799859400	HBBTUNHQEDAFOK-ZWNOBZJWSA-N	434.312	1.076	50	20	IDGD	
COc1cc(C(=O)NNc2cc([N+](=O)[O-])ccc2Br)ccc1OCC(N)=O	800616444	LSPLJXHOXDCTNN-UHFFFAOYSA-N	439.222	1.987	50	20	IDGD	
COc1ccc(C2=NO[C@@H](CNC(=O)NNC(=O)c3ccc4c(c3)OCCO4)C2)cc1F	802350017	QSEOIEGOBFCRFE-CQSZACIVSA-N	444.419	1.743	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN2C(=O)c3cc(F)cc(C)c3S2(=O)=O)cc1C	804918909	YXSUESJOOSDQPE-UHFFFAOYSA-N	439.490	1.672	50	20	IDGD	
COc1ccc(CS(C)(=O)=O)cc1NC(=O)NNC(=O)COc1ccccc1F	806637733	RTOZYIWJVHRBLW-UHFFFAOYSA-N	425.438	1.611	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cccc3c2CNC3=O)c(C)n1-c1ccccc1	806973301	JSMBHZGQKWJXFD-UHFFFAOYSA-N	431.452	1.737	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)c(F)cc1Br	806974620	PLIQGKHTMFBNCJ-UHFFFAOYSA-N	449.236	1.933	50	20	IDGD	
O=C(NNc1ncnc2ccsc12)C(=O)Nc1ccc(F)c(N2CCCNC2=O)c1	806997238	AYAAWLRFRATWMO-UHFFFAOYSA-N	429.437	1.832	50	20	IDGD	
Cc1nc2ccc(NC(=O)C(=O)NNc3ccc([N+](=O)[O-])cc3Br)cn2n1	810389955	OWMLKHOIQIMZKN-UHFFFAOYSA-N	434.210	1.790	50	20	IDGD	
O=C1CNC(=O)c2ccc(C(=O)NNC(=O)c3ccc(F)cc3Br)cc2N1	814330039	JCEMQZUWYZXQAE-UHFFFAOYSA-N	435.209	1.345	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)ccc1-c1ccncc1	815564928	XONIHQVRAWNPNP-HXUWFJFHSA-N	432.436	1.983	50	20	IDGD	
Cc1nc(CC(C)C)c(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)N(C)C)s1	815751659	IPRYICIPFBRMNI-UHFFFAOYSA-N	439.563	1.982	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)c1sccc1S(=O)(=O)N1CCCC1	822564828	WXMXKUWNJGNKTL-AWEZNQCLSA-N	437.499	1.134	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)[C@H](C)N1C(=O)c2ccc(C)cc2C1=O	892277041	NAMGDCFARXIRME-AWEZNQCLSA-N	433.468	1.739	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNS(=O)(=O)c2ccc3c(c2)oc(=O)n3C)cc1	903939316	PFYVFXJZFAFTEM-GFCCVEGCSA-N	435.458	1.307	50	20	IDGD	
O=C(COC(=O)CCc1nnc(-c2ccsc2)o1)NNC(=O)c1cccc([N+](=O)[O-])c1	904227371	BEMRAZRFYLFGMC-UHFFFAOYSA-N	445.413	1.643	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)/C=C\c1ccccc1)C(=O)NNC(=O)c1ccncc1	912769101	XKYDTKSHOLTUMN-QXSWTLKVSA-N	434.543	1.555	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNC(=O)C2=NN(c3ccccc3)[C@@H](C(N)=O)C2)cc1	913081432	PCKIQZJGWVHXJS-HXUWFJFHSA-N	437.500	1.993	50	20	IDGD	
O=C(COc1ccc(C(=O)c2ccccc2)cc1)NNC(=O)c1ccc(-n2cnnn2)cc1	913154123	GSNQNPNKYNKMHF-UHFFFAOYSA-N	442.435	1.733	50	20	IDGD	
C[C@H](NS(=O)(=O)c1cccs1)C(=O)OCC(=O)NNC(=O)c1cccc(Cl)c1	915020583	IYCUBOUNIPXSHD-JTQLQIEISA-N	445.906	1.073	50	20	IDGD	
Cc1oc(C(=O)NNC(=O)Cc2nc3ccccc3n2C)cc1S(=O)(=O)N1CCCC1	916116598	OZVNRQPGBAZMHO-UHFFFAOYSA-N	445.501	1.263	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)NC[C@@H](c1ccc(C)o1)N1CCOCC1	916229671	UIYYUNMIRPGVCS-SFHVURJKSA-N	430.505	1.933	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)NC1CCN(C(=O)c2ccccc2F)CC1	916379883	WQEPXDZOFQOMEI-UHFFFAOYSA-N	429.408	1.983	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Cn2nc(C3CC3)cc(C(F)(F)F)c2=O)cc1OC	917567527	VKCXZTWPGBTVTG-UHFFFAOYSA-N	440.378	1.618	50	20	IDGD	
CC[C@H](NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)c1ccc2c(c1)OCCO2	918132460	FTGWTDLJOPHQFD-INIZCTEOSA-N	437.456	1.800	50	20	IDGD	
Cn1ncc2c(O)nc(CCC(=O)NNC(=O)c3ccc(F)cc3Br)nc21	918341691	WRHFBSXUOKPXMN-UHFFFAOYSA-N	437.229	1.364	50	20	IDGD	
CCS(=O)(=O)N1CCC[C@H](C(=O)NNC(=O)[C@@H](C)Oc2c(C)cc(Cl)cc2C)C1	918551145	NYTOPMIDROYYOW-CABCVRRESA-N	445.969	1.933	50	20	IDGD	
O=C(NNC(=O)N1CCC(C(=O)NCC(F)(F)F)CC1)c1cc(Br)c[nH]1	918778419	DTZWOMJHKAJICF-UHFFFAOYSA-N	440.220	1.522	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)NNC(=O)c2cc(Br)c[nH]2)c1	918778784	OWXASFUOASCPIL-UHFFFAOYSA-N	426.227	1.083	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCCN(C)Cc1ccccc1	919790464	PGUXOLYGCOOCBO-UHFFFAOYSA-N	432.550	1.364	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)[C@@H](CC(N)=O)NC(=O)c2ccccc2Cl)cc1	920011917	CRZAIENBAFZCIU-QGZVFWFLSA-N	446.891	1.103	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2ccc(CN3C(=O)CNC3=O)cc2)cc1OC	920929248	DHPHVGXXFOAUNQ-UHFFFAOYSA-N	427.417	1.222	50	20	IDGD	
O=C(NNC(=O)c1ncoc1[C@@H]1CCCO1)c1ccc(S(=O)(=O)N2CCCC2)cc1	1116072056	WFFHQDVCPHXVLK-HNNXBMFYSA-N	434.474	1.385	50	20	IDGD	
CC(=O)NCCc1ccc(S(=O)(=O)NNC(=O)c2ccc(Br)cc2)cc1	1319160303	DLFIPVSVXINWAK-UHFFFAOYSA-N	440.319	1.751	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)NNC(=O)c1ccc(OC)cc1	1321025062	XGNRCAHPZPXZLV-UHFFFAOYSA-N	436.490	1.811	50	20	IDGD	
CN1CCN(Cc2cccc(CNC(=O)NNC(=O)Cc3nc4ccccc4n3C)c2)CC1	1338475056	DSRQHIHWAWSKNG-UHFFFAOYSA-N	449.559	1.394	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cn4ncccc4n3)C2)C1	1777954565	DLYHLPCQZYBHDW-FZKQIMNGSA-N	436.310	1.346	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](F)Cl)C2)n1	1778024423	YRSPVAMNPMFETG-SIXWZSSISA-N	426.876	1.702	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H]3C[C@@H](O)C3)C2)C1	1778134909	ALTQRQQKFIWDDV-FKRLUAHMSA-N	431.439	1.473	50	20	IDGD	
CC(C)(C)CC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1	1779370983	BIEAPEXFBMSZCV-VGOFRKELSA-N	431.537	1.249	50	20	IDGD	
O=C(c1cc([N+](=O)[O-])cc2c1OCC2)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Cl)CCO2	1780093582	NULOHNFWGHPCFN-QAPCUYQASA-N	427.816	1.508	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)Cc3ccc(OC)cc3C#N)C2)C1	1781176321	IVDBRHUVUBADDH-RXVVDRJESA-N	435.908	1.193	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(=O)oc1)C2	1781900887	XLFGNRVBDVCLTH-QMTMVMCOSA-N	441.322	1.941	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CN2CCCCC2=O)C1	1782100217	KOVRHRMIRXSDPI-IIBYNOLFSA-N	427.973	1.778	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(CCN(C(=O)c3nc4ccc(F)cn4n3)C2)C1	1782569441	SMSYCWYLRFWLFK-KRWDZBQOSA-N	440.273	1.097	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cccc3ccncc13)CCO2	1783937580	VEMUJQOPBFRPEF-QHCPKHFHSA-N	439.516	1.051	50	20	IDGD	
COc1cc(C(=O)N2CCO[C@]3(CCN(C(=O)C(Cl)Cl)C3)C2)c([N+](=O)[O-])cc1O	1783948349	LJNXWNMMCWSUMN-KRWDZBQOSA-N	448.259	1.556	50	20	IDGD	
Cc1nn(C)c(C)c1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]2C1	1783968492	ARNMDHVQNFSOQO-DDWPSWQVSA-N	441.370	1.661	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]2C1	1783974554	PVRPFNHWGYRPJE-HTOAHKCRSA-N	425.751	1.251	50	20	IDGD	
COc1ccc(Cl)c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]3C2)c1	1784095487	JFJGVPKIZLSJQC-WPUCRFQZSA-N	431.316	1.542	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3cccnc3Cl)[C@H]2C1	1785170149	NLILNSPGDGLRDT-JONQDZQNSA-N	430.332	1.511	50	20	IDGD	
COc1ncc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Br)C[C@@H]32)cc1F	1785638803	YLCXNJGHGSBHQQ-DTCNJJKHSA-N	448.264	1.513	50	20	IDGD	
CC(=O)Nc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CO[Si](C)(C)C)C[C@@H]32)ccn1	1787774742	UGVLCCBWOWKUAY-BZSNNMDCSA-N	448.596	1.485	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnn4ccncc34)[C@H]2C1	1788032245	GZAPCHDYIQLHAW-ZVZYQTTQSA-N	431.569	1.174	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)n3ccccc3=O)C[C@@H]21	1791056305	SDFFMDCXUBKEQV-QRJUGERDSA-N	440.338	1.172	50	20	IDGD	
Cc1ccc(C(=O)C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)Br)C[C@@H]32)cc1	1791173962	BLASVICXCDQBJC-IWCQGFGOSA-N	437.334	1.941	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)Nc3nccs3)C[C@@H]21	1791254414	MIGLSYVHDPIUCI-LXFSFDBISA-N	430.958	1.177	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(-c4ccccn4)[nH]n3)C[C@@H]21	1791255067	CXCQYWYUZXSKEM-ZTENYAIWSA-N	447.923	1.319	50	20	IDGD	
C[C@H](Oc1cccnc1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21	1791655296	MTEIMRXABZTXFF-YERCRUGSSA-N	444.301	1.519	50	20	IDGD	
C[C@@H](NC(=O)c1ccccc1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Cl)C[C@@H]21	1792247681	ORGBSYBMOLVUJW-YYESSZKYSA-N	425.888	1.319	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1C[C@H]1c1ccc(F)cc1)c1ccc(B(O)O)cc1	1792910596	YWADVTCRFXBBCC-WIYBCGNWSA-N	436.292	1.561	50	20	IDGD	
COC(=O)[C@H]1CC[C@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CO[Si](C)(C)C)C3)CC1	1793605002	QCCMARRJUWSOOC-CGNOENMKSA-N	440.613	1.407	50	20	IDGD	
COc1cccnc1CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)Br)C2	1794032926	ZURATKFXPWTQFA-FLTUCWPJSA-N	440.338	1.396	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc2[nH]ncc12	1796160588	OBKQBCDMPQNAAY-RBNVPPIJSA-N	435.322	1.940	50	20	IDGD	
Cc1ccc(CCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)s1	1798440662	HLBDPGGTADMZIO-MUJYYYPQSA-N	441.557	1.940	50	20	IDGD	
CCOc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@](C)(Cl)CCl)C3)nn1	1798754044	FESXTNUUKWCHFS-TYYYEBLRSA-N	431.320	1.315	50	20	IDGD	
CCCOc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCC(=O)NN(C)C)C3)cc1	1799009397	RXYRNEGTCJMJFH-OPMZPASUSA-N	446.548	1.052	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c(Br)cnn1C)C2	1799269463	GMFKCGFJDADEJM-LYIQGSDWSA-N	433.734	1.403	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CSc1ncccn1)C2	1799275382	VPTGDQKSJKOGBA-DMVWFOPNSA-N	433.361	1.395	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1(F)CC1	1800360547	MGYKKJMWOKVUHB-FVCICTRLSA-N	435.408	1.225	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnco1)C2)[C@H](Br)Cc1ccccc1	1800435600	KVWUQZUXXZSVCM-KYHPRHEASA-N	448.317	1.884	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c(cnn3C)c1)C2	1800640888	LAYPQDDJQMNRIG-DFGXFYAUSA-N	449.349	1.950	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3ccnn3c1)C2	1800642893	BHFKRLFLPAXCOG-FSDCSDTHSA-N	435.322	1.711	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1COc3ccccc3O1)C2	1800757969	YWDDWZUWTWGXET-HNKZQRQQSA-N	439.306	1.199	50	20	IDGD	
N=C(N)NCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](Br)Cc1ccccc1	1801568412	WXDKIYVHSTTZSO-FZKCQIBNSA-N	436.354	1.114	50	20	IDGD	
CCOc1c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](Cl)COC)cnc2c1cnn2C	1802276640	IGEIAXCKQWOXBG-UMPJEAMMSA-N	449.939	1.873	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H]2CNc3ccccc32)[C@H]1c1cccnc1)[C@H](O)CCl	1803139234	VLBCDUXUFLQQFE-ZSXHRAQDSA-N	428.920	1.896	50	20	IDGD	
CCS(=O)(=O)CC(=O)NC[C@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1	1803511432	BAUFERRYSRRPHE-PBHICJAKSA-N	446.367	1.307	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@@H](CNC(=O)[C@@H]2CNC(=O)O2)[C@@H]1c1cccnc1	1803642872	NYDQKNOYANMQPC-UNQGMJICSA-N	439.310	1.227	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2cccs2)[C@H]1c1cccnc1	1805391596	DKBSFFREFNUAET-OXQOHEQNSA-N	429.546	1.836	50	20	IDGD	
O=C1CCc2ccc(C(=O)N3CCC4(CCCN(C(=O)[C@H](O)CCl)C4)CC3)nc2N1	1805523760	UWLUYBFAZHBODU-MRXNPFEDSA-N	434.924	1.411	50	20	IDGD	
COC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)Br)[C@@H]1c1cccnc1	1806380893	PSQFZRVGCDCUTR-HACGYAERSA-N	426.311	1.824	50	20	IDGD	
COCCOCC(=O)NC[C@@H]1CCN(C(=O)[C@H](C)Br)[C@@H]1c1cccnc1	1806761691	KLSKMPLAOMKYNV-JLJPHGGASA-N	428.327	1.534	50	20	IDGD	
CS(=O)(=O)c1cncc(C(=O)N2CCCC3(CCN(C(=O)[C@H](F)Cl)CC3)C2)c1	1807479536	WLHYUBVYSXZROS-HNNXBMFYSA-N	431.917	1.864	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC2(CCCN(C(=O)c3coc(Cl)n3)C2)CC1	1807626121	VAXYOFQNAPIEDL-UHFFFAOYSA-N	431.685	1.166	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2[nH]nc3ncccc23)[C@@H]1c1cccnc1	1808116048	BCWHOIWDGYQLIY-ZVZYQTTQSA-N	442.907	1.926	50	20	IDGD	
Cc1nn[nH]c1C(=O)N1CC[C@H](CNC(=O)[C@@H](F)Br)[C@@H]1c1cccnc1	1808662754	QYKBGFXKPJTSDX-KWCYVHTRSA-N	425.262	1.518	50	20	IDGD	
O=C(COc1ccccc1F)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1	1812779482	XWRMAYSHQQTNSU-VPWXQRGCSA-N	435.883	1.905	50	20	IDGD	
COC[C@H](NC(C)=O)C(=O)N1CCCC[C@H]1c1cc(NC(=O)C(C)(C)CCl)n[nH]1	1814697001	HSSKMMPFLFBGKS-GJZGRUSLSA-N	427.933	1.818	50	20	IDGD	
Cc1cccc(C)c1C(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1	1815343874	UEPYLLZTTSKMBB-KRWDZBQOSA-N	449.341	1.979	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(C(=O)O)ncn2)n[nH]1	1816156372	WQFHZKFBHBLHCA-QMTHXVAHSA-N	436.856	1.458	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCN2CCN(C)CC2)n[nH]1	1817156160	MEOULNOYRZQMFP-RDJZCZTQSA-N	440.976	1.293	50	20	IDGD	
Cc1onc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)c1C	1817473925	GYEPAQAJODJPJF-QGZVFWFLSA-N	437.265	1.314	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)CCCn2cccc2)[nH]n1)c1cccc(B(O)O)c1	1817478791	BJAZNRHLRQRJLC-FQEVSTJZSA-N	449.320	1.677	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2nc[nH]c2[N+](=O)[O-])n[nH]1	1818078943	RQVMHDZMCKQTNI-GXSJLCMTSA-N	425.833	1.601	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](O)CCl)CC2)c1ccc2nc(CO)[nH]c2c1	1818150028	FAGJUSAJLMYTIQ-IINYFYTJSA-N	449.920	1.337	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)CCN3CCOC3=O)sc2C1	1818697159	NIICVSSFNPABQQ-QWRGUYRKSA-N	430.914	1.151	50	20	IDGD	
CC[C@@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CS(=O)(=O)N2CCCC2)[nH]n1	1820857233	QWJQNCDSFMWSOV-UKRRQHHQSA-N	445.973	1.845	50	20	IDGD	
Cn1ccc2c(O)ncc(C(=O)Nc3nc4c(s3)C[C@@H](NC(=O)[C@H](O)CCl)CC4)c21	1821175563	IQVZTQPSOOCCFK-TVQRCGJNSA-N	449.920	1.561	50	20	IDGD	
Cc1cc(/C=C/C(=O)N2CCCC[C@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)no1	1822414864	MFUKZIRZARTASH-JEJOPICUSA-N	443.508	1.785	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H]2[C@H]3SC=C[C@H]32)[nH]n1	1822416367	BQTFFCONSKBMGX-ZCFKWTISSA-N	432.550	1.650	50	20	IDGD	
C[C@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1)n1cccn1	1827059624	FCYKJRKGIQSOEI-DYESRHJHSA-N	438.337	1.057	50	20	IDGD	
O=C([C@H](F)Cl)N1CCC([C@H]2CCCCN2C(=O)CS(=O)(=O)N2CCCC2)CC1	1827675187	CMUDZDMQWOLFFQ-WBVHZDCISA-N	437.965	1.566	50	20	IDGD	
O=C(N[C@@H]1CCc2nc(NC(=O)[C@H]3CCCSC3)sc2C1)c1cccc(B(O)O)c1	1828152299	FYGRTEHRBZZFBW-DZGCQCFKSA-N	445.375	1.192	50	20	IDGD	
CCOc1ncccc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830352188	GZOGGTNNRYIACM-NRFANRHFSA-N	439.940	1.815	50	20	IDGD	
Cc1nc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)cs1	1830538092	VRNLKLPWFJCBQN-SJCJKPOMSA-N	446.367	1.553	50	20	IDGD	
Cc1c(Cl)cccc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1830720336	XLXHZPXOYNFIMC-QFBILLFUSA-N	431.316	1.318	50	20	IDGD	
COc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)c(Cl)c1	1830737984	JMNRCTRMTGIJOU-LPHOPBHVSA-N	447.315	1.018	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H]2CNC(=O)C2)CC1	1831408593	BYXRXNDELWCYTE-VNQPRFMTSA-N	428.371	1.773	50	20	IDGD	
Cc1nccn1[C@@H](C)C(=O)N1CCC([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1	1831877260	VXPKESCJVDVYJA-FXAWDEMLSA-N	446.596	1.745	50	20	IDGD	
C[C@H](Oc1ccccn1)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)CCl)CC2)CC1	1833312861	JAWPMCPSDYXNET-YJBOKZPZSA-N	438.956	1.020	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)[C@H](C)CC(N)=O)CC2)CC1	1833523253	DROUVGFVJTUOOR-CJNGLKHVSA-N	445.402	1.243	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)Cc3cc(C)no3)CC2)CC1	1833734625	PEMWNFFRTIEIQJ-SFHVURJKSA-N	426.945	1.351	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccn(C)c3)CCO2)C1	1833858911	ORPYCBKSHJFBED-MAUKXSAKSA-N	428.327	1.269	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)nc1	1834378674	SUVRHKOJIDYSFM-KDOFPFPSSA-N	426.311	1.243	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CSc3ncccn3)CCO2)C1	1836109725	HCQBWAIWGYJODP-BEFAXECRSA-N	442.969	1.433	50	20	IDGD	
CC(C)(C(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)c1ccccn1	1836719992	FZDPYMCEQFGSSN-SFHVURJKSA-N	437.968	1.958	50	20	IDGD	
O=C1Cc2cc(C(=O)N3CCO[C@@]4(COCCN(C(=O)C(Cl)Cl)C4)C3)ccc2N1	1836791692	MQTIKRQAGNQFCG-IBGZPJMESA-N	442.299	1.055	50	20	IDGD	
Cc1cccc(CC(=O)N2CCOC[C@@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)n1	1837708326	DFKLCECPZGNXOS-NRFANRHFSA-N	435.597	1.240	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ncc(F)cc3F)C2)C1	1837710343	WWCXXJJNYHCWFD-IBGZPJMESA-N	443.523	1.281	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)CC[C@@H]3CCOC3)C2)C1	1837717716	MKTJUISQRDNVNE-YLJYHZDGSA-N	428.602	1.111	50	20	IDGD	
C[C@H](C(=O)N1CCC(OC2CCN(C(=O)[C@H](F)Cl)CC2)CC1)[C@@H]1SC(=N)NC1=O	1838083509	UPALSBYHBUCGAF-BPNCWPANSA-N	448.948	1.322	50	20	IDGD	
CSc1ncccc1C(=O)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1838287303	GOMFGCJCPACZJL-QGZVFWFLSA-N	434.345	1.677	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)CNC(=O)C(F)(F)F)CC2)CC1	1838637078	MLTYOVZBFZCHSM-CQSZACIVSA-N	441.878	1.681	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(O)cc3)CCO2)C1	1838968731	SOSPZEIWRACYHU-IFXJQAMLSA-N	441.322	1.493	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)NC(=O)OC(C)(C)C)C2)C1	1839141399	HACTWIDWFJQNAH-MDOVXXIYSA-N	447.960	1.373	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3cccnc3)C2)C1	1839152205	RBACPJCLLPQTKU-UXHICEINSA-N	444.359	1.707	50	20	IDGD	
O=C(/C=C/c1ccsc1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839198403	ZFFFBUYFCBBCCV-YSCDTDAQSA-N	447.326	1.908	50	20	IDGD	
CC(C)=NO[C@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1	1839227099	JLOGTAAWYONTHA-VQIMIIECSA-N	429.590	1.095	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)c3ccc(C)cc3)C2)C1	1840155651	GBIMKJKUQBYNRG-LQBOVUBWSA-N	438.952	1.809	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC12CN(C(=O)c1cccc3c1NC(=O)C3=O)C2	1841287398	KXXFPPUREQQNDW-LLVKDONJSA-N	434.290	1.669	50	20	IDGD	
O=C(c1cnc2ccc(Br)cn12)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1	1841351403	OWKZIHQLRZBVQJ-ZDUSSCGKSA-N	441.713	1.514	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC2(CCCN2C(=O)[C@@H]2CC(=O)N(C3CCCC3)C2)C1	1841860525	ZOHPQEQVMIVWCV-ZIAGYGMSSA-N	426.355	1.764	50	20	IDGD	
CCOC(=O)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)[C@@H](F)Cl)C1	1843367510	IOJVKVDZTPDDBH-NWDGAFQWSA-N	435.880	1.181	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](O)[C@H](C(=O)N2CCCC23CN(C(=O)[C@@H](F)Cl)C3)C1	1843822621	DSNBWBPIUGFXNW-HZSPNIEDSA-N	433.908	1.342	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)c2cccc(C(F)(F)F)n2)C1	1844454831	UFDQPYGPEIUMQH-UHFFFAOYSA-N	427.427	1.290	50	20	IDGD	
O=C([C@H](O)CCl)N1CC2(CCCN2C(=O)c2cnc3cc(C(F)(F)F)ccn23)C1	1845716848	QXOMALCRBXEXHF-CYBMUJFWSA-N	430.814	1.770	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)Cc2cnc(C)s2)C1	1846584725	OSZYCNBEWPPHTF-YDZHTSKRSA-N	428.518	1.331	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2cc(F)cc(Cl)c2)C1	1846827212	NHXXCFPXHMNMFM-UHFFFAOYSA-N	431.855	1.608	50	20	IDGD	
CN(CC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H]1C[C@H]1C1CC1)NC(=O)NCc1ccccc1	1847490625	UINLZLKETUQCKV-TUFLPTIASA-N	439.560	1.581	50	20	IDGD	
O=C([C@@H](O)CCl)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)c1cccc(Br)c1	1847564853	DPGGTSJIBKLBEM-ZQDZILKHSA-N	431.714	1.284	50	20	IDGD	
CC(C)(NC(=O)c1ccc(Cl)s1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl	1847565059	GUIZPZJWQSKMNR-SRVKXCTJSA-N	448.372	1.711	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)N2CCN(C(=O)NNC(=O)c3ccccc3C)CC2)cc1	9796972	GYYJBPYQHFUBNL-UHFFFAOYSA-N	444.513	1.559	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(N3CCCC3)nn2)c1	116761975	YUVMNPTXCXERRG-UHFFFAOYSA-N	446.533	1.182	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NCc2ccc([C@@]3(C)NC(=O)NC3=O)cc2)cc1C	726281933	GQNWIPALEXIIGM-JOCHJYFZSA-N	439.472	1.267	50	20	IDGD	
NS(=O)(=O)c1ccc(OCCC(=O)NNC(=O)CC23CC4CC(CC(C4)C2)C3)cc1	726379855	SOQCJESIGWGWLS-UHFFFAOYSA-N	435.546	1.857	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)[C@H](CC)NC(=O)OC(C)(C)C)c2ccccc2c1=O	727114718	YWDXTQOQQUUVAX-HNNXBMFYSA-N	431.493	1.871	50	20	IDGD	
CSC[C@@H](C(=O)NNc1nc(-c2cccnc2)no1)N1C(=O)[C@H]2CCCC[C@H]2C1=O	728079580	YHRWNTLJWXRJEO-MJBXVCDLSA-N	430.490	1.482	50	20	IDGD	
C[C@H](C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1)N1CCc2ccccc21	728216027	NLCUMNAFBFIJCY-QGZVFWFLSA-N	443.573	1.517	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCC[C@@H](c2nnc3n2CCC3)C1	728915568	RSYPPTLFLXCYLX-CYBMUJFWSA-N	432.912	1.527	50	20	IDGD	
Nn1c(COc2ccccc2)nnc1SCC(=O)NNC(=O)c1ccc(Cl)cc1	729032304	CMBTYUKVMURLBF-UHFFFAOYSA-N	432.893	1.778	50	20	IDGD	
CC(C)(C)C(=O)NNC(=O)N1CCN(S(=O)(=O)c2ccc(Br)cc2)CC1	731499388	SBMQIFKXUTUOPX-UHFFFAOYSA-N	447.355	1.542	50	20	IDGD	
Cc1nn(-c2ccccc2)c2ncc(C(=O)NNC(=O)CCN3C[C@H](C)O[C@H](C)C3)cc12	732260027	NPVDXYBTRSODIG-IYBDPMFKSA-N	436.516	1.989	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)CCNC(=O)c2ccc3ccccc3c2)C[C@@H](C)O1	732261203	LKPINKBYCHTMMJ-CALCHBBNSA-N	426.517	1.606	50	20	IDGD	
Cc1ccc(C(=O)N2CCC[C@H](C(=O)NNC(=O)CCN3C[C@H](C)O[C@H](C)C3)C2)cc1	732261706	OPWCAZNCGWMCQP-NSHGMRRFSA-N	430.549	1.494	50	20	IDGD	
C[C@@H]1Cc2ccccc2N1C(=O)[C@@H]1CCCC[C@@H]1C(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1	732751882	ZGANWYXRBQRIPW-NRSFXHEJSA-N	447.557	1.353	50	20	IDGD	
NC(=O)c1ccccc1N1CC[C@@H](NC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)C1	733348406	NEDUPOAEPVBJTI-MRXNPFEDSA-N	433.472	1.194	50	20	IDGD	
COc1ccc(Cl)cc1NCC(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	733502100	LMNYMOIGVKVWSH-QGZVFWFLSA-N	449.847	1.291	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2c(C)nn(CCCl)c2C)c2ccccc2c1=O	733885214	UQPIADJXKJHKJG-UHFFFAOYSA-N	430.896	1.933	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)Cc2ccc3c(c2)OCCO3)CC1	734822151	RYYSCFLNGJYCSJ-UHFFFAOYSA-N	434.493	1.730	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2ccccc2OC2CCC2)CC1	735685771	BKAGZPPQYOBZCM-UHFFFAOYSA-N	445.545	1.706	50	20	IDGD	
O=C(NCc1nc(-c2ccc(F)cc2)n[nH]1)NNC(=O)c1csc(N2CCOCC2)n1	741416966	SZMAWDOCUSEQHB-UHFFFAOYSA-N	446.468	1.048	50	20	IDGD	
O=C(NNC(=O)c1cccc2cc[nH]c12)c1cccc(S(=O)(=O)N2CCOCC2)c1	742465620	QVNSTTPJSYXGJS-UHFFFAOYSA-N	428.470	1.264	50	20	IDGD	
CC(C)c1ccc(-n2c(NNC(=O)c3cn(CC(N)=O)nn3)nc3ccccc3c2=O)cc1	742673193	QBGPIIMLVBYYAS-UHFFFAOYSA-N	446.471	1.343	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNS(=O)(=O)c2cccc(-n3cnnn3)c2)cc1	743730589	SJNYUBCQMGUDNE-UHFFFAOYSA-N	430.490	1.711	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)Nc2ccc(S(N)(=O)=O)cc2)cc1Cl	743810125	BRSCICABIUJBNC-UHFFFAOYSA-N	443.869	1.863	50	20	IDGD	
CC(=O)Nc1cc(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)ccc1C	744622541	YAINCVKODOFIHS-UHFFFAOYSA-N	432.502	1.731	50	20	IDGD	
Nc1c(O)nc(O)nc1C(=O)NNC(=O)c1ccc(COc2ccc(Cl)cc2)cc1	746093138	CPTOMEATTLJUAU-UHFFFAOYSA-N	429.820	1.777	50	20	IDGD	
O=C(CCS(=O)(=O)c1ccc2c(c1)OCCO2)NNC(=O)c1ccc(Cl)cc1F	747329831	RPFFOHSCMODXAT-UHFFFAOYSA-N	442.852	1.875	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)[C@H](c1ccccc1)n1cccn1	747622093	FFEYWDINXYAVMG-QHCPKHFHSA-N	432.528	1.832	50	20	IDGD	
O=C(NNC(=O)c1cc(S(=O)(=O)N2CCCCC2)ccc1N1CCCC1)c1ccc[nH]1	747663544	LESWUQORHVBCNI-UHFFFAOYSA-N	445.545	1.864	50	20	IDGD	
CC(=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O)[C@H](C)c1nc2ccccc2s1	748780615	MSHNSBDMUKPDMD-JTQLQIEISA-N	432.531	1.477	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN1C(=O)c1ccc2c(c1)OCO2)[C@@H]1COc2ccccc2O1	749471934	ZVVJQCAPKOFCTP-KUHUBIRLSA-N	439.424	1.007	50	20	IDGD	
COC(=O)COc1c(C)cc(C(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)cc1C	752521893	VCRUHIUHGQWFFT-UHFFFAOYSA-N	449.485	1.725	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)N[C@@H]3CCCN(c4cccnc4)C3=O)nc21	753358945	SWFMOOMUZONDLN-CQSZACIVSA-N	439.480	1.504	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2cc(C(=O)O)c(C)cc2F)cc(OC)c1OC	753768441	FUIDBDMYYIHRCK-UHFFFAOYSA-N	442.421	1.481	50	20	IDGD	
COC(=O)c1cc(Cl)ccc1S(=O)(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	753774178	CNNZNASGZASFRG-UHFFFAOYSA-N	446.890	1.153	50	20	IDGD	
C[C@H](NCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)[C@H]1CCCN(C(=O)OC(C)(C)C)C1	754310245	BVSKBMQVDXLOOS-HOCLYGCPSA-N	449.508	1.981	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Cc2ccc3c(c2)COC3)c1	754346752	RFILNIGFVAGYJH-UHFFFAOYSA-N	431.514	1.751	50	20	IDGD	
C[C@H](CS(=O)(=O)c1ccc(F)cc1)C(=O)NNC(=O)[C@H](C)Oc1ccccc1F	755050038	VENMMQCECYAGAJ-OLZOCXBDSA-N	426.441	1.990	50	20	IDGD	
CCOC(=O)COc1cccc(NC(=O)NNC(=O)c2nnc(O)c3ccccc23)c1	755645064	CNYTVRWMLKRWSE-UHFFFAOYSA-N	425.401	1.744	50	20	IDGD	
CCNC(=O)COc1ccc(NC(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)cc1	755647393	OKMNKKGYCFCPOT-UHFFFAOYSA-N	446.460	1.694	50	20	IDGD	
Cc1c(NC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cccc1C(=O)N1CCOCC1	756184811	NLMDFMIUHXGUTI-LJQANCHMSA-N	440.456	1.460	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)Nc1cccc(OCCS(C)(=O)=O)c1	756297020	FSJKNGYDAWRZOL-CYBMUJFWSA-N	439.465	1.869	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)Nc1ccc(N2CCOCC2)c(F)c1	756336185	TXPXOQIIYBJSEK-UHFFFAOYSA-N	443.483	1.522	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1ccccc1CN(C)C(=O)OC(C)(C)C	756616930	DEHNYTVYWYZUGC-LBPRGKRZSA-N	443.526	1.144	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)CN1C(=O)NC2(C[C@H](C)C[C@@H](C)C2)C1=O	756866995	IQUWPPFHCDOYAH-MCIONIFRSA-N	434.468	1.487	50	20	IDGD	
CC(C)c1noc2nc(-c3ccco3)cc(C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)c12	758035146	JYXVIHLQVHZUHD-JTQLQIEISA-N	435.462	1.305	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NN=C1CCC2(CC1)NC(=O)NC2=O	758119773	UMGBRWVZIBXLOJ-UHFFFAOYSA-N	446.939	1.082	50	20	IDGD	
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)C(=O)Nc1ccccn1	758835900	ZUUGKBJXTFZBRG-KRWDZBQOSA-N	436.472	1.032	50	20	IDGD	
CCO[C@@H]1C[C@@H](NC(=O)NNc2ccc(S(=O)(=O)N(CC)CC)cn2)[C@@]12CCCO2	760140431	CICFFFBHWBJVDS-MDZRGWNJSA-N	441.554	1.465	50	20	IDGD	
COCC(=O)NN=Cc1ccc(OS(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2)c(OC)c1	761818157	SFLHAOKHOWAPJT-UHFFFAOYSA-N	437.430	1.776	50	20	IDGD	
COc1ccc2c(c1)[C@@H](C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1)CC2	761972265	MQTZTTZVFVUYAP-KRWDZBQOSA-N	431.514	1.889	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)c1cc(S(=O)(=O)N(C)C)ccc1F	762409578	QKSAZKTYTXZBBH-UHFFFAOYSA-N	441.506	1.638	50	20	IDGD	
Cc1ccc(S(C)(=O)=O)cc1S(=O)(=O)NNC(=O)CSc1ccccc1O	763410468	NSIGTRSQEKOFTR-UHFFFAOYSA-N	430.529	1.206	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccncc2)n(-c2cccc(C(F)(F)F)c2)n1	763465795	BHCRCVYZKZJUID-UHFFFAOYSA-N	432.362	1.994	50	20	IDGD	
CC[C@H](NC(=O)NNC(=O)CSc1ccccc1O)c1cccc(S(N)(=O)=O)c1	763497774	IPADPHQKHJLZBJ-AWEZNQCLSA-N	438.531	1.613	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cc(CC(C)(C)C)nn2C)cc(OC)c1OC	763540002	OWZQQHUVEBEQKE-UHFFFAOYSA-N	447.492	1.434	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)C(=O)Nc2cnn(C[C@@H]3CCCO3)c2)c1	763598503	ZYYUTJURIFHCHD-KRWDZBQOSA-N	443.504	1.659	50	20	IDGD	
CCN(CC)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2c(C)nc3ccccn23)cc1	763628982	NLVXRXFKZXOJMO-UHFFFAOYSA-N	436.472	1.524	50	20	IDGD	
CON(C)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2cc(C)ccc2C)cc1	763668923	STUDWJLNDUAGFU-UHFFFAOYSA-N	428.445	1.102	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C)c(C)c2)c(C)c1	763679252	JLSURSFYVVEWHO-UHFFFAOYSA-N	443.456	1.329	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2cc(F)cc(Cl)c2)c1	763718156	IDWXXFINHYTROG-UHFFFAOYSA-N	442.856	1.129	50	20	IDGD	
Cc1c(CS(C)(=O)=O)cccc1NC(=O)C(=O)NNC(=O)C12CC3CC(CC(C3)C1)C2	763727680	MEYBYEPAEYIEHC-UHFFFAOYSA-N	447.557	1.842	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(N2CCSCC2)cc1	763808301	JEAJFAHCCRLRLB-UHFFFAOYSA-N	439.497	1.276	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)cc1	763822310	YAKIWTOODXFRLP-UHFFFAOYSA-N	438.343	1.670	50	20	IDGD	
CC[C@@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)cc1	763873779	WHFDOFFCPKSVMF-ZIAGYGMSSA-N	444.463	1.907	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccnn2CCC(C)C)cc1	763878545	QZUGCLKKKOJHLZ-OAHLLOKOSA-N	429.477	1.685	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)C(=O)Nc1cccc(-c2cnco2)c1	763948991	MAIQNKXIEYKXKV-UHFFFAOYSA-N	432.396	1.633	50	20	IDGD	
CCc1nnc(-c2cccc(NC(=O)C(=O)NNC(=O)c3cc(Br)c[nH]3)c2)o1	763998223	NGKYXMWJZAEJML-UHFFFAOYSA-N	447.249	1.789	50	20	IDGD	
Cc1ccc(C(=O)N2C[C@@H](C)C[C@H](C)C2)cc1NC(=O)C(=O)NNC(=O)c1cnccn1	764023691	CWTKCAYTYFFPKN-KBPBESRZSA-N	438.488	1.303	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)nc1)C(=O)Nc1cc(F)ccc1OC[C@@H]1CCCO1	764102297	YDPVOBIIMKMZDU-ZDUSSCGKSA-N	436.827	1.832	50	20	IDGD	
Cc1cc(N2CCSCC2)ccc1NC(=O)C(=O)NNC(=O)[C@H]1Cc2ccccc2O1	764167430	JWZNJDLNXGHGFY-LJQANCHMSA-N	440.525	1.638	50	20	IDGD	
CCCCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)CCc2ccco2)cc1	764178051	ZTOIPOGMGDDWFW-UHFFFAOYSA-N	436.490	1.540	50	20	IDGD	
O=C(NNC(=O)c1cccc2ncccc12)C(=O)Nc1ccc(CN2CCCC2=O)cc1	764257870	PLFXTZXXPFYKQV-UHFFFAOYSA-N	431.452	1.757	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)C(=O)Nc1cccc(OC[C@H]2CCCO2)c1	764279164	YGYYQNHZBLXNBM-GOSISDBHSA-N	427.457	1.669	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C(=O)Nc1ccc(OCC(=O)N(C)C)cc1)c1ccccc1	764325966	CMDRVJICZHLOKH-SFHVURJKSA-N	426.473	1.433	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(C(N)=O)ccc2C)cc1Br	764327376	YRQWUPICYIUPLA-UHFFFAOYSA-N	449.261	1.265	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)C(=O)Nc1ccc(CCN2CCCC2)cc1	764343422	QDVNNFOGXCONKK-UHFFFAOYSA-N	446.511	1.910	50	20	IDGD	
COC[C@@H](C)n1c(C)cc(/C=C(/C#N)C(=O)NNC(=O)CNC(=O)c2cccnc2)c1C	764344209	UZQUTZFFUJHTJM-HBFFOVPNSA-N	438.488	1.192	50	20	IDGD	
COC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1F	764346302	VWWYSDNVHZEXSM-UHFFFAOYSA-N	440.391	1.589	50	20	IDGD	
Cc1cc(C(=O)NCC(C)C)ccc1NC(=O)C(=O)NNC(=O)COCc1ccccc1	764368345	VFTLMRAKLALXTM-UHFFFAOYSA-N	440.500	1.684	50	20	IDGD	
CCCNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)c1	764369224	ABSUNKKMXJLSEQ-UHFFFAOYSA-N	434.399	1.584	50	20	IDGD	
CCOC(=O)c1cc(C)sc1NC(=O)C(=O)NNC(=O)CSc1ccccc1O	764393649	KIWPYPGCQPNECZ-UHFFFAOYSA-N	437.499	1.817	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1cccc(NC(=O)c2cccs2)c1	764399904	NJWPIZPHNGIFCN-LBPRGKRZSA-N	434.474	1.138	50	20	IDGD	
CCc1cc(N2CCC[C@@H](NC(=O)NNC(=O)CSc3ccccc3O)C2)ncn1	764407980	GCAMWABNXPCUGL-OAHLLOKOSA-N	430.534	1.836	50	20	IDGD	
Cc1ccc(NC(=S)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cc1F	764519734	WUYDOEWIKIBAJA-UHFFFAOYSA-N	429.521	1.910	50	20	IDGD	
C[C@H]1CN(CCCNC(=O)NNC(=O)COc2ccc(Br)cc2)CCCO1	764582988	LOFQBGNLOXLLEU-AWEZNQCLSA-N	443.342	1.659	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)CSc2ccccc2O)c1	765249277	RKCSMNUWPFHACQ-UHFFFAOYSA-N	441.506	1.771	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2ccc(N3C(=O)CCC3=O)c([N+](=O)[O-])c2)c(OC)c1	766606028	RBWIYVQNDFHBCQ-UHFFFAOYSA-N	442.384	1.340	50	20	IDGD	
O=C(Cc1cc(-c2ccccc2)on1)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	766639753	AEQSBMGIDYJYQW-UHFFFAOYSA-N	447.495	1.490	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1[N+](=O)[O-]	767432280	RHJKZZVNHNQQTA-UHFFFAOYSA-N	448.457	1.463	50	20	IDGD	
O=C(COC(=O)CCc1nc(C2CCCC2)no1)NNC(=O)c1ccc([N+](=O)[O-])cc1	770036992	CTMLVQUZGIBHFS-UHFFFAOYSA-N	431.405	1.572	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)c3cc(F)c(F)cc3I)nc21	770982230	FCFMZDZIKNOMCR-UHFFFAOYSA-N	446.155	1.709	50	20	IDGD	
CCN1CCN(c2cccc(NC(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)c2)CC1	771277126	LDDBWUPUQVQXAS-UHFFFAOYSA-N	435.492	1.271	50	20	IDGD	
COc1ccc(N2C[C@@H](C(=O)NNC(=O)C(=O)NCc3ccc(Cl)cc3)CC2=O)cc1	772194697	CANMTOGPDYWLER-AWEZNQCLSA-N	444.875	1.165	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)c1ccc(CCNS(C)(=O)=O)cc1	772991554	VBZOPGDFVWHOED-CYBMUJFWSA-N	439.921	1.660	50	20	IDGD	
O=C(CCc1ccccc1)NNC(=O)NCc1ccc(N2CCCS2(=O)=O)c(F)c1	773590877	XDCOHCRRPBIUBY-UHFFFAOYSA-N	434.493	1.829	50	20	IDGD	
CC1CCC2(CC1)OC[C@H](CNC(=O)NNC(=O)c1nn(-c3ccccc3)cc1O)O2	776952885	RGNFUWCXSMWLNJ-PKAMJGAUSA-N	429.477	1.844	50	20	IDGD	
CC[C@H](C)C(=O)N1CCC[C@H](C(=O)N2CCN(S(=O)(=O)CBr)CC2)C1	777836300	IKBIONTZSWWJIM-KBPBESRZSA-N	438.388	1.098	50	20	IDGD	
Cc1cc(C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)nc(C(F)(F)F)n1	778386528	XSHVDTDIEBYGMO-UHFFFAOYSA-N	427.295	1.330	50	20	IDGD	
O=C(NNc1ccccc1OC(F)(F)F)C(=O)Nc1cccnc1N1CCOCC1	778799337	UEENPRHYUPHFMQ-UHFFFAOYSA-N	425.367	1.899	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)[C@@H](O)[C@H](O)c2nc3ccccc3s2)o1	779500861	SIRAMJFWLYJCMI-IRXDYDNUSA-N	432.502	1.587	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)CNC(=O)c2ccc([N+](=O)[O-])c(C)c2)o1	782589778	CIMVQNPIPLBZSO-UHFFFAOYSA-N	431.449	1.529	50	20	IDGD	
CNS(=O)(=O)c1ccc(C)c(NC(=O)C(=O)NNc2ncccc2C(F)(F)F)c1	783119728	DELZIHCXCDGVPT-UHFFFAOYSA-N	431.396	1.399	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2cccc(C(F)(F)F)c2)nc1	783263773	LBOBUGHFPBHNGD-UHFFFAOYSA-N	445.423	1.869	50	20	IDGD	
Cc1ccc(C)c(NNC(=O)C(=O)Nc2ccc(N3CCN(C(=O)C4CC4)CC3)nc2)c1	783368645	DRPUBJMSDZKPKT-UHFFFAOYSA-N	436.516	1.839	50	20	IDGD	
Cc1ccccc1NC(=O)NNC(=O)C(=O)Nc1ccccc1S(=O)(=O)C(F)F	783415975	MYCIMQVWKRHHJP-UHFFFAOYSA-N	426.401	1.783	50	20	IDGD	
O=C(NNc1ccc(-n2cccn2)nn1)C(=O)Nc1ccc(N2CCCC2=O)c(Cl)c1	783433685	YLOSYYJHISIKKA-UHFFFAOYSA-N	440.851	1.524	50	20	IDGD	
Cc1ccc(NNC(=O)C(=O)Nc2cccc(OCCNC(=O)OC(C)(C)C)c2)nn1	783948038	PXIQTNGFWYMAIF-UHFFFAOYSA-N	430.465	1.770	50	20	IDGD	
Cc1nccc(-c2cccc(NC(=O)C(=O)NNC(=O)CNC(=O)c3cccs3)c2)n1	784004705	JYJSKFYLCUZOPJ-UHFFFAOYSA-N	438.469	1.029	50	20	IDGD	
C=CCN(C)S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2cccc([N+](=O)[O-])c2C)cc1	784357522	AFXFGSKHUYNCEB-UHFFFAOYSA-N	447.473	1.792	50	20	IDGD	
COc1cccc(NNC(=O)C(=O)Nc2ccc(Cl)c(-n3nnnc3C3CC3)c2)n1	784845607	DZPFHMSTMWSSKU-UHFFFAOYSA-N	428.840	1.679	50	20	IDGD	
COc1cccc(NNC(=O)C(=O)N2C[C@H](CC(=O)N(C)C)c3cc(Cl)ccc32)n1	784846763	VHMWOBVHUMOKTM-LBPRGKRZSA-N	431.880	1.795	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2cc(Cl)ccn2)cc1	784861546	MLXLFYJARUWXNS-UHFFFAOYSA-N	425.898	1.847	50	20	IDGD	
COC(=O)c1ccc(S(=O)(=O)NNC(=O)CSc2ccccc2O)c(OC)c1	785512972	AMMQRJHIVKKWIS-UHFFFAOYSA-N	426.472	1.289	50	20	IDGD	
Cc1ccc(-n2cc(NC(=O)C(=O)NNC(=O)CNC(=O)c3cccs3)cn2)c(C)c1	786428299	YMLGKTSHIJUTHO-UHFFFAOYSA-N	440.485	1.067	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ccc(-n3cccn3)nn2)cc1C(=O)N1CCCCC1	787559297	CPJKSYVJUJGUIU-UHFFFAOYSA-N	448.487	1.679	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)C(=O)Nc1nc2c(s1)CCCC2	789732063	PAZMPFPALJBSBO-UHFFFAOYSA-N	426.458	1.313	50	20	IDGD	
COc1ccc(CN(C)C)cc1NC(=O)C(=O)NNC(=O)[C@H]1OCC[C@H]1c1ccccc1	789823997	YIJLTTDMHVXQJW-PXNSSMCTSA-N	440.500	1.415	50	20	IDGD	
O=C(CC(F)(F)F)NNC(=O)C12CCC(C(=O)NNC(=O)CC(F)(F)F)(CC1)CC2	790556102	BVOPIZSCKGVTPL-UHFFFAOYSA-N	446.348	1.527	50	20	IDGD	
Cc1ccc(CN2CC[C@H](NC(=O)NNC(=O)CSc3ccccc3O)C2=O)cc1	790700852	KBGGEBMJLCAHPD-INIZCTEOSA-N	428.514	1.924	50	20	IDGD	
CC(=O)N1CCCN(c2ccc(F)cc2NC(=O)C(=O)NNC(=O)CCC(C)C)CC1	790953163	XHXAARYAEGZRSW-UHFFFAOYSA-N	435.500	1.406	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cnc(CC(C)C)nc2)ccc1OC(C)C	792354677	LCDDUXKLDIYXNU-UHFFFAOYSA-N	429.477	1.871	50	20	IDGD	
COCCOC1CCC(C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)CC1	792811231	VUOMTNVTUACKEK-UHFFFAOYSA-N	426.539	1.271	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NN=C1CCOC[C@H]1C)N(S(C)(=O)=O)CC2	794485838	LTHAHVUCJNXMFR-DYVFJYSZSA-N	439.534	1.481	50	20	IDGD	
Cc1nc(O)c(Br)cc1C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	795196012	LICUDHXMDFMHIW-UHFFFAOYSA-N	428.264	1.336	50	20	IDGD	
C=C(CBr)COC(=O)[C@H](NS(=O)(=O)c1ccc(Cl)cc1)[C@H](C)O	795321828	YXHNIWBZATWMHM-GXFFZTMASA-N	426.716	1.862	50	20	IDGD	
CN1C(=C(C#N)C(=O)COC(=O)C2(S(C)(=O)=O)CCOCC2)N(C)c2ccccc21	796390319	TXCWGNKCCFARFO-UHFFFAOYSA-N	433.486	1.014	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2nnn(-c3cccc4cccnc34)c2C)cc1	801109524	RIVFWBHPXAFZTR-UHFFFAOYSA-N	429.440	1.832	50	20	IDGD	
C[C@H](CCNS(=O)(=O)c1ccccc1)NC(=O)NNC(=O)COc1ccc(C#N)cc1	802528999	MZAAATNQXFPIGW-OAHLLOKOSA-N	445.501	1.025	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)ccc1O)C(=O)Nc1ccc(OC(F)F)nc1	802566814	GCIZDVDYJRCFHG-UHFFFAOYSA-N	445.176	1.551	50	20	IDGD	
N#Cc1ccc(N2CC[C@H](C(=O)NNC(=O)c3csc(N4CCOCC4)n3)C2)c(F)c1	804169184	QSSJBOJLPLVTJD-AWEZNQCLSA-N	444.492	1.278	50	20	IDGD	
COc1ccc(-c2nn(CCC#N)cc2/C=C(/C#N)C(=O)NCC(=O)NCC#N)cc1OC	804820449	IENMLPSCLISCLH-YBEGLDIGSA-N	447.455	1.144	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1)C(=O)Nc1ccc(F)c(N2CCCNC2=O)c1	806972980	UWCRFBXDRCNESF-UHFFFAOYSA-N	433.827	1.799	50	20	IDGD	
CC1(C)CC(=O)c2cc(NC(=O)C(=O)NNC(=O)COc3ccccc3C#N)ccc2O1	806974348	GJXLZIUPQUTJPE-UHFFFAOYSA-N	436.424	1.467	50	20	IDGD	
COCc1csc(NC(=O)C(=O)NNC(=O)c2cc(OC)ccc2Br)n1	806978260	TXTSARNCLQFXLZ-UHFFFAOYSA-N	443.279	1.460	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)NCc1ccccc1S(N)(=O)=O	807605630	UQHOTJQLEZEFPY-NSHDSACASA-N	426.882	1.285	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)NCc1ccncc1OC[C@@H]1CCOC1	807616155	PFUCQRWPOXNGTQ-MRXNPFEDSA-N	428.489	1.969	50	20	IDGD	
COc1ccc(CNC(=O)NNC(=O)c2cccc3ccccc23)cc1S(N)(=O)=O	808273616	DILXGQKIWKYGSZ-UHFFFAOYSA-N	428.470	1.640	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)cc2[nH]ccc12	808936895	ZDVSJHYRHYTCQP-UHFFFAOYSA-N	448.439	1.170	50	20	IDGD	
CC[C@H](Nc1c([N+](=O)[O-])c(C)nn1C)C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	812727461	RJIJTOIEEYIZRL-AWEZNQCLSA-N	439.498	1.221	50	20	IDGD	
CC(=O)N[C@H](CC(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1)c1c(F)cccc1F	812730873	ZSQCRTGBMSMXIF-QGZVFWFLSA-N	440.472	1.926	50	20	IDGD	
Cc1cnc(Br)c(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c1	812979531	BBNDSIRMWDESOK-UHFFFAOYSA-N	443.261	1.738	50	20	IDGD	
Cc1cnc(Br)c(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)c1	812991946	RMFXVVFVPSAGSE-ZFWWWQNUSA-N	447.289	1.811	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccccc2-n2cccn2)cc1	813033195	JGYKQXLEJZSRFK-UHFFFAOYSA-N	428.474	1.204	50	20	IDGD	
NS(=O)(=O)c1ccc(CCNC(=O)NNC(=O)c2ccc(Br)s2)cc1	813540497	KDIMXMBAOXAOIX-UHFFFAOYSA-N	447.336	1.345	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCc2nncn2C1)[C@@H]1Cc2ccccc2CN1Cc1ccccc1	815157090	IFKRAQDMTZKRDK-RTWAWAEBSA-N	430.512	1.615	50	20	IDGD	
Cn1ncc(I)c1C(=O)NNC(=O)c1cccc(OC(F)F)c1	815387126	WIANQZWMLQCPOE-UHFFFAOYSA-N	436.156	1.701	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2nnn(Cc3ccccc3F)c2C)c1	815564327	FWVSEQHYVMKZOI-UHFFFAOYSA-N	440.435	1.247	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)Cn2c(S)nnc2-c2ccc(C)cc2)c1	825802159	YEAAUBSNVWDCKD-UHFFFAOYSA-N	426.502	1.810	50	20	IDGD	
CN(C)[C@H](CNC(=O)NNC(=O)c1nn(-c2ccccc2)cc1O)c1cccc(F)c1	838523662	ZLQUHYMYBKAKLH-QGZVFWFLSA-N	426.452	1.964	50	20	IDGD	
O=C(CCC(=O)N1CC(=O)Nc2ccccc21)NNC(=S)NCCc1cccs1	838835946	VCIWMQJEORCJHP-UHFFFAOYSA-N	431.543	1.551	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)C[C@@H]2Sc3ccc(Cl)cc3NC2=O)C[C@@H](C)O1	842471118	BPIMBZACMJBXRL-HSMVNMDESA-N	440.953	1.790	50	20	IDGD	
N#Cc1cccc(S(=O)(=O)NCC(=O)NNC(=O)c2ccc(Cl)cc2Cl)c1	913215917	CIIFUSBHDNXZFA-UHFFFAOYSA-N	427.269	1.605	50	20	IDGD	
Cc1cccc(C)c1OCCC(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	914809091	KDCCPYCJRUXASR-SFHVURJKSA-N	428.441	1.603	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)c1cn(-c2ccccc2Br)nn1	914880812	YSNHYHAPLBWZMI-UHFFFAOYSA-N	446.261	1.878	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CS(=O)(=O)CCCc2ccccc2)cc1C	915595254	BDLCQYNQBRTUHZ-UHFFFAOYSA-N	431.514	1.437	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Cc2c(C)nc3c(c(C)nn3C)c2C)cc(OC)c1OC	915807074	LVGQINUZGFCDEK-UHFFFAOYSA-N	441.488	1.923	50	20	IDGD	
CCS(=O)(=O)N1CCC(NC(=O)NNC(=O)COc2cc(C)ccc2C(C)C)CC1	916260287	WKAMVVCIUYQPHR-UHFFFAOYSA-N	440.566	1.642	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NN=Cc1cccc(O)c1)N(S(C)(=O)=O)CC2	916356423	VAZIUQZGVWBNRO-GOSISDBHSA-N	447.513	1.809	50	20	IDGD	
Cc1ccc(C)c(S(=O)(=O)NCC(=O)NNC(=O)c2cc3ccccc3cc2O)c1	917358374	QWFNVLPOXGTFEA-UHFFFAOYSA-N	427.482	1.902	50	20	IDGD	
COc1cccc(CCNC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)c1OC	918014192	NSAZULDZSRBTSN-UHFFFAOYSA-N	449.533	1.492	50	20	IDGD	
NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NNC(=O)Cc3c[nH]c4ccccc34)cc2)C1	918117970	LVIQDLSLBKQRHN-QGZVFWFLSA-N	448.527	1.943	50	20	IDGD	
O=C(NNC(=O)N1CCO[C@H](c2ccc(F)cc2)C1)c1csc(N2CCOCC2)n1	918776244	KLHGLLXFXPVFLB-INIZCTEOSA-N	435.481	1.547	50	20	IDGD	
Cc1c(/C=C(\C#N)C(=O)OCC(=O)N2CCC(C(=O)N(C)C(C)C)CC2)cc(C#N)n1C	919045719	IZVQABYKDSPGFI-VXLYETTFSA-N	439.516	1.761	50	20	IDGD	
CN(CCNC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)Cc1ccccc1	919790573	SUJMRIBKNWBKOW-UHFFFAOYSA-N	438.576	1.661	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)NC[C@@H](c1cccs1)N1CCN(C)CC1	919902432	DYDWXVZEXRIQPI-KRWDZBQOSA-N	431.562	1.618	50	20	IDGD	
C[C@H](C(=O)NNC(=O)c1ccc(F)cc1Br)N1C(=O)[C@@H]2CCCC[C@H]2C1=O	920456517	WDTSJKQDVNZFOA-YUSALJHKSA-N	440.269	1.913	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)Nc2ccccc2CN2C(=O)CNC2=O)c1C	920933461	PLISYABPBBUHQE-HNNXBMFYSA-N	439.472	1.975	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)N[C@@H]2CC(=O)N(c3ccccc3)C2)nc1	921125237	GGNCLJRYEGWTHN-OAHLLOKOSA-N	446.533	1.544	50	20	IDGD	
COc1ccccc1-n1c(C)cc(/C=C(/C#N)C(=O)c2c(N)n(C)c(=O)n(C)c2=O)c1C	1317728705	HPUXEKKQLDBKJI-WJDWOHSUSA-N	433.468	1.872	50	20	IDGD	
COc1ccccc1-n1cc(S(=O)(=O)NNC(=O)c2cncn2-c2ccccc2)cn1	1318887819	KOIWABAONMKLOE-UHFFFAOYSA-N	438.469	1.690	50	20	IDGD	
Cc1ncc2c(n1)CC[C@H](NC(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1)C2	1318917155	AQJWMGILUCCWIC-INIZCTEOSA-N	432.525	1.620	50	20	IDGD	
Nc1cnnc(NNC(=O)[C@@H]2CC(=O)N(c3ccccc3Br)C2)c1Cl	1333509544	RRJZFJKMEGWOOA-MRVPVSSYSA-N	425.674	1.971	50	20	IDGD	
Cc1ccc(SCC(=O)N2CC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)cc1	1778091638	WLFWGNPULFBJQX-JOCHJYFZSA-N	448.589	1.290	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc3nc[nH]c3c2)C1	1779012861	ZHWAXXLFKBMJRT-FQELHTAISA-N	434.924	1.944	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(C(F)(F)F)ccn3)C2)C1	1779663604	CYDJNGJQFGUZIL-CXAGYDPISA-N	435.830	1.798	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Cl)C2)c1ccc(-n2cccn2)nc1	1779813464	HSNBHPFNBDTPER-OXFYSEKESA-N	435.887	1.929	50	20	IDGD	
CC(C)c1ccc(C(=O)N2CC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)cc1	1780760627	MLSSXUOTAVRDJE-XMMPIXPASA-N	436.317	1.247	50	20	IDGD	
O=C(c1ccc2c(c1)COC2)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781329827	KVXUIOAOQVBUMU-MAUKXSAKSA-N	427.270	1.851	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](Cl)COC)C1	1782178578	AVTWWQZLTXGXDW-NXEZDXNNSA-N	434.917	1.316	50	20	IDGD	
COc1cc(Cl)ccc1CC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1782897736	SDVUYDCVEFLBJU-BEFAXECRSA-N	431.316	1.321	50	20	IDGD	
C/C=C(/C)C(=O)N1CC[C@]2(CN(C(=O)CN(C)NC(=O)NCc3ccccc3)CCO2)C1	1783081729	PDUSJRLAENTNNC-SILSAOTNSA-N	443.548	1.129	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cncc(N(C)C)c3)CCO2)C1	1783344001	LZNXUTHYNMEIAW-QFBILLFUSA-N	439.354	1.765	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc([N+](=O)[O-])cc3F)CCO2)C1	1783538669	XGKKDVRLPAJTKJ-GTNSWQLSSA-N	444.257	1.961	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H]3C[C@@]34C(=O)Nc3ccccc34)C2)C1	1783541888	BZZNHSYEDITPFR-FNVCAUGXSA-N	445.947	1.991	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)Cn3cnc4ccccc43)C2)C1	1783744497	SQAGAFWDAKBTFP-YWZLYKJASA-N	449.349	1.897	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@H]1C(=O)N1CC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1783849450	OIPKLMRSLIMCDZ-ZOCZFRKYSA-N	426.941	1.837	50	20	IDGD	
Cc1cc(F)c(C(=O)N2CCO[C@@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc1F	1783937976	QNPPBBANEWJTLM-OAQYLSRUSA-N	438.475	1.090	50	20	IDGD	
C[C@H](CC(=O)N1CCO[C@@]2(CCN(C(=O)C(Cl)Cl)C2)C1)NC(=O)OC(C)(C)C	1783945965	UTFWYWWTLYIWHJ-XIKOKIGWSA-N	438.352	1.923	50	20	IDGD	
Cc1ccc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]3C2)cn1	1783969943	RSOSKTPJUXYRHS-MGHWNKPDSA-N	438.366	1.943	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3n[nH]c4cc(Cl)ccc34)C[C@@H]21)[C@H](O)CCl	1784091813	CWHAUSOKPSWGOT-CEFQPYBMSA-N	441.315	1.409	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(C(F)(F)F)c3)C[C@@H]21)[C@H](O)CCl	1784091975	AKLYCJHOFCYAEA-HNKHHVNMSA-N	434.842	1.898	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3cccs3)[C@H]2C1	1785418353	UOVFMRLTKJCACR-SZMVWBNQSA-N	436.578	1.033	50	20	IDGD	
Cc1[nH]nc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)CBr)C[C@@H]32)c1F	1785761547	VYUOFUKFEHVPNF-IXOXFDKPSA-N	431.306	1.482	50	20	IDGD	
O=C(NC1(c2ccc(NC(=O)[C@H](O)c3ccco3)cc2)CCC1)c1ccc(B(O)O)cc1	1785854239	DRMASDFHCGRAEK-HXUWFJFHSA-N	434.257	1.441	50	20	IDGD	
CCc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Br)C[C@@H]32)cn1	1785880213	PHLPUWSVSGSQQU-TUUVXOQKSA-N	428.302	1.928	50	20	IDGD	
O=C(Cn1cccc([N+](=O)[O-])c1=O)NC1(c2ccc(NC(=O)[C@@H](O)CCl)cc2)CCC1	1786135761	PYFHQPKJRYAOJC-INIZCTEOSA-N	448.863	1.490	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc4n(n3)CCCO4)[C@H]2C1	1788352971	WGHPIASCNQVDBV-VODUFIJXSA-N	445.347	1.495	50	20	IDGD	
COc1cc(CCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]3C2)ccn1	1788765678	OCNRYIYBKYAHDG-FHWLQOOXSA-N	449.624	1.854	50	20	IDGD	
COc1ccnc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Br)C[C@@H]32)c1	1788892222	NSLWPGWQYJYAQW-HQRZJTNHSA-N	430.274	1.374	50	20	IDGD	
CCc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]32)nn1C	1789067640	OEILPLUELADYQM-HAHWVIBASA-N	431.364	1.812	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(=O)nc4sccn34)[C@H]2C1	1789139787	UOSBOQGNUJYFHE-XPCVCDNBSA-N	438.937	1.367	50	20	IDGD	
COc1cccc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]3C2)n1	1789922788	SPGIFBKGCYWTCT-MJFSBKNWSA-N	444.301	1.303	50	20	IDGD	
C[C@H](Nc1cccnc1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]2C1	1789923105	YJTQBRSPZXHLSH-OSZUESSQSA-N	443.317	1.552	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)Cc3ccccc3)C[C@@H]21)[C@H](F)Br	1789924686	AJFBUGALQOKWEW-WOYTXXSLSA-N	443.313	1.260	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(F)cnc3Cl)C[C@@H]21	1791255020	ABSNVQYYDBRVAK-HJPIBITLSA-N	434.295	1.721	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)Oc3cccnc3)[C@H]2C1	1791654672	XANPENNCFOLAIK-SRIISGBFSA-N	425.913	1.082	50	20	IDGD	
CCC[C@@H](NC(C)=O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](Br)CC)C[C@@H]21	1792188405	GFSIUTNAZMZNMP-VIQHNZTISA-N	446.386	1.444	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3cccnc3[nH]1)C2	1792870852	LUPTUZLVTQMAFI-ZIEJDFEHSA-N	435.322	1.797	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(C)(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](O)CCl)C1	1793111595	QZZPJGYHPDVVRC-XGUBFFRZSA-N	429.945	1.481	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](O)CCl)C1	1793115707	TYWMDLFGHMWLJN-KSWRQPAISA-N	443.972	1.871	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H]2C[C@]21C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCl	1793115941	BOSKTJMOJZJKCJ-VUSYMWPTSA-N	441.956	1.624	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1CCN(S(C)(=O)=O)CC1)C2	1793680575	BNCJVEOVFVTUJQ-YVSFHVDLSA-N	434.002	1.704	50	20	IDGD	
COc1cnc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)Br)C3)c(F)c1	1794453717	ZJLYMGISUOJFQE-NJBDSQKTSA-N	430.274	1.216	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1Cc2ccccc2CN1	1796373570	MZFNISHQFIMZPQ-NAIAOIPJSA-N	440.371	1.527	50	20	IDGD	
CC(=O)Nc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)Br)C3)ccn1	1796747180	YPZNYRUNZQMPOA-HPAJIGNASA-N	439.310	1.027	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CS[C@@H]1CCCCO1	1797791711	QGNYPAWZXXEMGV-BDLOOMQFSA-N	449.411	1.867	50	20	IDGD	
CC(C)c1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)n[nH]1	1798439865	LOXSAOZZVKNCLJ-BTTYYORXSA-N	425.493	1.097	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccnc(C(F)F)c1)C2)[C@H](F)Br	1799347412	KCIXHLQIPSWJHV-LFSVMHDDSA-N	436.228	1.913	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(F)(F)c1ccco1)C2)[C@H](F)Br	1799347462	PYMROSWPXGQENR-QCMRWSPLSA-N	425.201	1.652	50	20	IDGD	
CN1CCc2cc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@@H](F)Br)ccc21	1799347883	WJHQZROCCKRTCF-YALNPMBYSA-N	440.313	1.573	50	20	IDGD	
CC[C@H](CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](O)CCl)C2)NC(=O)OC(C)(C)C	1800184310	VHZIFSAJJXBXQX-LJIZCISZSA-N	431.961	1.918	50	20	IDGD	
CN(CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CCCO1)NC(=O)NCc1ccccc1	1801920981	SIQJBFHXEGXZJA-YRPNKDGESA-N	443.548	1.150	50	20	IDGD	
C[C@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc3n(n1)CCCNC3=O)C2	1801962409	IOEFYADITFIBHU-RVMXOQNASA-N	438.326	1.052	50	20	IDGD	
COCCOCCOCCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCBr)C2	1802083160	ZMODWAVLOSVAFY-MUJYYYPQSA-N	435.359	1.479	50	20	IDGD	
C#CC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2	1802126515	IDWSNEOGFMMMMM-AICCOOGYSA-N	431.892	1.027	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(=O)c3ccccc3o1)C2	1802333666	BDWAHMLOUGEAAG-MUJYYYPQSA-N	440.500	1.418	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H]1CCc3ccccc3[C@H]1O)C2	1802334476	LETSYBJHSUOVFK-PSBIQLRGSA-N	442.560	1.294	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H]2Cc3ccccc3O2)[C@H]1c1cccnc1)[C@@H](O)CCl	1803143283	YWQIOUKMBOCQCD-ZULIPRJHSA-N	429.904	1.691	50	20	IDGD	
Nc1c(C(=O)N2CCC3(CCCN(C(=O)[C@H](O)CCl)C3)CC2)sc2nccnc12	1805520048	ZQFQPDBCJQKTBW-GFCCVEGCSA-N	437.953	1.718	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H](CNC(=O)C(=O)N(C)C)[C@@H]1c1cccnc1	1806946723	PYMQQZQZNFXXSG-ILXRZTDVSA-N	425.327	1.349	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2cc(=O)n3[nH]cnc3n2)[C@H]1c1cccnc1	1807356536	CFCPDWHDVFCVDK-JKIFEVAISA-N	443.895	1.150	50	20	IDGD	
O=C(Cc1ccsc1)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1807559794	QOUMKQYOEYINNG-DENIHFKCSA-N	449.341	1.385	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1	1807998086	IHXODYMQTQKSHO-BNLOLNQZSA-N	449.305	1.991	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cnc(O)[nH]2)[C@@H]1c1cccnc1)[C@H](F)Br	1808668139	IZTBQIGETLLISS-UHTWSYAYSA-N	426.246	1.520	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)[C@@H](C)Nc2cnccn2)[C@@H]1c1cccnc1	1810325452	NTAHOFGEAGBVIF-NWGLXNPWSA-N	446.939	1.632	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)CNC(=O)c2cc(C)on2)[C@H]1c1cccnc1	1810380126	JOWBRTZOJUEEOT-JTDSTZFVSA-N	447.923	1.831	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2ccc(F)cc2)[C@@H]1c1cccnc1	1813072141	BVEVATKJCKYXAM-XMSQKQJNSA-N	441.507	1.913	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H](CNC(=O)CCS(C)(=O)=O)[C@@H]1c1cccnc1	1813574492	WATYLHXFBBPQGC-WBVHZDCISA-N	429.970	1.787	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1CCc2nc(NC(=O)CC(F)(F)F)sc2C1	1814450390	WCLUFKYCILRWBQ-MRVPVSSYSA-N	442.423	1.320	50	20	IDGD	
CN1CCC(C(=O)Nc2cc([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)CC1	1814493531	BMCUOHHGMJOINX-QGZVFWFLSA-N	433.557	1.117	50	20	IDGD	
C=CCOCCCC(=O)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1	1815350348	RPYYIBJJTPZBGK-MRXNPFEDSA-N	443.334	1.032	50	20	IDGD	
O=C(Cc1cccs1)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2	1815589788	OEDKOCXYSVWLEM-CQSZACIVSA-N	441.343	1.353	50	20	IDGD	
CS(=O)(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCBr)n[nH]1	1816784807	NXXMNDYRPNUEQP-GFCCVEGCSA-N	435.344	1.622	50	20	IDGD	
Cc1ccc(=O)n(C(C)(C)C(=O)N[C@H]2CCc3nc(NC(=O)[C@H](F)Cl)sc3C2)n1	1817125361	MIXCTZNAZBFQOA-HZMBPMFUSA-N	441.916	1.890	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)C1(C)CC1)CC2	1817276917	FWIQLOKCZVBHHM-BTQGWNRHSA-N	428.518	1.989	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1ccc(Cl)o1	1818425639	YJBLYMAAOQMCNE-OAHLLOKOSA-N	442.668	1.956	50	20	IDGD	
COC(C)(C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819400325	GEXLEECFBXDMEU-HNNXBMFYSA-N	429.481	1.139	50	20	IDGD	
CC[C@H](C)[C@H](O)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819401516	FRNLYQMONYNZCD-XZOAIXRZSA-N	443.508	1.121	50	20	IDGD	
C[C@H](Br)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(=O)n2O)[nH]n1	1822186700	PPXSAPQDGDIUEG-JQWIXIFHSA-N	438.282	1.898	50	20	IDGD	
O=C(c1cccn2c(O)nnc12)N1CCC([C@H]2CCCCN2C(=O)[C@H](O)CCl)CC1	1824183325	UMRHICSNBVWPHU-HZPDHXFCSA-N	435.912	1.268	50	20	IDGD	
Cc1cccnc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1	1824697242	NFHVTUWOBCYXKP-NRFANRHFSA-N	435.333	1.617	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCn1ccnn1)CC2	1825647627	RVUBSJHOAFTYOH-VHSXEESVSA-N	427.328	1.520	50	20	IDGD	
O=C([C@H](F)Br)N1CCC([C@H]2CCCCN2C(=O)CN2CCOCC2)CC1	1826718655	INXJRTGPRBEWKA-WBVHZDCISA-N	434.350	1.629	50	20	IDGD	
O=C(c1ccc(F)cn1)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827051186	OZYZBZBXZJMVGS-OAQYLSRUSA-N	439.296	1.448	50	20	IDGD	
Cc1ccc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)nc1C	1827055660	BMEPGRVXISAQMV-QHCPKHFHSA-N	449.360	1.925	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H]2CCC=CO2)CC1	1828896532	WRGWJXXXXSLREK-UXHICEINSA-N	441.532	1.611	50	20	IDGD	
COC[C@H](NC(C)=O)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCBr)CC1	1829112754	DBDMCYIADLWPCP-DLBZAZTESA-N	446.386	1.542	50	20	IDGD	
CC(C)(C)c1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)cn1	1829566510	PNZKRLQAOPRUIG-IERDGZPVSA-N	439.940	1.049	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(OC)c(F)c3)CCO2)C1	1830151705	NPZHENVOTOOWOO-QRWLVFNGSA-N	444.887	1.158	50	20	IDGD	
Cc1ccn(C)c1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2	1830542766	DPNKNMVPKZHYIQ-HNAYVOBHSA-N	442.354	1.435	50	20	IDGD	
C=CCNC(=O)/C=C\C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](Cl)COC)CC1	1831827451	YFFSDGWDWJCBAI-OPDSQHBBSA-N	425.957	1.718	50	20	IDGD	
CC(C)=NO[C@H](C)C(=O)N1CCC([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1	1831874898	XRCFBGXQOYFXGH-IEBWSBKVSA-N	437.585	1.780	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)CCNC(=S)NC)CC2)CC1	1833533738	OGFDTOZELHAUHA-KRWDZBQOSA-N	446.061	1.450	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)c3cc[nH]n3)CC2)CC1	1833560064	YCBGDSDHCIKPRY-ZDUSSCGKSA-N	426.359	1.626	50	20	IDGD	
Cc1cccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)n1	1834052111	SVQJKLMGYNUJPG-KDOFPFPSSA-N	426.311	1.243	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(F)cn3)CCO2)C1	1834481410	OCMNZKDWLFTJRU-ZWKOTPCHSA-N	434.295	1.527	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CCCSC3)C2)C1	1834826266	IGZPRTBCACDVEF-RHSMWYFYSA-N	435.384	1.371	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1)[C@@H]1CCC=CO1	1835723168	XXOYVHSFXRRKBX-JKSUJKDBSA-N	432.334	1.941	50	20	IDGD	
CN1CCCC[C@@H]1C(=O)N1CCC(N2CCC(NC(=O)[C@H](F)Br)CC2)CC1	1836413587	KKRNEQMXXUXYPH-SJORKVTESA-N	447.393	1.733	50	20	IDGD	
O=C(c1cncc2cnccc12)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836717890	DZGKZOLXUCYFDP-HXUWFJFHSA-N	446.935	1.842	50	20	IDGD	
CC(C)(C)C(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1	1837676361	SOALMDGXVMOYBM-UHFFFAOYSA-N	431.537	1.343	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ncccc3F)CCO2)C1	1838243069	HCXQQTFWIFWAKR-ACJLOTCBSA-N	444.301	1.322	50	20	IDGD	
C[C@H](C(=O)N1CCC(OC2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1)n1cccc1	1838789191	KKLXELLCORYNRO-GOSISDBHSA-N	447.580	1.421	50	20	IDGD	
CCCOc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)cc1	1839011073	JMGCQYYSQFVSEC-RXVVDRJESA-N	440.924	1.145	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)NNc3ccccc3)C2)C1	1839141495	KBBYGWHZVKCFJN-MDKPJZGXSA-N	438.956	1.465	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cccnc3Cl)C2)C1	1839142487	QGSFYECMYAYZGZ-DNVCBOLYSA-N	430.332	1.751	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3nccc(OC)c3OC)C2)C1	1839145682	CJXOQOCBMKTWFJ-JLTOFOAXSA-N	441.912	1.186	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cncc(C)c3)C2)C1	1839963779	VPJKZBOKVDKPBI-QFBILLFUSA-N	440.338	1.634	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccnc(Cl)c3)C2)C1	1840030968	BKTCYWVEOQXYJS-YVEFUNNKSA-N	446.729	1.588	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)ccc1F	1840035004	CXDZVQHWAYRAAD-IFXJQAMLSA-N	443.313	1.988	50	20	IDGD	
C[C@@H](NNc1ccccc1)C(=O)N1CCOC[C@]2(CN(C(=O)C(Cl)Cl)CCO2)C1	1840186565	AXCMFNGIGYYSJS-AUUYWEPGSA-N	445.347	1.252	50	20	IDGD	
Cc1ccc(CCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)nc1	1840186684	SEDMTSNOTOEWHM-LJQANCHMSA-N	430.332	1.583	50	20	IDGD	
O=C(C(Cl)Cl)N1CCO[C@]2(COCCN(C(=O)[C@H]3CCc4ccoc4C3)C2)C1	1840186748	OBLBCUZGBYOSID-LIRRHRJNSA-N	431.316	1.645	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1cnc(Cl)s1)C2	1843416294	UEVVDFBMRRJZGI-SSDVNMTOSA-N	434.909	1.748	50	20	IDGD	
O=C(OCc1ccccc1)N1CC(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](O)CCl)C1	1847562370	DFSCQDXRJYCNIB-OKZBNKHCSA-N	435.908	1.057	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](CC1CC1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl	1847564010	OPOAOZLCBWNECI-UGUYLWEFSA-N	429.945	1.481	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H]1C[C@H]1c1ccc(F)c(F)c1	1847612344	DAOJLIBMMDBEKU-LNMJFAINSA-N	434.487	1.643	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H]1CCN1C(=O)OC(C)(C)C	1847957148	BZDZSLVMJZBPDV-XUXIUFHCSA-N	430.343	1.981	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H]1CCCOC1	1848098872	IRUJMRJEKMISCE-VGWMRTNUSA-N	429.945	1.747	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CCCc1ccncc1	1848226905	CQRDFYLYICVXNA-FMEPYYHXSA-N	436.516	1.740	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)CS[C@@H](C)C(=O)Nc2cc(C)on2)cc1	10567810	KZFOJJLPFUEMPU-ZDUSSCGKSA-N	434.474	1.356	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2ccc(OCC(F)(F)F)nc2)c2ccccc2c1=O	14346584	HENUZMBZPIGZBA-UHFFFAOYSA-N	435.362	1.827	50	20	IDGD	
CCCCN1C(=O)c2ccc(C(=O)NNC(=O)COc3ccccc3OC)cc2C1=O	15884607	AOUGGEKGJXZJLN-UHFFFAOYSA-N	425.441	1.931	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(C(=O)NNC(=O)COc2ccccc2OC)cc1	15884618	YAPIQWPTVDFSLR-UHFFFAOYSA-N	435.502	1.566	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1cc(-c2ccco2)n(-c2cccc(Cl)c2)n1	25452957	HKWZNUCNSDEUOI-GFCCVEGCSA-N	448.888	1.981	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)c1cc(S(=O)(=O)NC)ccc1C	26793296	VIMRTMSMQKVVDV-UHFFFAOYSA-N	429.502	1.276	50	20	IDGD	
O=C(CNC(=O)c1ccc(Br)cc1)NNC(=O)c1cc(Br)c[nH]1	28717688	DBCWHOVISYTVGO-UHFFFAOYSA-N	444.083	1.731	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)NC[C@H]3CCCO3)c2)cc1	138671325	FJPBHYZJKKNZHA-QGZVFWFLSA-N	433.486	1.227	50	20	IDGD	
N#Cc1ccc(N2CCN(C(=O)NNC(=O)c3cc(Br)c[nH]3)CC2)c(F)c1	725860721	WJQJAUABTXGLTA-UHFFFAOYSA-N	435.257	1.965	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CCN(Cc2ccccc2)C(C)=O)cc(OC)c1OC	726134874	QJQHTYUWUXSJEJ-UHFFFAOYSA-N	429.473	1.912	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)NCCN2CCS(=O)(=O)CC2)c(C)n1-c1ccccc1F	726939255	RJEWZLDKRWVJJC-RGEXLXHISA-N	444.532	1.987	50	20	IDGD	
CC(C)Oc1ccc(NC(=S)NNC(=O)c2ccc(F)c(S(N)(=O)=O)c2)cc1	727495666	UJHWSKUXLYZHCD-UHFFFAOYSA-N	426.495	1.892	50	20	IDGD	
CC(C)COc1ncccc1C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	728669768	BAKQFEBBNZPYSQ-KRWDZBQOSA-N	429.429	1.261	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N1CCN(C(=O)N(C)C)CC1	728943117	HGUWFUVXWXWDAH-GFCCVEGCSA-N	442.314	1.256	50	20	IDGD	
O=C(NNC(=O)c1c(F)ccc(S(=O)(=O)NC2CC2)c1F)c1ccc([N+](=O)[O-])cc1	729833934	RDOAARWKQQRPHA-UHFFFAOYSA-N	440.384	1.389	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCN(c2ccc3c(c2)OCCO3)C1=O)c1cc2c(s1)CCC2	730516921	PDLPKCDFVBONLI-CQSZACIVSA-N	427.482	1.822	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCN(c2ccc3c(c2)OCCO3)C1=O)c1cccc2ncccc12	730550102	VSUFCSOWRMOQDM-QGZVFWFLSA-N	432.436	1.820	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2sccc2S(=O)(=O)N(C)C)cc(OC)c1OC	731957538	PNBXIWYAKBCACF-UHFFFAOYSA-N	443.503	1.099	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1	732052868	TXMGVDAEIRHGBC-GFCCVEGCSA-N	442.457	1.678	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)NCCN2CCN(C(=O)C3CCCCC3)CC2)cc(C#N)n1C	733177938	MYYIKBLZSTZVGZ-STZFKDTASA-N	436.560	1.953	50	20	IDGD	
O=C(NNC(=O)C(=O)N1CCCC1)N[C@@H]1CCN(c2cccc(OC(F)(F)F)c2)C1	734067344	KCKOWZJYJKKJOY-GFCCVEGCSA-N	429.399	1.117	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	734825393	DCGLDCYCYAZPNH-UHFFFAOYSA-N	429.518	1.631	50	20	IDGD	
Cc1n[nH]cc1C(=O)NN=C1C(=O)N(CC(=O)N(C)C)c2ccc(Br)cc21	735410835	ZIGBDUNHMYHUPJ-UHFFFAOYSA-N	433.266	1.050	50	20	IDGD	
CN(C)c1cccc(-c2nnc(SCC(=O)NNC(=O)c3cccc(Cl)c3)n2N)c1	735981047	YNUJBYCGMGNIQH-UHFFFAOYSA-N	445.936	1.932	50	20	IDGD	
CS(=O)(=O)CC[C@H](Cc1cccc(Br)c1)C(=O)NNC(=O)C1CCC1	741220531	SJWJMFYOZCRYAW-CQSZACIVSA-N	431.352	1.990	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c(C)c1	741880459	RJJGTOLZGSEWGK-UHFFFAOYSA-N	433.486	1.099	50	20	IDGD	
CC(C)[C@@H](NC1CCOCC1)C(=O)NNc1ccccc1S(=O)(=O)NC(C)(C)C	743417112	YANRTECPORIATN-GOSISDBHSA-N	426.583	2.000	50	20	IDGD	
O=C(Cc1cc2c(cc1Br)OCCO2)NNC(=O)[C@@H]1COc2ccccc2O1	743818160	QLNSTJWPUFQTQN-KRWDZBQOSA-N	449.257	1.750	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)[C@H]2CCCN2C(=O)Cc2ccccc2)cc1	744861977	LNYGJUSXMLZVBX-LJQANCHMSA-N	434.452	1.096	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CCC[C@H]1C(=O)OCC(=O)NNC(=O)c1cccc(C#N)c1	745074878	SOWRPOGIGUZUKM-HZPDHXFCSA-N	430.461	1.556	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)c1ccc(S(N)(=O)=O)s1	745485153	JUFAAAZHRUDUIA-QMMMGPOBSA-N	448.320	1.387	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@@H]2[C@@H]3CCCO[C@H]3C2(C)C)cc1	745860367	QNURABMWXQQNAK-CGTJXYLNSA-N	438.550	1.150	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)[C@@H]1CCCN(C(=O)CCOc2ccccc2)C1	746544961	CIJMMPGPJKUNTF-GOSISDBHSA-N	449.511	1.732	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2ccc(-c3ccccn3)nc2O)ccc1Cl	746817865	KESDZLQBVOZNRS-UHFFFAOYSA-N	447.860	1.225	50	20	IDGD	
C[C@H]1CCCC[C@@]12NC(=O)N(CC(=O)NNc1nc(-c3ccccn3)nc3c1CCC3)C2=O	747983137	RGJYDDUDEDNCRV-LFVRLGFBSA-N	449.515	1.971	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCCC(=O)N2CCCCCC2)nc1	748463566	WVLWGTTWVRZHJZ-UHFFFAOYSA-N	426.543	1.187	50	20	IDGD	
Cc1cc(Br)ccc1NNC(=O)[C@@H]1CC(=O)N([C@@H]2CCS(=O)(=O)C2)C1	748730171	KJMVIBPDHBORHY-DGCLKSJQSA-N	430.324	1.236	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)N[C@@H]1CCN(c2cccc(Cl)c2)C1=O	750266347	IAHLOKWJRCSFOW-OAHLLOKOSA-N	432.864	1.863	50	20	IDGD	
C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)NNC(=O)CNC(=O)c3ccco3)cc2[N+](=O)[O-])C1	751212810	YPRLDZVNIQTJRO-ZIAGYGMSSA-N	443.460	1.861	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)c2cc(S(N)(=O)=O)cc(C)c2C)cc1	751545877	GXACWNVXOJDDBD-CQSZACIVSA-N	435.502	1.578	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NC[C@H](c2cccnc2)C(C)C)cc1	751813019	DKGNYPRPUJDAEC-IBGZPJMESA-N	447.561	1.781	50	20	IDGD	
CCNC(=O)C1(CNC(=O)NNC(=O)c2cc(OC)ccc2Br)CCC1	753744804	CIHSTJUVLAMHKS-UHFFFAOYSA-N	427.299	1.708	50	20	IDGD	
O=C(NNC(=O)N1CCC[C@H](S(=O)(=O)N2CCc3ccccc32)C1)c1ccccc1	754142095	VBXVTTHXHAYMBE-SFHVURJKSA-N	428.514	1.898	50	20	IDGD	
COc1ccc(C2(C(=O)NNC(=O)c3csc(N4CCOCC4)n3)CCC2)cc1OC	754850742	RCTPYRYWUJIXAM-UHFFFAOYSA-N	446.529	1.880	50	20	IDGD	
O=C(NNc1ccc(C(F)(F)F)nn1)c1ccc(S(=O)(=O)NC[C@H]2CCCO2)cc1	755183241	IMSHTSRKYRIGKE-GFCCVEGCSA-N	445.423	1.710	50	20	IDGD	
CCCCNS(=O)(=O)c1cccc(NC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1	755533602	CKGYTOKMMKEQOQ-GOSISDBHSA-N	448.501	1.758	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)c2cc3ccccc3cc2O)n([C@H]2CCS(=O)(=O)C2)n1	755535547	QJSTWOXUPOEBCH-HNNXBMFYSA-N	443.485	1.876	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)ccc1O)Nc1cccnc1N1CCOCC1	756184119	RXPYBZAMFAAURL-UHFFFAOYSA-N	436.266	1.853	50	20	IDGD	
CCOc1cc(C(=O)N(C)C)ccc1NC(=O)NNC(=O)c1nnc(O)c2ccccc12	756867694	AWDRRKUZQGZMTL-UHFFFAOYSA-N	438.444	1.902	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)Nc1cccc(S(=O)(=O)Nc2nccs2)c1	756874147	OMBARKSMBQOYBO-NSHDSACASA-N	443.507	1.148	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)CCc2ccccc2O)ccc1S(=O)(=O)N(C)C	757776536	QVRIHKWENUYSJQ-UHFFFAOYSA-N	436.490	1.437	50	20	IDGD	
C=CCn1c(=O)c2ccccc2n2c(SCC(=O)NNc3ncc(F)cn3)nnc12	760922595	KPVXLDNNAXGXNV-UHFFFAOYSA-N	426.437	1.395	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)N[C@H]1CCN(Cc2ccccc2)C1=O	761674316	YUPIWSUIIXMILJ-INIZCTEOSA-N	428.514	1.919	50	20	IDGD	
CC(=O)N[C@H](C)c1ccc(S(=O)(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)s1	763439929	YPRVTAPVLZGYHD-LLVKDONJSA-N	448.567	1.560	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1cc(F)c(Cl)cc1F	763589306	LYHMRZGQCIXJLB-UHFFFAOYSA-N	436.846	1.837	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2cc3c(cc2[N+](=O)[O-])OCCCO3)c1	763628992	CYJLGZLJMBALFE-UHFFFAOYSA-N	444.400	1.229	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2ccccc2S(=O)(=O)C(C)C)c1	763665438	IWYAJZKALQFDFL-UHFFFAOYSA-N	447.513	1.650	50	20	IDGD	
COc1ccc(F)cc1NC(=O)C(=O)NNC(=O)COc1ccc(Br)cc1	763694373	GGVSYSSFPSERIB-UHFFFAOYSA-N	440.225	1.762	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccn(CCc2ccncc2)n1	763717532	YNNLQJZIIATGFN-UHFFFAOYSA-N	436.472	1.248	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2nnc(O)c3ccccc23)n([C@@H]2C[C@H]3CC[C@H]2C3)n1	763790560	KZLYIAACVXQALY-HEHGZKQESA-N	449.471	1.601	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccnn1Cc1ccccn1	763848639	DWBBQIXDZPWKAL-CYBMUJFWSA-N	426.408	1.019	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2nn(C(C)(C)C)cc2C#N)c1C	763851302	RPRLPVYSLFDRBB-AWEZNQCLSA-N	426.477	1.680	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccc(C(=O)NC(C)(C)C)cc1	763865460	QGJCQLKAMANMDR-ZDUSSCGKSA-N	444.463	1.907	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1cccn(CC(F)(F)F)c1=O	763866097	TWGOGFAQMWTFQQ-SNVBAGLBSA-N	444.341	1.103	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)C2=S=C3CCCCCCC3=C2)n(CCC#N)n1	763912481	WLKHFKPUUAQBIT-UHFFFAOYSA-N	428.518	1.563	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cccc(C(N)=O)n2)ccc1OCCC(C)C	763913917	FJJLHJJDGBWMPU-UHFFFAOYSA-N	443.460	1.014	50	20	IDGD	
O=C(NNC(=O)c1ccc(Br)s1)C(=O)Nc1cccc2c1OCCC2=O	763942119	UPRXWNXBFVHQKH-UHFFFAOYSA-N	438.259	1.876	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)on1)C(=O)Nc1ccc(C(=O)NC2CC2)cc1	764003595	IUILLTMKHKCCSQ-UHFFFAOYSA-N	433.424	1.634	50	20	IDGD	
CSCc1nc2ccccc2n1CC(=O)OCC(=O)NNC(=O)Cc1nc(C)cs1	764008374	GJBBUXQKDNXNCK-UHFFFAOYSA-N	447.542	1.598	50	20	IDGD	
CCc1cc(O)nc(-c2cccc(NC(=O)C(=O)NNC(=O)Cc3ccsc3)c2)n1	764034729	UOYMCXBYWAPSFT-UHFFFAOYSA-N	425.470	1.802	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1)[C@@H]1CN2CCCN1CC2	764074178	DRSKCSCBIKVKEO-PKTZIBPZSA-N	433.556	1.151	50	20	IDGD	
C[C@@H]1CN(Cc2ccccc2NC(=O)C(=O)NNC(=O)CCc2ccco2)C[C@@H](C)O1	764176748	FRCFGFJBCBRKBK-HZPDHXFCSA-N	428.489	1.608	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(NC(=O)C(=O)NNC(=O)CC(C)(C)C)ccc1C	764197587	FNTVVKJYLXYWJD-UHFFFAOYSA-N	426.539	1.548	50	20	IDGD	
CC(C)CCC(=O)NNC(=O)C(=O)Nc1cnc2c(c1)C[C@H](NC(=O)OC(C)(C)C)CC2	764202234	ABVVEMHBERHPJR-OAHLLOKOSA-N	447.536	1.986	50	20	IDGD	
COC(=O)CCSc1cccc(NC(=O)C(=O)NNC(=O)c2cccc(C#N)c2)c1	764235891	SQAWNNPERSUGQW-UHFFFAOYSA-N	426.454	1.613	50	20	IDGD	
COC(=O)Cc1ccccc1NC(=O)C(=O)NNC(=O)CSc1ccccc1OC	764394142	XFFUIQXEVXRRBT-UHFFFAOYSA-N	431.470	1.289	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)[C@@H](C)S(=O)(=O)C2CCOCC2)c(C)n1-c1ccccc1	764519790	FSQCVTGVDVBWLW-MRXNPFEDSA-N	433.530	1.837	50	20	IDGD	
CC(=NNC(=O)[C@H](C)CN1C[C@H](C)O[C@H](C)C1)c1ccc(Cl)c(S(N)(=O)=O)c1	764667426	RUUCKSDNRFMTEK-UPJWGTAASA-N	430.958	1.573	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NCCOCC(F)(F)C(F)F)cc1	764837541	DSQCELNCVNWXPI-UHFFFAOYSA-N	430.380	1.343	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)COc2ccc3c(c2)CCC(=O)N3)n[nH]1	765592563	OSQJDMIKIRBIIV-UHFFFAOYSA-N	435.440	1.810	50	20	IDGD	
C[C@](O)(C1CCN(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)CC1)C(F)(F)F	767330401	RTSUHXQSYKOCNI-SFHVURJKSA-N	444.458	1.459	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)[C@@H](C)NS(=O)(=O)c1ccc(C#N)cc1	767734175	JJZIRKNKUDGNFL-CQSZACIVSA-N	430.486	1.014	50	20	IDGD	
COc1ccc(CC(=O)NNc2nc3ccccc3[nH]2)cc1S(=O)(=O)N1CCOCC1	768492888	WNJQCPIRYCMDIB-UHFFFAOYSA-N	445.501	1.278	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)NC2CCN([C@H]3CCC[C@H]3O)CC2)cc1	769155277	MUYDAHNGJLZGRE-UIAACRFSSA-N	434.537	1.561	50	20	IDGD	
Cc1ccc(S(=O)(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)c(Cl)n1	769650030	BREJMCJFSGXUHR-UHFFFAOYSA-N	435.893	1.958	50	20	IDGD	
O=C(NNc1ccc(F)cc1Br)Nc1cnn(CC(=O)N2CCOCC2)c1	770053289	XFWNIDGHFLEMEG-UHFFFAOYSA-N	441.261	1.792	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)C[C@@H]2Oc3ccccc3NC2=O)C1	773411759	QYDHHILBUVFAKX-BBRMVZONSA-N	432.477	1.571	50	20	IDGD	
CCOc1cc(N2CCN(C)CC2)ccc1NC(=O)C(=O)NNc1ccc([N+](=O)[O-])cc1	773639377	OJIKNXYQKRQEPF-UHFFFAOYSA-N	442.476	1.827	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2)cc1NC(=O)CCN(C)C	773643780	GATAXZOJAXCMPV-UHFFFAOYSA-N	428.449	1.875	50	20	IDGD	
COCCS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccc3ccccc3n2)cc1	773662324	PXTOXOCSIQXYJX-UHFFFAOYSA-N	428.470	1.737	50	20	IDGD	
CN1CCC[C@@H](N(C)C(=O)c2ccc(NC(=O)C(=O)NNc3ccc(C#N)cc3)cc2)C1	773692343	FLADAXKXDJJKHM-HXUWFJFHSA-N	434.500	1.806	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)Nc2cc(OC)n(C)n2)cc1	775076906	RLFWGXSUCWPYGO-XNTDXEJSSA-N	449.471	1.722	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccccc1S(=O)(=O)N1CCCC1)c1cc2ccccc2o1	775282935	MXQNMXVOJJLJNY-UHFFFAOYSA-N	449.510	1.841	50	20	IDGD	
Cc1n[nH]c(C)c1CC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	776324268	ZUJRDXDHVJLETI-UHFFFAOYSA-N	433.515	1.893	50	20	IDGD	
COc1ccc(C(=O)NNc2cccc(S(C)(=O)=O)c2)cc1S(=O)(=O)N(C)C	776527516	NDABNUYDXDXPJZ-UHFFFAOYSA-N	427.504	1.106	50	20	IDGD	
CSC[C@H](C(=O)NNc1cccc(S(C)(=O)=O)c1)N1C(=O)[C@H]2CCCC[C@H]2C1=O	776537359	CAGDQAFPRCWZHB-OWCLPIDISA-N	439.559	1.440	50	20	IDGD	
COc1nc(C)c(Br)cc1C(=O)OCC(=O)NNC(=O)c1cccs1	777115546	BFSPFFCESGTENN-UHFFFAOYSA-N	428.264	1.841	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1cc([N+](=O)[O-])c2nsnc2c1	777795633	DYNOAVXXWXIPDX-UHFFFAOYSA-N	449.474	1.276	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@]2(C[C@@H]2C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)C1	780601438	VQRQLDSLWLMOAS-OPAMFIHVSA-N	444.536	1.488	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3c[nH]nc3-c3ccsc3)cc2)CC1	780950403	HFKFOBHIMFYRHK-UHFFFAOYSA-N	446.558	1.831	50	20	IDGD	
CC(=O)N1CCN(Cc2ccccc2NC(=O)NNC(=O)COCc2ccccc2)CC1	782078713	NVQJPGYGYOUTQW-UHFFFAOYSA-N	439.516	1.720	50	20	IDGD	
Cc1ccc(Cn2nccc2NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)o1	782892242	AMHMODGLCMDKRP-UHFFFAOYSA-N	435.444	1.048	50	20	IDGD	
O=C(NN=Cc1cc(-n2ccnc2)cs1)C(=O)NN=Cc1cc(-n2ccnc2)cs1	783784698	URRQSFMCAWGXCM-UHFFFAOYSA-N	438.498	1.781	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)C(=O)Nc1ccc(COc2ccccc2)cc1	784002928	XNSFDSYHHDJOKW-UHFFFAOYSA-N	436.424	1.375	50	20	IDGD	
CS(=O)(=O)Cc1cccc(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2Cl)c1	784380075	LLGMFQJYRWDLSC-UHFFFAOYSA-N	426.838	1.875	50	20	IDGD	
NS(=O)(=O)c1cc(F)cc(NC(=O)C(=O)NNc2ccc(OC(F)(F)F)cc2)c1	784801549	FGXNHRYPYXRRLW-UHFFFAOYSA-N	436.343	1.454	50	20	IDGD	
CC(=O)N1CCN(Cc2cccc(NC(=O)C(=O)NNc3cc(Cl)ccn3)c2)CC1	784856901	YHJDSPDRXITXPN-UHFFFAOYSA-N	430.896	1.481	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)[C@@H](c1ccccc1)N1CCC(O)CC1	785019468	JBRCZDAOSCYLOV-HSZRJFAPSA-N	435.528	1.944	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)N1CCc2c1cccc2C(F)(F)F	785022911	AZLILGADRDRMSG-UHFFFAOYSA-N	438.318	1.670	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)Nc1ccc(-n2cccn2)c(Cl)c1	785023963	SDJSKWCADCOTTI-UHFFFAOYSA-N	444.791	1.539	50	20	IDGD	
N#Cc1ccc(NNC(=O)C(=O)Nc2ccc(C[C@H]3CC(=O)NC3=O)cc2)cc1Cl	785092083	AEELVMSURQPVAY-ZDUSSCGKSA-N	425.832	1.499	50	20	IDGD	
CCn1c(COC(=O)/C(C#N)=C/C2CC2)nc2cc(S(=O)(=O)N3CCOCC3)ccc21	786678527	DVICZSWEXBBDOH-LFIBNONCSA-N	444.513	1.980	50	20	IDGD	
C[C@H]1CN(c2ccccc2F)CCN1C(=O)NNC(=O)c1csc(N2CCOCC2)n1	788987899	AEDBNSXHVMCEAI-AWEZNQCLSA-N	448.524	1.684	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)Nc1ccnn1-c1nc(C)cc(C)n1	789309814	MHEIZUFRXSBGDM-UHFFFAOYSA-N	425.449	1.910	50	20	IDGD	
COC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)cc1F	789809667	DEXNTQXRKGAAFP-YOEHRIQHSA-N	444.419	1.663	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)c2ncccc12	789809669	DJVZYEVGFMCJFZ-YWZLYKJASA-N	434.452	1.902	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1	789852834	WMZBAAHRXXYWRP-UHFFFAOYSA-N	433.384	1.747	50	20	IDGD	
CC(=O)N1CCCN(c2ccc(F)cc2NC(=O)C(=O)NNC(=O)OC(C)(C)C)CC1	790952331	MLLDKDCYFAXUDG-UHFFFAOYSA-N	437.472	1.379	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@@H](C)n1ccc2ccccc2c1=O	791196227	PFKFVUCNBAZRNE-CQSZACIVSA-N	441.513	1.625	50	20	IDGD	
C[C@@](O)(Cn1cc(C(F)(F)F)ccc1=O)C(=O)NNC(=O)c1cccc2ncccc12	792149940	SUXBGMCYSUPBBW-LJQANCHMSA-N	434.374	1.628	50	20	IDGD	
COc1ccc(Cn2cc(NC(=O)C(=O)NNC(=O)c3cccc4ncccc34)cn2)cc1	793026524	RWYXQVWYJOXFNT-UHFFFAOYSA-N	444.451	1.888	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(C)(C)[C@H]1C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	793424658	SXQYQRQJUCSCHW-OAHLLOKOSA-N	432.525	1.486	50	20	IDGD	
COc1ccccc1OCC(=O)NN=C[C@@H]1CCCN(C(=O)CNC(=O)OC(C)(C)C)C1	794469518	VBWXORTVKJPBHF-INIZCTEOSA-N	448.520	1.939	50	20	IDGD	
C[C@H](Cn1ccc2ccccc21)C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	794763992	PEAANPCMDIJKJP-OAHLLOKOSA-N	428.514	1.989	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)OCc2n[nH]c(C)n2)cc1	795282916	ZUQVISPIFGEWGT-OQLLNIDSSA-N	435.444	1.511	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)NCc2ccco2)(n2cccn2)CC1	795587691	ONDDRSMDKZNELW-UHFFFAOYSA-N	432.481	1.733	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2cc(S(=O)(=O)N3CCCC3)ccn2)cc1OC	797674319	RXDBVBHCLYFIFF-UHFFFAOYSA-N	449.489	1.350	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CC[S@@](=O)c2ccc3c(c2)OCCO3)cc1C	798309903	LTIOKAXZLPNKSA-WJOKGBTCSA-N	445.497	1.358	50	20	IDGD	
Cn1ncc2c1C[C@@H](C(=O)NNC(=O)CN1CCN(Cc3ccccc3Cl)CC1)CC2	798980132	FJRSHKCPNNDQGV-INIZCTEOSA-N	444.967	1.144	50	20	IDGD	
C[S@@](=O)C1(CNC(=O)NNC(=O)[C@@H]2Cc3ccccc3CN2Cc2ccccc2)CC1	799368674	YKYJCCFRDQBMOU-PKHCJMHPSA-N	440.569	1.855	50	20	IDGD	
CCOC(=O)c1ccccc1S(=O)(=O)NNC(=O)c1cc(OC)c(OC)c(OC)c1	799519543	JXEBIISBLHAUJN-UHFFFAOYSA-N	438.458	1.512	50	20	IDGD	
CN(c1ccccc1)S(=O)(=O)c1cccc(C(=O)NNC(=O)N=c2cc[nH]cc2)c1	802028947	GDNDZZGNTIZSMI-UHFFFAOYSA-N	425.470	1.795	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)CN2C(=O)N[C@]3(C[C@H](C)CC(C)(C)C3)C2=O)cc1	802058675	LJWYJJOVDHYPBV-ASSNKEHSSA-N	431.493	1.985	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)cc1N1CCNC1=O	802068095	ZMQYMDHJZHUUSR-UHFFFAOYSA-N	447.473	1.095	50	20	IDGD	
CC(C)CC(=O)NNC(=O)NC[C@H](N1CCN(C(=O)OC(C)(C)C)CC1)C(F)(F)F	802466408	YCOZBWSWNQQUID-ZDUSSCGKSA-N	439.479	1.847	50	20	IDGD	
Cn1cccc(NC(=O)C(=O)NNc2c(Br)cccc2Br)c1=O	802600214	ORRBLALSVGFARW-UHFFFAOYSA-N	444.083	1.992	50	20	IDGD	
C[C@H]1CN(C(=O)Cn2cc(NC(=O)NNc3nccnc3C3CCC3)cn2)C[C@@H](C)O1	806325422	FJLJKMOSWFZSFR-OKILXGFUSA-N	428.497	1.725	50	20	IDGD	
COCCNC(=O)[C@H](C)OC(=O)c1ccc(NC(=O)NNC(=O)c2ccccc2O)cc1	806748245	MNJBHJPVVAONQI-ZDUSSCGKSA-N	444.444	1.167	50	20	IDGD	
COCCNC(=O)[C@H](C)OC(=O)c1ccc(NC(=O)NNC(=O)c2scnc2C)cc1	806752737	KWWFRGVPJOTNOV-LBPRGKRZSA-N	449.489	1.226	50	20	IDGD	
COCCNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)CSc2ccc(C)cc2)c1	806975018	KKWHERSPPYLRCY-UHFFFAOYSA-N	444.513	1.249	50	20	IDGD	
Cc1cc(I)cc(NC(=O)C(=O)NNC(=O)c2scnc2C)c1	806978540	GCDXGBFTVWBMAU-UHFFFAOYSA-N	444.254	1.764	50	20	IDGD	
CNC(=O)c1cccc(NC(=O)C(=O)NNc2ccccc2[N+](=O)[O-])c1Br	806984686	PNSNTVBYIHXGOR-UHFFFAOYSA-N	436.222	1.799	50	20	IDGD	
Cc1cc([N+](=O)[O-])ccc1NNC(=O)C(=O)Nc1ccc(C[C@H]2CC(=O)NC2=O)cc1	807456409	KSYYYOOOHYFUAQ-ZDUSSCGKSA-N	425.401	1.190	50	20	IDGD	
O=C(NNc1nccnc1C1CCC1)C(=O)Nc1ccc2c(c1)C(=O)N(CC1CC1)C2=O	807462193	OEGJLFVGLXDQPQ-UHFFFAOYSA-N	434.456	1.832	50	20	IDGD	
C[C@@H]1[C@@H](NC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])CCN1Cc1ccccc1	807621776	JYAYMDWBJKTBOS-WBVHZDCISA-N	427.461	1.967	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)c2cc(N3CCOCC3)ccn2)C1	808011303	SBMZUMZXWXWFSM-HNNXBMFYSA-N	433.509	1.326	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)c1ccc(NS(=O)(=O)C(F)(F)F)c(C)c1	808045632	OTVLLXBNLDYZAU-UHFFFAOYSA-N	441.428	1.807	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(C(=O)NNC(=O)CNc2ccc(C)cc2C)cc1	811290594	MUZVELVSRGPHIS-UHFFFAOYSA-N	434.518	1.101	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2c(C)nsc2NC2CC2)cc1	814210775	JSKFSOIDFAGXGI-UHFFFAOYSA-N	437.547	1.416	50	20	IDGD	
CCc1cnc(C=NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)s1	814710825	SRTRVTCBSRYGEK-UHFFFAOYSA-N	436.559	1.809	50	20	IDGD	
COCCN1[C@H]2CC[C@H]1CC(N(C)CC(=O)NNC(=O)c1cc(Cl)ccc1OC)C2	815211717	OULYPJRWDHBCLD-HOTGVXAUSA-N	438.956	1.683	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc([C@@H]2CCOC2)cc1	815565490	QHJRUOAYCOANGG-MRXNPFEDSA-N	427.457	1.754	50	20	IDGD	
Cc1nc(NC(=O)C(=O)NNC(=O)c2ccc(COc3ccc(Cl)cc3)cc2)nn1C	815565535	RUJBGMWOOJAKKY-UHFFFAOYSA-N	442.863	1.756	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)cc1)[C@H]1C[C@H]1C	815568277	BMEGRDCITGFHQF-MJWYBRSISA-N	436.468	1.538	50	20	IDGD	
CCN(CC)C(=O)Cn1ccc2cc(NC(=O)C(=O)NNc3ncncc3F)ccc21	815766224	RLOMVLTTWWYYPA-UHFFFAOYSA-N	427.440	1.521	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@H]2CCCO2)n(-c2ccccc2C(F)(F)F)n1	815780434	XFUNRFKETHSDMJ-CYBMUJFWSA-N	425.367	1.464	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@@H]1CCO[C@@H](c2ccccc2)O1	816827747	CWGLEDCVGHWKAF-HNAYVOBHSA-N	432.502	1.553	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)/C(=C/c2ccc(F)cc2)n2nnnc2C)c1	818025567	ZVNRMRQXVUFWEM-LSCVHKIXSA-N	426.408	1.597	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)CN2C(=O)N[C@](C)(c3ccc(F)cc3)C2=O)c2ccccc2n1	818516029	MASWPOCGARIKEI-HSZRJFAPSA-N	449.442	1.911	50	20	IDGD	
Cc1nc(C(C)C)nc(O)c1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	884608996	AOSBLBBJRKSUFV-UHFFFAOYSA-N	447.517	1.473	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)c2ccc(S(=O)(=O)NC(C)(C)C)cc2)C[C@@H](C)O1	912921998	XYJUUQWHUQXSBP-HUUCEWRRSA-N	440.566	1.024	50	20	IDGD	
CSC[C@@H](C(=O)NNC(=O)Cc1ccc(Cl)cc1)N1C(=O)[C@H]2CCCC[C@H]2C1=O	913160102	NWEAXKGTTJAQPP-XHSDSOJGSA-N	437.949	1.937	50	20	IDGD	
COC(=O)c1ccc(Cl)c(S(=O)(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1	914564466	IIECWNMTKNFGOE-AWEZNQCLSA-N	426.834	1.276	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)c1cn(-c2ccccc2Br)nn1	914708634	CLAYXBJDUPRTCP-MRXNPFEDSA-N	444.245	1.631	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)[C@@H]2CC(=O)N(c3ccc(F)cc3F)C2)nc2ccccc21	914748188	MCYQFHAQNVPTIF-GFCCVEGCSA-N	427.411	1.595	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)N2CCN(C(=O)CN(C)C)CC2)c(C)n1C[C@H]1CCCO1	915267774	RZJMSYPEPSECJC-NNVROAHOSA-N	427.549	1.423	50	20	IDGD	
O=C(COCC(F)(F)F)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	915808845	RMTMFFPIRAPDSX-UHFFFAOYSA-N	434.374	1.785	50	20	IDGD	
O=C(NC[C@H]1CC1(Cl)Cl)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	915907911	JJTVWIFRRDCJNS-CYBMUJFWSA-N	449.360	1.999	50	20	IDGD	
CC(=NNC(=O)COc1ccc(C)c(C)c1)c1ccc(S(=O)(=O)NCC(=O)O)cc1	916297963	RGGQWRCKBWFAEI-UHFFFAOYSA-N	433.486	1.586	50	20	IDGD	
CC(=NNC(=O)CSc1ccc(C)cc1)c1ccc(S(=O)(=O)NCC(=O)O)cc1	916345861	PQEDLAAPDYJMMP-UHFFFAOYSA-N	435.527	1.990	50	20	IDGD	
COCc1ccc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1	916424931	HDNVOLJYQAHPOT-UHFFFAOYSA-N	446.529	1.762	50	20	IDGD	
Cc1cccc([C@@H](CNC(=O)NNC(=O)COc2ccccc2F)N2CCOCC2)c1	916435408	BZMDHDWXEOZBIE-LJQANCHMSA-N	430.480	1.917	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)NCc1cccc(S(N)(=O)=O)c1	916625477	KJYSAUUHUQCPME-UHFFFAOYSA-N	445.526	1.910	50	20	IDGD	
CCn1cc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)cn1	916738002	MGPXNKKMQJVPOG-UHFFFAOYSA-N	442.501	1.848	50	20	IDGD	
O=C(Cn1nc(C2CC2)cc(C(F)(F)F)c1=O)NNC(=O)c1cccc([N+](=O)[O-])c1	917569121	RCYPKPAYOPEGOR-UHFFFAOYSA-N	425.323	1.509	50	20	IDGD	
COc1ccc([N+](=O)[O-])cc1CNC(=O)NNC(=O)c1csc(N2CCOCC2)n1	918018074	NAEQZVZWIZRCLE-UHFFFAOYSA-N	436.450	1.041	50	20	IDGD	
CS(=O)(=O)Cc1ccc(CNC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc1	918018196	PDFFMHQODNGSJP-UHFFFAOYSA-N	443.485	1.267	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)CCc1nc(O)c2cnn(-c3ccccc3)c2n1	919820572	QVIVPPVEZVBITQ-UHFFFAOYSA-N	446.467	1.852	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1)N[C@H]1CCS(=O)(=O)C1	919886781	UWXFPQOJPXEXSC-LBPRGKRZSA-N	434.430	1.518	50	20	IDGD	
NC(=O)c1ccc(/C=C/C(=O)N2CCC[C@@H]2C(=O)NNC(=O)c2c[nH]c3ccccc23)cc1	920031242	AAAGSZIZPQOKCD-RGFVMQALSA-N	445.479	1.732	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)Nc2cccc(N3C(=O)CNC3=O)c2)cc1	920933613	ZNFLQTYQQHAJET-ZDUSSCGKSA-N	441.444	1.762	50	20	IDGD	
CN1CCN(c2ccccc2NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)CC1	920934892	GYWAXTRQNHZIMR-UHFFFAOYSA-N	431.518	1.308	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)c1cccc(N2CCOC2=O)c1	920982059	KCBFELKOBKAAHZ-CYBMUJFWSA-N	436.432	1.324	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN(C(=O)COc2ccccc2)C1)c1n[nH]c2c1CCCC2	1116117157	JLUSXPIMCAIZRX-OAHLLOKOSA-N	425.489	1.367	50	20	IDGD	
Cc1csc(CCCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)n1	1251514545	UNNCAXJMMQSGKF-UHFFFAOYSA-N	425.536	1.279	50	20	IDGD	
CC(=NNC(=O)CCN1CCC(C)CC1)c1ccc(S(=O)(=O)NCCC(=O)O)cc1	1317704192	SLXLBICRNQKDMO-UHFFFAOYSA-N	438.550	1.402	50	20	IDGD	
O=C(NNS(=O)(=O)c1cnn(-c2ccccc2F)c1)c1cncn1-c1ccccc1	1318831016	SVXBAHJECHXTFN-UHFFFAOYSA-N	426.433	1.820	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2ccc(C(=O)NCC(=O)N(C)C)c(Cl)c2)cc1	1321034758	FGDLXQLYGPSLOE-UHFFFAOYSA-N	447.879	1.633	50	20	IDGD	
O=C(CCc1nc2cccnc2[nH]1)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	1322655729	YTUMFIVHQMNQFW-UHFFFAOYSA-N	442.501	1.136	50	20	IDGD	
COC(=O)c1cc(Br)cc(S(=O)(=O)NNC(=O)c2ccc(OC)cc2)c1	1339273422	WUHGZJYVNITOMQ-UHFFFAOYSA-N	443.275	1.868	50	20	IDGD	
CCC1(C(=O)N2CC[C@]3(CN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)CCO3)C2)CCC1	1778329790	WDGAACQQTGBRTE-OLCUMFGGSA-N	429.521	1.531	50	20	IDGD	
O=C(c1cc(=O)nc2sccn12)N1CC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1779955713	HBQXDCVSBIWBJZ-INIZCTEOSA-N	431.301	1.003	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)c3cn4ncccc4n3)CCO2)C1	1781229292	FWOKAMLILSBJGY-ZWKOTPCHSA-N	426.304	1.409	50	20	IDGD	
O=C([C@@H]1CNc2ccccc21)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781331060	KHGZSAWWRRAQQF-XUWXXGDYSA-N	426.286	1.716	50	20	IDGD	
CCOC(=O)C1(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](Cl)COC)C3)CC1	1781627030	LMXRYHJROUEITA-SPYBWZPUSA-N	430.929	1.097	50	20	IDGD	
COc1cc(C)c(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)cc1OC	1781889669	VXZOLIPNKAYTSD-FOIQADDNSA-N	426.897	1.055	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1nc[nH]c1[N+](=O)[O-])C2	1781998726	GERDFRHICAEMNZ-LYOVBCGYSA-N	444.286	1.229	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc4n(n3)CCCN(C)C4)C2)C1	1782559018	MDKXEEHDQDEFRR-UTKZUKDTSA-N	437.972	1.570	50	20	IDGD	
CCOC(=O)C1(C(=O)N2CC[C@]3(CN(C(=O)[C@H](Br)CC)CCO3)C2)CC1	1782923712	YNXNEPQYAJXDKX-DYVFJYSZSA-N	431.327	1.333	50	20	IDGD	
C[C@@H](Cc1ccc(F)cc1)C(=O)N1CC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1	1782928609	JOQRZCVHGNUPEK-SBUREZEXSA-N	448.539	1.207	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)Cc3nnc(C)s3)CCO2)C1	1783342035	IDHNKTKKWGVYBC-WBMJQRKESA-N	431.356	1.392	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)COc3cccnc3)CCO2)C1	1783343755	PUUYQUHPQICMAQ-CRAIPNDOSA-N	426.311	1.464	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)CCc3ccnc(OC)c3)CCO2)C1	1783872607	CWSBLRNYDXKSMQ-OXJNMPFZSA-N	425.913	1.107	50	20	IDGD	
CCn1nccc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)CBr)C[C@@H]21	1786177834	HKPAEGUHDJVXRI-YXWQFLTLSA-N	427.343	1.527	50	20	IDGD	
O=C(Cc1ccc(C(F)(F)F)cc1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21	1786548046	MFXUEEMKFHDVHX-LLLHUVSDSA-N	448.869	1.827	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc4cnccc4[nH]3)[C@H]2C1	1788421309	BMXUNUIBQGDNOY-GWIFVGGISA-N	435.322	1.940	50	20	IDGD	
O=C(CC(F)(F)C(=O)O)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1	1788569069	NIFIZUOFCJNESI-UHFFFAOYSA-N	446.215	1.224	50	20	IDGD	
Cc1nccc(C(=O)Nc2ccc(C3(NC(=O)c4cccc(B(O)O)c4)CCC3)cc2)n1	1788808389	ANTXWOGBVWQKBQ-UHFFFAOYSA-N	430.273	1.526	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1)c1ccc(F)nc1	1789712723	RWZPPEVJDLJILL-UHFFFAOYSA-N	433.248	1.962	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(Cl)c(O)cc3O)[C@H]2C1	1789995044	AEPNMTDSRJNBML-WKTARRMCSA-N	447.315	1.598	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(F)c(F)c3OC)[C@H]2C1	1790170190	GPBNGLRJLXCLPX-PCBIJLKTSA-N	446.878	1.821	50	20	IDGD	
O=C(C[C@@H]1NC(=O)NC1=O)NC1(c2ccc(NC(=O)[C@H](F)Br)cc2)CCC1	1790532880	WKPWNNZVXZDNCC-AAEUAGOBSA-N	441.257	1.409	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ncccn3)C[C@@H]21	1790961531	PAKVTDZNXBVYTP-AJNGGQMLSA-N	425.327	1.172	50	20	IDGD	
CCc1noc(C)c1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]2C1	1791059394	YTXMMVGRMVYYMX-HTUGSXCWSA-N	428.327	1.922	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CCc4ccccc4O3)C[C@@H]21	1791257821	VCQXBULVGHNHAB-CAVMOMJPSA-N	436.936	1.614	50	20	IDGD	
CCOC(=O)C(C)(C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]21	1792227488	PPMDSLADALENCJ-MNUAXYBXSA-N	437.364	1.792	50	20	IDGD	
COc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)Br)C3)cc1F	1792679273	RXXOKRHGCNQTSP-YGSHXTJESA-N	429.286	1.821	50	20	IDGD	
N#C/C(=C\c1ccc(Br)cc1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C(O)O	1792901103	KXPVKPABHIBQFV-NOFFMGQBSA-N	434.290	1.305	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(Cl)sc1Cl)C2)[C@@H](O)CCl	1792980410	HTPNBTUQSYFEAQ-NUODRBITSA-N	427.737	1.858	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1ccc2ncccc2c1)c1ccc(B(O)O)cc1	1793854525	RJPRYBBRSTUJJJ-KOUNCHBCSA-N	443.312	1.409	50	20	IDGD	
CNCCCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1794142596	HWMQAOQKIYGVRP-FZKCQIBNSA-N	430.977	1.756	50	20	IDGD	
C[C@H](Sc1ccccn1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCBr	1795117014	JAZNRWUKQCKYCF-ZJOBFFGXSA-N	442.379	1.937	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](N)c1cccc(Cl)c1	1795630501	YMPBRQNZQJSSGT-GWCDLVAZSA-N	430.332	1.183	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(Cl)nc2n[nH]cc12	1796054532	YIXALVFKTUHZKA-YJKIEOBBSA-N	426.304	1.832	50	20	IDGD	
CC(=O)N[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Cl)c1cccc(Cl)c1	1796367907	ZTRXSVQIFMLACP-IMPMIVQMSA-N	446.306	1.641	50	20	IDGD	
C=CCOCCCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C(C)=N/NC(=O)c1ccc[nH]1	1796890737	ITHBUVORAQQUBG-DPEPCVEMSA-N	429.521	1.741	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnc(N)s1)C2	1796892265	UKPRGVUDDKRFRT-PNEZKNQNSA-N	429.506	1.111	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc3sccc3[nH]1)C2	1798440360	JSAODNRXAQMRJK-CLLJXQQHSA-N	438.513	1.794	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1sccc1Cl	1798975146	XMONDDCNVIVCOW-ZSBIGDGJSA-N	433.921	1.966	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc3ncccn13)C2	1800640669	DHIJSKIWWNXPKE-XFMPKHEZSA-N	436.310	1.106	50	20	IDGD	
COc1ccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)Br)cc1C	1800756559	FEZVITYOUVMUKM-AMVTXUCVSA-N	439.350	1.919	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)Br)o1	1800759009	CVAXIOHCKZJUMT-ADGXKJENSA-N	428.283	1.225	50	20	IDGD	
COc1ccc(C)c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)Br)c1	1800759656	BRVHDBOZPWYQST-VWPFQQQWSA-N	425.323	1.990	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/c1ccccc1[N+](=O)[O-])C2	1800983299	WYMGLJREYMKMJF-WABMZUMLSA-N	437.880	1.451	50	20	IDGD	
C[C@@H](Oc1ccccn1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@](C)(Cl)CCl)C2	1801366214	CLKQABOIRVJBDV-TWAUDHPGSA-N	430.332	1.675	50	20	IDGD	
CC[C@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](C)[C@@H]1SC(=N)NC1=O)C2	1801801979	QIRPFGXSZGZVJC-QKFSQAGISA-N	445.383	1.601	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1c(Cl)cccc1OC	1801802973	OXLUTMCZARFQRT-DMVWFOPNSA-N	431.316	1.806	50	20	IDGD	
COC(=O)c1ccc(OCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)C(Cl)Cl)C3)cc1	1802229868	GFXGQSDOQORRSW-YWVIFJGQSA-N	445.299	1.245	50	20	IDGD	
CC(C)(CCl)C(=O)NC[C@@H]1CCN(C(=O)[C@H]2CCCS2(=O)=O)[C@@H]1c1cccnc1	1802901999	IJFDDZXFQQZYOY-GVDBMIGSSA-N	441.981	1.930	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)c1	1803145723	HJRNUSJBWUEPRF-HOJAQTOUSA-N	444.919	1.959	50	20	IDGD	
COc1ncc(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)cc1F	1804958665	WUTXNTFRCQOGQT-RRQGHBQHSA-N	436.871	1.544	50	20	IDGD	
COc1cnc(C(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)c(F)c1	1805078772	VMLUNSCVQWPAAW-FDQGKXFDSA-N	436.871	1.544	50	20	IDGD	
CN1CCN(C2(C(=O)N3CC[C@H](CNC(=O)[C@@H](F)Cl)[C@@H]3c3cccnc3)CC2)CC1	1808314146	CPOGOQLHFYYMPL-FGTMMUONSA-N	437.947	1.402	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)N1CCCC2(CCN(C(=O)[C@H](C)CBr)CC2)C1	1810811813	LMOVFPDGHODOGF-KGLIPLIRSA-N	431.375	1.696	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2nccnc2C(N)=O)[C@@H]1c1cccnc1	1811191969	UHKBLGSRAUZEEI-ZQIUZPCESA-N	430.896	1.308	50	20	IDGD	
COc1cc(C(=O)NC[C@@H]2CCN(C(=O)CO[Si](C)(C)C)[C@H]2c2cccnc2)nn1C	1811633284	DYLQKSZYYFSBQS-JXFKEZNVSA-N	445.596	1.995	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)CSCC(=O)O)[C@@H]1c1cccnc1	1813033856	VJEYCMDEUOIGSS-JKIFEVAISA-N	429.926	1.159	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)C2CC(F)(F)C2)n[nH]1	1814540498	XLQBJBODEBCNII-OAHLLOKOSA-N	447.446	1.759	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3[nH]nc4ncccc34)sc2C1	1816874486	NEXUCHUEBVRXPE-MWLCHTKSSA-N	434.909	1.894	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H]2CCC(=O)N2)n[nH]1	1816965923	IMMDGECXUCUOAS-MDZLAQPJSA-N	426.315	1.711	50	20	IDGD	
N#Cc1ccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)cc1	1817472327	FXPUGHIWEXTLJU-HXUWFJFHSA-N	443.272	1.581	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CN2CCN(C(C)=O)CC2)n[nH]1	1818966418	FRVZLCCCNNXHOF-RDJZCZTQSA-N	438.960	1.583	50	20	IDGD	
CCS(=O)(=O)CC(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](F)Br)n[nH]1	1820931385	OKJUNEHTDVORCG-GWCFXTLKSA-N	439.307	1.527	50	20	IDGD	
C=C(C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)C(F)(F)F	1821992085	QXMYLXFGUWOIRV-HNNXBMFYSA-N	436.199	1.514	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)C(Cl)Cl	1822418072	KPSDJMACJHZIEN-ZDUSSCGKSA-N	425.081	1.199	50	20	IDGD	
CC[C@H](O)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)CC1	1824080707	SWRABHCNXYXMCL-OADZIARCSA-N	431.537	1.511	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)C#Cc1ccccc1)CC2	1826085533	ZOMWIMCPOJYJIE-INIZCTEOSA-N	439.541	1.480	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC([C@H]2CCCCN2C(=O)CN2CCN(C)CC2)CC1	1828444733	YLBGBFFOUXWJPM-SJLPKXTDSA-N	443.430	1.637	50	20	IDGD	
C/C(=C\c1cccs1)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1	1829696733	IDQKPQITKCRYHT-SNEZHOGFSA-N	428.938	1.208	50	20	IDGD	
CC(C)(C)n1cc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)[C@H](O)CCl)CC2)nn1	1829784314	ARKBBKZZIZYMCM-IAGOWNOFSA-N	425.961	1.866	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CN2CCN(C(C)=O)CC2)CC1	1830308658	UCTNIYFKYFZDCT-WOJBJXKFSA-N	441.016	1.788	50	20	IDGD	
C/C(=C\c1cccs1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1830719830	LVZVTEFSSSSFSP-VMAJJHQASA-N	428.938	1.208	50	20	IDGD	
Cc1cccc(Cl)c1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1830733008	CTSCJPPYZRWPQK-DNVCBOLYSA-N	431.316	1.318	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)Nc3cccnc3)C2)C1	1831645707	FKILWHJSUATZRS-DJPFJPOOSA-N	438.956	1.746	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3n[nH]c4c3CC[C@H]4C)C2)C1	1831646865	NKRFXFSNCGOTFC-ZJTDPSCFSA-N	438.956	1.937	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H](C)n2cnnn2)CC1	1831656825	LJLAACYDQXJLOM-GZBFAFLISA-N	427.347	1.637	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H]2CCCOC2)CC1	1832870043	OWZQEGYKJNPDRJ-YLJYHZDGSA-N	443.548	1.345	50	20	IDGD	
O=C(CCc1cc(F)ccn1)NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1833792907	YSLVDKRWGJAQAN-IBGZPJMESA-N	440.947	1.325	50	20	IDGD	
CCc1oncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](Br)CC)C2)C1	1834522358	RIEUFTQZLUAVKG-KDOFPFPSSA-N	444.326	1.481	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3ccccc3)CCO2)C1	1834842125	QYJVMWLLAAPSCU-OXQOHEQNSA-N	439.350	1.859	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3c[nH]c4nccc-4c3)CC2)CC1	1835014777	IDSLVOPHNFUSEU-LJQANCHMSA-N	447.967	1.954	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC1CCN(C2CCN(C(=O)[C@@H]3CCCCO3)CC2)CC1	1835835167	RKUATZYIHKKDBC-IBGZPJMESA-N	425.646	1.979	50	20	IDGD	
CO[C@H](C(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1)c1ccccc1	1836716875	VZUZNQYHZPABDZ-UXHICEINSA-N	438.952	1.972	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836719176	OXDFYYUQBGLFIF-SMDDNHRTSA-N	425.751	1.368	50	20	IDGD	
C[C@H](Cc1ccccn1)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836720350	QYYLASVGPKBWBK-UZLBHIALSA-N	437.968	1.859	50	20	IDGD	
CCc1oncc1C(=O)N1CCOC[C@@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1837712421	PVPGOOFUJNQAJD-LJQANCHMSA-N	425.558	1.159	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(COC)c[nH]3)CCO2)C1	1838513007	UWRIRSGZFNWRRM-UZLBHIALSA-N	427.929	1.639	50	20	IDGD	
Cc1ccccc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)Br)C2)C1	1838900414	DYARJEYVFALLLV-KXBFYZLASA-N	425.323	1.848	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(F)c(F)c1)CCO2	1839009378	GTCRZTOKDYJRTF-HXUWFJFHSA-N	442.535	1.886	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)/C=C/c3ccc([N+](=O)[O-])o3)C2)C1	1839141285	DDBUZNVIWDLOHM-CGGVFNQDSA-N	441.868	1.675	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc(OC)c(C)c3)C2)C1	1839143138	MLJNKZITCKYJGT-JXFKEZNVSA-N	425.913	1.486	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3CC(c4ccccc4)=NN3)C2)C1	1839148264	SNPWQNJTLRROSY-JLMWRMLUSA-N	448.951	1.226	50	20	IDGD	
Cc1cccc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)n1	1840030459	MZYBFNVVWVGCHW-HNAYVOBHSA-N	440.338	1.172	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3ccoc3)CCO2)C1	1840516809	NNHJLRVCUYDEFZ-VQIMIIECSA-N	443.338	1.842	50	20	IDGD	
CN(CC(=O)N1CC2(CCCN2C(=O)C(C)(C)C#N)C1)NC(=O)NCc1ccccc1	1841137959	CQDSPRZEAWXOBW-UHFFFAOYSA-N	426.521	1.086	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)Cc2csc(C)n2)C1	1842039452	NTCNVRMVALIADV-YDZHTSKRSA-N	428.518	1.331	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)[C@H](C)n2cccc2C=O)C1	1843020927	VEMNPJGUXKBGFD-WTJYETQFSA-N	438.488	1.199	50	20	IDGD	
Cc1cc2nc(C(=O)N3CCCC34CN(C(=O)CCC(=O)NN(C)C)C4)[nH]c2cc1C	1844217620	YLBVUYDMKJUIFX-UHFFFAOYSA-N	426.521	1.370	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@]2(C[C@H]2C(=O)N2CCCC23CN(C(=O)[C@H](O)CCl)C3)C1	1846156516	WDQDWPPPHFKTBC-MDOVXXIYSA-N	441.956	1.437	50	20	IDGD	
COc1ccc(OC)c(C(=O)CCC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](O)CCl)c1	1847564834	ZPHLDOWZQFSKHL-BQFCYCMXSA-N	438.908	1.468	50	20	IDGD	
C=C[C@@H](O)C(C)(C)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1848099253	GUKSOSNTJUVSFD-YHUYYLMFSA-N	443.972	1.893	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNS(=O)(=O)c2ccc3c(c2)CCN3C(C)=O)cc1	15245261	PPRYGCDRQWPVNY-CQSZACIVSA-N	447.513	1.771	50	20	IDGD	
Cc1cc(NC(=O)c2ccco2)sc1C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	26071060	TTYVAMCFKJSCDD-UHFFFAOYSA-N	437.441	1.952	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CN2C(=O)COc3ccc(Cl)cc32)cc(OC)c1OC	26687825	OXMGSMQHMPQBJX-UHFFFAOYSA-N	449.847	1.552	50	20	IDGD	
O=C(NNC(=O)c1ccc(Br)s1)c1cccc(CN2C(=O)CNC2=O)c1	27320311	KJIMKJNDJUFKSA-UHFFFAOYSA-N	437.275	1.637	50	20	IDGD	
O=C(NNC(=O)c1sccc1S(=O)(=O)N1CCCC1)c1ccc2c(c1)OCCO2	105618341	RFVSGAJNAVUSHN-UHFFFAOYSA-N	437.499	1.379	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)CCNC(=O)c2n[nH]c3ccccc23)cc1OC	726883867	NKFXCNKSUUKVOK-UHFFFAOYSA-N	425.445	1.551	50	20	IDGD	
CCN(CC(=O)N[C@@H]1CCS(=O)(=O)C1)S(=O)(=O)c1ccc(CCCCl)cc1	726972161	MESWXJYORHRYDV-OAHLLOKOSA-N	436.983	1.172	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN(C)CC(=O)Nc1cc(F)cc(F)c1	727434927	OIYZCAMDVUBWDO-UHFFFAOYSA-N	440.834	1.958	50	20	IDGD	
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC[C@@H](C(=O)NNC(=O)CCc2ccccc2)C1	728209937	JDIOHLRXNBEEDA-QGZVFWFLSA-N	433.534	1.207	50	20	IDGD	
CCCOc1c(Br)cc(C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)cc1OC	728371151	GKFKEPWNWPPPLJ-JTQLQIEISA-N	449.323	1.442	50	20	IDGD	
Cc1ccc2c(c1)C(=O)N([C@@H](C)C(=O)NNc1ccc(S(=O)(=O)NC3CC3)cc1)C2=O	730077206	NXJIQSFFHFKVCW-ZDUSSCGKSA-N	442.497	1.564	50	20	IDGD	
CCOC(=O)/C(C#N)=C\Nc1cc(S(=O)(=O)N(CC)CC)ccc1N1CCN(C)CC1	730965285	ALSGSHLVBUXKOE-MSUUIHNZSA-N	449.577	1.851	50	20	IDGD	
CSCC[C@@H](C(=O)NNc1nc(-c2cccnc2)no1)N1C(=O)[C@H]2CCCC[C@H]2C1=O	732110810	OPLJAHMDZFDLEW-ZNMIVQPWSA-N	444.517	1.872	50	20	IDGD	
Cc1c(C(=O)NNc2ccccc2S(C)(=O)=O)nnn1-c1ccc2c(c1)OCCO2	732301628	GGKFVNHCDGTFOH-UHFFFAOYSA-N	429.458	1.507	50	20	IDGD	
O=C(NNC(=O)[C@H]1CC(c2cc(F)ccc2F)=NO1)C1CCN(c2ncccn2)CC1	732638780	AFRBRXUURUNHNV-QGZVFWFLSA-N	430.415	1.312	50	20	IDGD	
COc1ccc(-n2c(C)cc(/C=C(/C#N)C(=O)N3CC[C@H](S(N)(=O)=O)C3)c2C)cc1	732664239	LLQNTAJHJRWCHW-OWMRDYPQSA-N	428.514	1.899	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)NCC1CCN(S(=O)(=O)C(F)(F)F)CC1	732676843	WJENLGYWOUZBIE-UHFFFAOYSA-N	440.419	1.260	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)[C@@H](C)Oc2ccc(F)cc2Cl)n1	733563312	MIOWGZRWXZIUQF-SNVBAGLBSA-N	429.857	1.945	50	20	IDGD	
O=C(NNC(=O)c1cc(-n2cccn2)ccn1)c1ccc(S(=O)(=O)N2CCCC2)cc1	736066670	PJFSKFWSEQIYIX-UHFFFAOYSA-N	440.485	1.127	50	20	IDGD	
COCC[C@H](Cc1cccc(Br)c1)C(=O)NNC(=O)C(=O)N1CCCC1	741209004	BLZMKFACQVZGDZ-CQSZACIVSA-N	426.311	1.414	50	20	IDGD	
CC(C)Nc1ncccc1C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	743334432	IXSLESOYKGSDEE-UHFFFAOYSA-N	432.550	1.595	50	20	IDGD	
CCS(=O)(=O)NCc1ccc(C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)cc1	743335238	NWZRCEVWGDMTNR-UHFFFAOYSA-N	447.485	1.879	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)/C=C/c1ccccc1)C(=O)NNc1ncnc2[nH]cnc12	743471271	XRBCDYISMOBDBQ-QSYFUGGGSA-N	447.546	1.508	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NCCc2ccn(-c3ccccc3)n2)cc1	743578616	XSOOUVSXNKZTKO-UHFFFAOYSA-N	442.501	1.854	50	20	IDGD	
COc1cc(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)ccc1[N+](=O)[O-]	744620457	FOTJAWVMVUAJPK-UHFFFAOYSA-N	436.446	1.381	50	20	IDGD	
CCCc1[nH]nc(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)c1[N+](=O)[O-]	744621435	RYFAIKLUMWZCFP-UHFFFAOYSA-N	438.466	1.048	50	20	IDGD	
CCOC(=O)[C@@H]1CCCN(C(=O)[C@H](C)OC(=O)/C(C#N)=C\c2cc(C#N)n(C)c2C)C1	744632040	IXOKMNFVVLCZQZ-ZNYYCOGKSA-N	426.473	1.846	50	20	IDGD	
CCCCNC(=O)NNC(=O)CNC(=O)[C@H]1c2ccccc2C(=O)N1Cc1ccccc1	745867941	QNBOMIVTEKCCEJ-HXUWFJFHSA-N	437.500	1.630	50	20	IDGD	
CN(C)CCN1C[C@@H](C(=O)NNC(=O)CCCOc2ccc(Cl)cc2Cl)CC1=O	746094010	XDXNWZGFMDVPNK-ZDUSSCGKSA-N	445.347	1.710	50	20	IDGD	
O=C(NCc1ccco1)NNC(=O)[C@@H]1CCCN1C(=O)Nc1ccc2c(c1)OCCO2	746166699	DMSIFQXUODKAEK-HNNXBMFYSA-N	429.433	1.578	50	20	IDGD	
Cc1cc(-n2c(C)cc(C(=O)OCC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)c2C)no1	746171637	RDUQOAGLMQVUKD-UHFFFAOYSA-N	441.400	1.917	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)c1ccccc1CN1CCOCC1	746201132	TUUJTKCIKWDFBZ-UHFFFAOYSA-N	430.530	1.716	50	20	IDGD	
CC(C)N(C)S(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)Cc2cn3ccccc3n2)c1	746545182	IBGPETZBOFRMNS-UHFFFAOYSA-N	447.492	1.506	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)c1ccc(N2CCCS2(=O)=O)cc1Cl	746556248	OMKNUBIWKNXMRX-UHFFFAOYSA-N	447.904	1.531	50	20	IDGD	
CN1C(=O)C[C@H](C(=O)NNC(=O)Cc2cn3ccccc3n2)[C@@H]1c1cccc(Cl)c1	746556253	OYQGLVHPVFLSLN-JXFKEZNVSA-N	425.876	1.897	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)CC2(NC(=O)OC(C)(C)C)CCC2)c2ccccc2c1=O	746821329	INDUZUDPLYISLK-UHFFFAOYSA-N	429.477	1.532	50	20	IDGD	
CCOc1ccc(NS(=O)(=O)c2ccc(C(=O)NNc3nccn(C)c3=O)cc2)cc1	747942676	ZFGPUDHELYNXKP-UHFFFAOYSA-N	443.485	1.737	50	20	IDGD	
Cc1nn(-c2ccccc2)c2sc(C(=O)NNC(=O)N[C@@H]3CCCN(C)C3=O)cc12	748662619	AQNMYYJEFBGNQG-OAHLLOKOSA-N	426.502	1.960	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)[C@@H]2CCCN(C(=O)C3CC3)C2)c2ccccc2c1=O	749562017	UOVMKYRNLNBMQS-OAHLLOKOSA-N	425.489	1.387	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)CNC(=O)OC(C)(C)C	749870735	KNAHMBBUBBCSPY-LBPRGKRZSA-N	443.526	1.587	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H]2CCCOc3ccccc32)c1	750338494	MMQNHCWQKLCBGC-KRWDZBQOSA-N	432.502	1.795	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)c1cn(-c2ccccc2)nc1-c1cccnc1	751212663	VZTDXXDXWIATKU-UHFFFAOYSA-N	430.424	1.718	50	20	IDGD	
CC(C)[C@H]1OCCC[C@@H]1CNC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	753033670	FNFSTMLWDZPYNQ-DENIHFKCSA-N	431.581	1.980	50	20	IDGD	
Cc1cc(Cl)c(S(=O)(=O)NNC(=O)CNC(=O)c2cccs2)cc1[N+](=O)[O-]	753079925	FOIVRNZKHMWTJM-UHFFFAOYSA-N	432.867	1.358	50	20	IDGD	
COc1ccc(C(=O)NNc2cc(Cl)nc(N)n2)cc1S(=O)(=O)NC(C)(C)C	753454909	YSASUVQKBPIKIK-UHFFFAOYSA-N	428.902	1.555	50	20	IDGD	
COC(=O)c1cc(Cl)ccc1S(=O)(=O)NNC(=O)c1ccc2c(c1)OCCO2	753768468	BQGNLWVDYVEORW-UHFFFAOYSA-N	426.834	1.521	50	20	IDGD	
C[C@H](OC(=O)/C(C#N)=C\c1ccc(O)cc1)C(=O)N[C@H](C)c1ccc(S(N)(=O)=O)cc1	754543148	SRPANFOXROQCMQ-COEKHNBSSA-N	443.481	1.756	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCc2ccncc2C)c1	755096473	PNDMPCDLWNQWIY-UHFFFAOYSA-N	433.534	1.607	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)F)cc1)C(=O)Nc1ncn(C2CCCCC2)n1	755347923	GFQNGVHZBUBRMW-UHFFFAOYSA-N	442.448	1.861	50	20	IDGD	
O=C(NNC(=O)c1ccccn1)Nc1cccc(S(=O)(=O)NC2=NCCCCC2)c1	755496798	XCEAVNASKNBRCV-UHFFFAOYSA-N	430.490	1.799	50	20	IDGD	
CON(C)S(=O)(=O)c1ccc(NC(=O)NNC(=O)c2ccc(O)c(Cl)c2)cc1	755531198	BPJAWFRSMDPZFY-UHFFFAOYSA-N	428.854	1.694	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2ccc3c(c2)CCN3C(C)=O)c2ccccc2c1=O	755536048	NUONJYSXFNOZTH-UHFFFAOYSA-N	434.456	1.792	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)Nc1cccc(OCC(=O)N2CCCC2)c1	755658026	QBHIUHLGURTGNF-UHFFFAOYSA-N	440.456	1.926	50	20	IDGD	
CSc1nnnn1-c1cccc(NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c1	755735364	VLOICJFNRAULDX-UHFFFAOYSA-N	447.502	1.254	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1ccccc1C(=O)N(C)C1CCCCC1	756118721	FZAUNBMTCZQZRP-ZDUSSCGKSA-N	439.538	1.182	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)Nc2ccc(OC)c(-n3cnnn3)c2)o1	756746820	JMGISTFVPOBDLE-UHFFFAOYSA-N	428.453	1.572	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(C(=O)NNc2nc(Br)cn3ccnc23)co1	756781002	JJGRAWYTDCIGOX-UHFFFAOYSA-N	429.256	1.092	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)Nc1cc(C2CC2)nn1[C@@H]1CCS(=O)(=O)C1	756856393	OZBATIIXHCYBDN-OAHLLOKOSA-N	447.517	1.611	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)COc2ccccc2F)cc1-n1nnnc1C1CC1	757622530	WSSSISYFLANOLY-UHFFFAOYSA-N	441.423	1.919	50	20	IDGD	
CC(=O)N1CC[C@@H](NC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)c2ccccc21	757795024	NZCNNNIIBUHIKE-QGZVFWFLSA-N	445.501	1.924	50	20	IDGD	
C[C@H](CN(C)C(=O)OC(C)(C)C)C(=O)N1CCN(S(=O)(=O)CBr)CC1	758511921	FBGZTEWOSMPGLH-GFCCVEGCSA-N	442.376	1.316	50	20	IDGD	
CN(C)[C@@H](C(=O)N1CCN(S(=O)(=O)CBr)CC1)c1cccc(Cl)c1	758526985	DXEZJEWASJXHHV-CQSZACIVSA-N	438.775	1.769	50	20	IDGD	
CC(C)NC(=O)c1ccc(C(=O)N2CCN(S(=O)(=O)CBr)CC2)cc1	758528462	VLOHWUVAUSRCRB-UHFFFAOYSA-N	432.340	1.265	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H](C#N)[C@@H](NC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)C1	758768035	HRKWHEHTSCUPON-YOEHRIQHSA-N	439.476	1.575	50	20	IDGD	
CN(NC(=O)c1nnc(O)c2ccccc12)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758785192	CDLPHZNFJOTUPV-UHFFFAOYSA-N	430.465	1.585	50	20	IDGD	
Cc1c(C(=O)NNC(=O)C(=O)Nc2ccccn2)sc2nc3n(c(=O)c12)CCCCC3	758824636	ZDKAEDMHAMHSRQ-UHFFFAOYSA-N	440.485	1.288	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)NCC[C@H](O)c1ccc(Cl)c(Cl)c1	758957792	QIQNCFRXLYDFSA-ZDUSSCGKSA-N	429.260	1.770	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)[C@H]1CN(C(=O)OC(C)(C)C)CCC1(F)F	760490323	NRDDBIRNAFAXNG-LLVKDONJSA-N	436.456	1.551	50	20	IDGD	
O=S(=O)(CBr)N1CCN(S(=O)(=O)c2ccc(F)cc2Cl)CC1	763205526	ACNGVRIJWWSIHO-UHFFFAOYSA-N	435.724	1.468	50	20	IDGD	
CCS(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)cc1	763439362	MQARCXHLYMUEER-UHFFFAOYSA-N	449.551	1.095	50	20	IDGD	
O=C(NNC(=O)c1ccccc1O)C(=O)Nc1ccc(=O)n(Cc2ccccc2Cl)c1	763529775	MZNHQSQXEOTCCY-UHFFFAOYSA-N	440.843	1.655	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(OC[C@@H]3CCCO3)c2)cc1OC	763550790	RRRHXLMFPXSAMY-KRWDZBQOSA-N	443.456	1.661	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2F)cc1-n1nnnc1C1CC1	763557141	WHAMCHWNYQMPJG-UHFFFAOYSA-N	439.407	1.087	50	20	IDGD	
CCOC(=O)c1ccn(-c2ccccc2NC(=O)C(=O)NNC(=O)c2cc(C)oc2C)n1	763587536	YGAULANOSNKZST-UHFFFAOYSA-N	439.428	1.659	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2c(F)cccc2-n2cccn2)c1	763648693	WGXUTLSGLOXOSC-UHFFFAOYSA-N	425.420	1.793	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cnn(CC(C)C)c2C(F)F)cc1	763658857	FNZMQIGEYCBNII-UHFFFAOYSA-N	439.419	1.650	50	20	IDGD	
CC(=O)N1CCCc2cc(NC(=O)C(=O)NNC(=O)COc3ccc(C)c(C)c3)ccc21	763665299	SQCQOFHCFDEDFR-UHFFFAOYSA-N	438.484	1.767	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2F)cc1C(=O)NC(C)C	763681733	IAUQXPGSBPUKCA-UHFFFAOYSA-N	430.436	1.437	50	20	IDGD	
O=C(NNC(=O)c1cccc(Cl)c1)C(=O)Nc1cccc(Cn2cccnc2=O)c1	763747953	JXIDBVZTELYKDQ-UHFFFAOYSA-N	425.832	1.345	50	20	IDGD	
CCOC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(N(C)C)c2)cc1	763758090	NHEAHWKLCHHBTK-UHFFFAOYSA-N	428.445	1.094	50	20	IDGD	
COc1ccc(Br)c(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)c1	763840012	OPOTUKUCCTUPPM-UHFFFAOYSA-N	440.225	1.762	50	20	IDGD	
COCCOc1ccc(C#N)cc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccc(F)cc1	763870616	ARJLXLHYASROMW-CYBMUJFWSA-N	444.419	1.276	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccccc2-n2nccc2C)cc1	763871447	FRCPKZSWNUEKSP-MRXNPFEDSA-N	449.467	1.937	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccc(OCc3ccccn3)c(F)c2)n1	763885452	MCNVPDFOJKUARC-UHFFFAOYSA-N	440.435	1.399	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)C(=O)Nc1ccc(OC2CCCCC2)cc1	763917024	NYLZMGNVAWZMBN-UHFFFAOYSA-N	449.471	1.774	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)nn1-c1ccccc1	763945582	ZQSJIRNCTBULLV-UHFFFAOYSA-N	445.439	1.472	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)on1)C(=O)Nc1ccn(-c2ncccc2F)n1	764010682	CCXMHIRUZHJTMZ-UHFFFAOYSA-N	435.375	1.461	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc(N2C[C@H](C)O[C@H](C)C2)cc1	764042340	HECZRLNOMVMRLI-GASCZTMLSA-N	426.473	1.709	50	20	IDGD	
NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(F)cc2Br)c(F)c1	764083857	BWGXLOKSCZOPET-UHFFFAOYSA-N	441.188	1.226	50	20	IDGD	
COC(=O)c1ccc(C(F)(F)F)cc1NC(=O)C(=O)NNC(=O)c1ccc(Cl)nc1	764100282	LPKWZKHDELEUHT-UHFFFAOYSA-N	444.753	1.940	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2ccc(Cl)c(C(=O)N(C)C)c2)cc1	764124984	PTTNEBBPRUFPGM-UHFFFAOYSA-N	446.891	1.769	50	20	IDGD	
COc1cc2nc(C)sc2cc1NC(=O)C(=O)NNC(=O)c1cccc(OC)c1O	764132108	JWAPOQHYHUZVEQ-UHFFFAOYSA-N	430.442	1.727	50	20	IDGD	
CCC(CC)NC(=O)[C@H]1CN(C(=O)C(=O)NNC(=O)CCC(C)C)c2ccccc2O1	764203208	OVTRKQLURRJAEG-GOSISDBHSA-N	432.521	1.669	50	20	IDGD	
CN(C)CC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)CCCc2ccccc2)cc1	764223553	IGTABNCAOMOVFC-UHFFFAOYSA-N	425.489	1.296	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)C(=O)Nc1cccc(Cl)c1-n1cncn1	764244134	AEVMYXWKVNVACX-UHFFFAOYSA-N	437.847	1.662	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)C(=O)Nc1ccnn1Cc1cccc(Cl)c1Cl	764267760	JTDLTAUYBFZCLR-UHFFFAOYSA-N	447.282	1.962	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C(=O)Nc1ccc2nc3n(c(=O)c2c1)CCC3)c1ccccc1	764328150	BKXVREWKNBFJHF-INIZCTEOSA-N	433.468	1.622	50	20	IDGD	
CCC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)cc1	764387846	NPFJZANJFWGDET-UHFFFAOYSA-N	438.419	1.964	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1ccc2c(c1)CCCC(=O)N2	764392248	CZUALVUYTUHTBC-UHFFFAOYSA-N	442.497	1.848	50	20	IDGD	
O=C(CCC(=O)N1CCN(c2ccccc2)CC1)NNC(=O)c1cc(Br)c[nH]1	764607886	LZCWWLSVAPQMNG-UHFFFAOYSA-N	448.321	1.667	50	20	IDGD	
Cn1c(=O)c2c(ncn2CC(=O)NN=C2CC3(CCCC3)Oc3ccccc32)n(C)c1=O	764812920	SQOMEYAGXWQQGF-UHFFFAOYSA-N	436.472	1.050	50	20	IDGD	
Cc1cc(I)cc(C(=O)NNC(=O)C(=O)Nc2ccccn2)c1C	765505610	KREQYQANIOBBCX-UHFFFAOYSA-N	438.225	1.703	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)CCC(=O)c2ccc(I)cc2)n[nH]1	765582558	CKSZLPWNGHRABW-UHFFFAOYSA-N	426.214	1.747	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)[C@@H](C)C3CCCC3)CC2)cc1	765730236	VYEYAOJMBQJAGW-KRWDZBQOSA-N	436.578	1.275	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cccc(-n4cccn4)c3)CC2)cc1	766643155	JXLJAQXODLERNI-UHFFFAOYSA-N	432.528	1.760	50	20	IDGD	
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC[C@H](C(=O)NNc2ncnc3ccsc23)C1	766678397	CDYMJXRKQKPHKR-LBPRGKRZSA-N	435.535	1.575	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1ccc([N+](=O)[O-])c(Cl)c1	767163433	MVILZFNJRDVULO-UHFFFAOYSA-N	425.854	1.925	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCCc2c(C)cccc2C)cc1	767216440	NBCYRDMNNXHOBV-UHFFFAOYSA-N	432.546	1.805	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)n(-c2ncccn2)n1	768239408	ZDMQOHOOTIXCJP-HNNXBMFYSA-N	437.460	1.141	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)[C@@H]3CCCN3C(=O)C(C)(C)C)n[nH]2)cc1OC	768278636	ITCAKMOKILPCKI-INIZCTEOSA-N	443.504	1.892	50	20	IDGD	
CCNC(=O)N(C)NC(=O)c1cc(C2CC2)nc2c1c(C)nn2[C@@H]1CCS(=O)(=O)C1	768410184	QEJQFLRBPZDRAP-CYBMUJFWSA-N	434.522	1.283	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)NCc1ccnc(OCCN(C)C)c1	770569473	TYGRORAKTDYJSQ-AWEZNQCLSA-N	435.912	1.973	50	20	IDGD	
C[C@@H]1OCC[C@@H]1C(=O)NNC(=O)c1ccc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1	770855421	DFFWITMZFHBLRB-SJCJKPOMSA-N	448.457	1.582	50	20	IDGD	
Cn1c(S)nc2cc(C(=O)NNc3nc(O)c4cnn(C(C)(C)C)c4n3)ccc2c1=O	770968272	UERXYEHVTQSEDK-UHFFFAOYSA-N	440.489	1.579	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)ccc1C	771605903	DQLODURTFOYWLD-UHFFFAOYSA-N	439.877	1.061	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNS(=O)(=O)c1ccc(Br)cc1	771609227	XIEJZTITVKKAOI-UHFFFAOYSA-N	446.710	1.728	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1ccc(S(=O)(=O)N2C[C@@H](C)C[C@H](C)C2)cc1	771843917	AUDPXCJGIGGGFY-KKUMJFAQSA-N	439.534	1.456	50	20	IDGD	
Cc1csc([C@@](O)(CC(=O)O[C@@H](C)C(=O)NNC(=O)CC(C)C)C(F)(F)F)n1	772064606	OECMCRNSYLZRHQ-BONVTDFDSA-N	425.429	1.717	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)C1	772194584	AGPOWZXYYBYHGN-CQSZACIVSA-N	438.912	1.751	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)[C@@H]2CC(=O)N(CC(F)(F)F)C2)C1	773412877	XSHJZGVTUUVQJA-NWDGAFQWSA-N	436.431	1.192	50	20	IDGD	
COc1ccc(NC(=O)c2cccc(NC(=O)C(=O)NNc3nccc(OC)n3)c2)cn1	773726068	GYTAVBFMGDXJBU-UHFFFAOYSA-N	437.416	1.223	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)N[C@@H](CS(C)(=O)=O)c3ccccc3)nc21	774272940	AXHATQKHTLTSEP-AWEZNQCLSA-N	447.521	1.699	50	20	IDGD	
COC(=O)CCN1CCN(C(=O)NNC(=O)c2cccc(Br)c2)[C@@H](C)C1	774739572	GQCBWSSUUMXNFG-LBPRGKRZSA-N	427.299	1.373	50	20	IDGD	
COc1ccc(CN2CC[C@H](NC(=O)NNc3cccc(S(C)(=O)=O)c3)C2=O)cc1	776621334	PUZJFJUEWIESDE-SFHVURJKSA-N	432.502	1.526	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)[C@@H](Cc1ccccc1)NC(=O)c1cccnc1	778438007	JWFGEACGJJRJKS-QGZVFWFLSA-N	441.488	1.095	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)c1ccccc1S(=O)(=O)N1CCCCC1	778444877	AZKIFFSGGZTVJW-UHFFFAOYSA-N	440.522	1.147	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)N[C@@H]1CCN(c2ccc(F)c(Cl)c2)C1	778641529	RMXNECODCCJCED-LLVKDONJSA-N	439.900	1.880	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)[C@H]2CC(c3ccccc3[N+](=O)[O-])=NO2)o1	781949586	MDDFJFSTTYRJJH-GOSISDBHSA-N	429.433	1.984	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C(=O)Nc2ccnn2Cc2ccccc2F)nc2ccccc21	782885220	GNJGSNNVCNUNDS-UHFFFAOYSA-N	449.446	1.286	50	20	IDGD	
O=C(NNc1ccc(Br)cc1)C(=O)Nc1cnn(CCN2CCOCC2)c1	783005989	LYKBEJBZQDBTOW-UHFFFAOYSA-N	437.298	1.060	50	20	IDGD	
Cc1nc(Cn2nnc(C(=O)NNC(=O)c3ccc(Br)s3)c2C)no1	784730962	XXCABRXIJQSBMY-UHFFFAOYSA-N	426.256	1.225	50	20	IDGD	
O=C(NNc1ccc(Br)nc1)C(=O)Nc1ccc2c(c1)S(=O)(=O)CC2	784814133	WYJRGCVGSSPPLX-UHFFFAOYSA-N	425.264	1.256	50	20	IDGD	
CNS(=O)(=O)c1ccc2c(c1)N(C(=O)C(=O)NNc1ccccc1C(F)(F)F)CC2	784821598	WQCUUXCTYJKACQ-UHFFFAOYSA-N	442.419	1.646	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)C(=O)Nc2ncn(Cc3ccc(Cl)cc3)n2)c1	784840666	DIGCLPWWRJEQPN-UHFFFAOYSA-N	448.892	1.465	50	20	IDGD	
O=C(NNc1cccc(C(F)(F)F)n1)C(=O)Nc1ccc(CN2C(=O)CNC2=O)cc1	784952028	ZTADEADRUPFSNY-UHFFFAOYSA-N	436.350	1.234	50	20	IDGD	
COCCCOc1ccccc1NC(=O)C(=O)NNC(=O)Cc1cn2ccccc2n1	785066459	AXVMXMAJBPYLLW-UHFFFAOYSA-N	425.445	1.078	50	20	IDGD	
NC(=O)[C@@H]1CCC[C@H](C(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)C1	786688874	XLRLWHPOODVTHH-SJORKVTESA-N	447.495	1.498	50	20	IDGD	
CC(C)Oc1cc(NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)ccc1C(N)=O	789735179	UKWZRAXRFLRXSQ-UHFFFAOYSA-N	434.836	1.331	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)CNS(=O)(=O)c1ccc(C)c(C)c1	789907778	BTFBPTYCDADSIE-UHFFFAOYSA-N	425.894	1.705	50	20	IDGD	
CC(C)Oc1ncccc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	790091182	PQNLTASYOMOWAL-UHFFFAOYSA-N	432.502	1.728	50	20	IDGD	
CC(C)N(C)c1ccc(C=NNC(=O)C(=O)NN=Cc2ccc(N(C)C(C)C)nc2)cn1	790141954	ZUCZIJZDWUTFKK-UHFFFAOYSA-N	438.536	1.766	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)ccc1O)C(=O)Nc1cccc(N2CCC2=O)c1	790952615	PAUAYTVFECNUOK-UHFFFAOYSA-N	447.245	1.291	50	20	IDGD	
CCOC(=O)Nc1ccc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1	791839896	NNPSFLFUPHBRLX-KRWDZBQOSA-N	443.412	1.399	50	20	IDGD	
Cc1cccnc1NNC(=O)C(=O)Nc1ccc(Br)cc1S(C)(=O)=O	792376434	TUCZHAMENFCZEH-UHFFFAOYSA-N	427.280	1.638	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)[C@@](C)(O)Cn2cc(C(F)(F)F)ccc2=O)n1	792648804	MFUFMKHWYDNUAZ-KRWDZBQOSA-N	428.415	1.398	50	20	IDGD	
CSSCCNC(=O)C(=O)N1CCc2cc(S(=O)(=O)N3CCCCC3)ccc21	793079516	QWFLZDKMZJCZNI-UHFFFAOYSA-N	443.616	1.878	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cccnc2OC(C)C)c1	793456944	CFIRNSBFEARPCC-UHFFFAOYSA-N	434.518	1.974	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)CN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)cc1	796385815	TXQNIKLLOYKGSH-QHCPKHFHSA-N	446.555	1.211	50	20	IDGD	
CCNC(=O)N(C)c1cccc(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3n2)c1	796990451	CSGDWPOFOCKWSO-UHFFFAOYSA-N	434.456	1.800	50	20	IDGD	
CC(=O)N[C@](C)(C(=O)NNc1cc(C#N)cc(Cl)n1)c1ccc(S(C)(=O)=O)cc1	797749672	XPTWOALZUDDPQM-SFHVURJKSA-N	435.893	1.505	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)C(=O)Nc2cncc(F)c2)c2ccccc2c1=O	799258481	FEYWXLFNXRXNKN-UHFFFAOYSA-N	426.408	1.130	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2ccc(C(=O)NNC(=O)CNc3ccccc3)cc2)C[C@@H](C)O1	799380849	MUPVZQNYJHIVAK-IYBDPMFKSA-N	446.529	1.358	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)NCc2cccc(CS(N)(=O)=O)c2)cc1OC	800719037	QZJQKPIDCYWIDN-UHFFFAOYSA-N	436.490	1.027	50	20	IDGD	
COCCO[C@H]1CCCN(C(=O)NNC(=O)c2ccc(OC)c(Br)c2)C1	801016868	AONZWKFXQJOPQD-ZDUSSCGKSA-N	430.299	1.940	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCCC2C[C@H](C)O[C@@H](C)C2)cc1	802510475	PJQYODNCYXOKGG-HOTGVXAUSA-N	440.566	1.540	50	20	IDGD	
Cc1ccc2[nH]cc(C(=O)NNc3ccccc3S(=O)(=O)N3CCOCC3)c(=O)c2c1	804423162	IBUDMWATVAAXDH-UHFFFAOYSA-N	442.497	1.614	50	20	IDGD	
C[C@@]1(c2ccc(Br)cc2)NC(=O)N(CC(=O)NNc2cccc(F)n2)C1=O	804773936	XAUYTRGBGKHKGR-KRWDZBQOSA-N	436.241	1.894	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)CNS(=O)(=O)c3ccc(C)c(C)c3)n[nH]2)cc1	810147760	RHVCQUKLTOSGOO-UHFFFAOYSA-N	441.513	1.741	50	20	IDGD	
O=C(CNS(=O)(=O)c1cccc(Br)c1)NNC(=O)c1ccc(Cl)nc1	810154732	DTUKJWZPNBZJRX-UHFFFAOYSA-N	447.698	1.237	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)NCC(=O)NNc2nc3ccccc3cc2C)cc1	810919821	WTUACLLXEJZBKS-UHFFFAOYSA-N	427.486	1.923	50	20	IDGD	
CN(C)c1noc(CNC(=O)NNC(=O)[C@@H]2Cc3ccccc3CN2Cc2ccccc2)n1	812220257	DPZNNVNVKNCZNE-IBGZPJMESA-N	449.515	1.593	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@H](F)C[C@H]1CNC(=O)NNC(=O)COc1ccc(C#N)cc1	813813897	FQMIUQWZKHZOMG-GJZGRUSLSA-N	435.456	1.615	50	20	IDGD	
COC(=O)c1ccc(C(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)[nH]1	814255382	LMBBXXQSMNGUHA-UHFFFAOYSA-N	448.482	1.738	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2nnn(-c3ccn(C)n3)c2C)ccc1OCCC(C)C	814369684	WYYGERQSPRRTNY-UHFFFAOYSA-N	441.492	1.818	50	20	IDGD	
O=C(NN=Cc1nc2c(s1)CCCC2)c1cccc(S(=O)(=O)N2CCOCC2)c1	814688655	HRCHRZAMVHRNGE-UHFFFAOYSA-N	434.543	1.807	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NCC(=O)NNc2ccc(F)cc2F)c1	825198649	RXBAOTDEJUPGKS-UHFFFAOYSA-N	440.472	1.868	50	20	IDGD	
COc1ccc2c(CC(=O)OCC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)coc2c1	849157397	ULFWVUDGUSGISM-UHFFFAOYSA-N	427.369	1.897	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)C1=NN(c2ccccc2)[C@@H](c2ccccc2)C1	912995522	CJAKLVWTGNRHGC-QFBILLFUSA-N	426.498	1.576	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)c2cccc(S(=O)(=O)NC3CCCC3)c2)cc1	913661064	YEHCATJFDXXFAS-UHFFFAOYSA-N	442.497	1.619	50	20	IDGD	
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC(=NNC(=O)c2cc(Cl)ccc2O)CC1	914554978	DFBRNNJUKYEYAS-UHFFFAOYSA-N	425.898	1.956	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)[C@H]1CC[C@@H](C(F)(F)F)NC1=O	914829711	NHLUYTGSIBWVJV-QWRGUYRKSA-N	438.200	1.432	50	20	IDGD	
COC(=O)CCCNC(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	915894669	OOQYDQXAZSMXIU-UHFFFAOYSA-N	437.460	1.286	50	20	IDGD	
Cc1nn(-c2ccc(F)cc2)c(C)c1CC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	916124791	NNOADRMUBROFAZ-UHFFFAOYSA-N	448.458	1.879	50	20	IDGD	
COc1ccccc1[C@H](NC(=O)NNC(=O)Cc1nc2ccccc2n1C)c1nccn1C	916228144	JLEUHNWDGWATBG-NRFANRHFSA-N	447.499	1.978	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)NCCOc1cccc(F)c1	916634622	MEGXXJRFPLJZMF-UHFFFAOYSA-N	429.496	1.747	50	20	IDGD	
COc1ccc(OC)c(CCNC(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)c1	919790468	PJIIIHCHLXYFAQ-UHFFFAOYSA-N	433.461	1.916	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)cc(C)c1OCc1cccnc1	919887295	ZLCGLYDCEKDZMZ-KRWDZBQOSA-N	432.502	1.409	50	20	IDGD	
Cc1ccc(Sc2ncccc2C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)cc1C	919888866	HOLTZZCPFDZJCF-AWEZNQCLSA-N	434.543	1.981	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)c2ccc3c(c2)nc(O)n3C)cc1	920288005	PLJIGRDRLFQRJU-UHFFFAOYSA-N	437.485	1.775	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)c1cccc(N2CCCC2=O)c1	920964490	OGCZIHKNVMATJA-CQSZACIVSA-N	444.513	1.922	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)c1ccc(N2CCCC2=O)cc1	920986287	XCSWQFAOWICUTB-CQSZACIVSA-N	434.460	1.494	50	20	IDGD	
C[C@H](OC[C@@H]1CCCCO1)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	921146450	ZRVYWOCMGXURFZ-RDJZCZTQSA-N	439.534	1.206	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)c2cc3c(c(S(N)(=O)=O)c2)CCC3)o1	1116103978	TVVHTRYLIIJJIN-UHFFFAOYSA-N	434.518	1.332	50	20	IDGD	
Nc1cnnc(NNC(=O)NCC(=O)N2CCN(c3ccc(Cl)cc3)CC2)c1Cl	1116299800	BKNYLVCAEJNYEC-UHFFFAOYSA-N	439.307	1.341	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)NCCCN1C(=O)NC(C)(C)C1=O	1122007753	PQEIEYSAWJGOON-UHFFFAOYSA-N	444.517	1.783	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN(C(=O)c2ccc3n[nH]cc3c2)C1)c1n[nH]c2c1CCCC2	1318137178	YIUMMBORYNFBEF-AWEZNQCLSA-N	435.488	1.478	50	20	IDGD	
CC(C)(C)c1ccc(NNC(=O)NCCCCN2CCN(c3ncccn3)CC2)nn1	1318938665	KGESAKFZKSSMAJ-UHFFFAOYSA-N	427.557	1.793	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNS(=O)(=O)c1c(F)cccc1Br	1324987922	IHAQNAVNJXZVIE-UHFFFAOYSA-N	426.264	1.422	50	20	IDGD	
O=C(NCCNc1nccc(C(F)(F)F)n1)NNC(=O)c1cncn1-c1ccccc1	1329073899	QYYMKBBNZOUEOV-UHFFFAOYSA-N	434.382	1.737	50	20	IDGD	
Cc1nc2ncccn2c1C(=O)N1CC[C@]2(CN(C(=O)CCBr)CCO2)C1	1777897887	DQSGGPQKHAYSTE-SFHVURJKSA-N	436.310	1.266	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnn4ccncc34)C2)C1	1777988349	LBKSGXBQNROZDJ-ROUUACIJSA-N	426.304	1.409	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cn4cc(F)ccc4n3)C2)C1	1778542170	KRPUDIKNDPFWNX-XIKOKIGWSA-N	439.285	1.700	50	20	IDGD	
CC1(C(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)CCCCC1	1779034291	QODLMVSFOVOKSA-JOCHJYFZSA-N	429.521	1.099	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(Br)cn3)C2)C1	1779424871	DIRNTDHVQHLREZ-SUMWQHHRSA-N	446.729	1.541	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3c(-c4ccncn4)noc3C)C2)C1	1780052129	PJISFRFRICKSPP-VLIAUNLRSA-N	449.895	1.137	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(=O)ccn3C)C2)C1	1780107042	XNBCXLJYTGPUHU-KSSFIOAISA-N	426.311	1.002	50	20	IDGD	
Cc1ccccc1OCC(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781327903	DGAZMAJTCIDDOH-AEFFLSMTSA-N	429.286	1.894	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(CCN(C(=O)c3cc(Cl)c(O)cc3O)C2)C1	1781471808	MIDKJZLKCZSOSZ-QGZVFWFLSA-N	447.713	1.980	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)c3cc(F)ccc3Cl)C2)C1	1781690174	UWURJZTWHHPFCN-HXUWFJFHSA-N	440.903	1.296	50	20	IDGD	
CCCC(=O)N[C@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](Cl)COC)C1	1782176212	YGROYVDOCQUKID-AXHMDWHKSA-N	431.961	1.059	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C[C@](C)(O)CC(=O)O)C1	1782203185	NROVIGPRTXDXJQ-IDENBPMYSA-N	432.945	1.524	50	20	IDGD	
CC(=O)NCCC(=O)N1CCO[C@]2(CCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1	1782866688	GXIXALPUYVMWBW-IHSQGBLNSA-N	446.454	1.228	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](OC(C)=O)C(C)C)CCO2	1783349848	UENLFARBPAUHTG-DAYGRLMNSA-N	433.343	1.578	50	20	IDGD	
CCOc1ncccc1C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](C)Br)C2)C1	1783528538	OSKUQJOFUHIUDD-FZKQIMNGSA-N	426.311	1.707	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cn(C)nc3C(F)F)CCO2)C1	1783533952	CBMAWWXGZOTYDC-QFYYESIMSA-N	435.269	1.585	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(CO)c(F)c3)CCO2)C1	1783536876	HTBKUNAYJPFGGH-XIKOKIGWSA-N	429.286	1.545	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(OC)cc(OC)c3)CCO2)C1	1783882118	OCTRMACACZYCTH-PXNSSMCTSA-N	426.897	1.401	50	20	IDGD	
O=C(C[C@H]1COc2ccccc2O1)N1CCO[C@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783942122	IGENXGKLXZADKN-ORAYPTAESA-N	429.300	1.850	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nccc4nc[nH]c34)C[C@@H]21	1786406038	NIAXUEOCPYFCRU-OBJOEFQTSA-N	436.310	1.336	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1)c1cncc(F)c1	1787470487	CWYXLJHHIAJVOC-UHFFFAOYSA-N	433.248	1.962	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)Nc3nccs3)[C@H]2C1	1787490073	YXIBSRHQCHJCNJ-PEDHHIEDSA-N	445.383	1.707	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1ccc(C2(NC(=O)Cc3ncccn3)CCC2)cc1	1789521279	RQXCCGXCRSHXJN-UHFFFAOYSA-N	445.483	1.466	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3ccc4ncnn4c3)[C@H]2C1	1789714691	KDZBQEDHDGXIRD-XSLAGTTESA-N	433.940	1.659	50	20	IDGD	
CC(C)N[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]2C1)C(C)C	1789922667	NVTIKSXXUYATPV-QXKUPLGCSA-N	436.366	1.679	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc4nc[nH]c34)C[C@@H]21)[C@@H](F)Br	1789923126	SSUFSZWYDYQJCA-YLUJIRGKSA-N	439.285	1.847	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cn(C(C)(C)C)nn3)C[C@@H]21	1791058891	LJLCLSHTKSVSJY-OSFYFWSMSA-N	442.358	1.410	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)COc3cc(C)ccc3C)C[C@@H]21	1791252872	UQMIMFUXFKFRKV-JPLJXNOCSA-N	438.952	1.916	50	20	IDGD	
C[C@@H](C(=O)Nc1ccc(C2(NC(=O)CCC(=O)NN(C)C)CCC2)cc1)n1cccn1	1791885339	LXUPBTALZOKDJH-INIZCTEOSA-N	426.521	1.951	50	20	IDGD	
COc1ccnc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C(C)(C)CCl)c1OC	1792784141	WABQHYVWPAOACT-AGGWBTHJSA-N	425.913	1.567	50	20	IDGD	
Cc1cccn2ncc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@H](C)CBr)c12	1792874472	PVZYUVFWTDUVMB-PNBKFKSVSA-N	449.349	1.877	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c(c1)OCO3)C2	1795114393	DBDBWBXHEQUDHN-FVCICTRLSA-N	425.279	1.404	50	20	IDGD	
Cc1nc2ncccn2c1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCBr	1795114572	YTBSHZUAOMWRTQ-AGGWBTHJSA-N	436.310	1.026	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cn1ccnc1	1795238612	RCMBEVXNWQUDND-FZKCQIBNSA-N	439.944	1.653	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C[C@@H](N)c1cccnc1	1795677751	DLDVCZGKVRPIDA-VJHAZISPSA-N	439.354	1.092	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](C)[C@H]1SC(=N)NC1=O	1796874270	NNVUCDIAPZKJFZ-JOLBHGKHSA-N	445.383	1.458	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2	1797956204	KBUOSWDLHWFRLW-FVCICTRLSA-N	442.972	1.806	50	20	IDGD	
CCCc1onc(C)c1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnccc1C(=O)NN	1798440433	QAHYWBNYIQKBNV-QDMKHBRRSA-N	440.504	1.500	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CS[C@H]1CCCCO1	1798481181	FPASNYRKRGXOAN-QOIOWGMHSA-N	426.583	1.257	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(Cl)cnc1O)C2	1799273254	AAOWMTFMLCUEBT-YDXZUZSKSA-N	436.723	1.880	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(O)c([N+](=O)[O-])c1)C2)[C@@H](F)Br	1799348673	LWEWIAWQQHDRID-RDBQEKCUSA-N	446.229	1.194	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cc[nH]n1	1800288874	COIXTVVCAQDDCU-YJMBJCRISA-N	441.438	1.427	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)ccc1F	1800391116	IXRZNODOWVAVQV-SSJPOKSSSA-N	441.463	1.917	50	20	IDGD	
Cc1cccc(Cl)c1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(B(O)O)cc1)C2	1800491641	FTMATLSGDLQQDT-BCDXTJNWSA-N	426.709	1.894	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1=Cc3ccccc3NC(=O)C1)C2	1800979187	WEHPHHAPFXMZSM-CLWJZODNSA-N	447.919	1.256	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cccc3[nH]ncc23)[C@H]1c1cccnc1)[C@@H](O)CCl	1803139902	XGUKXSLLDHBORR-JVPBZIDWSA-N	427.892	1.877	50	20	IDGD	
O=C1NCc2cc(C(=O)N3CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]3c3cccnc3)ccc21	1803143021	RAKBVASSGPSCLH-AYOQOUSVSA-N	442.903	1.244	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)/C=C/C2CC2)[C@H]1c1cccnc1	1803189651	AXKWJMGPZYGAGO-QNIGJGFBSA-N	434.500	1.366	50	20	IDGD	
CC(=O)NC(C)(C)C(=O)NC[C@@H]1CCN(C(=O)[C@H](C)Br)[C@@H]1c1cccnc1	1803598826	TWPZCCWIOBAKRU-VBNZEHGJSA-N	439.354	1.786	50	20	IDGD	
C=CCSCC(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1804173581	XNSDKKUOUCTQMS-WIYYLYMNSA-N	439.346	1.000	50	20	IDGD	
O=C([C@H](O)CCl)N1CCCC2(CCN(C(=O)[C@H]3CC[C@H]4CCC(=O)N4C3)CC2)C1	1805525380	PXRDDLIDMCUUAJ-YESZJQIVSA-N	425.957	1.218	50	20	IDGD	
CCS(=O)(=O)N[C@@H](C)C(=O)N1CCCC2(CCN(C(=O)C(C)(C)CCl)CC2)C1	1805953427	AXDYHBRYIDWYAK-HNNXBMFYSA-N	436.018	1.810	50	20	IDGD	
O=C(CC(F)(F)F)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1806835654	IQSDHFWWGULXDM-QAPCUYQASA-N	435.211	1.033	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NC[C@@H]1CCN(C(=O)C(Cl)Cl)[C@H]1c1cccnc1	1807595974	NMBWCZBKHLEXQI-BBRMVZONSA-N	439.299	1.914	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1)c1cc(O)nc(O)c1	1807989350	AVCDVAQFMLLSSM-UGSOOPFHSA-N	449.305	1.992	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)c3cc4ccccn4n3)CC2)C1	1809972704	ZXORYUHCRDHTQG-UHFFFAOYSA-N	446.316	1.173	50	20	IDGD	
Cc1cnoc1C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1	1811246331	MLBOLXKWJFUCKG-YJBOKZPZSA-N	449.471	1.010	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)c1ccnc2c1OCO2	1811309940	VFGIOKYONOFLRG-CWRNSKLLSA-N	432.864	1.125	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)c2cc[n+]([O-])cc2)[C@@H]1c1cccnc1	1812866778	KJMWDUVTGSWNJS-RRQGHBQHSA-N	433.306	1.818	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)CNC(=O)C(F)(F)F)[C@H]1c1cccnc1	1813099824	IWPBAKVLYYJNIL-VNHYZAJKSA-N	434.846	1.783	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)C[C@@H]2NC(=O)NC2=O)n[nH]1	1815771493	SIKFIVZXTPRNPN-RVPKQNPDSA-N	445.307	1.236	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3cnc4[nH]ncc4c3)sc2C1	1818956720	SSKLCWPGCYEBCG-NWDGAFQWSA-N	434.909	1.894	50	20	IDGD	
O=C(CCBr)N[C@H]1CCc2nc(NC(=O)c3ccnnc3O)sc2C1	1821095213	OZOSAOCAOFHKQQ-QMMMGPOBSA-N	426.296	1.650	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccnnc3O)sc2C1	1821101655	AGRDNAUFZBYVOZ-JGVFFNPUSA-N	426.296	1.648	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3cc(OC)n(C)n3)sc2C1	1821777627	GEWUERLJMKQQOI-VHSXEESVSA-N	427.914	1.365	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCc2nc(N)n[nH]2)[nH]n1	1822189497	UBNNZYUMAOUUQC-MWLCHTKSSA-N	439.318	1.518	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)C23CC(C(=O)OC)(C2)C3)[nH]n1	1822377560	XVGKBQXYWSPZDA-DQSKEURASA-N	438.912	1.999	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)C(Cl)Cl)n[nH]1	1822423789	LCFKFFLZRPCTKG-LBPRGKRZSA-N	440.291	1.518	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H](N)CCC(N)=O)CC1	1824093575	OIZJLSCKYABHPD-VNQPRFMTSA-N	445.402	1.230	50	20	IDGD	
CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](F)Cl)CC2	1826647171	KJIFKQSWLSRHLQ-IUPBHXKESA-N	442.904	1.060	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)COCc3ccccc3)C2)C1	1830359726	TYOQFUSBCKRTCG-JOCHJYFZSA-N	438.952	1.925	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)[C@H](O)CCl)CC2)nc2nccn12	1830925812	CVIXWSYWQYPALY-QZTJIDSGSA-N	433.940	1.871	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccn(C(F)F)n3)C2)C1	1831651167	NQTOTLCOIRMCME-UGSOOPFHSA-N	434.871	1.756	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)Cc2cscn2)CC1	1831871432	QHEFNDWMFPEXJC-SFHVURJKSA-N	435.594	1.678	50	20	IDGD	
O=C([C@H](F)Cl)N1CCOC[C@@]2(C1)CN(C(=O)C1(c3cccc(F)c3)CC1)CCO2	1832364540	FPPYTJQJUFLWQR-QFBILLFUSA-N	428.863	1.848	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3cccs3)CCO2)C1	1833160676	WEHDBOLBZYISHI-LPHOPBHVSA-N	430.954	1.391	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3n[nH]c4ccccc34)CC2)CC1)[C@@H](O)CCl	1833309841	AYGGQRMGOPQOAY-SFHVURJKSA-N	433.940	1.348	50	20	IDGD	
C[C@H](Nc1ccccn1)C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)CCl)CC2)CC1	1833312186	JLXSRFKALUJBCX-MAUKXSAKSA-N	437.972	1.053	50	20	IDGD	
Cc1nocc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)CBr)C2)C1	1834332319	KTZISDKWJUUOPC-YVEFUNNKSA-N	430.299	1.084	50	20	IDGD	
O=C(CCBr)NC1CCN(C2CCN(C(=O)CCn3ccnn3)CC2)CC1	1834423559	RCFMHCQBIJVESC-UHFFFAOYSA-N	441.374	1.025	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(CN(C(=O)CCBr)CCO2)C1	1834823398	RRYUSHLFBBMDGI-MRXNPFEDSA-N	437.407	1.079	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCC(N2CCC(NC(=O)Cn3cccn3)CC2)CC1	1834884246	RZHGRFUGCLCJPL-LJQANCHMSA-N	430.380	1.691	50	20	IDGD	
O=C(CCc1ccc[nH]1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1836015965	NPMBAUYNRLMKGA-WBVHZDCISA-N	432.290	1.094	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)C3CC(O)C3)CC2)CC1	1836684203	MLGZYRZVZYHJDU-KVULBXGLSA-N	431.371	1.929	50	20	IDGD	
O=C(c1ccnc(Cl)n1)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836717920	FDLGGAATBRZZKM-OAHLLOKOSA-N	431.320	1.342	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3Cc4ccccc4N3)C2)C1	1837715732	GWEGKQSZEHXOJC-UGKGYDQZSA-N	447.608	1.331	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(C)nc3C)CCO2)C1	1838363626	DGHGESAAQODHKZ-XLIONFOSSA-N	425.913	1.022	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)[C@H](C)NC=O)CC2)CC1	1838640502	YZPZEFCFYNJHDZ-BBRMVZONSA-N	432.359	1.293	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cn(C(C)(C)C)nn3)CCO2)C1	1838752830	GZJDEYKRVJHJJS-FQEVSTJZSA-N	441.960	1.368	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccccc3)CCO2)C1	1838852443	LTJSMHXOXPSHQI-VQIMIIECSA-N	425.323	1.930	50	20	IDGD	
O=C(c1ccnc2ncccc12)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1839543730	YUHPTFGTDRDCQH-LJQANCHMSA-N	439.299	1.504	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(Cl)cc3C)C2)C1	1840149519	RPNAQPCZHFOQSY-FXAWDEMLSA-N	445.343	1.972	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CSc3ccccc3)C2)C1	1840151708	MAVQGDJOUZIMCO-YLJYHZDGSA-N	442.965	1.489	50	20	IDGD	
Cc1c(F)ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)c1N	1840188111	OYEAHKVQVDLKJX-GOSISDBHSA-N	434.295	1.590	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccc(O)cn3)CCO2)C1	1840498006	JMAVBAUPOZYZPQ-RBUKOAKNSA-N	446.331	1.022	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](C(=O)N2CCCC23CN(C(=O)[C@H](F)Cl)C3)[C@H](O)C1	1841026109	VRLPXBPFLSAGKA-MJBXVCDLSA-N	433.908	1.342	50	20	IDGD	
O=C([C@@H](Br)Cc1ccccc1)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1	1841353961	ZTDDELCXAPUEAS-LSDHHAIUSA-N	429.742	1.796	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@](F)(C(=O)N2CCCC23CN(C(=O)[C@H](O)CCl)C3)C1	1843953452	ZWVDTDZUHNLJPL-BFUOFWGJSA-N	433.908	1.139	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)c1[nH]nnc1C)C2	1844692267	CNZRJYQWYSDIMK-UHFFFAOYSA-N	428.405	1.077	50	20	IDGD	
C=CCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)[C@H](O)CCl)C2	1845198991	WWVMFXFBWFNLPY-LSDHHAIUSA-N	429.945	1.649	50	20	IDGD	
Cc1nnc(NNC(=O)c2ccc3c(=O)n(CCc4ccccc4)c(=S)[nH]c3c2)[nH]c1=O	11548211	FGGWMPAZFPMXLF-UHFFFAOYSA-N	449.496	1.845	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2c[nH]c(=S)n2-c2ccccc2)c1	16594186	XDMLBLDRFAJAOM-UHFFFAOYSA-N	445.526	1.860	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CC(=O)N(c2ccc3c(c2)OCCO3)C1)c1ccc2c(c1)OCO2	26962840	NDHUISVHJLCLOQ-CYBMUJFWSA-N	425.397	1.001	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)[C@H](Cc2ccc(F)cc2)n2nnnc2C)c1	107707641	GPXDIJADHXPNKA-SFHVURJKSA-N	426.452	1.748	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cnc(-c3ccccc3)nc2)c1	109027741	FEHWHEVVVHHVKD-UHFFFAOYSA-N	425.470	1.469	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)NCc1ccc([C@]2(C)NC(=O)NC2=O)cc1	726282205	KNVUWXXCDGBELA-QFIPXVFZSA-N	439.472	1.213	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)CCNC(=O)c2n[nH]c3ccccc23)cc1OC	726883898	OBXCTDOPBCSTMZ-UHFFFAOYSA-N	439.472	1.941	50	20	IDGD	
NC(=O)c1ccc(/C=C/C(=O)N2CCC[C@@H]2C(=O)NNc2nc(-c3ccccc3)no2)cc1	728079376	GWHUTBPPGIAVFI-LVMGUKCRSA-N	446.467	1.983	50	20	IDGD	
Cc1cccn2cc(CC(=O)NNc3ccc(S(=O)(=O)N4CCN(C)CC4)cc3)nc12	728213630	CGKXQSZPMZSEAC-UHFFFAOYSA-N	442.545	1.265	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN1C(=O)Cc1ccccc1)C1CCN(c2ncccn2)CC1	728846964	XZJTWUWEOZTDGR-LJQANCHMSA-N	436.516	1.074	50	20	IDGD	
CCCCOc1ncccc1CNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1	728959192	IBODGWZVCGIRCW-UHFFFAOYSA-N	427.509	1.798	50	20	IDGD	
CCOc1ccc(-c2nc(C)c(C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)s2)cc1	729275103	KYUSLNQQAPARHH-NSHDSACASA-N	426.520	1.216	50	20	IDGD	
C[C@]12CCC(=O)N1c1ccccc1C(=O)N2CC(=O)NNC(=O)Cn1ccc2ccccc21	729541110	CJWIQTSZZLWMMN-XMMPIXPASA-N	445.479	1.788	50	20	IDGD	
O=C(Cc1nc(-c2ccccc2)cs1)NNC(=O)C1CCC2(CC1)NC(=O)NC2=O	731471588	YZGYHLCZQWMZRE-UHFFFAOYSA-N	427.486	1.268	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)c1nn(-c2ccc(F)cc2)ccc1=O	731597863	VDNNPECXIUNRIC-UHFFFAOYSA-N	434.431	1.745	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NNC(=O)c2ccccc2OC)cc1Br	732247393	GHPNFWRMFJYAAC-UHFFFAOYSA-N	437.250	1.755	50	20	IDGD	
Cc1ccc(C2(C(=O)OCC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)CCOCC2)cc1	732383541	LTLZOBZPELITDR-UHFFFAOYSA-N	441.440	1.956	50	20	IDGD	
COc1c(C(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)c(C)nn1C	732754152	PQLMNENJLISHJA-UHFFFAOYSA-N	446.471	1.514	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)NCCN1CCN(C(=O)C2CCCCC2)CC1	733350940	GLWLEUHXLMAZOZ-UHFFFAOYSA-N	433.528	1.423	50	20	IDGD	
CCS(=O)(=O)C[C@@H](C)NC(=O)NNC(=O)[C@@H](C)Oc1cccc(Br)c1	733660303	OIWQYEKYUKOASK-GHMZBOCLSA-N	436.328	1.370	50	20	IDGD	
Cc1nc(-c2ccc(S(=O)(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)cc2)co1	735267503	SXKYWHBJAQRQOF-UHFFFAOYSA-N	435.483	1.677	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)CSc2nnc(-c3ccco3)n2Cc2ccccc2)cn1	735444071	ABNZCOVHIVTHFQ-UHFFFAOYSA-N	437.485	1.873	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)N1CCC[C@@H](C(=O)c2ccc(F)cc2)C1	738476637	ZIQLFMHYZZBWCU-CQSZACIVSA-N	432.477	1.953	50	20	IDGD	
CCCn1c(=O)nc(O)c2c(C(=O)NNC(=O)C(=O)NC(CC)CC)cc(C(C)C)nc21	740851043	MWMDOXXOBMOAFS-UHFFFAOYSA-N	446.508	1.096	50	20	IDGD	
CC(C)(NS(C)(=O)=O)C(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1	742059878	OYLOBHCWPLKKST-LJQANCHMSA-N	444.557	1.089	50	20	IDGD	
Cc1nn(-c2ccccc2)c2sc(C(=O)NNC(=O)C(C)(C)NS(C)(=O)=O)cc12	743285083	PEJWBQRVJOJTIU-UHFFFAOYSA-N	435.531	1.484	50	20	IDGD	
CCN(CC)[C@H](CNC(=O)NNC(=O)c1csc(N2CCOCC2)n1)c1ccco1	743340860	MQTKVVJGXAQZLL-OAHLLOKOSA-N	436.538	1.600	50	20	IDGD	
Cc1ccc2cc(C(=O)NNc3ncccc3S(=O)(=O)N3CCN(C)CC3)ccc2n1	746292907	FTFLIOIKJXBBOO-UHFFFAOYSA-N	440.529	1.631	50	20	IDGD	
C[C@@H](NC(=O)C(C)(C)C)C(=O)NNc1ccc(S(=O)(=O)Nc2nccs2)cc1	747944719	WXNQXJXGVYRMJP-LLVKDONJSA-N	425.536	1.938	50	20	IDGD	
COCCn1cc(C(=O)NNc2ccc(S(=O)(=O)Nc3nccs3)cc2)ccc1=O	747944841	XXFZEINKPUXKGB-UHFFFAOYSA-N	449.514	1.509	50	20	IDGD	
Cc1cc(F)ccc1NNC(=O)[C@@H](CCS(C)(=O)=O)NS(=O)(=O)c1ccccc1	748562783	MPWZXLOOPMZFAU-QGZVFWFLSA-N	443.522	1.359	50	20	IDGD	
COc1cc(OC)cc(N2CC[C@@H](NC(=O)NNC(=O)COc3ccc(F)cc3)C2)c1	748660367	GREDMARNXLPQHU-OAHLLOKOSA-N	432.452	1.831	50	20	IDGD	
Cc1nn(-c2cncc3nnnn23)c(C)c1CC(=O)NNc1ccc(Cl)cc1[N+](=O)[O-]	750222011	UIZNWLPFOSICDW-UHFFFAOYSA-N	442.827	1.569	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(CC(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)C1	750509977	YZNVAJQQCFEYCQ-UHFFFAOYSA-N	436.421	1.156	50	20	IDGD	
Cc1nc(-c2ccccn2)nc(NNC(=O)c2ccc([C@@]3(C)NC(=O)NC3=O)cc2)c1C	751066923	OJXGLWHGQJHJLH-JOCHJYFZSA-N	431.456	1.967	50	20	IDGD	
CC[C@H](C)C(=O)N1CCC[C@@H](C(=O)NNC(=O)c2nn(CC)c(=O)c3ccccc23)C1	751291480	WFCAUBPXDCQOSV-LSDHHAIUSA-N	427.505	1.462	50	20	IDGD	
CCOCCCn1c(NNC(=O)C(=O)Nc2ccc(OC)cc2)nc2ccccc2c1=O	752047640	KHSIPRYVIUHUIV-UHFFFAOYSA-N	439.472	1.914	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(C(=O)NNc2ccc(-c3ccccc3)nn2)cc1	754471460	XPLXKZXMUDBVLM-UHFFFAOYSA-N	427.486	1.825	50	20	IDGD	
C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	755021188	OSWJSRSMAMOEAR-ADYSOMBNSA-N	441.396	1.529	50	20	IDGD	
COc1ccc(-n2cc(CNC(=O)NNC(=O)c3nn(-c4ccccc4)cc3O)nn2)cc1	755217115	HVGKANZDNVODEY-UHFFFAOYSA-N	448.443	1.311	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)NCCN2C(=O)[C@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2=O)c1C	755459105	NRPYAZBRQBLYOJ-URQWNIEUSA-N	436.512	1.582	50	20	IDGD	
CCCn1nc(C)c(C=NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c1C	755471109	COOLGQIYLPBNDV-UHFFFAOYSA-N	433.534	1.695	50	20	IDGD	
CN(C)C(=O)Cn1cc(NC(=O)NNC(=O)c2ccc(COc3ccccc3)o2)cn1	756794943	DIMZHKJLTKWXEZ-UHFFFAOYSA-N	426.433	1.610	50	20	IDGD	
Cn1cc(Br)cc(NC(=O)NNC(=O)c2nnc(O)c3ccccc23)c1=O	757599529	YDXJWPZNMWDLFD-UHFFFAOYSA-N	433.222	1.263	50	20	IDGD	
COCCOc1c(Cl)cc(NC(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)cc1Cl	757891112	VQXFRFDLDDBWMO-SECBINFHSA-N	440.305	1.606	50	20	IDGD	
CCn1cc(C(=O)C(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)cn1	758068034	JVHFYZSRGWAWMI-UHFFFAOYSA-N	444.451	1.305	50	20	IDGD	
O=C(NCc1ccc(Br)cc1Cl)NNC(=O)C(=O)Nc1ccccn1	758719790	JZXDQEMIYOKELU-UHFFFAOYSA-N	426.658	1.967	50	20	IDGD	
COCCc1noc(CN(C)C(=O)CCC(=O)C(C#N)=C2N(C)c3ccccc3N2C)n1	758848258	JQHWIROBSYQYKI-UHFFFAOYSA-N	438.488	1.888	50	20	IDGD	
CC[C@@H](CN1CCCC1)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	758848388	KGXSINDOHKDOAQ-KRWDZBQOSA-N	437.566	1.290	50	20	IDGD	
COc1cc(Br)c(N)c(C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)c1	759313536	MJVMJSOXASXHKU-UHFFFAOYSA-N	447.245	1.530	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCCN2CCN(CCI)CC2)cc1	759388953	NJLQAFCOQFYTFH-UHFFFAOYSA-N	437.347	1.326	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)CCNS(=O)(=O)c2ccc(C(C)(C)C)cc2)nc1	759730463	HZUZYVQAOIDYPW-UHFFFAOYSA-N	434.518	1.977	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)c2ccc(S(=O)(=O)N3C[C@@H](C)O[C@H](C)C3)cc2)nc1	759738772	PZSGJQAYKLWYTQ-ZIAGYGMSSA-N	448.501	1.423	50	20	IDGD	
COc1ccsc1S(=O)(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	760336526	GJHIZJNCWGRYGV-UHFFFAOYSA-N	445.544	1.165	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)C(=O)c1ccc(Cl)s1	760396252	YASYZLVXXLJDNY-UHFFFAOYSA-N	429.907	1.748	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCCC(=O)NNC(=O)CCc1ccccc1O	760815113	ZINBHGISRBRXMX-MRXNPFEDSA-N	448.520	1.378	50	20	IDGD	
CCNS(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)c1	762933108	TYSJMPSSJRAZAX-UHFFFAOYSA-N	431.449	1.589	50	20	IDGD	
CCOc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	763467348	CKNHCGJZSXGBMG-UHFFFAOYSA-N	443.416	1.095	50	20	IDGD	
Cc1cccc(F)c1NC(=O)C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	763529442	BBSIDJABOPTVQJ-UHFFFAOYSA-N	427.480	1.432	50	20	IDGD	
CCc1cccc2c1N(C(=O)C(=O)NNC(=O)CCN1CCN(c3ccccc3)CC1)CC2	763530190	FHHFMVYHIJKRLS-UHFFFAOYSA-N	449.555	1.498	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccn(CCN(C)C)n2)c(C)n1-c1ccccc1	763602533	STELMMLBBADEBY-UHFFFAOYSA-N	437.504	1.252	50	20	IDGD	
CO[C@@H](C)C(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)COc2cc(C)cc(C)c2)c1	763646151	CAQMGIGKAPWDQA-HNNXBMFYSA-N	442.472	1.442	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2ccccc2O[C@@H]2CCOC2)c1	763647991	RROHKZXGCCBMNP-MRXNPFEDSA-N	427.457	1.636	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(N2CCO[C@@H](C)C2)cc1	763661919	FEOLLHQZGRGGAA-HNNXBMFYSA-N	442.472	1.085	50	20	IDGD	
CC(C)Cn1ncc(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)c1C(C)C	763674961	RGCHLJQIACKMGW-UHFFFAOYSA-N	426.477	1.699	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)N1C[C@@H]2CCCN2c2ccccc21	763682248	PUBJQMMPBZQVSE-INIZCTEOSA-N	438.484	1.627	50	20	IDGD	
N#Cc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(Br)cc2)c(F)c1	763695622	RDHGQNGMHKRDAN-UHFFFAOYSA-N	435.209	1.625	50	20	IDGD	
O=C(CSc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1ccc(-n2cccn2)nc1	763737223	ZYQDBUGPEKBDPK-UHFFFAOYSA-N	430.877	1.799	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2cc(F)c(N3CCCC3)c(F)c2)c1	763775930	ZDDLTAVMOAHLKJ-UHFFFAOYSA-N	448.426	1.982	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccccc2C(=O)N2CCCCC2)cc1	763809800	PPLIQCAGJGYNKD-UHFFFAOYSA-N	438.484	1.786	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(NC(C)=O)c(C)c2)cc1	763859720	FJSPBURMYBYYGH-CQSZACIVSA-N	442.472	1.906	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(=O)n(CC)c2)cc1OC	763912021	KOWNFWZGKXRVDO-UHFFFAOYSA-N	430.461	1.455	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)c2c(C)nn(C)c2-n2ccnc2C)cc1	763926007	VHEVUPNWLRCCNM-AWEZNQCLSA-N	426.477	1.850	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)Cc2ccsc2)c(OC(F)F)c1	764033320	JVHXAWLDZWDZDU-UHFFFAOYSA-N	427.385	1.465	50	20	IDGD	
CN(C1CCCCC1)S(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)CC2CC2)cc1	764142731	JNQHTHLNTMAZFV-UHFFFAOYSA-N	436.534	1.526	50	20	IDGD	
O=C(NNC(=O)c1ccoc1)C(=O)Nc1ccnn1Cc1cccc(Br)c1	764158295	BDEJYRNBGAQYAD-UHFFFAOYSA-N	432.234	1.687	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CCc2ccco2)cc1NC(=O)c1ccncc1	764177212	KFOAXGLILDQDRX-UHFFFAOYSA-N	435.440	1.954	50	20	IDGD	
CC(=O)Nc1cc(NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)c(F)cc1F	764242164	BNRQTOOYFJVSCE-UHFFFAOYSA-N	429.383	1.664	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)C(=O)N1C[C@H](C(=O)OC)Oc2ccccc21)c1ccccc1	764330971	ZUYCQUJQFDGEDO-CRAIPNDOSA-N	425.441	1.295	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc4c(c3)CCC4)n[nH]2)cc1OC	764379516	ZTGZMEQDIYIBGE-UHFFFAOYSA-N	449.467	1.982	50	20	IDGD	
COC(=O)COc1cccc(NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)c1	764381926	BXXPQNUDVZWSPY-UHFFFAOYSA-N	443.441	1.090	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1cccc(NC(C)=O)c1C	764398273	RCHVZMLUYQHNSJ-UHFFFAOYSA-N	430.486	1.840	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)C(=O)Nc1cccc(C(=O)NC2CC2)c1	764405668	WNLGKBMGDCZRRM-UHFFFAOYSA-N	428.470	1.163	50	20	IDGD	
COCCCOc1ccc(C(=O)NNC(=O)c2cc(-c3ccccc3OC)[nH]n2)cn1	765593193	UNHFXLSLKALBLJ-UHFFFAOYSA-N	425.445	1.970	50	20	IDGD	
CC(C)c1ccccc1OCC(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765734444	ZEAPDJMZCQNPRY-UHFFFAOYSA-N	438.528	1.794	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)[C@@H]1COc2ccccc2C1	765759437	UPJHNAULLRPYKE-IBGZPJMESA-N	442.947	1.856	50	20	IDGD	
COC(=O)c1ccc(N2CCN(CC(=O)NNC(=O)Cc3ccccc3C)[C@H](C)C2)cc1	766863310	OJWWBBFADZJAEO-GOSISDBHSA-N	438.528	1.682	50	20	IDGD	
COc1ccc(CNC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c(C)c1	767140558	VYZVINHHJAAEHJ-UHFFFAOYSA-N	446.529	1.932	50	20	IDGD	
COC(=O)c1cn(CC(=O)NNc2c(OC)cccc2S(C)(=O)=O)c2ccccc12	768639606	RUDATMDXGXFNHA-UHFFFAOYSA-N	431.470	1.983	50	20	IDGD	
O=C(C/N=C1/NS(=O)(=O)c2ccccc21)NNC(=O)c1ccc(Cl)cc1Cl	769680334	VLQKCVGQVAHYHU-UHFFFAOYSA-N	427.269	1.493	50	20	IDGD	
CSCCNC(=S)NNC(=O)C1CCN(S(=O)(=O)/C=C\c2ccccc2)CC1	769767688	SEHMCWMULBASMA-ZROIWOOFSA-N	442.632	1.557	50	20	IDGD	
C=CCNS(=O)(=O)c1cccc(C(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)c1	770966595	MRXVKJBFJXERDA-UHFFFAOYSA-N	445.505	1.508	50	20	IDGD	
COc1ccc(C)cc1[C@]1(C)NC(=O)N(CC(=O)NNc2oc(C(C)C)nc2C#N)C1=O	771383208	SWQTUFTVFPKHSZ-NRFANRHFSA-N	440.460	1.897	50	20	IDGD	
CC(=O)NCC(=O)N1CCc2cc(C(=O)NNc3ccnc(Br)c3)ccc21	771560091	CESVGKRAROMWFB-UHFFFAOYSA-N	432.278	1.626	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)OCc2nncn2C)cc1	771873555	NMRUJTGFRRTPID-DHDCSXOGSA-N	435.444	1.213	50	20	IDGD	
Cc1cc(C)nc(-n2nc(C)c(CC(=O)O[C@@H](C)C(=O)NNC(=O)CC(C)C)c2C)n1	771996273	WJUCLPFGTLNUAS-INIZCTEOSA-N	430.509	1.564	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)[C@H]1CSCN1C(=O)c1ccc(Cl)cc1	772095586	KPUJOKGTKDXELN-IUODEOHRSA-N	441.937	1.980	50	20	IDGD	
O=C(COC(=O)c1cnn(CC(=O)NC2CCCC2)c1)NNC(=O)c1cccc(Cl)c1	772347445	MDUWPMJTDBDYKT-UHFFFAOYSA-N	447.879	1.213	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Nc2ccc(N3CCOCC3)cn2)cc(OC)c1OC	772439748	WVOPUSPFMNHOSQ-UHFFFAOYSA-N	431.449	1.411	50	20	IDGD	
Cc1sc2ncc(C(=O)NNC(=O)[C@@H]3CCCN(C(=O)OC(C)(C)C)C3)c(=O)n2c1C	773412483	WCXVWJHOPXAPSA-CYBMUJFWSA-N	449.533	1.781	50	20	IDGD	
CN1CCN(C(=O)NNC(=O)c2cccnc2SCc2ccc(C(N)=O)cc2)CC1	773658856	PLYLLKBMSYCPLC-UHFFFAOYSA-N	428.518	1.075	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)Nc1ccc(C[C@@H]2NC(=O)NC2=O)cc1	775707232	OXQJCXSEFHFYIN-INIZCTEOSA-N	425.445	1.231	50	20	IDGD	
C[C@H]1C[C@H](C(=O)NNc2ccc(Cl)nn2)[C@H](C(=O)NNc2ccc(Cl)nn2)C1	776153332	VEKLJPYLBCXSJV-OWUUHHOZSA-N	425.280	1.822	50	20	IDGD	
O=C(O)[C@H]1CC(=O)N(C2CCN(S(=O)(=O)c3ccc(CCCCl)cc3)CC2)C1	776714295	MAWDRUVOTNGVTM-HNNXBMFYSA-N	428.938	1.944	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(OCCC(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)C1	777395449	BFOXUJOFRSMYOA-UHFFFAOYSA-N	449.512	1.756	50	20	IDGD	
COCCC[C@@H](C)C(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	777966138	IVWWCFFOTUVJRL-MRXNPFEDSA-N	433.530	1.989	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)CCS(=O)(=O)c1ccc2c(c1)CCC2	778433756	QWYAFBUZNHMOCT-UHFFFAOYSA-N	425.507	1.011	50	20	IDGD	
Cn1cnn(CC(=O)NNC(=O)c2ccc(CSc3ccc(Cl)cc3)cc2)c1=O	778523585	DJPXQOZSSSSWQW-UHFFFAOYSA-N	431.905	1.989	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)Cn1c(S)nnc1-c1cccs1	780974461	XCOOXIFAAXMEBU-UHFFFAOYSA-N	426.524	1.358	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCOC[C@H]2CC(=O)c2ccco2)cc1OC	781929304	BRHCVCNMPLXJAR-OAHLLOKOSA-N	431.445	1.032	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ccccc2Br)cc1-n1cnnn1	782983679	GXRJSOMVHFQVLC-UHFFFAOYSA-N	432.238	1.515	50	20	IDGD	
Cc1ccccc1NC(=O)NNC(=O)C(=O)Nc1ccc(N2CCCS2(=O)=O)cc1	783411642	VWOUTQOFJCFXQM-UHFFFAOYSA-N	431.474	1.326	50	20	IDGD	
COc1ccc(Oc2ccc(NC(=O)C(=O)NNc3ccc(-n4cccn4)nn3)cn2)cc1	783432558	AJAGRLFDDNGQFT-UHFFFAOYSA-N	446.427	1.940	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2ccc(-n3cccn3)nn2)n(-c2cccc(Cl)c2)n1	783433470	TZCGWWSWRSTCRO-UHFFFAOYSA-N	437.851	1.892	50	20	IDGD	
Cc1cc(Br)c(F)cc1NC(=O)C(=O)NNc1ccc(-n2cccn2)nn1	783433717	ZWIKQEGJPKJJGQ-UHFFFAOYSA-N	434.229	1.954	50	20	IDGD	
NC(=O)COc1ccc(NC(=O)C(=O)NNc2ccc(F)cc2Br)cc1	784803010	ZPPNOYJWYSMFAU-UHFFFAOYSA-N	425.214	1.534	50	20	IDGD	
COCCOc1c(Cl)cccc1NC(=O)C(=O)NNC(=O)Cc1cn2ccccc2n1	785060663	JDYGDDUMNMTACH-UHFFFAOYSA-N	445.863	1.342	50	20	IDGD	
CN1CCN(c2ccccc2NC(=O)C(=O)NNc2nc(C(F)(F)F)cs2)CC1	785147150	ZHRYVYPUZGVHEY-UHFFFAOYSA-N	428.440	1.996	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1C(=O)N1CCOCC1	786120421	JXYAPNJAOCJEMA-UHFFFAOYSA-N	427.417	1.842	50	20	IDGD	
CC(=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O)[C@@H]1C[C@H]1c1ccc(Cl)s1	788422180	OKSCJRFDWRYBAQ-VHSXEESVSA-N	427.939	1.582	50	20	IDGD	
COc1cc(NNC(=O)C(=O)Nc2cc(Br)cn(C)c2=O)ccc1Cl	789799300	XNKLMXKVLRFKGC-UHFFFAOYSA-N	429.658	1.892	50	20	IDGD	
O=C(NCCc1cccc(OCC(F)(F)F)c1)NNC(=O)c1ccc(-n2cnnn2)cc1	792772213	GMVHURKZIBHQSI-UHFFFAOYSA-N	449.393	1.790	50	20	IDGD	
COc1c(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cccc1[N+](=O)[O-]	792774139	PPSPAZMWZPYBQF-UHFFFAOYSA-N	448.457	1.463	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)c1cnn(Cc2ccccc2Cl)c1	793075239	UHQVTIASMDHJQY-UHFFFAOYSA-N	446.920	1.953	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)[C@@H]2COCCN2C2CCCC2)CC1	793517720	KXDRQLOZSDJSHI-KRWDZBQOSA-N	439.557	1.360	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NN=Cc2c(C)nn(-c3ccccc3)c2N)cc1	794871107	FEQLRJNOBDKXHI-UHFFFAOYSA-N	440.529	1.842	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)N2CCN(CC(=O)N3C[C@H](C)C[C@@H](C)C3)CC2)cc(C#N)n1C	798117153	SHIYMQQIXAZRFU-IKQQZCIYSA-N	436.560	1.761	50	20	IDGD	
C[C@@H]1[C@H](NC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])CC(=O)N1Cc1ccccc1	798530725	SBKNTFDOJFALLJ-GDBMZVCRSA-N	441.444	1.494	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CC(=O)N([C@@H]2CCS(=O)(=O)C2)C1)Nc1ccc(Cl)cc1Cl	802088007	IHFQUWOFGYFPRO-MWLCHTKSSA-N	449.316	1.182	50	20	IDGD	
CCCn1c(=O)nc(O)c2c(C(=O)NNc3ccc(-n4ccnc4)nn3)cc(C(C)C)nc21	804956733	WQQIPGAZHFBZNP-UHFFFAOYSA-N	449.475	1.763	50	20	IDGD	
CCN(C)C(=O)c1cccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)c1	806974711	FVHIPBKZLVPQMG-ZDUSSCGKSA-N	430.436	1.471	50	20	IDGD	
O=C(NCc1noc2c1CCCC2)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	807620220	XTCWLROVCJWIAZ-UHFFFAOYSA-N	447.517	1.482	50	20	IDGD	
CC(=NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1)c1cnnn1-c1ccccc1	807949521	HRLGHRZMHUVTAN-UHFFFAOYSA-N	426.502	1.737	50	20	IDGD	
CCCNS(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)c2ccc(Cl)cc2)cc1	808068331	UKDPYHQPHLNJQS-UHFFFAOYSA-N	431.923	1.652	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)NCc1ccncc1OCCCN(C)C	808185898	GKEGRDSGNQWCMP-UHFFFAOYSA-N	425.493	1.512	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2cccc(OC(F)F)c2)cc1	813033625	CECLPSAYKVGKCE-UHFFFAOYSA-N	428.417	1.620	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)C(=O)Nc2ccc(Cl)c(F)c2)c2ccccc2c1=O	813366151	QGXJUYQQSUZMHJ-UHFFFAOYSA-N	445.838	1.999	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@@H](O)c3ccc(Cl)cc3)CC2)cc1	813486848	CAYOXVTWCDKWAD-NRFANRHFSA-N	430.936	1.647	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCc2nncn2C1)C(=O)Nc1ccc(OCC2CCCCC2)cc1	815691342	MXHCJCTVHLEDEJ-INIZCTEOSA-N	440.504	1.586	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2CCc3nncn3C2)c(OCc2ccccc2)c1	815692514	SPDKAEJEBYEEPW-KRWDZBQOSA-N	448.483	1.514	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)OCC(=O)NNC(=O)[C@H]3COc4ccccc4O3)n[nH]2)cc1	839240071	XKIUJRPVBPUVBK-LJQANCHMSA-N	436.424	1.529	50	20	IDGD	
CC(C)NC(=O)C(=O)NNC(=O)c1ccccc1C(=O)c1ccc(Br)cc1	861953201	QLUMRUKBGCWOAU-UHFFFAOYSA-N	432.274	1.966	50	20	IDGD	
Cc1ccc(NC(=S)NNC(=O)C2CCN(c3ccc4nnnn4n3)CC2)cc1C	887572002	KZRNKCIMXODHLD-UHFFFAOYSA-N	425.522	1.370	50	20	IDGD	
COCCN1C[C@@H](C(=O)NNC(=O)c2nc(-c3ccccc3)n(-c3ccccc3)n2)CC1=O	914460577	FECDSMDCWCGCPY-KRWDZBQOSA-N	448.483	1.190	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C2CCN(S(=O)(=O)c3cccnc3)CC2)c1	915133477	NZCSDSDGTLULBL-UHFFFAOYSA-N	446.529	1.326	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)COc2ccc(Br)cc2)c2c(O)nn(C)c2n1	915188479	PUHMGWSLIZGOLD-UHFFFAOYSA-N	434.250	1.585	50	20	IDGD	
CCO[C@H]1C[C@@H]1C(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccc(OC)cc2)c1	916095741	QPEDUSWQZKCDJL-ROUUACIJSA-N	433.486	1.682	50	20	IDGD	
O=C(NNC(=O)c1cccc(NC(=O)c2ccc(Br)cc2)c1)C(=O)NC1CC1	916110943	DPUAKGVYRLLDKB-UHFFFAOYSA-N	445.273	1.741	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NN=Cc2ccc(N3CCOCC3)s2)cc1	916277123	YWYZZDZMJCALRI-UHFFFAOYSA-N	436.559	1.664	50	20	IDGD	
CCCNC(=O)CN1CCC(NC(=O)NNC(=O)c2cc(-c3ccc(C)cc3)[nH]n2)CC1	916518699	HWUWEMVFFZFOBN-UHFFFAOYSA-N	441.536	1.320	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)CN(C)C(=O)c1ccc(Br)o1	917391717	DMMKXDZIOTZDAR-SNVBAGLBSA-N	442.241	1.868	50	20	IDGD	
Cc1c(C(=O)N([C@H]2CCS(=O)(=O)C2)N(C)C)nnn1-c1cccc(Br)c1	917622213	OYKYQTAOOLHHQL-AWEZNQCLSA-N	442.339	1.444	50	20	IDGD	
COc1ccc(CNC(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)cc1[N+](=O)[O-]	918019232	ZFYHPOKDBPBFFG-UHFFFAOYSA-N	434.405	1.773	50	20	IDGD	
CCCCS[C@@H](C)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	918140980	GATATPXTURSEGH-AWEZNQCLSA-N	429.564	1.390	50	20	IDGD	
Cc1c(/C=C(\C#N)C(=O)NCC(=O)N2CCN(C(=O)OC(C)(C)C)CC2)cc(C#N)n1C	918678537	ANFKKOSZHUSEFR-LICLKQGHSA-N	440.504	1.308	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1ccc(-n2nccc2-c2ccc(F)cc2)cc1	919694298	UTMUTQKMRINUTP-MRXNPFEDSA-N	442.472	1.874	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCCC3)cc2)c1O	919757065	VOQLUXHUKNKYHC-UHFFFAOYSA-N	433.486	1.650	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)[C@@H](CCSC)N1C(=O)c2ccccc2C1=O	919820253	RBAAWSGZIKAQCV-QGZVFWFLSA-N	441.509	1.803	50	20	IDGD	
O=C(NNC(=O)c1cc2c(cn1)OCCC2)c1ccc(S(=O)(=O)N2CCCC2)cc1	1116533631	GAWCODNXGQIGGT-UHFFFAOYSA-N	430.486	1.266	50	20	IDGD	
Cc1ccc(C(=O)NCC(=O)NNC(=O)COc2ccc(Br)cc2)s1	1317702753	UTGZCAQBJPHXBM-UHFFFAOYSA-N	426.292	1.775	50	20	IDGD	
CN(C)c1nccc(NNC(=O)CCNS(=O)(=O)c2cccc(Br)c2)n1	1318657961	HPELMYFVVBQEGU-UHFFFAOYSA-N	443.327	1.117	50	20	IDGD	
COc1cc(Br)c(F)cc1S(=O)(=O)NNC(=O)c1n[nH]c2c1CCCC2	1319931280	FDSOAWVQQNCOHI-UHFFFAOYSA-N	447.286	1.822	50	20	IDGD	
Cn1c(=O)n(C)c2cc(C(=O)N3CC[C@]4(C3)CN(C(=O)C(C)(C)CCl)CCO4)ccc21	1777864720	MPKXXBPECKSFGL-QFIPXVFZSA-N	448.951	1.586	50	20	IDGD	
C[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1C(=O)N1CC[C@]2(CN(C(=O)[C@H](F)Cl)CCO2)C1	1778348841	HHBFVKWTEYDAIQ-VPCSNGCSSA-N	447.935	1.854	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3c[nH]c4ccc(OC)cc34)C2)C1	1778509546	MCZUQOZHXNFVPT-UWJYYQICSA-N	435.908	1.874	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3c(C)nc4sccn34)C2)C1	1778721978	NAULKMQVPFLSLI-SCLBCKFNSA-N	426.926	1.402	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cc(-c3ccncc3)[nH]n1)CCO2	1779299185	UXXHYIHYSDUALC-NRFANRHFSA-N	443.580	1.767	50	20	IDGD	
CCOC(=O)/C=C/C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CO[Si](C)(C)C)C1	1779540849	WNLPBBNZRBQJFG-APJIANLZSA-N	426.586	1.471	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(CN(C(=O)c3ccno3)CCO2)C1	1780095633	ROOQOIPKTZGUAC-HXUWFJFHSA-N	444.400	1.265	50	20	IDGD	
COC(=O)C1(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@](C)(Cl)CCl)C2)CC1	1780717192	YOMISLKYGDPPQE-FSPWUOQZSA-N	435.348	1.690	50	20	IDGD	
C[C@@](O)(C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Br)C1)C(F)(F)F	1780771303	ZJXHFSPDFZRBHI-RDBQEKCUSA-N	449.239	1.504	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(S(C)(=O)=O)ccc3F)C2)C1	1782151670	SXPPNOKQIPRZAZ-BEFAXECRSA-N	446.928	1.690	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1nn(C)c3c1CCC3)C2	1782172549	GNLWCKLWZLXTIE-LUQKVYGDSA-N	438.956	1.290	50	20	IDGD	
CCc1ccnc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CCC(=O)NN(C)C)C2)c1	1782212052	QCRBZXGIRUJRBK-AUSIDOKSSA-N	445.564	1.145	50	20	IDGD	
C#CCCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2	1783165641	HXXCLPGNUABUEN-UPRBLEQPSA-N	427.505	1.048	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cnoc3COC)CCO2)C1	1783348301	XXJOXTFQHFZCBM-CXAGYDPISA-N	430.299	1.438	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(Cl)nn3)CCO2)C1	1783349658	QOLOJDFTQRODAQ-MEDUHNTESA-N	431.718	1.747	50	20	IDGD	
CCOC(=O)C(C)(C)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](Br)CC)C2)C1	1783352244	DTQYKURCCJXPNR-ACJLOTCBSA-N	433.343	1.579	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)[C@@H](C)Cn3ccnc3)CCO2)C1	1783354911	YPGFMTBKMXWPOB-MPGHIAIKSA-N	427.343	1.523	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2	1783355077	IZAYSMYLFVEDGJ-SUNKGSAMSA-N	426.149	1.773	50	20	IDGD	
CC(C)NC(=O)OC(C)(C)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](C)Br)C2)C1	1783538904	YSHAESGCDMKVOG-FZKQIMNGSA-N	448.358	1.513	50	20	IDGD	
O=C(Cc1cccc2ncccc12)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21	1784454121	JATCLMGCUYQSCF-UUXHPUJUSA-N	431.920	1.357	50	20	IDGD	
Cc1cc(C)n(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]32)n1	1785340888	YZIWVZVUBLYLSZ-FPXQBCRKSA-N	431.364	1.716	50	20	IDGD	
COc1cc(F)ccc1CC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1785657136	JWUHQAMOMJYFQB-FUHWJXTLSA-N	447.276	1.897	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(=O)cco3)[C@H]2C1	1786281938	XGTVUEUKPQLHLL-DUPGQFARSA-N	427.295	1.264	50	20	IDGD	
O=C(C[C@@H]1NC(=O)NC1=O)Nc1ccc(C2(NC(=O)[C@@H](F)Br)CCC2)cc1	1786761730	JVMVBFVEBFMDDM-WCQYABFASA-N	441.257	1.409	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3nc(OC)ccc3[N+](=O)[O-])[C@H]2C1	1787752671	PSDBELNZSQFNSB-ABHRYQDASA-N	440.884	1.609	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)c1ccnn1-c1ccccc1	1787767914	SXNXETQUGMIHOT-WQCNXYOZSA-N	432.908	1.065	50	20	IDGD	
CC(=O)NC(C)(C)C(=O)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1	1788144905	AZWLTKRGLYDILK-UHFFFAOYSA-N	437.305	1.029	50	20	IDGD	
C[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]21)n1ccccc1=O	1788750078	XODGIYHSJZLRAJ-HYUNPYRHSA-N	444.359	1.625	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)c1ccnc2c1OCO2	1789181016	QBNSQAYWWYAHJY-HVTMNAMFSA-N	444.257	1.094	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4ncccn4n3)C[C@@H]21	1791055667	CRXGOOGXQFERCD-ABHRYQDASA-N	436.310	1.106	50	20	IDGD	
Cc1cc(C)n(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]3C2)n1	1791056864	HIBKBEYLQRKJOT-UGUYLWEFSA-N	427.343	1.263	50	20	IDGD	
COC(=O)C12CC(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]4C3)(C1)C2	1791063680	POEPLHDYOCBDMJ-ZYJNRPTESA-N	443.338	1.093	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3cccc(OC)c3C)[C@H]2C1	1791122435	UIWCXYLGRUMBIO-JPLJXNOCSA-N	438.952	1.780	50	20	IDGD	
CCC[C@H](NC(C)=O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21	1792182219	LFKMFDURVKCENV-VGWMRTNUSA-N	432.359	1.056	50	20	IDGD	
C[C@@H](NNc1ccccc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2	1792507369	VSRPUMNPOJBKMN-ZXFNITATSA-N	439.354	1.366	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(N3CCCCC3)cc1)C2)[C@H](O)CCl	1792980563	TZSSRSLSEUOOLP-PIKOESSRSA-N	435.952	1.480	50	20	IDGD	
COC[C@H](C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)C2	1793444454	LUDXKEMSQFAFOO-WCCKXKFDSA-N	433.455	1.744	50	20	IDGD	
COc1c(Cl)cccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1	1796192365	DINQAGYLTFGKJQ-BJWYYQGGSA-N	442.708	1.594	50	20	IDGD	
C[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Cl	1796364990	OELDMEOJDOFJQV-KXKVQDCLSA-N	447.935	1.613	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2)c1ccc2cc(O)ccc2n1	1796858648	BLBGGXIDOLZEFY-HBCWATKFSA-N	448.317	1.929	50	20	IDGD	
Cc1c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)oc2ccccc12	1797416038	AYVQSQGQKQMACY-REPLKXPHSA-N	432.285	1.987	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cc1ccccc1F)C2	1798439178	MHHUYBROXKUBBO-MUJYYYPQSA-N	425.464	1.319	50	20	IDGD	
Cc1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)cc(C)c1O	1798443632	PQFJCGFVZDZDAS-BJWYYQGGSA-N	437.500	1.573	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CC(C)(C)O)C2	1799217726	DUDQTTCSXHFEJK-QDMKHBRRSA-N	433.461	1.933	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc3c(c1)CCC3)C2)[C@H](F)Br	1799344711	SJJTZFDTNORSDE-NBMJBFSESA-N	439.325	1.998	50	20	IDGD	
O=C1CC(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](Br)Cc2ccccc2)C1	1800436501	MCWZRCJHTFEZBB-NBMJBFSESA-N	449.345	1.561	50	20	IDGD	
Cc1ccn2c(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@H](C)Br)cnc2c1	1800762521	TZNRVYSAVGGKAE-ZJOBFFGXSA-N	435.322	1.629	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cn3c(F)cccc3n1)C2	1800762667	WZPCHIGKNCHFAC-LSSIXWDNSA-N	439.285	1.460	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)n1cc(C)cn1	1801344149	MGBLMPYVOPARDK-IBEHDNSVSA-N	427.343	1.516	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1CCN(c2ccc(F)cn2)CC1)[C@@H](O)CCl	1801368741	NOOQTGSHVZLRJZ-MHORFTMASA-N	438.931	1.675	50	20	IDGD	
CNc1nsnc1C(=O)NC[C@@H]1CCN(C(=O)[C@@H](Cl)COC)[C@H]1c1cccnc1	1802477822	LXXFKGRGUSCZHQ-YDHLFZDLSA-N	438.941	1.548	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc3nccn3c2)[C@H]1c1cccnc1)[C@@H](O)CCl	1803142667	GSEXIVDAIXHMNE-IEZWGBDMSA-N	427.892	1.649	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2nc(C)c(C)nc2O)[C@H]1c1cccnc1	1804875819	WTXVMKXBDISXHE-XYJFISCASA-N	447.923	1.767	50	20	IDGD	
O=C(COC(=O)C(F)(F)F)NC[C@H]1CCN(C(=O)C(Cl)Cl)[C@H]1c1cccnc1	1810190892	ZNDZONVIPGIODV-PWSUYJOCSA-N	442.221	1.997	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@H]1CCN(C(=O)CCN2CCOC2=O)[C@H]1c1cccnc1	1810546038	LIJRYBDBAXCUOM-XLIONFOSSA-N	448.596	1.781	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC2(CCCN(C(=O)c3cccc4[nH]ncc34)C2)CC1	1810587796	UVQWCMIGMBNPED-UHFFFAOYSA-N	446.316	1.401	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)c2ccnnc2O)[C@@H]1c1cccnc1	1811233710	QSEGIXVKFVNNNC-LNSITVRQSA-N	434.294	1.680	50	20	IDGD	
C#CCCCC(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1	1813049281	RWXOAYQORJHEMM-LAUBAEHRSA-N	434.500	1.203	50	20	IDGD	
N[C@@H](Cc1cscn1)C(=O)N1CC[C@H](CNC(=O)C(Cl)Cl)[C@H]1c1cccnc1	1813079028	CNUKPVBIOLIBHC-VHDGCEQUSA-N	442.372	1.918	50	20	IDGD	
COC(=O)NCC(=O)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@@H]1c1cccnc1	1813266892	MWMGZDSQRCOGGD-YUTCNCBUSA-N	431.262	1.134	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CN2CCSCC2)n[nH]1	1814416751	FCPHZJHLXHAOAX-UKRRQHHQSA-N	429.974	1.704	50	20	IDGD	
Cc1c(F)ccc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@@H](O)CCl)CC3)c1N	1815235123	RYRWNPXBOWDVQN-RNCFNFMXSA-N	426.901	1.998	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1coc(Cl)n1)CC2)c1cccc(B(O)O)c1	1815354773	CQXJMBDWJDISMI-NSHDSACASA-N	446.681	1.004	50	20	IDGD	
O=C(Cc1ccc2c(c1)OCO2)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1	1816997756	IEIWZWRBRIALKR-GJZGRUSLSA-N	434.880	1.973	50	20	IDGD	
COC(C)(C)C(=O)N[C@H]1CCc2nc(NC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)sc2C1	1817276872	ZNBPOAHXIHZLNN-JBBSTVMTSA-N	446.533	1.614	50	20	IDGD	
COc1ccnc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)c1	1817476761	PPOSXQYMGRBGPM-LJQANCHMSA-N	449.276	1.113	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](O)C(C)C)[nH]n1	1818111018	YMFKJVWHCNMJTD-BZEWVUQVSA-N	443.508	1.553	50	20	IDGD	
COc1cc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)CCC(=O)NN(C)C)CC3)ccn1	1820545771	CXGJMIIMHAXEFL-ZDUSSCGKSA-N	446.533	1.146	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H]2C[C@]2(F)Cl)n[nH]1	1822507244	MHZYMODMDKGMMB-WHWRDJHUSA-N	428.896	1.699	50	20	IDGD	
C[C@@H](C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCBr)[nH]n1)n1cnnn1	1822857108	WBXPXERAUIPRMX-CMPLNLGQSA-N	425.291	1.435	50	20	IDGD	
Cn1cc(CC(=O)N[C@@H]2CCc3nc(NC(=O)[C@H](F)Br)sc3C2)cn1	1823014376	VHSVWVYGRAULLF-RNCFNFMXSA-N	430.303	1.722	50	20	IDGD	
Cc1onc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)c1C	1824750131	OHKMWOKTLJUQJG-HXUWFJFHSA-N	439.321	1.518	50	20	IDGD	
CN[C@H](CC(=O)N1CCCC[C@H]1C1CCN(C(=O)CCBr)CC1)C(=O)O	1826941148	NKJZZPIPPTUSLF-CABCVRRESA-N	432.359	1.454	50	20	IDGD	
O=C(/C=C/c1cccnc1)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827056572	YTQPKUPNBUMSMR-JJNABOQBSA-N	447.344	1.708	50	20	IDGD	
CC(C)[C@H](S)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1	1828923550	LRQFUZLLMUCASO-MOPGFXCFSA-N	447.605	1.873	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2	1830543300	PGJBBKQWZOEPKP-XEZPLFJOSA-N	425.751	1.491	50	20	IDGD	
Cc1cc2[nH]c(C(=O)N3CCOC[C@]4(C3)CN(C(=O)[C@H](O)CCl)CCO4)cc2s1	1830736612	VFJNKOCYKQWNKC-BEFAXECRSA-N	441.937	1.208	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnoc3COC)C2)C1	1831647067	OXIWENPILZUNMU-BEFAXECRSA-N	429.901	1.299	50	20	IDGD	
O=C(Cc1cccnc1Cl)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1832723707	WEOKEMOKQOGVJZ-QGZVFWFLSA-N	436.723	1.538	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)nc1C	1833695099	FMBCOLWVUFENJY-LIRRHRJNSA-N	440.338	1.552	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCC(N2CCC(NC(=O)c3ncccn3)CC2)CC1	1834233184	BMIXEJLGDAJOOI-IBGZPJMESA-N	428.364	1.898	50	20	IDGD	
CC(C)c1cc(C(=O)NC2CCN(C3CCN(C(=O)[C@H](O)CCl)CC3)CC2)no1	1834304119	OXJUAIMQNRQAIJ-QGZVFWFLSA-N	426.945	1.583	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3csc(C)n3)CCO2)C1	1834459860	QZSROONGISDXMK-DYVFJYSZSA-N	446.367	1.695	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)C(=O)c3ccccc3)CCO2)C1	1834706806	UPQJRSJNLAWMGP-UXHICEINSA-N	443.327	1.562	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)c1cc2cccn2cn1	1835424033	SJXWMGCIRSEHKK-IBGZPJMESA-N	433.940	1.119	50	20	IDGD	
C=C[C@H](O)C(C)(C)C(=O)NC1CCN(C2CCN(C(=O)[C@H](Cl)COC)CC2)CC1	1835718180	WCDYCKXUJABDMX-MSOLQXFVSA-N	429.989	1.385	50	20	IDGD	
C[C@H](C(=O)N1CCC(N2CCC(NC(=O)CO[Si](C)(C)C)CC2)CC1)n1cccn1	1835837910	RTKCHJMMKDTKHH-QGZVFWFLSA-N	435.645	1.867	50	20	IDGD	
COc1ccc(C(=O)N2CCC(OC3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)s1	1836715125	JWAOVLCFVWVTSW-HNNXBMFYSA-N	430.954	1.969	50	20	IDGD	
C=CC(=O)N[C@@H](C)C(=O)N1CCC(OC2CCN(C(=O)CCBr)CC2)CC1	1837653560	BULOHNTTZPIDDY-AWEZNQCLSA-N	444.370	1.461	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc4[nH]ncc34)C2)C1	1837711388	GGHJVXQAWKNUNB-NRFANRHFSA-N	446.580	1.484	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CNc4ccccc43)C2)C1	1837711464	JDPLYBXGXWQEMZ-AVRDEDQJSA-N	447.608	1.504	50	20	IDGD	
COc1ccc(C(=O)N2CCOC[C@@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)cc1	1837714507	JJWMJQJFAXDWMK-OAQYLSRUSA-N	436.581	1.617	50	20	IDGD	
C=CC(=O)N[C@@H](C)C(=O)N1CCC(OC2CCN(C(=O)[C@H](C)Br)CC2)CC1	1838428625	QWXBILCPBCCJLM-KBPBESRZSA-N	444.370	1.459	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)C[C@](C)(O)CC(=O)O)CC2)CC1	1838637337	SUJMDARYEOZEAP-JXFKEZNVSA-N	432.945	1.618	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)CCC(N)=O)CC2)CC1	1838753533	FERVHLCNLYFSBO-OAHLLOKOSA-N	432.359	1.424	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)C3CCC(O)CC3)CC2)CC1	1838785455	GGYREHNVTANDPK-RJYAGPCLSA-N	430.973	1.790	50	20	IDGD	
Cc1ncccc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2	1839151557	WDPQEARAXAUBIY-OALUTQOASA-N	430.332	1.696	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)cc1O	1839202277	YYOXLRPEAKQEBS-YJBOKZPZSA-N	445.285	1.461	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCC(F)(F)F)C2)C1	1839963350	IIHJKBKWEQFMJH-IUODEOHRSA-N	445.276	1.959	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccnc3S)C2)C1	1840029976	XARQSWOWFXVEOJ-YVEFUNNKSA-N	444.351	1.224	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cccs3)C2)C1	1840032114	OAPQASVKQRCLAD-DYVFJYSZSA-N	431.352	1.530	50	20	IDGD	
Cc1ccc(/C=C/C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)s1	1840394585	UEPOBAAQYJAYEP-HLIGJIKWSA-N	428.938	1.126	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3ccoc3)CCO2)C1	1840516887	QUFZMSMIAHTGMX-RDTXWAMCSA-N	429.311	1.452	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@H](C)NS(=O)(=O)c2ccc(C)cc2)C1	1841369371	KMLRNYQNCDSQNE-RDJZCZTQSA-N	441.981	1.883	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1cc[nH]c3nccc1-3)C2	1843415693	BGADOKRFIHONAX-VULFUBBASA-N	433.472	1.466	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@](C)(C(=O)N2CCCC23CN(C(=O)[C@H](O)CCl)C3)C1	1843867224	HZLRFWBXSQWJJQ-KUHUBIRLSA-N	429.945	1.437	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](C(=O)N2CC3(CCCN3C(=O)C(Cl)Cl)C2)C1	1846388512	PHRKEGZJLAKCMW-NWDGAFQWSA-N	436.336	1.221	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H]1CCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl	1847559046	IYNUBWZMRQICKF-QZWWFDLISA-N	443.972	1.968	50	20	IDGD	
CCOC(=O)c1c(CCC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](O)CCl)c[nH]c1C	1847559969	VRVCMARYPGMDMR-JYJNAYRXSA-N	425.913	1.234	50	20	IDGD	
Cn1nc(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)/C(C#N)=C/c2ccc(F)cc2F)cc1O	1848331828	PUMVPNRDXBRMII-DQADQBJQSA-N	427.411	1.826	50	20	IDGD	
O=C(NCCCc1nc2ccccc2[nH]1)NNC(=O)c1csc(N2CCOCC2)n1	9756367	ABKIFPXLFLWWEM-UHFFFAOYSA-N	429.506	1.433	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=O)c2ccc3c(c2)OCO3)ccc1OC	15793538	CFLQOBZICLKXLR-UHFFFAOYSA-N	449.485	1.529	50	20	IDGD	
Cc1cc(C)cc(C(=O)NCC(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)c1	17197428	FAVUZCXFRAALMM-UHFFFAOYSA-N	435.484	1.785	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)[C@@H]1COc2ccccc2O1	23297237	TZVATIKUGMFFGD-FQEVSTJZSA-N	444.919	1.445	50	20	IDGD	
O=C(NC[C@@H]1C[C@H]2CC[C@H]1C2)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	726265404	DESOFYNPXUNSNZ-ZOBUZTSGSA-N	436.534	1.088	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)Cc2ccc(OC)c([N+](=O)[O-])c2)c2ccccc2c1=O	727661883	IZPUVMJYQLBFOD-UHFFFAOYSA-N	439.428	1.727	50	20	IDGD	
O=C(CCCc1ccccc1)NNS(=O)(=O)c1ccc(N2CCCS2(=O)=O)cc1	727719524	CMSMUWAWAAWGIJ-UHFFFAOYSA-N	437.543	1.559	50	20	IDGD	
O=C(COC(=O)CCc1nc(-c2ncccn2)no1)NNC(=O)c1cccc(Cl)c1	727903966	ZJUBDXOIJAGJRR-UHFFFAOYSA-N	430.808	1.117	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)N[C@@H](CN1CCN(C)CC1)c1ccccc1	727945019	IGJHIEPFUGYFDE-UWJYYQICSA-N	443.523	1.912	50	20	IDGD	
CN(C)N(C(=O)CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])[C@H]1CCS(=O)(=O)C1	728178417	XCZWLJJFPPOFEF-LBPRGKRZSA-N	438.428	1.908	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)c2cn(-c3ccc(C(F)(F)F)cn3)nn2)c1	728208395	UROHYNSIEHBVDQ-UHFFFAOYSA-N	435.366	1.563	50	20	IDGD	
Cc1cccc(NC(=O)CN(C)C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1C	728958096	SFCFCUAYROHMQW-UHFFFAOYSA-N	439.520	1.621	50	20	IDGD	
Cc1ccc(C)c(S(=O)(=O)Oc2ccc(C(=O)NNC(=O)Cc3cc[nH]n3)cc2)c1	730102405	AYMXIVVROIEEHL-UHFFFAOYSA-N	428.470	1.798	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1cc(C(=O)NNC(=O)COc2ccccc2O)ccc1F	730781890	BZCCYSJEZISAQS-UHFFFAOYSA-N	439.465	1.448	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(\C#N)C(=O)NCCC(=O)N2CCN(C(C)=O)CC2)c1C	730783433	NVXNIGBASAZERL-RSZPVBOMSA-N	443.548	1.416	50	20	IDGD	
CC(C)[C@@H](NS(=O)(=O)c1ccc2c(c1)OCCCO2)C(=O)NNC(=O)C1CCC1	732140763	JMWRSDFDKWLSAT-QGZVFWFLSA-N	425.507	1.098	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)ccc1F	733107881	AIZZOMRHOKWRHR-UHFFFAOYSA-N	431.449	1.337	50	20	IDGD	
CCOCCCn1c(NNC(=O)[C@H](C)NC(=O)c2ccoc2)nc2ccccc2c1=O	733266970	RJKOABZWHWZGDU-AWEZNQCLSA-N	427.461	1.678	50	20	IDGD	
NC(=O)[C@@H]1CCCN1Cc1cccc(NC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c1	733332676	LGDHOGAEJXCLMD-FQEVSTJZSA-N	447.499	1.789	50	20	IDGD	
C[C@@](O)(CNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)c1ccc(F)cc1F	734010198	NWIGQCMIJJKLTN-HXUWFJFHSA-N	434.447	1.209	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)c1cc(Cl)c2c(c1)OCCCO2	734240616	QHKRPMSKNWTRKQ-UHFFFAOYSA-N	428.873	1.970	50	20	IDGD	
O=C(C[C@H]1OCCc2ccccc21)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	734312375	BEOQSXFTYWKRHC-HXUWFJFHSA-N	443.525	1.936	50	20	IDGD	
O=C(COC(=O)C[C@@H]1OCCc2ccccc21)NNC(=O)[C@H]1COc2ccccc2O1	734604895	CZDMIBPVNLUVRQ-RBUKOAKNSA-N	426.425	1.221	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)CCc2ccc(Cl)s2)CC1	735117021	LNMOBVFYDYMVHO-UHFFFAOYSA-N	443.982	1.809	50	20	IDGD	
Cc1nnnn1[C@H](Cc1ccccc1)C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	735653570	KMOTVRAZGRWIEZ-LJQANCHMSA-N	441.517	1.349	50	20	IDGD	
N#CCCn1cc(/C=C(/C#N)C(=O)NC2CCN(CC(N)=O)CC2)c(-c2ccccc2)n1	737778519	NDEBSNCSVRRNRX-AQTBWJFISA-N	431.500	1.437	50	20	IDGD	
CC(C)(C)OC(=O)Nc1ccc(C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)c(Cl)c1	740776960	QETDLQXUKGFYTG-JTQLQIEISA-N	431.898	1.883	50	20	IDGD	
O=C(CN1C(=O)COc2ccc([N+](=O)[O-])cc21)NNC(=O)C(F)(F)Oc1ccccc1	741597087	JFANNLQGYOSHLR-UHFFFAOYSA-N	436.327	1.139	50	20	IDGD	
Cc1ccc(CCN(C[C@H]2CCCO2)C(=O)NNC(=O)CNC(=O)c2ccco2)cc1	743577891	TZLLEABGWWDEKA-GOSISDBHSA-N	428.489	1.782	50	20	IDGD	
COCCOC[C@H](C)NC(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1	745863258	CRIYPFKSRGMZMG-PGRDOPGGSA-N	440.544	1.995	50	20	IDGD	
CC(C)OC(=O)[C@@H](C)CNC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	745905592	LQDYUTOQGVDTKE-AWEZNQCLSA-N	440.522	1.003	50	20	IDGD	
Cc1ccc(S(=O)(=O)Nc2cccc(C(=O)NNC(=O)N3CCOCC3)c2)cc1F	745992697	INNRGMGMLFAINS-UHFFFAOYSA-N	436.465	1.622	50	20	IDGD	
CCN(c1ccccc1)S(=O)(=O)c1cccc(C(=O)NNC(=O)N2CCOCC2)c1	745992766	JTEYLHCNWLOPOV-UHFFFAOYSA-N	432.502	1.588	50	20	IDGD	
CN(C)C(=O)NNC(=O)c1cc(O)nc2ccc(S(=O)(=O)Nc3ccc(F)cc3)cc12	746006052	LEKLOAPUMGOPID-UHFFFAOYSA-N	447.448	1.796	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)Cc2cn3ccccc3n2)cc(S(=O)(=O)N(C)C)c1C	746545380	LQBLWYCPNREEHF-UHFFFAOYSA-N	429.502	1.205	50	20	IDGD	
CN(C)N(C(=O)CCNC(=O)c1ccc(Br)cc1)[C@H]1CCS(=O)(=O)C1	746950303	TXCCZHZSZODJCA-AWEZNQCLSA-N	432.340	1.061	50	20	IDGD	
CSCC[C@H](NC(=O)c1ccc2ccccc2n1)C(=O)NNC(=O)Cc1ccncc1	747429143	HCXMCTJTFTZRAP-IBGZPJMESA-N	437.525	1.871	50	20	IDGD	
CCCCn1c(=O)nc(O)c2c1nc(CCC(=O)NNC(=O)c1ccc[nH]1)n2CC(C)C	747663101	ZBPAAZVIZVLORF-UHFFFAOYSA-N	443.508	1.477	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)NCc1cc(Br)c2c(c1)OCCO2	748622087	CFSIMDFAVZEVGQ-JTQLQIEISA-N	432.271	1.102	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)[C@@H]3CCN(C4CCCCC4)C3)cc2)CC1	748848505	MNLPTVBXYIOVJK-GOSISDBHSA-N	449.621	1.720	50	20	IDGD	
COc1cc(I)c(C(=O)NNC(=O)c2cccn2C)cc1OC	750718481	ZFCAJOXJPLSXRX-UHFFFAOYSA-N	429.214	1.722	50	20	IDGD	
N#C/C(=C/c1ccc(F)cc1)C(=O)N1CCC(C(=O)NCCCN2CCOCC2)CC1	752463081	QNUUIEGAHFJFEJ-SILNSSARSA-N	428.508	1.810	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N2CCC(Cn3ccnn3)CC2)cc1Br	753066210	MDRUHRYDPPHJRT-UHFFFAOYSA-N	437.298	1.816	50	20	IDGD	
COC(=O)CCNC(=O)c1ccc(NC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1	755603657	MKCJVYMSRVEESG-UHFFFAOYSA-N	429.389	1.354	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)Nc2cc(S(N)(=O)=O)cc(C)c2C)cc1	756635751	SYWRJYHACRHZIL-CQSZACIVSA-N	448.501	1.774	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)cc1S(N)(=O)=O	756636376	DJJOACTWHQJKLZ-UHFFFAOYSA-N	432.437	1.638	50	20	IDGD	
O=C(COC(=O)CCC(=O)c1ccc(F)c(F)c1)NNC(=O)c1ccc([N+](=O)[O-])cc1	756698609	QMSHMTOZOXDITI-UHFFFAOYSA-N	435.339	1.840	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)Nc2cc(C3CC3)nn2[C@@H]2CCS(=O)(=O)C2)cc1	756856436	PSRSUGHTTNVMFK-OAHLLOKOSA-N	447.517	1.660	50	20	IDGD	
COc1ccccc1N1CC[C@H](NC(=O)NNC(=O)Cc2nc3ccccc3n2C)C1=O	757285405	HUJQHLXLHXYEMO-HNNXBMFYSA-N	436.472	1.260	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc(OC(F)(F)F)cc1)NN=c1cc[nH]cc1Cl	757405745	FLDVKJQBHJSTFN-UHFFFAOYSA-N	438.815	1.867	50	20	IDGD	
Cc1nn([C@@H]2CCS(=O)(=O)C2)c(C)c1NC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	757871800	MUZOGDNARVCKMO-CQSZACIVSA-N	436.450	1.234	50	20	IDGD	
O=C(c1csc(-c2ncccc2F)n1)N1CCN(S(=O)(=O)CBr)CC1	758512146	IFQKJLSMXGFEPN-UHFFFAOYSA-N	449.327	1.784	50	20	IDGD	
CC(=O)N[C@@H](CC(=O)N1CCN(S(=O)(=O)CBr)CC1)c1cccs1	758534887	LHADUYHJZZOMEH-LBPRGKRZSA-N	438.369	1.142	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H](C#N)[C@H](NC(=O)NNC(=O)Cn2ccc3ccccc32)C1	758749474	BAKZINMITAAWIS-JKSUJKDBSA-N	426.477	1.731	50	20	IDGD	
Cc1ccc(-n2ncc(C(=O)NNC(=O)C(=O)Nc3ccccn3)c2C(F)(F)F)cc1	758840719	XMCPRAIBXQHDGM-UHFFFAOYSA-N	432.362	1.994	50	20	IDGD	
CC[C@H](CN1CCCC1)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	758848390	KGXSINDOHKDOAQ-QGZVFWFLSA-N	437.566	1.290	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc(OC(F)(F)F)cc1)NNc1ncccc1[N+](=O)[O-]	759292557	UANIIMNKPCKYGB-UHFFFAOYSA-N	449.367	1.700	50	20	IDGD	
CC(C)(C)OC(=O)N1CCc2c(NC(=O)C(=O)NNC(=O)c3ccccn3)cccc21	763466765	KMLTUGYKUMJXGC-UHFFFAOYSA-N	425.445	1.779	50	20	IDGD	
O=C1CCc2cc(F)c(NC(=O)C(=O)NNC(=O)c3ccccc3Br)cc2N1	763482039	CVFLZDHHAPPVFW-UHFFFAOYSA-N	449.236	1.873	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2c[nH]c3ccccc23)cc1S(=O)(=O)N(C)C	763536242	OHUHKFUASXFRJQ-UHFFFAOYSA-N	443.485	1.126	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)Nc1ccccc1N1CCCCCC1	763570201	DFAZWZSMAWPKHP-HXUWFJFHSA-N	438.484	1.993	50	20	IDGD	
CSc1cc2c(cc1NC(=O)C(=O)NNC(=O)COc1cccc(C)c1)OCCO2	763623888	PNALXNOXSYMFHB-UHFFFAOYSA-N	431.470	1.653	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(N3CCO[C@H](C)C3)cc2)cc1	763662089	UBNWPTSWPKTQQP-OAHLLOKOSA-N	442.472	1.085	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2OC)c(OC)cc1Cl	763663634	MFSMLZYZFJKAST-UHFFFAOYSA-N	437.836	1.531	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)cc1OCC(F)F	763682595	XHKREABEDMVXTM-UHFFFAOYSA-N	432.383	1.676	50	20	IDGD	
CCCN1Cc2cccc(NC(=O)C(=O)NNC(=O)CN3CCCc4ccccc43)c2C1	763729417	ZAWIQJJCXYPZEL-UHFFFAOYSA-N	435.528	1.951	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C)cc2)cc1Br	763809185	KPSIGRIXTDYSPR-UHFFFAOYSA-N	436.262	1.931	50	20	IDGD	
COC(=O)C(C)(C)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C)cc2)cc1	763809836	QOKOFQPWDNWPNS-UHFFFAOYSA-N	427.457	1.611	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cc(N3CCOC3=O)ccc2C)cc1	763820199	IZVNBVRBIZPFDP-UHFFFAOYSA-N	426.429	1.425	50	20	IDGD	
CCOc1cc2c(cc1[C@@H]1C[C@H]1C(=O)NNC(=O)CNC(=O)c1cccnc1)O[C@@H](C)C2	763825422	WVLJRWFGOKTUOO-QANKJYHBSA-N	438.484	1.485	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)NCCOC)c(Cl)c2)cc1	763832911	ZSCDGBIFOXINGO-UHFFFAOYSA-N	446.891	1.678	50	20	IDGD	
CCCN1C(=O)CCc2cc(NC(=O)C(=O)NNC(=O)COc3ccc(F)cc3)ccc21	763840870	ZPZSDBDRXFDPLK-UHFFFAOYSA-N	442.447	1.680	50	20	IDGD	
CN(C)C(=O)c1cc(NC(=O)C(=O)NNC(=O)Cc2c[nH]c3ccccc23)ccc1Cl	763857322	NCCWMORIVYFHQU-UHFFFAOYSA-N	441.875	1.852	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2c[nH]nc2-c2ccccc2)cc1	763875838	BJZUULHVYAQVGQ-AWEZNQCLSA-N	435.440	1.833	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3cccc(CS(C)(=O)=O)c3)cc2C1	763938278	CYSSYNCEMGFDHN-GFCCVEGCSA-N	449.554	1.817	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)C(=O)Nc1c(F)cccc1-n1cccn1	763995317	PVZXFPBAAKLIJB-UHFFFAOYSA-N	435.213	1.502	50	20	IDGD	
Cc1ccnc(Oc2cc(NC(=O)C(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)ccc2C)c1	764002670	PRPGPFVKLMUPTJ-AWEZNQCLSA-N	446.485	1.011	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1ccc(F)cc1OCC1CC1	764005543	ACMXJZNDDXLURW-UHFFFAOYSA-N	429.404	1.785	50	20	IDGD	
CNC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2OC)ccc1Cl	764010552	BDLOBHBAIQZFGB-UHFFFAOYSA-N	439.255	1.761	50	20	IDGD	
CC1CCN(C(=O)c2ccccc2NC(=O)C(=O)NNC(=O)Cc2ccsc2)CC1	764024573	HRUSRDWRLWZNIO-UHFFFAOYSA-N	428.514	1.949	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2OC)cc1Cl	764042231	FCPBDYGUXBUFGZ-UHFFFAOYSA-N	435.820	1.300	50	20	IDGD	
CNC(=O)[C@H]1CN(C(=O)C(=O)NNC(=O)c2cccc3ccccc23)c2ccccc2O1	764047840	HZBAXCUANBALLW-LJQANCHMSA-N	432.436	1.141	50	20	IDGD	
O=C(Cn1cc(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3c2)cn1)NC1CCCC1	764066271	DRBJGGGFWOFIMY-UHFFFAOYSA-N	448.483	1.495	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2cc(Cl)cc3cccnc23)c1	764086401	SNXINYGBSZBCDG-UHFFFAOYSA-N	446.872	1.691	50	20	IDGD	
CC[C@@H](C)C(=O)NNC(=O)C(=O)Nc1cc(S(=O)(=O)N2CCCCC2)ccc1OC	764086734	VUWXJYYCJNEYSB-CYBMUJFWSA-N	440.522	1.002	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2cc(OC)c(C(C)C)c(OC)c2)c1O	764133871	YNUQMEQCGJWXKJ-UHFFFAOYSA-N	431.445	1.941	50	20	IDGD	
CCNC(=O)N1CCc2ccc(NC(=O)C(=O)NNC(=O)CCCc3ccccc3)cc21	764223120	AGXPKUSJPOCPBQ-UHFFFAOYSA-N	437.500	1.887	50	20	IDGD	
CSCCc1ccc(NC(=O)C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1	764260946	UKWCJLUMXICCBN-UHFFFAOYSA-N	442.545	1.385	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1ccc2oc(C(F)(F)F)nc2c1	764278510	ZKACHPCWTPNCMH-UHFFFAOYSA-N	438.318	1.717	50	20	IDGD	
COCCOc1c(Cl)cc(NC(=O)C(=O)NNC(=O)c2cnn(C)c2)cc1Cl	764358807	ITOGQNVPTAWDAO-UHFFFAOYSA-N	430.248	1.152	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cccc(C(=O)NC)c3C)n[nH]2)cc1	764385321	XFNFFVMDFTWXBO-UHFFFAOYSA-N	448.483	1.707	50	20	IDGD	
Cc1ccc(Sc2ccc(NC(=O)C(=O)NNC(=O)[C@H]3COCCO3)cc2)c(C)c1	764424353	IVMZHZZEBOLNTQ-QGZVFWFLSA-N	429.498	1.956	50	20	IDGD	
CC(=NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)c1ccc(Cl)c(S(N)(=O)=O)c1	764690117	MAMGHTOYNTURCN-UHFFFAOYSA-N	444.922	1.937	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)CCC(=O)N1CC(=O)Nc2ccccc21	765318194	DFGBRYDXYHDZOB-UHFFFAOYSA-N	447.492	1.204	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)c2cccc(CN3C(=O)CNC3=O)c2)n[nH]1	765599454	GOINGUWANMBLTL-UHFFFAOYSA-N	448.439	1.212	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3ccnc(-n4cccn4)c3)CC2)cc1	765749963	WYHKCJJNPNBVGA-UHFFFAOYSA-N	433.516	1.155	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1cc2c(cc1F)NC(=O)CC2	767821678	FGDXDYMWOVQSTR-UHFFFAOYSA-N	433.465	1.387	50	20	IDGD	
Cn1ccnc1[C@H](O)[C@H]1CCCN(C(=O)NNC(=O)c2cc(Br)c[nH]2)C1	769950982	DKOQBOBNSWAZLG-GXFFZTMASA-N	425.287	1.311	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1cc([N+](=O)[O-])ccc1I	772003749	LTOVAJPDAULDDQ-ZETCQYMHSA-N	435.174	1.302	50	20	IDGD	
C[C@H]1CN(c2ccc(C(=O)NNC(=O)C(=O)NCc3ccc(Cl)cc3)cn2)C[C@H](C)O1	772194782	DOMXRZOFFRYHOC-KBPBESRZSA-N	445.907	1.426	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)c1cccc(CN2CCOCC2)c1	772884371	JVEHJCRRINDITG-UHFFFAOYSA-N	430.892	1.250	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)N[C@H](C)CS(=O)(=O)c1ccc(C)cc1	773131312	KQSPQIZSYYKGJA-OAHLLOKOSA-N	435.502	1.575	50	20	IDGD	
Cc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1cccc(Cl)c1	774010278	SEZAXUCHTIWCOC-ZDUSSCGKSA-N	446.891	1.904	50	20	IDGD	
Cc1ccc(C)c(C(=O)CCC(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1	775616822	GNSDEWNQMQFFOS-HXUWFJFHSA-N	440.452	1.797	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)Nc1ccc(C[C@H]2NC(=O)NC2=O)cc1	775705994	LHRRIJBJOUQUIT-IAQYHMDHSA-N	429.408	1.196	50	20	IDGD	
CN(NC(=O)c1cc(F)cc([N+](=O)[O-])c1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776201031	DTMYQNFGISJJDU-UHFFFAOYSA-N	425.417	1.983	50	20	IDGD	
CN(NC(=O)c1ccc2c(c1)CCC(=O)N2C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776205045	IIPBGFSOFOKWNN-UHFFFAOYSA-N	445.520	1.845	50	20	IDGD	
CN(NC(=O)Nc1ccc2c(c1)C(=O)NC2=O)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776424108	ZHVSVYVZEVFMSM-UHFFFAOYSA-N	446.464	1.211	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)nn1-c1ccc(Cl)c(Cl)c1	777368241	RNOHTISTIVOVLT-JTQLQIEISA-N	446.316	1.619	50	20	IDGD	
O=C(c1ccn(-c2ccccc2F)n1)N1CCN(S(=O)(=O)CBr)CC1	777777496	JZYYCZPESUXYFF-UHFFFAOYSA-N	431.287	1.451	50	20	IDGD	
Cc1cc(C(=O)N2CCC[C@@H]2C(=O)NNC(=O)CNC(=O)OC(C)(C)C)ccc1[N+](=O)[O-]	778436015	CMJGJNGURXRTLF-OAHLLOKOSA-N	449.464	1.180	50	20	IDGD	
COc1ccc(Cn2ccc(NC(=O)C(=O)NNC(=O)Cc3c[nH]c4ccccc34)n2)cc1	778707303	KJSQONAFVOFFAW-UHFFFAOYSA-N	446.467	1.750	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N2CCCCC2)cc1NC(=O)C(=O)NN=c1cc[nH]cc1	783378578	IICOGOPMTXKAIH-UHFFFAOYSA-N	447.517	1.159	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2ccccc2COCc2ccccc2)CCS(=O)(=O)C1	783426025	LHJKDVDAWANLNY-OAQYLSRUSA-N	431.514	1.540	50	20	IDGD	
C#CCOc1cccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)c1	784215467	IXKBGBJSVYMFLD-UHFFFAOYSA-N	428.470	1.221	50	20	IDGD	
COc1ccc(Cn2nccc2NC(=O)C(=O)NNc2nccnc2Cl)c(OC)c1	784777630	BNOZEQUPULGUHD-UHFFFAOYSA-N	431.840	1.474	50	20	IDGD	
CN1CCN(C(=O)c2ccccc2NC(=O)C(=O)NNc2cc(F)c(F)c(F)c2)CC1	785082770	ITQOZPJMQQARFO-UHFFFAOYSA-N	435.406	1.573	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)C1CC1	785227031	JKZWDTAASKBVEM-HNNXBMFYSA-N	425.507	1.545	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H]2CCc3cc(C#N)ccc32)c1	787422674	BERHCGXBWZLGIF-SFHVURJKSA-N	427.486	1.440	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1cc(-c2ccsc2)nn1C	787542924	FURKUJCPCBKUSL-NSHDSACASA-N	431.449	1.841	50	20	IDGD	
Cc1ccc(C)c(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)N3CCN(C)CC3)cc2)c1	788166521	PBQCPUFGNFXCBG-UHFFFAOYSA-N	445.545	1.706	50	20	IDGD	
C[C@H]1CC(C)(C)C[C@]2(C1)NC(=O)N(CC(=O)NNc1ccc(-n3ccnc3)nn1)C2=O	788177734	MBLHQQHKBIJNNR-RBZFPXEDSA-N	426.481	1.242	50	20	IDGD	
CC(C)[C@H](NC(=O)OC(C)(C)C)C(=O)NCC(=O)NNc1nnc(-c2ccccn2)s1	788568042	WSPCUYAESIZHEK-AWEZNQCLSA-N	449.537	1.709	50	20	IDGD	
CCOC[C@@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)C(C)C	788875875	HAXOTIRVCQCBFQ-GOSISDBHSA-N	440.566	1.866	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N2C[C@H](O)C(C)(C)C2)cc1	791161853	PFUCCYPHCOYRCW-LZOLKVDOSA-N	437.500	1.570	50	20	IDGD	
Cc1cccnc1NNC(=O)C1CCN(S(=O)(=O)c2ccc3c(c2)OCCO3)CC1	791225056	LLPDFWGEGMYLGP-UHFFFAOYSA-N	432.502	1.705	50	20	IDGD	
O=C(NNC(=O)c1cccc(Cl)c1)C(=O)Nc1cccc(N2C(=O)CCCC2=O)c1	792352149	CGWYFAKOFLPXLH-UHFFFAOYSA-N	428.832	1.783	50	20	IDGD	
CN1CCN(c2ccc(NC(=O)C(=O)NNc3nc4ccccn4n3)cc2Cl)CC1	792394957	UWVCJIGXPZWHRC-UHFFFAOYSA-N	428.884	1.216	50	20	IDGD	
Cc1cnn(C)c1S(=O)(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1	795305938	QWYPRQMDBJSJFA-HXUWFJFHSA-N	439.541	1.665	50	20	IDGD	
C[C@@H]1C[C@@H](C)[C@H](C(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)O1	800320132	RNWJEHRFJASVPQ-SPYBWZPUSA-N	431.514	1.740	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)C(F)(F)c2ccccc2OCC(=O)N(C)C)cc1	801108726	RMVFYEURCOFXRD-UHFFFAOYSA-N	448.426	1.340	50	20	IDGD	
CS(=O)(=O)c1ccc(C(=O)NNC(=O)NCc2ccc(Cl)cc2)cc1[N+](=O)[O-]	801219075	DHKCBBSGEYVZIO-UHFFFAOYSA-N	426.838	1.796	50	20	IDGD	
COc1cc(N2CCN(CC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)CC2)ccc1F	801965624	RGILJESPGFDKEF-UHFFFAOYSA-N	431.424	1.326	50	20	IDGD	
Cc1ccc2c(c1)C(=O)N([C@@H](C)C(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)C2=O	802067083	KUIZEJWFCYINFR-LBPRGKRZSA-N	444.469	1.236	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN([C@@H](CNC(=O)NNc2cccnn2)C(F)(F)F)CC1	802466991	DTLKCCPNBZAUNG-LBPRGKRZSA-N	433.435	1.586	50	20	IDGD	
COC(=O)N(C)NC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc(Br)s1	804124950	PGPOAJWYMVKJGO-SECBINFHSA-N	440.341	1.783	50	20	IDGD	
COCc1nc(Cl)cc(NNC(=O)Nc2ccc(C(=O)NCCC(=O)OC)cc2)n1	806183970	NSRUWRHPMIUPMD-UHFFFAOYSA-N	436.856	1.718	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(F)cc2OC2CCOCC2)c1	806973433	BDXRFZRFAJZMPR-UHFFFAOYSA-N	444.463	1.849	50	20	IDGD	
O=C1COC[C@H](C[C@@H]2CN(C(=O)C(=O)NNc3cccc(Cl)c3)c3ccccc32)N1	806984015	KPQZLNFWUIRYNP-CJNGLKHVSA-N	428.876	1.819	50	20	IDGD	
Cn1[nH]cc2c(=NC(=O)C(=O)NNc3ccc([N+](=O)[O-])cc3Br)ccnc1-2	806984976	CLBPHCYCOCJRRU-UHFFFAOYSA-N	434.210	1.094	50	20	IDGD	
O=C(NNc1cccc(F)c1[N+](=O)[O-])C(=O)Nc1cc(F)c(N2CCOCC2)cc1F	807068904	UOHPMHUFWFPOAR-UHFFFAOYSA-N	439.350	1.931	50	20	IDGD	
O=C(NCCC1(O)CCC1)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	807264548	RYBTUDRYUXURFB-UHFFFAOYSA-N	446.529	1.414	50	20	IDGD	
CCS(=O)(=O)c1ccc([C@@H](C)NC(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)cc1	807268333	CUZJTYFJJZUBAD-LLVKDONJSA-N	436.446	1.799	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)NC1CCC2(CC1)NC(=O)NC2=O	807545561	XFHSDOBEANLXKR-HBBRBTLGSA-N	439.472	1.458	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)Nc2ccc(-c3ncon3)cc2)ccc1Cl	809149124	XQAJQMWGGDNSNG-UHFFFAOYSA-N	436.837	1.504	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@@H](C)C(=O)NNC(=O)CNS(=O)(=O)c1cccnc1	809980785	UXMVGTJNUJUNHS-ZDUSSCGKSA-N	440.909	1.245	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)CNS(=O)(=O)c2ccc3ccccc3c2)c1O	810191077	MNBCYGNBTCCZFS-UHFFFAOYSA-N	429.454	1.294	50	20	IDGD	
Cc1cc(CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc(N2CCCC2)n1	811851933	YOIJTSIOZNXXMY-UHFFFAOYSA-N	445.549	1.428	50	20	IDGD	
COCCOC(=O)c1c(C)[nH]c(C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)c1C	812732991	XDNMZWKPPHHHCY-UHFFFAOYSA-N	438.506	1.442	50	20	IDGD	
COC(=O)c1c(C)csc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	813034009	VEFUXZFXYITOJL-UHFFFAOYSA-N	440.503	1.175	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)C(C)(C)S(=O)(=O)c2ccc(Cl)cc2)cc1	813373958	NGWPECMEBPRNMK-UHFFFAOYSA-N	437.905	1.987	50	20	IDGD	
O=C(NNC(=O)C1(Cc2ccccc2Br)CC1)N[C@@H]1CCS(=O)(=O)C1	814620492	TWWBQSGFXAHKAK-GFCCVEGCSA-N	430.324	1.289	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NN=Cc2ncc(Br)s2)cc1	814730518	QEGZXBIGEGQTOP-UHFFFAOYSA-N	431.337	1.985	50	20	IDGD	
O=C(COC(=O)COc1ccc(Cl)c(F)c1)NNC(=O)c1cccc([N+](=O)[O-])c1	815301127	QXCHDNOQIJHHLC-UHFFFAOYSA-N	425.756	1.771	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCc2nncn2C1)C(=O)Nc1ccc(Sc2ccncc2)cc1	815691222	JAUGGIBGGZFDRX-CYBMUJFWSA-N	437.485	1.173	50	20	IDGD	
O=C(CC1CC1)NNC(=O)[C@H]1Cc2ccccc2CN1S(=O)(=O)c1ccc(F)cc1	819136561	ZYCQRHODXBVTJP-LJQANCHMSA-N	431.489	1.889	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)c3c(C)noc3n2)cc1	836699102	CXXLXKHJCMFFDA-AWEZNQCLSA-N	428.470	1.702	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCc3ccccc32)cc1C(=O)N1CC[C@@H](B(O)O)C1	864234287	UHYQSRVBUJHMLP-OAHLLOKOSA-N	430.291	1.136	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)CCNC(=O)C(C)(C)C)c2ccccc2c1=O	871399575	WRJQBKWUYPIWHQ-UHFFFAOYSA-N	429.521	1.900	50	20	IDGD	
Cc1cc(C)c(C)c(S(=O)(=O)NCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1C	913416738	RQYGKBRBOPWXBR-SFHVURJKSA-N	447.513	1.186	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)Cc2ccc(-n3cccc3)cc2)ccc1Cl	914750132	WLDLVIBIWYYCLK-UHFFFAOYSA-N	432.889	1.782	50	20	IDGD	
CNS(=O)(=O)c1cccc(CNC(=O)NNC(=O)c2cc3c(s2)CC[C@H](C)C3)c1	915259071	CPIARNABHLJZPS-LBPRGKRZSA-N	436.559	1.925	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)[C@@H]2CC(=O)N(Cc3cccc(C(F)(F)F)c3)C2)n1	915690963	YPQMEURNEYSYFJ-OAHLLOKOSA-N	437.422	1.715	50	20	IDGD	
O=C(NCCCc1ccccc1)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	915885527	FABFELRCLAPOHU-UHFFFAOYSA-N	446.529	1.284	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NC[C@@H](c2ccc(F)cc2)N2CCOCC2)cc1	915897300	BULDKGUESYCVLN-FQEVSTJZSA-N	446.479	1.617	50	20	IDGD	
O=C(NCCCn1cccn1)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	916377566	XIFAIMOWQFRVPJ-UHFFFAOYSA-N	434.522	1.092	50	20	IDGD	
COc1cc(C)c([C@H](C)NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1OC	916484235	BXRQZTKHKURBFC-ZDUSSCGKSA-N	425.449	1.693	50	20	IDGD	
CCCNC(=O)CN1CCC(NC(=O)NNC(=O)CSc2ccc(Cl)cc2)CC1	916518780	KOWUHLFSLILCQF-UHFFFAOYSA-N	441.985	1.753	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)c3ccc(S(=O)(=O)N4CCCC4)o3)n[nH]2)cc1	917178637	NEWIBXDSZPGFHL-UHFFFAOYSA-N	443.485	1.837	50	20	IDGD	
C[C@@H]1CCCN(S(=O)(=O)c2ccc(CNC(=O)NNC(=O)CC(F)(F)F)cc2)C1	918081432	AMTVABKZGRGZBK-GFCCVEGCSA-N	436.456	1.890	50	20	IDGD	
O=C(CC(F)(F)F)NNC(=O)C1CCN(S(=O)(=O)c2cccnc2Cl)CC1	918364746	RUXRIOVDGMWZCD-UHFFFAOYSA-N	428.820	1.236	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)OCC(=O)N[C@H](C)C(=O)N(C)C)c(C)n1C[C@@H]1CCCO1	918952504	IGMTUNIVIGDTLP-HJKDRAGNSA-N	430.505	1.327	50	20	IDGD	
COc1cc(CNC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)ccc1C	919791324	JTFOGQYZGPLTQY-UHFFFAOYSA-N	448.549	1.161	50	20	IDGD	
Cn1cc(C(=O)NNS(=O)(=O)c2cc3c(c(C(=O)O)c2)OCCO3)c2ccccc21	919956334	VACPHRGWHMBPFX-UHFFFAOYSA-N	431.426	1.271	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(NC3CC3)nc2)c1	919969870	GDMCYVLJIPPAOG-UHFFFAOYSA-N	431.518	1.761	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)NNC(=O)COc2ccc(C#N)cc2)cc1OC	920930253	BWEJLUUNWIQDKT-UHFFFAOYSA-N	447.473	1.560	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)Nc2ccccc2CN2C(=O)CNC2=O)c1	920930487	KHUHBPPLSVADGC-UHFFFAOYSA-N	425.445	1.587	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)cc2F)C[C@@H](C)O1	920933185	RMMRPWFEHCXDGS-XQQFMLRXSA-N	428.486	1.027	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)c1ccc(N2CCC[C@H](C(N)=O)C2)cc1	1324036100	FQCMBPMMUABHBG-ZBFHGGJFSA-N	428.464	1.756	50	20	IDGD	
CCS(=O)(=O)Nc1cccc(C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)c1	1324146807	YOXRHSIVCQIXCE-UHFFFAOYSA-N	426.520	1.455	50	20	IDGD	
CC(C)n1nc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](F)Cl)C2)cc1C(=O)O	1778023980	LEFUPZHVSNCYAL-ZRGWGRIASA-N	444.891	1.824	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc(OC)cn2)C1	1778388550	FHESKXZQOKZSPF-WRWLIDTKSA-N	425.913	1.472	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)c3cccc4ncsc34)C2)C1	1778650196	APMUPSMLOZSGDO-NRFANRHFSA-N	445.545	1.113	50	20	IDGD	
C[C@@H](Nc1nccs1)C(=O)N1CCO[C@@]2(CCN(C(=O)CO[Si](C)(C)C)C2)C1	1779295646	VBEGNIMEVBPQNH-RDTXWAMCSA-N	426.615	1.625	50	20	IDGD	
Cc1ccn2ncc(C(=O)N3CCO[C@]4(CCN(C(=O)CO[Si](C)(C)C)C4)C3)c2c1	1779295894	XZLTWDRJAZPXSU-NRFANRHFSA-N	430.581	1.938	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3nc(O)n4c3CCCC4)C2)C1	1779349165	STSVCZYFHANKRW-KPZWWZAWSA-N	441.326	1.152	50	20	IDGD	
COc1ccnc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)c1OC	1780451551	SNSZMSNZJDZSMA-XIKOKIGWSA-N	442.310	1.326	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2	1780574910	DHKHFNMHIRMFMU-NNMXDRDESA-N	433.936	1.824	50	20	IDGD	
CC[C@H](NC(C)=O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Br)C1	1780770243	JUKHQQWEYXMFKC-ZOMKSWQUSA-N	436.322	1.106	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)Nc1cccnc1)C2	1782170390	KJHJDKINUHGFIP-DZKDUJFISA-N	438.956	1.650	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccn4c(C)cc(C)nc34)C2)C1	1782578213	KDJVRPGZCUFHLU-UTKZUKDTSA-N	434.924	1.648	50	20	IDGD	
Cc1ccccc1OCC(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](C)Br)C2)C1	1783532406	HPJKERUMIIAFSG-KXBFYZLASA-N	425.323	1.987	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cc(Cl)c4nncn4c3)CCO2)C1	1783877654	MQDSQTIZPKLYOJ-RDTXWAMCSA-N	442.303	1.080	50	20	IDGD	
COc1ccc(/C=C(\C)C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]3C2)cc1	1784093755	FVSHHYJSORQULG-APZZBHBJSA-N	436.936	1.678	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccn(C(C)(C)C)n3)[C@H]2C1	1785702744	KDJVMDAHLNWYJT-JKQORVJESA-N	426.945	1.485	50	20	IDGD	
O=C(CS(=O)(=O)N1CCCC1)NC1(c2ccc(NC(=O)[C@@H](O)CCl)cc2)CCC1	1786132123	KJEQKNYRQZLBCW-INIZCTEOSA-N	443.953	1.146	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)N(C)C(C)=O)[C@H]2C1	1787521073	BHWTXJRAPQTMBT-YDMUCJKGSA-N	432.359	1.006	50	20	IDGD	
COCc1oncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)CBr)C[C@@H]21	1787719259	NKCIZBVPMWCTOO-DHMWGJHJSA-N	444.326	1.445	50	20	IDGD	
COc1ccc2oc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)[C@@H](O)CCl)C[C@@H]43)cc2c1	1788275967	IZVPJONUJZSKLV-DLLGKBFGSA-N	436.892	1.634	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21)c1cc(Cl)c2nncn2c1	1788558445	VMPKNZQJPLLGKO-RETIQXCHSA-N	430.267	1.510	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4cn[nH]c4cn3)C[C@@H]21	1788764264	IDQSCGFHSZQWCR-YEWWUXTCSA-N	431.569	1.403	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3noc(C)n3)C[C@@H]21	1790961788	UTNXPXWDDUARID-XUXIUFHCSA-N	429.315	1.074	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3ccc(F)nc3)C[C@@H]21	1791252942	ZGPRYAVQMXKFDO-QAETUUGQSA-N	427.904	1.387	50	20	IDGD	
CCn1nc(C(C)C)cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](Cl)COC)[C@H]2C1	1791254179	PENMUXBKHKCFKF-GGXPGOJBSA-N	440.972	1.874	50	20	IDGD	
Cc1cc(C(N)=O)cc(C)c1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]2C1	1791298235	KTBJAKDMCPPXNW-QEJZJMRPSA-N	442.343	1.799	50	20	IDGD	
COc1cscc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)CBr	1792867836	IUZIOFMIIBJWNO-OHTBPHCPSA-N	431.352	1.991	50	20	IDGD	
CCN(CC)C[C@@H](C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)CBr	1792872131	NLOIYGPLNYJRSI-NNXHMXCWSA-N	432.403	1.585	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ncc(OC)cc1F	1794453410	CIWGICRSKURVQV-WJNVRWDZSA-N	444.301	1.606	50	20	IDGD	
Cc1ccccc1OCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnccc1C(=O)NN)C2	1795724017	VTYJBPZVERLGHX-BJWYYQGGSA-N	437.500	1.324	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)c1cc(Cl)ccc1F	1796185679	GADLQMZEOYUIFH-BJWYYQGGSA-N	430.672	1.725	50	20	IDGD	
C=C(CC(=O)OCC)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C(C)=N/NC(=O)c1ccc[nH]1	1796892816	WOGPYZXAUIMKCP-GSWMANSFSA-N	443.504	1.268	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2cc(F)c(F)cc2[nH]1	1797339481	WKHRQCVTQFCTQJ-YFQWEKLQSA-N	441.862	1.903	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CCc3ccccc3[C@@H]1O)C2	1797953981	ZOHMIWNSPQBWJE-VVMYPULBSA-N	446.620	1.724	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CS[C@H]1CCCCO1)C2	1798440622	TYIFAPWTEIXWBI-YGTYGHESSA-N	447.561	1.197	50	20	IDGD	
C[C@H](NNc1ccccc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@](C)(Cl)CCl	1799273704	OMKAJOJDZDKLSK-FXTXOLNPSA-N	443.375	1.818	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnn3ncccc13)C2	1799274999	GJAZNKVKYAQKFZ-ABXQLRGKSA-N	426.304	1.169	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)[S@@](=O)c1ccccc1	1800217140	RDRSQWDATBQBAF-YPJWYIRZSA-N	426.966	1.790	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnco1)C2	1800332489	QSJUGLVZQDCLBR-PSKFDLRZSA-N	428.395	1.763	50	20	IDGD	
N#CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C#N)=C/c1ccc(Br)cc1	1800333711	HSXLIHYLUWJMJW-MAZHBOQJSA-N	443.301	1.859	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)[S@](=O)c1ccccc1)C2	1800979515	NUEDGSAGGBZMDM-IWLKUAPJSA-N	442.965	1.026	50	20	IDGD	
COc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C(Cl)Cl)ccc1[N+](=O)[O-]	1801021583	YGEPMSDFPPCWCZ-GNXNZQSNSA-N	432.260	1.610	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1CCN(CC)CC1	1802173734	IFXBPKCWIOHICQ-YYIAUSFCSA-N	430.387	1.481	50	20	IDGD	
COc1ccc(OCC(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]2c2cccnc2)cc1	1803136269	AUPINSOAZROFIK-OZOXKJRCSA-N	447.919	1.775	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)C1CCCCC1	1806223902	CBANRYTWGILEQM-IRLDBZIGSA-N	435.333	1.661	50	20	IDGD	
CC[C@H](NC(C)=O)C(=O)N1CC[C@@H](CNC(=O)CCBr)[C@H]1c1cccnc1	1806337432	HUVITGLUMAZQNB-XYJFISCASA-N	439.354	1.787	50	20	IDGD	
CC(F)(F)C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1	1806962819	LUDYVRAVLRZXNW-CZUORRHYSA-N	432.431	1.055	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)c2ccsc2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807365610	ZELJTVZSESFBOB-XLIONFOSSA-N	435.314	1.456	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)c2cnco2)[C@@H]1c1cccnc1	1808408720	JPEBMINTWPOWBF-RUVVGEKZSA-N	449.471	1.523	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)c3nccc4[nH]ccc34)CC2)C1	1809978184	OJKQOFWPRMNDPT-UHFFFAOYSA-N	446.316	1.401	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@@H](CNC(=O)c2ccnnc2O)[C@H]1c1cccnc1	1811220633	DMMUJDYYQKGCAG-IVMMDQJWSA-N	448.321	1.928	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2cnn3c2CCC3)[C@H]1c1cccnc1	1813034219	DYUAJEHXSMHAKR-IEZWGBDMSA-N	431.924	1.798	50	20	IDGD	
Cc1cnc2c(C(=O)N3CCCC[C@@H]3c3cc(NC(=O)[C@@H](O)CCl)n[nH]3)cnn2c1	1814873159	NSCUKEHRJVMINE-CABCVRRESA-N	431.884	1.666	50	20	IDGD	
C[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](O)CCl)n[nH]1	1814878067	SUQPDZOUJFDKIU-MRVWCRGKSA-N	443.932	1.915	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)CCSC(=N)N)sc2C1	1814952167	PQLRYFHWCHKVHK-SFYZADRCSA-N	434.385	1.855	50	20	IDGD	
CCS(=O)(=O)CC(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](C)Br)[nH]n1	1815173928	INQCREAQADEKSG-JQWIXIFHSA-N	435.344	1.620	50	20	IDGD	
CN[C@@H](CC(=O)N1CCCC[C@H]1c1cc(NC(=O)CCBr)n[nH]1)C(=O)O	1816781966	JLEDXYKTBKVAOZ-RYUDHWBXSA-N	430.303	1.250	50	20	IDGD	
O=C(N[C@@H]1CCc2nc(NC(=O)[C@H]3Cc4ccccc4CN3)sc2C1)[C@@H](O)CCl	1817132314	IJGAYUNCBOMFBI-BMFZPTHFSA-N	434.949	1.369	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](O)N2CCOCC2)n[nH]1	1819448349	OAUAVAXGNDTKBU-XCRHUMRWSA-N	448.351	1.289	50	20	IDGD	
C[C@@H](CS(C)(=O)=O)C(=O)N[C@H]1CCc2nc(NC(=O)CO[Si](C)(C)C)sc2C1	1820160159	FYQBQMUBJWDDHT-RYUDHWBXSA-N	447.655	1.587	50	20	IDGD	
N#Cc1cccc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2ccc(B(O)O)cc2)CC3)c1	1822027268	HQCMOCNORPPOEF-QGZVFWFLSA-N	446.297	1.234	50	20	IDGD	
Cc1n[nH]c(C)c1CC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCC(=O)NN(C)C)CC2	1823132058	GRJAMBCSLBBBSC-ZDUSSCGKSA-N	447.565	1.011	50	20	IDGD	
O=C1NCc2cc(C(=O)N3CCC([C@H]4CCCCN4C(=O)[C@@H](O)CCl)CC3)ccc21	1824186299	MRCSYLQCYBPZPN-MOPGFXCFSA-N	433.936	1.763	50	20	IDGD	
Cc1ccc(CC(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)cn1	1825295983	ZTWUXEFWGZZPNR-HSZRJFAPSA-N	449.360	1.546	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CN1CCNC1=N)CC2	1825447254	UJUUPFFHHCAQKN-UWVGGRQHSA-N	443.371	1.069	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(C(=O)O)ncn1)CC2	1825993023	DEWDTEMLXHFHKC-BDAKNGLRSA-N	439.881	1.111	50	20	IDGD	
Cc1nocc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827050772	FTJVAGJJMHOQRJ-FQEVSTJZSA-N	425.294	1.210	50	20	IDGD	
Cc1cc(CC(=O)N2CCC([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)no1	1827060700	XPQPOJHNRKQGRG-OAQYLSRUSA-N	439.321	1.139	50	20	IDGD	
N#Cc1ccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)cc1	1830013292	WFJSEDDPTMBUSI-QHCPKHFHSA-N	445.328	1.785	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1C[C@H]1C1CC1)CCO2	1830490380	TVOOTHZKSGEBIF-DEWZPKMOSA-N	429.355	1.520	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)C3CCC(O)CC3)C2)C1	1830544035	LQNIMXJGTQNXNA-GKSFYBEXSA-N	447.370	1.025	50	20	IDGD	
C=CCC(CC=C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1830642381	AGCCUJFARHNTBW-MAUKXSAKSA-N	433.318	1.902	50	20	IDGD	
C[C@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1)C1(O)CCC1	1831870176	SDSSEOJFEHGLRY-MJGOQNOKSA-N	436.597	1.530	50	20	IDGD	
COc1ccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)c(Cl)c1	1832537309	AGUFAHJNIOSIEZ-MJGOQNOKSA-N	449.306	1.882	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)/C=C/c3ccoc3)CCO2)C1	1832651642	OQNCKHCGRBZNBR-XVXNLHAJSA-N	431.316	1.986	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cccc4nccn34)CC2)CC1)[C@@H](O)CCl	1833312563	XMZKLSWEIHVHTH-SFHVURJKSA-N	433.940	1.119	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(OC(F)F)cn3)CCO2)C1	1833641822	QTYRWHXSRARASF-KUHUBIRLSA-N	447.866	1.770	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](C)CBr)C3)C2)c(C)o1	1834090620	OCGCPQJJZNKDDS-DJJJIMSYSA-N	443.338	1.997	50	20	IDGD	
O=C(c1scnc1C(F)(F)F)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1834571641	XDHTXWBFAZMAOQ-RISCZKNCSA-N	445.822	1.766	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCC(N2CCC(NC(=O)CSC(=N)N)CC2)CC1	1834655500	KIPPJWCWRZZWKV-QGZVFWFLSA-N	438.425	1.421	50	20	IDGD	
Nc1nc2cc(C(=O)N3CCO[C@]4(COCCN(C(=O)[C@H](F)Cl)C4)C3)ccc2s1	1835784680	KJELUJIQVHDVQH-KBXCAEBGSA-N	442.900	1.483	50	20	IDGD	
C#CC(=O)N1CCC(N2CCC(NC(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)CC2)CC1	1836107358	DJDYEBXRLRHIIV-UHFFFAOYSA-N	442.472	1.339	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3cccnc3)CCO2)C1	1836181259	GOISBCSDRZWYQP-KXBFYZLASA-N	440.338	1.254	50	20	IDGD	
CCN(C)[C@@H](C)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](F)Br)CC2)CC1	1836413997	SYISFLNQFOJEJB-XJKSGUPXSA-N	435.382	1.589	50	20	IDGD	
O=C(c1cc(O)nc(Cl)c1)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836714965	GLNCFDZRSYVDBQ-HNNXBMFYSA-N	446.331	1.653	50	20	IDGD	
O=C(c1ccc2ncncc2c1)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836717370	VLZPZCABLCNCTA-HXUWFJFHSA-N	446.935	1.842	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CSCc3[nH]cnc3C)CCO2)C1	1837330653	DCXCGQMXSINRJG-HNAYVOBHSA-N	444.985	1.425	50	20	IDGD	
O=C(CCBr)N1CCC(OC2CCN(C(=O)c3cncnc3)CC2)CC1	1837505500	WXILCNZYEYZRNX-UHFFFAOYSA-N	425.327	1.874	50	20	IDGD	
CN1CCN(CCC(=O)N2CCC(OC3CCN(C(=O)[C@@H](F)Cl)CC3)CC2)CC1	1837806624	LIDROBXQVLOQLK-LJQANCHMSA-N	432.968	1.157	50	20	IDGD	
CC(C)n1nccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)Br)C2)C1	1838024781	OOVMMMIFCKCYET-RDTXWAMCSA-N	443.342	1.317	50	20	IDGD	
O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)c1cc(F)ccc1F)CCO2	1838858924	XICZSXCZNZNMHP-SFHVURJKSA-N	447.276	1.820	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C)n4ccnc4n3)C2)C1	1839148254	SLFALRPFVCJJLJ-QRWLVFNGSA-N	435.912	1.125	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnn4c3CCC4)C2)C1	1839154717	VJRBBYGBSCSAPB-RTBURBONSA-N	445.347	1.136	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1CCc3nc[nH]c3C1)CCO2	1840361261	URXLBSNHHPKZBC-XFQAVAEZSA-N	438.956	1.379	50	20	IDGD	
C[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1)c1cccs1	1840375874	DFDSHRXGYOIECP-DXCKQFNASA-N	449.342	1.999	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)N1CCCC12CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)C2	1843429146	JPHAFMJQCJUJPW-IREQLNLFSA-N	430.455	1.942	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1cccc3c1CCCC3)C2	1844265506	KEZNNCLBVQWMSV-UHFFFAOYSA-N	433.512	1.695	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)C23CC(NC(=O)OC(C)(C)C)(C2)C3)C1	1846110088	PNSBGNUSEPHNIF-JAGHRAMZSA-N	441.956	1.891	50	20	IDGD	
Cc1ccc(C)c(N2N=C(C(=O)OCC(=O)NNC(=O)c3cccs3)CCC2=O)c1	9397413	WYXMKKBKEDJLRW-UHFFFAOYSA-N	428.470	1.852	50	20	IDGD	
COc1ccc(OCCN(C)C(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1	9790085	ZVFUSDAWXGLJNY-UHFFFAOYSA-N	435.506	1.354	50	20	IDGD	
CCOc1ccc(N2C[C@H](C(=O)NNC(=O)c3ccc(OC)c(OC)c3)CC2=O)cc1	10143093	KDCGJVPXMBALOB-OAHLLOKOSA-N	427.457	1.917	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)CNc2cccc(C(F)(F)F)c2)c1	11652368	GWILIRMDUUKETN-UHFFFAOYSA-N	444.435	1.829	50	20	IDGD	
COc1ccc(N2C[C@@H](C(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)CC2=O)c(OC)c1	17363966	GQNCXEPUWHTKCL-ZDUSSCGKSA-N	428.401	1.426	50	20	IDGD	
COC(=O)CNC(=O)COC(=O)/C(C#N)=C/c1cc(C)n(-c2ccc(OC)cc2)c1C	22209075	VFHDNIFCCJBOGV-LICLKQGHSA-N	425.441	1.842	50	20	IDGD	
Cc1ccc(S(=O)(=O)NC2CC2)cc1C(=O)NNC(=O)[C@@H]1COc2ccccc2O1	24880335	ZGIVUBXCWXSWJT-SFHVURJKSA-N	431.470	1.037	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)c2ccccc2OCC(=O)N(C)C)cc1	27741273	FZNGZBSHHJJAEH-HNNXBMFYSA-N	429.473	1.781	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)Cn1nnc2ccccc2c1=O	105181681	CAEQDSXMYWKIAO-LLVKDONJSA-N	446.261	1.169	50	20	IDGD	
COc1ccc(C(=O)NNc2nc(-c3cccnc3)no2)cc1S(=O)(=O)N1CCCC1	728078664	ORZATLSUTFXGKQ-UHFFFAOYSA-N	444.473	1.682	50	20	IDGD	
C[C@H](OCc1ccccc1)C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	728214170	MNCHTEMRUMUWAB-KRWDZBQOSA-N	432.546	1.671	50	20	IDGD	
CCN(Cc1ccccc1)C(=O)CNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1	728950570	TZEWIIGXDNHUEO-UHFFFAOYSA-N	439.520	1.072	50	20	IDGD	
CCOC(=O)[C@@H]1CCCN(C(=O)CN(C)C(=O)NNC(=O)CCCc2ccccc2)C1	728953796	BXSOWRHOKNJIMG-GOSISDBHSA-N	432.521	1.484	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)N2CCN(S(=O)(=O)c3ccc(Cl)cc3)CC2)c1	728954230	ADPSYPHVNDUNNL-UHFFFAOYSA-N	447.904	1.573	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)c1cccc(CN2CCS(=O)(=O)CC2)c1	729451782	DAOBXOGLGSOLMR-UHFFFAOYSA-N	440.525	1.333	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)NCCOc2ccc(S(C)(=O)=O)cc2)cc1	730067381	XPDJRUZZGBQSRS-UHFFFAOYSA-N	435.502	1.441	50	20	IDGD	
O=C(NCCCN1CCN(c2ncccn2)CC1)NNC(=O)c1cccc2ncccc12	730113763	AFQBTZQJMKTYFT-UHFFFAOYSA-N	434.504	1.181	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)[C@H]1CCN(c2ccc3c(c2)OCCO3)C1=O	730589641	LKTLOUBXWAIXLI-MRXNPFEDSA-N	425.441	1.209	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)N1CCC(NS(=O)(=O)c2cccs2)CC1	731499728	COEUKRMPBYGRMK-UHFFFAOYSA-N	438.531	1.554	50	20	IDGD	
O=C(NNC(=O)c1nnc2ccccc2c1O)c1cccc(S(=O)(=O)N2CCCC2)c1	732258801	TUXSNFAIFUJFDA-UHFFFAOYSA-N	441.469	1.195	50	20	IDGD	
COc1ccccc1CC(C)(C)C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	733026185	GTJKMHXYUUEHEZ-LJQANCHMSA-N	442.468	1.795	50	20	IDGD	
COCCN1C[C@@H](C(=O)NNc2nc3ccccc3c(=O)n2-c2ccc(C)cc2C)CC1=O	733264687	DNRPOTLZOGRZFU-KRWDZBQOSA-N	449.511	1.941	50	20	IDGD	
Cc1nc(SCC(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)c(C#N)c(C)c1C	734239518	QJNVRXCFXTZUMP-UHFFFAOYSA-N	436.538	1.826	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)N[C@H]2CCN(C3CC3)C2)c2ccccc2c1=O	734285628	QGHSPPSAOUVVKT-HNNXBMFYSA-N	426.521	1.767	50	20	IDGD	
CN1C(=O)C[C@@H](C(=O)NNC(=O)COc2ccc(C#N)cc2)[C@H]1c1cccc(Cl)c1	734417639	SQYOBMRTTJWQLX-YLJYHZDGSA-N	426.860	1.957	50	20	IDGD	
CN(CC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)[C@@H]1CCCN(c2ccccc2)C1=O	734489052	SOAOSVMMVISGOX-GOSISDBHSA-N	425.445	1.483	50	20	IDGD	
CN1C(=O)C[C@H](C(=O)OCC(=O)NNC(=O)c2ccccc2)[C@@H]1c1cccc(Cl)c1	734637500	RYYFNLITGMNAAG-LPHOPBHVSA-N	429.860	1.864	50	20	IDGD	
CSCc1ccc(C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)cc1	735117341	ROTVIDJOXSREBI-UHFFFAOYSA-N	435.575	1.638	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)NCc2cccc(S(=O)(=O)NCCOC)c2)cc1	735519211	QVXUMGVRSYQWQG-UHFFFAOYSA-N	434.518	1.318	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)[C@@H]2CCC[C@@H]2NC(=O)OC(C)(C)C)c2ccccc2c1=O	739678915	NHOJWBDRJXFKKZ-CABCVRRESA-N	429.477	1.388	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNS(=O)(=O)c1cc(Cl)c(Cl)c(C(=O)O)c1	740812476	KQGNGZSMLDAHFG-UHFFFAOYSA-N	426.278	1.306	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)N[C@@H]1CC(=O)N([C@H]2C[C@@H]2c2ccccc2)C1	743508311	NKWMFCFMYKAYKW-KURKYZTESA-N	432.484	1.744	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)N[C@@H]1CC(=O)N([C@H]2C[C@H]2c2ccccc2)C1	743508952	VIWTURGORWRGNF-YCPHGPKFSA-N	446.305	1.878	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)CCc2nc(-c3ccccn3)no2)cc1	743829610	XUWOZYLKYIXVCC-UHFFFAOYSA-N	430.446	1.321	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)CN2C(=O)CCOc3ccccc32)cc1	743831610	ZSMUIFBLEAKKSQ-UHFFFAOYSA-N	432.458	1.059	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1c[nH]c2ccc([N+](=O)[O-])cc12	744620288	IATIBBLNGWKMLU-UHFFFAOYSA-N	445.457	1.854	50	20	IDGD	
O=C(COCCOc1ccccc1)NNc1ccccc1S(=O)(=O)N1CCOCC1	744621980	LATHFVXQSFEQDT-UHFFFAOYSA-N	435.502	1.246	50	20	IDGD	
O=C(COC(=O)[C@H]1C[C@H]1c1ccc2c(c1)OCCO2)NNC(=O)c1cccc([N+](=O)[O-])c1	745285686	XZUSULWOCJNZSM-HOTGVXAUSA-N	441.396	1.474	50	20	IDGD	
COc1cccc(N2C[C@H](NC(=O)NNC(=O)c3cc([N+](=O)[O-])ccc3O)CC2=O)c1	745794389	ACBMMOORUSNANR-LLVKDONJSA-N	429.389	1.059	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H](CCC#N)c2ccccc2)c1	749219411	CDOKWSGNJYWCIS-GOSISDBHSA-N	429.502	1.926	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)CCC(C)(C)C(=O)NNC(=O)c1ncccc1C	752241538	WRQNEEBVHLRHLP-UHFFFAOYSA-N	426.477	1.122	50	20	IDGD	
Cc1ccc(C)c(S(=O)(=O)NCCC(=O)NNc2nc3ccccc3c(=O)n2C)c1	752909851	ZGGDSGHXAGUIEQ-UHFFFAOYSA-N	429.502	1.362	50	20	IDGD	
C[C@@H](Cc1cc(Br)ccc1F)NC(=O)NNC(=O)C(=O)Nc1ccccn1	755096071	LQSDGWYWSUMGSD-JTQLQIEISA-N	438.257	1.883	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)[C@@H](C)CS(=O)(=O)c2ccc(F)cc2)cn1	755668346	NEDACTIADHKESW-NSHDSACASA-N	426.495	1.657	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1NS(C)(=O)=O	756514934	BYKPJYDJCJUOBV-UHFFFAOYSA-N	440.503	1.237	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)Nc2ccc(Br)cc2Cl)co1	757645152	CFCWSMNJNXMSEP-UHFFFAOYSA-N	437.659	1.809	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2cc(Br)c[nH]2)cnn1CCO[C@H]1CCCCO1	758140494	UDTQUJHWSBFFEJ-HNNXBMFYSA-N	440.298	1.900	50	20	IDGD	
O=C(NNC(=O)c1csc(-c2ccc3c(c2)OCCO3)n1)C(=O)Nc1ccccn1	758840958	ZPMAXWISELZFGF-UHFFFAOYSA-N	425.426	1.376	50	20	IDGD	
CCO[C@@H]1C[C@H](NC(=O)NNC(=O)COc2ccc(Br)cc2)[C@@]12CCCO2	759325450	YZHAAAGBABFVDJ-DAYGRLMNSA-N	442.310	1.885	50	20	IDGD	
CC1(C)C(=O)N(C[C@@](C)(O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)c2ccccc21	760052860	GJMXOJHVSVCHKH-WZONZLPQSA-N	439.468	1.049	50	20	IDGD	
Cc1cc(C)nc(-n2nccc2NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2Cl)n1	760303625	PUSXJCZTYBMFPF-UHFFFAOYSA-N	430.812	1.923	50	20	IDGD	
N#Cc1c([N+](=O)[O-])cccc1S(=O)(=O)NNC(=O)c1ccc(F)cc1Br	760344340	LLROAVAPGNLKKC-UHFFFAOYSA-N	443.210	1.991	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CN2CCCN1CC2)c1nc(-c2ccccc2)n(-c2ccccc2)n1	763270293	ITHUEGVLLXUONP-IBGZPJMESA-N	431.500	1.085	50	20	IDGD	
CCOC(=O)Cn1ccc2cc(NC(=O)C(=O)NNC(=O)c3cc(C)oc3C)ccc21	763577092	RYRQMYPIHGORGS-UHFFFAOYSA-N	426.429	1.814	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(OC[C@H]3CCCO3)c2)c1	763623777	NDUWIDCAHXMKES-LJQANCHMSA-N	427.457	1.718	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2C)c2ccccc2c1=O	763787322	XCTICGYGDYWFPF-UHFFFAOYSA-N	438.400	1.033	50	20	IDGD	
CCNC(=O)N1CCc2ccc(NC(=O)C(=O)NNC(=O)COc3ccc(F)cc3)cc21	763838260	RQSUPPJBAXBIBI-UHFFFAOYSA-N	443.435	1.083	50	20	IDGD	
CC[C@@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)cc1	763864252	HKCMXGWNOKZINP-ZIAGYGMSSA-N	444.463	1.907	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)N1C[C@H]2CCCN2c2ccccc21	763873422	STRCMZPJDKQEOW-GDBMZVCRSA-N	426.448	1.756	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3ccc4c(c3)C(=O)N(C)CC4)cc2C1	763944114	WHJZADRJDNLLAB-GFCCVEGCSA-N	440.525	1.901	50	20	IDGD	
CCN1CCN(C(=O)c2ccc(NC(=O)C(=O)NNC(=O)c3ccccc3C)cc2)CC1	763958103	OLSXDVTUXDJNIX-UHFFFAOYSA-N	437.500	1.172	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)C(=O)Nc1ccc(F)cc1OCC(F)F	763994584	FJDHWVBRFMOMKH-UHFFFAOYSA-N	449.183	1.960	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)cc1F	763994889	IZFNAJPPHNVXAG-UHFFFAOYSA-N	443.229	1.341	50	20	IDGD	
O=C(Cc1cccc2ccccc12)NNC(=O)C(=O)Nc1ccc(Cn2cncn2)cc1	764037515	YHUKTBMOXCYNEI-UHFFFAOYSA-N	428.452	1.808	50	20	IDGD	
CN(C)c1nnc(-c2ccc(NC(=O)C(=O)NNC(=O)c3ccc(Cl)cc3O)cc2)o1	764126001	DHYWBTFAAVQELE-UHFFFAOYSA-N	444.835	1.561	50	20	IDGD	
COC(=O)c1cc2cc(NC(=O)C(=O)NNC(=O)CCc3ccc(OC)cc3)ccc2o1	764126191	GUYUGRLTECUAFG-UHFFFAOYSA-N	439.424	1.947	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc([C@@H](C)N3CCOCC3)cc2)c1O	764130995	LUTCEBCJXNAUNQ-CQSZACIVSA-N	442.472	1.194	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3CN2Cc2ccccc2)nn1C	764179026	MVQZHCFNLGIANM-HXUWFJFHSA-N	446.511	1.442	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)C(=O)Nc1ccc(C(=O)NCCc2ccccc2)cc1	764295584	NTPLNFLLFOIXNP-UHFFFAOYSA-N	434.456	1.090	50	20	IDGD	
CCOCC(=O)NNC(=O)C(=O)Nc1ccc(NC(=O)c2ccco2)cc1C(F)(F)F	764318496	VSCSKPGPQQDCFR-UHFFFAOYSA-N	442.350	1.673	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)C(=O)Nc1ccc(-n2cnc3ccccc32)nc1	764321048	PTCQSXWQAKHBON-UHFFFAOYSA-N	432.415	1.888	50	20	IDGD	
CCOC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)cc1	764377990	UPQGHVADAJDEBS-UHFFFAOYSA-N	427.442	1.715	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)C(=O)Nc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1	764385548	AWKNZTXDNHLPLW-ZIAGYGMSSA-N	429.452	1.542	50	20	IDGD	
Cc1ccc(NC(=O)C2CC2)cc1NC(=O)C(=O)NNC(=O)CSc1ccccc1O	764404337	IMSQHLAMGNXXFE-UHFFFAOYSA-N	442.497	1.927	50	20	IDGD	
C[C@H](NS(=O)(=O)c1ccc(C#N)cc1)C(=O)NNC(=O)C12CC3CC(CC(C3)C1)C2	764534999	XEQBIDWSKCRESZ-FCLDQCEHSA-N	430.530	1.589	50	20	IDGD	
O=C(CCOc1ccc(Cl)cc1)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765732119	GLNOXOMXYNMCBO-UHFFFAOYSA-N	444.919	1.714	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1cccc(NC(=O)C2CC2)c1	765734066	WFZWEGMBHCZNGY-UHFFFAOYSA-N	449.511	1.254	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3ccc(F)cc3[N+](=O)[O-])CC2)cc1	765749565	YVGTWRBOSQFKMJ-UHFFFAOYSA-N	429.452	1.621	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1cc(C(=O)N2CCCCC2)ccc1Cl	766264421	KGFYBRJWQSITRI-UHFFFAOYSA-N	432.868	1.847	50	20	IDGD	
O=C(NCCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1)NNc1ncnc2ccsc12	766892113	KONYPZJLIDERHW-UHFFFAOYSA-N	437.463	1.204	50	20	IDGD	
CCc1nn(C)c(Cl)c1C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	767846651	JUWWICIURKJVJJ-UHFFFAOYSA-N	440.957	1.329	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)CSc1nnc2n(C)c(=O)c3ccccc3n12	768289006	NYPJPGORLLDXBO-UHFFFAOYSA-N	436.497	1.372	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)CCn1c(=O)nc(O)c2ccccc21	768634912	RYBWYVCISNSSBS-UHFFFAOYSA-N	432.458	1.048	50	20	IDGD	
CC1(C)C(=O)Nc2ccc(C(=O)OCC(=O)NNC(=O)[C@H]3COc4ccccc4O3)cc21	768693885	CPRCAINNYGREKH-QGZVFWFLSA-N	439.424	1.061	50	20	IDGD	
C[C@]1(c2cccc(C(=O)NNc3nc(-c4ccccn4)nc4c3CCC4)c2)NC(=O)NC1=O	769143605	OFSRGFXZPNOCLA-HSZRJFAPSA-N	443.467	1.839	50	20	IDGD	
CC(C)(C)OC(=O)N1CCSC[C@H]1CC(=O)NNC(=O)Cc1cn2ccccc2n1	772150465	NYTPYFAVPGZTKI-OAHLLOKOSA-N	433.534	1.767	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)c1cc(S(=O)(=O)N2CCC2)ccc1Cl	772170569	SWQWHDWQCUGEFM-LBPRGKRZSA-N	445.925	1.473	50	20	IDGD	
Cc1cc(C)cc(N2CC[C@H](C(=O)NNC(=O)C(=O)NCc3ccc(Cl)cc3)C2=O)c1	772889343	FYLHQLCGRJRPGU-GOSISDBHSA-N	442.903	1.774	50	20	IDGD	
COc1ccc(C(=O)O)cc1S(=O)(=O)NNC(=O)[C@H](C)Oc1cccc(Cl)c1	773251059	HYPBLRBTWYIROR-JTQLQIEISA-N	428.850	1.824	50	20	IDGD	
CCS(=O)(=O)c1ccc(C(=O)NNC(=O)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1	773420822	PMSIKRFTTRNGHG-OAHLLOKOSA-N	439.534	1.888	50	20	IDGD	
O=C(NNc1ccc(OC(F)F)cc1)C(=O)Nc1cnn(Cc2nnc3n2CCCC3)c1	773663566	YEKKMUMVQIBOCY-UHFFFAOYSA-N	446.418	1.542	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2cccc(Cl)c2C)cc1	773771232	PNMKYWDXAQUKDN-UHFFFAOYSA-N	440.909	1.655	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(C)c(F)c2)c(OC(F)F)c1	773890209	YEYUPJHOKNSEMI-UHFFFAOYSA-N	439.346	1.922	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc(Cl)ccc1OC[C@H]1CCCCO1)c1cnccn1	777599929	GZNXPBXVGNWRCM-CYBMUJFWSA-N	426.882	1.701	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCO[C@@H](c3ccc(F)cc3F)C2)cc1OC	778283863	ZQACQJCZKIOTBY-LJQANCHMSA-N	435.427	1.817	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cnn(C)c1C(F)(F)F	782121729	UEMRNDDAMSLPMJ-UHFFFAOYSA-N	429.355	1.003	50	20	IDGD	
C[C@@H]1CN(C(=O)c2ccc(NC(=O)C(=O)NNC(=O)c3ccc(O)cc3)cc2)C[C@@H](C)O1	782832760	SKBTUAIFFRQLBW-ZIAGYGMSSA-N	440.456	1.041	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C(=O)N2CCc3c2cccc3C(F)(F)F)nc2ccccc21	782894293	PZWKKYNZQKUQJY-UHFFFAOYSA-N	445.401	1.871	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2ccc(S(=O)(=O)c3ccc(F)cc3)cc2)ncn1	783944686	OJGIJULYABGOLW-UHFFFAOYSA-N	429.433	1.839	50	20	IDGD	
Cc1c(NNC(=O)C(=O)Nc2ccc(C(=O)N3CCOCC3)c(F)c2)cccc1[N+](=O)[O-]	784352204	JPIHCTMXBMWBTQ-UHFFFAOYSA-N	445.407	1.597	50	20	IDGD	
Cc1nnnn1-c1cc(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2Cl)ccc1F	784382607	GNAMUMWPXGEDRE-UHFFFAOYSA-N	434.775	1.753	50	20	IDGD	
O=C(NNc1ccccc1Cl)C(=O)Nc1cc(C2CC2)nn1[C@H]1CCS(=O)(=O)C1	784770253	DWRUVGUEGOEDFC-LBPRGKRZSA-N	437.909	1.855	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2nccnc2Cl)cc1	784776643	PWHIUNZPJNXWBK-UHFFFAOYSA-N	426.886	1.242	50	20	IDGD	
CN1CCCCC/C1=N\S(=O)(=O)c1cccc(NC(=O)C(=O)NNc2ccccn2)c1	784796985	XGELWWDYWNLMGL-XIEYBQDHSA-N	444.517	1.756	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccc(F)cc2Br)cn1	784803573	OZMBTXHLXNBYKE-UHFFFAOYSA-N	431.243	1.469	50	20	IDGD	
CCCCNS(=O)(=O)c1cccc(NC(=O)C(=O)NNc2cccc([N+](=O)[O-])c2)c1	784828868	MQXGLHCELKQVID-UHFFFAOYSA-N	435.462	1.755	50	20	IDGD	
CN1CCOc2ccc(NC(=O)C(=O)NNc3ccc(S(=O)(=O)C(F)F)cc3)cc21	784833174	JNAXLXAGICALQF-UHFFFAOYSA-N	440.428	1.593	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)C(=O)Nc2cccc(N3CCCCC3=O)c2)c1	784841224	NXGNOPIWMGOSEC-UHFFFAOYSA-N	430.486	1.689	50	20	IDGD	
COc1ccc(I)c(NC(=O)C(=O)NNc2ccnc(F)c2)c1	784848772	MFVNMHVDXRANPN-UHFFFAOYSA-N	430.177	1.916	50	20	IDGD	
CC[C@H](C)NS(=O)(=O)c1cccc(NC(=O)C(=O)NNc2ccc(Cl)nc2)c1	784870472	UBGQHWCNULUAHF-NSHDSACASA-N	425.898	1.894	50	20	IDGD	
O=C(NNc1cc(F)c(F)cc1F)C(=O)Nc1cc(N2CCCS2(=O)=O)ccc1F	784891824	GCMGBMFWIQQNLL-UHFFFAOYSA-N	446.382	1.865	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1ccc2c(c1)C(=O)CCC2	785340162	XEBWRGBAVMKBHA-UHFFFAOYSA-N	431.470	1.700	50	20	IDGD	
C[C@H](Cc1ccccc1)NC(=S)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	786059272	ZFFSSUSEAVARCD-LLVKDONJSA-N	426.951	1.728	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c(OCC2CC2)c1	788493241	QGYOHVNPVOXSRN-UHFFFAOYSA-N	447.513	1.809	50	20	IDGD	
CN(C)C(=O)c1cc(F)ccc1NC(=O)C(=O)NNC(=O)[C@H]1OCC[C@H]1c1ccccc1	789811199	XFCYBODBPZEWFD-YJBOKZPZSA-N	442.447	1.186	50	20	IDGD	
O=C(NNC(=O)[C@H]1OCC[C@H]1c1ccccc1)C(=O)Nc1ccc(N2CCCC2=O)cc1	789824058	YQNLQVDOXRDEAM-ICSRJNTNSA-N	436.468	1.472	50	20	IDGD	
CC[C@@H](C)n1ncc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(C(C)=O)cc2)c1C	792267839	DITFWZVZURHZOH-DOMZBBRYSA-N	429.477	1.919	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C1(NC(=O)NC(C)C)CCCCC1	792329245	XQQYYCITHAXGGO-UHFFFAOYSA-N	426.539	1.952	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)nc1Br	793021361	CPAZUPAPWSIBFP-UHFFFAOYSA-N	425.214	1.457	50	20	IDGD	
Cn1ccc2ccc(NC(=O)C(=O)NNC(=O)c3cnn(-c4ccccc4)c3)cc2c1=O	793027112	VFJRTHAXVSDKKF-UHFFFAOYSA-N	430.424	1.124	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)Nc1ccc(S(=O)(=O)N(C)C)cn1	797652425	DZCVINYFGFZFGE-NSHDSACASA-N	441.897	1.606	50	20	IDGD	
CC(C)[C@@H](C(=O)NNc1cc([N+](=O)[O-])ccc1Br)N1CCCS1(=O)=O	800620729	ATWKWLYCPIIFFP-ZDUSSCGKSA-N	435.300	1.861	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2O1)C(=O)Nc1ccnc(OCc2ccccc2)c1	800623299	LHYLJTVMBHTOLW-LJQANCHMSA-N	432.436	1.750	50	20	IDGD	
Cc1ccc(C2=NO[C@H](CNC(=O)NNC(=O)Nc3ccc(S(C)(=O)=O)cc3)C2)cc1	800750034	IOZRXKNXRKVKLV-INIZCTEOSA-N	445.501	1.927	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ccc3nncn3n2)CC1)Nc1ccc(OC(F)F)cc1	802044512	RVRNNQWCPAPZKY-UHFFFAOYSA-N	446.418	1.795	50	20	IDGD	
CC(=O)Nc1ccc(NS(C)(=O)=O)c(C(=O)NNC(=O)Nc2ccc3c(c2)OCO3)c1	802107321	PYRLPHKAQLDFTP-UHFFFAOYSA-N	449.445	1.212	50	20	IDGD	
COc1ccc(C2=NO[C@H](CNC(=O)NNC(=O)c3cc([N+](=O)[O-])ccc3O)C2)cc1F	802350183	WHLMYXSBUAMSNM-LBPRGKRZSA-N	447.379	1.585	50	20	IDGD	
O=C(NNC(=O)[C@H]1CC(c2cc(F)ccc2F)=NO1)c1nn(-c2ccccc2)cc1O	806346016	FNXNRRLKGFJLSR-QGZVFWFLSA-N	427.367	1.810	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)NCc2ccccc2S(N)(=O)=O)c(C)n1-c1ccccc1	807605177	JSFHVPXHJSWDII-UHFFFAOYSA-N	441.513	1.886	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)[C@H](Cc2cnc[nH]2)NC(=O)CC(C)C)c1C	809961301	DAEPOKKJIOJURO-AEFFLSMTSA-N	429.521	1.715	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccc3nc(C)nn3c2)ccc1OC(C)C	810386404	XSLHAOOZWCOEBX-UHFFFAOYSA-N	426.433	1.233	50	20	IDGD	
NC(=O)c1ccc(OCC(F)F)c(NC(=O)C(=O)NNc2cc(F)c(F)cc2F)c1	810395687	PPCGKDFNBCTKNV-UHFFFAOYSA-N	432.305	1.929	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)c1cc(S(=O)(=O)NC2CC2)ccc1C	811873809	BBQWDIYCPMIQFO-UHFFFAOYSA-N	447.513	1.674	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@H]1CC[C@H](CNC(=O)NNC(=O)C(=O)N2CCCC2)CC1	812436008	CUMBCCXHCARZMW-SHTZXODSSA-N	425.530	1.270	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)N1CCN(c2cnccc2C#N)CC1	814325709	WJZVFRBCPHQXGL-CQSZACIVSA-N	428.880	1.937	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)COc2cccc(C)c2)cc1)[C@@H]1C[C@H]1C	815564858	VNJFTYZXMBNGSK-FOIQADDNSA-N	438.484	1.921	50	20	IDGD	
COC(=O)c1ccc(C)c(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)N(C)C)c1	815752053	ZXBBDTJFTUEZAS-UHFFFAOYSA-N	434.474	1.114	50	20	IDGD	
COCCN(C)NC(=O)c1cccc(NC(=O)C[C@H]2SC(N3CCCCC3)=NC2=O)c1	816561037	JOWNJCBUYXAXRY-QGZVFWFLSA-N	447.561	1.722	50	20	IDGD	
CCNS(=O)(=O)c1ccc(C)c(C(=O)NNc2ccccc2S(=O)(=O)N(C)C)c1	817055061	KLZYQJJMNCWDKK-UHFFFAOYSA-N	440.547	1.300	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)[C@@H](CC(C)C)N2C(=O)[C@H]3CC=CC[C@H]3C2=O)c1	863971747	DITLFVHJZKLAOD-CEXWTWQISA-N	427.501	1.887	50	20	IDGD	
CCOc1ccc(/C=C(/C#N)C(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1	895734062	GRIRMCPIMIFIJO-PTNGSMBKSA-N	427.486	1.747	50	20	IDGD	
CC(C)(C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1ccccc1	912638448	NNWLSIYPQGNEPF-UHFFFAOYSA-N	431.514	1.446	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(/C#N)C(=O)O[C@H](C)C(=O)N2CCC(C(N)=O)CC2)c1C	913150535	WWTBYVVQDDUZID-JVYQZZMCSA-N	444.532	1.875	50	20	IDGD	
CCn1c(=O)nc(O)c2c(C(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)cc(C(C)C)nc21	913962374	RYGMXZQITITECL-UHFFFAOYSA-N	440.416	1.623	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN(C)Cc2ccc(C(=O)NC3CC3)cc2)cc1OC	914574071	INKRBJYPBVYYNO-UHFFFAOYSA-N	440.500	1.489	50	20	IDGD	
COc1ccc(OCC(=O)NN=Cc2c(C)nn([C@H]3CCS(=O)(=O)C3)c2Cl)cc1	916296918	SYBLUAVNFPZBLA-ZDUSSCGKSA-N	440.909	1.742	50	20	IDGD	
CC(=NNC(=O)COc1ccccc1C#N)c1ccc(S(=O)(=O)N2CCOCC2)cc1	916323575	ADGVBGZGOBSEIF-UHFFFAOYSA-N	442.497	1.498	50	20	IDGD	
Cn1cc(S(=O)(=O)NC(=O)/C(C#N)=C/c2cn(CCC#N)nc2-c2ccccc2)cn1	916821677	OSWJSEZATKDSRE-MHWRWJLKSA-N	435.469	1.609	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNS(=O)(=O)c2ccc(C)c(Cl)c2)cc1	917721599	ZYHSFHWSBNHIRC-UHFFFAOYSA-N	445.950	1.587	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@@H]2C(=O)NNC(=O)c2ccc(C)cc2O)c(OC)c1	918339495	OYZXAONNDQYRTJ-QGZVFWFLSA-N	427.457	1.784	50	20	IDGD	
COc1ccc(-c2nnc(S)n2CC(=O)NNC(=O)Cc2ccccc2OC)cc1	919822739	FEBIFUFLZBYNCQ-UHFFFAOYSA-N	427.486	1.641	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)[C@H](CC(C)C)N1C(=O)[C@@H]2CC=CC[C@H]2C1=O	919822779	IYKSFNFOKQSZOY-KURKYZTESA-N	427.501	1.751	50	20	IDGD	
N#C/C(=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)N1C[C@@H]2C[C@@]2(CO)C1	1116724616	YSCYQCHZZNTGLL-GOURZXPUSA-N	439.903	1.827	50	20	IDGD	
CC(C)[C@@H](NC1CCOCC1)C(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1	1318763728	ATDIEZKSGSQTKA-QGZVFWFLSA-N	426.558	1.574	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1ccn(-c2ccncc2)n1	1339174762	NXKANEQXCCZIOH-UHFFFAOYSA-N	428.474	1.045	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2n[nH]c3c2CC[C@H]3C)C1	1778603766	AAMJBROVVKZFJT-GJDPQZJCSA-N	438.956	1.841	50	20	IDGD	
Cn1ncc2c(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)[C@H](O)CCl)C4)cccc21	1778708303	JGSALQVTDVGJNV-DBXWQHBBSA-N	434.924	1.301	50	20	IDGD	
CCOc1ccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)nn1	1780429309	GTQOZDYSIGSAIN-YVEFUNNKSA-N	427.299	1.102	50	20	IDGD	
O=C(CCc1cc(F)ccn1)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781326813	UWLLMOTYQOHMJI-WBVHZDCISA-N	432.265	1.674	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@](C)(O)C(F)(F)F)C2	1781997427	VWGFCZKWIIEZEW-YIKOMLBNSA-N	445.276	1.597	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccn3nccc13)C2	1782178088	FKIMFHJFSCCEQB-HGHGUNKESA-N	434.924	1.716	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)Cc2cnn(C)c2)C1	1782590608	SBZPDIVSQVNHFB-GPMSIDNRSA-N	441.370	1.650	50	20	IDGD	
C=CCOCCCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]2C1	1783964049	IGKPCORFKRUUDG-QAETUUGQSA-N	431.371	1.980	50	20	IDGD	
COc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]3C2)n(C)n1	1783968972	IGRYEZCTAMHQIN-ABHRYQDASA-N	443.342	1.053	50	20	IDGD	
Cc1ccc2c(/C=C/C(=O)N3CC[C@]4(C3)CN(C(=O)[C@H](O)CCl)CCO4)c[nH]c2c1	1785664008	PQHQAYHLYRZXPW-BMCWVKNRSA-N	431.920	1.919	50	20	IDGD	
CC(C)(C)n1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Br)C[C@@H]32)nn1	1789356172	CTZIISQYFYOOCW-IMIFBBOLSA-N	446.321	1.317	50	20	IDGD	
CNc1nsnc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]2C1	1789867398	ATBMYVVIXARTFT-ZGNZKYAMSA-N	436.365	1.409	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)C[C@@H]21	1790961405	JVXIXTXFHZINDO-DEQVHRJGSA-N	442.310	1.260	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1ccc(C2(NC(=O)c3cnc(N)s3)CCC2)cc1	1791600157	RVTKOBCIXXZHKA-UHFFFAOYSA-N	430.534	1.846	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3cnccn3)[C@H]2C1	1791661078	SEBNRAQXCJUPBX-LLLHUVSDSA-N	439.354	1.562	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)nc(Cl)c1)C2	1792870136	HUCQBABDFPQEJO-ADGXKJENSA-N	446.729	1.675	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1csc(-c3cccnc3)n1)C2)[C@H](O)CCl	1792978245	MOVKLEKALRBJEE-OCVGTWLNSA-N	436.921	1.008	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCl	1793116804	URYZRSXCXSJHMQ-YIDVYQOGSA-N	429.945	1.624	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](O)CCl)C2)C1CC1	1793211255	FFLOTHGPRDRDGB-QEOTZNIISA-N	443.972	1.918	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1C[C@@H]1F)C2	1793878180	BMQHAPCACZHSHD-BYGOPZEFSA-N	433.908	1.066	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cc1cc[nH]n1)C2	1794144091	LELJJJSEFIFAQF-FZKCQIBNSA-N	439.944	1.723	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnc(OCF)cn1	1794410743	YHXRBDJWIPLHIJ-UOHMRFDXSA-N	435.283	1.222	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1cc[nH]c2nccc1-2	1796187512	NYTLNUIRUSELSG-RDBQEKCUSA-N	425.258	1.408	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1=Cc2ccccc2NC(=O)C1	1798437093	HBWGEOXLSCLKGX-AXVVYFOYSA-N	447.919	1.256	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1nccn1C)C2	1799220014	FLDYPIIBZVXTAJ-QDMKHBRRSA-N	441.444	1.819	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Br)C1	1799352277	NSWJVJIYWDSAEM-PLJUSGQGSA-N	449.317	1.246	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](O)Cc1ccccc1	1800635855	KGMDYEMXQUSSJL-QRXRQMIZSA-N	429.344	1.416	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](Br)CC	1800643584	XWADGIGCVQIZPW-PEBLQZBPSA-N	435.315	1.311	50	20	IDGD	
Cc1cccn2ncc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@H](C)Br)c12	1800762617	VWZNQFNHMCGTSU-AYDFFVQHSA-N	435.322	1.629	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C[C@H]1CNc3ccccc3O1)C2	1800976684	BZLPWKPPNDKCGK-MRNSRZSKSA-N	437.924	1.093	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1[C@@H]3Sc4ccccc4[C@H]31)C2	1800976972	MWEQKLDFZDUCGW-OKRNVVFVSA-N	436.961	1.718	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc3c(c1)CCCO3)C2)C(Cl)Cl	1801014792	GUVVLTPTTURYMM-JLVBRIDZSA-N	427.328	1.947	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1C[C@H]1c1ccccc1	1802208293	WJBAWADZAMPIQT-VYMYIBDJSA-N	433.512	1.741	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C(Cl)Cl)[C@H]1CCc2nc(O)nc(O)c2C1	1802341431	FHZMCDODKRKTHC-MMWGEVLESA-N	429.304	1.435	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)c2ncc[nH]2)[C@@H]1c1cccnc1	1805156674	VTGKRQYDCCNMNJ-PVCWEEQBSA-N	448.487	1.258	50	20	IDGD	
CC[C@@H](NC(N)=O)C(=O)N1CCC2(CCCN(C(=O)[C@@H](C)CBr)C2)CC1	1805384573	OZRTWXLIHOKNRK-UONOGXRCSA-N	431.375	1.696	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)CSC(=N)N)[C@@H]1c1cccnc1	1807009768	QTJUVGZHQXSBJE-JKOKRWQUSA-N	428.356	1.497	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)c[nH]1	1807377191	ZCZSOTNFLBADDU-WIYYLYMNSA-N	432.289	1.031	50	20	IDGD	
O=C(Cn1cncn1)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@@H]1c1cccnc1	1807602737	HNEDZBXEYMCNMU-CFVMTHIKSA-N	425.262	1.070	50	20	IDGD	
O=C(c1cnc2ccoc2c1)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1	1809966987	OKEUVIBJCLWOKO-UHFFFAOYSA-N	447.300	1.666	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)c3cnccc3Cl)CC2)C1	1809978769	PPBQXEILVMAAOF-UHFFFAOYSA-N	441.724	1.573	50	20	IDGD	
O=C(/C=C/c1cccs1)N1CCCC2(CCN(C(=O)c3cccc(B(O)O)c3)CC2)C1	1810001465	OZWXESRSXQINGL-BQYQJAHWSA-N	438.358	1.986	50	20	IDGD	
Cc1noc(CC(=O)N2CC[C@H](CNC(=O)CO[Si](C)(C)C)[C@@H]2c2cccnc2)n1	1810542829	ZZSFMDLSPXXUJK-UZLBHIALSA-N	431.569	1.873	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@H]1CCN(C(=O)c2n[nH]cc2[N+](=O)[O-])[C@@H]1c1cccnc1	1810544952	VLQKHWOQURZUSZ-RDTXWAMCSA-N	446.540	1.884	50	20	IDGD	
CCOc1ccc(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)nn1	1811622866	PSKOUWOSDRLIBG-QILLFSRXSA-N	433.896	1.190	50	20	IDGD	
CC(=O)N[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)[C@](C)(Cl)CCl)[C@H]1c1cccnc1	1812657696	XCJJRQBWZZXNRK-XXHPDZBISA-N	429.348	1.848	50	20	IDGD	
CCc1oncc1C(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1813071712	UHRVBEFGTCBCPY-KKSFZXQISA-N	442.520	1.325	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)ccn1	1813073264	KJCZDLLBUHPVRR-UGKGYDQZSA-N	438.532	1.478	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)CNCP(=O)(O)O)sc2C1	1814763717	ZYNUHZPKSDPCRH-VHSXEESVSA-N	438.874	1.187	50	20	IDGD	
CCS(=O)(=O)CC(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCBr)[nH]n1	1815170477	NURQIJWKGALERT-LBPRGKRZSA-N	435.344	1.622	50	20	IDGD	
COC1(CC(=O)N[C@@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)CCC1	1815361439	FIZRMKPAWNCTEO-OAHLLOKOSA-N	443.334	1.008	50	20	IDGD	
CN[C@@H](CC(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCBr)n[nH]1)C(=O)O	1816781961	JLEDXYKTBKVAOZ-NWDGAFQWSA-N	430.303	1.250	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](F)Cl)CC2	1817279891	KTBPJNMBVXTBCE-SASYSFIBSA-N	440.888	1.724	50	20	IDGD	
COc1cc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)ccn1	1817472324	QJUIPZNUKLCTQQ-SFHVURJKSA-N	449.276	1.113	50	20	IDGD	
CC1(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cnccc3C(=O)NN)n[nH]2)CCC1	1819400421	JRRWUMGORKQMIJ-MRXNPFEDSA-N	425.493	1.904	50	20	IDGD	
COc1ccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)cn1	1822410600	MKCCVEFRYUDDQQ-MRXNPFEDSA-N	443.508	1.492	50	20	IDGD	
CSCC(C)(C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827050258	LGCUWFJWEHUTNH-FQEVSTJZSA-N	446.422	1.989	50	20	IDGD	
O=C([C@@H](O)CCl)N1CCC([C@H]2CCCCN2C(=O)[C@@H]2Cc3ccccc3CN2)CC1	1827566720	XXVSFINHSJJCOD-HBMCJLEFSA-N	433.980	1.920	50	20	IDGD	
O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1CCC(F)(F)C1)CCO2	1829645630	DURAWQWQXLDPAD-CZUORRHYSA-N	439.297	1.663	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)C1(O)CCC1)CCO2	1829731531	NRRNCTLVDKFNAF-RVKKMQEKSA-N	447.370	1.025	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCN2CCOC2=O)CC1	1831831423	XXLKFVMKWBCZRL-DLBZAZTESA-N	429.945	1.702	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H]2CCCS2(=O)=O)CC1	1831835102	OEFQYSDKPCGQLC-GVDBMIGSSA-N	434.986	1.437	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cnnc4ccccc34)CC2)CC1)[C@@H](O)CCl	1833310262	OKPUKBZIJINEKB-FQEVSTJZSA-N	445.951	1.415	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3ccc(F)cn3)CC2)CC1	1834299867	VUEUYCGKDKSTBZ-KRWDZBQOSA-N	426.920	1.660	50	20	IDGD	
Nc1nc(C(=O)NC2CCN(C3CCN(C(=O)CCBr)CC3)CC2)cs1	1834749863	NTLCXIAYQJPMSY-UHFFFAOYSA-N	444.399	1.696	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)c1ccc2n[nH]cc2c1	1834992573	AUERYBFVWIJLJO-IBGZPJMESA-N	433.940	1.348	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)c1cccc2cc[nH]c12	1835419472	SNUSGXFAXCBDKB-LJQANCHMSA-N	432.952	1.953	50	20	IDGD	
O=C1NCc2cc(C(=O)N3CCC(OC4CCN(C(=O)[C@@H](O)CCl)CC4)CC3)ccc21	1836717329	UDWKXELCGCJBGN-IBGZPJMESA-N	449.935	1.142	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccn4nccc4c3)CCO2)C1	1837155771	PHZHQDACNWINDS-OAQYLSRUSA-N	434.924	1.669	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3CNc4ccccc43)C2)C1	1837711466	JDPLYBXGXWQEMZ-GCJKJVERSA-N	447.608	1.504	50	20	IDGD	
COCCOCC(=O)N1CCC(OC2CCN(C(=O)[C@@](C)(Cl)CCl)CC2)CC1	1837768436	YLUAUMZVJRUXAD-IBGZPJMESA-N	439.380	1.884	50	20	IDGD	
Cc1nc(F)ccc1C(=O)N1CCO[C@]2(COCCN(C(=O)CCBr)C2)C1	1838262658	HFXDYJZCKAZYJL-SFHVURJKSA-N	444.301	1.384	50	20	IDGD	
O=C(c1[nH]cnc1-c1cccnc1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1838495891	KHUKMFOVPUYRSB-APWZRJJASA-N	437.859	1.076	50	20	IDGD	
C=C(CC(=O)OCC)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](Cl)COC)CC2)CC1	1838642463	PQWLKKRQSXIPPQ-SFHVURJKSA-N	444.956	1.748	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3nc(O)n4c3CCCC4)C2)C1	1839145415	HBJLAHJIAIKYRW-VBKZILBWSA-N	440.928	1.012	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccccc3)C2)C1	1839963551	OELNBSHQPCFYEC-FXAWDEMLSA-N	439.350	1.859	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1C[C@H]3CC[C@@H]1O3)CCO2	1840051425	ZSZLGMGOAWXCDF-MZZPOWALSA-N	445.354	1.184	50	20	IDGD	
O=C(CSc1ccncc1)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840186891	QYDAVSYVNHAUBC-KRWDZBQOSA-N	434.345	1.434	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(F)ccc3OC)CCO2)C1	1840691068	SQUYHPVGYQYSFS-OXQOHEQNSA-N	444.887	1.158	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)cc1Cl	1840732041	GVWSUTRWWYBNLF-YJBOKZPZSA-N	435.279	1.953	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H](C(=O)N2CC3(CCCN3C(=O)[C@@H](O)CCl)C2)C1	1841354042	FQJSNULDDAFWOP-OAGGEKHMSA-N	443.972	1.873	50	20	IDGD	
CC(C)(C)OC(=O)N1CC2(CC2)C[C@H]1C(=O)N1CCCC12CN(C(=O)[C@@H](O)CCl)C2	1841392305	LVUISOHAWIKQDA-GJZGRUSLSA-N	441.956	1.579	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H]1CC(=O)N1CCCC12CN(C(=O)[C@@H](O)CCl)C2	1841777158	ZENMSCUFWJGCEC-GJZGRUSLSA-N	429.945	1.579	50	20	IDGD	
Cc1ccc(COCC(=O)N2CC3(CCCN3C(=O)c3cccc(B(O)O)c3)C2)cc1C	1843013784	MNTAHZJYZKXLIR-UHFFFAOYSA-N	436.317	1.017	50	20	IDGD	
O=C(c1cnc(-c2ccccc2)s1)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843014337	YJUFKVYCZOBKJQ-UHFFFAOYSA-N	447.325	1.621	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1ccn3ccnc3c1)C2	1843416333	XVUDUNJVNCESSU-MFKUBSTISA-N	433.472	1.285	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)[C@@H](C)n1cc(C)cn1)C2	1843417350	YUCJCCWLSBWYEW-DTVDJLOLSA-N	425.493	1.090	50	20	IDGD	
C[C@@H]1CCCN(C(=O)OC(C)(C)C)[C@@H]1C(=O)N1CCCC12CN(C(=O)[C@@H](O)CCl)C2	1843985850	YULSMJYZUVRXEI-PMPSAXMXSA-N	443.972	1.825	50	20	IDGD	
Cc1cccc(C)c1SCC(=O)N1CCCC12CN(C(=O)c1cccc(B(O)O)c1)C2	1844374631	YTOHYQPMQYGVDK-UHFFFAOYSA-N	438.358	1.593	50	20	IDGD	
CS(=O)(=O)CC(=O)N1CC2(CCCN2C(=O)[C@@H](Br)Cc2ccccc2)C1	1845940664	CSHAGPIDIXVORS-HNNXBMFYSA-N	443.363	1.241	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cncc(S(C)(=O)=O)c1	1847495013	CSEJMEFODQRPHP-UGFHNGPFSA-N	444.351	1.332	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)C[C@@H](O)CNC(=O)OC(C)(C)C	1847870158	NBGLHYXAFJUCGZ-UGUYLWEFSA-N	431.961	1.871	50	20	IDGD	
O=C(COC(=O)CCCn1c(=O)oc2ccccc21)NNC(=O)c1ccc([N+](=O)[O-])cc1	9843257	XFXAYGSGHVKIMR-UHFFFAOYSA-N	442.384	1.287	50	20	IDGD	
O=C(COC(=O)[C@H]1CCCN(C(=O)c2ccc(F)cc2)C1)NNC(=O)c1cccs1	11060380	KCWXAOVGFCSDNE-AWEZNQCLSA-N	433.461	1.744	50	20	IDGD	
Cc1cc(C(=O)NCC(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)ccc1[N+](=O)[O-]	12511215	TUESLIVLTOVURW-UHFFFAOYSA-N	448.819	1.291	50	20	IDGD	
O=C(COC(=O)COCc1nc2ccccc2s1)NNC(=O)c1cccc([N+](=O)[O-])c1	18020361	JWDXHFSGHRBMCT-UHFFFAOYSA-N	444.425	1.726	50	20	IDGD	
O=C(NNS(=O)(=O)c1cccc(S(=O)(=O)NC2CC2)c1)c1cc2c(s1)CCC2	26223301	HTKYMFUCWYJWKI-UHFFFAOYSA-N	441.556	1.301	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N(C)C)o2)cc1OC	43809582	KWVVVPMKZLLDKA-UHFFFAOYSA-N	439.490	1.792	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NCc1ccc(OCC(F)(F)F)cc1	725872218	CDMXLOYJXQYRDJ-UHFFFAOYSA-N	430.408	1.950	50	20	IDGD	
COc1ccc(-c2nn(CCC#N)cc2/C=C(/C#N)C(=O)NCCn2cncn2)cc1OC	726537532	NGODCDRIWGUFPV-YVLHZVERSA-N	446.471	1.796	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1ccc(-n2cnnc2)cc1	727518194	AKCQJTXYRLXJBR-UHFFFAOYSA-N	429.820	1.547	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCOc2ccccc21)c1ccc(S(=O)(=O)N2CCCC2)cc1	728187431	IPDWAMKUAXFDSW-SFHVURJKSA-N	429.498	1.798	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)c1cc(F)ccc1Br)N1C(=O)[C@H]2CCCC[C@H]2C1=O	728550880	LXDUPGFRDDJDSE-ZMLRMANQSA-N	440.269	1.913	50	20	IDGD	
Cn1ccnc1[C@H](NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)c1ccccc1	728943671	AIPQVFZMVVNULI-GOSISDBHSA-N	434.504	1.547	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)c1ccc2c(c1)C(=O)NC2=O	729282187	LXLVIRUEIAKLPM-SECBINFHSA-N	432.230	1.561	50	20	IDGD	
CC[C@H](N=c1nn[nH]n1-c1ccccc1)C(=O)NNC(=O)c1cc(-c2ccc(C)cc2)[nH]n1	729520783	RYOAYJNVSPYLCF-KRWDZBQOSA-N	445.487	1.434	50	20	IDGD	
CC[C@@H](NC(=O)NNC(=O)COc1ccc(OC)cc1)c1cccc(S(N)(=O)=O)c1	729612184	BEVZFJHJWPKGBQ-QGZVFWFLSA-N	436.490	1.203	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNS(=O)(=O)c1cc2c(c(C(=O)O)c1)OCCO2	729667582	SSKYROQFTRZXQP-UHFFFAOYSA-N	431.426	1.120	50	20	IDGD	
CCOc1ccccc1C(=O)N1CCC[C@H]1C(=O)NNC(=O)COc1ccccc1O	730780587	ZHBIHZDZQFFKFB-INIZCTEOSA-N	427.457	1.622	50	20	IDGD	
Cc1nn(C)c(C)c1S(=O)(=O)NNC(=O)c1nn(CCC(C)C)c(=O)c2ccccc12	731053136	GWHURLBLGHDNMM-UHFFFAOYSA-N	446.533	1.416	50	20	IDGD	
CCc1c(C(=O)NNC(=O)CNC(=O)c2cccs2)nnn1-c1cccc(Cl)c1	731457616	MJGFZQWHJAIQHX-UHFFFAOYSA-N	432.893	1.736	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)c1cc(S(N)(=O)=O)ccc1Br	731493890	AROSJXJHQPIDFM-UHFFFAOYSA-N	428.264	1.180	50	20	IDGD	
Cc1ccc(S(=O)(=O)NC[C@H]2CCCN([C@H](C)C(=O)NNC(=O)CC(C)C)C2)cc1	731850174	PZNVVOABHZTUMI-QZTJIDSGSA-N	438.594	1.567	50	20	IDGD	
CSCC[C@H](C(=O)NNc1nc(-c2ccncc2)no1)N1C(=O)[C@H]2CCCC[C@@H]2C1=O	732065419	FNCYIEPXNLDYCM-SOUVJXGZSA-N	444.517	1.872	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)CCCc2nc(-c3ccc(F)cc3)no2)C[C@@H](C)O1	732259931	LIXOYRQXQOWTFJ-HUUCEWRRSA-N	433.484	1.845	50	20	IDGD	
CSCC[C@H](NC(=O)Cc1ccccc1)C(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	732750642	XUVGTNJGJARMIT-KRWDZBQOSA-N	430.486	1.836	50	20	IDGD	
Cc1ccc(-n2c(NNC(=O)[C@@H](C)NS(C)(=O)=O)nc3ccccc3c2=O)c(C)c1	733364763	DXHQWWLNINWGLP-CQSZACIVSA-N	429.502	1.383	50	20	IDGD	
CCn1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)Nc3ccc(OC)cc3)c2)cn1	733947742	GKMBHBNBQNURBD-UHFFFAOYSA-N	443.485	1.787	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)[C@]12CCC(=O)N1c1ccccc1S2	734239275	KXOKZPCLMVKYMP-LJQANCHMSA-N	435.506	1.471	50	20	IDGD	
CC(=O)N1CCc2ccc(S(=O)(=O)NNC(=O)c3cc(Br)c[nH]3)cc21	734419302	OVGXDTZAMNJLID-UHFFFAOYSA-N	427.280	1.310	50	20	IDGD	
CC1CCC(N2CCN(C(=O)NNC(=O)c3csc(N4CCOCC4)n3)CC2)CC1	734516031	DPXSNWCBWOPHLX-UHFFFAOYSA-N	436.582	1.530	50	20	IDGD	
CCOCCCN1CCC(=NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)[C@@H](C)C1	735228168	ROYGWIHRJDJHGG-SFHVURJKSA-N	438.594	1.856	50	20	IDGD	
O=C(CCc1ccccc1)NNC(=O)NC1CCN(S(=O)(=O)Cc2ccccc2)CC1	735583882	JUHUFFUSLZXCCQ-UHFFFAOYSA-N	444.557	1.944	50	20	IDGD	
O=C(NNC(=O)c1ccccc1O)NC1CCN(S(=O)(=O)Cc2ccccc2)CC1	735584791	ZGVNDHRGRPNMNK-UHFFFAOYSA-N	432.502	1.331	50	20	IDGD	
CCO[C@@H]1CC(=NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)C1(C)C	736429577	XMXPMFSRUUKORD-LJQANCHMSA-N	437.562	1.947	50	20	IDGD	
Cc1nc(-c2cccnc2)nc(NNC(=O)C2=NN(c3ccccc3)[C@H](C(N)=O)C2)c1C	736696634	KJVXNAQRFPHAPL-SFHVURJKSA-N	430.472	1.719	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)NC[C@@H](c1ccc(F)cc1)N1CCOCC1	738447981	RXCXQQZOEPRYAG-FQEVSTJZSA-N	430.480	1.746	50	20	IDGD	
O=C(CCN1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O)NNC(=O)CSc1ccc(Cl)cc1	742470948	CMYTTYKIZHCPFW-KFZJALRRSA-N	437.905	1.132	50	20	IDGD	
O=C(CN1C(=O)[C@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O)NNC(=O)Nc1ccc(-c2ccccc2)cc1	743826282	XCNQJJAHCUJZHW-JYBIWHBTSA-N	434.452	1.669	50	20	IDGD	
CSC[C@H](C(=O)NNC(=O)Nc1ccc(N(C)C)cc1)N1C(=O)[C@H]2CCCC[C@@H]2C1=O	743826393	BVMDGZSFAWNKHV-YESZJQIVSA-N	447.561	1.812	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN(C)Cc2nccn2Cc2ccccc2)cc1OC	744411444	DNOJYXRPZJVFPV-UHFFFAOYSA-N	437.500	1.842	50	20	IDGD	
CC1CCC(N2C[C@H](C(=O)OCC(=O)NNC(=O)c3cccc(C#N)c3)CC2=O)CC1	744999658	ZZPFHHGVIKRNCN-ZCDVPAHGSA-N	426.473	1.290	50	20	IDGD	
Cc1ccc(C(=O)N2CCC(NC(=O)NNC(=O)c3cc([N+](=O)[O-])ccc3O)CC2)cc1	745800080	NQGMLQDTHNTNFC-UHFFFAOYSA-N	441.444	1.858	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCC(C)(C)NC(=O)OC(C)(C)C)nc1	745926213	CJQRTJRLJOPPBB-UHFFFAOYSA-N	444.558	1.698	50	20	IDGD	
Cc1cc(=O)n(CC(=O)NC(C)C)c(C)c1C(=O)NNC(=O)c1cccc(N(C)C)c1	746014834	LDPNUZLACVHZNC-UHFFFAOYSA-N	427.505	1.131	50	20	IDGD	
C[C@@]12CCC(=O)N1c1ccccc1C(=O)N2CC(=O)NNC(=O)Cc1cn2ccccc2n1	746550424	MRPBNJYYYNDRMT-QHCPKHFHSA-N	446.467	1.023	50	20	IDGD	
Cc1nn(C)c2ncc(C=NNC(=O)c3ccc(S(=O)(=O)N4CCCC4)cc3)cc12	747610078	GORCJQDFUGFTOZ-UHFFFAOYSA-N	426.502	1.825	50	20	IDGD	
CCN(c1ccccc1)S(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)N2CCCC2)c1	748246667	NTXIFTYUXXLWIZ-UHFFFAOYSA-N	444.513	1.285	50	20	IDGD	
Cc1nc(Cl)cc(NNC(=O)c2cc(S(=O)(=O)N3CCOCC3)ccc2Cl)n1	748339207	QBEGVBDYGOXZHD-UHFFFAOYSA-N	446.316	1.870	50	20	IDGD	
COCCOCC(=O)NC1CCC(C(=O)NNC(=O)c2ccc3ccccc3n2)CC1	748697267	XXMMCVPTOZYKCN-UHFFFAOYSA-N	428.489	1.334	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN1S(=O)(=O)c1cccs1)c1ccc(Cl)cc1O	749265912	OQAHOZPPARIJDX-GFCCVEGCSA-N	429.907	1.721	50	20	IDGD	
O=C(CCN1C(=O)c2ccccc2C1=O)NNc1nc(Br)cn2ccnc12	750243726	NUTQXNAVAXGETH-UHFFFAOYSA-N	429.234	1.621	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)c2ccc(F)c(NS(C)(=O)=O)c2)cc1	750718116	CKCBTUSFWKHPQU-GFCCVEGCSA-N	439.465	1.824	50	20	IDGD	
Cc1ccc(F)cc1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	755382509	MVUXASYRRAWGJP-UHFFFAOYSA-N	436.465	1.622	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)Nc2ccc(S(=O)(=O)NC(C)C)cc2)c1	755517820	QRVSZVOKFQFDSM-UHFFFAOYSA-N	436.490	1.857	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)NNC(=O)c3nnc(O)c4ccccc34)cn2)C[C@@H](C)O1	755866828	YIHPPTVCLYIXPE-BETUJISGSA-N	437.460	1.811	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)NCCN2C(=O)[C@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2=O)c2ccccc2n1	756099171	UVANELDOTIHDAV-KODHJQJWSA-N	433.468	1.294	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)Nc1nnc(C(F)F)s1	756219848	MVAHUXBCGBIOIR-UHFFFAOYSA-N	446.461	1.727	50	20	IDGD	
CCCS(=O)(=O)Nc1ccc(NC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1	756571716	JRWOCYPDVWTTIM-KRWDZBQOSA-N	434.474	1.831	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)Nc3cn(C)c(=O)cc3C)n[nH]2)cc1OC	756893360	URVAEMYNYUZLMD-UHFFFAOYSA-N	426.433	1.568	50	20	IDGD	
Cc1cc(=O)c(C(=O)NNc2ccc(C(N)=O)nn2)nn1-c1cccc(C(F)(F)F)c1	757392572	QIWQYCSCUOWHLO-UHFFFAOYSA-N	433.350	1.206	50	20	IDGD	
COCc1cc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)ncn1	757719782	FOYGYHBYUQFJNN-UHFFFAOYSA-N	448.505	1.264	50	20	IDGD	
CN(C)c1nnc(-c2ccc(NC(=O)NNC(=O)COc3ccccc3[N+](=O)[O-])cc2)o1	757720655	WTOJZHJTWCBBGD-UHFFFAOYSA-N	441.404	1.943	50	20	IDGD	
Cc1ccc(-n2nc(-c3ccco3)cc2NC(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)cc1	757892360	DRJUDKCPKKNQGN-CYBMUJFWSA-N	446.489	1.531	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)[C@@](C)(O)CN2C(=O)C(C)(C)c3ccccc32)nc1C	760490333	NWJSYBRTRVUOLP-QFIPXVFZSA-N	441.488	1.480	50	20	IDGD	
C[C@H](CC(=O)NNC(=O)C(C)(C)c1ccccc1)NS(=O)(=O)c1cccnc1Cl	760556304	QSHUKNDOYBZBGO-CYBMUJFWSA-N	438.937	1.917	50	20	IDGD	
COc1cc(CN(CC(=O)NNC(=O)c2ccc(OC)c(OC)c2)C2CC2)ccc1O	760991974	DRCZFIKCTUFEGK-UHFFFAOYSA-N	429.473	1.844	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)N[C@@H]2CCN(C(=O)CC)C2)c2ccccc2c1=O	762380575	XPTYHYJQPVMHCB-CQSZACIVSA-N	428.493	1.152	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H]1[C@@H]1COCCC1=NNC(=O)Cc1cc(O)nc(O)n1	762422860	MUVWNWJMTUCSCP-HIFRSBDPSA-N	435.481	1.339	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)CCC(=O)NC3CCCC3)n[nH]2)cc1OC	763150906	SBKCLOMAOMXGGP-UHFFFAOYSA-N	429.477	1.694	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)[C@H]2CSCN2C(=O)C(C)(C)C)n[nH]1	763152621	HUUJMLKINIJSRY-OAHLLOKOSA-N	431.518	1.794	50	20	IDGD	
COC(=O)c1c(F)cccc1S(=O)(=O)NNC(=O)CCCNC(=O)OC(C)(C)C	763439351	MEBDTIHLEQPAJE-UHFFFAOYSA-N	433.458	1.227	50	20	IDGD	
CC(C)n1cnnc1-c1ccccc1NC(=O)C(=O)NNC(=O)c1ccc2c(c1)OCO2	763548140	KLDIOWSARHHVGX-UHFFFAOYSA-N	436.428	1.654	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cc(F)c(OC(C)C)c(F)c2)cc1	763660705	FTYFTCWDNKYRCC-UHFFFAOYSA-N	437.399	1.926	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccn(-c3ccccc3Cl)n2)cc1	763678563	GDNQLNDVFFMRLV-UHFFFAOYSA-N	438.831	1.562	50	20	IDGD	
Cc1nnc(-c2ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc3ccc(F)cc3)cc2)o1	763873289	VAQSJTRNXVLTLZ-NSHDSACASA-N	427.392	1.738	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccnn2C2CCCC2)cc1	763873801	YWHZBWOAEQKWNC-CQSZACIVSA-N	427.461	1.754	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2nc3c(s2)COCC3)cc1OC	763911093	CZYYMDKRSSLCIY-UHFFFAOYSA-N	448.501	1.803	50	20	IDGD	
CCc1c(NC(=O)C(=O)NNC(=O)c2cc(Br)cn2C)cnn1CC(C)C	764004549	GRJKXFRDRIUZOY-UHFFFAOYSA-N	439.314	1.602	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1cccc([C@H]2CNC(=O)C2)c1	764012897	ULSWUQXKYIPROF-GFCCVEGCSA-N	430.848	1.352	50	20	IDGD	
CN(c1ccccc1NC(=O)C(=O)NNC(=O)c1cccc2ccccc12)S(C)(=O)=O	764049679	VNNCWQOPZFTNNQ-UHFFFAOYSA-N	440.481	1.635	50	20	IDGD	
CC[C@@H](C)Oc1cccc(NC(=O)C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c1	764077205	JEVCNDKTRLFJQV-CYBMUJFWSA-N	433.486	1.667	50	20	IDGD	
CC[C@@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)CCc2ccc(OC)cc2)cc1	764126560	IUEPNIBDZAYAGM-OAHLLOKOSA-N	440.500	1.942	50	20	IDGD	
COCCn1ncc2ccc(NC(=O)C(=O)NNC(=O)c3ccc(Cl)cc3O)cc21	764127552	XFAABGISMOAANE-UHFFFAOYSA-N	431.836	1.441	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)C(=O)Nc2cnn(CC3CC3)c2)c1	764233239	UTUJLFGQKMVYPO-UHFFFAOYSA-N	436.266	1.464	50	20	IDGD	
CCOC(=O)c1cc(C)sc1NC(=O)C(=O)NNC(=O)Cn1ccc2ccccc21	764242586	IWGARILOPXIASQ-UHFFFAOYSA-N	428.470	1.974	50	20	IDGD	
CCCNS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)C(C)(C)c2ccccc2)cc1	764303280	UENVIWULGZBJCX-UHFFFAOYSA-N	446.529	1.439	50	20	IDGD	
O=C1CCc2ccc(NC(=O)C(=O)NNC(=O)c3cc(-c4ccc(F)cc4)[nH]n3)cc2N1	764387791	NKHJKVIQNOSEEP-UHFFFAOYSA-N	436.403	1.500	50	20	IDGD	
Cc1cc2c(cc1NC(=O)C(=O)NNC(=O)c1cc(-c3ccc(F)cc3)[nH]n1)OCO2	764388672	VKCKSFCHOZBDPL-UHFFFAOYSA-N	425.376	1.653	50	20	IDGD	
CC(C)(C)NC(=O)c1cccc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)c1	764401183	NOKGWEYGMLXLNV-UHFFFAOYSA-N	444.513	1.799	50	20	IDGD	
COCCn1ncc2ccc(NC(=O)C(=O)NNC(=O)c3ccc(Cl)cc3F)cc21	764410109	FXSAOSQKQOZEIN-UHFFFAOYSA-N	433.827	1.875	50	20	IDGD	
CC(C)(C)c1cc(NC(=O)C(=O)NNC(=O)[C@@H]2COCCO2)n(-c2cccc(Cl)c2)n1	764423988	FDYXLVFOBUJNRM-AWEZNQCLSA-N	449.895	1.325	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNS(=O)(=O)c1ccccc1Cl	765118592	MUSAWCUWBHMBKV-UHFFFAOYSA-N	436.921	1.108	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)c2cc3ccccc3o2)cc1F	765646919	LELKBSRQZCPWCH-UHFFFAOYSA-N	441.462	1.957	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)CSc3ccc(C#N)cc3)CC2)cc1	765754457	KKALDHHCSIYPEG-UHFFFAOYSA-N	437.569	1.924	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)[C@@H](NC3CCOCC3)C(C)C)n[nH]2)cc1OC	768276871	NBRRUGLLRACLNT-FQEVSTJZSA-N	445.520	1.648	50	20	IDGD	
CCNS(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(-c3ccccc3OC)[nH]n2)c1	768282118	YRBSRDRSXUKMBJ-UHFFFAOYSA-N	443.485	1.458	50	20	IDGD	
CC(C)Cc1nnc(NC(=O)CCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)s1	769464769	YXGTUOPZUPUVJF-AWEZNQCLSA-N	433.490	1.443	50	20	IDGD	
CSCC[C@H](NC(=O)NNc1nc(O)c2cnn(C)c2n1)c1nnc2ccccn12	770343154	XXOVHIHGTKYAKN-NSHDSACASA-N	428.482	1.232	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)NNC(=O)c1cnn(-c2ccccc2)c1	770517202	JXHYHMNBCHBENK-CYBMUJFWSA-N	442.863	1.968	50	20	IDGD	
CC[C@@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)CN1CCN(Cc2ccc(C)cc2)CC1	771415044	DYTVHDKILZCKKT-LJQANCHMSA-N	447.580	1.563	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccn(Cc3ccccc3)n2)c1	771866795	FAUWOJOKIOAFSY-UHFFFAOYSA-N	427.486	1.257	50	20	IDGD	
CNC(=O)COc1cccc(CC(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)c1	772454022	GTFWPCIMUQLSKE-UHFFFAOYSA-N	427.465	1.098	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNC(=O)[C@@H](C(C)C)N2CCCS2(=O)=O)cc1	772630990	NOGHIRWRLZDJDF-GOSISDBHSA-N	425.551	1.933	50	20	IDGD	
CN1CCN(C(=O)NNC(=O)c2ccccc2OCC(=O)Nc2ccccc2F)CC1	773672815	LBSIYNAHSXYACF-UHFFFAOYSA-N	429.452	1.445	50	20	IDGD	
COC(=O)[C@H](C)n1cccc1C=NNC(=O)CN1CCN(Cc2ccc(C)cc2)CC1	774584819	DAJDZITZDKKTAC-IBGZPJMESA-N	425.533	1.798	50	20	IDGD	
CCOC(=O)c1c(NC(=O)NNC(=O)Cc2ccccc2F)c(C#N)cn1CCOC	775765906	QOTNJDWECSQMIU-UHFFFAOYSA-N	431.424	1.717	50	20	IDGD	
CCOC(=O)N1CCC[C@@H]([C@H](C)NCC(=O)NNC(=O)c2ccc(OC)c(OC)c2)C1	776823227	MMMIJKRCOARJRZ-GOEBONIOSA-N	436.509	1.311	50	20	IDGD	
O=C(NNC(=O)N1CC[C@](O)(c2ccc(F)cc2)C1)c1csc(N2CCOCC2)n1	776885732	RQAXZIXFDUEVGD-LJQANCHMSA-N	435.481	1.067	50	20	IDGD	
CCS(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2cc(Br)c[nH]2)cc1	776886035	ZEBAYHVQTBIOBZ-UHFFFAOYSA-N	429.296	1.715	50	20	IDGD	
Cc1nc(C(C)(C)C)nc(O)c1C(=O)N1CCN(S(=O)(=O)CBr)CC1	777833128	SLRNSXUQSASZMA-UHFFFAOYSA-N	435.344	1.228	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)[C@H]2CC(=O)N(c3cc(C)ccc3OC)C2)nc1C	778421899	IGYPYJGZTFUFIR-AWEZNQCLSA-N	427.461	1.775	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)Cc1ccccc1I	778438414	WGPQQMJMFGKHQD-UHFFFAOYSA-N	433.246	1.506	50	20	IDGD	
CCOC(=O)NNS(=O)(=O)c1ccc(I)c(C(=O)OC)c1	778556347	KRTVHRCKSDJXAV-UHFFFAOYSA-N	428.204	1.017	50	20	IDGD	
CC(C)S(=O)(=O)c1ccc(CC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1	781157285	DCUKJXYMVWAIKX-UHFFFAOYSA-N	445.545	1.265	50	20	IDGD	
COc1ccc(NNC(=O)CCNS(=O)(=O)c2ccc(OC(F)(F)F)cc2)nc1	781515830	HQOTXUOGOFEINN-UHFFFAOYSA-N	434.396	1.801	50	20	IDGD	
CCSCc1cccc(NC(=O)C(=O)NNC(=O)c2csc(N3CCOCC3)n2)c1	782896936	KYNHYJKRVNAUBE-UHFFFAOYSA-N	449.558	1.633	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2cc(C(=O)N3CCN(C)CC3)ccc2OC)cc1	783039973	XRIZQRUXDVKQDY-UHFFFAOYSA-N	441.488	1.173	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2cccc3cccnc23)nc1	783264337	MZMBNMLGWOBEHP-UHFFFAOYSA-N	428.474	1.398	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2ccc(Cl)c(-n3nnnc3C3CC3)c2)nc(C)n1	783324783	BWTZIYFXIOEHJI-UHFFFAOYSA-N	427.856	1.682	50	20	IDGD	
COC(=O)c1[nH]c(C)cc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1	783407616	DVKPRLVTCHZZDR-UHFFFAOYSA-N	448.379	1.485	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNc2cc(C)ccn2)ccc1S(=O)(=O)N1CCCC1	783931371	NWDZSUQWDKXOKY-UHFFFAOYSA-N	433.490	1.265	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNc2cc(C)ncn2)c(OCC(F)(F)F)c1	783945076	UAUXWFYKTTUSLR-UHFFFAOYSA-N	427.339	1.595	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNc2cccc(S(C)(=O)=O)c2)c(C)c1	784841711	ZEORNOZYIOAMKG-UHFFFAOYSA-N	435.458	1.032	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)C(=O)Nc1ccc2c(cnn2C(F)F)c1	785067855	QHUHKITUPDPDDG-UHFFFAOYSA-N	427.371	1.408	50	20	IDGD	
CNS(=O)(=O)c1ccc(C)c(NC(=O)C(=O)NNc2nc(C(F)(F)F)cs2)c1	785146467	RZDIBXDDUMYXDK-UHFFFAOYSA-N	437.425	1.460	50	20	IDGD	
NC(=O)CCCC(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2Cl)c1	786611330	SFWKNAAWAUDBCP-UHFFFAOYSA-N	438.893	1.557	50	20	IDGD	
CCc1c(C(=O)NNC(=O)CCN2C[C@@H](C)O[C@H](C)C2)nnn1Cc1ccc(F)cc1	787865564	SRTOIFNBYVHWPU-HUUCEWRRSA-N	432.500	1.288	50	20	IDGD	
Cc1ccc(-n2cccn2)cc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccccc1F	789584104	CZACODFXMHGBLX-AWEZNQCLSA-N	425.420	1.873	50	20	IDGD	
Cc1cc(-n2cccn2)ccc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccccc1F	789584293	GRZATOOTHQWXTJ-AWEZNQCLSA-N	425.420	1.873	50	20	IDGD	
CC[C@H]1CCc2nc(NC(=O)C(=O)NNC(=O)[C@H]3COc4ccccc4O3)sc2C1	789731203	BFKNKQWLDFUGPP-XHDPSFHLSA-N	430.486	1.584	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1cccc2c1OCC[C@@H]2N(C)C	789740309	FLRHTOOBHVRYMJ-GUYCJALGSA-N	444.463	1.764	50	20	IDGD	
Cc1cccnc1NNC(=O)C(=O)Nc1ccc(S(=O)(=O)NC2=NCCCCC2)cc1	792379852	ONVKRNXHQHXTDK-UHFFFAOYSA-N	444.517	1.723	50	20	IDGD	
COCCOc1ccc(Br)cc1NC(=O)C(=O)NNc1nc2ccccn2n1	792394219	OIIQZXRBCUYTMA-UHFFFAOYSA-N	449.265	1.599	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCCCC2)cc1NC(=O)C(=O)NCCSSC	793076714	UTWVMTADJUXWDN-UHFFFAOYSA-N	447.604	1.936	50	20	IDGD	
COc1c(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)cccc1[N+](=O)[O-]	793589858	GVYLMSFFXQPIPV-UHFFFAOYSA-N	436.446	1.381	50	20	IDGD	
O=C(Cc1csc(N2CCOCC2)n1)NNC(=S)NCCCCC(F)(F)F	794969983	WMYCKARHODIALS-UHFFFAOYSA-N	425.502	1.750	50	20	IDGD	
CCNC(=O)N(C)c1cccc(NC(=O)C(=O)NNC(=O)Cc2ccccc2OC)c1	797003187	XOFAPANOOKONPY-UHFFFAOYSA-N	427.461	1.190	50	20	IDGD	
Cc1cc(N(C)C)cc(C)c1NC(=O)C(=O)NNC(=O)CNC(=O)OCc1ccccc1	797368980	KULQEENLDMGWPQ-UHFFFAOYSA-N	441.488	1.382	50	20	IDGD	
CCCCNS(=O)(=O)c1ccc(C)c(NC(=O)C(=O)NNC(=O)CCC(C)C)c1	799835293	OUZGMGXDGIUBMT-UHFFFAOYSA-N	426.539	1.596	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1)C(=O)NCCF	799904776	RJTABTWNIDVXOW-OXQOHEQNSA-N	441.507	1.418	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)C(F)(F)c2ccc(OCC(=O)N(C)C)cc2)cc1	801108101	CDOOYBYYFPZTLE-UHFFFAOYSA-N	448.426	1.340	50	20	IDGD	
COC1(C(=O)NNC(=O)Nc2ccc3c(c2)OCO3)CCN(C(=O)OC(C)(C)C)CC1	802105905	KPDFMNZIXTZBMN-UHFFFAOYSA-N	436.465	1.984	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)NCCNS(=O)(=O)c2ccc(F)cc2Cl)c1	802431400	FINLXVSZFQTMNB-UHFFFAOYSA-N	444.872	1.870	50	20	IDGD	
COC(=O)[C@]1(C(F)(F)F)CCN(C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)C1	805110080	OEMSVYVVOCOCBU-KRWDZBQOSA-N	425.367	1.654	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NN=C1CCCC[C@H]1[C@H]1CCCN1C(=O)OC(C)(C)C	811642080	YGXQTDBVYQHDOH-SQWLQELKSA-N	430.571	1.986	50	20	IDGD	
C[C@H](C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)C(C)(F)F	814784361	KXOBSDXDXZJISO-CYBMUJFWSA-N	433.477	1.079	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1nnn(Cc2ccccc2F)c1C	815568176	XPHYVTVUNBVMKV-UHFFFAOYSA-N	426.408	1.182	50	20	IDGD	
COC[C@@H](C)NS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2cccc(Cl)n2)cc1	815726938	AVASJOILXDRBDI-LLVKDONJSA-N	441.897	1.130	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1ccccc1OCC(F)F	815752216	JDRVBSKJRJQUMP-UHFFFAOYSA-N	442.444	1.663	50	20	IDGD	
COc1ccc(COCc2cccc(NC(=O)C(=O)NNC(=O)[C@H]3CCCO3)c2)cc1	815779391	DAEVDGRLOGTLHX-LJQANCHMSA-N	427.457	1.677	50	20	IDGD	
C=C1c2ccccc2C(=O)N1CC(=O)NNC(=O)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	816510897	JEXLMFNUQNJYAO-OAHLLOKOSA-N	428.489	1.908	50	20	IDGD	
C=C[C@H](O)C(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2cccc(C(F)(F)F)c2)c1	816830146	SZFAWFGXCJELOB-HNNXBMFYSA-N	443.403	1.814	50	20	IDGD	
O=C(CN1CCN(Cc2cn3ccccc3n2)CC1)NNC(=O)c1cccc(Cl)c1	821985867	XBBYJZFMHFSBIA-UHFFFAOYSA-N	426.908	1.567	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)C2=NN(c3ccccc3)C(=O)CC2)c2ccccc2c1=O	824455461	ADKZVHVCYSYSAP-UHFFFAOYSA-N	446.467	1.921	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)NNC(=O)NCCCN1C(=O)NC2(CCCC2)C1=O	915906227	SVWHRRUBMSJZAL-UHFFFAOYSA-N	426.477	1.296	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)ccc1OCC(=O)NC(C)C	916037243	OZZRAMICUADKBY-AWEZNQCLSA-N	447.463	1.966	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)NCCNS(=O)(=O)c1ccc(C)cc1	916278222	IPQJVXAOTZZMIF-UHFFFAOYSA-N	434.518	1.245	50	20	IDGD	
COc1cc(CNC(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)ccc1O	916373777	SWEAQWWWQPHTPC-UHFFFAOYSA-N	425.445	1.836	50	20	IDGD	
NC(=O)c1cc(NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)ccc1F	916376624	UMZOFLSAORRIHL-UHFFFAOYSA-N	428.468	1.290	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12)c1nncn1C	916580806	YJPJJAXOLOWEJO-CQSZACIVSA-N	446.471	1.279	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)cc(OC)c1OC	917717524	JLGMFGWJPRLMAB-UHFFFAOYSA-N	445.837	1.897	50	20	IDGD	
CC(C)CCSc1ccc(C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)cc1[N+](=O)[O-]	919886011	SNYONHOFVTUAJR-ZDUSSCGKSA-N	444.535	1.864	50	20	IDGD	
COCCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N[C@H](C)c2ccccc2)c1	920862462	IBOMBZOLAORPLD-OAHLLOKOSA-N	434.518	1.707	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)[C@H]2CC23CCS(=O)(=O)CC3)c(OC)cc1Cl	1116936107	BIPKIYHAIKAKLT-SNVBAGLBSA-N	431.898	1.725	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](OC(C)=O)C(C)C)C2)C1	1778801031	XZZYMFGJAMYWEL-RLFYNMQTSA-N	433.343	1.578	50	20	IDGD	
CC[S@@](=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCBr)C2	1779218994	VCZJMQCZJWEEIV-FQUGFPQKSA-N	437.400	1.444	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(-c4cccnc4)[nH]n3)C2)C1	1779611875	XIZDUCXADYFPRI-YJYMSZOUSA-N	448.321	1.699	50	20	IDGD	
Cn1c(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)cc2c[nH]c3nccc-3c21	1780035165	IXBBXMKGQXPNEB-IIBYNOLFSA-N	445.907	1.049	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(CN(C(=O)COC(C)C)CCO2)C1	1780095278	OEFRQSCIAYVJLD-OAQYLSRUSA-N	449.460	1.389	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(-n4ccnc4)ccn3)C2)C1	1780392277	ONONQJGICZODPL-IFXJQAMLSA-N	448.321	1.494	50	20	IDGD	
Cc1ccc(F)c(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C3)c1	1780935406	BBPHGWDYNRLCHQ-AUSIDOKSSA-N	448.539	1.635	50	20	IDGD	
COc1cccc2[nH]cc(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)[C@@H](O)CCl)C4)c12	1781322208	QHUOEEXLUICMAQ-AQOAWAETSA-N	449.935	1.904	50	20	IDGD	
O=C(/C=C/c1cccc(O)c1)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781335040	UYOGNWOHHGIOQQ-HRMTXBTBSA-N	427.270	1.926	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cn1cccn1)C2	1781899857	ATJNYFCXJRRVDM-IIDMSEBBSA-N	427.343	1.571	50	20	IDGD	
N#Cc1ccc(F)c(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)c1	1781965772	WNQYXILRERDWFD-PBHICJAKSA-N	428.233	1.831	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)Cn2cnc3ccccc32)C1	1782101347	IYOZHDPYXDNDDK-ZWDAVXSWSA-N	448.951	1.804	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1c(C)noc1C)C2	1782172058	MKGWYWPGXTXSPN-SQGPQFPESA-N	427.929	1.602	50	20	IDGD	
O=C([C@H](F)Br)N1CCO[C@]2(CCN(C(=O)C(F)(F)c3ccco3)C2)C1	1782723327	PNOFUMDIXVKGNS-SMDDNHRTSA-N	425.201	1.892	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)C/N=C/c3ccco3)CCO2)C1	1783349233	KJWMFVKAJJPRAK-GYMQQHCDSA-N	426.311	1.702	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccc4cnccc4n3)CCO2)C1	1783534798	OYXNZHBKBAEIPK-BFUOFWGJSA-N	433.306	1.857	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3[nH]cnc3-c3cccnc3)CCO2)C1	1783535613	AOPPZRDFICWNQJ-DJJJIMSYSA-N	448.321	1.699	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccccc3C(F)(F)F)C[C@@H]21)[C@@H](O)CCl	1784093232	SLPMIAPYFPNGMU-MZGVZZPPSA-N	434.842	1.898	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)Nc1ccc(C2(NC(=O)[C@@H](O)CCl)CCC2)cc1	1786776289	YSOULUMWGWOWCE-KRWDZBQOSA-N	430.892	1.545	50	20	IDGD	
Cc1cnn(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)CBr)C[C@@H]32)c1	1787114010	JKFYYSQNBXCGIZ-VGWMRTNUSA-N	427.343	1.202	50	20	IDGD	
Cc1cc(C)nc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Br)C[C@@H]32)c1	1787191336	ZGWKIKQHLVDERR-DARAHFNDSA-N	428.302	1.982	50	20	IDGD	
CN[C@@H](CC(=O)Nc1ccc(C2(NC(=O)[C@H](C)Br)CCC2)cc1)C(=O)O	1788065393	QIZDOFUITMRMDB-FZMZJTMJSA-N	426.311	1.967	50	20	IDGD	
Cc1noc(CC(=O)Nc2ccc(C3(NC(=O)c4cnccc4C(=O)NN)CCC3)cc2)n1	1788221472	FLRWZCLZBNCDJJ-UHFFFAOYSA-N	449.471	1.367	50	20	IDGD	
CN(CC(=O)NC1(c2ccc(NC(=O)[C@@H](F)Br)cc2)CCC1)C(=O)C(=O)O	1790536190	HOKDGOCPAWJAKH-CYBMUJFWSA-N	444.257	1.354	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)Nc3cccnc3)C[C@@H]21	1791058048	NROJYHXFVAANOC-BJMQQELFSA-N	439.354	1.645	50	20	IDGD	
CCc1noc(C)c1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)Br)[C@H]2C1	1791059395	YTXMMVGRMVYYMX-NHULGOKLSA-N	428.327	1.922	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cccc([N+](=O)[O-])c3)C[C@@H]21	1791251070	UJTJZXIALUWXFJ-DKIMLUQUSA-N	439.896	1.371	50	20	IDGD	
C[C@@H](CBr)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cc1ccc3ncnn3c1)C2	1792991659	RBGZVDVCFBYFAZ-HNKHHVNMSA-N	434.338	1.941	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1noc3ccccc13)C2	1795113027	VLUSZSDJCKURLC-DBWKPXFBSA-N	436.306	1.745	50	20	IDGD	
Cc1ccc(OCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Br)C3)cc1	1795309127	ZOMGDKDMGRFCMW-RMHZUWNSSA-N	429.286	1.654	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)c1cc(C(F)(F)F)c[nH]1	1796189252	QIZMXBNZAZGHFW-MUJYYYPQSA-N	435.211	1.279	50	20	IDGD	
Cc1c(Cl)cccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1	1796189781	ZHMFEALSPKJRAN-BCDXTJNWSA-N	426.709	1.894	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccnc1S)C2	1796889589	HAWAENYEPQDEBU-JWBKOJIWSA-N	440.529	1.756	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(F)cnc1Cl	1798047536	NKNHGWZBICLJJT-XHSYRHOGSA-N	434.693	1.861	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@]1(F)CCCC=C1F)C2	1798442684	MYGMIQKTHQNTDU-VJAMOUOBSA-N	433.459	1.683	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc([N+](=O)[O-])c3c1OCO3)C2	1799269222	VFXCABYFNJSHPC-WJNVRWDZSA-N	439.852	1.544	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)(Cl)Cl)C2)[C@@H](F)Br	1799346946	JIXVBIPRPFLOEE-ULAWRXDQSA-N	426.497	1.637	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccnc1S)C2	1800638262	WFRJBLXUAZCMHF-ZMJPVWNMSA-N	428.352	1.747	50	20	IDGD	
O=C(Cc1ccc2c(c1)CCO2)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2	1800688831	MQBIPDARATXPMU-CWPLJXCYSA-N	437.334	1.539	50	20	IDGD	
COc1cc(F)cc(/C=C/C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](O)CCl)C3)c1	1800853679	SGGATHRUCAUVCN-XPFYKSGMSA-N	426.872	1.037	50	20	IDGD	
COc1cc(CCC(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)ccn1	1803135718	GESVPCVQIOHMTL-LQWHRVPQSA-N	446.935	1.724	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccn3nccc3c2)[C@@H]1c1cccnc1)[C@H](O)CCl	1803142652	GMPFOOTVRGOCTH-QXAKKESOSA-N	427.892	1.649	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cc3n(n2)CCCC3)[C@H]1c1cccnc1)[C@@H](O)CCl	1803143182	WFXFMGROVGQVQW-SNRMKQJTSA-N	431.924	1.534	50	20	IDGD	
CC(=O)NC(C)(C)C(=O)NC[C@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1	1803589829	VPXMETHZUYHLQA-NVXWUHKLSA-N	439.354	1.787	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)NC[C@@H]1CCN(C(=O)CN)[C@@H]1c1cccnc1	1804239580	NVVUZWPHYVHUSS-YQQAZPJKSA-N	439.944	1.178	50	20	IDGD	
Cc1ncccc1C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1805503876	GCDIPZAWBRTAJI-PGRDOPGGSA-N	438.532	1.478	50	20	IDGD	
Cc1ccsc1C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1807365554	YLZWZKNHSBRUMD-UYAOXDASSA-N	449.341	1.765	50	20	IDGD	
Cc1ccccc1C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1807376509	VZDHWJLZKAZZEQ-OFNKIYASSA-N	443.312	1.703	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)c1cccc2nc[nH]c12	1808002269	TVGFUIANRILYRT-UCLAIMLFSA-N	427.892	1.877	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)C2(C#N)CC2)[C@@H]1c1cccnc1	1808415399	VQMMCPYZFZRAFO-HMDFAQMRSA-N	447.499	1.525	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@@H](CNC(=O)Cn2nccn2)[C@H]1c1cccnc1	1808920950	YRSGEIKHAMKVPG-UKPHBRMFSA-N	435.326	1.410	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC2(CCCN(C(=O)CC(F)(F)F)C2)CC1	1809489793	HMYXPMGYZCKZFM-UHFFFAOYSA-N	427.427	1.482	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2cn3cccnc3n2)[C@@H]1c1cccnc1	1809778821	BVEZRYBQZVUAJR-RYRKJORJSA-N	442.907	1.698	50	20	IDGD	
CC[C@H](NC(C)=O)C(=O)N1CC[C@@H](CNC(=O)CO[Si](C)(C)C)[C@@H]1c1cccnc1	1810537860	QHGUOQIJAPXYOY-BJLQDIEVSA-N	434.613	1.854	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@H]1CCN(C(=O)Cc2cncnc2)[C@@H]1c1cccnc1	1810542216	XMAJXDZCTWPBEP-WIYYLYMNSA-N	427.581	1.972	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)N1CC[C@H](CNC(=O)[C@H](C)Br)[C@H]1c1cccnc1	1812866127	BDFIFAPWPSHFIU-TZDHZFECSA-N	437.338	1.562	50	20	IDGD	
COCCOCCOCCC(=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Cl)[C@H]1c1cccnc1	1812932392	XURSEBGHFQGNEK-YTQUADARSA-N	445.919	1.692	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)COC(C)C)n[nH]1	1814549854	PHVXFKHRCWEDHR-ZZQPOVDQSA-N	443.508	1.961	50	20	IDGD	
O=C(Cn1ccccc1=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](F)Br)CC2	1815448962	XJINFDOVCBPCLU-YMTOWFKASA-N	443.298	1.608	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)CC(F)(F)C(=O)O)sc2C1	1817095576	JLNQYFKLFJYBIZ-SFYZADRCSA-N	425.841	1.419	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CNC(=O)c2ccco2)n[nH]1	1817606659	LFHJLYSIABCOBK-OCCSQVGLSA-N	437.884	1.679	50	20	IDGD	
N#Cc1cccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)c1	1820483618	AVDVYQYCKLKTNT-HXUWFJFHSA-N	443.272	1.581	50	20	IDGD	
Cc1cc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)CCC(=O)NN(C)C)CC3)ccc1O	1823328650	ZVVJZPBLUVXJRL-CQSZACIVSA-N	445.545	1.756	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCn1ccnn1)CC2	1825453363	WXKWGRIFXGELAD-QWRGUYRKSA-N	441.355	1.910	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnc(OC)cn1)CC2	1825999935	YCHAQPGSRAUTGV-ZJUUUORDSA-N	425.898	1.421	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@H]1CCc2nc(NC(=O)[C@H]3CCNC(=O)C3)sc2C1	1826222413	XESLVYLDMJEELF-YMNVWFMLSA-N	433.361	1.818	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)C23CC(C2)C3)CC1	1828925885	SLDDFWJBAXGJDC-PELQFQBLSA-N	425.533	1.719	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)C2=COCCC2)CC1	1828926080	YAJBMQYHTCIKHR-FQEVSTJZSA-N	441.532	1.613	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCc2nc(N)n[nH]2)CC1	1829102822	NQFNAPZWIPRGPP-MRXNPFEDSA-N	436.633	1.791	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc4c3OCC4)C2)C1	1830361822	FKPQKXJGIJNQAP-JOCHJYFZSA-N	436.936	1.957	50	20	IDGD	
Cc1cc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)no1	1830545784	MQXDLIDIWQRJHI-SCLBCKFNSA-N	444.326	1.013	50	20	IDGD	
CCCNC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1831193393	RXQKAHMPEYWJQH-FQEVSTJZSA-N	431.961	1.014	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)n3cc(C)cn3)C2)C1	1831657116	LXEQYDWGCKMAIZ-FUHIMQAGSA-N	426.945	1.616	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)C2=COCCC2)CC1	1831917943	NOWKBIDCGNIQTJ-HXUWFJFHSA-N	441.532	1.613	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@H](C)n2cnnn2)CC1	1832290572	PQLGSOYBXBROFV-KCQAQPDRSA-N	427.347	1.637	50	20	IDGD	
COc1cc(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)ccn1	1832600482	GVALMNCDSORSJD-IBGZPJMESA-N	446.331	1.283	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](F)Cl)CC2)CC1)[C@H]1COc2ccccc2O1	1833715391	GATLJMOFIUWRET-RTBURBONSA-N	439.915	1.932	50	20	IDGD	
Cc1cnc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)s1	1833804447	VWHQTDXKGDYLBL-XHDPSFHLSA-N	436.303	1.212	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3ccnn3C)CC2)CC1	1834214090	SSPVRYZBNJRBSI-INIZCTEOSA-N	440.386	1.779	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)Cc3cnc[nH]3)CC2)CC1	1835061051	ZPVHASWZVXLJDU-CQSZACIVSA-N	440.386	1.555	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cc(O)nc(O)n3)CC2)CC1	1835076085	SQVGIATYHMSBFI-OAHLLOKOSA-N	439.944	1.481	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)c1ccccc1)CCO2	1835289359	BUEAOULLQNZQQT-FPOVZHCZSA-N	436.581	1.028	50	20	IDGD	
CC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)C[C@@](C)(O)CC(=O)O)CC2)CC1	1836397316	DIRFOQOVGBAKFD-OXJNMPFZSA-N	431.961	1.191	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H]3CCCOC3)CC2)CC1)[C@@H](F)Br	1836414406	JJWCEBNKAFVNNV-CZUORRHYSA-N	434.350	1.675	50	20	IDGD	
CCc1ncsc1C(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836718528	QZGGBKKNTXFPRL-INIZCTEOSA-N	429.970	1.917	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](C)CS(C)(=O)=O)CC2)CC1	1836875793	MGFBDYIBBSYJIY-WMLDXEAASA-N	437.002	1.683	50	20	IDGD	
CCn1nc(C)cc1C(=O)N1CCOC[C@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1837711891	VZSKXORXUZEISR-FQEVSTJZSA-N	438.601	1.133	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cn4ccccc4n3)C2)C1	1837713147	JOOCNJBFSPLCOE-OAQYLSRUSA-N	446.580	1.256	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnccc3Cl)CCO2)C1	1837780382	FFZCUTBGTFJUMT-SJKOYZFVSA-N	446.729	1.588	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)CC(F)(F)C(=O)O)CC2)CC1	1838079411	LBGKCSRDLXPSOF-CQSZACIVSA-N	440.871	1.349	50	20	IDGD	
Cc1ncncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1	1838094705	HWKPVGNCGZXHIF-MSOLQXFVSA-N	431.320	1.091	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cncc(O)c3)CC2)CC1	1838777013	QSRNIMXYRXMOLS-SFHVURJKSA-N	425.913	1.653	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3cccnc3OC)C2)C1	1839142683	VWUPSZLSMKJZOM-LAUBAEHRSA-N	439.940	1.497	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cncc(F)c3)C2)C1	1839150929	CHTCDBLIJQBXTC-QZTJIDSGSA-N	434.295	1.527	50	20	IDGD	
Cc1cnn([C@H](C)C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)c1	1839155196	NLPZHMVSKNNYRU-MNEFBYGVSA-N	447.363	1.445	50	20	IDGD	
O=C(Cc1cccc(F)c1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839199205	KFXWLGXGHKMXQM-AEFFLSMTSA-N	447.276	1.515	50	20	IDGD	
CC(C)=NO[C@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)CBr)C2)C1	1839222544	QVTOSTHPWZCBLU-IIDMSEBBSA-N	448.358	1.275	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccn4nccc34)CCO2)C1	1839538186	XNBOCDXPEXRCNP-LAUBAEHRSA-N	434.924	1.812	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccoc3C)C2)C1	1839963590	PIEUQIFWGKTDLF-YJBOKZPZSA-N	429.311	1.832	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4c(s3)CCC4)C2)C1	1840150229	IAESITOGLQBXSP-QRWLVFNGSA-N	442.965	1.561	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc4ncccc34)C2)C1	1840152624	NRLKXYQTSNXGAR-XMSQKQJNSA-N	447.919	1.559	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(C)cc3F)C2)C1	1840155277	VVQCBJHUIWWXPW-OXQOHEQNSA-N	428.888	1.458	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1C[C@@]1(F)Cl)CCO2	1840242292	OJYHFYPOOMLCCH-KNPMLCFXSA-N	441.725	1.398	50	20	IDGD	
C[C@@H](C(=O)N1CCO[C@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1)c1ccccn1	1840503005	KSYJABHWWYYSDG-UTKZUKDTSA-N	435.597	1.493	50	20	IDGD	
O=C(C1CC2(CCC2)C1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1840604395	DPBWIJINAVEIQY-KSSFIOAISA-N	433.318	1.714	50	20	IDGD	
O=C([C@H](F)Br)N1CC2(CCCN2C(=O)[C@@H]2CC(=O)N(C3CCCC3)C2)C1	1841859653	XWUVYJCISCHAFD-DOMZBBRYSA-N	430.318	1.671	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](CCN)C(=O)N1CC2(CCCN2C(=O)CCBr)C1	1842637941	ZESYMVCDXBUKJX-CYBMUJFWSA-N	447.374	1.217	50	20	IDGD	
CCOC(=O)c1ncn2cc(C(=O)N3CCCC34CN(C(=O)[C@@H](Cl)COC)C4)ccc12	1843125255	JFWUPURVECGOLU-HNNXBMFYSA-N	448.907	1.582	50	20	IDGD	
O=C([C@H](F)Cl)N1CC2(CCCN2C(=O)CN2C(=O)C3(CCOCC3)c3ccccc32)C1	1845021028	ZHIGQMNYWKVESE-SFHVURJKSA-N	449.910	1.819	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)Cc1cc(OC)c(OC)c(OC)c1)C2	1846360908	MXOPDHITYLKESA-HNNXBMFYSA-N	440.924	1.712	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)CCCN1C(=O)c3ccccc3C1=O)C2	1846361008	RTVPUHYRDZADQF-KRWDZBQOSA-N	447.919	1.520	50	20	IDGD	
C[C@@](O)(CC(=O)O)CC(=O)N1CCCC12CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)C2	1846382608	GZVMRYXJTZSUQL-LFEYGZQNSA-N	447.438	1.691	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)NC(=O)OC(C)(C)C	1847500675	LEEBMABUCPHNQB-ZDEQEGDKSA-N	434.331	1.062	50	20	IDGD	
O=C(Cc1cccc(Br)c1F)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl	1847558329	KRFBTBFSZFEHMW-MELADBBJSA-N	433.705	1.932	50	20	IDGD	
Cc1cccc(-n2nnnc2SCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c1C	15512287	OYBGWNXCEMOCSI-UHFFFAOYSA-N	427.446	1.741	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)CN(C)C3=NS(=O)(=O)c4ccccc43)cc2C1	20938471	XKQZVVJVTONXPB-LBPRGKRZSA-N	446.554	1.715	50	20	IDGD	
CCCn1c(SCC(=O)NNC(=O)c2ccccc2)nc2cc(S(N)(=O)=O)ccc21	32883455	PJTLSZQIVSOXIZ-UHFFFAOYSA-N	447.542	1.647	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)c1cc(Cl)c(-n2cnnn2)cc1OC	107927773	XWWQZFQAXPNOQR-UHFFFAOYSA-N	431.840	1.206	50	20	IDGD	
COc1cc([C@@H](C)NC(=O)NNC(=O)CNC(=O)c2cccs2)cc(OC)c1OC	725873574	NYSPSOCIVSKARX-LLVKDONJSA-N	436.490	1.595	50	20	IDGD	
CN1C[C@H](NC(=O)/C(C#N)=C/c2cn(CCC(N)=O)nc2-c2ccc(Cl)cc2)CC1=O	726538108	XGAWUPVWMIJQGT-LEHPZIBWSA-N	440.891	1.333	50	20	IDGD	
Cc1ccc(C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)cc1NS(C)(=O)=O	726867284	CYHXTZDAVQGJPG-UHFFFAOYSA-N	438.531	1.564	50	20	IDGD	
O=C(CCCc1ccccc1)NNC(=O)c1cccc(CN2CCS(=O)(=O)CC2)c1	727715758	XADWRIZSVXZLKM-UHFFFAOYSA-N	429.542	1.701	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)NCCCN2CCC[C@H]2C(=O)N(C)C)c1C	728072882	LCSGISNGKJHYGI-LDVBQKTRSA-N	429.565	1.717	50	20	IDGD	
COc1cccc(N2CC[C@@H](NC(=O)NNC(=O)c3nn(-c4ccccc4)cc3O)C2)c1	728220168	CUXQEBDVAWPTSJ-OAHLLOKOSA-N	436.472	1.809	50	20	IDGD	
CCOC(=O)c1cc(S(=O)(=O)NNC(=O)c2cc(OC)cc(OC)c2)ccc1F	728502437	KEIWFMQGHMEMQI-UHFFFAOYSA-N	426.422	1.643	50	20	IDGD	
O=C(CCN1C(=O)[C@@H]2CCCC[C@H]2C1=O)NNC(=O)c1cc(F)ccc1Br	728549281	BPZFQKBYMVXEBA-VXGBXAGGSA-N	440.269	1.915	50	20	IDGD	
O=C(NC[C@@H](c1ccco1)N1CCCC1)NNC(=O)C1CCN(c2ncccn2)CC1	728941378	YAHIYJLWFSQRBH-KRWDZBQOSA-N	427.509	1.454	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1	731499721	CCHPLJIPQUCDDT-MRXNPFEDSA-N	425.489	1.541	50	20	IDGD	
Cc1c(C(=O)NNC(=O)CCN2C[C@H](C)O[C@@H](C)C2)nnn1-c1cccc2cccnc12	732260873	IRGALEZWOOTAJK-GJZGRUSLSA-N	437.504	1.384	50	20	IDGD	
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1ccco1)NNC(=O)c1cccc([N+](=O)[O-])c1	732330452	QXJUWXRQRFTXBM-HNNXBMFYSA-N	444.400	1.187	50	20	IDGD	
O=C(NNC(=O)C(=O)N1CCCC1)N[C@@H]1CCCN(Cc2ccc(F)cc2Cl)C1	732469805	RAMCIAPGLWRDOH-OAHLLOKOSA-N	425.892	1.396	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)N[C@@H]1CCN(c2ccccc2C(N)=O)C1	732589533	CNOSRKPMDUTDSD-ZIAGYGMSSA-N	429.452	1.301	50	20	IDGD	
O=C(NNC(=O)N1CCN(C(=O)c2ccccc2O)CC1)c1cnn(-c2ccccc2)c1	733349761	HGXQMVFZZRAORU-UHFFFAOYSA-N	434.456	1.390	50	20	IDGD	
COC[C@H](C)S(=O)(=O)NC(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccccc1	733715254	RFKHLZDWOMUXPC-ZCQLHAAUSA-N	427.486	1.852	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1	734240954	XRRVNJOBCWYHGS-INIZCTEOSA-N	437.516	1.893	50	20	IDGD	
C[C@@H]1CN(Cc2ccc(C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)cc2)C[C@@H](C)O1	734241297	MARLRMGHBUXKNU-HZPDHXFCSA-N	449.552	1.765	50	20	IDGD	
CN(CC(=O)NNc1cc(C(F)(F)F)nc(-c2ccccn2)n1)[C@@H]1CCS(=O)(=O)C1	734258613	MITMOQVETFVVCJ-LLVKDONJSA-N	444.439	1.119	50	20	IDGD	
C[C@H]1Oc2c(cccc2C(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)NC1=O	734825869	PNEFSXFPXTXELG-GFCCVEGCSA-N	447.492	1.750	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)[C@@H]2CC(=O)N(Cc3ccco3)C2)cc1C	736742742	PIBUMTKDGKQAPS-CYBMUJFWSA-N	433.486	1.565	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)N[C@@H]2CCN(CCOC)C2)c2ccccc2c1=O	739037134	ZUYXHWSXRKEXJQ-MRXNPFEDSA-N	444.536	1.251	50	20	IDGD	
COc1cccc(OCCCNC(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)c1	739039363	PSZABXSFUZPQTN-UHFFFAOYSA-N	437.522	1.872	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)c1cnn(-c2ncccc2Cl)c1C(F)F	740852105	KVSYIRNQDUPTJQ-UHFFFAOYSA-N	428.827	1.924	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@@H]2CCCN(C(=O)NCC(C)C)C2)cc(OC)c1OC	741171938	CKXKOZOHCOKWRP-CQSZACIVSA-N	436.509	1.551	50	20	IDGD	
COc1ccc(N2CCN(CCNC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)CC2)cc1	743363539	SZGWQVDATCXDEE-UHFFFAOYSA-N	442.476	1.370	50	20	IDGD	
CS(=O)(=O)CCN1CCC(NC(=O)NNC(=O)Nc2ccc(OC(F)F)cc2)CC1	743601745	ICSBUGNKUANVHP-UHFFFAOYSA-N	449.480	1.133	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)COc2cccc(N3CCCC3=O)c2)cc1	743831259	UJNPKQXLPVNTGM-UHFFFAOYSA-N	446.485	1.449	50	20	IDGD	
CCOc1ccc(/C=C(/C#N)C(=O)O[C@H](C)C(=O)N(CC)[C@H]2CCS(=O)(=O)C2)cc1	744572185	XRGXRWFODJZMAR-BESLQZQESA-N	434.514	1.960	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1cccc(Cn2ccnc2)c1	744621180	UGKXQLOONRCDSW-UHFFFAOYSA-N	441.513	1.709	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)[C@H](c2ccccc2F)N2CCOCC2)cc1	745495055	FFISCFKBKLVITO-FQEVSTJZSA-N	429.448	1.512	50	20	IDGD	
COc1cccc(N2C[C@@H](NC(=O)NNC(=O)c3cc([N+](=O)[O-])ccc3O)CC2=O)c1	745794391	ACBMMOORUSNANR-NSHDSACASA-N	429.389	1.059	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)[C@@H]2CCCN2C(=O)Nc2ccc3c(c2)OCCO3)cc1	746185246	MACXBRWUVGJMDO-KRWDZBQOSA-N	435.440	1.787	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)Cc2cn3ccccc3n2)c1	746550902	XVXOVBMHUOVRBI-UHFFFAOYSA-N	433.465	1.164	50	20	IDGD	
COc1cc(C(=O)NCC(=O)NNC(=O)Cc2cn3ccccc3n2)ccc1OC(F)F	746701377	KCKKUXUGKYWYEK-UHFFFAOYSA-N	447.398	1.064	50	20	IDGD	
CN(C)c1ccc(N2CCC(NC(=O)NNC(=O)Cc3cn4ccccc4n3)CC2)cc1	746769213	FUTUKDBBGNITLA-UHFFFAOYSA-N	435.532	1.942	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCc2csc(N(C)C)n2)nc1	747588284	DNKTWKUBUUNDKB-UHFFFAOYSA-N	427.556	1.461	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)Cc3cccc([N+](=O)[O-])c3C)CC2)cc1	747974042	AVZHIDXEMQGVGD-UHFFFAOYSA-N	439.516	1.719	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)c2ccc(C(=O)NNC(=O)C(=O)N3CCCC3)cc2)cc1	748247698	UUKNKRQCDNLWGI-UHFFFAOYSA-N	444.513	1.204	50	20	IDGD	
CC(C)OCCS(=O)(=O)NCC(=O)NNc1ccc(C(F)(F)F)cc1[N+](=O)[O-]	748527962	SNSAZOYWDZAUJX-UHFFFAOYSA-N	428.389	1.401	50	20	IDGD	
COC(=O)c1ccc(Cl)cc1S(=O)(=O)NNC(=O)c1cc(OC)cc(OC)c1	751260988	HVYDQBMBVVOQOH-UHFFFAOYSA-N	428.850	1.767	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(n2cc(C(=O)NNC(=O)NCc3ccco3)nn2)CC1	751371445	KDFPHERXZIQYTH-UHFFFAOYSA-N	433.469	1.587	50	20	IDGD	
COc1cc(OC)cc(N2C[C@@H](C(=O)NNC(=O)c3ccc(OC)c(OC)c3)CC2=O)c1	752268137	KRKMALDOHDVITE-AWEZNQCLSA-N	443.456	1.535	50	20	IDGD	
COc1cc(OC)cc(N2C[C@@H](C(=O)NNC(=O)CCc3ccccc3O)CC2=O)c1	752520621	FMNUKFPLSFTTFA-HNNXBMFYSA-N	427.457	1.543	50	20	IDGD	
CCc1c(C(=O)NNc2ccc([N+](=O)[O-])cc2Cl)cnc2c1c(=O)n(C)c(=O)n2C	754084076	DDPOFKJKGWQTBE-UHFFFAOYSA-N	432.824	1.513	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)c2cc(S(N)(=O)=O)oc2C)cc1Cl	754203769	IGRCFYWHZBGILE-UHFFFAOYSA-N	432.842	1.373	50	20	IDGD	
O=C(NCCN1C(=O)[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)NNC(=O)NCc1ccc(Cl)cc1	755256055	KGBFESOQVXXYIZ-DARAHFNDSA-N	431.880	1.161	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccc3c(c2)NC(=O)CS3)c1	755547588	ANBXNWBRYUWTLR-UHFFFAOYSA-N	449.514	1.448	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)Nc2cccc(CN3CCOC3=O)c2)c2ccccc2c1=O	755826458	DEILTBBAWMTRJU-UHFFFAOYSA-N	436.428	1.352	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)Nc1ccn(CC(=O)N(C)C)n1	756311650	QRMSSPAOPZVZIW-UHFFFAOYSA-N	427.490	1.870	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)Nc2cccc(N(CC(N)=O)Cc3ccccc3)c2)n1	756392776	JVKSFRFXWXOMNX-UHFFFAOYSA-N	449.515	1.845	50	20	IDGD	
O=C(NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)Nc1ccc2c(c1)COC2	757853718	NXPLGDXKWMHQAY-UHFFFAOYSA-N	430.486	1.968	50	20	IDGD	
Cc1nn([C@@H]2CCS(=O)(=O)C2)c(C)c1NC(=O)NNC(=O)c1ccc(Cl)cc1O	757871889	QSVDAKIEBNEOFT-GFCCVEGCSA-N	441.897	1.685	50	20	IDGD	
O=C(NNC(=O)C(=O)Nc1ccccn1)NC1CCN(c2nc3ccccc3s2)CC1	758726655	RUDCTLJWNFKGGR-UHFFFAOYSA-N	439.501	1.629	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)NNC(=O)N=c1cc[nH]cc1I	760025483	SORFVXWWIBDXPB-UHFFFAOYSA-N	435.225	1.985	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H](C)C[C@@H]2CCOC2)c1	760193326	KCLFNVVHUWYCSY-CABCVRRESA-N	426.539	1.476	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc([N+](=O)[O-])c(C(=O)O)c1)c1cccc(OC(F)F)c1	760361802	ATXUVZZMBCQPSB-UHFFFAOYSA-N	431.329	1.518	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)c2cc(S(C)(=O)=O)ccc2F)n[nH]1	763156636	ZTCMZUNURIGFNW-UHFFFAOYSA-N	432.433	1.703	50	20	IDGD	
Cc1ccc(Oc2ccc(NC(=O)C(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)cc2)nn1	763466562	JMEVSGLMKGPPKO-UHFFFAOYSA-N	436.384	1.885	50	20	IDGD	
CC(=O)NNC(=O)C(=O)Nc1ccc(Br)c(I)c1	763518812	ZOVDYVZFKHQATO-UHFFFAOYSA-N	426.008	1.160	50	20	IDGD	
O=C(NNC(=O)c1cc2ccccc2cc1O)C(=O)Nc1cccc(C(=O)NC2CC2)c1	763528670	XCDKRIFVOBSSIN-UHFFFAOYSA-N	432.436	1.837	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc2nc(OC)ccc2c1	763680481	GAGCQKILZFUAKQ-UHFFFAOYSA-N	438.440	1.807	50	20	IDGD	
COc1ccc(CN(C)C)cc1NC(=O)C(=O)NNC(=O)CN1CCCc2ccccc21	763728823	RGLLFCBVNOKCKO-UHFFFAOYSA-N	439.516	1.296	50	20	IDGD	
O=C(CN1CCCc2ccccc21)NNC(=O)C(=O)Nc1cccc(C(=O)NC2CC2)c1	763733738	GRCZZKUPQUKKTP-UHFFFAOYSA-N	435.484	1.118	50	20	IDGD	
O=C(CN1CCCc2ccccc21)NNC(=O)C(=O)Nc1ccccc1OCC(F)F	763746494	YPNUIVZIEUFCEE-UHFFFAOYSA-N	432.427	1.869	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(F)c(NC(C)=O)c2)cc1	763860505	HZHCPGXKJNHOMT-GFCCVEGCSA-N	446.435	1.736	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)c(C)c1	763872149	KFIATWUDRSQRJL-CQSZACIVSA-N	433.436	1.713	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@@H](C)C(=O)NNC(=O)C(=O)Nc1ccn(CCC#N)n1	763883508	PQIFGIIBSFFXCT-ZDUSSCGKSA-N	432.868	1.620	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccn(Cc3ccncc3)n2)cc1OC	763902009	LYGJEKZEIOYGLO-UHFFFAOYSA-N	438.444	1.133	50	20	IDGD	
CC(C)Cc1noc(-c2cc(Cl)ccc2NC(=O)C(=O)NNC(=O)c2cnccn2)n1	764023980	HEFSMTWEUWOORQ-UHFFFAOYSA-N	443.851	1.778	50	20	IDGD	
CCOCCOCc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)nc2)c1C	764100009	GJYFPTUANXRSND-UHFFFAOYSA-N	434.880	1.996	50	20	IDGD	
COc1ccc(NC(=O)c2ccc(NC(=O)C(=O)NNC(=O)CC(F)(F)F)cc2)cc1	764111160	DFPCLVGJDFGEKO-UHFFFAOYSA-N	438.362	1.986	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(OC(F)F)c3ncccc23)c1O	764130160	CHVRQQMPUDBLNE-UHFFFAOYSA-N	446.366	1.950	50	20	IDGD	
Cc1nc(COc2ccc(NC(=O)C(=O)NNC(=O)c3cccc4cccnc34)cc2)no1	764149707	ZDEYRKUQVXSPBP-UHFFFAOYSA-N	446.423	1.905	50	20	IDGD	
C[C@H]1CN(C(=O)c2ccc(NC(=O)C(=O)NNC(=O)CCc3ccco3)cc2)C[C@H](C)O1	764170872	ZDAHEBHMRZDIGM-GJZGRUSLSA-N	442.472	1.248	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNC(=O)CN(C)C)ccc1Sc1ccccc1	764213221	UWEQCJJZHCGKDQ-UHFFFAOYSA-N	444.513	1.662	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(CCN3CCSCC3)cc2)c1	764238502	TWAPYEXOALZGAK-UHFFFAOYSA-N	437.525	1.549	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)C(=O)Nc1ccc(-c2noc(C(F)(F)F)n2)cc1	764268487	VKCCASTYSKGQDU-UHFFFAOYSA-N	434.334	1.479	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)C(=O)Nc1cc(F)cc(N2CCOCC2)c1	764280629	FAYRBWUEIBHKTH-UHFFFAOYSA-N	430.436	1.087	50	20	IDGD	
CC(C)(C)n1cc(C#N)c(NC(=O)C(=O)NNC(=O)c2cc(Br)ccc2O)n1	764280709	RSKNNESEOPBAPJ-UHFFFAOYSA-N	449.265	1.378	50	20	IDGD	
CC(C)(C)NC(=O)c1cccc(NC(=O)C(=O)NNC(=O)CCc2ccccc2O)c1	764281447	XBPOXJBYGXAYPL-UHFFFAOYSA-N	426.473	1.639	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)ccc1Cl	764349659	RZWZVHHRJHNRQD-UHFFFAOYSA-N	426.212	1.885	50	20	IDGD	
CC[C@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1	764351468	RUVOAXQFGACJFU-HNNXBMFYSA-N	448.483	1.800	50	20	IDGD	
Cc1ccc(C(=O)NC2CC2)cc1NC(=O)C(=O)NNC(=O)C(F)(F)Oc1ccccc1	764379873	MZCFYQRKMXMSBN-UHFFFAOYSA-N	446.410	1.645	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NN=Cc3cccc4c3OCO4)CC2)cc1	764815767	FRMQWRMTDBOZJS-UHFFFAOYSA-N	444.513	1.180	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(CN3CCC(CO)CC3)cc2)c1	764821291	QWTSADFJPLSHCH-UHFFFAOYSA-N	445.541	1.369	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@]2(CCN(C(=O)NNC(=O)CNC(=O)c3ccco3)C2)C1	765241262	LFRWDXKQSBLFBF-FQEVSTJZSA-N	435.481	1.083	50	20	IDGD	
CC(C)[C@H](C(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1)N1CCCC1=O	766662682	AZQCOJXQBQQNPF-OAQYLSRUSA-N	449.983	1.252	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)N[C@@H]1CCCc2c[nH]nc21	767226630	JUUDFCDOGHZRDS-QGZVFWFLSA-N	446.533	1.606	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)C[C@H]2CN(C(=O)OC(C)(C)C)CCO2)cc1	767493469	PVSKJAQDWRNLBK-INIZCTEOSA-N	435.477	1.325	50	20	IDGD	
Cc1cc(Cl)c2c(c1)C(=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O)CCCO2	767763140	DGZRQKFMXCHOHF-UHFFFAOYSA-N	437.909	1.226	50	20	IDGD	
CC(C)Cn1ncc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1C1CC1	768266168	AIAIXYKLYTWRQO-UHFFFAOYSA-N	433.534	1.742	50	20	IDGD	
COc1ccc(NNC(=O)CN2C(=O)N[C@](C)(c3ccc(C)cc3)C2=O)c([N+](=O)[O-])c1	768331519	BHFNCBXJZCMCNO-HXUWFJFHSA-N	427.417	1.822	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)Cn1nc(Br)nc1Br	768398144	CFGIWZXURAQPKG-UHFFFAOYSA-N	431.088	1.502	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)c1ccc(Cl)c(S(C)(=O)=O)c1	768634640	OBLIVFNTSFHNLL-UHFFFAOYSA-N	432.907	1.913	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)NC1CCN([C@@H]2CCCC[C@@H]2O)CC1	769160518	JGGUGHFWYHKFJN-WBVHZDCISA-N	435.481	1.072	50	20	IDGD	
CC(C)(C)OC(=O)N1CCc2ccccc2[C@@H]1C(=O)NNC(=O)C(=O)Nc1ccccn1	769263164	WCIMJPXRFNBOEI-QGZVFWFLSA-N	439.472	1.702	50	20	IDGD	
Cc1cnn(Cc2ccccc2F)c1NC(=O)C(=O)NNC(=O)[C@@H]1Cc2ccccc2O1	769266626	ORWYGPNFJHWKAU-SFHVURJKSA-N	437.431	1.469	50	20	IDGD	
COc1cccc(C(=O)NCCNC(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)c1	770129546	QXVMPNFQTYFPFR-CYBMUJFWSA-N	434.880	1.876	50	20	IDGD	
Cc1ccc(C)c(-n2c(C)nnc2SCC(=O)NNc2nc(O)c3cnn(C)c3n2)c1	770974282	KVRPUDCGXVJPAF-UHFFFAOYSA-N	439.505	1.810	50	20	IDGD	
CCS(=O)(=O)N[C@@H](CCSC)C(=O)NNC(=O)[C@@H](C)Oc1cccc(Cl)c1	772964968	AEDWJVZMMXESQY-RISCZKNCSA-N	437.971	1.316	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(C)c(Br)cn2)cc1OC	773510756	IMZIXLOLLOXQTB-UHFFFAOYSA-N	437.250	1.569	50	20	IDGD	
COc1ccc(C(=O)N2CCCC2)cc1NC(=O)C(=O)NNc1ccc([N+](=O)[O-])cc1	773644218	LKWTZGPOQSUREG-UHFFFAOYSA-N	427.417	1.921	50	20	IDGD	
O=C(CN1CCN(Cc2nc3ccccc3[nH]2)CC1)NNC(=O)c1ccccc1Cl	774726818	HSVQSBLRRFNUAE-UHFFFAOYSA-N	426.908	1.795	50	20	IDGD	
O=C(NNC(=O)c1cccc(OC(F)F)c1)Nc1ccnn1[C@@H]1CCS(=O)(=O)C1	776060376	WVWPCWFYBLJIQD-LLVKDONJSA-N	429.405	1.311	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@H](C)c2ccc(N(C)C)cc2)cc1	776248347	YOAKKOVOFVWWBL-MRXNPFEDSA-N	447.561	1.773	50	20	IDGD	
CN(C)c1noc(CCC(=O)NNC(=O)c2nc(-c3ccccc3)n(-c3ccccc3)n2)n1	776596210	HHXQWFCEHMBFKH-UHFFFAOYSA-N	446.471	1.777	50	20	IDGD	
COC(=O)[C@@](C)(NCC(=O)NNC(=O)c1ccccc1)c1cccc(Br)c1	777616525	ZMYKBNLGJKDOAS-IBGZPJMESA-N	434.290	1.888	50	20	IDGD	
CC(C)CS(=O)(=O)N1CCC(NC(=O)NNC(=O)c2ccc(Cl)cc2F)CC1	777768923	WNLIUNOOHIMJCD-UHFFFAOYSA-N	434.921	1.873	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)NCc1ccc(COC2CCOCC2)cc1	778709063	XRTNDGMVMOAMAI-UHFFFAOYSA-N	436.509	1.737	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1cc2c(cc1F)NC(=O)CC2	778709325	GIFFSKNMZQJQQD-UHFFFAOYSA-N	434.811	1.772	50	20	IDGD	
CC(=O)Nc1cc(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)c(F)cc1F	782885723	HHFBGLGZLYYXAE-UHFFFAOYSA-N	444.398	1.139	50	20	IDGD	
CCOc1cc(NC(=O)C(=O)NNC(=O)c2csc(N3CCOCC3)n2)ccc1C	782897439	OVDUKABHSGVIJT-UHFFFAOYSA-N	433.490	1.087	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2ccc3nc(-c4ccc(F)cc4)oc3c2)CCS(=O)(=O)C1	783425491	IABQWBDBCQOPGE-FQEVSTJZSA-N	446.460	1.770	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2c(C)cnn2[C@H]2CCN(Cc3ccccc3)C2)ncn1	783945279	JJWPGQQIRVKRQN-SFHVURJKSA-N	434.504	1.819	50	20	IDGD	
COC(=O)c1cccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)c1C	784207867	JMHLVWRHBQMHKX-UHFFFAOYSA-N	446.485	1.304	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)C(=O)Nc1cccc2ccncc12	784210512	RQOHHFQJBSDRJM-UHFFFAOYSA-N	425.470	1.757	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)C(=O)Nc2cccc(OCC(=O)N3CCCC3)c2)c1	784853339	DLVRUHZITZWMRJ-UHFFFAOYSA-N	440.456	1.556	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)ccc1C(N)=O	785100346	WJOVSMJZTVQAMU-UHFFFAOYSA-N	431.399	1.346	50	20	IDGD	
O=C(NNC(=O)[C@H]1OCC[C@H]1c1ccccc1)C(=O)Nc1ccc(OC2COC2)cc1	789816931	GYIQHDBLOSBNRZ-OALUTQOASA-N	425.441	1.123	50	20	IDGD	
CCOC(=O)c1c(C)csc1NC(=O)C(=O)NNC(=O)[C@H]1OCC[C@H]1c1ccccc1	789824206	ZNODZHXXADNXIT-HOCLYGCPSA-N	445.497	1.892	50	20	IDGD	
COC(=O)c1nn(C)c(C)c1/C=C(/C#N)C(=O)Nc1cc2c(cc1[N+](=O)[O-])OCCO2	792866295	LLUFDUSFTUPZTA-WDZFZDKYSA-N	427.373	1.740	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)(F)F)cc1)C(=O)Nc1cnc(CC2CC2)nc1	793040874	HMVWZOOAWPIECZ-UHFFFAOYSA-N	443.407	1.804	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNS(=O)(=O)c3ccc(C#N)c(F)c3)CC2)cc1	793411648	LMBNDNSZWPOFQF-UHFFFAOYSA-N	445.520	1.133	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)[C@H]3[C@@H]4[C@@H]5[C@H]6[C@H]7C[C@@H]5[C@H]3[C@@H]7C[C@H]64)cc2)CC1	793711522	IESVQFLLJSKHCT-PLZOXNTBSA-N	442.585	1.460	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)c1ccc(=O)n(Cc2ccccc2)n1	795169276	LDWOMQDJSGZBSW-UHFFFAOYSA-N	427.486	1.299	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)COc1ccc(Br)cc1C(C)=O	796601917	VQSOOYWXFBMUGP-UHFFFAOYSA-N	428.283	1.483	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)Nc1ccc(F)c(N2CCOC2=O)c1	797662314	BAYGVNOCXXVOKC-UHFFFAOYSA-N	443.439	1.642	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)Nc2cc(S(=O)(=O)N3CCCC3)ccn2)c1	797674369	SXUDFOIGNQKJEN-UHFFFAOYSA-N	432.506	1.399	50	20	IDGD	
Cc1ccc([C@@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)C(=O)Nc2ccccn2)cc1	797738587	GFGDEZJELIZUDG-MRXNPFEDSA-N	427.461	1.742	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)/C(=C\c2cccnc2)NC(=O)c2ccccc2)cc1	801109587	UUDRQKYLYHYBNQ-XSFVSMFZSA-N	443.463	1.947	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)[C@](C)(O)CN2C(=O)C(C)(C)c3ccccc32)cc1	802121330	ZCFVZZQAVSQXNL-HSZRJFAPSA-N	439.516	1.981	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)N[C@@H]1CCc2ccccc2OC1	802403844	MOUXHOPVKPSRDH-HXUWFJFHSA-N	437.544	1.923	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)[C@H](c2cnn(C)c2)N(C)C(=O)OC(C)(C)C)nc1C	803051248	IWXIIVUKUFUZTQ-HNNXBMFYSA-N	447.496	1.747	50	20	IDGD	
CCCN(NC(=O)[C@H](C)NS(=O)(=O)c1ccc(C(N)=O)cc1)C(=O)OC(C)(C)C	804594629	JCNSJVVSUCFRMX-LBPRGKRZSA-N	428.511	1.131	50	20	IDGD	
CC(C)(C(=O)OCC(=O)NNC(=O)c1ccccc1)S(=O)(=O)c1ccc(Cl)cc1	805705660	PGKRERLUUPGYFI-UHFFFAOYSA-N	438.889	1.897	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)N[C@@H](CS(=O)(=O)N(C)C)C(F)(F)F)c(Cl)c1	805768329	XXVDCFYDWIJKAO-NSHDSACASA-N	445.851	1.806	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2nc3c(s2)CSCC3)cc1	806974744	GKJJKJPMSLXPOW-LLVKDONJSA-N	448.526	1.688	50	20	IDGD	
CCN(C)C(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)c1	806979418	UJPTUBTVLJLVGL-UHFFFAOYSA-N	440.485	1.630	50	20	IDGD	
COc1cccc([C@@H](CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)N(C)C)c1	807006647	SARBSBDEZGOPFE-QGZVFWFLSA-N	448.549	1.235	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)NNC(=O)[C@H]3COc4ccccc4O3)cc2C1	807026176	KSMFTXHABYONPS-IAQYHMDHSA-N	430.486	1.688	50	20	IDGD	
CCOC(=O)c1cnn(-c2cccc(NC(=O)C(=O)NNc3ncccc3F)c2)c1C	807300671	RXKOGCDSSVLYSV-UHFFFAOYSA-N	426.408	1.973	50	20	IDGD	
COCCCOc1ccc(CNC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1	807428181	YAMXZKMBRGBMSM-UHFFFAOYSA-N	439.472	1.493	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@@H]2NC(=O)NNC(=O)CNC(=O)c1ccco1	813805922	XDLMKJWODVEDMA-AWEZNQCLSA-N	435.481	1.129	50	20	IDGD	
CC(=O)c1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cs1	814698530	IKWQHNGRNBEHQG-UHFFFAOYSA-N	437.499	1.046	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2ccc3cc(C)ccc3n2)cc1	814724301	UNXKIGPKYDJZSD-UHFFFAOYSA-N	426.498	1.933	50	20	IDGD	
CCCOc1ccc(C(=O)NNS(=O)(=O)c2n[nH]cc2C(=O)OCC)cc1OC	818787325	BDFUVLPNQHNOSX-UHFFFAOYSA-N	426.451	1.007	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)c2ccc(CNC(N)=O)cc2)cc1	860450166	NPDNXJJKDZRDMF-UHFFFAOYSA-N	439.501	1.351	50	20	IDGD	
O=C(NNC(=O)[C@H]1CS[C@H](Cc2ccccc2F)C(=O)N1)c1c[nH]c2ccccc12	896280622	GPRMGPQOWSJNFD-QZTJIDSGSA-N	426.473	1.911	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)NCc2ccc(C(=O)NNc3ncccn3)cc2)cc1	913044278	HXZOFXYXOBHSPW-UHFFFAOYSA-N	425.470	1.915	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)CNS(=O)(=O)c3ccc(C#N)cc3)cc2C1	913162441	JCJHLYXVRNAXSQ-GFCCVEGCSA-N	432.527	1.484	50	20	IDGD	
CCOc1ccccc1C(=O)N1CCC[C@H]1C(=O)NNC(=O)Cn1cnc2ccccc21	914780640	ZVIPAQAPTXIXPQ-IBGZPJMESA-N	435.484	1.887	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)c2ccc(S(=O)(=O)N(C)C)o2)cc1	914838607	YLYUVZFTRRXOTJ-GFCCVEGCSA-N	425.463	1.157	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccc(Br)cc2)c2c1CCCC2)C(=O)NC1CC1	916111012	PHMWOEIPYOVXTF-UHFFFAOYSA-N	446.305	1.553	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cnn1Cc1ccccc1	916133548	XRKXGHHDWSHXKR-UHFFFAOYSA-N	447.904	1.615	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)NCc1ccc(N2CCO[C@H](C)C2)nc1	916392565	BOCGNZZROKHDRO-CABCVRRESA-N	431.468	1.744	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCc2ccc(N3CCO[C@H](C)C3)nc2)cc1OC	916393227	VENUBJQPZOROGS-CQSZACIVSA-N	429.477	1.468	50	20	IDGD	
CCOc1ccc(N2C[C@@H](C(=O)NNC(=O)C(=O)Nc3ccc(C)c(C)c3)CC2=O)cc1	916562729	XNYKYZLLTXIINM-INIZCTEOSA-N	438.484	1.841	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)NCCCn2nc3n(c2=O)CCCC3)c1C	916650206	SYTQITFXFWZQCQ-INIZCTEOSA-N	430.509	1.186	50	20	IDGD	
O=C(Cn1ccc([N+](=O)[O-])n1)NNC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1	916735519	YPKCOJGXZRMDNH-UHFFFAOYSA-N	432.400	1.500	50	20	IDGD	
COc1cc(OC)cc(C(=O)NCC(=O)NNC(=O)c2cc(-c3ccc(C)cc3)[nH]n2)c1	917178371	UYPSGNBHRJKANX-UHFFFAOYSA-N	437.456	1.593	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCCC[C@@H]2c2noc(C3CC3)n2)cc1OC	917183565	MRBSKXSSJMCWAC-OAHLLOKOSA-N	429.477	1.952	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)c1ccc(S(=O)(=O)N(C)C)cc1	918106651	YNJDTLKUDCGPIZ-LBPRGKRZSA-N	435.462	1.550	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)CCn2c(=O)nc(O)c3ccccc32)o1	920248461	GVZLKSUOHMQBBO-UHFFFAOYSA-N	427.461	1.388	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N2CCC(OC)CC2)cc1	920852838	YSIHGOAUDCNCFD-GHRIWEEISA-N	437.500	1.978	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H](C)OC[C@H]2CCCCO2)c1	921165048	HIQPPKHVBKQPAT-NVXWUHKLSA-N	441.550	1.452	50	20	IDGD	
CS(=O)(=O)c1ccc(OCCCCC(=O)NNC(=O)c2ccc3c(c2)OCO3)cc1	921299217	KUKGEGQSDJHXRE-UHFFFAOYSA-N	434.470	1.829	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)ccn1	1317847239	ASKNEAAGKYXDBF-UHFFFAOYSA-N	429.440	1.867	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)NCCNC(=O)c2ccccc2C(F)(F)F)cc1	1321732749	OYXOJTCGOZCMCK-UHFFFAOYSA-N	449.389	1.716	50	20	IDGD	
O=S(=O)(CBr)N1CCN(S(=O)(=O)c2c[nH]c(C(F)(F)F)c2)CC1	1325799931	XNTTYEAYWGYATL-UHFFFAOYSA-N	440.263	1.022	50	20	IDGD	
CN1CCN(c2ccc(C=NNC(=O)Cc3csc(N4CCOCC4)n3)cc2F)CC1	1337565171	SKBQUPXDNBWAAI-UHFFFAOYSA-N	446.552	1.563	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2nc[nH]c2[N+](=O)[O-])C1	1778062141	IXBPIHVWGYGESG-ZTFRIQLXSA-N	448.307	1.682	50	20	IDGD	
O=C(c1ccc2cccnc2n1)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1778434001	UYEGIZUBJYMNAC-KBXCAEBGSA-N	437.269	1.764	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc4n(n3)CCC4)C2)C1	1778671693	NQYLIWCUEFIWSK-RDTXWAMCSA-N	425.327	1.446	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)c3nccc4nc[nH]c34)CCO2)C1	1781227387	KUYRQFDWTLBVSZ-MSOLQXFVSA-N	426.304	1.638	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H]1CCC(=O)NC1)C2	1781897365	ISLALNODVZPVAQ-NXEZDXNNSA-N	444.370	1.200	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(C#N)cc3Cl)C2)C1	1781972628	IWIFHFLUEMNLKK-QFBILLFUSA-N	426.300	1.909	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3c(C)nc4ccc(F)cn34)C2)C1	1782305195	XGBPVFWMJKDJIO-MGPUTAFESA-N	438.887	1.479	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)nc2nccn12	1782352729	HCDBXGYLXVYOKP-HXUWFJFHSA-N	431.569	1.333	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3nc4ccc(F)cn4n3)C2)C1	1782569218	GTRZTZCIGQVOHU-ZWKOTPCHSA-N	444.294	1.548	50	20	IDGD	
CC(C)C1(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C3)CCC1	1782808202	OXSMLEOILNNTGS-XMSQKQJNSA-N	436.597	1.700	50	20	IDGD	
Cc1ccc(C(=O)NCC(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](F)Cl)C3)cc1	1783259307	STLUPWIKDZSSSB-PLMTUMEDSA-N	439.915	1.773	50	20	IDGD	
COc1ccc(CC(=O)N2CCO[C@]3(CCN(C(=O)[C@H](C)Br)C3)C2)cc1	1783533559	ZZLMUEFYQGYFIG-IFXJQAMLSA-N	425.323	1.851	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3c(F)ccc(O)c3F)CCO2)C1	1783535232	AYKXGVPHXBAYNQ-BMLIUANNSA-N	433.249	1.897	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3c(F)ccc(O)c3F)CCO2)C1	1783535237	AYKXGVPHXBAYNQ-QGHHPUGFSA-N	433.249	1.897	50	20	IDGD	
Cc1ccn2c(C(=O)N3CCO[C@]4(CCN(C(=O)[C@H](C)Br)C4)C3)cnc2c1	1783538009	VIBYPPGMOMMOJG-LIRRHRJNSA-N	435.322	1.870	50	20	IDGD	
CN1CCC(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Br)C[C@@H]32)CC1	1783656577	ISMRXQPVHZLNBN-QBYUYEEZSA-N	434.350	1.389	50	20	IDGD	
C[C@H](Oc1cccnc1)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2	1784547584	INTSSUOAZILPMP-GDIGMMSISA-N	430.332	1.915	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3ncccn3)[C@H]2C1	1785419489	LLSNOEJSFOPJNP-AJNGGQMLSA-N	425.327	1.030	50	20	IDGD	
CCN1CCC(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)CC1	1785638923	FIQBPLQJBSQXKV-HNAYVOBHSA-N	430.387	1.579	50	20	IDGD	
CC(=O)N[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCBr)[C@H]2C1)C(C)(C)C	1786404745	MFGLWCUMFAUXAE-QBYUYEEZSA-N	446.386	1.302	50	20	IDGD	
CC(=O)c1cc(C(=O)Nc2ccc(C3(NC(=O)c4ccc(B(O)O)cc4)CCC3)cc2)n[nH]1	1787222194	WWNMFIRZPQTCBX-UHFFFAOYSA-N	446.272	1.354	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3[nH]nc4ncccc34)[C@H]2C1	1787344743	PUQHLWMFKNLPFO-MDWPOOTQSA-N	440.331	1.788	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CC(F)(F)C(=O)O)[C@H]2C1	1787432781	PZNOSQYEQSBWCG-BJDJZHNGSA-N	441.269	1.107	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(N(C)C)nc3)[C@H]2C1	1789026104	CHAFCDCHZZJQKW-TUUVXOQKSA-N	439.354	1.524	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(C)n(C)n3)C[C@@H]21	1790961194	LLHRJIQIWLLURS-AYDFFVQHSA-N	427.343	1.495	50	20	IDGD	
O=C(Cc1[nH]nc2c(Cl)cccc12)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCl	1793115413	MUURPUVQSKCNGX-BUWBCJGYSA-N	425.316	1.997	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2c(n1)NC(=O)CC2	1796104887	YYEFEQBTTRPLEX-BASYENTBSA-N	434.924	1.577	50	20	IDGD	
CCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Cl	1796370711	LCUIHWZIYRMKHT-AIEDFZFUSA-N	435.924	1.804	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@H](O)C[C@H]1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](F)Cl	1796806240	ZCQAHFWUYKHBPA-JLZCTACVSA-N	433.908	1.529	50	20	IDGD	
Cc1ccc2[nH]c(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)CCC(=O)NN(C)C)C4)cc2c1	1796898684	BDLKJLKNRLSDMM-FAQVEIGNSA-N	441.532	1.053	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnc2cc(C)ccn2c1=O	1797609039	FXUQWWRLRHSRML-JYYAWHABSA-N	432.908	1.509	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccncc1Cl	1798058395	GXPDFXOJBCNKNO-MCYUEQNJSA-N	430.730	1.969	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(Cl)c2nncn2c1	1798380998	WBBYTXNWAAAUHJ-QVHKTLOISA-N	426.304	1.888	50	20	IDGD	
C[C@@H]1CCc2c(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3cnccc3C(=O)NN)n[nH]c21	1798440720	WFZHAYPWYLYADX-YIYPIFLZSA-N	437.504	1.024	50	20	IDGD	
Cc1cc(C(=O)NCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CCBr)C3)no1	1798508243	AEXSJSPSBLKKHH-CLLJXQQHSA-N	427.299	1.136	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1n[nH]c2cccc(F)c12	1800079599	LDHHVLGZLGDBOW-ZVXAKGHKSA-N	439.285	1.689	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](F)Br)c1ccc2nc(CO)[nH]c2c1	1800159477	HMSPJUSBXBBQBS-AZKPJATDSA-N	439.285	1.998	50	20	IDGD	
CO[C@H](C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](Br)Cc1ccccc1	1800435956	GEOCVFQNNAOUBA-SOVHRIKKSA-N	439.350	1.617	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](C)Cn1ccnc1	1802984939	NDAZEQYSRAAWSO-HEZDOATESA-N	439.520	1.291	50	20	IDGD	
O=C(Cn1nnc2ccccc21)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1	1804014796	GNNYUKLWCSNKRI-QSFXBCCZSA-N	442.907	1.132	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)c2ccco2)[C@@H]1c1cccnc1	1805377633	PXFCVZVKTVJTBM-BEFAXECRSA-N	434.456	1.307	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1CCN(C(=O)CCN2CCOCC2)[C@H]1c1cccnc1	1810539622	DOAXSCCCIQGPFD-UGKGYDQZSA-N	448.640	1.661	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)C(=O)Nc2cccnc2)[C@@H]1c1cccnc1	1813031396	NCWWBZDLROWYMM-RYQLBKOJSA-N	445.907	1.375	50	20	IDGD	
CC[C@H](C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1)N(CC)CC	1815333418	MJKYAXYVROMLDP-QZTJIDSGSA-N	449.600	1.895	50	20	IDGD	
CSCC(C)(C)C(=O)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1	1815349959	ANOFFLBUDGCMHN-AWEZNQCLSA-N	447.391	1.438	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)/C=C/c2ccoc2)[nH]n1)c1cccc(B(O)O)c1	1817474764	YUVVLXYUDMAKEH-IHHMQQGQSA-N	434.261	1.702	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](O)CCl)CC2)c1ccc2ncncc2c1	1819183529	ASXLPPZXXJELSE-SWLSCSKDSA-N	431.905	1.912	50	20	IDGD	
O=C(/C=N/O[C@@H]1CCCCO1)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](O)CCl)CC2	1819901426	VJHMSIQFFARGQT-VJFARUJESA-N	430.914	1.184	50	20	IDGD	
CC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnccc1C(=O)NN)CC2	1822850178	PTLJQHYIFDJXTD-CABZTGNLSA-N	436.925	1.385	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H]2C[C@H](O)CN2)CC1	1824094179	HSURXHXAJOQWLE-BSWAZPDLSA-N	430.387	1.360	50	20	IDGD	
CC[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1c[nH]c(=O)cn1)CC2	1825450698	UEAGUWRPZDOLHH-DTWKUNHWSA-N	440.323	1.626	50	20	IDGD	
C=CCNC(=O)/C=C\C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](Cl)COC)sc2C1	1825990892	GHJQYGKHZQHWNG-MVSYMCDOSA-N	426.926	1.167	50	20	IDGD	
CCCC(=O)N[C@H](C)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](Cl)COC)sc2C1	1826000453	SXCFZWYIOAKLSN-UTUOFQBUSA-N	430.958	1.614	50	20	IDGD	
C[C@H](C(=O)N[C@H]1CCc2nc(NC(=O)C(Cl)Cl)sc2C1)N1CCN(C)CC1	1826104311	KNZSFTUNDNMBRB-MNOVXSKESA-N	434.393	1.495	50	20	IDGD	
Cc1ccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)nc1C	1827055658	BMEPGRVXISAQMV-HSZRJFAPSA-N	449.360	1.925	50	20	IDGD	
CCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCN2C(=O)OCc1ccccc1	1828547901	BAKLQYMVDBGWAE-UTKZUKDTSA-N	437.924	1.448	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(=O)c4ccccc4o3)CCO2)C1	1830312980	VFGIANSQOXIZGR-ZHRRBRCNSA-N	448.903	1.880	50	20	IDGD	
C[C@H](Cn1ccnc1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830370800	YPAYXTQSJFAVKR-OXQOHEQNSA-N	426.945	1.241	50	20	IDGD	
Cc1cc(F)cc(C(=O)N2CCC(N3CCC(NC(=O)[C@H](O)CCl)CC3)CC2)c1	1833313498	HVUOCGOZSZVDLX-LJQANCHMSA-N	425.932	1.919	50	20	IDGD	
N[C@@H](Cc1cscn1)C(=O)NC1CCN(C2CCN(C(=O)C(Cl)Cl)CC2)CC1	1835049938	VDQGZUFQCDIEEI-HNNXBMFYSA-N	448.420	1.388	50	20	IDGD	
CCCc1onc(C)c1C(=O)NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1835195248	YJZODFISFHHWCH-KRWDZBQOSA-N	440.972	1.720	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](NC(C)C)C(C)C)CCO2	1835893134	ROHIPLYAHLXGJJ-WAOWUJCRSA-N	432.005	1.873	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccsc3)CCO2)C1	1836101809	OKVUFIAILVCHJA-DYVFJYSZSA-N	431.352	1.530	50	20	IDGD	
CCOc1cccc(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)c1	1836325620	RTEHMDFUKMMXCZ-FQEVSTJZSA-N	437.968	1.870	50	20	IDGD	
C[C@H](C(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1)n1ccccc1=O	1836717614	ZCAXVVZBAAORJM-CRAIPNDOSA-N	439.940	1.008	50	20	IDGD	
Cc1cccc2[nH]c(C(=O)N3CCO[C@@]4(COCCN(C(=O)[C@H](O)CCl)C4)C3)cc12	1836912666	GTJBBUNMSDTMFX-NQIIRXRSSA-N	435.908	1.146	50	20	IDGD	
CC1(C)CC(C(=O)N2CCC(OC3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)C1	1837920879	KPCIXVLJGTVCDK-UHFFFAOYSA-N	442.365	1.415	50	20	IDGD	
CCC(=O)C(=O)N1CCC(OC2CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CC2)CC1	1838103189	NGFXNWOAFFESHX-BUVRLJJBSA-N	445.520	1.098	50	20	IDGD	
COC(=O)C1(C(=O)N2CCC(OC3CCN(C(=O)[C@H](F)Br)CC3)CC2)CC1	1838648218	MKFOSYLXNTUGNT-AWEZNQCLSA-N	449.317	1.629	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3nc4ccccn4c3C)C2)C1	1839144814	LITKMOJTVZIMSL-IIBYNOLFSA-N	434.924	1.730	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C)n(C(F)F)n3)C2)C1	1839146013	IGPNSWAUVWAYHA-UGSOOPFHSA-N	434.871	1.674	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCCCCC(=O)OC)C2)C1	1839149021	QICUPYAVKYXYDF-OXJNMPFZSA-N	432.945	1.584	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)c1ccc(O)cc1)CCO2	1839171328	SDTWOLAILRBRDI-FYINFDKHSA-N	440.924	1.206	50	20	IDGD	
COc1cc(C)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)cc1OC	1839399181	NKFPDAPZBPSOEO-XLIONFOSSA-N	444.887	1.617	50	20	IDGD	
Cc1nc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)cs1	1840031221	JCOXYFJIFNZYCT-PXAZEXFGSA-N	446.367	1.234	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3Cl)C2)C1	1840033744	OQUIBSDWKHRNKL-SJCJKPOMSA-N	446.729	1.588	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)c(C)n1	1840034707	UYKJBZSTXUXCHY-AUUYWEPGSA-N	440.338	1.552	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3ccc(C)s3)C2)C1	1840151298	YCUHOJITBCOXLB-FXAWDEMLSA-N	444.981	1.699	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc4cnccc34)C2)C1	1840153187	GXTDSENFVCXVEO-SIKLNZKXSA-N	447.919	1.559	50	20	IDGD	
COc1cccc(CCC(=O)N2CCOC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)n1	1840186600	RBKDSZMYQWWYHY-IBGZPJMESA-N	446.331	1.283	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC12CN(C(=O)[C@H](CO)NC(=O)OC(C)(C)C)C2	1841286393	BPQCJAMDVLSVMW-STQMWFEESA-N	448.358	1.106	50	20	IDGD	
COc1cc(CC(=O)N2CC3(CCCN3C(=O)[C@H](O)CCl)C2)cc(OC)c1OC	1841350364	XZCZAMSNGZOFSL-CQSZACIVSA-N	426.897	1.058	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)CCN2C(=O)Cc3ccccc3C2=O)C1	1841402324	LQLMQLBMOAJENM-QGZVFWFLSA-N	431.920	1.822	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](C(=O)N2CCCC23CN(C(=O)C(C)(C)CCl)C3)C1	1845103950	PDLMSYZOPIBQFL-LSDHHAIUSA-N	443.972	1.683	50	20	IDGD	
O=C1C[C@@H](C(=O)N2CCCC23CN(C(=O)[C@@H](Br)Cc2ccccc2)C3)CN1	1846000429	IVBCQDPNDWCHKB-CVEARBPZSA-N	434.334	1.332	50	20	IDGD	
CC[C@@H](C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)N(CC)CC	1847873282	JQVSMTYOHMKPLQ-JJPGWHBYSA-N	430.553	1.443	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CNC(=O)NCc2ccc(C)cc2)cc(OC)c1OC	14074905	PJWAPPJVMSYLMI-UHFFFAOYSA-N	430.461	1.281	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2cccc(C(=O)NNC(=O)c3ccccc3O)c2)C[C@@H](C)O1	17573700	FPJYJNPIZWPDFP-OKILXGFUSA-N	433.486	1.265	50	20	IDGD	
CC(C)NS(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(Br)c[nH]2)c1	28717685	CKWFPCIDNPDCPS-UHFFFAOYSA-N	429.296	1.539	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)CNS(=O)(=O)c2ccc3c(c2)COC3)c1C	726382483	STDGXCUZIPNXMK-HNNXBMFYSA-N	447.513	1.227	50	20	IDGD	
C#CCNS(=O)(=O)c1cccc(C(=O)NNC(=O)c2c(Cl)cccc2Cl)c1	727806186	NEHPMCDFYSFEOW-UHFFFAOYSA-N	426.281	1.980	50	20	IDGD	
O=C(CCCc1ccccc1)NNC(=O)N1CCN(S(=O)(=O)c2ccccc2)CC1	727845979	DKUROFAFUMBCRR-UHFFFAOYSA-N	430.530	1.757	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)c1ccc(=O)n(-c2ccccc2)n1	728209426	DBVGEGLTKBKQDX-UHFFFAOYSA-N	425.470	1.430	50	20	IDGD	
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC[C@H](C(=O)NNc2nc(-c3ccncc3)no2)C1	728209826	IGBMATSMTBHWDC-AWEZNQCLSA-N	446.493	1.016	50	20	IDGD	
CN(C)[C@@H](CNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)Cc1ccccc1	729044957	PKGZEGKWGFGDAX-LJQANCHMSA-N	425.537	1.196	50	20	IDGD	
CN(C)CCOc1ccc(CCNC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1	729232119	DVCHKWHFYUBDPX-FQEVSTJZSA-N	428.489	1.340	50	20	IDGD	
CNS(=O)(=O)c1ccc([C@@H](C)NC(=O)NNC(=O)c2cccc3ncccc23)cc1	730120242	GBJPNGFOVOXRKL-CYBMUJFWSA-N	427.486	1.848	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)c1ccc(F)cc1I	730778324	MWRQWGWVIFNJDA-UHFFFAOYSA-N	430.173	1.976	50	20	IDGD	
CCCCN1CCCC[C@@H]1CNC(=O)NNC(=O)c1sc(N2CCOCC2)nc1C	731219273	WRFCNTHEHLQUKL-MRXNPFEDSA-N	438.598	1.887	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)C3(C(N)=O)CC3)c3ccccc3n2)cc1OC	731596939	MIXQPMSKMFASSA-UHFFFAOYSA-N	434.452	1.946	50	20	IDGD	
Cc1nc2c(c(C)nn2C)c(C)c1CCC(=O)NNC(=O)CCN1C[C@H](C)O[C@H](C)C1	732262973	YJJYYYNPMQCDAT-OKILXGFUSA-N	430.553	1.473	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1	732288720	QOENHPPWKJBGQS-ZDUSSCGKSA-N	432.458	1.747	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)N[C@@H]2CCN(CC(F)(F)F)C2=O)c1	732590975	ZESCFWZCMSJVGW-CQSZACIVSA-N	430.427	1.991	50	20	IDGD	
Cc1nn(-c2ccccc2)c2sc(C(=O)NNC(=O)C3CCS(=O)(=O)CC3)cc12	732932816	ZLTMROFOERZDNQ-UHFFFAOYSA-N	432.527	1.981	50	20	IDGD	
CCn1c(=O)nc(O)c2c(C(=O)NNc3nc4ccccc4c(=O)n3C)cc(C3CC3)nc21	733263697	QYGOGWSAYPYLBD-UHFFFAOYSA-N	447.455	1.398	50	20	IDGD	
CCCCC(COC)=NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	737416358	BIPXLCVXIRSRAD-UHFFFAOYSA-N	425.551	1.949	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN(C)[C@H](c2cccc(F)c2)c2cnn(C)c2)n1	738309281	LMRNBHHNKLOBAD-HXUWFJFHSA-N	430.509	1.735	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2cnn(C(C)C)c2)c1	741647808	JTHWYPIPJVSRHX-UHFFFAOYSA-N	443.551	1.118	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)c2ccc(N3CCCS3(=O)=O)cc2C)cc1C	741660299	MUMFVRBTPVZFMW-UHFFFAOYSA-N	431.514	1.992	50	20	IDGD	
CCOCCCn1c(NNC(=O)C(=O)NCc2ccc(F)cc2)nc2ccccc2c1=O	742075551	BRSKMTMCECPFDG-UHFFFAOYSA-N	441.463	1.722	50	20	IDGD	
CC(=O)NC1(c2noc(CCC(=O)NNc3ncnc4[nH]cnc34)n2)CCCCCC1	743469524	RZNFJXKNARMABH-UHFFFAOYSA-N	427.469	1.497	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)c2cc(Br)ccc2O)cc1NS(C)(=O)=O	743731955	FHABUKAQDDQBMW-UHFFFAOYSA-N	442.291	1.909	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(C(=O)NNC(=O)Nc2ccc(N(C)C)cc2)cc1	743826992	VCPCNNJQLBEPQM-UHFFFAOYSA-N	435.506	1.144	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CN2CCN(C(=O)Cc3c[nH]c4ccccc34)CC2)c1	744386299	AONMBQNFFLMKAL-UHFFFAOYSA-N	433.512	1.624	50	20	IDGD	
O=C(NCc1ccc(OCCN2CCCC2)cc1)NNC(=O)c1cc([N+](=O)[O-])ccc1O	745813587	CXNSNXGNEZKRGE-UHFFFAOYSA-N	443.460	1.919	50	20	IDGD	
CCN1CCN(C[C@@H](C)CNC(=O)NNC(=O)c2cc(F)ccc2Br)CC1	745863459	VBAYHAUNHWVPNZ-ZDUSSCGKSA-N	444.349	1.806	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN1C(=O)Nc1ccc2c(c1)OCCO2)c1ccc(Cl)nc1	746129384	SPMBIQBFWZTRBH-AWEZNQCLSA-N	445.863	1.964	50	20	IDGD	
O=C(NNc1nc(-c2ccncc2)no1)[C@H]1CN(Cc2nc(O)c3ccccc3n2)CCO1	746202352	XIFLVIUUUXJZHP-MRXNPFEDSA-N	448.443	1.125	50	20	IDGD	
O=C(COC(=O)CCN1C(=O)COc2ccccc21)NNC(=O)c1cccc(Cl)c1	746250269	DRVKFUQTTNLCKS-UHFFFAOYSA-N	431.832	1.460	50	20	IDGD	
COc1cc2c(cc1CNC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)O[C@H](C)C2	746343677	FYAOZGOXRSMHNH-GFCCVEGCSA-N	433.486	1.566	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)NC1CCN(C2CCCCC2)CC1	747501441	WTPLDQAJQKIZIR-UHFFFAOYSA-N	429.569	1.821	50	20	IDGD	
O=C(Cn1cc2ccccc2n1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	748516673	HYSIPWSUTSXPQZ-UHFFFAOYSA-N	427.486	1.282	50	20	IDGD	
CCn1c(NNC(=O)[C@@H]2CCCN2C(=O)c2ccc3c(c2)OCO3)nc2ccccc2c1=O	749566991	BKLSFJCHHOWTIE-KRWDZBQOSA-N	449.467	1.893	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)CCc2ccccc2)cc1S(=O)(=O)N1CCOCC1	749801007	RRQXIQGPROILNW-UHFFFAOYSA-N	445.541	1.664	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2cc(Cl)ccc2[N+](=O)[O-])c1	751270368	ULCMEKKBVUSIFZ-UHFFFAOYSA-N	433.851	1.275	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)CN(C(=O)OC(C)(C)C)C1CC1	753391165	CYABWRXVLLDDNP-UHFFFAOYSA-N	439.538	1.449	50	20	IDGD	
NC(=O)c1ccccc1Oc1ncccc1C(=O)OCC(=O)NNC(=O)c1cccs1	753512888	AMZCWBXYZPHKLP-UHFFFAOYSA-N	440.437	1.652	50	20	IDGD	
CN1C(=O)c2cccc3c(S(=O)(=O)NNC(=O)c4cc([N+](=O)[O-])ccc4O)ccc1c23	753779811	NXNQJJXDJNWKEL-UHFFFAOYSA-N	442.409	1.667	50	20	IDGD	
CNC(=O)c1ccc(Cl)c(NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1	755935177	ZOHFUIGNRUIPSK-UHFFFAOYSA-N	431.884	1.559	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)Nc1ccc(N2CCN(C(=O)C3CC3)CC2)nc1	756295431	NKCIGSNORDLVPP-UHFFFAOYSA-N	440.479	1.675	50	20	IDGD	
CN(C1CCCCC1)S(=O)(=O)c1ccccc1NC(=O)NNC(=O)Cc1cc[nH]n1	756563878	OUTQUVFBXSCCNY-UHFFFAOYSA-N	434.522	1.758	50	20	IDGD	
O=C(Cn1cc(NC(=O)NNC(=O)c2nnc(O)c3ccccc23)cn1)NC1CCCC1	756795090	NYCCLVMEJPPVEU-UHFFFAOYSA-N	438.448	1.057	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)Nc3cnn(CCN4CCOCC4)c3)cc2C1	756826182	BHZGYJRVSNXMNN-AWEZNQCLSA-N	432.550	1.868	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCc2n[nH]cc2C1)c1ccccc1NS(=O)(=O)c1cccs1	756872250	GRHYTWXFRUNGIS-GFCCVEGCSA-N	445.526	1.838	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)Nc2cc(C(N)=O)ccc2-n2cc(C)cn2)c1	757875076	KUZKLXZTLXJZSE-UHFFFAOYSA-N	438.444	1.763	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)Nc2ccc(-n3nnnc3C(C)C)c(C)c2)c1	758014823	JJXXFHJPDLBNHW-UHFFFAOYSA-N	437.464	1.914	50	20	IDGD	
CCN(CC)[C@H](C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)c1cccc(C(F)(F)F)c1	758043675	JGWDUDORLUKEHY-FZMZJTMJSA-N	438.472	1.173	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@@H](NC(=O)NNC(=O)C(=O)Nc1ccccn1)C1CCCCC1	758762900	GLJQEDBLEGBLLV-OAHLLOKOSA-N	448.524	1.824	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2noc(-c3cccc(OC)c3)n2)c2ccccc2c1=O	760195453	SQTXZVMRWBMVGA-UHFFFAOYSA-N	448.439	1.940	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@@H](CCC(N)=O)C(=O)NNc2c(C)cccc2F)cc1C	760515681	AKLRYFMJUUPSGY-KRWDZBQOSA-N	436.509	1.807	50	20	IDGD	
O=C(COC(=O)c1cc(C(F)(F)F)ccc1F)NNC(=O)[C@@H]1COc2ccccc2O1	761259114	FJRWSRWTXUIQKZ-HNNXBMFYSA-N	442.321	1.989	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)c1ccc(C)c(S(=O)(=O)NCC#N)c1	762408191	INORNMUUKJHGSZ-UHFFFAOYSA-N	448.526	1.359	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)CCCN(C)C2=NS(=O)(=O)c3ccccc32)n1	762895600	TWYCETVZFFNVKO-UHFFFAOYSA-N	445.549	1.627	50	20	IDGD	
CCC(=O)Nc1ccc(S(=O)(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)cc1	763439966	ZFQRWJBUQXAPIP-UHFFFAOYSA-N	428.511	1.650	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cccc1N1CCOC1=O	763471991	PGZWYCZZMHCWKV-UHFFFAOYSA-N	427.373	1.260	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)NNC(=O)Cn1ccc2ccccc21	763501329	ICADFTOWMCJFKW-UHFFFAOYSA-N	432.481	1.308	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccccc2-n2cccn2)cc(OC)c1OC	763540381	ULASEUCFBPLBJC-UHFFFAOYSA-N	439.428	1.298	50	20	IDGD	
NC(=O)c1ccc(F)c(NC(=O)C(=O)NNC(=O)COc2cccc(C(F)(F)F)c2)c1	763638637	DXGKHLFAKOYDDZ-UHFFFAOYSA-N	442.325	1.108	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccccc2C(=O)N2CCCCC2)cc1	763674900	QERAFABQANPIPG-UHFFFAOYSA-N	449.467	1.349	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)C(=O)Nc1cccc(CCN2CCCC2)c1	763680861	BWWUFMAAIYXDRC-UHFFFAOYSA-N	428.464	1.629	50	20	IDGD	
CN(C)c1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)CN1CCCc2ccccc21	763733821	HTDWQBUKDIEAAW-UHFFFAOYSA-N	429.908	1.945	50	20	IDGD	
COc1ccc(Cn2nccc2NC(=O)C(=O)NNC(=O)c2cccc(Cl)c2)cc1	763750677	RARZQWMTZIOZGL-UHFFFAOYSA-N	427.848	1.993	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)C(=O)Nc2cccc(COCC3CC3)c2)c2ccccc2c1=O	763790186	GKCQYKNRJZRBCM-UHFFFAOYSA-N	449.467	1.260	50	20	IDGD	
Cc1nn(-c2ccccc2)c2sc(C(=O)NNC(=O)CNC(=O)c3cccnc3)cc12	763820012	JFUVOIOHJNIHHU-UHFFFAOYSA-N	434.481	1.981	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(NC(=O)C3CC3)nc2)c1C	763848459	IBYMOFHKXPKHEB-AWEZNQCLSA-N	439.472	1.600	50	20	IDGD	
CCn1nc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(C(C)=O)cc2)cc1C1CC1	763871998	IPUHJTFQOYAJGU-CYBMUJFWSA-N	427.461	1.536	50	20	IDGD	
COC(=O)[C@@H](C)Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)cc1	763872271	MANDZUYYIDTCHB-KBPBESRZSA-N	445.447	1.731	50	20	IDGD	
CS(=O)(=O)c1ccc(F)c(NC(=O)C(=O)NNC(=O)Cc2ccc(Cl)cc2)c1	763932535	QOWWNXINQAKYKP-UHFFFAOYSA-N	427.841	1.211	50	20	IDGD	
O=C(NNC(=O)c1cc(Cl)ccc1O)C(=O)Nc1ccc(=O)n(Cc2ccccc2)c1	763978348	JAACGCIOMQAECN-UHFFFAOYSA-N	440.843	1.655	50	20	IDGD	
CON(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)CSc2ccccc2O)c1	764045972	WCINSPDLDGQMMN-UHFFFAOYSA-N	425.488	1.127	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)c2cc(C)[nH]n2)sc2c1CC[C@H](C)C2	764098031	IZNHRWOWZHFKHW-VIFPVBQESA-N	433.490	1.481	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)cc1	764126571	IVQALLACAWVBFC-UHFFFAOYSA-N	438.484	1.650	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)CCc2ccco2)cc(OC)c1Br	764178091	WKNPYUHYVGXDRB-UHFFFAOYSA-N	440.250	1.778	50	20	IDGD	
CN1CCC[C@H](N(C)C(=O)c2ccc(NC(=O)C(=O)NNC(=O)CC3CCCC3)cc2)C1	764187109	BXSKZEVCMNTFBM-IBGZPJMESA-N	443.548	1.519	50	20	IDGD	
COc1cc(F)c(NC(=O)C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)cc1F	764202267	AVOTXLRZOJUOPE-UHFFFAOYSA-N	430.408	1.364	50	20	IDGD	
Cc1ccnn1-c1ccccc1NC(=O)C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C	764202322	CBHBXOWJEZPWSM-UHFFFAOYSA-N	444.492	1.572	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)C(=O)Nc1cc(Cl)ccc1N1CCSCC1	764268736	PKXCVTCZPZFGSN-UHFFFAOYSA-N	433.921	1.617	50	20	IDGD	
CCOCC(=O)NNC(=O)C(=O)Nc1sc2c(c1C(=O)OC(C)C)CC[C@@H](C)C2	764317087	INSDMGCIGPVSKA-LLVKDONJSA-N	425.507	1.561	50	20	IDGD	
Cc1cc(N2CCOCC2)ccc1NC(=O)C(=O)NNC(=O)c1cnn(-c2ccccc2)c1	764350995	NMWFAOCGYJJFJR-UHFFFAOYSA-N	448.483	1.417	50	20	IDGD	
COC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3OC)[nH]n2)c1	764376255	ABKQTAHANIQAKC-UHFFFAOYSA-N	437.412	1.272	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc(F)c(C)c3)n[nH]2)cc1OC	764378052	IDVJVPHICNEHSG-UHFFFAOYSA-N	441.419	1.941	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)cc1S(C)(=O)=O	764380309	VDUZRFJALGHZGQ-UHFFFAOYSA-N	441.412	1.156	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)C(=O)Nc1cc(Br)cnc1-n1cccn1	764389237	NUHNBSNYPRZGPL-UHFFFAOYSA-N	444.249	1.133	50	20	IDGD	
CCn1c(NNC(=O)[C@H](C)NS(=O)(=O)c2ccc(C#N)cc2)nc2ccccc2c1=O	764717523	QVLYNLKZNXDHSF-ZDUSSCGKSA-N	440.485	1.098	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)c3cnn(-c4ccc(O)nn4)c3C)n[nH]2)cc1C	765558828	IQHUFYPNGSTXDJ-UHFFFAOYSA-N	432.444	1.758	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)[C@@H]2CC(=O)N(Cc3ccccn3)C2)n[nH]1	768276938	NVOUTCSBCIUTJE-CQSZACIVSA-N	434.456	1.290	50	20	IDGD	
Cc1nc2ccc(C(=O)NNC(=O)c3ccc(Cl)c(S(N)(=O)=O)c3)cc2nc1C	769252248	HHSBFVLXVCSVHW-UHFFFAOYSA-N	433.877	1.622	50	20	IDGD	
CCCCCCn1cc(S(=O)(=O)NNC(=O)c2c(C)nc3ccccn23)c(O)nc1=O	769621246	LYKCTQKAIPHEHP-UHFFFAOYSA-N	448.505	1.109	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)NCCN3C(=O)c4ccccc4C3=O)nc21	770352773	ATZOPMFSFYIIIQ-UHFFFAOYSA-N	438.448	1.209	50	20	IDGD	
Cc1cccc(S(=O)(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1Br	771898034	NJLSKCFLVWDWFD-CYBMUJFWSA-N	427.276	1.907	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)[C@@H]1CCCN1Cc1ccc(F)cc1	772904450	HUGVCBPMJJFASK-SFHVURJKSA-N	432.883	1.907	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)c1ccc(CCNS(C)(=O)=O)s1	772955134	PWPJYVUQPZGSPI-LLVKDONJSA-N	445.950	1.722	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)CCn1nc(O)c2ccccc2c1=O	772997416	UVUMPCFAAAKLDQ-LBPRGKRZSA-N	430.848	1.761	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NN=C1CCO[C@@H](C)C1)N(S(C)(=O)=O)CC2	773189538	HWIJPVGSXBGVSJ-GUYCJALGSA-N	439.534	1.624	50	20	IDGD	
CCCNC(=O)[C@H]1CN(C(=O)C(=O)NNc2ccc3ccccc3n2)c2ccccc2O1	773661966	NEQUILZOGZLUPB-LJQANCHMSA-N	433.468	1.998	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)NCCc2ccc(OCC(F)(F)F)nc2)cc1	776243070	CEVZYJUQGDJROO-UHFFFAOYSA-N	437.378	1.846	50	20	IDGD	
CCO[C@@H]1C[C@@H](NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)[C@@H]1Oc1ccccc1	776472927	LPFISYATHUNHSQ-QRVBRYPASA-N	437.460	1.231	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)CN2C(=O)Cn3c(cc4ccccc43)C2=O)c1	776538797	KRNDPTFYVNSBAL-UHFFFAOYSA-N	426.454	1.171	50	20	IDGD	
CCn1cc(-c2nn(C)cc2C(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)cn1	778574520	OTOOSZVWBZVCMY-UHFFFAOYSA-N	430.852	1.575	50	20	IDGD	
O=C(CN1CCC(n2ccc(C(F)(F)F)n2)CC1)NNC(=O)c1ccc([N+](=O)[O-])cc1	778969657	QCQGYSRHGRPXML-UHFFFAOYSA-N	440.382	1.908	50	20	IDGD	
Cc1cnn(-c2c(C(=O)NNc3nc(Br)cn4ccnc34)c(C)nn2C)c1	779386205	XBFCKQIDEIOVMT-UHFFFAOYSA-N	430.270	1.785	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)[C@@H]2C[C@@]23CCN(C(=O)OC(C)(C)C)C3)nc2ccccc21	780171910	UNLLLISMIBENAR-RCDICMHDSA-N	427.505	1.910	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@]2(C[C@H]2C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)C1	781280861	JDTBULCJOLKYLZ-AOMKIAJQSA-N	442.472	1.510	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)Cc2ccc3ccccc3c2)c(OC)c1	782118207	WHISEVNNQAYFQQ-UHFFFAOYSA-N	435.436	1.964	50	20	IDGD	
O=C(CCN1CCOCC1)Nc1cc(NC(=O)C(=O)NNc2ccccc2F)ccc1F	782705585	HEDHYCPPXMXUIK-UHFFFAOYSA-N	447.442	1.707	50	20	IDGD	
CCN1CCN(c2ccc(Cl)cc2NC(=O)C(=O)NNc2cc(C)nc(C)n2)CC1	783325146	UPIOLOIWBAYVAO-UHFFFAOYSA-N	431.928	1.971	50	20	IDGD	
Cc1ccc(C)c(NNC(=O)C(=O)Nc2ccccc2OCC(=O)N2CCOCC2)c1	783369665	VGMSZXNLFWXIBO-UHFFFAOYSA-N	426.473	1.623	50	20	IDGD	
CC(C)OC(=O)NCc1ccc(NC(=O)C(=O)NNc2ccc(-n3cccn3)nn2)cc1	783437284	WMOVFIFKFNSEOY-UHFFFAOYSA-N	438.448	1.379	50	20	IDGD	
COCCOc1cccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)c1	784214466	YABHYINILMQEOB-UHFFFAOYSA-N	448.501	1.234	50	20	IDGD	
O=C(NNc1ccc(F)c(F)c1F)C(=O)Nc1cccc(S(=O)(=O)NC2CC2)c1	784811974	VTWBJDXIQCBABS-UHFFFAOYSA-N	428.392	1.626	50	20	IDGD	
O=C(NNc1ccc(C(F)(F)F)nn1)C(=O)Nc1cc2c(cc1[N+](=O)[O-])OCCCO2	784886633	WGYQPCTVNHQXOC-UHFFFAOYSA-N	442.310	1.647	50	20	IDGD	
CCNC(=O)N(C)NC(=O)C(=O)Nc1cc(OC)c(NC(=O)c2ccccc2)cc1OC	784916808	WJWARLCENYCGLG-UHFFFAOYSA-N	443.460	1.587	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)OCc2nc3c(=O)n(C)c(=O)n(C)c3[nH]2)c(C)n1CC(C)C	785035317	LBQCEHBETCZCKV-LZYBPNLTSA-N	438.488	1.685	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)C(=O)Nc1ccc(-n2cccn2)c(Cl)c1	785066563	DRFRRZRRTBLHHE-UHFFFAOYSA-N	437.847	1.502	50	20	IDGD	
CCCCn1c(C)cc(/C=C(\C#N)C(=O)OCc2nc3c(=O)n(C)c(=O)n(C)c3[nH]2)c1C	785101859	FSVLOSHDNGWXOZ-MHWRWJLKSA-N	438.488	1.829	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2ccccc2N(C)S(C)(=O)=O)cc1Cl	785116196	BSVAZTQMYYQTOJ-UHFFFAOYSA-N	426.882	1.826	50	20	IDGD	
CNS(=O)(=O)c1ccc2c(c1)N(C(=O)C(=O)NNc1ccc(OC)c(Cl)c1)CC2	785120255	OLLTVIWELYBIFP-UHFFFAOYSA-N	438.893	1.289	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(C(=O)[C@@H](C)OC(=O)/C(C#N)=C/C3CC3)CC2)cc1	786677383	HIKIXHMWQQPEOT-APVMCDBPSA-N	431.514	1.620	50	20	IDGD	
CCOc1ccc(C(=O)NCC(=O)NNc2ccccc2S(N)(=O)=O)cc1OCC	788230116	HCBXGYLTANQSPY-UHFFFAOYSA-N	436.490	1.005	50	20	IDGD	
Cn1nc([C@@H]2CCCOC2)cc1NC(=O)C(=O)NNC(=O)c1cccc(C(F)(F)F)c1	790951891	MKQCAFNZOOYIBV-GFCCVEGCSA-N	439.394	1.733	50	20	IDGD	
O=C(NNc1cccc(F)c1[N+](=O)[O-])C(=O)Nc1ccc(CC(=O)N2CCOCC2)cc1	790999888	ZBTRXLONROETEF-UHFFFAOYSA-N	445.407	1.217	50	20	IDGD	
COc1cc(C(F)(F)F)ncc1NC(=O)C(=O)NNC(=O)COc1cccc(C)c1	792269513	ZTOBOLBUWNEXED-UHFFFAOYSA-N	426.351	1.582	50	20	IDGD	
O=C(NNc1nc2ccccn2n1)C(=O)Nc1ccc(=O)n(Cc2ccccc2Cl)c1	792395506	ZUONQXNMCSTEBA-UHFFFAOYSA-N	437.847	1.675	50	20	IDGD	
O=C(c1nc(Br)cs1)N1CCN(S(=O)(=O)CBr)CC1	792420025	WGNNOPYBIWWJFY-UHFFFAOYSA-N	433.147	1.346	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)c1cccc(NN2C(=O)[C@H]3CC=CC[C@@H]3C2=O)c1	792790646	ZSYBXRHUOZQQGL-IRXDYDNUSA-N	448.435	1.768	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)[C@@]12CCC(=O)N1c1ccccc1C(=O)N2C1CC1	792798865	QOPIFHBJOLKLGW-XMMPIXPASA-N	448.479	1.527	50	20	IDGD	
O=C(COC(=O)[C@@H]1CCS(=O)(=O)c2ccccc21)NNC(=O)c1ccc(Cl)cc1	792816047	DPMSIPCRIFRHNW-OAHLLOKOSA-N	436.873	1.605	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCCN(C(=O)NNC(=O)c3cccc(C)n3)CC2)cc1	793224549	DGTZFJGGGULASN-UHFFFAOYSA-N	447.517	1.150	50	20	IDGD	
C[C@@H]1CCC(=NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)[C@@H](n2cncn2)C1	794453049	IDQQODVGVBJZDR-BEFAXECRSA-N	446.533	1.446	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNC(=O)Nc1cc(C(F)(F)F)cnc1O	797617772	QOWIJYSRMFRZSB-UHFFFAOYSA-N	427.339	1.885	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2ccc3c(c2)OCO3)nnn1CCOc1ccc(F)cc1	800314611	QBTAONGOLSNIBB-UHFFFAOYSA-N	427.392	1.608	50	20	IDGD	
COc1cnc2ccccc2c1C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	801900270	JWXMKPRJPGBWLB-SFHVURJKSA-N	437.408	1.388	50	20	IDGD	
O=C(N=c1cc[nH]cc1)NNC(=O)c1cc(S(=O)(=O)N2CCCCC2)ccc1Cl	802029810	VMUWUWUJWSRJAW-UHFFFAOYSA-N	437.909	1.798	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)N[C@@H]2CCCN(C(=O)Cc3ccccc3)C2)cc1	802475111	ADIPJRSZKZMRCL-LJQANCHMSA-N	435.484	1.501	50	20	IDGD	
CCCN(NC(=O)Cc1c(C)nn(-c2cncc3nnnn23)c1C)C(=O)OC(C)(C)C	804595866	NDNKMOCOASIRED-UHFFFAOYSA-N	429.485	1.543	50	20	IDGD	
COc1ccc(CS(C)(=O)=O)cc1NC(=O)NNC(=O)c1nnc(O)c2ccccc12	806637081	XDJXPZLRSIMIDX-UHFFFAOYSA-N	445.457	1.355	50	20	IDGD	
Cc1cccc(F)c1NNC(=O)C(=O)N1C[C@H](C[C@@H]2COCC(=O)N2)c2ccccc21	806982711	CXLOBXWSHCRSIC-LSDHHAIUSA-N	426.448	1.613	50	20	IDGD	
O=C1COC[C@H](C[C@@H]2CN(C(=O)C(=O)NNc3ccc([N+](=O)[O-])cc3)c3ccccc32)N1	806984537	LWHXHCWLHRABCW-HIFRSBDPSA-N	439.428	1.073	50	20	IDGD	
NS(=O)(=O)c1ccc(C=NNC(=O)C(=O)NCc2ccc(Cl)cc2)cc1Cl	807979662	CWBFRWPUWRMIRZ-UHFFFAOYSA-N	429.285	1.407	50	20	IDGD	
CSc1ccc(-c2nsc(NC(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)n2)cc1	809932458	YJCDMRRGYSOICX-SNVBAGLBSA-N	427.533	1.514	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)Cc1sc(N2CCOCC2)nc1-c1ccccc1	811239484	NLMZOPLXPYEAOK-CQSZACIVSA-N	446.529	1.678	50	20	IDGD	
CC[C@H]1[C@H](C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)CCN1C(=O)OC(C)(C)C	811300376	GBDHKAFRJSHGJL-SJORKVTESA-N	444.488	1.898	50	20	IDGD	
COc1cnc(C(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)nc1	814723975	FVPYCELYNUTSQU-UHFFFAOYSA-N	430.424	1.318	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NN=C(C)Cn1cccn1)N(S(C)(=O)=O)CC2	814759229	WBLZKRBYRJULOD-KRWDZBQOSA-N	449.533	1.342	50	20	IDGD	
COC(=O)N1CCN(c2ccc(NC(=O)C(=O)NNc3cccc(F)c3F)cn2)CC1	815606325	UGAXDOLEBSPFGH-UHFFFAOYSA-N	434.403	1.330	50	20	IDGD	
Cc1ccc([C@]2(C)NC(=O)N(CC(=O)NNC(=O)COc3cc(C)ccc3C)C2=O)cc1	864002247	VBEXEVRIDLSLMK-QHCPKHFHSA-N	438.484	1.605	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1ccc(-n2cnnn2)c(C)c1	914914399	TWQCXBONIIUZOD-UHFFFAOYSA-N	444.835	1.251	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)Cc2ccc(-n3cnnn3)cc2)cc1	915065139	PVEWWWVQUDIGJO-UHFFFAOYSA-N	449.500	1.087	50	20	IDGD	
O=C(NCC(F)(F)F)c1ccc(S(=O)(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1	916104606	KVEMXILQFRTLMO-UHFFFAOYSA-N	446.363	1.510	50	20	IDGD	
O=C(O)CNC(=O)c1ccc(S(=O)(=O)NNC(=O)c2ccc(Cl)cc2Cl)cc1	916106830	CRSFEVIDQWUSFA-UHFFFAOYSA-N	446.268	1.431	50	20	IDGD	
C[C@H]1CN(c2ccc(CNC(=O)NNC(=O)COc3ccccc3[N+](=O)[O-])cn2)CCO1	916392705	ISCUOQUGXDANJN-AWEZNQCLSA-N	444.448	1.124	50	20	IDGD	
CN1CCN(C(=O)CCNC(=O)NNC(=O)COc2ccccc2-c2ccccc2)CC1	916433138	ATHUENFUJRQLBU-UHFFFAOYSA-N	439.516	1.227	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)NCCC(=O)N2CCN(C)CC2)c(C)n1-c1ccccc1	916433224	HPUYHNBYKBYPAX-UHFFFAOYSA-N	426.521	1.202	50	20	IDGD	
CCOC(=O)N[C@H](CNC(=O)NNC(=O)c1nn(CC)c(=O)c2ccccc12)CC(C)C	916630621	HNAYAOYGXQHTSX-AWEZNQCLSA-N	446.508	1.521	50	20	IDGD	
CC(=O)N1CCN(c2ccc(C(=O)NNC(=O)c3ccc(Cl)nc3)cc2[N+](=O)[O-])CC1	917251298	WTADNANROBNWQS-UHFFFAOYSA-N	446.851	1.387	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)N1CCN(C2=NS(=O)(=O)c3ccccc32)CC1	918002698	UCYMIGSJNXXYLJ-UHFFFAOYSA-N	427.486	1.116	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)NC1CCN(Cc2ccncc2)CC1	918014376	WCUBWWUWNLMJCQ-UHFFFAOYSA-N	435.488	1.582	50	20	IDGD	
O=C(NCc1nn(-c2ccccc2)c2c1CCC2)NNC(=O)c1ccc(-n2cnnn2)cc1	918235530	RXKOXWRUNIHJFR-UHFFFAOYSA-N	443.471	1.481	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)NC[C@]2(N3CCOCC3)CCSC2)c1C	919980815	RKQOYECKNNVTOG-WVWKGNOCSA-N	432.590	1.982	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NC2CCN(C(=O)OC)CC2)c2ccccc2c1=O	920051704	SYTBMFPMHGLQRY-UHFFFAOYSA-N	444.492	1.371	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)Nc2ccc3c(c2)C(=O)NC3=O)c2ccccc2c1=O	920930641	SWVYACBPFKPBGV-UHFFFAOYSA-N	434.412	1.328	50	20	IDGD	
COc1ccc(OC)c(CC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1	921188450	FINXABPHLXWPCP-UHFFFAOYSA-N	447.513	1.492	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)[C@@H](C)OC[C@H]1CCCCO1	921225875	KXGSJZCGVYHQSP-TZMCWYRMSA-N	428.869	1.627	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNS(=O)(=O)c1c(F)cccc1Br	1116263510	OPSMCYUYRXCMIV-UHFFFAOYSA-N	436.284	1.389	50	20	IDGD	
CC(=O)N(c1ccc(F)cc1)c1nc(C=NNC(=O)N[C@H]2CCS(=O)(=O)C2)cs1	1337811658	JUGDSBQWROYWKK-ZDUSSCGKSA-N	439.494	1.787	50	20	IDGD	
Cc1cn2c(=O)c(C(=O)N3CC[C@]4(C3)CN(C(=O)[C@H](F)Cl)CCO4)cnc2s1	1777991617	WMDJGWHZFQVYPS-SJCJKPOMSA-N	428.873	1.042	50	20	IDGD	
C[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Cl)C1	1778030725	ZHUQNNBMYRNILD-QGDIXAPHSA-N	435.924	1.948	50	20	IDGD	
Cn1ncc2cc(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)[C@@H](O)CCl)C4)ccc21	1778703948	NCTXDEYQIKDWSD-WAOWUJCRSA-N	434.924	1.301	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(COC)c[nH]3)C2)C1	1780079152	NACQAIUIEVCELT-KBXCAEBGSA-N	428.327	1.778	50	20	IDGD	
C=C(CC(=O)OCC)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](Cl)COC)C2	1780741061	JODMYLWCPZORRX-RZQQEMMASA-N	430.929	1.264	50	20	IDGD	
COc1cc(F)ccc1C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781333895	HLXXFZTYIWIARH-PBHICJAKSA-N	433.249	1.968	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1nnc(C)o1)C2	1781900827	TVGDWWIDCLNGQS-PMUMKWKESA-N	443.342	1.608	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(NC(C)=O)o1)C2	1782175362	JCAWCBSVTRENLJ-YYFZDKIDSA-N	441.912	1.619	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCCCCC(=O)OC)C2	1782179796	MUBJZALGPCZQQV-CSODHUTKSA-N	446.972	1.878	50	20	IDGD	
O=C(c1ccc2c(Cl)ccnc2c1)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1782201448	ADRNLRNELSEQGS-YLJYHZDGSA-N	438.311	1.931	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@@]2(C1)CN(C(=O)c1cc(O)no1)CCO2	1782867521	PJTSEEPJXYNIDC-NPZXAABXSA-N	444.394	1.709	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)Cc3ccc4c(c3)OCO4)CCO2)C1	1783532574	KOZSDVNBVDSJAA-BFUOFWGJSA-N	439.306	1.571	50	20	IDGD	
Cc1ccc(OCC(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](C)Br)C3)C2)cc1	1783533113	QUJKHPWOAOZUQT-KXBFYZLASA-N	425.323	1.987	50	20	IDGD	
C[C@H](NNc1ccccc1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CO[Si](C)(C)C)C[C@@H]21	1783553034	AOJSQTASPPHPTN-ZULIPRJHSA-N	448.640	1.823	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CC3CCN(C)CC3)[C@H]2C1	1783650229	FCKPOHGHPOLSCP-DKIMLUQUSA-N	444.414	1.729	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@H](C(=O)N2CC[C@@]3(CN(C(=O)CCBr)CCO3)C2)C1	1783856282	IQJFKUIPNWQSDF-QMTMVMCOSA-N	445.354	1.581	50	20	IDGD	
CC(C)Oc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]3C2)c(F)c1	1784091870	BGMZNUGNLXSCDW-FDARSICLSA-N	442.915	1.806	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)CCCn3ccnc3C)C2)C1	1784411940	MIAZYSVNYAOOEA-APWZRJJASA-N	441.370	1.975	50	20	IDGD	
CC(=O)Nc1ccccc1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1785100933	AMGGIZDZKDBUQG-YJBOKZPZSA-N	442.285	1.779	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)c1scnc1C(F)(F)F	1786265638	NRTQMPMHKHUVRK-NAKRPEOUSA-N	441.859	1.355	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)c1c[nH]c2nccc-2c1	1787331326	XJGVPEKNTKOULL-CYUUQNCZSA-N	439.285	1.798	50	20	IDGD	
Cn1ncc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]3C2)c1C(F)(F)F	1787444406	ZPGVONLMIRHMQH-DJFWLOJKSA-N	426.798	1.567	50	20	IDGD	
CCOC(=O)O[C@@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]2C1	1789871611	FWGUMQLNRGCCMJ-PLGIXQIDSA-N	439.336	1.764	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4cccn4cn3)C[C@@H]21)[C@H](F)Br	1789926448	YFWPZEDVNPOKAL-MZGVZZPPSA-N	439.285	1.618	50	20	IDGD	
COc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Cl)C[C@@H]32)c(O)c1OC	1790161314	AKTDTNKYAHSLPI-WKTARRMCSA-N	430.860	1.537	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)COc3ccc(F)cc3)C[C@@H]21	1791057439	DCCRFIGYGFUYSM-OQUILHJVSA-N	443.313	1.968	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4c[nH]nc4c3)C[C@@H]21	1791058146	ZSLINUIVGRYSAG-ZUFFMMDNSA-N	435.322	1.940	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)Cc3ccccc3)C[C@@H]21	1791063591	MFHDHKCRQVRCNX-QSGXVVIFSA-N	439.350	1.353	50	20	IDGD	
COc1cc(C#N)cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]3C2)c1	1791296775	ZWHQOPUAKIOSIX-RCBQFDQVSA-N	426.300	1.964	50	20	IDGD	
CSCC[C@H](O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)CBr)C[C@@H]21	1791303994	RDHQRJJKLNMJKM-QTVXIADOSA-N	437.400	1.111	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1ccc(C2(NC(=O)[C@@H](O)N3CCOCC3)CCC2)cc1	1791435055	PPUOXFDEERNRNY-FZKQIMNGSA-N	440.338	1.555	50	20	IDGD	
CC(C)(C)OC(=O)NC1(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Cl)C[C@@H]32)CC1	1792336991	ADIOUZMEDIRKNY-XDQVBPFNSA-N	433.908	1.558	50	20	IDGD	
CN(CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/C1CC1)NC(=O)NCc1ccccc1	1793158496	MCPWFLSRTJCHRA-SKHSGBRBSA-N	439.560	1.937	50	20	IDGD	
Cc1cccnc1CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2	1793994294	QNIQCHCJDVYLHY-RMHZUWNSSA-N	428.302	1.603	50	20	IDGD	
O=C(CCc1ccc(C(F)(F)F)cn1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2	1794097070	XXMBSKKTMRMZAO-DJZPMSPPSA-N	449.857	1.222	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)c1cc(F)cnc1Cl	1796191948	UJPOFCOEKNLKTH-MUJYYYPQSA-N	431.660	1.120	50	20	IDGD	
COc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Cl)c(F)c(OC)c1F	1796366759	CLHPIAIMHGCQDQ-HDZCRHJISA-N	436.814	1.720	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc[nH]c2nccc1-2	1796645825	LSVUWVFYBWETRS-BTTYYORXSA-N	433.472	1.079	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnn2ccncc12	1797061545	LFYDDQGTPMEODK-ABXQLRGKSA-N	426.304	1.169	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCc1ccc(F)cc1)C2	1798443052	OYDKOBRNKNKJLX-BCDXTJNWSA-N	439.491	1.709	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCCCCC(=O)OC)C2	1800644043	FRFYNQFCLBHGKY-KRXQYRFLSA-N	447.370	1.873	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1(c3ccccc3F)CC1)C2	1802344250	STHXXTDVUMSTSB-BJWYYQGGSA-N	430.524	1.869	50	20	IDGD	
C=C1CC(C(=O)NC[C@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)C1	1802414400	ORUCXGKKDHQMPL-OXQOHEQNSA-N	434.500	1.366	50	20	IDGD	
N[C@H](CC(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]1c1cccnc1)c1cccnc1	1803139380	XRIKOORMKHUOSS-SOAMZJECSA-N	431.924	1.172	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@@H]1c1cccnc1)c1csnn1	1803753070	IFQFKDLLDKIMAP-UHTWSYAYSA-N	428.287	1.943	50	20	IDGD	
Cc1csc(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)c1	1803770633	KOHAKORTWFDHIX-GHTZIAJQSA-N	449.341	1.765	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC2(CCCN(C(=O)CCc3ccc(F)nc3)C2)CC1	1806961093	QWPGPIHSDMLPGR-UHFFFAOYSA-N	447.555	1.758	50	20	IDGD	
C#CCO[C@H](C)C(=O)N1CC[C@H](CNC(=O)[C@@H](F)Br)[C@H]1c1cccnc1	1808649814	XYRQWBVEXGQASW-DTZQCDIJSA-N	426.286	1.816	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)c3sccc3F)CC2)C1	1809978026	UMZVKCZUFNOQAK-UHFFFAOYSA-N	430.310	1.726	50	20	IDGD	
CC(C)=NO[C@H](C)C(=O)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1	1809980799	UPGBYCDYFVHIJW-QGZVFWFLSA-N	429.326	1.012	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)[C@H](C)Cn2cncn2)[C@@H]1c1cccnc1	1810479870	HQUZIUZCEHRENY-BGTYHANMSA-N	434.928	1.269	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC2(CCCN(C(=O)c3cnc(O)nc3O)C2)CC1	1810861093	IMNLIWWZWFKAIK-LBPRGKRZSA-N	441.326	1.764	50	20	IDGD	
NC(=O)c1nccnc1C(=O)NC[C@@H]1CCN(C(=O)C(Cl)Cl)[C@H]1c1cccnc1	1811188825	MWUGCQAXYRBLFM-FZMZJTMJSA-N	437.287	1.094	50	20	IDGD	
CC[C@@H](NC(C)=O)C(=O)N1CC[C@H](CNC(=O)[C@H](C)Br)[C@@H]1c1cccnc1	1812864547	WBLWXELPJCVNQA-DXEWXGHRSA-N	439.354	1.786	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)Cc2cc(C)n(C)n2)[C@@H]1c1cccnc1	1813028590	PUZOWMBAZFTZDT-IMFGXOCKSA-N	433.940	1.626	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CSc2nc[nH]n2)[C@H]1c1cccnc1)C(Cl)Cl	1813081880	FGEVREHSFVTQGJ-AAEUAGOBSA-N	429.333	1.802	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)Cc2c(C)nn(C)c2C)[C@H]1c1cccnc1	1813421933	SVCBFMYZTITXIE-SLYNCCJLSA-N	447.967	1.934	50	20	IDGD	
O=C1CC[C@H](C(=O)Nc2cc([C@@H]3CCCCN3C(=O)[C@@H](F)Br)[nH]n2)CN1	1814524132	BSSJRMIVRFSIAU-NURSFMCSSA-N	430.278	1.619	50	20	IDGD	
C[C@H](CBr)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H]2CCNC(=O)C2)[nH]n1	1814783692	SXJJIUUTNRPAOP-YRGRVCCFSA-N	440.342	1.959	50	20	IDGD	
C[C@H](CS(C)(=O)=O)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CO[Si](C)(C)C)[nH]n1	1815229395	GZDDNUSDVRCETH-UKRRQHHQSA-N	444.630	1.934	50	20	IDGD	
CC1(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)CCCC1	1815347935	YCKARZNGTNHYLL-OAHLLOKOSA-N	427.335	1.629	50	20	IDGD	
C[C@@H](C(=O)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1)c1ccccc1	1815363959	CSTMDZFHTGNBFY-KDOFPFPSSA-N	449.341	1.852	50	20	IDGD	
Cn1ncc2c(C(=O)Nc3nc4c(s3)C[C@H](NC(=O)[C@@H](O)CCl)CC4)cccc21	1818552879	IYDLDTPMACFJLA-BMIGLBTASA-N	433.921	1.855	50	20	IDGD	
O=C1Cc2cc(C(=O)Nc3nc4c(s3)C[C@H](NC(=O)[C@@H](O)CCl)CC4)ccc2N1	1818918766	DPUGVLXWAIZDGH-RISCZKNCSA-N	434.905	1.463	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2n[nH]cc2[N+](=O)[O-])n[nH]1	1819659744	BEKSNOHYLMDROG-GXSJLCMTSA-N	425.833	1.601	50	20	IDGD	
C=CC[C@@H](C)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1	1819799416	BUIDYLLLFSWMFU-VXGBXAGGSA-N	428.518	1.580	50	20	IDGD	
CC/C=C(\C)C(=O)N[C@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1	1819801350	IUMLRVKHXZPTBG-QNCMIEPLSA-N	428.518	1.724	50	20	IDGD	
O=C1Cc2cccc(C(=O)Nc3cc([C@@H]4CCCCN4C(=O)[C@@H](O)CCl)[nH]n3)c2N1	1821512765	IJQSVAOIFJQBDJ-GJZGRUSLSA-N	431.880	1.810	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)C(C)(C)CCl)CC2	1826082819	DDVCFLFKIXKSFP-LLVKDONJSA-N	429.974	1.693	50	20	IDGD	
CCc1cc(C(=O)N[C@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)n(C)n1	1826088579	YOHVGXSAHUTPMS-ZDUSSCGKSA-N	447.565	1.038	50	20	IDGD	
O=C(CCc1ccc[nH]1)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827053036	UAKSVVHFWOHFHJ-JOCHJYFZSA-N	437.349	1.561	50	20	IDGD	
C[C@H](NC(=O)c1cnccn1)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](F)Cl)CC1	1827608949	MRCQKVPTHDWFTC-RRQGHBQHSA-N	439.919	1.749	50	20	IDGD	
C[C@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H](O)CCl)CC1)[C@H]1SC(=N)NC1=O	1827665618	ZARDIDKTFJLHSQ-PMOUVXMZSA-N	444.985	1.008	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccncn2)CC1	1827745841	LFJREWSMUDMLGV-IBGZPJMESA-N	437.504	1.022	50	20	IDGD	
Cc1onc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)c1C	1830535563	QEYHSXBOUQGOML-KZULUSFZSA-N	444.326	1.392	50	20	IDGD	
C=C(C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)CBr)CCO2)C(F)(F)F	1830544502	ZTLPUMOVZWECMN-IAQYHMDHSA-N	443.260	1.592	50	20	IDGD	
O=C(CCBr)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2CCCS2(=O)=O)CC1	1831280923	DGJJZMMNFFWXGE-HOTGVXAUSA-N	449.411	1.968	50	20	IDGD	
O=C(C(Cl)Cl)N1CCC([C@H]2CCCCN2C(=O)[C@H]2CCCS2(=O)=O)CC1	1831286488	XPWCLCVYYDZLCB-ZIAGYGMSSA-N	425.378	1.987	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CC(OCC)OCC)C2)C1	1831656556	GNCPWNVUKMGGCS-OXQOHEQNSA-N	434.961	1.640	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)C(C)(C)NCCC#N)CC1	1831871809	XILKHTZGZNJQEH-LJQANCHMSA-N	448.612	1.261	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3cccs3)CCO2)C1	1833160760	ZHDHHXBSRKMSST-KSSFIOAISA-N	445.379	1.921	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3ccc4ncoc4c3)CC2)CC1)[C@@H](O)CCl	1833310124	JOBLFVGLBVRHHD-SFHVURJKSA-N	434.924	1.613	50	20	IDGD	
O=C(c1coc(Cl)n1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1833557110	DKRHJHAAWBVHJX-QMTHXVAHSA-N	440.653	1.089	50	20	IDGD	
Cc1cnc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCBr)CCO3)C2)s1	1834819450	SBEWVWHOMOWQDP-MRXNPFEDSA-N	432.340	1.307	50	20	IDGD	
Cc1cccc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCBr)CCO3)C2)n1	1834819753	ZUKLCXNXWGCKOO-GOSISDBHSA-N	426.311	1.245	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3nc4ncccn4n3)CC2)CC1	1835353057	UHMWXNMHCWFKFA-MRXNPFEDSA-N	433.944	1.327	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cc4cn[nH]c4cn3)CC2)CC1	1835643349	RUIUDSRHPSMMJG-KRWDZBQOSA-N	448.955	1.397	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC1CCN(C2CCN(C(=O)c3ccc(O)nn3)CC2)CC1	1835834973	JSDMADKSGZQCPY-UHFFFAOYSA-N	435.601	1.219	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC(OC2CCN(C(=O)Cn3cncn3)CC2)CC1	1836670456	FSEQNLYTXOQBNF-CQSZACIVSA-N	442.358	1.308	50	20	IDGD	
C[C@H](Cn1cccn1)C(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836715735	YLZGKDBMOZVPIY-CRAIPNDOSA-N	426.945	1.118	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1837714845	PRVGPLHZKLPKGF-SJORKVTESA-N	441.428	1.531	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)CCc3cnn(C)c3)CC2)CC1	1837933387	SLQVPCSBYFXQLX-LJQANCHMSA-N	440.972	1.605	50	20	IDGD	
COc1ccnc(C(=O)N2CCO[C@@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)c1	1837950797	ZUXXSRNDZQJZRF-FQEVSTJZSA-N	425.913	1.425	50	20	IDGD	
Cc1noc(CC(=O)N2CCC(OC3CCN(C(=O)CO[Si](C)(C)C)CC3)CC2)n1	1837951202	JUKLGTJCLPASKR-UHFFFAOYSA-N	438.601	1.771	50	20	IDGD	
CCc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)no1	1838129337	PYIKDYJJRCSZGS-PXAZEXFGSA-N	430.299	1.090	50	20	IDGD	
COc1cc(OC)cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)c1	1838933760	GHBTTZCIAOYGAR-APWZRJJASA-N	430.860	1.308	50	20	IDGD	
C[C@H](Cn1ccnc1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2	1839155031	GWHZAPQNQXPVDX-AYOQOUSVSA-N	447.363	1.212	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)c1ccc(O)cc1)CCO2	1839171329	SDTWOLAILRBRDI-UQASEVPWSA-N	440.924	1.206	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)c1	1840186382	GOUNTWNAKMOKHW-HXUWFJFHSA-N	445.343	1.942	50	20	IDGD	
C[C@@H](Nc1nccs1)C(=O)N1CCOC[C@]2(CN(C(=O)C(Cl)Cl)CCO2)C1	1840187493	FMTKBRLFHXOKKS-BDJLRTHQSA-N	437.349	1.204	50	20	IDGD	
COc1cccc(Cl)c1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1840736993	OVXJVVSAGZYRQG-YJBOKZPZSA-N	435.279	1.953	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(CO)c(F)c3)CCO2)C1	1840780755	AIJZHTAOIFPTND-OAQYLSRUSA-N	442.915	1.653	50	20	IDGD	
O=C(CCBr)N1CC2(CCCN2C(=O)CCn2c(=O)oc3ccccc32)C1	1841987569	NZXYZTQLPPJCHF-UHFFFAOYSA-N	436.306	1.973	50	20	IDGD	
COc1ccc2cc(C(=O)N3CCCC34CN(C(=O)CCC(=O)NN(C)C)C4)[nH]c2c1	1843693977	CDKVQZITMXGGKQ-UHFFFAOYSA-N	427.505	1.367	50	20	IDGD	
O=C(c1cc(Br)cnc1Cl)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl	1847564021	RJTNXMNFHFDRBL-SRVKXCTJSA-N	437.121	1.913	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)NCCC(=O)NNC(=O)c2cc(Cl)ccc2O)cc1	10600880	XXVIJCCMJUDCAU-UHFFFAOYSA-N	439.877	1.378	50	20	IDGD	
Nc1c(Cl)cc(Cl)cc1C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	10960659	VPSXFLKPDPHMRU-CQSZACIVSA-N	440.239	1.720	50	20	IDGD	
CCc1ccccc1NC(=S)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	18919099	DYXKLKDQKQMDJA-UHFFFAOYSA-N	448.570	1.901	50	20	IDGD	
O=C(NNC(=O)c1cnc2ccccc2n1)c1cccc(S(=O)(=O)N2CCCC2)c1	21888725	ZFSQVKXUJDBBGT-UHFFFAOYSA-N	425.470	1.489	50	20	IDGD	
CCOCCO[C@@H](C)C(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	109051807	DJLZGWCPEVFCAL-ZDUSSCGKSA-N	441.531	1.752	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)NCC(=O)N1CCc2ccccc21	726190252	LDYCYLSUFQLAQJ-UHFFFAOYSA-N	447.289	1.748	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)N[C@@H]1C[C@H]1c1cccc(Br)c1	726609774	CVXBGAHFMUPVBA-JKSUJKDBSA-N	442.277	1.925	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2sc(NC(C)=O)nc2C)cc(OC)c1OC	727349720	GTAWLHJWMSDJAI-UHFFFAOYSA-N	444.491	1.059	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NN=Cc1cc(Br)c(O)c(Br)c1	728437892	XXHMDUIRCHZDJU-ZCFIWIBFSA-N	443.117	1.305	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCCc2ccc(NC(C)=O)cc2)nc1	729059555	ZHIMZLUGQLIPJW-UHFFFAOYSA-N	448.549	1.939	50	20	IDGD	
CNS(=O)(=O)c1ccc([C@@H](C)NC(=O)NNC(=O)Cn2ccc3ccccc32)cc1	729497186	PSPWOHCFOASLJI-CQSZACIVSA-N	429.502	1.641	50	20	IDGD	
CNS(=O)(=O)C1CCN(C(=O)CCC(=O)C(C#N)=C2N(C)c3ccccc3N2C)CC1	732131290	RDGFWJQUHOLIHX-UHFFFAOYSA-N	445.545	1.197	50	20	IDGD	
CN(CC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)[C@@H]1CCN(c2ccccc2Cl)C1=O	732206798	CXBMXGHITNETDO-QGZVFWFLSA-N	445.863	1.747	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)N[C@@H](Cc2ccccc2)CN2CCOCC2)cc1	732476468	KYAGZFLPEIXUPP-IBGZPJMESA-N	442.516	1.348	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N[C@@H](Cc2ccccc2)CN2CCOCC2)cc1OC	732476796	WWLVICFVRXGTHR-IBGZPJMESA-N	442.516	1.591	50	20	IDGD	
O=C(NCCCN1CCN(c2ncccn2)CC1)NNC(=O)NCc1ccc(Cl)cc1	732991181	XJTPEQYCJVAOOS-UHFFFAOYSA-N	446.943	1.356	50	20	IDGD	
C[C@H](CS(C)(=O)=O)NC(=O)NNC(=O)c1cn(-c2ccccc2)nc1-c1ccccc1	733660662	JRAZURRURMSPSI-OAHLLOKOSA-N	441.513	1.916	50	20	IDGD	
COc1ccc([C@H]2[C@H](C(=O)NNc3nc4ccccc4c(=O)n3C)CCC(=O)N2C)cc1	734438749	QKRBUYWWWYFSQM-XLIONFOSSA-N	435.484	1.995	50	20	IDGD	
C[C@H]1Oc2ccccc2O[C@@H]1C(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	734824502	AQPNNDKBPWTOTL-DYVFJYSZSA-N	434.493	1.945	50	20	IDGD	
C[C@@H](CC(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1)c1cccc(F)c1	735118349	SUXGSFAQSQUUBT-HNNXBMFYSA-N	435.525	1.794	50	20	IDGD	
CCn1c(CCC(=O)NNc2cc(C)nc(C)n2)nc2cc(S(=O)(=O)N(C)C)ccc21	736717269	YSCNVQMMXIWMCD-UHFFFAOYSA-N	445.549	1.789	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNS(=O)(=O)c1cc(Br)ccc1Cl	740812462	JZVSREFAWUZZFY-UHFFFAOYSA-N	426.720	1.717	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)COCc1ccccc1)[C@@H]1CN(Cc2ccccc2)CCO1	741276922	BZGHQYYHPMLVMU-NQIIRXRSSA-N	426.517	1.823	50	20	IDGD	
NS(=O)(=O)c1ccc(NC(=O)NNC(=S)NCCSc2ccccc2)cc1	741870353	RXFXFVSNABIKEW-UHFFFAOYSA-N	425.561	1.627	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)N[C@H]1CC(=O)N(CCOc2ccccc2)C1	743639868	YJCAFTUUMIGBQL-INIZCTEOSA-N	440.456	1.082	50	20	IDGD	
C[C@H](NC(=O)c1n[nH]c2ccccc12)C(=O)NNC(=O)c1cccc(Br)c1	743730615	BEVZZQRNOIYMOH-JTQLQIEISA-N	430.262	1.905	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)CC/N=C2/NS(=O)(=O)c3ccccc32)cc1	743828542	RQKDQFVFOUMXBZ-UHFFFAOYSA-N	430.490	1.034	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)c2cccc(S(=O)(=O)NC3CC3)c2)c1	744506309	NPXWJRVGVNXVTN-UHFFFAOYSA-N	431.470	1.054	50	20	IDGD	
CCCN(C(=O)[C@H](C)OC(=O)/C(C#N)=C/c1cccc(OC)c1)[C@H]1CCS(=O)(=O)C1	744568933	XZNPCENFVIUGIQ-YIXFDOPESA-N	434.514	1.960	50	20	IDGD	
CCN1CCN(C[C@H](C)CNC(=O)NNC(=O)c2ccc(Br)s2)CC1	745863232	UEQVDBUOJOAMGX-GFCCVEGCSA-N	432.388	1.728	50	20	IDGD	
COc1cc(C)nc(NNC(=O)CCNS(=O)(=O)c2c(Cl)cccc2Cl)n1	746634400	DCESMZNVBYDKBB-UHFFFAOYSA-N	434.305	1.912	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCc2ccccc2)cc1C(=O)NNc1nccn(C)c1=O	747942274	QYOSBFNHTNNNKR-UHFFFAOYSA-N	427.486	1.324	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)c(C)o1	748521161	JFQCACKTUSOKEA-UHFFFAOYSA-N	441.409	1.547	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NC[C@]2(N(C)C)CCSC2)cc1Br	748646953	JKYIVHPGTLKBFV-MRXNPFEDSA-N	431.356	1.839	50	20	IDGD	
CCc1c(C(=O)NNC(=O)c2cc(-c3ccc(OC)c(OC)c3)[nH]n2)[nH]c(C)c1C(N)=O	749258429	LXZQXEGUZGDLDL-UHFFFAOYSA-N	440.460	1.467	50	20	IDGD	
C[C@@H]1CN(S(=O)(=O)N2CCN(/C(=C/C#N)c3cccc([N+](=O)[O-])c3)CC2)C[C@@H](C)O1	750037022	UHNUTMDOKXJLQF-DRTXVBNMSA-N	435.506	1.431	50	20	IDGD	
CC(=O)NC[C@H]1CCn2ncc(C(=O)NNC(=O)c3cccc(Br)c3)c2C1	753133706	BNEGCBMLQCVSPC-LBPRGKRZSA-N	434.294	1.419	50	20	IDGD	
COc1ccc(N2CCN(C(=O)NNC(=O)c3c(C)nc4ccccn34)CC2)cc1F	753798125	LBNNYDLYFHAXMG-UHFFFAOYSA-N	426.452	1.967	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1ccnc(O[C@@H]2CCOC2)c1	755051040	LCNSZRAVJOKGHJ-CQSZACIVSA-N	449.847	1.529	50	20	IDGD	
CC(=O)Nc1ccc(NS(C)(=O)=O)c(C(=O)NNc2ccc(C(F)(F)F)nn2)c1	755191541	IQXXPYTULJGAAQ-UHFFFAOYSA-N	432.384	1.582	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)Nc1ccccc1C(=O)N1CCOCC1	755621467	ACZSBGROOYGLOT-SFHVURJKSA-N	426.429	1.152	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)CS(=O)(=O)c2ccc(F)cc2)cc1C	755623301	QVYCOYBKBMLYJB-AWEZNQCLSA-N	435.477	1.638	50	20	IDGD	
C=CCN(C)S(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1	755934463	VGMRVOCXPHLCED-GOSISDBHSA-N	446.485	1.486	50	20	IDGD	
CCCNC(=O)c1ccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1	756128005	WTJOZIXETYVCSV-UHFFFAOYSA-N	447.517	1.543	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)Nc1cc(S(=O)(=O)NC)ccc1C	756523807	DNTGFEMYZVGHMZ-UHFFFAOYSA-N	436.490	1.534	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(F)c(NC(=O)NNC(=O)c2ccc3c(c2)OCCO3)c1	756687498	ZWRNCUMAIDDJCI-UHFFFAOYSA-N	438.437	1.314	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)cc1-n1cnnn1	756747446	OXSFJVFSIDTNED-CQSZACIVSA-N	425.449	1.908	50	20	IDGD	
CCOC(=O)[C@@H](C)NC(=O)c1ccc(NC(=O)NNC(=O)COc2ccc(F)cc2)cc1	756789107	FAUQUAVPUIVDTP-CYBMUJFWSA-N	446.435	1.739	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)Nc1cc(Br)ccc1N1CCCC1	757709240	BKJPWAYRIQVTCJ-LLVKDONJSA-N	445.339	1.637	50	20	IDGD	
C[C@]12CCC(=O)N1c1ccccc1C(=O)N2CC(=O)NNc1nc(O)c2ccccc2n1	758299212	QROZJBSOWQGZLD-JOCHJYFZSA-N	432.440	1.778	50	20	IDGD	
CC(=NNC(=O)CNC(=O)c1cccnc1)c1ccc(S(=O)(=O)CC(F)(F)F)cc1	763198129	GMPTYYSBVMOEPM-UHFFFAOYSA-N	442.419	1.688	50	20	IDGD	
CC[C@@H](C)NS(=O)(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)c2ccccc2)c1	763431324	SEABLJILBKSNBU-CQSZACIVSA-N	432.502	1.304	50	20	IDGD	
Nc1c(Cl)cc(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1Cl	763462871	NUABYGOEASGYDS-UHFFFAOYSA-N	437.692	1.951	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ccccc2O)ccc1C	763529721	LJWDVACOOKVIKA-UHFFFAOYSA-N	448.501	1.131	50	20	IDGD	
Cc1cc(Br)cc(C)c1NC(=O)C(=O)NNC(=O)[C@H]1COc2ccccc2O1	763576434	AEIFMMXCMAFLCE-OAHLLOKOSA-N	448.273	1.992	50	20	IDGD	
O=C(CC[C@@H]1NC(=O)NC1=O)NNC(=O)c1cn(-c2ccccc2)nc1-c1ccccc1	763607558	FLXFOPVPJWEGKG-KRWDZBQOSA-N	432.440	1.289	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1ccc(N2CCCC2=O)c(F)c1	763627645	CJJBXHRTKUWJBZ-UHFFFAOYSA-N	438.419	1.308	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(N3CCOCC3)c(C)c2)cc1	763662066	SYTIDIJPBKKRPG-UHFFFAOYSA-N	442.472	1.005	50	20	IDGD	
Cc1cnn(-c2ccc(NC(=O)C(=O)NNC(=O)COc3ccccc3F)cc2F)c1	763682156	YHHOVGIQHHZKIY-UHFFFAOYSA-N	429.383	1.624	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(Cl)c(C(N)=O)c2)cc1	763878381	PTZXYJFOSBUEIH-LLVKDONJSA-N	446.847	1.195	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)C(=O)Nc1cccc(N2CCCCC2)c1	763951044	YROWJDBZVWGSDD-UHFFFAOYSA-N	448.483	1.968	50	20	IDGD	
COC(=O)c1cc(F)c(F)cc1NC(=O)C(=O)NNC(=O)c1cc(Br)c[nH]1	763994245	BRFARXSPPYMQIU-UHFFFAOYSA-N	445.176	1.242	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)C(=O)Nc1cccc(N2CCCCC2=O)c1	763996221	WYVPEMBSVHEVAT-UHFFFAOYSA-N	448.277	1.694	50	20	IDGD	
CO[C@H]1Cc2ccc(NC(=O)C(=O)NNC(=O)c3cc(Br)cn3C)cc2C1	764002499	NHVCOXKZAHSADA-AWEZNQCLSA-N	435.278	1.301	50	20	IDGD	
O=C(NNC(=O)c1cnccn1)C(=O)Nc1cccc(COc2ccc3c(c2)OCO3)c1	764024290	JYSNWNXDCWIHCX-UHFFFAOYSA-N	435.396	1.184	50	20	IDGD	
CC[C@H](C)C(=O)NNC(=O)C(=O)Nc1ccnn1Cc1ccc(OC)c(OC)c1OC	764081897	LRJZWGPSGHPEJH-LBPRGKRZSA-N	433.465	1.089	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(OCc3cccc(C#N)c3)c(F)c2)n[nH]1	764097203	BQJGYSXMCUTUGE-UHFFFAOYSA-N	436.403	1.708	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2ccc(NC(C)=O)c(OC)c2)cc1	764124522	JZNBLVSATLWNMG-UHFFFAOYSA-N	428.445	1.381	50	20	IDGD	
COC(=O)c1cc2cc(NC(=O)C(=O)NNC(=O)c3cccc(OC)c3O)ccc2o1	764130915	BMRPJWXSHSTXIF-UHFFFAOYSA-N	427.369	1.333	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2O1)C(=O)Nc1ccc(-n2cnc3ccccc32)nc1	764154086	OBDSWQSVBASOOO-IBGZPJMESA-N	442.435	1.510	50	20	IDGD	
O=C(NNC(=O)c1cccc(OC(F)F)c1)C(=O)Nc1ccn(CCc2ccncc2)n1	764251678	XGJXWUZVQZFJRB-UHFFFAOYSA-N	444.398	1.522	50	20	IDGD	
CN(c1ccccc1NC(=O)C(=O)NNC(=O)c1cccc2ncccc12)S(C)(=O)=O	764252553	IMAZVVHRPYHKIH-UHFFFAOYSA-N	441.469	1.030	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)C(=O)Nc1cc(N2CCNC2=O)ccc1Cl	764288209	FWNJATAKEPOSEZ-UHFFFAOYSA-N	445.863	1.294	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CCc2ccccc2O)cc1N1CCOC1=O	764288536	KGHHGUJIXRRNSO-UHFFFAOYSA-N	426.429	1.376	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)C(=O)Nc1cccc(C(=O)N2CCCCC2)c1	764319781	ASZQMLSGMCMAEB-UHFFFAOYSA-N	426.448	1.780	50	20	IDGD	
CN1CCCCC/C1=N/S(=O)(=O)c1cccc(NC(=O)C(=O)NNC(=O)C2CCC2)c1	764341754	JARBJGSKTHHBBY-ULJHMMPZSA-N	449.533	1.166	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)ncn2-c1ccccc1	764397064	FKFBMRGBTNPABE-AWEZNQCLSA-N	425.445	1.163	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)cn1	764519648	UIRCEQXSZGXYSG-UHFFFAOYSA-N	428.562	1.534	50	20	IDGD	
CC(C)(C)CC(=O)N1CCC(=NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)CC1	764829710	GFYXUBRAEKWVCA-UHFFFAOYSA-N	441.576	1.975	50	20	IDGD	
Cc1nn(C)c(C)c1OCC(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	765757852	XTWCZYQSKIOGLQ-UHFFFAOYSA-N	448.955	1.034	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1ccc(Cl)c(-n2nnnc2C2CC2)c1	766271792	PYLSMZZPVYXLRV-UHFFFAOYSA-N	429.828	1.074	50	20	IDGD	
CC(C)(Oc1ccc(C#N)cc1)C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	767632073	HXOUBOWBGNERIS-SFHVURJKSA-N	439.424	1.246	50	20	IDGD	
CC(=O)N1CCc2c(NC(=O)C(=O)NNC(=O)[C@H](C)Oc3ccccc3F)cccc21	769268353	ZDKHFKAIMZYTGU-LBPRGKRZSA-N	428.420	1.288	50	20	IDGD	
COC(=O)c1ccc(S(=O)(=O)NNC(=O)c2cc(F)ccc2Br)cn1	769631973	DTRYARSRLQBEIV-UHFFFAOYSA-N	432.227	1.393	50	20	IDGD	
NS(=O)(=O)c1ccc(C(=O)OCC(=O)NN=C(c2ccccc2)c2ccccc2)nc1	769838878	ZWIYUECLCSQEOU-UHFFFAOYSA-N	438.465	1.455	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)c2nccn3c(Br)cnc23)c1	769876411	INGANKHBBGOFMR-UHFFFAOYSA-N	432.234	1.418	50	20	IDGD	
N#Cc1cccc(NNC(=O)Nc2ccc(S(=O)(=O)N[C@@H]3CCS(=O)(=O)C3)cc2)c1	769936389	FESCKXZUWXFYCB-MRXNPFEDSA-N	449.514	1.172	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)CCCN1C(=O)c2cccc3cccc(c23)C1=O	771848411	ANGHEMGGTBFRAF-ZDUSSCGKSA-N	425.441	1.705	50	20	IDGD	
CN(C(=O)C1CC1)c1ccccc1C(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772888514	KFJFPADQNPSFMZ-UHFFFAOYSA-N	428.876	1.790	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)[C@@H]1CSCN1C(=O)c1ccccc1	772897402	HJEZKIIBUMMZCE-INIZCTEOSA-N	446.916	1.319	50	20	IDGD	
CC(C)(C(=O)NNC(=O)NCCOc1ccc(NS(C)(=O)=O)cc1)c1ccccc1	773541808	NQVURUCMCQZUAZ-UHFFFAOYSA-N	434.518	1.745	50	20	IDGD	
Cc1cc(C)cc(CCC(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)c1	777522828	ABLZMFJVSZMKAS-UHFFFAOYSA-N	431.562	1.710	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)N[C@@H]1CC(=O)N(c2ccc(Cl)c(F)c2)C1	778717916	GIGPCZRIPVZJTG-SNVBAGLBSA-N	443.863	1.440	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(Cl)c(C(=O)NNc2cccc(C(=O)OC)c2)c1	780792324	HNDBEUCPPLNUGA-UHFFFAOYSA-N	441.893	1.808	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)[C@@H]2CCCN2C(=O)/C=C/c2ccc(C(N)=O)cc2)c1	780793523	YTMJYIWYIQNOMD-DLENHJPASA-N	436.468	1.720	50	20	IDGD	
CCc1c(C(=O)NNC(=O)c2ccc3c(c2)OCCO3)nnn1Cc1ccc(F)cc1	782085992	HIJVDHIZEYPWJJ-UHFFFAOYSA-N	425.420	1.874	50	20	IDGD	
CCc1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)cc1CC	783258908	PMRDTGFPQNHVEN-UHFFFAOYSA-N	433.534	1.975	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2ccc(OC3CCCC3)c(Cl)c2)CCS(=O)(=O)C1	783425570	IOZOKFLMPYFKGH-GOSISDBHSA-N	429.926	1.798	50	20	IDGD	
O=C(NNc1ccc([N+](=O)[O-])cc1Cl)C(=O)Nc1ccccc1CN1CCNC1=O	784379658	BSOPXQGYYVWMPV-UHFFFAOYSA-N	432.824	1.855	50	20	IDGD	
O=C(NNC(=O)[C@H]1CC=CC[C@@H]1C(=O)N1CCOCC1)c1cccc(Br)c1	784429855	UUSCJNRVFGSVJY-HOTGVXAUSA-N	436.306	1.651	50	20	IDGD	
COc1cccc(NNC(=O)C(=O)Nc2cccc(C(=O)N3CCSCC3)c2C)n1	784842743	XCCAZBVAWXBDTQ-UHFFFAOYSA-N	429.502	1.669	50	20	IDGD	
CN1CCC[C@@H](N(C)C(=O)c2ccc(NC(=O)C(=O)NNc3cccnc3Cl)cc2)C1	784848245	HZXAVVPGRLBEHU-MRXNPFEDSA-N	444.923	1.983	50	20	IDGD	
CCNC(=O)N(C)NC(=O)C(=O)Nc1ccc(N2C[C@H](C)O[C@H](C)C2)c(C(F)(F)F)c1	784915859	GKTYUKOQYGMADO-TXEJJXNPSA-N	445.442	1.950	50	20	IDGD	
CCCCN1CCc2ccc(NC(=O)C(=O)NNC(=O)Cc3cn4ccccc4n3)cc21	785060788	LZZOMHKKHQSSKW-UHFFFAOYSA-N	434.500	1.826	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)[C@]2(O)CCc3ccccc3C2)CC1	786187553	XXVJSXQXEYOJFS-QFIPXVFZSA-N	432.521	1.636	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CN2CCCN(c3nnc(C(F)(F)F)s3)CC2)c1	786444620	OIQFKQDPMIILDE-UHFFFAOYSA-N	442.467	1.839	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1ccnc(Oc2ccc(F)cc2F)c1	788739840	RNSMTNNXACQUCI-VIFPVBQESA-N	429.405	1.243	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)Cn2c(S)nc3ccccc3c2=O)cc1OC	788826668	LHROEUBXOQXUCP-UHFFFAOYSA-N	428.470	1.554	50	20	IDGD	
Cn1nc([C@H]2CCCO2)cc1NC(=O)C(=O)NNC(=O)COc1ccc(C(C)(C)C)cc1	789731872	ITYYROFQQRFYJJ-QGZVFWFLSA-N	443.504	1.734	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)[C@@](C)(O)Cn1cc(C(F)(F)F)ccc1=O	792016641	RNMNWEJVZZSTKO-ZMZPIMSZSA-N	445.369	1.372	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@](C)(O)Cn2c(C)cccc2=O)ccc1OCCC(C)C	792031485	XFMOZZWXVCPPNA-HSZRJFAPSA-N	445.516	1.802	50	20	IDGD	
C[C@](O)(Cn1cc(C(F)(F)F)ccc1=O)C(=O)NNC(=O)Cn1ccc2ccccc21	792144450	WHVZKSYSDKKVBU-IBGZPJMESA-N	436.390	1.420	50	20	IDGD	
COc1ccc(C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c(OC)c1OC	792174617	ZIGKKWXTNBAGDZ-UHFFFAOYSA-N	433.373	1.239	50	20	IDGD	
COCCC[C@@H](Cc1ccccc1)NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	792286487	TVPLQZHGDYXWRE-KRWDZBQOSA-N	437.500	1.915	50	20	IDGD	
CNS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2cccc(Br)c2)nc1	792399379	AODXPVPVHKSAGD-UHFFFAOYSA-N	428.268	1.219	50	20	IDGD	
O=C(COC(=O)[C@@H]1CCCCN1Cc1ccccn1)NNC(=O)c1cccc([N+](=O)[O-])c1	795606257	KJPJEZZIOPYRHN-SFHVURJKSA-N	441.444	1.349	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)CNC(=O)OCc2ccccc2)ccc1N(C)C	797368949	JSQVUDIYSFRJOU-UHFFFAOYSA-N	427.461	1.073	50	20	IDGD	
Cc1cc(OCC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)ccc1[N+](=O)[O-]	797702194	UJWUNIBXELMYLB-UHFFFAOYSA-N	435.462	1.345	50	20	IDGD	
COC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1C	798042713	ZXBLLLMCVLPKMH-INIZCTEOSA-N	428.401	1.099	50	20	IDGD	
CNS(=O)(=O)c1ccccc1S(=O)(=O)NNC(=O)C12CC3CC(CC(C3)C1)C2	799518558	IGTZQVVSBSRAFC-UHFFFAOYSA-N	427.548	1.121	50	20	IDGD	
CCC1(CC)NC(=O)N(CC(=O)NNc2cc([N+](=O)[O-])ccc2Br)C1=O	800620219	GRMNUDNYLCECIP-UHFFFAOYSA-N	428.243	1.911	50	20	IDGD	
CCCCn1c(C)cc(/C=C(/C#N)C(=O)OCC(=O)c2c(N)n(C)c(=O)n(C)c2=O)c1C	801073944	NDKKNKPOLRQHQK-YBEGLDIGSA-N	441.488	1.218	50	20	IDGD	
COC(=O)[C@@H]1C[C@@H]2[C@H](CC[C@@H](C)N2CC(=O)NNC(=O)c2cc(Cl)ccc2OC)O1	801601291	LRMSFKSVYQESIU-OFIKQIQMSA-N	439.896	1.293	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)CN(C)C(=O)[C@@H](C)n2cccn2)cc1Cl	802071857	ILEOWAMHMMXIJK-LLVKDONJSA-N	438.872	1.426	50	20	IDGD	
Cc1ccc(S(=O)(=O)NC(C)(C)C)cc1C(=O)NNc1ccc(-n2ccnc2)nn1	804956712	VTQLPBVQHDSNJO-UHFFFAOYSA-N	429.506	1.804	50	20	IDGD	
COc1cc(C)c(NC(=O)C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)c(C)c1C	806975562	FKDJMZQQUXVKFV-UHFFFAOYSA-N	437.456	1.911	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2cc(C(F)(F)F)cc(Br)n2)n1	807069207	BOCTVELQYLEOLQ-UHFFFAOYSA-N	446.183	1.966	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cccc3ncccc23)cc2[nH]ccc12	808935137	KQCUCIOXLYSQSR-UHFFFAOYSA-N	431.408	1.902	50	20	IDGD	
COC(=O)C[C@H](C)CC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	809558441	ZXSDHUJXPWMQFV-GFCCVEGCSA-N	439.515	1.899	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)CCCn2c(C)cc(=O)cc2C)c2ccccc2c1=O	809954495	UJCMGNRCLRHFLZ-UHFFFAOYSA-N	437.500	1.826	50	20	IDGD	
O=C(NNC(=O)c1cc(Cl)ncc1Br)c1csc(N2CCOCC2)n1	809980369	LFYAWXUJKWKNEJ-UHFFFAOYSA-N	446.714	1.865	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)N[C@@H]1c2ccccc2CC12CCOCC2	811872954	ZWIBONMDGUBPBC-GOSISDBHSA-N	428.514	1.903	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)c2nnn(-c3ccn(C)n3)c2C)cc1OC	814369820	GKQMTRFPBMQCEX-UHFFFAOYSA-N	427.465	1.572	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)on1)C(=O)Nc1cn(Cc2ccccc2)nn1	815568028	SQPCKDNBZHDUKO-UHFFFAOYSA-N	431.412	1.381	50	20	IDGD	
Cc1nc(C#N)c(N2CCC(C(=O)NNc3ccccc3S(=O)(=O)N(C)C)CC2)o1	817054587	PDVNDNOTESRJMN-UHFFFAOYSA-N	432.506	1.465	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NNC(=O)c2ccoc2C2(O)CCOCC2)C1	819659096	SEQHEGMGQJJQFB-CQSZACIVSA-N	437.493	1.686	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)[C@H](CC(C)C)N1C(=O)[C@H]2CC=CC[C@H]2C1=O	825630853	QWRBERZQOQSYBT-JZXOWHBKSA-N	442.516	1.620	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2N2CCOCC2)cc1	864016261	QAYAAJSGSWVZRV-UHFFFAOYSA-N	425.401	1.143	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNS(=O)(=O)c2ccc3c(c2)oc(=O)n3C)cc1	903939318	PFYVFXJZFAFTEM-LBPRGKRZSA-N	435.458	1.307	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)[C@H]2Cc3ccccc3CN2C(C)=O)cc1	912608288	XBQNQLWGMXRUMU-YCRPNKLZSA-N	425.485	1.973	50	20	IDGD	
O=C(NNc1ncccn1)[C@@H]1CCCN(S(=O)(=O)c2ccc(Br)s2)C1	913043870	BYSWCUXGROKYSE-SNVBAGLBSA-N	446.352	1.845	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2ccc(C(=O)NNC(=O)c3cccnc3)cc2)cc1	913108904	WKRRZKYEZGKMAP-UHFFFAOYSA-N	426.454	1.966	50	20	IDGD	
O=C(CN1CCCN(C(=O)c2ccccc2F)CC1)NNC(=O)c1cccc([N+](=O)[O-])c1	913147589	DJXAKBLQBMVPJC-UHFFFAOYSA-N	443.435	1.343	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CN2C(=O)[C@@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2=O)ccc1OC(C)C	913154150	NUFMYGBPDHUHBC-MBZVMHRFSA-N	427.457	1.051	50	20	IDGD	
O=C(COc1cccc(NC(=O)c2ccco2)c1)NNC(=O)c1ccc(-n2cnnn2)cc1	914752114	VSVAIMKYWAWJCB-UHFFFAOYSA-N	447.411	1.348	50	20	IDGD	
O=C(NCc1ccnc(OC2CCCC2)c1)NNC(=O)c1csc(N2CCOCC2)n1	915257686	BLHURQSAZSQIRB-UHFFFAOYSA-N	446.533	1.840	50	20	IDGD	
CCOC(=O)N1CCC(NC(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)CC1	915878892	RTVQOMWLEYKKCO-UHFFFAOYSA-N	428.515	1.015	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)NC[C@H](c2cccs2)N2CCOCC2)c1	915893230	GXVRAIADAAHQME-QGZVFWFLSA-N	434.518	1.783	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)NCc1ccc(S(N)(=O)=O)s1	915906232	TYGSCHZAWNFTOA-LBPRGKRZSA-N	448.526	1.847	50	20	IDGD	
CCN(CC(=O)NNC(=O)c1ccccc1)Cc1nc(O)c2cc(OC)c(OC)cc2n1	916145480	TYLOTLQVJZSLPB-UHFFFAOYSA-N	439.472	1.636	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc([C@H](C)NCC(=O)NNC(=O)c2ccccc2)cc1	916149268	WUOVMWWCMKZXAV-INIZCTEOSA-N	432.546	1.829	50	20	IDGD	
O=C(NCc1cccnc1OCC(F)(F)F)NNC(=O)c1ccc(-n2cnnn2)cc1	916398417	WFPDOVFBQAXXSL-UHFFFAOYSA-N	436.354	1.143	50	20	IDGD	
O=C(CCCS(=O)(=O)N1CCCC1)NNC(=O)Cc1nc(-c2ccccc2)cs1	917394029	YQEOTLKPKMBZGH-UHFFFAOYSA-N	436.559	1.706	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)c2ccc(C)cc2O)cc1	917754072	WOTNKKYNNSKXJD-UHFFFAOYSA-N	441.531	1.354	50	20	IDGD	
O=C(NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1)c1ccc([N+](=O)[O-])[nH]1	917939175	OSIAPRTUBPQWBF-UHFFFAOYSA-N	435.443	1.860	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)[C@@H]2CCCN(S(=O)(=O)c3c(C)noc3C)C2)c(O)c1	918337869	VXMRPBHFZMAELB-CQSZACIVSA-N	436.490	1.167	50	20	IDGD	
CCCS(=O)(=O)N1CCCC[C@H]1C(=O)NNC(=O)Cn1c(CC)nc2ccccc21	919689556	WEOCVIFPKUDRDJ-KRWDZBQOSA-N	435.550	1.340	50	20	IDGD	
CNC(=O)NNC(=O)CN1C(=O)/C(=C\c2ccc(Br)cc2)SC1=S	919879495	ILPGVHUQQZQVCA-UXBLZVDNSA-N	429.321	1.611	50	20	IDGD	
O=C(NNC(=O)C(O)(c1ccccc1)c1ccccc1)c1csc(N2CCOCC2)n1	920473168	ILVBDKORLJUZGV-UHFFFAOYSA-N	438.509	1.677	50	20	IDGD	
C[C@H](O)CNS(=O)(=O)c1ccc(C(=O)NNC(=O)Cc2ccc(Cl)cc2)cc1	1120660006	BKHVSVVEENPYGN-LBPRGKRZSA-N	425.894	1.003	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNS(=O)(=O)c2cnn(-c3ccccc3)c2)CC1	1318568166	BPBNSAURSMDHFD-UHFFFAOYSA-N	449.533	1.829	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)c2cccc(N3CCNC3=O)c2)CC1	1318882445	QFRACZFEAMTILG-UHFFFAOYSA-N	446.508	1.560	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2n[nH]c3c2CCCC3)ccc1OCC(=O)NC(C)C	1319025383	KCZZKPLNFXIJIC-UHFFFAOYSA-N	429.477	1.275	50	20	IDGD	
COC(=O)c1cc(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)n(-c2ccccc2)n1	1321550954	QSAYBJMBMNKLPP-UHFFFAOYSA-N	449.471	1.127	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc3c(n1)OCCO3)C2)[C@H](F)Cl	1778025559	CCRPALZDNOOOCT-ZRGWGRIASA-N	427.860	1.515	50	20	IDGD	
O=C(c1c[nH]c2cnccc12)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1778753526	POHKYBACVSOYAX-YOEHRIQHSA-N	425.258	1.697	50	20	IDGD	
O=C(/C=C/c1ccc([N+](=O)[O-])o1)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781325776	QVZAKVYUJYTCQP-AWHZNEASSA-N	446.229	1.721	50	20	IDGD	
O=C([C@H]1CCc2nc[nH]c2C1)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781333109	CJJVJDQZVYZFAK-YLVFBTJISA-N	429.290	1.035	50	20	IDGD	
Cc1nccnc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)Br)C1	1781997818	KTGFLACDHPRNDR-RVZJWNSFSA-N	425.327	1.696	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Cl)C2)[C@@H]1C[C@@]12C(=O)Nc1ccccc12	1782005317	XKXNRKDUPSYWBQ-CISTUJAYSA-N	449.910	1.945	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)nc(Cl)c1)C2	1782170822	AECSRRNSXWKJOH-PJIJBLCYSA-N	446.331	1.822	50	20	IDGD	
O=C(Cc1ccc([N+](=O)[O-])cc1F)N1CC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1782974785	VCONPIJVXONGPJ-KRWDZBQOSA-N	434.251	1.910	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3nnc(-c4ccccc4)o3)CCO2)C1	1783534159	QOPOPQWRSDRBLM-YJYMSZOUSA-N	449.305	1.964	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)CCc3ncccc3OC)CCO2)C1	1783872757	GVKKEGHFIPPPJU-YWZLYKJASA-N	425.913	1.107	50	20	IDGD	
O=C(Cc1cc([N+](=O)[O-])ccc1F)N1CCO[C@@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783942964	QLMCNIHDQLXZAD-KRWDZBQOSA-N	434.251	1.910	50	20	IDGD	
Cc1onc(-c2ccccc2)c1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]2C1	1784086852	QEWCYUDUFZSFHV-FJIDUMEYSA-N	447.919	1.843	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nnc4cc(C)nn4c3C)C[C@@H]21	1784618893	UYXXZDIYQUWYPW-NXOAAHMSSA-N	448.955	1.742	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)N2CC[C@@]3(CN(C(=O)CCBr)CCO3)C2)c1	1785108527	NWOWGHMOSPTXQB-LJQANCHMSA-N	438.322	1.874	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Cl)C[C@@H]32)C1	1788114512	JBCXKUPWFQANAR-MXAVVETBSA-N	433.908	1.367	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3n[nH]cc3[N+](=O)[O-])[C@H]2C1	1788816033	KRQSLFSTNZSEGM-ZZTKVPBPSA-N	434.280	1.148	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1ccc(C2(NC(=O)Cc3cncnc3)CCC2)cc1	1789521214	NCPXWKCJEOBNKZ-UHFFFAOYSA-N	445.483	1.466	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3cccnc3)C[C@@H]21)[C@H](F)Br	1789922676	NWQLNTIMWJIRBZ-JKQORVJESA-N	428.302	1.684	50	20	IDGD	
N[C@H](CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]2C1)c1cccnc1	1789922739	PDFLZMIWZPPNJI-JBXGNFEISA-N	443.317	1.142	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3cnccn3)[C@H]2C1	1791660623	AJIRSKNDBBXRBT-SDADXPQNSA-N	425.327	1.172	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1C[C@@H]1c1ccc(Cl)cc1)C2)[C@@H](O)CCl	1792981384	KSYUBYSISVLINL-RTNWTXRISA-N	427.328	1.633	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cncc(S(C)(=O)=O)c1	1794626504	VXINVGJGDLLDQS-RUZUBIRVSA-N	444.351	1.520	50	20	IDGD	
CCSc1ncccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1	1796185829	UBIJZEUXBNOFBN-BCDXTJNWSA-N	439.346	1.439	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)c1ccc(OC(F)F)cc1	1796189506	WCTIYKRJCGUCOO-BCDXTJNWSA-N	444.243	1.533	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](C)[C@H]1SC(=N)NC1=O	1796879726	WYIAGMSQNLYVQP-ZNSALQAWSA-N	431.356	1.210	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccoc1C(F)(F)F	1797019744	GHCYUIVOUJOWRQ-CLLJXQQHSA-N	430.427	1.923	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc2nc(CO)[nH]c2c1)[C@@H](F)Br	1797389458	OODRSEIFXSPIPJ-AZKPJATDSA-N	439.285	1.998	50	20	IDGD	
C[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CO[Si](C)(C)C)N1CSCSC1	1797956819	FHLCRVGNFZTMFW-MPTYRVRUSA-N	447.699	1.471	50	20	IDGD	
Cc1cn(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@](C)(Cl)CCl)c(=O)nc1O	1800085145	SZLXHOVFXIOVHG-YFQWEKLQSA-N	431.320	1.132	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nc3ccccn3n1)C2	1800639495	GFSFWOFRTGHSQI-QVHKTLOISA-N	436.310	1.106	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COc1ccc(O)cc1)C2	1800754641	STVICXRGEKMTDE-JRATXPSKSA-N	427.295	1.144	50	20	IDGD	
CCOc1ccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Cl)C3)cc1OC	1800859635	OXVRERLKNVGGGD-GTYSZEQSSA-N	428.888	1.760	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cn3cc(Cl)ccc3n1)C2)C(Cl)Cl	1801014761	CDKAPMVEVPDONE-WDAIWFPHSA-N	431.707	1.995	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1n[nH]c3ccc(F)cc13)C2	1802336998	DJDXIHWDVNFHKO-QDMKHBRRSA-N	430.484	1.327	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1CCN(C(=O)[C@H](C)NC=O)[C@H]1c1cccnc1	1803016024	WGHCIQIAORITAM-VRKREXBASA-N	425.327	1.253	50	20	IDGD	
CCOC(CC(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]1c1cccnc1)OCC	1803146795	QKZKUAUBPQFRSL-GPMSIDNRSA-N	427.929	1.476	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)/C=C/C2CC2)[C@H]1c1cccnc1	1803189649	AXKWJMGPZYGAGO-DFUKUNQBSA-N	434.500	1.366	50	20	IDGD	
C=CCSCC(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1804172651	DVEHDLJWRSCTHD-NQIIRXRSSA-N	439.346	1.000	50	20	IDGD	
COC[C@H](NC(C)=O)C(=O)N1CCC2(CCCN(C(=O)[C@H](C)CBr)C2)CC1	1805385304	VYZIWHGFJPKQSL-ZBFHGGJFSA-N	446.386	1.400	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC2(CCCN(C(=O)c3ccns3)C2)CC1	1807885586	DFDCUJTYNVLVSQ-UHFFFAOYSA-N	428.518	1.300	50	20	IDGD	
CC(C)(C(=O)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1)c1ccccn1	1809979836	CRNNBYOALDEKOU-UHFFFAOYSA-N	449.360	1.584	50	20	IDGD	
CCOC(=O)N[C@H](O)C(=O)NC[C@@H]1CCN(C(=O)[C@H](Cl)CC)[C@@H]1c1cccnc1	1810100388	SNZCOTQIKRONRP-KLZNWCGWSA-N	426.901	1.169	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2ccccc2C(N)=O)[C@H]1c1cccnc1	1813034131	BLFZGLFWTUIKMD-SNRMKQJTSA-N	444.919	1.754	50	20	IDGD	
Cc1cnn(CC(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@@H](F)Br)CC3)c1	1815760174	PXAHIFHGQBJHLA-TVQRCGJNSA-N	430.303	1.951	50	20	IDGD	
COc1ncccc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1816430966	JYRWEZXAJKUUHS-SFHVURJKSA-N	449.276	1.113	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3cnn4ccncc34)sc2C1	1818507729	WSOXUCWYBVVOIS-JQWIXIFHSA-N	434.909	1.665	50	20	IDGD	
C[Si](C)(C)OCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(=O)n1O)CC2	1820160873	IICOSMHCTXOQTL-NSHDSACASA-N	436.566	1.619	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](O)N2CCOCC2)[nH]n1	1820865834	CFAGVTPEHDTYCB-XUWXXGDYSA-N	448.351	1.289	50	20	IDGD	
Cc1cc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@H](O)CCl)CC3)n(C(F)F)n1	1821567610	PWIIQULXPFKQMB-GZMMTYOYSA-N	433.868	1.869	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@H]1CCc2nc(NC(=O)c3cc(CO)on3)sc2C1	1821693777	XTPIASDADRUNTB-BDAKNGLRSA-N	443.323	1.880	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CC[C@H](N)C(N)=O)[nH]n1	1822088403	UPOCINVNOHUFEG-GMXVVIOVSA-N	443.346	1.168	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](C)n1cnnn1)CC2	1825453153	PXMLFUSSJKFYFI-AEJSXWLSSA-N	442.343	1.476	50	20	IDGD	
Cc1onc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)c1C	1827050377	PVSWVIJYLNCMAZ-HXUWFJFHSA-N	439.321	1.518	50	20	IDGD	
C=C[C@H](O)C(C)(C)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827057606	KZYRPQQTRIWEKN-RTWAWAEBSA-N	442.365	1.173	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnccc2F)CC1	1827326157	ZEWFKAPLKPJOKZ-LJQANCHMSA-N	433.528	1.827	50	20	IDGD	
CCc1ccnc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)c1	1827357201	LSSGVKPACXMEMG-QHCPKHFHSA-N	449.360	1.871	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(C)c3F)CCO2)C1	1830104126	WNQLNOCJISPFDT-JXFKEZNVSA-N	428.888	1.458	50	20	IDGD	
Cc1c(F)cccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)CCBr)C2)C1	1830155717	BRSJRQZQHRPJLF-LJQANCHMSA-N	443.313	1.989	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccccc3O)C2)C1	1830535863	VKWSKOZGGJRPOX-KUHUBIRLSA-N	441.322	1.493	50	20	IDGD	
CSc1ccc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)cc1	1830738650	RNAZGFSJXKJBGJ-PXNSSMCTSA-N	442.965	1.007	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccc(C#N)cc3)C2)C1	1831638108	AWDCTGSXNAYBQD-KNQAVFIVSA-N	433.936	1.965	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)Nc3ccccn3)C2)C1	1831650809	LGMQEMDDNOIQEL-LLGFUMIMSA-N	438.956	1.746	50	20	IDGD	
COC(=O)[C@@H]1CC[C@H](C(=O)NC2CCN(C3CCN(C(=O)C(Cl)Cl)CC3)CC2)C1	1833307478	UZJDASRZQHSCDK-UONOGXRCSA-N	448.391	1.951	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)[C@@H]3CCCS3(=O)=O)CC2)CC1	1833534644	JYRJOLYZURFKMR-MSOLQXFVSA-N	448.029	1.543	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3cnc[nH]3)CC2)CC1	1834170540	XOCJRLQUAKNIFJ-HNNXBMFYSA-N	426.359	1.768	50	20	IDGD	
CC(=O)N(C)[C@@H](C)C(=O)NC1CCN(C2CCN(C(=O)[C@@](C)(Cl)CCl)CC2)CC1	1835124063	LNFDCXDWCQOCQA-XOBRGWDASA-N	449.423	1.661	50	20	IDGD	
CC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](Br)Cc3ccccc3)C2)C1	1835204353	AZEOLDFPMRNWLU-IEBWSBKVSA-N	425.323	1.469	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cnn4cccnc34)CC2)CC1	1835536573	SPFZBXNZNZXFBJ-GOSISDBHSA-N	448.955	1.168	50	20	IDGD	
CC(C)N[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1)C(C)C	1835893059	PQLXNWHKDCHMDE-UWJYYQICSA-N	432.005	1.730	50	20	IDGD	
COc1cc(C#N)cc(C(=O)NC2CCN(C3CCN(C(=O)[C@H](O)CCl)CC3)CC2)c1	1836123236	VRWWSABPGDUIEY-HXUWFJFHSA-N	448.951	1.352	50	20	IDGD	
CC(C)Cc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)n(C)n1	1836337301	WVJCGXFYGWWFHU-VQIMIIECSA-N	430.908	1.223	50	20	IDGD	
C[C@H](C(=O)N1CCC(N2CCC(NC(=O)[C@@H](F)Br)CC2)CC1)n1ccnc1	1836414076	VXNQNPPXVVBCMB-CZUORRHYSA-N	444.349	1.706	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)C3=NN(C)C(=O)CC3)CC2)CC1	1837057714	SQELCHLKCZQBSJ-MRXNPFEDSA-N	426.945	1.611	50	20	IDGD	
O=C(C[C@@H]1CNc2ccccc2O1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1837352211	ZDBKAIHYVVYVOS-LXGCGDOSSA-N	441.887	1.240	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccnc(OC)c3)CCO2)C1	1837973993	NTGIHHCYOBAJDU-OXJNMPFZSA-N	425.913	1.568	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cn4cc(F)ccc4n3)C2)C1	1839146245	WWTPSVCVNPEXAO-FOIQADDNSA-N	438.887	1.561	50	20	IDGD	
COC1(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)CCC1	1839156497	RIHRQLMUPWEPIJ-HKUYNNGSSA-N	437.364	1.638	50	20	IDGD	
N#Cc1cc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)ccc1F	1839188191	PDNOUOUGVDBPFT-IBGZPJMESA-N	444.290	1.500	50	20	IDGD	
C=CCOCCCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839198534	HFHKNSDYPHRYCR-RDJZCZTQSA-N	437.306	1.116	50	20	IDGD	
C[C@]1(C(=O)N2CCOC[C@@]3(CN(C(=O)[C@@H](F)Br)CCO3)C2)CC=CCC1	1839203887	ZQLSHTUKWHVGGC-FHLIZLRMSA-N	433.318	1.880	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3n[nH]c4c(C)cccc34)CCO2)C1	1839596333	SDHDTYRVVTVWSY-HRAATJIYSA-N	434.924	1.959	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C1(F)CC1)CCO2	1839759070	WNSSEFYTQZCEEQ-JUALLIRVSA-N	449.429	1.830	50	20	IDGD	
C[C@@H](C(=O)N1CCOC[C@@]2(CN(C(=O)C(Cl)Cl)CCO2)C1)c1ccc(O)cc1	1840189318	KUIOJYBWIWNLMU-YJYMSZOUSA-N	431.316	1.756	50	20	IDGD	
C/C(=C\c1cccnc1)C(=O)N1CCO[C@@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1	1840413656	RBKUXHPRZQSBRT-YGYUYSJASA-N	447.608	1.793	50	20	IDGD	
CCOC(=O)c1c(CCC(=O)N2CC3(CCCN3C(=O)[C@@H](O)CCl)C2)c[nH]c1C	1841347701	BXIONFITMKADGC-HNNXBMFYSA-N	425.913	1.236	50	20	IDGD	
COC1(CC(=O)N2CC3(CCCN3C(=O)[C@H](F)Cl)C2)CN(C(=O)OC(C)(C)C)C1	1843364002	LTEPJESRXJCCMU-AWEZNQCLSA-N	433.908	1.750	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCCC12CN(C(=O)CNC(=O)c1cc(C)on1)C2	1846071090	WFDPVDRJGHODLI-GFCCVEGCSA-N	427.299	1.090	50	20	IDGD	
C[C@H](Br)C(=O)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1	1847037420	PHSBFTPHOZXYGD-MALLOTDXSA-N	425.279	1.803	50	20	IDGD	
COc1ccnc(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](C)CBr)c1OC	1847500057	ANSHIXMTLNFZMU-AVGNSLFASA-N	426.311	1.945	50	20	IDGD	
O=C(COC(=O)c1ccc(CS(=O)(=O)c2ccccc2)o1)NNC(=O)c1cccs1	10067657	CITKHWNIYTVKGE-UHFFFAOYSA-N	448.478	1.933	50	20	IDGD	
COc1ccc(C(=O)O)cc1S(=O)(=O)NNC(=O)c1cc(OC)c(OC)c(OC)c1	13359033	XFQXVNXPNPWMPU-UHFFFAOYSA-N	440.430	1.043	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)c1ccc(OCc2cn3ccccc3n2)cc1	16146017	RETDQXOVIIMCMH-HNNXBMFYSA-N	428.470	1.109	50	20	IDGD	
CN(CC(=O)NNC(=O)c1cnn(-c2ccccc2)c1)S(=O)(=O)c1ccc(Cl)cc1	17408023	JDXRMWALQMQLLW-UHFFFAOYSA-N	447.904	1.607	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)o1	105623940	HYWPCMAOVCEXQU-UHFFFAOYSA-N	448.545	1.981	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(CC(=O)NNC(=O)c2n[nH]c(=O)c3ccccc23)CC1	109282909	BHNMTAMEPPQESD-UHFFFAOYSA-N	429.477	1.721	50	20	IDGD	
CCOC(=O)C1=NN(c2ccccc2)[C@H](C(=O)NNC(=O)CNc2ccccc2OC)C1	110970496	XTJCXSPVRDIGAU-SFHVURJKSA-N	439.472	1.453	50	20	IDGD	
O=C(COC(=O)c1cnn(Cc2ccccc2)c1)NNC(=O)[C@H]1COc2ccccc2O1	115278987	YCOIPNIRNUDIPX-LJQANCHMSA-N	436.424	1.076	50	20	IDGD	
Cn1ccnc1[C@@H](NC(=O)NNC(=O)CNC(=O)c1cccs1)c1cccc(F)c1	725873494	OHZBWQCKFWKAQL-INIZCTEOSA-N	430.465	1.471	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)CCc2c(C)nc3ncnn3c2C)c1	728528598	IFUSTZSWYYDOJZ-UHFFFAOYSA-N	447.293	1.906	50	20	IDGD	
Cn1ccnc1[C@](O)(CCNC(=O)NNC(=O)Cn1ccc2ccccc21)C(F)(F)F	729496004	DMUFWOZUXSDTPH-GOSISDBHSA-N	438.410	1.545	50	20	IDGD	
O=C(CCCS(=O)(=O)c1ccc(Br)cc1)NNC(=O)c1cccnc1	730997515	XIWLUTMVGRUMSN-UHFFFAOYSA-N	426.292	1.859	50	20	IDGD	
CC(C)(C(=O)NNC(=O)NCCCN1CCN(c2ncccn2)CC1)c1ccccc1	731219239	VMVZESQQUCLICX-UHFFFAOYSA-N	425.537	1.297	50	20	IDGD	
N#Cc1ccccc1COc1cccc(C=NNC(=O)CSc2nnc(O)nc2O)c1	731314114	ANOSOWQAVFSJJA-UHFFFAOYSA-N	436.453	1.976	50	20	IDGD	
Cc1ccc(S(=O)(=O)NC[C@@H]2CCCN([C@H](C)C(=O)NNC(=O)CC(C)C)C2)cc1	731850167	PZNVVOABHZTUMI-MSOLQXFVSA-N	438.594	1.567	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C2CCN(c3cnccn3)CC2)cc1Br	732032515	AZSNRRGOOBWRAX-UHFFFAOYSA-N	434.294	1.925	50	20	IDGD	
O=C(NNC(=O)C1CCC1)c1ccccc1NS(=O)(=O)c1ccc2c(c1)OCCO2	732143841	GKHIRGCYUUUMCB-UHFFFAOYSA-N	431.470	1.820	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2ccc(CS(N)(=O)=O)cc2)cc1Br	732304997	CNGJKJJBYRVCFN-UHFFFAOYSA-N	442.291	1.321	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)NCCCNC(=O)c2cccc(F)c2)nc2ccccc21	732468802	KALPJKIFBRUQFJ-UHFFFAOYSA-N	426.452	1.405	50	20	IDGD	
O=C(NCCS(=O)(=O)NC[C@H]1CCCCO1)NNC(=O)C12CC3CC(CC(C3)C1)C2	732474088	GJPILJVQIRYFAZ-VQBCORBOSA-N	442.582	1.022	50	20	IDGD	
O=C(NNC(=O)[C@@H]1C[C@@H]1c1ccc(OCc2ccccc2)cc1)N[C@@H]1CCS(=O)(=O)C1	732554148	ZGBVTCVQAOHCDB-MISYRCLQSA-N	443.525	1.887	50	20	IDGD	
CCC[C@@H](NC(=O)Cc1ccccc1)C(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	732676023	AHSASHWUZDQCGM-GOSISDBHSA-N	435.484	1.867	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)Cn1nc(C)c(Cl)c1C	733522431	KTKJYNGTXACWFM-UHFFFAOYSA-N	429.260	1.820	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)C1	734163599	NOJXQYRDTSQPTA-CQSZACIVSA-N	430.469	1.006	50	20	IDGD	
O=C(CCCCCNC(=O)NC1CCCCC1)NNC(=O)c1ccc(-n2cnnn2)cc1	734418053	AIGPOGYLOWVPQD-UHFFFAOYSA-N	442.524	1.616	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)c3n[nH]c(C)c3C)c2)cc1	734418222	OHRQVBHFHUPKKV-UHFFFAOYSA-N	443.485	1.911	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)N[C@H]3CCN(CCN4CCOCC4)C3)cc2C1	734686740	TUHIQNSMLZEOQY-WBVHZDCISA-N	435.594	1.223	50	20	IDGD	
CN(C)CC[C@@H](NC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)C(C)(C)C	734954472	UZJIANVXUVVMOI-HXUWFJFHSA-N	432.613	1.896	50	20	IDGD	
C[C@H](CN1CCN(c2ccccn2)CC1)NC(=O)NN=c1sc2ccccc2n1C	735517706	FLXSELHMJCKNAQ-MRXNPFEDSA-N	425.562	1.960	50	20	IDGD	
Cn1cc(N2CC[C@H](NC(=O)NNC(=O)COc3ccccc3-c3ccccc3)C2=O)cn1	735583838	HPGOTQRLTHASLE-IBGZPJMESA-N	448.483	1.602	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)[C@@H]2CCC[C@H]2NC(=O)OC(C)(C)C)n1	740296476	LBVRVTZECUNYNV-CHWSQXEVSA-N	440.522	1.378	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)COc1ccccc1O)[C@H]1CN(Cc2ccccc2)CCO1	741276629	AFRVJVGASHNUCK-OXQOHEQNSA-N	428.489	1.391	50	20	IDGD	
O=C(COC(=O)[C@@H]1CN(Cc2ccccc2)CCO1)NNC(=O)c1cccc(Cl)c1	741382952	KFCHJHUYJALBMX-SFHVURJKSA-N	431.876	1.545	50	20	IDGD	
CC1CCN(c2nnc(SCC(=O)NNC(=O)C(C)(C)C)n2C[C@H]2CCCO2)CC1	742452459	SGDPMQYNRUSYHB-OAHLLOKOSA-N	438.598	1.979	50	20	IDGD	
CSc1ncc(Cl)c(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)n1	744621738	FRQYBYMCARMNEN-UHFFFAOYSA-N	443.938	1.630	50	20	IDGD	
O=C(CCOc1ccccc1)NNC(=O)NCCCN1CCN(c2ccncc2)CC1	748463511	UIEFNSNKYVOXJX-UHFFFAOYSA-N	426.521	1.393	50	20	IDGD	
CCn1cc(S(=O)(=O)NC(=O)/C(C#N)=C/c2cc(C)n(C[C@@H]3CCCO3)c2C)cn1	749216268	GYZSQCOSBIGBTA-GONKEYIRSA-N	431.518	1.912	50	20	IDGD	
CC[C@H](Oc1ccccc1C)C(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1	749330423	NURMSGICNDBNLG-SFHVURJKSA-N	433.530	1.929	50	20	IDGD	
C[C@H](NC(=S)NNC(=O)CCNS(=O)(=O)c1cccc(Br)c1)C1CC1	751620683	LIKRMOFHFXRWKY-JTQLQIEISA-N	449.396	1.411	50	20	IDGD	
Cc1ccc(C(=O)N([C@H]2CCS(=O)(=O)C2)N(C)C)cc1S(=O)(=O)NC1CCCC1	752282833	XCHXVCWFAXBEOX-KRWDZBQOSA-N	443.591	1.322	50	20	IDGD	
COc1cc(OC)cc(N2C[C@H](C(=O)NNC(=O)COc3ccc(C)cc3)CC2=O)c1	752400624	SDSQJRDXOIRYTA-OAHLLOKOSA-N	427.457	1.592	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)N[C@@H]3CCOC3)c2)cc1	752703343	HYEFDGZWWYDWHG-OAHLLOKOSA-N	434.474	1.229	50	20	IDGD	
Cc1ccc(C)n1-c1ccc(C(=O)NNC(=O)NC[C@H]2CCN(S(C)(=O)=O)C2)cc1	753671003	PPMMZVFIOZIBJQ-MRXNPFEDSA-N	433.534	1.320	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)N1CCC[C@H](S(=O)(=O)N2CCc3ccccc32)C1	754189115	YPFXDPXHGPUEJP-SFHVURJKSA-N	443.529	1.222	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)c2cnn(C)c2)cc1S(=O)(=O)N1CCCCCC1	755393170	LOJOCFGKOVKMSG-UHFFFAOYSA-N	434.522	1.760	50	20	IDGD	
C[C@@H](C(=O)N1CCN(S(=O)(=O)CBr)CC1)c1ccc([N+](=O)[O-])cc1F	755894205	MYUZTLNRSYZXCG-SNVBAGLBSA-N	438.275	1.664	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)NC2CCN(S(=O)(=O)C(C)(C)C)CC2)c1	755896363	RTFUOUORYNCMQS-UHFFFAOYSA-N	426.539	1.297	50	20	IDGD	
C=CCN(C)S(=O)(=O)c1ccc(NC(=O)NNC(=O)COc2ccc(F)cc2)cc1	755933888	RQCNEASAXIUDLC-UHFFFAOYSA-N	436.465	1.864	50	20	IDGD	
CN1CC(=O)N(c2cccc(NC(=O)NNC(=O)c3nnc(O)c4ccccc34)c2)C1=O	755995889	STJZUORXYQNNME-UHFFFAOYSA-N	435.400	1.200	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)c1O	756204615	CZVVCWFPOTVHJY-UHFFFAOYSA-N	434.474	1.102	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)N[C@@H]2CCN(c3c(F)cccc3F)C2=O)cc1	756210140	FCLYOQHEMIPBAO-MRXNPFEDSA-N	429.383	1.351	50	20	IDGD	
COC(=O)CN1CCN(c2ccc(NC(=O)NNC(=O)c3ccccc3C)cc2)CC1	756393886	SWFOVQQATICFED-UHFFFAOYSA-N	425.489	1.757	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)Nc1ccc(S(=O)(=O)NC2CC2)cc1	756775041	GTFWOWZCFNWIOB-KRWDZBQOSA-N	432.458	1.120	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)[nH]n1)Nc1ccc(S(=O)(=O)NC2CC2)cc1	756777141	VPQFYXMQWIRRGC-UHFFFAOYSA-N	440.485	1.984	50	20	IDGD	
COc1cccc(OC)c1CC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1	756900356	ZEVRUXVERYASJX-UHFFFAOYSA-N	435.502	1.023	50	20	IDGD	
CS(=O)(=O)N1CCc2c(NC(=O)NNC(=O)Cn3ccc4ccccc43)cccc21	758301277	LNQNFQLIUDVYSV-UHFFFAOYSA-N	427.486	1.816	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)N2CCN(c3nc(N)ns3)CC2)c(C)n1C[C@H]1CCCO1	758588881	LRTAIVWYNHKTOG-ZKTNYTPDSA-N	441.561	1.973	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C[C@@H](C)NS(=O)(=O)c2cccnc2Cl)cc1	760286415	YYXRVAMWOKITCP-CYBMUJFWSA-N	440.909	1.327	50	20	IDGD	
C[C@@H](NC(=O)OC(C)(C)C)[C@@H]1CN(C(=O)NNC(=O)Cn2ccc3ccccc32)CCO1	760758267	XJNNMHVFHZCLNK-QAPCUYQASA-N	445.520	1.996	50	20	IDGD	
COc1ccc(C(=O)C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1Cl	760802284	WQEZPXXPCSMDAM-UHFFFAOYSA-N	439.877	1.243	50	20	IDGD	
C[C@]1(c2ccc(Br)cc2)NC(=O)N(CC(=O)NNc2ncc(F)cn2)C1=O	760906917	WUXNVHKIGNTYKC-MRXNPFEDSA-N	437.229	1.289	50	20	IDGD	
O=C(NNC(=O)c1ccccc1)C(=O)Nc1ccc(N2CCOCC2)cc1C(F)(F)F	763431902	WEONADVYUGEFLT-UHFFFAOYSA-N	436.390	1.942	50	20	IDGD	
CN1CCN(Cc2ccc(CNC(=O)NNC(=O)CSc3ccccc3O)cc2)CC1	763472667	IWBSJDHAVONCST-UHFFFAOYSA-N	443.573	1.762	50	20	IDGD	
COC(=O)c1cc(C)ccc1NC(=O)C(=O)NNC(=O)c1ccccc1Br	763482885	MSUPDLXLMVALAI-UHFFFAOYSA-N	434.246	1.944	50	20	IDGD	
C[C@H](CC(=O)NNC(=O)C(=O)Nc1ccccn1)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	763565308	ZJMBBUIBBHVXEI-HUUCEWRRSA-N	433.509	1.841	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cc(C(=O)NCC(F)(F)F)ccc2C)c(C)o1	763584274	YVXKKRJWXXLGAD-UHFFFAOYSA-N	440.378	1.897	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(-c3nccs3)cc2)cc1	763660841	HTGGQVNKLPHKDG-UHFFFAOYSA-N	426.454	1.984	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(C(=O)OC)c(F)cc1F	763717544	ZJRSNWCLAIKOBU-UHFFFAOYSA-N	435.383	1.479	50	20	IDGD	
O=C(NNC(=O)c1cccc(Cl)c1)C(=O)Nc1ccc(CN2C(=O)CSC2=O)cc1	763747611	BZZIIPWOXZDNNF-UHFFFAOYSA-N	446.872	1.935	50	20	IDGD	
CCCOC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(OC)cc(OC)c2)cc1	763775193	NHMWOZUOWHXTAA-UHFFFAOYSA-N	429.429	1.670	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)ccc1NC(C)=O	763842222	XKNOKUNZZPBGMW-AWEZNQCLSA-N	442.472	1.824	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccn(Cc2ccccn2)n1	763852546	YIYSRGNBNVLLEP-CYBMUJFWSA-N	426.408	1.019	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)NNC(=O)C(=O)Nc1ccnn1Cc1ccccc1F	763861401	QLFAHYZYZFVEDZ-UHFFFAOYSA-N	434.431	1.880	50	20	IDGD	
CCc1cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(Br)c2)n(C)n1	763884852	YPXAYPRSDYHQIT-JTQLQIEISA-N	438.282	1.298	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cnc(-c3ccccc3)nc2)cc1OC	763910931	AJIKHBADVCFJPZ-UHFFFAOYSA-N	435.440	1.951	50	20	IDGD	
COc1ccc(CN(C)C)cc1NC(=O)C(=O)NNC(=O)c1cc(Br)c[nH]1	763996050	UCNYDOYOQFWRFW-UHFFFAOYSA-N	438.282	1.247	50	20	IDGD	
CCOC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2OC)cc1	764010497	AEDYAVANMKXFPE-UHFFFAOYSA-N	449.847	1.690	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)CCc2ccc(OC)cc2)cc1	764132371	UDKOFLUSFNPIKP-UHFFFAOYSA-N	448.501	1.176	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)CC(C)(C)C)c(C(=O)N2CCCCC2)cc1OC	764200338	ZIXMRHCKZXKYGP-UHFFFAOYSA-N	448.520	1.852	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)C(=O)Nc1ccnn1C1CCCCC1	764203067	IPYWPPICFONKGZ-UHFFFAOYSA-N	436.513	1.779	50	20	IDGD	
O=C(Cc1cc[nH]n1)NNC(=O)C(=O)Nc1cccc(C(=O)Nc2ccc(Cl)cn2)c1	764285743	KLPNBIDWAUZILF-UHFFFAOYSA-N	441.835	1.039	50	20	IDGD	
C[C@H]1CN(c2ccccc2NC(=O)C(=O)NNC(=O)Cc2ccccc2F)C[C@@H](C)O1	764320013	WDCZKWNKEBSOSH-GASCZTMLSA-N	428.464	1.768	50	20	IDGD	
CCOC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)cc1C#N	764349239	GYVHSIJELBOUTC-UHFFFAOYSA-N	445.819	1.885	50	20	IDGD	
CN(Cc1ccccc1NC(=O)C(=O)NNC(=O)Cc1ccncc1)C(=O)OC(C)(C)C	764352975	GEPADZTXTHGDHV-UHFFFAOYSA-N	441.488	1.777	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)cc1	765317009	IJCXZVJMCXFQSH-UHFFFAOYSA-N	442.538	1.439	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)S(=O)(=O)c1ccc(F)cc1	765324450	WJETYCINMCUYSW-LBPRGKRZSA-N	431.486	1.440	50	20	IDGD	
CC(C)(C)OC(=O)N1CCO[C@@H](C(=O)NNC(=O)c2cc(F)ccc2Br)C1	765406683	SYBWFIDYXVDUFZ-CYBMUJFWSA-N	446.273	1.985	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)CCC(=O)Nc2ccc3nc(O)[nH]c3n2)c1	765469582	RDZWOBLABVUIJU-UHFFFAOYSA-N	426.433	1.225	50	20	IDGD	
O=C(Cn1cc(Br)ccc1=O)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	765620836	SDCDNEIAHYLIGG-UHFFFAOYSA-N	434.225	1.601	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)N[C@H]1CCN(C2CCCCC2)C1=O	765887026	WWDFGDSWSQAQIS-INIZCTEOSA-N	426.477	1.456	50	20	IDGD	
CC(C)Oc1cncc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)c1	766636188	MERBMNKSCOZMJG-UHFFFAOYSA-N	425.489	1.088	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@@](C)(O)[C@@H](C)c3ccccc3)CC2)cc1	766644036	OCIDGJVNBISBIX-CPJSRVTESA-N	438.572	1.815	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)CN3C(=O)[C@@H]4[C@@H](C3=O)[C@H]3C=C[C@H]4C3)n[nH]2)cc1	768268737	UHQZHWXHBQZXBO-SLUIBLPYSA-N	433.468	1.207	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)Sc1nnc(-c2cc(-c3ccc(Cl)cc3)[nH]n2)n1N	768439181	DLUGQPCTWCFDQU-SECBINFHSA-N	434.913	1.740	50	20	IDGD	
CCOC(=O)c1[nH]c(C)c(S(=O)(=O)NNC(=O)c2ccc(OCC)c(OC)c2)c1C	768495706	FMIKBAVNUSERGM-UHFFFAOYSA-N	439.490	1.839	50	20	IDGD	
CN(C)C(=O)COc1ccc(C(F)(F)C(=O)OCC(=O)NNC(=O)c2ccccc2)cc1	769135711	SBJSSWXFWVIGQK-UHFFFAOYSA-N	449.410	1.250	50	20	IDGD	
C[C@@H](NC(=O)NNc1nc(O)c2cnn(C)c2n1)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	770370223	PPLTXGHUEPQSJY-VXGBXAGGSA-N	434.501	1.731	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)NNC(=O)[C@H]1COc2ccccc2O1	770650552	VSKYLQYRBYJVPL-MEDUHNTESA-N	434.836	1.309	50	20	IDGD	
CS(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)c2ccc3ccccc3n2)cc1F	771141292	JIILWSBWDMWFRZ-UHFFFAOYSA-N	438.462	1.369	50	20	IDGD	
Cn1cnc(-c2ccc(NC(=O)NNC(=O)CCN3CCN(c4ccccc4)CC3)cc2)n1	771769194	SOFADBRCYVHWBD-UHFFFAOYSA-N	448.531	1.847	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)/C(=C\c1cccs1)n1nnnc1-c1ccccc1	771914463	RZIIKQGPNCXKCO-MLDYKZIASA-N	440.485	1.889	50	20	IDGD	
Cc1ccc(CCC(=O)NCC(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)cc1	772188729	UAFIDFWEJQWYDC-UHFFFAOYSA-N	430.892	1.161	50	20	IDGD	
COC(=O)[C@H]1CN(C(=O)C(=O)NNc2ncc(Cl)cc2Cl)c2ccccc2O1	773677771	JRIIQICLSOHPKI-CYBMUJFWSA-N	425.228	1.799	50	20	IDGD	
O=C(NNC(=O)c1cnn2c(=O)cc[nH]c12)c1nc(-c2ccccc2)n(-c2ccccc2)n1	773711480	GNXYSIUXUZVCJL-UHFFFAOYSA-N	440.423	1.345	50	20	IDGD	
COC(=O)c1ccccc1CC(=O)NNC(=O)CN1CCN(Cc2ccc(C)cc2)CC1	775779998	AFZPMBPCTARTHY-UHFFFAOYSA-N	438.528	1.289	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)c1nnn(-c2cccc(F)c2)c1C(F)(F)F	778438277	NMLWLTZNIQESSJ-UHFFFAOYSA-N	446.361	1.711	50	20	IDGD	
COc1cc(C=NNC(=O)[C@@H](C)CN2CCOCC2)c([N+](=O)[O-])cc1OCC(F)F	778541042	WKTWFICYNRPAGT-LBPRGKRZSA-N	430.408	1.666	50	20	IDGD	
CN(C)C(=O)COc1ccccc1C(F)(F)C(=O)NNc1nc2ccccc2c(=O)n1C	778742770	LVCNLXMCQSIOSO-UHFFFAOYSA-N	445.426	1.636	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)[C@H]3CCN3C(=O)OC(C)(C)C)n[nH]2)cc1OC	780976490	TYECZGQJLVHCKP-OAHLLOKOSA-N	445.476	1.864	50	20	IDGD	
Cn1nncc1S(=O)(=O)NC(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccccc1	781738042	LNAVKNHXVXUGQS-XNTDXEJSSA-N	436.457	1.004	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H](NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)C1	782547574	XWSPVGNQMVHZRZ-HUUCEWRRSA-N	444.496	1.442	50	20	IDGD	
CSc1cccc(NC(=O)C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)c1	782896927	KVRXRDBOPNIUSM-UHFFFAOYSA-N	435.531	1.410	50	20	IDGD	
N#C[C@@H](c1ccccc1)c1ccc(NC(=O)C(=O)NNC(=O)CNC(=O)c2ccco2)cc1	784001936	GIWXVLZMKRNDSF-SFHVURJKSA-N	445.435	1.451	50	20	IDGD	
NS(=O)(=O)c1cc(F)cc(NC(=O)C(=O)NNc2ccc(F)cc2Br)c1	784802491	HOZOPQCFKSMRQN-UHFFFAOYSA-N	449.233	1.457	50	20	IDGD	
COc1ccc(C(=O)N2CCN(C)CC2)cc1NC(=O)C(=O)NNc1ncccc1Cl	784818085	MLZURBQZJLJWFL-UHFFFAOYSA-N	446.895	1.213	50	20	IDGD	
C#CCOc1ccc(F)cc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)C(F)F)cc1	784832719	DUWIFSNVBZJQEI-UHFFFAOYSA-N	441.387	1.916	50	20	IDGD	
CC[C@H](C)NS(=O)(=O)c1cccc(NC(=O)C(=O)NNc2cc(Cl)ccn2)c1	784856279	JYYVVZSOUVUCOR-NSHDSACASA-N	425.898	1.894	50	20	IDGD	
COC(=O)c1cc(F)ccc1NC(=O)C(=O)NNc1c(OC)cccc1S(C)(=O)=O	785330794	MKSAHFXZQKLFCQ-UHFFFAOYSA-N	439.421	1.106	50	20	IDGD	
CCS(=O)(=O)CCn1cc(C)c(NC(=O)NNC(=O)c2ccc(Cl)cc2F)n1	786735648	ABPGNYNKYRQNNS-UHFFFAOYSA-N	431.877	1.885	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCC3)cccc1N1CCNC1=O	787541109	MDPFKAUSTYJPGV-UHFFFAOYSA-N	427.486	1.475	50	20	IDGD	
Cc1ccc(N2CCNC2=O)cc1NC(=O)C(=O)NNC(=O)c1cc(Cl)ccc1O	787543361	ITNYFPZHQJZOQL-UHFFFAOYSA-N	431.836	1.283	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(C(=O)OC)c(C)cc2C)o1	788333310	LNCMNRGSGJBNNQ-UHFFFAOYSA-N	444.488	1.925	50	20	IDGD	
Nc1nc(Cl)cc(NNC(=O)Nc2ccc(N3CCOCC3)cc2N2CCOCC2)n1	789008759	UDKVPXNULOXLKB-UHFFFAOYSA-N	448.915	1.534	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)[C@H]1CC12CN(C(=O)OC(C)(C)C)C2	789834114	AQJWSQQAZAMMKF-CYBMUJFWSA-N	426.514	1.696	50	20	IDGD	
CN1CCC(Oc2ccc(CNC(=O)NNC(=O)CNC(=O)c3ccco3)cc2)CC1	790690714	DTULJGXIGLKRJD-UHFFFAOYSA-N	429.477	1.013	50	20	IDGD	
CCc1ccccc1N1C[C@H](C(=O)NNc2ccccc2S(=O)(=O)N(C)C)CC1=O	795168750	TWPPYNJMSFGNTC-MRXNPFEDSA-N	430.530	1.996	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cnc(C(C)C)nc2)cc1Br	797003395	CCXAHGDSNHMXJW-UHFFFAOYSA-N	436.266	1.771	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)CSc2ccccc2OC)cc1OC	797011953	NRGVLXSNQDURBN-UHFFFAOYSA-N	447.469	1.369	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(F)cc2I)n1	797370297	JVKBTDXILDRPPF-UHFFFAOYSA-N	442.188	1.533	50	20	IDGD	
C=CCNC(=S)NNC(=O)[C@H]1Cc2ccccc2CN1S(=O)(=O)c1ccc(F)cc1	798304456	STCRSJRVBZQJAR-GOSISDBHSA-N	448.545	1.623	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)Cc2c(C)[nH]c(-c3ccncc3)nc2=O)cc1C	798308821	BRFAPAQOINYNDR-UHFFFAOYSA-N	434.456	1.086	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@@H]2C(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1	798349030	RXCSGCNQGOEWLL-VQIMIIECSA-N	425.441	1.287	50	20	IDGD	
COC(=O)c1ccc(S(=O)(=O)NNC(=O)c2cccc(OC(F)F)c2)cc1OC	799123458	ZCSZTFXLHNPANW-UHFFFAOYSA-N	430.385	1.707	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNS(=O)(=O)c1ccc(OCCBr)cc1	799532252	PCIWDMNCJUDGQC-UHFFFAOYSA-N	436.328	1.075	50	20	IDGD	
CCCCNS(=O)(=O)c1ccc(C)c(NC(=O)C(=O)NNc2nc3ccccn3n2)c1	799835342	GMLZGBKVMYNSCE-UHFFFAOYSA-N	445.505	1.198	50	20	IDGD	
C[C@H]1CCCCN1S(=O)(=O)c1cccc(C(=O)NNc2ccc(-n3ccnc3)nn2)c1	804953292	KLZDAOVLGNDZGH-HNNXBMFYSA-N	441.517	1.982	50	20	IDGD	
Cc1cccc(N2CCN(S(=O)(=O)CC(=O)NNc3nccnc3C3CCC3)CC2)c1	805463180	MFJTWMSRAVKWGK-UHFFFAOYSA-N	444.561	1.648	50	20	IDGD	
COc1ccc(C(=O)NNc2nccnc2C2CCC2)cc1S(=O)(=O)N1CCOCC1	805464274	FUZQHSOGSZRANO-UHFFFAOYSA-N	447.517	1.531	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C(=O)Nc1cc(CS(C)(=O)=O)ccc1OC)c1ccccc1	806979797	GKLZDFACIKCQSA-INIZCTEOSA-N	447.513	1.520	50	20	IDGD	
COc1ccnc(NNC(=O)NCC(=O)Nc2ccc(I)cc2)n1	807240335	LBXCKTTWQAWWPQ-UHFFFAOYSA-N	442.217	1.355	50	20	IDGD	
CN(C1CCN(C(=O)OC(C)(C)C)CC1)S(=O)(=O)NNC(=O)c1ccccc1F	808069340	VCAJCXCSZVOGFD-UHFFFAOYSA-N	430.502	1.636	50	20	IDGD	
COC[C@]1(C(=O)NNC(=O)[C@H]2COc3ccccc3O2)CCN(C(=O)OC(C)(C)C)C1	809950819	ZIDSPHXRFMVIAI-IERDGZPVSA-N	435.477	1.247	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCCC[C@H]2COC(=O)NC2CCCC2)n1	810035000	YFQAIZBQFVFHTB-INIZCTEOSA-N	437.566	1.665	50	20	IDGD	
N#Cc1cc(Oc2ccc(NC(=O)C(=O)NNC(=O)COc3ccccc3O)cc2)ccn1	810387066	DHDONDCBTFNVEO-UHFFFAOYSA-N	447.407	1.616	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3nc(C)nn3c2)cc1Br	810387163	IPCKOLCVUGTOQY-UHFFFAOYSA-N	447.249	1.209	50	20	IDGD	
COCN1C(=O)CCc2cc(NC(=O)NNc3ccc(S(=O)(=O)N(C)C)cc3)ccc21	812976455	SLTKCTVJOJYOEP-UHFFFAOYSA-N	447.517	1.969	50	20	IDGD	
CCCc1nc(C)c(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)o1	814194838	NZLFKTYMPNUNBE-UHFFFAOYSA-N	436.490	1.031	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cn(Cc4ccccc4)nn3)n[nH]2)cc1	815568461	IPNCCRMMRPTIPF-UHFFFAOYSA-N	444.455	1.425	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2F)nnn1Cc1ccccc1F	815570799	MOGKCNZFRNFGGA-UHFFFAOYSA-N	448.817	1.966	50	20	IDGD	
COc1cccc(/C=C(\C#N)C(=O)O[C@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)c1	849204088	QHPUXYWPRGJWEE-QQFZQELXSA-N	429.454	1.820	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2CCN(C(C)C)C[C@H]2c2cnn(C)c2)cc1	849487540	OWNZXXWJGVZUIH-OALUTQOASA-N	426.521	1.329	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)c2cnc3c(c2)c(O)nc(=O)n3C2CC2)cc1OC	894104631	GQVFEEVCGCQLDR-UHFFFAOYSA-N	439.428	1.314	50	20	IDGD	
CN1CC[C@H](C(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)CC1=O	906969622	KQYWTFATHHOXGZ-LBPRGKRZSA-N	436.515	1.178	50	20	IDGD	
CCN(CC(=O)N[C@H]1CCS(=O)(=O)C1)C(=O)/C(C#N)=C/c1cc(C)n(CC(C)C)c1C	912663488	GSNXSYDOABMDIG-POUSBKIOSA-N	448.589	1.820	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2ccc(I)cc2)C[C@@H](C)O1	912921764	WAMCPUGFHCUWCZ-TXEJJXNPSA-N	431.274	1.552	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)CNS(=O)(=O)c2ccc(Cl)cc2)cc1	913033566	RSSHFGPGTNFNFZ-UHFFFAOYSA-N	427.935	1.866	50	20	IDGD	
O=C(NNc1ccnc2cc(Cl)ccc12)C1=NN([C@@H]2CCS(=O)(=O)C2)C(=O)CC1	913188090	GTMPCQAUWXKFQO-GFCCVEGCSA-N	435.893	1.497	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)NCCc1cn2c(n1)CCCC2	914541021	UTMWTLUMAZIGTA-UHFFFAOYSA-N	436.310	1.934	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)ccc1Cl	914782039	ZDKPXXIDVFJDLO-UHFFFAOYSA-N	437.840	1.591	50	20	IDGD	
O=C(NNC(=S)Nc1cc(S(=O)(=O)N2CCOCC2)ccc1Cl)C1CCCC1	914836853	RJTXOTKRVOUYSW-UHFFFAOYSA-N	446.982	1.869	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)[C@@H]1CCCN1C(=O)C(C)(C)C	915014104	IQGFCZZMGXRSRS-AWEZNQCLSA-N	439.896	1.690	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)c2sccc2-n2cnnn2)cc(OCC)c1OCC	915274207	RHAVKXXAGRNBCY-UHFFFAOYSA-N	446.489	1.995	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NC[C@H](c2ccccc2)N2CCCC2)c2ccccc2c1=O	915878679	USNIOXRCESYFHE-LJQANCHMSA-N	434.500	1.715	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2ccc(C)c(S(C)(=O)=O)c2)c2ccccc2c1=O	916035479	RKNIUPJGKVUCTB-UHFFFAOYSA-N	442.497	1.593	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)NCC2(NS(C)(=O)=O)CCCCC2)cc1OC	916253907	RYSLEWLXDSJTSI-UHFFFAOYSA-N	442.538	1.290	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCCNC(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)cc1	916276694	HHRCIAODXHUBTG-QGZVFWFLSA-N	448.545	1.688	50	20	IDGD	
CCC(=O)Nc1cccc(CNC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)c1	916381890	YDIXCQUYMVYSQG-UHFFFAOYSA-N	446.533	1.781	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCc2ccc(-n3cccn3)cc2)nc1	916519283	MLFQVKRSLNBSKN-UHFFFAOYSA-N	429.506	1.780	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)c2ccc(CSc3nncn3C)cc2)c(C(F)(F)F)n1	917365733	SPCMCIDJOGQHAJ-UHFFFAOYSA-N	439.423	1.935	50	20	IDGD	
COc1cc(C(=O)NCC(=O)NNC(=O)c2ccc(Cl)cc2O)cc(OC)c1OC	918358289	OMJDCLYIZUGRMP-UHFFFAOYSA-N	437.836	1.262	50	20	IDGD	
CNC(=O)NNC(=O)CSc1nc2ccccc2c(=O)n1Cc1ccccc1OC	919877939	OXTXIVJWYWYDRV-UHFFFAOYSA-N	427.486	1.506	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@@H]2C(=O)NNC(=O)NCCc2cccs2)c(OC)c1	920859322	DGHHEZQODFKQLW-QGZVFWFLSA-N	446.529	1.943	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NNC(=O)NCCc2cccs2)s1	920859344	GPVWQLPEPVNBRZ-AWEZNQCLSA-N	442.588	1.844	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)[C@@H](Cc1ccccc1)NC(=O)c1cccnc1	921304063	BWCWWRVWAKQWDR-LJQANCHMSA-N	442.479	1.840	50	20	IDGD	
COc1ccc(Br)c(S(=O)(=O)NNC(=O)c2n[nH]c3c2CCCC3)c1	1318909177	KJUNANKVOAYYHN-UHFFFAOYSA-N	429.296	1.683	50	20	IDGD	
CN(C)CCCOc1cnccc1CNC(=O)NNC(=O)c1cncn1-c1ccccc1	1323989288	TUONQFIQNIJFTR-UHFFFAOYSA-N	437.504	1.742	50	20	IDGD	
O=C(c1ccc2cncn2c1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1778692352	KZRGUJDZQCPENA-RHSMWYFYSA-N	425.258	1.468	50	20	IDGD	
CCc1cc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)nn1C	1779830311	VZEXQGWBWSEZDS-UGSOOPFHSA-N	427.343	1.457	50	20	IDGD	
O=C(c1cncc2cnccc12)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1780014419	ITJHKFXCEFWOQQ-CRAIPNDOSA-N	437.269	1.764	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Cl)CCO2	1780097709	FSWZUOXWHMBSBI-MAUKXSAKSA-N	443.815	1.498	50	20	IDGD	
COc1cc(C#N)cc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)c1	1780172917	KWOMPJQIYBIFOG-YJBOKZPZSA-N	440.269	1.701	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)C1CCC(O)CC1)C2)[C@H](F)Br	1780777704	ZKMQSSAWDFTPHD-UPYBYFBQSA-N	435.334	1.742	50	20	IDGD	
Cc1n[nH]c(C)c1CC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCBr)C2	1780826069	HEKYUUWCWFROIF-VQIMIIECSA-N	441.370	1.868	50	20	IDGD	
O=C(c1noc2c1CCCC2)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781331068	KLGGUVCPFPBIAB-WMLDXEAASA-N	430.274	1.687	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)cc1	1781333965	IXSTWWBRKGBZSP-CRAIPNDOSA-N	442.285	1.779	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C=C/c1cnc[nH]1)C2	1782001230	BXUFNVGCYCGNJH-MBTYCKMQSA-N	425.327	1.720	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cnc(OC)c(F)c3)CCO2)C1	1783344952	UUYXNMJEUNNUBC-UGSOOPFHSA-N	444.301	1.846	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cccc4c3OCCO4)CCO2)C1	1783534115	FEHCLFNNZQHUBG-YJYMSZOUSA-N	439.306	1.685	50	20	IDGD	
Cc1cccn2ncc(C(=O)N3CCO[C@]4(CCN(C(=O)[C@H](C)Br)C4)C3)c12	1783536222	IBAJDLDDJZZODS-LIRRHRJNSA-N	435.322	1.870	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cc(-c4ccccn4)[nH]n3)CCO2)C1	1783877794	PYFOMHPWGDTFPG-JLTOFOAXSA-N	433.896	1.169	50	20	IDGD	
Cc1nn(C)c(C)c1CC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2	1784509875	VOPINUYLAHKKOQ-ORAYPTAESA-N	441.370	1.440	50	20	IDGD	
C[C@@H](Oc1cccnc1)C(=O)N1CC[C@]2(CN(C(=O)CCBr)CCO2)C1	1784549106	XHSAVXAJFIZVCQ-KDOFPFPSSA-N	426.311	1.464	50	20	IDGD	
Cc1ccc2c(/C=C/C(=O)N3CC[C@]4(C3)CN(C(=O)[C@@H](O)CCl)CCO4)c[nH]c2c1	1785664014	PQHQAYHLYRZXPW-WJBBITPNSA-N	431.920	1.919	50	20	IDGD	
Cn1ncc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCBr)[C@H]3C2)c1Cl	1786406364	PMEMBZRXBBKZMS-DRZSPHRISA-N	433.734	1.452	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C3=C4c5ccccc5C(=O)N4CC3)C[C@@H]21)[C@@H](F)Cl	1787447963	OPZQEVZSLJHFOL-SJIKZXFPSA-N	447.894	1.771	50	20	IDGD	
Cc1cnn(CC(=O)NC2(c3ccc(NC(=O)c4ccc(B(O)O)cc4)cc3)CCC2)c1	1788140604	AOIFNCSCADSHIZ-UHFFFAOYSA-N	432.289	1.319	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1CCN(C(=O)OCC)CC1)C2	1793455667	QJOWLGYLMTVUBN-XMTFNYHQSA-N	443.972	1.852	50	20	IDGD	
CS(=O)(=O)CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C(C#N)=C/c1ccc(F)cc1F)C2	1795791353	RCFLTGWMHBPRHS-RMWXTBGQSA-N	437.468	1.555	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccnc3c(O)cccc13)C2	1797957389	MZJPIBDZFCZOBA-YVWYUNDQSA-N	443.576	1.995	50	20	IDGD	
C[C@H](Nc1ccccn1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2	1797973122	UEIDZKBRYCZFOH-ZJOBFFGXSA-N	425.327	1.257	50	20	IDGD	
C[C@@H](Cc1ccncc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Br	1799347227	NCWQWQLOENNIOV-HVQZGBDUSA-N	428.302	1.540	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(F)c1[N+](=O)[O-]	1799633100	VAWCLQFLMZBUIK-FVCICTRLSA-N	439.516	1.789	50	20	IDGD	
COc1c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)Br)ccc(F)c1F	1800759853	MANPEIVEXDXHKI-YYHMBLRTSA-N	447.276	1.960	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CCc2nc[nH]c2C1	1801266211	XZPYOUPADKXALK-TVRNETQVSA-N	439.354	1.135	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)Br)C3)cc1	1801785084	MCDMIUKGBZZBBD-FIUQPQMISA-N	438.322	1.632	50	20	IDGD	
Cc1c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](O)CCl)C3)cccc1C(F)(F)F	1801842237	JNOVRLVGNUFHSP-VZAMPYOESA-N	434.842	1.817	50	20	IDGD	
COC[C@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(-n3c(O)nnc3O)cc1)C2	1802278973	GBMMDYFSDHFSTF-UKMLZYKCSA-N	449.895	1.184	50	20	IDGD	
CC[C@@H](NC(C)=O)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@H]1c1cccnc1	1802882302	NOGGUPSJMVHILA-XUWVNRHRSA-N	443.317	1.693	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC2(CCCN(C(=O)COC(C)C)C2)CC1	1805017221	PNBPOPPQEGYVJV-JJIBRWJFSA-N	431.537	1.777	50	20	IDGD	
Cn1c(=O)n(C)c2cc(C(=O)N3CCC4(CCCN(C(=O)[C@@H](O)CCl)C4)CC3)ccc21	1805524566	TWGVFJZAUBHPOS-SFHVURJKSA-N	448.951	1.322	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)/C=C/c2ccoc2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1	1807369289	FBJBXFFFGOHTSG-ZBVIIRNFSA-N	445.284	1.387	50	20	IDGD	
CCc1noc(C)c1C(=O)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1	1809971397	VGPXVQKDFWEVHL-UHFFFAOYSA-N	439.321	1.384	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)c3cc4cnccc4[nH]3)CC2)C1	1809978801	SFIQBPCBRUJTCM-UHFFFAOYSA-N	446.316	1.401	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)c1ccc2ncnn2c1	1810052578	QYJJLIDEYZYSCQ-LESCRADOSA-N	428.880	1.044	50	20	IDGD	
Cc1c(C(=O)NC[C@@H]2CCN(C(=O)[C@H](F)Cl)[C@H]2c2cccnc2)cn2[nH]cnc(=O)c12	1811303743	UPKHOSVSEQLONT-JQFCIGGWSA-N	446.870	1.580	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)C23CC(F)(C2)C3)[C@@H]1c1cccnc1	1813068142	IVKHYUXAFJWIGJ-VYRUVADXSA-N	431.512	1.353	50	20	IDGD	
Cc1oncc1C(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1813071540	UOJHLRLHJPSJRW-JXFKEZNVSA-N	428.493	1.071	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)CO[Si](C)(C)C)[C@H]1c1cccnc1	1813072833	HBDOMUNIXXPEBO-UTKZUKDTSA-N	449.628	1.312	50	20	IDGD	
C[C@]1(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)CC=CCC1	1813579098	JMIRAXMMDCQPEO-HOKHCIIBSA-N	447.344	1.827	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@H]1CCc2nc(NC(=O)[C@H]3CCC(=O)N3)sc2C1	1814398949	BINAQLJPWUNRPC-WCABBAIRSA-N	429.340	1.365	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)C2CC(F)(F)C2)n[nH]1	1814540495	XLQBJBODEBCNII-HNNXBMFYSA-N	447.446	1.759	50	20	IDGD	
Cc1cccnc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1815396796	MXHDSPFVJLHFAF-SFHVURJKSA-N	433.277	1.413	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc(O)cc2)[nH]n1)c1ccc(B(O)O)cc1	1817472791	YCGMVMWEGFSIJH-LJQANCHMSA-N	434.261	1.415	50	20	IDGD	
COCCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)n[nH]1	1818111839	KRUUKARHOZYAQR-DXRSZSRVSA-N	429.481	1.572	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)[C@H](COC(C)=O)OC(C)=O)sc2C1	1819861395	FIJTZEBAIAFRKQ-OBJOEFQTSA-N	445.925	1.567	50	20	IDGD	
C[C@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1ccccn1	1822898972	SRLITIVVUUXFGA-YWZLYKJASA-N	447.304	1.594	50	20	IDGD	
O=C(N[C@@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1)c1nc[nH]c1[N+](=O)[O-]	1823002175	ACGCJCMGYQBIMO-MLUIRONXSA-N	447.246	1.691	50	20	IDGD	
O=C1Nc2c(cccc2C(=O)N2CCC([C@H]3CCCCN3C(=O)[C@@H](O)CCl)CC2)C1=O	1824184889	AOJBJZLGHICTTM-SJORKVTESA-N	447.919	1.654	50	20	IDGD	
O=C(C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1)c1ccco1	1825057366	KTPBHWMSKRWETD-IBGZPJMESA-N	438.289	1.076	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)c2cccs2)CC1	1825777379	TUVRVXHWDJNCLU-LJQANCHMSA-N	426.347	1.975	50	20	IDGD	
O=C(c1cscn1)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827051058	MGOHVLSZVLRLBL-LJQANCHMSA-N	427.335	1.370	50	20	IDGD	
CCOC(=O)N[C@H](O)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H](C)Br)CC1	1828763086	JPGVAVREOZFKRG-NWANDNLSSA-N	448.358	1.454	50	20	IDGD	
C[C@H](O)C(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)[C@H](F)Cl)C2)C1	1829325273	GJJYIDXZMJJEKF-DKICVRJWSA-N	441.887	1.354	50	20	IDGD	
Cc1nn(C)c(C)c1CC(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830370829	ZNLVPNRWKWTHKW-NRFANRHFSA-N	440.972	1.301	50	20	IDGD	
CN[C@H](CC(=O)N1CCC([C@H]2CCCCN2C(=O)[C@H](F)Br)CC1)C(=O)O	1830375912	WSFJOMMHEWPNGR-NFAWXSAZSA-N	436.322	1.359	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)no1	1830537664	MEPNOXODCAGEPM-PXAZEXFGSA-N	430.299	1.084	50	20	IDGD	
CC(C)=NO[C@H](C)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H](C)CBr)CCO2)C1	1830543273	OMRPUVYXNKZVPI-DAYGRLMNSA-N	448.358	1.275	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(O)nc(O)n2)CC1	1831652898	MGNUVGMHWYIUIU-FZMZJTMJSA-N	441.326	1.905	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H](C)Cn2cncn2)CC1	1831830794	ILAMAGBEIDQZKL-RYQLBKOJSA-N	425.961	1.788	50	20	IDGD	
O=C(Cc1c(F)ccc(F)c1F)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1832072834	WGHCMRTUMINCKF-SJLPKXTDSA-N	438.805	1.637	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)COC(C)(C)C)CCO2)C1	1832306927	KEYHUSOFDGFYGN-RDTXWAMCSA-N	435.359	1.289	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3ccnc(OC)c3)CCO2)C1	1832595957	MHTSZSHXGCGWDT-LAUBAEHRSA-N	439.940	1.497	50	20	IDGD	
Cc1ccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)cn1	1833133535	IGHYADTZXRZFGR-KXBFYZLASA-N	440.338	1.172	50	20	IDGD	
COC(=O)CCCCCC(=O)N1CCC(N2CCC(NC(=O)[C@H](O)CCl)CC2)CC1	1833312814	GFULDPNRSBVMBA-GOSISDBHSA-N	445.988	1.281	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccnc(C(F)F)c3)CCO2)C1	1833324054	MFUCFWSHNCEVPD-AUUYWEPGSA-N	447.866	1.343	50	20	IDGD	
Cc1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCBr)C3)C2)n1	1834045075	ICEJORJAIILGLZ-GOSISDBHSA-N	426.311	1.245	50	20	IDGD	
CC(C)=NO[C@H](C)C(=O)N1CCOC[C@]2(CN(C(=O)CCBr)CCO2)C1	1834823627	ACWMXMJIHCVUHZ-PBHICJAKSA-N	434.331	1.029	50	20	IDGD	
O=C1Cc2cccc(C(=O)N3CCC(N4CCC(NC(=O)[C@@H](F)Cl)CC4)CC3)c2N1	1835081028	DAHYIOTUHAYRDL-LJQANCHMSA-N	436.915	1.901	50	20	IDGD	
C[C@@H](Nc1ccccn1)C(=O)N1CCC(N2CCC(NC(=O)[C@H](F)Cl)CC2)CC1	1835084162	OHSPGZHYJGPVMF-KDOFPFPSSA-N	425.936	1.988	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC(N2CCC(NC(=O)c3ccc(CO)o3)CC2)CC1	1835927618	BGIMCDUPMGOLGN-UHFFFAOYSA-N	437.613	1.809	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)c3n[nH]cc3[N+](=O)[O-])CC2)CC1	1836396521	AABSMYOSAMJVIJ-CQSZACIVSA-N	426.905	1.521	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc4c(c3)CC(=O)N4)CCO2)C1	1836789591	MEUYHOGOSZOSQX-IIBYNOLFSA-N	435.908	1.269	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(F)nc3F)C2)C1	1837708379	DZAGZBPSKLQVNF-LJQANCHMSA-N	443.523	1.281	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3ccc(C#N)cc3)C2)C1	1839141771	SCGNGPALXISKGJ-KNQAVFIVSA-N	433.936	1.965	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3nnsc3C3CC3)C2)C1	1839144902	ODATUERNLNIULT-SCLBCKFNSA-N	428.942	1.503	50	20	IDGD	
Cc1ccccc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839202132	VPDCIOOGTQHRJI-QAPCUYQASA-N	429.286	1.756	50	20	IDGD	
Cc1cccc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)c1	1840032059	MQOCWUQTQWRNOU-OXQOHEQNSA-N	439.350	1.777	50	20	IDGD	
Cc1ccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)o1	1840508487	COWWLZGSXXSQNY-KBXCAEBGSA-N	429.311	1.370	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(F)c(C)cc3F)CCO2)C1	1840708343	CNIFAINZMRUARK-MGPUTAFESA-N	446.878	1.597	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@H]2CC(=O)N(c3cccc(OC)c3)C2)C1	1841009801	LVROYFZIFUAYBA-MAUKXSAKSA-N	449.935	1.505	50	20	IDGD	
COc1cc(/C=C/C(=O)N2CC3(CCCN3C(=O)[C@H](O)CCl)C2)cc(OC)c1OC	1841353580	FNFBFVNJVJAQMT-LLYBFZRZSA-N	438.908	1.529	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC2(CCCN2C(=O)c2cc(O)ncn2)C1	1841692091	AQQRAWGCRWQKEO-ZDUSSCGKSA-N	439.900	1.131	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC2(CCCN2C(=O)c2ccc(N3CCOCC3)cn2)C1	1842266262	OLTRPEUNRCIVQU-LJQANCHMSA-N	441.359	1.972	50	20	IDGD	
CCOC(=O)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)[C@@H](F)Cl)C1	1843367512	IOJVKVDZTPDDBH-VXGBXAGGSA-N	435.880	1.181	50	20	IDGD	
Cn1c(CC(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)cc2ccccc21	1844263376	YKLLYBWZFVOCEP-UHFFFAOYSA-N	446.511	1.237	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)C1CCN(c3ccc(F)cn3)CC1)C2	1846364483	RJPSZDBJFNKIRG-KRWDZBQOSA-N	438.931	1.894	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@]1(C(=O)N2CC3(CCCN3C(=O)C(Cl)Cl)C2)CCOC1	1846388585	ZEGJXJJPUUNYEL-SFHVURJKSA-N	436.336	1.677	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NN[C@@H](C(=O)NC2CC2)c2ccccc2)c1	15467706	GONOQQBTJYVXAG-HXUWFJFHSA-N	444.557	1.971	50	20	IDGD	
COc1ccc(-c2nnc(SCC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)n2N)cc1	20853216	XRZUKPGMMYNXSX-UHFFFAOYSA-N	443.445	1.129	50	20	IDGD	
Cc1c(C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)nnn1-c1cccc([N+](=O)[O-])c1	24359232	CWHSRVKYLJSQKH-LBPRGKRZSA-N	428.380	1.852	50	20	IDGD	
CCCCS(=O)(=O)N1CCC(C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)CC1	107820519	CUVDUYQREILLBN-AWEZNQCLSA-N	429.514	1.582	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)c1	726867794	VASZVHPNRXNSRC-UHFFFAOYSA-N	438.531	1.135	50	20	IDGD	
CC[C@@H](C)N(C)CCNC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	727230139	UCQVXJYZWXFQFH-OAHLLOKOSA-N	425.555	1.145	50	20	IDGD	
O=C(NNC(=O)N1CCO[C@H](c2cccc(F)c2)C1)c1csc(N2CCOCC2)n1	727473323	IAXZZQGGCRAULJ-INIZCTEOSA-N	435.481	1.547	50	20	IDGD	
C=CCNS(=O)(=O)c1cccc(C(=O)NNC(=S)Nc2ccc(OC)c(F)c2)c1	727498313	IRFNVBSNXFVOAA-UHFFFAOYSA-N	438.506	1.930	50	20	IDGD	
O=C(CCCc1ccccc1)NNC(=O)N1CCN(CC(=O)NC2CCCCC2)CC1	728596855	NQEBJWJPCWWMEJ-UHFFFAOYSA-N	429.565	1.817	50	20	IDGD	
CC/C=C(/C)C(=O)N1CSC[C@H]1C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	728846973	YIPAUIHTLGBFRK-HSLRFEFHSA-N	432.550	1.098	50	20	IDGD	
C[C@H](NC(=O)c1ccc(Cl)cc1)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	728889762	PHBJNVMMZZCRHT-ZDUSSCGKSA-N	430.896	1.312	50	20	IDGD	
CCc1ccccc1NC(=O)CN1CCN(C(=O)NNC(=O)c2cccc(C#N)c2)CC1	728954412	DUOQJIKBAMRPTB-UHFFFAOYSA-N	434.500	1.731	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCCN1CCOC[C@H]1C	729614201	JQYCREMEMYARFR-OLZOCXBDSA-N	429.315	1.268	50	20	IDGD	
CSC[C@@H](C(=O)NNC(=O)c1cccc2ncccc12)N1C(=O)[C@H]2CCCC[C@H]2C1=O	730224933	FZUULKGYOQGGFM-JZXOWHBKSA-N	440.525	1.903	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)c1csc(I)c1	730750958	ZIYGKYPVJSMJEW-UHFFFAOYSA-N	435.268	1.605	50	20	IDGD	
CCCc1c(C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)nnn1-c1cccc(Cl)c1	731571531	DKDOATKXGSCRPW-LLVKDONJSA-N	425.898	1.069	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNS(=O)(=O)C[C@H]2CCCCO2)cc1	731901987	IUTIDTQQXZSHBT-OAHLLOKOSA-N	425.536	1.241	50	20	IDGD	
Cc1n[nH]cc1S(=O)(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1	732045557	LSSZPPOWOHWBOE-LJQANCHMSA-N	425.514	1.655	50	20	IDGD	
Cn1c(NNC(=O)[C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])o2)nc2ccccc2c1=O	733263348	XMWKCYKAOHSVIU-CYBMUJFWSA-N	426.389	1.183	50	20	IDGD	
Cc1[nH]c2ccnn2c(=O)c1CC(=O)OCC(=O)C(C#N)=C1N(C)c2ccccc2N1C	733546181	BDXYLPNDDQKIQJ-UHFFFAOYSA-N	432.440	1.307	50	20	IDGD	
Cc1cccc(NC(=S)NNC(=O)Cn2cc(Br)c(O)nc2=O)c1C	733786671	DTKGKYLRNXTUHA-UHFFFAOYSA-N	426.296	1.346	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)O[C@@H]2CCN(C)C2=O)cc1	734889013	VHTPYEFSPYCPGI-HAZIXKIPSA-N	437.456	1.115	50	20	IDGD	
O=C(NNc1cccnn1)c1ccc(NS(=O)(=O)c2ccc3c(c2)OCCO3)cc1	736702378	TUZZUNHONOLEAA-UHFFFAOYSA-N	427.442	1.806	50	20	IDGD	
CC(C)C[C@H](C(=O)NNC(=O)COCc1ccccc1)N1C(=O)[C@H]2CC=CC[C@@H]2C1=O	737634661	LCDRIWXWNXNOMM-GBESFXJTSA-N	427.501	1.717	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cccc(NC(=O)N(C)C)c2)cc1	739679338	VOQWFDTUWHWDAX-UHFFFAOYSA-N	447.517	1.170	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN(C(=O)COc2ccccc2)C1)c1cc(Br)c[nH]1	741208162	SJDPJTVTOYZNNY-ZDUSSCGKSA-N	449.305	1.856	50	20	IDGD	
Cc1ccccc1O[C@@H](C)C(=O)N1CCN(CC(=O)NNC(=O)c2ccc(C#N)cc2)CC1	744406317	BRUZPNPMCRESJO-SFHVURJKSA-N	449.511	1.239	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)c2ccc(N3CCOCC3)c(F)c2)c1	744975075	KGKNLEIJEOSWGH-UHFFFAOYSA-N	426.404	1.152	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2ccc(S(N)(=O)=O)s2)ccc1OCCC(C)C	745485053	HVKHXKBFPGQIAS-UHFFFAOYSA-N	441.531	1.904	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)c1ccc(COc2ccccc2)o1)CN1CCN(C)CC1	745863224	TWOIOIKYUWQPFY-QGZVFWFLSA-N	429.521	1.686	50	20	IDGD	
CS[C@H]1CC[C@@H](NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)C1	745896834	MNRTXFBHEZDYKK-CABCVRRESA-N	426.564	1.699	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)[C@H]1[C@@H](C)OC(C)(C)N1C(=O)OC(C)(C)C	746094167	CPCRBTAPHFQVLV-CXAGYDPISA-N	437.493	1.982	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)c1ccc(S(=O)(=O)Nc2nccs2)cc1	746293401	IIKQAYOZITVSQO-UHFFFAOYSA-N	446.510	1.956	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)[C@@H]2CCCN2S(=O)(=O)c2cccs2)c1	749161374	XUBFVQWKLQANJW-HNNXBMFYSA-N	437.543	1.744	50	20	IDGD	
Cc1nccn1C[C@H](C)CNC(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12	749195970	HPQSRXHTECRMBF-CQSZACIVSA-N	425.493	1.763	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)c2ccc(F)c(S(=O)(=O)NC)c2)cc1OC	752398940	MOKQTYUBKUUJFN-UHFFFAOYSA-N	425.438	1.216	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1cc(OC)c(O)c(OC)c1	754263958	WJCQBQYZBBJPIF-UHFFFAOYSA-N	438.820	1.689	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2ccc3c(c2)C(C)(C)C(=O)N3)cc(OC)c1OC	755959885	WHRKMOHSCCJFKE-UHFFFAOYSA-N	449.485	1.565	50	20	IDGD	
N#CCc1ccc(OCc2ccccc2NC(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)cc1	756113074	YANVEMMYBPSOLZ-KRWDZBQOSA-N	442.497	1.919	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3cccc(-n4ccnn4)c3)n[nH]2)cc1OC	756144271	BBARHBFGJBQGDD-UHFFFAOYSA-N	433.428	1.749	50	20	IDGD	
COC(=O)c1cccc(NC(=O)C(=O)NNC(=O)CCc2ccco2)c1Br	756154449	CYRZVPINKIIVOJ-UHFFFAOYSA-N	438.234	1.547	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)Nc2ccc(S(=O)(=O)N(C)C3CC3)cc2)cc1	756403709	QTKOTQNNXKUBQF-UHFFFAOYSA-N	448.501	1.710	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NC(=O)NNC(=O)COc1ccccc1C#N	756527494	SUPDQMYBDFWEDR-UHFFFAOYSA-N	445.501	1.867	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)CN(C)C(=O)OCc2ccccc2)c2ccccc2c1=O	756797821	SJBJCLPXNZHICE-UHFFFAOYSA-N	437.456	1.446	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)Nc1cc(C(=O)OC)cc(S(C)(=O)=O)c1	757674901	XXKCVLLIECNHJC-UHFFFAOYSA-N	449.485	1.671	50	20	IDGD	
CC(C)CCn1nc(C(=O)NN=C2CCC3(CC2)NC(=O)NC3=O)c2ccccc2c1=O	758100211	QXZDSKGUEBSOPS-UHFFFAOYSA-N	438.488	1.681	50	20	IDGD	
COc1ccc(Oc2cc(CNC(=O)NNC(=O)C(=O)Nc3ccccn3)ccn2)cc1	758683890	JDWXZQHLPJPEHV-UHFFFAOYSA-N	436.428	1.747	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)N[C@@H]2CN(C(=O)OC(C)(C)C)C[C@H]2C#N)nc2ccccc21	758771020	MXJYINFNNGEXBX-UKRRQHHQSA-N	441.492	1.205	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)c1cc(S(C)(=O)=O)cc(C)c1C	758944355	DFYWPGOXYZGZNP-UHFFFAOYSA-N	432.498	1.562	50	20	IDGD	
COC(=O)c1cc(F)ccc1S(=O)(=O)NNC(=O)c1cccc(Br)c1	759104028	VXRYPMLRFHYXPI-UHFFFAOYSA-N	431.239	1.998	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)[C@@](C)(O)CN1C(=O)C(C)(C)c2ccccc21	760064666	BLNFHGSKLJEKEI-PSLXWICFSA-N	443.475	1.816	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)nc1I	760208759	CGJHZZINPWCALJ-UHFFFAOYSA-N	442.169	1.678	50	20	IDGD	
O=C(NNC(=O)c1ccccc1Br)C(=O)Nc1ccccc1-n1ccnn1	763482016	BDYGXRYCUZGIMV-UHFFFAOYSA-N	429.234	1.430	50	20	IDGD	
CN(C)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)cc1Cl	763550741	GFJRWWNJHFRFST-UHFFFAOYSA-N	432.820	1.170	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccc(C(C)(C)C)cc2)n(CCC#N)n1	763594119	GYEHFSZZYLELGI-UHFFFAOYSA-N	426.477	1.568	50	20	IDGD	
Cn1nccc1NC(=O)C(=O)NNC(=O)c1cn(-c2ccccc2)nc1-c1ccccc1	763600273	DXQLVUVIEGHNKN-UHFFFAOYSA-N	429.440	1.673	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(OC)c(OC(C)C)c2)cc1	763660438	DBJUQOMPFPOOTH-UHFFFAOYSA-N	431.445	1.656	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cc(Cl)c(OC)cc2OC)cc1	763662411	YFZKRSLXDGYZEY-UHFFFAOYSA-N	437.836	1.531	50	20	IDGD	
O=C(CN1CCCc2ccccc21)NNC(=O)C(=O)Nc1cccnc1OCC(F)F	763728050	HZESRRSNWXBOOW-UHFFFAOYSA-N	433.415	1.264	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccc(N2CCOC2=O)cc1	763867957	ZEZGBFXWWFDIMC-LBPRGKRZSA-N	430.392	1.336	50	20	IDGD	
CC(C)Cn1ncc(NC(=O)C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c1C(C)C	763921700	NVFVVQDDPCHFJB-UHFFFAOYSA-N	439.480	1.038	50	20	IDGD	
COCC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CC[C@@H](C)C3)cc1	763939254	CNHJAWSQBWGHNX-GFCCVEGCSA-N	444.513	1.858	50	20	IDGD	
C[S@](=O)Cc1ccccc1NC(=O)C(=O)NNC(=O)c1cccc(Br)c1	764063713	WMKDXQJCDNPWSP-SANMLTNESA-N	438.303	1.727	50	20	IDGD	
CC[C@H](C)C(=O)NNC(=O)C(=O)Nc1ccnn1Cc1c(OC)cc(OC)cc1OC	764083859	KNPSFINLEKHZEE-LBPRGKRZSA-N	433.465	1.089	50	20	IDGD	
CC(C)(C)S(=O)(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)CCc2ccco2)c1	764177933	VQZZYMZXBDWJQW-UHFFFAOYSA-N	435.502	1.712	50	20	IDGD	
O=C(CCC1CCCCC1)NNC(=O)C(=O)Nc1ccc(CC(=O)N2CCOCC2)cc1	764218002	LBJVBUQYQFWHSL-UHFFFAOYSA-N	444.532	1.534	50	20	IDGD	
C[C@H]1CN(Cc2cccc(NC(=O)C(=O)NNC(=O)Cc3ccccn3)c2)C[C@H](C)O1	764263780	IXJGOYDKWBVNQY-HOTGVXAUSA-N	425.489	1.019	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1ccc(N2CCCC2=O)c(Cl)c1	764276837	CBUGEBQBGKCROR-UHFFFAOYSA-N	446.847	1.337	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)Cc2ccncc2)cccc1-c1nnc2n1CCCCC2	764352766	AUXHBBQUQYZSII-UHFFFAOYSA-N	447.499	1.704	50	20	IDGD	
CNC(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)c1	764370023	KVPGAFWKPFAMEO-UHFFFAOYSA-N	440.790	1.457	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)N[C@@H]3CCCC[C@@H]3N3CCOCC3)n[nH]2)cc1	764374944	MMXCSYUOCIQVBL-XLIONFOSSA-N	426.521	1.973	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)C(=O)Nc1ccccc1CN1C[C@H](C)O[C@H](C)C1	764386151	RNARJSBFHONAJQ-IYBDPMFKSA-N	425.489	1.399	50	20	IDGD	
O=C(NNC(=O)[C@H]1COCCO1)C(=O)Nc1cccc(Oc2ccnc3ccccc23)c1	764423999	FSNPZDQUFHOWJR-LJQANCHMSA-N	436.424	1.528	50	20	IDGD	
CCOC(=O)/C=C\c1ccc(NC(=O)C(=O)NNC(=O)c2cncc(NC(C)=O)c2)cc1	764432623	HOZOPLSDOSWQSL-TWGQIWQCSA-N	439.428	1.016	50	20	IDGD	
O=C(CCNS(=O)(=O)c1cccs1)NNC(=O)c1cc(-c2cccs2)[nH]n1	765566247	SSDHXCJJBHYVSB-UHFFFAOYSA-N	425.517	1.329	50	20	IDGD	
CNS(=O)(=O)c1ccc(C)c(C(=O)NNC(=O)c2cc(-c3ccccc3OC)[nH]n2)c1	765600849	NWJXNQLLGTWGTA-UHFFFAOYSA-N	443.485	1.377	50	20	IDGD	
Cc1ccc(Cl)c(S(=O)(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)c1	765639689	DSVSIYVJGIUAKT-UHFFFAOYSA-N	430.939	1.873	50	20	IDGD	
Cc1nc2ccc(C(=O)NNC(=O)CN3CCN(C(=O)c4ccccc4)CC3)cc2nc1C	765734039	VGOZIADFNKOWDA-UHFFFAOYSA-N	446.511	1.466	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)N[C@@H](c1ccc(Cl)cc1)[C@@H]1CN(C)CCO1	766317847	GDRRGXQAEMVTRA-COXVUDFISA-N	428.917	1.094	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)c1cc([N+](=O)[O-])cc2c1OCCO2	767329787	LESPUIUGGLWDDA-UHFFFAOYSA-N	429.385	1.221	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)[C@@H]1CCCN(C(=O)c2ccccc2)C1	767340386	QKDCXSWGHCOIJB-HXUWFJFHSA-N	437.496	1.781	50	20	IDGD	
COc1cc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)ccc1OC(C)C	768182634	JDVIFKYMDDFEEP-IBGZPJMESA-N	444.440	1.627	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)[C@H]1CC(=O)N(Cc2ccc(C)cc2)C1	768612553	ORGIAZDGNVINPK-INIZCTEOSA-N	431.514	1.899	50	20	IDGD	
CSCCNC(=S)NNC(=O)/C(=C/c1ccco1)n1nnnc1-c1ccccc1	770246067	JEZPTDLNMHHFLV-QINSGFPZSA-N	429.531	1.790	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)NC[C@@H](NC(=O)OC(C)(C)C)c3ccccc3)nc21	770402771	VYJFRSRSSWODJO-CQSZACIVSA-N	442.480	1.961	50	20	IDGD	
CCN1CCN(c2cccc(NC(=O)C(=O)NNC(=O)CCCc3ccccc3)c2)CC1	770772059	SYCNRCPGDPTJFB-UHFFFAOYSA-N	437.544	1.937	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2ccnn2-c2cccc(F)c2)c1	770772995	CKVFWFRQOWDNLS-UHFFFAOYSA-N	425.420	1.793	50	20	IDGD	
C=CCNc1ncc(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)s1	771012535	MDIRXWYFVYFFGH-UHFFFAOYSA-N	436.563	1.434	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)NC[C@@H](O)C(C)C)cc1	771601372	IYALJCZPEDPIAL-OUQXZNHLSA-N	425.489	1.474	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NCCNS(=O)(=O)c2ccc(C)s2)cc1	772631006	OCOSHSPACSKAQU-UHFFFAOYSA-N	426.520	1.053	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)c1cnc2c(c1)c(O)nc(=O)n2C1CC1	772955107	PIAYPBCEEKIWCI-JTQLQIEISA-N	443.847	1.714	50	20	IDGD	
Cc1ccc(S(=O)(=O)C[C@@H](C)NC(=O)NNC(=O)c2c(C)nc3ccccn23)cc1	773131755	MKOIPCPQDNQRNX-CQSZACIVSA-N	429.502	1.758	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)ncc1Br	773548912	AUQWDCMMNYSGPO-UHFFFAOYSA-N	427.642	1.911	50	20	IDGD	
NC(=O)C1CCN(c2ccccc2NC(=O)C(=O)NNc2ccccc2[N+](=O)[O-])CC1	773653763	IBFJVQIPQJCCIP-UHFFFAOYSA-N	426.433	1.378	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccc(-n2nccn2)cc1	774002523	QTJTVKDDFXOFSH-LBPRGKRZSA-N	428.836	1.474	50	20	IDGD	
COCCOc1ncccc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1cccc(Cl)c1	774009612	RKQLQXLHSRGZHK-GFCCVEGCSA-N	436.852	1.314	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NC[C@H]2COC3(CCCCC3)O2)cc1	775758595	DDZYROXIVWWOFK-AWEZNQCLSA-N	426.495	1.502	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)NC2CCN(S(=O)(=O)CC(C)C)CC2)c1	777765372	MXGGQMKRDXOJSL-UHFFFAOYSA-N	440.566	1.463	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)c2cc3c(O)ncnc3cn2)c2ccccc2c1=O	778292508	MJPNJRHQHKKAQJ-UHFFFAOYSA-N	447.455	1.705	50	20	IDGD	
COc1ccc2nc(NNC(=O)c3cnc4c(c3C)c(=O)n(C)c(=O)n4C)c(C)cc2c1	778480656	IPPZGFVIEJUBON-UHFFFAOYSA-N	434.456	1.563	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)CCc1nc(O)c2c3c(sc2n1)CCC3	778517048	JQFCUZNQQJESNZ-UHFFFAOYSA-N	435.506	1.490	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)Nc2ccc(N3CCN(S(C)(=O)=O)CC3)nc2)c1	780576533	AHYSSAOLPFVCFM-UHFFFAOYSA-N	448.505	1.098	50	20	IDGD	
CC(C)S(=O)(=O)c1ccc(CC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1	781236189	OJSBLFVRQBHBOZ-UHFFFAOYSA-N	442.497	1.119	50	20	IDGD	
COc1ccc(Cl)cc1S(=O)(=O)N1CCN(S(=O)(=O)CBr)CC1	782473551	YAXBLPRKHQIBMJ-UHFFFAOYSA-N	447.760	1.337	50	20	IDGD	
CC[C@@H](C)NS(=O)(=O)Cc1cccc(NC(=O)C(=O)NNc2cncc(Cl)n2)c1	783259691	HSZMWXMNLVBZIR-LLVKDONJSA-N	440.913	1.430	50	20	IDGD	
CCOc1cc(N2CCN(C)CC2)ccc1NC(=O)C(=O)NNc1cc(C)nc(C)n1	783329338	FWCMWGXXRHXRTA-UHFFFAOYSA-N	427.509	1.326	50	20	IDGD	
COc1ccc(N2CCN(C(=O)/C(C#N)=C\c3cn(Cc4cccnc4)nn3)CC2)cc1	783698857	AOOGZNKHTAGEFI-UYRXBGFRSA-N	429.484	1.986	50	20	IDGD	
Cn1c(C(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)cc2c(=O)n3ccccc3nc21	784400679	ZUOQFRNDRVJYRN-UHFFFAOYSA-N	447.459	1.543	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ccnc(N(C)C)n2)cc1N1CCCCC1=O	784971181	VGVMPCHVGUXYLO-UHFFFAOYSA-N	427.465	1.150	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNc2cc(F)c(F)c(F)c2)cc1C(=O)OC	785083271	KIZXMIGGSFPGMB-UHFFFAOYSA-N	425.319	1.759	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1c[nH]nc1-c1ccccc1	785331219	QBZGQWANFXUSCG-UHFFFAOYSA-N	429.458	1.571	50	20	IDGD	
CCNC(=O)Nc1ccc(C)c(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)c1	787541356	POUBXFLREULIRD-UHFFFAOYSA-N	438.444	1.173	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2cccc(CNC(=O)OC(C)(C)C)c2)C[C@H](C)O1	787993404	SNFDXBWARKZECT-HOTGVXAUSA-N	434.537	1.972	50	20	IDGD	
O=C(NN=Cc1ccc(Br)cc1N1CCOCC1)[C@@H]1CCS(=O)(=O)C1	788708075	DWRBENMMNPCVAJ-CYBMUJFWSA-N	430.324	1.171	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2nc3c(s2)CCCC3)cc1	789740790	IBOYYLVSLQPSTG-GFCCVEGCSA-N	432.502	1.974	50	20	IDGD	
COc1cc(NNC(=O)C(=O)Nc2ncn(Cc3ccc(C#N)cc3)n2)ccc1Cl	789804939	RZZOBGYPGJZXLK-UHFFFAOYSA-N	425.836	1.942	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)[C@@H]1CCS(=O)(=O)c2ccccc21	791003644	BTDONGGWEUOIKI-OAHLLOKOSA-N	426.498	1.707	50	20	IDGD	
COc1ccc(NNC(=O)[C@@H]2CC(=O)C[C@H](C)[C@H]2C(=O)NNc2ccc(OC)cn2)nc1	791147439	ZMPUCJFHPNXZMW-JOKNJTHLSA-N	442.476	1.312	50	20	IDGD	
Cc1ccc2c(c1)CC[C@H](C(=O)NNc1ccc(S(=O)(=O)N3CCN(C)CC3)cc1)O2	793711208	YEIHPLVCFKJYIX-OAQYLSRUSA-N	444.557	1.768	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)Nc1ccc(S(=O)(=O)N(C)C)cn1	797652424	DZCVINYFGFZFGE-LLVKDONJSA-N	441.897	1.606	50	20	IDGD	
CN(C)Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])ccc1Cl	799258406	BRYOSHCELZDMKD-UHFFFAOYSA-N	449.851	1.475	50	20	IDGD	
CCOc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NNC(=O)CCc1ccc(OC)cc1	799259093	SPXFZUPQOWITNS-UHFFFAOYSA-N	430.417	1.721	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(C)c(C(=O)NNC(=O)Nc2ccc(OC)cc2)c1	802061307	UQQUCQAULMBUDJ-UHFFFAOYSA-N	436.490	1.395	50	20	IDGD	
CSC[C@@H](C(=O)NNc1ccc2c(=O)[nH]ccc2c1)N1C(=O)[C@H]2CCCC[C@H]2C1=O	803431533	BZOSLYOJBUVJLJ-BBWFWOEESA-N	428.514	1.878	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)[C@@](N)(c2cccc(F)c2)C(F)(F)F)c2ccccc2c1=O	806272444	GMLLCZHRDDHWAW-SFHVURJKSA-N	437.353	1.250	50	20	IDGD	
COc1ccc(CS(C)(=O)=O)cc1NC(=O)C(=O)NNC(=O)c1ccc(Cl)cc1	806973094	ZHDZFFWFENKUAY-UHFFFAOYSA-N	439.877	1.293	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1cc(F)c(Br)c(Cl)c1	806978870	HZWGDOMLXPOVQX-SSDOTTSWSA-N	440.653	1.379	50	20	IDGD	
COc1cc(OC)cc(Oc2cccc(CNC(=O)NNC(=O)C(=O)NC3CC3)c2)c1	807423183	OGIFAKKGIJUNOR-UHFFFAOYSA-N	428.445	1.605	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)OCC(=O)NCC(=O)Nc2ccc(F)c(F)c2)cc(C#N)n1C	809303463	NGKGBSBIPIYQPF-RZNTYIFUSA-N	441.394	1.688	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NN=C2CCCc3ccc(S(N)(=O)=O)cc32)cc1	811642796	GZZNCLOYNNMSMG-UHFFFAOYSA-N	436.515	1.600	50	20	IDGD	
COC(=O)c1cn(-c2cccc(NC(=O)NNC(=O)c3ccc(Cl)cc3O)c2)nn1	812977866	UPQQQPBIHPFWKB-UHFFFAOYSA-N	430.808	1.879	50	20	IDGD	
O=C(NNc1ccc2c(=O)[nH]ccc2c1)C1(S(=O)(=O)c2ccccc2)CCOCC1	813580764	SUZGCCKNXXUPSI-UHFFFAOYSA-N	427.482	1.994	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)Nc1ccc(CN2C(=O)CNC2=O)cc1	813837700	UANWZEHGPZRJRM-UHFFFAOYSA-N	446.489	1.137	50	20	IDGD	
Cc1nnsc1CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	813849758	PNMFWLBBXJTDRM-UHFFFAOYSA-N	438.535	1.165	50	20	IDGD	
Cc1cnc(-c2cccc(NC(=O)C(=O)NNc3ccccc3S(=O)(=O)N(C)C)c2)o1	815752291	MFAOZGLJKOFWQZ-UHFFFAOYSA-N	443.485	1.982	50	20	IDGD	
CCOc1ccc(NNC(=O)C(=O)Nc2ccccc2C(=O)N2CCN(C)CC2)cc1	815815331	VRBXZMQOBCHLAY-UHFFFAOYSA-N	425.489	1.555	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)c2ccccc2CN2CCOCC2)C1	816511093	OPXASECONKHMMJ-SFHVURJKSA-N	446.548	1.927	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)CNC(=O)COc2ccccc2)c1	816717204	SDUIOKVNNDILHU-UHFFFAOYSA-N	436.262	1.874	50	20	IDGD	
O=C(NNc1ncncc1F)C1CCN(S(=O)(=O)c2ccc(F)c(Cl)c2)CC1	817079826	MNIPGCJHHZPZJQ-UHFFFAOYSA-N	431.852	1.952	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)C(C)(C)C)N(S(C)(=O)=O)CC2	849286360	XERATPVPJGHGSM-CQSZACIVSA-N	427.523	1.146	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)[C@H]2CS[C@@H](Cc3ccccc3F)C(=O)N2)cc1	888625558	TXBBKBZBESKOKZ-MSOLQXFVSA-N	442.472	1.066	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)CCNS(=O)(=O)/C=C\c2ccccc2)c(C)c1	913164239	AVECOOUICDGKCT-QBFSEMIESA-N	430.530	1.843	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)no1	914864410	IDNBFRFGSCGSOB-UHFFFAOYSA-N	444.469	1.675	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(N3C[C@H](C)O[C@@H](C)C3)nc2)cc1	915037493	PYPQTDYFTLNUGS-HOTGVXAUSA-N	426.473	1.622	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@H]2C(=O)NNC(=O)c2ccc3c(c2)OCO3)c(OC)c1	915060138	GYCLADDDJYBLQO-INIZCTEOSA-N	441.440	1.498	50	20	IDGD	
CCn1c(S)nc2cc(C(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)ccc2c1=O	915077122	CXCUKMKUGSZELQ-UHFFFAOYSA-N	446.510	1.183	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)CNC(=O)c2c[nH]c3ccccc3c2=O)cc1OC	915357570	YSGCGCJMHRJYOS-UHFFFAOYSA-N	438.440	1.126	50	20	IDGD	
CCc1c(C(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)cnn1C	916105929	WPOGRPQXSRZWDU-UHFFFAOYSA-N	441.513	1.536	50	20	IDGD	
O=C(CCCOc1ccc(Cl)cc1Cl)NNC(=O)CN1CCS(=O)(=O)CC1	916107945	OIQANICSCULSPV-UHFFFAOYSA-N	438.333	1.030	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)N[C@@H](CN2CCOCC2)c2ccccc2)nc2ccccc21	916216875	VHTPVLHIVHJDMP-IBGZPJMESA-N	436.516	1.520	50	20	IDGD	
O=C(O)COc1ccc(C=NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1	916261050	RBDQHABSTCGNFV-UHFFFAOYSA-N	431.470	1.698	50	20	IDGD	
O=C(Cc1cccc2ccccc12)NNC(=O)NCCCN1CCN(c2ncccn2)CC1	916264079	UUIXVLVBOGSIFX-UHFFFAOYSA-N	447.543	1.715	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCc2cccnc2-n2ccnc2)nc1	916416240	RUFJZZLNHSJUQT-UHFFFAOYSA-N	430.494	1.175	50	20	IDGD	
O=C(NCc1cccc(N2CCCC2=O)c1)NNC(=O)c1nn(-c2ccccc2)cc1O	916517784	RWIVIJHUXKULMF-UHFFFAOYSA-N	434.456	1.849	50	20	IDGD	
CCS(=O)(=O)N(C)CCCNC(=O)NNC(=O)COc1cc(C)ccc1C(C)C	916580323	MUXDYIUPIBKBTM-UHFFFAOYSA-N	428.555	1.499	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12)c1nncn1C	916580805	YJPJJAXOLOWEJO-AWEZNQCLSA-N	446.471	1.279	50	20	IDGD	
CCOC(=O)N[C@@H](CNC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)CC(C)C	916631671	NUQFFTRKBVREFQ-CYBMUJFWSA-N	432.481	1.038	50	20	IDGD	
Cn1c(CCC(=O)NNC(=O)C(C)(C)C)nc2cc(S(=O)(=O)N3CCCCC3)ccc21	917180440	ULAJKOIZOHEMBX-UHFFFAOYSA-N	449.577	1.874	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2ccc(OC(C)C)c(OC)c2)ccc1O	917727280	BKWDWKQWORKCLZ-UHFFFAOYSA-N	438.458	1.598	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)NNC(=O)c2ccc(Br)s2)c1	918778963	VNRYAOPRLGSDRR-UHFFFAOYSA-N	426.296	1.866	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)NC3CC3)cc2)o1	920248915	VZRNDJILPAVJSZ-UHFFFAOYSA-N	434.518	1.637	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CN2CCN(C(=O)Cc3ccccc3Cl)CC2)cc1	920836345	FCRVLBPGASRHBM-UHFFFAOYSA-N	428.920	1.796	50	20	IDGD	
CS(=O)(=O)CC[C@H](C(=O)NNC(=O)c1cncn1-c1ccccc1)c1ccccc1	1321420641	LYWJRUNWNCTXHI-SFHVURJKSA-N	426.498	1.852	50	20	IDGD	
CCN(CC)CCN1C(=O)C(=NNC(=O)C(=O)OC)c2cc(Br)ccc21	1322286534	QARXQGXWWXBXOT-UHFFFAOYSA-N	425.283	1.131	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2c[nH]c3cnccc23)C1	1779181423	SCLCVJOCBCZZHL-YRISNDGFSA-N	434.924	1.944	50	20	IDGD	
CCOc1cccc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](F)Br)C3)C2)c1O	1781334066	UULAZENRRZNUPW-YJBOKZPZSA-N	445.285	1.925	50	20	IDGD	
O=C(c1ccccc1N1CCCCC1)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1782025952	HWDZQBQPNXVEAB-UGKGYDQZSA-N	435.952	1.720	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)nc(Cl)c1)C2	1782170821	AECSRRNSXWKJOH-IQUTYRLHSA-N	446.331	1.822	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)CBr)C2	1782171951	HJTJDMHCAUKUQX-ZOMKSWQUSA-N	439.778	1.785	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1nc(O)n3c1CCCC3)C2)C(Cl)Cl	1782218095	RZYMDSKQSBHQFB-BFUOFWGJSA-N	445.347	1.856	50	20	IDGD	
O=C(O)c1cnncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C(Cl)Cl)C1	1782218155	YJWHZDXEIHZJKL-SJKOYZFVSA-N	431.276	1.106	50	20	IDGD	
C[C@H](CN)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](Br)Cc3ccccc3)C2)C1	1783022929	MZFVQSWFVFVPEJ-MDYRTPRTSA-N	438.366	1.417	50	20	IDGD	
Cc1cc2[nH]c(C(=O)N3CCO[C@@]4(CCN(C(=O)CCC(=O)NN(C)C)C4)C3)cc2s1	1783936614	JUOQWQMWSKQTSK-OAQYLSRUSA-N	447.561	1.354	50	20	IDGD	
Cc1ccc2cc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]4C3)ccc2n1	1784092530	MNHKKBQCLNNOLH-XEYPJELSSA-N	431.920	1.736	50	20	IDGD	
COc1cc(Cl)cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]3C2)c1	1784096377	VUJSUQFBDWUUJQ-SPOWBLRKSA-N	431.316	1.542	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)Cc3ccc(O)cn3)C2)C1	1784637475	GXBZDVDFQVVPEA-ACJLOTCBSA-N	426.311	1.191	50	20	IDGD	
CNC(=O)CC(=O)Nc1ccc(C2(NC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CCC2)cc1	1786319522	COYMBPQXUOXPOS-MZJWZYIUSA-N	438.488	1.391	50	20	IDGD	
CC(=O)Nc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)C(C)(C)CCl)C[C@@H]32)ccn1	1787771471	LZOPUYHEEODUDN-ULQDDVLXSA-N	436.940	1.898	50	20	IDGD	
Cn1cc(F)cc1C(=O)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1	1788850411	WXJCXKCJAGEZGH-UHFFFAOYSA-N	435.264	1.906	50	20	IDGD	
C[C@@H](Cn1cncn1)C(=O)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1	1789614779	NNKFHTIBUSCOEZ-INIZCTEOSA-N	447.304	1.042	50	20	IDGD	
CCc1cc(C(=O)Nc2ccc(C3(NC(=O)c4cccc(B(O)O)c4)CCC3)cc2)nn1C	1789921937	UEWPCVMOASWSKD-UHFFFAOYSA-N	446.316	1.724	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C=C/c3cnccn3)[C@H]2C1	1791699877	LXHNTGXRFBXGQU-FHYOHNPVSA-N	427.332	1.706	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnc(Cl)nc1	1792371252	BOTYTDYKZASPMQ-RNJOBUHISA-N	431.718	1.507	50	20	IDGD	
Cc1c[nH]c(C)c1CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2	1793101589	FJSMAEWLHVPCLZ-RMHZUWNSSA-N	430.318	1.844	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CSc1ccc(F)cc1F	1793292127	DZBQUPYUBLJKED-JPVZDGGYSA-N	448.919	1.900	50	20	IDGD	
COCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](Br)Cc1ccccc1)C2	1795206743	HSJNHELQXKPPOX-DFGXFYAUSA-N	425.323	1.229	50	20	IDGD	
C#CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Cl	1796369778	DLOKNDPMNVTGQH-AICCOOGYSA-N	431.892	1.027	50	20	IDGD	
Cc1cc2nnc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)CCBr)C4)c(C)n2n1	1797438913	OPNFPTZAHWGQAW-BTTYYORXSA-N	435.326	1.778	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cn2ccsc2n1	1797485799	DBVJLQGZHGASRP-WYFUGZQLSA-N	431.345	1.835	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnc2snnc2c1	1798507730	RHQAACCRESQHFM-GMTLJSCSSA-N	440.323	1.073	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc(C(=O)OC)s1)C2	1799269074	SLXSTTSGGBRYHC-DMVWFOPNSA-N	428.938	1.684	50	20	IDGD	
CCOc1ncccc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@](C)(Cl)CCl	1799273337	DGJFVOUIXQINMF-FCIKYMEBSA-N	430.332	1.920	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2cccnc2nc1O	1799922219	AUPFFVUMLQSOHT-DNVSUFBTSA-N	449.305	1.322	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](CC1CC1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2	1800903488	VQUBFXCIVFBRLD-JKJDWNRSSA-N	447.935	1.804	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CCC[C@H](C(=O)OC)C1	1800964490	OOAFFUUKIATICE-WJWMFLMHSA-N	428.957	1.963	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(Cl)nc3n[nH]cc13)C2)C(Cl)Cl	1801016318	YCGWKTVHSAWWSO-IJBDUVHLSA-N	432.695	1.618	50	20	IDGD	
COC(=O)CCCCCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)CBr)C2	1801072067	WYWCADDVTMVABS-AFIMGQEJSA-N	447.370	1.731	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)Cn1ccnc1	1801375579	GQTWIHNTXWQPJA-QMHWVQJVSA-N	427.343	1.282	50	20	IDGD	
C=CCNC(=O)/C=C\C(=O)NC[C@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1	1802483369	UDVCYFCGTRAJKI-VPCYTDGVSA-N	449.349	1.731	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1cccs1	1805385226	SECKDMSBZCCDCF-PXNSSMCTSA-N	435.314	1.456	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H](CNC(=O)c2cnc(O)nc2O)[C@H]1c1cccnc1	1808276132	RLMFBWRSBBLSPR-UKRRQHHQSA-N	433.896	1.867	50	20	IDGD	
C[C@@H](C(=O)N1CC[C@H](CNC(=O)[C@H](F)Cl)[C@H]1c1cccnc1)N1CCN(C)CC1	1808316237	WWGWHPPDBHXFIH-HPBDAGMYSA-N	425.936	1.258	50	20	IDGD	
Cc1ccn2c(C(=O)NC[C@@H]3CCN(C(=O)[C@H](O)CCl)[C@H]3c3cccnc3)cnc2c1	1812252651	OPAGWPHBWAYWOE-HQRMLTQVSA-N	441.919	1.957	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)[C@@H]2CCCSC2)[C@@H]1c1cccnc1	1813074761	UTEXOBRVNWCVRK-WAOWUJCRSA-N	447.605	1.604	50	20	IDGD	
Cn1ccc(CC(=O)Nc2nc3c(s2)C[C@H](NC(=O)CCBr)CC3)n1	1815545290	MFBFAVIQIZBMJZ-SNVBAGLBSA-N	426.340	1.816	50	20	IDGD	
CS(=O)(=O)N1CCC(C(=O)N2CCCC[C@H]2c2cc(NC(=O)[C@@H](F)Cl)n[nH]2)CC1	1818039060	JGNPLWPQJLCGBE-DZGCQCFKSA-N	449.936	1.608	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)Cn2cccc([N+](=O)[O-])c2=O)[nH]n1)[C@@H](F)Cl	1818043217	IDNXZTQFQHOMQV-XHDPSFHLSA-N	440.819	1.706	50	20	IDGD	
Cc1cc(/C=C/C(=O)Nc2nc3c(s2)C[C@H](NC(=O)CCC(=O)NN(C)C)CC3)no1	1819944633	FARIHJSKTDSRGC-VUDGCMKMSA-N	446.533	1.438	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)N[C@@H]1CCc2nc(NC(=O)CO[Si](C)(C)C)sc2C1	1820166039	YZABROSOYRJBBY-VXGBXAGGSA-N	441.630	1.614	50	20	IDGD	
CC(=O)C[C@H](C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1822345599	XBVMTNWRKJZHNT-YVEFUNNKSA-N	441.492	1.329	50	20	IDGD	
C=C(C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1)C(F)(F)F	1827053070	BDIKCBPUWZEMQQ-GOSISDBHSA-N	438.255	1.718	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827058637	ZNKRIZKKWDYIBC-HXUWFJFHSA-N	446.429	1.451	50	20	IDGD	
CCc1ccnc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)c1	1827357198	LSSGVKPACXMEMG-HSZRJFAPSA-N	449.360	1.871	50	20	IDGD	
CC(=O)N1CCN(CC(=O)N2CCCC[C@@H]2C2CCN(C(=O)[C@@H](F)Cl)CC2)CC1	1828493028	PJOJWIMTUKIBIH-IEBWSBKVSA-N	430.952	1.305	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(O)c(F)c3)C2)C1	1830363643	GHSLQGCLGFDPFQ-FQEVSTJZSA-N	428.888	1.866	50	20	IDGD	
Cc1ncoc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)CBr)CCO2	1830537604	LFKSLKIMHSOMRO-PXAZEXFGSA-N	430.299	1.084	50	20	IDGD	
O=C(/C=C/c1ccc([N+](=O)[O-])o1)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1830912698	ZAYSXPPPEBCTSD-XKKXFUJGSA-N	448.259	1.461	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CS(C)(=O)=O)CC1	1831549165	MHNKATUCKMFCAX-LSDHHAIUSA-N	437.400	1.824	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCc2nc(N)n[nH]2)CC1	1831655271	MZZCBIKQPNVIDE-TZMCWYRMSA-N	441.374	1.723	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(CO)c(F)c3)C2)C1	1831658415	FHKXGVXWYADEHX-UWJYYQICSA-N	442.915	1.796	50	20	IDGD	
Cc1cccnc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1831834836	IPSJNZHYIRTZEW-RHSMWYFYSA-N	430.274	1.151	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H](O)c2ccccc2)CC1	1831871127	LWRMKPIEGFOVPZ-REWPJTCUSA-N	444.576	1.713	50	20	IDGD	
C[C@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1)N1C[C@H]2C[C@H]2C1	1831873745	VUHWISZSWJRMIL-PBASOCQRSA-N	447.624	1.319	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cn3nnc4ccccc43)CCO2)C1	1832199007	PWNYJJCQUOOHIX-HRAATJIYSA-N	449.939	1.295	50	20	IDGD	
CC(=O)C(C)(C)C(=O)NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1	1833410911	RRMAOPJCFBIMRJ-HNNXBMFYSA-N	434.350	1.864	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCC(N2CCC(NC(=O)c3cnccn3)CC2)CC1	1834123264	UIKOZNHZLGPGMB-IBGZPJMESA-N	428.364	1.898	50	20	IDGD	
Cc1cncc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)c1	1834287448	HDRXGFMSIGVGED-KSSFIOAISA-N	426.311	1.243	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(C)cn3)CCO2)C1	1834378222	AYLVTMLMLBHFDX-HNAYVOBHSA-N	440.338	1.634	50	20	IDGD	
CN(C)c1ccc(C(=O)N2CCC(N3CCC(NC(=O)[C@@H](F)Cl)CC3)CC2)cn1	1835084317	XJAGLORAPOVAFW-GOSISDBHSA-N	425.936	1.867	50	20	IDGD	
O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)CCc1ccsc1)CCO2	1836004709	NKLDSLKRVURCEF-SFHVURJKSA-N	445.379	1.922	50	20	IDGD	
COCCOCC(=O)N1CCC(OC2CCN(C(=O)[C@H](C)CBr)CC2)CC1	1836671244	RVBZQRLZSWBHBC-OAHLLOKOSA-N	449.386	1.679	50	20	IDGD	
Cc1nc(CC(=O)N2CCOC[C@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)cs1	1837710174	MHFZPPIYNPZIKC-LJQANCHMSA-N	441.626	1.302	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(F)nc3)CCO2)C1	1837851461	KMTLEOOUCMJWGS-KSSFIOAISA-N	444.301	1.464	50	20	IDGD	
CCc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)no1	1838129338	PYIKDYJJRCSZGS-SJCJKPOMSA-N	430.299	1.090	50	20	IDGD	
O=C(C[C@@H]1C[C@@H]2CC[C@H]1C2)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1839915227	JKCIWHHWBRRCNJ-LEVYEWFFSA-N	447.345	1.960	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(F)ccc3Cl)C2)C1	1840154769	FSRPJIPKVGSJCE-QFBILLFUSA-N	449.306	1.803	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)c3cccs3)C2)C1	1840156533	USCVGRJKGOPNEU-VCBZYWHSSA-N	430.954	1.562	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3c(C)nn(C)c3C)CCO2)C1	1840434516	DKEMYFMUIHGMIE-NQIIRXRSSA-N	440.972	1.443	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)CCc2ccc(F)c(F)c2)C1	1841200870	AFYXLJKLFGRAGE-UHFFFAOYSA-N	428.244	1.094	50	20	IDGD	
CSC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1	1841354521	FOCBVFOLCRCDNO-STQMWFEESA-N	435.974	1.046	50	20	IDGD	
Cc1ncoc1C(=O)N1CC2(CCCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C1	1841924190	GAWRWHAYLAKPMZ-ZDUSSCGKSA-N	426.901	1.932	50	20	IDGD	
O=C(CC[C@H]1CNc2ccccc2C1)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843011135	VFWCAKXMZLOGMR-GOSISDBHSA-N	447.344	1.248	50	20	IDGD	
O=C([C@@H]1[C@H]2Sc3ccccc3[C@@H]21)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843014278	TVYIDGHMSZUTFQ-AABGKKOBSA-N	434.326	1.071	50	20	IDGD	
Cc1cc(C(=O)N2CCCC23CN(C(=O)c2ccc(B(O)O)cc2)C3)nc2ccccc12	1843738992	APGUPXHNNDZQDI-UHFFFAOYSA-N	429.285	1.354	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)c1ncn3nc(N4CCOCC4)ccc13)C2	1845164622	QLPUKMZWOQIFMG-HNNXBMFYSA-N	446.939	1.400	50	20	IDGD	
C[C@@H]1Oc2ccc(C(=O)N3CC4(CCCN4C(=O)[C@H](F)Br)C3)cc2NC1=O	1845218567	NHTGDQVUDUSGJU-HZMBPMFUSA-N	440.269	1.914	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC12CN(C(=O)c1cc(=O)nc3sccn13)C2	1846177905	SAHFTIAISKREKW-JTQLQIEISA-N	425.308	1.356	50	20	IDGD	
COc1c(Cl)cccc1C(=O)N1CCCC12CN(C(=O)c1cccc(B(O)O)c1)C2	1846852870	VBAJAQTZHFMVHD-UHFFFAOYSA-N	428.681	1.159	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CCCC[C@@H]1C(=O)N1CCCC12CN(C(=O)[C@H](O)CCl)C2	1846950086	SETKIAIOKNXFAS-ARFHVFGLSA-N	443.972	1.873	50	20	IDGD	
O=C(CN1CCc2sccc2C1)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](F)Br	1848109065	XSAQLVMVIGHBCS-XEZPLFJOSA-N	430.343	1.999	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NN[C@@H](C(=O)NC2CC2)c2ccccc2)cc1	15474356	IBIROIWEZUAIEU-HXUWFJFHSA-N	430.530	1.256	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2sc3nc4n(c(=O)c3c2C)CCC4)cc1OC	15662993	VVKVMUOVQWXGGH-UHFFFAOYSA-N	428.470	1.805	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)CCC(=O)c2ccc3c(c2)OCCO3)c2ccccc2c1=O	15940207	ONEWQPNJZGJSEU-UHFFFAOYSA-N	436.424	1.129	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNS(=O)(=O)c2ccc3c(c2)NC(=O)CO3)cc1	24259973	UMFFWPLINMSVFX-LBPRGKRZSA-N	435.458	1.193	50	20	IDGD	
CN1C(=O)C(=NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)c2ccccc21	254560230	RJLORJDHIVBOIS-UHFFFAOYSA-N	426.498	1.972	50	20	IDGD	
CN1C(=C(C#N)C(=O)COC(=O)c2ccc(CS(C)(=O)=O)o2)N(C)c2ccccc21	726045974	NYQZNXFFLIUWFL-UHFFFAOYSA-N	429.454	1.871	50	20	IDGD	
O=C(COC(=O)[C@H]1CCCN(C(=O)c2ccc3n[nH]cc3c2)C1)NNC(=O)c1ccccc1	726202315	MLHJGQFQGSIKLE-KRWDZBQOSA-N	449.467	1.420	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)COc1ccccc1OCC(F)(F)F	727665883	KRVHMFJIWPVAGL-UHFFFAOYSA-N	431.392	1.645	50	20	IDGD	
N#C/C(=C\c1c[nH]nc1-c1ccc2c(c1)OCO2)C(=O)Nc1ccc(S(N)(=O)=O)cc1	728157195	MFHPUXBNWBDRSV-NTUHNPAUSA-N	437.437	1.998	50	20	IDGD	
C[C@H](C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1)n1cnc2ccccc21	728213705	HHNVDWHOHAEPFB-MRXNPFEDSA-N	442.545	1.677	50	20	IDGD	
COc1ccc(Cl)c(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1N	728341871	YKOVQJYFRFESRZ-AWEZNQCLSA-N	435.820	1.075	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(C)c(NC(=S)NNC(=O)Cc2cccnc2)c1	728800005	XVJGMNAQRFPRTH-UHFFFAOYSA-N	435.575	1.981	50	20	IDGD	
CCc1nc(CN2CCN(C(=O)NNC(=O)c3c(C)nc4ccccn34)CC2)cs1	728944613	HFVWHVYXHQIWHN-UHFFFAOYSA-N	427.534	1.834	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)COc1ccc2ccccc2c1Br	729276060	WIXLKHBJZCKKGC-SNVBAGLBSA-N	444.307	1.066	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)c2ccc3c(c2)nnn3C)c2ccccc2c1=O	729300256	PTHIHMLILYLLAH-UHFFFAOYSA-N	433.472	1.943	50	20	IDGD	
O=C(CNc1ccccc1)NNC(=O)[C@H]1CCCN(S(=O)(=O)Cc2ccccc2)C1	730585752	MMWQOYVJQVHNOE-SFHVURJKSA-N	430.530	1.488	50	20	IDGD	
COc1cc(OC)c(CCNC(=O)NNC(=O)COc2ccccc2C#N)c(OC)c1	731119433	RPOAMGCXBUOXQW-UHFFFAOYSA-N	428.445	1.536	50	20	IDGD	
O=Cc1ccc(OCc2occc2C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1	731599368	WWAULPWCWVWGTM-UHFFFAOYSA-N	432.396	1.722	50	20	IDGD	
CC(C)(C(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1)S(C)(=O)=O	733142938	ZBEVSJRXUZBTKG-LJQANCHMSA-N	429.542	1.584	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)c1ccccc1I	734239989	IMADCBZRQNCVSL-UHFFFAOYSA-N	448.261	1.760	50	20	IDGD	
CSCC[C@H](NC(=O)c1ccc([N+](=O)[O-])o1)C(=O)NNC(=O)Cc1ccsc1	734439472	FADBBRWSZOVGLJ-NSHDSACASA-N	426.476	1.491	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)NCC2(c3ccc(Br)cc3)CCOCC2)cn1	735514039	YJRKSKHQEKSKOM-UHFFFAOYSA-N	436.310	1.875	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)N[C@H](C)C(=O)N2CCCC[C@@H]2C)c2ccccc2c1=O	737053933	FXZKETLQCZIPKU-LSDHHAIUSA-N	442.520	1.711	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@H]2C(=O)NNC(=O)COCc2ccccc2)c(OC)c1	737638429	XTHSQLPRSQPMQR-IBGZPJMESA-N	441.484	1.673	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H]1C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	739511823	OCRQITKZQSBPRO-LSDHHAIUSA-N	425.507	1.545	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1ccc2c(c1)OCCO2)[C@H]1CN(Cc2ccccc2)CCO1	741285230	ZMMDBOWFVKJYKJ-IIBYNOLFSA-N	440.500	1.691	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Cc2ccc(F)cc2)cc(NS(C)(=O)=O)c1OC	742480081	JNUVYMSAPQELKX-UHFFFAOYSA-N	425.438	1.218	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCc2ccccc2-n2cccn2)nc1	743357092	WCLZLPGCPXASSC-UHFFFAOYSA-N	429.506	1.780	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)NCCCN2C(=O)COc3ccccc32)c1	743640860	WGYWBLIOFQCBJL-UHFFFAOYSA-N	428.445	1.464	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)Cn2nnc3ccccc3c2=O)cc1Cl	743833859	JNUGIGFIUIKVJA-UHFFFAOYSA-N	432.824	1.315	50	20	IDGD	
CN(CCCOc1ccc(S(C)(=O)=O)cc1)CC(=O)NNC(=O)c1ccc(C#N)cc1	744391542	YGLQMWKDLNGIMP-UHFFFAOYSA-N	444.513	1.124	50	20	IDGD	
CC(C)CC(=O)N[C@H](C(=O)OCC(=O)NNC(=O)c1cccc(C#N)c1)c1ccccc1	744935550	LDVPZBNNABDIHB-NRFANRHFSA-N	436.468	1.766	50	20	IDGD	
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)NNC(=O)c1cc([N+](=O)[O-])ccc1O	745428852	RFWIOXDZSAWWHS-UHFFFAOYSA-N	427.417	1.681	50	20	IDGD	
O=C(COC(=O)[C@H]1SCCc2sccc21)NNC(=O)[C@@H]1COc2ccccc2O1	745636819	OCQBVNHYDXZWIJ-YOEHRIQHSA-N	434.495	1.609	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)N[C@@H]1CCN(c2ccccc2Cl)C1=O	745813045	IHTUZXAMLHFOOY-CYBMUJFWSA-N	433.808	1.703	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)N[C@H]2CCN(c3cc(C)nn3C)C2=O)cc1	745907097	YGOWEDPYQHJXFT-YOEHRIQHSA-N	444.492	1.030	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)[C@@H]2CCCCN2C(=O)c2ccc(O)nn2)c1	746093694	VTOGTIJWAJOPKX-KRWDZBQOSA-N	427.461	1.020	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)NCC(=O)N2CCC(Cc3ccccc3)CC2)n1	746775102	CDAZMIIIMQHQDA-UHFFFAOYSA-N	426.521	1.312	50	20	IDGD	
O=C(CS(=O)(=O)C1CCCC1)NNc1ccc(S(=O)(=O)Nc2nccs2)cc1	747942608	BMRZJCGVDBHPGA-UHFFFAOYSA-N	444.560	1.744	50	20	IDGD	
C[C@@]1(c2ccc(C(=O)NNC(=O)Cc3nc(-c4ccccc4)cs3)cc2)NC(=O)NC1=O	748518421	BRHVMOKPROJHFA-QFIPXVFZSA-N	449.492	1.868	50	20	IDGD	
Cc1cc(F)ccc1NNC(=O)[C@H](CCS(C)(=O)=O)NS(=O)(=O)c1ccccc1	748562777	MPWZXLOOPMZFAU-KRWDZBQOSA-N	443.522	1.359	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCCN(C)Cc2ccc(F)cc2)nc1	748976412	ILACZZHDRWLHKO-UHFFFAOYSA-N	438.529	1.666	50	20	IDGD	
COc1cc([N+](=O)[O-])ccc1OC(=O)c1ccc(F)c(S(=O)(=O)N2CCOCC2)c1	751179375	FXCSTFFIMQUIMG-UHFFFAOYSA-N	440.405	1.983	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(n2cc(C(=O)NNC(=O)c3ccc(Cl)nc3)nn2)CC1	751336745	NPOTWAKMTBFKSS-UHFFFAOYSA-N	449.899	1.973	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNS(=O)(=O)c1cnn([C@H]2CCOC2)c1	751537811	ANFCHQFSGKFFJY-AWEZNQCLSA-N	433.515	1.900	50	20	IDGD	
CN(C)C(=O)c1ccc(C=NNC(=O)Cc2nn3c(C4CCCCC4)nnc3s2)[nH]1	752163927	NTAKBCFHHFJNAB-UHFFFAOYSA-N	428.522	1.956	50	20	IDGD	
CC(=O)NC[C@H]1CCn2ncc(C(=O)NNC(=O)c3cc(-c4ccc(F)cc4)[nH]n3)c2C1	753258790	KPSVSSIEPHRTEQ-ZDUSSCGKSA-N	439.451	1.186	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@H]2CCc3cc(OC)ccc3C2)c2ccccc2c1=O	753289820	YRDKIJFJNWNLLX-INIZCTEOSA-N	435.484	1.927	50	20	IDGD	
C[C@H](NCC(=O)NNC(=O)c1cccc(C#N)c1)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	754322116	XHIPDPVDTKBVOF-MAUKXSAKSA-N	429.521	1.944	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@@H](C)c1ccc([N+](=O)[O-])cc1F	754849105	KZTGIOQIDJEJFC-JTQLQIEISA-N	437.453	1.900	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)Cc2cccnc2)cc1S(=O)(=O)N1CCCCC1	755392378	GKDFDPLSLCIMRQ-UHFFFAOYSA-N	431.518	1.960	50	20	IDGD	
O=C(CN1CCOCC1)Nc1ccc(NC(=O)NNC(=O)c2ccc3ccccc3n2)cc1	755598231	FEZZQWJCZRCSIJ-UHFFFAOYSA-N	448.483	1.972	50	20	IDGD	
Cc1ccc(C(=O)NC2CC2)cc1NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1	755830090	ISXBWKHBIMPFRW-UHFFFAOYSA-N	437.504	1.747	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCC[C@@H]2C(=O)OCc2ccccc2)cc1OC	756533971	XHGRJJNJKHBVBK-GOSISDBHSA-N	441.484	1.673	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)Nc2cccn(CC(F)(F)F)c2=O)c2ccccc2c1=O	757659444	YFBYZBKIRPTACX-UHFFFAOYSA-N	436.350	1.124	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)Nc2c(C)nn([C@@H]3CCS(=O)(=O)C3)c2C)c1O	757872358	XOPGSXNWPDNHQM-GFCCVEGCSA-N	437.478	1.040	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)CC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)C[C@@H](C)O1	760119364	HIVSIAGTCRCEBQ-IXDOHACOSA-N	426.558	1.670	50	20	IDGD	
C[C@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)c1cccc([N+](=O)[O-])c1	761390951	MGJUUXCRLMOXQM-AWEZNQCLSA-N	446.485	1.944	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)CCc2nnc(-c3ccc(Cl)cc3)o2)C[C@H](C)O1	762444542	RDGPPDLIUFJGAD-KBPBESRZSA-N	435.912	1.969	50	20	IDGD	
CC(C)(C)OC(=O)N(CC(=O)NNc1nccc(N2CCOCC2)n1)C[C@H]1CCCO1	762860723	HUDUYOBSHJVUTK-OAHLLOKOSA-N	436.513	1.172	50	20	IDGD	
CN1CC[C@H](CNC(=O)NN[C@@]2(C)CCS(=O)(=O)C2)[C@@H]1c1ccc(Cl)c(F)c1	763091488	KSAOEBGMWZKCFC-SKDZVZGDSA-N	432.949	1.853	50	20	IDGD	
CCNC(=O)N1CCc2ccc(NC(=O)C(=O)NNC(=O)c3ccc4ccccc4n3)cc21	763448984	ASWBEWYGUFWNFS-UHFFFAOYSA-N	446.467	1.727	50	20	IDGD	
C[S@](=O)Cc1cc(NC(=O)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)ccc1Cl	763468944	YXRWVVXGKXLIAL-LJAQVGFWSA-N	438.849	1.526	50	20	IDGD	
O=C(NNC(=O)c1cccnc1)C(=O)Nc1ccccc1-n1cc(Br)cn1	763492070	TWBOBSLJHFJDHU-UHFFFAOYSA-N	429.234	1.430	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c(F)c1	763507795	FOQMWPFLKABJKY-UHFFFAOYSA-N	448.476	1.318	50	20	IDGD	
O=C(COc1cccc(C(F)(F)F)c1)NNC(=O)C(=O)Nc1ccc(-n2ccnn2)cc1	763639009	IFNTXLJKXDGAOD-UHFFFAOYSA-N	448.361	1.451	50	20	IDGD	
CCC(=O)Nc1ccc(Cl)c(NC(=O)C(=O)NNC(=O)COc2ccc(OC)cc2)c1	763659014	HDWRCKFIAZBSSC-UHFFFAOYSA-N	448.863	1.862	50	20	IDGD	
COC(=O)Nc1cc(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)ccc1F	763681693	MFVCCMPNVHEURG-UHFFFAOYSA-N	429.364	1.041	50	20	IDGD	
CNC(=O)CCOc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)cc1	763685556	CRVKQSICKMQQGD-UHFFFAOYSA-N	448.863	1.020	50	20	IDGD	
CSCC[C@H](NC(=O)c1ccc([N+](=O)[O-])o1)C(=O)NNC(=O)Cc1ccccc1C	763689621	YQWYLMXHNSJSSI-AWEZNQCLSA-N	434.474	1.738	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2cc(C3CCCCC3)nn2C)c1	763774788	FZJRIXVBYRWZJU-UHFFFAOYSA-N	429.477	1.885	50	20	IDGD	
N#Cc1c(F)cccc1-n1ccc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCC3)n1	763784193	BDBAIOJTEKAYKE-UHFFFAOYSA-N	438.444	1.833	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)C(=O)Nc2c(F)cc(F)cc2F)c2ccccc2c1=O	763790648	MFDIAGFHCACWTI-UHFFFAOYSA-N	447.373	1.794	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)NC3CC3)cc2)c1C	763840524	MJTQIWUNIAAOCF-OAHLLOKOSA-N	438.484	1.749	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccccc1SCCC(N)=O	763874137	ZVPMLLMISOMMAJ-LBPRGKRZSA-N	448.476	1.347	50	20	IDGD	
CS(=O)(=O)Cc1ccccc1NC(=O)C(=O)NNC(=O)c1cc2c(s1)CCCCC2	763962077	KYAIJGOIKMEYHD-UHFFFAOYSA-N	449.554	1.961	50	20	IDGD	
CC(=O)Nc1ccc(Cl)c(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)c1	763995009	CJQOAACAMQYUFL-UHFFFAOYSA-N	442.657	1.789	50	20	IDGD	
CCCCS(=O)(=O)N1CCC(C(=O)NNC(=O)CSc2ccccc2O)CC1	764045926	DUSKZNKDBLETDD-UHFFFAOYSA-N	429.564	1.474	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)Cc3ccccc3F)cn2)C[C@H](C)O1	764312944	DYEGCZBFESWIHV-KBPBESRZSA-N	429.452	1.163	50	20	IDGD	
COC(=O)c1cc(F)c(F)cc1NC(=O)C(=O)NNC(=O)c1cnn(-c2ccccc2)c1	764352072	ZGPAJEPBWHYVTH-UHFFFAOYSA-N	443.366	1.337	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc4nccn4c3)n[nH]2)cc1OC	764379252	SWPXLCULGXHMOF-UHFFFAOYSA-N	449.427	1.141	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)[C@H](C)NS(=O)(=O)c2ccc(C#N)cc2)c1	764524763	OMRMKLNAKAVXSH-HNNXBMFYSA-N	430.486	1.068	50	20	IDGD	
CC(C)NC(=O)C(=O)NNC(=O)CSc1nnc(-c2ccncc2)n1-c1ccccc1	764610277	XLYCADZSHYHDGA-UHFFFAOYSA-N	439.501	1.093	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNS(=O)(=O)c1ccc(Cl)s1	765119411	VTUYKLJQERUPNK-UHFFFAOYSA-N	442.950	1.169	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc([N+](=O)[O-])c2cccnc12)[C@H]1COc2ccccc2O1	766354374	BGIMQSIDODFRGI-OAHLLOKOSA-N	430.398	1.293	50	20	IDGD	
O=C(CSCc1ccccn1)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	766669766	SMNCQLUIFUCUHN-UHFFFAOYSA-N	447.992	1.933	50	20	IDGD	
CC1(C)OCC(C)(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)CO1	767163133	FEGUYHPOCSYADF-UHFFFAOYSA-N	425.507	1.021	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)CO[C@H]2CCCN(C(=O)OC(C)(C)C)C2)c1	768065068	UMNOSAYJXKBQTJ-KRWDZBQOSA-N	449.504	1.715	50	20	IDGD	
COc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)C(=O)NNc1c(F)cccc1Cl	770810759	AQCBGNUNDILTOU-UHFFFAOYSA-N	444.872	1.820	50	20	IDGD	
C[C@@H](C(=O)NNc1nc(O)c2cnn(C(C)(C)C)c2n1)S(=O)(=O)c1ccc(F)cc1	770967543	PZNDIPUGFKGNHQ-JTQLQIEISA-N	436.469	1.732	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)c3ccc(=O)n(Cc4ccccc4Cl)c3)nc21	770973121	LKEFRQMAIFDNKN-UHFFFAOYSA-N	425.836	1.689	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(NC(=O)NNc2ccnc(Br)c2)cc1	771161311	MAMADRBKPIIMFJ-UHFFFAOYSA-N	444.311	1.917	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)N2CCC3(CC2)CC(C(=O)OC)=NO3)c1C	771458035	CHDHNSALQCWROH-PDGQHHTCSA-N	428.489	1.969	50	20	IDGD	
C[C@@H]1Sc2ccc(C(=O)NNC(=O)C(=O)NCc3ccc(Cl)cc3)cc2NC1=O	772195438	MHRGCWFLINIWIY-JTQLQIEISA-N	432.889	1.850	50	20	IDGD	
CC1CCC(N2C[C@H](C(=O)NNC(=O)C(=O)NCc3ccc(Cl)cc3)CC2=O)CC1	772906290	SILMJUJBTKEDCQ-GNHJJJEISA-N	434.924	1.531	50	20	IDGD	
Cc1ccc(-n2nc(C)cc2NC(=O)C(=O)NNC(=O)c2c(Cl)cccc2Cl)nn1	773495620	DXRRXKFXINVPSX-UHFFFAOYSA-N	448.270	1.986	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccn(Cc2ccncc2)n1	774000986	BNFGFNHDHVFEHS-ZDUSSCGKSA-N	442.863	1.533	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)CCc2ccc3[nH]ccc3c2)cc1	775638868	JTHDDNKULDYPSU-UHFFFAOYSA-N	428.514	1.877	50	20	IDGD	
O=C(NNC(=O)c1cccc(Br)c1)Nc1ccnn1[C@H]1CCS(=O)(=O)C1	776056559	LNDCAPJVXUSGRD-LBPRGKRZSA-N	442.295	1.472	50	20	IDGD	
Cc1ccc(S(=O)(=O)C[C@@H](C)NC(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)cc1	776191149	ACIZNAVLAOLCQS-GFCCVEGCSA-N	436.446	1.415	50	20	IDGD	
CC(C)[C@H](NC(=O)OC(C)(C)C)C(=O)NCC(=O)NNc1cccc(S(C)(=O)=O)c1	776535093	ZCYKNNYHMUEYOT-INIZCTEOSA-N	442.538	1.199	50	20	IDGD	
CCOC(=O)N1CCC([C@H](C)NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)CC1	777684102	QGBGTAOMLKIFAK-ZDUSSCGKSA-N	440.522	1.291	50	20	IDGD	
C#CCCCCCC(=O)NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1	779936385	NGRWDSDRLIPQNU-UHFFFAOYSA-N	434.562	1.032	50	20	IDGD	
CN(C)[C@@H](C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1)c1cccc(Cl)c1	780105405	VXRKTJBAOTXSIC-IEBWSBKVSA-N	447.875	1.473	50	20	IDGD	
COc1cccc(NNC(=O)CCNS(=O)(=O)c2ccc(OC(F)(F)F)cc2)n1	780768611	WKMJSGUZGQYECQ-UHFFFAOYSA-N	434.396	1.801	50	20	IDGD	
CCCc1ccccc1NC(=O)C(=O)NNC(=O)c1sc(N2CCOCC2)nc1C	782896387	HLASZQWGMFJYEG-UHFFFAOYSA-N	431.518	1.640	50	20	IDGD	
CCN1CCN(Cc2ccc(NC(=O)C(=O)NNc3ncnc4ccsc34)cc2)CC1	783254543	DIZYUGNWQBNZCR-UHFFFAOYSA-N	439.545	1.911	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2ccc(C(=O)N3C[C@H](C)O[C@@H](C)C3)cc2)nc(C)n1	783324381	KEOXRESSCCILJM-KBPBESRZSA-N	426.477	1.425	50	20	IDGD	
CC(C)(C)Cc1cc(NC(=O)C(=O)NN[C@@]2(C)CCS(=O)(=O)C2)n(-c2ccccc2)n1	783428907	YRFCQLUHGDEAPD-NRFANRHFSA-N	447.561	1.597	50	20	IDGD	
O=C(NNc1ccc(-n2cccn2)nn1)C(=O)Nc1ccccc1OCc1cscn1	783432837	FXMBTJOYHNZPGC-UHFFFAOYSA-N	436.457	1.780	50	20	IDGD	
COC(=O)c1cc(C(C)(C)C)sc1NC(=O)C(=O)NNc1ccc(-n2cccn2)nn1	783433667	XNLNYAZWQQQVFG-UHFFFAOYSA-N	443.489	1.890	50	20	IDGD	
CO[C@H](C)c1cccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)c1	784215248	GLQAPQPEQMCSRQ-CYBMUJFWSA-N	432.502	1.917	50	20	IDGD	
C[C@H](C[S@](C)=O)NC(=O)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1	784254389	LICXEKYWHNEYKL-PSVRVRDFSA-N	428.558	1.711	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCCCC2)cc1NC(=O)C(=O)NNc1ccccc1	784765018	LKOTVHYEEWDGPF-UHFFFAOYSA-N	432.502	1.952	50	20	IDGD	
COCCOc1cccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)c1	784835223	ITHNCHRFQJQEBO-UHFFFAOYSA-N	443.428	1.790	50	20	IDGD	
Cc1cc(C)n(-c2cccc(NC(=O)C(=O)NNc3cccc(S(C)(=O)=O)c3)c2)n1	784844574	NIPRQMMMXNALPF-UHFFFAOYSA-N	427.486	1.974	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)C(=O)Nc2ccc(-n3nnnc3C(C)C)c(C)c2)c1	784851424	AITDCNHPNTXHLY-UHFFFAOYSA-N	437.460	1.963	50	20	IDGD	
CS(=O)(=O)c1c(F)cc(NC(=O)C(=O)NNc2ccc(C#N)c(Cl)c2)cc1F	785094450	GCUOVUAVGRCJDA-UHFFFAOYSA-N	428.804	1.975	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CN2CCC(CNC(=O)OCc3ccccc3)CC2)c1	786108982	SQNBHQVGLNRHED-UHFFFAOYSA-N	449.511	1.958	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](c2cc(C(=O)NNC(=O)COc3ccccc3O)n[nH]2)C1	787335968	WWOOVILNIGKBGC-ZDUSSCGKSA-N	445.476	1.680	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1)c1ncnn1C	788884850	CYWOHWCDYDVYOE-JXFKEZNVSA-N	433.516	1.834	50	20	IDGD	
COC[C@H](NC(=O)NNC(=O)[C@H](C)Oc1cccc(Br)c1)[C@@H]1CCCO1	789335689	SYDDSMIPLIEWEH-CQDKDKBSSA-N	430.299	1.741	50	20	IDGD	
Cn1nc([C@@H]2CCCO2)cc1NC(=O)C(=O)NNC(=O)c1cccc(C(F)(F)F)c1	789731107	CIVIBKRHMYDXAD-ZDUSSCGKSA-N	425.367	1.690	50	20	IDGD	
COc1cc(NNC(=O)C(=O)Nc2cnn(Cc3nnc4n3CCCC4)c2)ccc1Cl	789796250	PUGRLUJSDNTDDU-UHFFFAOYSA-N	444.883	1.603	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2ccc(CC(F)(F)F)cc2)c1	790393089	DOPKTCPPZWBXPR-UHFFFAOYSA-N	436.433	1.818	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2cc(N)cc(Br)c2C)n1	792399081	BZRALTVRFLOBGF-UHFFFAOYSA-N	441.307	1.652	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)Cc2ccc(NC(=O)OC(C)(C)C)cn2)c1	792651514	BWFHLNUOLPKFOV-UHFFFAOYSA-N	428.449	1.786	50	20	IDGD	
CCc1ccccc1OCC(=O)NNS(=O)(=O)c1cc(COC)cc(C(=O)OC)c1	793351347	WIWGPVLBAKZESK-UHFFFAOYSA-N	436.486	1.571	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)N[C@H]1CCc2ccccc2OC1	800983708	SEZVYMMEPJMKLJ-HNNXBMFYSA-N	431.518	1.626	50	20	IDGD	
CC(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)cc1	802068629	MMRKXQSPTRJERY-UHFFFAOYSA-N	439.515	1.739	50	20	IDGD	
CC(C)(C)OC(=O)N1CCOC[C@H]1CC(=O)OCC(=O)NNC(=O)c1cccs1	803947967	LUKAKBYQGKUNJK-GFCCVEGCSA-N	427.479	1.078	50	20	IDGD	
COC(=O)c1c(C)csc1NC(=O)C(=O)NNC(=O)CN1CCCc2ccccc21	806973452	BYDQTVZZJACBDK-UHFFFAOYSA-N	430.486	1.382	50	20	IDGD	
O=C1COc2c(cc(Cl)cc2NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)N1	806975737	MSZHBAIMKCYXBM-UHFFFAOYSA-N	439.211	1.430	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)N[C@@H](C)[C@@H](c1ccccc1)N(C)C	807404104	YUIGSAWWMLUUQW-YOEHRIQHSA-N	446.577	1.924	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccco2)c1	808045062	ACICGZHXAYJXAA-UHFFFAOYSA-N	439.490	1.308	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)c1ccc(Cl)c(S(=O)(=O)N(C)OC)c1	808045624	OKCYVNXEOKCPOZ-UHFFFAOYSA-N	437.902	1.072	50	20	IDGD	
CCOC(=O)C1CCN(S(=O)(=O)NNC(=O)c2cccc(Br)c2)CC1	808096858	JAFFPCKMDMOUIJ-UHFFFAOYSA-N	434.312	1.203	50	20	IDGD	
COC[C@]1(C(=O)NNC(=O)c2c(C)nc3ccccn23)CCN(C(=O)OC(C)(C)C)C1	809984498	MCZMIXDNXRYVDT-NRFANRHFSA-N	431.493	1.677	50	20	IDGD	
CNC(=O)c1cc(Oc2ccc(NC(=O)C(=O)NNc3cccc(F)n3)cc2F)ccn1	810414585	XMLYMHXCNLTRAS-UHFFFAOYSA-N	442.382	1.989	50	20	IDGD	
C[C@H]1Oc2ccccc2N(CC(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)C1=O	811791618	YLDHLHMOKQGOBX-GFCCVEGCSA-N	431.832	1.458	50	20	IDGD	
N#Cc1cc(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cnc1C(F)(F)F	814708830	SXHRYIPCIUYDBU-UHFFFAOYSA-N	446.433	1.945	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1nc(CC(F)(F)F)cs1	815566083	IMZWQMOWDZTPHA-UHFFFAOYSA-N	427.364	1.284	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCc2nncn2C1)C(=O)Nc1cc(Cl)ccc1C(F)(F)F	815692600	VPFRYYSEWRSOBU-QMMMGPOBSA-N	430.774	1.299	50	20	IDGD	
C[C@H](CC(=O)NNC(=O)[C@H]1CCCN(C(=O)OC(C)(C)C)C1)NC(=O)c1ccccc1	816510430	VZEKNNHOABADAU-WBVHZDCISA-N	432.521	1.990	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)CN2C(=O)[C@@H]3[C@@H](C2=O)[C@H]2C=C[C@H]3C2)c1	816716198	BKCSYAQHMZUJLG-NXPNQGMMSA-N	448.273	1.486	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)[C@H]1CSC(c2ccccc2O)=N1	816916194	YPQXYRIBMYYIGQ-MRXNPFEDSA-N	432.527	1.838	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)CNC(=O)NCc2ccc(F)cc2)cc1OC	822194526	BWLDOJGNDXZMMR-UHFFFAOYSA-N	432.452	1.884	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)N2CCN(CC(=O)NC(C)C)CC2)c(C)n1C[C@H]1CCCO1	843328389	LUZRRHSHXIEGSY-WCCCRJGXSA-N	441.576	1.860	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNS(=O)(=O)c2ccc(S(C)(=O)=O)cc2)cc1	874067886	QYWYJMXPTBDSTP-ZDUSSCGKSA-N	442.515	1.266	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)[C@H](C)N2C(=O)[C@H]3CCCC[C@H]3C2=O)cc1OC	913069810	NGQOCJFYNXHLHT-CWRNSKLLSA-N	431.489	1.809	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	914781929	WYBGVLDHIGVEOB-UHFFFAOYSA-N	430.465	1.892	50	20	IDGD	
Cc1nn(C(C)(C)C)c2nc(C3CC3)cc(C(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)c12	915831994	FIPSISMWDVXZJE-ZDUSSCGKSA-N	433.534	1.568	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)NC[C@@H]2CN(Cc3ccccc3)CCO2)cc1C	915895209	WUHJHUAFDDGVCN-HXUWFJFHSA-N	439.516	1.473	50	20	IDGD	
CN1CCC(NC(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)CC1	915898707	VAZKWWFQERUURP-UHFFFAOYSA-N	445.545	1.203	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)NCCNC(=O)c1ccc(Cl)cc1	916262957	ZFOJEHDMFBTYLJ-UHFFFAOYSA-N	434.880	1.878	50	20	IDGD	
O=C(O)COc1ccccc1C=NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	916323753	OEWQHNRXBQBBFZ-UHFFFAOYSA-N	431.470	1.698	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NN=C2CCS(=O)(=O)c3ccccc32)ccc1Cl	916334245	IHLSXMGJNPYNQN-UHFFFAOYSA-N	427.891	1.299	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCC(=O)N(C)Cc2ccccc2)nc1	918090003	IBJUQOFVZMIDIX-UHFFFAOYSA-N	434.522	1.053	50	20	IDGD	
CC(C)c1c(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)cnn1-c1ccc(Cl)cc1	919890079	ZOAWXIXGMGPWAX-CYBMUJFWSA-N	439.925	1.780	50	20	IDGD	
O=C(Cc1csc(-c2ccc(Cl)s2)n1)NNC(=O)N[C@H]1CCS(=O)(=O)C1	920037177	ZZCBMUIZCLQMAM-QMMMGPOBSA-N	434.952	1.585	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCc2ccc(-n3ccnc3)c(F)c2)c2ccccc2c1=O	920239012	SMHDFFAHEHLHEE-UHFFFAOYSA-N	449.446	1.885	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NC(=O)NNC(=O)c2n[nH]c3c2CCCC3)cc1	1320106280	QKJWFAWBFYAABI-UHFFFAOYSA-N	434.522	1.786	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCC(=O)NNC(=O)CNc2ccc(C)cc2C)cc1	1325875744	VWTPHAKFKMJUJL-UHFFFAOYSA-N	434.518	1.240	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(N(C)C)nc3)C2)C1	1779764582	JWAOTESRDGOYOM-BEFAXECRSA-N	439.354	1.765	50	20	IDGD	
CC(C)(C)n1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@](C)(Cl)CCl)C3)C2)nn1	1781232439	UOTNWZRLMBFPEB-MSOLQXFVSA-N	432.352	1.713	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781332777	FMBFKBGRMYDXBW-CWSCBRNRSA-N	430.112	1.680	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cccc(N4CCOCC4)c3)C2)C1	1781738425	ZTQCSCKNTJUOEL-KNQAVFIVSA-N	435.952	1.984	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1cc[nH]n1)C2	1781905793	UYINJLUIQFFWSC-IIDMSEBBSA-N	427.343	1.640	50	20	IDGD	
CCOC(=O)O[C@@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)Br)C1	1782002590	RTXSCXGQHIACBU-KYZVSKTDSA-N	449.342	1.845	50	20	IDGD	
O=C(c1cccn2nccc12)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1782333393	RPUYGYCUXCWJPO-RHSMWYFYSA-N	425.258	1.468	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)N1CC[C@]2(CN(C(=O)[C@@H](C)CBr)CCO2)C1	1782698052	FUMTXLPIMZROMR-OGHNNQOOSA-N	435.315	1.409	50	20	IDGD	
Cn1cnc(C(=O)N2CCO[C@]3(CCN(C(=O)/C(C#N)=C/c4ccc(F)cc4F)C3)C2)c1	1782863773	MAGMLIIETOUIBQ-AGBQBWRISA-N	441.438	1.749	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H]3CCCO3)C2)C1	1783491110	PQWLMURGAZLKDH-ODXUAPNFSA-N	431.439	1.881	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)NNc3ccccc3)[C@H]2C1	1783553317	BQUWHQJSUCBQGS-QDSNELGPSA-N	438.956	1.225	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3C[C@@H]3c3ccc(F)c(F)c3)C[C@@H]21)[C@@H](O)CCl	1784084462	SRRPSNJGWRAGDK-OVKDOBFJSA-N	442.890	1.648	50	20	IDGD	
CC(C)(C)OC(=O)CCCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21	1784134321	MQNLGVCMRUZZDJ-JONQDZQNSA-N	432.945	1.078	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4c(n3)OCCO4)C[C@@H]21	1784618538	MGNIJBHEEUMKEG-XSWJXKHESA-N	437.924	1.854	50	20	IDGD	
COc1cccc(CCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)C(Cl)Cl)C[C@@H]32)n1	1785228088	ZXFZFUGGCOFLFQ-QEJZJMRPSA-N	430.332	1.806	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc[nH]c4nccc3-4)C[C@@H]21	1786405707	AOYGAVKWUDQFHX-RCBQFDQVSA-N	435.322	1.893	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]3C2)c1	1787444829	KCBNBXBJAVEWIV-TUUVXOQKSA-N	432.901	1.218	50	20	IDGD	
Cc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCBr)C[C@@H]32)cc(O)n1	1787455880	RCXHASOZAIFALI-QEJZJMRPSA-N	426.311	1.474	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3occc3Br)[C@H]2C1	1787588297	NSMOELBNEVAZPL-IMIFBBOLSA-N	449.729	1.889	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc4sccc4[nH]3)[C@H]2C1	1788433337	ZNNXQALBWFEQMR-ZQIUZPCESA-N	447.561	1.196	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C=N/N3CCCCC3)[C@H]2C1	1788602243	SCZONJMYVKXIIR-JXDJOTKESA-N	443.386	1.469	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccccc3C(N)=O)[C@H]2C1	1790129419	NXESDESOAZWNBW-APYUEPQZSA-N	438.322	1.162	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3=NO[C@@H](c4ccccc4)C3)C[C@@H]21	1791253503	BYKBIFNKEHBYRT-CAVMOMJPSA-N	449.935	1.738	50	20	IDGD	
CSCC[C@@H](O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)CBr)C[C@@H]21	1791303992	RDHQRJJKLNMJKM-FQKPHLNHSA-N	437.400	1.111	50	20	IDGD	
C[C@@H](Cn1cncn1)C(=O)NC1(c2ccc(NC(=O)CCC(=O)NN(C)C)cc2)CCC1	1791601182	SRRLWZMMCRAMMW-INIZCTEOSA-N	441.536	1.421	50	20	IDGD	
CC(C)N(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2)C(=O)OC(C)(C)C	1792595111	QIAKYYKBPMLFAQ-OCVGTWLNSA-N	435.924	1.756	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1cc(F)ccn1)C2	1792868799	PNJHGHADIZPNBU-ZUMXRPEOSA-N	442.329	1.774	50	20	IDGD	
CCc1noc(C)c1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)CBr	1792870941	MSDYVOXXJAAOFL-YGSHXTJESA-N	428.327	1.780	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(O)cc1F)C2	1792874100	KSJYAZKUZYWKOH-OVZMXSCWSA-N	429.286	1.766	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H]1CCCO1)C2	1794144151	QSEMVGGUJJRGQF-QRJUGERDSA-N	429.945	1.936	50	20	IDGD	
O=C(Cc1ccc(Br)cn1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2	1794157734	IMZNLFZOKZJBJB-OWLDWWDNSA-N	434.693	1.511	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](CN)c1ccccc1	1795676999	WEQVKCCQKYGACJ-RZFLPCETSA-N	438.366	1.492	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1noc2c1CCCC2	1796154643	CSOLLYPUEMLDTC-RHQBZFHZSA-N	430.332	1.993	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2c(c1)SCC(=O)N2	1796293611	IVACARPEKNHOIM-AHXJXLJNSA-N	437.949	1.951	50	20	IDGD	
COc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Cl)cc(C(F)(F)F)n1	1796366476	WXKXXZJTQCUBGV-RDBQEKCUSA-N	439.793	1.847	50	20	IDGD	
CC(C)(C)OC(=O)N1CCOC[C@H]1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](F)Cl	1796809032	MJAJVHBZRVMBIL-AIEDFZFUSA-N	433.908	1.795	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1CCN(S(C)(=O)=O)CC1	1797705980	AJLDIEQNPGMWLV-BJWYYQGGSA-N	445.658	1.148	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCCNC(=O)OC(C)(C)C)C2	1799273860	RPVYRPAOVRWPEL-IVSAIRAKSA-N	431.961	1.898	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](C)N1CCN(C)CC1	1799965397	MCECCBXNKBEABU-BPKGMFCQSA-N	429.403	1.292	50	20	IDGD	
CC[C@H](C)[C@H](N)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C#N)=C/c1ccc(F)cc1F	1800332623	TZSZIVPVYBYRFI-SUADVCAXSA-N	446.498	1.835	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)Br)n1	1800757159	AHGUBHXCAPFKMO-YGSHXTJESA-N	439.310	1.027	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)Br	1800761633	DDASGFXVDQXRAR-RMPHRYRLSA-N	426.149	1.533	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1n[nH]c3ccc(C#N)cc13)C2	1802338622	UVWCICPEBBKALX-MUJYYYPQSA-N	437.504	1.059	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)[C@@H]2CCCCO2)[C@@H]1c1cccnc1	1802586560	AQYIEELNVUNYPR-LQWHRVPQSA-N	431.537	1.030	50	20	IDGD	
C[C@@H](CS(C)(=O)=O)C(=O)N1CCCC2(CCN(C(=O)CCBr)CC2)C1	1806040926	DPBAIMXGAPHEJG-AWEZNQCLSA-N	437.400	1.683	50	20	IDGD	
Cc1nnc(CC(=O)NC[C@@H]2CCN(C(=O)CO[Si](C)(C)C)[C@@H]2c2cccnc2)o1	1807470833	MERJVKNYOSGMNB-OXJNMPFZSA-N	431.569	1.873	50	20	IDGD	
Cn1ccc(CC(=O)NC[C@H]2CCN(C(=O)CO[Si](C)(C)C)[C@@H]2c2cccnc2)n1	1807511087	AERDQBXDODZYOP-DYESRHJHSA-N	429.597	1.915	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1ccccc1F	1811673402	NGQBHNPMJDZQOS-GCJKJVERSA-N	447.275	1.534	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2nc[nH]c2[N+](=O)[O-])[C@H]1c1cccnc1	1813030201	FDYXRFBMKVPVGY-IPYPFGDCSA-N	436.856	1.286	50	20	IDGD	
C/C(=C/C(=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@@H]1c1cccnc1)C(=O)O	1814097025	ZLHNVHSECUBOCV-PVPCMPRFSA-N	428.258	1.809	50	20	IDGD	
Cc1ccc(C(=O)NCC(=O)N2CCCC[C@@H]2c2cc(NC(=O)[C@@H](O)CCl)n[nH]2)cc1	1814876178	QIPIYXNTJUVKQJ-SJORKVTESA-N	447.923	1.740	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CNC(=O)c2cccnc2)n[nH]1	1815785895	CUIWVRYTGYARRZ-ZBFHGGJFSA-N	448.911	1.481	50	20	IDGD	
Cc1cnc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)s1	1816282963	AOSAKBCHPUBFNI-MRXNPFEDSA-N	439.306	1.474	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CN2CCOCC2)n[nH]1	1817150496	GFCVNQZHQXAPGX-GXTWGEPZSA-N	428.331	1.517	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1)c1nn[nH]c1C(F)(F)F	1820323560	PVTSTWYJIUNVEY-BDAKNGLRSA-N	435.794	1.452	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H]2C[C@H](O)CN2)n[nH]1	1820754058	WBDXLSWQSLNRNY-AUZPSNTRSA-N	428.331	1.298	50	20	IDGD	
O=C(CCBr)N[C@@H]1CCc2nc(NC(=O)c3c[nH]c(=O)cn3)sc2C1	1821466190	UPWRKFAZYJWLQP-MRVPVSSYSA-N	426.296	1.237	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(=O)cco2)[nH]n1	1822413403	UQGANSPLRWDZKK-OAHLLOKOSA-N	430.465	1.042	50	20	IDGD	
CC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCN1CCN(C)CC1)CC2	1822844107	URGOGYJTKNSGSN-KBPBESRZSA-N	428.002	1.710	50	20	IDGD	
COCCCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1	1824060819	VMEMFHAXGLIJHA-IBGZPJMESA-N	431.537	1.345	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H]2CNC(=O)O2)CC1	1824569579	PNXXQKJJROUTRI-YUELXQCFSA-N	430.343	1.746	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CN2CC(=O)NC2=O)CC1	1824608955	DWTOQJMTVPKCCI-JKSUJKDBSA-N	426.945	1.565	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1nccnc1OC)CC2	1825994148	QQPFUPZNOKFAMF-UWVGGRQHSA-N	425.898	1.421	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)COc1cccnn1)CC2	1826009064	LLHWCODVUPABTP-MNOVXSKESA-N	425.898	1.178	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)n2)CC1	1827600940	HGVHGCMEMTZKJF-INIZCTEOSA-N	436.585	1.973	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)c(C)o1	1830537842	QCOSFZWKRNJNKO-YJYMSZOUSA-N	443.338	1.997	50	20	IDGD	
CCCNC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](Cl)CCC)CCO2	1831640720	QMTCYJDAWJUMFV-OXQOHEQNSA-N	431.961	1.157	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1831654965	ZISLLDJTZYUHFI-SLEUVZQESA-N	429.714	1.541	50	20	IDGD	
Cc1ncc(CC(=O)N2CCC([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)s1	1831876192	BCSFZPVSINJLSV-IBGZPJMESA-N	449.621	1.987	50	20	IDGD	
Cc1noc(C)c1CC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)Br)C2)C1	1832561051	KJWQAJVCRPHHGM-XIKOKIGWSA-N	444.326	1.074	50	20	IDGD	
CC(C)[C@@H](O)C(=O)N1CCC(N2CCC(NC(=O)[C@H](C)CBr)CC2)CC1	1833265460	XELASBUMDVPLPJ-RHSMWYFYSA-N	432.403	1.606	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCC(N2CCC(NC(=O)CN3CCOCC3)CC2)CC1	1834621358	YOKQYJPLDYJXJT-FQEVSTJZSA-N	449.423	1.127	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](F)Cl)CC2)CC1)c1ccc(-n2cnnc2)cc1	1834651554	XZGRUKFOOUHSPF-LJQANCHMSA-N	448.930	1.987	50	20	IDGD	
CC[C@H](C)[C@@H](N)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1834686339	CQLQJNXBGOGPRR-APHBMKBZSA-N	435.382	1.622	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3ccncc3F)CC2)CC1	1835253406	HQIBPIOJCWPJSB-KRWDZBQOSA-N	426.920	1.660	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)c1ccn2ccnc2c1	1835573069	IOUMFNSLARQTIS-SFHVURJKSA-N	433.940	1.119	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)c1cnc(Cl)s1	1835993130	XDAGBEBYTAIXMH-ZDUSSCGKSA-N	435.377	1.581	50	20	IDGD	
O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)Cc1cccs1)CCO2	1836088039	ZVCAUCZANIGMSV-KRWDZBQOSA-N	431.352	1.532	50	20	IDGD	
COc1cnc(C(=O)N2CCC(OC3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)c(F)c1	1836715766	ZJTUELYCRIRIBJ-KRWDZBQOSA-N	443.903	1.441	50	20	IDGD	
O=C(c1ccc2ncncc2c1)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836717369	VLZPZCABLCNCTA-FQEVSTJZSA-N	446.935	1.842	50	20	IDGD	
O=C(c1ccc(Cl)cn1)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836717936	FYCMDMLSEQWSIJ-QGZVFWFLSA-N	430.332	1.947	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cc(O)ncn3)CC2)CC1	1836942071	YUGPMAJFGNBQSC-OAHLLOKOSA-N	426.901	1.048	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)c3ncnn3C)CC2)CC1	1837371939	VCUOQSVNUAYQRH-LBPRGKRZSA-N	428.331	1.211	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)o1	1837448157	BGOSEEUPRGCLOV-HXUWFJFHSA-N	441.912	1.573	50	20	IDGD	
CC(C)O[C@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)CBr)C2)C1	1837592556	WBPZIZYPQXLNIF-HDMKZQKVSA-N	435.359	1.287	50	20	IDGD	
CCc1[nH]nc(C(=O)N2CCOC[C@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)c1F	1837712412	PJSJTFXEDKPMDW-IBGZPJMESA-N	442.564	1.033	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)C#Cc3ccccc3)C2)C1	1837712484	UWDRTSIDPYFZEK-JOCHJYFZSA-N	430.577	1.346	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)c3ccccc3)C2)C1	1837712614	ZUCSUNWKONQHSK-TZIWHRDSSA-N	436.581	1.028	50	20	IDGD	
O=C([C@H](F)Br)N1CCC(OC2CCN(C(=O)[C@@H]3[C@H]4COC[C@H]43)CC2)CC1	1838648363	RSWXYHTUIDWJIF-JJXSEGSLSA-N	433.318	1.568	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1838648566	ZDGBSBCUOJPABL-ZIAGYGMSSA-N	443.741	1.929	50	20	IDGD	
O=C(c1ccc(O)cc1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1838971068	AIDSTTORIPBWCR-YOEHRIQHSA-N	431.258	1.153	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1C[C@H]1F)CCO2	1839099255	BPIFVCGKEKTVAO-APJXILSNSA-N	449.429	1.686	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(F)cc3OC)C2)C1	1839148891	MQFRHNHHPAAFSX-UZLBHIALSA-N	428.888	1.922	50	20	IDGD	
Cc1ccncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2	1839152734	JLOPZQBKQBHUDO-MOPGFXCFSA-N	430.332	1.696	50	20	IDGD	
O=C(CCc1ccccc1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839198215	XDLOPYOCMWXLIJ-MJGOQNOKSA-N	443.313	1.766	50	20	IDGD	
O=C(c1cc(Cl)c(O)cc1O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1839252183	PLPSTDOAGUOWFY-YOEHRIQHSA-N	437.251	1.356	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCBr)C3)C2)c(F)c1	1839259325	NLUCHKGSRSDMON-LJQANCHMSA-N	443.313	1.989	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ocnc3C)C2)C1	1839963851	YKSYXMRJUMOULV-GUYCJALGSA-N	430.299	1.227	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(F)s3)C2)C1	1840031489	RRGXMZVKTCPHHV-BDJLRTHQSA-N	435.315	1.741	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)COc3ccccc3)C2)C1	1840031784	BZTTUZZWGSGPBA-KXBFYZLASA-N	441.322	1.305	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3[nH]cc4c3CCC4)C2)C1	1840034223	FEQHVPVKTZCNMA-BFUOFWGJSA-N	440.338	1.357	50	20	IDGD	
O=C([C@H](F)Br)N1CC2(CCCN2C(=O)c2ncn(-c3cccc(F)c3)n2)C1	1842169481	BHLGULYPTRFUPL-ZDUSSCGKSA-N	440.248	1.914	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1ccc(C=O)s1)C2	1843415694	BGDMREZSXMJCCU-LPYMAVHISA-N	427.486	1.512	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2cccc3ncccc23)C1	1843634014	YXXOUOUAFPFYHH-UHFFFAOYSA-N	430.468	1.364	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2cnn3cccc(C)c23)C1	1845706902	HSJCVULHHYQTFO-WGOQTCKBSA-N	447.499	1.594	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](O)CCl)C[C@@H]2C[C@@H]21	1847558215	JESFOQQMYHZWSY-OJFNHCPVSA-N	427.929	1.186	50	20	IDGD	
Cc1ccc(S(=O)(=O)NC2CC2)cc1C(=O)NNC(=S)NCCc1cccs1	11523815	FCANKHKFGFBRHI-UHFFFAOYSA-N	438.600	1.849	50	20	IDGD	
CC(C)(C(=O)NNC(=O)c1ccccn1)S(=O)(=O)c1ccc(Br)cc1	726155694	WTGVVMBWHXGIKV-UHFFFAOYSA-N	426.292	1.858	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc(Br)c(F)cc1F)[C@@H]1COc2ccccc2O1	728502042	YSPDCQMMURVRER-ZDUSSCGKSA-N	449.229	1.877	50	20	IDGD	
CCOc1ccc(/C=C(/C#N)C(=O)NCC(=O)Nc2cccc(S(=O)(=O)NC)c2)cc1	729418018	RPARZULYSOAWFW-WJDWOHSUSA-N	442.497	1.655	50	20	IDGD	
CCN1CCC[C@@H]1CN1C[C@@H](C(=O)NNC(=O)c2cc3c(s2)CC[C@@H](C)C3)CC1=O	729625962	FYYOQIZMEZHOPW-HYVNUMGLSA-N	432.590	1.967	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N[C@H]2CCN(C3CC3)C2)cc1	730773932	MKNXHROHSOJIPY-WPNIOXTASA-N	448.527	1.694	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)c1cccc(S(=O)(=O)NC[C@H]2CCCO2)c1	731366510	WHSIIUANBXNFCD-MRXNPFEDSA-N	435.477	1.287	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)CCC(=O)N(CCC#N)c2ccccc2)C[C@@H](C)O1	732261509	NBDPIDLPAJAJDK-QZTJIDSGSA-N	429.521	1.360	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N2CC(n3cncn3)C2)cc1	732759051	JBCKFOMJOQUYED-LZYBPNLTSA-N	446.471	1.016	50	20	IDGD	
CC(C)NS(=O)(=O)c1cccc(C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c1	733110833	WQJLDWMQXFCTQK-UHFFFAOYSA-N	427.486	1.634	50	20	IDGD	
CN1C(=O)C[C@H](C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)[C@H]1c1cccc(Cl)c1	734419372	PMJAWJSOIWRMLH-FUHWJXTLSA-N	439.863	1.296	50	20	IDGD	
COc1ccc(CN2CC[C@H](NC(=O)NNC(=O)c3ccc(OC)c(OC)c3)C2=O)cc1	734521112	BWBKSXQEFLSRMS-KRWDZBQOSA-N	442.472	1.458	50	20	IDGD	
CCOCCCN1CC[C@H](NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)[C@@H](C)C1	734544398	RORLUHIPIMBFHS-HKUYNNGSSA-N	447.584	1.160	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NC[C@@H]2CCc3ccccc3C2)cc1	735386732	XVKFGPRTALUHDU-QGZVFWFLSA-N	444.557	1.751	50	20	IDGD	
O=C(COC(=O)c1cccc(Oc2cnccn2)c1)NNC(=O)c1cccc([N+](=O)[O-])c1	736926432	ARVSTKXXDWNWQX-UHFFFAOYSA-N	437.368	1.795	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)[C@@H](C)NC(=O)c1ccc(Br)s1	740851579	MPSSKCVQWGEJCI-MRVPVSSYSA-N	433.328	1.081	50	20	IDGD	
C[C@@H](C(=O)OCC(=O)NNC(=O)c1cccs1)N1CCN(c2ccc(F)cc2)CC1	740981859	FKOZKAVNGFENJL-AWEZNQCLSA-N	434.493	1.402	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)CNC(=O)c1cccs1)[C@@H]1CN(Cc2ccccc2)CCO1	741273157	GGVPNTOCSHQUDU-RDJZCZTQSA-N	445.545	1.098	50	20	IDGD	
CN(C)C(=O)CS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cccc3ncccc23)cc1	742070405	SOKWJPRAVLMUBW-UHFFFAOYSA-N	440.481	1.172	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)[C@H]2SCCc3sccc32)ccc1Cl	742477719	IWFIUIQMFOZGGF-ZDUSSCGKSA-N	431.948	1.841	50	20	IDGD	
C[C@@H]1NC(C(=O)NNC(=O)c2cccc(Br)c2)=NN(c2ccccc2)C1=O	742773139	NZCJJEBGMQFGIZ-NSHDSACASA-N	430.262	1.549	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)CN2CCN(c3ccccn3)CC2)c1	743286474	ZBANYUMMAVBXFO-UHFFFAOYSA-N	425.533	1.862	50	20	IDGD	
COC(=O)c1ccc(N2CCN(CC(=O)NNC(=O)c3cccc(C#N)c3)[C@H](C)C2)cc1	744393337	MFEVRHVETBHUQA-MRXNPFEDSA-N	435.484	1.317	50	20	IDGD	
CC(=O)Nc1cc(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)ccc1F	744621103	OYZHROKABUONBK-UHFFFAOYSA-N	436.465	1.562	50	20	IDGD	
CC(=O)Nc1ccc(CC(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)cc1	744621269	NHXLOOICCCTJQY-UHFFFAOYSA-N	432.502	1.352	50	20	IDGD	
Cc1c(Br)cccc1C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	745521135	QRIXTPKBUVLAKC-INIZCTEOSA-N	449.257	1.902	50	20	IDGD	
C[C@@H]1CN(S(=O)(=O)c2cc(C(=O)NNC(=O)c3ccc[nH]3)ccc2Cl)C[C@@H](C)O1	747663603	NDOXIRDHTNRRSU-VXGBXAGGSA-N	440.909	1.541	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCC[C@@H](C)[C@H]2CNC(=O)OC(C)(C)C)n1	747971090	XVRJKPJILXDAKG-UKRRQHHQSA-N	439.582	1.767	50	20	IDGD	
O=C(NCCC(=O)N1CCN(c2ccccn2)CC1)NNC(=O)c1ccc(Cl)cc1	748466836	NBQBLRHGLWEVLB-UHFFFAOYSA-N	430.896	1.418	50	20	IDGD	
O=C(CCN1C(=O)[C@H]2[C@H](C1=O)[C@H]1CC[C@H]2O1)NNc1ccc(OCC(F)(F)F)cc1	748701706	WYSIIZPRCIJFJR-RRCSTGOVSA-N	427.379	1.623	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)CNS(=O)(=O)c2ccc(Cl)s2)c1C	749838082	OCBUMRUMQQOTNE-GFCCVEGCSA-N	445.950	1.912	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)c1cnc2n1CCCC2	750786226	BXQUQUHXAWJBDL-UHFFFAOYSA-N	430.940	1.452	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNS(=O)(=O)c1ccc(F)cc1Br	751278981	FRTQBEGCFIKUJE-UHFFFAOYSA-N	436.284	1.389	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)c2ccc(F)c(S(=O)(=O)NC)c2)cc1	752399709	UUZOWDNTSRMHIH-GFCCVEGCSA-N	439.465	1.361	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)N[C@H](C)CO[C@@H]2CCOC2)c2ccccc2c1=O	753948799	RMGGGTXHYACPGD-HUUCEWRRSA-N	431.493	1.335	50	20	IDGD	
Cc1cnn(-c2ccc(C(N)=O)cc2NC(=O)C(=O)NNc2ccc(F)c(F)c2F)c1	755349247	PWSXFSKGPLJTEF-UHFFFAOYSA-N	432.362	1.779	50	20	IDGD	
CC1CCN(S(=O)(=O)c2ccc(NC(=O)NNC(=O)Cc3ccncc3)cc2)CC1	755422067	HYZIJAAGNSHTMV-UHFFFAOYSA-N	431.518	1.898	50	20	IDGD	
CN1CCN(C(=O)c2ccccc2NC(=O)NNC(=O)c2ccc(O)c(Cl)c2)CC1	755621818	DUYBJRFXVVFWIJ-UHFFFAOYSA-N	431.880	1.900	50	20	IDGD	
COCC(=O)Nc1ccc(NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1	755642022	UHEDUZLZDHREBV-UHFFFAOYSA-N	427.465	1.131	50	20	IDGD	
Cc1ccnc(NNC(=O)c2cc(O)nc3ccc(S(=O)(=O)N4CCOCC4)cc23)c1	755846404	ZWLYVYXZSMYAFR-UHFFFAOYSA-N	443.485	1.422	50	20	IDGD	
CC(C)(C)S(=O)(=O)N1CCC(NC(=O)NNc2ccccc2S(C)(=O)=O)CC1	755907854	VEOKCQJFDBNHOX-UHFFFAOYSA-N	432.568	1.309	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2cccc(OC)c2O)c(Cl)cc1F	755963709	XSMFCJXITHXIJK-UHFFFAOYSA-N	432.813	1.603	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)Nc1ccc(S(=O)(=O)/N=C2/CCCN2C)cc1	756074348	YBHSGNAPHAKFDW-MOHJPFBDSA-N	445.501	1.975	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c(C)c1	756319054	DHNXDMOIKIMAII-UHFFFAOYSA-N	448.501	1.491	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)NNC(=O)c2nn(CC)c(=O)c3ccccc23)cn1C	757594138	PHCNNNLKBJMLOV-UHFFFAOYSA-N	426.433	1.398	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)Nc1cc(Br)ccc1N1CCCC1	757709245	BKJPWAYRIQVTCJ-NSHDSACASA-N	445.339	1.637	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)Nc1ccc(CCS(C)(=O)=O)cc1	757749705	XAWYJKPNBUKVGS-UHFFFAOYSA-N	435.502	1.904	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2cc(C)n(CCC#N)n2)c1	757830594	JPQBTGAKPVMUGD-UHFFFAOYSA-N	447.521	1.602	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)N[C@H]1CN(C(=O)OC(C)(C)C)C[C@H]1C#N	758773984	SZXVBIJDEWKIPD-CABCVRRESA-N	447.492	1.554	50	20	IDGD	
COc1ccc(CC(=O)NNc2cc(C)ccc2F)cc1S(=O)(=O)N1CCOCC1	760141239	JRAFHRXBXBEUGG-UHFFFAOYSA-N	437.493	1.849	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H]2CC[C@H]3SCCS[C@H]23)c1	763061450	GCZIKLKWQQFHNC-RBSFLKMASA-N	444.604	1.261	50	20	IDGD	
O=C(Cn1nnc(-c2ccc(Cl)cc2)n1)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	763174600	VJAWRVJUTKJGCQ-UHFFFAOYSA-N	440.826	1.984	50	20	IDGD	
C[C@H]1CN(c2ccccc2NC(=O)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)C[C@H](C)O1	763471835	MTVFVGBGLIESOM-KBPBESRZSA-N	441.444	1.608	50	20	IDGD	
CN(C)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2Br)cc1	763483620	SZZMMGBNGZVWQU-UHFFFAOYSA-N	433.262	1.551	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)COc1ccccc1Br	763579412	LONYQIAAAQIIGF-UHFFFAOYSA-N	431.287	1.683	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cccc(-n3cnnn3)c2)c(C)n1-c1ccccc1	763602107	OCCWCWJERNDAIY-UHFFFAOYSA-N	444.455	1.470	50	20	IDGD	
CCOC(=O)N(C)c1ccc(NC(=O)C(=O)NNC(=O)COc2cccc(C)c2)cc1	763622684	FGRLRUANAWFSFH-UHFFFAOYSA-N	428.445	1.753	50	20	IDGD	
COC(=O)c1ccc(OC)cc1NC(=O)C(=O)NNC(=O)COc1cc(C)ccc1C	763668308	KXHMBWHDSSASLP-UHFFFAOYSA-N	429.429	1.264	50	20	IDGD	
O=C(CC12CC3CC(CC(C3)C1)C2)NNC(=O)C(=O)Nc1ccc2c(c1)OCC(=O)N2	763735991	QJMQRRUSQFYTLX-UHFFFAOYSA-N	426.473	1.710	50	20	IDGD	
CCSc1cccc(NC(=O)C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c1	763790792	ORQLSDBBARAOFT-UHFFFAOYSA-N	425.470	1.445	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)OCCCO3)cc1	763861846	RBLMSRKZFBFWKU-AWEZNQCLSA-N	443.456	1.800	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccc(OCCN(C)C)cc1	763871522	HGESMCGDIHCUCD-CQSZACIVSA-N	432.452	1.320	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(C(C)=O)cc2)cc1[N+](=O)[O-]	763879600	ZMPLYPLRTBXRAH-GFCCVEGCSA-N	444.400	1.359	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccc(N(C)Cc3ccccc3)cc2)n1	763885328	JOGMYRXRRGMHOH-UHFFFAOYSA-N	434.500	1.922	50	20	IDGD	
COC(=O)c1cc(F)c(F)cc1NC(=O)C(=O)NNC(=O)Cc1ccc(Cl)cc1	763933076	WRAHGVFRAQDIGH-UHFFFAOYSA-N	425.775	1.733	50	20	IDGD	
Cc1ccc(C(=O)NCC(F)(F)F)cc1NC(=O)C(=O)NNC(=O)c1cccn1C	763999196	RAPINWSCTNBMJS-UHFFFAOYSA-N	425.367	1.025	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)nc1)C(=O)Nc1cccn(Cc2ccc(F)cc2)c1=O	764101375	QHHICPVLOYJVSA-UHFFFAOYSA-N	443.822	1.484	50	20	IDGD	
CCOC(=O)N(C)c1ccc(NC(=O)C(=O)NNC(=O)c2cccc(OC)c2O)cc1	764132705	PQCZUGZSAOWQIL-UHFFFAOYSA-N	430.417	1.393	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(N3CCc4sccc4C3)nc2)cc1	764182735	RMWPQVZVSLUGIS-UHFFFAOYSA-N	446.492	1.977	50	20	IDGD	
CC(C)CCC(=O)NNC(=O)C(=O)Nc1cnc2c(c1)CN(C(=O)OC(C)(C)C)CC2	764203685	WCWVKQADPCDYTP-UHFFFAOYSA-N	433.509	1.897	50	20	IDGD	
CN1CCN(C(=O)c2ccccc2NC(=O)C(=O)NNC(=O)CCC2CCCCC2)CC1	764211871	LZHXZKRJOBFYRX-UHFFFAOYSA-N	443.548	1.521	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)C(=O)Nc1cccn(Cc2ccccc2)c1=O	764245304	POFMUAVJEBEDFX-UHFFFAOYSA-N	443.463	1.637	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)C(=O)Nc1ccccc1OCC1CC1	764259990	MHZYXGWYCJLITN-UHFFFAOYSA-N	438.488	1.268	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cnn(C)c2)n(-c2cccc(Br)c2)n1	764359317	PASKPBIEDSOJCZ-UHFFFAOYSA-N	446.265	1.076	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3c(ccn3CCN3CCOCC3)c2)o1	764370344	BJRWWMLJLJFHIB-UHFFFAOYSA-N	439.472	1.275	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1ccc2c(c1)C[C@H](OC)C2	764396743	BJGWAZRKFMSDKS-MRXNPFEDSA-N	429.498	1.687	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1ccnn1Cc1ccccn1	764396984	DIVKSRFYTJKINQ-UHFFFAOYSA-N	440.485	1.213	50	20	IDGD	
O=C(NNC(=O)[C@H]1COCCO1)C(=O)Nc1cc(Cl)ccc1SCC(F)(F)F	764430091	SNMFOYULIMBPOH-SNVBAGLBSA-N	441.815	1.496	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)N1CC[C@H]2[C@H](CCCN2Cc2ccccc2)C1	765731865	DDUNXDFOYSZQPG-MOPGFXCFSA-N	439.516	1.737	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@H](C)c3c(C)nn(C)c3C)CC2)cc1	766648302	JGVGYUWQEQWSIQ-QGZVFWFLSA-N	426.565	1.414	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)C3(NC(N)=O)CC3)c2)c(C)c1	767187112	IVHHFPUUGLADSP-UHFFFAOYSA-N	445.501	1.066	50	20	IDGD	
COC[C@@H](C)NC(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2OC)c1	770324481	KYEVXKRRJFZEFU-CYBMUJFWSA-N	436.490	1.475	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)N[C@H](C)[C@H]2CN(C)CCO2)c2ccccc2c1=O	770435346	OELVKZUVMGVJFC-CRAIPNDOSA-N	444.536	1.250	50	20	IDGD	
C[C@@H](C(=O)NNc1nc(O)c2cnn(C(C)(C)C)c2n1)c1ccc(S(C)(=O)=O)cc1	770958984	UZSSWIVNGDOLFO-LLVKDONJSA-N	432.506	1.937	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)CCCNC(=O)c2cccnc2)c2ccccc2c1=O	772013881	HMTCASDPUKAFHJ-UHFFFAOYSA-N	436.472	1.173	50	20	IDGD	
O=C(Cc1csc(-c2cccnc2)n1)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772187829	GLLJOJJGGVJTKO-UHFFFAOYSA-N	429.889	1.865	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccccc1-n1cncn1	774008658	KOYGMCSPKGEBED-LBPRGKRZSA-N	428.836	1.474	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)N[C@H](C)[C@H](OC)c1ccc(Br)cc1	774343147	HLBMWDFGNRHWQZ-JMSVASOKSA-N	432.315	1.907	50	20	IDGD	
COc1cc([C@H](C)NCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc(OC)c1OC	774962042	UBISGNNITMMQBT-LBPRGKRZSA-N	432.433	1.732	50	20	IDGD	
C[C@H](NCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)c1cccc(N2CCCC2=O)c1	775278028	GSMZCRMBFWZFPG-AWEZNQCLSA-N	425.445	1.833	50	20	IDGD	
O=C(COC(=O)[C@H]1CCc2c(Cl)cccc21)NNC(=O)[C@@H]1COc2ccccc2O1	775932104	POUQPVZIQYCZBA-KSSFIOAISA-N	430.844	1.900	50	20	IDGD	
CCO[C@@H]1C[C@@H](NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)[C@H]1Oc1ccccc1	776472920	LPFISYATHUNHSQ-GUDVDZBRSA-N	437.460	1.231	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1C[C@@H](SC)[C@H](N2CCCC2)C1	776487134	VYUHDLOMBIJFCS-NVXWUHKLSA-N	426.970	1.621	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2cc(C)nc(C(F)(F)F)n2)c2ccccc2c1=O	777414099	RITOBVAJMTYNAC-UHFFFAOYSA-N	434.378	1.999	50	20	IDGD	
O=C(c1ccc(N2CCCCCC2)nc1)N1CCN(S(=O)(=O)CBr)CC1	777833540	WUAXKIIJUNOPDS-UHFFFAOYSA-N	445.383	1.902	50	20	IDGD	
Cc1c(C(=O)N2CCN(S(=O)(=O)CBr)CC2)cnn1-c1ccccc1	777835693	CEUHKLMRLRTWAW-UHFFFAOYSA-N	427.324	1.621	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)[C@@H]2CCCN(S(=O)(=O)c3ccccc3)C2)nc1C	778427766	FSQGQZFTWSNMEK-OAHLLOKOSA-N	447.517	1.506	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)[C@H](O)[C@H](O)c1nc2ccccc2s1	779491536	QLKOGMHUPHCYDH-MOPGFXCFSA-N	439.497	1.450	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)nn1-c1cccc(C#N)c1	779920492	KPHIRTXNJKQHCP-UHFFFAOYSA-N	438.469	1.922	50	20	IDGD	
O=C(NNC(=O)c1ccc(-c2ccccc2OC(F)(F)F)o1)N[C@@H]1CCS(=O)(=O)C1	780460741	WCZYLZKMFCUTMI-SNVBAGLBSA-N	447.391	1.976	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)[C@@H]2C[C@@]23CCN(C(=O)OC(C)(C)C)C3)c1	781288686	XFDOULZPDHRJJL-KSFYIVLOSA-N	431.489	1.946	50	20	IDGD	
CC(=O)Nc1ccc(C(C)=NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1	781571400	JUIZKNQXAIIGFW-UHFFFAOYSA-N	444.513	1.820	50	20	IDGD	
CC(=O)N1CCN(c2cccc(NC(=O)NNC(=O)COc3cccc(C)c3)c2)CC1	782084253	YFMCPEBLQVVMOA-UHFFFAOYSA-N	425.489	1.895	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cc3[nH]ccc3cc2C)cc(OC)c1OC	782120888	HRTNUBSXHOUSRT-UHFFFAOYSA-N	426.429	1.902	50	20	IDGD	
O=C(NNc1ncc(C(F)(F)F)cc1Cl)C(=O)Nc1ccc(-n2cncn2)nc1	782852883	LWRYSNUMIIDEBA-UHFFFAOYSA-N	426.746	1.811	50	20	IDGD	
CSCCc1ccc(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)cc1	782894138	MLNWDQYHJDMCBD-UHFFFAOYSA-N	425.514	1.807	50	20	IDGD	
Cc1noc(-c2ccccc2)c1NC(=O)C(=O)NNC(=O)CNC(=O)c1cccs1	784004602	HSNVNZWXPZYEGK-UHFFFAOYSA-N	427.442	1.227	50	20	IDGD	
COC(=O)[C@@H](C)Cc1ccc(NC(=O)C(=O)NNc2ccc(C(F)(F)F)nn2)cc1	784885843	DKKGIDMQQWIBRG-JTQLQIEISA-N	425.367	1.929	50	20	IDGD	
COc1c(Cl)cc(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)cc1Cl	785068147	UUHMRBBLBLWNNF-UHFFFAOYSA-N	436.255	1.978	50	20	IDGD	
CNC(=O)c1cccc(NC(=O)C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)c1C	785100130	QTWMCTKRNQGZAN-UHFFFAOYSA-N	445.426	1.607	50	20	IDGD	
COC(=O)c1ccc(S(=O)(=O)NNC(=O)c2ccc(Br)s2)c(OC)c1	785482762	YCOYQJYHLORMES-UHFFFAOYSA-N	449.304	1.929	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)C(=O)Nc1cccc(C(F)(F)F)n1	786414384	NANZEPGNQJEQGX-UHFFFAOYSA-N	427.295	1.174	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)nc2)cc1C(=O)N(C)C(C)C	787544234	PRTFUQOKBPGBCO-UHFFFAOYSA-N	431.880	1.924	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)[C@@H]1CC(=O)N(c2cccc(Br)c2)C1	788176947	CMVZKLXDKARHOB-GFCCVEGCSA-N	442.277	1.921	50	20	IDGD	
C[C@H](C=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O)c1ccc(C(F)(F)F)cc1	788974942	JAAJLNWIGOGDQB-SNVBAGLBSA-N	429.424	1.496	50	20	IDGD	
CCNC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)c1C	789741457	VCFDGODWMWJMPL-CYBMUJFWSA-N	445.451	1.829	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccc2c1OCC[C@H]2OC	790951567	JDNUQZIYQMAHFR-OAHLLOKOSA-N	429.429	1.330	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cc(OC)cc(-n3cccn3)c2)cc1	792355932	XKWPVEPOMYGIJJ-UHFFFAOYSA-N	439.428	1.054	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)Cc2ccccc2S(C)(=O)=O)cc1C	792572586	VCQYGROSGUQMER-UHFFFAOYSA-N	438.527	1.569	50	20	IDGD	
Cc1nc(O)c(Br)cc1C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C	796485311	WXGWEYNAJHAFNK-UHFFFAOYSA-N	432.275	1.327	50	20	IDGD	
Cn1cc2c(n1)CCC[C@@H]2C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	798822925	CIERZARTTZDDKS-KRWDZBQOSA-N	445.545	1.476	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@@H]2C(=O)NNC(=O)COc2ccccc2OC)cc1	798826590	XSPDIPKQEJGJKB-QGZVFWFLSA-N	427.457	1.535	50	20	IDGD	
CCOC(=O)Oc1ccc(C(=O)N2CCN(S(=O)(=O)CBr)CC2)cc1	800530324	JRTWEBSTXHNGGV-UHFFFAOYSA-N	435.296	1.662	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)COC2CCN(C(=O)OC(C)(C)C)CC2)cc1	801109791	CCKLIUPCJYEDPI-UHFFFAOYSA-N	434.493	1.497	50	20	IDGD	
O=C(Cn1c(=O)ccn(Cc2ccccc2)c1=O)NNC(=O)Nc1cc(F)cc(F)c1	802005358	FDYPQSMGXWBVPJ-UHFFFAOYSA-N	429.383	1.189	50	20	IDGD	
O=C(CNS(=O)(=O)c1c[nH]c2ncccc12)NNC(=O)NCc1ccc(Cl)cc1	803161815	LYYAVUNMQWWFLN-UHFFFAOYSA-N	436.881	1.025	50	20	IDGD	
O=C(Cn1[nH]cc2c(=O)ncnc1-2)NNc1ccc(-c2cccc(C(F)(F)F)c2)nn1	804207357	HGFOOOVWFMBWME-UHFFFAOYSA-N	430.350	1.690	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N2C[C@@H](N3CCOCC3)C[C@H]2C)cc1Br	805104230	NRULXXGMPIDTRX-OCCSQVGLSA-N	441.326	1.607	50	20	IDGD	
CCOc1cc(N2CCN(C)CC2)ccc1NC(=O)NNc1ccc(-n2ccnc2)nn1	806318807	ZDXPUDUNUXLBMF-UHFFFAOYSA-N	437.508	1.961	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)C(=O)Nc1ccc(F)c(N2CCCNC2=O)c1	806980281	SBMQECXTDRWCEJ-UHFFFAOYSA-N	431.399	1.213	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1cccc(F)c1Cn1cccc(C)c1=O	806981526	WTMBJDBTMPNDEE-UHFFFAOYSA-N	426.408	1.225	50	20	IDGD	
Cn1ncc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)c1-c1ccccc1	807068579	LVHQZDKGMPYEIE-PXNSSMCTSA-N	433.468	1.746	50	20	IDGD	
Cc1nn(-c2ccccc2)c2sc(C(=O)NNC(=O)NCCn3cnc(C#N)n3)cc12	807512078	KEJWNETVJQNFMJ-UHFFFAOYSA-N	435.473	1.503	50	20	IDGD	
CCO[C@H]1CC(=NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)[C@H]1SC	807944290	WDQZLCCGFZNHJD-DLBZAZTESA-N	427.548	1.334	50	20	IDGD	
N#Cc1ccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1F	810255247	YBHGVWTZZKJWBI-UHFFFAOYSA-N	431.449	1.948	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)C3(c4ccccc4)CC(=O)C3)cc2)CC1	810341036	BTRINWLGVKEZHY-UHFFFAOYSA-N	442.541	1.367	50	20	IDGD	
CC(=NNC(=O)COc1ccc(Br)cc1)c1ccc2[nH]c(=O)c(=O)[nH]c2c1	811631939	TWRJRSYLEHBJSX-UHFFFAOYSA-N	431.246	1.898	50	20	IDGD	
COC(=O)Cc1cc(Br)ccc1S(=O)(=O)NNC(=O)c1ccccc1	811673850	AHWYKLLBIJKRBB-UHFFFAOYSA-N	427.276	1.788	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(N(C(C)=O)C3CC3)cc2)cc1OC	815564174	ZXVWOIRBDQJAEB-UHFFFAOYSA-N	440.456	1.619	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)c2cccc(N(C)C)c2)cc1)[C@@H]1C[C@H]1C	815565361	LROIWXDFRRZFIT-JLTOFOAXSA-N	437.500	1.914	50	20	IDGD	
Cc1nn(C)c2cc(NC(=O)C(=O)NNc3ccccc3S(=O)(=O)N(C)C)ccc12	815752602	ZAGHLHHMBOCPCW-UHFFFAOYSA-N	430.490	1.214	50	20	IDGD	
Cn1cc(NS(=O)(=O)c2ccsc2C(=O)NNc2nc3ccccc3n2C)cn1	816579554	UQVWFJGRZKJXCZ-UHFFFAOYSA-N	431.503	1.926	50	20	IDGD	
O=C(NNC(=O)c1cc2ccccc2[nH]1)c1cccc(S(=O)(=O)N2CCOCC2)c1	912638480	RALHFYVBICHRHX-UHFFFAOYSA-N	428.470	1.264	50	20	IDGD	
O=C(COC(=O)COc1ccc(F)c(Cl)c1)NNC(=O)c1cccc([N+](=O)[O-])c1	912692161	UMVLFPGKMISZFW-UHFFFAOYSA-N	425.756	1.771	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)c1ccc(OCC(F)(F)F)cc1	914749207	HFWXBLPBUAXDTH-UHFFFAOYSA-N	430.408	1.996	50	20	IDGD	
CCOC(=O)c1ccc(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)nc1C	914837440	BKXSNRJBVOFUFW-UHFFFAOYSA-N	439.516	1.540	50	20	IDGD	
CC(C)C(=O)Nc1ccc(C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1	914929181	CAELHSBXYPLLJR-UHFFFAOYSA-N	428.401	1.807	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)NC[C@@H]2CN(Cc3ccccc3)CCO2)nc2ccccc21	915895265	ZBFLPXNXXLZRRG-GOSISDBHSA-N	436.516	1.347	50	20	IDGD	
NC(=O)c1cccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1	915906325	APRRCYSUSFXKRQ-UHFFFAOYSA-N	431.474	1.037	50	20	IDGD	
Cc1nn(-c2ccccc2)c(C)c1CNC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	915930713	GXSWOBUATJWXKL-UHFFFAOYSA-N	445.483	1.880	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2cccc(C)c2)c1	916107732	DEWJQDVDCOVHBH-UHFFFAOYSA-N	425.532	1.649	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)NCCC(=O)NC(C)C)c2ccccc2c1=O	916268456	JVQHWETYBJQBOE-UHFFFAOYSA-N	430.509	1.445	50	20	IDGD	
CC(=NNC(=O)[C@H](C)Oc1ccc(F)cc1)c1ccc(S(=O)(=O)NCC(=O)O)cc1	916340705	ZHXTZBQJRHWFKL-ZDUSSCGKSA-N	437.449	1.496	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(/C#N)C(=O)N2CCN(C(=O)C(=O)NC3CC3)CC2)c1C	916409706	GCVUKYIBMNWPRO-JJBLJPBOSA-N	441.532	1.169	50	20	IDGD	
CCCNC(=O)CN1CCC(NC(=O)NNC(=O)c2ccc(OCC)c(OC)c2)CC1	916518966	RXTNJTCKLKUNCM-UHFFFAOYSA-N	435.525	1.029	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)C(C)(C)C)CC2)cc1	917180322	RTTQEBMJHDXWEJ-UHFFFAOYSA-N	439.534	1.458	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCCc2cccc(OC)c2OC)c2ccccc2c1=O	918217879	NTCFBIRIACUHQJ-UHFFFAOYSA-N	439.472	1.620	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)NNC(=O)c3ccc4c(c3)OCCO4)cc2C1	918779082	ACZZOCIEPCQBMD-NSHDSACASA-N	430.486	1.933	50	20	IDGD	
CSCC[C@@H](NC(=O)c1ccc([N+](=O)[O-])o1)C(=O)NNC(=O)NC1CCCCC1	919835553	UOYNTROWKITKFP-GFCCVEGCSA-N	427.483	1.702	50	20	IDGD	
COc1ccc(OCCCNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1	919922535	QQQYPAMUFDBXIX-UHFFFAOYSA-N	435.506	1.401	50	20	IDGD	
CCc1ccccc1OCC(=O)NNS(=O)(=O)c1ccc(F)c(S(C)(=O)=O)c1	920308995	MIANALQJARYMEA-UHFFFAOYSA-N	430.479	1.180	50	20	IDGD	
Cn1cc(C=NNC(=O)N[C@H]2CCS(=O)(=O)C2)c(-c2ccc3c(c2)OCCCO3)n1	920383247	CMBXLPJQDASENC-HNNXBMFYSA-N	433.490	1.069	50	20	IDGD	
CCOC(=O)NCC(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccc(C)cc2C)c1	920431647	KCKUIJFNUGKZDZ-UHFFFAOYSA-N	448.501	1.611	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)c1cn(-c2ccccc2)nc1-c1ccccc1)N1C(=O)CCC1=O	1115967024	DZWBLAKCXLPFKZ-HNNXBMFYSA-N	431.452	1.838	50	20	IDGD	
O=C(CN1CCC(CN2C(=O)c3ccccc3C2=O)CC1)NNC(=O)c1cccs1	1319583064	GFTQWOPCOLKGTM-UHFFFAOYSA-N	426.498	1.517	50	20	IDGD	
Cn1cc([C@H](NC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)c2ccccc2)cn1	1320205810	UACLKWVVNWYADV-GOSISDBHSA-N	442.501	1.949	50	20	IDGD	
C[C@H](O)CNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2ccc(C(C)(C)C)cc2)cc1	1353486823	RYCMRATVKAAJSH-AWEZNQCLSA-N	433.530	1.718	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2)C1=NO[C@@H](c2ccccc2)C1	1778788033	VKVWNVHKIPGLQU-JPAWQOSXSA-N	449.935	1.618	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1C	1779032125	ACGXTIXESUHNHQ-HSZRJFAPSA-N	437.500	1.059	50	20	IDGD	
COc1ccc([C@H](O)C(=O)N2CCO[C@@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)cc1	1779294862	QLEROKVHFDBUFY-PZJWPPBQSA-N	436.581	1.410	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(OC)c(O)cc3[N+](=O)[O-])C2)C1	1780198973	WPUPKQGTGXUVGJ-YJYMSZOUSA-N	441.868	1.770	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(C)nc3O)C2)C1	1780276502	XOUSTKFDQOFOBT-RDTXWAMCSA-N	426.311	1.713	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc3nonc3c1)C2	1782172934	QZFPIRXFLCFLPI-JNAXZKDPSA-N	436.896	1.604	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(N(C)C)nc1)C2	1782173440	BABMMESZLGWEAR-CSODHUTKSA-N	438.956	1.529	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4nn[nH]c4c3)C2)C1	1782581499	PWVUYQQLMYPOTN-XIKOKIGWSA-N	436.310	1.432	50	20	IDGD	
COCC(=O)N1CCO[C@@]2(CCN(C(=O)/C(C#N)=C/c3ccc(Br)cc3)C2)C1	1782869513	DJQZZQCAFXKHNA-QGRTWZNFSA-N	448.317	1.832	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(CC(C)C)nn3C)CCO2)C1	1783874296	CNGACLBPHODHAF-JXFKEZNVSA-N	426.945	1.316	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(OC)c(OC)c3)CCO2)C1	1783882795	RWIPXOULLFCOGD-MGPUTAFESA-N	426.897	1.401	50	20	IDGD	
Cc1ncc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]3C2)cn1	1783970208	TUMUDGIJWIWHME-MZGVZZPPSA-N	425.327	1.409	50	20	IDGD	
CCCNC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21	1784374658	GDIUZANLYPQIIZ-KKUMJFAQSA-N	432.359	1.058	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(O)nc(Cl)c3)[C@H]2C1	1785694063	DREYZLRORPYZMF-URBCHYCLSA-N	446.729	1.817	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3cncnc3)[C@H]2C1	1787041247	LDAWTBPBSGHMOY-HJWJTTGWSA-N	439.354	1.420	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3c(F)cncc3F)C[C@@H]21)[C@H](F)Br	1789924614	PFGYYQDKMJZIIR-COPCRZHJSA-N	436.228	1.644	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21	1790611711	MCNPARGJWMPPFC-MOLYVOAJSA-N	439.278	1.218	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(F)cn3)C[C@@H]21	1790961564	PRQQXSGRTCWUHM-PCBIJLKTSA-N	428.302	1.988	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CNc3ccccc31)C2	1792868316	WBZAUZMBLZSHQU-BEHLRCOKSA-N	436.350	1.816	50	20	IDGD	
Cc1ccc(C)n1-c1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](O)CCl)cc1	1792980778	VXJQUXKJRBWYFT-KOUHRCEDSA-N	445.947	1.897	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3cccnc3nc1O)C2	1793453278	DVNHPAUQMXTNOM-YALNPMBYSA-N	432.908	1.946	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnncc1C(=O)O	1798780877	SUDIPZJCEZNTRT-FBKDDSFISA-N	425.283	1.600	50	20	IDGD	
COc1cccc(OC)c1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Br)C2	1798828127	YQUBMEMRLRVREQ-KOFHJDLBSA-N	441.322	1.690	50	20	IDGD	
C#CCO[C@H](C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O	1799219484	MEBCLOYDHUZOFZ-MXASKKJJSA-N	443.456	1.810	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nc3ccc(F)cn3n1)C2	1799279344	JQNCIZGCUWKNKC-WZTYKQCMSA-N	444.294	1.308	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(OC(F)F)cc1	1799588974	HYBNZMHFLZWEPQ-OCVGTWLNSA-N	432.851	1.745	50	20	IDGD	
C[C@@H](Cc1ccncc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2	1800192813	FBITWZAVPOTKFE-HVQZGBDUSA-N	428.302	1.540	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(C)n(CC)n1)C2	1800642108	XHMHWVIIEXGYOY-FQLMCAECSA-N	427.343	1.588	50	20	IDGD	
COc1cccc(/C=C/C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Br)C3)c1	1800685290	BPLNHJLZRIXVCT-IUGBXOKJSA-N	441.297	1.989	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1c(F)cccc1Cl)C2	1800971373	WRIGSWWPXONSLJ-TYYYEBLRSA-N	433.307	1.865	50	20	IDGD	
COC(=O)CCCCCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@](C)(Cl)CCl)C2	1801075204	KFRZXURQUPNQGL-CSHUHZATSA-N	437.364	1.936	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CCCOC1	1802074649	AGNPPXNMAZFYHU-LEDJYJADSA-N	445.466	1.888	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc(C(=O)N(C)C)c1)C2	1802344342	XECRIWNVNLPCFA-REPLKXPHSA-N	443.548	1.013	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)N2CCC3(CCCN(C(=O)[C@H](O)CCl)C3)CC2)c1	1805515188	MUXDQHJCLWCZFX-QGZVFWFLSA-N	442.965	1.535	50	20	IDGD	
O=C(c1ncn(-c2ccccc2)n1)N1CCC2(CCCN(C(=O)[C@@H](O)CCl)C2)CC1	1805523818	WEXXEGHSAUIADI-KRWDZBQOSA-N	431.924	1.712	50	20	IDGD	
O=C(Cc1ccccc1)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1806512648	OTEJSLRONBJNEB-QPPBQGQZSA-N	443.312	1.324	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2nccnc2C(N)=O)[C@@H]1c1cccnc1	1811182443	NXHCKOIZJSLDJX-VKJFTORMSA-N	444.923	1.698	50	20	IDGD	
Cc1cccn2ncc(C(=O)NC[C@@H]3CCN(C(=O)[C@H](O)CCl)[C@H]3c3cccnc3)c12	1812268220	XKKUFHNNJDUEOL-HQRMLTQVSA-N	441.919	1.957	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)C2CC(C)(C)C2)[C@H]1c1cccnc1	1813074387	QLMDCYUDZSQSQJ-UTKZUKDTSA-N	429.565	1.897	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@H](C(=O)N2CCCC[C@@H]2c2cc(NC(=O)[C@H](O)CCl)n[nH]2)C1	1814877844	LZNWYPUISOIRKY-SJXGUFTOSA-N	440.928	1.981	50	20	IDGD	
O=C(Cc1ccc2c(c1)OCO2)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1	1816997755	IEIWZWRBRIALKR-CABCVRRESA-N	434.880	1.973	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnncc2C(=O)O)n[nH]1	1819763179	GRQDRJFSKAINDE-OCCSQVGLSA-N	436.856	1.458	50	20	IDGD	
C[C@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@](C)(Cl)CCl)[nH]n1)n1cnnn1	1822860495	GZGJLAVMJJZSNA-RSAASHCRSA-N	429.312	1.886	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCc1nc(N)n[nH]1)CC2	1822867593	JTAHXTGDDQFTKL-VPTHRUTESA-N	446.364	1.625	50	20	IDGD	
Cc1nc(CC(=O)N[C@@H]2CCc3nc(NC(=O)[C@H](F)Br)sc3C2)no1	1823001328	CRXOOGAHBSIFLO-KRTXAFLBSA-N	432.275	1.680	50	20	IDGD	
CC(C)=NO[C@@H](C)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCC(=O)NN(C)C)CC2	1823088407	BVSPAEICWQAJRI-QWHCGFSZSA-N	438.554	1.229	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](O)NC(=O)OC(C)(C)C)sc2C1	1823572405	XSVMKXHFXLZPTF-HFBDOXOYSA-N	446.957	1.916	50	20	IDGD	
O=C(NCC(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H](O)CCl)CC1)c1cccnc1	1824179564	UISXVKPJAGQEDO-MSOLQXFVSA-N	436.940	1.031	50	20	IDGD	
COC[C@H](C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1	1824606239	YAANCCHELYFPMK-HNAYVOBHSA-N	431.537	1.201	50	20	IDGD	
Cc1cc(CC(=O)N2CCCC[C@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)on1	1825017740	DXRUSBHWCMUFRC-IBGZPJMESA-N	433.553	1.518	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1nc[nH]c1[N+](=O)[O-])CC2	1825641092	MTBUHGINSLZEKH-RQJHMYQMSA-N	443.283	1.784	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)on1	1825964120	DZHRAILSZMPHFD-IBGZPJMESA-N	425.294	1.210	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCc1cnn(C)c1)CC2	1825999925	YBNXDKXDTODGOD-CHWSQXEVSA-N	425.942	1.675	50	20	IDGD	
Cc1cc(/C=C/C(=O)N[C@@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)no1	1826087422	BETIYZXBWLJCAG-VUDGCMKMSA-N	446.533	1.438	50	20	IDGD	
CC[C@H](C)[C@@H](O)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1	1828923693	UOERVOQHSCUHDS-CWFSZBLJSA-N	445.564	1.325	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccnc(F)c3)C2)C1	1830534586	CDFQIXFQLPXWEV-ACJLOTCBSA-N	444.301	1.322	50	20	IDGD	
CC(C)(C)c1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)s1	1830727835	HQVAJDHUQUCNRF-VBKZILBWSA-N	444.981	1.715	50	20	IDGD	
Cc1cccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@](C)(Cl)CCl)C3)C2)n1	1830921203	LQOPGJSEWJEBKF-UXHICEINSA-N	444.359	1.625	50	20	IDGD	
C[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1)n1ccnc1	1830981378	AFCMXILOQJQDGA-OLMNPRSZSA-N	433.336	1.137	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCCn3ccnc3C)C2)C1	1831657219	MVEHIWORXZENOI-RXVVDRJESA-N	440.972	1.836	50	20	IDGD	
Cc1ccc(CC(=O)N2CCC([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)cn1	1831871475	GCPDNPFUDBIQBU-OAQYLSRUSA-N	443.592	1.925	50	20	IDGD	
Cc1n[nH]c(C)c1C(=O)N1CCC([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1	1831873408	JEESBTLABFNUIX-SFHVURJKSA-N	432.569	1.633	50	20	IDGD	
Cc1noc(C)c1CC(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1832552138	XXOYMMBRQZWAQA-HXUWFJFHSA-N	427.929	1.555	50	20	IDGD	
COc1cccnc1CCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1832864233	KEPXHZFKJKSDCS-HKUYNNGSSA-N	429.876	1.014	50	20	IDGD	
Cn1ccc2cccc(C(=O)N3CCC(N4CCC(NC(=O)[C@@H](O)CCl)CC4)CC3)c21	1833310035	GNIGIQAZWJTXMX-FQEVSTJZSA-N	446.979	1.963	50	20	IDGD	
O=C(c1ccc(OC(F)F)cn1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1833638887	HUUJFTYULGBTQX-CXAGYDPISA-N	437.802	1.287	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC(OC2CCN(C(=O)C3CCCCC3)CC2)CC1	1837619327	BTIZFDQUXFLMFU-UHFFFAOYSA-N	442.365	1.559	50	20	IDGD	
CCOC(=O)/C=C/C(=O)N1CCC(OC2CCN(C(=O)CCBr)CC2)CC1	1837638008	ONMMFOIWTBRRKS-ONEGZZNKSA-N	445.354	1.889	50	20	IDGD	
Cc1ccccc1NCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)CO[Si](C)(C)C)CCO2	1837711788	QGJLPLPVURZNOS-JOCHJYFZSA-N	449.624	1.715	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cn4cc(F)ccc4n3)C2)C1	1839146250	WWTPSVCVNPEXAO-QRWLVFNGSA-N	438.887	1.561	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cccs3)C2)C1	1839152401	YCYNAWUGNATEAD-ZWKOTPCHSA-N	435.373	1.983	50	20	IDGD	
CC(C)n1cnc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)n1	1839152585	DYIWDOXYGIIINK-ZWKOTPCHSA-N	448.351	1.165	50	20	IDGD	
C=C(C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2)C(F)(F)F	1839203103	ZWRJUZWOYCMXFP-GWCFXTLKSA-N	433.196	1.252	50	20	IDGD	
C[C@H](C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H](F)Br)CCO2)C1)c1ccccc1	1839203667	RMPBJUNCWSBRRO-GMBSWORKSA-N	443.313	1.937	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc4cccnc4nc3O)CCO2)C1	1839514144	XMVVUSIFIVRQKR-KKSFZXQISA-N	448.907	1.423	50	20	IDGD	
CCc1ccnc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)c1	1840031732	APFHRIKLGOPVGS-LIRRHRJNSA-N	440.338	1.497	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cc(F)cc(F)c3)C2)C1	1840152133	XYWURGVGKXFCBD-XLIONFOSSA-N	446.878	1.218	50	20	IDGD	
C[C@H](Cc1ccccn1)C(=O)N1CCO[C@@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1	1840334373	SRQCMTYBLPMOGD-XMSQKQJNSA-N	449.624	1.568	50	20	IDGD	
CC(C)C1(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)CCC1	1840613393	XMIGFPQWIZMMCS-PBHICJAKSA-N	435.334	1.960	50	20	IDGD	
Cc1cc(F)ccc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)Br)C2)C1	1840778649	FMZJUPMMJUUIGP-KUHUBIRLSA-N	443.313	1.988	50	20	IDGD	
N#Cc1ccccc1OCC(=O)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1840820422	OSEMGTUTWSDCPB-LJQANCHMSA-N	442.299	1.197	50	20	IDGD	
CC[C@H](C)[C@@H](O)C(=O)N1CCCC12CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1841630078	NTPQVGPWKFRJFM-SOUVJXGZSA-N	431.961	1.729	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC2(CCCN2C(=O)C(F)(F)C(F)(F)C(=O)O)C1	1841825960	PQUBRRPNNMMKHV-MRVPVSSYSA-N	433.196	1.576	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2ncc(Cl)cn2)C1	1842325116	HBPIPAHHPVVUHZ-WYMPLXKRSA-N	429.868	1.081	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1ccn(C(F)F)n1)C2	1843416272	QXMHDRHVMQITNG-FSJBWODESA-N	433.419	1.229	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)[C@H](C)n2cncn2)C1	1846600369	VXJLCGYQRVADSM-ZDUSSCGKSA-N	442.432	1.190	50	20	IDGD	
CC(C)(C)OC(=O)N1CC2(CC[C@H](C(=O)N3CC[C@H]4[C@@H]3CCN4C(=O)[C@@H](F)Cl)O2)C1	1847286797	IFLGDTMKIAETDA-BYNSBNAKSA-N	445.919	1.891	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(Br)cc2)C1)C1CC1	14290548	RIDZYNQUPFWQIF-LBPRGKRZSA-N	430.324	1.407	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)c1ccc(N2CCOCC2)nc1	14372631	DOYKKNXPOSEPKL-CYBMUJFWSA-N	449.305	1.909	50	20	IDGD	
CCOc1ccc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)[C@H]3CCCO3)cc2)cc1	15737359	QPMAZBHXOKAKIW-GOSISDBHSA-N	433.486	1.826	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)CN(C)C2=NS(=O)(=O)c3ccccc32)c1C	20919318	FGSGQWUXXISRTP-OAHLLOKOSA-N	444.513	1.299	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2ccc3c(c2)CCN3C(C)=O)c2ccccc2c1=O	32204774	YDNHDZRTJJDBRB-UHFFFAOYSA-N	433.468	1.790	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CCN2C(=O)[C@H]3CCCC[C@H]3C2=O)cc(OC)c1OC	197983269	ZNVWRQACVLSRBA-OKILXGFUSA-N	433.461	1.039	50	20	IDGD	
COc1ccccc1NC(=O)C1CCN(C(=O)NNC(=O)CNC(=O)c2ccco2)CC1	725871426	BSHRILHPYQVHGO-UHFFFAOYSA-N	443.460	1.110	50	20	IDGD	
COc1ccc(CN2C[C@@H](C(=O)NNC(=O)c3nnc(O)c4ccccc34)CC2=O)cc1	726523721	VDXBPOZJNQOKOD-AWEZNQCLSA-N	435.440	1.154	50	20	IDGD	
CCN(CCNC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)C(C)C	726713916	NZCLILIFEBHHCW-UHFFFAOYSA-N	425.555	1.145	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCC(NC(=O)c3cc(C)oc3C)CC2)n1	727437196	NWEKQPIKTRALLD-UHFFFAOYSA-N	433.534	1.246	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNS(=O)(=O)c1cc(Br)ccc1Cl	727671387	YHXZAZYMEDQNOK-UHFFFAOYSA-N	436.671	1.435	50	20	IDGD	
CCc1c(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)[nH]c(C)c1C(C)=O	728216102	QKJNTABHEHJDJW-UHFFFAOYSA-N	447.561	1.781	50	20	IDGD	
CC(=O)NCC(=O)N1CCC[C@H]1C(=O)NNC(=O)c1ccc(-c2ccc(F)cc2)s1	728513434	IZNNSPIKHGYVTE-HNNXBMFYSA-N	432.477	1.442	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NC[C@@H]2CCN(CCc3ccccc3)C2)c2ccccc2c1=O	728754685	QHCJPLLQVQDMBK-SFHVURJKSA-N	448.527	1.442	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)NNC(=O)COc2ccccc2O)cc1OC	730818655	RCIKXFFFDXUYIM-UHFFFAOYSA-N	438.462	1.394	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2cccc(C(=O)NNC(=O)Cc3ccccc3F)c2)C[C@H](C)O1	731329392	KDTNGZIBKDNUSY-GJZGRUSLSA-N	449.504	1.627	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)c1nnn(-c2ccc3c(c2)OCCO3)c1C	731453055	GSMJMNLVEUPKBC-UHFFFAOYSA-N	437.456	1.749	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NCCOC[C@@H]2CCOC2)c2ccccc2c1=O	731762574	FEGRIEPZJONPMQ-OAHLLOKOSA-N	431.493	1.194	50	20	IDGD	
CC[C@H](C)NS(=O)(=O)c1ccc(C(=O)NNC(=O)CCN2C[C@@H](C)O[C@H](C)C2)cc1	732260550	FWOSLUKRANMPRP-ARFHVFGLSA-N	440.566	1.024	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CNC(=O)c2ccc(F)c(F)c2)cc1Br	732305072	GMVUEKNZWCDZDB-UHFFFAOYSA-N	442.216	1.927	50	20	IDGD	
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1ccco1)NNC(=O)c1cccc([N+](=O)[O-])c1	732330453	QXJUWXRQRFTXBM-OAHLLOKOSA-N	444.400	1.187	50	20	IDGD	
Cc1ccc([C@]2(C)NC(=O)N(CC(=O)NNC(=O)c3cnn(-c4ccccc4)c3)C2=O)cc1	733107218	WDHYHQQVDMQZNS-QHCPKHFHSA-N	446.467	1.409	50	20	IDGD	
CN(CC(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1)C(=O)C1CC1	733128935	ZVEMHGIRAYELFN-UHFFFAOYSA-N	433.472	1.018	50	20	IDGD	
C[C@@H](NC(=O)/C(C#N)=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)N(C)C	733163335	JYPHHKONEQJSIR-QQFZQELXSA-N	442.907	1.579	50	20	IDGD	
Cn1c(NNC(=O)c2ccc(S(=O)(=O)CCCC#N)cc2)nc2ccccc2c1=O	733261292	NXGBCZFDEQIFFI-UHFFFAOYSA-N	425.470	1.768	50	20	IDGD	
CC(C)(C)c1ccc([C@@H](O)CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1	734853929	DOFPKYDQDSXOAT-KRWDZBQOSA-N	447.561	1.955	50	20	IDGD	
CC(C)Oc1cccc([C@H](O)CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)c1	735088781	KOOZGOZHRWTYHZ-QGZVFWFLSA-N	449.533	1.445	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1cccc(C(=O)NNC(=O)c2cnn(C)c2)c1)c1ccccc1	735448950	CGCUGBJQDAKDRB-CQSZACIVSA-N	427.486	1.534	50	20	IDGD	
Cc1nc([N+](=O)[O-])cn1CCC(=O)NN=c1cc(C(F)(F)F)[nH]c(-c2ccncc2)n1	736706977	DYPWJWZAVISCHZ-UHFFFAOYSA-N	436.354	1.926	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)CCc2nc(-c3ccoc3)no2)c2ccccc2c1=O	739472458	DEZRMUFNAJPOGK-UHFFFAOYSA-N	436.428	1.843	50	20	IDGD	
CN(C)c1nccc(NNC(=O)c2cc([N+](=O)[O-])ccc2I)n1	740107968	SGTUESKPQUMQOW-UHFFFAOYSA-N	428.190	1.812	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)N[C@@H]2CCC[C@H](S(C)(=O)=O)C2)c2ccccc2c1=O	741092350	CLTYKFJESNWRNP-KGLIPLIRSA-N	449.533	1.277	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NN=Cc2c(N3CCOCC3)nc3ccccn23)cc1	741810119	QCYNDBPHORGDDP-UHFFFAOYSA-N	442.501	1.730	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)CCC(=O)N2CCC(c3ccccc3)=N2)c1	741829744	VQGIJZSPGATEFI-UHFFFAOYSA-N	447.451	1.279	50	20	IDGD	
Cc1cc(Br)c(S(=O)(=O)NNC(=O)[C@H]2COc3ccccc3O2)s1	742025284	LNXBMHBDWAFVPX-GFCCVEGCSA-N	433.305	1.969	50	20	IDGD	
CN(CCNC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)C(=O)OC(C)(C)C	743593565	SWWMIAKJPFSUQM-UHFFFAOYSA-N	429.499	1.293	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)N[C@H]2CCN(Cc3ccccc3)C2=O)nc1	744877927	LERKNCHARHYGHK-KRWDZBQOSA-N	446.533	1.196	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)N[C@@H]2CCN(Cc3ccccc3)C2=O)cc1OC	744878041	OQBYSBVCQKKCHU-QGZVFWFLSA-N	426.473	1.839	50	20	IDGD	
CS[C@@H]1CC[C@H](NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)C1	745896837	MNRTXFBHEZDYKK-LSDHHAIUSA-N	426.564	1.699	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)N[C@@H]1CC(=O)N([C@H]2C[C@@H]2c2ccccc2)C1	745915387	YULSNEGICVWNFX-OLMNPRSZSA-N	446.467	1.436	50	20	IDGD	
O=C(NNC(=O)c1csc2cncn12)c1cccc(S(=O)(=O)N2CCCCC2)c1	746092772	CPOGHEODHFWGDF-UHFFFAOYSA-N	433.515	1.645	50	20	IDGD	
CCC[C@H](NC(=O)NCc1ccc(F)cc1)C(=O)NNC(=O)Cc1cn2ccccc2n1	746637622	ROAMTZGTODSYFO-SFHVURJKSA-N	440.479	1.831	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)c2cnn(CC(=O)NC3CCCCC3)c2)c1	746678403	RYXBZPCVLROZRQ-UHFFFAOYSA-N	428.493	1.214	50	20	IDGD	
CC(C)C[C@H](C(=O)NNC(=O)CCOc1ccccc1)N1C(=O)[C@H]2CC=CC[C@H]2C1=O	747182537	JMHPOPCIDWHQGO-CEXWTWQISA-N	427.501	1.969	50	20	IDGD	
Cc1c(CC(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cccc1[N+](=O)[O-]	747725951	BMGPVBVEDJGGJW-UHFFFAOYSA-N	426.838	1.208	50	20	IDGD	
CN(C)C(=O)c1ccc(Cl)c(S(=O)(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)c1	747790756	FLDLERYRIIQSGH-UHFFFAOYSA-N	442.837	1.279	50	20	IDGD	
Cn1nnc2cc(C(=O)NNc3ccc(S(=O)(=O)Nc4nccs4)cc3)ccc21	747943477	YVUAQOHIYKVQSR-UHFFFAOYSA-N	429.487	1.983	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(Br)s1)NNc1ccc([N+](=O)[O-])cc1	747985737	FZNYIWSLUDGGEL-UHFFFAOYSA-N	435.281	1.840	50	20	IDGD	
CS(=O)(=O)N1CCC(CNC(=O)NNC(=O)CCSc2ccc(F)cc2)CC1	749017084	IJRYOMSPHJTVFT-UHFFFAOYSA-N	432.543	1.310	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)Cc1c(C)nn(-c2cncc3nnnn23)c1C)c1ccccc1	749840629	MNRNWDPUWHSGGJ-INIZCTEOSA-N	433.476	1.206	50	20	IDGD	
CC[C@@H](Oc1ccccc1C)C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	750460652	BPEFNAXWWYAACY-DNVCBOLYSA-N	428.441	1.683	50	20	IDGD	
CCN(CC(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2OC)c1)C1CC1	750828198	NJSNHXUSUXMYIF-UHFFFAOYSA-N	446.529	1.741	50	20	IDGD	
CCOCCNC(=S)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	750975771	ZEQBURQQBONSDT-UHFFFAOYSA-N	425.514	1.590	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2ccc(Br)cc2[N+](=O)[O-])C[C@H](C)O1	751059039	RWDCRQJQYSSGJX-QWRGUYRKSA-N	429.271	1.618	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)c1nn(-c2ccc(F)cc2)c2c1CCC2	751208448	DNBOTUUJJDKZII-UHFFFAOYSA-N	427.461	1.753	50	20	IDGD	
CC[C@H](C)NS(=O)(=O)c1ccc(C(=O)NNC(=O)CNC(=O)c2cccs2)cc1	751209132	MBVBSHDOMKVGCX-LBPRGKRZSA-N	438.531	1.016	50	20	IDGD	
Nc1nc(Cl)cc(NNC(=O)CS(=O)(=O)Cc2ccc(Br)cc2)n1	753453288	DFIKIJGVMDEVAX-UHFFFAOYSA-N	434.703	1.533	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)Nc2ccc3c(c2)NC(=O)CO3)c2ccccc2c1=O	755515202	QJNLIMPSWXRAKS-UHFFFAOYSA-N	436.428	1.775	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)c2cccc(OC(F)F)c2)n([C@@H]2CCS(=O)(=O)C2)n1	755530062	DQJZAGWGNLGHBT-GFCCVEGCSA-N	443.432	1.619	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1ccccc1CN(C)C(=O)OC(C)(C)C	756616928	DEHNYTVYWYZUGC-GFCCVEGCSA-N	443.526	1.144	50	20	IDGD	
O=C(NNC(=O)c1cccc(Br)c1)Nc1ccn(CCN2CCOCC2)n1	756646742	OPHULAVXVQXGDP-UHFFFAOYSA-N	437.298	1.444	50	20	IDGD	
C[C@@H]1CN(C2CC2)C[C@@H]1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	757792223	WJKXOHAGRXOUDC-BEFAXECRSA-N	449.577	1.288	50	20	IDGD	
Cc1nn([C@H]2CCS(=O)(=O)C2)c(C)c1NC(=O)NNC(=O)c1ccc(Cl)nc1	757872202	WEWDCWITUZHVRD-LBPRGKRZSA-N	426.886	1.374	50	20	IDGD	
O=C(CN1CCN(C(=O)OCc2ccccc2)CC1)NNc1nc(O)c2ccccc2n1	758299238	GHGUSUQLFKZWDZ-UHFFFAOYSA-N	436.472	1.733	50	20	IDGD	
COCc1nc2n(n1)C[C@@H](NC(=O)CCC(=O)C(C#N)=C1N(C)c3ccccc3N1C)CC2	758328891	VCHIESOWWUKLFZ-HNNXBMFYSA-N	449.515	1.526	50	20	IDGD	
Cc1ccc(S(=O)(=O)C2(C(=O)NNC(=O)C(=O)Nc3ccccn3)CCCC2)cc1	758840898	SUKSBBKNTBVTJV-UHFFFAOYSA-N	430.486	1.263	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)CCN3CCN(c4ccccn4)CC3)n[nH]2)cc1	762953166	GYPUDIBCIZWEMQ-UHFFFAOYSA-N	433.516	1.753	50	20	IDGD	
Cc1cc(Cl)ccc1OCCCC(=O)NNC(=O)C(=O)Nc1cccc(C(N)=O)n1	763499183	FXBXWYPXMQOYLT-UHFFFAOYSA-N	433.852	1.087	50	20	IDGD	
Cc1nc(C)c(NC(=O)C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)s1	763531587	PIXFACXYWXVVEL-UHFFFAOYSA-N	430.534	1.058	50	20	IDGD	
COCC[S@](=O)Cc1cccc(NC(=O)C(=O)NNC(=O)c2c[nH]c3ccccc23)c1	763535540	HKSYZLPBXGPCDH-HKBQPEDESA-N	442.497	1.463	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)CCC(=O)N3C)cc1OC	763543741	OCOBNXVCALEODG-UHFFFAOYSA-N	426.429	1.013	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)C(=O)Nc1ccc(OCc2ccccc2)nc1	763552345	YOUDYDNMKNFSBB-UHFFFAOYSA-N	434.408	1.789	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccccc2CN2CCNC2=O)c2ccccc2n1	763617084	SBFMZJKNVGSMMO-UHFFFAOYSA-N	446.467	1.468	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(OCC(F)(F)F)nc2)cc1	763674141	LLERXQAPAXYXTJ-UHFFFAOYSA-N	437.334	1.059	50	20	IDGD	
COC(=O)c1cc(Cl)ccc1NC(=O)C(=O)NNC(=O)COc1ccc(C#N)cc1	763677961	AERRDJCMZHKCOW-UHFFFAOYSA-N	430.804	1.163	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c(Cl)c1	763717936	DHDYAEGEYFLJKZ-UHFFFAOYSA-N	438.893	1.298	50	20	IDGD	
Cn1cccc(NC(=O)C(=O)NNC(=O)COc2ccccc2Cc2ccccc2)c1=O	763718085	GZQCSUPSLVBPOR-UHFFFAOYSA-N	434.452	1.141	50	20	IDGD	
CC(C)Oc1c(F)cc(NC(=O)C(=O)NNC(=O)c2nnc(O)c3ccccc23)cc1F	763789875	DQUWKBNVNVPDKS-UHFFFAOYSA-N	445.382	1.801	50	20	IDGD	
CCCOc1cc(F)ccc1NC(=O)C(=O)NNC(=O)COc1ccccc1[N+](=O)[O-]	763806134	ZONKYFQVOMDPEH-UHFFFAOYSA-N	434.380	1.688	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)OCCO3)cc1	763878616	RZVVORIIFVMOPT-ZDUSSCGKSA-N	427.413	1.214	50	20	IDGD	
O=C(Cc1ccsc1)NNC(=O)C(=O)Nc1ccnn1Cc1cnn(-c2ccccc2)c1	764025997	SOLPEQBWZWMBOC-UHFFFAOYSA-N	449.496	1.507	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cc3c(cc2[N+](=O)[O-])OCCCO3)c(O)c1	764105579	VQLCGEZWPAHURI-UHFFFAOYSA-N	430.373	1.170	50	20	IDGD	
COCCOc1c(Cl)cc(NC(=O)C(=O)NNC(=O)c2cc(C)[nH]n2)cc1Cl	764106306	HXHKKNQRMVQYAV-UHFFFAOYSA-N	430.248	1.450	50	20	IDGD	
CCOC(=O)CCc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)cc1	764168220	ONZIRSUHEQZACR-GOSISDBHSA-N	425.441	1.272	50	20	IDGD	
COc1ccc(NC(=O)c2cccc(NC(=O)C(=O)NNC(=O)CCC(C)C)c2)cn1	764200185	VZSJLYJLPFQFGJ-UHFFFAOYSA-N	427.461	1.865	50	20	IDGD	
Cc1nnc(-c2cccc(NC(=O)C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)c2)o1	764203258	KPBHMDXAERZIIG-UHFFFAOYSA-N	446.464	1.436	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1	764205119	ZVHZFPSECIIYKY-UHFFFAOYSA-N	443.844	1.639	50	20	IDGD	
Cc1cc(C(=O)NC2CCCCC2)ccc1NC(=O)C(=O)NNC(=O)c1c[nH]nc1C	764297977	KHXDSLMYSILAJN-UHFFFAOYSA-N	426.477	1.489	50	20	IDGD	
C[C@@H](c1cccc(NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)c1)N1CCOCC1	764345929	MLBSIXQWCNWTGO-ZDUSSCGKSA-N	446.891	1.839	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)c(Cl)c1)C(=O)Nc1ccnc(OCC(F)(F)F)c1	764348966	FLJDTUKJONBEAQ-UHFFFAOYSA-N	432.742	1.781	50	20	IDGD	
CCN(CC)CCn1ccc2cc(NC(=O)C(=O)NNC(=O)c3cnn(C)c3)ccc21	764358907	KHXLPBARIWCNSK-UHFFFAOYSA-N	425.493	1.116	50	20	IDGD	
CCNS(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2cc(C)nc3ccccc23)cc1	764371890	ALRIBEHVTGOKSQ-UHFFFAOYSA-N	441.513	1.986	50	20	IDGD	
O=C(NCc1ccc(F)cn1)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	764378507	OWYGWRQWAXIPSJ-UHFFFAOYSA-N	435.481	1.540	50	20	IDGD	
COc1ccc(NC(=O)c2cccc(NC(=O)C(=O)NNC(=O)c3ncccc3C)c2)cn1	764389276	QSHAABQOLOKERD-UHFFFAOYSA-N	448.439	1.446	50	20	IDGD	
CN1CC(=O)N(c2cccc(NC(=O)C(=O)NNC(=O)c3ccc(Cl)cc3F)c2)C1=O	764410014	FNMQBBMCTWBZCO-UHFFFAOYSA-N	447.810	1.277	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@]2(CCN(CC(=O)NNC(=O)c3cccc(C#N)c3)C2)C1	765035769	VWKGTFJXLGZZCE-QFIPXVFZSA-N	427.505	1.652	50	20	IDGD	
COC(=O)NNC(=O)C(=O)Nc1ccc(OC)c(NC(=O)Nc2ccccc2OC)c1	765372595	RDPCTLJOCYVLCL-UHFFFAOYSA-N	431.405	1.674	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)[C@H](C)S(=O)(=O)C2CCOCC2)c1	765406333	VCIANFYPTAPVQY-JTQLQIEISA-N	449.323	1.201	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1ccc(C(=O)N2CCCCC2)c(Cl)c1	766261396	XKHBOBWIRKONDF-UHFFFAOYSA-N	432.868	1.847	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1cc(C(=O)NCC(F)(F)F)ccc1C	766265068	VXZZMRRGEYOURX-UHFFFAOYSA-N	426.355	1.168	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)CN3CCN(C(=O)c4ccccc4)CC3)on2)cc1	766642890	OJEMFLYIYNSMFW-UHFFFAOYSA-N	447.495	1.869	50	20	IDGD	
O=C(Cc1ccc(S(=O)(=O)N2CCOCC2)s1)NNc1ncnc2ccsc12	766678815	RFVKYJBIULEAFF-UHFFFAOYSA-N	439.544	1.460	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)CN1CCN(Cc2ccc3c(c2)OCCO3)CC1	766835220	CFWJZGCLKPRTTC-UHFFFAOYSA-N	438.528	1.274	50	20	IDGD	
CCN(C(C)=O)c1nc(C=NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cs1	767033049	KYHLJMOALBPFDZ-UHFFFAOYSA-N	437.547	1.595	50	20	IDGD	
CN(C)C(=O)c1cc(F)ccc1NC(=O)C(=O)NNC(=O)CSc1ccccc1O	768244152	YTRVZRFQEOLDEX-UHFFFAOYSA-N	434.449	1.111	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)[C@@H](C)N2C(=O)[C@H]3CCCC[C@H]3C2=O)n[nH]1	768273677	ISWYKEIQUZTAOU-MCIONIFRSA-N	439.472	1.410	50	20	IDGD	
CCOC(=O)N[C@@H](C(=O)NNC(=O)c1cc(-c2ccc(OC)c(OC)c2)[nH]n1)C(C)C	768276540	KLICNYQWMVXIDZ-QGZVFWFLSA-N	433.465	1.626	50	20	IDGD	
Cc1ccc(CNC(=O)NNc2nc(O)c3cnn(C)c3n2)c(OC[C@H]2CCCO2)c1	770413499	SCCAGAQHNZLCSN-CQSZACIVSA-N	427.465	1.761	50	20	IDGD	
COC(=O)c1ccnc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1	770681017	FXRLDUFFQZNXDW-UHFFFAOYSA-N	447.473	1.119	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)[C@@H](Cc3ccccc3)NC(=O)OC(C)(C)C)nc21	770971838	AKUKOIFNNBABCL-CQSZACIVSA-N	427.465	1.648	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)C1=NN(Cc2ccccc2)C(=O)CC1	772884757	OTLQSIYBCLFLRT-UHFFFAOYSA-N	441.875	1.282	50	20	IDGD	
Cn1cc([C@H](NC(=O)NNC(=O)CNC(=O)c2cccs2)c2ccc(F)cc2)cn1	773265833	JKSTZLASBYYDBY-QGZVFWFLSA-N	430.465	1.471	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NNC(=O)c2cnc(O)c(Br)c2)C1	773422867	ZEAORINXRRJZHJ-SNVBAGLBSA-N	443.298	1.958	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNc2nc(C)cc(C)n2)cc(OC)c(OC)c1OC	773480216	OAGXUDJVSGEUCZ-UHFFFAOYSA-N	447.448	1.378	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)C(=O)Nc2cccc(C)n2)cc(OCC)c1OCC	773510766	IQOKSMMALIUNCF-UHFFFAOYSA-N	430.461	1.986	50	20	IDGD	
O=C(NNc1ccc(-n2cccn2)nn1)C(=O)Nc1cc2c(cc1Br)CCC2	773646761	YPJGBNVNXUMRHG-UHFFFAOYSA-N	442.277	1.995	50	20	IDGD	
O=C(NNC(=O)C12CC3CC(CC(C3)C1)C2)N[C@@H]1CCO[C@]2(CCS(=O)(=O)C2)C1	776073054	JCQJTXVMWUYNLP-WHKRZQRVSA-N	425.551	1.270	50	20	IDGD	
Cc1ccc(S(=O)(=O)C[C@@H](C)NC(=O)NNc2ccccc2S(C)(=O)=O)cc1	776190438	ASNUQGMZYNPPDJ-CQSZACIVSA-N	425.532	1.887	50	20	IDGD	
Cc1ccc(S(=O)(=O)C[C@H](C)NC(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)cc1	776195023	PPJTVIPQPRVEER-INIZCTEOSA-N	446.529	1.743	50	20	IDGD	
CCO[C@@H]1C[C@@H](NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)[C@H]1Oc1ccccc1	776530980	JPUYAUSCPAJVFN-GUDVDZBRSA-N	447.513	1.659	50	20	IDGD	
CC(=NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)C1CCS(=O)(=O)CC1	777418918	QOUNKXVJPUSCCU-UHFFFAOYSA-N	441.575	1.792	50	20	IDGD	
COc1ccc(-n2ccc(C(=O)N3CCN(S(=O)(=O)CBr)CC3)n2)cc1	777777900	RYBKKIJVLNJXKM-UHFFFAOYSA-N	443.323	1.321	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN[C@@H](c1nc(-c2nc[nH]n2)no1)C(C)C	778139090	AJTIYWHEJSUVSK-CQSZACIVSA-N	448.871	1.265	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)c2nnn(-c3ccc4c(c3)OCCO4)c2C)nc1C	778424370	PDZUOTFBMLAUAS-UHFFFAOYSA-N	439.432	1.379	50	20	IDGD	
CC(C)C[C@H](C(=O)NNC(=O)CNC(=O)OC(C)(C)C)N1C(=O)[C@H]2CC=CC[C@@H]2C1=O	778445873	VIQADZOWKGLKAM-SOUVJXGZSA-N	436.509	1.024	50	20	IDGD	
CN1CCN(CCCNC(=O)NNC(=O)CNC(=O)OC(C)(C)C)[C@H](c2ccccc2)C1	778616273	AOVGPBLNGBVEBB-SFHVURJKSA-N	448.568	1.220	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)c2ccc(S(=O)(=O)NC[C@H]3CCCO3)cc2)c1	780790840	ANLVYMRNVFVFQL-QGZVFWFLSA-N	433.486	1.687	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)cc1O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	780849275	XCLUCYMYASOOES-UHFFFAOYSA-N	441.465	1.651	50	20	IDGD	
COc1cc(S(=O)(=O)N2CCOCC2)cc(C(=O)NNc2ccnc(F)c2)c1OC	781362556	LFGRUXRUHISNKF-UHFFFAOYSA-N	440.453	1.016	50	20	IDGD	
CC(C)S(=O)(=O)c1ccc(CC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc1	781418234	UWDULAJDFLMOAU-UHFFFAOYSA-N	442.497	1.764	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)c1cc2nn[nH]c2cc1F	781953550	AEDIVPBZDKTWGZ-UHFFFAOYSA-N	445.886	1.329	50	20	IDGD	
C[C@H]1CN(C(=O)c2ccc(NC(=O)C(=O)NNc3ncncc3Cl)cc2)C[C@H](C)O1	782165184	FBJIGDQJISAOPE-RYUDHWBXSA-N	432.868	1.461	50	20	IDGD	
CCCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)cc1	782883497	AMYWIYIYWIJVQD-UHFFFAOYSA-N	436.472	1.042	50	20	IDGD	
O=C(NNC(=O)C(=O)NC1CC1)C(=O)Nc1cc([N+](=O)[O-])ccc1Sc1cccs1	782965819	JEFSYQZQYJZYDT-UHFFFAOYSA-N	449.470	1.172	50	20	IDGD	
Cc1cc(F)ccc1-n1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)n1	783028826	CKPRZZDKEUDQQR-UHFFFAOYSA-N	445.476	1.645	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2ccc(F)c(S(=O)(=O)NC(C)(C)C)c2)cc1	783037957	WAIOPGTXOTZAIT-UHFFFAOYSA-N	438.481	1.993	50	20	IDGD	
Cc1cc(Br)ccc1NNC(=O)C(=O)Nc1ccc(N2CCNC(=O)C2)nc1	784413592	VGVMRCYCJPWNCA-UHFFFAOYSA-N	447.293	1.171	50	20	IDGD	
O=C(NNc1nccnc1Cl)C(=O)N1C[C@@H](C(=O)N2CCCCC2)Oc2ccccc21	784777613	BEESWUYQNSJURP-HNNXBMFYSA-N	444.879	1.380	50	20	IDGD	
CS(=O)(=O)c1ccccc1-n1cc(NC(=O)C(=O)NNc2ncccc2Cl)cn1	784817982	ODBVAWCHMIPKTP-UHFFFAOYSA-N	434.865	1.406	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2cc(F)c(F)cc2F)cc1NS(C)(=O)=O	784897800	YLBWNLHGGFNHQM-UHFFFAOYSA-N	432.380	1.566	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)Nc1ccc(F)cc1OC(F)F	785023355	GGBNPFKSAOXYBI-UHFFFAOYSA-N	428.279	1.441	50	20	IDGD	
CCCCN1C(=O)CC[C@@H](C(=O)NNC(=O)N2CCN(C)CC2)[C@@H]1c1ccc(OC)cc1	788168833	FNGNWVJOUFKEQD-CTNGQTDRSA-N	445.564	1.763	50	20	IDGD	
Cc1ccc([C@@]2(C)NC(=O)N(CC(=O)NNc3nnc(-c4ccccn4)s3)C2=O)cc1	788563917	VJEXXZHMONUPRU-HXUWFJFHSA-N	437.485	1.819	50	20	IDGD	
COCCN1C(=O)c2ccc(C(=O)NNc3ccc(Cl)c(OC)c3)cc2S1(=O)=O	790177354	CWEXSNUSRGTCDL-UHFFFAOYSA-N	439.877	1.896	50	20	IDGD	
O=C(Cn1ccc2ccccc2c1=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	790819874	VRBIWLQOTUPQTG-UHFFFAOYSA-N	442.497	1.166	50	20	IDGD	
COc1cc(C(F)(F)F)ncc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccc(F)cc1	792269345	QTVGJUKKLUBJIA-SECBINFHSA-N	444.341	1.802	50	20	IDGD	
CNS(=O)(=O)c1ccc(NC(=O)NNC(=O)CCSc2ccc(F)cc2)nc1	792400502	OJZCWBIWJGPPNN-UHFFFAOYSA-N	427.483	1.464	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)N(C)[C@H](C)c2cccc(N3CCCS3(=O)=O)c2)n1	793229008	UFKYFLQURQPTLS-OAHLLOKOSA-N	431.518	1.977	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@H]2C(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1	798365092	MXBPVQLCFOQWMY-KRWDZBQOSA-N	425.441	1.532	50	20	IDGD	
Cc1ccc(C2=NO[C@H](CNC(=O)NNC(=O)COc3ccccc3[N+](=O)[O-])C2)cc1	800753492	DPWGOEFNCYSCLT-HNNXBMFYSA-N	427.417	1.806	50	20	IDGD	
CS(=O)(=O)Cc1nc2ccccc2n1CC(=O)NNC(=O)Nc1ccc2c(c1)OCO2	802096803	GHTPMNLATSJJLG-UHFFFAOYSA-N	445.457	1.163	50	20	IDGD	
Cc1nn(C)c2sc(C(=O)N[C@H](C)C(=O)NNC(=O)Nc3ccc4c(c3)OCO4)cc12	802105731	CUFFSMPQUYFDRT-SNVBAGLBSA-N	444.473	1.643	50	20	IDGD	
CNC(=O)COc1ccc(C(=O)NNC(=O)Nc2cc(OC)ccc2Cl)cc1OC	802113119	FBSGIGACKBYRNP-UHFFFAOYSA-N	436.852	1.949	50	20	IDGD	
Cc1ccc(C2=NO[C@H](CNC(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)C2)cc1C	802377157	DJMHYXZDZHFDRS-KRWDZBQOSA-N	444.513	1.844	50	20	IDGD	
COCCCn1nccc1C=NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	802712707	SOKGHKWWSQMMSO-UHFFFAOYSA-N	432.956	1.841	50	20	IDGD	
Cc1ccnc2ccc(C(=O)NNC(=O)CN3CCN(C(=O)c4ccccc4)CC3)cc12	802763655	ZBMITAFUDFCMSG-UHFFFAOYSA-N	431.496	1.762	50	20	IDGD	
O=C(NNc1ccc2c(=O)[nH]ccc2c1)[C@@H]1CS[C@H](Cc2ccccc2F)C(=O)N1	803428138	SGCCXYJHCUVTRR-ZWKOTPCHSA-N	426.473	1.953	50	20	IDGD	
COC(=O)N(C)NC(=O)/C(C#N)=C/c1cn(CCC(N)=O)nc1-c1ccc(OC)cc1	804124301	LNYWWXYTWKOVPK-GXDHUFHOSA-N	426.433	1.070	50	20	IDGD	
C[C@H](C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)C1CN(C(=O)OC(C)(C)C)C1	806444877	HEZVKWOGJRHHFP-LBPRGKRZSA-N	425.507	1.354	50	20	IDGD	
COCCCOc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)cc1OC	806972903	QNQJRQNZPCVPAG-UHFFFAOYSA-N	445.428	1.239	50	20	IDGD	
Cc1cc(F)ccc1NNC(=O)C(=O)N1C[C@@H](C[C@H]2COCC(=O)N2)c2ccccc21	807001992	OQCYGFDHMCUJIB-ZBFHGGJFSA-N	426.448	1.613	50	20	IDGD	
COc1ccc(C(=O)NNc2ncccc2F)cc1S(=O)(=O)NCc1ccccn1	807669812	TUIZCLOALUXQRI-UHFFFAOYSA-N	431.449	1.860	50	20	IDGD	
CCCS(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1	808065714	HRHGTJPSOVFRNA-UHFFFAOYSA-N	427.460	1.402	50	20	IDGD	
Cn1cncc1CNC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	812485963	AAFQKYNLFMXCBK-UHFFFAOYSA-N	442.501	1.043	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)Cn2nc(C)cc2C)cc1)[C@H]1C[C@H]1C	815566655	ALGMMVMEKGGAFM-XIKOKIGWSA-N	426.477	1.047	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2cccs2)[nH]n1)C(=O)Nc1cn(Cc2ccccc2)nn1	815570292	YIKFZBXSOLZLDG-UHFFFAOYSA-N	436.457	1.178	50	20	IDGD	
Cc1oc(-c2ccccc2)nc1CC(=O)NNC(=O)c1csc(N2CCOCC2)n1	842754680	OTMZBSNSFNKRDE-UHFFFAOYSA-N	427.486	1.947	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NCC(C)(C)N2CCOCC2)c2ccccc2c1=O	915894540	LOPUVEPDKDBDFD-UHFFFAOYSA-N	444.536	1.251	50	20	IDGD	
CCCCS(=O)(=O)N1CCC(C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)CC1	916037637	XEIAUKJGGSLBMR-AWEZNQCLSA-N	429.514	1.582	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)NC1CCN(C(=O)c2ccoc2)CC1	916261338	BROLLYLDFDOMRM-UHFFFAOYSA-N	431.405	1.202	50	20	IDGD	
CC(=NNC(=O)Cn1cnc2ccccc21)c1ccc(OCC(=O)N2CCOCC2)cc1	916272587	CSLMBOHXPWGQAU-UHFFFAOYSA-N	435.484	1.814	50	20	IDGD	
Cc1nn([C@@H]2CCS(=O)(=O)C2)c(Cl)c1C=NNC(=O)Cn1cnc2ccccc21	916273144	TYEUJECIIDTAEF-CYBMUJFWSA-N	434.909	1.705	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2ccnc(OC3CCCC3)c2)c1	916396103	WXPVNPRJXIBGCR-UHFFFAOYSA-N	432.502	1.951	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)sc(C)c1C	916561727	AVWRROTXHSTZLG-UHFFFAOYSA-N	444.469	1.578	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CNC(=O)c2ccc([N+](=O)[O-])c(C)c2)cc1C	916562409	PIXFYQKVBISJGQ-UHFFFAOYSA-N	427.417	1.036	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNS(=O)(=O)c2ccc(Cl)c([N+](=O)[O-])c2)cc1C	916567426	DAANVQLEUNFSFO-UHFFFAOYSA-N	426.838	1.813	50	20	IDGD	
O=C(COC(=O)CCC(=O)c1ccc(F)cc1F)NNC(=O)[C@H]1COc2ccccc2O1	917334295	JSQMHYXXUMSDPT-GOSISDBHSA-N	448.378	1.458	50	20	IDGD	
CSCC[C@H](NC(=O)c1ccccc1)C(=O)NNC(=O)CCN1C[C@H](C)O[C@@H](C)C1	917362874	PPFGXNIUCYHYLZ-BQFCYCMXSA-N	436.578	1.185	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)[C@@H](C)NS(=O)(=O)c1cccs1	917920515	ZQKHPBNIVKKMOR-GFCCVEGCSA-N	435.531	1.175	50	20	IDGD	
O=C(NCc1nc(C2CC2)no1)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	918233741	RCALKMYRBZEAJX-UHFFFAOYSA-N	448.505	1.266	50	20	IDGD	
Cn1c2ccccc2c2cc(S(=O)(=O)NNC(=O)N[C@H]3CCS(=O)(=O)C3)ccc21	919961004	NKONVJSHFKPJIG-LBPRGKRZSA-N	436.515	1.011	50	20	IDGD	
CS(=O)(=O)c1nc(C(=O)NNC(=O)c2cc(-c3ccccc3)on2)c2ccccn12	920255426	UDABQUMQUHALEQ-UHFFFAOYSA-N	425.426	1.468	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc([N+](=O)[O-])cc(S(C)(=O)=O)c2)cc1C	920303088	VTBKVVADBHHAFC-UHFFFAOYSA-N	434.430	1.015	50	20	IDGD	
CCCNC(=O)NNC(=O)c1ccc(OC)c(S(=O)(=O)N2C[C@@H](C)C[C@@H](C)C2)c1	921042605	CXUKODHPQCQVKS-OKILXGFUSA-N	426.539	1.716	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)CNC(=O)c3ccc(C)s3)CC2)cc1	1340526487	JHYSDZKCGNFZTI-UHFFFAOYSA-N	443.573	1.060	50	20	IDGD	
O=C(c1cn2ccc(Cl)cc2n1)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1778057638	KZTLHMYMKFJANC-RDTXWAMCSA-N	427.288	1.031	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Br)C2	1778105683	GITZWWUFOUDZRI-LSCFUAHRSA-N	436.322	1.058	50	20	IDGD	
Cc1ncncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)Br)C2	1779800370	GASHWEIPWYLJHG-CDHAZOANSA-N	425.327	1.696	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2c[nH]c(=O)cn2)C1	1780125012	MKNZHTWNLSJUPQ-WPKBUWHJSA-N	441.326	1.071	50	20	IDGD	
COc1ccnc(C(=O)N2CC[C@@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)c1OC	1780447918	MDVCDHGQKAFPSY-HXUWFJFHSA-N	437.569	1.394	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)Cc3ccc(C(=O)OC)s3)C2)C1	1780899275	UZEPIIXVQKEBSF-LIRRHRJNSA-N	444.937	1.161	50	20	IDGD	
C[C@H](NNc1ccccc1)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781326618	ZDAANVAMZKJQAL-JOQOYGCGSA-N	443.317	1.512	50	20	IDGD	
Cc1n[nH]c(C)c1CC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)Br)C1	1782003576	NROGMSMNQRDILF-SMNXXWJPSA-N	441.370	1.866	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc3cncn3c1)C2	1782175896	RSUXACHLPUQARG-DBXWQHBBSA-N	434.924	1.716	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(CO)c(F)c1)C2	1782179481	YEYJDULYNMFILT-HGHGUNKESA-N	442.915	1.699	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccoc1Cl)C2	1782211988	AANMJRNTMLOCJX-FOIQADDNSA-N	440.928	1.434	50	20	IDGD	
COc1ccc(Cl)cc1CC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1782976551	RMXKDUVITWDQHP-KXBFYZLASA-N	431.316	1.321	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CC[C@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1783848875	ASWAAHPMTFMNGH-FVJLSDCUSA-N	438.597	1.423	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)CCc3cccc([N+](=O)[O-])c3)CCO2)C1	1783871212	OEKFWGCCHGRQQA-FXAWDEMLSA-N	439.896	1.611	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)Cc3cc([N+](=O)[O-])ccc3F)CCO2)C1	1783873166	LVFFKOMJLGIXQI-DNVCBOLYSA-N	443.859	1.360	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3n[nH]c4cc(Cl)ccc34)CCO2)C1	1783876819	ATXALZNMPHITTI-LIRRHRJNSA-N	441.315	1.914	50	20	IDGD	
Cc1cc(F)c(F)c(C(=O)N2CCO[C@@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)c1	1783935130	PSOVPJSTASSJER-OAQYLSRUSA-N	438.475	1.090	50	20	IDGD	
Cc1cc(C)n(CCC(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)n1	1784321805	SRUPMENNKBTWMU-WBVHZDCISA-N	431.306	1.410	50	20	IDGD	
Cc1ncc(CC(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)s1	1784433275	DOZBTRSXOGBLDO-SJKOYZFVSA-N	430.368	1.855	50	20	IDGD	
O=C(NC1(c2ccc(NC(=O)[C@@H](O)c3ccco3)cc2)CCC1)c1ccc(B(O)O)cc1	1785854235	DRMASDFHCGRAEK-FQEVSTJZSA-N	434.257	1.441	50	20	IDGD	
CN(C)c1ncc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]32)o1	1785888826	YXVQKCGBJWNIHT-PAKFGRKTSA-N	433.336	1.570	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)c3ccccc3)[C@H]2C1	1786666596	ZKZJHYGGVVIEOJ-DRCYAFTPSA-N	429.344	1.936	50	20	IDGD	
Cc1nc(N)sc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]21	1786918375	ZRSNZNUGSYGPDS-GUUCOKDPSA-N	435.377	1.863	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3c[nH]c4nccc-4c3)[C@H]2C1	1787333059	BZSOUCWZYZQIJR-SZMVWBNQSA-N	430.581	1.959	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](S)C(C)C)C[C@@H]21	1787506780	MOYUMFXQLLDTIP-WMDQAJGNSA-N	449.577	1.055	50	20	IDGD	
COc1cnc(C(=O)Nc2ccc(C3(NC(=O)CCC(=O)NN(C)C)CCC3)cc2)cn1	1787561830	MIHULPUHNBLQNC-UHFFFAOYSA-N	440.504	1.606	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nc4ccc(F)cn4n3)C[C@@H]21	1788764106	LXEJBOQQIBNIJE-BPUTZDHNSA-N	449.559	1.313	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CCc4nc[nH]c4C3)C[C@@H]21	1788766091	NKAKNXTZIWAVOQ-FPXQBCRKSA-N	434.613	1.346	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)c1cc2ncsc2[nH]1	1788786807	MRGHEHOSPFWDAR-WTTBSCSTSA-N	445.314	1.908	50	20	IDGD	
Cn1nc(C(=O)NC2(c3ccc(NC(=O)c4cnccc4C(=O)NN)cc3)CCC2)cc1O	1789521053	BBAVVACSLQEDRN-UHFFFAOYSA-N	449.471	1.186	50	20	IDGD	
CC(C)(C)OC(=O)C(C)(C)CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21	1789685071	SPLYWKRZVAVNGG-VGWMRTNUSA-N	446.972	1.324	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cn3cnc4ccccc43)C[C@@H]21	1791063230	DJZSPNMTVMXCGI-XSWJXKHESA-N	449.349	1.799	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnn(-c4cccnc4)c3)C[C@@H]21	1791252677	RNBNFVDDIFMFLH-FZDIXFNVSA-N	447.923	1.114	50	20	IDGD	
C[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)c1ccccn1	1791715616	CITSUKAKZZQOKT-VRUQUDLLSA-N	428.302	1.855	50	20	IDGD	
CC#C[C@H](CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](O)CCl)c1ccc(O)cc1	1792982654	LIZXPDUBLPCZPG-VAVQPMOSSA-N	434.920	1.079	50	20	IDGD	
COc1nccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@](C)(Cl)CCl)C3)c1F	1795910338	FOUIIMRSWUPFFU-MSNRECKUSA-N	434.295	1.669	50	20	IDGD	
COc1ccc(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)cc1F	1796192811	SQVBEEGWGKNWCI-REPLKXPHSA-N	440.280	1.009	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)c1csc(-c2ccccc2)n1	1796691743	HXWCWYSVZYCBMQ-FSDCSDTHSA-N	435.933	1.613	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2)c1ccc2cnccc2n1	1796892290	PDJOZDSVPJYYBI-ZSBFGKGUSA-N	433.306	1.618	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2[nH]ccc2n1	1797399206	ZAVSLPOAXKSTRP-LKQDWFRTSA-N	435.322	1.940	50	20	IDGD	
Cc1cc(C(N)=O)cc(C)c1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CO[Si](C)(C)C)C2	1797733680	XYYXOMAQDBHHBV-XEMDLRDOSA-N	447.608	1.457	50	20	IDGD	
CC(=O)N1CCN(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@](C)(Cl)CCl)C3)CC1	1797933084	PJHURZMONYNXIB-RCJHGTSTSA-N	433.380	1.025	50	20	IDGD	
C[C@@H](Nc1ccccn1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@](C)(Cl)CCl)C2	1797977583	IHPVPSYBWBLLMU-HUYPOWGKSA-N	429.348	1.708	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2)c1cncc2cnccc12	1798456033	DQMSAHHLWJTNGO-ZSBFGKGUSA-N	433.306	1.618	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cn(C)nc1C(F)(F)F	1798793207	DNVMSVAIIGNNMO-CLLJXQQHSA-N	444.458	1.064	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(N3CCOCC3)cn1)C2	1799264511	OVNRZMFBBQTYTD-LORHWOILSA-N	436.940	1.139	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(Cl)nc1F)C2	1800757211	BHMCKYHOYVDEAU-ORXSELOVSA-N	434.693	1.861	50	20	IDGD	
CC(C)(C)OC(=O)N1CC=C(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C(Cl)Cl)C1	1801015930	YSPBZMLIBHNFRY-BTTYYORXSA-N	448.347	1.557	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc2occc2c1O	1801049295	YZDWBGZWRGLAQZ-BTTYYORXSA-N	449.467	1.703	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1c[nH]c(=O)cn1)C2	1801440341	PAKXFHQJMXLBTM-SELDRTEESA-N	439.422	1.907	50	20	IDGD	
CC(C)/C=C/C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1801623547	KLSQMULJEQFYRS-HMUZGSGMSA-N	443.972	1.920	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)c1ccc(OCC2CC2)c(F)c1	1801892906	UCMMLODCFKUYEB-LORHWOILSA-N	440.899	1.417	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)C(Cl)Cl)[C@H]1c1cccnc1)c1cc(O)nc(O)n1	1808305424	ZPPNNRDMHSEPKW-MFKMUULPSA-N	426.260	1.406	50	20	IDGD	
Cc1[nH]ccc1C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1	1810302130	GQXXIRFYFRXVIC-UZLBHIALSA-N	447.499	1.350	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1CCN(C(=O)c2ccc(O)nn2)[C@H]1c1cccnc1	1810541004	RJFWKIVAFTYITN-KXBFYZLASA-N	429.553	1.748	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@H]1CCN(C(=O)c2cccc(=O)n2O)[C@H]1c1cccnc1	1810541232	SSBSHEGVAYXMQD-UZLBHIALSA-N	444.564	1.652	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H](CNC(=O)[C@H](C)n2cncn2)[C@H]1c1cccnc1	1813398001	ZMEUULJIQXBFPJ-YALNPMBYSA-N	449.353	1.971	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](O)CCl)n[nH]1	1814875681	GPGSNCLAIHPIBR-ZIAGYGMSSA-N	443.932	1.916	50	20	IDGD	
CC(=O)N[C@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1)C(C)(C)C	1815057537	YCBAYMXKMNMNGX-SQWLQELKSA-N	427.933	1.552	50	20	IDGD	
CCC[C@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](O)NC(=O)OCC)[nH]n1	1815320158	VYJFYTJVCXHDJD-NORZTCDRSA-N	429.905	1.874	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CC[C@H](N)C(N)=O)n[nH]1	1817359979	SNAKHXZXEXVWGD-ZMNCSTGQSA-N	433.340	1.231	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(=O)n3[nH]cnc3n2)n[nH]1	1817467410	MYXNBHXNTGBCRV-ZWNOBZJWSA-N	432.872	1.464	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2nccs2)[nH]n1)c1cccc(B(O)O)c1	1817473532	ZBRWZPKUPACGPV-OAHLLOKOSA-N	425.279	1.166	50	20	IDGD	
Cc1nccnc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1819951486	ZEABAFRQRRJOGK-INIZCTEOSA-N	449.475	1.126	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)n2)[nH]n1)[C@@H](F)Br	1820931924	BHMOPLOEUSDPOK-BXKDBHETSA-N	443.233	1.607	50	20	IDGD	
CCNC(=S)NCC(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](Cl)COC)[nH]n1	1821646431	YAKADNDUEFEVQM-WCQYABFASA-N	430.962	1.140	50	20	IDGD	
N#Cc1cccc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2cccc(B(O)O)c2)CC3)c1	1822027150	GBCXGNFPBZEQQW-QGZVFWFLSA-N	446.297	1.234	50	20	IDGD	
Cc1cccnc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1	1822410912	RZBQSKWKYSSEMN-MRXNPFEDSA-N	427.509	1.792	50	20	IDGD	
CCc1cc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)nn1C	1822414866	MFYFSIICPWRMAF-KRWDZBQOSA-N	444.540	1.385	50	20	IDGD	
O=C(/C=C\C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1)NC1CC1	1823008984	YGRDQDSTGQBTHJ-JHYAKEMISA-N	445.314	1.580	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(=O)n3[nH]nnc3n2)CC1	1824614243	JUFFPOSIUZDSSN-GOEBONIOSA-N	449.943	1.453	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CN1CCSCC1)CC2	1825632297	RDTABKNNUNNDMD-MNOVXSKESA-N	447.424	1.887	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc[n+]([O-])cc1)CC2	1825641035	HKTBBXAGVFJBSW-ONGXEEELSA-N	425.308	1.786	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H]1CCc3nc[nH]c3C1)CC2	1826008826	IAJZOVSIXBZKPF-UTUOFQBUSA-N	437.953	1.837	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cncnc2)CC1	1828924996	AELFGVFSCKSKAJ-LJQANCHMSA-N	437.504	1.022	50	20	IDGD	
Cc1ccc2[nH]c(C(=O)N3CCOC[C@]4(C3)CN(C(=O)[C@H](O)CCl)CCO4)cc2c1	1830728579	VKTVGARPJJTJTE-NQIIRXRSSA-N	435.908	1.146	50	20	IDGD	
O=C([C@@H](O)CCl)N1CCC([C@H]2CCCCN2C(=O)c2nc3ccc(F)cn3n2)CC1	1831045556	IWYZJFNNJRQBDW-CVEARBPZSA-N	437.903	1.701	50	20	IDGD	
Cc1cc(/C=C/C(=O)N2CCC([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)no1	1831873194	CJCDHEDJRMIFNI-JCOOBLOPSA-N	445.564	1.989	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)Cn2cc(C)c(O)nc2=O)CC1	1832776690	XENWYKGOZLHDHS-IAGOWNOFSA-N	438.956	1.894	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3c[nH]c(C(C)(C)C)c3)CCO2)C1	1833382492	BFKXTCPELVYDKG-HRAATJIYSA-N	441.956	1.636	50	20	IDGD	
CC(=O)NC(C)(C)C(=O)NC1CCN(C2CCN(C(=O)[C@@](C)(Cl)CCl)CC2)CC1	1833486661	QQJANYLXUUMZHW-FQEVSTJZSA-N	449.423	1.709	50	20	IDGD	
Cc1cccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)c1	1835041305	BMWILUPZGJREIO-JOCHJYFZSA-N	434.609	1.845	50	20	IDGD	
N[C@@H](Cc1cccnc1)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](F)Cl)CC2)CC1	1835079520	CHMRSFGKQPPUOQ-ZWKOTPCHSA-N	425.936	1.057	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)c1ccc2cncn2c1	1835617854	YQTBAZCGQBCHRP-IBGZPJMESA-N	433.940	1.119	50	20	IDGD	
Cc1cc(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)nn1C(F)F	1836160459	HMDIDWODAOEBMP-INIZCTEOSA-N	447.914	1.372	50	20	IDGD	
O=C(c1csc2c1CCCO2)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1836391091	PREVIFCFWJPIBS-SFHVURJKSA-N	449.356	1.947	50	20	IDGD	
O=C(COc1ccc(O)cc1)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836619320	QYEZPOVZBSTULK-IBGZPJMESA-N	440.924	1.369	50	20	IDGD	
Cc1noc(CC(=O)N2CCC(OC3CCN(C(=O)[C@H](C)Br)CC3)CC2)n1	1837951500	VKMRBWUMPPAAGI-LBPRGKRZSA-N	443.342	1.703	50	20	IDGD	
Cc1cccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)c1	1838941506	NPIWLNUEQCNGRZ-BEFAXECRSA-N	425.323	1.848	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(F)cn3)C2)C1	1839151467	SDVFXCCJGVWMGX-ZWKOTPCHSA-N	434.295	1.527	50	20	IDGD	
CC(C)n1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)n1	1839153761	RLTFRFCAZWKMNB-RTBURBONSA-N	447.363	1.770	50	20	IDGD	
CCc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](Br)CC)CCO3)n[nH]1	1839964470	SLUYGDOIVXZILM-KDOFPFPSSA-N	443.342	1.216	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccc(F)cc3F)CCO2)C1	1839979275	FQDSFVAQJIBCBX-OXQOHEQNSA-N	430.879	1.981	50	20	IDGD	
Cc1ccnc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)c1	1840033250	YPDQLJRLENAXBR-RDTXWAMCSA-N	426.311	1.243	50	20	IDGD	
O=C(c1ccc2c(c1)OCO2)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840187570	JYMVAKKKTIQJLP-SFHVURJKSA-N	431.272	1.289	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)cc1Cl	1840731345	JRUOGGAYZPFEIB-KXBFYZLASA-N	447.315	1.018	50	20	IDGD	
O=C(c1cnc2cc(C(F)(F)F)ccn12)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1	1841353259	NLEWPENHYBHAEK-ZDUSSCGKSA-N	430.814	1.770	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](CC(=O)N1CCCC12CN(C(=O)[C@@H](O)CCl)C2)C1CC1	1841409918	WEPXXMUOUYNRBC-CABCVRRESA-N	429.945	1.483	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@H]2COCCN2C(=O)OC(C)(C)C)C1	1841751379	OJLLWVZRVXCGAJ-LSDHHAIUSA-N	429.945	1.843	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCCC12CN(C(=O)C1CCOCC1)C2	1841924446	MSNRULIBKGFAFB-HNNXBMFYSA-N	429.945	1.749	50	20	IDGD	
O=C(COc1ccc(Cl)c(F)c1)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843013153	OBWWKWWOFCSGDO-UHFFFAOYSA-N	446.671	1.055	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2cc(C(C)C)[nH]n2)C1	1844779750	NUALPXNYKVBDTO-OEAKJJBVSA-N	425.493	1.484	50	20	IDGD	
O=Cc1ccccc1-c1cncc(C(=O)N2CCCC23CN(C(=O)[C@@H](O)CCl)C3)c1	1845817156	UCZWVQPSPKBLBW-IBGZPJMESA-N	427.888	1.978	50	20	IDGD	
CN1C(=O)CC[C@H]1C(=O)N1CC2(CCCN2C(=O)/C(C#N)=C/c2ccc(F)cc2F)C1	1845871500	IUFMMCCJGYHEND-DWCFMXGVSA-N	428.439	1.696	50	20	IDGD	
Cc1ccc2[nH]cc(CC(=O)N3CC4(CCCN4C(=O)CCC(=O)NN(C)C)C3)c2c1	1846384204	PXJKOVUFFCJOID-UHFFFAOYSA-N	425.533	1.595	50	20	IDGD	
CC(C)C[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl	1847564476	XIXZVRNYPIYTJW-UGUYLWEFSA-N	431.961	1.727	50	20	IDGD	
C[C@@H](SCC(=O)Nc1ccc(F)cc1)C(=O)OCC(=O)NNC(=O)c1ccccc1	10472224	PGVWFMQLMHZFRR-CYBMUJFWSA-N	433.461	1.890	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C[C@H](NC(N)=O)c2cccs2)c2ccccc2c1=O	14044401	ZHSGMGYMKHJIOC-ZDUSSCGKSA-N	428.474	1.039	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)c1ccccc1F)C(=O)NNC(=O)c1ccccc1F	15794549	WNKDTTJMALCWBI-HNNXBMFYSA-N	443.497	1.826	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=O)COc2ccccc2OC)ccc1C	15879352	PIAMJECWKVXRHK-UHFFFAOYSA-N	449.529	1.874	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)CNC(=O)c2ccc3c(c2)OCO3)cc1	18071606	MXZUMKXVPKNNAK-CYBMUJFWSA-N	429.429	1.159	50	20	IDGD	
COc1ccc(C(=O)NCC(=O)NNC(=O)c2cc(-c3ccccc3)n[nH]2)cc1[N+](=O)[O-]	25406196	CQVXBMRFGBTEAH-UHFFFAOYSA-N	438.400	1.185	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)c1cc(S(=O)(=O)N2CCCCC2)cn1C	106071719	GBTWMPBCWWDGCP-UHFFFAOYSA-N	449.533	1.081	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)[C@H]1CC(=O)N(c2ccccc2F)C1	726862371	LIDCDBZGESZBFS-ZDUSSCGKSA-N	432.477	1.763	50	20	IDGD	
NC(=O)c1ccc(N2CCN(C(=O)NNC(=O)c3c(Cl)cccc3Cl)CC2)nc1	727847039	PIHXWRYWASHRMQ-UHFFFAOYSA-N	437.287	1.664	50	20	IDGD	
CN(C)N(C(=O)CSc1nnc(-c2cccs2)n1C1CC1)[C@H]1CCS(=O)(=O)C1	728460444	OOIPAOHQKQVNIP-ZDUSSCGKSA-N	441.604	1.926	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)CNC(=O)Cc2cccc(F)c2)c1	728528021	YBVJOCCZKQXJPY-UHFFFAOYSA-N	438.253	1.717	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(Cl)nc1Cl)C1CCN(c2ncccn2)CC1	728854172	ONDQWZZGSLFPFZ-UHFFFAOYSA-N	431.305	1.405	50	20	IDGD	
CCOc1ccc(CNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1OC	728948410	MMPBCJLRPFYFDC-UHFFFAOYSA-N	428.493	1.631	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)N[C@@H](CN1CCCC1)c1ccccc1	728959216	IHKRNWKWUBKCLX-FQEVSTJZSA-N	437.548	1.861	50	20	IDGD	
CCOc1ccc(N2C(=O)c3ccc(C(=O)NNC(=O)Cc4cc[nH]n4)cc3C2=O)cc1	730091798	XGWJYNKYXHRQCS-UHFFFAOYSA-N	433.424	1.613	50	20	IDGD	
COc1ccc(C[C@H](C)NC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])cc1OC	730129908	FFNGHBZUEDOAJU-ZDUSSCGKSA-N	432.433	1.952	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCC(=NNC(=O)c3ccnc(N(C)C)c3)CC2)cc1	731561182	ROLKYUOOEBSLGE-UHFFFAOYSA-N	431.518	1.727	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)N2CCC(CS(N)(=O)=O)CC2)c(C)n1C[C@@H]1CCCO1	732071485	HFWRYWIUZVEFIK-FJZBCQJGSA-N	434.562	1.718	50	20	IDGD	
CC1(C)Cc2ccc(C(=O)OCC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)c(O)c2O1	732337011	LGCWVRCUGYTWQM-UHFFFAOYSA-N	429.385	1.632	50	20	IDGD	
COC(=O)c1cc(OC(=O)CN2C(=O)COc3ccc([N+](=O)[O-])cc32)ccc1[N+](=O)[O-]	732652564	HJQGEZMSEZEOGE-UHFFFAOYSA-N	431.313	1.621	50	20	IDGD	
COc1ccc(N2C[C@H](C(=O)NNC(=O)c3cnn(-c4ccccc4)c3)CC2=O)c(OC)c1	733106967	RJWBRJHPQXOBFW-OAHLLOKOSA-N	449.467	1.704	50	20	IDGD	
C#CCNC(=O)CN1CCCN(C(=O)/C(C#N)=C\c2cc(C)n([C@@H](C)COC)c2C)CC1	733150507	LMCVYJSOZQSPQH-MAGMUUGSSA-N	439.560	1.503	50	20	IDGD	
CC(C)S(=O)(=O)c1ccccc1C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C	734239864	XVVUZRVJXXAJDQ-UHFFFAOYSA-N	428.511	1.337	50	20	IDGD	
CCCn1c(C)cc(/C=C(\C#N)C(=O)N[C@@H]2CC(=O)N(CCN3CCOCC3)C2)c1C	735822633	FYRGBHULZNRNFI-NNVROAHOSA-N	427.549	1.471	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)c2cnc3c(c2)c(C)nn3CCO)cc1C	736806579	GDFOENSWSXXMHV-UHFFFAOYSA-N	445.501	1.282	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)Cc2cccc3ccccc23)nc2c1c(=O)n(C)c(=O)n2C	737487118	KBVAGFYLJIKLQV-UHFFFAOYSA-N	431.452	1.098	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)NCc1cccc(C(=O)N2CCOCC2)c1	738461334	QQHAGSIEPJYVIZ-UHFFFAOYSA-N	426.473	1.206	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCCN1C(=O)c1ccc(O)nn1)c1cc2c(s1)CCCCC2	741746979	MYPJFBVMYZTFDP-OAHLLOKOSA-N	443.529	1.969	50	20	IDGD	
O=C(NNC(=O)c1ccc(-c2cc(F)c(F)c(F)c2)cc1)N[C@H]1CCS(=O)(=O)C1	742054349	DENDLKPJRLGSAR-ZDUSSCGKSA-N	427.404	1.902	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@H](C)C(=O)NNC(=O)CN1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O	742477022	CJRGWMCQLVEEBC-RYECPLHJSA-N	449.891	1.034	50	20	IDGD	
O=C(CN1CCN(c2ccccn2)CC1)NNC(=O)c1cc(F)ccc1Br	743336147	DFDVGVNNHNZCNE-UHFFFAOYSA-N	436.285	1.566	50	20	IDGD	
CC(C)(C)C(=O)NNC(=O)CN1CCC[C@@H](C(=O)Nc2ccc(Br)cn2)C1	744389746	YSSAPYUWZUOMRV-GFCCVEGCSA-N	440.342	1.688	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)N[C@H]2CCCN(c3ccn(C)n3)C2=O)c(C)n1-c1ccccc1	745883937	RBPQAUUAAAMNKB-IBGZPJMESA-N	449.515	1.967	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)N[C@@H]2CC(=O)N([C@@H]3C[C@@H]3c3ccccc3)C2)cc1C	745915233	XTBHTEQHVAEXGS-VAMGGRTRSA-N	449.511	1.729	50	20	IDGD	
C#CCNS(=O)(=O)c1cccc(C(=O)NNc2nc(-c3ccccn3)nc3c2CCC3)c1	747983387	SKAWDDZCGDXFFC-UHFFFAOYSA-N	448.508	1.696	50	20	IDGD	
CC(=O)N1CCN(S(=O)(=O)c2ccc(C(=O)NNc3cccc(C#N)c3)cc2)CC1	748029572	IEYWDLLMAYGMTK-UHFFFAOYSA-N	427.486	1.168	50	20	IDGD	
CC(C)(CNC(=O)NNC(=O)COc1ccccc1Cc1ccccc1)S(C)(=O)=O	748968371	VHIZTNLTBRDUBY-UHFFFAOYSA-N	433.530	1.810	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)NNC(=O)CNC(=O)c2cccs2)c1C	751208511	FQEYMILJTNWNRV-MHWRWJLKSA-N	429.502	1.297	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNS(=O)(=O)c1cc(C)cc(C(=O)O)c1F	753768043	CZMVCAZFMXFKDU-UHFFFAOYSA-N	426.422	1.620	50	20	IDGD	
O=C(Cc1cc[nH]n1)NNC(=O)c1ccc(Cl)cc1NS(=O)(=O)c1ccccc1	755284736	VYLPQXLKKIBZAB-UHFFFAOYSA-N	433.877	1.868	50	20	IDGD	
CCOCC(=O)NNC(=O)Nc1cc(S(=O)(=O)N(CC)CC)ccc1OC(C)C	755433551	BTTJSQAIJWTDLU-UHFFFAOYSA-N	430.527	1.694	50	20	IDGD	
CN1CCN(C(=O)c2ccccc2NC(=O)NNC(=O)COc2ccccc2F)CC1	755622926	KFRDQAPGIHXUSS-UHFFFAOYSA-N	429.452	1.445	50	20	IDGD	
COC(=O)c1nc(Cl)ccc1S(=O)(=O)NNC(=O)c1cnn(-c2ccccc2)c1	755967923	FAVHNQMRKWKFMQ-UHFFFAOYSA-N	435.849	1.331	50	20	IDGD	
COCC[S@](=O)Cc1cccc(NC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1	756613923	RVGYVVYJQKBAMX-JJCDCTGGSA-N	433.486	1.574	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2cc(F)c(F)c(F)c2)cc1	756708679	GIILOEWJLWTQHF-UHFFFAOYSA-N	430.408	1.886	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)c2cncc(I)c2)c1	756922081	CZFCXWGPQRPUJB-UHFFFAOYSA-N	445.238	1.165	50	20	IDGD	
Cc1cc(CNC(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)ncn1	757665569	WQRUEIKEAMGSDH-UHFFFAOYSA-N	443.467	1.687	50	20	IDGD	
Cc1nn([C@H]2CCS(=O)(=O)C2)c(C)c1NC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	757871815	NKIFYFVYYYQNAE-AWEZNQCLSA-N	436.450	1.234	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)nn1-c1ccc(Cl)cc1Cl	757930622	RCVWVKRCOUHHRW-VIFPVBQESA-N	449.320	1.578	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)c1NC(=O)c1ccccc1F	758037120	YJGQXYWXMASTNP-GFCCVEGCSA-N	436.465	1.085	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)c1cc(F)c([N+](=O)[O-])cc1F	763370879	VSWSGESIISPQKP-UHFFFAOYSA-N	433.415	1.846	50	20	IDGD	
O=C(NNC(=O)c1cccnc1)C(=O)Nc1ccc(F)cc1I	763490991	JUKXEZYTMSLACS-UHFFFAOYSA-N	428.161	1.225	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)C(=O)Nc1ccsc1	763511800	HKUHJDNNBVGMBB-UHFFFAOYSA-N	436.515	1.322	50	20	IDGD	
CC[C@@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)cc1	763548502	LZTWUZLMRUEYQO-GFCCVEGCSA-N	426.429	1.343	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNC(=O)COc2cc(C)ccc2C(C)C)cn1C	763596410	HABJYDPHCXWYQJ-UHFFFAOYSA-N	444.488	1.799	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1cccc(-c2n[nH]c(C3CC3)n2)c1	763623817	HYKSQMKWVDSOOR-UHFFFAOYSA-N	444.455	1.705	50	20	IDGD	
COCc1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2Cc2ccccc2)ncn1	763717910	CPYDGVXYPRFPTF-UHFFFAOYSA-N	449.467	1.379	50	20	IDGD	
Cc1cn(-c2ccc(C#N)cn2)nc1NC(=O)C(=O)NNC(=O)c1cc2c(s1)CCC2	763783904	QQVDAMLRHARZME-UHFFFAOYSA-N	435.469	1.397	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)C(=O)Nc1ccc(OC(F)F)c(F)c1	763802308	AKUWWFWMDSXNBR-UHFFFAOYSA-N	442.306	1.500	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccc(C(=O)N2CCCC2)cc1	763849106	HNOADLIMLAWYHF-AWEZNQCLSA-N	442.447	1.615	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc3ccc(F)cc3)cc2)CCO1	763871218	FJROHSVMNFIGTN-LSDHHAIUSA-N	444.463	1.604	50	20	IDGD	
COC(=O)Cc1ccccc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccc(C(C)=O)cc1	763872580	OSIFNMVRGIASRW-CQSZACIVSA-N	441.440	1.158	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccc(-n3nccc3C(F)(F)F)cc2)n1	763885006	IOYHMPRXYDFEAQ-UHFFFAOYSA-N	449.393	1.491	50	20	IDGD	
CC(=O)N(Cc1ccc(NC(=O)C(=O)NNC(=O)Cn2nc(C)cc2C)cc1)C(C)C	763891985	TUZIDDPRROTJFC-UHFFFAOYSA-N	428.493	1.043	50	20	IDGD	
CC[C@@H](C)Sc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)c(C)c1	764001904	GPHOQDVGFRRWGE-OLZOCXBDSA-N	427.548	1.406	50	20	IDGD	
CCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cccc(Br)c2)c(C)c1	764058357	GEOBMMQLWZAQCG-UHFFFAOYSA-N	447.289	1.907	50	20	IDGD	
COc1cccc(-c2cc(NC(=O)C(=O)NNC(=O)[C@H]3Cc4ccccc4O3)n(C)n2)c1	764153057	HVVYGBGAFODXFA-GOSISDBHSA-N	435.440	1.185	50	20	IDGD	
O=C(CCc1ccco1)NNC(=O)C(=O)Nc1cccc(C(=O)NCc2ccccc2)c1	764169599	QHYPXMOASFWAFH-UHFFFAOYSA-N	434.452	1.928	50	20	IDGD	
COCCn1nc(C)c(NC(=O)C(=O)NNC(=O)c2c(Cl)cccc2Cl)c1C	764227114	WGRRVBUBUDKUOW-UHFFFAOYSA-N	428.276	1.853	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F	764281570	YTKBORLDIGAYNA-UHFFFAOYSA-N	438.343	1.621	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)CCN2C(=O)OC(C)(C)C	764297903	ILZCIDWLHWFQCU-UHFFFAOYSA-N	428.449	1.415	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)c2cnn(C)c2)sc(C)c1C[C@H](C)CC	764358418	CXQNEMBCQSBDSF-LLVKDONJSA-N	449.533	1.955	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(N3CCCS3(=O)=O)ccc2Cl)o1	764370319	BBHJNBLDGSGGCR-UHFFFAOYSA-N	440.865	1.181	50	20	IDGD	
CC[C@@H](C)n1nc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3OC)[nH]n2)cc1C	764377961	UFJLXSIUIRSQMO-GFCCVEGCSA-N	439.476	1.961	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cc(C)n(CCC#N)n3)n[nH]2)cc1C	764389136	XMSCNQKXAILGPL-UHFFFAOYSA-N	434.460	1.512	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1ccc(C#N)cc1)C(=O)NNC(=O)C12CC3CC(CC(C3)C1)C2	764535002	XEQBIDWSKCRESZ-KCXBLQSVSA-N	430.530	1.589	50	20	IDGD	
C[C@H](NS(=O)(=O)c1cccc(C#N)c1)C(=O)NNC(=O)c1ccc(Cl)cc1Cl	764574311	QMMNGSMJQNVCSD-JTQLQIEISA-N	441.296	1.993	50	20	IDGD	
O=C(CNC(=O)c1cccc([N+](=O)[O-])c1)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	765615390	GFSCDURSZFAMSE-UHFFFAOYSA-N	426.364	1.315	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3ccnc(OC(C)C)c3)CC2)cc1	765750104	ZRRXBPIYYNLYAR-UHFFFAOYSA-N	425.533	1.756	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1ccc(C(=O)N2CCc3ccccc32)cc1	766260180	AYELEUYWGRBCKI-UHFFFAOYSA-N	432.440	1.770	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)CCC(=O)Nc1ccc2nc(O)[nH]c2n1	767163618	OQQUCWFQTCNPNJ-SNVBAGLBSA-N	430.396	1.136	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2c[nH]nc2-c2c(F)cccc2F)n1	768139003	GQCCMEJRBLLKFF-UHFFFAOYSA-N	435.412	1.667	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)Cn2cc(C(N)=O)c3ccccc32)n[nH]1	768274449	SPSSDLNVOUGUDT-UHFFFAOYSA-N	432.440	1.600	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)c1ccc(CS(=O)(=O)C(F)F)cc1	768645683	SFOSGXLFFOSGPP-UHFFFAOYSA-N	448.469	1.993	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)N[C@H](C)[C@@H]2CN(C)CCO2)cc(OCC)c1OCC	770124828	SSAVTSPQJICCMI-KDOFPFPSSA-N	438.525	1.546	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)N[C@@H]3CCN(c4ccccc4Br)C3)nc21	770394019	DWLXRQGYVKIKCB-SNVBAGLBSA-N	447.297	1.736	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)CSc1nnc(-c2cccs2)n1C	772075304	KNUMJVDOAZQOAX-NSHDSACASA-N	425.536	1.761	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)c1ccc(S[C@@H]2CCOC2=O)cc1	772884036	HNJUQZREIXTDSX-MRXNPFEDSA-N	447.900	1.825	50	20	IDGD	
CS(=O)(=O)CCOc1ccc(Cl)cc1NC(=O)C(=O)NNc1cccc(C#N)c1	773688357	KMMDHHAONSYUCN-UHFFFAOYSA-N	436.877	1.717	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1cc2c(cc1F)NC(=O)CC2	774010215	WIHKFDWJGOZOMH-SNVBAGLBSA-N	448.838	1.917	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)NC[C@@H]2CC[C@H](C(=O)N(C)C)O2)c(C)n1C[C@H]1CCCO1	775213560	VKLNAOOHMQIJRZ-WDHJJCDJSA-N	428.533	1.943	50	20	IDGD	
CS(=O)(=O)N1CCN(c2ccc(NC(=O)NNc3ccc4ccccc4n3)cn2)CC1	775617330	MBLFQKBKVAPBFE-UHFFFAOYSA-N	441.517	1.860	50	20	IDGD	
CN(C)CC(=O)NNC(=O)c1cn(-c2ccc(Br)cc2C(F)(F)F)nn1	776472791	ALGFFNRJGCKIBV-UHFFFAOYSA-N	435.204	1.371	50	20	IDGD	
CCOc1cc(C=NNC(=O)CO)ccc1OCc1cc([N+](=O)[O-])cc2c1OCOC2	776780461	INZLHGXGYAAFSE-UHFFFAOYSA-N	431.401	1.881	50	20	IDGD	
O=C(NN=Cc1cnn(Cc2ccc(C(F)(F)F)cc2)c1)N[C@@H]1CCS(=O)(=O)C1	777433147	WCHPAFWUVPYNIG-OAHLLOKOSA-N	429.424	1.770	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3cc4c(O)ncnc4cn3)n[nH]2)cc1OC	779041758	VLVSZDZWKQRHJT-UHFFFAOYSA-N	435.400	1.213	50	20	IDGD	
Cc1coc2ccc(NC(=O)C(=O)NNC(=O)c3csc(N4CCOCC4)n3)cc12	782897033	LOICUERNNVJNFK-UHFFFAOYSA-N	429.458	1.434	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)C(=O)Nc1cc(C#N)ccc1Cl	782897719	SPUFNXXLTORAFJ-UHFFFAOYSA-N	448.892	1.213	50	20	IDGD	
O=C(NNc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1ccccc1C(=O)N1CCOCC1	783291202	JURYKVCAWUHRPB-UHFFFAOYSA-N	447.835	1.802	50	20	IDGD	
Cn1c(=NNC(=O)C(=O)Nc2ccc(NC(=O)[C@H]3CCCO3)cc2)sc2ccccc21	783349511	KLOCNVZHMTTWPH-MRXNPFEDSA-N	439.497	1.928	50	20	IDGD	
COCCOC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)Nc2ccccc2C)c1	783411068	ODRBVEFTQFWCEJ-UHFFFAOYSA-N	429.433	1.981	50	20	IDGD	
CC(=O)N[C@@H](CC(C)C)C(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	783590669	WZRZSERGLVTKFZ-IBGZPJMESA-N	437.972	1.156	50	20	IDGD	
CN(NC(=O)CCOc1ccc(C(N)=O)cc1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	783705406	YBPVXOORIBLQEO-UHFFFAOYSA-N	449.508	1.190	50	20	IDGD	
Cc1ccnc(NNC(=O)C(=O)Nc2cc(Cl)ccc2OCCS(C)(=O)=O)c1	783929161	NXMACXVZPFNWGO-UHFFFAOYSA-N	426.882	1.549	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N[C@H]2CCCN(Cc3ccccn3)C2=O)cc1OC	784177383	RFOVPZXFOWNECF-INIZCTEOSA-N	427.461	1.234	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNc2nccnc2Cl)c(OCC(F)(F)F)c1	784777741	JGICCIWGRRNWNM-UHFFFAOYSA-N	447.757	1.940	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)F)cc1)C(=O)Nc1cccnc1Br	784835844	KKFYXBWPTRCSNC-UHFFFAOYSA-N	449.233	1.922	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNc2cccc(S(C)(=O)=O)c2)cnn1-c1ccccc1F	784844030	FCKLVDYWGJQJKW-UHFFFAOYSA-N	431.449	1.805	50	20	IDGD	
CCNC(=O)N(C)NC(=O)C(=O)Nc1cc(C)nn1[C@@H]1CCN(Cc2ccccc2)C1	784915928	JWYCIOIFCGCRQZ-QGZVFWFLSA-N	427.509	1.270	50	20	IDGD	
CC(C(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)=C1CN(C(=O)OC(C)(C)C)C1	786980790	PSEPXZFAAHEMAF-UHFFFAOYSA-N	448.432	1.466	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)NCc1ncnn1-c1ccccc1	787350381	QIUUZZPLOXTKSS-UHFFFAOYSA-N	448.531	1.310	50	20	IDGD	
O=C(Cc1cc(O)nc(S)n1)NN=C1C(=O)Nc2ccc(Br)c(Cl)c21	788014917	IGMAHRQRCRTDIV-UHFFFAOYSA-N	442.682	1.902	50	20	IDGD	
COc1ccc(OC)c([C@H]2C[C@H]2C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)c1	788084957	DGINVGMKKZOFHF-GDBMZVCRSA-N	446.529	1.870	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)[C@@H]1CCCCN1S(=O)(=O)c1ccccc1	788175625	WUPABMBNAMKOIG-INIZCTEOSA-N	427.490	1.349	50	20	IDGD	
O=C(NNC(=O)c1cc2ccccc2c(=O)o1)c1ccc(S(=O)(=O)N2CCCC2)cc1	788265181	KUCRVEREPGEDKU-UHFFFAOYSA-N	441.465	1.652	50	20	IDGD	
CCc1nn(C)c(CC)c1CC(=O)NNC(=O)c1cccc(S(=O)(=O)N(CC)CC)c1	790104901	XYKIMJCIJLSZHI-UHFFFAOYSA-N	449.577	1.579	50	20	IDGD	
O=C(CCCNS(=O)(=O)c1cccc(C(F)(F)F)c1)NNc1nc2ccccn2n1	791259814	CQEXXONDYXDZPF-UHFFFAOYSA-N	442.423	1.950	50	20	IDGD	
CC[C@@H](C)n1ncc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)c1C	792282845	WXEPBRZZWZOUQU-GFCCVEGCSA-N	437.526	1.326	50	20	IDGD	
CCNC(=O)N(C)NC(=O)C(=O)Nc1ccc(OC(F)(F)F)c(Br)c1	792361397	KTMCWDRZUYEVMR-UHFFFAOYSA-N	427.177	1.979	50	20	IDGD	
CNS(=O)(=O)c1ccc(NC(=O)NNC(=O)COc2cccc(C(F)(F)F)c2)nc1	792393030	IKWXGPCYYLGOGV-UHFFFAOYSA-N	447.395	1.240	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNC(=O)NCc1nc(-c2ccc(F)cc2)n[nH]1	793030131	YPTJEBPXDYMSAL-UHFFFAOYSA-N	441.423	1.368	50	20	IDGD	
C[C@@]1(C(=O)NNC(=O)COc2ccccc2O)CCN(C(=O)OCc2ccccc2)C1	793458845	KQEIKJBCNKDBTD-JOCHJYFZSA-N	427.457	1.967	50	20	IDGD	
COc1ccc(N2C[C@@H](C(=O)NNc3ccccc3S(=O)(=O)N(C)C)CC2=O)cc1	795161927	TULGDMOWYJACGP-AWEZNQCLSA-N	432.502	1.442	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNS(=O)(=O)c2csc3ccccc23)ccc1Cl	795282260	DJRMMCAFTCNRCX-UHFFFAOYSA-N	445.931	1.825	50	20	IDGD	
CNC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)c(C)c1	796990411	RTAVXIANAMKBBI-UHFFFAOYSA-N	442.516	1.422	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)Nc1cccc2c1CCO2	797670960	BFMXPJPYUGXENY-UHFFFAOYSA-N	446.485	1.109	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)NCCN(C)S(=O)(=O)c1ccc(F)cc1	798047981	ABGFKMUBAMQGCG-UHFFFAOYSA-N	448.480	1.047	50	20	IDGD	
CCCCNS(=O)(=O)c1ccc(C)c(NC(=O)C(=O)NNC(=O)OC(C)(C)C)c1	799835294	OVOWLSDRHSWCON-UHFFFAOYSA-N	428.511	1.568	50	20	IDGD	
O=C(CCNS(=O)(=O)c1cccnc1)NNc1cc([N+](=O)[O-])ccc1Br	800616401	LBBADTUHEOWVMX-UHFFFAOYSA-N	444.267	1.564	50	20	IDGD	
C[C@H](Sc1ccccc1C(=O)OCC(=O)NNC(=O)c1cccc(C#N)c1)C(N)=O	801487075	MGHRGMQOSAQJAG-LBPRGKRZSA-N	426.454	1.142	50	20	IDGD	
CC(C)(C)[C@H]1CCc2sc(C(=O)NNC(=O)NC3CC(NS(C)(=O)=O)C3)cc2C1	802418700	PHJKBIPMIXRIHO-HSBZDZAISA-N	442.607	1.923	50	20	IDGD	
O=C(NNC(=O)N1CCOCC1)c1cccc(S(=O)(=O)Nc2cccc(Cl)c2)c1	804031196	VUSMFOSZXHMDGW-UHFFFAOYSA-N	438.893	1.827	50	20	IDGD	
O=C(NNc1ncccc1F)C(=O)Nc1ccc(S(=O)(=O)NC2=NCCCCC2)cc1	807300145	AVPWAFSXTGTXRF-UHFFFAOYSA-N	448.480	1.553	50	20	IDGD	
O=C(NNc1cccc(F)n1)C(=O)Nc1c(C(=O)N2CCOCC2)oc2ccccc12	807392990	REWLUCHHWOYHHM-UHFFFAOYSA-N	427.392	1.521	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2ccc(-n3cccn3)nn2)nn1-c1ccc(F)cc1F	808938499	XESYPKYAENGOHB-UHFFFAOYSA-N	439.386	1.516	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)[C@H](c2ccccc2F)N2CCOCC2)cc1	812731515	KHVYDVFIDBVJAO-IBGZPJMESA-N	436.509	1.593	50	20	IDGD	
Cc1nn(C)c2cc(NC(=O)C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)ccc12	812980519	SRTSNIGGUSDGJM-UHFFFAOYSA-N	432.481	1.273	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2cnn(-c3ccccc3)c2)cc1	813033354	PCHFJNFMYXXKDZ-UHFFFAOYSA-N	428.474	1.204	50	20	IDGD	
Cc1c(S(=O)(=O)NC(=O)/C(C#N)=C/c2cc(C)n(C[C@@H]3CCCO3)c2C)cnn1C	813956536	OZMMJSZPWPLURH-GONKEYIRSA-N	431.518	1.738	50	20	IDGD	
CN(C)c1cc(F)c(C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)cc1[N+](=O)[O-]	814485099	WGTLDWUOWJUMNZ-UHFFFAOYSA-N	429.364	1.290	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	815269554	UMXZJAYEYWWIFU-UHFFFAOYSA-N	439.472	1.051	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1ccc(F)cc1OCC#N	815751641	IBEVEHASDSNIHY-UHFFFAOYSA-N	435.437	1.060	50	20	IDGD	
Cc1ccc2nc(C(=O)NNC(=O)CN3CCN(C(=O)c4ccccc4)CC3)ccc2c1	815827281	SMAOHMVFUIXGAJ-UHFFFAOYSA-N	431.496	1.762	50	20	IDGD	
Cn1nncc1NNC(=O)CCNS(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1	816769163	WPICZANQGGNDKX-UHFFFAOYSA-N	426.808	1.299	50	20	IDGD	
CC(=O)N1CCN(S(=O)(=O)c2ccc(C(=O)NNc3cccc(Cl)n3)cc2)CC1	817009762	YLEUHYZINGNVRL-UHFFFAOYSA-N	437.909	1.345	50	20	IDGD	
CCCS(=O)(=O)Nc1cccc(C(=O)NNc2ccccc2S(=O)(=O)N(C)C)c1	817054641	RGCSDLWBXFOGTR-UHFFFAOYSA-N	440.547	1.846	50	20	IDGD	
CCOC(=O)c1ccc(C#N)c(SCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)n1	818135188	MTVKXQSZEDLJEP-UHFFFAOYSA-N	429.414	1.591	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNC(=O)CNS(=O)(=O)c2ccccc2F)cc1	913524782	IORDGNLBNFRAHR-UHFFFAOYSA-N	437.493	1.990	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)NCc1nnc2n1CCCCC2	914531412	PQOQSMLGQRVEGM-UHFFFAOYSA-N	437.298	1.676	50	20	IDGD	
COc1cc(/C=C(/C#N)C(=O)Nc2ccc(S(N)(=O)=O)cc2)ccc1OCC(=O)O	915849268	KGADYHNVGSIDCA-JYRVWZFOSA-N	431.426	1.352	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)NC[C@H]2CN(Cc3ccccc3)CCO2)cc1C	915895208	WUHJHUAFDDGVCN-FQEVSTJZSA-N	439.516	1.473	50	20	IDGD	
O=C(Cn1nnc(-c2ccccc2)n1)NN=Cc1ccccc1OCC(=O)N1CCCC1	915907037	LMHCVVRTOFOXMI-UHFFFAOYSA-N	433.472	1.492	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NC[C@@H](c2cccc(C)c2)N2CCOCC2)cc1	916435609	IIOAMZOZVRUXBO-NRFANRHFSA-N	442.516	1.786	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)c1[nH]c2ccc(Br)cc2c1Cl	918208717	IPMDIJBNGYJDNN-ZETCQYMHSA-N	434.699	1.780	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)CSCCOc2ccc(S(N)(=O)=O)cc2)cc1	918548634	HRHUKZLZBVNDBM-UHFFFAOYSA-N	437.543	1.470	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C2CCN(S(=O)(=O)c3ccccc3)CC2)cc1	919834343	YEAAAXIHSAQTKS-UHFFFAOYSA-N	445.541	1.876	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)[C@@H]2CCCN2C(=O)/C=C/c2ccc(C(N)=O)cc2)c(O)c1	920037427	PAUWOSQZDCPYKC-DBEXCURXSA-N	436.468	1.265	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)NC[C@@H](c2cccc(F)c2)N2CCOCC2)c1	921199335	HRDVXDBBKHVPSI-FQEVSTJZSA-N	429.496	1.909	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)c2cc(S(C)(=O)=O)ccc2Cl)c2ccccc2c1=O	933567932	ADDKIWIQBCIHTO-UHFFFAOYSA-N	434.861	1.065	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1S(C)(=O)=O	1116083545	ABPAWNFEKFQUHJ-UHFFFAOYSA-N	439.534	1.807	50	20	IDGD	
C[C@H](NC(=O)c1ccc(Br)s1)C(=O)NNC(=O)c1n[nH]c2c1CCCC2	1317890090	RHQJFDMQZQQJBH-QMMMGPOBSA-N	440.323	1.692	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NCc1cccc(CN2CCN(C)CC2)c1	1318284670	YXPFEYYNJISHEL-KRWDZBQOSA-N	443.523	1.871	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)c2nc(C3CC3)n(-c3ccccc3)n2)c1	1321414068	DKIQYFSOJZFIRU-UHFFFAOYSA-N	425.470	1.623	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)NCCCOCC2CCOCC2)CC1	1322034658	RCJNWJQNZGCBRJ-UHFFFAOYSA-N	442.557	1.797	50	20	IDGD	
C[C@@H](Nc1nccs1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2	1778066941	IYJNALQSNCEIAW-UHQDVWGKSA-N	430.958	1.057	50	20	IDGD	
CC(C)N1CCC(C(=O)N2CCO[C@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)CC1	1779294748	YASTYDRZCSEDNT-NRFANRHFSA-N	425.646	1.788	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cn3c(F)cccc3n1)CCO2	1779299560	XEZGYNMAKJHZTJ-FQEVSTJZSA-N	434.544	1.768	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(-n4cccn4)nc3)C2)C1	1779690359	YIBRHHGYJFWRFJ-OAQYLSRUSA-N	443.580	1.562	50	20	IDGD	
COc1cc(OC)cc(C(=O)N2CC[C@@]3(CN(C(=O)CCBr)CCO3)C2)c1	1780657175	MZAFWESKKDWNCS-LJQANCHMSA-N	441.322	1.932	50	20	IDGD	
C[C@H](Oc1cccnc1)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781335517	UIPAYIROHQJBQS-JDFRZJQESA-N	430.274	1.369	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(F)ccc3Cl)C2)C1	1781690173	UWURJZTWHHPFCN-FQEVSTJZSA-N	440.903	1.296	50	20	IDGD	
CCCCC[C@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2	1781817621	KYJBPMXQXDMEMZ-SNYIIPAISA-N	444.381	1.710	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cn1cccn1)C2	1781899855	ATJNYFCXJRRVDM-HDMKZQKVSA-N	427.343	1.571	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CC2(O)CCC2)C1	1782779105	OHGHJLUIZCFWMA-IIDMSEBBSA-N	431.371	1.836	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](O)Cc3ccccc3)C2)C1	1783344144	PJDJAMSUZFGSHX-ABSDTBQOSA-N	439.350	1.593	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccnn3CCOC)CCO2)C1	1783347291	FNYFQNSJXJGLBG-RDTXWAMCSA-N	443.342	1.147	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(OC)ccn3)CCO2)C1	1783349898	VMQBRGANOZAWMG-KSSFIOAISA-N	426.311	1.707	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)Cc3ccccc3O)CCO2)C1	1783354836	GFBSQCPFTKCJPP-KXBFYZLASA-N	425.323	1.938	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(OC(F)F)cc3)CCO2)C1	1783880941	NSIVZFOHVGDWBX-BEFAXECRSA-N	432.851	1.985	50	20	IDGD	
O=C(C(Cl)Cl)N1CC[C@@]2(C1)CN(C(=O)[C@@H]1ON=C(c3ccccc3)O1)CCO2	1783946116	IMTBQGCQDGCCJW-ZWKOTPCHSA-N	428.272	1.355	50	20	IDGD	
O=C(C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]2C1)c1ccc(Cl)cc1	1784084198	NRORCRUEEGCQET-TUUVXOQKSA-N	429.300	1.102	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3csc4c3CCCO4)C[C@@H]21)[C@H](O)CCl	1784090224	UTEAKLGAQNXCAI-YUDUHTQSSA-N	428.938	1.266	50	20	IDGD	
Cc1nc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]3C2)c(C(F)(F)F)o1	1784090427	GBMTYHSDMJESPS-BJDJZHNGSA-N	439.818	1.195	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3noc(C)n3)[C@H]2C1	1785276870	WXQOBGKHLLNFKO-XUXIUFHCSA-N	429.315	1.074	50	20	IDGD	
O=C(CC[C@@H]1CNc2ccccc2C1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21	1786901183	RQEXIJYKGJZUQB-OMBLBEMTSA-N	449.979	1.630	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ncn(-c4ccccc4)n3)[C@H]2C1	1787585077	NWYHAYRUEWCKRU-DKIMLUQUSA-N	431.924	1.878	50	20	IDGD	
O=C(CCc1cncnc1)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1	1788143666	LBVDMNUQEXQZHD-UHFFFAOYSA-N	444.300	1.537	50	20	IDGD	
CCc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Br)C[C@@H]32)n(C)n1	1788946149	YEAUYBLUMCGUAR-HQRZJTNHSA-N	431.306	1.266	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1(c2ccc(NC(=O)C3=NNC(=O)C3)cc2)CCC1	1789476623	GLZVMRCVBWJZOT-LGJNPRDNSA-N	449.471	1.130	50	20	IDGD	
COc1cc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Cl)C[C@@H]32)ccc1[N+](=O)[O-]	1789848694	FNPFPXZLDFACKY-RASHJEQFSA-N	443.859	1.660	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21)c1cnc2ccc(F)cn12	1790474492	LXTVQFQKCQDRRD-JKOKRWQUSA-N	429.279	1.870	50	20	IDGD	
C[C@H](Cc1ccc(F)cc1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21	1790722417	BMXZPIKHXWKOCA-CRWDZZMISA-N	426.916	1.584	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccn(C)c3=O)C[C@@H]21	1790958222	MRMIKIUWNNNUJW-HNKHHVNMSA-N	440.338	1.152	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CSc3nc[nH]n3)C[C@@H]21	1790963270	BAEQGDHMHPEHTP-CYDGBPFRSA-N	446.371	1.050	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nccc4nc[nH]c34)C[C@@H]21	1791057705	OIYQEGAMAYXGMR-MNXVOIDGSA-N	436.310	1.335	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc4ccnn34)C[C@@H]21	1791061577	XAPSNHHMCCLYOO-RMRKRWHISA-N	435.322	1.711	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc4c3OCCO4)C[C@@H]21	1791253496	BWEIRSXOLALHGA-MBGYTDRXSA-N	438.908	1.305	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]2C1	1791298149	DRVLZYGDMPXFNC-RMEBNNNOSA-N	433.332	1.525	50	20	IDGD	
COC(=O)[C@@H]1CC[C@@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)CBr)C3)C1	1792967104	XSDGJJUMUMKDMK-SDSMMKDESA-N	445.354	1.196	50	20	IDGD	
O=C(CCBr)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1(c2ccc(O)cc2)CC1	1793025499	KZYIACYBIDRFPS-ZSBFGKGUSA-N	437.334	1.798	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CC=CC[C@@H]1C(=O)OC)C2	1793452598	CMLXOUFZHDGZKI-BQULAQKPSA-N	426.941	1.739	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ncc(F)cc1F	1793578942	RUMGBTPKDRLLMT-QPPBUOOMSA-N	432.265	1.737	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](Br)Cc1ccccc1)C2)c1ncc[nH]1	1794503425	YKYWJCTUGKZLTO-YVSFHVDLSA-N	447.333	1.619	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(C)(C)NCCC#N	1795601231	WJNVBSDQGLQMCU-LXTVHRRPSA-N	429.359	1.031	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2)c1cc(-c2ccco2)no1	1796125204	VZSRSQIPYNJRQO-DPIQGUFMSA-N	438.278	1.923	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)c1c(F)cccc1Cl	1796188417	CAOQYRHBKQKCGG-MUJYYYPQSA-N	430.672	1.725	50	20	IDGD	
COc1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)ccc1F	1796192636	OJBZAZZKDAUNIA-BCDXTJNWSA-N	426.253	1.080	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(C(F)F)no1	1796359803	PXCPEFJUWVFNAK-AIUQWGENSA-N	448.430	1.998	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(-n2cccn2)nc1	1798210230	WKJYUPHGPJCVMB-ZMMAXQRCSA-N	431.924	1.878	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc(Cl)c1)C2	1798441785	KJNFUJFMBVPKNU-MUJYYYPQSA-N	427.892	1.904	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccn(-c2ccccc2)n1	1798698651	RBQKSUSBWSCURG-AFIMGQEJSA-N	447.333	1.859	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1c(C)n[nH]c1C)C2	1800642497	LMPPSXGKADYAJP-YXPYIKCWSA-N	427.343	1.332	50	20	IDGD	
O=C(CCNC(=O)c1ccccc1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2	1801954676	MBJNIRCXBAKGDF-MIFYACCESA-N	428.316	1.200	50	20	IDGD	
C[C@H]1[C@@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Cl)C3)CCN1C(=O)OC(C)(C)C	1802250006	YHVAVXCJFVDUNU-KXKVQDCLSA-N	447.935	1.756	50	20	IDGD	
C=C1C[C@@H](C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](O)CCl)C3)N(C(=O)OC(C)(C)C)C1	1802505423	UBMZNHZHGPTRQK-BQJWPVKWSA-N	441.956	1.790	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2nccc3[nH]ccc23)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803139244	MTOLNBKEQRRZMA-UCLAIMLFSA-N	427.892	1.877	50	20	IDGD	
COC[C@H](C)C(=O)N1CCCC2(CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CC2)C1	1806142457	DNLKOZFXRNVZAE-FWGBXFHKSA-N	431.537	1.634	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)C(F)F)[C@H]1c1cccnc1	1806431446	JUUGJPZKNVQKQB-JBVPVUGKSA-N	432.431	1.487	50	20	IDGD	
CC(C)=CCCC(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1807367147	QOVMZVOXDXIPJW-REWPJTCUSA-N	435.333	1.827	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)Cn2cc(Cl)cn2)[C@H]1c1cccnc1	1807414083	PWGDXXLTDCWLAA-UWWQBHOKSA-N	440.331	1.891	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cc(CO)on2)[C@H]1c1cccnc1)[C@@H](F)Br	1808675445	ABHCRNIQCYHDPS-TUKIKUTGSA-N	441.257	1.572	50	20	IDGD	
Cc1cnc2c(C(=O)NC[C@@H]3CCN(C(=O)[C@@H](O)CCl)[C@H]3c3cccnc3)cnn2c1	1809830182	AZFUWZPCARVPNI-SZMVWBNQSA-N	442.907	1.352	50	20	IDGD	
C=CCNC(=O)/C=C\C(=O)N1CC[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]1c1cccnc1	1810537557	KZLMDTBXPVAAJG-IYOIXKLHSA-N	444.608	1.797	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2c(O)cc(O)cc2O)[C@H]1c1cccnc1	1811433532	MKTMZAJRKLAPOA-FRIZHTMISA-N	449.891	1.772	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H](CNC(=O)Cn2ccncc2=O)[C@@H]1c1cccnc1	1812339810	LPLXWRBYRHVHBY-APWZRJJASA-N	431.924	1.609	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)o1	1813067704	BMKQZCKDKNRPQV-LAUBAEHRSA-N	427.505	1.676	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@H]1CCc2nc(NC(=O)CS(C)(=O)=O)sc2C1	1814314723	JAJPZITZCKJGCK-IUCAKERBSA-N	438.369	1.131	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)Cc2cscn2)[nH]n1)c1ccc(B(O)O)cc1	1817471713	YCWCOEQRJRQWDW-QGZVFWFLSA-N	439.306	1.095	50	20	IDGD	
O=C(CS(=O)(=O)N1CCCC1)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](F)Cl)[nH]n1	1818108678	QFPXOISZQOOKLK-IUODEOHRSA-N	435.909	1.362	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H]1CC1(F)F)CC2	1819797334	SQHRBSSAMPWZPX-LDYMZIIASA-N	436.444	1.023	50	20	IDGD	
O=C(CN1CCOCC1)N[C@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1	1823002253	BZFYGLMEDILFFK-ZANVPECISA-N	435.319	1.078	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCC([C@@H]2CCCCN2C(=O)C(O)O)CC1	1824026972	AWHBIEFXEXSMAV-SKTWIKFTSA-N	433.455	1.802	50	20	IDGD	
COC(=O)c1ccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)[C@H](O)CCl)CC2)cn1	1824182516	FFYNRVCEIYLAIR-QZTJIDSGSA-N	437.924	1.701	50	20	IDGD	
O=C1OCCN1CC(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H](F)Br)CC1	1824333227	ANWSKDHSSCARMG-DZGCQCFKSA-N	434.306	1.749	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)Cn1cc([N+](=O)[O-])cn1)CC2	1825993015	DACLOTWSAQVOND-GXSJLCMTSA-N	442.885	1.114	50	20	IDGD	
CCOc1cnc(C(=O)N[C@@H]2CCc3nc(NC(=O)[C@H](Cl)COC)sc3C2)cn1	1825993543	JTWXZJQVWULCGG-GHMZBOCLSA-N	439.925	1.811	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)Cn1nc(C)cc1C)CC2	1825994719	YHCSMUCKKVNSGP-CHWSQXEVSA-N	425.942	1.822	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](C)S)sc2C1	1826017268	FQZXBUVOPZCKFR-GAKXBQIDSA-N	434.547	1.507	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(C3CC3)on1)CC2	1826083722	QCRXBOFGRTWHAK-GFCCVEGCSA-N	446.533	1.607	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CN2CCNC2=N)CC1	1826874392	NPBBDZINPGAUKF-HNAYVOBHSA-N	432.396	1.682	50	20	IDGD	
O=C([C@H](F)Br)N1CCC([C@H]2CCCCN2C(=O)c2cnc(O)nc2O)CC1	1827590771	SIERAMRINWBZMU-OLZOCXBDSA-N	445.289	1.812	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)C(=O)Nc2cccnc2)CC1	1829045308	UOSVZXLETSXVNU-MSOLQXFVSA-N	436.940	1.894	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H]3CCCCN3C)CCO2)C1	1830775301	LPHKCQCUCYBQNY-GJYPPUQNSA-N	446.386	1.101	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)n1ccnc1)CCO2	1830985819	RUJKACVRVKHHPN-RVKKMQEKSA-N	443.342	1.074	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnn(C)c3Cl)C2)C1	1831654974	PFSVULWDVTVGLO-KDOFPFPSSA-N	433.336	1.551	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)Oc3cccnc3)C2)C1	1831657845	BREYDIBDIBRJGR-MDKPJZGXSA-N	439.940	1.713	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)/C=C/c3ccsc3)CCO2)C1	1833142817	QJIOZMFXJBDWLY-CUKLOCQMSA-N	428.938	1.472	50	20	IDGD	
COc1ccc(C(=O)N2CCC(N3CCC(NC(=O)[C@H](O)CCl)CC3)CC2)cc1F	1833306715	ZKPLIUZPUPEFHY-GOSISDBHSA-N	441.931	1.619	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)c3cnco3)CC2)CC1	1833594682	XUSFVTLVBLEMHZ-CYBMUJFWSA-N	427.343	1.891	50	20	IDGD	
Cc1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@](C)(Cl)CCl)C3)C2)n1	1834050522	DMWKJCIFJPWHMC-MOPGFXCFSA-N	430.332	1.696	50	20	IDGD	
Cc1noc(C)c1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)CBr)C2)C1	1834061924	AOZIUELHFWKHEC-XIKOKIGWSA-N	444.326	1.392	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)[C@H]3CCC(=O)N3)CC2)CC1	1834588890	OCSZNDSAGZLYHL-HZPDHXFCSA-N	443.386	1.010	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)c3ccc(Cl)nc3)C2)C1	1834820065	LTVHNRQBVXAYFA-QGZVFWFLSA-N	446.729	1.590	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCN3CCCCC3)CCO2)C1	1835128839	ONUFFDTZJGSDEY-RXVVDRJESA-N	429.989	1.726	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC1CCN(C2CCN(C(=O)c3ccncc3O)CC2)CC1	1835837126	XTPBYLYPWYXZAT-UHFFFAOYSA-N	434.613	1.824	50	20	IDGD	
Cc1cnn(CC(=O)N2CCC(N3CCC(NC(=O)CO[Si](C)(C)C)CC3)CC2)c1	1835837204	BFLKLBMOBHXWFE-UHFFFAOYSA-N	435.645	1.615	50	20	IDGD	
CCc1[nH]nc(C(=O)N2CCC(OC3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)c1F	1836715309	PGCYAQQNNFKHHM-HNNXBMFYSA-N	430.908	1.323	50	20	IDGD	
Cc1ccc(C(=O)N2CCC(OC3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)c(O)n1	1836717810	CWFWFYHDGYMICD-KRWDZBQOSA-N	425.913	1.308	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)N1C[C@H]3C[C@H]3C1)CCO2	1837279730	RKSOKJDLCDEVMR-YXZMJPADSA-N	427.973	1.191	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)CS[C@@H]3CCCCO3)CCO2)C1	1837501245	IHMGAWLPFOQJMD-YLJYHZDGSA-N	449.013	1.968	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cnn(C)c3C)CC2)CC1	1837544963	MTNGIBCCONVAJL-GOSISDBHSA-N	426.945	1.595	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(Cl)o3)C2)C1	1837713157	KBVDJQJHPMGYEH-SFHVURJKSA-N	430.961	1.855	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccn4ccnc4c3)C2)C1	1837713297	URDYCLYMYJVFMF-OAQYLSRUSA-N	446.580	1.256	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)Cn3cc(C)cn3)CC2)CC1	1837980763	IFHGWJIFCLYDKO-GOSISDBHSA-N	426.945	1.444	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4c(c3)CC(=O)N4)C2)C1	1839146459	ZHNSVGCEEGFRBQ-IIBYNOLFSA-N	435.908	1.269	50	20	IDGD	
C=C[C@H](O)C(C)(C)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2	1839153979	XGYHEPURMNYFKW-JVPBZIDWSA-N	437.364	1.252	50	20	IDGD	
CC(C)N1CCC[C@H]1C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](C)Br)CCO2)C1	1840036112	FONCARCNMKXDSV-TXPKVOOTSA-N	446.386	1.099	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CCN3CCCC3)CCO2)C1	1840940950	NEHDWJWJRFRPFO-APWZRJJASA-N	446.386	1.102	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@H](C(=O)N2CC3(CCCN3C(=O)[C@@H](O)CCl)C2)C[C@@H](F)C1	1841351621	WEKZVZUULZHQGX-ZNMIVQPWSA-N	447.935	1.385	50	20	IDGD	
C=CCC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1	1841352982	XOGVEUMZCUUFAY-HUUCEWRRSA-N	429.945	1.649	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)Cc2noc(C(C)C)n2)C1	1841996564	BORNGJZAKYMNOK-ZVHZXABRSA-N	441.492	1.073	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)c1ccncn1)C2	1844692475	AHHTYIXYAGHWGX-UHFFFAOYSA-N	425.401	1.441	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)c2cc(C)[nH]n2)C1	1844769166	COVMCLUJNULVQX-UHFFFAOYSA-N	427.417	1.682	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H](CC(=O)N2CCCC23CN(C(=O)[C@@H](O)CCl)C3)C1	1846471800	MYVVURHDDYTPOA-GJZGRUSLSA-N	429.945	1.437	50	20	IDGD	
CC(C)Oc1ccc(C(=O)N2CCCC23CN(C(=O)c2ccc(B(O)O)cc2)C3)cc1C#N	1846878540	YGPGQGWRMZZIJN-UHFFFAOYSA-N	447.300	1.156	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CCNC(=O)c1ccc[nH]1	1847495948	QFPLAWVJAPJJNJ-SNPRPXQTSA-N	425.327	1.367	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCCC(=O)NNC(=O)c2cc(Cl)ccc2O)cc1C	10600697	NBCBWCRQHHJOBU-UHFFFAOYSA-N	425.894	1.792	50	20	IDGD	
CCOc1cc(C(=O)OCC(=O)NNC(=O)c2ccc(C)cc2)c([N+](=O)[O-])cc1OC	19473230	RBQMCSOHKOYZNA-UHFFFAOYSA-N	431.401	1.929	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2ccc(C(=O)OCC)c(C)n2)c2ccccc2c1=O	106060927	PMLADKGYJYENMD-UHFFFAOYSA-N	437.456	1.761	50	20	IDGD	
Cc1nn(-c2ccccc2)c2sc(C(=O)NNC(=O)CCN3C(=O)CCC3=O)cc12	725905287	PINJDHXKTHGAMQ-UHFFFAOYSA-N	425.470	1.696	50	20	IDGD	
CCN(CCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(CC)CC)c1)C1CC1	726281535	XOXQMORICWRUBK-UHFFFAOYSA-N	425.555	1.145	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCCc2cnn(C)c2)c1	726851642	SXNNUGIFQWUWSU-UHFFFAOYSA-N	436.538	1.027	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)NCCc2ccc(I)s2)n1	727034835	UUZCDYCXYHYUSF-UHFFFAOYSA-N	447.302	1.739	50	20	IDGD	
NC(=O)c1ccc(/C=C/C(=O)N2CCC[C@@H]2C(=O)NNC(=O)CCCc2ccccc2)cc1	727715507	RANLPHSMTMEKKJ-RDOKFVIMSA-N	448.523	1.960	50	20	IDGD	
Cc1nc2ccnn2c(C)c1CCC(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	728210995	CPUANTCCVARNSH-UHFFFAOYSA-N	428.518	1.863	50	20	IDGD	
C[C@]1(C2CC2)NC(=O)N(CC(=O)NNC(=O)c2cc(F)ccc2Br)C1=O	728548549	IITZHZNVWWBMAT-MRXNPFEDSA-N	427.230	1.070	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2ccc(S(=O)(=O)C(C)C)cc2)n1	728727287	BCICIOOKXMIFSK-UHFFFAOYSA-N	439.515	1.181	50	20	IDGD	
CN1CCC(CCNC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)CC1	728751914	FKVDLBLZLSIRHM-UHFFFAOYSA-N	437.566	1.147	50	20	IDGD	
COc1cc(CCC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc(OC)c1OC	728845996	TTZHMKCDBCKQOB-UHFFFAOYSA-N	443.504	1.499	50	20	IDGD	
N#Cc1cccc(C(=O)NNS(=O)(=O)c2ccc(C(=O)NCC(F)(F)F)cc2)c1	728853672	YURBZZXSYFKGBB-UHFFFAOYSA-N	426.376	1.474	50	20	IDGD	
O=C(COC(=O)[C@@H]1CC(=O)N(c2ccc(F)cc2)C1)NNC(=O)c1ccc([N+](=O)[O-])cc1	730369164	JNFRWGZPRWGFEJ-CYBMUJFWSA-N	444.375	1.091	50	20	IDGD	
COC(=O)[C@H](NCC(=O)NNC(=O)c1cc(Cl)ccc1OC)c1ccc(OC)cc1	731032034	BWJKVUPELBJQAB-GOSISDBHSA-N	435.864	1.622	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NC[C@@H](C)N(C)Cc1ccccc1	732236086	NZZXRAQDKIVAMG-OAHLLOKOSA-N	446.577	1.753	50	20	IDGD	
Cc1ccc(C(=O)N2CCC[C@H](C(=O)NNC(=O)CCN3C[C@@H](C)O[C@H](C)C3)C2)cc1	732261705	OPWCAZNCGWMCQP-GGPKGHCWSA-N	430.549	1.494	50	20	IDGD	
CCN(C(=O)CCC(=O)C(C#N)=C1N(C)c2ccccc2N1C)[C@@H](C)CS(C)(=O)=O	732976519	QUPZJBWQTPCYPZ-HNNXBMFYSA-N	432.546	1.939	50	20	IDGD	
CCn1c(=O)c2ccccc2n(CC(=O)NNC(=O)NCc2ccc(Cl)cc2)c1=O	733003289	GBCRXKUJPAGXMN-UHFFFAOYSA-N	429.864	1.367	50	20	IDGD	
CNS(=O)(=O)c1ccc(CCC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1	733110208	RTGWLKKEVSOIJM-UHFFFAOYSA-N	427.486	1.174	50	20	IDGD	
COCCNC(=O)CSc1ccccc1C(=O)NNc1nc2ccccc2c(=O)n1C	733261100	KDSHTQYASGRNTH-UHFFFAOYSA-N	441.513	1.545	50	20	IDGD	
Cc1cccc(-n2c(NNC(=O)CN(C)S(C)(=O)=O)nc3ccccc3c2=O)c1C	733264728	RSLWYAYUIZQUGA-UHFFFAOYSA-N	429.502	1.337	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)[C@H]1CCCCN1C(=O)OC(C)(C)C	734240280	MPSVYPWRHCHACS-CYBMUJFWSA-N	429.518	1.631	50	20	IDGD	
Cc1cccc(N2C[C@H](C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)CC2=O)c1C	734240930	WTTCOZHLPDTRDR-OAHLLOKOSA-N	433.509	1.511	50	20	IDGD	
COc1ccc(CN2CC[C@@H](NC(=O)NNC(=O)[C@H](C)Oc3ccc(F)cc3)C2=O)cc1	734682489	AZENGMNGRORFLS-IFXJQAMLSA-N	444.463	1.733	50	20	IDGD	
C[C@H](Sc1nncn1C)C(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	734825417	FJTNOHKXCCYDHO-NSHDSACASA-N	427.531	1.026	50	20	IDGD	
CC(=O)NC[C@H]1CN(C(=O)/C(C#N)=C\c2cn(CCC#N)nc2-c2ccccc2)CCO1	735476866	UNNXMKXPCRJKNV-JCAJYURWSA-N	432.484	1.734	50	20	IDGD	
CCc1ccccc1O[C@@H](C)C(=O)N1CCN([C@H](C)C(=O)NNC(=O)CC(C)C)CC1	736622803	CMOWULRMBVYUTG-MSOLQXFVSA-N	432.565	1.743	50	20	IDGD	
Cc1nc(-c2cccnc2)nc(NNC(=O)CNC(=O)c2c[nH]c3ccccc3c2=O)c1C	736696938	PBBLWKOWMWZSMU-UHFFFAOYSA-N	443.467	1.870	50	20	IDGD	
CCCn1c(CCC(=O)NNc2cc(C)nc(C)n2)nc2cc(S(N)(=O)=O)ccc21	736719225	YNEFGBBLMOSCMP-UHFFFAOYSA-N	431.522	1.576	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)CCn2cnc3sccc3c2=O)cc1C	736753627	PISSWJFOFQLTDQ-UHFFFAOYSA-N	448.526	1.785	50	20	IDGD	
Cc1cccc(NC(=O)N2CCN(CC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)CC2)c1	738309290	LTBNPDNOQCJKGZ-UHFFFAOYSA-N	440.460	1.514	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H]1C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	739552937	XSQBPTHSKIVCES-JKSUJKDBSA-N	432.525	1.534	50	20	IDGD	
C[C@@H](CC(=O)NNC(=O)C12CC3CC(CC(C3)C1)C2)/N=C1/NS(=O)(=O)c2ccccc21	742471657	IICHIBVCZYBXKS-QRYOHXEKSA-N	444.557	1.868	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@H](C)n2nnc(-c3ccccc3)n2)cc(OC)c1OC	742472002	JGGPGTHFVXYZQV-LBPRGKRZSA-N	426.433	1.388	50	20	IDGD	
CC(C)(C)OC(=O)N(CC(=O)NNC(=O)c1csc(N2CCOCC2)n1)CC1CC1	742477425	HXEZQUADSQNHDN-UHFFFAOYSA-N	439.538	1.388	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cccc3ncccc23)cc(NS(C)(=O)=O)c1OC	742647164	XZVKUGZMJKWEMH-UHFFFAOYSA-N	444.469	1.698	50	20	IDGD	
CCCCc1ccc(NC(=S)NNC(=O)CCN2C(=O)[C@H]3[C@H](C2=O)[C@H]2CC[C@H]3O2)cc1	743821895	XNEWOWLXPUOLGO-PSBWJHGTSA-N	444.557	1.899	50	20	IDGD	
CSC[C@@H](C(=O)NNC(=O)Nc1ccc(N(C)C)cc1)N1C(=O)[C@H]2CCCC[C@H]2C1=O	743826389	BVMDGZSFAWNKHV-BBWFWOEESA-N	447.561	1.812	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)CN2CCN([C@H](CO)c3ccc(Cl)cc3)CC2)cc1	744399413	MFQVSUAXFZKVDM-HXUWFJFHSA-N	441.919	1.324	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)c2ccc(N3CCCS3(=O)=O)cc2)c1	744527107	YFVTZQNBGWHAFD-UHFFFAOYSA-N	431.470	1.153	50	20	IDGD	
CCc1ccccc1N1C[C@H](C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)CC1=O	744546468	KZFWGPUCJIBPFH-GOSISDBHSA-N	434.452	1.478	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)CCn2c(=O)oc3cc(Cl)ccc32)c1	744596128	VOOHFZYSMTVWHX-UHFFFAOYSA-N	442.815	1.514	50	20	IDGD	
C[C@@H](CN1CCN(c2ccccc2)CC1)NC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	745838135	KIXPGZJAEYPKTR-INIZCTEOSA-N	426.477	1.750	50	20	IDGD	
COc1cc(C=NNC(=O)CSc2nc(C)cc(C)n2)cc(Cl)c1OCC(N)=O	745984804	QYFVRYAEZUABLC-UHFFFAOYSA-N	437.909	1.862	50	20	IDGD	
CN(C)C(=O)NNC(=O)C1CCN(S(=O)(=O)c2ccc(Br)s2)CC1	746012870	NMYHIBAILXCBLF-UHFFFAOYSA-N	439.357	1.214	50	20	IDGD	
Cc1c(C(=O)NNC(=O)Cc2cn3ccccc3n2)nnn1-c1ccc(OC(F)F)cc1	746548317	GQLSGEKPEURADS-UHFFFAOYSA-N	441.398	1.829	50	20	IDGD	
N#Cc1ccc(NNC(=O)C2CCN(c3ccc4nnnn4n3)CC2)cc1C(F)(F)F	746893483	LVJDRKHDZNVWNS-UHFFFAOYSA-N	431.382	1.769	50	20	IDGD	
C[C@@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)NNC(=O)c2ccc(Cl)cc2F)C1=O	747330540	BSTTXZVQSJZVNK-IBGZPJMESA-N	436.802	1.846	50	20	IDGD	
COc1cc(CN2CCN(CC(=O)NNC(=O)c3cccc(C#N)c3)CC2)cc(OC)c1	747842303	CAXCAUHJYXFPGO-UHFFFAOYSA-N	437.500	1.154	50	20	IDGD	
CCOc1cc(C(=O)NNc2nccn(C)c2=O)ccc1OCC(=O)N1CCCCC1	747942592	YHMRCNNIPVHNKU-UHFFFAOYSA-N	429.477	1.327	50	20	IDGD	
Cc1nn(-c2ccc(C(F)(F)F)cn2)c(C)c1CC(=O)NNC(=O)C(=O)N1CCCC1	748239056	DDNUBKZMSXLXFS-UHFFFAOYSA-N	438.410	1.215	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCCNC(=O)OC(C)(C)C)nc1	749344426	LAZRENDBERRVKD-UHFFFAOYSA-N	430.531	1.263	50	20	IDGD	
C[C@H](C(=O)NNc1nc(Br)cn2ccnc12)n1nnc(-c2ccccc2)n1	750248277	KXWPHJUAEPDLKH-SNVBAGLBSA-N	428.254	1.850	50	20	IDGD	
Cc1nnc2n1C[C@@H](C(=O)NNC(=O)[C@@H]1Cc3ccccc3CN1Cc1ccccc1)CC2	750728697	YEITWSHQIMNZOE-VXKWHMMOSA-N	444.539	1.923	50	20	IDGD	
O=C(CCOC1CCOCC1)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	753274562	RERBJEKOWDLZGX-UHFFFAOYSA-N	439.534	1.208	50	20	IDGD	
C[C@@H](C(=O)OCC(=O)NNC(=O)c1ccc(Cl)cc1)c1ccc(S(C)(=O)=O)cc1	753489487	QOGXFSNAUWTKGD-GFCCVEGCSA-N	438.889	1.851	50	20	IDGD	
COc1cc(OC)cc(OCCCNC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1	753924615	JEWDKXDEMVJILQ-IBGZPJMESA-N	431.445	1.643	50	20	IDGD	
C[C@H](Sc1ccccn1)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	754217654	GGXPMZJPNQJHFR-AWEZNQCLSA-N	434.543	1.808	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Nc2ccc(NS(C)(=O)=O)cc2)cc(OC)c1OC	756705406	JQXSPRRJWOWGNV-UHFFFAOYSA-N	438.462	1.550	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2cc([N+](=O)[O-])ccc2Cl)c1	756966587	BHFVBQLJVQZYHU-UHFFFAOYSA-N	426.838	1.796	50	20	IDGD	
COCCCS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1	757823466	QZRRUCCBRHRHIE-UHFFFAOYSA-N	436.446	1.872	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)c2cnn(CCO[C@@H]3CCCCO3)c2C)cc1	758623635	LSYADYVVBNWOTP-HXUWFJFHSA-N	444.488	1.661	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)C2(CNC(=O)OC(C)(C)C)CC2)c1	759375716	PVNBTWJMBCWQIW-UHFFFAOYSA-N	440.522	1.003	50	20	IDGD	
CC1(Cn2cc(C(=O)NNc3cc(C(F)(F)F)nc(-c4cccnc4)n3)nn2)COC1	760282763	LUXZYAOHKAZEHA-UHFFFAOYSA-N	434.382	1.942	50	20	IDGD	
O=C(NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)N[C@@H]1CCC[C@@H]2OCC[C@H]21	761795560	WIBKRWDAOCHIQD-KSZLIROESA-N	436.534	1.373	50	20	IDGD	
C[C@@H](CCS(C)(=O)=O)NC(=O)NNC(=O)[C@@H](C)Oc1cccc(Br)c1	761995511	ZEKRMUUJAHXCIL-WDEREUQCSA-N	436.328	1.370	50	20	IDGD	
N#Cc1cccc([C@@H]2CN(C(=O)NNC(=O)c3csc(N4CCOCC4)n3)CCO2)c1	762413658	AWBHTCBJFOEZAR-KRWDZBQOSA-N	442.501	1.279	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cc(C)n([C@@H](C)C3CC3)n2)cc(OC)c1OC	763544583	ZNOQVCLMERWBGQ-LBPRGKRZSA-N	445.476	1.588	50	20	IDGD	
CSc1cc2c(cc1NC(=O)C(=O)NNC(=O)[C@@H]1COc3ccccc3O1)OCCO2	763571984	KBEZOYZEHRKWOG-INIZCTEOSA-N	445.453	1.106	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(Br)nc1	763680762	BHUSNTRTQOYPQP-UHFFFAOYSA-N	437.250	1.408	50	20	IDGD	
CCc1ncc(NC(=O)C(=O)NNC(=O)COc2ccccc2Cc2ccccc2)cn1	763718900	RKLJJMQQYZEFRY-UHFFFAOYSA-N	433.468	1.795	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc2nc(C(F)F)[nH]c2c1	763809707	ZLTUQGNVEAFPAW-UHFFFAOYSA-N	428.355	1.537	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cccnc2N2CCOCC2)c1C	763852022	UCUZSLJCBJIDFT-INIZCTEOSA-N	441.488	1.088	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cnn(-c3ccccc3)n2)cc1	763878017	OBNKHZZPPSTISM-AWEZNQCLSA-N	436.428	1.023	50	20	IDGD	
CC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)c1C	763949331	OLWSVGBWEDPVKF-UHFFFAOYSA-N	436.428	1.244	50	20	IDGD	
COC(=O)c1cccc(C#Cc2cccc(NC(=O)C(=O)NNC(=O)c3ccc[nH]3)c2)c1	763981051	RVXPVYFYRYPWBD-UHFFFAOYSA-N	430.420	1.601	50	20	IDGD	
COCCOc1cccc(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)c1	763994391	CRVVWVANVJGHKQ-UHFFFAOYSA-N	425.239	1.202	50	20	IDGD	
CCN(CC)C(=O)COc1cccc(NC(=O)C(=O)NNC(=O)Cc2ccsc2)c1	764035095	SOMDQXUDGYBZFB-UHFFFAOYSA-N	432.502	1.324	50	20	IDGD	
CS(=O)(=O)c1ccc(F)c(NC(=O)C(=O)NNC(=O)c2cccc(C(F)(F)F)c2)c1	764040474	JWIMOHAVAJJAEU-UHFFFAOYSA-N	447.366	1.648	50	20	IDGD	
COc1c(Cl)cccc1NC(=O)C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	764078327	QPFTXRYCCIECHD-UHFFFAOYSA-N	425.850	1.152	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(C)c(C(=O)NC(C)C)c2)c1O	764130182	CLLQECOVDVQRFA-UHFFFAOYSA-N	428.445	1.247	50	20	IDGD	
COc1ccc(OC(F)F)c(NC(=O)C(=O)NNC(=O)c2cccc(OC)c2O)c1	764132673	PHFJTVQILGLXLY-UHFFFAOYSA-N	425.344	1.411	50	20	IDGD	
O=C(NNC(=O)c1ccoc1)C(=O)Nc1ccc(CN2CCN(c3ccccn3)CC2)cc1	764158626	JDQKBOQKPPTIMT-UHFFFAOYSA-N	448.483	1.397	50	20	IDGD	
CCN(CC)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)Cc2ccccn2)cc1Cl	764264161	NSCQPJFIQIJEFN-UHFFFAOYSA-N	431.880	1.546	50	20	IDGD	
COc1ccc(F)cc1NC(=O)C(=O)NNC(=O)c1cc(Br)ccc1O	764278646	VCKROMCPOORXRG-UHFFFAOYSA-N	426.198	1.702	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)C(=O)Nc1ccc(OCC(F)(F)C(F)F)nc1	764385780	JBTKSLZYHQDNMY-UHFFFAOYSA-N	429.330	1.464	50	20	IDGD	
COc1nccnc1NNC(=O)CN(C)S(=O)(=O)c1ccc(Br)cc1	764461351	ZXVAYBOSMNAEJY-UHFFFAOYSA-N	430.284	1.012	50	20	IDGD	
CNc1c(C(=O)OCC(=O)NNC(=O)c2ccc(OC)c(OC)c2)cccc1[N+](=O)[O-]	765514539	DUXCKOYTHLSPBO-UHFFFAOYSA-N	432.389	1.272	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNS(=O)(=O)c1cnc2c(Cl)c(C)nn2c1	766308934	DVYBKPUEVIZWDR-UHFFFAOYSA-N	430.273	1.976	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)c1csc2cncn12	766659924	JOQOKBCFPVAKKG-UHFFFAOYSA-N	432.937	1.628	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2sccc2S(=O)(=O)NC2CCCCCC2)n[nH]1	768279162	VNTKHRSWUMLDDA-UHFFFAOYSA-N	425.536	1.856	50	20	IDGD	
CC(C)O[C@@H]1C[C@@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)C1(C)C	768448581	MRIIUCAFQKCSSO-HZPDHXFCSA-N	426.539	1.473	50	20	IDGD	
CCOC(=O)c1nn(C)cc1C=NNC(=O)CN1c2cccc3cccc(c23)S1(=O)=O	769777828	NUUMDWFMKZMZMN-UHFFFAOYSA-N	441.469	1.409	50	20	IDGD	
CCc1nc(-c2ccc(C(=O)OCC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)cc2)n[nH]1	770153531	HPISBTBFQCTIST-UHFFFAOYSA-N	438.400	1.560	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)Cc1ccc(NS(=O)(=O)c2cccs2)cc1	771985776	RTRMDSUWFZKZSA-LBPRGKRZSA-N	439.515	1.581	50	20	IDGD	
COC(=O)c1ccc(S(=O)(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)cc1F	773251730	KTINTSXNKQTQIM-UHFFFAOYSA-N	433.458	1.227	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)c2cc(N3CCNC3=O)ccc2F)C1	773416669	CWHSMTQNIRAWGN-ZDUSSCGKSA-N	449.483	1.763	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1cccc2cncc(Br)c12	773543865	AAUXCVFQPZWEBE-SNVBAGLBSA-N	439.266	1.135	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2ccnn2[C@H]2CCN(Cc3ccccc3)C2)n1	773724680	UUIHDCDKIIOXSU-INIZCTEOSA-N	436.476	1.211	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)NCc2ccc(S(N)(=O)=O)c(C)c2)c1C	773747170	VLCQFIFYFIHXFP-YBFXNURJSA-N	430.530	1.931	50	20	IDGD	
CNC(=O)Cn1ccc2ccc(NC(=O)C(=O)NNC(=O)c3ccc(C)c(F)c3)cc21	773888269	IZEPGVQOSDEUDZ-UHFFFAOYSA-N	425.420	1.235	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@](N)(c2ccccc2OC)C(F)(F)F)cc1OC	776103270	UFPOJMKWIXXXQO-GOSISDBHSA-N	427.379	1.890	50	20	IDGD	
Cc1csc2ncc(C(=O)NNC(=O)COc3ccc(Br)cc3)c(=O)n12	776291290	LAJPXJJLDLJQNH-UHFFFAOYSA-N	437.275	1.667	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)c2cn(-c3cccc(Cl)c3F)nn2)c1	776440121	WANVHGXBXZROCW-UHFFFAOYSA-N	442.794	1.549	50	20	IDGD	
CCCCS(=O)(=O)N1CCC(C(=O)NNc2ncc(C(=O)OCC)c(C)n2)CC1	778422202	XHYPZXGXDKRFND-UHFFFAOYSA-N	427.527	1.247	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)c1cnn(-c2cccc(Br)c2)c1	778436503	LWZJOKPJNKDOBO-UHFFFAOYSA-N	438.282	1.921	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)[C@H](O)Cc1cccc(C(F)(F)F)c1	778834780	CNTKREZJVSZIRS-CYBMUJFWSA-N	434.415	1.464	50	20	IDGD	
C[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1NC(=O)NNC(=O)c1nnc(O)c2ccccc12	779715453	ZJVBIAHVHVWPJI-DOMZBBRYSA-N	444.492	1.925	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2cn3c(n2)CCCC3)cc1Br	779836827	GRAUSFKAYKPWPW-UHFFFAOYSA-N	429.296	1.614	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2CC(=O)N(c3ccc(F)c(C)c3)C2)cc1C	779871292	FLQPMZORNUYSNT-HNNXBMFYSA-N	426.448	1.890	50	20	IDGD	
O=C(COc1ccccc1Cc1ccccc1)NNC(=O)NC[C@H]1CC(=O)N(C2CC2)C1	780885026	ACINHVOEDAJGQZ-GOSISDBHSA-N	436.512	1.998	50	20	IDGD	
Cc1nnc(CNC(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)s1	780902573	NQIFUDSZOKFQMH-UHFFFAOYSA-N	449.500	1.693	50	20	IDGD	
CC(C)(C)[C@H](Br)C(=O)Nc1cccc(S(=O)(=O)N2CCNC(=O)C2)c1	781076917	WUIQXJOLCRHHCD-CQSZACIVSA-N	432.340	1.555	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)Cc2ccc(C(=O)NNC(=O)NC[C@H](C)C#N)cc2)cc1	781952546	WBAJTAWBHOEZCU-MRXNPFEDSA-N	443.529	1.919	50	20	IDGD	
CC(=NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)c1ccc(N2CCNC2=O)cc1	782133521	YWSTXKMMEIZUFA-UHFFFAOYSA-N	429.502	1.621	50	20	IDGD	
Cc1cc(N2CCCC2)ccc1NC(=O)C(=O)NNC(=O)Cc1nc2ccccc2n1C	782887020	NOGTZWUDYFFABU-UHFFFAOYSA-N	434.500	1.811	50	20	IDGD	
CC(C)(C)OC(=O)Nc1ccc(F)c(NC(=O)C(=O)NN[C@]2(C)CCS(=O)(=O)C2)c1	783426109	FTQUFBWADCGAJZ-GOSISDBHSA-N	444.485	1.309	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2cccc3c2CCCC3)n([C@@H]2CCS(=O)(=O)C2)n1	783451593	QPFZRTFCBGYCMP-OAHLLOKOSA-N	431.518	1.512	50	20	IDGD	
CCNC(=O)COc1cccc(NC(=O)C(=O)NNc2ccc(Br)nc2)c1	784810417	ZYAOYLLISDNAOB-UHFFFAOYSA-N	436.266	1.441	50	20	IDGD	
COc1cccc(NNC(=O)C(=O)Nc2ccc(S(=O)(=O)N3CCCCC3)cc2)n1	784847841	NXLGOZIBSMLVRD-UHFFFAOYSA-N	433.490	1.347	50	20	IDGD	
CS(=O)(=O)CCOc1ccc(Cl)cc1NC(=O)C(=O)NNc1cc(Cl)ccn1	784856147	DHLSXAIGZRHNRC-UHFFFAOYSA-N	447.300	1.894	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)C(=O)Nc3cnc4c(c3)c(C)nn4C)n[nH]2)c1	785126366	PEQUPERDZRSMCI-UHFFFAOYSA-N	446.471	1.683	50	20	IDGD	
O=C(COC(=O)[C@@H]1[C@H]2CC[C@@H](O2)[C@@H]1C(F)(F)F)NNC(=O)c1ccc([N+](=O)[O-])cc1	785802363	UXMOORPQRGYMFO-OXHZDVMGSA-N	431.323	1.255	50	20	IDGD	
Cc1nnc(-c2ccccc2C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)o1	786382446	VENRINSFJWQXPK-UHFFFAOYSA-N	425.357	1.571	50	20	IDGD	
CN1C(=C(C#N)C(=O)COC(=O)[C@@H]2CCCN2C(=O)C(F)(F)F)N(C)c2ccccc21	786580631	HRMBLDLNPHFJHY-HNNXBMFYSA-N	436.390	1.973	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)cc1C(=O)N(C)C(C)C	787543411	VSJQMFDGYLJAQW-LJQANCHMSA-N	438.484	1.565	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)c2cccc(CNC(=O)OC(C)(C)C)c2)C[C@@H](C)O1	787993405	SNFDXBWARKZECT-HZPDHXFCSA-N	434.537	1.972	50	20	IDGD	
COc1ccc(S(=O)(=O)N[C@@H](C)C(=O)Nc2cccc(NC(=O)NN(C)C)c2)cc1	788253906	LOZUFVFSBGAADI-ZDUSSCGKSA-N	435.506	1.599	50	20	IDGD	
Cc1nn(C)c(-n2ccnc2C)c1C(=O)NNC(=O)COc1ccc(Br)cc1	788260622	CNXQNRBSBHZBJJ-UHFFFAOYSA-N	447.293	1.825	50	20	IDGD	
CSC[C@@H](C(=O)NNc1nnc(-c2ccccn2)s1)N1C(=O)[C@H]2CCCC[C@H]2C1=O	788563962	YLIMIEARNMOSNL-SCRDCRAPSA-N	446.558	1.950	50	20	IDGD	
COc1ccc(C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c(OC(F)F)c1	789231891	DQNMQYCUVWWTSY-UHFFFAOYSA-N	439.327	1.823	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2ccc(C(N)=O)c(OC(C)C)c2)cc1	789732664	CZTPYQCVQUHSNA-UHFFFAOYSA-N	442.472	1.300	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1nn(-c2ccc(Cl)cc2)cc1O	789930963	KSQXHPFECCNZLS-UHFFFAOYSA-N	441.879	1.699	50	20	IDGD	
CCCNC(=O)[C@@H]1CN(C(=O)C(=O)NNc2cccc(F)c2[N+](=O)[O-])c2ccccc2O1	790999242	PWEVPVCMYIMAOA-INIZCTEOSA-N	445.407	1.497	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)NCCCCn1cc(Br)cn1	792223835	GVZCNLBBPJCARX-UHFFFAOYSA-N	428.262	1.974	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)cc(-n2cccn2)c1	792355929	XKIKAOXUHBRJTP-UHFFFAOYSA-N	427.392	1.185	50	20	IDGD	
C[C@@H](Cn1ncc2ccccc21)C(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	792849488	WVEFWGVGTYJQPX-ZDUSSCGKSA-N	425.401	1.585	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)CCCN1C(=O)c2ccccc2C1=O	795169231	JNCLRSPFSJJCRS-UHFFFAOYSA-N	430.486	1.456	50	20	IDGD	
C[C@H]1CN(c2ccc(C(=O)NNc3ccccc3S(=O)(=O)N(C)C)cn2)C[C@@H](C)O1	795177587	NDQAHGLOJMZFDK-GASCZTMLSA-N	433.534	1.702	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)COc2cccc(C)c2)c(OC)c(C)c1OC	796992107	MLZMCILVUCKKSS-UHFFFAOYSA-N	431.445	1.494	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)c(OC)c(C)c1OC	796998277	DFRMJUJZALPDLZ-UHFFFAOYSA-N	437.836	1.780	50	20	IDGD	
CC(C)CCn1nc(C(=O)NNC(=O)C(=O)Nc2cncc(F)c2)c2ccccc2c1=O	799258722	KJTCVDCSJJHCJR-UHFFFAOYSA-N	440.435	1.376	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCC(N3CCc4ccccc43)CC2)cc1OC	800405077	AIZALHOOPJYUOW-UHFFFAOYSA-N	438.528	1.992	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3cc(F)cc4nn[nH]c34)n[nH]2)cc1OC	800526489	KKCMXFDSKVSXAY-UHFFFAOYSA-N	425.380	1.579	50	20	IDGD	
Nc1c(Cl)c(Cl)nc(C(=O)NNS(=O)(=O)c2cccc3c2OCO3)c1Cl	800831042	PSVBFYJHOLRURW-UHFFFAOYSA-N	439.664	1.976	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)CNC(=O)c2ccccc2OC)c(OC)cc1Cl	802078778	SPIYZOJFMOLUIR-UHFFFAOYSA-N	436.852	1.949	50	20	IDGD	
CN(C)C(=O)CN1[C@H]2CC[C@H]1CC(NC(=O)NNC(=O)Nc1ccc(N(C)C)cc1)C2	807513707	DSVBSZUXESZXIB-ROUUACIJSA-N	431.541	1.172	50	20	IDGD	
Cc1ccc(Br)c(S(=O)(=O)NCCNC(=O)NNc2ccc(C)nn2)c1	807562365	NADNRYULFMTMIL-UHFFFAOYSA-N	443.327	1.461	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)N[C@@H]1CCCN(C(=O)CCC(F)(F)F)C1	807574464	QRCZNYRHUAEBQB-GFCCVEGCSA-N	431.371	1.872	50	20	IDGD	
CCOC(=O)c1cccc(NC(=O)c2cccc(NC(=O)C(=O)NNc3ncccn3)c2)c1	810387588	BCQVFEJJJHUCNX-UHFFFAOYSA-N	448.439	1.987	50	20	IDGD	
C[C@H](C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1)N1CCN(c2ccc(F)cc2)CC1	812727843	YKKDLVDDQDAXLC-MRXNPFEDSA-N	449.552	1.730	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(C)cnc2Br)cc1OC	812980261	RBXKMAQLGHLHMK-UHFFFAOYSA-N	437.250	1.569	50	20	IDGD	
COC(=O)c1cn(-c2cccc(NC(=O)C(=O)NNc3ncnc4ccsc34)c2)nn1	812982881	BHTOPFRDAVOBAH-UHFFFAOYSA-N	438.429	1.140	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)Cn2cccc(C(F)(F)F)c2=O)C1	816510426	VZCZMPRYMGEBOR-LBPRGKRZSA-N	446.426	1.662	50	20	IDGD	
O=C(NNc1ncncc1F)c1ccc(Cl)c(S(=O)(=O)NC[C@@H]2CCCO2)c1	817077791	QNARHAGPZQKTOW-NSHDSACASA-N	429.861	1.483	50	20	IDGD	
CCCCN1C(=O)c2ccc(C(=O)NNC(=O)CCN3C[C@H](C)O[C@H](C)C3)cc2C1=O	912921356	NOGKXGBRISWQFA-GASCZTMLSA-N	430.505	1.343	50	20	IDGD	
CCn1c(=O)nc(O)c2c(C(=O)NNC(=O)c3c[nH]c4ccccc34)cc(C3CC3)nc21	914439720	LXRYSXNNUDWUNB-UHFFFAOYSA-N	432.440	1.951	50	20	IDGD	
O=C(COc1ccccc1C(F)(F)F)NNC(=O)c1csc(N2CCOCC2)n1	914749261	KDJKEHCKUDOLFH-UHFFFAOYSA-N	430.408	1.839	50	20	IDGD	
Cc1occc1C(=O)Nc1nc(CC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cs1	915806723	URSISNQUGUPRQP-INIZCTEOSA-N	442.453	1.827	50	20	IDGD	
CS(=O)(=O)NC1(CNC(=O)NNC(=O)CCSc2ccc(F)cc2)CCCCC1	916253860	PIUSEJQSYUBETE-UHFFFAOYSA-N	446.570	1.890	50	20	IDGD	
COc1cccc(NCC(=O)NN=Cc2c(C)nn([C@H]3CCS(=O)(=O)C3)c2Cl)c1	916360204	XTIDGQBFLBFRFH-AWEZNQCLSA-N	439.925	1.775	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)Nc2ccc(F)c(C(N)=O)c2)c2ccccc2c1=O	916376606	TYWCIOMXUBEOQH-UHFFFAOYSA-N	426.408	1.682	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)NCCN2CCN(c3ccccc3)CC2)c1	916514304	AMYPZLYUGXXLMU-UHFFFAOYSA-N	425.533	1.835	50	20	IDGD	
C[C@@]12CCC(=O)N1c1ccccc1C(=O)N2CC(=O)NNC(=O)c1ccc(Cl)nc1	917252161	CWOGTDZDOPUKHA-FQEVSTJZSA-N	427.848	1.495	50	20	IDGD	
CN(C)C(=O)COc1cccc(CNC(=O)NNC(=O)Cc2nc3ccccc3n2C)c1	918223555	JCYNHFOLUAIGRO-UHFFFAOYSA-N	438.488	1.113	50	20	IDGD	
Cc1nn(-c2ccc(Cl)cc2)c(C)c1CC(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1	919884136	DXYSTKATDNCOGF-AWEZNQCLSA-N	439.925	1.203	50	20	IDGD	
O=C(NNC(=O)c1[nH]c2ccc(Br)cc2c1Cl)N[C@@H]1CCS(=O)(=O)C1	919885761	NOCJOJMCNPDDOH-MRVPVSSYSA-N	449.714	1.715	50	20	IDGD	
CSCC[C@@H](NC(=O)c1ccc([N+](=O)[O-])o1)C(=O)NNC(=O)NCc1ccco1	920856006	XKZBXLWNYVRSKG-LLVKDONJSA-N	425.423	1.163	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(CC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)CC1	921303119	NUUZEDUPNHSLGT-UHFFFAOYSA-N	429.481	1.461	50	20	IDGD	
O=C(Cn1c(=O)ccn(Cc2ccccc2)c1=O)NNc1ccc(Br)cc1	932523518	BPBFLEHMURRWBV-UHFFFAOYSA-N	429.274	1.964	50	20	IDGD	
Cc1[nH]nc(C(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)c1Br	1251914304	FIGDFWNHVFLQOP-UHFFFAOYSA-N	430.303	1.889	50	20	IDGD	
Cc1cnn(-c2c(C(=O)NNC(=O)C3CCN(C(=O)OC(C)(C)C)CC3)c(C)nn2C)c1	1320445649	LUVYDLBLALGFGZ-UHFFFAOYSA-N	445.524	1.631	50	20	IDGD	
Cn1c(C(=O)NNC(=O)c2cncn2-c2ccccc2)cc2c(=O)n3ccccc3nc21	1324358770	ZAFAGTULDFWEOQ-UHFFFAOYSA-N	427.424	1.447	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1cc(C(C)(C)C)nn1Cc1ccccc1	1342389228	SELSKQKAVHMRBH-ZDUSSCGKSA-N	436.538	1.319	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnn4ccncc34)C2)C1	1777976569	DCPWMOJMLPUYIF-FZKQIMNGSA-N	436.310	1.204	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Cl)C2)[C@H]1ON=C(c2ccccc2)O1	1779260814	RPXGRQCGMCIUCX-PBGAUENZSA-N	439.871	1.769	50	20	IDGD	
COc1ccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](C)Br)C3)nn1	1779954881	RJPWFNFQOSKIOS-RVZJWNSFSA-N	441.326	1.396	50	20	IDGD	
COCCC(=O)N1CCO[C@]2(CCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1	1780097106	QLYQBTAVWZEUMQ-HXUWFJFHSA-N	435.433	1.000	50	20	IDGD	
N#Cc1ccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](O)CCl)C3)c(Cl)c1	1781105100	IVMIIAAYXOLHPB-MBOZVWFJSA-N	440.327	1.939	50	20	IDGD	
COC(=O)[C@@H]1CC[C@H](C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)C1	1781325592	ODBVPRGQAGTYKJ-ZBYUQBLASA-N	435.290	1.096	50	20	IDGD	
O=C(c1ccn2nccc2c1)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781331501	LSQNWWNHIVBBHA-RHSMWYFYSA-N	425.258	1.468	50	20	IDGD	
O=C([C@H](F)Br)N1CC[C@@]2(C1)CN(C(=O)C1(Br)CC1)CCO2	1781332937	KOMSUEAZWCLYTQ-JOYOIKCWSA-N	428.096	1.434	50	20	IDGD	
CC1(C)CCC(CC(=O)N2CC[C@@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)CC1	1781403865	ICAFJZXNDFQTNG-XMMPIXPASA-N	442.365	1.416	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)Oc1ccccn1)C2	1782179463	XSSHRWOASCORAI-KYFSNAEOSA-N	439.940	1.617	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](C)[S@@](=O)c3ccccc3)C2)C1	1782688427	WYRURXSWSOKCRT-SILXOERBSA-N	442.965	1.266	50	20	IDGD	
COc1ccc(F)cc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2	1782926341	HUHJZFHXBFJQLM-XAUMDUMWSA-N	428.888	1.562	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)Cc3ccc4c(c3)OCO4)CCO2)C1	1783532580	KOZSDVNBVDSJAA-YJYMSZOUSA-N	439.306	1.571	50	20	IDGD	
Cc1cc2nnc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)C(C)(C)CCl)[C@H]4C3)c(C)n2n1	1783850548	YQFOLLDYTUQTTE-JYJNAYRXSA-N	448.955	1.599	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(O)n3)C[C@@H]21	1783967056	AAACXDPMLZFFSJ-OSFYFWSMSA-N	426.311	1.412	50	20	IDGD	
COc1ccc(Cl)c(CC(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)c1F	1784052842	HHVIJHZFZRQFBD-AUUYWEPGSA-N	449.306	1.460	50	20	IDGD	
COC(=O)[C@H]1CC[C@@H](C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCBr)C[C@@H]32)C1	1784081961	OSGGLQIMPYEXBY-YXMSTPNBSA-N	445.354	1.340	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(OC(F)F)cn3)[C@H]2C1	1785746197	CETTYPJYFVKETB-ZIEJDFEHSA-N	447.866	1.530	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(=O)c3ccccc3)[C@H]2C1	1786338042	DFHGQKBTUUADCF-IWCQGFGOSA-N	437.334	1.880	50	20	IDGD	
O=C(Cc1ccccc1C(F)(F)F)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21	1786518230	AYOHIQQXMMZLBO-OTRWWLKZSA-N	448.869	1.827	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3noc4c3CCCC4)[C@H]2C1	1787305975	RCZWEFZEKWVQGN-DUPGQFARSA-N	440.338	1.930	50	20	IDGD	
O=C(CCc1cn[nH]c1)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1	1788140062	DKGCHVHSTMFILG-UHFFFAOYSA-N	432.289	1.470	50	20	IDGD	
Cc1cnn(CC(=O)Nc2ccc(C3(NC(=O)CCC(=O)NN(C)C)CCC3)cc2)c1	1788289430	UMZKJPKTXHWIPZ-UHFFFAOYSA-N	426.521	1.699	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4c(c3)NC(=O)CO4)C[C@@H]21	1789863101	CROUMWWBLWVYND-XSWJXKHESA-N	435.908	1.628	50	20	IDGD	
Cc1ccc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](O)CCl)C[C@@H]32)cc1[N+](=O)[O-]	1789910303	UWTNRKZKZVGINH-ONIAQPFYSA-N	439.896	1.025	50	20	IDGD	
COc1cccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]3C2)c1	1789924482	GSTOGZPZJFYMDA-QCEMKRCNSA-N	429.286	1.979	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21)c1ccc(O)c([N+](=O)[O-])c1	1790022150	DJIYWGRAPKETNB-MJVIPROJSA-N	432.260	1.697	50	20	IDGD	
CC(C)=NO[C@@H](C)C(=O)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1	1790564557	GRTUXWMAYATXIG-INIZCTEOSA-N	437.305	1.915	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CC[C@H](O)CC3)C[C@@H]21	1790963914	OEDKQQIHLHODIK-UYLCUJDWSA-N	431.371	1.691	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3c(C)nc4ccccn34)C[C@@H]21	1791253836	HMGROMIRGRCVBW-NXOAAHMSSA-N	434.924	1.490	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)NC1(c2ccc(NC(=O)CCC(=O)NN(C)C)cc2)CCC1	1791599987	OEAVQCFUNXLIKE-OAHLLOKOSA-N	431.537	1.360	50	20	IDGD	
CC(C)(Cc1ccccc1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(B(O)O)cc1)C2	1792996109	KFNFKOIGHCIOCE-KOUNCHBCSA-N	434.345	1.887	50	20	IDGD	
CC1(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](O)CCl)CN(C(=O)OC(C)(C)C)C1	1793117457	MDLAPAJROLJSMV-QKPAOTATSA-N	443.972	1.871	50	20	IDGD	
Cn1cnc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C3)n1	1794934543	NCSYHAZINXXGDG-CRWXNKLISA-N	440.932	1.199	50	20	IDGD	
COc1ccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)Br)C3)cc1	1795260641	PZCWQTJIWXWTRP-LJGDNWOOSA-N	425.323	1.611	50	20	IDGD	
CC(C)(C)OC(=O)N1CCCC[C@@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Cl	1796368578	NNWCAHQLGYVQMV-JKJDWNRSSA-N	447.935	1.900	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccn(CCOC)n1	1797070381	REWGNIZOQQFERH-LXTVHRRPSA-N	427.343	1.955	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc2cccnc12)c1cccc(B(O)O)c1	1797329647	OXOGDMIMJUDSRD-ACDBMABISA-N	429.285	1.480	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc([N+](=O)[O-])c2c1OCO2	1798628185	VDAFWHBSGNSVAR-WJNVRWDZSA-N	439.852	1.544	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccc([N+](=O)[O-])c(OC)c1	1799249709	BCUIKVTXTVQFKE-YGTYGHESSA-N	439.896	1.753	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3nncn3c1)C2	1799277501	WCAJBTGRNIMFLG-ZFHGCVPZSA-N	426.304	1.169	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3ncsc3[nH]1)C2)[C@H](F)Br	1799349661	JRBICUSXMBCRCI-VVJJBPBLSA-N	431.287	1.518	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1c[nH]c2cccc(OC)c12	1800004387	YWYWWBOZKMSUQS-FCIKYMEBSA-N	435.908	1.634	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc3c1OCC3)C2	1800641301	XUEIXBKNKSQPIK-YALNPMBYSA-N	437.334	1.998	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(F)cnc1Cl)C2	1800759012	DEXNFSGDOYHFKH-XHSYRHOGSA-N	434.693	1.861	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cn1cnc2ccccc21	1800886520	PRVOYJCHNGIUQD-ZTENYAIWSA-N	449.349	1.657	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cc(Cl)ccc1OC)C2	1800979597	QIPKTTUHKLNACE-QHHYFVSCSA-N	445.343	1.735	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cn1cccc([N+](=O)[O-])c1=O)[C@@H](F)Br	1801358398	WLQRDSQDTSUNLD-FBKDDSFISA-N	445.245	1.085	50	20	IDGD	
COC(=O)C[C@@H](NC(=O)OC(C)(C)C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](F)Cl)C2	1802020370	DCTSQXFLPXCEEP-WPLOAARJSA-N	449.907	1.615	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)Cc2ccc3c(c2)OCO3)[C@H]1c1cccnc1)[C@H](O)CCl	1803137993	GHHHAHPADLNZAU-FVJLSDCUSA-N	445.903	1.659	50	20	IDGD	
C[C@H](Nc1cccnc1)C(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]1c1cccnc1	1803138330	JOTLUOFRZIIVFD-RGIVZKHGSA-N	431.924	1.583	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cnc3ccccc3n2)[C@H]1c1cccnc1)[C@H](O)CCl	1803139247	MYEBTVZQGJEKMN-BEVDRBHNSA-N	439.903	1.944	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)C23CC(F)(C2)C3)[C@H]1c1cccnc1	1803661481	RMRSASKBGVQABP-UCPPSSTDSA-N	431.512	1.353	50	20	IDGD	
Cn1nncc1C(=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@@H]1c1cccnc1	1804750651	XTPURDCUJJRTTR-IACUBPJLSA-N	425.262	1.220	50	20	IDGD	
O=C(CCBr)NC[C@@H]1CCN(C(=O)c2ccc[n+]([O-])c2)[C@H]1c1cccnc1	1806339098	IUIKFKJFXYAPET-YJBOKZPZSA-N	433.306	1.820	50	20	IDGD	
O=C(CCC(F)(F)F)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1806826178	SZHPOGUFSZPLHT-LPHOPBHVSA-N	449.238	1.424	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)c2ccc(F)cc2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807368113	YZNOODCCNHLLNV-KNQAVFIVSA-N	447.275	1.534	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CC(F)(F)F)[C@H]1c1cccnc1)c1cccc(B(O)O)c1	1807370340	ARRJKYITRAVDSI-YJBOKZPZSA-N	435.211	1.033	50	20	IDGD	
Cc1cc2nnc(C(=O)N3CC[C@H](CNC(=O)[C@H](F)Cl)[C@@H]3c3cccnc3)c(C)n2n1	1808312835	JXAKRKQUXGCMHI-JLSDUUJJSA-N	445.886	1.990	50	20	IDGD	
CC(C)CNC(=O)C(=O)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@@H]1c1cccnc1	1808447804	WFWVOCKIZXELQG-ZNMIVQPWSA-N	443.317	1.550	50	20	IDGD	
C#CCO[C@H](C)C(=O)N1CC[C@H](CNC(=O)[C@@H](F)Br)[C@@H]1c1cccnc1	1808649812	XYRQWBVEXGQASW-DMRZNYOFSA-N	426.286	1.816	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC2(CCCN(C(=O)CCN3CCOCC3)C2)CC1	1809584019	IUXKITRZHOLZBO-QGZVFWFLSA-N	444.414	1.971	50	20	IDGD	
Cc1ncsc1C(=O)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1	1809976765	OHJQZTDREJCUQM-UHFFFAOYSA-N	427.335	1.290	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)C(Cl)Cl)[C@@H]1c1cccnc1)c1n[nH]cc1[N+](=O)[O-]	1810638993	TVTYQVHNWAAMNU-GXFFZTMASA-N	427.248	1.836	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)[C@H](C)n2cncn2)[C@H]1c1cccnc1	1812866948	BDIWMGCINGOHKZ-SDADXPQNSA-N	435.326	1.724	50	20	IDGD	
C=CCNC(=O)/C=C\C(=O)N1CC[C@H](CNC(=O)C(Cl)Cl)[C@@H]1c1cccnc1	1813074251	PORGJCLZJHAGLU-SWFLQVRRSA-N	425.316	1.750	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)[C@@H]1CCC(F)(F)C1	1814387678	PEQBLGZIPXPDNT-RHSMWYFYSA-N	446.263	1.831	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccnc2S)n[nH]1	1814449187	SUANVBXUNMYPJF-OAHLLOKOSA-N	445.549	1.772	50	20	IDGD	
O=C(CC1CCCC1)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1	1815339919	URPHYLWTHNIMMK-INIZCTEOSA-N	427.335	1.629	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@H]1CCc2nc(NC(=O)Cn3cccn3)sc2C1	1815707246	ZOQHHCYNHARWCL-MNOVXSKESA-N	426.340	1.983	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2CCC(F)(F)C2)[nH]n1)c1cccc(B(O)O)c1	1817474863	GTKLHDMQZWLGHB-PBHICJAKSA-N	446.263	1.831	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)C2CC(F)(F)C2)[nH]n1)c1cccc(B(O)O)c1	1817475824	VTBQIFGRMHBQNE-INIZCTEOSA-N	432.236	1.441	50	20	IDGD	
COCc1oncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](Cl)COC)CC2	1817805373	YPDOIDZIKAIHNJ-ONGXEEELSA-N	428.898	1.757	50	20	IDGD	
CCC(=O)C(=O)N1CCCC[C@H]1c1cc(NC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)n[nH]1	1818113303	JKJWVOVFQNEPNI-GIEPYWIESA-N	427.465	1.515	50	20	IDGD	
Cc1ccoc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1818170944	ZGQJPVWSNPIKLI-INIZCTEOSA-N	437.460	1.929	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1ccncc1F	1818393793	KBPAIEHBEGNQBU-SFHVURJKSA-N	437.240	1.243	50	20	IDGD	
C[C@H](Cn1cncn1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CO[Si](C)(C)C)CC2	1820072426	GZCATIJJOVHFCY-OLZOCXBDSA-N	436.614	1.834	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@H]1CCc2nc(NC(=O)c3cnncc3C(=O)O)sc2C1	1820500554	BNMSTTQSXAZIBQ-JTQLQIEISA-N	449.565	1.709	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](O)c2ccccc2)[nH]n1	1822413047	NINUELZUUKUNET-UWJYYQICSA-N	442.520	1.508	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)CCc2cncnc2)[nH]n1	1822413913	GYVLPGSQNMYQKP-QGZVFWFLSA-N	442.524	1.198	50	20	IDGD	
C=CCO[C@H](C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1	1824504516	PZNYLQLKXZNMFZ-UTKZUKDTSA-N	428.338	1.191	50	20	IDGD	
Cc1[nH]nc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)c1F	1825606728	PSVOHJPITWSRGY-SFHVURJKSA-N	442.300	1.084	50	20	IDGD	
CCc1ncccc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827055790	FXKUNTZVGOVQIC-HSZRJFAPSA-N	449.360	1.871	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)Cc2ccccn2)CC1	1827219805	DLUFKINFAFXSRZ-JOCHJYFZSA-N	435.333	1.237	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnsn2)CC1	1828925122	FKHGFVIZEQZYSZ-KRWDZBQOSA-N	443.533	1.084	50	20	IDGD	
O=C(C(Cl)Cl)N1CCOC[C@@]2(C1)CN(C(=O)C1(c3ccccc3)CC1)CCO2	1829843660	NWUBRFMFBILRCO-LJQANCHMSA-N	427.328	1.978	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccnn3CCOC)C2)C1	1831647572	XTWZNHLFZAMJKN-JXFKEZNVSA-N	442.944	1.007	50	20	IDGD	
C[C@]1(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1(F)F	1832803870	PMQKQPIAOONKAC-LAUBAEHRSA-N	449.502	1.964	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3ccc4nc[nH]c4c3)CC2)CC1)[C@@H](O)CCl	1833310587	SLEFIMXTXIEGTD-IBGZPJMESA-N	433.940	1.348	50	20	IDGD	
C=CCO[C@H](C)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1833477741	RFEZZMABMRIBGS-CZUORRHYSA-N	434.350	1.840	50	20	IDGD	
Cc1oncc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)CBr)C2)C1	1834310575	AQWBXDXYFWYGNU-SJCJKPOMSA-N	430.299	1.084	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccnn3CC)CCO2)C1	1834417695	OJNOQWDZBCKPLV-RDTXWAMCSA-N	443.342	1.147	50	20	IDGD	
O=C(CCN1CCOCC1)NC1CCN(C2CCN(C(=O)C(Cl)Cl)CC2)CC1	1834638176	WTODEHOFSNXPJP-UHFFFAOYSA-N	435.396	1.084	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)C(F)(F)C(F)F)C2)C1	1834819339	LXZRQFYLQZNDPC-ZDUSSCGKSA-N	435.212	1.128	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)Br)CC2)CC1	1835125397	PSKWCJWOHRLNBM-ZIAGYGMSSA-N	445.402	1.208	50	20	IDGD	
O=C(COCc1ccccc1)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1835370236	NEYDYKVQPZIJOA-LJQANCHMSA-N	431.316	1.463	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC1CCN(C2CCN(C(=O)COc3cccnc3)CC2)CC1	1835835276	PDQMZSGOKSKUKI-UHFFFAOYSA-N	448.640	1.884	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)C3=NO[C@H](c4ccccc4)C3)CCO2)C1	1836585755	DULAVNALOPYGDG-JLMWRMLUSA-N	449.935	1.978	50	20	IDGD	
O=C(c1nc2ccccc2[nH]1)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836718433	XLOVZPSVHRSNCE-GOSISDBHSA-N	434.924	1.775	50	20	IDGD	
O=C(c1cc(C(F)(F)F)ccn1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1838084573	HMZMZCLFBBFGKT-CZUORRHYSA-N	439.793	1.705	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC(OC2CCN(C(=O)c3c[nH]c(=O)cn3)CC2)CC1	1838430517	JGFOSBMNACUBBX-UHFFFAOYSA-N	436.585	1.234	50	20	IDGD	
CC(C)c1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)on1	1838775778	HWAMMTVFWDRLKH-HXUWFJFHSA-N	439.585	1.720	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](C)n3cncn3)CC2)CC1	1838787221	VSCOBJVVBAZRPD-PBHICJAKSA-N	427.933	1.092	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(C)c(F)c3)CCO2)C1	1838916524	XGGZTOMOMNZRJN-OXJNMPFZSA-N	428.888	1.458	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3c(F)cccc3F)C2)C1	1839146608	QIUISSPELISPSO-QRWLVFNGSA-N	430.879	1.981	50	20	IDGD	
C=CCC(F)(F)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2	1839155248	PJQZROQNHWJALI-JKSUJKDBSA-N	429.291	1.891	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(F)nc3)C2)C1	1840033566	IZJIEFIBRJGGHV-YVEFUNNKSA-N	430.274	1.074	50	20	IDGD	
C=C(C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)Br)CCO2)C(F)(F)F	1840034958	BJXQDBSOYGBTFR-SMDDNHRTSA-N	429.233	1.345	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)c3ccccn3)C2)C1	1840036008	CFNMOLGHPWEXGU-ZRGWGRIASA-N	440.338	1.425	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)Cc2ccc(S(C)(=O)=O)cc2)C1	1842811535	RCIDHBBXIUJBGI-INIZCTEOSA-N	428.938	1.090	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)C2(c3cccc(Cl)c3)CC2)C1	1843817370	XXWZKQJKTOGETP-UHFFFAOYSA-N	432.952	1.948	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2O)C1	1843824745	DDSLUFLGNXKDHW-PMPSAXMXSA-N	443.972	1.825	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)c2ccc(C(F)(F)F)cc2)C1	1844947571	XEVKPRIWKCYZTR-UHFFFAOYSA-N	432.207	1.516	50	20	IDGD	
O=C(Cn1ccnn1)N1CC2(CCCN2C(=O)[C@H](Br)Cc2ccccc2)C1	1845941315	SDPVQVWEQLMSQN-MRXNPFEDSA-N	432.322	1.488	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC12CN(C(=O)[C@H](CCO)NC(=O)OC(C)(C)C)C2	1846175160	IGKAERXDPRUUHY-STQMWFEESA-N	448.358	1.249	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cccnc1S	1847270606	QOJUFGKYQOANCB-CCODGHKUSA-N	426.502	1.320	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H]1C[C@@H]1c1ccc(F)cc1	1847457907	UVIXBRRPTBOUKV-JYBIWHBTSA-N	437.475	1.443	50	20	IDGD	
CCn1c(NNC(=O)CCNS(=O)(=O)c2ccccc2Cl)nc2ccccc2c1=O	11163920	KLNRRLCZGPUNOF-UHFFFAOYSA-N	449.920	1.882	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)[C@@H]2CC(=O)N(c3ccc4c(c3)OCCO4)C2)c1	15878797	NKMUELMFXLGJCR-MRXNPFEDSA-N	439.468	1.654	50	20	IDGD	
O=C(NNC(=O)c1ccccn1)c1ccc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1	17329475	PKNILRCMMDFOOX-UHFFFAOYSA-N	441.425	1.865	50	20	IDGD	
C[C@H]1Cc2cc(C(=O)NNC(=O)c3ccc4c(c3)OCCO4)ccc2N1S(C)(=O)=O	21904175	BODBNJMXZYWYLL-LBPRGKRZSA-N	431.470	1.243	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)Cn2c(=O)n(C)c3ccccc32)cc1OC	22191949	VAZVHTDTQFLPHI-UHFFFAOYSA-N	426.473	1.989	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CCn2c(=O)[nH]c(=O)c3ccccc32)ccc1OC(C)C	105283235	PLWQUIDAONGDLX-UHFFFAOYSA-N	440.456	1.337	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)[C@H]2CCCN2S(=O)(=O)c2cccs2)c(C)c1	110889794	VONQVEDLQHIBNP-MRXNPFEDSA-N	436.559	1.778	50	20	IDGD	
COCCCNC(=S)N(C)NC(=O)c1cccc(S(=O)(=O)N2CCCC[C@H]2C)c1	726077530	YPPQGJXOQMKRFL-OAHLLOKOSA-N	442.607	1.737	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)Cc2csc(N3CCOCC3)n2)cc1F	726436880	OGQKSILZWDYQOQ-UHFFFAOYSA-N	425.511	1.688	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCc1ccc2c(c1)OCCCO2	727474109	YNGPKVDXDNLRSP-UHFFFAOYSA-N	447.517	1.594	50	20	IDGD	
COc1ccc(S(=O)(=O)NCCC(=O)NNc2nc(-c3ccccc3)no2)cc1OC	728080425	FYBNHJIPIZFHSE-UHFFFAOYSA-N	447.473	1.566	50	20	IDGD	
O=C(COC(=O)c1csc(-c2ccccn2)n1)NNC(=O)[C@H]1COc2ccccc2O1	728341509	ZSBDYFAMLFTPQP-MRXNPFEDSA-N	440.437	1.349	50	20	IDGD	
O=C(CSc1nnc(-c2cccs2)n1C1CC1)NNC(=O)[C@H]1CCS(=O)(=O)C1	728460972	PFOHUZHUHALJMP-JTQLQIEISA-N	441.560	1.016	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)[C@@H]2CCCN2c2ncnc3sccc23)cc1	728668264	RACBMYNHGICESO-INIZCTEOSA-N	439.497	1.973	50	20	IDGD	
Cc1noc(C)c1CSc1ccccc1C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O	729274878	GKQVDQYXXPISKB-LLVKDONJSA-N	426.520	1.282	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NC[C@H]1CN2CCC[C@H]2CO1	729494868	HYGORQCHTFDODB-NOLJZWGESA-N	441.326	1.410	50	20	IDGD	
C[C@@H]1Oc2c(ccc(Cl)c2Cl)C1=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O	729932973	SSADZKBGNKXCSG-ZETCQYMHSA-N	444.300	1.179	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)N2CCC[C@H](CS(N)(=O)=O)C2)c(C)n1C[C@@H]1CCCO1	732093166	SEYOYZIDFLBZJY-AKYASHOOSA-N	434.562	1.718	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NCCCCN1C(=O)c2ccccc2C1=O	732472794	WHMGVYWRSMVEGF-CQSZACIVSA-N	442.447	2.000	50	20	IDGD	
CCC[C@H](NC(=O)Cc1ccccc1)C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	732633580	MXVZLEIICPRWHE-SFHVURJKSA-N	431.514	1.379	50	20	IDGD	
CN(CCNC(=O)NNC(=O)COc1ccc(Br)cc1)CC(F)(F)F	732673506	KOSQAYDWJDFSHB-UHFFFAOYSA-N	427.221	1.652	50	20	IDGD	
CS(=O)(=O)CCCNC(=O)NNC(=O)c1cn(-c2ccccc2)nc1-c1ccccc1	732891938	WBDHDWYWTIMPRF-UHFFFAOYSA-N	441.513	1.918	50	20	IDGD	
CCOCCCn1c(NNC(=O)[C@@H](NC(C)=O)C2CCCC2)nc2ccccc2c1=O	733268427	LBSHVOMMTPDBAZ-IBGZPJMESA-N	429.521	1.961	50	20	IDGD	
O=C(NNc1ccc(Br)cc1Cl)[C@@H]1CC(=O)N(CCN2CCOCC2)C1	733807346	BBHUFWXCMUKLAL-GFCCVEGCSA-N	445.745	1.726	50	20	IDGD	
CCc1cc(NNC(=O)C2=NN(c3ccccc3)[C@H](C(N)=O)C2)nc(-c2ccccn2)n1	734357255	RDJFBPJEAHSSTB-SFHVURJKSA-N	430.472	1.664	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=S)Nc1ccc2c(c1)OCO2	735233908	WJYGOJZPDXFDBT-UHFFFAOYSA-N	427.530	1.945	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)N[C@H](C)C(=O)N2CCCC[C@@H]2C)nc1	737048063	RSDNMGKSKTWWMA-UONOGXRCSA-N	426.543	1.184	50	20	IDGD	
CC(=NNC(=O)COc1ccc(C#N)cc1)c1cccc(S(=O)(=O)N2CCOCC2)c1	739400837	SGDKQQAZJYUPLW-UHFFFAOYSA-N	442.497	1.498	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cn(CCC(C)C)nn2)c1	740812600	QOYTUZHTOGUQMF-UHFFFAOYSA-N	436.538	1.430	50	20	IDGD	
CC(C)c1nn([C@H]2CCS(=O)(=O)C2)cc1C(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	742463225	PGCYOISUQTUMCL-AWEZNQCLSA-N	435.462	1.349	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)[C@@H](C)NC(=O)OC(C)(C)C	743093889	JSMUCMOLWTWFJV-SNVBAGLBSA-N	429.857	1.566	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)[C@H]2CCSc3ccccc32)CC1	743419980	RJCACLKPCVSBGI-INIZCTEOSA-N	447.586	1.740	50	20	IDGD	
O=C(NNC(=O)c1cccc(Br)c1)NNC(=O)c1cc(Br)c[nH]1	743508512	OYOWWZFJLJKLJP-UHFFFAOYSA-N	445.071	1.829	50	20	IDGD	
COc1cccc(-c2noc([C@H](C)NC(=O)NNC(=O)CNC(=O)c3ccco3)n2)c1	743578611	XRRGPGHDZDIDII-NSHDSACASA-N	428.405	1.160	50	20	IDGD	
CCCCN1C(=O)CC[C@H](C(=O)NNC(=O)C(=O)NC(C)C)[C@@H]1c1ccc(OC)cc1	744447095	XGBRQTGQOPFGFF-HKUYNNGSSA-N	432.521	1.447	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)O[C@H](C)C(=O)N2CCN(C(=O)c3ccco3)CC2)cc(C#N)n1C	744633839	ZZDNQADVNDKAGV-CJMVGXJBSA-N	449.467	1.621	50	20	IDGD	
COc1ccc(N2CCC(NC(=O)NNC(=O)c3cc([N+](=O)[O-])ccc3O)CC2)cc1	745795230	CMGSMLMKBCGZTF-UHFFFAOYSA-N	429.433	1.922	50	20	IDGD	
C[C@@H](c1ccccc1)[C@@](C)(O)C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	747413608	UDWHZMRMTCYZAS-HRAATJIYSA-N	433.530	1.705	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)Cc1ccc(NS(=O)(=O)c2ccc(F)cc2)cc1	747429983	YBXFTPYTPUPVQA-UHFFFAOYSA-N	442.472	1.954	50	20	IDGD	
COc1ccc(-c2nn(Cc3ccccc3)cc2C(=O)NNC(=O)C(=O)N2CCCC2)cc1	748247149	LQNCWORESCYIIK-UHFFFAOYSA-N	447.495	1.990	50	20	IDGD	
COc1ccccc1N1CC[C@H](CNC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)C1	749932230	RQDRBMOJISCJKY-QRWLVFNGSA-N	426.473	1.692	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N[C@H]1CC(=O)N(C2CC2)C1	750654557	CVMAZADFKKSKCJ-JQWIXIFHSA-N	425.283	1.310	50	20	IDGD	
Nc1cc(Br)cc(C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c1	753394899	XRBLGNLNZLFVRE-UHFFFAOYSA-N	437.206	1.558	50	20	IDGD	
C[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	755313017	PPOYRTRGHNQCIN-NXEZZACHSA-N	448.929	1.298	50	20	IDGD	
COc1ccc(I)c(NC(=O)NNC(=O)Cn2nc(C)cc2C)c1	756274557	KTCHICKKOJSWSP-UHFFFAOYSA-N	443.245	1.966	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1	756611305	RYOWANABBHKALC-LBPRGKRZSA-N	434.430	1.975	50	20	IDGD	
CNS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2cc(-c3ccc(C)cc3)[nH]n2)cc1	756640399	MABNPQOUKCIKQZ-UHFFFAOYSA-N	428.474	1.760	50	20	IDGD	
CCOC(=O)[C@@H](C)NC(=O)c1ccc(NC(=O)NNC(=O)c2ccccc2OC)cc1	756789986	KLHFHZZJLHNMGW-CYBMUJFWSA-N	428.445	1.843	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N2CCO[C@@H]([C@H]3CCCO3)C2)cc1Br	756937545	YEOWSOOZLNYZAX-HUUCEWRRSA-N	428.283	1.692	50	20	IDGD	
CCOc1ccc(-c2nnc(S)n2CCC(=O)NNc2ccc(C(N)=O)nn2)cc1	757402164	ITGLZDDAEYHBFW-UHFFFAOYSA-N	428.478	1.055	50	20	IDGD	
CC[C@H](C)NS(=O)(=O)c1cccc(NC(=O)NNC(=O)c2cncc(NC(C)=O)c2)c1	757711781	RSTAHTCHMKNVOX-LBPRGKRZSA-N	448.505	1.583	50	20	IDGD	
C=CCC(CC=C)C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	758371002	SFNBNJJQCFPORG-UHFFFAOYSA-N	435.546	1.556	50	20	IDGD	
CCCc1c(NC(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)cnn1-c1ccc(F)cc1	760130293	CYWLLQMIGGJFEM-NSHDSACASA-N	426.474	1.054	50	20	IDGD	
Cc1cc(N2CCCS2(=O)=O)ccc1C(=O)NNC(=O)CCNC(=O)OC(C)(C)C	760442363	JYCFNXYYIJSDTE-UHFFFAOYSA-N	440.522	1.211	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)c1ccc(C[C@@H]2CC(=O)NC2=O)cc1	762370269	IWKFTSXEWYUMAB-OAHLLOKOSA-N	427.482	1.454	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)CN3C(=O)c4cccc([N+](=O)[O-])c4C3=O)n[nH]2)cc1	762957898	YTOQSHYDODOTHA-UHFFFAOYSA-N	448.395	1.351	50	20	IDGD	
CC[C@H](C)NS(=O)(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)c2ccccc2)c1	763431317	SEABLJILBKSNBU-AWEZNQCLSA-N	432.502	1.304	50	20	IDGD	
C[C@@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)cc2)CCO1	763442858	UJDPHSUBVHMKAD-CYBMUJFWSA-N	427.417	1.220	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)C(=O)Nc1cccc(Cl)c1F	763529963	DUIFBEHWNXNDMD-UHFFFAOYSA-N	447.898	1.777	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(CCN3CCSCC3)cc2)c(C)o1	763582435	HHPPCRYHGGOSBU-UHFFFAOYSA-N	430.530	1.887	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(C)c(C(=O)NC(C)C)c1	763664192	SFQVKGYEQDNTHG-UHFFFAOYSA-N	442.472	1.307	50	20	IDGD	
COc1ccc(CN(C)C)cc1NC(=O)C(=O)NNC(=O)COc1ccc(C)c(C)c1	763667770	VOYCJEXBTAEWOT-UHFFFAOYSA-N	428.489	1.539	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)n(-c2ccccc2)n1	763733989	JVYGJWQNHYVMMD-UHFFFAOYSA-N	432.484	1.719	50	20	IDGD	
N#CCCCOc1cccc(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)c1	763746511	ZJEHUYXDAGMRAK-UHFFFAOYSA-N	435.484	1.908	50	20	IDGD	
Cc1cc(C(=O)NC(C)C)ccc1NC(=O)C(=O)NNC(=O)c1cccc(N(C)C)c1	763754986	YRAKFOVGUDHOFL-UHFFFAOYSA-N	425.489	1.599	50	20	IDGD	
CCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)CSc2ccc(C)cc2)c(C)c1	763890909	IGWYYTDSHZDAGT-UHFFFAOYSA-N	428.514	1.931	50	20	IDGD	
O=C(NNC(=O)c1ccc(Br)s1)C(=O)Nc1cccnc1OCC(F)F	763941672	RPWLMGIAQBMCDL-UHFFFAOYSA-N	449.233	1.949	50	20	IDGD	
CCN1CCN(c2ccc(Cl)cc2NC(=O)C(=O)NNC(=O)c2cccn2C)CC1	763994039	VUGXCKXGSYBKJV-UHFFFAOYSA-N	432.912	1.220	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1cccc([C@@H]2CNC(=O)C2)c1	764012899	ULSWUQXKYIPROF-LBPRGKRZSA-N	430.848	1.352	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2cc(C(F)(F)F)ccc2F)c1	764077224	JNZRWYYKFXWLPN-UHFFFAOYSA-N	447.366	1.648	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(CN3C[C@H](C)O[C@H](C)C3)c2)c(O)c1	764111677	YTTITYCHGMGYSD-IYBDPMFKSA-N	440.500	1.710	50	20	IDGD	
COCCOc1ccc(Br)cc1NC(=O)C(=O)NNC(=O)c1ccoc1	764160267	QTQPDITWFTULQV-UHFFFAOYSA-N	426.223	1.467	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1cc(F)ccc1Br	764277665	GHOJRJPGQSTGDW-UHFFFAOYSA-N	426.198	1.459	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)C(=O)Nc1cccc(COCC(F)(F)C(F)F)c1	764354174	MPNZNNONQSKMOQ-UHFFFAOYSA-N	442.369	1.827	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)N(C)[C@H]3CCCN(C)C3)cc2)o1	764370020	KRMBIVDCBJZELJ-KRWDZBQOSA-N	441.488	1.154	50	20	IDGD	
O=C(NNC(=O)C(F)(F)Oc1ccccc1)C(=O)Nc1cc2c(cc1Cl)OCCO2	764371326	YHQKJOFAGGNOPS-UHFFFAOYSA-N	441.774	1.869	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2cccs2)[nH]n1)C(=O)Nc1c(F)cccc1-n1cccn1	764382995	UCYYSNBKXFPSPK-UHFFFAOYSA-N	439.432	1.863	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)C(F)(F)C1(O)CCC1	764752518	KJSFUVCWLZHXGK-UHFFFAOYSA-N	430.883	1.155	50	20	IDGD	
CCCS(=O)(=O)N1CCCC[C@H]1C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C	765323056	NDXIZLFTQSEXOG-AWEZNQCLSA-N	434.559	1.033	50	20	IDGD	
O=C(CSc1nnc(-c2ccncc2)n1Cc1ccco1)NNC(=O)Cc1cccnc1	765421572	WPZTUSBEDHTRCQ-UHFFFAOYSA-N	449.496	1.859	50	20	IDGD	
CC(=O)Nc1cc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)ccc1F	765738923	PZZYPPCKUSXFGW-UHFFFAOYSA-N	441.463	1.003	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)[C@H]1C[C@H]1c1c(F)cccc1F	765739503	WBZOTKGLHKGTGD-SJORKVTESA-N	442.466	1.674	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)C[C@H]3OC(=O)c4ccccc43)CC2)cc1	765756311	TXUNOUSZINXIDB-OAQYLSRUSA-N	436.512	1.562	50	20	IDGD	
Cc1nc(O)c(C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1Br	765973563	JUALUEUFNUJLJZ-UHFFFAOYSA-N	432.234	1.180	50	20	IDGD	
CCOC(=O)N[C@H](C(=O)NNC(=O)CN1CCN(Cc2ccc(C)cc2)CC1)C(C)C	766641859	FTZBTAXADDPKAK-FQEVSTJZSA-N	433.553	1.031	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)c3cc(C)ccc3S(N)(=O)=O)n[nH]2)cc1	767886568	KHGHFJBFIGPEKM-UHFFFAOYSA-N	427.486	1.670	50	20	IDGD	
CC(C)(O)C(=O)NNC(=O)c1cc(-c2cccnc2)nc2c1cnn2Cc1cccnc1	768244840	OYGFMPGXWRINGX-UHFFFAOYSA-N	431.456	1.469	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@H]2CCOC3(CCCC3)C2)cc1	769177474	YUSVSPMOMUWWQU-INIZCTEOSA-N	438.550	1.438	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)N[C@H]2CCO[C@]3(CCSC3)C2)c2ccccc2c1=O	769229682	FITWYJOREVAZEY-LHSJRXKWSA-N	445.545	1.976	50	20	IDGD	
CCn1nnnc1-c1cccc(NC(=O)NNc2c(OC)cccc2S(C)(=O)=O)c1	769237875	BJEIYFBTWMGSDI-UHFFFAOYSA-N	431.478	1.921	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(F)(F)c1ccc(OCC(=O)N(C)C)cc1	769459441	MFNBKMPAGQSVNC-UHFFFAOYSA-N	435.427	1.644	50	20	IDGD	
CC(C)(C)OCc1cc(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)no1	770208028	JIHIXCWXQJQVRV-UHFFFAOYSA-N	430.870	1.365	50	20	IDGD	
CSCCNC(=S)NNC(=O)c1cc(NC(=O)OCC(F)(F)F)ccc1O	770241102	UHQCHKKNZAEATG-UHFFFAOYSA-N	426.442	1.975	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)NCCNS(=O)(=O)c1cccs1	770659758	VDGQCDCQHVMFHA-NSHDSACASA-N	446.938	1.478	50	20	IDGD	
CCN1CCN(c2cccc(NC(=O)C(=O)NNC(=O)Cc3ccccc3OC)c2)CC1	770772304	VRZYSJJHSDWIPI-UHFFFAOYSA-N	439.516	1.166	50	20	IDGD	
COc1cccc(-n2c(C)nnc2SCC(=O)NNc2nc(O)c3cnn(C)c3n2)c1	770968732	LYEZCAMGOIIDSR-UHFFFAOYSA-N	441.477	1.202	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1ccc(S(=O)(=O)N2CCC(C)CC2)cc1	771940403	RMYJQDZSWCPQES-AWEZNQCLSA-N	425.507	1.210	50	20	IDGD	
CC(C)(C)OC(=O)N1CCSC[C@H]1CC(=O)NNC(=O)Cn1cnc2ccccc21	772221243	JHQWEAVODAEXIS-CQSZACIVSA-N	433.534	1.926	50	20	IDGD	
N#Cc1ccc(NNC(=O)C(=O)N2C[C@H](C(=O)N3CCCCC3)Oc3ccccc32)cc1	773696404	AHCQSRRVSRUKCZ-HXUWFJFHSA-N	433.468	1.808	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2cnc(C3OCCO3)s2)c2ccccc2c1=O	773712309	KXIYARRKMMCYST-UHFFFAOYSA-N	429.458	1.383	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(C(=O)N3CCOCC3)c2)cc1F	773887359	ANCQNZIILCYJQT-UHFFFAOYSA-N	428.420	1.006	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccn(-c2ncccc2F)n1	774001727	ITPMICFKBFCBTG-NSHDSACASA-N	446.826	1.613	50	20	IDGD	
CN(C)C(=O)[C@H]1CC[C@H](CNC(=O)NNC(=O)c2ccc(F)cc2Br)O1	775462226	WWJJAPOZRCEDJL-ZWNOBZJWSA-N	431.262	1.168	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccc(NC(=O)NNC(=O)COc2ccc(F)cc2)nc1	776063846	XOGVEIQNEVQVCA-UHFFFAOYSA-N	439.469	1.529	50	20	IDGD	
C#C[C@H](NC(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12)[C@H]1CCCO1	776230233	KFIVPSWFYKXZLG-VQTJNVASSA-N	445.479	1.570	50	20	IDGD	
CC[C@H](C)NS(=O)(=O)c1ccc(C(=O)NNc2cccc(S(C)(=O)=O)c2)cc1	776532445	AOYDORIWOQIRKX-ZDUSSCGKSA-N	425.532	1.924	50	20	IDGD	
O=C(NNC(=O)N1CC[C@@H](C(=O)NCC(F)(F)F)C1)c1cccc(Br)c1	777567957	VIXUJGCPQWHMEW-SNVBAGLBSA-N	437.216	1.804	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)CNC(=O)OC(C)(C)C)c(Cl)cc1F	777941295	QYXVXOMENKFTIW-UHFFFAOYSA-N	439.849	1.100	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)CNC(=O)OC(C)(C)C)N1CCN(c2ccccc2)CC1	778605861	UFIIDJIQOXMSND-INIZCTEOSA-N	434.541	1.052	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)[C@H]1CCCN1C(=O)c1ccccc1O	781011959	BHSKFYHHPAMRPX-MRXNPFEDSA-N	444.875	1.114	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)Cc2csc(NC(=O)c3ccco3)n2)c1	782304615	HMNDXAMPHNAZJQ-UHFFFAOYSA-N	442.453	1.844	50	20	IDGD	
NC(=O)CCOc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2Cl)cc1	782925560	KLDUOWRYXIDJEE-UHFFFAOYSA-N	439.255	1.647	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccc(C#N)c(Cl)c2)nc1	783263740	KRGJKSSMSSRTHQ-UHFFFAOYSA-N	436.881	1.375	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)(F)F)cc1)C(=O)Nc1cnn(CC(F)F)c1	783407347	APULBUIQINHCLN-UHFFFAOYSA-N	441.338	1.524	50	20	IDGD	
CC(C)(C)Cc1cc(NC(=O)C(=O)NNC(=O)C(=O)N2CCCC2)n(-c2ccccc2)n1	783998766	GMPURUOLDVSJNV-UHFFFAOYSA-N	440.504	1.169	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)C(=O)Nc1ccccc1SCC(F)(F)F	784003881	DFUBYGDTYZZRGD-UHFFFAOYSA-N	444.391	1.450	50	20	IDGD	
Cc1cc2c(cc1NC(=O)C(=O)NNc1c(F)cc(C(=O)NC3CC3)cc1F)OCO2	785099915	MXHLXHSZMZJJAD-UHFFFAOYSA-N	432.383	1.976	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)Nc1cnc(N2CCN(C(=O)OC(C)(C)C)CC2)nc1	786187172	SLAFJZVZRSVKMR-UHFFFAOYSA-N	444.496	1.339	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCCc2ccc(F)c(F)c2)cc1	786819678	SCBHHWDDUWVLCN-UHFFFAOYSA-N	440.472	1.467	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)C(=O)Nc1ccc(Oc2cccc(F)c2F)nc1	787543615	ZKERSERXCYCDBS-UHFFFAOYSA-N	427.367	1.876	50	20	IDGD	
COC(=O)c1cncc(S(=O)(=O)NNC(=O)c2sc(-c3ccccc3)nc2C)c1	788476900	HLUKMWFJDFAOSW-UHFFFAOYSA-N	432.483	1.923	50	20	IDGD	
COC(=O)c1cncc(S(=O)(=O)NNC(=O)c2ccc(Br)cc2Cl)c1	788494102	PEVCOYWEIWGDQP-UHFFFAOYSA-N	448.682	1.907	50	20	IDGD	
Cc1cc([C@@H](CC(=O)NNC(=O)C(=O)NC2CC2)NC(=O)OC(C)(C)C)cc(Cl)n1	788495731	PXMQODAUKWLBEG-CYBMUJFWSA-N	439.900	1.425	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)NCCC(=O)NNc2nnc(-c3ccccn3)s2)cc1	788590612	DITYITBRQSVALN-UHFFFAOYSA-N	446.514	1.614	50	20	IDGD	
CN(C)[C@H]1CCOc2c(NC(=O)C(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)cccc21	789730362	PAUACCZUSXTDJB-INIZCTEOSA-N	427.417	1.380	50	20	IDGD	
CN(C)CC(=O)NNC(=O)C(=O)Nc1ccc(Oc2ncc(Cl)cn2)c(Cl)c1	789735020	JCXHXKWFFZBAAI-UHFFFAOYSA-N	427.248	1.223	50	20	IDGD	
O=C(NNC(=O)[C@H]1OCC[C@H]1c1ccccc1)C(=O)N1C[C@@H]2CCCN2c2ccccc21	789809984	JSVYKCRNHTULDF-WFXMLNOXSA-N	434.496	1.722	50	20	IDGD	
CS(=O)(=O)c1cc(CNC(=O)NNC(=O)Cc2ccncc2)cc(C(F)(F)F)c1	790865044	OZNCEBKRPUHNLW-UHFFFAOYSA-N	430.408	1.577	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)[C@@H]2CC(=O)C[C@H](C)[C@H]2C(=O)NNc2nc(C)cc(C)n2)n1	791122570	AQFBOBIVOUDLMS-LZVXQISVSA-N	440.508	1.318	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2ncsc2C(F)(F)F)cc1	792017347	GYWINFQQYRKNTE-UHFFFAOYSA-N	436.437	1.552	50	20	IDGD	
CC[C@@H](C)n1ncc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3OC)[nH]n2)c1C	792266253	OXXGZNHOUDCOKL-GFCCVEGCSA-N	439.476	1.961	50	20	IDGD	
CNC(=O)c1cc2cc(NC(=O)C(=O)NNc3ccc(Br)nc3)ccc2[nH]1	792361696	OJMGHALCTLHGET-UHFFFAOYSA-N	431.250	1.767	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)c1ccc(Cl)c(NS(C)(=O)=O)c1	795169281	LHZOUDVKDMMXSE-UHFFFAOYSA-N	446.938	1.719	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2nnn(Cc3ccncc3)c2C)cc1Br	796384102	MVWWVTROKSEAIV-UHFFFAOYSA-N	445.277	1.876	50	20	IDGD	
CNC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2F)c(C)c1	797011884	LSICEECOLKKHOY-UHFFFAOYSA-N	436.827	1.312	50	20	IDGD	
CC(C)(C)Nc1ccccc1NC(=O)C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	799259163	URNIPIBGOQAELF-UHFFFAOYSA-N	432.502	1.700	50	20	IDGD	
Cc1nc(N2CCOCC2)nc(O)c1CCC(=O)NNC(=O)Nc1ccc(Cl)cc1	802015392	LPBUINVVDFRDEA-UHFFFAOYSA-N	434.884	1.766	50	20	IDGD	
O=C(CS(=O)(=O)Cc1cccc(Br)c1)NNC(=O)N=c1cc[nH]cc1	802032245	DNPGJDHITKLTPK-UHFFFAOYSA-N	427.280	1.034	50	20	IDGD	
COCCCn1c(S)nc2cc(C(=O)NNC(=O)N=c3cc[nH]cc3)ccc2c1=O	802033699	KEBHDWMDJULGEM-UHFFFAOYSA-N	428.474	1.005	50	20	IDGD	
CN1CCN(Cc2ccc(C(=O)NNC(=O)Nc3ccc(S(C)(=O)=O)cc3)cc2)CC1	802065459	AWWBXPMXHXDSAX-UHFFFAOYSA-N	445.545	1.304	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)N[C@@H]2CCN(C(=O)Nc3ccccc3)C2)cc1	802498533	HWURIJXSLJCYRU-MRXNPFEDSA-N	427.461	1.711	50	20	IDGD	
CC(=O)N[C@@](C)(C(=O)NNc1ccc2c(=O)[nH]ccc2c1)c1ccc(S(C)(=O)=O)cc1	803433572	TUIPCMGUNPJAII-OAQYLSRUSA-N	442.497	1.426	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N2CCn3nccc32)cc1	803660082	RPXZXOKJHIEMAA-VBKFSLOCSA-N	431.456	1.584	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)[C@@H](C)n2ccc3ccccc3c2=O)n1	805628937	LPNJRVPHWQCGHO-CYBMUJFWSA-N	428.470	1.261	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(NC(=O)NNC(=O)CSc2ccccc2O)ccc1F	806544002	QCPIGYTZVQZVCX-UHFFFAOYSA-N	442.494	1.727	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)[C@H](NC(=O)c1ccccc1)c1ccccc1	807081666	GGRNBWUPDMOBHV-HXUWFJFHSA-N	431.452	1.130	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)c1cc([N+](=O)[O-])ccc1N1CCOCC1	807211434	SJLRKCKTZOZDHL-UHFFFAOYSA-N	437.453	1.107	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)NCCCN2C(=O)c3ccccc3C2=O)nc2ccccc21	807494725	LJORXDAMAUDZJZ-UHFFFAOYSA-N	434.456	1.133	50	20	IDGD	
COC[C@]1(C(=O)NNc2ccc(S(C)(=O)=O)cc2)CCN(C(=O)OC(C)(C)C)C1	810681830	YCFIWSRFMRRUSN-IBGZPJMESA-N	427.523	1.807	50	20	IDGD	
COc1ccc2c(c1)C1(CC1)CN(C(=O)NNC(=O)c1csc(N3CCOCC3)n1)C2	811851886	WWHPNNYDUVGUIL-UHFFFAOYSA-N	443.529	1.890	50	20	IDGD	
COC(=O)c1scc(C)c1NC(=O)C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	813034006	VCLYRYWTPHSWNE-UHFFFAOYSA-N	440.503	1.175	50	20	IDGD	
Cc1ccc(CN(C)C)cc1NC(=O)C(=O)NNc1ccccc1S(=O)(=O)N(C)C	815750579	FBPMEKIGRBLNQD-UHFFFAOYSA-N	433.534	1.389	50	20	IDGD	
O=C(COC(=O)CSc1ccc2c(c1)OCCO2)NNC(=O)c1ccc([N+](=O)[O-])cc1	849132492	OLIWKZPZLKXOKO-UHFFFAOYSA-N	447.425	1.463	50	20	IDGD	
CCOCc1nc(C)c(C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)s1	857431186	DUPDADLEHXALGF-UHFFFAOYSA-N	425.536	1.664	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)c2cc(S(=O)(=O)NC(C)C)ccc2F)c1	914712265	HPMOJORNUTZRBW-UHFFFAOYSA-N	439.465	1.604	50	20	IDGD	
COc1ccnc(NNC(=O)CCCN2C(=O)c3ccc(Br)cc3C2=O)n1	914762631	YTCQTVXIJYBRGF-UHFFFAOYSA-N	434.250	1.767	50	20	IDGD	
COc1ccc([C@@H](CNC(=O)NNC(=O)c2ccccc2F)N2CCOCC2)cc1OC	915895428	NXGHNLXMPGMIRO-GOSISDBHSA-N	446.479	1.860	50	20	IDGD	
NS(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2cc3c(s2)CCCCC3)s1	915906187	PXBZDQVXQVRAAM-UHFFFAOYSA-N	428.561	1.870	50	20	IDGD	
CCS(=O)(=O)NCCNC(=O)NNC(=O)CCCOc1ccc(Cl)cc1Cl	916516984	VBENEKJQZRIYBX-UHFFFAOYSA-N	441.337	1.422	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)N[C@H]1CCCN(Cc2ccccc2)C1	916607720	MXVYBBGBWBSUPR-KRWDZBQOSA-N	444.561	1.588	50	20	IDGD	
CC(C)N1C(=O)c2ccc(C(=O)NNC(=O)Cc3c[nH]c4ccccc34)cc2S1(=O)=O	916745644	AMSIAJIIZPYTFB-UHFFFAOYSA-N	440.481	1.725	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)CN2C(=O)N[C@@](C)(c3ccc(C)cc3)C2=O)cc1	919835672	OJMSZCLFBKYYNC-QHCPKHFHSA-N	438.484	1.551	50	20	IDGD	
O=C(NNC(=O)c1ccccc1OCc1cn2ccccc2n1)N[C@H]1CCS(=O)(=O)C1	919889561	OEEFCLXGJLGNHF-AWEZNQCLSA-N	443.485	1.044	50	20	IDGD	
C[C@H](CC(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1)n1ccnc1	920426042	CEFKLUUNVPXGCX-MRXNPFEDSA-N	430.472	1.997	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@H](C)Cc3c(C)n[nH]c3C)CC2)cc1	1116292431	HYIOWYAPLKXRRN-QGZVFWFLSA-N	426.565	1.479	50	20	IDGD	
Cc1nc(N(C)C)sc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	1319892271	FCOPEPAOPMMVOY-UHFFFAOYSA-N	437.547	1.377	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCC(=O)NNC(=O)CCc2ccc(OC)cc2)cc1	1324585559	CIYZSJIKDHFANI-UHFFFAOYSA-N	435.502	1.152	50	20	IDGD	
Cn1c(C(=O)O)cc(Br)c1C=NNC(=O)c1csc(N2CCOCC2)n1	1339160189	ATYSCUCMBNSJLK-UHFFFAOYSA-N	442.295	1.543	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4c(c3)n(C)c(=O)n4C)C2)C1	1777867692	QXADGSXHICDMLI-YCRPNKLZSA-N	434.924	1.338	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(C)(C(=O)N2CC[C@]3(CN(C(=O)[C@@H](F)Cl)CCO3)C2)C1	1778315156	WBVCWGCBXQZYHH-YJYMSZOUSA-N	433.908	1.608	50	20	IDGD	
CC(C)(C)c1cnc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](O)CCl)C3)cn1	1778414786	ZHGLBDKKVJMASS-LUQKVYGDSA-N	438.956	1.501	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc4cn[nH]c4cn3)C2)C1	1778780334	BRPCNSNBZOQHPO-QZTJIDSGSA-N	426.304	1.638	50	20	IDGD	
O=C1COc2ccc(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)[C@H](F)Cl)C4)cc2N1	1779049293	LFDMKROMMPYMOQ-OXFYSEKESA-N	439.871	1.679	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cccn(C(F)F)c3=O)C2)C1	1779363733	YBQIIXIAXJPSAX-PIGZYNQJSA-N	448.264	1.470	50	20	IDGD	
COc1ccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)CO[Si](C)(C)C)C3)nn1	1779951653	LTILGRPLZQIWDM-OXQOHEQNSA-N	436.585	1.464	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H]1CC[C@@H]3CCC(=O)N3C1)C2	1780707218	FFLWUSKOIUPURD-AISJGGJLSA-N	439.984	1.919	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)nc(O)c1)C2	1780713509	WAENJDFPQQKWDD-UPRAQXHNSA-N	446.331	1.857	50	20	IDGD	
O=C([C@H](O)CCl)N1CCO[C@@]2(CCN(C(=O)C3(c4ccc(F)c(F)c4)CC3)C2)C1	1780922607	PZASRMSHKXSMEW-APWZRJJASA-N	428.863	1.426	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)Br)C1	1782002935	XUNRMXOPVUKCEC-BCUIYNNISA-N	425.751	1.538	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCn2ccnn2)C1	1782566107	VMRZFYLRVFRIKZ-HDMKZQKVSA-N	442.358	1.356	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cnn4cccnc34)CCO2)C1	1783350004	XZOMMNSYYDFEGU-KSSFIOAISA-N	436.310	1.346	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3nn[nH]c3C(F)(F)F)CCO2)C1	1783537100	LLRLNQRASQCTNY-OQPBUACISA-N	440.220	1.050	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)C#Cc3ccc(Cl)cc3)CCO2)C1	1783871797	VVONZZVAKNVSMW-YLJYHZDGSA-N	425.312	1.775	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)/C=C/c3ccccc3[N+](=O)[O-])CCO2)C1	1783884450	SDTWFGSWFXQJHR-BGJVTSJYSA-N	437.880	1.692	50	20	IDGD	
CC(C)n1cnc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]3C2)n1	1783965850	VXCAFHNWARBBQE-AJNGGQMLSA-N	442.358	1.483	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4ccccn4n3)C[C@@H]21	1783965946	XRXIOSAZNRYSOJ-DNUAJFIVSA-N	449.349	1.959	50	20	IDGD	
C[C@@H]1CCc2c(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)CCBr)[C@H]4C3)n[nH]c21	1786406824	IVERSRIYHDLAHI-DHMWGJHJSA-N	439.354	1.838	50	20	IDGD	
CC(C)(C)OC(=O)NCC1(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]3C2)CC1	1787444650	DZPOEUNFNOXXFK-ZQDZILKHSA-N	447.935	1.805	50	20	IDGD	
CCOC(=O)/C=C/C(=O)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1	1787652551	AYFMSDMHABYKBX-OUKQBFOZSA-N	436.273	1.233	50	20	IDGD	
C=C(C)CC(C)(C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1	1788611053	HZMQJVLDYDNQPT-SNRMKQJTSA-N	443.548	1.271	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3n[nH]cc3[N+](=O)[O-])[C@H]2C1	1788813128	GQRUJUBWKOOLQQ-ZPFDUUQYSA-N	444.286	1.085	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cncc(C(F)(F)F)c3)[C@H]2C1	1789017929	DUIVNUFFPQVKED-KSYCFECVSA-N	449.857	1.948	50	20	IDGD	
Cc1nc2ccc(F)cn2c1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Cl)C[C@@H]21	1790380956	FSGKOEKXYAZWEO-PLNCSYRRSA-N	426.851	1.910	50	20	IDGD	
NC(=O)[C@H](N)CCC(=O)NC1(c2ccc(NC(=O)[C@H](F)Br)cc2)CCC1	1790534842	UFEIHJAQJJGWCX-OCCSQVGLSA-N	429.290	1.404	50	20	IDGD	
COc1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)cc1F	1792749991	LQCDEUUQFPXYPG-BCDXTJNWSA-N	426.253	1.080	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2)c1cc(=O)c2ccccc2o1	1792762785	VJBFBTBGTYALCH-DBWKPXFBSA-N	449.301	1.781	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(Cl)ccc1F)c1ccc(B(O)O)cc1	1792772335	WIDAILOHEJLVQA-BJWYYQGGSA-N	430.672	1.725	50	20	IDGD	
CCOc1c(F)cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](O)CCl)cc1Cl	1792980689	UJECWKBYFCAKDR-NOXHYTERSA-N	449.306	1.681	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCc1cc(F)ccn1	1794027151	SKUQKICGWGPACN-KOFHJDLBSA-N	428.302	1.526	50	20	IDGD	
Cc1cncc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Br)C3)c1	1794073814	LUGBMGREWXEBAL-FSDCSDTHSA-N	428.302	1.603	50	20	IDGD	
C[C@@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)n1cccc1C=O	1795750717	WDRQEUNOKXUFPB-QIRZIZBZSA-N	430.274	1.142	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCn1c(=O)oc3ccccc31)C2	1799263248	HTGIVJXEIJLYMW-YGTYGHESSA-N	435.908	1.592	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1n[nH]c3c1CCCC3)C2	1799275504	SWNVVMHYKPZIDV-CVGJEZRXSA-N	429.348	1.728	50	20	IDGD	
CN(C)c1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Br)cc1	1799348887	RHZKIVYKNHQPNX-OCVGTWLNSA-N	428.302	1.646	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cn3ccsc3n1)C2	1800759679	ZVEZJEYWKBCJHW-KQXIARHKSA-N	427.324	1.382	50	20	IDGD	
Cc1ncc(/C=C/C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)Br)C3)s1	1801494210	MPUPPEQWKQBJOV-WXDAGQQPSA-N	428.352	1.838	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc3cccnc3n2)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803142859	LDNQRNDJAMOKIX-YTQUADARSA-N	439.903	1.944	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2ccns2)[C@H]1c1cccnc1	1805220726	JVYFCBWFPHLBFV-HNAYVOBHSA-N	430.534	1.231	50	20	IDGD	
O=C(CCC(F)(F)F)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1806825182	HFLXCMNENQXYTB-LPHOPBHVSA-N	449.238	1.424	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1807360306	QWSFBYURAFLRAB-HOJAQTOUSA-N	443.740	1.489	50	20	IDGD	
Cn1cnc(C(=O)N2CC[C@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]2c2cccnc2)n1	1808292595	ZAEWJEDZPCPLME-HBUWYVDXSA-N	425.320	1.766	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)CCc2nc(N)n[nH]2)[C@H]1c1cccnc1	1810150703	YPWXWODNHATFKW-RLFYNMQTSA-N	433.944	1.828	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H](CNC(=O)CCC(N)=O)[C@@H]1c1cccnc1	1812634734	ZFWBCCYXLXMRBC-KEYYUXOJSA-N	425.327	1.526	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)c2cnnn2C)[C@H]1c1cccnc1	1812773209	AYHQJBBDJFMKJY-DZKIICNBSA-N	435.326	1.703	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2ccc3nncn3c2)[C@H]1c1cccnc1	1813030684	LJVWXPCHPNCQKN-AYBZRNKSSA-N	442.907	1.698	50	20	IDGD	
CC(C)C1(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)CCC1	1813665739	XXPRWXRMPMZDIV-RBBKRZOGSA-N	449.360	1.907	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)Cn2cc([N+](=O)[O-])cn2)n[nH]1	1815823830	WFURRDKOIJUYKD-TZMCWYRMSA-N	439.860	1.461	50	20	IDGD	
O=C1C[C@H](C(=O)N2CCCC[C@H]2c2cc(NC(=O)CCBr)n[nH]2)CCN1	1816784814	NYFKHSXXMLYLRL-YPMHNXCESA-N	426.315	1.713	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)CCc2cccnc2)[nH]n1)c1cccc(B(O)O)c1	1817475388	PNFFCAMTXWKRHM-HXUWFJFHSA-N	447.304	1.423	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)CCN3CCOC3=O)sc2C1	1818696916	BBRZCRCTKQXQAQ-ZJUUUORDSA-N	445.339	1.681	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CC(F)(F)F)CC2	1819795374	MBXLRWWLFNCNFD-MRVPVSSYSA-N	442.423	1.320	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2nccnc2C(N)=O)n[nH]1	1820024149	XVPHDORXMIHSGW-ZDUSSCGKSA-N	445.556	1.456	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](N)CCC(N)=O)[nH]n1	1820864175	RXCXGRUFKUBMSI-GSDQYQHOSA-N	433.340	1.231	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)[C@H](O)CCl)[nH]n2)cc1O	1821355975	PUYXNQYENZFFFM-DOTOQJQBSA-N	449.895	1.979	50	20	IDGD	
CCOC(=O)C1(C(=O)N2CCCC[C@H]2c2cc(NC(=O)[C@@H](Cl)COC)n[nH]2)CC1	1822375863	HQDGLKOTMODIEO-JSGCOSHPSA-N	426.901	1.999	50	20	IDGD	
C[C@H](C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1)n1cncn1	1823014332	UGWXXKPIFRXNQL-SOCHQFKDSA-N	431.291	1.598	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@H](C)n2cnnn2)CC1	1824096304	OKHVHDQSDQTAJL-YCPHGPKFSA-N	441.374	1.885	50	20	IDGD	
CC[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCn1ccnn1)CC2	1825453360	WXKWGRIFXGELAD-GHMZBOCLSA-N	441.355	1.910	50	20	IDGD	
O=C(CCn1ccnn1)Nc1nc2c(s1)C[C@@H](NC(=O)CCBr)CC2	1826871141	GNEWZOIIQYXGGN-JTQLQIEISA-N	427.328	1.522	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)CC(F)(F)C(=O)O)CC1	1827597656	VJMZOLGKUJITAQ-OAHLLOKOSA-N	446.495	1.089	50	20	IDGD	
CC(=O)N1CCN(CC(=O)N2CCCC[C@@H]2C2CCN(C(=O)[C@H](F)Cl)CC2)CC1	1828493031	PJOJWIMTUKIBIH-MJGOQNOKSA-N	430.952	1.305	50	20	IDGD	
Cc1onc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)c1C	1830535566	QEYHSXBOUQGOML-XIKOKIGWSA-N	444.326	1.392	50	20	IDGD	
Cc1c(F)cccc1C(=O)NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1833169848	HPCPMGDUEOSOHC-LJQANCHMSA-N	425.932	1.919	50	20	IDGD	
Cc1ncccc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)CBr)C2)C1	1834035387	NUIPPTBNLFBQKW-LIRRHRJNSA-N	440.338	1.491	50	20	IDGD	
COc1ncc(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)cc1C	1834331361	CKOJTALSCRLZOY-SFHVURJKSA-N	438.956	1.184	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)nc1	1834379423	XSIWHYIQHWLTQB-RHSMWYFYSA-N	430.274	1.151	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3nccs3)CCO2)C1	1834431307	KVUIWQUICCMHLT-MLGOLLRUSA-N	432.340	1.244	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)c1nccc2occc12	1834928051	JYPUUHVHKHTXIW-QGZVFWFLSA-N	434.924	1.613	50	20	IDGD	
Cc1cccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)c1	1835041306	BMWILUPZGJREIO-QFIPXVFZSA-N	434.609	1.845	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)c1cccc2cc[nH]c12	1835419471	SNUSGXFAXCBDKB-IBGZPJMESA-N	432.952	1.953	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)C(Cl)Cl)CC2)CC1)c1cc2ncccn2n1	1835543174	RFTQJIAMLROUTO-UHFFFAOYSA-N	439.347	1.718	50	20	IDGD	
CC(=O)O[C@@H](C(=O)NC1CCN(C2CCN(C(=O)C(Cl)Cl)CC2)CC1)C(C)C	1835651599	ZNDHCKYTCNGHRI-MRXNPFEDSA-N	436.380	1.949	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@H](C)NC(=O)NCC)CC2)CC1	1835704781	ZAZQSPZMDABYNQ-YJBOKZPZSA-N	444.020	1.673	50	20	IDGD	
O=C(C(=O)N1CCC(N2CCC(NC(=O)[C@@H](F)Br)CC2)CC1)c1ccco1	1836413313	APTWPDGPNDZDHM-MRXNPFEDSA-N	444.301	1.724	50	20	IDGD	
Cc1cccnc1CCC(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836715322	PNPSEKAOTCJMRL-FQEVSTJZSA-N	437.968	1.921	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccn4cncc4c3)CCO2)C1	1837074670	YMPYSKYBCZKJOA-NRFANRHFSA-N	434.924	1.669	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cc(=O)cco3)CC2)CC1	1837592660	BDGUCKAKWYFVFN-QGZVFWFLSA-N	426.897	1.506	50	20	IDGD	
O=C1C[C@H](C(=O)N2CCC(OC3CCN(C(=O)CCBr)CC3)CC2)CCN1	1837654599	FXIBUYRPGNRLOO-CQSZACIVSA-N	444.370	1.296	50	20	IDGD	
O=C(c1cnc(Cl)s1)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1838160868	BDFCQGJAROYENM-CQSZACIVSA-N	428.725	1.670	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)CSc3nc[nH]n3)CC2)CC1	1838636560	AJTOZESDHOTQPK-HNNXBMFYSA-N	429.974	1.913	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](C)Cn3ccnc3)CC2)CC1	1838786080	KAZCAUAWDYQYEV-LPHOPBHVSA-N	440.972	1.772	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(N(C)C)cc3)CCO2)C1	1838964304	YRXKZEVSQYVFRZ-GHTZIAJQSA-N	439.940	1.076	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CC(c4ccccc4)=NN3)C2)C1	1839148266	SNPWQNJTLRROSY-LQBOVUBWSA-N	448.951	1.226	50	20	IDGD	
Cc1nn(C)c(C)c1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2	1839150345	JUVXLWQCUXDXIE-OALUTQOASA-N	447.363	1.343	50	20	IDGD	
Cc1nc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)ccc1F	1839151387	PNLMPVZRXKCHRG-RTBURBONSA-N	448.322	1.835	50	20	IDGD	
O=C(Cc1cccs1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839198733	ARANCFITJWXVAS-ZBFHGGJFSA-N	435.315	1.438	50	20	IDGD	
O=C(c1cccc2nscc12)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1839576261	USVFFAPPUVJYFB-YJBOKZPZSA-N	427.885	1.901	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C)no3)C2)C1	1839963846	YGKMJNKYVSPYGR-DYVFJYSZSA-N	430.299	1.227	50	20	IDGD	
COc1ccccc1CC(=O)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840189677	GNQZQRVWSYUEBD-IBGZPJMESA-N	431.316	1.498	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(CO)c(F)c3)CCO2)C1	1840781659	DIYXNAUJELTWJZ-UTKZUKDTSA-N	442.915	1.796	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1c(Cl)cncc1Cl)C2	1844263183	CBLGHIOUZKLIFM-UHFFFAOYSA-N	449.298	1.518	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)C23CC(c4ccccc4)(C2)C3)C1	1847137443	WFSJOCDWBAEAJY-UHFFFAOYSA-N	430.313	1.305	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H]1CCC(=O)NC1	1847325992	VVDYBXDMLWLBIB-ASGCUOLLSA-N	428.439	1.600	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=S)Nc2ccc3c(c2)OCCO3)c1	17450697	GWPBPWBFAKWPHK-UHFFFAOYSA-N	436.515	1.340	50	20	IDGD	
CC(=O)N(c1nnc(SCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)s1)C1CC1	25771573	MMCCLUCXPBTYPM-UHFFFAOYSA-N	436.475	1.515	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)NC[C@H](O)COc2ccc3c(c2)OCO3)c1C	725890578	RXZKUULHANYDEV-XSORJCKLSA-N	441.484	1.943	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NCCc2ccn(-c3ccccc3)n2)c2ccccc2c1=O	726252380	HECFUUZQGZCVPQ-UHFFFAOYSA-N	431.456	1.306	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)c1ccc2c(c1)CC(=O)N2C	728307934	QCLSKWBYAGSCDV-GFCCVEGCSA-N	430.486	1.314	50	20	IDGD	
Cc1ccn(-c2ccc(C(=O)OCC(=O)NNC(=O)[C@@H]3COc4ccccc4O3)cc2)n1	728327961	CVTMLQDZUYDOCG-IBGZPJMESA-N	436.424	1.325	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2ccc(-n3c(C)cnc3O)cc2)n1	728733365	VIBMCIKWMBHIEQ-UHFFFAOYSA-N	429.458	1.198	50	20	IDGD	
O=C(CNC(=O)NNC(=O)c1ccc(Br)cc1Cl)NCC(F)(F)F	728948693	GACSHBDGPSHIMN-UHFFFAOYSA-N	431.596	1.725	50	20	IDGD	
C[C@H](C(=O)NC1CC1)N1CCN(C(=O)NNC(=O)c2c(Cl)cccc2Cl)CC1	728953838	DGRYDZAUPSVTDW-LLVKDONJSA-N	428.320	1.633	50	20	IDGD	
CCC(=O)Nc1cccc(CNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1	728960117	UNZFKFXJSRYVPT-UHFFFAOYSA-N	425.493	1.572	50	20	IDGD	
CCc1cccc(NC(=O)CNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1	728961212	CDPCWXYNUVRDCY-UHFFFAOYSA-N	425.493	1.225	50	20	IDGD	
NC(=O)c1ccc(/C=C/C(=O)N2CCC[C@@H]2C(=O)NNC(=O)Cc2ccccc2F)cc1	731329904	CLYNIBHQRPEVEO-VSRDTVRMSA-N	438.459	1.319	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccc(F)cc2)ccc1=O)c1nn(-c2ccccc2)cc1O	731688120	XNCSXOCYLNVCDM-UHFFFAOYSA-N	434.387	1.338	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)C1CCN(C(=O)c2ccc(Br)cc2)CC1	732082797	MBLPDMRNFCYPDI-UHFFFAOYSA-N	434.294	1.794	50	20	IDGD	
O=C1CCc2cc(S(=O)(=O)NNC(=O)c3cnn(-c4ccccc4)c3)c(F)cc2N1	733123160	VQGWMZYMVVAXCI-UHFFFAOYSA-N	429.433	1.519	50	20	IDGD	
O=C(CNC(=O)NCc1ccc([N+](=O)[O-])cc1)NNC(=O)c1cnn(-c2ccccc2)c1	733169822	AZIUNPPFQLTLRB-UHFFFAOYSA-N	437.416	1.041	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCC2(C(=O)N(C)C)CCCC2)c2ccccc2c1=O	733658916	OZTBBPYPIXRZBH-UHFFFAOYSA-N	428.493	1.009	50	20	IDGD	
NC(=O)[C@@H]1CCCN1Cc1cccc(NC(=O)NNC(=O)c2ccc(O)c(Cl)c2)c1	734160460	BJVYUUZPYPJCST-INIZCTEOSA-N	431.880	1.962	50	20	IDGD	
CCOCCCN1CC[C@H](NC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)[C@@H](C)C1	734545024	VERVMBKSGFJBDM-PXNSSMCTSA-N	428.537	1.953	50	20	IDGD	
COCCOc1ccc(-n2nc(C)c(C(=O)NNc3nc(-c4cccnc4)no3)n2)cc1	735049507	DMCPHAWFADHPNX-UHFFFAOYSA-N	436.432	1.803	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(C(=O)NNc2ccc(Cl)nn2)cc1Br	735688993	FUBQJONBWDWVEN-UHFFFAOYSA-N	434.703	1.900	50	20	IDGD	
COC(=O)c1cc(Br)cc(S(=O)(=O)NNC(=O)c2ccccc2OC)c1	736063788	VNXPHTHABROHOE-UHFFFAOYSA-N	443.275	1.868	50	20	IDGD	
CCc1ccccc1O[C@H](C)C(=O)N1CCN([C@H](C)C(=O)NNC(=O)CC(C)C)CC1	736622804	CMOWULRMBVYUTG-QZTJIDSGSA-N	432.565	1.743	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2cc(OC)ccc2Br)cs1	743256869	HLOPXOVWIURDPL-UHFFFAOYSA-N	449.304	1.929	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)[C@H](C)NC(=O)c2cc3c(C)nn(C)c3s2)cn1	743823459	ORJXHCBVKAIAKK-JTQLQIEISA-N	447.546	1.483	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1ccc(-n2cccn2)nc1	744620981	KACYDTKCCGXNAC-UHFFFAOYSA-N	428.474	1.045	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)N[C@H]2CCCN(c3ccn(C)n3)C2=O)c1C	745882561	HQICZYRVXULAEU-CVEARBPZSA-N	428.493	1.330	50	20	IDGD	
Cc1cc(=O)n(CC(=O)NC(C)C)c(C)c1C(=O)NNC(=O)C(C)(C)c1ccccc1	746239640	NAYJZVPLTKTVAZ-UHFFFAOYSA-N	426.517	1.729	50	20	IDGD	
Cc1sc2nc(CCC(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)nc(O)c2c1C	748700464	MPGQEASMKDKLHN-UHFFFAOYSA-N	438.473	1.383	50	20	IDGD	
C[C@H](C(=O)NNc1ccc(OCC(F)(F)F)cc1)N1C(=O)[C@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O	748703795	SWPAZSUROJKSLU-NSAPBPOKSA-N	427.379	1.622	50	20	IDGD	
CC(C)(C)OC(=O)NCC1CCN(CC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)CC1	748808774	QIMYKRRVYYQPPU-UHFFFAOYSA-N	435.481	1.593	50	20	IDGD	
CC[C@@H](C)NC(=S)NNC(=O)c1cc(S(=O)(=O)NCc2ccccc2)ccc1O	749760319	BSEQWUMBCAWHFE-CYBMUJFWSA-N	436.559	1.778	50	20	IDGD	
Cc1ccccc1CC(=O)N1CCN(C(=O)NNC(=O)c2cc(Br)c[nH]2)CC1	749917880	NHLBTPLZPCXXFB-UHFFFAOYSA-N	448.321	1.827	50	20	IDGD	
COC(=O)COc1c(C)cc(C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)cc1C	752568869	JFHLXTAUBYLWPH-UHFFFAOYSA-N	439.424	1.345	50	20	IDGD	
COc1cc(C)cc(CNC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1	752686670	LFYCKUIGUDFCAB-UHFFFAOYSA-N	446.529	1.932	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ncc(Cc3ccccc3)s2)cc1	756163295	GTUDMZVNLGSTPN-UHFFFAOYSA-N	440.481	1.907	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccc([S@](C)=O)c(F)c2)c1	756768925	AVEWNYODNHGUDP-NDEPHWFRSA-N	442.494	1.280	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1N1CCOC1=O	756816878	CCLKGPDLDVEMOT-KRWDZBQOSA-N	428.401	1.645	50	20	IDGD	
COC(=O)CCC(C)=NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	756870177	HHDXLCFIHCCGNA-UHFFFAOYSA-N	425.507	1.085	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1cc(-c2ccccc2)n(-c2ccccc2)n1	758041525	ZOSGYCPPSSTXRY-AWEZNQCLSA-N	427.486	1.238	50	20	IDGD	
O=C(NN/C=C1/C(=O)N(c2ccccn2)C(=O)c2ccccc21)C(=O)Nc1ccccn1	758414345	CTYKXCPVWNDBPQ-DTQAZKPQSA-N	428.408	1.264	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)[C@@H]1CC(=O)N(C)[C@H]1c1ccc(Cl)c(F)c1	759154482	UMZYOCRYJCVQOE-WBMJQRKESA-N	426.876	1.451	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cccc([C@H]3CCOC3)c2)cc1	761197310	RTMLBQQOGGCJDQ-SFHVURJKSA-N	431.514	1.581	50	20	IDGD	
CCCS(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)c2ccccc2OC)cc1F	762474892	KTUMRKILSZPKFT-UHFFFAOYSA-N	445.494	1.609	50	20	IDGD	
O=C(COCc1ccccc1)NNS(=O)(=O)c1cc(Br)cc(C(=O)O)c1	762475849	SVITUIWAQNXJEF-UHFFFAOYSA-N	443.275	1.674	50	20	IDGD	
O=S1(=O)CCN(C2CCN(S(=O)(=O)c3ccc(CCCCl)cc3)CC2)CC1	763214117	RYFFMTBTABPSBD-UHFFFAOYSA-N	435.011	1.742	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNS(=O)(=O)c1ccc2oc(=O)ccc2c1	763439748	QROZSMSNAMBPFN-UHFFFAOYSA-N	425.463	1.407	50	20	IDGD	
Cc1nc(COc2ccc(NC(=O)C(=O)NNC(=O)c3ccc4ccccc4n3)cc2)no1	763450617	OJTDOKJECBCCBZ-UHFFFAOYSA-N	446.423	1.905	50	20	IDGD	
O=C(NNC(=O)c1ccccn1)C(=O)Nc1ccc(C(=O)NCCc2ccccc2)cc1	763467642	RKTCGJKRIVOLGV-UHFFFAOYSA-N	431.452	1.454	50	20	IDGD	
COC(=O)c1c(NC(=O)C(=O)NNC(=O)c2ccc(OC)c(OC)c2)sc(C)c1C	763549825	ACHZJWWHTALKPU-UHFFFAOYSA-N	435.458	1.568	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccnn2Cc2ccccn2)c2ccccc2n1	763613802	CMYITCYKEKCGDQ-UHFFFAOYSA-N	429.440	1.583	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2cc(N3CCCC3=O)ccc2Cl)c1	763619307	RKQCGKBEFXZUOL-UHFFFAOYSA-N	444.875	1.940	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(C)c(NC(C)=O)c1C	763682838	PFHKIIHBJUHMHG-UHFFFAOYSA-N	442.472	1.825	50	20	IDGD	
CCCNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)c1	763684299	JAFBHQFBCQJPMN-UHFFFAOYSA-N	432.864	1.645	50	20	IDGD	
O=C(COc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1cccc(NC(=O)C2CC2)c1	763686792	UESHTIRSQSCBAF-UHFFFAOYSA-N	430.848	1.853	50	20	IDGD	
O=C(CSc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1cccc(-n2cnnn2)c1	763736438	UFTXIEWFRGCKDI-UHFFFAOYSA-N	431.865	1.194	50	20	IDGD	
CCCS(=O)(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2cccc(Cl)c2)c1	763748329	RGFZDUFVXWAGQB-UHFFFAOYSA-N	438.893	1.891	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2cccc(Cl)c2)c(C(=O)N(C)C)cc1OC	763751039	WCENOIKAFIQMMS-UHFFFAOYSA-N	448.863	1.459	50	20	IDGD	
C[C@@H](c1cccc(NC(=O)C(=O)NNC(=O)c2cccc(N(C)C)c2)c1)N1CCOCC1	763754994	YVDNEQWDTRTDJT-INIZCTEOSA-N	439.516	1.546	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1cccnc1Br	763848657	FKSIXOHECAJYTC-VIFPVBQESA-N	425.214	1.537	50	20	IDGD	
COC(=O)C(C)(C)c1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)cc1	763865083	IAFFJNXSRCFFSP-ZDUSSCGKSA-N	445.447	1.830	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(OCC(C)C)nc2)cc1OC	763903988	XKXPAWXHKYTSCV-UHFFFAOYSA-N	430.461	1.923	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccc(Cl)cc2)c(OCC(=O)N(C)C)c1	763931108	DEOVCZXXVSFJKZ-UHFFFAOYSA-N	446.891	1.444	50	20	IDGD	
COc1ncnc(N(C)C)c1NC(=O)C(=O)NNC(=O)c1cc2c(s1)CC[C@H](C)C2	763939218	BEPSZPLUORMVBR-JTQLQIEISA-N	432.506	1.137	50	20	IDGD	
O=C(NNC(=O)c1ccc[nH]1)C(=O)Nc1ccc(CCn2cc(Br)cn2)cc1	763979560	MYHSOSSHXDMHIV-UHFFFAOYSA-N	445.277	1.616	50	20	IDGD	
Cc1ccnn1-c1ccccc1NC(=O)C(=O)NNC(=O)c1cc(Br)c[nH]1	763994774	GEZVVPQUCFNIQA-UHFFFAOYSA-N	431.250	1.671	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccccc2C(=O)N(C)C2CCCCC2)n[nH]1	764097397	CRLNKVFUQGJGDO-UHFFFAOYSA-N	426.477	1.523	50	20	IDGD	
CCOc1cc(C(=O)N(C)C)ccc1NC(=O)C(=O)NNC(=O)c1ccc(C)cc1O	764111433	WOSWMCBWAXKOKT-UHFFFAOYSA-N	428.445	1.201	50	20	IDGD	
Cc1cc(C(=O)N2CCC(C)CC2)ccc1NC(=O)C(=O)NNC(=O)Cc1ccccn1	764267300	RSLFMSFODGXXEK-UHFFFAOYSA-N	437.500	1.591	50	20	IDGD	
Cc1cnn(-c2ccc(NC(=O)C(=O)NNC(=O)CCc3ccccc3O)cc2F)c1	764288443	GGRRWEJYCTZDET-UHFFFAOYSA-N	425.420	1.744	50	20	IDGD	
Cc1cnn([C@H]2CCCc3ccccc32)c1NC(=O)C(=O)NNC(=O)Cc1ccncc1	764352742	CRVQTDWKEPUDRM-IBGZPJMESA-N	432.484	1.841	50	20	IDGD	
CC(C)(C)c1ccc(Cn2nccc2NC(=O)C(=O)NNC(=O)Cc2ccncc2)cc1	764353510	JCGLTVBNUMXYAO-UHFFFAOYSA-N	434.500	1.953	50	20	IDGD	
COC(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(C)c(C)c3)[nH]n2)c1	764388063	OYSYGHAPKKWXNN-UHFFFAOYSA-N	449.467	1.809	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3cc([N+](=O)[O-])cnc3C)n[nH]2)cc1OC	765596937	OWIMFKFGBAMJEI-UHFFFAOYSA-N	426.389	1.780	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNS(=O)(=O)c1cc(N(C)C)ccc1Br	766320554	JVJHZAGPKARLCS-UHFFFAOYSA-N	435.344	1.129	50	20	IDGD	
CCOc1ccc(NC(=O)CN2CCN(CC(=O)NNC(=O)c3ccccc3)CC2)cc1	767067757	LPDRUXISNIKVRD-UHFFFAOYSA-N	439.516	1.103	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)CCCOc2ccc3c(c2)OCO3)cc1	767527517	FHUKPLGOVWNCBY-UHFFFAOYSA-N	425.397	1.450	50	20	IDGD	
CN(C)C(=O)c1cc(F)ccc1NC(=O)C(=O)NNC(=O)COc1ccc(Cl)cc1	768229272	APWGEOGFXIXEIL-UHFFFAOYSA-N	436.827	1.346	50	20	IDGD	
COc1cc(N2C[C@H](C(=O)NNC(=S)Nc3ccccn3)CC2=O)cc(OC)c1OC	768578027	KAZYYXJUFGJWJP-GFCCVEGCSA-N	445.501	1.478	50	20	IDGD	
O=C(NNS(=O)(=O)/C=C/c1cccc(Cl)c1)c1csc(N2CCOCC2)n1	768867444	RCBZKLSWPXYLSB-RUDMXATFSA-N	428.923	1.868	50	20	IDGD	
COc1ccc(Br)c(CC(=O)NNC(=O)CCN2C[C@H](C)O[C@@H](C)C2)c1	768930198	OFZHULRRCPCOCG-STQMWFEESA-N	428.327	1.647	50	20	IDGD	
CCOC(=O)NNC(=O)Nc1cc(S(=O)(=O)N2CCOCC2)ccc1N1CCCC1	769926272	ZKUFMNOXFRIBHD-UHFFFAOYSA-N	441.510	1.090	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)N[C@@H]1CCO[C@]2(CCS(=O)(=O)C2)C1	770785435	QJQPLVIKANGYPI-WPKBUWHJSA-N	445.925	1.174	50	20	IDGD	
CCOC(=O)N1[C@H](C(=O)NNc2nc(O)c3cnn(C)c3n2)CC[C@@H]1c1ccc(C)o1	770982976	KGGZNYQYLGWOQC-OLZOCXBDSA-N	429.437	1.776	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2ncccc2C(F)(F)F)CC1	771388592	PLKJGXYJYJAPEL-UHFFFAOYSA-N	444.439	1.188	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)c2cnn(CC(=O)NC3CCCC3)c2)cc1	772042442	MNBIPKXAQRPCCK-OAHLLOKOSA-N	443.504	1.569	50	20	IDGD	
CCS(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)c1	772890316	XWXFZXDDZZKLGV-UHFFFAOYSA-N	441.868	1.350	50	20	IDGD	
Cc1nc2ccccc2n1CCC(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	773230710	OVBVPSQHLDTAOV-UHFFFAOYSA-N	443.529	1.899	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)C(=O)Nc2ccc(S(=O)(=O)NCCC(C)C)cc2)n1	773478740	AUXBWORTTFPVQG-UHFFFAOYSA-N	434.522	1.500	50	20	IDGD	
CCOC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(C)c(F)c2)cc1C#N	773885239	KKKSMWBEUKMVJU-UHFFFAOYSA-N	427.392	1.974	50	20	IDGD	
COCCO[C@@H]1COCC[C@@H]1NC(=O)NNC(=O)c1ccc(-n2c(C)ccc2C)cc1	777278982	LSDYIZLJOFRLOL-VQTJNVASSA-N	430.505	1.859	50	20	IDGD	
Cc1nc2c(cnn2C(C)C)cc1C(=O)N1CCN(S(=O)(=O)CBr)CC1	777777013	CBENPFUNDLXVEK-UHFFFAOYSA-N	444.355	1.761	50	20	IDGD	
CCn1cc(-c2n[nH]cc2C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)cn1	778295502	QGYJECUKTQSKID-UHFFFAOYSA-N	434.460	1.659	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N[C@H](CO)C(C)C)cc1	778409208	AULIOCYUUUJNOE-NXIIHZOPSA-N	425.489	1.474	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)c1cn(C)nc1-c1cnn(C)c1	780171915	PQABGSMDIBTGIV-NSHDSACASA-N	447.293	1.812	50	20	IDGD	
O=C(NNc1ccc(Br)cn1)C(=O)Nc1ccc(CN2C(=O)CCC2=O)cc1	784341708	ROKOUGYGFKENSD-UHFFFAOYSA-N	446.261	1.575	50	20	IDGD	
CS(=O)(=O)NCc1ccc(NC(=O)C(=O)NNc2ccc(OC(F)(F)F)cc2)cc1	784802148	SURUMDQYSHHDRS-UHFFFAOYSA-N	446.407	1.716	50	20	IDGD	
O=C1CCc2ccc(NC(=O)C(=O)NNc3c(F)cc(C(=O)NC4CC4)cc3F)cc2N1	785099553	IKFXTTWFILOJFY-UHFFFAOYSA-N	443.410	1.824	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)C(=O)Nc3cnn(C)c3C(F)F)n[nH]2)c1	785130546	UDZGMPNLJNENET-UHFFFAOYSA-N	431.403	1.764	50	20	IDGD	
COc1cc(C(=O)N(C)C)ccc1NC(=O)C(=O)NNc1nc(C(F)(F)F)cs1	785143917	FKHCEFIOFHEKTF-UHFFFAOYSA-N	431.396	1.954	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)N2CCN(C(=O)/C(C#N)=C\c3ccc(F)cc3)CC2)C[C@@H](C)O1	785193964	USYRHTRZVRKHFP-VZSJXSDZSA-N	436.509	1.231	50	20	IDGD	
O=C(NNc1ccc(F)cc1F)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(Cl)cc1	785881569	MHJBKTXDMOXHKE-WBMJQRKESA-N	431.848	1.885	50	20	IDGD	
COC(=O)CCc1cccc(NC(=O)C(=O)NNC(=O)c2cccc(OC(F)F)c2)c1	786417634	UJCHCLJSWBFAND-UHFFFAOYSA-N	435.383	1.793	50	20	IDGD	
COCCc1ccccc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)NC(C)C)cn1	786422854	QSTOQWFYEHFDNB-UHFFFAOYSA-N	435.506	1.039	50	20	IDGD	
CCCCN1C(=O)CC[C@@H](C(=O)NNC(=O)N2CCN(C)CC2)[C@H]1c1ccccc1OC	788169522	QQPCZXJMOYYQPI-WIYYLYMNSA-N	445.564	1.763	50	20	IDGD	
NS(=O)(=O)c1cc(Cl)c(F)c(C(=O)NNc2nnc(-c3ccccn3)s2)c1	788557844	ANMAIPBKIJZKMA-UHFFFAOYSA-N	428.858	1.797	50	20	IDGD	
CC1(C)Cc2cccc(NC(=O)C(=O)NNC(=O)c3csc(N4CCOCC4)n3)c2O1	789594902	PFSWKMMMEIBEAA-UHFFFAOYSA-N	445.501	1.093	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)CC(=O)N3C)cc1	789741597	XLDOBMYCRHMEMX-ZDUSSCGKSA-N	440.456	1.158	50	20	IDGD	
O=C(CCOCC(F)(F)C(F)(F)F)NNC(=O)C1CCN(c2ncccn2)CC1	790586144	CXRGQZWGUAESSI-UHFFFAOYSA-N	425.358	1.445	50	20	IDGD	
CCS(=O)(=O)c1ccc([C@H](C)NC(=O)NNC(=O)CNC(=O)OC(C)(C)C)cc1	790987789	HLXXHCBJJQRCQZ-LBPRGKRZSA-N	428.511	1.396	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc(Br)cc1)NNc1nc2ccccn2n1	791256647	AALBRPXNWXZBOS-UHFFFAOYSA-N	439.295	1.304	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2cc([N+](=O)[O-])c(F)cc2N)c2ccccc2c1=O	791296816	LXCUZAWEJAWOJS-UHFFFAOYSA-N	428.380	1.511	50	20	IDGD	
COc1ccc(Cn2cc(NC(=O)C(=O)NNc3cccc(S(C)(=O)=O)c3)cn2)cc1	793018596	TZPUAHGBNWAWAD-UHFFFAOYSA-N	443.485	1.425	50	20	IDGD	
CCc1ccc(S(=O)(=O)NNC(=O)CNC(=O)OCc2ccccc2)cc1C(=O)O	794598976	QKKVCKXUIFQPRV-UHFFFAOYSA-N	435.458	1.183	50	20	IDGD	
Cc1nnnn1[C@@H](Cc1ccc(F)cc1)C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	794721188	QDLBIHLNAAJALK-SFHVURJKSA-N	447.496	1.298	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)c2ccccc2F)(S(C)(=O)=O)CC1	794761021	VRCLZJMJPJICRD-UHFFFAOYSA-N	443.497	1.401	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cc(C(F)(F)F)ccc2Br)n[nH]1	797003064	VYZZGOMDBVXBAO-UHFFFAOYSA-N	434.172	1.899	50	20	IDGD	
COC(=O)c1cc(F)c(Br)cc1NC(=O)C(=O)NNc1cncc(Cl)n1	797044394	ARRBSJCUZJXWTM-UHFFFAOYSA-N	446.620	1.900	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)c2ccc(S(=O)(=O)N(C)C)cc2)cc1C	798308107	PRGQOFXRGQJXOB-OAHLLOKOSA-N	446.529	1.443	50	20	IDGD	
O=C(NNC(=O)c1cccc(CN2C(=O)CNC2=O)c1)Nc1ccc(Br)cc1	801994688	XXKFMFSRVOLSJN-UHFFFAOYSA-N	446.261	1.967	50	20	IDGD	
COC(=O)N(C)NC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(Br)cc2)C1	804125609	WFFCIXSMFOBAQC-NSHDSACASA-N	434.312	1.579	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)c1ccc2c(c1)C(=O)N(Cc1ccco1)C2=O	804953247	IOQMQADBYWXJEY-UHFFFAOYSA-N	429.396	1.808	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1c(C)c(C(F)(F)F)nn1C	806976485	DXZMCXVZOBJKLI-UHFFFAOYSA-N	433.774	1.809	50	20	IDGD	
Cc1ccc(F)c(NNC(=O)C(=O)N2C[C@H](C[C@@H]3COCC(=O)N3)c3ccccc32)c1	807014017	NYYJLZYSJGBCLW-LSDHHAIUSA-N	426.448	1.613	50	20	IDGD	
Cn1c(=O)n(C)c2cc(N3CCCCC3)c(NC(=O)C(=O)NNc3cccc(F)n3)cc21	807391833	MISMFHUWPNWJSO-UHFFFAOYSA-N	441.467	1.483	50	20	IDGD	
CCc1nnc(NC(=O)[C@H](C)[C@H](C)NC(=O)NNC(=O)COc2ccc(F)cc2)s1	807565851	QWVOFRURJHBQOB-MNOVXSKESA-N	438.485	1.612	50	20	IDGD	
Cc1cc(C)c(C)c(S(=O)(=O)NCC(=O)NNc2nc(-c3cccnc3)no2)c1C	810340078	YDVQDTTUXPPOJF-UHFFFAOYSA-N	430.490	1.787	50	20	IDGD	
CC(C)c1cc(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)n(-c2ccccc2)n1	810385256	PMZAGRWVSGBFBF-IBGZPJMESA-N	449.467	1.922	50	20	IDGD	
COC[C@@]1(C(=O)OCC(=O)NNC(=O)c2cccs2)CCN(C(=O)OC(C)(C)C)C1	811399825	QQUPXEYPKGAAAO-LJQANCHMSA-N	441.506	1.326	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)C(=O)N3CCN(c4ccccc4)CC3)cc2C1	812451578	IKBMOQWTXXMXLZ-HNNXBMFYSA-N	426.542	1.983	50	20	IDGD	
COCC1(CNC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)CCCCC1	812613709	UTEUYXSMMYYXJV-UHFFFAOYSA-N	440.566	1.543	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2cccc(-n3ccnc3)c2)cc1	813033348	OTSQAYQPXMTYRE-UHFFFAOYSA-N	428.474	1.204	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@H](NC(=O)OC(C)(C)C)C(C)C	814225327	SNGTZOVPEFSXDK-CYBMUJFWSA-N	441.554	1.598	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)N2CCC(=NNC(=O)N=c3cc[nH]cc3)CC2)cc1	815002496	DOCQSSMEWHMWTP-UHFFFAOYSA-N	430.490	1.424	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)c2sccc2S(=O)(=O)N2CCCC2)c1	822559816	MNCDXIZRPXRCFX-UHFFFAOYSA-N	439.515	1.625	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)c1cc([N+](=O)[O-])ccc1N1CCOCC1	864000464	XNXJDDYIVWZYPR-UHFFFAOYSA-N	430.417	1.280	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)[C@H]2CC(=O)N(c3ccccc3)C2)cc1OC	914989701	UCTLBUKYCWRQPL-HNNXBMFYSA-N	441.440	1.061	50	20	IDGD	
Cn1c(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc(Cl)c1Cl	915188598	CGSOOMWLCYLDHV-UHFFFAOYSA-N	425.681	1.708	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNC(=O)CNS(=O)(=O)c2cccs2)cc1	915190582	KGGKPZPFRBHESK-UHFFFAOYSA-N	425.532	1.913	50	20	IDGD	
O=C(NNC(=O)c1cc2c(nc1O)CCC2)c1ccc(S(=O)(=O)N2CCCC2)cc1	916125347	KYTUWIQUOKIFAN-UHFFFAOYSA-N	430.486	1.135	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)NCCCN2C(=O)NC3(CCCCC3)C2=O)c1	916268751	MODHGQNPXJDIBQ-UHFFFAOYSA-N	445.520	1.657	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2cccnc2OC)c1	916398760	IIQJNMVZBBVNMI-UHFFFAOYSA-N	435.506	1.265	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)NCCN2CCN(c3ccc(F)cc3)CC2)c1	916513637	IJIXSKGUTARUEU-UHFFFAOYSA-N	443.523	1.974	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)Cn2cc(Br)cn2)c2ccccc2c1=O	916719933	KHWCACBRIVZNTP-UHFFFAOYSA-N	433.266	1.398	50	20	IDGD	
C[C@H](Oc1ccc2c(c1)CCC2)C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	918203569	BJIJTWRCSIRMKG-NSHDSACASA-N	437.905	1.705	50	20	IDGD	
CC[C@@H](NC(=O)NNC(=O)COc1ccc(F)cc1)c1ccccc1OCC(=O)NC	918222555	XRNOKUZXHQDQLE-QGZVFWFLSA-N	432.452	1.811	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NNC(=O)c2ccc(Cl)cc2O)cc1	918358304	UKQAQOZHQYILRZ-INIZCTEOSA-N	437.905	1.968	50	20	IDGD	
C[C@H]1CCCN(C(C)(C)CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)C1	919797448	MXAIMEWRFDRNEZ-HNNXBMFYSA-N	439.582	1.391	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)[C@@H]1CS[C@@]2(C)CCC(=O)N12	920768397	MFWGETYMZJWKJM-SVKFGRERSA-N	442.335	1.818	50	20	IDGD	
C[C@@H]1CN(Cc2csc(NC(=O)NNC(=O)c3ccc4c(c3)OCO4)n2)C[C@@H](C)O1	920932547	NSJOOCLJKCBMJE-VXGBXAGGSA-N	433.490	1.948	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)NCc2cccc(C(F)(F)F)c2)cc1C(N)=O	921298075	NNUMJBRMBCBLPK-UHFFFAOYSA-N	446.407	1.506	50	20	IDGD	
Cc1ccc(CCS(=O)(=O)N2CCN(S(=O)(=O)CBr)CC2)cc1	1116929362	HLXVOEDCULNNAD-UHFFFAOYSA-N	425.370	1.167	50	20	IDGD	
Cc1nn([C@H]2CCS(=O)(=O)C2)c(Cl)c1C=NNC(=O)Cc1cn2ccccc2n1	1252511744	ZNHPEVZPAGVKDN-AWEZNQCLSA-N	434.909	1.545	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN(C(=O)c2ccc3n[nH]cc3c2)C1)c1n[nH]c2c1CCCC2	1318137181	YIUMMBORYNFBEF-CQSZACIVSA-N	435.488	1.478	50	20	IDGD	
Cn1cc([C@H](NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c2ccccc2)cn1	1320064552	KWQBLEMCSMPBMO-LJQANCHMSA-N	434.504	1.547	50	20	IDGD	
COCc1nc(CNC(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)cs1	1330071204	UQULJFMLIIHGIV-UHFFFAOYSA-N	427.527	1.767	50	20	IDGD	
O=C(c1ccccc1N1CCCC1=O)N1CCN(S(=O)(=O)CBr)CC1	1342426996	VABBGMZGHMNYPK-UHFFFAOYSA-N	430.324	1.253	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)N[C@@H]1COc2c(F)cc(F)cc2C1	1346318027	CKBTULYTZGUHRJ-ZDUSSCGKSA-N	429.383	1.804	50	20	IDGD	
CCOC(=O)N1CCC(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](F)Cl)C2)CC1	1778027187	CMLFYGWMQGRPOA-JXXFODFXSA-N	447.935	1.903	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@]1(C)C[C@@H]1C)C2	1778092863	SVELAOYPQJNJEH-GHTHYRKVSA-N	443.548	1.680	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(N4C(=O)C=CC4=O)cc3)CCO2)C1	1781224744	ZYGDXEGMBDPWCJ-HTAPYJJXSA-N	445.903	1.577	50	20	IDGD	
CC(C)Cc1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)n(C)n1	1781331258	NCRGSKKUOJKQJL-CRAIPNDOSA-N	445.333	1.753	50	20	IDGD	
CCOC(CC(=O)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1)OCC	1781334350	LZUJZFJRCRZKOK-GOEBONIOSA-N	425.295	1.296	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccnnc1)C2	1781900610	FYEQPWBMOHNBRU-HDMKZQKVSA-N	425.327	1.778	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C#CC1(O)CCCCC1)C2	1782175161	FNXSWXHRLJPQOI-DBXWQHBBSA-N	440.968	1.453	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc3[nH]ccc3n1)C2	1782176181	XKKBUKRSTDAEKM-CFCCAZDESA-N	434.924	1.944	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@](C)(Cl)CCl)C2	1782178467	JUWWJSOHXVPJBY-NSNWQYSKSA-N	429.772	1.990	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C13CC(C(=O)OC)(C1)C3)C2	1782179212	IOELDMHDBFMQOA-ROIMBAQASA-N	442.940	1.097	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnc4ccc(F)cn34)C2)C1	1782464804	IEXVZJWJLZSMML-KPZWWZAWSA-N	439.285	1.700	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)Cc2cnc(C)s2)C1	1782510428	OUKOEZAHVWRYKZ-FRQCXROJSA-N	429.970	1.762	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1COc3ccccc3O1)CCO2	1783530288	WLGKEXBEQVRPHD-AXHNFQJDSA-N	439.306	1.440	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cnn(-c4cccnc4)c3)CCO2)C1	1783533290	YWXLHYWTRDFKNO-IFXJQAMLSA-N	448.321	1.494	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)c1cccnc1S	1783547555	REOOCQWQCSJBEW-UBHSHLNASA-N	428.352	1.749	50	20	IDGD	
COc1cnc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]3C2)cn1	1783968162	QVAMEXZWNGAHIL-ABHRYQDASA-N	441.326	1.110	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(C)o3)[C@H]2C1	1784694013	NTWHSBVFKQIGRQ-LVWMUPNFSA-N	441.488	1.315	50	20	IDGD	
Cn1ccc(C(=O)Nc2ccc(C3(NC(=O)c4cnccc4C(=O)NN)CCC3)cc2)n1	1787415083	UOYLZBFEJQPROS-UHFFFAOYSA-N	433.472	1.480	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ncc(F)cc3F)C[C@@H]21	1788764967	DONSTMMUPPBIID-NOLJZWGESA-N	427.524	1.805	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccn(C(F)F)n3)[C@H]2C1	1788941639	XBBZVMZAFZUKJM-ZPFDUUQYSA-N	435.269	1.655	50	20	IDGD	
Cn1ccc(=O)cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]21	1789223137	NPCBBEOCGAEXRK-HAHWVIBASA-N	430.332	1.215	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1ccc(C2(NC(=O)[C@@H]3CCCOC3)CCC2)cc1	1789523541	GLQDGUWEJDTGSZ-OAHLLOKOSA-N	437.500	1.859	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)[C@H](F)Br)CCC2)cc1)[C@H](O)N1CCOCC1	1789554699	HAAVHAGEDVGGFS-YOEHRIQHSA-N	444.301	1.462	50	20	IDGD	
CC(C)=CCCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C[C@@H]21	1789814527	KBTPXXWUWCPZNM-RWRPXTCXSA-N	443.548	1.847	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]2C1	1789871494	CSOADBYOAYZJOP-JLPNCARGSA-N	430.170	1.986	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc([N+](=O)[O-])o3)C[C@@H]21)[C@H](F)Br	1789920965	LCGQRIUXXYFGIN-PZEZNAACSA-N	434.218	1.472	50	20	IDGD	
N#Cc1c[nH]c(C(=O)Nc2ccc(C3(NC(=O)c4cnccc4C(=O)NN)CCC3)cc2)c1	1790146185	HEHBCNBSRKDNDI-UHFFFAOYSA-N	443.467	1.946	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](O)C(=O)Nc1ccc(C2(NC(=O)[C@H](O)CCl)CCC2)cc1	1790729015	CPOZOJCSHOGFLI-PBHICJAKSA-N	441.912	1.563	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3cnc[nH]3)C[C@@H]21	1790958517	SGAWIITUXHFSCD-HNKHHVNMSA-N	427.343	1.496	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)Nc3ccccn3)C[C@@H]21	1791056143	OYYPLKJTKFCLOB-QRJUGERDSA-N	439.354	1.645	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ncc(OC)cc3F)C[C@@H]21	1791252415	LGSHPMXAKFCGIX-PCBIJLKTSA-N	429.876	1.076	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2C1)c1cccs1	1791293236	PIGFZKKXPZEXFV-QAETUUGQSA-N	436.578	1.204	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)Cn3ccnc3)[C@H]2C1	1791630425	PBELBQSQTMTZPY-YXMSTPNBSA-N	427.343	1.282	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1(C)CC1)C2	1793881230	XQYJGSMLYHJYAP-XGUBFFRZSA-N	429.945	1.508	50	20	IDGD	
CC(C)NC(=O)OC(C)(C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCBr	1795114972	RYGPQRCARNHHNZ-AGGWBTHJSA-N	448.358	1.274	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](O)c1ccccc1	1795380389	KYMQCHYWLBKTCJ-JJTUDDRGSA-N	425.323	1.483	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(CC(C)C)nn1C	1796018016	HYKAUYYRNRRZNP-KPEUIFRASA-N	426.945	1.076	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)c1csc2c1CCCC2	1796191343	AXAXQPHBNFLHSS-BCDXTJNWSA-N	438.358	1.872	50	20	IDGD	
COC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C(Cl)Cl)C2	1796841061	YJLHLPYASGHPHW-YVECIDJPSA-N	438.352	1.968	50	20	IDGD	
Cc1c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Br)C3)nc2ccccn12	1796847138	JMYTYCCPMRHHLP-VZAMPYOESA-N	439.285	1.536	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(C)(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](O)CCl)C3)C1	1797890329	IEZFCMYRHZFCDZ-XGUBFFRZSA-N	429.945	1.481	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc[nH]c3nccc1-3)C2	1798440293	KMKYLGZQRLLUCG-BTTYYORXSA-N	433.472	1.079	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccnc2c1OCO2	1798469025	FMCNQVKNMLDXMH-FMSGJZPZSA-N	440.294	1.045	50	20	IDGD	
Cc1ccc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Br)cn1	1799344202	BXUDZTAWJYYGLR-FSDCSDTHSA-N	428.302	1.603	50	20	IDGD	
Cc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Br)cc(C)c1O	1799351832	CHMVRPDAOVRQDZ-HLPPOEQASA-N	429.286	1.903	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc3ncccn13)C2	1800640667	DHIJSKIWWNXPKE-QVHKTLOISA-N	436.310	1.106	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](Br)CC	1800643587	XWADGIGCVQIZPW-RKQHYHRCSA-N	435.315	1.311	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1	1800718981	ONAJYVHRYFWHRJ-BTTYYORXSA-N	438.912	1.376	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c[nH]c3ccc(OC)cc13)C2	1800976832	KKRFYJCJLPVHQU-OESLAJAZSA-N	435.908	1.634	50	20	IDGD	
C[C@@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc3n(n1)CCCN(C)C3)C2	1801966029	CWADBLZRKZGFLN-APIJFGDWSA-N	438.370	1.754	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCc1c[nH]c2ncccc12	1802067860	QIYJCAWBYYJPBG-HIRMHNASSA-N	434.924	1.339	50	20	IDGD	
O=C(Cc1cn2c(nc1=O)SCC2)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C(Cl)Cl	1802343840	LBTUGALLWMGSDF-ZSBIGDGJSA-N	431.345	1.333	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H](CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](O)CCl)C3)C1	1802578506	QOEUWVCXRHRMHS-ZOFXXKQRSA-N	443.972	1.871	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)[C@@H]1C[C@H]1C1CC1	1802991558	YQOVEXPDSHYKCR-VXSCBNMQSA-N	433.317	1.127	50	20	IDGD	
Cc1nn[nH]c1C(=O)N1CC[C@H](CNC(=O)[C@@H](C)CBr)[C@@H]1c1cccnc1	1803009802	XZRKKAULULOHRW-PEYYIBSZSA-N	435.326	1.859	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)n2ccnn2)[C@H]1c1cccnc1	1803013817	AOALTCDYNDRERF-JHNDHUHGSA-N	449.353	1.971	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc3cnccc3n2)[C@H]1c1cccnc1)[C@@H](O)CCl	1803139800	WACOAVHTACJSRV-VDGAXYAQSA-N	439.903	1.944	50	20	IDGD	
CCOC(=O)N[C@H](O)C(=O)N1CC[C@H](CNC(=O)[C@H](Cl)CC)[C@H]1c1cccnc1	1808264526	YSMGNRWTWGOEHC-KCYZZUKISA-N	426.901	1.169	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CCn2ccnn2)[C@@H]1c1cccnc1)[C@H](F)Br	1808681548	VSRPKQJFJVDSBZ-IMJJTQAJSA-N	439.289	1.460	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)c1cnn2ccncc12	1809381219	MXGRCRZSYKJCOG-QGTPRVQTSA-N	428.880	1.044	50	20	IDGD	
CC(=O)O[C@H](C(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)C(C)C	1810098238	GXPXCJVABKOHNX-MLHJIOFPSA-N	425.913	1.275	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)C2=NNC(=O)C2)[C@H]1c1cccnc1	1810224174	CBHYYZMKRJUPCF-HEHGZKQESA-N	436.310	1.137	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)[C@H](C)Cn2cncn2)[C@@H]1c1cccnc1	1812867603	SPEUGBNBODVCNG-YQFWSFKMSA-N	449.353	1.799	50	20	IDGD	
C=CCOCCCC(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1813069540	ZRDPRNLDIMOVLB-CVDCTZTESA-N	445.564	1.443	50	20	IDGD	
Cc1noc(C)c1C(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1813070144	GLKPVVRZXCELSR-LAUBAEHRSA-N	442.520	1.379	50	20	IDGD	
CCC1(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)CCC1	1815356364	FTWFOLQCKFZCMC-OAHLLOKOSA-N	427.335	1.629	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1coc(Cl)n1	1816174241	CEMAGCJNRCWGFR-HNNXBMFYSA-N	443.656	1.351	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](F)Cl)CC2	1817279893	KTBPJNMBVXTBCE-YXUOLVMDSA-N	440.888	1.724	50	20	IDGD	
Cc1ccc(CC(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)cn1	1817474058	KIZGRZREDGNWFH-FQEVSTJZSA-N	447.304	1.342	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccnc(Cl)n2)n[nH]1	1819749456	WHTROYHTKWLIHI-CQSZACIVSA-N	448.915	1.532	50	20	IDGD	
CC[C@@H](Br)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2C[C@H](O)CN2)[nH]n1	1822091093	WABRDIXUPBFTDG-XCCSTKFXSA-N	428.331	1.298	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccn3c(O)nnc23)[nH]n1	1822369498	OLRDTVDJYLYUQA-JSGCOSHPSA-N	447.883	1.718	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)ccc2O)[nH]n1	1822415653	MTWXOLREXPWRQY-INIZCTEOSA-N	444.492	1.500	50	20	IDGD	
CSCC[C@H](O)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1	1823013524	CMYZEJOLEBSHPM-POZPLHJXSA-N	440.360	1.860	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)Cc2ccccn2)CC1	1827220339	RXRHXLMLSAIZAU-QFIPXVFZSA-N	435.333	1.237	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2n[nH]cc2[N+](=O)[O-])CC1	1829163789	NMGQIVYQZATDMW-ZIAGYGMSSA-N	427.889	1.805	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCN3CCCCC3)C2)C1	1830359876	XQWBAMYWEKKAFH-NRFANRHFSA-N	429.989	1.584	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccn4cncc4c3)C2)C1	1830362353	RQIARWPOYIOZFF-OAQYLSRUSA-N	434.924	1.669	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3F)C2)C1	1830538832	RHIKZLXLPDOKQJ-FZKQIMNGSA-N	444.301	1.322	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CNC(=O)C(F)(F)F)CC1	1831834369	COPHBCOEEWGEOT-ZIAGYGMSSA-N	441.878	1.538	50	20	IDGD	
O=C([C@H](F)Br)N1CCC([C@@H]2CCCCN2C(=O)CCn2ccnn2)CC1	1832246470	HEQAOFNCVPAKFM-HOCLYGCPSA-N	430.322	1.978	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3cncc(OC)c3)CCO2)C1	1832916268	MMUNNOSRVGUCQG-RXVVDRJESA-N	439.940	1.497	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@](C)(O)C(F)(F)F)CC2)CC1	1833644171	MDVRDWYLLACKNC-YOEHRIQHSA-N	427.895	1.889	50	20	IDGD	
CCN(CC)C[C@@H](C)C(=O)N1CCOC[C@]2(CN(C(=O)CCBr)CCO2)C1	1834825345	XTDXEMCDYUBMPO-APWZRJJASA-N	448.402	1.206	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCC(N2CCC(NC(=O)CCN3CCOC3=O)CC2)CC1	1835451367	RGFRZCNEICLKPF-UHFFFAOYSA-N	442.988	1.665	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)c1cc2ncsc2[nH]1	1835849007	YDGNNHFGZHVCAU-MRXNPFEDSA-N	439.969	1.409	50	20	IDGD	
O=C(/C=C/c1cccs1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1835966214	MPGOLCKDGNRPFW-JUPLKNRCSA-N	447.326	1.908	50	20	IDGD	
O=C(Cc1cc(F)cc(F)c1)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1836123207	KIMMMQIZLUOQPK-GOSISDBHSA-N	437.270	1.767	50	20	IDGD	
O=C(c1cccc2c[nH]nc12)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836718283	UPKBJJQRZNGIPA-GOSISDBHSA-N	434.924	1.775	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4ccccn4n3)C2)C1	1837713353	YMABQGWOOALUHM-OAQYLSRUSA-N	446.580	1.256	50	20	IDGD	
C[C@@](O)(CC(=O)O)CC(=O)N1CCC(OC2CCN(C(=O)C(Cl)Cl)CC2)CC1	1838791250	LGRYJZZPXKYNLP-SFHVURJKSA-N	439.336	1.405	50	20	IDGD	
O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)c1ccccc1F)CCO2	1838854361	DKWLRFWMWRJCAC-SFHVURJKSA-N	429.286	1.681	50	20	IDGD	
O=C(/C=C/C1CCCC1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839202015	QQBBAMACIFCUMG-MMUANNJHSA-N	433.318	1.880	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)CCO2)C1	1839414651	USPWNPBFZMFHFA-LPHOPBHVSA-N	441.868	1.388	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1[C@@H]3C=CS[C@@H]13)CCO2	1839700281	KSCOLGAXRAQONM-YPIIOCQESA-N	445.379	1.491	50	20	IDGD	
COc1ccc(Cl)cc1CC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1839790146	JSFFATJMGNKZMH-HKUYNNGSSA-N	449.306	1.882	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3oncc3C)C2)C1	1839966070	TZPMQAWEEPIKIE-DYVFJYSZSA-N	430.299	1.227	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(OC)cc3F)C2)C1	1840154681	CMWHRYCCQPNRAI-OXQOHEQNSA-N	444.887	1.158	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)c1ccccn1)CCO2	1840330151	NJJJHVNXIDMYBA-HRAATJIYSA-N	439.940	1.069	50	20	IDGD	
CC(=O)N/C(=C\c1ccco1)C(=O)N1CC2(CCCN2C(=O)[C@@H](C)CBr)C1	1841288764	NVVVPQIDUSTUCQ-LWLPBDFMSA-N	438.322	1.991	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC2(CCCN2C(=O)[C@@H](O)CNC(=O)OC(C)(C)C)C1	1841300148	ROUKWCIEFVSWFN-OLZOCXBDSA-N	448.358	1.249	50	20	IDGD	
CC(C)c1nn2ccccc2c1C(=O)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843013812	QIQVNHYMADGDSG-UHFFFAOYSA-N	446.316	1.268	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@](F)(C(=O)N2CCCC23CN(C(=O)[C@H](O)CCl)C3)C1	1843953455	ZWVDTDZUHNLJPL-YJYMSZOUSA-N	433.908	1.139	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)c2n[nH]c3cc(Cl)ccc23)C1	1844106502	FBGDNNGDLGTAAO-UHFFFAOYSA-N	438.680	1.027	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)c2cnc(Cl)c(Cl)c2)C1	1844448636	LWVJHXLLFQNWFY-UHFFFAOYSA-N	434.088	1.199	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCCC12CN(C(=O)/C=C\C(=O)NC1CC1)C2	1845871296	LPYDXAPDWKIARD-XVRBRGRQSA-N	440.450	1.910	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ccc3nnc(C(F)(F)F)n3n2)CC1)c1ccccc1	10509366	HHSHWGRTTRFJLX-UHFFFAOYSA-N	433.394	1.821	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)C[C@@H](NC(N)=O)c1ccccc1	11742003	LJGSHYYKXLHTAK-OAHLLOKOSA-N	448.863	1.453	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)[C@H](C)NS(=O)(=O)c2ccc(Cl)cc2)c1	17059828	CLLGIOHFWNXRMQ-NSHDSACASA-N	441.893	1.485	50	20	IDGD	
C[C@H](NC(=O)c1cccs1)C(=O)NNC(=O)c1ccc(CSc2nncn2C)cc1	21291374	GOOJENGKYDTUSR-LBPRGKRZSA-N	444.542	1.748	50	20	IDGD	
O=C(CCc1cccnc1)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	22245164	CRSZPWNQSJRHHP-UHFFFAOYSA-N	438.509	1.954	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(Br)s2)C1)C1CC1	29509452	HGELEOIZABRYNG-SNVBAGLBSA-N	436.353	1.469	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)C2CCN(S(=O)(=O)c3cccnc3)CC2)c(C)c1	110885742	WDZOAQQUWPPKLV-UHFFFAOYSA-N	445.545	1.359	50	20	IDGD	
O=C(CCCN1C(=O)c2ccccc2C1=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	110891110	JLIVMJCREKHPNP-UHFFFAOYSA-N	442.497	1.647	50	20	IDGD	
CCOc1ccccc1OS(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)NC(C)C)c1	726612646	JBIJXBOPSYGEIH-UHFFFAOYSA-N	449.485	1.139	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)CS(=O)(=O)NC2CCC(C)CC2)c1C	726869020	MEIHACABNBPIHH-BLDCVEFLSA-N	425.551	1.716	50	20	IDGD	
N#C/C(=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)OCCn1cncn1	727179949	JZBIWFYKMAYOJQ-DHDCSXOGSA-N	439.863	1.821	50	20	IDGD	
O=C(CCNC(=O)c1n[nH]c2ccccc12)NNc1ccc(S(=O)(=O)NC2CC2)cc1	728212071	RDLFVJXQLMMICC-UHFFFAOYSA-N	442.501	1.267	50	20	IDGD	
C[C@@H]1Oc2ccccc2O[C@H]1C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	728214923	UXIAHMYJCLBADU-MGPUTAFESA-N	446.529	1.294	50	20	IDGD	
COc1cccc([C@H](C)C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)c1	728216336	WTJFVLILHXIIPH-INIZCTEOSA-N	432.546	1.878	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc(Br)c(F)cc1F)[C@H]1COc2ccccc2O1	728502040	YSPDCQMMURVRER-CYBMUJFWSA-N	449.229	1.877	50	20	IDGD	
Cc1cc(CN2CCN(C(=O)NNC(=O)c3ccc(Br)s3)CC2)no1	728942251	NEQVOMCFPDHYOF-UHFFFAOYSA-N	428.312	1.979	50	20	IDGD	
O=C(NCc1cc(Cl)c2c(c1)OCCO2)NNC(=O)C1CCN(c2ncccn2)CC1	728947939	GYKFJKUACLHNSU-UHFFFAOYSA-N	446.895	1.648	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)CSc3nnnn3CC(F)(F)F)cc2C1	729966819	SJGPZVBUSPNUEL-MRVPVSSYSA-N	434.469	1.975	50	20	IDGD	
CC(C)(C)[C@H]1CCc2sc(C(=O)NNC(=O)Cn3[nH]cc4c(=O)ncnc3-4)cc2C1	730514579	AUNPKYCVDLXHKL-LBPRGKRZSA-N	428.518	1.745	50	20	IDGD	
Cc1c(C(=O)NNC(=O)[C@H]2COc3ccccc3O2)nnn1-c1cccc2ncccc12	731327223	RJVQLVYDFKOPNQ-LJQANCHMSA-N	430.424	1.725	50	20	IDGD	
Cc1c(C(=O)OCC(=O)NNC(=O)c2cccs2)nnn1-c1cccc2cccnc12	731522896	DUCQEEUFEFSNIU-UHFFFAOYSA-N	436.453	1.803	50	20	IDGD	
O=C(Cc1ccc2ccccc2c1)NNC(=O)c1ccc2c(c1)S(=O)(=O)N=C1N=CNN12	731808292	OWCQGIWSFBYECR-UHFFFAOYSA-N	448.464	1.255	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21	732304177	STRGDUONZLRSMT-UHFFFAOYSA-N	434.430	1.830	50	20	IDGD	
CC(C)N(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c1	733108377	ORGNAXJWDBYNLF-UHFFFAOYSA-N	441.513	1.976	50	20	IDGD	
O=C(NC[C@]1(N2CCOCC2)CCSC1)NNC(=O)c1cnn(-c2ccccc2)c1	733342796	IVABVWQGABLHBT-HXUWFJFHSA-N	430.534	1.024	50	20	IDGD	
CCOc1cc(CNC(=O)NNC(=O)c2nn(CC)c(=O)c3ccccc23)ccc1OC	734068783	JPSDDCNSMSINRM-UHFFFAOYSA-N	439.472	1.968	50	20	IDGD	
CC(C)COC(=O)N1CCC(C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)CC1	734241963	YLHOVMDASKGPHE-UHFFFAOYSA-N	429.518	1.346	50	20	IDGD	
Cc1cc(NNC(=O)[C@H]2CC(=O)N(CCN3CCOCC3)C2)ccc1Br	734254656	COVOGHABFKTFDR-AWEZNQCLSA-N	425.327	1.381	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)c2ccc(F)c(S(N)(=O)=O)c2)cc1C	736781704	YFPKRQMERDPVES-UHFFFAOYSA-N	443.478	1.023	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)CCC[S@@](=O)c1ccc(Br)cc1	740851583	MUHBCKHOCFQETA-AREMUKBSSA-N	446.367	1.789	50	20	IDGD	
O=C(NNC(=O)[C@@H](c1ccc(Cl)cc1Cl)N1CCOCC1)C(=O)N1CCCC1	742601444	JSAWBTIGYVHTHH-OAHLLOKOSA-N	429.304	1.137	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)[C@@H](C)NC(=O)c1cc2c(C)nn(C)c2s1	743286461	YLXANBQWYBGYNS-CYBMUJFWSA-N	443.529	1.850	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)C[C@H](c2ccccc2)N2CCOC2=O)cc1	743830444	VEKRKVKVAVRJMU-QGZVFWFLSA-N	446.485	1.826	50	20	IDGD	
CN(C)c1ccc(C(=O)c2ccccc2C(=O)NNC(=O)[C@@H]2COCCO2)cc1[N+](=O)[O-]	744651562	XOEQWAHHUPRXHN-SFHVURJKSA-N	442.428	1.068	50	20	IDGD	
CCc1nc(COc2ccc(C(=O)OCC(=O)NNC(=O)c3cccc(C#N)c3)cc2)no1	745039619	RQQLXCWLTIAPFW-UHFFFAOYSA-N	449.423	1.701	50	20	IDGD	
O=C(COC(=O)[C@@H]1C[C@@H]1c1ccc2c(c1)OCCO2)NNC(=O)c1cccc([N+](=O)[O-])c1	745285688	XZUSULWOCJNZSM-HZPDHXFCSA-N	441.396	1.474	50	20	IDGD	
CC(C)=CC(=O)NCc1ccc(C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)cc1	745633298	OUZZZAFJIZKYJO-UHFFFAOYSA-N	434.452	1.759	50	20	IDGD	
CC[C@@H](C)C[C@H](C)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	745889304	GVIRZKDMTJFXBR-CABCVRRESA-N	426.539	1.476	50	20	IDGD	
COc1ccc([N+](=O)[O-])cc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)N(C)C)c1	746012883	ODDNYDRYNXXVPR-UHFFFAOYSA-N	437.434	1.320	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)O[C@@H](C)C(=O)N(C)C)cc1	746159817	MQXSMRHXVODJDT-LUYJPIOASA-N	439.472	1.361	50	20	IDGD	
CNC(=O)CC1CCN(C(=O)NNC(=O)[C@@H](C)Oc2cccc(Br)c2)CC1	747489983	DSIAHLIHPFOCMV-GFCCVEGCSA-N	441.326	1.805	50	20	IDGD	
COc1cc(OC)cc(N2CC[C@@H](NC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)C2)c1	748661649	MNKRBUMZEXHAEY-CQSZACIVSA-N	429.433	1.835	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)c2cc(S(=O)(=O)NC)cs2)cc1	748689030	FOVLOYFQWMSRSL-NSHDSACASA-N	427.504	1.283	50	20	IDGD	
O=C(NCCNS(=O)(=O)Cc1ccon1)NNC(=O)c1c(Cl)cccc1Cl	750275356	HAMZWGHQIBMZMD-UHFFFAOYSA-N	436.277	1.045	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2cc(F)c(F)c(C(=O)O)c2)cc(OC)c1OC	751142058	KRWISGJYVVXCNJ-UHFFFAOYSA-N	446.384	1.312	50	20	IDGD	
O=C(CCCOc1ccc2c(c1)CCC(=O)N2)NNC(=O)CNC(=O)c1cccs1	751208557	GTSBNFPNQHOOLM-UHFFFAOYSA-N	430.486	1.369	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)c1ccc(-n2cccc2)nc1	753180971	XXYXVYIFXZMNRP-UHFFFAOYSA-N	439.497	1.732	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@@H](C)C(=O)NNC(=O)c1cc(S(N)(=O)=O)oc1C	754182115	LYEKDXSRVLKVSU-NSHDSACASA-N	429.882	1.734	50	20	IDGD	
CCOc1ccc(NC(=O)NNC(=O)Cc2cc[nH]n2)cc1S(=O)(=O)N(CC)CC	755452096	XPIDXLBTSVPXQC-UHFFFAOYSA-N	438.510	1.234	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2ccc(N3CCCS3(=O)=O)cc2)cc1OC	755593300	JVQSESUVGKBMMP-UHFFFAOYSA-N	434.474	1.710	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccc(NC(=O)[C@H]3CCCO3)cc2)c1	755642283	XBBADHZKFPDEAW-QGZVFWFLSA-N	446.485	1.674	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)Nc2ccccc2CN2C(=O)CCC2=O)c1	756223012	WUZIDIZZNKKRKL-UHFFFAOYSA-N	426.429	1.819	50	20	IDGD	
COCCS(=O)(=O)c1ccc(NC(=O)NNC(=O)COc2cc(C)ccc2C)cc1	756564819	VSWCTEKPDRMRRE-UHFFFAOYSA-N	435.502	1.955	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)Nc1ccc(NS(C)(=O)=O)c(Cl)c1	756703421	AUXFNRPKMWPYEM-UHFFFAOYSA-N	442.881	1.952	50	20	IDGD	
O=C(NNC(=O)C(F)(F)c1nccs1)c1ccc(S(=O)(=O)N2CCCC2)cc1	756796138	FKMNQJPQWAUTGS-UHFFFAOYSA-N	430.458	1.481	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)Nc2cc(C(N)=O)ccc2CN(C)C)cc1	756826195	BSKUCXCOQRMEFR-AWEZNQCLSA-N	443.504	1.866	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Nc2ccc(N3CCOCC3)nc2C)cc(OC)c1OC	757734047	ROIIRIBWZZTQQV-UHFFFAOYSA-N	445.476	1.719	50	20	IDGD	
Cn1cc(-c2ccccc2CNC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cn1	759623552	YJUUFFROCGWTDB-UHFFFAOYSA-N	431.456	1.478	50	20	IDGD	
COc1ccc(/C=C(\C#N)C(=O)OCC(=O)Nc2cc(S(N)(=O)=O)ccc2OC)cc1	759859888	DDCYDROXAWBDKS-NTEUORMPSA-N	445.453	1.440	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)c1c[nH]c2ccc(Oc3ccccc3)cc2c1=O	760815010	FLKICBXHBRCESJ-GFCCVEGCSA-N	444.469	1.019	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccc(C(=O)NNc2nccc(N3CCOCC3)n2)cc1	762848172	NVWNLMQKJFJTAG-UHFFFAOYSA-N	434.522	1.147	50	20	IDGD	
Cn1ncnc1COc1ccc(S(=O)(=O)NNC(=O)CSc2ccccc2O)cc1	763409899	KMAOYNUDYHOMSN-UHFFFAOYSA-N	449.514	1.202	50	20	IDGD	
CC(=O)N(C)c1ccc(S(=O)(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)cc1	763439341	LRYAYBFCYQSZQN-UHFFFAOYSA-N	428.511	1.284	50	20	IDGD	
O=C(NNC(=O)c1ccccn1)C(=O)Nc1cccc(C(=O)Nc2ccc(Cl)cn2)c1	763466174	FFHYXLHGALMSMT-UHFFFAOYSA-N	438.831	1.782	50	20	IDGD	
COC(=O)CSCc1cccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)c1	763547888	GFNYRGYCCGSLHX-UHFFFAOYSA-N	445.453	1.221	50	20	IDGD	
COC(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C(C)(C)C)cc2)cc1	763595443	PBBDQSDMODDZDG-UHFFFAOYSA-N	441.484	1.865	50	20	IDGD	
COC(=O)N(C)Cc1ccc(NC(=O)C(=O)NNC(=O)COc2cc(C)cc(C)c2)cc1	763648636	FOGSXLYVDUOJEP-UHFFFAOYSA-N	442.472	1.667	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(OC(F)F)c(Cl)c2)cc1	763673207	AILUNVVXTBRNRI-UHFFFAOYSA-N	438.774	1.978	50	20	IDGD	
COCCOc1cccc(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)c1	763745255	BFRVWAFEWAFBBQ-UHFFFAOYSA-N	426.473	1.251	50	20	IDGD	
CNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(OC)cc(OC)c2)cc1Cl	763775439	RBQFNPAOALAKCH-UHFFFAOYSA-N	434.836	1.117	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cc(N3CCCC3=O)ccc2Cl)cc1	763812516	GQYOQIWMRRWOSR-UHFFFAOYSA-N	444.875	1.940	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc[nH]2)nn1CCCOc1ccc(F)cc1	763980268	WTVVTRKZYFJPOO-UHFFFAOYSA-N	428.424	1.528	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)C(=O)N1C[C@H]2CCCN2c2ccccc21	763994198	BGOSNOMNJVSUTR-GFCCVEGCSA-N	432.278	1.554	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1ccccc1N1CCN(C)CC1	764012416	QMIWXLBSBBMLQB-UHFFFAOYSA-N	445.907	1.500	50	20	IDGD	
CCNC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2OC)c1	764012448	QMLSTJGJQDOWFT-UHFFFAOYSA-N	433.852	1.890	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc(NS(C)(=O)=O)c(Cl)c1	764042324	GHBWXWUAQCBYNP-UHFFFAOYSA-N	440.865	1.120	50	20	IDGD	
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)CSc1ccccc1O	764049410	YYCOKTKOHOHSOQ-KRWDZBQOSA-N	426.498	1.860	50	20	IDGD	
CN1C(=O)c2ccc(NC(=O)C(=O)NNC(=O)Cc3ccc4ccccc4c3)cc2C1=O	764083281	BAIBXUNOPFRCNX-UHFFFAOYSA-N	430.420	1.394	50	20	IDGD	
Cc1nn(C)c2ncc(NC(=O)C(=O)NNC(=O)c3ccc(F)cc3Br)cc12	764085453	KWEKQADYQLUSKS-UHFFFAOYSA-N	449.240	1.578	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccccc2OCC(F)(F)F)c1O	764130987	CWLASOSBQWLAOG-UHFFFAOYSA-N	427.335	1.742	50	20	IDGD	
Cc1ccccc1-n1nccc1NC(=O)C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C	764203536	MTBOKWAGRQVEAC-UHFFFAOYSA-N	444.492	1.572	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)C(=O)Nc1ccc(-n2cccn2)cc1C(F)(F)F	764385734	GNFCDIXKGJLAGU-UHFFFAOYSA-N	432.362	1.994	50	20	IDGD	
CSc1cc2c(cc1NC(=O)C(=O)NNC(=O)CSc1ccccc1O)OCCO2	764401195	NVTKYKOYZLNLBA-UHFFFAOYSA-N	449.510	1.764	50	20	IDGD	
CCN1CCC(=NNC(=O)CN2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)[C@@H](C)C1	764818399	KVMBWATXWWXKQO-SFHVURJKSA-N	435.594	1.135	50	20	IDGD	
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)NNC(=O)c1csc(N2CCOCC2)n1	765197770	XWGHSAFNOIBCSF-NVXWUHKLSA-N	444.561	1.444	50	20	IDGD	
COc1cc2c(cc1OC)CN(C(=O)CCC(=O)NNC(=O)c1cccc(C#N)c1)CC2	765418023	ZMMXPIURCDDARD-UHFFFAOYSA-N	436.468	1.702	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)CCCOc2ccc3c(c2)OCO3)cc1	765486310	VQFAROWSXGJHLU-UHFFFAOYSA-N	435.458	1.831	50	20	IDGD	
O=C(NC[C@@H]1CCCCN1C1CC1)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	765665144	ZJZKONRDMNVBFR-SFHVURJKSA-N	449.577	1.432	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	765751587	NYPKIVXQOXQDDG-UHFFFAOYSA-N	446.935	1.693	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cc4c(C)nn(C)c4s3)CC2)cc1	765753987	IDMBMIAQPCQKBR-UHFFFAOYSA-N	440.573	1.830	50	20	IDGD	
Cc1cc(S(=O)(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)ccc1C#N	766549211	SRMJJVNZIVNVDM-UHFFFAOYSA-N	437.522	1.759	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1cncn1-c1ccccc1	766642791	MWCZAQCXLCNTMU-UHFFFAOYSA-N	432.484	1.091	50	20	IDGD	
O=C(NCCNS(=O)(=O)c1cccc([N+](=O)[O-])c1)NNc1ncnc2ccsc12	766900344	YMNSROQYSGSZBI-UHFFFAOYSA-N	437.463	1.204	50	20	IDGD	
O=C(NNC(=O)c1ccc(Br)c(Cl)c1F)N[C@H]1CCS(=O)(=O)C1	767683567	IBTHSPUSAGYQNX-LURJTMIESA-N	428.667	1.373	50	20	IDGD	
CC(C)(C)[C@H](Br)C(=O)Nc1ccc(N2CCN(S(C)(=O)=O)CC2)nc1	768098722	HNQYFTWAJKVIBY-CQSZACIVSA-N	433.372	1.911	50	20	IDGD	
CN(C)C(=O)COc1ccc(C(F)(F)C(=O)NNC(=O)c2ccc(Cl)nc2)cc1	769557660	RTFADXVYRASMHC-UHFFFAOYSA-N	426.807	1.755	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2CC(=O)N(c3c(F)cccc3F)C2)cc1C	770865896	ZPFFZCKGTRVTDI-ZDUSSCGKSA-N	430.411	1.721	50	20	IDGD	
Cc1nnnn1/C(=C\c1ccccc1)C(=O)NNc1nc(O)c2cnn(C(C)(C)C)c2n1	770965783	NEAIZAXRKQCOJW-GDNBJRDFSA-N	434.464	1.723	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)[C@@H](C)NS(=O)(=O)c1cccc(C(F)(F)F)c1	771008871	MBIQPOZICPXOOE-LLVKDONJSA-N	445.419	1.842	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)C3CCN(c4ccc5cccc(O)c5n4)CC3)nc21	771019213	DHSSYZALVUOTST-UHFFFAOYSA-N	434.460	1.682	50	20	IDGD	
Cc1cc(S(=O)(=O)NCCNC(=O)NNC(=O)C(C)(C)c2ccccc2)c(C)s1	771980440	PRXIBBARHCTYTA-UHFFFAOYSA-N	438.575	1.951	50	20	IDGD	
O=C(Cn1cc(C(=O)NNc2nc(Br)cn3ccnc23)cn1)NC1CCCC1	772475330	XLDOKMKYSXYUBZ-UHFFFAOYSA-N	447.297	1.504	50	20	IDGD	
O=C(COC(=O)c1ccoc1Br)NNC(=O)[C@@H]1COc2ccccc2O1	773543924	WOCBGLGMDOYZRE-LBPRGKRZSA-N	425.191	1.186	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)NC[C@@H]2COC3(CCCC3)O2)c2ccccc2c1=O	774306772	BSYHTJXEHDZWEM-CQSZACIVSA-N	429.477	1.607	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2cc(C#N)ccc2Cl)c1	775255312	PGWFJVGTACUVCY-UHFFFAOYSA-N	442.906	1.085	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)N[C@H]2CCO[C@@]3(CCS(=O)(=O)C3)C2)c1C	776075519	BEHRVZVRPYOXLS-GUXCAODWSA-N	439.534	1.137	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc2c(c1)OCCCO2)NNc1ncc(Cl)cc1Cl	776263474	NEELOZDBRGICSC-UHFFFAOYSA-N	447.300	1.971	50	20	IDGD	
O=C(COC(=O)c1ccc(C(F)(F)F)cc1O)NNC(=O)c1ccc([N+](=O)[O-])cc1	776402810	ZHMUVYJQZNKYAH-UHFFFAOYSA-N	427.291	1.937	50	20	IDGD	
COc1nc(C)c(Br)cc1C(=O)NNC(=O)CCNC(=O)OC(C)(C)C	777178734	OXKTYEVVJVLHPZ-UHFFFAOYSA-N	431.287	1.837	50	20	IDGD	
CCn1cc(-c2nn(C)cc2C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)cn1	778296070	UCURUYDPJLKSJX-UHFFFAOYSA-N	448.487	1.669	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)CCSCc1nc(O)c2ccccc2n1	778437820	DZVJTGDXUKYNME-UHFFFAOYSA-N	435.506	1.631	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2ccc(Cl)c(-n3nnnc3C3CC3)c2)nc1	782145816	YVHQNZWYKHSCLN-UHFFFAOYSA-N	428.840	1.679	50	20	IDGD	
COC(=O)c1cc(Br)ccc1NC(=O)C(=O)NNC(=O)c1ccc(O)cc1	782830461	KGTOLKGRWOCWAY-UHFFFAOYSA-N	436.218	1.341	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)(F)F)cc1)C(=O)Nc1cccc2c1OCO2	783409781	VWYAOXBGVKFDBV-UHFFFAOYSA-N	431.348	1.791	50	20	IDGD	
C[C@@H]1CCC[C@H](OCc2cccc(NC(=O)C(=O)NN[C@]3(C)CCS(=O)(=O)C3)c2)C1	783426785	KFHXXZVIUVEUKF-FYINFDKHSA-N	437.562	1.918	50	20	IDGD	
O=C(NNc1ccc(-n2cccn2)nn1)C(=O)Nc1ccc(OC(F)F)c2cccnc12	783436695	NDJOAYGXQOQFRE-UHFFFAOYSA-N	440.370	1.894	50	20	IDGD	
COCC[C@H](Cc1ccco1)NC(=O)NNC(=O)c1sc(N2CCOCC2)nc1C	784171885	OVQVNBORNXUKBY-CQSZACIVSA-N	437.522	1.473	50	20	IDGD	
C[C@H](c1ccc(NC(=O)C(=O)NNc2cccc(S(C)(=O)=O)c2)cc1)N1CCOCC1	784844777	NSWONQURLQBIRU-OAHLLOKOSA-N	446.529	1.565	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@@H]2C)ccc1NC(=O)C(=O)NNc1ccnc(N(C)C)n1	784969005	GZAUDIPVKDTNIF-HNNXBMFYSA-N	439.520	1.947	50	20	IDGD	
COc1cc(C#N)ccc1NC(=O)C(=O)NNC(=O)c1cc(-c2cc(C)ccc2C)[nH]n1	785125342	CIYKVEIMJPRRBD-UHFFFAOYSA-N	432.440	1.974	50	20	IDGD	
Cc1cc(NC(=O)[C@H](C)SCC(=O)OCC(=O)NNC(=O)c2cccs2)no1	785300127	RIPNSZVAHBSWOL-JTQLQIEISA-N	426.476	1.109	50	20	IDGD	
C[C@@]1(NNC(=O)NC[C@@H](C(=O)OCc2ccccc2)c2ccccc2)CCS(=O)(=O)C1	786891186	VVPXIKHPKKLHDP-DENIHFKCSA-N	445.541	1.895	50	20	IDGD	
Cc1ccc(N2CCNC2=O)cc1NC(=O)C(=O)NNC(=O)c1ccc2ccccc2n1	787543792	IDAAMEAGYRSYIH-UHFFFAOYSA-N	432.440	1.473	50	20	IDGD	
Cc1ccc(N2CCNC2=O)cc1NC(=O)C(=O)NNC(=O)Cc1ccc(Cl)cc1	787544197	PJVBXPVAVGDOFA-UHFFFAOYSA-N	429.864	1.507	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2cc([C@H]3CCCO3)nn2C)c2ccccc2c1=O	788724035	CFBDDZSILOVJEU-OAHLLOKOSA-N	425.449	1.468	50	20	IDGD	
CC1(C)Cc2cccc(NC(=O)C(=O)NNc3ccc(S(=O)(=O)NC4CC4)cc3)c2O1	789588493	CHQIXGGTNXVUPJ-UHFFFAOYSA-N	444.513	1.923	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c(-c2ccoc2)n1	789866757	BJDDVCNFYSTESZ-UHFFFAOYSA-N	443.485	1.539	50	20	IDGD	
CCCCNC(=O)NNS(=O)(=O)c1cccc(S(=O)(=O)N2CCCCCC2)c1	790392740	XWIMBIOYUKGRIP-UHFFFAOYSA-N	432.568	1.544	50	20	IDGD	
Cc1ccc(C)c(S(=O)(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)c1[N+](=O)[O-]	790398686	LWECTOZPUKAPNO-UHFFFAOYSA-N	430.483	1.826	50	20	IDGD	
Cn1nc([C@H]2CCCOC2)cc1NC(=O)C(=O)NNC(=O)c1cc2ccccc2cc1O	790956001	CHLPRBGSHILEES-HNNXBMFYSA-N	437.456	1.573	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)C(=O)Nc3cccc(N4CCC4=O)c3)n[nH]2)c1	790966444	UCQISPGTRTUNOZ-UHFFFAOYSA-N	446.467	1.830	50	20	IDGD	
C[C@@H]1CC(=O)C[C@H](C(=O)NNC(=O)OC(C)(C)C)[C@@H]1C(=O)NNC(=O)OC(C)(C)C	791123795	KFWDIJCLQMYZHE-KGYLQXTDSA-N	428.486	1.330	50	20	IDGD	
CC(C)(C)OC(=O)N1CC=C(CCNC(=O)NNC(=O)C(=O)Nc2ccccn2)CC1	793409796	KJWWFPGDQXDZAB-UHFFFAOYSA-N	432.481	1.308	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C2=NN(Cc3ccc(F)cc3)C(=O)CC2)cc1	794718115	XJZYCIHZSQNKJQ-UHFFFAOYSA-N	447.492	1.698	50	20	IDGD	
CCOC(=O)c1cc(S(=O)(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)ccc1C	795295187	ZONVLHREBXFYGQ-UHFFFAOYSA-N	440.499	1.199	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3cc4ccccc4c(=O)o3)cc2)CC1	797745799	BLNVKIPVMMLKFQ-UHFFFAOYSA-N	442.497	1.486	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)N[C@H]1CCCN(C(=O)Cc2ccccc2)C1	802474647	OHVDNKSLMUVTBS-KRWDZBQOSA-N	425.445	1.773	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCC[C@H]2C[C@H](C)O[C@H](C)C2)cc1	802510471	PJQYODNCYXOKGG-BJWYYQGGSA-N	440.566	1.540	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)[C@@H](c2cnn(C)c2)N(C)C(=O)OC(C)(C)C)nc1C	803051249	IWXIIVUKUFUZTQ-OAHLLOKOSA-N	447.496	1.747	50	20	IDGD	
CSC[C@H](C(=O)NNc1ccc2c(=O)[nH]ccc2c1)N1C(=O)[C@H]2CCCC[C@H]2C1=O	803431535	BZOSLYOJBUVJLJ-IXDOHACOSA-N	428.514	1.878	50	20	IDGD	
COC(=O)c1cc(C)c(NC(=O)C(=O)NNC(=O)COc2ccccc2F)c(Cl)c1	806973628	GBCHBJDSBMJAJO-UHFFFAOYSA-N	437.811	1.739	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(F)cc2OC2CCOCC2)c1O	806977324	DSXGGBHYSPODFI-UHFFFAOYSA-N	447.419	1.497	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2c(C)c(C(F)(F)F)nn2C)c(OC)c1	806978765	JSBNMYOKKPWUAT-UHFFFAOYSA-N	429.355	1.164	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)[C@@H]1CCCC12OCCO2	807092369	CMQSYFACSXEZPG-KRWDZBQOSA-N	436.940	1.148	50	20	IDGD	
CN(NC(=O)[C@@H]1C[C@H](c2ccccc2)OC1=O)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	809763121	KALXNPFHIRLNJF-DLBZAZTESA-N	446.504	1.927	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNS(=O)(=O)CCc1ccccc1Br	812270725	NXMIHUGRCBCKHC-UHFFFAOYSA-N	436.328	1.467	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2ccc(N3CCNC3=O)cc2)c2ccccc2c1=O	812530934	LWCBLYRVHSSCKS-UHFFFAOYSA-N	434.456	1.411	50	20	IDGD	
CCCc1nnc(SCC(=O)NNc2ccccc2S(=O)(=O)NC(C)(C)C)n1N	813494271	FHKXLSLVNFSRMY-UHFFFAOYSA-N	441.583	1.257	50	20	IDGD	
COC(=O)C(C)(C)c1csc(NC(=O)C(=O)NN=c2sc3ccccc3n2C)n1	815588687	VYRIDNVIDZUTLU-UHFFFAOYSA-N	433.515	1.718	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3nn(C)cc3Br)n[nH]2)cc1OC	815887163	WDQGOHJPQGXSRC-UHFFFAOYSA-N	449.265	1.665	50	20	IDGD	
Cc1cccc2c(=O)n(CC(=O)NNC(=O)[C@H]3CCCN(C(=O)OC(C)(C)C)C3)cnc12	816509777	BXMQCGDGSWLOOU-HNNXBMFYSA-N	443.504	1.499	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)N(C)[C@@H]2CCN(S(C)(=O)=O)C2)c(C)n1C[C@H]1CCCO1	816816672	DQJSQOOEHBTDHP-XFVDGSDISA-N	434.562	1.683	50	20	IDGD	
Cc1cc(CC(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)on1	816829695	ARNMHPFZNJZWFC-UHFFFAOYSA-N	428.470	1.465	50	20	IDGD	
NC(=O)CCn1c(SCC(=O)NNC(=O)c2ccccc2Cl)nnc1-c1ccco1	863890161	NZVMEBSZTJUZBW-UHFFFAOYSA-N	448.892	1.620	50	20	IDGD	
CCC[C@H](NC(=O)NCc1ccc(Br)cc1)C(=O)N1CC[C@@H](B(O)O)C1	864234526	SGIIBGSGOZTJLX-HIFRSBDPSA-N	426.120	1.492	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)[C@H]1CS[C@H](Cc2ccccc2F)C(=O)N1	892500474	WDIPFONQKAQREU-IAGOWNOFSA-N	435.452	1.334	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)CNS(=O)(=O)c2ccccc2F)c(C)n1-c1ccccc1	913419445	CEYSQMRSGIBUKP-UHFFFAOYSA-N	444.488	1.973	50	20	IDGD	
CCn1c(=O)nc(O)c2c(C(=O)NNC(=O)COc3ccc(C#N)cc3)cc(C3CC3)nc21	914163968	KBNOOOKNFFOEBK-UHFFFAOYSA-N	448.439	1.106	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NN=C2C(=O)Nc3c(F)ccc(Cl)c32)cc1	914559257	FWDYUKMIQKUWIW-UHFFFAOYSA-N	438.868	1.881	50	20	IDGD	
COc1cccc(C[C@@H](C(=O)NNC(=O)COc2ccc(C)c(C)c2)n2nnnc2C)c1	915695580	TXSLTQQTSXLPAU-FQEVSTJZSA-N	438.488	1.617	50	20	IDGD	
O=C(NC[C@H](c1cccs1)N1CCOCC1)NNC(=O)c1ccc2c(c1)OCCO2	915893105	CIUYWVWXZYJHGZ-OAHLLOKOSA-N	432.502	1.537	50	20	IDGD	
Cc1nc2ccnn2c(C)c1CCC(=O)OCC(=O)NNC(=O)c1cccc(Cl)c1	919483118	KMYKMBISYSQHAN-UHFFFAOYSA-N	429.864	1.937	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)c2cc(-c3ccco3)nc3c(C(N)=O)ncn23)cc1	919836434	OXBIUMDIEIJAKV-UHFFFAOYSA-N	448.439	1.491	50	20	IDGD	
O=C(CN1CCc2ccccc21)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	919963310	ZHJJZFWNPNLZSA-UHFFFAOYSA-N	428.514	1.295	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc2c(c1)OCCCO2)NNC(=O)c1c[nH]c2ccccc12	920211669	IGPZQSBTVUCBDW-UHFFFAOYSA-N	444.469	1.069	50	20	IDGD	
COCCCNC(=O)NNC(=O)[C@H]1CC(=O)N(c2ccc(Br)c(C)c2)C1	920862025	IJXYIEGKKMKXCD-LBPRGKRZSA-N	427.299	1.477	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@H]2CCCN2C(=O)/C=C/c2ccc(C(N)=O)cc2)cc1	1115888306	HFPCZAHKRCIHTJ-CQTFCRGUSA-N	436.468	1.260	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)N[C@@H]2CCCN(C(=O)c3ccccc3)C2)c1	1318175373	MDCKQVSTNFOYCT-QGZVFWFLSA-N	426.473	1.953	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)[C@@H]2CC(=O)N(c3ccc(F)cc3)C2)CC1	1318655728	ASDLZVCWEQVLKH-OAHLLOKOSA-N	448.495	1.973	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4nonc4c3)C2)C1	1777721499	KBAXQKZHKXAWNT-SCLBCKFNSA-N	437.294	1.840	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnn3cccnc23)C1	1778963018	NRZBVOYBCNHNGX-RZQQEMMASA-N	435.912	1.111	50	20	IDGD	
COc1ccc(CCC(=O)N2CCO[C@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)cn1	1779294654	WGQQRCVKIVEFSY-NRFANRHFSA-N	435.597	1.704	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@]2(C1)CN(C(=O)c1ccccc1-n1nccn1)CCO2	1779298785	JVUKXPGMKFSXKI-NRFANRHFSA-N	443.580	1.562	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)N2CCO[C@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)c1	1779299882	HSPUTDCPWAZXIW-NRFANRHFSA-N	433.581	1.940	50	20	IDGD	
CCn1nc(C(C)C)cc1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](Cl)COC)CCO2	1780403851	FJLDJHQJJZEHLW-QRWLVFNGSA-N	426.945	1.724	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)c1ccccc1)C2)[C@@H](F)Br	1780771976	XNIFLVIWTHFVHI-YKTARERQSA-N	443.313	1.924	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C1(C(=O)OC)CC1)C2	1781904956	HMFVVSXLCIGPBS-HBUWYVDXSA-N	445.354	1.627	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(C)ccc3-n3ccnn3)C2)C1	1782169603	VFVMUJQTNYIWMJ-DYESRHJHSA-N	447.923	1.273	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3cccc4ccnn34)C2)C1	1782221129	YRVYOYSWXAVJFG-KUHUBIRLSA-N	435.322	1.809	50	20	IDGD	
O=C(c1c[nH]c2c(Cl)cccc12)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1782451524	WYEJXPCZWOPUCA-DNVCBOLYSA-N	426.300	1.865	50	20	IDGD	
CCOC(=O)C(C)(C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CO[Si](C)(C)C)C2	1783231771	AEPHJHYOUFXYCQ-IIBYNOLFSA-N	442.629	1.941	50	20	IDGD	
Cc1nc2ncccn2c1C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](C)Br)C2)C1	1783533638	CNJRXWKILGWENZ-KPZWWZAWSA-N	436.310	1.265	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ncn(C)c3C(F)(F)F)CCO2)C1	1783876087	URVOHELUOFEIOR-MEDUHNTESA-N	438.834	1.136	50	20	IDGD	
O=C(c1cnc(C(F)(F)F)cn1)N1CCO[C@@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783945192	DTKSTSPKBARXID-CQSZACIVSA-N	427.210	1.743	50	20	IDGD	
COc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]3C2)cc(OC)c1C	1784096347	VNYQDHMLSYYHNT-AMVTXUCVSA-N	440.924	1.205	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnnc(Cl)c3)[C@H]2C1	1785452543	AJLYDBWBTTXOFE-HTWFXAOOSA-N	435.739	1.960	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cncc(N(C)C)c3)[C@H]2C1	1785557195	CDNYPRVOBSRDAB-PYTWLRIVSA-N	439.354	1.524	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cncc(F)c3)[C@H]2C1	1786147027	RQNKAMUHBSICRZ-KSYCFECVSA-N	428.302	1.988	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)c3ccccc3)[C@H]2C1	1786672345	ZKZJHYGGVVIEOJ-ZTTBQOKTSA-N	429.344	1.936	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1ccc(C2(NC(=O)C#CC(=O)O)CCC2)cc1	1788648694	DZAVALIJYCNJAN-VULFUBBASA-N	435.440	1.343	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cn4cccnc4n3)C[C@@H]21	1789867852	HDBUYLSLPZUWNG-NGOJXBLDSA-N	440.331	1.559	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4occc4c3O)C[C@@H]21	1791257249	UMLDTXJLQSZSRF-RPZXMPESSA-N	436.892	1.986	50	20	IDGD	
Cc1c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](O)CCl)nc2ccc(Cl)cn12	1792983803	OSMUXSFUXXWNNK-IFOZYUSPSA-N	441.315	1.099	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(C)(C)NC(=O)OC(C)(C)C	1793629585	JLFXTLLGSFRNJM-LXTVHRRPSA-N	431.961	1.897	50	20	IDGD	
COc1ccc(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)cc1C	1793892386	YWZFLCMRWHGTEF-WKCHPHFGSA-N	436.317	1.178	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)Nc1cccnc1	1795611781	ROKQWZXBNKKWMS-QKDZRIPBSA-N	425.327	1.255	50	20	IDGD	
Cc1cc(F)c(F)c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)c1	1796193039	JHSCAHGSEBCFCA-BJWYYQGGSA-N	428.244	1.519	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1Cc2ccccc2CN1	1796326772	XXPPOOMQSMQIPN-UWLPGLTFSA-N	436.350	1.074	50	20	IDGD	
CCS(=O)(=O)c1ccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Cl)cc1	1796370145	HYBDCKDAIZPNDY-LTCOOKNTSA-N	446.928	1.147	50	20	IDGD	
CC(C)(C)OC(=O)NC12CC(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@H](F)Cl)(C1)C2	1796370460	KMZSDSIZPYVGKG-BALXUMTASA-N	445.919	1.558	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CS(=O)(=O)N1CCCC1	1796888233	OBXSSKVRJIKJRG-LOUJCGABSA-N	440.393	1.287	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(Cl)nc3n[nH]cc13)C2	1799270259	VQHRFLSQXODDQF-YJKIEOBBSA-N	426.304	1.832	50	20	IDGD	
C[C@@H](S)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](Br)Cc1ccccc1	1800437422	YAKFQJXYNDPKLL-FMPTWSOUSA-N	441.391	1.901	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@](C)(Cl)CCl)C2	1800642631	SQFSYRNIVYBKJW-ONQKKCPMSA-N	430.170	1.986	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(O)cc1F)C2	1800643569	XNDPVMKCACNPQH-YHYOWMERSA-N	429.286	1.908	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COc1ccccc1F)C2	1800761642	DEVYUWFJWQPOFY-KOFHJDLBSA-N	429.286	1.578	50	20	IDGD	
COc1ccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C(Cl)Cl)c(C#N)c1	1801017186	AONGRGQJLZRHFV-XOIINTDNSA-N	426.300	1.503	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)Oc1ccccn1	1801362671	QCZVPFDIPFUCNK-WVCIDPQESA-N	440.338	1.470	50	20	IDGD	
CCC[C@@H](NC(C)=O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](Br)CC)C2	1802037806	IYZIEWILSUZHDR-NPJQDHAYSA-N	432.359	1.054	50	20	IDGD	
CN(C)C(=O)NCC(=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@@H]1c1cccnc1	1802680399	JKLXFNCFSWUXGR-NWANDNLSSA-N	444.305	1.049	50	20	IDGD	
CC[C@@H](NC(C)=O)C(=O)NC[C@@H]1CCN(C(=O)CO[Si](C)(C)C)[C@@H]1c1cccnc1	1802879259	HHSXBRODLKQMMF-NLWGTHIKSA-N	434.613	1.854	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)[C@@H]1C[C@H]1C1CC1	1802990758	VFZFZUFCSHKDRV-VXSCBNMQSA-N	433.317	1.127	50	20	IDGD	
C=C[C@@H]1C[C@]1(NC(=O)OC(C)(C)C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](O)CCl)C2	1804408583	NMASBASJGRJOJU-VUSYMWPTSA-N	441.956	1.694	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)C1CCCCC1	1806223905	CBANRYTWGILEQM-RBBKRZOGSA-N	435.333	1.661	50	20	IDGD	
C[C@H](C(=O)N1CC[C@@H](CNC(=O)CCBr)[C@H]1c1cccnc1)n1ccnn1	1806346514	JKYZUZGQQAYRIO-UKPHBRMFSA-N	435.326	1.725	50	20	IDGD	
O=C(CCC(F)(F)F)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1806825176	HFLXCMNENQXYTB-APWZRJJASA-N	449.238	1.424	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1807360308	QWSFBYURAFLRAB-IHPCNDPISA-N	443.740	1.489	50	20	IDGD	
O=C(Cn1ccccc1=O)NC[C@@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1	1807438352	WOSYXATZFCXPON-JXFKEZNVSA-N	447.333	1.734	50	20	IDGD	
CCc1[nH]nc(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)c1Cl	1807700959	UGCLFYVGNFXRTF-JDFRZJQESA-N	440.331	1.940	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)c1noc2c1CCCC2	1808021596	PTVNZNOVQYUGRX-GMBSWORKSA-N	432.908	1.868	50	20	IDGD	
CN1C(=O)CC[C@H]1C(=O)NC[C@@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1	1808757467	KQILIFLWKPHGQF-RLFYNMQTSA-N	437.338	1.493	50	20	IDGD	
O=C(CCCn1cccc1)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1	1809972571	KQBZTSKXJWIHJF-UHFFFAOYSA-N	437.349	1.493	50	20	IDGD	
CC(=O)O[C@H](C(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)C(C)C	1810098233	GXPXCJVABKOHNX-FJIDUMEYSA-N	425.913	1.275	50	20	IDGD	
COc1cc(C(=O)NC[C@@H]2CCN(C(=O)CO[Si](C)(C)C)[C@@H]2c2cccnc2)nn1C	1811633286	DYLQKSZYYFSBQS-OXJNMPFZSA-N	445.596	1.995	50	20	IDGD	
CC(=O)C(C)(C)C(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1813069547	ZRMZLIGZUAAOCC-FXAWDEMLSA-N	431.537	1.076	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](C)CS(C)(=O)=O)n[nH]1	1815232009	DCUQULVAKBSYJL-DYEKYZERSA-N	434.946	1.336	50	20	IDGD	
COc1ccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)cn1	1815443907	ISIVCOIOUALLRD-INIZCTEOSA-N	443.508	1.492	50	20	IDGD	
COc1cccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)n1	1816268522	CUWNAPPLOVJCCM-GOSISDBHSA-N	449.276	1.113	50	20	IDGD	
COc1cccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)n1	1816269045	UJOOGOMHZLEHDV-SFHVURJKSA-N	449.276	1.113	50	20	IDGD	
O=C(Cc1cccnc1)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1817621186	VGFYCOLSBCPYRA-IBGZPJMESA-N	433.277	1.033	50	20	IDGD	
C#CCCCC(=O)N[C@@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1	1819799478	CVHQSPCETHIKMK-GFCCVEGCSA-N	426.502	1.171	50	20	IDGD	
C[C@@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1)n1ccnc1	1822411966	GELNLCUBWKZFBQ-GOEBONIOSA-N	430.513	1.233	50	20	IDGD	
C=C[C@@H](O)C(C)(C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1	1822416149	RWGMIYSUMSFTOU-HZPDHXFCSA-N	434.541	1.348	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H]2C[C@]2(F)Cl)n[nH]1	1822503971	IAAQHJPTJPQMJJ-BBEJJTJUSA-N	449.874	1.639	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCn1cncn1)CC2	1822869336	JTFKSDVCARCRIY-QFYYESIMSA-N	431.349	1.973	50	20	IDGD	
CN(C)C(=O)NCC(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1	1822999786	XTZOZRCSUVZUTK-HQJQHLMTSA-N	436.307	1.017	50	20	IDGD	
Cc1cc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)[C@H](O)CCl)CC2)nc2nccn12	1824187914	LCWFXPZNEANCBJ-ZWKOTPCHSA-N	433.940	1.871	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc3nn[nH]c3c1)CC2	1826004950	WGOVQMAIQFWTCL-QWRGUYRKSA-N	434.909	1.894	50	20	IDGD	
CC(C)[C@@H](S)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827050007	DGRMZELHKBDHFP-VQTJNVASSA-N	432.395	1.554	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H]2C[C@@H](O)C2)CC1	1827680608	RHKCZAOGYZYWDP-SJUMRLIMSA-N	443.548	1.511	50	20	IDGD	
CC(C)O[C@H](C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1	1829020687	WGHNBMCKPHZGEE-UTKZUKDTSA-N	430.354	1.413	50	20	IDGD	
CCS(=O)(=O)CC(=O)N1CCC([C@@H]2CCCCN2C(=O)CO[Si](C)(C)C)CC1	1829100298	YTQBWZHHMYCAGY-KRWDZBQOSA-N	432.659	1.892	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc([N+](=O)[O-])o3)CCO2)C1	1829490441	VMQWYWCVVUTPES-MEDUHNTESA-N	446.254	1.041	50	20	IDGD	
O=C(c1cccnc1S)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1829798923	RZGBUOXSZNIBKQ-LRDDRELGSA-N	448.314	1.131	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1830363690	JCZKGRPMMZPRPO-XHDPSFHLSA-N	429.714	1.398	50	20	IDGD	
CC(C)=NO[C@H](C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1	1830414481	GEHWXZJOPAZRDA-UTKZUKDTSA-N	443.353	1.401	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](O)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H](O)CCl)CC1	1830666439	NRNUHRNDSDDRNU-OWCLPIDISA-N	447.960	1.049	50	20	IDGD	
CC(C)(Cc1ccccc1)C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1	1830719685	HIZVAYNZFPLTDB-GCJKJVERSA-N	438.952	1.311	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CSc2nc[nH]n2)CC1	1832151616	FSILZNZKFBNFQV-GJZGRUSLSA-N	429.974	1.770	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](F)c3ccccc3)CC2)CC1)[C@@H](O)CCl	1833307969	FPUAFGPYXXOCIS-OALUTQOASA-N	425.932	1.869	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3ccc4ccnn4c3)CC2)CC1)[C@@H](O)CCl	1833312370	RMGFAEPSYSVGOS-IBGZPJMESA-N	433.940	1.119	50	20	IDGD	
COc1cc(C(=O)N2CCC(N3CCC(NC(=O)[C@@H](O)CCl)CC3)CC2)ccc1F	1833312841	HKCSDJISZSMKCU-SFHVURJKSA-N	441.931	1.619	50	20	IDGD	
C[C@@H](C(=O)NC1CCN(C2CCN(C(=O)CO[Si](C)(C)C)CC2)CC1)n1ccnc1	1833377031	WYQJWEKZSVBAHA-KRWDZBQOSA-N	435.645	1.867	50	20	IDGD	
CCc1nn(C)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](Cl)CC)C3)C2)c1Cl	1833595925	KOHFOOIYEGMLNC-BFUOFWGJSA-N	447.363	1.723	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3ncc(F)cc3F)CC2)CC1	1833603313	BCRVGUFYNYSLTJ-INIZCTEOSA-N	444.910	1.799	50	20	IDGD	
COc1ccccc1C(=O)N1CCOC[C@]2(CN(C(=O)CCBr)CCO2)C1	1834823721	FNZFICOLVZPKHR-IBGZPJMESA-N	441.322	1.550	50	20	IDGD	
CCCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1	1834881891	AZAPIZLAPCCOSE-OAQYLSRUSA-N	449.460	1.390	50	20	IDGD	
C=C[C@H](O)C(C)(C)C(=O)N1CCC(N2CCC(NC(=O)CO[Si](C)(C)C)CC2)CC1	1835837004	JRIACYFFIGWNQU-IBGZPJMESA-N	439.673	1.983	50	20	IDGD	
Cc1nnsc1C(=O)N1CCC(N2CCC(NC(=O)[C@H](F)Br)CC2)CC1	1836412651	OXUZMPJHYDUJDA-AWEZNQCLSA-N	448.362	1.722	50	20	IDGD	
O=C(c1cc(O)nc(Cl)c1)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836714966	GLNCFDZRSYVDBQ-OAHLLOKOSA-N	446.331	1.653	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc4cccnc4n3)CCO2)C1	1836832468	BJHOGQYRDDAJFJ-KKSFZXQISA-N	432.908	1.717	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3c(C)nn(C)c3C)CC2)CC1	1836958717	GFNFFCYWJPGZQO-SFHVURJKSA-N	440.972	1.903	50	20	IDGD	
COCCn1nccc1C(=O)N1CCC(OC2CCN(C(=O)C(Cl)Cl)CC2)CC1	1838138248	QDNNTCSUZMJUIC-UHFFFAOYSA-N	447.363	1.945	50	20	IDGD	
Cc1cc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)on1	1839150249	GNTQCUSSSAPOKX-QZTJIDSGSA-N	434.320	1.218	50	20	IDGD	
CN1CCCC[C@@H]1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2	1839150657	SWRXSEKCDBLYTM-AYOQOUSVSA-N	436.380	1.163	50	20	IDGD	
C[C@@]1(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)CC1(F)F	1839156383	NYZQHZNDEYPNOZ-HRCADAONSA-N	429.291	1.724	50	20	IDGD	
O=C(/C=C/c1ccco1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839197663	DUEAVQCMPBMMPU-PKOQZONYSA-N	431.258	1.440	50	20	IDGD	
O=C(c1cccc(-c2cnco2)c1)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1	1839365036	WMPFNBYKSRAIIO-UTKZUKDTSA-N	449.891	1.011	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccccc3Cl)C2)C1	1840154190	OWXOIXYPYBIQTC-LPHOPBHVSA-N	431.316	1.664	50	20	IDGD	
O=C(c1ccc(Cl)nc1F)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840186128	BPTZACVDDPICJB-MRXNPFEDSA-N	440.686	1.748	50	20	IDGD	
O=C(c1cc(O)nc(Cl)c1)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840186335	JOOWGBDAAHLOQI-INIZCTEOSA-N	438.695	1.314	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)cc2c[nH]nc12	1840189692	HIXMQUZLJBTIQH-LJQANCHMSA-N	441.315	1.745	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3cc(C)cc(F)c3)CCO2)C1	1840241687	RBUAOYKAPHLSRG-GHTZIAJQSA-N	442.915	1.387	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H](C(=O)N2CCCC23CN(C(=O)[C@H](O)CCl)C3)C[C@@H]2C[C@@H]21	1841359790	VTWFTRZPIVGCKY-ZQDZILKHSA-N	427.929	1.187	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)CCc1ccc(F)nc1)C2	1843415377	OBLCAZJQKHODOY-CVKSISIWSA-N	440.479	1.491	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)Cc1c(F)ccc(F)c1F)C2	1844263537	OEYCCLFSDMBQCF-UHFFFAOYSA-N	447.417	1.162	50	20	IDGD	
C[C@@H](C(=O)N1CCCC12CN(C(=O)[C@@H](Br)Cc1ccccc1)C2)n1cnnn1	1846648345	WKHWGEVHLMWFQR-HOCLYGCPSA-N	447.337	1.444	50	20	IDGD	
COc1cc(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](O)CCl)ccc1Br	1847561837	IFUZGBILPNHVEI-IHRRRGAJSA-N	431.714	1.873	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@@]2(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](O)CCl)C1	1847563038	LVXFRUANDKJSBM-DQKQSUEQSA-N	441.956	1.435	50	20	IDGD	
CC(C)[C@@H](C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cnccc1C(=O)NN)c1ccccc1	1847615065	JNHLKYFEYIQSIX-PCCBWWKXSA-N	435.528	1.940	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H]1CC(=O)N(Cc2cccs2)C1	1848148506	DEVZKJMYWGQFBS-ORQFMDKSSA-N	439.965	1.552	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc3ccccc3[nH]c2=O)c1	11660580	DMIWOILNKIVJQW-UHFFFAOYSA-N	442.497	1.633	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)CN2C(=O)N[C@](C)(c3ccc(F)cc3)C2=O)cc1	28028967	QNWADGDTZJTTFX-OAQYLSRUSA-N	444.488	1.841	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)CN1C(=O)N[C@@](C)(c2ccc(F)cc2)C1=O	28698367	BMPZUWHBTRAYSH-NRFANRHFSA-N	438.419	1.010	50	20	IDGD	
Cc1ccc(-c2nnn(CC(=O)NNC(=O)CCN3CCN(c4ccccc4)CC3)n2)cc1	727941021	PHYUMEUPRVYLAA-UHFFFAOYSA-N	448.531	1.008	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)[C@@H](C)NC(=O)c3n[nH]c4ccccc34)n[nH]2)cc1	728208231	KYNCRHXTXXZBKK-CYBMUJFWSA-N	431.456	1.841	50	20	IDGD	
CCc1cccc(OCC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)c1	728212779	DIQXDKFYNGNEKC-UHFFFAOYSA-N	432.546	1.707	50	20	IDGD	
Cc1cccc(N2C[C@@H](C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)CC2=O)c1C	728846254	VTNIQZWMAZDNSF-SFHVURJKSA-N	436.516	1.510	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCCc2ccc(NC(C)=O)cc2)c2ccccc2c1=O	729057297	FOZKZVCCGPQLNC-UHFFFAOYSA-N	436.472	1.562	50	20	IDGD	
O=C(COC(=O)c1sccc1OC(F)F)NNC(=O)[C@@H]1COc2ccccc2O1	729775141	PYLKFHLBEWASAO-LBPRGKRZSA-N	428.369	1.494	50	20	IDGD	
COc1cc(C(=O)NNC(=O)N[C@H](C)CN2CCN(C)CC2)ccc1OCCC(C)C	730131568	RCKQMLSNSBAECV-QGZVFWFLSA-N	435.569	1.700	50	20	IDGD	
O=C(NCCS(=O)(=O)N1CCSCC1)NNC(=O)c1cc2c(s1)CCCCC2	730582446	AVKJCCXBSCPTFO-UHFFFAOYSA-N	446.620	1.340	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(C)(C)c2ccccc2)cc1S(=O)(=O)N1CCOCC1	731172932	DAZMCAAZDOHXQO-UHFFFAOYSA-N	445.541	1.755	50	20	IDGD	
COc1ccc(CCN2C[C@H](C(=O)NNC(=O)Cc3ccccc3F)CC2=O)cc1OC	731328740	DPPJXKZTUQUERV-QGZVFWFLSA-N	443.475	1.624	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)c1sccc1S(=O)(=O)N1CCOCC1)c1ccccc1	731999949	AUMNUYUERFRHLI-OAHLLOKOSA-N	437.543	1.724	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)N[C@@H](Cc1ccccc1)CN1CCOCC1	732476357	GICOMFAMJBAXFG-MJGOQNOKSA-N	444.507	1.867	50	20	IDGD	
O=C(NNC(=O)[C@H](Cc1cccnc1)NC(=O)c1ccccc1)c1cccc([N+](=O)[O-])c1	733252207	HTQUIWSPSAIVCH-IBGZPJMESA-N	433.424	1.792	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)[C@@H]1CCCCN1C(=O)c1ccccc1	734240156	KDYPJNAVJSVZAX-INIZCTEOSA-N	433.509	1.536	50	20	IDGD	
COc1ccc(CN2CC[C@H](NC(=O)NNC(=O)c3cc(OC)cc(OC)c3)C2=O)cc1	734541740	JJXGZIPDWKFAJU-IBGZPJMESA-N	442.472	1.458	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)c2sccc2S(=O)(=O)N2CCc3ccccc3C2)cn1	735449626	JHYDXOHWGWCEPX-UHFFFAOYSA-N	445.526	1.303	50	20	IDGD	
CC(C)(C)OC(=O)NC1(C(=O)NNC(=O)CNC(=O)c2ccco2)Cc2ccccc2C1	736010372	FHNWQKBRDBEKTL-UHFFFAOYSA-N	442.472	1.219	50	20	IDGD	
C[C@@H]1[C@@H](C)S(=O)(=O)CCN1C(=O)CCC(=O)C(C#N)=C1N(C)c2ccccc2N1C	736269797	GSMRTVBKZONAFN-HUUCEWRRSA-N	430.530	1.691	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(N2CCOC2=O)cc1)c1cccc(OC(F)F)c1	740811945	JWFMWNAHOREMPS-UHFFFAOYSA-N	427.385	1.868	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)N[C@@H](C)[C@H]2CN(Cc3ccccc3)CCO2)cc1	741425200	KSJNCFSEZFXXDS-LAUBAEHRSA-N	442.516	1.694	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNC(=O)CN2C(=O)[C@@H]3[C@H]4CC[C@@H](O4)[C@@H]3C2=O)cc1	742474375	WUXROGWJADCOSS-RWQQGDIJSA-N	429.473	1.035	50	20	IDGD	
COc1ccc(N2C[C@@H](C(=O)NNC(=O)c3cc(Br)ccc3O)CC2=O)cc1	743729998	LAAINLDUEKOKLM-NSHDSACASA-N	448.273	1.977	50	20	IDGD	
O=C(CCc1nc(-c2ncccn2)no1)NNC(=O)c1cc(Br)ccc1O	743731573	UMONHTRULUUGJK-UHFFFAOYSA-N	433.222	1.389	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1)NC1CCCC1	744052556	HXHFWWRPMPRUQV-ZDUSSCGKSA-N	439.494	1.269	50	20	IDGD	
CCOc1ccc(N2C[C@H](C(=O)OCC(=O)NNC(=O)c3cccc(C)c3)CC2=O)cc1	744461606	KEZSQJJZQSAKLP-QGZVFWFLSA-N	439.468	1.751	50	20	IDGD	
CCCc1noc(CCCC(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)n1	744621209	VDOKIVDULWNIGQ-UHFFFAOYSA-N	437.522	1.509	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	744642828	HHLLMPJWSDWGHN-INIZCTEOSA-N	440.481	1.619	50	20	IDGD	
O=C(NNC(=O)c1cc(S(=O)(=O)N2CCCC2)ccc1O)c1ccc([N+](=O)[O-])cc1	745991086	PJVDANRAPHEPFJ-UHFFFAOYSA-N	434.430	1.160	50	20	IDGD	
COc1cc(C)nc(NNC(=O)[C@H]2CC(=O)N(c3cc(OC)c(OC)c(OC)c3)C2)n1	746633405	SIKQEPJITVIPRX-LBPRGKRZSA-N	431.449	1.316	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H](COC)c2ccco2)c1	746769700	FXXXOARPPQCGMY-MRXNPFEDSA-N	438.506	1.642	50	20	IDGD	
COC(=O)c1ccsc1N1CC[C@H](NC(=O)NNC(=O)C(C)(C)c2ccccc2)C1=O	746779866	LKWZESPIRDLZMD-HNNXBMFYSA-N	444.513	1.948	50	20	IDGD	
CCC(=O)NNS(=O)(=O)c1c(Br)cc(C(=O)O)cc1Br	747595869	IMRJBKOENFBDTE-UHFFFAOYSA-N	430.074	1.629	50	20	IDGD	
COC(=O)c1ccccc1S(=O)(=O)N1CCC(C(=O)NNc2cccc(C#N)c2)CC1	748044198	ACPQZBSSIPIIFE-UHFFFAOYSA-N	442.497	1.889	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)NCc1ccccc1CN1CCC(O)CC1	749589827	IZOYRUKCIMTVIO-UHFFFAOYSA-N	426.517	1.725	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(CCCNC(=O)NNC(=O)CCc2ccccc2)CC1	750324941	NOKJRCWKQVHRIF-UHFFFAOYSA-N	433.553	1.892	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)N[C@@H](C)CO[C@H]2CCOC2)c2ccccc2c1=O	753948798	RMGGGTXHYACPGD-GJZGRUSLSA-N	431.493	1.335	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)[C@H](NC1CCOCC1)C(C)C	754502507	AMELANMCGPPLAU-GOSISDBHSA-N	441.912	1.446	50	20	IDGD	
CS(=O)(=O)CCN1CCC(NC(=O)NNc2cc(C(F)(F)F)ccc2F)CC1	754643832	FRXQEUZPKORCFO-UHFFFAOYSA-N	426.436	1.980	50	20	IDGD	
C[C@@H](CS(=O)(=O)c1ccc(F)cc1)C(=O)NNC(=O)c1cc(Br)c[nH]1	755066754	XSVPXWRWNKUBCU-VIFPVBQESA-N	432.271	1.787	50	20	IDGD	
COCCN(C)S(=O)(=O)[C@@H]1CCCN(C(=O)NNC(=O)c2ccc3ccccc3c2)C1	755227213	KPYIRYOYBWGGKU-LJQANCHMSA-N	448.545	1.567	50	20	IDGD	
COC(=O)CCOc1ccc(NC(=O)NNC(=O)c2nnc(O)c3ccccc23)cc1	756279199	PUILGHZILLDHQC-UHFFFAOYSA-N	425.401	1.744	50	20	IDGD	
CCn1nc(NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1C1CC1	756887971	UJUYOUCFQGEIFM-UHFFFAOYSA-N	434.522	1.562	50	20	IDGD	
Cc1cc2c(cc1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N3CCCC3)c1)OCO2	757978181	CTVPXAKZFUDFCI-UHFFFAOYSA-N	446.485	1.975	50	20	IDGD	
CC(C)(C)OC(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c1	763471867	ODQHUSUPHGLSBF-UHFFFAOYSA-N	442.428	1.879	50	20	IDGD	
CCN(CC)CCNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2ccccc2F)c1	763555240	BWCFXBSTTIWYMP-UHFFFAOYSA-N	443.479	1.297	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)C(=O)Nc1ccc(-n2cccn2)c(Cl)c1	763559819	WCBMMSKIHJWTDP-UHFFFAOYSA-N	427.804	1.654	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)C3CC3)cc2C(F)(F)F)C[C@@H](C)O1	763562899	NNOZWZYMIUOVPZ-PHIMTYICSA-N	428.411	1.815	50	20	IDGD	
CCCc1cc(NC(=O)C(=O)NNC(=O)COc2cccc(C(F)(F)F)c2)n(C)n1	763641527	WZXUOFNIFXISBU-UHFFFAOYSA-N	427.383	1.556	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2ccccc2N2CCOC2=O)c1	763666007	SXWQEKOICXRFTK-UHFFFAOYSA-N	426.429	1.425	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(OC[C@@H]3CCCO3)c2)cc1	763672990	AHMINENWXVYSQC-IBGZPJMESA-N	438.440	1.281	50	20	IDGD	
CC(C)Oc1c(F)cc(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)cc1F	763682196	SIZVTCKNMFSMCD-UHFFFAOYSA-N	432.383	1.789	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc2oc(CC)nc2c1	763682359	RGSQGPITCWNZDI-UHFFFAOYSA-N	426.429	1.954	50	20	IDGD	
COC(=O)c1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)COc1ccc(C#N)cc1	763682650	YPFIRQRLBRYUKE-UHFFFAOYSA-N	430.804	1.163	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2ccc(N3CCO[C@@H](C)C3)cc2)c1	763771448	ASBGTRYTGOFGRT-AWEZNQCLSA-N	442.472	1.329	50	20	IDGD	
O=C(NNC(=O)c1cc2c(s1)CCC2)C(=O)Nc1cccc(N2CCCNC2=O)c1	763780634	CGZWDGPBFWPEJG-UHFFFAOYSA-N	427.486	1.556	50	20	IDGD	
CC(=O)NCc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)cc1	763852116	VBJXITLTAQOJTG-HNNXBMFYSA-N	426.473	1.493	50	20	IDGD	
Cc1nc(-c2ccccc2NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)no1	763864071	FPWXQPBPVAIAPA-LLVKDONJSA-N	427.392	1.738	50	20	IDGD	
COC(=O)N(C)c1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)cc1	763871528	HIDLWIYHLWYIJI-LBPRGKRZSA-N	432.408	1.582	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccc(NC(=O)C2CC2)nc1	763874076	ZLAYDBUXJQOXFM-LLVKDONJSA-N	429.408	1.123	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccc(-c3cn4ccsc4n3)cc2)n1	763884223	DGWUSTQFKAQTIC-UHFFFAOYSA-N	437.485	1.662	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccccc2N(C)C(C)=O)ccc1OC(C)C	763916122	ILNDOAFVPDHPTI-UHFFFAOYSA-N	442.472	1.865	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3ccc4c(c3)C(=O)N(C)C4=O)cc2C1	763940750	IJEIZYVBFNGBNQ-JTQLQIEISA-N	440.481	1.498	50	20	IDGD	
CCOC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)cc1	763974418	OLJLKXATCRBHFR-UHFFFAOYSA-N	435.820	1.387	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)C(=O)Nc1cc(Cl)ccc1C(=O)N1CCCCC1	763993811	RREDEHLWPABQLR-UHFFFAOYSA-N	431.880	1.704	50	20	IDGD	
O=C1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3cccc(C(F)(F)F)c3)cc2)CCN1	764036942	FHOALSFNNLZOAX-UHFFFAOYSA-N	449.389	1.041	50	20	IDGD	
NS(=O)(=O)c1cc(F)cc(NC(=O)C(=O)NNC(=O)c2cccc3ccccc23)c1	764050182	BBOYLRDFYUTXDH-UHFFFAOYSA-N	430.417	1.026	50	20	IDGD	
CCOC(=O)c1cc(-c2ccccc2)ccc1NC(=O)C(=O)NNC(=O)c1cc(C)[nH]n1	764108466	IIHNGNTZAZAHRN-UHFFFAOYSA-N	435.440	1.962	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1O)C(=O)Nc1cccc(CN2CCOC2=O)c1	764116842	IQEQTQPFWRGMFS-UHFFFAOYSA-N	432.820	1.398	50	20	IDGD	
COCCOc1ccc(Br)cc1NC(=O)C(=O)NNC(=O)CC(C)(C)C	764198229	FHNPRJMXHSDFSM-UHFFFAOYSA-N	430.299	1.996	50	20	IDGD	
Cn1cc(NC(=O)C(=O)NNC(=O)CCC2CCCCC2)cc(Br)c1=O	764211579	QYPMOWYPAXVJSO-UHFFFAOYSA-N	427.299	1.594	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1cccc(C(=O)N2CCCCC2)c1	764279941	ILPZNLNGGFVZAB-UHFFFAOYSA-N	440.456	1.183	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)C(=O)Nc1ccc(CN2CCOC2=O)cc1	764345538	GWQPWDXFOPBQNE-UHFFFAOYSA-N	448.439	1.224	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)C(=O)Nc1ccnn1-c1ccc(Cl)cc1	764363904	WEZGJBFTXCPJGQ-UHFFFAOYSA-N	427.848	1.828	50	20	IDGD	
Cc1cc(C(=O)NC(C)C)ccc1NC(=O)C(=O)NNC(=O)C(F)(F)Oc1ccccc1	764371092	XDKHAIBGSKEQAI-UHFFFAOYSA-N	448.426	1.891	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc3ccccc3)cc2)CCO1	764379784	KMQGODVYKVRUBJ-AWEZNQCLSA-N	448.426	1.669	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1cccc2c1oc(=O)n2C	764392342	DPYWFNQYHUJDFX-UHFFFAOYSA-N	430.442	1.018	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1ccc(N2CCOC2=O)cc1	764398502	SUVWMIUSRDWUSX-UHFFFAOYSA-N	444.469	1.530	50	20	IDGD	
CC(=NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C)[C@H](C)c1nc2ccccc2s1	764817286	KOYKSPQUSWLPDI-NSHDSACASA-N	439.501	1.339	50	20	IDGD	
CCC(=NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1)C1CCOCC1	764817512	FFIWJSLZHVASPQ-UHFFFAOYSA-N	436.578	1.610	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CSc2ccccc2O)ccc1OCC(=O)NC(C)C	765247287	AKBLWIZXTZXXAL-UHFFFAOYSA-N	447.513	1.858	50	20	IDGD	
CC(C)S(=O)(=O)c1ccccc1C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C	765312798	BAWPHSJYFSFCIO-UHFFFAOYSA-N	427.523	1.935	50	20	IDGD	
O=C(NN=C1CCN2CCC[C@H]12)c1cc(S(=O)(=O)NCc2ccccc2)ccc1O	765563024	IJIUPCXRCYLGEO-LJQANCHMSA-N	428.514	1.825	50	20	IDGD	
C#CCNS(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)c1	765571842	PYWJLVKQTIYTDI-UHFFFAOYSA-N	429.483	1.125	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)Cc3ccc(S(N)(=O)=O)cc3)n[nH]2)cc1	765574598	AXCLRIKWVKEHSM-UHFFFAOYSA-N	427.486	1.290	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)[C@@H](C)NC(=O)c3cccs3)n[nH]2)cc1OC	765602167	WKRKHYBHUBGJGS-LLVKDONJSA-N	443.485	1.735	50	20	IDGD	
COc1ccc(S(N)(=O)=O)cc1NC(=O)COC(=O)[C@@H](Br)C(C)(C)C	766751847	NOBKAQHDYDBIEV-CYBMUJFWSA-N	437.312	1.634	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)CN1CCN(C(=O)c2cccc(Cl)c2)CC1	766842587	FWJBRDIOGBSOBD-UHFFFAOYSA-N	428.920	1.796	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)CCC(=O)c2ccc3c(c2)CCC(=O)N3)nc2ccccc21	767244959	QOIWDSWQNXFXEV-UHFFFAOYSA-N	433.468	1.811	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)c1ccc2nc[nH]c2c1	768290545	JNYBOMJOSSIRLS-UHFFFAOYSA-N	426.908	1.795	50	20	IDGD	
CSCC[C@H](NC(=O)c1ccc([N+](=O)[O-])o1)C(=O)NNC(=S)Nc1ccccn1	768580050	DHCOCWNCEIEGPN-JTQLQIEISA-N	438.491	1.452	50	20	IDGD	
CC(C)Cn1ncc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1C1CC1	768649123	QHYBFPPIJOAIKI-GOSISDBHSA-N	442.472	1.561	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)c3cccc([C@@]4(C)NC(=O)NC4=O)c3)n[nH]2)cc1	768958072	WBVCCPTUCLGBPY-JOCHJYFZSA-N	432.440	1.515	50	20	IDGD	
CN1CCN(CCCNC(=O)NNc2nc(O)c3cnn(C)c3n2)[C@@H](c2ccccc2)C1	770339086	CSNRQSZDSCPCGY-QGZVFWFLSA-N	439.524	1.074	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)N1CCN(c2nccnc2C#N)C[C@H]1C	770647519	MQVGAXDLVMJRMC-KGLIPLIRSA-N	443.895	1.720	50	20	IDGD	
CC1CCN(C(=O)C(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)CC1	771608393	KSITWLXPDFRYCO-UHFFFAOYSA-N	447.499	1.408	50	20	IDGD	
CCN1CCC[C@@H]1CN1C[C@@H](C(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)CC1=O	772997455	VDUPIYBABGSFLC-HLLBOEOZSA-N	436.940	1.588	50	20	IDGD	
CCNC(=O)N1CCc2ccc(NC(=O)C(=O)NNC(=O)c3ccc(C)c(F)c3)cc21	773889752	OARZXEUZIQANEH-UHFFFAOYSA-N	427.436	1.626	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)NC[C@@H]1COC2(CCCCC2)O1	776070302	VCLTZJYSHDXEGP-HXUWFJFHSA-N	445.564	1.605	50	20	IDGD	
COC(=O)C1(c2ccc(S(=O)(=O)NNC(=O)c3cc(Br)c[nH]3)cc2)CC1	776272822	XPTJAKYIRKRNMY-UHFFFAOYSA-N	442.291	1.605	50	20	IDGD	
CC(=NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1)C1CCSCC1	777442869	JQDLLGBUWVWVRI-UHFFFAOYSA-N	438.619	1.937	50	20	IDGD	
Cc1cc(Br)cc(C=NNC(=O)[C@@H](C)NS(C)(=O)=O)c1OC(F)F	777886554	ZQVNRAAQPIKJLQ-MRVPVSSYSA-N	428.255	1.747	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)n[nH]1	778689754	UBUUZOZPZZCERB-UHFFFAOYSA-N	425.357	1.797	50	20	IDGD	
COC[C@H](C)n1ccc(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2Br)n1	778754073	WGEKIHPGVAAZTK-VIFPVBQESA-N	441.242	1.843	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccccc1S(=O)(=O)NC1CC1)c1ccc(Cl)cc1F	780396284	OUJJMVGKXATLDA-UHFFFAOYSA-N	447.897	1.543	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cnc3nc(C)ccc3c2O)cc1OC	781234356	MUBZJHROILDRQH-UHFFFAOYSA-N	440.412	1.279	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN(Cc2ccccc2)C[C@H](O)C(F)(F)F)n1	781343889	JPFCOECQDVXYKG-AWEZNQCLSA-N	430.452	1.567	50	20	IDGD	
CC[C@H]1C[C@@H](CC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)CCO1	781552737	ZBIMIPYJSPCTKQ-RDJZCZTQSA-N	439.534	1.064	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)CNC(=O)c2cccs2)n([C@@H]2C[C@H]3CC[C@H]2C3)n1	784005131	QAHHTTPELTYJOW-MELADBBJSA-N	444.517	1.130	50	20	IDGD	
CCN1CCN(C(=O)Cc2ccc(NC(=O)C(=O)NNc3ccc(F)cc3)cc2)CC1	784784035	JEUNUVXXMSGKDO-UHFFFAOYSA-N	427.480	1.614	50	20	IDGD	
COc1cc(F)cc(NNC(=O)C(=O)Nc2cc(C(=O)N3CCOCC3)ccc2C)c1	785245157	CLYYVSAMBRXENJ-UHFFFAOYSA-N	430.436	1.697	50	20	IDGD	
CC(C)(C)c1cc(NC(=O)NNC(=O)[C@H]2COc3ccccc3O2)n(-c2ncccn2)n1	789272902	MZFHSNIHTBISCP-OAHLLOKOSA-N	437.460	1.953	50	20	IDGD	
O=C(NC[C@H](Cc1cccc(F)c1)C(=O)N1CCOCC1)NNC(=O)c1ccccc1O	789311887	VMSJGWWZBWXBAW-INIZCTEOSA-N	444.463	1.193	50	20	IDGD	
O=C(NNc1cccc(F)c1[N+](=O)[O-])C(=O)Nc1ccc(C(=O)N2CCOCC2)c(F)c1	790997988	YVPLMNFPNIIVBJ-UHFFFAOYSA-N	449.370	1.427	50	20	IDGD	
Cc1nc2c(C(=O)NNC(=O)c3cccc(S(=O)(=O)N4CCCC4)c3)cccc2o1	791448004	ZNGWEQYXDYOEKT-UHFFFAOYSA-N	428.470	1.996	50	20	IDGD	
CN(C)N(C(=O)CCNS(=O)(=O)c1ccc(C(C)(C)C)cc1)[C@@H]1CCS(=O)(=O)C1	792854344	JIYSTCJSNZZYLO-MRXNPFEDSA-N	445.607	1.145	50	20	IDGD	
COC(=O)c1cc(Br)c(S(=O)(=O)NNC(=O)c2cccc(C)n2)s1	794599764	MHDHWIYMNJXTQF-UHFFFAOYSA-N	434.293	1.624	50	20	IDGD	
O=C(CN1CCNC(=O)[C@@H]1c1ccc(Br)cc1)NNC(=O)c1cccs1	796574589	HOZAKASECWBGSA-HNNXBMFYSA-N	437.319	1.445	50	20	IDGD	
CC(C)Oc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3n2)cc1C(N)=O	796991299	KCSFJZPPCRMQOR-UHFFFAOYSA-N	435.440	1.521	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(F)cc2-c2cnn(C)c2)c(OC)c1	797003984	FNQALICNSPQDHU-UHFFFAOYSA-N	441.419	1.643	50	20	IDGD	
CC(C)Oc1ccc(NC(=O)C(=O)NNC(=O)C(C)(C)c2ccccc2)cc1C(N)=O	797004124	IARIWKVOJNJHHL-UHFFFAOYSA-N	426.473	1.636	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2ccc(C#N)s2)c1	797815494	SACNTZMFGVCOIH-UHFFFAOYSA-N	442.544	1.274	50	20	IDGD	
CN(NC(=O)Cc1ccc([S@](C)=O)cc1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	797985174	OZWSUNFIKOULCE-PMERELPUSA-N	438.550	1.602	50	20	IDGD	
Cc1ccccc1NC(=O)NNC(=O)[C@H]1CN(Cc2nc(O)c3ccccc3n2)CCO1	798310838	WXPZVNPTVKEFRO-GOSISDBHSA-N	436.472	1.698	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H]2CCc3cnn(C)c3C2)c1	798823055	GGBHVGNHDBKLKS-HNNXBMFYSA-N	433.534	1.017	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1ccccc1Sc1ccccc1[N+](=O)[O-]	799299710	BRTFUYOWBYWSCR-GFCCVEGCSA-N	435.483	1.942	50	20	IDGD	
CN(C)C(=O)Cn1ccc(NS(=O)(=O)c2ccc(OCCBr)cc2)n1	799529534	UUKNVVDJYKHLDU-UHFFFAOYSA-N	431.312	1.546	50	20	IDGD	
CC(C)CCC(=O)NNC(=O)C(=O)Nc1cc2c(cc1N1CCCCC1)n(C)c(=O)n2C	800623804	WWSZJGDWVVFYFO-UHFFFAOYSA-N	444.536	1.389	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCCCCC2)cc1)NNC(=O)N=c1cc[nH]cc1	802036246	RXDFPLNVBYPFJQ-UHFFFAOYSA-N	445.545	1.854	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCCC(=O)NNC(=O)Nc2ccc3c(c2)OCO3)cc1C	802099698	ANFNMFSIEKWARM-UHFFFAOYSA-N	434.474	1.553	50	20	IDGD	
COc1ccc(Cl)c(NC(=O)NNC(=O)CCN2C(=O)[C@@H]3[C@H]4CC[C@@H](O4)[C@@H]3C2=O)c1	802110863	VVUJAMQYHWIRQK-XOUADPBQSA-N	436.852	1.054	50	20	IDGD	
Cc1cc([N+](=O)[O-])ccc1NNC(=O)C(=O)Nc1cccc(C(=O)N2CCOCC2)c1	807455576	OYKHKKKUCZCMAJ-UHFFFAOYSA-N	427.417	1.457	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CNS(=O)(=O)c2ccccc2C(F)(F)F)c(O)c1	810172160	AEQDUBMFRPLGCU-UHFFFAOYSA-N	431.392	1.459	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)CNS(=O)(=O)c1c(F)cccc1F	810792241	NVZTXLQJEXQFSE-UHFFFAOYSA-N	445.469	1.191	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)CNC(=O)Cc2cccc3ccccc23)cc1	812728596	QXBPCBKZSCHHMS-UHFFFAOYSA-N	440.525	1.892	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCCCN(C)C)cc1C(=O)NNc1cnc2ccccc2n1	813519067	OWTACTXXXROBLL-UHFFFAOYSA-N	442.545	1.925	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c2ccccc2c1)N[C@H]1CCS(=O)(=O)C1	814406624	DYLGBJUHVVHGGL-LBPRGKRZSA-N	426.292	1.733	50	20	IDGD	
CCOC(=O)c1cc(COC)cc(NC(=O)C(=O)NNc2ccc3c(=O)[nH]ccc3c2)c1	815639452	YESQZVBTNDQBPX-UHFFFAOYSA-N	438.440	1.933	50	20	IDGD	
CC(C)(C)OC(=O)N1CCc2c(cccc2NC(=O)C(=O)NNC(=O)[C@H]2CCCO2)C1	815779567	LHFHPRQJKUIATM-MRXNPFEDSA-N	432.477	1.245	50	20	IDGD	
Cc1ccc(S(=O)(=O)Nc2ccc(C(=O)NNc3cnnn3C)cc2)cc1[N+](=O)[O-]	816769407	GSOYVYLMRWJAER-UHFFFAOYSA-N	431.434	1.589	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)[C@@H]1CCCN(C(=O)c2ccc(F)cc2)C1	825649148	BFZBTRQSMAKWRX-MRXNPFEDSA-N	428.464	1.946	50	20	IDGD	
CC(C)[C@H]1CC[C@@H](C)C[C@@H]1OCC(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	839163473	VEAIKKZBWSHIIN-YKCBXCCJSA-N	448.516	1.994	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)cnn1-c1ccc(O)nn1	891693582	GEIUQMQQSRPAIG-UHFFFAOYSA-N	448.443	1.042	50	20	IDGD	
Cc1cc(S(=O)(=O)Nc2ccccc2C(=O)NNc2nnc(C)c(O)n2)ccc1F	899425051	ZSKAQVOULVAVIM-UHFFFAOYSA-N	432.437	1.891	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@H](C)C(=O)NNC(=O)c1cc(S(N)(=O)=O)ccc1F	912865750	ACJYIJVDWYZUOW-LLVKDONJSA-N	443.884	1.972	50	20	IDGD	
C[C@H]1CN(c2ccc(C(=O)OCC(=O)NNC(=O)c3cccc(Cl)c3)cn2)C[C@@H](C)O1	915039346	ZBBSSCZYHYDGQN-OKILXGFUSA-N	446.891	1.967	50	20	IDGD	
CCOC(=O)c1ccc(NC(=S)NNC(=O)Cn2nnc(-c3ccccc3)n2)cc1	916112520	POZGAYHTVWDZME-UHFFFAOYSA-N	425.474	1.535	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)NCC(C)(C)N1CCN(C)CC1	916258710	FFVNREMTZLQTJV-KRWDZBQOSA-N	427.549	1.964	50	20	IDGD	
CCn1cnc2c1c(=O)n(CC(=O)NN=Cc1ccc(O)cc1)c(=O)n2Cc1ccccc1	916331293	GKQZVWBIQPNYSF-UHFFFAOYSA-N	446.467	1.284	50	20	IDGD	
N#Cc1cccc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)c1	916406812	LPYRXIOAIXJIHT-UHFFFAOYSA-N	441.513	1.877	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NCCN2CCN(c3ccc(F)cc3)CC2)cc1	916513967	XVKWJRMYHGVRHG-UHFFFAOYSA-N	429.496	1.666	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Cn2nc(-c3ccccc3)ccc2=O)c2ccccc2c1=O	916740949	JBNIMJFZHUMVQL-UHFFFAOYSA-N	444.451	1.101	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=O)c2ccc(Cl)nc2)ccc1OC	917248754	BWBHMKJCYVEFPJ-UHFFFAOYSA-N	440.909	1.849	50	20	IDGD	
N#Cc1nc(C2CC2)oc1N1CCN(C(=O)NNC(=O)c2cc(Br)c[nH]2)CC1	918778513	JNKCEBJZVFXPHT-UHFFFAOYSA-N	448.281	1.691	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)c2ccc3c(c2)S(=O)(=O)N(C(C)C)C3=O)cc1	919836385	LCCBXDIHPFKLFK-UHFFFAOYSA-N	445.497	1.642	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)Nc1ccccc1CN1C(=O)CNC1=O	920931403	NYGKPHUMQLTKBS-UHFFFAOYSA-N	425.445	1.533	50	20	IDGD	
C[C@H](OC[C@H]1CCCCO1)C(=O)NNC(=O)c1ccc(CSc2nncn2C)cc1	921165805	YELOQUSHRFJTAT-WMLDXEAASA-N	433.534	1.843	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)c1ncc(C(N)=O)cc1Cl	1319398944	LIKGUJAXWRVKMB-MRVPVSSYSA-N	441.669	1.825	50	20	IDGD	
CCOC(=O)[C@H]1CN(C(=O)OC(C)(C)C)CCN1CC(=O)NNC(=O)c1cccc(C)c1	1319984351	FLLUSRRYIIIWCD-QGZVFWFLSA-N	448.520	1.240	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2nc3ccccn3n2)c1	1325403906	DIXWOQZJLXHTFB-UHFFFAOYSA-N	431.478	1.226	50	20	IDGD	
O=C(c1ccc2cnccc2n1)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1777737235	UZCOSDUAOGJZGE-YJBOKZPZSA-N	437.269	1.764	50	20	IDGD	
Cn1c(=O)n(C)c2cc(C(=O)N3CC[C@@]4(C3)CN(C(=O)C(Cl)Cl)CCO4)ccc21	1777868973	WHDHDZSMEOFBEN-LJQANCHMSA-N	441.315	1.124	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)COc1cccnc1)C2	1779539932	TXZOUZOXDOCNRM-WIYYLYMNSA-N	435.597	1.826	50	20	IDGD	
Cc1ncncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Br)C2	1779799029	JIYCHLUWIOQMNU-CKEIUWERSA-N	429.290	1.603	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H]1CC[C@H]3CCC(=O)N3C1)C2	1780707228	FFLWUSKOIUPURD-MDRIIXRWSA-N	439.984	1.919	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(CCN(C(=O)CC34CCCN3CCC4)C2)C1	1781131805	BRSDISNABHZTIF-LJQANCHMSA-N	428.371	1.620	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccc4c(c3)OCO4)CCO2)C1	1783535137	ZHEUEUWCUNLGFF-KZULUSFZSA-N	425.279	1.642	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](C)NC(=O)OC(C)(C)C)C2)C1	1783711874	BCJMJVZBSUCVJJ-VFVRVIDISA-N	448.358	1.513	50	20	IDGD	
C=CCCc1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](Cl)COC)C3)C2)c(O)n1	1783873479	PBNXWVMUKBEACY-UTKZUKDTSA-N	437.924	1.603	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(C(F)(F)F)n3C)CCO2)C1	1783874840	LUGXNUXJFVGEFY-SJKOYZFVSA-N	437.846	1.741	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)Cc3ccc4c(c3)CCCO4)CCO2)C1	1783876173	WJPPZNROINXQMI-AVRDEDQJSA-N	436.936	1.638	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccnc(C(F)(F)F)c3)C[C@@H]21)[C@@H](O)CCl	1784087001	SXOCAISSFCWWFY-XUXIUFHCSA-N	435.830	1.293	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCBr)[C@H]3C2)n(C(F)F)n1	1786409028	QFKVOTBJTFUIAI-OBJOEFQTSA-N	449.296	1.965	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C=C\C(=O)NC3CC3)[C@H]2C1	1788495542	QUCXZLYEZBVUPC-HDAVKZNTSA-N	432.348	1.037	50	20	IDGD	
CCN(CC)C[C@@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21	1790604403	SDIVWVCSQALKNF-YXMSTPNBSA-N	436.366	1.635	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cn4ccsc4n3)C[C@@H]21	1791253485	BKDMGTMRHDOZPO-XPCVCDNBSA-N	426.926	1.243	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C(F)(F)C(F)(F)C(=O)O)C[C@@H]21)C(Cl)Cl	1791292488	GISCKCHZHKMDMM-FXQIFTODSA-N	439.189	1.125	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(N3CCCCC3)cc1)C2)[C@@H](O)CCl	1792980562	TZSSRSLSEUOOLP-HNJRGHQBSA-N	435.952	1.480	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cc(C)n(C)n1	1793131791	PKYOEDZNPMFNRF-IARIHHJXSA-N	427.343	1.034	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2)c1nc2ccc(C(F)(F)F)cn2n1	1795969522	NNMFLMCEDKAVME-OTMMVIPVSA-N	449.792	1.486	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@@H](C)C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](F)Cl)cc1	1796805017	UOGJOOYOPAOFCJ-KSXIZUIISA-N	445.944	1.834	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1n[nH]c2c1CC[C@H]2C	1796968232	XHEYYJRBPYHFHO-ZRTFPUAOSA-N	439.354	1.694	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1occc1Br)c1ccc(B(O)O)cc1	1797008338	LVKDACMAEOJMIO-QDMKHBRRSA-N	447.094	1.288	50	20	IDGD	
C[C@@H](Nc1ccccc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2	1797668764	GRULXPPWOUBBNZ-CNRIWFPOSA-N	428.302	1.767	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc2cccnc2n1	1798011220	DAFKNEDDUKSYFG-MUJYYYPQSA-N	445.483	1.194	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1snnc1C1CC1)C2	1799275090	KMPDULKKFNQKST-JJHQXXDFSA-N	433.361	1.855	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)c1cc(F)cc(C(F)(F)F)c1	1799529561	DSQFMXCIEBWADT-JLUCKKNBSA-N	438.805	1.647	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1c2c(nn1C)CCC2	1800049578	FHGZEWPOAGEICM-FAXLKDOZSA-N	439.354	1.286	50	20	IDGD	
CCS(=O)(=O)N[C@@H](C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@](C)(Cl)CCl	1800076148	BQEDJWUAEIQJQH-CQUYNDQOSA-N	428.382	1.189	50	20	IDGD	
CC[C@@H](C)[C@H](N)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C#N)=C/c1ccc(F)cc1F	1800332622	TZSZIVPVYBYRFI-JEBHCDCDSA-N	446.498	1.835	50	20	IDGD	
COc1ccc(/C=C/C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](O)CCl)C3)c(F)c1	1800832363	OSLMAOIYANSECX-UYDRDUHSSA-N	426.872	1.037	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCc1cnc2[nH]ccc2c1	1800846804	XOLZTQZMKOUHNM-ZMMAXQRCSA-N	434.924	1.339	50	20	IDGD	
Cc1ccc(C(=O)C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Br)C3)cc1	1800884814	PUNJZWPWBLHOGL-FQLMCAECSA-N	427.270	1.458	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1CCc2ccccc2C1	1801844123	RNXCUAFWYGXTTK-HAGHYFMRSA-N	447.539	1.742	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cc1cc3ccccc3n1C)C2	1802335166	YLIVMBLVQLRDLO-REPLKXPHSA-N	439.560	1.732	50	20	IDGD	
O=C(COc1ccc(O)cc1)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1	1802886489	NDBHZFFOBXOBGG-CVAIRZPRSA-N	433.892	1.472	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2nc3ccc(F)cn3n2)[C@H]1c1cccnc1)[C@H](O)CCl	1803147575	ISPOTOFAMRSUSM-LXZKKBNFSA-N	446.870	1.183	50	20	IDGD	
COc1cnc(C(=O)NC[C@@H]2CCN(C(=O)[C@H](C)Br)[C@@H]2c2cccnc2)cn1	1806046577	JXQNOWDIKZJACX-RVSPLBMKSA-N	448.321	1.983	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2cc3n(n2)CCNC3=O)[C@H]1c1cccnc1	1806084767	QTAALIHTOPDQPY-RVKKMQEKSA-N	444.923	1.359	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC2(CCCN(C(=O)CSc3ccncc3)C2)CC1	1806860899	HPIOYJREWYXIQG-UHFFFAOYSA-N	447.605	1.778	50	20	IDGD	
O=C(CN1CCCC1=O)NC[C@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1	1806921856	XUOBRFLNAJEANN-DNVCBOLYSA-N	437.338	1.495	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)Cc2ccccn2)[C@H]1c1cccnc1	1807655671	LCVGHHAGAGIFDQ-FDDCHVKYSA-N	438.532	1.098	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1CCN(C(=O)Cc2cncnc2)[C@H]1c1cccnc1	1810542214	XMAJXDZCTWPBEP-RXVVDRJESA-N	427.581	1.972	50	20	IDGD	
CCc1cc(C(=O)NC[C@@H]2CCN(C(=O)[C@H](Cl)COC)[C@H]2c2cccnc2)nn1C	1811143196	HEIBZUQSIYUKLI-WDYCEAGBSA-N	433.940	1.951	50	20	IDGD	
CC(=O)NCCC(=O)NC[C@@H]1CCN(C(=O)[C@](C)(Cl)CCl)[C@H]1c1cccnc1	1812661423	KBWXUHATCQEWIN-VDZJLULYSA-N	429.348	1.850	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)CC(F)(F)C(=O)O)[C@H]1c1cccnc1	1812865433	YKDWEPLNFXSZPZ-JKOKRWQUSA-N	448.264	1.981	50	20	IDGD	
CSCC[C@H](O)C(=O)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@@H]1c1cccnc1	1813094441	YVKWGPZGHZNWLG-XQLPTFJDSA-N	448.358	1.892	50	20	IDGD	
CCS(=O)(=O)N[C@H](C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)C(Cl)Cl)[nH]n1	1815167869	KNZSCRSLNHAWEC-KOLCDFICSA-N	440.353	1.533	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ncc[nH]2)n[nH]1	1816247520	FYRXEGZRAPDUOT-HURLIOHXSA-N	437.464	1.573	50	20	IDGD	
Cc1cc(C(=O)NCC(=O)N[C@H]2CCc3nc(NC(=O)[C@H](F)Cl)sc3C2)no1	1817125164	GKEVAGDWVAQZTM-SDBXPKJASA-N	429.861	1.316	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)Cc2cscn2)[nH]n1)c1cccc(B(O)O)c1	1817475683	XZTOSDCJXCDILB-QGZVFWFLSA-N	439.306	1.095	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)CCBr)[nH]n1)c1cc(O)nc(O)n1	1818029209	YKXLVRVKMMCJIQ-NSHDSACASA-N	439.270	1.702	50	20	IDGD	
COCCCC(=O)N1CCCC[C@H]1c1cc(NC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)n[nH]1	1818110390	DRQBWNFIZDSFEW-ZZQPOVDQSA-N	443.508	1.962	50	20	IDGD	
C[C@@H]1CCC[C@@H]1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnccc1C(=O)NN)CC2	1818880831	WUZMXCNKTQKALK-AGIUHOORSA-N	442.545	1.804	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)/C=N/O[C@@H]3CCCCO3)sc2C1	1819907865	UCECTEYCUPROCO-NNUZQQSMSA-N	444.941	1.838	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H]2CNC(=O)C2)n[nH]1	1821962347	ROEMZLNWKHBUSE-GMXVVIOVSA-N	426.315	1.711	50	20	IDGD	
Cc1cccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)n1	1822412722	GRJBAMUTPIZHOY-QGZVFWFLSA-N	427.509	1.792	50	20	IDGD	
O=C(CCn1cncn1)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](F)Br)[nH]n1	1822682734	CMDDLBRVIZEJAP-FZMZJTMJSA-N	428.266	1.774	50	20	IDGD	
CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](F)Cl)[nH]n1	1822701323	FPYPANYDWVWQPU-YCPHGPKFSA-N	439.879	1.407	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CSc2nc[nH]n2)n[nH]1	1822713611	JEODBJCUGQVPKU-PWSUYJOCSA-N	427.918	1.566	50	20	IDGD	
CN1C(=O)CC[C@H]1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@](C)(Cl)CCl)CC2	1823051897	TXZJILQGMZGCAH-MIHTYCSTSA-N	433.361	1.912	50	20	IDGD	
C=CCO[C@H](C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1	1824507248	KCPFUVCYWYAZGD-UZLBHIALSA-N	443.548	1.510	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H]3CCNC(=O)C3)sc2C1	1826228799	PRZJNUWGNUTBFC-MXWKQRLJSA-N	443.367	1.755	50	20	IDGD	
C[C@@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1)n1cccn1	1827059629	FCYKJRKGIQSOEI-UWJYYQICSA-N	438.337	1.057	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](O)CCl)CC2)c1ccc(CO)c(F)c1	1827903024	RWANKYMWIBSEPB-FZMZJTMJSA-N	427.885	1.600	50	20	IDGD	
Cc1c[nH]cc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1	1828926714	OHDUBSNOKWYSIC-FQEVSTJZSA-N	438.532	1.869	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H](O)N2CCOCC2)CC1	1828974388	RUMRQXXUPHBRTA-ZVZYQTTQSA-N	446.386	1.040	50	20	IDGD	
C=CCO[C@H](C)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](C)CBr)CCO2)C1	1830536088	XXTVFIMJTZZDAJ-IIDMSEBBSA-N	433.343	1.065	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3CC[C@@H](C)O3)C2)C1	1830540956	XCGNNIHJTDCXRM-ATNYBXOESA-N	433.343	1.041	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H](COC)NC(C)=O)CC1	1831830355	AGEBFULAEVTKSL-OKZBNKHCSA-N	431.961	1.011	50	20	IDGD	
CCn1nc(C(=O)N2CCC([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)cc1C	1831873530	NPGGHPUSZGYLHY-HXUWFJFHSA-N	446.596	1.818	50	20	IDGD	
CSCC[C@@H](O)C(=O)N1CCC(N2CCC(NC(=O)C(C)(C)CCl)CC2)CC1	1833216084	UBFJIDNJVCAOIF-QGZVFWFLSA-N	434.046	1.937	50	20	IDGD	
Cc1nc(CC(=O)N2CCC(N3CCC(NC(=O)[C@@H](O)CCl)CC3)CC2)c(C)s1	1833307867	BQGBHPHYYWGVRP-SFHVURJKSA-N	443.013	1.474	50	20	IDGD	
Cc1ncccc1CCC(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)CCl)CC2)CC1	1833308168	KQZPAVWSISOLBI-FQEVSTJZSA-N	436.984	1.494	50	20	IDGD	
C#CCO[C@H](C)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)Br)CC2)CC1	1833469027	JUJULLUWRSMRNT-HUUCEWRRSA-N	428.371	1.380	50	20	IDGD	
Cc1ccn(CC(=O)NC2CCN(C3CCN(C(=O)[C@H](C)Br)CC3)CC2)n1	1833854640	IFTUHSAQEMNQPY-HNNXBMFYSA-N	440.386	1.547	50	20	IDGD	
Cc1ncccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)CBr)C2)C1	1834035368	NUIPPTBNLFBQKW-AUUYWEPGSA-N	440.338	1.491	50	20	IDGD	
O=C(CCc1ccsc1)NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1834825204	AHVSCJYOXSWOKR-GOSISDBHSA-N	427.998	1.852	50	20	IDGD	
C[C@H](Nc1nccs1)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1835104936	ROMBVHWHLKOBBU-BBRMVZONSA-N	444.001	1.115	50	20	IDGD	
Cc1ocnc1C(=O)NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1	1836008778	DQTCFNZIJKOZQJ-UHFFFAOYSA-N	427.343	1.953	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)CCc3ncc[nH]3)CC2)CC1)[C@@H](F)Br	1836414357	GQPMNFNXUDTGFM-QGZVFWFLSA-N	444.349	1.604	50	20	IDGD	
C=C(CC(=O)OCC)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836718053	PIGNXSSVTBACBO-KRWDZBQOSA-N	430.929	1.094	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)[C@@H]3CCCN3C)CC2)CC1	1837003999	OLHNFCDCBIHMCK-YOEHRIQHSA-N	430.387	1.863	50	20	IDGD	
CCc1ncsc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](Cl)COC)C2)C1	1838838933	HTIYLMYLNNZELZ-SCLBCKFNSA-N	431.942	1.029	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)OC(=O)NC(C)C)CCO2	1839073724	CXJHMJSHLIUPKG-QRWLVFNGSA-N	447.960	1.373	50	20	IDGD	
Cc1cc2cc(C(=O)N3CCO[C@@]4(COCCN(C(=O)[C@H](O)CCl)C4)C3)ccc2[nH]1	1839614402	DQSWXENBAMTDEK-NQIIRXRSSA-N	435.908	1.146	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(F)cn3)C2)C1	1840031513	SFZZJLRMXKTMNI-PXAZEXFGSA-N	430.274	1.074	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1C[C@@H]1c1ccccc1)CCO2	1840121051	DZYZOLCAYYFHTP-MDPIYQRISA-N	436.936	1.500	50	20	IDGD	
O=C(Cc1cc(F)ccc1[N+](=O)[O-])N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1840887227	BJKHEFUJHJRXTG-AEFFLSMTSA-N	447.822	1.267	50	20	IDGD	
O=C(c1cccc(I)c1)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1	1841352668	FHFBHVXXARVFQL-CYBMUJFWSA-N	448.688	1.708	50	20	IDGD	
CN[C@H](CC(=O)N1CCCC12CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)C2)C(=O)O	1842953033	LCKIURRNLYIHKZ-OEXZBZRSSA-N	432.427	1.138	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)/C=C/c1cnc(C)s1)C2	1843417311	VRFHGXKUSQMJNX-WDTMVEHESA-N	440.529	1.802	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCCC12CN(C(=O)c1cnc3c(c1)CCNCC3)C2	1846072359	SZRXLHYVIKZKOG-MRXNPFEDSA-N	435.366	1.760	50	20	IDGD	
O=C(c1cn2c(Br)cccc2n1)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl	1847564372	YPYCDZVOBRFXSQ-RWMBFGLXSA-N	441.713	1.512	50	20	IDGD	
Cc1nc(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)co1	1848095578	AARCLKACMDVSQF-QEJZJMRPSA-N	426.901	1.931	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)c2cccc(S(=O)(=O)NC(C)C)c2)cc1	9755274	BEYGZSAXQLPRGX-UHFFFAOYSA-N	433.486	1.300	50	20	IDGD	
O=C(NNC(=S)NCCc1cccs1)c1cccc(S(=O)(=O)N2CCCC2)c1	11505234	MRJWBLYVHQJEFS-UHFFFAOYSA-N	438.600	1.884	50	20	IDGD	
CS(=O)(=O)NCCc1ccc(C(=O)NNC(=O)CCSc2ccc(F)cc2)cc1	12683193	DWWWZFNNQORBME-UHFFFAOYSA-N	439.534	1.861	50	20	IDGD	
Cc1cc(C)cc(C(=O)NCC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)c1	12702338	KHBDUTOSHIJDFU-UHFFFAOYSA-N	431.518	1.096	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)c1ccc(S(=O)(=O)C(F)F)cc1	13082232	RPIFPXOEOAKZBO-UHFFFAOYSA-N	436.396	1.649	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)N(C)CCCC(=O)NNC(=O)c2ccccc2O)cc1	17574600	RJGPOLVJYNBURJ-UHFFFAOYSA-N	433.486	1.457	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCc2ccc3c(c2)CCO3)cc1	726272395	KBKAFGFUBIXTTG-UHFFFAOYSA-N	432.502	1.081	50	20	IDGD	
NC(=O)c1cccc(CCNC(=O)NNC(=O)COc2ccc(Br)cc2)c1	726621477	VJEIWUXVYNUKPG-UHFFFAOYSA-N	435.278	1.500	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2nnn(-c3cccc(Cl)c3)c2C)n1	728732377	LCYIIVRWHULIGQ-UHFFFAOYSA-N	448.892	1.541	50	20	IDGD	
Cc1cccnc1CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	729622240	QZIGZCWCNKDDKM-UHFFFAOYSA-N	431.518	1.709	50	20	IDGD	
O=C(NNC(=O)N1CCOCC1)c1cnn(-c2ncccc2Cl)c1C(F)(F)Cl	731004590	GJEQXDWIQNHUMB-UHFFFAOYSA-N	435.218	1.895	50	20	IDGD	
CNS(=O)(=O)C1CCN(C(=O)/C(C#N)=C\c2cc(C)n(C[C@@H]3CCCO3)c2C)CC1	732126147	CAJOEQPFVPBULL-OVCORXIESA-N	434.562	1.731	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NCCc1nc(-c2cccc(Cl)c2)no1	734168409	SANBXPFHIFTVKC-UHFFFAOYSA-N	448.892	1.754	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)CCn1c(=O)oc2cc(Cl)ccc21	734238886	BCQJYJLICPKNJV-UHFFFAOYSA-N	441.872	1.493	50	20	IDGD	
CCCS(=O)(=O)c1ccccc1C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C	734241983	ZITNTZPOLVDUMD-UHFFFAOYSA-N	428.511	1.339	50	20	IDGD	
COc1ccc(S(=O)(=O)C[C@@H](C)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)cc1	734990860	BXMJDGZGTCIXCS-ZIAGYGMSSA-N	438.477	1.859	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)N2CCC[C@@H]2C(=O)NNc2ccc(Cl)nn2)o1	735688817	XLYXPHGEFIDSRR-SNVBAGLBSA-N	443.869	1.196	50	20	IDGD	
CC[C@H](C)[C@H](NC(=O)N1CCCC1)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	736075417	XYKAJAAILJWXPK-RDJZCZTQSA-N	431.541	1.061	50	20	IDGD	
CN(C(=O)c1ccncc1)c1ccc(CNC(=O)NN[C@@]2(C)CCS(=O)(=O)C2)cc1	737057884	VMZQLFXGADSSSH-FQEVSTJZSA-N	431.518	1.239	50	20	IDGD	
Cc1ccsc1S(=O)(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	741648900	QOFQNHRCKPZHMK-UHFFFAOYSA-N	429.545	1.464	50	20	IDGD	
Cc1c(S(=O)(=O)NNC(=O)CNC(=O)c2ccco2)cnn1-c1ccc(Cl)cc1	742030176	ROENCTSGGXSDDO-UHFFFAOYSA-N	437.865	1.167	50	20	IDGD	
CC(C)[C@H](NC1CCOCC1)C(=O)NNC(=O)c1ccc(CSc2nncn2C)cc1	743296560	CVDUBDSPOHWFRS-SFHVURJKSA-N	446.577	1.662	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NNC(=O)c2cccc3ccccc23)c1	743628544	UMJNVPVHRUPNGS-UHFFFAOYSA-N	426.454	1.532	50	20	IDGD	
Cc1ccc(S(=O)(=O)NC2CC2)cc1C(=O)NNC(=O)Nc1ccc(N(C)C)cc1	743827260	BGQFHVYQMTZWGA-UHFFFAOYSA-N	431.518	1.968	50	20	IDGD	
Cc1ccc(NC(=O)N(C)C)c(C(=O)OCC(=O)NNC(=O)Cc2nc(C)cs2)c1	745036673	KQHQJJYBFIIGBM-UHFFFAOYSA-N	433.490	1.400	50	20	IDGD	
C[C@@H]1C[C@@H](NC(=O)NNC(=O)CC23CC4CC(CC(C4)C2)C3)C(=O)N1c1cnn(C)c1	745918324	NRTWPEMRZDINKS-CKWSYRFPSA-N	428.537	1.851	50	20	IDGD	
C[C@H]1C[C@H](NC(=O)NNC(=O)CC23CC4CC(CC(C4)C2)C3)C(=O)N1c1cnn(C)c1	745918329	NRTWPEMRZDINKS-FQDUBUPRSA-N	428.537	1.851	50	20	IDGD	
Cn1c(=NNC(=O)c2cc(S(=O)(=O)N3CCCC3)ccc2O)sc2ccccc21	745991534	XEUFUTHCINKHAA-UHFFFAOYSA-N	432.527	1.976	50	20	IDGD	
Cc1ccc(N(CCC(=O)NNC(=O)N2CCOCC2)S(=O)(=O)c2ccccc2)cc1	745992593	FIFQSNMRYNIVMB-UHFFFAOYSA-N	446.529	1.653	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CN(Cc2nc(O)c3ccccc3n2)CCO1)c1c[nH]c2ccccc12	746101316	XLRXJNMIMWUNOD-IBGZPJMESA-N	446.467	1.479	50	20	IDGD	
COC[C@@H](Cc1ccccc1)NC(=O)NNC(=O)c1sc(N2CCOCC2)nc1C	746779106	HCXHLISVUJVHOS-MRXNPFEDSA-N	433.534	1.490	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)[C@H]1CCCN1C(=O)c1ccc(Br)cc1	747324068	YIPMBQKOTFWWHN-MRXNPFEDSA-N	431.290	1.839	50	20	IDGD	
O=C(CCN1CCN(C(=O)[C@H]2CCCO2)CC1)NNc1ccccc1Br	748066145	LAMUMYAMORPLFN-MRXNPFEDSA-N	425.327	1.606	50	20	IDGD	
O=C(COC(=O)Cc1coc2cc(F)ccc12)NNC(=O)[C@@H]1COc2ccccc2O1	748229210	MYJCIAQMBWYKGB-SFHVURJKSA-N	428.372	1.645	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)NCCC(=O)N1CCN(c2ccccc2)CC1	748466481	YXNLIENHHWBKCY-UHFFFAOYSA-N	427.480	1.438	50	20	IDGD	
CCS(=O)(=O)N1CCC[C@@H](C(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)C1	748520351	ODNNWGQQGMWNCG-LLVKDONJSA-N	443.469	1.485	50	20	IDGD	
CCN(Cc1ccccc1)c1ccc(C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)cc1	748718126	SFOBTHSFXSOHQI-SFHVURJKSA-N	430.530	1.844	50	20	IDGD	
CC(C)(CCC(=O)NNC(=O)c1ccc(C#N)cc1)C(=O)NNC(=O)c1ccc(C#N)cc1	749365187	UTASMKQAKQDABH-UHFFFAOYSA-N	446.467	1.459	50	20	IDGD	
NS(=O)(=O)c1ccc(OCCSCC(=O)NNC(=O)c2cc3ccccc3o2)cc1	749474665	QHEPDWMXJCVPNO-UHFFFAOYSA-N	449.510	1.653	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)N[C@H]1CCN(c2cccc(Cl)c2)C1=O	750669863	GBSHOMXEQDFNEA-INIZCTEOSA-N	426.864	1.666	50	20	IDGD	
O=C(NNS(=O)(=O)c1cnn([C@@H]2CCOC2)c1)c1ccc(F)cc1Br	751540376	AEMLNKLCAXTTRV-SNVBAGLBSA-N	433.259	1.369	50	20	IDGD	
CCOC(=O)c1ccc(N2CC(NC(=O)NNC(=O)c3cccc(OC(F)F)c3)C2)nc1	753279319	JUAFEKQBSUXAGS-UHFFFAOYSA-N	449.414	1.693	50	20	IDGD	
CC(C)Cn1c(=O)nc(O)c2c(C(=O)NNc3nccn(C)c3=O)cc(C(C)C)nc21	754431945	OOLKIXIBWWWXJZ-UHFFFAOYSA-N	427.465	1.127	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)Nc2ccc(OCC(=O)NC)cc2)cc1	756441343	KQSISDZCRFTTIS-AWEZNQCLSA-N	430.461	1.830	50	20	IDGD	
CN(C)C(=O)Cn1cc(NC(=O)NNC(=O)c2cc(F)ccc2Br)cn1	756800768	FOPFSMNBXZYZOW-UHFFFAOYSA-N	427.234	1.339	50	20	IDGD	
COC(=O)CCc1csc(NC(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)n1	757735744	YXBDHARUKHMZIZ-UHFFFAOYSA-N	438.462	1.741	50	20	IDGD	
Cc1csc(=O)n1CCC(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758782325	PZYRZNUSZMSJKT-UHFFFAOYSA-N	427.527	1.244	50	20	IDGD	
COc1cccc2c1CC[C@@H]2NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	760207880	SBERKNGYWLQOAD-KRWDZBQOSA-N	432.502	1.577	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)CCc1nnc(C2CCCC2)o1	760279644	IEVSHGIWHYGGSI-UHFFFAOYSA-N	434.522	1.723	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H]1[C@H]1COCCC1=NNC(=O)CNC(=O)c1ccco1	762422785	AOQVIQQAFCHXQL-HOCLYGCPSA-N	434.493	1.918	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2cccc(C3OCCO3)c2)ccc1Cl	763462051	DPPWFABYDYDTGY-UHFFFAOYSA-N	425.850	1.108	50	20	IDGD	
Cc1cc(Cl)ccc1OCCCC(=O)NNC(=O)C(=O)Nc1cncnc1N(C)C	763499098	CVLZQZMXZGNYRN-UHFFFAOYSA-N	434.884	1.450	50	20	IDGD	
O=C(NNC(=O)c1ccccc1O)C(=O)Nc1ccnn1Cc1ccc(Cl)c(F)c1	763526634	CVVGDSLZEKGLOU-UHFFFAOYSA-N	431.811	1.829	50	20	IDGD	
Cc1cc(I)ccc1NC(=O)C(=O)NNC(=O)c1ccccc1O	763528748	SGZUAFYSOXVVQU-UHFFFAOYSA-N	439.209	1.705	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)C(=O)N1CCc2ccc(Br)cc21	763548525	MGAGSTAJKBENPC-UHFFFAOYSA-N	432.230	1.528	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)Nc1ccc(-c2csnn2)cc1	763576472	AUQLUWUAIJPKQP-MRXNPFEDSA-N	425.426	1.131	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccccc1N1CCCCC1	763646453	HDFIUCSPBYYSJX-UHFFFAOYSA-N	426.473	1.850	50	20	IDGD	
O=C(CN1CCCc2ccccc21)NNC(=O)C(=O)Nc1ccc(N2CCCC2=O)cc1	763745212	AWGSLXAOJDFOJA-UHFFFAOYSA-N	435.484	1.352	50	20	IDGD	
CCOC(=O)COc1cccc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCC3)c1	763784891	JQHHBXLGWPSMTP-UHFFFAOYSA-N	431.470	1.578	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)ncn3C)c2ccccc2c1=O	763790777	OFADMEBNJBMTMI-UHFFFAOYSA-N	447.455	1.264	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C)c(S(=O)(=O)NC3CC3)c2)cc1	763829723	KEJFRFSJFZPTJN-UHFFFAOYSA-N	444.513	1.398	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(Cn3cncn3)cc2)c1C	763850743	PBTUGKUYPPGVLU-MRXNPFEDSA-N	436.472	1.497	50	20	IDGD	
CON(C)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)cc1	763856255	GHONMTACBXFQRI-LBPRGKRZSA-N	432.408	1.013	50	20	IDGD	
CO[C@@H]1Cc2ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc3ccc(C(C)=O)cc3)cc2C1	763871150	DWHBXKKTCTXPHA-JLTOFOAXSA-N	439.468	1.556	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccccc2C[S@@](C)=O)cc1OC	763911281	IFHMPNONCUSIGW-WJOKGBTCSA-N	447.513	1.762	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)ncn3C)cc1OC	763912237	USLIJALMSZASCS-UHFFFAOYSA-N	425.445	1.770	50	20	IDGD	
C[S@](=O)Cc1cc(NC(=O)C(=O)NNC(=O)Cc2ccc(F)cc2)ccc1Cl	763919025	OXAXLWKPHJVYBR-NDEPHWFRSA-N	425.869	1.686	50	20	IDGD	
CCOc1cc(C(=O)N(C)C)ccc1NC(=O)C(=O)NNC(=O)Cc1ccc(Cl)cc1	763930883	CDZHQUCLXSAZSH-UHFFFAOYSA-N	446.891	1.769	50	20	IDGD	
CC(=O)Nc1cc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)ccc1Cl	764006199	MAVQWPOGFBGPIS-UHFFFAOYSA-N	432.820	1.469	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(CNC(=O)OC(C)C)cc2)c(O)c1	764111717	ZJPPZDOIWVMBKR-UHFFFAOYSA-N	428.445	1.735	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2cccc(OC[C@@H]3CCCO3)c2)cc1	764127855	TXSAYJOTIJQMDO-FQEVSTJZSA-N	441.484	1.972	50	20	IDGD	
CN(C)CC(=O)NNC(=O)C(=O)Nc1ccnc(Oc2ccccc2Br)c1	764204406	URPMABBQWOCELM-UHFFFAOYSA-N	436.266	1.284	50	20	IDGD	
COC(=O)c1ccc(-n2cc(C)cn2)c(NC(=O)C(=O)NNC(=O)c2scnc2C)c1	764247163	OAVRFXXCVDBUQG-UHFFFAOYSA-N	442.457	1.132	50	20	IDGD	
COc1c(Cl)cccc1NC(=O)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	764259486	IKUOEFDEIXQBCT-UHFFFAOYSA-N	432.868	1.141	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1ccc(CCN2CCCC2)cc1	764279658	AQQQTBMIQGKAFF-UHFFFAOYSA-N	426.473	1.195	50	20	IDGD	
CCS(=O)(=O)N1CCC[C@@H](C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)C1	764328701	IBQJKBHKVJMCMA-LLVKDONJSA-N	430.477	1.362	50	20	IDGD	
CCNS(=O)(=O)c1ccc(CNC(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)cc1	764372905	FFAFIKTZDJIEKZ-UHFFFAOYSA-N	447.517	1.071	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)OCCO3)n[nH]1	764376384	CJXSKQLWECTDBB-UHFFFAOYSA-N	437.412	1.256	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H](O)c2cccc(OC)c2)c1	764584058	FQWSDUPNWIWIAU-GOSISDBHSA-N	435.502	1.220	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NN=Cc1cc(Cl)cc([N+](=O)[O-])c1O	764830700	NTGAHXVLYRDXFX-UHFFFAOYSA-N	445.863	1.862	50	20	IDGD	
O=C(CC[S@@](=O)c1ccc2c(c1)OCCO2)NNC(=O)CSc1ccccc1O	765247857	LBBDGSFROCSIAG-GDLZYMKVSA-N	436.511	1.601	50	20	IDGD	
O=C(CCCNS(=O)(=O)c1ccc(F)cc1)NNC(=O)CSc1ccccc1O	765253305	QSAGQSANIYVKBZ-UHFFFAOYSA-N	441.506	1.530	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)CNC(=O)c2ccc3c(c2)OCO3)n[nH]1	765594987	ASLIVVINMZXJSX-UHFFFAOYSA-N	437.412	1.005	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)[C@@H]1CCC[C@H](C(F)(F)F)C1	765731816	BYEMPLJTOGFGGR-SJORKVTESA-N	440.466	1.961	50	20	IDGD	
CCOC(=O)N1CCC(C(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)CC1	765749332	XATGKRMUHKVANL-UHFFFAOYSA-N	445.564	1.129	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)[C@H]1COc2ccccc2C1	765755985	JQWCVXKSZHKIHD-LJQANCHMSA-N	442.947	1.856	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)Nc1ccccc1N1CCN(C)CC1	767221262	RYMNDLADUOAPSJ-UHFFFAOYSA-N	433.534	1.999	50	20	IDGD	
Nn1c(SCC(=O)NNC(=O)C2CC2)nnc1-c1cc(-c2ccc(Cl)cc2)[nH]n1	768438825	CPGQUIWUBBWAOS-UHFFFAOYSA-N	432.897	1.352	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)c1ccc(Br)c(C(F)(F)F)c1	768898691	ANIBFYBIKGTFPV-QMMMGPOBSA-N	429.214	1.664	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N(C)C)nc2)cc1	769735989	MRQNGSXLBNVODW-UHFFFAOYSA-N	434.518	1.832	50	20	IDGD	
CSCCNC(=S)NNC(=O)c1cc(I)cc([N+](=O)[O-])c1	769766520	VXHHTAWMPMHZOY-UHFFFAOYSA-N	440.288	1.671	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)c3ccc(CCNS(C)(=O)=O)cc3)nc21	770967609	YBRFGTLKDCZWHF-UHFFFAOYSA-N	447.521	1.136	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)[C@@H]3CCN(c4cc(Cl)ccc4Cl)C3=O)nc21	770972061	PLZNLPUJEJEUOA-VIFPVBQESA-N	436.259	1.872	50	20	IDGD	
O=C(CCC/N=C1/NS(=O)(=O)c2ccccc21)NNc1ccnc(Br)c1	771548955	FIPNACXRBJCDLS-UHFFFAOYSA-N	438.307	1.806	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)CN1C(=O)N[C@]2(C[C@H](C)CC(C)(C)C2)C1=O	771971230	YFWDVPXYDUMRJQ-YPENRWOSSA-N	438.525	1.248	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)C[C@H]2CSCCN2C(=O)OC(C)(C)C)cc1	772389389	USFOXHAGEWWHAN-HNNXBMFYSA-N	438.550	1.997	50	20	IDGD	
CCCC(=O)N1CSC[C@H]1C(=O)NNC(=O)[C@H]1CCCN(C(=O)OC(C)(C)C)C1	773420825	PNTPPEWXCPOXKN-KBPBESRZSA-N	428.555	1.483	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ccccc2[N+](=O)[O-])cc1NC(=O)CCN(C)C	773654567	YMBJWJRLOQZXJJ-UHFFFAOYSA-N	428.449	1.875	50	20	IDGD	
CCOc1cc(N2CCN(C)CC2)ccc1NC(=O)C(=O)NNc1cnc2ccccc2n1	773717641	AHSQDPFLUUVGJM-UHFFFAOYSA-N	449.515	1.862	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@@H](C(=O)NNc2ccc(C(F)(F)F)cn2)[C@@H](C)O)cc1	775249274	JZZYXBHIRUMZTG-IAQYHMDHSA-N	432.424	1.580	50	20	IDGD	
C[C@H](NCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)c1cccc(N2CCCC2=O)c1	775279866	VFFHORMHTFBQRL-AWEZNQCLSA-N	425.445	1.833	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCC[C@@](C)(O)c1ccccc1	777411839	JEDZPFVKXWXXJX-HXUWFJFHSA-N	433.534	1.530	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)N[C@H]3CCN(c4ccc(F)c(Cl)c4)C3=O)nc21	777751422	DJWVOLIOPMAJTM-LBPRGKRZSA-N	434.819	1.293	50	20	IDGD	
CCc1ccccc1OCC(=O)NNS(=O)(=O)c1ccc(OCC(F)(F)F)nc1	777906790	GPLSRZYGLIIXKD-UHFFFAOYSA-N	433.408	1.974	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)C[C@@H]1CCN(C(=O)OC(C)(C)C)C1	778431711	CXEINUIAAYAQBF-INIZCTEOSA-N	433.505	1.875	50	20	IDGD	
CCn1cc(-c2nn(C)cc2C(=O)NNC(=O)c2cc(-c3ccccc3OC)[nH]n2)cn1	779039479	BUAVGKBTBOVLRL-UHFFFAOYSA-N	434.460	1.777	50	20	IDGD	
O=C(COc1ccccc1-c1ccccc1)NNC(=O)[C@@H](O)[C@H](O)c1nc2ccccc2[nH]1	779580429	ZQPMWLUXENFVNV-VXKWHMMOSA-N	446.463	1.851	50	20	IDGD	
COc1cccc(NNC(=O)c2ccc3c(c2)S(=O)(=O)N(C[C@H]2CCCO2)C3=O)n1	780771093	AODBMSKAPVRHPI-CYBMUJFWSA-N	432.458	1.171	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)N[C@H]1CCCN(c2ccc(C#N)cc2)C1=O	780893899	GSTMPPWGCXRARU-KRWDZBQOSA-N	427.486	1.783	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1Cl	782897379	ODXRXNJDCMIURL-UHFFFAOYSA-N	439.881	1.041	50	20	IDGD	
O=C(Cn1cc(NC(=O)C(=O)NNc2ccc(Br)cc2F)cn1)NC1CC1	783085700	LAEGVXWEYFTULN-UHFFFAOYSA-N	439.245	1.145	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)n(CCC#N)n1	783409804	WODDLTGRNWKVLJ-UHFFFAOYSA-N	444.395	1.481	50	20	IDGD	
Cc1ccc(C(=O)Nc2ccccc2)cc1NC(=O)C(=O)NN[C@@]1(C)CCS(=O)(=O)C1	783428106	TXMPMIJPXTZNSM-NRFANRHFSA-N	444.513	1.384	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2cccc3c2CCCC3)cc1	783451817	WBDTWJAAUGVQML-UHFFFAOYSA-N	446.529	1.572	50	20	IDGD	
O=C(CCn1nnc2ccccc2c1=O)NNC(=O)COc1ccc(Br)cc1	783489860	FHQVCZQNXWAMNC-UHFFFAOYSA-N	446.261	1.171	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)C(=O)Nc1ccc(C(F)(F)F)cc1Cl	784004720	QIPPBSREQRZIFH-UHFFFAOYSA-N	432.742	1.468	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)c(C)c1	784210318	NIOLLOWAZCIKEV-UHFFFAOYSA-N	432.502	1.916	50	20	IDGD	
CCOC(=O)COc1ccc(NC(=O)C(=O)NNc2cccc(S(C)(=O)=O)c2)cc1	784839649	NBGDVLJNMJBQCK-UHFFFAOYSA-N	435.458	1.114	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)C(=O)Nc2ccccc2C(=O)N2CCOCC2)c1	784853731	NKDWIUFTQPOAPU-UHFFFAOYSA-N	426.429	1.027	50	20	IDGD	
CCCCNS(=O)(=O)c1cccc(NC(=O)C(=O)NNc2cc(Cl)ccn2)c1	784861723	REFINGJWZSXJBR-UHFFFAOYSA-N	425.898	1.895	50	20	IDGD	
Cc1ccc(C(=O)NCC2CC2)cc1NC(=O)C(=O)NNC(=O)c1cccc(N(C)C)c1	785991976	UOJYFPNIHFWJNY-UHFFFAOYSA-N	437.500	1.601	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1ccc(C)c(N2CCNC2=O)c1	787545070	ZTHBKDZVPXHDGK-UHFFFAOYSA-N	445.863	1.586	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1C(=O)N(C)C(C)C	787545316	SJNPKCKLYMYAST-UHFFFAOYSA-N	441.444	1.783	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)Cc1ccccc1F)[C@@H](C)C(=O)NNC(=O)Cc1ccccc1F	790607228	STZQEVLWWGOFGY-ZIAGYGMSSA-N	446.454	1.317	50	20	IDGD	
C[C@]1(C2CC2)NC(=O)N(c2ccc(CNC(=O)NNC(=O)c3ccc(C#N)cc3)cc2)C1=O	790693078	UOOLJRXHZPFPGB-HSZRJFAPSA-N	446.467	1.927	50	20	IDGD	
O=C(CN1CCNC(=O)[C@H]1c1ccc(OC(F)(F)F)cc1)NNC(=O)c1ccccc1	792359907	NMZWGPURUTVALP-QGZVFWFLSA-N	436.390	1.519	50	20	IDGD	
CCOC(=O)c1csc([C@@H]2CCCN2CC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)n1	792470850	MGJLJBLIYMYCQK-HNNXBMFYSA-N	447.473	1.826	50	20	IDGD	
COc1c(NC(=O)C(=O)NNC(=O)COc2ccc(C)c(C)c2)cc(Cl)cc1C(N)=O	793022656	AMVJEQUHDVEEHY-UHFFFAOYSA-N	448.863	1.229	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(S(=O)(=O)C(F)F)cc2)cc1C	793201925	ATOLXQZWKLCLFX-UHFFFAOYSA-N	425.413	1.699	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccccc1S(=O)(=O)C(F)F)c1ccc(Cl)cc1O	794582989	WIVCVHMQYMBHPA-UHFFFAOYSA-N	440.833	1.665	50	20	IDGD	
CN(C)S(=O)(=O)/C(C#N)=C\c1ccc(OCCn2cc(C(=O)O)nn2)c(Cl)c1	794956981	MDPKFLPYINWIJQ-GHXNOFRVSA-N	425.854	1.465	50	20	IDGD	
CCn1ncc(NC(=O)C(=O)NNC(=O)COc2cc(C)cc(C)c2)c1C(F)(F)F	799257046	FJDVPTBNOUDPRB-UHFFFAOYSA-N	427.383	1.704	50	20	IDGD	
CCc1cccc(C)c1NNC(=O)C(=O)Nc1ccc(CC(=O)NCC(=O)OC)cc1	799842962	HPDGFEADONKORB-UHFFFAOYSA-N	426.473	1.471	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1cc(-c2ccc(OC)nc2)ccc1C	802567279	MERHVFMPMXLCAH-AWEZNQCLSA-N	430.461	1.203	50	20	IDGD	
COc1cc(C(=O)NNC(=O)N[C@H]2CCCN(C(=O)N3CCCC3)C2)cc(OC)c1OC	804866343	XGUYTWHXBLAAKP-HNNXBMFYSA-N	449.508	1.337	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)C1CCN(C(=O)CCOc2ccccc2)CC1	804957206	FHLAHXBXMBOPAE-UHFFFAOYSA-N	435.488	1.813	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)NNc2ccc(-n3ccnc3)nn2)N(C)c2ccccc21	804957671	PLVFTXNSPXCAIY-UHFFFAOYSA-N	443.471	1.776	50	20	IDGD	
O=C(NCCC(=O)N1CCN(c2ccccn2)CC1)NNc1ccc2c(=O)[nH]ccc2c1	806645120	UKQAXKWZECLFPC-UHFFFAOYSA-N	435.488	1.288	50	20	IDGD	
CC(C)Cn1ncc(NC(=O)C(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)c1C1CC1	807018612	YNWMLPZEXFYULI-UHFFFAOYSA-N	430.421	1.430	50	20	IDGD	
CCCc1c(NC(=O)C(=O)NNc2ccc(-n3ccnc3)nn2)cnn1-c1cc(C)ccn1	807428694	IQRHEZQUVMXGFL-UHFFFAOYSA-N	446.475	1.586	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)C(=O)Nc1ccccc1OC[C@H]1CCCCO1	807429744	WXXNHSIIBVLYIR-OAHLLOKOSA-N	437.460	1.692	50	20	IDGD	
O=C(CNS(=O)(=O)c1cccs1)NNc1nc(-c2ccccn2)nc2c1CCC2	810442427	SQRQBBPIQZZYKV-UHFFFAOYSA-N	430.515	1.510	50	20	IDGD	
O=C(NNC(=O)N1CCC(C(=O)N2CCOCC2)CC1)c1ccc(Br)s1	813539517	PZABZBPSAFKINU-UHFFFAOYSA-N	445.339	1.436	50	20	IDGD	
Cc1c(C(=O)NNC(=O)[C@H](C)Oc2cccc(Br)c2)nnn1-c1ccn(C)n1	814366739	QKORRVOJESJRKQ-NSHDSACASA-N	448.281	1.300	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cc(C#N)cc(N(C)C)c2)cc1OC	814571532	QDECHZRWFVBXBA-UHFFFAOYSA-N	426.429	1.259	50	20	IDGD	
CCC(=NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1)c1ccc(F)cn1	814877106	IRESYLNDZSHMHB-UHFFFAOYSA-N	447.536	1.766	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1)[C@H]1C[C@H]1C	815563765	NJCQHVKCHMFSOJ-XIKOKIGWSA-N	439.428	1.756	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2F)cc1)C1CC1	815565580	UAZNJZZNAQYHCY-UHFFFAOYSA-N	428.420	1.506	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCc2nncn2C1)C(=O)Nc1cc(Cl)ccc1OC1CCCC1	815692390	PXKUKDALRRMRAM-LBPRGKRZSA-N	446.895	1.601	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1ccc(F)cc1OC(F)F	815751835	QISMJWLTBZUXEB-UHFFFAOYSA-N	446.407	1.759	50	20	IDGD	
C[C@H](Cc1cnc2ccccc2n1)C(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	815934283	UNACDPPHUUCUMA-CYBMUJFWSA-N	425.876	1.926	50	20	IDGD	
COCCN(C)NC(=O)c1cccc(NC(=O)C[C@@H]2SC(N3CCCCC3)=NC2=O)c1	816561036	JOWNJCBUYXAXRY-KRWDZBQOSA-N	447.561	1.722	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)[C@@H](NS(=O)(=O)c2ccc(C)cc2)C(C)C)cc1	825588305	DNVZMWOFYJJJTB-FQEVSTJZSA-N	432.546	1.866	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(C(=O)NNC(=O)CNc2ccccc2OC)cc1	825624049	CGROMLOPPHJXKU-UHFFFAOYSA-N	434.518	1.599	50	20	IDGD	
Cn1nc(SCC(=O)NN=Cc2ccc(-c3ccc(F)cc3)s2)c(=O)n(C)c1=O	839410231	NLZAJLKULYACFJ-UHFFFAOYSA-N	433.490	1.589	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)O[C@@H](C)C(=O)N2CCC(C(N)=O)CC2)c1C	913026858	ARULAEZITAAACC-JJBLJPBOSA-N	430.505	1.314	50	20	IDGD	
C[C@]12CCC(=O)N1c1ccccc1C(=O)N2CC(=O)NNC(=O)c1c[nH]c2ccccc12	913557508	CMUIVNQAYFRNJT-HSZRJFAPSA-N	431.452	1.928	50	20	IDGD	
O=C(NNC(=O)C1CCN(C(=O)CCc2ccccc2)CC1)c1ccc(-n2cnnn2)cc1	914846659	QBFSGRVAYXZGKI-UHFFFAOYSA-N	447.499	1.295	50	20	IDGD	
Cc1nc2c(c(C)nn2C)c(C)c1CC(=O)NNC(=O)c1csc(N2CCOCC2)n1	916135966	BDJCNJMEQMHGHT-UHFFFAOYSA-N	443.533	1.190	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)NCc1ccc(N2CCCCC2)nc1	916392405	UFBHVNCFYSHOEM-UHFFFAOYSA-N	428.449	1.890	50	20	IDGD	
C[C@@H]1CN(c2ccc(CNC(=O)NNC(=O)[C@@H](C)Oc3ccccc3F)cn2)CCO1	916392567	BOCGNZZROKHDRO-HUUCEWRRSA-N	431.468	1.744	50	20	IDGD	
CC[C@@H](C)NS(=O)(=O)c1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)cc1	916562208	NCPQYNAZSPUEMU-OAHLLOKOSA-N	446.529	1.780	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccncc2)on1)c1ccc(S(=O)(=O)N2CCCC2)cc1	916734804	OMSOZSRUYIBREX-UHFFFAOYSA-N	441.469	1.596	50	20	IDGD	
COc1ccc(C(=O)NCC(=O)NNC(=O)c2cc(-c3ccc(C)cc3)[nH]n2)cc1OC	917178076	JEZSTPMIOWAYOU-UHFFFAOYSA-N	437.456	1.593	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)Cn1nc(-c2ccccc2)ccc1=O	917918230	YNSRERGQAAHGRQ-UHFFFAOYSA-N	430.468	1.670	50	20	IDGD	
Cc1ccccc1NC(=O)NNC(=O)CCCNS(=O)(=O)c1ccc2c(c1)OCCO2	918691592	FLAZYAXLDHEUGM-UHFFFAOYSA-N	448.501	1.678	50	20	IDGD	
COc1ccc(C(=O)Nc2ccccc2C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)cc1	920433511	VWQXJYRTTLTEAU-CQSZACIVSA-N	431.470	1.143	50	20	IDGD	
O=C(CNS(=O)(=O)c1cccc(F)c1)NNC(=O)c1ccc(Br)cc1	1317698699	QMSOPYQCXORBFE-UHFFFAOYSA-N	430.255	1.328	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)c3ccc4occc4c3)CCO2)C1	1779032716	WVBGSZKRDHNVTC-HSZRJFAPSA-N	449.467	1.189	50	20	IDGD	
O=C(COc1cc(Cl)ccn1)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2	1779500218	PXKCSAOPDSRAHB-SPYBWZPUSA-N	446.331	1.227	50	20	IDGD	
C[C@@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CO[Si](C)(C)C)C1)n1ccccc1=O	1779545313	BOJCCVUUWQQXLJ-NJNPRVFISA-N	449.624	1.775	50	20	IDGD	
COc1cc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)ccn1	1779555053	CGMQMPIMNZKROX-ACJLOTCBSA-N	426.311	1.565	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc4c(c3)NC(=O)[C@@H](C)O4)CCO2)C1	1781216712	BCKCVNRUGXYIPJ-VWVPQACVSA-N	435.908	1.867	50	20	IDGD	
Cc1nccn1CC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)Br)C1	1782001310	DGQRUOAJYIVPRJ-DDUZABMNSA-N	427.343	1.489	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)C3=NO[C@H](c4ccccc4)C3)CCO2)C1	1783874034	BLHSQVMZRKNDLW-MDKPJZGXSA-N	435.908	1.588	50	20	IDGD	
Cc1nn(C)c(C)c1CC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2	1784515368	SZORMDQMSZRVSH-XIKOKIGWSA-N	427.343	1.193	50	20	IDGD	
CC[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)N(CC)CC	1784630681	VTBHSNKEBXMZPU-QXKUPLGCSA-N	436.366	1.777	50	20	IDGD	
O=C(c1ccc(CO)c(F)c1)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1785268716	VVMRMBDGARNZLR-PBHICJAKSA-N	433.249	1.452	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3n[nH]c(C4CC4)c3F)[C@H]2C1	1785768386	WHBUPWQZWDFXGX-FQUUOJAGSA-N	428.892	1.273	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ncon3)C[C@@H]21	1790693911	IPZDGEWGFOUFFE-MJKMTRRRSA-N	443.410	1.548	50	20	IDGD	
Cc1nc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](C)Br)[C@H]3C2)cs1	1791057069	NZNWWDSMRRREDG-LVGORTOPSA-N	430.368	1.757	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cccnc1Cl)C2	1792868648	IQYBIZOCRDOWFT-OEYIWLLWSA-N	444.757	1.898	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3cnccc3[nH]1)C2	1792871453	ZLZIWBXBZQAFEF-MBMVNNNZSA-N	435.322	1.797	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c(F)cc(Cl)cc1Cl)C2)[C@H](O)CCl	1792980693	UJNYLAAMSFHZFF-NWIKQPOISA-N	439.698	1.935	50	20	IDGD	
CC(C)(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2)NC(=O)OC(C)(C)C	1793013316	XSVLLIFMHIPZPU-NEBZKDRISA-N	435.924	1.804	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCl)c1n[nH]c2c1CCc1ncccc1-2	1793113932	YSMHFOAMJIPIOO-LKQDWFRTSA-N	429.908	1.422	50	20	IDGD	
C[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCBr)n1cccc1C=O	1795112858	RCHFNTKGOGMTFL-VWPFQQQWSA-N	426.311	1.236	50	20	IDGD	
COc1ccccc1OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCBr	1795112901	GQUIGKJCDGHQJV-HBCWATKFSA-N	441.322	1.449	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1cccc2c[nH]nc12	1796183448	WBBGIXPXGFNUOZ-WJNVRWDZSA-N	425.258	1.457	50	20	IDGD	
CCSc1ncccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1	1796189764	XWOQRWVQRCSNMD-BCDXTJNWSA-N	439.346	1.439	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1nnc2cc(C)nn2c1C	1796924018	RSNXRQQNMZNBCC-KRXQYRFLSA-N	434.928	1.352	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2cccnc2s1	1797424150	ZIPKQXWXYUWDIW-MUJYYYPQSA-N	429.546	1.921	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2cnccc2[nH]1	1798182661	PAJWNJRBTBTNQB-FKDCUARVSA-N	447.499	1.949	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H]1CCC(=O)N1)C2	1799217680	BMAHHZYBFHGBNJ-UMPJEAMMSA-N	444.444	1.051	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc([N+](=O)[O-])ccc1N(C)C)C2	1799272264	KKFGTNLTODVVHS-VLWCASSMSA-N	438.912	1.881	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1c[nH]c2ccccc12)c1cccc(B(O)O)c1	1799901024	BLMQBNKLKWQZAX-ACDBMABISA-N	431.301	1.342	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1n[nH]c3c1CS(=O)(=O)C3)C2	1800078659	GLHMFWVLDOOEHL-UCSBCBTLSA-N	449.360	1.326	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cnc3ccccn13)C2	1800754625	SLWFJWVEIPIRPP-FLTUCWPJSA-N	435.322	1.250	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cncc(N(C)C)c1)C2	1800758296	RZWIPXOVFLVUJB-ZIEJDFEHSA-N	425.327	1.134	50	20	IDGD	
Cc1ccc(CSCCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](O)CCl)C3)cc1	1800865535	HNLCXPLWNQHGIS-AJYBTWMASA-N	440.993	1.808	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1ccc(CO)c(F)c1	1801901818	GAQDLXMENDCWEP-AYRXBEOTSA-N	433.249	1.212	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)[C@H]1COc2ccccc2O1	1804195874	JGMZWRQOGPYNJG-LNKGRISISA-N	445.903	1.527	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)CNC(=O)c2cc(C)on2)[C@H]1c1cccnc1	1808263852	PZBGKVRYINPCNK-BXWFABGCSA-N	447.923	1.831	50	20	IDGD	
CCc1cc(C(=O)N2CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)no1	1813074045	QMWRXQUEHPSPTC-HRAATJIYSA-N	442.520	1.325	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@H]1CCc2nc(NC(=O)[C@H]3CCC(=O)N3)sc2C1	1814414573	BINAQLJPWUNRPC-ATZCPNFKSA-N	429.340	1.365	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CNC(=O)N(C)C)n[nH]1	1814562334	LURCENQDPLKKEG-YPMHNXCESA-N	443.346	1.704	50	20	IDGD	
O=C(CCBr)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1816781698	FOUREUJYNKITIN-HNNXBMFYSA-N	449.114	1.180	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)CC[C@@H]2CCOC2)[nH]n1)c1ccc(B(O)O)cc1	1817475498	PPFARMUZOKPHLO-BEFAXECRSA-N	440.309	1.212	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CC(C)(C)O)[nH]n1	1818112235	XKFOZNVUXDWVHG-ANDSAHIGSA-N	443.508	1.697	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1ccc(F)cc1	1820554537	CTTVYNUZNXNDGQ-LJQANCHMSA-N	436.252	1.848	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN2C(=O)C=CC2=O)[nH]n1	1822193082	ZYDXXHMTXUFUCR-PWSUYJOCSA-N	438.282	1.110	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](O)c2ccccc2)[nH]n1	1822413040	NINUELZUUKUNET-DYESRHJHSA-N	442.520	1.508	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)Cc2ccc(O)cn2)[nH]n1	1822416781	PBZKRAYUKWFEGA-QGZVFWFLSA-N	443.508	1.118	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)Cn1ccncc1=O)CC2	1822869279	HXAWXOBHHBTCIF-DYZYQPBXSA-N	444.344	1.548	50	20	IDGD	
C[C@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1ccccn1	1822899373	SZFIJQOXUNNHIY-YWZLYKJASA-N	447.304	1.594	50	20	IDGD	
COc1nccnc1C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](C)Br)sc2C1	1825636473	GLRSXLNDCIEFGG-DTWKUNHWSA-N	440.323	1.951	50	20	IDGD	
O=C(c1ccccc1O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827055644	AZCMYFGWBNOBTL-OAQYLSRUSA-N	436.317	1.619	50	20	IDGD	
CC[C@H](C)[C@H](O)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827055803	JZGHQRMUIFQNEJ-NDXORKPFSA-N	430.354	1.007	50	20	IDGD	
Cc1cnoc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827057254	AHQAWAJJTJPZPS-LJQANCHMSA-N	425.294	1.210	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)CN)CC1	1829637150	WSPBMGFTLACDHD-SFHVURJKSA-N	432.477	1.712	50	20	IDGD	
O=C(CCc1ccc(F)c(F)c1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1830271925	MENGNWAQFGWKPZ-HKUYNNGSSA-N	434.842	1.888	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccnc(F)c3)C2)C1	1830534590	CDFQIXFQLPXWEV-SCLBCKFNSA-N	444.301	1.322	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](S)C(C)C)CCO2	1831499269	TUBNVVKBHZKFAC-VBQJREDUSA-N	437.400	1.571	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cn3nc(C)cc3C)C2)C1	1831640601	NZGCTGVTCBUVTP-YLJYHZDGSA-N	426.945	1.364	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ncn(C(C)C)n3)C2)C1	1831647367	UNOJHQLUJKRVAR-BEFAXECRSA-N	427.933	1.337	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CCN2C(=O)C=CC2=O)CC1	1831829056	XFBLESCABJXXRJ-IRXDYDNUSA-N	439.940	1.175	50	20	IDGD	
Cc1cccc(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)n1	1832618785	QGPSHUSHQRAWTQ-IBGZPJMESA-N	430.332	1.583	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)CCN2CCCC2)CC1	1832966027	MJNPBFLJHPUBQG-QFIPXVFZSA-N	441.381	1.086	50	20	IDGD	
C[C@@H](Oc1cccnc1)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)CCl)CC2)CC1	1833313094	VIKRXDNKOWGWLU-BEFAXECRSA-N	438.956	1.020	50	20	IDGD	
O=C(Cc1cnccn1)NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1833371946	AVUMKHDCRIHQMK-QGZVFWFLSA-N	442.333	1.281	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)[C@H](C)NC(=O)CC)CC2)CC1	1833529708	HFACTUANKBKKMA-YJBOKZPZSA-N	429.005	1.880	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3scnc3C3CC3)CCO2)C1	1833732257	RHKOVHXZAUGQBV-AUUYWEPGSA-N	443.953	1.344	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccn3C)CCO2)C1	1833911725	HUNIJAGLAUPUFK-KDOFPFPSSA-N	428.327	1.269	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3csc(N)n3)CC2)CC1	1834752821	OQEOFNNCSOWJNA-NSHDSACASA-N	444.399	1.694	50	20	IDGD	
Cc1ccnc(C(=O)N2CCOC[C@]3(CN(C(=O)CCBr)CCO3)C2)c1	1834821703	USFBPPYECSRMJW-SFHVURJKSA-N	426.311	1.245	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@H](COC)NC(C)=O)CC2)CC1	1835840432	QGOMUVSSCJENLM-MOPGFXCFSA-N	445.004	1.117	50	20	IDGD	
Cc1nccnc1C(=O)NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1	1836012588	MZEDFMGKHSZFIR-UHFFFAOYSA-N	438.370	1.755	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@H]3CCCS3(=O)=O)CC2)CC1	1836922666	OVSJJWASPSTLCE-QZTJIDSGSA-N	449.013	1.970	50	20	IDGD	
O=C(c1ccc(-c2cc[nH]n2)cc1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1839396099	WXTJWIALMMIEET-PXNSSMCTSA-N	436.871	1.681	50	20	IDGD	
O=C(C#Cc1ccc(Cl)cc1)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840187246	OWRKKTRNWQOMAP-LJQANCHMSA-N	445.730	1.952	50	20	IDGD	
Cc1ccn2ncc(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)C(Cl)Cl)CCO4)c2c1	1840187756	UVITVPPVXGVODP-LJQANCHMSA-N	441.315	1.516	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC12CN(C(=O)c1ccc3nc(CO)[nH]c3c1)C2	1841287520	SDVJIWZYMBEAJW-GFCCVEGCSA-N	435.322	1.903	50	20	IDGD	
Cn1cc(NC(=O)OC(C)(C)C)cc1C(=O)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1	1841349781	NVBKKHAWMUIZCQ-HNNXBMFYSA-N	440.928	1.789	50	20	IDGD	
COC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)C(C)(C)CCl)C2	1843381462	UQAMCCSICGESGO-CQSZACIVSA-N	431.961	1.995	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)Cc1cc(F)cc(F)c1)C2	1843415817	QWSFNZBBTYLHKX-VULFUBBASA-N	443.454	1.845	50	20	IDGD	
COc1ccc([C@H](C)C(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)cc1	1844263248	JYSOEEOAVIIJGR-HNNXBMFYSA-N	437.500	1.314	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1cc(-c3ccccc3)no1)C2	1844264635	SBALGTUJATZLSU-UHFFFAOYSA-N	446.467	1.471	50	20	IDGD	
COC(=O)c1ccc(CC(=O)N2CCCC23CN(C(=O)[C@@H](F)Br)C3)cc1	1846476470	WWMNPZABQXTBIA-OAHLLOKOSA-N	427.270	1.910	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)CCn3c(=O)[nH]c(=O)c4ccccc43)cc2C1	24310276	UEPAVAVTRUTOGR-GFCCVEGCSA-N	426.498	1.727	50	20	IDGD	
CN(CCOc1ccc(Br)cc1)C(=O)NNC(=O)CNC(=O)c1ccco1	725871828	HGMDHDOJCYRYDK-UHFFFAOYSA-N	439.266	1.524	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1)N1CCN(C)CC1	725895205	VPPWTYGXHUAANG-WMZHIEFXSA-N	435.572	1.397	50	20	IDGD	
CC(C)c1nc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cs1	726495553	PWVADKQCLHCPSF-UHFFFAOYSA-N	438.531	1.362	50	20	IDGD	
CC[C@@H](C)N(C)CCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(CC)CC)c1	727227548	BHODNSZABAAPCY-OAHLLOKOSA-N	427.571	1.391	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N[C@H](CN2CCN(C)CC2)c2ccccc2)cc1OC	727841043	MTMOXAVKWQDFCZ-LJQANCHMSA-N	441.532	1.637	50	20	IDGD	
CC(=O)N1C[C@H](C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)Oc2ccccc21	728210567	OZOHGZKZCBYRRL-LJQANCHMSA-N	430.486	1.385	50	20	IDGD	
COc1cc(C#N)ccc1OCCCC(=O)NNC(=O)C1CCN(c2ncccn2)CC1	728846140	SGYGTFZPAVSCRZ-UHFFFAOYSA-N	438.488	1.580	50	20	IDGD	
CC[C@H](NC(=O)NNC(=O)CCc1ccc(OC)cc1)c1cccc(S(N)(=O)=O)c1	729231355	UPTKGKOHVIZCOV-SFHVURJKSA-N	434.518	1.757	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)NCC2CCN(C(C)=O)CC2)c1	729623851	LYGFWBGNAREQKE-UHFFFAOYSA-N	427.299	1.660	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCN(c2ccc3c(c2)OCCO3)C1=O)c1ccc2c(c1)OCCO2	730520434	HKFVZKVAXHGVIE-HNNXBMFYSA-N	439.424	1.043	50	20	IDGD	
CCOC(=O)/C(C#N)=C\NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	730943115	DPXQANIYTFPJQD-VKAVYKQESA-N	428.470	1.370	50	20	IDGD	
CC(C)(C(=O)NNC(=O)[C@@H]1CCCN1C(=O)/C=C/c1ccc(C(N)=O)cc1)c1ccccc1	731176235	LRVGIJJKBHNVKX-IURSYISVSA-N	448.523	1.915	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)CS(=O)(=O)Cc1cccc(Br)c1	731492589	RFUDQXILPAIPOM-UHFFFAOYSA-N	441.303	1.834	50	20	IDGD	
O=C(NNc1nc(-c2ccccc2)no1)c1cc(S(=O)(=O)N2CCOCC2)ccc1F	732111553	BHWCLHVHMJOEIP-UHFFFAOYSA-N	447.448	1.654	50	20	IDGD	
Cc1nn(CCCl)c(C)c1C(=O)NCC(=O)N1CCN(C(=O)OC(C)(C)C)CC1	733922949	GBNGEEYLOPZXLM-UHFFFAOYSA-N	427.933	1.548	50	20	IDGD	
COCCS(=O)(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2Cl)c1	737751039	LBSWOWLLUFCNBV-UHFFFAOYSA-N	447.922	1.351	50	20	IDGD	
CC(=NNC(=O)c1c(C)nc2ccccn12)c1cccc(S(=O)(=O)N2CCOCC2)c1	739400865	VYTQWPWTDPQUDN-UHFFFAOYSA-N	441.513	1.818	50	20	IDGD	
Cc1ccc(C(=O)NNS(=O)(=O)c2cccc(I)c2)c(O)c1	739671537	VCISXZKRZJKPDW-UHFFFAOYSA-N	432.239	1.929	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)CCc1nc(-c2ccoc2)no1	739681341	WSTWTZIVWJBHBS-UHFFFAOYSA-N	432.462	1.325	50	20	IDGD	
O=C(NC[C@@H](O)c1c(Cl)cccc1Cl)NNC(=O)c1ccc(-n2cnnn2)cc1	740903235	LAFCPHXHOAMTKY-CQSZACIVSA-N	436.259	1.647	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)N[C@H](CCCO)c1ccccc1	741094568	LHRNLWZPZSVZDE-MRXNPFEDSA-N	433.534	1.746	50	20	IDGD	
COCCOCC(C)=NNC(=O)c1cc(S(=O)(=O)NCc2ccccc2)ccc1O	741164115	XTQWCVIDCGCHGP-UHFFFAOYSA-N	435.502	1.639	50	20	IDGD	
COc1ccc(Oc2ccc(S(=O)(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)cc2)cc1	741203299	DUOROBGUUDFFMC-CYBMUJFWSA-N	440.499	1.232	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN(c2ncnc3sccc23)C1)c1ccc(-n2cnnn2)cc1	742481015	PUKSRWZTLZHCGW-CQSZACIVSA-N	449.500	1.345	50	20	IDGD	
Cc1c(F)cccc1S(=O)(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	743250405	YZPLQQDOJBRPDI-UHFFFAOYSA-N	441.506	1.542	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)CCc2nc(-c3ccncc3)no2)cc1	743830561	XRJAWCCLKIVVBQ-UHFFFAOYSA-N	430.446	1.321	50	20	IDGD	
O=C(CN1CCc2c(cccc2N2CCOC2=O)C1)NNC(=O)c1cccc([N+](=O)[O-])c1	744413764	JBXPIEMAYIEXJD-UHFFFAOYSA-N	439.428	1.371	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2nc(C)c(C)s2)c1	745923550	RYHNTHOKIBEEQV-UHFFFAOYSA-N	439.563	1.935	50	20	IDGD	
Cc1cc(N2C[C@H](C(=O)NNC(=O)N3CCOCC3)CC2=O)ccc1Br	745987951	NTUKZJDSHSNFDN-GFCCVEGCSA-N	425.283	1.183	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)[C@@H]2CCCN2C(=O)NCc2cccc(Br)c2)cn1	746281859	HNWPMNGUVZJDOA-HNNXBMFYSA-N	449.309	1.318	50	20	IDGD	
COC(=O)COc1c(C)cc(C=NNC(=O)Cc2csc(N3CCOCC3)n2)cc1C	746487967	AUDWMSPXOOBEHS-UHFFFAOYSA-N	446.529	1.841	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NN=C(Cc1ccccc1)[C@@H](C)NC(=O)OC(C)(C)C	746576808	RAKGKLROUNRPIJ-ZIAGYGMSSA-N	426.539	1.552	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)C1(S(=O)(=O)c2ccc(Cl)cc2)CC1	746640359	BKCFQVWXSISWRA-UHFFFAOYSA-N	432.889	1.684	50	20	IDGD	
COc1cc(S(=O)(=O)NNC(=O)COc2ccccc2O)ccc1Br	747270143	QUXSGJVDYXWLNW-UHFFFAOYSA-N	431.264	1.552	50	20	IDGD	
CN(C(=O)CNC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)C1CCCCC1	748666857	SBUBDHSQDMNXJK-UHFFFAOYSA-N	425.511	1.217	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)c2ccc3ncc(I)n3c2)c1	749378860	GYMCCUKDNAQOQI-UHFFFAOYSA-N	431.193	1.885	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)[C@H]2CCCN2C(=O)c2ccc3c(c2)OCO3)cc1	749561418	JYSAZTKJDUPHFT-QGZVFWFLSA-N	436.424	1.118	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NCc2ccccc2CN2CCC(O)CC2)cc1	749589344	HFIZQJUITBAPFZ-UHFFFAOYSA-N	442.516	1.561	50	20	IDGD	
O=C(NNC(=O)N1CCOCC1)[C@H]1CCCN1C(=O)c1ccc(Br)cc1	749598447	AJMOIOQDKYUDDG-CQSZACIVSA-N	425.283	1.127	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)[C@@H]1CCn2cncc2C1	750914645	MIJPKDAKWIYHEK-QGZVFWFLSA-N	430.940	1.064	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NNC(=O)CNC(=O)c2cccs2)cc1OCC	751280850	VRQSZTCCWLBQDS-UHFFFAOYSA-N	427.504	1.285	50	20	IDGD	
COc1cc(NC(=O)CN(C)CC(=O)NNC(=O)c2cccc(Cl)c2)cc(OC)c1	752332051	OLVQESUDJOCLPD-UHFFFAOYSA-N	434.880	1.689	50	20	IDGD	
O=C(NCCNS(=O)(=O)c1ccc(Cl)s1)NNC(=O)c1cccc([N+](=O)[O-])c1	752687845	AZKGQFFUEMENJC-UHFFFAOYSA-N	447.882	1.232	50	20	IDGD	
COc1ccc2c(c1)CC[C@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)C2	753282261	DNFKDPNHXRJJKX-KRWDZBQOSA-N	446.529	1.447	50	20	IDGD	
CCOc1ccc(/C=C(\C#N)C(=O)N2CCC[C@@H](S(=O)(=O)N(C)CCOC)C2)cc1	754707764	FWADIJWNSVZMFP-WORNYLJVSA-N	435.546	1.891	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)Nc2ccc(Cl)c(S(=O)(=O)N3CCCCC3)c2)cn1	755434566	MDGQZIXIGGSWPP-UHFFFAOYSA-N	440.913	1.715	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2ccc(S(=O)(=O)NC(C)C)cc2)cc1OC	755517293	MYLBVHSLLUXPKI-UHFFFAOYSA-N	436.490	1.857	50	20	IDGD	
COC(=O)CCNC(=O)c1ccc(NC(=O)NNC(=O)Cc2ccccc2OC)cc1	755603521	KHKFEWFLQGTJLV-UHFFFAOYSA-N	428.445	1.384	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)cc1NC(=O)OC(C)(C)C	755695633	ZLZFJRLRIQCELG-SNVBAGLBSA-N	445.498	1.133	50	20	IDGD	
CCOc1ccc([C@@H](C)NC(=O)CCCNC(=O)NN[C@]2(C)CCS(=O)(=O)C2)cc1	756127588	ZXRYRWLLZYBLJF-FOIQADDNSA-N	440.566	1.424	50	20	IDGD	
Cc1c(/C=C(\C#N)C(=O)NCCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)cc(C#N)n1C	756309944	NFPVFMVTUSRIHH-OQLLNIDSSA-N	427.442	1.610	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)c1ccccc1F)C(=O)NN=c1cc[nH]cc1Cl	757418916	MKJWYWJKPXIVPZ-AWEZNQCLSA-N	432.930	1.839	50	20	IDGD	
CC(C)Oc1ccc(Br)cc1NC(=O)NNC(=O)[C@H](C)NS(C)(=O)=O	757739267	KOCSDBHBDDAYFX-VIFPVBQESA-N	437.316	1.327	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)c1ccc(Br)c(C(F)(F)F)c1	758027791	XEBQIGOFIIADHL-ZCFIWIBFSA-N	432.218	1.167	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(C)c(C(=O)NNc2nc(O)c3ccccc3n2)c1	758309084	KAIPMFMCRBNUDQ-UHFFFAOYSA-N	431.474	1.325	50	20	IDGD	
CN(NC(=O)CNC(=O)OCc1ccccc1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758785758	FMGLZQIJEVJFRV-UHFFFAOYSA-N	449.508	1.549	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NNC(=O)C(=O)NC(CC)CC)cc1Br	759681421	YLNRFOSQWMQZNR-UHFFFAOYSA-N	436.328	1.462	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2cccc([N+](=O)[O-])c2C#N)cc(OC)c1OC	760334043	FRBWCGLVZBVRPS-UHFFFAOYSA-N	436.402	1.116	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3cccc([C@H]4CCOC4)c3)cc2)CC1	762003065	NXQANTSEMONKHA-IBGZPJMESA-N	444.557	1.884	50	20	IDGD	
COc1ccc(C(=O)N2CCCCCC2)cc1NC(=O)C(=O)NNC(=O)c1cccnc1	763490756	DKIXZFONNJYQBE-UHFFFAOYSA-N	439.472	1.506	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cnc1Cl	763530872	JTZGTRUFNTYCNS-UHFFFAOYSA-N	444.923	1.342	50	20	IDGD	
O=C(NNC(=O)c1c[nH]c2ccccc12)C(=O)Nc1cnn(-c2cnc3ccccc3n2)c1	763536466	QIQHORSFDIRTLA-UHFFFAOYSA-N	440.423	1.697	50	20	IDGD	
C=CCN(C)S(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2F)cc1	763562068	TVMMNRSGRHSXDR-UHFFFAOYSA-N	434.449	1.032	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)Nc1cccc(OC[C@@H]2CCCO2)c1	763570157	DALBHSKSVVZLRH-LPHOPBHVSA-N	441.440	1.170	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cccc(NC(=O)[C@H](C)n3cccn3)c2)c(C)o1	763576824	FZAAMKAVTRWOPP-ZDUSSCGKSA-N	438.444	1.692	50	20	IDGD	
Cc1ccccc1-c1cc(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)n(C)n1	763576923	DSDPPXGUIYTFJU-GOSISDBHSA-N	435.440	1.321	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1c(F)cccc1-n1cccn1	763680627	HFXKCFSMOIXPHP-UHFFFAOYSA-N	441.419	1.575	50	20	IDGD	
O=C(COc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1ccc2c(c1)OC(F)(F)O2	763684257	HYSWENMGGKJXFA-UHFFFAOYSA-N	427.747	1.826	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)c(F)cc1F	763686573	OHIVOQXMFBRNCS-UHFFFAOYSA-N	441.774	1.570	50	20	IDGD	
O=C(COc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1cccnc1N1CCCCC1	763686687	PTHDFAGDJMCVJR-UHFFFAOYSA-N	431.880	1.890	50	20	IDGD	
O=C(CN1CCCc2ccccc21)NNC(=O)C(=O)Nc1ncn(C2CCCCC2)n1	763745693	IMQQDDHVXJRMRR-UHFFFAOYSA-N	425.493	1.322	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2cc(C)nn2Cc2ccccc2)c1	763772426	MDXWLFPHDWUKNN-UHFFFAOYSA-N	437.456	1.657	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)C(=O)Nc2c(F)cc(Cl)cc2F)c2ccccc2c1=O	763790443	ISVYNRDIPPEOOR-UHFFFAOYSA-N	435.774	1.265	50	20	IDGD	
CC(C)(C)NC(=O)c1ccccc1NC(=O)C(=O)NNC(=O)COc1ccccc1C#N	763807633	PFUDEBQXBOPDDV-UHFFFAOYSA-N	437.456	1.251	50	20	IDGD	
CCN(CC)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)Cc2c[nH]c3ccccc23)cc1	763861935	WCKOVWNBSFFGRD-UHFFFAOYSA-N	435.484	1.979	50	20	IDGD	
O=C(NNC(=O)c1cc(Cl)ccc1O)C(=O)Nc1ccccc1S(=O)(=O)C(F)F	763976942	JDQGKAHQHBZLBI-UHFFFAOYSA-N	447.803	1.442	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)OC)cc2F)o1	764139283	QUOQTTULFLPUSR-UHFFFAOYSA-N	434.424	1.447	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)OC)c(F)c2)o1	764139494	VBZDDSVHNWJHIS-UHFFFAOYSA-N	434.424	1.447	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)C(=O)Nc1cccc(N2CCCNC2=O)c1	764239050	BXPORJDLMQEHSD-UHFFFAOYSA-N	434.456	1.347	50	20	IDGD	
Cc1ncsc1C(=O)NNC(=O)C(=O)Nc1cccc(CN(C)Cc2cscn2)c1	764246975	SUBZOMWYNMBSMQ-UHFFFAOYSA-N	444.542	1.940	50	20	IDGD	
COCCOc1ccc(C#N)cc1NC(=O)C(=O)NNC(=O)c1cccc(OC(F)F)c1	764251186	QFWFDQULXDMIKR-UHFFFAOYSA-N	448.382	1.585	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NN=C3C(=O)Nc4cc5c(cc43)OCCO5)n[nH]2)cc1OC	764800938	UEOOTWMYPJHYCM-UHFFFAOYSA-N	449.423	1.951	50	20	IDGD	
COc1cc(C=NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)ccc1OC(C)=O	764829193	VRJKXEBYIYENQW-UHFFFAOYSA-N	438.484	1.529	50	20	IDGD	
COc1ncccc1NC(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	765313489	QZTWCUCSSSBOQR-UHFFFAOYSA-N	432.912	1.714	50	20	IDGD	
CCOC(=O)NNC(=O)C(=O)Nc1cc(S(=O)(=O)N(CC)CC)ccc1OC(C)C	765406149	YBALRZBWWVFROQ-UHFFFAOYSA-N	444.510	1.220	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C[C@@H](NC(N)=O)c2ccccc2C)n[nH]1	765592752	QVXLAYIFLDTRAD-MRXNPFEDSA-N	436.472	1.954	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)c1cnc2ccccc2n1	766661631	XYUKWRJHAJOCPC-UHFFFAOYSA-N	438.919	1.862	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)CCC(=O)N2CCN(c3ccccn3)CC2)cc1	767894625	VGCVBXUOSZNHCI-UHFFFAOYSA-N	439.516	1.299	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNC(=O)c2cncc(NC(C)=O)c2)c2ncccc12	768242571	UAGQCXJQPJVHLV-UHFFFAOYSA-N	436.428	1.387	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)CN2C(=O)N[C@@]3(CCCC(C)(C)C3)C2=O)o1	768975378	FWNMKWFBWOBBSO-JOCHJYFZSA-N	447.536	1.773	50	20	IDGD	
COC(=O)c1[nH]c(C)c(C(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)c1C	769208414	KRRHJATXJVDKQQ-UHFFFAOYSA-N	437.497	1.762	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3sc(NC4CC4)nc3C)CC2)cc1	771043972	DLXOPNKCNHLQGV-UHFFFAOYSA-N	442.589	1.913	50	20	IDGD	
C[C@@H]1CCCN(C(=O)C(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)C1	771610179	RPLDUGPUYSXTBJ-MRXNPFEDSA-N	447.499	1.408	50	20	IDGD	
CC(C[C@H]1CCCN1C(=O)OC(C)(C)C)=NNC(=O)CSc1nnc(O)nc1O	771877522	SBOHZFKNGPPSLT-LLVKDONJSA-N	426.499	1.657	50	20	IDGD	
C[C@H]1C[C@@H](NC(=O)OC(C)(C)C)CCN1C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	771945395	ALWPJUDSPDAWCS-ZFWWWQNUSA-N	444.496	1.394	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)C2(OCc3ccccc3)CCOCC2)c1	772059500	XKYXHQSLVGJMJI-UHFFFAOYSA-N	432.498	1.617	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)Nc2ccc(N3CCOCC3)cn2)cc1	772405552	MFBUDXFORKMMAX-HNNXBMFYSA-N	427.461	1.741	50	20	IDGD	
COc1cc(C)c(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3OC)[nH]n2)cc1F	773495919	HPZDGKSTEOVONK-UHFFFAOYSA-N	441.419	1.941	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccc(Br)cn1	773526536	CZJVLUZHYCKCLO-VIFPVBQESA-N	425.214	1.537	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNc2ccccc2[N+](=O)[O-])cccc1C(=O)N1CCOCC1	773654325	RYSYJZUKDUNWNX-UHFFFAOYSA-N	427.417	1.457	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)CNS(=O)(=O)c1ccccc1N	774326392	FRFUVVSCWZNNDV-UHFFFAOYSA-N	445.526	1.440	50	20	IDGD	
CCCc1nnc(S)n1CC(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776202019	OXWFJERIMGHFML-UHFFFAOYSA-N	441.558	1.155	50	20	IDGD	
C#C[C@H](NC(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1)[C@@H]1CCCO1	776226851	ILXFOZFJNHBBOD-PMACEKPBSA-N	445.483	1.513	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2N2CCOCC2)c1	776558660	JAKCFKFQEIBVJW-UHFFFAOYSA-N	428.445	1.888	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)NCc1ccc(NC(=O)c2ccco2)cc1	778068772	BNLKWCVSIQOEOO-UHFFFAOYSA-N	431.449	1.887	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)c2c(C)nn(C)c2-n2cccn2)cc1C	778481822	ATHYMSBWWNGTNK-UHFFFAOYSA-N	430.490	1.465	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@@H](C(=O)NNC(=O)c2cccc3ncccc23)[C@@H](C)O)cc1	779513702	IJNCXRVVRSXBBW-AUUYWEPGSA-N	442.497	1.032	50	20	IDGD	
Cn1ncc(Cl)c1C=NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	780189374	YQKFZWMWRRTWNS-UHFFFAOYSA-N	439.925	1.177	50	20	IDGD	
CC1C[C@@H](C(=O)NNc2ncncc2Cl)[C@H](C(=O)NNc2ncncc2Cl)C1	781835921	BWPOSBFLHIMZRS-NXEZZACHSA-N	425.280	1.822	50	20	IDGD	
CN1CCC(N(C)c2ccc(NC(=O)C(=O)NNC(=O)c3ccc(O)cc3)cc2)CC1	782837344	IMIWGLSYEFJXTP-UHFFFAOYSA-N	425.489	1.322	50	20	IDGD	
O=C1NC[C@H]2CN(S(=O)(=O)c3ccc(S(F)(F)(F)(F)F)cc3)CCN2C1=O	782985626	QNTLJQJQJSCGDE-VIFPVBQESA-N	435.396	1.675	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2cccc(CSc3ccccn3)c2)CCS(=O)(=O)C1	783428791	XIPZQCUAVXZMCM-LJQANCHMSA-N	434.543	1.510	50	20	IDGD	
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)NNC(=O)CSc1ccccc1O	784339811	FKVXMSVATZDDLJ-UHFFFAOYSA-N	441.443	1.189	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNc2cccnc2Cl)cc1S(=O)(=O)N(C)C	784842392	SBEUJKKTGFBZPK-UHFFFAOYSA-N	441.897	1.466	50	20	IDGD	
Cc1n[nH]c(C)c1[C@@H](C)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	784976107	JJYKHBCGMAIPRX-CYBMUJFWSA-N	433.534	1.766	50	20	IDGD	
CC[C@@H](C)n1ncc(NC(=O)C(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)c1C1CC1	785023912	PXVZXRDLYUXLEI-SNVBAGLBSA-N	430.421	1.745	50	20	IDGD	
Cc1ccc(NC(=O)Nc2ccccc2)cc1NC(=O)C(=O)NNc1nccn(C)c1=O	785086212	KXWXQEKQJOCGRR-UHFFFAOYSA-N	435.444	1.815	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2cc(C(=O)N(C)C)ccc2OC)n1	785226743	VCZCJQHAKFPGFP-UHFFFAOYSA-N	429.481	1.115	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)[C@]1(O)CCc2ccccc2C1	786259341	FSCJKHVFYFVXEF-NRFANRHFSA-N	431.514	1.071	50	20	IDGD	
Cc1ccc(CNC(=O)NNC(=O)[C@@H](C)Oc2cccc(Br)c2)c(=O)n1C	787339243	GWTAPANTNDAFNL-GFCCVEGCSA-N	437.294	1.754	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)N[C@@H]1CSc2ccc(Br)cc21	787399969	NXMIXDYWOIQUTA-LLVKDONJSA-N	439.291	1.949	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2cccc3ncccc23)cccc1N1CCNC1=O	787541600	AJNVBVALUYLROG-UHFFFAOYSA-N	432.440	1.473	50	20	IDGD	
CCOc1ccc(C(=O)NCC(=O)NNc2ccc(-n3ccnc3)nn2)cc1OCC	788174145	GAJFRANYCLHSQL-UHFFFAOYSA-N	425.449	1.333	50	20	IDGD	
NS(=O)(=O)c1ccccc1NNC(=O)c1cn(-c2cccc(C(F)(F)F)c2)nn1	788227686	FVJNZAMUEJICIZ-UHFFFAOYSA-N	426.380	1.690	50	20	IDGD	
CC(C)(C)OC(=O)N1CC2(C[C@H]2C(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)C1	789191398	GODKKHBABKYDHW-AWEZNQCLSA-N	438.506	1.500	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccc3c2OCC[C@@H]3N(C)C)cc1	789731262	CVLZUSUSVWNDIK-SFHVURJKSA-N	442.472	1.245	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC(C(=O)NNc3nc4ccccn4n3)CC2)c(C)c1	791252194	JPQJJXUZBBCKDY-UHFFFAOYSA-N	428.518	1.890	50	20	IDGD	
Cc1ccn(-c2ccc(NC(=O)C(=O)NNC(=O)[C@H]3OCC[C@H]3c3ccccc3)cc2)n1	793068912	PMSUGXPKELMMHO-PMACEKPBSA-N	433.468	1.839	50	20	IDGD	
COc1cc(C)nc(NNC(=O)C2(S(C)(=O)=O)CCN(C(=O)OC(C)(C)C)CC2)n1	796878459	FWEQDIYRAVWWNV-UHFFFAOYSA-N	443.526	1.051	50	20	IDGD	
O=C(NC[C@H]1CCC(F)(F)C1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	797556689	SZNPCCDUPCKDLP-ZDUSSCGKSA-N	430.477	1.851	50	20	IDGD	
Cn1nc(O)c2c(C(=O)NNC(=O)Nc3ccc(S(C)(=O)=O)cc3)cc(C3CC3)nc21	802069019	UFIYZYAKNNOSOH-UHFFFAOYSA-N	444.473	1.421	50	20	IDGD	
Cc1nc(O)c(Br)cc1C(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	803000101	RGWWPWNVAJVFCH-UHFFFAOYSA-N	441.669	1.589	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCc2ccc(C[S@](C)=O)cc2)cc(OC)c1OC	804865779	NXGXQHRUEUAVGG-PMERELPUSA-N	435.502	1.735	50	20	IDGD	
O=C(NNC(=O)N1CC[C@@]2(CCN(Cc3ccccc3)C2)C1)c1ccc(-n2cnnn2)cc1	804867385	AHLWLZWCUGYZJR-HSZRJFAPSA-N	446.515	1.615	50	20	IDGD	
O=C(NNc1nccnc1C1CCC1)c1ccc(S(=O)(=O)NC[C@H]2CCCO2)cc1	805461429	CIOLZPKIMQLXOV-MRXNPFEDSA-N	431.518	1.958	50	20	IDGD	
CNS(=O)(=O)c1cc(NC(=O)C(=O)NNc2cccc([N+](=O)[O-])c2C)ccc1F	807005637	KAOBSMFUBCKEPG-UHFFFAOYSA-N	425.398	1.032	50	20	IDGD	
CN1CCN(C(=O)NNC(=O)C2CCN(C(=O)c3ccc(C(F)(F)F)cc3)CC2)CC1	807378869	NLEQOCYCDRBXNL-UHFFFAOYSA-N	441.454	1.546	50	20	IDGD	
O=P(CCN1CCN(S(=O)(=O)c2cc[nH]n2)CC1)(c1ccccc1)c1ccccc1	809988899	SKJMWXKPRWLGMT-UHFFFAOYSA-N	444.497	1.730	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)Nc2cc(C(N)=O)ccc2OCC(F)F)c1	810343725	QBJWAXCZJZRLLN-UHFFFAOYSA-N	436.375	1.249	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(C(=O)NNC(=O)COc2cc(C)cc(C)c2)cc1	811257475	IRTAPHIWANHCGM-UHFFFAOYSA-N	435.502	1.068	50	20	IDGD	
CC(C)n1ncc2cc(C(=O)OCC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)cnc21	811623191	GQDVTDCXAYVZND-UHFFFAOYSA-N	426.389	1.538	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)nn1[C@H](C)C1CC1	813033469	VEMFYTQJTLPOCM-CYBMUJFWSA-N	434.522	1.495	50	20	IDGD	
CC(=NNC(=O)[C@@H](C)NS(C)(=O)=O)c1nnn(-c2cccc(Br)c2)c1C	814835338	NVWXBWJJXWRSIZ-SNVBAGLBSA-N	443.327	1.116	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1cc(Cl)ccc1I	815571754	LGRXPOWBYPUGKQ-UHFFFAOYSA-N	447.620	1.825	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNc2ncncc2F)c(Br)cc1F	815764509	KGZKZKOAXCKITQ-UHFFFAOYSA-N	430.165	1.386	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNS(=O)(=O)c1ccc2c(c1)NC(=O)CO2	818788555	PXSSTEHORCMXNU-CYBMUJFWSA-N	441.465	1.948	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2CCN(C(C)C)C[C@@H]2c2cnn(C)c2)cc1C	849485550	GXBFOLAKGOFJFB-VQTJNVASSA-N	440.548	1.637	50	20	IDGD	
CC(C)C[C@H](C(=O)NNC(=O)c1cccc(N(C)C)c1)N1C(=O)[C@@H]2CC=CC[C@H]2C1=O	904225105	VDDMSBKFRPOXFP-GUDVDZBRSA-N	426.517	1.880	50	20	IDGD	
C[C@H](Oc1ccccc1Cl)C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	914587035	MYJGOFQIWUBMFO-YVEFUNNKSA-N	434.832	1.638	50	20	IDGD	
O=C(NNC(=O)C1CCN(C(=O)OCc2ccccc2)CC1)c1ccc(-n2cnnn2)cc1	916144580	FRCYPTQMZQBOLN-UHFFFAOYSA-N	449.471	1.472	50	20	IDGD	
CCc1ncncc1C(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	916160632	UKMUKZMTJGBRSE-UHFFFAOYSA-N	431.499	1.976	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)NCc1ccc(-n2ccnc2)nc1	916236332	FKGQNJBTLQFVII-UHFFFAOYSA-N	448.531	1.310	50	20	IDGD	
CCCCNC(=O)c1ccc(CNC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1	916639770	ZASISIIIHCFPDS-LJQANCHMSA-N	426.473	1.887	50	20	IDGD	
CCC[C@@H](C)N1C[C@@H](C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)CC1=O	917515356	COQUEUBWRFLDMT-CABCVRRESA-N	427.505	1.776	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCCc1c(F)cccc1F	918014347	YZVNQNSJJXZOIB-UHFFFAOYSA-N	425.461	1.753	50	20	IDGD	
CC(C)[C@H](CNC(=O)NNC(=O)c1ccc(F)cc1Br)N1CCN(C)CC1	918202098	IXFAJQCPIPNRPD-INIZCTEOSA-N	444.349	1.804	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)c1ccc(OCC(=O)NC)c(OC)c1	919689488	RVZNRLPTKTYJDO-UHFFFAOYSA-N	439.472	1.193	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)NCC(=O)N1CCCc2ccccc21	920045412	KXVNRZYDJCWSMI-UHFFFAOYSA-N	427.417	1.283	50	20	IDGD	
O=C(COc1ccc(Cl)cc1)NNC(=O)Nc1ccccc1CN1C(=O)CNC1=O	920931432	QAEQXEMCGKBRFN-UHFFFAOYSA-N	431.836	1.624	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCc1ccc(-n2ccnc2)cc1	921199987	RURJQFJWEJELAW-UHFFFAOYSA-N	441.517	1.618	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)CC1(CC(=O)N2CCOCC2)CCCC1	1254792843	FTGKPSNLVVHSMK-UHFFFAOYSA-N	440.541	1.248	50	20	IDGD	
O=C(NCc1ccc(N2CCOCC2)c(F)c1)NNC(=O)c1cncn1-c1ccccc1	1317941190	ZWHCMMOMYAQIRR-UHFFFAOYSA-N	438.463	1.992	50	20	IDGD	
CC(=O)Nc1cc(F)c(S(=O)(=O)NNC(=O)c2n[nH]c3c2CCCC3)cc1Cl	1322530062	BZUXKANOHMQTQN-UHFFFAOYSA-N	429.861	1.663	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)Cc2ccccc2S(C)(=O)=O)CC1	1329021908	BQDKEMLEWBMQON-UHFFFAOYSA-N	439.534	1.427	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(CCN(C(=O)c3ccc4cnccc4n3)C2)C1	1777732392	WFVAEYNRDVOZAI-LJQANCHMSA-N	433.306	1.858	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccn(C(F)F)c1=O)C2)[C@H](F)Cl	1778031534	YTAADBQMHSFYTP-FHSNZYRGSA-N	435.830	1.905	50	20	IDGD	
COC(=O)c1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)cn1	1779295757	WVCAQRWBFWVAIC-FQEVSTJZSA-N	435.553	1.163	50	20	IDGD	
COC[C@H](C)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1	1780095603	QUALJPDGSALHJA-QKKBWIMNSA-N	449.460	1.246	50	20	IDGD	
COc1cc(C#N)cc(C(=O)N2CC[C@@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)c1	1780175498	NLPUXYFFCOUJDV-OAQYLSRUSA-N	431.565	1.862	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H]2CCCCN2C)C1	1780595209	XMGHSIRXWDQDBB-WFXMFSGNSA-N	430.387	1.768	50	20	IDGD	
Cc1cc(C)n(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](F)Br)C2)n1	1780771189	VPBUDWCPPKPCSM-QGPMSJSTSA-N	445.333	1.704	50	20	IDGD	
Cc1ccc(CCC(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)cn1	1781327017	WDZDMHBFSGJQFE-AEFFLSMTSA-N	428.302	1.843	50	20	IDGD	
O=C(c1n[nH]c2c1CCCC2)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781330933	IWQOKGAKTAPGRV-YOEHRIQHSA-N	429.290	1.423	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc3cncn3c1)C2	1782175899	RSUXACHLPUQARG-WAOWUJCRSA-N	434.924	1.716	50	20	IDGD	
O=C(CCc1cnccn1)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Br)C2	1782576593	MZQQYCQVWJBIRE-QGPMSJSTSA-N	443.317	1.614	50	20	IDGD	
COCCC(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](Br)Cc3ccccc3)C2)C1	1783022627	KULQVEPFJSZYFA-XLIONFOSSA-N	439.350	1.859	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccn(CCOC)n3)CCO2)C1	1783348226	XBXPCXWSQQBAHA-KDOFPFPSSA-N	443.342	1.147	50	20	IDGD	
CC(C)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc(OCF)cn3)C[C@@H]21	1783846162	MJLMETJIMZCRIU-YDHLFZDLSA-N	428.892	1.641	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)Cc3cc([N+](=O)[O-])ccc3F)CCO2)C1	1783873168	LVFFKOMJLGIXQI-HNAYVOBHSA-N	443.859	1.360	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3c(C)nc4sccn34)CCO2)C1	1783878500	ZDPWFFJFESTSRZ-SCLBCKFNSA-N	426.926	1.402	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)C(=O)Nc3c(C)cccc3C)CCO2)C1	1783880579	KGZUMBKCHKQEOC-IIBYNOLFSA-N	437.924	1.326	50	20	IDGD	
C[C@@H](Cc1ccccc1)C(=O)N1CCO[C@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1	1783938500	ZRKYGKMMBGSOMR-MBSDFSHPSA-N	430.549	1.068	50	20	IDGD	
O=C(C[C@@H]1OCCc2ccccc21)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21	1784395626	XMDMLRSOWUESQT-JBDAPHQKSA-N	436.936	1.270	50	20	IDGD	
CCOC(=O)C(C)(C)C(=O)N1CC[C@]2(CN(C(=O)[C@H](Br)CC)CCO2)C1	1785525151	KRHRZAVQFMZPSA-ACJLOTCBSA-N	433.343	1.579	50	20	IDGD	
Cc1nc(CC(=O)Nc2ccc(C3(NC(=O)c4cccc(B(O)O)c4)CCC3)cc2)no1	1786844539	PCAAFJIDSPEJFD-UHFFFAOYSA-N	434.261	1.048	50	20	IDGD	
Cc1cc(C(N)=O)cc(C)c1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]2C1	1787446655	VELAFUVOECAPQW-QEWYBTABSA-N	425.888	1.530	50	20	IDGD	
COC(=O)c1ccc(OCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]3C2)cc1	1787451256	CWOOXOWAXAYGRM-OWIUFQIYSA-N	442.871	1.366	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)c1cnc2ncccn12	1788005523	RTAGZMUNWCGVJR-AUZPSNTRSA-N	440.273	1.013	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)c3n[nH]cc3[N+](=O)[O-])CCC2)cc1)c1ccc(B(O)O)cc1	1788142370	UUONWMWWOULMCA-UHFFFAOYSA-N	449.232	1.059	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)c3cc[n+]([O-])cc3)CCC2)cc1)c1cccc(B(O)O)c1	1788148074	ZAEZBMKJPUJZBB-UHFFFAOYSA-N	431.257	1.061	50	20	IDGD	
C[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21)[S@](=O)c1ccccc1	1790595338	HSUBNWKHXVGRNW-ZBCAILASSA-N	430.929	1.697	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CC[S@@](=O)CC)C[C@@H]21	1790960731	RCFSROXRDIAOCY-SHNGGNKPSA-N	437.400	1.298	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3ccccc3F)[C@H]2C1	1791768547	URYJBEIHMDDGMQ-BMFAXAFESA-N	426.916	1.992	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CC(=O)N(C3CCCC3)C1)C2	1793445877	UESJERRCRBBWAL-ZKHYITAMSA-N	439.984	1.775	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1c(C)noc1C	1793886919	ICKKIFBSFJOICY-YXPYIKCWSA-N	428.327	1.597	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C(F)(F)C(F)(F)C(=O)O)[C@H](F)Br	1793977335	NOJKMEBEXSKJHQ-YWIQKCBGSA-N	437.159	1.670	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCc1c(C)noc1C	1794139468	CIOGJWUUZZQZKW-CXHZTBPHSA-N	442.354	1.987	50	20	IDGD	
CCc1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C3)n[nH]1	1796412789	DTLVKQRAIWEPEA-VFMVUTOHSA-N	425.493	1.358	50	20	IDGD	
C[C@H](Nc1cnccn1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@](C)(Cl)CCl)C2	1797780634	QODCESNFQLNVQT-FRTWLMODSA-N	430.336	1.103	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(-c3ccco3)no1)C2	1797954780	ISRZSMMMELVPKM-HBCWATKFSA-N	433.537	1.989	50	20	IDGD	
Cn1ccc2c(O)ncc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)CO[Si](C)(C)C)C4)c21	1798431825	UVFZQWPPZFMMTB-ZSBFGKGUSA-N	446.580	1.334	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(OC)c(NC(C)=O)c1	1798608248	FEPYBEQRIXMMSB-YYAJDYIMSA-N	437.924	1.874	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1CN(C(=O)OC(C)(C)C)C1)C2	1799267645	CPNSOYHMWLPVFF-QKPAOTATSA-N	429.945	1.460	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c[nH]nc3c1)C2)[C@H](F)Br	1799346286	OGXQSKNJUJHMHF-NEBZKDRISA-N	425.258	1.457	50	20	IDGD	
O=C1Cc2cccc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@H](F)Br)c2N1	1799347563	SAUXISFXONKSNJ-VAECKANCSA-N	440.269	1.075	50	20	IDGD	
CC(=O)N[C@@](C)(C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2)c1ccccc1F	1799407283	WDHIOLVCMGNIOW-UZSUOLLMSA-N	443.878	1.301	50	20	IDGD	
CC(=O)N[C@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](O)CCl)C2)c1ccc(F)cc1	1799813815	IRXPOEPYDDOUIB-ILOCAZANSA-N	425.888	1.241	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)c1cnc2ccc(Cl)cc2c1	1799923781	CRKPOSRCMIOIHE-DACLVMHWSA-N	438.311	1.691	50	20	IDGD	
Cc1cc(C#N)cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)c1	1800765249	JLHOWLAAMAPVSV-BCDXTJNWSA-N	432.484	1.431	50	20	IDGD	
Cc1onc(-c2ccncn2)c1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(Cl)Cl	1801016441	LIDUYMGQZKRPQM-GNXNZQSNSA-N	440.287	1.447	50	20	IDGD	
C[C@@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCC(=O)NN(C)C)N1CSCSC1	1802337200	JTMPECKUQGIBJC-JONQDZQNSA-N	443.639	1.041	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1csc(C(F)(F)F)n1)C2	1802337229	LGBFSUCHQSWUSZ-ZSBIGDGJSA-N	447.483	1.787	50	20	IDGD	
COc1ccccc1OCC(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1	1802801994	AUPLNIGYMRHQJC-FVJLSDCUSA-N	447.919	1.775	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)CCc2nc(N)n[nH]2)[C@H]1c1cccnc1	1803691700	IXLFCILREBNOJY-VKJFTORMSA-N	433.944	1.828	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1CC(=O)C1	1804155196	BQTJRZPFEJRYFJ-FQLMCAECSA-N	427.929	1.736	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)C2=CCCC2)[C@@H]1c1cccnc1	1806212087	BOZNIVCCCWJJIP-XLIONFOSSA-N	434.500	1.510	50	20	IDGD	
O=C(CCBr)NC[C@@H]1CCN(C(=O)CN2CCOCC2)[C@@H]1c1cccnc1	1806340850	OMIGTWUYOSHHDS-QFBILLFUSA-N	439.354	1.205	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cccn3c(O)nnc23)[C@H]1c1cccnc1)[C@H](F)Cl	1808308181	BOFZFTYNYRSMDY-QEJZJMRPSA-N	432.843	1.684	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)c3c(F)cccc3F)CC2)C1	1809969333	DTBRANHHOBRKQZ-UHFFFAOYSA-N	442.271	1.803	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)c3cnoc3C3CC3)CC2)C1	1809976773	OQOAOBXWERSQDY-UHFFFAOYSA-N	437.305	1.390	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)[C@H]2CC[C@H](O)CC2)[C@H]1c1cccnc1	1813075041	WXQVZHQUXOOEAW-KIQACKJLSA-N	445.564	1.012	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@H](CNC(=O)CCn2ccnn2)[C@H]1c1cccnc1	1813432322	GFLZCIBTMKOPFM-FXAWDEMLSA-N	430.585	1.621	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)[C@H]2CCCS2)[C@@H]1c1cccnc1	1813615320	FPTLPPZUKPHYAZ-HLIPFELVSA-N	433.578	1.356	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1CCc2nc(NC(=O)C3(C#N)CC3)sc2C1	1814470359	SRJAJUPFXHUTMM-BUGPSZFBSA-N	439.501	1.493	50	20	IDGD	
CC(=O)N[C@H](C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](C)CBr)n[nH]1	1814783267	MLVJITOCAYCVPG-JTNHKYCSSA-N	428.331	1.957	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](O)CCl)n[nH]1	1814874779	DUHNYVHXYMHXPX-QWHCGFSZSA-N	429.905	1.526	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccccc2O)n[nH]1	1816266750	GZLLZXMLAKARKJ-INIZCTEOSA-N	428.493	1.794	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CC1CC1)CC2	1817279895	KTTFEZTWVFQVNM-OBPDLJBASA-N	428.518	1.989	50	20	IDGD	
CC(C)CNC(=O)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCBr)[nH]n1	1818132321	PYNPTLAIQLEIJL-ZDUSSCGKSA-N	428.331	1.959	50	20	IDGD	
Cc1ncncc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1819868232	MHCNNJCEAJLLBR-KRWDZBQOSA-N	449.475	1.126	50	20	IDGD	
CN1CCN(C2(C(=O)Nc3cc([C@@H]4CCCCN4C(=O)[C@H](F)Cl)[nH]n3)CC2)CC1	1820794615	CEGTWEHFUSOSIY-HOCLYGCPSA-N	426.924	1.716	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](N)CCC(N)=O)[nH]n1	1820864177	RXCXGRUFKUBMSI-ZMNCSTGQSA-N	433.340	1.231	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CN2CCN(C)CC2)[nH]n1	1822186781	JEQGJFGTXOGDBZ-UKRRQHHQSA-N	441.374	1.433	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCN2CCOCC2)[nH]n1	1822369245	NRTFDRVVSSCKOB-HOCLYGCPSA-N	427.933	1.378	50	20	IDGD	
N=C(N)SCCC(=O)N[C@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1	1823002568	DQEZHMQYYISXAS-WKEGUHRASA-N	438.348	1.762	50	20	IDGD	
COC(=O)NCC(=O)N1CCC([C@H]2CCCCN2C(=O)[C@H](C)CBr)CC1	1824096879	XTEYDCQCDMJTBP-UKRRQHHQSA-N	432.359	1.993	50	20	IDGD	
O=C(c1nc(O)n2c1CCCC2)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)CC1	1824186971	WTBYXIJYFQRNEB-RDJZCZTQSA-N	438.956	1.758	50	20	IDGD	
C#CC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CC2	1825011416	DNUNZGOWGNCACZ-JQWIXIFHSA-N	426.926	1.820	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc([N+](=O)[O-])[nH]1)CC2	1826004316	ZCBJFXPDLDATLW-RKDXNWHRSA-N	427.870	1.859	50	20	IDGD	
Cc1nnsc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827052767	DTIXTYJVKQTZIA-SFHVURJKSA-N	442.350	1.073	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(F)cn3C)C2)C1	1830538594	KNQRQFSWEDEUCS-UGSOOPFHSA-N	446.317	1.265	50	20	IDGD	
Cc1ocnc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2	1830543556	UBNZAJCPPAMITC-YVEFUNNKSA-N	430.299	1.084	50	20	IDGD	
Cc1cc(C)c(OCC(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)c(C)c1	1831168901	QDJWNLABDLPPKR-TZIWHRDSSA-N	442.915	1.981	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4ccccn4n3)C2)C1	1831647439	VBJSDVGEEYFZTH-DYESRHJHSA-N	434.924	1.812	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2nc(C)c(C)[nH]c2=O)CC1	1831828395	RMCIBODJAOKUHD-IAGOWNOFSA-N	438.956	1.874	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CCCC(F)(F)F)CCO2)C1	1832265675	XRHHJOLPBFGUSW-IUODEOHRSA-N	445.276	1.959	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)CN3CCCC3)CC2)CC1	1833102750	DYEVLXBAZCDAEO-HNNXBMFYSA-N	429.403	1.437	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3ncn(C)n3)CC2)CC1	1834090393	OVWJWTBTYHEZLH-OAHLLOKOSA-N	441.374	1.174	50	20	IDGD	
CN(C)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)[C@H](F)Cl)CC2)CC1	1835078635	QLVKMFOFDJQVOG-SFHVURJKSA-N	425.936	1.867	50	20	IDGD	
CC(=O)N(C)[C@@H](C)C(=O)NC1CCN(C2CCN(C(=O)[C@](C)(Cl)CCl)CC2)CC1	1835124061	LNFDCXDWCQOCQA-VBKZILBWSA-N	449.423	1.661	50	20	IDGD	
Cc1nc[nH]c1C(=O)NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1	1835194066	PQCXJPHUZGTHMS-HNNXBMFYSA-N	430.322	1.594	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3n[nH]c4ccccc34)CCO2)C1	1836936693	QBZDNEGREIZWSV-OAQYLSRUSA-N	434.924	1.898	50	20	IDGD	
Cc1noc(C)c1CC(=O)N1CCOC[C@@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1837710029	CXZJCRPYXPUSKA-FQEVSTJZSA-N	439.585	1.142	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(F)n3)CCO2)C1	1837910067	DZVVUXONRBNJCT-ACJLOTCBSA-N	444.301	1.464	50	20	IDGD	
C[C@H]1C[C@]1(C)C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1	1837920233	SHFPMHDPVNGETI-HJPURHCSSA-N	428.338	1.025	50	20	IDGD	
O=C(c1ncccc1C(F)(F)F)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1838142176	GEULTHFYICNHSW-CZUORRHYSA-N	439.793	1.705	50	20	IDGD	
O=C(c1cccc(-c2cnccn2)c1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1838592232	XBUBOSXJZMJLOW-WIYYLYMNSA-N	448.882	1.748	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)C3(C(=O)OC)CC3)CC2)CC1	1838758329	ZHAACUOPEFCKNI-MRXNPFEDSA-N	430.929	1.192	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cn3cnc4ccccc43)C2)C1	1839148726	HXGVWMXFTQIVST-IERDGZPVSA-N	434.924	1.510	50	20	IDGD	
CC(C)c1nc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)co1	1839197604	BUQRVJMTJLOJOM-CXAGYDPISA-N	448.289	1.559	50	20	IDGD	
Cc1cc(F)ccc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839203418	KOBIKPFAVBGZFL-YJBOKZPZSA-N	447.276	1.895	50	20	IDGD	
C=CC[C@H](C(=C)C)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](C)Br)CCO2)C1	1840033536	IJJNLNDQMNYEND-FRQCXROJSA-N	429.355	1.995	50	20	IDGD	
O=C(c1cccc([N+](=O)[O-])c1Br)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1	1841352955	WUQSOWBLZSLDNS-LBPRGKRZSA-N	446.685	1.774	50	20	IDGD	
O=Cc1ccccc1-c1cncc(C(=O)N2CC3(CCCN3C(=O)[C@H](O)CCl)C2)c1	1841353165	IDORMPMGNLEEIT-LJQANCHMSA-N	427.888	1.978	50	20	IDGD	
C[C@H]1CC[C@@H](C(=O)N2CC3(CCCN3C(=O)[C@H](O)CCl)C2)CN1C(=O)OC(C)(C)C	1841354800	WRPOVLPVYRIEFA-ARFHVFGLSA-N	443.972	1.825	50	20	IDGD	
COc1ccc(C(=O)N2CC3(CCCN3C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)c(C)c1	1843416502	RMFSOWYDLMQREV-PCLIKHOPSA-N	437.500	1.955	50	20	IDGD	
CN(CC(=O)N1CCCC12CN(C(=O)c1cccs1)C2)NC(=O)NCc1ccccc1	1845038480	HQHNVPKSBPZVNF-UHFFFAOYSA-N	441.557	1.911	50	20	IDGD	
COCCOCCOCCOCC(=O)N1CCCC12CN(C(=O)C(C)(C)CCl)C2	1846256135	SYHMVVHLPUSVOT-UHFFFAOYSA-N	434.961	1.151	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)C1=CN2CCS(=O)(=O)N=C2C=C1	16177146	KHNMPHMQMDWBJR-UHFFFAOYSA-N	443.510	1.377	50	20	IDGD	
CC(C)[C@@H](NS(=O)(=O)c1ccc2c(c1)OCCCO2)C(=O)NNC(=O)c1ccccn1	17328829	OKIMVNRNXHCHRJ-GOSISDBHSA-N	448.501	1.007	50	20	IDGD	
COc1ccc(N2C[C@H](C(=O)NNC(=O)[C@@H]3COc4ccccc4O3)CC2=O)c(OC)c1	27068330	ZITCOWSZGRNCKN-YJYMSZOUSA-N	441.440	1.044	50	20	IDGD	
COCCCNC(=S)N(C)NC(=O)c1ccc(Cl)c(S(=O)(=O)N2CCCC2)c1	726076436	STPPQMAZANLDSF-UHFFFAOYSA-N	448.998	1.612	50	20	IDGD	
CC(C)(C)NC(=S)NNC(=O)CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1	726139292	PKAJGRVIICKWOT-UHFFFAOYSA-N	428.458	1.157	50	20	IDGD	
Cc1nn(CCC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c(C)c1[N+](=O)[O-]	726496309	VQEASJYBPZPBAV-UHFFFAOYSA-N	443.508	1.158	50	20	IDGD	
O=C1CN(C(=O)c2ccc(CNC(=O)NNc3ccc(OC(F)F)cc3)cc2)CCN1	726706084	WHBMBTAOMTYRBQ-UHFFFAOYSA-N	433.415	1.686	50	20	IDGD	
O=C(COc1ccc2c(c1)CCC(=O)N2)NNc1ccc(S(=O)(=O)NC2CC2)cc1	726863022	LMXHQJXUKTVSDA-UHFFFAOYSA-N	430.486	1.534	50	20	IDGD	
CCCS(=O)(=O)Nc1ccc(C(=O)OCC(=O)NNC(=O)c2cccs2)cc1	728110137	ZZLFQUXJPCGKLS-UHFFFAOYSA-N	425.488	1.518	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)[C@H]1CCCN1C(=O)Cc1ccccc1	728211613	YZEYOYRSJSHYLC-HXUWFJFHSA-N	442.541	1.804	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2cccc(C#N)c2)s1	728943407	OCEZYGZHHKJXHJ-UHFFFAOYSA-N	435.531	1.794	50	20	IDGD	
CC[C@@H](N=c1nn[nH]n1-c1ccccc1)C(=O)NNC(=O)[C@H](C)Oc1ccc(F)cc1	729281791	DNOZWHVEDSOCKQ-SUMWQHHRSA-N	427.440	1.029	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)CSc2nnnn2CC(F)(F)F)cc1OC	729966940	ZWHFHHBJIKKELT-UHFFFAOYSA-N	434.400	1.196	50	20	IDGD	
CNS(=O)(=O)c1cccc([C@@H](C)NC(=O)NNC(=O)c2cccc3ncccc23)c1	730128742	ZYWCCLCQJHKTFA-CYBMUJFWSA-N	427.486	1.848	50	20	IDGD	
O=C(NCCS(=O)(=O)N1CCSCC1)NNc1ncc(C(F)(F)F)cc1Cl	730584529	XYGHNXBIZQDFHQ-UHFFFAOYSA-N	447.892	1.759	50	20	IDGD	
Cc1c(C(=O)NNC(=O)Cn2cnc3ccccc32)nnn1-c1ccc(OC(F)F)cc1	731186754	SHBACOMVZKEQDZ-UHFFFAOYSA-N	441.398	1.988	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Cn2nnc(-c3ccc(C)cc3)n2)cc1Br	732033450	HJJDAEAXJXIESO-UHFFFAOYSA-N	445.277	1.881	50	20	IDGD	
O=C(NCC(=O)OCc1ccccc1Cl)NNC(=O)C1CCN(c2ncccn2)CC1	733347220	QLXRXBIZFKATHG-UHFFFAOYSA-N	446.895	1.420	50	20	IDGD	
CNS(=O)(=O)c1ccc(C(=O)NNc2cc(C(F)(F)F)nc(-c3ccccn3)n2)o1	734258275	HDSUSOMELQXPHG-UHFFFAOYSA-N	442.379	1.815	50	20	IDGD	
CN1C(=O)C[C@@H](C(=O)NNC(=O)c2nnc(O)c3ccccc23)[C@@H]1c1cccc(Cl)c1	734417777	UJEPLWPBBYBDNW-QAPCUYQASA-N	439.859	1.969	50	20	IDGD	
CN1C(=O)CC[C@H](C(=O)NNC(=O)N2CCOCC2)[C@H]1c1ccc(C(F)(F)F)cc1	734429313	MBPLVMYOJQOUHM-GOEBONIOSA-N	428.411	1.688	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)NC1CCN(S(=O)(=O)Cc2ccccc2)CC1	735513578	QFWWWOZVDVHTNS-UHFFFAOYSA-N	446.529	1.634	50	20	IDGD	
CCc1c(C(=O)NNC(=O)C(=O)NC(CC)CC)nnn1-c1ccc(OC(C)C)cc1	741216216	CYUOJLRVADMUAT-UHFFFAOYSA-N	430.509	1.683	50	20	IDGD	
COc1ccc(Br)cc1S(=O)(=O)NNC(=O)c1cc([N+](=O)[O-])ccc1O	743268679	FCPSOQVCDOQDKJ-UHFFFAOYSA-N	446.235	1.695	50	20	IDGD	
C[C@H](C(=O)NNC(=O)CC12CC3CC(CC(C3)C1)C2)N1C(=O)[C@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O	744352856	QEQCGUBSQYXIKG-FRAHLAIGSA-N	429.517	1.291	50	20	IDGD	
N#CCCn1cc(/C=C(\C#N)C(=O)N2CCC[C@H](S(N)(=O)=O)C2)c(-c2ccccc2)n1	744530334	HLFCGCLVVBAXAH-WPNIOXTASA-N	438.513	1.650	50	20	IDGD	
CC(C)[C@@H](NC(=O)c1cccs1)C(=O)OCC(=O)NNC(=O)c1cccc(C#N)c1	744612427	DVRXINZQNAEHDD-QGZVFWFLSA-N	428.470	1.379	50	20	IDGD	
C[C@H]1CN(c2ccc(C(=O)OCC(=O)NNC(=O)c3cccc(C#N)c3)cn2)C[C@H](C)O1	744714111	APFFHTDKIXJCJI-GJZGRUSLSA-N	437.456	1.185	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)NC1CCN(C(=O)c2ccccc2)CC1	745396229	NPDBMQBPFVMLDW-UHFFFAOYSA-N	427.417	1.549	50	20	IDGD	
NC(=O)CC[C@@H](C(=O)NNC(=O)c1cccc(Cl)c1)N1C(=O)c2ccccc2C1=O	746094717	DCPVCEQOZNBKLZ-HNNXBMFYSA-N	428.832	1.031	50	20	IDGD	
O=C(NNC(=O)c1c[nH]c2ccccc12)c1ccc(F)c(S(=O)(=O)Cc2ncon2)c1	746100978	ONEIDTOETBGFJO-UHFFFAOYSA-N	443.416	1.739	50	20	IDGD	
COCCN1C(=O)c2ccc(C(=O)NNc3cc(F)c(F)c(F)c3)cc2S1(=O)=O	746703006	FOYPTFSXZFFWTF-UHFFFAOYSA-N	429.376	1.652	50	20	IDGD	
NS(=O)(=O)c1ccc2c(c1)oc(=O)n2CC(=O)NNc1cccc(Br)c1	748020251	RUOJFBRWTQMLFC-UHFFFAOYSA-N	441.263	1.148	50	20	IDGD	
Cc1ccc(OCC(=O)N2CCN(CC(=O)NNC(=O)c3cccc(Cl)c3)CC2)cc1	748807308	KIUCFSSPFVQELG-UHFFFAOYSA-N	444.919	1.633	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)[C@H]1CCCN1S(=O)(=O)c1cccs1	749162310	XCXDCYHOEVPKNI-CQSZACIVSA-N	427.479	1.267	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)[C@@H](Cc1c[nH]c2cc(F)ccc12)NC(C)=O	749529106	BEQUZLWKFXBVFU-LJQANCHMSA-N	426.448	1.753	50	20	IDGD	
O=C(NNc1nc(Br)cn2ccnc12)c1ccc(=O)n(-c2ccc(F)cc2)n1	750248707	SKGTURJSFONRFG-UHFFFAOYSA-N	444.224	1.934	50	20	IDGD	
CC[S@](=O)[C@H]1CCC[C@H](NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)C1	750669833	DSSAMXYPFZMJRV-GPJBHEHESA-N	449.621	1.609	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)N1CCSCC1	750828265	RULGTBJWTGJRSM-HNNXBMFYSA-N	440.591	1.060	50	20	IDGD	
CC[C@H](C)C(=O)N1CCC[C@H](C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)C1	751043849	RGHBPKGJZDTVAW-PMACEKPBSA-N	443.592	1.631	50	20	IDGD	
COC[C@@H](C)n1c(C)cc(/C=C(\C#N)C(=O)NNC(=O)CNC(=O)c2cccs2)c1C	751209346	PFHSRJOISUZONW-IREQLNLFSA-N	443.529	1.858	50	20	IDGD	
CCOc1ccc(Oc2ccc(NC(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)cc2)cc1	755430118	OGZAYLIQMUYRQU-ZDUSSCGKSA-N	436.490	1.968	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)Nc1ccc(NC(=O)CN2CCOCC2)cc1	755599030	KBACZGXQGDQSQY-UHFFFAOYSA-N	441.488	1.327	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)Nc2cccc(N3C(=O)CN(C)C3=O)c2)o1	755990449	FECUOFJXFDWXQN-UHFFFAOYSA-N	442.476	1.986	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)Nc2ccc(CN3CCOC3=O)cc2)c2ccccc2c1=O	756094647	ZEEHOYOATHKTRC-UHFFFAOYSA-N	436.428	1.352	50	20	IDGD	
COCCS(=O)(=O)c1ccc(NC(=O)NNC(=O)COc2ccc(C#N)cc2)cc1	756556930	YDHGEMNJJDZNTF-UHFFFAOYSA-N	432.458	1.210	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)N[C@H](C)c2ccc(-n3ccnn3)cc2)nc1	756758937	ULSMGGIKIUALEH-CQSZACIVSA-N	444.521	1.736	50	20	IDGD	
CC[C@H]1CN(C(=O)NNC(=O)CNC(=O)c2ccco2)CC[C@H]1NC(=O)OC(C)(C)C	757020615	PTDGQXBOJUJHTB-UONOGXRCSA-N	437.497	1.375	50	20	IDGD	
COCc1nc2n(n1)C[C@H](NC(=O)NNC(=O)[C@H](C)Oc1ccc3ccccc3c1)CC2	757773484	CFMBHWOLYYGKFU-WMLDXEAASA-N	438.488	1.690	50	20	IDGD	
Cc1c(C(=O)N2CCN(S(=O)(=O)CBr)CC2)[nH]c2c1C(=O)CC(C)(C)C2	758526209	AKRAISIEJOFABO-UHFFFAOYSA-N	446.367	1.918	50	20	IDGD	
COCCS(=O)(=O)c1ccc(CNC(=O)NNC(=O)Cn2ccc3ccccc32)cc1	758993764	NBXWTXGBIUWDCK-UHFFFAOYSA-N	444.513	1.592	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1cnc2ccc(F)cc2c1	759607579	KNLFMVXOMZKBCL-UHFFFAOYSA-N	435.459	1.593	50	20	IDGD	
C[C@@H](O)C[C@@H](CNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)c1ccccc1	759610389	KZHPCUBHWLJHCT-APWZRJJASA-N	426.521	1.578	50	20	IDGD	
Cc1noc(C[C@H](NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c2ccccc2)n1	759875078	MTDNPIACZBJMFV-KRWDZBQOSA-N	443.485	1.710	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccnn1Cc1ccc(F)cc1	760280104	QVDSWBVGLVNGKU-UHFFFAOYSA-N	439.447	1.798	50	20	IDGD	
CCS(=O)(=O)c1cccc(S(=O)(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)c1	763439093	ILUNMZZRBJDMBO-UHFFFAOYSA-N	449.551	1.095	50	20	IDGD	
Cc1cc(Br)ncc1NC(=O)C(=O)NNC(=O)[C@@H]1COc2ccccc2O1	763573306	YLGVXJMQRNARDA-ZDUSSCGKSA-N	435.234	1.078	50	20	IDGD	
Cc1ncc(-c2ccccc2)cc1NC(=O)C(=O)NNC(=O)[C@H]1COc2ccccc2O1	763575004	OESRXDBIAPBPTB-HXUWFJFHSA-N	432.436	1.983	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(S(=O)(=O)C[C@@H]3CCCO3)cc2)c(C)o1	763577253	ULIFBNNWKBZWBX-HNNXBMFYSA-N	449.485	1.249	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1ccnn1-c1ccc(Cl)cc1	763629711	RLCSWMMRVHVYSG-UHFFFAOYSA-N	437.847	1.882	50	20	IDGD	
COc1ccc(CN(C)C)cc1NC(=O)C(=O)NNC(=O)COc1cc(C)cc(C)c1	763644840	NRJRGEABAJQRSO-UHFFFAOYSA-N	428.489	1.539	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)c1	763665642	LQROIMWCGXJMOJ-UHFFFAOYSA-N	438.484	1.704	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)cc1	763727257	AMGXKRLDULAKKR-UHFFFAOYSA-N	426.473	1.251	50	20	IDGD	
CCOC(=O)C(C)(C)n1cc(NC(=O)C(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)cn1	763736618	WZWGLQNBFBAUQD-UHFFFAOYSA-N	445.520	1.484	50	20	IDGD	
Cn1ccnc1-c1cccc(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)c1	763745600	GYQDWGJNWBDIDM-UHFFFAOYSA-N	432.484	1.626	50	20	IDGD	
CCCNS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cccc(Cl)c2)cc1	763747824	NGVAKGNJYCBGBA-UHFFFAOYSA-N	438.893	1.428	50	20	IDGD	
CN(C)CCOc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(N(C)C)c2)cc1Cl	763759876	FLNVONZQLCZWJM-UHFFFAOYSA-N	447.923	1.746	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)C(=O)Nc1ccccc1N1CCCCC1	763802958	DDRKLRYCJORCEY-UHFFFAOYSA-N	441.444	1.750	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccccc2N2C[C@H](C)O[C@@H](C)C2)cc1	763811736	LJORYZDQKBQUPJ-IRXDYDNUSA-N	440.500	1.774	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2cc(Cl)ccc2OC[C@@H]2CCCO2)n1	763879939	ABNVZAXKTQZHFI-HNNXBMFYSA-N	449.895	1.497	50	20	IDGD	
CC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc1Cl	763944496	MFDDHYIVCRNMKU-UHFFFAOYSA-N	441.831	1.834	50	20	IDGD	
CNC(=O)c1cc(Oc2ccccc2NC(=O)C(=O)NNC(=O)c2ccccc2C)ccn1	763957819	KYXYNHFZHCFQIY-UHFFFAOYSA-N	447.451	1.942	50	20	IDGD	
Cc1noc(COc2ccc(NC(=O)C(=O)NNC(=O)c3cn(C)c4ccccc34)cc2)n1	763981706	PDRKXDTURIBPLX-UHFFFAOYSA-N	448.439	1.848	50	20	IDGD	
CCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(C)cc3)[nH]n2)cc1	764110837	LTXDJWCSRKBQRO-UHFFFAOYSA-N	434.456	1.535	50	20	IDGD	
O=C(Cc1ccccn1)NNC(=O)C(=O)Nc1cc(C(F)(F)F)ccc1-n1cccn1	764267154	PYMMATUQOLBGSL-UHFFFAOYSA-N	432.362	1.615	50	20	IDGD	
CCCC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)COc2ccccc2O)c1C	764277590	KHZJYVBUKKXIDM-UHFFFAOYSA-N	428.445	1.604	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2csc(-c3ccccn3)n2)c(OC)c1	764287077	SJOBGCQHFLMEFD-UHFFFAOYSA-N	427.442	1.622	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)C(=O)Nc1cccc(-c2nnnn2C2CC2)c1)c1ccccc1	764327748	DPIQAMYHEWZDLC-GOSISDBHSA-N	433.472	1.955	50	20	IDGD	
CN1CCCN(c2ccc(NC(=O)C(=O)NNC(=O)c3ccc(O)c(Cl)c3)cc2)CC1	764349136	JXHYIZYNEGFFOI-UHFFFAOYSA-N	445.907	1.587	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)C(=O)Nc1ccc(N2CCSCC2)cc1	764363085	KNFKBVXCEGWAHK-UHFFFAOYSA-N	428.514	1.543	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)CCC(=O)N3)n[nH]1	764376264	ANGBTKSXIFGJNS-UHFFFAOYSA-N	448.439	1.370	50	20	IDGD	
CCN(CC)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)cn1	764388582	SUHMSHKESLAQFF-UHFFFAOYSA-N	439.451	1.857	50	20	IDGD	
COc1cc(C)ccc1Oc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2COCCO2)cc1F	764426652	VQQZWDPNKUMGDN-GOSISDBHSA-N	447.419	1.436	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)Nc3cccc(S(N)(=O)=O)c3)n[nH]2)cc1C	765302269	WRDYBJVTLLPGDL-UHFFFAOYSA-N	428.474	1.807	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)Nc2cccc(N3C(=O)CNC3=O)c2)n[nH]1	765308835	BTWFLWOVRJWHRO-UHFFFAOYSA-N	449.427	1.608	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1ccnn1Cc1ccc(Br)cc1	766264816	PJZSDEWZYPXOGR-UHFFFAOYSA-N	446.265	1.574	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)[C@@H]1CSCCS1	766659283	ABIRFJJLWFRTRV-INIZCTEOSA-N	429.011	1.454	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)c1cc(COc2ccccc2F)on1	767244642	AZEDADJZNZPLJW-UHFFFAOYSA-N	447.448	1.761	50	20	IDGD	
CNS(=O)(=O)c1cccc(NC(=O)[C@@H](C)NC(=O)[C@H](Br)C(C)(C)C)c1	767977657	BXKLKTUKOYGJBO-MFKMUULPSA-N	434.356	1.848	50	20	IDGD	
O=C(NNC(=O)N1CCC(OCc2ccc(F)cc2)CC1)c1ccc(-n2cnnn2)cc1	768679593	YKGOYAURPWTDNN-UHFFFAOYSA-N	439.451	1.837	50	20	IDGD	
COC(=O)c1cccc(CCNC(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)c1	769003284	DYZUDZGXWFGIDH-UHFFFAOYSA-N	435.506	1.424	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CC(=O)N(Cc2ccccc2Cl)C1)c1ccc2c(c1)OCCO2	770390195	BZCQUULJLQRKIX-OAHLLOKOSA-N	429.860	1.921	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)CCC(=O)c1cc(Br)ccc1OC	771844465	DTQHGHPAKHQBNL-SNVBAGLBSA-N	429.267	1.910	50	20	IDGD	
COc1cccc(/C=C(\C(=O)O[C@H](C)C(=O)NNC(=O)CC(C)C)n2nnnc2C)c1	771922861	PWLLDCZVXYJCLY-VVBXCHJUSA-N	430.465	1.113	50	20	IDGD	
CCOc1ccccc1C(=O)N1CCC[C@@H]1C(=O)O[C@H](C)C(=O)NNC(=O)CC(C)C	771993580	PUXHEKINDHWONK-NVXWUHKLSA-N	433.505	1.815	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNS(=O)(=O)c1c[nH]c(C(=O)N2CCCC2)c1	773267854	XSDPBFVFMBGFQH-GFCCVEGCSA-N	440.909	1.681	50	20	IDGD	
O=C(NNc1c(F)cccc1F)C(=O)Nc1ccccc1OCC(=O)N1CCOCC1	773710164	XPGSRAGPZMHCFA-UHFFFAOYSA-N	434.399	1.284	50	20	IDGD	
COc1ccc(S(=O)(=O)NC2CC2)cc1NC(=O)C(=O)NNc1c(F)cccc1F	773714604	WGXCLIBERDZEDG-UHFFFAOYSA-N	440.428	1.496	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)NC(=O)[C@@H](C)O2	774008467	JBXTZEKAPZUGIG-MNOVXSKESA-N	446.847	1.613	50	20	IDGD	
CC[C@@H](NCC(=O)NNC(=O)c1ccc(C#N)cc1)c1ccccc1OCC(=O)N(C)C	775058382	YXLWIYWYMAWLKQ-LJQANCHMSA-N	437.500	1.527	50	20	IDGD	
COc1ccc(CNC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)nc1	775089959	NGFXGHDFSPRYLN-UHFFFAOYSA-N	433.490	1.019	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)Nc2ccc(C[C@@H]3NC(=O)NC3=O)cc2)c1	775703214	NVHMWINELFENTD-KRWDZBQOSA-N	425.445	1.286	50	20	IDGD	
CN(NC(=O)c1cnn(C)c1C(F)(F)F)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776206502	TZFUENNVRUWJIT-UHFFFAOYSA-N	434.419	1.688	50	20	IDGD	
O=C(Cn1cnc2ccccc21)NNC(=O)[C@@]1(F)CCN(C(=O)OCc2ccccc2)C1	776966940	YVAGLHZPQAGUJK-JOCHJYFZSA-N	439.447	1.935	50	20	IDGD	
CC(C)(C(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1)c1cccnc1	778380330	XJAFBYKICDJYBZ-UHFFFAOYSA-N	429.952	1.978	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)CNS(=O)(=O)c2ccc(Cl)s2)nc1C	778430331	ZXHVQCNEUKQXDU-UHFFFAOYSA-N	433.899	1.098	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)Nc1ccnn1Cc1c(Cl)cccc1Cl	779471815	OMSLYSSOSOHUTE-JTQLQIEISA-N	446.316	1.826	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNS(=O)(=O)c2cccc(C(F)F)c2)ccc1Cl	780366456	LSBSBRUKMDBTQJ-UHFFFAOYSA-N	439.849	1.548	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2ccc(C(=O)NNc3ncncc3Cl)cc2)C[C@H](C)O1	781829544	AVQXASHDDFMUTP-RYUDHWBXSA-N	425.898	1.685	50	20	IDGD	
CCc1ccc(CC)c(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)c1	783264987	VMXLBEDWKCNZRZ-UHFFFAOYSA-N	433.534	1.975	50	20	IDGD	
COC(=O)c1cc(Br)c(F)cc1NC(=O)C(=O)NNc1ccc(C)nn1	783947997	PIQQHFOPMWIDDW-UHFFFAOYSA-N	426.202	1.555	50	20	IDGD	
CCCCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNc2ccc(Cl)nn2)cc1	784792259	KLCGYIQSGBSNGC-UHFFFAOYSA-N	426.886	1.754	50	20	IDGD	
O=C(NNc1ccc(F)c(F)c1F)C(=O)Nc1ccc(F)c(N2CCCS2(=O)=O)c1	784807442	YQBVNWRDYOVTDB-UHFFFAOYSA-N	446.382	1.865	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccncc2)c(OCc2ccccc2)c1	785990350	FCEONRZDFBJMCF-UHFFFAOYSA-N	434.452	1.998	50	20	IDGD	
C[C@@H]1[C@H](C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)CCN1C(=O)OC(C)(C)C	786251495	WRIDASWWDKIGKS-CHWSQXEVSA-N	429.518	1.487	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)[C@@H]1CCc2nccn2C1	787127893	WFLGFWQUVUXBFJ-QGZVFWFLSA-N	430.940	1.064	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)[C@@H]1CCCN(C(=O)CCOc2ccccc2)C1	788178933	UGWBLSOFNLIQBZ-QGZVFWFLSA-N	435.488	1.813	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(F)c(NC(=O)C(=O)NNc2cccc(F)c2[N+](=O)[O-])c1	791000818	QKVKAFTURMIQCB-UHFFFAOYSA-N	443.388	1.205	50	20	IDGD	
O=C(CCNS(=O)(=O)c1cccc(Br)c1)NNc1nc2ccccn2n1	791247877	COYQYBPSNAPFBS-UHFFFAOYSA-N	439.295	1.304	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3ccnn3-c3ccccc3)cc2)CC1	792268051	QVFAROJCVBLEGU-UHFFFAOYSA-N	440.529	1.565	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1	794064588	ONQLDTKICCVGOA-UHFFFAOYSA-N	438.400	1.468	50	20	IDGD	
CC(C)[C@H](NC(=O)NCc1ccccc1)C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	794720319	MTWNCYIJKMWCQP-IBGZPJMESA-N	447.561	1.904	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@H]2CN(C(=O)NNC(=O)c3cc(Br)c[nH]3)C[C@@H]2C1	796505061	PKSCEFXOSQLOAE-PHIMTYICSA-N	442.314	1.930	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)Nc1ccc(S(=O)(=O)N(C)C)cn1	797654113	SXQDDZUZGRXHII-LLVKDONJSA-N	425.442	1.091	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@H]2C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)cc1	798966179	KINPTGPSJKLGRC-INIZCTEOSA-N	449.508	1.155	50	20	IDGD	
O=C(NNC(=O)c1cc(F)cc2nn[nH]c12)c1cccc(S(=O)(=O)N2CCCCC2)c1	800378315	GEYJBSRVHLSNJL-UHFFFAOYSA-N	446.464	1.346	50	20	IDGD	
Cc1nn(-c2ccccn2)c(C)c1C=NNC(=O)Cc1csc(N2CCOCC2)n1	802708820	LGYGZWRDKZNQHU-UHFFFAOYSA-N	425.518	1.870	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NC[C@@H]1CCCS(=O)(=O)C1	804880755	NDJBTSZACYNMFD-NEPJUHHUSA-N	448.339	1.372	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)[C@@H](c1cnn(C)c1)N(C)C(=O)OC(C)(C)C	806365676	SVUDBNWVLXXALS-GOSISDBHSA-N	446.508	1.596	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)C(=O)Nc1nc2c(s1)CSCC2	806974703	RUJDRRQSEJOVIL-UHFFFAOYSA-N	437.459	1.006	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC[C@H]2C)c1	807371421	LDZWVHWFPLODLH-OAHLLOKOSA-N	441.550	1.800	50	20	IDGD	
CN(C)C(=O)CN1[C@H]2CC[C@H]1CC(NC(=O)NNC(=O)Cc1ccc3ccccc3c1)C2	807513178	IXHIZDITBRUIKZ-SFTDATJTSA-N	437.544	1.796	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)NCCn1cc(Br)cn1	807529462	VBMPPQROLDCWNJ-UHFFFAOYSA-N	428.312	1.777	50	20	IDGD	
COC(=O)c1c(F)ccc(NC(=O)C(=O)NNC(=O)c2c(C)nc3ccccn23)c1F	810385480	UTBOJCOHWOCNIG-UHFFFAOYSA-N	431.355	1.107	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)Nc1ncc(C(F)(F)F)s1	812978969	HGYWVVARCWLCEX-UHFFFAOYSA-N	440.201	1.663	50	20	IDGD	
COC(=O)CC[C@@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)Nc1ccc2c(c1)OCO2	813574725	HBSHNOBNPPQJOJ-GFCCVEGCSA-N	438.437	1.415	50	20	IDGD	
CCOC(=O)c1cc(COC)cc(NC(=O)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c1	815564038	VKOXMOAIAUAIFX-UHFFFAOYSA-N	444.400	1.318	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1ccc2c(c1)CCCC2=O	815734752	YAIHZPMJEKWSLQ-UHFFFAOYSA-N	429.498	1.983	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C[C@H](c2nccn2C)C(F)(F)F)c2ccccc2c1=O	816805890	LLBARTUXUNFADV-CYBMUJFWSA-N	436.394	1.647	50	20	IDGD	
CS(=O)(=O)c1cc(C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)c(Cl)cn1	816915730	JOYAOWSLXCKDGR-UHFFFAOYSA-N	444.922	1.336	50	20	IDGD	
CC(C)C[C@@H](C(=O)NNC(=O)COc1ccccc1F)N1C(=O)[C@H]2CC=CC[C@H]2C1=O	864020689	RQHPSVGFFXRUHB-UXLLHSPISA-N	431.464	1.718	50	20	IDGD	
O=S(=O)(c1ccc(N2CC[C@@H](B(O)O)C2)nc1)N1CCC(Cc2ccccc2)CC1	864233950	NNEWTFITMMGFFB-LJQANCHMSA-N	429.351	1.778	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2cccc(NC(=O)[C@H]3CCCO3)c2)n1	907781629	HPBPLCJCZKNZDW-OAHLLOKOSA-N	446.485	1.116	50	20	IDGD	
Cc1cc(C)nc(-n2nc(C)c(CC(=O)NNC(=O)Cn3cnc4ccccc43)c2C)n1	914459472	XUFFQMRWWYFEBK-UHFFFAOYSA-N	432.488	1.636	50	20	IDGD	
COc1ccc2c(c1)C[C@@H](C(=O)OCC(=O)NNC(=O)c1cc(Cl)ccc1OC)CO2	915011717	CMWDSSAJIDEZTJ-CYBMUJFWSA-N	448.859	1.913	50	20	IDGD	
COc1cccc(C[C@H](C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)n2nnnc2C)c1	916091499	SPSRBUBXHLJWAF-QGZVFWFLSA-N	425.405	1.143	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)c2ccc3ccccc3n2)cc1	916104602	JQIVNXYPHQFULH-UHFFFAOYSA-N	434.499	1.108	50	20	IDGD	
CCn1cnc2c1c(=O)n(CC(=O)NN=C(C)c1ccncc1)c(=O)n2Cc1ccccc1	916330798	AVHJOEXUIIAUOU-UHFFFAOYSA-N	445.483	1.363	50	20	IDGD	
O=C(NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)N[C@H]1COc2ccccc2C1	916638795	LXFJLUCYLPWYTO-QGZVFWFLSA-N	444.513	1.419	50	20	IDGD	
CC(C)(C)C(=O)NNC(=O)c1ccc(NC(=O)C[C@@H]2SC(N3CCCC3)=NC2=O)cc1	917181511	NQGYREJCLUHJFO-HNNXBMFYSA-N	445.545	1.916	50	20	IDGD	
CN(CC(=O)NNC(=O)c1ccccc1OCc1ccc(F)cc1)c1ncnc2[nH]cnc12	917906620	CBSVKCFVFKIOKQ-UHFFFAOYSA-N	449.446	1.968	50	20	IDGD	
CN(Cc1ccccc1)C(=O)CNC(=O)NNC(=O)COc1ccc(Br)cc1	918090659	QDUDWYFQGOWXBB-UHFFFAOYSA-N	449.305	1.817	50	20	IDGD	
O=C(COc1ccc(C2SCCCS2)cc1)NNC(=O)N[C@H]1CCS(=O)(=O)C1	919883180	BLZWHVFMJIKRSQ-ZDUSSCGKSA-N	445.588	1.452	50	20	IDGD	
Cc1csc([C@@](O)(CC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)C(F)(F)F)n1	920253408	BIYWQNNULPWPOG-LRDDRELGSA-N	431.392	1.579	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)OC(C)(C)C)CC2)o1	920402039	LNSCTKSPYKGSDQ-UHFFFAOYSA-N	445.494	1.413	50	20	IDGD	
CC(C)(C)c1ccc(NNC(=O)NCC2CCN(S(=O)(=O)C(F)(F)F)CC2)nn1	1251942834	BHGWPTRLEMXZDX-UHFFFAOYSA-N	438.476	1.962	50	20	IDGD	
CN(CCO)S(=O)(=O)c1ccc(C(=O)NNc2ccc(Br)cc2F)cc1	1256497694	ZELONXYAUIJIOS-UHFFFAOYSA-N	446.298	1.958	50	20	IDGD	
COC(=O)c1ccsc1N1CC[C@@H](NC(=O)NNC(=O)c2ccccc2Cl)C1=O	1318877349	QDYNQTFTAIZBJM-CYBMUJFWSA-N	436.877	1.938	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1cnn(-c2ccncc2)c1C	1323457693	OKFQCWKPBYZMTK-UHFFFAOYSA-N	443.847	1.856	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CN2CCN(Cc3cccc4cccnc34)CC2)c1	1333927080	RATFJEDQLNLEJY-UHFFFAOYSA-N	428.496	1.685	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc4cccn4cn3)C2)C1	1778051643	NTYWYNBGUVZXFG-DNVCBOLYSA-N	435.322	1.951	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cn(C)c3ncccc23)C1	1779193428	LZMSEBYVZQXPPW-NJNPRVFISA-N	448.951	1.955	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@]2(C1)CN(C(=O)Cc1cnc3ccccn13)CCO2	1779295094	XPQZQWJIKHOGBA-NRFANRHFSA-N	430.581	1.558	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(-n4cccn4)nc3)C2)C1	1779686990	YDNSWNABEGNVFA-OAQYLSRUSA-N	431.924	1.976	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(Cl)cc4nn[nH]c34)C2)C1	1780224485	NDGLDKRYGKVKDR-FZKQIMNGSA-N	442.303	1.309	50	20	IDGD	
O=C(CCc1ccc(F)nc1)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781325573	FODQDLSJPFHBBL-WBVHZDCISA-N	432.265	1.674	50	20	IDGD	
Cc1ccncc1CCC(=O)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781327260	ZMTXQKZLHKTCOJ-FUHWJXTLSA-N	428.302	1.843	50	20	IDGD	
Cc1cc(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](C)Br)C2)on1	1781997074	BJWIJXJQCYVKCW-DDUZABMNSA-N	428.327	1.823	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](NC(C)=O)C(C)(C)C)C2	1782172489	VUODDAWNKQZCAS-GRXQJBFDSA-N	445.988	1.305	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CNC(=O)C(F)(F)F)C1	1782234420	RDMDEHWVJKZVKU-SJKOYZFVSA-N	441.878	1.444	50	20	IDGD	
Cc1cccn2ncc(C(=O)N3CC[C@@]4(CN(C(=O)CCBr)CCO4)C3)c12	1782519797	SNMGKXTXKBEIFJ-LJQANCHMSA-N	435.322	1.871	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](C)NC(=O)c3ccccn3)C2)C1	1782665880	CCBJYCTXLSHUEW-QYWGDWMGSA-N	436.940	1.437	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](C)n1cccc1C=O)CCO2	1783341077	BELHVBRHBWBGND-ALKREAHSSA-N	440.338	1.865	50	20	IDGD	
CC(C)N1CCC(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](C)Br)C3)C2)CC1	1783530138	SLWWXLIAIYQYTG-DNVCBOLYSA-N	430.387	1.720	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)CCc3ccc4c(c3)OCO4)CCO2)C1	1783876063	LRXLDKAPVADEJT-IERDGZPVSA-N	438.908	1.432	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)/C=C3\C(=O)Nc4ccccc43)CCO2)C1	1783877610	LXHFQQGBUFNJLL-MQWXRXCUSA-N	433.892	1.106	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)CCc3cnc4[nH]ccc4c3)CCO2)C1	1783879179	PHOQGYRLIAYTRF-DYESRHJHSA-N	434.924	1.579	50	20	IDGD	
Cc1noc(N)c1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]2C1	1783968140	QTJFXBCCNFCSME-IXOXFDKPSA-N	429.315	1.190	50	20	IDGD	
Cc1noc(C)c1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]2C1	1783968249	RWZRCMUUUAKQBL-KJEVXHAQSA-N	428.327	1.916	50	20	IDGD	
O=C(/C=C/C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]2C1)c1cccs1	1784090589	IVCLEHJEQNLUJG-WZJKIVPMSA-N	426.922	1.066	50	20	IDGD	
COC(=O)c1ccccc1CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Cl)C[C@@H]21	1784201263	ONVUCDIEZKRWHL-PCODUJHASA-N	440.899	1.920	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)C(=O)c3cccn3C)C2)C1	1784606716	LIPKHMKTSVOBBO-FZKQIMNGSA-N	426.311	1.069	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C34CC(C(F)(F)F)(C3)C4)[C@H]2C1	1784655802	XJDULFMARMASMO-PBPQCTSDSA-N	438.874	1.953	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(C(N)=O)cc3)C2)C1	1784931181	CHEZWDRXAUUSBI-BEFAXECRSA-N	438.322	1.403	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ncc(Cl)cn3)[C@H]2C1	1785821298	GMGOTIKEGDCNLJ-UKJIMTQDSA-N	431.718	1.507	50	20	IDGD	
Cn1cc2cc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)CCBr)[C@H]4C3)ccc2n1	1786407072	DGFUDOSGNISMSW-ZVZYQTTQSA-N	449.349	1.952	50	20	IDGD	
Cn1cccc(C(=O)Nc2ccc(C3(NC(=O)c4cccc(B(O)O)c4)CCC3)cc2)c1=O	1786513194	YMJUXHVPOUSJPK-UHFFFAOYSA-N	445.284	1.127	50	20	IDGD	
C=CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]2C1	1787443730	RSGAMPWDTLFTPT-UVPYHEFZSA-N	447.935	1.970	50	20	IDGD	
O=C(Cc1ccc(O)cn1)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1	1788145332	LXLAFTMFGQAYEG-UHFFFAOYSA-N	445.284	1.457	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)c1ccc2ncnn2c1	1788451500	MZCWCNBYUSXIEC-ABHRYQDASA-N	440.273	1.013	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)Cn3cncn3)[C@H]2C1	1788728016	XJGVMFADNLIMDI-QXKUPLGCSA-N	442.358	1.067	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CCc4nc[nH]c4C3)C[C@@H]21	1788766090	NKAKNXTZIWAVOQ-DRMAHVMPSA-N	434.613	1.346	50	20	IDGD	
CCOC(=O)N[C@@H](O)C(=O)Nc1ccc(C2(NC(=O)[C@@H](C)Br)CCC2)cc1	1789409782	UJEKNMLXSKUUQU-BZNIZROVSA-N	442.310	1.968	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4ncnn4c3)C[C@@H]21	1789868186	QGUDJGADSKFJPI-XMDUPGNXSA-N	440.331	1.559	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CSCC(=O)O)C[C@@H]21	1789873309	UNTNKTDMAPYFIF-CENBSLRLSA-N	427.350	1.020	50	20	IDGD	
COc1ccc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]3C2)cc1	1789922164	FJYIRLWCGQCCTR-MBGYTDRXSA-N	443.313	1.908	50	20	IDGD	
O=C(CCBr)N1CC[C@H]2CO[C@@H](CNC(=O)C3(Br)CC3)[C@H]2C1	1789929808	SLGVARBLPUZYME-SRVKXCTJSA-N	438.160	1.679	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccn4c(C)cc(C)nc34)[C@H]2C1	1790531013	RXJXNLCGAUVYLM-WNHJNPCNSA-N	448.951	1.798	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)N(C)C(C)=O)C[C@@H]21	1790961851	RQDNADPLYQIUMS-YDMUCJKGSA-N	432.359	1.006	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc4ccnn34)C[C@@H]21	1791061576	XAPSNHHMCCLYOO-HPZZRFSDSA-N	435.322	1.711	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4c(c3)CCN4C)C[C@@H]21	1791255003	YQRMCIZWNDZWRE-JPLJXNOCSA-N	435.952	1.526	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4c(c3)CCCO4)C[C@@H]21	1791256446	QRXWIMZUADPNSK-GNBUJSLZSA-N	436.936	1.859	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(F)nc1F	1792372184	WZKACRLBJGSSOW-DYNIEEOBSA-N	432.265	1.594	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CC[C@H](C(F)(F)F)CC1)C2)[C@H](O)CCl	1792983368	JAZMMYZOSULVRP-QAUDVVSPSA-N	426.863	1.544	50	20	IDGD	
CC(C)(C)OC(=O)N1CC=C(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](O)CCl)C1	1793106768	KFKJSZWLQPKYPS-QKPAOTATSA-N	427.929	1.401	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CC(=O)N(C2CCCC2)C1	1793777707	ADBQRSWNIOLGIS-VVRDOHNDSA-N	425.957	1.385	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CCC(=O)NN(C)C)C3)c1	1794066644	XVRZSCGIDGJLBQ-REPLKXPHSA-N	430.549	1.693	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cncc(N(C)C)c1	1794293486	CKKWAZAFOOGKPU-JJAZEVLHSA-N	439.354	1.382	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(-n3cccn3)nc1)C2	1795115677	GCTYSUPZSRZYIF-JLVBRIDZSA-N	448.321	1.256	50	20	IDGD	
COc1ccc(CCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)cc1	1795512121	ZPUIULYQSLCMGD-WKCHPHFGSA-N	436.317	1.260	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc(Br)nc1)C2)[C@H](F)Cl	1796367256	CDZSEPLLCUTNOU-JLUCKKNBSA-N	434.693	1.511	50	20	IDGD	
Cc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)CBr)C3)cc(O)n1	1796373868	UEIYQJDTDLYOAJ-HPAJIGNASA-N	426.311	1.330	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)Nc1nccs1	1796417564	LLRCYASEBMCKHC-QNSTZXKLSA-N	445.383	1.707	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2)C1=NN(c2ccccc2)C(=O)C1	1796482668	MRKWHTBYAHJFGX-DRXBFXEBSA-N	439.299	1.173	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc2nc[nH]c12	1796607286	UHYRQEYEMWEPSQ-CWNKPHDYSA-N	447.499	1.949	50	20	IDGD	
CCc1oncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C(C)=N/NC(=O)c1ccc[nH]1	1796890004	STDKEIVUICUCIF-JWBKOJIWSA-N	426.477	1.623	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1n[nH]c2c1CC[C@H]2C	1796973439	CQXZWQLCDKPIPX-VNUHZKFNSA-N	425.327	1.446	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1cc2cnccc2[nH]1	1797520089	TVKMANXWLOSDCR-BAESOJJISA-N	425.258	1.457	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(C=O)s1)C2	1798439240	RKNIULRQXZZOKR-CLLJXQQHSA-N	427.486	1.125	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Br)c1	1799344947	ZPCVNVNAAXMQDH-DACLVMHWSA-N	443.313	1.962	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](CCO)NC(=O)OC(C)(C)C)C2	1800067683	LWEANJWTBPZFBX-YIDVYQOGSA-N	431.961	1.918	50	20	IDGD	
Cc1ccc(CCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)cc1	1801762364	MIBWJDOCQMPRCV-REPLKXPHSA-N	435.528	1.878	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H]1CC(=O)N(C3CCCC3)C1)C2	1802271160	YOEGDORLVZNRME-AGTSVGGPSA-N	425.957	1.670	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc3sc(N)nc3c1)C2	1802332707	GLFPTAFDUIAUHR-QDMKHBRRSA-N	444.561	1.503	50	20	IDGD	
CCC(=O)N[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@@H]1c1cccnc1	1803434951	YPAXBTBTKZADRO-JMGFVUJMSA-N	443.317	1.693	50	20	IDGD	
C[C@H]1[C@@H](C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](O)CCl)C3)CCN1C(=O)OC(C)(C)C	1804632970	CJJBSWCOZHZTBA-CVWVJMLGSA-N	443.972	1.870	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)c2cccnc2)[C@H]1c1cccnc1	1805465954	YTGBTEALMMHPPJ-OXQOHEQNSA-N	445.483	1.109	50	20	IDGD	
O=C([C@@H](O)CCl)N1CCCC2(CCN(C(=O)[C@H]3ON=C(c4ccccc4)O3)CC2)C1	1805522148	FXPWVCCSFIZPMI-OXJNMPFZSA-N	435.908	1.552	50	20	IDGD	
Cc1cccc(CC(=O)N2CCCC3(CCN(C(=O)CCC(=O)NN(C)C)CC3)C2)n1	1805694924	DQDICAMBEBCNCT-UHFFFAOYSA-N	429.565	1.537	50	20	IDGD	
Cc1occc1C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1807369718	SPMDKWVFNAPJNU-GHTZIAJQSA-N	433.273	1.296	50	20	IDGD	
CN1CCN(C2(C(=O)NC[C@@H]3CCN(C(=O)[C@@H](F)Cl)[C@H]3c3cccnc3)CC2)CC1	1807943417	ZMJNZEFJLIVBKX-OKZBNKHCSA-N	437.947	1.402	50	20	IDGD	
Cc1ccoc1C(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1808502354	WYBHNQGMOAGZQJ-XLIONFOSSA-N	427.505	1.676	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)c2cc(CO)on2)[C@@H]1c1cccnc1	1811590941	CWYVCFXZRKUUKM-GHJWDPDVSA-N	437.294	1.665	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2cccn2C)[C@H]1c1cccnc1	1813069711	ASIBAHQBLTZQTC-UWJYYQICSA-N	426.521	1.113	50	20	IDGD	
CN1N=C(C(=O)N2CC[C@@H](CNC(=O)C(Cl)Cl)[C@H]2c2cccnc2)CCC1=O	1813076685	YSOCSNPKDJJTGT-SWLSCSKDSA-N	426.304	1.499	50	20	IDGD	
Cc1nc2ncccn2c1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](O)CCl)n[nH]1	1814871291	LXVVQYFPBVKABW-KGLIPLIRSA-N	431.884	1.666	50	20	IDGD	
O=C(/C=C/c1cccnc1)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1815959951	HGZHSCDTFDPPNS-HSSRVXSRSA-N	445.288	1.504	50	20	IDGD	
C[C@H](Cn1cccn1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1	1816017349	KWZBHEYZTRUBNE-WBVHZDCISA-N	444.540	1.308	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)[C@@H](O)CCl)[nH]n2)n1	1816086586	OMJDUSJQHTWLKL-GJZGRUSLSA-N	434.884	1.669	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CS(C)(=O)=O)n[nH]1	1817057445	WISQECHDYDTUJR-XHDPSFHLSA-N	425.338	1.683	50	20	IDGD	
C=CCC(F)(F)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1	1817477202	PCWTVETXFGJHRY-INIZCTEOSA-N	432.236	1.607	50	20	IDGD	
C[Si](C)(C)OCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)COc1cccnn1)CC2	1820168671	JKAIJOONECNMOP-GFCCVEGCSA-N	435.582	1.776	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](C)Cn1cncn1)CC2	1825999920	GPGHBMFOADFTJB-SRVKXCTJSA-N	426.930	1.237	50	20	IDGD	
Cc1nscc1C(=O)N[C@@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1	1826080520	PELQZYQHEQVLRR-LLVKDONJSA-N	436.563	1.507	50	20	IDGD	
O=C([C@@H]1CCCS1(=O)=O)N1CCC([C@@H]2CCCCN2C(=O)CCBr)CC1	1826359785	OMVHEDWBZIFEHQ-HOTGVXAUSA-N	449.411	1.968	50	20	IDGD	
C[C@H](C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCC(=O)NN(C)C)CC2)c1ccccn1	1827074186	LHQDQUYIIMUNBZ-KBPBESRZSA-N	444.561	1.627	50	20	IDGD	
Cc1ccnc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)c1	1827757207	FEFOFXZUDPGTOE-QFIPXVFZSA-N	435.333	1.617	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccnc(OC)c3F)C2)C1	1831645628	DWAQCJDBKWOZDQ-MGPUTAFESA-N	443.903	1.707	50	20	IDGD	
Cc1cccnc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1831834832	IPSJNZHYIRTZEW-PBHICJAKSA-N	430.274	1.151	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)C[C@@](C)(O)CC(=O)O)CC1	1831869430	NHWWRXXTVLWLKQ-RZQQEMMASA-N	432.945	1.476	50	20	IDGD	
COc1cc(C(=O)N2CCC([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)ccn1	1831873430	KLNXUFFNUCJIJM-LJQANCHMSA-N	445.564	1.697	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cccc4ccnn34)CC2)CC1)[C@H](O)CCl	1833312034	IXTGEWJNCQVOEW-LJQANCHMSA-N	433.940	1.119	50	20	IDGD	
O=C(c1scnc1C1CC1)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1833732372	XEYOCDVILYCXFO-QGZVFWFLSA-N	434.345	1.894	50	20	IDGD	
C[C@H](Cn1cccn1)C(=O)NC1CCN(C2CCN(C(=O)C(Cl)Cl)CC2)CC1	1833889021	GOAPATMEOZSKCM-CQSZACIVSA-N	430.380	1.895	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)c1cc(O)nc(Cl)c1	1833991443	YKZNWNFZEAZOIF-HNNXBMFYSA-N	445.347	1.226	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)cn1	1833998959	AWEKONXAFWAFRA-OALUTQOASA-N	430.332	1.696	50	20	IDGD	
Cc1ncsc1C(=O)N1CCO[C@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1	1834268400	MTHDOQSJNCABHE-SFHVURJKSA-N	427.599	1.373	50	20	IDGD	
Cc1nnc(CC(=O)NC2CCN(C3CCN(C(=O)[C@H](F)Br)CC3)CC2)o1	1834834719	GQVGLDFSFJOHHP-INIZCTEOSA-N	446.321	1.183	50	20	IDGD	
C[C@H](Nc1cccnc1)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1835695366	FGZIEWBMPDCCEV-UGSOOPFHSA-N	431.320	1.142	50	20	IDGD	
Cc1ccn2c(C(=O)N3CCC(OC4CCN(C(=O)[C@@H](O)CCl)CC4)CC3)cnc2c1	1836719363	QHGPBVLLKUAGES-IBGZPJMESA-N	448.951	1.855	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3c(OC)cccc3OC)C2)C1	1839145841	FMLMHPKMTFMAEW-YCRPNKLZSA-N	440.924	1.791	50	20	IDGD	
CC(C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2	1839150027	AEQFMFOSELQNLT-ROUUACIJSA-N	425.353	1.494	50	20	IDGD	
O=C(c1ccnc2c(O)cccc12)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1839606884	YLHBOJDAPMJSAK-PXNSSMCTSA-N	437.855	1.545	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)ccn1	1840033465	GBZPTRLKLQJHLT-KSSFIOAISA-N	426.311	1.243	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc(C)c(C)c3)C2)C1	1840149834	BEFPCCMMXNHGDH-YLJYHZDGSA-N	425.913	1.022	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(C)c(C)n3)C2)C1	1840151079	VXHUUTXOAIRUOT-UZLBHIALSA-N	425.913	1.022	50	20	IDGD	
CNc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](Cl)COC)CCO3)cc1	1840151937	RWEXATIYOZSAHA-XLIONFOSSA-N	425.913	1.052	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(C)c(O)c3)C2)C1	1840154793	GYSPVMVPPMRDNH-OXQOHEQNSA-N	426.897	1.024	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(OC)c3C)C2)C1	1840155960	GNFVMJIUMRLCOM-UWJYYQICSA-N	440.924	1.327	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)Cc2cc3ccccc3n2C)C1	1841251491	QIQTVJKOBMPQIT-UHFFFAOYSA-N	425.533	1.297	50	20	IDGD	
CC(C)[C@@H](CC(=O)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1)NC(=O)OC(C)(C)C	1841354142	JXLTVFANYPWICB-CABCVRRESA-N	431.961	1.729	50	20	IDGD	
CN(CC(=O)N1CC2(CCCN2C(=O)c2ccco2)C1)NC(=O)NCc1ccccc1	1842368344	FDUXLFVMCZIVOD-UHFFFAOYSA-N	425.489	1.443	50	20	IDGD	
O=C([C@H](O)CCl)N1CC2(CCCN2C(=O)c2cn3c(Br)cccc3n2)C1	1844149435	YLDFQPWIFQCJMT-GFCCVEGCSA-N	441.713	1.514	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H]1CC(=O)N(c2cccc(OC)c2)C1	1847218858	DFXSJEYURXTBRI-VLQPXKRTSA-N	449.935	1.504	50	20	IDGD	
COc1cc(CC(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)cc(OC)c1OC	3453178	NBKLJSCMNFCVJZ-UHFFFAOYSA-N	436.848	1.913	50	20	IDGD	
Cc1cc(NC(=O)CSCC(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)no1	11642425	UFCIRAUWUAMUEK-UHFFFAOYSA-N	440.865	1.313	50	20	IDGD	
O=C(CN1CCN(S(=O)(=O)c2cccc(Cl)c2)CC1)NNC(=O)c1cccs1	15408592	AEIPBNMZAPUVFB-UHFFFAOYSA-N	442.950	1.169	50	20	IDGD	
Cc1cccc(C)c1OCc1nnc(SCC(=O)NNC(=O)c2cccs2)n1N	24216216	KQTLLAUAHOJVHJ-UHFFFAOYSA-N	432.531	1.803	50	20	IDGD	
NS(=O)(=O)c1ccc(CC(=O)NNC(=O)COc2ccccc2-c2ccccc2)cc1	110923708	AFUCKHVZTCAMEO-UHFFFAOYSA-N	439.493	1.770	50	20	IDGD	
O=C(NN=Cc1nccn1CC(F)(F)F)c1cccc(S(=O)(=O)N2CCCC2)c1	727687630	OOBKAWMELWEMJA-UHFFFAOYSA-N	429.424	1.994	50	20	IDGD	
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC[C@@H](C(=O)NN=c2sc3ccccc3n2C)C1	728202859	BQBZECRGAMLFOF-CQSZACIVSA-N	448.574	1.613	50	20	IDGD	
Cc1nc(-c2ccco2)ccc1C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	728341278	BVFREJMNEAEIGD-IBGZPJMESA-N	437.408	1.794	50	20	IDGD	
CCN(CC)C(=O)c1ccc(C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1	729122620	FCSJPZWQLHQKKN-UHFFFAOYSA-N	442.428	1.695	50	20	IDGD	
CC[C@@H](NC(=O)NNC(=O)c1ccc2ccccc2n1)c1cccc(S(N)(=O)=O)c1	729229932	CEIRPEDUVXAPOA-MRXNPFEDSA-N	427.486	1.978	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)NC[C@H]2CN3CCC[C@@H]3CO2)c1	729617608	FFZILNNALSLOGQ-YPMHNXCESA-N	427.299	1.265	50	20	IDGD	
Cc1cc(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)ccc1F	729836155	HQHMIPDNIUCTAF-UHFFFAOYSA-N	441.506	1.542	50	20	IDGD	
CC/C=C(/C)C(=O)N1CSC[C@@H]1C(=O)OCC(=O)NNC(=O)c1ccc(Cl)cc1	730321733	BQJKPZVZHANEDD-KYHFQZCVSA-N	439.921	1.902	50	20	IDGD	
O=C(NNc1nc(-c2ccccc2)no1)c1ccccc1S(=O)(=O)N1CCOCC1	732111740	JLZJCVCXHNCYJA-UHFFFAOYSA-N	429.458	1.514	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N[C@@H](C)C(=O)NCc2ccco2)cc1Br	732244188	DPVAEZRXSNCQJY-JTQLQIEISA-N	439.266	1.700	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)Cc2cn3cc(Cl)cc(Cl)c3n2)C[C@@H](C)O1	732259026	JXPKSUNNUKLBSX-VXGBXAGGSA-N	428.320	1.830	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)[C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)c1	732264458	RWXXUVJQMKKXMI-CQSZACIVSA-N	447.473	1.529	50	20	IDGD	
Cc1ccc(C(=O)NNS(=O)(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c(O)c1	733121853	PNUIJZRJLOHCGY-UHFFFAOYSA-N	439.515	1.108	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)CC[C@H]1NC(=O)N(c2ccc(C#N)cc2)C1=O	733804802	MPXDZKCXNLKKRE-GOSISDBHSA-N	449.467	1.552	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2ccn(-c3ccccc3N)n2)cc1OC	735957253	OBORKXXQOMTWIQ-UHFFFAOYSA-N	439.428	1.090	50	20	IDGD	
COc1ccc(OC)c(-n2nnnc2SCC(=O)NNC(=O)c2cccc(C)c2)c1	742452280	WTZYBBFDDIBEPY-UHFFFAOYSA-N	428.474	1.541	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)[C@H](c1ccccc1F)N1CCOCC1	742476861	KBOWEHVVBYBIDT-QFIPXVFZSA-N	439.491	1.959	50	20	IDGD	
Cc1nc(CNC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)nc2ccccc12	743581308	SOGOKIWXWIYVEM-UHFFFAOYSA-N	428.474	1.878	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)OCc2nc(CS(C)(=O)=O)no2)c(C)n1C[C@@H]1CCCO1	744553005	XVMOMQZQGIZBPF-BDBSJLECSA-N	448.501	1.862	50	20	IDGD	
Cc1c(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)[nH]c2c1C(=O)CCC2	744622254	YMCGSPDIZQRLHV-UHFFFAOYSA-N	432.502	1.620	50	20	IDGD	
O=C(NNC(=O)c1sccc1S(=O)(=O)N1CCC(O)CC1)c1ccccc1F	745475239	BJJQVCUHJDQNHV-UHFFFAOYSA-N	427.479	1.107	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)N[C@@H]1CC(=O)N([C@@H]2C[C@H]2c2ccccc2)C1	746774097	UYCRCXVXMISYFV-CEXWTWQISA-N	432.484	1.364	50	20	IDGD	
CSC[C@H](C(=O)NNC(=O)CCOc1ccccc1)N1C(=O)[C@H]2CCCC[C@@H]2C1=O	747182577	OIVKILGBNZHZRQ-YESZJQIVSA-N	433.530	1.510	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)N[C@H]1CCN(CC(F)(F)F)C1	747310302	IRWQHWANVBZURO-INIZCTEOSA-N	442.486	1.166	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)c1cccc(S(=O)(=O)N2CCc3ccccc32)c1	747322661	JQBLRDOVCATEAR-UHFFFAOYSA-N	436.493	1.837	50	20	IDGD	
C[C@@H](CN1CCCCCC1)C(=O)NNC(=S)Nc1cccc(S(=O)(=O)N(C)C)c1	747725426	MPMUEGICGLIAHO-HNNXBMFYSA-N	441.623	1.767	50	20	IDGD	
CCOc1ccccc1OS(=O)(=O)c1cccc(C(=O)NNc2nccn(C)c2=O)c1	747946133	UKHSBUGGEYSRKC-UHFFFAOYSA-N	444.469	1.704	50	20	IDGD	
COCCOCCNC(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1	747979058	BTHLQCRYBPXAHF-OAQYLSRUSA-N	426.517	1.607	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)c2ccc([C@@]3(C)NC(=O)NC3=O)cc2)cc1	748013344	PKIPUYRSTQRMCU-MCMMXHMISA-N	440.456	1.368	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)N[C@H](C)c1ccc(NC(=O)c2ccncc2)cc1	748628979	BFZBSMBTYXJCJR-HUUCEWRRSA-N	429.477	1.777	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)c1cc(Cl)ccc1I	751202948	YOVULDXKJHMJQD-UHFFFAOYSA-N	447.616	1.729	50	20	IDGD	
CC(C)[C@@H](C(=O)NNC(=O)CNC(=O)c1cccs1)n1nnc(-c2ccccc2)n1	751206926	WQXXXFAYCAPDAO-INIZCTEOSA-N	427.490	1.176	50	20	IDGD	
C[C@H](NC(=S)NNC(=O)C1CCN(C2=NS(=O)(=O)c3ccccc32)CC1)C1CC1	751619713	WQXZPGMUFMSZQE-LBPRGKRZSA-N	435.575	1.141	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)c2cc(I)ccc2-n2cnnn2)o1	752777421	KZEKIXCYPLUVBT-UHFFFAOYSA-N	438.185	1.243	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@H](C)[C@@H](C)NC(=O)OC(C)(C)C	755312375	DMPMXMRWLOZZMI-VXGBXAGGSA-N	441.554	1.598	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2cnn(C)c2)cc1S(=O)(=O)N1CCCCC1	755413548	NIPXQKHKIBRLLD-UHFFFAOYSA-N	436.494	1.070	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)Nc2cccc(-n3nnnc3SC)c2)c1	755732576	YXQXPJQHRTWIDG-UHFFFAOYSA-N	429.462	1.868	50	20	IDGD	
COC(=O)c1cc(NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c(F)cc1F	755851666	GZNQWWXQIKIBOT-UHFFFAOYSA-N	434.403	1.611	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(F)c(NC(=O)NNC(=O)c2ccc(Cl)cc2O)c1	756682523	HTGSVMIWJHQUPM-UHFFFAOYSA-N	430.845	1.902	50	20	IDGD	
C[C@@](O)(CN1Cc2ccccc2C1=O)C(=O)NNC(=O)CSc1ccc(Cl)cc1	756797617	QOBZLOWOMMXYEU-HXUWFJFHSA-N	433.917	1.987	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N=c2cc[nH]cc2Br)c2ccccc2c1=O	757806784	VSJBKQZJVWVYSC-UHFFFAOYSA-N	431.250	1.462	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccnc(OCC(F)F)c2)c1	758055386	OFAYHMCCYDQZIJ-UHFFFAOYSA-N	428.417	1.051	50	20	IDGD	
O=C(NNC(=O)C(=O)Nc1ccccn1)N[C@H]1CCN(c2ccccc2Br)C1	758766800	PQORYTXCFAJBGL-LBPRGKRZSA-N	447.293	1.392	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H](C#N)[C@H](NC(=O)NNC(=O)COc2ccccc2C#N)C1	758775077	VRVIURCPHLDQJA-LSDHHAIUSA-N	428.449	1.027	50	20	IDGD	
C[C@H](NC(=O)OC(C)(C)C)[C@H]1CCCN(CC(=O)NNC(=O)c2cccc(C#N)c2)C1	758791714	JBRXWAVOJHYCAQ-YJBOKZPZSA-N	429.521	1.944	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)COc1ccc(Br)cc1)CC1(C)OCCO1	758851202	DLCQEOFNMBZWBA-LBPRGKRZSA-N	430.299	1.948	50	20	IDGD	
O=C(NC[C@@H](O)c1ccc(Cl)c(F)c1)NNC(=O)c1csc(N2CCOCC2)n1	762530526	YQMLGGRXJVRNIO-CQSZACIVSA-N	443.888	1.450	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)CCCCN3CCOCC3)n[nH]2)cc1OC	763147289	GHGXXNGIBAUJFJ-UHFFFAOYSA-N	431.493	1.357	50	20	IDGD	
CN(CC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)[C@H]1CCSC1	763385976	KHMGPKHLSNTCGM-INIZCTEOSA-N	440.591	1.060	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)cn2)C[C@H](C)O1	763442113	LIORQZRJKOUVLY-STQMWFEESA-N	442.432	1.003	50	20	IDGD	
O=C(NNC(=O)c1c[nH]c2ccccc12)C(=O)Nc1ccc(CN2C(=O)CCCC2=O)cc1	763536987	ZATJSDRJKYRXOF-UHFFFAOYSA-N	447.451	1.607	50	20	IDGD	
Cc1c(Br)cccc1NC(=O)C(=O)NNC(=O)[C@@H]1COc2ccccc2O1	763569769	BNEDZTBNVJJQCD-HNNXBMFYSA-N	434.246	1.683	50	20	IDGD	
CCN(CC)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2OC)cc1	763658030	UBYFOVXBLAFARL-UHFFFAOYSA-N	442.472	1.342	50	20	IDGD	
COC(=O)[C@@H](C)Cc1ccc(NC(=O)C(=O)NNC(=O)COc2cc(C)ccc2C)cc1	763668931	SXCCMKHFZNVOHB-INIZCTEOSA-N	441.484	1.820	50	20	IDGD	
COC(=O)c1c(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)sc(C)c1C	763681349	KJFLDRSJXUKTCE-UHFFFAOYSA-N	430.442	1.188	50	20	IDGD	
COC(=O)c1cc(Cl)ccc1NC(=O)C(=O)NNC(=O)COc1ccc(Cl)cc1	763693969	CXKFEHOVFFQAEY-UHFFFAOYSA-N	440.239	1.945	50	20	IDGD	
Cc1cn(-c2ccc(C#N)cn2)nc1NC(=O)C(=O)NNC(=O)C12CC3CC(CC(C3)C1)C2	763729415	YWFVRODYOHGKDT-UHFFFAOYSA-N	447.499	1.750	50	20	IDGD	
C[C@@H](c1ccc(NC(=O)C(=O)NNC(=O)Cc2ccc(F)cc2)cc1)N1CCOCC1	763919808	YTGKQWMFTMUAPB-HNNXBMFYSA-N	428.464	1.548	50	20	IDGD	
C[S@](=O)c1cccc(NC(=O)C(=O)NNC(=O)c2ccc(Br)s2)c1	763940461	HLFUJXOBDVQGAH-DEOSSOPVSA-N	430.305	1.648	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)C(=O)Nc1ccc(SC(F)F)nc1	763995100	MNWMFBNJWPYBTH-UHFFFAOYSA-N	434.222	1.887	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)c(F)cc1F	763996229	XKHQGKVMIMZEPX-UHFFFAOYSA-N	445.176	1.242	50	20	IDGD	
O=C(NNC(=O)c1cccc(C(F)(F)F)c1)C(=O)Nc1ccccc1Cn1cncn1	764036887	CNRGRLBQMWAAPC-UHFFFAOYSA-N	432.362	1.745	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1cccc(CN2C[C@@H](C)O[C@H](C)C2)c1	764042321	GEYBDZHGWRIUNS-HZPDHXFCSA-N	440.500	1.704	50	20	IDGD	
Cc1cc(N2CCCS2(=O)=O)ccc1C(=O)NNC(=O)CSc1ccccc1O	764048727	FARHTDJKUWRICR-UHFFFAOYSA-N	435.527	1.794	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)CSc2ccccc2O)cc(S(=O)(=O)N(C)C)c1C	764051158	UVMCUPJHESMRDK-UHFFFAOYSA-N	437.543	1.813	50	20	IDGD	
C=CCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(C)cc3)[nH]n2)cc1	764110985	NSMBFWYCFXXKFU-UHFFFAOYSA-N	446.467	1.701	50	20	IDGD	
CS(=O)(=O)CCOc1cccc(NC(=O)C(=O)NNC(=O)CCC2CCCCC2)c1	764214648	ASKODBLXWCGBKZ-UHFFFAOYSA-N	439.534	1.556	50	20	IDGD	
N#Cc1cccc(-c2csc(NC(=O)C(=O)NNC(=O)COc3ccccc3O)n2)c1	764278090	QRRXENMKGZNJHV-UHFFFAOYSA-N	437.437	1.552	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cnn(CC(C)C)c2)cc1Br	764326771	NTTFSLYZHBDWQN-UHFFFAOYSA-N	438.282	1.710	50	20	IDGD	
COc1ccc(COCc2cccc(NC(=O)C(=O)NNC(=O)c3cnn(C)c3)c2)cc1	764358448	DRKASHQDLCHXMD-UHFFFAOYSA-N	437.456	1.545	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)N2CCC[C@@H](S(C)(=O)=O)C2)N(C)c2ccccc21	764431278	AQPFLHCPJXSZFI-OAHLLOKOSA-N	430.530	1.693	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)c1ccc(CN2CCC(CO)CC2)cc1	764589123	ORTSKBLCEJKAHC-OAQYLSRUSA-N	425.485	1.492	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2cnn(-c3ccccn3)c2C)cc(OC)c1OC	765024571	GCSLIYUKEFHWSM-UHFFFAOYSA-N	447.473	1.225	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNS(=O)(=O)c3cccc(F)c3F)CC2)cc1	765126096	HYTGORPCXVESJV-UHFFFAOYSA-N	438.500	1.401	50	20	IDGD	
Cc1nnnn1/C(=C\c1ccc(F)cc1)C(=O)NNC(=O)CSc1ccccc1O	765249714	OSWTWAWXWCRIOH-GDNBJRDFSA-N	428.449	1.764	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)Nc1ccc([N+](=O)[O-])cc1	765312698	KIYRIYKWWFTETD-UHFFFAOYSA-N	426.433	1.206	50	20	IDGD	
CCN(CC)CCn1ccc2cc(NC(=O)C(=O)NNc3nccnc3OC)ccc21	766264863	QQLHDFQEVGJTFT-UHFFFAOYSA-N	425.493	1.864	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2csc(S(C)(=O)=O)c2)cc1Br	766452682	CWQIIPDWOQMMIS-UHFFFAOYSA-N	433.305	1.998	50	20	IDGD	
Cc1ccn2ncc(C(=O)NNc3ccc(S(=O)(=O)N4CCN(C)CC4)cc3)c2c1	766850920	SVPPBFMFSXNZNV-UHFFFAOYSA-N	428.518	1.336	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)NCCCCN1C(=O)c2ccccc2C1=O	766988801	AVNSPGZVZJUFLO-UHFFFAOYSA-N	430.486	1.793	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)CNC(=O)Cc1cccc2ccccc12	767261583	CZTMLDMAXJDDHF-UHFFFAOYSA-N	447.491	1.740	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cnn(C(F)F)c2)cc1OC	768236417	BZBPILMYXFIAMC-UHFFFAOYSA-N	425.392	1.865	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)ccc1OC(C)C	768239326	JZQHKRXGZLVKOV-UHFFFAOYSA-N	439.266	1.973	50	20	IDGD	
Cn1cnc(CNC(=O)NNc2ccc(S(=O)(=O)NC3CCCCCCC3)cn2)n1	768992848	QGAUYNFYNBBBBU-UHFFFAOYSA-N	436.542	1.428	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)[C@H]2CCN(C(=O)OCc3ccccc3)C2)C[C@@H](C)O1	770110954	QEMVSLUCUUHZAO-SCTDSRPQSA-N	432.521	1.292	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)NCC1(NS(C)(=O)=O)CCCCC1	770128803	UEGSAVVOBLPHFQ-ZDUSSCGKSA-N	446.957	1.690	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)NCCNC(=O)c3ccccc3F)nc21	770356206	QSQPYNAAHHNBEQ-UHFFFAOYSA-N	430.444	1.482	50	20	IDGD	
C[C@@H]1CCCC[C@]12NC(=O)N(CC(=O)NNc1nc(O)c3cnn(C(C)(C)C)c3n1)C2=O	770958075	HMLSLBVHVMKEFX-GIPWTMENSA-N	444.496	1.231	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)CCSCc3nc(O)c4ccccc4n3)nc21	770979762	JBBMSYCWUUAUNU-UHFFFAOYSA-N	426.462	1.484	50	20	IDGD	
CCCCNC(=O)NNC(=O)CN1C(=O)N[C@](C)(c2ccc(Br)cc2)C1=O	771250658	LNTRZWHEODAZAR-QGZVFWFLSA-N	440.298	1.347	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)c(C)c1	771605153	PWBXZPLJLALVQD-UHFFFAOYSA-N	425.894	1.673	50	20	IDGD	
COCCCNC(=O)NNC(=O)c1c[nH]c2ccc(I)cc2c1=O	772627851	ZPOTYBAWDFRJTL-UHFFFAOYSA-N	444.229	1.113	50	20	IDGD	
CC(C)(C)c1sc(C(=O)O)cc1S(=O)(=O)NNC(=O)CNC(=O)c1ccco1	773248879	GZQGKDPIVBWYTI-UHFFFAOYSA-N	429.476	1.076	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CC(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1)c1ccccc1	773263739	ZTLGHNMCYSFGEM-GJZGRUSLSA-N	425.507	1.225	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2ccccc2OCc2ccc(F)cc2)nn1C	773494195	PPCLSQCZVFHHMA-UHFFFAOYSA-N	441.419	1.547	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(NC(=O)[C@@H]3CCCO3)cc2)cc1F	773890652	YIBIRLZRBJEGAF-KRWDZBQOSA-N	428.420	1.651	50	20	IDGD	
C[C@@H](NCC(=O)NNC(=O)c1ccc(C#N)cc1)c1ccc(OCC(=O)NC2CC2)cc1	774968599	VSBRYODYRTUTTN-OAHLLOKOSA-N	435.484	1.327	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)N[C@@H]2CCO[C@@]3(CCS(=O)(=O)C3)C2)cc1	776075737	DIWCYGJMHUCRQA-KDOFPFPSSA-N	427.548	1.154	50	20	IDGD	
CC(=O)c1cc(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)c(C)nc1C	777160752	GIDFJYZADYZJPC-UHFFFAOYSA-N	432.502	1.679	50	20	IDGD	
COCCO[C@H]1COCC[C@H]1NC(=O)NNC(=O)c1cc(OC)ccc1Br	777280337	ZMAWPRQNTPUXRT-CABCVRRESA-N	446.298	1.222	50	20	IDGD	
O=C(NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1)c1cnc2[nH]nnc2c1	777791080	DXMODZWNJFNODY-UHFFFAOYSA-N	443.470	1.290	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)CCC(=O)N3CCOC)cc1	778708054	TWLZSOFUZMIIGP-UHFFFAOYSA-N	438.484	1.574	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)c2ccc(C)c(S(=O)(=O)N3CCOCC3)c2)c1	780800286	FNMQKPLVFPPOIZ-UHFFFAOYSA-N	433.486	1.559	50	20	IDGD	
CC(=O)N1CCN(Cc2ccccc2NC(=O)NNC(=O)COc2ccc(C)cc2)CC1	782079289	XQBHYXIRCYCLFX-UHFFFAOYSA-N	439.516	1.891	50	20	IDGD	
Cc1ccc(Sc2ccc(NC(=O)C(=O)NNC(=O)C(=O)NC3CC3)cc2)c(C)c1	782965823	JIAQQKPCSZFKDI-UHFFFAOYSA-N	426.498	1.819	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)N2C[C@H](CC(=O)N(C)C)c3cc(Cl)ccc32)nc(C)n1	783324915	SDQUXGGFNJHLIC-ZDUSSCGKSA-N	430.896	1.799	50	20	IDGD	
O=C(NNc1ccc(F)cc1F)C(=O)N1C[C@@H](C(=O)N2CCOCC2)Oc2ccccc21	783347796	YJOZZLXTULXJRA-SFHVURJKSA-N	446.410	1.061	50	20	IDGD	
Cc1ccc(NNC(=O)C(=O)Nc2ccc(CC(=O)N3CCc4ccccc43)cc2)nn1	783951580	IKMHRVHNGCKKFB-UHFFFAOYSA-N	430.468	1.999	50	20	IDGD	
NC(=O)CCOc1ccccc1NC(=O)C(=O)NNc1nc(-c2ccc(Cl)cc2)no1	784800079	RDXZHXIATCUCQT-UHFFFAOYSA-N	444.835	1.726	50	20	IDGD	
CN1CCN(CCOc2ccc(NC(=O)C(=O)NNc3ccc(Cl)nc3)cc2)CC1	784869829	NZNSJLNIQXGVCV-UHFFFAOYSA-N	432.912	1.443	50	20	IDGD	
Cc1ccc(Br)c(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)c1	785068134	UQNBFENCRPLPTJ-UHFFFAOYSA-N	430.262	1.734	50	20	IDGD	
CCc1cc(Br)ccc1NNC(=O)C(=O)Nc1cnc(OC)c(C(N)=O)c1	785098574	BKSAGWJEQYNRSC-UHFFFAOYSA-N	436.266	1.596	50	20	IDGD	
CCCc1c(NC(=O)C(=O)NNC(=O)c2ccccc2O)cnn1-c1cccc(C#N)c1	785989377	SRSDXLCEASPQAG-UHFFFAOYSA-N	432.440	1.802	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)c1nn(-c2cccc(F)c2)cc1O	786048265	DKRMJHXWDJNIFX-UHFFFAOYSA-N	431.449	1.915	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCc2nccn2C1)c1cccc(S(=O)(=O)N2CCCCC2)c1	786686589	DNGFQEWDODPXBF-INIZCTEOSA-N	431.518	1.081	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)N[C@H](COC)[C@@H]2CCCO2)c2ccccc2c1=O	789333616	BWGUBWPINDTBHV-MSOLQXFVSA-N	445.520	1.725	50	20	IDGD	
CCn1cnc2c1c(=O)n(CC(=O)NN=C(C)c1cc(C)on1)c(=O)n2Cc1ccccc1	790289539	KGTSXYOJYRMEAY-UHFFFAOYSA-N	449.471	1.265	50	20	IDGD	
CC(C)CCn1nc(C(=O)NNC(=O)C(=O)Nc2cccc(F)n2)c2ccccc2c1=O	793022245	RRIVJBRSRWCUBM-UHFFFAOYSA-N	440.435	1.376	50	20	IDGD	
CC(C)(C)c1cc(NC(=O)C(=O)NNC(=O)c2ccncc2)n(-c2ccc(C#N)cc2)n1	793023066	GZBKVIFZLNASRA-UHFFFAOYSA-N	431.456	1.836	50	20	IDGD	
CC(C)n1nnnc1-c1ccccc1NC(=O)C(=O)NNc1ccc2c(=O)[nH]ccc2c1	793070916	VOBYXJTYHCKFND-UHFFFAOYSA-N	432.444	1.844	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNS(=O)(=O)c1ccccc1S(=O)(=O)C(F)F	794587966	SRTICVNENAYEFB-UHFFFAOYSA-N	443.453	1.647	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNS(=O)(=O)c1cc(C(=O)O)cc2c1CCC2	794598208	CMMIFJHUXXWXOD-UHFFFAOYSA-N	447.469	1.109	50	20	IDGD	
CNS(=O)(=O)N1CCC(C(=O)NNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1	794759357	YMKLZONPMUPELM-UHFFFAOYSA-N	425.389	1.233	50	20	IDGD	
CC(=O)N[C@@](C)(C(=O)NNC(=O)C(C)(C)c1ccccc1)c1ccc(S(C)(=O)=O)cc1	797449509	LWFWBSLHPFIFEN-JOCHJYFZSA-N	445.541	1.567	50	20	IDGD	
O=C(NCc1c(F)cc(F)c(F)c1F)NNC(=O)C1CCN(c2ncccn2)CC1	797521342	RTIHXXDTMUAJHB-UHFFFAOYSA-N	426.374	1.780	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)[C@@H]2CC(C(=O)OC(C)(C)C)=NO2)c2ccccc2c1=O	798272769	FVCFNBGXVLSEHQ-HNNXBMFYSA-N	443.460	1.054	50	20	IDGD	
O=C(NNc1nc2ccccn2n1)Nc1cnc(N2CCOCC2)c(Br)c1	799248724	APFJKHDUPANWRS-UHFFFAOYSA-N	433.270	1.872	50	20	IDGD	
COc1nccc(NC(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)n1	801727235	QFQIKXHTCYNDGK-UHFFFAOYSA-N	445.443	1.654	50	20	IDGD	
CCN(CC)CC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2cc(C)oc2C)c1	806973826	XELWYDNAJUSAOA-UHFFFAOYSA-N	429.477	1.576	50	20	IDGD	
Cc1c(C(F)(F)F)nn(C)c1NC(=O)C(=O)NNC(=O)C1=S=C2CC[C@@H](C)CC2=C1	806975992	YBYBICLJIOMHMS-MRVPVSSYSA-N	443.451	1.671	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)[C@@H](Cc1cnc[nH]1)NC(=O)CC(C)C	811102758	CRVBMAKEIYYUKQ-CQSZACIVSA-N	437.522	1.039	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)Cc2ccc(S(=O)(=O)C(F)F)cc2)cc1	812732725	RHLYLILRJAUUBA-UHFFFAOYSA-N	447.485	1.619	50	20	IDGD	
COc1ccc([C@@H](O)C2CCN(CC(=O)NNC(=O)Cc3nc(C)cs3)CC2)cc1	812858839	CYBUVADYBRLTBE-OAQYLSRUSA-N	432.546	1.596	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2cc(C3(C)CCCC3)on2)cc1	813033026	ARZPCMJVAPETME-UHFFFAOYSA-N	435.506	1.838	50	20	IDGD	
C#CCOc1cc(F)ccc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	813033060	CCTVHMTUGUOFBC-UHFFFAOYSA-N	434.449	1.170	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2nc(C(F)(F)F)cs2)cc1	813033377	QMEYKZFZKZMXEH-UHFFFAOYSA-N	437.425	1.494	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)Cc2ccc(C(=O)NN=Cc3cnn(C)n3)cc2)cc1	814701883	IIYBNNRNEXAATQ-UHFFFAOYSA-N	426.502	1.708	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)c2cnn(C)c2I)c1	814727194	RKCFZESYLSJVPS-UHFFFAOYSA-N	430.202	1.117	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1ccc([C@@H]2CCOC2)cc1	815613345	LAFHFLSMRGONGT-CQSZACIVSA-N	433.486	1.684	50	20	IDGD	
O=C(CN1C(=O)[C@H]2CC=CC[C@H]2C1=O)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1	815853936	IAMDYHHBBHVKTQ-BETUJISGSA-N	431.392	1.374	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)C[C@H](c2ccccc2)c2ncc[nH]2)c1	816810718	XMPYQJOJGITYMV-GOSISDBHSA-N	441.513	1.643	50	20	IDGD	
CCC[C@H](C(=O)NNC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1)S(N)(=O)=O	816828556	IWANEGMYPUYQQT-MRXNPFEDSA-N	442.501	1.153	50	20	IDGD	
O=C(NNc1ncncc1F)c1cc(S(=O)(=O)NC2CC2)ccc1Br	817079734	YTKAHXFVMQHBOI-UHFFFAOYSA-N	430.259	1.576	50	20	IDGD	
CC(C)[C@H](NS(=O)(=O)c1ccc(Br)cc1)C(=O)NNC(=O)CC1CC1	819109945	QKBNTRDWFCWCFZ-HNNXBMFYSA-N	432.340	1.700	50	20	IDGD	
O=C(CCCC[C@@H]1SC[C@H]2NC(=O)N[C@H]21)NNC(=S)NCCc1cccs1	819427714	RCVAUUGPFDTKBG-VNHYZAJKSA-N	427.621	1.512	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)NCCC(=O)NN=c2sc3ccccc3n2C)cc1	855556520	ZIMFQIBZFKSJDH-UHFFFAOYSA-N	447.542	1.499	50	20	IDGD	
Cc1ccc(NC(=O)COC(=O)/C(C#N)=C/c2cc(C#N)n(C)c2C)cc1S(N)(=O)=O	913287092	SPUZBPIWIJSZRT-GIDUJCDVSA-N	441.469	1.250	50	20	IDGD	
CN(C)N(C(=O)[C@H]1CC(=O)N(c2ccccc2Br)C1)[C@@H]1CCS(=O)(=O)C1	914438452	YYOZHMLKSNYNNU-QWHCGFSZSA-N	444.351	1.294	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1sccc1-n1cnnn1	915395286	ZQSOJWOAZRACQE-UHFFFAOYSA-N	436.837	1.004	50	20	IDGD	
CCS(=O)(=O)N(C)CCCNC(=O)/C(C#N)=C/c1cc(C)n(C[C@@H]2CCCO2)c1C	915729563	OXKYAEPCNDWRBZ-ACSPXDACSA-N	436.578	1.979	50	20	IDGD	
O=C(NCc1cn2ccsc2n1)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	916217922	FBCMDMYQVQUBFF-UHFFFAOYSA-N	448.530	1.325	50	20	IDGD	
COc1ncccc1CNC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	916399425	YSCLVWYZUAXYMI-UHFFFAOYSA-N	433.490	1.019	50	20	IDGD	
CCOc1ccc(C(=O)NNS(=O)(=O)c2cc3c(cc2F)NC(=O)CC3)cc1OC	917728193	YJQBPAOOWIXHJV-UHFFFAOYSA-N	437.449	1.741	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)c1cccc([N+](=O)[O-])c1	918217649	LKSJFXLGUUTUCU-LBPRGKRZSA-N	435.462	1.550	50	20	IDGD	
Cc1ccc([C@]2(C)NC(=O)N(CC(=O)NNC(=O)c3ccc(Cl)cc3O)C2=O)cc1	918358009	SURPVRUQCSXWFT-FQEVSTJZSA-N	430.848	1.582	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)CCOc2ccccc2[N+](=O)[O-])c1	918678776	OXYYVLCUOPORHB-UHFFFAOYSA-N	436.446	1.075	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)NCc1cccc(NC(=O)[C@H]2CCCO2)c1	920236990	GQDCHYPGGRKYJG-GOSISDBHSA-N	430.436	1.853	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@@H]2C(=O)NNC(=O)c2cncn2-c2ccccc2)cc1	1116900959	UDNXBHDFKRQFRQ-LJQANCHMSA-N	433.468	1.947	50	20	IDGD	
C[C@@H](NC(=O)c1ccc(Br)s1)C(=O)NNC(=O)c1n[nH]c2c1CCCC2	1317890089	RHQJFDMQZQQJBH-MRVPVSSYSA-N	440.323	1.692	50	20	IDGD	
COc1ccc(S(=O)(=O)CCC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1	1328049650	DDEMMZZVEDOHMI-UHFFFAOYSA-N	428.470	1.506	50	20	IDGD	
Cn1ccc(NNC(=O)CCc2nc3cc(S(=O)(=O)N4CCCCC4)ccc3n2C)n1	1339439302	XDCJIYPSQLFRSV-UHFFFAOYSA-N	445.549	1.557	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCN2CCOC2=O)C1	1778775693	DDHHQAKKNWWQBQ-JXXFODFXSA-N	429.945	1.750	50	20	IDGD	
CC(C)CNC(=O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CO[Si](C)(C)C)C1	1779543886	SJRQWPWDPULNKZ-OXQOHEQNSA-N	427.618	1.124	50	20	IDGD	
COc1cc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)cc(Cl)n1	1779796562	POEHTFLSVYCLNX-GTNSWQLSSA-N	446.729	1.971	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnn(C)c3Cl)C2)C1	1779857215	ZGHXRMORZSGXIT-BDJLRTHQSA-N	433.734	1.548	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](COC)NC(=O)OC(C)(C)C)CCO2	1781217091	FFTSEKQPBZAUFL-BXTJHSDWSA-N	447.960	1.373	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)C3=NN(c4ccccc4)C(=O)C3)CCO2)C1	1781218509	NRJZRKQBVKIJAE-HRAATJIYSA-N	432.908	1.627	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)c3nc(O)n4c3CCCC4)CCO2)C1	1781230505	TXFFINDZXUDTMR-MOPGFXCFSA-N	445.347	1.605	50	20	IDGD	
CCOc1cccc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](F)Br)C3)C2)c1O	1781334059	UULAZENRRZNUPW-MAUKXSAKSA-N	445.285	1.925	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnc3c(c2)CCNCC3)C1	1781526311	DJIGUVNPSWBDJK-KKLQWCBXSA-N	448.995	1.915	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1	1782009593	WZTYHYYYHYLGPQ-QGHHPUGFSA-N	447.713	1.978	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1nnsc1C1CC1)C2	1782173096	WXCPGNIEASEWGP-PJIJBLCYSA-N	442.969	1.797	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccnc(OC)c1)C2	1782175363	JKTVHOKBWIRJIF-JXXFODFXSA-N	425.913	1.472	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4nn[nH]c4c3)C2)C1	1782581497	PWVUYQQLMYPOTN-KZULUSFZSA-N	436.310	1.432	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3nc(C)c(C)[nH]c3=O)CCO2)C1	1783344938	UPRPRVLENXKWSZ-SCLBCKFNSA-N	441.326	1.004	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cnc(C(F)(F)F)cn3)CCO2)C1	1783874216	ANBQROXGKIFMCK-ZBEGNZNMSA-N	436.818	1.193	50	20	IDGD	
CN(C)C(=O)c1cccc(C(=O)N2CCO[C@]3(CCN(C(=O)C(Cl)Cl)C3)C2)c1	1783952897	WPHBVOAYOHPQNC-IBGZPJMESA-N	428.316	1.636	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C[C@H]3CCCCO3)C[C@@H]21	1783969405	MAEKSFZAXOHBHL-ALYAQQCSSA-N	431.371	1.956	50	20	IDGD	
Cc1nccn1CCCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](C)CBr)CCO2	1784405833	GJJQSQMYBOLJPE-DNVCBOLYSA-N	441.370	1.833	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c(Cl)c1	1785039069	DXCDQFOHGBHQTG-NRFANRHFSA-N	436.940	1.465	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](CN)c3ccccc3)[C@H]2C1	1786924609	MDYQCWUGZGTFSF-HILJTLORSA-N	438.366	1.492	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C=C/c3cccs3)[C@H]2C1	1787001391	DQHQWJPVEBTFHO-BPVMCAHGSA-N	434.562	1.114	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)c1[nH]nc2ccncc12	1787341582	VYKNSYGLYXBDNK-PBLBJHRBSA-N	440.273	1.242	50	20	IDGD	
C[C@H](C(=O)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1)N1C[C@H]2C[C@@H]2C1	1788142180	IWWXFCYVKXRKHY-BHIYHBOVSA-N	447.344	1.454	50	20	IDGD	
COc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Br)C[C@@H]32)cc1	1789592986	KYUZMCJDTKRJIY-TUUVXOQKSA-N	429.286	1.979	50	20	IDGD	
CC(=O)NCC(C)(C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]2C1	1789867781	JMWBLVDZZCWETP-XLPNERPQSA-N	436.380	1.365	50	20	IDGD	
Cc1cccc(C)c1NC(=O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21	1789874852	CYRLNNJOBXHWTL-JKQORVJESA-N	425.888	1.756	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3noc4c3CCCC4)C[C@@H]21)[C@@H](F)Br	1789922208	ANXPFUQJPZTGKR-YLUJIRGKSA-N	444.301	1.837	50	20	IDGD	
O=C(Cn1cccc([N+](=O)[O-])c1=O)Nc1ccc(C2(NC(=O)[C@H](O)CCl)CCC2)cc1	1791111215	NTMXNPFYRQLQMW-MRXNPFEDSA-N	448.863	1.490	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(=O)c3ccc(Cl)cc3)C[C@@H]21	1791250040	XGZDZXQCTSGFGR-LLLHUVSDSA-N	443.327	1.756	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1ccc(C2(NC(=O)CCc3cnc[nH]3)CCC2)cc1	1791600023	VUEAOJDLGJKDOS-UHFFFAOYSA-N	426.521	1.849	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2)c1ncn(-c2cccc(F)c2)n1	1794286032	DIYSZMTWDBRULQ-JLUCKKNBSA-N	425.823	1.144	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1CCN(c3ccc(F)cn3)CC1)C2)[C@@H](F)Cl	1796370609	NJJIEDPRPQMVCZ-LTCOOKNTSA-N	442.894	1.561	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1c(C)noc1C)C2	1796889943	PHLHSBFNGYRBTF-VFMVUTOHSA-N	426.477	1.677	50	20	IDGD	
COc1ccnc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)c1	1796891716	HIQIEGZZCULMDK-MVRRYPJTSA-N	438.488	1.476	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1(C(F)(F)F)CC1	1797270311	YGPXHDLCXDZHGH-YFKTTZPYSA-N	427.261	1.950	50	20	IDGD	
CC[C@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(CS(C)(=O)=O)nc1)C2	1800070621	OVWQJFOIHICDFB-YVSFHVDLSA-N	427.954	1.895	50	20	IDGD	
CCC(=O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](Br)Cc1ccccc1	1800437230	SKRMADFTJGGABJ-DFGXFYAUSA-N	437.334	1.561	50	20	IDGD	
COc1cccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)Br)C3)c1C	1800822449	CZORJUFPYDVOCA-AMVTXUCVSA-N	439.350	1.919	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1ON=C(c3ccccc3)O1)C2)C(Cl)Cl	1801017165	URUCGEAZGVRRJY-YFQWEKLQSA-N	428.272	1.114	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CCCOC1	1802074650	AGNPPXNMAZFYHU-SQJQVPFXSA-N	445.466	1.888	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)Cc2cnc3ccccn23)[C@H]1c1cccnc1)[C@@H](O)CCl	1803137771	RNBNUKWQRXKGIP-MDKPJZGXSA-N	441.919	1.578	50	20	IDGD	
COc1nccc(C(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)c1F	1803139085	SLEPOVSRXLVVOO-UKPHBRMFSA-N	436.871	1.544	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H]2CNc3ccccc32)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803139229	VLBCDUXUFLQQFE-MFHCWRBVSA-N	428.920	1.896	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc3nncn3c2)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803142849	KWDLOQYUUWYPRL-QILLFSRXSA-N	428.880	1.044	50	20	IDGD	
Cc1cccc(CC(=O)N2CCCC3(CCN(C(=O)c4cccc(B(O)O)c4)CC3)C2)n1	1805688770	AKYPHBHBIMKGRW-UHFFFAOYSA-N	435.333	1.157	50	20	IDGD	
C=CCO[C@H](C)C(=O)N1CCCC2(CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CC2)C1	1806026422	RLFVOLGYIRLHND-UPMNJHNBSA-N	443.548	1.943	50	20	IDGD	
O=C(CC1CCCC1)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1806189702	GUHTUVGHILSKHN-NZQKXSOJSA-N	435.333	1.661	50	20	IDGD	
COCCOCC(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)Br)[C@@H]1c1cccnc1	1806761697	KLSKMPLAOMKYNV-UKPHBRMFSA-N	428.327	1.534	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@H](CNC(=O)CN2CCOCC2)[C@H]1c1cccnc1	1806909874	ZMVJVPBIJZRKBS-HQRMLTQVSA-N	443.375	1.656	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)CC2CCOCC2)[C@@H]1c1cccnc1	1806935687	HLRXJDRZULTJKQ-CVDCTZTESA-N	445.564	1.277	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1807366952	WEIFCVKCJSMYDZ-YZGWKJHDSA-N	443.740	1.489	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)CCc2cnn(C)c2)[C@H]1c1cccnc1	1807430926	DQQRUIUEYKDHBO-CMKODMSKSA-N	433.940	1.708	50	20	IDGD	
Cc1cnn(CC(=O)NC[C@@H]2CCN(C(=O)[C@H](F)Br)[C@@H]2c2cccnc2)c1	1807668582	NJTNLGSTQMGBBD-UAGQMJEPSA-N	438.301	1.983	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)c1nc2ccccn2n1	1807928241	HTRGCSKZFSETJJ-ZMSDIMECSA-N	428.880	1.044	50	20	IDGD	
CCc1oncc1C(=O)N1CCCC2(CCN(C(=O)c3ccc(B(O)O)cc3)CC2)C1	1808761927	DTHBJNYVXDMSTA-UHFFFAOYSA-N	425.294	1.075	50	20	IDGD	
Cc1cc(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)c[nH]1	1808776627	VNWMMTYELGQLFG-GHTZIAJQSA-N	432.289	1.031	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)C(F)(F)C(F)F)CC2)C1	1809969429	VURJSXBSLDOUIT-UHFFFAOYSA-N	430.207	1.112	50	20	IDGD	
CC(=O)NCC(=O)NC[C@@H]1CCN(C(=O)[C@H](C)CBr)[C@@H]1c1cccnc1	1812614632	OAPAPIIJHOWEFU-ISTRZQFTSA-N	425.327	1.255	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2cn3ncccc3n2)[C@H]1c1cccnc1	1813031285	SBEOMUDUMFDUDH-BXWFABGCSA-N	442.907	1.698	50	20	IDGD	
Nc1n[nH]c(CCC(=O)N2CC[C@H](CNC(=O)C(Cl)Cl)[C@H]2c2cccnc2)n1	1813078426	PWSLZLDLEJHAKB-BXUZGUMPSA-N	426.308	1.224	50	20	IDGD	
CCOC(=O)C(C)(C)C(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1	1814166737	IYXGESYIPWZTSQ-XHSDSOJGSA-N	425.913	1.276	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@H]2CCC(F)(F)C2)[nH]n1)c1cccc(B(O)O)c1	1817474867	GTKLHDMQZWLGHB-YOEHRIQHSA-N	446.263	1.831	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccccc2F)[nH]n1)c1cccc(B(O)O)c1	1817476370	CJXKEDNJGIPVTF-LJQANCHMSA-N	436.252	1.848	50	20	IDGD	
O=C(Cn1ccccc1=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](F)Br)[nH]n1	1817520336	PLPVAMIIVMNDTE-BLLLJJGKSA-N	440.273	1.954	50	20	IDGD	
CCOC(=O)N[C@H](O)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCBr)[nH]n1	1819239129	CQCRPTDGBLCJJN-IAQYHMDHSA-N	446.302	1.251	50	20	IDGD	
Cn1nc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)[C@@H](F)Br)n[nH]2)cc1O	1820931745	QCEDTAMAKRAQJQ-GXFFZTMASA-N	429.250	1.845	50	20	IDGD	
CC(=O)N[C@H](C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](C)CBr)[nH]n1	1821967886	ZWBXRHJJGAECFJ-MISXGVKJSA-N	428.331	1.957	50	20	IDGD	
CC[C@@H](Br)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN2CCOCC2)[nH]n1	1822088479	WRCDNTLFJMUUFF-HIFRSBDPSA-N	442.358	1.908	50	20	IDGD	
Cc1nc(CC(=O)N2CCCC[C@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)cs1	1822410304	DXEGBSCBYJXSCE-INIZCTEOSA-N	447.565	1.782	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)COc2ccc(O)nn2)[nH]n1)C(Cl)Cl	1822422515	GFPSFGAANAHXED-JTQLQIEISA-N	429.264	1.780	50	20	IDGD	
CC[C@@H](NC(C)=O)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1	1822999600	VENMBKOMVXDLAY-KBVBSXBZSA-N	435.319	1.660	50	20	IDGD	
O=C(NCC(=O)N1CCC([C@H]2CCCCN2C(=O)[C@H](O)CCl)CC1)c1cccnc1	1824179566	UISXVKPJAGQEDO-QZTJIDSGSA-N	436.940	1.031	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)CCl)CC2)c1cnc2ccc(F)cn12	1824268962	RGUHOOWQTVSGCT-MFKMUULPSA-N	437.884	1.755	50	20	IDGD	
CC[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)Cn1nccn1)CC2	1825451195	GQDPAXDLMHYCPV-NXEZZACHSA-N	427.328	1.520	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)Cc1ccc(F)cc1)CC2	1826085497	XIFYRNBONYNRQF-HNNXBMFYSA-N	447.536	1.810	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@H]1CCc2nc(NC(=O)[C@H](C)n3cnnn3)sc2C1	1826973975	WFOFOZUUUSUHGY-UTLUCORTSA-N	442.343	1.334	50	20	IDGD	
O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)c1cccnc1S)CCO2	1829793619	UFZZQRXXNSSUNP-KRWDZBQOSA-N	444.351	1.225	50	20	IDGD	
CN1CCC(CC(=O)N2CCO[C@@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)CC1	1830006333	SVBWGMXXSPRLIU-NRFANRHFSA-N	441.645	1.026	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(Cl)c3C)CCO2)C1	1830140198	UMQUKBBANYESFB-FXAWDEMLSA-N	445.343	1.972	50	20	IDGD	
Cc1nn(C)c(C)c1C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830354415	YPSGZVVOCAILGH-FQEVSTJZSA-N	426.945	1.372	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccncc3)C2)C1	1830543406	RAVRTSBSUIPFLF-KXBFYZLASA-N	440.338	1.112	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(OC)nn2C)CC1	1831826842	AUZDXMBLTPPZNJ-CVEARBPZSA-N	426.945	1.916	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)/C=C\C(=O)NC2CC2)CC1	1831831323	UUDAFSRVTPRKIG-BTFXCVNISA-N	425.957	1.695	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)c1ccccc1)CCO2	1832232279	OQZQWLJKNMZLRC-ZSZQSSIHSA-N	443.313	1.937	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3c[nH]c4ncccc34)CC2)CC1)[C@H](O)CCl	1833310296	PKAQQSZRZPUJEW-GOSISDBHSA-N	433.940	1.348	50	20	IDGD	
O=C([C@@H](O)CCl)N1CCC(N2CCC(NC(=O)C3(c4ccc(O)cc4)CC3)CC2)CC1	1833328974	OKJGGYKBUBDSMK-FQEVSTJZSA-N	449.979	1.595	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1)c1cc(O)ncn1	1833554597	APJAEIQUQSDQJB-OAHLLOKOSA-N	444.305	1.058	50	20	IDGD	
Cc1cc(CC(=O)NC2CCN(C3CCN(C(=O)[C@@H](C)Br)CC3)CC2)on1	1833734200	DGHRKLPWFQLVAY-CQSZACIVSA-N	441.370	1.881	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)Cc3noc(C)n3)CC2)CC1	1833808795	DQXNQIAEAXQSTG-QGZVFWFLSA-N	425.961	1.900	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1)c1ccc(O)nn1	1834071179	UKNUKMSTKXTWQF-OAHLLOKOSA-N	444.305	1.058	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(F)cn3)CCO2)C1	1834480444	KZMWRPXHAZPXLX-KSSFIOAISA-N	444.301	1.464	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccc(F)cc3)CCO2)C1	1835052159	TWOWCKCBJXONGH-AUUYWEPGSA-N	443.313	1.608	50	20	IDGD	
O=C(CCBr)N1CCC(OC2CCN(C(=O)Cc3cnccn3)CC2)CC1	1836773367	GQFKEWPVETXYDM-UHFFFAOYSA-N	439.354	1.803	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)C/N=C/c3ccco3)CCO2)C1	1837560000	GXVLPSLBZBQSCZ-WNBNNUDTSA-N	425.913	1.420	50	20	IDGD	
CCc1cnc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)s1	1837721975	JFCIGHQEBKBTML-LJQANCHMSA-N	441.626	1.627	50	20	IDGD	
O=C(Cn1cccn1)N1CCC(OC2CCN(C(=O)[C@H](F)Br)CC2)CC1	1837973947	JQXXMMQXFWMWDI-INIZCTEOSA-N	431.306	1.572	50	20	IDGD	
Cc1nn[nH]c1C(=O)N1CCC(OC2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1838001567	UMRFBTMFNGRCPQ-CQSZACIVSA-N	432.294	1.416	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C=C/c3cnc(C)s3)C2)C1	1839148501	ANXQDCYATBGKLM-HLIGJIKWSA-N	427.954	1.939	50	20	IDGD	
Cc1ncncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2	1839153666	OABQUYPNONJPOV-MSOLQXFVSA-N	431.320	1.091	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cncc(O)c3)C2)C1	1839155631	ZOTMKMSVFUYHFV-MSOLQXFVSA-N	432.304	1.094	50	20	IDGD	
O=C(c1ccc(O)c(F)c1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839201812	KBXJNSQEZPVDOB-WMLDXEAASA-N	449.248	1.292	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3oc(C)nc3C)C2)C1	1839965466	ZIVYRAODLQWLSY-KDOFPFPSSA-N	444.326	1.535	50	20	IDGD	
CCc1oncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)Br)CCO2	1840032160	PBIGTHRBCAPZPK-YVEFUNNKSA-N	430.299	1.090	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3c(F)cccc3Cl)C2)C1	1840153772	ARBVNSHGQTYVFB-KUHUBIRLSA-N	449.306	1.803	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(F)ccc3Cl)C2)C1	1840154767	FSRPJIPKVGSJCE-APWZRJJASA-N	449.306	1.803	50	20	IDGD	
C[C@@H]1CCc2c(C(=O)N3CCOC[C@]4(C3)CN(C(=O)C(Cl)Cl)CCO4)n[nH]c21	1840188504	NGMYNXMMDHGBCT-ZMZPIMSZSA-N	431.320	1.333	50	20	IDGD	
CCOC(CC(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1)OCC	1840280131	VTZUPUMTUXOCDL-FQEVSTJZSA-N	434.961	1.497	50	20	IDGD	
Cc1ncc(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)s1	1840400710	FKAOSOULYPDNDO-SJKOYZFVSA-N	446.367	1.234	50	20	IDGD	
CN(CC(=O)N1CC2(CCCN2C(=O)[C@@H]2CC=CCC2)C1)NC(=O)NCc1ccccc1	1841295307	IWIAWEPDKBQUQW-HXUWFJFHSA-N	439.560	1.892	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1ccc3c(c1)CCCO3)C2	1843417353	YXQNGXRSDLVAGK-WGOQTCKBSA-N	449.511	1.963	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)C1(c3cccc(F)c3)CC1)C2	1844263613	YCYXYSNVAPFQKE-UHFFFAOYSA-N	437.475	1.373	50	20	IDGD	
CCOC(=O)N1CCC(C(=O)N2CC3(CCCN3C(=O)CO[Si](C)(C)C)C2)CC1	1844379686	AWMYFFRKHADXLV-UHFFFAOYSA-N	425.602	1.910	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)c1ccnn1C)C2	1844692070	CELRHZFRZDESJH-UHFFFAOYSA-N	427.417	1.384	50	20	IDGD	
C=CC(=O)N[C@@H](C)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1848099147	CTWXSSIXFWNEOW-AJNGGQMLSA-N	442.944	1.011	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1ccnc(C(F)F)c1	1848302226	NYSGUQFOMHHRCH-HOTGVXAUSA-N	430.415	1.147	50	20	IDGD	
Cc1c(/C=C(\C#N)C(=O)OCC(=O)N(CCC(N)=O)Cc2ccccc2)cc(C#N)n1C	10958197	PTEKSJHZSUZCQN-VXLYETTFSA-N	433.468	1.560	50	20	IDGD	
CCn1c(NNC(=O)c2cccc(S(=O)(=O)NC(C)C)c2)nc2ccccc2c1=O	11163721	MJQIHRSVNZARGL-UHFFFAOYSA-N	429.502	1.860	50	20	IDGD	
CON(C)S(=O)(=O)c1cc(C(=O)NNC(=O)COc2ccc(C)cc2)ccc1Cl	14934472	VEHOCFUGOVVHPH-UHFFFAOYSA-N	441.893	1.670	50	20	IDGD	
O=C(CCNC(=O)NC12CC3CC(CC(C3)C1)C2)NNC(=O)[C@H]1COc2ccccc2O1	15794962	CSMFUWJJRFWCSZ-VYBOSXCSSA-N	442.516	1.632	50	20	IDGD	
Cc1nnc(NNC(=O)[C@H](NS(=O)(=O)c2ccc3ccccc3c2)C(C)C)nc1O	21127954	SFAZNXPSKJSEOI-MRXNPFEDSA-N	430.490	1.485	50	20	IDGD	
Nn1c(SCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)nnc1-c1ccc(F)cc1	21165556	OHGCMCTYDLWQLG-UHFFFAOYSA-N	431.409	1.260	50	20	IDGD	
CCOc1ccc(NC(=S)NNC(=O)c2ccc(CCNS(C)(=O)=O)s2)cc1	28633704	MBJPPOLRKUFGKZ-UHFFFAOYSA-N	442.588	1.870	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)[C@H](Cc2ccccc2)n2nnnc2C)o1	303693910	MRUZAMNXPDROGQ-SFHVURJKSA-N	425.493	1.661	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H](c2ccccc2)[C@H]2CCCO2)c1	726711372	DHOUKWYLZTTWHQ-RTBURBONSA-N	446.529	1.801	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)C(C)(C)NC(C)=O)c1	726765225	HXRLJCCQGWUUPI-UHFFFAOYSA-N	448.501	1.172	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)c1ccc(C)c(S(=O)(=O)NCC#N)c1	726883907	ONDBOPCLOFCMBQ-UHFFFAOYSA-N	446.485	1.036	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)[C@@H](c2ccccc2)N2CCN(C)CC2)cc1OC	727764928	VLLTZHMHGFWZNW-OAQYLSRUSA-N	426.517	1.844	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(CN(C)C)cc2)c1	727869874	KNGICXCPVRXTKT-UHFFFAOYSA-N	432.546	1.854	50	20	IDGD	
Cc1nc2ccccc2n1CC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	728216344	XFDYZUVFSCUNAE-UHFFFAOYSA-N	442.545	1.424	50	20	IDGD	
CC(C)(C)CC(=O)NNC(=O)C1CCN(S(=O)(=O)c2ccc3c(c2)OCCO3)CC1	728608378	WDZOXSHQIQDAFH-UHFFFAOYSA-N	439.534	1.442	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CC(=O)N(c2ccc(Cl)cc2)C1)C1CCN(c2ncccn2)CC1	728845241	FCXSIBUPLQXOSB-OAHLLOKOSA-N	442.907	1.547	50	20	IDGD	
CN1CCN([C@@H](C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)c2ccccc2)CC1	729532193	UDUMEGWFAQLWIM-OAQYLSRUSA-N	443.573	1.559	50	20	IDGD	
CCN1CCC[C@H]1CN1C[C@@H](C(=O)NNC(=O)c2ccc(Br)s2)CC1=O	729626154	JKVWERXXNQGWLY-RYUDHWBXSA-N	443.367	1.604	50	20	IDGD	
CC(C)COc1ccc(CC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1	730206058	GVQURDYLBHNFGQ-UHFFFAOYSA-N	433.530	1.975	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1cc(F)ccc1N1CCOCC1	730769328	SHPYIPNBKJBRSR-UHFFFAOYSA-N	449.508	1.339	50	20	IDGD	
CCOc1ccc(N2C(=O)/C(=C/NNC(=O)C(=O)NC3CC3)c3ccccc3C2=O)cc1	730983939	ZWJGVPPASKWLBQ-CPNJWEJPSA-N	434.452	1.513	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])c(C)c1	731492200	BODJIGOAZRIZGZ-KRWDZBQOSA-N	426.429	1.978	50	20	IDGD	
O=C(NNc1nc(-c2cccnc2)no1)[C@@H]1CS[C@H](Cc2ccccc2F)C(=O)N1	732111065	ZBYAVCJKZOJEJZ-LSDHHAIUSA-N	428.449	1.557	50	20	IDGD	
Cn1c(NNC(=O)CN2C(=O)c3ccccc3N3C(=O)CC[C@@]23C)nc2ccccc2c1=O	733365823	SWWAEAGPIWXJAZ-QHCPKHFHSA-N	446.467	1.376	50	20	IDGD	
Cc1ccc([C@H](CNC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)N2CCOCC2)o1	733642059	UTOKPWFHXZOAAR-IBGZPJMESA-N	438.488	1.791	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)NCc1ccnc(OC2CCOCC2)c1	733655120	WPRBPZJMVGXYAP-UHFFFAOYSA-N	445.432	1.457	50	20	IDGD	
CCc1cc(NNC(=O)c2nc(S(C)(=O)=O)n3ccccc23)nc(-c2ccccn2)n1	734357074	NREJZJNTVHCTNK-UHFFFAOYSA-N	437.485	1.909	50	20	IDGD	
COc1ccc(S(=O)(=O)C[C@H](C)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1	734990409	IXSGVYAECKMNDV-SCLBCKFNSA-N	434.470	1.092	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)c2ccc(Cl)c(S(=O)(=O)N3CCCCCC3)c2)cn1	735444490	LJZOTWLAWIBSMF-UHFFFAOYSA-N	439.925	1.713	50	20	IDGD	
Cc1noc(CNC(=O)NNc2ccc(S(=O)(=O)NC3CCCCCCC3)cn2)n1	735579738	LGTVRQFXSSSTBF-UHFFFAOYSA-N	437.526	1.991	50	20	IDGD	
CCc1ccc(O[C@H](C)C(=O)N2CCN(CC(=O)NNC(=O)c3cccs3)CC2)cc1	736622268	PBNPULPVNCRJHP-MRXNPFEDSA-N	444.557	1.683	50	20	IDGD	
CC(C)(C)NC(=O)Nc1ccc(Cl)c(C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)c1	741663122	WUSDZGIMTBZAID-SNVBAGLBSA-N	430.914	1.456	50	20	IDGD	
CCc1nc(C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)nn1-c1ccccc1F	741693034	JESSEUZBCRHUCH-UHFFFAOYSA-N	435.460	1.438	50	20	IDGD	
CC(=NNC(=O)[C@H](C)CN1CCOCC1)c1ccc(S(=O)(=O)CC(F)(F)F)cc1	741757276	PSSWZCXSLYRNRT-CYBMUJFWSA-N	435.468	1.831	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H](c2cccc(F)c2)N2CCOCC2)c1	741897227	CENWZOWMOVJXOM-SFHVURJKSA-N	435.477	1.064	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)CN(C)c1ccccc1[N+](=O)[O-]	742478842	RYZNCGAUFKOROR-UHFFFAOYSA-N	434.478	1.094	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)N[C@H]2CC(=O)N(c3ccccc3)C2)cc1	743571093	VZXGCWMFLIYBBG-AWEZNQCLSA-N	431.474	1.231	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)c1cc2c(s1)CC[C@@H](C)C2)N1C(=O)[C@H]2[C@H](C1=O)[C@H]1CC[C@H]2O1	746100484	NBXQXRWOAMQMAM-GBIWMZKISA-N	431.514	1.185	50	20	IDGD	
CCCCS(=O)(=O)N1CCC(C(=O)NNC(=O)c2ccc(CN(CC)CC)o2)CC1	746396770	DDOJHJIQMCGEMX-UHFFFAOYSA-N	442.582	1.724	50	20	IDGD	
COc1cc(C)nc(NNC(=O)[C@H]2CCCN(S(=O)(=O)c3ccc(C)s3)C2)n1	746626112	WEMZUAGAOZKYBW-ZDUSSCGKSA-N	425.536	1.708	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)NNC(=O)CN1CCN(C(=O)OCc2ccccc2)CC1	747347933	IGCMGUREAXLZEX-UHFFFAOYSA-N	449.511	1.812	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)c1ccccc1F)C(=O)NNC(=O)c1cccn1C	747599137	NXVIQUCSDXKSAX-ZDUSSCGKSA-N	428.511	1.025	50	20	IDGD	
O=C(CCN1CCN(C(=O)[C@@H]2CCCO2)CC1)NNc1cccc(Br)c1	748019338	AFFQEJZZDZKHBH-INIZCTEOSA-N	425.327	1.606	50	20	IDGD	
O=C(CNS(=O)(=O)c1cccs1)NNc1ccc(S(=O)(=O)C(F)F)cc1	748609420	BERDDEHFJMKUFH-UHFFFAOYSA-N	425.460	1.166	50	20	IDGD	
O=C(CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@@H]12)NNc1ccc(S(=O)(=O)C(F)F)cc1	748611284	IKFGQFSIJMIQKV-KCQAQPDRSA-N	448.517	1.852	50	20	IDGD	
C[C@H](CC(N)=O)NC(=O)/C(C#N)=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	748719525	PEVLSKRPKBRAOJ-ZMTLZGASSA-N	428.880	1.366	50	20	IDGD	
O=C(CN1CCC[C@H](CNC(=O)c2ccccc2)C1)NNC(=O)c1cccc([N+](=O)[O-])c1	748834633	FCJJDPUWHSAJPZ-MRXNPFEDSA-N	439.472	1.498	50	20	IDGD	
CO[C@H](C)c1noc(CN2CCCN(C(=O)NNC(=O)c3ccc(C#N)cc3)CC2)n1	750277495	XHIYOTQMZGTWLH-CQSZACIVSA-N	427.465	1.211	50	20	IDGD	
CNC(=O)Cc1noc(COC(=O)/C(C#N)=C/c2cc(C)n(C[C@@H]3CCCO3)c2C)n1	750317983	JEWJFPIJNWNGSL-BDBSJLECSA-N	427.461	1.606	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)c1ccccc1SCC(=O)N1CCCC1	751211897	YDCHAHKTHZXBGO-UHFFFAOYSA-N	446.554	1.654	50	20	IDGD	
COc1cccc2c1OCC(C(=O)NNC(=O)c1sc(N3CCOCC3)nc1C)=C2	751295430	YMXFJJSTMMOTNI-UHFFFAOYSA-N	430.486	1.534	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2C[C@H](CCN3CCCC3=O)c3ccccc32)n1	751485731	PMGXXJDMKXWMAS-INIZCTEOSA-N	441.557	1.758	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)c2ccc(CS(=O)(=O)C(F)F)cc2)c1	751568625	WUFZRVIWERAADT-UHFFFAOYSA-N	428.413	1.916	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)NCCn2c(O)nc3ccccc32)cc1	753035781	AJJCNONSOBOSQJ-AWEZNQCLSA-N	427.461	1.939	50	20	IDGD	
C[C@@H](Sc1ccccn1)C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	754220473	RQCZOSHVCRLKJY-CQSZACIVSA-N	434.543	1.808	50	20	IDGD	
O=C(Cc1ccc2ccccc2c1)NNC(=O)NCCN1C(=O)[C@@H]2[C@@H](C1=O)[C@H]1C=C[C@H]2C1	755259212	SLIAWHZFIRDPDT-QIJZPMMNSA-N	432.480	1.520	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)Nc2cccc(S(=O)(=O)N3CCCCC3)c2)n1	755358470	DYNKJHDUPPLWEA-UHFFFAOYSA-N	434.522	1.527	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)Nc2ccc(S(=O)(=O)N(C)C(C)C)cc2)c1	755454162	VGEPYNIQBCRYIF-UHFFFAOYSA-N	448.505	1.535	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NN=Cc1cccc(F)c1O	755490326	MYTQLGDVCQBFAC-UHFFFAOYSA-N	435.477	1.635	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)Nc2ccc(C)c(-n3cnnn3)c2)n[nH]1	755679936	PAJOTNHFKWAJGI-UHFFFAOYSA-N	433.432	1.836	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)on1)Nc1cnn(CCN2CCOCC2)c1	756826166	AYWYEQXGHOEIMJ-UHFFFAOYSA-N	425.449	1.337	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N2CC[C@]3(CCOC3)C2)cc1	757006982	SNOQTUNVIJXUTC-RKMMBKDRSA-N	449.511	1.980	50	20	IDGD	
COc1ccccc1N1CC[C@H](NC(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)C1=O	757291901	KSXMNHCVFZBOFS-CJNGLKHVSA-N	430.436	1.738	50	20	IDGD	
C[C@H]1C[C@@H](C)C[C@]2(C1)NC(=O)N(CC(=O)NNC(=S)Nc1ccc(N(C)C)cc1)C2=O	757649852	XGTNHEZYXVMLMH-GFENJXEQSA-N	446.577	1.817	50	20	IDGD	
O=C(CCN1C(=O)CNC1=O)Nc1ccc(NC(=O)NNc2ccc(Cl)nn2)cc1	758027786	ALERMKZDXZKCTD-UHFFFAOYSA-N	432.828	1.159	50	20	IDGD	
CN(CC(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1)C(=O)OC(C)(C)C	758781956	JMSYNDWQRJAADB-UHFFFAOYSA-N	429.518	1.489	50	20	IDGD	
C[C@H](O)C[C@H](CNC(=O)NNC(=O)c1csc(N2CCOCC2)n1)c1ccccc1	759608783	CSWBKLUYWSWPQF-GOEBONIOSA-N	433.534	1.478	50	20	IDGD	
CCOC(=O)c1cc(S(=O)(=O)NNC(=O)c2cccc(Br)c2)cn1C	760513918	YSXYKTWJHOBAFZ-UHFFFAOYSA-N	430.280	1.588	50	20	IDGD	
CCC(=O)NNC(=O)C(=O)Nc1ccc(CNC(=O)c2ccc(Br)cc2)cc1	763440354	AIAPGKHAWCWWIV-UHFFFAOYSA-N	447.289	1.875	50	20	IDGD	
Cc1cc(C(=O)NCC(C)C)ccc1NC(=O)C(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	763442118	LJVQIRRVHWGLRC-UHFFFAOYSA-N	441.444	1.689	50	20	IDGD	
O=C(NNC(=O)c1ccc2ccccc2n1)C(=O)Nc1ccc(NC(=O)[C@H]2CCCO2)cc1	763454982	LQVZJLANWLUIJH-LJQANCHMSA-N	447.451	1.752	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)Nc1ccc(Br)cc1F	763569719	ANMPHSSZYUQHBO-CQSZACIVSA-N	438.209	1.514	50	20	IDGD	
Cc1c(Cl)cc(F)c(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1F	763571676	NQWXGLMKCXQOKK-ZDUSSCGKSA-N	425.775	1.853	50	20	IDGD	
CCn1nnnc1-c1cccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)c1	763605530	UZDPLCRHXUDTMP-UHFFFAOYSA-N	445.443	1.150	50	20	IDGD	
COC(=O)COc1cccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)c1	763605672	PYBYXAXWUBELHV-UHFFFAOYSA-N	437.412	1.028	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(OCCN(C)C)c(Cl)c2)c1	763630566	NRCBVMDDYCYCNC-UHFFFAOYSA-N	448.907	1.754	50	20	IDGD	
Cc1c(Cl)cccc1NC(=O)C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	763718866	PPTCMYVIWLPBQH-UHFFFAOYSA-N	438.893	1.298	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNC(=O)CC23CC4CC(CC(C4)C2)C3)cn1C	763734295	KGIHDCDVTVXUSW-UHFFFAOYSA-N	430.505	1.894	50	20	IDGD	
CCCCOc1ccccc1NC(=O)C(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	763786381	NAEMGBFYHWRIMX-UHFFFAOYSA-N	437.456	1.512	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(C(=O)N3CCOCC3)c2C)cc1	763830300	BNBWOBUBUUMVSG-UHFFFAOYSA-N	438.484	1.430	50	20	IDGD	
COCc1cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2c(C)cc(Cl)cc2C)ncn1	763882329	IUGKPLBZOHCDMY-LBPRGKRZSA-N	435.868	1.447	50	20	IDGD	
COc1ccc(C#N)cc1NC(=O)C(=O)NNC(=O)c1ccc(OC(C)C)c(OC)c1	763916157	JSVQNKBAECYIHA-UHFFFAOYSA-N	426.429	1.762	50	20	IDGD	
C[S@@](=O)Cc1cc(NC(=O)C(=O)NNC(=O)Cc2ccc(F)cc2)ccc1Cl	763919024	OXAXLWKPHJVYBR-MUUNZHRXSA-N	425.869	1.686	50	20	IDGD	
O=C(Cc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1cccc(CN2CCOC2=O)c1	763931585	KFDIYTMMEGBFIG-UHFFFAOYSA-N	430.848	1.621	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)ccc1C	763947657	CCMRGWHUAUEEDW-UHFFFAOYSA-N	437.412	1.073	50	20	IDGD	
CNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(COc3ccccc3)o2)cc1	763955157	IJRCSUNLLZMKBE-UHFFFAOYSA-N	436.424	1.618	50	20	IDGD	
COCCCOc1cccc(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)c1	763999458	WZJKXJLMMAFFLJ-UHFFFAOYSA-N	439.266	1.592	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1ccccc1CN1CCOCC1	764010768	DBKDRIKHFYABRJ-UHFFFAOYSA-N	446.891	1.581	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cccc(Br)c2)ccc1C	764058386	GSYWRVJMWCOCDQ-UHFFFAOYSA-N	434.246	1.944	50	20	IDGD	
N#Cc1c(F)cccc1-n1ccc(NC(=O)C(=O)NNC(=O)c2cccc3cccnc23)n1	764142742	ALUVYHMWTBCBFW-UHFFFAOYSA-N	443.398	1.831	50	20	IDGD	
Cc1ccc(Oc2ccc(NC(=O)C(=O)NNC(=O)[C@H]3Cc4ccccc4O3)cc2)nn1	764151443	IUCDWHAPCDEORF-GOSISDBHSA-N	433.424	1.667	50	20	IDGD	
COC(=O)c1c(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)sc2c1CCCC2	764162935	GMYXASHTEKZCQL-AWEZNQCLSA-N	443.481	1.503	50	20	IDGD	
CCCNS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)CCCc2ccccc2)cc1	764224605	ROXUHJGHJWYMRE-UHFFFAOYSA-N	446.529	1.484	50	20	IDGD	
CCN(CC)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)CCc2ccccc2O)cc1	764277731	GYFSUNOEODSHOF-UHFFFAOYSA-N	426.473	1.593	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)ccc1O)C(=O)Nc1cnn(-c2ccccn2)c1	764279875	GSHQLRPKXUWSSU-UHFFFAOYSA-N	445.233	1.135	50	20	IDGD	
COCCOCc1cccc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c1	764342840	KVWDCHNRAXVYAX-UHFFFAOYSA-N	437.456	1.435	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)c(Cl)c1)C(=O)Nc1ncn(Cc2ccc(Cl)cc2)n1	764355862	KNYUQSDALOLCKZ-UHFFFAOYSA-N	449.254	1.739	50	20	IDGD	
COc1cc(C)c(NC(=O)C(=O)NNC(=O)CSc2ccccc2OC)cc1OC	764393898	SVZMMNZAYXKMTH-UHFFFAOYSA-N	433.486	1.899	50	20	IDGD	
CCOC(=O)/C=C\c1ccc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)cc1	764404223	GSHOIEFNEVCGNB-XFXZXTDPSA-N	443.481	1.847	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C[C@H]1CN(C(=O)OC(C)(C)C)CCO1	764554772	WYLLRAQPEQBSGK-KGLIPLIRSA-N	425.457	1.766	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNS(=O)(=O)c1ccc(F)cc1	765118419	DGDFDNGXPCWXEV-UHFFFAOYSA-N	440.928	1.606	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)c2ccc(N3C(=O)CCC3=O)cc2)n[nH]1	765593315	WHLBZFGLSXXTAC-UHFFFAOYSA-N	433.424	1.814	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1cccc(NC(=O)CN2CCCCCC2)c1	766272289	RNXOEUMFEGPCBL-UHFFFAOYSA-N	441.492	1.382	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCC([C@](C)(O)C(F)(F)F)CC2)cc1OC	767908953	VWQDCAZTSYENPV-SFHVURJKSA-N	433.427	1.490	50	20	IDGD	
C[C@H]1C[C@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)C[C@@H](C)O1	768124090	JXIAKYCIYOPABY-SCAQPMJSSA-N	438.550	1.761	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C)c(NC(=O)CCN(C)C)c2)c(O)c1	768238526	BIINEXGVMZODPL-UHFFFAOYSA-N	441.488	1.299	50	20	IDGD	
CCOC(=O)C1(CNC(=O)NNC(=O)[C@@H](C)Oc2cccc(Br)c2)CC1	770327825	VYQKOWSQAIVGFE-LLVKDONJSA-N	428.283	1.890	50	20	IDGD	
CN(C)C(=O)COc1ccccc1C(=O)NNc1nc(O)c2cnn(C(C)(C)C)c2n1	770966672	VPVHAGGZLLXQKG-UHFFFAOYSA-N	427.465	1.511	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)[C@@H](C)NS(=O)(=O)c3cccs3)n[nH]2)cc1	771044651	IAFQIJDQXZDVIY-GFCCVEGCSA-N	447.542	1.829	50	20	IDGD	
COc1ccccc1[C@]1(C)NC(=O)N(CC(=O)NNC(=O)c2cc(Cl)ccc2O)C1=O	771537461	GQXOQBNBKCYARU-FQEVSTJZSA-N	446.847	1.282	50	20	IDGD	
Cc1cc(C(=O)O)cc(S(=O)(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)c1C	771608533	UWVABFBODRGLCS-UHFFFAOYSA-N	439.877	1.281	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccc(-c3ncn(C)n3)cc2)c1	771776783	GHQGWGSRKXAORR-UHFFFAOYSA-N	443.489	1.199	50	20	IDGD	
COc1cc(Br)c(S(=O)(=O)NNC(=O)c2ccccc2O)cc1C(=O)O	772861536	LMDMMDKAKFMGNX-UHFFFAOYSA-N	445.247	1.485	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1cc(C(F)(F)F)ccn1	773733129	WIFSIVLAGCWQRR-UHFFFAOYSA-N	432.380	1.594	50	20	IDGD	
CCOc1ccc(C(=O)NNS(=O)(=O)c2ccc(OC)c(CC(=O)O)c2)cc1OC	774605116	MTJSKQJMFAGCAQ-UHFFFAOYSA-N	438.458	1.353	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(OCC(=O)NNC(=O)c2cc(Br)c[nH]2)CC1	777092250	KKTCUQRUYXUJBF-UHFFFAOYSA-N	445.314	1.954	50	20	IDGD	
CCc1ccccc1S(=O)(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	777594898	ZAYLCARNVAQWFE-UHFFFAOYSA-N	437.543	1.657	50	20	IDGD	
COC(=O)[C@](C)(NCC(=O)NNC(=O)c1cccs1)c1cccc(Br)c1	777615228	DCWLZOHZEGSMIC-QGZVFWFLSA-N	440.319	1.950	50	20	IDGD	
Cn1cc(C(=O)NNS(=O)(=O)c2cc(Cl)ccc2OC[C@H]2CCCCO2)cn1	777629259	JCXLWGCRGUSEOJ-CQSZACIVSA-N	428.898	1.645	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)NC[C@@H]2COC3(CCOCC3)O2)c1	777760913	UPCBYROUUQCHKP-GFCCVEGCSA-N	444.282	1.324	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)[C@H](NC(=O)NCc2ccccc2)C(C)C)nc1C	778423751	GPEQXLGDDXUNEZ-QGZVFWFLSA-N	428.493	1.929	50	20	IDGD	
Cc1c(C(=O)NNC(=O)CNC(=O)OC(C)(C)C)cnn1CCO[C@@H]1CCCCO1	778432839	AZSDONLVQOGSGF-MRXNPFEDSA-N	425.486	1.020	50	20	IDGD	
COc1ccc(-n2cnnc2SCC(=O)NNC(=O)CNC(=O)OC(C)(C)C)cc1	778445861	UWDFFYCRTZTLEB-UHFFFAOYSA-N	436.494	1.040	50	20	IDGD	
O=C(NN=c1cc[nH]cc1)c1cc(S(=O)(=O)N2CCCC2)ccc1Br	780761331	PBFAGTHFGKVRPA-UHFFFAOYSA-N	425.308	1.807	50	20	IDGD	
COCCNS(=O)(=O)c1cccc(CNC(=O)NNc2cccc(C(=O)OC)c2)c1	780832121	HBXBFCCXDFZWRE-UHFFFAOYSA-N	436.490	1.224	50	20	IDGD	
COc1ccc(S(=O)(=O)NC(C)(C)C)cc1NC(=O)C(=O)NNc1ccccc1F	782705703	IZWNCILRMSDYGY-UHFFFAOYSA-N	438.481	1.993	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)C(=O)Nc2cc(F)c(S(C)(=O)=O)c(F)c2)c1	784852183	RVFAWDGNLTYHAZ-UHFFFAOYSA-N	427.385	1.237	50	20	IDGD	
Cc1ccc(F)c(NNC(=O)C(=O)N2C[C@@H](C(=O)N3CCOCC3)Oc3ccccc32)c1	784885025	STSPWGILDZGCIC-IBGZPJMESA-N	442.447	1.230	50	20	IDGD	
O=C1C[C@@H](Cc2ccc(NC(=O)C(=O)NNc3cccc(C(F)(F)F)n3)cc2)C(=O)N1	784957117	FMZANJICJBGBON-LLVKDONJSA-N	435.362	1.387	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)C(=O)Nc1c(F)cccc1Br	785066711	GNSQMZPFXVERIP-UHFFFAOYSA-N	434.225	1.565	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)cccc1N1CCNC1=O	787541369	QAGCWVLWYHUJLY-UHFFFAOYSA-N	445.863	1.343	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ncccc2C)cc1S(=O)(=O)N1CCCC1	787578848	XJGTXJGZLMCGOX-UHFFFAOYSA-N	433.490	1.265	50	20	IDGD	
CC(C)C[C@H](C(=O)NNc1ccccc1S(N)(=O)=O)N1C(=O)[C@H]2CC=CC[C@@H]2C1=O	788223416	JEEOBVRVIRODPN-OFQRWUPVSA-N	434.518	1.143	50	20	IDGD	
CN(C)NC(=O)Nc1cccc(NC(=O)c2ccc(S(=O)(=O)NCCC#N)cc2)c1	788254565	NZOBZKUEFUIOOX-UHFFFAOYSA-N	430.490	1.729	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2[C@H]3[C@H]4C[C@@H]5[C@@H]6[C@H]4[C@H]2[C@@H]6C[C@H]53)c1	792774838	YCXGAZHAEAMWIQ-QRXYLLQBSA-N	443.569	1.872	50	20	IDGD	
CN(C)N(C(=O)CCC(=O)Nc1nnc(C2CCCCC2)s1)[C@@H]1CCS(=O)(=O)C1	792851514	XPQZOXRULLGTRU-CQSZACIVSA-N	443.595	1.797	50	20	IDGD	
NC(=O)[C@H](NC(=O)NNC(=O)Cn1ccc2ccccc21)c1cccc(Br)c1	792916952	BVYCGNTYWMUORJ-QGZVFWFLSA-N	444.289	1.961	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)c(C)cc1C	796991711	HVSPXQWHJSEVLJ-UHFFFAOYSA-N	431.445	1.738	50	20	IDGD	
CC(=O)N[C@](C)(C(=O)NNc1cccc(F)c1[N+](=O)[O-])c1ccc(S(C)(=O)=O)cc1	797760157	AXZMMXQRTBASHM-SFHVURJKSA-N	438.437	1.632	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc(C)c1Cl	799835544	RKRHRAKRFMGLJZ-UHFFFAOYSA-N	430.896	1.749	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2cc(S(=O)(=O)N3CCC[C@H](C)C3)cn2C)cc1	802064886	FGCOQAXTPUIERC-AWEZNQCLSA-N	449.533	1.921	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)c2cccc(S(N)(=O)=O)c2C)cc1Cl	802076753	VIBLEFRZLQGIGZ-UHFFFAOYSA-N	442.881	1.780	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)C(=O)N1CCc2cc(F)ccc21	802564907	RUKBCPBVUQQEPM-UHFFFAOYSA-N	434.493	1.935	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(F)cc2)C1	807371888	SUCMRHQKQQQMTN-AWEZNQCLSA-N	445.513	1.163	50	20	IDGD	
CSc1cc2c(cc1NC(=O)C(=O)NNc1ccc(-n3ccnc3)nn1)OCCO2	807428761	KPXUYKZDHQTBAI-UHFFFAOYSA-N	427.446	1.237	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)NCCCn1cc(Br)cn1	807613078	WLZSKRACPKQSKX-LLVKDONJSA-N	428.262	1.973	50	20	IDGD	
C[C@@H]1C(=O)Nc2cc(C(=O)NNC(=O)[C@@H]3CCCN(C(=O)OC(C)(C)C)C3)ccc2N1C	808011262	RNRNBWMWJQPNAW-UKRRQHHQSA-N	445.520	1.872	50	20	IDGD	
CCCNC(=O)NNS(=O)(=O)c1cc(Cl)c(OCC(=O)N(C)C)c(Cl)c1	808082809	KWURWFGBOJOGPH-UHFFFAOYSA-N	427.310	1.363	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(F)c(C(=O)OC)c1C	810384943	LQIOKBKCLVDRNN-UHFFFAOYSA-N	447.419	1.484	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc2ccccc2c1)NNC(=O)c1cnn(-c2ccccc2)c1	810397876	BDLOUXWABMANFE-UHFFFAOYSA-N	449.492	1.765	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(Br)s1)NNc1cnnc2ccccc12	810404089	DXKPJCNATSHWDD-UHFFFAOYSA-N	442.320	1.875	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NN=C1CCc2c(O)cccc21	812383073	YVSCQSAVWIOJRC-UHFFFAOYSA-N	443.525	1.812	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)C(=O)N3CCN(c4ccccc4)CC3)cc2C1	812451581	IKBMOQWTXXMXLZ-OAHLLOKOSA-N	426.542	1.983	50	20	IDGD	
COC(=O)c1cn(-c2cccc(NC(=O)NNC(=O)c3cc(-c4ccccc4)[nH]n3)c2)nn1	812981607	DHUUAHOXLVJJBI-UHFFFAOYSA-N	446.427	1.911	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccnn2C2CCCCC2)cc1	813033197	JIZMUQQYJPQLBQ-UHFFFAOYSA-N	434.522	1.720	50	20	IDGD	
COC[C@]1(C(=O)NNC(=O)NCCc2cccs2)CCN(C(=O)OC(C)(C)C)C1	813424649	SBISSAKHKOMIBV-IBGZPJMESA-N	426.539	1.895	50	20	IDGD	
Cc1c(S(=O)(=O)NC(=O)/C(C#N)=C\c2cc(C)n(C[C@@H]3CCCO3)c2C)cnn1C	813956541	OZMMJSZPWPLURH-XUKORKDYSA-N	431.518	1.738	50	20	IDGD	
COc1ccccc1C(=O)NNS(=O)(=O)CCCCN1C(=O)c2ccccc2C1=O	814211275	XDCVPZHPKSJXMW-UHFFFAOYSA-N	431.470	1.336	50	20	IDGD	
CC(=NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1csc(C(=O)O)c1	814688538	BPDDMYZLSOQLLJ-UHFFFAOYSA-N	437.499	1.621	50	20	IDGD	
C[C@@H](Cc1cnc2ccccc2n1)C(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	815467003	OLXMQBHSRDXKNO-ZDUSSCGKSA-N	437.412	1.721	50	20	IDGD	
CCOC(=O)c1ccc(C(=O)OCC(=O)NNC(=O)c2cc(Cl)ccc2OC)nc1	815535001	ZDZAPIBQRPNHDS-UHFFFAOYSA-N	435.820	1.538	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)C(=O)Nc1ccc([C@H]2CCOC2)cc1	815567140	PUHNFQAFQUDRMR-HNNXBMFYSA-N	435.440	1.482	50	20	IDGD	
CCOC(=O)c1ccc(C(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)nc1	815634186	FMGBEMWMTUMOGU-UHFFFAOYSA-N	435.481	1.602	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCc2nncn2C1)C(=O)Nc1ccc(Cl)cc1-c1ccccc1	815692462	RNDCHAJSZLLQLH-AWEZNQCLSA-N	438.875	1.947	50	20	IDGD	
Cn1nncc1NNC(=O)c1ccc(NS(=O)(=O)c2ccc3c(c2)OCCCO3)cc1	816769323	CGDSPUOUUOCJPR-UHFFFAOYSA-N	444.473	1.534	50	20	IDGD	
O=C(NNC(=O)C1(c2ccc(Br)cc2)CCCC1)[C@H]1CCS(=O)(=O)C1	827398576	FRBXCNKFPPDBJI-LBPRGKRZSA-N	429.336	1.843	50	20	IDGD	
O=C(NNC(=O)[C@@]12CCC(=O)N1c1ccccc1S2)c1csc(N2CCOCC2)n1	892846914	JYRMHCUXJVICSA-IBGZPJMESA-N	445.526	1.370	50	20	IDGD	
COc1cc(C=NNC(=O)CSc2nnc(O)nc2O)ccc1OCc1ccncc1	912808707	PIZRDJWGEQVRHC-UHFFFAOYSA-N	442.457	1.508	50	20	IDGD	
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC(=NNC(=O)Cc2nc3ccccc3n2C)CC1	914559606	RINHKSJDACAYGH-UHFFFAOYSA-N	443.533	1.413	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NCCNS(=O)(=O)c2cccc(Cl)c2)cc1	916294602	DEZKAZBSYWBUHW-UHFFFAOYSA-N	440.909	1.336	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NCc2ccc(N3CCO[C@@H](C)C3)nc2)cc1C	916393292	XMKNNDMTOLCQSG-KRWDZBQOSA-N	427.505	1.833	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CCC(=O)N2CCC(c3ccccc3)=N2)cc1C	916563013	YCFRUWDKRXFKJM-UHFFFAOYSA-N	435.484	1.806	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(S(=O)(=O)NNC(=O)c2ccc3ccccc3c2)c1	917749129	JVBBBMLYVJSALY-UHFFFAOYSA-N	433.511	1.713	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2cc(C(=O)O)ccc2F)cc(OC)c1OC	918061914	FZDUEZSLODQPCV-UHFFFAOYSA-N	428.394	1.173	50	20	IDGD	
CCNC(=O)COc1cccc(CNC(=O)NNC(=O)c2ccc(OC)c(OC)c2)c1	918090204	AKUAQXJVWMFNMY-UHFFFAOYSA-N	430.461	1.363	50	20	IDGD	
CCN1CCN(Cc2ccc(CNC(=O)NNC(=O)Cc3ccccc3OC)cc2)CC1	919904039	PYYLXLXLIOHKGY-UHFFFAOYSA-N	439.560	1.906	50	20	IDGD	
COc1cccc(C(=O)NNS(=O)(=O)c2ccc(I)cc2)c1O	919958123	AFXIUCDCVMAYJM-UHFFFAOYSA-N	448.238	1.629	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)NCc2cccc(C(=O)N3CCOCC3)c2)c1	920812358	YAOKTQMBTBWXOW-UHFFFAOYSA-N	440.500	1.685	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1csc(-c2ccccn2)n1	921056908	NHHDTHGFEPRDNW-UHFFFAOYSA-N	430.515	1.881	50	20	IDGD	
Cc1nn(C)c(-n2cccn2)c1C(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1	1116689753	FFUPXMWTTKLKDN-UHFFFAOYSA-N	431.497	1.322	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)c2n[nH]cc2I)cc1	1255036684	SNEBOKRQNQMWRE-SECBINFHSA-N	444.229	1.642	50	20	IDGD	
Cc1nn([C@@H]2CCS(=O)(=O)C2)c(C)c1C=NNC(=O)Cc1nc2ccccc2n1C	1317710265	UVMZBQDVQVIBRA-OAHLLOKOSA-N	428.518	1.439	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)[C@H](CC)N=c1nn[nH]n1-c1ccccc1	1318373030	KXQWMUODTKFEDF-INIZCTEOSA-N	447.503	1.034	50	20	IDGD	
Cc1cc(N2CCCS2(=O)=O)ccc1C(=O)NNC(=O)c1cncn1-c1ccccc1	1318816944	VUZVCTNTQXRMSB-UHFFFAOYSA-N	439.497	1.795	50	20	IDGD	
C[C@@H]1CC[C@@H](C)N1[C@H](C)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	1320622456	IWGOFLGBICORIM-BRWVUGGUSA-N	436.578	1.884	50	20	IDGD	
O=C(NNC(=O)N1CCC(C(=O)c2cccs2)CC1)c1ccc(-n2cnnn2)cc1	1340049501	VFGYFFMEEISHKP-UHFFFAOYSA-N	425.474	1.673	50	20	IDGD	
Cc1nc2ncccn2c1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2	1777901242	AMHQVCHFFBCRCZ-MOPGFXCFSA-N	440.331	1.718	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4c(c3)CNC4=O)C2)C1	1778729048	NLUBAKJLVKTNDB-BLVKFPJESA-N	436.306	1.157	50	20	IDGD	
C=C(C)CC(C)(C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2	1779510710	OZXWRGUAKNFXSB-HYBUGGRVSA-N	442.365	1.486	50	20	IDGD	
COc1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](F)Br)C3)ccn1	1779719597	SOCSTTKLNAAGFK-QIIPPGSGSA-N	444.301	1.908	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cn(C(C)(C)C)nn2)C1	1780195205	PRSHJUYTVHGDDC-YYFZDKIDSA-N	441.960	1.414	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc([N+](=O)[O-])[nH]3)C2)C1	1780414866	VBCABVXYCIGGOK-MEDUHNTESA-N	429.271	1.397	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)CC34CCCN3CCC4)C2)C1	1781130558	BGCDSAHTUBTCND-JXFKEZNVSA-N	442.398	1.866	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)C(=O)Nc3c(C)cccc3C)C2)C1	1781242424	NTHPFEYGDAZQRY-HRAATJIYSA-N	437.924	1.326	50	20	IDGD	
O=C(c1ccc2c(c1)OCO2)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781330474	XRWJJFZXQQHXRN-YOEHRIQHSA-N	429.242	1.549	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1ccc(F)cc1)C2	1782210873	VENQXCZDFOTCFK-AUSIDOKSSA-N	448.539	1.255	50	20	IDGD	
O=C(Cc1ccc(O)cn1)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Br)C2	1782634023	DUOPZGDUPJKWGQ-UWWQBHOKSA-N	444.301	1.534	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)[C@H](C)Br)CCO2)C1	1783355075	IZAYSMYLFVEDGJ-COPLHBTASA-N	426.149	1.773	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(O)c([N+](=O)[O-])c3)CCO2)C1	1783537535	ONAODYVCVRYKDN-APPDUMDISA-N	442.266	1.527	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3nnc4cc(C)nn4c3C)[C@H]2C1	1787910910	VUCQQBZMJKFGQG-JONQDZQNSA-N	434.928	1.352	50	20	IDGD	
COc1cc(C(=O)NC2(c3ccc(NC(=O)c4ccc(B(O)O)cc4)cc3)CCC2)ccn1	1788142448	XPJSHWFNNFFWOG-UHFFFAOYSA-N	445.284	1.832	50	20	IDGD	
O=C(CCN1CCCCC1)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1	1788145977	NBUYGOBCCSTPBC-UHFFFAOYSA-N	449.360	1.990	50	20	IDGD	
C=CC[C@H](C(=C)C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21	1788524480	GKEGXVRCWMGFCU-JSJNYSNDSA-N	441.532	1.047	50	20	IDGD	
C[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CO[Si](C)(C)C)C[C@@H]21)n1ccccc1=O	1788746570	OCRRBDFHGXPWBG-XSLAGTTESA-N	435.597	1.241	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc4[nH]ncc4c3)C[C@@H]21)[C@@H](F)Br	1789926442	YEXOHWBAJXGCSH-NZPIUUIZSA-N	440.273	1.242	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnn4ccncc34)C[C@@H]21	1791055999	LNMDEXKEXCDZRX-DUPGQFARSA-N	436.310	1.106	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(=O)c2ccccc2o1	1792764251	XDKJJGNNDSIRAZ-USGNIVHTSA-N	444.560	1.848	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CC(=O)N(Cc2ccccc2)C1)[C@H](O)CCl	1793397558	VVMHHXGRTOWQIM-UJWQCDCRSA-N	433.936	1.273	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnco1	1793567053	QQVPHEWKWLVEHY-PSKFDLRZSA-N	428.395	1.763	50	20	IDGD	
CC(C)c1nc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@](C)(Cl)CCl)C3)no1	1794002691	XZTOZMPQYAFCTL-ABXQLRGKSA-N	433.336	1.561	50	20	IDGD	
CCc1[nH]nc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)CBr)C3)c1F	1794512120	BBWRZCAXGNZXKL-DYNIEEOBSA-N	431.306	1.345	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCS(=O)(=O)c1ccccc1)[C@@H](O)CCl	1795716188	DDJPZCIVSJIWBE-IVSAIRAKSA-N	428.938	1.088	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)c1cccc(Br)c1)C2)[C@@H](F)Cl	1796367710	QUGKSUKYTQDGLA-FONWIUJUSA-N	449.704	1.607	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CO[Si](C)(C)C)n1	1797952733	JEAMHRSMOOMBGS-CCWDJLKJSA-N	434.569	1.095	50	20	IDGD	
CC(=O)N[C@@H](C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O	1799222019	ZNGGLBSNLMXBFM-KSYCFECVSA-N	446.460	1.297	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CC13CCCN1CCC3)C2	1799277093	SRNOMOGBMYRTAM-LORHWOILSA-N	432.392	1.831	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1Cc3ccccc3N1)C2	1799279496	PVBLDZZTJGYLAG-ACSCVQKFSA-N	426.344	1.849	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)c1ccc(O)cc1)C2	1800759945	SSDUAKFAJABAHQ-ADAAFCRPSA-N	425.323	1.869	50	20	IDGD	
Cc1oc(C(C)(C)C)cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCC(=O)NN(C)C	1801009600	QINDAJLBSYVNOH-VPTLXERWSA-N	448.564	1.462	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cnc(C)s1	1801337570	KGAIBRWHWOUEHT-FAXLKDOZSA-N	430.368	1.757	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1CCN(C(=O)[C@H]2CCC(=O)N2)[C@@H]1c1cccnc1	1803009991	ZKDIHNKFAMIWTN-DUFGSWQCSA-N	437.338	1.397	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cnn3ccccc23)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803138672	CZICHEKKNUVUCA-ZYSHUDEJSA-N	427.892	1.649	50	20	IDGD	
Cc1c(C(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]2c2cccnc2)nc2ccccn12	1803139739	UTQXDPZHQVFGFE-MBOZVWFJSA-N	441.919	1.957	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)cc1	1803146755	PUHQBXSISGXHRY-HOJAQTOUSA-N	444.919	1.959	50	20	IDGD	
CCc1[nH]nc(C(=O)N2CCCC3(CCN(C(=O)CCC(=O)NN(C)C)CC3)C2)c1F	1807840743	GGRLVJGSNARMON-UHFFFAOYSA-N	436.532	1.329	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@H](CNC(=O)Cn2nccn2)[C@H]1c1cccnc1	1808961856	YKVRBKCPKRRQME-LESCRADOSA-N	425.320	1.615	50	20	IDGD	
Cc1ccc(C(=O)N2CCC3(CCCN(C(=O)c4ccc(B(O)O)cc4)C3)CC2)s1	1809967769	KDKNDCXDQSQQIJ-UHFFFAOYSA-N	426.347	1.895	50	20	IDGD	
O=C(C(=O)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1)c1ccccc1	1809976808	RBANPXCGLWKGSM-UHFFFAOYSA-N	434.301	1.094	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)[C@H]2CC2(F)F)[C@H]1c1cccnc1	1810302593	LWSXZNYXRBZSMR-XKQJLSEDSA-N	444.442	1.055	50	20	IDGD	
COC(=O)CCC(=O)N1CC[C@H](CNC(=O)[C@@H](C)Br)[C@@H]1c1cccnc1	1812864073	KCSGQAHIFLUNJN-MRRJBJDNSA-N	426.311	1.824	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1CCc2nc(NC(=O)CCC#N)sc2C1	1814492950	MDJRIRDFIBDWIW-BTQGWNRHSA-N	427.490	1.493	50	20	IDGD	
CC(=O)C(C)(C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1815077571	DIEKABJQPRDBMS-INIZCTEOSA-N	441.492	1.329	50	20	IDGD	
Cc1ccsc1C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1	1815339902	SSLYUCBVQSKAGD-CQSZACIVSA-N	441.343	1.732	50	20	IDGD	
Cc1ncccc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1	1816391855	FBIIBQWXIMQWGN-KRWDZBQOSA-N	427.509	1.792	50	20	IDGD	
Cc1cc(C)nc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)c1	1817475561	UGFGMJPNIDMGMA-HXUWFJFHSA-N	447.304	1.721	50	20	IDGD	
CC(=O)OC[C@H](OC(C)=O)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](F)Cl)[nH]n1	1819430723	BJTSJJCINAYBLD-VNHYZAJKSA-N	432.836	1.431	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1CCc2nc(NC(=O)/C=C\C(=O)NC3CC3)sc2C1	1819529427	XBJAFEZWOYMSDV-LJTDUEICSA-N	436.610	1.741	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1[nH]cc2c1CCC2	1820104539	LBWZJOZIEVLHRN-LJQANCHMSA-N	447.304	1.526	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN2C(=O)CNC2=O)[nH]n1	1820862827	UVFDXDCYUZWGOO-GTNSWQLSSA-N	445.307	1.190	50	20	IDGD	
CC[C@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1)N(CC)CC	1822410679	ONQUKGWUWIAWLP-QZTJIDSGSA-N	449.600	1.895	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)CCc3ccc(O)nn3)sc2C1	1824491764	OJWUKFPTDRNUHK-NEPJUHHUSA-N	439.925	1.437	50	20	IDGD	
O=C(NCC(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H](O)CCl)CC1)c1cccnc1	1825087856	KOFMBHJAFNCSLT-ROUUACIJSA-N	436.940	1.031	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCC(=O)N1CCCC1)CC2	1825995513	YHYVQJMOLVCSQV-STQMWFEESA-N	442.969	1.712	50	20	IDGD	
Cc1[nH]nc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)c1F	1827050732	WBVSVGFGCURJRT-SFHVURJKSA-N	442.300	1.084	50	20	IDGD	
O=C(c1cncs1)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827056006	NLYSPFJVLFHRCW-GOSISDBHSA-N	427.335	1.370	50	20	IDGD	
O=C(Cn1cccc([N+](=O)[O-])c1=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H](F)Cl)CC1	1827615186	XHCIMAVRPJGLCN-RHSMWYFYSA-N	442.875	1.911	50	20	IDGD	
COc1ccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)nc1	1827961789	LJQGOAVPVPJWGN-FQEVSTJZSA-N	445.564	1.697	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)cc1Cl	1830107416	QSDWCOCVUNJQEM-QFBILLFUSA-N	431.316	1.318	50	20	IDGD	
Cc1c(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)nc2ccccn12	1830362573	ZCORUBUMAJOGQN-JOCHJYFZSA-N	448.951	1.978	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)nn1C(F)F	1830364673	OMADGGDAXUDPES-IBGZPJMESA-N	448.898	1.922	50	20	IDGD	
CSCC(C)(C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1831538319	PFCQMBHYGRLXOB-MLGOLLRUSA-N	441.363	1.523	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4cccn4cn3)C2)C1	1831645579	CMJAJPZJLFFQEI-UTKZUKDTSA-N	434.924	1.812	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4cn[nH]c4cn3)C2)C1	1831649845	BZUJVZTVQBHTRP-QRWLVFNGSA-N	435.912	1.435	50	20	IDGD	
Cc1nccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)n1	1831873069	HZMIFDIOVSDNHP-LJQANCHMSA-N	430.553	1.391	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(F)s3)CCO2)C1	1833212455	VDMJPEXJMADJBA-PXAZEXFGSA-N	449.342	1.988	50	20	IDGD	
COC(=O)[C@H]1CC[C@H](C(=O)NC2CCN(C3CCN(C(=O)C(Cl)Cl)CC3)CC2)C1	1833307476	UZJDASRZQHSCDK-KBPBESRZSA-N	448.391	1.951	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)CCl)CC2)CC1	1833312247	MSDXCGCRYWAIKV-CABCVRRESA-N	438.794	1.331	50	20	IDGD	
Cc1cncc(CCC(=O)NC2CCN(C3CCN(C(=O)[C@H](O)CCl)CC3)CC2)c1	1833814791	JADPKZUBXAJALA-HXUWFJFHSA-N	436.984	1.494	50	20	IDGD	
CCn1ccc(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](C)Br)CC3)CC2)n1	1834274472	PAQIUWRLLHMTKN-CQSZACIVSA-N	440.386	1.872	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)c3ccccc3)C2)C1	1834818744	DDOHTJULLAEKAU-MJGOQNOKSA-N	443.313	1.939	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)CCc3cccnc3)CC2)CC1	1834887953	LQBMQOABADOODF-FQEVSTJZSA-N	436.984	1.840	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)C#Cc3ccccc3)CCO2)C1	1835101988	MKZJWLUCKXWROF-SFTDATJTSA-N	439.339	1.731	50	20	IDGD	
Cc1cccc(CCC(=O)N2CCC(OC3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)n1	1836715350	RAGXNVKFWXHCCN-FQEVSTJZSA-N	437.968	1.921	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cc(C(C)=O)[nH]n3)CC2)CC1	1837367290	ADOBJXLLLJOAEE-MRXNPFEDSA-N	440.928	1.478	50	20	IDGD	
C[Si](C)(C)c1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)co1	1837426478	UAMAUBCXPBZZOD-SFHVURJKSA-N	449.407	1.699	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(C#N)cc3)C2)C1	1837714473	HYACDCNKRSIYJJ-NRFANRHFSA-N	431.565	1.480	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccncc1Cl)CCO2	1837887032	CTDDRWOMBOQKHP-LJQANCHMSA-N	441.988	1.657	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](C)N3CCN(C)CC3)CC2)CC1	1838627088	ISXHWOKVOLKHQZ-XLIONFOSSA-N	443.032	1.638	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C/N=C/c3ccco3)C2)C1	1839153651	NHJXQHJYNCMMRY-DIRCNHEISA-N	446.331	1.391	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)[C@@H](C)CC)C2)C1	1839962551	JXRPWEOJPXINBE-OIPACUDHSA-N	435.359	1.023	50	20	IDGD	
C=CCC(F)(F)C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](Br)CC)CCO2)C1	1839966926	UNQJHSSCRWOVTJ-CJNGLKHVSA-N	439.297	1.828	50	20	IDGD	
COc1ccc(F)cc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840190774	LVYLTGDSRDGPDY-SFHVURJKSA-N	435.279	1.708	50	20	IDGD	
COc1ccc(COCC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)cc1	1840253900	NWSLUNLFJGUYPT-QUCCMNQESA-N	444.887	1.203	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)CCc2c[nH]c3ccccc23)C1	1843071452	KSEQBGKCWZNKJA-UHFFFAOYSA-N	425.533	1.677	50	20	IDGD	
O=C(/C=C/C(=O)N1CC2(CCCN2C(=O)[C@H](F)Br)C1)NCc1ccccc1	1845215982	OSELWOYADAWDAG-OZSKJFCKSA-N	438.297	1.753	50	20	IDGD	
Cc1ccc2nc(C(=O)N3CC4(CCCN4C(=O)CCC(=O)NN(C)C)C3)sc2c1	1846384451	VBOMYHIMMBQRND-UHFFFAOYSA-N	429.546	1.795	50	20	IDGD	
COc1cc(CC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](O)CCl)cc(OC)c1OC	1847556078	CGEYSNJHZHNEKV-SOUVJXGZSA-N	426.897	1.056	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)C[C@H]2Sc3ccc(Cl)cc3NC2=O)C[C@@H](C)O1	10889285	BPIMBZACMJBXRL-BFQNTYOBSA-N	440.953	1.790	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)NCc1ccccc1S(=O)(=O)N(C)C	22434918	WVIRIUFLSBYOFH-UHFFFAOYSA-N	440.909	1.743	50	20	IDGD	
O=C(Cn1cnc2ccc(Br)cc2c1=O)NNc1nc(-c2ccncc2)no1	110849199	ZHYGBOMYYRYRNF-UHFFFAOYSA-N	442.233	1.747	50	20	IDGD	
O=C(CCN1C(=O)[C@H]2CCCC[C@H]2C1=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	726867251	CBWKCHLVOAUZJJ-CALCHBBNSA-N	434.518	1.136	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)c1ccccc1	727115988	NFEGWQADWBCRRL-KRWDZBQOSA-N	437.460	1.689	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)C[C@@H]3C(=O)Nc4ccccc43)cc2)CC1	728216378	YNNFFEUVYNGKLH-SFHVURJKSA-N	443.529	1.192	50	20	IDGD	
COc1cccc2c1OCC(C(=O)OCC(=O)NNC(=O)[C@@H]1COc3ccccc3O1)=C2	728343273	DDPLZSTUIIQGKJ-SFHVURJKSA-N	440.408	1.002	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NCCC2CCN(C)CC2)c2ccccc2c1=O	728753112	XEMYVNWUJDGVDV-UHFFFAOYSA-N	428.537	1.873	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)F)cc1)c1ccc(N2CCCS2(=O)=O)cc1	728974509	RFDPRHSIFOCAOR-UHFFFAOYSA-N	445.469	1.980	50	20	IDGD	
NC(=O)[C@H]1CC(C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)=NN1c1ccccc1	728975839	VUGHZOAMBPRNCM-OAHLLOKOSA-N	437.428	1.246	50	20	IDGD	
O=C(CN1C(=O)NC2(CCCCC2)C1=O)NNc1ccc(S(=O)(=O)C(F)F)cc1	728976614	YDCGKKMJFVTKTN-UHFFFAOYSA-N	430.433	1.381	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Br)cc2F)CC1)NNC(=O)c1ccc[nH]1	729512901	WEZDBFPKCYCRKN-UHFFFAOYSA-N	438.301	1.495	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)NCc2ccc(CN3CCC(O)CC3)cc2)c1	729621605	PTGNYNDWOKSHGI-UHFFFAOYSA-N	425.533	1.854	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)[C@@H]2CC(=O)N(C[C@@H]3CCCN3CC)C2)cc1	729625934	FDUIEIWZVIDVCH-KURKYZTESA-N	446.548	1.333	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)c2ccc(C)c(S(=O)(=O)NCC#N)c2)cc1C	731185624	BQZOAKDLIPQZQU-UHFFFAOYSA-N	430.486	1.254	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCCCN(C(=O)C2CCC2)C2CC2)c1	731364517	PTJGZDZEOYPSFV-UHFFFAOYSA-N	436.534	1.215	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)[C@H](C)N2CCN(c3ccc(F)cc3)CC2)c1	732264349	QQIQCFLLSFDBDQ-INIZCTEOSA-N	429.496	1.604	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)N[C@@H](Cc1ccccc1)CN1CCOCC1	732476854	ZOUKMVMDCLPPQC-SFHVURJKSA-N	430.480	1.478	50	20	IDGD	
Cc1ncc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c(C(C)C)n1	734099972	YGOISDVEFHCJRR-UHFFFAOYSA-N	431.518	1.768	50	20	IDGD	
C#CCNS(=O)(=O)c1ccc(C(=O)NNc2nc(-c3ccccn3)nc(C)c2C)cc1	734259432	IARHFYHHRPLXDH-UHFFFAOYSA-N	436.497	1.824	50	20	IDGD	
Cc1nc(-c2ccc(S(=O)(=O)NNC(=O)C3CCN(c4ncccn4)CC3)cc2)co1	735267612	GZKHLUVTJKDJST-UHFFFAOYSA-N	442.501	1.666	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)NCCCN2CCC(O)CC2)N(C)c2ccccc21	735832405	ZENLVCVEGZKCCJ-UHFFFAOYSA-N	425.533	1.620	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)c1nn(-c2ccc(F)cc2)cc1Br	740852897	OLHNGHZEOGUQDM-UHFFFAOYSA-N	440.273	1.840	50	20	IDGD	
CCS(=O)(=O)NCc1ccc(C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1	741692526	UTZATJLQSHBOIA-UHFFFAOYSA-N	427.486	1.386	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)[C@H]3C[C@]34CCc3ccccc34)cc2)CC1	743334676	MKSTYSXKEYMPMG-GGAORHGYSA-N	440.569	1.970	50	20	IDGD	
COc1cccc(O[C@@H](C)CNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1	743588550	BZLDDKQOGBRBOG-HNNXBMFYSA-N	428.493	1.500	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)c1cccc(S(=O)(=O)N2CCCCC2)c1	743813215	RQKYLVPIWYLXSJ-UHFFFAOYSA-N	448.457	1.550	50	20	IDGD	
O=C(CN1C(=O)Cn2c(cc3ccccc32)C1=O)NNC(=O)c1ccc2ccccc2n1	743842313	SZTYBLCVMOSGEY-UHFFFAOYSA-N	427.420	1.633	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(C(=O)OCC(=O)NNC(=O)c2cccc(C)c2)cc1	744494419	WDUXJDJGSRMELG-UHFFFAOYSA-N	447.513	1.644	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)[C@H](Cc2ccc(F)cc2)n2nnnc2C)c1	745017275	KTHPCCWMPULANR-SFHVURJKSA-N	440.435	1.217	50	20	IDGD	
CC[C@H](C)[C@H](NC(=O)N1CCCC1)C(=O)OCC(=O)NNC(=O)c1ccc(C#N)cc1	745060810	XICYHJOTOFFQNB-KSSFIOAISA-N	429.477	1.083	50	20	IDGD	
CC(=O)Nc1ccc(CCNC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)cc1	745801922	HFWRKRCXIJTYOI-UHFFFAOYSA-N	433.490	1.627	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCC(=O)OC(C)(C)C)c1	745835780	CADXXPKHXICUIM-UHFFFAOYSA-N	442.538	1.393	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1)N[C@@H]1CCSC1	745898980	CRQBCRSRLMAEST-MRXNPFEDSA-N	434.543	1.615	50	20	IDGD	
C[C@H]1C[C@H](NC(=O)NNC(=O)Nc2ccc(OC(F)F)cc2)C(=O)N1c1cnn(C)c1	745916348	CHTCAEVIBINKEF-HZMBPMFUSA-N	437.407	1.551	50	20	IDGD	
C[C@@H]1OC(C)(C)N(C(=O)OC(C)(C)C)[C@@H]1C(=O)NNC(=O)COc1ccc(C#N)cc1	746095051	WZNJGLNZEYZAMC-GUYCJALGSA-N	432.477	1.845	50	20	IDGD	
COC(=O)c1ccsc1N1CC[C@@H](NC(=O)NNC(=O)CCc2ccccc2)C1=O	746783102	ZZUKAYGYUYSGQM-OAHLLOKOSA-N	430.486	1.603	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NC[C@@H](C)Cn2ccnc2C)c2ccccc2c1=O	749196820	QZEIZUYUARCQNY-OAHLLOKOSA-N	439.520	1.982	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN1C(=O)c1ccc2c(c1)OCO2)c1cccc([N+](=O)[O-])c1	749463710	XNNMDDVMHDWZOK-HNNXBMFYSA-N	426.385	1.389	50	20	IDGD	
NS(=O)(=O)c1ccc(N2CCN(C(=O)NNC(=O)c3cc4ccccc4o3)CC2)cc1	750289283	QWYYWNHUDQCQEY-UHFFFAOYSA-N	443.485	1.257	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)N[C@H]1CCN(c2cccc(Cl)c2)C1=O	750671324	QNCGROQOGRVZCO-AWEZNQCLSA-N	433.808	1.703	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)Nc2cccc(S(=O)(=O)N3CCOCC3)c2)cc1	755353977	MMYVKTLXAWCPNG-UHFFFAOYSA-N	432.502	1.736	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCCCC2)cc1NC(=O)NNC(=O)c1cccn1C	755410027	CZBJZWVHKGYRKM-UHFFFAOYSA-N	435.506	1.675	50	20	IDGD	
CNS(=O)(=O)c1cc(NC(=O)NNC(=O)[C@@H](C)Oc2ccc(C(C)=O)cc2)ccc1C	755515920	OLNIJFQPAUIGCN-CQSZACIVSA-N	448.501	1.726	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)Nc1ccccc1CN1C(=O)CCC1=O	756220556	ITPWTTAAPNMCCR-UHFFFAOYSA-N	434.412	1.451	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)Nc3cccc(C(=O)NCCC(N)=O)c3)cc2C1	756393944	ULUSTSUTAMNPMB-GFCCVEGCSA-N	443.529	1.945	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)Nc2cnn(-c3ccccc3S(C)(=O)=O)c2)cc1	756708219	ZYAQEZSEJWBISG-UHFFFAOYSA-N	443.485	1.816	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)Nc2cnn(CC(=O)N3C[C@@H](C)O[C@H](C)C3)c2)c1	756838142	LNQYNVAPQONJEL-HZPDHXFCSA-N	444.492	1.059	50	20	IDGD	
CCCCN1C(=O)C[C@H](C(=O)NNc2ccc(C(N)=O)nn2)[C@@H]1c1ccc(OC)cc1	757399212	MYCRRIXLSUAYGV-KXBFYZLASA-N	426.477	1.417	50	20	IDGD	
O=C(NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)Nc1ccc(C2CC2)nn1	757699447	FXWXARBZBBWKGJ-UHFFFAOYSA-N	430.490	1.605	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NCCSCc2ccnc(Cl)c2)c2ccccc2c1=O	758691469	XLYGBMWGMAQCHJ-UHFFFAOYSA-N	446.920	1.859	50	20	IDGD	
CN1C(=O)C[C@@H](C(=O)NNc2nc(O)c3cnn(C)c3n2)[C@H]1c1ccc(Cl)c(F)c1	759108215	QJWHKPAYILWJHN-YMTOWFKASA-N	433.831	1.524	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NC[C@H](C[C@@H](C)O)c2ccccc2)c2ccccc2c1=O	759612522	SLHMPLFVNFYZMO-WBVHZDCISA-N	437.500	1.915	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)NCc1ccc(S(=O)(=O)NCC(C)C)cc1	759661467	GNSFYASDWJGQMQ-UHFFFAOYSA-N	448.545	1.703	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc2c(c1)COC2)NNC(=O)c1cccc(OC(F)F)c1	759787891	UYYGLKZBLYLXAY-UHFFFAOYSA-N	441.412	1.058	50	20	IDGD	
Cc1ccnc(-n2nccc2NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)c1	760279359	NACHWDVLJZCHJC-MRXNPFEDSA-N	436.472	1.746	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccnn1-c1nc(C)cc(C)n1	760280656	WJBMOTMHPJZFND-UHFFFAOYSA-N	437.460	1.006	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)CNC(=O)c1cc(-c2ccccc2)on1	760432679	QBDVEHWNCNNCCO-UHFFFAOYSA-N	431.449	1.134	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCCC(=O)NNC(=O)c1cccc(C#N)c1	760813651	LKPVLZXXGHBXOH-INIZCTEOSA-N	429.477	1.225	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)N[C@@H]2CCCN(c3ccccc3F)C2=O)cc1	761817863	DYCPIZWKUAYCBV-QGZVFWFLSA-N	430.436	1.739	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)CN2C(=O)N[C@@](C)(c3ccc(OC)cc3)C2=O)n1	762902139	MQCJUGWJYUQADN-NRFANRHFSA-N	441.492	1.242	50	20	IDGD	
CCc1ncc(S(=O)(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)s1	763375242	XJUWRSGGUSTPHH-UHFFFAOYSA-N	433.556	1.598	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)C(=O)Nc1cccnc1OCc1ccccc1	763441285	AVQXGHGBNQMVCE-UHFFFAOYSA-N	435.396	1.969	50	20	IDGD	
COC(=O)c1[nH]c(C)cc1NC(=O)C(=O)NNC(=O)COc1cc(C)ccc1C(C)C	763598130	VNKPRUNLJLPWLA-UHFFFAOYSA-N	430.461	1.706	50	20	IDGD	
COC(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)c1	763602169	VIAAHMUCLRUNKP-UHFFFAOYSA-N	441.831	1.916	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1ccc2nc(C(F)F)[nH]c2c1	763624876	OSQRCVATKLFAAR-UHFFFAOYSA-N	427.371	1.856	50	20	IDGD	
C[S@](=O)c1cccc(NC(=O)C(=O)NNC(=O)COc2cccc(C(F)(F)F)c2)c1	763639590	PFOLJBCTYLQLBB-PMERELPUSA-N	443.403	1.608	50	20	IDGD	
CCN(CC)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(OC)cc2)cc1	763659757	QNZQRZNDTZWZEW-UHFFFAOYSA-N	442.472	1.342	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccc(OC(F)(F)F)c1	763663396	IDCSWWVMRZDRKH-UHFFFAOYSA-N	427.335	1.759	50	20	IDGD	
CCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2cc(C)ccc2C)c(C)c1	763665576	KKVWGYJJPCMBRP-UHFFFAOYSA-N	426.473	1.526	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)ccc1NC(C)=O	763684397	KUKQOVZYNMOPKF-UHFFFAOYSA-N	434.836	1.472	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)Nc2ncn(Cc3ccc(Cl)cc3)n2)cc1	763834782	PWMDYTXBDPDYSB-UHFFFAOYSA-N	426.864	1.942	50	20	IDGD	
Cc1ccnn1-c1ccccc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccccc1F	763851574	UHYUOCQPJYYZIE-AWEZNQCLSA-N	425.420	1.873	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1cccc(Oc2cnccn2)c1	763857258	LSDOBMWAUZZCQC-CYBMUJFWSA-N	439.403	1.961	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(OC(C)C)nc2)cc1	763861933	UDONCRCVCPQTQM-AWEZNQCLSA-N	430.461	1.821	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cccnc2-n2cccn2)cc1	763867194	SQVDFZOZNZVJJP-CQSZACIVSA-N	438.444	1.219	50	20	IDGD	
Cc1ccc(N2CCOC2=O)cc1NC(=O)C(=O)NNC(=O)c1ccc2c(c1)OCCO2	764004446	WJWLMIYCIOVZPE-UHFFFAOYSA-N	440.412	1.123	50	20	IDGD	
O=C(Cc1ccsc1)NNC(=O)C(=O)N1CCc2cc(Br)cc(F)c21	764024125	AQCJETBTHGZKEC-UHFFFAOYSA-N	426.267	1.929	50	20	IDGD	
Cc1ccc(C(=O)NCC(F)(F)F)cc1NC(=O)C(=O)NNC(=O)Cc1ccsc1	764035986	VLRUENOIQMTAAK-UHFFFAOYSA-N	442.419	1.677	50	20	IDGD	
CC[C@@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(NC(=O)[C@H]2CCCO2)cc1C(F)(F)F	764082393	NKAACIMJWOWWSX-QMTHXVAHSA-N	444.410	1.955	50	20	IDGD	
C[C@H]1CN(c2ccccc2NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)C[C@@H](C)O1	764152301	CZABNOSTWZKJHZ-MDOVXXIYSA-N	438.484	1.390	50	20	IDGD	
Cc1cc(I)ccc1NC(=O)C(=O)NNC(=O)c1ccc(C#N)cc1	764176252	APVFGWHVPGSAOT-UHFFFAOYSA-N	448.220	1.871	50	20	IDGD	
Cc1nc(CC(C)C)c(NC(=O)C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)s1	764268194	ZLJXXVVGFANKPG-UHFFFAOYSA-N	445.549	1.443	50	20	IDGD	
CNC(=O)Cn1ccc2ccc(NC(=O)C(=O)NNC(=O)c3cc4ccccc4o3)cc21	764331636	YSYGOWQOXYJDCT-UHFFFAOYSA-N	433.424	1.533	50	20	IDGD	
CCn1cnnc1-c1cccc(NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)c1	764348987	BKZXVSYQTQOHIX-UHFFFAOYSA-N	428.836	1.724	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)CSC[C@H]3CCCCO3)CC2)cc1	765749283	WMWJGAKJNQBNMM-HXUWFJFHSA-N	434.606	1.562	50	20	IDGD	
C=CC(=O)NCc1ccc(C(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)cc1	766642278	QIPIBQOSNUKFOT-UHFFFAOYSA-N	449.555	1.376	50	20	IDGD	
CSCCNC(=S)NNC(=O)CN1C(=O)N[C@](C)(c2ccc(F)c(Cl)c2)C1=O	770255139	VWTKWHYFNRXSMC-MRXNPFEDSA-N	447.945	1.104	50	20	IDGD	
COc1ccc(C(=O)NCCNC(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)cc1	770261941	MNMDBRKHYYGSJQ-CYBMUJFWSA-N	434.880	1.876	50	20	IDGD	
COc1cc(C)nc(NNC(=O)CN2C(=O)N[C@](C)(c3ccc(F)c(Cl)c3)C2=O)n1	771400607	JWPFCZIDJSEGNR-GOSISDBHSA-N	436.831	1.496	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2ccc(C(=O)OC)cc2F)c2ccccc2c1=O	771883230	SNFQQUHREXPLCC-UHFFFAOYSA-N	426.404	1.807	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O	771884058	WDXJBCBJJGFTIR-SNVBAGLBSA-N	439.380	1.473	50	20	IDGD	
COC(=O)Cn1cc(C(C)=NNC(=O)[C@@H]2Cc3ccccc3CN2Cc2ccccc2)nn1	772840862	AHUFZNKWLHECHS-QFIPXVFZSA-N	446.511	1.918	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2cc(F)c(F)cc2I)n1	773723946	IIPQXQLKCYFDAE-UHFFFAOYSA-N	449.155	1.450	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2ccc(Cl)cc2I)n1	773724223	OOCPJMSJEXAXCJ-UHFFFAOYSA-N	447.620	1.825	50	20	IDGD	
COc1ccnc(NNC(=O)Nc2ccc(S(=O)(=O)N3C[C@H](C)O[C@H](C)C3)cc2)n1	775447530	YSNULBHSTNGXGB-BETUJISGSA-N	436.494	1.432	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)Nc2ccc(C[C@@H]3NC(=O)NC3=O)cc2)cc1C	775708023	LZHFYRHRKNMCGN-KRWDZBQOSA-N	425.445	1.286	50	20	IDGD	
Cc1nc2c(cc1C(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1)c(C)nn2C	776204042	AGRASUUSFZUCEW-UHFFFAOYSA-N	445.524	1.834	50	20	IDGD	
CC[C@H](C)Oc1cc(CNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)ccn1	776909722	XMRJSUJLVULDEV-HNNXBMFYSA-N	427.509	1.796	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NN=Cc2cccc(Br)n2)cc1	777878255	HGGPKMYLQZBBCC-UHFFFAOYSA-N	425.308	1.923	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1cc2c(cc1F)NC(=O)CC2	778707764	PUZXAMWGZITUOQ-SNVBAGLBSA-N	432.383	1.403	50	20	IDGD	
O=C(N[C@@]1(C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)CCOC1)OCc1ccccc1	779708605	XBPCBOGXRIGSSS-FQEVSTJZSA-N	428.401	1.441	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc2c(c1)nc(CCC(=O)NN=c1cc[nH]cc1)n2CC	780761351	PRSLLTUWTZGWQI-UHFFFAOYSA-N	444.561	1.980	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=O)CCNC(=O)OC(C)(C)C)c1	780970551	DQPAUKGZFVPMSG-UHFFFAOYSA-N	448.929	1.266	50	20	IDGD	
C[C@@]1(C(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)CCCOC1	781237722	JUQFNUUHMAWHSC-OAQYLSRUSA-N	431.514	1.743	50	20	IDGD	
O=C(NNc1ncncc1Cl)Nc1ccc(N2CCOCC2)cc1N1CCOCC1	782010199	DIAFZYDIJBRGAK-UHFFFAOYSA-N	433.900	1.952	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1ccc(F)c(Br)c1	784005113	OYEDRJKOOPKFGZ-UHFFFAOYSA-N	443.254	1.166	50	20	IDGD	
CC(C)(C)OC(=O)N1CCc2ncc(NC(=O)C(=O)NNc3ccnc(F)c3)cc2C1	784848613	HNTMDUMZZARPJW-UHFFFAOYSA-N	430.440	1.991	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)n([C@H]2C[C@H]3CC[C@H]2C3)n1	785068658	ZJCVNEXRZLCLQL-ZOBUZTSGSA-N	435.488	1.529	50	20	IDGD	
CCOC(=O)c1cnn(C)c1NC(=O)C(=O)NNC(=O)COc1ccc(C(C)(C)C)cc1	786413531	BIAGDDLFNQUMPR-UHFFFAOYSA-N	445.476	1.059	50	20	IDGD	
Cc1ccc(-n2cc(NC(=O)C(=O)NNC(=O)Cc3cn4ccccc4n3)cn2)c(C)c1	786430347	UGUDHIHLVHOVQA-UHFFFAOYSA-N	431.456	1.465	50	20	IDGD	
N#C/C(=C/c1cn(CCC(N)=O)nc1-c1ccc(Br)cc1)C(=O)NOCCO	787297516	WCKSTXGDSPUSAG-LCYFTJDESA-N	448.277	1.135	50	20	IDGD	
CN1CCN(C(=O)NNC(=O)[C@@H]2CCCN2C(=O)c2ccc(Br)cc2)CC1	788170031	WZGMTRZMSGXWPW-HNNXBMFYSA-N	438.326	1.042	50	20	IDGD	
CC(C)Oc1cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)ccc1C(N)=O	789740010	DMGRZJUDJHFEQB-LBPRGKRZSA-N	446.435	1.265	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NN=C(C)c1ncc[nH]1)N(S(C)(=O)=O)CC2	790151566	NHOZEBSPILHXEH-HNNXBMFYSA-N	435.506	1.216	50	20	IDGD	
Cc1ccc(C)c(S(=O)(=O)NNC(=O)c2csc(N3CCOCC3)n2)c1[N+](=O)[O-]	790388264	YVWOZHLEKBOXJM-UHFFFAOYSA-N	441.491	1.128	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1ccc(N2CCCCC2)c2ncccc12	791947138	RBLURBZKDHNSPA-ZDUSSCGKSA-N	434.522	1.316	50	20	IDGD	
Cc1cccnc1NNC(=O)C(=O)Nc1ccc(S(=O)(=O)/N=C2/CCCN2C)cc1	792379825	NZXICLXVNWOHOO-JLPGSUDCSA-N	430.490	1.285	50	20	IDGD	
O=C(NNc1nc2ccccn2n1)C(=O)Nc1nc2cc3c(cc2s1)OC(F)(F)O3	792394648	LDXVIYWWJQKEGZ-UHFFFAOYSA-N	433.356	1.742	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NC[C@H]2CCCN(C(C)=O)C2)cc1Br	792932824	UYZMEMSNFVVRMM-GFCCVEGCSA-N	427.299	1.660	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)NCc2ccc(S(C)(=O)=O)c(C(F)(F)F)c2)n1	793085825	PHPOHHRRRZNHJC-UHFFFAOYSA-N	430.408	1.957	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)c2cc(S(=O)(=O)NCc3ccco3)ccc2C)n1	794090599	XMLXPANKTDPOPS-UHFFFAOYSA-N	428.470	1.845	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)[C@@H](c2cnn(C)c2)N(C)C(=O)OC(C)(C)C)c1	794768700	XQHQBRZRUOAPIU-QGZVFWFLSA-N	447.492	1.807	50	20	IDGD	
CCOC(=O)c1ccc(OC)c(S(=O)(=O)NNC(=O)Cn2ccc3ccccc32)c1	795315713	XTDOEYKQMHKZRA-UHFFFAOYSA-N	431.470	1.836	50	20	IDGD	
COC(=O)c1cc(F)cc(NC(=O)C(=O)NNc2ccnc(Br)c2)c1F	797085170	KTCIRUHKJZUAOR-UHFFFAOYSA-N	429.177	1.991	50	20	IDGD	
COc1cccnc1CC(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	798154319	FHYARZABXPTAJI-UHFFFAOYSA-N	443.467	1.796	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@@H]2C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1	798349027	RXCSGCNQGOEWLL-APWZRJJASA-N	425.441	1.287	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNS(=O)(=O)c1ccc(C(=O)OC)c(OC)c1	799120031	HRIMOHGGPLCHTD-UHFFFAOYSA-N	438.458	1.269	50	20	IDGD	
CC(C)(C)OC(=O)NCC1(C(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)CC1	802066934	DXEDZTRVASMIQI-UHFFFAOYSA-N	426.495	1.548	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2ccc(=O)n(-c3ccccc3)n2)cc1	802069012	UAWAODRAWCXILV-UHFFFAOYSA-N	427.442	1.103	50	20	IDGD	
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC[C@@H](C(=O)NNc2ccc3c(=O)[nH]ccc3c2)C1	803437980	YDXVICBYKHUVRB-OAHLLOKOSA-N	444.517	1.412	50	20	IDGD	
C[C@](O)(CSc1cccc(F)c1)C(=O)OCC(=O)NNC(=O)c1ccc(C#N)cc1	803801419	IXNAFMMPEHQLOV-FQEVSTJZSA-N	431.445	1.545	50	20	IDGD	
CCn1c(CCC(=O)NNc2ncccc2F)nc2cc(S(=O)(=O)N(C)C)ccc21	804215468	ROPCOXDKHLVSPZ-UHFFFAOYSA-N	434.497	1.917	50	20	IDGD	
COC(=O)c1cc(NC(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)c(C)cc1Br	806740590	TYBAPFMKYWARQJ-VIFPVBQESA-N	448.295	1.132	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2c(C)c(C(F)(F)F)nn2C)c1	806973735	UZBHVEHZROWGPY-UHFFFAOYSA-N	427.383	1.529	50	20	IDGD	
CCOc1ccc(Br)cc1NC(=O)C(=O)NNc1ccc(-n2ccnc2)nn1	807429487	SHNXWRNLHLNCMM-UHFFFAOYSA-N	446.265	1.905	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H](N2CCN(CC(=O)NNC(=O)c3ccccc3)CC2)C1	808772539	JRQPYANNQPQNTN-GOSISDBHSA-N	431.537	1.075	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2cc(C(N)=O)ccc2OCC(F)F)c(OC)c1	810341429	JXNIFKBAEPKKSM-UHFFFAOYSA-N	438.387	1.913	50	20	IDGD	
CC(=NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)c1csc(N)n1	812382719	REKBNNUCYHJLMO-UHFFFAOYSA-N	437.547	1.219	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)N[C@H]1CC(=O)N(c2ccccc2F)C1	813236768	QPEIEOLCIFOETH-LBPRGKRZSA-N	431.380	1.249	50	20	IDGD	
CC(C)(C)Oc1ccc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)nc1	814516879	FWXLLTSYIFVOLL-QGZVFWFLSA-N	429.429	1.403	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)C(=O)Nc2cccc(C3CC3)n2)c2ccccc2c1=O	815566268	NUFQAIYJCDQCLJ-UHFFFAOYSA-N	434.456	1.650	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)NNC(=O)c1cc(Br)c[nH]1	838619665	ZVKAZBWBEFRKHK-UHFFFAOYSA-N	430.646	1.728	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cccn2)nc1)c1ccc(S(=O)(=O)N2CCCC2)cc1	875351575	WXALUCARMMJYNQ-UHFFFAOYSA-N	440.485	1.127	50	20	IDGD	
CC(C)Cn1c(=O)nc(O)c2c(C(=O)NNC(=O)c3cccn3C)cc(C(C)C)nc21	914445846	HIIMPBIMZNDWOM-UHFFFAOYSA-N	426.477	1.690	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)CNS(=O)(=O)c2cccs2)cc1OC	915188983	OQUFOBNRUFKUQD-UHFFFAOYSA-N	441.531	1.675	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCCCN2CCc3ccccc3C2)nc1	916459154	FYMOIVHTBMZURT-UHFFFAOYSA-N	446.577	1.843	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCCCCN2CCC[C@H](C)C2)nc1	916503847	HFUMUEUACLBWRV-INIZCTEOSA-N	426.587	1.907	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc(S(=O)(=O)NC(C)(C)C)ccc2C)cc1	916830479	BFDLMRNCVJQOKL-UHFFFAOYSA-N	446.529	1.780	50	20	IDGD	
Cc1nnc([C@@H]2Cc3ccccc3CN2CC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)o1	917194324	HEXVHJQFMJLYKG-SFHVURJKSA-N	436.428	1.847	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2cc(C(=O)NNC(=O)CN3CCCC3=O)ccc2C)cc1	920826936	PSROUNIXHVETCB-UHFFFAOYSA-N	444.513	1.488	50	20	IDGD	
C[C@H](OC[C@H]1CCCCO1)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	921146448	ZRVYWOCMGXURFZ-DOTOQJQBSA-N	439.534	1.206	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)NC1CCN(c2nccs2)CC1	1256503515	AVNOJJCFKHDCLI-UHFFFAOYSA-N	437.551	1.049	50	20	IDGD	
C[C@H](Sc1nnnn1C1CC1)C(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1	1318621341	NJDRILRAXQIYEI-NSHDSACASA-N	439.542	1.283	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2cccc(C(=O)NNc3nncc(N)c3Cl)c2)C[C@@H](C)O1	1319208797	NJSLSEXYFKGNIJ-PHIMTYICSA-N	440.913	1.267	50	20	IDGD	
COc1ccc(Cl)c(NC(=O)NNC(=O)[C@@H]2Nc3ccccc3S(=O)(=O)N2)c1	1344719669	YFEYNBSQZTUCFH-CQSZACIVSA-N	425.854	1.231	50	20	IDGD	
Cc1nc2sccn2c1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1778718775	DBCPIMKHGVDCBL-WBMJQRKESA-N	445.314	1.838	50	20	IDGD	
COc1cc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](F)Br)C2)n(C)n1	1780771032	QRQJGFHUWVHVTH-SUYBPPKGSA-N	447.305	1.247	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(=O)oc1)C2)[C@@H](F)Br	1780771985	YDCQMHDKNMAHQX-SUYBPPKGSA-N	431.258	1.458	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)N2CC[C@]3(CN(C(=O)[C@@H](F)Cl)CCO3)C2)C1	1781162621	RPYXYAXVYRSOBL-BXTJHSDWSA-N	447.935	1.998	50	20	IDGD	
C[C@@H]1CCc2c(C(=O)N3CCO[C@]4(CCN(C(=O)[C@@H](F)Br)C4)C3)n[nH]c21	1781330367	WXYSSFGPAQMPEY-VMDBXTETSA-N	429.290	1.593	50	20	IDGD	
O=C(c1cc2cccnc2[nH]1)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781330980	BOZVYBIRJIRKSK-GUYCJALGSA-N	425.258	1.697	50	20	IDGD	
N#Cc1ccc(F)c(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)c1	1781965773	WNQYXILRERDWFD-RHSMWYFYSA-N	428.233	1.831	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CCC(=O)NN(C)C)C2)cc1	1782212277	OQZVLVVZKHZGCU-AUSIDOKSSA-N	430.549	1.496	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(CCN(C(=O)Cc3ccc4c(c3)CCO4)C2)C1	1783418538	YZLFNFMXEXJYRW-HXUWFJFHSA-N	437.334	1.779	50	20	IDGD	
COc1ncc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](C)Br)C3)C2)cc1C	1783531966	GJSFRGTZOTUTCU-UGSOOPFHSA-N	426.311	1.626	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cc3cc(F)ccc3[nH]1)CCO2	1783935230	PBZYFIDMPDJOJE-QFIPXVFZSA-N	445.495	1.124	50	20	IDGD	
COCc1oncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]2C1	1783965787	ROOGSCRGUAMOTI-JURCDPSOSA-N	444.326	1.445	50	20	IDGD	
Cc1nn(C)cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]2C1	1783968655	FBXBCDXJCSMFPY-XTBFLFJDSA-N	427.343	1.353	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(C(F)(F)F)ccn3)C[C@@H]21)[C@H](O)CCl	1784091315	MYCMUXVPGNIFQS-FATJJJSSSA-N	435.830	1.293	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3cc(F)ccn3)C[C@@H]21	1786400906	FGFKDSGBDFDYHP-JQFCIGGWSA-N	442.329	1.918	50	20	IDGD	
COc1ccc(COCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]3C2)cc1	1787450145	VMWQRVCZBJVHIA-PCODUJHASA-N	428.888	1.726	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)NC(=O)c3ccccc3)C[C@@H]21	1789864360	RGCZACSGHHZXDX-RFZNHBKKSA-N	435.952	1.802	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)[C@@H](F)Br	1789923248	AMVVTIALMANOHC-WLRJLXCNSA-N	434.075	1.347	50	20	IDGD	
CCN(CC)C[C@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21	1790600543	UWDWXZFMMZLTIE-QAETUUGQSA-N	432.403	1.729	50	20	IDGD	
COCc1c[nH]c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]3C2)c1	1791058765	DZWPGLSBHGRJBS-DSRCVFDASA-N	428.327	1.538	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC1(c2ccc(NC(=O)C[C@](C)(O)CC(=O)O)cc2)CCC1	1791596329	NVTJQESSQSDBPN-NRFANRHFSA-N	448.520	1.109	50	20	IDGD	
CCOC(=O)[C@@H]1CCC[C@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](Cl)COC)C3)C1	1792958733	UKSAKQTWNQYJAX-ZKZVPCBQSA-N	444.956	1.199	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1CCOCC1	1795328657	SKNBBZYOJYVBIL-QKWTUQEISA-N	445.466	1.888	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CSc1ncccn1	1795839917	MIVAOKVNJOFHNG-QVHKTLOISA-N	443.367	1.332	50	20	IDGD	
Cc1cccc(-c2cnccc2C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](O)CCl)C3)c1	1795997408	CMSYTJCAKWPGRX-JWWGGVBKSA-N	443.931	1.860	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2sccn2c1	1796115669	OMRITMZWSUPGAJ-DNVSUFBTSA-N	426.336	1.987	50	20	IDGD	
N#Cc1cccc(CCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)c1	1796189721	RKAIWYXNHVQBFF-KOUNCHBCSA-N	431.301	1.123	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H]2C[C@]21C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Cl	1796369559	YVFCOYSHJHMNGM-RTDPWRILSA-N	445.919	1.510	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1cnn2ccccc12	1796841812	LVQLUVYIQANSRA-JLUCKKNBSA-N	425.258	1.228	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2c(c1)n(C)c(=O)n2C	1796982705	CYYMOFPACHQZGP-BASYENTBSA-N	434.924	1.098	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)Nc1cnccn1	1797778764	CXGOZXGBWWZXSX-JAAXMTQOSA-N	440.342	1.040	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ncon1	1798352332	ZPPQOKWPXYDMJB-UJLMUCCTSA-N	429.383	1.158	50	20	IDGD	
CO/C=C(\C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O	1798524846	NDEREKZQYMAIHS-UQPONMPSSA-N	447.444	1.274	50	20	IDGD	
CCOc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@](C)(Cl)CCl)nn1	1799276387	DYKDMOQBXLQISE-ABXQLRGKSA-N	431.320	1.315	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnc2ccc(F)cn12	1800064534	FAWBDLVUSMOJEU-LSSIXWDNSA-N	439.285	1.460	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(Cl)nc1F)C2	1802333381	VPNNBCLHOZMQIR-CLLJXQQHSA-N	425.892	1.499	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)C2CC(F)(F)C2)[C@H]1c1cccnc1	1802639562	DSQQYZAAHNGBLJ-HNAYVOBHSA-N	437.491	1.506	50	20	IDGD	
CCOC(CC(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)OCC	1803146799	QKZKUAUBPQFRSL-MDZRGWNJSA-N	427.929	1.476	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)[C@@H](C)CS(C)(=O)=O)[C@@H]1c1cccnc1	1803587595	HZYORIMNCAFXEJ-ORQFMDKSSA-N	445.969	1.022	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@H](CNC(=O)[C@H]2CCC(=O)N2)[C@@H]1c1cccnc1	1806821486	FQRVGPKBTWEIPF-MVWRLGRASA-N	427.332	1.602	50	20	IDGD	
CC[C@H](NC)C(=O)N1CCCC2(CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CC2)C1	1809952563	CCGSERXZDYEMNN-XUANBZSPSA-N	430.553	1.350	50	20	IDGD	
C[C@@H](Cc1ccccn1)C(=O)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1	1809972829	RPBDURFROHMMFQ-IBGZPJMESA-N	449.360	1.485	50	20	IDGD	
O=C(c1ccc2nccn2c1)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1	1809978830	VTQUHMJHZNKVKM-UHFFFAOYSA-N	446.316	1.173	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)c1cc2ncsc2[nH]1	1810577384	HOEQCPJMYIOKFZ-MAZHCROVSA-N	433.921	1.939	50	20	IDGD	
CC(C)(C)n1cc(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)nn1	1811549013	OSBOTOVEQJKYQJ-BHYGNILZSA-N	434.928	1.347	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)[C@H]2CC[C@H](O)CC2)[C@@H]1c1cccnc1	1813189926	BKAAIJPPXKEIDI-KIQACKJLSA-N	445.564	1.012	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)[C@H](C)n2cnnn2)[C@H]1c1cccnc1	1813473608	WVYRRIDPKZCLGO-DDHJSBNISA-N	436.314	1.119	50	20	IDGD	
Cc1ncccc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1816390709	IKILAOIMQAADRN-SFHVURJKSA-N	448.487	1.731	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCN2CCOCC2)n[nH]1	1817180578	AIUJWZXAPBDSLB-DZGCQCFKSA-N	442.358	1.908	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@H]2C[C@@]2(F)Cl)[nH]n1)c1cccc(B(O)O)c1	1817479346	LCLVIDHWAWFTQV-WTANOLMUSA-N	434.664	1.320	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1ccc(Cl)o1	1818425407	KAIAEMFLCPBFOA-OAHLLOKOSA-N	442.668	1.956	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnn4cccnc34)sc2C1	1818991677	NKIAQAIQWGLRAC-ZYHUDNBSSA-N	434.909	1.665	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)/C=C\C(=O)NC3CC3)sc2C1	1819532597	DBQPNFUHSMZSRR-PBWNMSGQSA-N	426.926	1.144	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@H]1CCc2nc(NC(=O)c3n[nH]cc3[N+](=O)[O-])sc2C1	1820299027	JVZHNFYHWBHJPL-VIFPVBQESA-N	438.542	1.852	50	20	IDGD	
Cc1cc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2cccc(B(O)O)c2)CC3)ccn1	1820482464	LOBOIRAJOKIEBR-MRXNPFEDSA-N	436.302	1.066	50	20	IDGD	
C[C@@H]1C[C@]1(C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1820770697	VEUVEKHRDZKEFM-FFUDGTDTSA-N	425.493	1.760	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CC[C@H](N)C(N)=O)[nH]n1	1820864512	BUTQAEGWWGMLFE-ZMNCSTGQSA-N	433.340	1.231	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H]2CCCS2(=O)=O)n[nH]1	1821835346	DAJMFLQSGVYLAR-CYZMBNFOSA-N	447.355	1.762	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@H]2CCC(=O)N2)CC1	1824094671	XUWGCYFLWBBGRZ-BMFZPTHFSA-N	428.371	1.916	50	20	IDGD	
Cc1nc(CC(=O)N[C@H]2CCc3nc(NC(=O)[C@@H](C)Br)sc3C2)no1	1825637008	PLSHKLIIKQVCSZ-APPZFPTMSA-N	428.312	1.773	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(O)nc(O)c1)CC2	1825641048	GNGQRANQQNZNSJ-CBAPKCEASA-N	441.307	1.959	50	20	IDGD	
O=C(CSc1nc[nH]n1)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](F)Br)CC2	1826673727	OFOSOTQNADFNPE-LDWIPMOCSA-N	449.331	1.656	50	20	IDGD	
CC(C)(C)NCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1	1826858228	GHKMIMDEDHPAQY-LJQANCHMSA-N	444.580	1.307	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CN2CCNC2=N)CC1	1826868941	ATQMHRRFMCGDIP-ZBFHGGJFSA-N	442.402	1.477	50	20	IDGD	
Cc1cc(C)nc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)c1	1827052876	LHKNVGVFGVWCNC-HSZRJFAPSA-N	449.360	1.925	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)CN)C2)C1	1829221866	YSRVHDUBTHUTFV-UTKZUKDTSA-N	436.940	1.415	50	20	IDGD	
O=C([C@H](F)Br)N1CCC([C@H]2CCCCN2C(=O)Cn2ccncc2=O)CC1	1831109753	BIMQANDBWUIVLD-PBHICJAKSA-N	443.317	1.554	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(O)ccc3O)C2)C1	1831653783	LTOZLOWSXPJGIL-UZLBHIALSA-N	426.897	1.575	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2csc(N)n2)CC1	1831871462	REFVFLVGCYDAPA-INIZCTEOSA-N	436.582	1.332	50	20	IDGD	
Cc1nc(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)cs1	1832972289	HYAVAHDRVBBQLG-YVEFUNNKSA-N	446.367	1.234	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3nc(C)sc3C)CCO2)C1	1833151658	VKOJKNLCPKGJJO-DNVCBOLYSA-N	429.970	1.776	50	20	IDGD	
C/C(=C/C(=O)N1CCC(N2CCC(NC(=O)[C@H](C)CBr)CC2)CC1)C(=O)O	1833265921	CORXEEBGHHTQSQ-YBEMTRGBSA-N	444.370	1.620	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)Cc3cnccn3)CC2)CC1	1833372737	DZHFDRNZHRONED-AWEZNQCLSA-N	438.370	1.374	50	20	IDGD	
CCCNC(=O)CCC(=O)NC1CCN(C2CCN(C(=O)[C@@H](Cl)COC)CC2)CC1	1833426069	NPFPCRQATTXTBN-SFHVURJKSA-N	445.004	1.118	50	20	IDGD	
CC[C@@H](C)[C@@H](O)C(=O)NC1CCN(C2CCN(C(=O)CO[Si](C)(C)C)CC2)CC1	1833499164	WZHKDZDPPMOKBK-OXQOHEQNSA-N	427.662	1.817	50	20	IDGD	
O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)c1ccccc1O)CCO2	1833753110	MLOPPLNTPFLGHL-GOSISDBHSA-N	427.295	1.247	50	20	IDGD	
Cn1cncc1C(=O)NC1CCN(C2CCN(C(=O)[C@](C)(Cl)CCl)CC2)CC1	1834244810	KXMPKAMIJGCXSF-LJQANCHMSA-N	430.380	1.842	50	20	IDGD	
O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)Cc1ccccc1)CCO2	1834992769	HRTLYJANKVWCDY-IBGZPJMESA-N	425.323	1.471	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cnc4ccccn34)CC2)CC1	1835348940	JOUCTRFBEUJZKK-SFHVURJKSA-N	447.967	1.773	50	20	IDGD	
C=CC[C@H](C)C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1	1835738068	BEXGFXFVMHTPOS-INIZCTEOSA-N	442.564	1.083	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)o1	1837454838	MMAXBZMBPDSXQR-KRWDZBQOSA-N	434.276	1.112	50	20	IDGD	
CCc1noc(C)c1C(=O)N1CCO[C@@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1	1838059611	MIXPUSHTSRGDRC-HXUWFJFHSA-N	439.585	1.467	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)/C=C/c3cnccn3)CC2)CC1	1838786833	RAKOKCAJNNCTJN-PHXNAMCJSA-N	436.940	1.742	50	20	IDGD	
O=C(c1[nH]cc2c1CCC2)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839201004	UWIVMGZGHBRVML-MAUKXSAKSA-N	444.301	1.264	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccn(C)c3)C2)C1	1839963895	ZUWYNXFFHMZJCF-QAPCUYQASA-N	428.327	1.269	50	20	IDGD	
Cc1noc(C)c1CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2	1840030334	IVXVZOLGLVZPSF-KZULUSFZSA-N	444.326	1.074	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3sccc3F)C2)C1	1840030604	PXIBITZBHRGZTI-ZBEGNZNMSA-N	435.315	1.741	50	20	IDGD	
C=CC[C@H](C(=C)C)C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](C)Br)CCO2)C1	1840033535	IJJNLNDQMNYEND-FCEWJHQRSA-N	429.355	1.995	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cncc(O)c3)CCO2)C1	1840063118	QCMPWNPUDOXXSX-ROUUACIJSA-N	432.304	1.094	50	20	IDGD	
O=C(C(Cl)Cl)N1CCO[C@]2(COCCN(C(=O)[C@H]3CNc4ccccc43)C2)C1	1840188152	QXOOOIFUXDTRSL-LIRRHRJNSA-N	428.316	1.456	50	20	IDGD	
C[C@H]1[C@@H](C(=O)N2CC3(CCCN3C(=O)[C@@H](O)CCl)C2)CCN1C(=O)OC(C)(C)C	1841354500	FBJHAIQTBUGLIJ-KKUMJFAQSA-N	429.945	1.435	50	20	IDGD	
O=C(c1cnc(-c2ccccc2)s1)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843011787	SBZVIKRPVUTRNA-UHFFFAOYSA-N	447.325	1.621	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](C(=O)N2CC3(CCCN3C(=O)[C@@H](F)Cl)C2)[C@@H](O)C1	1843361672	HPTPKSHXVGGTJD-MELADBBJSA-N	433.908	1.342	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)c2c(C)n[nH]c2C)C1	1844415148	YNXYBRFSHCQKEP-UHFFFAOYSA-N	441.444	1.991	50	20	IDGD	
C[C@@H](CNC(=O)OCc1ccccc1)C(=O)N1CCCC12CN(C(=O)[C@H](O)CCl)C2	1845197400	QGUJTDSEWSTHPQ-DOTOQJQBSA-N	437.924	1.352	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCCC12CN(C(=O)[C@@H]1CCCS1(=O)=O)C2	1845871659	BNPUNLLMXCHLJJ-DWCFMXGVSA-N	449.479	1.652	50	20	IDGD	
O=C1C[C@@H](C(=O)N2CC3(CCCN3C(=O)[C@H](Br)Cc3ccccc3)C2)CN1	1845942384	CRZXEQVBRJKOJZ-HZPDHXFCSA-N	434.334	1.332	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H]2COC[C@@]2(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](F)Cl)C1	1847289980	DQVARFHZZWZIMH-MOMPZSSISA-N	445.919	1.606	50	20	IDGD	
CC(C)(C)OC(=O)N1CC2(C[C@H]2C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](O)CCl)C1	1847563995	SXHSYGISHOQRHA-ZQDZILKHSA-N	427.929	1.045	50	20	IDGD	
CCOc1cc(Br)c(CC(=O)NNC(=O)C(=O)NC2CC2)cc1OCC	10214334	GZCQNPXDDJKEDE-UHFFFAOYSA-N	428.283	1.215	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc(OC)c1OC	15315044	BPNHNFJTSKRPMC-UHFFFAOYSA-N	442.516	1.686	50	20	IDGD	
CC(C)n1nc(C(=O)NNS(=O)(=O)c2cccc3nsnc23)c2ccccc2c1=O	19108139	NELRBPYPZGGWKP-UHFFFAOYSA-N	444.498	1.605	50	20	IDGD	
Cc1nnc(NNC(=O)CSc2nnc(-c3cccnc3)n2-c2ccccc2)nc1O	23311738	BXGIGZMWBOUZCG-UHFFFAOYSA-N	435.473	1.764	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)NCCC(=O)NNC(=O)Cc2c[nH]c3ccccc23)cc1	24453638	QYAHEQJXWVNRLM-UHFFFAOYSA-N	442.497	1.429	50	20	IDGD	
C[C@@H](NC(=O)c1cccs1)C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	24632720	DGSSBDHMAZRQCQ-MRXNPFEDSA-N	429.546	1.226	50	20	IDGD	
CCNS(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)c1	108416020	MFXDVLOBPYFVBW-AWEZNQCLSA-N	437.493	1.969	50	20	IDGD	
CC(=O)N1c2ccccc2C[C@H]1C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	726496442	XSXUNOMAZFKONQ-QFIPXVFZSA-N	435.528	1.324	50	20	IDGD	
Cn1ccnc1[C@@](O)(CC(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1)C(F)(F)F	726867789	USTKICPCQGCGLS-INIZCTEOSA-N	447.439	1.144	50	20	IDGD	
CC(C)(C)OC(=O)N(CCNC(=O)NNC(=O)c1nn(-c2ccccc2)cc1O)C1CC1	727605699	ABSHDWWARJUQOT-UHFFFAOYSA-N	444.492	1.921	50	20	IDGD	
COc1ccc(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)cc1[N+](=O)[O-]	728213273	HWJPPGZISFIIJZ-UHFFFAOYSA-N	449.489	1.296	50	20	IDGD	
CC(C)C[C@@H](/N=C1/NS(=O)(=O)c2ccccc21)C(=O)NNC(=O)c1cccc(C#N)c1	728872873	REINVWCWPXAKMS-QGZVFWFLSA-N	439.497	1.473	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)[C@@H]1CCN(c2cccc(Br)c2)C1=O	730779961	MSSWFTNMMNGOBE-AWEZNQCLSA-N	448.273	1.734	50	20	IDGD	
CN1CCN(C(=O)c2ccc(CNC(=O)NNC(=O)Cc3ccccc3F)cc2)CC1	731358885	GCXZFEZFRSOSIG-UHFFFAOYSA-N	427.480	1.286	50	20	IDGD	
C=CCn1c(=O)c2ccccc2n2c(S[C@@H](C)C(=O)NNC(=O)CC(C)C)nnc12	731904902	QSTGDXJKIUUGBI-ZDUSSCGKSA-N	428.518	1.904	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CCn2cc([N+](=O)[O-])nc2C)cc1Br	732036156	YRRZYVNMEBCCCJ-UHFFFAOYSA-N	426.227	1.722	50	20	IDGD	
O=C(NNC(=O)C1CCC1)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O	732291640	CLEYOZWTVFXOQJ-UHFFFAOYSA-N	434.430	1.662	50	20	IDGD	
Cn1c(NNC(=O)[C@@H](Cc2ccccc2)NC(=O)c2cccnc2)nc2ccccc2c1=O	733261476	BZGGSQXPGUTEMD-HXUWFJFHSA-N	442.479	1.813	50	20	IDGD	
CCc1nc(COc2ccc(C(=O)NNC(=O)CCN3C[C@H](C)O[C@H](C)C3)cc2)no1	734541576	AXARRUDOSZIACT-GASCZTMLSA-N	431.493	1.471	50	20	IDGD	
Cc1ccc(NCCCNC(=O)NNC(=O)CNC(=O)c2cccs2)c([N+](=O)[O-])c1	740044478	XAUOSHBACRLXIC-UHFFFAOYSA-N	434.478	1.527	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)COc1ccc(F)cc1)[C@H]1CN(Cc2ccccc2)CCO1	741436003	SSXMNBPRDZATSW-OXQOHEQNSA-N	430.480	1.824	50	20	IDGD	
CC(=O)N[C@H](Cc1c[nH]c2ccc(Br)cc12)C(=O)NNC(=O)NCC1CC1	742053308	HEHDFTCJAKDPPW-MRXNPFEDSA-N	436.310	1.718	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cccc(Cl)c2)cc(NS(C)(=O)=O)c1OC	742472995	XZCDYDSXFNJFHO-UHFFFAOYSA-N	427.866	1.804	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NCCCN2CCCCCC2=O)cc1	743504375	QIEXNNRACLCWGV-UHFFFAOYSA-N	425.511	1.219	50	20	IDGD	
COc1ccc2c(c1)OCC[C@H]2NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1	743589209	QQWLDLSTTXMIDY-QGZVFWFLSA-N	426.477	1.556	50	20	IDGD	
CCS(=O)(=O)CCNC(=O)NNC(=O)Nc1ccc(Br)cc1Cl	743591039	FHVCXZIBUCEEPC-UHFFFAOYSA-N	427.708	1.873	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1n[nH]c2ccc([N+](=O)[O-])cc12	744621467	XQINXQTZRJRLHK-UHFFFAOYSA-N	446.445	1.249	50	20	IDGD	
CC(C)CNC(=O)N1CCC[C@@H](CC(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)C1	745112912	WGLMQOYWWSVXQW-KRWDZBQOSA-N	443.504	1.330	50	20	IDGD	
CS[C@@H]1CC[C@@H](NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)C1	745896836	MNRTXFBHEZDYKK-HUUCEWRRSA-N	426.564	1.699	50	20	IDGD	
CC[C@H]1Oc2cc([C@H](C)NC(=O)NNC(=O)CNC(=O)c3ccco3)ccc2NC1=O	745933199	UUJWFELGHFXJDF-SMDDNHRTSA-N	429.433	1.211	50	20	IDGD	
CC(=NNC(=O)CCOc1ccccc1)c1ccc(S(=O)(=O)N2CCNCC2)cc1	747059217	KJKDPCAQFUSHBO-UHFFFAOYSA-N	430.530	1.590	50	20	IDGD	
O=C(CCNS(=O)(=O)c1cccc([N+](=O)[O-])c1)NNC(=O)c1cccc2cccnc12	747423975	APBAFOPQJWNOPK-UHFFFAOYSA-N	443.441	1.273	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(CCNC(=O)NNC(=O)c2ccc(Cl)cc2F)CC1	747583267	APGSUCYZRPFEFX-UHFFFAOYSA-N	443.907	1.976	50	20	IDGD	
Cc1c(C(=O)NNC(=O)CC23CC4CC(CC(C4)C2)C3)cnc2c1c(=O)n(C)c(=O)n2C	747718964	BRVJKPLCUVMXAL-UHFFFAOYSA-N	439.516	1.308	50	20	IDGD	
COc1ccc(C(=O)NNc2nccn(C)c2=O)cc1S(=O)(=O)N1C[C@@H](C)C[C@H](C)C1	747945723	PGWXRIQCOWFBDP-KBPBESRZSA-N	449.533	1.212	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)/C=C/c3ccc4c(c3)OCO4)cc2)CC1	748621257	ZBMWZOWWGLSXSL-YCRREMRBSA-N	444.513	1.508	50	20	IDGD	
Cc1nccn1CCNC(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	749214568	BFTMVWDPGSONAS-UHFFFAOYSA-N	445.483	1.594	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)NCC(=O)N1CCN(c2ccccc2)CC1	749222338	VSBZREHMERMBTA-UHFFFAOYSA-N	439.516	1.307	50	20	IDGD	
CC[C@H](NC(=O)NNC(=O)c1csc(N2CCOCC2)n1)c1nnc2n1CCCCC2	749579589	LUKILZKGSUZZQI-ZDUSSCGKSA-N	448.553	1.393	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)Cc1c(C)nn(-c2cncc3nnnn23)c1C)c1ccccc1	749840636	MNRNWDPUWHSGGJ-MRXNPFEDSA-N	433.476	1.206	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)CNC(=O)OC(C)(C)C	750438430	GXJYFLOPZAOJCM-GFCCVEGCSA-N	432.481	1.038	50	20	IDGD	
Cc1ccc(-c2nnc(S)n2CC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1	751069709	IDNQBYMVCPCRMN-MRXNPFEDSA-N	425.470	1.530	50	20	IDGD	
C[C@H](NC(=S)NNC(=O)CS(=O)(=O)Cc1cccc(Br)c1)C1CC1	751620438	ULHHXFQXAYBFAT-JTQLQIEISA-N	434.381	1.658	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)NCC3(C)CCN(C(=O)OC(C)(C)C)CC3)nc21	753358316	VMCFUZRCXCOCCQ-UHFFFAOYSA-N	434.501	1.732	50	20	IDGD	
CC(C)C[C@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)N1CCCCC1=O	755041882	UBQNQGXGXSCKCS-QGZVFWFLSA-N	438.550	1.125	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)c2ccc(Cl)cc2F)n([C@@H]2CCS(=O)(=O)C2)n1	755532916	MXMBAHLSZKVDOX-LLVKDONJSA-N	429.861	1.810	50	20	IDGD	
COc1ccc(C(=O)N(C)C)cc1NC(=O)NNC(=O)COc1ccccc1[N+](=O)[O-]	756120610	HQYGAMVEQHNHDR-UHFFFAOYSA-N	431.405	1.537	50	20	IDGD	
Cc1c(NC(=O)NNC(=O)COc2ccc(C#N)cc2)cccc1C(=O)N1CCOCC1	756184476	GVWUPUYUHYSTPK-UHFFFAOYSA-N	437.456	1.571	50	20	IDGD	
Cc1nc(-c2cccc(NC(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)c2)no1	756225027	ZIOFRJKBDMDVCS-UHFFFAOYSA-N	444.473	1.762	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2nc(C(C)(C)C)ns2)cc1	756358810	XWJJSEPFMYLACS-UHFFFAOYSA-N	440.551	1.617	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)Nc1ccc(S(=O)(=O)NC2CC2)cc1	756774904	DZMUIEOXQSQGOP-UHFFFAOYSA-N	432.458	1.365	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)CN2C(=O)NC3(C[C@H](C)C[C@@H](C)C3)C2=O)o1	756949486	HWUWICWUZDIVPS-HUUCEWRRSA-N	447.536	1.629	50	20	IDGD	
Cc1ccc(S(=O)(=O)Cc2ccc(C(=O)NNc3ccc(C(N)=O)nn3)cc2)cc1	757408598	WMRXHAMDYMHYPL-UHFFFAOYSA-N	425.470	1.615	50	20	IDGD	
COC(=O)c1cc(NC(=O)NNC(=O)c2ccc3c(c2)OCO3)cc(S(C)(=O)=O)c1	757674928	YCACAUPDYSIHFZ-UHFFFAOYSA-N	435.414	1.072	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)CN2C(=O)NC3(C[C@@H](C)C[C@H](C)C3)C2=O)cc1	757734266	MUDODKDWHNTSML-KBPBESRZSA-N	431.493	1.001	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)NC[C@H]1CC(=O)N(Cc2ccccc2)C1	759683034	LKRBFYQZCPFCFD-NVXWUHKLSA-N	428.464	1.972	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)[C@@](C)(O)CN2C(=O)C(C)(C)c3ccccc32)c1	760054306	ULJXCVLALGJQPV-QHCPKHFHSA-N	441.484	1.540	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)NCCNS(=O)(=O)NC(C)C)c(C)n1C[C@@H]1CCCO1	760641240	NTRVYTCNEQWQPH-MVDPLZLPSA-N	437.566	1.140	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)C1=CC=CN2CCS(=O)(=O)N=C12	761309624	MFIWYFAIWYDCSE-UHFFFAOYSA-N	443.510	1.377	50	20	IDGD	
O=C(CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)NNc1nccc(N2CCOCC2)n1	762860126	IOMHFGDWHAIGSE-UHFFFAOYSA-N	443.420	1.053	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C2CCN(S(=O)(=O)c3cccnc3)CC2)n1	762896606	ANZTXMIRSJSANC-UHFFFAOYSA-N	433.538	1.262	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)c3cnc4c(c3)c(O)nc(=O)n4C)n[nH]2)c1	763173848	DORXYGQRCHIKNX-UHFFFAOYSA-N	433.428	1.116	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)c3c(C)oc(C)c3S(N)(=O)=O)n[nH]2)c1	763175719	SCIGNOGZCAQHIN-UHFFFAOYSA-N	431.474	1.626	50	20	IDGD	
NC(=O)c1cnn2c(C(=O)NNC(=O)COc3ccccc3Cc3ccccc3)ccnc12	763306976	VGXSFNCOAGAHIN-UHFFFAOYSA-N	444.451	1.259	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1cccc(OC[C@H]2CCCO2)c1	763472532	WNYZCIJNGNCEKQ-QGZVFWFLSA-N	428.401	1.552	50	20	IDGD	
CCOc1cc(C)ccc1NC(=O)C(=O)NNC(=O)c1cc(OC)c(OC)c(OC)c1	763539544	NBOASMSHQVLXKY-UHFFFAOYSA-N	431.445	1.819	50	20	IDGD	
O=C(NNC(=O)c1c[nH]c2ccccc12)C(=O)Nc1ccc(N2CCOCC2)c(F)c1	763540401	GSRNJMDVKBHFRK-UHFFFAOYSA-N	425.420	1.543	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(NC(=O)CCN(C)C)cc2)c1	763618998	MBTSULMIYMEXPY-UHFFFAOYSA-N	441.488	1.050	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(C(=O)NC2CC2)ccc1C	763657469	NIIYXUHOZKGSHE-UHFFFAOYSA-N	440.456	1.061	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2cnn(CC(C)C)c2C(F)F)c1	763772572	NDDIATGEAVGPQN-UHFFFAOYSA-N	439.419	1.894	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2cccc(-n3nc(C)cc3C)c2)c1	763772576	NHXSSVNEPJUXMG-UHFFFAOYSA-N	437.456	1.906	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)C(=O)Nc2ccc(C)nc2)c2ccccc2c1=O	763820635	LYCAXYQSNCZUKC-UHFFFAOYSA-N	436.472	1.690	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)cccc1N1CCOC1=O	763840350	UBAKXFRKZUXHHW-UHFFFAOYSA-N	430.392	1.256	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccccc1OC[C@H]1CCCCO1	763842112	BMAKLOYDHQINSD-QGZVFWFLSA-N	445.447	1.939	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccc(C(=O)NC2CC2)cc1	763867207	SXYMWEHUTIHKSV-GFCCVEGCSA-N	428.420	1.271	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cccc(-n3cccn3)c2)cc1	763873618	WQDDFJRECTWXTE-OAHLLOKOSA-N	435.440	1.628	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ncn(C3CCCCC3)n2)cc1	763879049	VWLPTGCIIVFMRT-AWEZNQCLSA-N	442.476	1.539	50	20	IDGD	
CC(C)(C)c1nsc(NC(=O)C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)n1	763945065	UHOUDBXGYQETHQ-UHFFFAOYSA-N	429.462	1.127	50	20	IDGD	
O=C(NNC(=O)c1ccc(COc2ccccc2)o1)C(=O)Nc1ccn(CC(F)F)n1	763950216	MAUWVTTYRMGSOG-UHFFFAOYSA-N	433.371	1.720	50	20	IDGD	
O=C(Cc1ccsc1)NNC(=O)C(=O)Nc1ccc(NC(=O)NCc2ccco2)cc1	764025975	SHRHZJQGCIVYPF-UHFFFAOYSA-N	441.469	1.991	50	20	IDGD	
Cc1nn(C)c2sc(C(=O)N[C@@H](C)C(=O)NNC(=O)CSc3ccccc3O)cc12	764046584	OLSLRKYHDBZIRA-NSHDSACASA-N	447.542	1.707	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3c2)cc1S(C)(=O)=O	764067152	OMBLEBDPGUJUPP-UHFFFAOYSA-N	425.466	1.951	50	20	IDGD	
NC(=O)CCOc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccc3ccccc3c2)cc1	764085746	TYTYTAXVEAKVJF-UHFFFAOYSA-N	434.452	1.423	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3c[nH]nc3-c3ccccn3)n[nH]2)cc1	764110910	MNTVTUQDENVRCJ-UHFFFAOYSA-N	430.428	1.570	50	20	IDGD	
COC(=O)N(C)Cc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccccc2OC)cc1	764138169	AAJBYEMCSHYQDN-UHFFFAOYSA-N	428.445	1.222	50	20	IDGD	
CC(C)(C)OC(=O)NCCOc1ccc(NC(=O)C(=O)NNC(=O)c2ccoc2)cc1	764160713	XQZPQYGZOXBSMM-UHFFFAOYSA-N	432.433	1.583	50	20	IDGD	
C[C@H](C(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)CC2CCCC2)cc1)n1cncn1	764179408	STJKDRHOWLQSGF-CYBMUJFWSA-N	427.465	1.144	50	20	IDGD	
O=C(Cc1ccccn1)NNC(=O)C(=O)Nc1ccnn1Cc1c(Cl)cccc1Cl	764267364	URLBSFFYBAJEJF-UHFFFAOYSA-N	447.282	1.962	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)C(=O)Nc1cc(Cl)ccc1C(=O)N1CCCC1	764389528	SHVSHSVNAYNHNB-UHFFFAOYSA-N	429.864	1.679	50	20	IDGD	
CCOc1cc(NC(=O)C(=O)NNC(=O)CSc2ccccc2OC)ccc1OC	764397365	HKCHBJLEOLGMGP-UHFFFAOYSA-N	433.486	1.981	50	20	IDGD	
Cc1ccc([C@H](C)[C@H](O)C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)cc1	765198237	KZNFHTLSJLQZLA-UWJYYQICSA-N	446.573	1.539	50	20	IDGD	
CC(C)CNS(=O)(=O)c1ccc(C(=O)NNC(=O)CSc2ccccc2O)cc1	765247757	IWMIHGNYKNFCDJ-UHFFFAOYSA-N	437.543	1.880	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)CSc2nnc(-c3ccco3)n2Cc2ccco2)cn1	765469049	LJDKOOGABLICAH-UHFFFAOYSA-N	427.446	1.466	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)NNC(=O)c2cc(-c3cc(C)ccc3C)[nH]n2)c(C)o1	765576151	NPMWQELCCCSTOH-UHFFFAOYSA-N	431.474	1.578	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N(C)C)cc2)n[nH]1	765601755	TXHFUWQZFWDAQU-UHFFFAOYSA-N	443.485	1.410	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CC(F)F)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	765777184	IEAMHDFPOJYYSP-ZDUSSCGKSA-N	442.467	1.389	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1ccc2c(C=O)n[nH]c2c1	766175433	SERQMKXEYJQLMI-UHFFFAOYSA-N	430.804	1.655	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N2CCCCC2)cc1NC(=O)C(=O)NNc1cnccn1	766260434	OHPWSOBHWJUOFM-UHFFFAOYSA-N	448.505	1.132	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)c2cc(C)ccc2S(N)(=O)=O)cc1OC	767193967	SPIUQSWBXGZLEO-UHFFFAOYSA-N	435.502	1.905	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)[C@@H]1CC(=O)N(c2cccc(C)c2C)C1	767270547	AZEVNJKPZIQUFS-LJQANCHMSA-N	437.496	1.898	50	20	IDGD	
CCn1cc(C(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)c(=O)c2ccc(C)nc21	767710106	BLYFJBMMWYYVJX-UHFFFAOYSA-N	442.859	1.996	50	20	IDGD	
Cn1nc(SCC(=O)NN=Cc2cc(Br)ccc2Cl)c(=O)n(C)c1=O	767765088	OULORGPSOBEVLO-UHFFFAOYSA-N	446.714	1.137	50	20	IDGD	
O=C(CN1C(=O)Cn2c(cc3ccccc32)C1=O)NNC(=O)c1cc(-c2cccs2)[nH]n1	768262300	GYQNCMMUVNFINW-UHFFFAOYSA-N	448.464	1.537	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@@H]2C[C@@H](OC(C)C)C2(C)C)cc1	768431193	PQXBTGNBBLVLKD-IAGOWNOFSA-N	440.566	1.538	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)CN1C(=O)N[C@]2(CCCC(C)(C)C2)C1=O	768566467	RZKKDYHZEKUWIO-ZSEKCTLFSA-N	434.468	1.631	50	20	IDGD	
O=C(NNC(=S)Nc1ccccn1)C1CCN(S(=O)(=O)c2ccccc2F)CC1	768585978	ZARFQFRMBUKUQZ-UHFFFAOYSA-N	437.522	1.639	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)N2CCCC[C@@H]2CS(N)(=O)=O)N(C)c2ccccc21	769581811	KIAHWEADYPPQDF-OAHLLOKOSA-N	445.545	1.327	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)N1CCN(c2ccc(C#N)cn2)CC1	770647571	NDEATNAFFIFHLH-AWEZNQCLSA-N	428.880	1.937	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1cc(S(=O)(=O)N(CC)CC)ccc1Cl	771882254	OLIRSENYLKLPJO-NSHDSACASA-N	433.914	1.473	50	20	IDGD	
Cc1nc(-c2c(C)c(C)nn(C)c2=O)sc1C(=O)O[C@@H](C)C(=O)NNC(=O)CC(C)C	772006087	SXUBVGRTYPXVRI-ZDUSSCGKSA-N	449.533	1.568	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNc2cccc(Cl)c2)cc(S(C)(=O)=O)c1	773736673	RBCDXVUBPRAQKP-UHFFFAOYSA-N	425.850	1.612	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(N3CCNC3=O)ccc2Cl)cc1F	773890101	RRYUQYLOIJNVAG-UHFFFAOYSA-N	433.827	1.717	50	20	IDGD	
Cc1cc(C(=O)N2CCOCC2)ccc1NC(=O)C(=O)NNc1nccnc1C(C)C	773993416	UXLUKSFTUWKGKC-UHFFFAOYSA-N	426.477	1.463	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNS(=O)(=O)c2cccc(C)c2Cl)cc1	775669528	LULDJUSIVSGFBT-UHFFFAOYSA-N	445.950	1.587	50	20	IDGD	
COCCO[C@H]1COCC[C@@H]1NC(=O)NNC(=O)c1sc(-c2ccccc2)nc1C	776845941	IWMSHVXVJYBWME-HOTGVXAUSA-N	434.518	1.883	50	20	IDGD	
CC(C)(C)OC(=O)NCC(F)(F)CNC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	777677705	LPNPKDZZIODEIH-ZDUSSCGKSA-N	430.408	1.317	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)NC2CCN(S(=O)(=O)CC(C)C)CC2)cc1	777765317	KJXGXJFVWTXHGB-UHFFFAOYSA-N	440.566	1.408	50	20	IDGD	
Cc1cc(N2C[C@H](C(=O)OCC(=O)NNC(=O)Cc3ccccc3C)CC2=O)ccc1F	780182791	VSYVKINDTVZMNV-QGZVFWFLSA-N	441.459	1.729	50	20	IDGD	
CCc1cccc2c1N(C(=O)C(=O)NNC(=O)c1sc(N3CCOCC3)nc1C)CC2	782896376	HDOQEPCALJMLHG-UHFFFAOYSA-N	443.529	1.201	50	20	IDGD	
CCOc1ccc(Oc2ccccc2NC(=O)C(=O)NNC(=O)C(=O)NC2CC2)cc1	782968185	YWNWQGINXQNQNC-UHFFFAOYSA-N	426.429	1.242	50	20	IDGD	
O=C(NNc1ccc(-n2cccn2)nn1)C(=O)Nc1cc(N2CCCC2=O)ccc1Cl	783436218	IADMFOSESUWMBY-UHFFFAOYSA-N	440.851	1.524	50	20	IDGD	
O=C(NNc1ccc(-n2cccn2)nn1)C(=O)Nc1ccc2oc(C(F)(F)F)nc2c1	783437365	ZGPMBNXQMQFIRT-UHFFFAOYSA-N	432.322	1.904	50	20	IDGD	
CC(C)Cn1cc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)NC(C)(C)C)cn1	784834311	WAXALONEGWJXIY-UHFFFAOYSA-N	436.538	1.698	50	20	IDGD	
N#Cc1ccc(NNC(=O)C(=O)Nc2ccc(S(=O)(=O)NC3CC3)cc2)cc1Cl	785091403	APMZFESLGRGNDE-UHFFFAOYSA-N	433.877	1.734	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)[C@@H]2CC(c3c(F)cccc3F)=NO2)c2ccccc2c1=O	785688488	COJPVSXDYMGTSR-HNNXBMFYSA-N	427.367	1.166	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)N[C@@H]1CCc2cc(C#N)ccc21	787429845	HLBOBIFOBRBAQH-MRXNPFEDSA-N	426.502	1.791	50	20	IDGD	
Cc1cc(F)cc(-n2cc(C(=O)OCC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)nn2)c1	789058383	MGJJTCACCFGRQG-UHFFFAOYSA-N	442.363	1.241	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)c(OC)c1	789809583	APZSDBQEWOLVPS-YJBOKZPZSA-N	441.440	1.140	50	20	IDGD	
COc1cc(Cl)c(Cl)cc1NC(=O)C(=O)NNC(=O)Cc1cn2ccccc2n1	792285926	MOTXEDJIDWZFGC-UHFFFAOYSA-N	436.255	1.978	50	20	IDGD	
Cc1cccnc1NNC(=O)C(=O)Nc1cccc(S(=O)(=O)/N=C2\CCCN2C)c1	792374626	CYLQGHKKTARRHD-LFVJCYFKSA-N	430.490	1.285	50	20	IDGD	
COc1c(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2F)cc(Cl)cc1C(N)=O	793025516	LZPNSJDCVJBSJO-UHFFFAOYSA-N	443.218	1.640	50	20	IDGD	
COC(=O)c1cc(F)c(Br)c(S(=O)(=O)NNC(=O)c2cccc(C)n2)c1	794599828	PQMOYRZJACWRAJ-UHFFFAOYSA-N	446.254	1.702	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C[C@H]1CN(C(=O)OC(C)(C)C)CCO1	795162490	ZZXSCWKRYPRYSO-AWEZNQCLSA-N	442.538	1.406	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(C(=O)NNc2ncnc(Cl)c2C(C)C)cc1	798142513	RYIJBXLOJQPPPF-UHFFFAOYSA-N	427.914	1.935	50	20	IDGD	
O=Cc1ccc(OCCn2cc(C(=O)NNC(=O)NCC(F)(F)F)nn2)c(Cl)c1	798316186	VOISIVADBYBUJF-UHFFFAOYSA-N	434.762	1.329	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)[C@@H]2CCCN2C(=O)c2ccc(OC)cc2)nc1C	798989648	LVGYYXGZWHKGPK-KRWDZBQOSA-N	427.461	1.718	50	20	IDGD	
N#Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)ccc1OC(F)(F)F	799833995	HFMBPAWRXBLQAI-UHFFFAOYSA-N	440.309	1.761	50	20	IDGD	
O=C(NNS(=O)(=O)c1c(Cl)nc2ccc(Br)cn12)c1cnccn1	799916090	GRVHHYSAGHCYLL-UHFFFAOYSA-N	431.659	1.164	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)N[C@H](C)CCNS(=O)(=O)c2ccccc2)cc1	802528128	QJPAKMSMIODALM-MRXNPFEDSA-N	434.518	1.461	50	20	IDGD	
Cc1cc([N+](=O)[O-])ccc1NNC(=O)c1ccc(C)c(S(=O)(=O)N2CCOCC2)c1	805385060	MVWKPRRLUFSNOB-UHFFFAOYSA-N	434.474	1.989	50	20	IDGD	
C[C@H](C#N)S(=O)(=O)c1ccc(NC(=O)NNC(=O)COc2ccccc2C#N)cc1	806456037	DLOADUJRNPAMLX-CYBMUJFWSA-N	427.442	1.476	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2cc(C#N)ccc2Cl)CC1	806872981	QARIBJHEVBKFIU-UHFFFAOYSA-N	434.909	1.300	50	20	IDGD	
Cc1cc(I)cc(NC(=O)C(=O)NNC(=O)c2ccc(C#N)cc2)c1	806978235	RYLKAXUWVBPAQN-UHFFFAOYSA-N	448.220	1.871	50	20	IDGD	
COCc1nc(Cl)cc(NNC(=O)c2cc(NS(C)(=O)=O)c(OC)c(OC)c2)n1	807235585	LUDTYYWFPRVORH-UHFFFAOYSA-N	445.885	1.422	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)N[C@@H](C)[C@H](c1ccccc1)N(C)C	807404103	YUIGSAWWMLUUQW-WMLDXEAASA-N	446.577	1.924	50	20	IDGD	
CN(C)CCOc1ccc(/C=C\C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1	808231948	HNCATXXYWMEVBN-XFXZXTDPSA-N	431.514	1.505	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(Br)s1)NNc1ncccc1[N+](=O)[O-]	810527095	GSSZZEUOFNEOBP-UHFFFAOYSA-N	436.269	1.235	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN1C(=O)Nc1ccccc1)c1csc(N2CCOCC2)n1	813366834	UBCFXZSHZKZRDG-INIZCTEOSA-N	444.517	1.437	50	20	IDGD	
Cc1cc(CNC(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)nc(N2CCCC2)n1	813855722	SNMHDSGHLRCTTP-UHFFFAOYSA-N	440.512	1.812	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCc2nncn2C1)C(=O)Nc1ccc(Cl)c(Br)c1	815691754	AFGCSZIPKOTHDL-MRVPVSSYSA-N	441.673	1.043	50	20	IDGD	
CCC(C)(C)OCc1cccc(NC(=O)C(=O)NNC(=O)[C@@H]2CCc3nncn3C2)c1C	815692087	IXJVTGYEZVEYRJ-OAHLLOKOSA-N	442.520	1.640	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@@H]2CCCN(c3ccccc3)C2=O)cc1	816596943	XZBJFZPPIRDESZ-KRWDZBQOSA-N	430.486	1.686	50	20	IDGD	
O=C(Cn1cccn1)NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2Cl)c1	842471360	KZRNQUOHKBKKDO-UHFFFAOYSA-N	433.877	1.799	50	20	IDGD	
O=C(CN1CCC(C(=O)c2ccc(O)cc2)CC1)NNC(=O)c1ccc([N+](=O)[O-])cc1	857835992	DICIYGHRROQCDX-UHFFFAOYSA-N	426.429	1.656	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](NC(=O)NCc2ccccc2)C(C)C)cc1	893071313	ABSFOIXYNOCEPM-SFHVURJKSA-N	425.489	1.605	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)[C@H]2CCCN(C(=O)Cc3ccccc3)C2)c2ccccc2c1=O	914750685	WQBHRPVQJRMTTC-KRWDZBQOSA-N	447.495	1.176	50	20	IDGD	
COc1ccc2c(c1)C[C@@H](C(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1)CO2	914782016	XXJHLIDNFPGOKC-MRXNPFEDSA-N	447.513	1.023	50	20	IDGD	
Cc1cc(C=NNC(=O)[C@H](C)CN2C[C@@H](C)O[C@H](C)C2)c(C)n1CCN1CCOCC1	915954496	GDKXOWSRBUYXME-MISYRCLQSA-N	433.597	1.633	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)COc1ccc(Br)cc1)c1nnc2ccccn12	916222319	YXSFLAWIXRSOQE-LLVKDONJSA-N	433.266	1.962	50	20	IDGD	
O=C(NCc1ccc(OCC(F)(F)F)nc1)NNC(=O)c1nnc(O)c2ccccc12	916399025	UVJYUUXAFZQBRT-UHFFFAOYSA-N	436.350	1.816	50	20	IDGD	
C[C@H]1CCCN(C(=O)C2CCN(CC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)CC2)C1	917105133	ALTTVDKKKBSGKP-HNNXBMFYSA-N	431.493	1.326	50	20	IDGD	
C[C@]12CCC(=O)N1c1ccccc1C(=O)N2CC(=O)NNC(=O)c1ccc(Cl)nc1	917252162	CWOGTDZDOPUKHA-HXUWFJFHSA-N	427.848	1.495	50	20	IDGD	
COc1cc(S(=O)(=O)NNC(=O)c2cc3c(s2)CCC3)cc(C(=O)O)c1OC	917722511	DNPBZPJZUPIZPQ-UHFFFAOYSA-N	426.472	1.576	50	20	IDGD	
Cc1ccc(C(=O)NNS(=O)(=O)c2cccc(C(=O)NCC(F)(F)F)c2)c(O)c1	917754025	WHVHSKDRQDTHEP-UHFFFAOYSA-N	431.392	1.616	50	20	IDGD	
COc1cccc([C@H](C)NC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)c1	918110396	YRUSNNCHPYEHTR-HNNXBMFYSA-N	448.549	1.414	50	20	IDGD	
CNS(=O)(=O)c1ccc([C@@H](C)NC(=O)NNC(=O)c2cc(Br)c[nH]2)cc1	919778690	HGULMIHMYFMLJF-SECBINFHSA-N	444.311	1.391	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)c1ccc(N2NC(=O)CCC2=O)cc1	920288130	OKUANRANBOVMCZ-UHFFFAOYSA-N	434.456	1.218	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1N1CCOCC1)c1cc(-c2ccccc2)[nH]n1	920425641	OJVTVNFJVHOOIH-UHFFFAOYSA-N	436.428	1.896	50	20	IDGD	
CN(C)C(=O)c1cccc(NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c1	920929343	MZXXKQXRQXGDCI-UHFFFAOYSA-N	438.532	1.753	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)n(-c2cccc(C(F)(F)F)c2)n1	920932815	HQXXFGJDPZVYIC-LLVKDONJSA-N	445.423	1.787	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)c2ccc(OC)cc2)c(OC)c1	1319557065	FJSSHZQUYJYNGP-UHFFFAOYSA-N	443.503	1.089	50	20	IDGD	
CCCS(=O)(=O)N1CCCC[C@H]1C(=O)NNC(=O)c1ccc(Br)cc1	1323784839	FMHHHNCUVHQXFN-AWEZNQCLSA-N	432.340	1.804	50	20	IDGD	
NC(=O)CC[C@H](C(=O)NNC(=O)c1ccccc1Cl)N1C(=O)c2ccccc2C1=O	1329604918	RPBXTPJRTMCIFA-OAHLLOKOSA-N	428.832	1.031	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2nccc3nc[nH]c23)C1	1777927090	LBQYHXBYUXPBOM-XBHMSOGKSA-N	435.912	1.339	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C#CC2(O)CCCCC2)C1	1779398131	IIWLUPGQHWKXOJ-DBXWQHBBSA-N	440.968	1.453	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnn3c1CCC3)C2)[C@H](F)Br	1780777354	XIHHWGQUWBFECW-RVKKMQEKSA-N	443.317	1.647	50	20	IDGD	
Cc1n[nH]c(C)c1CC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)Br)C2	1780827610	WVFOESSWXUSHST-JOKNJTHLSA-N	441.370	1.866	50	20	IDGD	
O=C(c1snnc1C1CC1)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781330177	SEICGLRFBUBAOV-WFASDCNBSA-N	433.303	1.550	50	20	IDGD	
C[C@H](Oc1cccnc1)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781335516	UIPAYIROHQJBQS-DXCKQFNASA-N	430.274	1.369	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(O)cn1)C2	1781996919	YEFIKLOXCBILJD-WBHUJUFNSA-N	426.311	1.698	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCc1cnc[nH]1)C2	1781997503	YWUZMZOKNHERCW-JCKWVBRZSA-N	427.343	1.640	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Br)C2)[C@@H]1C[C@H]2CC[C@@H]1O2	1782022908	AEOBXEJLKVFWFW-WDMREZPVSA-N	433.318	1.758	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C[C@](C)(O)CC(=O)O)C1	1782201784	AULTYCSSUNLYIH-VOBQZIQPSA-N	432.945	1.381	50	20	IDGD	
CC(C)Cc1cc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](C)Br)C3)C2)n(C)n1	1783532394	HOCMNWBSWQCAMX-KUHUBIRLSA-N	441.370	1.846	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3[nH]cnc3-c3cccnc3)CCO2)C1	1783535618	AOPPZRDFICWNQJ-YJYMSZOUSA-N	448.321	1.699	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(OC(F)F)cn3)CCO2)C1	1783873407	OIFWDBYQRLHKAT-SCLBCKFNSA-N	433.839	1.380	50	20	IDGD	
Cc1nccn1[C@H](C)C(=O)N1CC[C@]2(CN(C(=O)[C@H](C)CBr)CCO2)C1	1784628624	LHTLKPXXYWEWDF-HBUWYVDXSA-N	427.343	1.613	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(CCN(C(=O)CCNC(=O)c3ccccc3)C2)C1	1785331775	BWVSRAZFWSFWFT-QFIPXVFZSA-N	447.608	1.488	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnnc(Cl)c3)[C@H]2C1	1785446893	PNHKVUKJEYZYKS-XWUBHJNHSA-N	445.745	1.754	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCBr)[C@H]2C1	1786407739	QCTFGHHBSUYESX-RHYQMDGZSA-N	426.149	1.535	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CC3CC3)[C@H]2C1	1786626450	INPARBIVFKUBQW-QAETUUGQSA-N	443.972	1.898	50	20	IDGD	
C[C@H](Nc1cccnc1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21	1786862128	QTIPPRGDYKSJOQ-OTRWWLKZSA-N	439.354	1.647	50	20	IDGD	
CC(=O)O[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)C(C)C	1788479462	FMFYQLJNZCIIDY-YTFOTSKYSA-N	437.306	1.244	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nc4ccccn4n3)C[C@@H]21	1788764875	OEPLCZOZFKVVBV-JYJNAYRXSA-N	431.569	1.174	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CNC(=O)c3ccco3)C[C@@H]21	1789866768	YWFBPGOELKOXCB-VODUFIJXSA-N	446.331	1.225	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)ccc3O)C[C@@H]21	1789871752	IYTHYVKTLAYUKS-WNZPGNDNSA-N	431.316	1.927	50	20	IDGD	
Cc1nnc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]3C2)s1	1791057917	KTGVFQPRVHHHAM-IXOXFDKPSA-N	431.356	1.152	50	20	IDGD	
C[C@@H](Oc1cccnc1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CO[Si](C)(C)C)C[C@@H]21	1791655736	UVQCFKXHBNCEJI-NEPXVJNWSA-N	435.597	1.680	50	20	IDGD	
CCOc1ncccc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)Br)C2	1792382012	RWDJLJNKTCVPHN-XPCVCDNBSA-N	426.311	1.467	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)n1cccc1C=O)C2	1792868475	YLLKWWLMKLOSSQ-WVCIDPQESA-N	440.338	1.482	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)nc(Cl)c1)C2	1792870137	HUCQBABDFPQEJO-BTABJRDXSA-N	446.729	1.675	50	20	IDGD	
Cc1ccc(C)n1-c1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](O)CCl)cc1	1792980832	VXJQUXKJRBWYFT-YHELAOLJSA-N	445.947	1.897	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1CC(O)C1)C2	1794141302	DTTPCVOHXNMUIP-PYGQZDJESA-N	429.945	1.528	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnc(OCF)cn1	1794409472	CLYQTLZWVUXTHP-OXIQGZBJSA-N	445.289	1.159	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(C(F)F)no1	1795913269	KGHAFNHZCJGRGI-XHSYRHOGSA-N	436.253	1.846	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](COC)NC(=O)OC(C)(C)C	1796844216	ZDTUBTWDVXHCGI-QRJUGERDSA-N	447.960	1.418	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc3ccccn3n1)C2	1796892521	KKAMNIMXJMJLAK-BQYPDTMYSA-N	447.499	1.720	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cnc3ccccn13)C2	1797953791	HMVRCPPSCAQVDT-VPTLXERWSA-N	430.581	1.318	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cn3c(F)cccc3n1)C2	1799279376	LKPMFOHXTLEUFW-JZGBQWHFSA-N	443.306	1.913	50	20	IDGD	
COc1cc(F)ccc1CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Br	1799350584	YJQUTGJBEGTTIM-CZAMWMTLSA-N	447.276	1.657	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)c1ccc(OCC2CC2)cc1F	1799422104	MAXYGAWYHDFXGA-FTUNRGFVSA-N	440.899	1.417	50	20	IDGD	
Cc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCBr)C3)nc2nccn12	1799988752	KAOJZAXAMPCOGU-YWVIFJGQSA-N	436.310	1.026	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C[C@H]1COc3ccccc3O1)C2	1800971397	YLFOQXDXHIENJG-OYFMXXACSA-N	438.908	1.060	50	20	IDGD	
CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](Cl)COC	1800983321	YIZUVPJBBUMJEC-QRJUGERDSA-N	447.960	1.133	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CSc2ccncc2)[C@@H]1c1cccnc1)[C@H](O)CCl	1803136813	VVOKXKSHYXBVBF-KVSKMBFKSA-N	434.949	1.874	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)/C=N/O[C@@H]2CCCCO2)[C@@H]1c1cccnc1)[C@H](O)CCl	1803142752	IDTILXNXECIRQL-MHVLGXLCSA-N	438.912	1.216	50	20	IDGD	
COc1ccc(F)cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnccc1C(=O)NN)C2	1803610972	RZRZDYGNNXHYRV-QDMKHBRRSA-N	441.463	1.398	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H](CNC(=O)[C@@H](C)CC(N)=O)[C@@H]1c1cccnc1	1803671840	NNIVUEYMJVNNBQ-GUSZCTEKSA-N	439.354	1.772	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2cccnc2C(N)=O)[C@H]1c1cccnc1	1804812279	SBXFGTOZDSOZLC-QILLFSRXSA-N	429.908	1.913	50	20	IDGD	
CC[C@@H](NC(N)=O)C(=O)N1CCC2(CCCN(C(=O)[C@H](C)CBr)C2)CC1	1805384576	OZRTWXLIHOKNRK-ZIAGYGMSSA-N	431.375	1.696	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1cccs1	1805385710	UUDDNBIKWFEOFB-FXAWDEMLSA-N	435.314	1.456	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)Cc2cccs2)[C@@H]1c1cccnc1	1807552319	SYBUKWRSKUALLB-VGSWGCGISA-N	443.573	1.765	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)[C@H](C)N2CCN(C)CC2)[C@@H]1c1cccnc1	1807873847	BSBCQNVUVLHRGH-RNQOJCNYSA-N	436.000	1.741	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H](CNC(=O)c2cc(O)nc(O)n2)[C@@H]1c1cccnc1	1808295522	KSRFDQJOYGVYCO-CJNGLKHVSA-N	433.896	1.867	50	20	IDGD	
Cc1nnc(CC(=O)N2CC[C@H](CNC(=O)[C@H](F)Br)[C@@H]2c2cccnc2)o1	1808661275	HQTGYIXDXHZRTQ-KCXAZCMYSA-N	440.273	1.712	50	20	IDGD	
O=C1Cc2cc(C(=O)NC[C@@H]3CCN(C(=O)[C@H](O)CCl)[C@H]3c3cccnc3)ccc2N1	1809683443	IKJVGWWKDLJUAA-CVAIRZPRSA-N	442.903	1.496	50	20	IDGD	
CCc1ncsc1C(=O)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1	1809971002	HCSHFRDINNVNBI-UHFFFAOYSA-N	441.362	1.544	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1CCN(C(=O)CSCC(=O)O)[C@@H]1c1cccnc1	1810549248	ZGZGSINMGXOVPJ-HNAYVOBHSA-N	439.610	1.757	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)/C=C\C(=O)NC2CC2)[C@@H]1c1cccnc1	1812866090	HILQDQRDPRMFRX-RGQFZIAOSA-N	449.349	1.706	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)CCc2cnn(C)c2)[C@@H]1c1cccnc1	1813032912	ZBVDGEXZNDEDSQ-WSTZPKSXSA-N	433.940	1.708	50	20	IDGD	
Cc1ncsc1C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1813070378	IGWSFPZQOXVWNT-APWZRJJASA-N	444.561	1.539	50	20	IDGD	
CN(C)C(=O)NCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@](C)(Cl)CCl)[nH]n1	1814564197	XBGMMWXVWWAWKP-YVEFUNNKSA-N	433.340	1.909	50	20	IDGD	
Cc1ccoc1C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1	1815341332	WPZXOFCXEDRMDT-CQSZACIVSA-N	425.275	1.264	50	20	IDGD	
O=C(CCBr)N[C@@H]1CCc2nc(NC(=O)c3cnc(O)nc3O)sc2C1	1817082119	XCWHGXCPXGHVOK-SSDOTTSWSA-N	442.295	1.355	50	20	IDGD	
O=C1NCCCn2nc(C(=O)N3CCCC[C@@H]3c3cc(NC(=O)[C@@H](F)Cl)n[nH]3)cc21	1818038981	HHDCTKHBEMZPDU-IUODEOHRSA-N	437.863	1.580	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)C#CC2CC2)[nH]n1	1818110660	MWNCQFSLDPGCOL-VBYICHLGSA-N	435.488	1.949	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)Cc2ccccn2)[nH]n1	1819403144	WABAXEBLEINLEK-SFHVURJKSA-N	448.487	1.352	50	20	IDGD	
C[Si](C)(C)OCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1nc[nH]c1[N+](=O)[O-])CC2	1820164783	JCOGYBRZMDQIKN-SECBINFHSA-N	438.542	1.852	50	20	IDGD	
Cc1ccc(O)c(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)c1	1820462154	AOYGEVYDNYDMRI-LJQANCHMSA-N	448.288	1.723	50	20	IDGD	
Cn1ccc(=O)cc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCBr)CC2	1821309262	CTLSIOXMQPLXNY-SNVBAGLBSA-N	439.335	1.853	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@H]1CCc2nc(NC(=O)c3ccccc3)sc2C1	1821837452	RZMDHOBWCOFYQM-ZDUSSCGKSA-N	436.497	1.681	50	20	IDGD	
CC[C@@H](Br)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H]2C[C@H](O)CN2)[nH]n1	1822091092	WABRDIXUPBFTDG-UZGDPCLZSA-N	428.331	1.298	50	20	IDGD	
C[C@](O)(CC(=O)O)CC(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](F)Br)[nH]n1	1822411442	YZMAKEOVHDDDOV-JMPLFQLZSA-N	449.277	1.708	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@H](O)CCl)CC2)c1ccnc2ncccc12	1824087111	WHBBMXXVNBNHJF-QMTHXVAHSA-N	431.905	1.912	50	20	IDGD	
O=C1Cc2cccc(C(=O)Nc3nc4c(s3)C[C@@H](NC(=O)[C@H](O)CCl)CC4)c2N1	1824198852	NJJXDAHWCFFIHP-GXFFZTMASA-N	434.905	1.463	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)C[C@@](C)(O)CC(=O)O)CC2	1825647072	IMPPKNHKFJQMMI-AGRCIMAESA-N	448.339	1.454	50	20	IDGD	
CCOC(=O)C1(C(=O)N[C@H]2CCc3nc(NC(=O)[C@H](Cl)COC)sc3C2)CC1	1826004638	PPMKEDZEUQQOKY-WDEREUQCSA-N	429.926	1.652	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@H]1CCc2nc(NC(=O)CCn3cncn3)sc2C1	1826608526	NJHXICLQHFVLIV-QFYYESIMSA-N	431.349	1.973	50	20	IDGD	
CCc1oncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827054756	JHNPHNHFFTZBPU-HXUWFJFHSA-N	439.321	1.464	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccnc4c3OCO4)C2)C1	1830364680	PALZOMMIDMUGJO-HXUWFJFHSA-N	439.896	1.145	50	20	IDGD	
O=C(C#Cc1ccc(Cl)cc1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1830468751	SPSBKVAROSNIBR-IEBWSBKVSA-N	429.275	1.682	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H]2CCCS2(=O)=O)CC1	1831286225	STHMDJIGBWMADG-BBWFWOEESA-N	434.986	1.437	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3c(C)nn(C)c3C)C2)C1	1831639841	DXRRJGRGAYKHCB-UZLBHIALSA-N	426.945	1.514	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccccc3C(N)=O)C2)C1	1831653504	GVJRTJZZTGNGMS-UWJYYQICSA-N	437.924	1.263	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CSc2nc[nH]n2)CC1	1831838066	YOMPYYSCBVNOLB-LSDHHAIUSA-N	429.974	1.770	50	20	IDGD	
CCn1nc(C)cc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1	1831871218	NLAQNIYONILJHX-IBGZPJMESA-N	446.596	1.818	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)C(F)(F)C(F)F)CCO2	1832190952	OIJFBFANZUPBRA-HNNXBMFYSA-N	430.471	1.195	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3cccc(C)n3)CCO2)C1	1832618676	NHECSSIWOZYRAC-NQIIRXRSSA-N	439.940	1.033	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cn3nc(C)cc3C)CCO2)C1	1833035357	BWCDHIRVZCVUPT-YLJYHZDGSA-N	426.945	1.364	50	20	IDGD	
C#CCO[C@H](C)C(=O)N1CCC(N2CCC(NC(=O)[C@H](C)CBr)CC2)CC1	1833265263	RQVKQAXDHCVHCF-HZPDHXFCSA-N	442.398	1.627	50	20	IDGD	
O=C(CCCc1ccncc1)NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1833843334	GVUAZXPTQPQKPP-FQEVSTJZSA-N	436.984	1.576	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC(N2CCC(NC(=O)c3ccc[n+]([O-])c3)CC2)CC1	1833908769	QKDBIQQXQRBWMJ-UHFFFAOYSA-N	434.613	1.357	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)Cc3ccc(F)cn3)C2)C1	1834822429	NGPIPVWMQPGWCM-GOSISDBHSA-N	444.301	1.005	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@]3(CN(C(=O)CCBr)CCO3)C2)cc1F	1834823753	IJQYPPSVYDTERV-IBGZPJMESA-N	443.313	1.989	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC(N2CCC(NC(=O)c3cc[n+]([O-])cc3)CC2)CC1	1836052038	KCJKDYDBECGMRH-UHFFFAOYSA-N	434.613	1.357	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](F)Cl)CC2)CC1)c1ccnc2c1OCO2	1836092527	ASBRWONWOZYASN-INIZCTEOSA-N	426.876	1.530	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC1CCN(C2CCN(C(=O)c3cc[n+]([O-])cc3)CC2)CC1	1836399897	PXSIJQSCNBRVSF-FQEVSTJZSA-N	443.375	1.742	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc4cnccc34)CCO2)C1	1837036751	ZEWPIIHETIIXPR-UGKGYDQZSA-N	447.919	1.559	50	20	IDGD	
O=C(CCC(=O)N1CCC(OC2CCN(C(=O)[C@@H](F)Cl)CC2)CC1)N1CCCC1	1837065572	YDOLBEPHFUUYKF-LJQANCHMSA-N	431.936	1.922	50	20	IDGD	
Cc1cnc(C(=O)N2CCOC[C@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)s1	1837712203	ITRRPHZWUXPJET-SFHVURJKSA-N	427.599	1.373	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3ccc4nn[nH]c4c3)CC2)CC1	1838719225	UJORFGOVFDWHIP-QGZVFWFLSA-N	449.939	1.824	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)CCCn3ccnc3)CC2)CC1	1838786684	QBDJMEXLGLJQIU-IBGZPJMESA-N	440.972	1.916	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3n[nH]c4c(F)cccc34)C2)C1	1839145972	SJBFUZTUUJFRMI-JLTOFOAXSA-N	438.887	1.789	50	20	IDGD	
Cc1cncc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)c1	1839197766	IBDPWZFUEHHHHR-WMLDXEAASA-N	430.274	1.151	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)cc1	1839201898	NAPKYINEEANYFD-CRAIPNDOSA-N	429.286	1.756	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccnc4ncccc34)CCO2)C1	1839541300	YCAGMYRGPWSZEH-JOCHJYFZSA-N	446.935	1.965	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3c(C)n[nH]c3C)C2)C1	1839965226	QZNZXFSPNDQEIQ-KDOFPFPSSA-N	443.342	1.270	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(F)cc3F)C2)C1	1840153911	FPDLLKZLYSVIFR-HNAYVOBHSA-N	432.851	1.289	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc4ccoc34)C2)C1	1840154752	FNKNVBXTBRUURF-LAUBAEHRSA-N	436.892	1.757	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)ncc1[N+](=O)[O-]	1840187540	IBAFBHIKYJAJBM-QGZVFWFLSA-N	447.275	1.172	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CC[C@H](O)CC1)CCO2	1840271503	BDXBIRGPOUWOMT-NNFUDEMPSA-N	447.370	1.167	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@@H](C(=O)N2CC3(CCCN3C(=O)[C@@H](O)CCl)C2)C[C@H]2C[C@H]21	1841348717	ZNABXKCAYSTELK-TUVASFSCSA-N	427.929	1.187	50	20	IDGD	
C[C@@H]1CC[C@@H](C(=O)N2CC3(CCCN3C(=O)[C@H](O)CCl)C2)CN1C(=O)OC(C)(C)C	1841348956	WRPOVLPVYRIEFA-BZUAXINKSA-N	443.972	1.825	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2cc(O)nc(Cl)c2)C1	1842246311	AVTFRBAWAZUHJJ-WYMPLXKRSA-N	444.879	1.392	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2ccnc(C(F)(F)F)c2)C1	1842328416	WTNCFFAXUWMPDT-UHFFFAOYSA-N	448.405	1.230	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@H]2O)C1	1843824736	DDSLUFLGNXKDHW-HRCADAONSA-N	443.972	1.825	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)c2ccc([N+](=O)[O-])c3c2OCO3)C1	1844758972	SGSNRMCPAJARAN-GFCCVEGCSA-N	425.825	1.394	50	20	IDGD	
O=C(c1ccc(OCCCO)cc1)N1CC2(CCCN2C(=O)[C@@H](F)Br)C1	1845218548	LTTPMFUYNRHFCZ-OAHLLOKOSA-N	429.286	1.955	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1ncc(Cl)cc1Cl	1847203601	MFDJIRAIBFSLGF-GJZGRUSLSA-N	449.298	1.516	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H]1CC(=O)N(c2cccc(OC)c2)C1	1847218857	DFXSJEYURXTBRI-QZHFEQFPSA-N	449.935	1.504	50	20	IDGD	
Cn1nccc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1848095845	VBTMTUNMFJTKLZ-IHRRRGAJSA-N	425.917	1.368	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CCN1CCCC1	1848099074	VKNJAQUPYSFJDU-ULQDDVLXSA-N	442.988	1.806	50	20	IDGD	
Cc1noc(C)c1C(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	14804226	OQRFDSUKERXNQC-UHFFFAOYSA-N	428.470	1.845	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)cn1	16228534	CAWFMUZJHRGMNE-UHFFFAOYSA-N	429.436	1.923	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)[C@H](C)NS(=O)(=O)c1ccc(C)cc1	27266016	BUHDIHYIAIAGQK-LBPRGKRZSA-N	425.894	1.785	50	20	IDGD	
CN1CCN(S(=O)(=O)N2CCN(C(=O)CCCC[C@H]3CCSS3)CC2)CC1	106141041	WVKDDEVRFFLTIJ-INIZCTEOSA-N	436.669	1.337	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)CCC(=O)N2CCc3sccc3C2)nc2ccccc21	117522387	PHGXRSQRHMXOEW-UHFFFAOYSA-N	425.514	1.690	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)c1ccc(C)cc1)C(=O)NNC(=S)NC(C)(C)C	726135419	KNDKTFONVJVEIP-AWEZNQCLSA-N	432.637	1.689	50	20	IDGD	
O=C(CN1CCC(C(=O)Nc2ccc(F)cc2)CC1)NNC(=O)c1ccc([N+](=O)[O-])cc1	726183482	GRYNJDNGBOBWEU-UHFFFAOYSA-N	443.435	1.846	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)CSC[C@@H]2CCCCO2)cc1	727364337	SNIBKHMBLPQEBJ-HNNXBMFYSA-N	429.564	1.065	50	20	IDGD	
O=C(NNC(=O)N1CCCN(Cc2cscn2)CC1)c1cc(Br)c[nH]1	727473713	RAJFPQRUYCVSSN-UHFFFAOYSA-N	427.328	1.796	50	20	IDGD	
COc1ccc(CN2C[C@@H](C(=O)NNC(=O)CNc3cccc(OC)c3)CC2=O)cc1	728207751	GMNDTVKZLHSHEJ-INIZCTEOSA-N	426.473	1.312	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)ccc1OCC(=O)OC	728454953	BXFDEMQSIVCIHG-SFHVURJKSA-N	430.413	1.238	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)c1ccc(Cl)c(S(=O)(=O)N2CCCCC2)c1	728852125	MUZHEFHSZSXJHW-UHFFFAOYSA-N	436.921	1.913	50	20	IDGD	
CCN(C)c1ccccc1CNC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1	730134501	CKCROYDPKCQAPV-UHFFFAOYSA-N	447.561	1.602	50	20	IDGD	
O=C(NNC(=O)c1cccc(OC(F)F)c1)NNC(=O)c1cnn(-c2ccccc2)c1	733346140	MVUBOLMGNDGGOC-UHFFFAOYSA-N	430.371	1.763	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)NC2CCN(C[C@H]3CCCO3)CC2)cc1	734280075	DINAMSSOTUMSHN-OXJNMPFZSA-N	434.537	1.826	50	20	IDGD	
O=C(CC12CC3CC(CC(C3)C1)C2)NNC(=O)N[C@H]1CCN(CCN2CCOCC2)C1	734686459	ODZBHBBHFFYFKF-QSVDNLTKSA-N	433.597	1.330	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)c(-c2cccnc2)n1	734825107	UTAINDNXMGCGGW-UHFFFAOYSA-N	443.508	1.826	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)N[C@@H](C)CN2CCN(c3ccccn3)CC2)c1	735518431	JPHZEGGNAOBHTO-INIZCTEOSA-N	442.520	1.254	50	20	IDGD	
O=C(C[C@H](C(=O)NN=Cc1cccc(F)c1)N1CCOCC1)NN=Cc1cccc(F)c1	741766361	KLHUPPOLNUKIHH-HXUWFJFHSA-N	443.454	1.656	50	20	IDGD	
O=C(Cn1nc(-c2ccccc2)ccc1=O)NNC(=O)c1cc(Br)ccc1O	743732386	SVBJPNGICAUQII-UHFFFAOYSA-N	443.257	1.840	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)c2cc(N3CCOC3=O)ccc2F)cc1	745133247	ARYWGISMRUJQDL-UHFFFAOYSA-N	426.360	1.272	50	20	IDGD	
CC1(C)[C@H](NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)[C@H]2CCCO[C@H]21	745859862	FTWPJGFXNFLJNS-HMXCVIKNSA-N	429.565	1.733	50	20	IDGD	
Cc1noc(C)c1S(=O)(=O)NC1(C(=O)NNC(=O)c2ccc(C#N)cc2)CCCC1	746185838	UGMXGBSQKRRWOK-UHFFFAOYSA-N	431.474	1.215	50	20	IDGD	
O=C(COC[C@H]1CCCO1)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	746386820	VNBNJRDMCIWSOI-CYBMUJFWSA-N	439.515	1.506	50	20	IDGD	
C[C@@H]1Cc2cc(C(=O)NNC(=O)Cc3cn4ccccc4n3)ccc2N1S(C)(=O)=O	746548470	IGNBJEBWBFUBJZ-CYBMUJFWSA-N	427.486	1.049	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NNC(=O)c2csc(N3CCOCC3)n2)c(C)c1	749152456	PWBBPEXZDWWDHX-UHFFFAOYSA-N	426.520	1.310	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)N2CCN(/C(=C/C#N)c3ccc([N+](=O)[O-])cc3)CC2)C[C@@H](C)O1	750035587	GJIHTYAZCFUNSU-CSMDERHNSA-N	435.506	1.431	50	20	IDGD	
O=C(COC(=O)[C@@H]1CCCN1Cc1ccc(F)cc1)NNC(=O)c1cccc([N+](=O)[O-])c1	750503913	PKBSFNPSHICZPO-SFHVURJKSA-N	444.419	1.703	50	20	IDGD	
C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NNC(=O)CNC(=O)c1cccs1	751211939	NABTYSXFDVHVIM-SECBINFHSA-N	426.838	1.654	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@](C)(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)C1	751886987	BDHKDYFHYUDRKK-QFIPXVFZSA-N	446.552	1.878	50	20	IDGD	
C[C@H](C(=O)N1CCCC1)N1CCN(C(=O)NNC(=O)Cn2ccc3ccccc32)CC1	755154346	UMPVKMPEATUGQQ-QGZVFWFLSA-N	426.521	1.011	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)N2CCN([C@H](C)C(=O)N3CCCC3)CC2)c1C	755727832	KYRUXUHKGKLQFW-JFLDFIPSSA-N	441.576	1.813	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)Nc2cccc(N3C(=O)CN(C)C3=O)c2)c1	755996374	WNFZWZYPNWAMDO-UHFFFAOYSA-N	427.417	1.569	50	20	IDGD	
CC(C)(C)OC(=O)Nc1ccccc1CC(=O)NNC(=O)CNC(=O)c1cccnc1	756138108	KFVLVZKPPHNYFG-UHFFFAOYSA-N	427.461	1.549	50	20	IDGD	
CC(C)(C)OC(=O)NCc1cccc(NC(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)c1	756526902	SFLBPXMXTXTJCS-ZDUSSCGKSA-N	426.495	1.299	50	20	IDGD	
Cc1nn(C)c(C)c1[C@H](NC(=O)NNC(=O)COc1ccccc1[N+](=O)[O-])C(F)(F)F	757885730	KLXWZDRODDSQEI-HNNXBMFYSA-N	444.370	1.958	50	20	IDGD	
CCS(=O)(=O)NCC(=O)NNC(=O)c1ccc(CSc2nc3ccccc3[nH]2)cc1	758054109	XGYFBEZWJNIJDS-UHFFFAOYSA-N	447.542	1.556	50	20	IDGD	
O=C(NCC1(c2ccccc2Br)CC1)NNC(=O)C(=O)Nc1ccccn1	758804742	RIWJGVYEZGRECP-UHFFFAOYSA-N	432.278	1.845	50	20	IDGD	
CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)NNC(=O)C(=O)Nc2ccccn2)CC1	758833315	FYMHMWYACSXCLW-UHFFFAOYSA-N	426.433	1.626	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)c2cncnc2)c1	760802438	XPIOWNPNMWSAMR-UHFFFAOYSA-N	427.442	1.361	50	20	IDGD	
Cc1cc(Cl)c([N+](=O)[O-])cc1S(=O)(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	761885956	JNOUFQDAQVJOMZ-UHFFFAOYSA-N	437.825	1.156	50	20	IDGD	
COc1cccc(C[C@H](C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)n2nnnc2C)c1	762939558	TYGFFYSXOASNGI-HXUWFJFHSA-N	446.471	1.625	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NN=Cc1cnn(-c2ccc(Br)cc2)c1	763193109	MYCJMVHKHYKRER-UHFFFAOYSA-N	427.262	1.910	50	20	IDGD	
O=C(NNC(=O)c1ccccc1)C(=O)Nc1cccc(F)c1I	763429958	CMMDFORBSHTRHH-UHFFFAOYSA-N	427.173	1.830	50	20	IDGD	
CCOC(=O)c1cc(Br)ccc1NC(=O)C(=O)NNC(=O)c1ccncc1	763462027	HYODBHWMPCLNNR-UHFFFAOYSA-N	435.234	1.421	50	20	IDGD	
CCc1ccccc1NC(=O)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	763507812	GKFFVDXJUVEGTA-UHFFFAOYSA-N	444.513	1.433	50	20	IDGD	
O=C(NNC(=O)c1c[nH]c2ccccc12)C(=O)Nc1ccc(NC(=O)[C@@H]2CCCO2)cc1	763534494	GWWOBCFKSYKMLU-SFHVURJKSA-N	435.440	1.685	50	20	IDGD	
Cc1cc(Br)cc(C)c1NC(=O)C(=O)NNC(=O)[C@@H]1COc2ccccc2O1	763576433	AEIFMMXCMAFLCE-HNNXBMFYSA-N	448.273	1.992	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)C(=O)Nc2ccc3c(c2)C(=O)NCC3)c1	763598059	SZYWGIJOXMPAGE-UHFFFAOYSA-N	438.484	1.569	50	20	IDGD	
CC(=O)NCc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C(C)(C)C)cc2)cc1	763599646	JUFMIXQZZVPTNQ-UHFFFAOYSA-N	440.500	1.785	50	20	IDGD	
CCn1nc(C)c(NC(=O)C(=O)NNC(=O)COc2cccc(C(F)(F)F)c2)c1C	763641495	WKMUTXDZXWERJA-UHFFFAOYSA-N	427.383	1.704	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(C)c(S(C)(=O)=O)c2)cc1C	763666495	GOAMVBFDHLMBLL-UHFFFAOYSA-N	433.486	1.180	50	20	IDGD	
CCc1ncc(NC(=O)C(=O)NNC(=O)COc2ccc(OCc3ccccc3)cc2)cn1	763681273	VSJYREKRKITHBL-UHFFFAOYSA-N	449.467	1.783	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cc(C#N)ccc2OC(F)F)cc1	763682706	YUHDSHDUCSSXBJ-UHFFFAOYSA-N	429.339	1.196	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(C(=O)NC(C)C)c(C)c1	763712175	MVSPLOCKBUKTDP-UHFFFAOYSA-N	440.500	1.861	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cccnc2OCC(F)F)c1C	763840384	KJCDRRJUCOGZCB-CYBMUJFWSA-N	436.415	1.896	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)ccc1F	763851873	FYRUEPORMORFRM-ZDUSSCGKSA-N	431.420	1.783	50	20	IDGD	
C=CCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)cc1	763871628	IBZBVBLPEYHCHY-CYBMUJFWSA-N	428.420	1.295	50	20	IDGD	
CCOC(=O)/C=C\c1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)cc1	763872873	PODNBRHFKQBBMZ-XMRSSTEGSA-N	443.431	1.955	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1cccc(C(=O)NC2CC2)c1	763873026	RLZMSEYQPNTOQW-LBPRGKRZSA-N	428.420	1.271	50	20	IDGD	
Cc1nc(-c2ccccc2NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)no1	763873472	TYJPGWUOZRXNPP-NSHDSACASA-N	427.392	1.738	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cncnc2N(C)C)ccc1OCCC(C)C	763914475	MYUGPDJVFKZQRK-UHFFFAOYSA-N	444.492	1.376	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3ccc4c(c3)NC(=O)[C@H](C)O4)cc2C1	763943086	QRDHXCNNXYXXRC-QWRGUYRKSA-N	442.497	1.992	50	20	IDGD	
COc1cc(Cl)c(C)cc1NC(=O)C(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	763945597	ZXDFAXKRCLMZTJ-UHFFFAOYSA-N	443.847	1.948	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)cc1C(=O)OC	763978494	JWJDVSBVSHHJPH-UHFFFAOYSA-N	449.803	1.019	50	20	IDGD	
COC(=O)[C@H]1CN(C(=O)C(=O)NNC(=O)Cc2cccc3ccccc23)c2ccccc2O1	764019555	PHJAWGNOYVGQNF-HXUWFJFHSA-N	447.447	1.497	50	20	IDGD	
C[C@H]1CN(Cc2ccccc2NC(=O)C(=O)NNC(=O)Cc2ccsc2)C[C@H](C)O1	764034675	TYZPKTMSCUCTJV-GJZGRUSLSA-N	430.530	1.686	50	20	IDGD	
CS(=O)(=O)NCc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3c2)cc1	764064889	RQINUADNKDQBHA-UHFFFAOYSA-N	440.481	1.289	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(NC(=O)c3ccccc3)nc2)c(O)c1	764105444	RVRKRPNCRMVSQN-UHFFFAOYSA-N	433.424	1.748	50	20	IDGD	
CC(=O)N(C)c1cccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(C)cc3)[nH]n2)c1	764110343	ICWSBRGNJMBCHV-UHFFFAOYSA-N	434.456	1.768	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc([S@@](=O)C(F)(F)F)cc2)c1O	764131083	MOROZJHFEQNNGH-SSEXGKCCSA-N	445.375	1.428	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1cc(F)c(Br)c(F)c1	764275749	SYVTVZGJABXHCE-UHFFFAOYSA-N	444.188	1.598	50	20	IDGD	
Cc1nc(COc2ccc(NC(=O)C(=O)NNC(=O)CCc3ccccc3O)cc2)no1	764281293	QLKYRYYSBNWHTJ-UHFFFAOYSA-N	439.428	1.381	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)C(=O)Nc1ccc([S@](=O)C(F)(F)F)cc1	764289680	XYRVJWCLQSLSJJ-PMERELPUSA-N	443.403	1.738	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)C(C)(C)c2ccccc2)c(=O)n(-c2ccccc2)n1C	764309947	XPEICPUXVITYND-UHFFFAOYSA-N	435.484	1.548	50	20	IDGD	
O=C(NNC(=O)C1CCC1)C(=O)Nc1ccc(CCn2cc(Br)cn2)cc1	764334181	ADKWSGINYHWOJT-UHFFFAOYSA-N	434.294	1.774	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)[C@@H](C)NS(=O)(=O)c2cccc(C#N)c2)c1	764526636	YFODHSWKLLRKJL-OAHLLOKOSA-N	430.486	1.068	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)OC(C)(C)C)cc1S(=O)(=O)N1CCOCC1	765114017	OKXPHVXULLXULK-UHFFFAOYSA-N	430.483	1.277	50	20	IDGD	
CCCn1ncc(C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)c1C1CC1	765531502	VRDRXQYTJSOUPL-UHFFFAOYSA-N	433.534	1.561	50	20	IDGD	
COc1ccc(N2C[C@@H](C(=O)NNC(=O)c3cc(-c4cccs4)[nH]n3)CC2=O)cc1	765568989	BHKZNTCBMYQZEF-LBPRGKRZSA-N	425.470	1.961	50	20	IDGD	
O=C(NNC(=O)c1ccccc1O)c1cc(I)cc([N+](=O)[O-])c1	765788874	QWBVGYPJGRXQNN-UHFFFAOYSA-N	427.154	1.980	50	20	IDGD	
COC(=O)c1nccc2c(S(=O)(=O)NNC(=O)c3cccc(OC)c3O)cccc12	766316837	BVZZWTOGRWPUAL-UHFFFAOYSA-N	431.426	1.359	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)Cc3cc4ccccc4nc3O)CC2)cc1	766646598	UHUNJKJRPKDUQC-UHFFFAOYSA-N	447.539	1.757	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)c1[N+](=O)[O-]	768069224	AZNBXPBOLMJXGP-UHFFFAOYSA-N	441.488	1.491	50	20	IDGD	
CC(C)(C)OC(=O)N1CCO[C@H](C(=O)NNc2nc(Br)cn3ccnc23)C1	768225826	DALCIWNBHKEEFD-JTQLQIEISA-N	441.286	1.571	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3csc(NC4CC4)n3)CC2)cc1	769303307	VKMAUMRQPSGUON-UHFFFAOYSA-N	428.562	1.605	50	20	IDGD	
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N([C@@H]1CCS(=O)(=O)C1)N(C)C	769621065	LWYXMWPIXKQSCP-VQIMIIECSA-N	434.562	1.344	50	20	IDGD	
CN1CC(=O)N(Cc2ccc(C(N)=O)cc2NC(=O)NNc2ncccc2Cl)C1=O	770061800	XCZXUTOUAAIQTC-UHFFFAOYSA-N	431.840	1.377	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)NC1CCN(S(=O)(=O)C2CC2)CC1	770649979	SFIXUWLAZOTZBH-LBPRGKRZSA-N	444.941	1.394	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1ccc(OC)c(S(=O)(=O)NC2CCCC2)c1	771867526	LDGUNZVSCFNTSX-LBPRGKRZSA-N	441.506	1.019	50	20	IDGD	
C#CCOc1ccccc1NC(=O)C(=O)NNC(=O)c1cc(OC)ccc1Br	773497100	TYFRCEDKDZGRBR-UHFFFAOYSA-N	446.257	1.869	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(C(F)(F)F)cn2)cc(OC)c1OC	773510013	DFLKVNGPWIZAEX-UHFFFAOYSA-N	442.350	1.526	50	20	IDGD	
C[C@H](CN(C)Cc1ccccc1)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	776079527	FAVKDQYMQZZUPS-MRXNPFEDSA-N	447.561	1.401	50	20	IDGD	
COc1ccccc1[C@@](N)(C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)C(F)(F)F	776117608	SUVLALBDIHBCNV-QGZVFWFLSA-N	445.419	1.276	50	20	IDGD	
Cc1ccc([C@]2(C)NC(=O)N(CC(=O)NNc3cccc(S(C)(=O)=O)c3)C2=O)cc1	776537274	ANNILIXRBNXZSV-FQEVSTJZSA-N	430.486	1.309	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)nn1-c1ccc(Cl)c(Cl)c1	776751721	DNDGYOIJJXPLQF-JTQLQIEISA-N	431.301	1.683	50	20	IDGD	
CCOC(=O)N1CCC([C@H](C)NCC(=O)NNC(=O)c2ccc(OC)c(OC)c2)CC1	778227847	TZUNIVPPCQLZOA-AWEZNQCLSA-N	436.509	1.311	50	20	IDGD	
C[C@H](CNC(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccc(Cl)cc1)S(N)(=O)=O	782037690	LDMPEFINDRZFLY-GULXKOIASA-N	446.920	1.817	50	20	IDGD	
CC(=O)N1CCN(Cc2ccccc2NC(=O)C(=O)NNc2c(C)cccc2F)CC1	782124119	NDSLOLBLNXRCNG-UHFFFAOYSA-N	427.480	1.880	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)C(=O)N1CCCc2ccc(F)cc21	782897984	UTVIHLIKINQQHX-UHFFFAOYSA-N	447.492	1.168	50	20	IDGD	
CNC(=O)Cn1ccc2ccc(NC(=O)C(=O)NN=c3sc4ccccc4n3C)cc21	783350368	YGBBQCOSFODCEI-UHFFFAOYSA-N	436.497	1.511	50	20	IDGD	
N#Cc1cccc(Oc2ccc(NC(=O)C(=O)NNc3ccc(-n4cccn4)nn3)cn2)c1	783433431	SUIHDLRJXLBUFM-UHFFFAOYSA-N	441.411	1.803	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNc2ccnc(Br)c2)c(F)cc1F	784837186	FLSPNLASZYYKGU-UHFFFAOYSA-N	429.177	1.991	50	20	IDGD	
CCOC(=O)/C=C\c1ccc(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)cc1	785060033	GAZRKETWEWLEAV-FLIBITNWSA-N	435.440	1.239	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2ccn(Cc3ccc(OC)cc3)n2)n1	785226104	OWMMKRNXJDQENG-UHFFFAOYSA-N	438.492	1.658	50	20	IDGD	
C=CCNC(=O)c1ccc(NC(=O)C(=O)NNc2c(OC)cccc2S(C)(=O)=O)cc1	785339739	UCXNLQBVXQHSSI-UHFFFAOYSA-N	446.485	1.096	50	20	IDGD	
NC(=O)[C@@H]1CCC[C@H](C(=O)NNC(=O)c2nc(-c3ccccc3)n(-c3ccccc3)n2)C1	786687830	ITARMAXBPCCUAH-SJORKVTESA-N	432.484	1.987	50	20	IDGD	
CS(=O)(=O)N1CCN(c2ccc(NC(=O)/C(C#N)=C\c3ccc(O)cc3)cn2)CC1	787348861	UIEMXRDGKADKDU-VBKFSLOCSA-N	427.486	1.414	50	20	IDGD	
O=C(NN=C1C(=O)Nc2ccc(Br)c(Cl)c21)N[C@@H]1CCS(=O)(=O)C1	788014686	GHPCEIGMFJFZEW-ZCFIWIBFSA-N	435.687	1.245	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)NOC[C@@H]2CCOC2)cc1	788573700	HKDZKKOPCVKGAM-ZXMBATIKSA-N	439.472	1.425	50	20	IDGD	
CCc1csc(NC(=O)C(=O)NNC(=O)COc2ccc(Br)cc2)n1	789731754	GZSQSIVUQSUZKE-UHFFFAOYSA-N	427.280	1.633	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2cccc3c2OCC[C@@H]3N(C)C)c1	789733137	XPEKVWQDIJAERJ-SFHVURJKSA-N	440.500	1.854	50	20	IDGD	
Cc1cccc(=O)n1C[C@](C)(O)C(=O)NNC(=O)c1cc(F)ccc1Br	792137897	ZJPFBXSPOXOKMD-KRWDZBQOSA-N	426.242	1.271	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc3ccn(C)c(=O)c3c2)c1C	793022603	YPHORGNQOUIVQR-OAHLLOKOSA-N	436.468	1.709	50	20	IDGD	
COCc1cc(C(=O)OC)cc(S(=O)(=O)NNC(=O)NCCc2cccs2)c1	793382918	VVDZUDYFPZKDES-UHFFFAOYSA-N	427.504	1.416	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@@H]2[C@H]3CN(C(=O)OC(C)(C)C)C[C@H]32)cc(OC)c1OC	794186100	SVTPNPTXQBYTIG-VIKVFOODSA-N	435.477	1.586	50	20	IDGD	
CC(Cn1cc(C(F)(F)F)ccc1=O)=NNC(=O)Cc1csc(N2CCOCC2)n1	794485689	YBQGJEHAARFQLJ-UHFFFAOYSA-N	443.451	1.895	50	20	IDGD	
CCOC(=O)c1ccc(NNC(=O)[C@@](C)(O)CN2C(=O)NC3(CCCC3)C2=O)cc1C	794647456	SWELHLJZGFBGDM-FQEVSTJZSA-N	432.477	1.230	50	20	IDGD	
C[C@@H]1CCN(C(=O)OC(C)(C)C)[C@H](C)[C@H]1NCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	796646448	BOLGNUPDNIXAGK-LBTNJELSSA-N	449.508	1.979	50	20	IDGD	
COC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)c1C	798042125	NECJMJCNVXLLHF-LBPRGKRZSA-N	432.408	1.866	50	20	IDGD	
CCNS(=O)(=O)c1ccc2c(c1)N(C(=O)C(=O)NNc1c(C)cccc1CC)CC2	799842462	IGNREILFVBVJGJ-UHFFFAOYSA-N	430.530	1.888	50	20	IDGD	
Cc1ccc(C2=NO[C@@H](CNC(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)C2)cc1	800753101	WRDDGSJHESAAPN-OAHLLOKOSA-N	434.456	1.379	50	20	IDGD	
CC(C)(NS(C)(=O)=O)C(=O)NNc1c(Br)cccc1Br	801504646	DFUXRKRUZGXNDN-UHFFFAOYSA-N	429.134	1.983	50	20	IDGD	
CN(CC(=O)NNC(=O)Nc1ccc(Br)cc1)S(=O)(=O)c1cccnc1	801993842	DTAQZIVASAPIBJ-UHFFFAOYSA-N	442.295	1.318	50	20	IDGD	
CN(CC(=O)NNC(=O)Nc1ccc(Br)cc1)S(=O)(=O)c1ccccc1	801995292	DFEHGAZZQZCWFW-UHFFFAOYSA-N	441.307	1.923	50	20	IDGD	
C[C@H](C(=O)NNC(=O)Nc1ccc(Cl)cc1Cl)N1C(=O)[C@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O	802090935	KFVDCNIVOQNEEZ-QXVRGBBPSA-N	441.271	1.697	50	20	IDGD	
CS(=O)(=O)c1cc(C(=O)NNC(=O)c2cc(Br)ccc2O)ccc1F	806947585	JUJKPZGFUWJORZ-UHFFFAOYSA-N	431.239	1.772	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(F)cc1OC1CCOCC1	806972403	VAMWGJHVIZQIPP-UHFFFAOYSA-N	446.391	1.691	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)C(=O)Nc1cccc2c1CNC2=O	806974712	FXDWHTZWORXYQG-UHFFFAOYSA-N	435.465	1.762	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)C(=O)Nc1ccc(OCc2ccccc2)nc1	807429282	RDKJVJFPXQCOBQ-UHFFFAOYSA-N	430.428	1.718	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2C)cc1NS(C)(=O)=O	807457814	LTECKJRPFQUQBA-UHFFFAOYSA-N	437.434	1.365	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)Cc2ccc(C(=O)NNC(=O)c3cncn3C)cc2)cc1	809559040	YEAUYVKFOHKZFZ-UHFFFAOYSA-N	441.513	1.624	50	20	IDGD	
O=C(CCc1ccccc1)NNC(=O)CNS(=O)(=O)c1ccccc1C(F)(F)F	810284557	SKUOZDQDKYVPPJ-UHFFFAOYSA-N	429.420	1.764	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)CNS(=O)(=O)c1ccccc1F	811462425	PGZQHDOYWKVZRG-NSHDSACASA-N	429.857	1.372	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NN=Cc2ccc(S(N)(=O)=O)cc2)CC1	811643336	BUWKAHPYNXILLO-UHFFFAOYSA-N	425.511	1.367	50	20	IDGD	
COC(=O)c1cc(Br)cc(C(=O)NNC(=O)c2cncc(NC(C)=O)c2)c1	812536931	SXJSWJIOKSZRSL-UHFFFAOYSA-N	435.234	1.664	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)cc1	813033090	DYLMEJOEFLWNPG-UHFFFAOYSA-N	441.853	1.580	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cnc(C(F)(F)F)c(C#N)c2)c1	814722203	OJMXYACGZMAUKP-UHFFFAOYSA-N	441.391	1.297	50	20	IDGD	
Cc1cccc(-n2c(NNC(=O)CCn3ncn(C)c3=O)nc3ccccc3c2=O)c1C	815603892	XLTHUWJWWVQSPD-UHFFFAOYSA-N	433.472	1.431	50	20	IDGD	
CC[C@@H](C)NS(=O)(=O)c1cccc(NC(=O)C(=O)NNc2cccc(Cl)n2)c1	815726135	QGALNKTVSCHQBY-LLVKDONJSA-N	425.898	1.894	50	20	IDGD	
Cc1oc(-c2cnn(C)c2)nc1C(=O)NNC(=O)[C@H]1CCCN(C(=O)OC(C)(C)C)C1	816510552	YZCHQFMVMRUODI-ZDUSSCGKSA-N	432.481	1.792	50	20	IDGD	
Cc1c(C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)cnn1-c1ccc(Br)cc1	893185843	UEMROCNWEOETDS-LLVKDONJSA-N	441.307	1.139	50	20	IDGD	
O=C(NNc1ncccn1)c1cc(S(=O)(=O)N2CCCC2)ccc1Br	913044334	OIQXNTHGDAWDQI-UHFFFAOYSA-N	426.296	1.781	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)CNS(=O)(=O)c2ccc3ccccc3c2)cc1C	913450234	HHLCMIDPMDHWBW-UHFFFAOYSA-N	441.509	1.961	50	20	IDGD	
NC(=O)CC[C@@H](NC(=O)OCc1ccccc1)C(=O)NNC(=O)c1cc2c(s1)CCC2	913571501	CFSFUMQJUZWSBL-OAHLLOKOSA-N	444.513	1.558	50	20	IDGD	
CC(C)(C)c1ccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCOCC3)o2)cc1	914750407	HOPBSZVFSXGORI-UHFFFAOYSA-N	435.502	1.673	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCCc2ccc3c(c2)OCCO3)nc1	915891381	MXVPURYDEIPJBX-UHFFFAOYSA-N	449.533	1.752	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)NCCN2CCN(Cc3ccccc3)CC2)cc1	915902174	RBSGJJMWSQAKGS-UHFFFAOYSA-N	436.516	1.085	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)NCC[C@](O)(c1nccn1C)C(F)(F)F	916377474	BUYQYVCCSMKCAO-SFHVURJKSA-N	443.426	1.532	50	20	IDGD	
Cc1ccc(N2C(=O)C[C@H](C(=O)NNC(=O)CN3CCCC3=O)[C@H]2c2cccs2)cc1	916758501	BISXQHWJSVYUHI-KKSFZXQISA-N	440.525	1.921	50	20	IDGD	
CCOc1ccc(SCC(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1	917238797	QYPRSBJNTZPZBJ-GOSISDBHSA-N	446.481	1.708	50	20	IDGD	
CN1C(=C(C#N)C(=O)COC(=O)[C@@H](CO)NC(=O)c2ccccc2)N(C)c2ccccc21	917501897	HAOXRYYVQVDYDM-QGZVFWFLSA-N	434.452	1.211	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2ccc3ccccc3c2)cc1	918111692	DITIPGPKOJIEEQ-UHFFFAOYSA-N	427.482	1.839	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1	918118964	WVMLGRNSWOUFBY-GOSISDBHSA-N	438.532	1.599	50	20	IDGD	
CCN(CCCNC(=O)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1)S(C)(=O)=O	918119281	RJMKWXCUMJCHNY-UHFFFAOYSA-N	446.473	1.278	50	20	IDGD	
COc1ccc(N2C[C@H](C(=O)NNC(=O)Cc3ccccc3OC)CC2=O)c(OC)c1	919822795	KBGCVICTDMDRNZ-OAHLLOKOSA-N	427.457	1.455	50	20	IDGD	
C[C@@H](NC(=O)OCc1ccccc1)C(=O)OCC(=O)NNC(=O)c1cccc(Cl)c1	919867331	LQYNPTMGOSTNFE-CYBMUJFWSA-N	433.848	1.959	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNS(=O)(=O)c1cc2c(c(C(=O)O)c1)OCCO2	919957165	GOGDUSGQDNNLGL-UHFFFAOYSA-N	442.833	1.441	50	20	IDGD	
C=CCN(C(=O)CCC(=O)C(C#N)=C1N(C)c2ccccc2N1C)[C@H]1CCS(=O)(=O)C1	919989583	NQYPSQQPOZPMNP-INIZCTEOSA-N	442.541	1.859	50	20	IDGD	
C[C@@H]1CN(Cc2cccc(CNC(=O)NNC(=O)COc3ccc(F)cc3)c2)CCO1	920238372	WERDJFISUNLVPR-MRXNPFEDSA-N	430.480	1.956	50	20	IDGD	
COCCCOc1ccc(C(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)cn1	1318611111	DDFYPGSLUYVQNX-UHFFFAOYSA-N	436.509	1.905	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)cn1	1320263440	KNLYVAREZHITEC-UHFFFAOYSA-N	428.511	1.437	50	20	IDGD	
COc1ccc2nc(NNC(=O)c3ccc(S(=O)(=O)N(C)CCO)cc3)c(C)cc2c1	1321174322	MQGJRCYWKBMELC-UHFFFAOYSA-N	444.513	1.922	50	20	IDGD	
CCOC(=O)[C@@H]1CN(C(=O)OC(C)(C)C)CCN1[C@H](C)C(=O)NNC(=O)CC(C)C	1340800229	COMNRZLGJCKRCO-CABCVRRESA-N	428.530	1.053	50	20	IDGD	
C=C[C@H](O)C(C)(C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCBr)C2	1779332328	GPDDBUKSRCIRGP-QMTMVMCOSA-N	431.371	1.858	50	20	IDGD	
C=C[C@@H](O)C(C)(C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Br)C2	1779337860	DVJDOMLSBCPBRW-UHQDVWGKSA-N	435.334	1.764	50	20	IDGD	
CC/C=C(\C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1	1779374943	HDSPVCBPMCMYRA-FDNMTVOUSA-N	429.521	1.169	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(OC)cc3OC)C2)C1	1780536857	PTORVUADVJQCGD-JXFKEZNVSA-N	426.897	1.401	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(CCN(C(=O)CC34CCCN3CCC4)C2)C1	1781131803	BRSDISNABHZTIF-IBGZPJMESA-N	428.371	1.620	50	20	IDGD	
O=C(c1cccc2ccnn12)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781333637	PHSGMRLRZKVXNI-WMLDXEAASA-N	425.258	1.468	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H]2CCCS2(=O)=O)C1	1781649714	ITYRROCVYHZQSM-YKTARERQSA-N	434.986	1.485	50	20	IDGD	
COc1cc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](F)Cl)CCO3)cc([N+](=O)[O-])c1OC	1782116932	WDODGFKKDBGYQR-QAPCUYQASA-N	445.831	1.590	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc(Cl)nc3)[C@H]2C1	1783374660	CZKQYDPVKMUKNN-IMIFBBOLSA-N	445.745	1.754	50	20	IDGD	
COC(=O)[C@@H]1CC[C@H](C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](C)Br)C3)C2)C1	1783527615	DPEYCBYPXPEZFE-NPSOMJIGSA-N	431.327	1.189	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](C)Br)C3)C2)c1	1783538562	TZIBHVOAYUCXFD-BFUOFWGJSA-N	438.322	1.872	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](N)c1cccc(Cl)c1)CCO2	1783875650	JTRRNFYXQKZXAU-BXWFABGCSA-N	430.332	1.424	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3cnc4ccccn34)[C@H]2C1	1784049847	UQKUSULDMUURSL-OTRWWLKZSA-N	449.349	1.640	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3C[C@H]3c3ccc(F)c(F)c3)C[C@@H]21)[C@@H](O)CCl	1784084463	SRRPSNJGWRAGDK-WREGWWGESA-N	442.890	1.648	50	20	IDGD	
COC(=O)NCC(=O)N1CC[C@]2(C1)CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)CCO2	1784263391	RATFRFYRWDFYIL-OMKLEDIQSA-N	448.426	1.058	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](C)n3cccc3)C2)C1	1784327451	XJDIVQFCJRQEJZ-ITSXBRTRSA-N	440.504	1.013	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H]1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21	1784819569	KRBZAOSNWYWHQN-YTFOTSKYSA-N	433.908	1.510	50	20	IDGD	
Cc1nn(C)c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)CBr)C[C@@H]32)c1F	1785776124	JBGITXDKHRFPTE-SAXRGWBVSA-N	445.333	1.492	50	20	IDGD	
Cc1c(C(=O)NC2(c3ccc(NC(=O)[C@@H](O)CCl)cc3)CCC2)cn2[nH]cnc(=O)c12	1786136778	PLNFMRDSDGWRJG-INIZCTEOSA-N	443.891	1.678	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cncc(F)c3)[C@H]2C1	1786144080	QUBUEUPFHUVCBA-APYUEPQZSA-N	428.302	1.845	50	20	IDGD	
Cc1ccc2nc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)[C@@H](O)CCl)C[C@@H]43)ccc2c1	1787863756	DWOMMUIRQSMTSJ-FVCZOJIISA-N	431.920	1.736	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3nc4ccccc4n(C)c3=O)[C@H]2C1	1787975531	LONFNENEYWCQMG-XSWJXKHESA-N	446.935	1.544	50	20	IDGD	
O=C(Cc1ccccn1)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1	1788143639	IUASTVRSYMREGL-UHFFFAOYSA-N	429.285	1.752	50	20	IDGD	
Cc1nccn1CCCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]2C1	1788766270	YQYIGRZNDKDVQR-FHWLQOOXSA-N	436.629	1.803	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCN3CCOC3=O)C[C@@H]21	1789868450	VERZYIBBASEZOX-NUXNZHGMSA-N	436.336	1.045	50	20	IDGD	
Cc1n[nH]c(C)c1CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]2C1	1789872302	QCLVDEHTOOOBRB-FJXLLPKBSA-N	431.364	1.785	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]3C2)c(C)n1C	1789924871	ZSVZHPFGNHUQGU-TUUVXOQKSA-N	430.318	1.926	50	20	IDGD	
COc1cc(C)c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](O)CCl)C[C@@H]32)cc1OC	1790192133	NLKUFZINKRCRIS-AMVTXUCVSA-N	440.924	1.205	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CCCCN3C)C[C@@H]21	1790958564	VFQYHYYOANWIBC-SIRPWMCASA-N	430.387	1.624	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4ncccc4[nH]3)C[C@@H]21	1791060820	JLFNXMRAWBXFDO-MRHIQRDNSA-N	435.322	1.940	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3(C(F)(F)F)CCC3)C[C@@H]21	1791289409	XUVSICFYSWMDMJ-KKUMJFAQSA-N	448.486	1.072	50	20	IDGD	
CCOC(CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)OCC	1791420514	PPQNFESWLYBIBD-WFGGJUAMSA-N	439.322	1.446	50	20	IDGD	
Cn1cccc1C(=O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]21	1791694597	LOTAXTSAPKCEFB-NGOJXBLDSA-N	430.332	1.424	50	20	IDGD	
COc1ccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](O)CCl)c(Cl)c1	1792974756	BPAWXQYINAMIDG-VLWCASSMSA-N	431.316	1.080	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COc1ccc(Cl)c(F)c1)C2)[C@@H](O)CCl	1792975483	SNNVCYQDTWKCAH-RERORNDZSA-N	435.279	1.047	50	20	IDGD	
CC(C)c1nc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCBr)C3)no1	1793997545	HUIGFZAEJKIBSU-DRXBFXEBSA-N	429.315	1.110	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1cnc2ccoc2c1	1796232692	COOPNMSDEHNWMI-BAESOJJISA-N	426.242	1.722	50	20	IDGD	
CCOC(CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)OCC	1796893245	VGOCAOPEGXUWRL-GSWMANSFSA-N	447.536	1.548	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1ccc2ncncc2c1	1797468277	LYLPNWQHICINKN-OCVGTWLNSA-N	437.269	1.524	50	20	IDGD	
Cn1c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Cl)C3)cc2c[nH]c3nccc-3c21	1798482537	PXASBPPWQAVLBU-RBNVPPIJSA-N	433.871	1.744	50	20	IDGD	
Cc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](O)CCl)C3)ccc1Br	1799026960	VLDUEYMKFXWOQN-OCVGTWLNSA-N	445.741	1.560	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)Cc1ccncc1	1800191048	QJRTZAHRDUWYFX-HUMVNOLHSA-N	438.366	1.881	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnn3cccnc13)C2	1800640929	MKJNSFLXAZGLDT-AYRXBEOTSA-N	436.310	1.106	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3cn[nH]c3cn1)C2	1800641386	ADVURIHQAWKGEB-ZWUHOBOKSA-N	436.310	1.335	50	20	IDGD	
C[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(Cl)Cl)N1CSCSC1	1801017155	SRGOYMYYCFQUEA-YFKTTZPYSA-N	428.407	1.423	50	20	IDGD	
Cc1noc(C)c1CCC(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1	1803141330	MUDAZWFEEQNPBI-KPFFTGBYSA-N	434.924	1.925	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CS[C@@H]2CCCCO2)[C@H]1c1cccnc1)[C@H](O)CCl	1803142737	HKYVBJQLYZZZOA-ISARSNTHSA-N	441.981	1.947	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2sccc2F)[C@H]1c1cccnc1	1803858781	XPFQUXHCFLCSNH-HNAYVOBHSA-N	447.536	1.975	50	20	IDGD	
Cc1nc(CC(=O)NC[C@@H]2CCN(C(=O)CO[Si](C)(C)C)[C@H]2c2cccnc2)no1	1804496197	LCWZHNMZLGVIRA-JXFKEZNVSA-N	431.569	1.873	50	20	IDGD	
COCCOCC(=O)N1CC[C@@H](CNC(=O)CCBr)[C@@H]1c1cccnc1	1806340651	ITFDOAAVNKXTGE-YJBOKZPZSA-N	428.327	1.535	50	20	IDGD	
COCCOCC(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)CBr)[C@H]1c1cccnc1	1806753536	OKKMFTUATIHFJQ-ZVZYQTTQSA-N	442.354	1.781	50	20	IDGD	
Cc1cc[nH]c1C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1807369621	QKIJATXQPKUGFE-WIYYLYMNSA-N	432.289	1.031	50	20	IDGD	
O=C(CCc1ccccn1)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1	1809969661	ZPUGSNDOGZIJPL-UHFFFAOYSA-N	435.333	1.239	50	20	IDGD	
O=C(c1n[nH]c2c1CS(=O)(=O)C2)N1CCC2(CCCN(C(=O)[C@@H](F)Cl)C2)CC1	1810900825	GHYUDVFDIHDXDC-CQSZACIVSA-N	432.905	1.217	50	20	IDGD	
O=C(CCn1ccnn1)NC[C@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1	1813432531	ZGVLKKZGRDOFBX-CRAIPNDOSA-N	435.326	1.554	50	20	IDGD	
C[C@H](CBr)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H]2CCC(=O)NC2)[nH]n1	1814776334	MMOOBUKPKFECCY-DYEKYZERSA-N	440.342	1.959	50	20	IDGD	
CC[C@H](C)[C@H](O)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1815253857	SXOLELFMMJANNT-XZOAIXRZSA-N	443.508	1.121	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@H]1CCC(F)(F)C1)CC2)c1ccc(B(O)O)cc1	1815336000	WFEXGUVERWEOCF-JSGCOSHPSA-N	449.288	1.484	50	20	IDGD	
CC(C)[C@@H](S)C(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1	1815337750	WJWXIYPUVKKJST-XJKSGUPXSA-N	433.364	1.003	50	20	IDGD	
CCc1ccc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)cc1	1815360581	JPYWWCGNPSLYOV-GOSISDBHSA-N	449.341	1.925	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H]1CC[C@@H]3CCC(=O)N3C1)CC2)[C@H](F)Cl	1817128795	QTBSXOUDTHTRFR-CZFOOCMKSA-N	428.917	1.991	50	20	IDGD	
CC(C)[C@H](S)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1	1817473844	CFADNUJQPYCWDM-AEFFLSMTSA-N	430.339	1.350	50	20	IDGD	
C[C@H](Br)C(=O)Nc1cc([C@H]2CCCCN2C(=O)Cn2ccncc2=O)[nH]n1	1822188720	NBBLWUDEKYUUCX-WCQYABFASA-N	437.298	1.442	50	20	IDGD	
O=C1C[C@H](C(=O)Nc2cc([C@H]3CCCCN3C(=O)[C@@H](F)Br)[nH]n2)CCN1	1822486268	VGGWEBYTHXJELP-GLXFQSAKSA-N	430.278	1.619	50	20	IDGD	
C[C@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@](C)(Cl)CCl)[nH]n1)n1cnnn1	1822860504	GZGJLAVMJJZSNA-XAGWURHQSA-N	429.312	1.886	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1c[nH]c(=O)cn1)CC2	1822867981	PXAFCOPQUOBNOB-VPTHRUTESA-N	430.317	1.689	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](C)n1ccnn1)CC2	1825647695	VEUVCEMTHHATAX-LPEHRKFASA-N	427.328	1.691	50	20	IDGD	
CC[C@@H](NC(N)=O)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CCBr)CC1	1826357339	WWPOFVLJJAMDNM-CABCVRRESA-N	431.375	1.838	50	20	IDGD	
O=C(CSc1nc[nH]n1)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](F)Br)CC2	1826673728	OFOSOTQNADFNPE-LHLIQPBNSA-N	449.331	1.656	50	20	IDGD	
N=C1NCCN1CC(=O)N1CCCC[C@H]1C1CCN(C(=O)CCBr)CC1	1826871762	LGURRTBEJGVLGQ-HNNXBMFYSA-N	428.375	1.231	50	20	IDGD	
Cc1cc(CC(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)no1	1827055293	UAXLRJWCKXBVIT-OAQYLSRUSA-N	439.321	1.139	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(Cl)cnc3O)CCO2)C1	1829557880	SXJLXNBZMQDJKG-HNAYVOBHSA-N	446.331	1.918	50	20	IDGD	
O=C(Cn1ccncc1=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H](F)Br)CC1	1830382541	KLVBHHDDVDJGII-RHSMWYFYSA-N	443.317	1.554	50	20	IDGD	
C[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1)n1ccnc1	1830981376	AFCMXILOQJQDGA-JLSDUUJJSA-N	433.336	1.137	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccnc(F)c3)CCO2)C1	1831907110	GXIXHVKZRULOMY-SJKOYZFVSA-N	430.274	1.074	50	20	IDGD	
CN1CCC[C@H]1C(=O)NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1	1833622342	SWVYKXYPXYBOIE-HOTGVXAUSA-N	433.366	1.343	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)C3CCOCC3)CCO2)C1	1835193499	GQRDUHIXWRIUFN-YJBOKZPZSA-N	433.343	1.043	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](O)c3ccccc3)CCO2)C1	1835299166	BMNVOAKSRGCUHN-LSTHTHJFSA-N	445.343	1.413	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCC(N2CCC(NC(=O)c3nc4ncccn4n3)CC2)CC1	1835350728	DAOIHTJGMMRGDR-UHFFFAOYSA-N	447.971	1.575	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)C(Cl)Cl)CC2)CC1)c1cc2n(n1)CCC2	1835610404	LHFJALCNIOIILU-UHFFFAOYSA-N	428.364	1.818	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@H](OC(C)=O)C(C)C)CC2)CC1	1835650465	JZGYJKRPOWOVPX-RTBURBONSA-N	445.988	1.400	50	20	IDGD	
Cc1cc(C(=O)NC2CCN(C3CCN(C(=O)[C@H](C)Br)CC3)CC2)n[nH]1	1836148347	XBKNYIIRTJUAGS-ZDUSSCGKSA-N	426.359	1.687	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccccn3)CCO2)C1	1836184777	NKBDXUJCEFRECQ-KXBFYZLASA-N	440.338	1.112	50	20	IDGD	
Cc1nc[nH]c1C(=O)N1CCC(N2CCC(NC(=O)[C@H](F)Br)CC2)CC1	1836412718	RIVMFAASTIGEOF-HNNXBMFYSA-N	430.322	1.594	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cccc4ccnn34)CC2)CC1	1836480999	IURZWWKHIWHYGY-LJQANCHMSA-N	447.967	1.773	50	20	IDGD	
CC(=O)NCC(=O)N1CCC(OC2CCN(C(=O)[C@H](C)CBr)CC2)CC1	1836673105	BAGSNDHKOTXAOI-CYBMUJFWSA-N	432.359	1.152	50	20	IDGD	
Cc1cnc2c(C(=O)N3CCO[C@]4(COCCN(C(=O)C(C)(C)CCl)C4)C3)cnn2c1	1836943561	DUQOZCKOEYJGHR-OAQYLSRUSA-N	449.939	1.373	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)CCc3ccco3)CC2)CC1	1837182803	UFKJEBMSNZQBTH-UHFFFAOYSA-N	448.564	1.584	50	20	IDGD	
Cc1cc(/C=C/C(=O)N2CCO[C@@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)no1	1837555319	LDFHJQHMFRLXMJ-XJDXJNMNSA-N	437.569	1.304	50	20	IDGD	
CCNC(=S)NCC(=O)N1CCC(OC2CCN(C(=O)[C@H](Cl)CC)CC2)CC1	1838637364	NBYQMUCDAFLYEQ-MRXNPFEDSA-N	433.018	1.486	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)CCNC(C)=O)CC2)CC1	1838755599	STYLCKHFGBRTAG-KRWDZBQOSA-N	446.386	1.685	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(C(C)C)no3)CCO2)C1	1838779013	OEGIZIZSYZWCKN-KUHUBIRLSA-N	429.901	1.122	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(O)nc(Cl)c3)C2)C1	1839143422	WBCLFTCJGMTICI-ACJLOTCBSA-N	432.304	1.528	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(-c4cccnc4)[nH]n3)C2)C1	1839145360	FISAZFRAEKNPQB-IIBYNOLFSA-N	447.923	1.559	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CS[C@H]3CCCCO3)C2)C1	1839145418	HGDABOQDWFUAMF-IEZWGBDMSA-N	434.986	1.720	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccccc3O)C2)C1	1840031469	RIPQQAYREIOMHA-ACJLOTCBSA-N	427.295	1.246	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(C#N)ccc3F)C2)C1	1840155391	ZWJWIKWEVDXIJO-JXFKEZNVSA-N	439.871	1.021	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3c(C)cc(C)cc3C)C2)C1	1840156824	VEYSSZBWGOIPON-PGRDOPGGSA-N	438.952	1.936	50	20	IDGD	
O=C(C(Cl)Cl)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3CCc4ccoc4C3)C2)C1	1840186737	OBLBCUZGBYOSID-AUUYWEPGSA-N	431.316	1.645	50	20	IDGD	
O=C(c1cccc2[nH]ncc12)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840187747	UBXJLMVCLYAKEQ-GOSISDBHSA-N	427.288	1.437	50	20	IDGD	
C[C@H](Cn1ccnc1)C(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1840428701	SXDIDXVSSQCNGS-OXQOHEQNSA-N	426.945	1.241	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1CCCS1)CCO2	1840578475	APDBPAOOJRHBGV-GRDNDAEWSA-N	435.384	1.512	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H]2CC[C@@H](C2)[C@@H]1C(=O)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1	1841353599	GQFLKWSQWHZSOZ-YHUYYLMFSA-N	441.956	1.578	50	20	IDGD	
O=C([C@H](O)CCl)N1CC2(CCCN2C(=O)Cc2cc(F)ccc2Br)C1	1841838353	DAHVXWGDMCPUNP-CQSZACIVSA-N	433.705	1.934	50	20	IDGD	
CC(=O)N1CCC(N2CCC(C(=O)N3CC4(CCCN4C(=O)[C@H](F)Cl)C3)CC2)CC1	1843364155	UYATVFKDEIYWSH-SFHVURJKSA-N	442.963	1.447	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1cccc3nc[nH]c13)C2	1843415717	FFMBXVCOPBQIRA-VULFUBBASA-N	433.472	1.514	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)[C@H]2[C@H]3c4ccccc4S[C@H]32)C1	1844271298	XPYATFXAONBBKJ-HSALFYBXSA-N	434.326	1.071	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC2(CCCN2C(=O)c2ccnnc2O)C1	1844609903	OPHDCVMLPAKNON-ZDUSSCGKSA-N	439.900	1.131	50	20	IDGD	
Cc1c(C(=O)N2CCCC23CN(C(=O)[C@H](C)CBr)C3)cn2[nH]cnc(=O)c12	1844655270	LTHRQQNUUDIFIV-LLVKDONJSA-N	436.310	1.179	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)c2cccc(-c3cnco3)c2)C1	1845415464	RDKFEYCELRPEPR-UHFFFAOYSA-N	425.489	1.532	50	20	IDGD	
CCOc1ccc(N2C(=O)c3ccc(C(=O)NNc4nnc(C)c(=O)[nH]4)cc3C2=O)cc1	11547778	ALTBVCQOIDCXOW-UHFFFAOYSA-N	434.412	1.430	50	20	IDGD	
O=C(COC(=O)CCn1cnc2sccc2c1=O)NNC(=O)c1ccc(Cl)cc1	12873283	OQNODJCOMASVAP-UHFFFAOYSA-N	434.861	1.506	50	20	IDGD	
Cc1ccc(C)c(N2N=C(C(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)CCC2=O)c1	17191665	LCRIPGZQXXSLIC-UHFFFAOYSA-N	446.467	1.494	50	20	IDGD	
Cc1cc(CN2C(=O)c3ccccc3C2=O)cc(C(=O)NNC(=O)c2ccccn2)c1O	17328810	VSPSZQSBHHUSTI-UHFFFAOYSA-N	430.420	1.967	50	20	IDGD	
COCCOc1cc([N+](=O)[O-])c(C(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1OC	22021360	AXMILUVILBAUTP-GOSISDBHSA-N	447.400	1.230	50	20	IDGD	
COCCn1nc(C(=O)NNc2ccc(S(=O)(=O)c3ccc(C)cc3)cc2)ccc1=O	23417391	YZVBVPZSFSBHRE-UHFFFAOYSA-N	442.497	1.788	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)c2ccc(Cl)c(S(=O)(=O)NC[C@H]3CCCO3)c2)n1	24505030	ICTAISJGZRPAGE-CQSZACIVSA-N	439.925	1.961	50	20	IDGD	
Cc1cccc2c(=O)n(CCC(=O)OCC(=O)NNC(=O)c3ccc(Cl)cc3)cnc12	26230989	SUVBSHZSURIOTF-UHFFFAOYSA-N	442.859	1.753	50	20	IDGD	
CSCC[C@H](NC(=O)c1cccc(C)c1)C(=O)NNC(=O)CNC(=O)c1cccs1	725741045	KZUZLJKGWILNPG-HNNXBMFYSA-N	448.570	1.485	50	20	IDGD	
Cc1ccc([C@@H](CN2CCOCC2)NC(=O)NNC(=O)CNC(=O)c2cccs2)cc1	725873194	UTZQPVHBQFZPMV-QGZVFWFLSA-N	445.545	1.190	50	20	IDGD	
Cc1cccc(NC(=S)NNC(=O)[C@H](CCC(N)=O)NC(=O)OCc2ccccc2)c1	725906829	DXNYMNQZISZQJN-KRWDZBQOSA-N	443.529	1.873	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)C1CCCCCC1	726134953	TZDRWXRXGQOUSN-UHFFFAOYSA-N	437.562	1.758	50	20	IDGD	
C[C@H]1CN(C[C@H](C)C(=O)NNC(=S)NCCc2ccc3c(c2)OCCO3)C[C@@H](C)O1	726748578	ZBIRWNZBJJVLOS-HRCADAONSA-N	436.578	1.241	50	20	IDGD	
Cn1c(SCC(=O)OCC(=O)NNC(=O)c2cccs2)nnc1-c1cccs1	726827308	QUNQBTQHNHVUOJ-UHFFFAOYSA-N	437.528	1.702	50	20	IDGD	
O=C(NNC(=O)c1cc2ccccc2cc1NS(=O)(=O)c1cccs1)c1cnn[nH]1	729456929	PDCIRSYSJGFDAE-UHFFFAOYSA-N	442.482	1.895	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)[C@@H]1CCCN1C(=O)c1ccc2c(c1)OCO2	730033166	VAYHTBBXRHPARI-INIZCTEOSA-N	425.441	1.506	50	20	IDGD	
O=C(CCn1cc(Br)cn1)NNc1ccc(S(=O)(=O)NC2CC2)cc1	730077295	RKFLYDHZFYLYHD-UHFFFAOYSA-N	428.312	1.620	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(C)c(C(=O)NNC(=O)c2cccc3ncccc23)c1	730225246	VRBIMOBYQUIZEJ-UHFFFAOYSA-N	442.497	1.543	50	20	IDGD	
CCCN(C)CC(=O)NNC(=O)c1ccc(NS(=O)(=O)c2ccc(OCC)cc2)cc1	730273544	XKBCLGOCVUUQMU-UHFFFAOYSA-N	448.545	1.989	50	20	IDGD	
C[C@@H]1CCCN(S(=O)(=O)c2cc(C(=O)NNC(=O)CCc3ccccc3O)n(C)c2)C1	730285999	TUQOPFQRBPOAIS-OAHLLOKOSA-N	448.545	1.545	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1ccccc1	730671635	HUEBWXNTTSWILW-OAHLLOKOSA-N	432.502	1.413	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CC[C@@H]2NC(=O)N(c3cccc(C)c3)C2=O)cc1OC	730738442	UQRZJFOUGAEORW-INIZCTEOSA-N	440.456	1.678	50	20	IDGD	
N#Cc1ccc(C(=O)NNS(=O)(=O)c2cc(Br)cc([N+](=O)[O-])c2)cc1	731179204	XSWKQRMWCOEPFH-UHFFFAOYSA-N	425.220	1.852	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)NCCNS(=O)(=O)c1cccc(Cl)c1	731498735	ZGOACIDGFLNFRI-UHFFFAOYSA-N	426.882	1.271	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)c1ccc(C)c(S(=O)(=O)N2CCOCC2)c1)c1ccccc1	731996978	IYDYJSAECCJJDO-LJQANCHMSA-N	445.541	1.971	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)c1csc(N2CCOCC2)n1)N(C)Cc1ccccc1	732236506	XXHQCCYAHNQESQ-OAHLLOKOSA-N	432.550	1.444	50	20	IDGD	
COc1ccc(-c2noc(CCC(=O)NNC(=O)CCN3C[C@@H](C)O[C@H](C)C3)n2)cc1	732260224	QJKPPIPDVYBQLQ-HUUCEWRRSA-N	431.493	1.325	50	20	IDGD	
Cc1cccc(-c2nnc(S)n2CCC(=O)NNC(=O)CCN2C[C@H](C)O[C@@H](C)C2)c1	732261872	GJWUNQLPASRXRJ-HOTGVXAUSA-N	446.577	1.579	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)CNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)c1ccccc1	732292249	UGJLTRBWXMPRDA-GOSISDBHSA-N	446.529	1.008	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cc(S(N)(=O)=O)ccc2F)cc1Br	733370989	UPSUISYXAOUOSU-UHFFFAOYSA-N	446.254	1.319	50	20	IDGD	
C[C@@]1(CNC(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)CCOC1	733651606	RKMNIRDFINWWDS-SFHVURJKSA-N	438.531	1.920	50	20	IDGD	
C[C@H]1CN(c2ccc(C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)cn2)C[C@H](C)O1	734242225	XUAOCWCCXCWSLJ-KBPBESRZSA-N	436.513	1.164	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)CCS(=O)(=O)C1CCCC1	734252390	QUADOBLIMCKZNS-UHFFFAOYSA-N	431.580	1.954	50	20	IDGD	
COCCNS(=O)(=O)c1cccc(CNC(=O)NN=c2sc3ccccc3n2C)c1	735517695	FFJRAUPFBUHRRW-UHFFFAOYSA-N	449.558	1.480	50	20	IDGD	
COC(=O)c1ccccc1S(=O)(=O)N1CCC(C(=O)NNc2cc(C)nc(C)n2)CC1	736718451	GYSSGZGWQBLQNV-UHFFFAOYSA-N	447.517	1.424	50	20	IDGD	
C[C@H]1C[C@H](C)CN(S(=O)(=O)c2cccc(C(=O)NNc3ccnc(N(C)C)n3)c2)C1	740112365	FVRPQHSKKGWHLN-GJZGRUSLSA-N	432.550	1.966	50	20	IDGD	
O=C(COC(=O)[C@@H]1CN(Cc2ccccc2)CCO1)NNC(=O)c1ccc(Cl)cc1	741381157	FOUZVNXCHNZVBV-SFHVURJKSA-N	431.876	1.545	50	20	IDGD	
O=C(CN1C(=O)c2cccc([N+](=O)[O-])c2C1=O)NNC(=O)C(F)(F)Oc1ccccc1	741597644	PDLAYHWDXNGLPD-UHFFFAOYSA-N	434.311	1.010	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)[C@@H]2CCCN(C(=O)c3ccncc3)C2)cc1	741886719	ARIYBFBKHJXOOA-SJLPKXTDSA-N	440.500	1.947	50	20	IDGD	
CCCc1c(C(=O)NNc2nnc(C)c(O)n2)nnn1Cc1cccc(Br)c1	743296492	YDNZWDRWLQCILP-UHFFFAOYSA-N	447.297	1.997	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NC2CCN(CC(F)(F)F)CC2)nc1	743357065	VGEJPXSCRSOIMH-UHFFFAOYSA-N	438.476	1.421	50	20	IDGD	
COCCOc1ccccc1C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	744619131	JBVFROQXZYZABC-UHFFFAOYSA-N	435.502	1.490	50	20	IDGD	
Cn1cc(C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)c(-c2ccc([N+](=O)[O-])cc2)n1	744845358	QFCWJJNWNZEIHR-UHFFFAOYSA-N	448.395	1.485	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)[C@@H](c2ccccc2F)N2CCOCC2)c1	745495844	JRHHPCCTRJYOGU-HXUWFJFHSA-N	440.431	1.075	50	20	IDGD	
CCOC(=O)N[C@H](CNC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)CC(C)C	745608309	WVTFEBVKIGTNAJ-AWEZNQCLSA-N	443.526	1.587	50	20	IDGD	
Cc1ccc(N2CC[C@@H](NC(=O)NNC(=O)COc3ccccc3[N+](=O)[O-])C2=O)cc1	745860196	ZCZOIJDIQQYVBV-OAHLLOKOSA-N	427.417	1.418	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)NCCc2ncc[nH]2)cc1	746243584	XSUIXRSMIBFWOR-VBKFSLOCSA-N	433.472	1.423	50	20	IDGD	
CCO[C@H](CCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)C1CCCC1	747591513	BWUBSEPMPIBIEJ-GOSISDBHSA-N	440.566	1.866	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)c1ccccc1)C(=O)NNc1cc(Cl)nc(C)n1	747979990	LSFLUQORHLZGPP-ZDUSSCGKSA-N	429.955	1.982	50	20	IDGD	
CNC(=O)CCNC(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccc(OC)c(OC)c1	748722146	PNGZFLVNPUCGEP-WJDWOHSUSA-N	436.472	1.640	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@H]2CCCN2S(=O)(=O)c2cccs2)cc1OC	749114611	SUQSNWNQSNIUOB-CYBMUJFWSA-N	439.515	1.380	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)[C@@H]2CCCN2C(=O)c2ccc3c(c2)OCO3)c1	749470795	ANWQLNDGQUZERI-KRWDZBQOSA-N	441.440	1.498	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(/C#N)C(=O)NNC(=O)CNC(=O)c2cccs2)c1C	751209343	PFHSRJOISUZONW-DUPVFGOHSA-N	443.529	1.858	50	20	IDGD	
CC[C@@H](CS(=O)(=O)c1ccccc1)NC(=O)NNC(=O)Cc1cn2ccccc2n1	752705279	QSDRTWGDSHCQPO-HNNXBMFYSA-N	429.502	1.460	50	20	IDGD	
O=C(NN=C1CCCC[C@H](N2C(=O)c3ccccc3C2=O)C1)N[C@@H]1CCS(=O)(=O)C1	752728251	YFTYWRXIXJRGIZ-CABCVRRESA-N	432.502	1.458	50	20	IDGD	
CC(C)(C)OC(=O)N(CC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)C1CC1	753002625	IICDZEYEWZVYEM-UHFFFAOYSA-N	445.564	1.746	50	20	IDGD	
CS(=O)(=O)CC1(CNC(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)CC1	753020258	HMMBFZNHNURDLT-UHFFFAOYSA-N	429.442	1.431	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@@H](C)C(=O)NNC(=O)CN1C(=O)N[C@@](C)(C2CC2)C1=O	754822163	BGAGPGBZMJJSOP-YUNKPMOVSA-N	436.896	1.592	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2csc([C@@H]3CCCO3)n2)ccc1Cl	755411318	PLAKBYWSHYQHSS-NSHDSACASA-N	430.895	1.370	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)Nc1ccccc1C(=O)N1CCOCC1	755625390	ZGBZPJUFLVHITA-UHFFFAOYSA-N	436.428	1.274	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)Nc1ccc(CN2C(=O)CCC2=O)cc1	755661225	GEQFCEGXJINEHU-UHFFFAOYSA-N	426.429	1.576	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)Nc1ccc(OCc2ccccn2)c(Cl)c1	756253015	NFFSLRHEFSURQN-GFCCVEGCSA-N	438.893	1.901	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)Nc1ccc(OC)c(-n2cnnn2)c1	756748040	UYBVLXYUCSQEDL-UHFFFAOYSA-N	429.462	1.625	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNS(=O)(=O)c2ccc(F)cc2C(=O)OC)cc1	759093976	GFVSREVDAIDKGQ-GFCCVEGCSA-N	440.449	1.788	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNS(=O)(=O)c2cc(C)c(Cl)c(C(=O)O)c2)cc1C	759095576	POJVVYLKXMVQBT-UHFFFAOYSA-N	439.877	1.912	50	20	IDGD	
COc1ccc2c(c1)OC[C@H]2CC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	760223316	KDYHKQXJJFKZNV-CQSZACIVSA-N	433.486	1.273	50	20	IDGD	
Cc1cc(C)nc(-n2nccc2NC(=O)C(=O)NNC(=O)c2ccc3ccccc3n2)n1	760279159	JIZYEVNHPUSGSA-UHFFFAOYSA-N	430.428	1.227	50	20	IDGD	
CC1(C)C(=O)N(C[C@@](C)(O)C(=O)NNc2ccccc2S(C)(=O)=O)c2ccccc21	760451185	ZEYWOJXWDFIXIU-OAQYLSRUSA-N	431.514	1.609	50	20	IDGD	
COC(=O)c1cc(Cl)ccc1S(=O)(=O)NNC(=O)CSc1ccccc1O	763412451	LRVDQZISRWVPMB-UHFFFAOYSA-N	430.891	1.934	50	20	IDGD	
O=C(NNC(=O)c1ccccc1O)C(=O)Nc1cc(Br)ccc1-n1cccn1	763529568	KTRIXRIWXUNXFY-UHFFFAOYSA-N	444.245	1.740	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cccc(CN3C[C@H](C)O[C@@H](C)C3)c2)c(C)o1	763584321	ZZYKIURETSPUKB-GJZGRUSLSA-N	428.489	1.905	50	20	IDGD	
O=C(COc1cccc(C(F)(F)F)c1)NNC(=O)C(=O)N1CCc2c(F)cccc21	763640272	VBORTNCOHHPCTI-UHFFFAOYSA-N	425.338	1.960	50	20	IDGD	
CC(C)(C)NC(=O)c1cccc(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)c1	763680254	DXTZKQYBLMGNTF-UHFFFAOYSA-N	437.456	1.251	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(N3CCCCC3=O)c2)cc1	763681810	ODNQGXKAPMOYTK-UHFFFAOYSA-N	435.440	1.240	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)C(=O)N1CCc2c1cccc2C(F)(F)F	763681941	SPDBWQLHULGIDH-UHFFFAOYSA-N	425.338	1.960	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2ccc(OC(C)C)c(C#N)c2)c1	763771469	AVIBVGKLAOUXCN-UHFFFAOYSA-N	426.429	1.762	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cc(OC)cc(OC)c2)ccc1Cl	763775203	NWAMOLBHTYITOJ-UHFFFAOYSA-N	435.820	1.544	50	20	IDGD	
CN(C)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)cc1Cl	763813795	OEDMDSOPWHVVIA-UHFFFAOYSA-N	443.847	1.078	50	20	IDGD	
COC(=O)NCc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)cc1	763873098	QSVALKPAOPRLOV-GFCCVEGCSA-N	432.408	1.235	50	20	IDGD	
CCOc1ccc(OC)cc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccc(C(C)=O)cc1	763878908	UCYCMHJWBUHAJH-AWEZNQCLSA-N	443.456	1.850	50	20	IDGD	
COCc1c(Br)cccc1NC(=O)C(=O)NNC(=O)Cn1nc(C)cc1C	763885430	LTHQGKRPALIFGD-UHFFFAOYSA-N	438.282	1.195	50	20	IDGD	
Cc1ccc(-n2cc(C)cn2)c(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)c1	764005540	AAFZEPZUSXDBPB-UHFFFAOYSA-N	435.440	1.660	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)C(=O)N1CC2(CCC2)c2c(F)cccc21	764006255	NLLWOJRXQUBCDQ-UHFFFAOYSA-N	425.416	1.826	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)C2CCCC2)n([C@@H]2CCN(Cc3ccccc3)C2)n1	764078130	YSWKZUDEGBQLBV-LJQANCHMSA-N	438.532	1.915	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cc(F)c(I)c(F)c2)n[nH]1	764108693	MODWNNPGFTZOQA-UHFFFAOYSA-N	449.155	1.001	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1O)C(=O)Nc1ccc(S(=O)(=O)C(F)F)cc1	764124673	NPWLJPUDGUAVJF-UHFFFAOYSA-N	447.803	1.442	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ncn(C3CCCCC3)n2)o1	764139152	PCOGHWHHGPLVBW-UHFFFAOYSA-N	431.497	1.618	50	20	IDGD	
CC(C)S(=O)(=O)c1ccccc1NC(=O)C(=O)NNC(=O)Cn1ccc2ccccc21	764242410	QBIJPLSIEVCMED-UHFFFAOYSA-N	442.497	1.610	50	20	IDGD	
Cc1cc(C)n(-c2ccc(NC(=O)C(=O)NNC(=O)Cn3ccc4ccccc43)cn2)n1	764243309	RXLQPKQYCFSWME-UHFFFAOYSA-N	431.456	1.625	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)C(=O)Nc1ncn(Cc2ccc(Cl)cc2)n1	764289926	ZMYRCCJAJBOXRE-UHFFFAOYSA-N	442.863	1.404	50	20	IDGD	
O=C(NNC(=O)C1CCC1)C(=O)Nc1ccc(CN2CCN(c3ccccn3)CC2)cc1	764344016	YLBRCZVFMRYBSP-UHFFFAOYSA-N	436.516	1.290	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)C(=O)Nc1cc(C(=O)N(C)C(C)C)ccc1Cl	764387513	UVHHSMFWYJJDCQ-UHFFFAOYSA-N	431.880	1.924	50	20	IDGD	
COc1cccc([C@@H](O)C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)c1	764586516	VTVVXYKOZDRALU-LJQANCHMSA-N	447.513	1.364	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1ccc(C#N)cc1)C(=O)NNC(=O)c1cc(-c2ccccc2)on1	764634300	DNVLHJRUJYZPMV-CYBMUJFWSA-N	439.453	1.341	50	20	IDGD	
Cn1c(=O)c2c(ncn2CC(=O)NN=C2CCCSc3ccc(Cl)cc32)n(C)c1=O	764813484	ZOULXIYRBJREES-UHFFFAOYSA-N	446.920	1.494	50	20	IDGD	
Cn1cc(C=NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)c(-c2ccncc2)n1	764827890	LRAXDOHIDSLLRF-UHFFFAOYSA-N	431.500	1.390	50	20	IDGD	
CCn1c(S)nc2cc(C(=O)NNC(=O)CSc3ccccc3O)ccc2c1=O	765247514	GQOHZLUUNVIZCY-UHFFFAOYSA-N	430.511	1.964	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2cc(C(F)(F)F)ccn2)cc1	765341515	CDZOWTAGZXJRBL-UHFFFAOYSA-N	445.423	1.882	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)CC2CCCC2)c(I)c1	765699436	RLTIJVQETZMZBQ-UHFFFAOYSA-N	445.257	1.966	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)CCCOc3cccnc3)CC2)cc1	765749237	WDADAEOAFKYLJH-UHFFFAOYSA-N	425.533	1.514	50	20	IDGD	
COC(=O)CC(C)(C)CC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	767163976	VVEWXIQSSVVWDK-UHFFFAOYSA-N	425.507	1.212	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)c1ccc(OCC(F)(F)F)nc1	767267457	JVVFLEFOGZVPQU-UHFFFAOYSA-N	425.363	1.878	50	20	IDGD	
Cc1ccc([C@](O)(CC(=O)OCC(=O)NNC(=O)Cc2ccccc2C)C(F)(F)F)o1	767279667	WQQDAVPZSMDVKU-LJQANCHMSA-N	442.390	1.970	50	20	IDGD	
CC(C)C[C@@H](NC(=O)OCc1ccccc1)C(=O)N([C@@H]1CCS(=O)(=O)C1)N(C)C	768127266	PARMAGYKRGKVNY-QZTJIDSGSA-N	425.551	1.820	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)Cc2c(C)nc3nc(SC)nn3c2C)cc1	768160606	ZXUCFNSWBGACRT-UHFFFAOYSA-N	429.506	1.274	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1cnc(Cl)c(Br)c1	768238572	DFZPAMXYAARZAI-UHFFFAOYSA-N	441.669	1.835	50	20	IDGD	
CCNS(=O)(=O)c1ccc(CC(=O)NNc2c(OC)cccc2S(C)(=O)=O)cc1	768635020	UAQYKSWCDAWAQD-UHFFFAOYSA-N	441.531	1.083	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)CN1C(=O)N[C@@]2(CCCC[C@@H]2C)C1=O	768635282	XCWAORVZDSHXQL-HXPMCKFVSA-N	438.506	1.043	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)CCC(=O)c2ccc3c(c2)CCC(=O)N3)C[C@@H](C)O1	768686689	ILCTUQNEZNGYOV-HUUCEWRRSA-N	430.505	1.181	50	20	IDGD	
COCCC(=O)N1CCC(NC(=O)NNC(=O)c2cc(F)ccc2Br)CC1	769168664	WEDKOZFGHLACML-UHFFFAOYSA-N	445.289	1.560	50	20	IDGD	
CN1CCC(N2CC[C@@H](NC(=O)NNc3nc(O)c4cnn(C(C)(C)C)c4n3)C2)CC1	770396369	OYHZMVSCSWPFEL-CYBMUJFWSA-N	431.545	1.082	50	20	IDGD	
Cn1ccnc1[C@H](O)C1CCN(C(=O)NNC(=O)c2cc(Br)c[nH]2)CC1	771949181	QQKXFUFSJFLSBM-CYBMUJFWSA-N	425.287	1.311	50	20	IDGD	
Cc1ccc(S(=O)(=O)C[C@@H](C)NC(=O)NNC(=O)c2cc(Br)c[nH]2)cc1	773137029	XJBRAFSMOCGLOM-LLVKDONJSA-N	443.323	1.892	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2ccc(Br)c(C)n2)c1	773525697	PEKKTKSDTDSUJC-UHFFFAOYSA-N	435.278	1.934	50	20	IDGD	
COc1cc(SC)ccc1NC(=O)C(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	773531572	NKJDBNFGHYTYSY-UHFFFAOYSA-N	441.469	1.708	50	20	IDGD	
COC(=O)c1ccc(CCC(=O)N2CCN(S(=O)(=O)CBr)CC2)cc1	777833574	WXHOTKZFQNUFIF-UHFFFAOYSA-N	433.324	1.232	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cc(C)nc(C(F)(F)F)n2)cc1	778292982	NYRUUEQEYYLSJH-UHFFFAOYSA-N	445.423	1.194	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)NC[C@H](c1ccc(F)cc1)N1CCOCC1	778580073	FDIBPGVGNKVLEB-MRXNPFEDSA-N	439.488	1.054	50	20	IDGD	
COc1cc(OC)c(NC(=O)C(=O)NNC(=O)Cc2ccccn2)cc1Br	778709221	AWRBRQKEYIRDHL-UHFFFAOYSA-N	437.250	1.190	50	20	IDGD	
COc1cc(OC)c(NC(=O)C(=O)NNC(=O)CC(F)(F)F)cc1Br	778712818	JYSGGLKNEHOFGF-UHFFFAOYSA-N	428.161	1.505	50	20	IDGD	
CCN(CC)C(=O)CCC1CCN(C(=O)NNC(=O)CNC(=O)c2cccs2)CC1	782501646	AMSGNLUVZWOCMK-UHFFFAOYSA-N	437.566	1.579	50	20	IDGD	
O=C(CN1c2cccc3cccc(c23)S1(=O)=O)NN/C=C1/C(=O)NC(=O)c2ccccc21	783680198	ZCPAHEKIBZELOP-LFIBNONCSA-N	448.460	1.280	50	20	IDGD	
Cc1c(NNC(=O)C(=O)Nc2ccc(N3C[C@H](C)O[C@H](C)C3)nc2)cccc1[N+](=O)[O-]	784354132	IOQKNZMIROXSKG-BETUJISGSA-N	428.449	1.994	50	20	IDGD	
O=C(NNc1ccnc(Br)c1)C(=O)Nc1ccc(N2CCOCC2)c(F)c1	784838462	WTIUSDKAFMROEH-UHFFFAOYSA-N	438.257	1.902	50	20	IDGD	
N#C/C(=C\c1ccccc1)C(=O)OCC(=O)NCc1ccc(C(=O)N2CCOCC2)cc1	785345390	ONNFQYPIHAVEIT-KGENOOAVSA-N	433.464	1.926	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)CCC(=O)Nc2ccc3nc(O)[nH]c3n2)cc1C	787863124	LIUXNEHPIAYKRH-UHFFFAOYSA-N	426.433	1.225	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)CCC(=O)N2CCCC#N	787889467	ONNMSZNZZYTOBT-UHFFFAOYSA-N	433.468	1.978	50	20	IDGD	
O=C(NNc1nc2ccccn2n1)C(=O)Nc1ccc(OCC(F)(F)C(F)F)nc1	792389660	VKMSXUYPPPLCCZ-UHFFFAOYSA-N	427.318	1.485	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(CCC(=O)NNc2nnc(-c3ccccn3)s2)CC1	792474742	IFZRGZHOEUOZEM-UHFFFAOYSA-N	433.538	1.986	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)CC(F)(F)F)n(-c2nc3ccccc3s2)n1	793025296	JWVSYKOUWKNIHN-UHFFFAOYSA-N	426.380	1.829	50	20	IDGD	
COC1(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)CCC(C)CC1	793319943	SPCPFHBRZCMIDK-UHFFFAOYSA-N	426.539	1.476	50	20	IDGD	
CCOC(=O)c1cc(COC)cc(S(=O)(=O)NNC(=O)c2ccc(Cl)cc2O)c1	793368070	QIHSGLDSQZMTLS-UHFFFAOYSA-N	442.877	1.992	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1cccc2c1CCO2	796988460	FGQFNFYFEZXQOG-UHFFFAOYSA-N	432.502	1.780	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NC2CCN(c3nccs3)CC2)c2ccccc2c1=O	798509437	OQCSMYOYZYQSJT-UHFFFAOYSA-N	441.517	1.486	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2sccc2S(=O)(=O)N2CCCC2)cc1	801108329	LDGNPUDFWZMJQD-UHFFFAOYSA-N	436.515	1.241	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN[C@H]2CCN(C(=O)OC(C)(C)C)CC2(C)C)n1	801584590	FRYDESUGPPPFCA-AWEZNQCLSA-N	439.582	1.767	50	20	IDGD	
COc1ccc(CN2CC[C@@H](NC(=O)NNC(=O)c3cccc(C#N)c3)C2=O)c(OC)c1	805067647	YDUAAUYLHOYTLH-GOSISDBHSA-N	437.456	1.321	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)Nc1nc(Cc2ccccc2)cs1	806973738	VCPLCNZFOMVLKJ-KRWDZBQOSA-N	438.465	1.660	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)C(=O)Nc2cc(Cl)cc3c2OCC(=O)N3)c1	806973858	MLGKZOJVMLLTOW-UHFFFAOYSA-N	431.836	1.137	50	20	IDGD	
CNS(=O)(=O)c1cc(NC(=O)C(=O)NNc2ccc(C(F)(F)F)cc2)ccc1F	806984562	XVDBYELVDDPGRY-UHFFFAOYSA-N	434.371	1.834	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCc2ccncc2OC[C@H]2CCOC2)cc1OC	807615508	HYTNVYJXCLYAPI-AWEZNQCLSA-N	430.461	1.658	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)cc2[nH]ccc12	808934680	QFZXQVROQVWSSX-UHFFFAOYSA-N	428.376	1.259	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)NNC(=O)C1(S(=O)(=O)c2ccccc2)CCOCC1	809145076	NBEKIESRCFCTBE-UHFFFAOYSA-N	441.509	1.881	50	20	IDGD	
COC[C@]1(C(=O)NNC(=O)Cc2nc3ccccc3n2C)CCN(C(=O)OC(C)(C)C)C1	809983982	RGHIWIMEVWSXMZ-QFIPXVFZSA-N	445.520	1.537	50	20	IDGD	
Cc1cc(C)c(C)c(S(=O)(=O)NCC(=O)NNc2nc(O)c3ccccc3n2)c1C	810517511	PVURSLUFUYYYCW-UHFFFAOYSA-N	429.502	1.991	50	20	IDGD	
O=C(NNC(=O)c1sccc1S(=O)(=O)N1CCc2ccccc2C1)c1ccncc1	811861235	YMKHYIMVLNXURF-UHFFFAOYSA-N	442.522	1.965	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(C(F)(F)F)s1)C1CCN(c2ncccn2)CC1	812267057	HQZWZQMAXQMNSX-UHFFFAOYSA-N	435.453	1.783	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)[C@@H]2CCCN(C(=O)Cc3ccccc3)C2)cc1	812732738	AGWQSAMMHJDWBV-GOSISDBHSA-N	444.557	1.861	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ncc(C(F)(F)F)s2)cc1	812979638	ZJJGVBVRYXVRPU-SECBINFHSA-N	444.391	1.918	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N1CC[C@@H](CS(C)(=O)=O)C1	814271476	MXYAZGDQIMDMKZ-NWDGAFQWSA-N	448.339	1.324	50	20	IDGD	
Cc1nn2c(=O)c3ccccc3[nH]c2c1C=NNC(=O)Nc1ccc(S(N)(=O)=O)cc1	814968088	NTCVAFOFXLKRMU-UHFFFAOYSA-N	439.457	1.287	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)C(=O)Nc1cc(F)cc(F)c1F	815595300	NISPLLSTEFGBNE-UHFFFAOYSA-N	428.392	1.626	50	20	IDGD	
CN(C)c1nc(N)nc(C(=O)NNC(=O)c2cn(-c3ccccc3)nc2-c2ccccc2)n1	816815605	YVPMOIWGDMBLDZ-UHFFFAOYSA-N	443.471	1.447	50	20	IDGD	
CC(C)c1ccccc1OCC(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	849188695	QDPXMOGYEWZJQX-LJQANCHMSA-N	428.441	1.719	50	20	IDGD	
O=C(COc1ccccc1-c1ccccc1)NNC(=O)CN1C(=O)[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O	863995932	HNAWLDNCNJQAQF-ZCVTWQBDSA-N	445.475	1.687	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)c1ccc(-n2cnnn2)cc1	894382697	BGNFMSIFXMUNBD-HNNXBMFYSA-N	425.474	1.180	50	20	IDGD	
Cn1c(=O)oc2cc(S(=O)(=O)NNC(=O)c3ccc(Br)s3)ccc21	903958776	MWIXMTFQTXYAKR-UHFFFAOYSA-N	432.277	1.579	50	20	IDGD	
NC(=O)c1ccc(NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc1	915879992	AQMIOFXEKVJNFJ-UHFFFAOYSA-N	431.474	1.037	50	20	IDGD	
Cc1cc(Br)ccc1NC(=O)CNC(=O)NNc1ccc(-n2cccn2)nn1	915897883	VCNYTZBBCMIJJO-UHFFFAOYSA-N	445.281	1.998	50	20	IDGD	
CC(C)NS(=O)(=O)c1cccc(CNC(=O)NNC(=O)c2cccc(N(C)C)c2)c1	916486339	MOTURKVTDGCJRQ-UHFFFAOYSA-N	433.534	1.584	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCCCCN2CCC(C)CC2)c2ccccc2c1=O	916503443	UGQUPLLZBUJCOD-UHFFFAOYSA-N	428.537	1.873	50	20	IDGD	
C[C@H]1C[C@@H](C)CN(CCCCNC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)C1	916506051	UVPMIAWERXTVTH-IYBDPMFKSA-N	428.537	1.636	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)NC[C@@]2(N3CCOCC3)CCSC2)c1C	916636690	JQDQCFOVVJVUNT-UWJYYQICSA-N	436.578	1.609	50	20	IDGD	
C[C@@H]1CCCN(C(=O)C2CCN(CC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)CC2)C1	917105134	ALTTVDKKKBSGKP-OAHLLOKOSA-N	431.493	1.326	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)c3csnn3)c2)cc1	917899954	PEYPREABMJVJFZ-UHFFFAOYSA-N	433.471	1.422	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1OC	918219939	RNKCHHDVAFCRDU-UHFFFAOYSA-N	446.479	1.948	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2c[nH]c3ccccc23)cc1	920211689	LEMXJHWGCZIXBO-UHFFFAOYSA-N	444.469	1.084	50	20	IDGD	
N#Cc1ccc(NCC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1	920805952	WATYTEIAZKFPIN-UHFFFAOYSA-N	427.486	1.216	50	20	IDGD	
NC(=O)[C@@H]1CCCN1Cc1cccc(NC(=O)NNC(=O)c2ccc(Cl)cc2O)c1	920939746	XARKYEBRPHABKF-INIZCTEOSA-N	431.880	1.962	50	20	IDGD	
O=C(NCc1ccnc(OC2CCOCC2)c1)NNC(=O)c1cncn1-c1ccccc1	1251840073	RZKGBLTXMDBBAL-UHFFFAOYSA-N	436.472	1.969	50	20	IDGD	
O=C(NNc1cncc(Br)c1)c1ccc(S(=O)(=O)N2CCOCC2)o1	1323068503	ZHLZSWFGVNLBRW-UHFFFAOYSA-N	431.268	1.215	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NCCc1nc(Cc2ccccc2)no1	1343055613	OMALZDRXJQMDHF-UHFFFAOYSA-N	428.474	1.025	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccc3c(c1)NC(=O)CO3)CCO2	1779296873	JLSADKIIFSRKFD-OAQYLSRUSA-N	447.564	1.313	50	20	IDGD	
CCn1nc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)cc1C	1779713667	CXKBQGNSJOVXIL-FZKQIMNGSA-N	427.343	1.686	50	20	IDGD	
COCc1oncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Br)C1	1780773265	KZPLEMXWIRIYGK-CKEIUWERSA-N	448.289	1.639	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cnc4sc(C)cn4c3=O)CCO2)C1	1781218457	HVWJATKTRCNVDT-AUUYWEPGSA-N	438.937	1.525	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(CO)c(F)c3)CCO2)C1	1781234789	ZCLIGTUKUAQDGG-RTBURBONSA-N	433.307	1.998	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cn1cc(Cl)cn1)C2	1782170703	UAJUHXXJCLLMAV-HDMKZQKVSA-N	433.336	1.304	50	20	IDGD	
COc1ccc(F)cc1CC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2	1782295179	LYSNWCWMXNVJGF-YRISNDGFSA-N	442.915	1.490	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](CN)c1ccccc1)CCO2	1783341071	BDISGQQJTUTVAY-UWVAXJGDSA-N	438.366	1.732	50	20	IDGD	
COc1ncc(Cl)cc1C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](C)Br)C2)C1	1783527680	FFXKXFKKEXJYBU-PIGZYNQJSA-N	446.729	1.971	50	20	IDGD	
CCc1[nH]nc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](C)Br)C3)C2)c1Cl	1783532672	MICWNGGOCZJYBE-QFYYESIMSA-N	433.734	1.852	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)C3CCC4(CC3)OCCO4)CCO2)C1	1783537153	QIXSDPINPAGLCU-RDTXWAMCSA-N	445.354	1.533	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)[C@H](C)CNC(=O)OC(C)(C)C)CCO2)C1	1783870471	CGXFPGIMTPMYLG-STXHMFSFSA-N	447.960	1.231	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(F)c(F)c3OC)CCO2)C1	1783879890	BIVVSZCQRGLDNQ-ORAYPTAESA-N	432.851	1.671	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(F)c(F)c3OC)CCO2)C1	1783879892	BIVVSZCQRGLDNQ-YJYMSZOUSA-N	432.851	1.671	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(C)cc3-n3nccn3)CCO2)C1	1783880916	GUCAAFKXHRYNCP-UTKZUKDTSA-N	447.923	1.273	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(=O)c3ccco3)[C@H]2C1	1785136882	QEWOWISHDFIZIY-OSFYFWSMSA-N	427.295	1.473	50	20	IDGD	
CS(=O)(=O)c1ccc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](F)Cl)CCO3)cc1F	1785226343	PVZYVPCRETUQRS-YOEHRIQHSA-N	436.864	1.207	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)c1cccc2c1OCC2	1787817893	YDIFHDISUZPPAM-NZUILWFCSA-N	441.297	1.905	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)c1cc2ccccn2n1	1787843535	BUBRXNSFJKLOBU-QRTARXTBSA-N	435.322	1.713	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4nncn4c3)[C@H]2C1	1788375300	LCCWRLNGQIIBLQ-XLPNERPQSA-N	440.331	1.559	50	20	IDGD	
Cc1cccc(C)c1SCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21	1788760117	YVQSFFXTMBNSDH-XSLAGTTESA-N	440.993	1.975	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3nc(O)n4c3CCCC4)[C@H]2C1	1788788537	AZIXDOOYVQSFNO-MPTYRVRUSA-N	438.956	1.926	50	20	IDGD	
C[C@@H](C(=O)NC1(c2ccc(NC(=O)c3cnccc3C(=O)NN)cc2)CCC1)n1ccnn1	1789521688	DHYQAMQUYMNYEQ-AWEZNQCLSA-N	448.487	1.286	50	20	IDGD	
CCOc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]3C2)nn1	1789924556	MBKRLARNFSMESB-TZQJONAQSA-N	445.289	1.159	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cncc(O)c3)[C@H]2C1	1791108894	ZMLXCZJKQDBNKS-KNPMLCFXSA-N	426.311	1.412	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]3C2)c(C)c1	1791290928	SNKUZXHDDVCAAR-IHPCNDPISA-N	430.549	1.270	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3ccccc3F)[C@H]2C1	1791768549	URYJBEIHMDDGMQ-DWRORGKVSA-N	426.916	1.992	50	20	IDGD	
Cc1ccccc1-c1ncccc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2	1796008053	IUDHHZJGIBWPDA-JSJNYSNDSA-N	443.931	1.860	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2c(c1)COC2	1797012024	PSTRAYDPCLDTTO-BIMQEMHKSA-N	437.334	1.951	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CS[C@@H]1CCCCO1	1797791715	QGNYPAWZXXEMGV-CTTHAOKLSA-N	449.411	1.867	50	20	IDGD	
COc1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CCC(=O)NN(C)C)C3)cc(Cl)n1	1798980340	OTFCCVAIHJCKPP-QDMKHBRRSA-N	437.928	1.368	50	20	IDGD	
CCOC(=O)O[C@@H](C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@](C)(Cl)CCl	1799279450	OQGYOQZLNAWALG-QHRNJGFCSA-N	425.309	1.374	50	20	IDGD	
CC(=O)Nc1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](F)Br)ccn1	1800159636	LIFLGBXJJJGMPQ-XFMPKHEZSA-N	427.274	1.982	50	20	IDGD	
C#CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C#N)=C/c1ccc(Br)cc1	1800335770	KJSAYPVEDSCGJK-MAZHBOQJSA-N	428.286	1.579	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(F)c1[N+](=O)[O-])C2	1800977080	IBPUFGGSMLVIRD-NDPMZMCLSA-N	429.832	1.191	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc3c(c1)NC(=O)[C@H](C)O3)C2	1802279642	YTQIAXGPMUHWNZ-HVQZGBDUSA-N	435.908	1.912	50	20	IDGD	
Cc1cc[nH]c1C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1807369620	QKIJATXQPKUGFE-RXVVDRJESA-N	432.289	1.031	50	20	IDGD	
O=C(CCBr)N1CCC2(CCCN(C(=O)c3cccc(=O)n3O)C2)CC1	1807553409	CODCZMCQBSPSNG-UHFFFAOYSA-N	426.311	1.715	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H](CNC(=O)Cn2ccnn2)[C@H]1c1cccnc1	1807674621	MATLCDVAZVHJNQ-FRFSOERESA-N	435.326	1.410	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2nc3ccccn3n2)[C@H]1c1cccnc1	1807934007	JOFDTCCJMCQQFK-SOLBZPMBSA-N	442.907	1.698	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@H]1CCN(C(=O)CN2CCOC2=O)[C@H]1c1cccnc1	1808290946	ZRUWTXANKDBFFQ-ALKREAHSSA-N	443.331	1.776	50	20	IDGD	
Cn1c(C(=O)N2CC[C@@H](CNC(=O)CO[Si](C)(C)C)[C@@H]2c2cccnc2)cccc1=O	1810539637	DPALDVADWZTQES-UWJYYQICSA-N	442.592	1.951	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1CCN(C(=O)c2cccc(=O)n2O)[C@H]1c1cccnc1	1810541215	SSBSHEGVAYXMQD-JXFKEZNVSA-N	444.564	1.652	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)CCC(N)=O)[C@H]1c1cccnc1	1812779265	QWLFIGMZEWZMDY-KEYYUXOJSA-N	425.327	1.526	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1CCc2nc(NC(=O)CN3CCCC3=O)sc2C1	1814585608	JULGYEKFTVSUIN-WDEREUQCSA-N	443.367	1.709	50	20	IDGD	
CCS(=O)(=O)CC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](C)CBr)n[nH]1	1814778393	GOSHXJSBPAQXFU-WCQYABFASA-N	449.371	1.868	50	20	IDGD	
C[C@@H](CBr)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN2CCNC2=N)[nH]n1	1814779987	CLRYJJXHAZTOQV-AAEUAGOBSA-N	440.346	1.273	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)C[C@H](N)c3cccnc3)sc2C1	1815182608	LCGPQEDNEINHSI-RDBSUJKOSA-N	437.953	1.794	50	20	IDGD	
C=CCOCCCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1815207198	WSRSWVRBSPVQQT-IBGZPJMESA-N	440.309	1.378	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H]2CCC(=O)N2)n[nH]1	1817091657	FWWAXAHEBSLCQJ-WZRBSPASSA-N	426.315	1.854	50	20	IDGD	
Cc1ccnc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)c1	1818190556	MPCVZORCYMGZCK-IBGZPJMESA-N	433.277	1.413	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)CN3CCN(C)CC3)sc2C1	1818796500	RMZDZFUQKCIRKS-UONOGXRCSA-N	428.002	1.710	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)[C@@H]1C[C@@]1(F)Cl	1822502824	VLUJSGBCGVHMAD-RFUYNDQBSA-N	434.664	1.320	50	20	IDGD	
CC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](C)N1CCN(C)CC1)CC2	1822849042	FPSYFAQXXJMBAC-MGPQQGTHSA-N	428.002	1.708	50	20	IDGD	
Cn1nc(C(=O)N[C@@H]2CCc3nc(NC(=O)[C@@H](F)Br)sc3C2)cc1O	1823003166	WHUANCVNSQBODR-KSBSHMNSSA-N	432.275	1.499	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCC(=O)N1CCCC1)CC2	1825995512	YHYVQJMOLVCSQV-QWHCGFSZSA-N	442.969	1.712	50	20	IDGD	
Cc1cccc(CC(=O)N[C@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)n1	1826082949	GWKIPLHKRWXCPF-HNNXBMFYSA-N	444.561	1.374	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)Cc1ccc(F)cn1)CC2	1826085169	IJXUEESXIDPXHN-AWEZNQCLSA-N	448.524	1.205	50	20	IDGD	
CC(=O)N1CCCC[C@@H]1C1CCN(C(=O)CN(C)NC(=O)NCc2ccccc2)CC1	1826589901	BLGVBLNZYZJDRB-OAQYLSRUSA-N	429.565	1.972	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)C2CC(=O)C2)CC1	1827679770	UQYPASUGHLQPKJ-PXMCARDJSA-N	441.532	1.719	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccnc3OCC)CCO2)C1	1829535776	BAHZYWWGUHVWEQ-DYESRHJHSA-N	439.940	1.958	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1	1830307577	HDLDSZFBISISLC-ROUUACIJSA-N	435.956	1.936	50	20	IDGD	
CC(=O)C(C)(C)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](C)CBr)CCO2)C1	1830533301	JZVHSURJKPVVLM-FZKQIMNGSA-N	433.343	1.089	50	20	IDGD	
Cc1nn(C)c(C)c1C(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1831804638	SNBUMDBMRHJVEC-FQEVSTJZSA-N	426.945	1.372	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H](COC)NC(C)=O)CC1	1831830357	AGEBFULAEVTKSL-RCCFBDPRSA-N	431.961	1.011	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)Cn2cc(C)c(O)nc2=O)CC1	1832776691	XENWYKGOZLHDHS-IRXDYDNUSA-N	438.956	1.894	50	20	IDGD	
CC(C)(C)[C@H](O)C(=O)NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1	1833287883	QCSJDOJTAKKTNE-CABCVRRESA-N	436.366	1.656	50	20	IDGD	
CC(=O)C(C)(C)C(=O)NC1CCN(C2CCN(C(=O)[C@H](C)Br)CC2)CC1	1833412044	VXKIXOWETWJFGM-ZDUSSCGKSA-N	430.387	1.957	50	20	IDGD	
NC(=O)c1ncccc1C(=O)NC1CCN(C2CCN(C(=O)C(Cl)Cl)CC2)CC1	1833920800	FTJSJPYBJNMXHA-UHFFFAOYSA-N	442.347	1.169	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccnc3)CCO2)C1	1834009899	NQQLDSARTJRDMJ-MAUKXSAKSA-N	426.311	1.325	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)COC3CCCCC3)C2)C1	1834819505	QBNGNOCYNSCOHE-IBGZPJMESA-N	447.370	1.577	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccccc3)CCO2)C1	1835000595	XXMINOMFGDDLLQ-PXNSSMCTSA-N	439.350	1.859	50	20	IDGD	
Cc1nc[nH]c1C(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)CBr)CC2)CC1	1835189831	FKZSGDZZFQOGRB-ZDUSSCGKSA-N	440.386	1.934	50	20	IDGD	
O=C(CCC(F)(F)F)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1835325025	BLRQXTXFLGQNCM-AAEUAGOBSA-N	435.212	1.476	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)c1cncc2cnccc12	1836087507	ADOWOSBQWOTTAH-FQEVSTJZSA-N	445.951	1.415	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@@H]3CCCN(C)C3)CC2)CC1	1836351655	GIHMDTYPKONXOP-VQIMIIECSA-N	429.005	1.154	50	20	IDGD	
C[C@]1(C(=O)NC2CCN(C3CCN(C(=O)CCBr)CC3)CC2)CCCN1	1836384132	LSYFFHQKMXBHLI-LJQANCHMSA-N	429.403	1.485	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCC(OC2CCN(C(=O)[C@H]3CCCS3(=O)=O)CC2)CC1	1836624151	CITXQWGPUARUPP-QGZVFWFLSA-N	449.013	1.827	50	20	IDGD	
CC(=O)N[C@@H](C)C(=O)N1CCC(OC2CCN(C(=O)[C@H](C)CBr)CC2)CC1	1836674750	ZFFJZNLRFQFKTC-KGLIPLIRSA-N	446.386	1.541	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)c3ccncc3)CC2)CC1	1837426784	FPZXYWXWOWZELK-UHFFFAOYSA-N	431.537	1.067	50	20	IDGD	
Cc1nc(C)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)CBr)C3)C2)o1	1837999534	GHDIHHCBVWJQIP-KZULUSFZSA-N	444.326	1.392	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnc(Cl)s3)CCO2)C1	1838160906	CVDGFHNQBABXOZ-BDJLRTHQSA-N	438.333	1.120	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccnc3SC)CCO2)C1	1838287206	FPMLOGCUXBUWIZ-DNVCBOLYSA-N	427.954	1.891	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)c(O)n1	1838671222	DDVJKUNXVBFQTE-HXUWFJFHSA-N	437.569	1.017	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)CCn3cncn3)CC2)CC1	1838773729	YKRBEDJRURZXEO-CQSZACIVSA-N	442.358	1.450	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3C[C@H]4CC[C@@H]3O4)C2)C1	1839155157	LSNXOBAWPJKKIZ-GVYRHCHYSA-N	435.348	1.247	50	20	IDGD	
O=C(c1ccc(O)cc1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839201774	JCHVIULFKRGFTC-PBHICJAKSA-N	431.258	1.153	50	20	IDGD	
CC(C)=NO[C@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)CCBr)C2)C1	1839224396	RBHWNEITQLSOLV-PBHICJAKSA-N	434.331	1.029	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(C)o3)C2)C1	1839962926	VLCUFWGUCZILML-KDOFPFPSSA-N	429.311	1.832	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3csc(C)n3)C2)C1	1839963427	JWYRSPMMKUTCCG-CXAGYDPISA-N	446.367	1.695	50	20	IDGD	
Cc1c(F)cccc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2	1840030401	KPWWKQCLTPCCNP-AUUYWEPGSA-N	443.313	1.988	50	20	IDGD	
COc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)cc1	1840034617	REDFVGSHDDGPNQ-KUHUBIRLSA-N	441.322	1.549	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)C3CCC(F)(F)CC3)C2)C1	1840150288	IALLRVFPFUJGCC-YJBOKZPZSA-N	438.899	1.522	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4[nH]c(C)cc4c3)C2)C1	1840155160	RBUUBQYCGDIVOB-GCJKJVERSA-N	449.935	1.800	50	20	IDGD	
O=C(c1cc2ncccc2[nH]1)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840189957	UXENXXVHLUJNIP-GOSISDBHSA-N	427.288	1.437	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)n1cccc1)CCO2	1840354039	AYFHTJPAPWNABE-TXPKVOOTSA-N	442.354	1.679	50	20	IDGD	
C[C@]1(C(=O)N2CCO[C@]3(COCCN(C(=O)CCBr)C3)C2)CC=CCC1	1840553134	GUTJDXZEBMZLAH-OALUTQOASA-N	429.355	1.974	50	20	IDGD	
CCN1CCC(C(=O)N2CCO[C@@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)CC1	1840928333	ARKBEEJOFDEQKJ-OAQYLSRUSA-N	441.645	1.026	50	20	IDGD	
C[C@@H](C(=O)N1CC2(CCCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C1)n1cncn1	1841925420	TWBNKSHOPCNKKP-KBPBESRZSA-N	440.932	1.175	50	20	IDGD	
C/C(=C\c1cccnc1)C(=O)N1CC2(CCCN2C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C1	1843417212	IQHMCUYVLYMTBQ-OZVSRTATSA-N	434.500	1.822	50	20	IDGD	
CC(C)O[C@@H](C)C(=O)N1CCCC12CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2	1844329795	ZNUKYTZUJADPND-SFHVURJKSA-N	445.564	1.350	50	20	IDGD	
CN(CC(=O)N1CCCC12CN(C(=O)C1(C#N)CCC1)C2)NC(=O)NCc1ccccc1	1845039908	VHIQBSPEVHAACD-UHFFFAOYSA-N	438.532	1.230	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)CCN1C(=O)Cc3ccccc3C1=O)C2	1845162865	RPNQMHLPSMYUAV-KRWDZBQOSA-N	431.920	1.822	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@H]1CN(Cc3ccccc3)CCO1)C2	1846362442	FCZPYJUPGLEBCD-OALUTQOASA-N	435.952	1.345	50	20	IDGD	
O=C(Cc1cccc(Br)c1F)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl	1847558327	KRFBTBFSZFEHMW-IHRRRGAJSA-N	433.705	1.932	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H]1CCC[C@@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](O)CCl)C1	1847567742	CPGBZFRFPANBAM-JSRQGNBESA-N	443.972	1.871	50	20	IDGD	
O=C(NNC(=O)c1n[nH]c(=O)c2ccccc12)c1c[nH]nc1-c1ccc2c(c1)OCCO2	14346888	ZSDNSJPETMKYAT-UHFFFAOYSA-N	432.396	1.159	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)c1ccc2c(c1)CCCN2S(C)(=O)=O	14842306	RXXPBCQRRTYRTR-UHFFFAOYSA-N	427.486	1.430	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)Cn2c(-c3cccs3)n[nH]c2=S)nc2ccccc21	17411449	TWODADNTHJKLCO-UHFFFAOYSA-N	427.515	1.946	50	20	IDGD	
COc1cc(C(=O)NCC(=O)NNC(=O)COc2cccc(C)c2)ccc1OC(F)F	104747456	PRYRLEUXSFSSFG-UHFFFAOYSA-N	437.399	1.561	50	20	IDGD	
COc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NNC(=O)c2ccc3ccccc3n2)cc1	725870086	PZITYXOPNBKAED-ZDUSSCGKSA-N	428.470	1.371	50	20	IDGD	
C[C@H](NC(=O)OCc1ccccc1)C(=O)NNC(=O)c1csc(N2CCOCC2)n1	726089314	NABBCINFUCRTIV-ZDUSSCGKSA-N	433.490	1.056	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)cc1	726281139	BPOHAJBIRCMVCJ-HNNXBMFYSA-N	432.502	1.065	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)CNC(=O)CCC2CCCC2)cc1	726521180	BIGCJYPHJIYBDO-UHFFFAOYSA-N	444.561	1.955	50	20	IDGD	
CN(C[C@H]1CCCN(CC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)C1)C(=O)OC(C)(C)C	727135168	SDCWJTDSRARPAL-OAHLLOKOSA-N	449.508	1.935	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)CCc3ccc(N(C)C)cc3)cc2)CC1	728213195	GFKWWQPBQCUIAU-UHFFFAOYSA-N	445.589	1.765	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3cc4c(F)cccc4[nH]3)cc2)CC1	728215392	YVQYFVCKBHWJMC-UHFFFAOYSA-N	431.493	2.000	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1cc(Cl)c2c(c1)OCCCO2	728847502	HUTACKJWQZSQSP-UHFFFAOYSA-N	431.880	1.969	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(CCNC(=O)NNC(=O)Cc2cccnc2)s1	729230463	XYTAVUQZTUJERS-UHFFFAOYSA-N	439.563	1.289	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)CN2Cc3ccccc3C2=O)cc1	729966204	NITDBZQJERYVTD-UHFFFAOYSA-N	436.497	1.524	50	20	IDGD	
Cn1nc(SCC(=O)NN=Cc2ccc(-c3ccccc3Cl)o2)c(=O)n(C)c1=O	730568780	BECPQLLMFITVEP-UHFFFAOYSA-N	433.877	1.635	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2nc(C)n(-c3ccccc3)n2)cc1OC	731743054	FKJWXPCVALCUGF-UHFFFAOYSA-N	439.428	1.211	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2c[nH]nc2C)cc1S(=O)(=O)N[C@H]1CCCC[C@H]1C	732084083	KDHPWMSYUUFLEZ-WBMJQRKESA-N	449.533	1.659	50	20	IDGD	
CCc1cccc(C)c1NC(=S)NNC(=O)CNS(=O)(=O)c1ccc(C#N)cc1	732280920	JQHIBFJPDCFCHY-UHFFFAOYSA-N	431.543	1.725	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)N[C@H]2CCN(c3ccccc3Cl)C2=O)cc1	732469989	QBIUXRAGRNLMCZ-INIZCTEOSA-N	427.848	1.726	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)N[C@@H]1CCN(c2ccccc2C(N)=O)C1	732594764	IHNLVYGKLLYOMG-OAHLLOKOSA-N	441.488	1.172	50	20	IDGD	
Cc1nc(-c2ncccn2)nc(O)c1CC(=O)NNC(=O)c1cc(-c2ccccc2)on1	732752192	CNQRIAAKHVNRDS-UHFFFAOYSA-N	431.412	1.606	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2csc(CNC(=O)OC(C)(C)C)n2)C[C@@H](C)O1	732828838	VCCFAHLBPCBJRS-BETUJISGSA-N	441.554	1.428	50	20	IDGD	
O=C(CN1C(=O)Cn2c(cc3ccccc32)C1=O)NNc1ccc(Br)nc1	732838080	IMSZAEZNBCEIIM-UHFFFAOYSA-N	428.246	1.925	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)CCn1c(C)c(C)sc1=O	734596056	SXMVABKHBFKXCE-UHFFFAOYSA-N	441.893	1.583	50	20	IDGD	
CCOC(=O)c1cc(S(=O)(=O)NNC(=O)c2ccccc2OC)cc([N+](=O)[O-])c1C	734807523	TYYCWGIHVOJZNI-UHFFFAOYSA-N	437.430	1.712	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)CC(=O)NNC(=O)Cc2c[nH]c3ccccc23)cc1F	734808829	GIMRYDDAUZFQDL-UHFFFAOYSA-N	431.445	1.673	50	20	IDGD	
C[C@@H](CC(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1)NC(=O)C1CCCC1	734822433	WBWQUBLVJQBSFN-AWEZNQCLSA-N	439.557	1.801	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)c(C(F)(F)F)n1	734824717	IWPFGEHELZOAGX-UHFFFAOYSA-N	434.419	1.782	50	20	IDGD	
Cc1ccc(O[C@H](C)C(=O)N2CCN([C@H](C)C(=O)NNC(=O)CC(C)C)CC2)c(C)c1	738333436	VUXOZMAAYQZOJL-RTBURBONSA-N	432.565	1.797	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)NCc1cccc(C(=O)NC[C@H]2CCCO2)c1	738990886	QTQMLDCTFOUFSY-HXUWFJFHSA-N	440.500	1.643	50	20	IDGD	
COCC[C@@H](Cc1cccc(Br)c1)C(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1	741176465	VCYMYDONRYLANU-KBPBESRZSA-N	447.351	1.226	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)CCS(=O)(=O)c2ccc3c(c2)OCCO3)cc1	743829214	HHWMDZGZWGEHQM-UHFFFAOYSA-N	448.501	1.541	50	20	IDGD	
CC(C)COC(=O)N1CCC(C(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)CC1	743829968	IJJALRQSIDDBBT-UHFFFAOYSA-N	440.522	1.747	50	20	IDGD	
O=C(NNC(=O)c1sccc1S(=O)(=O)N1CCC(O)CC1)c1ccc(Cl)cc1	745477194	VIFJHPLQOXVZET-UHFFFAOYSA-N	443.934	1.622	50	20	IDGD	
CC(C)(CNC(=O)NNC(=O)c1cc([N+](=O)[O-])ccc1O)c1ccc2c(c1)OCCO2	745788082	FBOFZGLNEYDSEW-UHFFFAOYSA-N	430.417	1.993	50	20	IDGD	
CN1CCO[C@H](C(=O)NNC(=O)c2ccc(CSc3nc4ccccc4[nH]3)cc2)C1	746092430	OLTHUKSPJIRAIY-SFHVURJKSA-N	425.514	1.947	50	20	IDGD	
Cn1ncnc1COc1ccc(S(=O)(=O)NNC(=O)c2c[nH]c3ccccc23)cc1	746591993	SESGJTLDLNFBRF-UHFFFAOYSA-N	426.458	1.499	50	20	IDGD	
CCN1C(=O)c2ccc(C(=O)NNC(=O)c3ccc(Cl)cc3F)cc2S1(=O)=O	747329591	PNRQTYYLCFSNIE-UHFFFAOYSA-N	425.825	1.718	50	20	IDGD	
CN(CC(=O)NNC(=O)c1ccc(Cl)cc1F)S(=O)(=O)c1cccc([N+](=O)[O-])c1	747330082	QLPDPYIYNBPKBV-UHFFFAOYSA-N	444.828	1.469	50	20	IDGD	
CS(=O)(=O)Cc1nc2ccccc2n1CC(=O)NNC(=O)c1cccc2cccnc12	747425197	WVPFGLHAHFIJNS-UHFFFAOYSA-N	437.481	1.590	50	20	IDGD	
NS(=O)(=O)c1ccc(NCCC(=O)NNc2ccc(Cl)c(F)c2)c([N+](=O)[O-])c1	748897297	ALIBXXNNIYAUMK-UHFFFAOYSA-N	431.833	1.980	50	20	IDGD	
C[C@H](O)c1ccc(CNC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1	749348593	RNMPXVDGUBMNBA-SFHVURJKSA-N	425.533	1.783	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)c2sccc2S(=O)(=O)Nc2cnn(C)c2)cc1	750719280	RYYRMCBCDVPVSG-UHFFFAOYSA-N	449.514	1.431	50	20	IDGD	
COc1cc(OC)cc(N2C[C@H](C(=O)NNC(=S)NCCc3cccs3)CC2=O)c1	752519651	BBFSHTQREQTGEY-CYBMUJFWSA-N	448.570	1.856	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)Cc2ccc(OCc3ccccn3)cc2)C[C@@H](C)O1	752611391	ZGWCJGSTDYSCCH-QZTJIDSGSA-N	426.517	1.850	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(NC(=O)NNC(=O)COc2ccc(Cl)cc2)c1	755367814	UMEHSYMRGHTQRZ-UHFFFAOYSA-N	426.882	1.822	50	20	IDGD	
COc1ccc(C(F)(F)C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1	755398860	OPQUJAVZCACFQU-UHFFFAOYSA-N	441.456	1.564	50	20	IDGD	
NC(=O)COc1ccc(NC(=O)NNC(=O)COc2cccc(C(F)(F)F)c2)cc1	755802554	QSDNMYUESIKMFH-UHFFFAOYSA-N	426.351	1.801	50	20	IDGD	
Cc1c(NC(=O)NNC(=O)c2cccc(N(C)C)c2)cccc1C(=O)N1CCOCC1	756185005	WTJAZOSIUHQIIG-UHFFFAOYSA-N	425.489	2.000	50	20	IDGD	
CS(=O)(=O)Cc1cccc(NC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)c1	756269221	MSBDEVDOTOKMHD-UHFFFAOYSA-N	429.458	1.589	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN(C)[C@H](C)c2ccc([S@](C)=O)cc2)cc1OC	756550729	MBFFKYMZJFJKEO-WYIRRWHOSA-N	433.530	1.895	50	20	IDGD	
NC(=O)c1ccc(NNC(=O)c2ccc(S(=O)(=O)Nc3ccc(Cl)cc3)cc2)nn1	757409005	YBJGAZOOGDQPEO-UHFFFAOYSA-N	446.876	1.787	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)N=c2cc[nH]cc2[N+](=O)[O-])c2ccccc2c1=O	757805931	QASXAHZIJYVMAH-UHFFFAOYSA-N	425.405	1.388	50	20	IDGD	
O=C(CSc1nnc(CO)n1-c1ccccc1)NNC(=O)c1ccc([N+](=O)[O-])cc1	758011134	PLJJKXHHEWAXDD-UHFFFAOYSA-N	428.430	1.221	50	20	IDGD	
Cc1noc(C)c1S(=O)(=O)N1CCC[C@@H](C(=O)NNc2nc(O)c3ccccc3n2)C1	758308759	BEXLJOKZBHKZPH-CYBMUJFWSA-N	446.489	1.484	50	20	IDGD	
C[C@@H](NC(=O)OC(C)(C)C)[C@H]1CCCN(CC(=O)NNC(=O)c2ccc(C#N)cc2)C1	758797560	IJAHZOIJYBKXSQ-QAPCUYQASA-N	429.521	1.944	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NC[C@@H]2CN(Cc3ccccc3)CCCO2)cc1	759350385	COHIDIOCZCVJSH-OAQYLSRUSA-N	426.517	1.995	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)[C@H]2CCCN(S(=O)(=O)c3c(C)noc3C)C2)nc1	759729613	ZYESGEGWAMGBSH-AWEZNQCLSA-N	437.478	1.017	50	20	IDGD	
CC[C@H](NC(=O)NNC(=O)Cn1nc(C)cc1C)[C@@H]1CN(Cc2ccccc2)CCO1	761796469	YBTVOVITMASKJF-PMACEKPBSA-N	428.537	1.510	50	20	IDGD	
Cn1ccc([C@@H](NC(=O)NNC(=O)C(=O)Nc2ccccn2)c2ccc(Cl)cc2)n1	763159111	XFMITROLCMJBGF-INIZCTEOSA-N	427.852	1.527	50	20	IDGD	
CCOC(=O)N(C)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1	763445408	GQJIMXJTTKFDIL-UHFFFAOYSA-N	429.389	1.587	50	20	IDGD	
COC(=O)c1ccc(OC)cc1NC(=O)C(=O)NNC(=O)c1cc2ccccc2cc1O	763525836	DWCSSIWOBOWHHS-UHFFFAOYSA-N	437.408	1.740	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)N[C@H]1CCN(C2CCCCC2)C1=O	763528384	TYLKTOLVKBBDCI-HNNXBMFYSA-N	425.530	1.555	50	20	IDGD	
CC[C@H](C)n1nc(NC(=O)C(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)cc1C	763542522	GHHHLLOEIHUXRW-NSHDSACASA-N	433.465	1.588	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)cc1	763584433	ZFLRDRRXNANBGH-UHFFFAOYSA-N	444.429	1.651	50	20	IDGD	
N#CCOc1cccc(NC(=O)C(=O)NNC(=O)COc2ccc(Br)cc2)c1	763696674	YFLPHIWGLRAOGG-UHFFFAOYSA-N	447.245	1.516	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(C)c(C(=O)NC(C)C)c1	763717497	WEFMVLPQEKTGMI-UHFFFAOYSA-N	440.500	1.861	50	20	IDGD	
O=C(CSc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1cnn(-c2ccncc2)c1	763734211	IDSCKMVGPWKCQF-UHFFFAOYSA-N	430.877	1.799	50	20	IDGD	
O=C(CSc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1cc(-n2cnnn2)ccc1F	763736527	VNXIRGURFYPTFE-UHFFFAOYSA-N	449.855	1.333	50	20	IDGD	
CCOc1ccc(OC)cc1NC(=O)C(=O)NNC(=O)COc1ccccc1[N+](=O)[O-]	763804459	UCJFTWAROVZJTC-UHFFFAOYSA-N	432.389	1.167	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)c1ccc(F)c(I)c1	763818200	CMZRIXBQSVNHKL-UHFFFAOYSA-N	442.188	1.016	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)Cc2c[nH]c3ccccc23)cccc1N1CCOC1=O	763861022	NQEVVLNDEZNOHQ-UHFFFAOYSA-N	435.440	1.762	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccccc2-n2cccn2)cc1	763861387	OYQGXLIIJUVHGJ-OAHLLOKOSA-N	437.456	1.824	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)Cc2c[nH]c3ccccc23)c(F)cc1F	763865498	QXPPQDGKTGBKOW-UHFFFAOYSA-N	430.367	1.561	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(C(C)=O)cc2)cc1	763872124	KMDCBBWYZIITBZ-CYBMUJFWSA-N	427.413	1.229	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2c3c(nn2C)CCC3)cc1OC	763912625	QIFGVJKOFRSCQS-UHFFFAOYSA-N	429.477	1.496	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(OC(C)C)c(OC)c2)cc1OC	763916395	ORHHYSAPMVNGLS-UHFFFAOYSA-N	431.445	1.899	50	20	IDGD	
CC[C@@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)cc1	763973922	HKSUOAURDXKCNI-LLVKDONJSA-N	432.864	1.974	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)C(=O)Nc1ccc(OCC2CCCCC2)cc1	763996782	FQSBJORZSAFSAB-OAHLLOKOSA-N	437.518	1.166	50	20	IDGD	
Cc1ccc(COc2cccc(NC(=O)C(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)c2)cc1	764002896	VPDWIQOUPBAMAM-INIZCTEOSA-N	445.497	1.095	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)ccc1N1CCOCC1	764003576	HWILNRORSPEUGT-UHFFFAOYSA-N	440.456	1.003	50	20	IDGD	
COC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2cc(Br)cn2C)cc1	764004654	KQZWFTBQJPDXLM-UHFFFAOYSA-N	438.238	1.366	50	20	IDGD	
COCCOc1c(Cl)cccc1NC(=O)C(=O)NNC(=O)c1ccc2c(c1)OCCO2	764006763	UNMLCABRTRQETO-UHFFFAOYSA-N	449.847	1.536	50	20	IDGD	
COC(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(Br)c2)cc1	764058162	CJXLUQPCGKCFML-UHFFFAOYSA-N	434.246	1.564	50	20	IDGD	
O=C(NNC(=O)c1cccc(Br)c1)C(=O)Nc1ccc(N2CCCC2=O)cc1	764063069	KITHUVGPCUQPBM-UHFFFAOYSA-N	445.273	1.976	50	20	IDGD	
C[C@H]1Oc2ccc(NC(=O)C(=O)NNC(=O)Cc3ccc4ccccc4c3)cc2NC1=O	764083313	BEQGMNYQYNCHRO-CYBMUJFWSA-N	432.436	1.888	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(Sc3nccn3C)cc2)c(O)c1	764109241	IUTUDPBFRPGKPJ-UHFFFAOYSA-N	425.470	1.985	50	20	IDGD	
CS(=O)(=O)c1c(Cl)cccc1NC(=O)C(=O)NNC(=O)c1ccc(Cl)cc1O	764125015	QCDLTQNVXLZHKO-UHFFFAOYSA-N	446.268	1.502	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1O)C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F	764126375	JCEDIKZPJVFNRM-UHFFFAOYSA-N	444.734	1.955	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1cccc(Cl)c1-n1cccn1	764277702	NCUQZHZHABJIOI-UHFFFAOYSA-N	429.820	1.396	50	20	IDGD	
CCOCC(=O)NNC(=O)C(=O)Nc1ccc(N(C)C(=O)c2ccc(Cl)cc2)cc1	764326859	PPIXWQLHICQRAA-UHFFFAOYSA-N	432.864	1.739	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)C(=O)Nc1ccc(C(=O)N2CCc3ccccc32)cc1	764385933	QAPJOEPQYBYQHY-UHFFFAOYSA-N	443.463	1.993	50	20	IDGD	
COc1ccc(C(=O)NNc2nccnc2OC)cc1S(=O)(=O)N1C[C@@H](C)C[C@H](C)C1	764465503	NEBRSAFJOPOYLB-KBPBESRZSA-N	449.533	1.917	50	20	IDGD	
Cc1ccc([C@@H](C)[C@H](O)C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1	764586452	VGONRCXBGQXCKN-UZLBHIALSA-N	445.541	1.705	50	20	IDGD	
CO[C@]1(CNC(=O)NNC(=O)COc2ccc(OCc3ccccc3)cc2)CCOC1	764811952	VBVALSDXSPOMHR-QFIPXVFZSA-N	429.473	1.780	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccc(C(=O)NNC(=O)CSc2ccccc2O)o1	765247791	ATMLHCJVMIQCBD-UHFFFAOYSA-N	427.504	1.615	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)c2nn(CC)c(=O)c3ccccc23)cc1S(C)(=O)=O	765530706	QTZWXSPYRYRXTE-UHFFFAOYSA-N	442.497	1.457	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cccc(C(=O)N(C)C)c3)CC2)cc1	765749755	SUQCGEVBTQLPGH-UHFFFAOYSA-N	437.544	1.276	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1	766262361	XZMBXCLSNKREKM-INIZCTEOSA-N	436.476	1.211	50	20	IDGD	
NC(=O)COc1ccc(Cl)cc1S(=O)(=O)NNC(=O)c1ccc2ccccc2c1	766321251	VQDNZSAVPGRLHY-UHFFFAOYSA-N	433.873	1.981	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cnn1CC(C)C	766358910	ZPXYKRRYNPSXGB-UHFFFAOYSA-N	433.534	1.707	50	20	IDGD	
Cc1ccc(-c2n[nH]c(SCC(=O)NNc3nccc(N4CCOCC4)n3)n2)cc1	768242306	BCQQRFOKWNCVMB-UHFFFAOYSA-N	426.506	1.642	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)N[C@@H]1CCOC2(CCOCC2)C1	769201339	UVVHUWBOAPFXLD-LJQANCHMSA-N	445.564	1.257	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1ccc2nnc(C(C)(C)C)n2c1	769539303	XDAJNBVVPUKTJR-UHFFFAOYSA-N	443.533	1.703	50	20	IDGD	
CCNC(=O)N(C)NC(=O)c1ccc(OC)c(S(=O)(=O)N2C[C@@H](C)C[C@@H](C)C2)c1	770549177	MHKKCBVINSYTLT-OKILXGFUSA-N	426.539	1.668	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N[C@H](C)c2nnc(C)o2)cc1	771568800	YTXBLQOCRFSMPG-YDRQLGOLSA-N	449.471	1.910	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1nn(-c2ccc(F)cc2)cc1Br	772135326	BVILFGQMEZFYQS-SECBINFHSA-N	427.230	1.877	50	20	IDGD	
CC(=O)N1CCN(c2ccc(C(=O)NNc3nccnc3C(C)C)cc2[N+](=O)[O-])CC1	772815745	MGBJGGUJEBJGEL-UHFFFAOYSA-N	427.465	1.934	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1	773270190	ZTYDIWJSLRAGAB-GFCCVEGCSA-N	439.394	1.638	50	20	IDGD	
Cc1nc2ccccc2n1CCC(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	773391846	PCXRMDYOMBHTBW-UHFFFAOYSA-N	448.527	1.340	50	20	IDGD	
N#Cc1ccc(NNC(=O)C(=O)Nc2cc(Br)cnc2-n2cccn2)cc1	773696772	KMARMIFONLJJQW-UHFFFAOYSA-N	426.234	1.983	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2ccnn2Cc2ccc(Br)cc2)n1	773726162	JUFZQQFPUPYQMH-UHFFFAOYSA-N	446.265	1.574	50	20	IDGD	
Cc1cccc(S(=O)(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)c1Cl	775669810	PKXYUANBONABGL-UHFFFAOYSA-N	430.939	1.873	50	20	IDGD	
Cn1cc([C@H](NC(=O)NNC(=O)c2nnc(O)c3ccccc23)c2ccc(F)cc2)cn1	776197544	VRPIHDGJLKORGG-QGZVFWFLSA-N	435.419	1.942	50	20	IDGD	
Cc1cnn(-c2c(C(=O)NNC(=O)COc3ccc(Br)cc3)c(C)nn2C)c1	777411194	IYJDNVMTNRSTNO-UHFFFAOYSA-N	447.293	1.825	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNS(=O)(=O)c1cccc(S(F)(F)(F)(F)F)c1	777623378	DPLSYUNSUKZCCD-ZETCQYMHSA-N	447.429	1.591	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CN2CCNC(=O)[C@@H]2c2cccc(Br)c2)c1	777717621	WGLIYIQWRDXCQO-SFHVURJKSA-N	445.317	1.692	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)c1occc1CS(=O)(=O)c1ccccc1	778433038	GCETYOZGTYRLOP-UHFFFAOYSA-N	437.474	1.539	50	20	IDGD	
Cc1cc2c(N3CCC[C@@H]3C(=O)NNC(=O)CNC(=O)OC(C)(C)C)ncnc2s1	778438285	SRGJBPUPWZCRGA-CYBMUJFWSA-N	434.522	1.641	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(C)c(C(=O)NNC(=O)CNC(=O)OC(C)(C)C)c1	778438787	YYEPRSZLOKKRKY-UHFFFAOYSA-N	442.538	1.311	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3ccc(-c4ncn(C)n4)cc3)n[nH]2)cc1OC	779935418	IPCIXUCLUGXIAB-UHFFFAOYSA-N	447.455	1.964	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2ccc(S(=O)(=O)N3CCC(C)CC3)cc2)nc1	782140232	FTUJQBFJOAJLKU-UHFFFAOYSA-N	447.517	1.593	50	20	IDGD	
Cc1cc(C)c(S(=O)(=O)NNC(=O)c2cc(Br)c[nH]2)c(C)c1CC(=O)O	782249212	FXFTVEDBUKMLGY-UHFFFAOYSA-N	444.307	1.953	50	20	IDGD	
COc1ccc(C(=O)N2CCN(C)CC2)cc1NC(=O)C(=O)NNc1ccccc1F	782708382	KRORKYCTVBRHED-UHFFFAOYSA-N	429.452	1.304	50	20	IDGD	
O=C(NNC(=O)N1CCC(CCCn2ccnc2)CC1)c1csc(N2CCOCC2)n1	782996282	GICBYGBZUCTAGT-UHFFFAOYSA-N	447.565	1.723	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2ccc3cc(Br)ccc3c2)CCS(=O)(=O)C1	783428883	YIAMWTPSWHSNFA-QGZVFWFLSA-N	440.319	1.739	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CNC(=O)c2cccs2)cc1C(F)(F)F	784003889	DLBUAYKFFMNGGQ-UHFFFAOYSA-N	428.392	1.591	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)[C@@H]3CC=CC[C@H]3C(=O)N3CCOCC3)n[nH]2)cc1	784345477	BGZMENPMIYMEON-QZTJIDSGSA-N	437.500	1.587	50	20	IDGD	
O=C(Cc1cccc(N2CCCC2=O)c1)NNC(=O)c1csc(N2CCOCC2)n1	784814331	ZJUVSQNFSDOVFJ-UHFFFAOYSA-N	429.502	1.110	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(NC(=O)C(=O)NNc2cccnc2Cl)ccc1Cl	784842412	SXMLTZMUHPNDNO-UHFFFAOYSA-N	432.289	1.721	50	20	IDGD	
CCN(CC)C(=O)Cn1ccc2cc(NC(=O)C(=O)NNc3cccc(OC)n3)ccc21	784844434	XFEJBJIDIBETKK-UHFFFAOYSA-N	438.488	1.995	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc(CC(N)=O)cc3)n[nH]2)c1	785125392	CWVKFDSYQMXGPC-UHFFFAOYSA-N	434.456	1.121	50	20	IDGD	
CNS(=O)(=O)c1ccc2c(c1)N(C(=O)C(=O)NNc1nc(C(F)(F)F)cs1)CC2	785147354	FEXIAFSSIXTBCO-UHFFFAOYSA-N	449.436	1.102	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2ccc(OC)c(N3CCOC3=O)c2)n1	785231378	GWEHNHITMLKTJF-UHFFFAOYSA-N	443.464	1.370	50	20	IDGD	
CCCc1c(NC(=O)C(=O)NNC(=O)c2ccc(O)cc2)cnn1-c1cccc(C#N)c1	785991903	HHVHANHHKAEBOB-UHFFFAOYSA-N	432.440	1.802	50	20	IDGD	
Cc1ccc(Br)nc1C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	786688680	PXSGWPMWRWPRFP-UHFFFAOYSA-N	447.698	1.528	50	20	IDGD	
COC(=O)[C@](C)(CNC(=O)NNC(=O)c1cc(OC)c(OC)c(OC)c1)c1ccccc1	787254707	ITXXJZPDPUORBI-JOCHJYFZSA-N	445.472	1.787	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)N2CCN(C(=O)/C(C#N)=C/c3ccc(O)cc3)CC2)c1	787371013	HMOULSHXAXQTKB-QGOAFFKASA-N	439.493	1.687	50	20	IDGD	
COC(=O)c1sc(S(=O)(=O)NNC(=O)[C@H]2COc3ccccc3O2)c(C)c1Cl	788478949	WGMICFKRBWZWCP-LLVKDONJSA-N	446.890	1.646	50	20	IDGD	
COC(=O)c1nc([C@H]2CCCN2C(=O)NNC(=O)CNC(=O)c2ccco2)sc1C	792880986	BUPOCBOETUFOBR-LLVKDONJSA-N	435.462	1.139	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)C(=O)Nc1ccc2c(c1)N(CC(F)F)CCS2	793024874	HKWGVFDDINTTQA-UHFFFAOYSA-N	435.456	1.587	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)c2cccc(NN3C(=O)[C@H]4CC=CC[C@@H]4C3=O)c2)c1	793417631	DEHFWZBGYWHOPJ-OALUTQOASA-N	429.436	1.911	50	20	IDGD	
CN(C)C(=O)Nc1ccc(CNC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])cc1	793499219	PDKJDYLYYYHTLA-UHFFFAOYSA-N	430.421	1.598	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2cnnn2-c2c(Cl)cccc2Cl)C[C@H](C)O1	794898770	GGUOWOBEERPJJW-RYUDHWBXSA-N	441.319	1.834	50	20	IDGD	
COc1ccccc1O[C@@H]1CCCN(CC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)C1	796567201	QNZCIZCVHWXLDR-QGZVFWFLSA-N	428.445	1.908	50	20	IDGD	
Cc1ccc(F)c(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)c1Br	796992062	LGEIILISOOABRA-UHFFFAOYSA-N	449.236	1.933	50	20	IDGD	
Cc1c(CS(C)(=O)=O)cccc1NC(=O)NNC(=O)CNC(=O)OCc1ccccc1	797628435	XYLYCLQFCWVCLR-UHFFFAOYSA-N	448.501	1.619	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccc(C#N)cc2C(F)(F)F)cn1	799842260	ZWVKQNZPBPTPJP-UHFFFAOYSA-N	427.364	1.457	50	20	IDGD	
CCOC(=O)COc1ccc(NC(=O)NNC(=O)c2nnc(O)c3ccccc23)cc1	800560256	FISUXILNVXRATB-UHFFFAOYSA-N	425.401	1.744	50	20	IDGD	
C[C@H](Sc1ccccc1C(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1)C(N)=O	801182294	KFUCAIKDPGZEOI-NSHDSACASA-N	434.905	1.383	50	20	IDGD	
Cc1nc(C#N)c(N2CCC(C(=O)NNC(=O)Nc3ccc(S(C)(=O)=O)cc3)CC2)o1	802068277	HCFMZICPALSHLI-UHFFFAOYSA-N	446.489	1.328	50	20	IDGD	
C[C@@H](Cn1ccc2ccccc21)C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	803794221	AOAOYRTZIPSKSX-YWZLYKJASA-N	437.452	1.808	50	20	IDGD	
CC(C)(C)OC(=O)N1CCc2[nH]nc(C(=O)NNc3ccc(-n4ccnc4)nn3)c2C1	804956004	UXHLZOGYAFFYEO-UHFFFAOYSA-N	425.453	1.436	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)Nc2cc(CS(C)(=O)=O)ccc2OC)cc1	806638759	MODKZQPCMBJZBM-UHFFFAOYSA-N	437.474	1.480	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)Nc1ccc(F)c(N2C(=O)CCC2=O)c1	806743089	KJQHUYFWJGTWSV-UHFFFAOYSA-N	425.376	1.582	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(C#N)c(Br)c1	806973766	VZFQNTDVNADJCK-UHFFFAOYSA-N	447.245	1.494	50	20	IDGD	
COCCNC(=O)c1cccc(NC(=O)C(=O)NN=c2sc3ccccc3n2C)c1	806997073	CSNCRVJXTXPLJQ-UHFFFAOYSA-N	427.486	1.187	50	20	IDGD	
CNC(=O)c1cccc(NC(=O)C(=O)NNc2cc(Cl)ccn2)c1Br	807013316	OLMYHKXRDHRKKL-UHFFFAOYSA-N	426.658	1.939	50	20	IDGD	
CCS(=O)(=O)c1ccc([C@H](C)NC(=O)NNC(=O)COc2ccc(C#N)cc2)cc1	807269302	GCDJKYGVTINUKZ-AWEZNQCLSA-N	430.486	1.822	50	20	IDGD	
CN1CCN(C(=O)NNC(=O)Cn2cnc3scc(-c4cccs4)c3c2=O)CC1	807381842	LBUKQQAYDXLICV-UHFFFAOYSA-N	432.531	1.175	50	20	IDGD	
C#CC[C@]1(C(=O)OCC(=O)NNC(=O)c2cccs2)CCCN1C(=O)OC(C)(C)C	808597132	HQYCFHFRRHXKNI-HXUWFJFHSA-N	435.502	1.845	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C(=O)Nc2nc3c(s2)CCCC3(C)C)nc2ccccc21	810390641	JKJLGNQTSWTYCL-UHFFFAOYSA-N	440.529	1.972	50	20	IDGD	
CCc1cc(NNC(=O)C(=O)N2CCN(c3ccccc3)CC2)nc(-c2ccccn2)n1	812506844	AYLLKIQQXDJWNX-UHFFFAOYSA-N	431.500	1.893	50	20	IDGD	
CC(=O)N(C)c1ccccc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	813034085	XPDIQFNNKCVJIB-UHFFFAOYSA-N	433.490	1.001	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NN=Cc3cccnc3Cl)CC2)cc1	814878655	FZLSJYROLZDAPU-UHFFFAOYSA-N	435.937	1.500	50	20	IDGD	
Cc1cc(C(F)(F)F)ncc1NC(=O)C(=O)NNc1ccccc1S(=O)(=O)N(C)C	815752621	ZJAUFOOAFROVEQ-UHFFFAOYSA-N	445.423	1.741	50	20	IDGD	
CN(C)N(C(=O)[C@H]1CC(=O)N(c2ccccc2Br)C1)[C@H]1CCS(=O)(=O)C1	914438453	YYOZHMLKSNYNNU-STQMWFEESA-N	444.351	1.294	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCCOc2ccccc2F)cc1	915890094	UMHMHTMJRFKPDZ-UHFFFAOYSA-N	438.481	1.164	50	20	IDGD	
CCCCS(=O)(=O)N1CCC(C(=O)NNC(=O)COc2ccccc2OCC)CC1	916032574	BGEIGXAUVMUYLF-UHFFFAOYSA-N	441.550	1.453	50	20	IDGD	
COc1cc(C=NNC(=O)C(N)=O)ccc1OCC(=O)Nc1ccccc1C(F)(F)F	916272236	GHBBMGLDNQZEBE-UHFFFAOYSA-N	438.362	1.667	50	20	IDGD	
CCN(CC)c1ccc(CNC(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)cn1	916389902	IJMKQJUYIJSCGV-UHFFFAOYSA-N	435.554	1.836	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCN(C(=O)Cc3ccc(Cl)cc3)CC2)n1	917129114	SUVBLKGFFUGAJX-UHFFFAOYSA-N	449.964	1.182	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)c3ccc(N4CCCS4(=O)=O)cc3)n[nH]2)cc1	917178347	UBVVWEDHEKDVGW-UHFFFAOYSA-N	439.497	2.000	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)CCn1cc(Br)cn1	917532222	QWJQSLURCMDERS-UHFFFAOYSA-N	449.353	1.395	50	20	IDGD	
Cc1ccc(-n2nnc(C(=O)NNC(=O)c3sc(N4CCOCC4)nc3C)c2C)cc1	917679202	FKSVQTIEQXXADK-UHFFFAOYSA-N	441.517	1.560	50	20	IDGD	
O=C(CNC(=O)c1ccc2c(c1)OCO2)NNC(=O)c1ccc(F)cc1Br	918340265	HMCJYCPDWAPBPE-UHFFFAOYSA-N	438.209	1.508	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)CNC(=O)c1ccc(F)c(F)c1	918677436	XISVTDIASXJACG-UHFFFAOYSA-N	445.470	1.054	50	20	IDGD	
C[C@H]1CCCN(C[C@@H](C)NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)C1	919915459	VGCJSAAGWCRWLC-LSDHHAIUSA-N	425.555	1.001	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)NC3CC3)c2)o1	920272359	PJAQXTVITHTMEL-UHFFFAOYSA-N	434.518	1.637	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCc2ccc(F)c(F)c2)cc1	920344695	XWPYKVUCVNIVHQ-UHFFFAOYSA-N	426.445	1.424	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@@H]1CCCN(CC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)C1	920418973	OBBGNOFWJQHCBP-AWEZNQCLSA-N	435.481	1.593	50	20	IDGD	
C[C@]1(NNC(=O)NCc2cc(Br)c3c(c2)OCCO3)CCS(=O)(=O)C1	921124900	URXMMFVASXHMCO-HNNXBMFYSA-N	434.312	1.101	50	20	IDGD	
C=C(Br)CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	921127791	ZGRMFSBJRSGVHU-UHFFFAOYSA-N	431.312	1.324	50	20	IDGD	
Cc1nc2c(cc1C(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1)c(C)nn2C	1318559373	ZOUBZRNPFBZHPL-UHFFFAOYSA-N	430.509	1.993	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)CC1(CC(=O)N2CCOCC2)CCCC1	1323189731	AELADYBCCLJZIC-UHFFFAOYSA-N	435.546	1.831	50	20	IDGD	
O=C(COCc1ccncc1)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	1342431492	SBDISZQKQCNVGY-UHFFFAOYSA-N	431.924	1.217	50	20	IDGD	
O=C1NCc2cc(C(=O)N3CC[C@]4(CN(C(=O)CCBr)CCO4)C3)ccc21	1778720441	PJJGPYGANVRAKP-IBGZPJMESA-N	436.306	1.159	50	20	IDGD	
Cc1ncncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Br)C2	1779799030	JIYCHLUWIOQMNU-JKIFEVAISA-N	429.290	1.603	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(-n4ccnc4)ccn3)C2)C1	1780392278	ONONQJGICZODPL-KUHUBIRLSA-N	448.321	1.494	50	20	IDGD	
O=C(COc1ccc(O)cc1)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781326252	VOESQDOMLLTMOI-WBVHZDCISA-N	431.258	1.291	50	20	IDGD	
COc1ncc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](F)Br)C3)C2)cc1C	1781328718	XCDZFEWSVWJFQW-SUMWQHHRSA-N	430.274	1.533	50	20	IDGD	
Cc1c(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](F)Br)C3)C2)nc2ccccn12	1781330484	YAFRKOAMXJIQRW-MAUKXSAKSA-N	439.285	1.777	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)c(F)c1	1781600312	VAVNBBXCUZTZGS-PBHICJAKSA-N	433.249	1.968	50	20	IDGD	
CCc1cc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](Cl)COC)C2)n(C)n1	1782175600	OCXCWDUKPXTXKD-XAUMDUMWSA-N	426.945	1.364	50	20	IDGD	
COc1ccccc1CC(=O)N1CC[C@]2(CN(C(=O)CCBr)CCO2)C1	1783326938	KPIKTWFSBYVUAT-LJQANCHMSA-N	425.323	1.853	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc4cncn4c3)CCO2)C1	1783349738	SBFWZHRIXOUHQR-LPHOPBHVSA-N	435.322	1.951	50	20	IDGD	
COC(=O)[C@@H]1CC[C@H](C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](C)Br)C3)C2)C1	1783527614	DPEYCBYPXPEZFE-KYZVSKTDSA-N	431.327	1.189	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)C#Cc3ccc(Cl)cc3)CCO2)C1	1783871795	VVONZZVAKNVSMW-PXNSSMCTSA-N	425.312	1.775	50	20	IDGD	
COC(=O)CCCCCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1784051572	TWHGUUDMASXKHQ-RDJZCZTQSA-N	437.306	1.630	50	20	IDGD	
COc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]32)cn1	1784763803	SKFLGQGHTXAWHN-XLPNERPQSA-N	430.332	1.920	50	20	IDGD	
CCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1785578496	MUCPBPOQQJKGBU-AVYPCKFXSA-N	447.960	1.109	50	20	IDGD	
CCOc1cnc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Br)C[C@@H]32)cn1	1785609390	ITVYUTOHSSVLRK-UHXUCMFUSA-N	445.289	1.159	50	20	IDGD	
O=C(CCS(=O)(=O)c1ccccc1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Cl)C[C@@H]21	1786586865	YOBMZJPAOVMFIK-OWIUFQIYSA-N	446.928	1.365	50	20	IDGD	
CC(C)OC(=O)c1ncccc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]2C1	1787444322	SVIWLOAWRPAHOX-NZUILWFCSA-N	441.887	1.775	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3c[nH]c4ccccc34)[C@H]2C1	1789749336	AADADNFRXQLPJG-DEYWJSPQSA-N	433.936	1.944	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(O)c(F)c3)[C@H]2C1	1790067997	YEFDBZVNABNNBK-LESCFKLSSA-N	429.286	1.908	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4nn[nH]c4c3)[C@H]2C1	1790538484	LFFHUUQHVASNSC-SDPXSBNPSA-N	436.310	1.335	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)Br)C[C@@H]21	1791063584	MCIPYGBPJQSTQI-GCHJQGSQSA-N	426.149	1.533	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN1CCCC1	1792545448	HRXVVXAWECNPIY-BDCURPAKSA-N	444.482	1.557	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCl)[C@@H]1Cc2[nH]nc(C(F)(F)F)c2C1	1793113019	YOFZLTMRKJKYRE-JVWRJRKNSA-N	434.846	1.381	50	20	IDGD	
CCOc1cnc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)CBr)C3)cn1	1794337787	PLOZPGAVEALGMN-JFILPPLUSA-N	441.326	1.110	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnccc1N(C)C	1794472723	PTHHRUKVZOJBBR-YXPYIKCWSA-N	439.354	1.524	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1ccc(F)cc1	1795657243	AAVCCSYHABLYPK-BJWYYQGGSA-N	425.464	1.319	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nc3cc([N+](=O)[O-])ccc3[nH]1)C2)[C@H](F)Cl	1796366966	QEGGYLMSYGCHSF-WAYYCVMKSA-N	425.804	1.209	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1cccc2c1OCC2	1796796390	XXFSHQXABILVBX-FAXLKDOZSA-N	427.270	1.515	50	20	IDGD	
CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CO[Si](C)(C)C)C(=O)c1ccccc1	1797953909	RFDZQUQCGPDBNN-RMFSNUHRSA-N	447.608	1.200	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1n[nH]c2c1CCc1ncccc1-2	1798477169	GSKFJDAIIQMKTM-VLWCASSMSA-N	443.935	1.791	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CC(=O)N(C3CCCC3)C1)C2	1799263262	ILXTZVSHRZAVME-LSIDRNEPSA-N	425.957	1.385	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(N3CCOCC3)n1)C2	1799270111	QDVMINRRDZXOMM-YYAJDYIMSA-N	436.940	1.139	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nc3ccccn3n1)C2	1799275334	TXZXJCJNSAQHCG-AZGFTEDZSA-N	426.304	1.169	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1n[nH]c(C3CC3)c1F)C2	1799275833	DGVHIVSGMOFSJO-ZSMOCIRGSA-N	433.311	1.866	50	20	IDGD	
CN(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1(C#N)CC1)C2)NC(=O)NCc1ccccc1	1799864855	QKWDCQUATYHHPY-REPLKXPHSA-N	438.532	1.275	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc3ccccn13)C2	1800640733	FZGQWSRRMKZYCM-LOUJCGABSA-N	435.322	1.711	50	20	IDGD	
COc1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](O)CCl)C3)c(F)c(OC)c1F	1800671164	ARXJJSSPDIQNEG-NOHGZBONSA-N	432.851	1.834	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(N(C)C)cn1)C2	1800757444	GCDGZYSFLQHVQW-JFILPPLUSA-N	425.327	1.134	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)c1ccccc1Cl)C2	1800982179	YUHNMWBSNUWAIJ-BRJGLHKUSA-N	431.316	1.217	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3occc3c1)C2	1801011101	BGLVOPTWDONEIA-UPHUGPLXSA-N	428.489	1.009	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CCc2nc[nH]c2C1	1801268916	OONWOPIWWCCHDQ-FLEUSKLQSA-N	429.348	1.341	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(C(N)=O)cc1	1801653392	HFJWDEVXFQHIJH-BQDHKBFISA-N	438.322	1.020	50	20	IDGD	
CC(C)(C)OC(=O)N1CC2(C[C@H]2C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](O)CCl)C3)C1	1801879964	UMGZQKBXSWBKIX-QRJUGERDSA-N	441.956	1.481	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)n1	1803140931	JMLVZSQOLNIZTM-HHXXYDBFSA-N	445.907	1.354	50	20	IDGD	
O=C1NCc2cc(C(=O)N3CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]3c3cccnc3)ccc21	1803143022	RAKBVASSGPSCLH-LZQZEXGQSA-N	442.903	1.244	50	20	IDGD	
COC(=O)C1(C(=O)N2CC[C@@H](CNC(=O)CCBr)[C@H]2c2cccnc2)CC1	1806346521	KADLHEXDWGDVFL-GOEBONIOSA-N	438.322	1.826	50	20	IDGD	
O=C(CCBr)NC[C@@H]1CCN(C(=O)COc2cccnn2)[C@@H]1c1cccnc1	1806347106	SXJCTPZIQDNVLY-HNAYVOBHSA-N	448.321	1.741	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cc(O)no2)[C@@H]1c1cccnc1)[C@@H](F)Br	1808667919	GRVYDWIHGGBAKK-ZLKJLUDKSA-N	427.230	1.785	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)N1CC[C@H](CNC(=O)[C@@H](F)Br)[C@@H]1c1cccnc1	1808668957	TXSYSRNWLMFYFQ-XABYNWHXSA-N	441.301	1.469	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)[C@H](Cl)COC)[C@@H]1c1cccnc1	1810238761	ILFGTOLCDVMLOK-XLNGHYISSA-N	439.944	1.049	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)[C@@H]2CCC=CO2)[C@H]1c1cccnc1	1810264854	VMAAERVVRKADBY-LVCYWYKZSA-N	429.521	1.153	50	20	IDGD	
CCC(C)(C)C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1	1810304514	DRQGZSVLDOQTPO-APWZRJJASA-N	438.532	1.836	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@H]1CCN(C(=O)c2cnc(O)nc2O)[C@H]1c1cccnc1	1810540575	FQNDBKLXGYQFSA-PBHICJAKSA-N	445.552	1.454	50	20	IDGD	
CN[C@H](CC(=O)N1CC[C@H](CNC(=O)CO[Si](C)(C)C)[C@H]1c1cccnc1)C(=O)O	1810541113	OUDBNAGYTOWMOG-GPMSIDNRSA-N	436.585	1.002	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)[C@@H]2CCCS2(=O)=O)[C@@H]1c1cccnc1	1812497460	KTUANUFPBAUYGQ-QZWWFDLISA-N	427.954	1.682	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H](CNC(=O)[C@@H]2CNC(=O)C2)[C@@H]1c1cccnc1	1812643991	UHUWWHAYXHXHIM-DFHZNHDVSA-N	427.332	1.460	50	20	IDGD	
COC(=O)C1(C(=O)N2CC[C@H](CNC(=O)[C@H](C)Br)[C@H]2c2cccnc2)CC1	1812868283	XEGPRJNNBWQJLM-NWANDNLSSA-N	438.322	1.824	50	20	IDGD	
C=C(C(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1)C(F)(F)F	1813074445	RCHTZDAZFQQHFN-YJBOKZPZSA-N	441.454	1.579	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@H]1CCc2nc(NC(=O)C3(C#N)CC3)sc2C1	1814470362	SRJAJUPFXHUTMM-ZVYABZQBSA-N	439.501	1.493	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@H]1CCCSC1)CC2)c1ccc(B(O)O)cc1	1815347958	ZUNSHKBXQLOFBG-DZGCQCFKSA-N	445.375	1.192	50	20	IDGD	
Cc1nnc(CC(=O)Nc2nc3c(s2)C[C@@H](NC(=O)CCBr)CC3)o1	1815485347	HXSOIMZASNEGST-VIFPVBQESA-N	428.312	1.774	50	20	IDGD	
NC(=O)c1ncccc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCBr)[nH]n1	1816076269	XAMMJUHJUBNEGR-ZDUSSCGKSA-N	449.309	1.995	50	20	IDGD	
CCOCCC(=O)N[C@H]1CCc2nc(NC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)sc2C1	1817282359	CTZHDUFXSKRGLI-XIXVAHAYSA-N	446.533	1.616	50	20	IDGD	
CCO/C=C/C(=O)N[C@H]1CCc2nc(NC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)sc2C1	1817283216	XOTXFXNKNUHEJU-KOGZKQLOSA-N	444.517	1.739	50	20	IDGD	
C#CCCCCC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819404129	AKANLJHVAODUAU-SFHVURJKSA-N	437.504	1.908	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccco1)CC2	1819795194	JQWLGDWQCVPUMH-SNVBAGLBSA-N	426.458	1.274	50	20	IDGD	
CN1C(=O)CC[C@H]1C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCBr)[nH]n1	1820951203	DXUNDCHIOGOPLR-OLZOCXBDSA-N	426.315	1.808	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc(O)cc2F)n[nH]1	1821112812	LVNSYXCQICHLRZ-KRWDZBQOSA-N	446.483	1.933	50	20	IDGD	
O=C(Cn1ccncc1=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](F)Br)[nH]n1	1821656862	RAOXUAZKDYZMLD-XHDPSFHLSA-N	441.261	1.349	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(C#N)cc2)[nH]n1	1822414748	LGMVDDXNWLICSC-SFHVURJKSA-N	437.504	1.960	50	20	IDGD	
C[C@@H](C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1ccccn1	1822898962	SRLITIVVUUXFGA-FOIQADDNSA-N	447.304	1.594	50	20	IDGD	
Cc1ccc(CC(=O)Nc2cc([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)o1	1822909846	JLGYRNXDKUWLNQ-KRWDZBQOSA-N	430.509	1.919	50	20	IDGD	
COCC1(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1	1824480965	VDRLKANJXIUXOP-FQEVSTJZSA-N	428.338	1.026	50	20	IDGD	
COc1cccc(C(=O)N[C@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)n1	1826080587	SXWCPDRONOEKNL-LBPRGKRZSA-N	446.533	1.146	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1	1826083626	PGSJCGSRTVFFBJ-NWDGAFQWSA-N	429.974	1.836	50	20	IDGD	
O=C(c1cccs1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827051482	ZAJKRWLKLPOAJK-IBGZPJMESA-N	426.347	1.975	50	20	IDGD	
Cn1cc(F)cc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827059374	NXSMWXXLWKANNG-HXUWFJFHSA-N	441.312	1.391	50	20	IDGD	
O=C(/C=C/c1cnccn1)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827059621	FADSSZXBWCEPAY-DORXLWPQSA-N	448.332	1.103	50	20	IDGD	
C=C[C@H](O)C(C)(C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1	1828881414	CXQJPIFAXDQSLK-RTWAWAEBSA-N	442.365	1.173	50	20	IDGD	
CC[C@H](C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2)N(CC)CC	1830354456	YZNVFTBDEMHGKC-UTKZUKDTSA-N	432.005	1.828	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](C)CBr)CCO2)C1	1830535245	KENVCYPCZKXIKZ-JKIFEVAISA-N	439.778	1.881	50	20	IDGD	
Cc1cc(C)c(OCC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)c(C)c1	1831168897	QDJWNLABDLPPKR-FPOVZHCZSA-N	442.915	1.981	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccnc3OCC)C2)C1	1831638466	CWWMLIFAKDGNQN-UWJYYQICSA-N	439.940	1.958	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C=N/O[C@H]3CCCCO3)C2)C1	1831650146	DPLHWZZDNSLMSC-UPCXQOFDSA-N	445.944	1.379	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCBr)C3)C2)cnc1C	1833295502	HGFQGSZDGUCNTH-LJQANCHMSA-N	440.338	1.553	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)[C@@H]3CCC(=O)NC3)CC2)CC1	1833529651	CUGSSBLUOJAYCZ-QAPCUYQASA-N	426.989	1.492	50	20	IDGD	
COc1cscc1C(=O)N1CCOC[C@]2(CN(C(=O)CCBr)CCO2)C1	1834821602	OYTGBSPGGBHTOK-KRWDZBQOSA-N	447.351	1.612	50	20	IDGD	
C[C@@H](Nc1ccccc1)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1835692766	VJNAQMJWGXEOSN-UZLBHIALSA-N	436.984	1.658	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(F)c(C)c3N)CCO2)C1	1835875524	YZDJMNKOQBUCLB-MGPUTAFESA-N	443.903	1.040	50	20	IDGD	
Cc1nccnc1C(=O)NC1CCN(C2CCN(C(=O)CO[Si](C)(C)C)CC2)CC1	1836013745	WYYVAZZEFVJWEZ-UHFFFAOYSA-N	433.629	1.822	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3ncccc3F)CC2)CC1	1836024685	UBYLFDHTLRSLRX-MRXNPFEDSA-N	426.920	1.660	50	20	IDGD	
Cn1ccc(CC(=O)N2CCC(N3CCC(NC(=O)[C@@](C)(Cl)CCl)CC3)CC2)n1	1836398658	QMJTXKYDLYEJBF-FQEVSTJZSA-N	444.407	1.771	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1Cc3ccccc3CN1)CCO2	1836498936	OOSQDTKHUAOPEP-TXTKFYIRSA-N	449.979	1.565	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC(OC2CCN(C(=O)[C@H]3CNC(=O)C3)CC2)CC1	1836673597	HXICQZVTKVAIPQ-UONOGXRCSA-N	444.370	1.152	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ncoc3C)CCO2)C1	1838208344	DGFOFYDXBLMQQT-CXAGYDPISA-N	430.299	1.227	50	20	IDGD	
COc1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCBr)C3)C2)c1	1838927477	QKSYXMODMGNKDG-LJQANCHMSA-N	441.322	1.550	50	20	IDGD	
N#Cc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)cc1	1839202199	XOQOSPBJMVAUJQ-MAUKXSAKSA-N	440.269	1.319	50	20	IDGD	
O=C(c1cc(F)ccc1Cl)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1	1839325473	XATDBOFSSUJGCT-MAUKXSAKSA-N	435.279	1.149	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C)ccc3F)C2)C1	1840155196	RXUIBBIZLJVPQK-OXJNMPFZSA-N	428.888	1.458	50	20	IDGD	
O=C(Cc1ccc2c(c1)CCC2)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840186246	CPKXMUCILMCHAT-OAQYLSRUSA-N	441.355	1.978	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)C3CCC(O)CC3)CCO2)C1	1840272114	GWKWGZUMURFQSP-XTUQQUOLSA-N	447.370	1.025	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(F)ccc3OC)CCO2)C1	1840689497	MGBKHKCLCVDVGE-JXFKEZNVSA-N	428.888	1.922	50	20	IDGD	
C[C@]1(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)CC1(F)F	1840828113	NJJDJNWCYKMLNO-GDLCADMTSA-N	429.233	1.179	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC2(CCCN2C(=O)[C@H]2CCCCO2)C1	1841101644	HIXRKIFSYGANSL-LSDHHAIUSA-N	429.945	1.891	50	20	IDGD	
C=CCO[C@@H](C)C(=O)N1CCCC12CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2	1841609953	FYVODSYFXYPFJP-AWEZNQCLSA-N	431.445	1.928	50	20	IDGD	
Cc1cc(C(=O)N2CCCC23CN(C(=O)CCC(=O)NN(C)C)C3)c2cc(O)ccc2n1	1844021731	AEUNMRYVLLNGGU-UHFFFAOYSA-N	439.516	1.439	50	20	IDGD	
Cc1ccc(=O)n(C(C)(C)C(=O)N2CCCC23CN(C(=O)CCBr)C3)n1	1844353626	QXHPRBAAFUZRCE-UHFFFAOYSA-N	425.327	1.275	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCCC12CN(C(=O)c1ccc(-n3c(O)nnc3O)cc1)C2	1844378659	QJNDNBZKIDCDAV-UHFFFAOYSA-N	445.552	1.347	50	20	IDGD	
C=CC[C@@H](C)C(=O)N1CC2(CCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)C1	1845039375	JLFRCVXXSCGWTL-GOSISDBHSA-N	427.549	1.748	50	20	IDGD	
C[C@H](NC(=O)c1ccccn1)C(=O)N1CC2(CCCN2C(=O)[C@H](F)Br)C1	1845219919	QNHSIDJVZSPNHQ-AAEUAGOBSA-N	427.274	1.094	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCCC12CN(C(=O)c1nnc3cc(C)nn3c1C)C2	1846070310	BOHBTZKIYUSCCD-CYBMUJFWSA-N	435.326	1.732	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H]2C[C@@H](C[C@@H]2O)[C@H]1C(=O)N1CCCC12CN(C(=O)[C@H](F)Cl)C2	1846203415	WSPQSDRNTPRCPR-YTFOTSKYSA-N	445.919	1.483	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](O)CCl)CC1	1847569000	SHRRVGGCLWUKRI-HRCADAONSA-N	429.945	1.435	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)C1CCC(C(F)(F)F)CC1	1847991046	YSVKVDLQQQTUFM-CKUJCDMFSA-N	432.487	1.930	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(C(=O)NNC(=O)c3ccccc3C)CC2)cc1C	9796731	OWQVKYCHOYBTGP-UHFFFAOYSA-N	430.530	1.973	50	20	IDGD	
Cc1noc2nc(-c3ccc(F)cc3)cc(C(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)c12	12799936	OERDFVPECJAXQA-GFCCVEGCSA-N	432.433	1.533	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1	15467793	NZMYYTZMEOUYCW-UHFFFAOYSA-N	449.554	1.569	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)NNC(=O)c2ccc(Cl)cc2OC)ccc1OC	21028287	IPVNMGKQLCEPRV-UHFFFAOYSA-N	427.866	1.340	50	20	IDGD	
CN(CC(=O)NNC(=O)c1ccc(Cl)cc1Cl)C1=NS(=O)(=O)c2ccccc21	23795939	KEUWTVLZUBACFY-UHFFFAOYSA-N	441.296	1.835	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Cn2cc(C(=O)OC)c3ccccc32)c2ccccc2c1=O	28580433	RCLCFTWPOLHSTF-UHFFFAOYSA-N	447.451	1.619	50	20	IDGD	
COc1ccc(C)cc1CN1CCN(CC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)CC1	29193232	PMPSIHOLCZRRHK-UHFFFAOYSA-N	441.488	1.491	50	20	IDGD	
CCn1c(SCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)nc2ccccc2c1=O	36788231	DGRSYISQFKEZMR-UHFFFAOYSA-N	427.442	1.878	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2ccn(-c3cc(C)ccc3OC)n2)c2ccccc2c1=O	60106515	AQDGMIUCCHIPEZ-UHFFFAOYSA-N	446.467	1.994	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)NC[C@@H]3CCCO3)c2)cc1	138671236	FJPBHYZJKKNZHA-KRWDZBQOSA-N	433.486	1.227	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)N2CCN(C(=O)Cn3cnnn3)CC2)c(C)n1CCC(C)C	725882994	IFCBKNMNWDVCEA-UDWIEESQSA-N	438.536	1.416	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)NC[C@@H](c1ccc(Cl)cc1)N1CCOCC1	726245888	CJFJFFOKLSJVKC-INIZCTEOSA-N	449.895	1.067	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)N[C@@H](C)c1cccc(S(=O)(=O)NC)c1	727608063	KOPBXTAGPOEMLI-AWEZNQCLSA-N	434.518	1.628	50	20	IDGD	
C=CCOc1c(Br)cc(C=NNC(=O)[C@H](C)NS(C)(=O)=O)cc1OC	728434983	SCHKENPSYXCEBM-JTQLQIEISA-N	434.312	1.410	50	20	IDGD	
CC(=O)N(c1ccc(C)c(C)c1)c1nc(C=NNC(=O)[C@H](C)NS(C)(=O)=O)cs1	728437381	RCGHHCGJAPSSCR-ZDUSSCGKSA-N	437.547	1.832	50	20	IDGD	
Cc1cc(S(C)(=O)=O)c(C)c(S(=O)(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c1	730203717	WTBDGQHKGLUAQD-UHFFFAOYSA-N	427.460	1.238	50	20	IDGD	
Cc1ccc(-c2noc(CN3CCN([C@@H](C)C(=O)NNC(=O)CC(C)C)CC3)n2)cc1	731848635	JPKAEAYSSBXDJP-KRWDZBQOSA-N	428.537	1.745	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)N[C@H](Cc1ccccc1)CN1CCOCC1	732476447	JSPCEMYKIIYPRK-LJQANCHMSA-N	442.516	1.348	50	20	IDGD	
COc1ccc(CN2CC[C@H](NC(=O)NNC(=O)COc3cccc(C)c3)C2=O)cc1	734516314	GKKPEPHDKYGUDF-IBGZPJMESA-N	426.473	1.514	50	20	IDGD	
CCOCCCN1CC[C@@H](NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)[C@H](C)C1	734544341	QZCBNBMLOKMPSH-CRAIPNDOSA-N	440.566	1.171	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCCC2)cc1)NNC(=O)COCc1ccccc1	737634922	QFCUTRUHNYIQMS-UHFFFAOYSA-N	445.541	1.768	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)CC[S@@](=O)c2ccc3c(c2)OCCO3)c1	740738474	IACJRABPWADZON-SSEXGKCCSA-N	432.498	1.799	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC[C@H]2C)c1	740851682	QRCSCFRTSQJCSB-CQSZACIVSA-N	438.550	1.316	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCc2nc(-c3ccccc3)n[nH]2)nc1	741415974	JRMWHYUURRZSSC-UHFFFAOYSA-N	444.521	1.724	50	20	IDGD	
CS(=O)(=O)[C@H]1CCCCC1=NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	741451641	LCLPHFWEZUWCBY-SFHVURJKSA-N	441.575	1.934	50	20	IDGD	
C[C@H](CN1CCN(c2ccccc2)CC1)NC(=O)NNC(=O)CNC(=O)c1cccs1	743577994	GPODUQFMPGWHJU-MRXNPFEDSA-N	444.561	1.019	50	20	IDGD	
O=C(NNC(=O)N1CCN(S(=O)(=O)Cc2ccon2)CC1)c1cccc2ccccc12	743628433	SUVKGRHFTYYYTB-UHFFFAOYSA-N	443.485	1.330	50	20	IDGD	
CNS(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=O)Nc2ccc(N(C)C)cc2)c1	743828966	QOAPIXINWVHMJK-UHFFFAOYSA-N	425.898	1.781	50	20	IDGD	
Cn1cc(-c2cccc(C(=O)NNc3ccccc3S(=O)(=O)N3CCOCC3)c2)cn1	744619909	CRPHBRCFRHXECR-UHFFFAOYSA-N	441.513	1.865	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)CCNC(=O)N2CCc3ccccc3C2)cc1	745056716	DJWRCAHGCPDCGQ-UHFFFAOYSA-N	449.467	1.020	50	20	IDGD	
O=C(NNC(=O)c1ccnc(F)c1)c1cccc(S(=O)(=O)NCc2ccccc2)c1	745490937	AYMSASSKRUQYBT-UHFFFAOYSA-N	428.445	1.774	50	20	IDGD	
O=C(CNC(=O)[C@@H]1c2ccccc2C(=O)N1Cc1ccccc1)NNC(=O)c1ccc[nH]1	745838350	LOBCVBLCEJSRRS-FQEVSTJZSA-N	431.452	1.289	50	20	IDGD	
CO[C@@]1(C)C[C@H](NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)C1(C)C	745930370	DCZWODBUVGLPJY-JXFKEZNVSA-N	438.550	1.619	50	20	IDGD	
O=C(CSc1ccc(Cl)cc1)NNC(=O)NCCNS(=O)(=O)c1cccs1	747437506	KIAIHWBUDZRLPM-UHFFFAOYSA-N	448.979	1.803	50	20	IDGD	
O=C1CC(=O)Nc2cc(S(=O)(=O)NNC(=O)c3ccc(Cl)cc3F)ccc2N1	747621188	PSZKOLRZISTXPW-UHFFFAOYSA-N	426.813	1.383	50	20	IDGD	
CC(=NNC(=O)Cc1ccncc1)c1ccc(S(=O)(=O)N2CCCC[C@@H]2C(=O)O)cc1	747641522	CZRZULMHBYFQCE-LJQANCHMSA-N	444.513	1.792	50	20	IDGD	
O=C(NNC(=O)c1cccc(NC(=O)c2ccc(Br)o2)c1)C(=O)N1CCCC1	748240330	SAWCOOYTZGRZHL-UHFFFAOYSA-N	449.261	1.678	50	20	IDGD	
CN1CCC[C@@H](NC(=O)NNC(=O)[C@@H]2Cc3ccccc3CN2Cc2ccccc2)C1=O	748664614	LRVANZWEAVQWOB-RTWAWAEBSA-N	435.528	1.565	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)c1cc(Br)c2c(c1)OCCO2	748697795	VTXNQHYYLBBIMU-UHFFFAOYSA-N	445.229	1.944	50	20	IDGD	
Cn1ccnc1SCc1cccc(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c1	749161429	MOYPCWBBEFMAGI-UHFFFAOYSA-N	434.485	1.763	50	20	IDGD	
O=C(NC[C@H]1SCCc2ccccc21)NNC(=O)c1csc(N2CCOCC2)n1	749612038	KEAMABXWGLZZNT-MRXNPFEDSA-N	433.559	1.954	50	20	IDGD	
O=C(NNC(=O)N1CCN(S(=O)(=O)c2ccccc2)CC1)c1cc2ccccc2o1	750289291	RDONDLLIBBBTKR-UHFFFAOYSA-N	428.470	1.794	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2Br)c1	751081779	DBEHLEHWLMIKEV-UHFFFAOYSA-N	442.247	1.836	50	20	IDGD	
Cc1ccc(Br)cc1S(=O)(=O)NNC(=O)CNC(=O)c1cccs1	751280791	VDYIPGAYZMYDNR-UHFFFAOYSA-N	432.321	1.559	50	20	IDGD	
O=C(CCSc1ccnc2cc(Cl)ccc12)NNC(=O)N[C@H]1CCS(=O)(=O)C1	751361094	RATVYECRSZSTMM-LBPRGKRZSA-N	442.950	1.888	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2ccc(C#N)cc2)cc1OCC	751397425	PPHGPCJXIHOMOK-UHFFFAOYSA-N	446.485	1.095	50	20	IDGD	
Cc1cc(S(N)(=O)=O)cc(C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)c1C	751842354	QCNOYQAICHUPTP-UHFFFAOYSA-N	438.531	1.148	50	20	IDGD	
CN(Cc1nc[nH]n1)C(=O)/C(C#N)=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	754860031	WDIQFOHGSWWEQQ-ZSOIEALJSA-N	438.879	1.763	50	20	IDGD	
CCCC[C@@H](NC(=O)[C@H](C)NC(=O)C(C)(C)C)C(=O)NNC(=O)NC1CCCCC1	755036547	VKTCSTIQILAYTO-GOEBONIOSA-N	425.574	1.875	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2ccc(F)c(F)c2F)cc1	755364436	LJXXTLJARAXDGB-UHFFFAOYSA-N	430.408	1.886	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)Nc1cccc(S(=O)(=O)NC2CC2)c1	755586523	XZSCXJVXQXUFFD-UHFFFAOYSA-N	442.457	1.243	50	20	IDGD	
CCOC(=O)/C=C\c1ccc(NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1	755847834	YCCSMQALNPIMPG-RAXLEYEMSA-N	435.440	1.976	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)C(=O)Nc2ncc(Cc3ccccc3)s2)c1	756170029	PVJSDSVPDXHMED-UHFFFAOYSA-N	438.469	1.487	50	20	IDGD	
Cc1c(NC(=O)NNC(=O)c2ccc3c(c2)OCO3)cccc1C(=O)N1CCOCC1	756185071	YAUYSYRBDJWBGH-UHFFFAOYSA-N	426.429	1.663	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)N[C@@H](C)c2ccc([S@@](C)=O)cc2)nc1	756721318	GFRKRFCGLWFGGA-CFJPQMKISA-N	439.563	1.893	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)Nc1ccccc1OCC(=O)N1CCOCC1	756874518	QEVHDDLTMSRCJU-UHFFFAOYSA-N	430.436	1.459	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N1CCO[C@@H]([C@H]2CCCO2)C1	756916591	RKQVTAMETXOENN-APHBMKBZSA-N	442.310	1.837	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)[C@H]1CCc2n[nH]cc2C1	757097004	XOEPPAFLTKTZSK-HNNXBMFYSA-N	430.940	1.133	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)N[C@@H]1CCN(C(=O)CCc2ccccc2)C1	757284549	FHJFVJNHDSOGKE-LJQANCHMSA-N	435.484	1.501	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)Nc1ccc(F)cc1CS(C)(=O)=O	757677019	DVSXTSFVOVIRIR-UHFFFAOYSA-N	425.438	1.611	50	20	IDGD	
CNC(=O)Cn1nc(NC(=O)NNC(=O)c2ccc(COc3ccccc3)o2)cc1C	757821467	BGRWSOVSTLYVHW-UHFFFAOYSA-N	426.433	1.576	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)c1cccc(-n2nccc2-c2ccccc2)c1	758030369	QAVFFSXRKDYNRU-CQSZACIVSA-N	427.486	1.238	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)c1cc(NC(=O)CC(C)(C)C)ccc1Cl	758047687	YXSHCZGOVDSHKI-SNVBAGLBSA-N	432.930	1.413	50	20	IDGD	
Cc1ccc(-n2cc(C(=O)NNC(=O)N[C@@H]3CCS(=O)(=O)C3)c(C(C)(C)C)n2)cc1	758446463	PZWVPFKPGVEHTI-CQSZACIVSA-N	433.534	1.609	50	20	IDGD	
C[C@@H]1CCCCN1S(=O)(=O)c1ccc(C(=O)NNC(=O)C(=O)Nc2ccccn2)cc1	758835262	VLHCEILGWYNMNN-CQSZACIVSA-N	445.501	1.044	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)NC[C@H]1CN(Cc2ccccc2)CCCO1	759350760	IVXQXKBPBQFUGN-FQEVSTJZSA-N	437.500	1.559	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)c2cn(C)c(=O)c3ccccc23)c2ccccc2c1=O	760067126	STUBVJGAOVLDHQ-UHFFFAOYSA-N	431.452	1.904	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNS(=O)(=O)c2cccc([N+](=O)[O-])c2C#N)cc1	760336081	WTUZGTZTSADYKP-LBPRGKRZSA-N	434.430	1.642	50	20	IDGD	
Cn1cccc1C(=O)NNS(=O)(=O)c1c(Br)cc2nc(O)oc2c1Cl	763416160	HLGMSKJAVKNHIH-UHFFFAOYSA-N	449.670	1.911	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNS(=O)(=O)c1ccc(N2CCCC2=O)cc1	763439796	SWEJHBMHTJHKOS-UHFFFAOYSA-N	440.522	1.428	50	20	IDGD	
Cc1coc(-c2cc(NC(=O)C(=O)NNC(=O)[C@H]3COc4ccccc4O3)ccc2C)n1	763578860	QUJJCUWLJAKMQM-GOSISDBHSA-N	436.424	1.884	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1c2c(nn1-c1ccccc1)CCC2	763630426	ZNGWCXQSRVDYLG-UHFFFAOYSA-N	443.467	1.717	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2ccc(C(=O)N(C)C)c(C)c2)c1	763644484	KGEZQNCTJHIVTI-UHFFFAOYSA-N	426.473	1.479	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(N3CCOC3=O)c2C)cc1	763659753	QGZIOHYOAONEPQ-UHFFFAOYSA-N	442.428	1.125	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc3oc(N(C)C)nc3c2)cc1C	763664515	BTTVIIMRGXLTGB-UHFFFAOYSA-N	425.445	1.676	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cccc(N(C)C)c2)ccc1Cl	763754174	MVWQVQOSPCXCJV-UHFFFAOYSA-N	432.864	1.982	50	20	IDGD	
Cc1coc(-c2cc(NC(=O)C(=O)NNC(=O)COc3ccccc3C#N)ccc2C)n1	763812189	FLVHIJSEGRZDPC-UHFFFAOYSA-N	433.424	1.995	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc1Cl	763945061	UAUOSVGUOHKIFT-UHFFFAOYSA-N	429.820	1.640	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)CCC(=O)N2C	764011671	KIFFLJRYJZGZHS-UHFFFAOYSA-N	430.848	1.657	50	20	IDGD	
O=C1C[C@H](c2cccc(NC(=O)C(=O)NNC(=O)Cc3cccc4ccccc34)c2)CN1	764037565	ZBTDAYQWUFYKEH-SFHVURJKSA-N	430.464	1.772	50	20	IDGD	
O=C(Cc1ccc2ccccc2c1)NNC(=O)C(=O)Nc1ccc(-n2cncn2)c(F)c1	764083188	ACUHZJCRAQZIMK-UHFFFAOYSA-N	432.415	1.888	50	20	IDGD	
CN(C)C(=O)COc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccc3ccccc3c2)cc1	764084431	VFUDHVURNANXIZ-UHFFFAOYSA-N	448.479	1.635	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(CC(=O)Nc3ccccc3F)cc2)n[nH]1	764106758	RETUVLQXMYTOCY-UHFFFAOYSA-N	438.419	1.438	50	20	IDGD	
COC(=O)c1cc(F)ccc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccc(C)cc2)[nH]n1	764111789	SVQHWNFCMUCOPG-UHFFFAOYSA-N	439.403	1.711	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2ccc(-c3csnn3)cc2)cc1	764131098	GHCQRLBMKFTTMM-UHFFFAOYSA-N	425.470	1.932	50	20	IDGD	
CCCCCn1nc(C)cc1NC(=O)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	764259952	LSOMRXSZUNERAC-UHFFFAOYSA-N	442.524	1.174	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1ccc(-c2n[nH]c(C3CC3)n2)cc1	764278506	QSSPNOOJBAOISI-UHFFFAOYSA-N	436.428	1.220	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)CCCc2cccs2)cc1N1CCOC1=O	764343146	ONASEFZZWZWQBU-UHFFFAOYSA-N	446.485	1.822	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)N2CCC3(CC2)NC(=O)N(C)C3=O)c(C)n1C[C@H]1CCCO1	764406812	LIFFRRNCCUBKAB-XLXASQRYSA-N	439.516	1.734	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)[C@H](C)S(=O)(=O)C1CCOCC1	764566250	KTMBXXJPUCFNNR-ZDUSSCGKSA-N	437.543	1.862	50	20	IDGD	
CNC(=O)c1ccc(C=NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)cc1	764830626	IXJBCJSESKFBAA-UHFFFAOYSA-N	427.936	1.968	50	20	IDGD	
CC(C)Oc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)C(=O)NNC(=O)OC(C)(C)C	765397324	YQEIFJONUQYHFA-UHFFFAOYSA-N	444.510	1.219	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)[C@@H]3CC(=O)N(c4ccccc4)C3)n[nH]2)cc1OC	765598579	LNBQIKRNWBMGML-OAHLLOKOSA-N	449.467	1.908	50	20	IDGD	
NS(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)c1	765618161	YCHLCVXIYKCDSO-UHFFFAOYSA-N	437.840	1.591	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	766659878	HPMNREBXBHCRGX-UHFFFAOYSA-N	440.935	1.495	50	20	IDGD	
COC(=O)C(C)(C)[C@@H](NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)c1ccccc1	767146181	VLOMRFKBANEDJK-KRWDZBQOSA-N	437.460	1.547	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)Cc1cc(Cl)c2c(c1)OCCO2	767275549	QOFCDYRXZBQHAZ-UHFFFAOYSA-N	432.860	1.895	50	20	IDGD	
Cc1cc(C)cc(C(=O)NCC(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)c1	771391496	JXLFCPFYRYCMJG-UHFFFAOYSA-N	446.529	1.197	50	20	IDGD	
Cc1ccc(N2C[C@@H](C(=O)NNC(=O)C(=O)NCc3ccc(Cl)cc3)CC2=O)cc1	772194775	DKXQVMSDAMALCU-HNNXBMFYSA-N	428.876	1.465	50	20	IDGD	
Cc1cc(=O)c(C(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)nn1-c1ccccc1	772884057	HUTLYVBHQKNVLH-UHFFFAOYSA-N	439.859	1.272	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)[C@H](C)c3ccccc3)CC2)cc1	773389810	HAHSOKKYUNUKCU-GOSISDBHSA-N	444.557	1.252	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2cc(C)c(OC)cc2C)c2ccccc2c1=O	773525375	PKWHFTCGMNQIQY-UHFFFAOYSA-N	437.456	1.442	50	20	IDGD	
COC(=O)c1c(F)cccc1NNC(=O)[C@@H](Cc1cccc(OC)c1)n1nnnc1C	773641498	OHFHCHIAZRTPBX-QGZVFWFLSA-N	428.424	1.843	50	20	IDGD	
CON(C)S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2cccc(C(F)(F)F)c2)cc1	773743817	LUWWEUZYWKFBAU-UHFFFAOYSA-N	446.407	1.969	50	20	IDGD	
O=C(COc1ccc(Cl)cc1)NNC(=O)Nc1ccc(C[C@H]2NC(=O)NC2=O)cc1	775704324	ATXKXWXVVLNFMX-OAHLLOKOSA-N	431.836	1.322	50	20	IDGD	
Cc1ncc(C(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)c(C)n1	777275830	PDSFLQBIEWAWAZ-UHFFFAOYSA-N	428.452	1.926	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)[C@H]1CCCN(C(=O)c2ccc(Cl)cc2)C1	778442760	DRNJBIJRZJCWRH-AWEZNQCLSA-N	438.912	1.864	50	20	IDGD	
O=C(Cc1ccccn1)NNC(=O)C(=O)Nc1cc(Cl)ccc1OC[C@@H]1CCOC1	778711903	XNKJVJZCVWMHIS-CYBMUJFWSA-N	432.864	1.479	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNS(=O)(=O)c1ccccc1S(=O)(=O)NC1CC1	780387310	NMPSSYCSVAVYRD-UHFFFAOYSA-N	448.526	1.092	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2ccc(OC)c(-n3cnnn3)c2)ccc1OC(C)C	781578210	IGTDKJNWULKJEH-UHFFFAOYSA-N	426.433	1.542	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Cc2ccc3c(c2)NC(=O)C3)c1	784585962	CHWJUSZOFZGYJG-UHFFFAOYSA-N	444.513	1.215	50	20	IDGD	
COc1c(NC(=O)C(=O)NNc2nc(-c3ccc(Cl)cc3)no2)cccc1C(N)=O	784799860	QGASLJNJYFHDJQ-UHFFFAOYSA-N	430.808	1.579	50	20	IDGD	
CNC(=O)[C@@H]1CN(C(=O)C(=O)NNc2ccc(OC(F)(F)F)cc2)c2ccccc2O1	784803719	LNKSWESXPRPVRL-HNNXBMFYSA-N	438.362	1.569	50	20	IDGD	
CCn1nc(C)c(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)NC(C)(C)C)c1C	784833641	QJYWLTHPKNQUOT-UHFFFAOYSA-N	436.538	1.678	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc4c(c3)CCC(=O)N4)n[nH]2)c1	785126177	LGBITFGQTNKMKS-UHFFFAOYSA-N	446.467	1.978	50	20	IDGD	
CCN(C(=O)COC(=O)/C(C#N)=C/C1CC1)c1c(O)nc(=O)n(Cc2ccccc2)c1N	786672520	BAEMSYYXOHTXJD-MHWRWJLKSA-N	437.456	1.335	50	20	IDGD	
Cc1cc(OCc2ccc(C(=O)NNC(=O)NCc3nnn(C)n3)cc2)ccc1Cl	787438178	YWIYHEWBQAYCMJ-UHFFFAOYSA-N	429.868	1.895	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2cccc(N3CCNC3=O)c2C)c1	787541928	YDGJKPFUKGEISZ-UHFFFAOYSA-N	439.472	1.306	50	20	IDGD	
CCC1(CC)Oc2ccc(NC(=O)C(=O)NNC(=O)c3cc([N+](=O)[O-])ccc3O)cc2O1	787900941	KMMOEFRCSOWCKR-UHFFFAOYSA-N	444.400	1.988	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNS(=O)(=O)Cc1cc(C(C)(C)C)on1	788139909	QHQFYKGOCZACDP-UHFFFAOYSA-N	443.551	1.338	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)[C@@H]1CC(=O)N(C2CC2)[C@H]1c1cccc(OC)c1	788164952	WMIOCDNXPNJNMG-MJGOQNOKSA-N	433.505	1.684	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)COc2cc(C)ccc2C)c(C)cc1C	788330123	FKIZUDCOMGVXEV-UHFFFAOYSA-N	427.457	1.872	50	20	IDGD	
COc1cc(NC(=O)NNc2cc(Cl)nc(N)n2)ccc1S(=O)(=O)N1CCCC1	789102194	SGJYBPZNDQIVPC-UHFFFAOYSA-N	441.901	1.654	50	20	IDGD	
COC(=O)c1cc(C=NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)cn1C	790166845	WDOCRUUKJMZJGQ-UHFFFAOYSA-N	431.924	1.733	50	20	IDGD	
O=C(NNC(=O)N1CCc2ccc(Br)cc2C1)c1ccc(-n2cnnn2)cc1	790654561	CZBPKXAIIPIFKX-UHFFFAOYSA-N	442.277	1.838	50	20	IDGD	
O=C(NNc1cccc(F)c1[N+](=O)[O-])C(=O)Nc1cccc(C(=O)N2CCOCC2)c1	790997545	SAUICRNXEPAVSM-UHFFFAOYSA-N	431.380	1.288	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)c2cn(C)c3c(cnn3C)c2=O)cc1OC	791195599	DCQATKCKLINBFG-UHFFFAOYSA-N	427.461	1.534	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)CCc3ncc[nH]3)c2)cc1	791196211	ONQORJSESAVROJ-UHFFFAOYSA-N	443.485	1.613	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)N[C@@H]1C[C@H]1c1ccc(Br)c(F)c1	792309928	XYKXKVXJWHDOPS-GXFFZTMASA-N	439.241	1.798	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)N1CCNC(=O)[C@@H]1c1ccc(OC(F)(F)F)cc1	792361202	XGJIFGQNQHICHE-WBMJQRKESA-N	430.427	1.640	50	20	IDGD	
C[C@H]1CCC(=NNC(=O)C(=O)NN=C2CC[C@@H](C)C[C@H]2n2cncn2)[C@@H](n2cncn2)C1	794453076	IVGFEELHLMMELH-MHGIMSBQSA-N	440.512	1.236	50	20	IDGD	
CCOc1ccc(C(=O)NNS(=O)(=O)c2ccc(C(=O)OC)cc2F)cc1OC	794577748	ZRWHSRQASNFTOI-UHFFFAOYSA-N	426.422	1.643	50	20	IDGD	
CCCCn1nc(C(=O)NN=C(CS(=O)(=O)N(C)C)C(C)C)c2ccccc2c1=O	794876527	FKWLDDRDYDUPAA-UHFFFAOYSA-N	435.550	1.830	50	20	IDGD	
C#Cc1cc(F)c(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(OCC)cc2)c(F)c1	802566235	FNHNOZXARNFAEQ-GFCCVEGCSA-N	431.395	1.898	50	20	IDGD	
O=C(Cc1nc(-c2ccccc2)cs1)NNC(=O)CN1C(=O)NC2(CCCCC2)C1=O	802579115	GFWXVUHQSIYVSC-UHFFFAOYSA-N	441.513	1.755	50	20	IDGD	
Cc1onc(-c2cccnc2)c1C(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	803825329	ZTWINGIIJSHLBN-UHFFFAOYSA-N	425.357	1.571	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN1C(=O)C(F)(F)F)c1ccc(F)cc1Br	806527237	JSYNYDMVRCRELE-JTQLQIEISA-N	426.164	1.903	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)C(=O)Nc1ccc(F)c(S(=O)(=O)NC)c1)c1ccccc1	806979938	KJRKVRDNSZKXHQ-CQSZACIVSA-N	436.465	1.014	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)c1c[nH]c2c(OC(F)(F)F)cccc2c1=O	807369836	MBICRKLNXFEHSX-UHFFFAOYSA-N	431.367	1.977	50	20	IDGD	
COCCCS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2nccnc2C2CCC2)cc1	807462532	FMCAOMAUGQMVGK-UHFFFAOYSA-N	447.517	1.636	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1ccnc(C(F)(F)F)c1	808408738	ZSEKJUSFYZLSRJ-UHFFFAOYSA-N	435.406	1.319	50	20	IDGD	
Cc1cc(C)c(C)c(S(=O)(=O)NCC(=O)NNc2ccc(S(C)(=O)=O)cc2)c1C	810681048	IMXCSOWLLNBUBY-UHFFFAOYSA-N	439.559	1.745	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(Cl)c(Cl)c1)NNc1ccc(-n2ccnc2)nn1	811455392	DTCNPSFTSYSNBK-UHFFFAOYSA-N	442.288	1.391	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)c2cccc(S(=O)(=O)NC3CC3)c2)cc1	812727089	OEHUQQRLUHEBQS-UHFFFAOYSA-N	438.531	1.135	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)Nc2cc(Br)cn(C)c2=O)cc1	812951093	KFCYJHWMWIXLBN-UHFFFAOYSA-N	444.311	1.547	50	20	IDGD	
O=C1CN(Cc2cccc(NC(=O)C(=O)NNC(=O)CCC3CCCCC3)c2)CCN1	812979936	HWFNROYEYBGFIB-UHFFFAOYSA-N	429.521	1.065	50	20	IDGD	
CC(=NNC(=O)Cc1cc[nH]n1)c1ccc(S(=O)(=O)N2CCCC[C@@H]2C(=O)O)cc1	814957660	MHJUQFRHCQGWEE-QGZVFWFLSA-N	433.490	1.120	50	20	IDGD	
COC(=O)C(C)(C)c1csc(NC(=O)C(=O)NNC(=O)CCCc2cccs2)n1	815569608	AHQJIQVMGNUUCH-UHFFFAOYSA-N	438.531	1.764	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@H](C)C(=O)NNC(=O)C1CCN(S(C)(=O)=O)CC1	836608842	RYNULEHITMTROM-CYBMUJFWSA-N	431.942	1.543	50	20	IDGD	
CCOc1ccc(/C=C(\C#N)C(=O)OCC(=O)Nc2cccc(S(N)(=O)=O)c2)cc1	849205306	ZKLBMMPLBCTKSH-XNTDXEJSSA-N	429.454	1.822	50	20	IDGD	
O=C(C1CCN(S(=O)(=O)c2cc(Cl)ccc2Cl)CC1)N1CC[C@@H](B(O)O)C1	864233207	GMTIOXQRDVZOGT-GFCCVEGCSA-N	435.138	1.469	50	20	IDGD	
Cc1nc(C(C)(C)C)nc(O)c1C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	885804090	FEZARMJZQCGYRY-UHFFFAOYSA-N	440.548	1.761	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCc2ccccc21)c1cccc(S(=O)(=O)N2CCOCC2)c1	906446770	ANKDFICQRIFECO-HXUWFJFHSA-N	443.525	1.589	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)/C=C\c1ccccc1)C(=O)NNC(=O)c1cccnc1	912628603	PBJNEGWDFPMXST-OJNOIJSXSA-N	434.543	1.555	50	20	IDGD	
C[C@H]1CN(c2ccc(C(=O)NNC(=O)c3nn(-c4ccccc4)cc3O)cn2)C[C@@H](C)O1	914865277	LVWCMEGOBIBIJN-GASCZTMLSA-N	436.472	1.661	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)[C@H](Cc2cccc(F)c2)n2nnnc2C)cc1C	915695503	KTTWGPDYBORXAE-IBGZPJMESA-N	426.452	1.748	50	20	IDGD	
Cc1c(NC(=O)[C@@H](C)SCC(=O)NNC(=O)C(C)C)c(=O)n(-c2ccccc2)n1C	915776037	RJTTXQVCTPWPLK-CQSZACIVSA-N	433.534	1.348	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNS(=O)(=O)c2ccc(Cl)cc2)cc1	916110987	BBLPEGKUSLDXPC-UHFFFAOYSA-N	431.923	1.279	50	20	IDGD	
CCNC(=O)CNC(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccc(OC)c(OC)c1	916161975	YLOFBZOUAVKFAN-MHWRWJLKSA-N	436.472	1.640	50	20	IDGD	
O=C(CN1CCC(NC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)CC1)Nc1ccccc1	916240082	MCLKPIFUYQKGDS-UHFFFAOYSA-N	440.460	1.642	50	20	IDGD	
CCC(=O)Nc1cccc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1	916381631	OMAHHAMRPWTMRK-UHFFFAOYSA-N	447.517	1.430	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)N[C@@H]3C[C@H]4C[C@H]3[C@H]3CCC[C@@H]34)nc2)CC1	916585145	QCFNSNLFOFCMEG-GYFISPQKSA-N	448.593	1.469	50	20	IDGD	
CCCCN(C(=O)COC(=O)/C(C#N)=C\c1cccc(OC)c1)[C@H]1CCS(=O)(=O)C1	916599470	RQAZKGLHDGZPAF-PNDHZVEESA-N	434.514	1.961	50	20	IDGD	
CSCC[C@H](NC(=O)c1ccccc1)C(=O)NNC(=O)C(=O)Nc1ccc(C)cc1	916830686	PCVXFCGEVGLTBV-KRWDZBQOSA-N	428.514	1.633	50	20	IDGD	
Cc1cccc(-n2nnc(C(=O)NNC(=O)CCN3CCN(c4ccccc4)CC3)c2C)c1	917532393	UTTLHWZGDKHQCJ-UHFFFAOYSA-N	447.543	1.857	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)N1CCCCC1	918119458	BPDSPRDRKBWAIL-MRXNPFEDSA-N	437.566	1.290	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)Cn2c(CS(C)(=O)=O)nc3ccccc32)cc1	920010480	HLZPCUKZYCLAII-UHFFFAOYSA-N	444.513	1.370	50	20	IDGD	
CNC(=O)c1ccc(CNC(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1	1116092319	OZQCRFGDHQUWSG-UHFFFAOYSA-N	433.509	1.524	50	20	IDGD	
COc1ccc(S(=O)(=O)CCC(=O)NNC(=O)c2ccccc2Cl)cc1OC	1319039334	MNLLKAORNWRJHY-UHFFFAOYSA-N	426.878	1.982	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)CO[C@H]2CCOC2)c1	1319065217	OHSBSPYTJDXVDQ-HNNXBMFYSA-N	449.485	1.063	50	20	IDGD	
Cc1cc(C)n(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CO[Si](C)(C)C)C2)n1	1779539704	KBNHXNVNSBLDCE-WIYYLYMNSA-N	436.629	1.865	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CC#N)C2	1780054208	BMHJSGDWQIIJNY-WIYYLYMNSA-N	444.444	1.561	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@@]3(CN(C(=O)CCBr)CCO3)C2)n(C(F)F)n1	1780309060	DUABWFNSTHUYPN-MRXNPFEDSA-N	435.269	1.815	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2)c1cccc(F)c1[N+](=O)[O-]	1780997836	GNYCXHQBCJCCPG-SPYBWZPUSA-N	443.859	1.461	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)[C@H](C)CNC(=O)OC(C)(C)C)CCO2)C1	1781211281	OOLBDQWYKWVWEF-SXGZJXTBSA-N	431.961	1.995	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)COC(=O)C(F)(F)F)CCO2)C1	1781230087	MVJXFAONHAAOGX-UONOGXRCSA-N	435.226	1.158	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](F)Br)C3)C2)c(F)c1	1781334039	USFXOHDUAJKCSM-YOEHRIQHSA-N	433.249	1.968	50	20	IDGD	
O=C(c1ccc(C(F)(F)F)c(F)c1)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1781619497	DWRRLICADNQWPC-RHSMWYFYSA-N	438.805	1.888	50	20	IDGD	
C=C[C@H](O)C(C)(C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)Br)C1	1781997952	OVMNFJOIBXQNGC-XTDOFWJNSA-N	431.371	1.857	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnn4c3CCC4)C2)C1	1782322914	UYBJEYQZWNCXMZ-RDTXWAMCSA-N	425.327	1.446	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3nc4ccccn4n3)CCO2)C1	1783344151	ZLISHYCMBVQWFA-ACJLOTCBSA-N	436.310	1.346	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H]3C[C@@]34C(=O)Nc3ccccc34)C2)C1	1783492378	BZZNHSYEDITPFR-XARZLDAJSA-N	445.947	1.991	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)CNC(=O)c3cccs3)CCO2)C1	1783532621	QEGMRWLOWBKQMF-PXAZEXFGSA-N	444.351	1.091	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN3C(=O)CSC3=S)C[C@@H]21	1784624987	YKERXVNVJVRRTQ-XUXIUFHCSA-N	448.010	1.234	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)C1CCC(C(F)(F)F)CC1	1784868880	XUVKAKJHSJMXCK-IFQCYBEWSA-N	440.890	1.935	50	20	IDGD	
COc1cncc(CCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)C(Cl)Cl)C[C@@H]32)c1	1785269301	XCAIABKAJAXLKK-BPUTZDHNSA-N	430.332	1.806	50	20	IDGD	
Cc1nn(C)c(C(=O)Nc2ccc(C3(NC(=O)CCC(=O)NN(C)C)CCC3)cc2)c1F	1787177233	YMPQMCNUVFTRFR-UHFFFAOYSA-N	444.511	1.988	50	20	IDGD	
C[C@@H](Br)C(=O)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1	1788143555	MZDULWYKJJDUAM-CYBMUJFWSA-N	445.122	1.898	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4cncn4c3)[C@H]2C1	1788427592	YBIMQNLTXWUZKD-WDSOQIARSA-N	430.581	1.779	50	20	IDGD	
C[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21)N1CSCSC1	1788682943	MXEYAQBUZADWDS-QMVSFRDZSA-N	425.979	1.544	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nccnc3OC)C[C@@H]21	1790960772	DUYDFSIGYYLUEO-FQUUOJAGSA-N	441.326	1.252	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)n1cccc1C=O	1795752597	SJGMSYCPWZGJCH-BDLOOMQFSA-N	440.338	1.625	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(C)s1)C2	1796440913	DRKBOCJVJXSABE-SNOXVSQISA-N	443.529	1.394	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](C)Cn1ccnc1)C2	1796893201	QWOJCKDZXIPCFK-CZRLGECOSA-N	439.520	1.291	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2)[C@@H](O)c1cccc(Br)c1	1799096937	CQIPTYIDBOVGEQ-HZZBMVKVSA-N	449.704	1.607	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(C)c(C(=O)O)c(C)c1)C2	1800979663	UDDVVSMZWWPBFV-KYHPRHEASA-N	438.908	1.459	50	20	IDGD	
O=C1C[C@@H](C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](Br)Cc2ccccc2)CN1	1801570786	WENVNWSITNWPHR-UYTYNIKBSA-N	448.361	1.767	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CNc2ccc(F)cc2)[C@H]1c1cccnc1)[C@@H](O)CCl	1803138619	LOXVHTWMBGFXOC-QSFXBCCZSA-N	434.899	1.938	50	20	IDGD	
CN1N=C(C(=O)NC[C@H]2CCN(C(=O)CO[Si](C)(C)C)[C@@H]2c2cccnc2)CCC1=O	1804120576	KADZJECWCMUSRZ-OXQOHEQNSA-N	445.596	1.547	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1)c1ccc(O)nn1	1805267434	IRFMBNMSHKSDTL-SUMWQHHRSA-N	434.294	1.682	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H](CNC(=O)CN)[C@H]1c1cccnc1	1807029397	PSRDEWRTZBBGJV-HLLBOEOZSA-N	439.944	1.178	50	20	IDGD	
C[C@H](CC(N)=O)C(=O)N1CC[C@H](CNC(=O)[C@H](F)Br)[C@H]1c1cccnc1	1808649422	RLIVLVZAIVUIHL-LTZCYQRMSA-N	429.290	1.289	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)c1cn2cc(F)ccc2n1	1809848235	QSTJLRKLVSRWCN-YJLNNSPDSA-N	445.882	1.788	50	20	IDGD	
O=C(c1ccc2c[nH]nc2c1)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1	1809977840	JFPDVBASMNLIKS-UHFFFAOYSA-N	446.316	1.401	50	20	IDGD	
Cc1csc(C(=O)N2CCC3(CCCN(C(=O)c4cccc(B(O)O)c4)C3)CC2)c1	1809977989	QFZJIRDIGFTQLX-UHFFFAOYSA-N	426.347	1.895	50	20	IDGD	
CSCC(C)(C)C(=O)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1	1809978011	SPOROVVGXNKENN-UHFFFAOYSA-N	432.395	1.600	50	20	IDGD	
C[C@H](NC(=O)c1cnccn1)C(=O)N1CCC2(CCCN(C(=O)[C@H](F)Cl)C2)CC1	1810904871	USJRWQKKJWLYCO-ZFWWWQNUSA-N	425.892	1.361	50	20	IDGD	
CCc1cc(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](Cl)COC)[C@@H]2c2cccnc2)n(C)n1	1810922407	SGQJTVWANPJHFD-VDZJLULYSA-N	433.940	1.951	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2cccc(F)c2)[C@@H]1c1cccnc1	1811807678	SGQNOTPWIOOPDR-AVRDEDQJSA-N	441.507	1.913	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)C1CC2(CCC2)C1	1813650100	UXGBXHCVLFBEQY-UGKGYDQZSA-N	447.344	1.661	50	20	IDGD	
C[C@H](CBr)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN2CCOCC2)[nH]n1	1814780800	TUPCNWMVYSPCQQ-HIFRSBDPSA-N	442.358	1.765	50	20	IDGD	
Cc1cccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)n1	1816393589	NVQDOCGQOJIJSL-LJQANCHMSA-N	433.277	1.413	50	20	IDGD	
O=C(Cc1ccccc1)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1816889105	KJOWBGAJYCOLLZ-HXUWFJFHSA-N	432.289	1.638	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)CC(F)(F)F)n[nH]1	1817102238	CRHWRQGTFYQRIQ-ZDUSSCGKSA-N	439.398	1.667	50	20	IDGD	
CNCCCC(=O)N1CCCC[C@H]1c1cc(NC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)n[nH]1	1818111854	LPCDGYNVNRUQGR-YSGZUTGPSA-N	442.524	1.535	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3nc4ncccn4n3)sc2C1	1818310386	NDOAZNOONUGNFV-ZJUUUORDSA-N	435.897	1.060	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](O)CCl)CC2)c1ccc2nccnc2c1	1818488431	RUHAJQUBUMZYFP-XHDPSFHLSA-N	431.905	1.912	50	20	IDGD	
CN1CCN(CC(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@@](C)(Cl)CCl)CC3)CC1	1818802928	OQYSVSCIUDCMDM-XIKOKIGWSA-N	448.420	1.539	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H]2C[C@H](O)CN2)n[nH]1	1820754061	WBDXLSWQSLNRNY-XCCSTKFXSA-N	428.331	1.298	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnn3c2OCCC3)n[nH]1	1821434939	XAWPTZJFXRWXIT-HIFRSBDPSA-N	436.900	1.948	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)Cn2ccncc2=O)n[nH]1	1821656947	SLXYNXDBMIBHFA-SCLBCKFNSA-N	441.319	1.895	50	20	IDGD	
C[C@H](C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](F)Br)[nH]n1)n1ccnn1	1821724453	DWKALMQVFKLCNZ-IRUJWGPZSA-N	428.266	1.945	50	20	IDGD	
C=CCSCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1	1824958207	OHHCSHPITHCGJT-LJQANCHMSA-N	445.589	1.838	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)C[C@@](C)(O)CC(=O)O)CC2	1825647078	IMPPKNHKFJQMMI-OMQMVUIESA-N	448.339	1.454	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnn3cccnc13)CC2	1826000667	ZWHANRAPBPNQAV-ZYHUDNBSSA-N	434.909	1.665	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc3n(n2)CCNC3=O)CC1	1826197243	HJFUKECRGZKDJX-NVXWUHKLSA-N	435.956	1.877	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)C(=O)C2CC2)CC1	1827677034	BTGNYDGHGGMZBW-KWXFCVSUSA-N	441.532	1.719	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H]2CC2(F)F)CC1	1828376976	QQTBNRXBQJPNMP-DLBZAZTESA-N	435.475	1.574	50	20	IDGD	
Cc1n[nH]cc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1	1829742821	PTIQKEQWTTZLLY-LJQANCHMSA-N	439.520	1.264	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(C)c3F)CCO2)C1	1830104129	WNQLNOCJISPFDT-UZLBHIALSA-N	428.888	1.458	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(O)c(OC)c3)C2)C1	1831654043	HWNHUSIFKPTRRH-KKSFZXQISA-N	440.924	1.878	50	20	IDGD	
C[C@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1)n1cccn1	1832239413	FTPJVOWZJDQIEO-IEBWSBKVSA-N	432.569	1.437	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CCCC(F)(F)F)CCO2)C1	1832265670	XRHHJOLPBFGUSW-DOMZBBRYSA-N	445.276	1.959	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3ccc(C)s3)CCO2)C1	1832888013	FMUSIXWBUHDNTQ-XLIONFOSSA-N	444.981	1.699	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)COC3CCCCC3)CC2)CC1)[C@H](O)CCl	1833306710	ZJSROMPDRUFQTR-LJQANCHMSA-N	429.989	1.507	50	20	IDGD	
COc1cc(C(=O)N2CCC(N3CCC(NC(=O)[C@H](O)CCl)CC3)CC2)ccc1O	1833313724	PKODFCFICVZVHY-GOSISDBHSA-N	439.940	1.186	50	20	IDGD	
Cn1ncc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)c1C(F)(F)F	1833327181	XSSFDQHYQCVANG-WFASDCNBSA-N	442.797	1.043	50	20	IDGD	
CCc1ncccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1	1833518986	IQIZMVVKFVQSBI-PMACEKPBSA-N	444.359	1.950	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)[C@@H]1Cc2ccccc2O1	1835474698	IBOYVVBPYKYGLV-ICSRJNTNSA-N	435.952	1.161	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CC[C@@H](C)O1)CCO2	1836609368	OCBAZVYJJCDPOF-ADAWSYLGSA-N	433.343	1.184	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)C3CC(O)C3)CC2)CC1	1836684206	MLGZYRZVZYHJDU-MQBCKMQZSA-N	431.371	1.929	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](OC(C)=O)C(C)C)CCO2	1837214763	ZNBUVWXOKVUBAJ-QKLQHJQFSA-N	432.945	1.438	50	20	IDGD	
Cc1nc(C(=O)N2CCOC[C@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)cs1	1837712367	NQQJBXAEKATDJY-SFHVURJKSA-N	427.599	1.373	50	20	IDGD	
Cc1noc(N)c1C(=O)N1CCC(OC2CCN(C(=O)[C@@H](C)Br)CC2)CC1	1837861137	YDYLOJAFEAIRKD-LLVKDONJSA-N	443.342	1.961	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(-c4ccccn4)[nH]n3)CCO2)C1	1838051214	DSHUVPFMPBEUIZ-QVKFZJNVSA-N	447.923	1.559	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3ccnc(OC)c3)CC2)CC1	1838466064	OBXHTRYUQDMGKJ-GOSISDBHSA-N	439.940	1.956	50	20	IDGD	
Cc1nn(C)cc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2	1839150172	DEUPYWHZRIVOTP-MSOLQXFVSA-N	433.336	1.035	50	20	IDGD	
C[C@H](C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2)n1ccnc1	1839150851	ZFWRHTSGPZGWNT-ZTFGCOKTSA-N	433.336	1.137	50	20	IDGD	
CCOc1cccc(C(=O)N2CCO[C@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)c1O	1839427835	WXKDSFDBMIYGAJ-LJQANCHMSA-N	447.315	1.665	50	20	IDGD	
COc1cc(C)c(C)cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1839464573	UYIZFCHSGUOCFM-PXNSSMCTSA-N	428.888	1.916	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3n[nH]c4ccc(C#N)cc34)CCO2)C1	1839489228	TZJGILFKXMBJSY-HRAATJIYSA-N	445.907	1.522	50	20	IDGD	
Cc1cccn2ncc(C(=O)N3CCO[C@@]4(COCCN(C(=O)C(C)(C)CCl)C4)C3)c12	1839610635	VIHMBXJBYNZZMA-QFIPXVFZSA-N	448.951	1.978	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cc(C)on3)C2)C1	1839967122	BDYTWTOWIZNSIT-MAUKXSAKSA-N	444.326	1.155	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(C)cc3Cl)C2)C1	1840155967	GNQMEULQEOGSCP-YLJYHZDGSA-N	445.343	1.972	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)cc1	1840728133	MRBQJYBZZXICIO-IBGZPJMESA-N	444.315	1.519	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)C3CCSCC3)CCO2)C1	1840925046	JWRJGWOURNNTCB-ZWKOTPCHSA-N	439.405	1.822	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)CC[C@H]2CNc3ccccc3C2)C1	1842955244	NVJSYJJYVNFGKM-GOSISDBHSA-N	447.344	1.248	50	20	IDGD	
C[C@@H]1CCC[C@H]1C(=O)N1CCCC12CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2	1843967551	WIVCSWAVTKZPJD-UYAOXDASSA-N	441.576	1.972	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H](C(=O)N2CCCC23CN(C(=O)[C@@H](F)Cl)C3)[C@H]2OCC[C@H]21	1846184251	CRFNNFGUYPVMHH-GBJTYRQASA-N	445.919	1.749	50	20	IDGD	
C[C@H]1CC[C@@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](O)CCl)N1C(=O)OC(C)(C)C	1847217858	QPYQWVCFCHKZMO-UVPYHEFZSA-N	429.945	1.576	50	20	IDGD	
C=CCC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl	1847564810	DIBSEFMRRUZXPD-FXUDXRNXSA-N	429.945	1.647	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H]1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CCBr	1847954692	BENSABNLRFGJAE-MELADBBJSA-N	430.343	1.983	50	20	IDGD	
CN(CC(=O)NNC(=O)c1cccs1)CC(=O)Nc1ccccc1Br	15449963	BMGKEXGEBLIIQB-UHFFFAOYSA-N	425.308	1.842	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)c1ccccc1)C(=O)NNC(=O)c1ccccc1F	15794537	ONROWALDPFDANI-INIZCTEOSA-N	425.507	1.687	50	20	IDGD	
O=C(NNC(=O)c1ccc[nH]1)c1ccc(Cl)c(S(=O)(=O)NC[C@H]2CCCO2)c1	726629596	JKPIBBOFHQDLJE-GFCCVEGCSA-N	426.882	1.200	50	20	IDGD	
Cn1ncc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1C(F)F	727293752	ZBPGJWDMOYKKSV-UHFFFAOYSA-N	427.433	1.217	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)CNC(=O)NCc1ccc(Cl)cc1	727363917	IWVJDAFTCOAMPG-UHFFFAOYSA-N	434.880	1.764	50	20	IDGD	
COc1nc(C)cc(C)c1CNC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	727605500	LQBMGELPCGVMRE-UHFFFAOYSA-N	440.548	1.750	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNS(=O)(=O)c1cccc(-n2cnnn2)c1	728170593	HLDOMCPPAINGRT-UHFFFAOYSA-N	441.498	1.718	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)C[C@H](c2ccccc2)N2CCOC2=O)cc1	728380494	OJWJZCNKOHUHQI-GOSISDBHSA-N	425.441	1.883	50	20	IDGD	
NC(=O)[C@@H]1CC(C(=O)NNC(=O)c2cc(F)ccc2Br)=NN1c1ccccc1	728549078	BSCOTYCPQCDPBR-HNNXBMFYSA-N	448.252	1.469	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCN([C@H](C)c3ccc(F)cc3F)CC2)n1	728932017	IKSRIFBDLQEHOV-CQSZACIVSA-N	437.516	1.798	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)N2CCCN(S(=O)(=O)c3ccc(F)cc3)CC2)c1	728955152	ZMPPDWSMQBNAKM-UHFFFAOYSA-N	445.476	1.448	50	20	IDGD	
CN1CCN(Cc2ccc(CNC(=O)NNC(=O)Cn3ccc4ccccc43)cc2)CC1	729497935	UHLMVGZUUJPKNM-UHFFFAOYSA-N	434.544	1.919	50	20	IDGD	
COC(=O)c1ccc(COc2ccccc2C=NNC(=O)[C@@H]2CCS(=O)(=O)C2)cc1	730575771	HSYQMCOITGEHLV-GOSISDBHSA-N	430.482	1.937	50	20	IDGD	
Cc1nnc(NNC(=O)CC[C@H]2NC(=O)N(c3ccc(Cl)c(Cl)c3)C2=O)nc1O	730585859	QYSAZJRTVNGTDF-LLVKDONJSA-N	440.247	1.541	50	20	IDGD	
CCOc1cc(C=NNC(=O)Cc2cc(O)nc(S)n2)ccc1O[C@H](C)C(=O)N(C)C	730586365	GDOZHRQDEIDMGD-GFCCVEGCSA-N	447.517	1.418	50	20	IDGD	
O=C(NNc1nc(-c2ccncc2)no1)[C@@H]1CS[C@H](Cc2ccccc2F)C(=O)N1	732065630	RVYDHPVHNNOJTE-LSDHHAIUSA-N	428.449	1.557	50	20	IDGD	
Cc1cccc(-c2nnc(S)n2CC(=O)NNC(=O)CCN2C[C@@H](C)O[C@H](C)C2)c1	732260906	JAHCIIINKWUTDG-HUUCEWRRSA-N	432.550	1.189	50	20	IDGD	
C[C@H]1CCC[C@@H](OCC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)C1	732931758	GENIMJLURUOSBK-DOTOQJQBSA-N	439.534	1.064	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)NCC1(c2cccc(Br)c2)CC1	734524433	DSMTXQQLICKNSC-UHFFFAOYSA-N	435.278	1.834	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)c2cc(F)cc([N+](=O)[O-])c2N)CC1	734824905	MNDSUTOLMATMGT-UHFFFAOYSA-N	440.432	1.660	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)N[C@@H](C)CN1CCN(c2ccccn2)CC1	735587803	XXELRRZZGSLHEN-SFHVURJKSA-N	440.548	1.564	50	20	IDGD	
CSCC[C@H](C(=O)NNC(=O)COCc1ccccc1)N1C(=O)[C@H]2CCCC[C@H]2C1=O	737634833	OERVBRCYIRMYLQ-FGTMMUONSA-N	447.557	1.648	50	20	IDGD	
CCCCS(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)c2ccc(C)cc2O)cc1	737757476	ZCFVNRNNIHNSLC-UHFFFAOYSA-N	441.531	1.866	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)[C@@H]1CCCN(C(=O)c2ccc3n[nH]cc3c2)C1	737926405	GTNCKIDNLWDNJQ-GOSISDBHSA-N	435.484	1.779	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)CCS(=O)(=O)c2ccc3c(c2)OCCCO3)c1	741144206	KMABMSKLMZCQJL-UHFFFAOYSA-N	447.513	1.539	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CSc2nnc(COc3ccc(F)cc3)n2N)c1	741851066	IFVAXKQZFFWNHV-UHFFFAOYSA-N	441.448	1.135	50	20	IDGD	
CCCS(=O)(=O)N1CCCC[C@@H]1C(=O)NNC(=O)c1cccc(Br)c1	742769788	SXHPDMQDIOCDMK-CQSZACIVSA-N	432.340	1.804	50	20	IDGD	
COCCOc1ccccc1CNC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	743544057	OFKZABKSZDQGBQ-UHFFFAOYSA-N	436.490	1.651	50	20	IDGD	
Cc1ccc([C@]2(C)NC(=O)N(CC(=O)NNC(=O)Nc3ccc(N(C)C)cc3)C2=O)cc1	743827016	VYBLYFMKRFDYEN-QFIPXVFZSA-N	438.488	1.681	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)c2cn(Cc3ccccn3)nn2)cc1Cl	743834246	XECBNXKFLBLNFY-UHFFFAOYSA-N	431.840	1.859	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H](c2ccccc2)N(C)C)c1	744313653	FRHQKNJKHFHPOE-LJQANCHMSA-N	432.546	1.781	50	20	IDGD	
Cc1ccc(N2C(=O)CC[C@H](C(=O)NNC(=O)C(=O)NC3CC3)[C@@H]2c2cccs2)cc1	744463542	KAEIRKQQSTYQJW-QFBILLFUSA-N	440.525	1.967	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)O[C@H](C)C(=O)N2CCN(c3ncccn3)CC2)cc(C#N)n1C	744632861	QGGCZIOIXGWPND-CJMVGXJBSA-N	433.472	1.183	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)c2c(C)cc(=O)n(CC(=O)NC(C)C)c2C)c1	746013470	CDMUBVZOTUEAKS-UHFFFAOYSA-N	442.516	1.447	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)C1CCN(C(=O)/C=C\c2ccccc2)CC1	746547985	ATJJIZLCVQTOGF-KTKRTIGZSA-N	431.496	1.976	50	20	IDGD	
CSCc1noc(CCC(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)n1	746855671	BBRISEAJOKBZLK-UHFFFAOYSA-N	446.577	1.139	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccc(Br)c(C(=O)NNC(=O)c2ccc[nH]2)c1	747662444	OFDLKBNUYWZRCE-UHFFFAOYSA-N	443.323	1.929	50	20	IDGD	
CC[C@@H](Oc1ccccc1F)C(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1	748285914	MHLRJLNTFLYPCE-QGZVFWFLSA-N	437.493	1.760	50	20	IDGD	
CC[S@](=O)[C@@H]1CCC[C@@H](NC(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)C1	750265270	BJIVBEAUCFJSMR-SIJNZQJQSA-N	427.523	1.736	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)CN1CCN(C(=O)OCc2ccccc2)CC1	751061049	RDYKKHNSHDZBFI-UHFFFAOYSA-N	440.500	1.427	50	20	IDGD	
O=C(NNC(=O)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1)[C@@H]1CCS(=O)(=O)C1	751062867	NSKYJKXIUHHSPF-PBHICJAKSA-N	433.452	1.023	50	20	IDGD	
O=C(NNC(=O)c1csc(-c2cccc(C(F)(F)F)c2)n1)N[C@@H]1CCS(=O)(=O)C1	751363519	XJZSEXVBKWMNJZ-LLVKDONJSA-N	448.448	1.960	50	20	IDGD	
O=C(NNC(=S)Nc1ccccn1)[C@@H]1CC(=O)N(CCOc2ccccc2Cl)C1	752313991	FJRCOFSQPKXOKS-CYBMUJFWSA-N	433.921	1.980	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCc2ccc3c(c2)C(=O)NCC3)cc(OC)c1OC	754135970	SGQJDLIBGSTRCQ-UHFFFAOYSA-N	428.445	1.143	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(N(C)C)c(NC(=O)NNC(=O)c2ccccn2)c1	755435260	RUVUHKJMZVQGKU-UHFFFAOYSA-N	434.522	1.645	50	20	IDGD	
CNC(=O)Cc1ccc(NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1	755659046	QVWPBCMVZLFICR-UHFFFAOYSA-N	438.532	1.340	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)CNC(=O)c2ccco2)cc(C)c1Br	756189596	MKPXCWIBDDWUOT-UHFFFAOYSA-N	437.250	1.175	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)Nc1ccc(S(=O)(=O)NC2CC2)cc1	756777439	XSGMUCPDSTURTK-UHFFFAOYSA-N	442.457	1.243	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Nc2ccc3c(c2)C(=O)N(C)CC3)cc(OC)c1OC	757690629	NXTJMEAXZMFKGL-UHFFFAOYSA-N	428.445	1.807	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)nn1CCC#N	757830918	LZYYQDNUTNTXPN-UHFFFAOYSA-N	445.505	1.356	50	20	IDGD	
CCc1ccc(S(C)(=O)=O)cc1C(=O)NNC(=O)c1cc(OC)c(OC)c(OC)c1	758055732	RYCNJKORMRGLMX-UHFFFAOYSA-N	436.486	1.753	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCc2ccc3c(c2)C(=O)NCC3)nc1	758685723	UOVFKQWMSRAVTE-UHFFFAOYSA-N	446.533	1.224	50	20	IDGD	
O=C(NC[C@H]1CN(Cc2ccccc2)CCCO1)NNC(=O)c1cccc([N+](=O)[O-])c1	759362804	MLLUHEUXHWCHQY-IBGZPJMESA-N	427.461	1.830	50	20	IDGD	
COc1ccc(C[C@H](C)CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1	759676499	PVXUBXOEKBUQNA-HNNXBMFYSA-N	448.545	1.768	50	20	IDGD	
CCS(=O)(=O)c1cc(F)ccc1NC(=O)NNC(=O)COc1ccc(OC)cc1	760013725	GASOGGDAYJNKLF-UHFFFAOYSA-N	425.438	1.860	50	20	IDGD	
COc1ccccc1C(=O)C(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	760920078	YYMJIHRNZWTSLL-UHFFFAOYSA-N	444.919	1.497	50	20	IDGD	
COc1ccc(C[C@H](C)CNC(=O)NNC(=O)CNC(=O)c2cccs2)cc1OC	762572309	YSZRPFQVFKVOTJ-ZDUSSCGKSA-N	434.518	1.704	50	20	IDGD	
CC(C)n1nnnc1-c1ccccc1NC(=O)C(=O)NNC(=O)c1c[nH]c2ccccc12	763540883	LUJYLTUFDWPTNT-UHFFFAOYSA-N	432.444	1.802	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(F)c(N3CCCC3)c(F)c2)cc1OC	763550607	HJXDDFDOCVVQDU-UHFFFAOYSA-N	448.426	1.982	50	20	IDGD	
Cc1coc(-c2cc(NC(=O)C(=O)NNC(=O)[C@@H]3COc4ccccc4O3)ccc2C)n1	763578863	QUJJCUWLJAKMQM-SFHVURJKSA-N	436.424	1.884	50	20	IDGD	
COC(=O)c1cccc(NC(=O)C(=O)NNC(=O)COc2cccc(C(F)(F)F)c2)c1	763638973	GIVAGDDQUXBIQO-UHFFFAOYSA-N	439.346	1.657	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccc(NC(=O)C2CC2)c1	763656862	GSPAHJLVDLLLIT-UHFFFAOYSA-N	426.429	1.209	50	20	IDGD	
COc1ccc(Cn2nccc2NC(=O)C(=O)NNC(=O)COc2ccccc2F)cc1	763682781	OKJJURNDHHDITK-UHFFFAOYSA-N	441.419	1.244	50	20	IDGD	
Cc1ccc(C(=O)N2CCOCC2)cc1NC(=O)C(=O)NNC(=O)c1cccc(Cl)c1	763749725	CVRDATJLHNOECO-UHFFFAOYSA-N	444.875	1.521	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1cccc(-c2nncn2C)c1	763866338	OSBVXJMLRAMPBS-LBPRGKRZSA-N	426.408	1.175	50	20	IDGD	
O=C(Cc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1cnn(-c2cnc3ccccc3n2)c1	763936376	HXUAUJIOGBDDDL-UHFFFAOYSA-N	449.858	1.798	50	20	IDGD	
Cc1nn(C)c2ncc(NC(=O)C(=O)NNC(=O)c3ccc(Br)s3)cc12	763939557	BBMHANNDXSLAKS-UHFFFAOYSA-N	437.279	1.500	50	20	IDGD	
CC(C)(C)[C@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3cccc(C(N)=O)n3)cc2C1	763940059	IGQGRHOJJXYPAG-LBPRGKRZSA-N	443.529	1.793	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccccc1CN1C[C@@H](C)O[C@H](C)C1	764047634	JPNAQPIZQZMHSY-HZPDHXFCSA-N	440.500	1.704	50	20	IDGD	
O=C(NNC(=O)c1cccc(Br)c1)C(=O)Nc1cccc(-c2nnco2)c1	764063535	QTVQRTUGARLIIM-UHFFFAOYSA-N	430.218	1.899	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)C2CCCC2)cc1S(=O)(=O)N1CCCCC1	764064091	DQZVTLDEEHWLEY-UHFFFAOYSA-N	436.534	1.446	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2cccc(N3CCOC3=O)c2C)cc1	764124150	DHCHJBYDMDCLPQ-UHFFFAOYSA-N	440.456	1.679	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccc([C@@H](C)N2CCOCC2)cc1	764137150	ZYCQLXWMHXOGNU-MRXNPFEDSA-N	440.500	1.417	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)CCC2CCCCC2)c(=O)n(-c2ccccc2)n1C	764210499	IHTQTKBOORPNLW-UHFFFAOYSA-N	427.505	1.931	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1ccc(OC[C@@H]2CCCO2)cc1	764277641	LXUIFMCXZRRUBA-INIZCTEOSA-N	429.429	1.115	50	20	IDGD	
CCN1CCC(n2nccc2NC(=O)C(=O)NNC(=O)C(C)(C)c2ccccc2)CC1	764309523	PHDCBKFIEDABGN-UHFFFAOYSA-N	426.521	1.604	50	20	IDGD	
COc1cccc(-c2nsc(NC(=O)C(=O)NNC(=O)c3ccc(O)c(Cl)c3)n2)c1	764350064	ZUYNDTWTDZXQCP-UHFFFAOYSA-N	447.860	1.972	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)C(=O)Nc1ccccc1C(=O)N1C[C@@H](C)C[C@@H](C)C1	764389626	UHNIZDXSPUFGEN-GASCZTMLSA-N	437.500	1.908	50	20	IDGD	
CC(C)(C)OC(=O)N1CCO[C@@H](C(=O)NNC(=O)c2ccc(Br)s2)C1	764568832	KYMPDUUHPAWRAV-SECBINFHSA-N	434.312	1.908	50	20	IDGD	
C[C@H](NS(=O)(=O)c1cccc(C#N)c1)C(=O)NNC(=O)c1cc2c(s1)CC[C@@H](C)C2	764571792	KLSOKKLEIDGWLY-OLZOCXBDSA-N	446.554	1.873	50	20	IDGD	
O=C(Cc1c[nH]c2cc(Br)ccc12)NNC(=O)c1ccc(-n2cnnn2)cc1	764581938	ZWBYLZKZAGCWEZ-UHFFFAOYSA-N	440.261	1.910	50	20	IDGD	
CCOC(=O)NNC(=O)C(=O)Nc1ccc2c(c1)N(C(=O)Cc1cccc(OC)c1)CC2	765409540	OMCDBDJBXBPUMU-UHFFFAOYSA-N	440.456	1.543	50	20	IDGD	
COc1ccc(Cn2ncc(C)c2NC(=O)C(=O)NNc2nccnc2OC)cc1OC	766262026	PPSXKQKLEYPLEL-UHFFFAOYSA-N	441.448	1.137	50	20	IDGD	
CC(=NNC(=O)Cc1cc(C)[nH]n1)c1ccc(S(=O)(=O)N2CCCC[C@H]2C(=O)O)cc1	767402716	DZWDPJKKXXVHKF-SFHVURJKSA-N	447.517	1.429	50	20	IDGD	
COc1cc2c(cc1OC)CN(C(=O)CCC(=O)NNc1ccnc(N(C)C)n1)CC2	768148513	ZMIBMCOHWZUOFQ-UHFFFAOYSA-N	428.493	1.368	50	20	IDGD	
COc1ccc(Cn2ncc3cc(C(=O)NNC(=O)c4cc(C)[nH]n4)cnc32)c(OC)c1	768279138	ZJGMUQNWSHEBER-UHFFFAOYSA-N	435.444	1.603	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)CCN2C(=O)c3ccccc3C2=O)n[nH]1	768281824	QFCULOLNWNCMMO-UHFFFAOYSA-N	433.424	1.533	50	20	IDGD	
CS(=O)(=O)c1nc(C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)c2ccccn12	768289152	OSUUDONFYARJNX-UHFFFAOYSA-N	442.432	1.342	50	20	IDGD	
COc1cc(N[C@H]2CCCN(CC(=O)NNC(=O)c3ccc(C#N)cc3)C2)cc(OC)c1	768555123	HTDPIFWCTZACLI-SFHVURJKSA-N	437.500	1.913	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)c1ccc(N2C[C@@H](C)O[C@H](C)C2)nc1	768641829	WVHOEUIIVZOVIC-ZIAGYGMSSA-N	434.518	1.864	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)N[C@@H]2CCOC3(CCOCC3)C2)nc1	769199785	DTLBNXRQBXJRRZ-OAHLLOKOSA-N	441.554	1.466	50	20	IDGD	
COC(=O)c1ccc(S(=O)(=O)NNC(=O)c2sc(-c3ccccc3)nc2C)cn1	769625168	ITAMATKHIVZYDU-UHFFFAOYSA-N	432.483	1.923	50	20	IDGD	
O=C(NNC(=O)N1CC[C@@]2(C1)OCc1ccccc12)c1csc(N2CCOCC2)n1	770308021	QWRRAWOVFSEXAD-FQEVSTJZSA-N	429.502	1.466	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)N1CC[C@H](C(=O)NCC(F)(F)F)C1	770646495	FKULJLBAMFAFQR-QWRGUYRKSA-N	436.818	1.849	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)c1cc(N2C[C@H](C)O[C@H](C)C2)ccn1	770813029	AHWFLBMNGPHLDT-IYBDPMFKSA-N	428.489	1.934	50	20	IDGD	
O=C(CSc1ccc2c(c1)OCCO2)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772201293	VHKLKVPQUZBXBF-UHFFFAOYSA-N	435.889	1.667	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cncnc2-c2ccccc2)cc1OC	773607219	NKVHHQFFVGPYOH-UHFFFAOYSA-N	436.424	1.779	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2cc(S(=O)(=O)N3CCCCC3)ccc2C)n1	773727392	YXXYLLNJQGCTQW-UHFFFAOYSA-N	448.505	1.050	50	20	IDGD	
COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1cccc(Cl)c1	774003161	URKRWGRDVGAENW-SNVBAGLBSA-N	436.808	1.810	50	20	IDGD	
CS(=O)(=O)Cc1ccc(Cl)cc1S(=O)(=O)NNC(=O)c1ccc(Cl)nc1	774614307	KPGNPYPBSPTCLJ-UHFFFAOYSA-N	438.314	1.556	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)Nc3ccc(F)c(F)c3)nc2)CC1	775373520	JXRKWUAVRXPYRF-UHFFFAOYSA-N	426.449	1.445	50	20	IDGD	
CC(C)N1C(=O)C[C@H](C(=O)NNc2ccc(C(N)=O)nn2)[C@H]1c1ccc(Cl)c(F)c1	776488401	NONVBTAFJXCBOY-APPDUMDISA-N	434.859	1.809	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1)N[C@@H]1CCCOCC1	776632906	HAULRORPWHNORS-LJQANCHMSA-N	435.488	1.902	50	20	IDGD	
CN(C)N(C(=O)[C@]1(F)CCN(C(=O)OCc2ccccc2)C1)[C@@H]1CCS(=O)(=O)C1	776750267	OWFJOSZAQIUPSP-APWZRJJASA-N	427.498	1.230	50	20	IDGD	
CC(=NNC(=O)CNC(=O)OC(C)(C)C)c1cccc(S(=O)(=O)N2CCOCC2)c1	777904444	OBLQQHWBMNVEGL-UHFFFAOYSA-N	440.522	1.072	50	20	IDGD	
O=C(CN1CCC(Oc2cncc(Cl)n2)CC1)NNC(=O)c1cccc([N+](=O)[O-])c1	778184698	FXUVXVPYTAOMTC-UHFFFAOYSA-N	434.840	1.343	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)Cc1csc(NC(=O)c2cccs2)n1	778437635	HNDQFQJJWZFBIM-UHFFFAOYSA-N	439.519	1.672	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)c1ccc(S(=O)(=O)Cc2ccccc2)cc1	778438077	KMCGXOUWOQFRLI-UHFFFAOYSA-N	447.513	1.946	50	20	IDGD	
CCCCNC(=O)NNC(=O)c1cc(I)ccc1N1CCOCC1	778587090	TZVXSVCFZPAVQU-UHFFFAOYSA-N	446.289	1.872	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1cc2c(cc1F)NC(=O)CC2	778707763	PUZXAMWGZITUOQ-JTQLQIEISA-N	432.383	1.403	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2cc3[nH]ccc3cc2C)c2ccccc2c1=O	782121426	YEJLGUUKBXQUCT-UHFFFAOYSA-N	432.440	1.606	50	20	IDGD	
O=C(NNc1ncc(C(F)(F)F)cc1Cl)C(=O)Nc1cccnc1-n1cncn1	782853595	FFDSLPXGPBHSNB-UHFFFAOYSA-N	426.746	1.811	50	20	IDGD	
CS(=O)(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2Cl)c1	782925613	LOPZRYOJTKNYOB-UHFFFAOYSA-N	430.269	1.797	50	20	IDGD	
O=C(NNc1ncnc2ccsc12)C(=O)Nc1cnn(-c2cnc3ccccc3n2)c1	783253137	IWXOFEWJRFVSHR-UHFFFAOYSA-N	431.441	1.902	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccnn2C2CCCCC2)nc1	783262045	ARCSRXWTMMVZBQ-UHFFFAOYSA-N	449.537	1.552	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2cccc(COC(C)C)c2)nc1	783264452	QATGWCSUKKCUKJ-UHFFFAOYSA-N	449.533	1.775	50	20	IDGD	
Cc1ccc(NNC(=O)C(=O)Nc2ccc(S(=O)(=O)N3C[C@@H](C)C[C@H](C)C3)cc2)nn1	783951461	HFOBNYCXCJASCI-KBPBESRZSA-N	446.533	1.533	50	20	IDGD	
CCOc1c(Cl)cc(NC(=O)C(=O)NNC(=O)CNC(=O)c2ccco2)cc1Cl	784002401	OMTDSUIJSIFBSV-UHFFFAOYSA-N	443.243	1.501	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)C(=O)Nc1ccc2scnc2c1	784210547	UPKLHLNCVBTOBU-UHFFFAOYSA-N	431.499	1.819	50	20	IDGD	
C[C@H]1C[C@H](C)CN(S(=O)(=O)c2ccc(NC(=O)C(=O)NNc3ccccn3)cc2)C1	784801518	QMGRPPIFLKSWEP-GJZGRUSLSA-N	431.518	1.830	50	20	IDGD	
CN1CCN(C(=O)c2ccc(NC(=O)C(=O)NNc3cccc([N+](=O)[O-])c3)cc2)CC1	784834208	ZSWGQFWJBDEREU-UHFFFAOYSA-N	426.433	1.064	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H]2[C@H]3CC[C@@H](O3)[C@@H]2C(F)(F)F)c1	785444576	JNPHNWWTSYILBR-MQYQWHSLSA-N	435.424	1.054	50	20	IDGD	
COCCc1ccccc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccc(C(C)=O)cc1	786413557	BWQSYAFQPWKHEL-HNNXBMFYSA-N	427.457	1.632	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN1C1CC1)c1ccccc1NS(=O)(=O)c1cccs1	786735942	OMLZTHUWVORKCP-MRXNPFEDSA-N	434.543	1.937	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)CC2CCC3(CC2)OCCO3)c1	788087750	SJVOQWNGHSKBTG-UHFFFAOYSA-N	425.507	1.021	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2ccc(C(=O)NNC(=O)N3CCN(C)CC3)cc2)cc1C	788167145	WKSLLCMOPYHUFX-UHFFFAOYSA-N	445.545	1.706	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)c(C)cc1C	788331440	RFYHHWCSOYYTGX-UHFFFAOYSA-N	437.250	1.580	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)c1	788818255	OYGSADOFLLOPFP-UHFFFAOYSA-N	439.877	1.208	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1cc([C@H]2CCCOC2)nn1C	790952986	YRJDOCNHPBDDQS-STQMWFEESA-N	433.440	1.007	50	20	IDGD	
O=C(NNc1nc2ccccn2n1)C1CCN(S(=O)(=O)c2cccnc2Cl)CC1	791240204	WHYQOGDRLYLJRW-UHFFFAOYSA-N	435.897	1.322	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)[C@](C)(O)Cn2c(C)cccc2=O)c1	792138852	SXTQWIZTPVCGCX-GOSISDBHSA-N	438.278	1.140	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1nc(Br)cs1	792361031	YZXYXSHJAJUBEN-UHFFFAOYSA-N	447.336	1.683	50	20	IDGD	
CCc1c(NC(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)cnn1-c1ccccc1Cl	792483641	DFIKRABCRNIAKU-LLVKDONJSA-N	425.898	1.676	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=O)c2cc3ccccc3cc2O)n(C)c1	792522024	VHBWXXUVFWMZTJ-UHFFFAOYSA-N	444.513	1.989	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNS(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-]	794599026	SOANPBXPVDCVMU-UHFFFAOYSA-N	442.837	1.484	50	20	IDGD	
Cc1nc(COc2cccc(C(=O)NNc3ccccc3S(=O)(=O)N(C)C)c2)no1	795160622	GJCPUARTCDLOMB-UHFFFAOYSA-N	431.474	1.964	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)Cc2cccnc2)(n2cccn2)CC1	796140825	NTJXWJSTOJHSCW-UHFFFAOYSA-N	428.493	1.394	50	20	IDGD	
COC(=O)c1cc(F)cc(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)c1F	796990704	VVQVPZJQXXESBC-UHFFFAOYSA-N	446.410	1.290	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccnn2Cc2cnn(-c3ccccc3)c2)n1	797370287	JMHJCXDGEBOPHX-UHFFFAOYSA-N	444.455	1.220	50	20	IDGD	
O=C(COC(=O)[C@H]1CCCN1C(=O)OCc1ccccc1)NNC(=O)c1cccs1	797505983	SQBXXGUUICSBQQ-OAHLLOKOSA-N	431.470	1.854	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NC(=O)NNC(=O)Cc2ccc3ccccc3c2)nc1	797654248	XQTAVCZCJWTJDT-UHFFFAOYSA-N	427.486	1.881	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@@H]2C(=O)OCC(=O)NNC(=O)c2ccc(C)cc2)cc1	798790611	QDEWLBGERSLLOU-LJQANCHMSA-N	439.468	1.613	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2nnn(-c3cccc4ncccc34)c2C)cc1	801106042	PVFYIPMLCZDUCY-UHFFFAOYSA-N	429.440	1.832	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)N[C@@H]1CCCN(C(=O)Cc2ccccc2)C1	802471979	DOOPXLFGQJFRCF-LJQANCHMSA-N	435.484	1.501	50	20	IDGD	
COC(=O)c1c(F)cc(NC(=O)C(=O)NNc2ccc(Br)cn2)cc1F	802570925	BHTPGCHQECXABN-UHFFFAOYSA-N	429.177	1.991	50	20	IDGD	
COCc1csc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(C)c(C)c3)[nH]n2)n1	806978957	JYNWQTXKVUFENJ-UHFFFAOYSA-N	428.474	1.696	50	20	IDGD	
CN(CC(=O)N([C@H]1CCS(=O)(=O)C1)N(C)C)c1cc(Br)ccc1[N+](=O)[O-]	808023858	AZGUZNBRNAZRBF-LBPRGKRZSA-N	449.327	1.286	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)CNS(=O)(=O)c3cc(C)ccc3C)n[nH]2)cc1	810148030	UUMNRTVEFRGIOZ-UHFFFAOYSA-N	441.513	1.741	50	20	IDGD	
CC(C)c1nc(C#N)c(NNC(=O)CNS(=O)(=O)c2cccc(Br)c2)o1	810261586	DXVDZFZQJCJANH-UHFFFAOYSA-N	442.295	1.854	50	20	IDGD	
Cc1nc(NC(=O)C(=O)NNC(=O)CNC(=O)c2cccs2)ccc1-c1ccccc1	810394816	BFPYSKNUIDNMBY-UHFFFAOYSA-N	437.481	1.634	50	20	IDGD	
CC(C)Nc1ccc(S(=O)(=O)NCC(=O)NNc2ncccc2Cl)cc1[N+](=O)[O-]	810405764	OAUMDAVDEJRLKN-UHFFFAOYSA-N	442.885	1.885	50	20	IDGD	
CC(=O)N1c2ccc(S(=O)(=O)NNC(=O)C(=O)Nc3ccc(C)c(C)c3)cc2C[C@@H]1C	812551945	PEBPBYGMOYWKQA-AWEZNQCLSA-N	444.513	1.549	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)[C@@H]2CC(=O)N(c3ccc(F)cc3F)C2)cc1	812728651	UKOYWLQJKOWION-GFCCVEGCSA-N	438.456	1.711	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)[C@@H](O)c1ccc(Cl)cc1	813467404	GOLUHPRMLPHMOZ-KRWDZBQOSA-N	425.894	1.538	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)C2CCCC2)nnn1Cc1ccc(C(F)(F)F)cc1	815568051	UBHGKGWLMGHDMO-UHFFFAOYSA-N	438.410	1.930	50	20	IDGD	
COC(=O)c1cc(F)c(Br)cc1NC(=O)C(=O)NNc1ncncc1F	815764439	IITCCIWUUBNRIF-UHFFFAOYSA-N	430.165	1.386	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H](C(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)C[C@H]2C[C@H]21	815934157	OODJRDXOQKMPRW-YUELXQCFSA-N	436.896	1.502	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cc(S(C)(=O)=O)ncc2Cl)cc(OC)c1OC	816814192	KNGHAFKOOINEPT-UHFFFAOYSA-N	443.865	1.239	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)[C@H]1CSCN1C(=O)CC(C)(C)C	817055246	SNWDEUQNAZRXSM-CQSZACIVSA-N	428.580	1.718	50	20	IDGD	
CCN1CCN(S(=O)(=O)c2ccc(Cl)c(C(=O)NNC(=O)CC3CC3)c2)CC1	819131794	PXJGVVYVJSCMCI-UHFFFAOYSA-N	428.942	1.227	50	20	IDGD	
COCCCNC(=S)N(C)NC(=O)c1sccc1S(=O)(=O)N1CCCCC1	899890197	PSXTYCNGPNALQB-UHFFFAOYSA-N	434.609	1.410	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)C[C@H]2OC(=O)c3ccccc32)c1	912643078	QMPLEEZJQPYLKF-GOSISDBHSA-N	445.497	1.780	50	20	IDGD	
COc1ccccc1NC(=S)NNC(=O)CCNS(=O)(=O)c1ccc(F)cc1	913441290	WHHKRNVXEAHDPO-UHFFFAOYSA-N	426.495	1.521	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)CNS(=O)(=O)c2ccc3ccccc3c2)c1	913531765	JZHFVNJROVRCIR-UHFFFAOYSA-N	443.481	1.597	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)[C@H]2CC(=O)N(C(CC)CC)C2)c2ccccc2c1=O	915619846	QEJRTYFVEJNOBI-AWEZNQCLSA-N	427.505	1.605	50	20	IDGD	
COCCN(CCOC)S(=O)(=O)c1ccc(C(=O)NNC(=O)c2ccccc2C)cc1	916146646	NYPCYPFHQUTWPO-UHFFFAOYSA-N	449.529	1.353	50	20	IDGD	
COc1cc(OC)cc([C@H](NC(=O)NNC(=O)c2ccccc2O)c2nccn2C)c1	916229724	WWBZSAZRJQDOSP-SFHVURJKSA-N	425.445	1.877	50	20	IDGD	
CN1CCN(c2cc(CNC(=O)NNC(=O)c3cc(Br)c[nH]3)ccn2)CC1	916389786	DRGWFGLERLZBQI-UHFFFAOYSA-N	436.314	1.068	50	20	IDGD	
COCc1cccc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1	916426673	POQWBRQIKDXEAK-UHFFFAOYSA-N	446.529	1.762	50	20	IDGD	
C[C@@H](CN1CCOCC1)NC(=O)NNC(=O)COc1ccc(OCc2ccccc2)cc1	916470476	LSBUVSCYFWVBBU-SFHVURJKSA-N	442.516	1.696	50	20	IDGD	
CN(CC(=O)NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)c1ccc(Br)o1	917390789	JMHBFYOAIFZOEK-ZDUSSCGKSA-N	438.234	1.102	50	20	IDGD	
O=C1COc2ccc(S(=O)(=O)NNC(=O)c3ccc(F)cc3Br)cc2N1	917755307	UBSQDCUECGNQBR-UHFFFAOYSA-N	444.238	1.542	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)N2CCN(C3=NS(=O)(=O)c4ccccc43)CC2)cc(C#N)n1C	918613894	ZLYJHCVRVUNXKJ-BOPFTXTBSA-N	448.508	1.405	50	20	IDGD	
CCC(=O)N1CCCC[C@H]1C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	919743753	UZXHWEVLGOVNKN-KRWDZBQOSA-N	436.534	1.023	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@@H](C)COc2cccc(C)c2)cc1	919781774	TYEQZAPDCJCIBY-KRWDZBQOSA-N	448.545	1.722	50	20	IDGD	
CCCCn1c(C)cc(/C=C(\C#N)C(=O)N(C)CC(=O)N[C@H]2CCS(=O)(=O)C2)c1C	920291297	UUNJGWNKOWOAOB-MVDPLZLPSA-N	434.562	1.574	50	20	IDGD	
COC(=O)/C=C/c1cc(OC)c(OC)c(S(=O)(=O)NNC(=O)c2ccccc2O)c1	921018098	XPGJOMXTCMWORV-CMDGGOBGSA-N	436.442	1.219	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)CCCC[C@@H]2SC[C@@H]3NC(=O)N[C@@H]23)c1C	921302587	ZTTUUNFKJQFOAP-WXSAJPJJSA-N	434.562	1.944	50	20	IDGD	
CN(CCCC(=O)NNC(=O)c1ccccc1Cl)C1=NS(=O)(=O)c2ccccc21	1116133831	LEZWWWMITAGKNQ-UHFFFAOYSA-N	434.905	1.962	50	20	IDGD	
O=C(CNC(=O)c1cc(Cl)ccn1)NNC(=O)c1cc(Br)ccc1O	1116149935	BIOSNXZNDWAGPF-UHFFFAOYSA-N	427.642	1.394	50	20	IDGD	
COC(=O)C1(CS(=O)(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)CCCC1	1117647550	QRLQVZMRLKKQKT-UHFFFAOYSA-N	447.554	1.318	50	20	IDGD	
Cc1ccc2c(c1)S[C@H](C(=O)OCC(=O)NNC(=O)[C@@H]1COc3ccccc3O1)C2	1317766416	SPXHTNIYVFQBOM-WMZOPIPTSA-N	428.466	1.542	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2cncn2-c2ccccc2)nnn1-c1ccc2c(c1)OCCO2	1318633147	RMGXUSXXMHEYNL-UHFFFAOYSA-N	445.439	1.607	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1)[C@@H](C)N1CCOCC1	1318971783	DHPKVLBLVPAGGF-LSDHHAIUSA-N	427.546	1.073	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1sc(N(C)C)nc1C	1319944305	JAONAXDPXHMYOB-UHFFFAOYSA-N	426.882	1.798	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)c3nn(-c4ccccc4F)cc3Br)nc21	1322738124	IDQRJJMDLYDHPR-UHFFFAOYSA-N	447.228	1.913	50	20	IDGD	
O=C(NNC(=O)c1n[nH]c2c1CCCC2)c1cc(S(=O)(=O)N2CCC2)ccc1Cl	1323526347	MNPGDKIVSBQUIC-UHFFFAOYSA-N	437.909	1.411	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2n[nH]c3ccccc23)C1	1779018425	ZORJHYJMGKTJPD-QLVMHMETSA-N	434.924	1.944	50	20	IDGD	
Cc1nnc(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@](C)(Cl)CCl)C2)o1	1780713273	PITCSYBPRRDSEQ-JEBQAFNWSA-N	433.336	1.671	50	20	IDGD	
CCn1nccc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Br)C1	1780771096	BYUDNCMTHSZBLE-JKIFEVAISA-N	431.306	1.721	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Br)C1	1780777249	PMYXBUVGESXZKP-ICUOPCATSA-N	444.139	1.974	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)CN3CCc4sccc4C3)CCO2)C1	1781215426	PSFCHDWFJFPHBG-JXFKEZNVSA-N	425.982	1.954	50	20	IDGD	
COc1cccc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](F)Br)C3)C2)c1F	1781335019	RATGDHXUMJXZAT-YOEHRIQHSA-N	433.249	1.968	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3c(O)cc(O)cc3O)C2)C1	1781818990	SKYLVVBECHJYDP-QGHHPUGFSA-N	429.267	1.030	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(O)cc1F)C2	1782179070	NLTVBPYCEVTCHL-WRWLIDTKSA-N	428.888	1.913	50	20	IDGD	
Cc1cccc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CCC(=O)NN(C)C)C2)c1F	1782210258	KZLPSYDNVAAODG-WZONZLPQSA-N	448.539	1.635	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnc4c(c3)CCNCC4)C2)C1	1782727868	SCXIQNDAEFTATE-QFIPXVFZSA-N	434.968	1.478	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(CCN(C(=O)C3CCC4(CC3)OCCO4)C2)C1	1782942194	SOZCHJOWJZFDLE-FQEVSTJZSA-N	440.613	1.601	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)/C=C/c3ccc(OC)cc3F)C2)C1	1783660235	IIAQDOPJVAHGGV-RKUWUGLRSA-N	440.899	1.931	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](N)c1cccc(Cl)c1)CCO2	1783875653	JTRRNFYXQKZXAU-FCEWJHQRSA-N	430.332	1.424	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)CCc3ccc(N(C)C)cc3)CCO2)C1	1783879536	WPDCQLNMSWFSLS-UGKGYDQZSA-N	437.968	1.769	50	20	IDGD	
O=C(c1nc2cc([N+](=O)[O-])ccc2[nH]1)N1CCO[C@@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783950025	RZVZKWJYNAAANB-QGZVFWFLSA-N	442.259	1.718	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cn4cc(Cl)ccc4n3)C[C@@H]21)[C@@H](O)CCl	1784090418	FSQYDVWHCNXDPR-MZGVZZPPSA-N	441.315	1.181	50	20	IDGD	
Cc1cc(C)n(CCC(=O)N2CC[C@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)n1	1784321063	LQQUYSRPYOPOGX-MOPGFXCFSA-N	431.364	1.956	50	20	IDGD	
CCCNC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]21	1784374934	DRWWTRUFKFYRPV-XLPNERPQSA-N	436.380	1.509	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(-c4ncc[nH]4)cc3)C2)C1	1785156689	ZNDYHDCIEJRFIR-LAUBAEHRSA-N	432.908	1.774	50	20	IDGD	
Cc1nn(C)c(C)c1CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCBr)[C@H]2C1	1786407685	IMABXYHMHHRCKL-XIRDDKMYSA-N	441.370	1.344	50	20	IDGD	
C[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CO[Si](C)(C)C)C[C@@H]21)n1cccc1C=O	1786996284	RBARDSNIVXHXKH-NEPXVJNWSA-N	435.597	1.693	50	20	IDGD	
Cc1cc(/C=C/C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCBr)C[C@@H]32)no1	1788672841	TXYPUNDCBHPIEG-PFUQRVJESA-N	426.311	1.761	50	20	IDGD	
CCc1cc(C(=O)Nc2ccc(C3(NC(=O)c4ccc(B(O)O)cc4)CCC3)cc2)n(C)n1	1789805831	WKVHQKGQVPFUBY-UHFFFAOYSA-N	446.316	1.724	50	20	IDGD	
CCOc1ccc(Cl)cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21	1790121548	XFDFBXCVUNETHK-PTOXDTDZSA-N	445.343	1.932	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CC34CCCN3CCC4)C[C@@H]21	1791254114	NIBWRUDWNIRUMR-XSLAGTTESA-N	427.973	1.238	50	20	IDGD	
Cc1cc(F)cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]3C2)c1	1791293724	FBVWUASCRVQVGT-SNRMKQJTSA-N	434.512	1.100	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)COc1ccc(O)cc1	1792778550	NYQBQXNYGGQENV-KOFHJDLBSA-N	427.295	1.144	50	20	IDGD	
Cc1ccc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)CBr)nc1	1792870576	SDBZTVGCUFJYDQ-GGXPGOJBSA-N	438.366	1.943	50	20	IDGD	
C[C@@H](CBr)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](C)N1CCN(C)CC1)C2	1792991663	RFMWQFFIVATLTA-NNXHMXCWSA-N	429.403	1.292	50	20	IDGD	
CC(C)(C)OC(=O)N1CC2(C[C@H]2C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](O)CCl)C1	1793116049	FXMDVBYJODJHCB-XFIYOXNOSA-N	441.956	1.481	50	20	IDGD	
C=CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Cl	1796365377	WIORLJIJJMBKGG-KHMAMNHCSA-N	433.908	1.580	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1n[nH]c(C)c1F)C2	1796889678	AAVFNNXSKNEJHB-MGGJZVGQSA-N	429.456	1.243	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1C[C@@]13C(=O)Nc1ccccc13)C2	1799269776	FABVMPSXWMICKI-YEFSBHDESA-N	431.920	1.503	50	20	IDGD	
COc1ccc([C@@H](O)C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@](C)(Cl)CCl)cc1	1799273889	SOIJDOPZEGPWCX-AENLNBOZSA-N	445.343	1.555	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1Cc3ccccc3N1)C2	1799279498	PVBLDZZTJGYLAG-BXNDMCELSA-N	426.344	1.849	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)c1ccc(OCC2CC2)c(F)c1	1801892905	UCMMLODCFKUYEB-HIRMHNASSA-N	440.899	1.417	50	20	IDGD	
C#CC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](Cl)CC)C2	1802129061	YSRTYDQNOITMRV-BPKGMFCQSA-N	441.956	1.510	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(N3CCN(C)CC3)cc1)C2	1802271298	QOWQADLMRWZJSO-GFOJFJKKSA-N	448.995	1.944	50	20	IDGD	
COC[C@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(N3CCN(C)CC3)cc1)C2	1802271301	QOWQADLMRWZJSO-NRDMVMEKSA-N	448.995	1.944	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1CCN(C(=O)Cn2cncn2)[C@H]1c1cccnc1	1803008211	JIIKONWYJDRRCN-KMFMINBZSA-N	435.326	1.410	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)c2cnnn2C)[C@H]1c1cccnc1	1804745560	AVNLJOKZEIOUMJ-OFQRWUPVSA-N	435.326	1.703	50	20	IDGD	
O=C(Cc1cccs1)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1807542609	JNEMPWMFRLWCML-PGRDOPGGSA-N	449.341	1.385	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)NC[C@H]1CCN(C(=O)CO[Si](C)(C)C)[C@@H]1c1cccnc1	1808228127	AFYUJIQGOZFNRK-SOLBZPMBSA-N	435.601	1.386	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@H](CNC(=O)c2cc(O)nc(O)n2)[C@H]1c1cccnc1	1808304104	USBAPAVSBAJSKG-KBXCAEBGSA-N	445.552	1.454	50	20	IDGD	
Cn1cccc1C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1	1810297338	BRLTWMSGSUKRNF-OXJNMPFZSA-N	447.499	1.052	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)C(=O)Nc2cccnc2)[C@H]1c1cccnc1	1810466325	YNSLTASVVBWPCK-BPQIPLTHSA-N	445.907	1.375	50	20	IDGD	
Cc1cc(C(=O)NC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)ccn1	1810789615	BFBUDXJVZTWBNY-UGKGYDQZSA-N	438.532	1.478	50	20	IDGD	
COc1nc(C)ccc1C(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1	1811045010	FWCRALFRHJKWEG-SZMVWBNQSA-N	432.908	1.713	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)c1cnc2snnc2c1	1811342567	NEJORTNJPJNRFB-MAZHCROVSA-N	446.920	1.401	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2cc(OC)n(C)n2)[C@H]1c1cccnc1	1813033804	ZZNXHMPHGSUBDI-VKJFTORMSA-N	435.912	1.397	50	20	IDGD	
Cc1cc(C)cc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)c1	1815360186	BCPNGNKNDLXCLM-SFHVURJKSA-N	449.341	1.979	50	20	IDGD	
CC(C)(C)OCC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1815591177	OKSUIFHUJSMVMI-QGZVFWFLSA-N	428.298	1.211	50	20	IDGD	
O=C(/C=C/c1ccco1)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1815947656	COOSXWDLMFUZME-YXBWYFRISA-N	434.261	1.702	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccncc2F)[nH]n1)c1ccc(B(O)O)cc1	1817471642	KWVDBZXSPRDRBN-SFHVURJKSA-N	437.240	1.243	50	20	IDGD	
CNCCCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)n[nH]1	1818111853	LPCDGYNVNRUQGR-NFXIUMSZSA-N	442.524	1.535	50	20	IDGD	
Cc1ccnc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)c1	1818194116	YKDSQFSUCKSMFK-KRWDZBQOSA-N	427.509	1.792	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](O)CCl)CC2)c1ccc2cccnc2n1	1818972499	XHISMCLZFDXTEU-FZMZJTMJSA-N	431.905	1.912	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccns2)[nH]n1	1819402294	ZMRPEGLWFJMTDN-CQSZACIVSA-N	440.489	1.484	50	20	IDGD	
O=C(CCBr)N[C@@H]1CCc2nc(NC(=O)c3n[nH]cc3[N+](=O)[O-])sc2C1	1820295593	LFBXPJNXPQNWRF-SSDOTTSWSA-N	443.283	1.785	50	20	IDGD	
Cc1ccn(C)c1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2	1821728192	VEDKGQGDTFNKQL-OAHLLOKOSA-N	438.318	1.009	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnnc(Cl)c2)[nH]n1	1822410915	RZKNADGOWFWWGL-CQSZACIVSA-N	448.915	1.532	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(C#N)c2)[nH]n1	1822414309	AKEYNTFKDHHYHF-GOSISDBHSA-N	437.504	1.960	50	20	IDGD	
Cc1cnn([C@@H](C)C(=O)N2CCCC[C@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)c1	1822416558	HSFSGRZWBNMBJT-RDJZCZTQSA-N	444.540	1.541	50	20	IDGD	
Cn1c(C(=O)N[C@H]2CCc3nc(NC(=O)[C@@H](F)Br)sc3C2)cccc1=O	1823001333	CUKHVAJBMAKUQM-ISVAXAHUSA-N	443.298	1.758	50	20	IDGD	
Cc1nnc(CC(=O)N[C@@H]2CCc3nc(NC(=O)[C@@H](C)Br)sc3C2)o1	1825640463	AHYMHRKUIWVICE-VXNVDRBHSA-N	428.312	1.773	50	20	IDGD	
Cc1nc(C)c(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)o1	1829297651	NJSPDTUQFLEIKB-GOSISDBHSA-N	433.553	1.898	50	20	IDGD	
O=C(c1cnc(O)nc1O)N1CCC([C@@H]2CCCCN2C(=O)[C@H](F)Br)CC1	1830378405	MDXJRNIVWMIOLD-STQMWFEESA-N	445.289	1.812	50	20	IDGD	
C=CCO[C@H](C)C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](C)CBr)CCO2)C1	1830536089	XXTVFIMJTZZDAJ-RKVPGOIHSA-N	433.343	1.065	50	20	IDGD	
Cc1ccc2cc(C(=O)N3CCOC[C@]4(C3)CN(C(=O)[C@@H](O)CCl)CCO4)ccc2n1	1830727817	GMVJNIKUAYMFMG-UGKGYDQZSA-N	447.919	1.213	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(O)nc(Cl)c3)C2)C1	1831643932	LSISIWLNJRUVHH-LIRRHRJNSA-N	446.331	1.918	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)Cn3cccn3)C2)C1	1831644464	YBODUHWXGYKIQG-ZWOKBUDYSA-N	426.945	1.383	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cn4ncccc4n3)C2)C1	1831646430	JYDGGVHLHAATLS-QRWLVFNGSA-N	435.912	1.207	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H]2CCCS2)CC1	1832438697	NNOPETOHDDHDMW-RBUKOAKNSA-N	445.589	1.814	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3ccnc(C)c3)CCO2)C1	1832627510	LGTPLIWUEODSPS-GHTZIAJQSA-N	439.940	1.033	50	20	IDGD	
CC(C)(C)n1cc(C(=O)N2CCC(N3CCC(NC(=O)[C@@H](O)CCl)CC3)CC2)cn1	1833308301	QIRDNVAYJBDDSY-SFHVURJKSA-N	439.988	1.423	50	20	IDGD	
CN(C)c1cncc(C(=O)N2CCO[C@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)c1	1833358726	RQZAWKSOHINGGX-OAQYLSRUSA-N	438.956	1.483	50	20	IDGD	
Cc1ncccc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)Br)C2)C1	1834042477	AKGNAWGPJRYYAV-ACJLOTCBSA-N	426.311	1.243	50	20	IDGD	
O=C(CCOc1ccccc1)NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1834424680	SJQGSTNLIOYCGI-HXUWFJFHSA-N	437.968	1.627	50	20	IDGD	
O=C(Cc1ccccc1F)NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1834488330	JHHLOSOGVIBGTH-IBGZPJMESA-N	425.932	1.540	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCC(N2CCC(NC(=O)CN3CCOCC3)CC2)CC1	1834621362	YOKQYJPLDYJXJT-HXUWFJFHSA-N	449.423	1.127	50	20	IDGD	
CCCC(=O)N[C@H](C)C(=O)NC1CCN(C2CCN(C(=O)C(Cl)Cl)CC2)CC1	1835820603	BHAFXDGCUKTEJC-CYBMUJFWSA-N	435.396	1.667	50	20	IDGD	
Cc1n[nH]c(C)c1CC(=O)N1CCC(N2CCC(NC(=O)CO[Si](C)(C)C)CC2)CC1	1835836347	ZMHYLXCUQLFEDT-UHFFFAOYSA-N	449.672	1.992	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)c1ccc(Cl)cn1	1835900201	GNVCHEUAHXJSPS-QGZVFWFLSA-N	429.348	1.520	50	20	IDGD	
O=C([C@@H](F)Br)N1CCOC[C@]2(C1)CN(C(=O)C1(C(F)(F)F)CC1)CCO2	1836719671	OVEBSRNEFDASNB-MFKMUULPSA-N	447.223	1.476	50	20	IDGD	
Cc1ccn(CC(=O)N2CCC(OC3CCN(C(=O)CCBr)CC3)CC2)n1	1837191748	WHFAYSULZFENBV-UHFFFAOYSA-N	441.370	1.975	50	20	IDGD	
COC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)CCBr)CC2)CC1	1837652024	XOLYCLULZOCGHR-UHFFFAOYSA-N	433.343	1.723	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4c[nH]nc4c3)C2)C1	1837711721	OIUCECKANCAGPR-NRFANRHFSA-N	446.580	1.484	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3cc(F)ccn3)C2)C1	1839142751	ZLQXIYDHAOKSDE-PXNSSMCTSA-N	427.904	1.627	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccncc3)C2)C1	1839154541	QQFAKKJTQSDYQJ-RTBURBONSA-N	430.332	1.317	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3csc(C)n3)C2)C1	1839963430	JWYRSPMMKUTCCG-SUMWQHHRSA-N	446.367	1.695	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)C3(CC)COC3)C2)C1	1839966349	BNNLWPMHRZIKMX-KBXCAEBGSA-N	433.343	1.043	50	20	IDGD	
CC[C@H]1CC[C@H](C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](Cl)COC)C3)C2)CC1	1840059199	XHQIHZKPRYIBDK-IKVWTGGYSA-N	430.973	1.913	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)c(Cl)c1	1840734553	VFGOBSNZNPFPFH-QAPCUYQASA-N	435.279	1.953	50	20	IDGD	
O=C([C@@H](Br)Cc1ccccc1)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1	1841353959	ZTDDELCXAPUEAS-GJZGRUSLSA-N	429.742	1.796	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1cccc3nscc13)C2	1844265014	KTVLRBTUEZAPMV-UHFFFAOYSA-N	436.497	1.426	50	20	IDGD	
COc1cc(C(=O)N2CCCC23CN(C(=O)[C@H](O)CCl)C3)cc([N+](=O)[O-])c1OC	1845550985	DIRAWHXHKNQQOF-CYBMUJFWSA-N	427.841	1.029	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)C1(CNC(=O)OC(C)(C)C)CC1)C2	1846359797	KLIGDTKTPNQVTL-CQSZACIVSA-N	429.945	1.749	50	20	IDGD	
COc1cc(C(=O)N2CC3(CCCN3C(=O)CCC(=O)NN(C)C)C2)cc(OC)c1C	1846386258	RYFOCQJPROZLAC-UHFFFAOYSA-N	432.521	1.202	50	20	IDGD	
O=C(NCCC(=O)N1CCCC12CN(C(=O)[C@H](F)Br)C2)c1ccccc1	1846959024	DLXZJOYZUHQNRN-HNNXBMFYSA-N	426.286	1.700	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@](F)(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](O)CCl)C1	1847563893	RHEVNCNRPDSSJG-CJXDPKRBSA-N	447.935	1.527	50	20	IDGD	
CCNS(=O)(=O)c1ccc(C)c(C(=O)NNC(=O)c2ccc(OCC)c(OC)c2)c1	15475872	ZEFNLRHSMCBBFF-UHFFFAOYSA-N	435.502	1.775	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CCCn2c(=O)oc3ccccc32)cc(OC)c1OC	15792639	FWRBCJNHGYYUCT-UHFFFAOYSA-N	429.429	1.862	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)[C@@H]2CCCN2S(=O)(=O)c2ccc(C)cc2)cc1	17111832	NSSWUOGNKKBSIQ-IBGZPJMESA-N	431.514	1.683	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2C1)c1ccc(S(=O)(=O)N2CCCC2)cc1	17516936	SSRPOABFWIPELN-KRWDZBQOSA-N	429.498	1.483	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)c1occc1CS(=O)(=O)c1ccccc1	26692792	CQQYPYJOSBJOIH-GOSISDBHSA-N	442.449	1.855	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCCCC2)cc1C(=O)NNC(=O)c1ccc2c(c1)OCO2	26964303	SDQYZGHYFZOAHS-UHFFFAOYSA-N	445.497	1.973	50	20	IDGD	
N#Cc1ccc(CS(=O)(=O)CC(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)cc1	110890480	ROZHUYNTWPOXSW-UHFFFAOYSA-N	448.526	1.057	50	20	IDGD	
Cn1cc(NS(=O)(=O)c2ccsc2C(=O)NNC(=O)CCc2ccccc2)cn1	725715990	NYXMAUGHFFMVOT-UHFFFAOYSA-N	433.515	1.676	50	20	IDGD	
Cc1ccc(-n2ccnc2SCC(=O)NNC(=O)CNC(=O)c2ccco2)cc1C	725739411	GINMATGERNFMTO-UHFFFAOYSA-N	427.486	1.752	50	20	IDGD	
CN(C)CC(=O)NNC(=O)c1ccc(S(=O)(=O)Nc2cccc(C(F)(F)F)c2)cc1	727761631	UOZNOUGJRVQXAF-UHFFFAOYSA-N	444.435	1.829	50	20	IDGD	
CCS(=O)(=O)CCNC(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1	727943781	OSOYUNPGDICBQT-HXUWFJFHSA-N	444.557	1.379	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)c2ccccc2S(C)(=O)=O)c1	728529598	GIVXZODRPJNXRW-UHFFFAOYSA-N	427.276	1.936	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)CNC(=O)c2ccc(F)cc2F)c1	728608779	BIUZXVXIMUXWAC-UHFFFAOYSA-N	442.216	1.927	50	20	IDGD	
CCOC(=O)C1=NN(c2ccccc2)[C@H](C(=O)NNC(=O)NCCc2cccs2)C1	731185123	QJGITWCDYZGGLE-KRWDZBQOSA-N	429.502	1.819	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)NCc1ccc(C(=O)N2CCNC(=O)C2)cc1)c1ccccc1	732240792	LEUYVUHUWJNWJB-IBGZPJMESA-N	437.500	1.283	50	20	IDGD	
COCC(=O)NC1CCN(C(=O)NNC(=O)c2ccc(OC)c(Br)c2)CC1	732255687	KGMQNMORIQNXAI-UHFFFAOYSA-N	443.298	1.039	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)CCN1C[C@@H](C)O[C@H](C)C1)N1CCC(Cc2ccccc2)CC1	732261057	AHISNFYPMMMPNQ-AQNXPRMDSA-N	430.593	1.976	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)CNS(=O)(=O)c1ccc2c(c1)OCCCO2)c1ccccc1	732291255	DJSDVZJIMZPPBM-KRWDZBQOSA-N	447.513	1.467	50	20	IDGD	
Cc1cc(C)c(S(=O)(=O)NCCC(=O)NNc2ccccc2S(C)(=O)=O)c(C)c1	732304459	WYKZDRWGWNDFLF-UHFFFAOYSA-N	439.559	1.827	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NC2CCN(CCN(C)C)CC2)cc1Br	732443887	FJUGZZVXBIJJEL-UHFFFAOYSA-N	442.358	1.428	50	20	IDGD	
COc1ccc([C@H]2[C@H](C(=O)NNC(=O)c3ccc4c(c3)OCCO4)CCC(=O)N2C)cc1	734316160	KSGBIFXBJFTEPQ-UTKZUKDTSA-N	439.468	1.837	50	20	IDGD	
CCc1cc(NNC(=O)CNC(=O)c2c[nH]c3ccccc3c2=O)nc(-c2ccccn2)n1	734356413	AUVUHGLMMYVRDU-UHFFFAOYSA-N	443.467	1.816	50	20	IDGD	
CC[C@H](C)[C@H](NC(=O)N1CCCC1)C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	736073063	AQGADFRTNWXDCA-KSSFIOAISA-N	437.566	1.791	50	20	IDGD	
Cc1ccccc1O[C@H](C)C(=O)N1CCN(CC(=O)NNC(=O)c2cccs2)CC1	736622968	FLAJGDMSHVFBRN-MRXNPFEDSA-N	430.530	1.429	50	20	IDGD	
COC[C@@H]1CCN(C(=O)/C(C#N)=C\c2cn(CCC(N)=O)nc2-c2ccc(OC)cc2)C1	739757105	OJNFKZJDWZINKO-CJMVGXJBSA-N	437.500	1.836	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)NCc1cc(F)ccc1N1CCOCC1	741093414	RFAXYVHHIKCDPO-UHFFFAOYSA-N	427.436	1.443	50	20	IDGD	
Cc1cc(N2CCCS2(=O)=O)ccc1C(=O)NNC(=O)[C@@H](C)Oc1ccccc1F	741525505	LZZUNRHMCILHRB-CQSZACIVSA-N	435.477	1.903	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)[C@H]3CCCCN3C(=O)c3ccc(O)nn3)cc2C1	741740460	AIKUIXDZBFJRKO-IUODEOHRSA-N	443.529	1.824	50	20	IDGD	
CN(C)C1(CNC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)Cc2ccccc2C1	743633956	HHBSMWPAOWYFMO-UHFFFAOYSA-N	445.545	1.525	50	20	IDGD	
CC(C)(C)C(=O)NNC(=O)CN1CCN(Cc2nc(-c3ccc(Cl)cc3)no2)CC1	744385798	PCQICHXVFMUASJ-UHFFFAOYSA-N	434.928	1.701	50	20	IDGD	
O=C(/C=C/c1ccc2c(c1)OCO2)NNc1ccccc1S(=O)(=O)N1CCOCC1	744620559	KQJCKRQAUHUIIO-SOFGYWHQSA-N	431.470	1.593	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)NCCNS(=O)(=O)Cc2ccccc2)cc1	745518376	KQFCSDZVWRPWST-UHFFFAOYSA-N	434.522	1.208	50	20	IDGD	
CNS(=O)(=O)c1cccc([C@H](C)NC(=O)NNC(=O)Nc2ccc(N(C)C)cc2)c1	745800820	PKDNOHQJJVRGEV-ZDUSSCGKSA-N	434.522	1.758	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)N[C@@H]2[C@H]3CCCO[C@H]3C2(C)C)nc1	745859913	HEIXCEMFKKZZHX-DJIMGWMZSA-N	425.555	1.942	50	20	IDGD	
C[C@@H]1C[C@H](NC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)C(=O)N1c1ccccc1	745883033	RHVSKZIYWHIFEA-DYVFJYSZSA-N	445.501	1.620	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2ccc(Cl)cc2F)cc1	747515797	SRAMZWDDRPMKRF-UHFFFAOYSA-N	427.841	1.421	50	20	IDGD	
O=C(NCCc1cccs1)NNS(=O)(=O)c1ccc(C(=O)O)cc1Br	747609630	WNPYWSCPBRYHJH-UHFFFAOYSA-N	448.320	1.944	50	20	IDGD	
CCCCCS(=O)(=O)CC(=O)NNc1ccc(S(=O)(=O)Nc2nccs2)cc1	747942718	JLDUHUHCNLYVNL-UHFFFAOYSA-N	446.576	1.992	50	20	IDGD	
COCCN(CCOC)S(=O)(=O)c1ccc(C(=O)NNc2cccc(C#N)c2)cc1	748037600	ONISZOWMASTLCR-UHFFFAOYSA-N	432.502	1.599	50	20	IDGD	
C[C@@H](C(=O)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1)N1C(=O)[C@H]2CCCC[C@H]2C1=O	748519938	FTSXDIBBDUPHKA-LEWSCRJBSA-N	447.435	1.987	50	20	IDGD	
CCOc1ccc(C(=O)NNS(=O)(=O)c2sc(C(=O)OC)cc2OC)cc1OC	748791439	TYHBBLWBVOOLIO-UHFFFAOYSA-N	444.487	1.574	50	20	IDGD	
CC(C)(C)C(=O)c1ccc(S(=O)(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1	749141699	IWMLRFILBRZIOB-UHFFFAOYSA-N	445.545	1.932	50	20	IDGD	
Cn1nc(SCC(=O)NN=Cc2cc(-c3ccccc3)ccc2O)c(=O)n(C)c1=O	749444900	ZNOYIYPLDQVJHF-UHFFFAOYSA-N	425.470	1.094	50	20	IDGD	
O=C(O)CCC(=O)c1ccc(S(=O)(=O)NNC(=O)c2cccc(OC(F)F)c2)cc1	751213354	SDNVBBABHVRMDF-UHFFFAOYSA-N	442.396	1.959	50	20	IDGD	
CCCCS(=O)(=O)N1CCC(C(=O)NNC(=S)NCCc2cccs2)CC1	753080554	YMNNBDOWWRGYAC-UHFFFAOYSA-N	432.637	1.628	50	20	IDGD	
COC(=O)c1coc(S(=O)(=O)NNC(=O)c2cc(OC)ccc2Br)c1	753954352	LXLCLAKIYSPLJT-UHFFFAOYSA-N	433.236	1.461	50	20	IDGD	
CCCOc1ccc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1N	754608235	NYSVRLNIBLBHQU-SFHVURJKSA-N	429.429	1.202	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2ccc(NC(=O)NNC(=O)c3cccn3C)cc2)C[C@@H](C)O1	755422127	IYUXTMPPRXSCGB-OKILXGFUSA-N	435.506	1.290	50	20	IDGD	
CNS(=O)(=O)c1cc(NC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)ccc1C	755514476	HXWWQOXELLWBJR-UHFFFAOYSA-N	444.473	1.261	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)ccc1NC(=O)OC(C)(C)C	755939012	CLXXIKAAYZFOTA-NSHDSACASA-N	442.494	1.630	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2ccc(C)cc2OCC(=O)N(C)C)cc1OC	756202631	KKLHXQGHVDUYTM-UHFFFAOYSA-N	430.461	1.946	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)Nc1ncn(CC(=O)N(C)C)n1	756770746	MPJCNKJZAHLUBT-CYBMUJFWSA-N	425.449	1.140	50	20	IDGD	
O=C(CC12CC3CC(CC(C3)C1)C2)NNC(=O)Nc1cnn(CC(=O)N2CCOCC2)c1	756835642	QAPOVERYGUTKKC-UHFFFAOYSA-N	444.536	1.501	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NCc2cc([N+](=O)[O-])ccc2Cl)c2ccccc2c1=O	757256522	QFHQKGBRAFOWLZ-UHFFFAOYSA-N	430.808	1.639	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2cc(OC)cc(OC)c2)ccc1Cl	757471472	CUKVYKPLELBCAC-UHFFFAOYSA-N	428.850	1.767	50	20	IDGD	
CS(=O)(=O)Cc1cc(F)ccc1NC(=O)NNC(=O)COc1ccccc1[N+](=O)[O-]	757679312	SZUGRSFVYGXJBU-UHFFFAOYSA-N	440.409	1.510	50	20	IDGD	
Cc1nn(Cc2ccccc2)c2sc(C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)cc12	758034633	HTPHBYWVRCMWBI-LBPRGKRZSA-N	435.531	1.153	50	20	IDGD	
O=C(NNc1nc(O)c2ccccc2n1)c1ccc(S(=O)(=O)N2CCOCC2)cc1	758310619	HAJFEEHYRJCTOF-UHFFFAOYSA-N	429.458	1.113	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1ccc(-c2nnc(S)o2)cc1	759812298	RIUUDXNXFWPPQQ-UHFFFAOYSA-N	425.474	1.493	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)c2ccccc2C)c(OC)c1	761273525	RGMXQRRFOHHAGZ-UHFFFAOYSA-N	427.504	1.389	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)NCCNC(=O)c2ccc(O)cc2)N(C)c2ccccc21	761962951	LXPLHDCQTDFBQP-UHFFFAOYSA-N	447.495	1.909	50	20	IDGD	
O=C(CCc1nc(O)c2c3c(sc2n1)CCC3)NNc1nccc(N2CCOCC2)n1	762866578	PFRMSJOVQUSZFX-UHFFFAOYSA-N	441.517	1.588	50	20	IDGD	
Cc1ccc(NC(=O)C(C)C)cc1NC(=O)C(=O)NNC(=O)[C@H]1COc2ccccc2O1	763569476	ACLMTEAYNVYITK-GOSISDBHSA-N	440.456	1.515	50	20	IDGD	
CCOC(=O)c1cc(C)sc1NC(=O)C(=O)NNC(=O)COc1ccccc1CC	763714504	XQIBDQKMRFHDNX-UHFFFAOYSA-N	433.486	1.961	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)cc1NS(C)(=O)=O	763728346	UEHTZJTVWKVTSC-UHFFFAOYSA-N	448.545	1.669	50	20	IDGD	
CN(C)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cccc(N(C)C)c2)cc1Cl	763759829	CWUOTUNLNDCYJQ-UHFFFAOYSA-N	431.880	1.508	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(F)c(C(N)=O)c2)cc1	763767765	KAJKZJGZXVHLDP-UHFFFAOYSA-N	430.436	1.749	50	20	IDGD	
CC(=O)Nc1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])ccc1C	763804638	VBDPSDLFSGFQFW-UHFFFAOYSA-N	429.389	1.027	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)C(=O)Nc1ccc(Cc2ccncc2)cc1	763806029	YGFYASBJNMMMNK-UHFFFAOYSA-N	449.423	1.746	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(C(=O)NC2CCCC2)cc1	763814470	UXQYRAXFPXZJTD-UHFFFAOYSA-N	449.467	1.396	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cc(CC(C)C)nn2C)cc1	763860504	HXMAOZRVNFPVCN-CQSZACIVSA-N	431.493	1.571	50	20	IDGD	
CCn1cnnc1-c1ccccc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccc(F)cc1	763872233	LOMUQLBSXOXYNY-CYBMUJFWSA-N	440.435	1.658	50	20	IDGD	
COc1cc(OC)c(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(C(C)=O)cc2)cc1F	763878352	PDHSSGTYEABNEC-GFCCVEGCSA-N	447.419	1.599	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cnc(C(C)(C)C)nc2)cc1OC	763912210	SGXUTHYFMZMHHO-UHFFFAOYSA-N	429.477	1.971	50	20	IDGD	
C[C@@H](c1cccc(NC(=O)C(=O)NNC(=O)Cc2ccc(F)cc2)c1)N1CCOCC1	763921123	QZSBKUBPKQSULI-HNNXBMFYSA-N	428.464	1.548	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3ccc4c(c3)NC(=O)CO4)cc2C1	763939278	CUSODUJJKUPLKY-JTQLQIEISA-N	428.470	1.604	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)C(=O)Nc1ccc(F)c(NC(=O)Cc2ccccc2)c1	763999628	WSCLASJTLZPBMC-UHFFFAOYSA-N	437.431	1.745	50	20	IDGD	
COc1c(F)cc(F)cc1NC(=O)C(=O)NNC(=O)c1cc(Br)cn1C	764001751	DZDOXQAEZBBBMD-UHFFFAOYSA-N	431.193	1.474	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)Nc1cnn(-c2ccccc2)c1	764004303	CJIBKBLBDXIYLB-UHFFFAOYSA-N	431.250	1.373	50	20	IDGD	
C[C@@H]1CN(C(=O)c2ccc(NC(=O)C(=O)NNC(=O)Cc3ccsc3)cc2)C[C@@H](C)O1	764034550	GQUXQIBZFNOKME-ZIAGYGMSSA-N	444.513	1.326	50	20	IDGD	
CSc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1Cl	764078634	ZAYXOSREOXIHRV-UHFFFAOYSA-N	441.918	1.865	50	20	IDGD	
COC(=O)c1cc(Br)ccc1NC(=O)C(=O)NNC(=O)CC1CCCC1	764188537	PSSPZVALLVCSRZ-UHFFFAOYSA-N	426.267	1.902	50	20	IDGD	
CNC(=O)Cn1ccc2ccc(NC(=O)C(=O)NNC(=O)c3cccc4ncccc34)cc21	764257888	PYYNJYFVKUBVAN-UHFFFAOYSA-N	444.451	1.335	50	20	IDGD	
CN(C)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(Br)ccc2O)cc1	764277389	LPMUOHHIUJNGSZ-UHFFFAOYSA-N	449.261	1.256	50	20	IDGD	
O=C1C[C@H](Cc2ccc(C(=O)NNc3c(F)cc(C(=O)NC4CC4)cc3F)cc2)C(=O)N1	764329291	HSCIYUHKJKYBRK-ZDUSSCGKSA-N	442.422	1.819	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cnn1-c1ccccc1	764343439	QLXUXKARBIIPIN-UHFFFAOYSA-N	429.440	1.766	50	20	IDGD	
C[S@](=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1F	764351068	OKCCBCKJJICMGI-PMERELPUSA-N	429.433	1.149	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COCCO1)C(=O)Nc1ccc(OCc2cccc(F)c2)c(F)c1	764430709	ZVNLOTNECNLIBG-KRWDZBQOSA-N	435.383	1.045	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)c1ccc(COc2ccccc2)o1)S(=O)(=O)C1CCOCC1	764570525	DXFJUBDEPOEXEM-AWEZNQCLSA-N	436.486	1.602	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)cn1	765313525	SKRQHYZVAXGVEG-UHFFFAOYSA-N	432.912	1.714	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2ccc(Cl)c(F)c2)CC1	766194434	XJRFEQTYAPEABB-UHFFFAOYSA-N	427.889	1.567	50	20	IDGD	
COC(=O)[C@@H](c1cccc(Cl)c1)N1CCN([C@@H](C)C(=O)NNC(=O)CC(C)C)CC1	766974196	ZLUJWCWQBMNQEB-HNAYVOBHSA-N	438.956	1.754	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)[C@H](c1ccccc1)N1CCN(C)CC1	768627670	CIMQYJMZTWHGAZ-FQEVSTJZSA-N	432.546	1.531	50	20	IDGD	
C[C@H](CNC(=O)OC(C)(C)C)NC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	769532807	RHTXBFIERWMDSB-QGZVFWFLSA-N	448.568	1.442	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)[C@H]1CCN(C(=O)OCc2ccccc2)C1	770073270	LQOUBMWYCDQXEA-KRWDZBQOSA-N	427.457	1.880	50	20	IDGD	
COCCc1nc(C)c(C(C)=NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)s1	770615585	LRWWJFUKDPBSIC-UHFFFAOYSA-N	443.573	1.939	50	20	IDGD	
CC(C)(C)OC(=O)N1CCO[C@H](C(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)C1	770966737	XKQKGCCDGIXTEO-LBPRGKRZSA-N	435.485	1.366	50	20	IDGD	
C[C@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)c1cn(C)c2ccccc12	771869827	ZHHCHORXDJTFIU-AWEZNQCLSA-N	428.514	1.993	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)c1cccc(OC[C@@H]2CCCO2)c1	772188145	HJICIWVELXTSRF-SFHVURJKSA-N	431.876	1.975	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)Nc2cnn(Cc3nnc4n3CCCC4)c2)c1	772640691	OBRYCZNGROPOKX-UHFFFAOYSA-N	438.492	1.708	50	20	IDGD	
COc1cc(Br)c(S(=O)(=O)NNC(=O)c2cccn2C)cc1C(=O)O	772858806	YMLUXVRMLFPLJG-UHFFFAOYSA-N	432.252	1.118	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)C(=O)Nc2ccc(Cl)cn2)c1	773546169	JIDQYUBRLJYJCT-UHFFFAOYSA-N	427.642	1.906	50	20	IDGD	
CCN1CCN(c2ccc(NC(=O)C(=O)NNC(=O)c3ccc(C)c(F)c3)c(C)c2)CC1	773888096	GFCYTWXYKBNCKO-UHFFFAOYSA-N	441.507	1.984	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)C(=O)N(C)C2=O	774009438	PPYJQRASYKTFAW-SNVBAGLBSA-N	444.831	1.119	50	20	IDGD	
CC[C@H](NCC(=O)NNC(=O)c1ccc(C#N)cc1)c1ccccc1OCC(=O)N(C)C	775058381	YXLWIYWYMAWLKQ-IBGZPJMESA-N	437.500	1.527	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCc2ccc(OC(F)F)cn2)cc(OC)c1OC	775218390	BLZCUKJSDHQVRX-UHFFFAOYSA-N	426.376	1.853	50	20	IDGD	
CO[C@@H]1[C@H](C)[C@@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)C1(C)C	776069697	NNCONXDKEMDFJL-KBRIMQKVSA-N	438.550	1.475	50	20	IDGD	
Cc1cccc2c(=O)c(C(=O)N3CCN(S(=O)(=O)CBr)CC3)c[nH]c12	776189011	WWACSNRKHDVOPO-UHFFFAOYSA-N	428.308	1.277	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)c1ccccc1)C(=O)NNc1cc(Cl)nc(N)n1	779374943	JJKKJTUFGZBNKB-NSHDSACASA-N	430.943	1.256	50	20	IDGD	
O=C(NN=Cc1c[nH]nc1-c1ccsc1)c1cccc(S(=O)(=O)N2CCOCC2)c1	780187450	USZGCIATJJABTH-UHFFFAOYSA-N	445.526	1.923	50	20	IDGD	
CC(C)[C@H](NS(=O)(=O)c1ccc(Br)cc1)C(=O)NN=c1cc[nH]cc1	780761045	DFWFKOCSSVTEHJ-HNNXBMFYSA-N	427.324	1.712	50	20	IDGD	
O=C(CCn1c(=O)oc2cc(S(=O)(=O)N3CCCC3)ccc21)NNc1ccnc(F)c1	781366568	LIEPZNWXWKUHDJ-UHFFFAOYSA-N	449.464	1.447	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)cc1)C(=O)Nc1cccc(C(=O)NCc2ccccc2)c1	782830093	FZWKSGTWJXCJIJ-UHFFFAOYSA-N	432.436	1.722	50	20	IDGD	
CCc1cccc(CC)c1NC(=O)C(=O)NNC(=O)c1csc(N2CCOCC2)n1	782896444	IMDVYHYPCMIMFN-UHFFFAOYSA-N	431.518	1.504	50	20	IDGD	
CN(C)CCn1c(=O)oc2ccc(NC(=O)C(=O)NNc3ncnc4ccsc34)cc21	783252687	AXFRIWKJIYRZHC-UHFFFAOYSA-N	441.473	1.243	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ccc(F)cc2C)cc1OCC(=O)NC1CC1	783446721	YPSPEUFYFXFYEQ-UHFFFAOYSA-N	430.436	1.882	50	20	IDGD	
CN1CCCCC/C1=N\S(=O)(=O)c1cccc(NC(=O)C(=O)NNc2cccnn2)c1	784862959	QWKILIMAAPLWGT-KOEQRZSOSA-N	445.505	1.151	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)C(=O)Nc1ccc(N2CCSCC2)cc1	785067063	GUIQOWFABWMYPP-UHFFFAOYSA-N	438.513	1.216	50	20	IDGD	
Cn1ccnc(NNC(=O)C(=O)Nc2ccc(Cl)cc2I)c1=O	785086491	QLVFLIIEOAJHPB-UHFFFAOYSA-N	447.620	1.120	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)N2CCN(C(=O)COC(=O)/C(C#N)=C/C3CC3)CC2)cc1	786680932	OWBJODJAPCPMQG-LDADJPATSA-N	445.497	1.125	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)N3CCN(C)CC3)c2)cc1	788166176	JJHQPNUNSISYNT-UHFFFAOYSA-N	431.518	1.398	50	20	IDGD	
N#Cc1ccc(N2C(=O)N[C@@H](CCC(=O)NNc3cccc(F)c3[N+](=O)[O-])C2=O)cc1	791076651	RQJYBWLHBOXEMH-HNNXBMFYSA-N	426.364	1.954	50	20	IDGD	
Cc1nc2c(C(=O)NNC(=O)c3cccc(S(=O)(=O)N4CCOCC4)c3)cccc2o1	791447001	RZMKCRWNIUPRIP-UHFFFAOYSA-N	444.469	1.232	50	20	IDGD	
COc1ccc(OC)c(C2=NO[C@@H](C(=O)NNC(=O)c3ccc4c(c3)OCCO4)C2)c1	791483805	QHMVPLRVYGZEPC-LJQANCHMSA-N	427.413	1.429	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)Cc2ccc(NC(=O)OC(C)(C)C)cn2)C[C@@H](C)O1	792628369	HRWHRHBTYBWUHX-HUUCEWRRSA-N	435.525	1.618	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N1C[C@@H](C)O[C@@]2(CCOC2)C1	792782091	YXWRIPXZEBIHPI-VBHSOAQHSA-N	442.310	1.837	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2nc(Br)ccc2F)n1	795857214	RDVWINTUZYKENF-UHFFFAOYSA-N	431.243	1.295	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(C)(C)[C@H]1C(=O)OCC(=O)NNC(=O)c1cccc(C#N)c1	796222529	PYIJILHZHZLDGZ-MRXNPFEDSA-N	430.461	1.508	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCC(O)(Cc3cccc(C)c3)CC2)cc1OC	796485620	STRANPJBLNHRTQ-UHFFFAOYSA-N	441.528	1.843	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2ccc(F)c(N3CCOC3=O)c2)c1	796991491	FERYMNDHVSIMJR-UHFFFAOYSA-N	444.419	1.564	50	20	IDGD	
COc1cc2c(cc1S(=O)(=O)NNC(=O)c1cccc(OC(F)F)c1)OCC(=O)N2	797429881	DTZLPEZJYDLSIB-UHFFFAOYSA-N	443.384	1.251	50	20	IDGD	
CC(C)(C)Nc1ccccc1NC(=O)C(=O)NNC(=O)CNC(=O)OCc1ccccc1	799263432	PBOLAWVHBHWMDX-UHFFFAOYSA-N	441.488	1.909	50	20	IDGD	
CSC[C@@H](C)C(=O)N1CCC(C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)CC1	799537793	QOWFZWXOHXRTBI-CQSZACIVSA-N	446.529	1.100	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2[C@H]3C=C(c4ccnn4C)C[C@H]2CC3)cc1OC	802017748	YYRHKWKEMRENTO-IAGOWNOFSA-N	425.489	1.519	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2ccc(OC)c(S(=O)(=O)NC(C)C)c2)cc1	802052497	NDAQQSJARMHUKJ-UHFFFAOYSA-N	436.490	1.857	50	20	IDGD	
CCOC(=O)C(C)(C)CC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	805150806	JNRAZRYRKRRZJC-UHFFFAOYSA-N	425.507	1.212	50	20	IDGD	
COc1ccc([C@]2(C)NC(=O)N(CC(=O)NNc3ccc([N+](=O)[O-])cc3C)C2=O)cc1	805374769	XSTUSINBBWBYMT-FQEVSTJZSA-N	427.417	1.822	50	20	IDGD	
Cc1cc(I)cc(NC(=O)C(=O)NNC(=O)c2cccc(C)n2)c1	807069646	KBOPDUCUPWEMHC-UHFFFAOYSA-N	438.225	1.703	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)[C@H](c1ccccc1)N(C)C	807403965	FQPIUPWIJMMBCI-DNVCBOLYSA-N	447.561	1.572	50	20	IDGD	
Cc1cc([N+](=O)[O-])ccc1NNC(=O)C(=O)Nc1ccc(O[C@@H]2CCN(C)C2=O)cc1C	807456515	BHKJGQFYBVOGAW-GOSISDBHSA-N	441.444	1.903	50	20	IDGD	
O=C(NNc1nccnc1C1CCC1)C(=O)Nc1ccc(F)c(S(=O)(=O)NC2CC2)c1	807462717	NZZCUXJZKWTUMK-UHFFFAOYSA-N	448.480	1.406	50	20	IDGD	
O=C(NCc1ccncc1OC[C@H]1CCOC1)NNC(=O)c1cc(Br)c[nH]1	807616204	PPJCZVSIDHEPCN-NSHDSACASA-N	438.282	1.732	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNS(=O)(=O)c2ccc(C(F)F)cc2)ccc1Cl	808070538	XLIKYVMKZGFMCH-UHFFFAOYSA-N	439.849	1.548	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)CNS(=O)(=O)c1ccc(Cl)c(Cl)c1	810194002	LLVZIGOLKSBAIK-UHFFFAOYSA-N	446.312	1.670	50	20	IDGD	
Cc1nnc(-c2ccc(NC(=O)C(=O)NNc3ccc(S(=O)(=O)N(C)C)cc3)cc2)o1	813033881	PKAGISIBFOKPAP-UHFFFAOYSA-N	444.473	1.377	50	20	IDGD	
COc1cc(CNC(=O)NNC(=O)c2nnc(O)c3ccccc23)cc(OC)c1OC	813533304	UBFNNUPXFDAUSL-UHFFFAOYSA-N	427.417	1.505	50	20	IDGD	
N#Cc1ccc(-c2ccc(OCC(=O)NNC(=O)C[C@@H]3CCCS(=O)(=O)C3)cc2)cc1	814721036	VASSYOXDJZVCOK-KRWDZBQOSA-N	441.509	1.966	50	20	IDGD	
CC(C)OC(=O)c1c(NC(=O)C(=O)NNC(=O)[C@H]2CCCO2)sc2c1CC[C@@H](C)C2	815779169	USIZWYHGRNNGNP-DGCLKSJQSA-N	437.518	1.703	50	20	IDGD	
CN(C)NC(=O)Nc1cccc(NC(=O)CN2C(=O)Cn3c(cc4ccccc43)C2=O)c1	816407344	YUIUKXRHPATRDP-UHFFFAOYSA-N	434.456	1.861	50	20	IDGD	
Cn1nncc1NNC(=O)C1CCN(S(=O)(=O)c2cccc(OC(F)(F)F)c2)CC1	816772197	QNKKDGCBUQZAOY-UHFFFAOYSA-N	448.427	1.258	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)[C@H]2CC(=O)N(Cc3ccccc3Cl)C2)cc1	913429556	IATZSXCYMGKCBR-HNNXBMFYSA-N	430.892	1.957	50	20	IDGD	
CC(C)(C)OC(=O)NNC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1	913471538	BEWWXJPLZCLPGX-CQSZACIVSA-N	428.467	1.694	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NC[C@@H](Cc2ccccc2)N(C)C)nc1	915900885	IZIFAZYRFXVCNO-GOSISDBHSA-N	448.593	1.911	50	20	IDGD	
Cn1ncc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1C(F)(F)F	916096058	DXCCFPWGVXKCFX-UHFFFAOYSA-N	445.423	1.298	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)c2c(C)oc(C)c2S(N)(=O)=O)cc1	916134303	KKXZIWFWWHSEDE-GFCCVEGCSA-N	425.463	1.171	50	20	IDGD	
COc1ccc2c(c1)C(=NNC(=O)c1cccc(S(=O)(=O)N3CCCC3)c1)C(=O)N2	916261842	HCOOUVCGJZYDRD-UHFFFAOYSA-N	428.470	1.566	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)NCc2ccnc(N3CCOCC3)c2)c1C	916389293	UZHFPRHYJIRSFT-KRWDZBQOSA-N	427.505	1.833	50	20	IDGD	
C[C@@H]1CN(c2ccc(CNC(=O)NNC(=O)Cc3nc4ccccc4n3C)cn2)CCO1	916392757	KEZVPMWOTJECSA-OAHLLOKOSA-N	437.504	1.267	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)N2CCN(C(=O)C(=O)NC3CC3)CC2)c(C)n1CC(C)C	916409194	YBHPGWNCEVQCLH-XDHOZWIPSA-N	425.533	1.617	50	20	IDGD	
CC(=O)N1CCc2cc(Br)c(S(=O)(=O)NNC(=O)c3ccccn3)cc21	917713091	DVNWMXNMHLBDTI-UHFFFAOYSA-N	439.291	1.376	50	20	IDGD	
CNC(=O)NNC(=O)c1cccc(NC(=O)C[C@@H]2SC(N3CCCCC3)=NC2=O)c1	919877880	GBUYZUADRFNRCV-AWEZNQCLSA-N	432.506	1.073	50	20	IDGD	
CCOC(=O)c1sc2[nH]c(CSCCC(=O)NNC(=O)NC)nc(=O)c2c1C	919879644	XQUHHNBNAHDUAY-UHFFFAOYSA-N	427.508	1.053	50	20	IDGD	
O=C(NNC(=O)c1ccccc1OCc1cn2ccccc2n1)N[C@@H]1CCS(=O)(=O)C1	919889562	OEEFCLXGJLGNHF-CQSZACIVSA-N	443.485	1.044	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NCc2ccc(-n3ccnc3)c(F)c2)c2ccccc2c1=O	920238911	MZBWWPGDHBFASG-UHFFFAOYSA-N	435.419	1.403	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)N(C)CC(=O)N[C@@H]2CCS(=O)(=O)C2)c(C)n1CCC(C)C	920291468	VKYHEFMWWGXOQV-PYIVIEQSSA-N	448.589	1.820	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)NCc2cccnc2N2CCN(C)CC2)c1C	921248463	ZJQUYUWNUXMLFD-GOSISDBHSA-N	440.548	1.748	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3ccnc(OC4CCC4)c3)cc2)CC1	1253782811	KHRUNPYQSLSYIA-UHFFFAOYSA-N	445.545	1.706	50	20	IDGD	
O=C(COC(=O)c1cnn(C2CCCCC2)c1)NNC(=O)[C@@H]1COc2ccccc2O1	1322731278	JDJGPFVEOQVIQZ-SFHVURJKSA-N	428.445	1.533	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](C)N3CSCSC3)C2)C1	1779147537	CCSLMQATBPJUMC-JKIFEVAISA-N	438.015	1.113	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccn(CCOC)n1)C2	1780703053	YMEIGVGMRWMIEH-WRWLIDTKSA-N	426.945	1.674	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)Cn3c(=O)n(C)c4ccccc43)CCO2)C1	1781219367	OQCOLUXTYSOJIA-VFNWGFHPSA-N	434.924	1.187	50	20	IDGD	
CC(C)c1nc(CC(=O)N2CCO[C@@]3(CCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)no1	1781225048	SNZZTQHDAGTBHH-ROUUACIJSA-N	433.336	1.802	50	20	IDGD	
CC[C@H](CC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2)NC(=O)OC(C)(C)C	1781358879	ATCZFGMDQFBGAC-SIFCLUCFSA-N	447.960	1.109	50	20	IDGD	
CCOc1ccc(Cl)cc1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1781743584	SYGJHJQKVQVFDB-KXBFYZLASA-N	431.316	1.782	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnsn1)C2	1781900334	ARHCXEBMGBFMFV-AXAPSJFSSA-N	431.356	1.839	50	20	IDGD	
C[C@@H](Cn1cncn1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)Br)C1	1781997614	DSUORMDOOGYUOA-LUXYFRNMSA-N	442.358	1.212	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCN1CCOC1=O)C2	1781999352	WOZNYRBRBFBCGF-PMUMKWKESA-N	446.342	1.126	50	20	IDGD	
O=C(c1nc2cc([N+](=O)[O-])ccc2[nH]1)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Cl)CCO2	1782181870	HCWZYEHFBCLVQL-DYVFJYSZSA-N	425.804	1.449	50	20	IDGD	
CCOC(=O)C1(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](Br)CC)C3)C2)CC1	1783355856	YQYDEHAHZAOWGN-SUMWQHHRSA-N	431.327	1.333	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3c(C)nc4sccn34)CCO2)C1	1783878494	ZDPWFFJFESTSRZ-ACJLOTCBSA-N	426.926	1.402	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(F)c(F)c3OC)CCO2)C1	1783879885	BIVVSZCQRGLDNQ-BFUOFWGJSA-N	432.851	1.671	50	20	IDGD	
Cc1cc(Cl)cc(C(=O)N2CCO[C@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)c1	1783938102	UKWHYECESMWZQP-NRFANRHFSA-N	436.940	1.465	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]2C1	1783974557	PVRPFNHWGYRPJE-YHQUGGNUSA-N	425.751	1.251	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)c1cccc(C(F)(F)F)n1	1788878603	UZTWGZCPVDEIFE-VTPLQMEGSA-N	435.830	1.293	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccccc3)[C@H]2C1	1789426658	HUIRRKRDQCRCJY-QXDWZXEQSA-N	437.500	1.414	50	20	IDGD	
C[C@@H](C(=O)NC1(c2ccc(NC(=O)c3cnccc3C(=O)NN)cc2)CCC1)n1cncn1	1789523709	OOEBTYAJEXDWTC-AWEZNQCLSA-N	448.487	1.286	50	20	IDGD	
C[C@H](Cn1cncn1)C(=O)Nc1ccc(C2(NC(=O)CCC(=O)NN(C)C)CCC2)cc1	1789618900	SOUDAAVPVGNGBZ-MRXNPFEDSA-N	441.536	1.421	50	20	IDGD	
COc1c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](O)CCl)C[C@@H]32)ccc(F)c1F	1790168358	MNIZWUWTWKFLDI-FATJJJSSSA-N	432.851	1.166	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(C)nn3C)C[C@@H]21	1790961897	WPTQJKHVJHWTNF-YXWQFLTLSA-N	427.343	1.495	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=N/O[C@H]3CCCCO3)C[C@@H]21	1791055696	DZZMDROXROMNRB-ULXNUZMESA-N	446.342	1.279	50	20	IDGD	
O=C(NC1(c2ccc(NC(=O)[C@@H]3[C@@H]4C=CS[C@@H]34)cc2)CCC1)c1cccc(B(O)O)c1	1791086580	BXOYUXQOQCBVIL-XUVXKRRUSA-N	434.326	1.989	50	20	IDGD	
CCc1[nH]nc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](Cl)COC)[C@H]3C2)c1Cl	1791253956	GFGMCACGSFJSAN-FMSGJZPZSA-N	433.336	1.473	50	20	IDGD	
Cn1nc(C(F)(F)F)cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]2C1	1791298473	ZZVLBNWCHHZJJW-QXEWZRGKSA-N	443.253	1.836	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(F)cc1C(F)(F)F)C2)[C@H](O)CCl	1792983348	ICARRIWAGIJAOB-ANGCBRKESA-N	438.805	1.647	50	20	IDGD	
Cc1c(F)ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCBr)c1N	1795113110	ZHCCEGZGNCSUAZ-DPIQGUFMSA-N	428.302	1.705	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CNc1ccc(F)cc1	1795543509	CBADJFHNRLPSGS-JRATXPSKSA-N	428.302	1.611	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2sc(N)nc2c1	1795660348	RYJMANQUOPFSNK-OQMKEHIESA-N	438.937	1.336	50	20	IDGD	
CC(C)(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Cl)NC(=O)OC(C)(C)C	1796360906	DYXSZNCRYSFJGK-AYRXBEOTSA-N	435.924	1.804	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1cc(C(F)(F)F)c[nH]1	1796546779	GNNBBCGJNGALIF-VVJJBPBLSA-N	442.207	1.927	50	20	IDGD	
CC(C)(C)c1cnc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CO[Si](C)(C)C)C3)cn1	1796759406	OWSCZZYPHJKEJZ-CCWDJLKJSA-N	434.613	1.829	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2c(c1)OCCO2	1796791886	XSRCRLABOBQGDN-ACNBBOPNSA-N	443.327	1.897	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cc1ccccc1O)C2	1796893794	UOKZPLMNVCYALK-DHMPJCMBSA-N	437.500	1.707	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccn2cncc12	1797519794	HJJHZIUVDJORLA-VWPFQQQWSA-N	435.322	1.569	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)Nc1ccccn1	1797972090	XEZVWDIFJVUVDQ-WVCIDPQESA-N	439.354	1.503	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1(C(F)(F)F)CCC1)C2)[C@H](F)Br	1799346682	WATYZCRRYUOFDT-VLEAKVRGSA-N	431.224	1.999	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc3n(n1)CCNC3=O)C2	1800079179	OEBGRJQEHHEVEE-DBYGNECLSA-N	428.320	1.115	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccn3cncc3c1)C2	1800641679	GZNCHRNEDGHDEK-FSDCSDTHSA-N	435.322	1.711	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Cl)C3)C1	1800768139	MPZQVCIIMGVUNR-IBEHDNSVSA-N	447.935	1.758	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1=NO[C@@H](c3ccccc3)C1)C2	1800978028	JUQKLBQDMKMHLQ-LMCLKVLCSA-N	435.908	1.347	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccccc1OC(F)F	1801816023	MMYYYEMUDDBROL-LMWOUKEDSA-N	432.851	1.745	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCOCCOCCOC	1802086684	JLKUPSUDNBPRCY-YVSFHVDLSA-N	449.386	1.868	50	20	IDGD	
CNC(=O)CC(=O)N1CC[C@H](CNC(=O)[C@@H](C)CBr)[C@H]1c1cccnc1	1803011129	NYHZICUBXSZXGW-DXCKQFNASA-N	425.327	1.255	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)Cc2cccc([N+](=O)[O-])c2)[C@@H]1c1cccnc1)[C@H](O)CCl	1803137854	UGZQICCCTUTDPP-ILZDJORESA-N	446.891	1.838	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)CSCC(=O)OC)[C@@H]1c1cccnc1	1803579539	HHJFNUHIOOKKMQ-VKJFTORMSA-N	443.953	1.247	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)CN2CC(=O)NC2=O)[C@H]1c1cccnc1	1804183151	LJNBDWMAKZFRAL-RLFYNMQTSA-N	435.912	1.047	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)/C=C/c2ccoc2)[C@@H]1c1cccnc1	1804320329	SMWZVNQSCNNVKO-IDDCSHTPSA-N	439.516	1.767	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)[C@@H](C)Cn2cccn2)[C@@H]1c1cccnc1	1804723997	YWHFJTUJGMVNPA-NQYYFHDYSA-N	433.940	1.874	50	20	IDGD	
O=C(CCBr)NC[C@@H]1CCN(C(=O)CCn2cncn2)[C@@H]1c1cccnc1	1806346269	DXMYQQHLYAVULL-MAUKXSAKSA-N	435.326	1.554	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CCC2CCC2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1	1807367025	WVMQDSDPQRGMAG-NZQKXSOJSA-N	435.333	1.661	50	20	IDGD	
CCc1[nH]nc(C(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)c1Cl	1807700957	UGCLFYVGNFXRTF-DXCKQFNASA-N	440.331	1.940	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1CCN(C(=O)[C@H]2CCNC(=O)C2)[C@@H]1c1cccnc1	1808317980	PNLGHUPQKBLPKW-UXYNSRGZSA-N	441.359	1.850	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H](CNC(=O)[C@@H](F)Br)[C@@H]1c1cccnc1)n1cncn1	1808679669	AGECKNIONFDVEM-REBRKWNGSA-N	439.289	1.631	50	20	IDGD	
C[C@H](Nc1cccnc1)C(=O)N1CCCC2(CCN(C(=O)CCC(=O)NN(C)C)CC2)C1	1809785663	JMKUUTQKQKINMW-SFHVURJKSA-N	444.580	1.486	50	20	IDGD	
O=C(/C=C/c1ccccc1)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1	1809976913	XPDVVJCAHIEDHL-ZHACJKMWSA-N	432.329	1.925	50	20	IDGD	
Cc1oncc1C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1	1810299567	SMXTVCFYQACSGA-BEFAXECRSA-N	449.471	1.010	50	20	IDGD	
COC[C@H](NC(C)=O)C(=O)NC[C@@H]1CCN(C(=O)C(C)(C)CCl)[C@@H]1c1cccnc1	1810558572	GKDPIXLTDBKLLR-OKZBNKHCSA-N	438.956	1.504	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)c1cn2c(F)cccc2n1	1812178035	OQEUWPAGXQEPFP-GMBSWORKSA-N	445.882	1.788	50	20	IDGD	
C=C(CC(=O)OCC)C(=O)N1CC[C@H](CNC(=O)[C@@H](Cl)COC)[C@@H]1c1cccnc1	1813032134	GHNLBPYCPRWNCN-AOIWGVFYSA-N	437.924	1.851	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)COc2ccc(O)nn2)[C@@H]1c1cccnc1)C(Cl)Cl	1813081153	JHCVLCDITRBVQB-MLGOLLRUSA-N	440.287	1.466	50	20	IDGD	
C#CCCCCC(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1813223770	UNWJBXFLFGMWLK-REWPJTCUSA-N	433.317	1.275	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)CCc2ccoc2)[C@@H]1c1cccnc1	1813528516	NGGXYBUDJMJCKS-CVDCTZTESA-N	441.532	1.686	50	20	IDGD	
C[C@]1(C(=O)N[C@@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)CC=CCC1	1815347893	VTTVZLPLVIPMNS-ZHRRBRCNSA-N	439.346	1.795	50	20	IDGD	
COC(=O)[C@H]1CC[C@H](C(=O)Nc2cc([C@@H]3CCCCN3C(=O)[C@H](O)CCl)[nH]n2)CC1	1815465316	FNDABNNDDBHLFM-DARAHFNDSA-N	440.928	1.981	50	20	IDGD	
C[C@H](O)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)n[nH]1	1815705076	WKYXJBYWVSILSV-FPMFFAJLSA-N	443.932	1.915	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)C[C@@H]2CCCCO2)[nH]n1)c1cccc(B(O)O)c1	1817473805	AQIMRPKTQIVQTN-PKOBYXMFSA-N	440.309	1.355	50	20	IDGD	
C[C@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1)n1cccc1	1817474858	HSCOOHYZNICCHL-DNVCBOLYSA-N	435.293	1.458	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)CCc2ccc[nH]2)[nH]n1)c1cccc(B(O)O)c1	1817475607	VJNXYABXPGQXKV-LJQANCHMSA-N	435.293	1.356	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@H]1CCc2nc(NC(=O)c3cn[nH]c3)sc2C1	1817554644	PBGFCVISGTZTNQ-SQXLOGQISA-N	440.489	1.226	50	20	IDGD	
C[C@]1(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cnccc3C(=O)NN)n[nH]2)CC1(F)F	1819404316	GVJMPUMGHHNMAN-AUUYWEPGSA-N	447.446	1.759	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H]2C[C@@]2(F)Cl)[nH]n1	1819404782	YRRSXDYYTPQGKB-UHYGZKCKSA-N	449.874	1.639	50	20	IDGD	
C[Si](C)(C)OCC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1819593687	QFHVBFLCFXFIEI-QGZVFWFLSA-N	444.373	1.247	50	20	IDGD	
O=C(O)c1cnncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)C(Cl)Cl)CC2	1820502425	MKUQDQWHCXRXJP-LURJTMIESA-N	430.273	1.661	50	20	IDGD	
CC[C@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN2CCS(=O)(=O)CC2)[nH]n1	1820853292	HZDRCDSIJZAXPD-ZFWWWQNUSA-N	445.973	1.150	50	20	IDGD	
C[C@@H](O)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)[nH]n1	1822172587	KXYYSVPBUQHWCZ-KWCYVHTRSA-N	443.932	1.915	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCc2nc(N)n[nH]2)[nH]n1	1822189495	UBNNZYUMAOUUQC-KOLCDFICSA-N	439.318	1.518	50	20	IDGD	
CC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc3n(n1)CCNC3=O)CC2	1822844292	YBFGIGSUVIKXOG-UWVGGRQHSA-N	436.925	1.326	50	20	IDGD	
CC[C@@H](NC(C)=O)C(=O)N[C@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1	1822999603	VENMBKOMVXDLAY-SBMIAAHKSA-N	435.319	1.660	50	20	IDGD	
N[C@@H](Cc1cscn1)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H](O)CCl)CC1	1824183156	PVMORODGGDBECS-BBWFWOEESA-N	428.986	1.232	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)CCN2C(=O)C=CC2=O)CC1	1824773528	GANOGPJTLBBIBJ-IAGOWNOFSA-N	439.940	1.175	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)Cc2ncccn2)CC1	1825322067	XVGJNCNPKFZJLR-GOSISDBHSA-N	430.553	1.012	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(C3CC3)on1)CC2	1826083725	QCRXBOFGRTWHAK-LBPRGKRZSA-N	446.533	1.607	50	20	IDGD	
CC(C)(C)[C@@H](O)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827048946	DMIHCIZTDDTWNA-UXHICEINSA-N	430.354	1.007	50	20	IDGD	
O=C([C@H]1[C@H]2SC=C[C@H]21)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827053464	QKUWRZRCLBRKNZ-BQJUDKOJSA-N	440.374	1.475	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccnnc2)CC1	1828925643	OBHQIZBAMCKIPQ-LJQANCHMSA-N	437.504	1.022	50	20	IDGD	
CNC(=S)NCCC(=O)N1CCCC[C@H]1C1CCN(C(=O)CCBr)CC1	1828928516	JJRSBOPIMMAQLF-HNNXBMFYSA-N	447.443	1.875	50	20	IDGD	
CN1CCC(CC(=O)N2CCO[C@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)CC1	1830006337	SVBWGMXXSPRLIU-OAQYLSRUSA-N	441.645	1.026	50	20	IDGD	
Cc1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)c1F	1830103850	MHMOJFWVEHOFDR-AUUYWEPGSA-N	443.313	1.988	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3c(C)noc3C)C2)C1	1831640614	OKCRLBRUWOHPKP-FXAWDEMLSA-N	427.929	1.698	50	20	IDGD	
CCC(=O)N[C@H](C)C(=O)NC1CCN(C2CCN(C(=O)C(C)(C)CCl)CC2)CC1	1833418333	WQURDEGQTOJDHK-OAHLLOKOSA-N	429.005	1.738	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)c3nc4ncccn4n3)CC2)CC1	1833533194	YFOGKAWVLWOOLJ-KRWDZBQOSA-N	447.971	1.717	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cncc(F)c3)CCO2)C1	1834358814	FOURGWFVZUBOQO-QAPCUYQASA-N	444.301	1.464	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cnn(-c4cccnc4)c3)CC2)CC1)[C@H](F)Cl	1835078438	FTAOVGBFMWYIEN-IBGZPJMESA-N	448.930	1.987	50	20	IDGD	
NCC(=O)N1CCO[C@]2(COCCN(C(=O)CCCCCCCCBr)C2)C1	1835555524	FBIZTEOZPQYOCO-IBGZPJMESA-N	448.402	1.527	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](C)N3C[C@H]4C[C@H]4C3)CC2)CC1	1835671889	AWVSGXSVMOFANG-WWNBULGVSA-N	425.017	1.916	50	20	IDGD	
CC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)CCc3ccc(O)nn3)CC2)CC1	1836397570	IURIJZAUXUQBGC-SFHVURJKSA-N	437.972	1.704	50	20	IDGD	
CC(C)(C)n1ccc(C(=O)N2CCC(OC3CCN(C(=O)[C@H](O)CCl)CC3)CC2)n1	1836715399	SJXFZZYDHYEOLT-GOSISDBHSA-N	440.972	1.850	50	20	IDGD	
Cc1cc(C)n(CCC(=O)N2CCC(OC3CCN(C(=O)[C@H](O)CCl)CC3)CC2)n1	1836720243	MROMWUPGWCSZQY-LJQANCHMSA-N	440.972	1.488	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)COc3cc(Cl)ccn3)CCO2)C1	1837654023	IFMYIWVPWMIFNY-KXBFYZLASA-N	446.331	1.588	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3cccnc3)C2)C1	1839152207	RBACPJCLLPQTKU-WOJBJXKFSA-N	444.359	1.707	50	20	IDGD	
O=C(/C=C/c1ccco1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839197661	DUEAVQCMPBMMPU-JUPLKNRCSA-N	431.258	1.440	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3c(F)cncc3F)C2)C1	1840033639	MCRCVEHBWPFIAI-APPDUMDISA-N	448.264	1.213	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccncc3Cl)C2)C1	1840033646	MFSKRNHGEUYZKL-YVEFUNNKSA-N	446.729	1.588	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCn3nc(C)cc3C)CCO2)C1	1840345178	BCQBCFYEHRJIQJ-NQIIRXRSSA-N	440.972	1.754	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CC[C@H](C(=O)N2CC3(CCCN3C(=O)[C@H](O)CCl)C2)C1	1841347637	AOKUMNGUXFTKML-RRFJBIMHSA-N	429.945	1.483	50	20	IDGD	
COc1ccc(CC(=O)N2CCCC23CN(C(=O)CCC(=O)NN(C)C)C3)c(Cl)c1	1841912958	DORRUYSKLAVMKJ-UHFFFAOYSA-N	436.940	1.468	50	20	IDGD	
COC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)CO[Si](C)(C)C)C2	1843382599	UZCKSZZPVDRORP-OAHLLOKOSA-N	443.617	1.581	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)C(C)(C)C(C)=O)C2	1844691990	WHKDQXVHDIDORY-UHFFFAOYSA-N	431.445	1.952	50	20	IDGD	
C[C@H](NC(=O)c1ccc(F)cc1)C(=O)N1CCCC12CN(C(=O)[C@@H](F)Br)C2	1845004053	NHEHQCQKBVYNCL-SMDDNHRTSA-N	444.276	1.838	50	20	IDGD	
C[C@H](Br)C(=O)N1CC2(CCCN2C(=O)C[C@@H](O)CNC(=O)OC(C)(C)C)C1	1845231533	SXVAEAACEHQRIF-QWHCGFSZSA-N	448.358	1.249	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CCOCCNC(=O)OC(C)(C)C	1847723035	GSPYBLJZMRFQES-JYJNAYRXSA-N	447.960	1.373	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(Cl)cc2[N+](=O)[O-])cc1OC	10748826	OIFVJUDELGZBFZ-UHFFFAOYSA-N	437.792	1.883	50	20	IDGD	
CCCCCCOc1ccc(C(=O)NNC(=O)C2=CN3CCS(=O)(=O)N=C3C=C2)cc1	17360175	NPGKIHWEZAKYGL-UHFFFAOYSA-N	446.529	1.904	50	20	IDGD	
O=C(NNC(=S)NCCc1ccccn1)c1cccc(S(=O)(=O)N2CCCCC2)c1	726120694	SJUXDFCDHOQSTH-UHFFFAOYSA-N	447.586	1.608	50	20	IDGD	
NC(=O)c1ccc(NC(=S)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc1	726438966	GWMVOKYHAVAYCY-UHFFFAOYSA-N	447.542	1.201	50	20	IDGD	
Cn1c(SCC(=O)OCC(=O)NNC(=O)c2ccccc2)nnc1-c1cccs1	726825372	AWIUKSAUGPALRV-UHFFFAOYSA-N	431.499	1.640	50	20	IDGD	
O=C(CCCc1ccccc1)NNC(=O)NCCCN1CCN(c2ncccn2)CC1	727840887	DDCFTPPEJDUQTQ-UHFFFAOYSA-N	425.537	1.342	50	20	IDGD	
C[C@@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(S(=O)(=O)NNC(=O)C3CCCC3)cc2)C1	728259942	MJTWKUORVTWYGJ-HUUCEWRRSA-N	443.591	1.853	50	20	IDGD	
COc1cc(C=NNC(=O)[C@H](C)NS(C)(=O)=O)ccc1OC(=O)c1cccs1	728433910	GWHZUIJDENBDNW-NSHDSACASA-N	425.488	1.364	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)C1CCN(S(=O)(=O)c2ccc(F)c(F)c2)CC1	728852792	XIKZFXLGFISZAN-UHFFFAOYSA-N	438.456	1.151	50	20	IDGD	
Cc1cc(S(=O)(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c2ncccc2c1	728854497	WXSIQNKLLXJZCN-UHFFFAOYSA-N	426.502	1.559	50	20	IDGD	
O=C(COC(=O)[C@H]1COc2ccc(Cl)cc2C1)NNC(=O)[C@@H]1COc2ccccc2O1	729236716	KQHXNPBTUDFUPF-ACJLOTCBSA-N	446.843	1.422	50	20	IDGD	
CSC[C@H](C(=O)NNC(=O)Cn1ccc2ccccc21)N1C(=O)[C@@H]2CCCC[C@H]2C1=O	729448428	QUEIDHVHFMOYOK-JFIYKMOQSA-N	442.541	1.696	50	20	IDGD	
O=C(CN1CCC[C@H](NS(=O)(=O)c2cccc(F)c2)C1)NNC(=O)c1cccs1	729483263	SBKPBBSODIZBNU-AWEZNQCLSA-N	440.522	1.091	50	20	IDGD	
CC(=O)N1Cc2ccccc2C[C@@H]1C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	730076960	FJXCAHOVHKMKPK-HXUWFJFHSA-N	428.514	1.544	50	20	IDGD	
Cc1ccc(-c2noc(CN3CCN([C@H](C)C(=O)NNC(=O)CC(C)C)CC3)n2)cc1	731848636	JPKAEAYSSBXDJP-QGZVFWFLSA-N	428.537	1.745	50	20	IDGD	
COc1ccc(N(C)S(=O)(=O)c2cccc(C(=O)NNC(=O)c3c[nH]nc3C)c2)cc1	731852865	JVUYPWQLCDECSI-UHFFFAOYSA-N	443.485	1.627	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2ccc3c(c2)OCCO3)cc1Br	732048746	ROAPRQICRWVTSC-UHFFFAOYSA-N	443.275	1.852	50	20	IDGD	
COc1cc(I)c(C(=O)NNC(=O)c2c[nH]nc2C)cc1OC	732084483	KJSUTZXPJRRCJS-UHFFFAOYSA-N	430.202	1.415	50	20	IDGD	
O=C(COC(=O)c1cccc(Br)c1O)NNC(=O)c1cccc([N+](=O)[O-])c1	732341842	OHKYKIJEMRWMQC-UHFFFAOYSA-N	438.190	1.681	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)N[C@@H]1CCCN(c2cc(N3CCOCC3)ncn2)C1	732914218	IZKCGETVVNYNDU-QGZVFWFLSA-N	439.520	1.235	50	20	IDGD	
COCCOCC(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccc(C)cc2C)c1	733123201	AERHVUHWSHCQQN-UHFFFAOYSA-N	435.502	1.528	50	20	IDGD	
Cc1ccc(-n2c(NNC(=O)CCN3C(=O)CCC3=O)nc3ccccc3c2=O)c(C)c1	733264636	BWFARVIMKSLJTH-UHFFFAOYSA-N	433.468	1.985	50	20	IDGD	
CCOCCCn1c(NNC(=O)Cn2c(C)c(C)sc2=O)nc2ccccc2c1=O	733268271	JLTBNFPZJZLGJE-UHFFFAOYSA-N	431.518	1.806	50	20	IDGD	
O=C(NC[C@@H](c1cccs1)N1CCOCC1)NNC(=O)c1cnn(-c2ccccc2)c1	733350359	VNANRDSQOIGRFE-SFHVURJKSA-N	440.529	1.951	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)c1cc(F)ccc1N1CCOCC1	734241561	IJRJTZRMAIBIJH-UHFFFAOYSA-N	425.461	1.131	50	20	IDGD	
COc1cc(Br)ccc1C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C	734241845	WLYWYDNWDLUGHT-UHFFFAOYSA-N	431.287	1.926	50	20	IDGD	
COc1ccc(CN2CC[C@H](NC(=O)NNC(=O)[C@@H](C)Oc3ccc(F)cc3)C2=O)cc1	734682490	AZENGMNGRORFLS-KUHUBIRLSA-N	444.463	1.733	50	20	IDGD	
Cc1cccc(-n2c(NNC(=O)c3cn(C)c(=O)n(C)c3=O)nc3ccccc3c2=O)c1C	735053214	BBPVXYXGSMWZAI-UHFFFAOYSA-N	446.467	1.157	50	20	IDGD	
Cc1c(C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)oc2c(F)cccc12	735118331	SEZNZGAPVUEDLY-UHFFFAOYSA-N	447.492	1.968	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)NC[C@H](c1cccc(F)c1)N1CCOCC1	738458553	AWFFSCZODBFKJI-HXUWFJFHSA-N	430.480	1.746	50	20	IDGD	
Cc1c(C(=O)NNc2ccnc(N(C)C)n2)nnn1C1CCN(C(=O)OC(C)(C)C)CC1	740112026	BSVBXRVPGFWZHM-UHFFFAOYSA-N	445.528	1.771	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCc2ccco2)cc1C(=O)NNc1ncnc2[nH]cnc12	740746510	KGYXJCNQXJWFQP-UHFFFAOYSA-N	427.446	1.490	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)CCC(=O)c1cc(Br)ccc1OC	740851714	RZLVAVVPKUAACZ-UHFFFAOYSA-N	442.310	1.873	50	20	IDGD	
O=C(CSc1nnc(-c2ccc(F)cc2)n1CCN1CCOCC1)NNC(=O)C1CC1	742451233	OCQJDLJMPRRVHL-UHFFFAOYSA-N	448.524	1.066	50	20	IDGD	
Cc1cc(N2CCCS2(=O)=O)ccc1C(=O)NNC(=O)c1cc(-c2ccccc2)[nH]n1	743288934	KVBSLVJPLIVNRX-UHFFFAOYSA-N	439.497	2.000	50	20	IDGD	
COc1ccc(CN2CC[C@@H](NC(=O)NNC(=O)Nc3ccc(N(C)C)cc3)C2=O)cc1	743616668	MFUNHJICVUGCBU-LJQANCHMSA-N	440.504	1.898	50	20	IDGD	
CC(C)c1nnc(CCC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)o1	746822158	NLWUNNCSCUNQJT-UHFFFAOYSA-N	435.506	1.371	50	20	IDGD	
CC(C)C[C@H](C(=O)NNC(=O)CCOc1ccccc1)N1C(=O)[C@@H]2CC=CC[C@H]2C1=O	747182538	JMHPOPCIDWHQGO-GUDVDZBRSA-N	427.501	1.969	50	20	IDGD	
COc1ccc2c(c1)C(=NNC(=O)c1cccc(S(=O)(=O)N3CCOCC3)c1)CC2	747624517	NOYQZGNKDZFILO-UHFFFAOYSA-N	429.498	1.796	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)NCc2cc(C)no2)cc1	747712537	JJPLZTXZMFEMCH-MHWRWJLKSA-N	434.456	1.954	50	20	IDGD	
COc1ccc(C)cc1[C@]1(C)NC(=O)N(CC(=O)NNc2cccc([N+](=O)[O-])c2)C1=O	748008686	RWFYELZIMWMLQV-FQEVSTJZSA-N	427.417	1.822	50	20	IDGD	
NS(=O)(=O)c1ccc(CC(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)cc1	748519219	WSCYTAADSNVNOV-UHFFFAOYSA-N	437.421	1.313	50	20	IDGD	
NC(=O)c1ccc(/C=C/C(=O)N2CCC[C@H]2C(=O)NNC(=O)CCc2ccccc2)cc1	749800081	JIDXUMIRHWROJM-RNTFSAEZSA-N	434.496	1.570	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)Cn1c(S)nnc1-c1ccc(C)cc1	751202117	ITAHCEWCDXUJEH-UHFFFAOYSA-N	427.486	1.777	50	20	IDGD	
O=C(NNS(=O)(=O)c1scc(Br)c1Br)N1CCOCC1	751213501	XXAONAUKUAVKAQ-UHFFFAOYSA-N	449.146	1.508	50	20	IDGD	
CC[C@@H](CS(=O)(=O)c1ccccc1)NC(=O)NNC(=O)c1c(C)nc2ccccn12	752127245	NFKQQCUMKAZTLL-HNNXBMFYSA-N	429.502	1.839	50	20	IDGD	
Cc1noc(C)c1[C@H](C)CNC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	752700290	SZUCXIKVDXPQNN-CYBMUJFWSA-N	449.533	1.824	50	20	IDGD	
CC[C@@H](NC(=O)NNC(=O)COc1ccccc1-c1ccccc1)C(=O)N1CCOCC1	753057064	KVAGHINZLQRXTP-LJQANCHMSA-N	440.500	1.700	50	20	IDGD	
Nc1nc(Cl)cc(NNC(=O)c2cc(I)cc([N+](=O)[O-])c2)n1	753463162	AYJSSJRVPGUQQV-UHFFFAOYSA-N	434.581	1.982	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)NCCC(=O)NNc2ccc(C(F)(F)F)nn2)cc1	755293988	PLHJWJXUVNJYGN-UHFFFAOYSA-N	446.411	1.266	50	20	IDGD	
CCCNC(=O)c1cccc(NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1	755794843	DVIZXBHEXZUZSA-UHFFFAOYSA-N	425.493	1.686	50	20	IDGD	
CC(C)(C)S(=O)(=O)N1CCC(NC(=O)NNC(=O)Cc2c[nH]c3ccccc23)CC1	755901077	UAROTRKOTJPIBJ-UHFFFAOYSA-N	435.550	1.634	50	20	IDGD	
COCCS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2cc(Cl)ccc2O)cc1	756552077	LPENXTHGVUFLJX-UHFFFAOYSA-N	427.866	1.932	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)Nc1ccn(CCN(C)C)n1	756766774	YVSSOVNKDVFUQE-LBPRGKRZSA-N	439.314	1.827	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Cc2ccn(-c3ccccc3)n2)cc1	756900369	ZOVIPMYZQONTHS-UHFFFAOYSA-N	441.513	1.191	50	20	IDGD	
COc1cc([N+](=O)[O-])ccc1C(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	757600366	ZFUKJKYSZMXXNC-UHFFFAOYSA-N	437.453	1.853	50	20	IDGD	
CCOC(=O)Cc1nnc(NC(=O)NNC(=O)[C@@H](C)Oc2ccc(C(C)=O)cc2)s1	757755305	TXBMBWBFGJKCCH-LLVKDONJSA-N	435.462	1.467	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1ccc(C(=O)NC2CC2)cc1	757852613	YVTOUWJNSXMIAN-UHFFFAOYSA-N	445.859	1.859	50	20	IDGD	
CN(NC(=O)Cc1ccc2c(c1)OCCO2)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758786250	KQTAPFMCNBCAIZ-UHFFFAOYSA-N	434.493	1.636	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)CC1(C)OCCO1	758856775	AZZYSZSFBOBBBT-SFHVURJKSA-N	433.553	1.318	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCC(C)(C)CCOC)c1	760166815	VXJYBYBPOYQSRO-UHFFFAOYSA-N	428.555	1.724	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)Nc1cccc(N2C(=O)CNC2=O)c1	761223494	RHCFESZEBVLZBW-UHFFFAOYSA-N	429.458	1.696	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)CN[C@H](c2ccccc2)C(F)(F)F)c1	761457778	MJRRICCRRZKSCR-GOSISDBHSA-N	434.374	1.756	50	20	IDGD	
CCc1csc(-n2cc(C(=O)OCC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)cn2)n1	762885638	SAHQMWRCOGGUSY-UHFFFAOYSA-N	444.429	1.417	50	20	IDGD	
Cc1cc(C)nc(SCc2ccc(C(=O)NNC(=O)[C@H]3CN4CCCN3CC4)cc2)n1	763263593	IPRXWTGQGKJEMK-LJQANCHMSA-N	440.573	1.537	50	20	IDGD	
Cc1ccc(Cn2cccc(NC(=O)C(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)c2=O)cc1	763441682	GJZVEIYTJGBXLE-UHFFFAOYSA-N	449.423	1.513	50	20	IDGD	
NC(=O)c1ccccc1N1CC[C@H](NC(=O)NNC(=O)CSc2ccccc2O)C1	763506496	GCJMCYTUTQCBLR-ZDUSSCGKSA-N	429.502	1.193	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1ccccc1-c1nncn1C(C)C	763625840	YOLPLAWEOFWCHU-UHFFFAOYSA-N	446.471	1.882	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc([S@@](C)=O)c(F)c1	763680522	GIUOZZPZDIQNTM-SSEXGKCCSA-N	437.449	1.127	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)cc1NC(C)=O	763728227	KCWXKOJQIOSGCM-UHFFFAOYSA-N	439.472	1.192	50	20	IDGD	
O=C(CSc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1cccnc1N1CCOCC1	763736868	WJUILCDPPQMRRW-UHFFFAOYSA-N	449.920	1.450	50	20	IDGD	
CCN(Cc1ccccc1NC(=O)C(=O)NNC(=O)c1cc(OC)cc(OC)c1)C(C)=O	763775892	XSOQUZPBXGALNX-UHFFFAOYSA-N	442.472	1.472	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)C(=O)Nc1cc(-c2ccccc2)ns1	763921784	WCZZMFYYWVETQV-UHFFFAOYSA-N	434.441	1.186	50	20	IDGD	
CCNC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccc(Cl)cc2)cc1	763939075	DZHWWHDDXXJDOD-UHFFFAOYSA-N	432.864	1.184	50	20	IDGD	
COC(=O)c1[nH]c(C)cc1NC(=O)C(=O)NNC(=O)c1ccc(Br)s1	763940283	GMEXPFATGSEVLS-UHFFFAOYSA-N	429.252	1.333	50	20	IDGD	
COc1ccc(NC(C)=O)cc1NC(=O)C(=O)NNC(=O)c1cc(Br)c[nH]1	763998683	SEDDSPBSHNLSAP-UHFFFAOYSA-N	438.238	1.144	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc(N2CCOCC2)c2ccncc12	764042389	IDTJKGYZFWVAEN-UHFFFAOYSA-N	449.467	1.480	50	20	IDGD	
NC(=O)CCOc1ccccc1NC(=O)C(=O)NNC(=O)c1cccc(Br)c1	764063565	RVIFFKLHLZWHCT-UHFFFAOYSA-N	449.261	1.103	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(CN3C[C@H](C)O[C@@H](C)C3)c2)c(O)c1	764111671	YTTITYCHGMGYSD-HOTGVXAUSA-N	440.500	1.710	50	20	IDGD	
Cc1ccc(Cn2nccc2NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)s1	764164406	PCBXQCKAMGPBPV-INIZCTEOSA-N	425.470	1.391	50	20	IDGD	
Cc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C	764204744	TYBSCBIZWVCWSF-UHFFFAOYSA-N	449.508	1.088	50	20	IDGD	
C=CCN(CC=C)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2scnc2C)cc1	764245657	HXXZYRXUDNMKTK-UHFFFAOYSA-N	427.486	1.665	50	20	IDGD	
COC(=O)c1cc(F)c(F)cc1NC(=O)C(=O)NNC(=O)c1cccc(OC(F)F)c1	764259471	ILZWHKCOWOQMLT-UHFFFAOYSA-N	443.309	1.753	50	20	IDGD	
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC(=O)C(=O)NNC(=O)Cc2ccccn2)cc1	764267137	PHICFFNAOYKJAT-AWEZNQCLSA-N	441.488	1.996	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)C(=O)Nc1ccc(NC(=O)NCc2ccco2)cc1	764269086	UMNAEIAJXUASOG-UHFFFAOYSA-N	436.428	1.325	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc3ccccc3o2)cc1S(=O)(=O)N(C)C	764331192	PYAVHBAGTODECK-UHFFFAOYSA-N	444.469	1.391	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)C(=O)Nc1ccc(C(=O)NCC(C)C)c(Cl)c1	764388859	KHARHZKTXUGPOD-UHFFFAOYSA-N	431.880	1.829	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)Nc1cnn(-c2ncccc2C#N)c1	764739684	VBWQUZITRCMQMV-UHFFFAOYSA-N	428.453	1.597	50	20	IDGD	
COc1ccc(C)nc1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	765291475	NSZLBBZEOYBDGH-UHFFFAOYSA-N	433.490	1.650	50	20	IDGD	
Cc1nn(C)c(C)c1OCC(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	765759337	UDBRNCBSIGCTJC-UHFFFAOYSA-N	448.955	1.034	50	20	IDGD	
CCc1ccc(C(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)cc1S(C)(=O)=O	766163972	RKYPOXUJMZIFIZ-UHFFFAOYSA-N	438.889	1.924	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)c2cc(Br)c(C)n(C)c2=O)cn1	768208801	XULKLVNMCUCIRI-UHFFFAOYSA-N	426.296	1.491	50	20	IDGD	
CC[C@H](C)NC(=O)CN1CCN(C(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)CC1	770650426	VIWIYWONHZABBN-GJZGRUSLSA-N	439.944	1.380	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)[C@@H]3CN(Cc4ccccc4)CCO3)nc21	770957718	DQCMMYNDUOFABO-INIZCTEOSA-N	425.493	1.631	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)c3ccc(C[C@@H]4CC(=O)NC4=O)cc3)nc21	770966667	NLEVMXRSXVPOEP-CYBMUJFWSA-N	437.460	1.249	50	20	IDGD	
Cc1cc(C(=O)N2CCC[C@H]2C(=O)NNc2nc(O)c3cnn(C)c3n2)ccc1[N+](=O)[O-]	770979088	CLRYTAYOJGKOLT-AWEZNQCLSA-N	440.420	1.033	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNS(=O)(=O)c1ccc2oc(=O)ccc2c1	771608120	SAILUBCHNJAFAJ-UHFFFAOYSA-N	435.845	1.072	50	20	IDGD	
Cc1nc(S(=O)(=O)NCCC(=O)NNc2ccc(Br)c(F)c2)cn1C	771691463	VJKZWXJQUKFPFW-UHFFFAOYSA-N	434.291	1.442	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)c1cc(I)ccc1O	771868063	NNRRLKCPWDHMKS-VIFPVBQESA-N	434.230	1.736	50	20	IDGD	
COc1cccc(-c2nc(C)c(C(=O)OCC(=O)NNC(=O)c3cccc(C#N)c3)[nH]2)c1	772103936	CBJGUARAXPLDGK-UHFFFAOYSA-N	433.424	1.883	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NNC(=O)c2cn(Cc3ccccc3)nn2)C1	773412530	WJRGUWDBHSIYFD-MRXNPFEDSA-N	428.493	1.735	50	20	IDGD	
COc1cccc(C)c1NC(=O)C(=O)NNC(=O)c1sc(N2CCOCC2)nc1C	773625461	BWTRDZDNWXDTLH-UHFFFAOYSA-N	433.490	1.005	50	20	IDGD	
COC(=O)c1c(F)cccc1NNC(=O)CN1C(=O)N[C@@]2(CCc3ccccc32)C1=O	773637166	AYMIEGXIRYUXKW-OAQYLSRUSA-N	426.404	1.449	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccccc1CCN(C)C	774010018	UJIQYWMCFMOCNG-AWEZNQCLSA-N	432.908	1.998	50	20	IDGD	
CN(C)C(=O)[C@H]1CC[C@@H](CNC(=O)NNC(=O)COc2ccccc2-c2ccccc2)O1	775455891	XTZDQXMYWJOAAK-FXAWDEMLSA-N	440.500	1.699	50	20	IDGD	
Cn1cc(S(=O)(=O)NNC(=O)c2cc3ccccc3o2)cc1C(=O)NCC(F)(F)F	775675834	KIABANBHIMONOW-UHFFFAOYSA-N	444.391	1.687	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)Nc1ccnn1[C@H]1CCS(=O)(=O)C1	776054582	GWSFOAIUAHMOLS-RYUDHWBXSA-N	425.442	1.002	50	20	IDGD	
Cc1cc(C)c2[nH]cc(C(=O)NNC(=O)c3sc(N4CCOCC4)nc3C)c(=O)c2c1	776102928	RZWLSWOIBRJPNP-UHFFFAOYSA-N	441.513	1.821	50	20	IDGD	
CCC(=O)N1CCC[C@@H](C(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)C1	776200926	CWBHNIMIHAYHEP-OAHLLOKOSA-N	425.530	1.271	50	20	IDGD	
O=C(NCC1CC1)NNS(=O)(=O)c1cc(Br)c(Cl)c(C(=O)O)c1	777617363	TYWSSKXFOCOUEC-UHFFFAOYSA-N	426.676	1.703	50	20	IDGD	
CC(C)CS(=O)(=O)N1CCC(NC(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)CC1	777769771	ZCHYZNPHLJOTFI-CQSZACIVSA-N	444.529	1.374	50	20	IDGD	
O=C(c1cnc(-c2ncccn2)s1)N1CCN(S(=O)(=O)CBr)CC1	777832616	OWCPSFFGWFTAQO-UHFFFAOYSA-N	432.325	1.040	50	20	IDGD	
CC(C)(C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)c1cccnc1	778221097	PIRQUYDENIEHTH-UHFFFAOYSA-N	430.530	1.995	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N[C@@H](C)c2ncon2)cc1	778408981	HOQKVFOQPAPHAB-NCPSJORJSA-N	435.444	1.601	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)c1cc(S(=O)(=O)N(C)C)cn1C	778531900	MAFSOPFRKLGYKA-CQSZACIVSA-N	444.513	1.657	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)NCc2cccc(CN3CCC[C@H](C(N)=O)C3)c2)c1	780827101	GHLPSQPUCYUKKD-IBGZPJMESA-N	439.516	1.997	50	20	IDGD	
COc1ccc(NNC(=O)Nc2ccc(Cl)c(S(=O)(=O)N3CCOCC3)c2)nc1	782006163	BYYWASNLKRNPIO-UHFFFAOYSA-N	441.897	1.913	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)CCC(=O)N2CC(F)(F)F	782125218	XVCPYPWLSBWCIP-UHFFFAOYSA-N	449.389	1.631	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2ccnn2Cc2ccc(OC)cc2OC)nc1	782145828	ZCGGGEHGWPADNC-UHFFFAOYSA-N	426.433	1.434	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c(C)c1F	782910644	NFZMHSHHULDJNF-UHFFFAOYSA-N	445.494	1.016	50	20	IDGD	
O=C(NNc1ccc(F)cc1F)C(=O)Nc1ccc(F)c(N2CCCS2(=O)=O)c1	783340815	WZDMWTPKUBHYCO-UHFFFAOYSA-N	428.392	1.726	50	20	IDGD	
COC(=O)[C@H](Cc1ccc(F)cc1)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1	783575226	VQTCBYDHUDQDAZ-SFHVURJKSA-N	437.493	1.160	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2cccc([N+](=O)[O-])c2C)cc1S(=O)(=O)N(C)C	784358787	ZMGHHLOSCMVRJJ-UHFFFAOYSA-N	435.462	1.544	50	20	IDGD	
C[C@H](C(=O)Nc1ccc(NC(=O)C(=O)NNc2ccc(F)c(F)c2F)cc1)n1cncn1	784807151	QLNOKNQSNZLTHL-SNVBAGLBSA-N	447.377	1.977	50	20	IDGD	
O=C(NNc1ccc(Br)nc1)C(=O)Nc1cccc(C(=O)N2CCOCC2)c1	784807210	WPDGGRZCGIIBSN-UHFFFAOYSA-N	448.277	1.398	50	20	IDGD	
Cn1cc(NC(=O)C(=O)NNc2ccnc(Br)c2)cc(Br)c1=O	784837390	QCNVMJYOBYXABX-UHFFFAOYSA-N	445.071	1.387	50	20	IDGD	
CCN1CCN(c2ccc(NC(=O)C(=O)NNc3ccc(C(F)(F)F)nn3)cc2)CC1	784886322	OHKIHDZJPREJBH-UHFFFAOYSA-N	437.426	1.719	50	20	IDGD	
O=C(NNc1cc(F)c(F)cc1F)C(=O)Nc1cccc(N2CCCS2(=O)=O)c1	784886671	RPGPGEISKCDSKW-UHFFFAOYSA-N	428.392	1.726	50	20	IDGD	
Cc1cc(C(N)=O)ccc1NC(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	785836836	IORAOKZPGMWDJF-UHFFFAOYSA-N	434.497	1.735	50	20	IDGD	
CN(C)C(=O)c1cc(NC(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)ccn1	785848152	DNACPILTTQEJLB-UHFFFAOYSA-N	449.512	1.424	50	20	IDGD	
C[C@@H](OC(=O)/C(C#N)=C\C1CC1)C(=O)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1	786680074	GNBPOICCTDHYCH-IZCBMXNHSA-N	433.486	1.438	50	20	IDGD	
CCc1c(C(=O)NNC(=O)CCNC(=O)OC(C)(C)C)nnn1Cc1ccc(F)cc1	787912635	HPFCDMKFTRRRTI-UHFFFAOYSA-N	434.472	1.704	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)c(C)cc1C	788331508	RZEKDJIVLXGPDF-UHFFFAOYSA-N	435.440	1.880	50	20	IDGD	
O=C(COc1ccccc1CNC(=O)NNc1nc2ccccn2n1)NC[C@H]1CCCO1	790215569	KTEYFVNUOFNOIN-MRXNPFEDSA-N	439.476	1.230	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N2CC[C@H](N3CCCC3=O)C2)cc1Br	791024532	XXXOAZLBQOEAMO-LBPRGKRZSA-N	425.283	1.509	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@@H]2CC(c3cccc(OC)c3)=NO2)c2ccccc2c1=O	792016939	CZRRJMIHMLFLCL-SFHVURJKSA-N	435.440	1.379	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCN(C)[C@@H](Cc3ccccc3)C2)cc1OC	792938220	BWZLZCWVXBZTBD-IBGZPJMESA-N	426.517	1.324	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNS(=O)(=O)c1ccc(S(C)(=O)=O)nc1	794577142	REWUWQRRVGRXHK-ZDUSSCGKSA-N	449.510	1.415	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@H](c2cnn(C)c2)N(C)C(=O)OC(C)(C)C)cc1OC	794756746	CFEKROKCSPEREA-KRWDZBQOSA-N	447.492	1.807	50	20	IDGD	
COc1ccc(F)c2[nH]c(C(=O)OCC(=O)NNC(=O)[C@@H]3COc4ccccc4O3)cc12	796201870	VNILGYGVGMHLDN-KRWDZBQOSA-N	443.387	1.460	50	20	IDGD	
CC[C@@H](C)NS(=O)(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)c2cccc(C)n2)c1	797370252	IXQWKZHHBCHGNX-CYBMUJFWSA-N	447.517	1.008	50	20	IDGD	
CS(=O)(=O)Nc1ccc(NC(=O)NNC(=O)CNC(=O)OCc2ccccc2)cc1	797629571	JDSXVICTMFGKCB-UHFFFAOYSA-N	435.462	1.137	50	20	IDGD	
COc1ccc(OC)c(C2=NO[C@@H](C(=O)NNC(=O)C(=O)Nc3ccc(C)c(C)c3)C2)c1	798310640	SYKBOVVZLIAYOJ-LJQANCHMSA-N	440.456	1.600	50	20	IDGD	
O=C(NNS(=O)(=O)c1cccc(Br)c1F)[C@@H]1COc2ccccc2O1	799120512	OQVOJUFKVKPCLN-LBPRGKRZSA-N	431.239	1.738	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2ccc(C(=O)NNC(=O)CNc3ccccc3)cc2)C[C@H](C)O1	799380847	MUPVZQNYJHIVAK-HOTGVXAUSA-N	446.529	1.358	50	20	IDGD	
N#Cc1cc(NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)ccc1OC(F)(F)F	799834395	CXQXBWUXGLDLKY-OAHLLOKOSA-N	434.330	1.546	50	20	IDGD	
CC(C)(C)[C@@H](NC(N)=O)C(=O)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1	800328108	HFZRFYBUFYSBQF-PMACEKPBSA-N	437.544	1.844	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)C(=O)Nc1ccnc(OCc2ccccc2)c1	800632170	RIAIFZTXEUKVMO-UHFFFAOYSA-N	444.451	1.637	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2ccc3c(c2)S(=O)(=O)N(C(C)C)C3=O)cc1	802056851	DCSBGKSOFOGHKA-UHFFFAOYSA-N	432.458	1.715	50	20	IDGD	
Cc1cc(=O)c(C(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)nn1-c1ccccc1	802064279	LCEWHEADJMNLQV-UHFFFAOYSA-N	441.469	1.411	50	20	IDGD	
CC(=O)CCc1ccc(OCC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)cc1	802067822	NLCQUEUUWNQIAL-UHFFFAOYSA-N	433.486	1.843	50	20	IDGD	
O=C(CC[C@H]1NC(=O)N(c2ccc(Cl)cc2)C1=O)NNc1ccc(-n2ccnc2)nn1	804955799	XXPKQPVQAXELLN-CQSZACIVSA-N	440.851	1.664	50	20	IDGD	
Cc1cc([N+](=O)[O-])ccc1NNC(=O)CCC(=O)Nc1ccc2c(n1)n(C)c(=O)n2C	805378997	ZVFVEAVEFVTYOO-UHFFFAOYSA-N	427.421	1.351	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)Nc1cc2ccccn2n1	806651502	HLQOIZUDPFTYIK-UHFFFAOYSA-N	428.474	1.585	50	20	IDGD	
Cc1c(C(F)(F)F)nn(C)c1NC(=O)C(=O)NNC(=O)[C@H]1OCC[C@H]1c1ccccc1	807068969	XNYOOSHFCBTSHR-STQMWFEESA-N	439.394	1.406	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)N[C@H]1CCCN(C(=O)N2CCCC2)C1	807458495	BQRKMQUKTJIAOV-INIZCTEOSA-N	433.509	1.475	50	20	IDGD	
COC(=O)Cc1occ(C)c1C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	809984026	ZFIXJYSLNSRVMA-UHFFFAOYSA-N	449.485	1.163	50	20	IDGD	
C[C@]1(NNC(=O)NCc2cccc(-c3nc(CC(F)(F)F)no3)c2)CCS(=O)(=O)C1	812478853	BGXRSRKDAHGPNS-INIZCTEOSA-N	447.439	1.722	50	20	IDGD	
COC[C@@]1(C(=O)NNC(=O)Nc2ccc3c(c2)OCO3)CCN(C(=O)OC(C)(C)C)C1	813575056	MPIKVKRDEZGMSD-HXUWFJFHSA-N	436.465	1.842	50	20	IDGD	
CCc1c(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)N(C)C)cnn1CC(C)C	815751507	CCDDWSWQWFIMHW-UHFFFAOYSA-N	436.538	1.434	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)[C@@H](O)[C@H](O)c1nc2ccccc2s1	817054078	RWHFWERRWNAGTC-HOTGVXAUSA-N	436.515	1.084	50	20	IDGD	
CCS(=O)(=O)N[C@@H](CCSC)C(=O)NNC(=O)[C@H](C)Oc1cccc(C)c1C	818857717	HEKBCPIAPGRXFE-GJZGRUSLSA-N	431.580	1.279	50	20	IDGD	
COc1ccc(/C=C\C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1OC	873803976	BGEMSLHWIOXLLM-LUAWRHEFSA-N	433.486	1.429	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc2c(c1)nc(CCC(=O)NNc1ncccn1)n2CC	913044060	RRXLYUBDPUYBLG-UHFFFAOYSA-N	445.549	1.953	50	20	IDGD	
O=C(COC(=O)COc1ccc(F)c(Cl)c1)NNC(=O)[C@H]1COc2ccccc2O1	913391915	OSLMHCHCZQOYEY-MRXNPFEDSA-N	438.795	1.389	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)CN1c2cccc3cccc(c23)S1(=O)=O	914440131	VZOYSFDKYWOUID-UHFFFAOYSA-N	435.465	1.386	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2ccn(-c3ccc(F)cc3)n2)cc1OC	915411801	UYNHYGOFIJLEOI-UHFFFAOYSA-N	442.403	1.647	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)C[C@H]2CCCO2)c1	915636543	OSNPQGBDIYBEKS-OAHLLOKOSA-N	433.486	1.826	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCCNc2ccccn2)c1	916576573	QSDMMGKODWEWIQ-UHFFFAOYSA-N	448.549	1.558	50	20	IDGD	
O=C(NC[C@@]1(N2CCOCC2)CCSC1)NNC(=O)c1ccc(Br)s1	916636848	MXXWMITUEZYZOV-HNNXBMFYSA-N	449.396	1.663	50	20	IDGD	
O=C(CNC(=O)c1ccc(Br)s1)NNC(=O)c1ccc2c(c1)OCCO2	916737565	DEKJOHWMULCYLD-UHFFFAOYSA-N	440.275	1.473	50	20	IDGD	
O=C(CCCS(=O)(=O)N1CCCC1)NNC(=O)c1ccc(COc2ccccc2)o1	917393224	DTIIOMQBBBXAOI-UHFFFAOYSA-N	435.502	1.825	50	20	IDGD	
CC(C)C(=O)N1CCCC[C@H]1C(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12	917531003	NTUGNNNUQRLDIM-KRWDZBQOSA-N	427.505	1.776	50	20	IDGD	
CN(CC(=O)NNC(=O)COc1ccccc1-c1ccccc1)c1ncnc2[nH]cnc12	917907100	PASVHFXMWAMGAT-UHFFFAOYSA-N	431.456	1.683	50	20	IDGD	
CCN(CC)CC(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2OC)c1	920297798	PJUJADKEEHIQDG-UHFFFAOYSA-N	434.518	1.599	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2cccc(C(=O)N(C)C)c2)cc1	920931468	UKPOEDVQEWLJTA-UHFFFAOYSA-N	447.517	1.170	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1OC	1115884322	REUBHBIPGIVXRV-MRXNPFEDSA-N	426.473	1.480	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)c2ccnc(O[C@@H]3CCOC3)c2)CC1	1320381595	DWXVGTZNPLFHGW-MRXNPFEDSA-N	434.493	1.657	50	20	IDGD	
CC(C)n1ncc2c1[C@@H](NC(=O)NNC(=O)C1CCN(c3ncccn3)CC1)CCC2	1320388763	WRTCLOMHHQWCHW-KRWDZBQOSA-N	426.525	1.878	50	20	IDGD	
CCOC(=O)c1ncc(C(=O)NNC(=O)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)s1	1324276390	YCJBZYKMKDRQPS-LLVKDONJSA-N	426.495	1.728	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc2c1CCC2	1328899972	QLYBYXKEGXJKAB-UHFFFAOYSA-N	425.470	1.083	50	20	IDGD	
O=C(NNC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1)C1CCN(c2ncccn2)CC1	1331907958	SZLIQEDZYNNHPX-UHFFFAOYSA-N	425.449	1.400	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)[C@H]2CCN2C(=O)OC(C)(C)C)CC1	1338555765	SBJTTYYLQWNPBK-CQSZACIVSA-N	426.514	1.790	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)c1n[nH]cc1I	1339250263	IZTZCTQIDJWZMM-ZETCQYMHSA-N	434.621	1.896	50	20	IDGD	
CC(C)CNC(=O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)Br)C2	1778117205	WXHNXUJFSUWYRP-PMUMKWKESA-N	432.359	1.056	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1CC[C@@H]3CCC(=O)N3C1)CCO2	1779300728	WGZGELGNVYUZAC-LZJOCLMNSA-N	437.613	1.069	50	20	IDGD	
Cc1ccoc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1	1779373109	BAUQKPIDCKMOMF-VGOFRKELSA-N	441.488	1.028	50	20	IDGD	
Cn1ccc(=O)cc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Br)C2	1780058922	KMIBEOJWYLTGGF-IIDMSEBBSA-N	444.301	1.203	50	20	IDGD	
CC(C)(C)n1cc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)nn1	1780354613	UMMYBQXMTZCAOG-LRDDRELGSA-N	432.294	1.167	50	20	IDGD	
CN1CCC(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](F)Br)C2)CC1	1780770477	PHOXSZCDCWLWFS-IIDMSEBBSA-N	434.350	1.533	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CN1CCCC1)C2	1781898036	ZRXQGDJSKSUAFU-GPMSIDNRSA-N	430.387	1.770	50	20	IDGD	
Cc1nnc(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](C)Br)C2)s1	1781998511	ZZBOZNXNJZTTAM-XTQGRXLLSA-N	445.383	1.686	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C2CCC(O)CC2)C1	1782332644	NCQCTGHIUUERLY-IWJNZZSASA-N	431.371	1.835	50	20	IDGD	
C[C@@H](O)C(=O)N1CCO[C@@]2(CCN(C(=O)/C(C#N)=C/c3ccc(Br)cc3)C2)C1	1782870541	SZWZYUKYUHRYIJ-AFVLYDJWSA-N	448.317	1.567	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(Cl)cnc3O)[C@H]2C1	1783402807	JENIJUQVRABSHU-HJPIBITLSA-N	432.304	1.288	50	20	IDGD	
Cc1ccccc1OCC(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](C)Br)C2)C1	1783532401	HPJKERUMIIAFSG-DNVCBOLYSA-N	425.323	1.987	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)C3CCC4(CC3)OCCO4)CCO2)C1	1783537145	QIXSDPINPAGLCU-KBXCAEBGSA-N	445.354	1.533	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C34CC(c5ccccc5)(C3)C4)C[C@@H]21)[C@H](O)CCl	1784096780	MVZLJYYCIQSJRE-UVFKXKFKSA-N	432.948	1.688	50	20	IDGD	
CCOc1cnc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCBr)[C@H]3C2)cn1	1786400838	AXLSEWSRYUSLMJ-YDHLFZDLSA-N	441.326	1.254	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc4nc(C)ccc4o3)[C@H]2C1	1787158662	VSTXERIGMFBFCB-ZTENYAIWSA-N	435.908	1.983	50	20	IDGD	
Cn1cccc1C(=O)C(=O)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1	1788149419	PNDFTQUFJLTSKE-UHFFFAOYSA-N	445.284	1.336	50	20	IDGD	
C[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]2C1)n1ccccc1=O	1789870741	SVYDGFGSYMPGBX-YPTDYUDTSA-N	444.359	1.625	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]3C2)c(O)c1	1789924818	XIRXBXAIQBVNOF-NZBMOFRJSA-N	445.285	1.685	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]2C1)c1ccccn1	1789926815	GGIOCSQAOQAJLI-IICXDKKESA-N	428.302	1.855	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CSc3ncccn3)C[C@@H]21	1791058311	WEEBJJIHLUTASL-RFGFWPKPSA-N	443.367	1.332	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3Cc4ccccc4N3)C[C@@H]21	1791063241	DKCKZQBWKADJHB-FUXXODJASA-N	436.350	1.786	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)COc3ccc(F)cc3)C[C@@H]21	1791251228	APRRPAKVSIMJFC-MGHWNKPDSA-N	428.888	1.438	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3CCC4(CC3)OCCO4)C[C@@H]21	1791257370	BZRXTTSXAALODZ-FJIDUMEYSA-N	444.956	1.153	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(S(C)(=O)=O)c1	1792695063	GRRZFSDGVKAXFT-MVJTYMMSSA-N	442.965	1.701	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CC1CCN(C)CC1)C2	1792866783	IJFONKQKOPXWIE-SCNOPHJPSA-N	430.387	1.339	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(-c3ccccc3)nc1)C2)[C@@H](O)CCl	1792980953	OJOBINQYSWJSIJ-HNJRGHQBSA-N	429.904	1.552	50	20	IDGD	
COC(=O)c1ccccc1CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2	1793093497	SDZHPCSLJWQCQQ-DACLVMHWSA-N	426.872	1.530	50	20	IDGD	
COc1ccc([C@H]2C[C@H]2C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)cc1	1793521733	ZYKICHAMQMWIRD-QGAVKGNSSA-N	448.328	1.431	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1nc(Cl)ccc1F	1794524150	OBRKFROKPSDFKT-ZSBIGDGJSA-N	446.870	1.438	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COc1ccccc1F)C2	1795116542	QWYVTCAMWHDNRN-IVWMJMPLSA-N	429.286	1.579	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)c1cccc2ccncc12	1796189491	USNIHJLIVXWBOK-ACDBMABISA-N	429.285	1.480	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@]1(F)CCCCC1(F)F)C2	1796191468	PIVMRWCUAYQXAN-AXVVYFOYSA-N	438.255	1.536	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C=C/c1cccnc1)C2	1796890746	JTZQKLMSDMWDHP-SGNWOITLSA-N	434.500	1.867	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)c1n[nH]c2cc(Cl)ccc12	1797507669	XQUPMIUUHVTWOG-ANGCBRKESA-N	427.288	1.019	50	20	IDGD	
Cn1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CO[Si](C)(C)C)c(C(F)(F)F)n1	1797956712	APJUXWNZRDKQAP-JJLQDPRZSA-N	448.518	1.494	50	20	IDGD	
O=C1CC(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](Br)Cc2ccccc2)C3)=NN1	1798374875	NAVJBYOLKNNKKM-QKPAOTATSA-N	447.333	1.507	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1snnc1C1CC1)C2)[C@@H](F)Br	1799347808	TUYBLPATENCLRK-BSTOTGJRSA-N	433.303	1.309	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1ccc2c(c1)C(=O)CC2	1799959575	PYSGOSHQNNAYBB-RMHZUWNSSA-N	439.281	1.709	50	20	IDGD	
O=C1Nc2c(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)[C@H](F)Br)cccc2C1=O	1800158249	FSNUGKKHIVJHGE-OFYUCFFLSA-N	438.253	1.764	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1coc([Si](C)(C)C)c1)C2	1800759095	HDWWFGAPBIRKPM-ZIEJDFEHSA-N	443.414	1.811	50	20	IDGD	
C[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(C)(C)CCl)C2	1800861681	FMFYICCLOIBBDS-APIJFGDWSA-N	431.961	1.754	50	20	IDGD	
C[C@@H](NC(=O)c1ccccc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(Cl)Cl	1801021013	DSVJIEUGZFGYCB-REBRKWNGSA-N	428.316	1.198	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccnc3c2OCO3)[C@H]1c1cccnc1)[C@H](O)CCl	1803140804	IHNCYMFLBQCEDX-IMJJTQAJSA-N	432.864	1.125	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cnn3cccnc23)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803143300	ZSFAFJYAZWRHGD-BHYGNILZSA-N	428.880	1.044	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)c2cnco2)[C@H]1c1cccnc1	1803858018	CNRLBZSIERHGOB-CPJWQURSSA-N	449.471	1.523	50	20	IDGD	
CC(C)C1(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)CCC1	1807373725	FFCMUKIZHFMOJG-IRLDBZIGSA-N	449.360	1.907	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc(O)nn2)[C@H]1c1cccnc1)[C@H](F)Br	1808651200	KGYXOMMAMPWUFR-CQDKDKBSSA-N	438.257	1.587	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H](CNC(=O)[C@@H](F)Br)[C@H]1c1cccnc1)n1cnnn1	1808681494	UNTHHFVOXYEJDQ-FMKGYKFTSA-N	440.277	1.026	50	20	IDGD	
O=C(COc1ccccc1)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1	1809976777	OTFQDKFKFZJPIW-UHFFFAOYSA-N	436.317	1.290	50	20	IDGD	
Cn1c(C(=O)N2CC[C@H](CNC(=O)CO[Si](C)(C)C)[C@H]2c2cccnc2)cccc1=O	1810539625	DPALDVADWZTQES-DYESRHJHSA-N	442.592	1.951	50	20	IDGD	
CCc1oncc1C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1813071710	UHRVBEFGTCBCPY-IERDGZPVSA-N	442.520	1.325	50	20	IDGD	
CC(C)NC(=O)OC(C)(C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](O)CCl)n[nH]1	1814872559	LPNBLIONCPQUSA-UONOGXRCSA-N	443.932	1.915	50	20	IDGD	
O=C(C[C@H]1CCCCO1)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1	1815350299	OXJXFQRQAIKPEP-HZPDHXFCSA-N	443.334	1.008	50	20	IDGD	
CN1CCN(C2(C(=O)N[C@H]3CCc4nc(NC(=O)[C@@H](F)Cl)sc4C3)CC2)CC1	1817128656	QCRNWDRHRDOIPG-SMDDNHRTSA-N	429.949	1.370	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](F)Cl)CC2	1817279890	KTBPJNMBVXTBCE-RZUYCRIBSA-N	440.888	1.724	50	20	IDGD	
CCNC(=O)N[C@@H](C)C(=O)N[C@@H]1CCc2nc(NC(=O)CO[Si](C)(C)C)sc2C1	1820166037	YZABROSOYRJBBY-NWDGAFQWSA-N	441.630	1.614	50	20	IDGD	
O=C(N[C@H]1CCc2nc(NC(=O)c3ccccc3F)sc2C1)c1cccc(B(O)O)c1	1821849013	XUVTUKHMFASFMG-AWEZNQCLSA-N	439.277	1.502	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CSc2nc[nH]n2)[nH]n1	1822374524	MQDFKLKVTQGKBR-JQWIXIFHSA-N	427.918	1.566	50	20	IDGD	
CC(C)NC(=O)OC(C)(C)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](O)CCl)CC2	1822574210	FECMDBGTWCIVOV-ZYHUDNBSSA-N	446.957	1.568	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](C)N3CCN(C)CC3)sc2C1	1822693188	PFGPQKANRKAVEF-MCIONIFRSA-N	428.002	1.708	50	20	IDGD	
COc1cc(C(=O)N[C@@H]2CCc3nc(NC(=O)[C@@H](F)Br)sc3C2)nn1C	1823007053	KMRSHYSHAMEONO-JMCQJSRRSA-N	446.302	1.802	50	20	IDGD	
O=C(Cc1ccc2ncnn2c1)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)CC1	1824184425	MTPAKRSFDBKUSX-ROUUACIJSA-N	433.940	1.491	50	20	IDGD	
CC(C)(C)OCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1	1824893684	NLLPTLMKXPZBHA-HXUWFJFHSA-N	430.354	1.415	50	20	IDGD	
O=C(C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1)c1ccco1	1825057333	IZGAOBBOVFKAEC-LJQANCHMSA-N	438.289	1.076	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H]1CNC(=O)C1)CC2	1825451790	RFQWZFCEFDLXMU-AEJSXWLSSA-N	429.340	1.365	50	20	IDGD	
Cc1nscc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1	1825657177	GLBNBBIJBQNDCC-FQEVSTJZSA-N	441.362	1.678	50	20	IDGD	
Cc1ncsc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1	1825990793	WHHCVDRWCMNFBD-IBGZPJMESA-N	441.362	1.678	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)Cc1c(C)n[nH]c1C)CC2	1826007184	TUJDEURKBVFGKB-WCQYABFASA-N	425.942	1.892	50	20	IDGD	
Cc1nccn1[C@@H](C)C(=O)N[C@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1	1826091801	DFRZBGAYEGOHAV-JSGCOSHPSA-N	447.565	1.194	50	20	IDGD	
N#Cc1c[nH]c(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)c1	1827056267	CMMZKRPLGOTTEH-OAQYLSRUSA-N	434.305	1.113	50	20	IDGD	
O=C1COc2ccc(C(=O)N3CCCC[C@H]3C3CCN(C(=O)[C@@H](O)CCl)CC3)cc2N1	1828624271	BEPGGPZNPRSNQJ-ROUUACIJSA-N	449.935	1.851	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3c[nH]c4cnccc34)C2)C1	1830361837	FWBPSZPXPZWWDV-NRFANRHFSA-N	434.924	1.898	50	20	IDGD	
COc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)ccn1	1830364361	HHCRPBVTQOBOPC-HXUWFJFHSA-N	425.913	1.425	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccccn3)C2)C1	1830538431	FTBPOOKVKOJVIK-BEFAXECRSA-N	440.338	1.112	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C13CC(F)(C1)C3)CCO2	1831592805	JSVAACAHTREFBA-HELAGCTPSA-N	433.318	1.509	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)Cn3cccn3)C2)C1	1831644461	YBODUHWXGYKIQG-FUHIMQAGSA-N	426.945	1.383	50	20	IDGD	
C[C@@H](C(=O)NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1)n1ccnc1	1833378116	DQGRIGHQWCLWDI-XJKSGUPXSA-N	444.349	1.706	50	20	IDGD	
Cc1ncc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)cn1	1833814634	DBIZKOMBYGMWQV-ROUUACIJSA-N	431.320	1.091	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccs3)CCO2)C1	1833940497	NYNAORVGCULSSS-CXAGYDPISA-N	431.352	1.992	50	20	IDGD	
Cc1ccc2oc(C(=O)NC3CCN(C4CCN(C(=O)[C@H](O)CCl)CC4)CC3)cc2n1	1834914101	IWGDFDJXLIDGKF-GOSISDBHSA-N	448.951	1.921	50	20	IDGD	
O=C(CCCCn1cccc1)NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1835799058	XPZVYRVBPBGXBU-FQEVSTJZSA-N	439.000	1.830	50	20	IDGD	
CC[C@H](C)[C@@H](O)C(=O)N1CCC(N2CCC(NC(=O)CO[Si](C)(C)C)CC2)CC1	1835834781	KGXINDTUMPNCFK-OXJNMPFZSA-N	427.662	1.817	50	20	IDGD	
O=C(c1csc2c1CCCC2)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1	1836896340	ZXUNXHNQERUGSS-JXFKEZNVSA-N	442.965	1.297	50	20	IDGD	
CC(=O)NCC(C)(C)C(=O)N1CCC(OC2CCN(C(=O)C(Cl)Cl)CC2)CC1	1836932690	UXQWFVBTKFGOBP-UHFFFAOYSA-N	436.380	1.951	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cc(C(=O)O)ncn3)CC2)CC1	1837289955	FPFOWBSJWVGLNT-HNNXBMFYSA-N	438.912	1.804	50	20	IDGD	
CC(C)(C(=O)N1CCOC[C@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1)c1ccccn1	1837717621	JJSRXLRUZCOGJN-QFIPXVFZSA-N	449.624	1.667	50	20	IDGD	
C[C@H](C(=O)N1CCOC[C@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1)c1ccccn1	1837717956	SQFPMMXNTKHDEC-UWJYYQICSA-N	435.597	1.493	50	20	IDGD	
CCc1cnc(C(=O)N2CCO[C@]3(COCCN(C(=O)CCBr)C3)C2)s1	1837720077	CBOLWEAYQRRUMH-KRWDZBQOSA-N	446.367	1.561	50	20	IDGD	
C[C@@H](C(=O)N1CCC(OC2CCN(C(=O)[C@H](F)Br)CC2)CC1)n1cncn1	1838647949	ARCYJTRHKWQEJX-WFASDCNBSA-N	446.321	1.528	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCN3CCCC3)C2)C1	1839156133	CJDHHGRXBVUALY-RBUKOAKNSA-N	436.380	1.165	50	20	IDGD	
Cc1nc(C)c(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)o1	1839200574	MMLVYZPSFXPYMJ-XJKSGUPXSA-N	434.262	1.052	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)c(O)c1	1839203446	LMEDHIBYRREROM-YJBOKZPZSA-N	445.285	1.461	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(O)c(F)c1)CCO2	1839304776	ZWXUWOUIUHFVTO-FQEVSTJZSA-N	440.544	1.453	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3ccc(C)nc3)C2)C1	1840149935	CDINNEUEUKLCNP-GHTZIAJQSA-N	439.940	1.033	50	20	IDGD	
Cc1ccc(C(=O)C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)cc1	1840190877	SFXXDNSJCJUJQH-IBGZPJMESA-N	429.300	1.438	50	20	IDGD	
C[C@@H](Oc1ccccn1)C(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1840422814	LDMGOKRNUZLQEZ-IIBYNOLFSA-N	439.940	1.570	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CCCC[C@@H]1C(=O)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1	1841354835	ZKHITEGUYAKHKU-ARFHVFGLSA-N	443.972	1.873	50	20	IDGD	
COc1ccc(CC(=O)N2CCCC23CN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C3)cc1	1842720088	YOXITINORLCCEJ-PCLIKHOPSA-N	437.500	1.575	50	20	IDGD	
O=C(Cc1ccccc1C(F)(F)F)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843013294	DBOLCYQSWDVEFU-UHFFFAOYSA-N	446.234	1.445	50	20	IDGD	
O=C(COCCOCCOCc1ccccc1)N1CC2(CCCN2C(=O)[C@H](F)Cl)C1	1843366842	UDBGQABNINRBBE-IBGZPJMESA-N	442.915	1.974	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1nccc3[nH]ccc13)C2	1843415683	AKXGVVHBMJJQJU-VULFUBBASA-N	433.472	1.514	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)c1c[nH]nc1C)C2	1844692824	NYNRLGGPNSQKMZ-UHFFFAOYSA-N	427.417	1.682	50	20	IDGD	
CN1CCC[C@H](C(=O)N2CCCC23CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C3)C1	1845052557	PVAJKMPDEROAHN-HOTGVXAUSA-N	442.988	1.664	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc2n(n1)CCCN(C)C2	1847501890	GXAMJGPIFBFOHW-COXVUDFISA-N	438.370	1.565	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2ccc(OCc3noc(C)n3)cc2)c2ccccc2c1=O	14044365	FFTDRYPIPJQLFD-UHFFFAOYSA-N	448.439	1.762	50	20	IDGD	
CCCC[C@@H](NC1=NS(=O)(=O)c2ccccc21)C(=O)NNC(=O)c1ccccc1F	14290614	NZBIAXZGLPIZJA-MRXNPFEDSA-N	432.477	1.884	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C(C)C)c1	15879473	BSMFCNXHCWPELM-UHFFFAOYSA-N	435.502	1.564	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)c2ccccc2S(=O)(=O)N2CCOCC2)c1	106241173	SURLWAGBJNLHAV-UHFFFAOYSA-N	447.513	1.164	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(N(C)C)c(F)c2)c1	109339613	AVBOLRIKFXNRJO-UHFFFAOYSA-N	436.509	1.997	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCCc2ccn(-c3ccccc3)n2)nc1	726254554	WTMLLUFNAUCEHY-UHFFFAOYSA-N	443.533	1.823	50	20	IDGD	
COc1cc(OC)cc(C(=O)NCC(=O)NNC(=S)Nc2ccc(OC)c(F)c2)c1	727499007	UYIRVNAMAPLKJU-UHFFFAOYSA-N	436.465	1.599	50	20	IDGD	
CNS(=O)(=O)c1cccc([C@@H](C)NC(=O)NNC(=O)c2ccc3ccccc3n2)c1	727608895	ZXXKAWVAVKTDDY-CYBMUJFWSA-N	427.486	1.848	50	20	IDGD	
CN(C)N(C(=O)c1cc(N2CCCC2=O)cc(C(F)(F)F)c1)[C@@H]1CCS(=O)(=O)C1	728232832	AAWVVOVKKZFPRO-CQSZACIVSA-N	433.452	1.938	50	20	IDGD	
CCCOc1c(Br)cc(C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)cc1OC	728371152	GKFKEPWNWPPPLJ-SNVBAGLBSA-N	449.323	1.442	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2cc(C3CC3)nc3c2c(C)nn3C)n1	728721268	WZZHCPRXJKTCQC-UHFFFAOYSA-N	442.501	1.466	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)CNC(=O)c2ccc(Br)cc2)cn1	729693053	GEYFYQJSQAWYHX-UHFFFAOYSA-N	438.307	1.600	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)c2cccc(CN3CCOCC3)c2)c2ccccc2c1=O	732053809	VVMQUFHXICYAMN-UHFFFAOYSA-N	449.511	1.884	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)[C@H]2CCCN(C(=O)Cc3ccccc3)C2)C[C@@H](C)O1	732260866	IPDAANRZRYNFJF-NSHGMRRFSA-N	430.549	1.114	50	20	IDGD	
COCCOc1cc([N+](=O)[O-])c(C(=O)NNc2nc3ccccc3c(=O)n2C)cc1OC	733263543	IOGUBCMPEISIFX-UHFFFAOYSA-N	443.416	1.632	50	20	IDGD	
CN(C)CC(=O)NNC(=O)c1ccc(CNS(=O)(=O)c2ccc(C(C)(C)C)cc2)cc1	733359500	JAGPHZVYUZTAAF-UHFFFAOYSA-N	446.573	1.785	50	20	IDGD	
C[C@H]1C[C@@H](C)CN(S(=O)(=O)NNC(=O)c2ccc(CSc3nncn3C)cc2)C1	733876321	ITMRZOAOWUTMKN-OKILXGFUSA-N	438.579	1.565	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN(C)[C@H]2CCCN(c3ccccc3)C2=O)cc1OC	734488751	LNAPWBRTEGYTGB-SFHVURJKSA-N	440.500	1.592	50	20	IDGD	
COc1ccc(S(=O)(=O)C[C@@H](C)C(=O)NNC(=O)c2nnc(O)c3ccccc23)cc1	735029104	SWWFHWYXUQQGDT-GFCCVEGCSA-N	444.469	1.215	50	20	IDGD	
Cc1ccc(C)c(S(=O)(=O)Nc2ccccc2C(=O)NNC(=O)c2cnn(C)c2)c1	735471178	SOWFYEZFMHEQPA-UHFFFAOYSA-N	427.486	1.913	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)NCc1cccc(-n2cncn2)c1	735516401	NBYWUYUHMDAQAV-UHFFFAOYSA-N	445.277	1.939	50	20	IDGD	
CC(C)(C)NS(=O)(=O)Cc1cccc(C(=O)NNC(=O)COCc2ccccc2)c1	737629772	XXKXMGAYWLMEFV-UHFFFAOYSA-N	433.530	1.882	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)CN2CCN(c3ccccn3)CC2)cc1	740748891	CDPBMKILWFCTJN-QGZVFWFLSA-N	427.505	1.217	50	20	IDGD	
COc1ccc(-c2n[nH]c(CNC(=O)NNC(=O)C(=O)Nc3ccc(C)c(C)c3)n2)cc1	741413243	HHWWUUAWRWCAAY-UHFFFAOYSA-N	437.460	1.566	50	20	IDGD	
CC1(C)[C@H]2OCC[C@H]2[C@H]1NC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	741426633	WIOYIPUBIPHRMN-BBWFWOEESA-N	436.534	1.229	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@@H](Cn2cccn2)c2ccccc2)c2ccccc2c1=O	741427582	RRYLYVBTEVMNKS-IBGZPJMESA-N	445.483	1.998	50	20	IDGD	
CS(=O)(=O)c1ccc(C(=O)NNC(=O)C(F)(F)Oc2ccccc2)cc1[N+](=O)[O-]	741596593	VLEZGLLDNVEXET-UHFFFAOYSA-N	429.357	1.431	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C[C@H](C)/N=C2/NS(=O)(=O)c3ccccc32)cc1	742477534	QKOMDSOEFWUIFJ-AWEZNQCLSA-N	430.486	1.039	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C[C@@H](C)/N=C1/NS(=O)(=O)c2ccccc21	742478966	XZMWSQGGSOFYGW-OLZOCXBDSA-N	448.476	1.258	50	20	IDGD	
Cn1ccc(N2CCC[C@H](NC(=O)NNC(=O)c3c(Cl)cccc3Cl)C2=O)n1	743585785	PUTSRMRETYWRJT-LBPRGKRZSA-N	425.276	1.867	50	20	IDGD	
CCC[C@@H](NC(=O)Cc1ccccc1)C(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	743830065	MDADUXQUDVQTSW-GOSISDBHSA-N	446.529	1.770	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CN2CCN([C@@H](C)C(=O)Nc3cccc(F)c3)CC2)c1	744387628	VYAUSBFMYVZMNV-KRWDZBQOSA-N	441.507	1.540	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)[C@@H]2CC(=O)N(c3ccc4c(c3)CCC4)C2)c1	744681945	ICTKVFWGMIZKSH-LJQANCHMSA-N	446.463	1.404	50	20	IDGD	
CCN(CC)CCN1C(=O)C(=NNC(=O)[C@H](C)CN2C[C@@H](C)O[C@H](C)C2)c2ccccc21	744762185	OPHMFWSNNSFYIX-GUDVDZBRSA-N	443.592	1.941	50	20	IDGD	
CCCCS(=O)(=O)N1CCC(C(=O)OCC(=O)NNC(=O)c2cccc(C)c2)CC1	744794866	QYPPLASTDMFXPJ-UHFFFAOYSA-N	439.534	1.141	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)N[C@H]2CC(=O)N(CCOc3ccccc3)C2)cc1C	745848718	WDAARXRHVRPLOF-SFHVURJKSA-N	440.500	1.693	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@H]2CCOc3cc(OC)ccc32)c2ccccc2c1=O	745860866	FIHSSBWOZXJRNM-KRWDZBQOSA-N	437.456	1.893	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)N[C@@H]2CC(=O)N([C@H]3C[C@H]3c3ccccc3)C2)cc1C	745915230	XTBHTEQHVAEXGS-AABGKKOBSA-N	449.511	1.729	50	20	IDGD	
Nc1ccc(Br)c(C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c1	747097549	JDSQPFIGJKVHCD-UHFFFAOYSA-N	437.206	1.558	50	20	IDGD	
COc1ccc2c(c1)OC[C@@H](C(=O)OCC(=O)NNC(=O)c1cc(Cl)ccc1OC)C2	747528546	YXSPNKUONYFBDC-ZDUSSCGKSA-N	448.859	1.913	50	20	IDGD	
O=C(CCN1C(=O)[C@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O)NNc1ccc(F)cc1Br	748074135	PMUBGKUWHNSPHN-UXOAXIEHSA-N	426.242	1.584	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(Cl)c(C(=O)NNc2cc(Cl)nc(C)n2)c1	748339918	RCWFLUIKWSAKPT-UHFFFAOYSA-N	434.305	1.773	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)NCc1ccccc1CN1CCC(O)CC1	749591274	OWDXLPRCPOCLCD-UHFFFAOYSA-N	430.480	1.692	50	20	IDGD	
CCO[C@@H]1C[C@@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)C1(CC)CC	749617588	QBTQOXBXNMEWDD-IAGOWNOFSA-N	440.566	1.865	50	20	IDGD	
CC[S@](=O)[C@@H]1CCC[C@@H](NC(=O)NNC(=O)c2csc(N3CCOCC3)n2)C1	750265233	AHLUFHGODXLSAU-ZUKSIGSZSA-N	429.568	1.004	50	20	IDGD	
O=C(NNC(=O)N1CCC(OC[C@@H]2CCCCO2)CC1)C1CCN(c2ncccn2)CC1	750274638	CRBAHELELDBBGG-IBGZPJMESA-N	446.552	1.484	50	20	IDGD	
O=C(NN=C1CCCc2cc(O)ccc21)c1cccc(S(=O)(=O)N2CCOCC2)c1	750913195	WQVTYTUHWLZZSQ-UHFFFAOYSA-N	429.498	1.884	50	20	IDGD	
Cc1nc(-c2cccnc2)nc(O)c1CCC(=O)NNC(=O)c1c(C)nc2ccccn12	751302405	IVNWZCYEHZCINR-UHFFFAOYSA-N	431.456	1.903	50	20	IDGD	
CN(CCO)S(=O)(=O)c1ccccc1CNS(=O)(=O)c1ccc(CCCl)cc1	751404905	WDCKMMVYUYIYLZ-UHFFFAOYSA-N	446.978	1.559	50	20	IDGD	
O=C(NNC(=O)N1CCC(OC[C@@H]2CCCO2)CC1)C1CCN(c2ncccn2)CC1	751606337	DMJUBKRAUMUUPN-SFHVURJKSA-N	432.525	1.094	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCc2ccc([S@](C)=O)cc2)nc1	753049121	FBKHIOBUTLGVFS-MHZLTWQESA-N	425.536	1.332	50	20	IDGD	
C[C@@]1(CCC(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)CCC(=O)N1	753431654	VNMCBIRGHYVEIN-NRFANRHFSA-N	435.956	1.054	50	20	IDGD	
O=C(CO)NNC(=O)c1cccc(NC(=O)c2ccccc2I)c1	753440064	VZJHEGFBMILEGX-UHFFFAOYSA-N	439.209	1.297	50	20	IDGD	
Cc1oc(C(=O)NNC(=O)c2ccc(F)cc2Br)cc1S(=O)(=O)N(C)C	753579899	AHXDKKGSYJWQQV-UHFFFAOYSA-N	448.270	1.815	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)N[C@@H]2[C@@H]3CCO[C@H]3C23CCC3)c2ccccc2c1=O	754677585	WHSKLUUKWYIWEI-CGTJXYLNSA-N	425.489	1.879	50	20	IDGD	
COc1c(F)ccc(F)c1C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	755046148	AIHJBAUNGYNSTO-UHFFFAOYSA-N	439.440	1.833	50	20	IDGD	
O=C(Cc1cc[nH]n1)NNC(=O)c1cccc(S(=O)(=O)Nc2cccc(Cl)c2)c1	755269691	NARLJKTVSUWCOH-UHFFFAOYSA-N	433.877	1.868	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCc2n[nH]cc2C1)c1nn(Cc2ccccc2)c(=O)c2ccccc12	756862549	DZYUIMZFZVDAQZ-INIZCTEOSA-N	442.479	1.734	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)N[C@H]1CCN(C(=O)CCc2ccccc2)C1	756931964	RQLVPBDXBJEOCG-INIZCTEOSA-N	443.529	1.042	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)NNC(=O)CCc2ccccc2O)cc(S(C)(=O)=O)c1	757609131	OHKAYQFNTNZZJW-UHFFFAOYSA-N	449.485	1.758	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NCc2cc(Cl)cc3c2OCC3)c2ccccc2c1=O	758696913	VSPIBNZGARLWDL-UHFFFAOYSA-N	427.848	1.666	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)N[C@H]2CN(C(=O)OC(C)(C)C)C[C@H]2C#N)cc1	758756315	XXFJGBGINPROLO-CJNGLKHVSA-N	431.497	1.847	50	20	IDGD	
O=C(NNC(=O)c1nnn(-c2cccc(F)c2)c1C(F)(F)F)C(=O)Nc1ccccn1	758838280	DOKKGNWVMVGTCA-UHFFFAOYSA-N	437.313	1.220	50	20	IDGD	
COCCCC(C)=NNC(=O)C[C@H]1c2cc(OC)c(OC)cc2CCN1S(C)(=O)=O	759191181	CBIUKHRSBUIOJR-KRWDZBQOSA-N	441.550	1.871	50	20	IDGD	
CO[C@@](C)(C(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1)c1ccccc1F	760053699	OJEYFYAZUHKHCR-HXUWFJFHSA-N	437.493	1.464	50	20	IDGD	
C[C@H](C(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1)c1cccc(C(=O)c2ccccc2)c1	761431890	VHSPDDJTZLDMGJ-KSSFIOAISA-N	429.498	1.539	50	20	IDGD	
Cc1nnnn1/C(=C\c1ccc(F)cc1)C(=O)NNC(=O)c1cc(-c2ccccc2)[nH]n1	762937743	LRQORNLFQRWGJL-ODLFYWEKSA-N	432.419	1.970	50	20	IDGD	
CCc1ncc(S(=O)(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)s1	763374767	WESYZXWAUJVMCB-UHFFFAOYSA-N	444.560	1.113	50	20	IDGD	
CN(C)CC1CCN(c2ccc(NC(=O)C(=O)NNC(=O)c3ccccc3O)cc2)CC1	763527095	GHWUZJBUTKGZEF-UHFFFAOYSA-N	439.516	1.570	50	20	IDGD	
CCOc1cc2c(cc1NC(=O)C(=O)NNC(=O)c1ccc(OC)c(OC)c1)O[C@H](C)C2	763544554	YJACSRWOLCNKPE-GFCCVEGCSA-N	443.456	1.826	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cnn(CC(F)F)c2)c(C)n1-c1ccccc1	763602042	LCFLQFOSRVHXME-UHFFFAOYSA-N	430.415	1.955	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)c2c(C)nc3ccccn23)cc1F	763629045	NWARLJFNVQTUHX-UHFFFAOYSA-N	429.408	1.207	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1ccc(N2CCOCC2)c(F)c1	763629841	OWRWHIZCQZZIPA-UHFFFAOYSA-N	440.435	1.018	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(-c3nnnn3C3CC3)c2)c1	763631114	UZSFYPDEEXMKMY-UHFFFAOYSA-N	435.444	1.148	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2ccnn2Cc2ccc(C)o2)c1	763644934	OZCLLPSVHSNNMC-UHFFFAOYSA-N	425.445	1.615	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccc(NC(=O)C(C)C)c1	763657358	KVRNOQDQWRZAQP-UHFFFAOYSA-N	428.445	1.455	50	20	IDGD	
CCCCn1nccc1NC(=O)C(=O)NNC(=O)COc1ccc(Br)cc1	763692777	CIMFJZMOXVLQHR-UHFFFAOYSA-N	438.282	1.611	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)C(=O)Nc2cc(F)cc(N3CCOCC3)c2)c1	763761016	YJAPPZTWADBSKO-UHFFFAOYSA-N	429.452	1.128	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(-n3cnnn3)c2)cc1	763768493	RDZAPTZDTZQOEM-UHFFFAOYSA-N	437.460	1.487	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc2c(cnn2C(F)F)c1	763806443	DCBCCCIVFQFWSF-UHFFFAOYSA-N	428.355	1.468	50	20	IDGD	
Cc1ccc(-n2nc(C(=O)NNC(=O)CNC(=O)c3cccnc3)c3c2CCC3)c(C)c1	763813027	FMEFMVBAXRXSRQ-UHFFFAOYSA-N	432.484	1.564	50	20	IDGD	
Cc1cc(C)n(-c2ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc3ccccc3F)cn2)n1	763849369	IUGBOKNHQITDPC-CQSZACIVSA-N	440.435	1.577	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cnn(-c3ccccn3)c2)cc1	763860482	HKPSULDTTWIHQD-CQSZACIVSA-N	438.444	1.219	50	20	IDGD	
Cc1nnc(-c2cccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc3ccc(F)cc3)c2)o1	763864366	BXAYXVDQHGKTSX-LLVKDONJSA-N	427.392	1.738	50	20	IDGD	
CCNC(=O)c1ccc(C)c(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)c1	763867913	YRVBZFPLRAJEJY-ZDUSSCGKSA-N	430.436	1.437	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)ncn3C)ccc1OC(C)C	763916283	LLCQUZMINGMVMJ-UHFFFAOYSA-N	425.445	1.769	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)C(=O)NNC(=O)c1ccccc1C	763958271	UAEBYUOAZYJIOO-UHFFFAOYSA-N	448.501	1.044	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)C(=O)Nc1ccccc1C(=O)N1CCCC1	763996728	ZMYSDUPILIUAEO-UHFFFAOYSA-N	448.277	1.413	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1cccnc1OCc1ccccc1	764005646	DRIDCAVPSCZIIG-UHFFFAOYSA-N	448.435	1.832	50	20	IDGD	
O=C(NNC(=O)c1cccc(C(F)(F)F)c1)C(=O)Nc1ccccc1CN1CCNC1=O	764037456	KYEVMOWXVSJUQS-UHFFFAOYSA-N	449.389	1.630	50	20	IDGD	
CNS(=O)(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3c2)c1C	764061682	KSJIDIXNTIBBFO-UHFFFAOYSA-N	440.481	1.456	50	20	IDGD	
COc1cc(C#N)ccc1Oc1ccc(NC(=O)C(=O)NNC(=O)c2cc(C)[nH]n2)cc1	764098505	OUILMVWOIZZITG-UHFFFAOYSA-N	434.412	1.790	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)N3CCC[C@H](C)C3)cc2C)n[nH]1	764098938	QGSQYJLVBZVLDP-LBPRGKRZSA-N	426.477	1.298	50	20	IDGD	
CN(C)C(=O)C[C@H]1CN(C(=O)C(=O)NNC(=O)CC(F)(F)F)c2ccc(Cl)cc21	764117664	TUBKMKXKQHCYBN-VIFPVBQESA-N	434.802	1.348	50	20	IDGD	
CN(C1CCCCC1)S(=O)(=O)c1ccccc1NC(=O)C(=O)NNC(=O)CC1CC1	764143412	VBIDNKYXTBHJIS-UHFFFAOYSA-N	436.534	1.526	50	20	IDGD	
CC(=O)N(Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)cc1)C1CC1	764169943	XJIYWJTYDZLSDC-FQEVSTJZSA-N	436.468	1.287	50	20	IDGD	
CC(C)CNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(C#N)cc2)cc1Cl	764177750	PYYMIPJAXQPQEB-UHFFFAOYSA-N	441.875	1.997	50	20	IDGD	
CC(C)N(C)C(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)Cc2cccnc2)c1	764265599	BMPBCAJHYUGCIC-UHFFFAOYSA-N	431.880	1.544	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)C(=O)Nc1cccc(C[S@@](=O)c2ccccc2)c1	764267871	KNSYZHSMQMXZCV-WJOKGBTCSA-N	436.493	1.718	50	20	IDGD	
CN(C)C(=O)C[C@@H]1CN(C(=O)C(=O)NNC(=O)Cc2cccnc2)c2ccc(Cl)cc21	764268336	IBPHSCHLANDPIV-CQSZACIVSA-N	443.891	1.034	50	20	IDGD	
CN(Cc1cccc(NC(=O)C(=O)NNC(=O)c2cnn(C)c2)c1)C(=O)OC(C)(C)C	764358899	OWZSPGXZVSYWNH-UHFFFAOYSA-N	430.465	1.187	50	20	IDGD	
CC[C@H](C)NS(=O)(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(C)o2)c1	764370322	QDDGDNVQTUHVOJ-LBPRGKRZSA-N	436.490	1.206	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cccc4c3OCCO4)n[nH]2)cc1	764385159	TZJMTGQMLZRFCN-UHFFFAOYSA-N	435.440	1.810	50	20	IDGD	
Cc1ccc(NC(=O)Nc2ccccc2)cc1NC(=O)C(=O)NNC(=O)[C@@H]1COCCO1	764434296	PYGYXUBHARBMLU-KRWDZBQOSA-N	441.444	1.140	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cccn2C)cc(Br)c1F	764664256	UHZHFBQMXBCXOD-UHFFFAOYSA-N	441.213	1.113	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2ccc(OCC(F)(F)F)cn2)c2ccccc2c1=O	765186705	UUZJHPXWMHRCAR-UHFFFAOYSA-N	435.362	1.827	50	20	IDGD	
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC[C@@H](C(=O)NNc2ncnc3ccsc23)C1	766678394	CDYMJXRKQKPHKR-GFCCVEGCSA-N	435.535	1.575	50	20	IDGD	
CC(=O)N1C[C@H](C(=O)OCC(=O)NNC(=O)Cc2ccccc2C)Oc2ccccc21	767258517	CSGFBEKJLRGHML-LJQANCHMSA-N	425.441	1.042	50	20	IDGD	
Cc1nc(-c2ncccn2)nc(O)c1CC(=O)NNC(=O)c1cc(-c2cccs2)[nH]n1	768260826	OXVRAIQLOULBRM-UHFFFAOYSA-N	436.457	1.403	50	20	IDGD	
CC(C)[C@H](NC(=O)OC(C)(C)C)C(=O)NCC(=O)NNC(=O)c1cccc(N(C)C)c1	768268789	ODLGEIOGXIKTKZ-KRWDZBQOSA-N	435.525	1.179	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)[C@@H](c1cccc(F)c1)N1CCOCC1	768634027	BABPCJZMJHJICJ-LJQANCHMSA-N	437.493	1.754	50	20	IDGD	
NS(=O)(=O)c1ccc(C(=O)NNC(=O)COc2ccccc2-c2ccccc2)nc1	769739142	TWLSSBMRJMXPSP-UHFFFAOYSA-N	426.454	1.236	50	20	IDGD	
CSCCNC(=S)NNC(=O)c1cccc(CN2C(=O)c3ccccc3C2=O)c1	769768057	DILHWVJCCSSPMZ-UHFFFAOYSA-N	428.539	1.955	50	20	IDGD	
CSCCNC(=S)NNC(=O)[C@H](C)N1C(=O)c2ccc(Br)cc2C1=O	770240672	QGIKYUSBMWMFNR-QMMMGPOBSA-N	445.364	1.292	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)NC3CCN(C[C@H]4CCCO4)CC3)nc21	770395040	GWTKYAXPOTUKOO-CQSZACIVSA-N	432.529	1.556	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)N[C@@H]3CCCC[C@@H]3N3CCOCC3)nc21	770410530	ASRLESFYCINAFL-CABCVRRESA-N	432.529	1.556	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNS(=O)(=O)c1cnn(Cc2ccccc2)c1	771606758	XKBGOANWMCWYBT-UHFFFAOYSA-N	447.904	1.211	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1cc(S(=O)(=O)N2CCCC[C@H]2C)ccc1C	771934920	XAAJQVZSNDHFGZ-CABCVRRESA-N	439.534	1.661	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)c1sccc1S(=O)(=O)N1CCCC1	771969898	SNTJFGBZALENTE-LBPRGKRZSA-N	431.536	1.271	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1ccc(OCC(F)F)c(C(F)(F)F)c1	772540653	LBOGQRKTOGXFRM-SSDOTTSWSA-N	448.370	1.440	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)c2ccnc(O[C@H]3CCOC3)c2)C1	773420772	PLLYNDZICOEPKZ-HOTGVXAUSA-N	434.493	1.657	50	20	IDGD	
Cc1nc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)ccc1Br	773526461	AQVNHWVOKABEBP-SNVBAGLBSA-N	439.241	1.845	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)NCC1CCN(C2CC2)CC1	775203905	KHDHPCNCNHGLLY-UHFFFAOYSA-N	428.581	1.404	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)NNc2cnccn2)cc1	775278998	QFIYSXSJGJGDRN-XNTDXEJSSA-N	432.444	1.274	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)Nc1ccc(C[C@@H]2NC(=O)NC2=O)cc1	775705155	YMHGNQGTKCZDJV-ZBEGNZNMSA-N	429.408	1.196	50	20	IDGD	
O=C(NNC(=O)c1c(Cl)cccc1Cl)N[C@H]1CCO[C@@]2(CCS(=O)(=O)C2)C1	776075769	DVFGOKXYJSLEFB-QFYYESIMSA-N	436.317	1.674	50	20	IDGD	
Nc1ccc(C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1OC(F)(F)F	778358105	RAQDITBEEYCAOQ-UHFFFAOYSA-N	442.306	1.694	50	20	IDGD	
CCOC(=O)N1[C@H](c2ccc(C)o2)CC[C@@H]1C(=O)NNC(=O)CNC(=O)OC(C)(C)C	778441534	LWLWSPJNURUWFH-UONOGXRCSA-N	438.481	1.922	50	20	IDGD	
COc1ccc(Cn2ccc(NC(=O)C(=O)NNC(=O)Cn3ccc4ccccc43)n2)cc1	778709872	JWDCMSUKKGCLKS-UHFFFAOYSA-N	446.467	1.681	50	20	IDGD	
C[C@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1NC(=O)NNC(=O)c1cc([N+](=O)[O-])ccc1O	779704501	LREZQZDMZJZMCH-SMDDNHRTSA-N	437.453	1.890	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1)N[C@@H]1CCC[C@@H]1CCO	779710323	CKZDIKCJDLIDKG-YLJYHZDGSA-N	449.515	1.884	50	20	IDGD	
O=C(NNc1ncncc1Cl)C(=O)Nc1cc(N2CCCS2(=O)=O)ccc1Cl	782158835	FHSFMIXEVPJYAB-UHFFFAOYSA-N	445.288	1.405	50	20	IDGD	
Cc1cccc(COc2cccc(NC(=O)C(=O)NN[C@@]3(C)CCS(=O)(=O)C3)c2)c1	783428677	YOONKEILOUWHDO-NRFANRHFSA-N	431.514	1.711	50	20	IDGD	
O=C(NNc1nccc2sccc12)C(=O)Nc1ccc(N2CCCS2(=O)=O)cc1	783438317	AEOPSLCVGCHOKV-UHFFFAOYSA-N	431.499	1.918	50	20	IDGD	
Cc1cc([N+](=O)[O-])c(Cl)c(S(=O)(=O)NNC(=O)CNC(=O)c2cccs2)c1	783821698	OEWYYNLYPDEIPB-UHFFFAOYSA-N	432.867	1.358	50	20	IDGD	
O=C(NNc1ccccc1)C(=O)Nc1ccc(N2CCOCC2)cc1N1CCOCC1	784769997	WDDSFIRUEKSJHD-UHFFFAOYSA-N	425.489	1.442	50	20	IDGD	
CC(=O)Nc1cccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)c1	784836205	SKAPYZPFRXPBFZ-UHFFFAOYSA-N	426.401	1.723	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)C(=O)Nc2ccccc2CN2CCOCC2)c1	784846227	LZJRSKWDBGEVED-UHFFFAOYSA-N	432.502	1.004	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNc2ccc(Cl)nc2)cc1OC	784870224	IHOWIYJQCFBKAX-UHFFFAOYSA-N	427.870	1.587	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)c3nnn(Cc4noc(C)n4)c3C)n[nH]2)c1	785181663	DQQRFMWFIIDBHX-UHFFFAOYSA-N	435.448	1.408	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2cccc(Br)n2)c1	786140773	PQFXANVGEHLGKW-UHFFFAOYSA-N	442.295	1.561	50	20	IDGD	
CCOC(=O)c1cnn(C)c1NC(=O)C(=O)NNC(=O)C1=S=C2CCCCCCC2=C1	786415161	ZFWUZLHPHKELRI-UHFFFAOYSA-N	447.517	1.055	50	20	IDGD	
N#C/C(=C\C1CC1)C(=O)OCC(=O)NCCN1C(=O)S/C(=C\c2cccnc2)C1=O	786674972	YTOKZLQBQQFXRO-MICXRRPDSA-N	426.454	1.637	50	20	IDGD	
Cc1nn([C@@H]2CCS(=O)(=O)C2)c(C)c1/C=C(/C#N)C(=O)NCc1ccc([N+](=O)[O-])cc1	787148149	RTIIAGDGRUBABT-YZIPPPLESA-N	443.485	1.991	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)[C@@H](CC3CCC3)NC(C)=O)n[nH]2)cc1OC	787478729	RWBNLNXFHPFWEB-MRXNPFEDSA-N	429.477	1.550	50	20	IDGD	
O=C(NNC(=O)C12CCC(C(=O)NNC(=O)c3ccccn3)(CC1)CC2)c1ccccn1	789868210	UUPUXLWOMSMYCH-UHFFFAOYSA-N	436.472	1.039	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NN=Cc2c(Br)c(C)nn2C)cc1	790291122	RXTFOJFMRLVATQ-UHFFFAOYSA-N	442.339	1.570	50	20	IDGD	
O=C(CC1CC1)NNC(=O)C(=O)Nc1cc(Br)cc(C(=O)N2CCCC2)c1	790951068	BVJNQXPGLSKVLU-UHFFFAOYSA-N	437.294	1.571	50	20	IDGD	
CNS(=O)(=O)c1ccc(C)c(NC(=O)C(=O)NNc2cccc(F)c2[N+](=O)[O-])c1	790994390	WHAOBYFLIFLXKO-UHFFFAOYSA-N	425.398	1.032	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCCC[C@H]2C(=O)OCc2ccccc2)n1	791644178	ZKQHHVHGYNHTOL-KRWDZBQOSA-N	430.530	1.739	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(CCC(=O)NNC(=O)Cn2ccc3ccccc32)CC1	792143811	RVXYCOHJPILPHO-UHFFFAOYSA-N	429.521	1.732	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)[C@H]3[C@H]4[C@@H]5C[C@@H]6[C@@H]7C[C@@H]([C@@H]4[C@@H]75)[C@@H]63)cc2)CC1	793711521	IESVQFLLJSKHCT-IJIOMUBASA-N	442.585	1.460	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCC1([S@@](C)=O)CCC1	798048829	SSLOQEVXXGFZBP-SSINHNECSA-N	432.340	1.848	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(O[C@@H]3CCN(C)C3=O)cc2C)cc1F	799259555	BWHZKJGTWQVRIA-GOSISDBHSA-N	442.447	1.452	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)OCC(=O)N2C	799262786	CMJDDXFROHEEQU-LLVKDONJSA-N	446.847	1.249	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCC[C@H](CCNC(=O)OC(C)(C)C)C2)n1	799358992	ROZCQXYTCYAREW-OAHLLOKOSA-N	439.582	1.768	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN2CCC(S(=O)(=O)N3CCCC3)CC2)cc1C	800482965	QUIPPLUTEXLACA-UHFFFAOYSA-N	442.607	1.270	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)c3ccc(S(C)(=O)=O)c([N+](=O)[O-])c3)n[nH]2)cc1	801132811	SVUOOLKJNUOFSG-UHFFFAOYSA-N	443.441	1.772	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)Nc2ccc(Br)cc2)cc1S(N)(=O)=O	801997800	SXRMBABMWIFTTO-UHFFFAOYSA-N	427.280	1.871	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)[C@@](C)(NC(C)=O)c2ccc(S(C)(=O)=O)cc2)cc1	802052210	LYVJKKKIGUTYSR-FQEVSTJZSA-N	448.501	1.303	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2ccc(N3CCC(O)CC3)cc2)cc1	802066636	UIDZVKXZTSFTTL-UHFFFAOYSA-N	432.502	1.518	50	20	IDGD	
CC(C)(C)OC(=O)N=c1cc[nH]cc1C(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	802068552	KVBXMFZFZSKROD-UHFFFAOYSA-N	449.489	1.721	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)c2ccc(CNS(C)(=O)=O)o2)c(OC)cc1Cl	802083451	KLEKAYKORKSSMA-UHFFFAOYSA-N	446.869	1.466	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)NCCC(=O)OC1CCCCC1	802452394	YDPILRBODJKKRU-UHFFFAOYSA-N	445.564	1.795	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)N[C@H]2CCCN(C(=O)Cc3ccccc3)C2)c1	802475421	JCECMAMCHNYAKF-SFHVURJKSA-N	430.530	1.950	50	20	IDGD	
COC(=O)c1c(F)cc(NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)cc1F	802566962	KCTBOKZFPDXOIO-UHFFFAOYSA-N	430.367	1.492	50	20	IDGD	
CN(C)S(=O)(=O)C[C@@H](NC(=O)NNC(=O)NCc1ccc(Cl)cc1)C(F)(F)F	805766671	BCHADWHCUJYCIF-LLVKDONJSA-N	445.851	1.176	50	20	IDGD	
COCCNC(=O)[C@H](C)OC(=O)c1ccc(NC(=O)NNc2nc(C)cc(C)n2)cc1	806745733	KYCCXRUTFJHBQL-AWEZNQCLSA-N	430.465	1.550	50	20	IDGD	
CNC(=O)c1cccc(NC(=O)C(=O)NNc2cccc(C(=O)OC)c2)c1Br	806968854	QRIJMYGWTDJWIK-UHFFFAOYSA-N	449.261	1.677	50	20	IDGD	
CCN(CC)CC(=O)Nc1cccc(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2)c1	806984769	UFLJFMPMMLZBDP-UHFFFAOYSA-N	428.449	1.957	50	20	IDGD	
O=C1COC[C@H](C[C@@H]2CN(C(=O)C(=O)NNc3cccnc3Cl)c3ccccc32)N1	807013437	RSNPNOJKMJOVMY-OLZOCXBDSA-N	429.864	1.214	50	20	IDGD	
C=C[C@@](C)(O)CC(=O)NNC(=O)c1ccc(CN(C)S(=O)(=O)c2ccc(C)cc2)cc1	809983974	YHSNTZBSZQPVEF-JOCHJYFZSA-N	445.541	1.904	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCC(Oc3ncccc3C)CC2)cc1OC	809992964	CEVJZIOKCUDQDE-UHFFFAOYSA-N	428.489	1.712	50	20	IDGD	
CC(=O)c1cccc(S(=O)(=O)NCC(=O)NNc2nnc(-c3ccccn3)s2)c1	811389196	FPIOWSIRPHXAOZ-UHFFFAOYSA-N	432.487	1.224	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1)C(=O)N1CCN(c2ccccc2)CC1	812534945	TZESAXWPNAJRBW-UHFFFAOYSA-N	436.447	1.326	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)c2ccc(=O)n(Cc3ccccc3)n2)cc1	812726409	DCQYSKRZJOYTLZ-UHFFFAOYSA-N	427.486	1.299	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)cc1	812729227	MJJRDTRCDIFAQW-UHFFFAOYSA-N	430.446	1.788	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)[C@H](O)c1ccc(Cl)cc1F	813467421	GVOVRMQDBHKBBZ-QGZVFWFLSA-N	443.884	1.677	50	20	IDGD	
Cc1nc(Cn2nnc(NC(=O)C(=O)NNc3ccccc3OC(F)(F)F)c2C)no1	815576929	BWLJSMOKHQTLRE-UHFFFAOYSA-N	440.342	1.307	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)CN2C(=O)[C@@H]3CCCC[C@H]3C2=O)c1	818767515	LTLOFVZKBKSDQD-VXGBXAGGSA-N	438.278	1.854	50	20	IDGD	
COCCCNC(=S)N(C)NC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccccc1	837643392	BZWOBIHBOHXJGO-INIZCTEOSA-N	428.580	1.104	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@H](CSC)N2C(=O)[C@@H]3CCCC[C@H]3C2=O)cc1OC	859323313	ZOHAWGKDMGGMAI-KFWWJZLASA-N	449.529	1.372	50	20	IDGD	
O=C(c1cc(S(=O)(=O)N2CCc3ccccc3C2)ccc1Cl)N1CC[C@H](B(O)O)C1	864234057	ORXVMEJGUCATIG-INIZCTEOSA-N	448.737	1.776	50	20	IDGD	
O=C(COC(=O)c1sccc1-n1cccc1)NNC(=O)[C@H]1COc2ccccc2O1	878482477	RSOKFEQUUPJBRY-MRXNPFEDSA-N	427.438	1.683	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1	912992019	XCLQZUNZBBHJGA-SFHVURJKSA-N	446.485	1.908	50	20	IDGD	
NS(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)COc2ccccc2-c2ccccc2)c1	913445694	OUWFEIHWKPWMHX-UHFFFAOYSA-N	443.456	1.980	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)[C@H]2CCN(c3ccccc3Br)C2=O)n1	916140036	SZTAMPZDTRFTAY-CYBMUJFWSA-N	434.294	1.463	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)NC[C@@H](C)N2CCN(c3ccccc3)CC2)c1	916514272	ACJPCHJEOXNNKI-QGZVFWFLSA-N	441.532	1.859	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)NCCNS(=O)(=O)Cc2ccccc2)c1	916517327	RNZMSIFAHHVMSO-UHFFFAOYSA-N	434.518	1.132	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NCCNS(=O)(=O)Cc1ccccc1	916517553	ZIRYZXSOCGAALO-AWEZNQCLSA-N	438.481	1.043	50	20	IDGD	
Cc1nn(C(C)(C)C)c(C)c1C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	917291967	FMIUWMABFITFLB-MRXNPFEDSA-N	430.461	1.399	50	20	IDGD	
O=C(NCC(F)(F)F)c1ccc(S(=O)(=O)NNC(=O)c2ccc(Cl)nc2)cc1	917747844	YLALDJZNPWIXKC-UHFFFAOYSA-N	436.799	1.650	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)[C@H](C)NS(=O)(=O)c2cccs2)c1C	917918952	IOMRJEBOSRLCGA-UONOGXRCSA-N	425.532	1.647	50	20	IDGD	
Cc1cccc(Oc2ccc(S(=O)(=O)NNC(=O)N[C@H]3CCS(=O)(=O)C3)cc2)c1	919961253	YLQYGBNJHYBNPM-AWEZNQCLSA-N	439.515	1.467	50	20	IDGD	
Cn1cc(C=NNC(=O)N[C@@H]2CCS(=O)(=O)C2)c(-c2ccc3c(c2)OCCCO3)n1	920383250	CMBXLPJQDASENC-OAHLLOKOSA-N	433.490	1.069	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1OC	920929756	OAIRLEKNPQMFQN-UHFFFAOYSA-N	437.434	1.832	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)[C@@H](Cc2ccccc2)NC(=O)c2cccnc2)cc1	921301275	UQIICXADTNMJMO-OAQYLSRUSA-N	432.480	1.958	50	20	IDGD	
C[C@H](C(=O)NNC(=O)c1cn(-c2ccccc2)nc1-c1ccccc1)N1C(=O)CCC1=O	1115967025	DZWBLAKCXLPFKZ-OAHLLOKOSA-N	431.452	1.838	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)c3nnn(-c4ccccc4F)c3C(F)(F)F)nc21	1253273017	ONTRNJXPBOBZIP-UHFFFAOYSA-N	437.317	1.564	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)N[C@H]1CCCc2c1cnn2Cc1ccccc1	1318134520	BWLLPHVRECTXAW-KRWDZBQOSA-N	436.472	1.662	50	20	IDGD	
CCN1CCOC[C@H]1C(=O)NNC(=O)c1ccc(CSc2nc(C)cc(C)n2)cc1	1335881500	PNWYDBCNEIYGIM-SFHVURJKSA-N	429.546	1.867	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)[C@@H]3COc4ccc(F)cc4C3)cc2)CC1	1336204075	FMDDBNRHOQLTCE-INIZCTEOSA-N	448.520	1.456	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)NCCCN1C(=O)NC(C)(C)C1=O	1346613491	IIDGIXDFFCHLFE-CQSZACIVSA-N	441.488	1.658	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@H]2COc3c(F)cc(F)cc3C2)c2ccccc2c1=O	1527968808	IZZJXARPSHOWDP-CYBMUJFWSA-N	443.410	1.642	50	20	IDGD	
Cc1c(C(=O)N2CC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)oc2ccccc12	1777746890	DAIGDMBOYSJSLQ-XMMPIXPASA-N	448.284	1.178	50	20	IDGD	
O=C1NCc2cc(C(=O)N3CC[C@@]4(CN(C(=O)CCBr)CCO4)C3)ccc21	1778720442	PJJGPYGANVRAKP-LJQANCHMSA-N	436.306	1.159	50	20	IDGD	
O=C(C#CC1(O)CCCCC1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1779066980	KEIGKWLRNMSDII-CRAIPNDOSA-N	431.302	1.205	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(CCN(C(=O)c3cccn(C(F)F)c3=O)C2)C1	1779359555	SBGITCNHADXRAB-IBGZPJMESA-N	443.523	1.538	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)Cn2cncn2)C1	1779494983	HFOVNVDTNQJJIC-TVKQPGBESA-N	425.961	1.836	50	20	IDGD	
Cc1ccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C3)c(C)n1	1779959907	OZRNYMFPSAVSPZ-AUSIDOKSSA-N	445.564	1.199	50	20	IDGD	
O=C(CC(=O)N1CC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2)Nc1ccc(F)cc1	1780883663	LSONXIJUIRDKQV-GOSISDBHSA-N	432.279	1.788	50	20	IDGD	
O=C([C@H](F)Br)N1CC[C@@]2(C1)CN(C(=O)[C@H]1CCc3ccccc3O1)CCO2	1781332803	FNMHPOALSHCWGP-JTDSTZFVSA-N	441.297	1.901	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCC(=O)OC)C2	1781900856	WGCSHRRAFGVANU-PMUMKWKESA-N	433.343	1.627	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)O)C1	1781988613	HLLHQEKHVOWBOB-XMLVGPMBSA-N	449.460	1.028	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(=O)oc1)C2	1781996460	KQJDMDJBGUYCSN-RVZJWNSFSA-N	427.295	1.551	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)COc1ccccc1F)C2	1782178677	CSPQFHOAYVKDQX-FQELHTAISA-N	442.915	1.972	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)N1CC[C@]2(CN(C(=O)[C@@H](F)Cl)CCO2)C1	1783576442	MJWXWNUTUHPYJY-PJIJBLCYSA-N	433.908	1.750	50	20	IDGD	
Cc1cccc(C(=O)N2CCO[C@@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)c1Cl	1783937358	GTFGOQLHDBJMKM-OAQYLSRUSA-N	436.940	1.465	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)Cc3ccc(OC)c(F)c3)C2)C1	1784703823	ASWQYSOVUDMPPB-YWZLYKJASA-N	428.888	1.461	50	20	IDGD	
COc1ncccc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)CBr)C[C@@H]21	1786009327	SOCBLYHFWXGDOZ-VRKREXBASA-N	440.338	1.715	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4c[nH]nc4c3)C[C@@H]21	1786406106	QUDGFCHBAQVWFW-ZOBUZTSGSA-N	435.322	1.941	50	20	IDGD	
CC(C)N1CCC(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]3C2)CC1	1789921449	JOQYDJLSGRHRHK-LUKYLMHMSA-N	448.377	1.777	50	20	IDGD	
NC(=O)c1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]3C2)cc1	1789926503	AMIZPCTWVTVNDY-ZQDZILKHSA-N	442.285	1.069	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnn4c3OCCC4)C[C@@H]21	1791061624	ZRRQCMFFTMUUJB-DHMWGJHJSA-N	441.326	1.042	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1ccc(C2(NC(=O)c3cnn4ncccc34)CCC2)cc1	1791599266	GIIUNAQFDIMYAJ-UHFFFAOYSA-N	449.515	1.850	50	20	IDGD	
O=C([C@H](O)CCl)N1CC[C@H]2CO[C@@H](CNC(=O)C34CC(c5ccccc5)(C3)C4)[C@H]2C1	1792329776	SIDMLTJCYNAGFB-UVFKXKFKSA-N	432.948	1.688	50	20	IDGD	
CC(C)N[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)CBr)C(C)C	1792867779	KVHSHGIEOHTLBO-KSWRQPAISA-N	432.403	1.630	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c(O)cc(O)cc1O)C2	1792874371	OANQOIYKKWTYEV-DJQAVVSRSA-N	443.294	1.038	50	20	IDGD	
COc1cccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)Br)C3)c1	1795240709	AIHPZFCUTPYSRA-FRQROOTJSA-N	425.323	1.611	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)Nc1cccnc1	1795610922	HRGVIDKGPKYZPB-QZLJAVCYSA-N	439.354	1.645	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1noc(-c3ccccc3)n1)C2)[C@@H](F)Cl	1796367662	MENUQGXGXBEODA-LTCOOKNTSA-N	436.871	1.793	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnn3cccnc13)C2	1796892470	GBAIQZFQVSDFQN-LCFLCXBCSA-N	448.487	1.115	50	20	IDGD	
Cn1c(=O)n(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CCBr)C3)c2ccccc21	1797746421	IBTQDCCMLKBZBE-QDMKHBRRSA-N	449.349	1.763	50	20	IDGD	
CC(C)(C)c1cnc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Br)cn1	1799347492	OFKUYBDLQISAJD-JLUCKKNBSA-N	443.317	1.668	50	20	IDGD	
C[C@H](S)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN(C)NC(=O)NCc1ccccc1	1799869463	PVMHCVMWXYIYLH-OWLYRPNTSA-N	433.578	1.289	50	20	IDGD	
CC(C)(C)[C@@H](O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C#N)=C/c1ccc(F)cc1F	1800332637	VZAOZKUEXYWEQK-DRZPZYELSA-N	447.482	1.868	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(NC(C)=O)o1)C2	1800642061	UHFKEALYLVFVIY-ZWUHOBOKSA-N	442.310	1.615	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1ccc(F)c(F)c1)C2	1800973588	IWJLLZUSCLBLDP-NXEZDXNNSA-N	430.879	1.741	50	20	IDGD	
Cc1ccc(/C=C/C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCC(=O)NN(C)C)C3)s1	1801328965	NJRGUJYPCGTYQV-VASXEIHQSA-N	434.562	1.032	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]1c1cccnc1	1803139278	NGQQMDINDJBWJB-MBOZVWFJSA-N	441.919	1.957	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)C(OC)OC)[C@H]1c1cccnc1	1803357712	XGPVIYQDMQUYMV-SOUVJXGZSA-N	428.327	1.880	50	20	IDGD	
O=C(Cc1cncnc1)NC[C@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1	1804646785	IJVXLBOWIPBHCL-VQIMIIECSA-N	432.322	1.905	50	20	IDGD	
CN[C@H](CC(=O)N1CCC2(CCCN(C(=O)[C@H](C)CBr)C2)CC1)C(=O)O	1805384236	YOAIIGYQIKWOLE-ZIAGYGMSSA-N	432.359	1.311	50	20	IDGD	
C[C@H](C(=O)N1CCC2(CCCN(C(=O)[C@H](O)CCl)C2)CC1)N1CSCSC1	1805522787	LBVTZVSOXKVWSH-HUUCEWRRSA-N	436.043	1.860	50	20	IDGD	
C[C@H](Cn1cncn1)C(=O)N1CC[C@H](CNC(=O)CCBr)[C@@H]1c1cccnc1	1806342790	LIITYMLUVIVSDD-KYJSFNMBSA-N	449.353	1.800	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC2(CCCN(C(=O)CCN3C(=O)C=CC3=O)C2)CC1	1806386981	REWABNSJVPZWCL-AWEZNQCLSA-N	440.338	1.316	50	20	IDGD	
O=C(Cc1cccs1)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1807542604	JNEMPWMFRLWCML-AVRDEDQJSA-N	449.341	1.385	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2csnn2)[C@H]1c1cccnc1)[C@@H](F)Br	1808649189	LDDXJTHNIVQZCG-WCFLWFBJSA-N	428.287	1.943	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC2(CCCN(C(=O)CN3CCCC3=O)C2)CC1	1809556129	OGLAUACIJUKMPF-HNNXBMFYSA-N	428.371	1.871	50	20	IDGD	
O=C(C#CC1(O)CCCCC1)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1	1810329713	GFPIAFIVKISZFS-BJLQDIEVSA-N	433.936	1.386	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1	1812773765	IZERXCZMQNCLTQ-XQLPTFJDSA-N	432.746	1.861	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)CSc2nc[nH]n2)[C@@H]1c1cccnc1	1813032789	GLHALPJVFUOSJA-IJEWVQPXSA-N	438.941	1.252	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2cnccc2F)[C@@H]1c1cccnc1	1813070865	LRKUNOHLCFEUDD-HRAATJIYSA-N	442.495	1.308	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)cn1C	1813071440	SAPQCOZTSFISKN-PGRDOPGGSA-N	440.548	1.421	50	20	IDGD	
C[C@H](Cn1cncn1)C(=O)N1CC[C@@H](CNC(=O)C(Cl)Cl)[C@H]1c1cccnc1	1813077428	INTAJYASEHCQSL-VHDGCEQUSA-N	425.320	1.819	50	20	IDGD	
C#CCCCCC(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1813223767	UNWJBXFLFGMWLK-OFNKIYASSA-N	433.317	1.275	50	20	IDGD	
Cc1cc(C)n2ncc(C(=O)N3CCCC[C@@H]3c3cc(NC(=O)[C@H](O)CCl)n[nH]3)c2n1	1814871694	VQIODEKZBONMQI-HZPDHXFCSA-N	445.911	1.975	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(O)cc1)CC2)c1cccc(B(O)O)c1	1815360745	MYLLMXNLUANDHP-HNNXBMFYSA-N	437.286	1.068	50	20	IDGD	
Cn1nc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)CCBr)[nH]n2)cc1O	1816121451	FXIRNYMGMOWKLG-LBPRGKRZSA-N	425.287	1.940	50	20	IDGD	
COc1ncc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)[C@@H](O)CCl)[nH]n2)cc1F	1816149776	FQKGOXFYGLBYNU-KGLIPLIRSA-N	425.848	1.858	50	20	IDGD	
CC(C)CNC(=O)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CO[Si](C)(C)C)CC2	1817329046	UGENMBWJTPAKJX-GFCCVEGCSA-N	426.615	1.679	50	20	IDGD	
Cc1cccc(CC(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)c1	1817471081	DPSJJPBHGBRRBG-OAQYLSRUSA-N	446.316	1.947	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@H](F)Cl)[nH]n1)c1cc2n(n1)CCCNC2=O	1818975309	JMEKOEYLRCQKSN-DOMZBBRYSA-N	437.863	1.580	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CNC(=O)N(C)C)[nH]n1	1822185758	PTGOGCXHERDCMV-PWSUYJOCSA-N	429.319	1.456	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2CCC(=O)N2C)[nH]n1	1822190679	UQOAVRAZCQJCAJ-WXHSDQCUSA-N	426.315	1.806	50	20	IDGD	
N#Cc1ccccc1OCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1	1823385501	INEAGJQJOJZYIZ-HOTGVXAUSA-N	431.880	1.952	50	20	IDGD	
O=C(C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1)c1ccco1	1825057332	IZGAOBBOVFKAEC-IBGZPJMESA-N	438.289	1.076	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CSc1nc[nH]n1)CC2	1825646713	BUEMCXJQOGHUNY-HTQZYQBOSA-N	445.368	1.749	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)[C@H](O)c2ccccc2)CC1	1826659094	DSXOXXXEOXDQAG-NFBKMPQASA-N	444.576	1.713	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc4[nH]ncc34)C2)C1	1830358079	PELMNLHQBBVIAF-OAQYLSRUSA-N	434.924	1.898	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccn(C)c3)C2)C1	1830535083	IPUDDJLHIQCIER-RDTXWAMCSA-N	428.327	1.126	50	20	IDGD	
C[C@H](Sc1ccccc1)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1	1831149788	IIVUTGBCHWKCFB-KNBMTAEXSA-N	442.965	1.223	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4c(c3)OCO4)C2)C1	1831645904	FEBUIXBBFOORAN-KKSFZXQISA-N	438.908	1.893	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(OC)ccn3)C2)C1	1831650760	KYRGMIKBMQAVFJ-OXJNMPFZSA-N	425.913	1.568	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)CN(CC)CC)C2)C1	1831657075	LEJCDKAWYIJPHJ-WFXMLNOXSA-N	432.005	1.828	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc([N+](=O)[O-])o2)CC1	1831869236	BYCDKOTVILTOLY-MRXNPFEDSA-N	449.508	1.794	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)C(=O)c2ccco2)CC1	1831870936	JGHKAVOXWSBKIY-QGZVFWFLSA-N	432.521	1.455	50	20	IDGD	
COc1ncccc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1	1831871360	BCUOARHVUAMDBO-IBGZPJMESA-N	445.564	1.697	50	20	IDGD	
O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)c1ccnc(F)c1)CCO2	1831897491	HKKFDODKYVYPRD-KRWDZBQOSA-N	430.274	1.076	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3csc(C)n3)CCO2)C1	1832963818	GJCUSUVMELNCCL-LPHOPBHVSA-N	429.970	1.858	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)/C=C/c3ccco3)CCO2)C1	1833078552	ZVYFDZOGVBTEFC-BMCXSGSRSA-N	427.295	1.533	50	20	IDGD	
C[C@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)[C@@H]3[C@H]4COC[C@H]43)CC2)CC1	1833266220	WKIRANDJAWCIMW-ZSGPHXLJSA-N	442.398	1.481	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cccn(C)c3=O)CC2)CC1	1833584361	NEAARWLMHFFDHO-IBGZPJMESA-N	436.984	1.978	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnc(N(C)C)o3)CCO2)C1	1833896166	QJSPWNQFGUCLPK-AUUYWEPGSA-N	428.917	1.218	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1)c1ccc(O)cn1	1834335603	QWFMQCZYSUAPMW-UHFFFAOYSA-N	439.354	1.757	50	20	IDGD	
C[C@@H](Oc1ccccn1)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](F)Cl)CC2)CC1	1835082769	DYJORTSVKYGIEH-RDTXWAMCSA-N	426.920	1.955	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3cccnc3)CCO2)C1	1836152533	LXVUHNTYTSCNSZ-HNAYVOBHSA-N	440.338	1.112	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3cccnc3)CCO2)C1	1836182557	OVPSKPRELVJTSP-WOJBJXKFSA-N	444.359	1.707	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@@](C)(O)C(F)(F)F)CC2)CC1	1837018758	PFGZKCDSVCTTGX-RHSMWYFYSA-N	444.878	1.552	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)C3Cc4ccccc4C3)C2)C1	1837717588	IFHAPJKLLUOXAF-QHCPKHFHSA-N	446.620	1.709	50	20	IDGD	
O=C(CNC(=O)C(F)(F)F)N1CCC(OC2CCN(C(=O)[C@H](F)Cl)CC2)CC1	1838085738	BBZADNXDOZIJBC-ZDUSSCGKSA-N	431.814	1.198	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccnc4c3OCO4)CCO2)C1	1838474815	PHRYDUPLURXFQJ-FQEVSTJZSA-N	439.896	1.145	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4c(c3)CCN4C)C2)C1	1839144958	PDJLHSCRGJXXGH-PGRDOPGGSA-N	435.952	1.766	50	20	IDGD	
Cc1nc2ccc(F)cn2c1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1839526787	XPDGQGHOGZQOEL-VQIMIIECSA-N	442.850	1.386	50	20	IDGD	
COc1ccccc1CC(=O)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1839955853	WVRHKOJBYBSWDK-LJQANCHMSA-N	431.316	1.498	50	20	IDGD	
Cc1cc(C)nc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)c1	1840032137	OHTPRXADMVMVNF-BEFAXECRSA-N	440.338	1.552	50	20	IDGD	
CN(C)c1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)cn1	1840188965	OHACDWIYHZTGBS-GOSISDBHSA-N	431.320	1.021	50	20	IDGD	
O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1C[C@]1(F)Cl)CCO2	1840244138	WBEZYFZXBCXLPV-BYCMXARLSA-N	427.698	1.152	50	20	IDGD	
Cc1nccn1[C@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1	1840494059	OQRSERKZLVXOCF-CCKFTAQKSA-N	447.363	1.445	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C1CC1)CCO2	1840637022	LKFYMQMCKZWSTK-NRFANRHFSA-N	447.444	1.000	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](CCC)NC(C)=O)CCO2	1840851243	KZYSHIVSTAVFLK-QKLQHJQFSA-N	431.961	1.155	50	20	IDGD	
Cc1nn2cc(CC(=O)N3CCCC34CN(C(=O)[C@H](C)Br)C4)nc2s1	1841787197	LHMLFGFYNWRJGF-JTQLQIEISA-N	426.340	1.629	50	20	IDGD	
O=C([C@H]1[C@H]2c3ccccc3S[C@H]21)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843011631	XSGRJQDTJOAVHO-HSALFYBXSA-N	434.326	1.071	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843012061	ZJISMYONGAMCMF-UHFFFAOYSA-N	428.681	1.159	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)[C@H](C)CBr)C2	1843415200	XITAFBFZUQIVNM-JLKNBBFOSA-N	438.326	1.355	50	20	IDGD	
O=C([C@H](O)CCl)N1CC2(CCCN2C(=O)c2cc(Br)c(O)cc2F)C1	1844743848	JWDNDEPWGFGRGE-CYBMUJFWSA-N	435.677	1.711	50	20	IDGD	
O=C(c1ncn(-c2cccc(F)c2)n1)N1CC2(CCCN2C(=O)[C@@H](F)Br)C1	1845216431	QJBSLDSLLFLMSB-CYBMUJFWSA-N	440.248	1.914	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)Cc2cccc(C(F)(F)F)c2)C1	1845922929	VQZIKHPVJVMAHV-UHFFFAOYSA-N	446.234	1.445	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H]2CC[C@@H](C2)[C@@H]1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl	1847564094	QXRKPNFYOXINNT-KBCNZALWSA-N	441.956	1.576	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccccn2)c1	17329221	STLVBTYQPZZCLS-UHFFFAOYSA-N	426.454	1.966	50	20	IDGD	
O=C1Nc2cc3c(cc2/C1=N/NC(=O)c1csc(N2CCOCC2)n1)OCCCO3	17418168	MBHREBFAKLYTSI-UHFFFAOYSA-N	429.458	1.227	50	20	IDGD	
COc1ccc(-c2nnc(SCC(=O)NNC(=O)c3ccc(C)cc3)n2N)cc1OC	21229821	UWOVUJQGYORFNZ-UHFFFAOYSA-N	442.501	1.538	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)C1CCN(c2ccc3cccc(O)c3n2)CC1	728210294	LDSBFYWXLINSMY-UHFFFAOYSA-N	437.456	1.327	50	20	IDGD	
COC(=O)NC(C)(C)C(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	729303251	IJDCGMPZNCYOPV-UHFFFAOYSA-N	440.503	1.445	50	20	IDGD	
CNS(=O)(=O)c1cccc(NC(=O)CNS(=O)(=O)c2ccc(CCCl)cc2)c1	729487799	ZAGKMUJOPAPKFG-UHFFFAOYSA-N	445.950	1.293	50	20	IDGD	
O=C(NNC(=O)[C@@H](Oc1ccc(F)c(F)c1)c1ccccc1)N[C@@H]1CCS(=O)(=O)C1	730536844	WGJAHRMFJNDOPF-DYVFJYSZSA-N	439.440	1.602	50	20	IDGD	
COc1ccccc1C(=O)NNS(=O)(=O)c1cc2c(cc1Br)OCCO2	731493956	DHJMANJLVDKZHG-UHFFFAOYSA-N	443.275	1.852	50	20	IDGD	
O=C(COC(=O)c1cn(-c2cccc([N+](=O)[O-])c2)nn1)NNC(=O)c1ccc(Cl)cc1	731526983	UQXNZLLRZUHBRS-UHFFFAOYSA-N	444.791	1.447	50	20	IDGD	
Cc1ccc(C)n1-c1ccc(C(=O)NNC(=O)NC2CCN(CC(=O)N(C)C)CC2)cc1	731762221	JBGDENPAUQHHLN-UHFFFAOYSA-N	440.548	1.591	50	20	IDGD	
O=C(NNc1nc(-c2cccnc2)no1)[C@H]1CS[C@H](Cc2ccccc2F)C(=O)N1	732111064	ZBYAVCJKZOJEJZ-HUUCEWRRSA-N	428.449	1.557	50	20	IDGD	
Cc1cccc(-n2c(C)cc(/C=C(\C#N)C(=O)NCC(=O)NCCN3CCOCC3)c2C)c1	732157779	GRUHVVHHUWHBFV-PXLXIMEGSA-N	449.555	1.874	50	20	IDGD	
Cc1nc(C(=O)NNC(=O)CCN2C[C@@H](C)O[C@H](C)C2)nn1-c1ccccc1C(C)C	732260295	CGAYNJMNSWBASS-HZPDHXFCSA-N	428.537	1.959	50	20	IDGD	
O=C(NCCCNC(=O)c1cccc(F)c1)NNC(=O)c1nn(-c2ccccc2)cc1O	732469652	JJLWBTODOHBJEH-UHFFFAOYSA-N	440.435	1.481	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)[C@@H](CCSC)NC(=O)Cc2ccccc2)cn1	732838227	AEVBRMUUUSBHDC-MRXNPFEDSA-N	447.586	1.888	50	20	IDGD	
CC(=O)N1CCc2cc(S(=O)(=O)NNC(=O)c3cnn(-c4ccccc4)c3)ccc21	733123306	YLXNCBVUAZQQGL-UHFFFAOYSA-N	425.470	1.405	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)COc1ccc(F)cc1Br	734240361	PCXQXFGOOQJBNF-UHFFFAOYSA-N	449.277	1.822	50	20	IDGD	
C[C@H](C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1)n1cnc2ccccc21	735116804	GOTBIEQKQVGSNL-OAHLLOKOSA-N	443.533	1.072	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)CCN2C(=O)CCc3ccccc32)c2ccccc2c1=O	737766265	NPGZNRUVRIAWOS-UHFFFAOYSA-N	433.468	1.547	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2cc3c(nc2O)CCCCC3)ccc1Cl	737766509	OLEJWQXEBFQAMY-UHFFFAOYSA-N	438.893	1.432	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H]1C(=O)NNC(=O)c1csc(N2CCOCC2)n1	739679856	DPIKSWYHARLERO-QWHCGFSZSA-N	439.538	1.434	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)c2cc(C)c3c(O)nc(O)nc3n2)cc1	740749113	LZXSXGWBVSTPCO-LLVKDONJSA-N	427.417	1.372	50	20	IDGD	
CC(C)CNC(=O)N1CCC[C@H](C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)C1	741213671	AZDNFYIHUCUENN-HNNXBMFYSA-N	437.566	1.648	50	20	IDGD	
Cc1nc2c(c(O)nn2C)c(C)c1CCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	742242359	ZDEIWFOFTJLMPX-MRXNPFEDSA-N	425.445	1.211	50	20	IDGD	
CNC(=O)COc1ccc(C(=O)NNC(=O)c2cccc(Br)c2)cc1OC	742771865	FZSNCYYERVLFQW-UHFFFAOYSA-N	436.262	1.657	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)cs1	743251969	IACMFRDOUCXGRM-UHFFFAOYSA-N	430.460	1.184	50	20	IDGD	
C[C@H]1Oc2ccccc2N(CC(=O)NNC(=O)c2cc(Br)ccc2O)C1=O	743731916	CXDITUBZNLVAFY-SNVBAGLBSA-N	434.246	1.730	50	20	IDGD	
N#CCCn1cc(/C=C(\C#N)C(=O)N2CCC[C@@H](S(N)(=O)=O)C2)c(-c2ccccc2)n1	744530335	HLFCGCLVVBAXAH-XYSGSMRZSA-N	438.513	1.650	50	20	IDGD	
Cc1cc(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)c2c(C)n[nH]c2n1	744619791	YRAVMUDKKTVBFS-UHFFFAOYSA-N	430.490	1.353	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)[C@H]2CC(=O)N(c3ccc(Cl)cc3)C2)c1	744822704	WOHUVXSHACFGBA-HNNXBMFYSA-N	440.843	1.569	50	20	IDGD	
N=C1NC(=O)[C@@H](CC(=O)NNC(=O)c2nc(-c3ccccc3)n(-c3ccccc3)n2)S1	745413699	NGVVEGSATQVPHL-CQSZACIVSA-N	435.469	1.252	50	20	IDGD	
CC[C@H]1Oc2cc([C@@H](C)NC(=O)NNC(=O)COc3ccccc3O)ccc2NC1=O	745934068	YMBGBMHKCMXORW-MLGOLLRUSA-N	428.445	1.972	50	20	IDGD	
COc1cc(C)nc(NNC(=O)C2CCN(S(=O)(=O)c3cc(F)ccc3F)CC2)n1	746632617	GDTDHAUKEDOSQZ-UHFFFAOYSA-N	441.460	1.616	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)[C@H](Cc2cccc(F)c2)n2nnnc2C)o1	747713283	RDUVSGGFDZKJPX-SFHVURJKSA-N	443.483	1.800	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NN=C1CCO[C@H]1C)N(S(C)(=O)=O)CC2	747743035	ZKNFNGZTMBJTAV-LRDDRELGSA-N	425.507	1.234	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCCCN(C)C)cc1C(=O)NNc1cccc([N+](=O)[O-])c1	748003840	KDFXBEDDTDVDOL-UHFFFAOYSA-N	435.506	1.890	50	20	IDGD	
O=C(CSc1nnc(N2CCOCC2)n1CC(F)(F)F)NNC(=O)c1ccccc1	748151805	PEOKGXSNBZLNOJ-UHFFFAOYSA-N	444.439	1.230	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)[C@]2(F)CCN(C(=O)OC(C)(C)C)C2)n1	748209976	OHFGWOKJCKHQCO-SFHVURJKSA-N	444.485	1.034	50	20	IDGD	
O=C(CCc1nc(-c2cc(Br)cs2)no1)NNC(=O)C(=O)N1CCCC1	748239712	LMNKDGDHJRPSQN-UHFFFAOYSA-N	442.295	1.263	50	20	IDGD	
COc1cc(OC)cc(N2CC[C@H](NC(=O)NNC(=O)Cc3ccccc3OC)C2)c1	748660265	DUXLECPGODVJPN-INIZCTEOSA-N	428.489	1.864	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)NCC3CCN(S(C)(=O)=O)CC3)cc2C1	748827521	MRXJYQIOSKSJRX-LBPRGKRZSA-N	428.580	1.489	50	20	IDGD	
Cc1nc(S(=O)(=O)N2CCC(C(=O)NNC(=O)c3cc4ccccc4o3)CC2)cn1C	749466995	DKTAOXRLNHEKGV-UHFFFAOYSA-N	445.501	1.337	50	20	IDGD	
O=C(NCCNS(=O)(=O)Cc1ccon1)NNc1nc(Cl)c(Cl)cc1Cl	750660473	MSKNRNAVVFCEQN-UHFFFAOYSA-N	443.700	1.776	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(Br)c(O)c2)c1	750815429	ZQZQUUQKOUANSB-UHFFFAOYSA-N	442.291	1.480	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)c1ccc(F)c(NS(C)(=O)=O)c1	751293386	HFTHRDDXNOCUAR-UHFFFAOYSA-N	433.465	1.571	50	20	IDGD	
Cn1c(NNC(=O)[C@H]2CC(=O)N(c3ccc4c(c3)OCCO4)C2)nc2ccccc2c1=O	752906430	IUDNLCZSVNAYNC-ZDUSSCGKSA-N	435.440	1.201	50	20	IDGD	
Cn1c(NNC(=O)CNS(=O)(=O)c2ccc3ccccc3c2)nc2ccccc2c1=O	752907891	OTWRVXFCYDTHIB-UHFFFAOYSA-N	437.481	1.508	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)N[C@H]1CCN(Cc2ccc(C#N)cc2)C1=O	753725386	YBCFMOJABLXFQD-IBGZPJMESA-N	435.484	1.631	50	20	IDGD	
CC(=NNC(=O)Cc1csc(N2CCOCC2)n1)c1ccc2c(c1)CCC(=O)N2C	754714649	WKUXECFMVDWWER-UHFFFAOYSA-N	427.530	1.972	50	20	IDGD	
C[C@H](CS(=O)(=O)c1ccc(F)cc1)C(=O)NNC(=O)[C@@H](C)Oc1ccc(F)cc1	755048170	DOGNUOLWMRYDGP-CHWSQXEVSA-N	426.441	1.990	50	20	IDGD	
Cc1nc(S(=O)(=O)N2CCC(C(=O)NNc3ccc(C(F)(F)F)nn3)CC2)cn1C	755191918	UDOPBUKTCLMCEL-UHFFFAOYSA-N	447.443	1.081	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)NNC(=O)[C@@H](C)Oc2c(C)cc(Cl)cc2C)co1	755413522	VWTZCTRQBQRYBY-LLVKDONJSA-N	429.882	1.686	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(NC(=O)NNC(=O)c2cc(C)[nH]n2)ccc1Cl	755430531	CRRZNHJZPHWCJQ-UHFFFAOYSA-N	428.902	1.869	50	20	IDGD	
CCOCC(=O)NNC(=O)Nc1ccc(S(=O)(=O)N[C@H](C)[C@@H]2C[C@H]3CC[C@H]2C3)cc1	755512532	MHGZJWVYBYEVJY-LLDVTBCESA-N	438.550	1.979	50	20	IDGD	
Cn1c(=O)oc2cc(NC(=O)NNC(=O)CCN3CCN(c4ccccc4)CC3)ccc21	756361828	IATUGNYAGLYJLU-UHFFFAOYSA-N	438.488	1.497	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)Nc1cccc(CS(=O)(=O)c2ccccc2)c1	756533391	DIGCRCXNNCGFDA-OAHLLOKOSA-N	435.502	1.865	50	20	IDGD	
C[C@H]1CN(C(=O)Cn2cc(NC(=O)NNC(=O)CCCc3ccccc3)cn2)C[C@H](C)O1	756838270	LXEKRXQOLCBLBV-IRXDYDNUSA-N	442.520	1.695	50	20	IDGD	
NC(=O)c1ccc(NNC(=O)[C@H]2CCCN(C(=O)c3ccccc3OC(F)F)C2)nn1	757401774	FLFWHVJGACQOFT-NSHDSACASA-N	434.403	1.172	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)Nc3cccnn3)c2)cc1	757660263	AIHIWOBQPQZREP-UHFFFAOYSA-N	442.457	1.753	50	20	IDGD	
C[C@H]1C[C@H](NC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])CN1Cc1ccccc1	757769035	VICJQFZCHJUHHS-RDJZCZTQSA-N	427.461	1.967	50	20	IDGD	
COCc1nc2n(n1)C[C@@H](NC(=O)NNC(=O)[C@@H](C)Oc1ccc3ccccc3c1)CC2	757773480	CFMBHWOLYYGKFU-PBHICJAKSA-N	438.488	1.690	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)Nc1cccc(F)c1I	757779258	CTJBGTLQWXAGOV-MRVPVSSYSA-N	425.198	1.635	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1	758023907	ADVBHQGFKJYTNW-NSHDSACASA-N	436.877	1.703	50	20	IDGD	
C[C@@H](NC(=O)OC(C)(C)C)[C@H]1CN(CC(=O)NNC(=O)c2cccc(Cl)c2)CCO1	760975434	QVZOLVXVYJEFOV-CZUORRHYSA-N	440.928	1.715	50	20	IDGD	
C[C@@H](NC(=O)OC(C)(C)C)[C@H]1CN(CC(=O)NNC(=O)c2ccccc2Cl)CCO1	760977775	RKJUXBVMACGIEP-CZUORRHYSA-N	440.928	1.715	50	20	IDGD	
COCC(=O)Nc1cccc(CNC(=O)NNC(=O)CSc2ccccc2OC)c1	761656070	XQIPLQBJRORPJJ-UHFFFAOYSA-N	432.502	1.903	50	20	IDGD	
O=C(CCNC(=O)C12CC3CC(CC(C3)C1)C2)NNc1nccc(N2CCOCC2)n1	762856423	PLRPGBWRMZBZSO-UHFFFAOYSA-N	428.537	1.479	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)NCc1ccc(NS(C)(=O)=O)cc1	763461650	BEZGRSFWLOLYQZ-UHFFFAOYSA-N	443.526	1.193	50	20	IDGD	
COC(=O)c1ccc(OC(C)C)c(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)c1	763549290	WRQZGJOBPGOTAY-UHFFFAOYSA-N	443.412	1.389	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(Oc3cnccn3)c2)cc1OC	763550410	FKXDIKIXZCNQHN-UHFFFAOYSA-N	437.412	1.686	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(OCC(N)=O)cc2)c(C)n1-c1ccccc1	763599884	BBMQPUQVYJEBKB-UHFFFAOYSA-N	449.467	1.358	50	20	IDGD	
Cc1nc(-c2ccc(NC(=O)C(=O)NNC(=O)c3cc(-c4ccccc4)[nH]n3)cc2)n[nH]1	763603783	AEDOECYWKHXMCT-UHFFFAOYSA-N	430.428	1.570	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(C2CC2)nn1-c1ccccc1	763658355	VFBVAZBMFMFTRJ-UHFFFAOYSA-N	449.467	1.923	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(F)c(NC(C)=O)c1	763682232	LAJSEVBFDMRNAV-UHFFFAOYSA-N	432.408	1.348	50	20	IDGD	
CN1C(=O)COc2ccc(NC(=O)C(=O)NNC(=O)CCSc3ccc(F)cc3)cc21	763894896	FPYTZPWPTWWVPT-UHFFFAOYSA-N	446.460	1.449	50	20	IDGD	
O=C(NNC(=O)c1ccc(COc2ccccc2)o1)C(=O)Nc1cccc(-n2ccnn2)c1	763956028	SZKBRJHTMXUKHM-UHFFFAOYSA-N	446.423	1.839	50	20	IDGD	
Cc1ccnc(Oc2ccc(NC(=O)C(=O)NNC(=O)c3ccc4c(c3)OCCO4)cc2)n1	764005931	GJRSOTPZZPLOQL-UHFFFAOYSA-N	449.423	1.748	50	20	IDGD	
Cc1cn2cc(NC(=O)C(=O)NNC(=O)c3ccc(F)cc3Br)ccc2n1	764086957	YSYLNXMYRRNECG-UHFFFAOYSA-N	434.225	1.944	50	20	IDGD	
CN(C)C(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccc3ccccc3c2)cc1	764091322	IMMJPLWKUNOVHH-UHFFFAOYSA-N	432.480	1.799	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(-n3nc(C)cc3C)c(F)c2)c1O	764132659	ZQOLPJDKKVTPBE-UHFFFAOYSA-N	441.419	1.742	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2cc(F)c(Br)c(F)c2)c1O	764133613	XTUYMGJVYDZGLO-UHFFFAOYSA-N	444.188	1.841	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)Cc2ccccc2OC)ccc1Br	764139292	RFGKKWDKUVFZQG-UHFFFAOYSA-N	436.262	1.795	50	20	IDGD	
COC(=O)c1cc(C(C)C)ccc1NC(=O)C(=O)NNC(=O)COc1ccccc1O	764277115	HTNLYBVBCOECEL-UHFFFAOYSA-N	429.429	1.467	50	20	IDGD	
CC(=O)N(Cc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccccc2F)cc1)C1CC1	764313877	NTUOZTMAAMTADM-UHFFFAOYSA-N	426.448	1.665	50	20	IDGD	
CCOc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NNC(=O)c1cc2ccccc2o1	764331623	YLGOYDSIBVZNCB-UHFFFAOYSA-N	438.440	1.933	50	20	IDGD	
CNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)c1C	764376309	BKGNKZZOORNFLK-UHFFFAOYSA-N	426.458	1.206	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cccc(C(=O)N(C)C)c3)n[nH]2)cc1	764384949	OAHSOJCOPWVJSQ-UHFFFAOYSA-N	448.483	1.741	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)C(=O)Nc1cccc(C(=O)N2CCc3ccccc32)c1	764388798	JHORBLUTKVTVSE-UHFFFAOYSA-N	443.463	1.993	50	20	IDGD	
COc1cc(F)c(NC(=O)C(=O)NNC(=O)CSc2ccccc2OC)cc1F	764397707	MFKZOOUHEHRMJE-UHFFFAOYSA-N	425.413	1.860	50	20	IDGD	
Cc1ccc(-c2n[nH]c(SCC(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)n2)cc1	764545295	UDKHJBOATOLKIO-UHFFFAOYSA-N	449.496	1.580	50	20	IDGD	
O=C(CCSc1ccc(F)cc1)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765735011	GPUQBKRYKKWECN-UHFFFAOYSA-N	444.532	1.913	50	20	IDGD	
CC[C@@H]1CCCC[C@H]1OCC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1	766339062	NADILMITTFPLBO-SJLPKXTDSA-N	425.551	1.748	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)CN1CCN(CC(=O)Nc2ccc(F)cc2)CC1	766828820	KLZTZYZWYQPJCA-UHFFFAOYSA-N	441.507	1.080	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNS(=O)(=O)c2ccc3c(c2)oc(=O)n3CC)cc1	767439013	ZOEVMPDICANDMB-CYBMUJFWSA-N	449.485	1.790	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1cccc(C#N)c1)C(=O)NNC(=O)c1cc(-c2ccccc2)[nH]n1	767822542	CZSZLCDGOZUUSM-CYBMUJFWSA-N	438.469	1.076	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)C2=S=C3CCCCCC3=C2)n(-c2ncccn2)n1	768236366	BDARTUMARUCJLQ-UHFFFAOYSA-N	439.501	1.039	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccccc2OCC(=O)Nc2cccnc2)o1	768241245	FOSJVAKBVJREAH-UHFFFAOYSA-N	437.412	1.400	50	20	IDGD	
C[C@H](OCc1ccccc1)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	768967039	NTAQRYYPTXKKGW-INIZCTEOSA-N	447.513	1.074	50	20	IDGD	
O=C(NNC(=O)c1nccn2c(Br)cnc12)c1nnc(O)c2ccccc12	769615267	PLZMXPBSDZUXJD-UHFFFAOYSA-N	428.206	1.215	50	20	IDGD	
CSCCNC(=S)NNC(=O)COc1ccc(I)cc1	769765986	PULNZESAIUWAQS-UHFFFAOYSA-N	425.317	1.528	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)c2c[nH]c3c(OC(F)(F)F)cccc3c2=O)c1	770063459	XBQRNTWYWRXJEW-UHFFFAOYSA-N	449.345	1.855	50	20	IDGD	
CN1CCN(C(=O)c2ccccc2NC(=O)C(=O)NNc2c(F)cccc2Cl)CC1	770810383	NHJAHSQWGQYGTJ-UHFFFAOYSA-N	433.871	1.949	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)c3cn(Cc4cccc(F)c4)nn3)nc21	770957476	AIEGTRMLBGKYRS-UHFFFAOYSA-N	425.428	1.823	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1c(C)c2cc(Br)ccc2oc1=O	772184419	DTVYEYUHAVFPLV-VIFPVBQESA-N	425.235	1.967	50	20	IDGD	
Cc1ncc(CCNC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)s1	772617664	JYUNLOBJOYKWGD-UHFFFAOYSA-N	437.547	1.423	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cnc3sc(C)cn3c2=O)cc1Br	772672329	BAJIONBWGORHBT-UHFFFAOYSA-N	437.275	1.910	50	20	IDGD	
CC(C)[C@@H](C(=O)NNC(=O)c1cc(F)ccc1Br)N1CCCS1(=O)=O	772688556	QVRDSWRARSAWHB-ZDUSSCGKSA-N	436.303	1.409	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)c2nnn(-c3cccc4ncccc34)c2C)c1	773069806	KMGNDCPUQZZWFX-UHFFFAOYSA-N	430.428	1.552	50	20	IDGD	
COc1ccc(C(=O)N2CCCC2)cc1NC(=O)C(=O)NNc1nccnc1C(C)C	773991647	JIVWWPRBQBKEQW-UHFFFAOYSA-N	426.477	1.926	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)N[C@H](CNC(=O)OC(C)(C)C)C3CCCC3)nc21	775127214	YJQGFBVPXVPKPX-CYBMUJFWSA-N	434.501	1.779	50	20	IDGD	
N#C/C(=C\c1ccc(O)cc1)C(=O)Nc1cccc(S(=O)(=O)N2CCNC(=O)C2)c1	776622743	MSYCNSMPAUWVES-XNTDXEJSSA-N	426.454	1.058	50	20	IDGD	
CCn1c(NNC(=O)c2cccc([N+](=O)[O-])c2N2CCOCC2)nc2ccccc2c1=O	776703157	SRRLWEJHZLLGOM-UHFFFAOYSA-N	438.444	1.918	50	20	IDGD	
CN(NC(=O)CN1C(=O)/C(=C\c2ccc(Br)cc2)SC1=S)C(N)=O	778415528	JLEGECWIYULDGK-UXBLZVDNSA-N	429.321	1.692	50	20	IDGD	
COCC(=O)N1CCc2cc(NC(=O)C(=O)NNC(=O)c3c[nH]c4ccccc34)ccc21	778706482	RZZMCAUMDNSIHT-UHFFFAOYSA-N	435.440	1.103	50	20	IDGD	
O=C(NNC(=O)c1cccc2nn[nH]c12)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	780978967	LNWKCEQDPUJVAC-UHFFFAOYSA-N	439.439	1.735	50	20	IDGD	
C[C@H](NCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)c1cccc(NS(C)(=O)=O)c1	781913036	VTQPJJNJJWLFBF-LBPRGKRZSA-N	435.462	1.078	50	20	IDGD	
Cn1c(=NNC(=O)C(=O)Nc2cccc(-c3nnnn3C3CC3)c2)sc2ccccc21	783349784	QFJIBFAGFSKHRO-UHFFFAOYSA-N	434.485	1.799	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2ccccc2-c2cc(F)c(F)c(F)c2)CCS(=O)(=O)C1	783426667	JBWFFHMODQZTMW-IBGZPJMESA-N	441.431	1.907	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)C(=O)Nc1nc(-c2ccccc2F)cs1	784001661	AGNYBICCYFFMSC-UHFFFAOYSA-N	431.405	1.058	50	20	IDGD	
COC(=O)c1sccc1NC(=O)C(=O)NNc1c(F)cc(C(=O)NC2CC2)cc1F	785100251	UXFPOBMETMCAGT-UHFFFAOYSA-N	438.412	1.787	50	20	IDGD	
Cc1ccc(Br)nc1C(=O)N1CCN(S(=O)(=O)CBr)CC1	787235170	JBHGUTZJUIGXBO-UHFFFAOYSA-N	441.145	1.593	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(O)c(C(=O)NNC(=O)NCc2ccc(Cl)cc2)c1	787435855	DLNJJXRBXPJGDR-UHFFFAOYSA-N	426.882	1.440	50	20	IDGD	
NS(=O)(=O)c1ccccc1NNC(=O)c1ccc2c(=O)n3c(nc2c1)CCCCC3	788222843	AWFVPFRRECCUIL-UHFFFAOYSA-N	427.486	1.527	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2cccc3ccn(C)c23)nc1	788337770	LNDNZDARXFLVAC-UHFFFAOYSA-N	430.490	1.342	50	20	IDGD	
Cn1cc(-c2ccc(NC(=O)NNC(=O)c3cc(Br)ccc3O)nn2)cn1	788785537	GOICFQGNSUHDHJ-UHFFFAOYSA-N	432.238	1.812	50	20	IDGD	
Cc1onc(-c2ccc(C(F)(F)F)cc2)c1C(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1	790492460	UZEVWHGPVHGZJE-LBPRGKRZSA-N	446.407	1.800	50	20	IDGD	
CCN1CCN(c2ccc(NC(=O)C(=O)NNc3cccc(F)c3[N+](=O)[O-])cc2)CC1	790999182	ZYXNBETVOKSROP-UHFFFAOYSA-N	430.440	1.958	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(NC(=O)C(=O)NNc2cccc(F)c2[N+](=O)[O-])c1	791000204	KJJMBPYWSHDVST-UHFFFAOYSA-N	425.398	1.066	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NC[C@H](C)NC(=O)OC(C)(C)C	792253120	FCZKZDLDXPYNBC-NSHDSACASA-N	442.542	1.145	50	20	IDGD	
CC[C@H](C)n1ncc(NC(=O)C(=O)NNC(=O)c2cc(Br)cn2C)c1C	792269849	WERFIFCQDKAMHT-VIFPVBQESA-N	425.287	1.663	50	20	IDGD	
COC(=O)c1cc(NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc(Cl)c1F	792503110	BDWIDONTCDJKSC-UHFFFAOYSA-N	433.787	1.708	50	20	IDGD	
CC(C)[C@H](NC(=O)NNC(=O)CNC(=O)OCc1ccccc1)c1nc(C2CC2)no1	792975582	DRWJNXKUSKFDTJ-INIZCTEOSA-N	430.465	1.901	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)C(=O)Nc1cccc(F)n1	793022413	XHSIEJFHXGHWIW-VIFPVBQESA-N	425.214	1.537	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=O)c2cccc(C)n2)c1	794074699	HQJFOGDMVVZKTA-UHFFFAOYSA-N	426.882	1.043	50	20	IDGD	
COC(=O)c1cc(F)cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)c1F	796991021	YRFOCBJJDLINRK-SECBINFHSA-N	439.346	1.444	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)cc1OC	797355144	ANNNDDRKBKCIDI-NSHDSACASA-N	449.847	1.689	50	20	IDGD	
CCCn1c(C)cc(/C=C(\C#N)C(=O)N(CCN2CCN(C)CC2)CC(=O)OC)c1C	798552729	LRGZSMJQZYZXQH-RCCKNPSSSA-N	429.565	1.671	50	20	IDGD	
COc1cc(F)cc(NNC(=O)C(=O)Nc2ccc(O[C@H]3CCN(C)C3=O)cc2C)c1	799262745	JIDFTUIZGAOXLO-SFHVURJKSA-N	430.436	1.834	50	20	IDGD	
O=C(/C=C/c1ccccc1)NCCCNC(=O)NNC(=O)c1cc([N+](=O)[O-])ccc1O	800759878	UQUVOAUALAZPCE-JXMROGBWSA-N	427.417	1.464	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)NC[C@@H]2CC(c3ccc4c(c3)CCO4)=NO2)c1	802336269	ADOOGLHKMPRMHO-INIZCTEOSA-N	430.486	1.844	50	20	IDGD	
COc1ccccc1[C@@]1(C)NC(=O)N(CC(=O)NNc2ccc3c(=O)[nH]ccc3c2)C1=O	803428657	CJKXJUKLRQPBDE-JOCHJYFZSA-N	435.440	1.447	50	20	IDGD	
Cn1cc(S(N)(=O)=O)cc1C(=O)NNc1ccc(-c2cccc(C(F)(F)F)c2)nn1	804210134	GNIPNYUGXMQJNQ-UHFFFAOYSA-N	440.407	1.905	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CCN2C[C@H](C)O[C@H](C)C2)cc(Br)c1OC	806339497	GKUFOJBRABXRBF-TXEJJXNPSA-N	444.326	1.727	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)Nc1ccc(F)c(N2CCCNC2=O)c1	806803707	DMPHUEVJECSIMV-UHFFFAOYSA-N	431.424	1.986	50	20	IDGD	
COCC(=O)NNC(=O)C(=O)Nc1nc(Cc2ccccc2Br)cs1	806980316	UKUIBLBEUIIHOJ-UHFFFAOYSA-N	427.280	1.229	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2cc(C(=O)OC)c3cc[nH]c3c2)n1	808941792	ZEEQKRLQTWDGGM-UHFFFAOYSA-N	425.449	1.673	50	20	IDGD	
N#Cc1cccc(S(=O)(=O)NCC(=O)NNc2nc(-c3ccc(Cl)cc3)no2)c1	810396639	CUJRXDXTIXTFTD-UHFFFAOYSA-N	432.849	1.683	50	20	IDGD	
O=C(COc1cc(C(F)(F)F)cc(C(F)(F)F)c1)NNC(=O)[C@H]1CCS(=O)(=O)C1	812205431	NCFPRDGYRKCMFZ-QMMMGPOBSA-N	448.341	1.685	50	20	IDGD	
CCc1ccc(NC(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)cc1S(N)(=O)=O	812938807	QHVMOJULYDFWPM-UHFFFAOYSA-N	441.535	1.295	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)Nc2ccccc2CN2CCNC2=O)cc1	812959694	NXSMLZGOXGOJLH-UHFFFAOYSA-N	432.506	1.611	50	20	IDGD	
Cc1ccn(-c2ccccc2NC(=O)C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)n1	813034003	UZWQYPJQWMNTIG-UHFFFAOYSA-N	442.501	1.513	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2ncsc2NC(=O)OCC)c2ccccc2c1=O	813366881	XOMVKLYBBVAHHY-UHFFFAOYSA-N	444.473	1.906	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)[C@H]2CCCO2)cccc1-c1nnc2n1CCCCC2	815779096	RATRQMBNWZWPHL-MRXNPFEDSA-N	426.477	1.245	50	20	IDGD	
O=C(CCN1C(=O)CCNC1=S)NNC(=O)COc1ccccc1-c1ccccc1	816805956	NETBHTRAITYWLE-UHFFFAOYSA-N	426.498	1.377	50	20	IDGD	
CCn1c(NNC(=O)CN2C(=O)COc3ccc(Cl)cc32)nc2ccccc2c1=O	818036416	VLYHHIHNZGDLLZ-UHFFFAOYSA-N	427.848	1.939	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)CNS(=O)(=O)c2cccc(C(F)(F)F)c2)c1	913445636	CYRWWVKSHTZJMY-UHFFFAOYSA-N	445.419	1.519	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)[C@@H](C)Oc2cccc(Br)c2)ccc1-n1cnnn1	914749305	MYOUYNCBOWVNDD-GFCCVEGCSA-N	445.277	1.962	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)[C@H]1CC(=O)N(c2ccccc2)C1	914988994	LIZVJQBHCWJMKS-ZDUSSCGKSA-N	445.859	1.706	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)c1ccc(Cl)c(I)c1	915279577	OHTUJGFNPBIJTA-QMMMGPOBSA-N	442.662	1.140	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NCCCN1C(=O)NC2(CCCC2)C1=O	915906183	PUFBTJKAVABLMM-ZDUSSCGKSA-N	435.456	1.178	50	20	IDGD	
O=C(NCC#Cc1cccc(C(F)(F)F)c1)NNC(=O)c1ccc(-n2cnnn2)cc1	916247755	YAGDTSJHULDNBR-UHFFFAOYSA-N	429.362	1.677	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NC[C@@H](C2CCCCC2)N(C)C)c2ccccc2c1=O	916449170	SJVRKJRKWCZICO-SFHVURJKSA-N	428.537	1.871	50	20	IDGD	
CN(CCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)C1CCCCC1	916456377	XKYKDEPGWRAFGH-UHFFFAOYSA-N	439.582	1.536	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCCC2)cc1	919820472	FNZFKPAQYWQJJQ-UHFFFAOYSA-N	445.541	1.802	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)NCCCN2C(=O)NC3(CCCCC3)C2=O)cc1	919902023	NXJVHWKDEMJJBO-UHFFFAOYSA-N	445.520	1.603	50	20	IDGD	
O=C(CN1CCCC1=O)NNC(=O)c1ccc(NC(=O)c2cc(F)cc(F)c2)cc1O	920433500	ULUNTQTWDKRLJP-UHFFFAOYSA-N	432.383	1.306	50	20	IDGD	
COCCCNC(=O)NNC(=O)/C(=C\c1cccs1)n1nnnc1-c1ccccc1	920862298	WXSLMKSRSLSVFX-DTQAZKPQSA-N	427.490	1.767	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)c1ccc(N2CCOC2=O)cc1	920969997	DLVIIKHPJJFMGE-ZDUSSCGKSA-N	446.485	1.752	50	20	IDGD	
CC(C)CN1C(=O)/C(=C/NNC(=O)CSc2nc3ccccc3o2)C(=O)NC1=S	920977533	CHZPHWCRXGCHEY-YRNVUSSQSA-N	433.515	1.324	50	20	IDGD	
CC(=O)c1cccc(S(=O)(=O)NCC(=O)NNC(=O)Cc2cccc3ccccc23)c1	1118275322	OZJDVDPZMAGKPZ-UHFFFAOYSA-N	439.493	1.711	50	20	IDGD	
CC(=NNC(=O)CCN1CCC(C)CC1)c1ccc(S(=O)(=O)N2CCOCC2)cc1	1318441261	OBMVBXGHMYKAKE-UHFFFAOYSA-N	436.578	1.670	50	20	IDGD	
CS(=O)(=O)Cc1c(C(=O)NNc2nccc(N3CCOCC3)n2)oc2ccccc12	1319162988	IOIXXFMYGGREAR-UHFFFAOYSA-N	431.474	1.361	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2cc3nc(O)[nH]c3cc2Br)cc1	1319806836	BPKGGJARBKKGRT-UHFFFAOYSA-N	441.263	1.663	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2C(=O)N[C@](C)(c3ccc(C)cc3)C2=O)cc1OC	1337084134	DETHPGVRMRKLHO-JOCHJYFZSA-N	440.456	1.240	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)c1n[nH]cc1I	1347729928	XDWBMDOISNVARP-UHFFFAOYSA-N	435.247	1.022	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cn4ccc(Cl)cc4n3)C2)C1	1778063128	XFDPFBDJWTUXBQ-LIRRHRJNSA-N	441.315	1.685	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)CCc3ccc(OC)cc3F)C2)C1	1778286562	BYLXHKDKBTXMJR-UWJYYQICSA-N	442.915	1.851	50	20	IDGD	
COc1cc(CCC(=O)N2CCO[C@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)ccn1	1779294734	XSGLJPQWXQNUDE-NRFANRHFSA-N	435.597	1.704	50	20	IDGD	
COCc1c[nH]c(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](F)Br)C3)c1	1780047855	CYJNEYSVBMEEBU-RVKKMQEKSA-N	446.317	1.979	50	20	IDGD	
CC(=O)N/C(C)=C/C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@](C)(Cl)CCl)C1	1780716727	NVBOFGXMKOYGRV-APNFSWDMSA-N	434.364	1.777	50	20	IDGD	
CC(C)NC(=O)OC(C)(C)C(=O)N1CC[C@]2(CN(C(=O)[C@H](C)Br)CCO2)C1	1781023913	PUVRRUFPMJSGKR-UGSOOPFHSA-N	448.358	1.513	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2c3c(nn2C)CCC3)C1	1781372329	RBJNWVSFTLCEDW-QLVMHMETSA-N	438.956	1.290	50	20	IDGD	
C[C@@H](Oc1ccccc1)C(=O)N1CC[C@]2(CN(C(=O)[C@@H](F)Br)CCO2)C1	1781378583	KATLOJPJSPDBCY-DDUZABMNSA-N	429.286	1.974	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CN1CCOC1=O)C2	1781897588	MMENEBARLDJZMV-HBUWYVDXSA-N	446.342	1.126	50	20	IDGD	
COc1ccccc1CC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](C)Br)CCO2	1783330766	SNUFMEZSRAPQCI-LIRRHRJNSA-N	425.323	1.851	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3nc(C)oc3C(F)(F)F)CCO2)C1	1783876508	WVSOLJGGLJXGSI-MEDUHNTESA-N	439.818	1.699	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3n[nH]c4c(Cl)cccc34)CCO2)C1	1783882012	PAEFREIGUNFYPF-AUUYWEPGSA-N	441.315	1.914	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/c3cnccn3)C[C@@H]21	1783974424	NUFKEUUVRIHLIW-CIISDZTESA-N	437.338	1.501	50	20	IDGD	
CCSc1ncccc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]2C1	1784084457	SMXVZDMKXMRIOR-TUUVXOQKSA-N	427.954	1.387	50	20	IDGD	
Cn1nc2c(c1C(=O)N1CC[C@H]3CO[C@@H](CNC(=O)CCBr)[C@H]3C1)CCC2	1786407064	DCPDTOXDEYJGQO-NOLJZWGESA-N	439.354	1.287	50	20	IDGD	
Cc1cc(C(=O)Nc2ccc(C3(NC(=O)c4ccc(B(O)O)cc4)CCC3)cc2)nn1C	1787357004	OUWXVFNDWYSMES-UHFFFAOYSA-N	432.289	1.470	50	20	IDGD	
CCn1nccc1C(=O)Nc1ccc(C2(NC(=O)c3cnccc3C(=O)NN)CCC2)cc1	1787505704	JKZWTQHCTSJGPL-UHFFFAOYSA-N	447.499	1.963	50	20	IDGD	
COc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)CBr)C[C@@H]32)ccn1	1788904168	RCZMXCFATUNJNF-TUUVXOQKSA-N	440.338	1.715	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3snnc3C3CC3)C[C@@H]21)[C@@H](F)Br	1789922201	AHAJKAWVGVAVBR-AYGWYOGXSA-N	447.330	1.699	50	20	IDGD	
Cc1cccnc1CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]2C1	1789922281	JRECLYJSPYHQPO-ILXVDBEPSA-N	442.329	1.993	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C3CCC4(CC3)OCCO4)C[C@@H]21)C(Cl)Cl	1791295839	FLUWDGROQNIDGU-KKUMJFAQSA-N	435.348	1.703	50	20	IDGD	
CO[C@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1ccccc1	1795376872	FALNUKURDVIKPS-QRJUGERDSA-N	429.286	1.654	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)c1cc(F)cnc1Cl	1796188673	HDFWSBFTTWWCDB-MUJYYYPQSA-N	431.660	1.120	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)c1ccc2scnc2c1	1796191336	AAMUBNOVEPPYQM-BCDXTJNWSA-N	435.314	1.542	50	20	IDGD	
Cn1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Br)C3)c(C(F)F)n1	1796702750	VCEIVHHJMHYTNR-UJYYTQATSA-N	439.232	1.251	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnc2ccccn12	1797471913	BKBLECWGHSPFLD-CKFWPPNZSA-N	447.499	1.720	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](COC(C)=O)OC(C)=O	1798476722	IBMFTXWGANCXQX-YIDVYQOGSA-N	447.326	1.293	50	20	IDGD	
CN(C)c1cccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Br)C3)c1	1798886305	ZQURXIZQSXHKGE-OCVGTWLNSA-N	428.302	1.646	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)CNC(=O)OC(C)(C)C)C2	1799265101	ZNVMKBBDJWNCMV-RBGFHDKUSA-N	431.961	1.754	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)c1n[nH]c2c(Cl)cccc12	1799897809	XOXIQKUEHLZFBE-RDBQEKCUSA-N	427.288	1.019	50	20	IDGD	
Cc1c(F)ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)Br)c1N	1800756813	RVFADAGHUVYJMD-OVZMXSCWSA-N	428.302	1.703	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)nc3ccccc13)C2	1800757608	MTXWDLIWBIWONP-ZIVKBKJYSA-N	448.317	1.927	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)[C@H]1CCc2ccccc2O1	1800954599	WIKXBQOENACJRQ-IMPMIVQMSA-N	441.297	1.660	50	20	IDGD	
COC[C@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H]1CC(=O)N(C3CCCC3)C1)C2	1802271164	YOEGDORLVZNRME-YGTYDBBMSA-N	425.957	1.670	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccnc3ncccc23)[C@H]1c1cccnc1)[C@@H](O)CCl	1803147823	MEEFBHUDOASWTR-SNRMKQJTSA-N	439.903	1.944	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2cccn(C)c2=O)[C@@H]1c1cccnc1	1803835123	HYTRYAZLMZANEZ-SZMVWBNQSA-N	432.908	1.354	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CC1Cc2ccccc2C1	1804503636	HZCZJGLXGVABRY-WKCHPHFGSA-N	426.561	1.803	50	20	IDGD	
Cc1nocc1C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1	1805823314	CONNYGSRYDQZOD-KXBFYZLASA-N	449.471	1.010	50	20	IDGD	
O=C(/C=C\C(=O)NC1CC1)NC[C@@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1	1810123634	DZMOWQMIYKNFBM-PGHKVSDBSA-N	449.349	1.707	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)C23CC(C2)C3)[C@H]1c1cccnc1	1810309091	OZEQGTZHLCVMIS-UYEBVHNJSA-N	434.500	1.200	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)c1ccc2nn[nH]c2c1	1812296631	DGIZWKJCIACFIM-BMGDILEWSA-N	428.880	1.272	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)[C@@H]2CCNC(=O)C2)[C@H]1c1cccnc1	1813136924	PWWMOXVIWSIUNS-TZDHZFECSA-N	437.338	1.397	50	20	IDGD	
C[C@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)CCSC(=N)N)sc2C1	1814952168	PQLRYFHWCHKVHK-YUMQZZPRSA-N	434.385	1.855	50	20	IDGD	
C[C@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1)n1ccnc1	1815006653	GHUJKJUVDMQTQR-ZBFHGGJFSA-N	430.513	1.233	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(F)c1)CC2)c1cccc(B(O)O)c1	1815361185	ZOZQCELTXUVYTQ-MRXNPFEDSA-N	439.277	1.502	50	20	IDGD	
CC(C)CNC(=O)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](C)Br)CC2	1817331008	WUEPYZNJDLLLQX-UWVGGRQHSA-N	431.356	1.611	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)CCc2ccco2)[nH]n1)c1ccc(B(O)O)cc1	1817471057	QMJYIYYMZRLTGI-LJQANCHMSA-N	436.277	1.621	50	20	IDGD	
Cc1n[nH]c(C)c1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1819663096	QMZVOXXSLKFARQ-QGZVFWFLSA-N	436.281	1.049	50	20	IDGD	
O=C(N[C@H]1CCc2nc(NC(=O)c3ccccc3F)sc2C1)c1ccc(B(O)O)cc1	1821848284	ANAUARSDHISUFX-AWEZNQCLSA-N	439.277	1.502	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCS(C)(=O)=O)[nH]n1	1822192386	SWBAKMUWASDRFK-ZYHUDNBSSA-N	435.344	1.620	50	20	IDGD	
COc1ncccc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1	1822413209	OFSRFGCNGQMYIK-INIZCTEOSA-N	443.508	1.492	50	20	IDGD	
O=C([C@@H](O)CCl)N1CCC([C@@H]2CCCCN2C(=O)c2cnc(OCF)cn2)CC1	1825545323	RVNODCFODWZRQH-HOTGVXAUSA-N	428.892	1.615	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)CSc3nc[nH]n3)sc2C1	1826674345	BYQMQBACGFSBKW-JGVFFNPUSA-N	445.368	1.749	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)COC3CCCCC3)CCO2)C1	1830383782	JLROMGWUHLICNW-PXNSSMCTSA-N	432.945	1.046	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CCCCC1(F)F)CCO2	1831726432	KRDGPXKNZVPRQM-VKJFTORMSA-N	438.899	1.522	50	20	IDGD	
CC(C)[C@H](S)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1	1831871979	YEZCUBJDJNXWOL-PXNSSMCTSA-N	426.627	1.934	50	20	IDGD	
Cc1ncccc1CCC(=O)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1832640073	MAKVPVJRPITLPB-LJQANCHMSA-N	430.332	1.583	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)COc3cccnc3)CCO2)C1	1832668739	VBECUFLVEHSXNG-HXUWFJFHSA-N	425.913	1.182	50	20	IDGD	
COc1ncccc1CCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1833000357	PWZIKEALWFAZLC-VQIMIIECSA-N	429.876	1.014	50	20	IDGD	
C[C@@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)c3cc(O)n[nH]3)CC2)CC1	1833263430	LDOVLKMFKOAQQO-LBPRGKRZSA-N	442.358	1.332	50	20	IDGD	
Cn1cccc1C(=O)NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1	1834097644	MVUVCSFEZGTWMY-UHFFFAOYSA-N	425.371	1.995	50	20	IDGD	
N=C(N)SCCC(=O)N1CCC(N2CCC(NC(=O)CCBr)CC2)CC1	1834421576	AIHUONSJULANQZ-UHFFFAOYSA-N	448.431	1.360	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cc4ncccn4n3)CC2)CC1	1835543165	QKPYAPIODQSSLM-KRWDZBQOSA-N	448.955	1.168	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCC(N2CCC(NC(=O)c3cccnn3)CC2)CC1	1835895578	BYKJFENHVFYDHF-IBGZPJMESA-N	428.364	1.898	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)[C@H]3Cc4ccccc4O3)CCO2)C1	1836644842	UTYAPQWGMFMRFA-GCJKJVERSA-N	436.936	1.712	50	20	IDGD	
O=C(c1nccc2[nH]ccc12)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836718061	QZBHSPWSJVKKDH-SFHVURJKSA-N	434.924	1.775	50	20	IDGD	
CC#CC[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1)c1ccccc1	1837611239	FOHUOEPBBNIWIP-SXWKCWPCSA-N	448.947	1.240	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(O)ccc3F)C2)C1	1837715068	UGOKIRLPXBGZOY-HXUWFJFHSA-N	440.544	1.453	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)CCc3nc(N)n[nH]3)CC2)CC1	1838367191	TWYRHFIQPFBSLQ-OAHLLOKOSA-N	426.949	1.336	50	20	IDGD	
CCc1cc(C(=O)N2CCC(OC3CCN(C(=O)[C@H](Cl)COC)CC3)CC2)nn1C	1838503746	IXQWFWROKOIWSZ-GOSISDBHSA-N	440.972	1.849	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)COc3ccc(F)cc3)C2)C1	1839143270	RFWWWIXUMHEMKL-FXAWDEMLSA-N	428.888	1.678	50	20	IDGD	
O=C(c1ccc(O)cc1F)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839201743	HZISFEJJQVIXPZ-RHSMWYFYSA-N	449.248	1.292	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(F)ccc3Cl)CCO2)C1	1839327609	UBKFHGKSAQIKPK-VQIMIIECSA-N	449.306	1.803	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)C[C@H]3C[C@@H]4CC[C@H]3C4)CCO2)C1	1839915829	BIBHSQPLQKOLGE-ATOXUGOLSA-N	428.957	1.523	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3c(F)cccc3F)C2)C1	1840154241	QIRPUYFRRITPFG-BFUOFWGJSA-N	432.851	1.289	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H](C)Cn3ccnc3)CCO2)C1	1840429523	VYTXBQOMHZPUGM-ABSDTBQOSA-N	426.945	1.383	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C1CC1)CCO2	1840637715	RZAAFGRCGXWPEC-IXNCKXOBSA-N	431.439	1.738	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@H](CCO)NC(=O)OC(C)(C)C)C2	1841665909	AISOLFGQKZNWTP-HUUCEWRRSA-N	431.961	1.873	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2	1841669769	UYVDBNSMXBGWPW-GOSISDBHSA-N	449.983	1.944	50	20	IDGD	
Cc1cc(C(N)=O)cc(C)c1C(=O)N1CC2(CCCN2C(=O)[C@H](F)Br)C1	1845217983	GQPSLSYFRZKQJY-AWEZNQCLSA-N	426.286	1.910	50	20	IDGD	
Cn1nncc1C(=O)N1CC2(CCCN2C(=O)[C@@H](Br)Cc2ccccc2)C1	1845940264	GMAYLCBVGVUIKG-HNNXBMFYSA-N	432.322	1.638	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1ccc(O)nc1	1848099030	AFCJNHRBAYLMQK-KKUMJFAQSA-N	438.912	1.735	50	20	IDGD	
COc1cn(-c2ccccc2)nc1C(=O)NNC(=O)c1sc(N2CCOCC2)nc1C	12702048	SNAKUAWOUYDWCR-UHFFFAOYSA-N	442.501	1.557	50	20	IDGD	
CCOC(=O)c1cc(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc([N+](=O)[O-])c1	12802170	PTBALSUVNBYTLD-UHFFFAOYSA-N	449.445	1.139	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)c2ccc(Cl)c(N3CCCC3=O)c2)c2ccccc2c1=O	14888064	YJSZBEBYCUIJFT-UHFFFAOYSA-N	439.859	1.789	50	20	IDGD	
Cc1ccc(S(C)(=O)=O)cc1C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	15314740	GGLBILVHVAUVSJ-UHFFFAOYSA-N	444.557	1.372	50	20	IDGD	
Cc1ccc(N2C[C@H](C(=O)NNC(=O)c3csc(N4CCOCC4)n3)CC2=O)cc1F	26352599	FXFMCROSLXKFSW-CYBMUJFWSA-N	447.492	1.241	50	20	IDGD	
C[C@H]1CC(C)(C)C[C@]2(C1)NC(=O)N(CC(=O)NNC(=O)Cc1c[nH]c3ccccc13)C2=O	45591533	UWZXYNQFZITODI-PSLXWICFSA-N	439.516	1.995	50	20	IDGD	
COc1ccc(C=NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)cc1F	725723594	JDIZMTPFYCLOAS-UHFFFAOYSA-N	449.504	1.938	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)CSc1nncn1-c1cccc(Cl)c1	725740298	DBZMROHPTWVVDB-UHFFFAOYSA-N	434.865	1.183	50	20	IDGD	
O=C(NNC(=S)NCCc1ccc(Cl)cc1Cl)N[C@H]1CCS(=O)(=O)C1	726476460	HOCDGNINUBDCAZ-NSHDSACASA-N	425.363	1.401	50	20	IDGD	
CCCOc1c(Br)cc(C=NNC(=O)[C@@H](C)NS(C)(=O)=O)cc1OC	728435979	BLOAOLPTBPGKGF-SNVBAGLBSA-N	436.328	1.634	50	20	IDGD	
C#CCNC(=O)CN1CCN(C(=O)/C(C#N)=C/c2cc(C)n([C@@H](C)COC)c2C)CC1	728533514	LUVIXAWMLKTGFY-LANLRWRYSA-N	425.533	1.113	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)CNC(=O)COc2ccccc2)c1	728609237	TXKBZEWVBOSSDQ-UHFFFAOYSA-N	436.262	1.414	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)CNC(=O)c2ccc(F)c(F)c2)c1	728609295	XOLLVNCWKAHDES-UHFFFAOYSA-N	442.216	1.927	50	20	IDGD	
CN(CCCC(=O)NNC(=O)Cc1ccccc1F)S(=O)(=O)c1ccc(F)cc1	731329345	DHWYEMSCWQTZCN-UHFFFAOYSA-N	425.457	1.756	50	20	IDGD	
COc1ccccc1C(=O)NN=C(C)c1ccc(S(=O)(=O)NCCCC(=O)O)cc1	731488165	XJRAOSKQSFZKBS-UHFFFAOYSA-N	433.486	1.992	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)NCc2ccc(OCCN3CCCC3)cc2)cc1	732471888	HEZGOKBYEHEMEG-UHFFFAOYSA-N	437.500	1.942	50	20	IDGD	
O=C(CCCc1cccs1)NNC(=O)CCNS(=O)(=O)c1cccc([N+](=O)[O-])c1	732556310	RZHYRAPQAOAAFZ-UHFFFAOYSA-N	440.503	1.495	50	20	IDGD	
CS(=O)(=O)Nc1cc2ccccc2cc1C(=O)NNC(=O)[C@H]1COc2ccccc2O1	732923310	VGMSEJIAQKUTCZ-LJQANCHMSA-N	441.465	1.812	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@@H]2C(=O)NNc2nc3ccccc3c(=O)n2C)s1	733260977	VBOGPAJDDYFKNM-OAHLLOKOSA-N	447.542	1.600	50	20	IDGD	
COc1cccc(CNC(=O)NNC(=O)CNC(=O)c2ccco2)c1OC1CCCC1	733341471	CEBRBWWKCPNQPS-UHFFFAOYSA-N	430.461	1.870	50	20	IDGD	
CCS(=O)(=O)C[C@H](C)N(C)C(=O)NNC(=O)c1ccc(OC)c(Br)c1	733348151	LOIFOEALUGABNH-JTQLQIEISA-N	436.328	1.567	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)c1cccc(NC(=O)[C@H]2CCCO2)c1	734241542	PRJGIYCOQGAKEF-OAHLLOKOSA-N	435.481	1.273	50	20	IDGD	
COc1ccc([C@H]2[C@H](C(=O)NNC(=O)COc3ccc(C#N)cc3)CCC(=O)N2C)cc1	734417085	JOKKGMGKFIVTLZ-KNQAVFIVSA-N	436.468	1.703	50	20	IDGD	
COc1ccc([C@H]2[C@H](C(=O)OCC(=O)NNC(=O)c3ccccc3)CCC(=O)N2C)cc1	734618260	TYYVSNYKBAGTIC-NQIIRXRSSA-N	439.468	1.609	50	20	IDGD	
COc1ccc(S(=O)(=O)C[C@@H](C)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1	735012768	HKWJPUVSFODDBP-OAHLLOKOSA-N	442.497	1.752	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)NCc1ccccc1S(=O)(=O)N1CCN(C)CC1	735088277	GCUGDYMAKOCULM-UHFFFAOYSA-N	445.545	1.075	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)CCCOc2ccccc2)CC1	735118572	XDBOOZSIQPPIMS-UHFFFAOYSA-N	433.534	1.320	50	20	IDGD	
O=C(NCc1nc(-c2ccc(F)cc2)n[nH]1)NNC(=O)c1nn(-c2ccccc2)cc1O	741417644	UKKUGZWHEBPUFZ-UHFFFAOYSA-N	436.407	1.646	50	20	IDGD	
O=C(CSc1nnc2n(Cc3ccccc3)c(=O)c3ccccc3n12)NNC(=O)C1CC1	742444723	DGHDCWNDKSQWMF-UHFFFAOYSA-N	448.508	1.742	50	20	IDGD	
C[C@H]1CN(C(=O)NNC(=O)CNC(=O)c2cccs2)CCN1C(=O)OC(C)(C)C	743576603	HBTQGIMABOFFFC-LBPRGKRZSA-N	425.511	1.160	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)c2cnn3c(-c4ccccc4)ccnc23)c1	744733155	XXBOXAAIKDGFSF-UHFFFAOYSA-N	440.419	1.886	50	20	IDGD	
COc1ccc(Br)c(C(=O)OCC(=O)NNC(=O)c2cccs2)c1N	745289853	RZVVYYMDFIZWRA-UHFFFAOYSA-N	428.264	1.719	50	20	IDGD	
Cc1noc(C)c1S(=O)(=O)NC1(C(=O)NNC(=O)CCc2ccccc2)CCCC1	746192548	YEHUCACNVPBPQP-UHFFFAOYSA-N	434.518	1.663	50	20	IDGD	
COc1sc(/C=C(\C#N)C(=O)c2c(N)n(C)c(=O)n(C)c2=O)cc1Br	746520131	KFZSWKUFOHBPRQ-QPJJXVBHSA-N	425.264	1.289	50	20	IDGD	
COc1ccc(S(=O)(=O)C[C@@H](C)C(=O)NNC(=O)Cc2cn3ccccc3n2)cc1	746547989	AVYYIGPLPFPLTM-CQSZACIVSA-N	430.486	1.143	50	20	IDGD	
O=C(CCc1nc(O)c2c3c(sc2n1)CCC3)NNC(=O)Cc1cn2ccccc2n1	746701857	NNLOJCBZKNTHOP-UHFFFAOYSA-N	436.497	1.856	50	20	IDGD	
O=C(NNC(=O)[C@H]1C[C@@H]1c1cccc(Br)c1)c1ccc(-n2cnnn2)cc1	747411584	CMUMRPDRCXSAES-CVEARBPZSA-N	427.262	1.990	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1ccc(C(=O)NNC(=O)Cc2ccncc2)cc1	747428893	ZAABXIZBUTZQKU-UHFFFAOYSA-N	440.481	1.895	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)NCc1nnc2c(Cl)cc(C(F)(F)F)cn12	747491608	WJSBIZMVGBOLDL-UHFFFAOYSA-N	427.774	1.870	50	20	IDGD	
Cc1c(Cl)cc(C(=O)O)cc1S(=O)(=O)NNC(=O)c1ccc2c(c1)OCCO2	747603454	YGBSDPPIHZZLHJ-UHFFFAOYSA-N	426.834	1.741	50	20	IDGD	
COc1cc(OC)c(S(=O)(=O)NNC(=O)c2ccc(C#N)cc2)cc1Br	747608565	HKVAUAZOGXEBLJ-UHFFFAOYSA-N	440.275	1.961	50	20	IDGD	
COCCNS(=O)(=O)c1c[nH]c(C(=O)NNc2ccc(F)cc2Br)c1	748074544	DHURNJUUFNDPLB-UHFFFAOYSA-N	435.275	1.598	50	20	IDGD	
O=C(NNC(=O)c1ccc(S(=O)(=O)Nc2ccccc2F)cc1)C(=O)N1CCCC1	748247086	UDLGVMQUKJDHDL-UHFFFAOYSA-N	434.449	1.010	50	20	IDGD	
CC(C)NC(=O)C(=O)NNC(=O)c1nnn(-c2ccc(Br)cc2)c1C1CC1	748698668	FWYVXWPSQPJXRM-UHFFFAOYSA-N	435.282	1.193	50	20	IDGD	
CC(C)Oc1ccc(-c2nc(C(=O)NNC(=O)N[C@H]3CCS(=O)(=O)C3)cs2)cc1	749173492	LNHIGIXREXHILX-ZDUSSCGKSA-N	438.531	1.728	50	20	IDGD	
COc1ccc(S(=O)(=O)NCCC(=O)NNC(=O)CCc2ccccc2)cc1OC	749851926	RWXAMPVFJMBOIG-UHFFFAOYSA-N	435.502	1.152	50	20	IDGD	
CCn1c(CCC(=O)NNC(=O)CC2CCCC2)nc2cc(S(=O)(=O)N(C)C)ccc21	749951478	IOTCSOWHRSMCKN-UHFFFAOYSA-N	449.577	1.967	50	20	IDGD	
O=C(Cc1csc(N2CCOCC2)n1)NN[C@H](C(=O)N1CCCCC1)c1ccccc1	750198128	MFRVEBXXEZZHCL-FQEVSTJZSA-N	443.573	1.897	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)c1occc1CS(=O)(=O)c1ccccc1	751209914	YBNWROSNFWTNPA-UHFFFAOYSA-N	447.494	1.506	50	20	IDGD	
CCOC(=O)[C@@H]1Cc2cc(S(=O)(=O)NNC(=O)c3c[nH]c4ccccc34)ccc2O1	751538751	ONDBLWHPWDVVPI-SFHVURJKSA-N	429.454	1.658	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNS(=O)(=O)c1ccc(Cl)c(C(=O)OC)c1	757474469	TZRNEQVFNLPORD-UHFFFAOYSA-N	442.877	1.914	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)Nc2ccc(CS(C)(=O)=O)c(F)c2)c1	757674357	FYDDIZCBVWFBIS-UHFFFAOYSA-N	425.438	1.854	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@@H]2CN(C)Cc3ccccc32)cc1	757736522	YSLMXIJVRYERLM-LJQANCHMSA-N	445.545	1.133	50	20	IDGD	
C[C@@H]1C[C@H](NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)CN1Cc1ccccc1	757773559	PIJHNSULYFWWBQ-QAPCUYQASA-N	430.530	1.697	50	20	IDGD	
Cc1csc(SCc2ccccc2C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)n1	758040006	NBWRXVIBZUIDFQ-NSHDSACASA-N	428.561	1.443	50	20	IDGD	
Cc1onc(-c2ccncc2)c1C(=O)N1CCN(S(=O)(=O)CBr)CC1	758522449	IGPYAJIIAMIQCN-UHFFFAOYSA-N	429.296	1.485	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ccc(C(F)(F)F)cn2)CC1)C(=O)Nc1ccccn1	758826748	DMGZGAZXNGGJPN-UHFFFAOYSA-N	436.394	1.498	50	20	IDGD	
O=C(NCCOc1cccc(C(F)(F)F)n1)NNC(=O)c1ccc2c(c1)OCCO2	758950072	ZEBJHLHTRLYKEK-UHFFFAOYSA-N	426.351	1.895	50	20	IDGD	
N#CCc1ccc(C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)cc1	759606000	NTBIMGVWEKLXGL-UHFFFAOYSA-N	425.920	1.985	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)NC[C@H]1CC(=O)N(Cc2ccccc2)C1	759683540	NXZFJEQPWCPFFH-GOSISDBHSA-N	440.500	1.843	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)C(=O)c3ccc(Cl)s3)cc2)CC1	760463454	QZHXGEAEHMLEDM-UHFFFAOYSA-N	442.950	1.664	50	20	IDGD	
COCCS(=O)(=O)c1ccc(C(=O)NNC(=O)CSc2ccccc2OC)cc1	761633881	UDRLXBQPAPMGKN-UHFFFAOYSA-N	438.527	1.669	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)c2ccc3nnc(O)n3c2)c2ccccc2c1=O	762681631	PRJFWFGQJXYDLG-UHFFFAOYSA-N	435.444	1.410	50	20	IDGD	
O=C(CCn1c(S)nnc1-c1cccs1)NNc1nccc(N2CCOCC2)n1	762854198	WWJJJXPLFKFLNM-UHFFFAOYSA-N	432.535	1.455	50	20	IDGD	
COc1cc(Br)cc(NC(=O)C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c1	763444875	CJJHZXATYXERJK-UHFFFAOYSA-N	437.206	1.766	50	20	IDGD	
Cc1cc(Cl)ccc1OCCCC(=O)NNC(=O)C(=O)Nc1c(C)ccn(C)c1=O	763500059	KIIZNTBYSFUGRG-UHFFFAOYSA-N	434.880	1.601	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)c(C)c1	763686507	MTJVAOYYUBLZHS-UHFFFAOYSA-N	435.864	1.839	50	20	IDGD	
CCCc1ccccc1NC(=O)C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	763718391	KQJBHJNCXDFFPR-UHFFFAOYSA-N	432.502	1.289	50	20	IDGD	
CC(C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)cc1	763728214	JLVRWPRDSSTNOS-UHFFFAOYSA-N	437.500	1.364	50	20	IDGD	
COC(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)CSc2ccc(Cl)cc2)cc1	763734061	KXJHLYUFKBXNBW-UHFFFAOYSA-N	435.889	1.934	50	20	IDGD	
COCCn1ncc2ccc(NC(=O)C(=O)NNC(=O)c3cc(OC)cc(OC)c3)cc21	763773395	XDEDMDHYIRZZHX-UHFFFAOYSA-N	441.444	1.100	50	20	IDGD	
CN(C)C(=O)c1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)c1cc2c(s1)CCC2	763781225	GZZBCPIAVRXIEW-UHFFFAOYSA-N	434.905	1.992	50	20	IDGD	
CCOc1cc2c(cc1NC(=O)C(=O)NNC(=O)COc1ccc(C)cc1)O[C@H](C)C2	763812475	GNDFUMJRFUGOCD-CQSZACIVSA-N	427.457	1.882	50	20	IDGD	
CCNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)c1	763838554	AIUUUPIQTHAWQP-HNNXBMFYSA-N	426.473	1.607	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)C(=O)Nc1cccc(CN2CCCCC2=O)c1	763839253	HRKXTAOEHFAREN-UHFFFAOYSA-N	442.447	1.503	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)c(F)cc1F	763863642	ATEZXQWVSNZTNN-VIFPVBQESA-N	439.346	1.444	50	20	IDGD	
Cc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccc(F)cc1	763873834	ZGDFWJBZJUBVGP-ZDUSSCGKSA-N	430.436	1.389	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1ccnn1-c1ccc(Cl)cc1	764004302	PGIRUSYARVSBDS-UHFFFAOYSA-N	441.831	1.697	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccccc2CC(F)(F)F)c1	764077142	HTISRRIMHDCNSW-UHFFFAOYSA-N	443.403	1.595	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2cccc(Cl)c2N2CCOCC2)c1O	764130225	DSRRNXQQPVCBLR-UHFFFAOYSA-N	448.863	1.291	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1c(SC)cnn1-c1ccccc1	764139287	QXGFKJFVBBOMAJ-UHFFFAOYSA-N	439.497	1.931	50	20	IDGD	
COC(=O)c1cc(Cl)ccc1NC(=O)C(=O)NNC(=O)Cn1ccc2ccccc21	764245175	NYKDNTJTTNZQJH-UHFFFAOYSA-N	428.832	1.867	50	20	IDGD	
Cc1ncsc1C(=O)NNC(=O)C(=O)Nc1cccc(I)c1	764247533	SFYIALXWPINKOD-UHFFFAOYSA-N	430.227	1.456	50	20	IDGD	
CCn1nnnc1-c1cccc(NC(=O)C(=O)NNC(=O)c2cccc3ncccc23)c1	764257284	BKVZFMUYOOXVKZ-UHFFFAOYSA-N	430.428	1.308	50	20	IDGD	
O=C1CCc2cc(NC(=O)C(=O)NNC(=O)c3cc(F)ccc3Br)ccc2N1	764270217	IKXNVDATACWUCD-UHFFFAOYSA-N	449.236	1.873	50	20	IDGD	
COCC(=O)NNC(=O)C(=O)Nc1ccc2c(c1)CCC(=O)N2Cc1ccc(Cl)cc1	764299314	CPZKLGSJVKPTIL-UHFFFAOYSA-N	444.875	1.552	50	20	IDGD	
COc1cc(F)c(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3OC)[nH]n2)cc1F	764377930	SXILTGIWBGDWHU-UHFFFAOYSA-N	445.382	1.772	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(-n2nccc2C(F)(F)F)cc1	764398900	IKRNLRFUYLFRIW-LLVKDONJSA-N	443.382	1.029	50	20	IDGD	
CC(=O)[C@H]1CC(C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)=NN1c1ccccc1	765312872	FNLFNVHMHRISQQ-QGZVFWFLSA-N	431.493	1.663	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)c1cc(-c2ccco2)[nH]n1	765754541	KBCUXPLFOJNCEX-UHFFFAOYSA-N	442.907	1.902	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)c2ccnc(CNC(=O)OC(C)(C)C)c2)nc2ccccc21	766136621	WLGGPBIOEUIYOI-UHFFFAOYSA-N	438.488	1.997	50	20	IDGD	
Cc1ccc(C(=O)C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)cc1	766659289	AFPLOPRYPDVAJA-UHFFFAOYSA-N	428.920	1.796	50	20	IDGD	
C[C@]1(CNC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)CCO[C@@H]1C1CC1	768529560	ZSISROILKFWPQZ-FYYLOGMGSA-N	429.565	1.734	50	20	IDGD	
CSCCNC(=S)NNC(=O)CCCNS(=O)(=O)c1ccc2c(c1)CCCC2	769769325	SENCKMVTZROCSR-UHFFFAOYSA-N	444.648	1.482	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)Nc2ccc(N3CCOCC3)cc2N2CCOCC2)n1	769934217	PTBHXVLGSJVOER-UHFFFAOYSA-N	427.509	1.915	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)Nc1ccn(CCS(C)(=O)=O)n1	770511790	CIPKKQHVVMYGEV-LLVKDONJSA-N	429.886	1.201	50	20	IDGD	
Cc1cccc(NC(=S)NNC(=O)[C@H](C)NS(=O)(=O)c2ccc(C(N)=O)cc2)c1C	770955888	RWYXDLQMUFGBOF-ZDUSSCGKSA-N	449.558	1.087	50	20	IDGD	
O=C([C@@H](O)Cc1ccccc1Cl)N1CCN(S(=O)(=O)CBr)CC1	773613479	RLZXKTODEQAXBY-ZDUSSCGKSA-N	425.732	1.070	50	20	IDGD	
CS(=O)(=O)N1CCc2c(NC(=O)C(=O)NNc3cnc4ccccc4n3)cccc21	773719105	WSWGVYKRGVUPQQ-UHFFFAOYSA-N	426.458	1.034	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)n(C)c(=O)n2C	774008985	NMLCYPWFWQZEEX-LLVKDONJSA-N	445.863	1.084	50	20	IDGD	
CC(=O)Nc1cc(C)c(S(=O)(=O)NNC(=O)c2ccccn2)cc1Br	774607142	CRWCBTMLZZGMMY-UHFFFAOYSA-N	427.280	1.734	50	20	IDGD	
C[C@@H]1[C@@H](C)N(C(=O)OC(C)(C)C)CCN1C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	776316031	DZAGIVWRAPPSGW-ZIAGYGMSSA-N	444.496	1.346	50	20	IDGD	
Cc1cc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)nn1C1CCCCC1	776434070	TZDOUGMMDGLPKU-IBGZPJMESA-N	442.472	1.841	50	20	IDGD	
O=C(NCC(=O)N1CCOCC1)C(=O)Nc1ccccc1S[C@H](Cl)C(F)(F)F	776498490	WIIWQFNCXBTVHA-HNNXBMFYSA-N	439.843	1.819	50	20	IDGD	
COCCO[C@H]1COCC[C@@H]1NC(=O)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1	777279991	WQGHEBIANLVRAT-KBPBESRZSA-N	441.428	1.427	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2cc([N+](=O)[O-])c3nsnc3c2)c2ccccc2c1=O	777787352	SIFKLAPXXAWSAZ-UHFFFAOYSA-N	439.413	1.404	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(Br)s1)NNc1cc(Cl)ccn1	778453446	XYBQVXFIXXZABL-UHFFFAOYSA-N	425.717	1.981	50	20	IDGD	
Cc1nc(O)c(C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1Br	778457714	BDFGAWDVNQGJMD-UHFFFAOYSA-N	428.264	1.336	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)c1coc(-c2ccc(Br)cc2F)n1	778553320	CIFHQRAXPZYGQS-QMMMGPOBSA-N	446.254	1.439	50	20	IDGD	
O=C(Cc1cc[nH]n1)NNC(=O)C(=O)Nc1cc(Cl)ccc1OC[C@H]1CCCCO1	778715638	ZEOAPNLKVSQZOF-CQSZACIVSA-N	435.868	1.340	50	20	IDGD	
C[C@H](NC(=O)OC(C)(C)C)[C@@H]1CCN(CC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)C1	778980944	ZPLXDMFWFGYRCE-DZGCQCFKSA-N	435.481	1.591	50	20	IDGD	
Cc1nn(C)c(C)c1S(=O)(=O)N[C@@H](C)C(=O)NNc1ccccc1OC(F)(F)F	779208854	OCTPCCOUAZYGPE-JTQLQIEISA-N	435.428	1.746	50	20	IDGD	
COc1ccc(Cn2ccc(NC(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)n2)cc1	779510294	SCBLAIBHCQFDFH-UHFFFAOYSA-N	433.432	1.382	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)[C@@H]1CCCN(C(=O)c2ccc(F)cc2)C1	780972044	XHYBRNAUSYAFAH-OAHLLOKOSA-N	436.484	1.740	50	20	IDGD	
COc1ccc(Cl)cc1S(=O)(=O)NNC(=O)c1csc(N2CCOCC2)n1	782461872	ITGXWQTVSNUYHH-UHFFFAOYSA-N	432.911	1.265	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)c1cccc(NS(=O)(=O)C(F)(F)F)c1	782666894	GROCLZFNYUCCRV-UHFFFAOYSA-N	433.364	1.494	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3ccc(O)cc3)cc2F)C[C@@H](C)O1	782833046	BQGBDHUVYHIUJI-BETUJISGSA-N	430.436	1.545	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2ccc3[nH]nc(C(N)=O)c3c2)ccc1Br	783923131	MLFDQVHBXOLQGI-UHFFFAOYSA-N	431.250	1.815	50	20	IDGD	
CCCCn1ccnc1-c1cccc(NC(=O)C(=O)NNC(=O)C(=O)N2CCCC2)c1	784000236	RJCGAFBAPIFXCI-UHFFFAOYSA-N	426.477	1.059	50	20	IDGD	
Cn1c(C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)cc2c(=O)n3ccccc3nc21	784447039	RKYDCXYQCMUQAW-UHFFFAOYSA-N	447.423	1.939	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)Nc1ccc(CCN2CCCC2)cc1	785023706	OEBWTBVHKLKFAQ-UHFFFAOYSA-N	441.444	1.338	50	20	IDGD	
O=C(COC(=O)[C@H]1CCCN1c1ccccc1)NNC(=O)[C@H]1COc2ccccc2O1	785123660	ASNBDPZTADZYNR-VQIMIIECSA-N	425.441	1.186	50	20	IDGD	
COC(=O)c1ccc(S(=O)(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c(OC)c1	785488994	PTAXCACIHWHHOR-UHFFFAOYSA-N	430.442	1.291	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)[C@H]1CC12CN(C(=O)OC(C)(C)C)C2	789297038	UQFLUMORLPLWAS-MRXNPFEDSA-N	431.489	1.485	50	20	IDGD	
Cn1nc(C2CCCC2)cc1NC(=O)C(=O)NNC(=O)[C@H]1OCC[C@H]1c1ccccc1	789813866	XDLRNLAXVCWDLN-LPHOPBHVSA-N	425.489	1.736	50	20	IDGD	
N#CCCn1cc(/C=C(/C#N)C(=O)N2CCC[C@@]3(C2)NC(=O)NC3=O)c(-c2ccccc2)n1	790237016	FDMHFXGEVJQGGU-ZDALTALBSA-N	443.467	1.571	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)c1nccnc1C(=O)NCc1ccc(F)cc1	792798133	LZLPPBXNZVPHKD-UHFFFAOYSA-N	437.431	1.558	50	20	IDGD	
CC(C)C(CS(=O)(=O)N(C)C)=NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	794862886	VEUOJIAEWDITCZ-UHFFFAOYSA-N	444.579	1.104	50	20	IDGD	
CCn1ncc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)c1C(F)(F)F	799259069	MYSMBICUBDEZRF-UHFFFAOYSA-N	435.309	1.680	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)N[C@@H]2COc3cc(F)c(Br)cc32)n1	800746916	BOCAEUIYYBYKIX-CYBMUJFWSA-N	426.246	1.866	50	20	IDGD	
O=C(N=c1cc[nH]cc1)NNC(=O)[C@@H]1CCCN1C(=O)Nc1ccc2c(c1)OCCO2	802034373	KXLHYRCTTIJWCZ-HNNXBMFYSA-N	426.433	1.124	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)[C@H]2CS[C@@H](Cc3ccccc3F)C(=O)N2)cc1	802061515	XRNSOZPPIAJVPO-SJORKVTESA-N	432.477	1.830	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@@H]2CCCC[C@@H]2C(=O)N2CCCC2)cc1	802063864	RIQSZXDLNHGPNE-SJORKVTESA-N	436.534	1.672	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NC[C@H]2CCCS(=O)(=O)C2)cc1Br	805103784	DPMNMNRFHZAZAR-SNVBAGLBSA-N	434.312	1.227	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)Nc1ccc(S(=O)(=O)C[C@@H]2CCCO2)cc1	806264163	ADJZXNIBPCBADH-HNNXBMFYSA-N	443.489	1.764	50	20	IDGD	
O=C1COC[C@@H](C[C@H]2CN(C(=O)C(=O)NNc3ccc4ccccc4n3)c3ccccc32)N1	806984702	QGTRJHVQTWNDRP-DLBZAZTESA-N	445.479	1.713	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(NC(=O)C(=O)NNc2cc(F)c(F)c(F)c2)ccc1F	807020153	HHCRGAWIJFJULY-UHFFFAOYSA-N	434.371	1.575	50	20	IDGD	
CC(C)CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	810318093	PCWWYHPQXBFYTK-GOSISDBHSA-N	448.549	1.067	50	20	IDGD	
COC(=O)c1c(F)ccc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c1F	810387412	VDXOOAGLRGRUDR-UHFFFAOYSA-N	443.366	1.337	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ncc(C(F)(F)F)s2)cc1	812979640	ZJJGVBVRYXVRPU-VIFPVBQESA-N	444.391	1.918	50	20	IDGD	
CCNC(=O)Nc1cccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)c1	813033798	LWMHKWMODHXBEX-UHFFFAOYSA-N	448.505	1.160	50	20	IDGD	
CN(C)c1cc(Br)cc(C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)c1	814410603	CVUTXMPNHCFAAH-UHFFFAOYSA-N	444.330	1.984	50	20	IDGD	
C[C@H](Cc1cnc2ccccc2n1)C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	814722135	LHDFPGHWUCULFJ-CQSZACIVSA-N	441.513	1.520	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)cc1)[C@H]1C[C@H]1C	815564419	IKSQBUUZOYZGOT-PXAZEXFGSA-N	438.440	1.576	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)Cc2ccccc2F)cc1)[C@@H]1C[C@@H]1C	815569382	QYIHZFQDAVMSMB-ORAYPTAESA-N	426.448	1.916	50	20	IDGD	
C[C@H](Oc1ccccc1NC(=O)C(=O)NNC(=O)[C@@H]1CCc2nncn2C1)c1ccccc1	815692475	RTJPXARNOGQLHI-DOTOQJQBSA-N	448.483	1.767	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNc3nc4ccccc4n3C)CC2)cc1	816577188	AEMFZBIUNXCWOO-UHFFFAOYSA-N	442.545	1.331	50	20	IDGD	
COc1cccc(/C=C(/C(=O)OCC(=O)NNC(=O)c2cccs2)n2nnnc2C)c1	818158506	HVGXHKUXDYXOGP-GDNBJRDFSA-N	442.457	1.054	50	20	IDGD	
CC(=NNC(=O)c1cnccn1)c1ccc(S(=O)(=O)N2CCC(C(=O)O)CC2)cc1	818287566	OLTMQSLKLOJINP-UHFFFAOYSA-N	431.474	1.116	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)[C@@H](O)[C@H](O)c1nc2ccccc2s1	825477590	RPVCNMDNWJWHDG-ROUUACIJSA-N	431.470	1.316	50	20	IDGD	
COCCNC(=O)CSc1ccccc1C(=O)NNC(=O)[C@H]1COc2ccccc2O1	859414961	OIQQYPIPYQPMJG-QGZVFWFLSA-N	445.497	1.142	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=S)NC2CCN(Cc3ccccc3)CC2)c1	913478938	JJUFXKGRWKILGD-UHFFFAOYSA-N	446.598	1.864	50	20	IDGD	
COCCN1C[C@H](C(=O)NNC(=O)c2nc(-c3ccccc3)n(-c3ccccc3)n2)CC1=O	914460578	FECDSMDCWCGCPY-QGZVFWFLSA-N	448.483	1.190	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)[C@@H]1CCCN1C(=O)c1cc(Cl)cc(Cl)c1	914719752	PQVIXLPIFLOLOD-HZMBPMFUSA-N	448.328	1.180	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)C1CCN(C(=O)COc2ccccc2)CC1	914846888	ZESUOTFHDBMNFJ-UHFFFAOYSA-N	429.448	1.670	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)[C@@H]1CS[C@H](Cc2ccccc2F)C(=O)N1	914879959	CQFKEHWCCNTUEU-MAUKXSAKSA-N	447.488	1.203	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)CNS(=O)(=O)c2cccs2)cc1	915188823	WZIFZKXPRDNQIA-LBPRGKRZSA-N	427.504	1.040	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)[C@H]2CC(=O)N(Cc3ccccn3)C2)c2ccccc2c1=O	915259858	FYUSMMQHYMLHGC-HNNXBMFYSA-N	448.483	1.182	50	20	IDGD	
COc1cc2c(cc1OC)C(=NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1)C(=O)N2	915945312	SSEOKHKNULZKMC-UHFFFAOYSA-N	446.485	1.105	50	20	IDGD	
O=C(NCCC(=O)N1CCOCC1)NNC(=O)c1ccccc1OCc1ccc(F)cc1	916251413	NCYUQCJBPJIHSN-UHFFFAOYSA-N	444.463	1.598	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N1CCC(CC(N)=O)CC1	916571530	IXAHLHOBEZJXLB-LLVKDONJSA-N	427.299	1.545	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCC2(c3ccc(F)cc3)CC2)cc1	916624140	SPXCFJZCFVGGJN-UHFFFAOYSA-N	448.520	1.817	50	20	IDGD	
C=C(Cl)COc1ccc(C(C)=NNC(=O)CSc2nn(C)c(=O)n(C)c2=O)cc1	917544944	PEYMJEYRCOAMCM-UHFFFAOYSA-N	437.909	1.243	50	20	IDGD	
CCCOc1ccc(C(=O)NNS(=O)(=O)c2ccc(OC)c(C(=O)O)c2)cc1OC	917727812	QHGJOCIRALRJON-UHFFFAOYSA-N	438.458	1.814	50	20	IDGD	
CCCC[C@H](/N=C1/NS(=O)(=O)c2ccccc21)C(=O)NNC(=O)c1ccc(C)cc1O	918337741	UAPCPTWAOAZZJB-INIZCTEOSA-N	444.513	1.759	50	20	IDGD	
CCN(CCCNC(=O)/C(C#N)=C/c1cc(C)n(C[C@@H]2CCCO2)c1C)S(C)(=O)=O	918670045	HNUOETUIQPPTBL-ACSPXDACSA-N	436.578	1.979	50	20	IDGD	
CNS(=O)(=O)c1ccc([C@H](C)NC(=O)NNC(=O)c2c(C)nc3ccccn23)cc1	919779777	ZEDIEZJSZVRWOC-LBPRGKRZSA-N	430.490	1.256	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)N2CCC(=NNC(=O)Cc3nc(C)cs3)CC2)cc1	920372870	FZZJBOMRZDHRBF-UHFFFAOYSA-N	449.558	1.909	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)/C(=C/c2ccc(F)cc2)n2nnnc2C)cc1OC	920425660	ONXOWBBKUFMIFS-BOPFTXTBSA-N	440.435	1.987	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N2CCC(OC)CC2)cc1	920852839	YSIHGOAUDCNCFD-LGMDPLHJSA-N	437.500	1.978	50	20	IDGD	
Cc1cc(C)cc(NNC(=O)[C@H](CCS(C)(=O)=O)NS(=O)(=O)c2ccccc2)c1	932436961	GMJNLQFMLXETQV-SFHVURJKSA-N	439.559	1.528	50	20	IDGD	
Cc1oc(C(=O)NNC(=O)c2cncn2-c2ccccc2)cc1S(=O)(=O)N1CCCC1	1115852795	NYCLLQCFBRIJPI-UHFFFAOYSA-N	443.485	1.633	50	20	IDGD	
N#Cc1ccc(N2C[C@H](C(=O)NNc3ccc(S(=O)(=O)NC4CC4)cc3)CC2=O)cc1	1251585730	FXZSOYVROPOVKE-OAHLLOKOSA-N	439.497	1.495	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)CO[C@@H]2CCOC2)c1	1319065220	OHSBSPYTJDXVDQ-OAHLLOKOSA-N	449.485	1.063	50	20	IDGD	
COC(=O)c1cc(NC(=O)NNC(=O)c2ccccc2Cl)cc(S(C)(=O)=O)c1	1320425479	ZKQFOORLGQRMMN-UHFFFAOYSA-N	425.850	1.997	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4nncn4c3)C2)C1	1778597001	VILHOIFLIQDNPF-ZWKOTPCHSA-N	426.304	1.409	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cn3ncccc3n2)C1	1778667278	ZTPAFTMHMPVGJN-AKCHCHLHSA-N	435.912	1.111	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@]2(C1)CN(C(=O)Cc1cccnc1Cl)CCO2	1779294658	WGSQPQUODXFKQT-IBGZPJMESA-N	425.989	1.959	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(C(N)=O)cc1)C2	1779545885	NPLLAEFXOJAIEU-XMSQKQJNSA-N	447.608	1.765	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc(CO)o2)C1	1779706548	NTDAYVSDLLUNKT-VVFCZOMOSA-N	443.338	1.930	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](F)Cl)CCO3)C1	1781162617	RPYXYAXVYRSOBL-AUSJPIAWSA-N	447.935	1.998	50	20	IDGD	
CC(C)Cc1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](F)Br)C3)C2)n(C)n1	1781331260	NCRGSKKUOJKQJL-MAUKXSAKSA-N	445.333	1.753	50	20	IDGD	
Cc1cc(Br)ccc1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1781564966	KWXALVLXACEZHS-YJBOKZPZSA-N	445.741	1.801	50	20	IDGD	
C[C@@H](O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C(C#N)=C/c2ccc(F)cc2F)C1	1781599116	ZETHRDOAAFRTKB-IYKZQOMLSA-N	433.455	1.766	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc[n+]([O-])cc1)C2	1781903411	SPVZWRDYTYJXQI-FRQCXROJSA-N	440.338	1.621	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cn3ncccc3n1)C2	1782173128	YFPAPOUUHRWFJG-AKCHCHLHSA-N	435.912	1.111	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)C3(O)CCC3)[C@H]2C1	1783509655	VRQQJSCICAEHDR-YXMSTPNBSA-N	431.371	1.548	50	20	IDGD	
COC(=O)N(CC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Cl)CCO2)Cc1ccccc1	1783693072	XQPPSTKCEHDTHV-PXNSSMCTSA-N	441.887	1.619	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)Cc3cccc(C(F)(F)F)n3)CCO2)C1	1783873207	MBWLOUGPYOWVRV-RDTXWAMCSA-N	449.857	1.727	50	20	IDGD	
O=C(c1ncn(-c2cccc(F)c2)n1)N1CCO[C@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783942906	CFNPIAMEUMIRRH-SFHVURJKSA-N	442.278	1.654	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@]3(F)CCCCC3(F)F)C[C@@H]21)[C@@H](O)CCl	1784093475	WCQHPOFUAVFQKQ-DEEHTKSCSA-N	426.863	1.483	50	20	IDGD	
CC(C)(C)OC(=O)N1CC=C(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Cl)C[C@@H]32)C1	1784343255	FEFBZKGFCXYEJE-VGWMRTNUSA-N	445.919	1.678	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CNC(=O)c3ccco3)C[C@@H]21	1784617631	AILNNRNMLDFCJI-MPTYRVRUSA-N	425.913	1.397	50	20	IDGD	
C[C@H](NC(=O)c1cnccn1)C(=O)NC1(c2ccc(NC(=O)[C@H](O)CCl)cc2)CCC1	1786135106	YJQQDALWGMNWAH-SUMWQHHRSA-N	445.907	1.329	50	20	IDGD	
COCCOCCOCCC(=O)NC1(c2ccc(NC(=O)[C@H](O)CCl)cc2)CCC1	1786138864	YGGCKPNUHCMHQP-GOSISDBHSA-N	442.940	1.790	50	20	IDGD	
Cc1cc(CC(=O)Nc2ccc(C3(NC(=O)c4cnccc4C(=O)NN)CCC3)cc2)on1	1786722569	LYCBXSCNDZZCIU-UHFFFAOYSA-N	448.483	1.972	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)[C@@H]3SC(=N)NC3=O)[C@H]2C1	1787492484	FQZGPTGPPLAXEA-LZXPERKUSA-N	444.985	1.176	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc4ncccn4n3)[C@H]2C1	1788304756	ONIGWARUUHHYTP-OSFYFWSMSA-N	436.310	1.106	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc4c3NC(=O)C4)C[C@@H]21	1788763414	GBQBWESJKUSZCA-SZMVWBNQSA-N	445.592	1.626	50	20	IDGD	
CCc1[nH]nc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]3C2)c1F	1789868733	KTLBBVNECAGESY-FNCVKVGOSA-N	435.327	1.941	50	20	IDGD	
C[C@@H](Cn1cccn1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]2C1	1789869079	XDMOSNSHQFVMLD-GMHRPJKWSA-N	431.364	1.735	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@](C)(O)C(F)(F)F)C[C@@H]21	1790958509	RVXAULRIZGIKMR-HJHSNUOESA-N	445.276	1.453	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(=O)cco3)C[C@@H]21	1790961649	SYFZCBVSRSBECV-ZIEJDFEHSA-N	427.295	1.407	50	20	IDGD	
CC(=O)Nc1ccc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]3C2)cc1	1791294603	COTXTKYJHPJPST-XIRDDKMYSA-N	442.343	1.971	50	20	IDGD	
CC(C)(C)OC(=O)N(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2)C1CC1	1792637759	WMLHAZOIOJMYRD-VZAMPYOESA-N	433.908	1.510	50	20	IDGD	
COc1ccccc1OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@](C)(Cl)CCl)C2	1792721098	DZTSUTBDVXXBDF-VLBMKZOESA-N	445.343	1.900	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc([N+](=O)[O-])o1)C2	1792867088	WDGJOYHMSJIXDW-NJBDSQKTSA-N	430.255	1.422	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc3ccccn13)C2	1792868093	PHTUWOFGZTVAAA-VWPFQQQWSA-N	435.322	1.569	50	20	IDGD	
COc1ccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCBr)cc1	1795112853	WJUMPTVFGBDDST-CCWDJLKJSA-N	425.323	1.612	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1cccc2[nH]ncc12	1796159383	YYXTZTMOGLMUTD-OWLDWWDNSA-N	425.258	1.457	50	20	IDGD	
O=C(COc1cccc(Cl)c1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1	1796189656	MLIHJCYZMWORSL-REPLKXPHSA-N	442.708	1.351	50	20	IDGD	
O=C(CCc1c[nH]c2ccccc12)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1	1796191128	BVSBAMJZSCXQHW-WKCHPHFGSA-N	445.328	1.732	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1nnsc1C1CC1	1796645560	QOIYDMJDYGGCNG-JJHQXXDFSA-N	433.361	1.855	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2cccnn2n1	1798422327	RDFKFWRBAFWZDW-TYYYEBLRSA-N	426.304	1.169	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cn1cnc3ccccc31)C2	1799278467	IBFISYNRPVMHPJ-VLBMKZOESA-N	439.343	1.862	50	20	IDGD	
Cc1cccc(C)c1NC(=O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CO[Si](C)(C)C)C2	1799283226	REXCKPSKFOPLLY-XEMDLRDOSA-N	447.608	1.683	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cn1cnc3ccccc31)C2)[C@H](F)Br	1799347154	KXXOWSOHMCJZBX-LZDSYCOUSA-N	439.285	1.316	50	20	IDGD	
C[C@@H](Oc1ccccc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2	1799378016	KIXLQUWSRDSJMS-ZXFNITATSA-N	425.323	1.829	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(O)c([N+](=O)[O-])c1	1799486674	OJIPLIAFCLZFPL-ADGXKJENSA-N	442.266	1.287	50	20	IDGD	
CCOc1cccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)Br)C3)c1O	1799756708	NSCLMGQQYQWSSU-NFFDBFGFSA-N	441.322	1.778	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1C[C@@]12C(=O)Nc1ccccc12	1800766746	OVRRTZUHHHJUIG-LPYJRYEISA-N	431.920	1.503	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)[C@@H]1CCc2ccccc21	1801114877	ZSORLXVERPTSGA-IEHFGQBSSA-N	425.298	1.997	50	20	IDGD	
COc1ccc(F)cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2	1801721703	GUGXLLVGRZDWBU-DPIQGUFMSA-N	429.286	1.823	50	20	IDGD	
C[C@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C(F)(F)C(F)(F)C(=O)O)C2	1801959765	ZISODATVMJYXNF-MAUMQABQSA-N	433.196	1.763	50	20	IDGD	
CCC[C@H](NC(C)=O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](Br)CC)C2	1802037804	IYZIEWILSUZHDR-DGADGQDISA-N	432.359	1.054	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cccn3ccnc23)[C@@H]1c1cccnc1)[C@H](O)CCl	1803142539	FBGQQRQPYXXZLP-CGTJXYLNSA-N	427.892	1.649	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)c2cccc(=O)n2C)[C@H]1c1cccnc1	1805315052	DDOWWGUTLRBGKQ-DHSIGJKJSA-N	447.333	1.883	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CCC3(CCCN(C(=O)[C@H](O)CCl)C3)CC2)cc1O	1805526783	LMNOZOMHDIREAX-GOSISDBHSA-N	437.924	1.795	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC2(CCCN(C(=O)c3ncc(F)cc3F)C2)CC1	1806339284	OOTNOGGLOLFTNZ-UHFFFAOYSA-N	443.259	1.198	50	20	IDGD	
O=C(CN1CCOCC1)NC[C@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1	1806903627	GBGYIGBQRFITNM-VQIMIIECSA-N	439.354	1.205	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@H]1CCN(C(=O)Cn2nccn2)[C@H]1c1cccnc1	1808305967	XXAOUFSXVKRMBE-HFTRVMKXSA-N	425.320	1.615	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)[C@H]2C[C@@H]2F)[C@@H]1c1cccnc1	1808416184	GPBFKUXVZXGEPR-CCTKTUGFSA-N	440.479	1.579	50	20	IDGD	
Cn1ccc(C(=O)N2CC[C@H](CNC(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)c1	1810299958	VSNYHDVRNCESBV-UZLBHIALSA-N	447.499	1.052	50	20	IDGD	
Cc1cnoc1C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1811250584	SEOUXCDAKYWNRA-LPHOPBHVSA-N	428.493	1.071	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)c1c(O)cc(O)cc1O	1811412224	HUWCFKIZYLWYQB-XZOAIXRZSA-N	435.864	1.118	50	20	IDGD	
Cc1nc(C(=O)N2CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)cs1	1813070441	JATYFPWSWSISHS-OXJNMPFZSA-N	444.561	1.539	50	20	IDGD	
CN1CCN(CCC(=O)Nc2nc3c(s2)C[C@@H](NC(=O)C(C)(C)CCl)CC3)CC1	1814575720	ZDUQVWUDGNJRKI-AWEZNQCLSA-N	442.029	1.958	50	20	IDGD	
Cc1ccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)cn1	1816371434	SWPPWIZIDMHCBC-LJQANCHMSA-N	433.277	1.413	50	20	IDGD	
COc1ccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)cc1	1817472394	HETNNFYZHBIIJK-FQEVSTJZSA-N	448.288	1.718	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1)c1ncn(-c2ccccc2)n1	1818197991	UKQRKCXGVNOBNT-HZPDHXFCSA-N	443.895	1.896	50	20	IDGD	
Cc1cc2nnc(C(=O)Nc3nc4c(s3)C[C@H](NC(=O)[C@H](F)Cl)CC4)c(C)n2n1	1818248996	YCUVRSYQRRITBN-OTYXRUKQSA-N	437.888	1.958	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnc4[nH]ncc4c3)sc2C1	1818956719	SSKLCWPGCYEBCG-NEPJUHHUSA-N	434.909	1.894	50	20	IDGD	
Cc1ncncc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819403413	KWGWQSVIYHSGOK-QGZVFWFLSA-N	449.475	1.126	50	20	IDGD	
O=C(N[C@@H]1CCc2nc(NC(=O)[C@@H]3CC[C@@H]4CCC(=O)N4C3)sc2C1)[C@@H](F)Cl	1822624194	XWKYQSFXRGXJDE-UYUMYWFVSA-N	428.917	1.991	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(O)nc(O)n1)CC2	1822863066	FRQLIIBPDZHTBB-QZTNRIJFSA-N	446.316	1.806	50	20	IDGD	
CC(=O)C(C)(C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1	1824373958	WYIJYLVNJWQAEI-HXUWFJFHSA-N	428.338	1.215	50	20	IDGD	
CC[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H]1CNC(=O)O1)CC2	1825441526	ZMEGRIYNQGWPCG-MRTMQBJTSA-N	431.312	1.337	50	20	IDGD	
CC[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CN1CCCC1=O)CC2	1825446222	AAILLEMNGUCRHX-GHMZBOCLSA-N	443.367	1.851	50	20	IDGD	
CC[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1[nH]nnc1C)CC2	1825447001	NMRKBYONMKGIAX-RKDXNWHRSA-N	427.328	1.969	50	20	IDGD	
COc1cc(C(=O)N[C@H]2CCc3nc(NC(=O)[C@@H](C)Br)sc3C2)n(C)n1	1825636119	AQFPNARLHYPHCE-BDAKNGLRSA-N	442.339	1.894	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(=O)n1O)CC2	1825994606	WONFNQAPIPYRHB-VHSXEESVSA-N	426.882	1.022	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@H]1CCc2nc(NC(=O)[C@H](C)S)sc2C1	1826017269	FQZXBUVOPZCKFR-MDCUWKKUSA-N	434.547	1.507	50	20	IDGD	
Cc1cncc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)c1	1827055983	MGEDDQTWMVHTTF-QFIPXVFZSA-N	435.333	1.617	50	20	IDGD	
Cc1nn(C)c(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)c1F	1830357766	GDMMGQLSZZJZEY-LJQANCHMSA-N	430.908	1.203	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830366250	MJGHEEWDCUCYDM-BLLLJJGKSA-N	425.751	1.491	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cn4ccsc4n3)C2)C1	1831650923	MHADXTCYUNRMQJ-KUHUBIRLSA-N	440.953	1.873	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2nccnc2C(N)=O)CC1	1831833138	UNWBKJYJCKYYGZ-CABCVRRESA-N	437.928	1.063	50	20	IDGD	
C[C@]1(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1(F)F	1832801654	DKOTZRUQHOGYLO-GHTZIAJQSA-N	434.292	1.645	50	20	IDGD	
Cc1cncc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)c1	1834285420	PIRPLRXPZJSUSK-PBHICJAKSA-N	430.274	1.151	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3ncn(C(C)C)n3)CC2)CC1	1835205415	GHSCWHJLVJKIRB-KRWDZBQOSA-N	440.976	1.298	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)c1cn2ccsc2n1	1835592892	KVJJVJNSLRHMPA-MRXNPFEDSA-N	439.969	1.181	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3cccs3)CCO2)C1	1836091559	PMNAWAUDQMSAEK-QZTJIDSGSA-N	435.373	1.983	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)c1c(F)cccc1F	1836223737	JMKBPBMFLWDZTM-KRWDZBQOSA-N	429.895	1.750	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc4nccn4c3)CCO2)C1	1836574321	QYXJTWQZXAYWJO-DYESRHJHSA-N	434.924	1.812	50	20	IDGD	
Cc1cc(C)n(CC(=O)N2CCC(OC3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)n1	1836714918	CQDLBHDZTBAPKQ-SFHVURJKSA-N	426.945	1.098	50	20	IDGD	
Cn1ncc2c(C(=O)N3CCC(OC4CCN(C(=O)[C@H](O)CCl)CC4)CC3)cccc21	1836716963	AYFQCMYQRIOZKA-HXUWFJFHSA-N	448.951	1.785	50	20	IDGD	
Cc1nc(CC(=O)N2CCC(OC3CCN(C(=O)CCBr)CC3)CC2)no1	1837154449	AMBOPVLCQAQIRY-UHFFFAOYSA-N	443.342	1.704	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)/C=N/O[C@H]3CCCCO3)CCO2)C1	1837526131	SNOPFUFBQYFOCS-UPCXQOFDSA-N	445.944	1.379	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)nc1C	1837712458	SOMUFAUBGWSLKH-NRFANRHFSA-N	435.597	1.620	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(C)nc3OC)CCO2)C1	1838176384	FMAHFMCNYBWVPX-OXQOHEQNSA-N	425.913	1.486	50	20	IDGD	
COc1cccc(OC)c1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1838881962	DOEABAGSIFBAQU-QFBILLFUSA-N	430.860	1.308	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2	1839150158	ZXMFZMBHBCLVHD-SJORKVTESA-N	429.772	1.944	50	20	IDGD	
O=C([C@@H]1[C@H]2C=CS[C@@H]21)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839202356	CGSABOQOMMNEHW-WSGDXGOYSA-N	435.315	1.008	50	20	IDGD	
Cc1ccc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)o1	1839203177	CFSHVDLHNINACJ-RDJZCZTQSA-N	433.274	1.277	50	20	IDGD	
O=C(c1cc(F)cc(Cl)c1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1	1840708826	DEFLWRVZAARLNS-YJBOKZPZSA-N	435.279	1.149	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@H](NC(=O)c2ccccc2)[C@@H](C)O)C1	1841223396	CTBKOIUTSIJSSO-NXHRZFHOSA-N	435.952	1.777	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)C#Cc2ccc(Cl)cc2)C1	1841262241	BNHGSKVGCHIGJW-UHFFFAOYSA-N	437.887	1.207	50	20	IDGD	
C#CCO[C@@H](C)C(=O)N1CC2(CCCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C1	1841924073	SDUIHLQHONGDKM-GJZGRUSLSA-N	427.929	1.360	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)[C@@H]2[C@H]3Sc4ccccc4[C@H]32)C1	1844271300	XPYATFXAONBBKJ-UFYCRDLUSA-N	434.326	1.071	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)/C=C/c1ccccc1[N+](=O)[O-])C2	1846386465	PRNYDIAINMUCEJ-CSKARUKUSA-N	429.477	1.184	50	20	IDGD	
COc1ccc(C(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)c(Cl)c1	1846847374	GFLDLLQOCFSHBN-UHFFFAOYSA-N	443.891	1.478	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1[C@@H](C(=O)N1CC[C@H]3[C@@H]1CCN3C(=O)[C@H](O)CCl)C2	1847568115	BGBBOBBLZDVLLS-KBCNZALWSA-N	441.956	1.576	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](CCN)NC(=O)OC(C)(C)C	1847867203	QVGBNGGAOQTSNM-WCVJEAGWSA-N	430.977	1.838	50	20	IDGD	
O=C(NCCc1ccc(Br)s1)NNC(=O)c1n[nH]c(=O)c2ccccc12	11608238	GDUSYEHEMORCQG-UHFFFAOYSA-N	436.291	1.934	50	20	IDGD	
CCn1c(=O)c2ccccc2n(CC(=O)NNC(=O)Cc2cccc3ccccc23)c1=O	12643650	XGBQYDKRJQBASR-UHFFFAOYSA-N	430.464	1.726	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)NC[C@H]2CCCO2)c1)c1cccc([N+](=O)[O-])c1	21898202	GLYPAGJIPXVACH-MRXNPFEDSA-N	448.457	1.127	50	20	IDGD	
O=C(NNC(=O)c1c[nH]c2ccccc12)c1cccc(S(=O)(=O)NC[C@H]2CCCO2)c1	21901190	LXSJIRAJTHPXLJ-OAHLLOKOSA-N	442.497	1.700	50	20	IDGD	
CC(C)N1C(=O)c2ccc(C(=O)NNC(=O)[C@@H](C)Oc3ccccc3F)cc2S1(=O)=O	108057942	OXCFAHMFENWJGS-GFCCVEGCSA-N	449.460	1.607	50	20	IDGD	
Cc1ccc(C)c(NC(=S)NNC(=O)CN(C)C2=NS(=O)(=O)c3ccccc32)c1	725907664	PTBULCOBYWDFFN-UHFFFAOYSA-N	431.543	1.702	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2ccccc2C)c1	727350207	UCKAMXGIVCFUQW-UHFFFAOYSA-N	425.532	1.649	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)N[C@@H](C)c1cccc(S(=O)(=O)N(C)C)c1	727609395	KIZOMVMSPVJVPK-HNNXBMFYSA-N	448.545	1.970	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)N[C@@H](CN1CCN(C)CC1)c1ccccc1	727946360	WZCLVEBGNVFDLR-PXNSSMCTSA-N	443.523	1.912	50	20	IDGD	
O=C(CNC(=O)[C@H]1c2ccccc2C(=O)N1C1CC1)NNc1nc(-c2ccncc2)no1	728071585	BZFWGWYKEGIIFP-QGZVFWFLSA-N	433.428	1.050	50	20	IDGD	
COc1cccc(N2CC[C@@H](NC(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)C2)c1	728221312	RHHZNWLNSMIMTP-OAHLLOKOSA-N	432.502	1.322	50	20	IDGD	
O=C(NNC(=O)c1cnn[nH]1)c1ccc(NS(=O)(=O)c2ccc(Cl)s2)cc1	729455710	VGFKEDFDNMZCPX-UHFFFAOYSA-N	426.867	1.395	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)CCNS(=O)(=O)c2cc(C)ccc2C)cn1	729691848	DDBJHGVIZUZCEA-UHFFFAOYSA-N	437.547	1.393	50	20	IDGD	
CC(C)(C(=O)NNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)c1ccccc1	731220428	HAXCABIUCMRRDR-UHFFFAOYSA-N	425.493	1.032	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cn(-c3cccc([N+](=O)[O-])c3)nn2)cc(OC)c1OC	731453404	KGGXIDHCCVNAJH-UHFFFAOYSA-N	442.388	1.276	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)[C@@H]1CCCN1C(=O)/C=C\c1ccc(C(N)=O)cc1	731492500	KRLBODFWTUMCMI-GFBZKKKVSA-N	436.468	1.260	50	20	IDGD	
O=C(CNS(=O)(=O)c1cccc(C(F)(F)F)c1)NNc1nc(-c2ccncc2)no1	732065674	USVPJORLXDRTES-UHFFFAOYSA-N	442.379	1.572	50	20	IDGD	
C[C@@H]1CC(C)(C)C[C@@]2(C1)NC(=O)N(CC(=O)NNc1ccccc1S(C)(=O)=O)C2=O	732302890	SQQBCMURRHWYHW-ZUOKHONESA-N	436.534	1.670	50	20	IDGD	
COc1ccc([C@@]2(C)NC(=O)N(CC(=O)NNc3ccccc3S(C)(=O)=O)C2=O)cc1	732305524	MKXFIQSUKQBYMW-HXUWFJFHSA-N	446.485	1.009	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)N[C@H](Cc2ccccc2)CN2CCOCC2)cc1C	732476291	CVERONLPVNQFIG-OAQYLSRUSA-N	440.544	1.956	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCC1(N(C)C)CCOCC1	733851251	RXMMDEZBEJKSSA-CYBMUJFWSA-N	443.342	1.658	50	20	IDGD	
CCCn1c(CCC(=O)NNc2nccnc2Cl)nc2cc(S(N)(=O)=O)ccc21	734261577	NMOXIXAZASXMDF-UHFFFAOYSA-N	437.913	1.613	50	20	IDGD	
CC(=O)NCC(=O)N1CCc2cc(C(=O)NNC(=O)CSc3ccc(C)cc3)ccc21	735647456	ODSWSCZGIQVECD-UHFFFAOYSA-N	440.525	1.574	50	20	IDGD	
CCc1ccc([C@@H]2COCCN2C(=O)NNC(=O)c2csc(N3CCOCC3)n2)o1	736370621	NJIYNNZBVLNFIM-HNNXBMFYSA-N	435.506	1.563	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)c2cccnc2N2CCOCC2)cc1C	736768653	LQDWVLADBLAGSD-UHFFFAOYSA-N	432.502	1.469	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)Cc2csc(-c3nc[nH]n3)n2)cc1C	736821145	PMNVIESDPKFVKB-UHFFFAOYSA-N	434.503	1.407	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cccc3ccccc23)cc1	741695299	AFPKHDGJHCTNFY-UHFFFAOYSA-N	427.482	1.839	50	20	IDGD	
O=C(NNc1c(F)cc(F)cc1Br)[C@@H]1CC(=O)N(CCN2CCOCC2)C1	742108058	CIRRHNQBPNOWBX-LLVKDONJSA-N	447.280	1.351	50	20	IDGD	
COC(=O)Cn1cc(S(=O)(=O)NNC(=O)c2cc3c(s2)CCCCCC3)cn1	742255760	RUKCHAYAZACBAJ-UHFFFAOYSA-N	426.520	1.400	50	20	IDGD	
CCCCN1C(=O)CC[C@H](C(=O)NNC(=O)C(=O)NC2CC2)[C@H]1c1ccc(OC)cc1	744463437	DIWIJXZUFZVWJY-PKOBYXMFSA-N	430.505	1.201	50	20	IDGD	
CC(=NNC(=O)c1cc(Cl)ccc1O)c1ccc(S(=O)(=O)N2CCNCC2)cc1	744775896	HDZDAJNZHJCBPT-UHFFFAOYSA-N	436.921	1.794	50	20	IDGD	
CC(C)(C)OC(=O)N1CCCC[C@@H]1C(=O)OCC(=O)NNC(=O)c1ccc(C#N)cc1	744884679	UTGRYFABSNCJLH-MRXNPFEDSA-N	430.461	1.652	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)c2ccccc2S(=O)(=O)CC(F)F)c1	744991468	FTEAITRWWAUOQN-UHFFFAOYSA-N	440.424	1.652	50	20	IDGD	
Cc1nn(-c2ccc(F)cc2)nc1C(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	745467397	HMMHNLALOJTZKG-UHFFFAOYSA-N	442.363	1.241	50	20	IDGD	
C[C@@](O)(Cc1ccccc1)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	746093923	VIZBTONOSUEXJH-JOCHJYFZSA-N	445.541	1.616	50	20	IDGD	
COc1cc([N+](=O)[O-])ccc1OC(=O)CNS(=O)(=O)c1ccc(CNC(C)=O)s1	746192946	CJQQMHNNWLZFSM-UHFFFAOYSA-N	443.459	1.185	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)c1sccc1S(=O)(=O)NCc1cccs1	747428522	QAMNWRVLGMAQNZ-UHFFFAOYSA-N	436.540	1.687	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)NCCCN1CCN(c2cccc(Cl)c2)CC1	747503713	OZVGZZGOFURYDQ-UHFFFAOYSA-N	430.940	1.820	50	20	IDGD	
O=C(NNc1ccc(F)cc1Br)C1=NN([C@H]2CCS(=O)(=O)C2)C(=O)CC1	748075490	ZBYVWQGBSRQHSG-JTQLQIEISA-N	447.286	1.197	50	20	IDGD	
CNS(=O)(=O)c1csc(C(=O)NNC(=O)Cc2nc(-c3ccccc3)cs2)c1	748693829	FXUQCJBPXUQUCU-UHFFFAOYSA-N	436.540	1.783	50	20	IDGD	
CC(C)[C@@H](C(=O)NNc1c(F)cc(C(=O)NC2CC2)cc1F)N1CCCS1(=O)=O	748834599	PVZXZAIPRDQOEL-INIZCTEOSA-N	430.477	1.360	50	20	IDGD	
O=C1CN(C(=O)c2ccc(CNC(=O)NNC(=O)c3cc4ccccc4o3)cc2)CCN1	749548565	VPNUHDPVZWTWAQ-UHFFFAOYSA-N	435.440	1.149	50	20	IDGD	
O=C(NNC(=O)C1CCC(NC(=O)C2CCCC2)CC1)c1nnc(O)c2ccccc12	751294041	NHBZUAXOYWGAPB-UHFFFAOYSA-N	425.489	1.962	50	20	IDGD	
CCNC(=O)C1(CNC(=O)NNC(=O)c2ccc(OC)c(Br)c2)CCC1	753139593	VFXURROCDAGTKH-UHFFFAOYSA-N	427.299	1.708	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCS(=O)(=O)[C@H]2CCCC[C@@H]21	753852008	SQHJAIWGZWCGNI-HOCLYGCPSA-N	429.926	1.151	50	20	IDGD	
NC(=O)c1ccc(/C=C\C(=O)N2CCC[C@@H]2C(=O)NNc2ccc(C(F)(F)F)nn2)cc1	755182625	MVGQFZVRXOEADM-XTXQVDMPSA-N	448.405	1.742	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)Nc1cccc(S(=O)(=O)NC2CC2)c1	755586461	XBJYFNFRUFSHTM-UHFFFAOYSA-N	428.474	1.550	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2ccc(CN3C(=O)CCC3=O)cc2)cc1OC	755664074	VCHVZMAAQSYENR-UHFFFAOYSA-N	426.429	1.819	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)Nc1ccc2c(c1)CCO2	755717513	REENHECLWNFTTP-UHFFFAOYSA-N	446.485	1.109	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)Nc1ccc(OC(F)F)cc1OC(F)F	755916771	RZDYGSQYKYWGPV-ZETCQYMHSA-N	429.348	1.477	50	20	IDGD	
CCCS(=O)(=O)Nc1ccc(NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1	756572027	LCFLVEKMDXMIIW-UHFFFAOYSA-N	444.477	1.281	50	20	IDGD	
COc1cccc(OC)c1CC(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	756941225	IMEUYTMGUQAYGN-UHFFFAOYSA-N	436.509	1.976	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)CN2C(=O)NC3(C[C@@H](C)C[C@H](C)C3)C2=O)cn1	757649074	UQPVNDGQEVVLMZ-RYUDHWBXSA-N	434.522	1.155	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)Cc1cccc(OCc2ccc(Cl)cc2)c1	758024490	HBCPSQYEPFEUHS-CYBMUJFWSA-N	439.921	1.547	50	20	IDGD	
CCOc1cc2c(cc1[C@@H]1C[C@H]1NC(=O)NNC(=O)C(=O)Nc1ccccn1)O[C@@H](C)C2	758753470	QKMJMDMJHGSCTG-DUVNUKRYSA-N	439.472	1.629	50	20	IDGD	
CSCC[C@H](NC(=O)c1ccccc1Cl)C(=O)NNC(=O)C(=O)Nc1ccccn1	758840601	KSOJQBWNXOVAFT-AWEZNQCLSA-N	449.920	1.373	50	20	IDGD	
C[C@@H](CO)CCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	759635422	SIPOMTLVXFMWTJ-MRXNPFEDSA-N	448.545	1.518	50	20	IDGD	
CC(C)Oc1ccc(NC(=S)NNC(=O)c2ccc(=O)n(-c3cnn(C)c3)c2)cc1	760810346	STOQXRLQPWLGGX-UHFFFAOYSA-N	426.502	1.990	50	20	IDGD	
Nc1c(Cl)cc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1Cl	761452694	RTISQJKOWDPATJ-AWEZNQCLSA-N	440.239	1.720	50	20	IDGD	
CC[C@H](NC(=O)NNC(=O)C(=O)Nc1ccccn1)[C@H]1CN(Cc2ccccc2)CCO1	761789628	HKCJYQQBKQSCOZ-ZWKOTPCHSA-N	440.504	1.030	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)[C@@H](Cc1cccc(F)c1)n1nnnc1C	762409162	NZLLXKWRGSAONE-MRXNPFEDSA-N	444.492	1.853	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2cc(C)n(CC(F)(F)F)c2C)n1	762742013	HXBUBISSZKYESL-UHFFFAOYSA-N	432.424	1.979	50	20	IDGD	
COCCn1ccc2ccc(NC(=O)C(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)cc21	763471313	HFROTEJGTIULIL-UHFFFAOYSA-N	425.401	1.596	50	20	IDGD	
Cn1cnnc1-c1cccc(NC(=O)C(=O)NNC(=O)c2ccccc2Br)c1	763482684	JEOWFSVFDQSEPR-UHFFFAOYSA-N	443.261	1.644	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ccccc2Br)ccc1F	763482948	PKMNGNPISGRMOC-UHFFFAOYSA-N	438.209	1.775	50	20	IDGD	
CCn1cnnc1-c1cccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)c1	763604940	QTFUKNRYJBZLRT-UHFFFAOYSA-N	444.455	1.755	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(CS(C)(=O)=O)c2C)c1	763619327	SLAGJLKHPJCHPB-UHFFFAOYSA-N	433.486	1.013	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1ccccc1-n1c(C)cnc1O	763629685	QSNPRSMQPRDMJR-UHFFFAOYSA-N	433.428	1.242	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc2oc(N(C)C)nc2c1	763646597	IOEMYQBELDWDAB-UHFFFAOYSA-N	427.417	1.067	50	20	IDGD	
COC(=O)c1cc(Cl)ccc1NC(=O)C(=O)NNC(=O)COc1ccccc1OC	763664558	XTONMVNDCOPCBK-UHFFFAOYSA-N	435.820	1.300	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(CS(C)(=O)=O)c2C)cc1C	763665614	ZSUGOOYFBDTUKI-UHFFFAOYSA-N	447.513	1.321	50	20	IDGD	
COCC[S@](=O)Cc1cccc(NC(=O)C(=O)NNC(=O)c2cccc(Cl)c2)c1	763747245	DANSGKLNNNXKDH-LJAQVGFWSA-N	437.905	1.635	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(Cl)c2)cc1-n1nnnc1C	763747339	IQWKGTBMYISNOY-UHFFFAOYSA-N	429.824	1.032	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(N3CCCC3=O)c(F)c2)c1	763758096	NKIJOKYARLTDCB-UHFFFAOYSA-N	427.436	1.418	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)C(=O)N2CCc3c(F)cccc32)c2ccccc2c1=O	763791775	WOZGLIPAHQTCGK-UHFFFAOYSA-N	437.431	1.467	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2nnc(O)c3ccccc23)c(C(F)(F)F)c1	763791786	WQPVEIGJOIZMII-UHFFFAOYSA-N	449.345	1.763	50	20	IDGD	
CCN(CC)C(=O)c1ccccc1NC(=O)C(=O)NNC(=O)COc1ccccc1C#N	763807794	GLCCGORLBFOYIO-UHFFFAOYSA-N	437.456	1.205	50	20	IDGD	
Cc1ccc(NC(=O)C2CC2)cc1NC(=O)C(=O)NNC(=O)COc1ccc(F)cc1	763837268	CYKKOHHAQWSSBO-UHFFFAOYSA-N	428.420	1.648	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)C(=O)Nc1ccc(F)c(C(F)(F)F)c1	763916942	KVUSPVLRKWDDPM-UHFFFAOYSA-N	437.313	1.220	50	20	IDGD	
O=C(NNC(=O)c1ccc(Br)s1)C(=O)Nc1cccc2c1OCCO2	763941392	XOAKAKYQPZPPCY-UHFFFAOYSA-N	426.248	1.682	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)c(OCC(=O)N(C)C)c1	763978954	PLQTTYJWOFSMKD-UHFFFAOYSA-N	448.863	1.221	50	20	IDGD	
COCCOc1ccc(Br)cc1NC(=O)C(=O)NNC(=O)c1cccn1C	763992486	FQEBXWGQTZGWPO-UHFFFAOYSA-N	439.266	1.213	50	20	IDGD	
CCCCCn1nc(C)cc1NC(=O)C(=O)NNC(=O)c1cc(Br)cn1C	764004646	KJKVJKMIYFLHSA-UHFFFAOYSA-N	439.314	1.882	50	20	IDGD	
Cc1cc(C(=O)N2CCOCC2)ccc1NC(=O)C(=O)NNC(=O)CCC1CCCCC1	764212329	XKIJMENWMUYMBC-UHFFFAOYSA-N	444.532	1.914	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)C(=O)Nc1ccc(N2C(=O)CCCC2=O)cc1	764320776	KWIJBHSSFFERSY-UHFFFAOYSA-N	426.404	1.198	50	20	IDGD	
CNC(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2F)c1	764413885	VDZIXTMDYYQPFG-UHFFFAOYSA-N	427.219	1.892	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)C(=O)Nc2cc(C)ccc2-n2cc(C)cn2)c1	764431472	YFCYWANNVKZWMS-UHFFFAOYSA-N	435.444	1.242	50	20	IDGD	
Cc1cc(C)nc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c1	765276049	LAANAEHQEZECMA-UHFFFAOYSA-N	433.490	1.186	50	20	IDGD	
O=C(CCc1c[nH]c2ccccc12)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765739252	RNAQVLQDPOWXNC-UHFFFAOYSA-N	433.512	1.706	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1)n1cnc2ccccc21	766641607	ICUCYOFRUHUIIC-KRWDZBQOSA-N	434.500	1.203	50	20	IDGD	
O=C(NNC(=O)c1ccccc1COC1CCOCC1)c1csc(N2CCOCC2)n1	767822676	MVZLCDOLSMKOTB-UHFFFAOYSA-N	446.529	1.750	50	20	IDGD	
O=S(=O)(CBr)N1CCN(S(=O)(=O)c2ccc(CCCl)cc2)CC1	767851628	RJZXJMTWTODSHC-UHFFFAOYSA-N	445.788	1.456	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(C(=O)NN=c2cc[nH]cc2Cl)ccc1Br	768453203	VTQWMZGIXZMGER-UHFFFAOYSA-N	433.715	1.927	50	20	IDGD	
CCn1c(NNC(=O)CN2C(=O)N[C@]3(CCCC(C)(C)C3)C2=O)nc2ccccc2c1=O	768929250	XPBJCEIYTJPTDF-QFIPXVFZSA-N	440.504	1.750	50	20	IDGD	
CCCOc1cccc(CC(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)c1	770195581	PGKYAWIJJFKDAP-UHFFFAOYSA-N	438.528	1.623	50	20	IDGD	
CCCn1c(C)cc(/C=C(\C#N)C(=O)N2CCN(S(=O)(=O)CCCOC)CC2)c1C	770334849	XTHBEZIYDHNNTD-HMMYKYKNSA-N	436.578	1.932	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=O)c2ccc3c(c2)OCCO3)ccc1C	770391259	KYMNWPXZPJFKOV-UHFFFAOYSA-N	447.513	1.872	50	20	IDGD	
Cc1nn([C@@H]2CCS(=O)(=O)C2)c(C)c1NC(=O)C(=O)NNc1c(F)cccc1Cl	770805740	FMDFJBFNFMGISH-LLVKDONJSA-N	443.888	1.734	50	20	IDGD	
O=C(CS[C@H]1CCS(=O)(=O)C1)NNC(=S)Nc1cccc(Br)c1	770996487	OTHJOMVLTMJXQG-NSHDSACASA-N	438.394	1.687	50	20	IDGD	
O=C(NNc1ccc(F)c([N+](=O)[O-])c1)c1cc(S(=O)(=O)N2CCSCC2)c[nH]1	773063270	NLOCLCJFZOAQBC-UHFFFAOYSA-N	429.455	1.556	50	20	IDGD	
CS(=O)(=O)c1ccc(OCCCC(=O)NNc2cccc(S(C)(=O)=O)c2)cc1	776538976	SHFRUBBTAJSZJA-UHFFFAOYSA-N	426.516	1.796	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)NCCC(=O)N2CCN(c3ccccc3)CC2)c1	776619037	NIWOBOXRSYBMHT-UHFFFAOYSA-N	445.545	1.455	50	20	IDGD	
O=C(NC[C@H]1COC2(CCOCC2)O1)NNC(=O)c1ccc(Br)cc1Cl	776909112	KZUHIDQWKBVFAY-NSHDSACASA-N	448.701	1.969	50	20	IDGD	
CCOc1cnc(C(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)cn1	777758457	BELSNGHWLZQKCK-UHFFFAOYSA-N	444.451	1.708	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N[C@H](CO)C(C)C)cc1	778409212	AULIOCYUUUJNOE-OUQXZNHLSA-N	425.489	1.474	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@@H](O)[C@H](O)c2nc3ccccc3s2)ccc1OC(C)C	779488689	ICBCZCCFVYODNT-ROUUACIJSA-N	445.497	1.948	50	20	IDGD	
N#Cc1cccc(C(=O)NNS(=O)(=O)c2ccc(S(=O)(=O)C(F)(F)F)cc2)c1	780386738	HRLNDSFSJSCEAI-UHFFFAOYSA-N	433.389	1.475	50	20	IDGD	
COc1ccc(NNC(=O)[C@@H]2C[C@@H](O)CN2S(=O)(=O)c2ccc(Cl)cc2)nc1	781520914	IXVSBBGEWUYFNJ-DOMZBBRYSA-N	426.882	1.011	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc2c(c1)nc(CCC(=O)NNc1ncncc1Cl)n2C	781834448	VYAJQNIWLVJHTE-UHFFFAOYSA-N	437.913	1.343	50	20	IDGD	
CS(=O)(=O)Cc1ccccc1NC(=O)C(=O)NNc1ccc(Cl)cc1[N+](=O)[O-]	783290811	GJWSIDGMFQEFFW-UHFFFAOYSA-N	426.838	1.875	50	20	IDGD	
COc1ccc(S(=O)(=O)C(F)(F)F)cc1NC(=O)C(=O)NNc1cc(C)nc(C)n1	783325085	SHJCQDHLLRPESH-UHFFFAOYSA-N	447.395	1.477	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNc2ccc(F)cc2F)cc(S(C)(=O)=O)c1	783339890	IPZFQMKKDWWAQL-UHFFFAOYSA-N	441.412	1.627	50	20	IDGD	
COc1ccc(Oc2ccc(NC(=O)C(=O)NN[C@]3(C)CCS(=O)(=O)C3)cn2)cc1	783426157	GCRXLHVFAJIGHW-LJQANCHMSA-N	434.474	1.019	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2ccccc2Nc2c(F)cccc2F)CCS(=O)(=O)C1	783427278	QZPHWXOYMZMQJX-IBGZPJMESA-N	438.456	1.845	50	20	IDGD	
Cc1cccc(NC(=O)C(=O)NNC(=O)CNC(=O)c2cccs2)c1Br	784005407	ZJQCJGJGUVSQIE-UHFFFAOYSA-N	439.291	1.335	50	20	IDGD	
CC(C)Oc1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)cc1	784210207	IIMMIYQBQHBONZ-UHFFFAOYSA-N	432.502	1.996	50	20	IDGD	
O=C(NNc1ccc([N+](=O)[O-])cc1Cl)C(=O)Nc1cccc(C(=O)N2CCOCC2)c1	784380478	STTQHKLSHFSWJA-UHFFFAOYSA-N	447.835	1.802	50	20	IDGD	
COc1ccc(NC(=O)c2cccc(NC(=O)C(=O)NNc3ccc(Cl)nn3)c2)cn1	784789684	MXPKOSXKCBDNDL-UHFFFAOYSA-N	441.835	1.868	50	20	IDGD	
O=C(NNc1ccc(Br)nc1)C(=O)Nc1ccccc1CN1CCOCC1	784809519	RCMSXMBLZXCHBS-UHFFFAOYSA-N	434.294	1.758	50	20	IDGD	
Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)C(F)F)cc1	784833684	QRLFIPJDIJTCDR-UHFFFAOYSA-N	428.373	1.981	50	20	IDGD	
CCNC(=O)N(C)NC(=O)C(=O)Nc1c(-c2ccc(Br)cc2)c(C)nn1C	784917720	RVVAJUWITUIBLE-UHFFFAOYSA-N	437.298	1.789	50	20	IDGD	
C[C@H]1C[C@H](C)CN(C(=O)c2ccccc2NC(=O)C(=O)NNc2ccnc(N(C)C)n2)C1	784969042	HDRAJQZYTXVJJF-GJZGRUSLSA-N	439.520	1.743	50	20	IDGD	
CN1Cc2ccc(NC(=O)C(=O)NNc3c(F)cc(C(=O)NC4CC4)cc3F)cc2C1	785099252	BMUSSZOYHCOUQM-UHFFFAOYSA-N	429.427	1.884	50	20	IDGD	
COc1cc(F)cc(NNC(=O)C(=O)Nc2cccc(C(=O)N3CCOCC3)c2C)c1	785241200	DDEWDPVKNHPYEY-UHFFFAOYSA-N	430.436	1.697	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(c2ncc(NC(=O)C(=O)NNc3ccccn3)cn2)CC1	786412906	VMWVSLBGSXZKIP-UHFFFAOYSA-N	442.480	1.011	50	20	IDGD	
COC(=O)CCc1cccc(NC(=O)C(=O)NNC(=O)COc2ccc(C)c(C)c2)c1	786413653	FMXHQIJBMMKYGU-UHFFFAOYSA-N	427.457	1.574	50	20	IDGD	
Cc1ccc(N2CCNC2=O)cc1NC(=O)C(=O)NNC(=O)c1ccc(Cl)cc1F	787550357	SPUIXBPRPGTRSP-UHFFFAOYSA-N	433.827	1.717	50	20	IDGD	
COC(=O)c1csc(-c2cccc(CNC(=O)NNC(=O)C(=O)N3CCCC3)c2)n1	790621482	RCWGJDHVPNLTMP-UHFFFAOYSA-N	431.474	1.050	50	20	IDGD	
O=C(NNc1cccc(F)c1[N+](=O)[O-])C(=O)Nc1ccc(NC(=O)[C@H]2CCCO2)cc1	790993298	DRQZWJGVFPGDTN-OAHLLOKOSA-N	431.380	1.933	50	20	IDGD	
CC[C@H](C)CC(=O)NNC(=O)C[C@@H]1c2cc(OC)c(OC)cc2CCN1S(C)(=O)=O	791092511	WOVMEBDVOCDBCF-XJKSGUPXSA-N	441.550	1.536	50	20	IDGD	
CN(C)N(C(=O)c1cccc(NS(=O)(=O)C(F)(F)F)c1)[C@@H]1CCS(=O)(=O)C1	792853469	DVXKZMMVISPBGO-GFCCVEGCSA-N	429.442	1.054	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2c(C)nc3ccccn23)nc1Br	793022661	ASBFZWJCXKDHDT-UHFFFAOYSA-N	431.250	1.508	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)Cc2cc(C(C)(C)C)on2)cc(OC)c1OC	795281453	WAVJXOBVIKKCTJ-UHFFFAOYSA-N	427.479	1.762	50	20	IDGD	
COC(=O)CN(CCN1CCN(C)CC1)S(=O)(=O)c1ccc(CCCCl)cc1	798470068	SKLCTKKGFHQRAP-UHFFFAOYSA-N	431.986	1.269	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)N[C@@H]2CC(=O)N(Cc3ccccc3)[C@@H]2C)cc1C	798529946	AFRNFWIQVNYDRW-VQIMIIECSA-N	437.500	1.762	50	20	IDGD	
Cc1cc(O[C@@H]2CCN(C)C2=O)ccc1NC(=O)C(=O)NNc1ccccc1[N+](=O)[O-]	799259538	BPGBWQVMQUVILU-QGZVFWFLSA-N	427.417	1.595	50	20	IDGD	
O=C(CNC(=O)c1ccc2c(c1)OCO2)NNc1cc([N+](=O)[O-])ccc1Br	800621320	QVXLTWYMBRQJQN-UHFFFAOYSA-N	437.206	1.959	50	20	IDGD	
Cn1nnc2c(C(=O)NNC(=O)COc3ccc(-c4ccc(C#N)cc4)cc3)ccnc21	801103696	NMKGMQOLVUECDV-UHFFFAOYSA-N	427.424	1.742	50	20	IDGD	
O=C(NNC(=O)c1ccccc1S(=O)(=O)N1CCOCC1)Nc1cc(F)cc(F)c1	802001439	WOTJSALINBNWIG-UHFFFAOYSA-N	440.428	1.452	50	20	IDGD	
O=C(NNC(=O)C1CCN(C(=O)COc2ccccc2)CC1)Nc1ccc2c(c1)OCO2	802096690	AJINXDXPXJQKQO-UHFFFAOYSA-N	440.456	1.886	50	20	IDGD	
Cc1nc(C(F)(F)F)ccc1NC(=O)C(=O)NNC(=O)CN1CCCc2ccccc21	802566547	UZVFMSHKPBCGGD-UHFFFAOYSA-N	435.406	1.948	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)c1ccccc1NS(=O)(=O)C(F)(F)F	804952851	XNANUWDKBRYESG-UHFFFAOYSA-N	427.368	1.681	50	20	IDGD	
CC(=NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1)c1ccc2[nH]c(=O)c(=O)[nH]c2c1	811644157	SWQBWRIHOLRVPC-UHFFFAOYSA-N	444.492	1.639	50	20	IDGD	
C[C@H](CS(=O)(=O)c1ccc(F)cc1)C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	812730264	BPDHQMKPSQKXQK-CYBMUJFWSA-N	443.522	1.629	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@@H](C)C(=O)NNC(=O)c1nnn(-c2ccn(C)n2)c1C	814366061	BHJWHFQRQUOLTL-ZDUSSCGKSA-N	431.884	1.808	50	20	IDGD	
CC[C@@H](C)C(=O)NNC(=O)C(=O)Nc1ccc([N+](=O)[O-])c(I)c1	815567635	GFNJJFVHZGPPPN-SSDOTTSWSA-N	434.190	1.331	50	20	IDGD	
O=C(CCc1ccon1)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	816829726	BXJZTXVMSJSXCK-UHFFFAOYSA-N	428.470	1.547	50	20	IDGD	
O=C(NNC(=O)c1ccc2oc(S)nc2c1)c1ccc(S(=O)(=O)N2CCCC2)cc1	816829920	JRLQFWADVUDIAM-UHFFFAOYSA-N	446.510	1.976	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)c1	825786431	QTEQDUJDJSIAIB-UHFFFAOYSA-N	446.529	1.743	50	20	IDGD	
COc1cc(C=NNC(=O)c2sc(N)nc2C)ccc1OCC(=O)N1CCOCC1	874106580	FTMOFJHZZLGCQX-UHFFFAOYSA-N	433.490	1.044	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CSc2nc3ccc(C)cc3c(=O)n2C)cc1OC	915795993	ZHXXYFGNCAUBCZ-UHFFFAOYSA-N	442.497	1.812	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)NC[C@@H]2CN(Cc3ccccc3)CCO2)c1	915894036	FUHHXZNTQGTPNN-HXUWFJFHSA-N	428.489	1.549	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)NCCCN2CCN(c3ncccn3)CC2)cc1	916267099	ADZCOLRGMTTWMA-UHFFFAOYSA-N	443.577	1.420	50	20	IDGD	
CN1CCN(CCCNC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)[C@@H](c2ccccc2)C1	916485108	MYTORNBNPOGVAL-HXUWFJFHSA-N	440.504	1.918	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)NCCS(=O)(=O)NC(C)(C)C	916622539	YOFAZWKSRDJNJT-UHFFFAOYSA-N	439.563	1.780	50	20	IDGD	
C[C@@H](NC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)c1ccc(C#N)cc1	916627799	WZLNOJGFQSJXHY-OAHLLOKOSA-N	443.533	1.277	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCCOc1cccc(Cl)c1	916646243	FEKULIWFLCSIRH-UHFFFAOYSA-N	439.925	1.965	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCCC(=O)NC2CCCCC2)nc1	918124096	QRFLIAPUFXIGSV-UHFFFAOYSA-N	426.543	1.233	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)CN2C(=O)c3ccccc3N3C(=O)CC[C@@]23C)c1O	919755772	CXHUCRJNDDONIM-QFIPXVFZSA-N	438.440	1.161	50	20	IDGD	
C=CC(=O)NCc1ccc(C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)cc1	919973420	ZUBAOXJZLVWPPG-UHFFFAOYSA-N	429.502	1.165	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)/C=C/c1ccccc1)C(=O)NNC(=O)NCC1CC1	920859261	RSWVJPJRTRMTIW-YBHKSSGVSA-N	426.564	1.439	50	20	IDGD	
CN(C)Cc1cccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1	920929241	DGBLRLCQZVITNJ-UHFFFAOYSA-N	445.545	1.999	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1)n1cccc1	1116351804	IBFTTXSZQIZAEK-INIZCTEOSA-N	426.498	1.989	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)c2cccc(N3CCNC3=O)c2)CC1	1322961100	GJEUKENAYXIRNN-UHFFFAOYSA-N	431.493	1.624	50	20	IDGD	
COc1cc(C(=O)NNC(=O)N[C@@H]2COc3c(F)cc(F)cc3C2)cc(OC)c1OC	1346317473	AISJZGGTXBUXPD-ZDUSSCGKSA-N	437.399	1.938	50	20	IDGD	
Cc1ccc(NC(=S)NNC(=O)c2ccc(S(=O)(=O)NC[C@@H](C)O)cc2)cc1C	1346621234	SSWDDVGFWSGFHM-CQSZACIVSA-N	436.559	1.594	50	20	IDGD	
O=C1Cc2cc(C(=O)N3CC[C@@]4(CN(C(=O)CCBr)CCO4)C3)ccc2N1	1778389504	LACJFYYPBHZMDC-LJQANCHMSA-N	436.306	1.410	50	20	IDGD	
O=C(/C=N/N1CCCCC1)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Br)C2	1779365763	FFMMBEJKWQNKLN-ZNZVRDGBSA-N	447.349	1.663	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCc1cncnc1)C2	1779543468	CLUNPNOAOMBABM-WIYYLYMNSA-N	434.613	1.775	50	20	IDGD	
CCc1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)CCBr)C3)nn1C	1779906056	NORLXVIWICDTBQ-VQIMIIECSA-N	441.370	1.895	50	20	IDGD	
Cn1cc(CCC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](F)Br)C2)cn1	1780771091	BQIPDIWJEFYOCI-QGPMSJSTSA-N	445.333	1.557	50	20	IDGD	
O=C(c1ccn(C(F)F)n1)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781330959	BIKMGJAGWUPIOA-QMTHXVAHSA-N	425.205	1.412	50	20	IDGD	
O=C(c1cn2ccsc2n1)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781331717	PZHJIWMWGLGYBE-XHDPSFHLSA-N	431.287	1.530	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(CCN(C(=O)c3n[nH]c4ccc(C#N)cc34)C2)C1	1782197022	WYUYXSNJTWWEBD-OAQYLSRUSA-N	441.564	1.730	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C[C@@](C)(O)CC(=O)O)C1	1782203189	NROVIGPRTXDXJQ-PBGAUENZSA-N	432.945	1.524	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@H](C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](C)Br)C3)C2)C1	1783539849	OHYVKMMZECYGBP-XTDOFWJNSA-N	445.354	1.579	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)Cn3ccc4c(F)cccc43)CCO2)C1	1783870671	FHYMZKNDACQSFP-IERDGZPVSA-N	437.899	1.864	50	20	IDGD	
C[C@H](CNC(=O)OC(C)(C)C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Cl)C[C@@H]21	1784102249	VMUJSPYJYVXRSS-CAEXGNQWSA-N	435.924	1.661	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(C(=O)OC)nc3)C[C@@H]21	1784618539	QWEQEUPCPLQKOW-CUSZFKRNSA-N	437.924	1.869	50	20	IDGD	
Cc1onc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)CBr)C[C@@H]32)c1C	1784772226	ZQRBEFYBAROSJW-KJEVXHAQSA-N	428.327	1.916	50	20	IDGD	
O=C(CCc1ccc(F)nc1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21	1785234907	VNZROAFWVDLJOF-AYMQEEERSA-N	446.292	1.824	50	20	IDGD	
O=C(/C=C/c1ccc(O)c(O)c1O)N1CC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1785510595	RXDXQGRPPZXNBO-ROVVAWJSSA-N	431.272	1.450	50	20	IDGD	
CC1(CC(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](F)Cl)CCO3)CN(C(=O)OC(C)(C)C)C1	1785709757	QPGRLDYLRHXLBS-YWZLYKJASA-N	447.935	1.998	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccsc3)[C@H]2C1	1785921261	PVBCSLUTDUGFGJ-FUPWHNRLSA-N	443.529	1.475	50	20	IDGD	
CN1CCN(C2(C(=O)NC3(c4ccc(NC(=O)[C@H](O)CCl)cc4)CCC3)CC2)CC1	1786135958	JEKCINJOHXELSK-GOSISDBHSA-N	434.968	1.500	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)Cc3ccccc3)C[C@@H]21	1786406992	AGIPXWNNUCPOPG-FJIDUMEYSA-N	439.350	1.355	50	20	IDGD	
NC[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)c1ccccc1	1786924241	GWGQIXNRYHCBNJ-BQJWPVKWSA-N	442.329	1.399	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CC(=O)N(C4CCCC4)C3)C[C@@H]21)[C@@H](F)Cl	1787444403	ZNPUBRSCICJMAG-WSLKZVHASA-N	429.920	1.292	50	20	IDGD	
Cc1noc(N)c1C(=O)Nc1ccc(C2(NC(=O)c3cnccc3C(=O)NN)CCC2)cc1	1788009738	CGBKCHAANMBFBH-UHFFFAOYSA-N	449.471	1.625	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)c1ccc2ncnn2c1	1788450587	VVMKMTKXEIPAGQ-KKUMJFAQSA-N	436.310	1.108	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3CCC3)C[C@@H]21	1789222341	UGVRQQANFGLUNM-QSFXBCCZSA-N	445.472	1.914	50	20	IDGD	
N#Cc1c[nH]c(C(=O)NC2(c3ccc(NC(=O)c4cnccc4C(=O)NN)cc3)CCC2)c1	1789521266	WRPBJXHXKLHUPN-UHFFFAOYSA-N	443.467	1.946	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)COc3ccccc3F)C[C@@H]21)[C@H](F)Br	1789924974	KNPGESKCOALTLT-HJXMPXNTSA-N	447.276	1.875	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3Cc4ccccc4O3)C[C@@H]21	1791055940	KXVFEVLFTXTPSN-ADBDHWBDSA-N	437.334	1.753	50	20	IDGD	
CCOC(=O)C(C)(C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)CBr)C[C@@H]21	1792222681	RYRCXYAZUXNDEC-QPSCCSFWSA-N	447.370	1.586	50	20	IDGD	
Cc1nc(C)c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)CBr)s1	1792870167	JRXMSLGECSNFQW-WTDIUWLJSA-N	430.368	1.994	50	20	IDGD	
CC(=O)OC[C@@H](OC(C)=O)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](C)CBr	1792986575	AIKOHZPNAVQCNI-YDVLKRNPSA-N	447.326	1.150	50	20	IDGD	
COc1ccc(-c2cc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@H](F)Cl)n[nH]2)cc1	1796362971	LRDJPBUOXZOSRY-GGNLRSJOSA-N	436.871	1.823	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1ccc2c(c1)OCCO2	1796791231	AZRHGDTYCIWIDP-VZAMPYOESA-N	443.269	1.352	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(Cl)c(O)cc1O	1799445064	BROZHCJIPHZOEL-AMDHYVTDSA-N	447.713	1.738	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1CCC2(CC1)OCCO2	1800379166	COIPUIWKERZYSH-XMTFNYHQSA-N	428.957	1.917	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C[C@@H](N)c1cccnc1)C2	1800638942	DLKJUOCDVGSSNV-WXQHOCMDSA-N	439.354	1.235	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2	1800785607	HMOLUUUWZLLXGG-XLWJZTARSA-N	433.908	1.510	50	20	IDGD	
C[C@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cn1c(=O)n(C)c3ccccc31)C2	1801963025	VDVIBGYIJOHTEC-XQLPTFJDSA-N	449.349	1.762	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H]2CC[C@@H]3CCC(=O)N3C2)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803140190	BKZINIPXHDIJHK-ILRSOXBSSA-N	448.951	1.088	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1CCCSC1	1804244154	IJOWTWIWTFCYNH-AECQCBAMSA-N	431.562	1.902	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC2(CCCN(C(=O)c3cnc(OCF)cn3)C2)CC1	1807655737	MUSUIDVQRGNAMQ-AWEZNQCLSA-N	428.892	1.881	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1	1807998088	IHXODYMQTQKSHO-PLQHRBFRSA-N	449.305	1.991	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2nccnc2OC)[C@@H]1c1cccnc1	1813029847	ZKCTYGBZXNLOGJ-HLLBOEOZSA-N	433.896	1.454	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2cscn2)[C@H]1c1cccnc1	1813071230	QRFMLENYKIMJJH-KXBFYZLASA-N	430.534	1.231	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)CC2CCOCC2)[C@H]1c1cccnc1	1813071476	QVRNLIHLEHSSFS-CVDCTZTESA-N	445.564	1.277	50	20	IDGD	
O=C(CCn1ccnn1)NC[C@@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1	1813432534	ZGVLKKZGRDOFBX-MAUKXSAKSA-N	435.326	1.554	50	20	IDGD	
Cc1ccccc1C(=O)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1	1815361083	WJRJZHDCYCOKKB-MRXNPFEDSA-N	435.314	1.671	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@H](F)Br)CC2)c1cc(O)nc(O)c1	1816727034	CFSPNBXYPMLHHU-KRTXAFLBSA-N	445.270	1.866	50	20	IDGD	
COc1ccc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)CCC(=O)NN(C)C)CC3)nc1	1817884361	SJHFRPPYERJRLZ-GFCCVEGCSA-N	446.533	1.146	50	20	IDGD	
Cc1c(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@@H](O)CCl)CC3)nc2ccccn12	1818103419	YGGVGNCAFQUKOK-YPMHNXCESA-N	433.921	1.925	50	20	IDGD	
CCC(=O)N[C@H](C)C(=O)N[C@H]1CCc2nc(NC(=O)CO[Si](C)(C)C)sc2C1	1820160480	NHZOMAKMQOWXBD-NEPJUHHUSA-N	426.615	1.821	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)C23CC(C(=O)OC)(C2)C3)n[nH]1	1822148996	XXUYAHCHYGCXHF-BZUWMGCQSA-N	438.912	1.999	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCN2CCCCC2)[nH]n1	1822412684	DXLMKLAHXBSYTD-SFHVURJKSA-N	447.584	1.651	50	20	IDGD	
Cc1nnc(CC(=O)N[C@@H]2CCc3nc(NC(=O)[C@@H](F)Br)sc3C2)o1	1823002176	AOLBKWHUBFIFNU-JMCQJSRRSA-N	432.275	1.680	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H]1CCNC(=O)C1)CC2	1825453146	PVYQXGLTUXPBHU-DCAQKATOSA-N	443.367	1.755	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CSCC(=O)O)CC2	1825647016	HRFIARWETHAOTA-JGVFFNPUSA-N	436.353	1.656	50	20	IDGD	
CS(=O)(=O)CC(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H](F)Br)CC1	1826628910	KGJIKQXEFVNYIE-TZMCWYRMSA-N	427.336	1.341	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H]2CCCO2)CC1	1827244372	IJYOFTAASBXBNC-RBUKOAKNSA-N	429.521	1.097	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CN2CCCC2)CC1	1828922328	SJFJYKXXPMMDHM-HXUWFJFHSA-N	442.564	1.014	50	20	IDGD	
Cc1ncc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)CC2)[nH]1	1828923782	XXDGTSBSUZRVOS-IBGZPJMESA-N	439.520	1.264	50	20	IDGD	
CC(C)NCCC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1	1828926305	DUPDJURKBXKDBP-FQEVSTJZSA-N	444.580	1.307	50	20	IDGD	
CC(C)(C)c1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)cn1	1829566512	PNZKRLQAOPRUIG-IIBYNOLFSA-N	439.940	1.049	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(F)c3C)CCO2)C1	1830164166	XTABBCZNPUOSNU-OXQOHEQNSA-N	428.888	1.458	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3CC(C)(C)C3)C2)C1	1830543870	GSELPNDQDVIVFO-KUHUBIRLSA-N	431.371	1.910	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cnncc2C(=O)O)CC1	1831831368	WNNSLQOCCWTLQC-IAGOWNOFSA-N	438.912	1.662	50	20	IDGD	
C[C@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)c3ccon3)CC2)CC1	1833262584	WWLMUCIZPCGSEN-CYBMUJFWSA-N	427.343	1.891	50	20	IDGD	
C[C@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)c3cncnc3)CC2)CC1	1833262587	WXHCRQAAIJVSQZ-CQSZACIVSA-N	438.370	1.693	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3scnc3C3CC3)CC2)CC1)[C@H](O)CCl	1833308050	GVQDXADCALWGPK-MRXNPFEDSA-N	440.997	1.805	50	20	IDGD	
Cc1nc(C)c(C(=O)N2CCC(N3CCC(NC(=O)[C@@H](O)CCl)CC3)CC2)s1	1833309458	WKZYNMQXBUSELN-INIZCTEOSA-N	428.986	1.545	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCBr)CCO2)C1	1834823973	OZSZMBGJMTYQIS-LSDHHAIUSA-N	446.169	1.464	50	20	IDGD	
Cc1cccc(F)c1C(=O)N1CCOC[C@@]2(CN(C(=O)CCBr)CCO2)C1	1834826858	YZSSWENCXSKODH-LJQANCHMSA-N	443.313	1.989	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(CN(C(=O)CCC(F)(F)F)CCO2)C1	1835323139	LYLVFERGSATXLK-MRXNPFEDSA-N	426.508	1.637	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](F)Cl)CC2)CC1)c1cc2n(n1)CCCO2	1835569455	RENFOTNIRUZTLT-QGZVFWFLSA-N	427.908	1.385	50	20	IDGD	
C[C@H](C(=O)NC1CCN(C2CCN(C(=O)C(Cl)Cl)CC2)CC1)N1C[C@H]2C[C@H]2C1	1835676656	IYJXOEVIOUELIC-KFWWJZLASA-N	431.408	1.702	50	20	IDGD	
O=C(c1cc[nH]c2nccc1-2)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1836440434	DQSQUZCSNABQQT-GOSISDBHSA-N	427.288	1.388	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CCC(OC3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)o1	1836716956	AGFWRWKZCRLEPK-INIZCTEOSA-N	441.912	1.450	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836719173	OXDFYYUQBGLFIF-FZMZJTMJSA-N	425.751	1.368	50	20	IDGD	
C[C@H](C(=O)N1CCC(OC2CCN(C(=O)[C@@H](F)Cl)CC2)CC1)N1CCN(C)CC1	1838084277	UHMOXKNYGDXGPT-CRAIPNDOSA-N	432.968	1.155	50	20	IDGD	
COc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)cc(Cl)n1	1838230405	BGQOYYZFOZNDPX-YOEHRIQHSA-N	436.267	1.348	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(NC(C)=O)c3)C2)C1	1839148880	MNBPURZRJBWOLA-GHTZIAJQSA-N	437.924	1.732	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccnc(F)c3)C2)C1	1839150193	FIKRSLODVWPIPE-QZTJIDSGSA-N	434.295	1.527	50	20	IDGD	
O=C(c1cc(C2CC2)on1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839197268	OHUSHIVVJPEQAB-WMLDXEAASA-N	446.273	1.313	50	20	IDGD	
Cc1ccc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)o1	1839203176	CFSHVDLHNINACJ-NVXWUHKLSA-N	433.274	1.277	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CC(c3ccccc3)=NN1)CCO2	1839636069	HHCGYRKAGFNFIN-KPLVRAHFSA-N	448.951	1.226	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)C[C@H]3CCCCO3)C2)C1	1839962562	KLUANUNPUOKXCV-GJYPPUQNSA-N	447.370	1.576	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C)ccn3)C2)C1	1839964240	KUCBLPYEQJKEQS-KXBFYZLASA-N	440.338	1.634	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccc(F)cc3)C2)C1	1840032112	NZSFNGNJLTXAGQ-LIRRHRJNSA-N	443.313	1.608	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3c(F)cccc3F)C2)C1	1840153899	FGYNYHJQCNKGGY-QRWLVFNGSA-N	446.878	1.218	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(Cl)c(F)c3)C2)C1	1840155067	OUVLXCYKIIDPPE-BEFAXECRSA-N	449.306	1.803	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(CN(C(=O)CCCn3cccc3)CCO2)C1	1840461230	KGSKHORLCOTHTH-OAQYLSRUSA-N	437.613	1.576	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccc(C)o3)CCO2)C1	1840508720	LRWHILGFGPZZLG-APWZRJJASA-N	443.338	1.760	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccccc3C3CC3)CCO2)C1	1840658303	WQPWLBASYSYNJB-KNQAVFIVSA-N	436.936	1.888	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1ncc(Cl)cc1Cl)C2	1844263336	TYFRQUWNXUGCSM-UHFFFAOYSA-N	449.298	1.518	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)CCc1c[nH]c3ccccc13)C2	1844263904	JUWUMGPDVBFIIA-UHFFFAOYSA-N	446.511	1.616	50	20	IDGD	
COc1cc(Br)ccc1CC(=O)N1CCCC12CN(C(=O)[C@H](O)CCl)C2	1846461816	NVLHSDREUZZENM-CQSZACIVSA-N	445.741	1.803	50	20	IDGD	
O=C(COC(=O)c1ccc(OCC(F)(F)F)nc1)NNC(=O)c1cccc([N+](=O)[O-])c1	14168641	CQMVALRFOJXNTN-UHFFFAOYSA-N	442.306	1.549	50	20	IDGD	
O=C(NCc1nccn1C(F)F)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	726709795	POWXSEKIIPEFGG-UHFFFAOYSA-N	442.448	1.207	50	20	IDGD	
O=C(CCCc1ccccc1)NNC(=O)c1sccc1S(=O)(=O)N1CCOCC1	727717519	YLZQVGJOBNVLMS-UHFFFAOYSA-N	437.543	1.553	50	20	IDGD	
COc1ccc(C(=O)NNc2nc(-c3cccnc3)no2)cc1S(=O)(=O)NC1CC1	728079034	HPKFFTQAXGITJM-UHFFFAOYSA-N	430.446	1.338	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NC[C@@H]2CN3CCC[C@H]3CO2)c2ccccc2c1=O	729619018	NWXSJKXTQAOZSM-JKSUJKDBSA-N	442.520	1.004	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)NCc1ccc(CN2CCC(O)CC2)cc1	730913010	ZLOQKATVFZVBCR-UHFFFAOYSA-N	428.489	1.258	50	20	IDGD	
CC(C)(C)[C@@H]1CCc2sc(C(=O)NNC(=O)NCCCN3C(=O)CNC3=O)cc2C1	731116860	DBGTVCSWSISRHT-CYBMUJFWSA-N	435.550	1.785	50	20	IDGD	
O=Cc1ccc(OCc2occc2C(=O)NNC(=O)CNC(=O)c2cccs2)cc1	731625797	RLTKZYHHERDLTR-UHFFFAOYSA-N	427.438	1.924	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)CNC(=O)OCC(F)(F)F)c1	732071599	XBSUBMGTYHNMCX-UHFFFAOYSA-N	428.161	1.507	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)CNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)c1ccccc1	732292251	UGJLTRBWXMPRDA-SFHVURJKSA-N	446.529	1.008	50	20	IDGD	
O=C(NNc1cccc([N+](=O)[O-])c1)N[C@@H]1CCCN(c2cc(N3CCOCC3)ncn2)C1	732914030	JQYLNVQCWQDQRO-MRXNPFEDSA-N	442.480	1.517	50	20	IDGD	
CCOCCCn1c(NNC(=O)c2cccc(C(=O)OC)n2)nc2ccccc2c1=O	733266422	VDKPDORKOKDIFY-UHFFFAOYSA-N	425.445	1.762	50	20	IDGD	
CC(C)[C@H](CNC(=O)NNC(=O)Cc1nc2ccccc2n1C)NC(=O)OC(C)(C)C	734689660	NMJUBAXZQGVEAD-HNNXBMFYSA-N	432.525	1.996	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)N[C@@H](C)[C@@H]1CN(Cc2ccccc2)CCO1	741266400	JWURUGIQZWIPNP-UWJYYQICSA-N	442.516	1.694	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)[C@H]1CCCN(C(=O)c2ccncc2)C1	742034605	MAZJYDVUXBDYSE-KRWDZBQOSA-N	434.500	1.694	50	20	IDGD	
Cc1ccc(-n2c(=O)c3ccccc3n3c(SCC(=O)NNC(=O)C4CC4)nnc23)cc1	742445608	WGFWPMADXKLIJL-UHFFFAOYSA-N	448.508	1.991	50	20	IDGD	
CCOCCCn1c(=O)c2ccccc2n2c(SCC(=O)NNC(=O)C3CC3)nnc12	742445846	YNYNPZRNWFNHLJ-UHFFFAOYSA-N	444.517	1.120	50	20	IDGD	
Cc1ccc(S(=O)(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1Br	743252022	KBXULTHCTLSFQD-HNNXBMFYSA-N	427.276	1.907	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)/C=C/c1ccccc1)C(=O)NNc1ncnc2[nH]cnc12	743471269	XRBCDYISMOBDBQ-PLWJUESGSA-N	447.546	1.508	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)[C@H]1CC(=O)N(c2ccccc2)C1	744622342	SLXSXSQESUFXDY-INIZCTEOSA-N	444.513	1.204	50	20	IDGD	
O=C(NNC(=O)c1sccc1S(=O)(=O)N1CCCC[C@H]1CCO)c1ccccn1	745475076	TZMHDWASGUNUFC-ZDUSSCGKSA-N	438.531	1.144	50	20	IDGD	
COc1cc(C(=O)NCC(=O)NNC(=O)c2ccc(Cl)cc2F)cc(OC)c1OC	747514776	HXCZENZKULNVQB-UHFFFAOYSA-N	439.827	1.696	50	20	IDGD	
COc1ccc(Cl)cc1NC(=O)CCNC(=O)NNC(=O)COc1ccccc1O	747592420	ZOMNMWZXEUJPHJ-UHFFFAOYSA-N	436.852	1.792	50	20	IDGD	
O=C(CN1CCOC[C@H]1C[C@@H](O)c1ccccc1)NNC(=O)c1cccc([N+](=O)[O-])c1	747655521	CEVVKIBQYIOTKG-RTBURBONSA-N	428.445	1.180	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)c2ccc([C@]3(C)NC(=O)NC3=O)cc2)cc1OC	748015214	QKPPDRAOJRTCKE-NRFANRHFSA-N	426.429	1.223	50	20	IDGD	
CNS(=O)(=O)c1csc(C(=O)NNC(=O)COc2cc(C)ccc2C(C)C)c1	748691761	ZERYZGZQXQAACR-UHFFFAOYSA-N	425.532	1.928	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)NCCNC(=O)Cc2cccc(F)c2)cc1C	749013961	CBUWHPQDPZINJW-UHFFFAOYSA-N	429.452	1.070	50	20	IDGD	
CCc1cccc(S(=O)(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)c1	751208089	ZXJCPADIQCISBE-UHFFFAOYSA-N	425.532	1.188	50	20	IDGD	
O=C(C[C@H]1CSCCS1)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	752128158	XKCMKFKYPQLRJL-INIZCTEOSA-N	443.038	1.844	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N[C@H](C)c2nc[nH]n2)cc1	752640355	VHGIKQSNEILAGY-GULXKOIASA-N	434.460	1.337	50	20	IDGD	
CC(C)c1cccc(-n2cc(O)c(C(=O)NNC(=O)CCN3C[C@@H](C)O[C@H](C)C3)n2)c1	752788295	DSFXLHOBCPXWQJ-HZPDHXFCSA-N	429.521	1.962	50	20	IDGD	
CSCCCCCCNC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	753284903	PJFNPBHDVFUTIZ-UHFFFAOYSA-N	444.627	1.567	50	20	IDGD	
Cc1c(NC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)c(=O)n(-c2ccccc2)n1C	755321434	UHMLOMNUPGPBDX-UHFFFAOYSA-N	447.455	1.842	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(NC(=O)NNC(=O)c2cnccn2)ccc1Cl	755431557	KLBKPBOTLUHSAO-UHFFFAOYSA-N	426.886	1.627	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)Nc2cc(C)nn2[C@H]2CCS(=O)(=O)C2)c1	755538086	ZMSFPTLDVARYIO-HNNXBMFYSA-N	435.506	1.400	50	20	IDGD	
COc1cc(CN2CC[C@@H](NC(=O)NNC(=O)COc3ccccc3O)C2)cc(OC)c1	756103791	UKHUNXRSTTXRBO-MRXNPFEDSA-N	444.488	1.393	50	20	IDGD	
COC(=O)c1ccc(NC(=O)NNC(=O)c2ccc(OC)c(OC)c2)cc1C(=O)OC	756816311	CQGGNSRXWDNHOH-UHFFFAOYSA-N	431.401	1.744	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)CC1(C)OCCO1	758856774	AZZYSZSFBOBBBT-GOSISDBHSA-N	433.553	1.318	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)C1(CNC(=O)OC(C)(C)C)CC1	759381441	SQHSCWKKUDQPLT-UHFFFAOYSA-N	439.538	1.354	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2Br)C[C@@H](C)O1	760787891	MUYKMXXMZCGLJL-PHIMTYICSA-N	429.271	1.618	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1cnc(-c2cccnc2)s1	761205929	LSMFFCSOHZEBQO-UHFFFAOYSA-N	430.515	1.881	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1	761638371	YFSXTHHHLKYFLS-UHFFFAOYSA-N	437.543	1.564	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)NCCc1ccc(Cl)nc1	761774820	QOQURXPVYIGEMX-UHFFFAOYSA-N	430.940	1.820	50	20	IDGD	
N#Cc1ccc(-c2ccc(OCC(=O)NNC(=O)c3ccc4nnc(O)n4c3)cc2)cc1	762937863	NCBGLRTZOYHDFC-UHFFFAOYSA-N	428.408	1.814	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNS(=O)(=O)c1cc2oc(=O)[nH]c2cc1Cl	763439743	QJTARXRERHZQOP-UHFFFAOYSA-N	448.885	1.389	50	20	IDGD	
CN(C)C(=O)c1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)c1c[nH]c2ccccc12	763541623	ZHHHCVCXQDIIJG-UHFFFAOYSA-N	427.848	1.923	50	20	IDGD	
COC(=O)C(C)(C)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)cc1	763548817	SMPBLWBIUNSXTG-UHFFFAOYSA-N	427.413	1.266	50	20	IDGD	
Cc1ccc(-n2cc(C)cn2)c(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1	763572622	STPCOBAOIRZVET-LJQANCHMSA-N	435.440	1.415	50	20	IDGD	
C[S@@](=O)c1cccc(NC(=O)C(=O)NNC(=O)COc2ccc(C(C)(C)C)cc2)c1	763593259	AHZXZYLRQSKDPI-SSEXGKCCSA-N	431.514	1.886	50	20	IDGD	
COC(=O)c1ccccc1NC(=O)C(=O)NNC(=O)COc1ccc(C(C)(C)C)cc1	763595475	QMMXYUUEUHWZGQ-UHFFFAOYSA-N	427.457	1.936	50	20	IDGD	
CC(C)(C)c1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc3c(c2)OCCO3)cc1	763601435	ZJDNSTAKHZEKCJ-UHFFFAOYSA-N	427.457	1.920	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1cccc(N2CCOC2=O)c1C	763628440	KMXZVXYKCIIIAX-UHFFFAOYSA-N	436.428	1.307	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(N3CCCNC3=O)c2)c1	763631058	SWUDODGEBUJAQJ-UHFFFAOYSA-N	425.445	1.080	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2F)c(OC)cc1Cl	763683198	WORDIKOLKQJNQS-UHFFFAOYSA-N	425.800	1.661	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)C(=O)Nc1ccc(Cl)c2cccnc12	763803238	KAAQIOAGJPDEAZ-UHFFFAOYSA-N	443.803	1.961	50	20	IDGD	
Cc1cc(Oc2ncccn2)ccc1NC(=O)C(=O)NNC(=O)COc1ccc(F)cc1	763837611	JRRMIEOUFGDRLR-UHFFFAOYSA-N	439.403	1.881	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)C(=O)Nc1ccc(CC(N)=O)cc1	763851851	FWPHIAKFDFLKJD-AWEZNQCLSA-N	434.452	1.421	50	20	IDGD	
Cc1nnc(-c2cccc(NC(=O)C(=O)NNC(=O)Cc3c[nH]c4ccccc34)c2)n1C	763860241	CFUJKASDZAYFET-UHFFFAOYSA-N	431.456	1.600	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cnn(-c3ccccc3)n2)cc1	763864588	DDSXTELSDRVKRJ-CQSZACIVSA-N	438.444	1.219	50	20	IDGD	
CON(C)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)cc1	763873126	RUWPEYKCCDLVHF-GFCCVEGCSA-N	432.408	1.013	50	20	IDGD	
O=C(NNC(=O)c1ccc(Br)s1)C(=O)Nc1cccc(-n2ccnn2)c1	763940118	DNUAVNUHEKRILG-UHFFFAOYSA-N	435.263	1.491	50	20	IDGD	
COc1cccc(Cn2nccc2NC(=O)C(=O)NNC(=O)c2ccccc2C)c1OC	763957467	DRBYPAJLCLKTON-UHFFFAOYSA-N	437.456	1.657	50	20	IDGD	
COC(=O)c1cc(F)c(F)cc1NC(=O)C(=O)NNC(=O)c1ccc(Cl)cc1OC	764011606	IXRHTSDQHXUXOS-UHFFFAOYSA-N	441.774	1.813	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1cc(OC)c(OC)c(OC)c1	764012394	PDCUAPKESOWZJB-UHFFFAOYSA-N	437.836	1.774	50	20	IDGD	
CCCCN(C)c1ccc(NC(=O)C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1	764083900	CGFVPIWTOQJGAE-UHFFFAOYSA-N	446.529	1.726	50	20	IDGD	
COC(=O)c1cc(Br)c(F)cc1NC(=O)C(=O)NNC(=O)CC(F)(F)F	764115398	PTFVROBYQBQLOW-UHFFFAOYSA-N	444.135	1.413	50	20	IDGD	
CCN(CC(=O)NNC(=O)Cc1ccccc1C)CC(=O)Nc1ccc2c(c1)OCCO2	764157129	YVOXMDOAVIMXCB-UHFFFAOYSA-N	440.500	1.417	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)C(C)C)cc1NC(=O)C(=O)NNC(=O)CC1CCCC1	764189214	YUCNMQXDGRRMES-UHFFFAOYSA-N	438.550	1.690	50	20	IDGD	
O=C(CCCc1ccccc1)NNC(=O)C(=O)Nc1ccc(CN2C(=O)CCC2=O)cc1	764223585	JTBLRBBYMQYNQE-UHFFFAOYSA-N	436.468	1.444	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)C(=O)Nc1cc(Br)ccc1-n1cccn1	764267617	IBCZQJPKBPJWOS-UHFFFAOYSA-N	443.261	1.358	50	20	IDGD	
NC(=O)c1cnn2c(C(=O)NNc3cc(C(F)(F)F)nc(-c4cccnc4)n3)ccnc12	764271624	PWTPNUOEZQMSRE-UHFFFAOYSA-N	443.349	1.456	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C(=O)N1C[C@H](C(=O)OC)Oc2ccccc21)c1ccccc1	764330973	ZUYCQUJQFDGEDO-MAUKXSAKSA-N	425.441	1.295	50	20	IDGD	
COc1cc(OC)c(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1Cl	764350218	AZBKMBVVGDWWCM-UHFFFAOYSA-N	443.847	1.943	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)C(=O)Nc1csc(-c2ccccn2)n1	764352067	ZCGGCYJOWGACAN-UHFFFAOYSA-N	433.453	1.791	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccnn2[C@H]2CCN(Cc3ccccc3)C2)o1	764371375	ZDGHMWFJKJRMAT-KRWDZBQOSA-N	436.472	1.631	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1)C(=O)Nc1cc2c(cc1Cl)OCO2	764386845	DFBNENWAZLHAHC-UHFFFAOYSA-N	445.794	1.998	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)C(=O)Nc1ccc(CN2CCOC2=O)cc1	764404495	KHAAYKHTMDSDKM-UHFFFAOYSA-N	444.469	1.223	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)C(=O)Nc1ccnc(OCC(F)(F)F)c1	764405230	QVTLOWGPGYORIA-UHFFFAOYSA-N	444.391	1.607	50	20	IDGD	
CC(C)(C)OC(=O)N1CCO[C@H](C(=O)NNC(=O)c2ccc(Br)s2)C1	764568834	KYMPDUUHPAWRAV-VIFPVBQESA-N	434.312	1.908	50	20	IDGD	
COc1cc(C(C)=NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc([N+](=O)[O-])c1O	764665098	IAJKJBWIECJLFQ-UHFFFAOYSA-N	436.446	1.713	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)[C@@H](c1ccccc1)N1CCC(O)CC1	765417936	KKLJKXPWUTUOGY-LJQANCHMSA-N	434.537	1.637	50	20	IDGD	
Cc1ccc(C)c(S(=O)(=O)NCCC(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)c1	765572014	UHUNZJMYPYFSDI-UHFFFAOYSA-N	447.542	1.885	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)CSCC(=O)Nc2cccc(Br)c2)n[nH]1	765587561	DIAVUCDGFBMFNM-UHFFFAOYSA-N	426.296	1.614	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccccc1)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	765616885	PKLNLRUFOYZTFR-UHFFFAOYSA-N	431.449	1.345	50	20	IDGD	
Cc1noc(C)c1CCC(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	765752332	RCJMKBAUBGSNHY-UHFFFAOYSA-N	433.940	1.843	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)N[C@H]2CCC[C@@H]2C(=O)NC)cc(OCC)c1OCC	765778866	QLACJYLWWWFZMF-GJZGRUSLSA-N	436.509	1.741	50	20	IDGD	
CN(C)c1nccc(NNC(=O)c2cc(I)cc([N+](=O)[O-])c2)n1	766194424	WXVIOQDRXZNHSQ-UHFFFAOYSA-N	428.190	1.812	50	20	IDGD	
CCCCCn1cc(CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)c(C)n1	767186895	GNFPXQLDXOIFAQ-UHFFFAOYSA-N	435.554	1.819	50	20	IDGD	
O=S(=O)(CBr)NC[C@H](NS(=O)(=O)CBr)C1CCCC1	767541177	PORFRCHHKDUOSP-VIFPVBQESA-N	442.195	1.089	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)N[C@@H]1CC(=O)N(Cc2ccccc2C(F)(F)F)C1	768519497	VADMYALOXBCGAK-TZMCWYRMSA-N	446.426	1.188	50	20	IDGD	
CC1(C)CCC[C@@]2(C1)NC(=O)N(CC(=O)NNC(=O)c1cc(Br)c[nH]1)C2=O	768571068	METVRRDHEPFRPS-KRWDZBQOSA-N	440.298	1.429	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)NCc2cccnn2)cc1	768578622	HWSIYXCZCZXVFK-LFIBNONCSA-N	431.456	1.447	50	20	IDGD	
COc1ccc(C(=O)NNC(=S)Nc2ccccn2)cc1S(=O)(=O)N1CCCC1	768579724	VVVALRGJNQEFDT-UHFFFAOYSA-N	435.531	1.506	50	20	IDGD	
C[C@H](NC(=S)NNC(=O)CN1C(=O)N[C@@](C)(c2ccc(F)c(Cl)c2)C1=O)C1CC1	770247420	WTJSYIXUFUUHIW-YYSFKGJASA-N	441.916	1.540	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccc(Br)c(F)c2)cn1	770809903	CCTRDOXTBWSZLP-UHFFFAOYSA-N	431.243	1.469	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2CCCCO2)c1	772221672	TXVYWSLTFPLFBO-SFHVURJKSA-N	433.486	1.826	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)c1cc(N2C[C@@H](C)O[C@H](C)C2)ccn1	772561082	OBQCGDDXQQBBJI-ZIAGYGMSSA-N	434.518	1.864	50	20	IDGD	
Cc1noc(-c2ccccc2)c1NC(=O)C(=O)NNC(=O)COc1ccccc1[N+](=O)[O-]	773495113	YPJIMCFGUCPHJE-UHFFFAOYSA-N	439.384	1.723	50	20	IDGD	
Nc1nc(Cl)cc(NNC(=O)CNS(=O)(=O)c2ccc(OC(F)(F)F)cc2)n1	773864413	XJUCJQKMOJSOQI-UHFFFAOYSA-N	440.791	1.032	50	20	IDGD	
COc1cc([C@@H](NC(=O)NNC(=O)c2c[nH]nc2C)C(F)(F)F)cc(OC)c1OC	775995978	ODTHYLOZZHMTLX-CQSZACIVSA-N	431.371	1.992	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)N[C@H](c1ccc(OC(F)F)cc1)C(F)(F)F	776011788	BHDSZKPIVPWHGN-OIBJUYFYSA-N	448.370	1.160	50	20	IDGD	
O=C(NNC(=O)c1c(Cl)cccc1Cl)N[C@@H]1CCO[C@]2(CCS(=O)(=O)C2)C1	776075770	DVFGOKXYJSLEFB-QLJPJBMISA-N	436.317	1.674	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)c2cn(-c3cccc(Cl)c3F)nn2)cc1	776441793	XWVCUFFWBAVWOY-UHFFFAOYSA-N	442.794	1.549	50	20	IDGD	
COCCO[C@H]1COCC[C@@H]1NC(=O)NNC(=O)c1cc(OC)ccc1Br	777280340	ZMAWPRQNTPUXRT-GJZGRUSLSA-N	446.298	1.222	50	20	IDGD	
CCCCn1c(N)c(N(CC(=O)NNC(=O)c2cccc(C)c2)CC(C)C)c(O)nc1=O	777606268	NVNJKBDQISYQGF-UHFFFAOYSA-N	444.536	1.563	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)c2ccc(O[C@H](C)C(=O)NN(C)C(N)=O)cc2)cc1C	778418077	IIYOCHCFQAEUCD-OAHLLOKOSA-N	434.518	1.938	50	20	IDGD	
CN(C)CCn1ccc(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2Br)n1	778752105	MVLHNVFOWWXNRB-UHFFFAOYSA-N	440.258	1.197	50	20	IDGD	
COC[C@@H](C)n1ccc(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2Br)n1	778754072	WGEKIHPGVAAZTK-SECBINFHSA-N	441.242	1.843	50	20	IDGD	
CC[C@@H](C)[C@@H](C)C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	779719195	LEJTXBHXBYBZLD-HZPDHXFCSA-N	425.551	1.470	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1S(=O)(=O)NNC(=O)C12CC3CC(CC(C3)C1)C2	780365957	PPDQWLXHXYCRKG-UHFFFAOYSA-N	441.575	1.463	50	20	IDGD	
CC(C)c1nc(C#N)c(NNC(=O)[C@@H]2C[C@@H](O)CN2S(=O)(=O)c2ccc(F)cc2)o1	780515892	NBFJPPDLQUGYEB-DOMZBBRYSA-N	437.453	1.076	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)CNC(=O)NCc2ccc([N+](=O)[O-])cc2)cc1Cl	782799601	ZHWAOPRPKLCETM-UHFFFAOYSA-N	435.824	1.977	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)cc1)C(=O)Nc1ccc2c(c1)CCN2C(=O)c1cccnc1	782831290	CNKBEAJLWDQVPS-UHFFFAOYSA-N	445.435	1.390	50	20	IDGD	
CCOc1cc(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)ccc1OC	782892596	FBKQLRGHXPUMPM-UHFFFAOYSA-N	425.445	1.309	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C(=O)Nc2cc(Br)ccc2F)nc2ccccc21	782894406	UHDRMMOLFBXTGI-UHFFFAOYSA-N	448.252	1.804	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ncnc3ccsc23)cc1NC(=O)CCN(C)C	783253748	SGWLPHSZKOBBTQ-UHFFFAOYSA-N	441.517	1.972	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)(F)F)cc1)C(=O)Nc1cnc(C2CC2)nc1	783407801	FVJMCFMSIHJFRU-UHFFFAOYSA-N	429.380	1.729	50	20	IDGD	
Cc1ccccc1NC(=O)NNC(=O)C(=O)Nc1ccc2nc(N3CCOCC3)oc2c1	783413322	IFGKUFONDVMNRR-UHFFFAOYSA-N	438.444	1.764	50	20	IDGD	
Cc1cc(N2CCOCC2)ccc1NC(=O)C(=O)NNc1cccc(S(C)(=O)=O)c1	784845055	XHPQLRYQBRJDKB-UHFFFAOYSA-N	432.502	1.317	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(c2ncc(NC(=O)NNC(=O)C3CCCC3)cn2)CC1	786184090	UOCDFOADAVTXAW-UHFFFAOYSA-N	433.513	1.877	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)N(C)Cc1cccc(Br)c1OCC(C)(C)O	786450305	DJWGYTWMYNGIKN-GFCCVEGCSA-N	430.343	1.977	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C)c(C(=O)N3CCOCC3)c2)cc1	787541399	QSPQPKLTEITBJG-UHFFFAOYSA-N	438.484	1.430	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)NNC(=O)C(C)(OCC)OCC	788006824	MNFNJYSZHCAUGM-UHFFFAOYSA-N	446.526	1.278	50	20	IDGD	
CS(=O)(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)ccc1Cl	788331640	STZRGGCHUNAQMP-UHFFFAOYSA-N	446.268	1.502	50	20	IDGD	
CSC[C@H](C(=O)NNc1nnc(-c2ccccn2)s1)N1C(=O)[C@H]2CCCC[C@@H]2C1=O	788563963	YLIMIEARNMOSNL-SGMGOOAPSA-N	446.558	1.950	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1cnnn1-c1cccc(F)c1	789871223	NVWHNTFFKABKIS-UHFFFAOYSA-N	431.453	1.083	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCN([C@@H](C#N)c3cccc(Cl)c3)CC2)n1	791621829	XBWZRXLGDBFHDC-KRWDZBQOSA-N	446.964	1.677	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)[C@@](C)(NC(C)=O)c1ccc(S(C)(=O)=O)cc1)c1ccccc1	797449365	OAFIEZYEPFQFGV-KNQAVFIVSA-N	445.541	1.783	50	20	IDGD	
Cc1ccccc1NC(=O)NNC(=O)c1cc(S(N)(=O)=O)ccc1Br	798310824	WPXCCEDSGAKMRX-UHFFFAOYSA-N	427.280	1.871	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)Nc1ccc(F)cc1OCCC(F)(F)F	800593771	QKGVYDWXKMYCMN-SECBINFHSA-N	427.376	1.744	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(Br)s1)NNC(=O)Nc1ccccc1	801989537	CEMOJHRVZRLJNZ-UHFFFAOYSA-N	433.309	1.642	50	20	IDGD	
CCN1CCN(CC(=O)NNC(=O)Nc2c(Cl)cc(Cl)cc2Cl)C(=O)C1=O	802068497	DNEYTERLQSNDLG-UHFFFAOYSA-N	436.683	1.490	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)Cn2ccc(=O)c([N+](=O)[O-])c2)cc1Cl	802071892	MBIFZMKITAYWPP-UHFFFAOYSA-N	425.785	1.280	50	20	IDGD	
Cc1c(C(F)(F)F)nn(C)c1NC(=O)C(=O)NNC(=O)c1cc(Br)c[nH]1	806977007	RLRBYDFBCUIYMS-UHFFFAOYSA-N	437.176	1.238	50	20	IDGD	
CC[C@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(Oc2ccnc(C(=O)NC)c2)c(F)c1	810384938	RTLLMFIIWAMOLT-NSHDSACASA-N	431.424	1.505	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C[C@@H](c2ccccc2)N2CCOC2=O)cc1	812730709	STFKHBAIMSJUSC-SFHVURJKSA-N	432.502	1.964	50	20	IDGD	
O=C1CN(Cc2cccc(NC(=O)C(=O)NNC(=O)c3ccc4ccccc4c3)c2)CCN1	812978967	HGOVNHHDTDXJAR-UHFFFAOYSA-N	445.479	1.171	50	20	IDGD	
CCOC(=O)c1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(CC)CC)c2)nc1	814698365	BIMFIZNRHBLXDQ-UHFFFAOYSA-N	448.501	1.364	50	20	IDGD	
CC(=O)C1(C(=O)NNC(=O)c2ccc(CN(C)S(=O)(=O)c3ccc(C)cc3)cc2)CC1	814717466	JGZMDPSLEWEVGA-UHFFFAOYSA-N	443.525	1.946	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)C(C)(C)c2ccccc2)nnn1Cc1ccccc1F	815569226	KZTAQAQCEYYIST-UHFFFAOYSA-N	438.463	1.838	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCc2nncn2C1)C(=O)Nc1ccc(Cl)c(C(F)(F)F)c1	815692358	PFFMPGJEXBJFQY-MRVPVSSYSA-N	430.774	1.299	50	20	IDGD	
Cc1nn([C@@H]2CCS(=O)(=O)C2)c2nc(C3CC3)cc(C(=O)NNC(=O)CC3CC3)c12	819109822	KVVIKVHORFWOIN-CQSZACIVSA-N	431.518	1.538	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)[C@@H](CC(C)C)N1C(=O)[C@H]2CC=CC[C@H]2C1=O	825630855	QWRBERZQOQSYBT-SOLBZPMBSA-N	442.516	1.620	50	20	IDGD	
O=C(COC(=O)CCNS(=O)(=O)/C=C/c1ccccc1)NNC(=O)c1cccs1	834582409	MHILXPWJLJGCPF-FMIVXFBMSA-N	437.499	1.033	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCCN1CCc2ccccc2C1	913465362	UBOLBGKMCYHABD-UHFFFAOYSA-N	444.561	1.290	50	20	IDGD	
Cc1nnnn1[C@@H](Cc1cccc(F)c1)C(=O)NNC(=O)[C@H](C)Oc1ccccc1F	915697597	SNPDAXNQKZKSNL-SJCJKPOMSA-N	430.415	1.658	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc([C@@H](C)NC(=O)NN[C@]2(C)CCS(=O)(=O)C2)cc1	915901806	LKYQRSHBTFJVGG-RDTXWAMCSA-N	446.595	1.159	50	20	IDGD	
CC(=NNC(=O)c1c(C)nc2ccccn12)c1ccc(S(=O)(=O)N2CCOCC2)cc1	915929808	JMIPROXPYKQCJE-UHFFFAOYSA-N	441.513	1.818	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)NCCc2cc(Cl)c3c(c2)OCCO3)cc1	916229982	FLRWSRXBUDLMPM-UHFFFAOYSA-N	430.848	1.935	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCCNC(=O)c2ccccc2Cl)c1	916263403	AGNGXHJXBWYGGS-UHFFFAOYSA-N	438.893	1.118	50	20	IDGD	
Cc1ccc(CNC(=O)c2cccc(CNC(=O)NN[C@]3(C)CCS(=O)(=O)C3)c2)cc1	916511023	IWXKJTRZPNTSGV-JOCHJYFZSA-N	444.557	1.806	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCCOc2ccc(F)cc2)cc1	916612747	IPLNSMLKCIUFMU-UHFFFAOYSA-N	438.481	1.164	50	20	IDGD	
CC(C)(C)NS(=O)(=O)CCNC(=O)NNC(=O)COc1ccccc1-c1ccccc1	916622408	PAUSTARWWVKLPW-UHFFFAOYSA-N	448.545	1.781	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)NCCS(=O)(=O)Cc2ccccc2)cc1OC	916635812	FFLLIVSVBYIQDJ-UHFFFAOYSA-N	435.502	1.653	50	20	IDGD	
O=C(NCCCCN1CCN(Cc2ccccc2)CC1)NNC(=O)c1ccccc1O	918229200	YRYUPUNVKDAOLD-UHFFFAOYSA-N	425.533	1.934	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCc2ccc(N3CCOCC3)cc2)nc1	919790982	VOGXQYFQLGSMJG-UHFFFAOYSA-N	448.549	1.431	50	20	IDGD	
CC(C)(C)Cc1noc2nc(C3CC3)cc(C(=O)NNC(=O)N[C@H]3CCS(=O)(=O)C3)c12	919884472	FVLIWVNNZUMTNC-LBPRGKRZSA-N	449.533	1.820	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)c2nc(S(C)(=O)=O)n3ccccc23)cc1	920274894	ZOKPJMGMWCNYIY-ZDUSSCGKSA-N	446.485	1.365	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)Nc1ccc2c(c1)C(=O)NC2=O	920931147	DDJCHVQRCNMLJE-UHFFFAOYSA-N	433.218	1.564	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(N2CCOCC2)c(C(=O)NNc2cccnn2)c1	1116567096	JPRSDSSLQNYDOC-UHFFFAOYSA-N	434.522	1.101	50	20	IDGD	
Cc1nn([C@@H]2CCS(=O)(=O)C2)c2nc(C3CC3)cc(C(=O)NNc3cccnn3)c12	1320946176	OUVHDRRGLPPENJ-CYBMUJFWSA-N	427.490	1.524	50	20	IDGD	
CC(C)NS(=O)(=O)c1cc(C(=O)NNC(=O)c2cncn2-c2ccccc2)ccc1F	1321605377	MVVILSLLUXBPTL-UHFFFAOYSA-N	445.476	1.773	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)c2ccccc2CN2CCOCC2)CC1	1323411325	LJQDNQNHWOILQW-UHFFFAOYSA-N	446.548	1.927	50	20	IDGD	
O=C(NCCS(=O)(=O)CCc1ccccc1)NNC(=O)c1cncn1-c1ccccc1	1344645852	YGXHFMTVSANEPC-UHFFFAOYSA-N	441.513	1.474	50	20	IDGD	
CC(C)(C)c1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](O)CCl)C3)[nH]n1	1779725347	DEUKYLGRZHSMKJ-YYFZDKIDSA-N	426.945	1.434	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccnc4c3OCO4)C2)C1	1780029229	WHGQTPRIEHWDND-ZWKOTPCHSA-N	430.288	1.490	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cccc(C#N)c2)C1	1780350137	RVKZAQDRSGUKMB-AUSIDOKSSA-N	441.532	1.059	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](NC(=O)OC)c1ccccc1)CCO2	1781211053	HGAKQDJZOXSVHA-CSODHUTKSA-N	437.924	1.931	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H]1CN(Cc3ccccc3)CCO1)CCO2	1781218387	HAUIFWLJXFSXMW-SXWKCWPCSA-N	449.979	1.735	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](NC(C)=O)c1ccc(F)cc1)CCO2	1781218930	UHZNXOJRPOJWSH-DBXWQHBBSA-N	439.915	1.850	50	20	IDGD	
C[C@H](C(=O)N1CCO[C@]2(CCN(C(=O)[C@@](C)(Cl)CCl)C2)C1)n1ccccc1=O	1781229686	HZRAFRMTMMNZMQ-MDASCCDHSA-N	430.332	1.476	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](O)NC(=O)OC(C)(C)C)C2)C1	1781853824	QITBHWFVVMUWKK-NJSLBKSFSA-N	433.933	1.067	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1nnc(C)s1)C2	1782170251	DQPZULCZJGHJDA-HBUWYVDXSA-N	430.958	1.157	50	20	IDGD	
Cc1cc(F)ccc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCC(=O)NN(C)C)C1	1782214247	MODJTXYTSMCHCG-AUSIDOKSSA-N	448.539	1.635	50	20	IDGD	
C[C@@H](Cc1ccco1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)C2	1782598490	MDODWBGAVUWWKS-GEQKSPFYSA-N	448.564	1.345	50	20	IDGD	
CC(C)(C)OC(=O)NC12CC(C(=O)N3CC[C@@]4(CN(C(=O)[C@H](F)Cl)CCO4)C3)(C1)C2	1783437021	QMOZZNAJWUBZTQ-QHQDJBGNSA-N	445.919	1.798	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(-c4ccccn4)[nH]n3)CCO2)C1	1783538067	SKGNYTQVBAZYSO-YJYMSZOUSA-N	448.321	1.699	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CC3CCN(C)CC3)[C@H]2C1	1783656715	FVFXYKBJNGGSEI-HJWJTTGWSA-N	430.387	1.481	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc4cc(OC)ccc4n3)CCO2)C1	1783875360	QCNIJYDONJGHBY-JTSKRJEESA-N	447.919	1.941	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3nnc(-c4ccccc4)o3)CCO2)C1	1783877204	HIKFGRWFXZYUSN-FOIQADDNSA-N	434.880	1.434	50	20	IDGD	
Cc1ccc(SCC(=O)N2CCO[C@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc1	1783936411	VNGQBOOYJZEWMR-QFIPXVFZSA-N	448.589	1.290	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCCC(=O)OC(C)(C)C)[C@H]2C1	1784137453	SVCDTJUPSQYKBR-NXOAAHMSSA-N	446.972	1.732	50	20	IDGD	
Cc1ccc(C(=O)NCC(=O)N2CC[C@@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)cc1	1785561429	SAFOHWORHXSIAA-JOCHJYFZSA-N	435.952	1.820	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(O)cn3)[C@H]2C1	1786272371	YOWHPCYKLSJICI-DSPQJCBJSA-N	426.311	1.412	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CC3CCOCC3)[C@H]2C1	1786739266	BBGZREXSPWAOBN-NXOAAHMSSA-N	431.371	1.956	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)c3ccc(=O)oc3)CCC2)cc1)c1cccc(B(O)O)c1	1788145928	HUKFYCJHXKGJKW-UHFFFAOYSA-N	432.241	1.381	50	20	IDGD	
CCCC(=O)N[C@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)CBr)C[C@@H]21	1788738715	GLLCIZKEPBTRHB-OWYFMNJBSA-N	446.386	1.302	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)c1ccc(C(F)(F)F)cc1	1789604019	TWJRXLQDKHNYJL-TUUVXOQKSA-N	434.842	1.898	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(OC)n(C)n3)C[C@@H]21	1790962813	CESACBPEDCPAJO-XPCVCDNBSA-N	443.342	1.196	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)n3cc(C)cn3)C[C@@H]21	1790963771	LXPUBLKFIVOSBZ-HMDCTGQHSA-N	441.370	1.906	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)c1cc(C(F)(F)F)ccn1	1796188731	NBJLOBGIAGBBRC-BJWYYQGGSA-N	447.222	1.346	50	20	IDGD	
C[C@H](Sc1ccccn1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1	1796192068	FRYIGWNZLACRPA-FZDIXFNVSA-N	439.346	1.194	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CCc3ccccc3O1)C2	1797956506	HCZHACRYDIJXQD-SHJAMOMRSA-N	432.593	1.821	50	20	IDGD	
C/C=C(\C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O	1798522960	JCHPJNIRMSSRFF-QDLNHOJZSA-N	431.445	1.690	50	20	IDGD	
C[C@H]1Oc2ccc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)C(C)(C)CCl)C4)cc2NC1=O	1798581625	PKZZTBHBGNJWQK-LJGDNWOOSA-N	449.935	1.874	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(OC)c(O)cc1[N+](=O)[O-])C2	1799269026	QORAWTKDBULXEQ-WYFUGZQLSA-N	441.868	1.530	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1noc3c1CCCC3)C2	1799274789	IBHYWSOQVWVWJZ-CVGJEZRXSA-N	430.332	1.993	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nc3ccccc3o1)C2)[C@@H](F)Br	1799348488	JDPRNFOKCTWEFK-RDBQEKCUSA-N	426.242	1.722	50	20	IDGD	
COc1cc(C)cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCBr)C3)c1	1799450070	DJBCCXRRLPCYQC-JLVBRIDZSA-N	425.323	1.992	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cc(F)ccc1F)C2	1800763832	MDCXKDLMECYGIL-MMPOEDRJSA-N	431.277	1.880	50	20	IDGD	
CC[C@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](COC(C)=O)OC(C)=O)C2	1801801298	CZERGPPLGHBPBX-XFIYOXNOSA-N	447.326	1.293	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CO[Si](C)(C)C)C2	1801955935	NLLQCVDNMFCYPV-JLVBRIDZSA-N	443.617	1.342	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1CCN(C(=O)c2cc(O)ncn2)[C@@H]1c1cccnc1	1803010685	JHAAEPVZMOVZAU-HACGYAERSA-N	448.321	1.928	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc3c(c2)OCO3)[C@@H]1c1cccnc1)[C@H](O)CCl	1803138724	DWFSKTGYCZJHNN-FRQCXROJSA-N	431.876	1.730	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2nccc3nc[nH]c23)[C@H]1c1cccnc1)[C@H](O)CCl	1803138857	GHDTVYUBTALCBL-JOQOYGCGSA-N	428.880	1.272	50	20	IDGD	
CN(C)c1cncc(C(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)c1	1803142060	VNWUPLQWGMNODH-MNEFBYGVSA-N	431.924	1.462	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCCC2(CCN(C(=O)[C@@H](C)NS(=O)(=O)CC)CC2)C1	1806154015	QWONPCZRWAXZIE-CVEARBPZSA-N	436.018	1.953	50	20	IDGD	
C[C@@H](O)C(=O)N1CCC2(CCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)CC1	1806760971	SAULEKUJBWBLHQ-CABCVRRESA-N	431.961	1.731	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cccs2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1	1807369771	UTJKNHAOUDWYMJ-PXNSSMCTSA-N	435.314	1.456	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc(O)cc2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1	1807374440	HIBLKQCHFHQICM-SIKLNZKXSA-N	445.284	1.100	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](O)C(=O)N1CC[C@H](CNC(=O)[C@H](F)Cl)[C@@H]1c1cccnc1	1808314453	HHJKBNTXOWFDFA-ORIJERBGSA-N	444.891	1.465	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)[C@@H]2C[C@H]2C2CC2)[C@H]1c1cccnc1	1810293275	BSWJHRYRVQLMSC-ROPHOZQPSA-N	448.527	1.446	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)n3)C2)CC1	1810881856	AULRMVWNYQLTGD-GFCCVEGCSA-N	441.326	1.764	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)c1cc2cccnn2n1	1811264462	XKIBADHQHZBXLL-BMGDILEWSA-N	428.880	1.044	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2cnc3ncccn23)[C@@H]1c1cccnc1	1813030195	HSQNIBLKTUNAMU-XYJFISCASA-N	442.907	1.698	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2sccc2F)[C@@H]1c1cccnc1	1813069007	RNQIWFZNKCDODZ-HNAYVOBHSA-N	447.536	1.975	50	20	IDGD	
C[C@@H](CS(C)(=O)=O)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CO[Si](C)(C)C)[nH]n1	1815229385	GZDDNUSDVRCETH-DZGCQCFKSA-N	444.630	1.934	50	20	IDGD	
CC[C@H](C)[C@H](O)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1815253855	SXOLELFMMJANNT-IWEFOYFVSA-N	443.508	1.121	50	20	IDGD	
CSCC(C)(C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1815265275	KPBAVTPOBTURAG-QGZVFWFLSA-N	444.366	1.785	50	20	IDGD	
Cc1ccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)nc1C	1816235954	STRPPESNDKKZLS-HXUWFJFHSA-N	447.304	1.721	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)CCc2ccoc2)[nH]n1)c1ccc(B(O)O)cc1	1817475889	YTGKUKHNALIFEA-LJQANCHMSA-N	436.277	1.621	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)C1=CCCS1)CC2	1819794094	ZONJFMPBXAXLOX-JTQLQIEISA-N	444.542	1.388	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H]2C[C@H](O)CN2)n[nH]1	1820754060	WBDXLSWQSLNRNY-UZGDPCLZSA-N	428.331	1.298	50	20	IDGD	
CNc1nsnc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](Cl)COC)n[nH]1	1822366899	MXLPZDFJVCNJAL-ONGXEEELSA-N	427.918	1.863	50	20	IDGD	
CC(=O)Nc1cc(C(=O)N2CCC([C@H]3CCCCN3C(=O)[C@H](O)CCl)CC2)ccn1	1824183304	TVIJGUPWXRETBL-QZTJIDSGSA-N	436.940	1.873	50	20	IDGD	
COc1cc(C(=O)N[C@@H]2CCc3nc(NC(=O)[C@@H](C)Br)sc3C2)n(C)n1	1825636123	AQFPNARLHYPHCE-RKDXNWHRSA-N	442.339	1.894	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](C)n1cncn1)CC2	1825648057	XEDPAIAXVHAYLY-AEJSXWLSSA-N	427.328	1.691	50	20	IDGD	
Cc1nocc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1	1826042256	RCLXTHRTNWDOIQ-HXUWFJFHSA-N	425.294	1.210	50	20	IDGD	
C[C@H](Cc1ccco1)C(=O)N[C@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1	1826091771	BTOBWVZCJOGSSQ-KGLIPLIRSA-N	447.561	1.900	50	20	IDGD	
CCc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)nn1C	1830365268	WDMGKWVHAYNNRM-FQEVSTJZSA-N	426.945	1.318	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CCc3ccoc3C1)CCO2	1830940375	KWSHOYXZEQHASY-XGHQBKJUSA-N	440.924	1.095	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)C3CCC(F)(F)CC3)CCO2)C1	1831010025	ZRJAXHVHACLDFM-CRAIPNDOSA-N	438.899	1.522	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)Nc3cnccn3)C2)C1	1831651061	NFRVHCNQUNEOJX-GUXCAODWSA-N	439.944	1.141	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)c2cncc(O)c2)CC1	1831699669	XFJCRYSQCYMUDR-NRFANRHFSA-N	437.305	1.014	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)c2cncc(O)c2)CC1	1831702630	NGEBTCXAITZZBQ-LJQANCHMSA-N	431.537	1.394	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccnc2S)CC1	1831869162	BACLAZMRMUFHIN-SFHVURJKSA-N	447.605	1.977	50	20	IDGD	
Cc1c(F)cccc1C(=O)NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1833169847	HPCPMGDUEOSOHC-IBGZPJMESA-N	425.932	1.919	50	20	IDGD	
Cc1cccc(CCC(=O)N2CCC(N3CCC(NC(=O)[C@@H](O)CCl)CC3)CC2)n1	1833308480	TWQNNGMVPLNDDV-FQEVSTJZSA-N	436.984	1.494	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](C)CBr)C3)C2)on1	1834218246	SMQNLBRXJIACEQ-SJCJKPOMSA-N	430.299	1.084	50	20	IDGD	
CC(C)c1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCBr)C3)C2)no1	1834495880	XOKIMGHBEVIZFN-GOSISDBHSA-N	444.326	1.653	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)C[C@H]3CCCCO3)C2)C1	1834818903	FIYYIEAIHSBELQ-CRAIPNDOSA-N	433.343	1.187	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](C)Nc3cnccn3)CC2)CC1	1835748202	TWFWJYNUPFMRCK-CRAIPNDOSA-N	436.988	1.866	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3ccncn3)CC2)CC1)[C@@H](F)Br	1836412688	QCJPVAYHQFJNSS-OAHLLOKOSA-N	428.306	1.352	50	20	IDGD	
CC(C)n1nccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1	1838024184	WMFPBPMMUUUYGJ-MOPGFXCFSA-N	447.363	1.770	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cc4cn[nH]c4cn3)CC2)CC1	1838356346	AGPLWRDJCUYHEA-KRWDZBQOSA-N	449.939	1.824	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cncc4cnccc34)CCO2)C1	1838465386	VJBLINRLCIAXPW-GHTZIAJQSA-N	432.908	1.717	50	20	IDGD	
Cc1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)c1	1838940741	WVHIYHQQUWRFSX-QAPCUYQASA-N	429.286	1.756	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4ncncc4c3)C2)C1	1839145408	GTTMBGFSVCWXJW-UTKZUKDTSA-N	432.908	1.717	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(O)c(OC)c3)C2)C1	1839146732	UNIUKQXNGNKHAY-FOIQADDNSA-N	426.897	1.488	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3n[nH]c4c(C)cccc34)C2)C1	1839148356	WLWCOZCBISWFEJ-IIBYNOLFSA-N	434.924	1.959	50	20	IDGD	
Cc1ccc(F)cc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839197237	NPBQHRIGMJTJGS-YJBOKZPZSA-N	447.276	1.895	50	20	IDGD	
CCOc1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)c1O	1839426474	XIPNSEUUKQQUFW-LPHOPBHVSA-N	430.860	1.395	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3c(C)noc3C)C2)C1	1839963114	ACYZADQWDYZUKQ-KDOFPFPSSA-N	444.326	1.535	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3CCCOC3)C2)C1	1839967109	ANTWLEIBMZFBOF-RVKKMQEKSA-N	433.343	1.043	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CCCS3)C2)C1	1839967443	MJJGEGWJXOJKCT-VBQJREDUSA-N	435.384	1.512	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CNC(=O)OC(C)(C)C)CCO2)C1	1839986003	FLXUCYKDIQMPLT-FOIQADDNSA-N	447.960	1.375	50	20	IDGD	
CCc1ncsc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](Cl)COC)CCO2	1840154008	HVUHAZJJYCMKCE-UGSOOPFHSA-N	431.942	1.029	50	20	IDGD	
CCn1nc(C(C)C)cc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840188948	MRJMJUPTUUHTTD-LJQANCHMSA-N	447.363	1.900	50	20	IDGD	
O=C(c1n[nH]c2ccc(Br)cc12)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1	1841350557	JYBBFWFKLKVWHH-CYBMUJFWSA-N	441.713	1.742	50	20	IDGD	
CC(C)[C@H](CC(=O)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1)NC(=O)OC(C)(C)C	1841354143	JXLTVFANYPWICB-GJZGRUSLSA-N	431.961	1.729	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)C2CCN(c3ccc(F)cn3)CC2)C1	1845830684	VNNJZIGPPCEYJQ-QGZVFWFLSA-N	438.931	1.894	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)[C@@H](c1ccccc1Cl)N(C)C)C2	1846385900	IXKDPXFXVBHFKB-HXUWFJFHSA-N	449.983	1.519	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)c2ccccc2OC(F)F)C1	1846856381	KVMFSQDIBNGFFN-UHFFFAOYSA-N	430.216	1.099	50	20	IDGD	
CCOC(=O)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)[C@@H](F)Cl)C2	1847043734	NNRRENOYSBXDNX-VXGBXAGGSA-N	435.880	1.181	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H]2COC[C@@]2(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](F)Cl)C1	1847289984	DQVARFHZZWZIMH-SLARRSDRSA-N	445.919	1.606	50	20	IDGD	
C[C@@H](Sc1ccccc1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cnccc1C(=O)NN	1847732831	SFGJEXNWEOWUHV-CCKFTAQKSA-N	439.541	1.681	50	20	IDGD	
C[C@H]1Oc2ccccc2O[C@H]1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	14287690	JCSMCEHKSYGYRT-AUUYWEPGSA-N	445.497	1.461	50	20	IDGD	
Cn1c(N)c(C(=O)/C(C#N)=C/c2c(-c3ccccc3)nc3ccccn23)c(=O)n(C)c1=O	16881693	ROIGLZYPZLQAEO-NTCAYCPXSA-N	426.436	1.771	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)CNC(=O)Cc2cccc(F)c2)c2ccccc2c1=O	107921273	JVRWTORNFHBZQU-UHFFFAOYSA-N	439.447	1.066	50	20	IDGD	
CC(C)c1noc2nc(-c3ccco3)cc(C(=O)NNC(=O)N[C@@H]3CCS(=O)(=O)C3)c12	727732184	NMSHBSQWMBCUBH-LLVKDONJSA-N	447.473	1.737	50	20	IDGD	
CCCOC(=O)c1ccc(S(=O)(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1	727795452	IAMAMAHDXHFHLD-UHFFFAOYSA-N	440.499	1.280	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)NCCCN2CCC[C@H](C(N)=O)C2)c(C)n1C[C@@H]1CCCO1	728078313	YLDSSROZYKJBPW-ZYIOACJDSA-N	441.576	1.895	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NNc2nc(-c3cccnc3)no2)cc1	728079095	KNULNWBEPUWLOJ-INIZCTEOSA-N	428.474	1.736	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNS(=O)(=O)c1cc(F)ccc1Cl	728502346	GUGCXXUJJAGCFN-UHFFFAOYSA-N	434.902	1.704	50	20	IDGD	
CC/C=C(\C)C(=O)N1CSC[C@@H]1C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	728846972	YIPAUIHTLGBFRK-HQYNXSMWSA-N	432.550	1.098	50	20	IDGD	
O=C(CC1CCCCC1)NCCNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1	728961819	QSPCXFUVSSHVAS-UHFFFAOYSA-N	431.541	1.110	50	20	IDGD	
CC[C@H](NC(=O)NNC(=O)Cc1c[nH]c2ccccc12)c1cccc(S(N)(=O)=O)c1	729612667	HFHZMXQFJDRHED-KRWDZBQOSA-N	429.502	1.840	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@H](C(=O)NNC(=O)CCc2ccccc2O)C(C)C)cc1	730034488	VTLPUMRCTRBIQR-FQEVSTJZSA-N	433.530	1.784	50	20	IDGD	
C[C@H]1C[C@@H]1C(=O)Nc1ccc(C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1	732328496	ZTHGMJBJIWCGID-SJCJKPOMSA-N	440.412	1.807	50	20	IDGD	
O=C(NCCCC(=O)N1Cc2ccccc2C1)NNC(=O)c1nn(-c2ccccc2)cc1O	732474243	KHVLYOGMJBOJDV-UHFFFAOYSA-N	448.483	1.845	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)N[C@H]1CCN(c2ccccc2C(N)=O)C1	732595558	RUTCZYNIFYEDCM-ZFWWWQNUSA-N	429.452	1.301	50	20	IDGD	
Cc1cc(NNC(=O)C2CCN(c3ccc4nnnn4n3)CC2)ccc1Br	734254976	SRGXXGZTWFQCHM-UHFFFAOYSA-N	431.298	1.950	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(F)c(Br)c1)c1cc([N+](=O)[O-])ccc1O	743268999	VLEOUNVPXKCUKY-UHFFFAOYSA-N	434.199	1.825	50	20	IDGD	
CNc1cc(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)cc(Cl)n1	744621010	MEWNGZOCYSQVBH-UHFFFAOYSA-N	425.898	1.555	50	20	IDGD	
Cc1cc(N2CC[C@@H](NC(=O)NNC(=O)CCSc3ccc(F)cc3)C2=O)n(C)n1	745904937	FQACDVPQRIRUMF-OAHLLOKOSA-N	434.497	1.486	50	20	IDGD	
O=C(NNC(=O)c1cc(S(=O)(=O)N2CCCC2)ccc1O)c1cccc([N+](=O)[O-])c1	745990954	MKOMTZHGNNQCHC-UHFFFAOYSA-N	434.430	1.160	50	20	IDGD	
CN(CCO)S(=O)(=O)c1ccccc1CNC(=O)NNc1cc(F)c(F)c(F)c1	746764503	APHNYHWSUAGZSN-UHFFFAOYSA-N	432.424	1.543	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1	748627088	GFQSVHKPKTXVIW-ZDUSSCGKSA-N	430.452	1.639	50	20	IDGD	
CS(=O)(=O)N1CCC(CNC(=O)NNC(=O)CC23CC4CC(CC(C4)C2)C3)CC1	748827073	DIBODFVHVFRVKG-UHFFFAOYSA-N	426.583	1.595	50	20	IDGD	
COCCCOc1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1	749865274	GJYLWYWWOQAUKQ-UHFFFAOYSA-N	435.502	1.427	50	20	IDGD	
O=C(COC(=O)[C@H]1CCCN1Cc1ccc(F)cc1)NNC(=O)c1cccc([N+](=O)[O-])c1	750503912	PKBSFNPSHICZPO-GOSISDBHSA-N	444.419	1.703	50	20	IDGD	
COC(=O)[C@H]1CCC[C@@H](C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)C1	751060711	KRSZZCBDTPTHGX-CVEARBPZSA-N	438.550	1.045	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)c1nnn(-c2cccc(F)c2)c1C(F)(F)F	751200283	UWZSLYKMXUUBLJ-UHFFFAOYSA-N	440.313	1.209	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)c1cc([N+](=O)[O-])ccc1Br	751211584	IRHQDXCQOXVKPP-UHFFFAOYSA-N	427.236	1.610	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2cccc(F)c2F)c1	751261237	TZEPEGHWAPZSKV-UHFFFAOYSA-N	447.485	1.619	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)c2sccc2S(=O)(=O)Nc2cnn(C)c2)c1	751296764	NPPZCPVURZHOMW-UHFFFAOYSA-N	448.530	1.423	50	20	IDGD	
CCn1c(NNC(=O)CNS(=O)(=O)c2c(F)cccc2F)nc2ccccc2c1=O	751883576	JRENCNRATVGTPO-UHFFFAOYSA-N	437.428	1.116	50	20	IDGD	
Cc1cc(S(N)(=O)=O)cc(C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)c1C	752144278	ULIXPEPNQSXUEG-UHFFFAOYSA-N	433.458	1.704	50	20	IDGD	
Cc1cc(S(N)(=O)=O)cc(C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)c1C	752626721	VYRVIXXRRNVRHE-UHFFFAOYSA-N	431.449	1.555	50	20	IDGD	
CNS(=O)(=O)c1ccc(CCC(=O)NNC(=O)c2cc(C)nc3ccccc23)cc1	753117457	NEPBFZPZFRHMGM-UHFFFAOYSA-N	426.498	1.845	50	20	IDGD	
C[C@@H]1CCCN(S(=O)(=O)c2cc(C(=O)NNc3cc(Cl)nc(N)n3)n(C)c2)C1	753455709	XXGGWQQGSITGCS-SNVBAGLBSA-N	427.918	1.228	50	20	IDGD	
CCc1cccc(C)c1NC(=S)NNC(=O)c1cc(OC)c(S(N)(=O)=O)s1	754182126	MCTYMTKVKLOILH-UHFFFAOYSA-N	428.561	1.906	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2c[nH]nc2-c2ccccc2F)c1	755041845	SUECGOOCGLCUQE-UHFFFAOYSA-N	431.449	1.541	50	20	IDGD	
CNC(=O)Cc1ccc(NC(=O)NNC(=O)COc2ccc(Br)cc2)cc1	755659056	RCTUDQSFCNPSCL-UHFFFAOYSA-N	435.278	1.969	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)Nc1ccc(CN2CCCC2=O)cc1	755938923	AQZDJOGCDJIHJZ-UHFFFAOYSA-N	427.417	1.949	50	20	IDGD	
C[C@@]1(CNC(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)CCCO1	756079450	UFEZWCKCPCWPOX-QHCPKHFHSA-N	435.484	1.958	50	20	IDGD	
Cn1cnc(S(=O)(=O)NCC(=O)NNC(=O)c2ccc(-c3ccc(F)cc3)s2)c1	756081246	SFQBNWKYUKWVPX-UHFFFAOYSA-N	437.478	1.027	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)Nc1cc(S(=O)(=O)C(F)(F)F)ccc1OC	756298504	ZCBDHDIWDGMGOS-SECBINFHSA-N	443.400	1.193	50	20	IDGD	
CCc1c(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cnn1CC(C)C	757775364	JNJJDAKAKMAUJM-UHFFFAOYSA-N	436.538	1.818	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)c2cccc(N(C)C)c2)cc1S(=O)(=O)NC1CC1	757863597	DSFDZAASDZRNNY-UHFFFAOYSA-N	431.518	1.968	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)NC2COC(C)(C)OC2)c2ccccc2c1=O	758726748	NLXAZXWQVISHOH-UHFFFAOYSA-N	431.493	1.682	50	20	IDGD	
COC(=O)CS(=O)(=O)Cc1ccc(CNC(=O)NNc2ccc(Cl)nc2)cc1	760200152	WFSCTSFYYBBZAU-UHFFFAOYSA-N	426.882	1.649	50	20	IDGD	
COc1cc(C)nc(NNC(=O)[C@@H]2CCCC[C@H]2C(=O)NNc2nc(C)cc(OC)n2)n1	761166956	PAVQUAOPCDJMFL-ZIAGYGMSSA-N	444.496	1.293	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)Nc1ccc(CN2C(=O)CNC2=O)cc1	761223937	VKIUKZVAVCCOKJ-UHFFFAOYSA-N	443.485	1.692	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)c3cnc4c(c3)c(O)nc(=O)n4C3CC3)n[nH]2)cc1	762957602	YLZOZUZYKZIDOI-UHFFFAOYSA-N	445.439	1.605	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)NCc2ccnc(OCCN(C)C)c2)c1C	763097687	IHRZJEXBSKMNOV-QGZVFWFLSA-N	429.521	1.937	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNS(=O)(=O)c1cc(F)c(F)c(C(=O)O)c1	763439373	NBYQBQXTIKKAGJ-UHFFFAOYSA-N	437.421	1.277	50	20	IDGD	
Cc1ccc(C(=O)NC2CC2)cc1NC(=O)C(=O)NNC(=O)c1ccc2ccccc2n1	763451301	YGSZEWBLMKVKMJ-UHFFFAOYSA-N	431.452	1.835	50	20	IDGD	
C[S@@](=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2Br)cc1F	763483192	OZNRGDHQRCFZHD-AREMUKBSSA-N	442.266	1.725	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ccccc2F)ccc1Cl	763555344	CVHLUKFHMYOANX-UHFFFAOYSA-N	442.856	1.129	50	20	IDGD	
CN1CCN(c2ccccc2NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)CC1	763602264	YEYLRDNISWNDBS-UHFFFAOYSA-N	447.499	1.228	50	20	IDGD	
COC(=O)N(C)Cc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(OC)cc2)cc1	763662009	RRSGWKFYXHFPHX-UHFFFAOYSA-N	444.444	1.058	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)COc2cc(C)ccc2C)c(F)cc1F	763668806	QFJQSBXERSWBAB-UHFFFAOYSA-N	435.383	1.533	50	20	IDGD	
Cc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NNC(=O)C12CC3CC(CC(C3)C1)C2	763735216	NGDNUBVGCMUOFB-UHFFFAOYSA-N	426.517	1.999	50	20	IDGD	
C=CCN(CC=C)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cccc(N(C)C)c2)cc1	763759847	DKVSLJCGZDSXIO-UHFFFAOYSA-N	449.511	1.967	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)CCC(=O)N2C	763850976	RJUMAACWYRYOJD-GFCCVEGCSA-N	428.420	1.288	50	20	IDGD	
C[C@@H]1CCC2=S=C(C(=O)NNC(=O)C(=O)Nc3cc(CC(C)(C)C)nn3C)C=C2C1	763938185	BCAYEKNLXVEIGU-GFCCVEGCSA-N	431.562	1.933	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3ccn(Cc4ccncc4)n3)cc2C1	763942475	NBKGBWVQGOCVNC-CYBMUJFWSA-N	438.513	1.912	50	20	IDGD	
CCCCCn1nc(C)cc1NC(=O)C(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	763944741	PAJRXDKZKLUGME-UHFFFAOYSA-N	439.476	1.673	50	20	IDGD	
COCCOc1ccc(F)cc1NC(=O)C(=O)NNC(=O)c1ccc(Cl)cc1OC	764011938	LTVSXUXZEHPDJP-UHFFFAOYSA-N	439.827	1.913	50	20	IDGD	
CC(C)OC(=O)c1c(NC(=O)C(=O)NNC(=O)c2cnccn2)sc2c1CC[C@@H](C)C2	764025523	WUFVAZWCPHDYGB-LLVKDONJSA-N	445.501	1.628	50	20	IDGD	
COc1cccc(-c2cc(NC(=O)C(=O)NNC(=O)c3cccc(OC)c3O)n(C)n2)c1	764131639	IVPSQSALZNZULE-UHFFFAOYSA-N	439.428	1.210	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)CCC2CCCCC2)cc1C(=O)OC	764217993	KXPAEGAFUFFSQD-UHFFFAOYSA-N	433.461	1.706	50	20	IDGD	
Cc1cc(S(C)(=O)=O)ccc1NC(=O)C(=O)NNC(=O)c1cccc(OC(F)F)c1	764260135	PVELCYIFDQEKDE-UHFFFAOYSA-N	441.412	1.400	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)C(=O)Nc1cccc(Cl)c1Cl	764260979	VLBLGRFPLXXXNN-UHFFFAOYSA-N	437.287	1.786	50	20	IDGD	
CCOC(=O)c1cc2cc(NC(=O)C(=O)NNC(=O)Cc3ccccn3)ccc2s1	764270018	BGEKOMQYYFPULT-UHFFFAOYSA-N	426.454	1.802	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)ccc1O)C(=O)Nc1ccc(-n2cccn2)nc1	764276255	BDABEOWKPAWVPF-UHFFFAOYSA-N	445.233	1.135	50	20	IDGD	
C[C@H](C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1)c1c(F)cccc1F	764283307	UKPCXBYUCLTVPU-ZDUSSCGKSA-N	439.488	1.543	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)OCO3)cc1Br	764326266	FGALJUKPRDAJNH-UHFFFAOYSA-N	436.218	1.586	50	20	IDGD	
Cc1ccc(Cn2nccc2NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)o1	764343486	RJVCUCUOBWUHFE-UHFFFAOYSA-N	433.428	1.418	50	20	IDGD	
Cc1nn(-c2ccccc2)c2ncc(C(=O)NNC(=O)CNC(=O)c3cccnc3)cc12	764344619	FVHAYASTJMTUAQ-UHFFFAOYSA-N	429.440	1.315	50	20	IDGD	
CC(=NNC(=O)CN1CCN(Cc2ccc(C)cc2)CC1)c1cccc(S(N)(=O)=O)c1	764831966	XQXZATJHSFUCSV-UHFFFAOYSA-N	443.573	1.300	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3cnc4cc(C)nn4c3C)n[nH]2)cc1OC	765598278	JUYXFXCOFWNYBO-UHFFFAOYSA-N	435.444	1.828	50	20	IDGD	
COC(=O)c1cccc(C(=O)NNC(=O)c2cc(-c3ccc(OC)c(OC)c3)[nH]n2)n1	765602374	XWIYPHGHVQYZDN-UHFFFAOYSA-N	425.401	1.350	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)CCn1c(=O)oc2cc(Cl)ccc21	767274986	XRHBZMYNBUFIJX-UHFFFAOYSA-N	445.859	1.880	50	20	IDGD	
CN(C)CCS(=O)(=O)c1ccccc1C(=O)NNc1ccccc1S(C)(=O)=O	767730243	AMHDBQLUQJOGSR-UHFFFAOYSA-N	425.532	1.182	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)CN2C(=O)N[C@]3(CCCC(C)(C)C3)C2=O)cc1	768561721	DVQXSSWEEUUWHO-QFIPXVFZSA-N	430.505	1.666	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)N[C@@H]2CCOC3(CCOCC3)C2)nc1	769203599	DBJDXLIXBNNENL-CQSZACIVSA-N	427.527	1.123	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1ccc(O)c(C(=O)NNc2ncc(F)cn2)c1	770134365	NFVDXBXUAAJMLA-UHFFFAOYSA-N	433.421	1.888	50	20	IDGD	
CNS(=O)(=O)c1ccc(C(=O)NNC(=S)Nc2cccc(Br)c2)cn1	770221963	YWQGLXFPAUUJKS-UHFFFAOYSA-N	444.336	1.384	50	20	IDGD	
CCc1nc(-c2ccc(C(=O)NNC(=O)c3nn(CC)c(=O)c4ccccc34)cc2)n[nH]1	770750716	WRPYDMYCKMQSRS-UHFFFAOYSA-N	431.456	1.839	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)[C@H]3CCCN3C(=O)c3ccccc3OC(F)F)nc21	770979456	FCVJKPOKQCTDTG-GFCCVEGCSA-N	447.402	1.418	50	20	IDGD	
CCS(=O)(=O)N1CCC(C(=O)NNC(=S)Nc2cccc(Br)c2)CC1	770997424	WSQRAUNKISTOSP-UHFFFAOYSA-N	449.396	1.828	50	20	IDGD	
CC(C)n1nc(C(=O)NNS(=O)(=O)c2ccc3c(c2)CCCO3)c2ccccc2c1=O	771591163	QSDPHPCFFHILMM-UHFFFAOYSA-N	442.497	1.926	50	20	IDGD	
COc1cc(F)c(S(=O)(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)c(F)c1	771605936	FSSHTZJSMWUWPS-UHFFFAOYSA-N	433.820	1.253	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1ccc(=O)n(CCOc2ccccc2Cl)c1	772217116	YLEFHVQZJSKYBY-ZDUSSCGKSA-N	435.864	1.683	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2cc(N(C)C)nc3ccccc23)n1	772307359	YCBKSCIAVBJVFO-UHFFFAOYSA-N	427.486	1.613	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)C[C@@H]2CSCCN2C(=O)OC(C)(C)C)c1	772390582	YUOZBDOKCUNSEU-OAHLLOKOSA-N	438.550	1.997	50	20	IDGD	
O=C(COC(=O)c1ccn(Cc2ccccc2)n1)NNC(=O)[C@@H]1COc2ccccc2O1	772470931	NEQHYKGFIPSYNO-IBGZPJMESA-N	436.424	1.076	50	20	IDGD	
Cc1ccc2c(c1)C(=O)N([C@H](C)C(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1)C2=O	772899216	ZMUYRBLVEZLBAA-GFCCVEGCSA-N	442.859	1.097	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)ccc1OC	773253087	XJYCHFMJVMPBAK-LLVKDONJSA-N	442.877	1.912	50	20	IDGD	
CCCCN(C)S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2nc(C)cc(C)n2)cc1	773479062	QBTDBQZFIMLILZ-UHFFFAOYSA-N	434.522	1.596	50	20	IDGD	
CCOC(=O)[C@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNc2c(F)cccc2F)cc1	773708422	BAXSBSKMUWGCGK-NSHDSACASA-N	434.399	1.728	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2nccnc2C(C)C)cc1	773991828	DCEAIXQNDHIUQG-UHFFFAOYSA-N	434.522	1.712	50	20	IDGD	
CC[C@H](NCC(=O)NNC(=O)c1cccc(C)c1)c1ccccc1OCC(=O)N(C)C	775067944	TUXFDFXSUUJJRN-IBGZPJMESA-N	426.517	1.964	50	20	IDGD	
CCn1cnc2c1c(=O)n(CC(=O)NN=Cc1ccc(F)nc1)c(=O)n2Cc1ccccc1	777423418	SKYVKZWPAOEKQT-UHFFFAOYSA-N	449.446	1.112	50	20	IDGD	
CCc1ccc(C(=O)NNc2ccccc2C(=O)OC)cc1S(=O)(=O)N1CCOCC1	777772750	LMEOYWIGCFEFAF-UHFFFAOYSA-N	447.513	1.813	50	20	IDGD	
O=C(c1cccc(OC[C@H]2CCCO2)c1)N1CCN(S(=O)(=O)CBr)CC1	777778122	XNHQKUBLIRJHDX-MRXNPFEDSA-N	447.351	1.684	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)NNC(=O)CNC(=O)OC(C)(C)C)c(C)n1C[C@H]1CCCO1	778444864	ALXZBXBIUCARGA-DAIOKFOQSA-N	445.520	1.863	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)NCC(F)(F)CNC(=O)OC(C)(C)C)cc1C	779667948	BPTFZRQPACECOZ-UHFFFAOYSA-N	443.451	1.732	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)Cc1cccc(I)c1	780974090	OHLUBMJNYKCBLM-UHFFFAOYSA-N	447.273	1.896	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(OC3COC3)cc2)cc1	782121445	YYLIIHVVTZSPFZ-AWEZNQCLSA-N	441.440	1.220	50	20	IDGD	
Cc1cc(Cl)ccc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)NC(C)C)cn1	783264865	SJRMKEQIBJXEBF-UHFFFAOYSA-N	425.898	1.812	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2cccc(C(=O)N3CCSCC3)c2C)nc(C)n1	783326916	PQFFHPXPZQTJPM-UHFFFAOYSA-N	428.518	1.673	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)c1cccc2nn[nH]c12	783675826	FNYATZZASUOIGS-UHFFFAOYSA-N	427.896	1.190	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)C(=O)Nc1ccccc1N1CCCC1	784210067	ASDPYUCQZPJQFR-UHFFFAOYSA-N	443.529	1.809	50	20	IDGD	
O=C(COC(=O)c1ccc(C(F)(F)F)c(F)c1)NNC(=O)[C@H]1COc2ccccc2O1	784252330	NPZGANJWSNYLFI-OAHLLOKOSA-N	442.321	1.989	50	20	IDGD	
Cc1c(NNC(=O)C(=O)Nc2cnn(CC(=O)NC3CCCC3)c2)cccc1[N+](=O)[O-]	784352295	LQXBDZUCVOHSEP-UHFFFAOYSA-N	429.437	1.240	50	20	IDGD	
COc1ncnc(N(C)C)c1NC(=O)C(=O)NNc1nc(-c2ccc(Cl)cc2)no1	784795045	KHXNAFACDXXEEF-UHFFFAOYSA-N	432.828	1.336	50	20	IDGD	
CCOC(=O)[C@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNc2cccnc2Cl)cc1	784848200	GZHXBNWULWAKPM-NSHDSACASA-N	433.852	1.498	50	20	IDGD	
O=C(NNc1ncc(F)cn1)C(=O)Nc1cc(-c2nnc3n2CCCCC3)ccc1F	784949160	GDGCXLGYTBAPHQ-UHFFFAOYSA-N	428.403	1.822	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2ccccc2CN2C(=O)CCC2=O)n1	785227413	QUDWEKCFWIFUMT-UHFFFAOYSA-N	439.476	1.054	50	20	IDGD	
CCS(=O)(=O)CCn1cc(C)c(NC(=O)NNC(=O)COc2cc(C)cc(C)c2)n1	786718544	SNRKLSAPVGPTRY-UHFFFAOYSA-N	437.522	1.475	50	20	IDGD	
COC(=O)COc1ccc(C=NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1[N+](=O)[O-]	788712663	YAGBNGIOXUCLOA-UHFFFAOYSA-N	435.414	1.314	50	20	IDGD	
COC(=O)c1cc(Cl)cc(S(=O)(=O)NNC(=O)c2cccc(OC)c2O)c1OC	790054865	RMOKMEZAAJBIBG-UHFFFAOYSA-N	444.849	1.473	50	20	IDGD	
COCCN(C)c1ccc(C=NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cn1	790150255	KHYUNBTVMNYBFA-UHFFFAOYSA-N	425.898	1.229	50	20	IDGD	
Cc1c(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cnn1-c1ccccc1	792736944	YYDHWKBXLQHLCZ-IBGZPJMESA-N	436.424	1.325	50	20	IDGD	
O=C(Cc1ccc2c[nH]nc2c1)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	793681687	JKDDRTSAEXKVRW-UHFFFAOYSA-N	440.935	1.724	50	20	IDGD	
C[C@@](O)(CN1C(=O)NC2(CCCC2)C1=O)C(=O)NNc1cccc(Br)c1	793704528	INALEOMMFUTENO-MRXNPFEDSA-N	425.283	1.508	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)c1ccc(C)cc1)C(=O)NNC(=O)c1cccc(C)n1	794080382	LWAKJAJDAKTBBP-KRWDZBQOSA-N	436.559	1.560	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)c2nnn(Cc3cc(C)no3)c2C)cc1	794201061	RDNFWZRPXQHDGH-AWEZNQCLSA-N	428.449	1.558	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1)n1cnc(C#N)n1	798830501	SHFWYQGYSBTZBH-AWEZNQCLSA-N	427.428	1.420	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1ccc(Cl)c(CN(C)C)c1	799258017	YEGVMUVGNJEZSO-UHFFFAOYSA-N	428.880	1.757	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)c1nnn(CCOc2ccc(F)cc2)c1C	800687585	BEZQIAATHVTNBI-UHFFFAOYSA-N	442.451	1.686	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](Cc2ccccc2)NC(=O)c2cccnc2)cc1	801109306	JMZOSROGDQSJNI-HXUWFJFHSA-N	445.479	1.517	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)N(CCO)CCN2CCOCC2)c(C)n1C[C@@H]1CCCO1	801174653	YMUDMEIGJWYXHL-VAZXNAHHSA-N	430.549	1.344	50	20	IDGD	
CN(C)CCOc1ccc(/C=C/C(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)cc1	802066949	FMKATLGIBOGLSM-AWNIVKPZSA-N	446.529	1.897	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1cc(C(=O)NNc2ccc(-n3ccnc3)nn2)ccc1F	804957746	UDMSYIUEAWGLFK-UHFFFAOYSA-N	433.469	1.635	50	20	IDGD	
CC[C@H]1CN(C(=O)NNC(=O)c2ccc(OC)c(Br)c2)C[C@@H](C)S1(=O)=O	805103833	FGRZSHRKWVZPNM-PWSUYJOCSA-N	448.339	1.710	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@@H]2CCN(c3ccccc3F)C2)cc1	809983643	MJYWGDKEDUUVNG-MRXNPFEDSA-N	448.520	1.429	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)Nc1ccc(C(N)=O)cc1OCC(F)F	810307126	VEZARDOFJFQQRX-UHFFFAOYSA-N	438.387	1.670	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNS(=O)(=O)c1ccc(Oc2ccc(Cl)cc2)cc1	811683458	UJVNHVLYEINEPC-NSHDSACASA-N	447.922	1.380	50	20	IDGD	
Cc1cc(CNC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc(N2CCCC2)n1	812539714	ITEFEAKSACRQFB-UHFFFAOYSA-N	435.488	1.381	50	20	IDGD	
Cc1ccc(S(C)(=O)=O)cc1NC(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	812916498	WGUJEDRSVPUXOL-UHFFFAOYSA-N	426.520	1.797	50	20	IDGD	
COC(=O)c1cc(C(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)c[nH]1	814266315	CTWCLEJZTBNUOI-UHFFFAOYSA-N	445.439	1.578	50	20	IDGD	
COC(=O)CCc1nnc(NC(=O)NNc2ccccc2S(=O)(=O)N(C)C)s1	814641133	DSXZHZHVPZPANH-UHFFFAOYSA-N	428.496	1.043	50	20	IDGD	
CNC(=O)c1cc(Oc2cccc(NC(=O)C(=O)NNc3nccnc3Cl)c2)ccn1	815598904	FZCPQDKTUDWMTA-UHFFFAOYSA-N	441.835	1.759	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCO1)C(=O)Nc1cnn(-c2ccc(F)cc2)c1C(F)(F)F	815778151	FAWDBVQIPOPFHE-GFCCVEGCSA-N	429.330	1.295	50	20	IDGD	
CCOc1cc(Br)c(NC(=O)C(=O)NNC(=O)[C@H]2CCCO2)cc1OCC	815780114	JRLNHNNTDICYFF-GFCCVEGCSA-N	444.282	1.511	50	20	IDGD	
Cn1ncc(C(=O)NNc2nnc(-c3ccccn3)s2)c1I	816418960	CHWGMFOZLLVWAZ-UHFFFAOYSA-N	427.231	1.695	50	20	IDGD	
O=C(CN1CCCCCC1=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	818032248	XUWBRPHDOKOVPS-UHFFFAOYSA-N	447.499	1.552	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)[C@H]2CC(=O)N(CCN(C)C)C2)c1	818745481	IWZIHADAWBKWGP-LBPRGKRZSA-N	427.299	1.089	50	20	IDGD	
Cc1ccc([C@]2(C)NC(=O)N(CC(=O)NNC(=S)NCCc3cccs3)C2=O)cc1	838851454	ZCXHGALZOHXJGB-FQEVSTJZSA-N	445.570	1.562	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)c(C)c1	879385708	OTJSFWKZTZPTSK-UHFFFAOYSA-N	435.502	1.159	50	20	IDGD	
O=C(CCSc1ccc(F)cc1)NNC(=O)C1CCN(c2ccc3nnnn3n2)CC1	897004697	HOPOFJJUDRQDPX-UHFFFAOYSA-N	444.496	1.205	50	20	IDGD	
CN(C)N(C(=O)C1CCN(c2oc(-c3ccco3)nc2C#N)CC1)[C@@H]1CCS(=O)(=O)C1	915141418	QDIHAZQEVDKVQH-OAHLLOKOSA-N	447.517	1.515	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)NC1CCN(C2CC2)CC1	916239910	QZUIGQJVYUOVRV-UHFFFAOYSA-N	435.550	1.042	50	20	IDGD	
COc1cc(OC)c(C=NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)c(OC)c1	916277003	WLEWIFNSGBTVPR-UHFFFAOYSA-N	435.502	1.792	50	20	IDGD	
CC(=NNC(=O)[C@@H](C)CN1CCOCC1)c1ccc(S(=O)(=O)N2CCCCC2)cc1	916364531	OVWFELDIKWSFQW-KRWDZBQOSA-N	436.578	1.670	50	20	IDGD	
O=C(O)COc1ccccc1C=NNC(=O)CN1c2cccc3cccc(c23)S1(=O)=O	916368433	PDEYQYWCVZSUIE-UHFFFAOYSA-N	439.449	1.962	50	20	IDGD	
COCC(=O)Nc1cccc(CNC(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)c1	916382900	BSAHAXATWIQZGY-UHFFFAOYSA-N	427.461	1.357	50	20	IDGD	
C[C@@H]1C[C@@H](C)CN(CCCCNC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)C1	916506050	UVPMIAWERXTVTH-HZPDHXFCSA-N	428.537	1.636	50	20	IDGD	
O=C(NCCN1CCN(c2ccccc2)CC1)NNC(=O)c1cc(Br)c[nH]1	916514325	AURHVLXAUUJDDB-UHFFFAOYSA-N	435.326	1.543	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCN(c3nc4ccccc4s3)CC2)n1	917101501	BZBKGWKACHFOTE-UHFFFAOYSA-N	430.559	1.573	50	20	IDGD	
Cc1ccc(C(=O)N2CCN(CC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)CC2)cc1	917108677	PDTXVBQEMMFEPR-UHFFFAOYSA-N	425.445	1.122	50	20	IDGD	
O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)NNC(=O)c1cccc([N+](=O)[O-])c1	918219865	PKEWVPRSQKPTTH-UHFFFAOYSA-N	431.424	1.839	50	20	IDGD	
CN(CCO)S(=O)(=O)c1ccc(C(=O)NNC(=O)Nc2cc(F)cc(F)c2)cc1	1117154450	LWMWGCRVJLZOIG-UHFFFAOYSA-N	428.417	1.044	50	20	IDGD	
CCOC(=O)N1CC[C@@H](NC(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)C1	1320473901	LOVQKDJGOOXBCV-CQSZACIVSA-N	427.502	1.195	50	20	IDGD	
C[C@@H]1CN(CCCNC(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)CCCO1	1320785710	LNKUOMIDKDMSNN-MRXNPFEDSA-N	441.573	1.465	50	20	IDGD	
CCCn1nc(C(=O)NNS(=O)(=O)c2ccc(CC#N)cc2)c2ccccc2c1=O	1322285855	ITBPDXYUYLJUSH-UHFFFAOYSA-N	425.470	1.496	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)Cc2ccc(S(=O)(=O)NC)cc2)cc1OC	1325392864	XWENXYSEHFCLPX-UHFFFAOYSA-N	435.502	1.396	50	20	IDGD	
C[C@@H]1CCCN(C(=O)CCNC(=O)NNC(=O)COc2ccc(Br)cc2)C1	1346003870	XTBAWSBJKAWVCR-CYBMUJFWSA-N	441.326	1.807	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2)c1cc2sccn2c1	1777824360	CEJLWTTUKBRQLZ-QMTMVMCOSA-N	425.938	1.728	50	20	IDGD	
C[C@H](C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Br)C2)N1C[C@H]2C[C@H]2C1	1779252740	GWDGZBONZBFREA-WLQXYJQWSA-N	446.361	1.531	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cc(-c3ccccn3)[nH]n1)CCO2	1779298276	IOPSSVNCPZUIFR-OAQYLSRUSA-N	443.580	1.767	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnc(OCF)cn1)C2	1780703368	OPNLWWBVBFFZNW-ZBQZNYHESA-N	428.892	1.927	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CO[Si](C)(C)C)C2	1781515297	RUADKPYVAJSBSR-JXXFODFXSA-N	444.601	1.913	50	20	IDGD	
O=C(c1n[nH]c2c(Cl)cccc12)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1782215594	OPVJEDBFENMYRV-ACJLOTCBSA-N	427.288	1.260	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](O)CCl)C3)c1	1782993365	OOKJPQFUFYWEOZ-WAOWUJCRSA-N	437.924	1.372	50	20	IDGD	
CO[C@H](C)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](Br)Cc3ccccc3)C2)C1	1783021736	GMTZVGBWWDAEDQ-OXFYSEKESA-N	439.350	1.857	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(OC)cn3)CCO2)C1	1783347981	QZANVRKUCDKQJH-KSSFIOAISA-N	426.311	1.707	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3occc3Br)CCO2)C1	1783874343	CZSQORXZXWVDOX-WBMJQRKESA-N	435.702	1.739	50	20	IDGD	
CC(=O)N[C@H](C(=O)N1CCO[C@]2(CCN(C(=O)C(Cl)Cl)C2)C1)c1ccc(F)cc1	1783948164	CVMBCOVWGJCGOL-KXBFYZLASA-N	446.306	1.637	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCBr)[C@H]2C1	1786404841	WKAWQGDVIIIZJW-CYDGBPFRSA-N	440.176	1.782	50	20	IDGD	
Cc1nc2cc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)[C@H](O)CCl)C[C@@H]43)ccc2s1	1788006172	MYKZWIBLLYUMQY-DIECFANBSA-N	437.949	1.798	50	20	IDGD	
O=C(CCBr)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1	1788145998	PYMISCLXYOLPRA-UHFFFAOYSA-N	445.122	1.899	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)c1cnc2[nH]ncc2c1	1788272670	IPTFJWIQBRUGSF-CQDKDKBSSA-N	436.310	1.336	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnn4cccnc34)[C@H]2C1	1788293385	LKBRYHBTNXJKGJ-VFSPDHHESA-N	440.331	1.559	50	20	IDGD	
CC(=O)N[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]2C1)C(C)(C)C	1788762136	MPIUYWVGFJDZOT-DWRORGKVSA-N	441.645	1.368	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21)c1cc(-c2cccnc2)[nH]n1	1788936215	PHIAAZSRUGEFOL-XEZPLFJOSA-N	438.315	1.869	50	20	IDGD	
O=C1CN(CC(=O)NC2(c3ccc(NC(=O)[C@H](F)Br)cc3)CCC2)C(=O)N1	1790532805	VDXWZEOFFPGZFO-AWEZNQCLSA-N	441.257	1.363	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]3C2)c(O)c1	1791059177	QHNQNKLZFRCOJA-LMMLAZSQSA-N	441.322	1.778	50	20	IDGD	
CCN(CC)C[C@@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)Br)[C@H]2C1	1791063105	ACOHJPVBPSBKLP-XAJHFOFHSA-N	432.403	1.727	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1cncnc1)C2	1792867614	HYUJQXNPUAOLIM-FAYQHZLMSA-N	425.327	1.030	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1CCN(C(=O)OCC)CC1)C2	1793455665	QJOWLGYLMTVUBN-MHORFTMASA-N	443.972	1.852	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1nc(Cl)ccc1F)c1ccc(B(O)O)cc1	1794524125	KUZKJSWEWRZDBS-QDMKHBRRSA-N	431.660	1.120	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)c1ccnc2c(O)cccc12	1796193210	VJAMIKLRCUCYFS-BCDXTJNWSA-N	445.284	1.186	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)nc2ccccc12	1796915814	CQYKAVKQDBPUQF-ZIVKBKJYSA-N	448.317	1.927	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2)c1cn2ccc(Cl)cc2n1	1797108486	XGKNROUKWQJCBV-WDAIWFPHSA-N	431.707	1.995	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)NC(=O)c1ccc(F)cc1)C2	1799268926	OFKTVCNTKIYNLT-CNGORYIKSA-N	439.915	1.551	50	20	IDGD	
N#Cc1cccc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Br)c1	1799343425	WWALPRSDHFTNHE-MVJTYMMSSA-N	438.297	1.771	50	20	IDGD	
COc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Br)cc1OC	1799349312	WINHFDJAYVDRKB-VZAMPYOESA-N	445.285	1.598	50	20	IDGD	
CCOc1cccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Br)c1	1799349388	YWDFNHBUKMWCQT-XRGAULLZSA-N	429.286	1.979	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnc2ccc(F)cn12	1800064535	FAWBDLVUSMOJEU-OVZMXSCWSA-N	439.285	1.460	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cn[nH]c1)C2)[C@@H](Br)Cc1ccccc1	1800435707	NGKIJCNYDBSVDQ-MHORFTMASA-N	447.333	1.619	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(OC)cn1)C2	1800641329	YSMVSXGNUYYIJP-LMWOUKEDSA-N	426.311	1.467	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)COc1ccc(C(=O)OC)cc1	1802229973	IJGIANCZKUNOBF-HIRMHNASSA-N	438.908	1.459	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](NC(=O)OC)c1ccccc1)C2	1802271865	XNGMKGOEZJUXSI-CWQOZTLDSA-N	437.924	1.976	50	20	IDGD	
C[C@@H]1CCc2c(C(=O)N3CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]3c3cccnc3)n[nH]c21	1803138429	ARHLHPGZNDSCPL-KJPHAFAOSA-N	431.924	1.774	50	20	IDGD	
COC(=O)CCCCCC(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]1c1cccnc1	1803145672	GPKRGWUVJPUDET-MBOZVWFJSA-N	439.940	1.811	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2cc(C(=O)O)ncn2)[C@@H]1c1cccnc1	1804972709	GDCNTROTAVEPSD-KEYYUXOJSA-N	447.879	1.143	50	20	IDGD	
O=C(CCBr)NC[C@@H]1CCN(C(=O)c2c[nH]c(=O)cn2)[C@@H]1c1cccnc1	1806344221	YIEDRQNUPCAMML-SUMWQHHRSA-N	434.294	1.270	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@@H](CNC(=O)[C@@H]2CCC(=O)N2)[C@@H]1c1cccnc1	1806631028	BBKZPLLVOUYEJH-DYWXZXKOSA-N	437.338	1.397	50	20	IDGD	
C[C@H](C(=O)NC[C@H]1CCN(C(=O)C(Cl)Cl)[C@@H]1c1cccnc1)N1CCN(C)CC1	1807877470	IWXWYFXLCULJOC-DJIMGWMZSA-N	442.391	1.527	50	20	IDGD	
CN1CCN(CCC(=O)N2CC[C@H](CNC(=O)[C@@H](F)Cl)[C@@H]2c2cccnc2)CC1	1808308126	ASNMKXOVDTULNK-NZSAHSFTSA-N	425.936	1.259	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cc(=O)nc3cccnn23)[C@H]1c1cccnc1)[C@H](F)Cl	1808315098	KDABPDKIQSORJJ-KKXDTOCCSA-N	444.854	1.339	50	20	IDGD	
Cc1cc(NC(=O)CC(=O)NC[C@@H]2CCN(C(=O)[C@@H](F)Cl)[C@H]2c2cccnc2)no1	1808394893	RVCIJXVAOZZEKS-DOPJRALCSA-N	437.859	1.947	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)c2ccc[nH]2)[C@@H]1c1cccnc1	1808417934	UABQGGNHVAPAQV-TYXIVBLQSA-N	447.499	1.863	50	20	IDGD	
C=C(CC(=O)OCC)C(=O)NC[C@@H]1CCN(C(=O)[C@H](Cl)COC)[C@@H]1c1cccnc1	1808463158	CFPKOYNGXRXHMM-YQVWRLOYSA-N	437.924	1.851	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)c3ccc(Cl)o3)CC2)C1	1809977760	GBUFIFNGLVGRKC-UHFFFAOYSA-N	430.697	1.771	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@@H]1c1cccnc1)c1cc[n+]([O-])cc1	1811197210	BHHXKKKMTNVCEA-ARFHVFGLSA-N	437.269	1.725	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2ccc(OC)nn2)[C@@H]1c1cccnc1	1811210628	YOIHXKGPWULOPC-MPGHIAIKSA-N	433.896	1.454	50	20	IDGD	
Cn1nc2c(c1C(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)CCC2	1812223305	SZXFYNSBTLBSOZ-JCGIZDLHSA-N	431.924	1.223	50	20	IDGD	
Cc1ncc(C(=O)N2CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)s1	1813070223	HFWBZESMRJWAKS-UZLBHIALSA-N	444.561	1.539	50	20	IDGD	
CC(C)O[C@H](C)C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1813073387	LVBJROMYUATWLR-HGHGUNKESA-N	433.553	1.274	50	20	IDGD	
Cc1cnc2c(C(=O)N3CCCC[C@@H]3c3cc(NC(=O)[C@H](O)CCl)n[nH]3)cnn2c1	1814873163	NSCUKEHRJVMINE-HUUCEWRRSA-N	431.884	1.666	50	20	IDGD	
Cc1cccc(CC(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)n1	1814969406	RMWQWUXHERYRHO-FQEVSTJZSA-N	447.304	1.342	50	20	IDGD	
Cc1ccc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)cc1C	1815343628	FOCSYYWVWHTCAX-GOSISDBHSA-N	449.341	1.979	50	20	IDGD	
O=C(/C=C/C1CCCC1)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1	1815343751	NATKVMQBXPFHLE-UPKKBRNCSA-N	439.346	1.795	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@H]1CC=CCC1)CC2)c1cccc(B(O)O)c1	1815359738	BTKQZBCXEOGEJM-BBRMVZONSA-N	425.319	1.405	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](F)Br)CC2)c1cc(O)nc(O)n1	1817103277	DWVAOEIFMVDWDS-XUOSJQGZSA-N	446.258	1.261	50	20	IDGD	
CN[C@H](CC(=O)N1CCCC[C@H]1c1cc(NC(=O)CO[Si](C)(C)C)n[nH]1)C(=O)O	1819593461	ILHOGKAGXUFJJE-KGLIPLIRSA-N	425.562	1.316	50	20	IDGD	
C[C@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)c3ccnnc3O)sc2C1	1821101657	AGRDNAUFZBYVOZ-YUMQZZPRSA-N	426.296	1.648	50	20	IDGD	
CC(C)(C)n1cc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@H](O)CCl)CC3)nn1	1821631019	VXDRUVHUOKFFOS-JOYOIKCWSA-N	426.930	1.315	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)c3cccc(F)c3)sc2C1	1822048575	YZXKGOCIQUJSIQ-AWEZNQCLSA-N	433.509	1.881	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)Cc2ccccn2)[nH]n1	1822413886	DSQDPOFISOLIJS-KRWDZBQOSA-N	427.509	1.413	50	20	IDGD	
CCc1cc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)n[nH]1	1822414370	TYAWXXUFUYDZKX-MRXNPFEDSA-N	430.513	1.374	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)[C@H]1C[C@]1(F)Cl	1822501252	KDSQZMIZRIXNME-FRIZHTMISA-N	434.664	1.320	50	20	IDGD	
O=C(COc1cccnn1)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](F)Br)[nH]n1	1822754993	XYMJRZSKZJGTHB-XHDPSFHLSA-N	441.261	1.961	50	20	IDGD	
CC[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnnn1C)CC2	1825440797	FJDDAJHFLKUYQF-DTWKUNHWSA-N	427.328	1.671	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cocn2)CC1	1826162042	DUOGCMSMPHZKNQ-SFHVURJKSA-N	426.477	1.220	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CS(C)(=O)=O)CC1	1826629320	VPALXLHVUYDIPQ-YOEHRIQHSA-N	427.394	1.887	50	20	IDGD	
C[C@@]1(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2cccc(B(O)O)c2)CC3)CC1(F)F	1828048093	VDCRWJSHKKCWDI-XIKOKIGWSA-N	435.261	1.094	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(O)nc(O)n2)CC1	1829102063	LAUPSBRHBIUPKA-MRXNPFEDSA-N	436.585	1.973	50	20	IDGD	
O=C(CCn1ccnn1)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](F)Br)CC1	1830381312	ISNWTKBYONASKH-GOEBONIOSA-N	430.322	1.978	50	20	IDGD	
COc1ccccc1CCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1830991708	DNGWXAXXOMSLOL-UYAOXDASSA-N	428.888	1.619	50	20	IDGD	
COc1ccc([C@@H]2C[C@@H]2C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)cc1	1831302638	VRYWLCLUORKJCO-UGNRZPKXSA-N	440.899	1.790	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CNC(=O)c2ccco2)CC1	1831830875	XZCOPDYHAZNJCK-IRXDYDNUSA-N	439.940	1.883	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H](C)N2CCN(C)CC2)CC1	1831833385	NMMXEEFPKZKOLK-HOJAQTOUSA-N	443.032	1.496	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)C[C@](C)(O)CC(=O)O)CC1	1831835153	OZOKUTHGYZBTFN-FTRWYGJKSA-N	432.945	1.476	50	20	IDGD	
C[C@H]1CCc2c(C(=O)N3CCC(N4CCC(NC(=O)[C@@H](O)CCl)CC4)CC3)n[nH]c21	1833310293	PDDFLIWDGVPOMU-GUYCJALGSA-N	437.972	1.244	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)Cc3nnc(C)o3)CC2)CC1	1834831908	RTCVYBZTRXPPDW-QGZVFWFLSA-N	425.961	1.900	50	20	IDGD	
O=C([C@H]1CCc2nc[nH]c2C1)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836720358	RDNLHOGXSLHNBV-LIRRHRJNSA-N	438.956	1.113	50	20	IDGD	
O=C(c1ccc(O)nn1)N1CCC(OC2CCN(C(=O)[C@H](F)Br)CC2)CC1	1837368682	GTOMYFGCQUFOLI-HNNXBMFYSA-N	445.289	1.485	50	20	IDGD	
Cc1cc(/C=C/C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)no1	1837558598	RISKQGXWLXQFHY-UIOCAAJDSA-N	442.310	1.236	50	20	IDGD	
CCc1noc(C)c1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)Br)C2)C1	1838060317	IKSPRABFGVQDKG-KZULUSFZSA-N	444.326	1.399	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](C)Br)CC2)CC1	1838428628	QWXBILCPBCCJLM-ZIAGYGMSSA-N	444.370	1.459	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCC(OC2CCN(C(=O)[C@H]3CNC(=O)C3)CC2)CC1	1838639035	SOQHUWXQUAHEQI-BFUOFWGJSA-N	434.364	1.357	50	20	IDGD	
O=C(c1cccc2ccnn12)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1839500600	MHUXZPGLNYVHOV-SFHVURJKSA-N	427.288	1.208	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCCc3ccncc3)C2)C1	1840150802	QPYZFPDKWVERMS-WIYYLYMNSA-N	439.940	1.115	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(F)(F)Cl)CCO2	1840286614	GFTVLGCQOAMHPK-ZWNOBZJWSA-N	433.677	1.448	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC12CN(C(=O)CN(C)C(=O)c1ccccc1)C2	1841285489	ATAFWXPHBBDEQN-OAHLLOKOSA-N	436.350	1.993	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@](C)(C(=O)N2CC3(CCCN3C(=O)[C@H](O)CCl)C2)C1	1841351298	KRQZGXJKBWWBFE-KUHUBIRLSA-N	429.945	1.437	50	20	IDGD	
CC(C)(C)OC(=O)NCCOCC(=O)N1CC2(CCCN2C(=O)CCBr)C1	1842639032	XUHOXIILXMBRBF-UHFFFAOYSA-N	448.358	1.516	50	20	IDGD	
O=C([C@H]1CCc2cccc(Cl)c21)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843012254	UASBJWNKVPPNFS-SFHVURJKSA-N	438.720	1.567	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)c2ncsc2Br)C1	1843451038	JTQWEUPOTXOTAB-UHFFFAOYSA-N	444.355	1.096	50	20	IDGD	
CC(=O)C[C@@H](C)C(=O)N1CCCC12CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2	1846328321	CCDAYOATJKEVMP-QGZVFWFLSA-N	443.548	1.151	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)c1ccccc1OC(F)(F)F)C2	1846383895	GQUANHFGZWZGTL-UHFFFAOYSA-N	442.438	1.775	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)CCNc1ccccc1[N+](=O)[O-]	10887612	BBLBRSRDFBJFOD-UHFFFAOYSA-N	434.478	1.460	50	20	IDGD	
CC(=O)c1cccc(S(=O)(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)c1	16095365	GCJIAGZNOMEHGB-UHFFFAOYSA-N	428.470	1.803	50	20	IDGD	
CCOc1ccccc1OCc1nnc(SCC(=O)NNC(=O)c2ccccc2)n1N	16466036	ZQJUWNCTLVAZQU-UHFFFAOYSA-N	442.501	1.523	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cc(-c3ccccc3)n[nH]2)cc(OC)c1OCC(N)=O	17519468	PJJNWPBTCHFONP-UHFFFAOYSA-N	439.428	1.033	50	20	IDGD	
CC(C)C(=O)NNC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(Br)s2)C1	26796821	HPEYJJQEVJYZOV-SNVBAGLBSA-N	438.369	1.715	50	20	IDGD	
Cc1ccc(C(=O)NC2CCN(C(=O)NNC(=O)CNC(=O)c3cccs3)CC2)s1	725872871	HOOSNCGBLDUSAY-UHFFFAOYSA-N	449.558	1.483	50	20	IDGD	
O=C(NC[C@H]1C[C@H]2CC[C@H]1C2)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	726265399	DESOFYNPXUNSNZ-YQQAZPJKSA-N	436.534	1.088	50	20	IDGD	
O=C(NNC(=S)NCCc1ccc2c(c1)OCCO2)c1nnc(O)c2ccccc12	726745246	BWZSWGCKFXXSPG-UHFFFAOYSA-N	425.470	1.458	50	20	IDGD	
O=C(CNC(=O)NCc1ccc(Cl)cc1)NNC(=O)c1cc(Br)c[nH]1	727367261	HPTATZQUYWTLQG-UHFFFAOYSA-N	428.674	1.691	50	20	IDGD	
CCOc1ccccc1CCNC(=O)NNC(=O)c1sc(N2CCOCC2)nc1C	727843246	FYKKDPDWJXZEHB-UHFFFAOYSA-N	433.534	1.874	50	20	IDGD	
CC(C)(C)c1noc(CCCC(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)n1	728328912	YUOFBLDMIGHNJD-HNNXBMFYSA-N	446.460	1.220	50	20	IDGD	
O=C(COC(=O)c1ccc(Cl)nc1Cl)NNC(=O)[C@@H]1COc2ccccc2O1	728338459	DGZXNBZYYBIHFV-LBPRGKRZSA-N	426.212	1.533	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)c2ccc(CS(C)(=O)=O)o2)c1	728525786	GFBYDHVPUYJVFA-UHFFFAOYSA-N	431.264	1.670	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2ccc(NNC(=O)c3cn[nH]c3)c([N+](=O)[O-])c2)cc1	729295320	WYDJOTWLMLNNBR-UHFFFAOYSA-N	432.418	1.884	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)Cc1cccc(NS(C)(=O)=O)c1	730204823	FRLHKOSUMHNJDS-UHFFFAOYSA-N	429.502	1.360	50	20	IDGD	
CCCS(=O)(=O)c1ccccc1S[C@H](C)C(=O)NNC(=O)C(=O)N1CCCC1	730539429	DXOIPMIUKQNKQK-CYBMUJFWSA-N	427.548	1.121	50	20	IDGD	
O=C(CC12C[C@@H]3C[C@H](C1)CC(C(=O)NNC(=O)C1CCC1)(C3)C2)NNC(=O)C1CCC1	732142259	SULFUGYOGWNEAA-CBKSTNSXSA-N	430.549	1.858	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)c1sccc1S(=O)(=O)N1CCCC1	732304057	QLICIJNKBDPQEU-UHFFFAOYSA-N	429.545	1.693	50	20	IDGD	
CC(C)C[C@@H](C(=O)NNC(=O)c1cnn(-c2ccccc2)c1)N1C(=O)[C@H]2CC=CC[C@H]2C1=O	733108923	YUTLTYSFOFJDFX-ZCNNSNEGSA-N	449.511	1.999	50	20	IDGD	
CS(=O)(=O)Cc1ccc(CNC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1	733340869	RNACLWHSXFXZKD-UHFFFAOYSA-N	427.486	1.561	50	20	IDGD	
Cc1ccc(N2C[C@H](C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)CC2=O)cc1F	734241896	MHCGJNXCNBOPKK-CYBMUJFWSA-N	437.472	1.342	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)CN1C(=O)[C@H]2CCCC[C@@H]2C1=O	734251110	ZIDLWKRVQNINOK-KBPBESRZSA-N	436.534	1.382	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)[C@@H]2CC(=O)N(Cc3ccco3)C2)CC1	734825462	GKJKTTRKERUJDA-CQSZACIVSA-N	449.508	1.358	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)CN2C(=O)COc3ccccc32)cc1C	736755389	OODFYRIHZKUBFB-UHFFFAOYSA-N	431.470	1.349	50	20	IDGD	
O=C(COC(=O)c1cc(O)nc2ccc(F)cc12)NNC(=O)[C@H]1COc2ccccc2O1	738822021	MMDIBLXTOPMMFZ-QGZVFWFLSA-N	441.371	1.224	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)c1ccccc1F)C(=O)NNc1ncnc2[nH]cnc12	740746467	GLKFBWUERONEMG-LLVKDONJSA-N	439.498	1.035	50	20	IDGD	
CCS(=O)(=O)c1ccccc1C(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	742709341	DOWQOXKDSUOJCW-UHFFFAOYSA-N	435.414	1.006	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)N[C@H]3C[C@H]3c3cccc(F)c3)nc2)CC1	743357074	VPQBNWHHPCPFDG-ROUUACIJSA-N	448.524	1.339	50	20	IDGD	
O=C(NNC(=O)N1CCN(C(=O)c2ccccc2O)CC1)c1cccc(Br)c1	743687215	KYITVZDKHWZDRF-UHFFFAOYSA-N	447.289	1.967	50	20	IDGD	
Cc1ccc(-c2noc([C@@H](C)N3CCN(CC(=O)NNC(=O)C(C)(C)C)CC3)n2)cc1	744386646	CTUVMFNEAZNIBG-MRXNPFEDSA-N	428.537	1.917	50	20	IDGD	
CN(C)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCN(c3ccc(F)cc3)CC2)c1	746008249	JZMMLYCUNJWTLD-UHFFFAOYSA-N	449.508	1.253	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)NCc1cccc(C(=O)NCc2ccco2)c1	746758094	KMVMHFLSLYXEIC-UHFFFAOYSA-N	446.467	1.930	50	20	IDGD	
COC[C@@H](Cc1ccccc1)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	746781867	KQDCNUQRNSMKHA-QGZVFWFLSA-N	434.518	1.139	50	20	IDGD	
Cc1ccnc2nc(C(=O)NNC(=O)[C@@H]3Cc4ccccc4CN3Cc3ccccc3)nn12	747779259	RAEQTIHJPAHXKC-FQEVSTJZSA-N	441.495	1.821	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)N(C)CC(=O)NNc2cc(Cl)nc(C)n2)cc1	747980748	YCXXGQOJIIPPSG-UHFFFAOYSA-N	426.886	1.161	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)c2ccc([C@]3(C)NC(=O)NC3=O)cc2)cc1	748013356	PKIPUYRSTQRMCU-XMHCIUCPSA-N	440.456	1.368	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)C(=O)N2CCCC2)ccc1OCCOc1ccccc1	748247374	YWEYUGCZXAVYNL-UHFFFAOYSA-N	441.484	1.927	50	20	IDGD	
NC(=O)c1ccc(/C=C/C(=O)N2CCC[C@H]2C(=O)NNC(=O)c2cc3ccccc3o2)cc1	749477337	YSNUTKOQXOXCNH-PEKVBPLLSA-N	446.463	1.997	50	20	IDGD	
C[C@@]1(c2ccccc2)NC(=O)N(CC(=O)NNC(=O)c2cc(Br)c[nH]2)C1=O	750843752	OUHOSGMURLNNNC-KRWDZBQOSA-N	434.250	1.005	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cn(-c3ccc(C(F)(F)F)cn3)nn2)cc1OC	751048574	XLKRMLLFEXEMRC-UHFFFAOYSA-N	436.350	1.773	50	20	IDGD	
CC(C)(C)NC(=O)CN1CCC(CNC(=O)NNC(=O)c2ccc3ccccc3n2)CC1	751112073	RPVXAMOQUPCFGL-UHFFFAOYSA-N	440.548	1.806	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)c1cc(F)ccc1I	751198851	IKCHIPAMZNOGDA-UHFFFAOYSA-N	431.161	1.214	50	20	IDGD	
CC(C)[C@@H](NC(=O)C12CC3CC(CC(C3)C1)C2)C(=O)NNC(=O)CNC(=O)c1ccco1	751207516	YITRUOJHEZNVTA-VYBOSXCSSA-N	444.532	1.514	50	20	IDGD	
COc1ccc(CCN2C[C@H](C(=O)NNC(=S)N[C@H](C)C3CC3)CC2=O)cc1OC	751616816	JZNAHZOXDRPOFC-CZUORRHYSA-N	434.562	1.389	50	20	IDGD	
C[C@H](C(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)c1ccc(S(C)(=O)=O)cc1	753481717	DHSPGGSAXAAFEH-LBPRGKRZSA-N	449.441	1.106	50	20	IDGD	
Cn1cccc1C(=O)NNS(=O)(=O)c1cc(Br)c(Cl)c(C(=O)O)c1	753523640	LPPBTLIUVCXBQE-UHFFFAOYSA-N	436.671	1.763	50	20	IDGD	
C[C@@]1(O)CCN(C(=O)/C(C#N)=C\c2cn(CCC(N)=O)nc2-c2ccc(Cl)cc2)C1	754368382	RZOCCOZFDHSCMN-PLTPHKKDSA-N	427.892	1.969	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)Nc1ccc(NC(=O)[C@@H]2CCCO2)cc1	755640633	KHKUVVYWZXJTMY-ROUUACIJSA-N	426.429	1.797	50	20	IDGD	
CC(C)(C)S(=O)(=O)N1CCC(NC(=O)NNc2cccc(S(C)(=O)=O)c2)CC1	755921074	BNRSSYDSOPDQNI-UHFFFAOYSA-N	432.568	1.309	50	20	IDGD	
CCc1c(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)cnn1CC(C)C	756012341	KNSZUPSJSVCAGG-UHFFFAOYSA-N	448.593	1.795	50	20	IDGD	
CN1CCCCC/C1=N/S(=O)(=O)c1cccc(NC(=O)NNC(=O)c2cnn(C)c2)c1	756164042	BJCXGXPFZVGPCW-ULJHMMPZSA-N	447.521	1.480	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN(CCc2ccccc2)[C@@H]2CCOC2)cc1OC	756544966	SQDPMAFGKVFHAC-LJQANCHMSA-N	427.501	1.798	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2ccsc2C(=O)NNc2ccc(C(N)=O)nn2)cc1	757403168	XACCLVWGFVSRTB-UHFFFAOYSA-N	432.487	1.503	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)c2ccc3ccccc3n2)ccc1S(=O)(=O)N(C)C	757776466	QGMRKODWNDQSIE-UHFFFAOYSA-N	443.485	1.960	50	20	IDGD	
CS(=O)(=O)N1CCc2c(NC(=O)NNC(=O)c3cc(-c4ccccc4)[nH]n3)cccc21	758296301	MILOWCMWIADVRP-UHFFFAOYSA-N	440.485	1.865	50	20	IDGD	
C=C1c2ccccc2C(=O)N1[C@H](C)C(=O)N1CCN(S(=O)(=O)CBr)CC1	758523526	QEVVCOVAVPPUBY-CYBMUJFWSA-N	442.335	1.328	50	20	IDGD	
Cc1ccc(CNC(=O)NNC(=O)C(=O)Nc2ccccn2)c(OCC(F)(F)F)c1	758847497	UMAIPIWIKRUTAP-UHFFFAOYSA-N	425.367	1.800	50	20	IDGD	
Cc1c(CNC(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)cnn1C	759609928	YBPDHSQVXNWLGP-UHFFFAOYSA-N	445.483	1.631	50	20	IDGD	
CCS(=O)(=O)c1cc(F)ccc1NC(=O)NNC(=O)COc1ccccc1[N+](=O)[O-]	760016434	SOMBNDDPPNQHNF-UHFFFAOYSA-N	440.409	1.759	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)c1ccc(CCNS(C)(=O)=O)s1	761528228	WDJJUVYLKSPRTO-UHFFFAOYSA-N	425.532	1.242	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](Cc1ccccc1)C(=O)NNc1nccc(N2CCOCC2)n1	762852128	UMDOUYVKGLTZIK-QGZVFWFLSA-N	442.520	1.892	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)c1ccc(S(=O)(=O)Nc2nccs2)cc1	763051254	GAAWHDJCXKOUQA-UHFFFAOYSA-N	439.519	1.010	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3ccccc3O)cc2F)C[C@H](C)O1	763530409	UUMRHAUUHDWPMQ-STQMWFEESA-N	430.436	1.545	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(OC(C)C)nc2)cc(OC)c1OC	763540668	YLJUPGDYXDQQLP-UHFFFAOYSA-N	432.433	1.294	50	20	IDGD	
CCc1c(NC(=O)C(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)cnn1CC(C)C	763540755	ZDBQIPDSZXBTMC-UHFFFAOYSA-N	447.492	1.527	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(-n3nccn3)cc2C(F)(F)F)c(C)o1	763576647	QBCPWUUDYSYHGF-UHFFFAOYSA-N	436.350	1.896	50	20	IDGD	
CCc1nnc(-c2ccc(NC(=O)C(=O)NNC(=O)COc3ccc(C#N)cc3)cc2)o1	763681546	VKQQTPIICGALHN-UHFFFAOYSA-N	434.412	1.336	50	20	IDGD	
CC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(Br)cc2)cc1	763695602	QIBGTKFCFNZJAU-UHFFFAOYSA-N	449.261	1.572	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)[C@@H]3C[C@]34CCOC4)c2)cc1	763731639	BGNSLQCGMZUJBX-RXVVDRJESA-N	445.497	1.684	50	20	IDGD	
COC(=O)c1cc(Cl)ccc1NC(=O)C(=O)NNC(=O)c1cc(OC)cc(OC)c1	763775455	RFQCQKBNVUFWJR-UHFFFAOYSA-N	435.820	1.544	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccnn2-c2ccc(Cl)cc2)cc1	763810036	XSWZVCIIJUCXSC-UHFFFAOYSA-N	427.848	1.999	50	20	IDGD	
CNC(=O)c1ccc(OC)c(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)c1	763847989	GHAFDHLLJUERCH-AWEZNQCLSA-N	442.472	1.225	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1	763945446	YAQVPSTZQGCSHF-UHFFFAOYSA-N	444.791	1.539	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1c2c(nn1-c1ccccc1)CCC2	764004608	ZBPZBTLJBRMQAI-UHFFFAOYSA-N	447.451	1.532	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)Cc2cccc3ccccc23)cc1S(N)(=O)=O	764037450	XEIZBRNKUFBHET-UHFFFAOYSA-N	440.481	1.124	50	20	IDGD	
Cc1ccc(C(N)=O)cc1NC(=O)C(=O)NNC(=O)c1ccc(F)cc1Br	764084684	GJULEPAJPNXHPZ-UHFFFAOYSA-N	437.225	1.395	50	20	IDGD	
CCCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)cc1Cl	764154714	TZZXEKRGGKGWCN-QGZVFWFLSA-N	444.875	1.569	50	20	IDGD	
COCc1c(Br)cccc1NC(=O)C(=O)NNC(=O)[C@@H]1Cc2ccccc2O1	764155302	XXZBRBAWWRWSST-INIZCTEOSA-N	448.273	1.685	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2O1)C(=O)Nc1ccc(N2CCCC2=O)c(Cl)c1	764167862	NASFOGGHUVXTLG-KRWDZBQOSA-N	442.859	1.556	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)C(=O)Nc1cc(Br)c(F)cc1Cl	764268536	WKOAEHSXBQBKAJ-UHFFFAOYSA-N	429.633	1.965	50	20	IDGD	
Cc1cn(-c2ccc(C#N)cn2)nc1NC(=O)C(=O)NNC(=O)C(C)(C)c1ccccc1	764320753	KOJGTFOMIJEGCE-UHFFFAOYSA-N	431.456	1.511	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)c1cnn(-c2ncccc2Cl)c1C(F)F	764345733	UXUQHJLYIZFKRM-UHFFFAOYSA-N	449.805	1.444	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)c(Cl)c1)C(=O)Nc1ccn(CCc2ccncc2)n1	764349720	UGIUPDXDYRFTIY-UHFFFAOYSA-N	428.836	1.280	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2cccs2)[nH]n1)C(=O)Nc1ccc(O[C@@H]2CCOC2)cc1	764382387	JBEPWHHYYSNCFQ-CQSZACIVSA-N	441.469	1.706	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CN2CCC(C(=O)NCCCN3CCCCC3)CC2)cc1	764383840	TVDFZXMMNCVZER-UHFFFAOYSA-N	443.592	1.460	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc(C(N)=O)c(F)c3)n[nH]2)cc1	764384747	KWBNDHHKGWCWRB-UHFFFAOYSA-N	438.419	1.277	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc(-n4ccnn4)cc3)n[nH]2)cc1C	764386563	IXMDEOVOAREYOS-UHFFFAOYSA-N	444.455	1.674	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)C(=O)Nc1cnn(-c2ccccc2F)c1	764393654	KLVWWASXYWRLET-UHFFFAOYSA-N	429.433	1.595	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNS(=O)(=O)c2ccc(O)c(NC(C)=O)c2)cc1	765030889	STXWFHVGOKEERN-LBPRGKRZSA-N	437.474	1.526	50	20	IDGD	
CCn1c(NNC(=O)c2cc(Br)c(C)n(C)c2=O)nc2ccccc2c1=O	765217551	JNVNLRZIUWLRFO-UHFFFAOYSA-N	432.278	1.943	50	20	IDGD	
CC(C)(C)OC(=O)N1CCO[C@H](C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)C1	765385106	MSVZNTFGFRQCHN-INIZCTEOSA-N	440.522	1.206	50	20	IDGD	
CC(C)(C)S(=O)(=O)CC(=O)NNC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1	767191348	AJFRTAFWGMIMOL-UHFFFAOYSA-N	441.513	1.909	50	20	IDGD	
O=C(NNc1c(Cl)cc(F)cc1Cl)C1=NN([C@@H]2CCS(=O)(=O)C2)C(=O)CC1	767397225	YAOZZTHJYVRYSB-SECBINFHSA-N	437.280	1.741	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)CO[C@H]1CCCN(C(=O)OC(C)(C)C)C1	767730782	RCIFAUFBUCMYPF-HNNXBMFYSA-N	437.493	1.638	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)Cc2nnn(-c3ccccc3)c2C)n[nH]1	768281901	SBTUAILIASQYOH-UHFFFAOYSA-N	431.456	1.978	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NC[C@]2(C)CCO[C@H]2C2CC2)cc1	768529186	OPJGOWJTSWHOSP-ICSRJNTNSA-N	438.550	1.151	50	20	IDGD	
COCCOc1ccccc1N1CCN(CC(=O)NNC(=O)c2cccc(C#N)c2)CC1	768552793	QUNUNUXGZNPXPO-UHFFFAOYSA-N	437.500	1.167	50	20	IDGD	
Cn1c(=O)n(C)c2nc(NC(=O)CCC(=O)NNc3cc(C#N)cc(Cl)n3)ccc21	768701300	NHYBEYMSGRNUKG-UHFFFAOYSA-N	428.840	1.054	50	20	IDGD	
Nc1ccc(C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c(C(F)(F)F)c1	770063481	AHECUHGDNCZSKU-UHFFFAOYSA-N	426.307	1.814	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)[C@@](C)(O)C(C)C)c2)cc1	770207813	BMBJAAVGVZORGZ-FQEVSTJZSA-N	435.502	1.664	50	20	IDGD	
CSCC[C@H](NC(=O)c1cccc(C)c1)C(=O)NNc1nc(O)c2cnn(C)c2n1	770973417	MSQDNLOGPQHRRJ-AWEZNQCLSA-N	429.506	1.372	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1ccc(C(N)=O)cc1)C(=O)NNc1cc(Cl)ccc1Cl	771027172	GYHPTCXJQWDHCT-SECBINFHSA-N	431.301	1.902	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNS(=O)(=O)c1ccc(C(=O)O)c(Cl)c1	771606925	ZTMWQZHXLHWDAR-UHFFFAOYSA-N	446.268	1.318	50	20	IDGD	
CCOC(=O)CON=C(C(=O)NNc1nc2ccc(OC)cc2cc1C)c1cc[nH]n1	772527066	UPTXHWMCXUUMAL-UHFFFAOYSA-N	426.433	1.702	50	20	IDGD	
N#Cc1ccc(N2CCC[C@@H]2C(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)cc1	772885238	XRUBTENFEQBTPU-GOSISDBHSA-N	425.876	1.644	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2cc(C(=O)N3C[C@H](C)C[C@@H](C)C3)ccc2C)n1	773724081	MKGSKRCKLBRVAY-ZIAGYGMSSA-N	440.504	1.994	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccc(OCCN(C)C)cc1	774007581	CDICHKDGGJPOEE-AWEZNQCLSA-N	448.907	1.834	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNc1cnc2ccccc2n1	774769777	GCTADWFTOUKPBY-UHFFFAOYSA-N	441.513	1.727	50	20	IDGD	
CN(C)C(=O)COc1ccccc1C(F)(F)C(=O)NNC(=O)NCCc1cccs1	778649019	GUJKDCDCRMSRHJ-UHFFFAOYSA-N	440.472	1.880	50	20	IDGD	
COc1ccnc(NNC(=O)Nc2ccnn2Cc2ccc(OC)c(OC)c2OC)n1	779461741	KHDNFBGIRODXRB-UHFFFAOYSA-N	429.437	1.904	50	20	IDGD	
CC(C)(C)OC(=O)N=c1cc[nH]cc1C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C	780715179	HPCWYQVHSPAJNT-UHFFFAOYSA-N	438.485	1.319	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCC(C(=O)NNc3ccnc(F)c3)CC2)cc1OC	781358429	UBSFUUYYHXBACS-UHFFFAOYSA-N	438.481	1.782	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)[C@H]1CCCN(C2CCC2)C1	781404183	PNRYSWHTRRSQAR-WMZOPIPTSA-N	429.569	1.676	50	20	IDGD	
CN1CCC[C@@H](N(C)C(=O)c2ccc(NC(=O)C(=O)NNc3ncncc3Cl)cc2)C1	782166676	UEQNDWLVUWMSPE-OAHLLOKOSA-N	445.911	1.378	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNc2ccc(OC)cc2)cc1S(=O)(=O)N(C)C	783034807	IZMGHKRNRLDCJH-UHFFFAOYSA-N	436.490	1.426	50	20	IDGD	
COCC[S@@](=O)Cc1cccc(NC(=O)C(=O)NNC(=O)Nc2ccccc2C)c1	783415991	NMIREBGYOUPKJY-SSEXGKCCSA-N	432.502	1.682	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)Nc2ccccc2C)ccc1N1CCCC1=O	783417298	PILFHMHHCAOOII-UHFFFAOYSA-N	425.445	1.922	50	20	IDGD	
COc1c(NC(=O)C(=O)NNc2ccc(OCC(F)(F)F)cc2)cccc1C(N)=O	784370490	USISFDAWKYNALN-UHFFFAOYSA-N	426.351	1.817	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1ccc2c(c1)CC(=O)N2	784834265	ZYWKGUBLOFGSMI-UHFFFAOYSA-N	445.501	1.340	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)C(=O)Nc2ncn(Cc3ccc(Cl)cc3)n2)c1	784852793	PLWMFGPEYRWEGN-UHFFFAOYSA-N	428.836	1.848	50	20	IDGD	
COc1ccc(C(=O)N2CCN(C)CC2)cc1NC(=O)C(=O)NNc1cc(C)ccc1F	784884959	OJXMOGCZCZLVGT-UHFFFAOYSA-N	443.479	1.612	50	20	IDGD	
O=C(NNc1cccc(C(F)(F)F)n1)C(=O)Nc1ccc(C(=O)N2CCOCC2)cc1	784953798	HBBGGCCDXYZQLA-UHFFFAOYSA-N	437.378	1.655	50	20	IDGD	
C=CCN(C)S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2cc(F)c(F)c(F)c2)cc1	785088492	OBGUUHZLPKCSKT-UHFFFAOYSA-N	442.419	1.992	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2ccc(CC(=O)N3CCOCC3)cc2)cc1Cl	785116183	DWZSXKCLAKUMQM-UHFFFAOYSA-N	446.891	1.832	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccccc3-n3ccnn3)n[nH]2)c1	785125331	CFBRNXWTMAURCO-UHFFFAOYSA-N	444.455	1.674	50	20	IDGD	
COC(=O)c1cc(N2CCOCC2)ccc1NC(=O)C(=O)NNc1cc(F)cc(OC)c1	785245097	ATDUMHSNAYAPPA-UHFFFAOYSA-N	446.435	1.539	50	20	IDGD	
CS(=O)(=O)c1cc(NC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)ccc1Cl	788308671	BGQICLMGSYYDLL-AWEZNQCLSA-N	425.850	1.736	50	20	IDGD	
Cc1nc2c(C(N)=O)cnn2c(C)c1CCC(=O)NNc1nnc(-c2ccccn2)s1	788563476	FBPFCUPBHILNIE-UHFFFAOYSA-N	437.489	1.434	50	20	IDGD	
O=C(NCC1CCN(S(=O)(=O)c2ccccc2)CC1)NNc1nc2ccccn2n1	790259550	FHLAYPLWTFZLAS-UHFFFAOYSA-N	429.506	1.456	50	20	IDGD	
COc1ccc(OC)c(C2=NO[C@H](C(=O)NNc3c(OC)cccc3S(C)(=O)=O)C2)c1	792328704	RMMZXLBRZRCRGM-KRWDZBQOSA-N	449.485	1.752	50	20	IDGD	
Cc1ccc(C(=O)NCC(F)(F)F)cc1NC(=O)C(=O)NNc1nc2ccccn2n1	792396188	YMEAKGLVTTUXHT-UHFFFAOYSA-N	435.366	1.412	50	20	IDGD	
COc1nc(N)nc(N2CCCC2)c1C=NNC(=O)CNC(=O)OCc1ccccc1	794560340	ZJIPXXHGVKWTLC-UHFFFAOYSA-N	427.465	1.044	50	20	IDGD	
CC(Cc1ccccc1C(F)(F)F)=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O	794849612	ABDVOLABCMTGAZ-UHFFFAOYSA-N	429.424	1.325	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NN=Cc2ccc(O[C@H](C)C(=O)O)cc2)cc1	794872031	RWYFRINXULABPW-OAHLLOKOSA-N	433.486	1.618	50	20	IDGD	
CN(C(=O)OC(C)(C)C)[C@H](C(=O)NNC(=O)COc1ccccc1O)c1cnn(C)c1	796252470	BSKMKYXGUOHBHM-KRWDZBQOSA-N	433.465	1.260	50	20	IDGD	
COc1ccc(C)cc1S(=O)(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	799816584	KARNXXWNANYDFF-UHFFFAOYSA-N	442.538	1.801	50	20	IDGD	
Cc1c(I)cc([N+](=O)[O-])cc1C(=O)NNc1ccc(C(N)=O)nn1	801631501	VKDVIQKGJFVQHZ-UHFFFAOYSA-N	442.173	1.154	50	20	IDGD	
Cc1nc(C(F)(F)F)ccc1NC(=O)C(=O)NNC(=O)Cc1nc2ccccc2n1C	802570257	KIOJJXPSGKHIKX-UHFFFAOYSA-N	434.378	1.624	50	20	IDGD	
COCCn1cc(C(=O)NNC(=O)COc2ccc(Br)cc2)c(=O)cc1C	806284397	DTDXMKNMLALQRW-UHFFFAOYSA-N	438.278	1.406	50	20	IDGD	
O=C1O[C@@H](c2ccccc2)C[C@H]1C(=O)N1CCN(S(=O)(=O)CBr)CC1	809750494	YASWGIJMYGHIGU-UONOGXRCSA-N	431.308	1.117	50	20	IDGD	
COC(=O)c1c(F)ccc(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)c1F	810384071	AGGRXZWSIXQCFF-UHFFFAOYSA-N	445.176	1.242	50	20	IDGD	
O=C(NNC(=O)C(=O)NC1CC1)N[C@@H]1CCCc2c1[nH]c1ccc(Br)cc21	812431953	ACUGHOQSLFUZBH-CQSZACIVSA-N	434.294	1.917	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)[C@@H]2CCCN(C(=O)c3ccncc3)C2)cc1	812730248	DJNXCBWINDULRI-MRXNPFEDSA-N	431.518	1.327	50	20	IDGD	
CC(C)[C@H](O)C(=O)NNC(=O)CCN1CCN(C(c2ccccc2)c2ccccc2)CC1	813367327	XSUXHNXLZRWROQ-DEOSSOPVSA-N	438.572	1.948	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccc(Br)c(C#N)c1	815568364	FJWSTVGWWAWCGI-UHFFFAOYSA-N	431.246	1.658	50	20	IDGD	
CC/C=C(\C)C(=O)N1CSC[C@H]1C(=O)NNc1ccccc1S(=O)(=O)N(C)C	817055217	RNARDRLDOUJKRQ-NRUITVPNSA-N	426.564	1.638	50	20	IDGD	
O=C(CNS(=O)(=O)c1cccc(F)c1)NNC(=O)CSc1ccc(Cl)cc1	913496490	HXIALFXPMLUSPM-UHFFFAOYSA-N	431.898	1.697	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)c2cccc(S(=O)(=O)NCC3CC3)c2)cc1	914604759	OGVLMSXODZKELV-UHFFFAOYSA-N	432.502	1.257	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Cn2cc(Br)ccc2=O)cc(OC)c1OC	914686857	PQYWVJMVXXOVLA-UHFFFAOYSA-N	440.250	1.098	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)[C@H]2CCCN(C(=O)Cc3ccccc3)C2)c1	914712721	SPHJLPOYWIBLID-KRWDZBQOSA-N	425.485	1.946	50	20	IDGD	
COc1ccc([C@H](CNC(=O)NNc2ccc(-n3cccn3)nn2)N2CCOCC2)cc1	915897150	XELYTLCAOVOLQR-SFHVURJKSA-N	438.492	1.371	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)c1cc(I)ccc1-n1cnnn1	916148816	ATQSOSBXEMCCOP-UHFFFAOYSA-N	448.224	1.650	50	20	IDGD	
CCc1n[nH]cc1C(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	917907399	WSJUYPGLXMWYHO-UHFFFAOYSA-N	427.486	1.525	50	20	IDGD	
Cc1ccc([C@@H](C)NC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)s1	919787146	MWZVXARXZARWMN-CQSZACIVSA-N	438.579	1.775	50	20	IDGD	
NC(=O)c1ccc(/C=C\C(=O)N2CCC[C@H]2C(=O)NNC(=O)c2c[nH]c3ccccc23)cc1	920031239	AAAGSZIZPQOKCD-DBBZSVRUSA-N	445.479	1.732	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NN=Cc1nc2c(c(O)nc(=O)n2C)n1C	920363685	GFUXBKOUDVBALQ-SECBINFHSA-N	449.265	1.053	50	20	IDGD	
CCCNC(=O)NNC(=O)c1cccnc1SCC(=O)Nc1ccc2c(c1)OCO2	921042692	LBBYKMQMZAWZHQ-UHFFFAOYSA-N	431.474	1.895	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)CNC(=O)c3cc(Cl)ccn3)n[nH]2)cc1	1116300578	BZFQLYNAWBEJNP-UHFFFAOYSA-N	426.864	1.879	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2ccc(Br)o2)c1	1320680540	GRYWMJYXFGHHBW-UHFFFAOYSA-N	445.295	1.437	50	20	IDGD	
C[C@@H](CS(=O)(=O)c1ccc(F)cc1)C(=O)NNC(=O)c1cncn1-c1ccccc1	1323703371	BCQGBQQWTBKAKK-AWEZNQCLSA-N	430.461	1.882	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)[C@H]2CC23CCS(=O)(=O)CC3)c1	1325208325	CQUCZWRFYRVWQG-LLVKDONJSA-N	431.308	1.894	50	20	IDGD	
COC(=O)C(=O)NNC(=O)NCCc1ccc(OCC(=O)Nc2ccc(C)cc2)cc1	1330489849	QPICYOGCKWSBFP-UHFFFAOYSA-N	428.445	1.058	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnn4cccnc34)C2)C1	1778445720	JEPNEPBFEZCPDB-MSOLQXFVSA-N	426.304	1.409	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](C)n3ccccc3=O)C2)C1	1779272520	WNLKVBYVZYPVEC-VCBZYWHSSA-N	440.338	1.413	50	20	IDGD	
CCOC(=O)c1cccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)c1F	1780108897	WIWUDECDLVHPBQ-FOIQADDNSA-N	442.871	1.046	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(C(C)C)[nH]n2)C1	1780155183	HIYQRZGSZZGIBP-WIBUTAKZSA-N	426.945	1.914	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc4c(c3)NC(=O)[C@H](C)O4)CCO2)C1	1781216713	BCKCVNRUGXYIPJ-XLDJFRKUSA-N	435.908	1.867	50	20	IDGD	
O=C(CCc1cc(F)ccn1)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781326808	UWLLMOTYQOHMJI-NVXWUHKLSA-N	432.265	1.674	50	20	IDGD	
COC(=O)CCCCCC(=O)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781335241	WQHNQINAHBGCMD-DOTOQJQBSA-N	437.306	1.630	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cccc(NC(=O)OC)c3)C2)C1	1781443492	BHUYFNNWZQPJSQ-OXJNMPFZSA-N	439.896	1.562	50	20	IDGD	
CCOC(=O)C1(C(=O)N2CC[C@]3(CN(C(=O)[C@@H](Br)CC)CCO3)C2)CC1	1782923715	YNXNEPQYAJXDKX-GUYCJALGSA-N	431.327	1.333	50	20	IDGD	
O=C(C1CCC2(CC1)OCCO2)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1782943949	FOIRZRVOEGBQSG-PBHICJAKSA-N	449.317	1.440	50	20	IDGD	
CCOc1cnc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](Br)CC)C3)C2)cn1	1783342584	CAIKOIIOVIAJIY-SCLBCKFNSA-N	441.326	1.492	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)Cc3ccc(OC)c(O)c3)CCO2)C1	1783867754	AEMNOHBMECFAHX-YWZLYKJASA-N	426.897	1.027	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cc(CC(C)C)nn3C)CCO2)C1	1783874299	CNGACLBPHODHAF-OXQOHEQNSA-N	426.945	1.316	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)Cc3ccc(C)c([N+](=O)[O-])c3)CCO2)C1	1783882201	WIOUCJLHJKNLKG-JXFKEZNVSA-N	439.896	1.529	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=N/N3CCCCC3)C[C@@H]21	1783967847	YCQYPSATHGOMAV-JXDJOTKESA-N	443.386	1.469	50	20	IDGD	
CC1CCN(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)CBr)C[C@@H]32)CC1	1784317373	IEYPOXFQKHKEDP-XSLAGTTESA-N	444.414	1.729	50	20	IDGD	
Cc1nn(C)c(C)c1CC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1784512600	KYBTZNOJWQDGFY-WBVHZDCISA-N	431.306	1.100	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](C)Oc3cccnc3)C2)C1	1784547502	PIUZLDCPDSZCQC-SUNYJGFJSA-N	426.311	1.462	50	20	IDGD	
Cn1cccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]32)c1=O	1784733642	MCURIKKGPWAPJM-VFSPDHHESA-N	430.332	1.215	50	20	IDGD	
C[C@@H](CBr)C(=O)NC1(c2ccc(NC(=O)[C@@H](N)CCC(N)=O)cc2)CCC1	1787976075	ZPXYMWINZCHFPX-WFASDCNBSA-N	439.354	1.744	50	20	IDGD	
CC[C@@H](Br)C(=O)NC1(c2ccc(NC(=O)CC[C@@H](N)C(N)=O)cc2)CCC1	1788062396	ZJLGBBOHAVKLLI-HUUCEWRRSA-N	439.354	1.887	50	20	IDGD	
CC1=CC[C@H](C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)CC1	1788611200	ORSZMIXDNOWJLB-FVCZOJIISA-N	441.532	1.025	50	20	IDGD	
C[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)n1ccccc1=O	1788749966	RNRWSGIQOCXSJK-XSEXMBABSA-N	444.301	1.080	50	20	IDGD	
COCCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)[C@H]2C1	1789222323	SIGNRESDDWXKCJ-FNHZYXHNSA-N	449.460	1.150	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](N)c3ccccn3)C[C@@H]21	1789866730	XBCJFJRCAQDNNF-RMVLQADPSA-N	429.348	1.297	50	20	IDGD	
CCOc1ncccc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](Cl)COC)[C@H]2C1	1791251147	XOJLJYXEYKQIIG-LLLHUVSDSA-N	425.913	1.327	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4c(c3)CC(=O)N4)C[C@@H]21	1791253949	JPPKWRFWNVEIJA-MBGYTDRXSA-N	435.908	1.028	50	20	IDGD	
COc1ccc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]3C2)cc1O	1791292457	RTWGGTVUPDXMAF-XEZPLFJOSA-N	431.316	1.727	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCCCCC(=O)OC)[C@H]2C1	1791353838	LOIBXJGACLLWDJ-NXOAAHMSSA-N	432.945	1.343	50	20	IDGD	
COCCCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)C2	1792842627	SPEZYMCYCVPPSZ-JFABSOQWSA-N	433.455	1.888	50	20	IDGD	
Cc1cc(/C=C/C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)CBr)no1	1792871053	PPJUHMQICNQCPZ-PGQDAVBQSA-N	426.311	1.617	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1CCc2ccoc2C1	1793290745	UHJBWZUCCGTGLS-NXOAAHMSSA-N	437.500	1.335	50	20	IDGD	
Cc1nn2cc(CC(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)[C@H](F)Br)C4)nc2s1	1793904718	IWIGTGKJXGHQKW-TWJQMWNJSA-N	444.330	1.970	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)COc1ccc(F)cc1	1795592359	COGWLMQJXTUNKA-MUJYYYPQSA-N	441.463	1.155	50	20	IDGD	
CC(C)(C)OC(=O)N1CC=C(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Cl)CC1	1796370791	MDGNUEFDAJSQEA-QKPAOTATSA-N	445.919	1.678	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1=NN(c2ccccc2)C(=O)C1	1796480528	MBMUYTZDEXOMQW-DOHHPOSVSA-N	446.935	1.776	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1nccc2[nH]ccc12	1796653117	AXSPIHMNBFYRKZ-BTTYYORXSA-N	433.472	1.127	50	20	IDGD	
Cc1cnc2c(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@@](C)(Cl)CCl)C4)cnn2c1	1797420408	TZICRIYQTTUSJF-QPWUGHHJSA-N	440.331	1.477	50	20	IDGD	
CC(=O)O[C@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)CBr)C2)C(C)C	1797589609	AHKHIPWUQUNPCX-JZYAIQKZSA-N	433.343	1.195	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCN1Cc2ccccc2C1=O	1797767101	RYGVBZXJCAMNEO-SFNKJDCFSA-N	433.936	1.925	50	20	IDGD	
COCCCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O	1798521488	KJBYYOXWLVVJAU-YVWYUNDQSA-N	449.460	1.150	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(OC)c(O)cc1[N+](=O)[O-])C2	1799269024	QORAWTKDBULXEQ-QTFJUKGGSA-N	441.868	1.530	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cn3cccnc3n1)C2	1799275873	CLKRGASXQOFFQQ-JPVZDGGYSA-N	426.304	1.169	50	20	IDGD	
NC[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Br)c1ccccc1	1799346146	FPJHURJOZMXOTR-JKJDWNRSSA-N	428.302	1.009	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](C)N1CCN(C)CC1	1799968775	VPQWAFFLLSCPHQ-ZOFXXKQRSA-N	429.403	1.434	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ncon1)C2)[C@@H](Br)Cc1ccccc1	1800437234	SOAGTTUUWBYAKI-FZKCQIBNSA-N	449.305	1.279	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3cncn3c1)C2	1800642069	UZDJCOVEDYPLSC-YALNPMBYSA-N	435.322	1.711	50	20	IDGD	
O=C(COc1ccccc1F)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2	1800645747	CFNHTUIBCJVGCJ-IVWMJMPLSA-N	429.286	1.579	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCn1nc(C)cc1C	1801247904	CKKVJLGBXBYKTK-KYHPRHEASA-N	441.370	1.653	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc3nonc3c2)[C@@H]1c1cccnc1)[C@H](O)CCl	1803139717	UGMMSCITPVXBRK-BMGDILEWSA-N	429.864	1.537	50	20	IDGD	
Cc1cc(C)n(CCC(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]2c2cccnc2)n1	1803145819	INDROFRUUSRWAW-QWFCFKBJSA-N	433.940	1.591	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC2(CCN(C(=O)CN3CCNC3=N)CC2)C1	1805383652	UTQBSQADSOCCLP-AWEZNQCLSA-N	428.375	1.089	50	20	IDGD	
Cc1cc(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)c(C)o1	1805562240	SWAJCSDHMSPLEN-DENIHFKCSA-N	447.300	1.605	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1	1807998090	IHXODYMQTQKSHO-PPHDSNJXSA-N	449.305	1.991	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@H](CNC(=O)c2cc(O)nc(O)n2)[C@@H]1c1cccnc1	1808304112	USBAPAVSBAJSKG-KSSFIOAISA-N	445.552	1.454	50	20	IDGD	
CCn1nc(C(=O)N2CCC3(CCCN(C(=O)c4ccc(B(O)O)cc4)C3)CC2)cc1C	1809971295	QNICNKAJNABVNP-UHFFFAOYSA-N	438.337	1.050	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)c3cccc4nc[nH]c34)CC2)C1	1809977681	CHJGCYBGGAMVPC-UHFFFAOYSA-N	446.316	1.401	50	20	IDGD	
CC(=O)NCCC(=O)NC[C@@H]1CCN(C(=O)[C@](C)(Cl)CCl)[C@@H]1c1cccnc1	1812661421	KBWXUHATCQEWIN-KVSKMBFKSA-N	429.348	1.850	50	20	IDGD	
Cc1ccc(C(=O)N[C@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)cc1	1815343840	RROKVVWHLPCVIK-KRWDZBQOSA-N	435.314	1.671	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)Cn3cc(Cl)cn3)sc2C1	1815413882	LRHPKQXOXWAXBF-WDEREUQCSA-N	432.333	1.859	50	20	IDGD	
O=C1CC[C@@H](C(=O)N2CCCC[C@H]2c2cc(NC(=O)CCBr)n[nH]2)CN1	1816779315	FXPODBIIEQYOGO-YPMHNXCESA-N	426.315	1.713	50	20	IDGD	
O=C(CCBr)Nc1cc([C@@H]2CCCCN2C(=O)[C@H]2CCCS2(=O)=O)[nH]n1	1816784190	DBNOCDLVKBCDHN-QWHCGFSZSA-N	447.355	1.764	50	20	IDGD	
CC[C@@H](NC(N)=O)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCBr)CC2	1817017376	XGLNZVKNRRLFJX-DTWKUNHWSA-N	432.344	1.287	50	20	IDGD	
CN1CCN(C2(C(=O)N[C@@H]3CCc4nc(NC(=O)[C@@H](F)Cl)sc4C3)CC2)CC1	1817128641	QCRNWDRHRDOIPG-BXUZGUMPSA-N	429.949	1.370	50	20	IDGD	
O=C(N[C@H]1CCc2nc(NC(=O)[C@H](F)Cl)sc2C1)c1cnc2c(c1)CCNCC2	1817134470	NVJDYAZYURJXPR-LRDDRELGSA-N	437.928	1.987	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](O)C(C)C)CC2	1817276576	VIFNDWRQZFIFJU-MXRJAMCGSA-N	446.533	1.206	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccoc2Cl)[nH]n1)c1cccc(B(O)O)c1	1817477089	YQOKHZXAZUFCGI-INIZCTEOSA-N	442.668	1.956	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H]1CCC=CO1)CC2	1819797835	MBNYZIDGICJIND-ABAIWWIYSA-N	442.501	1.060	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)C/N=C/c3ccco3)sc2C1	1819956125	DEOQBKSWKIHSDL-SRRANQMSSA-N	446.533	1.140	50	20	IDGD	
COC[C@H](NC(C)=O)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CO[Si](C)(C)C)CC2	1820193529	XMYXWGOQYPHLDK-JSGCOSHPSA-N	442.614	1.058	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)Cc1ccn(C)n1)CC2	1825642490	QZYZCJVHVZMJAF-ZJUUUORDSA-N	426.340	1.815	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccccn2)CC1	1825809231	JIXDPWKMTJLKGC-HXUWFJFHSA-N	436.516	1.627	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](C)Cn1cccn1)CC2	1825994030	OLZMQQSOTJCGLA-AGIUHOORSA-N	425.942	1.842	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)C(C)(C)CCl)CC2	1826082821	DDVCFLFKIXKSFP-NSHDSACASA-N	429.974	1.693	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CS(C)(=O)=O)CC1	1826630043	XIMGOVSIXSNPFV-GJZGRUSLSA-N	437.400	1.824	50	20	IDGD	
C=C(C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1)C(F)(F)F	1827060269	FAQAECLWOTWSNL-GOSISDBHSA-N	438.255	1.718	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1CCc2nc(NC(=O)C34CC(C3)C4)sc2C1	1827353737	PIIWJFZCFPSGQL-CLCPWWMLSA-N	440.529	1.989	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)[C@@]3(C)CC3(F)F)sc2C1	1828054697	JGFAMHLILRGKOQ-DYZYQPBXSA-N	429.493	1.473	50	20	IDGD	
CCn1nc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)cc1C	1829397490	IELINFLMQRHCIN-HXUWFJFHSA-N	446.596	1.818	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cncc(F)c3)C2)C1	1830537314	DDXZJGNADORGAS-SCLBCKFNSA-N	444.301	1.322	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H]3CC=CCC3)CCO2)C1	1830568137	NSQDBYFSFAXYFF-GPMSIDNRSA-N	429.355	1.973	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](O)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H](F)Cl)CC1	1830667985	QMOUNJWWWGEGFS-RRFJBIMHSA-N	435.924	1.984	50	20	IDGD	
COC(=O)[C@@H]1CC[C@H](C(=O)N2CCO[C@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)C1	1830704928	CJIMIQHFDVGWAY-GCKMJXCFSA-N	444.956	1.297	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H](O)CCl)CC1	1831578702	SBRYIFHBKNXPQW-CVEARBPZSA-N	431.961	1.731	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(Cl)cnc3O)C2)C1	1831638998	JHTNZLBTKZGJKA-BEFAXECRSA-N	446.331	1.918	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3c(F)c(C)nn3C)C2)C1	1831643844	IGINSEZQVYKTRV-LIRRHRJNSA-N	430.908	1.345	50	20	IDGD	
Cc1nnsc1C(=O)N1CCC([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1	1831873278	OLAHFEZLNRCXQB-MRXNPFEDSA-N	436.582	1.453	50	20	IDGD	
O=C(/C=C/c1ccsc1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1833141857	QYYZLWUBPDWEPH-CYJXPKQYSA-N	447.326	1.908	50	20	IDGD	
C=CCO[C@@H](C)C(=O)NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1	1833477737	RFEZZMABMRIBGS-BBRMVZONSA-N	434.350	1.840	50	20	IDGD	
CN1CCC[C@H]1C(=O)N1CCC(N2CCC(NC(=O)CCBr)CC2)CC1	1834422281	BCQDQHCXIIQBTL-KRWDZBQOSA-N	429.403	1.437	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)COc3ccc(F)cc3)CCO2)C1	1834959851	YAMWTPQYZLSOOI-OAQYLSRUSA-N	442.915	1.926	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)C#Cc3ccccc3)CCO2)C1	1835101985	MKZJWLUCKXWROF-NHCUHLMSSA-N	439.339	1.731	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnccc3F)CCO2)C1	1836317798	BUFJQIXVQAEKAQ-ROUUACIJSA-N	434.295	1.527	50	20	IDGD	
O=C(c1cccn2ccnc12)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1837001519	MNLAASNQBSBAQT-GOSISDBHSA-N	427.288	1.208	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(C#N)c1)CCO2	1838907308	LAGSYOPJZSYPTJ-OAQYLSRUSA-N	431.565	1.480	50	20	IDGD	
COc1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)c1	1838929113	YOCSDOHPYIBORG-OAQYLSRUSA-N	436.581	1.617	50	20	IDGD	
CN1CCCC[C@@H]1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2	1839150661	SWRXSEKCDBLYTM-MNEFBYGVSA-N	436.380	1.163	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)cc(O)n1	1839152229	RKGCCNHINKAQGS-OALUTQOASA-N	446.331	1.402	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccncc3)C2)C1	1839154538	QQFAKKJTQSDYQJ-MOPGFXCFSA-N	430.332	1.317	50	20	IDGD	
CCn1nc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)cc1C	1840033618	LIIIXAQOFNAYLX-RDTXWAMCSA-N	443.342	1.065	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc(Cl)s3)C2)C1	1840153037	BGPOMQLXBXAVOG-BDJLRTHQSA-N	438.333	1.120	50	20	IDGD	
C[C@H]1CCc2c(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)C(Cl)Cl)CCO4)n[nH]c21	1840188502	NGMYNXMMDHGBCT-BBATYDOGSA-N	431.320	1.333	50	20	IDGD	
COC1(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](C)CBr)C3)C2)CCC1	1840615183	ALCCWYUDYDEMEB-KXBFYZLASA-N	447.370	1.433	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(OC)c3F)CCO2)C1	1840794293	WHEQZTKRNXLHLD-MGPUTAFESA-N	428.888	1.922	50	20	IDGD	
COc1cc(Br)ccc1CC(=O)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1	1841354112	IWNAHFWZHLPPJW-AWEZNQCLSA-N	445.741	1.803	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)CCc2cccnc2C)C1	1841947600	TVZZCDJXOCBJCL-YZSQISJMSA-N	436.516	1.660	50	20	IDGD	
O=C(c1n[nH]c2c(Cl)cccc12)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843012181	MGQAGFYHMJXRJO-UHFFFAOYSA-N	438.680	1.027	50	20	IDGD	
CN1CCCn2nc(C(=O)N3CC4(CCCN4C(=O)[C@](C)(Cl)CCl)C3)cc2C1	1845172361	DHVJOEDIBSPQQB-GOSISDBHSA-N	428.364	1.772	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)c1nn(-c3ccccc3)c3c1COC3)C2	1846361896	UQRJSVNMMVVMNU-KRWDZBQOSA-N	444.919	1.973	50	20	IDGD	
N=C(N)NCC(=O)N1CC2(CCCN2C(=O)CCCCCCCCBr)C1	1847121561	PXEWFWZBQRUUOC-UHFFFAOYSA-N	430.391	1.798	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)c1ccc(S(=O)(=O)C(F)F)cc1	12800774	RBOXJCZSLQCDOA-UHFFFAOYSA-N	446.457	1.051	50	20	IDGD	
O=C(CCc1nc2ccccc2[nH]1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	16969761	BFXSJMXKLXLJNA-UHFFFAOYSA-N	441.513	1.741	50	20	IDGD	
C=CCNS(=O)(=O)c1ccc(C(=O)NNC(=O)[C@H](C)Oc2ccc(OCC)cc2)cc1	18071977	APKXBLHTLNEDEM-HNNXBMFYSA-N	447.513	1.778	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)CCc2nnc(-c3ccccc3)o2)c2ccccc2c1=O	20908258	WDQDHLHLCWDYDE-UHFFFAOYSA-N	432.440	1.860	50	20	IDGD	
Cc1ccc(OCCCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1	726262472	FXGAYRHYNZHAPN-UHFFFAOYSA-N	434.518	1.658	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)c2cccc(CN3CCS(=O)(=O)CC3)c2)c(C)c1	728205279	XRSBGCCBRVRSID-UHFFFAOYSA-N	444.557	1.407	50	20	IDGD	
CC(=O)N1C[C@@H](C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)Oc2ccccc21	728210566	OZOHGZKZCBYRRL-IBGZPJMESA-N	430.486	1.385	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)CCC(=O)c3ccccc3)cc2)CC1	728213384	ZFNCLTITHAFXRU-UHFFFAOYSA-N	430.530	1.729	50	20	IDGD	
CCOC(=O)c1cc(S(=O)(=O)NNC(=O)c2ccc(OC)c(OC)c2)ccc1F	728501442	LDRIZHMRUSYTOU-UHFFFAOYSA-N	426.422	1.643	50	20	IDGD	
C[C@H]1Sc2ccc(C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)cc2NC1=O	728847961	GMCXQHSAGRYVJM-GFCCVEGCSA-N	426.502	1.587	50	20	IDGD	
CC(C)Oc1ccc(-c2nc(C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)cs2)cc1	729276387	DNOOZJMEJYZVQL-LLVKDONJSA-N	426.520	1.296	50	20	IDGD	
O=C(CN1C(=O)N[C@]2(CCc3ccccc32)C1=O)NNC(=O)Cn1ccc2ccccc21	729450168	NYIRUVCLSOCCCB-QHCPKHFHSA-N	431.452	1.182	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCCCN1C(=O)CCC1=O	730021497	LUBCHKGUCJNNEH-NSHDSACASA-N	441.282	1.086	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)[C@H]1CS[C@@]2(c3ccc(F)cc3)CCC(=O)N12	730778706	UCUKAPMXRGAQNT-QVKFZJNVSA-N	445.472	1.648	50	20	IDGD	
COC(=O)c1ccc(OCCNC(=O)NNC(=O)c2cc(Br)c[nH]2)cc1	731219332	ZWHKELPVZOOCDK-UHFFFAOYSA-N	425.239	1.587	50	20	IDGD	
CCN(CC)[C@H](C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1)c1ccccc1	732351224	YACNYXPNDPZMGC-FPOVZHCZSA-N	441.484	1.600	50	20	IDGD	
C[C@H]1CN(Cc2ccc(C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)cc2)C[C@@H](C)O1	734241299	MARLRMGHBUXKNU-IYBDPMFKSA-N	449.552	1.765	50	20	IDGD	
CN(C)CC(C)(C)CNC(=S)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	734766089	BETPKKVWGCXPPC-UHFFFAOYSA-N	430.619	1.652	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)c2ccc(OS(=O)(=O)c3cccc([N+](=O)[O-])c3)cc2)cn1	735445957	LEAKNIJYQPQQIX-UHFFFAOYSA-N	445.413	1.171	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)COc1ccc(C#N)cc1)[C@H]1CN(Cc2ccccc2)CCO1	741431580	HNUQMQUZSAMPQI-DYESRHJHSA-N	437.500	1.557	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)c1ccc(Cl)c(N2CCNC2=O)c1	742474770	VQHDBOVSWDAKHC-UHFFFAOYSA-N	426.820	1.593	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CNC(=O)c2cccs2)cc(OC)c1OC(F)F	742613653	VKCJSSGSZAJHMH-UHFFFAOYSA-N	429.401	1.558	50	20	IDGD	
CON(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cccc(Br)c2)c1	742771376	QUFYVLQOPCQRBG-UHFFFAOYSA-N	442.291	1.706	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)CC1	744584033	SCHKRILEPDTEOG-UHFFFAOYSA-N	430.461	1.510	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)[C@@]23CCC(=O)N2c2ccccc2S3)c1	744617752	ICTVFUCLNJNUKM-NRFANRHFSA-N	436.449	1.491	50	20	IDGD	
Cc1sc(=O)n(CCC(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)c1C	744622080	VVYPLZYMLJQKBU-UHFFFAOYSA-N	440.547	1.081	50	20	IDGD	
CCc1c(C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)cnn1Cc1ccccc1	744743553	DFUPYPXCKRMQPI-UHFFFAOYSA-N	431.452	1.983	50	20	IDGD	
COc1cc(C)nc(NNC(=O)[C@@H]2CCC[C@@H](C(=O)NNc3nc(C)cc(OC)n3)C2)n1	746632899	LCCSBJOVUXNDLS-ZIAGYGMSSA-N	444.496	1.293	50	20	IDGD	
NC(=O)CC[C@H](C(=O)NNC(=O)c1ccc(Cl)cc1F)N1C(=O)c2ccccc2C1=O	747431259	HUIZKUZJFGVXFA-OAHLLOKOSA-N	446.822	1.170	50	20	IDGD	
O=C(Cc1ccccc1)NCC(=O)NNc1ccc(S(=O)(=O)Nc2nccs2)cc1	747942904	LCPYELUKSPKEAW-UHFFFAOYSA-N	445.526	1.746	50	20	IDGD	
Cc1nc(Cl)cc(NNC(=O)CNC(=O)c2ccccc2I)n1	747981365	DSDFTDUNWMIGKS-UHFFFAOYSA-N	445.648	1.916	50	20	IDGD	
COc1ccccc1CC(=O)N1CCC(NC(=O)NNC(=O)Cc2ccc(F)cc2)CC1	749018839	SGPSVPNVJRGHIX-UHFFFAOYSA-N	442.491	1.941	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)c1cc(I)c[nH]1	750232968	LPIHJUJBQOLHKG-UHFFFAOYSA-N	437.197	1.585	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)c1cc(Br)cc([N+](=O)[O-])c1Cl	750830132	XYOGFEKITYQNHV-LURJTMIESA-N	440.659	1.206	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)NNC(=O)[C@@H](C)Oc2c(C)cc(Cl)cc2C)c(C)o1	751297565	IRTBHQCDDPZDLM-GFCCVEGCSA-N	443.909	1.995	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)c2ccc(N3CCCS3(=O)=O)cc2)nc2ccccc21	753118389	SRKDZEMNZAMWIS-UHFFFAOYSA-N	427.486	1.117	50	20	IDGD	
CC(C)n1cnc(S(=O)(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)c1	753950831	USVABMBGONEISE-UHFFFAOYSA-N	430.531	1.356	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)Nc2cccc(C(=O)N3CCOCC3)c2)c1	755926647	LUOYTVYFCATZKV-UHFFFAOYSA-N	428.445	1.643	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2ccc(OC)c(OC)c2)c(Cl)cc1F	755958706	QCXMPVHZNFKMKC-UHFFFAOYSA-N	446.840	1.906	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)Nc1ncc(Cc2ccccc2)s1	756197676	KRALGTYOZGRPLE-UHFFFAOYSA-N	441.425	1.747	50	20	IDGD	
Cc1c(C(=O)NNC(=O)[C@H]2COc3ccccc3O2)cnn1CCO[C@@H]1CCCCO1	758053179	FLWWEPXOURKPCB-RTBURBONSA-N	430.461	1.336	50	20	IDGD	
O=C(NNc1nc(O)c2ccccc2n1)c1cccc(S(=O)(=O)NC[C@H]2CCCO2)c1	758310412	BVOVORMJHYZEFI-CQSZACIVSA-N	443.485	1.550	50	20	IDGD	
C[C@H](NC(=O)OC(C)(C)C)[C@H]1CCCN(CC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)C1	758786176	YVMXKKUHOSDNGV-HOCLYGCPSA-N	449.508	1.981	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cnn(C)c3Br)CC2)cc1	760380858	IOGGLVCEROJBMC-UHFFFAOYSA-N	449.353	1.070	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCCOc1ccc(Cl)cn1	760712954	CKPFDQDTOLTLGX-UHFFFAOYSA-N	440.913	1.360	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)Cc2ccc(C(=O)NN=C3CCN(C)C3=O)cc2)cc1	761744079	YHSALOKFGXFPSY-UHFFFAOYSA-N	428.514	1.764	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)C1CCOCC1	762370629	RFCYEXMMJGBSDX-HNNXBMFYSA-N	438.550	1.620	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)C(=O)Nc1cc(F)ccc1OC[C@@H]1CCCO1	763441806	KARFNZDECUBEQE-HNNXBMFYSA-N	446.391	1.691	50	20	IDGD	
CC(C)CCNS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2O)cc1	763525372	AVHUULPGFPGDKX-UHFFFAOYSA-N	448.501	1.116	50	20	IDGD	
CCN(CC)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2O)cc1Cl	763528263	WUBDWEUDMOTMDR-UHFFFAOYSA-N	432.864	1.927	50	20	IDGD	
CC[C@@H](C)n1nc(NC(=O)C(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)cc1C	763542510	GHHHLLOEIHUXRW-LLVKDONJSA-N	433.465	1.588	50	20	IDGD	
CCOC(=O)c1c(F)cccc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccccc2)[nH]n1	763611584	BBXHDJJFIQEMLH-UHFFFAOYSA-N	439.403	1.792	50	20	IDGD	
COc1ccc(OC(C)C)c(NC(=O)C(=O)NNC(=O)c2c(C)nc3ccccn23)c1	763628732	LVULSINCEGTWAP-UHFFFAOYSA-N	425.445	1.838	50	20	IDGD	
Cc1cccc(NC(=O)C(=O)NNC(=O)COc2ccc(Br)cc2)c1C#N	763696688	YVKMLBYXEFKCEG-UHFFFAOYSA-N	431.246	1.794	50	20	IDGD	
Cc1ccc(Br)c(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)c1	763806451	DDIMTAZSMWHGSL-UHFFFAOYSA-N	431.246	1.794	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)NC(C)C)cc2)c1C	763841961	VOMUPEOVOGCTGS-INIZCTEOSA-N	440.500	1.995	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(Cl)c(C(=O)NC)c2)cc1OC	763900178	BJUAOVIFAYLVCD-UHFFFAOYSA-N	448.863	1.507	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)C(=O)Nc1cccc(-c2nccs2)c1	763916692	JNUXMUMRTNESHU-UHFFFAOYSA-N	434.441	1.186	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)c(OC)cc1Cl	763998138	MJICGBDFKSRRSZ-UHFFFAOYSA-N	445.657	1.848	50	20	IDGD	
O=C(NNC(=O)c1ccc2ccccc2c1)C(=O)Nc1ccccc1CN1C(=O)CCC1=O	764064303	HWHFIKRZIYNOSP-UHFFFAOYSA-N	444.447	1.889	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(N3CCSCC3)cc2C)c(O)c1	764111776	ZSOKKQOMHHSKKM-UHFFFAOYSA-N	428.514	1.962	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2ccc(CC(=O)N(C)C)cc2)cc1	764125843	CDAWDQKIXLUDRV-UHFFFAOYSA-N	426.473	1.045	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2cnn(-c3cc(C)ccc3C)c2C)c1O	764131214	OORYHBMEELOXAI-UHFFFAOYSA-N	437.456	1.911	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ccoc2)ccc1Cl	764159338	AQIDHBUHAAMFNV-UHFFFAOYSA-N	442.881	1.363	50	20	IDGD	
CCOC(=O)c1cnn2c(C(=O)NNc3nc(O)c4cnn(C(C)(C)C)c4n3)ccnc12	764215375	KZCUFUPREZONLU-UHFFFAOYSA-N	439.436	1.263	50	20	IDGD	
CN1CCc2ccc(NC(=O)C(=O)NNC(=O)c3cccc(OC(F)F)c3)cc2C1=O	764251254	SWGJZIUTCBHBIS-UHFFFAOYSA-N	432.383	1.316	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C(=O)Nc1ccc(C)c(S(=O)(=O)NC)c1)c1ccccc1	764327275	WRYPOEZEDLGVTC-INIZCTEOSA-N	432.502	1.183	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)n(C2CCOCC2)n1	764377434	DXXONKARNXXPOD-UHFFFAOYSA-N	437.403	1.301	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1ccn(Cc2ccccc2)n1	764394326	ZLHWMDJDFNWBBS-UHFFFAOYSA-N	439.497	1.818	50	20	IDGD	
Cn1ccnc1-c1csc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)n1	764404598	MOYJBKQRPUBLOG-UHFFFAOYSA-N	432.487	1.127	50	20	IDGD	
C[C@H](NS(=O)(=O)c1cccc(C#N)c1)C(=O)NNC(=O)C12CC3CC(CC(C3)C1)C2	764533140	IAVUMQBCGSOZSG-FCLDQCEHSA-N	430.530	1.589	50	20	IDGD	
O=C(NNC(=O)C1(O)CCSCC1)c1cccc(S(=O)(=O)NCc2ccccc2)c1	764588514	SULDPXYWMOHFLA-UHFFFAOYSA-N	449.554	1.184	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NN=CCCC1CCOCC1	764898389	VPXMOMZFIPUUKT-UHFFFAOYSA-N	437.562	1.949	50	20	IDGD	
NC(=O)COc1ccc(Cl)cc1S(=O)(=O)NNC(=O)c1cc2c(s1)CCC2	766310741	LISMLFKASIPLKY-UHFFFAOYSA-N	429.907	1.378	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)NCCc1cn2c(n1)SCC2	767950478	VHYDMWRNQZFYPX-UHFFFAOYSA-N	440.323	1.703	50	20	IDGD	
CCC[C@H](C)NS(=O)(=O)c1cc(C(=O)NNC(=O)C(C)(C)O)c(Cl)cc1Cl	768261691	NSLHHTNKXXKRKV-VIFPVBQESA-N	440.349	1.992	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)CCn2nc(C)c([N+](=O)[O-])c2C)n[nH]1	768274763	ZYBFJEOOAZBABZ-UHFFFAOYSA-N	427.421	1.658	50	20	IDGD	
COc1ccc(NNC(=O)c2ccc3c(c2)S(=O)(=O)N(C(C)C)C3=O)c([N+](=O)[O-])c1	768327734	IAVJLSOBIUDURF-UHFFFAOYSA-N	434.430	1.913	50	20	IDGD	
CCOC(=O)c1cnn2c(C(=O)OCC(=O)NNC(=O)c3ccc(Cl)cc3)ccnc12	769847200	ALJBLBAJPSYTTI-UHFFFAOYSA-N	445.819	1.177	50	20	IDGD	
COc1ccccc1-c1noc([C@H](C)NC(=O)NNc2nc(O)c3cnn(C)c3n2)n1	770397420	CUXAWKZWDMXFAS-VIFPVBQESA-N	425.409	1.515	50	20	IDGD	
Cc1cccc(F)c1NNC(=O)C(=O)Nc1cccc(S(=O)(=O)N2CCN(C)CC2)c1	770822072	QGGWFPVGNQNNLK-UHFFFAOYSA-N	449.508	1.152	50	20	IDGD	
C[C@@H]1OCC[C@H]1C(=O)NNC(=O)c1ccc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1	770855429	DFFWITMZFHBLRB-YVEFUNNKSA-N	448.457	1.582	50	20	IDGD	
COc1ccc(-c2nnc(S)n2CCC(=O)NNc2nc(O)c3cnn(C)c3n2)cc1	770968771	NTIOAOGKWCAIDN-UHFFFAOYSA-N	441.477	1.158	50	20	IDGD	
O=C(NNC(=O)N1CCC(Oc2ncccc2F)CC1)c1ccc(-n2cnnn2)cc1	772337625	IEEGZVBZAIFPQI-UHFFFAOYSA-N	426.412	1.094	50	20	IDGD	
CC(C)COc1cccc(OCC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1	772789638	HXRZGSLFYGEMNE-UHFFFAOYSA-N	427.505	1.954	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1cccc([C@@H]2CNC(=O)C2)c1	774010030	UOAWTOCZDRQWMN-JSGCOSHPSA-N	444.875	1.497	50	20	IDGD	
CCCCn1cc(CNC(=O)NNC(=O)c2nn(CC)c(=O)c3ccccc23)c(C)n1	774302805	JQGVTLXNOQKSAY-UHFFFAOYSA-N	425.493	1.866	50	20	IDGD	
O=C(COC(=O)c1cc(O)c2ccccc2c1O)NNC(=O)[C@@H]1COc2ccccc2O1	776524949	QLBPIGBECQEAIA-SFHVURJKSA-N	438.392	1.395	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2sc3nc(C)nc(N)c3c2C)cc(OC)c1OC	777841044	XBEHAHZAKHYWIV-UHFFFAOYSA-N	431.474	1.991	50	20	IDGD	
COc1ccc(Cn2ccc(NC(=O)C(=O)NNC(=O)c3c[nH]c4ccccc34)n2)cc1	778705859	HEIBAVXQZFSARS-UHFFFAOYSA-N	432.440	1.821	50	20	IDGD	
Cc1nn(-c2ccc(S(N)(=O)=O)cc2)c(C)c1CCC(=O)NNc1nccnc1Cl	781932805	YCUBROICIRLGLS-UHFFFAOYSA-N	449.924	1.656	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)nc1Br	781934733	WFWWYNZSJUNYPZ-UHFFFAOYSA-N	442.295	1.221	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2ccc(OC)c(S(=O)(=O)NC3CC3)c2)cc1	783036103	NUYCEKXEVQXOHX-UHFFFAOYSA-N	434.474	1.226	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccc3ncsc3c2)nc1	783263890	MMJBCQXUYNSDBI-UHFFFAOYSA-N	434.503	1.460	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NN[C@]2(C)CCS(=O)(=O)C2)ccc1C(=O)OC(C)(C)C	783424875	GFQPTCPZJWBHSD-LJQANCHMSA-N	425.507	1.087	50	20	IDGD	
O=C(NNc1ccc(-n2cccn2)nn1)C(=O)Nc1cccc(-c2n[nH]c(C3CC3)n2)c1	783435979	GCBACJQXMKWONX-UHFFFAOYSA-N	430.432	1.407	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)N[C@H]2COc3cc(F)cc(F)c32)cc1	784575552	VARHSMFXSSYVJJ-ZDUSSCGKSA-N	426.401	1.838	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNc2cccc(S(C)(=O)=O)c2)ccc1N1CCCC1=O	784841779	QUCJCIIAXUPSMR-UHFFFAOYSA-N	446.485	1.307	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)[C@@H](CC1CCC1)NC(C)=O	787171289	JFZBFBAPNPVLRN-OAHLLOKOSA-N	425.869	1.348	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)cc1N1CCNC1=O	787544553	UKSXHHBEBGIQRE-UHFFFAOYSA-N	449.265	1.015	50	20	IDGD	
CC(C)(C)c1csc(NC(=O)C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)n1	789731424	HJQTWLWBGLCMNZ-UHFFFAOYSA-N	428.474	1.732	50	20	IDGD	
Cn1cc(-c2ncccc2NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)cn1	789815664	DCKZGVCTUOSZGA-LPHOPBHVSA-N	434.456	1.141	50	20	IDGD	
COc1cc(NNC(=O)c2cc(S(N)(=O)=O)ccc2N2CCOCC2)ccc1Cl	790188119	XFGDWRLBCFUJEB-UHFFFAOYSA-N	440.909	1.590	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2c(C)ccc(C)c2[N+](=O)[O-])cc(OC)c1OC	790384927	FCJLJBYUAVSXBT-UHFFFAOYSA-N	439.446	1.861	50	20	IDGD	
C[C@@H]1CC(=O)C[C@@H](C(=O)NNC(=O)c2ccccc2)[C@@H]1C(=O)NNC(=O)c1ccccc1	791122373	YJEWVUFTULXBIS-NIKGAXFTSA-N	436.468	1.140	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)[C@](C)(O)Cn2cc(C(F)(F)F)ccc2=O)c1	792014854	ODXSOOZRXLBVSP-GOSISDBHSA-N	427.379	1.153	50	20	IDGD	
Cc1nc2c(C(=O)NNC(=O)c3ccc(S(=O)(=O)N4CCCC4)cc3)cccc2o1	792016052	LDKAFLRAARFOII-UHFFFAOYSA-N	428.470	1.996	50	20	IDGD	
CCCOc1ccc(C(=O)NNS(=O)(=O)c2cnc(C)c(C(=O)OC)c2)cc1OC	793351405	XPQFXVHUHIRQCR-UHFFFAOYSA-N	437.474	1.597	50	20	IDGD	
C[C@H]1CN(c2ccnc(C(=O)NNc3ccc(S(=O)(=O)N(C)C)cc3)c2)C[C@H](C)O1	794730565	MTCNXDALOOMGRD-GJZGRUSLSA-N	433.534	1.702	50	20	IDGD	
COC(=O)[C@@H](CS(=O)(=O)NNC(=O)c1cccc(Br)c1)c1ccccc1	795335080	UJBRJJGZGNVACN-HNNXBMFYSA-N	441.303	1.970	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)cc1)C(=O)Nc1ccc(Cl)c(CN2CCOCC2)c1	797537389	LDOKWZHDHRBRKD-UHFFFAOYSA-N	432.864	1.278	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)N[C@@H]1CCCN(C(=O)Cc2ccccc2)C1	800983554	NFUINCNGBSNMDH-GOSISDBHSA-N	434.500	1.820	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)[C@@H]2CC[C@H](C(F)(F)F)NC2=O)cc1Cl	802074590	RYOUSZDZEWBIQZ-JMCQJSRRSA-N	438.790	1.967	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNc2cc(Cl)ccn2)(S(C)(=O)=O)CC1	803054052	HPXABNOMSJJMMI-UHFFFAOYSA-N	432.930	1.992	50	20	IDGD	
CCc1nnc(NC(=O)[C@@H](C)[C@H](C)NC(=O)NNC(=O)COc2ccccc2F)s1	804867411	AOFIGNQKBSJDFJ-QWRGUYRKSA-N	438.485	1.612	50	20	IDGD	
COCCNC(=O)[C@H](C)OC(=O)c1ccc(NC(=O)NNc2ncncc2Cl)cc1	806747092	YLKFOUHOCABJGB-NSHDSACASA-N	436.856	1.587	50	20	IDGD	
COCc1csc(NC(=O)C(=O)NNC(=O)c2cc(-c3cc(C)ccc3C)[nH]n2)n1	807021486	OZBYANFJDOIWIF-UHFFFAOYSA-N	428.474	1.696	50	20	IDGD	
CN1CCN(C(=O)NNC(=O)[C@@H]2CC(=O)N(C)[C@@H]2c2ccc(Cl)c(Cl)c2)CC1	807382313	AGVWLYLSDHYMGV-MLGOLLRUSA-N	428.320	1.501	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)C1(S(=O)(=O)c2ccccc2)CCOCC1	808475838	CLHNXKFXXHTKML-UHFFFAOYSA-N	442.497	1.047	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)[C@@H]2CCc3nnn(C)c3C2)cc(OCC)c1OCC	809949530	QMLAOWKNTYEGAK-CYBMUJFWSA-N	431.493	1.577	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)CC(C)(C)C)c(C(=O)NCC(F)(F)F)cc1F	810386971	ZJDOHQHSPCCIRG-UHFFFAOYSA-N	434.390	1.948	50	20	IDGD	
Cc1cc(NNC(=O)CNS(=O)(=O)c2ccc(NC(C)C)c([N+](=O)[O-])c2)nc(C)n1	810422243	IHUZQWQCWNRVNV-UHFFFAOYSA-N	437.482	1.244	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)Cn1nc(C(F)(F)F)cc1C	811245125	HASNVFITYGBSPG-UHFFFAOYSA-N	448.785	1.877	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)[C@@H]2CCN(c3ccccc3Cl)C2)n1	811418306	YIVLCAGEXGVVGL-CYBMUJFWSA-N	436.921	1.865	50	20	IDGD	
Cc1ccc(S(=O)(=O)NC2CC2)cc1C(=O)OCC(=O)NNC(=O)c1ccccc1	811841101	PDQWBCFMFAHBHI-UHFFFAOYSA-N	431.470	1.054	50	20	IDGD	
COC[C@]1(CNC(=O)NNC(=O)COc2ccccc2OC)OCCc2ccccc21	811851587	JVYVMRXSDWSVPU-QFIPXVFZSA-N	429.473	1.519	50	20	IDGD	
C[C@H](NCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)c1ccc(N2CCCNC2=O)cc1	812900399	ZMXMZDQJMFIBJT-AWEZNQCLSA-N	440.460	1.626	50	20	IDGD	
O=C(CN1CCN([C@H](C(=O)NCc2ccccc2)c2ccccc2)CC1)NNC(=O)C1CC1	812909060	CDGZUCLBCYPNDO-QHCPKHFHSA-N	449.555	1.219	50	20	IDGD	
CCCN1C(=O)c2ccccc2N2C(=O)CC[C@@]12C(=O)NNC(=O)c1ccc(C#N)cc1	814675437	NDSDDJLYOVOGNK-HSZRJFAPSA-N	431.452	1.708	50	20	IDGD	
CC(=O)N1CCN(Cc2cccc(NC(=O)C(=O)NNc3cccc(Cl)n3)c2)CC1	815728806	VAMKPAUFBZLNEM-UHFFFAOYSA-N	430.896	1.481	50	20	IDGD	
C[C@H]1CCCN(S(=O)(=O)c2ccc(NC(=O)C(=O)NNc3ncncc3F)cc2)C1	815764413	GZLABPJEHYGSAN-LBPRGKRZSA-N	436.469	1.118	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)[C@H]2CCCO2)sc2c1CC[C@H](CC)C2	815779144	SPQGKACHOCZZJY-WCQYABFASA-N	437.518	1.705	50	20	IDGD	
Cc1ccc2snc(C(=O)NNC(=O)CN3CCN(C(=O)c4ccccc4)CC3)c2c1	815827449	ZNRPLKXLGPPBLC-UHFFFAOYSA-N	437.525	1.824	50	20	IDGD	
CCOc1ccc(N2C[C@@H](C(=O)NNC(=O)CNc3cccc(OC)c3)CC2=O)cc1	825810594	OXIOWCVWDSBUKP-HNNXBMFYSA-N	426.473	1.706	50	20	IDGD	
Cc1ccc(C)c(NC(=S)NNC(=O)Cn2cc(Br)c(O)nc2=O)c1	836442847	YUACZCWROZIQNO-UHFFFAOYSA-N	426.296	1.346	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)NCCc1ccc(S(N)(=O)=O)cc1	838483002	XAIPABQQWNIQAV-UHFFFAOYSA-N	426.882	1.183	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1	860475626	SGKUUGSLWOSCIV-QGZVFWFLSA-N	425.470	1.708	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)CN2C(=O)N[C@@]3(C[C@@H](C)CC(C)(C)C3)C2=O)c1	864001596	QAIAUHVRZKUQGA-NPMXOYFQSA-N	444.532	1.966	50	20	IDGD	
C=CCn1c(=O)c2ccccc2n2c(SCC(=O)NNC(=O)C3CCCC3)nnc12	914849307	VNSHBDQGUVLSJW-UHFFFAOYSA-N	426.502	1.660	50	20	IDGD	
CN1C(=C(C#N)C(=O)COC(=O)[C@@H]2CC(=O)N(CC(F)(F)F)C2)N(C)c2ccccc21	914969257	KUXSVPZGWZIXHN-GFCCVEGCSA-N	436.390	1.831	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@@H]2C(=O)NNC(=O)COc2cccc(C)c2)c(OC)c1	915059540	BCRLRWIUCFLYBU-LJQANCHMSA-N	441.484	1.843	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)NCCN2CCS(=O)(=O)CC2)c(C)n1C[C@@H]1CCCO1	915264199	OFTAHXOSTXGYEU-DTBYZMGXSA-N	434.562	1.038	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)C[C@@H](C)n2nc(C)cc2C)c1	915685632	HSIAOKCBJBXATA-MRXNPFEDSA-N	435.550	1.943	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NC[C@@H](Cc2ccccc2)N(C)C)nc1	915899236	BMDWKLNIPBXRNI-QGZVFWFLSA-N	434.566	1.567	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)NC[C@H](C(C)C)N2CCN(C)CC2)cc1OC	916257729	AVPKBNRWVJVGRM-GOSISDBHSA-N	435.569	1.700	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)NCCS(=O)(=O)NCc2ccccc2)c1	916645256	KLKCZUCQAIGXQH-UHFFFAOYSA-N	434.518	1.132	50	20	IDGD	
COc1ccc(N2CCCN(CC(=O)NNC(=O)c3ccc(OC)c(OC)c3)CC2)cc1	917210261	KQWDKQKBAPFGDA-UHFFFAOYSA-N	442.516	1.686	50	20	IDGD	
CCc1c(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)[nH]c(C)c1C(C)=O	917919756	WJDYLWFBKYJXIX-UHFFFAOYSA-N	426.882	1.464	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)c1ccc(OCC(=O)NC(C)C)c(OC)c1	919822851	OGPAUWFZUSFYAN-UHFFFAOYSA-N	429.473	1.611	50	20	IDGD	
O=C(Cn1c(Cc2ccccc2)nc2ccccc21)NNC(=O)N[C@@H]1CCS(=O)(=O)C1	919888460	DAYXIQQXMBZDSN-MRXNPFEDSA-N	441.513	1.145	50	20	IDGD	
COc1cccc(/C=C(/C(=O)NNC(=O)Cc2c[nH]c3ccccc23)n2nnnc2C)c1	920422326	SMLMBHSUFZYZGX-JAIQZWGSSA-N	431.456	1.860	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)Nc1ccc(CN2C(=O)CNC2=O)cc1	920932830	IBPZXSJHWWGFBK-UHFFFAOYSA-N	435.238	1.296	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@H]3COc4ccc(F)cc4C3)CC2)cc1	1116407508	OAMPDYIVPUUWPL-HXUWFJFHSA-N	440.519	1.650	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2C(=O)N[C@@](C)(c3ccc(F)c(Cl)c3)C2=O)cc1	1324050363	XLXRFNFUBFTMAR-FQEVSTJZSA-N	448.838	1.716	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)N2CCN(C(=O)N3CCOCC3)CC2)c1C	1337820619	PCOKTTFTPUDJRG-HMMYKYKNSA-N	429.521	1.255	50	20	IDGD	
O=C(c1cc2c(F)cc(F)cc2[nH]1)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1777795364	UUMWVCXTNJCDHH-APWZRJJASA-N	427.835	1.489	50	20	IDGD	
CN1CCc2cc(C(=O)N3CC[C@@]4(C3)CN(C(=O)[C@H](F)Br)CCO4)ccc21	1777920641	NLOTUQICHROWJX-QFBILLFUSA-N	440.313	1.813	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)Cn2cncn2)C1	1779494988	HFOVNVDTNQJJIC-WOCWXWTJSA-N	425.961	1.836	50	20	IDGD	
CN1CCC[C@@H](C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CO[Si](C)(C)C)C2)C1	1779546888	WFUFRQPPFJLIRK-DBXWQHBBSA-N	425.646	1.694	50	20	IDGD	
CN(C)c1ccc([N+](=O)[O-])c(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](F)Cl)CCO3)c1	1780117152	GDWXWCCBJDSKDY-CRAIPNDOSA-N	428.848	1.639	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)[C@@H](O)CCNC(=O)OC(C)(C)C)CCO2)C1	1781216900	QDCYUJVKEYTYIO-AVYPCKFXSA-N	447.960	1.109	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)c3nc4ccccn4n3)CCO2)C1	1781227455	MBZZRTXKTMXFFG-ZWKOTPCHSA-N	426.304	1.409	50	20	IDGD	
COc1cccnc1CCC(=O)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781325410	CWRDUXQHTAJSPT-FUHWJXTLSA-N	444.301	1.543	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1n[nH]c3c1CC[C@@H]3C)C2	1782172864	OXCLEPTWLLOBEJ-WRUKREGBSA-N	438.956	1.841	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccnc4c3OCO4)CCO2)C1	1783352810	SWTVTKBNCNJVTJ-FZKQIMNGSA-N	440.294	1.427	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc(Cl)nc3)[C@H]2C1	1783380630	MALFZVLQOHFHDP-URBCHYCLSA-N	431.718	1.507	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccc4c(c3)CCN4C)CCO2)C1	1783534795	ZITYZQZQIIJQKA-JLTOFOAXSA-N	436.350	1.906	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc([N+](=O)[O-])cc3F)CCO2)C1	1783881334	RPBXTRUDMYJKCC-KSSFIOAISA-N	429.832	1.431	50	20	IDGD	
Cc1cc(Cl)ccc1C(=O)N1CCO[C@@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1	1783933037	OVPPQFAXMRPXFI-OAQYLSRUSA-N	436.940	1.465	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3[C@H]4c5ccccc5S[C@H]43)C[C@@H]21)[C@@H](O)CCl	1784092193	IWAVXAPMYFINQB-FVUWOOOVSA-N	436.961	1.454	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3ccc(F)nc3)[C@H]2C1	1785236093	ZLMSTWAYGLGWMN-NXOAAHMSSA-N	427.904	1.387	50	20	IDGD	
Cc1nc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCBr)C[C@@H]32)cs1	1785291469	BMEUECAPADDQIN-QEJZJMRPSA-N	430.368	1.759	50	20	IDGD	
CC(C)N[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)Br)C[C@@H]21)C(C)C	1786961972	FNIUNUKAAIIZFT-QUSNUVHPSA-N	432.403	1.772	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnn4ccncc34)[C@H]2C1	1788038630	CZVJTFMSXNZGHJ-DUPGQFARSA-N	436.310	1.106	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C=N/O[C@@H]3CCCCO3)[C@H]2C1	1788652367	CIKZGBZKHRPAFO-DVBHBNPLSA-N	429.945	1.903	50	20	IDGD	
CCOC(=O)O[C@@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]2C1	1789924699	BIXCNLUBCXAVAE-PJSNJIKXSA-N	439.278	1.218	50	20	IDGD	
COc1ccccc1CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]2C1	1789925094	NDVQKPGNNSHHJV-ILXVDBEPSA-N	443.313	1.908	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)c1ccc(NC(=O)C2CC2)cc1	1789989340	NTECVJUMYRXHNS-WNHJNPCNSA-N	449.935	1.228	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(O)c(O)c(Cl)c3)[C@H]2C1	1790246172	PPCFTTXNMVMIAE-JPYFCXBMSA-N	447.315	1.598	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(O)ccc3O)[C@H]2C1	1790264035	DARPDLXLKBXFQJ-LMMLAZSQSA-N	441.322	1.722	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc4ccnn34)[C@H]2C1	1790345230	SRDGUOPYZQIXRL-HPZZRFSDSA-N	435.322	1.711	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](OC(C)=O)C(C)C)C[C@@H]21	1790960464	IINMRZDNLGPNEM-WOYTXXSLSA-N	447.370	1.727	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc(C)nc3)C[C@@H]21	1790961644	SSCBWFARBZNPAB-HNKHHVNMSA-N	425.327	1.552	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nc4ccccn4c3C)C[C@@H]21	1791253788	GTDAHPXBNLRFQU-NXOAAHMSSA-N	434.924	1.490	50	20	IDGD	
C[C@H](Br)C(=O)Nc1ccc(C2(NC(=O)CN(CCO)CCO)CCC2)cc1	1791435246	AOJMTOLCFQQRTP-AWEZNQCLSA-N	442.354	1.191	50	20	IDGD	
CC1(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)/C(C#N)=C/c2ccc(F)cc2F)C3)COC1	1792624807	DKPNHDJHKCCSEH-ULMACSCCSA-N	431.439	1.498	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3n[nH]cc3c1)C2	1792868227	UPZHCYKOBVRNJN-RMIITELYSA-N	435.322	1.797	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(C)(C)c1ccccn1)C2	1792872005	IKNHASZMLQMZIH-PNBKFKSVSA-N	438.366	1.980	50	20	IDGD	
CC(C)(C)OC(=O)N1CC=C(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](O)CCl)C1	1793106767	KFKJSZWLQPKYPS-FZKCQIBNSA-N	427.929	1.401	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccnc(C(=O)OCC)c1)C2	1793448823	LSPJKUFDAABYLF-DFGXFYAUSA-N	437.924	1.869	50	20	IDGD	
Cc1cc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)CBr)C3)ccn1	1793910781	VOJKBCDTKXQSQQ-UEILYKACSA-N	438.366	1.943	50	20	IDGD	
CCn1nccc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2	1795259870	QYRKDRRXKDCKOU-BDHJUDLHSA-N	425.493	1.289	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1ccc(S(C)(=O)=O)cc1	1795852712	UZQWNOITEIWGIV-KYHPRHEASA-N	442.965	1.525	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2ccccn2n1	1796834145	MECJLDUJNXIYGC-YXPYIKCWSA-N	435.322	1.711	50	20	IDGD	
CC(C)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1ON=C(c2ccccc2)O1	1797640590	VRIKOYMITMQSIL-RCJHGTSTSA-N	435.908	1.576	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C=N/O[C@H]1CCCCO1	1797810750	WJTRRUIFELXZEA-PKFJTPLDSA-N	446.342	1.136	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccn(C(F)F)c1=O	1797993249	NCNDOSWFHCDZBU-AYRXBEOTSA-N	431.867	1.854	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1CCCC1)C2	1798522624	FMGQEDXYHAFKFQ-CWPLJXCYSA-N	445.472	1.914	50	20	IDGD	
COc1cccc(OC)c1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2	1798827148	LBXMILBSDLGDSC-OJXGSEEGSA-N	445.285	1.598	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)Cc1ccccc1)C2	1799279794	UAYVVDUIUHJQAY-WFNPHZEWSA-N	429.344	1.416	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(-n2cncn2)c1	1799774719	YYDGZMYYRBEWTC-NBMJBFSESA-N	431.924	1.878	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnn2c1OCCC2	1799936064	NWVHCOCLGMITFJ-AZGFTEDZSA-N	431.320	1.105	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c(c1)CC(=O)N3)C2	1800759596	XKHABHJBOPFQET-MJRMRKOOSA-N	436.306	1.168	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccccc1-n1nccn1)C2	1800759722	DRQUGCNRMQSKLU-ZJOBFFGXSA-N	448.321	1.254	50	20	IDGD	
COc1cccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Br)C3)c1C	1800822265	RAOUJEFVTBASTF-LTCOOKNTSA-N	443.313	1.826	50	20	IDGD	
C[C@@H](S)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](Br)Cc1ccccc1)C2	1800987441	QNBZZBJCCHHPGM-USACIQFYSA-N	441.391	1.901	50	20	IDGD	
C[C@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C=C/C(=O)NCc1ccco1)C2	1801962851	ABBWGVAZWDVHDV-MVGBAZTJSA-N	438.322	1.874	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C=C/c1ccc(O)c(O)c1O	1802079144	UMYQKBQSUKQQDO-BDBLBAKTSA-N	438.908	1.814	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cc1noc3ccccc13)C2	1802332515	CULIQBBRIJIFNW-MUJYYYPQSA-N	427.505	1.382	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H]1C[C@H]1c1ccc(F)cc1)C2	1802334860	QPXXGELPQVMMDO-LJDSDSDDSA-N	430.524	1.940	50	20	IDGD	
CC(=O)N[C@H](C(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)C(C)(C)C	1803136131	OCHZSRAGYAAACZ-ZJPYXAASSA-N	438.956	1.238	50	20	IDGD	
CCOc1cnc(C(=O)NC[C@@H]2CCN(C(=O)[C@H](Cl)COC)[C@@H]2c2cccnc2)cn1	1804919635	MQQWEXFUULBKRL-FRQCXROJSA-N	447.923	1.844	50	20	IDGD	
CC(C)(C)n1cc(C(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)cn1	1804925208	BKGHTEKMWBMSIP-CGTJXYLNSA-N	433.940	1.952	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)N1CCC2(CCCN(C(=O)[C@@H](O)CCl)C2)CC1	1805528949	BMCALVMQLPQJIY-HNNXBMFYSA-N	431.961	1.732	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H](CNC(=O)C(=O)N(C)C)[C@H]1c1cccnc1	1806936751	RBWFJCUHKYZGCS-BPLDGKMQSA-N	425.327	1.207	50	20	IDGD	
Cc1noc(C)c1C(=O)N1CCCC2(CCN(C(=O)c3cnccc3C(=O)NN)CC2)C1	1808219413	XECKXBCYDHTSEN-UHFFFAOYSA-N	440.504	1.449	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC2(CCCN(C(=O)c3nccn3C)C2)CC1	1808622692	LEGGXZPSCUJOIX-PCLIKHOPSA-N	439.520	1.399	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)Cc2ncccn2)[C@H]1c1cccnc1)[C@@H](F)Br	1808651109	IIUPVSGZKLAFCT-RRQGHBQHSA-N	436.285	1.811	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)NC[C@H]1CCN(C(=O)C(Cl)Cl)[C@H]1c1cccnc1	1810242037	ZSNPNNLTMMSJLB-BNOWGMLFSA-N	430.336	1.599	50	20	IDGD	
CC[C@H](C)CC(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1	1810295351	SGSOIQOOANZCAH-LUQKVYGDSA-N	438.532	1.836	50	20	IDGD	
CC[C@H](NC(C)=O)C(=O)N1CC[C@H](CNC(=O)CO[Si](C)(C)C)[C@@H]1c1cccnc1	1810537863	QHGUOQIJAPXYOY-HBFSDRIKSA-N	434.613	1.854	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)C[C@H]2CCCCO2)[C@@H]1c1cccnc1	1813068192	JQCJZKSVIHMRIU-YCRNBWNJSA-N	445.564	1.420	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H]2CCCCO2)n[nH]1	1814505813	HPNUUECYHQXIHN-DLBZAZTESA-N	441.492	1.283	50	20	IDGD	
Cc1cc(C)cc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)c1	1815360183	BCPNGNKNDLXCLM-GOSISDBHSA-N	449.341	1.979	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnc(N(C)C)o2)n[nH]1	1816330860	KKDKUMOKVLRDII-CQSZACIVSA-N	446.512	1.143	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnc[nH]1)CC2	1817277292	PGXMMHWAEDGODO-YBGGJHSQSA-N	440.489	1.226	50	20	IDGD	
C[Si](C)(C)OCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN2C(=O)C=CC2=O)[nH]n1	1819597207	LMQSFHHCNBUVHT-AWEZNQCLSA-N	433.541	1.178	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCC1CCC1)CC2	1819792787	AQFQTJURBHARMG-ZDUSSCGKSA-N	442.545	1.948	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)Cn2ccccc2=O)[nH]n1)[C@@H](F)Br	1820932910	VDDWYPJWEJCYSI-BLLLJJGKSA-N	440.273	1.954	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](O)CCl)CC2)c1cncc2cnccc12	1821208110	KDASQQDBFADHSA-NHYWBVRUSA-N	431.905	1.912	50	20	IDGD	
CCNC(=S)NCC(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](C)Br)n[nH]1	1822188880	PFWHKMUMGCYPRS-JQWIXIFHSA-N	445.387	1.669	50	20	IDGD	
Cc1nn(C)cc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1	1822411068	ZENHCQQKYQVQTN-INIZCTEOSA-N	430.513	1.131	50	20	IDGD	
CCS(=O)(=O)CC(=O)N[C@@H]1CCc2nc(NC(=O)[C@@](C)(Cl)CCl)sc2C1	1822861127	WGOKOWMCTMFRAF-PSLIRLAXSA-N	442.390	1.726	50	20	IDGD	
O=C(NCC(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H](O)CCl)CC1)c1ccco1	1824182176	VPSFVDBPRBMQOB-CVEARBPZSA-N	425.913	1.229	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccnc3c1OCO3)CC2	1826002817	CUEUQJLEYHZAIC-MWLCHTKSSA-N	438.893	1.746	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(=O)cco2)CC1	1826230777	RGRUTGBTTCNOAC-GOSISDBHSA-N	432.521	1.246	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H]3C[C@@]3(F)Cl)sc2C1	1826274271	QARBMPSSMUQQLW-KEYDSSBGSA-N	431.921	1.353	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC([C@H]2CCCCN2C(=O)CN2CCNC2=N)CC1	1826873919	PCVWBANAJOHOJT-DZGCQCFKSA-N	428.375	1.229	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H](O)C(C)C)CC1	1827677456	UGWKOVNTRODCRH-TZPGLHDLSA-N	445.564	1.757	50	20	IDGD	
C[C@H](C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(B(O)O)cc1)CC2)c1ccccc1	1828230984	WWFFXCCJMPNEQF-KSSFIOAISA-N	449.341	1.852	50	20	IDGD	
CC(=O)C(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)[C@@H](F)Cl)C2)C1	1828792145	MLBVFPXEERKBSM-OXQOHEQNSA-N	439.871	1.562	50	20	IDGD	
CC(=O)C[C@H](C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1	1828925276	IFUBXIVDHHMTKT-YWZLYKJASA-N	443.548	1.534	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc(N(C)C)o3)C2)C1	1831643937	LUZNFSHTRANTBS-AUUYWEPGSA-N	428.917	1.218	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCN3CCCCC3)C2)C1	1831647104	PWUXSBXVFBYUSK-WIYYLYMNSA-N	429.989	1.726	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccn4nccc34)C2)C1	1831653532	HJKXPFDSIBUOHK-UWJYYQICSA-N	434.924	1.812	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)CC[C@H]2CCOC2)CC1	1831876932	NCEGAILXHOJYKK-AZUAARDMSA-N	436.597	1.796	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3cccc(OC)n3)CCO2)C1	1832769205	LRDDNIWQOLOGON-OXJNMPFZSA-N	425.913	1.107	50	20	IDGD	
N#Cc1ccc(CC(=O)N2CCC(N3CCC(NC(=O)[C@H](O)CCl)CC3)CC2)cc1	1833306261	OUHZALZYVDPBRE-HXUWFJFHSA-N	432.952	1.272	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3ccc4[nH]ccc4n3)CC2)CC1)[C@@H](O)CCl	1833309951	FPXQKHIKRHTQJO-IBGZPJMESA-N	433.940	1.348	50	20	IDGD	
CC[C@H](C)[C@H](O)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1833499725	SKVVEDPYYRNNCN-VBNZEHGJSA-N	436.366	1.656	50	20	IDGD	
CCc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)cn1	1833892741	PXGIOKLSIVFDHL-MAUKXSAKSA-N	444.301	1.405	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)s1	1833957568	OFJYNYOVCYBACN-LJQANCHMSA-N	426.611	1.978	50	20	IDGD	
CC(C)c1cc(C(=O)N2CCOC[C@]3(CN(C(=O)CCBr)CCO3)C2)no1	1834819262	MMAFEAJMVLOKFD-SFHVURJKSA-N	444.326	1.653	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC(N2CCC(NC(=O)c3cc4n(n3)CCC4)CC2)CC1	1835609057	MIGWSBCUMRYDJC-UHFFFAOYSA-N	447.656	1.866	50	20	IDGD	
Cc1cnoc1C(=O)NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1836070380	AHPWQTXWLAWZRA-OAHLLOKOSA-N	431.306	1.859	50	20	IDGD	
Cc1n[nH]cc1C(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)Br)CC2)CC1	1836154932	YQZALVAALRZBCW-GFCCVEGCSA-N	426.359	1.687	50	20	IDGD	
Cc1nc2ccncc2cc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1836837543	RYHGMZPKIQYSEL-YLJYHZDGSA-N	436.871	1.543	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccn4cncc34)CCO2)C1	1837107564	IQWHLTXUIHYNDD-LAUBAEHRSA-N	434.924	1.812	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cc(OC)ccn3)CC2)CC1	1838464636	VRVSYYILMKFTCA-GOSISDBHSA-N	439.940	1.956	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@@H]3CCCS3(=O)=O)CC2)CC1	1838637396	NUIMBCMRAQRFDT-SJORKVTESA-N	434.986	1.580	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccccc3)CCO2)C1	1838849093	ROXKRWWIWGTURJ-KXBFYZLASA-N	425.323	1.788	50	20	IDGD	
CCc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)nn1C	1839153588	LNRLBBGMNGQEJP-RBUKOAKNSA-N	447.363	1.289	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cc(C#N)ccc1F)CCO2	1839421531	WXIFJZZGTYTOCT-NRFANRHFSA-N	449.555	1.619	50	20	IDGD	
COc1cccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)c1C	1840071109	OPEWUKZRZCKACA-HXUWFJFHSA-N	445.343	1.806	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)C3=COCCC3)CCO2)C1	1840213946	CJHHOZXCGPKTNZ-KSSFIOAISA-N	431.327	1.168	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC12CN(C(=O)c1nc(O)n3c1CCCC3)C2	1841287869	LWFNSRJNITWYDG-LBPRGKRZSA-N	425.327	1.773	50	20	IDGD	
Cn1c(C(=O)N2CC3(CCCN3C(=O)[C@H](O)CCl)C2)cc2c1-c1ncccc1OC2	1841350646	PKWMYDXMCKZKPR-OAHLLOKOSA-N	430.892	1.396	50	20	IDGD	
CS(=O)(=O)Cc1ncccc1C(=O)N1CCCC12CN(C(=O)[C@@H](F)Br)C2	1842241150	PWBVHZRLISAEDU-CYBMUJFWSA-N	448.314	1.134	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@H]1C[C@@](C)(O)CN1C(=O)OC(C)(C)C)C2	1845167848	XDEMQRNRRAROCY-QEEYODRMSA-N	443.972	1.968	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)CCOCCOCCOCCOC)C1	1845245273	NNVRAFZEFZPWLY-SFHVURJKSA-N	448.988	1.684	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)c2cccc(-c3cnco3)c2)C1	1845414393	XSBCGTDBMUJVKL-UHFFFAOYSA-N	431.257	1.152	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@](C)(O)C[C@H]1C(=O)N1CCCC12CN(C(=O)[C@H](F)Cl)C2	1846230598	WKVQZDLEHUUDGN-LXIYXOSZSA-N	433.908	1.485	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H]1CCCCO1	1847310204	AXOIYHFULXBDQM-VGWMRTNUSA-N	429.945	1.889	50	20	IDGD	
O=C(c1ccc2[nH]nc(Br)c2c1)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl	1847564400	ZERNZCYWAKLAEW-MELADBBJSA-N	441.713	1.741	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)C1CCN(S(=O)(=O)c2ccc(C#N)cc2)CC1	16492530	GEHIBIPLWYJASW-UHFFFAOYSA-N	426.498	1.729	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)c2ccc(CCNS(C)(=O)=O)s2)c1	17203338	YNVIQLQONISUFM-UHFFFAOYSA-N	425.532	1.297	50	20	IDGD	
CN1C(=C(C#N)C(=O)COC(=O)c2csc(S(N)(=O)=O)c2)N(C)c2ccccc21	22747990	HZBAMKFTMMPXQO-UHFFFAOYSA-N	432.483	1.443	50	20	IDGD	
O=C(NNC(=O)c1ccc(=O)n(Cc2ccccc2Cl)c1)c1ccc(-n2cnnn2)cc1	27094155	IVMAKILEPRJWPO-UHFFFAOYSA-N	449.858	1.601	50	20	IDGD	
CCOC(=O)c1ccc(N2CCCN(CC(=O)NNC(=O)c3ccc(F)cc3)CC2)nc1	725798723	MWFNGYSGMXMYFL-UHFFFAOYSA-N	443.479	1.371	50	20	IDGD	
CC(C)COC(=O)N1CCC(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)CC1	726156296	DLWVPHROYCPMKH-UHFFFAOYSA-N	439.538	1.245	50	20	IDGD	
Cc1c(NNC(=O)NCc2ccc(C(=O)N3CCNC(=O)C3)cc2)cccc1[N+](=O)[O-]	728127362	IJTSRADLFPJKBD-UHFFFAOYSA-N	426.433	1.302	50	20	IDGD	
Cc1nn(Cc2ccc(C(=O)N([C@H]3CCS(=O)(=O)C3)N(C)C)cc2)c(C)c1[N+](=O)[O-]	728179727	UPDMSGIZFWTNEF-KRWDZBQOSA-N	435.506	1.562	50	20	IDGD	
Cn1c(=O)n(C)c2cc(S(=O)(=O)NNC(=O)c3cccc(OC(F)F)c3)ccc21	728510535	MYYUUPWIPNOFCJ-UHFFFAOYSA-N	426.401	1.102	50	20	IDGD	
CN(C)CCNC(=O)c1cccc(CNC(=O)NNC(=O)c2cccc(OC(F)F)c2)c1	728596238	IFDFPKBEQGUHJT-UHFFFAOYSA-N	449.458	1.724	50	20	IDGD	
COCCn1cc(C(=O)OCC(=O)NNC(=O)Cc2nc(C)cs2)c2ccccc21	728729592	QKDOVTVUTZRXOD-UHFFFAOYSA-N	430.486	1.600	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=O)c2cccc(C#N)c2)c1	728870042	NYEVGGQNOLNPOG-UHFFFAOYSA-N	436.877	1.211	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)c1ccc2c(c1)C(=O)N(C[C@@H]1CCCO1)C2=O	729451124	INKHZHRCBGKZHC-KRWDZBQOSA-N	446.463	1.878	50	20	IDGD	
CCOC(=O)c1cnn(-c2ccc(C(=O)NNC(=O)c3cnn[nH]3)cc2)c1C(F)(F)F	729457994	ZGLUDSDSYNOBGI-UHFFFAOYSA-N	437.338	1.261	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)NC[C@@H]2CN3CCC[C@@H]3CO2)c1	729617604	FFZILNNALSLOGQ-DGCLKSJQSA-N	427.299	1.265	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)[C@H]1CCCN1C(=O)c1ccc2c(c1)OCO2	730033170	VAYHTBBXRHPARI-MRXNPFEDSA-N	425.441	1.506	50	20	IDGD	
O=C(COC(=O)c1ccc(N2CCOCC2)c(F)c1)NNC(=O)c1ccc([N+](=O)[O-])cc1	730374634	NRARMZIOMFERNO-UHFFFAOYSA-N	446.391	1.189	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)N1CCC([C@H](O)c2ccc(Cl)cc2)CC1	731500179	DTKXMBCDLAKNJC-GOSISDBHSA-N	434.880	1.849	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Cn2c(=O)n(C)c3ccccc32)cc1Br	732034599	WVRIXLWQAJOYCC-UHFFFAOYSA-N	433.262	1.572	50	20	IDGD	
N#CCc1ccc(Oc2ccc(C(=O)NNC(=O)N[C@H]3CCS(=O)(=O)C3)cc2)cc1	732061231	FFFDXQKPJXRTMA-INIZCTEOSA-N	428.470	1.676	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)COc2ccc(Oc3ccccn3)cc2)C[C@@H](C)O1	732259867	KSAUNHMIGIBVNR-CALCHBBNSA-N	428.489	1.899	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)c2nnc3ccccc3c2O)cc1	732266998	PZOGKHGGBPFMFZ-UHFFFAOYSA-N	435.469	1.831	50	20	IDGD	
COC(=O)c1cc(OC(=O)CN2C(=O)N[C@]3(CCc4ccccc43)C2=O)ccc1[N+](=O)[O-]	732651235	ATAZEHCWVDGTIE-NRFANRHFSA-N	439.380	1.680	50	20	IDGD	
CCOCCCn1c(NNC(=O)Cc2c(C)nc(C)nc2O)nc2ccccc2c1=O	733267302	WAWFVACEUKELKR-UHFFFAOYSA-N	426.477	1.621	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc2c(c1)nc(CCC(=O)NNc1cnccn1)n2CC	734242436	GIYWRJWZWVRZGQ-UHFFFAOYSA-N	445.549	1.953	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)[C@H]2CC(=O)N(c3ccccc3)C2)CC1	734821122	GYRQODOALZIOAN-HNNXBMFYSA-N	445.520	1.769	50	20	IDGD	
O=C(NNS(=O)(=O)C[C@@H]1CCCO1)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	735645851	HUNNBRPVWKOMLL-SFHVURJKSA-N	442.501	1.132	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)[C@H]3CSc4ccccc43)cc2)CC1	735686337	QKKDDWWONPFGRT-SFHVURJKSA-N	432.571	1.955	50	20	IDGD	
Cc1ccc(C(=O)NCCNC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)cc1	743602456	QUDCNILSWRZTST-UHFFFAOYSA-N	433.490	1.164	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccccc1)NNC(=O)c1cc(Br)ccc1O	743733656	OGANEXDBBDUQST-UHFFFAOYSA-N	442.291	1.284	50	20	IDGD	
Cc1cnc2c(S(=O)(=O)N3CCN(CC(=O)NNC(=O)C(C)(C)C)CC3)cccc2c1	744386685	FKBRQFVDRSESDG-UHFFFAOYSA-N	447.561	1.043	50	20	IDGD	
O=C(CCn1c(=O)oc2cc(S(=O)(=O)N3CCCC3)ccc21)NNc1ccccc1	746022049	SIMJFAAIPNEDET-UHFFFAOYSA-N	430.486	1.912	50	20	IDGD	
O=C(NNC(=O)[C@H]1CN(Cc2nc(O)c3ccccc3n2)CCO1)c1c[nH]c2ccccc12	746101317	XLRXJNMIMWUNOD-LJQANCHMSA-N	446.467	1.479	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCCN1C(=O)c1ccc(O)nn1)c1cc(-c2ccccc2)on1	746108416	SBTDQBKIUXRTNB-MRXNPFEDSA-N	436.428	1.293	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)C1CCN(S(=O)(=O)/C=C\c2ccccc2)CC1	747323724	LSPRCKOIHHVMBO-GDNBJRDFSA-N	428.514	1.484	50	20	IDGD	
COc1ccc(-c2nn(CCC#N)cc2C(=O)NNC(=O)Cc2ccncc2)cc1[N+](=O)[O-]	747429437	NLKOTHSOOHTLAZ-UHFFFAOYSA-N	449.427	1.779	50	20	IDGD	
COc1ccc(/C=C(/C#N)C(=O)OCC(=O)Nc2ccc(C)c(S(N)(=O)=O)c2)cc1	747873182	BEHCORTWZSFAHP-DHDCSXOGSA-N	429.454	1.740	50	20	IDGD	
COc1ccc(C(=O)NNc2nccn(C)c2=O)cc1S(=O)(=O)Nc1ccc(C)cc1	747946334	ZLIYQSUECKKIHT-UHFFFAOYSA-N	443.485	1.655	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCc2ccc(O)cc2)c1	749347651	VEQKMPKMJRNTDF-UHFFFAOYSA-N	434.518	1.609	50	20	IDGD	
O=C(CNc1ccccc1)NNC(=O)c1ccc2ncc(I)n2c1	749524532	XIHXPWZNNBTFHY-UHFFFAOYSA-N	435.225	1.812	50	20	IDGD	
CCCCN1C(=O)CC[C@@H](C(=O)NNC(=O)C(=O)NC(C)C)[C@H]1c1ccccc1OC	750873383	QKKGTBFJPZJFQH-VQIMIIECSA-N	432.521	1.447	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)n[nH]2)cc1OC	751297175	HDZWCGFOCMWVMT-UHFFFAOYSA-N	448.439	1.416	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NN[C@@H](C(=O)OC)c2cccc(C#N)c2)c1	751445487	FGAAAFUXGGHSRJ-LJQANCHMSA-N	444.513	1.737	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)[C@H]1CCO[C@@H]1c1ccnn1-c1ccccc1C	753132440	YMFRDTFDWYBJQS-LPHOPBHVSA-N	427.505	1.711	50	20	IDGD	
CC(C)(C)OC(=O)Nc1nc(Cl)ccc1C=NNC(=O)N[C@H]1CCS(=O)(=O)C1	754941467	HFPQCZUVCBIBRE-NSHDSACASA-N	431.902	1.902	50	20	IDGD	
O=C(NCCN1C(=O)[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)NNC(=O)c1c(Cl)cccc1Cl	755150550	VRKDFXJVYFLMRB-TXFQPVFDSA-N	437.283	1.745	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)COc2ccc(Cl)cc2)n([C@H]2CCS(=O)(=O)C2)n1	755529091	BYNHUCAIVKCTDC-ZDUSSCGKSA-N	441.897	1.436	50	20	IDGD	
CC(=O)Nc1cc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)ccc1C	755912710	HHFRQSAMQOKICM-UHFFFAOYSA-N	433.490	1.670	50	20	IDGD	
C=CCN(C)S(=O)(=O)c1ccc(NC(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1	755932878	OLYLDLDYWFOGOP-UHFFFAOYSA-N	446.485	1.731	50	20	IDGD	
CC(C)CSCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	756754777	SMMJQNPEIAJEOQ-UHFFFAOYSA-N	428.580	1.804	50	20	IDGD	
COCCC(=NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)C(C)C	756819247	FJESFEGMFVMYRJ-UHFFFAOYSA-N	425.551	1.805	50	20	IDGD	
CCOc1cc(C(=O)N(C)C)ccc1NC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	756869324	RWADZWZHQMMIGA-SFHVURJKSA-N	428.445	1.780	50	20	IDGD	
CCN1CCN(C(=O)Cc2ccc(NC(=O)NNC(=O)Cc3ccccc3F)cc2)CC1	757580620	HWFNYGVULDNUAA-UHFFFAOYSA-N	441.507	1.928	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(C(=O)NC3CC3)cc2)cc1OC	757851372	LTMFEMHYAQALTF-UHFFFAOYSA-N	441.440	1.214	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)Nc2cnn(C3CCN(C(=O)OC(C)(C)C)CC3)c2)n[nH]1	758186825	PCJIWONZKBPVLL-UHFFFAOYSA-N	432.485	1.953	50	20	IDGD	
O=C(NC[C@H]1CN(Cc2ccccc2)CCCO1)NNC(=O)[C@H]1COc2ccccc2O1	759233496	UUNPRLZITBHTQT-GHTZIAJQSA-N	440.500	1.448	50	20	IDGD	
COCc1nc(C)c(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)s1	759659890	DKWBXPUGFGPABZ-UHFFFAOYSA-N	439.563	1.291	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)/C(=C/c2ccccc2)n2nnnc2C)n[nH]1	763150749	BCVSHHGSBSPRJM-UNOMPAQXSA-N	444.455	1.840	50	20	IDGD	
COc1cc(C(C)=NNC(=O)CNC(=O)c2cccnc2)ccc1S(=O)(=O)C(F)F	763195420	OOMITKYKPPDUMR-UHFFFAOYSA-N	440.428	1.357	50	20	IDGD	
Cc1ccc(C(N)=O)cc1NC(=O)C(=O)NNC(=O)c1cc(C)n(-c2ccccc2)c1C	763603231	XOICZXWDJQIWIQ-UHFFFAOYSA-N	433.468	1.901	50	20	IDGD	
CCN(Cc1ccccc1NC(=O)C(=O)NNC(=O)c1cccc(N(C)C)c1)C(C)=O	763760810	SYIQHKLIXPHSKJ-UHFFFAOYSA-N	425.489	1.521	50	20	IDGD	
Cc1cnc(O)n1-c1ccccc1NC(=O)C(=O)NNC(=O)COc1ccc(F)cc1	763838763	UKQIPKPZGXNQAE-UHFFFAOYSA-N	427.392	1.190	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccc(CCN2CCCC2)cc1	763843012	LEMPMZYLNKPOPG-UHFFFAOYSA-N	428.464	1.629	50	20	IDGD	
Cc1conc1NC(=O)C(=O)NNC(=O)c1nn(CCC(C)C)c(=O)c2ccccc12	763843388	QCMIQNZQQOQXNI-UHFFFAOYSA-N	426.433	1.139	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cccc(-n3cccn3)c2)cc1	763860480	HJEZKMRBTPLZDQ-OAHLLOKOSA-N	437.456	1.824	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc3nc(C)cn3c2)cc1	763861913	TWJRCLGLQYACKU-AWEZNQCLSA-N	425.445	1.595	50	20	IDGD	
Cc1ccc(Cn2nccc2NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)o1	763867563	WVMABNSKZSKMEV-CYBMUJFWSA-N	429.408	1.525	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccc(S(=O)(=O)C(F)F)cc1	763932765	RGDILDDHFKPYAX-UHFFFAOYSA-N	429.376	1.151	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)[C@H](C)n1c(C)cc(O)cc1=O	764021737	VEIATXNIVPUGIM-NSHDSACASA-N	437.836	1.090	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)Cc2ccsc2)ccc1Br	764033772	ONUXCXNHKRWZHM-UHFFFAOYSA-N	440.275	1.626	50	20	IDGD	
CN(C)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cccc(Br)c2)cc1	764058361	GFADRUDBLFTTOU-UHFFFAOYSA-N	433.262	1.551	50	20	IDGD	
CCCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)nc2)cc1	764093923	ZFRRDVWOCIVDNH-UHFFFAOYSA-N	439.881	1.286	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)C(=O)Nc1cncc(Br)c1	764203620	ANQINHYHIXJTTE-UHFFFAOYSA-N	444.286	1.235	50	20	IDGD	
Cc1ccc(-n2nc(-c3ccco3)cc2NC(=O)C(=O)NNC(=O)Cc2cc[nH]n2)cc1	764286515	WOTFHHWOTDHMSX-UHFFFAOYSA-N	433.428	1.492	50	20	IDGD	
CN1CCCN(c2ccc(NC(=O)C(=O)NNC(=O)C(C)(C)c3ccccc3)cc2)CC1	764309820	VOXAGYSMATXUBV-UHFFFAOYSA-N	437.544	1.892	50	20	IDGD	
CS(=O)(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)c2cc3ccccc3o2)c1	764340952	BATGAZJNXRNUBD-UHFFFAOYSA-N	435.845	1.889	50	20	IDGD	
COC(=O)c1cc2cc(NC(=O)C(=O)NNC(=O)COCc3ccccc3)ccc2o1	764365775	AVRBTIVYUZXSON-UHFFFAOYSA-N	425.397	1.522	50	20	IDGD	
COC(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)c1	764377308	NCEYTDISBIBTLV-UHFFFAOYSA-N	427.442	1.253	50	20	IDGD	
CC(C)COc1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)cn1	764381893	BNQJZSPWUHEJBY-UHFFFAOYSA-N	428.474	1.968	50	20	IDGD	
COCCOc1ccccc1NC(=O)C(=O)NNC(=O)c1cc(-c2cccs2)[nH]n1	764383076	VPAIUIUTPSQMFL-UHFFFAOYSA-N	429.458	1.563	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cnn(-c4ccncc4)c3)n[nH]2)cc1C	764386218	BTQUSDNWINZJMN-UHFFFAOYSA-N	444.455	1.674	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1ccccc1-c1cc(F)c(F)c(F)c1	764399303	KFIOUHIPLSESDG-NSHDSACASA-N	439.390	1.908	50	20	IDGD	
O=C(NNC(=O)[C@H]1COCCO1)C(=O)Nc1ccc(Sc2ccccc2)c(Cl)c1	764433859	OGZARIHODKNRNP-OAHLLOKOSA-N	435.889	1.993	50	20	IDGD	
COc1ccc(CNC(=S)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)cc1	764519225	OEIPNLBHRPJJGD-UHFFFAOYSA-N	441.601	1.817	50	20	IDGD	
CC(C)(C)OC(=O)N1CCO[C@H](CC(=O)NNC(=O)c2nnc(O)c3ccccc23)C1	764544202	DLQIMAGQCJTOFW-GFCCVEGCSA-N	431.449	1.122	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNS(=O)(=O)c1cncc(F)c1	765119046	LORYMPPAONBSIK-UHFFFAOYSA-N	441.916	1.001	50	20	IDGD	
Cc1nc2c(C(N)=O)cnn2c(C)c1CCC(=O)NNC(=O)CSc1ccccc1O	765248444	HZRCYPLGASXACP-UHFFFAOYSA-N	442.501	1.023	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)c3cc(S(N)(=O)=O)ccc3C)n[nH]2)c1	765581446	OYCUGUQKJSRMPT-UHFFFAOYSA-N	427.486	1.724	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)CCC(C)C)c(I)c1	765698327	OKYQTHXRSYXJDV-UHFFFAOYSA-N	433.246	1.822	50	20	IDGD	
O=C(NCc1ccc(O)c(Br)c1)NNC(=O)C1CCN(c2ncccn2)CC1	765751042	HLMAYIPYACWVHJ-UHFFFAOYSA-N	449.309	1.692	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)c3cscc3C)CC2)cc1	766635849	GZEKESRWKSFYQH-UHFFFAOYSA-N	436.559	1.132	50	20	IDGD	
C[C@@H](NC(=O)C1CCCC1)C(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	766660499	MTWAAEITMSECAR-MRXNPFEDSA-N	449.983	1.300	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)C[C@H]3C(=O)Nc4ccccc43)n[nH]2)cc1OC	768276202	IMCXCTFOOXFBPD-CQSZACIVSA-N	435.440	1.981	50	20	IDGD	
CC(C)[C@H](NC(=O)OC(C)(C)C)C(=O)NCC(=O)NNc1nc(-c2cccnc2)no1	768393795	WMWBZHKPAZACEY-AWEZNQCLSA-N	433.469	1.240	50	20	IDGD	
NS(=O)(=O)c1cccc2c(C(=O)NNC(=O)c3cccc(Br)c3)nccc12	768484979	PEMKZNHHKYIRMA-UHFFFAOYSA-N	449.286	1.720	50	20	IDGD	
O=C(NNC(=S)Nc1ccccn1)c1ccc(S(=O)(=O)NC[C@@H]2CCCO2)cc1	768581372	OWWDBCFUOQRNJM-AWEZNQCLSA-N	435.531	1.170	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)c1ccc(CCNS(C)(=O)=O)s1	768645113	MXMRLRRGXBEMCI-UHFFFAOYSA-N	447.560	1.009	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)Nc1ccc(F)cc1CS(C)(=O)=O	769243894	WIVUOCXZYQTJKU-UHFFFAOYSA-N	445.494	1.931	50	20	IDGD	
CCNc1nc(C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)cs1	769301195	FOUXDMPMHYVYTF-UHFFFAOYSA-N	436.969	1.807	50	20	IDGD	
CSC[C@@H](C(=O)NNC(=O)c1ccc2c(c1)OCCO2)N1C(=O)[C@H]2CCCC[C@H]2C1=O	770416907	DMFUDQXBLNUIAZ-ZNMIVQPWSA-N	447.513	1.126	50	20	IDGD	
CCN1CCN(c2cccc(NC(=O)C(=O)NNC(=O)COc3ccc(F)cc3)c2)CC1	770773170	FITCUBHRRMKECG-UHFFFAOYSA-N	443.479	1.133	50	20	IDGD	
CC(C)(C)OC(=O)NNC(=O)CN1C(=O)N[C@](C)(c2ccc(Br)cc2)C1=O	771211529	IODRISDNDQTWSU-QGZVFWFLSA-N	441.282	1.772	50	20	IDGD	
CCN1C(=O)c2ccc(C(=O)NNc3ccnc(Br)c3)cc2S1(=O)=O	771553303	UHRSSRPYEABMPT-UHFFFAOYSA-N	425.264	1.765	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)c1sccc1S(=O)(=O)N1CCCCC1	771914488	NCNVLMVTUFNEIZ-ZDUSSCGKSA-N	445.563	1.662	50	20	IDGD	
COc1c(C)cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1C	773163340	XUBXQCXPJVQFPH-UHFFFAOYSA-N	447.513	1.408	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)N[C@@H](C)[C@@H](OC)c1ccc(Br)cc1	774343151	HLBMWDFGNRHWQZ-YWPYICTPSA-N	432.315	1.907	50	20	IDGD	
C[C@H](NCC(=O)NNC(=O)c1ccc(C#N)cc1)c1cc(F)ccc1N1CCC(O)CC1	775355165	ADMTUXICRLPMSD-HNNXBMFYSA-N	439.491	1.770	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)NCCc3ccc(OCCN4CCCC4)cc3)nc21	775453827	GCZMMQGKJFBAFS-UHFFFAOYSA-N	440.508	1.412	50	20	IDGD	
CC(=O)[C@@H]1C[C@H](CC(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)C1(C)C	776147248	LHHBNMWYLSBMEH-CVEARBPZSA-N	437.566	1.102	50	20	IDGD	
Cc1cc(C)c(S(=O)(=O)NCCC(=O)NNc2cccc(S(C)(=O)=O)c2)c(C)c1	776541412	VIMIFELKAJBPDT-UHFFFAOYSA-N	439.559	1.827	50	20	IDGD	
COCCO[C@@H]1COCC[C@@H]1NC(=O)NNC(=O)Nc1cc(Cl)c(OC)cc1OC	776939802	RZRPDVAAIFFMDW-BLLLJJGKSA-N	446.888	1.513	50	20	IDGD	
CC(=NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1)C1CCS(=O)(=O)CC1	777442256	BXKUIKYFUJLCET-UHFFFAOYSA-N	440.997	1.775	50	20	IDGD	
C[C@@H]1C(=O)N(C)CCN1C(=O)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1	777485671	MRVUKCGKJARNOZ-UTKZUKDTSA-N	435.528	1.517	50	20	IDGD	
C[C@@H]1CN(Cc2ccc(CNC(=O)NNC(=O)CNC(=O)OC(C)(C)C)cc2)C[C@@H](C)O1	778614654	UPABKSFUQCDZEC-HZPDHXFCSA-N	449.552	1.651	50	20	IDGD	
COCC(=O)N1CCc2cc(NC(=O)C(=O)NNC(=O)CCC3CCCCC3)ccc21	778710890	RMOWPBAPDFQVNH-UHFFFAOYSA-N	430.505	1.669	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N2CCN(CC(C)(C)O)C[C@H]2C)cc1Br	780990928	VBYWDESWRQRKST-GFCCVEGCSA-N	443.342	1.589	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)c(OC)c1	782125224	YBFUILFYYDXTQX-UHFFFAOYSA-N	437.355	1.240	50	20	IDGD	
C=C(C)COc1cccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)c1	783265715	WRJYVAIOEVZEKO-UHFFFAOYSA-N	447.517	1.805	50	20	IDGD	
O=C(NNc1ccc(Cl)nn1)C(=O)Nc1ccc2nc(N3CCOCC3)sc2c1	784791808	BIUAZUBDNVTDMV-UHFFFAOYSA-N	433.881	1.658	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)F)cc1)C(=O)Nc1cnn(-c2ccncc2)c1	784835823	JKDUVCXBWZNCFX-UHFFFAOYSA-N	436.400	1.345	50	20	IDGD	
COc1cccc(NNC(=O)C(=O)Nc2ccc(C(=O)N(C)[C@H]3CCCN(C)C3)cc2)n1	784845557	BVUAOXJNPMRRST-KRWDZBQOSA-N	440.504	1.338	50	20	IDGD	
C[C@H]1[C@@H](C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)CCN1C(=O)OC(C)(C)C	786251652	OUIIZVVLBGLWFG-HOCLYGCPSA-N	432.525	1.486	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2cccc(N3CCNC3=O)c2C)cc1	787541787	DQWZMDLZPSZXBP-UHFFFAOYSA-N	439.472	1.252	50	20	IDGD	
CN1CCN(C(=O)NNC(=O)[C@@H]2CCCN2C(=O)c2ccc(Cl)c(Cl)c2)CC1	788170070	YWCNWAHRPIYZQT-HNNXBMFYSA-N	428.320	1.586	50	20	IDGD	
CCNC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)COc2ccc(OC)cc2)c1C	789731241	CBMAFGULNKKFCS-UHFFFAOYSA-N	443.460	1.310	50	20	IDGD	
CC1(c2cc(NC(=O)C(=O)NNC(=O)COc3ccccc3[N+](=O)[O-])no2)CCCC1	789732541	RLRFXEFLQPVIFI-UHFFFAOYSA-N	431.405	1.579	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC(NC(=O)NNc3nc4ccccn4n3)CC2)cc1	790134219	IKKWKYMOHJDVJE-UHFFFAOYSA-N	429.506	1.517	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2cccc(F)c2[N+](=O)[O-])cc1C(=O)N1CCOCC1	790999272	QHXDEYUNXZYBPL-UHFFFAOYSA-N	445.407	1.597	50	20	IDGD	
CC(C)NC(=O)NC1(C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)CCCCC1	792015584	DESLSEYYYYBBQQ-UHFFFAOYSA-N	428.493	1.105	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)C(=O)Nc1ccc(Cc2nnc3n2CCC3)cc1	792266684	UNLNELWHGOHFTG-UHFFFAOYSA-N	448.483	1.118	50	20	IDGD	
Cc1cc(=O)c(C(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)nn1-c1ccccc1	792554698	FOFIWVBBZOOPLG-UHFFFAOYSA-N	440.843	1.812	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)c1ncccc1Br	792776340	GPQOJWYNBJCZKY-UHFFFAOYSA-N	432.322	1.817	50	20	IDGD	
O=C(CCc1cnccn1)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	792788350	BSZZSNKAHAGOAP-UHFFFAOYSA-N	439.497	1.349	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)CCN(C)C(=O)OC(C)(C)C)c2ccccc2c1=O	794774527	HIESFCDPMQACLJ-UHFFFAOYSA-N	431.493	1.995	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)cc1	796384881	PZKLFCXICSQXOI-HSZRJFAPSA-N	435.572	1.648	50	20	IDGD	
CC(C)Oc1ccc(NC(=O)C(=O)NNC(=O)CCCc2cccs2)cc1C(N)=O	797005272	CUEPYVSETFGJFA-UHFFFAOYSA-N	432.502	1.743	50	20	IDGD	
Cc1ccc(F)c(NC(=O)C(=O)NNC(=O)CNC(=O)c2ccco2)c1Br	797072409	WAXJODSXLCVHGN-UHFFFAOYSA-N	441.213	1.006	50	20	IDGD	
COc1cc2c(cc1S(=O)(=O)NNC(=O)c1ccc3ccccc3n1)OCC(=O)N2	797428264	UOYCBQZSTYDXCB-UHFFFAOYSA-N	428.426	1.198	50	20	IDGD	
CCOc1cccc([C@@H]2C[C@H]2NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1	798111493	HSDGGRYCZSVKFH-RBUKOAKNSA-N	446.529	1.836	50	20	IDGD	
Cc1cc(O[C@H]2CCN(C)C2=O)ccc1NC(=O)C(=O)NNC(=O)CCc1ccccc1	799258931	LCXIJJYTZACTER-IBGZPJMESA-N	438.484	1.323	50	20	IDGD	
O=C(COC(=O)c1ccncc1C(F)(F)F)NNC(=O)[C@H]1COc2ccccc2O1	800239804	WGBXPICGNKPZSG-CQSZACIVSA-N	425.319	1.245	50	20	IDGD	
COc1cc2cc(C(=O)NNC(=O)C(=O)Nc3ccc(C)cc3)[nH]c2c(OC)c1OC	801106461	ANOMRMIMNMZAQU-UHFFFAOYSA-N	426.429	1.902	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)CCCC(=O)c2ccc3c(c2)OCCO3)C[C@@H](C)O1	806339921	LKVWYWCAYASHMB-IYBDPMFKSA-N	433.505	1.458	50	20	IDGD	
COc1ccc(Br)cc1C(=O)CCC(=O)NNC(=O)N1CCN(C)CC1	807378660	IBZMKVQDGLGIGG-UHFFFAOYSA-N	427.299	1.409	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)C(=O)Nc1cc(N2CCCC2=O)ccc1Cl	807428691	IMQRZYIWPQPOQY-UHFFFAOYSA-N	440.851	1.524	50	20	IDGD	
O=C(NNC(=O)N1CCC[C@H](CNS(=O)(=O)C2CC2)C1)c1cccc2ccccc12	808273687	FLSSXAXJQLCJEB-OAHLLOKOSA-N	430.530	1.988	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)N[C@@H]1CCN(C(=O)OC(C)(C)C)C2(CCC2)C1	813793830	BCHWRWDSWSRIEY-HUUCEWRRSA-N	428.530	1.691	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2snnc2C)c1	813850446	XEECXUOWOHHTGK-UHFFFAOYSA-N	426.524	1.021	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)N1CCN(c2cnccc2C#N)CC1	814325708	WJZVFRBCPHQXGL-AWEZNQCLSA-N	428.880	1.937	50	20	IDGD	
CC(C)c1cc(Br)ccc1NC(=O)C(=O)NNC(=O)[C@@H]1CCc2nncn2C1	815692184	LNYFSZAPUBVSJB-LLVKDONJSA-N	449.309	1.513	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1cccc(C(F)(F)F)n1	815752281	LWRRZROLJJRNHI-UHFFFAOYSA-N	431.396	1.433	50	20	IDGD	
CCOc1ccc(NNC(=O)C(=O)Nc2cc(C(=O)N3CCOCC3)ccc2OC)cc1	815816183	LOJWBJHLKXFDRR-UHFFFAOYSA-N	442.472	1.648	50	20	IDGD	
Cc1nnnn1/C(=C/c1ccc(F)cc1)C(=O)NNC(=O)[C@H](C)Oc1ccccc1F	818029936	RQDJIPZOHODQME-OOIIIRTPSA-N	428.399	1.873	50	20	IDGD	
COC(=O)CCc1c(C)nn(-c2ccc(C(=O)NNC(=O)N3CCN(C)CC3)cc2)c1C	819720701	FIALXEWWULQUDO-UHFFFAOYSA-N	442.520	1.197	50	20	IDGD	
CC(C)(C)C(=O)NCCCC(=O)NNC(=O)c1ccc2c(=O)n3c(nc2c1)CCCCC3	823296871	YMONMBPVRPPAPV-UHFFFAOYSA-N	441.532	1.826	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)[C@@H]2CCCN2S(=O)(=O)c2ccc(C)cc2)cc1	825589054	SCPMGPUHNNZWCP-IBGZPJMESA-N	430.530	1.716	50	20	IDGD	
O=C(NNC(=O)c1ccccc1S(=O)(=O)N1CCCCC1)c1cccc([N+](=O)[O-])c1	866703677	KHBYROALUCLERQ-UHFFFAOYSA-N	432.458	1.844	50	20	IDGD	
CSC[C@H](C(=O)NNC(=O)Cc1ccc(Cl)cc1)N1C(=O)[C@@H]2CCCC[C@H]2C1=O	913160099	NWEAXKGTTJAQPP-BZUAXINKSA-N	437.949	1.937	50	20	IDGD	
CCn1c(CCC(=O)NNC(=O)C2CCCC2)nc2cc(S(=O)(=O)N(C)C)ccc21	914842756	MHRTVSJSWKYDGI-UHFFFAOYSA-N	435.550	1.577	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@H]2CCN(Cc3ccccc3)C2)c2ccccc2c1=O	915903050	TXEDRWBHGAOROZ-KRWDZBQOSA-N	434.500	1.635	50	20	IDGD	
O=C(NCCNS(=O)(=O)c1ccccc1)NNC(=O)c1ccc(Br)s1	916294564	CNUQPSULJFPNPM-UHFFFAOYSA-N	447.336	1.433	50	20	IDGD	
CCC[C@H](C)N1C[C@H](C(=O)NNC(=O)c2nn(CCC)c(=O)c3ccccc23)CC1=O	917519036	HDZTYSTWQMYJPE-LSDHHAIUSA-N	427.505	1.605	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)CN(C)c1ncnc2[nH]cnc12	917922604	ZPSYMBPMOQPRKE-JTQLQIEISA-N	448.281	1.167	50	20	IDGD	
O=C(NCc1cccc(CN2CCOCC2)c1)NNC(=O)[C@@H]1COc2ccccc2O1	918223853	PJWGIDQCAPCSSR-FQEVSTJZSA-N	426.473	1.189	50	20	IDGD	
C=CCn1c(=O)c2ccccc2n2c(SCC(=O)NNC(=O)CC(F)(F)F)nnc12	918364213	MFMHGLMXIDBOHU-UHFFFAOYSA-N	440.407	1.422	50	20	IDGD	
Cc1cccc(-n2ccnc2SCC(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)c1C	919885182	NGJLPQBKAFTNSO-CQSZACIVSA-N	437.547	1.099	50	20	IDGD	
O=C(NNC(=O)c1cccc(OCc2cn3ccccc3n2)c1)N[C@H]1CCS(=O)(=O)C1	919889681	RFWYGVMMMJMJFN-HNNXBMFYSA-N	443.485	1.044	50	20	IDGD	
COc1cc(C(=O)NN=Cc2nc3c(c(O)nc(=O)n3C)n2C)ccc1OCCC(C)C	920366486	QQVLRZDDZJUGOW-UHFFFAOYSA-N	442.476	1.570	50	20	IDGD	
Cn1cc(S(=O)(=O)N2CCOCC2)cc1C(=O)NNc1ccc(Br)cc1	932528646	KXBZJUXPFDUDJM-UHFFFAOYSA-N	443.323	1.565	50	20	IDGD	
COc1cc(O)ccc1C=NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1	1116289131	UWGNTKSLTBTUDP-UHFFFAOYSA-N	446.529	1.166	50	20	IDGD	
COC(=O)[C@H](CS(=O)(=O)NNC(=O)c1cncn1-c1ccccc1)c1ccccc1	1257410957	GHZGWQKJJIHOPQ-QGZVFWFLSA-N	428.470	1.393	50	20	IDGD	
CC(=O)NC[C@H]1CCn2ncc(C(=O)NNc3c(F)cc(C(=O)NC4CC4)cc3F)c2C1	1320856174	RETKCPRMQZMDLM-LBPRGKRZSA-N	446.458	1.509	50	20	IDGD	
CN1C(=O)C[C@@H](C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)c2ccccc21	1322177868	HNNQJCMQMVYGEY-MRXNPFEDSA-N	444.513	1.301	50	20	IDGD	
CC(C)NC(=O)OC(C)(C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Cl)C1	1778025361	QLQRJRKSKOXPJE-PJIJBLCYSA-N	435.924	1.948	50	20	IDGD	
CN(C)c1ccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)cn1	1779763332	HJISZTHTLLYUTB-WMLDXEAASA-N	429.290	1.282	50	20	IDGD	
COc1c(Cl)ccnc1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2	1780327748	AXIJIVDQDMGBNM-PIGZYNQJSA-N	446.729	1.971	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ncc(Cl)cn1)C2)[C@H](F)Br	1780771220	WWXCYOUZXLFMFD-BFQNTYOBSA-N	449.708	1.948	50	20	IDGD	
CC(=O)N[C@H](C(=O)N1CCO[C@@]2(CCN(C(=O)[C@](C)(Cl)CCl)C2)C1)C(C)(C)C	1781225105	DKPVJJNIZFWSJV-ZMYBRWDISA-N	436.380	1.603	50	20	IDGD	
O=C(c1ccc2c(c1)OCO2)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781330472	XRWJJFZXQQHXRN-WMLDXEAASA-N	429.242	1.549	50	20	IDGD	
O=C(c1[nH]nc2ncccc12)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781330547	BIHCPUIKYBCZRL-WBMJQRKESA-N	426.246	1.092	50	20	IDGD	
C[C@@H](C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Br)C2)n1ccnn1	1781549345	AIPUBNUEEMGVPZ-VPWBDBDCSA-N	432.294	1.044	50	20	IDGD	
Cc1cc2[nH]c(C(=O)N3CC[C@]4(CN(C(=O)CCC(=O)NN(C)C)CCO4)C3)cc2s1	1782299577	SVMKWLVYBHDEAD-NRFANRHFSA-N	447.561	1.354	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CNC(=O)OC)C1	1782395965	MPOKSRXAPMMUIN-OGHNNQOOSA-N	434.331	1.030	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](CC)NC(C)=O)[C@H]2C1	1783582763	XZHPZSPLFJNTMN-QXKUPLGCSA-N	432.359	1.054	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)/C=C/c3cc(F)cc(OC)c3)C2)C1	1783695151	SJSBSHVWTMWPLE-MXHCUOCRSA-N	440.899	1.931	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@@H](C(=O)N2CC[C@]3(CN(C(=O)CCBr)CCO3)C2)C1	1783856276	IQJFKUIPNWQSDF-CLCXKQKWSA-N	445.354	1.581	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)CC(=O)Nc3ccc(F)cc3)CCO2)C1	1783880853	GCNFIWNSUNPKQZ-OXQOHEQNSA-N	441.887	1.238	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1ccc3occc3c1)CCO2	1783935143	PKQFHZKUNIGHDG-QFIPXVFZSA-N	428.489	1.249	50	20	IDGD	
COc1ccc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]3C2)c(Cl)c1	1784086541	YBISHZZCDYAJAP-IKICRFKJSA-N	445.343	1.471	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3CCCCN3C)[C@H]2C1	1784121615	WARLIKFYJBUDFE-WOYTXXSLSA-N	430.387	1.624	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](NC(C)=O)C(C)(C)C)[C@H]2C1	1784313133	SANFHXPFVNVVOW-ATIWLJMLSA-N	429.989	1.924	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc([N+](=O)[O-])c(OC)c3)C2)C1	1785182544	ILDFJBSVQHYLCI-IFXJQAMLSA-N	441.868	1.301	50	20	IDGD	
Cc1cncc(CCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Br)C[C@@H]32)c1	1785288546	BBZRYCMHKGUMDV-NBOOPKSLSA-N	442.329	1.993	50	20	IDGD	
Cc1nc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Br)C[C@@H]32)cs1	1785296571	MYEGJJMCTROVDD-NHULGOKLSA-N	434.331	1.664	50	20	IDGD	
CCOC(=O)N1CCC(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](Cl)CC)CCO3)CC1	1785373802	PZUQWITUPDWAJQ-JXFKEZNVSA-N	429.945	1.702	50	20	IDGD	
C[C@H](NC(=O)c1ccccc1)C(=O)N1CC[C@@]2(CN(C(=O)C(Cl)Cl)CCO2)C1	1785561422	KUINSQNEAKCOEQ-DJJJIMSYSA-N	428.316	1.439	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc4cn[nH]c4cn3)[C@H]2C1	1788468807	CSQTZUPGDRTMSV-GPMKHBRKSA-N	436.310	1.335	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCBr)C[C@@H]32)o1	1788606095	SSQWTFICVBYAKP-YDHLFZDLSA-N	442.310	1.616	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C/N=C/c3ccco3)[C@H]2C1	1788676652	USMFBGNDFLEKNO-PAZXJDCASA-N	440.338	1.709	50	20	IDGD	
CC(C)(C)c1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Br)C[C@@H]32)[nH]n1	1788916717	RZQRVTUEINWBJV-UHXUCMFUSA-N	445.333	1.991	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C[C@@H](N)c3cccnc3)C[C@@H]21	1791057460	DEGZDFQNHXZGDK-GWFJUFKTSA-N	439.354	1.235	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(O)cc3F)C[C@@H]21	1791060893	LIZLGDGXICOUMO-KHJVZFFJSA-N	429.286	1.908	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCCn3ccnc3C)C[C@@H]21	1791256200	HKCLIFUOISPFPP-XSLAGTTESA-N	426.945	1.205	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3ncc[nH]3)[C@H]2C1	1791478649	LAMBJNCPMXXJIH-QPSCCSFWSA-N	427.343	1.353	50	20	IDGD	
Cn1ccc2c(O)ncc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)C(C)(C)CCl)c21	1792783894	GBOCYDDJLAHWFE-YWVIFJGQSA-N	434.924	1.747	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c(cnn3C)c1)C2	1792868260	SJYANBWMBVLAJD-GMLZMKKNSA-N	449.349	1.808	50	20	IDGD	
CO[C@@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)CBr)C2)c1ccccc1	1795168613	YNSBUCQUYUQVGI-XEIOYGOASA-N	439.350	1.995	50	20	IDGD	
COC(=O)c1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Cl)c([N+](=O)[O-])c1	1796366854	JCFRBLUZIZPNTD-JLUCKKNBSA-N	443.815	1.119	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](C)c1ccccn1)C2	1796893212	RTXFRKSYXVSUKC-FPKOZTFZSA-N	436.516	1.957	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cn2ncccc2n1	1797040669	BXEZPCLBLNOLDA-TYYYEBLRSA-N	426.304	1.169	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C=N/O[C@H]1CCCCO1	1797810758	WJTRRUIFELXZEA-ZTOXMCBWSA-N	446.342	1.136	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(C)(C)F)C2	1798522299	OFPSLKWQEMAMMA-FVCICTRLSA-N	437.424	1.471	50	20	IDGD	
O=C(CCc1noc(-c2ccccc2)n1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2	1799045067	YSMXWRVHQXJLMQ-LTCOOKNTSA-N	436.871	1.793	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@](C)(Cl)CCl)C3)C1	1800968616	GUPLIAFEBYNRLB-BVWVXVDMSA-N	449.375	1.792	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(OC)ccc1Cl	1801666174	UUUCIUPXLOTOFA-LZDSYCOUSA-N	431.316	1.806	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1ccc2c(c1)CCO2	1801853995	ZNBGDGYAVPKICN-REPLKXPHSA-N	428.533	1.175	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H]2C[C@H]2C[C@@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2	1802137399	FAJFJHNLERGVGG-YOBHKWJMSA-N	445.919	1.508	50	20	IDGD	
C[C@@H](Sc1ccccn1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc(B(O)O)c1)C2	1802889995	RJKSIIIODATDBT-DQEVTTJGSA-N	439.346	1.194	50	20	IDGD	
COC(=O)c1ccc(C(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]2c2cccnc2)cn1	1803139762	VSGBOJKNVHUXIL-ZTFGCOKTSA-N	446.891	1.183	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cn3cc(F)ccc3n2)[C@@H]1c1cccnc1)[C@H](O)CCl	1803143257	XXBCSTIQQOSUGS-POZUXBRTSA-N	445.882	1.788	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCc1c[nH]c2ncccc12)c1ccc(B(O)O)cc1	1804262864	YHXLSWMVUPCTSF-ACDBMABISA-N	446.316	1.127	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)C(Cl)Cl)[C@H]1c1cccnc1)c1cccc(=O)n1O	1804951703	PGUIBYPZEYBHJA-WFASDCNBSA-N	425.272	1.604	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@H](CNC(=O)CS(C)(=O)=O)[C@@H]1c1cccnc1	1806768621	JUYTZZSEWGCKJY-QRTARXTBSA-N	436.361	1.368	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)CSC(=N)N)[C@H]1c1cccnc1	1807009780	QTJUVGZHQXSBJE-ZKYQVNSYSA-N	428.356	1.497	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)CCSC(=N)N)[C@@H]1c1cccnc1	1807127022	MQJVSSIHRXYVBJ-DZKIICNBSA-N	427.958	1.358	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)c1nccc2[nH]ccc12	1808087234	RXAGUFWPKCGXED-YJLNNSPDSA-N	427.892	1.877	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)c1nccc2nc[nH]c12	1808129929	YDBGZXFNABQETG-DHSIGJKJSA-N	428.880	1.272	50	20	IDGD	
Cc1cc(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)c[nH]1	1808774194	BQTHDJVKYBZMKB-RXVVDRJESA-N	432.289	1.031	50	20	IDGD	
C[C@H](Cn1cncn1)C(=O)N1CCC2(CCCN(C(=O)CCBr)C2)CC1	1809067442	ZTFLOYJCAYPUJK-OAHLLOKOSA-N	426.359	1.930	50	20	IDGD	
Cn1cc(F)cc1C(=O)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1	1809972618	UEUBIBJNPOTGTN-UHFFFAOYSA-N	427.285	1.003	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@H]1CCN(C(=O)CN2CCOCC2)[C@H]1c1cccnc1	1810540251	INEKGVPTVQMNCA-NQIIRXRSSA-N	434.613	1.271	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2ccc3ncnn3c2)[C@H]1c1cccnc1	1813030734	GDNQOWPENOXMLQ-IEZWGBDMSA-N	442.907	1.698	50	20	IDGD	
NC(=O)c1ncccc1C(=O)N1CC[C@H](CNC(=O)C(Cl)Cl)[C@H]1c1cccnc1	1813078654	VGBODKDKHNMUTL-IUODEOHRSA-N	436.299	1.699	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccccn2)n[nH]1	1816366480	ATIGZSXCNVWAQX-KRWDZBQOSA-N	434.460	1.423	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc(F)cn2)n[nH]1	1816590100	DFJJNIVUZQHAEZ-INIZCTEOSA-N	431.472	1.623	50	20	IDGD	
C[C@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)c3cnc(O)nc3O)sc2C1	1817090086	SXGCFJORPCJOBW-BQBZGAKWSA-N	442.295	1.354	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)C1=COCC1)CC2	1817283043	ROSRIGAJIRBVHV-OBPDLJBASA-N	442.501	1.493	50	20	IDGD	
C#CCCC(=O)N[C@H]1CCc2nc(NC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)sc2C1	1817284428	JUIRFEGRVYVDDD-XIXVAHAYSA-N	426.502	1.603	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](F)Br)CC2)c1cc(CO)on1	1821704143	OJEJVEBIPPIVHA-KSBSHMNSSA-N	433.259	1.540	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H]2CCCCN2C)[nH]n1	1822412161	KVRQBINAOPWIOV-DLBZAZTESA-N	433.557	1.259	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)CCCn2ccnc2)[nH]n1	1822416663	KGHQDCCGEUGPJQ-QGZVFWFLSA-N	444.540	1.452	50	20	IDGD	
C[C@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1)n1cccn1	1822416732	MMVGLVJZLDBCPU-GDBMZVCRSA-N	430.513	1.233	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)Cc3ccc4ncnn4c3)sc2C1	1822501239	LUAFBBICHYZOPY-CHWSQXEVSA-N	448.936	1.594	50	20	IDGD	
CCS(=O)(=O)CC(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1	1822998330	CFBQIFGUVSZPGJ-HQJQHLMTSA-N	442.332	1.180	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)[C@H](O)CCl)CC2)n1	1824180232	FGAKXGPTQTZTGC-QZTJIDSGSA-N	436.940	1.873	50	20	IDGD	
C#CCCCCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2	1826420498	GAVPLPDHWBOHET-MRXNPFEDSA-N	425.319	1.242	50	20	IDGD	
Cn1cccc1C(=O)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](F)Br)CC2	1827001705	UTQKWXPDLDIEQR-OQPBUACISA-N	443.298	1.967	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(C)o3)CCO2)C1	1831801868	WDDRJYDUELQSPT-KBXCAEBGSA-N	429.311	1.832	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@](C)(O)C(F)(F)F)CCO2	1832148603	AGOIPYYYVPDRLB-HZPDHXFCSA-N	430.851	1.021	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)CCc3cc(F)ccn3)CC2)CC1)[C@H](O)CCl	1833308607	XBKLHRGZCIDDQL-LJQANCHMSA-N	440.947	1.325	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)CCSC(=N)N)CC2)CC1	1833532155	FUFXLSIDTGFSTQ-INIZCTEOSA-N	432.034	1.982	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](COC)NC(C)=O)CC2)CC1	1833533354	BFARQIAQUGYSRF-RTBURBONSA-N	445.004	1.117	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3ccc[n+]([O-])c3)CC2)CC1	1833912542	NKDGIYHGRJBNIN-AWEZNQCLSA-N	439.354	1.289	50	20	IDGD	
Cc1nc(C)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCBr)C3)C2)s1	1834072595	NHQPOYMFGXEIRN-QGZVFWFLSA-N	446.367	1.615	50	20	IDGD	
Cc1cccc(CC(=O)N2CCOC[C@@]3(CN(C(=O)CCBr)CCO3)C2)n1	1834819396	NXWBRCUUYMJQLQ-LJQANCHMSA-N	440.338	1.174	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(CN(C(=O)C#Cc3ccccc3)CCO2)C1	1835100442	SQFHLCBNCCYYRY-QFIPXVFZSA-N	430.577	1.346	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)c3cn4ncccc4n3)CC2)CC1	1836393956	DHYHFJRTNLHOQN-QGZVFWFLSA-N	432.956	1.932	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H]3C[C@H]4CC[C@@H]3O4)CC2)CC1)[C@H](F)Br	1836414556	QPFOALGZYIDOJD-NCOADZHNSA-N	446.361	1.816	50	20	IDGD	
O=C([C@@H](O)CCl)N1CCC(OC2CCN(C(=O)[C@H]3CNc4ccccc43)CC2)CC1	1836716911	XMWQERVWOPDBBC-ICSRJNTNSA-N	435.952	1.794	50	20	IDGD	
Cc1c(C(=O)N2CCC(OC3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)nc2ccccn12	1836717424	AYEKTQRRHMBQCO-SFHVURJKSA-N	448.951	1.855	50	20	IDGD	
O=C(c1cc[nH]c2nccc1-2)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836718413	XELNEDQETBNVFA-SFHVURJKSA-N	434.924	1.726	50	20	IDGD	
C[C@@H]1C[C@@]1(C)C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1	1837920238	SHFPMHDPVNGETI-WAIKUNEKSA-N	428.338	1.025	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)c3cnc(O)[nH]3)CC2)CC1	1838479511	HLBYIFXQVWFYEQ-AWEZNQCLSA-N	443.342	1.901	50	20	IDGD	
CCc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)cn1	1839151446	RRLORGRXNFPHSF-VQTJNVASSA-N	444.359	1.950	50	20	IDGD	
Cc1nscc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2	1839151662	ZPHXZQDLFVSGKO-IRXDYDNUSA-N	436.361	1.758	50	20	IDGD	
CCOC(=O)c1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)cc1	1839445528	XQIOHFKAOSRUCB-OXJNMPFZSA-N	442.871	1.468	50	20	IDGD	
N#Cc1ccc2[nH]nc(C(=O)N3CCO[C@]4(COCCN(C(=O)[C@@H](F)Cl)C4)C3)c2c1	1839487871	JSKPARRUTUVKFM-VQIMIIECSA-N	435.843	1.039	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccccc3O)C2)C1	1840031472	RIPQQAYREIOMHA-UGSOOPFHSA-N	427.295	1.246	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)nc1	1840031595	VZQVIDPDHAFJSY-KSSFIOAISA-N	426.311	1.243	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC2(CCCN2C(=O)c2cc(=O)nc3sccn23)C1	1844625637	JZGMBKIHZAFKLR-LLVKDONJSA-N	439.335	1.747	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@H]2CN(C(=O)OC(C)(C)C)C[C@H]2O)C1	1845107821	NHINRYXFIPAQHH-QLFBSQMISA-N	429.945	1.435	50	20	IDGD	
CC(C)(C)OC(=O)N1CC=C(C(=O)N2CCCC23CN(C(=O)[C@H](O)CCl)C3)CC1	1846941977	JIUORGHGVYVLBP-OAHLLOKOSA-N	427.929	1.357	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1ccc(CS(C)(=O)=O)nc1	1847869681	TUNJOQQHLDSYNF-IKGGRYGDSA-N	427.954	1.849	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)Cc1cc(OC)c(OC)c(OC)c1	1847975792	PCXXIAABYVWCAP-JYJNAYRXSA-N	440.924	1.711	50	20	IDGD	
O=C(CCn1c(=O)oc2cc(Cl)ccc21)NNC(=O)c1nn(-c2ccccc2)cc1O	10159726	DZFHKUSTTMLXIN-UHFFFAOYSA-N	441.831	1.991	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)c2cc([N+](=O)[O-])cnc2O)cc(OCC)c1OCC	16494892	PEELEKQOHYKLTL-UHFFFAOYSA-N	434.405	1.966	50	20	IDGD	
CSc1cccc(N2C[C@@H](C(=O)NNC(=O)[C@H]3COc4ccccc4O3)CC2=O)c1	26974265	HOCSSXHDLOVVGL-SCLBCKFNSA-N	427.482	1.749	50	20	IDGD	
CCCCS(=O)(=O)N1CCC(C(=O)NNC(=O)c2cc(-c3ccccc3)n[nH]2)CC1	108059964	PUDTZMAMPOTWPV-UHFFFAOYSA-N	433.534	1.680	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)CNC(=O)c2cccs2)CC1	725873689	PSMNEJADAJDMGW-UHFFFAOYSA-N	425.511	1.208	50	20	IDGD	
COc1ccc(CCNC(=O)NNC(=O)CNC(=O)c2ccco2)cc1OC(F)F	726270029	REZHQVCVWZUSHL-UHFFFAOYSA-N	426.376	1.193	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Cc2nnc(-c3ccccc3)n2C)cc(OC)c1OC	728160015	FXQWVFXYOKODRQ-UHFFFAOYSA-N	425.445	1.512	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)COCCc3ccccc3)cc2)CC1	728215572	GPQIUFLQVUKIDX-UHFFFAOYSA-N	432.546	1.325	50	20	IDGD	
O=C(NNC(=O)c1cccc(OC(F)F)c1)NNC(=O)c1nn(-c2ccccc2)cc1O	728599391	FJKNINLRMHLOEH-UHFFFAOYSA-N	446.370	1.468	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NNC(=O)Cc1cccnc1	728941896	FKWFZDDXXYSIHA-NSHDSACASA-N	436.266	1.216	50	20	IDGD	
CC[C@H](NC(=O)NNC(=O)C(=O)Nc1ccc(C)c(C)c1)c1cccc(S(N)(=O)=O)c1	729613097	NOJSUXAXJHCLNZ-KRWDZBQOSA-N	447.517	1.371	50	20	IDGD	
COCCc1ccc(OCCCC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1	729966262	QAPGOMNYAYXTLK-UHFFFAOYSA-N	438.484	1.743	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)[C@@H](Cc1ccccc1)NC(=O)c1ccccc1	730781319	KAIMEGKLILBXFC-LJQANCHMSA-N	433.464	1.960	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)C1(S(=O)(=O)c2ccccc2)CC1	731343243	HEZDYLKVVHWKLI-UHFFFAOYSA-N	426.498	1.753	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)N1CCC[C@H](CN2CCN(c3ccccn3)CC2)C1	731849620	AQNBPZWUEKSPGK-WOJBJXKFSA-N	430.597	1.498	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2cc(Br)cc(F)c2N)n1	733018909	ZELIGDUGGPPYMA-UHFFFAOYSA-N	445.270	1.482	50	20	IDGD	
Cc1nnnn1[C@@H](Cc1cccc(F)c1)C(=O)NNC(=O)c1cnn(-c2ccccc2)c1	733110014	NGSLTZOCUCMIHY-IBGZPJMESA-N	434.435	1.551	50	20	IDGD	
CCOCCCn1c(NNC(=O)c2cnc3ccc(C)cn3c2=O)nc2ccccc2c1=O	733268058	IIPFTRTXMXPONA-UHFFFAOYSA-N	448.483	1.896	50	20	IDGD	
Cc1nn(CCCl)c(C)c1C(=O)NCc1ccc(S(=O)(=O)N2CCOCC2)cc1	733887102	YULDVLQHOBJDAJ-UHFFFAOYSA-N	440.953	1.690	50	20	IDGD	
Cc1ccn2c(=O)c(C(=O)NNc3ccccc3S(=O)(=O)NC(C)(C)C)cnc2c1	734251372	CKHJIWLRIZXTDU-UHFFFAOYSA-N	429.502	1.837	50	20	IDGD	
Cc1cc(NNC(=O)CCn2cnc3c2c(=O)n(C)c(=O)n3C)ccc1Br	734253124	LSXAXCAVYMNAJU-UHFFFAOYSA-N	435.282	1.038	50	20	IDGD	
COCCNS(=O)(=O)c1cccc(CNC(=O)NNC(=O)c2c[nH]c3ccccc23)c1	735517257	AZJMXXHGNHOEQJ-UHFFFAOYSA-N	445.501	1.237	50	20	IDGD	
CN1CCC[C@@H](CNC(=O)NNC(=O)C(=O)NC2CC2)[C@H]1c1ccc(C(F)(F)F)cc1	735587035	QQTXWSAJIKKKCL-XJKSGUPXSA-N	441.454	1.697	50	20	IDGD	
Cc1cc(NNC(=O)C2CCN(S(=O)(=O)c3ccc4c(c3)OCCO4)CC2)nc(C)n1	736717254	WYMPBVIBQNIVLW-UHFFFAOYSA-N	447.517	1.409	50	20	IDGD	
CC(=O)Nc1cc(F)c(S(=O)(=O)NNC(=O)COCc2ccccc2)cc1Cl	737757036	XVQONLHBWBJBRX-UHFFFAOYSA-N	429.857	1.964	50	20	IDGD	
C=CCn1c(=O)c2ccccc2n2c(SCC(=O)NNc3ncnc4[nH]cnc34)nnc12	740746843	RZVQPOYYEMUIQW-UHFFFAOYSA-N	448.472	1.132	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)COc1ccccc1C#N)[C@H]1CN(Cc2ccccc2)CCO1	741426168	QAUMINGSKNRUBG-LAUBAEHRSA-N	437.500	1.557	50	20	IDGD	
C[C@@H](CC(=O)NNC(=O)c1ccc2ccccc2n1)/N=C1/NS(=O)(=O)c2ccccc21	742463819	RAZLYGJIXSDYNA-ZDUSSCGKSA-N	437.481	1.513	50	20	IDGD	
CCc1ccccc1OCC(=O)NNS(=O)(=O)c1cc2oc(=O)[nH]c2cc1Cl	743249758	NDKJCOGZFXDCSW-UHFFFAOYSA-N	425.850	1.725	50	20	IDGD	
Cc1cc(N2CC[C@H](NC(=O)NNC(=O)c3c(Cl)cccc3Cl)C2=O)n(C)n1	743585205	DWBLKXBDGUJGJR-LBPRGKRZSA-N	425.276	1.785	50	20	IDGD	
Cc1noc(C(F)(F)F)c1C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	746096922	RCUFUWVRLLRKNO-UHFFFAOYSA-N	446.407	1.861	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)c1ccc(Br)nc1	746506826	NURXKFOHYJRHFV-UHFFFAOYSA-N	432.322	1.817	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccccc1	746553684	PAGNIRMXGNEGBW-SFHVURJKSA-N	441.513	1.268	50	20	IDGD	
CC(=O)NC1(c2noc(CCC(=O)NNC(=O)Cc3ccncc3)n2)CCCCCC1	747323163	LDZSVFRULWJGEA-UHFFFAOYSA-N	428.493	1.473	50	20	IDGD	
COc1ccc(/C=C/C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)cc1	748620093	PAFAJGHRISIEPQ-LFYBBSHMSA-N	430.530	1.788	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN1C1CCCC1)c1cccc(S(=O)(=O)N2CCCC2)c1	749174573	AXCYXQMXIVPXGJ-LJQANCHMSA-N	434.562	1.639	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNS(=O)(=O)c1ccc(OCC(F)(F)F)cc1	751282473	MFHOGKWGEJOLBL-UHFFFAOYSA-N	437.421	1.429	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)N[C@@H]1CCO[C@H](c2ccc(F)cc2)C1	754136958	WYRDPICPDROBJA-AEFFLSMTSA-N	425.424	1.666	50	20	IDGD	
O=C(NN=c1cc[nH]c2ccccc12)[C@H]1CN(Cc2nc(O)c3ccccc3n2)CCO1	754420169	NGDMVGQYTONQRR-HXUWFJFHSA-N	430.468	1.650	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)c2cccnc2I)cc1	754937665	KOVCKXIHNCRCIN-UHFFFAOYSA-N	439.209	1.613	50	20	IDGD	
C[C@H](NC(=O)OC(C)(C)C)[C@@H](C)C(=O)NNC(=O)c1csc(N2CCOCC2)n1	755327038	UGVXRGYEFVSFCB-NEPJUHHUSA-N	427.527	1.290	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)Nc1ccccc1C(=O)N1CCOCC1	755624254	RDLBWCCAXOMYII-UHFFFAOYSA-N	426.429	1.397	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)Nc2cccc(OC[C@@H]3CCCO3)c2)c2ccccc2c1=O	755723748	WXJDIUUEGSQKDP-INIZCTEOSA-N	437.456	1.958	50	20	IDGD	
O=C(NC[C@@H]1CSCCS1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	756063804	UTKOICOXFUSJLD-CQSZACIVSA-N	444.604	1.264	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)c3coc(S(=O)(=O)N(C)C)c3)n[nH]2)cc1	756141187	YHZRUEIRFYRGMJ-UHFFFAOYSA-N	431.474	1.557	50	20	IDGD	
CN(C)c1nnc(-c2ccc(NC(=O)NNC(=O)c3nnc(O)c4ccccc34)cc2)o1	757718931	AGFKPTWQYFGRQQ-UHFFFAOYSA-N	434.416	1.918	50	20	IDGD	
Cc1nn(-c2ccccc2)c2sc(C(=O)NNC(=O)N[C@@H]3CCCS(=O)(=O)C3)cc12	758657346	IQKRVIJHSPNPAG-CYBMUJFWSA-N	447.542	1.917	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN(C(=O)Nc2ccccc2F)C1)C(=O)Nc1ccccn1	758831904	DSYGXMSHUYSEGS-ZDUSSCGKSA-N	428.424	1.251	50	20	IDGD	
O=C(NCCCc1ccc2c(c1)OCCO2)NNC(=O)c1nn(-c2ccccc2)cc1O	758894424	LDHCPRSGTDLXSC-UHFFFAOYSA-N	437.456	1.926	50	20	IDGD	
COc1ccc(-c2nn(CCC#N)cc2/C=C(/C#N)C(=O)N(C)[C@H]2CCNC2=O)cc1OC	760103096	HTNYCEKPLDWNTL-QMJOVRGKSA-N	448.483	1.735	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H]2CCC[C@H]3OCC[C@H]23)c1	761789339	GJBLNFVETMHOEC-KZNAEPCWSA-N	438.550	1.619	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)N[C@@H]1CCCN(c2ccccc2F)C1=O	761820311	FHDXNHXHWCALTJ-OAHLLOKOSA-N	438.419	1.614	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)[C@H](Cc1ccccc1)n1nnnc1C	762408066	FSSUPSBHKIHOCC-INIZCTEOSA-N	426.502	1.714	50	20	IDGD	
Cc1nc(COc2ccc(NC(=O)C(=O)NNC(=O)c3c[nH]c4ccccc34)cc2)no1	763535697	JTMOGLLGRSBIKY-UHFFFAOYSA-N	434.412	1.838	50	20	IDGD	
CCOC(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(OC)c(OC)c2)c1	763541688	AGZYXEBJPVOUFS-UHFFFAOYSA-N	429.429	1.209	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2ccc(S(C)(=O)=O)cc2C)c1	763646842	KFCAEYABCBHKFW-UHFFFAOYSA-N	433.486	1.180	50	20	IDGD	
Cc1nc(CC(C)C)c(NC(=O)C(=O)NNC(=O)c2nnc(O)c3ccccc23)s1	763791357	QHVAGEQBXKZVHN-UHFFFAOYSA-N	428.474	1.699	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(N3CCCS3(=O)=O)cc2)cc1	763829157	BTXLKROZCIYQDF-UHFFFAOYSA-N	430.486	1.189	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccc(OCC2CCOCC2)cc1	763840724	WTCKUMKENMZTBF-UHFFFAOYSA-N	445.447	1.796	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cccc(N3CCCC3=O)c2)c1C	763850780	PWAPLOXRRLJUSM-MRXNPFEDSA-N	438.484	1.984	50	20	IDGD	
CCOC(=O)c1c(F)cccc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccccc1F	763857630	NNBYOTTVHKRYJV-LLVKDONJSA-N	435.383	1.695	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cc(CC(C)(C)C)nn2C)cc1	763860702	KXNVIVXCXGVVBN-CQSZACIVSA-N	445.520	1.961	50	20	IDGD	
CC(C)n1ncc2cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc3ccc(F)cc3)cnc21	763866386	OWWJVEMFYKPGFW-LBPRGKRZSA-N	428.424	1.705	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc(Br)s2)n(CCC#N)n1	763942210	XMPVEBPBZAFRPQ-UHFFFAOYSA-N	425.268	1.329	50	20	IDGD	
C[C@H]1COCCN1c1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)on2)cc1	764003162	AOQLOXKJTGEGNM-HNNXBMFYSA-N	449.467	1.966	50	20	IDGD	
CC[C@@H](C)C(=O)NNC(=O)C(=O)Nc1cc(Br)ccc1N1CCOCC1	764087259	ZLLAVULBBWALEW-LLVKDONJSA-N	427.299	1.418	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)CC2CCCC2)cccc1S(=O)(=O)NC(C)(C)C	764179857	WWCKLFBEOUJMPW-UHFFFAOYSA-N	438.550	1.738	50	20	IDGD	
Cc1ccc(Cn2cccc(NC(=O)C(=O)NNC(=O)c3cccc(C#N)c3)c2=O)cc1	764236454	YXKDNMAPWLMLOF-UHFFFAOYSA-N	429.436	1.476	50	20	IDGD	
Cc1nnnn1-c1cc(NC(=O)C(=O)NNC(=O)c2cccc3ncccc23)ccc1F	764260987	VXFJELBHECCSPQ-UHFFFAOYSA-N	434.391	1.058	50	20	IDGD	
COCC(=O)NNC(=O)C(=O)Nc1cccc(NC(=O)c2cccc(C(F)(F)F)c2)c1	764299782	JKXTZIJWKYJKPJ-UHFFFAOYSA-N	438.362	1.690	50	20	IDGD	
COCC(=O)NNC(=O)C(=O)Nc1ccc(OCc2ccccc2)c(Br)c1	764300230	UUBUAMVYFCVKNH-UHFFFAOYSA-N	436.262	1.760	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@@H]2COc3ccc(C)cc32)cc1	764373902	HJWODRUXMMFKCK-QGZVFWFLSA-N	432.502	1.388	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1)Nc1cccc(N2C(=O)CNC2=O)c1	765311067	OJCQGOQWGOHUGJ-UHFFFAOYSA-N	437.391	1.739	50	20	IDGD	
Cc1nn(C)c2[nH]c(=O)c(CCC(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)c(C)c12	765317032	IVRAUGCKPLJTCJ-UHFFFAOYSA-N	448.524	1.263	50	20	IDGD	
C[C@H](Cc1ccc(F)c(Br)c1)C(=O)NNC(=O)CNC(=O)c1ccco1	765381811	JOEPVWOBGMDGBM-SNVBAGLBSA-N	426.242	1.937	50	20	IDGD	
C=CCC(CC=C)C(=O)NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1	765733869	RUDCQFIUBABIHG-UHFFFAOYSA-N	434.562	1.217	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3ccc(Cn4cccn4)cc3)CC2)cc1	765748705	PFXHKEZKYNZFGX-UHFFFAOYSA-N	446.555	1.819	50	20	IDGD	
CS(=O)(=O)c1ccc(Oc2ccc(NC(=O)C(=O)NNc3cnccn3)cc2)cc1	766256889	NOOWWFOMNCFZOT-UHFFFAOYSA-N	427.442	1.754	50	20	IDGD	
COC(=O)c1nccc2c(S(=O)(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)cccc12	766307719	MZKUWVUOUIOOJB-UHFFFAOYSA-N	430.398	1.553	50	20	IDGD	
CCC(CC)N1C[C@@H](C(=O)NNC(=O)c2cc(-c3ccc(OC)c(OC)c3)[nH]n2)CC1=O	768277551	QHKMZFGWNRYRQH-AWEZNQCLSA-N	443.504	1.892	50	20	IDGD	
COc1ccc(NNC(=O)[C@@H]2CC(=O)N(c3ccc4c(c3)OCCO4)C2)c([N+](=O)[O-])c1	768332399	KXBFXRGZOIQHAN-GFCCVEGCSA-N	428.401	1.871	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)N[C@@H](C)[C@@H]2CN(C)CCO2)c2ccccc2c1=O	770435552	OELVKZUVMGVJFC-YJBOKZPZSA-N	444.536	1.250	50	20	IDGD	
CC(C)[C@H](NC(=O)c1ccccn1)C(=O)NNc1nc(O)c2cnn(C(C)(C)C)c2n1	770968571	LOQNGQSLEOTNPZ-AWEZNQCLSA-N	426.481	1.580	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)CNC(=O)c1cccc(Br)c1	771941731	ATHGQVGLVIBVFE-NSHDSACASA-N	428.283	1.304	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CN(C)[C@@H](C(N)=O)c2cccc(Br)c2)cc1	772399338	MMHKUZHWXKPFGK-QGZVFWFLSA-N	433.306	1.677	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CCC[C@H]1C(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772888876	NIQONUYYEHCROE-HUUCEWRRSA-N	438.912	1.797	50	20	IDGD	
Cc1nc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)ccc1Br	773549053	FJGKRPBBRCZICS-UHFFFAOYSA-N	443.261	1.738	50	20	IDGD	
CS(=O)(=O)N1CCN(c2ccc(NC(=O)NNc3cnc4ccccc4n3)cn2)CC1	775616606	CGZKDZJLOBTOPT-UHFFFAOYSA-N	442.505	1.255	50	20	IDGD	
COC(=O)Cn1cccc1C=NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	776188157	WGHHPGZYALRPSN-UHFFFAOYSA-N	431.924	1.582	50	20	IDGD	
CCNS(=O)(=O)c1ccccc1S(=O)(=O)NNC(=O)C12CC3CC(CC(C3)C1)C2	777597621	VNQHKURGMIUGBK-UHFFFAOYSA-N	441.575	1.511	50	20	IDGD	
C[C@@H]1CCN(S(=O)(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)C1	777906628	DCUDAQYVXUTZFW-GFCCVEGCSA-N	444.560	1.370	50	20	IDGD	
Cc1nn(CC(F)(F)F)c(C)c1[C@@H](C)C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	778227438	VSJHYHYFZYALMU-SNVBAGLBSA-N	436.398	1.603	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)c2ccccc2c1=O	778531986	QSAMVTCTRIANAQ-UHFFFAOYSA-N	433.327	1.518	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cnn([C@H](C)C3CC3)c2)cc1	778707857	QIKRBGQSSBIUDK-TZMCWYRMSA-N	427.461	1.610	50	20	IDGD	
O=C1CN(CCNC(=O)NNc2c(Cl)cc(Br)cc2Cl)CCN1	781407182	WHQWWBCPRGXKID-UHFFFAOYSA-N	425.114	1.814	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)N2CCN(Cc3nc(COC)no3)CC2)c1C	781470734	FDHZEJHUZCDRAQ-XDHOZWIPSA-N	442.520	1.532	50	20	IDGD	
O=C(NNC(=O)c1ccccc1Br)C(=O)Nc1ccc(OC2COC2)cc1	782121720	TZAIMNXYZMDLMP-UHFFFAOYSA-N	434.246	1.626	50	20	IDGD	
CCOc1cccc(NC(=O)C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)c1	782897357	NBRBZGSPKYPKPS-UHFFFAOYSA-N	433.490	1.087	50	20	IDGD	
CC(C)CCc1ccc(NC(=O)C(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1	782898013	WEWRBGLRPRPWBO-UHFFFAOYSA-N	445.545	1.968	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCN(c2nc(C)cc(C)n2)CC1	783012408	OTDXMHWBTOUDDE-UHFFFAOYSA-N	432.912	1.339	50	20	IDGD	
COc1ccc(I)c(NC(=O)C(=O)NNc2cncc(Cl)n2)c1	783258643	NCNSTVLSJAVACJ-UHFFFAOYSA-N	447.620	1.825	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccccc2C(F)(F)F)nc1	783265927	ZXOJXJBPCWKSQP-UHFFFAOYSA-N	445.423	1.869	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccco1)c1ccccc1NS(=O)(=O)c1cccs1	783525922	CWLJESHSFWKFBS-UHFFFAOYSA-N	427.485	1.765	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)C(=O)Nc1cc(Cl)cc(C(F)(F)F)c1	784004020	HAPWQIGVCQKLRA-UHFFFAOYSA-N	432.742	1.468	50	20	IDGD	
CCNC(=O)COc1ccc(NC(=O)C(=O)NNc2ccc(Br)cn2)cc1	784341428	MBQHHPQPIFPYOS-UHFFFAOYSA-N	436.266	1.441	50	20	IDGD	
CC(C)C[C@H](C(=O)OCC(=O)NNC(=O)c1cccs1)N1C(=O)[C@H]2CC=CC[C@H]2C1=O	784474084	FGCJYQTZHKVNLK-QLFBSQMISA-N	447.513	1.418	50	20	IDGD	
CN(C)C(=O)C[C@@H]1CN(C(=O)C(=O)NNc2ccc(Cl)nn2)c2ccc(Cl)cc21	784789040	DDLGWDJWELRUCN-SNVBAGLBSA-N	437.287	1.835	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1cnn(CC(F)F)c1	784833264	MMIJWVCRCLENAL-UHFFFAOYSA-N	444.464	1.307	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNc2cc(F)c(F)cc2F)c(C(=O)N(C)C)cc1OC	784892839	BJCKVRPHWXFUQB-UHFFFAOYSA-N	440.378	1.905	50	20	IDGD	
CN(C)c1nccc(NNC(=O)C(=O)Nc2ccc(C(=O)NC3CCCCC3)cc2)n1	784969804	QEUOCZFLPPKFHZ-UHFFFAOYSA-N	425.493	1.687	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)C(=O)Nc1ccc2oc(C(F)(F)F)nc2c1	785061628	ZEPSHHWKQRTGGR-UHFFFAOYSA-N	446.345	1.823	50	20	IDGD	
CCCCn1c(C)cc(/C=C(/C#N)C(=O)OCc2nc3c(=O)n(C)c(=O)n(C)c3[nH]2)c1C	785101861	FSVLOSHDNGWXOZ-YBEGLDIGSA-N	438.488	1.829	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc4c(c3)OCCO4)n[nH]2)c1	785125940	IRRFZDGNNIQKCM-UHFFFAOYSA-N	435.440	1.864	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN1c1ccccc1)c1ccc(S(=O)(=O)N2CCCC2)cc1	786654078	PZABVFUDUGXUIB-FQEVSTJZSA-N	442.541	1.901	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cc(C(=O)NNC(=O)[C@@H](C)O)ccc1Cl	786702477	FADRLHMKGQSODI-SNVBAGLBSA-N	427.866	1.291	50	20	IDGD	
CCC[C@H]1CCc2nc(NC(=O)C(=O)NNC(=O)[C@@H]3COc4ccccc4O3)sc2C1	789731593	FZBHGRDNTMYBFA-LRDDRELGSA-N	444.513	1.974	50	20	IDGD	
Cn1nc([C@H]2CCCO2)cc1NC(=O)C(=O)NNC(=O)CC12CC3CC(CC(C3)C1)C2	789733312	ZJCGNQNRNDZLLW-DCJJRUGTSA-N	429.521	1.964	50	20	IDGD	
COc1ccc(OC)c(C2=NO[C@H](C(=O)NNC(=O)Cc3nc4ccccc4n3C)C2)c1	792016979	DUVIEDLNSRVGJU-IBGZPJMESA-N	437.456	1.474	50	20	IDGD	
CC(C)(C)n1nccc1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	792390615	RMXQRTNUADURHK-UHFFFAOYSA-N	434.522	1.889	50	20	IDGD	
Cc1c(S(=O)(=O)NNC(=O)[C@H]2Cc3ccccc3CN2Cc2ccccc2)cnn1C	793385767	QTXYDYAUVXJPMY-HXUWFJFHSA-N	439.541	1.665	50	20	IDGD	
Cn1cc2c(n1)CCCC2=NNC(=O)CCCCC(=O)NN=C1CCCc2nn(C)cc21	794465341	NFLPUFIAKFIIML-UHFFFAOYSA-N	438.536	1.727	50	20	IDGD	
Cc1nn(Cc2ccccc2)c(N)c1C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C	796480891	AUHXOEBHCQTNHF-UHFFFAOYSA-N	431.497	1.291	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)C(=O)Nc2ccccc2-c2csc(C)n2)c1	797012766	UEEZOJSYOJCHDS-UHFFFAOYSA-N	438.469	1.872	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)NCc3ccc(F)cc3)cc2)n1	797369869	OMICIMXRVNMHBN-UHFFFAOYSA-N	449.442	1.859	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)Cc2ccc([S@](C)=O)cc2)c2ccccc2c1=O	797792007	JEIBMEYMSLSQBP-PMERELPUSA-N	426.498	1.719	50	20	IDGD	
COc1ccc(CS(C)(=O)=O)cc1NC(=O)C(=O)NNc1cc(F)c(F)cc1F	807014448	VVZVAJSBGUGNKI-UHFFFAOYSA-N	431.392	1.739	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN2CCC[C@@H](CNS(=O)(=O)C3CC3)C2)cc1C	808771220	WCCFZHVMLUZZGI-AWEZNQCLSA-N	442.607	1.174	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C2(S(=O)(=O)c3ccccc3)CCOCC2)c1	809146356	DWBSKXQERATGTE-UHFFFAOYSA-N	446.525	1.853	50	20	IDGD	
COCC1(CNC(=O)NNC(=O)[C@H](C)Oc2cccc(Br)c2)CCOCC1	813772202	CBVQCFACXNNQCY-ZDUSSCGKSA-N	444.326	1.990	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)C(C)(C)C)nnn1Cc1ccc(C(F)(F)F)cc1	815551293	OVCWTDGEFHSEFS-UHFFFAOYSA-N	426.399	1.786	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCc2nncn2C1)c1cccc(NC(=O)c2ccc3nc[nH]c3c2)c1	816883650	HLHXSLHGXOQRNM-HNNXBMFYSA-N	444.455	1.430	50	20	IDGD	
CCOC(=O)c1ccc(C(=O)NNC(=O)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)nc1C	819659118	SWKSBDRZGKWDGL-CQSZACIVSA-N	434.493	1.975	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2ccc3[nH]c(=O)cnc3c2)ccc1OC(C)C	821132276	NKBKTXAXEDTQKJ-UHFFFAOYSA-N	432.458	1.342	50	20	IDGD	
O=C(c1ccc(NS(=O)(=O)c2ccc3c(c2)OCCCO3)cc1)N1CC[C@@H](B(O)O)C1	864234921	ZFVVYWFYIZJWEG-OAHLLOKOSA-N	446.290	1.338	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)CN1C(=O)N[C@]2(C[C@H](C)CC(C)(C)C2)C1=O	912604618	OJBVCHMIQWJRSS-QLEMLULZSA-N	448.495	1.877	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)[C@H]2CCCN2C(=O)C(C)(C)C)cc1OC	915014239	JSVXPCMTLNXMJP-CQSZACIVSA-N	435.477	1.045	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)NCC1(N2CCOCC2)CCCCC1	915897125	WOMSEAPYFBEPRJ-UHFFFAOYSA-N	434.537	1.830	50	20	IDGD	
CC(=O)Nc1ccc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1	916250915	QSSRQXAYRQIIOG-UHFFFAOYSA-N	433.490	1.040	50	20	IDGD	
Cc1ncc2c(n1)CC[C@@H](NC(=O)NNC(=O)c1nn(C(C)C)c(=O)c3ccccc13)C2	916319420	QZLNTACMGWJJAS-OAHLLOKOSA-N	435.488	1.577	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H]2CCN3CCC[C@@H]3C2)c1	916573267	JTOOQHRIPJXYIZ-IAGOWNOFSA-N	437.566	1.288	50	20	IDGD	
CN(CC(=O)NNC(=O)c1ccc(Cl)cc1O)C(=O)c1ccc(Br)o1	918362196	NEJRFYBBFOVNAA-UHFFFAOYSA-N	430.642	1.934	50	20	IDGD	
CNS(=O)(=O)c1ccc([C@@H](C)NC(=O)NNC(=O)COc2ccc(C)c(C)c2)cc1	919778462	BZGWGBZMXAKYPT-OAHLLOKOSA-N	434.518	1.682	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCC(=NNC(=O)C(=O)Nc3ccc(C)cc3)CC2)cc1	920367738	AAELTGDEAYVOST-UHFFFAOYSA-N	444.513	1.899	50	20	IDGD	
C[C@H]1CN(Cc2csc(NC(=O)NNC(=O)c3ccc4c(c3)OCCO4)n2)C[C@@H](C)O1	920933452	ZZKUVVUZJWZNLV-BETUJISGSA-N	447.517	1.990	50	20	IDGD	
CCCNC(=O)NNC(=O)C1CCN(S(=O)(=O)c2cc([N+](=O)[O-])ccc2C)CC1	921042884	RRHAFQNSZLRPRR-UHFFFAOYSA-N	427.483	1.044	50	20	IDGD	
O=C(NCCCS(=O)(=O)c1ccccc1)NNC(=O)c1nn(-c2ccccc2)cc1O	921202533	YKSIRBLJAVDQNQ-UHFFFAOYSA-N	443.485	1.386	50	20	IDGD	
Cc1cc(COc2ccc(C(=O)NNC(=O)C(=O)NC(C)C)cc2Br)on1	921304158	JHFLANPOJZRYAC-UHFFFAOYSA-N	439.266	1.610	50	20	IDGD	
CN1CCN(Cc2cccc(CNC(=O)NNC(=O)[C@@H]3COc4ccccc4O3)c2)CC1	1318232867	MZTIBSHJTPYPJO-NRFANRHFSA-N	439.516	1.104	50	20	IDGD	
COc1c(F)cc(Br)cc1S(=O)(=O)NNC(=O)c1n[nH]c2c1CCCC2	1318327483	QSBRPXVFNYQBHR-UHFFFAOYSA-N	447.286	1.822	50	20	IDGD	
O=C(CN1CCC([C@@H]2C(=O)Nc3ccccc32)CC1)NNC(=O)c1ccc([N+](=O)[O-])cc1	1319926325	CMLDXKRVUPWLEP-FQEVSTJZSA-N	437.456	1.804	50	20	IDGD	
O=C(c1cnc(-c2ccccc2)s1)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1779750281	IJHGOUDLLFAZNK-FOIQADDNSA-N	435.933	1.853	50	20	IDGD	
CCc1cc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](Br)CC)CCO3)nn1C	1779832180	CDAQERBSEMCSDM-KBXCAEBGSA-N	427.343	1.600	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H]3C[C@H]3F)C2)C1	1781081910	RIAPJMYPLIXCCT-LJPSSGMGSA-N	433.908	1.306	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)c3cnn4ncccc34)CCO2)C1	1781227338	JKGYRXGHQSHZLU-QZTJIDSGSA-N	426.304	1.409	50	20	IDGD	
CC(C)(C)c1cc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](F)Br)C3)C2)[nH]n1	1781332365	XRTAHERTNRZMBF-GUYCJALGSA-N	431.306	1.841	50	20	IDGD	
O=C(c1ccc2nn[nH]c2c1)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1782582382	BGFSQMAUCMQSEI-XJKSGUPXSA-N	426.246	1.092	50	20	IDGD	
C[C@@H](CC(=O)N1CC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2)c1ccccc1	1783280589	OPOQXIPUIUAYOL-UUOWRZLLSA-N	436.317	1.004	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](CN)c1ccccc1)CCO2	1783341068	BDISGQQJTUTVAY-FUHIMQAGSA-N	438.366	1.732	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cnc(-c4ccccn4)nc3)CCO2)C1	1783873180	LWSFRTUBHZNKHE-KKSFZXQISA-N	445.907	1.236	50	20	IDGD	
Cc1ccc(CCC(=O)N2CCO[C@@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)s1	1783933048	BMQQRSCLAVRBAQ-OAQYLSRUSA-N	436.578	1.192	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C=C/C(=O)NCc3ccccc3)[C@H]2C1	1784055012	MNEHBJYCJQQDIN-ROVTZRPGSA-N	447.963	1.856	50	20	IDGD	
Cc1cccc(CCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]32)c1	1784912903	HUQXFBKOCIUOBH-ACRUOGEOSA-N	444.576	1.280	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCCC(F)(F)F)[C@H]2C1	1784921663	GESHBVZGHJMELB-KKUMJFAQSA-N	436.475	1.072	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(CCN(C(=O)c3ccccc3C3CC3)C2)C1	1784949259	ORBGLEDOXYTTSQ-XMMPIXPASA-N	434.301	1.001	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)Cc3cc(F)ccc3[N+](=O)[O-])C2)C1	1785533633	XTNACJLXUDYMFP-DNVCBOLYSA-N	443.859	1.360	50	20	IDGD	
COc1cc(F)ccc1CC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2	1785659922	AIUWYHWTQLQBDY-BFUOFWGJSA-N	443.313	1.990	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)C3(F)CN(C(=O)OC(C)(C)C)C3)C2)C1	1785687163	KHAODJFQRZMJHU-KUHUBIRLSA-N	447.935	1.793	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](F)Cl)CCO3)CC1	1785716633	RWUCREPKBAVGER-MGPUTAFESA-N	447.935	1.998	50	20	IDGD	
CC(C)N[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)Br)C[C@@H]21)C(C)C	1786961969	FNIUNUKAAIIZFT-JSRQGNBESA-N	432.403	1.772	50	20	IDGD	
Cn1nc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCBr)C[C@@H]32)c2c1CCC2	1788019486	OKWKNOKLWHNIOC-NOLJZWGESA-N	439.354	1.287	50	20	IDGD	
COCc1c[nH]c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Br)C[C@@H]32)c1	1789211037	WQIVABXALKYPLA-NZBPQXDJSA-N	432.290	1.445	50	20	IDGD	
CC[C@@H](C)[C@H](O)C(=O)NC1(c2ccc(NC(=O)c3cnccc3C(=O)NN)cc2)CCC1	1789519926	RIQIQJZLOJJMEL-KUHUBIRLSA-N	439.516	1.840	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cn3cc(Cl)cn3)C[C@@H]21)[C@H](F)Br	1789922748	PIFNMGCZKWXMFM-HVTMNAMFSA-N	437.697	1.207	50	20	IDGD	
CC(C)(C)OC(=O)NCCOCCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCl	1793106775	KXSSCWLDFUUIRC-FZKCQIBNSA-N	447.960	1.156	50	20	IDGD	
N#Cc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Cl)C3)c(C(F)(F)F)n1	1795994318	ANDAVJUVJKTIQM-NVVZYBJKSA-N	434.777	1.710	50	20	IDGD	
COc1ccc([C@H]2C[C@H]2C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)cc1	1796188002	STKGUSHJZVODIK-QGAVKGNSSA-N	448.328	1.431	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1nnsc1C1CC1	1796644212	BDXMVRASFMEHFS-RNJOBUHISA-N	443.367	1.792	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCN1CCCCC1)C2	1796889827	KTXPPPIBBWBPHQ-PNFLAOTCSA-N	442.564	1.635	50	20	IDGD	
CC(=O)OC[C@H](OC(C)=O)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](C)CBr)C2	1798470255	MUUMVIYZRROBAD-IRHMCKRBSA-N	447.326	1.150	50	20	IDGD	
Cc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)/C(C#N)=C/c2ccc(F)cc2F)C3)n[nH]1	1798651228	CPMRTNDVTFRLFL-AHHPBITISA-N	441.438	1.807	50	20	IDGD	
COc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)Br)C3)cc1OC	1798895390	OQQLNDVDUCGNSM-DPYKFYPSSA-N	441.322	1.690	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccn3ccnc13)C2	1799277265	VJEBYXOZPSFUSN-QPWUGHHJSA-N	425.316	1.774	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccn3cncc13)C2)[C@@H](F)Br	1799349509	HPBGHJKFUGZSPU-BAESOJJISA-N	425.258	1.228	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(Cl)cnc1OC)C2	1800974239	RUMHAYAJSNDASB-BAESOJJISA-N	432.304	1.201	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3cc(O)ccc3n1)C2	1800978042	KCBSUVIFSFLLSA-QHHYFVSCSA-N	433.892	1.397	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1(c3ccccc3)CCC1)C2	1801012107	DJKAPNIKWPCFFL-OPMZPASUSA-N	442.560	1.071	50	20	IDGD	
C[C@H](Sc1ccccn1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2	1801318145	FOAKQAIQSKFKQK-QIRZIZBZSA-N	446.342	1.842	50	20	IDGD	
CC[C@@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCNC(=O)c1ccc[nH]1)C2	1801798961	LTKYTKXKORJAIZ-LXTVHRRPSA-N	439.354	1.946	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)c1cc(Cl)c(Cl)cc1F	1801862254	DVAKZTPWUVEUGY-WUEYEGCSSA-N	439.698	1.935	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CC1CN(C(=O)OC(C)(C)C)C1	1802062115	PTFRANUOFSAYSR-KYHPRHEASA-N	443.972	1.850	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](C)NC(=O)c1ccc(F)cc1)C2	1802284050	VZDKDKUIBLBFAR-LKIBZCMFSA-N	439.915	1.836	50	20	IDGD	
COc1ccc([C@H](C)C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CCC(=O)NN(C)C)cc1	1802334097	INJOBGVSYKVOLK-KANFNMMFSA-N	430.549	1.810	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCC(=O)NN(C)C	1802337534	YWERXTHCHQBPRG-MUJYYYPQSA-N	436.940	1.973	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](C)n1cc(C)cn1	1802925313	XISGBTWHSMUBJZ-VEVDZHASSA-N	439.520	1.525	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@H]1CCN(C(=O)c2c[nH]c(=O)cn2)[C@H]1c1cccnc1	1803016465	XZBINXUKUVQCMX-MRRJBJDNSA-N	448.321	1.516	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC2(CCCN(C(=O)C3(c4ccccc4)CC3)C2)CC1	1804896745	IQWHXNQVNBXOMK-UHFFFAOYSA-N	446.356	1.943	50	20	IDGD	
O=C(CC(=O)N1CCC2(CCCN(C(=O)[C@H](O)CCl)C2)CC1)Nc1ccc(F)cc1	1805525568	ZAHNWCVMYCYFKG-QGZVFWFLSA-N	439.915	1.985	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H]2C[C@]2(F)Cl)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807367045	JLTAJVOFFPJZMG-DZKDUJFISA-N	445.687	1.006	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)c2cnoc2)[C@H]1c1cccnc1	1808417585	NCNCMAMXIFCSAN-VQMZYRHSSA-N	449.471	1.523	50	20	IDGD	
Cn1nc(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)c2c1CCC2	1809359666	HPBOGRDUJPMBNK-FNHZYXHNSA-N	431.924	1.223	50	20	IDGD	
Cc1ccc(CCC(=O)N2CCC3(CCCN(C(=O)c4ccc(B(O)O)cc4)C3)CC2)nc1	1809968806	FTPGWUWWPWTQDZ-UHFFFAOYSA-N	449.360	1.547	50	20	IDGD	
O=C(CSC1CCCC1)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1	1809978136	VPLIMFLEFUGKQL-UHFFFAOYSA-N	444.406	1.887	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)no1	1810297829	FFJYFQDGIFJHJW-HNAYVOBHSA-N	449.471	1.010	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2n[nH]cc2[N+](=O)[O-])[C@@H]1c1cccnc1)C(Cl)Cl	1813079239	WPIUCLMMNZOUNW-GXFFZTMASA-N	427.248	1.836	50	20	IDGD	
O=C1C[C@H](C(=O)NC[C@H]2CCN(C(=O)CCBr)[C@@H]2c2cccnc2)CCN1	1813133735	OAOWDRSXEJJGBC-DDUZABMNSA-N	437.338	1.399	50	20	IDGD	
C[C@H](C(=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@H]1c1cccnc1)n1cncn1	1813402224	ONYZJQJAWSVIBP-UQOMUDLDSA-N	439.289	1.631	50	20	IDGD	
O=C(CCC(F)(F)F)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1	1815339408	DTGJOJFGJBIZQA-LBPRGKRZSA-N	441.240	1.391	50	20	IDGD	
Cc1cccc(CC(=O)N[C@@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)c1	1815355114	NFNMHKGZZVTPMU-GOSISDBHSA-N	449.341	1.600	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1cnoc1C1CC1	1816655603	FSHFLFLVLRRJCI-SFHVURJKSA-N	449.276	1.575	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)C1CC(=O)C1)CC2	1817284818	PATVVKHKIXBGDQ-LUKCILAXSA-N	442.501	1.168	50	20	IDGD	
CC[C@@H](NC(N)=O)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCBr)[nH]n1	1817991104	XFKHJVGUGAQCDZ-ZYHUDNBSSA-N	429.319	1.634	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](O)CCl)CC2	1818081067	JOCWVQLOOYRZED-AAEUAGOBSA-N	433.921	1.925	50	20	IDGD	
N#Cc1ccc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2ccc(B(O)O)cc2)CC3)cc1	1822162953	GIRUUZRWKHQNBD-QGZVFWFLSA-N	446.297	1.234	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](Cl)COC)CC2	1824613354	VZDKUWYPYSWVMS-OUAUKWLOSA-N	433.914	1.871	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](Br)CC)sc2C1	1825445890	LDYNCKRXGDDCDL-GMTAPVOTSA-N	443.367	1.919	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H]1C[C@]1(F)Cl)CC2	1826090133	WPQYIODXFCNAKP-GPHJXTMHSA-N	431.921	1.353	50	20	IDGD	
O=C(C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1)c1ccccc1	1827054535	FIUYYAXSBBCTHR-JOCHJYFZSA-N	448.328	1.483	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H]3[C@H]4COC[C@H]43)sc2C1	1827377654	FJSZMKCKAVDFTM-YBRCUDMCSA-N	428.352	1.979	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cnc(O)nc2O)CC1	1827592351	SWRFMMIFAPVQLX-FZMZJTMJSA-N	441.326	1.905	50	20	IDGD	
O=C(N[C@@H]1CCc2nc(NC(=O)[C@@H]3CCCSC3)sc2C1)c1cccc(B(O)O)c1	1828152301	FYGRTEHRBZZFBW-UKRRQHHQSA-N	445.375	1.192	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)CN)CCN2C(=O)OCc2ccccc2)C1	1828961652	UWZAYNUFUCPYAX-LAUBAEHRSA-N	436.940	1.415	50	20	IDGD	
O=C([C@@H](F)Cl)N1CCC([C@@H]2CCCCN2C(=O)c2cc(=O)nc3cccnn23)CC1	1829620906	WTUHZEBCFJDGCB-KBXCAEBGSA-N	435.887	1.857	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc([N+](=O)[O-])[nH]3)C2)C1	1831653706	CWYVAORDUMWZSM-FZKQIMNGSA-N	428.873	1.400	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccn(C(C)C)n3)C2)C1	1831653855	FXBCNLCQFKRXFI-JXFKEZNVSA-N	426.945	1.942	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4ccnn4c3)C2)C1	1831654035	PNKKQIQJTMTVML-WIYYLYMNSA-N	434.924	1.812	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCS(C)(=O)=O)CC1	1831656059	DQZFQHATDCAOIM-DZGCQCFKSA-N	437.400	1.824	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)C3CCC(CO)CC3)CCO2)C1	1832513780	AVCILKIBCFMFJA-YMPMHWPESA-N	430.973	1.649	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3c[nH]c(C(C)(C)C)c3)CCO2)C1	1833382493	BFKXTCPELVYDKG-IERDGZPVSA-N	441.956	1.636	50	20	IDGD	
Cn1ccc(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](F)Br)CC3)CC2)n1	1834218381	VQSIUPJSPUYLQI-OAHLLOKOSA-N	430.322	1.296	50	20	IDGD	
C=CCC(CC=C)C(=O)N1CCOC[C@]2(CN(C(=O)CCBr)CCO2)C1	1834818730	CYSKOJQDGIGWAG-IBGZPJMESA-N	429.355	1.996	50	20	IDGD	
Cc1nc[nH]c1C(=O)NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1835194073	PQCXJPHUZGTHMS-OAHLLOKOSA-N	430.322	1.594	50	20	IDGD	
C[C@@H]1CCc2c(C(=O)NC3CCN(C4CCN(C(=O)[C@@H](O)CCl)CC4)CC3)n[nH]c21	1835358961	FRPKEFGMCAOUOW-DYVFJYSZSA-N	437.972	1.244	50	20	IDGD	
O=C(c1csc2c1CCCO2)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1836388925	LDANVQHDZWZVSJ-KBXCAEBGSA-N	432.901	1.678	50	20	IDGD	
Cc1n[nH]c(C)c1CC(=O)NC1CCN(C2CCN(C(=O)CO[Si](C)(C)C)CC2)CC1	1836424932	AHXPVKHVGLXKNQ-UHFFFAOYSA-N	449.672	1.992	50	20	IDGD	
Cn1ncc2cc(C(=O)N3CCC(OC4CCN(C(=O)[C@H](O)CCl)CC4)CC3)ccc21	1836717376	VPCFPDJZSADJLS-HXUWFJFHSA-N	448.951	1.785	50	20	IDGD	
Cc1ncc(CC(=O)N2CCC(OC3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)s1	1836720229	LSNJOAULLFIJAJ-KRWDZBQOSA-N	429.970	1.592	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc4c(c3)CC(=O)N4)CCO2)C1	1836784152	HGIJNAZZUXTSPG-VGSWGCGISA-N	449.935	1.659	50	20	IDGD	
C[C@H](Sc1cccs1)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1	1837226694	JCDSQMVRDNHWKQ-PMUMKWKESA-N	448.994	1.285	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3c(C)noc3N)CC2)CC1	1837861106	WTVJCKRQOTYLBN-OAHLLOKOSA-N	428.917	1.431	50	20	IDGD	
COC(=O)NCC(=O)N1CCC(OC2CCN(C(=O)[C@@](C)(Cl)CCl)CC2)CC1	1838638474	YLTIUOFPECQSJK-SFHVURJKSA-N	438.352	1.577	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)[C@H]3CNC(=O)C3)CC2)CC1	1838754004	FJOGCGDCHLZQJP-CZUORRHYSA-N	444.370	1.295	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc4ccc(F)cn34)C2)C1	1839147890	FZDFZQVPIHFWBZ-QRWLVFNGSA-N	438.887	1.561	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(C)c4n[nH]cc4c3)C2)C1	1839148223	RMUCDGOHGQWFGC-UWJYYQICSA-N	434.924	1.959	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(F)nc3)C2)C1	1839153910	VTAUNVSHIFEDHT-MSOLQXFVSA-N	434.295	1.527	50	20	IDGD	
O=C([C@H](F)Br)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CCC(F)(F)C3)C2)C1	1839196959	AHTFXENMEPYGEO-XUJVJEKNSA-N	443.260	1.569	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccnc3C)C2)C1	1839963564	OHLNHEKYSHWFTR-LPHOPBHVSA-N	440.338	1.634	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(C=O)s3)C2)C1	1840032473	ZFJIRHNWWZMILD-SJKOYZFVSA-N	445.335	1.414	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(C=O)s3)C2)C1	1840032474	ZFJIRHNWWZMILD-YVEFUNNKSA-N	445.335	1.414	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccc(Cl)cc3)C2)C1	1840151564	FWSMWWCXYXEIDT-YLJYHZDGSA-N	445.343	1.593	50	20	IDGD	
O=C(c1cccc2c1CCCC2)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1	1840719609	CUDRQTHCXQJNAG-UGKGYDQZSA-N	436.936	1.235	50	20	IDGD	
COc1ccc([C@H](O)C(=O)N2CCCC23CN(C(=O)[C@@H](C)CBr)C3)cc1	1841181743	NHPOUYHNCLKLNK-BBRMVZONSA-N	425.323	1.963	50	20	IDGD	
O=C1NC[C@@H](C(=O)N2CCCC23CN(C(=O)[C@H](Br)Cc2ccccc2)C3)O1	1841649984	CVKGQHLDOAOTCM-CABCVRRESA-N	436.306	1.304	50	20	IDGD	
Cn1cc(CC(=O)N2CC3(CCCN3C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)cn1	1841925355	NNVXQHSIVVOCFG-HNNXBMFYSA-N	439.944	1.298	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)c2ccc[n+]([O-])c2)C1	1842146502	NBVFHOFMMXWHKR-UHFFFAOYSA-N	440.412	1.284	50	20	IDGD	
CC(C)(C)OC(=O)N1CCCO[C@@H](C(=O)N2CC3(CCCN3C(=O)[C@H](F)Cl)C2)C1	1843363954	JSLHMPNFEKAIPP-KGLIPLIRSA-N	433.908	1.750	50	20	IDGD	
C[C@H](Br)C(=O)N1CC2(CCCN2C(=O)Cn2c(=O)n(C)c3ccccc32)C1	1843860902	ZVIJXOWMFKFQJZ-ZDUSSCGKSA-N	435.322	1.327	50	20	IDGD	
O=C([C@H](F)Br)N1CC2(CCCN2C(=O)c2cc(Cl)c3nncn3c2)C1	1844226635	HGISEZQNJRPCTQ-NSHDSACASA-N	430.665	1.890	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC2(CCCN2C(=O)/C=C/C(=O)NCc2ccco2)C1	1844343156	ANDWRRYQMBENNT-GJBLVYBDSA-N	438.322	1.686	50	20	IDGD	
CC(C)n1nc(C(=O)N2CC3(CCCN3C(=O)[C@H](F)Br)C2)cc1C(=O)O	1845216816	MSUHEWOQQXISIJ-LBPRGKRZSA-N	431.262	1.670	50	20	IDGD	
O=C([C@@H](O)CCl)N1CC2(CCCN2C(=O)c2cn3ccc(C(F)(F)F)cc3n2)C1	1845574511	DLBWRZJHDIMPCL-ZDUSSCGKSA-N	430.814	1.770	50	20	IDGD	
C#CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)[C@H](F)Br)C2	1847071984	SBNJACREHGIGEF-OLZOCXBDSA-N	446.317	1.797	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H]1C[C@@H]1c1ccc(F)cc1	1847457908	UVIXBRRPTBOUKV-UMGGQSCQSA-N	437.475	1.443	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1ccc2c(n1)NC(=O)CC2	1847498008	AJBNSFMWAAIVIG-CQDKDKBSSA-N	435.322	1.813	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1nc2ccccc2n(C)c1=O	1847501921	ZUAHDQYZBGPRHQ-RCBQFDQVSA-N	447.333	1.780	50	20	IDGD	
C[C@@H](C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)n1ccnn1	1848098453	CINDYCOVJFPRSX-AJNGGQMLSA-N	440.932	1.173	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N1CCN(c2ncccn2)CC1	10610174	AIZQTVXYMCXTEV-ZDUSSCGKSA-N	449.309	1.569	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2c(C)nc3ccccn23)cc(Cl)c1OCC(N)=O	12778636	OPFLMPUEHUXKJC-UHFFFAOYSA-N	431.836	1.244	50	20	IDGD	
NC(=O)c1ccc(SCC(=O)NNC(=O)c2cc(Br)c[nH]2)c([N+](=O)[O-])c1	28717743	RZRKOHYPWYDVPB-UHFFFAOYSA-N	442.251	1.338	50	20	IDGD	
O=C(NNC(=O)C1(c2ccc(Br)cc2)CC1)c1ccc(-n2cnnn2)cc1	71834291	IRZHFAINNWZTCD-UHFFFAOYSA-N	427.262	1.918	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)CCOC)cc2)cc1OC	109987774	KLAPFHPGMOBXAO-UHFFFAOYSA-N	436.486	1.589	50	20	IDGD	
COc1cc(CN(C)C(=O)NNC(=O)CNC(=O)c2ccco2)ccc1OC(F)F	725872326	NCSCKGKZNKFCIJ-UHFFFAOYSA-N	426.376	1.492	50	20	IDGD	
NS(=O)(=O)c1ccc(CNC(=S)NNC(=O)c2cc(-c3ccccc3)on2)cc1	726449101	AZXCYKKCRGVTPD-UHFFFAOYSA-N	431.499	1.298	50	20	IDGD	
CC[C@@H](Cc1ccccc1)NC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1	727943448	FFZVSFGESXBESW-SFHVURJKSA-N	432.546	1.967	50	20	IDGD	
COc1ccc([N+](=O)[O-])cc1C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	728214065	WQXGOCJSHWJEBZ-UHFFFAOYSA-N	449.489	1.296	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)CSCc3ccccn3)cc2)CC1	728214603	BRGHNZNZNAQSCR-UHFFFAOYSA-N	435.575	1.394	50	20	IDGD	
O=C(COC(=O)c1ccc(F)c(C(F)(F)F)c1)NNC(=O)[C@H]1COc2ccccc2O1	728332958	NXJXWYBEESKDST-OAHLLOKOSA-N	442.321	1.989	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)[C@H]1CS[C@H](Cc2ccccc2F)C(=O)N1	729450929	AZQHHWDVNJYXIM-IEBWSBKVSA-N	440.500	1.771	50	20	IDGD	
N#CCn1c(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc2ccccc21	729769854	WRRJZQYCOYJVJP-IBGZPJMESA-N	434.408	1.309	50	20	IDGD	
O=C(NNC(=O)[C@@H]1C[C@@H](O)CN1C(=O)OCc1ccccc1)c1cccc2ncccc12	730287351	RCBCXGZUQFVFHW-UZLBHIALSA-N	434.452	1.768	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)NCCS(=O)(=O)N3CCSCC3)cc2C1	730577863	CWKZZKOORNGJNV-GFCCVEGCSA-N	446.620	1.196	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NCCc2c(C)noc2C)c2ccccc2c1=O	730677487	NNMUAONNVDVBSB-UHFFFAOYSA-N	426.477	1.988	50	20	IDGD	
CC(C)(C(=O)NNC(=O)CN1C(=O)N[C@@](C)(c2ccc(F)cc2)C1=O)c1ccccc1	731173357	NQOWEIRRNWZEOJ-QFIPXVFZSA-N	426.448	1.718	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)CCn2c(S)nnc2-c2cccs2)C[C@H](C)O1	732261377	MPVJUGWMZALCGD-STQMWFEESA-N	438.579	1.332	50	20	IDGD	
Cc1ccc(C)n1-c1ccc(C(=O)NNC(=O)NCCN/C(O)=C2/N=CC=CC2=O)cc1	732466654	QHRKOZYLTBUVAG-VZCXRCSSSA-N	436.472	1.565	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)N[C@H]2CCN(c3ccccc3C(N)=O)C2)cc1	732594720	HOKIFKHATKRXPT-HNNXBMFYSA-N	427.530	1.795	50	20	IDGD	
O=C(/C=C\C1CCOCC1)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	732653885	NSGQJFOHVDJDPY-KTKRTIGZSA-N	443.525	1.909	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(C(=O)NNC(=O)NCc2ccc(Cl)cc2)ccc1F	733003550	SSEPEFYBNLDTGT-UHFFFAOYSA-N	428.873	1.874	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccccc2NC(=O)OC)c1	733123234	CGWAAJCSGZODBH-UHFFFAOYSA-N	448.501	1.970	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)NC[C@]2(C)CCOC2)cc1	733181120	QWRUJUZLCIRDIB-LYQKSFCXSA-N	437.500	1.884	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)c1ccc(I)cc1	734239978	GPXVXGLLWPRQMG-UHFFFAOYSA-N	448.261	1.760	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2ccc(OC(F)F)cc2)CC1	735117500	VAWOVFWTMWKRSY-UHFFFAOYSA-N	441.460	1.376	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)CCc2ccc(Cl)cc2)CC1	735117597	YWFPYDLPDAZHBH-UHFFFAOYSA-N	437.953	1.747	50	20	IDGD	
Cc1cc(F)ccc1S(=O)(=O)Nc1ccccc1C(=O)NNC(=O)c1cnn(C)c1	735471468	ZDIJJGFVNQKSKE-UHFFFAOYSA-N	431.449	1.743	50	20	IDGD	
O=C(NNC(=S)Nc1ccc(OC(F)F)c(Cl)c1)N[C@H]1CCS(=O)(=O)C1	735622747	FLARDTKABFJGMI-QMMMGPOBSA-N	428.870	1.629	50	20	IDGD	
O=C(NCCCc1ccc(O)cc1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	735760800	DNQGXHQBLVVSFN-UHFFFAOYSA-N	446.529	1.754	50	20	IDGD	
O=C(COCc1ccccc1)NNS(=O)(=O)c1ccc(C(=O)NCC(F)(F)F)cc1	737755318	ALUDJVSTBIJROF-UHFFFAOYSA-N	445.419	1.505	50	20	IDGD	
Cc1cc(CNC(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)n[nH]1	739020082	JPHCXSIWRLPPDY-UHFFFAOYSA-N	434.503	1.725	50	20	IDGD	
CCC(C)(C)C1CCC2(CC1)NC(=O)N(CC(=O)NNc1ccnc(N(C)C)n1)C2=O	740118972	YYBQCWARNFSTDN-UHFFFAOYSA-N	431.541	1.903	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)c1ccc(C[C@H]2CC(=O)NC2=O)cc1	741144197	KHDCKUYVMVYHQC-INIZCTEOSA-N	425.441	1.131	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)[C@@H]2CCCCN2C(=O)c2ccc(O)nn2)c1C	741740644	CTEWGEJNEWTIJV-WBVHZDCISA-N	441.488	1.409	50	20	IDGD	
NC(=O)[C@@H]1CC(C(=O)NNC(=O)c2cccc(Br)c2)=NN1c1ccc(F)cc1	742773105	MYHRJCWYEILGMF-HNNXBMFYSA-N	448.252	1.469	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)NC[C@H]2CN3CCC[C@H]3CO2)cc1Cl	743593963	KHQBUWWMOZLLAJ-RYUDHWBXSA-N	427.889	1.556	50	20	IDGD	
CCCN(C(=O)[C@H](C)OC(=O)/C(C#N)=C\c1cc(C#N)n(C)c1C)[C@H]1CCS(=O)(=O)C1	744630945	CETAGCFGYOXCKA-ADFYMVDPSA-N	446.529	1.470	50	20	IDGD	
CC(C)S(=O)(=O)c1ccccc1C(=O)OCC(=O)NNC(=O)c1cccc(C#N)c1	744734088	ONQCLBMWIZYSGD-UHFFFAOYSA-N	429.454	1.358	50	20	IDGD	
Cc1ccc(CN2C(=O)CC[C@H]2C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)cc1	745591608	HZUOPUDKTGWCDK-IBGZPJMESA-N	434.452	1.362	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H]2CC[C@@H](SC)C2)c1	745893772	GMOJFOWABGHLIO-HUUCEWRRSA-N	428.580	1.945	50	20	IDGD	
CN(C)[C@@H](C(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)c1c(F)cccc1Cl	746096955	SMXWUOJRIDXKLF-QGZVFWFLSA-N	431.855	1.790	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)N[C@H]2CCCN(CC(F)(F)F)C2=O)cc1C	746339611	QBHNWKIBABQHKS-ZDUSSCGKSA-N	429.399	1.126	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)Cn2c(=O)n(CC)c(=O)c3ccccc32)o1	746392562	OQOVZAYPTDJHDK-UHFFFAOYSA-N	441.488	1.079	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(C(=O)NNC(=O)Cc2cn3ccccc3n2)cc1	746547809	QAQLNPZAWIFGIC-UHFFFAOYSA-N	429.502	1.369	50	20	IDGD	
O=C(CCC(=O)N1CCN(c2ncccn2)CC1)NNc1ccccc1Br	748065823	FBZCQYFDJPDLJQ-UHFFFAOYSA-N	433.310	1.811	50	20	IDGD	
O=C(COCC(=O)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1)NCc1cccnc1	748523033	LUGHFZPSXZENMT-UHFFFAOYSA-N	446.407	1.151	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCCN(C)Cc2ccc(F)cc2)c2ccccc2c1=O	748977597	ROQQJBLHAWYTQS-UHFFFAOYSA-N	440.479	1.632	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)c2ccc(Br)c(S(C)(=O)=O)c2)c1	749112840	FSNTWCPEUSMTGS-UHFFFAOYSA-N	440.319	1.993	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCCc2nnc(-c3ccccc3)o2)cc(OC)c1OC	749201733	ARZQCDBPLIXARA-UHFFFAOYSA-N	441.444	1.949	50	20	IDGD	
C[C@@H](O)c1ccc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1	749348727	SSKCLRXIMLCPMM-OAHLLOKOSA-N	446.529	1.669	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(/C#N)C(=O)N2CCN(CCn3cncn3)CC2)c1C	749397993	XGHCLGRQHDCUAN-UMUMUWHJSA-N	425.537	1.655	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)CNS(=O)(=O)c2ccc(Cl)s2)c2ccccc21	749838269	MMLGNCJGHBVYGL-UHFFFAOYSA-N	426.907	1.633	50	20	IDGD	
O=C(COC(=O)C[C@H](O)c1ccc(Cl)cc1)NNC(=O)[C@@H]1COc2ccccc2O1	750368915	CJZVQYJNQGTSDC-YOEHRIQHSA-N	434.832	1.294	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)c2c[nH]nc2-c2ccc3c(c2)OCO3)cc1	752150093	HLBHLQQPDBWYGL-UHFFFAOYSA-N	433.380	1.295	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1	752237691	CCXAXBZNQWHROT-INIZCTEOSA-N	447.473	1.303	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)[C@@H]1CC(=O)N(CCOc2ccccc2Cl)C1	752286511	ONGGJLDFSHTCMN-MRXNPFEDSA-N	445.903	1.966	50	20	IDGD	
COC(=O)c1cc(NC(=O)NNC(=O)COc2ccccc2OC)c(C)c([N+](=O)[O-])c1	753140268	QGZHUTOQVMUMTE-UHFFFAOYSA-N	432.389	1.930	50	20	IDGD	
CC(C)(C)OC(=O)NC1(CNC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])CCC1	753333715	DLXBKVVLVSEVQN-UHFFFAOYSA-N	437.453	1.751	50	20	IDGD	
CC(=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O)c1cc(Cl)c(N)c(Cl)c1	754714484	TYXXMNBXPLDMLK-UHFFFAOYSA-N	431.305	1.001	50	20	IDGD	
C#CCOCCC(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2Cl)c1	755380675	CZGFONKXSKUMOT-UHFFFAOYSA-N	435.889	1.942	50	20	IDGD	
COC(=O)c1cccc(NC(=O)C(=O)NNC(=O)Cc2ccsc2)c1Br	756155215	MRJNMQWOENAJSQ-UHFFFAOYSA-N	440.275	1.626	50	20	IDGD	
CO[C@H](C)C(=O)Nc1cccc(NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c1	756230423	WSCLSRYKXFOQRD-GFCCVEGCSA-N	434.474	1.530	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)Nc1ccccc1OCC(=O)N1CCOCC1	756872252	CTZMFVLWXVDTSF-UHFFFAOYSA-N	446.435	1.295	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)Nc2ccc3c(c2)S(=O)(=O)CC3)cc1	757707918	CMMMPMYZPKRMCG-CYBMUJFWSA-N	431.470	1.839	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccon2)c1	757850378	BOQFXDLVEIXKHH-UHFFFAOYSA-N	431.430	1.951	50	20	IDGD	
CCS(=O)(=O)NCC(=O)NNC(=O)c1ccc(COc2ccc(Cl)c(C)c2)cc1	758058268	KJNYPHBAEHTSSR-UHFFFAOYSA-N	439.921	1.928	50	20	IDGD	
O=C([C@@H]1CCN(c2ccc(F)cc2)C1=O)N1CCN(S(=O)(=O)CBr)CC1	758534062	APPOHXYDOQCGDD-AWEZNQCLSA-N	448.314	1.005	50	20	IDGD	
O=C(NNC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1)C(=O)Nc1ccccn1	758827176	IKHFQPDTYVWSPD-UHFFFAOYSA-N	427.424	1.729	50	20	IDGD	
O=C(NNC(=O)N1CCN(c2nc(F)c(F)cc2F)CC1)c1cc(Br)c[nH]1	758851180	BCEYSTBZKMGZTI-UHFFFAOYSA-N	447.215	1.766	50	20	IDGD	
COc1cc(F)cc(NNC(=O)Cn2cnc3c(c(Br)nn3C)c2=O)c1	759324631	GKVZIBOKFKFNTG-UHFFFAOYSA-N	425.218	1.184	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)C2CCN(S(=O)(=O)c3c(C)noc3C)CC2)nc1	759738393	ODAOGGVRILLWIL-UHFFFAOYSA-N	437.478	1.017	50	20	IDGD	
CCCOc1cccnc1C(=O)NNC(=O)CN1CCN(Cc2ccc(C)cc2)CC1	760447754	GTIJPPBAWLFYGG-UHFFFAOYSA-N	425.533	1.758	50	20	IDGD	
CNS(=O)(=O)c1ccc(CCC(=O)NNC(=O)CSc2ccccc2OC)cc1	761618468	FDFPVTFBJUWAGM-UHFFFAOYSA-N	437.543	1.476	50	20	IDGD	
CCOc1ccccc1C(=O)N1CCC[C@@H]1C(=O)NNc1nccc(N2CCOCC2)n1	762856846	YBJXKMABSMNHMF-QGZVFWFLSA-N	440.504	1.460	50	20	IDGD	
CCOc1ccc(OCc2ccc(C(=O)NNC(=O)Cn3cc([C@@H](C)O)nn3)cc2)cc1	763015263	YCWSBYSQRLZKMG-OAHLLOKOSA-N	439.472	1.770	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ccccn2)c(Br)cc1F	763465180	UWYGQXNULYQDOT-UHFFFAOYSA-N	439.197	1.170	50	20	IDGD	
Cn1c(=O)oc2c(NC(=O)C(=O)NNC(=O)c3ccccc3Br)cccc21	763483397	RBIKCYLHMKOXLY-UHFFFAOYSA-N	433.218	1.294	50	20	IDGD	
C[C@H]1CN(Cc2cccc(NC(=O)C(=O)NNC(=O)c3ccccc3O)c2)C[C@H](C)O1	763527162	NJQUHTTTXSNVDR-GJZGRUSLSA-N	426.473	1.401	50	20	IDGD	
Cc1ccc2c(c1)N(C(=O)C(=O)NNC(=O)CCN1CCN(c3ccccc3)CC1)CC2	763530301	HMGZFUVHNRFDBV-UHFFFAOYSA-N	435.528	1.244	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)Nc1c(F)c(F)c(F)c(F)c1F	763571844	PCHDZHVJWYKAIG-MRVPVSSYSA-N	431.273	1.308	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(OC[C@@H]3CCCO3)c2)c1	763623776	NDUWIDCAHXMKES-IBGZPJMESA-N	427.457	1.718	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)C(=O)Nc1cccc(OC[C@H]2CCCO2)c1	763680139	RWRWQHSOSGRVSW-MRXNPFEDSA-N	431.420	1.548	50	20	IDGD	
CC1CCN(Cc2ccc(NC(=O)C(=O)NNC(=O)COc3ccc(C#N)cc3)cc2)CC1	763680280	FFGMLUKPFSRZNT-UHFFFAOYSA-N	449.511	1.955	50	20	IDGD	
CC(C)CNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)cc1	763686722	QYFKIUXTOLYXNW-UHFFFAOYSA-N	446.891	1.891	50	20	IDGD	
COc1cc(OC)c(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)cc1F	763694416	IDKNHOHGELLBOD-UHFFFAOYSA-N	425.800	1.661	50	20	IDGD	
O=C(NNC(=O)C12CC3CC(CC(C3)C1)C2)C(=O)Nc1cccc(N2CCCNC2=O)c1	763735673	QVERGXRGUGXFSS-UHFFFAOYSA-N	439.516	1.909	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cccc(C(=O)NC3CC3)c2)c1C	763852241	GHHSDQCQJAVWKN-OAHLLOKOSA-N	438.484	1.749	50	20	IDGD	
O=C(CCSc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccc(-n2cccn2)nc1	763895310	NTHWFVCLZCQOAD-UHFFFAOYSA-N	428.449	1.675	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(-n3ccnc3C)nc2)cc1OC	763902620	VLARZEWFTAOZQU-UHFFFAOYSA-N	438.444	1.383	50	20	IDGD	
N#CCOc1cc(F)ccc1NC(=O)C(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	763944025	KDLKGLDDZRHYSW-UHFFFAOYSA-N	438.375	1.019	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc(S(=O)(=O)NCCC(C)C)cc1	763958450	WWJPKZRMORDXRH-UHFFFAOYSA-N	446.529	1.719	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)nn1-c1ccccc1	763994944	JWOOJQKIASRTEV-UHFFFAOYSA-N	431.250	1.671	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)C(=O)Nc1cccc(CCN2CCCC2)c1	763996913	GXVWRWJCMUWCMJ-UHFFFAOYSA-N	448.321	1.815	50	20	IDGD	
O=C(CCc1ccco1)NNC(=O)C(=O)Nc1ccc(C(=O)NCc2ccccc2)cc1	764171142	FBPCEXDDTRIIOI-UHFFFAOYSA-N	434.452	1.928	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(-n3cnc4ccccc43)nc2)c1	764236064	AWZWSMBKEORPBQ-UHFFFAOYSA-N	425.408	1.692	50	20	IDGD	
Cc1cc(N2CCOCC2)ccc1NC(=O)C(=O)NNC(=O)CCc1ccccc1O	764277863	JKCTXCCWMBXNJJ-UHFFFAOYSA-N	426.473	1.256	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2c[nH]nc2C)cc1I	764297748	YBJVAMLVDXKADE-UHFFFAOYSA-N	427.202	1.031	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)c(Cl)c1)C(=O)Nc1ccc2nc3n(c(=O)c2c1)CCC3	764346362	XZTUSHULWRBWQT-UHFFFAOYSA-N	441.831	1.101	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)C(=O)Nc2ccc(-c3nnc4n3CCCCCC4)cc2)cn1	764358614	LRLPRRNGQRTPQW-UHFFFAOYSA-N	436.476	1.195	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1cc(C(F)(F)F)ccc1-n1cccn1	764401317	VPMSVDAEZSUXQE-NSHDSACASA-N	443.382	1.029	50	20	IDGD	
Cc1nc(-c2cccnc2)nc(O)c1CC(=O)NNC(=O)CSc1ccccc1O	765249700	OHCLVBYPEZHRNI-UHFFFAOYSA-N	425.470	1.740	50	20	IDGD	
Cc1ccc(N(C)S(=O)(=O)c2cccc(C(=O)NNC(=O)c3cc(C)[nH]n3)c2)cc1	765588399	ZYQBSJCAALESJY-UHFFFAOYSA-N	427.486	1.926	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C[C@@H](NC(N)=O)c2cccc(C)c2)n[nH]1	765592193	JGXSMBFTCKGRKY-MRXNPFEDSA-N	436.472	1.954	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)c(Cl)c1	765734367	YIGFUQMYQSFQGF-UHFFFAOYSA-N	430.892	1.568	50	20	IDGD	
O=C(Cc1coc2cc(F)ccc12)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765738903	PWYOAEDGCJIWOE-UHFFFAOYSA-N	438.459	1.720	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)c2nc(-c3ccccc3)n(-c3ccccc3)n2)c(=O)n1	765973475	DAJNCQGLMPOZNQ-UHFFFAOYSA-N	443.467	1.569	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)c1cn(Cc2cccc(F)c2)nn1	767379190	ANYSUACTQARVHN-UHFFFAOYSA-N	425.420	1.321	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN(CCO)Cc2ccc(Cl)c(Cl)c2)n1	767791105	YOUOZNDVWIIJNE-UHFFFAOYSA-N	431.345	1.943	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2cccc([N+](=O)[O-])c2)cc1NC(=O)CCN(C)C	768227944	HWVNZOAQGPISMT-UHFFFAOYSA-N	428.449	1.875	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3ccc(-n4ccnc4)nn3)n[nH]2)cc1OC	768275795	GJZRFSXXVVIGRN-UHFFFAOYSA-N	434.416	1.144	50	20	IDGD	
Cc1oc2ccccc2c1CC(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	768711539	DGMANPVFANOJDE-UHFFFAOYSA-N	443.529	1.758	50	20	IDGD	
CC(C)Oc1ccc(NC(=S)NNC(=O)c2ccc(S(N)(=O)=O)cc2F)cc1	769744225	LOFDGEIDLAQUQA-UHFFFAOYSA-N	426.495	1.892	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)c1cccnc1I	770526091	BQGPMFGPMJHZRT-UHFFFAOYSA-N	441.225	1.925	50	20	IDGD	
COc1ccccc1C(=O)N[C@H](CCSC)C(=O)NNc1nc(O)c2cnn(C)c2n1	770974634	NNOSWVSCMYDMSB-CYBMUJFWSA-N	445.505	1.072	50	20	IDGD	
O=C(NCc1nc(COc2ccccc2)n[nH]1)NNC(=O)c1nnc(O)c2ccccc12	771375998	IIQYNGFQHDINRF-UHFFFAOYSA-N	434.416	1.177	50	20	IDGD	
Cc1nc(COc2ccc(C(=O)NNC(=O)C(=O)NCc3ccc(Cl)cc3)cc2)no1	772188276	JSIISMRIWFZSKC-UHFFFAOYSA-N	443.847	1.688	50	20	IDGD	
C[C@@H]1C[C@@H](NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)CCN1C(=O)OC(C)(C)C	772339908	QJJRSYXEHFUMFH-HIFRSBDPSA-N	444.496	1.394	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)[C@H](C(C)C)N2CCCS2(=O)=O)cc1	772631406	RIZQCXCIWHJASP-PBHICJAKSA-N	427.523	1.060	50	20	IDGD	
COc1cc(Cl)ccc1NC(=O)C(=O)NNC(=O)c1cc(OC)c(OC)c(OC)c1	773490921	GGIVUPRLEJDWBL-UHFFFAOYSA-N	437.836	1.774	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2cc3c(cc2Br)CCC3)n1	773526921	HAUXNWHRPQATMF-UHFFFAOYSA-N	434.294	1.537	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNc2cnc3ccccc3n2)cc1Cl	773717522	AATNHKLYQHSLPY-UHFFFAOYSA-N	429.820	1.917	50	20	IDGD	
C[C@@H](OC[C@@H]1CCCCO1)C(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776201838	MHNLSPCHHDNXHU-CVEARBPZSA-N	428.530	1.596	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)c2ccc3c(c2)S(=O)(=O)N(C2CC2)C3=O)c1	776534358	JLJPTIBSMNBCOC-UHFFFAOYSA-N	435.483	1.154	50	20	IDGD	
O=C(NC[C@@H]1COC2(CCOCC2)O1)NNC(=O)c1cc(F)ccc1Br	777758848	OXHPZCXCXSTTEK-LLVKDONJSA-N	432.246	1.454	50	20	IDGD	
O=C([C@H]1CCCN1Cc1ccccc1)N1CCN(S(=O)(=O)CBr)CC1	777778005	VRPDDXDNKGHTJJ-MRXNPFEDSA-N	430.368	1.477	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N[C@@H]2CCCN(c3ccc(C#N)cc3)C2=O)cc1OC	779975424	UZPJARVEXYHBRF-QGZVFWFLSA-N	437.456	1.715	50	20	IDGD	
COC1(CNC(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)CCC1	780860006	IFEGMWJGOYGKCR-UHFFFAOYSA-N	435.488	1.902	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)C[C@H](O)c1ccc(OCc2ccccc2)cc1	780921173	JCZXIPHLPAZZLI-IBGZPJMESA-N	437.452	1.860	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Cc2nc(-c3ccccc3)cs2)cc1-n1cnnn1	781938151	XIAYDSZXQUVYRH-UHFFFAOYSA-N	435.469	1.798	50	20	IDGD	
COc1cc(Cl)ccc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)NC(C)C)cn1	783263751	KWJRYVQNVOZSFP-UHFFFAOYSA-N	441.897	1.512	50	20	IDGD	
Cc1cc(C)c(NNC(=O)C(=O)N2CCc3cc(S(=O)(=O)N(C)C)ccc32)c(C)c1	783368572	PVTHNZAFQLMTLN-UHFFFAOYSA-N	430.530	1.895	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2c(C)cnn2[C@@H]2CCN(Cc3ccccc3)C2)ncn1	783945278	JJWPGQQIRVKRQN-GOSISDBHSA-N	434.504	1.819	50	20	IDGD	
CN(C)CCc1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)cc1	784215406	IDEXTRIECNQVCF-UHFFFAOYSA-N	445.545	1.313	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCNC(=O)[C@@H]1c1ccccc1F	784514900	TWPYTDHYZCHOBV-SFHVURJKSA-N	434.855	1.422	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)C2CN(C(=O)OC(C)(C)C)C2)CC1	784664652	MBQKYZSBCBZCGZ-UHFFFAOYSA-N	441.529	1.583	50	20	IDGD	
CCC(CC)NC(=O)[C@@H]1CN(C(=O)C(=O)NNc2ccc(Cl)nn2)c2ccccc2O1	784792313	OAJBRTUSMCJDEV-HNNXBMFYSA-N	446.895	1.672	50	20	IDGD	
COCCOc1ccc(Br)cc1NC(=O)C(=O)NNc1cccc(OC)n1	784846184	NNFOPRXWFWDFDT-UHFFFAOYSA-N	439.266	1.960	50	20	IDGD	
CCNC(=O)N(C)NC(=O)C(=O)Nc1cc(F)c(F)cc1I	784915964	LHDJPTZDLZBNFK-UHFFFAOYSA-N	426.161	1.200	50	20	IDGD	
O=C(NCc1ccccc1)NNC(=O)[C@@H]1CCCN1S(=O)(=O)c1cccc([N+](=O)[O-])c1	787591846	ZHDXDQPTLVCZQA-KRWDZBQOSA-N	447.473	1.279	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(Cl)cc2-n2cccn2)c1	788332316	ZQZNFOWPFHPNLJ-UHFFFAOYSA-N	427.848	1.999	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2ccc(-c3cnn(C)c3)nn2)c2ccccc2c1=O	788788856	MJCDBCDYEVFMDR-UHFFFAOYSA-N	433.432	1.073	50	20	IDGD	
COc1ccccc1C(=O)NNS(=O)(=O)c1cc(Cl)cc(C(=O)N(C)C)c1OC	790068922	QJLOZPCSSRFDOP-UHFFFAOYSA-N	441.893	1.682	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)on1)C(=O)Nc1cccc(Br)n1	793026500	SGPHBUORLXEOAN-UHFFFAOYSA-N	430.218	1.899	50	20	IDGD	
O=C(NNc1ccc2c(=O)[nH]ccc2c1)C(=O)Nc1cnn(-c2cnc3ccccc3n2)c1	793070468	SMJZBFXHCAJGQF-UHFFFAOYSA-N	440.423	1.739	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)[C@@]2(C)CCN(C(=O)OCc3ccccc3)C2)C[C@@H](C)O1	794898430	FQNXYFNOCMJEBS-IXFSTUDKSA-N	446.548	1.682	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)CNC(=O)c1ccccc1OC(F)F	795151575	JNJGOHGVSQJSMX-UHFFFAOYSA-N	442.444	1.411	50	20	IDGD	
CCOC(=O)c1ccc(F)c(S(=O)(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)c1	795327271	XNEKKJZRNUHDEF-UHFFFAOYSA-N	427.366	1.240	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cccc(C(F)(F)F)c2)cc1OC	796998133	FZSWVQUBSORJNS-UHFFFAOYSA-N	439.346	1.900	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(OC)c(NC(=O)NNC(=O)c2cccc(C)n2)c1	797607551	FRJAVBCUJLCCBG-UHFFFAOYSA-N	435.506	1.896	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)[C@@H]2CCc3cnn(C)c3C2)c2ccccc2c1=O	798829296	FGVISCUNGYDFGH-OAHLLOKOSA-N	436.516	1.886	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2cc(Cl)cc(C(N)=O)c2)cc(OC)c1OC	799119975	GWZAGEXIZISWAU-UHFFFAOYSA-N	443.865	1.088	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@@H](C)NC(=O)CCc2ccccc2)cc(OC)c1OC	799295129	ZMDZVSFPVXITCP-CQSZACIVSA-N	429.473	1.611	50	20	IDGD	
Cc1ccnc(NNC(=O)C(=O)Nc2cc3c(cc2N2CCCCC2)n(C)c(=O)n3C)c1	800629358	RDVWTDBLDVUVQO-UHFFFAOYSA-N	437.504	1.653	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)[C@@H]2C[C@@H](O)CN2C(=O)OCc2ccccc2)cc1	802060843	HYMVLHIYQXKQOH-AEFFLSMTSA-N	428.445	1.620	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)N[C@H]1CCN(C(=O)COc2ccccc2)C1	802468468	RJVVCLJHRFWGDQ-HNNXBMFYSA-N	427.417	1.219	50	20	IDGD	
CCCN(NC(=O)[C@@H](NS(=O)(=O)c1ccc(C)cc1)[C@@H](C)O)C(=O)OC(C)(C)C	804592169	AQGHEPUZSUFMLX-ZBFHGGJFSA-N	429.539	1.701	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(Br)c(C(=O)NNc2cccc(F)n2)c1	804768778	UZTMPTPVHXKBNP-UHFFFAOYSA-N	447.286	1.665	50	20	IDGD	
O=C(NNC(=O)N1CC=C(c2ccc(O)cc2)CC1)c1csc(N2CCOCC2)n1	807129278	CGZGDIYSTGFZNQ-UHFFFAOYSA-N	429.502	1.829	50	20	IDGD	
C[C@]1(C2CC2)NC(=O)N(c2ccc(CNC(=O)NNC(=O)CC(F)(F)F)cc2)C1=O	807239670	IHFWBBOWCGPEHL-QGZVFWFLSA-N	427.383	1.694	50	20	IDGD	
CN1CCC[C@H](N(C)C(=O)c2ccc(NC(=O)C(=O)NNc3ncccc3F)cc2)C1	807300602	GUBUYNHHLCIHHO-INIZCTEOSA-N	428.468	1.469	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)C[C@H](CC(C)(C)C)C(=O)NNC(=O)c1cccn1C	808038232	PODFNWPBBKNMDN-CQSZACIVSA-N	430.509	1.028	50	20	IDGD	
COc1cc(Cl)c(NC(=O)C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1C	808935112	JOHMYDFTKWCDAW-UHFFFAOYSA-N	446.895	1.450	50	20	IDGD	
O=C(NNS(=O)(=O)CCCN1C(=O)c2ccccc2C1=O)c1cccc2ncccc12	811682978	LDIKASXUJJSMER-UHFFFAOYSA-N	438.465	1.485	50	20	IDGD	
Cn1c(=O)c(CNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc2ccccc21	813837555	PDNYTQVNIPHTJW-UHFFFAOYSA-N	435.488	1.076	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2cc(C(=O)NNc3ncncc3F)ccc2Cl)C[C@H](C)O1	817067744	POYCPMVATMOBLN-QWRGUYRKSA-N	443.888	1.824	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)c1ccc(-n2cncn2)nc1	828879010	MPZUFKDSOFEVDI-NSHDSACASA-N	431.250	1.653	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)Cc1ccccc1O[C@H]1CCOC1	857431685	PUHJLIIOPKUCLA-INIZCTEOSA-N	446.529	1.460	50	20	IDGD	
CCN1CCC[C@@H]1CNC(=S)NNC(=O)CN1c2cccc3cccc(c23)S1(=O)=O	884367102	QOWQRQBAYLTIMN-OAHLLOKOSA-N	447.586	1.328	50	20	IDGD	
COC(=O)c1cccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)n1	916096568	UJZBBCJBIOEHMA-UHFFFAOYSA-N	446.485	1.118	50	20	IDGD	
Cc1oc(C)c(S(N)(=O)=O)c1C(=O)NNC(=O)c1ccc(COc2ccccc2)o1	916148427	JGANFHZZIIGOME-UHFFFAOYSA-N	433.442	1.791	50	20	IDGD	
C[C@H](Cn1ccnc1)NC(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	916623193	IQJSPMQOBCKZIU-MRXNPFEDSA-N	445.487	1.618	50	20	IDGD	
COCCN1C(=O)c2ccc(C(=O)NN=c3sc4ccccc4n3C)cc2S1(=O)=O	916740651	AIDDUNPWWAZTMV-UHFFFAOYSA-N	446.510	1.276	50	20	IDGD	
COCC(=O)NC1CCN(C(=O)NNC(=O)c2ccc(COc3ccccc3)o2)CC1	918002894	YVDRWXPGOYHBOG-UHFFFAOYSA-N	430.461	1.440	50	20	IDGD	
CCn1c(NNC(=O)c2cc(S(=O)(=O)N(C)C)ccc2F)nc2ccccc2c1=O	918015956	BTLINKGEJOPBPR-UHFFFAOYSA-N	433.465	1.563	50	20	IDGD	
CCc1ccc(C(=O)Nc2sccc2C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)cc1	918208683	HTPVZNMJDWAERH-CQSZACIVSA-N	435.527	1.759	50	20	IDGD	
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1ccco1)NNC(=O)c1ccc(Cl)cc1	919639829	FHJKHPHYIZWATF-OAHLLOKOSA-N	433.848	1.932	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCC[C@H](C)C3)cc2)c1O	919757110	YGSGJYMHMAVZPZ-AWEZNQCLSA-N	447.513	1.896	50	20	IDGD	
O=C1CCc2cc(-c3csc(NC(=O)NNC(=O)[C@H]4CCS(=O)(=O)C4)n3)ccc2N1	920933175	RJTCJVBFJXUKAO-LBPRGKRZSA-N	449.514	1.282	50	20	IDGD	
CN1CCc2nc3ccccc3c(C(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)c2C1	933646130	CZSABKHEDPXTNX-UHFFFAOYSA-N	442.479	1.544	50	20	IDGD	
N#Cc1ccc(N2C[C@@H](C(=O)NNc3nc(Br)cn4ccnc34)CC2=O)cc1	1116216099	NDLASFLJSDBCIR-LBPRGKRZSA-N	440.261	1.860	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)ccc1N1CCN(C)CC1	1320106312	RRCVWDPSUJKRFJ-UHFFFAOYSA-N	449.515	1.460	50	20	IDGD	
COc1cc(C(=O)CCC(=O)NNC(=O)c2n[nH]c3c2CCCC3)cc(OC)c1OC	1320670212	PBCZIVWVHSVMEV-UHFFFAOYSA-N	430.461	1.738	50	20	IDGD	
Cn1c(=O)c(C(=O)N2CC[C@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)nc2ccccc21	1777887403	ZPTHAMFMFAZRGQ-QFIPXVFZSA-N	446.935	1.642	50	20	IDGD	
Cc1nc2ncccn2c1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2	1777903158	HCNIUJWTOWXDNJ-KZULUSFZSA-N	436.310	1.265	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnc(O)nc2O)C1	1778009364	UKNZBJKDPDKMSZ-NXOUGTEYSA-N	447.319	1.252	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)[C@]3(F)CCCCC3(F)F)C2)C1	1778222692	JOXJQNFYWJGYKE-RTBURBONSA-N	448.486	1.107	50	20	IDGD	
C[C@H](Nc1cnccn1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CO[Si](C)(C)C)C2	1779393333	LEPIGRBOZYIACF-CSODHUTKSA-N	449.628	1.642	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C=C/c2cc(C)on2)C1	1779441645	YGCSEUXCGMNUEK-MAEGOCJMSA-N	425.913	1.764	50	20	IDGD	
C[C@@H]1Oc2ccc(C(=O)N3CC[C@]4(C3)CN(C(=O)[C@H](F)Cl)CCO4)cc2NC1=O	1780177958	XCVMMGANGIFWSF-LLJZQGTPSA-N	425.844	1.384	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)C2)C1	1781765626	HBUYDKUPBMVZFD-MAUKXSAKSA-N	429.832	1.431	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@](C)(O)C(F)(F)F)C2	1781997424	VWGFCZKWIIEZEW-HKCMKHECSA-N	445.276	1.597	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccn3nccc3c1)C2	1782175354	ILQBFFHFNFVLMN-WAOWUJCRSA-N	434.924	1.716	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCCn2ccnc2)C1	1782485662	YILLMRDWRVBQNZ-GPMSIDNRSA-N	441.370	1.961	50	20	IDGD	
CC(C)N(C)CC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)CBr)C2	1782733178	BOCBDTAUBSNECJ-GPMSIDNRSA-N	432.403	1.872	50	20	IDGD	
COc1ccccc1CC(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](C)Br)C2)C1	1783540356	UQDOHSKHQULWGH-KUHUBIRLSA-N	425.323	1.851	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]2C1	1783974555	PVRPFNHWGYRPJE-PEDHHIEDSA-N	425.751	1.251	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)CCCn3ccnc3C)C2)C1	1784411941	MIAZYSVNYAOOEA-LPHOPBHVSA-N	441.370	1.975	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3coc(Cl)n3)[C@H]2C1	1785672924	JSIWBHOOHVDQMJ-ZPFDUUQYSA-N	434.718	1.952	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc(F)cn3)C[C@@H]21	1786405873	HLYUNBUQTPTOSS-RCBQFDQVSA-N	428.302	1.528	50	20	IDGD	
CCCC(=O)N[C@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCBr)[C@H]2C1	1786406043	FDZCENWPKFUVLA-QPSCCSFWSA-N	432.359	1.056	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cn3ccccc3=O)[C@H]2C1	1787018207	PUSMXANDLTURHC-JONQDZQNSA-N	440.338	1.002	50	20	IDGD	
CC(=O)O[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)C(C)C	1788479459	FMFYQLJNZCIIDY-BTFPBAQTSA-N	437.306	1.244	50	20	IDGD	
CCOc1cnc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]3C2)cn1	1791057401	UNAZEHCLAGTZJF-OSFYFWSMSA-N	441.326	1.252	50	20	IDGD	
C[C@@H](Oc1cccnc1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21	1791652245	JAZKTMFTANDKPH-OHFALNGGSA-N	440.338	1.614	50	20	IDGD	
COc1ccc(OCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCBr)C3)cc1	1792725175	DPBGJSODVNRRKP-HBCWATKFSA-N	441.322	1.449	50	20	IDGD	
O=C(CCc1ccc2c(c1)OCO2)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2	1795321788	YZSCOBYCUWCMMS-FVCICTRLSA-N	429.300	1.741	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CNc1ccc(F)cc1	1795540671	CUVMMAUIGUAYCN-FLTUCWPJSA-N	442.329	1.858	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1nccc2[nH]ccc12	1796209145	NIQNLYLUEPBSBH-FAXLKDOZSA-N	435.322	1.940	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)c1csc(-c2cccnc2)n1	1796483063	HTCFMCLWROTIOQ-OCVGTWLNSA-N	436.921	1.008	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccnn1CCOC	1797057951	FQRFMMNUIAFRMX-LXTVHRRPSA-N	427.343	1.955	50	20	IDGD	
O=C(CCCCn1cccc1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2	1797885981	TXRPUQULEORQFC-YALNPMBYSA-N	430.318	1.939	50	20	IDGD	
Cc1cc2nc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)c3cccc(B(O)O)c3)C4)[nH]c2cc1C	1798360372	IZQSTYADJKAVQS-REPLKXPHSA-N	446.316	1.425	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)COC1CCCCC1)C2	1798439666	UVBBVIOPQPOXKQ-MUJYYYPQSA-N	429.521	1.286	50	20	IDGD	
COc1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)c(C)c1	1799781109	HFVDQAJEPANCNZ-MUJYYYPQSA-N	437.500	1.568	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(F)c(F)cc1F	1800375286	PJENVVWGXPYQQY-ZSBIGDGJSA-N	447.417	1.668	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc(OC)c(F)c1)C2	1800982261	ATEFXOLIHZARJY-YGTYGHESSA-N	428.888	1.220	50	20	IDGD	
Cc1cc2cc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)CCC(=O)NN(C)C)ccc2[nH]1	1801012746	IOLFJTBKWOTLJP-OPMZPASUSA-N	441.532	1.053	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)Oc1cccnc1	1801396576	WKLTTWUTNWATMU-SVZOTFJBSA-N	440.338	1.470	50	20	IDGD	
CC(C)(CCl)C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1802899497	CZFWXKADXKLDPK-MJGOQNOKSA-N	443.740	1.346	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)n(C(F)F)n1	1803142535	ZISNQHXZSGIIMA-KBMXLJTQSA-N	441.866	1.901	50	20	IDGD	
CCOC(=O)N[C@H](O)C(=O)N1CCC2(CCCN(C(=O)[C@H](C)CBr)C2)CC1	1805385460	ZJXCKYLWAFPRAR-ZIAGYGMSSA-N	448.358	1.313	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC2(CCCN(C(=O)CCN3C(=O)C=CC3=O)C2)CC1	1806386982	REWABNSJVPZWCL-CQSZACIVSA-N	440.338	1.316	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)CCNC(=S)NC)[C@@H]1c1cccnc1	1808263180	DCAYJGLITPJJSN-HLLBOEOZSA-N	425.986	1.589	50	20	IDGD	
CN1CCN(C2(C(=O)N3CC[C@H](CNC(=O)[C@@H](F)Cl)[C@H]3c3cccnc3)CC2)CC1	1808314150	CPOGOQLHFYYMPL-KZNAEPCWSA-N	437.947	1.402	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)N1CC[C@H](CNC(=O)[C@@H](F)Br)[C@@H]1c1cccnc1	1808662272	JTBHOGLDVCVNSJ-ZOBORPQBSA-N	444.305	1.225	50	20	IDGD	
O=C(Cc1ccc(F)cc1)N1CCCC2(CCN(C(=O)c3cccc(B(O)O)c3)CC2)C1	1809259237	ZCKNPJPEHXYCDJ-UHFFFAOYSA-N	438.308	1.593	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)c1cn2ccsc2n1	1809938554	OJTRPGXXOFEXSQ-NUEKZKHPSA-N	433.921	1.710	50	20	IDGD	
C=C1CC(C(=O)N2CC[C@H](CNC(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)C1	1810295684	VFCYOHMMECWCBP-UZLBHIALSA-N	434.500	1.366	50	20	IDGD	
Cc1[nH]ccc1C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1	1810302127	GQXXIRFYFRXVIC-JXFKEZNVSA-N	447.499	1.350	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2cnncc2C(=O)O)[C@@H]1c1cccnc1	1810804519	PVHPGWFZSXSWRE-COXVUDFISA-N	447.879	1.143	50	20	IDGD	
Cn1ccc(=O)cc1C(=O)NC[C@@H]1CCN(C(=O)CO[Si](C)(C)C)[C@H]1c1cccnc1	1811369072	KDWOGFBHRUECET-UWJYYQICSA-N	442.592	1.951	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)Cn2nnc3ccccc32)[nH]n1)[C@H](O)CCl	1814867951	SJOQCBOGOBKCCX-GDBMZVCRSA-N	431.884	1.446	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@H]1CCc2nc(NC(=O)CN3CCNC3=N)sc2C1	1814927625	INKLQDRSAWDTPS-FVMDXXJSSA-N	433.365	1.131	50	20	IDGD	
CC[C@@H](NC)C(=O)N[C@H]1CCc2nc(NC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)sc2C1	1817280240	QUDBCFHQLADLJH-UZGQRAPBSA-N	445.549	1.187	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)CCl)CC2)c1nnsc1C1CC1	1817702204	MZNWBTMVMJAKBP-SCZZXKLOSA-N	427.939	1.698	50	20	IDGD	
O=C(Cc1ccncc1)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1820716291	TWGGKLZSSGMTKS-LJQANCHMSA-N	433.277	1.033	50	20	IDGD	
O=C(CCCn1cccc1)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1822826861	HEUMCFJXLXVERH-HXUWFJFHSA-N	449.320	1.677	50	20	IDGD	
COC(=O)c1ccc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)[C@H](O)CCl)CC2)cn1	1824182518	FFYNRVCEIYLAIR-ZWKOTPCHSA-N	437.924	1.701	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccoc2)CC1	1825051676	GILTVRNCHFAPGX-DGOUCMFKSA-N	436.317	1.906	50	20	IDGD	
Cc1cc[nH]c1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1	1825530525	OYHPTPDCAJZORR-IBGZPJMESA-N	438.532	1.869	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cccn(C)c1=O)CC2	1825635484	HLHLUSLGFQTZRC-NXEZZACHSA-N	439.335	1.851	50	20	IDGD	
CC(=O)N/C(C)=C/C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](C)Br)sc2C1	1825647905	XUAQBUSZLUXBMQ-XHCRCFASSA-N	429.340	1.878	50	20	IDGD	
C[C@@H]1CC[C@H](C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)O1	1827058993	CDLMLLWEJAKURV-MAODMQOUSA-N	428.338	1.167	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)Cc2cccs2)CC1	1827155196	ZLAUGCBGBGPNIV-OAQYLSRUSA-N	440.374	1.904	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)C3CC(F)(F)C3)CCO2)C1	1829990414	CQCYJHZGERABFH-HOTGVXAUSA-N	429.291	1.724	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc4nc[nH]c34)C2)C1	1830358041	OKTBMDZSYTUSSC-OAQYLSRUSA-N	434.924	1.898	50	20	IDGD	
C[C@@H](Cn1cccn1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830358621	PSXRQGHAWCKCPZ-OXJNMPFZSA-N	426.945	1.241	50	20	IDGD	
COC1(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)CCC1	1830545734	MGGZBZYSCFPHTM-HNAYVOBHSA-N	447.370	1.433	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H]2CNC(=O)C2)CC1	1831421486	YVKIIPRTTIDUDY-HRCADAONSA-N	428.371	1.916	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3nccc4nc[nH]c34)C2)C1	1831645267	ANPHHUUAPQKMPM-VLIAUNLRSA-N	435.912	1.435	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)C2CCC(O)CC2)CC1	1832000867	GYOBBTJRDIHFBY-KITAHSCOSA-N	442.365	1.151	50	20	IDGD	
C[C@H](C(=O)NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1)C1(O)CCC1	1833070665	GXRBMOIQRLTWMY-CJNGLKHVSA-N	448.377	1.800	50	20	IDGD	
C[C@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)CC(N)=O)CC2)CC1	1833265431	VRZLJQFQDLWVJP-UONOGXRCSA-N	445.402	1.101	50	20	IDGD	
C[C@H](Nc1cccnc1)C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)CCl)CC2)CC1	1833308944	FCRSACLERGSIFN-HNAYVOBHSA-N	437.972	1.053	50	20	IDGD	
COc1cnc(C(=O)N2CCO[C@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)c(F)c1	1833635271	OEYYGJVRBDMDIL-QGZVFWFLSA-N	436.267	1.103	50	20	IDGD	
Cc1noc(C)c1C(=O)N1CCO[C@@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1	1834066307	OIJHSHMQEYQBGQ-LJQANCHMSA-N	425.558	1.213	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3cccn3C)CC2)CC1	1834100859	HMIWTZQAOBZCHN-CQSZACIVSA-N	425.371	1.994	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3cc(=O)cco3)CC2)CC1	1834345184	NZUPVSMLSQQXKY-CYBMUJFWSA-N	440.338	1.608	50	20	IDGD	
Cc1nc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCBr)C3)C2)cs1	1834454315	WILXAVBKAAARNL-MRXNPFEDSA-N	432.340	1.307	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCC(N2CCC(NC(=O)Cn3cncn3)CC2)CC1	1834872451	CUQJQDYZNLDGGP-GOSISDBHSA-N	431.368	1.086	50	20	IDGD	
O=C(/C=N/O[C@H]1CCCCO1)NC1CCN(C2CCN(C(=O)C(Cl)Cl)CC2)CC1	1835768526	JCDTUDLORDNOJG-KOWBDXASSA-N	449.379	1.891	50	20	IDGD	
Cc1ccc(C(=O)C(=O)N2CCC(OC3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)cc1	1836718705	AJGSGALWZPLFLZ-IBGZPJMESA-N	436.936	1.776	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)/C=N/O[C@@H]3CCCCO3)CCO2)C1	1837526120	SNOPFUFBQYFOCS-DJBOWYRTSA-N	445.944	1.379	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)CCCc3cccnc3)C2)C1	1837717420	FHJUJRBKIQIPSY-JOCHJYFZSA-N	449.624	1.712	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cn(C(C)(C)C)nn3)C2)C1	1839146095	KBQHAIYTJTZFMC-IFXJQAMLSA-N	427.933	1.121	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cc(F)ccc3F)C2)C1	1839149675	ODYISOBKWSNTNF-OXQOHEQNSA-N	430.879	1.981	50	20	IDGD	
Cc1cncc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)c1	1839197765	IBDPWZFUEHHHHR-RHSMWYFYSA-N	430.274	1.151	50	20	IDGD	
Cc1ccnc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)c1	1839200176	CXYMGLSZRCAYFI-YOEHRIQHSA-N	430.274	1.151	50	20	IDGD	
COc1cccc(/C=C/C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)c1	1839994773	FBSUNWZBCIKQPX-YHTLKTDXSA-N	426.872	1.699	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CCC(F)(F)F)C2)C1	1840032331	VNCBPTQENYDKIM-RISCZKNCSA-N	431.249	1.569	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(Cl)cc3C)C2)C1	1840149520	RPNAQPCZHFOQSY-PXNSSMCTSA-N	445.343	1.972	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4[nH]c(C)cc4c3)C2)C1	1840155162	RBUUBQYCGDIVOB-XMSQKQJNSA-N	449.935	1.800	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1cc(F)cc(Cl)c1)C2	1844265530	MKNHYZBOJWLVNS-UHFFFAOYSA-N	431.855	1.608	50	20	IDGD	
C=CCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)[C@@H](O)CCl)C2	1845198989	WWVMFXFBWFNLPY-GJZGRUSLSA-N	429.945	1.649	50	20	IDGD	
Cn1cc(C(=O)N2CC3(CCCN3C(=O)[C@H](F)Br)C2)c(C(F)(F)F)n1	1845218585	OATSVGAWZTZCCW-JTQLQIEISA-N	427.196	1.946	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)Cc2ccc(F)cc2F)C1	1846081968	ZWQUWQPGUQFAQU-UHFFFAOYSA-N	429.427	1.023	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@H](NC(C)=O)c1ccc(F)cc1)C2	1846363337	CVIASAQYHBAKDM-IRXDYDNUSA-N	425.888	1.460	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](CC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](O)CCl)C1	1847564384	VCYYFUDPJIVYSC-UGUYLWEFSA-N	429.945	1.435	50	20	IDGD	
O=C1C[C@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)CCBr)CN1C1CCCC1	1848039054	KZFBQGSNWQTVSV-BPUTZDHNSA-N	426.355	1.764	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)Cc1cncnc1	1848095779	OIVLLUHTHKBFGL-JYJNAYRXSA-N	437.928	1.353	50	20	IDGD	
COc1ccc(/C=C(\C#N)C(=O)O[C@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)cc1	10866924	PEYIKIFENZCQCY-WDGDVPDHSA-N	429.454	1.820	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cnc3onc(C(C)C)c3c2)cc1OC	11683012	RMOLVGFVZIBMJR-UHFFFAOYSA-N	442.428	1.981	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)n(C)c1	16203371	LZEYMFIYYBPQDT-ZDUSSCGKSA-N	440.497	1.423	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)c1	17252195	XKZNDUNBCMTLDP-UHFFFAOYSA-N	427.417	1.810	50	20	IDGD	
CCn1c(=O)c2ccccc2n(CC(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)c1=O	18103655	BDDJAIQNKOSJSW-MRXNPFEDSA-N	438.484	1.415	50	20	IDGD	
Cc1nnc(NNC(=O)c2ccc(Cl)c(S(=O)(=O)N3CCCCCC3)c2)nc1O	29066896	IDGVDQZREOKFJP-UHFFFAOYSA-N	440.913	1.861	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C2CCC3(CC2)NC(=O)NC3=O)ccc1OCCC(C)C	110739571	GOENBQHZBRHRHN-UHFFFAOYSA-N	446.504	1.650	50	20	IDGD	
Cc1ccc(CC(=O)N2CCN(CC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)CC2)cc1	725811841	GTFDMHGLJSIDQN-UHFFFAOYSA-N	439.472	1.051	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)N1CCN(C(=O)CCC2CCCCC2)CC1	725871639	OUMBVVUVFWWMHG-UHFFFAOYSA-N	433.509	1.255	50	20	IDGD	
COc1ccccc1Nc1nc(Cl)c(C=NNC(=O)[C@H](C)NS(C)(=O)=O)s1	728437129	YHPLCKMNXMESHJ-VIFPVBQESA-N	431.927	1.937	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)Nc2cnn(CCN3CCOCC3)c2)c1C	728538039	AFRXXUBMEXXWQE-MOSHPQCFSA-N	426.521	1.826	50	20	IDGD	
COc1cccc([C@@H](C)N2CCN(CC(=O)NNC(=O)Cc3nc(C)cs3)CC2)c1	728930962	WROXROHBLCLALB-MRXNPFEDSA-N	431.562	1.529	50	20	IDGD	
COc1ccccc1-n1c(C)nnc1SCC(=O)NNC(=O)COc1ccccc1O	730782639	RKXBKFXEMNRRRQ-UHFFFAOYSA-N	443.485	1.608	50	20	IDGD	
CCN1CCN(Cc2ccc(CNC(=O)NNC(=O)COc3ccccc3O)cc2)CC1	730822766	IOMJGWKPMLDABO-UHFFFAOYSA-N	441.532	1.439	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)CCCN1C(=O)c2ccc(Br)cc2C1=O	731853035	PKTZJNUZRIUDNA-UHFFFAOYSA-N	434.250	1.318	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)C1CCN(S(=O)(=O)c2ccc(C(C)C)cc2)CC1	732083142	VMPSVBXJSVRZGQ-UHFFFAOYSA-N	433.534	1.703	50	20	IDGD	
COC(=O)N(C)c1ccccc1C(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	732330055	OYELITUTVNURNY-UHFFFAOYSA-N	430.373	1.415	50	20	IDGD	
COC(=O)c1cc(OC(=O)c2ccc(F)c(S(=O)(=O)N(C)C)c2)ccc1[N+](=O)[O-]	732652436	BGDKDQKAMKGBOG-UHFFFAOYSA-N	426.378	1.990	50	20	IDGD	
CC(=NNC(=O)c1ccc(O)c(Cl)c1)c1ccc(S(=O)(=O)NCCC(=O)O)cc1	734095030	YHBVFFNQPZHZOO-UHFFFAOYSA-N	439.877	1.953	50	20	IDGD	
CC(=O)Nc1ccsc1C=NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	735408058	BKPXHNWUIGFQIJ-UHFFFAOYSA-N	436.515	1.491	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCCC2)c1	740851819	XMGZXIXYPUHUAJ-UHFFFAOYSA-N	438.550	1.317	50	20	IDGD	
O=C(NNC(=O)c1ccncc1F)c1cccc(S(=O)(=O)NCc2ccccc2)c1	741207025	MDRNWGPPGFUEGI-UHFFFAOYSA-N	428.445	1.774	50	20	IDGD	
CN(CC(=O)NNC(=O)c1cccs1)C[C@@H](O)COc1ccccc1C(F)(F)F	741797895	BQXLGJPKJJKJOB-GFCCVEGCSA-N	431.436	1.900	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CSc2nnc(-c3cccs3)n2CCC(N)=O)c1	742451309	RUXNEPLYZIWZOW-UHFFFAOYSA-N	444.542	1.744	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)CS[C@H](C)C(=O)Nc2cc(C)on2)c1	744550639	LIOUSHBYOLPHPA-CYBMUJFWSA-N	434.474	1.356	50	20	IDGD	
Cc1cc(C)cc(N2CC[C@@H](C(=O)OCC(=O)NNC(=O)c3ccc(C#N)cc3)C2=O)c1	744850637	MMWWRBMPPJVSSW-LJQANCHMSA-N	434.452	1.532	50	20	IDGD	
CCc1nc(C(=O)OCC(=O)NNC(=O)c2ccc(C)cc2)nn1-c1ccccc1F	745237875	BVUKLTVRWMHGAT-UHFFFAOYSA-N	425.420	1.895	50	20	IDGD	
CCN(CC)C(=O)c1ccc(CNC(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)cc1	745465175	YEXKWYSSHAPOTA-UHFFFAOYSA-N	429.433	1.927	50	20	IDGD	
CO[C@@H](CNC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)c1cccc(Cl)c1	745911898	MLOHYDYIOLBZGM-INIZCTEOSA-N	429.864	1.919	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)NCc2cccc(C(F)(F)F)c2)cn1C	745977892	FEFZTENJBHNYEI-UHFFFAOYSA-N	434.396	1.523	50	20	IDGD	
O=C(CCN/C(O)=C1\N=CC=CC1=O)NNC(=O)c1cc(F)ccc1Br	746216274	QIALKTXQSALYMQ-JQIJEIRASA-N	425.214	1.266	50	20	IDGD	
CSc1nc(C)c(CCC(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c(C)n1	746271368	FLDNJGCLOFRXEP-UHFFFAOYSA-N	447.473	1.661	50	20	IDGD	
C[C@H](NS(=O)(=O)c1ccc(Cl)cc1)C(=O)NNC(=O)Cc1cn2ccccc2n1	746641155	MYJCSGFZVVEMIA-LBPRGKRZSA-N	435.893	1.045	50	20	IDGD	
CS(=O)(=O)CC[C@H](NS(=O)(=O)c1ccccc1)C(=O)NNc1ccccc1Cl	748314885	LFYIJNFMYYZHCI-INIZCTEOSA-N	445.950	1.565	50	20	IDGD	
COc1cc(OC)cc(N2CC[C@H](NC(=O)NNC(=O)COc3ccccc3OC)C2)c1	748659616	BQDGUKLCRYZYCQ-HNNXBMFYSA-N	444.488	1.701	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNc3cccc([N+](=O)[O-])c3C)CC2)cc1	748669981	AURSIMCKFSRAHO-UHFFFAOYSA-N	447.517	1.661	50	20	IDGD	
Cc1c(NNC(=O)c2sccc2S(=O)(=O)N2CCOCC2)cccc1[N+](=O)[O-]	748670802	ZQPXRZCFNQTZCU-UHFFFAOYSA-N	426.476	1.743	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)CNC(=O)c2cc(-c3ccccc3)on2)cc1	749325329	QCBYBRDEJMEWDI-UHFFFAOYSA-N	436.424	1.384	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)[C@H]2CCCN(S(=O)(=O)c3ccc([N+](=O)[O-])cc3)C2)o1	752523441	UJAUTNBANFBLRR-ZDUSSCGKSA-N	436.446	1.358	50	20	IDGD	
CC[C@H](CS(=O)(=O)c1ccccc1)NC(=O)NNC(=O)c1cc([N+](=O)[O-])ccc1O	752706160	SFXBGDSDAHDKHR-GFCCVEGCSA-N	436.446	1.497	50	20	IDGD	
CC(=O)NC[C@@H]1CCn2ncc(C(=O)NNc3nc(-c4ccccn4)nc4c3CCC4)c2C1	754245755	LCLONFOYKLISCL-OAHLLOKOSA-N	446.515	1.679	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)Nc1cccc(N2CCCS2(=O)=O)c1	755889129	KQSWAXQZJDBETR-UHFFFAOYSA-N	428.474	1.649	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)Nc1ccc(C)c(N2CCCS2(=O)=O)c1	756704819	MDJPMXKBWHNIFV-UHFFFAOYSA-N	448.501	1.775	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNS(=O)(=O)c1cccc(F)c1C(=O)OC	757647236	ZSZHOHLKWJSBIX-UHFFFAOYSA-N	426.422	1.400	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1cccnc1Oc1ccc(Cl)cc1Cl	758048371	SHHKNZUFABRZPB-VIFPVBQESA-N	447.300	1.879	50	20	IDGD	
CC(C)[C@H](NC(=O)C12CC3CC(CC(C3)C1)C2)C(=O)NNC(=O)C(=O)Nc1ccccn1	758827919	OWOHFOJESGEJLI-NGOBRMJYSA-N	441.532	1.525	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)CCNS(=O)(=O)c2ccc3c(c2)CCCC3)nc1	759721669	QDZIHMQDMPNMFV-UHFFFAOYSA-N	432.502	1.559	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC2(CC1)CC(C(=O)NNc1cc(Cl)nc(N)n1)=NO2	760491750	LOJDRKSYLHOLIN-UHFFFAOYSA-N	425.877	1.701	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)c2ccc(I)c(O)c2)cc1	761041760	STZPJIVIGAWQTE-UHFFFAOYSA-N	441.225	1.879	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)Cc1cc(F)cc2c1OCOC2	761388437	YGFRXKSPXUVJNT-UHFFFAOYSA-N	436.465	1.297	50	20	IDGD	
C[C@H](C(=O)NNC(=O)CNC(=O)c1cccnc1)c1cccc(C(=O)c2ccccc2)c1	762262985	JDELHLMKDLMENQ-INIZCTEOSA-N	430.464	1.994	50	20	IDGD	
CCCn1c(=O)n(CCC(=O)NNc2nccc(N3CCOCC3)n2)c2ccccc21	762865035	HXSFFXYSBLXBBE-UHFFFAOYSA-N	425.493	1.373	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C2(NS(=O)(=O)c3ccc(Cl)cc3)CCCCC2)n[nH]1	763121231	ZTPMWHUNXOBODC-UHFFFAOYSA-N	439.925	1.814	50	20	IDGD	
Cc1nnnn1[C@@H](Cc1ccccc1)C(=O)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	763172901	DSFMJRXEUMZJPT-IBGZPJMESA-N	434.435	1.756	50	20	IDGD	
COc1ccc(CN(C)C)cc1NC(=O)C(=O)NNC(=O)c1ccccc1Br	763484511	ZRRBDVWUHJZTGE-UHFFFAOYSA-N	449.305	1.919	50	20	IDGD	
O=C(NNC(=O)c1ccccc1O)C(=O)Nc1nc2cc3c(cc2s1)OC(F)(F)O3	763527682	QGQCYEKNMQZYHY-UHFFFAOYSA-N	436.352	1.723	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1Cl	763532373	XVUUMDCVHGOIFF-UHFFFAOYSA-N	443.935	1.947	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)Nc1ccc(OC2CCC2)c(F)c1	763574402	ANONWWHFKRKIEK-SFHVURJKSA-N	429.404	1.683	50	20	IDGD	
C=CCNC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2c(C)nc3ccccn23)cc1	763623786	HIUDZTHPVSFDQX-UHFFFAOYSA-N	435.444	1.350	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)cc1S(C)(=O)=O	763686879	WKCZDFHZGWGIRW-UHFFFAOYSA-N	439.877	1.217	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)C(C)C)c(C(=O)N2[C@H](C)CCC[C@H]2C)cc1OC	763820112	GFKICBRRLQNQJZ-ZIAGYGMSSA-N	448.520	1.849	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)C(=O)Nc1cnn(-c2cnc3ccccc3n2)c1	763838096	NHNDWQZMIOUPRG-UHFFFAOYSA-N	449.402	1.120	50	20	IDGD	
COC(=O)Cc1ccccc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1cccc(C)c1C	763852534	WRPAVWJVZXQPIP-HNNXBMFYSA-N	427.457	1.572	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)ccc1Cl	763857330	NJDOGPJTTDLAGD-JTQLQIEISA-N	437.811	1.819	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cc(C)n([C@H](C)C3CC3)n2)cc1	763878632	SDGAJNFZTDLJIN-HIFRSBDPSA-N	441.488	1.919	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccc(OCCN3CCCCC3)cc2)n1	763892962	OYUWMKISSDNORP-UHFFFAOYSA-N	442.520	1.151	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)C(=O)Nc2ccc(CN3CCCC3=O)cc2)cc1	763897728	DHBZKJWWLNNFLD-UHFFFAOYSA-N	440.525	1.996	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)C2=S=C3CCCCCC3=C2)cc1	763968394	OOLZGXMDYOKBGJ-UHFFFAOYSA-N	435.527	1.158	50	20	IDGD	
Cc1cc(-c2cccc(Cl)c2)ccc1NC(=O)C(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1	763997277	IGLXKSMJYYQUIR-HNNXBMFYSA-N	449.916	1.836	50	20	IDGD	
Cc1cc(SC(C)(C)C)ccc1NC(=O)C(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1	763999290	VEHNSDHPPOPDRT-GFCCVEGCSA-N	427.548	1.406	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)on2)ccc1-n1cnnn1	764004114	RRFIAZYIUHKBPV-UHFFFAOYSA-N	432.400	1.025	50	20	IDGD	
CC[C@H](C)C(=O)NNC(=O)C(=O)Nc1ccccc1S(=O)(=O)N(C)C1CCCCC1	764084799	WKLWZPIGMHQKAL-AWEZNQCLSA-N	438.550	1.772	50	20	IDGD	
CC[C@@H](C)C(=O)NNC(=O)C(=O)Nc1cccc(S(=O)(=O)N(C)C2CCCCC2)c1	764086081	SOWGMHZYHMKVFT-CQSZACIVSA-N	438.550	1.772	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2cccnc2N2CCCCC2)cc1	764126821	JWGDDCWQGHCGIS-UHFFFAOYSA-N	425.489	1.799	50	20	IDGD	
O=C(CC1CCCC1)NNC(=O)C(=O)Nc1ccc(N2CCOCC2)c2ccncc12	764178801	KDNHOPSRJBDUCI-UHFFFAOYSA-N	425.489	1.738	50	20	IDGD	
CO[C@H](C)C(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)CCCc2cccs2)c1	764340417	BVLYUQRJUCRPMC-CYBMUJFWSA-N	432.502	1.830	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)c2ncccc2C)sc2c1CCSC2	764385837	MEUBEMFYQIBIGB-UHFFFAOYSA-N	448.526	1.817	50	20	IDGD	
CO[C@@H]1Cc2ccc(NC(=O)C(=O)NNC(=O)c3cc(-c4ccc(F)cc4)[nH]n3)cc2C1	764389058	XOETXOFAVMWUSK-QGZVFWFLSA-N	437.431	1.729	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1cc(C(=O)N(C)C)ccc1C	764392876	ACFUYOCITMNPTD-UHFFFAOYSA-N	444.513	1.584	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1cccc(-c2nnco2)c1	764394113	WPLLZMPUYWOVFV-UHFFFAOYSA-N	427.442	1.623	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)ccc1C(=O)NC(C)C	764402103	XVQZXXGCNJUNTQ-UHFFFAOYSA-N	444.513	1.717	50	20	IDGD	
COCCOc1cc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2F)ccc1OC	764411196	SEKAJCHIJIEOHS-UHFFFAOYSA-N	439.827	1.913	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C[C@@H]1CN(C(=O)OC(C)(C)C)CCO1	764523154	LNTISAKIHWOYJO-OAHLLOKOSA-N	437.493	1.638	50	20	IDGD	
CC(=NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1)c1cc(C(N)=O)n(C)c1	764831965	SPQHIZLQHDZBQM-UHFFFAOYSA-N	430.940	1.435	50	20	IDGD	
Cc1ccc(CN2C[C@H](C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)CC2=O)cc1	765312909	HAJAFFPNTSQELE-QGZVFWFLSA-N	432.521	1.796	50	20	IDGD	
O=C(CCn1cc(Cl)cn1)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	765757510	UHJPBKAGMDZRMP-UHFFFAOYSA-N	439.347	1.545	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)CO[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)c1	767771931	UTAWEFVPUOKWDI-OAHLLOKOSA-N	437.493	1.881	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNS(=O)(=O)c1c(Cl)cc(F)cc1Br	768048459	SDRRVCGTURABGR-UHFFFAOYSA-N	444.710	1.856	50	20	IDGD	
Cc1c(C(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)nnn1Cc1ccc(F)cc1	768227482	ZZLBBDLTEHURQL-UHFFFAOYSA-N	446.464	1.644	50	20	IDGD	
O=C(NNC(=S)Nc1ccccn1)c1cccc(S(=O)(=O)NCc2ccco2)c1	768580761	IOLGPLWXJIKPFR-UHFFFAOYSA-N	431.499	1.785	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)N[C@H]2CCO[C@@]3(CCSC3)C2)c2ccccc2c1=O	769229688	FITWYJOREVAZEY-QKKBWIMNSA-N	445.545	1.976	50	20	IDGD	
O=C(NNc1ccc(Cl)nn1)Nc1ccc(F)c(S(=O)(=O)N2CCOCC2)c1	769973914	KVGCQNRVJSNCMX-UHFFFAOYSA-N	430.849	1.439	50	20	IDGD	
O=C(COC(=O)c1ncoc1-c1ccc(F)cc1)NNC(=O)[C@@H]1COc2ccccc2O1	770471094	DFOKIRYWIPNXHP-INIZCTEOSA-N	441.371	1.625	50	20	IDGD	
CS(=O)(=O)c1cc(S(=O)(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c(Cl)s1	770634019	HDTCNDGPWSLTDX-UHFFFAOYSA-N	439.880	1.337	50	20	IDGD	
CCN1CCN(c2cccc(NC(=O)C(=O)NNC(=O)c3c(C)nc4ccccn34)c2)CC1	770773059	CMSYQQMVTPQKBF-UHFFFAOYSA-N	449.515	1.184	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNS(=O)(=O)c1cc(Br)sc1Cl	771142707	FJZAYGNMQJWURU-UHFFFAOYSA-N	432.749	1.778	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)c1cnn(CC(=O)NC2CCCC2)c1	772630701	LCJZESWQVQYKCA-UHFFFAOYSA-N	437.504	1.315	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCC(=O)NNc2nccnc2C(C)C)cc1OCC	772874794	GCYALKIVTLWKSU-UHFFFAOYSA-N	437.522	1.819	50	20	IDGD	
O=C(NNc1ccccn1)C(=O)Nc1ccc(OCCN2C(=O)c3ccccc3C2=O)cc1	773479390	UJCPYGKHPDMYIR-UHFFFAOYSA-N	445.435	1.838	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)C(=O)Nc1cccc2cc[nH]c12	773492593	OCKHAVBGIXTVBY-UHFFFAOYSA-N	434.500	1.466	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)Cc2c[nH]c3ccccc23)ncc1Br	773530095	TUEOJZWSPDSCCY-UHFFFAOYSA-N	430.262	1.962	50	20	IDGD	
CCOc1ccc(C(=O)NNS(=O)(=O)c2ccc(C3(C(=O)OC)CC3)cc2)cc1OC	776271060	HFWYLJBUINHCKD-UHFFFAOYSA-N	448.497	1.922	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)[C@@H]1CCCN1C(=O)C(F)(F)F	776312793	OZOXCJKTNRAHMX-NSHDSACASA-N	438.200	1.529	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)CCC(=O)N2CCN(c3ccccn3)CC2)c1	776534858	VVWUGWXPGJQWKV-UHFFFAOYSA-N	431.518	1.057	50	20	IDGD	
CSc1ccc(C(=O)N2CCN(S(=O)(=O)CBr)CC2)cc1[N+](=O)[O-]	777777113	FGGDGGGTCHWYPR-UHFFFAOYSA-N	438.325	1.757	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)c3cc([N+](=O)[O-])c4nsnc4c3)nc21	778268941	JDQMYWLYFNTEQN-UHFFFAOYSA-N	429.422	1.957	50	20	IDGD	
CC(C)N(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)CNC(=O)OC(C)(C)C)cc1	778434325	ZYSMOYUFFKGGRA-UHFFFAOYSA-N	428.511	1.001	50	20	IDGD	
COC[C@@H](C)n1c(C)cc(/C=C(\C#N)C(=O)NS(=O)(=O)c2c(C)nn(C)c2OC)c1C	778852616	OLUHRSBVMFQZLE-LFMVTYOGSA-N	449.533	1.775	50	20	IDGD	
C[C@@H](NC(=O)CC(C)(C)C)C(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	779414624	SWVALHURSIPCGG-CQSZACIVSA-N	427.546	1.563	50	20	IDGD	
N#Cc1ccc(N2CCC[C@@H](NC(=O)NNC(=O)c3cc(Br)c[nH]3)C2=O)cc1	779968122	ONEVCJFNNYPONJ-CQSZACIVSA-N	445.277	1.788	50	20	IDGD	
COc1cccc(NNC(=O)Nc2cccc(S(=O)(=O)N3CCCN(C)CC3)c2)n1	780553639	ZIRZWZBRDRRTCS-UHFFFAOYSA-N	434.522	1.565	50	20	IDGD	
CN1CCC/C1=N\S(=O)(=O)c1cccc(NC(=O)C(=O)NNc2ccccc2F)c1	782706044	OSUMKTSXXZVQPR-JJIBRWJFSA-N	433.465	1.720	50	20	IDGD	
CC(C)c1nccn1Cc1cccc(NC(=O)C(=O)NN[C@@]2(C)CCS(=O)(=O)C2)c1	783427923	URFNPSMHOSDSQB-FQEVSTJZSA-N	433.534	1.191	50	20	IDGD	
N#Cc1cccnc1-n1cc(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2Cl)cn1	784382995	WGMDUUHTAQQXQF-UHFFFAOYSA-N	426.780	1.782	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)c1cc(Cl)sc1S(N)(=O)=O	785690366	FUKAHJRRYFLYJF-UHFFFAOYSA-N	441.922	1.422	50	20	IDGD	
CN(NC(=O)Nc1cnn(-c2ccccc2)n1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	785862327	QYQGCMANXDBLSX-UHFFFAOYSA-N	444.496	1.908	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCc2ccc(CCN(C)C)cc2)cc(OC)c1OC	786103822	ZCSFWPDRSJTYLM-UHFFFAOYSA-N	430.505	1.961	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)C(=O)Nc1cc(Cl)ccc1OCC1CCC1	786413645	DZWCALLJHFGFTP-LBPRGKRZSA-N	443.909	1.040	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CNC(=O)OC(C)(C)C)cc(Br)c1OC	786541967	GBEAEUJRLZVPPG-UHFFFAOYSA-N	432.271	1.752	50	20	IDGD	
Cc1ccc(S(=O)(=O)Nc2cccc(C(=O)NNC(=O)N3CCN(C)CC3)c2)cc1F	788166520	PBNDVHKQQCDULD-UHFFFAOYSA-N	449.508	1.537	50	20	IDGD	
CS(=O)(=O)[C@H]1CCCC(=NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)C1	788407879	GWQZOCODXUDRLN-INIZCTEOSA-N	427.548	1.544	50	20	IDGD	
CCOC(=O)c1oc2ccc(S(=O)(=O)NNC(=O)CNC(=O)c3ccco3)cc2c1C	788748460	SJUJQQUKJNRKRU-UHFFFAOYSA-N	449.441	1.250	50	20	IDGD	
Cn1c(N)c(C(=O)/C(C#N)=C\c2cccc(I)c2)c(=O)n(C)c1=O	790587407	TWGMJIPIEKVWGO-POHAHGRESA-N	436.209	1.061	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)[C@@H]2CC(c3cc(OC)ccc3OC)=NO2)cc1	792630266	UOBFRXPMIDJEMH-IBGZPJMESA-N	428.445	1.465	50	20	IDGD	
Cn1ccc2ccc(NC(=O)C(=O)NNC(=O)c3ccc(Br)s3)cc2c1=O	793022292	UCPMVTXIAQENIO-UHFFFAOYSA-N	449.286	1.762	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)N(CC(F)F)CCS2	793024173	CELHXRYRKFKUEB-NSHDSACASA-N	446.476	1.001	50	20	IDGD	
CC(C)(C)CC(=O)NNC(=O)C(=O)Nc1ccc2c(c1)N(CC(F)F)C(=O)CS2	793024962	GRJKORSPHUJKLM-UHFFFAOYSA-N	428.461	1.913	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)NCc2ncnn2CC)c2ccccc2c1=O	793461848	NRKLJYPWKYVKTG-UHFFFAOYSA-N	426.481	1.342	50	20	IDGD	
O=C(CCn1cnccc1=O)NNC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1	794233358	CTOCZESWRNSYLD-UHFFFAOYSA-N	429.440	1.342	50	20	IDGD	
CCNC(=O)N(C)c1cccc(NC(=O)C(=O)NNC(=O)Cc2ccc(Cl)cc2)c1	796999285	KGOMRRATULYOCX-UHFFFAOYSA-N	431.880	1.834	50	20	IDGD	
CC(C)Oc1ccc(NC(=O)C(=O)NNC(=O)c2cccc3cccnc23)cc1C(N)=O	797001713	KCHFMPKWLOKDMM-UHFFFAOYSA-N	435.440	1.521	50	20	IDGD	
C[C@@H]1C[C@@H](C)[C@@H](C(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)O1	800320129	RNWJEHRFJASVPQ-CLCXKQKWSA-N	431.514	1.740	50	20	IDGD	
O=C(NNC(=O)c1ccc(Br)s1)C(=O)Nc1ccc(OC(F)F)nc1	802566474	RKTXXJVYTOGQPY-UHFFFAOYSA-N	435.206	1.907	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)N1CCC[C@H]1COC(=O)NC1CCCCC1	805043373	IXSYALVWMMBLDW-HNNXBMFYSA-N	435.481	1.274	50	20	IDGD	
Cc1cc([N+](=O)[O-])ccc1NNC(=O)c1cc(S(=O)(=O)N2CCOCC2)ccc1F	805384910	TVBUVFYZELQUJK-UHFFFAOYSA-N	438.437	1.820	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3ccc4c(c3)N(C)CCO4)cc2)CC1	806782018	JDKYRLZOIISHSI-UHFFFAOYSA-N	445.545	1.208	50	20	IDGD	
O=C([C@H]1CC(c2cccc(F)c2)=NO1)N1CCN(S(=O)(=O)CBr)CC1	807196466	LTJQSXMLNKZJQR-CQSZACIVSA-N	434.287	1.145	50	20	IDGD	
Cc1ccc(S(=O)(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1C(=O)OC(C)C	808070471	XBOBCSOTJCXOQW-UHFFFAOYSA-N	444.473	1.159	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccccc1F)NNC(=O)c1cc(Br)ccc1O	810449234	KUTBMWGXSFKAHT-UHFFFAOYSA-N	446.254	1.033	50	20	IDGD	
O=C(CNS(=O)(=O)c1c(F)cccc1F)NNC(=O)c1cc(-c2cccs2)[nH]n1	810585115	LLBHCJOIDPEBNR-UHFFFAOYSA-N	441.441	1.156	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)NCc1cccc(N2C(=O)NC3(CCCC3)C2=O)c1	811954806	DHRUAAPMDBWXBV-UHFFFAOYSA-N	436.472	1.524	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@H]1CC[C@H](CNC(=O)NNC(=O)C(=O)Nc2ccccn2)CC1	812436201	FTZMOZXUMRYPEA-SHTZXODSSA-N	448.524	1.682	50	20	IDGD	
CNC(=O)COc1ccc(NC(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)c(C)c1	812976376	BSXDVMXQLCEGCK-UHFFFAOYSA-N	435.506	1.519	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)cc1Cl	813033917	REQPXKPFRNZSAY-UHFFFAOYSA-N	426.882	1.681	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)CNC(=O)c1cccs1)c1ccc(N2CCCOC2=O)cc1	814294310	KQMKDIPRXGPVBG-ZDUSSCGKSA-N	445.501	1.916	50	20	IDGD	
CC(=NNC(=O)Nc1ccc(S(N)(=O)=O)cc1)c1ccc(OCC(=O)N(C)C)cc1	814969240	IGFSBNIGCYFVGP-UHFFFAOYSA-N	433.490	1.347	50	20	IDGD	
CC(C)CC(=O)NNC(=O)C(=O)Nc1ccc([N+](=O)[O-])c(I)c1	815567367	WASKKPRQLIMSPB-UHFFFAOYSA-N	434.190	1.331	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNc2ccc(S(C)(=O)=O)cc2)cc1)[C@H]1C[C@@H]1C	815585180	ADPKSNMRPIDWHK-DJJJIMSYSA-N	444.513	1.933	50	20	IDGD	
CCOc1c(Cl)cc(NC(=O)C(=O)NNC(=O)[C@H]2CCc3nncn3C2)cc1Cl	815692337	ONVXPVBODLRZLQ-VIFPVBQESA-N	441.275	1.332	50	20	IDGD	
CCS(=O)(=O)N[C@H](CCSC)C(=O)NNC(=O)CC12CC3CC(CC(C3)C1)C2	818823839	FFCADIHHUXAHDW-LZUXJJCOSA-N	431.624	1.801	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)c1ccccc1)C(=O)NNC(=O)CNc1ccccc1	823327487	NKXDATFXIPAYBO-QGZVFWFLSA-N	436.559	1.346	50	20	IDGD	
CC(C)CNS(=O)(=O)c1ccc(Br)c(C(=O)N2CC[C@H](B(O)O)C2)c1	864234396	UROIKSQBJWIDQA-NSHDSACASA-N	433.133	1.072	50	20	IDGD	
Nc1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)cc1[N+](=O)[O-]	912643334	VHHAPOHGUURIKD-UHFFFAOYSA-N	447.473	1.426	50	20	IDGD	
C=CCNC(=S)NNC(=O)c1cccc(NS(=O)(=O)c2ccc3c(c2)OCCO3)c1	913435473	GUENQRLFRILCFJ-UHFFFAOYSA-N	448.526	1.554	50	20	IDGD	
O=C(NNC(=O)c1ccc2nc(O)[nH]c2c1)c1cccc(S(=O)(=O)N2CCCCC2)c1	914748433	CTIXAJXOZKDIQI-UHFFFAOYSA-N	443.485	1.518	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NC[C@H](c2cccs2)N2CCOCC2)cc1OC	915893268	IBWVMKOCWKHKBT-OAHLLOKOSA-N	434.518	1.783	50	20	IDGD	
COc1ccc([C@H](CNC(=O)NNc2ccc(-n3cccn3)nn2)N(C)C)cc1OC	915894653	MVKWONVWXILMPK-HNNXBMFYSA-N	426.481	1.609	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NCc2ccnc(N3CCCCC3)c2)c2ccccc2c1=O	916255019	WBSYIWFODQQBQF-UHFFFAOYSA-N	435.488	1.463	50	20	IDGD	
O=C(NCCNc1ncc(Cl)cc1Cl)NNC(=O)c1ccc(-n2cnnn2)cc1	916521952	UNHRUVUMFOIJRL-UHFFFAOYSA-N	436.263	1.420	50	20	IDGD	
Cc1nn([C@@H]2CCS(=O)(=O)C2)c(C)c1C=NNC(=O)[C@H](C)CN1C[C@H](C)O[C@@H](C)C1	917028280	DHOZTIUIMMIZKM-LDDOYCOJSA-N	439.582	1.055	50	20	IDGD	
O=C(CCOCc1ccccc1)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	918201845	OOLRNSSXKITTHA-UHFFFAOYSA-N	431.514	1.839	50	20	IDGD	
COC(=O)COc1ccc(C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)cc1	918280710	VVAJKAYGXNMUOP-UHFFFAOYSA-N	438.440	1.604	50	20	IDGD	
C[C@@H](C(=O)N(C)CC(=O)NNC(=O)c1ccc(F)cc1Br)n1cccn1	919849223	NNDRCJHRDPHHBD-JTQLQIEISA-N	426.246	1.265	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)[C@@H]1CS[C@@H](Cc2ccccc2F)C(=O)N1	920212945	HORTXOVNFZQFSA-WMZOPIPTSA-N	431.489	1.367	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2cc(F)ccc2NS(C)(=O)=O)c2ccccc2c1=O	920418478	WXSMMJQGHOVPCS-UHFFFAOYSA-N	447.448	1.002	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CS[C@@H](Cc2ccccc2F)C(=O)N1)c1cccc([N+](=O)[O-])c1	935812232	ICUFFJRRLOKURZ-HOTGVXAUSA-N	432.433	1.338	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)OCC(=O)N2CCN(C(=O)OC(C)(C)C)CC2)cc(C#N)n1C	1317986769	TZTDSKRMENZFMC-YVLHZVERSA-N	441.488	1.735	50	20	IDGD	
Cc1c(I)cccc1NC(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1	1320263369	IXQRWUYGFKDWPQ-SECBINFHSA-N	437.259	1.187	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2ccc([S@](C)=O)cc2)cc1	1342407935	KPKBFDWOCOAYLR-NDEPHWFRSA-N	438.531	1.206	50	20	IDGD	
Cc1nc[nH]c1CSCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2	1778913877	UOWVPCMATOSRHH-SJKOYZFVSA-N	445.383	1.565	50	20	IDGD	
CCn1ccc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](F)Br)C2)n1	1780771650	OORQQNYEHGIRLT-JKIFEVAISA-N	431.306	1.721	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(OC)c(N(C)C)c3)C2)C1	1781129042	ZSASMHQTLGIPJY-HRAATJIYSA-N	439.940	1.459	50	20	IDGD	
O=C(Cc1cccc(Cl)n1)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781325825	JAYKASWSROIBMO-GOEBONIOSA-N	434.693	1.798	50	20	IDGD	
O=C(c1cc2ncccc2[nH]1)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781333840	SCDHUCQSSDDBHW-YOEHRIQHSA-N	425.258	1.697	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnc(OCF)cn1)C2	1782170978	LQRTYWKUIZCOCD-ZXYWRSMDSA-N	444.891	1.164	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(O)c(F)c1)C2	1782177942	AYLDMXANXMZFEB-JNAXZKDPSA-N	428.888	1.913	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)COc3ccc(O)cc3)CCO2)C1	1783338057	CXFOFRKVUZVHMY-VQIMIIECSA-N	441.322	1.774	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccn(C(C)(C)C)n3)CCO2)C1	1783531711	BURJPVKHFHQNMP-ACJLOTCBSA-N	427.343	1.865	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3csc4c3CCCO4)CCO2)C1	1783874232	AYJBGOKRIYDXAW-BEFAXECRSA-N	428.938	1.770	50	20	IDGD	
COc1ncccc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]2C1	1783968540	WQFHVGZCAIORPV-VRKREXBASA-N	440.338	1.715	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3cnccn3)[C@H]2C1	1784242392	FSKWGMAJLNRNMP-SDADXPQNSA-N	425.327	1.030	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)N2CC[C@@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)c1	1785113896	WSXOPBJXHLPJRB-OAQYLSRUSA-N	433.581	1.940	50	20	IDGD	
CC(C)(C)[C@H](O)C(=O)Nc1ccc(C2(NC(=O)c3cnccc3C(=O)NN)CCC2)cc1	1786098050	CSSVJHBPLWVQJH-GOSISDBHSA-N	439.516	1.840	50	20	IDGD	
CCOC(=O)N[C@H](O)C(=O)Nc1ccc(C2(NC(=O)[C@@H](F)Br)CCC2)cc1	1789407114	WXDNEGKGZOGQOJ-IUODEOHRSA-N	446.273	1.876	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cn3c(=O)n(C)c4ccccc43)C[C@@H]21	1789859597	GZMIWMKKNDXGSM-FPXQBCRKSA-N	448.951	1.337	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3C[C@@]34C(=O)Nc3ccccc34)C[C@@H]21	1789864915	KDWBQPPSDSCXRE-TUKDEAEVSA-N	445.947	1.894	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]2C1	1789925238	CSXHUEACIBKWPC-MNXVOIDGSA-N	425.371	1.508	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)C3(O)CCC3)C[C@@H]21	1790962212	QUOJRSATYMLJCM-CWVYHPPDSA-N	431.371	1.691	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nn(C)c4c3CCC4)C[C@@H]21	1791055822	IYGWPXHYRDYEOO-DUPGQFARSA-N	439.354	1.286	50	20	IDGD	
C#CC[C@@H](NC(=O)OC(C)(C)C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21	1792257970	QZCIPHXNJVSVDJ-QMHWVQJVSA-N	445.919	1.417	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3ccccn3n1)C2	1792868096	PMKHLRJASOXJDS-ZJOBFFGXSA-N	435.322	1.569	50	20	IDGD	
CC(C)[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](O)CCl)c1ccc(F)cc1	1792982891	VSOCXHSJPGSMLO-PTIUUAQKSA-N	426.916	1.755	50	20	IDGD	
C[C@@H](CBr)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cn1cc([N+](=O)[O-])cn1)C2	1792986938	GEDIQCKVTYAVGW-RVMXOQNASA-N	428.287	1.461	50	20	IDGD	
C[C@@H](CBr)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CNC(=O)c1cccnc1)C2	1792987325	NMQPJJMHFFERON-HNKHHVNMSA-N	437.338	1.481	50	20	IDGD	
C[C@@H](CBr)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CNC(=O)C(F)(F)F)C2	1792993495	KYGQJBQVVZBSCU-MMWGEVLESA-N	428.249	1.334	50	20	IDGD	
C[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCl	1793111438	IUCWXBAVDKMAIS-CVWVJMLGSA-N	443.972	1.727	50	20	IDGD	
Cc1ccc(CCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)s1	1794312034	RMZCKDMIGTYOKJ-REPLKXPHSA-N	426.347	1.621	50	20	IDGD	
CN(C)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2	1794472019	ASAZNYFEISNPGM-BAESOJJISA-N	429.290	1.041	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnccc1N(C)C	1794473144	ZORDAEFXUAEKDF-NFFDBFGFSA-N	425.327	1.134	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3cc(O)ccc3n1)C2	1795114523	RQXLYVIAPOGGIY-HBCWATKFSA-N	448.317	1.929	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](CC1CC1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Cl	1796368212	FXPRNUWYISUEPS-YIDVYQOGSA-N	447.935	1.804	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ncn(-c3ccccc3)n1)C2	1797955877	MFYKRFRNAWWUOD-HGKCTWBKSA-N	443.580	1.322	50	20	IDGD	
COC(=O)[C@H]1CCC[C@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CO[Si](C)(C)C)C1	1797956791	ZMASIIWLSVKXMX-CWLGOENISA-N	440.613	1.407	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc[nH]1	1797998938	CQYCYNIQVJATMI-XRGAULLZSA-N	440.928	1.350	50	20	IDGD	
Cc1noc(C)c1CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Br	1799344552	NZADDDCMWNMRJK-NOXHYTERSA-N	432.290	1.504	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnc2c(c1)CCNCC2	1800243109	GQUIDNOYHKIQBE-AJYBTWMASA-N	434.968	1.381	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)CN(CC)CC)C2	1800643620	YISZRQHLRFUSTD-NQNKBUKLSA-N	432.403	1.727	50	20	IDGD	
COc1cc(C)c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)c(C)c1	1800650938	WLHAOJHBGLEZDM-ACDBMABISA-N	436.317	1.557	50	20	IDGD	
COc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)Br)cc1OC	1800760187	GRIFXPQZXJLRGR-DPYKFYPSSA-N	441.322	1.690	50	20	IDGD	
CCOC(=O)[C@@H]1CCC[C@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C(Cl)Cl)C1	1801015946	ZLUXOIJCHXKWOY-ZQNQSHIBSA-N	435.348	1.749	50	20	IDGD	
CN(C)C(=O)c1cccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C(Cl)Cl)c1	1801021414	MPPIWBXOQHVVCX-QDMKHBRRSA-N	428.316	1.395	50	20	IDGD	
Cc1ccc2c(/C=C/C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@@H](O)CCl)C4)c[nH]c2c1	1802182459	BQXCXODTGKTWBZ-RNNGLFPASA-N	431.920	1.679	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc3ncsc13)C2	1802337595	PQHJZOBFZKRVPH-QDMKHBRRSA-N	429.546	1.921	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@H]1CCN(C(=O)Cn2cncn2)[C@@H]1c1cccnc1	1803008209	JIIKONWYJDRRCN-FRFSOERESA-N	435.326	1.410	50	20	IDGD	
C=CCC(CC=C)C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1803082068	NICHMTPVDRQSMV-FYYLOGMGSA-N	447.344	1.849	50	20	IDGD	
CN(C)c1ccc(C(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)nc1	1803140067	ALRFNTVSUVNHGO-MNEFBYGVSA-N	431.924	1.462	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccnc3ncccc23)[C@@H]1c1cccnc1)[C@H](O)CCl	1803147822	MEEFBHUDOASWTR-KFKAGJAMSA-N	439.903	1.944	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC2(CCCN(C(=O)[C@@H](O)C(C)C)C2)CC1	1805643002	PFUYAEGIZQLATP-MRSJDWDVSA-N	431.537	1.369	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCCC2(CCN(C(=O)[C@H](C)NS(=O)(=O)CC)CC2)C1	1806154018	QWONPCZRWAXZIE-JKSUJKDBSA-N	436.018	1.953	50	20	IDGD	
O=C(CCBr)NC[C@H]1CCN(C(=O)c2cc[n+]([O-])cc2)[C@H]1c1cccnc1	1806344289	ZNSCJHPXAPNCHN-AEFFLSMTSA-N	433.306	1.820	50	20	IDGD	
COc1ccc(CC(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)cc1	1806582845	FDCHDVPSEBBQCY-CUWPLCDZSA-N	431.920	1.938	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCC2(CCCN(C(=O)CN3CCS(=O)(=O)CC3)C2)CC1	1806699381	HVDVNJICLYCLST-UHFFFAOYSA-N	448.029	1.213	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H](CNC(=O)Cn2cnnn2)[C@H]1c1cccnc1	1807614630	RVZFVMTZBPYPRR-UNEWFSDZSA-N	426.308	1.010	50	20	IDGD	
O=C(c1ccc(-n2cnnc2)cc1)N1CCCC2(CCN(C(=O)[C@@H](O)CCl)CC2)C1	1809624105	RZSSMMODCBRNOW-SFHVURJKSA-N	431.924	1.712	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)c1ccn2cncc2c1	1809965792	FIZTWSMWJFBPEI-QXAKKESOSA-N	427.892	1.649	50	20	IDGD	
C=CC[C@H](C(=C)C)C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1810171180	FGJWXZFREANYMK-WWNPGLIZSA-N	447.344	1.849	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)C2=CCCC2)[C@@H]1c1cccnc1	1810299056	NHUDNIBASOTWKQ-YLJYHZDGSA-N	434.500	1.510	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)C2(F)CCC2)[C@@H]1c1cccnc1	1810308761	NSRDXBNQMFUDCC-CRAIPNDOSA-N	440.479	1.292	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@H]1CCN(C(=O)COc2cccnn2)[C@@H]1c1cccnc1	1810547812	IYWUCZHLNFALEV-DYESRHJHSA-N	443.580	1.808	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)C(OC)OC)[C@@H]1c1cccnc1	1812773525	GEFXNPRTSKAAKG-QLFBSQMISA-N	428.327	1.880	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2c(O)cc(O)cc2O)[C@H]1c1cccnc1	1813034500	NXKZISLCDGVYHC-WTANOLMUSA-N	449.891	1.772	50	20	IDGD	
C[C@H]1CC[C@H](C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)CC1	1813546340	OYEWVRGHTFWYJG-PGCKSFNISA-N	449.360	1.907	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC[C@H]1c1cc(NC(=O)C2=NN(C)C(=O)CC2)n[nH]1	1815626267	XMSXLVGNZCHTCM-MFKMUULPSA-N	439.314	1.793	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CN)n[nH]1	1817237657	IHKYYPIGVIPXBU-QWHCGFSZSA-N	428.921	1.493	50	20	IDGD	
Cc1cc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cccc(B(O)O)c2)CC3)ccn1	1820482463	LOBOIRAJOKIEBR-INIZCTEOSA-N	436.302	1.066	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](O)c2ccccc2)[nH]n1	1822413043	NINUELZUUKUNET-LAUBAEHRSA-N	442.520	1.508	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CN2C(=O)C=CC2=O)n[nH]1	1822530730	ZCQLXZQLEOOPLU-KZULUSFZSA-N	442.303	1.563	50	20	IDGD	
C[C@@H](C(=O)Nc1nc2c(s1)C[C@H](NC(=O)C(C)(C)CCl)CC2)N1CCN(C)CC1	1822685294	YAALCBCVBVHCFS-UONOGXRCSA-N	442.029	1.956	50	20	IDGD	
CC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CNC(=O)c1cc(C)on1)CC2	1822849172	HPTDPHJABXHEPC-WDEREUQCSA-N	439.925	1.799	50	20	IDGD	
CCOc1ccc(C(=O)N[C@H]2CCc3nc(NC(=O)[C@@H](Cl)COC)sc3C2)nn1	1826003282	JVRFYUHIFALTHO-QWRGUYRKSA-N	439.925	1.811	50	20	IDGD	
CNC(=S)NCCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCBr)CC1	1828928521	JJRSBOPIMMAQLF-OAHLLOKOSA-N	447.443	1.875	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCBr)C2)C1	1830359557	RZFFADQIPHEJJG-MRXNPFEDSA-N	425.751	1.493	50	20	IDGD	
CC(=O)O[C@H](C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2)C(C)C	1830361730	BBDWOGXUOATKLS-OXJNMPFZSA-N	432.945	1.296	50	20	IDGD	
C/C(=C\c1ccc(C)o1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1830732090	UPSGWONONDFZSK-OHVBHTQWSA-N	426.897	1.047	50	20	IDGD	
CC(C)Cc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)cc1	1830733704	RIMNHDKAFTVEJK-KNQAVFIVSA-N	438.952	1.555	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3c(C)nn(C)c3C)C2)C1	1831659192	OEAIZTHCSKEZMX-NQIIRXRSSA-N	440.972	1.443	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)[C@H]2CCCS2)CC1	1832433920	LYABZFSCYQODAU-WOJBJXKFSA-N	430.379	1.495	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CSc3ccncc3)CCO2)C1	1832709556	LAPQYYGBZHJJOO-APWZRJJASA-N	427.954	1.648	50	20	IDGD	
COc1ncccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1	1834131222	STWXQNKOGIJSKR-MOPGFXCFSA-N	446.331	1.397	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3ccnnc3)CC2)CC1	1834142528	AGCCTUDSYMKSOK-QGZVFWFLSA-N	438.370	1.835	50	20	IDGD	
Cc1oc(C(C)(C)C)cc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1	1834195638	OMWYAGHREXFBKN-HRAATJIYSA-N	442.940	1.555	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(O)n3)CCO2)C1	1834197731	VKASFADZOTZPPV-SCLBCKFNSA-N	442.310	1.031	50	20	IDGD	
Cc1ncsc1C(=O)N1CCO[C@]2(COCCN(C(=O)CCBr)C2)C1	1834265391	UWSWFGHQCKTSLO-INIZCTEOSA-N	432.340	1.307	50	20	IDGD	
C[C@@H](C(=O)N1CCC(N2CCC(NC(=O)CCBr)CC2)CC1)n1ccnn1	1834424325	RMWCFAQNRBLCOA-AWEZNQCLSA-N	441.374	1.196	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)CC(C)(C)O)CC2)CC1	1834572298	UWJOSWSYPTZKIK-AWEZNQCLSA-N	432.403	1.750	50	20	IDGD	
Cc1cccc(C(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)c1	1834798363	MEFGNDOEMBKPTG-UHFFFAOYSA-N	449.360	1.174	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@H](COC)NC(C)=O)CC2)CC1	1835840434	QGOMUVSSCJENLM-OALUTQOASA-N	445.004	1.117	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3cscn3)CCO2)C1	1836044606	BBEDMINJXCQUAO-YOEHRIQHSA-N	446.367	1.316	50	20	IDGD	
CCc1nc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](C)CBr)C3)C2)co1	1838131661	LCFPMSGUWZWBFP-SCLBCKFNSA-N	444.326	1.338	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cc4n(n3)CCC4)CC2)CC1	1838341807	IOKLCGGAANEIPL-SFHVURJKSA-N	438.956	1.695	50	20	IDGD	
CC(C)n1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@](C)(Cl)CCl)C3)C2)n1	1838788338	UKMAWACHEUAKQV-MOPGFXCFSA-N	447.363	1.770	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(F)ccc3OC)C2)C1	1839148590	CZEXVCJGCAGJJE-JXFKEZNVSA-N	428.888	1.922	50	20	IDGD	
Cc1ccc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)cn1	1839150327	JJKIHHKTTQPFRD-WOJBJXKFSA-N	444.359	1.625	50	20	IDGD	
O=C([C@@H](F)Br)N1CCO[C@]2(COCCN(C(=O)C3(C(F)(F)F)CC3)C2)C1	1839200597	KUKLNSJVKCJIFK-ZWNOBZJWSA-N	447.223	1.476	50	20	IDGD	
O=C([C@@H]1[C@H]2C=CS[C@@H]21)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1839699900	XJMRWGHEHXGKOU-XRMRDTNMSA-N	435.315	1.008	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2ccc([N+](=O)[O-])o2)C1	1840965593	HZWAUIDYTPMXOT-CIAFOILYSA-N	428.405	1.139	50	20	IDGD	
O=C1CC[C@@H](C(=O)N2CCCC23CN(C(=O)[C@@H](Br)Cc2ccccc2)C3)CN1	1841115052	YWRTUQABHPZCSO-SJORKVTESA-N	448.361	1.722	50	20	IDGD	
CC(=O)N[C@H](Cc1cc(F)c(F)c(F)c1)C(=O)N1CCCC12CN(C(=O)[C@@H](F)Cl)C2	1845019810	SGBLDXKZSMRXFY-GDBMZVCRSA-N	449.832	1.889	50	20	IDGD	
C[C@@H](NC(=O)c1ccc(F)cc1)C(=O)N1CC2(CCCN2C(=O)[C@@H](F)Br)C1	1845219113	VTAYDJYGNVXXNS-BXUZGUMPSA-N	444.276	1.838	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)NC(=O)OC(C)(C)C	1847500671	LEEBMABUCPHNQB-MROQNXINSA-N	434.331	1.062	50	20	IDGD	
COC(=O)C1(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CC1	1848098467	CUEQIDLYWJYLKW-IHRRRGAJSA-N	443.928	1.274	50	20	IDGD	
C[C@H](NS(=O)(=O)c1ccc(Cl)cc1)C(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	17330063	FUTXKIAWHSWQNF-JTQLQIEISA-N	426.838	1.376	50	20	IDGD	
O=C(/C=C/c1ccccc1)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	28604862	BEAWLGMPTWNLFW-XYOKQWHBSA-N	443.525	1.501	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)CN2C(=O)N[C@]3(C[C@H](C)CC(C)(C)C3)C2=O)c1	104669860	QCHMNGCZXGKSCP-QRQCRPRQSA-N	430.505	1.658	50	20	IDGD	
CC(=O)Nc1ccc(NS(C)(=O)=O)c(C(=O)NNC(=O)c2cccc(N(C)C)c2)c1	111205830	ORJGEYZWCXZLNS-UHFFFAOYSA-N	433.490	1.157	50	20	IDGD	
Cc1ccc(OCC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)c(C)c1	728212829	GWCXMCHIKCHIFA-UHFFFAOYSA-N	432.546	1.762	50	20	IDGD	
NS(=O)(=O)c1ccc(CC(=O)NNC(=S)Nc2cccc(Br)c2)cc1	728312150	FLCMUPTZMLAAKC-UHFFFAOYSA-N	443.348	1.657	50	20	IDGD	
Cc1ccc(S(C)(=O)=O)cc1S(=O)(=O)NNC(=O)c1cccc(OC(F)F)c1	728510571	OQYKOTAWUFKMCZ-UHFFFAOYSA-N	434.442	1.623	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2cc(C)n(-c3nccs3)c2C)n1	728723720	SUBHNJPBMPEAKJ-UHFFFAOYSA-N	433.515	1.862	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCCCCC2)cc1C(=O)NNC(=O)Cc1cccnc1	728852173	QDEZXGIYVZCJKP-UHFFFAOYSA-N	446.529	1.659	50	20	IDGD	
Cc1ncsc1C(=O)NNC(=O)c1ccc(C(=O)NNC(=O)c2scnc2C)cc1	729541476	QXFMPMLNCKWASL-UHFFFAOYSA-N	444.498	1.366	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)Cc2cc[nH]n2)cc1S(=O)(=O)NCc1ccccc1	730102600	HCOZHMPDXIPNGO-UHFFFAOYSA-N	427.486	1.200	50	20	IDGD	
C[C@H](C(=O)NNC(=O)Cc1ccccc1F)N1C(=O)c2ccc(Br)cc2C1=O	731330254	GMXSKRUFBHWBNJ-SNVBAGLBSA-N	448.248	1.963	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)[C@H](C)N2CCC(Cc3ccccc3)CC2)C[C@@H](C)O1	732261063	AHISNFYPMMMPNQ-ZCNNSNEGSA-N	430.593	1.976	50	20	IDGD	
Cc1cc(C)nc(-n2nc(C)c(CC(=O)NNC(=O)CCN3C[C@H](C)O[C@H](C)C3)c2C)n1	732262868	WTKRGEYAOQPZTR-IYBDPMFKSA-N	443.552	1.085	50	20	IDGD	
O=C(COC(=O)[C@@H]1CC(=O)N(C2CCCCC2)C1)NNC(=O)c1cccc([N+](=O)[O-])c1	732323167	IRTVTDHHGBSRIB-CQSZACIVSA-N	432.433	1.080	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)[C@H]1CC(=O)N(C[C@H]2CCCN2CC)C1	733125430	HMGFDAFEGAJXSM-DLBZAZTESA-N	440.548	1.079	50	20	IDGD	
Cc1ccc(C)n1-c1nc(CC(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)cs1	734239615	UHTITTBUCTUUNR-UHFFFAOYSA-N	436.538	1.948	50	20	IDGD	
C[C@@]12CCC(=O)N1c1ccccc1C(=O)N2CC(=O)NNC(=O)COCc1ccccc1	737634607	IVJHYWJABJJKQH-QHCPKHFHSA-N	436.468	1.350	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)N1CCC(NC(=O)c2ccc(F)cc2)CC1	738496973	HRZRQYMDDQJOBO-UHFFFAOYSA-N	428.464	1.978	50	20	IDGD	
CC(=NNC(=O)CNc1ccccc1F)c1cccc(S(=O)(=O)N2CCOCC2)c1	739401114	XYKGGPHFNNTWPY-UHFFFAOYSA-N	434.493	1.799	50	20	IDGD	
CS(=O)(=O)[C@H]1CCC[C@@H](NC(=O)NNC(=O)c2cc(F)ccc2Br)C1	741093366	QDTVDNQNOKNGTR-MNOVXSKESA-N	436.303	1.888	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)C[C@@H]2CCCN(C(=O)NCC(C)C)C2)cc1C	741302114	RHRVVMZJTJJVQW-KRWDZBQOSA-N	431.537	1.857	50	20	IDGD	
C[C@H]1CCC[C@H](C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)C1	741513871	DDCRZPVBGVAXRF-WMZOPIPTSA-N	437.562	1.614	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)N2CCC[C@@H]2CN2CCOCC2)N(C)c2ccccc21	742762601	QOUKSWUPGQLWFE-GOSISDBHSA-N	437.544	1.980	50	20	IDGD	
C[C@@H](CC(=O)NNC(=O)NCc1ccc(Cl)cc1)/N=C1/NS(=O)(=O)c2ccccc21	743822665	BLRIUSLAVKLCHN-LBPRGKRZSA-N	449.920	1.688	50	20	IDGD	
COc1cc(Br)ccc1C(=O)OCC(=O)NNC(=O)c1cccc(C#N)c1	744900738	BJUXMDGWNVUQJX-UHFFFAOYSA-N	432.230	1.947	50	20	IDGD	
CCc1ccc([C@@H](COC)NC(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)o1	745847115	LCWRFFTYWXSHPP-OAHLLOKOSA-N	425.511	1.938	50	20	IDGD	
O=C(NCCOC1CCC1)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	745907010	ZECABWUQCCZMBM-UHFFFAOYSA-N	435.488	1.902	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)c1cccc(-n2cccn2)c1	745930176	BCVKTHFZANPPMB-CQSZACIVSA-N	427.486	1.981	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@@H]1CCCN1Cc1ccccn1	746097794	NJIOUVOVFJQCHE-INIZCTEOSA-N	430.534	1.109	50	20	IDGD	
COc1cc(C(=O)NNC(=O)N[C@@H]2CCCN(CC(F)(F)F)C2=O)ccc1OC(C)C	746339839	RYYWFCFMLBSTPH-CYBMUJFWSA-N	446.426	1.980	50	20	IDGD	
COC[C@H](Cc1ccccc1)NC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1	746781686	HOYCLDNHOHKDOW-SFHVURJKSA-N	448.545	1.204	50	20	IDGD	
C#CCN1C(=O)C(=NNC(=O)[C@H](C)CN2CCOCC2)c2cc(Br)ccc21	747042111	NKTBRTHOKGMHKC-CYBMUJFWSA-N	433.306	1.218	50	20	IDGD	
C[C@H](NS(=O)(=O)c1ccc(C(N)=O)cc1)C(=O)NNc1ccc(Cl)cc1Cl	748017784	SIUKJDNGPVKKDI-VIFPVBQESA-N	431.301	1.902	50	20	IDGD	
Cc1nc(Cl)sc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	748516720	JYJOKOCQEMRKAI-UHFFFAOYSA-N	428.923	1.964	50	20	IDGD	
O=C1CN(S(=O)(=O)c2cccc(C(=O)NNc3cccc4cnccc34)c2)CCN1	748762899	HFWMZIFKLQFMIS-UHFFFAOYSA-N	425.470	1.112	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCN(c3c(C#N)cnc4ccccc34)CC2)n1	748810393	OQRVJQWKCYKDQV-UHFFFAOYSA-N	449.540	1.384	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)[C@@H]2CCCN2C(=O)c2ccc3c(c2)OCO3)cc1C	749561457	LHQCVQOGBXGLFI-SFHVURJKSA-N	439.468	1.863	50	20	IDGD	
C[C@H](C(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1)c1cnn(C)c1	749884416	WPFYKMPTDVZXGV-HNNXBMFYSA-N	430.472	1.687	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NNC(=O)c1cc2ccccc2o1	750268361	QTIGBIAOWAGXCF-UHFFFAOYSA-N	444.473	1.323	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NNC(=O)COc2cccc(C)c2)cc1	750574737	GHZAJDVHLXIKRD-IBGZPJMESA-N	431.514	1.683	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)CNC(=O)c1ccco1)n1nnc(-c2ccc(Cl)cc2)n1	751204221	GHGNJHCDLZBOJT-CYBMUJFWSA-N	431.840	1.115	50	20	IDGD	
Cc1noc(C)c1CSc1ncccc1C(=O)NNC(=O)CNC(=O)c1ccco1	751206667	LEJSRTLIQSCAJN-UHFFFAOYSA-N	429.458	1.763	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)Cn2cc(Br)c(O)nc2=O)c2ccccc2n1	753117191	ZVFQQNBODWWZJQ-UHFFFAOYSA-N	432.234	1.029	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3ccc(-n4cccc4)nc3)cc2)CC1	753340579	FJRPLBIKWXRVLB-UHFFFAOYSA-N	440.529	1.565	50	20	IDGD	
C[C@@H](CCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)N1CCCCC1	753411839	UMIVQKZQTZCLES-HNNXBMFYSA-N	425.555	1.145	50	20	IDGD	
CN1CC[C@H](NC(=O)NNC(=O)C(=O)Nc2ccccn2)[C@@H]1c1ccc(Cl)c(F)c1	755100892	VOQLPVIFSOCCCL-HOCLYGCPSA-N	434.859	1.588	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)Nc1ccc(S(=O)(=O)N2CCC[C@H](C)C2)cc1	755447758	RFHKACXRGPVTHQ-LSDHHAIUSA-N	442.538	1.311	50	20	IDGD	
CS(=O)(=O)Cc1ccc(NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1	756269876	RZDLKORJJFGKAU-UHFFFAOYSA-N	425.488	1.101	50	20	IDGD	
NC(=O)CCOc1ccc(NC(=O)NNC(=O)c2cc(Br)ccc2O)cc1	756510645	RDYCZHGLEOECNO-UHFFFAOYSA-N	437.250	1.875	50	20	IDGD	
CNS(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@H](C)Oc2ccc(C(C)=O)cc2)cc1	756639669	BWGAOLHMIUMMKD-ZDUSSCGKSA-N	434.474	1.418	50	20	IDGD	
COC(=O)c1ccc(NC(=O)NNC(=O)c2ccc(OC)cc2OC)cc1C(=O)OC	756818294	RKQXMVJJTPHQJJ-UHFFFAOYSA-N	431.401	1.744	50	20	IDGD	
CCOC(=O)Cn1cccc(NC(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)c1=O	757764257	PUKHTYHAISSHTG-OAHLLOKOSA-N	430.461	1.648	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)CCCSc1ccc(Br)cc1	758052891	JZPGQSUDGKHDGD-JTQLQIEISA-N	438.369	1.407	50	20	IDGD	
CCS(=O)(=O)N1CCC(CNC(=O)NNC(=O)CSc2ccccc2OC)CC1	758745322	SHQGNAVIBFDOEX-UHFFFAOYSA-N	444.579	1.179	50	20	IDGD	
O=C(CN1CC[C@H](N2CC(=O)Nc3ccccc32)C1)NNC(=O)c1ccccc1Cl	759895620	HCAMXDONDZVAFM-AWEZNQCLSA-N	427.892	1.634	50	20	IDGD	
COc1ccc(Br)c(C(=O)OCC(=O)NNC(=O)Cc2nc(C)cs2)c1	760005742	MCIBOZFCLXHXLW-UHFFFAOYSA-N	442.291	1.770	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)CNC(=O)c1ccccc1C(F)(F)F	760438131	RPNGUYSDCGRSBT-UHFFFAOYSA-N	432.399	1.497	50	20	IDGD	
CCOCCC1(CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)CCCC1	760715756	QFLHINJUAJQEFT-UHFFFAOYSA-N	425.555	1.911	50	20	IDGD	
CC[C@@H](CC(F)(F)F)NC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	761040390	GMESFBMIGKIKFQ-LBPRGKRZSA-N	438.476	1.375	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)CCN1CCN(c2ccccn2)CC1	762410502	XQNWHHFWLVJXPM-UHFFFAOYSA-N	429.546	1.542	50	20	IDGD	
O=C(CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@@H]12)NNC(=O)c1cc(-c2ccccc2)[nH]n1	762937967	OCWBRLQJZAXWMJ-XYJFISCASA-N	428.518	1.564	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)n[nH]1	763153812	MRPXBGMQJABDTK-UHFFFAOYSA-N	425.357	1.797	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2)cc1NS(C)(=O)=O	763498225	FFKHIWOMUMYSMP-UHFFFAOYSA-N	440.865	1.120	50	20	IDGD	
Cc1cccc(NC(=O)C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1C	763509276	QGSNIUQYIVLCMR-UHFFFAOYSA-N	444.513	1.488	50	20	IDGD	
CC[C@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2c(C)nc3ccccn23)cc1	763628365	IXCWQQMEIMJOSC-ZDUSSCGKSA-N	436.472	1.571	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(Oc3cnccn3)c2)cc1	763679585	OHOMNGOEKFPJJB-UHFFFAOYSA-N	432.396	1.305	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(Cl)c(C(=O)OC)c1	763684134	FQRFFGQQACMXJL-UHFFFAOYSA-N	449.847	1.690	50	20	IDGD	
O=C(COC(=O)c1ccc([N+](=O)[O-])c(Cl)c1)NNC(=O)[C@H]1COc2ccccc2O1	763720661	YOJJDSKDSHBZBS-OAHLLOKOSA-N	435.776	1.392	50	20	IDGD	
CSc1c(F)cc(NC(=O)C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1F	763789738	BPNHNMRBVXRHFL-UHFFFAOYSA-N	447.423	1.333	50	20	IDGD	
CC(=O)N1CCCc2cc(NC(=O)C(=O)NNC(=O)COc3ccccc3C#N)ccc21	763808783	QPJNEQDESZRWOY-UHFFFAOYSA-N	435.440	1.022	50	20	IDGD	
CCOc1ccc(-c2noc(CCC(=O)NNC(=O)CNC(=O)c3cccnc3)n2)cc1	763818361	JFJNOBIWRCHISN-UHFFFAOYSA-N	438.444	1.040	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)c1csc(-c2ccc3c(c2)OCO3)n1	763825027	OVRGLLFIXSWXBR-UHFFFAOYSA-N	425.426	1.125	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)c(F)c1	763841208	ORWNHNBOVJLQGG-CYBMUJFWSA-N	431.420	1.783	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccc(NC(=O)[C@H]2CCCO2)cc1	763843746	UCKDNLYJOFSDRT-QGZVFWFLSA-N	444.419	1.108	50	20	IDGD	
CCOC(=O)c1cc(C)sc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccccc1F	763852969	ZOWTWELZKFEVGZ-LLVKDONJSA-N	437.449	1.926	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cccc(-c3nnco3)c2)cc1	763873702	XUGABUVJVBQFPJ-ZDUSSCGKSA-N	437.412	1.493	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)C(=O)Nc1cccc(SC(F)F)c1	763916225	DQAJUPLVHMQQJK-UHFFFAOYSA-N	433.400	1.377	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cnc3c(c2)c(C)nn3C)ccc1OC(C)C	763916343	MYJUJDFKWTYKJC-UHFFFAOYSA-N	440.460	1.472	50	20	IDGD	
COc1cc(OC)c(NC(=O)C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc1F	763944687	ORYFYGOWAUEWDT-UHFFFAOYSA-N	443.391	1.134	50	20	IDGD	
CC(C)C(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)c1	763996204	WEFLRRVASIFLKI-UHFFFAOYSA-N	436.266	1.771	50	20	IDGD	
Cn1c(C2CC2)nc2cc(NC(=O)C(=O)NNC(=O)c3ccc4c(c3)OCCO4)ccc21	764003738	ILIVJURYMATPBJ-UHFFFAOYSA-N	435.440	1.622	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(-n3nccn3)cc2C(F)(F)F)c(O)c1	764105180	LMTXXDNBCDCIHX-UHFFFAOYSA-N	448.361	1.700	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)CC2CC2)c(C(=O)N2CCCCC2)cc1OC	764142417	DXDSTIWQLPZKMQ-UHFFFAOYSA-N	432.477	1.216	50	20	IDGD	
CN(C)c1ccc(C(F)(F)F)cc1NC(=O)C(=O)NNC(=O)[C@H]1Cc2ccccc2O1	764155326	YHENMQJDJGNJSE-MRXNPFEDSA-N	436.390	1.861	50	20	IDGD	
O=C(NNC(=O)c1ccoc1)C(=O)Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1	764159748	FSLPUKDSVFTPOV-UHFFFAOYSA-N	434.474	1.244	50	20	IDGD	
CS(=O)(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2cccc(OC(F)F)c2)c1	764251807	YYLXPRWYDIUQKJ-UHFFFAOYSA-N	427.385	1.091	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)C(=O)Nc1ccc(-c2nnc3n2CCCCCC3)cc1	764267473	WJMXAMCDSBFGKE-UHFFFAOYSA-N	447.499	1.785	50	20	IDGD	
CNC(=O)c1ccc(C)c(NC(=O)C(=O)NNC(=O)c2cc(Br)ccc2O)c1	764276841	GWMUKXUHPUQWBP-UHFFFAOYSA-N	449.261	1.222	50	20	IDGD	
O=C(NNC(=O)c1cc2ccccc2o1)C(=O)Nc1ccc(N2CCOCC2)c(F)c1	764343134	QKMPCYSPYURKGJ-UHFFFAOYSA-N	426.404	1.808	50	20	IDGD	
CC(C)N(C)C(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)Cc2ccncc2)c1	764355486	CFUGAVSOVBNIOA-UHFFFAOYSA-N	431.880	1.544	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COCc2ccccc2)nn1-c1cccc(F)c1	764367501	XGMVCGUQDVKEBT-UHFFFAOYSA-N	425.420	1.623	50	20	IDGD	
CCN(CC)CCNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2ccc(C)o2)c1	764367594	JPZDKYATGKFKDL-UHFFFAOYSA-N	429.477	1.059	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H](O)c2cc(Cl)cc(Cl)c2)c1	764599888	VJEJIXDQKXPEMF-OAHLLOKOSA-N	446.312	1.738	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)c1cc(I)c[nH]1	765311585	YNHBFQMKWMKVSA-UHFFFAOYSA-N	436.250	1.685	50	20	IDGD	
O=Cc1cccc(OCC(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)c1	766664868	WRNGNUUZAZQAPR-UHFFFAOYSA-N	444.919	1.497	50	20	IDGD	
CN(CCCC(=O)NNc1ncnc2ccsc12)C1=NS(=O)(=O)c2ccccc21	766671006	YEBBUZPRUKQZLM-UHFFFAOYSA-N	430.515	1.996	50	20	IDGD	
Cc1ccc(C(=O)NNS(=O)(=O)c2cc3nc(O)[nH]c3cc2Br)c(O)c1	768498511	ISCXVNLOPYZGBR-UHFFFAOYSA-N	441.263	1.668	50	20	IDGD	
O=C(NCc1ccco1)NNS(=O)(=O)c1cc2nc(O)[nH]c2cc1Br	768506415	RUWNRPBLTSVITA-UHFFFAOYSA-N	430.240	1.317	50	20	IDGD	
CN1C(=C(C#N)C(=O)COC(=O)[C@@H](NS(C)(=O)=O)C(C)(C)C)N(C)c2ccccc21	770108562	CEKQWWHPILYTRO-QGZVFWFLSA-N	434.518	1.384	50	20	IDGD	
CCCNC(=O)CN1CCC(NC(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)CC1	770188589	LEWCLQUPJJLHTE-CQSZACIVSA-N	439.944	1.428	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)C(=O)Nc2ccc(F)c(S(=O)(=O)NC(C)(C)C)c2)n1	773480256	OFXWXPADFQMWCI-UHFFFAOYSA-N	438.485	1.391	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2cc(C)nn2-c2ccc(C)nn2)c1	773494023	KQMZJDHKVNBWKG-UHFFFAOYSA-N	437.460	1.061	50	20	IDGD	
O=C(NNc1ccc(C(F)(F)F)cn1)C(=O)Nc1ccc(CN2C(=O)CNC2=O)cc1	773666529	FUWZSWGQEQWBLV-UHFFFAOYSA-N	436.350	1.234	50	20	IDGD	
Cc1cc(Br)cc(NC(=O)C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c1	777140820	CABUDTITUHXHCQ-UHFFFAOYSA-N	444.249	1.133	50	20	IDGD	
CC[C@H](C)n1nc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cc1C	778380309	VVYWVWUMSTXWIV-INIZCTEOSA-N	426.521	1.382	50	20	IDGD	
O=C(NNC(=O)[C@H](O)Cc1cccc(C(F)(F)F)c1)C1CCN(c2ncccn2)CC1	778723922	HCDGVOQTXUKNTL-MRXNPFEDSA-N	437.422	1.463	50	20	IDGD	
CCn1c(SCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)nnc1-c1ccncc1	779607711	CZZIREBIPFHFCY-UHFFFAOYSA-N	427.446	1.822	50	20	IDGD	
CN(C)[C@H](C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1)c1cccc(Cl)c1	780105404	VXRKTJBAOTXSIC-HKUYNNGSSA-N	447.875	1.473	50	20	IDGD	
O=C(NNc1c(F)cccc1F)[C@@H]1C[C@H](O)CN1S(=O)(=O)c1ccc(Cl)cc1	782017168	QTYOQVVLZXUNLR-NHYWBVRUSA-N	431.848	1.885	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCc2nnc(SC)s2)nc1	783061465	XUTHRJPLSHQKDV-UHFFFAOYSA-N	431.569	1.512	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccc3scnc3c2)nc1	783262958	FLXALXFXBYGCNU-UHFFFAOYSA-N	434.503	1.460	50	20	IDGD	
CCOC(=O)C(C)(C)n1cc(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2Cl)cn1	784382748	LGKOHORFBCHAGG-UHFFFAOYSA-N	438.828	1.825	50	20	IDGD	
CCn1nc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)cc1C1CC1	784835562	CBRPUQPTLGBJBU-UHFFFAOYSA-N	427.433	1.859	50	20	IDGD	
CCN(CC)C(=O)COc1ccc(NC(=O)C(=O)NNc2ncc(F)cn2)cc1Cl	784949044	BPWXWNZMZVSQPM-UHFFFAOYSA-N	438.847	1.598	50	20	IDGD	
CCN(CC)C(=O)Cn1ccc2cc(NC(=O)C(=O)NNc3ncc(F)cn3)ccc21	784950221	USEMNABEXOIDNH-UHFFFAOYSA-N	427.440	1.521	50	20	IDGD	
CNC(=O)Cn1ccc2ccc(NC(=O)C(=O)NNc3cccc(C(F)(F)F)n3)cc21	784951914	BYZOYWWCXQCRMS-UHFFFAOYSA-N	434.378	1.883	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1ccccc1-n1nccc1C	785330692	KIHNRTWIPJZRBU-UHFFFAOYSA-N	443.485	1.675	50	20	IDGD	
Cc1csc(C(=O)NNC(=O)CNC(=O)c2ccco2)c1I	786855724	CHYLELHGCKDEEC-UHFFFAOYSA-N	433.227	1.445	50	20	IDGD	
CCCCOc1ccc(C(=O)NNS(=O)(=O)c2cncc(C(=O)OC)c2)cc1OC	788479896	AWSOCUNXPYLUIS-UHFFFAOYSA-N	437.474	1.679	50	20	IDGD	
CN(NS(=O)(=O)c1ccc2c(c1)OCO2)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	788914153	BAPVNTWOQCJGFZ-UHFFFAOYSA-N	442.494	1.213	50	20	IDGD	
COCc1ccc(S(=O)(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)cc1	788916467	OVDKKBIHDXHDPK-UHFFFAOYSA-N	442.538	1.631	50	20	IDGD	
Cc1ccc(C#N)cc1S(=O)(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	788917042	SNPGYSLNHWEHGJ-UHFFFAOYSA-N	437.522	1.665	50	20	IDGD	
CCNC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)c1C	789732553	RPAXABWPGPXFNV-UHFFFAOYSA-N	447.879	1.955	50	20	IDGD	
O=C(NNC(=O)[C@H]1OCC[C@H]1c1ccccc1)C(=O)Nc1ccccc1O[C@H]1CCOC1	789812826	ODLNHISIIHFRMS-ZWOKBUDYSA-N	439.468	1.513	50	20	IDGD	
O=C(Cc1csc(-c2cccc(Br)c2)n1)NNC(=O)CN1CCCC1=O	789857903	LDPLGCBBHQKCAG-UHFFFAOYSA-N	437.319	1.885	50	20	IDGD	
O=C(NNS(=O)(=O)c1cnn(CC(F)F)c1)c1ccc(COc2ccccc2)o1	790004253	DKVRYWNBDYXHEH-UHFFFAOYSA-N	426.401	1.944	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)CCOCC(F)(F)C(F)(F)F)c1	790112442	FJUWWDWAVCWMFG-UHFFFAOYSA-N	447.382	1.302	50	20	IDGD	
Cc1ccc(CN2CC[C@H](NC(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)C2=O)cc1	790703567	YQHJLZQSOODEAP-SFHVURJKSA-N	444.513	1.144	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)F)cc1)C(=O)Nc1cccc(N2CCC2=O)c1	790943972	AWTOSVDTCISDNR-UHFFFAOYSA-N	438.412	1.501	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2OC)cc(-n2cccn2)c1	792352186	DJMNIRVAGYZXQM-UHFFFAOYSA-N	443.847	1.943	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)N2CCN(S(=O)(=O)c3ccc4c(c3)CCC4)CC2)n1	793229398	ZCLJEUFDXJTRAY-UHFFFAOYSA-N	443.529	1.240	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)c1ccc(Br)cn1	793409227	CSWVEYLDEUTOGA-JTQLQIEISA-N	445.277	1.796	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNC(=O)Cn1nnc(-c2ccc(Cl)cc2)n1	794069301	FOHMQPZRIWAFOR-UHFFFAOYSA-N	443.851	1.067	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)N1CCC[C@@H](C=NNC(=O)c2ccc3c(c2)OCO3)C1	794457362	WSARDQNHFJEJIU-AWEZNQCLSA-N	432.477	1.894	50	20	IDGD	
COC(=O)c1cc(F)c(Br)cc1NC(=O)C(=O)NNC(=O)c1ccccn1	796992161	RUGZRQSUFPBOQU-UHFFFAOYSA-N	439.197	1.170	50	20	IDGD	
COC(=O)c1cc(F)c(Br)cc1NC(=O)C(=O)NNc1ncc(F)cn1	797101451	YYJQCROWGPMISR-UHFFFAOYSA-N	430.165	1.386	50	20	IDGD	
O=C(NC[C@@H]1CCC(F)(F)C1)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	797550875	HAXVKVBUXBYCDK-CYBMUJFWSA-N	446.476	1.087	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)Nc2ccc(S(=O)(=O)N(C)C)cn2)o1	797652411	CZRUYSBLQHVPNY-UHFFFAOYSA-N	438.510	1.233	50	20	IDGD	
COC(=O)c1cccc(NC(=O)C(=O)NNC(=O)CCc2ccccc2O)c1OC(C)C	799259462	YREHAALNWREWMY-UHFFFAOYSA-N	443.456	1.685	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@H]2C(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)cc1	799289618	FPCOWDQZEIILJS-IBGZPJMESA-N	438.484	1.703	50	20	IDGD	
CS(=O)(=O)CC[C@@H](NC(=O)OCc1ccccc1)C(=O)NNC(=O)Nc1ccccc1	801984890	NFDKCDGVRDOEPS-QGZVFWFLSA-N	448.501	1.569	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccccc1)NNC(=O)Nc1ccc(Br)cc1	801997073	RYLFINCHQLJEER-UHFFFAOYSA-N	441.307	1.970	50	20	IDGD	
COc1ccc(Cl)c(NC(=O)NNC(=O)c2ccc(S(=O)(=O)CC(N)=O)cc2)c1	802113245	JOEXJUMQRJXOCR-UHFFFAOYSA-N	440.865	1.074	50	20	IDGD	
COc1ccc(S(C)(=O)=O)cc1S(=O)(=O)NNC(=O)c1ccc(Cl)cc1F	802722360	XXLPNXHGSKPLQH-UHFFFAOYSA-N	436.870	1.515	50	20	IDGD	
Cc1cc([N+](=O)[O-])cc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1F	803457319	DUUMBSRBCHLASG-HNNXBMFYSA-N	433.348	1.187	50	20	IDGD	
COCCCS(=O)(=O)NCC(=O)NNc1ccc(-c2cccc(C(F)(F)F)c2)nn1	804208408	KLBMZNFWGQPMKB-UHFFFAOYSA-N	447.439	1.561	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2cnn(CCN(C)C)c2-c2ccccc2)C[C@@H](C)O1	806340023	MPDUEORQWMTQKI-HDICACEKSA-N	442.564	1.372	50	20	IDGD	
COc1cc(C(=O)NNc2nccc(N3CCOCC3)n2)cc(Br)c1OC	807076079	RKJQRGVAGAJKGZ-UHFFFAOYSA-N	438.282	1.850	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)COc2ccccc2O)cnn1-c1ccc(Cl)cc1	808935063	HHIQGQOWEPZTHR-UHFFFAOYSA-N	443.847	1.705	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@H](F)C[C@H]1CNC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	813815842	YLWGVFKRZJVSEU-JSGCOSHPSA-N	425.417	1.886	50	20	IDGD	
CNC(=O)Oc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(Br)s2)c1	815566876	HZQLSKFDJGAOMR-UHFFFAOYSA-N	441.263	1.629	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1cc(Cl)ccc1OC(F)(F)F	815571277	ZJCCUOQDJGPPNR-QMMMGPOBSA-N	427.763	1.376	50	20	IDGD	
Cc1nc(Cn2nnc(NC(=O)C(=O)NNc3cc(Cl)cc(Cl)c3)c2C)no1	815619435	NFPQECPQAFBERK-UHFFFAOYSA-N	425.236	1.715	50	20	IDGD	
O=C(NNC(=O)c1c(F)ccnc1F)c1cccc(S(=O)(=O)NCc2ccccc2)c1	816829804	FOHJKONCMMFXNU-UHFFFAOYSA-N	446.435	1.913	50	20	IDGD	
O=C(NNc1cccc(Cl)n1)c1ccc2c(c1)S(=O)(=O)N(C[C@@H]1CCCO1)C2=O	817008813	IUUDRJCLMIRJDI-LBPRGKRZSA-N	436.877	1.815	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)CN2C(=O)N[C@]3(C[C@H](C)CC(C)(C)C3)C2=O)cc1C	864001797	KGLSJDYGXXVFDH-FATZIPQQSA-N	444.532	1.966	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)C1=NN(c2ccccc2)C(=O)CC1	912848193	RDXQCPSFBPGDEW-UHFFFAOYSA-N	442.501	1.232	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)Cc1c(C)nn(-c2nc(C)cc(C)n2)c1C	914465277	NMESNEMFJMRGBY-UHFFFAOYSA-N	437.504	1.707	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NC[C@@H](Cc2ccccc2)N(C)C)c2ccccc2c1=O	915900992	MSNFGXKVALPVAF-QGZVFWFLSA-N	436.516	1.533	50	20	IDGD	
CC(=NNC(=O)[C@@H](C)Oc1ccc(F)cc1)c1ccc(S(=O)(=O)NCC(=O)O)cc1	916340704	ZHXTZBQJRHWFKL-CYBMUJFWSA-N	437.449	1.496	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NCc1ccc(N2CCO[C@H](C)C2)nc1	916392940	QCBRYMLLGUOVFT-CABCVRRESA-N	431.468	1.744	50	20	IDGD	
CC(C)Oc1ccc(CCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1	916393816	MXHPWYWZBWVNHJ-UHFFFAOYSA-N	448.545	1.911	50	20	IDGD	
O=C(NCC(F)(F)F)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	916524769	KDEZOAHTQQFXHA-UHFFFAOYSA-N	430.408	1.671	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)c2ccc3c(c2)S(=O)(=O)N(C2CC2)C3=O)cc1	919836490	TYBRDPDNQGIHMB-UHFFFAOYSA-N	443.481	1.396	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)NCc1cccc(C(=O)N2CCOCC2)c1	920422488	KNLDXNJCSJODMW-UHFFFAOYSA-N	436.472	1.259	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCc2nc(Cc3ccccc3)no2)nc1	921122323	ZVJHRKHGIKHMNV-UHFFFAOYSA-N	445.505	1.568	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)N1CCC([C@H]2C(=O)Nc3ccccc32)CC1	1251506703	BACDAIZOKQHLSF-GOSISDBHSA-N	441.513	1.667	50	20	IDGD	
COc1cc(O)ccc1C=NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	1337122253	MHWYAVWNMFGGKN-UHFFFAOYSA-N	447.513	1.505	50	20	IDGD	
C[C@H](CCNC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)N(C)C(=O)OC(C)(C)C	1338931137	FFRNEABCBFPBSK-CYBMUJFWSA-N	446.508	1.523	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4nc(CO)[nH]c4c3)C2)C1	1777702941	OEAALKUQBXZMNX-NRFANRHFSA-N	434.924	1.764	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H]1C[C@@]13C(=O)Nc1ccccc13)C2)[C@H](F)Cl	1778027812	AQCUIZHNAXOHEC-BSFXZMFCSA-N	449.910	1.945	50	20	IDGD	
COc1ccc(CCC(=O)N2CCO[C@@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)cn1	1779294656	WGQQRCVKIVEFSY-OAQYLSRUSA-N	435.597	1.704	50	20	IDGD	
C[C@@H](Nc1nccs1)C(=O)N1CCO[C@]2(CCN(C(=O)CO[Si](C)(C)C)C2)C1	1779295644	VBEGNIMEVBPQNH-KDOFPFPSSA-N	426.615	1.625	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cn(C(C)(C)C)nn3)C2)C1	1780351057	HUFBGFZQZMYHMG-SCLBCKFNSA-N	442.358	1.508	50	20	IDGD	
CCC(=O)N[C@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@](C)(Cl)CCl)C1	1780706697	NYWHSUXOCDVFRB-TUFGIGEDSA-N	436.380	1.651	50	20	IDGD	
CN1CCC[C@H](C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](F)Br)C2)C1	1780773657	KUIJYYGGRCJVFC-LUXYFRNMSA-N	434.350	1.533	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](COC)NC(=O)OC(C)(C)C)CCO2	1781217096	FFTSEKQPBZAUFL-STXHMFSFSA-N	447.960	1.373	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)[C@@H]3COc4ccccc4O3)CCO2)C1	1781225573	ZZMXPRGBULPZDV-VDGAXYAQSA-N	443.327	1.893	50	20	IDGD	
O=C(Cc1cccc(Cl)n1)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781325827	JAYKASWSROIBMO-HOCLYGCPSA-N	434.693	1.798	50	20	IDGD	
O=C([C@@H]1Cc2ccccc2CN1)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781332095	ZQNMNENRWADXKC-TXPKVOOTSA-N	440.313	1.221	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)C3(Br)CC3)C2)C1	1781345872	MBTRFKFOGVILCQ-ZIAGYGMSSA-N	428.154	1.980	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)n2ccnn2)C1	1781552136	JFWRVJVAFGFMLB-SZOQZIPDSA-N	428.331	1.136	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)ncn1)C2	1781997279	OJRPWSRBYSLTOQ-XTQGRXLLSA-N	427.299	1.093	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)Oc1cccnc1)C2	1782178226	JHFTYQJAVBBBQS-NWUWZPLHSA-N	439.940	1.617	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@]2(C1)CN(C(=O)c1ccnnc1)CCO2	1782863697	IZJDNRHGSPRPPO-IXNCKXOBSA-N	439.422	1.805	50	20	IDGD	
CCc1cc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](Br)CC)C3)C2)n(C)n1	1783349218	KAQQBQLGTNPLEJ-KSSFIOAISA-N	427.343	1.600	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)CCc3cc(F)ccn3)CCO2)C1	1783529806	NPUDTGBSCLETDQ-ACJLOTCBSA-N	428.302	1.767	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](C)Oc1cccnc1)CCO2	1783540620	ZVKNLLKOKIOMRC-DEYYWGMASA-N	426.311	1.462	50	20	IDGD	
O=C(c1cc(N2CCCC2)ccn1)N1CCO[C@@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783945623	QCJFDICRAMNZQI-LJQANCHMSA-N	427.332	1.929	50	20	IDGD	
COc1ccc2nc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]4C3)ccc2c1	1784093484	XCMOIGBZBCZRTK-UQOODKLHSA-N	447.919	1.436	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)CCn3nc(C)cc3C)C2)C1	1784321141	KOVLOAHORNTOPD-APWZRJJASA-N	441.370	1.893	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccn(C)c3=O)[C@H]2C1	1784733786	LPILLSLIYJIVAU-TUUVXOQKSA-N	440.338	1.152	50	20	IDGD	
CC(C)(C)OC(=O)CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21	1784777953	ABIQCLRSOPSVQO-IHRRRGAJSA-N	433.343	1.483	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc(OCF)cn3)[C@H]2C1	1785692723	NEBMQSMONHJKSE-MNXVOIDGSA-N	445.289	1.159	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(Cl)ncn3)[C@H]2C1	1789055591	ZZUSGKNPTZSOBO-MNXVOIDGSA-N	445.745	1.754	50	20	IDGD	
COc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Cl)C[C@@H]32)cc1NC(C)=O	1789277853	SVEDCGFQTXHVJN-DFEHZGFQSA-N	441.887	1.781	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1ccc(C2(NC(=O)c3ccnnc3O)CCC2)cc1	1789521178	PYZDSTRLLCBNIA-UHFFFAOYSA-N	447.455	1.242	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4n[nH]cc4c3)C[C@@H]21)[C@H](F)Br	1789923185	WVLWKOONRLBWRH-MZGVZZPPSA-N	439.285	1.847	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3c[nH]c4nccc-4c3)C[C@@H]21	1791057690	NYTHFXNOJDRJSG-XTBFLFJDSA-N	435.322	1.891	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(C#N)cc(OC)c3)C[C@@H]21	1791253692	GEWHLYVTINTBNG-FZDIXFNVSA-N	435.908	1.414	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1ccc(C2(NC(=O)c3cnn4ccncc34)CCC2)cc1	1791601527	HCXWUURCJWZHPW-UHFFFAOYSA-N	449.515	1.850	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1CCN(S(C)(=O)=O)CC1)C2	1793680576	BNCJVEOVFVTUJQ-YYIAUSFCSA-N	434.002	1.704	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C(=O)c1ccco1	1794195157	GYAZRHVKHXUVNV-NGYDUSEUSA-N	425.445	1.235	50	20	IDGD	
Cc1ncc(Br)cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2	1794317443	ZLOXNPKDJWOFPC-DJBIQUGXSA-N	434.693	1.890	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1scnc1C1CC1	1794509854	QPLXYXCJWNABDN-FBKDDSFISA-N	432.315	1.914	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/C(=O)c1cccs1)C2	1795112420	DPMQIOLJAVUZFW-SHXSXUFKSA-N	441.347	1.862	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)[C@@H]1CCc2ccccc2O1	1796189955	FSIRAMLPJIDSTP-IIZPIQPGSA-N	434.301	1.012	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnn2ncccc12	1796276729	CQNIRSBYYXKAEU-FAXLKDOZSA-N	436.310	1.106	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@](C)(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Cl)C1	1796365426	SAMLBXUGWJEXPQ-SGQRUEDASA-N	447.935	1.758	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCc1ccccn1)C2	1796891038	ZJUSEWUUHARLCB-INZAXJFKSA-N	436.516	1.786	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(C(F)F)no1)C2	1796892023	BDWIXGBDPUBGIB-AIUQWGENSA-N	448.430	1.998	50	20	IDGD	
O=C([C@H](O)CCl)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1(c2cccc(Cl)c2)CC1	1797113903	XAFKULHAMHOBLO-DLTLXFJOSA-N	427.328	1.561	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1ccc(C(F)(F)F)[nH]1	1797989104	WTUDQMLIMLERNK-IWXIMVSXSA-N	442.207	1.927	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(Cl)cnc1O)C2	1798439842	JKHCEIJOFAIKNY-CLLJXQQHSA-N	444.879	1.005	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CSc1ccncc1)C2)[C@H](F)Br	1799344261	FOBOBLYKSIYHFN-JLUCKKNBSA-N	432.315	1.454	50	20	IDGD	
CC1(C)CCC(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2ccc(B(O)O)cc2)C3)CC1	1799397945	ZPRBHQUVKQMSBG-HATOLVCRSA-N	442.365	1.176	50	20	IDGD	
Cc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)Br)C3)cc2c[nH]nc12	1799919640	XMHFSAHPGADKSW-RMIITELYSA-N	435.322	1.858	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc2c1NC(=O)C2	1800030015	CAOKPCXVUOYGPJ-CCWDJLKJSA-N	431.565	1.236	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CC[C@H]1CNc3ccccc3C1)C2	1800975829	VEIRSBHRYIXOHA-DRASZATQSA-N	449.979	1.894	50	20	IDGD	
C[C@@H](Cc1ccncc1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnccc1C(=O)NN)C2	1801246540	GFHJEVABTWZDNQ-OWLYRPNTSA-N	436.516	1.211	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(-c3cccnc3)[nH]n1)C2	1802337841	VUDSMKYYXNYGJB-BJWYYQGGSA-N	439.520	1.097	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc3n[nH]cc3c2)[C@H]1c1cccnc1)[C@H](O)CCl	1803138449	AXSADDVUZQYXLV-IPELMVKDSA-N	427.892	1.877	50	20	IDGD	
CC(=O)NC(C)(C)C(=O)NC[C@H]1CCN(C(=O)CO[Si](C)(C)C)[C@H]1c1cccnc1	1803592878	WGATVPKOBMAWRQ-MJGOQNOKSA-N	434.613	1.854	50	20	IDGD	
COc1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)cc1Cl	1803734988	JLGDKDIJBQLNMH-BCDXTJNWSA-N	442.708	1.594	50	20	IDGD	
O=C(CCc1cc(F)ccn1)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1	1804441756	FCSFMRBRBIVNHG-QSFXBCCZSA-N	434.899	1.854	50	20	IDGD	
Cc1ncsc1C(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1805756917	ZIDKVWTWRHNPME-VQIMIIECSA-N	444.561	1.539	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2cncs2)[C@@H]1c1cccnc1	1805977192	PSXNDKVNMZDYKE-BEFAXECRSA-N	430.534	1.231	50	20	IDGD	
O=C(CCBr)NC[C@H]1CCN(C(=O)c2cc[n+]([O-])cc2)[C@@H]1c1cccnc1	1806344293	ZNSCJHPXAPNCHN-SJLPKXTDSA-N	433.306	1.820	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H](CNC(=O)[C@H]2CCC(=O)N2)[C@H]1c1cccnc1	1806809955	BBKZPLLVOUYEJH-DNNBLBMLSA-N	437.338	1.397	50	20	IDGD	
CN1CCN(CCC(=O)NC[C@@H]2CCN(C(=O)[C@@H](F)Cl)[C@H]2c2cccnc2)CC1	1806914432	PULYLEXCFYSOJJ-YTQUADARSA-N	425.936	1.259	50	20	IDGD	
Cc1cc(NC(=O)CC(=O)N2CC[C@H](CNC(=O)[C@@H](F)Cl)[C@H]2c2cccnc2)no1	1808312965	NXFYBAIVLAGJOS-FSPWUOQZSA-N	437.859	1.947	50	20	IDGD	
Cc1noc(N)c1C(=O)N1CC[C@H](CNC(=O)[C@H](F)Br)[C@@H]1c1cccnc1	1808660785	CZMVFLFRHLEJJK-XBFCOCLRSA-N	440.273	1.970	50	20	IDGD	
O=C(c1c[nH]c2nccc-2c1)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1	1809977812	IZKJRFUKQHBNIR-UHFFFAOYSA-N	446.316	1.353	50	20	IDGD	
CCc1ccnc(C(=O)N2CCCC3(CCN(C(=O)c4cccc(B(O)O)c4)CC3)C2)c1	1810395096	FPDCBLFEABASKK-UHFFFAOYSA-N	435.333	1.482	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)N1CC[C@H](CNC(=O)CO[Si](C)(C)C)[C@H]1c1cccnc1	1810541634	LIHSPVOKJXNDIX-SOLBZPMBSA-N	435.601	1.386	50	20	IDGD	
C[C@H](C(=O)NC[C@@H]1CCN(C(=O)CO[Si](C)(C)C)[C@H]1c1cccnc1)n1ccnn1	1812398362	CYDATXPHCBVLOL-AYBZRNKSSA-N	430.585	1.792	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)C(=O)N(C)C)[C@H]1c1cccnc1	1812775865	CNYSYZIUCVFBDN-KKUMJFAQSA-N	425.327	1.349	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)o1	1813067708	BMKQZCKDKNRPQV-UTKZUKDTSA-N	427.505	1.676	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)C#Cc3ccccc3)sc2C1	1814021673	LJXNGEOKDCICLQ-MRXNPFEDSA-N	439.541	1.480	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@H]1CCc2nc(NC(=O)CN3CCCC3=O)sc2C1	1814585606	JULGYEKFTVSUIN-MNOVXSKESA-N	443.367	1.709	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)Cn2nnc3ccccc32)[nH]n1)[C@H](O)CCl	1814867953	SJOQCBOGOBKCCX-GOEBONIOSA-N	431.884	1.446	50	20	IDGD	
Cc1nc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)ccc1F	1816145136	MPISTQWPFIAATG-KRWDZBQOSA-N	445.499	1.931	50	20	IDGD	
CC(=O)Nc1cc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@H](O)CCl)CC3)ccn1	1817904037	AZZDPANIZOXROI-WCQYABFASA-N	437.909	1.322	50	20	IDGD	
CN[C@H](CC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@](C)(Cl)CCl)n[nH]1)C(=O)O	1820865117	OHNBDPWXADUEKS-QFSBIZTOSA-N	434.324	1.701	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CNC(=O)OC)n[nH]1	1822625857	FPTDLQRRWWAAFY-CMPLNLGQSA-N	430.303	1.931	50	20	IDGD	
O=C(N[C@@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1)c1ccc[n+]([O-])c1	1823001460	FYIZKXXWBPSBMF-SKDRFNHKSA-N	429.271	1.693	50	20	IDGD	
CCOC(=O)/C=C/C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1	1823003764	NVIVWSBPXYKJDE-ZHZVHNBDSA-N	434.287	1.865	50	20	IDGD	
O=C(c1cnc2c(c1)CCNCC2)N1CCC([C@H]2CCCCN2C(=O)[C@@H](O)CCl)CC1	1824188955	WUFSNWMOQLUGFI-RTWAWAEBSA-N	448.995	1.603	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CN(C)C(=O)C(=O)O)CC1	1824615297	NRJLZTHVNDDJCL-CVEARBPZSA-N	429.945	1.557	50	20	IDGD	
C[C@H](C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](F)Br)CC2)n1ccnn1	1824690758	JLVHIJJYJUYIEM-XLDPMVHQSA-N	431.291	1.598	50	20	IDGD	
CC[C@H](C)[C@@H](N)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1	1826842867	LNWLXUYPQAJPKY-RYGJVYDSSA-N	444.580	1.292	50	20	IDGD	
Cc1cc(C(=O)NCC(=O)N2CCC([C@H]3CCCCN3C(=O)[C@H](F)Cl)CC2)no1	1827608961	MUCNLQVXEXHAPO-WBVHZDCISA-N	428.892	1.867	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cncc(F)c3)C2)C1	1830537316	DDXZJGNADORGAS-UGSOOPFHSA-N	444.301	1.322	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)c[nH]1	1830538778	POVGTHRYDUZAKU-UGSOOPFHSA-N	428.327	1.424	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)C(C)(F)F)CCO2	1831684168	GTEIMBXXLUOZDJ-PXAZEXFGSA-N	441.313	1.908	50	20	IDGD	
O=C(Cc1ccc(F)cc1Cl)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1	1832273893	GUHVMEVGNCJRNC-APWZRJJASA-N	449.306	1.078	50	20	IDGD	
O=C(Cc1ccc(Cl)s1)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1	1832599508	CLCNZMKTMKXAMF-SUMWQHHRSA-N	437.345	1.000	50	20	IDGD	
O=C(CCc1cc(F)ccn1)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1832854365	NZHWWEWVKYVFQK-GOSISDBHSA-N	434.295	1.413	50	20	IDGD	
CN1CCCC[C@@H]1C(=O)NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1833318549	QOYUMLKTXJETPJ-IAGOWNOFSA-N	447.393	1.733	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCC(N2CCC(NC(=O)Cc3cnccn3)CC2)CC1	1833371971	DJDCTBVUFQQVOE-FQEVSTJZSA-N	442.391	1.827	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(C(C)=O)[nH]n3)CCO2)C1	1833820985	PMNYKBDCSSINDY-LIRRHRJNSA-N	426.901	1.090	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCBr)CCO3)C2)s1	1834819714	YTHNFWUNUPXXJV-QGZVFWFLSA-N	431.352	1.912	50	20	IDGD	
C[C@@H]1CCC[C@@H]1C(=O)NC1CCN(C2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1	1835511411	RRJLVGSPHYWDPB-XLIONFOSSA-N	435.613	1.367	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC1CCN(C2CCN(C(=O)/C=C/c3cnc[nH]3)CC2)CC1	1835837930	SXBDJRPCJVUAPC-SNAWJCMRSA-N	433.629	1.846	50	20	IDGD	
N#Cc1c[nH]c(C(=O)NC2CCN(C3CCN(C(=O)CCBr)CC3)CC2)c1	1836167316	ZCZGRQSJNQZIHD-UHFFFAOYSA-N	436.354	1.857	50	20	IDGD	
CC(C)N(C)CC(=O)N1CCC(N2CCC(NC(=O)[C@@H](F)Br)CC2)CC1	1836414623	USJQMMNDTPFWFM-QGZVFWFLSA-N	435.382	1.589	50	20	IDGD	
O=C(c1ccn2cncc2c1)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836717137	KCEPXNSLSLYGKY-LJQANCHMSA-N	434.924	1.546	50	20	IDGD	
C#CCO[C@@H](C)C(=O)N1CCC(OC2CCN(C(=O)CCBr)CC2)CC1	1836856881	ARXLJVDOSIFJSO-HNNXBMFYSA-N	429.355	1.808	50	20	IDGD	
CC(C)=NO[C@H](C)C(=O)N1CCOC[C@@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1837714470	HOGGEARNIKNFAH-VQIMIIECSA-N	429.590	1.095	50	20	IDGD	
CN1CCC[C@H](C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)C1	1839067216	JHKFWFSEAQRHJB-ZYSHUDEJSA-N	436.380	1.021	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(-n4cncn4)c3)C2)C1	1839147575	VYKUGVBMQDYOJT-NQIIRXRSSA-N	447.923	1.355	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cccc(F)c3F)C2)C1	1839147989	JAUQWNDHGIRIGJ-MGPUTAFESA-N	430.879	1.981	50	20	IDGD	
Cc1cc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)on1	1839150250	GNTQCUSSSAPOKX-ROUUACIJSA-N	434.320	1.218	50	20	IDGD	
O=C(c1cccc(-c2cnco2)c1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1839365301	CVFHPUZRGPXJBR-XLIONFOSSA-N	437.855	1.946	50	20	IDGD	
O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1[C@@H]3C=CS[C@@H]13)CCO2	1839696714	UYXUKHPYQMJULU-CRNXPOROSA-N	431.352	1.103	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CC3(F)F)C2)C1	1839965473	ZKWKWNZMJQAOMP-HUBLWGQQSA-N	425.270	1.272	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(F)(F)C(F)F)C2)C1	1840030396	KMQMKTOXVVOOHO-ZANVPECISA-N	435.212	1.127	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3ccc(F)cc3)C2)C1	1840155500	DMYVKUIPBXHLNX-NQIIRXRSSA-N	442.915	1.469	50	20	IDGD	
O=C(c1noc2c1CCCC2)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840187658	PEJJWPLWXOUDGF-SFHVURJKSA-N	432.304	1.427	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3ccoc3)CCO2)C1	1840516806	NNHJLRVCUYDEFZ-APWZRJJASA-N	443.338	1.842	50	20	IDGD	
Cc1ncc(/C=C/C(=O)N2CCO[C@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)s1	1840520385	CYNQCRWQGONCSO-RCAFFNEUSA-N	434.345	1.725	50	20	IDGD	
CC(=O)N[C@H](C)C(=O)N1CC2(CCCN2C(=O)[C@@H](Br)Cc2ccccc2)C1	1845942420	FKKCMAIYSRMUTM-PBHICJAKSA-N	436.350	1.721	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC2(CCCN2C(=O)C2CCC(O)CC2)C1	1846468980	UZRSXUGKSZZEOL-GPANFISMSA-N	443.972	1.873	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)C2CCC(O)CC2)C1	1846470172	CVGABXCKDDUNJW-UHFFFAOYSA-N	445.472	1.888	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)COC1CCCCC1	1847440711	KFACCJRLQZBCCR-XPVJKVDVSA-N	429.521	1.672	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@H](O)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@](C)(Cl)CCl	1847512622	QYXIQWBOZPRISB-PAKFGRKTSA-N	438.352	1.310	50	20	IDGD	
C#CCO[C@H](C)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O	1847806215	OFANWBIVFOKMJA-BVGQSLNGSA-N	429.429	1.374	50	20	IDGD	
O=C(COC(=O)c1ccccc1S(=O)(=O)N1CCCCC1)NNC(=O)c1ccccc1	11044698	FAWCOVDJYWWQJF-UHFFFAOYSA-N	445.497	1.479	50	20	IDGD	
CCCn1nc(C(=O)NNS(=O)(=O)c2ccccc2[N+](=O)[O-])c2ccccc2c1=O	16095540	MZTAGUAYXJDJRR-UHFFFAOYSA-N	431.430	1.338	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNS(=O)(=O)c1ccc(N2CCCC2=O)cc1	28808115	HGTZKPOSNVIFNW-UHFFFAOYSA-N	433.486	1.601	50	20	IDGD	
O=C(NNC(=O)N1CCCN(CCCc2ccccc2)CC1)c1ccc(-n2cnnn2)cc1	725860113	KIEVTWMIJNPMQB-UHFFFAOYSA-N	448.531	1.657	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccc(F)cc2F)CC1)NNC(=O)c1cccc(Cl)c1	726971406	HMBQFNBGPDPGTE-UHFFFAOYSA-N	436.846	1.837	50	20	IDGD	
CC(=O)N[C@H](CC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)c1c(F)cccc1F	727303613	WROPTDUBZAGDFF-MRXNPFEDSA-N	439.440	1.397	50	20	IDGD	
CN(C)N(C(=O)CN1C(=O)c2cc(Cl)c(Cl)cc2C1=O)[C@H]1CCS(=O)(=O)C1	728179111	FHXYOKIEJHNMPN-VIFPVBQESA-N	434.301	1.082	50	20	IDGD	
COc1cccc(-n2c(C)nnc2SCC(=O)N([C@@H]2CCS(=O)(=O)C2)N(C)C)c1	728179361	JUEBAKUVRMCMOC-OAHLLOKOSA-N	439.563	1.169	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)Cc3ccc4c(c3)CCO4)cc2)CC1	728214746	RVWNWOHHLNBDJB-UHFFFAOYSA-N	430.530	1.243	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ccc3nncn3n2)CC1)c1cccc(OC(F)F)c1	728487247	YSIFTUSOZFKXSJ-UHFFFAOYSA-N	431.403	1.403	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNS(=O)(=O)c1c(Cl)nc2sccn12	728502335	GRLBZOFVOOIGAI-UHFFFAOYSA-N	430.895	1.836	50	20	IDGD	
C[C@H]1C[C@@H](C)CN(CCCCNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)C1	728946684	RJZWELNTOWKCSQ-HDICACEKSA-N	431.585	1.782	50	20	IDGD	
CS(=O)(=O)CCNC(=S)NNC(=O)COc1ccc(-c2ccc(C#N)cc2)cc1	729157713	GOKAZMKJOAECFK-UHFFFAOYSA-N	432.527	1.144	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)C(=O)NCCCc1ccccc1	729511642	SAGGLGCCRNOACM-UHFFFAOYSA-N	434.290	1.724	50	20	IDGD	
O=C(Cn1[nH]cc2c(=O)ncnc1-2)NNc1ccc(S(=O)(=O)Nc2ccccc2)cc1	730588342	DHFNUZVTMVJQMV-UHFFFAOYSA-N	439.457	1.015	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)NC[C@@H]2CCCN2C(=O)OC(C)(C)C)nc2ccccc21	730909215	MLZXXJTVHCQKED-AWEZNQCLSA-N	430.509	1.846	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)c2nnn(-c3ccc4c(c3)OCCO4)c2C)cc1	731454643	HCPFLDKEIIKPCI-UHFFFAOYSA-N	438.444	1.229	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc2c(c1)C(=O)NC2=O)c1cc(F)ccc1Br	731596472	LGOTZMWSTDRLSO-UHFFFAOYSA-N	442.222	1.095	50	20	IDGD	
COC(=O)c1cc(OC(=O)Cn2c(=O)ccn(Cc3ccccc3)c2=O)ccc1[N+](=O)[O-]	732651895	WSXCZQRERIRAOE-UHFFFAOYSA-N	439.380	1.359	50	20	IDGD	
CCCCS(=O)(=O)N1CCC[C@@H]1C(=O)NNC(=O)Cn1c(CC)nc2ccccc21	734119648	GFANHUGISOLAGS-QGZVFWFLSA-N	435.550	1.340	50	20	IDGD	
COc1ccc([C@H]2[C@@H](C(=O)NNC(=O)COc3ccccc3O)CCC(=O)N2C)cc1	734433289	CDOLEUTXXJAQPT-KKSFZXQISA-N	427.457	1.537	50	20	IDGD	
CC(=NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1)c1cccc(S(N)(=O)=O)c1	734749748	ABXRZHUECLXZCT-UHFFFAOYSA-N	439.538	1.757	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2cccc(C(F)F)c2)CC1	735118329	SAQDHXPQOBXQNR-UHFFFAOYSA-N	425.461	1.712	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)NNC(=O)[C@H]2Cc3ccccc3CN2Cc2ccccc2)cn1	735513711	VCGHHWQUXCOINP-HXUWFJFHSA-N	447.499	1.022	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)CCn2nc(C)c([N+](=O)[O-])c2C)cc1C	736806969	JLSQHYMVFADEQO-UHFFFAOYSA-N	437.478	1.735	50	20	IDGD	
O=C(CCNS(=O)(=O)c1cccc(Cl)c1)NNC(=O)COCc1ccccc1	737923687	STNQGPQEKGDHCP-UHFFFAOYSA-N	425.894	1.373	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)c1ccc2c(=O)n(-c3ccccc3)c(O)nc2c1	740853038	SFOGIVJWIOLGMY-UHFFFAOYSA-N	437.456	1.157	50	20	IDGD	
C[C@H](CC(=O)c1ccccc1F)C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	742472101	XPPSNEYHTBMCBP-CYBMUJFWSA-N	435.477	1.746	50	20	IDGD	
Cn1ccnc1[C@](O)(CC(=O)NNC(=O)c1cccc(Br)c1)C(F)(F)F	742773514	WNKPNKCHJYJYLV-CQSZACIVSA-N	435.200	1.784	50	20	IDGD	
CSC1(CNC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)CCOCC1	743510668	ZRXQFMXGLJAMPJ-UHFFFAOYSA-N	429.568	1.144	50	20	IDGD	
Cc1nc2ncnn2c(C)c1CCC(=O)NNC(=O)c1cc(Br)ccc1O	743732091	KFVDXPJLVFIDJG-UHFFFAOYSA-N	433.266	1.603	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)NNC(=O)Nc2ccc(OC(F)F)cc2)ccc1OC	743831731	FENRWPBIZTXSKB-UHFFFAOYSA-N	444.416	1.671	50	20	IDGD	
C[C@H]1CCCC[C@@]12NC(=O)N(CC(=O)NNC(=O)Nc1ccc(OC(F)F)cc1)C2=O	743832634	XQYDXBVBCFPFLG-JEOXALJRSA-N	439.419	1.941	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)CN2CCN(C(=O)c3cc4ccccc4[nH]3)CC2)cc1	744392643	WYEODIIPONMCPE-UHFFFAOYSA-N	430.468	1.259	50	20	IDGD	
CCS(=O)(=O)NCc1ccc(C(=O)OCC(=O)NNC(=O)c2ccc(C)cc2)cc1	745140766	JNTAWJSRYIVGGD-UHFFFAOYSA-N	433.486	1.052	50	20	IDGD	
CC(C)c1nn(C)c(Cl)c1C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	745191281	PVVSFKRRXPPSSP-ZDUSSCGKSA-N	436.852	1.341	50	20	IDGD	
CC(C)=CC(=O)NCc1ccc(C(=O)OCC(=O)NNC(=O)Cc2nc(C)cs2)cc1	745633585	SCCPMPOFQJELKA-UHFFFAOYSA-N	444.513	1.581	50	20	IDGD	
C[C@H](O)[C@H](NC(=O)C(C)(C)C)C(=O)OCC(=O)C(C#N)=C1N(C)c2ccccc2N1C	745700943	IDGAEQITVLDXDD-UGSOOPFHSA-N	428.489	1.332	50	20	IDGD	
CCO[C@H]1C[C@@H](NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)C12CCC2	745851917	XVZNKLQAHAKDMY-SJORKVTESA-N	438.550	1.294	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)c2cc(S(=O)(=O)N3CCCC3)ccc2O)c1	745990935	LLJCDWHPQJQXAS-UHFFFAOYSA-N	432.502	1.318	50	20	IDGD	
C[C@H]1CC(C)(C)C[C@]2(C1)NC(=O)N(CC(=O)NNC(=O)Cc1cn3ccccc3n1)C2=O	746554187	YEDPOXODTDILEM-FPTDNZKUSA-N	440.504	1.161	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)CCc2c(C)nc3cc(O)nn3c2C)cc1	746943882	WXSFRKABLSCVSS-UHFFFAOYSA-N	425.445	1.297	50	20	IDGD	
COc1cc(C(C)=NNC(=O)Cn2nnc(-c3ccccc3)n2)ccc1S(C)(=O)=O	747042808	SLRFXMBPCBIVSK-UHFFFAOYSA-N	428.474	1.293	50	20	IDGD	
O=C(CN1c2cccc3cccc(c23)S1(=O)=O)NNC(=O)c1cc(Br)c[nH]1	750844252	ZUNROWBDTLLWAI-UHFFFAOYSA-N	449.286	1.900	50	20	IDGD	
O=S(=O)(NNc1ccc(S(=O)(=O)NC2CC2)cn1)c1ccc(CCCCl)cc1	751269669	PUJFXKWIJLLYAX-UHFFFAOYSA-N	444.966	1.999	50	20	IDGD	
CCOC(=O)[C@H]1Cc2cc(S(=O)(=O)NNC(=O)C(C)(C)c3ccccc3)ccc2O1	751548281	OUGKXVGVHNXBIL-GOSISDBHSA-N	432.498	1.841	50	20	IDGD	
CC(C)(C(=O)NNC(=O)NCCNS(=O)(=O)c1ccc(Cl)s1)c1ccccc1	752170976	OETMOSCTFDBPMP-UHFFFAOYSA-N	444.966	1.988	50	20	IDGD	
CC(C)Oc1cc(CNC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)ccn1	752696615	AINHKZRPQDRODY-UHFFFAOYSA-N	440.548	1.912	50	20	IDGD	
N#Cc1ccc(NNC(=O)[C@@H]2CC(=O)N(c3cccc(S(N)(=O)=O)c3)C2)cc1Cl	753302078	FMZHVRSOFCKNKP-GFCCVEGCSA-N	433.877	1.355	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1ccc(Br)c(C(F)(F)F)c1	755425368	PMZOZMJXHGEYEC-ZCFIWIBFSA-N	447.233	1.558	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2cc(Br)c[nH]2)cc1	755515649	FWVREFMCTZVEKS-UHFFFAOYSA-N	444.311	1.930	50	20	IDGD	
CS(=O)(=O)c1ccccc1-n1cc(NC(=O)NNC(=O)COc2ccccc2F)cn1	756704555	HSSCHLURILQISP-UHFFFAOYSA-N	447.448	1.647	50	20	IDGD	
CCOC(=O)[C@@H](C)NC(=O)c1ccc(NC(=O)NNC(=O)c2ccc(C)cc2O)cc1	756789975	KEAAUJGTJRGLGN-CYBMUJFWSA-N	428.445	1.849	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNc3ccc(C(N)=O)nn3)c2)cc1	757408616	WTBLFIWVIOKGDP-UHFFFAOYSA-N	442.457	1.142	50	20	IDGD	
C[C@H]1C[C@@H](NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)CN1Cc1ccccc1	757762102	JMSYPDHJVNIXKU-DOTOQJQBSA-N	434.500	1.541	50	20	IDGD	
CC(=NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1)c1cc([N+](=O)[O-])ccc1O	758119824	UYVCLROXTNIRBC-UHFFFAOYSA-N	425.445	1.599	50	20	IDGD	
C#CCNC(=S)NNC(=O)c1ccc(CN(C)S(=O)(=O)c2ccc(C)cc2)cc1	758170947	FSEGRAAWKPVJFD-UHFFFAOYSA-N	430.555	1.558	50	20	IDGD	
CCNS(=O)(=O)c1ccc(CC(=O)NNC(=S)Nc2ccc(OCC)cc2)cc1	759357758	QPNMZEZSMVAYEB-UHFFFAOYSA-N	436.559	1.944	50	20	IDGD	
O=C(NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)C(=O)c1ccc(Cl)s1	760067049	QXXDMBNKCDKSQD-UHFFFAOYSA-N	441.918	1.830	50	20	IDGD	
C[C@H](NC(=O)c1cccc(Cl)c1Cl)C(=O)NNc1nccc(N2CCOCC2)n1	762860025	AQMLDMUVOFVXAF-NSHDSACASA-N	439.303	1.882	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2ccncc2)cccc1-c1nnc2n1CCCCC2	763464038	KMNBHMYLVATTMF-UHFFFAOYSA-N	433.472	1.775	50	20	IDGD	
CN(C)CCC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2c[nH]c3ccccc23)cc1	763535253	QLPXIHFBXNRRAX-UHFFFAOYSA-N	436.472	1.458	50	20	IDGD	
CCc1cc(Br)ccc1NC(=O)C(=O)NNC(=O)[C@H]1COc2ccccc2O1	763575251	RZUMCESHKLBDMN-MRXNPFEDSA-N	448.273	1.937	50	20	IDGD	
O=C(NCc1ccc(N2CCCS2(=O)=O)cc1)NNC(=O)c1ccc2ccccc2n1	763707280	YGFSFAKOOBVWEE-UHFFFAOYSA-N	439.497	1.919	50	20	IDGD	
CS(=O)(=O)c1ccc(F)c(NC(=O)C(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)c1	763723011	MURRADARCJHXQZ-UHFFFAOYSA-N	437.493	1.532	50	20	IDGD	
CCc1ccc(NC(=O)C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1C	763739136	ZXSCRFFHIYQDAD-UHFFFAOYSA-N	446.529	1.272	50	20	IDGD	
COCCS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cccc(Cl)c2)cc1	763747180	AJWPXYGPCMZUFJ-UHFFFAOYSA-N	439.877	1.160	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccco3)nc3ccccc23)c(=O)n(C)c1	763762386	AYNYTWCMHYNOAF-UHFFFAOYSA-N	445.435	1.902	50	20	IDGD	
CC(C)COc1ccccc1NC(=O)C(=O)NNC(=O)COc1ccccc1[N+](=O)[O-]	763804252	RAQZTLGMAYBVRE-UHFFFAOYSA-N	430.417	1.795	50	20	IDGD	
COC(=O)c1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)COc1ccccc1C#N	763806929	JEWRBQVHYRAGRU-UHFFFAOYSA-N	430.804	1.163	50	20	IDGD	
CC(C)(C)OC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)cn1	763840330	SACSJKLTQYIQMB-UHFFFAOYSA-N	447.423	1.733	50	20	IDGD	
COC(=O)NCc1ccc(NC(=O)C(=O)NNC(=O)CCSc2ccc(F)cc2)cc1	763895038	KBIINZIAZHGJMX-UHFFFAOYSA-N	448.476	1.950	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)C(=O)Nc1csc(-c2ccccn2)n1	763943960	HYMVYCANJDKVSI-UHFFFAOYSA-N	449.452	1.496	50	20	IDGD	
CN(Cc1cccc(NC(=O)C(=O)NNC(=O)c2cccn2C)c1)C(=O)OC(C)(C)C	763998498	LFSKRSCTGUTPFM-UHFFFAOYSA-N	429.477	1.792	50	20	IDGD	
C[C@@H](Oc1ccccc1NC(=O)C(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1)c1ccccc1	764001598	BFWBDXPDLIKFSS-ZBFHGGJFSA-N	445.497	1.347	50	20	IDGD	
Cc1nnnn1-c1cccc(NC(=O)C(=O)NNC(=O)Cc2cccc3ccccc23)c1	764019486	NHJIMFWOGYRZBX-UHFFFAOYSA-N	429.440	1.453	50	20	IDGD	
CCS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)CCc2ccc(OC)cc2)cc1	764126830	JWXHMTVJDXWCRT-UHFFFAOYSA-N	433.486	1.208	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)Cc3ccccn3)cc2F)C[C@H](C)O1	764266789	LLLPAJBRYGPLCI-KBPBESRZSA-N	429.452	1.163	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1cccc(NC(=O)c2ccccc2)c1	764278395	YAIRCWYQMHPELY-UHFFFAOYSA-N	448.435	1.809	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)C(=O)Nc1ccc(C[C@@H]2CC(=O)NC2=O)cc1)c1ccccc1	764327809	FMVYYJVMYIYMRH-SJLPKXTDSA-N	436.468	1.172	50	20	IDGD	
O=C(NNC(=O)c1cc2ccccc2o1)C(=O)Nc1cccc(-c2nnnn2C2CC2)c1	764330878	LKROWVIBMNYHBN-UHFFFAOYSA-N	431.412	1.821	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)c1ccc(Sc2ccccc2Cl)nn1	764343693	QRRWSWSTGXREDQ-UHFFFAOYSA-N	442.888	1.867	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)C(=O)Nc1ccccc1-n1cc(Br)cn1	764353456	HEOQTUCXBLEMMJ-UHFFFAOYSA-N	443.261	1.358	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)Cc2ccncc2)cccc1C(=O)Nc1ccccc1	764356383	WJNNYAHWRPJGMH-UHFFFAOYSA-N	431.452	1.971	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1)C(=O)Nc1cccnc1-n1cccn1	764387317	JQYXHPKCRBKKDC-UHFFFAOYSA-N	434.391	1.196	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)C(=O)Nc1cccc(N2CCOC2=O)c1	764400752	GZULTHCIZGZKGM-UHFFFAOYSA-N	430.442	1.227	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])c2cccnc12)c1csc(N2CCOCC2)n1	765531176	NLLUYWDWDYSYRS-UHFFFAOYSA-N	428.430	1.511	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)cc1S(=O)(=O)N(C)C	765568946	ABAOYVSXPQKFCS-UHFFFAOYSA-N	449.514	1.472	50	20	IDGD	
O=C(CCN1C(=O)[C@H]2CCCC[C@@H]2C1=O)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	765618796	OIHPOVPZXBSNTQ-GJZGRUSLSA-N	427.436	1.542	50	20	IDGD	
CC(C)c1ccc(OCC(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cc1	765733025	LNLBLCCFYZNFQS-UHFFFAOYSA-N	438.528	1.794	50	20	IDGD	
O=C(CCn1cc(Cl)cn1)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	765757326	CHTFNIQHMSDMPU-UHFFFAOYSA-N	439.347	1.545	50	20	IDGD	
Cc1cc(C=NNC(=O)C[C@@H](C(=O)NN=Cc2cc(C)oc2C)N2CCOCC2)c(C)o1	767901655	WCFSNTCPGBVJFB-FQEVSTJZSA-N	443.504	1.798	50	20	IDGD	
C[C@@H](O)CNC(=O)/C(C#N)=C/c1cn(CCC(N)=O)nc1-c1ccc(Br)cc1	769106466	NCIPFPMHZKVUOX-ZBQKXELDSA-N	446.305	1.592	50	20	IDGD	
CSCCNC(=S)NNC(=O)CS(=O)(=O)c1cccc(Br)c1	769767308	JDJKCRJLUGTTQN-UHFFFAOYSA-N	426.383	1.081	50	20	IDGD	
CN1C(=C(C#N)C(=O)COC(=O)c2ccc(S(N)(=O)=O)cc2F)N(C)c2ccccc21	769860637	WTVDMWKEOHLIJO-UHFFFAOYSA-N	444.444	1.520	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)CCN3CCN(c4ccccc4)CC3)nc21	770958391	MKDWWYNKPBEVJH-UHFFFAOYSA-N	438.536	1.942	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1cc(S(=O)(=O)NCc2ccco2)ccc1C	771874703	MAGKLZZGXDIJDF-ZDUSSCGKSA-N	437.474	1.169	50	20	IDGD	
COc1cccc(-n2c(CC(=O)NNC(=O)CC#N)csc2=NCc2ccco2)c1	771879913	ATDZVCJWMQKOBW-UHFFFAOYSA-N	425.470	1.845	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)c1cc2ccccc2cc1NS(C)(=O)=O	771912339	HDLRKXYHLKSGGW-CYBMUJFWSA-N	435.502	1.950	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)NCCN(C)S(=O)(=O)c2cccs2)c1	772014667	BQAOFYKENVKJNR-UHFFFAOYSA-N	425.536	1.079	50	20	IDGD	
Cc1cc(S(N)(=O)=O)cc(C(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)c1C	772993573	CQLMZWVTTGGWSZ-GFCCVEGCSA-N	425.894	1.833	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2)cc1OC	773643054	HMMNHICEPZLVQF-UHFFFAOYSA-N	437.434	1.447	50	20	IDGD	
O=C(CN1CCOCC1)Nc1ccc(NC(=O)C(=O)NNc2c(F)cccc2F)cc1	773719240	ZKROTAKIECWZHW-UHFFFAOYSA-N	433.415	1.317	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cc1Cl	777812505	GLZBRJLOMLQBCX-UHFFFAOYSA-N	425.876	1.431	50	20	IDGD	
CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)NNC(=O)CNC(=O)OC(C)(C)C	778437502	FCPGMVSXOMNUNY-MRXNPFEDSA-N	435.456	1.026	50	20	IDGD	
COC1CCN(C2(CNC(=O)NNC(=O)CNC(=O)OC(C)(C)C)CCCC2)CC1	778661632	QGRBCPWTWGVESU-UHFFFAOYSA-N	427.546	1.265	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCOC[C@H]1c1noc(C(C)C)n1	779632801	VMXHZJFSQBAEJN-AWEZNQCLSA-N	437.884	1.690	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2Br)c2ccccc2c1=O	782162499	OVAONCMUDOXQNO-UHFFFAOYSA-N	446.217	1.679	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2cccc(S(=O)(=O)NC(C)(C)C)c2C)nc(C)n1	783325581	NKOVZNYGJDMMFL-UHFFFAOYSA-N	434.522	1.560	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2cccc(S(=O)(=O)N(C)C3CCCCC3)c2)ncn1	783948354	NDGMLHZKECKUPH-UHFFFAOYSA-N	446.533	1.820	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)c1cc2c(=O)n3ccccc3nc2n1C	784294898	ULAZCKMXDCIERB-UHFFFAOYSA-N	443.467	1.560	50	20	IDGD	
CO[C@@H](C)C(=O)Nc1cccc(NC(=O)C(=O)NNc2ccc(Br)nc2)c1	784812415	ODGSZKQOWOKELH-JTQLQIEISA-N	436.266	1.899	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1ccc(F)cc1C#N	784832902	GJLZHAIPQQFWIF-UHFFFAOYSA-N	433.465	1.856	50	20	IDGD	
COC(=O)CCNC(=O)c1ccc(NC(=O)C(=O)NNc2ccc(Cl)c(F)c2)cc1	785180150	IEUWNOQEXQEZMR-UHFFFAOYSA-N	436.827	1.854	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)N[C@@H]2CCCN(C3CCCCC3)C2=O)cc1C	785921512	FBIBPSFAMTUTFO-GOSISDBHSA-N	429.521	1.896	50	20	IDGD	
N#C/C(=C\C1CC1)C(=O)OCC(=O)NCc1ccccc1S(=O)(=O)N1CCCCC1	786669672	LWIOAHMWBJJMFE-LDADJPATSA-N	431.514	1.881	50	20	IDGD	
CCS(=O)(=O)CCn1cc(C)c(NC(=O)NNC(=O)c2cccc3ncccc23)n1	786713367	NTBMPGOUUHUAQE-UHFFFAOYSA-N	430.490	1.641	50	20	IDGD	
O=C(COC(=O)COc1ccc([N+](=O)[O-])c2cccnc12)NNC(=O)c1cccs1	786784438	UYJJIDKIHZPCGZ-UHFFFAOYSA-N	430.398	1.588	50	20	IDGD	
Cc1ccc(CNC(=O)NNC(=O)CNC(=O)OC(C)(C)C)c(-n2cc(Cl)cn2)n1	787287542	XJJMUNLFWULHAU-UHFFFAOYSA-N	437.888	1.584	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)CC(C)(C)C)cc1S(=O)(=O)N1CCCC1	787542976	SRILCGZLOGBMBN-UHFFFAOYSA-N	440.522	1.002	50	20	IDGD	
O=C(NNc1nnc(-c2ccccn2)s1)[C@@H]1CC(=O)N(c2ccc3c(c2)OCCO3)C1	788557981	CZHJSPFSXAPSKD-GFCCVEGCSA-N	438.469	1.868	50	20	IDGD	
CC(=O)N1CCc2ccc(S(=O)(=O)NNC(=O)CCCc3ccccc3)cc2CC1	790053268	OBIZTCCQXVYCFO-UHFFFAOYSA-N	429.542	1.966	50	20	IDGD	
Cc1cc(F)c(Br)cc1S(=O)(=O)NNC(=O)CNC(=O)c1ccco1	790389171	JXJMZZHDTBQNIN-UHFFFAOYSA-N	434.243	1.229	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)Cc2cccc(C(F)F)c2)CC1	790730691	QYPQFILNDXYNDA-UHFFFAOYSA-N	439.488	1.641	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@H]2CCS(=O)(=O)c3ccccc32)c2ccccc2c1=O	791002771	JJLILXPOYYYQNC-HNNXBMFYSA-N	440.481	1.139	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCCCC2)cc1)NNc1nc2ccccn2n1	791240263	ZSWXJAZOVMEREC-UHFFFAOYSA-N	428.518	1.980	50	20	IDGD	
COc1cc(C(F)(F)F)ncc1NC(=O)C(=O)NNC(=O)c1ccc(O)c(Cl)c1	792265477	BKKJCRHBNBZFMK-UHFFFAOYSA-N	432.742	1.868	50	20	IDGD	
CN(NC(=O)CCc1ccccc1C(N)=O)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	792316285	BJZWJBHRYLJVMG-UHFFFAOYSA-N	433.509	1.354	50	20	IDGD	
CC(C)(C)OC(=O)NCc1ccc(NC(=O)C(=O)NNc2nc3ccccn3n2)cc1	792393308	CVMDWPPLZOZGTR-UHFFFAOYSA-N	425.449	1.836	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ccc(OC)c(OC)c2)c(F)cc1C	793023540	QHAOJEOWGNJJBH-UHFFFAOYSA-N	447.419	1.728	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNC(=O)Cn1cnc2c(oc3ccccc32)c1=O	794075439	JFVNLZOHCNZDDI-UHFFFAOYSA-N	449.423	1.217	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H]2[C@@H](C1)[C@@H]2C(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	794413002	KZURIUDEXSIJNM-FICVDOATSA-N	436.896	1.217	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1nc2nc(C)cc(C)n2n1	794989143	ZKVMABIJWDLNII-UHFFFAOYSA-N	432.824	1.021	50	20	IDGD	
COc1ccccc1CCNC(=O)CNC(=O)NNC(=O)c1cnn(-c2ccccc2)c1	798064058	LRNWWBWDFLXLOK-UHFFFAOYSA-N	436.472	1.184	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NCc1ccncc1OCC(F)(F)F	798522395	MHBBWLKDFQCGTF-UHFFFAOYSA-N	431.396	1.345	50	20	IDGD	
CCOC(=O)[C@@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)c1cc(C)nc2ccccc12	799009295	SPEVWBLIEUPCDE-INIZCTEOSA-N	430.461	1.761	50	20	IDGD	
CCc1cccc(C)c1NNC(=O)C(=O)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1	799842451	HVLZGMFXWAESRS-UHFFFAOYSA-N	446.529	1.660	50	20	IDGD	
CCOC(=O)Oc1ccc(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)cc1	800508646	CPCFFOSFMWNZQB-UHFFFAOYSA-N	449.485	2.000	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CCn2c(S)nc3ccccc3c2=O)cc1	801107191	PIZWIQIOSOMRCX-UHFFFAOYSA-N	425.470	1.170	50	20	IDGD	
COc1ccc(-n2cc(O)c(C(=O)NNC(=O)Nc3ccc(S(C)(=O)=O)cc3)n2)cc1	802067091	LAILEVIXXXNJQF-UHFFFAOYSA-N	445.457	1.457	50	20	IDGD	
Cc1c(C(=O)NNC(=O)Nc2ccc3c(c2)OCO3)sc2nc3n(c(=O)c12)CCC3	802102920	GFABHPSWQSICFQ-UHFFFAOYSA-N	427.442	1.908	50	20	IDGD	
CCN1C(=O)c2ccc(C(=O)NNC(=O)Nc3ccc(N(C)C)cc3)cc2S1(=O)=O	802119832	BCNARZFBKGOFEX-UHFFFAOYSA-N	431.474	1.384	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)NCCNS(=O)(=O)c1ccc(F)cc1Cl	802432307	AWLMISUBVWACAP-UHFFFAOYSA-N	446.863	1.470	50	20	IDGD	
COC[C@]1(CNC(=O)NNC(=O)c2ccc(C#N)cc2)CCCN1C(=O)OC(C)(C)C	805026110	CIPOBCFMRVLIHS-OAQYLSRUSA-N	431.493	1.918	50	20	IDGD	
CCN(CC(=O)NNC(=O)c1csc(N2CCOCC2)n1)Cc1ccccc1Cl	806338013	JTXCNLMBGVPFQV-UHFFFAOYSA-N	437.953	1.916	50	20	IDGD	
O=C(NNC(=O)C(=O)Nc1ccccn1)N[C@H](c1cncc(Br)c1)C1CC1	807252362	PDIBSVPIADLISH-AWEZNQCLSA-N	433.266	1.659	50	20	IDGD	
Cc1nc(Cl)ccc1S(=O)(=O)NNC(=O)c1sc(N2CCOCC2)nc1C	808070168	PLZXMGNWEYJOHN-UHFFFAOYSA-N	431.927	1.268	50	20	IDGD	
O=C(NNC(=O)c1cnccn1)C(=O)Nc1cnn(-c2ccc(F)cc2)c1C(F)(F)F	810384854	QPFDBVKZODFZOA-UHFFFAOYSA-N	437.313	1.220	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)C(=O)Nc2cnn(-c3ccc(F)cc3)c2C(F)(F)F)cn1	810387320	PVCHPHUPZSMBNN-UHFFFAOYSA-N	439.329	1.163	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)Nc1cccc(N2C(=O)N[C@](C)(C3CC3)C2=O)c1	812985937	KSINGFRBOLKUFP-FKIZINRSSA-N	433.465	1.116	50	20	IDGD	
COC(=O)C(C)(C)c1csc(NC(=O)C(=O)NNC(=O)c2cc3ccccc3o2)n1	815569857	KFJSPHIGHAHBRV-UHFFFAOYSA-N	430.442	1.740	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)/C=C\CN(C)CC(F)(F)F)cc2)CC1	815854859	UGJKTBXNDYXRFT-ARJAWSKDSA-N	449.499	1.116	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)[C@H](CC(C)C)N1C(=O)[C@@H]2CC=CC[C@H]2C1=O	825630854	QWRBERZQOQSYBT-NUJGCVRESA-N	442.516	1.620	50	20	IDGD	
CC(C)Cn1nc(C(=O)OCC(=O)NNC(=O)c2cccs2)c2ccccc2c1=O	848977865	DAXZHCXCOSCVLD-UHFFFAOYSA-N	428.470	1.732	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)[C@@H](C)N1C(=O)c2ccc(C)cc2C1=O	892277048	NAMGDCFARXIRME-CQSZACIVSA-N	433.468	1.739	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)CCc2ccc(S(=O)(=O)NC3CC3)cc2)c1	913464944	FSEXYRPDJSKYIV-UHFFFAOYSA-N	430.530	1.587	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)c1ccc(NC(=O)C2CC2)cc1	913628109	WIAYOEARZMPXAS-ZDUSSCGKSA-N	434.460	1.716	50	20	IDGD	
CNS(=O)(=O)c1ccc(C(=O)NNC(=O)C2=S=C3CC[C@@H](C(C)(C)C)CC3=C2)o1	915064395	MFBCZAOXJFLIGT-GFCCVEGCSA-N	439.559	1.813	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)C(=O)Nc2cc(C)on2)c2ccccc2c1=O	915357461	LVDIEIXYXQTGRX-UHFFFAOYSA-N	426.433	1.283	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NCc2ccc(C(=O)N3CCCC3)cc2)c2ccccc2c1=O	916252663	MNJWMKSPNZTGPL-UHFFFAOYSA-N	448.483	1.314	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCc2cccc(C(=O)N(C)C)c2)cc(OC)c1OC	916483183	CZYPYKJDPPMMDW-UHFFFAOYSA-N	430.461	1.558	50	20	IDGD	
COc1cc(CNC(=O)NNC(=O)c2ccc(Cl)cc2)ccc1OCC(=O)N(C)C	916641437	GVJCKOQPMHOYRF-UHFFFAOYSA-N	434.880	1.960	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)CCNS(=O)(=O)c3ccccc3)n[nH]2)cc1	917175677	HIVIAXJOPCZCNI-UHFFFAOYSA-N	427.486	1.515	50	20	IDGD	
C[C@H]1C[C@@H](C)CN(S(=O)(=O)c2cccc(C(=O)NNC(=O)NCC(F)(F)F)c2)C1	918707049	KQCXIAUWTNGJSR-TXEJJXNPSA-N	436.456	1.860	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)CN(C)c2nc3ccccc3s2)c2ccccc2c1=O	919743061	ZDSSZMFLTCKZLF-UHFFFAOYSA-N	436.497	1.924	50	20	IDGD	
C[C@@H](Cc1cccc(O)c1)NC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	919784409	PUWSYOJTLBEKFR-HNNXBMFYSA-N	446.529	1.752	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)c2cccc(S(=O)(=O)NCC3CC3)c2)cc1	919834137	NCSMTKBHJGNSTD-UHFFFAOYSA-N	431.514	1.777	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)[nH]n1)Nc1ccccc1CN1C(=O)CNC1=O	920932541	NMSLEOUMECQHSD-UHFFFAOYSA-N	433.428	1.595	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)CCCN(C)C(=O)OC(C)(C)C)c2ccccc2c1=O	921301154	PGTDFIRAIGPSQB-UHFFFAOYSA-N	431.493	1.825	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)[C@H](CSC)N2C(=O)[C@H]3CCCC[C@@H]3C2=O)c1	929085883	RBZCPXIXOBGLPO-ULQDDVLXSA-N	449.529	1.372	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)[C@H]2CC(=O)N(c3ccc(C#N)cc3)C2)cc1	1318034334	VDJQPRXPTIMTOW-RDJZCZTQSA-N	436.468	1.925	50	20	IDGD	
CS(=O)(=O)c1nc(C(=O)NNC(=O)c2ccc(Br)cc2)c2ccccn12	1318045495	GKAPERGYFMAQOX-UHFFFAOYSA-N	437.275	1.575	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N[C@@H](C)C(=O)NCC(F)(F)F)cc1Br	1318504797	SWPJBRMXLCZNCW-ZETCQYMHSA-N	441.204	1.469	50	20	IDGD	
Cc1nc(C(=O)NNc2cncc(Br)c2)nn1-c1n[nH]c(C(F)(F)F)n1	1319748363	PUGHGDDZJPNQTC-UHFFFAOYSA-N	432.164	1.627	50	20	IDGD	
O=C(NNC(=O)N1CCC(n2cc(Cl)cn2)CC1)C1CCN(c2ncccn2)CC1	1319932213	WOUVIPPZVYINGJ-UHFFFAOYSA-N	432.916	1.621	50	20	IDGD	
CNS(=O)(=O)c1ccc(CC(=O)NNC(=O)CCSc2ccc(F)cc2)cc1	1320288960	JPMMBBRHAFGZAX-UHFFFAOYSA-N	425.507	1.606	50	20	IDGD	
CNS(=O)(=O)c1ccc(CC(=O)NNC(=O)c2ccc(F)cc2Br)cc1	1323861297	FPEKWMJSFMUKOT-UHFFFAOYSA-N	444.282	1.500	50	20	IDGD	
Cn1ccc(NNC(=O)CCNS(=O)(=O)c2ccc(Cl)c(C(F)(F)F)c2)n1	1326698342	XRIAURQNKOYICH-UHFFFAOYSA-N	425.820	1.904	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCCc2ccc(OCC(=O)NC3CC3)cc2)cc1	1337603933	IKSSPRDHCCXUBA-UHFFFAOYSA-N	426.473	1.539	50	20	IDGD	
CC(C)(C)S(=O)(=O)N1CCC(NC(=O)NNC(=O)c2cncn2-c2ccccc2)CC1	1339006825	LHFVXKXWRYXSPT-UHFFFAOYSA-N	448.549	1.409	50	20	IDGD	
CC1(C)NC(=O)N(CCCNC(=O)NNC(=O)c2cccc(Br)c2)C1=O	1341380509	IGGDYJABXQHZRB-UHFFFAOYSA-N	426.271	1.114	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4nonc4c3)C2)C1	1777714358	OTRQJUICCFDKOF-KPZWWZAWSA-N	437.294	1.697	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)[C@@H]3CCC[C@H]4CCCC[C@H]43)C2)C1	1778299011	NJHFVHOZYJEKIJ-DBYOASNMSA-N	448.608	1.796	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnn3cccnc13)C2	1779543903	DLSCBSFZGWYKJN-DYESRHJHSA-N	445.596	1.708	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(-c4ccccn4)[nH]n3)C2)C1	1779632292	ZOKRKRIWSIBGHW-DJJJIMSYSA-N	448.321	1.699	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnc4snnc4c3)C2)C1	1780071810	PLECVNSKRDLWRU-IAGOWNOFSA-N	444.344	1.766	50	20	IDGD	
Cn1ccc(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@](C)(Cl)CCl)C2)n1	1780713289	PTRMAZDPGVOINR-ATZDWAIDSA-N	431.364	1.713	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(N4CCOCC4)cc3)CCO2)C1	1781218261	MUUVSXAOLWLGON-KNQAVFIVSA-N	435.952	1.984	50	20	IDGD	
CC(=O)Nc1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)ccn1	1781229758	LODFRTGAEOLOLV-OALUTQOASA-N	443.331	1.720	50	20	IDGD	
COc1cnc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](F)Br)C3)C2)c(F)c1	1781328137	JCXDQOJWGMSHEI-BBRMVZONSA-N	434.237	1.363	50	20	IDGD	
O=C(c1c[nH]c2ncccc12)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781329883	MQFIBNVINYRLMB-DYVFJYSZSA-N	425.258	1.697	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](O)Cc2ccccc2)C1	1781895874	JUSJFVMQCDMPTN-PSHVLCQKSA-N	438.952	1.358	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc3nn(C)cc3c1)C2	1782177922	AMWDCNGPRDOIOE-SFGWALBWSA-N	448.951	1.955	50	20	IDGD	
CC(C)(O)CC(=O)N1CCO[C@@]2(CCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1	1782864665	QQNGMECRKNGDOH-NAVGAYGYSA-N	433.455	1.863	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccc([N+](=O)[O-])[nH]3)CCO2)C1	1783351138	FNKMRWXQDYLJEO-MEDUHNTESA-N	429.271	1.540	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)Cc3ccc(O)cn3)CCO2)C1	1783354276	OPYOOCZWHATCGL-MAUKXSAKSA-N	426.311	1.333	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](C)n1cc(C)cn1)CCO2	1783354520	SKYAIPYZUXDTPP-MPGHIAIKSA-N	427.343	1.756	50	20	IDGD	
CC(C)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4c(c3)CNC4=O)C[C@@H]21	1783851572	DHCNAVPLCOYUKM-WBAXXEDZSA-N	433.936	1.788	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3n[nH]c4cc(Cl)ccc34)CCO2)C1	1783876815	ATXALZNMPHITTI-KUHUBIRLSA-N	441.315	1.914	50	20	IDGD	
O=C(C(Cl)Cl)N1CC[C@]2(C1)CN(C(=O)[C@H]1C[C@@]13C(=O)Nc1ccccc13)CCO2	1783950051	KDOUIXXWGOCUKC-CWVNLOTRSA-N	438.311	1.530	50	20	IDGD	
O=C(Nc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]3C2)cc1)C1CC1	1784093261	TYIKAYCVIBZUJZ-WNHJNPCNSA-N	449.935	1.228	50	20	IDGD	
CCOC(CC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2)OCC	1784165769	GAOGDFXHYJCAES-ZBFHGGJFSA-N	425.295	1.296	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3(N4CCN(C)CC4)CC3)C[C@@H]21	1784620521	CMSSPVNKHJVMRH-OKYOBFRVSA-N	441.016	1.154	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@](C)(O)C(F)(F)F)[C@H]2C1	1784872405	UMHTTWWRYSVMKK-SQRMYFJTSA-N	445.276	1.310	50	20	IDGD	
O=C(C1Cc2ccccc2C1)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1785683398	DSSLKNWQLSQPNP-LPHOPBHVSA-N	425.298	1.922	50	20	IDGD	
Cc1nc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCBr)[C@H]3C2)ccc1F	1786400941	HLCVTOVVBKUOMZ-XEZPLFJOSA-N	428.302	1.907	50	20	IDGD	
CC[C@H](C)[C@H](O)C(=O)Nc1ccc(C2(NC(=O)c3cnccc3C(=O)NN)CCC2)cc1	1786401908	ZWJVADLMMUAFRA-LIRRHRJNSA-N	439.516	1.840	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4c(c3)OCO4)C[C@@H]21	1786407295	WGOZOWWXBKBIMH-ZQIUZPCESA-N	439.306	1.794	50	20	IDGD	
Nc1c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)C(Cl)Cl)C[C@@H]32)sc2nccnc12	1786952999	RMEPZZLZXVCOQW-GUBZILKMSA-N	444.344	1.671	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(N4CCOCC4)c3)C[C@@H]21)[C@@H](F)Cl	1787449189	CXIJYIIIOQZSDB-DSLXNQLJSA-N	439.915	1.651	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)c1c[nH]c2ncccc12	1787875800	UVHZKAUQMKXRPO-HJPIBITLSA-N	439.285	1.847	50	20	IDGD	
CC[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]2C1)N(CC)CC	1789921810	XPCJOPHHIRZOGP-QMHWVQJVSA-N	436.366	1.777	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(O)c(F)c3)[C@H]2C1	1790067998	YEFDBZVNABNNBK-SDPXSBNPSA-N	429.286	1.908	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCCn3ccnc3)C[C@@H]21	1791065390	WZTNYCIEUPHHJR-UGUYLWEFSA-N	427.343	1.426	50	20	IDGD	
Cc1nn(C)cc1C(=O)NC1(c2ccc(NC(=O)CCC(=O)NN(C)C)cc2)CCC1	1791600054	WRQRIYRFGQOJBC-UHFFFAOYSA-N	426.521	1.849	50	20	IDGD	
O=C(CCc1cnccn1)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21	1791660185	OYCPTZGPTDZFOM-BPUTZDHNSA-N	425.327	1.174	50	20	IDGD	
CC(C)(C)OC(=O)NCC1(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](O)CCl)C3)CC1	1792626900	JELUNGUUWQMZCS-LXTVHRRPSA-N	429.945	1.529	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(Br)cc1F)C2)[C@@H](O)CCl	1792975234	NLUUGKLUXDTZCE-OWLDWWDNSA-N	449.704	1.391	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CCN1C(=O)OC(C)(C)C	1793865615	AVSUZZHUZFEPTP-QRJUGERDSA-N	429.945	1.888	50	20	IDGD	
CCc1[nH]nc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CO[Si](C)(C)C)c1Cl	1797954782	JKAVHYWNLYYDTF-DRXBFXEBSA-N	428.993	1.680	50	20	IDGD	
C[C@H](NC(=O)c1ccccc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CO[Si](C)(C)C	1797958923	BIKREJGFNPAQOK-BOLBYERCSA-N	447.608	1.246	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H]1CCCCC1(F)F)C2	1798439691	XFYZPKBKSAZZQE-UMPJEAMMSA-N	435.475	1.762	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(C)(C)OC(=O)NC(C)C	1799128715	TZGJADOXDKBECI-FZKCQIBNSA-N	431.961	1.897	50	20	IDGD	
COCCCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN(C)NC(=O)NCc1ccccc1	1799865798	MWFCHECMTSLKIT-ACDBMABISA-N	445.564	1.397	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1coc([Si](C)(C)C)c1)C2	1800976709	DENXRVBBDDKOKD-IVSAIRAKSA-N	428.989	1.282	50	20	IDGD	
Cc1nn(C)c(C)c1CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@](C)(Cl)CCl)C2	1801380689	LDOMLORJUSADRP-CSHUHZATSA-N	431.364	1.405	50	20	IDGD	
CCOC(=O)C1(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C3)CC1	1801483767	LWSVBMIRNUFQLJ-BDHJUDLHSA-N	443.504	1.102	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(Cl)c3nncn3c1)C2	1802337141	HKHNOSMAHYRHKZ-QDMKHBRRSA-N	447.927	1.008	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@H]1CCN(C(=O)c2ncn(C)n2)[C@H]1c1cccnc1	1803008172	HJWXWEKRWKQDHC-YUELXQCFSA-N	435.326	1.561	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)Cc2cccnc2Cl)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803136391	PQSBSNXXEUJRRM-XYJFISCASA-N	437.327	1.978	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC2(CCCN(C(=O)C3(c4ccccc4)CC3)C2)CC1	1804896705	CPUIKKQLUZYBKQ-UHFFFAOYSA-N	446.356	1.943	50	20	IDGD	
O=C(CN1CCOCC1)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@H]1c1cccnc1	1806908439	HDQCCDGYAPKSBI-BHYGNILZSA-N	443.317	1.110	50	20	IDGD	
C#CCCCCC(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1807374142	IRPNOLNNYUYBNP-REWPJTCUSA-N	433.317	1.275	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)[C@H](C)CS(C)(=O)=O)[C@@H]1c1cccnc1	1808243365	DZRBMFCZHGHVJW-BSWAZPDLSA-N	429.970	1.786	50	20	IDGD	
CCOc1ccc(C(=O)N2CC[C@H](CNC(=O)[C@H](Cl)COC)[C@H]2c2cccnc2)nn1	1813033305	PYHCLGCMBRRQNT-GPMSIDNRSA-N	447.923	1.844	50	20	IDGD	
Cc1ccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)cn1	1816371432	SWPPWIZIDMHCBC-IBGZPJMESA-N	433.277	1.413	50	20	IDGD	
COc1nccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)[C@@H](O)CCl)[nH]n2)c1F	1817664104	GOFIGJCKZWQKSF-STQMWFEESA-N	425.848	1.858	50	20	IDGD	
CS(=O)(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](F)Br)n[nH]1	1820936524	BGZICBFMDKPWGU-ZWNOBZJWSA-N	439.307	1.527	50	20	IDGD	
Cc1cc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@H](O)CCl)CC3)nn1C(F)F	1821555544	QYCMSOQZWCKIPT-GZMMTYOYSA-N	433.868	1.869	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)COc2ccc(O)nn2)[nH]n1	1822376625	NROSBSBYIWBHFG-WCQYABFASA-N	438.872	1.230	50	20	IDGD	
O=C(N[C@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1)c1n[nH]cc1[N+](=O)[O-]	1823006489	BCOMJDMOPVWHLB-RRAGMBSWSA-N	447.246	1.691	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)Cn3nccn3)sc2C1	1823119398	JQQXECIMKYOJML-NXEZZACHSA-N	427.328	1.520	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)C13CC(C(=O)OC)(C1)C3)CC2	1826005052	ZHPCEJIBUFHWHM-IAPJOXICSA-N	441.937	1.652	50	20	IDGD	
Cc1cc(C(=O)N[C@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)ccc1O	1826088823	QDCUVZDSQNVVOL-AWEZNQCLSA-N	445.545	1.756	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCC([C@H]2CCCCN2C(=O)CS(C)(=O)=O)CC1	1826629317	VPALXLHVUYDIPQ-PBHICJAKSA-N	427.394	1.887	50	20	IDGD	
COCC1(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)CC1	1827056072	RQFWLAWKUJIXDI-FQEVSTJZSA-N	428.338	1.026	50	20	IDGD	
O=C([C@@H]1C[C@H]2CC[C@@H]1O2)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827060537	OSVXOBVSCDZRIP-CZYKHXBRSA-N	440.349	1.167	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ncc[nH]2)CC1	1827680732	GMLOUIPSXQPCSM-GTPWMTBTSA-N	439.520	1.777	50	20	IDGD	
Cc1cc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)CC2)c[nH]1	1828927017	XWOVMBDGDLYOFI-FQEVSTJZSA-N	438.532	1.869	50	20	IDGD	
O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(C3CC3)on1)CCO2	1830196064	ZHWKPJGLNUIEMN-GOSISDBHSA-N	442.310	1.407	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccn4ccnc34)C2)C1	1830362336	REQZPQULUUGKBH-NRFANRHFSA-N	434.924	1.669	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2n[nH]cc2[N+](=O)[O-])CC1	1831830980	KYMURTWCUIBKOV-KBPBESRZSA-N	427.889	1.805	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3cn[nH]c3)CCO2)C1	1832942172	IVEHGUMGCKJILT-MSOLQXFVSA-N	433.336	1.035	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3ccnc4ncccc34)CC2)CC1)[C@@H](O)CCl	1833312482	VVGBCALMWLOOGA-IBGZPJMESA-N	445.951	1.415	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)c3n[nH]cc3[N+](=O)[O-])CC2)CC1	1833533805	QSVWIXNOECVELK-OAHLLOKOSA-N	440.932	1.911	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)C[C@H]3CCCCO3)CC2)CC1	1833684121	PSFJPDXBGFBPHM-RTBURBONSA-N	429.989	1.771	50	20	IDGD	
Cn1cc(C(=O)NC2CCN(C3CCN(C(=O)CCBr)CC3)CC2)cn1	1834191302	LOHAASDQGCDCHG-UHFFFAOYSA-N	426.359	1.390	50	20	IDGD	
Cc1cccc(C(=O)N2CCOC[C@]3(CN(C(=O)CCBr)CCO3)C2)n1	1834819755	ZUKLCXNXWGCKOO-SFHVURJKSA-N	426.311	1.245	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)c1cnnc2ccccc12	1835321961	KGFOWGAONJZRNU-HXUWFJFHSA-N	445.951	1.415	50	20	IDGD	
CC(C)/C=C/C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1	1835737368	MFBKANDLMZSLDR-ONEGZZNKSA-N	442.564	1.083	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccccn3)CCO2)C1	1836190784	GVDQOMGPLWSYKI-VQIMIIECSA-N	440.338	1.254	50	20	IDGD	
CC(=O)O[C@@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1)C(C)C	1837213614	NBNYMUGGGJEIHJ-UZLBHIALSA-N	432.945	1.296	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](Cl)CC)CC2)CC1	1838383017	VOXTUTJLPMQRDJ-PBHICJAKSA-N	430.977	1.710	50	20	IDGD	
CCNC(=O)N[C@@H](C)C(=O)N1CCC(OC2CCN(C(=O)C(Cl)Cl)CC2)CC1	1838383597	LRJFHMWUFDOBCK-LBPRGKRZSA-N	437.368	1.496	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3c(C)nc4sccn34)C2)C1	1839146224	WUMZKROSVYGIPH-KUHUBIRLSA-N	440.953	1.792	50	20	IDGD	
O=C(CCc1ccccc1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839198214	XDLOPYOCMWXLIJ-IEBWSBKVSA-N	443.313	1.766	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3snnc3C)C2)C1	1839963990	BRXAVKVCXNMMBT-LRDDRELGSA-N	447.355	1.090	50	20	IDGD	
CCc1nc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](Br)CC)CCO3)co1	1839965624	FNQLEDMHWVVCAM-UGSOOPFHSA-N	444.326	1.481	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3ccsc3)C2)C1	1840032129	OFHYJSQCDLELQQ-KBXCAEBGSA-N	445.379	1.921	50	20	IDGD	
O=C1CCc2ccc(C(=O)N3CCOC[C@]4(C3)CN(C(=O)C(Cl)Cl)CCO4)cc21	1840190035	ZZUAUPRNMLUNCJ-FQEVSTJZSA-N	441.311	1.689	50	20	IDGD	
C[C@H](Cc1ccco1)C(=O)N1CCO[C@@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1	1840470962	IRWGCWCUJIPRCI-DYESRHJHSA-N	438.597	1.766	50	20	IDGD	
O=C(C1CC2(CCC2)C1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1840604394	DPBWIJINAVEIQY-KDOFPFPSSA-N	433.318	1.714	50	20	IDGD	
COc1cc(Cl)cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)c1	1840742454	UQJGTXROLRBKSD-QAPCUYQASA-N	435.279	1.953	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)C2CN(C(=O)c3ccccc3OC)C2)C1	1841249318	SASTUHZRYASAEN-KRWDZBQOSA-N	449.935	1.224	50	20	IDGD	
O=C(c1ccc2[nH]nc(Br)c2c1)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1	1841351682	XWOAOIXVOLEBMO-ZDUSSCGKSA-N	441.713	1.742	50	20	IDGD	
CCC(=O)N[C@@H](C)C(=O)N1CCCC12CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1841532288	OQUZHUAKVKWJQZ-KBPBESRZSA-N	444.960	1.237	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC2(CCCN2C(=O)c2nc3c(=O)[nH]c4ccccc4n3n2)C1	1843808578	OFNGJTNLJIRLBU-UHFFFAOYSA-N	442.907	1.653	50	20	IDGD	
O=C(C(Cl)Cl)N1CC2(CCCN2C(=O)c2nc3c(=O)[nH]c4ccccc4n3n2)C1	1843809627	DRLNQWAYLBBAKT-UHFFFAOYSA-N	435.271	1.192	50	20	IDGD	
C[C@@H]1CCC[C@@H]1C(=O)N1CCCC12CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2	1843967550	WIVCSWAVTKZPJD-QUCCMNQESA-N	441.576	1.972	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)Cc1ccc(F)cc1F)C2	1844265339	SFKBLMUKMHTWRO-UHFFFAOYSA-N	429.427	1.023	50	20	IDGD	
Cc1nnc(NNC(=O)c2ccc(Cl)c(S(=O)(=O)NCc3ccccc3)c2)[nH]c1=O	11335832	YCYOINKQAYXPGT-UHFFFAOYSA-N	448.892	1.362	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C1CCN(C(=O)/C=C/c2ccccc2)CC1	15795088	BIADLKCJPZZOLR-RQWLHQTBSA-N	435.480	1.926	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1	46728460	DVTHAOOMXLRIGM-UHFFFAOYSA-N	433.384	1.747	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)c2cc(S(=O)(=O)N3CCCC3)c(C)o2)cc1	107926763	BGCQQIKTHUAFLG-UHFFFAOYSA-N	436.490	1.254	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN(Cc2ccccc2)[C@H](C)CN2CCOCC2)n1	111054560	GTMMATNWDRLELS-GOSISDBHSA-N	445.589	1.364	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)CNS(=O)(=O)c1ccc(Cl)s1	725878889	ZUUVMDNSWBHYND-UHFFFAOYSA-N	431.923	1.469	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)c1cc(F)c(F)cc1[N+](=O)[O-]	727705343	NKNJZAXPRCBBIA-UHFFFAOYSA-N	433.415	1.846	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)N[C@H](CN1CCN(C)CC1)c1ccccc1	727945013	IGJHIEPFUGYFDE-LAUBAEHRSA-N	443.523	1.912	50	20	IDGD	
COCCn1nc(C(=O)NNc2ccc(S(=O)(=O)Nc3ccccc3)cc2)ccc1=O	728215449	LELPEJZYWYSCBJ-UHFFFAOYSA-N	443.485	1.447	50	20	IDGD	
CS(=O)(=O)N1CCC(C(=O)NNC(=O)c2ccc(Br)cc2Cl)CC1	728829464	ONJDUYTXJWRCAQ-UHFFFAOYSA-N	438.731	1.535	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)F)cc1)c1nc2ncc(Br)cn2n1	728972190	GEEICJXJIHWVHM-UHFFFAOYSA-N	447.221	1.640	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)CCNS(=O)(=O)c2ccccc2Cl)cn1	729693119	JVXXJSIKEBCJNE-UHFFFAOYSA-N	443.938	1.430	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=S)Nc2ccc(OC)nc2)n(C)c1	729693178	MRGUJXAOTLDLNH-UHFFFAOYSA-N	440.551	1.091	50	20	IDGD	
CCS(=O)(=O)CCOc1ccc(S(=O)(=O)NNC(=O)c2ccccc2OC)cc1	731493562	FUIYGHMORQJHFD-UHFFFAOYSA-N	442.515	1.132	50	20	IDGD	
CCOc1ccc(CN2C(=O)c3ccccc3C2=O)cc1C(=O)NNC(=O)c1c[nH]nc1C	731851628	IGFCRFMALZXQFJ-UHFFFAOYSA-N	447.451	1.988	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)Sc1nnc2n(CCCOC)c(=O)c3ccccc3n12	731904766	QKOZOBFTHKTDHY-LBPRGKRZSA-N	432.506	1.119	50	20	IDGD	
Cc1ccc(C(=O)NCCNC(=O)NNC(=O)COc2ccc(Br)cc2)cc1	732248977	MKKYGZAWJJBLPP-UHFFFAOYSA-N	449.305	1.897	50	20	IDGD	
CSCC[C@H](C(=O)NNc1ccccc1S(C)(=O)=O)N1C(=O)c2ccccc2C1=O	732303581	IQEZIGJCPMVXPO-MRXNPFEDSA-N	447.538	1.951	50	20	IDGD	
O=C(COC(=O)c1ccn(-c2ccccc2F)n1)NNC(=O)c1cccc([N+](=O)[O-])c1	732323733	CPKXUAQAUHFBLJ-UHFFFAOYSA-N	427.348	1.538	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)N[C@@H](Cc2ccccc2)CN2CCOCC2)cc1C	732476290	CVERONLPVNQFIG-NRFANRHFSA-N	440.544	1.956	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)N[C@@H](Cc2ccccc2)CN2CCOCC2)cc1	732476690	SEYQKACWTMGTJW-FQEVSTJZSA-N	426.517	1.648	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)C1	734174022	XNEOVQXVFDFXSC-CQSZACIVSA-N	440.522	1.434	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNS(=O)(=O)c2c[nH]c3ncccc23)CC1	734807428	PJCBZHFOIMPFSL-UHFFFAOYSA-N	438.510	1.455	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)N2CCC(C(=O)NNc3cc(C)nc(C)n3)CC2)cc1	736711641	CXHWMNHZPOYETF-UHFFFAOYSA-N	431.518	1.840	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)CCn2nnc3ccccc3c2=O)cc1C	736768641	LLYHJYNXRGSMRZ-UHFFFAOYSA-N	443.485	1.118	50	20	IDGD	
CC(C)CNC(=O)N1CCC[C@H](C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)C1	741283373	FYLKNKBPDKROCX-HNNXBMFYSA-N	428.493	1.417	50	20	IDGD	
CN(CCCC(=O)NNC(=O)c1cc2c(s1)CCC2)C1=NS(=O)(=O)c2ccccc21	742033469	AMBBQHUPIAEYDM-UHFFFAOYSA-N	446.554	1.859	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CN2CCN(Cc3cn4cc(Cl)ccc4n3)CC2)cc1	742598072	WHNHTRPNDPJXAQ-UHFFFAOYSA-N	440.935	1.875	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NCc2noc(-c3cccs3)n2)cc1	743568357	FYXRCFGPXMRNRM-UHFFFAOYSA-N	436.475	1.738	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)c1	744644115	KHTYFTVYKOSPAW-INIZCTEOSA-N	440.481	1.619	50	20	IDGD	
CC(C)c1nc(C#N)c(NNC(=O)c2cc(S(N)(=O)=O)ccc2Br)o1	746303416	UAIBIDWLLMPWDE-UHFFFAOYSA-N	428.268	1.836	50	20	IDGD	
O=C(CSCc1cscn1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	746765997	DETVCNUVTMVXAG-UHFFFAOYSA-N	440.572	1.622	50	20	IDGD	
CS(=O)(=O)Cc1nc2ccccc2n1CC(=O)NNC(=O)c1ccc(Cl)cc1F	747329432	KKUHVMBVQWVJMD-UHFFFAOYSA-N	438.868	1.835	50	20	IDGD	
CCn1c(=O)c(C(=O)/C(C#N)=C/c2ccc(C(=O)OC)o2)c(N)n(Cc2ccccc2)c1=O	749451480	HWPWVIHQHDXMGE-RVDMUPIBSA-N	448.435	1.830	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)NCc1ccccc1CN1CCC(O)CC1	749591362	PMXZSYWWHZGGSO-UHFFFAOYSA-N	437.500	1.424	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c(=O)oc2ccccc12	750015327	ONEHAASTPXSTJT-UHFFFAOYSA-N	429.454	1.427	50	20	IDGD	
C[C@H]1C[C@@H](NC(=O)NNC(=O)CNC(=O)c2cccs2)CCN1Cc1ccccc1	751098322	GADRMQZQCFUBCG-RDJZCZTQSA-N	429.546	1.861	50	20	IDGD	
COc1ccc(-c2nnc(S)n2CCC(=O)NNC(=O)COc2ccccc2F)cc1	751200610	QZJVDNCONFTJMR-UHFFFAOYSA-N	445.476	1.998	50	20	IDGD	
CC[C@@H](C)C(=O)N1Cc2ccccc2C[C@H]1C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	751295091	KRNNRBLAZPEKCA-QRWLVFNGSA-N	447.499	1.423	50	20	IDGD	
O=C(CC[C@H]1CCOC1)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	751297199	ISSFRUFKDOJGNB-KRWDZBQOSA-N	431.514	1.743	50	20	IDGD	
CCOC(=O)[C@H]1Cc2cc(S(=O)(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)ccc2O1	751538840	OZNVPPPRCZCKJD-MRXNPFEDSA-N	435.414	1.085	50	20	IDGD	
COCCCOc1cccc(CNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1	752168036	HJYJCWNUOFIDCP-UHFFFAOYSA-N	442.520	1.639	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCS(=O)(=O)[C@@H]2CCCC[C@H]21	753852004	SQHJAIWGZWCGNI-GDBMZVCRSA-N	429.926	1.151	50	20	IDGD	
CC(=O)Nc1ccc(C)c(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1	755905628	ZGDCCMVBAZXUEU-UHFFFAOYSA-N	433.490	1.670	50	20	IDGD	
COCCCOc1ccccc1NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1	756186874	LRMLUCQNRFWHCZ-UHFFFAOYSA-N	428.493	1.961	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)Nc2cnc(OC)c(C(N)=O)c2)c1	757693516	YYVOFBMCDVCUQF-UHFFFAOYSA-N	438.238	1.427	50	20	IDGD	
COc1ccc(-c2ccc(C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)c(F)c2)c(F)c1	758047340	MNBDWEFNQBLXSO-JTQLQIEISA-N	427.429	1.339	50	20	IDGD	
CCCCCn1nc(C(=O)NN=C2CCC3(CC2)NC(=O)NC3=O)c2ccccc2c1=O	758100642	UWALJLSIFZROFY-UHFFFAOYSA-N	438.488	1.825	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@H](NC(=O)NNC(=O)c2cc(Br)c[nH]2)[C@H](C#N)C1	758780259	ZSRCMAFUBXRAEL-BXKDBHETSA-N	441.286	1.480	50	20	IDGD	
O=C(NNC(=O)c1cccc(N2C(=O)c3ccccc3C2=O)c1)C(=O)Nc1ccccn1	758840654	LICLCYOQJATTGL-UHFFFAOYSA-N	429.392	1.282	50	20	IDGD	
CC(C)Oc1cc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)ccn1	759691590	XKTRQJPGOPNKOG-UHFFFAOYSA-N	432.502	1.728	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)c1ccc2c(c1)nc(O)n2CC(F)(F)F	760441605	AGAISAFQDLXRKC-UHFFFAOYSA-N	445.398	1.980	50	20	IDGD	
C[C@H](NC(=S)NNC(=O)CCNC(=O)[C@H]1CCCN1C(=O)OC(C)(C)C)C1CC1	760826778	XYISEFLZLPQDON-GXTWGEPZSA-N	427.571	1.186	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(Cl)c(C(=O)NC2CC2)c1	763470937	AWJNHBGFNQOSQR-UHFFFAOYSA-N	445.819	1.540	50	20	IDGD	
C[C@H]1CN(Cc2cccc(NC(=O)C(=O)NNC(=O)c3ccccc3F)c2)C[C@H](C)O1	763556137	KZIQVFVQDAQFHQ-GJZGRUSLSA-N	428.464	1.835	50	20	IDGD	
Cc1cccc(Cn2nccc2NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1	763571510	MZQALPQTUPGYOW-GOSISDBHSA-N	435.440	1.166	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2c(F)cccc2-n2cccn2)cc1C	763666190	CZUMLVIZQNAWPJ-UHFFFAOYSA-N	425.420	1.793	50	20	IDGD	
Cc1nc(Br)ccc1NC(=O)C(=O)NNC(=O)COc1ccccc1F	763679756	CKJXLUXHRLGOKF-UHFFFAOYSA-N	425.214	1.457	50	20	IDGD	
CO[C@@H](C)C(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)c1	763686790	UEGRIKYHMXGMGY-LBPRGKRZSA-N	448.863	1.478	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)cc1F	763746431	UWJUFMONIFXXMG-UHFFFAOYSA-N	444.463	1.390	50	20	IDGD	
Cc1ccc(F)cc1NC(=O)C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	763796375	AQONNOKFIQZMOE-UHFFFAOYSA-N	448.476	1.318	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)ccc1Br	763812093	CIDALOZCLXZJMP-UHFFFAOYSA-N	447.245	1.494	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)c(OC[C@@H]2CCCO2)c1	763838211	QGBBSJROTHANJA-KRWDZBQOSA-N	445.447	1.857	50	20	IDGD	
Cc1cc(C)n(-c2ccc(NC(=O)C(=O)NNC(=O)COc3ccc(F)cc3)cn2)n1	763840808	YBYLIVDUJZIMRP-UHFFFAOYSA-N	426.408	1.188	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)c(Br)n1	763843036	MLCIDJXAQNZZTN-UHFFFAOYSA-N	425.214	1.457	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)C(=O)Nc1ccc(C(N)=O)c(F)c1	763848995	GUBACVJIOQYRHP-GFCCVEGCSA-N	438.415	1.631	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccnn2-c2ccccc2)cc1	763862402	WWMHAPSTSVUZGP-HNNXBMFYSA-N	437.456	1.824	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccnn1Cc1ccccc1F	763865990	MVWCSJRLOBJPIU-ZDUSSCGKSA-N	443.410	1.763	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccn(-c3ccccc3)n2)cc1	763877149	HVUFAUPEXPDHGP-OAHLLOKOSA-N	435.440	1.628	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1	763879553	XYFDQHLMVIJJHU-CYBMUJFWSA-N	428.401	1.659	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(CC(=O)OC)c2)cc1OC	763902079	PSSMOHYNRAJXGJ-UHFFFAOYSA-N	429.429	1.209	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccc(-c2nnc3n2CCCC3)cc1	763918679	KEEBZRXEGNOORV-UHFFFAOYSA-N	436.447	1.749	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1OCC	764006586	QSPHVSJFAXAUCG-UHFFFAOYSA-N	429.429	1.655	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2OC)c(OC(F)F)c1	764041685	ZWMGUJKNHONVHQ-UHFFFAOYSA-N	437.355	1.483	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)CCCN3C(C)=O)c1O	764131206	HQBUMTPAIJQXMQ-UHFFFAOYSA-N	426.429	1.100	50	20	IDGD	
O=C(CC1CCCC1)NNC(=O)C(=O)Nc1ncn(Cc2cccc(Br)c2)n1	764184017	LOLNEULWWLZDMZ-UHFFFAOYSA-N	449.309	1.755	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2O)ccc1C(=O)NC(C)C	764276913	FCDSONPHWCZXCB-UHFFFAOYSA-N	428.445	1.004	50	20	IDGD	
CCc1noc(-c2ccc(C)c(NC(=O)C(=O)NNC(=O)COc3ccccc3O)c2)n1	764278640	SRNYIYYEJILGBV-UHFFFAOYSA-N	439.428	1.478	50	20	IDGD	
Cc1ccc2c(c1)[C@@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N3CCCC3)c1)CO2	764373958	HXOSOQBIKSMXSJ-SFHVURJKSA-N	444.513	1.857	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COCCO1)C(=O)Nc1ccc(Cc2nc3ccccc3s2)cc1	764433779	NTOCUFXWSVJXKX-INIZCTEOSA-N	440.481	1.388	50	20	IDGD	
CON(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)c1	765570051	QJAKUSXKOVRQES-UHFFFAOYSA-N	435.487	1.395	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)CN2C(=O)c3ccc(C)cc3C2=O)n[nH]1	765599437	GDHIOARQTSTGRI-UHFFFAOYSA-N	433.424	1.451	50	20	IDGD	
C/C=C(/C=C/C(=O)NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1)CC	766635732	DWVMKZYLJAKYJI-AENXRKRXSA-N	434.562	1.361	50	20	IDGD	
O=C(COc1ccc(OCc2ccccc2)cc1)NNC(=O)NC[C@H]1CCCS1(=O)=O	767172720	AECRQYWHESTDNB-LJQANCHMSA-N	447.513	1.552	50	20	IDGD	
Cn1c(=O)c2c(ncn2CCC(=O)NNc2c(Cl)cc(F)cc2Cl)n(C)c1=O	767401839	IPALGGKEGQGQQZ-UHFFFAOYSA-N	429.239	1.413	50	20	IDGD	
C[C@H](NS(=O)(=O)c1ccc(C#N)cc1)C(=O)NNC(=O)c1cc(-c2ccccc2)[nH]n1	767823199	HMCRWDAQRSVFJX-ZDUSSCGKSA-N	438.469	1.076	50	20	IDGD	
O=S(=O)(CBr)N1CCN(S(=O)(=O)c2cccc3cnccc23)CC1	767848541	BEVKYZILEKKALL-UHFFFAOYSA-N	434.337	1.223	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3cnc4ccc(C)cn4c3=O)n[nH]2)cc1OC	768275744	FGSYRHNYXFDOIP-UHFFFAOYSA-N	448.439	1.485	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)CSc1nnnn1-c1ccc2c(c1)OCCO2	768398295	SGKRQGKNFIJKNV-UHFFFAOYSA-N	440.485	1.224	50	20	IDGD	
CCN1CCN(C[C@@H](C)CNC(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)CC1	770531826	BCOVRAXJSHGDFX-JKSUJKDBSA-N	425.961	1.711	50	20	IDGD	
O=C(NNC(=O)c1ccc2nc[nH]c2n1)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	770549526	ONEWQNAWRULTQB-UHFFFAOYSA-N	439.439	1.735	50	20	IDGD	
CCNS(=O)(=O)[C@@H]1CCN(C(=O)NNC(=O)c2ccc(COc3ccccc3)o2)C1	770753127	CWPGSGULJBDZQY-MRXNPFEDSA-N	436.490	1.227	50	20	IDGD	
C[C@@H]1CN(C(=O)NNC(=O)Cn2ccc3ccccc32)CCN1c1nccn2cnnc12	771217171	XVXUSKIPACRDKF-OAHLLOKOSA-N	433.476	1.031	50	20	IDGD	
Cc1cc([N+](=O)[O-])cc(S(=O)(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)c1F	771609218	WWJIUNDHNDLONX-UHFFFAOYSA-N	444.828	1.322	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1ncccc1OCc1cccc(Cl)c1	771822139	PRGWBWWWNHDLNH-NSHDSACASA-N	441.897	1.404	50	20	IDGD	
CC[C@@H](C)C(=O)N1CSC[C@@H]1C(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772898553	SACHQJKNRNDDBJ-BXUZGUMPSA-N	426.926	1.051	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)CSc1nnnn1CC(F)(F)F	772990611	ORBWNKLMPTXBGZ-MRVPVSSYSA-N	438.819	1.596	50	20	IDGD	
O=C(COC(=O)c1ccnc(O)c1Br)NNC(=O)c1cccc([N+](=O)[O-])c1	773655746	RBLJDCSTVUHNQW-UHFFFAOYSA-N	439.178	1.076	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)N[C@H](c1ccccc1OC(F)F)C(F)(F)F	776003037	WIKKAEKYVIZIPJ-GMSGAONNSA-N	448.370	1.160	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)N[C@H](c1ccc(OC(F)F)cc1)C(F)(F)F	776011786	BHDSZKPIVPWHGN-GMSGAONNSA-N	448.370	1.160	50	20	IDGD	
CC[C@@H](C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1)c1ccc(OC)cc1	776232679	URYNHVSGBFIABY-GOSISDBHSA-N	447.561	1.663	50	20	IDGD	
CC(C)(C)OC(=O)NCC(F)(F)CNC(=O)NNC(=O)CSc1ccccc1O	777677620	FRWLGFCYTKTJRH-UHFFFAOYSA-N	434.465	1.975	50	20	IDGD	
O=C(COc1cc(C(F)(F)F)cc(C(F)(F)F)c1)NNC(=O)C(=O)N1CCCC1	778252122	OOUDJXIGONGUMR-UHFFFAOYSA-N	427.301	1.873	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(C(F)(F)F)cc1F)c1ccc(-n2cnnn2)cc1	780366387	KRAGEZRUZTVBTE-UHFFFAOYSA-N	430.343	1.444	50	20	IDGD	
COc1cccc(NNC(=O)[C@H](CCSC)NS(=O)(=O)c2ccccc2F)n1	780771874	GMRQDQVPNKRGMX-ZDUSSCGKSA-N	428.511	1.773	50	20	IDGD	
N#Cc1ccc(N2CCC[C@@H](NC(=O)NNC(=O)CSc3ccccc3O)C2=O)cc1	780896202	LIBAQHXXBZMCMJ-MRXNPFEDSA-N	439.497	1.882	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)c1cccc(I)c1	780971259	MLLINBSTKSMWMW-UHFFFAOYSA-N	433.246	1.967	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)CNC(=O)c1ccc(Br)s1	780973574	CFIBTAIAFOCSCS-UHFFFAOYSA-N	449.327	1.303	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)c1cc2nn[nH]c2cc1F	781953567	AGSAEPCOUVUAHZ-UHFFFAOYSA-N	445.886	1.329	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNS(=O)(=O)c2cc(F)cc(C(=O)OC)c2)cc1	782250526	YEDALBHXTWQICN-GFCCVEGCSA-N	440.449	1.788	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)OCc2nnc(C)o2)cc1	782536262	SLKMJAVDYSEJCT-OQLLNIDSSA-N	436.428	1.776	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)cc1)C(=O)Nc1ccc(S(=O)(=O)C2CCCC2)cc1	782830288	GTDJROFRKACWNR-UHFFFAOYSA-N	431.470	1.508	50	20	IDGD	
COc1ccc(OC(C)C)c(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)c1	782894583	PSOFAGBDIJVSJR-UHFFFAOYSA-N	439.472	1.698	50	20	IDGD	
C=CCS(=O)(=O)CCNC(=O)NNC(=O)[C@H](C)Oc1cccc(Br)c1	782997957	SKAGZTAHVPTECT-NSHDSACASA-N	434.312	1.148	50	20	IDGD	
Cc1ccc(C)c(NNC(=O)C(=O)Nc2cccc(S(=O)(=O)N3CCN(C)CC3)c2)c1	783362171	MUPNYJQMWWSUES-UHFFFAOYSA-N	445.545	1.321	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)CCS(=O)(=O)C1	783428661	YAKHNLOIEWIBKY-RXVVDRJESA-N	426.498	1.479	50	20	IDGD	
CC1(C)CN(C(=O)C(=O)NNC(=O)CNC(=O)c2cccs2)c2cccc(Cl)c21	784004620	HXVBKXUZTWCXBN-UHFFFAOYSA-N	434.905	1.603	50	20	IDGD	
CCNC(=O)COc1ccc(NC(=O)C(=O)NNc2ccc(Br)nc2)cc1	784811114	IFJGSSNLBBEPJU-UHFFFAOYSA-N	436.266	1.441	50	20	IDGD	
CC(C)(C)Oc1cc(F)ccc1NC(=O)C(=O)NNC(=O)Cc1cn2ccccc2n1	785059808	BEFGOEXYISRFQZ-UHFFFAOYSA-N	427.436	1.979	50	20	IDGD	
O=C(c1nn(-c2cccc(F)c2)cc1O)N1CCN(S(=O)(=O)CBr)CC1	786525393	HTMOHRUQHPMGOG-UHFFFAOYSA-N	447.286	1.157	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)[C@@H]2CN(C)C(=O)c3ccccc32)c2ccccc2c1=O	786654864	SKKFJXOLPJGAIH-GOSISDBHSA-N	433.468	1.608	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)NNC(=O)c1ccc2c(c1)S(=O)(=O)N(C1CC1)C2=O	787436361	YEZNBZBMNMYPOF-UHFFFAOYSA-N	448.888	1.791	50	20	IDGD	
Cc1cccnc1C(F)(F)C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	787459830	CVVRAYPPEUNJNJ-UHFFFAOYSA-N	439.488	1.561	50	20	IDGD	
Cc1nc(Cn2nnc(C(=O)NNc3ccc(S(=O)(=O)C(F)(F)F)cc3)c2C)no1	787460175	GWOQXOUAPHHDIR-UHFFFAOYSA-N	445.383	1.377	50	20	IDGD	
COCCNS(=O)(=O)c1cccc(C(=O)Nc2cccc(NC(=O)NN(C)C)c2)c1	788262157	JHXFLRSRQQPVRV-UHFFFAOYSA-N	435.506	1.462	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)c2cnnn2-c2cccc(F)c2)cc1C	789107289	YRYVITZUNJTFQQ-UHFFFAOYSA-N	431.449	1.957	50	20	IDGD	
COc1c(C)cnc(Cn2cnc(NC(=O)C(=O)NNc3c(C)cccc3F)n2)c1C	789745177	GBYPKRQODIOEHX-UHFFFAOYSA-N	427.440	1.876	50	20	IDGD	
Cc1ccn(C[C@@](C)(O)C(=O)NNC(=O)COc2ccccc2-c2ccccc2)c(=O)c1	790462260	LMKSYCIIPJFHED-XMMPIXPASA-N	435.480	1.801	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2cc([C@@H]3CCCOC3)nn2C)c1	790952872	WYBGCYWTZRVSRK-OAHLLOKOSA-N	429.477	1.096	50	20	IDGD	
COc1ccc(NNC(=O)[C@H]2[C@@H](C)CC(=O)C[C@H]2C(=O)NNc2ccc(OC)cn2)nc1	791147440	ZMPUCJFHPNXZMW-MOFZMDFASA-N	442.476	1.312	50	20	IDGD	
CC(C)(C)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)cc1[N+](=O)[O-]	793021617	GZCFBLWOADSHJK-UHFFFAOYSA-N	439.428	1.929	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)Cc3ccc(S(=O)(=O)N(C)C)cc3)n[nH]2)cc1	793076840	VCGINUXNXPFGAG-UHFFFAOYSA-N	441.513	1.639	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNS(=O)(=O)c2ccc(C#N)c(F)c2)cc1	793351351	WMXBEAIIRPISMZ-UHFFFAOYSA-N	446.489	1.741	50	20	IDGD	
Cc1ccc2c(c1)C(=O)N([C@H](C)C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1)C2=O	794711625	OQHBZSGKZQRWGQ-CYBMUJFWSA-N	430.486	1.373	50	20	IDGD	
O=C(CNC(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1)NCC(F)F	796535628	LICCOHJOXGUDML-GOSISDBHSA-N	445.470	1.325	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)c2ccc(Cl)c(S(=O)(=O)N3CCOCC3)c2)n1	797245708	NLWXKEVMBPIVQO-UHFFFAOYSA-N	438.893	1.139	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)CNC(=O)OCc2ccccc2)cc1NS(C)(=O)=O	797625726	CECZNTKQGSMNNB-UHFFFAOYSA-N	449.489	1.446	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)NCCN(C)S(=O)(=O)c1ccc(F)cc1)c1ccccc1	798098116	OMEPJOUXAZVWMB-SFHVURJKSA-N	436.509	1.970	50	20	IDGD	
CC(=O)N1CCCc2cc(S(=O)(=O)NNC(=O)c3ccc4c(c3)OCCO4)ccc21	798158864	CLXHPRILLVHMRB-UHFFFAOYSA-N	431.470	1.380	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](CC(F)F)NC(=O)OC(C)(C)C)cc1C	798309512	GYQRSWYBHBMCJX-CYBMUJFWSA-N	428.436	1.938	50	20	IDGD	
CCN1CCC[C@H]1CN1C[C@H](C(=O)NNC(=O)Nc2cc(OC)ccc2Cl)CC1=O	802107987	FFACXBXYWWLDPL-KGLIPLIRSA-N	437.928	1.834	50	20	IDGD	
CCCNS(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)CCCc2ccccc2)cc1	808088815	CJSVWIBPQLKZDK-UHFFFAOYSA-N	439.559	1.707	50	20	IDGD	
CCOC(=O)c1ccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc1	809983708	QNOMWBSHXLQPEK-UHFFFAOYSA-N	445.497	1.723	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)nn1C1CCCCC1	810385596	VZUBJZDUTCVWJX-QGZVFWFLSA-N	427.461	1.623	50	20	IDGD	
CCOc1ccc(NC(=S)NNC(=O)C(=O)N2CCN(c3ccccc3)CC2)cc1	812456987	AGHQXLNKQGFPDR-UHFFFAOYSA-N	427.530	1.752	50	20	IDGD	
Cc1ccc(NC(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)cc1NS(C)(=O)=O	812935356	AQWDNBMVSDFUEP-UHFFFAOYSA-N	441.535	1.765	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2csc(-c3ccccn3)n2)cc1	813033819	NAHLLUINHSLOIR-UHFFFAOYSA-N	446.514	1.537	50	20	IDGD	
COc1ccc(Cl)c(NC(=O)C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)c1	813034026	VSJPFXDAYWPVNP-UHFFFAOYSA-N	426.882	1.681	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)c1ccc(C(=O)NNC(=O)c2ccccc2C)nc1	813369247	XXHFLLOSVZDQEQ-UHFFFAOYSA-N	431.452	1.848	50	20	IDGD	
CC(=NNC(=O)Cc1csc(N2CCOCC2)n1)c1ccc(N2C(=O)CCC2=O)cc1	814216477	NRQDLDLWRWNGAZ-UHFFFAOYSA-N	441.513	1.716	50	20	IDGD	
CCOC(=O)c1ccc(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)nc1	814708027	CEZPFPVXKDOKNY-UHFFFAOYSA-N	425.489	1.232	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NN=C(C)c1ccc(S(=O)(=O)CC(N)=O)cc1	814744728	QTFIMNVLLASEFS-UHFFFAOYSA-N	441.513	1.398	50	20	IDGD	
Cc1cccc(Oc2ccc(NC(=O)C(=O)NNC(=O)[C@H]3CCc4nncn4C3)cc2)c1	815691557	UAUWVXXRPKZOPT-HNNXBMFYSA-N	434.456	1.727	50	20	IDGD	
CCCCOc1ccc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)N(C)C)cn1	815750383	ACJIJEWNFJJDPU-UHFFFAOYSA-N	435.506	1.593	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCO1)C(=O)Nc1ccc(NC(=O)C2CC2)cc1C(F)(F)F	815778331	MPQOGYBCBUNCBA-CYBMUJFWSA-N	428.367	1.319	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@](C)(O)c3ccc(Cl)cc3)CC2)cc1	815827017	JDAKRUQTCGNWAQ-HSZRJFAPSA-N	444.963	1.821	50	20	IDGD	
NC(=O)c1ccc(SCC(=O)NNC(=O)c2ccc3ccccc3n2)c([N+](=O)[O-])c1	912766642	CTCJQZGARMVRJN-UHFFFAOYSA-N	425.426	1.795	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2cc3c(s2)CC[C@H](C)C3)cc1	913162548	YKRFKDRKTPORRA-LBPRGKRZSA-N	449.554	1.815	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1ccc(Cl)c(I)c1	915279576	OHTUJGFNPBIJTA-MRVPVSSYSA-N	442.662	1.140	50	20	IDGD	
CC(=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O)c1ccc(OC(F)(F)F)cc1	915957734	SJNOFXXSMOJNQG-UHFFFAOYSA-N	431.396	1.010	50	20	IDGD	
O=C(Cc1nc2ncccn2n1)NNC(=O)c1cn(-c2ccccc2)nc1-c1ccccc1	917954782	XOYZTTQYENVGQW-UHFFFAOYSA-N	438.451	1.981	50	20	IDGD	
O=C(CC(F)(F)F)NNC(=O)C1CCN(S(=O)(=O)c2ccc(F)c(Cl)c2)CC1	918704164	UZSMHFOTYWYVCO-UHFFFAOYSA-N	445.822	1.980	50	20	IDGD	
C[C@H]1CN(Cc2cccc(CNC(=O)NNC(=O)COc3ccccc3C#N)c2)CCO1	920236984	GNTAAGUCPFPGHD-KRWDZBQOSA-N	437.500	1.688	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)CN2C(=O)N[C@@]3(CCCC[C@H]3C)C2=O)o1	920272335	MYXANJUHPCMQTH-SPLOXXLWSA-N	433.509	1.383	50	20	IDGD	
C[C@@H]1CC(C)(C)C[C@]2(C1)NC(=O)N(CC(=O)NNC(=O)NCCc1cccs1)C2=O	920861366	YALSHDTULJZSQN-XCLFUZPHSA-N	435.550	1.758	50	20	IDGD	
Cc1nn([C@H]2CCS(=O)(=O)C2)c(Cl)c1C=NNC(=O)CNC(=O)OC(C)(C)C	1116499263	BNGMJPPVOSKCFU-NSHDSACASA-N	433.918	1.179	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)c1cc(Br)c(C=O)n1C	1319222027	KQTCSCJVHVACPS-UHFFFAOYSA-N	436.262	1.455	50	20	IDGD	
CCOC(=O)N1CCC[C@@H](C(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)C1	1322957871	PKFPBJPFPJGZOK-OAHLLOKOSA-N	426.514	1.649	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4c(c3)n(C)c(=O)n4C)C2)C1	1777864948	QXMKJRIFTUQTBR-KSFYIVLOSA-N	448.951	1.728	50	20	IDGD	
CC[S@](=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@](C)(Cl)CCl)C1	1780711798	DEERLKTWTWEOFU-PENXLVGXSA-N	441.421	1.895	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)Cc3ccc(C(=O)OC)s3)C2)C1	1780899272	UZEPIIXVQKEBSF-AUUYWEPGSA-N	444.937	1.161	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)o1	1781229539	FTNWRBSEGBRVRQ-ZWKOTPCHSA-N	432.304	1.918	50	20	IDGD	
Cc1ccccc1NCC(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781331270	NJYHVXPBBOPNDG-SJLPKXTDSA-N	428.302	1.927	50	20	IDGD	
CN(C)CC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C(C#N)=C/c2ccc(F)cc2F)C1	1781597079	NRNCHENOXKJZOI-NADQMYELSA-N	446.498	1.947	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCC(=O)NN(C)C)C1	1782208959	DDWBCEDVQJMWDZ-RZQQEMMASA-N	430.977	1.281	50	20	IDGD	
C[C@H](CC(N)=O)C(=O)N1CCO[C@@]2(CCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1	1782860864	DSATXIAKHBNHGW-PSVNBWQCSA-N	446.454	1.213	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1Cc3ccccc3CN1)CCO2	1783534004	CPZPZSOZVLSWHJ-VHFSOBRXSA-N	436.350	1.314	50	20	IDGD	
Cc1nn(C)c(C)c1CC(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](C)Br)C2)C1	1783538405	CIMLJPKFNNKAQA-XIKOKIGWSA-N	427.343	1.193	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](C)Br)C2)C1	1783539713	MWIUEFKPAWSFGI-GJRWTSMGSA-N	443.338	1.355	50	20	IDGD	
O=C(CCc1c[nH]c2ccc(F)cc12)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1783671670	IFENAUYXNRPZLS-WIYYLYMNSA-N	437.899	1.669	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc4cc(O)ccc4n3)CCO2)C1	1783874280	FXUWOMPJIJYOPO-KKSFZXQISA-N	433.892	1.638	50	20	IDGD	
COc1c(C)cc(C(=O)N2CCO[C@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc1C	1783934414	GEXBYGFJZMIEBI-QHCPKHFHSA-N	446.548	1.129	50	20	IDGD	
C[C@@H]1[C@H](C(=O)N2CC[C@]3(CN(C(=O)[C@H](F)Cl)CCO3)C2)CCN1C(=O)OC(C)(C)C	1785745279	WOLIQFUCQKOMKV-GXNBUGAJSA-N	447.935	1.996	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3CCC[C@H]3C)[C@H]2C1	1788235090	CTDYKDXVBWULSN-MKZDJKJRSA-N	443.548	1.536	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4nncn4c3)[C@H]2C1	1788374467	BYILACYGSHPKIS-ULQDDVLXSA-N	431.569	1.174	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4c(c3)CNC4=O)[C@H]2C1	1788444011	XHXHHNUAECXFNO-SNRMKQJTSA-N	445.592	1.375	50	20	IDGD	
Cc1ccc(=O)n(C(C)(C)C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)C(Cl)Cl)C[C@@H]32)n1	1788733482	UNNHWWKJUFVBGX-IHRRRGAJSA-N	445.347	1.070	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccn4ccnc4c3)C[C@@H]21)[C@H](F)Br	1789925684	HHZZKFIIPWTCQF-YXWQFLTLSA-N	439.285	1.618	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(OC)ccn3)C[C@@H]21	1790960471	JZXUOOWGSFRYKM-QEWYBTABSA-N	440.338	1.857	50	20	IDGD	
C/C(=C\c1cccs1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2C1	1791287226	VJEGFYFTARIISZ-MXQYBANVSA-N	448.589	1.504	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nc4ccc(F)cn4n3)C[C@@H]21)C(Cl)Cl	1791296311	QKPVOXXUFDCCKW-DLOVCJGASA-N	430.267	1.265	50	20	IDGD	
CCS(=O)(=O)N[C@H](C)C(=O)NC1(c2ccc(NC(=O)[C@@H](Cl)COC)cc2)CCC1	1791565619	SMQBHBLQNSDRCN-CJNGLKHVSA-N	445.969	1.702	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Cc1ccccn1)C2	1792872147	NVTDLUGVROQCSB-WXQHOCMDSA-N	438.366	1.881	50	20	IDGD	
COc1cccc(-c2cc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@H](O)CCl)c[nH]2)c1	1792975668	UIGLBVLWLBJBFA-WOUAJJJCSA-N	447.919	1.493	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(C)(C)CCl)C2	1793630706	QOFJAJMCBVTBKU-QKPAOTATSA-N	443.972	1.850	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cccc(C(F)(F)F)n1	1794069931	FVAPDKHUYJXZAR-IFOZYUSPSA-N	449.857	1.486	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CNC(=O)c1cccs1	1794394693	GCLOHLXFGKSBEZ-RVMXOQNASA-N	428.352	1.900	50	20	IDGD	
Cn1c(=O)n(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CO[Si](C)(C)C)c2ccccc21	1798626275	VAQMOEPVOGBMFL-BJWYYQGGSA-N	444.608	1.830	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)[C@@H]1CCCCN1Cc1ccccc1	1799035617	IKQWNPGTUSEZHV-SSTJLMRISA-N	449.979	1.230	50	20	IDGD	
C[C@@H](Nc1nccs1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@](C)(Cl)CCl	1799275364	QKRYYPUPUCTRIV-KCRLFOLJSA-N	435.377	1.769	50	20	IDGD	
COc1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)c(F)c1	1800384676	VURILEALJOPLEI-BJWYYQGGSA-N	426.253	1.080	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnn(C)c1Cl)C2	1800641897	MCRHHLFLTHDLIO-LYIQGSDWSA-N	433.734	1.450	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)CBr)C2	1800754947	YYWFQKUINPKTHU-CSYMLDBXSA-N	426.149	1.390	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1n[nH]c3c1CCCC3)C2	1800758333	WVRHREVQUHEJRT-OHTBPHCPSA-N	425.327	1.275	50	20	IDGD	
O=C(C(O)O)N1CCCC2(CCN(C(=O)[C@H](Br)Cc3ccccc3)CC2)C1	1805284057	ZZXXATXMKYRBSL-MRXNPFEDSA-N	439.350	1.535	50	20	IDGD	
O=C(c1cc(O)cc([N+](=O)[O-])c1)N1CCC2(CCCN(C(=O)[C@@H](O)CCl)C2)CC1	1805527210	VCDIOGYKTDHKOK-INIZCTEOSA-N	425.869	1.745	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)c2cocn2)[C@H]1c1cccnc1	1806019375	XZBLNCQURKXGAN-CPJWQURSSA-N	449.471	1.523	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H](CNC(=O)CS(C)(=O)=O)[C@H]1c1cccnc1	1806763386	DAUQSMBHWDUVSY-XNRPHZJLSA-N	446.367	1.163	50	20	IDGD	
Cc1cc[nH]c1C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1807369618	QKIJATXQPKUGFE-GHTZIAJQSA-N	432.289	1.031	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cccs2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1	1807369770	UTJKNHAOUDWYMJ-FXAWDEMLSA-N	435.314	1.456	50	20	IDGD	
Cc1ccccc1C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1807376511	VZDHWJLZKAZZEQ-REWPJTCUSA-N	443.312	1.703	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)c1cc(C(F)F)no1	1807721219	YVKRSJSPLRJFRA-CORIIIEPSA-N	428.823	1.927	50	20	IDGD	
COCCn1nccc1C(=O)NC[C@@H]1CCN(C(=O)[C@H](Cl)COC)[C@H]1c1cccnc1	1808638881	FTJYLIDNNMLMAK-SCTDSRPQSA-N	449.939	1.498	50	20	IDGD	
CN1C(=O)CC[C@H]1C(=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@H]1c1cccnc1	1808774548	SCYHHZFNPNSGFN-DARAHFNDSA-N	441.301	1.399	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2cn3ncccc3n2)[C@@H]1c1cccnc1	1809358298	SSVSCZVVMKPMJN-BXWFABGCSA-N	442.907	1.698	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2nn(C)c3c2CCC3)[C@H]1c1cccnc1	1809367698	UOKHTIMWDBBGQW-OXFYSEKESA-N	445.951	1.877	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2cn3cccnc3n2)[C@@H]1c1cccnc1	1809778819	BVEZRYBQZVUAJR-BQFCYCMXSA-N	442.907	1.698	50	20	IDGD	
NC(=O)c1nccnc1C(=O)NC[C@@H]1CCN(C(=O)C(Cl)Cl)[C@@H]1c1cccnc1	1811188828	MWUGCQAXYRBLFM-SMDDNHRTSA-N	437.287	1.094	50	20	IDGD	
Cc1cc[nH]c1C(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1813069738	BBCCTQUFUFLTPQ-UWJYYQICSA-N	426.521	1.411	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1)n1cccc1	1813074989	WPVAPTPXCOFOHY-JUXOCIIHSA-N	440.548	1.523	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)Cn2nnc3ccccc32)[nH]n1)[C@@H](O)CCl	1814867954	SJOQCBOGOBKCCX-HOCLYGCPSA-N	431.884	1.446	50	20	IDGD	
O=C(/C=C/c1ccoc1)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1	1815350193	JOECXCYPQFLRAZ-IEXSPKMKSA-N	437.286	1.355	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@H]1CCc2nc(NC(=O)Cn3ccccc3=O)sc2C1	1815448127	QJGXWTFZZSCFLY-ZDUSSCGKSA-N	434.594	1.769	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](F)Br)[nH]n1	1817994530	VWBZXLJWEDTVLV-MKPLZMMCSA-N	433.282	1.539	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)C2(C)COC2)[nH]n1	1818110573	KHVMQKRHTJONDZ-ANDSAHIGSA-N	441.492	1.572	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(O)nn2)[nH]n1)[C@H](F)Br	1820930826	DKCIYDKGYCUXON-GWCFXTLKSA-N	427.234	1.902	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1)c1cc(O)cc([N+](=O)[O-])c1	1821263016	ZBUWAIIPAJPSRF-CABCVRRESA-N	437.840	1.929	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCN2CCOC2=O)[nH]n1	1822370320	MLARHOSKDBYPCR-OCCSQVGLSA-N	427.889	1.498	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)C(C)(C)CNC(C)=O)[nH]n1	1822372138	ZJZJJVIDVIXILP-HIFRSBDPSA-N	427.933	1.818	50	20	IDGD	
Cc1ncc(CC(=O)N2CCCC[C@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)s1	1822416719	LWLFWUMWLVLTCN-INIZCTEOSA-N	447.565	1.782	50	20	IDGD	
Cc1ccc(CC(=O)N2CCCC[C@@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)o1	1822417075	XRIDNGOKAKRMOK-QGZVFWFLSA-N	430.509	1.919	50	20	IDGD	
O=C(Cc1cccs1)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827055182	UOUCFVXJNQTOMZ-OAQYLSRUSA-N	440.374	1.904	50	20	IDGD	
CC(=O)C[C@H](C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827060528	NGCYKASSSWUJAY-KKSFZXQISA-N	428.338	1.215	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@H](O)N2CCOCC2)CC1	1828974382	RUMRQXXUPHBRTA-LESCRADOSA-N	446.386	1.040	50	20	IDGD	
CC[C@H](C)CC(=O)N1CCO[C@]2(COCCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)C1	1831050758	CCJFJSWPHGLKON-KXMYUJBBSA-N	447.536	1.013	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4ncccn4n3)C2)C1	1831651620	RZJXTJDGJCNUKQ-FOIQADDNSA-N	435.912	1.207	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc4nccn34)C2)C1	1831654073	PYKPEEHDLZSFPA-HRAATJIYSA-N	434.924	1.812	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccnc(F)c2)CC1	1831871326	RTZZCNQCAQAEGA-GOSISDBHSA-N	433.528	1.827	50	20	IDGD	
O=C(c1sccc1F)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1831919369	LWHXQHVTNXFXPQ-DOMZBBRYSA-N	439.278	1.648	50	20	IDGD	
CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H](F)Cl)CC1	1832139349	WLSBMIRXCBFIKT-KURKYZTESA-N	441.935	1.611	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cccnc3S)CC2)CC1	1833081687	UYQUWXWLFUATAN-QGZVFWFLSA-N	440.997	1.809	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)[C@@H]1CCc2ccoc2C1	1833362378	MVRCTZYMNQWUQP-APWZRJJASA-N	437.968	1.556	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ncc(Cl)cn3)CCO2)C1	1833781459	GCYXWGNAIFJYOR-KBXCAEBGSA-N	431.320	1.608	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3conc3C)CCO2)C1	1834340171	JJMNEADSEVDZOL-YOEHRIQHSA-N	430.299	1.227	50	20	IDGD	
COc1cccc(CC(=O)NC2CCN(C3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)c1	1834497787	DSYFDISUYGUPQL-FQEVSTJZSA-N	437.968	1.409	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)Cc3nnc(C)o3)CC2)CC1	1834831907	RTCVYBZTRXPPDW-KRWDZBQOSA-N	425.961	1.900	50	20	IDGD	
O=C(Cc1ccc2ccccc2c1)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1	1834891261	XGLQABNVKSPHQR-NZQKXSOJSA-N	446.931	1.438	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)COCc3ccccc3)CCO2)C1	1835365469	VKXFYPPBNNLYJS-JOCHJYFZSA-N	438.952	1.925	50	20	IDGD	
CCCC(=O)N[C@@H](C)C(=O)NC1CCN(C2CCN(C(=O)[C@H](Cl)CC)CC2)CC1	1835820786	QEJCOEWCOWIJOV-MAUKXSAKSA-N	429.005	1.880	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3cccs3)CCO2)C1	1836092059	OJRXUHAYBRTHIG-YJBOKZPZSA-N	445.379	1.921	50	20	IDGD	
O=C(CC12CCCN1CCC2)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836718085	PPMBXEFWAJFFQP-LJQANCHMSA-N	442.000	1.603	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(C=O)s3)C2)C1	1837711336	DVTNPACMSNBLGS-LJQANCHMSA-N	440.594	1.482	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)Cc3cscn3)CC2)CC1	1837945974	RALGQHGUPCOIBQ-QGZVFWFLSA-N	429.970	1.938	50	20	IDGD	
COCCn1nccc1C(=O)N1CCC(OC2CCN(C(=O)[C@H](F)Cl)CC2)CC1	1838083641	ZBWPNZGXTHBVCC-KRWDZBQOSA-N	430.908	1.676	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)/C=N/N3CCCCC3)CC2)CC1	1838392113	LNKJJKFXBSEOHW-SYVPYPDPSA-N	442.988	1.711	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)nc1C	1839197575	BGQHBJPZLBLGFL-YJBOKZPZSA-N	444.301	1.459	50	20	IDGD	
O=C(CCc1ccsc1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839199747	STONRKDUUDICFJ-WBVHZDCISA-N	449.342	1.828	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3c4c(nn3C)CCC4)CCO2)C1	1839581107	DLWAGBZYGOOKAB-IIBYNOLFSA-N	438.956	1.386	50	20	IDGD	
CCN(CC)C[C@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)Br)C2)C1	1839680038	VVQTVTOFSFCYLO-TXPKVOOTSA-N	448.402	1.204	50	20	IDGD	
Cc1cccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)n1	1840030939	AVHGORJFPNGAKU-KSSFIOAISA-N	426.311	1.243	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(OC)c3F)C2)C1	1840156228	LCIZZMNMABMLPX-MGPUTAFESA-N	444.887	1.158	50	20	IDGD	
O=C(CNc1ccc(F)cc1)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840187879	CIBBGPPHFWVOFC-GOSISDBHSA-N	434.295	1.498	50	20	IDGD	
O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1C[C@@]1(F)Cl)CCO2	1840244141	WBEZYFZXBCXLPV-UGFHNGPFSA-N	427.698	1.152	50	20	IDGD	
C[C@H](Cc1ccco1)C(=O)N1CCO[C@]2(COCCN(C(=O)CCBr)C2)C1	1840468816	QLBPVSJZUIUHIL-BEFAXECRSA-N	443.338	1.700	50	20	IDGD	
COc1ccc(/C=C/C(=O)N2CC3(CCCN3C(=O)c3ccc(B(O)O)cc3)C2)c(F)c1	1843012400	LQPXEOQXHLXDCW-UXBLZVDNSA-N	438.264	1.045	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@H]2CN(Cc3ccccc3)CCO2)C1	1843925293	BBXPCWVSFLZPQA-RTBURBONSA-N	435.952	1.345	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)[C@@H]2[C@H]3Sc4ccccc4[C@@H]32)C1	1844275953	WHWUREVMCFFAPE-AABGKKOBSA-N	428.558	1.451	50	20	IDGD	
Cc1onc(-c2ccncn2)c1C(=O)N1CCCC12CN(C(=O)[C@H](F)Br)C2	1844669592	QOWZNRIHUDHRNE-AWEZNQCLSA-N	438.257	1.948	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H]1CCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl	1847559043	IYNUBWZMRQICKF-QAETUUGQSA-N	443.972	1.968	50	20	IDGD	
Cc1nc(COc2ccc(C(=O)NNC(=O)c3csc(N4CCOCC4)n3)cc2)no1	10292153	PYSGQOUZZPLHAP-UHFFFAOYSA-N	444.473	1.325	50	20	IDGD	
Cn1c(=O)c2ccccc2n2c(SCC(=O)NNC(=O)c3ccccc3Cl)nnc12	16321358	JTAFKNBIHOBJOV-UHFFFAOYSA-N	442.888	1.788	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1ccn(-c2ccccc2F)n1	106125240	SPVCEHMQUVXYOC-UHFFFAOYSA-N	430.465	1.688	50	20	IDGD	
COC(=O)CSCCC(=O)NNC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1	110534296	CKEPWSKROIPXDY-UHFFFAOYSA-N	439.497	1.992	50	20	IDGD	
O=C(C[C@@H]1C(=O)Nc2ccccc21)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	116312303	JVKCBXAWLGXAAI-KRWDZBQOSA-N	442.497	1.358	50	20	IDGD	
CC(=O)N1c2ccccc2C[C@H]1C(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12	726523729	VHHIYYYPHDKRGY-IBGZPJMESA-N	433.468	1.716	50	20	IDGD	
CCCNC(=O)NNS(=O)(=O)c1cc(C(=O)OC)c(Cl)cc1Br	728262754	JVEUSGMZLQKHDD-UHFFFAOYSA-N	428.692	1.792	50	20	IDGD	
CCOc1cn(-c2ccccc2)nc1C(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	728512351	QNYUMHVILCNXPW-UHFFFAOYSA-N	432.440	1.593	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)NNC(=O)c2cccc(OC(F)F)c2)ccc1OC	728544422	BRTKLAYHXRMBNY-UHFFFAOYSA-N	429.401	1.280	50	20	IDGD	
C[C@H](C(=O)N(C)CC(=O)NNC(=O)c1cc(F)ccc1Br)n1cccn1	728546088	NAITXWHVDRPWKS-SNVBAGLBSA-N	426.246	1.265	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1c[nH]nc1-c1ccc2c(c1)OCCO2	728981018	KZYFIXDGLFBZCN-UHFFFAOYSA-N	449.471	1.316	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)CSc2ccc(C(N)=O)cc2[N+](=O)[O-])cn1	729693350	UYAHXDFBHCEKCW-UHFFFAOYSA-N	436.475	1.207	50	20	IDGD	
Cc1ccc2c(c1)[C@@H](NC(=O)NNc1ccc(S(=O)(=O)N3CCN(C)CC3)cn1)CC2	730132958	YNSXOASRSJIJTA-IBGZPJMESA-N	444.561	1.640	50	20	IDGD	
Cn1nc(SCC(=O)NN=Cc2ccc(OCc3ccccc3)cc2)c(=O)n(C)c1=O	730569421	ZWZSSAYGPNHKIM-UHFFFAOYSA-N	439.497	1.300	50	20	IDGD	
CCC[C@H](NC(=O)NCc1ccc(F)cc1)C(=O)NNC(=O)COc1ccccc1O	730781518	PTEHESWGYPPXGZ-INIZCTEOSA-N	432.452	1.726	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)c1ccccc1CS(=O)(=O)c1ccccc1	731168329	XSRQCOOIYHNSHJ-UHFFFAOYSA-N	441.465	1.445	50	20	IDGD	
C[C@H](C(=O)NNC(=O)[C@@H]1COc2ccccc2O1)N1CCN(c2ccc(F)cc2)CC1	731865408	DNJXLTNRTZWQRF-QRWLVFNGSA-N	428.464	1.324	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])o1	731874509	JZQQALSNBNEGPS-ZDUSSCGKSA-N	446.416	1.418	50	20	IDGD	
CCCn1c(=O)n(C)c(=O)c2c(S[C@H](C)C(=O)NNC(=O)CC)nc(C(C)C)nc21	731904073	FBJQMQKDFIWJRC-LLVKDONJSA-N	436.538	1.062	50	20	IDGD	
C[C@H](NC(=O)CCC(=O)NNC(=O)NC1CC1)C(=O)c1ccc(Br)cc1	732062649	HAKWKZQFOJPMFK-JTQLQIEISA-N	425.283	1.410	50	20	IDGD	
Cc1nc(C(=O)NNC(=O)CCN2C[C@H](C)O[C@@H](C)C2)nn1-c1ccccc1C(C)C	732260293	CGAYNJMNSWBASS-HOTGVXAUSA-N	428.537	1.959	50	20	IDGD	
CCOc1ccccc1C(=O)N1CCC[C@@H]1C(=O)NNC(=O)CCN1C[C@H](C)O[C@@H](C)C1	732261341	CFKHUKLZCXKDOM-JENIJYKNSA-N	446.548	1.337	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNS(=O)(=O)c2ccc([N+](=O)[O-])cc2)CC1	734807156	HZISEEJVHAPVNY-UHFFFAOYSA-N	443.482	1.487	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)c1cccc(-n2cccn2)c1	734989845	VEZVWBCXBXXBBH-UHFFFAOYSA-N	439.497	1.732	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)c2csc(N3CCOCC3)n2)c(C)c1C	735265909	ORZPABINTVLNIR-UHFFFAOYSA-N	426.520	1.228	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)CC[C@@H]2NC(=O)N(c3ccc(Cl)c(Cl)c3)C2=O)cn1	735446228	GBFNRRBTJXUZJV-ZDUSSCGKSA-N	439.259	1.393	50	20	IDGD	
CC(=O)NC[C@@H]1CN(C(=O)/C(C#N)=C\c2cn(CCC#N)nc2-c2ccccc2)CCO1	735476865	UNNXMKXPCRJKNV-JAORQVBISA-N	432.484	1.734	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2ccc(C(=O)NNc3ccnc(N(C)C)n3)cc2)C[C@H](C)O1	740114171	RRBPHTMLHXVVNR-KBPBESRZSA-N	434.522	1.097	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)Cn2nnc(-c3ccc(Br)cc3)n2)c1	741853783	KSDNEBCDPUUOQV-UHFFFAOYSA-N	426.234	1.435	50	20	IDGD	
O=C(NNC(=O)[C@@H](c1cccc(F)c1)N1CCOCC1)c1cc(Br)c[nH]1	742036991	RGTYWUNBRUMCMZ-OAHLLOKOSA-N	425.258	1.751	50	20	IDGD	
NS(=O)(=O)c1ccc(CNC(=S)NNC(=O)c2cccc(Br)c2)cc1	743009483	VCLINJWTWWPQJL-UHFFFAOYSA-N	443.348	1.406	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1	743576290	AUKZTTKFLXHOCV-UHFFFAOYSA-N	431.405	1.202	50	20	IDGD	
Cc1ccc(C)c(NC(=S)NNC(=O)c2ccc(S(=O)(=O)CC(=O)N(C)C)cc2)c1	743820333	QDIZXQPZLOWGFB-UHFFFAOYSA-N	448.570	1.797	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1)NC1CCCC1	744054036	NQEZINVSZJGGSU-MRXNPFEDSA-N	439.494	1.411	50	20	IDGD	
CC(C)(C)CC(=O)N1CSC[C@H]1C(=O)OCC(=O)NNC(=O)c1ccc(C#N)cc1	744975957	VRFHJUTXLZCXMY-HNNXBMFYSA-N	432.502	1.200	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H]1CCC[C@H]1C(=O)OCC(=O)NNC(=O)c1ccc(C#N)cc1	745075485	XOWFNMHHNHAEQC-CVEARBPZSA-N	430.461	1.556	50	20	IDGD	
COc1ccc([C@H](CNC(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)N(C)C)cc1OC	745289035	DPJYGGRZTUSGRJ-HNNXBMFYSA-N	447.448	1.565	50	20	IDGD	
C[C@H](CCOc1ccccc1)C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	745994653	JXBQQABPPPGTKY-QGZVFWFLSA-N	447.561	1.566	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](CNC(=O)NNC(=O)Cc2cn3ccccc3n2)C1	746763282	ZJQVLFXSCJDMHG-OAHLLOKOSA-N	430.509	1.854	50	20	IDGD	
COC(=O)c1cc(C)c(C)c(S(=O)(=O)NNC(=O)c2cc(Br)c[nH]2)c1	747601399	LXRSNTIUQSSBGR-UHFFFAOYSA-N	430.280	1.804	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2cccc(Br)c2)ccc1F	747616156	LCWFVXWJDAQZTQ-UHFFFAOYSA-N	431.239	1.998	50	20	IDGD	
COc1ccc(C(=O)NNc2cc(Cl)nc(C)n2)cc1S(=O)(=O)N1CCCC1	747980689	WKROUAYZPRPMOX-UHFFFAOYSA-N	425.898	1.988	50	20	IDGD	
CCn1c(SCC(=O)NNC(=O)C(=O)N2CCCC2)nnc1-c1ccc(Cl)cc1	748246004	CINYEALKDMMTAT-UHFFFAOYSA-N	436.925	1.480	50	20	IDGD	
Cc1cc(S(=O)(=O)Nc2ccccc2C(=O)NNC(=O)C(=O)N2CCCC2)ccc1F	748246588	DFFLFHWMBHDTNE-UHFFFAOYSA-N	448.476	1.318	50	20	IDGD	
N#Cc1ccc(N2C(=O)N[C@@H](CCC(=O)NNC(=O)c3cc4ccccc4o3)C2=O)cc1	749473761	MPMDBBBXFBATRL-INIZCTEOSA-N	431.408	1.971	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN[C@](C)(C(N)=O)c1cccc(Cl)c1	750054197	ATXHRZIWJZCYEA-IBGZPJMESA-N	439.299	1.753	50	20	IDGD	
C[C@@H](C(=O)NNc1nc(Br)cn2ccnc12)n1nnc(-c2ccccc2)n1	750248276	KXWPHJUAEPDLKH-JTQLQIEISA-N	428.254	1.850	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)NNC(=O)c2ccc(OC)c(Br)c2)c(C)o1	751378628	JTCIOIGVAFBNIJ-UHFFFAOYSA-N	446.279	1.342	50	20	IDGD	
Cc1ccc(/C=C(\C#N)C(=O)OCC(=O)N2CCc3cc(S(N)(=O)=O)ccc32)cc1	752821443	DSKKKJUQOYVOFD-LICLKQGHSA-N	425.466	1.682	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)N[C@@H]1CCN(c2c(F)cccc2F)C1=O	755085055	QZKJSVTZSDAXRI-LLVKDONJSA-N	442.220	1.805	50	20	IDGD	
COc1ccc(C(F)(F)C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)cc1	755410079	JPXFMJYCTGGFQH-UHFFFAOYSA-N	426.445	1.850	50	20	IDGD	
CCOc1ccc(Oc2ccccc2NC(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)cc1	755429532	HANZOVKWWQCWAK-ZDUSSCGKSA-N	436.490	1.968	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)Nc2cccc(N3CCCS3(=O)=O)c2)c1	755890508	TZGWLKOGOTWPLU-UHFFFAOYSA-N	432.462	1.046	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)Nc1ccc(C(=O)N2CCOCC2)cc1	755932570	BPTYGFFKWXOOKF-UHFFFAOYSA-N	436.428	1.274	50	20	IDGD	
CCOCC(=O)NNC(=O)Nc1ccc(S(=O)(=O)/N=C2/CCCCCN2C)cc1	756115602	UHTGVUHFTHLKNR-JWGURIENSA-N	425.511	1.469	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)Nc3ccn(CCS(C)(=O)=O)n3)n[nH]2)cc1C	756759121	IQHYTCVVAPXPHX-UHFFFAOYSA-N	445.505	1.401	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(N3CCCS3(=O)=O)cc2)cc1	756832721	MVFHWQUOICBPLF-UHFFFAOYSA-N	431.470	1.153	50	20	IDGD	
COC(=O)c1cc(NC(=O)NNC(=O)COc2cc(C)ccc2C)cc(S(C)(=O)=O)c1	757673304	BPRJPYWKOVNOEO-UHFFFAOYSA-N	449.485	1.725	50	20	IDGD	
C[C@@H]1CN(C2CC2)C[C@H]1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	757792225	WJKXOHAGRXOUDC-DNVCBOLYSA-N	449.577	1.288	50	20	IDGD	
CCn1cc(C(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3CN2Cc2ccccc2)cn1	758908201	NYGMDHVRQCQUDC-OAQYLSRUSA-N	431.496	1.860	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)sc1Br	759021337	ZSLQYMOGKMEJEV-UHFFFAOYSA-N	440.323	1.987	50	20	IDGD	
COc1cc(N2CCN(C(=O)NNC(=O)c3cccc(C#N)c3)CC2)cc(OC)c1OC	759255549	XGGBWRHPYPFKAV-UHFFFAOYSA-N	439.472	1.761	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(Br)c([N+](=O)[O-])c1)c1ccc([N+](=O)[O-])cc1	760340171	XKWOYCBHFKFCIY-UHFFFAOYSA-N	445.207	1.889	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2cc(Cl)c3c(c2)OCCO3)n1	762206119	QJCFSZSCDPYPOA-UHFFFAOYSA-N	425.850	1.423	50	20	IDGD	
O=C(NNC(=O)c1cc(F)c(O)c(F)c1)c1cccc(S(=O)(=O)N2CCCCC2)c1	762544612	SJHCVJUTRBLBGS-UHFFFAOYSA-N	439.440	1.920	50	20	IDGD	
O=C(NNc1nccc(N2CCOCC2)n1)c1cc([N+](=O)[O-])ccc1N1CCCCC1	762851826	GWOYHNIQNPUDMZ-UHFFFAOYSA-N	427.465	1.969	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)[nH]n1)C(=O)Nc1ccc(CN2CCOC2=O)cc1	763615267	ZJSYIBABILLUMR-UHFFFAOYSA-N	448.439	1.429	50	20	IDGD	
CC(C)(C)OC(=O)Nc1ccc(CC(=O)NNC(=O)CNC(=O)c2cccnc2)cc1	763825547	ZITVYFDMTSEVJY-UHFFFAOYSA-N	427.461	1.549	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccc(OC[C@H]2CCCO2)cc1	763848533	CRGSZHPOEWCSLS-WMLDXEAASA-N	445.447	1.937	50	20	IDGD	
CCOCCOc1c(Cl)cccc1NC(=O)C(=O)NNC(=O)Cn1nc(C)cc1C	763890851	HGFDUUATOXUPRS-UHFFFAOYSA-N	437.884	1.355	50	20	IDGD	
CSc1cnn(-c2ccccc2)c1NC(=O)C(=O)NNC(=O)Cn1nc(C)cc1C	763891192	LGFWSYDKIIANFI-UHFFFAOYSA-N	427.490	1.194	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(N)=O)c(F)c2)cc1OC	763913064	YNNHWNLOMPYZBF-UHFFFAOYSA-N	446.435	1.512	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)C(=O)Nc1cccc(NC(=O)[C@@H](C)n2cccn2)c1	763950009	HQPSQRPAWQPGNN-OAHLLOKOSA-N	434.456	1.791	50	20	IDGD	
C[C@@H](c1cccc(NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)c1)N1CCOCC1	764152371	DKSRJVHRUOFRMC-MGPUTAFESA-N	438.484	1.169	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCCCC2)cc1NC(=O)C(=O)NNC(=O)CCC(C)C	764203152	NEQOEFQEKXKSLN-UHFFFAOYSA-N	438.550	1.692	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)C(=O)Nc2cc(N3CCNC3=O)ccc2Cl)c1	764234778	IXYBZKXOJAJXLO-UHFFFAOYSA-N	426.820	1.141	50	20	IDGD	
Cc1ncsc1C(=O)NNC(=O)C(=O)Nc1cccc(CNC(=O)OC(C)(C)C)c1	764246539	KTCQCNKHBFBZES-UHFFFAOYSA-N	433.490	1.876	50	20	IDGD	
Cc1ccc(S(C)(=O)=O)cc1NC(=O)C(=O)NNC(=O)c1cccc(OC(F)F)c1	764250069	IKZFSEBFYTVEDE-UHFFFAOYSA-N	441.412	1.400	50	20	IDGD	
CNC(=O)CCOc1ccc(NC(=O)C(=O)NNC(=O)C(C)(C)c2ccccc2)cc1	764309069	KLBHQHMIMXBUOP-UHFFFAOYSA-N	426.473	1.265	50	20	IDGD	
Cc1ccc2nc(-c3ccc(NC(=O)C(=O)NNC(=O)[C@@H]4COCCO4)cc3)sc2c1	764424741	KWJJDABGWDDYHL-INIZCTEOSA-N	440.481	1.773	50	20	IDGD	
Cc1n[nH]c(C)c1[C@H](C)CC(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	764752158	HSPGMQYCXGYVGU-OAHLLOKOSA-N	426.521	1.126	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cc(C)[nH]n2)cc1S(=O)(=O)N1CCCCCC1	765586440	VCPICXJVUOTDJP-UHFFFAOYSA-N	435.506	1.366	50	20	IDGD	
CSc1ncc(Cl)c(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)n1	765731648	AOMGCEZPHWZWFQ-UHFFFAOYSA-N	448.936	1.071	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)N[C@@H]2CN(Cc3ccccc3)C[C@@H]2C)nc1	765892750	MNZXEFXJRDKJLW-QFBILLFUSA-N	446.577	1.915	50	20	IDGD	
COc1cc(Br)c(NC(=O)C(=O)NNc2nccnc2OC)cc1OC	766270431	GYNIHULSRRRPIT-UHFFFAOYSA-N	426.227	1.347	50	20	IDGD	
CCc1c(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cnn1C(C)(C)C	766636507	PDORITZDQHOCAB-UHFFFAOYSA-N	440.548	1.420	50	20	IDGD	
CC[C@H](OC1CCCCC1)C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	766642136	JSPPVAMDZGNKSJ-FQEVSTJZSA-N	430.549	1.720	50	20	IDGD	
NC(=O)c1ccc(C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)s1	766663639	KYPLEKRGXZDAQC-UHFFFAOYSA-N	435.937	1.079	50	20	IDGD	
CCOC(=O)c1cnc(C)c(C(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)c1	767541654	TZCPBFAYYTUPHM-UHFFFAOYSA-N	449.508	1.910	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)Cc2ccccn2)n(-c2ccc(C(F)(F)F)cn2)n1	768244356	ZWXLBQVAJSRASE-UHFFFAOYSA-N	447.377	1.318	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)Sc1nnc(-c2cc(-c3ccccc3)[nH]n2)n1N	768437880	KVVMAICDKLULDD-GFCCVEGCSA-N	428.522	1.723	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)CCOc1ccc(S(C)(=O)=O)cc1	768609922	BPGNURZZBYVRDF-UHFFFAOYSA-N	442.515	1.414	50	20	IDGD	
COc1ccc(NC(=O)NNc2c(OC)cccc2S(C)(=O)=O)cc1-n1nnnc1C	769232640	IRDPALXSXDXKTL-UHFFFAOYSA-N	447.477	1.540	50	20	IDGD	
O=C(CCC(=O)c1ccccn1)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	770245016	KIJWVYYMRSPYSW-UHFFFAOYSA-N	443.935	1.663	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)N1CCC[C@H]1C(=O)NNc1nc(O)c2cnn(C)c2n1	770972428	QUQSDNFAVSDHRP-ZDUSSCGKSA-N	445.867	1.479	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)N1CCN(C2CCN(C(C)C)CC2)CC1	771200017	NFPBNPDTFZLGER-UHFFFAOYSA-N	427.553	1.488	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1cccc(NC(=O)[C@H]2Cc3ccccc3O2)c1	772025712	RKFHUQZSSISNLS-SCLBCKFNSA-N	425.441	1.732	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)Nc2cnn(Cc3nnc4n3CCCC4)c2)cc1C	772635865	IIMNNEREBXDJIY-UHFFFAOYSA-N	438.492	1.708	50	20	IDGD	
Cc1ccc(I)cc1NC(=O)C(=O)NNC(=O)c1ccc(C#N)cc1	773497515	VMORLXGUPOXZOV-UHFFFAOYSA-N	448.220	1.871	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(S(=O)(=O)N3CCCC3)c2)cc1F	773885075	HBPJRCBGZMWDKD-UHFFFAOYSA-N	448.476	1.318	50	20	IDGD	
CN(C)C(=O)[C@H]1CC[C@H](CNC(=O)NNC(=O)c2ccc(COc3ccccc3)o2)O1	774659287	NGEDZQCZOFKNCZ-CRAIPNDOSA-N	430.461	1.438	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cnn(C)c3-c3ccccc3)CC2)cc1	775542369	JWDIMUROVUIREW-UHFFFAOYSA-N	446.555	1.974	50	20	IDGD	
CC(C)n1cnnc1SCC(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776201364	IXCTYWBDSKTUHE-UHFFFAOYSA-N	441.558	1.587	50	20	IDGD	
N#C/C(=C/c1ccc(O)cc1)C(=O)N1CCN(S(=O)(=O)c2cccc([N+](=O)[O-])c2)CC1	776596320	IFQNHMVIDAGGKH-VBKFSLOCSA-N	442.453	1.740	50	20	IDGD	
CC[C@@H](C)Oc1cc(CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)ccn1	776885538	LETNJDPMHTWSQG-CYBMUJFWSA-N	434.522	1.696	50	20	IDGD	
CCOC(=O)N1CCC[C@@H]([C@H](C)NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)C1	776929908	GXDVKUQJXBPHAU-DZGCQCFKSA-N	440.522	1.291	50	20	IDGD	
O=C(NC[C@@H]1COC2(CCCCCC2)O1)NNC(=O)c1nn(-c2ccccc2)cc1O	776952305	KAVILBPYTMKFKI-MRXNPFEDSA-N	429.477	1.988	50	20	IDGD	
CCCc1nc(C)c(NC(=O)C(=O)NNC(=O)c2nn(CC)c(=O)c3ccccc23)s1	777140825	CCUPFEWXDBQAPH-UHFFFAOYSA-N	442.501	1.534	50	20	IDGD	
CC1CCC2(CC1)OC[C@H](CNC(=O)NNc1ccc(S(=O)(=O)NC(C)C)cn1)O2	777761313	MDWKEMGYPWYRCT-HVEKOLDVSA-N	441.554	1.716	50	20	IDGD	
CC(=O)CCc1ccc(OCC(=O)N2CCN(S(=O)(=O)CBr)CC2)cc1	777777910	SLEVDPUUYHVALE-UHFFFAOYSA-N	447.351	1.413	50	20	IDGD	
CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)NNC(=O)CNC(=O)OC(C)(C)C	778437501	FCPGMVSXOMNUNY-INIZCTEOSA-N	435.456	1.026	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)C[C@@H]2CCO[C@@H](C(C)C)C2)cc1	781575963	BILCPTOMMNWSQY-SJLPKXTDSA-N	425.551	1.604	50	20	IDGD	
CCS(=O)(=O)c1ccc(Br)c(C(=O)NNC(=O)Cc2ccncc2)c1	781692525	BDVVAULIYACOEY-UHFFFAOYSA-N	426.292	1.641	50	20	IDGD	
O=C(NNc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1ccc(CN2C(=O)CCC2=O)cc1	783290619	CODRCDGPSCIITC-UHFFFAOYSA-N	445.819	1.979	50	20	IDGD	
Cn1c(=NNC(=O)C(=O)Nc2cc(S(C)(=O)=O)ccc2Cl)sc2ccccc21	783349464	ITINZHFOZXUSLT-UHFFFAOYSA-N	438.918	1.867	50	20	IDGD	
COC(=O)c1cc(Br)c(F)cc1NC(=O)C(=O)NNc1cc(C)ncn1	783944287	IIWVFRNBINYTHE-UHFFFAOYSA-N	426.202	1.555	50	20	IDGD	
O=C(COC(=O)CCN1C(=O)[C@H]2CCCC[C@@H]2C1=O)NNC(=O)c1ccc(Cl)cc1	784386482	UFFNOWYOLWSRAG-GJZGRUSLSA-N	435.864	1.210	50	20	IDGD	
O=C(NNc1nc(-c2ccc(Cl)cc2)no1)C(=O)Nc1cnn(C[C@@H]2CCCO2)c1	784799821	OROOTURTWWYNFF-AWEZNQCLSA-N	431.840	1.847	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@@H]2CCCN2c2ccccc2)cc1	786639656	NOHTYFWORVYKFL-IBGZPJMESA-N	430.530	1.432	50	20	IDGD	
N#CCCCN1C(=O)CCc2cc(NC(=O)C(=O)NNC(=O)CC3CCCC3)ccc21	787890097	UNQGYGILRSRISN-UHFFFAOYSA-N	425.489	1.936	50	20	IDGD	
CC1(C)CCC[C@]2(C1)NC(=O)N(CC(=O)NNc1nnc(-c3ccccn3)s1)C2=O	788556294	IEBGEOXRPAKPNA-LJQANCHMSA-N	429.506	1.934	50	20	IDGD	
O=C(NNc1nnc(-c2ccccn2)s1)c1ccc(S(=O)(=O)N2CCOCC2)cc1	788558605	RMQUAHFIELAKHZ-UHFFFAOYSA-N	446.514	1.378	50	20	IDGD	
O=C(COC(=O)c1ccc(O[C@H]2CCOC2)cc1)NNC(=O)c1cccc([N+](=O)[O-])c1	789196441	BSYSJSNUYVDDNX-KRWDZBQOSA-N	429.385	1.381	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)cnn1C1CCCC1	789811154	WFFZHPRPEMIUEV-HKUYNNGSSA-N	425.489	1.965	50	20	IDGD	
COCCN(C)c1ccc(C=NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cn1	790166712	TWDSVJRRRZKZHH-UHFFFAOYSA-N	438.532	1.072	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)N[C@@H]1CCN(Cc2ccc(F)cc2)C1=O	790677429	ODJVXUJXOVOMSR-OAHLLOKOSA-N	431.380	1.185	50	20	IDGD	
O=C(N[C@@H]1CCS(=O)(=O)C1)[C@H]1CCCC[C@H]1C(=O)NNc1cccc(F)c1[N+](=O)[O-]	791150283	LLVKJQGTMXDIFZ-FRRDWIJNSA-N	442.469	1.287	50	20	IDGD	
Cc1cc2ccccc2nc1NNC(=O)C(=O)Nc1cccc(C(=O)N(C)CC(N)=O)c1	793054103	AYYKLZFDKFQZHF-UHFFFAOYSA-N	434.456	1.182	50	20	IDGD	
COc1ccc(CCC(=O)N2CCCN(C(=O)NNC(=O)c3cccc(C)n3)CC2)cc1	793220013	JFJFEFFNSQIJOZ-UHFFFAOYSA-N	439.516	1.920	50	20	IDGD	
CN(CCO)S(=O)(=O)c1ccc(C(=O)NNc2ccc([N+](=O)[O-])cc2Cl)cc1	798335958	WVRSXRMQNZFTQY-UHFFFAOYSA-N	428.854	1.618	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)NCCCNS(=O)(=O)c1ccccc1Cl	798492557	FVVFQLGMRPHIAP-UHFFFAOYSA-N	442.900	1.721	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1)C(=O)Nc1cncc(F)c1	799258674	FPYQFUZRYLTXJG-OAQYLSRUSA-N	447.470	1.934	50	20	IDGD	
CC(C)OCCCn1c(NNC(=O)C(C)(C)N2CCOCC2)nc2ccccc2c1=O	801156548	WHNVOCJHEHUSKD-UHFFFAOYSA-N	431.537	1.766	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCN(c2ccc(C#N)nc2)CC1	801553813	XJQRNGBWUOKXAK-UHFFFAOYSA-N	428.880	1.198	50	20	IDGD	
C[C@@H](CCNS(=O)(=O)c1ccccc1)NC(=O)NNC(=O)COc1ccccc1F	801737602	HCTUBHIQSLPQDI-AWEZNQCLSA-N	438.481	1.292	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1csc(N2CCOCC2)n1)c1nccn1-c1ccccc1	804868044	SUHMXFWUNNHYQH-AWEZNQCLSA-N	441.517	1.871	50	20	IDGD	
CSC[C@H](C(=O)NNc1ccc(-n2ccnc2)nn1)N1C(=O)[C@H]2CCCC[C@@H]2C1=O	804955935	ZGCUZIGCJTXITE-MELADBBJSA-N	429.506	1.012	50	20	IDGD	
C/C=C(\CC)C(=O)NNC(=O)C[C@@H]1c2cc(OC)c(OC)cc2CCN1S(C)(=O)=O	809999856	TVVSJZRWTWWGGK-MSXUNZPYSA-N	439.534	1.456	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)CNS(=O)(=O)c2cc(C)ccc2C)o1	810199970	HOVQCLZOMVAPHB-UHFFFAOYSA-N	436.534	1.478	50	20	IDGD	
CNC(=O)c1cc(Oc2ccc(NC(=O)C(=O)NNC(=O)OC(C)(C)C)cc2F)ccn1	810389366	DFCXZBABNPLPGK-UHFFFAOYSA-N	447.423	1.867	50	20	IDGD	
CCOC(=O)c1ccc(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)cc1	810461711	FBJSOAYZANRMMF-UHFFFAOYSA-N	433.486	1.641	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCC(=O)NNc2nc(Br)cn3ccnc23)cc1	810484513	ANWOWZRUMLOLKC-UHFFFAOYSA-N	439.295	1.222	50	20	IDGD	
Cn1cc(C(=O)NNS(=O)(=O)CCCN2C(=O)c3ccccc3C2=O)c2ccccc21	811680628	NPHJVKZBKUIIHL-UHFFFAOYSA-N	440.481	1.429	50	20	IDGD	
C[C@@H](CC(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1)c1ccc(F)c(Br)c1	812535456	WROSACJIRKDZPH-GXSJLCMTSA-N	436.303	1.599	50	20	IDGD	
CC(C)N(C)c1cccc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)N(C)C)c1	815752137	FENMEXYPSXLNEZ-UHFFFAOYSA-N	433.534	1.863	50	20	IDGD	
O=C(NNc1ncncc1F)C(=O)Nc1cc(-c2nnc3n2CCCCC3)ccc1F	815763931	IUHWPBAWMNTZPT-UHFFFAOYSA-N	428.403	1.822	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)CCC(=O)N1CCOc2ccccc21	817055280	VCUZHOXGBXDIIB-UHFFFAOYSA-N	432.502	1.586	50	20	IDGD	
C[C@@H](Sc1nnnn1C1CC1)C(=O)NNC(=O)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	819658847	PTBGBTOKHBYWNK-VXGBXAGGSA-N	439.542	1.283	50	20	IDGD	
CCCCC(=O)N1CSC[C@H]1C(=O)NNC(=O)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	819658883	QDLYMIXBAXEHBU-CABCVRRESA-N	442.582	1.873	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)[C@@H]2CC(=O)N(c3cc(C)ccc3OC)C2)c1	825782408	WWUVICKKNBOTLY-OAHLLOKOSA-N	426.473	1.625	50	20	IDGD	
Cc1nc2c(c(C)nn2C)c(C)c1CCC(=O)OCC(=O)NNC(=O)c1cccs1	842013097	FKGIHSGQUAGTQZ-UHFFFAOYSA-N	429.502	1.892	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCCN1C(=O)c1cccs1)c1csc(N2CCOCC2)n1	892846087	USMXQVCICOZZTP-CQSZACIVSA-N	449.558	1.497	50	20	IDGD	
O=C(NNC(=O)c1ccc(F)c(S(=O)(=O)N2CCOCC2)c1)NC1CCCCC1	913449212	LBCIFJGAAGOHOF-UHFFFAOYSA-N	428.486	1.123	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)[C@H]1CC(=O)N(C2CCCCC2)C1	914708156	LWVSPMJLWREUTF-IBGZPJMESA-N	441.576	1.527	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cn(-c3ccc(Cl)cc3)nn2)c1	914748178	LOYJPLOHGSTLQF-UHFFFAOYSA-N	448.892	1.246	50	20	IDGD	
CCCNC(=O)CN1CCC(NC(=O)/C(C#N)=C\c2cc(C)n(CCOC)c2C)CC1	915178449	FEDOIFPVJYTZRV-ZHZULCJRSA-N	429.565	1.765	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@@H]2C(=O)NNC(=O)COc2ccc(F)cc2)c(OC)c1	915188652	IKNUIWKUUUXSAV-GOSISDBHSA-N	445.447	1.674	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)NCc2ccc(S(N)(=O)=O)cc2)cc1	915884631	MKNJVHCCGBDPNI-ZDUSSCGKSA-N	436.490	1.031	50	20	IDGD	
NS(=O)(=O)c1ccc(CNC(=O)NNC(=O)CC23CC4CC(CC(C4)C2)C3)s1	915906152	MYGLZAXLPQCZCK-UHFFFAOYSA-N	426.564	1.832	50	20	IDGD	
CCN(CC)[C@@H](CNC(=O)NNC(=O)c1csc(N2CCOCC2)n1)CC(C)C	916258806	MDTGOSBFISYQFU-OAHLLOKOSA-N	426.587	1.680	50	20	IDGD	
COc1ccc(C(=O)NN=C(C)c2ccc(S(=O)(=O)N3CCNCC3)cc2)cc1OC	916288898	JAAGLYOBOSPWFQ-UHFFFAOYSA-N	446.529	1.452	50	20	IDGD	
C[C@@H]1CN(C[C@@H](C)C(=O)NN=Cc2ccccc2OCC(=O)N2CCCC2)C[C@@H](C)O1	916372162	OJLBMVVEIZVEIG-GUDVDZBRSA-N	430.549	1.883	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)NCc1ccc(-n2cncn2)nc1	916395246	GBZLJTHXVYYDOM-UHFFFAOYSA-N	446.265	1.334	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)c1cccc(NC(=O)c2ccco2)c1	916746537	UDHHWDCVDYBXFN-UHFFFAOYSA-N	441.469	1.900	50	20	IDGD	
O=C(NNC(=O)[C@H]1CC(=O)N(c2ccc(Cl)cc2)C1)c1ccc(-n2cnnn2)cc1	917924965	HERNLRDTXWUPNO-ZDUSSCGKSA-N	425.836	1.130	50	20	IDGD	
Cc1ccc([C@@H](CNC(=O)NNC(=O)COc2ccccc2F)N2CCOCC2)cc1	918099568	UPVURLANCQALLO-LJQANCHMSA-N	430.480	1.917	50	20	IDGD	
CC(C)Oc1ccc(NS(=O)(=O)CC(=O)NNC(=O)COc2ccc(F)cc2)cc1	918420392	WCOGQQQNDCAXAC-UHFFFAOYSA-N	439.465	1.581	50	20	IDGD	
O=C(CCNS(=O)(=O)c1cccc([N+](=O)[O-])c1)NNC(=O)c1ccc2ccccc2c1	920342859	OZAKYCQJNMIBSJ-UHFFFAOYSA-N	442.453	1.878	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)[C@H]2COc3ccc(F)cc3C2)ccc1Cl	1253776626	YCXKDSCWPKPHFW-LLVKDONJSA-N	427.841	1.139	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)c2ccccc2SCC(N)=O)CC1	1318656483	KMYLMWMSNKCQNA-UHFFFAOYSA-N	436.534	1.672	50	20	IDGD	
Cc1ncnc(O)c1CCC(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	1319240842	PVROOOAPZHUECT-UHFFFAOYSA-N	446.939	1.042	50	20	IDGD	
COc1ccc(S(=O)(=O)CCC(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)cc1	1319802360	BLAYWGFHOKWLHA-UHFFFAOYSA-N	434.499	1.772	50	20	IDGD	
CN(C)Cc1cc(C(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)no1	1325133965	PNHYENRFVVBEJU-UHFFFAOYSA-N	446.467	1.569	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@@H]2COc3c(F)cc(F)cc3C2)c2ccccc2c1=O	1527968809	IZZJXARPSHOWDP-ZDUSSCGKSA-N	443.410	1.642	50	20	IDGD	
COC(=O)c1ccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)C(Cl)Cl)C3)cn1	1778209044	BLBUOGCBBAUGDL-AUUYWEPGSA-N	444.315	1.799	50	20	IDGD	
Cc1nc2ccncc2cc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2	1778950740	IDHILCOZONCAFX-NNMXDRDESA-N	446.935	1.665	50	20	IDGD	
C[C@H](Cn1cncn1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CO[Si](C)(C)C)C2	1779499657	NTLJTSRFDYDJGL-MBOZVWFJSA-N	437.617	1.280	50	20	IDGD	
O=C(c1cc(Br)ccc1O)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1780556684	NPXVPNLKNKFOFH-PBHICJAKSA-N	447.713	1.198	50	20	IDGD	
COCc1c[nH]c(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](F)Br)C2)c1	1780773988	QXRSAJMYGKKEAQ-IIDMSEBBSA-N	446.317	1.979	50	20	IDGD	
O=C(c1nccc2[nH]ccc12)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781332008	YFIQAOFGOFAFSF-WMLDXEAASA-N	425.258	1.697	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H]2Cc3ccccc3N2)C1	1781589154	TZJGQZNOUMKAOP-FAGZOMQFSA-N	435.952	1.791	50	20	IDGD	
CC1=CC[C@@H](C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CCC(=O)NN(C)C)C2)CC1	1782214120	DPHQIAMJGLKMQD-DNVFCKCGSA-N	434.581	1.620	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cccc4c3NC(=O)C4)C2)C1	1782410332	KDEKPTRONYVJOW-HXPMCKFVSA-N	436.306	1.408	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)n2cccn2)C1	1782562269	RVVMZWSZCQEVMY-LUXYFRNMSA-N	427.343	1.741	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc4nccn4c3)CCO2)C1	1783347135	ACFQCORSYXBCMV-KXBFYZLASA-N	435.322	1.951	50	20	IDGD	
COC(=O)CCCCCC(=O)N1CCO[C@]2(CCN(C(=O)[C@H](C)Br)C2)C1	1783539440	JAFDNCROLXVYLL-KBXCAEBGSA-N	433.343	1.723	50	20	IDGD	
O=C(/C=C/c1ccc(O)cc1Cl)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1783775090	PMLSESHFKUVIJL-VEODVNFMSA-N	429.300	1.488	50	20	IDGD	
C=CCOCCCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]2C1	1783964050	IGKPCORFKRUUDG-QZWWFDLISA-N	431.371	1.980	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3scnc3C(F)(F)F)C[C@@H]21)[C@@H](O)CCl	1784086150	GRMBBPVRZHBWEF-NAKRPEOUSA-N	441.859	1.355	50	20	IDGD	
CCOCCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)CCO2	1784696458	YQLZZNDIKCPCBN-NRFANRHFSA-N	449.460	1.390	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H]1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Cl)C[C@@H]21	1784819566	KRBZAOSNWYWHQN-SBJFKYEJSA-N	433.908	1.510	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)COc3cccnc3)[C@H]2C1	1785147792	LBHWZEKUCDDUCA-SDADXPQNSA-N	426.311	1.224	50	20	IDGD	
Cc1nnc(CCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CO[Si](C)(C)C)C[C@@H]32)s1	1785322836	IHEIUSDMRYRPSV-JYJNAYRXSA-N	440.642	1.610	50	20	IDGD	
COc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)CBr)C[C@@H]32)n(C)n1	1785614117	PIMLITIKPPEDIY-ABHRYQDASA-N	443.342	1.053	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc(N(C)C)o3)[C@H]2C1	1785885749	ABJHGRIDQFGMHZ-CYDGBPFRSA-N	429.315	1.117	50	20	IDGD	
COc1cnc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)CBr)C[C@@H]32)cn1	1786239043	DFMYYDMXWDCBJP-ABHRYQDASA-N	441.326	1.110	50	20	IDGD	
CC(C)(NCCC#N)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]21	1786859370	CTJSNIQBAHBKHO-XMDUPGNXSA-N	433.380	1.484	50	20	IDGD	
COc1ccnc(C(=O)NC2(c3ccc(NC(=O)c4ccc(B(O)O)cc4)cc3)CCC2)c1	1788142410	WWBBYDJWQJLSGF-UHFFFAOYSA-N	445.284	1.832	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1ccc(C2(NC(=O)c3ncon3)CCC2)cc1	1788645311	BZNVUULLGSQEML-LGJNPRDNSA-N	435.444	1.951	50	20	IDGD	
CCOC(=O)c1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Cl)C[C@@H]32)ccn1	1789335169	SHFUWPNTZJLIFY-DARAHFNDSA-N	427.860	1.386	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cn(C(C)(C)C)nn3)[C@H]2C1	1789354562	JWWPNCQVFXVPPI-DZKIICNBSA-N	425.961	1.891	50	20	IDGD	
CCC[C@@H](NC(C)=O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]2C1	1789872654	PPIHGXBVKIJYPE-KSPMYQCISA-N	436.380	1.507	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnn4c3CCC4)[C@H]2C1	1790390547	RSIAJYASCBEMBH-HAHWVIBASA-N	429.348	1.659	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3n[nH]cc3[N+](=O)[O-])C[C@@H]21	1790960489	LQCUTZWWZULGPD-ZPFDUUQYSA-N	444.286	1.085	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCOCCOCCOC)[C@H]2C1	1791132529	QQNYVFDLQRHXPY-OKYOBFRVSA-N	448.988	1.443	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc4c(c3)CCO4)C[C@@H]21	1791258067	YCNRZTCRACTHHE-JPLJXNOCSA-N	436.936	1.398	50	20	IDGD	
CCOC(CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)Br)C[C@@H]21)OCC	1791424467	QXRDYFRVIKGPLG-QPSCCSFWSA-N	435.359	1.539	50	20	IDGD	
C[C@@H](Cn1ccnc1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21	1791628059	IOWYLCQDDVZHOB-YYFQZIEXSA-N	431.306	1.189	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccccc1F)C2	1792867605	GZVXESPPKONYLK-LJGDNWOOSA-N	427.314	1.989	50	20	IDGD	
CN(C)c1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](O)CCl)c2ccccc12	1792978543	ZUSNZXDZTHXMNA-IALDWUNLSA-N	445.947	1.709	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1(c2ccc(O)cc2)CC1	1793027265	QABWMBPDMNZHOS-ZJOBFFGXSA-N	437.334	1.797	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1=CCN(C(=O)OC(C)(C)C)C1	1793224945	GTMRUBHRKCDZNN-YYIAUSFCSA-N	441.956	1.771	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc(O)c3ccn(C)c13)C2	1793448300	BFRIGZQPDDSHJG-DLTLXFJOSA-N	434.924	1.890	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(C)nn1C(F)F	1798682212	YQIGNAQGAVFOGJ-GFQSEFKGSA-N	449.296	1.963	50	20	IDGD	
COc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)Br)C3)c(O)c1	1798835608	PIEFXEHJNNWGDW-OVZMXSCWSA-N	427.295	1.387	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(NC(=O)OC)c1	1799429848	KZVKIKQGQLSZIF-FSDCSDTHSA-N	439.896	1.322	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc[nH]n1)C2)[C@H](Br)Cc1ccccc1	1800435664	LFSFESYHRFJKIX-KYHPRHEASA-N	447.333	1.619	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1c(C)nn(C)c1C)C2	1800644545	ZRVVYVQLEKCKOO-KPEUIFRASA-N	441.370	1.343	50	20	IDGD	
C[C@H](CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(Cl)Cl)NC(=O)OC(C)(C)C	1801016338	ZMDLNFNAJFEPEQ-NRWUCQMLSA-N	438.352	1.683	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@H]1CCN(C(=O)[C@H]2CCC(=O)N2)[C@@H]1c1cccnc1	1803009985	ZKDIHNKFAMIWTN-DNNBLBMLSA-N	437.338	1.397	50	20	IDGD	
CC(C)(C)OC(=O)CC(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]1c1cccnc1	1803136705	TZFQQHSWEQUDLE-RVKKMQEKSA-N	425.913	1.419	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2c(F)ccc(O)c2F)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803141798	UJEQUEIJKNUMQM-XLWVJDPXSA-N	439.846	1.985	50	20	IDGD	
Cc1ccc(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)o1	1803779104	IQUPDIYUYFMRED-GHTZIAJQSA-N	433.273	1.296	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)CSC1=S	1804335961	NXWJONZOJKQLLL-ZAQLIGFBSA-N	438.402	1.721	50	20	IDGD	
O=C(O)c1cc(C(=O)NC[C@@H]2CCN(C(=O)C(Cl)Cl)[C@@H]2c2cccnc2)ncn1	1804974284	RBXVNTQEZJGQRE-SMDDNHRTSA-N	438.271	1.693	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)c1n[nH]c(C2CC2)c1F	1805124578	WZFNCMRKHHYFIS-DEYYWGMASA-N	435.887	1.741	50	20	IDGD	
CC[C@@H](NC(C)=O)C(=O)N1CC[C@H](CNC(=O)CCBr)[C@H]1c1cccnc1	1806337426	HUVITGLUMAZQNB-JFIYKMOQSA-N	439.354	1.787	50	20	IDGD	
C=CCSCC(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1807363401	OMCSKFFSWUFWOQ-WIYYLYMNSA-N	439.346	1.000	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1CCN(C(=O)Cn2cnnn2)[C@H]1c1cccnc1	1808294743	CEDYKVBHKZZTJJ-QRTARXTBSA-N	426.308	1.010	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)c2cccnc2)[C@@H]1c1cccnc1	1810298567	IVCTVOFLGOMOPE-OXQOHEQNSA-N	445.483	1.109	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)CCn2cncn2)[C@@H]1c1cccnc1	1812778771	LNDPVOICOGEKQA-XYJFISCASA-N	449.353	1.943	50	20	IDGD	
Cc1nc(CC(=O)N2CC[C@H](CNC(=O)[C@@H](C)Br)[C@H]2c2cccnc2)no1	1812865212	MVTIVHDLRXJTEX-JDSLSITLSA-N	436.310	1.805	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)CSCC(=O)O)[C@@H]1c1cccnc1	1813088708	LSWVIXOEBWMZNF-RBOXIYTFSA-N	444.351	1.689	50	20	IDGD	
CS(=O)(=O)CCC(=O)NC[C@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1	1813573985	KGHSSCOZZSATPN-PBHICJAKSA-N	446.367	1.307	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(=O)n4[nH]cnc4n3)sc2C1	1815323165	AUGXMKQSJPDZLO-ZJUUUORDSA-N	449.924	1.507	50	20	IDGD	
C[C@H](NC(=O)c1cnccn1)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](F)Cl)sc2C1	1817125496	PNQUPRJTIBFWIR-RWEMILLDSA-N	440.888	1.198	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)c3cc(F)cn3C)sc2C1	1817853675	VHGXAXKBGPLBHE-LBPRGKRZSA-N	436.513	1.220	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)[nH]n1)[C@@H](F)Cl	1818045618	ZDFNQKMQSIIHTL-TVQRCGJNSA-N	433.918	1.797	50	20	IDGD	
CCOCC(=O)N1CCCC[C@H]1c1cc(NC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)n[nH]1	1818111806	IVAFLMDCMQUWNN-OHHQFBAHSA-N	429.481	1.572	50	20	IDGD	
CC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CN1C(=O)CSC1=S)CC2	1822857484	IMNNLBSOPYXBGJ-BDAKNGLRSA-N	447.007	1.933	50	20	IDGD	
Cn1cccc1C(=O)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1	1823013873	KROGPLDZXDOVTE-OQPBUACISA-N	443.298	1.967	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)CCl)CC2)c1cnn2cccc(F)c12	1824366784	YSRGICWIUBNESL-RNCFNFMXSA-N	437.884	1.755	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCBr)CC2	1826085125	FTXNDFVWSRUVAO-JTQLQIEISA-N	446.371	1.213	50	20	IDGD	
Cc1nnsc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827052765	DTIXTYJVKQTZIA-GOSISDBHSA-N	442.350	1.073	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccccc3)C2)C1	1830538073	VDAZJDTWXIJCCL-OXQOHEQNSA-N	439.350	1.717	50	20	IDGD	
C[Si](C)(C)C#CCCCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1830731592	MTODHJWHIBPDLF-PXNSSMCTSA-N	445.032	1.094	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(COC)c[nH]3)C2)C1	1831653871	FYCGEXPNGFDRHA-JXFKEZNVSA-N	427.929	1.639	50	20	IDGD	
Cc1cc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)ccn1	1831873257	FWIXHCAHKLOURH-FQEVSTJZSA-N	429.565	1.996	50	20	IDGD	
CCc1cc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)n(C)n1	1831873773	XIVCKWCWACUTEI-IBGZPJMESA-N	446.596	1.589	50	20	IDGD	
O=C([C@@H](F)Br)N1CCC([C@@H]2CCCCN2C(=O)CN2C(=O)C=CC2=O)CC1	1831986644	SVWYGSPWDYLVLO-SUMWQHHRSA-N	444.301	1.222	50	20	IDGD	
Cc1cn(CC(=O)N2CCCC[C@H]2C2CCN(C(=O)C(Cl)Cl)CC2)c(=O)nc1O	1832775637	DWFVAJLGPOTOOD-AWEZNQCLSA-N	445.347	1.681	50	20	IDGD	
Cc1cc(C(=O)N2CCC(N3CCC(NC(=O)[C@@H](O)CCl)CC3)CC2)cc2c[nH]nc12	1833311902	GUWNWDFHVSWQTK-IBGZPJMESA-N	447.967	1.656	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3coc(Cl)n3)CCO2)C1	1833557905	YWXSJLWTVTVUHS-HOTGVXAUSA-N	440.711	1.634	50	20	IDGD	
O=Cc1ccc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCBr)CCO3)C2)s1	1834822382	KKNDBSIJSHNTKL-QGZVFWFLSA-N	445.335	1.416	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)COc3ccccc3)CCO2)C1	1834954871	BQNKWMNTISTRCC-DNVCBOLYSA-N	441.322	1.305	50	20	IDGD	
CC(C)N[C@@H](C(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)C(C)C	1836716710	KQLLIOLOOPFPTF-RBUKOAKNSA-N	432.005	1.607	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)CC(=O)OC(C)(C)C)CC2)CC1	1836991191	BWISFNFFMAOMCX-QGZVFWFLSA-N	446.972	1.971	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)N1C[C@H]3C[C@H]3C1)CCO2	1837279728	RKSOKJDLCDEVMR-HUTLKBDOSA-N	427.973	1.191	50	20	IDGD	
COc1ccnc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)c1	1837956289	RSSUXIGDQOYYMB-RBUKOAKNSA-N	446.331	1.397	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cc(C)nc(O)c3)CC2)CC1	1838090174	FZFXRXLKIWDJOY-SFHVURJKSA-N	439.940	1.962	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(O)c(OC)c3)CCO2)C1	1838974760	YWGFGCZEXBKMBI-MGPUTAFESA-N	426.897	1.488	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)c(C)c1	1839026269	PTMGNKYJZGLBCA-LJQANCHMSA-N	431.316	1.877	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cncn3-c3ccncc3)C2)C1	1839142768	AHBPWQSKVNMCSM-UTKZUKDTSA-N	447.923	1.355	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)C3=NO[C@H](c4ccccc4)C3)C2)C1	1839144598	FWAYTMXDZQMAIQ-LQBOVUBWSA-N	449.935	1.978	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(F)c(OC)c3)C2)C1	1839148651	FKGFAWTUEZBNEF-QRWLVFNGSA-N	428.888	1.922	50	20	IDGD	
CN(C)c1ncc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)o1	1839151604	XTPHOYQBFGJCQR-MSOLQXFVSA-N	449.335	1.047	50	20	IDGD	
CN(C)c1ncc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)o1	1839151607	XTPHOYQBFGJCQR-ZWKOTPCHSA-N	449.335	1.047	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)cn1C	1839153450	YWFLPVYOYZNGFW-MOPGFXCFSA-N	432.348	1.640	50	20	IDGD	
Cc1cccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)n1	1839197747	HLWZYNBKCYBQHM-YOEHRIQHSA-N	430.274	1.151	50	20	IDGD	
Cc1cc(F)cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCBr)C3)C2)c1	1839283988	NSLBXOFNRTWZNQ-LJQANCHMSA-N	443.313	1.989	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C13CC(C(=O)OC)(C1)C3)CCO2	1840004822	QWXQHFFHLKJWSM-SDDUFFJTSA-N	442.940	1.194	50	20	IDGD	
Cc1cscc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2	1840033000	QFRIYVFIBZHKRO-DYVFJYSZSA-N	431.352	1.910	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(N(C)C)c3)C2)C1	1840154410	WPKGMKYNOPXQQL-NQIIRXRSSA-N	439.940	1.076	50	20	IDGD	
CO[C@@H](C(=O)N1CCOC[C@]2(CN(C(=O)C(Cl)Cl)CCO2)C1)c1ccccc1	1840188028	KLUJPAHSUGDJGC-DNVCBOLYSA-N	431.316	1.634	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCCn3ccnc3)CCO2)C1	1840383266	NWWDLWLGNJIMLF-XLIONFOSSA-N	426.945	1.527	50	20	IDGD	
Cc1ccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)o1	1840508490	COWWLZGSXXSQNY-RDTXWAMCSA-N	429.311	1.370	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)/C=C/c3cnc(C)s3)CCO2)C1	1840520271	XELFNZBQFRUHKZ-BSCWQEJHSA-N	427.954	1.939	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)[C@@H]2C[C@H]2c2ccc(F)c(F)c2)C1	1841397684	UZEMRVWNQRPYLZ-ZWKOTPCHSA-N	440.255	1.265	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2nc3ccccn3c2C)C1	1843657240	PTUTVYWKEJLHJO-CVKSISIWSA-N	447.499	1.594	50	20	IDGD	
Cn1nc(C(=O)N2CC3(CCCN3C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)cc1O	1845870627	IVERMHRXPILBOM-VGOFMYFVSA-N	427.411	1.828	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@H](C)NC(=O)OCc2ccccc2)C1	1846166632	UUUSRUWKJSJJLA-NVXWUHKLSA-N	437.924	1.759	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H]2C[C@@]21C(=O)N1CCCC12CN(C(=O)[C@H](O)CCl)C2	1846187591	FZWUGINLYIGDSK-JZKQVHKSSA-N	427.929	1.189	50	20	IDGD	
CCc1nn(C)c(C(=O)N2CC3(CCCN3C(=O)[C@H](Cl)COC)C2)c1Br	1846361738	MIFNWVVDBWATJS-LLVKDONJSA-N	447.761	1.816	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)Cc1cccc(C(F)(F)F)c1)C2	1846385840	CEYRDRQQYLJGNU-UHFFFAOYSA-N	440.466	1.824	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)[C@H]1CC[C@H](C(F)(F)F)CC1)C2	1846386336	AZSZUNQDDXPUKR-SHTZXODSSA-N	432.487	1.932	50	20	IDGD	
C[C@@H](C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C1(O)CCC1	1847253506	KLTOFOPWWRNUIW-VGWMRTNUSA-N	443.972	1.871	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1nc(O)n2c1CCCC2	1847498337	BWYFEOIHWJHWTO-AVGNSLFASA-N	425.327	1.771	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)/C=C/C(=O)NCc1ccco1	1847499390	YIVZMEAMGNMYQP-UQOCBMMUSA-N	438.322	1.685	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1ncc(F)cc1F	1847930222	DTUSXTMVQCARSR-AERCPGEASA-N	430.415	1.309	50	20	IDGD	
CCn1c(NNC(=O)c2cc(S(=O)(=O)NC)ccc2Cl)nc2ccccc2c1=O	11165061	FXNMSRGOVFGGJP-UHFFFAOYSA-N	435.893	1.735	50	20	IDGD	
O=C(CCNC(=O)NC12CC3CC(CC(C3)C1)C2)NNC(=O)[C@@H]1COc2ccccc2O1	15794961	CSMFUWJJRFWCSZ-HAVBXNNZSA-N	442.516	1.632	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)c2ccc([N+](=O)[O-])c(O)c2)cc1	25444697	JPLZLVGXHCKVTI-UHFFFAOYSA-N	428.430	1.796	50	20	IDGD	
CCCCS(=O)(=O)N1CCC(C(=O)NNC(=O)CNc2ccccc2OC)CC1	108098652	WHICGRQZFKASPR-UHFFFAOYSA-N	426.539	1.096	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c2c(C)n[nH]c2n1	725879053	WCYVKVNTFRFCPF-UHFFFAOYSA-N	442.501	1.434	50	20	IDGD	
CC(=O)N1CCN(c2ccccc2CNC(=O)NNC(=O)Cc2ccc(F)cc2)CC1	726274249	OITLVSPOUAXKKH-UHFFFAOYSA-N	427.480	1.567	50	20	IDGD	
COC(=O)C[C@@H]1c2cc(OC)c(OC)cc2CCN1CC(=O)NNC(=O)c1cccs1	727238163	GEYIDXRKAOBLHV-OAHLLOKOSA-N	447.513	1.689	50	20	IDGD	
CCc1ccccc1OCC(=O)NNS(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2	728261279	PQCRMAZPKVFUHB-UHFFFAOYSA-N	437.430	1.317	50	20	IDGD	
COc1cccc2c1OCC[C@H]2NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1	728951365	HTPXQRSSTYIEJM-MRXNPFEDSA-N	426.477	1.556	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NN=Cc2ccc(OC(F)(F)C(=O)O)cc2)ccc1Cl	730726686	BMSQOEIOQSKZFH-UHFFFAOYSA-N	447.803	1.808	50	20	IDGD	
CN(C)C(=O)CN1CCC(NC(=O)NNC(=O)c2ccc(F)cc2Br)CC1	731761801	GADVWDYLBXBTKS-UHFFFAOYSA-N	444.305	1.085	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Cn2cc(C(N)=O)c3ccccc32)cc1Br	732033341	CKUABUZTWPPDSG-UHFFFAOYSA-N	445.273	1.973	50	20	IDGD	
COC(=O)c1cc(OC(=O)C2=NN(c3ccc(F)cc3)[C@H](C(N)=O)C2)ccc1[N+](=O)[O-]	732652777	PTZCPWSAZNBQDN-INIZCTEOSA-N	430.348	1.546	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)N1CCN([C@H]2CCN(c3ccccc3)C2=O)CC1	732998577	MTGOZKYGHMIDFL-IBGZPJMESA-N	437.500	1.473	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCN(C(=O)c3c(C)nn(CCCl)c3C)CC2)cc1	733873391	MCRVISJTQNWZTD-UHFFFAOYSA-N	440.953	1.894	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)[C@H]1CCCC[C@H]1C(=O)N1CCCC1	734241595	RIXBEQUMMKGIRA-LSDHHAIUSA-N	425.530	1.270	50	20	IDGD	
CC(C)C(CNC(=O)c1ccc([N+](=O)[O-])cc1)=NNC(=O)CNC(=O)c1cccs1	734748040	IHWKKYBHVUBZKV-UHFFFAOYSA-N	431.474	1.944	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN(C(=O)COc2ccccc2)C1)c1cnn(-c2ccccc2)c1	741188881	OOCWGDWSOFYLFT-GOSISDBHSA-N	447.495	1.951	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Cc2cccc([N+](=O)[O-])c2)c1	742032546	MOOAXTVZRYFWGY-UHFFFAOYSA-N	434.474	1.629	50	20	IDGD	
CN(CCCC(=O)NNC(=O)c1ccc(Cl)nc1)C1=NS(=O)(=O)c2ccccc21	742048451	NNPHMXCEPZYYEI-UHFFFAOYSA-N	435.893	1.357	50	20	IDGD	
CCn1c(NNC(=O)[C@@H]2CCCCN2C(=O)c2ccc(O)nn2)nc2ccccc2c1=O	742243213	OTLSMMJRLBPPGH-INIZCTEOSA-N	437.460	1.050	50	20	IDGD	
CC(C)(C)c1nc2ccc(S(=O)(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)cc2s1	743250644	GWIQPDSVNCZBKP-SNVBAGLBSA-N	431.561	1.338	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)Cn2cnc3sccc3c2=O)cc1Cl	743834560	KSBVQRIUOYHVQF-UHFFFAOYSA-N	437.865	1.982	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1ccccc1-n1cccn1	744619233	KXNLWSSOXJAKSO-UHFFFAOYSA-N	427.486	1.650	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(CCNC(=O)NNC(=O)c2ccc3ccccc3n2)CC1	744896135	LDUNOYPTJDMODI-UHFFFAOYSA-N	442.520	1.732	50	20	IDGD	
C[C@H](CC(=O)OCC(=O)NNC(=O)c1cccc(C#N)c1)S(=O)(=O)c1ccc(F)cc1	744957770	OGTBVLJPWJPFPF-CYBMUJFWSA-N	447.444	1.254	50	20	IDGD	
CCO[C@H](C)c1ncc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)s1	745449684	SAZVUIFGYLZQOI-RISCZKNCSA-N	435.458	1.385	50	20	IDGD	
COc1cccc2c1OC[C@H](NC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)C2	745801036	JRYKYQGKJCDARF-CQSZACIVSA-N	434.474	1.438	50	20	IDGD	
Cc1c(C(=O)NNC(=O)Cc2cn3ccccc3n2)nnn1-c1cccc2ncccc12	746548106	DBJXQKPWWRLKJS-UHFFFAOYSA-N	426.440	1.775	50	20	IDGD	
C[C@@H](CCNC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)N(C)Cc1ccccc1	746774723	RYLGNFZWXWBTAO-INIZCTEOSA-N	432.546	1.945	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(Cl)s1)NNC(=O)c1ccc(Cl)cc1F	747431808	PRIKLSUXMBTSGZ-UHFFFAOYSA-N	426.278	1.934	50	20	IDGD	
O=C(NNc1ccc(F)cc1Br)C1CCN(c2ccc3nnnn3n2)CC1	748074747	APNLOLRHVPGELK-UHFFFAOYSA-N	435.261	1.781	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCCN1C(=O)/C=C/c1ccc(Cl)cc1)C(=O)N1CCCC1	748239191	FEWZJXXOYAEHJQ-YRYLYKBFSA-N	432.908	1.504	50	20	IDGD	
COc1ccc(-c2nc(C)c(C(=O)NNC(=O)CNC(=O)c3ccco3)s2)cc1OC	751201749	KYMSWVVLKKQZOL-UHFFFAOYSA-N	444.469	1.920	50	20	IDGD	
CC(C)CCOc1ccc(S(=O)(=O)NNC(=O)CNC(=O)c2cccs2)cc1	751280885	VVXPUWSOHGSDQB-UHFFFAOYSA-N	425.532	1.913	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNS(=O)(=O)c1cc(Br)ccc1F	751283192	UXQODLBQQXHJDD-UHFFFAOYSA-N	436.284	1.389	50	20	IDGD	
C[C@@](O)(C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)c1cccc(C(F)(F)F)c1	754838039	QQKKPQUARDWVTI-KRWDZBQOSA-N	430.404	1.778	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)C(O)(c1ccccc1)c1ccccc1	755012673	MJYMKYHAMKFDDI-UHFFFAOYSA-N	428.489	1.778	50	20	IDGD	
CNS(=O)(=O)c1cc(NC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)ccc1C	755515457	MLQLOZYYDPNOEG-UHFFFAOYSA-N	428.474	1.555	50	20	IDGD	
COCCOC(=O)Nc1cccc(NC(=O)NNC(=O)COc2ccc(C#N)cc2)c1	756220552	IMYDWZXHAQBFQB-UHFFFAOYSA-N	427.417	1.985	50	20	IDGD	
CN1CCCN(S(=O)(=O)c2cccc(NC(=O)NNC(=O)CC(C)(C)C)c2)CC1	756361452	ZYOPCVNPUNJPIK-UHFFFAOYSA-N	425.555	1.602	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(F)c(NC(=O)NNC(=O)c2nnc(O)c3ccccc23)c1	756681533	CRFLFSKFHSPBTC-UHFFFAOYSA-N	448.436	1.191	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)Nc2ccc(C[C@H]3CC(=O)NC3=O)cc2)cc1OC	756817141	WHFRITSTWMEEIJ-HNNXBMFYSA-N	440.456	1.766	50	20	IDGD	
COc1cc(N2C[C@H](C(=O)NNc3ncccc3[N+](=O)[O-])CC2=O)cc(OC)c1OC	759298170	URDBNISGSMPNHP-LLVKDONJSA-N	431.405	1.512	50	20	IDGD	
CCO[C@@H]1C[C@H](NC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)[C@@]12CCCO2	759322799	QYFFVWBKKBCGIB-DAYGRLMNSA-N	426.495	1.152	50	20	IDGD	
C[C@]1(c2ccccc2)CN(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)CCO1	759718759	PEZAUKVTTDTJRD-HXUWFJFHSA-N	431.518	1.582	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)c1cccnc1OCC(F)F	760222805	CTTDOBYLZMCPQG-UHFFFAOYSA-N	433.459	1.699	50	20	IDGD	
O=C(NNc1ncc(F)cn1)c1cccc(NS(=O)(=O)c2ccc3nnn(O)c3c2)c1	760912688	XFONLAIGTCXGIM-UHFFFAOYSA-N	444.408	1.155	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)c1ccc(I)c(O)c1	760930553	LUQNPVWPTILLES-UHFFFAOYSA-N	435.218	1.283	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCC[C@H]1C(=O)NNC(=O)c1ccccc1F)c1ccccc1F	761134826	CBSZETRQSVKQAM-ZIAGYGMSSA-N	444.438	1.993	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)c1cccc(S(=O)(=O)NCC2CC2)c1	761637780	UNKRZRDDMMEVNT-UHFFFAOYSA-N	449.554	1.937	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCCCN(C)C)cc1C(=O)NNC(=O)c1ccc(C#N)cc1	762166679	BBXWJUOINHAHAL-UHFFFAOYSA-N	443.529	1.172	50	20	IDGD	
Cc1c(C=NNC(=O)CNC(=O)c2cccnc2)c(=O)n2c([nH]c3ccccc32)c1C#N	763204814	RPYIZSMXTQEBKT-UHFFFAOYSA-N	427.424	1.236	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2cc3ccccc3cc2O)cc1NC(C)=O	763517368	IQTYAKSFIVOACX-UHFFFAOYSA-N	436.424	1.912	50	20	IDGD	
O=C(NNC(=O)c1c[nH]c2ccccc12)C(=O)Nc1cccc(OCC(=O)N2CCCC2)c1	763541289	SAHCAQVDUSKNCP-UHFFFAOYSA-N	449.467	1.569	50	20	IDGD	
CSc1cc2c(cc1NC(=O)C(=O)NNC(=O)c1ccc3c(c1)OCO3)OCCO2	763548150	KYYPWRIBPIHHFA-UHFFFAOYSA-N	431.426	1.308	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2ccc(Cl)c(C(=O)N(C)C)c2)c1	763645850	ZNXKLSGKXVSNPC-UHFFFAOYSA-N	446.891	1.824	50	20	IDGD	
C[C@@H]1Oc2ccc(NC(=O)C(=O)NNC(=O)COc3ccc(Cl)cc3)cc2NC1=O	763686936	XGYOMTICZZMNOQ-JTQLQIEISA-N	432.820	1.224	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccc(N2CCOC2=O)cc1	763851950	WMFMLZRDDLGGFR-GFCCVEGCSA-N	430.392	1.336	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)C(=O)Nc1cnc2c(c1)COCC2	763854622	SDXHMHNANRVKCT-AWEZNQCLSA-N	434.452	1.861	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1cc2c(cc1Cl)OCCO2	763864639	DSCUGGRIJILEIT-SNVBAGLBSA-N	437.811	1.804	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccccc2C[S@@](C)=O)cc1	763867177	SLCXEWDRXYZINQ-AOYOOGHLSA-N	447.513	1.517	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cnn(-c3ccccc3)n2)cc1	763878018	OBNKHZZPPSTISM-CQSZACIVSA-N	436.428	1.023	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc(CN2C(=O)CSC2=O)cc1	763958289	UUWPLVRZKMJJLP-UHFFFAOYSA-N	426.454	1.590	50	20	IDGD	
CCN(CC)C(=O)COc1ccc(NC(=O)C(=O)NNC(=O)c2ccc[nH]2)cc1Cl	763980350	RXJHWBJRGBIDJS-UHFFFAOYSA-N	435.868	1.315	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(OC3CCCC3)cc2)c1	764076591	CBJDGYFRUNPQQS-UHFFFAOYSA-N	445.497	1.811	50	20	IDGD	
O=C(CC1CCCC1)NNC(=O)C(=O)Nc1ccc(NC(=O)NC[C@H]2CCCO2)cc1	764178472	AGGOGMIJXBYFOF-QGZVFWFLSA-N	431.493	1.653	50	20	IDGD	
Cc1cnn(Cc2cc(F)ccc2F)c1NC(=O)C(=O)NNC(=O)Cc1ccccn1	764264047	MHXRSVBHSFNLEQ-UHFFFAOYSA-N	428.399	1.242	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(C(=O)N2CCCC[C@H]2C)cc1C	764399937	NYIDUTQUISMGSX-HZPDHXFCSA-N	448.520	1.147	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)[C@H](C)S(=O)(=O)C2CCOCC2)cc1OC	764576482	ZLJCOQAMLMXIJB-ZDUSSCGKSA-N	428.507	1.227	50	20	IDGD	
CC(=NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1)c1ccc(F)cc1O	764814943	APHFLZUNWRNRQU-UHFFFAOYSA-N	448.520	1.686	50	20	IDGD	
CCN1C(=O)C(=NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)c2cc(C)ccc21	764818384	KJANOSKOAJOQLY-UHFFFAOYSA-N	433.512	1.640	50	20	IDGD	
CC1CCN(S(=O)(=O)c2ccc(NC(=O)C(=O)NNC(=O)OC(C)(C)C)cc2)CC1	765385628	DHGCFYMQAHHBSV-UHFFFAOYSA-N	440.522	1.602	50	20	IDGD	
COCCS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)cc1	765570077	RCDNRQNYNRACOC-UHFFFAOYSA-N	434.499	1.633	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2nc(C)cc(C)n2)c(I)c1	765699504	UEYUTURBSQGSTN-UHFFFAOYSA-N	441.229	1.788	50	20	IDGD	
CN(C)[C@@H](C(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1)c1ccccc1	766659918	JFYROHJDZKZZHP-JOCHJYFZSA-N	443.979	1.908	50	20	IDGD	
NC(=O)c1ccc(C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)cc1	766659933	JXVAHVLKJOUFGJ-UHFFFAOYSA-N	429.908	1.018	50	20	IDGD	
COc1ccc(NNC(=O)c2cc(S(=O)(=O)N3CCSCC3)c[nH]2)c([N+](=O)[O-])c1	768328071	PXSVDBTWBVOCCA-UHFFFAOYSA-N	441.491	1.426	50	20	IDGD	
COc1ccc(NNC(=O)Cn2c(=O)ccn(Cc3ccccc3)c2=O)c([N+](=O)[O-])c1	768331701	LZFZYONCSNAOAN-UHFFFAOYSA-N	425.401	1.118	50	20	IDGD	
COc1cccc(-c2nnc(SCC(=O)NNC(=O)Cc3ccccc3C)n2N)c1	768435471	WFADXDISZDYQNJ-UHFFFAOYSA-N	426.502	1.458	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1	768644533	FHIKIVQZEORHCS-UHFFFAOYSA-N	431.430	1.950	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1cnn(-c2ccccc2)c1C(F)(F)F	769266276	MRRLPNSKBRQRPL-NSHDSACASA-N	443.382	1.029	50	20	IDGD	
COc1cccc(-n2c(C)nnc2SCC(=O)NNC(=S)NCCSC)c1	770238617	BFYPDZMTUYEYED-UHFFFAOYSA-N	426.593	1.535	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N2CCO[C@H](COC(C)C)C2)cc1Br	770403799	LVDDEKQIUVROIM-ZDUSSCGKSA-N	430.299	1.938	50	20	IDGD	
CON(C)C(=O)[C@H](CCSC)NC(=O)NNC(=O)[C@@H](C)Oc1cccc(Cl)c1	770543078	FJQBRABEFKRKMC-RISCZKNCSA-N	432.930	1.579	50	20	IDGD	
Cc1cn(-c2ccccc2)nc1C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	771415732	NBDHZGKJFQCSGJ-UHFFFAOYSA-N	446.511	1.400	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)[C@H](CC(C)C)N1C(=O)[C@H]2CC=CC[C@@H]2C1=O	771851712	CJMJQHVOSRDNNX-QAETUUGQSA-N	435.521	1.478	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1cccc(S(=O)(=O)N[C@@H](C)c2ccccc2)c1	771936817	BRKDWAJWLUVFKN-GJZGRUSLSA-N	447.513	1.829	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)[C@H]1CCCN(C(=O)c2ccccc2OC(F)F)C1	771987639	GHOPILFXEONMPD-OLZOCXBDSA-N	441.431	1.629	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1ccc([N+](=O)[O-])cc1I	772069405	PNEHHHQMGODUNE-ZETCQYMHSA-N	435.174	1.302	50	20	IDGD	
NC(=O)c1cc(OC2CCN(CC(=O)NNC(=O)c3ccccc3Cl)CC2)ccn1	772333232	PJSSOJZDRQPPQJ-UHFFFAOYSA-N	431.880	1.138	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)c3cnn(CC(=O)NC4CCCC4)c3)n[nH]2)cc1	772422791	UYESZSVIWAWHGR-UHFFFAOYSA-N	435.488	1.715	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@@H](C(C)C)N2CCCS2(=O)=O)cc1Br	772691680	BTNUKHPBZUUJAR-CQSZACIVSA-N	448.339	1.279	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)C1=NN(c2ccccc2)C(=O)CC1	772898893	VCJDPFVTJJHUDA-UHFFFAOYSA-N	427.848	1.287	50	20	IDGD	
CCOc1ccc2c(c1)[C@@H](NC(=O)NNC(=O)C1CCN(c3ncccn3)CC1)CCO2	773273503	OFXLPEGYKASRKX-SFHVURJKSA-N	440.504	1.946	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cc(C(F)(F)F)ccn2)cc1	773530064	SZDPDIKHHIBRDA-NSHDSACASA-N	438.362	1.856	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2cnc3ccccc3n2)cc1-n1nnnc1C1CC1	773716625	LTZCNSYOPWHOOE-UHFFFAOYSA-N	445.443	1.573	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)N[C@H]3CCN(c4ccccc4C(F)(F)F)C3)nc21	776265265	PZZUIDWBHKGUMK-JTQLQIEISA-N	436.398	1.993	50	20	IDGD	
CCOC(=O)N1CCC[C@@H]([C@@H](C)NCC(=O)NNC(=O)c2ccc(OC)c(OC)c2)C1	776823226	MMMIJKRCOARJRZ-GDBMZVCRSA-N	436.509	1.311	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(C(=O)NNC(=O)c2ccc(Br)s2)n(C)c1	778540422	SXVYLSPQZKWSNA-UHFFFAOYSA-N	435.325	1.174	50	20	IDGD	
CCNC(=O)CC(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccc(C)cc2C)c1	780848657	DJJQJSUZLMDVSE-UHFFFAOYSA-N	432.502	1.391	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)CSc2ccccc2OC)c(OC)c1	782125172	WTXZKBHCMFYNND-UHFFFAOYSA-N	447.469	1.369	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNS(=O)(=O)c2cc(F)cc(C(=O)OC)c2)cc1	782250527	YEDALBHXTWQICN-LBPRGKRZSA-N	440.449	1.788	50	20	IDGD	
CCCOc1ccc(NC(=O)C(=O)NNC(=O)c2csc(N3CCOCC3)n2)c(C)c1	782896484	JEOVHDHJDDCHEP-UHFFFAOYSA-N	447.517	1.477	50	20	IDGD	
CCc1ccc(NC(=O)C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)cc1C	782898348	ZQAXJGGIYVPSEE-UHFFFAOYSA-N	431.518	1.559	50	20	IDGD	
O=C(NNc1cncc(Cl)n1)C(=O)Nc1ccc(-n2nccn2)cc1C(F)(F)F	783265053	BYGKUXAPUULYRI-UHFFFAOYSA-N	426.746	1.811	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)c(C)n1	783407800	FPHYJNVCVAPHHK-UHFFFAOYSA-N	432.380	1.774	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2cnn(CC(=O)NC3CC3)c2)ccc1Br	783923381	JWQHGSMXXIVZOL-UHFFFAOYSA-N	435.282	1.314	50	20	IDGD	
CN1CCC/C1=N/S(=O)(=O)c1cccc(NC(=O)C(=O)NNc2ccnc(F)c2)c1	784851644	FHHVOZCLLRYEJS-JLPGSUDCSA-N	434.453	1.115	50	20	IDGD	
O=C(NNc1c(F)cc(C(=O)NC2CC2)cc1F)C(=O)Nc1ccc(-n2ccnc2)nc1	785100728	YFFQZJGPSUDGDM-UHFFFAOYSA-N	441.398	1.520	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O	785408478	UJFASQRDKOXEEO-SNVBAGLBSA-N	441.487	1.357	50	20	IDGD	
CC(C)(C)c1cnc(CCC(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)o1	786205431	BWEIPXSQNOXBTK-HNNXBMFYSA-N	431.445	1.435	50	20	IDGD	
C[C@H]1[C@H](C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)CCN1C(=O)OC(C)(C)C	786257416	VSWRALPQNSIVPD-SWLSCSKDSA-N	425.507	1.497	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1ccc(-c2ccco2)cc1F	787555439	MVHLDNUDNKTNIR-UHFFFAOYSA-N	430.417	1.663	50	20	IDGD	
CN1CCN(C(=O)NNC(=O)Cc2ccc(NS(=O)(=O)c3cccs3)cc2)CC1	788165567	CSSSYIAHPTWTKK-UHFFFAOYSA-N	437.547	1.080	50	20	IDGD	
COCc1cccc(S(=O)(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)c1	788916843	RPRFLFFLOPRSOZ-UHFFFAOYSA-N	442.538	1.631	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)NC[C@H](Cc2cccc(F)c2)C(=O)N2CCOCC2)o1	789308201	ALJPQEJKRIAXRZ-INIZCTEOSA-N	432.452	1.389	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(C(=O)CCC(=O)NNc3ncccc3C)CC2)cc1	791212084	OZHFPZVDYAWFHU-UHFFFAOYSA-N	445.545	1.455	50	20	IDGD	
COc1ccc(OC)c(C2=NO[C@@H](C(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)C2)c1	791512630	LKBNPXDGDZTCOE-GOSISDBHSA-N	447.469	1.062	50	20	IDGD	
CNC(=O)c1cc2cc(NC(=O)C(=O)NNc3ccc(Br)cn3)ccc2[nH]1	792364488	OCCVDNMXUXRHSD-UHFFFAOYSA-N	431.250	1.767	50	20	IDGD	
Cc1cc(C(=O)N2CCC[C@H](C)C2)ccc1NC(=O)C(=O)NNc1nc2ccccn2n1	792392123	SKSDLLSTNZHALZ-AWEZNQCLSA-N	435.488	1.992	50	20	IDGD	
COc1cc(C(F)(F)F)ncc1NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	792512316	VJIDDSVZWQUJLQ-UHFFFAOYSA-N	436.350	1.822	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)Cc2ccc(C(N)=O)cc2)c2ccccc2c1=O	792569915	ZPLKLAUQEQJQKK-UHFFFAOYSA-N	435.484	1.689	50	20	IDGD	
CCc1onc(-c2ccccc2Cl)c1C(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1	793177576	VBPMHDNZWUCNQW-JTQLQIEISA-N	426.882	1.689	50	20	IDGD	
Cc1cc(C)c(S(=O)(=O)NNC(=O)CNC(=O)OCc2ccccc2)cc1[N+](=O)[O-]	794596566	ISKJKKAINZSRAW-UHFFFAOYSA-N	436.446	1.448	50	20	IDGD	
C[C@@H]1CN(c2ccc(C(=O)NNc3ccccc3S(=O)(=O)N(C)C)cn2)C[C@@H](C)O1	795177589	NDQAHGLOJMZFDK-HUUCEWRRSA-N	433.534	1.702	50	20	IDGD	
Cc1ccc([C@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)cc1	797711345	JQLLDYZCDDFOMK-CABCVRRESA-N	440.522	1.078	50	20	IDGD	
Cc1cn(-c2ccc(Cl)cc2)nc1NC(=O)C(=O)NNC(=O)c1ccc2c(c1)OCO2	799257437	KWFXFEKABGJDOF-UHFFFAOYSA-N	441.831	1.963	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCC[C@@H](CCNC(=O)OC(C)(C)C)C2)n1	799358987	ROZCQXYTCYAREW-HNNXBMFYSA-N	439.582	1.768	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCCCNC(=O)/C=C/c2ccccc2)cc1OC	799861468	SYEGUNCFRCEVPY-FMIVXFBMSA-N	426.473	1.868	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2CC(=O)N(C)[C@@H]2c2cccc(Cl)c2)cc1	801108371	MJWAMOWYQNBXFU-FUHWJXTLSA-N	428.876	1.954	50	20	IDGD	
O=C(CNS(=O)(=O)c1c[nH]c2ncccc12)NNc1ccc(Br)cc1F	802825442	PIAUHAJCVZTNCI-UHFFFAOYSA-N	442.270	1.886	50	20	IDGD	
O=C(NNc1ccc2c(=O)[nH]ccc2c1)c1cccc(S(=O)(=O)N2CCOCC2)c1	803432217	NMIGPQUXSIOQKV-UHFFFAOYSA-N	428.470	1.306	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)[C@@H]1CCN(c2ccc(C#N)cc2F)C1	804527128	OYUUSNNMMZKNIM-OAHLLOKOSA-N	433.484	1.976	50	20	IDGD	
O=C(NCCCN1C(=O)c2ccccc2C1=O)NNC(=O)c1cc(Br)c[nH]1	804869485	RRHKGCMUVUHIMM-UHFFFAOYSA-N	434.250	1.408	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)C(=O)c1ccc(O)cc1	807093892	PNSVACWCOZFVGT-UHFFFAOYSA-N	430.892	1.194	50	20	IDGD	
CCCNS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2nccnc2C2CCC2)cc1	807460642	SYIOWLNIZOUBDY-UHFFFAOYSA-N	432.506	1.514	50	20	IDGD	
COc1cc(NC(C)=O)c(Cl)cc1S(=O)(=O)NNC(=O)COCc1ccccc1	808093487	PCIVLUDEWRJGEB-UHFFFAOYSA-N	441.893	1.833	50	20	IDGD	
O=C(NNc1c(F)cc(C(=O)NC2CC2)cc1F)C(=O)Nc1cccc2c1COC2=O	808939395	QNLBYMQCPFKUTE-UHFFFAOYSA-N	430.367	1.609	50	20	IDGD	
CC[C@@H]1[C@H](C(=O)NNC(=O)CCN2C[C@H](C)O[C@H](C)C2)CCN1C(=O)OC(C)(C)C	809981610	QWHVOKKYEGDAET-YYIAUSFCSA-N	426.558	1.669	50	20	IDGD	
COC(=O)c1c(F)ccc(NC(=O)C(=O)NNC(=O)c2cccc3ncccc23)c1F	810387344	ROHXKNCLSBPFQB-UHFFFAOYSA-N	428.351	1.699	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)Cc2sc(N3CCOCC3)nc2-c2ccccc2)n[nH]1	810584068	LQDDBWXMNRKRHZ-UHFFFAOYSA-N	426.502	1.682	50	20	IDGD	
Cc1nc2c(C#N)cnn2c(C)c1CCC(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	812730339	FCFJDYQWVFKJLF-UHFFFAOYSA-N	441.517	1.544	50	20	IDGD	
O=C1CN(Cc2cccc(NC(=O)C(=O)NNc3cccc(C(F)(F)F)c3)c2)CCN1	812981352	WLIUTDDZLNSESF-UHFFFAOYSA-N	435.406	1.719	50	20	IDGD	
Cc1nn(C)c2cc(NC(=O)C(=O)NNc3ccc(S(=O)(=O)N(C)C)cc3)ccc12	813033376	QLRQOAQMDHCFNW-UHFFFAOYSA-N	430.490	1.214	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCc2nncn2C1)C(=O)Nc1ccccc1Oc1cccc(F)c1	815691530	SSPJLEZIXAAKDX-ZDUSSCGKSA-N	438.419	1.558	50	20	IDGD	
CC[C@H](C)NS(=O)(=O)c1cccc(NC(=O)C(=O)NNc2cccc(Cl)n2)c1	815726136	QGALNKTVSCHQBY-NSHDSACASA-N	425.898	1.894	50	20	IDGD	
CC(C)N(C)S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2cccc(Cl)n2)cc1	815726683	PNRMEMAOAYSAJZ-UHFFFAOYSA-N	425.898	1.846	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1ccc(-c2ncco2)cc1	815750813	KUYZALLKLDSKPN-UHFFFAOYSA-N	429.458	1.674	50	20	IDGD	
CCc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NNc1ccccc1S(=O)(=O)N(C)C	815751603	GJUBRUGJJZXITH-UHFFFAOYSA-N	435.462	1.489	50	20	IDGD	
Cc1nc(S(=O)(=O)N2CCC(C(=O)NNc3nc4ccccc4n3C)CC2)cn1C	816577689	WIYWVXFXAVQKBJ-UHFFFAOYSA-N	431.522	1.159	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@H]1CCN(Cc2ccccc2)C1	816828502	HNDZIWIYUOBXJG-KRWDZBQOSA-N	429.546	1.571	50	20	IDGD	
CCCn1c(=O)nc(O)c2c(C(=O)NNC(=O)C(C)(OCC)OCC)cc(C(C)C)nc21	819727744	JEZHCJYNTUNBBY-UHFFFAOYSA-N	449.508	1.581	50	20	IDGD	
CC[C@@]1(C)NC(=O)N(CC(=O)NNC(=O)c2ccccc2OCc2ccc(F)cc2)C1=O	863987329	QZMCPGNYPUAXNV-JOCHJYFZSA-N	442.447	1.886	50	20	IDGD	
CSCC[C@H](NC(=O)c1ccccc1Br)C(=O)N1CC[C@@H](B(O)O)C1	864233172	HPXPFUGESSLOQI-RISCZKNCSA-N	429.145	1.376	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)CN1C(=O)N[C@](C)(c2ccc(C)cc2)C1=O	871635780	XVGPPPOEZWZIMN-HSZRJFAPSA-N	438.484	1.551	50	20	IDGD	
CCNS(=O)(=O)c1cccc(C(=O)NNC(=O)Cn2c(CC)nc3ccccc32)c1	915776219	FIGWUDZNFBFUCU-UHFFFAOYSA-N	429.502	1.358	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)NCc2ccccc2CN2CCOCC2)cc1C	915926689	AVFONHIJGIXOOB-UHFFFAOYSA-N	439.516	1.605	50	20	IDGD	
CCOc1ncccc1CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	916400660	RLMPNFDLUOLPJO-UHFFFAOYSA-N	447.517	1.409	50	20	IDGD	
Cc1cccc([C@@H](CNC(=O)NNC(=O)[C@H]2COc3ccccc3O2)N2CCOCC2)c1	916435369	AESRMOURPHCJKL-WIYYLYMNSA-N	440.500	1.539	50	20	IDGD	
CC(C)N1C(=O)c2ccc(C(=O)NNC(=O)c3cccc(N(C)C)c3)cc2S1(=O)=O	916740854	DSLQVTWJXDEKLK-UHFFFAOYSA-N	430.486	1.380	50	20	IDGD	
CN(CCCNC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)c1ccccc1F	918130019	CGAGNHUIUVTUJB-UHFFFAOYSA-N	426.452	1.543	50	20	IDGD	
Cc1ccc([C@@H](C)NC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)cc1	918233612	IYUYZHKDWORYAM-MRXNPFEDSA-N	432.550	1.713	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)[C@@H]2CCCN(S(=O)(=O)c3ccc([N+](=O)[O-])cc3)C2)n1	919810180	FDCYYDAJSGXBOZ-CQSZACIVSA-N	434.478	1.546	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)CSCc2cc(=O)n3ccsc3n2)cc1	919834108	LGCUOZWEQIMGKS-UHFFFAOYSA-N	432.527	1.778	50	20	IDGD	
CCNC(=O)CNC(=O)/C(C#N)=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	920852814	XDTDTIMTASDEHD-ZROIWOOFSA-N	428.880	1.238	50	20	IDGD	
CC(=O)NC1(c2noc(CCC(=O)NNC(=O)NCc3ccco3)n2)CCCCCC1	920855958	SRLYFBNBXDJCFN-UHFFFAOYSA-N	432.481	1.811	50	20	IDGD	
O=C(NNC(=O)[C@H]1CS[C@H](Cc2ccccc2F)C(=O)N1)c1ccc2ccccc2n1	935742360	HMWCSKUYIMCRQZ-RTBURBONSA-N	438.484	1.978	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@@H]2CCCN(S(=O)(=O)Cc3ccccc3)C2)cc1	1318318361	LUYTUQLHNREUCA-GOSISDBHSA-N	431.514	1.698	50	20	IDGD	
CC[C@H](N=c1nn[nH]n1-c1ccccc1)C(=O)NNC(=O)Nc1cc(OC)ccc1Cl	1321309995	MYSQCPDZHLFANE-HNNXBMFYSA-N	444.883	1.790	50	20	IDGD	
O=C(NNc1cccnn1)C1CCN(S(=O)(=O)c2ccc(Br)s2)CC1	1325255026	MHQOJEXITMBXDL-UHFFFAOYSA-N	446.352	1.845	50	20	IDGD	
CCC[C@H](C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2)n1cccc1	1778041336	CRHBZEMJXGERCJ-BMQTXXJKSA-N	425.957	1.943	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc4ncccn4n3)C2)C1	1778464924	BYNMHMRIMMHXMK-QZTJIDSGSA-N	426.304	1.409	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4ncncc4c3)C2)C1	1778605455	UEAHWPWNVNDMTO-DJJJIMSYSA-N	433.306	1.857	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](C)N3C[C@H]4C[C@@H]4C3)C2)C1	1778853224	HQHHRCHTNNLQBC-INJPQVFBSA-N	428.371	1.188	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(-c4cccnc4)[nH]n3)C2)C1	1779611857	WCPXRZRBXRVVLV-MGPUTAFESA-N	433.896	1.169	50	20	IDGD	
CCc1noc(C)c1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](Cl)COC)C2	1779776986	QCIAGDJTPPFFQU-AKCHCHLHSA-N	427.929	1.927	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnc(O)nc1O)C2	1780712218	XKDHUPKPYHTJNY-OCBCSQNSSA-N	447.319	1.252	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCNC(=O)OC(C)(C)C)CCO2	1781216903	QDCYUJVKEYTYIO-MDOVXXIYSA-N	447.960	1.109	50	20	IDGD	
NC[C@H](C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1)c1ccccc1	1781331358	PAOHLWQATCLCLM-MPGHIAIKSA-N	428.302	1.249	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(OC)c(OC)cc3C)C2)C1	1781895022	WLIMFYODNSWEAZ-IIBYNOLFSA-N	440.924	1.710	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1csc(N)n1)C2	1781998412	SXKHZGOEZZSXFW-KANYHAFZSA-N	431.356	1.636	50	20	IDGD	
N[C@@H](Cc1cscn1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C(Cl)Cl)C1	1782217641	SJOKUCFADMOSOB-OGHNNQOOSA-N	435.377	1.331	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)Cc3c(C)n[nH]c3C)CCO2)C1	1783351439	AVNNNKNHYHRPJZ-MAUKXSAKSA-N	427.343	1.572	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3n[nH]c4c(F)cccc34)CCO2)C1	1783533722	GFDODHSFEIYUTF-ADLMAVQZSA-N	439.285	1.929	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cc4ncsc4[nH]3)CCO2)C1	1783538651	VHHOTYITSSCPJI-MGPLVRAMSA-N	427.324	1.851	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cnn(C)c3C(F)(F)F)CCO2)C1	1783873319	NTUSDEJSDDBSEG-WBMJQRKESA-N	438.834	1.136	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)Cc3ccc(OC)cc3C#N)CCO2)C1	1783882232	WVDIHNVXOHFBKA-GHTZIAJQSA-N	435.908	1.193	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CCCCN3C)C[C@@H]21	1783964515	WNXPBVDLJVTEBE-VIQHNZTISA-N	430.387	1.481	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3cn[nH]c3)C[C@@H]21	1783970388	YPEMUHSZTFIFGA-TUUVXOQKSA-N	427.343	1.353	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3nc(C)sc3C)[C@H]2C1	1785413713	YEBIRXWXTWHORJ-JKQORVJESA-N	429.970	1.536	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3N(C)C)[C@H]2C1	1785758735	GZACSXPYHAOWPQ-HPZZRFSDSA-N	439.354	1.524	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)c3ccc(O)nc3)CCC2)cc1)c1cccc(B(O)O)c1	1788147891	MZYUYVPAQATIKJ-UHFFFAOYSA-N	431.257	1.529	50	20	IDGD	
COCCn1nccc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]2C1	1789865866	HNNRJIFDSNFGPW-IWKLRQMXSA-N	447.363	1.359	50	20	IDGD	
C[C@@H](Nc1cccnc1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]2C1	1789923107	YJTQBRSPZXHLSH-ZLTXHLNPSA-N	443.317	1.552	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)COc3ccc(OC)cc3)C[C@@H]21	1791249248	GHSCNRWFCYPCSC-FZDIXFNVSA-N	440.924	1.308	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCCCn3cccc3)C[C@@H]21	1791255424	QRQUMOGQABCWTE-OKYOBFRVSA-N	425.957	1.892	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(Cl)c(O)cc3O)C[C@@H]21	1791257183	SEGMQGAOMMSOSC-WKTARRMCSA-N	447.315	1.598	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)C1CCN(c2ccccc2)CC1	1792904123	AIXNNNACALTJGY-PIKOESSRSA-N	435.952	1.092	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3cc[nH]c3cc1Cl)C2)[C@@H](O)CCl	1792980918	AUDCDOCNXUYUCA-LZDSYCOUSA-N	426.300	1.624	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C=C/c1ccc([N+](=O)[O-])o1	1793109185	KASCTXKEFRUCBT-OTISQIKCSA-N	442.266	1.574	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)Br)C3)n1	1794281008	KQOCKHLUCJUHFZ-VFFTVRQLSA-N	439.310	1.027	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(N(C)C)cn1	1794457546	YPKNOSJCPUNBNQ-VWPFQQQWSA-N	439.354	1.382	50	20	IDGD	
O=C(CCOc1ccccc1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2	1795119890	UUGUWDCZPCFWHP-DLTLXFJOSA-N	429.286	1.736	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)c1cc(C(F)(F)F)c[nH]1	1796191074	WDEVOFGSNSBRNL-MUJYYYPQSA-N	435.211	1.279	50	20	IDGD	
Cc1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](F)Cl)C3)n(-c2cccc(=O)n2C)n1	1796388780	LVAQIXOHTAIYLZ-KYZVSKTDSA-N	435.887	1.666	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2c(c1)OCO2	1796785254	SYYXNGLFHDRXMS-MBMVNNNZSA-N	439.306	1.650	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnc2[nH]ncc2c1	1797346139	DNFSCHOPPWJJQH-AHXJXLJNSA-N	426.304	1.397	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc(S(C)(=O)=O)cc1)C2	1799266090	UOHGWDVSVIBVMJ-LORHWOILSA-N	442.965	1.240	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc([N+](=O)[O-])c(O)cc1C)C2	1799271791	BZXDLLSRVKJLGT-IFOZYUSPSA-N	425.869	1.829	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccn3cncc13)C2)[C@H](F)Br	1799349511	HPBGHJKFUGZSPU-JLUCKKNBSA-N	425.258	1.228	50	20	IDGD	
C[C@@H](Cc1ccccn1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Br	1799351841	COVZHDATHUZRDH-IGNRKKQASA-N	428.302	1.540	50	20	IDGD	
COc1cc(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](O)CCl)C3)ccc1[N+](=O)[O-]	1800045702	DHJWXZPQJLSJEJ-HLPPOEQASA-N	425.869	1.384	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=N/O[C@@H]1CCCCO1)C2	1800641997	PZFIBHHBTIPVND-RDYRMYCPSA-N	446.342	1.279	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3nn(C)cc3c1)C2	1800762089	NKOUQGPBGYWQJL-FIUQPQMISA-N	435.322	1.560	50	20	IDGD	
Cc1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)cc2c[nH]nc12	1800919306	CVXOXJDTPYZTGK-BJWYYQGGSA-N	447.499	1.435	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc(Cl)c(F)c1)C2	1800970571	GKEVBVPBJKAABN-HRJSJKBJSA-N	433.307	1.865	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c(c1C)OCCO3)C2	1800975522	PWVURNISEKJYOJ-CXHZTBPHSA-N	438.908	1.223	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cn1cccc([N+](=O)[O-])c1=O	1801358338	OTIWNVDZZWVYEX-YFQWEKLQSA-N	445.303	1.631	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1Cc2[nH]nc(C(F)(F)F)c2C1)[C@H](O)CCl	1801413536	GWEDAPUVJXLBTR-YNXVLUOKSA-N	434.846	1.381	50	20	IDGD	
C[C@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](C)NC(=O)c1cnccn1)C2	1801962972	GSALNMIGKSPVGV-YHQUGGNUSA-N	438.326	1.017	50	20	IDGD	
C=CCCc1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CCC(=O)NN(C)C)c(O)n1	1802333228	NWUPAHQYQXBPMA-BCDXTJNWSA-N	443.548	1.531	50	20	IDGD	
CS(=O)(=O)Cc1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)C(Cl)Cl)cn1	1802340480	CAMCUSZHYLCUIF-BTTYYORXSA-N	434.345	1.682	50	20	IDGD	
COc1ccccc1OCC(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1	1802801992	AUPLNIGYMRHQJC-CSODHUTKSA-N	447.919	1.775	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cc(Cl)cnc2O)[C@H]1c1cccnc1)[C@@H](O)CCl	1803138122	XIDHSCZLDGKHCR-RCBQFDQVSA-N	439.299	1.755	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1cccs1	1805385232	SECKDMSBZCCDCF-YLJYHZDGSA-N	435.314	1.456	50	20	IDGD	
O=C(O)CSCC(=O)N1CC[C@@H](CNC(=O)CCBr)[C@H]1c1cccnc1	1806347401	WUFAAFIRIDYONA-SUMWQHHRSA-N	444.351	1.690	50	20	IDGD	
Cc1ccn(C)c1C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1807360033	GPUXMJRDURBHOR-DENIHFKCSA-N	446.316	1.042	50	20	IDGD	
COC(=O)NCC(=O)N1CC[C@H](CNC(=O)[C@@](C)(Cl)CCl)[C@@H]1c1cccnc1	1808315734	JSIHZOKOLMOCNY-XUWXXGDYSA-N	431.320	1.680	50	20	IDGD	
Cc1cc(C(=O)NC[C@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)c[nH]1	1808778274	LJWUPRBKAOWBND-UTKZUKDTSA-N	426.521	1.411	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@H]1CCN(C(=O)c2ccc(O)nn2)[C@H]1c1cccnc1	1810540994	RJFWKIVAFTYITN-BEFAXECRSA-N	429.553	1.748	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@H]1CCN(C(=O)Cc2cncnc2)[C@H]1c1cccnc1	1810542211	XMAJXDZCTWPBEP-NQIIRXRSSA-N	427.581	1.972	50	20	IDGD	
COc1ccc(C(=O)NC[C@@H]2CCN(C(=O)CCBr)[C@@H]2c2cccnc2)nn1	1811205212	HWZFCYAPRXQXIS-KBXCAEBGSA-N	448.321	1.985	50	20	IDGD	
CO[C@H](C)C(=O)NC[C@H]1CCN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@@H]1c1cccnc1	1813105346	KFBGGVHDSWIYBO-DJPGYCMPSA-N	440.504	1.256	50	20	IDGD	
C[C@H](Oc1ccccn1)C(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1	1813407244	SUEWWNJLHCNOSS-RMRDIRSESA-N	432.908	1.550	50	20	IDGD	
COc1ccc([C@H](O)C(=O)N2CCCC[C@@H]2c2cc(NC(=O)[C@H](O)CCl)n[nH]2)cc1	1814863960	DJOMKSSSJGPRRI-NUJGCVRESA-N	436.896	1.744	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1	1817470154	KXKVLLPPADBXNW-DOTOQJQBSA-N	432.717	1.803	50	20	IDGD	
C[C@@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1)c1ccccn1	1817474234	BGIJEFJMDLRVHE-FOIQADDNSA-N	447.304	1.594	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)c3ccncc3F)sc2C1	1817870382	SHQCHHRZIJIVEJ-LLVKDONJSA-N	434.497	1.276	50	20	IDGD	
C[Si](C)(C)OCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnc(O)nc2O)[nH]n1	1819593970	UMFMDILTULYJBM-ZDUSSCGKSA-N	434.529	1.768	50	20	IDGD	
O=C(Cc1ccc2ncnn2c1)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1	1820699510	KEBLNUCCXUSYRO-CABCVRRESA-N	431.884	1.287	50	20	IDGD	
CN(CC(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@](C)(Cl)CCl)[nH]n1)C(=O)C(=O)O	1821716076	XECNVSPSEQWXLW-GTNSWQLSSA-N	448.307	1.181	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2C[C@H](O)CN2)[nH]n1	1822091091	WABRDIXUPBFTDG-IMIFBBOLSA-N	428.331	1.298	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](C)N2CCN(C)CC2)[nH]n1	1822374632	YLGZGVCMSNDDGA-HLLBOEOZSA-N	440.976	1.292	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1	1822417011	VONNHZRVNAMKLJ-OCCSQVGLSA-N	428.921	1.029	50	20	IDGD	
CC(C)N1CCC[C@H]1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1	1822418274	YLIZBWBWWKMDRJ-MSOLQXFVSA-N	447.584	1.648	50	20	IDGD	
CC[C@H](C)[C@@H](O)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1	1824547941	DGTWTQBADMMERC-CWFSZBLJSA-N	445.564	1.325	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)Cn1ccncc1=O)CC2	1825646504	DAXLSKRSOFOKPL-UWVGGRQHSA-N	440.323	1.095	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)C(=O)Nc1cccnc1)CC2	1826000198	OGIPKNMKVJMSNA-CMPLNLGQSA-N	437.909	1.343	50	20	IDGD	
Cc1oncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1	1826026645	ARCBXAXLEOQPDY-HXUWFJFHSA-N	425.294	1.210	50	20	IDGD	
CC(C)NCCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1	1827019909	JVGGLUKXHOUVOZ-HXUWFJFHSA-N	444.580	1.307	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2nc[nH]n2)CC1	1827346659	GDZOBKOKURARAR-NFXIUMSZSA-N	440.508	1.172	50	20	IDGD	
CN1CCN(CC(=O)N2CCCC[C@@H]2C2CCN(C(=O)CCBr)CC2)CC1	1828442379	VVZHKPKTWNIYAQ-GOSISDBHSA-N	443.430	1.639	50	20	IDGD	
Cc1ccc(CCC(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)cc1F	1831308651	DXKWUWZUTNDCSZ-GHTZIAJQSA-N	442.915	1.123	50	20	IDGD	
C=CCOCCCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1	1831412051	BGOZYQWLYHUOCR-RTBURBONSA-N	437.364	1.662	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CN(CCO)CCO)CC1	1831483720	VEOVBMXBVUYNAF-MOPGFXCFSA-N	432.005	1.300	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@H](C)Br)CC1	1831652853	KSSBBFORAZFAJO-AEGPPILISA-N	431.375	1.836	50	20	IDGD	
Cc1onc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](C)CBr)C3)C2)c1C	1831972141	XQCROEGGBKWOCY-XIKOKIGWSA-N	444.326	1.392	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3cccc(OC)n3)CCO2)C1	1832823778	BZVHCMOPRIWAII-LAUBAEHRSA-N	439.940	1.497	50	20	IDGD	
Cn1cccc(C(=O)N2CCC(N3CCC(NC(=O)C(C)(C)CCl)CC3)CC2)c1=O	1833213367	NHSUAZIFSOZTBW-UHFFFAOYSA-N	436.984	1.836	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)Cc3ccc(F)cc3F)CC2)CC1)[C@H](O)CCl	1833312577	YHPGSZNUVMKQCX-LJQANCHMSA-N	443.922	1.679	50	20	IDGD	
C=CCOCCCC(=O)NC1CCN(C2CCN(C(=O)[C@H](Cl)COC)CC2)CC1	1833470917	XODATFPNSVBMBV-LJQANCHMSA-N	429.989	1.795	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)c3cnsn3)CC2)CC1	1833975292	BKHHWKKIGPANEZ-GFCCVEGCSA-N	444.399	1.754	50	20	IDGD	
CC(C)n1nccc1C(=O)NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1835944759	NPMAKDYQSUUULT-GOSISDBHSA-N	425.961	1.249	50	20	IDGD	
O=C(c1cnc2cc(Cl)ccn12)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1836369139	ZIPYAOSZLLONQV-YJBOKZPZSA-N	445.278	1.592	50	20	IDGD	
C[C@@H]1CCc2c(C(=O)N3CCC(OC4CCN(C(=O)[C@H](O)CCl)CC4)CC3)n[nH]c21	1836717068	GPYJLNQFMIFKFE-CXAGYDPISA-N	438.956	1.671	50	20	IDGD	
CCc1cc(C(=O)N2CCC(OC3CCN(C(=O)[C@H](O)CCl)CC3)CC2)nn1C	1836718259	MMDYZILLRMNCDH-GOSISDBHSA-N	426.945	1.194	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccn4ccnc34)CCO2)C1	1836995031	GLQDRPGTOMQUAM-UWJYYQICSA-N	434.924	1.812	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)CCN(C)C(C)=O)CC2)CC1	1837041214	YUSNMCUCMWSUBE-SFHVURJKSA-N	431.961	1.107	50	20	IDGD	
COc1ccc(C(=O)N2CCOC[C@@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)cn1	1837710150	LHJQOMKYMRXLMV-HXUWFJFHSA-N	437.569	1.012	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCC(OC2CCN(C(=O)C3=NNC(=O)C3)CC2)CC1	1838379798	CYSLGZZZHITWIQ-GOSISDBHSA-N	433.336	1.097	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4nn(C)cc4c3)C2)C1	1839148238	RYNZLEVYVWLTKD-UTKZUKDTSA-N	434.924	1.661	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccncc3)C2)C1	1839963209	DSTPTYGUVYYOFT-CRAIPNDOSA-N	426.311	1.325	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C13CC(C(=O)OC)(C1)C3)CCO2	1840004823	QWXQHFFHLKJWSM-VWNGAAMTSA-N	442.940	1.194	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3ccccc3)C2)C1	1840032143	OLTAPPOWRQTHCA-OXQOHEQNSA-N	439.350	1.859	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCCn3ccnc3)CCO2)C1	1840383578	ULJOKIDUPXPTLG-HXUWFJFHSA-N	426.945	1.385	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@@H](O)CC(=O)N1CC2(CCCN2C(=O)C(C)(C)CCl)C1	1841226982	QADORFOXYHITCG-AWEZNQCLSA-N	431.961	1.731	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@](F)(C(=O)N2CC3(CCCN3C(=O)[C@@H](O)CCl)C2)C1	1841353611	GVVGUELUBSEJSL-VBKZILBWSA-N	447.935	1.529	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)c2cc3cc[nH]c3cc2Cl)C1	1843789012	WEGHQIZFUUIVBE-UHFFFAOYSA-N	437.692	1.632	50	20	IDGD	
Cc1ccc(C(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)c(F)c1F	1844265625	XPRXLNPIHXKTHR-UHFFFAOYSA-N	429.427	1.403	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)c1cc(O)ncn1)C2	1844691842	HFDUDXAUBRXVNL-UHFFFAOYSA-N	441.400	1.147	50	20	IDGD	
COc1cc(C(=O)N2CCCC23CN(C(=O)[C@@H](F)Br)C3)c([N+](=O)[O-])cc1O	1844737987	YLMLFVQSGLUDMD-CYBMUJFWSA-N	446.229	1.817	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@H](NC(C)=O)c2ccc(F)cc2)C1	1845010378	MYGXTEYJUTXUDZ-IAGOWNOFSA-N	425.888	1.460	50	20	IDGD	
CN(CC(=O)N1CCCC12CN(C(=O)c1ccco1)C2)NC(=O)NCc1ccccc1	1845038435	BROVWXSNAFAZEF-UHFFFAOYSA-N	425.489	1.443	50	20	IDGD	
CCOC(=O)c1ncn2c1CC[C@@H](C(=O)N1CCCC13CN(C(=O)[C@H](Cl)CC)C3)C2	1845863352	VGKWGVMYEJPCKJ-HUUCEWRRSA-N	436.940	1.843	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC2(CCCN2C(=O)[C@@H]2C[C@@]23C(=O)Nc2ccccc23)C1	1846183684	RLRPVMXRGPTDCB-VQZRKKFQSA-N	432.318	1.883	50	20	IDGD	
O=C(NNC(=O)c1cc(Cl)ccc1O)c1ccc(S(=O)(=O)N2CCOCC2)cc1	10623743	AXFUQVIYFKHJPP-UHFFFAOYSA-N	439.877	1.141	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)cc(Cl)c1OCC(N)=O	11237148	UNNROFFJMXBGMM-SNVBAGLBSA-N	439.827	1.580	50	20	IDGD	
COc1ccc(Cn2nnnc2SCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1	15047315	DMUWTVYRZFKYFB-UHFFFAOYSA-N	443.445	1.192	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)cc1	24295839	QZVXPJZROPKVNL-BEFAXECRSA-N	449.504	1.902	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)CN1C(=O)COc2ccc([N+](=O)[O-])cc21	24630035	KICYGQBDLBEIRF-UHFFFAOYSA-N	434.792	1.443	50	20	IDGD	
CCn1c(SCC(=O)NNC(=O)c2ccc(OC)c(OC)c2)nc2ccccc2c1=O	28628507	KYHGCMJZZDODGB-UHFFFAOYSA-N	442.497	1.987	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NCc1ccc(NC(=O)c2ccco2)cc1	725858420	LCJLHJMMLGOMKT-UHFFFAOYSA-N	441.469	1.854	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)NC[C@H](O)COc2ccc3c(c2)OCO3)c1C	725890572	RXZKUULHANYDEV-MAYQHFBPSA-N	441.484	1.943	50	20	IDGD	
COc1ccc([C@H](CNC(=O)NNC(=O)CNC(=O)c2ccco2)N2CCCCC2)cc1	726083101	FKUVECKCSDVBHU-SFHVURJKSA-N	443.504	1.576	50	20	IDGD	
C[C@@H]1CCCCN1C(=O)CN1CCN(C(=O)NNC(=O)CCCc2ccccc2)CC1	727845963	CLUSOUGBBOLRFR-LJQANCHMSA-N	429.565	1.769	50	20	IDGD	
CN(C)c1nc2sc(C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)cc2s1	728890416	PVJOFEJHLIDPCH-UHFFFAOYSA-N	431.547	1.891	50	20	IDGD	
CCC(CC)[C@@H](CNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)N1CCCC1	729047035	KPMTZPWGPSRYHE-LJQANCHMSA-N	431.585	1.924	50	20	IDGD	
CCC(CC)N1C[C@@H](C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)CC1=O	729297050	RMPWMOHDFPKPEB-SFHVURJKSA-N	429.565	1.383	50	20	IDGD	
NC(=O)c1ccc(SCC(=O)NNC(=O)Cn2ccc3ccccc32)c([N+](=O)[O-])c1	729450467	WWAGSXFCAPPHFR-UHFFFAOYSA-N	427.442	1.588	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(OC)c(C(=O)NNC(=O)CNc2ccccc2)c1	729514055	JMUJWNRDLFTEOY-UHFFFAOYSA-N	434.518	1.599	50	20	IDGD	
Cc1ccc([C@@H](CNC(=O)NNC(=O)Cn2ccc3ccccc32)N2CCOCC2)o1	729585372	DJZAQTWRWFKJQL-LJQANCHMSA-N	425.489	1.947	50	20	IDGD	
O=C(Cc1cc[nH]n1)NNC(=O)c1cc(S(=O)(=O)NC2CC2)c(Cl)cc1Cl	730103153	YMDWBIDCELMNNH-UHFFFAOYSA-N	432.289	1.161	50	20	IDGD	
Cc1c(/C=C(\C#N)C(=O)N2CCN(Cc3nnnn3-c3ccccc3)CC2)cc(C#N)n1C	730776359	AZHPGWZVVKLBCH-XDHOZWIPSA-N	441.499	1.432	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2ccc3c(c2)OCCO3)nnn1-c1cccc2ncccc12	731327796	ZRFOFCULKMJYCE-UHFFFAOYSA-N	430.424	1.970	50	20	IDGD	
CNS(=O)(=O)Cc1ccc(CNC(=O)NNC(=O)NCc2ccc(Cl)cc2)cc1	732990519	GKZBYOLHTXLLBV-UHFFFAOYSA-N	439.925	1.603	50	20	IDGD	
CN(CC(=O)NNC(=O)c1cnn(-c2ccccc2)c1)C(=O)c1ccc(Br)o1	733106570	HILDNGKADQVUJE-UHFFFAOYSA-N	446.261	1.761	50	20	IDGD	
CCOCCCn1c(NNC(=O)[C@H]2CCCN(C(=O)CC)C2)nc2ccccc2c1=O	733266035	DCHFPRCMGOJOIP-INIZCTEOSA-N	429.521	1.915	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)NCc2cc(C)[nH]n2)cc1	733286239	UYRQHLOCZOJJFW-YBEGLDIGSA-N	433.472	1.689	50	20	IDGD	
Cc1ccc2c(=O)c(C(=O)OCC(=O)NNC(=O)c3ccc(Cl)cc3)cn(C)c2n1	734041647	TXRJYNYPLJNTCP-UHFFFAOYSA-N	428.832	1.513	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)N[C@@H]2CCC[C@@H](C(=O)N(C)C)C2)c2ccccc2c1=O	734223939	RVKDAJHVRJVELN-HUUCEWRRSA-N	442.520	1.568	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1	734241582	QUCZMABSNQBZSG-UHFFFAOYSA-N	433.425	1.249	50	20	IDGD	
CCOC(=O)c1cc(S(=O)(=O)NNC(=O)c2cc(C)oc2C)cc([N+](=O)[O-])c1C	734807062	SBGWKQFFUUMBBE-UHFFFAOYSA-N	425.419	1.913	50	20	IDGD	
CN(C)C(=O)c1ccc(C(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)cc1	734821965	QCAZVJAEMGEWOP-UHFFFAOYSA-N	433.509	1.732	50	20	IDGD	
O=C(CCOc1ccc(Cl)cc1[N+](=O)[O-])NNC(=O)CNC(=O)c1cccs1	735007023	IRVWAZYJOLRUSZ-UHFFFAOYSA-N	426.838	1.656	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)C2CCN(S(=O)(=O)c3ccc(C(C)(C)C)cc3)CC2)cn1	735445150	KKQIDDSQPHXLGD-UHFFFAOYSA-N	447.561	1.580	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)Cc2ccc(S(=O)(=O)CC(F)(F)F)cc2)cc1	736554695	WABFUSDEDLCYJC-UHFFFAOYSA-N	425.388	1.898	50	20	IDGD	
CCCCn1c(=O)nc(O)c2c1nc(CCC(=O)NNc1cccnn1)n2CC(C)C	736702145	DJWZPBGJFQYXLC-UHFFFAOYSA-N	428.497	1.621	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)N1CCN(CC(=O)NC2CCCCC2)CC1	738497375	SWOUKRYKGVRZMU-UHFFFAOYSA-N	431.537	1.011	50	20	IDGD	
Cc1nn(C)c2sc(C(=O)N[C@H](C)C(=O)NNC(=O)COc3ccc(F)cc3)cc12	742034984	UHRUNXVHRLVGLW-LLVKDONJSA-N	433.465	1.427	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N[C@H]2CCSC2)cc1	742778528	PAVNZWDQEKSZQA-MJSCBBHESA-N	425.514	1.963	50	20	IDGD	
O=C(NCCc1nc(C(F)(F)F)cs1)NNC(=O)c1ccc(-n2cnnn2)cc1	743509330	BLMOZNBHDRQMHE-UHFFFAOYSA-N	426.384	1.324	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)N[C@H]3CCCN(c4ccn(C)n4)C3=O)cc2C1	743512893	ZTRGFLYIDFHWHE-OCCSQVGLSA-N	430.534	1.746	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)/C=C/c1ccccc1)C(=O)NNC(=O)NC1CCCC1	744052481	FDZYLEZNRPISGQ-VSOYFRJCSA-N	440.591	1.971	50	20	IDGD	
COc1cc(CC(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)cc(OC)c1OC	744476539	NLQNISWEGRFPLP-UHFFFAOYSA-N	427.413	1.131	50	20	IDGD	
CN(C)[C@@H](CNC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)c1cccc(F)c1	745291525	FCJZIEJCQOAXMX-KRWDZBQOSA-N	437.497	1.868	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NC[C@H](C)Oc2cccc(F)c2)c2ccccc2c1=O	745880144	ZTDBOWCXRKYXKS-ZDUSSCGKSA-N	427.436	1.967	50	20	IDGD	
CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)NNC(=O)c1cccc(N(C)C)c1	749334456	GJMDMPQIXAAOEA-FQEVSTJZSA-N	425.464	1.881	50	20	IDGD	
O=C(NNC(=O)c1cc(S(=O)(=O)N2CCCC2)ccc1O)c1cc2ccccc2o1	749545952	SBRWHDMEPLAMQL-UHFFFAOYSA-N	429.454	1.998	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNS(=O)(=O)c2ccc3[nH]c(=O)ccc3c2)cc1	751142862	UFTDJAVYBKZQSV-ZDUSSCGKSA-N	431.470	1.704	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNS(=O)(=O)c2ccc(C(=O)CCC(=O)O)cc2)c1	751208042	WQESRGVYMMLLJQ-UHFFFAOYSA-N	436.442	1.375	50	20	IDGD	
O=C(NNc1cccnn1)c1cc(S(=O)(=O)N2CCOCC2)ccc1N1CCCCC1	753100538	ROBOZLQGBXGXQO-UHFFFAOYSA-N	446.533	1.245	50	20	IDGD	
COC(=O)c1cc(Cl)ccc1S(=O)(=O)NNC(=O)c1cnn(-c2ccccc2)c1	753777885	AVLDNBOVKRHTBL-UHFFFAOYSA-N	434.861	1.936	50	20	IDGD	
CC(C)c1c(NC(=O)C(=O)NNC(=O)CNC(=O)c2ccco2)cnn1-c1ccccc1	753853094	QNPAMRBPFCVHNJ-UHFFFAOYSA-N	438.444	1.105	50	20	IDGD	
N#C/C(=C/c1ccc(O)cc1)C(=O)OCC(=O)N(C[C@@H]1CCCO1)[C@@H]1CCS(=O)(=O)C1	754536546	KLYWZULWJBZRGX-ICCJGISBSA-N	448.497	1.037	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)Nc1ccc(N2CCc3sccc3C2)nc1	755859441	PBQLWVMAUTYWPT-CYBMUJFWSA-N	435.531	1.293	50	20	IDGD	
COC(=O)[C@H]1Cc2ccccc2CN1CC(=O)NNC(=O)c1cc(Cl)ccc1OC	755864638	WBLAKTSCAWVFAU-QGZVFWFLSA-N	431.876	1.710	50	20	IDGD	
CN(C)C(=O)COc1cccc(NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1	755960193	GGJPRAGFFCIUFI-UHFFFAOYSA-N	441.492	1.013	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)Nc1ccc(CN2CCOC2=O)cc1	756109610	HXPZAHOQRCDRMC-UHFFFAOYSA-N	436.428	1.997	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)Nc2cccc(C(=O)NCCC(N)=O)c2)cc1C	756395570	XTTUDQZOVDTDOI-UHFFFAOYSA-N	427.461	1.140	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)Cc2ccncc2)ccc1S(=O)(=O)N1CCCC1	756584925	IAJHYPKYWXSJQS-UHFFFAOYSA-N	433.490	1.270	50	20	IDGD	
CC1CCN(S(=O)(=O)Cc2ccccc2CNC(=O)NNC(=O)c2ccc[nH]2)CC1	756744851	KUDLRKGSOYKBSB-UHFFFAOYSA-N	433.534	1.721	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)Nc1ccc(CS(C)(=O)=O)c(F)c1	757674235	BXHGFQJWVURXKU-UHFFFAOYSA-N	425.438	1.611	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)Nc1cnn(-c2cnc3ccccc3n2)c1	757782851	JUFIROFJRUDJDM-GOSISDBHSA-N	431.412	1.808	50	20	IDGD	
O=C(CCCn1c(=O)oc2ccccc21)N1CCN(S(=O)(=O)CBr)CC1	758527139	JBMSLWFZPZFGHP-UHFFFAOYSA-N	446.323	1.201	50	20	IDGD	
CCN(CC)[C@H](C(=O)N1CCN(S(=O)(=O)CBr)CC1)c1ccccc1	758534070	BEBRXLRZVKEZEA-INIZCTEOSA-N	432.384	1.896	50	20	IDGD	
O=C(NNC(=O)[C@@]12CCC(=O)N1c1cc(Cl)ccc1S2)C(=O)Nc1ccccn1	758840385	NWNWSGBRGXJAQR-SFHVURJKSA-N	431.861	1.450	50	20	IDGD	
COCCC(C)(C)CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	760165607	XHVSSEOKELFSJN-UHFFFAOYSA-N	426.539	1.478	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)Cc1csc(NC(=O)c2cc(C)ccc2O)n1	760894801	OOHCCKZXKYLDJU-UHFFFAOYSA-N	447.517	1.404	50	20	IDGD	
COc1ccc(Br)c(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)c1	763549201	UOYBUHVSJVOYOT-UHFFFAOYSA-N	436.218	1.586	50	20	IDGD	
COC(=O)c1cc(Cl)cc(NC(=O)C(=O)NNC(=O)c2ccc(OC)c(OC)c2)c1	763551282	VERHRFOUDRANRQ-UHFFFAOYSA-N	435.820	1.544	50	20	IDGD	
N#Cc1ccc(-n2ccc(NC(=O)C(=O)NNC(=O)c3ccccc3F)n2)c(Cl)c1	763561965	QKSDRTULAVKTRR-UHFFFAOYSA-N	426.795	1.936	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2ccn([C@@H](C)c3ccccc3)n2)c1	763772253	PFRNMYWKEKBTOV-AWEZNQCLSA-N	437.456	1.909	50	20	IDGD	
Cc1cc(N2CCCC2)ccc1NC(=O)C(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	763790722	NOLYWDXXURVHOF-UHFFFAOYSA-N	448.483	1.242	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)C(=O)Nc1ccccc1-n1ccnn1	763854529	ROTDPQFVMNTEGE-HNNXBMFYSA-N	444.451	1.974	50	20	IDGD	
CNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)cc1Cl	763864404	IKXWBVLKCJVYBV-JTQLQIEISA-N	436.827	1.392	50	20	IDGD	
CCNC(=O)COc1cccc(NC(=O)C(=O)NNC(=O)Cc2c[nH]c3ccccc23)c1	763864525	CMFWYNQABHLNES-UHFFFAOYSA-N	437.456	1.011	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)ccc1C(=O)NC(C)C	763866180	URYMKFYCNNUKNF-AWEZNQCLSA-N	444.463	1.826	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(OCC(C)C)nc2)cc1	763878299	OPZTXVLZYQDSEP-HNNXBMFYSA-N	442.472	1.872	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccccc2-n2cccn2)cc1	763879030	VRJIQNULVKWEMN-HNNXBMFYSA-N	435.440	1.628	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)n1	763892191	ATLQZSHGWTUGEJ-GASCZTMLSA-N	446.483	1.039	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(F)c(C(=O)OC)c2)cc1OC	763911486	FZYLKJQGKOCDAU-UHFFFAOYSA-N	433.392	1.419	50	20	IDGD	
O=C(Cc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1ccc(N2CCCC2=O)c(F)c1	763936696	PIOQNYLASODQCA-UHFFFAOYSA-N	432.839	1.935	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3ccccc3C(=O)N(C)C)cc2C1	763939435	MTRWUNZYMAZHKL-LBPRGKRZSA-N	428.514	1.974	50	20	IDGD	
Cn1c(=O)oc2c(NC(=O)C(=O)NNC(=O)c3cc4c(s3)CCCCC4)cccc21	763968511	QDJZEPJJZVWYFW-UHFFFAOYSA-N	428.470	1.862	50	20	IDGD	
O=C(Cc1ccsc1)NNC(=O)C(=O)Nc1cccc(N2CCN(CC3CC3)CC2)c1	764035169	MVLGVHRXYXJYRU-UHFFFAOYSA-N	441.557	1.609	50	20	IDGD	
CC(C)(C)Oc1ccccc1NC(=O)C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	764076598	CKUQVGBNXJJHHO-UHFFFAOYSA-N	433.486	1.667	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(S(C)(=O)=O)ccc2Cl)c(O)c1	764111290	OJVAWSHTJNNILT-UHFFFAOYSA-N	425.850	1.157	50	20	IDGD	
CCn1cnnc1-c1ccccc1NC(=O)C(=O)NNC(=O)c1ccc(Cl)cc1O	764126022	DYVYGUFSTZVMGV-UHFFFAOYSA-N	428.836	1.724	50	20	IDGD	
O=C(CCc1ccco1)NNC(=O)C(=O)Nc1nc2cc3c(cc2s1)OC(F)(F)O3	764169804	SDBRKTHFKXNDOW-UHFFFAOYSA-N	438.368	1.930	50	20	IDGD	
Cc1cc(I)ccc1NC(=O)C(=O)NNC(=O)Cc1ccccn1	764264106	NGLTXFJFYZFOAR-UHFFFAOYSA-N	438.225	1.323	50	20	IDGD	
COCCOc1c(Cl)cccc1NC(=O)C(=O)NNC(=O)CCc1ccccc1O	764280536	CNCSQYNCFWKPOX-UHFFFAOYSA-N	435.864	1.790	50	20	IDGD	
C[S@@](=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)cc1F	764381944	CQBNLNLVVWIXQS-GDLZYMKVSA-N	435.462	1.414	50	20	IDGD	
C[S@](=O)c1cccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)c1	764388274	QFWDXFWEXZHNFG-PMERELPUSA-N	429.433	1.353	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)o1	765618171	YKPBFPXGYZGHCB-UHFFFAOYSA-N	449.464	1.960	50	20	IDGD	
Cc1cc(C(=O)NNS(=O)(=O)c2cc(Cl)ccc2OCC(N)=O)c2ccccc2n1	766306760	GMHLLYFCFGFPCX-UHFFFAOYSA-N	448.888	1.684	50	20	IDGD	
CC(C)CN1N=C(C(=O)NNC(=O)[C@@H](C)Oc2cccc(Br)c2)CCC1=O	766340292	YDWKOCSYNIAVMI-GFCCVEGCSA-N	439.310	1.998	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)CS(=O)(=O)C(C)(C)C)cc1	767188792	HAPQVYHNHJOZET-UHFFFAOYSA-N	425.536	1.082	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)[C@H](C)N2C(=O)c3ccc(Br)cc3C2=O)c(O)c1	769650374	IVFJNOGWXXMMJC-JTQLQIEISA-N	446.257	1.909	50	20	IDGD	
CSCCNC(=S)NNC(=O)[C@@H]1CCCN1C(=O)c1ccc(Br)cc1	770245395	NMBCURZLBBHOMH-ZDUSSCGKSA-N	445.408	1.912	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)N[C@@H]3CCN(c4ccc(Br)cc4)C3)nc21	770383315	GGLZTZLDEOEGQB-LLVKDONJSA-N	447.297	1.736	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNc2c(F)cccc2Cl)ccc1S(=O)(=O)N(C)C	770810854	VQVUSXWEAADBGI-UHFFFAOYSA-N	444.872	1.820	50	20	IDGD	
CC(C)(C)OC(=O)N1CCO[C@H](CC(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)C1	770966715	OMBLHIXVSWIEQG-GFCCVEGCSA-N	449.512	1.756	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)[C@H]1CCCCN1C(=O)c1ccc(O)nn1	772962377	ADYZJLFBQSGATB-BLLLJJGKSA-N	447.879	1.445	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)[C@@H](NS(=O)(=O)c2ccc(C)cc2)C(C)C)c1	773070083	MOORZVOWJUMFDC-SFHVURJKSA-N	447.517	1.113	50	20	IDGD	
Cc1ccc(-n2nc(C)cc2NC(=O)C(=O)NNC(=O)c2ccc3ccccc3c2)nn1	773497663	ZVPAYFHOEHIELK-UHFFFAOYSA-N	429.440	1.832	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cc(C)cc(C)n3)n[nH]2)cc1OC	773545927	KYRODAODJOFZGX-UHFFFAOYSA-N	438.444	1.505	50	20	IDGD	
O=C(COC(=O)c1cc(O)c2ccccc2c1O)NNC(=O)c1cccc([N+](=O)[O-])c1	776553485	NJAQCXYVPAJYTQ-UHFFFAOYSA-N	425.353	1.777	50	20	IDGD	
Cc1cc(F)c2nc(O)cc(C(=O)OCC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)c2c1	778871799	XJYPTTRHYUYSRS-UHFFFAOYSA-N	442.359	1.914	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)c(OC)c1	782123734	JPEGOCLZBYLSHU-UHFFFAOYSA-N	433.442	1.066	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2cc(C(=O)N3CCSCC3)ccc2C)nc1	782145716	NSYHIOKJBMKWGM-UHFFFAOYSA-N	429.502	1.669	50	20	IDGD	
CCc1c(C(=O)NNC(=O)CNC(=O)c2cccs2)nnn1Cc1ccc(F)cc1	783109360	FVUNVHFZSZTEOD-UHFFFAOYSA-N	430.465	1.280	50	20	IDGD	
COc1cccc(Oc2ccc(NC(=O)C(=O)NN[C@]3(C)CCS(=O)(=O)C3)cc2)c1	783424984	HAQRYRRCTPWSKS-HXUWFJFHSA-N	433.486	1.624	50	20	IDGD	
COc1cc(C=NNC(=O)c2sc(N3CCOCC3)nc2C)ccc1OCCC(=O)O	783813887	UCRQWADCYUJFCN-UHFFFAOYSA-N	448.501	1.914	50	20	IDGD	
CC(C)(C)OC(=O)N[C@]1(C(=O)NNc2ccc(C(N)=O)nn2)[C@@H]2CCCO[C@@H]2C1(C)C	783902262	XNWBJOTZNVJLFO-FYYVMTAXSA-N	434.497	1.117	50	20	IDGD	
Cc1c([N+](=O)[O-])cn(CC(=O)NNC(=O)c2ccc(F)cc2)c(=O)c1Br	783925179	SEBBTBDIPYQGEH-UHFFFAOYSA-N	427.186	1.428	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2ccc(CC(=O)N3CCc4ccccc43)cc2)ncn1	783945911	SKNIMIDYSKYPAY-UHFFFAOYSA-N	430.468	1.999	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1cc(C(F)(F)F)ccc1F	784003427	FEDTUTAADHIFEH-UHFFFAOYSA-N	432.355	1.422	50	20	IDGD	
COc1ccc(C(=O)CCC(=O)NNC(=O)c2ccc3c(c2)OCO3)c(OC)c1OC	784580526	RJJOGIKVOWKESK-UHFFFAOYSA-N	430.413	1.865	50	20	IDGD	
O=C(NNc1cccnc1Cl)C(=O)N1C[C@H](C(=O)N2CCCCC2)Oc2ccccc21	784838838	FURHXPWOVDQHPR-QGZVFWFLSA-N	443.891	1.985	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)sc(C)c1C	785068645	YSDCOZFBEGJDKP-UHFFFAOYSA-N	443.485	1.518	50	20	IDGD	
O=C1COc2cc(NC(=O)C(=O)NNc3c(F)cc(C(=O)NC4CC4)cc3F)ccc2N1	785100147	RUFHIGGFCYHMJO-UHFFFAOYSA-N	445.382	1.270	50	20	IDGD	
COc1cc(F)cc(NNC(=O)C(=O)Nc2ccc(CC(=O)N3CCOCC3)cc2)c1	785247037	RTWFKBQLSVAUSQ-UHFFFAOYSA-N	430.436	1.317	50	20	IDGD	
O=C(Cc1ccc(Cl)cn1)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	785670526	RYUIUZZHBBNDEN-UHFFFAOYSA-N	436.921	1.913	50	20	IDGD	
COc1ccc(OC)c([C@@H]2C[C@@H]2C(=O)N2CCN(S(=O)(=O)CBr)CC2)c1	788526061	PLVGARFMWSGWDB-ZFWWWQNUSA-N	447.351	1.634	50	20	IDGD	
CC(C)(C)Cc1csc(NC(=O)C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)n1	789735448	PCJWRUALASJGTB-UHFFFAOYSA-N	445.549	1.524	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)cc(-n2cccn2)c1	792355083	OTJNBHURPGSOCT-CYBMUJFWSA-N	441.419	1.573	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cc(O)ccc2C(F)(F)F)cc1	792806287	GFXOBAZJDPRLGL-UHFFFAOYSA-N	445.419	1.801	50	20	IDGD	
COC[C@H](CO)NC(=O)/C(C#N)=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	794100399	DUTZUEUJQUNEBE-QHIITQONSA-N	431.880	1.109	50	20	IDGD	
Cc1cc(=O)oc2cc(OCC(=O)NNc3ccccc3S(=O)(=O)N(C)C)ccc12	795168763	UISWMCYNNKEBIU-UHFFFAOYSA-N	431.470	1.874	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)c1cc(Br)cnc1OCC1CC1	796600014	LNITXXJKBIFFIS-UHFFFAOYSA-N	427.299	1.699	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)[C@](C)(NC(C)=O)c1ccc(S(C)(=O)=O)cc1)c1ccccc1	797449367	OAFIEZYEPFQFGV-SIKLNZKXSA-N	445.541	1.783	50	20	IDGD	
Cc1cc(O[C@H]2CCN(C)C2=O)ccc1NC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	799239020	RJTBJYTXUOYOFI-KRWDZBQOSA-N	427.417	1.979	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNS(=O)(=O)c2ccc(C(=O)N(C)C)cc2)cc1	799519150	PSGMTEYKGSRHRR-AWEZNQCLSA-N	435.502	1.564	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2c(C)nn(C)c2Br)cc(OC)c1OC	800797440	NDSUMFIZHASIAG-UHFFFAOYSA-N	427.255	1.592	50	20	IDGD	
CN1C(=C(C#N)C(=O)COC(=O)[C@@H]2COCCN2CC(F)(F)F)N(C)c2ccccc21	801340825	NWIAWSGYAOURJT-INIZCTEOSA-N	438.406	1.683	50	20	IDGD	
C[C@](O)(CN1Cc2ccccc2C1=O)C(=O)NNC(=O)Nc1ccc(OC(F)F)cc1	802045920	ULELIDMXXJPORU-FQEVSTJZSA-N	434.399	1.848	50	20	IDGD	
Cc1cc(F)ccc1-n1cc(O)c(C(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)n1	802067689	KGWZTJHYFNYHGR-UHFFFAOYSA-N	447.448	1.895	50	20	IDGD	
COCc1ncc(C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)s1	802762633	JKSVRKAVSOLYHK-UHFFFAOYSA-N	437.953	1.522	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NNc2ccc(-n3ccnc3)nn2)ccc1OC	804951208	MJQRYVVGVMKNNJ-UHFFFAOYSA-N	445.505	1.458	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N2CC[C@@H](C(=O)N3CCCC3)C2)cc1Br	805103778	DIUSNVHQPOZWSC-CYBMUJFWSA-N	439.310	1.756	50	20	IDGD	
COCCOc1ccc(S(C)(=O)=O)cc1NC(=O)NNC(=O)Cc1ccc(F)cc1	806737288	SRRZKYJDOCNSIK-UHFFFAOYSA-N	439.465	1.650	50	20	IDGD	
CCCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNc2nccnc2C2CCC2)cc1	807462462	BEYJFGGMTUQOMU-UHFFFAOYSA-N	432.506	1.978	50	20	IDGD	
CC(C)CCn1nc(C(=O)NNS(=O)(=O)c2ccc(C#N)o2)c2ccccc2c1=O	808069899	KNJWDFDQTWOGAT-UHFFFAOYSA-N	429.458	1.531	50	20	IDGD	
CC1(C)CCCc2sc(NC(=O)C(=O)NNC(=O)COc3ccccc3C#N)nc21	810385841	BSSSSMOXDSHFRV-UHFFFAOYSA-N	427.486	1.794	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)NCc2ccc(OC)c(S(N)(=O)=O)c2)c1C	811542622	AZAZGXQDNJPENG-WQRHYEAKSA-N	446.529	1.631	50	20	IDGD	
O=C(NCCc1cn[nH]c1)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	812522630	MQVNETPVDUZSAI-UHFFFAOYSA-N	434.503	1.459	50	20	IDGD	
COc1ccc(OC)c(C2=NO[C@@H](C(=O)NNc3ccc(S(=O)(=O)N(C)C)cc3)C2)c1	812726565	HYSNPKVNTZZPPP-LJQANCHMSA-N	448.501	1.590	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)c2ccc(S(C)(=O)=O)c([N+](=O)[O-])c2)cc1	812728141	HQFXRUKJHFYQJL-UHFFFAOYSA-N	442.475	1.006	50	20	IDGD	
NS(=O)(=O)c1ccc(NC(=O)NN=Cc2ccc(OCCN3CCCC3)cc2)cc1	814969130	GVXXGXPZWQUWQP-UHFFFAOYSA-N	431.518	1.964	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1ccc(-c2csnn2)cc1	815751066	QLBIKRDJXLMODK-UHFFFAOYSA-N	446.514	1.537	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1cccc(-n2cccn2)c1	815751964	WJXNDUCDMIDSBN-UHFFFAOYSA-N	428.474	1.204	50	20	IDGD	
CCOc1ccc(NNC(=O)C(=O)Nc2ccc(C)c(S(=O)(=O)NC3CC3)c2)cc1	815816999	XMHOFQWTOHBWHB-UHFFFAOYSA-N	432.502	1.916	50	20	IDGD	
COc1cccc(/C=C(\C(=O)NNC(=O)COc2ccc(F)cc2)n2nnnc2C)c1	818029855	OQMSYLYWXRFOBE-WOJGMQOQSA-N	426.408	1.354	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)[C@@H](O)[C@@H](O)c2nc3ccccc3[nH]2)c1	818751010	VGXCCVOIJXHAKI-CABCVRRESA-N	449.261	1.650	50	20	IDGD	
O=C(CCn1c(S)nc2ccccc2c1=O)NNC(=S)NCCc1cccs1	819427970	XRKMXPHIEVMTPK-UHFFFAOYSA-N	433.584	1.875	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)CCNS(=O)(=O)c2c(C)c(C)c(C)c(C)c2C)n1	913025878	NRYBDYDJWKBZFA-UHFFFAOYSA-N	449.577	1.558	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)c1ccc2c(=O)n3c(nc2c1)CCCCC3	914279636	BNYHFHYZQLESPC-UHFFFAOYSA-N	430.468	1.774	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCc2ccc(-n3ccnc3)nc2)cc(OC)c1OC	914535256	WYCDGDYQJATIPW-UHFFFAOYSA-N	426.433	1.437	50	20	IDGD	
C[C@H]1CN(Cc2ccc(C(=O)NNC(=O)[C@@H]3COc4ccccc4O3)cc2)C[C@@H](C)O1	914775513	RXYWRVARZIAOPU-MRUHUIDDSA-N	425.485	1.897	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)Cc2csc(Cc3ccccc3)n2)c2ccccc2c1=O	915190573	IINVUMARGJUQCY-UHFFFAOYSA-N	433.493	1.985	50	20	IDGD	
CC(C)NC(=O)C(=O)NNC(=O)c1cccc(NC(=O)c2cccc(Br)c2)c1	916040886	ONYDFWCYNJBLGI-UHFFFAOYSA-N	447.289	1.987	50	20	IDGD	
CNS(=O)(=O)c1ccc(CNC(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)s1	916232825	MDJBRPFPNFOUGZ-JTQLQIEISA-N	430.483	1.093	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)NCCCN1C(=O)NC2(CCCCC2)C1=O	916268712	HZVRWXMLKKLIIJ-UHFFFAOYSA-N	445.520	1.603	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)c1cc(Br)c[nH]1)N1CCN(c2ccccc2)CC1	916514363	BDFWUSMAQNXEJX-CQSZACIVSA-N	449.353	1.932	50	20	IDGD	
CC(C)(Oc1ccc(F)cc1)C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	916519383	DVQAMKZMYAZSRE-QGZVFWFLSA-N	432.404	1.514	50	20	IDGD	
CCS(=O)(=O)N(C)CCCNC(=O)NNC(=O)[C@@H](C)Oc1ccc2ccccc2c1	916580321	MPHSRNVMWVLMHZ-OAHLLOKOSA-N	436.534	1.609	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CN2C(=O)N[C@@]3(C[C@@H](C)CC(C)(C)C3)C2=O)cc1	916830522	DKFHADUYJYKYJD-RCDICMHDSA-N	443.504	1.218	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(O)c([N+](=O)[O-])c1)c1ccc(F)cc1Br	917754951	OWUSSRVMTLAZPT-UHFFFAOYSA-N	434.199	1.825	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1nnn(-c2ccccc2)c1C	919607384	SUHOSLRPUJQWGE-UHFFFAOYSA-N	443.847	1.856	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)[C@@H](Cc2ccc(F)cc2)n2nnnc2C)cc1	920012539	UBHNSTFXXQGLFA-LJQANCHMSA-N	426.452	1.693	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)c2sccc2NC(=O)c2ccncc2)c1	920458373	QPCUUNYLDPQNMB-UHFFFAOYSA-N	444.494	1.874	50	20	IDGD	
O=C(COc1cccc(I)c1)NNC(=O)c1n[nH]c2c1CCCC2	1256157765	UHEQEEIJEDWKAJ-UHFFFAOYSA-N	440.241	1.733	50	20	IDGD	
CC(=O)N1C[C@H](C(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)Oc2ccccc21	1318567695	VLDRCCWUDXEWBJ-GOSISDBHSA-N	446.504	1.595	50	20	IDGD	
CCS(=O)(=O)Nc1cccc(C(=O)NNC(=O)c2cc(Br)ccc2O)c1	1318792596	WJUKBAJNELFOQA-UHFFFAOYSA-N	442.291	1.991	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NN=Cc3cccc4cn[nH]c34)CC2)cc1	1319278692	RVPSKODWJOWOEV-UHFFFAOYSA-N	440.529	1.328	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)NCCN1C(=O)COc2ccccc21	1320552010	SVCSHPXHBHXSTN-UHFFFAOYSA-N	430.486	1.543	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cnn(-c3ccccc3)c2OC)cc(OC)c1OC	1324045209	GUAXDQZUCDBBAS-UHFFFAOYSA-N	426.429	1.982	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)/C=C3\C(=O)Nc4ccccc43)C2)C1	1778910027	YIPWUBCVKCUCDY-NWADFXISSA-N	448.317	1.635	50	20	IDGD	
C[C@@H](C(=O)N1CC[C@@]2(CN(C(=O)C(Cl)Cl)CCO2)C1)N1CSCSC1	1779150138	UNQWRZDYNNNSCU-NHYWBVRUSA-N	428.407	1.663	50	20	IDGD	
Cn1nc(C(F)(F)F)cc1C(=O)N1CCO[C@@]2(CCN(C(=O)CO[Si](C)(C)C)C2)C1	1779299332	XGVSOJKPJDYBSR-QGZVFWFLSA-N	448.518	1.734	50	20	IDGD	
CCc1cc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CO[Si](C)(C)C)C2)nn1C	1779545452	NCJZXGLBIUOFEP-WIYYLYMNSA-N	436.629	1.962	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](F)Br)C2)nc1	1780773699	RNZIFAYCIZAPIB-IIDMSEBBSA-N	444.301	1.908	50	20	IDGD	
O=C(c1snnc1C1CC1)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781330175	SEICGLRFBUBAOV-IUODEOHRSA-N	433.303	1.550	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccccc3C(N)=O)C2)C1	1781761325	FCBKZYSCCUYWQQ-HNAYVOBHSA-N	438.322	1.403	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cccn4nccc34)C2)C1	1782328299	BFGWAWAXOTUUEQ-AUUYWEPGSA-N	435.322	1.809	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3[nH]nc4ccncc34)CCO2)C1	1783347272	DXTTYQKTELISRA-ACJLOTCBSA-N	436.310	1.575	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1CCc3nc[nH]c3C1)CCO2	1783540423	WKFIIAYSCINTFH-JCGVRSQUSA-N	425.327	1.128	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cnc4cc(Cl)ccn34)CCO2)C1	1783875974	QFDNEVXVYDFDHB-KUHUBIRLSA-N	441.315	1.685	50	20	IDGD	
CC#C[C@H](CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]2C1)c1ccc(O)cc1	1784096507	YYGHRMJIGHPYRQ-DIZVHYTASA-N	448.947	1.469	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccnc3C(N)=O)[C@H]2C1	1785519191	BDNIQSSKWYJZIE-MDWPOOTQSA-N	443.331	1.010	50	20	IDGD	
Cc1nc(O)c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]32)nc1C	1785575547	NHLOFLHKGSKPCY-MNUAXYBXSA-N	445.347	1.629	50	20	IDGD	
O=C(CCCCCCCCBr)N1CC[C@]2(C1)CN(C(=O)C(O)O)CCO2	1785666311	SEJYDDMCGIAVSK-SFHVURJKSA-N	435.359	1.253	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC1(c2ccc(NC(=O)CCc3cn[nH]c3)cc2)CCC1	1786850201	AAXKNVZSBOQVNJ-UHFFFAOYSA-N	447.499	1.789	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)Cc3ccccc3)C[C@@H]21	1789871838	KWQHBUWMCGPGIH-ZZAJSIFASA-N	443.371	1.806	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CNc3ccc(F)cc3)C[C@@H]21)[C@H](F)Br	1789922088	BZYTVSJILQRZLR-SIUGBPQLSA-N	446.292	1.908	50	20	IDGD	
COc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Cl)C[C@@H]32)c(O)c1OC	1790161318	AKTDTNKYAHSLPI-ZIYPJXPISA-N	430.860	1.537	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3csc(N)n3)C[C@@H]21	1790961436	KSVCITQWIBKVQX-ZPFDUUQYSA-N	431.356	1.492	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(Cl)cnc3O)C[C@@H]21	1791054427	GVGCDXUDEGNJGN-NUZBWSBOSA-N	446.729	1.817	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@](C)(O)C(F)(F)F)C[C@@H]21	1791055207	OFGWLOAOFZWLIJ-ADADXYTCSA-N	431.249	1.063	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4cn[nH]c4cn3)C[C@@H]21	1791055794	IDGLURNVJHTQNL-IZBNFRDHSA-N	436.310	1.335	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccn(C(C)(C)C)n3)C[C@@H]21	1791252055	AFSUDCQOKVEXJV-JKQORVJESA-N	426.945	1.485	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1ccc(C2(NC(=O)c3ccc[n+]([O-])c3)CCC2)cc1	1791599388	FIPWOBCXMNQPLQ-UHFFFAOYSA-N	425.489	1.441	50	20	IDGD	
O=C(NC1(c2ccc(NC(=O)C(Cl)Cl)cc2)CCC1)c1cc(=O)n2[nH]nnc2n1	1791604844	XQZPGCNUOGUVBB-UHFFFAOYSA-N	436.259	1.364	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCl)[C@@H]1CC(=O)N(Cc2cccs2)C1	1793110549	KVKHLNOCVHEFSX-GAGVYUBLSA-N	439.965	1.335	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@](C)(O)C(F)(F)F	1793693897	AWFRQWMSVFVSQB-MZODFIPJSA-N	431.249	1.063	50	20	IDGD	
Cc1c(F)ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)Br)C3)c1N	1795701646	AENMFXGUMQGCHD-LSSIXWDNSA-N	428.302	1.703	50	20	IDGD	
CC[C@@H](NC)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)C2	1795728220	KRKLODBFTNKYKL-UHVSXOQYSA-N	432.471	1.459	50	20	IDGD	
CCCc1onc(C)c1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2	1796612612	JUFBYSNLDYULHU-FVCICTRLSA-N	428.327	1.924	50	20	IDGD	
CN(CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnoc1)NC(=O)NCc1ccccc1	1796989973	FGIHXFLKASWXDX-REPLKXPHSA-N	440.504	1.273	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H](F)C[C@H]1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](O)CCl)C2	1797676953	ALMCLAASMFHBFU-RDGWLKQMSA-N	447.935	1.572	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccno1)C2	1798522666	JYJBYRHDZYTNTN-IVWMJMPLSA-N	444.400	1.025	50	20	IDGD	
Cc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Br)cc(C)c1O	1799351830	CHMVRPDAOVRQDZ-FQLMCAECSA-N	429.286	1.903	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccn(-c2ccccc2)n1)c1ccc(B(O)O)cc1	1799426509	VJZKTRDRQCZFFZ-NUZGMZIFSA-N	444.300	1.118	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cn2c(F)cccc2n1	1799999568	LLHWZVWRJVWNDP-JZGBQWHFSA-N	443.306	1.913	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)NC(=O)OC(C)(C)C	1800596944	JZTZQURYVKWIAD-DIACKHNESA-N	434.331	1.251	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc([N+](=O)[O-])[nH]1)C2	1800642436	HXALCNDNHNKYIM-FBKDDSFISA-N	429.271	1.300	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1occc1Br)C2	1800978150	MLJYRHNKCLVURZ-LFSVMHDDSA-N	435.702	1.499	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Br)C3)c1	1801788324	IHZJLTWYZGHZHM-OCVGTWLNSA-N	442.285	1.539	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCc1c[nH]c2ncccc12	1802065546	ZYIGCKVEUSXUJP-UPHUGPLXSA-N	444.608	1.937	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](C)n1cccn1	1803008140	IGPKKMHFQSTZBV-PIEAIKFESA-N	425.493	1.216	50	20	IDGD	
CC(=O)O[C@H](C(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)C(C)C	1803143073	STCZHUMDEYEIAG-OWSLCNJRSA-N	425.913	1.275	50	20	IDGD	
C[C@H](Oc1cccnc1)C(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]1c1cccnc1	1803145846	JCATXGOKJPQKRB-QNDJGXFYSA-N	432.908	1.550	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCc1ccoc1	1803173697	XMKISEXYVGBQDH-XMYAHUOOSA-N	425.489	1.984	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)Cn2ccncc2=O)[C@@H]1c1cccnc1	1803693652	AOVMWPHHADEFRP-FUHIMQAGSA-N	431.924	1.752	50	20	IDGD	
C=CCSCC(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1804172655	DVEHDLJWRSCTHD-WIYYLYMNSA-N	439.346	1.000	50	20	IDGD	
O=C(CCNC(=O)c1ccc[nH]1)NC[C@@H]1CCN(C(=O)[C@@H](F)Cl)[C@H]1c1cccnc1	1804460350	FZYMAOQJWGLJMR-JCGIZDLHSA-N	435.887	1.770	50	20	IDGD	
COC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@@H]1c1cccnc1	1806377682	RSZQQDKMHIJYNR-MAZHCROVSA-N	430.274	1.731	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)C2=CCCS2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807358999	BXEOSUKJEMVYKY-YLJYHZDGSA-N	437.330	1.102	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)[C@@H]2CNC(=O)O2)[C@@H]1c1cccnc1	1812774531	XNZFJKIXKXSOTM-CBBWQLFWSA-N	439.310	1.369	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)Cn2ccccc2=O)[C@@H]1c1cccnc1	1812865419	YBCQQMJEGFFVDN-ZSZQSSIHSA-N	447.333	1.733	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)C(F)(F)Cl)[C@@H]1c1cccnc1	1813072549	DASOPQZEMUXMML-XJKSGUPXSA-N	431.871	1.292	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2ccc(C(N)=O)cc2)[C@H]1c1cccnc1	1813739024	CJCRVVJHPFNHJU-CEXWTWQISA-N	444.919	1.754	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H]3CCC(=O)N3)sc2C1	1814410618	HDLYIOJVMMYKTQ-WCABBAIRSA-N	429.340	1.507	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCCC[C@H]1c1cc(NC(=O)CCN2C(=O)C=CC2=O)n[nH]1	1815472393	YRRPNSNBXCDMLG-HNNXBMFYSA-N	447.568	1.568	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)Cc3nnc(C)s3)sc2C1	1815583611	MHEGOTPWZNAQET-ZJUUUORDSA-N	429.955	1.712	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@H](F)Br)[nH]n1)c1ccc(O)nn1	1816297866	JZGUQVQIQFULHZ-GWCFXTLKSA-N	427.234	1.902	50	20	IDGD	
COc1cc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@@H](F)Br)CC3)nn1C	1821771838	DWKCNUASEYMGES-JMCQJSRRSA-N	446.302	1.802	50	20	IDGD	
CC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)C1(N3CCN(C)CC3)CC1)CC2	1822849317	HVRGAZZUIWZQOD-KBPBESRZSA-N	440.013	1.853	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H]1CCNC(=O)C1)CC2	1822869916	OYKOFXKIPMABBY-GBNMTWHSSA-N	433.361	1.818	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H]3CCC(=O)N3C)sc2C1	1823043055	QCMQABVLBRXSMB-FOGDFJRCSA-N	443.367	1.707	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC([C@H]2CCCCN2C(=O)CN2C(=O)CNC2=O)CC1	1824899614	AGCUNMBCTFCXNT-MRXNPFEDSA-N	438.601	1.009	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H](C)CN)CC1	1826792417	MUOJCUGUNIGLLG-GBYGFOPDSA-N	430.553	1.335	50	20	IDGD	
O=C(CCc1ccccn1)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827056570	YSQMJTSFXDLJOH-HSZRJFAPSA-N	449.360	1.628	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(Cl)ccc3F)CCO2)C1	1830192024	MMRJWJFLSCJDDI-KXBFYZLASA-N	449.306	1.803	50	20	IDGD	
C[C@@H](Nc1nccs1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830358050	OSHWZHNNCVDCEH-KUHUBIRLSA-N	444.985	1.665	50	20	IDGD	
Cc1cccn2ncc(C(=O)N3CCOC[C@]4(C3)CN(C(=O)C(C)(C)CCl)CCO4)c12	1830365734	GSFQGXCADXBAQC-QFIPXVFZSA-N	448.951	1.978	50	20	IDGD	
COc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)c(Cl)c1	1830737988	JMNRCTRMTGIJOU-VQIMIIECSA-N	447.315	1.018	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccn4nccc4c3)C2)C1	1831650257	GJZRYCQFCAFQFL-RXVVDRJESA-N	434.924	1.812	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4ncnn4c3)C2)C1	1831650365	GVTMSVSPGVBZQD-OXQOHEQNSA-N	435.912	1.207	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(C)n4ccnc4n3)C2)C1	1831654240	RRFWVVFQRPYSKD-IIBYNOLFSA-N	449.939	1.515	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cnccc2F)CC1	1831871234	NPJJOEHSBUNZHP-LJQANCHMSA-N	433.528	1.827	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)CCc2ccoc2)CC1	1832343517	QNNJMKQJUPOXNA-JOCHJYFZSA-N	438.333	1.826	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cccc4cc[nH]c34)CC2)CC1)[C@@H](O)CCl	1833310111	IVEQZOWZDYYWHT-IBGZPJMESA-N	432.952	1.953	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)/C=C\C(=O)NC3CC3)CC2)CC1	1833533851	SOMYIDJODUSXAX-RURPWVQCSA-N	439.000	1.800	50	20	IDGD	
CN(C)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1833658751	PPAHERQXPCADAW-NRFANRHFSA-N	438.956	1.483	50	20	IDGD	
Cc1cnc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCBr)C3)C2)s1	1833799524	VJEYKLRCXPWDPM-MRXNPFEDSA-N	432.340	1.307	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3cnccn3)CC2)CC1	1834124096	AGXMOFVEGVWIPO-MRXNPFEDSA-N	438.370	1.835	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)COCCOC)CC2)CC1	1834566646	AYBWIODFDDXCBE-KRWDZBQOSA-N	448.402	1.395	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cnc4[nH]ncc4c3)CC2)CC1	1835526499	KEKYVLKCXFCYBG-GOSISDBHSA-N	448.955	1.397	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3cccnn3)CC2)CC1	1835895389	PWDCAFKUNOWNCR-MRXNPFEDSA-N	438.370	1.835	50	20	IDGD	
Cc1nn(C)c(C)c1CC(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836720056	HNWJPPQXKBIXPG-LJQANCHMSA-N	440.972	1.178	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3nnc(-c4ccccc4)o3)CCO2)C1	1837537610	ZGKLYUBFZCOTCI-IIBYNOLFSA-N	448.907	1.824	50	20	IDGD	
Cc1cncc(CCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)CO[Si](C)(C)C)CCO3)c1	1837710117	JDYVLAWNCMJDIB-JOCHJYFZSA-N	449.624	1.631	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3c(F)cncc3F)CCO2)C1	1838161678	PMDBFTZYQMAEEX-IBGZPJMESA-N	431.867	1.695	50	20	IDGD	
O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)c1c(F)cccc1F)CCO2	1838861840	HTTWVNWHSRPWPW-SFHVURJKSA-N	447.276	1.820	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)NC(=O)OC(C)(C)C)C2)C1	1839141397	HACTWIDWFJQNAH-AVYPCKFXSA-N	447.960	1.373	50	20	IDGD	
Cc1ncc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)s1	1839152601	FMWQHZQKWFLJMW-SJORKVTESA-N	436.361	1.758	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(C)cc(F)c3)CCO2)C1	1839285546	DEZDMEPAXJHQRU-FXAWDEMLSA-N	428.888	1.458	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCBr)C3)C2)ccc1O	1839307358	IDKQGKSTVDUEPB-LJQANCHMSA-N	441.322	1.556	50	20	IDGD	
Cc1ccn2c(C(=O)N3CCO[C@]4(COCCN(C(=O)C(C)(C)CCl)C4)C3)cnc2c1	1839600953	WVBDVJGGWAUTIW-JOCHJYFZSA-N	448.951	1.978	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1[C@H]3C=CS[C@H]31)CCO2	1839700102	FQSWEAVADVZNAQ-JQIDMEAISA-N	431.352	1.101	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C[C@@H](C)c3ccccc3)C2)C1	1840156555	VBTLIPYQGAQNJN-ZWCUEREDSA-N	438.952	1.890	50	20	IDGD	
O=C(c1c[nH]c2cc(Cl)ccc12)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843013977	KCWFLECWCGKMLS-UHFFFAOYSA-N	437.692	1.632	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](CC1CC1)C(=O)N1CCCC12CN(C(=O)[C@H](O)CCl)C2	1846297314	BWXFWWMSFACVIN-HUUCEWRRSA-N	429.945	1.483	50	20	IDGD	
CCOC(=O)c1ccc(C(=O)N2CC3(CCCN3C(=O)CCC(=O)NN(C)C)C2)cc1	1846385664	GCHHUHQGTVTZKC-UHFFFAOYSA-N	430.505	1.053	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC2(CCCN2C(=O)CCn2cncn2)C1	1846545295	PVVNVFHIPZYJNZ-AWEZNQCLSA-N	440.932	1.004	50	20	IDGD	
O=C(Cc1c(F)cccc1Cl)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cccc(B(O)O)c1	1847416774	LXSTUCFMBHUOBH-OALUTQOASA-N	430.672	1.217	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](CCO)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CCBr	1847639217	GJDNTDRNVVQENN-RDBSUJKOSA-N	448.358	1.249	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CCOCCOCCOCCOC	1847870184	NMOUQDCQTVKSQC-QYZOEREBSA-N	448.988	1.682	50	20	IDGD	
CCc1cc(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)n[nH]1	1848099603	OWNVENSSRAAQOF-JYJNAYRXSA-N	439.944	1.920	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)c1cn(Cc2ccccc2)nc1-c1cccnc1	9930725	FHVOMTQAWHSWDL-KRWDZBQOSA-N	439.497	1.189	50	20	IDGD	
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCC(=O)NNC(=O)c1ccc(C)cc1	15345575	NNQNUBZHHCOIBI-FQEVSTJZSA-N	436.468	1.528	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCCC2)cc1	15884617	XQEXNXAGJFIOPH-UHFFFAOYSA-N	447.513	1.710	50	20	IDGD	
O=C(NNC(=O)C1CCN(S(=O)(=O)c2ccccc2)CC1)c1cccc([N+](=O)[O-])c1	17329685	GPWLMBIMEBSXCR-UHFFFAOYSA-N	432.458	1.457	50	20	IDGD	
CC(=NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1ccc2c(c1)OCCO2	254579620	XZNPUOSVEUZBCX-UHFFFAOYSA-N	445.497	1.633	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cc(F)c(F)cc2[N+](=O)[O-])cc1OC	725936246	WDKXXRPFNUMOOI-UHFFFAOYSA-N	439.327	1.508	50	20	IDGD	
COCCCNC(=S)N(C)NC(=O)c1ccc(S(=O)(=O)N2CCC[C@H](C)C2)cc1	726077303	VOBLCWPWAKFAKR-HNNXBMFYSA-N	442.607	1.595	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@H]2CCOc3c(OC)cccc32)c2ccccc2c1=O	726274546	RGVHCOVCCGXVMW-INIZCTEOSA-N	437.456	1.893	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)NC2CC2)c1)c1cccc(OC(F)F)c1	728488437	XSFZLFLSUOBHLX-UHFFFAOYSA-N	425.413	1.804	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)[C@@H]1CCCN1C(=O)c1ccc(Br)cc1	728852493	CTCUMAJUDOICLT-INIZCTEOSA-N	431.290	1.839	50	20	IDGD	
O=C(NNC(=O)[C@@H](c1ccccc1)N1CCSCC1)C1CCN(c2ncccn2)CC1	728889643	DNUGHXRDUJTRDA-LJQANCHMSA-N	440.573	1.631	50	20	IDGD	
COc1ccccc1CC(=O)N1CCC(NC(=O)NNC(=O)c2cccc(C#N)c2)CC1	729049099	LTVSNVUJHFOGDD-UHFFFAOYSA-N	435.484	1.745	50	20	IDGD	
O=C(CCCCN1CCCC1)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	729295525	LTACUQLSZOGOAX-UHFFFAOYSA-N	436.578	1.888	50	20	IDGD	
COc1cccc(C(=O)NNS(=O)(=O)c2cc(C)cc(S(C)(=O)=O)c2C)c1O	730203226	JUKUQLPYJICOIJ-UHFFFAOYSA-N	428.488	1.044	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)[C@H]1CCCN(S(=O)(=O)Cc2ccccc2)C1	731328712	UIUIUMGLOLEGIM-SFHVURJKSA-N	433.505	1.758	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)[C@@H](CCSC)N1C(=O)c2ccccc2C1=O	731492274	FJIJWEXDCBZWKS-MRXNPFEDSA-N	427.482	1.874	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)CCCCOc2cccc(C#N)c2)c1	732050745	IVORYTWFBSMCKV-UHFFFAOYSA-N	444.513	1.819	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2c(C)oc(C)c2S(N)(=O)=O)cc1Br	732174754	DEFTXQCRVGWMNI-UHFFFAOYSA-N	446.279	1.390	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)[C@@H]1CCCN1C(=O)c1ccc2c(c1)OCO2	732302921	ATBQNOKMCYDEBJ-HNNXBMFYSA-N	431.470	1.567	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)N[C@H](Cc2ccccc2)CN2CCOCC2)c1	732476729	UWBPLQDCIKMZBU-HXUWFJFHSA-N	426.517	1.648	50	20	IDGD	
C[C@]1(CNC(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)CCOC1	733653001	BGTHLUPGBHJMGW-HSZRJFAPSA-N	435.484	1.815	50	20	IDGD	
CC(C)C(=O)Nc1cccc(F)c1C(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	734033885	GOPLFPQRKHEBHK-UHFFFAOYSA-N	446.391	1.946	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)C1	734169130	MYOBDAYYAPJGHQ-MRXNPFEDSA-N	447.540	1.423	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)CN1C(=O)COc2ccccc21	734250741	HFTBUEGJJDQRTL-UHFFFAOYSA-N	432.502	1.632	50	20	IDGD	
CC(C)C(CNC(=O)c1ccc([N+](=O)[O-])cc1)=NNC(=O)Cc1cc(O)nc(S)n1	734746445	LBZNJMHFGYKWLX-UHFFFAOYSA-N	432.462	1.480	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)CCc2c[nH]c3ccccc23)CC1	735117613	ZHTLHAGDVWLFSN-UHFFFAOYSA-N	442.545	1.575	50	20	IDGD	
C[C@@H](CN1CCN(c2ccccn2)CC1)NC(=O)NNC(=O)[C@@H](C)Oc1ccccc1F	735585262	CTOYGFKNLKUKAJ-DLBZAZTESA-N	444.511	1.529	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCc2nc(-c3ccc(F)cc3)n[nH]2)nc1	741416266	NRVCXQVDNNKAOK-UHFFFAOYSA-N	448.484	1.519	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CN2CCc3ccc(S(=O)(=O)N4CCCC4)cc32)cc1	741801303	IUCDGSBAJMHCEI-UHFFFAOYSA-N	442.541	1.603	50	20	IDGD	
CN(C)C(=O)CS(=O)(=O)c1ccc(C(=O)NNC(=O)C(C)(C)c2ccccc2)cc1	741924110	BUQWPMQXQUCZNK-UHFFFAOYSA-N	431.514	1.287	50	20	IDGD	
COc1ccccc1-n1cc(S(=O)(=O)NNC(=O)c2cc(Br)c[nH]2)cn1	743251712	TYBOXUCAXPAABQ-UHFFFAOYSA-N	440.279	1.595	50	20	IDGD	
O=C1C[C@H](Cc2ccc(C(=O)NNc3ccc(S(=O)(=O)C(F)F)cc3)cc2)C(=O)N1	743334569	ASGIBWHMKFMRAV-ZDUSSCGKSA-N	437.424	1.645	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)N[C@H]2CCCN(S(C)(=O)=O)C2)cc1Cl	743563070	LQBASYKEBIIUJL-JTQLQIEISA-N	449.917	1.117	50	20	IDGD	
COC[C@H]1CN(C(=O)NNC(=O)[C@H]2Cc3ccccc3CN2Cc2ccccc2)CCO1	743573805	IUCWWBUBPKIDQA-FGZHOGPDSA-N	438.528	1.702	50	20	IDGD	
Cc1c(/C=C(\C#N)C(=O)O[C@@H](C)C(=O)N2CCN(c3ncccn3)CC2)cc(C#N)n1C	744632862	QGGCZIOIXGWPND-GYKGCMEESA-N	433.472	1.183	50	20	IDGD	
O=C(NCC1(N2CCSCC2)CCCCC1)NNC(=O)c1cc([N+](=O)[O-])ccc1O	745815286	ILWGTKZIFIUZIJ-UHFFFAOYSA-N	437.522	1.996	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)NCCC(=O)NNC(=O)c2ccc(Cl)cc2F)cc1	747513388	AEVHMKYVXMVWNT-UHFFFAOYSA-N	441.868	1.811	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc2c(c1)nc(CCC(=O)NNC(=O)c1ccc[nH]1)n2C	747662946	REZJWFZMCZWSLJ-UHFFFAOYSA-N	446.533	1.326	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)c1ccc(S(=O)(=O)CCCC#N)cc1	748344005	QTAGJAAXINMLMT-UHFFFAOYSA-N	431.470	1.613	50	20	IDGD	
Cc1cc(C(=O)NNc2ccccc2S(=O)(=O)NC(C)(C)C)ccc1S(N)(=O)=O	748592997	COSLOPGHVGJQSY-UHFFFAOYSA-N	440.547	1.476	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3cc(F)c(F)c(F)c3)cc2)CC1	748619923	MYTAMHDBQHGDPD-UHFFFAOYSA-N	428.436	1.797	50	20	IDGD	
CNS(=O)(=O)C[C@@H]1CCCN1C(=O)/C(C#N)=C/c1cc(C)n(C[C@H]2CCCO2)c1C	749510090	KKNWYRIVLZUHSH-FPZBBQJASA-N	434.562	1.731	50	20	IDGD	
CN(C(=O)OC(C)(C)C)[C@@H]1CCN(C(=O)NNC(=O)CNC(=O)c2cccs2)C1	750274569	GJQQLGIBIQLIMI-GFCCVEGCSA-N	425.511	1.160	50	20	IDGD	
Cc1cnc([C@H](C)NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)s1	750665345	VVQSFVFNKVBRJW-ZDUSSCGKSA-N	437.547	1.941	50	20	IDGD	
CCOC(=O)[C@H]1Cc2cc(S(=O)(=O)NNC(=O)Cn3ccc4ccccc43)ccc2O1	751547690	MASULLBXIKPGMB-LJQANCHMSA-N	443.481	1.518	50	20	IDGD	
CO[C@H](C)c1nc(CN2CCCN(C(=O)NNC(=O)Cc3cccnc3)CC2)cs1	752369954	LYXBNTATQKZKHZ-OAHLLOKOSA-N	432.550	1.737	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)NC[C@@H]2CCC[C@]23NC(=O)N(C)C3=O)c1C	752726584	WFECILJKZYOGMC-UKWNFHBSSA-N	427.505	1.495	50	20	IDGD	
CCN1CCN(c2ccc(Cl)cc2NC(=O)NNC(=O)[C@@H](C)OCCOC)CC1	755447028	UYOPERADVPXRDS-CQSZACIVSA-N	427.933	1.686	50	20	IDGD	
COc1ccc(CN2C(=O)c3ccccc3C2=O)cc1C(=O)NNc1ccc(C(N)=O)nn1	757391012	GLTWPUKMUZYDKA-UHFFFAOYSA-N	446.423	1.137	50	20	IDGD	
COCC[C@@H](Cc1cccc(Br)c1)C(=O)NNC(=O)C(=O)Nc1ccccn1	758835749	YNXWKIHSJLECPQ-AWEZNQCLSA-N	449.305	1.825	50	20	IDGD	
CC(C)C[C@@H](CCC(=O)NNC(=O)c1ccccn1)C(=O)NNC(=O)c1ccccn1	759109027	IIIALJHIEDQEJB-OAHLLOKOSA-N	426.477	1.141	50	20	IDGD	
CCS(=O)(=O)Nc1cc(OC)ccc1S(=O)(=O)NNC(=O)c1ccccc1F	761267332	QPJQHANAZZDKEM-UHFFFAOYSA-N	431.467	1.219	50	20	IDGD	
O=C(COC(=O)c1cccc([C@H]2CCOC2)c1)NNC(=O)[C@H]1COc2ccccc2O1	761546912	IKLWKXLMNCCLRM-QFBILLFUSA-N	426.425	1.335	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)NCc2ccc(S(=O)(=O)Nc3ccc(F)cc3)cc2)cn1	762393815	PVNQQOLCEPBARJ-UHFFFAOYSA-N	446.464	1.504	50	20	IDGD	
COCCOc1ccc(Br)cc1NC(=O)C(=O)NNC(=O)c1ccccc1	763424468	ADKBDJJJNLZPKP-UHFFFAOYSA-N	436.262	1.874	50	20	IDGD	
CCOc1ccc(C#N)cc1NC(=O)C(=O)NNC(=O)c1cc(OC)c(OC)c(OC)c1	763539626	OHJABIQHZCYHND-UHFFFAOYSA-N	442.428	1.382	50	20	IDGD	
CCOCCOc1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)c1ccc2c(c1)OCO2	763547518	CRPSAGJDRGPSIP-UHFFFAOYSA-N	449.847	1.884	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)N1CC2(CCC2)c2c(F)cccc21	763569703	AKBXPSGGLXZYCN-QGZVFWFLSA-N	425.416	1.581	50	20	IDGD	
C[C@@H]1COCCN1c1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)cc1	763599903	AKRDEOWLHGWOEF-OAHLLOKOSA-N	448.483	1.702	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2ccc(C)c(C(=O)N(C)C)c2)c1	763644124	GJAGRBKLEOFVAK-UHFFFAOYSA-N	426.473	1.479	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)N[C@H]1CCCC[C@H]1N1CCOCC1	763661411	WFLSJLBPSWUVLA-DLBZAZTESA-N	428.493	1.165	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(C(=O)NC)c(Cl)c1	763716765	MCHDRKPKHUNFRX-UHFFFAOYSA-N	432.864	1.427	50	20	IDGD	
NC(=O)CCSc1ccccc1NC(=O)C(=O)NNC(=O)C12CC3CC(CC(C3)C1)C2	763733370	FHQIQGQFWFOIRG-UHFFFAOYSA-N	444.557	1.956	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2cccc(Cl)c2-n2cccn2)c1	763773274	URALZBBOMMHICX-UHFFFAOYSA-N	443.847	1.943	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCC3)ccc1N1CCCC1=O	763784012	SRSHODOPUHGTMU-UHFFFAOYSA-N	442.497	1.772	50	20	IDGD	
Cc1nc2cc(C(=O)NNC(=O)CNC(=O)c3cccnc3)ccc2n1-c1ccccc1	763824315	HPAHIHZRTWAJLT-UHFFFAOYSA-N	428.452	1.920	50	20	IDGD	
C[S@](=O)Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)ccc1Cl	763837231	AZVIDYSUFKSSCW-LJAQVGFWSA-N	441.868	1.523	50	20	IDGD	
Cc1cc(N2CCOCC2)ccc1NC(=O)C(=O)NNC(=O)COc1ccc(F)cc1	763839745	LJTNDQYKTURPPG-UHFFFAOYSA-N	430.436	1.136	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccccc2-c2noc(C)n2)cc1OC	763900207	BQPTZXCXVIVECO-UHFFFAOYSA-N	439.428	1.852	50	20	IDGD	
COc1ccc(Cl)c(NC(=O)C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)c1	763943341	GCLNDFUVZJPYSS-UHFFFAOYSA-N	429.820	1.640	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)C(=O)Nc1ccc(-c2ccc[nH]2)cc1	763944017	JXFXOUOPUQQEMO-UHFFFAOYSA-N	430.424	1.973	50	20	IDGD	
CC(C)n1ncc2ccc(NC(=O)C(=O)NNC(=O)c3nn(-c4ccccc4)cc3O)cc21	763949507	PHFJPPOJTHZGRC-UHFFFAOYSA-N	447.455	1.908	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)Nc1cc(F)ccc1OC(F)F	764004863	PJCKCXUKKCROGC-UHFFFAOYSA-N	449.183	1.928	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2ccc(N3CCSCC3)cc2)cc1	764124622	MJQCUTNWTMZUNA-UHFFFAOYSA-N	442.541	1.967	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(-c3n[nH]c(C)n3)c2)o1	764139273	QPVRCHNXTGFTHP-UHFFFAOYSA-N	439.476	1.615	50	20	IDGD	
O=C(NNC(=O)c1ccoc1)C(=O)Nc1cccc(CS(=O)(=O)C2CCCCC2)c1	764162949	GFGCXXWBAMQNPR-UHFFFAOYSA-N	433.486	1.927	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)C(=O)Nc1ccc(Br)nc1	764203444	MDFRONOARLWKFG-UHFFFAOYSA-N	444.286	1.235	50	20	IDGD	
Cc1nc(C)n(-c2ccccc2NC(=O)C(=O)NNC(=O)c2cccc(OC(F)F)c2)n1	764259105	CMSJVCKIOFUFFQ-UHFFFAOYSA-N	444.398	1.885	50	20	IDGD	
CN(C)C(=O)C[C@@H]1CN(C(=O)C(=O)NNC(=O)Cc2ccccn2)c2ccc(Cl)cc21	764264587	QANANMSMWSRKDJ-CYBMUJFWSA-N	443.891	1.034	50	20	IDGD	
CCN(CC)C(=O)c1ccccc1NC(=O)C(=O)NNC(=O)COc1ccccc1O	764276838	CCOSCRUVGFKRJL-UHFFFAOYSA-N	428.445	1.039	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)C(C)(C)c2ccccc2)c(OCC(=O)N(C)C)c1	764302964	QHUCZPOXSCKHFL-UHFFFAOYSA-N	440.500	1.526	50	20	IDGD	
Cc1ccnn1-c1ccccc1NC(=O)C(=O)NNC(=O)c1cnn(-c2ccccc2)c1	764342789	JSPBUYNTYDIMQM-UHFFFAOYSA-N	429.440	1.766	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)N3CCSCC3)cc2C)o1	764371552	PBNRNBFCUNWXNH-UHFFFAOYSA-N	430.486	1.485	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2cccs2)[nH]n1)C(=O)N1C[C@@H]2CCCN2c2ccccc21	764383207	YDXVGJAICVNSNI-ZDUSSCGKSA-N	436.497	1.915	50	20	IDGD	
CCc1nnc(-c2cccc(NC(=O)C(=O)NNC(=O)CSc3ccccc3O)c2)o1	764404549	LFPDDGCMHWDBSN-UHFFFAOYSA-N	441.469	1.883	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)C(=O)Nc2cc(C)n(-c3ccc(C)cc3)n2)c1	764430766	PEZFYCHXHNNUAS-UHFFFAOYSA-N	435.444	1.242	50	20	IDGD	
COc1nccnc1NNC(=O)c1ccc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1	764469982	BABHKXCZHUTWBM-UHFFFAOYSA-N	444.429	1.951	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)[C@H](C)S(=O)(=O)C2CCOCC2)c(C)n1-c1ccccc1	764519789	FSQCVTGVDVBWLW-INIZCTEOSA-N	433.530	1.837	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C[C@@H]1CN(C(=O)OC(C)(C)C)CCO1	764565219	ZQMNSZGXFWGTCI-XJKSGUPXSA-N	425.457	1.766	50	20	IDGD	
CC(CC1CCOCC1)=NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1	764817831	IYKHEXOQLQIPFY-UHFFFAOYSA-N	436.578	1.610	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)COc2ccc(N(C)S(=O)(=O)c3cccs3)cc2)n[nH]1	765586947	GBWQBUPOLLYBSJ-UHFFFAOYSA-N	449.514	1.445	50	20	IDGD	
C#CCOc1ccc(C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)cc1	765755090	DCSFARGXFHNLFT-UHFFFAOYSA-N	440.931	1.931	50	20	IDGD	
CS(=O)(=O)c1cc(C(=O)NNC(=O)COc2ccc(Br)cc2)cs1	766294659	LNRWWFJXEXAUNP-UHFFFAOYSA-N	433.305	1.754	50	20	IDGD	
O=C(CSc1nncs1)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	766667859	DPAKSYVUPUDNLI-UHFFFAOYSA-N	440.982	1.249	50	20	IDGD	
O=S(=O)(CBr)N1CCN(S(=O)(=O)Cc2ccc(F)cc2F)CC1	767851115	NYPYBIVYFRNKNI-UHFFFAOYSA-N	433.296	1.094	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc(Br)c(C)n(C)c2=O)cc1C	768180558	MYDNOASRKOTAAD-UHFFFAOYSA-N	435.278	1.473	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2ccc(OCC(F)(F)F)cn2)cc1	768223824	FGNSUBYCDPSULD-UHFFFAOYSA-N	432.380	1.893	50	20	IDGD	
C[C@H](C(=O)NNc1c(F)cc(C(=O)NC2CC2)cc1F)S(=O)(=O)C1CCOCC1	768242656	HCWQNAYDPDMGRN-SNVBAGLBSA-N	431.461	1.282	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)[C@H](Br)C(C)(C)C)cc2)CC1	768310539	DGKPBORTWWEVEI-HNNXBMFYSA-N	447.399	1.875	50	20	IDGD	
CCNC(=O)N(C)NC(=O)[C@]12CCC(=O)N1c1ccccc1C(=O)N2Cc1ccccc1	768412999	NBLYQQIMHQMMGU-QHCPKHFHSA-N	435.484	1.858	50	20	IDGD	
C[C@]1(NNC(=O)N[C@@H]2CC(=O)N(Cc3ccccc3C(F)(F)F)C2)CCS(=O)(=O)C1	768519194	LUVMHOAOGFAJQJ-DYVFJYSZSA-N	448.467	1.187	50	20	IDGD	
N#Cc1cc(Cl)nc(NNC(=O)[C@@H]2CCCC[C@@H]2C(=O)N[C@@H]2CCS(=O)(=O)C2)c1	769055354	GJTPJNDQOHHIOY-HZSPNIEDSA-N	439.925	1.159	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)NC1CCN([C@@H]2CCCC[C@@H]2O)CC1	769159631	DYNUFGDBBVBZCK-MSOLQXFVSA-N	442.520	1.290	50	20	IDGD	
COC(=O)c1cn([C@@H]2CCN(C(=O)NNC(=O)[C@@H](C)Oc3cccc(Cl)c3)C2)nn1	770648493	RNHMJZYKLCCDGD-DGCLKSJQSA-N	436.856	1.173	50	20	IDGD	
C[C@H]1CCCCN1S(=O)(=O)c1ccc(C(=O)NNc2nc(O)c3cnn(C)c3n2)cc1	770972895	KKXXTVNLNGGEGT-LBPRGKRZSA-N	445.505	1.389	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)c1ccc(OC2CCOCC2)cc1	772192196	KXGSUSZCTJJWIY-UHFFFAOYSA-N	431.876	1.975	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)c([N+](=O)[O-])cc1OC	772898291	PTTKMLDWDKRQGK-UHFFFAOYSA-N	436.808	1.343	50	20	IDGD	
COC(=O)[C@@H]1CN(C(=O)C(=O)NNc2ncc(Cl)cc2Cl)c2ccccc2O1	773677772	JRIIQICLSOHPKI-ZDUSSCGKSA-N	425.228	1.799	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ncn(C2CCCCC2)n1	774002567	RQQPWEFZFAVAAL-LBPRGKRZSA-N	434.884	1.990	50	20	IDGD	
CC[C@@H](NCC(=O)NNC(=O)c1ccccc1Cl)c1ccccc1OCC(=O)NC	775128048	FTBFKRMWUMEWOH-QGZVFWFLSA-N	432.908	1.967	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)c1cccc([N+](=O)[O-])c1N1CCOCC1	776291779	YVTDSCGMYABWQB-ZDUSSCGKSA-N	432.408	1.799	50	20	IDGD	
COc1nc(C)c(Br)cc1C(=O)NNC(=O)c1nnc(O)c2ccccc12	777087405	WZFSZYNHJWZXHT-UHFFFAOYSA-N	432.234	1.885	50	20	IDGD	
COc1cccc(NNC(=O)Nc2ccc(OC)c(S(=O)(=O)N3CCOCC3)c2)n1	780450908	BRFNXLZNNWTRLZ-UHFFFAOYSA-N	437.478	1.268	50	20	IDGD	
Cc1cc(C(=O)N2CCSCC2)ccc1NC(=O)C(=O)NNc1cncc(Cl)n1	783259937	RLRYOFUDKHWYKP-UHFFFAOYSA-N	434.909	1.709	50	20	IDGD	
NC(=O)COc1cccc(NC(=O)C(=O)NNc2ccc(F)cc2Br)c1	784803226	GTIQOXGVJANJHL-UHFFFAOYSA-N	425.214	1.534	50	20	IDGD	
O=C(NNc1ncccc1Cl)C(=O)N1C[C@H](C(=O)N2CCCCC2)Oc2ccccc21	784819796	VCQGFCZOMPSKFU-QGZVFWFLSA-N	443.891	1.985	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNc2cccc([N+](=O)[O-])c2)cccc1C(=O)N1CCOCC1	784830718	BVOJYAHEFVXAHP-UHFFFAOYSA-N	427.417	1.457	50	20	IDGD	
N#Cc1ccc(NNC(=O)C(=O)Nc2ccc(CN3C(=O)CNC3=O)cc2)cc1Cl	785094421	DUFHCUQRRDRYQD-UHFFFAOYSA-N	426.820	1.345	50	20	IDGD	
CCOC(=O)[C@](C)(CNC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)c1ccccc1	787309306	KYNYFWDSPLEKKM-OAQYLSRUSA-N	447.513	1.555	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNS(=O)(=O)c1ccc(C#N)c(Br)c1	788493600	QIJDQEGDZJLWEW-UHFFFAOYSA-N	433.284	1.155	50	20	IDGD	
Cc1ccc(-n2cccn2)cc1NC(=O)C(=O)NNC(=O)CSc1ccccc1O	789585812	GMOVXBTWWKMCBK-UHFFFAOYSA-N	425.470	1.765	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2cccc3c2OCC[C@@H]3N(C)C)c1	789731380	DGWIWMOLBAKCPJ-SFHVURJKSA-N	442.472	1.489	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(C(N)=O)c(OC(C)C)c1	789731637	DZYAUAMTSJLWLN-UHFFFAOYSA-N	442.472	1.300	50	20	IDGD	
CC[C@H]1CCc2nc(NC(=O)C(=O)NNC(=O)c3ccc4c(c3)OCCO4)sc2C1	789732012	NUCYQCQMFMTKMY-NSHDSACASA-N	430.486	1.829	50	20	IDGD	
COc1cc(NNC(=O)C(=O)Nc2cccc(C(=O)N3CCOCC3)c2)ccc1Cl	789804981	VGQMDYSXSLYARF-UHFFFAOYSA-N	432.864	1.903	50	20	IDGD	
O=C(COC(=O)[C@@H]1CCS(=O)(=O)c2ccccc21)NNC(=O)c1cccc(Cl)c1	792816499	FDUCBCMKVROBQZ-OAHLLOKOSA-N	436.873	1.605	50	20	IDGD	
CC(C)C(CS(=O)(=O)N(C)C)=NNC(=O)c1ccc(CSc2nncn2C)cc1	794860858	QUDUGKFROJKNMX-UHFFFAOYSA-N	438.579	1.741	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(C)c(OCC3CCOCC3)c2)n1	797370958	NAOXXWIRSKEUQA-UHFFFAOYSA-N	426.473	1.904	50	20	IDGD	
O=C(NCCCNS(=O)(=O)c1ccccc1Cl)NNC(=O)c1ccccc1F	798493251	PCMYCIDUTOGASH-UHFFFAOYSA-N	428.873	1.792	50	20	IDGD	
CC(CC(C)(C)c1c[nH]c2ccccc12)=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O	799473805	ADPIVERUPHGOBP-UHFFFAOYSA-N	442.545	1.912	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NCCS(=O)(=O)CCc1ccccc1	800756925	QJFMGYJFNXKECU-OAHLLOKOSA-N	437.493	1.581	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2CN(C(=O)OC(C)(C)C)CCC2(F)F)cc1	801109758	AMCKIZIHBQUFKZ-AWEZNQCLSA-N	440.447	1.973	50	20	IDGD	
O=C(NNC(=O)c1cc(I)ccc1-n1cnnn1)Nc1ccccc1	801988775	PNUZQTPRXXHYEM-UHFFFAOYSA-N	449.212	1.733	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)c2cc(C)c3c(O)nc(O)nc3n2)c(OC)cc1Cl	802081478	QEMOFFCTCCWDHI-UHFFFAOYSA-N	448.823	1.882	50	20	IDGD	
COc1ccc(S(=O)(=O)C[C@@H](C)C(=O)NNC(=O)Nc2ccc3c(c2)OCO3)cc1	802105003	NUDHPUOFZSWYLR-GFCCVEGCSA-N	435.458	1.687	50	20	IDGD	
O=C(Cn1nnc(-c2ccccc2)n1)NN=Cc1cn2ccc(Br)cc2n1	811631345	VGLNMCCAJCBLFF-UHFFFAOYSA-N	425.250	1.901	50	20	IDGD	
Cc1cnc(Br)c(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)c1	812979448	ULGFVQPDLVMWHQ-SNVBAGLBSA-N	439.241	1.845	50	20	IDGD	
Cc1cccc(C(C)C)c1NNC(=O)C(=O)Nc1cccn(CCS(C)(=O)=O)c1=O	813048412	WDGMLOYBQOCNNZ-UHFFFAOYSA-N	434.518	1.407	50	20	IDGD	
O=C(NNc1nc[nH]n1)C1CCN(S(=O)(=O)c2cccc(OC(F)(F)F)c2)CC1	816634898	WFWOLMKFVMBHJO-UHFFFAOYSA-N	434.400	1.247	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)CCNS(=O)(=O)c1ccc(C)c(C)c1	825615149	KJWAFRCKSRHNFV-UHFFFAOYSA-N	434.518	1.240	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)[C@@H]1CC(=O)N(c2cc(C)ccc2OC)C1	825624009	BBICQGQMMSTEPI-OAHLLOKOSA-N	426.473	1.625	50	20	IDGD	
O=C(NNc1ncccn1)c1ccccc1NS(=O)(=O)c1ccc2nc(O)[nH]c2c1	913044137	RQTVDXHIZZTLIU-UHFFFAOYSA-N	425.430	1.616	50	20	IDGD	
Cn1ccnc1[C@@H](NC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)c1ccccc1	916220727	YDHGJOCIMDZEJI-KRWDZBQOSA-N	427.486	1.557	50	20	IDGD	
COc1ccc(C(=O)NN=C(C)c2ccc(S(=O)(=O)NCCC(=O)O)cc2)cc1OC	916288771	FFURHFZJCRZYST-UHFFFAOYSA-N	449.485	1.611	50	20	IDGD	
COc1cc(CNC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)ccc1OC(C)C	916393387	KCDLPHBJAAFQPK-UHFFFAOYSA-N	439.472	1.874	50	20	IDGD	
CC1CCN([C@@H](CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)C(C)C)CC1	916440071	YKUSSSHROJNUMF-KRWDZBQOSA-N	438.598	1.680	50	20	IDGD	
O=C(NCCCN1CCN(Cc2ccccc2)CC1)NNC(=O)c1cccc([N+](=O)[O-])c1	916485841	JBZKFKCSSMOOQD-UHFFFAOYSA-N	440.504	1.747	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)NC[C@H](c1ccccc1)N1CCOCC1	916511196	MNCVNOACQFOCQD-GOSISDBHSA-N	443.460	1.378	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)NCc2ccc(S(=O)(=O)N(C)C)cc2)c2ccccc2n1	916646771	MSATZMNIYXSBMM-UHFFFAOYSA-N	441.513	1.938	50	20	IDGD	
CCC(=O)Nc1cccc(C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)c1	916736523	WUGAIYGMQMTVMR-UHFFFAOYSA-N	432.502	1.425	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)CCNS(=O)(=O)c3ccc(F)cc3)n[nH]2)cc1	917178550	VPGAVYFEKFHNFD-UHFFFAOYSA-N	445.476	1.654	50	20	IDGD	
O=C(Cc1csc(N2CCOCC2)n1)NN=Cc1c[nH]nc1-c1ccc2c(c1)OCO2	917542717	NEJYWUICCASTSJ-UHFFFAOYSA-N	440.485	1.791	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1	918001746	HIYXUGSEIVIJPN-QGZVFWFLSA-N	449.515	1.489	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)c1ccc2c(c1)S(=O)(=O)N(C[C@@H]1CCCO1)C2=O	918550178	LHPPTSKKEKYGQX-HNNXBMFYSA-N	443.481	1.393	50	20	IDGD	
O=C(CN1C(=O)Cn2c(cc3ccccc32)C1=O)NNC(=O)c1cc(Br)c[nH]1	920274844	YRGRMRZGLPCMGC-UHFFFAOYSA-N	444.245	1.176	50	20	IDGD	
Cn1c(O)nc2cc(C(=O)NNC(=O)c3ccc(S(=O)(=O)N4CCCC4)cc3)ccc21	920284801	IMUJYKVJTPNYGD-UHFFFAOYSA-N	443.485	1.138	50	20	IDGD	
CCOc1ccc(OCc2ccc(C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)cc2)cc1	920298644	QHULMTJHRWOXDX-AWEZNQCLSA-N	435.502	1.363	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(=O)n4c(nc3c2)CCCCC4)cc1	920300414	ANISKIKCCNTFHA-UHFFFAOYSA-N	433.468	1.831	50	20	IDGD	
CCNC(=O)[C@@H](C)NC(=O)/C(C#N)=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	920848998	KULSCEZKQJYSQZ-QQFZQELXSA-N	442.907	1.627	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CC(=O)N(c2cccc(Br)c2)C1)c1n[nH]c2c1CCCC2	1317825620	KJUXOCQOMLKJQU-LLVKDONJSA-N	446.305	1.865	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)c2ccc(CS(C)(=O)=O)cc2)CC1	1318611651	IMWZMWAQRTYSKA-UHFFFAOYSA-N	439.534	1.639	50	20	IDGD	
O=C(CC[S@](=O)c1ccc2c(c1)OCCO2)NNC(=O)c1cncn1-c1ccccc1	1323390932	NLKVZJQEDGRNGF-HKBQPEDESA-N	440.481	1.602	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnc4ccccn34)C2)C1	1777818018	SQYCJOMEPUYVNB-IFXJQAMLSA-N	435.322	1.809	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CN2CCN(C)CC2)C1	1778846644	ZTESTPDOMWOOPR-WAOWUJCRSA-N	429.005	1.155	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H]1CC(c3ccccc3)=NO1)CCO2	1779294663	WICQTNPHKPOWHT-DENIHFKCSA-N	445.592	1.861	50	20	IDGD	
COCc1c[nH]c(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](F)Br)C3)c1	1780047853	CYJNEYSVBMEEBU-IIDMSEBBSA-N	446.317	1.979	50	20	IDGD	
CC(C)(C)n1cc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)nn1	1780354615	UMMYBQXMTZCAOG-WBMJQRKESA-N	432.294	1.167	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)cc1OC	1780658159	GCWDVHGYJJYYPM-ORAYPTAESA-N	441.322	1.931	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(N4CCOCC4)cc3)CCO2)C1	1781218257	MUUVSXAOLWLGON-DENIHFKCSA-N	435.952	1.984	50	20	IDGD	
CN(C)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781327784	AANJRFAXSALCGR-RHSMWYFYSA-N	429.290	1.282	50	20	IDGD	
C/C=C(/C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2	1781716153	PRDJDTGBDPUISY-IXIAIYGASA-N	429.521	1.601	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H]2CCCOC2)C1	1783211150	XHTQPEPUJDXYRV-YYAJDYIMSA-N	431.371	1.958	50	20	IDGD	
O=C(COc1ccccc1F)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1783361877	WSLQAADUHVXOFN-WBVHZDCISA-N	433.249	1.725	50	20	IDGD	
COc1cc(F)ccc1CC(=O)N1CCO[C@]2(CCN(C(=O)[C@H](C)Br)C2)C1	1783536735	GZBQPPPQZKEQJP-ORAYPTAESA-N	443.313	1.990	50	20	IDGD	
CCSc1cccnc1C(=O)N1CCO[C@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1	1783935772	WPNAJUCGMKBHMU-NRFANRHFSA-N	449.577	1.010	50	20	IDGD	
Cc1nn(C)c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]3C2)c1F	1783969849	QEBYOQNNYMGGDC-PYJNHQTQSA-N	445.333	1.492	50	20	IDGD	
CC#C[C@@H](CC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](Cl)COC)CCO2)c1ccc(O)cc1	1784012797	CCPHBQRMBSJCPM-GREBRCKQSA-N	448.947	1.973	50	20	IDGD	
O=C(CSc1ccc(F)cc1F)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21	1784414799	ZVFCYOMBFSYNOT-YUDUHTQSSA-N	448.919	1.636	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@](C)(O)C(F)(F)F)[C@H]2C1	1784872393	UMHTTWWRYSVMKK-IAGXKZSMSA-N	445.276	1.310	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(C(=O)O)n(C(C)C)n3)[C@H]2C1	1785717018	FNFZMWZZVYUEJW-ZJOBFFGXSA-N	440.928	1.773	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)c3ccnc(F)c3)CCC2)cc1)c1ccc(B(O)O)cc1	1788140110	IKXSXJDALQQYDZ-UHFFFAOYSA-N	433.248	1.962	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CCc4nc[nH]c4C3)C[C@@H]21	1789872964	MKAJSJWXDWTOFL-WWMMRCEASA-N	443.375	1.731	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc(N)s3)C[C@@H]21	1790960888	BTMIDYUHIYMAJW-YFKTTZPYSA-N	431.356	1.492	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1ccc(C2(NC(=O)C[C@](C)(O)CC(=O)O)CCC2)cc1	1791573021	XAHXIHOJOOMGQL-BEFAXECRSA-N	426.897	1.990	50	20	IDGD	
CCOC(=O)N1CCC(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](Cl)CC)C[C@@H]32)CC1	1792144303	ZXXMZOQAKUZDKW-XSLAGTTESA-N	443.972	1.852	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1ccc(F)nc1)C2	1792868898	VMBAHQZOHYSQCI-FRQROOTJSA-N	442.329	1.774	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCl)c1nc2ccc(C(F)(F)F)cn2n1	1793109659	DSXRTZKIJUQMGI-RNJOBUHISA-N	445.829	1.600	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCl)c1cccc(OC2CCOCC2)n1	1793113731	SFRGWZKKFHVGFC-BASYENTBSA-N	437.924	1.491	50	20	IDGD	
Cn1nccc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)C2	1794786792	JTOCLIHWZFIWAI-AOWDBCOTSA-N	441.438	1.509	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2)c1nn(-c2ccccc2)c2c1COC2	1796096907	XBQANLUQJKUUQM-OESLAJAZSA-N	448.882	1.640	50	20	IDGD	
C=CC[C@@H](CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Cl)NC(=O)OC(C)(C)C	1796369761	CSFUFNOCKSBFLK-SSRUIJIPSA-N	447.935	1.970	50	20	IDGD	
CC(C)=CCCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1	1796443759	GZTNMLQJXYHQDF-ODRBZYGGSA-N	429.521	1.456	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc2c1cnn2C	1797090188	YFSBICREYYRZRY-ZDFLXESQSA-N	449.349	1.950	50	20	IDGD	
CC(=O)OC[C@@H](OC(C)=O)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](C)CBr)C2	1798470260	MUUMVIYZRROBAD-YDVLKRNPSA-N	447.326	1.150	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(C)(C)NC(=O)OC(C)(C)C)C2	1799263099	FIWAZULDTPCAQX-LXTVHRRPSA-N	431.961	1.897	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc(OC)cc1[N+](=O)[O-])C2	1799267955	GVNNIFBTYJPYKY-QHHYFVSCSA-N	439.896	1.753	50	20	IDGD	
COc1ccc([C@H](O)C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@](C)(Cl)CCl)cc1	1799273888	SOIJDOPZEGPWCX-ACSCVQKFSA-N	445.343	1.555	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=N/O[C@@H]1CCCCO1)C2	1799276495	KRIFEUILLBELED-BNDVCMTDSA-N	436.336	1.341	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3ncoc3c1)C2)[C@H](F)Br	1799347807	TUVVQKAKRBJNAW-JLUCKKNBSA-N	426.242	1.722	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(O)c(OC)c1)C2	1800642429	HPRXISMUJRIVOD-UMPJEAMMSA-N	441.322	1.778	50	20	IDGD	
COC[C@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H]1CCN1C(=O)OC(C)(C)C)C2	1802269156	DYJPBPAKDWGVTB-QRJUGERDSA-N	429.945	1.888	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)Cc2cncnc2)[C@@H]1c1cccnc1	1804654788	VBIAGSSDBVDQLL-XCRHUMRWSA-N	432.322	1.904	50	20	IDGD	
Cc1nn2cc(CC(=O)N3CCC4(CCCN(C(=O)[C@@H](O)CCl)C4)CC3)nc2s1	1805518199	PVHUMCWMEYNQKI-HNNXBMFYSA-N	439.969	1.473	50	20	IDGD	
CCC(=O)N[C@H](C)C(=O)N1CC[C@@H](CNC(=O)CCBr)[C@H]1c1cccnc1	1806343334	UZXDCVRLTGAORV-QIIPPGSGSA-N	439.354	1.787	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)Cn2ccccc2=O)[C@@H]1c1cccnc1	1807441172	FJEILYUBPISCEG-GMBSWORKSA-N	447.333	1.733	50	20	IDGD	
C[C@H](C(=O)NC[C@H]1CCN(C(=O)C(Cl)Cl)[C@H]1c1cccnc1)N1CCN(C)CC1	1807877481	IWXWYFXLCULJOC-OIISXLGYSA-N	442.391	1.527	50	20	IDGD	
Cc1noc(CC(=O)N2CC[C@H](CNC(=O)[C@H](F)Br)[C@H]2c2cccnc2)n1	1808661374	KAMPMMCXRUNADH-WQVCFCJDSA-N	440.273	1.712	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2cnc3ncccn23)[C@@H]1c1cccnc1	1809333149	HJYCQOKRWAOGSE-BQFCYCMXSA-N	442.907	1.698	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC2(CCCN(C(=O)c3n[nH]c4c3CS(=O)(=O)C4)C2)CC1	1810261412	VMKOKNVDPJQGKR-CQSZACIVSA-N	442.969	1.700	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2cc(C(C)=O)[nH]n2)[C@H]1c1cccnc1	1813029271	HDMJCZWOUXZPFB-MPGHIAIKSA-N	433.896	1.581	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)C(=O)Nc2cccnc2)[C@H]1c1cccnc1	1813031397	NCWWBZDLROWYMM-SZMVWBNQSA-N	445.907	1.375	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2cc(=O)ccn2C)[C@H]1c1cccnc1	1813032249	VZKZONJZPSOUIG-IEZWGBDMSA-N	432.908	1.354	50	20	IDGD	
COC[C@H](NC(C)=O)C(=O)N1CC[C@H](CNC(=O)C(Cl)Cl)[C@H]1c1cccnc1	1813078021	MUWCRROHMGZRJK-QLFBSQMISA-N	431.320	1.042	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1CCc2nc(NC(=O)CSC(=N)N)sc2C1	1814717826	ZJIZCLUMXNBSBF-HTQZYQBOSA-N	434.385	1.713	50	20	IDGD	
Cc1noc(N)c1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](F)Br)CC2	1814910007	FPDRMPBIDXXKSX-LHLIQPBNSA-N	432.275	1.938	50	20	IDGD	
CCC[C@@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1815318305	SCENXCCZYGJLNT-NVXWUHKLSA-N	432.717	1.803	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)CC2CCOCC2)[nH]n1)c1cccc(B(O)O)c1	1817475330	OAHNZNAUIJDGDR-LJQANCHMSA-N	440.309	1.212	50	20	IDGD	
COCc1oncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](Cl)COC)CC2	1817805372	YPDOIDZIKAIHNJ-MWLCHTKSSA-N	428.898	1.757	50	20	IDGD	
Cc1cc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)cc(O)n1	1818053777	DJSYCRKKMVQVIA-INIZCTEOSA-N	443.508	1.498	50	20	IDGD	
Cc1ncncc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1	1819869867	OFJCKQHNCMMQCJ-MRXNPFEDSA-N	428.497	1.187	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CN2CCCCC2=O)n[nH]1	1822303386	HCTSSKWRZOTOSZ-UKRRQHHQSA-N	425.917	1.668	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@](C)(O)C(F)(F)F)[nH]n1	1822410953	UBGIIMDEUYXQLK-PXAZEXFGSA-N	448.446	1.088	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)Cc1cnn(C)c1)CC2	1825646872	FMTPICPOORFFNV-KOLCDFICSA-N	426.340	1.815	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc3ncnn3c1)CC2	1825999629	AWNUZOQQARCJOJ-VXGBXAGGSA-N	434.909	1.665	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)/C=C/c1ccco1)CC2	1826080542	PZDBWUGMVZCDQA-CFNZNRNTSA-N	431.518	1.735	50	20	IDGD	
CCc1cc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)n[nH]1	1827288797	SUGDMZGRCDJIEL-OAQYLSRUSA-N	438.337	1.199	50	20	IDGD	
CC[C@@H](NC(N)=O)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CO[Si](C)(C)C)CC1	1827561937	JZEZQKZJHISSNO-SJORKVTESA-N	426.634	1.905	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3c[nH]c4nccc-4c3)C2)C1	1830357754	JZJALKQBOQTJNL-NRFANRHFSA-N	434.924	1.850	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4nc[nH]c4c3)C2)C1	1830362404	VNJKINGUVTWJBQ-NRFANRHFSA-N	434.924	1.898	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnn(C)c3Cl)C2)C1	1831654971	PFSVULWDVTVGLO-KBXCAEBGSA-N	433.336	1.551	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)C[C@](C)(O)CC(=O)O)CC1	1831869429	NHWWRXXTVLWLKQ-FTRWYGJKSA-N	432.945	1.476	50	20	IDGD	
Cc1ccn(C)c1C(=O)N1CCC([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1	1831874586	SGBXBZKUDJJJPP-IBGZPJMESA-N	431.581	1.940	50	20	IDGD	
C=CCSCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](Br)CC)C2)C1	1832461527	YKPDYNKHHMPHOM-WMLDXEAASA-N	435.384	1.536	50	20	IDGD	
C[C@@H](Cn1cncn1)C(=O)N1CCC(N2CCC(NC(=O)C(C)(C)CCl)CC2)CC1	1833214873	VJEJXIPUEPQYLJ-INIZCTEOSA-N	439.004	1.751	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3nc(Cl)ccc3F)CC2)CC1)[C@H](O)CCl	1833308297	QEPNIMGMEGQFSB-OAHLLOKOSA-N	447.338	1.659	50	20	IDGD	
Cc1nc(F)ccc1C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)CCl)CC2)CC1	1833312681	WVIVKLKVYHPHQG-QGZVFWFLSA-N	426.920	1.314	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](C)CC(N)=O)CC2)CC1	1833523259	DROUVGFVJTUOOR-XJKSGUPXSA-N	445.402	1.243	50	20	IDGD	
Cn1ccc(C(=O)NC2CCN(C3CCN(C(=O)[C@@](C)(Cl)CCl)CC3)CC2)n1	1834217403	NAFFQXKLJGHRHI-IBGZPJMESA-N	430.380	1.842	50	20	IDGD	
Cc1ncoc1C(=O)NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1	1834260782	DXXLFPSRNGBTMN-HNNXBMFYSA-N	431.306	1.859	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3csc(C)n3)CC2)CC1	1834292865	CKUKZWIRJVGOFI-MRXNPFEDSA-N	428.986	1.891	50	20	IDGD	
CO[C@@H](C(=O)NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)c1ccccc1	1834457974	MCWWMLARWIJFID-WOJBJXKFSA-N	437.968	1.545	50	20	IDGD	
CC(C)=NO[C@H](C)C(=O)N1CCOC[C@@]2(CN(C(=O)CCBr)CCO2)C1	1834823628	ACWMXMJIHCVUHZ-RHSMWYFYSA-N	434.331	1.029	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccccc3)CCO2)C1	1834990888	TXRFEZVVEWCCOV-JXFKEZNVSA-N	439.350	1.717	50	20	IDGD	
CC(=O)N[C@@H](C(=O)N1CCC(N2CCC(NC(=O)[C@@H](F)Cl)CC2)CC1)C(C)(C)C	1835079365	VIHKNXMPABQZER-DLBZAZTESA-N	432.968	1.643	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3ncn(-c4ccccc4)n3)CC2)CC1)[C@H](F)Cl	1835079584	HDBPBTASYHXBRS-SFHVURJKSA-N	448.930	1.987	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)C#Cc3ccccc3)CCO2)C1	1835103228	YULPODUHXNZRGE-GHTZIAJQSA-N	449.345	1.668	50	20	IDGD	
CC[S@@](=O)CCC(=O)NC1CCN(C2CCN(C(=O)C(Cl)Cl)CC2)CC1	1835659281	XBGKCQKKOXFFBB-AREMUKBSSA-N	426.410	1.520	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](CN)c1ccccc1)CCO2	1835818768	QLGHGLNOTXRFKN-KNQAVFIVSA-N	449.624	1.037	50	20	IDGD	
Cc1c(F)ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)c1N	1835875078	MYIPRTUQNHGBOS-SFHVURJKSA-N	434.295	1.590	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCC(N2CCC(NC(=O)[C@@]3(C)CCCN3)CC2)CC1	1836384434	NTXGBLVYXWUHIG-WOJBJXKFSA-N	433.424	1.936	50	20	IDGD	
CC(=O)Nc1ccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)cc1	1836661076	CANBFCWEAJWAMY-QUCCMNQESA-N	441.887	1.178	50	20	IDGD	
Cc1cnc2c(C(=O)N3CCC(OC4CCN(C(=O)[C@H](O)CCl)CC4)CC3)cnn2c1	1836716994	CSBRGHIWHQOKFO-GOSISDBHSA-N	449.939	1.250	50	20	IDGD	
O=C(c1ccc2ncncc2c1)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1837026879	CGPRUDDRCYIFLU-LJQANCHMSA-N	439.299	1.504	50	20	IDGD	
Cc1nc(CC(=O)N2CCC(OC3CCN(C(=O)[C@@H](F)Br)CC3)CC2)no1	1837155733	OHGQXLOJZDMUTI-MRXNPFEDSA-N	447.305	1.610	50	20	IDGD	
O=C(c1c[nH]c2cnccc12)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1837179850	OXTJAWWGGDLSRD-SFHVURJKSA-N	427.288	1.437	50	20	IDGD	
C=CC[C@@H](C(=C)C)C(=O)N1CCO[C@]2(COCCN(C(=O)CCBr)C2)C1	1837305818	KFLCKIFAJIFDPC-LPHOPBHVSA-N	429.355	1.996	50	20	IDGD	
O=C(COc1cc(Cl)ccn1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1837652974	NLLGYABLPCNFIP-WBVHZDCISA-N	436.267	1.105	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(F)n3)CCO2)C1	1837908041	PFTLBAAJKXJMQF-MSOLQXFVSA-N	434.295	1.527	50	20	IDGD	
CC(C)c1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)on1	1838777628	QYXBSFSVJHKLBA-RHSMWYFYSA-N	448.289	1.559	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccccc3)CCO2)C1	1838849092	ROXKRWWIWGTURJ-HNAYVOBHSA-N	425.323	1.788	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccnc(Cl)c3)C2)C1	1840150844	RSCSIONXXRNTRW-KDOFPFPSSA-N	432.304	1.059	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3(C(F)(F)F)CC3)C2)C1	1840153317	KCYUWTIQGMSISR-DOMZBBRYSA-N	428.835	1.039	50	20	IDGD	
CC(C)(C)OC(=O)N1CC2(C[C@H]2C(=O)N2CC3(CCCN3C(=O)[C@H](O)CCl)C2)C1	1841353906	XEGUANGZTDWWDG-UONOGXRCSA-N	427.929	1.047	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC2(CCCN2C(=O)[C@H](C)[C@H]2SC(=N)NC2=O)C1	1843409390	WZWBVFPTMVRLAW-OUAUKWLOSA-N	431.356	1.166	50	20	IDGD	
O=C1Nc2ccccc2Cn2nc(C(=O)N3CCCC34CN(C(=O)[C@H](F)Cl)C4)cc21	1844640812	ZZTZDKHXVNKAFF-INIZCTEOSA-N	431.855	1.849	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H](C(=O)N2CCCC23CN(C(=O)C(Cl)Cl)C3)[C@@H](O)C1	1845108866	VOLYMNSQYRBTFM-RYUDHWBXSA-N	436.336	1.221	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@H](C)NS(=O)(=O)c1ccc(C)cc1)C2	1845162811	PHERKQCVJQOEAH-RDJZCZTQSA-N	441.981	1.883	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@H](F)C[C@H]1C(=O)N1CCCC12CN(C(=O)[C@@H](O)CCl)C2	1847132487	VIFOMEQJZWRUBJ-IHRRRGAJSA-N	433.908	1.137	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cccnc1CS(C)(=O)=O	1847435355	JZBXXINLSYRIND-HOTGVXAUSA-N	427.954	1.707	50	20	IDGD	
O=C(CC12CC3CC(CC(C3)C1)C2)NCC(=O)OCC(=O)NNC(=O)c1cccs1	9415924	ZZBBACULTSEZRL-UHFFFAOYSA-N	433.530	1.775	50	20	IDGD	
C=C1c2ccccc2C(=O)N1CC(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12	14044624	MRDLYLXSSBNQIJ-UHFFFAOYSA-N	431.452	1.865	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2Oc3ccccc3O[C@H]2C)c1	14287662	WDRROOQGBDWCPJ-IFXJQAMLSA-N	447.513	1.707	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)c2ccc(S(C)(=O)=O)cc2)c2ccccc2c1=O	15945500	HDRXKFQCJKPQCE-UHFFFAOYSA-N	428.470	1.456	50	20	IDGD	
Cc1nnnn1/C(=C\c1cccc(F)c1)C(=O)OCC(=O)NNC(=O)c1cccs1	23579864	LHYPSBTYICKSMZ-ZROIWOOFSA-N	430.421	1.185	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cc(-c3ccccc3)n[nH]2)cc1	28636182	QJOHIXUSNABCCP-UHFFFAOYSA-N	443.485	1.076	50	20	IDGD	
CC(=O)N(c1nnc(SCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)s1)C1CC1	105622308	FOZPEGVBWZODGZ-UHFFFAOYSA-N	436.475	1.515	50	20	IDGD	
Cc1ccc(C(=O)NC2CCN(C(=O)NNC(=O)CNC(=O)c3ccco3)CC2)s1	725871537	DAPNALUILDPFGN-UHFFFAOYSA-N	433.490	1.015	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc2c(c1)COC2)NNC(=O)c1cc(-c2ccccc2)on1	726866339	QJUYBAGPXUCONV-UHFFFAOYSA-N	442.453	1.111	50	20	IDGD	
CSCC[C@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	727114344	PUFIMNOVXRPBAJ-AWEZNQCLSA-N	449.533	1.341	50	20	IDGD	
Cn1c(=O)n(C)c2cc(S(=O)(=O)NNC(=O)c3c(Cl)cccc3Cl)ccc21	727796179	KZYALVYLIJBBNF-UHFFFAOYSA-N	429.285	1.807	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)c2cnc3ccc(C)cn3c2=O)c1	728528787	MGBXKAZWOGMPJI-UHFFFAOYSA-N	431.246	1.849	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2ccc(NC(=O)NC(C)C)cc2)n1	728732221	IGTJNBIARXYMHQ-UHFFFAOYSA-N	433.490	1.528	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccccc1Cl)NNC(=O)Cn1ccc2ccccc21	729541384	VTHPTTKULFHCPL-UHFFFAOYSA-N	434.905	1.811	50	20	IDGD	
O=C(NN=c1cc[nH]c2ccccc12)c1ccc(S(=O)(=O)NC[C@@H]2CCCO2)cc1	730289134	WHNBYVJTGQOCEK-INIZCTEOSA-N	426.498	1.871	50	20	IDGD	
CCCNC(=O)CCC(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	732050757	JLNXIBGESPWLQF-UHFFFAOYSA-N	435.484	1.512	50	20	IDGD	
Cc1nc(-c2ccccn2)nc(NNC(=O)CN2C(=O)COc3ccc([N+](=O)[O-])cc32)c1C	734256944	UZOGRSHDYXKKLJ-UHFFFAOYSA-N	449.427	1.932	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)Cn2nnc(-c3ccccc3)n2)CC1	734824579	DQVRBAFVZCZMFF-UHFFFAOYSA-N	444.496	1.070	50	20	IDGD	
Cc1nn(C)cc1[C@@H](C)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	739033394	BTSRWAAVXNXBRT-CYBMUJFWSA-N	434.522	1.218	50	20	IDGD	
CC(C)C(=O)N(C)Cc1ccc(C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)cc1	741692274	CNBYFZLJIFMENU-UHFFFAOYSA-N	435.525	1.770	50	20	IDGD	
C[C@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1cccc(F)c1	741879126	LERSVTHAWJWJSK-AWEZNQCLSA-N	435.477	1.411	50	20	IDGD	
Cc1nn(C)c2sc(C(=O)N[C@@H](C)C(=O)NNC(=O)c3cc(Cl)ccc3O)cc12	743295037	DWXPJXXIJAJNQY-VIFPVBQESA-N	435.893	1.882	50	20	IDGD	
O=C(NNc1ccc(Cl)nc1)N[C@@H]1CCCN(c2cc(N3CCOCC3)ncn2)C1	745817060	SDOBPXDNRXWYKP-OAHLLOKOSA-N	432.916	1.657	50	20	IDGD	
CC[C@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)c1ccncc1	745835813	DODZKSPMVWKONC-SFHVURJKSA-N	431.518	1.961	50	20	IDGD	
O=C(CNC(=O)[C@@H]1c2ccccc2C(=O)N1Cc1ccccc1)NNC(=O)NCC1CC1	745867647	BNKVMYZCJBXEDS-FQEVSTJZSA-N	435.484	1.240	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)c1ccccc1S(=O)(=O)C(F)(F)F	746545493	PJBKYSRQXMAHRZ-UHFFFAOYSA-N	426.376	1.632	50	20	IDGD	
COc1cccc(/C=C(\C(=O)NNC(=O)c2cccc3cccnc23)n2nnnc2C)c1	747425828	RLIINAFKFIFOQS-CPNJWEJPSA-N	429.440	1.998	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNc3ccc(S(=O)(=O)N4CCN(C)CC4)cc3)n[nH]2)o1	747517740	FGJNFOIBCJTHHY-UHFFFAOYSA-N	444.517	1.671	50	20	IDGD	
Cc1c(CC(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)cccc1[N+](=O)[O-]	747916074	OPHFREDNJIVEOM-UHFFFAOYSA-N	434.474	1.610	50	20	IDGD	
O=C(CN1C(=O)NC2(CCCCC2)C1=O)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1	748522238	ODEHASXJRFTBER-UHFFFAOYSA-N	448.423	1.678	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)NNC(=O)c2cc(F)ccc2Br)o1	748642607	HOYBKVVTXPCVGF-UHFFFAOYSA-N	435.227	1.981	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)Nc1cc(C)nn1-c1ccc(C(F)(F)F)cn1	748659974	FZMMYCGHUFLCCW-LLVKDONJSA-N	430.387	1.799	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCn2cncc2C1)c1nn(Cc2ccccc2)c(=O)c2ccccc12	750828240	QNHDOAXAEQPZJZ-QGZVFWFLSA-N	442.479	1.665	50	20	IDGD	
COc1cc([N+](=O)[O-])ccc1OC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1	751164849	JTJPEMSVJMRNPB-UHFFFAOYSA-N	449.485	1.824	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNS(=O)(=O)c1cc(Cl)ccc1C(=O)OC	751261211	JHBYUUDGVUQSTI-UHFFFAOYSA-N	442.877	1.914	50	20	IDGD	
CO[C@@H](C)c1nc(CN2CCCN([C@H](C)C(=O)NNC(=O)CC(C)C)CC2)cs1	752355694	RVCHXHYSEUYZOH-CVEARBPZSA-N	425.599	1.940	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NN=C1CCCC[C@H](N2C(=O)c3ccccc3C2=O)C1	752733308	HYDLZXABIOMHGS-KRWDZBQOSA-N	433.468	1.913	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)NC[C@H]2CCCN2S(C)(=O)=O)c(C)n1C[C@@H]1CCCO1	753144539	RTHZQRCABHCJAA-BXWLARMLSA-N	434.562	1.731	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)c2ccc(CNS(C)(=O)=O)o2)cc1OC	753566587	SHQCQCVAHQNGCU-UHFFFAOYSA-N	439.490	1.591	50	20	IDGD	
Cc1sc2ccc(Cl)cc2c1S(=O)(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O	753981465	HSSGWOXLTLMMCG-SSDOTTSWSA-N	425.941	1.110	50	20	IDGD	
COC(=O)c1cccc([C@H](NNC(=O)c2sc(N3CCOCC3)nc2C)C(=O)OC)c1	753998838	MAWXNTCKUMJNAH-HNNXBMFYSA-N	448.501	1.223	50	20	IDGD	
Cc1oc(C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)cc1S(=O)(=O)N(C)C	754013435	GDCPFQUSULPZPW-UHFFFAOYSA-N	437.446	1.592	50	20	IDGD	
O=C(NNC(=O)N1CCO[C@@H](CCc2ccccc2)C1)c1csc(N2CCOCC2)n1	754135266	QRGJJBDQUAYJEP-KRWDZBQOSA-N	445.545	1.668	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)Nc1ccccc1C(=O)N1CCOCC1	755621451	ACZSBGROOYGLOT-GOSISDBHSA-N	426.429	1.152	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)Nc1cccc(OCC(=O)N2CCCC2)c1	755656873	LRHUMUBFOBEGSC-UHFFFAOYSA-N	426.429	1.883	50	20	IDGD	
CCc1noc(CC)c1CC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	755776396	LYTMDAQXYZOKQX-UHFFFAOYSA-N	435.550	1.421	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2ccc(-n3cccn3)nc2)cc1	755851280	NYQJIAPVLOQOAP-UHFFFAOYSA-N	443.489	1.049	50	20	IDGD	
CC(C)(C)S(=O)(=O)N1CCC(NC(=O)NNC(=O)c2cc3c(s2)CCC3)CC1	755896434	CUFHNDAWPBMRFR-UHFFFAOYSA-N	428.580	1.774	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(F)c(NC(=O)NNC(=O)Cn2ccc3ccccc32)c1	756683353	MHKCPLPSBPFFMM-UHFFFAOYSA-N	433.465	1.884	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)Nc2cc(C3CC3)nn2[C@H]2CCS(=O)(=O)C2)cc1	756856434	PSRSUGHTTNVMFK-HNNXBMFYSA-N	447.517	1.660	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)Cc2ccc(C(=O)NNC(=O)c3cn(C)cn3)cc2)cc1	758060047	XTFXZRUICUXDNQ-UHFFFAOYSA-N	441.513	1.624	50	20	IDGD	
O=C(c1ccncc1Br)N1CCN(S(=O)(=O)CBr)CC1	758513260	SEQJGCGAINXGQF-UHFFFAOYSA-N	427.118	1.284	50	20	IDGD	
CCCC1(C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)CCC1	759112299	WDVKGOPCLOZHSY-UHFFFAOYSA-N	437.562	1.758	50	20	IDGD	
CC(C)NC(=O)N1CCC[C@H]1C(=O)NNC(=O)[C@H](C)Oc1cccc(Br)c1	760295783	SKQAHNNMODTNAA-WFASDCNBSA-N	441.326	1.946	50	20	IDGD	
C[C@H](NC(=O)OC(C)(C)C)[C@@H]1CN(CC(=O)NNC(=O)c2cccc(Cl)c2)CCO1	760975427	QVZOLVXVYJEFOV-BBRMVZONSA-N	440.928	1.715	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)c1cccc([N+](=O)[O-])c1	761402156	SZGIXNTZVTUKTJ-CQSZACIVSA-N	446.485	1.944	50	20	IDGD	
O=C(NNC(=O)C1CC1)C(=O)Nc1ccc(Br)cc1-c1nc(C2CC2)no1	763563704	UFUQMKJQUAANJR-UHFFFAOYSA-N	434.250	1.872	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)Nc1ccc(F)cc1OCC(F)F	763572010	KMZLPUFNMFMOAD-OAHLLOKOSA-N	439.346	1.396	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(N3CCCC3=O)c(Cl)c2)c1	763624722	ZOLGUFCERIGOCF-UHFFFAOYSA-N	444.875	1.940	50	20	IDGD	
CSc1ccncc1NC(=O)C(=O)NNC(=O)COc1cccc(C(F)(F)F)c1	763641910	ZTRVMQBZAZMQQQ-UHFFFAOYSA-N	428.392	1.987	50	20	IDGD	
CCCN1Cc2cccc(NC(=O)C(=O)NNC(=O)COc3ccccc3OC)c2C1	763656875	HGNGHRWXNWEBHJ-UHFFFAOYSA-N	426.473	1.586	50	20	IDGD	
CC(C)OC(=O)NCc1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2F)cc1	763678653	GUQXZRBKBJJZJW-UHFFFAOYSA-N	446.435	1.625	50	20	IDGD	
COCCOc1ccc(F)cc1NC(=O)C(=O)NNC(=O)CN1CCCc2ccccc21	763729335	WEIORBYBTGVVML-UHFFFAOYSA-N	444.463	1.390	50	20	IDGD	
O=C(NNC(=O)c1cccc(Cl)c1)C(=O)Nc1ccccc1CN1C(=O)CCC1=O	763750937	UFMYTQCUDDOUSE-UHFFFAOYSA-N	428.832	1.389	50	20	IDGD	
CC(C)C(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])c1	763804954	YPIPZIQCZZDXPQ-UHFFFAOYSA-N	443.416	1.354	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cccc(S(C)(=O)=O)c2)c1C	763852075	UTXWUVSGGFDPFZ-AWEZNQCLSA-N	433.486	1.260	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)NC(=O)CS3)cc1OC	763904552	ZUPKUUMKVXRAPF-UHFFFAOYSA-N	444.469	1.538	50	20	IDGD	
CS(=O)(=O)c1c(F)cc(NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)cc1F	763974062	KDNTYGDFJKXJFO-UHFFFAOYSA-N	447.803	1.127	50	20	IDGD	
COCCn1ccc(NC(=O)C(=O)NNC(=O)c2ccc(-c3ccc(F)cc3)s2)n1	763976148	SGBTZVYNDKJSIW-UHFFFAOYSA-N	431.449	1.797	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)C(=O)Nc1ccc(NC(=O)C2CC2)cc1C(F)(F)F	763999085	MZLKYTIARLFCBS-UHFFFAOYSA-N	437.378	1.792	50	20	IDGD	
CS(=O)(=O)c1ccc(F)c(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)on2)c1	764003592	IRQMXMUKEXWXRH-UHFFFAOYSA-N	446.416	1.284	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)c(OCCN(C)C)c1	764007019	XNVAMPOVYKMRLH-UHFFFAOYSA-N	442.472	1.106	50	20	IDGD	
CCOc1cc(NC(=O)C(=O)NNC(=O)c2ccccc2OC)c([N+](=O)[O-])cc1OCC	764040827	NDWFEXIKVTTWMN-UHFFFAOYSA-N	446.416	1.801	50	20	IDGD	
CCCc1c(NC(=O)C(=O)NNC(=O)c2ccccc2OC)cnn1-c1cc(C)ccn1	764047088	BGDSQXNEQRCBOH-UHFFFAOYSA-N	436.472	1.937	50	20	IDGD	
Cn1cnn(-c2ccc(NC(=O)C(=O)NNC(=O)Cc3ccc4ccccc4c3)cc2)c1=O	764084437	KMDULDASVZZXBJ-UHFFFAOYSA-N	444.451	1.053	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)nc2)cc1Cl	764101040	NWDWLMDHSLUVPY-UHFFFAOYSA-N	427.244	1.813	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccccc3C(=O)N(C)C)n[nH]2)cc1	764111867	RXKXMNALKQIPPB-UHFFFAOYSA-N	434.456	1.487	50	20	IDGD	
CC(C)CCNS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)CC(F)(F)F)cc1	764117910	ZXNHPXGKDWGMNV-UHFFFAOYSA-N	438.428	1.049	50	20	IDGD	
Cc1ncsc1C(=O)NNC(=O)C(=O)Nc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1	764246838	ROHQUBKNQKHGKX-QWRGUYRKSA-N	435.481	1.604	50	20	IDGD	
N#Cc1cccc(Oc2ccc(NC(=O)C(=O)NNC(=O)COc3ccccc3O)cn2)c1	764278103	RDYCXYPQURHRAW-UHFFFAOYSA-N	447.407	1.616	50	20	IDGD	
N#Cc1cc(Cl)ccc1-n1ccc(NC(=O)C(=O)NNC(=O)Cc2ccccc2F)n1	764320386	ZWHWDYPIROLHKU-UHFFFAOYSA-N	440.822	1.865	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cnc(C3CC3)nc2)cc1Br	764326080	DZNVCWHDRHAQCL-UHFFFAOYSA-N	434.250	1.525	50	20	IDGD	
CCN(CC)CCNC(=O)c1cc(NC(=O)C(=O)NNC(=O)C2CCC2)ccc1Cl	764342424	OLVFSTAWNUEWJW-UHFFFAOYSA-N	437.928	1.298	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(NC(=O)NC[C@H]3CCCO3)cc2)o1	764371487	OTCJDIFUVKGSIP-OAHLLOKOSA-N	429.433	1.288	50	20	IDGD	
COC(=O)c1csc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3OC)[nH]n2)c1	764377850	RGTNTZLLYNJPLO-UHFFFAOYSA-N	443.441	1.333	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)ccc1F	764385174	UZFYERRJNCPDQM-UHFFFAOYSA-N	431.405	1.464	50	20	IDGD	
CN(C)Cc1cccc(NC(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)c1	765313242	QHPKSLWMXALCFD-UHFFFAOYSA-N	438.532	1.359	50	20	IDGD	
N#C/C(=C/c1cn(CCC(N)=O)nc1-c1ccc(Br)cc1)C(=O)OCC(N)=O	765743643	HMPZEUSGEDIRKF-GHXNOFRVSA-N	446.261	1.123	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N[C@@H](C(N)=O)c2ccc(F)cc2)cc1Br	766618362	XVACHSKZIVTNOA-CQSZACIVSA-N	439.241	1.767	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)[C@H]3CCCN3C(=O)C(C)(C)C)n[nH]2)cc1OC	768278640	ITCAKMOKILPCKI-MRXNPFEDSA-N	443.504	1.892	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)c1	768291305	PRVCMKKLTCWBHW-UHFFFAOYSA-N	429.952	1.985	50	20	IDGD	
COc1cc(O)c(C=NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cc1OC	768367345	PCWQQTCYGXGLIV-UHFFFAOYSA-N	426.473	1.318	50	20	IDGD	
CCc1c(C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)cnn1-c1ccccc1OC	769175968	FYIVCBKEXQOMQL-UHFFFAOYSA-N	447.451	1.933	50	20	IDGD	
C[C@]1(c2ccc(F)c(Cl)c2)NC(=O)N(CC(=O)NNC(=O)NC2CCCC2)C1=O	770224436	XTAVVKBRHVGDKY-GOSISDBHSA-N	425.848	1.519	50	20	IDGD	
C[S@](=O)c1cccc(C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)c1	770245913	NGXWFNRTSOZGES-PMERELPUSA-N	448.976	1.656	50	20	IDGD	
Cc1cccc(F)c1NNC(=O)C(=O)Nc1cc(S(=O)(=O)N(C)C)ccc1N(C)C	770822176	ZPZJEVVQJCIXQM-UHFFFAOYSA-N	437.497	1.532	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)/C=C/c3ccc(NS(C)(=O)=O)cc3)nc21	770957997	GJHOSLSCNFXUHX-JXMROGBWSA-N	445.505	1.815	50	20	IDGD	
Cc1cccc([C@@H](CC(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)NC(N)=O)c1	770968474	XNFQKCLMTKIDIY-CQSZACIVSA-N	426.481	1.838	50	20	IDGD	
CS(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)c2c[nH]c3ccccc23)cc1F	771148396	LJLQYKYPDIJJTH-UHFFFAOYSA-N	426.451	1.302	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)Cc2ccccc2I)cc1	771219622	KVBONZPAWQIWQH-UHFFFAOYSA-N	435.221	1.932	50	20	IDGD	
COc1ccccc1[C@]1(C)NC(=O)N(CC(=O)NNc2ccnc(Br)c2)C1=O	771536866	ABOCPTSHUMQYFD-SFHVURJKSA-N	448.277	1.763	50	20	IDGD	
O=C(NNc1ccc(F)c([N+](=O)[O-])c1)c1cccc(S(=O)(=O)NC[C@@H]2CCCO2)c1	771591022	UTGXALDXRQDMQW-AWEZNQCLSA-N	438.437	1.948	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)c1ccc(S(=O)(=O)N(C)C(C)C)cc1	771970304	KRGZFLVFPQLORQ-AWEZNQCLSA-N	427.523	1.454	50	20	IDGD	
CCOc1ccccc1C(=O)N1CCC[C@@H]1C(=O)O[C@@H](C)C(=O)NNC(=O)CC(C)C	771993579	PUXHEKINDHWONK-DOTOQJQBSA-N	433.505	1.815	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)[C@H]1CCCCN1C(=O)c1cccs1	772896765	BRZAHOJGFCXWFJ-OAHLLOKOSA-N	448.932	1.860	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)C[C@@H](NC(N)=O)c2cccs2)C1	773418329	TWJPFBYKLAXEHY-QWHCGFSZSA-N	439.538	1.642	50	20	IDGD	
O=C(NNc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(I)cn1	773578178	RBNBPWIQEQKYIV-UHFFFAOYSA-N	427.158	1.676	50	20	IDGD	
Cc1cc(S(N)(=O)=O)ccc1CNC(=O)NNC(=O)c1cccc(Br)c1	775213491	YCIJQMWMACYHTK-UHFFFAOYSA-N	441.307	1.549	50	20	IDGD	
C[C@H](NCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)c1ccc(N2CCOCC2)cc1	775259290	REHQIGHVZCNAQQ-HNNXBMFYSA-N	427.461	1.543	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H]2[C@H](C)[C@@H](OC)C2(C)C)c1	776065825	CYSQVJUDXLWPMW-IAOVAPTHSA-N	440.566	1.721	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)[C@@H]2CC(=O)N(c3ccc4c(c3)OCCO4)C2)c1	776534717	RADUPRNIKSVSIR-CYBMUJFWSA-N	431.470	1.358	50	20	IDGD	
COC(=O)N1CCC([C@@H](C)NC(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)CC1	776917982	IMEDSIIQKRSPQF-CYBMUJFWSA-N	429.518	1.489	50	20	IDGD	
O=C(CSc1nnc(O)nc1O)NN=Cc1ccc(Br)c2cccnc12	777881619	GGEDCYPTAZDNNZ-UHFFFAOYSA-N	435.263	1.836	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNS(=O)(=O)c2ccc3c(c2)OCO3)c1	777931222	QQQHYCZPVXNSCB-UHFFFAOYSA-N	429.248	1.810	50	20	IDGD	
C[C@H](c1cccc(N2CCCS2(=O)=O)c1)N(C)CC(=O)NNC(=O)c1ccccc1	778226440	RLLUMXFYFJVUBU-MRXNPFEDSA-N	430.530	1.681	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NCC2=CCN(C(=O)OC(C)(C)C)CC2)cc1	779676715	JHPPQFFMVFCCFQ-UHFFFAOYSA-N	434.493	1.972	50	20	IDGD	
CCNC(=O)N(C)NC(=O)c1cccc(NS(=O)(=O)c2ccc3c(c2)OCCCO3)c1	780708581	LIGAWKCAJITDLB-UHFFFAOYSA-N	448.501	1.955	50	20	IDGD	
COC(=O)c1ccccc1NNC(=O)CN1C(=O)c2ccc(Br)cc2C1=O	780731186	XPQRXNKEKGRWNX-UHFFFAOYSA-N	432.230	1.975	50	20	IDGD	
O=C(NCc1ncn(Cc2cccc(F)c2)n1)NNC(=O)c1cc([N+](=O)[O-])ccc1O	780852610	YHCMZDUHWVGQHI-UHFFFAOYSA-N	429.368	1.224	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2ccc(C(=O)N3C[C@H](C)O[C@@H](C)C3)cc2)nc1	782148338	LGCLVJIHKHPMKW-KBPBESRZSA-N	427.461	1.421	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H]2CC[C@@H](C1)N2CC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	782505237	XATYFVCNGDADAN-WBVHZDCISA-N	447.492	1.830	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H](CC(C)C)NC(C)=O)c1	783383830	DCMYXXMLRJFTSU-KRWDZBQOSA-N	426.539	1.029	50	20	IDGD	
Cc1ccc(C(N)=O)cc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1	783407589	DMUUNSKYFPSWHB-UHFFFAOYSA-N	444.391	1.469	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNc2cc(C)ccn2)cc1S(=O)(=O)N1CCCC1	783931697	XDQBFGROQPGCEQ-UHFFFAOYSA-N	447.517	1.655	50	20	IDGD	
Cc1c(COC(C)(C)C)cccc1NC(=O)C(=O)NNC(=O)CNC(=O)c1ccco1	784004770	UEYKDOMLWPOXEI-UHFFFAOYSA-N	430.461	1.419	50	20	IDGD	
CN1CCN(c2ccccc2NC(=O)C(=O)NNc2ccc(Br)cn2)CC1	784339279	GCPSLPKUPAZVHB-UHFFFAOYSA-N	433.310	1.678	50	20	IDGD	
CO[C@H]1Cc2ccc(NC(=O)C(=O)NNc3ccc(S(=O)(=O)C(F)F)cc3)cc2C1	784833594	OKHXWUCQVYHRAH-HNNXBMFYSA-N	439.440	1.878	50	20	IDGD	
O=C(NNc1cccc(C(F)(F)F)n1)C(=O)Nc1ccc2nc3n(c(=O)c2c1)CCC3	784951203	FRZOAADLDHESQH-UHFFFAOYSA-N	432.362	1.838	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)C(=O)Nc1ccc(Oc2ccc(F)cc2)nc1	785061614	YUOHKDHJYZFTRU-UHFFFAOYSA-N	448.414	1.989	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1ccc(Oc2cccc(F)c2F)nc1	786097734	YWPRGCJXWFCBOI-SECBINFHSA-N	429.405	1.243	50	20	IDGD	
COC[C@H](C)NC(=O)NC(=O)COC(=O)/C(C#N)=C\c1cc(C)n(C[C@@H]2CCCO2)c1C	786384438	LRIXLLIRZKDIDA-LGMQXIHNSA-N	446.504	1.595	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)CCCc2ccc(O)c(F)c2)ccc1Cl	786688710	QYUDOHIJXASFMI-UHFFFAOYSA-N	429.857	1.616	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)COCc2ccccc2)cc1C(=O)N(C)C(C)C	787549280	JLIOIWFSNVIRPC-UHFFFAOYSA-N	440.500	1.778	50	20	IDGD	
CCC1(CC)Oc2ccc(NC(=O)C(=O)NNC(=O)CNC(=O)c3cccs3)cc2O1	787898473	JMGBZPGAOXNEMQ-UHFFFAOYSA-N	446.485	1.552	50	20	IDGD	
O=C(NNC(=O)c1n[nH]c2c1CCCCC2)c1ccc(S(=O)(=O)N2CCCC2)cc1	789735626	QPTCOUJRTOJKDM-UHFFFAOYSA-N	431.518	1.538	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)CC(=O)N2C	789740958	LGAZQYSAHAJVCR-AWEZNQCLSA-N	446.463	1.912	50	20	IDGD	
CC(C)(C)c1csc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)n1	789759133	XIBYTAHBJDNKJS-UHFFFAOYSA-N	437.547	1.963	50	20	IDGD	
CCN1CCN(Cc2ccc(NC(=O)C(=O)NNc3cccc(F)c3[N+](=O)[O-])cc2)CC1	790998961	MFZPHCROVSCPGN-UHFFFAOYSA-N	444.467	1.953	50	20	IDGD	
CC(C)(C(=O)NNC(=O)[C@@](C)(O)Cn1cc(C(F)(F)F)ccc1=O)c1ccccc1	792160598	ZCBLOKDLRJOCIE-IBGZPJMESA-N	425.407	1.743	50	20	IDGD	
Cc1ccc(-n2ncc(NC(=O)C(=O)NN[C@@]3(C)CCS(=O)(=O)C3)c2C(C)C)cc1	792278553	SZGJTTZWNSJBAW-FQEVSTJZSA-N	433.534	1.441	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCC3)cc(-n2cccn2)c1	792354766	LHLZJANTSCODIQ-UHFFFAOYSA-N	425.470	1.831	50	20	IDGD	
CC(=NNC(=O)c1nn(-c2ccccc2)cc1O)c1cc(S(N)(=O)=O)c(C)cc1C	794484856	GHXNWFMOCRYQCW-UHFFFAOYSA-N	427.486	1.996	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C[C@@H]1COCCN1C(=O)OC(C)(C)C	794760120	NVUKPXXWYOSXOO-OAHLLOKOSA-N	437.493	1.638	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)c1cnc(NC(=O)OC(C)(C)C)cn1	795182354	UNIJGUMAMULSQE-UHFFFAOYSA-N	436.494	1.831	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)[C@H]2N(C(=O)OC(C)(C)C)CC2(C)C)n1	796220845	LBPUCMQJEFVEFU-OAHLLOKOSA-N	440.522	1.330	50	20	IDGD	
CNC(=O)c1ccc(OC)c(NC(=O)NNC(=O)CNC(=O)OCc2ccccc2)c1	797615207	WIIDYHWKASMFNM-UHFFFAOYSA-N	429.433	1.134	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCC1([S@@](C)=O)CCC1	798048827	SSLOQEVXXGFZBP-JPQMIFPKSA-N	432.340	1.848	50	20	IDGD	
NC(=O)[C@H]1CC(C(=O)NNc2cc([N+](=O)[O-])ccc2Br)=NN1c1ccccc1	800618202	KMUHOYIHLNENDR-OAHLLOKOSA-N	447.249	1.921	50	20	IDGD	
Cc1cn(-c2ccc(F)cc2)nc1C(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	801451647	JUDJNQNLUXTCBB-UHFFFAOYSA-N	441.375	1.846	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)CCCC(=O)Nc2ccccc2C#N)cc1	802063970	FPSAUIGWIBUDGV-UHFFFAOYSA-N	443.485	1.923	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)c([N+](=O)[O-])cc1OC	802068021	WUFHDEDHAZCDRM-UHFFFAOYSA-N	438.418	1.482	50	20	IDGD	
Cc1nn(-c2ccccn2)c(C)c1C=NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	802713027	ZEIHYYSVPQBQLW-UHFFFAOYSA-N	445.527	1.792	50	20	IDGD	
COC(=O)[C@@]1(C(F)(F)F)CCN(C(=O)NNC(=O)c2cc(Br)c[nH]2)C1	804869572	VLFASFKLRCAIOB-GFCCVEGCSA-N	427.177	1.559	50	20	IDGD	
CCOc1ccc(NC(=O)NNc2ncccc2F)cc1S(=O)(=O)N1CCOCC1	806175867	HCHMBPPCCWECSK-UHFFFAOYSA-N	439.469	1.789	50	20	IDGD	
COC(=O)COCC(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccc(C)cc2C)c1	806331226	FFZQBHIBHIWAIH-UHFFFAOYSA-N	449.485	1.055	50	20	IDGD	
Cc1cccn(Cc2c(F)cccc2NC(=O)C(=O)NNC(=O)c2cccn2C)c1=O	806976307	AGMDTTSRBXYJHU-UHFFFAOYSA-N	425.420	1.082	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)C(=O)Nc1ccc2c(c1)nc1n2CCCCC1	807428710	JBBAHMZOBARITG-UHFFFAOYSA-N	431.460	1.820	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)N[C@@H]2CCCN(C(=O)CCC(F)(F)F)C2)c1	807573875	HMJBPOIOUDDZPG-CYBMUJFWSA-N	446.426	1.981	50	20	IDGD	
COC(=O)N(C)NC(=O)CNS(=O)(=O)c1ccc(SCC(C)C)c([N+](=O)[O-])c1	807660549	DDHMOPHRXDZGLB-UHFFFAOYSA-N	434.496	1.351	50	20	IDGD	
Cn1nnc2c1C[C@@H](C(=O)NNc1ccc(S(=O)(=O)Nc3ccccc3)cc1)CC2	810341639	OGWDZLDWQCWBNF-AWEZNQCLSA-N	426.502	1.864	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(Br)s1)NNc1nccnc1Cl	810407782	MFZXNLXCZVDPNC-UHFFFAOYSA-N	426.705	1.376	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cccc(F)c2Br)c1	814210652	IGLGGJHTHDWOJN-UHFFFAOYSA-N	444.282	1.913	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)NCC(=O)NCCN3CCCCCC3)cc2C1	814270393	IKMJWOCYCFQYKK-HNNXBMFYSA-N	435.594	1.809	50	20	IDGD	
Cc1ccc(Oc2ccccc2NC(=O)C(=O)NNC(=O)[C@@H]2CCc3nncn3C2)cc1	815692176	LHPHEGLNQYIZEW-OAHLLOKOSA-N	434.456	1.727	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)C(=O)Nc2cccc3c2CNC3=O)c1	815865832	GXWWUJJZWVVZBP-UHFFFAOYSA-N	447.245	1.561	50	20	IDGD	
CN(C)c1cc(F)c(C(=O)NNc2ccccc2S(=O)(=O)N(C)C)cc1[N+](=O)[O-]	817055261	UDDLNEWTJJHNID-UHFFFAOYSA-N	425.442	1.807	50	20	IDGD	
CCCC[C@@H](/N=C1/NS(=O)(=O)c2ccccc21)C(=O)NNC(=O)NC1CCCCC1	836541673	IHZDTYVWYOYUIG-MRXNPFEDSA-N	435.550	1.947	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccccc1F)NNC(=O)c1ccc(Br)s1	913161153	ATXPRNWPBJPWJZ-UHFFFAOYSA-N	436.284	1.389	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)CCc2c(C)c3c(C)nn(C)c3[nH]c2=O)cc1	914857747	XMRVFWBDAFPQGH-UHFFFAOYSA-N	426.477	1.079	50	20	IDGD	
O=C(COC(=O)Cn1cc(Br)ccc1=O)NNC(=O)c1ccc(Cl)cc1	915041524	SWSWYZZGJRGHIU-UHFFFAOYSA-N	442.653	1.269	50	20	IDGD	
CCCCS(=O)(=O)N1CCC(C(=O)NNC(=O)c2ccc(OC)c(OC)c2)CC1	915874483	IJAKJVNKKIDICC-UHFFFAOYSA-N	427.523	1.307	50	20	IDGD	
CN1CCN([C@H](CNC(=O)NNc2ccc(-n3cccn3)nn2)c2cccs2)CC1	915901024	CGMZKFHZBRBVPP-OAHLLOKOSA-N	427.538	1.339	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)c1	915902885	OTRGKEVCQDGBBU-GOSISDBHSA-N	445.545	1.155	50	20	IDGD	
CC(=NNC(=O)[C@@H]1COc2ccccc2O1)c1ccc(OCC(=O)N2CCOCC2)cc1	916292302	WKNXIOGIPZQHMI-NRFANRHFSA-N	439.468	1.604	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NC2CCN(C(=O)c3ccccc3F)CC2)cc1	916379890	XAJAXTBBWUKZTK-UHFFFAOYSA-N	444.463	1.848	50	20	IDGD	
CCCS(=O)(=O)N1CCC(NC(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)CC1	916383286	AYLVUSWCRKAHBA-INIZCTEOSA-N	440.566	1.605	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)NCc1ccc(N2CCO[C@@H](C)C2)nc1	916392622	FGBLYWKHSKMUII-INIZCTEOSA-N	427.505	1.779	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)NCc2cccc(C(=O)NCc3ccco3)c2)cc1	918133524	BZFWTAWNTIPTNC-UHFFFAOYSA-N	447.451	1.991	50	20	IDGD	
CNS(=O)(=O)c1ccc([C@H](C)NC(=O)NNC(=O)c2ccc(Cl)cc2OC)cc1	919778645	FXUCYJGIIDGSNW-NSHDSACASA-N	440.909	1.962	50	20	IDGD	
COc1ccc(-n2ccc(CNC(=O)NNC(=O)COc3ccccc3OC)n2)cc1	919917281	ZLUXBXCLKAZSAJ-UHFFFAOYSA-N	425.445	1.799	50	20	IDGD	
COCCCNC(=O)NNC(=O)c1ccc(NS(=O)(=O)c2ccc(C(C)=O)cc2)cc1	920862468	JJMQGGFROPUQCI-UHFFFAOYSA-N	448.501	1.671	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@@H](C)C(=O)NNC(=O)CNS(=O)(=O)c1ccccc1	1115812204	DWVHZFONYIUGCD-AWEZNQCLSA-N	439.921	1.850	50	20	IDGD	
CCOC(=O)c1c(S(=O)(=O)NNC(=O)c2ccc(Br)cc2)n[nH]c1C	1115862759	CRLDXOTZOYZVJA-UHFFFAOYSA-N	431.268	1.281	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)C[C@@H]2Oc3ccccc3NC2=O)CC1	1116087116	IGPDAPJVCLSAQL-INIZCTEOSA-N	432.477	1.571	50	20	IDGD	
CSc1ncc(Br)c(C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)n1	1118517890	LUTDLMDEKNIMFZ-NSHDSACASA-N	425.264	1.562	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ccc3nnnn3n2)CC1)c1c(Cl)cccc1Cl	1318268495	IXOGWIXSTUOFPG-UHFFFAOYSA-N	435.275	1.504	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccn(-c3ccncc3)n2)c1	1322039083	FVQVSQYOZPRHJL-UHFFFAOYSA-N	442.501	1.373	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)c2n[nH]cc2I)cc1	1324037219	VQNGXIUETKATNB-UHFFFAOYSA-N	435.247	1.022	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCc2c(F)cccc2NS(C)(=O)=O)cc1OC	1331970406	KXPBTCCWDRNFAQ-UHFFFAOYSA-N	440.453	1.359	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)c2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1	1347440259	AIEQRKJAEQWJCG-MRXNPFEDSA-N	445.545	1.396	50	20	IDGD	
COc1ccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](F)Br)C3)nc1	1778386411	JAOJWEJMRSHTME-RVKKMQEKSA-N	444.301	1.908	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4nncn4c3)C2)C1	1778593199	FVNGDJFIAQSQJJ-ACJLOTCBSA-N	436.310	1.204	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cnc(OCF)cn1)CCO2	1779295843	CWJZAKAJLUOHPP-SFHVURJKSA-N	426.521	1.077	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cccc(-n3cncn3)c1)CCO2	1779299073	OQRRMAJUZGVVQU-OAQYLSRUSA-N	443.580	1.562	50	20	IDGD	
C[C@H](Nc1ccccn1)C(=O)N1CC[C@]2(CN(C(=O)CCBr)CCO2)C1	1779321737	OHAHENNRMASNQY-KSSFIOAISA-N	425.327	1.497	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(-n4c(O)nnc4O)cc3)C2)C1	1780203336	FGFGSKQJSZCIFO-FOIQADDNSA-N	449.895	1.139	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)CCNC(=O)c3ccc[nH]3)CCO2)C1	1781223648	AKZMFHFXDCOBPI-MOPGFXCFSA-N	445.347	1.201	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)COc3ccc(C(=O)OC)cc3)CCO2)C1	1781226512	ZPGKOGGMLFFNNJ-UTKZUKDTSA-N	438.908	1.699	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cn1cc([N+](=O)[O-])cn1)C2)C(Cl)Cl	1782215045	VKZITTPVGVQTQJ-MLGOLLRUSA-N	434.280	1.109	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)CSc3ccncc3)CCO2)C1	1783529535	LPMGLEVVIFQMLZ-GUYCJALGSA-N	428.352	1.787	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccnn3-c3ccccc3)CCO2)C1	1783874489	HXPWMUVVNBYVKN-DYESRHJHSA-N	432.908	1.570	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc4nccn34)C[C@@H]21	1783973219	VDEOLIDAORGDJG-AESZEHBQSA-N	449.349	1.959	50	20	IDGD	
COc1ccc(F)cc1CC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1784084117	GPOCRINEBCFGCW-FUHWJXTLSA-N	447.276	1.897	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cn4c(Cl)cccc4n3)C[C@@H]21)[C@@H](O)CCl	1784091305	ZQWSJDAWDMGHQD-JURCDPSOSA-N	441.315	1.181	50	20	IDGD	
C[C@@H](Sc1cccs1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]2C1	1784091807	CPFZZNNAMGXVSQ-QTVXIADOSA-N	432.995	1.808	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CNC(=O)C(F)(F)F)C[C@@H]21	1784623457	GOKCOWSCNSFFIJ-RVMXOQNASA-N	427.851	1.052	50	20	IDGD	
CCOCCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)CCO2	1784696461	YQLZZNDIKCPCBN-OAQYLSRUSA-N	449.460	1.390	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(CO)c(F)c3)C2)C1	1785266125	KPKOVUIPQMMPPC-BEFAXECRSA-N	443.313	1.935	50	20	IDGD	
C[C@H]1[C@@H](C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](F)Cl)CCO3)CCN1C(=O)OC(C)(C)C	1785739425	WOLIQFUCQKOMKV-VPCSNGCSSA-N	447.935	1.996	50	20	IDGD	
COc1cccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)Br)C[C@@H]32)n1	1785812333	MBURJELZZJVAIP-ABHRYQDASA-N	426.311	1.467	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC1(c2ccc(NC(=O)C3=NN(C)C(=O)CC3)cc2)CCC1	1786657961	DBTJPDJHZPMBMW-UHFFFAOYSA-N	442.520	1.102	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CC(F)(F)C(=O)O)[C@H]2C1	1787435645	AIEPEOYBKMYCKJ-BJDJZHNGSA-N	441.269	1.250	50	20	IDGD	
C#CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]2C1	1787451277	FLQDALDSHWPUEE-QXKUPLGCSA-N	445.919	1.417	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4nccn4c3)[C@H]2C1	1788055453	BDQDUOSMURZHPF-HJWJTTGWSA-N	449.349	1.959	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1ccc(C2(NC(=O)[C@H](O)CCl)CCC2)cc1	1788642653	LDGPSMGYQLQSKD-FCLYZYNOSA-N	445.907	1.854	50	20	IDGD	
COC(=O)c1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]3C2)cn1	1788762475	BDOAOGWMCRSPBA-BQFCYCMXSA-N	449.580	1.313	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)[C@@H](O)CCl)CCC2)cc1)c1cc2n(n1)CCCNC2=O	1789221713	ZAKLTTIHGPTLKH-KRWDZBQOSA-N	445.907	1.364	50	20	IDGD	
Cn1ccc(=O)cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]2C1	1789870625	RHGUBJUCOWLBAF-BCRCDCHUSA-N	430.332	1.215	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4n(n3)CCCC4)C[C@@H]21	1791055711	GIAZGGHKRXTCKK-HPZZRFSDSA-N	439.354	1.596	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1ccc(C2(NC(=O)c3cnn4c3CCC4)CCC2)cc1	1791602544	MBUPLNDBLOPVMS-UHFFFAOYSA-N	438.532	1.950	50	20	IDGD	
C/C(=C\c1cccs1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCC(=O)NN(C)C)C2	1792462779	HEOKSKUJURFWQD-HUQGBOGLSA-N	434.562	1.114	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cn3ccccc3n1)C2	1792867439	BKBSQDLUVUHQRE-VWPFQQQWSA-N	435.322	1.569	50	20	IDGD	
CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CO[Si](C)(C)C)C2)C(=O)c1ccccc1	1793230966	BCCKZNDEXHZXFT-RMFSNUHRSA-N	447.608	1.200	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CC(=O)OC(C)(C)C	1793592908	NQIAKGKSPAKKKH-OQMKEHIESA-N	433.343	1.481	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1COc2ccccc2O1	1793846989	YBEOKGSOYQHNTC-HNKZQRQQSA-N	439.306	1.199	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cn1ccc2sccc2c1=O	1794316361	BOJMSOFOPRQHBR-FQLMCAECSA-N	437.949	1.955	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnc[nH]1	1794716865	YDTNLSTWVORCKA-PSKFDLRZSA-N	427.411	1.498	50	20	IDGD	
COc1c(C)cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)cc1C	1796193044	JRGOUMAGMZZEKU-WKCHPHFGSA-N	436.317	1.557	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1c[nH]c2nccc-2c1	1796193629	OGFQMKNUACBNRW-BQDHKBFISA-N	435.322	1.749	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2[nH]ccc2n1	1797394028	ZJUOQYKMWCWXCJ-KOFHJDLBSA-N	435.322	1.797	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)COC(=O)C(F)(F)F	1798338970	DQHNEUUHVSQINP-MMWGEVLESA-N	429.233	1.761	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cn1nccn1)C2	1799220545	BJPNTJSXRYWXAP-QDMKHBRRSA-N	442.432	1.064	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cocn1)C2)[C@H](Br)Cc1ccccc1	1800435505	IYJWUGQPSRBDNI-KYHPRHEASA-N	448.317	1.884	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C#CC1(O)CCCCC1)C2	1800642148	YNUGPPMMWSFXPJ-KYHPRHEASA-N	441.366	1.448	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H]2C[C@@]2(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Cl)C3)C1	1800714484	JTAWKCABHGJWOC-RNCJLBHCSA-N	445.919	1.367	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cc(F)ccc1Cl)C2	1800974316	SAOCIYGYEHBTBC-ZDFLXESQSA-N	433.307	1.865	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C[C@H]1CNc3ccccc3O1)C2	1800976685	BZLPWKPPNDKCGK-OYFMXXACSA-N	437.924	1.093	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C=C/c1ccccc1[N+](=O)[O-]	1802109544	KCYODFDZEJJFQS-WABMZUMLSA-N	437.880	1.451	50	20	IDGD	
N#Cc1ccc(CC(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)cc1	1803137457	PXZYDCIBKASCSY-SBHAEUEKSA-N	426.904	1.801	50	20	IDGD	
N#Cc1cc(CC(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)ccc1F	1803141940	WDQXDRKJOJTINF-BSIFCXSSSA-N	444.894	1.941	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NC[C@@H]1CCN(C(=O)[C@H](F)Cl)[C@H]1c1cccnc1	1804369206	PBNLFDDGENOZTH-WBAXXEDZSA-N	433.871	1.447	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC2(CCCN(C(=O)c3cnc(Cl)nc3)C2)CC1	1804675459	OOZOFQMUIRRGPY-UHFFFAOYSA-N	436.944	1.348	50	20	IDGD	
Cc1cc[nH]c1C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1805005151	SIVOGPXJWVBPIX-GHTZIAJQSA-N	432.289	1.031	50	20	IDGD	
Cc1cccc(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)n1	1805508496	WAKHIDJQLFHGNL-DENIHFKCSA-N	444.300	1.098	50	20	IDGD	
Cc1oncc1C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1	1805799562	SMUBMOHVVFHPIT-BEFAXECRSA-N	449.471	1.010	50	20	IDGD	
N=C(N)SCC(=O)N1CC[C@H](CNC(=O)CCBr)[C@@H]1c1cccnc1	1806341174	ZRNQWUUTVNWFCD-DOMZBBRYSA-N	428.356	1.499	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)c1ccc2nccnc2c1	1809384826	ONACXZXIDSZHNW-PWIZWCRZSA-N	439.903	1.944	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2cnc3[nH]ncc3c2)[C@@H]1c1cccnc1	1809712210	CDCHWOUMYCSVAM-WBAXXEDZSA-N	442.907	1.926	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)CC(N)=O)[C@@H]1c1cccnc1	1812774243	NHIJSYHENKSXNI-NZUILWFCSA-N	439.354	1.772	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2sccc2F)[C@H]1c1cccnc1	1813069005	RNQIWFZNKCDODZ-BEFAXECRSA-N	447.536	1.975	50	20	IDGD	
CCc1cc(C(=O)N2CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)n[nH]1	1813070564	IUBPIFPWPCNSHZ-IIBYNOLFSA-N	441.536	1.060	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H]2CNC(=O)O2)n[nH]1	1815279514	GSCDKFWXJVOGJX-USWWRNFRSA-N	428.287	1.684	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@H]1CCC(F)(F)C1)CC2)c1cccc(B(O)O)c1	1815347897	VXOUNGUSEMGQEK-JSGCOSHPSA-N	449.288	1.484	50	20	IDGD	
O=C1CCc2ccc(C(=O)Nc3nc4c(s3)C[C@H](NC(=O)[C@@H](O)CCl)CC4)nc2N1	1816659483	OAGBSRWUGRLWRF-MFKMUULPSA-N	449.920	1.248	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC[C@H]1c1cc(NC(=O)C[C@H](NC)C(=O)O)n[nH]1	1817368075	GWACFLNQPCOARC-DRZSPHRISA-N	444.330	1.638	50	20	IDGD	
COc1ncccc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1	1817471413	YZICUAHPGHVEBX-GOSISDBHSA-N	449.276	1.113	50	20	IDGD	
Cn1ncc2cc(C(=O)Nc3nc4c(s3)C[C@@H](NC(=O)[C@@H](O)CCl)CC4)ccc21	1818544027	RVVRBUXJDNMUCL-WFASDCNBSA-N	433.921	1.855	50	20	IDGD	
CC(C)N1CCC[C@H]1C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1	1822418275	YLIZBWBWWKMDRJ-ROUUACIJSA-N	447.584	1.648	50	20	IDGD	
CC[C@H](NC(C)=O)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](C)Br)sc2C1	1825631924	NEJDBWJGVPGGRA-GDPRMGEGSA-N	431.356	1.753	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(O)nn1)CC2	1825637399	ZDYDGJIJDCWCQK-YUMQZZPRSA-N	426.296	1.648	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(OC)nn1C)CC2	1825994067	PUPDDWJONFTQFW-VHSXEESVSA-N	427.914	1.365	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](C)Cn2cncn2)CC1	1829056994	DUVSZJZPFXEDKG-SZMVWBNQSA-N	425.961	1.788	50	20	IDGD	
Cn1ncc2c(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)C(C)(C)CCl)CCO4)cccc21	1830361828	FTBXBAOBAXIVGI-JOCHJYFZSA-N	448.951	1.908	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(F)cn3)C2)C1	1830537181	CITWDBNBMJBMSV-UGSOOPFHSA-N	444.301	1.322	50	20	IDGD	
CCc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)no1	1830540063	MKFMVAAXIFQEGE-ACJLOTCBSA-N	444.326	1.338	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(C(N)=O)cc3)C2)C1	1831659833	WGJGYBMJBGMSFQ-DYESRHJHSA-N	437.924	1.263	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnc(OC)c(F)c3)CCO2)C1	1833480470	JUBZSOKNZRBTNJ-MGPUTAFESA-N	443.903	1.707	50	20	IDGD	
COc1cc(C(=O)NC2CCN(C3CCN(C(=O)C(Cl)Cl)CC3)CC2)n(C)n1	1833955723	JADWLFNLWBLXIA-UHFFFAOYSA-N	432.352	1.418	50	20	IDGD	
Cn1ccnc1C(=O)NC1CCN(C2CCN(C(=O)[C@@](C)(Cl)CCl)CC2)CC1	1834270426	ISKUQCHGOQXQFF-IBGZPJMESA-N	430.380	1.842	50	20	IDGD	
CCc1ncccc1C(=O)N1CCOC[C@@]2(CN(C(=O)CCBr)CCO2)C1	1834819252	LYFLPHOYVPTCIT-LJQANCHMSA-N	440.338	1.499	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)COc3ccccc3)C2)C1	1834822514	RVYUKOIRBKIXDP-LJQANCHMSA-N	441.322	1.307	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NC1CCN(C2CCN(C(=O)[C@H](F)Cl)CC2)CC1	1834869020	QMZRQEHHIWAMNN-KRWDZBQOSA-N	428.892	1.115	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cc4n(n3)CCC4)CC2)CC1	1835609860	FMBGJYVAGZVCFF-SFHVURJKSA-N	437.972	1.268	50	20	IDGD	
O=C(C(Cl)Cl)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1CNc3ccccc31)CCO2	1835723069	QASNWHIUNJPACU-KUHUBIRLSA-N	428.316	1.456	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)c(O)n1	1837715193	BUGCFBSITNSXTB-FQEVSTJZSA-N	437.569	1.017	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(OC)cc3OC)CCO2)C1	1838880283	LFTPUOFFKBPEJQ-LAUBAEHRSA-N	440.924	1.791	50	20	IDGD	
C=CC[C@H](C(=C)C)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H](F)Br)CCO2)C1	1839201158	YIYCOTHQRKRGCZ-IIDMSEBBSA-N	433.318	1.902	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(O)c(F)c3)CCO2)C1	1839305932	NEMNVVOLAKYAPE-XIKOKIGWSA-N	445.285	1.385	50	20	IDGD	
CCc1nc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](Br)CC)CCO3)co1	1839965622	FNQLEDMHWVVCAM-FZKQIMNGSA-N	444.326	1.481	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3CCCS3)C2)C1	1839967442	MJJGEGWJXOJKCT-JJRVBVJISA-N	435.384	1.512	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1	1840034091	AEQMCKGERRIDIX-CQDKDKBSSA-N	446.169	1.463	50	20	IDGD	
Cc1nccn1[C@@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1	1840492256	JGUIVVKYUCUBBF-OXJNMPFZSA-N	438.601	1.060	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCCC12CN(C(=O)c1cccnc1CS(C)(=O)=O)C2	1841225586	JBTQGBKTLOOHPI-UHFFFAOYSA-N	427.954	1.708	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1cc(C)c(O)c(C)c1)C2	1843417206	IFPLKYUSVBEXDT-PCLIKHOPSA-N	437.500	1.960	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC2(CCCN2C(=O)c2nnc3cc(C)nn3c2C)C1	1843698697	SRUCVAGETFFFGD-ZDUSSCGKSA-N	435.326	1.732	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCCC12CN(C(=O)C1=NN(c3ccccc3)C(=O)C1)C2	1844377863	CDNDZCGGUIBUPO-UHFFFAOYSA-N	428.565	1.834	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCCC12CN(C(=O)c1ccc(CS(C)(=O)=O)nc1)C2	1845170288	JFKDDYRZTKBUJG-QGZVFWFLSA-N	448.372	1.680	50	20	IDGD	
CC(C)(C)OC(=O)N1CC2(C[C@H](C(=O)N3CCCC34CN(C(=O)[C@@H](F)Cl)C4)CO2)C1	1846120173	GQTMYCLAFAOCMW-UONOGXRCSA-N	445.919	1.750	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@H](CC(N)=O)NC(=O)OC(C)(C)C)C1	1847090054	JEFGPVTZGDKFQW-KGLIPLIRSA-N	444.960	1.366	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(F)cc1)c1cccc(S(=O)(=O)N2CCCC2)c1	16128553	YJIJVUQUDGWYAU-UHFFFAOYSA-N	427.479	1.234	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2ccc(C(=O)NNC(=O)c3ccccn3)cc2)cc1	17329262	XSYVAJBZZPIZFI-UHFFFAOYSA-N	426.454	1.966	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)NCCC(=O)NNC(=O)c2cc3c(s2)CCC3)cc1	17445315	WSLXYYRJGZVBBL-UHFFFAOYSA-N	435.527	1.569	50	20	IDGD	
COc1cc(C(=O)NNC(=O)COc2cccc(N3CCCC3=O)c2)cc(OC)c1OC	26956781	WKIBWQRCLJBYMX-UHFFFAOYSA-N	443.456	1.679	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)Cc2ccc3c(c2)OCCO3)cc1OC	28630204	SHINFYSFGCPCEX-UHFFFAOYSA-N	430.413	1.022	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)c1ccc(S(=O)(=O)N2CCCC2)cc1	28717359	FCXLVNOPCKCDKI-UHFFFAOYSA-N	441.307	1.637	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)N1CCC(OCCc2ccccc2)CC1	725874306	YJPJLAQRCSWMKC-UHFFFAOYSA-N	430.530	1.942	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)[C@H](C)NC(=O)c2n[nH]c3ccccc23)cc1OC	726382346	QYSHLIILZSNCCK-LBPRGKRZSA-N	425.445	1.550	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)on1)Nc1cccc(CN2C(=O)CNC2=O)c1	726873418	GJKANMBMVBIODU-UHFFFAOYSA-N	434.412	1.860	50	20	IDGD	
O=C(Cc1csc(N2CCOCC2)n1)NN=Cc1ccc(N2CCOCC2)c(F)c1	727254163	QCODPZPVSCEJNF-UHFFFAOYSA-N	433.509	1.648	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)NCCCN2CCC[C@H](C(N)=O)C2)c(C)n1C[C@@H]1CCCO1	728078312	YLDSSROZYKJBPW-ZUDJBQOZSA-N	441.576	1.895	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)CSc1nnc(-c2cccs2)n1C1CC1	728473411	KNUNUHLXYCVVIQ-UHFFFAOYSA-N	446.514	1.604	50	20	IDGD	
CN(C)C(=O)c1cccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1	728512015	JKTCSYVQXGMMOM-UHFFFAOYSA-N	444.513	1.248	50	20	IDGD	
CN(C(=O)CN1CCN(CC(=O)NNC(=O)c2ccccc2Cl)CC1)C1CCCCC1	728575597	CSQYLUMVMWOUHH-UHFFFAOYSA-N	449.983	1.510	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)c1ccccc1F)C(=O)NNC(=O)Cc1cccnc1	728892664	BNAMIUXFSARQDJ-OAHLLOKOSA-N	440.522	1.011	50	20	IDGD	
CC(C)[C@H](NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)c1nc(C2CC2)no1	729052032	DLMXRPIGNHJWAO-HNNXBMFYSA-N	428.497	1.681	50	20	IDGD	
C[C@H]1CCC[C@@H]1NC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	729624725	XWSXNMGHAXOKFS-YJBOKZPZSA-N	438.550	1.159	50	20	IDGD	
CC/C=C(\C)C(=O)N1CSC[C@@H]1C(=O)OCC(=O)NNC(=O)c1ccc(Cl)cc1	730321727	BQJKPZVZHANEDD-HETKQVNLSA-N	439.921	1.902	50	20	IDGD	
Cc1ccc(F)c2c1C(=NNC(=O)c1cccc(S(=O)(=O)N3CCOCC3)c1)C(=O)N2	732710105	FBFWOFITNMXZLA-UHFFFAOYSA-N	446.460	1.241	50	20	IDGD	
CCc1cc(N2CCC[C@H](NC(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)C2)ncn1	732914767	VZHQVTQZFFNBSC-INIZCTEOSA-N	446.533	1.056	50	20	IDGD	
Cc1nnnn1[C@H](Cc1ccc(F)cc1)C(=O)NNC(=O)c1cnn(-c2ccccc2)c1	733110306	HGIWYKHIIIMWBO-LJQANCHMSA-N	434.435	1.551	50	20	IDGD	
Cc1nc2[nH]n(C)c(=O)c2c(C)c1CCC(=O)NNC(=O)c1cnn(-c2ccccc2)c1	733169813	ATBTZZIQZRXMEK-UHFFFAOYSA-N	433.472	1.458	50	20	IDGD	
O=C(CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@H]12)NNC(=O)c1cnn(-c2ccccc2)c1	733170262	VUBULSFOSLWSFP-BQFCYCMXSA-N	428.518	1.359	50	20	IDGD	
Cc1ccc(CN2C[C@@H](C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)CC2=O)cc1	734241533	IEKGJNYBHSAVQN-INIZCTEOSA-N	433.509	1.199	50	20	IDGD	
Cc1[nH]c2ccnn2c(=O)c1CC(=O)NNc1ccccc1S(=O)(=O)NC(C)(C)C	734251000	SUPATRGCYWQHBO-UHFFFAOYSA-N	432.506	1.094	50	20	IDGD	
CN1C(=O)CC[C@@H](C(=O)NNC(=O)C(=O)NC2CC2)[C@H]1c1ccc(C(F)(F)F)cc1	734418355	KJJHWJPVDJOERI-UKRRQHHQSA-N	426.395	1.041	50	20	IDGD	
CN1CC[C@H](OC(=O)/C(C#N)=C\c2cn(CCC(N)=O)nc2-c2ccc(Cl)cc2)C1=O	734880378	DNEHJOZFVNBJLX-QXSWTLKVSA-N	441.875	1.760	50	20	IDGD	
COC(=O)CCn1c(S[C@@H](C)C(=O)NNC(=O)CC(C)C)nc2ccccc2c1=O	734982852	NUDMZNIBLPITHF-ZDUSSCGKSA-N	434.518	1.634	50	20	IDGD	
Cc1cccc(NS(=O)(=O)c2ccc(C(=O)NNC(=O)c3cnn(C)c3)cc2)c1C	735471084	MTBIEEHLTYUUFH-UHFFFAOYSA-N	427.486	1.913	50	20	IDGD	
NC(=O)CSCC(=O)NNC(=O)c1ccc(CN2C(=O)c3cccc4cccc2c34)cc1	735647054	SLADVODFIAMJNV-UHFFFAOYSA-N	448.504	1.980	50	20	IDGD	
Cc1cc(C(=O)N2CCC[C@H]2C(=O)NNC(=O)COCc2ccccc2)ccc1[N+](=O)[O-]	737634601	IKFZRSFAWUUQQF-IBGZPJMESA-N	440.456	1.872	50	20	IDGD	
CN(CC1CC1)S(=O)(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	737756915	QBZVAPWTGWCPBF-UHFFFAOYSA-N	441.513	1.266	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)NCCNC(=O)c1cccc(Br)c1	738496886	CQBUVRKEOIVRQF-UHFFFAOYSA-N	449.305	1.726	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2cc(C)nc3ccccc23)ccc1OC	739668096	ZKYXHPTWJBIBOD-UHFFFAOYSA-N	429.454	1.962	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2cc(Br)c[nH]2)ccc1OC	739670601	KZCIOWLHHCNWBM-UHFFFAOYSA-N	432.252	1.196	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)c1cccc(CS(=O)(=O)c2ccccc2)c1	740851508	ITVSTNLPJQJWQV-UHFFFAOYSA-N	431.514	1.726	50	20	IDGD	
O=C(CCS(=O)(=O)c1ccc2c(c1)OCCCO2)NNC(=O)c1c[nH]c2ccccc12	741143950	BVDLIYMYXWHQPH-UHFFFAOYSA-N	443.481	1.954	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@]2(C)CCc3ccccc3C2)cc1	742471801	KFTGYQBRLPDUHZ-JOCHJYFZSA-N	429.542	1.958	50	20	IDGD	
CCOC(=O)[C@H]1CCCN(C(=O)CN(C)C(=O)NNC(=O)c2cccc3ccccc23)C1	743628026	LJTAHEDFNACTBH-KRWDZBQOSA-N	440.500	1.928	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Nc2ccc(C)cc2Cl)cc(OC)c1OCC(N)=O	743824830	DETPPAAUSBGVMD-UHFFFAOYSA-N	436.852	1.996	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1cnc(-c2ccccn2)s1	744621845	RFJLTNPOYXQTFC-UHFFFAOYSA-N	445.526	1.983	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)c1ccc(Br)cc1Cl)CN1CCN(C)CC1	745863899	ZBOLSKSTAUSGNY-LBPRGKRZSA-N	446.777	1.930	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](CC(=O)NNC(=O)CNC(=O)c1ccco1)c1ccccc1	746162764	NQIXTIIFXWKGMS-OAHLLOKOSA-N	430.461	1.813	50	20	IDGD	
O=C(NNc1nc(-c2ccccc2)no1)[C@@H]1CN(Cc2nc(O)c3ccccc3n2)CCO1	746240959	DPTKMTDGBMUULC-KRWDZBQOSA-N	447.455	1.730	50	20	IDGD	
Cc1sc(=O)n(CC(=O)NNc2ccc(S(=O)(=O)Nc3nccs3)cc2)c1C	747943743	MIQFWEZSWIAXEC-UHFFFAOYSA-N	439.544	1.927	50	20	IDGD	
CCN(C[C@@H]1CCN(CC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)C1)CC(F)(F)F	747966218	FSIQYTCMIYOASZ-ZDUSSCGKSA-N	431.415	1.562	50	20	IDGD	
CCCCN1C(=O)C[C@H](C(=O)NNC(=O)C(=O)N2CCCC2)[C@H]1c1ccc(OC)cc1	748246704	GALJOFJKUNIBHY-PKOBYXMFSA-N	430.505	1.155	50	20	IDGD	
CC(=O)c1cccc(S(=O)(=O)NCCC(=O)NNC(=O)c2cc3ccccc3o2)c1	749543254	DENVWMORDXPGCR-UHFFFAOYSA-N	429.454	1.765	50	20	IDGD	
O=C(NCC1CCN(S(=O)(=O)C(F)F)CC1)NNC(=O)c1cc2ccccc2o1	749574149	ZYLKEXDMOQGTPM-UHFFFAOYSA-N	430.433	1.641	50	20	IDGD	
CCCN(CC)c1ccc(C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)cn1	750865844	MGINXVGMKRMAQE-UHFFFAOYSA-N	432.550	1.994	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N[C@@H](C)c2nc(C)no2)cc1	751395832	FPHNZZUWFUFVIZ-RKPNYOAGSA-N	449.471	1.910	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(C(=O)NNc2cc(Cl)nc(N)n2)cc1Br	753455608	ULDGMWDWWMFRGA-UHFFFAOYSA-N	449.718	1.482	50	20	IDGD	
O=C(NCCN1C(=O)[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)NNC(=O)c1c(Cl)cccc1Cl	755150548	VRKDFXJVYFLMRB-DUBDDPSESA-N	437.283	1.745	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Cc2cc[nH]n2)cc1S(=O)(=O)N[C@@H]1CCCC[C@H]1C	755268796	IAWPTSLNXUMLEY-CZUORRHYSA-N	449.533	1.279	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(NC(=O)NNC(=O)c2c[nH]nc2C)ccc1Cl	755431951	RLPNXUQNDQRKDK-UHFFFAOYSA-N	428.902	1.869	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)cc1OCC(F)(F)F	755666037	VEPCEXZDMHVRDB-SECBINFHSA-N	425.385	1.224	50	20	IDGD	
COC(=O)c1nscc1S(=O)(=O)NNC(=O)[C@@H](C)Oc1ccc2ccccc2c1	755957875	NQKWBCMHYILXAB-LLVKDONJSA-N	435.483	1.860	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNS(=O)(=O)c2ccc3c(c2)C(C)(C)C(=O)N3)cc1C	755959305	ZOCYNPVJTRYUED-UHFFFAOYSA-N	430.486	1.481	50	20	IDGD	
CCc1cc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)n(C)n1	756594487	NOEPEJPJMNCAGE-UHFFFAOYSA-N	434.522	1.624	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2cnn(CC(F)(F)F)c2)c1	756649246	MUXDHHQBEIRFTH-UHFFFAOYSA-N	434.400	1.162	50	20	IDGD	
Cc1nn(C)c2nc(-c3ccccc3)cc(C(=O)NNC(=O)C(=O)Nc3ccccn3)c12	758821251	LOMYHMAOWNNAQG-UHFFFAOYSA-N	429.440	1.738	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccnn1Cc1ccc(F)cc1	760279605	OFHSPCMAKLUBIN-ZDUSSCGKSA-N	443.410	1.763	50	20	IDGD	
COc1cc(Br)cc(S(=O)(=O)NNC(=O)CNC(=O)c2cccs2)c1	760511066	GMGGOXAAQNIARI-UHFFFAOYSA-N	448.320	1.259	50	20	IDGD	
COc1ccc2c(c1)OC[C@H]2CC(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	760614051	MOEQQXWIAORMOO-CYBMUJFWSA-N	429.385	1.474	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)C3=Cc4cc(F)ccc4OC3)CC2)cc1	761487314	HYHBXDAPDGDFHX-UHFFFAOYSA-N	438.503	1.875	50	20	IDGD	
CC(C)NS(=O)(=O)c1c[nH]c(C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)c1	763173116	JSZCLCRBDGTWJI-UHFFFAOYSA-N	434.453	1.305	50	20	IDGD	
COc1ccc(Cl)c(NC(=O)C(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)c1	763540126	RLVIWGPSMFDUGH-UHFFFAOYSA-N	437.836	1.774	50	20	IDGD	
O=C(NNC(=O)c1ccccc1F)C(=O)Nc1ccccc1I	763556007	JKHMRFHPHZPWBA-UHFFFAOYSA-N	427.173	1.830	50	20	IDGD	
CNC(=O)c1cc(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)ccc1Cl	763685412	BPENDTIIYRSVBC-UHFFFAOYSA-N	439.255	1.518	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2c(F)cc(F)cc2F)c2ccccc2c1=O	763786427	NVTLWCWIQIHXRO-UHFFFAOYSA-N	433.346	1.233	50	20	IDGD	
CC(C)CC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)cc1	763813427	MAAZVFLVBCGCLK-UHFFFAOYSA-N	437.456	1.708	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccc(F)c(-n2nnnc2C2CC2)c1	763919679	SAURNKYOWNKESC-UHFFFAOYSA-N	441.398	1.147	50	20	IDGD	
CN(C)CC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccc(Cl)cc2)cc1	763936389	IUGABKMYUQMAIF-UHFFFAOYSA-N	431.880	1.169	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc(-n4cncn4)c(F)c3)n[nH]2)cc1	764111821	UKPSHZWOYLJXFF-UHFFFAOYSA-N	448.418	1.505	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2cccc(Cl)c2-n2cncn2)cc1	764131137	GUMZXUIGVLWRCD-UHFFFAOYSA-N	442.863	1.648	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)C(=O)Nc1cccc(-n2nnnc2SC)c1)c1ccccc1	764328084	KNDIUDMXZYUEHS-MRXNPFEDSA-N	439.501	1.664	50	20	IDGD	
COc1nccnc1NNC(=O)[C@H](CCSC)NS(=O)(=O)c1ccc(C)cc1	764483947	JWTPEMCTSJLQBD-AWEZNQCLSA-N	425.536	1.337	50	20	IDGD	
COc1cc(OC)c(OC)cc1C=NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	764819240	PYZCWHJKZLWQEE-UHFFFAOYSA-N	440.500	1.621	50	20	IDGD	
CC(C)(C)OC(=O)NNS(=O)(=O)c1cc(S(C)(=O)=O)ccc1Br	764933177	XQDSPOVBQWHIDW-UHFFFAOYSA-N	429.314	1.571	50	20	IDGD	
Cc1cc(N2CC[C@H](NC(=O)NNC(=O)Cc3cccnc3)C2=O)ccc1Br	765244761	PRAUVTKERXBNFC-INIZCTEOSA-N	446.305	1.831	50	20	IDGD	
CC(C)(C)OC(=O)NCc1cc(C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)ccn1	766136658	WRUBROGAHZTMNF-KRWDZBQOSA-N	428.445	1.707	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)c2ccc(N3C(=O)CCC3=O)c([N+](=O)[O-])c2)c1	766343531	KWRQJYCMAOQEOF-UHFFFAOYSA-N	425.401	1.389	50	20	IDGD	
CC1CCC2(CC1)NC(=O)N(NC(=O)COC(=O)[C@@H](Br)C(C)(C)C)C2=O	766749830	FJJBKURNURQDKW-JKIHBJTHSA-N	432.315	1.871	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)c2ccc(N3C(=O)CCC3=O)c([N+](=O)[O-])c2)c1	767415527	QWLLAOUAGAFRRO-UHFFFAOYSA-N	440.412	1.705	50	20	IDGD	
CC(C)NC(=O)Nc1ccccc1C(=O)NNC(=O)c1csc(N2CCOCC2)n1	768993260	NBLFRTQSRJLVKM-UHFFFAOYSA-N	432.506	1.584	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCN(C(=O)OCc2ccccc2)C1)[C@@H]1COc2ccccc2O1	770080790	RCTJQUHGGVDSHW-APWZRJJASA-N	425.441	1.633	50	20	IDGD	
CCS(=O)(=O)N(C)C1CCN(C(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)CC1	770650015	SMPUHAFVUZQUQM-ZDUSSCGKSA-N	446.957	1.594	50	20	IDGD	
CCC[C@@](C)(O)C(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2OC)c1	770745825	HVASUOBKTGYSDY-HXUWFJFHSA-N	435.502	1.808	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CN2CCN(CCOc3ccccc3Cl)CC2)c1	771089006	BUHSMUXZFGDANV-UHFFFAOYSA-N	441.919	1.669	50	20	IDGD	
Cc1nc(C(=O)NNc2ccnc(Br)c2)nn1-c1n[nH]c(C(F)(F)F)n1	771538042	UNFQTLYFSYINOW-UHFFFAOYSA-N	432.164	1.627	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)c2cn(-c3ccc(C(F)(F)F)cn3)nn2)c1	773086347	FANASGHFIMRZRX-UHFFFAOYSA-N	434.338	1.109	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)CCN2C(=O)COc3ccccc32)C1	773411855	AWLSGWWQPOWQOE-HNNXBMFYSA-N	446.504	1.597	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccc(Cn2cncn2)cc1	774008642	KFRWKAXGVFFRFO-ZDUSSCGKSA-N	442.863	1.533	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1)Nc1ccnn1[C@H]1CCS(=O)(=O)C1	776054298	FGFNKJQXQICHPG-ZDUSSCGKSA-N	447.452	1.238	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)NCCc3ccc(OCC(F)(F)F)nc3)nc21	776248363	ZABYBBLCRQESOY-UHFFFAOYSA-N	426.359	1.274	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NC2CCN(S(=O)(=O)CC(C)C)CC2)cc1	777765465	SMSSWDPQGHMWMD-UHFFFAOYSA-N	426.539	1.154	50	20	IDGD	
CC(C)CS(=O)(=O)N1CCC(NC(=O)NNC(=O)[C@H](C)Oc2ccccc2F)CC1	777769770	ZCHYZNPHLJOTFI-AWEZNQCLSA-N	444.529	1.374	50	20	IDGD	
Cc1c(C(=O)N2CCN(S(=O)(=O)CBr)CC2)cnn1-c1ccc(F)cc1	777836836	LENUQAKIPIOFNZ-UHFFFAOYSA-N	445.314	1.760	50	20	IDGD	
COc1ccc(Br)c(S(=O)(=O)NNC(=O)CNC(=O)OC(C)(C)C)c1	777939368	LNFUTLXVADXASR-UHFFFAOYSA-N	438.300	1.292	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(OC(C)(C)C)nc2)cc1OC	778186909	NLPPCSPSSJGISB-UHFFFAOYSA-N	431.445	1.894	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2cc(Cl)ccc2OC[C@H]2CCOC2)n1	778707631	ONJWPBCRBRRKEG-AWEZNQCLSA-N	449.895	1.355	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)CNS(=O)(=O)c2cccc(C(F)(F)F)c2)c1	781038507	XGXCWMKHUSNSDP-UHFFFAOYSA-N	431.392	1.914	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H]2CC[C@@H](C1)N2CC(=O)NNC(=O)c1ccc(C#N)cc1	782513177	XEBMZFRMSQJVRZ-MSOLQXFVSA-N	427.505	1.793	50	20	IDGD	
O=C(NNc1nc2ccccc2s1)C(=O)Nc1ccc(N2CCCS2(=O)=O)cc1	782813066	GJDXIAAEIOMBFB-UHFFFAOYSA-N	431.499	1.918	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)cc1)C(=O)Nc1ccnn1Cc1ccc(Cl)c(F)c1	782834382	UJUMEWTWSGOITF-UHFFFAOYSA-N	431.811	1.829	50	20	IDGD	
CN(C1CCCCC1)S(=O)(=O)c1cccc(NC(=O)C(=O)NN=c2cc[nH]cc2)c1	783376212	JLFGWOROVSSRPL-UHFFFAOYSA-N	431.518	1.539	50	20	IDGD	
CC(=O)Nc1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)cc1C	784210287	LYYQXADZFNGXTC-UHFFFAOYSA-N	445.501	1.476	50	20	IDGD	
COC(=O)CNC(=O)c1ccc(NC(=O)C(=O)NNc2ccc(C(C)(C)C)cc2)cc1	784805323	DWQNWJAUIPWBCT-UHFFFAOYSA-N	426.473	1.969	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)F)cc1)C(=O)Nc1cccc2c1OCCO2	784833553	NWEQFPHBGSIFBO-UHFFFAOYSA-N	427.385	1.536	50	20	IDGD	
Cc1ccc(C(N)=O)cc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)C(F)F)cc1	784835767	HMDQZBKQCDGCFW-UHFFFAOYSA-N	426.401	1.172	50	20	IDGD	
O=C1CN(c2ccc(NC(=O)C(=O)NNc3nc(C(F)(F)F)cs3)cc2)CCN1	785145162	FSQNSYWOBKPIDC-UHFFFAOYSA-N	428.396	1.180	50	20	IDGD	
CCNC(=O)c1ccc(NC(=O)C(=O)NNc2c(OC)cccc2S(C)(=O)=O)c(C)c1	785330542	JWZCJKVQEQSCCD-UHFFFAOYSA-N	448.501	1.239	50	20	IDGD	
COC(=O)c1ccc(S(=O)(=O)NNC(=O)c2nnc(-c3ccccc3)o2)c(OC)c1	785485894	HDDMXNCHCASOND-UHFFFAOYSA-N	432.414	1.155	50	20	IDGD	
Cc1cc2c(cc1C)O[C@@H](C(=O)OCC(=O)NNC(=O)[C@@H]1COc3ccccc3O1)C2	786392417	VVWOMOHMGKXAFX-MOPGFXCFSA-N	426.425	1.138	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)[C@H]2CCC[C@H](C(N)=O)C2)c2ccccc2c1=O	786688720	RWFMXIHXCQMAJD-GJZGRUSLSA-N	427.505	1.639	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)[C@H]1CC(=O)N(c2cccc(Br)c2)C1	788176949	CMVZKLXDKARHOB-LBPRGKRZSA-N	442.277	1.921	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCC(F)(F)c2ccccc2)cc1	788846963	XWTCUCXFKRZISE-UHFFFAOYSA-N	440.472	1.738	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2nc(C(C)(C)C)cs2)cc(OC)c1OC	789730647	WBABLFZPATYKGE-UHFFFAOYSA-N	436.490	1.866	50	20	IDGD	
O=C(NNC(=O)[C@H]1OCC[C@H]1c1ccccc1)C(=O)Nc1ccc(-n2cccn2)c(F)c1	789810256	LYXKUECWOMCQAH-LPHOPBHVSA-N	437.431	1.670	50	20	IDGD	
O=C(Cc1cc(F)c(Cl)cc1[N+](=O)[O-])NNC(=O)c1csc(N2CCOCC2)n1	790482752	CTNJSQGKWMOFFA-UHFFFAOYSA-N	443.844	1.684	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)[C@@H]1CC(=O)N(C)[C@H]1c1ccc(Cl)c(Cl)c1	790664110	PLVVBJOIODNTQF-WBMJQRKESA-N	443.331	1.965	50	20	IDGD	
CC(=NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1)C1CN(C(=O)OC(C)(C)C)C1	794525269	WUUGJTQOACRCPM-UHFFFAOYSA-N	443.548	1.803	50	20	IDGD	
CNC(=O)c1cc(Cl)cc(S(=O)(=O)NNC(=O)c2cccc(Cl)c2)c1OC	795280683	RQLFEUIFYBLOPJ-UHFFFAOYSA-N	432.285	1.985	50	20	IDGD	
Cc1nnc(COCC(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)s1	796515660	ZWPGCHLUWXRVCH-UHFFFAOYSA-N	428.515	1.093	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2cnc(Cl)c(Br)c2C)n1	797369858	NTTOFKBOSDIDFY-UHFFFAOYSA-N	426.658	1.909	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)COc2ccc([N+](=O)[O-])c(C)c2)c2ccccc2c1=O	797411474	URZKCHLNJKZSPN-UHFFFAOYSA-N	439.428	1.863	50	20	IDGD	
N#CC1(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)CC1	797582708	MHKGZDKDUOKUOB-UHFFFAOYSA-N	427.486	1.413	50	20	IDGD	
CC(=O)N[C@@](C)(C(=O)NNc1nc(-c2ccncc2)no1)c1ccc(S(C)(=O)=O)cc1	797720646	ZMZCJPYYJYHGOR-LJQANCHMSA-N	444.473	1.030	50	20	IDGD	
CC(C)(C)OC(=O)[C@@H]1CC(C(=O)NNC(=O)NCC(F)(F)F)=NN1c1ccccc1	798315320	FHWGEOZCQMHLAQ-ZDUSSCGKSA-N	429.399	1.856	50	20	IDGD	
CO[C@@H](C)CS(=O)(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	800831466	VDKRLXOSYCFTGN-AWEZNQCLSA-N	430.486	1.044	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)C2(NC(=O)NCc3ccccc3)CCCC2)cc1	801109532	ROIHMNVUTWPMMD-UHFFFAOYSA-N	437.500	1.893	50	20	IDGD	
CC(C)OCCCn1c(NNC(=O)c2cncc(-n3ccnn3)c2)nc2ccccc2c1=O	801898252	OXOVIESHTNZRJH-UHFFFAOYSA-N	448.487	1.944	50	20	IDGD	
O=C(c1ccc(CN2CCCC2)cc1)N1CCN(S(=O)(=O)CBr)CC1	801947051	WCEUUZDACOPCFF-UHFFFAOYSA-N	430.368	1.722	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)N[C@@H](C)c1c(F)cncc1F	804867978	QQXGWOUUUYVFEQ-VIFPVBQESA-N	426.449	1.667	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNc1nccnc1C1CCC1	805463127	ZEXSBMIMLCWFTL-UHFFFAOYSA-N	445.545	1.841	50	20	IDGD	
COCCNC(=O)c1cccc(NC(=O)C(=O)NNc2ccnc(Br)c2)c1	807012524	VTAFRIRDMYXJMD-UHFFFAOYSA-N	436.266	1.302	50	20	IDGD	
O=C(NNc1ncccc1F)C(=O)Nc1ccc2c(ccn2CCN2CCOCC2)c1	807302068	WEVAMIKPCKZFOX-UHFFFAOYSA-N	426.452	1.589	50	20	IDGD	
CSCc1cccnc1C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	810341100	CQZUEDZTIYCPSU-UHFFFAOYSA-N	435.575	1.638	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)c1cn2c(Br)cnc2s1	815227918	LDOIYTSRXNPYAV-UHFFFAOYSA-N	428.293	1.411	50	20	IDGD	
O=C(NNc1cnccn1)C(=O)Nc1ccc([N+](=O)[O-])c(I)c1	815558159	SMSIWXCOZATXIW-UHFFFAOYSA-N	428.146	1.071	50	20	IDGD	
N#Cc1ccc(Oc2ccc(NC(=O)C(=O)NNC(=O)[C@H]3CCc4nncn4C3)cc2)cc1	815690960	AVTWWENMIWOBLK-HNNXBMFYSA-N	445.439	1.291	50	20	IDGD	
Cc1noc(C)c1CSCC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	856531860	JCTYQQPJGWXXDR-UHFFFAOYSA-N	431.562	1.884	50	20	IDGD	
CC(C)C[C@H](C(=O)NNC(=O)c1ccc2c(c1)OCO2)N1C(=O)[C@@H]2CC=CC[C@H]2C1=O	859355120	NTWTXTRQOFWHFO-BZUAXINKSA-N	427.457	1.542	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)[C@H](C)N2C(=O)c3ccc(Br)cc3C2=O)n1	893368152	GVMHULBJZFLEJX-NSHDSACASA-N	448.277	1.095	50	20	IDGD	
Cc1cc(C)cc(OCCC(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1	913395886	ULAQLNWTUDQZKL-LJQANCHMSA-N	428.441	1.603	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)CCNS(=O)(=O)/C=C\c2ccccc2)nc2ccccc21	913538441	RODMVBAWTQAONF-OWBHPGMISA-N	441.513	1.244	50	20	IDGD	
Cc1nnnn1[C@@H](Cc1ccc(F)cc1)C(=O)NNC(=O)[C@@H](C)Oc1ccccc1F	915697799	YHBVUZTXOBYFKI-PXAZEXFGSA-N	430.415	1.658	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)CCNS(=O)(=O)c2ccc3c(c2)OCCCO3)cc1	915783965	SYTDOFLAYMOJLE-UHFFFAOYSA-N	447.513	1.540	50	20	IDGD	
COc1cc(C=NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)ccc1OC(C)=O	916276449	DBSSGSYKPHFMFQ-UHFFFAOYSA-N	433.486	1.700	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)NC[C@@H]2CCS(=O)(=O)C2)cc(OCC)c1OCC	916375497	YQKBKHWMAAVGHV-ZDUSSCGKSA-N	443.522	1.261	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)NCCCN1CCN(Cc2ccccc2)CC1	916487328	ANBMGNOMYLZBJP-UHFFFAOYSA-N	443.523	1.743	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)CCCS(=O)(=O)N1CCCC1	917390694	XPDNBRJGUSPFKQ-INIZCTEOSA-N	433.530	1.960	50	20	IDGD	
CC[C@@H](NC(=O)NNC(=O)COc1ccc(C#N)cc1)c1ccccc1OCC(=O)NC	918221714	MCHYKUULPOYTHN-GOSISDBHSA-N	439.472	1.544	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)NC[C@H]3CCCO3)c2)c(O)c1	918337318	HPTOGTFVJJZAHX-OAHLLOKOSA-N	433.486	1.233	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)OCC(=O)NCc2cccc(C(=O)NC3CC3)c2)cc(C#N)n1C	919043993	FVWITAKKMNOBGJ-OCKHKDLRSA-N	445.479	1.864	50	20	IDGD	
CCn1c(O)nc2cc(C(=O)OCC(=O)NNC(=O)c3cccc(Cl)c3)ccc2c1=O	919459302	OJOOFGCDPCEHDI-UHFFFAOYSA-N	444.831	1.393	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)Cn2c(C)c(C)sc2=O)c2ccccc2c1=O	919810358	BVNIHHKPPMYHGT-UHFFFAOYSA-N	443.529	1.888	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(F)cc2)C1	919820503	JIVNJEZUTGWVNL-INIZCTEOSA-N	449.504	1.625	50	20	IDGD	
CCCCC(=O)NNC(=O)C[C@@H]1c2cc(OC)c(OC)cc2CCN1S(C)(=O)=O	920596071	DVTVPIWBTHIEPI-OAHLLOKOSA-N	427.523	1.290	50	20	IDGD	
O=C(COC(=O)CCCNC(=O)c1ccc(F)cc1)NNC(=O)c1cccc(Cl)c1	920628842	USJWMHULFDTKDK-UHFFFAOYSA-N	435.839	1.994	50	20	IDGD	
O=C(CN1CCCC1=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccc(F)cc2)c1	920827549	UHLHGMLKQFWPTL-UHFFFAOYSA-N	434.449	1.010	50	20	IDGD	
NC(=O)[C@H]1CCCN1Cc1cccc(NC(=O)NNC(=O)c2ccc(Cl)cc2O)c1	920939747	XARKYEBRPHABKF-MRXNPFEDSA-N	431.880	1.962	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)CCCC[C@@H]2SC[C@H]3NC(=O)N[C@H]32)cc1OC	921302885	RFOIFQQURLOKMA-RPVQJOFSSA-N	436.534	1.581	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1)C(=O)NCC(F)(F)F	1318621917	ASGMSHQMLRTPSO-JTQLQIEISA-N	439.435	1.031	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2cc(Cl)ccc2CS(C)(=O)=O)cc1	1323425115	FZBKNCYSCABNPQ-UHFFFAOYSA-N	432.907	1.517	50	20	IDGD	
CCOC(=O)c1cc(C(=O)N2CCO[C@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)ccn1	1779297827	AQCRTZBDYLVINK-NRFANRHFSA-N	449.580	1.553	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)n2ccccc2=O)C1	1779530888	JPHNDTGNCIIMRS-BZLDKRAPSA-N	439.940	1.177	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc([N+](=O)[O-])[nH]3)C2)C1	1780414865	VBCABVXYCIGGOK-BZNIZROVSA-N	429.271	1.397	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2)c1ccc([N+](=O)[O-])cc1F	1780880262	ZMIDKCDZVAIPRB-GPMSIDNRSA-N	443.859	1.461	50	20	IDGD	
O=C(c1cccc2c1OCC2)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781330212	UELIBQFORHHXHD-YJBOKZPZSA-N	427.270	1.756	50	20	IDGD	
Cc1ncncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)Br)C1	1781998100	SONFJSVKYVQGMB-CDHAZOANSA-N	425.327	1.696	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1cccc(OC)n1)C2	1782172448	UWHOJRQMXDRTEZ-CBGDNZLLSA-N	439.940	1.400	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1n[nH]c3c1CCCC3)C2	1782172544	GMAUPNJCHKKLKY-QLVMHMETSA-N	438.956	1.670	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CSCC(=O)O)C1	1782223712	BXVLMKBRYYKCJL-OAUYIBNBSA-N	441.377	1.554	50	20	IDGD	
CSCC[C@@H](O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@](C)(Cl)CCl)C2	1782232282	FHXYEPMHJUFZDX-KJWYOANISA-N	441.421	1.851	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3nc4ccc(F)cn4n3)CCO2)C1	1783535616	FVJHHNTWZBYRGO-DIFFPNOSSA-N	440.273	1.095	50	20	IDGD	
Cn1c(=O)c(C(=O)N2CCO[C@]3(CCN(C(=O)C(Cl)Cl)C3)C2)nc2ccccc21	1783947911	MIUWZOJDFYOSQO-IBGZPJMESA-N	439.299	1.181	50	20	IDGD	
Cn1c(=O)n(C)c2cc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]4C3)ccc21	1787447022	IJKBPMMASQVILG-MGBSGCIJSA-N	438.887	1.005	50	20	IDGD	
CCOC(=O)C(C)(C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]2C1	1789872584	ONHRJLUHGVYKCA-MNUAXYBXSA-N	437.364	1.792	50	20	IDGD	
CCC[C@H](NC(C)=O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]2C1	1789872651	PPIHGXBVKIJYPE-GMHRPJKWSA-N	436.380	1.507	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cn4c(F)cccc4n3)[C@H]2C1	1790420485	CVCKCHODHFNSRW-ZOBUZTSGSA-N	448.571	1.918	50	20	IDGD	
CN[C@H](CC(=O)NC1(c2ccc(NC(=O)[C@@H](F)Br)cc2)CCC1)C(=O)O	1790534950	XSXSTMPEJKDRFO-TZMCWYRMSA-N	430.274	1.874	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3n[nH]c4c(F)cccc34)C[C@@H]21	1791253829	HIEQBTHSYNJJPF-PCBIJLKTSA-N	438.887	1.549	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@](C)(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](O)CCl)C1	1793112631	SJQKJXVXXFDVTN-WUUQAYSMSA-N	443.972	1.871	50	20	IDGD	
CCC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCl	1793117452	MCUONQPNMMWDSO-XFIYOXNOSA-N	431.961	1.918	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C[C@@H]1OCCc2ccccc21	1793488646	OFJCUDONVIUECG-JTJHWIPRSA-N	442.560	1.702	50	20	IDGD	
Cc1nc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Br)C3)c(C)s1	1794181532	BITYVHZYXDQFTP-BAESOJJISA-N	434.331	1.583	50	20	IDGD	
C[C@@H](Oc1cccnc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCBr	1795116880	CILBNTVFPYINEX-VWPFQQQWSA-N	426.311	1.224	50	20	IDGD	
COc1cccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)CBr)C3)c1	1795239595	OBDNSZRBKOGZPB-JNNRSPCRSA-N	439.350	1.858	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1	1796188552	TWNDEUWBUOLPTL-ACDBMABISA-N	431.301	1.342	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1Cc2ccccc2O1	1797226866	DPYUQVLVPJPYAJ-FZMWSMFESA-N	437.334	1.753	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1c[nH]c2cnccc12	1797562038	HIFBRLGJTHBDSD-JRATXPSKSA-N	435.322	1.797	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(C)cc1-n1nccn1	1798630439	HFKOFSDHUTUCCQ-LORHWOILSA-N	431.924	1.796	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccnc3c1OCO3)C2	1799277886	VARGMRXEYMQHTB-IMEWIIRVSA-N	430.288	1.250	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3nn[nH]c3c1)C2	1799279863	VSPHDWCFPWCZJY-ABXQLRGKSA-N	426.304	1.397	50	20	IDGD	
Cc1ccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CO[Si](C)(C)C)C3)cc1[N+](=O)[O-]	1799330029	IIURJOFANMQGHX-UPHUGPLXSA-N	449.580	1.887	50	20	IDGD	
CCn1nc(C(C)C)cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Br	1799348310	DSTHCQLKSJUPDN-NOXHYTERSA-N	445.333	1.920	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(F)c(N(C)C)c(F)c1	1799836232	XVTZKOSTMPTSGK-UMPJEAMMSA-N	445.894	1.488	50	20	IDGD	
C[C@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](F)Br)[C@H]1SC(=N)NC1=O	1800159270	PKBTVPCJUHYRHF-ALMWHKAHSA-N	435.319	1.118	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc2nscc12	1801074500	ZKDXMFFMYMRDIF-QDMKHBRRSA-N	429.546	1.921	50	20	IDGD	
CCS(=O)(=O)N[C@@H](C)C(=O)N1CCC2(CCCN(C(=O)C(C)(C)CCl)C2)CC1	1805257398	AUEHSSGQDSBEKG-HNNXBMFYSA-N	436.018	1.810	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)NC[C@@H]1CCN(C(=O)[C@](C)(Cl)CCl)[C@H]1c1cccnc1	1808231659	IEBMLYZMHRIIHE-XMDUPGNXSA-N	444.363	1.771	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)[C@H](C)Cn2cncn2)[C@H]1c1cccnc1	1810480051	MRWVSHKFHHHDRY-YALNPMBYSA-N	449.353	1.799	50	20	IDGD	
COC(=O)C1(C(=O)N2CC[C@@H](CNC(=O)CO[Si](C)(C)C)[C@@H]2c2cccnc2)CC1	1810548998	WQXBVZSHHRDWLU-WMZOPIPTSA-N	433.581	1.892	50	20	IDGD	
CC(=O)NCCC(=O)NC[C@@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1	1812656593	QJDFYIUAJKTXKJ-MAUKXSAKSA-N	425.327	1.399	50	20	IDGD	
CC[C@H](NC)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1)CC2	1815306640	LIWGXLJWYJNKFI-IJWZPVHRSA-N	445.549	1.187	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cn[nH]c1)CC2	1817279757	CGXZVDGZIBGJJN-FVXKHRDXSA-N	440.489	1.226	50	20	IDGD	
COC[C@H](C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)n[nH]1	1818110531	JIFRGTHQMRQUPL-XJULRZDRSA-N	443.508	1.818	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1cccc(F)c1	1820489641	VYWGLIBENHUVSN-LJQANCHMSA-N	436.252	1.848	50	20	IDGD	
Cc1ccc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cccc(B(O)O)c2)CC3)cc1C	1822149930	PNULFEULNSSJBT-SFHVURJKSA-N	449.341	1.979	50	20	IDGD	
CN1N=C(C(=O)N[C@H]2CCc3nc(NC(=O)[C@H](F)Br)sc3C2)CCC1=O	1823002974	VUOYOVSGKAWJBY-MADCSZMMSA-N	446.302	1.354	50	20	IDGD	
CN1C(=O)CC[C@H]1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@](C)(Cl)CCl)CC2	1823051899	TXZJILQGMZGCAH-NVTQBHAOSA-N	433.361	1.912	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](O)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H](O)CCl)CC1	1824188190	OCPPAUJCVJQFQT-ARFHVFGLSA-N	447.960	1.049	50	20	IDGD	
COc1nn(C)cc1C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](C)Br)sc2C1	1825637143	SXZRWKJYXQGXNK-BDAKNGLRSA-N	442.339	1.894	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(O)n2)CC1	1825943423	KZCPEIYEFHSALA-FQEVSTJZSA-N	437.305	1.014	50	20	IDGD	
Cc1ccc(C(=O)N[C@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)c(O)c1	1826092145	OAKIGFWXDQNNCG-ZDUSSCGKSA-N	445.545	1.756	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)CC2CCOCC2)CC1	1826735156	KGUSFGMOKPSEDI-HXUWFJFHSA-N	436.597	1.796	50	20	IDGD	
O=C(C(Cl)Cl)N1CCC([C@@H]2CCCCN2C(=O)c2cc(=O)n3[nH]cnc3n2)CC1	1827048246	IXRCMJVAJRJTJV-ZDUSSCGKSA-N	441.319	1.455	50	20	IDGD	
C[C@@H](C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(B(O)O)cc1)CC2)c1ccccc1	1828230982	WWFFXCCJMPNEQF-KDOFPFPSSA-N	449.341	1.852	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)COc3ccccc3F)C2)C1	1830365153	BCMNEBYGQXANLJ-OAQYLSRUSA-N	442.915	1.926	50	20	IDGD	
Cc1cc[nH]c1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2	1830535504	PHAUCYSTQPRYTP-KSSFIOAISA-N	428.327	1.424	50	20	IDGD	
O=C(c1csc2c1CCCC2)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1830731076	HPVLYFSNQHKIDA-UZLBHIALSA-N	442.965	1.297	50	20	IDGD	
CSc1ccc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)cc1	1830738654	RNAZGFSJXKJBGJ-YLJYHZDGSA-N	442.965	1.007	50	20	IDGD	
O=C(C[C@@H]1COc2ccccc2O1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1831236128	WSRQAPGUDSGHEB-HEFCMCLBSA-N	442.871	1.207	50	20	IDGD	
CCNC(=S)NCC(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H](Cl)COC)CC1	1831834750	HMLGGPPIPFYRGB-CVEARBPZSA-N	433.018	1.344	50	20	IDGD	
C=C[C@H](O)C(C)(C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1	1831873110	AJLXEDQWYWJXDI-OALUTQOASA-N	436.597	1.552	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)Cc3c(C)noc3C)CC2)CC1	1833730365	RTWGLPIXEIDBBN-LJQANCHMSA-N	440.972	1.659	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cc(O)nc(O)n3)CC2)CC1	1835076600	SEBIURYSGJKOPN-CQSZACIVSA-N	425.917	1.090	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3ccc4ncnn4c3)CC2)CC1	1835633091	SMNZRZJCODVEEG-GOSISDBHSA-N	432.956	1.932	50	20	IDGD	
CCN1CCC(C(=O)N2CCC(OC3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)CC1	1836721525	QETNVVAXIUEXPC-IBGZPJMESA-N	429.989	1.317	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](C)Cn3cccn3)CC2)CC1	1837222720	XEGARZDJVZGPOO-LPHOPBHVSA-N	440.972	1.772	50	20	IDGD	
O=C(c1cnc(OCF)cn1)N1CCC(OC2CCN(C(=O)[C@@H](F)Cl)CC2)CC1	1837307226	MWKNDBMAZGERTL-MRXNPFEDSA-N	432.855	1.929	50	20	IDGD	
COC1(CC(=O)N2CCOC[C@@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)CCC1	1837717836	PDKKKIXKUAGYFG-FQEVSTJZSA-N	428.602	1.254	50	20	IDGD	
C=CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)CCO2	1838528296	ONNUIQUFMPCDMP-NRFANRHFSA-N	447.444	1.166	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnn4c(C)cc(C)nc34)C2)C1	1839144498	BUMVWHBXMAMALT-UTKZUKDTSA-N	449.939	1.434	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4nn(C)cc4c3)C2)C1	1839148237	RYNZLEVYVWLTKD-LAUBAEHRSA-N	434.924	1.661	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCCn3ccnc3)C2)C1	1839154907	BQBPGAVDSWTFLE-OALUTQOASA-N	447.363	1.356	50	20	IDGD	
C=CCOCCCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839198535	HFHKNSDYPHRYCR-WBVHZDCISA-N	437.306	1.116	50	20	IDGD	
O=C(c1cc(F)c(F)cc1F)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1839288716	JRCMELQSPSMQJR-KRWDZBQOSA-N	441.233	1.978	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccnc3C)C2)C1	1839963565	OHLNHEKYSHWFTR-QFBILLFUSA-N	440.338	1.634	50	20	IDGD	
Cc1ncc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)s1	1840032590	CPCUNAQLIUORMC-ZBEGNZNMSA-N	432.340	1.305	50	20	IDGD	
N#Cc1ccc(CCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)cc1	1840187080	JTKFXVMONICZJO-HXUWFJFHSA-N	440.327	1.751	50	20	IDGD	
Cc1cc(F)cc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)c1	1840241537	KCZGEFRWFOTDNJ-IBGZPJMESA-N	433.307	1.937	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](CCN)C(=O)N1CCCC12CN(C(=O)C(C)(C)CCl)C2	1842910995	IEVXGOKHWAFENR-CQSZACIVSA-N	430.977	1.697	50	20	IDGD	
O=C(c1ccccc1OC(F)F)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843015317	CYYRRDMZXCGCCL-UHFFFAOYSA-N	430.216	1.099	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1ccc(CC#N)cc1)C2	1843416575	AIDHNKYIZNWONN-WGOQTCKBSA-N	432.484	1.704	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC2(CCCN2C(=O)c2cccc3c2NC(=O)C3=O)C1	1844125697	NVYXQAUJTYXUBJ-NSHDSACASA-N	434.290	1.669	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC12CN(C(=O)c1cccc(N3CCOCC3)n1)C2	1846176917	MGXBQSGKURAFQA-AWEZNQCLSA-N	437.338	1.519	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@H]1Cc3[nH]nc(C(F)(F)F)c3C1)C2	1846364497	RTABLKYEFAZIJP-CMPLNLGQSA-N	434.846	1.601	50	20	IDGD	
Cc1cc(F)cc(CC(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)c1	1846434640	BDFROJUCFLUJQR-UHFFFAOYSA-N	425.464	1.192	50	20	IDGD	
CC(C)NS(=O)(=O)c1cccc(C(=O)NNC(=S)NCCc2cccs2)c1	11515990	WOZOLGZVCYAGDY-UHFFFAOYSA-N	426.589	1.786	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1	21290764	FZZUQWRELTXCFO-UHFFFAOYSA-N	435.473	1.158	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cccc(OC[C@H]3CCCO3)c2)c1	26228281	JOLNWIIJETTYFW-GOSISDBHSA-N	447.513	1.570	50	20	IDGD	
CSc1cccc(N2C[C@@H](C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)CC2=O)c1	27094030	DXODGUPKZHTPIQ-AWEZNQCLSA-N	437.485	1.198	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)c1ccc2c(c1)CCCN2S(C)(=O)=O	27199666	IOODIVKLNLDIPO-CYBMUJFWSA-N	435.477	1.766	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@@H](C)N2C(=O)NC3(CCCC3)C2=O)ccc1OC(C)C	110367534	SWGDAKSOCVEBEW-CYBMUJFWSA-N	432.477	1.497	50	20	IDGD	
O=C(CN(Cc1ccccc1)S(=O)(=O)c1ccc(Cl)cc1)NNC(=O)c1cnc[nH]1	725879898	QQGZRWOQAFIASX-UHFFFAOYSA-N	447.904	1.715	50	20	IDGD	
O=C(CCn1c(S)nnc1-c1cccs1)NNC(=O)CNC(=O)c1cccs1	725902729	SVTRSBGGHBRZNQ-UHFFFAOYSA-N	436.544	1.324	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)NC[C@@H](c1ccccc1Cl)N1CCCC1	726084983	FWRUYMYXANCCIV-INIZCTEOSA-N	433.896	1.830	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](CNC(=O)NNC(=O)COc2ccc(C#N)cc2)C1	726264953	BTHLYQUWPGDLCM-MRXNPFEDSA-N	431.493	1.915	50	20	IDGD	
CCS(=O)(=O)CCNC(=O)NNC(=O)c1cn(-c2ccccc2)nc1-c1ccccc1	727944194	WJTDKRDKSOBBAE-UHFFFAOYSA-N	441.513	1.918	50	20	IDGD	
CS(=O)(=O)Nc1cccc(CNC(=O)NNC(=O)c2cccc(OC(F)F)c2)c1	728594379	MRIIXCRDNIKGSD-UHFFFAOYSA-N	428.417	1.804	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)NCCNc2ncccc2C#N)c1	728748389	XVBVKYQEDCTUKG-UHFFFAOYSA-N	433.266	1.780	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)NNC(=O)c1ccc(Br)cc1Cl	728954630	LBYNHMZXSMEYBD-UHFFFAOYSA-N	426.658	1.715	50	20	IDGD	
COc1cccc(C(=O)N2CCN(C(=O)NNC(=O)Cn3ccc4ccccc43)CC2)c1	729506677	IVENXQLBSANAQN-UHFFFAOYSA-N	435.484	1.849	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)CCc2ccc(S(=O)(=O)NC3CC3)cc2)cn1	729692577	WIUKEQFVURSDLM-UHFFFAOYSA-N	449.558	1.481	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)c1ccccc1NS(=O)(=O)C(F)(F)F	730095320	AWULGLNWOZFUFT-AWEZNQCLSA-N	445.375	1.549	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)Cc2c(C)nc3[nH]n(C)c(=O)c3c2C)c1C	730103504	FYKSLWSKSNWGJX-OAHLLOKOSA-N	425.489	1.653	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)c2cn(-c3cccc([N+](=O)[O-])c3)nn2)cc1	731453656	PDXVWAOMIGAHJJ-CYBMUJFWSA-N	440.416	1.803	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)c2nn(-c3ccc(F)cc3)ccc2=O)cc1OC	731596916	LKWLWUJTKGGADN-UHFFFAOYSA-N	426.404	1.854	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)N[C@H]2CCN(c3ccccc3C(N)=O)C2)c1	732595077	LUKZBWSCTBFEJA-INIZCTEOSA-N	425.489	1.390	50	20	IDGD	
Cc1nc(S(=O)(=O)NCC(=O)NNc2ccc(Br)cc2Cl)cn1C	733806255	WZUYTLOPYAIWBA-UHFFFAOYSA-N	436.719	1.566	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)N[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)c2ccccc2c1=O	734218335	HZJHGABSCQNLLK-CYBMUJFWSA-N	444.492	1.277	50	20	IDGD	
CC(=O)N[C@@H](CC(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)c1c(F)cccc1F	734239483	PQUUEHZMLVVBCT-AWEZNQCLSA-N	443.451	1.387	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)c1ccc(CN2CCCCC2=O)cc1	734241880	LKNFITNXEBIZNS-UHFFFAOYSA-N	433.509	1.668	50	20	IDGD	
CN(C)[C@H](CNC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)c1c(F)cccc1F	734675740	LWXFOVIQMAMTEL-MRXNPFEDSA-N	440.472	1.615	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1cnn(-c2ccc(F)cc2)n1	737766536	PWNGDVUPXSUPPO-UHFFFAOYSA-N	431.453	1.083	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)CSc2ccc(Cl)cc2)nc2c1c(=O)n(C)c(=O)n2C	737767004	NSJNWBGLHAASHY-UHFFFAOYSA-N	447.904	1.147	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cc(O)nc3ccc(F)cc23)cc1OC	738811371	UMDCAKJCTUCUFU-UHFFFAOYSA-N	443.387	1.715	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)[C@@H](C)N2CCN(c3ccc(F)cc3)CC2)cc1	740982518	MDILLMCNORPZLO-QGZVFWFLSA-N	442.491	1.649	50	20	IDGD	
CC(C)c1nc(C(=O)NNC(=O)CNC(=O)c2cccs2)nn1-c1ccccc1F	741918722	ICASDBFBVCYIFY-UHFFFAOYSA-N	430.465	1.782	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)[C@@H](C)NC(=O)c2cc3c(C)nn(C)c3s2)c1O	743316697	GUMYHVKXIPBIRK-SNVBAGLBSA-N	431.474	1.237	50	20	IDGD	
CCNC(=O)NNC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(Br)s1	743900772	LKPBTTCRYBMAAP-VIFPVBQESA-N	439.357	1.404	50	20	IDGD	
Cc1ccc(-c2noc(CN3CCN(CC(=O)NNC(=O)c4cccc(C)c4)CC3)n2)cc1	744385287	GPHLHOQHHVDIKQ-UHFFFAOYSA-N	448.527	1.932	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1cc(C(=O)NNC(=O)Cc2cn3ccccc3n2)ccc1F	746554360	ZPZDLTKELXRSIU-UHFFFAOYSA-N	447.492	1.554	50	20	IDGD	
Cc1cccc([C@@H](CNC(=O)NNC(=O)Cc2cn3ccccc3n2)N2CCOCC2)c1	746750111	LJRGCDAGZVJBRD-HXUWFJFHSA-N	436.516	1.589	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)CC1(CS(C)(=O)=O)CC1	746821330	IPSKNWTXTPURGF-LLVKDONJSA-N	433.324	1.579	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)N2CCC[C@@H]2C(=O)NNc2ccc(OC)cc2)o1	746886133	JBJQLELBACYXCQ-OAHLLOKOSA-N	437.474	1.761	50	20	IDGD	
CCS(=O)(=O)N1CCN(C(=O)/C(C#N)=C\c2cc(C)n(C[C@H]3CCCO3)c2C)CC1	748055256	OXNROXQSTDVMGG-QRRJMBGHSA-N	434.562	1.685	50	20	IDGD	
O=C(CCC(=O)c1ccc(I)cc1)NNC(=O)C(=O)N1CCCC1	748246972	RLZHPJPRWNBLKD-UHFFFAOYSA-N	443.241	1.024	50	20	IDGD	
C[C@]1(c2ccc(C(=O)NNC(=O)c3cc(F)ccc3Br)cc2)NC(=O)NC1=O	748538855	YLGRMUMEULYGDT-GOSISDBHSA-N	449.236	1.718	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN2CCN(c3nccn4cnnc34)[C@@H](C)C2)cc1C	749450076	PRBKWLRZSRSSCH-AWEZNQCLSA-N	442.549	1.028	50	20	IDGD	
CS(=O)(=O)Nc1ccc(C(=O)NNc2nc(Br)cn3ccnc23)cc1	750248428	ZIOKHAAYAKVESN-UHFFFAOYSA-N	425.268	1.620	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)N[C@@H]1CCN(CCCc2ccccc2)C1=O	750291914	MYFLUGLDZIZVGR-GOSISDBHSA-N	438.484	1.636	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)N[C@H]1CCN(CCCc2ccccc2)C1=O	750292948	VJPSDKAURIDNPP-KRWDZBQOSA-N	426.473	1.335	50	20	IDGD	
CN(C)C(=O)CN1C(=O)C(=NNC(=O)CC(F)(F)F)c2cc(Br)ccc21	750934305	JXKQRUFNJOIGJV-UHFFFAOYSA-N	435.200	1.657	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2ccc(Cl)cc2Cl)n([C@@H]2CCS(=O)(=O)C2)n1	751359527	WHDWHYRHCXRYRF-LLVKDONJSA-N	446.316	1.940	50	20	IDGD	
C[C@@H]1C[C@H](CNC(=O)OC(C)(C)C)CN1C(=O)NNC(=O)CNC(=O)c1cccs1	752153628	GBGNXIAUPZPPLN-CHWSQXEVSA-N	439.538	1.454	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCCC[C@H]2c2nnc(C3CCOCC3)o2)n1	752926891	RDVDLLGLCIBEBJ-HNNXBMFYSA-N	448.549	1.646	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)N[C@@H]2CCN(Cc3ccc(C#N)cc3)C2=O)cc1C	753732478	MEVUQKFKDBYHCI-HXUWFJFHSA-N	435.484	1.685	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1S(=O)(=O)N(C)C	755393936	WUYBVRLQVYFYFM-UHFFFAOYSA-N	434.474	1.483	50	20	IDGD	
CN1CCN(CC(=O)N(C)c2ccc(NC(=O)NNC(=O)c3ccccc3O)cc2)CC1	756361315	WOQIIYIYZBYLFG-UHFFFAOYSA-N	440.504	1.069	50	20	IDGD	
CCOC(=O)[C@H](C)NC(=O)c1ccc(NC(=O)NNC(=O)c2ccc(Cl)nc2)cc1	756791857	XWYPLQDORJAXKC-NSHDSACASA-N	433.852	1.883	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)Nc1cc(C2CC2)nn1[C@H]1CCS(=O)(=O)C1	756854005	BPLMBHCOSRZURN-ZDUSSCGKSA-N	433.490	1.595	50	20	IDGD	
CCn1cc(S(=O)(=O)NNC(=O)c2cc(OC)ccc2Br)c([N+](=O)[O-])n1	756938087	DVDYZEGVSLHCFI-UHFFFAOYSA-N	448.255	1.206	50	20	IDGD	
CCc1c(C(=O)N2CCN(S(=O)(=O)CBr)CC2)cnn1CCC(C)C	757595747	VJMFXUANTGFTTK-UHFFFAOYSA-N	435.388	1.932	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)Nc2cccc(S(=O)(=O)NC)c2C)cc1OC	757722220	VNWQXUZGWFBQDY-UHFFFAOYSA-N	436.490	1.777	50	20	IDGD	
Cn1nc(Br)cc1C(=O)NNC(=O)COc1ccc(Br)cc1	757791392	FJBQWSLRZDVKRX-UHFFFAOYSA-N	432.072	1.785	50	20	IDGD	
Cc1nc2ccnn2c(C)c1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	760332037	OLJLWSNZFVFQQP-UHFFFAOYSA-N	442.501	1.205	50	20	IDGD	
C[C@H]1CCS(=O)(=O)CCN1C(=O)NNC(=O)[C@@H](C)Oc1cccc(Br)c1	763129880	WKRLFCIGMRJIBE-NWDGAFQWSA-N	448.339	1.466	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)[C@H](C)N2C(=O)c3ccc(C)cc3C2=O)n[nH]1	763150710	ADUWYWJSQMTUCP-ZDUSSCGKSA-N	447.451	1.839	50	20	IDGD	
O=C(NCc1cccnc1OCC(F)F)NNC(=O)c1csc(N2CCOCC2)n1	763459571	BUOURFVYIZXPHN-UHFFFAOYSA-N	442.448	1.163	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2)cc1-n1nnnc1C	763504159	RDFYHCWLJFHPCT-UHFFFAOYSA-N	429.824	1.032	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(OCCN(C)C)c2)cc1OC	763543723	NMBPMBMNHMBBJE-UHFFFAOYSA-N	430.461	1.044	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)COc2cccc(C)c2)ccc1Br	763624801	NRPBTTPBRXDMJX-UHFFFAOYSA-N	436.262	1.931	50	20	IDGD	
CCN1CCN(c2ccc(NC(=O)C(=O)NNC(=O)COc3ccccc3F)cc2)CC1	763681131	KMGKJGDUEVJJNT-UHFFFAOYSA-N	443.479	1.133	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1OC	763681569	LSRUXKVKDGDMFZ-UHFFFAOYSA-N	432.389	1.167	50	20	IDGD	
CN(C)C(=O)c1cc(NC(=O)C(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)ccc1F	763724063	VOTGEXNUQWJJSB-UHFFFAOYSA-N	430.480	1.830	50	20	IDGD	
COc1cc(C)c(NC(=O)C(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])cc1OC	763802313	ARZVRASFHJSVIV-UHFFFAOYSA-N	432.389	1.085	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)NCc3ccc(F)cc3)cc2)n[nH]1	764106288	HFHLRKPAYXMTSA-UHFFFAOYSA-N	438.419	1.187	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(-n3cnc4ccccc43)nc2)c(O)c1	764108041	AVPBEIDVLAFKSI-UHFFFAOYSA-N	430.424	1.834	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccc(C)cc1OC[C@@H]1CCCO1	764136045	MPYHFBIJLRSDGW-KRWDZBQOSA-N	441.484	1.890	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ncn(Cc2ccc(Cl)cc2)n1	764138729	IWGWVXQKDVEUJJ-UHFFFAOYSA-N	442.863	1.317	50	20	IDGD	
CCOc1ccc(C#N)cc1NC(=O)C(=O)NNC(=O)c1ccc(CN(CC)CC)o1	764138997	MIQDSGDWHJGIEG-UHFFFAOYSA-N	427.461	1.791	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2O1)C(=O)Nc1ccc(OC[C@@H]2CCCO2)cc1	764154323	PKZZLIWIPUODOR-HKUYNNGSSA-N	425.441	1.334	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CC2CCCC2)cc1S(=O)(=O)NC(C)(C)C	764178485	AVOAINCIWWOBNS-UHFFFAOYSA-N	438.550	1.738	50	20	IDGD	
COc1ccc(S(=O)(=O)NC(C)(C)C)cc1NC(=O)C(=O)NNC(=O)CCC(C)C	764197735	GWBJEVFOBBBNMS-UHFFFAOYSA-N	442.538	1.294	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)C(=O)Nc1ccc(C(=O)N2CCOCC2)cc1)c1ccccc1	764328010	ISEACFUTQHUKNL-LJQANCHMSA-N	438.484	1.439	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)C(=O)Nc1ccc(N2CCCS2(=O)=O)cc1)c1ccccc1	764330764	XNBZUZWNDROWBU-GOSISDBHSA-N	444.513	1.506	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)C(=O)Nc1ccc(NC(=O)C2CC2)cc1	764343974	WNXDHELOQRAJEV-UHFFFAOYSA-N	432.440	1.621	50	20	IDGD	
COC(=O)Nc1cc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)ccc1F	764351508	SGNWYEVWZXJRBM-UHFFFAOYSA-N	440.391	1.589	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)cc1C(=O)N(C)C	764393658	KOORVPKSVHWVSE-UHFFFAOYSA-N	430.486	1.281	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)C(=O)Nc1cccc(Oc2cnccn2)c1	764405981	ZTUOUKVVUAHQPN-UHFFFAOYSA-N	439.453	1.853	50	20	IDGD	
CCNC(=O)COc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2F)c1	764410240	BDQGHBKMKPFHJI-UHFFFAOYSA-N	436.827	1.394	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NN=Cc3cnn(C(C)C)c3)CC2)cc1	764819321	QURCTTIBFLTAMZ-UHFFFAOYSA-N	432.550	1.229	50	20	IDGD	
CC1(C)CCC[C@@]2(C1)NC(=O)N(CC(=O)NNC(=O)CSc1ccccc1O)C2=O	765247980	BZXAENJGBXUHCZ-FQEVSTJZSA-N	434.518	1.523	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)N[C@H]2CCC[C@H]2C(=O)NC)cc(OCC)c1OCC	765778863	QLACJYLWWWFZMF-CABCVRRESA-N	436.509	1.741	50	20	IDGD	
Cc1nn(C(C)(C)C)c(C)c1C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	766654734	VABOJBMQJWZRON-UHFFFAOYSA-N	440.548	1.474	50	20	IDGD	
Cc1c(C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)nnn1Cc1ccc(F)cc1	768138032	GWSXATYEIWBSRY-UHFFFAOYSA-N	434.472	1.840	50	20	IDGD	
CN(C)C(=O)c1cc(F)ccc1NC(=O)C(=O)NNC(=O)C(F)(F)Oc1ccccc1	768240736	AAODINIQRJPQDX-UHFFFAOYSA-N	438.362	1.285	50	20	IDGD	
CC(C)(C)OC(=O)N1Cc2ccc(C(=O)NNC(=O)C(=O)Nc3ccccn3)cc2C1	769001738	PXRNLBUZUVZFOR-UHFFFAOYSA-N	425.445	1.732	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)NC3CCN([C@@H]4CCC[C@@H]4O)CC3)n[nH]2)cc1	769154376	KGVBWJRENVSMFB-UXHICEINSA-N	426.521	1.707	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)NCCc1ccc(S(N)(=O)=O)cc1	770075520	HDPBMAQBNQIWOP-GFCCVEGCSA-N	440.909	1.328	50	20	IDGD	
CN(Cc1ccccc1)C(=O)CNC(=O)NNc1nc(O)c2cnn(C(C)(C)C)c2n1	770352586	WQXATTMZERDKCF-UHFFFAOYSA-N	426.481	1.572	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2ccc(NNC(=O)C3(O)CCC3)c([N+](=O)[O-])c2)cc1	771839027	DJCCRGPXMKPFPS-UHFFFAOYSA-N	436.446	1.762	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)CCNC(=O)c1cc(F)ccc1Br	772024999	OZNNBFZBNAKSAI-SECBINFHSA-N	432.246	1.197	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)CN(C)C(=O)c1ccc(Br)s1	772036218	IIDPSPWWTJUVCR-JTQLQIEISA-N	448.339	1.708	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NCCN(C)S(=O)(=O)c1cccs1	772623665	HVLGDKNNVFZALT-GFCCVEGCSA-N	444.510	1.306	50	20	IDGD	
O=C(NNC(=O)N1CCO[C@H](Cc2ccccc2)C1)c1csc(N2CCOCC2)n1	776315929	DFBQAQGDGGAXMH-MRXNPFEDSA-N	431.518	1.278	50	20	IDGD	
Cc1nn(C)c(-n2cccn2)c1C(=O)NNC(=O)COc1ccc(Br)cc1	777411752	ZZWIRYQIZSYRPV-UHFFFAOYSA-N	433.266	1.517	50	20	IDGD	
COCCCNC(=O)NNS(=O)(=O)c1cc(Br)c(Cl)c(C(=O)O)c1	777616089	CDMDROCGIBMWEY-UHFFFAOYSA-N	444.691	1.330	50	20	IDGD	
CC(C)N1CC[C@@H](NC(=O)NNC(=O)C(=O)NC2CC2)[C@H]1c1ccc(Cl)c(F)c1	777750538	PYVSITGMBBZSIR-HZPDHXFCSA-N	425.892	1.612	50	20	IDGD	
O=C(c1ccc(-c2ccccc2)nc1O)N1CCN(S(=O)(=O)CBr)CC1	777779836	SIBYXMGZDDDYGV-UHFFFAOYSA-N	440.319	1.894	50	20	IDGD	
CCOc1cnc(C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)cn1	777812477	FYQFTAAUKWPBCZ-UHFFFAOYSA-N	432.912	1.108	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)c1cccc(NC(=O)CCn2ccnc2)c1	778440819	FSVDJTGKPBBEEQ-UHFFFAOYSA-N	430.465	1.198	50	20	IDGD	
Cc1nn(CC(F)(F)F)c(C)c1[C@H](C)C(=O)NNc1nccc(N2CCOCC2)n1	778508691	KXUWUAYGORNYOK-NSHDSACASA-N	427.431	1.936	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)Cc2c(C)nc3nc(SC)nn3c2C)nc1C	778512416	UNMFCVFTVLJSRF-UHFFFAOYSA-N	430.494	1.424	50	20	IDGD	
O=C(NNc1ccc([N+](=O)[O-])cc1Br)C1=CN2CCS(=O)(=O)N=C2C=C1	779146921	NCURWPSKLYPNOC-UHFFFAOYSA-N	442.251	1.298	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)[C@@H](O)[C@@H](O)c1nc2ccccc2s1	779540973	VFXBVEDFBISBBA-DLBZAZTESA-N	433.511	1.639	50	20	IDGD	
N#Cc1ccc(S(=O)(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)c(Cl)c1	779843096	BSZGZFVJMYLVAH-UHFFFAOYSA-N	427.269	1.491	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12)c1ncn(C)n1	780703798	SHMMRDASLFURCZ-CQSZACIVSA-N	446.471	1.279	50	20	IDGD	
Cc1nn([C@H]2CCS(=O)(=O)C2)c2nc(C3CC3)cc(C(=O)NN=c3cc[nH]cc3)c12	781020184	SCJIUVWTFBPEEJ-HNNXBMFYSA-N	426.502	1.551	50	20	IDGD	
COc1ccc(-c2nn(CCC#N)cc2/C=C(\C#N)C(=O)OCc2nnnn2C)cc1OC	781865949	VUWKDGIMOARQOY-OQLLNIDSSA-N	448.443	1.655	50	20	IDGD	
CN(C)C(=O)CNC(=O)c1ccc(NC(=O)NNc2ncncc2Cl)cc1Cl	782055990	GBYXFZOYBSYAPY-UHFFFAOYSA-N	426.264	1.750	50	20	IDGD	
N#C/C(=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)O[C@H]1CCOC1=O	782180079	CSSXNRSMNSIUSM-WQMJKPAKSA-N	428.832	1.845	50	20	IDGD	
CCNC(=O)N(C)NS(=O)(=O)c1c(Br)cc2nc(O)oc2c1Cl	782478790	UFEXKELFVKFNPJ-UHFFFAOYSA-N	427.664	1.804	50	20	IDGD	
CC(=NNC(=O)CNC(=O)c1ccco1)[C@H]1CN(C(=O)OCc2ccccc2)CCO1	783841864	YBXCEUVFSZJNDX-GOSISDBHSA-N	428.445	1.539	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)CNC(=O)c2ccco2)cc1OC1CCCC1	784002384	DGCIAQNEJDPLCV-UHFFFAOYSA-N	444.444	1.126	50	20	IDGD	
Cc1cc(S(N)(=O)=O)cc(NC(=O)C(=O)NNc2ccc(OC(F)(F)F)cc2)c1C	784803815	NFZGIAZHLVRXFN-UHFFFAOYSA-N	446.407	1.931	50	20	IDGD	
CC(=O)N1CCCc2cc(NC(=O)C(=O)NNc3cccc(S(C)(=O)=O)c3)ccc21	784842293	XJUVNEVHHDKKMP-UHFFFAOYSA-N	430.486	1.471	50	20	IDGD	
NC(=O)C1CCN(Cc2cccc(NC(=O)C(=O)NNc3cc(F)c(F)cc3F)c2)CC1	784893159	JZLZXNUWVRXAAV-UHFFFAOYSA-N	449.433	1.883	50	20	IDGD	
COC(=O)c1ccc(N2CCCC2)c(NC(=O)C(=O)NNc2ccnc(N(C)C)n2)c1	784971321	YMAONDAVPANFBY-UHFFFAOYSA-N	427.465	1.011	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccc(C)c(C(=O)N(C)C(C)C)c2)n1	787543752	NBIYGSAKWDZCBG-UHFFFAOYSA-N	428.493	1.075	50	20	IDGD	
COc1ccc(-c2nn(CCC#N)cc2/C=C(\C#N)C(=O)NCc2nnn(C)n2)cc1OC	787853658	HBPBIVBNHLOIEP-OQLLNIDSSA-N	447.459	1.228	50	20	IDGD	
CCOC(=O)c1ccc(C)c(S(=O)(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c1	788741467	ISAGWDVKAIISNS-UHFFFAOYSA-N	440.499	1.199	50	20	IDGD	
COc1cc(NNC(=O)C(=O)Nc2cccc(S(=O)(=O)NC3CC3)c2)ccc1Cl	789795704	DIUXTSQUKVEGBY-UHFFFAOYSA-N	438.893	1.871	50	20	IDGD	
Cc1cccc(CCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)n1	792237599	MKYANKICUGTOIU-UHFFFAOYSA-N	445.545	1.751	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)cc(-n2cccn2)c1	792354827	LXERZHNNPWLOBJ-UHFFFAOYSA-N	448.483	1.420	50	20	IDGD	
O=C(Cc1ccc2c[nH]nc2c1)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	793682588	PAAURLHHYUAQLA-UHFFFAOYSA-N	440.935	1.724	50	20	IDGD	
Nc1nc(Cl)cc(NNC(=O)c2cccc(NN3C(=O)[C@@H]4CC=CC[C@H]4C3=O)c2)n1	793799091	BQFPOPINIXZFBM-CHWSQXEVSA-N	427.852	1.747	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C2=C(C)N(C)c3ncnn3[C@@H]2C)cc1Br	798962670	OTSPYPZVIFNSPW-SNVBAGLBSA-N	435.282	1.795	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)[C@@](C)(O)Cn2cc(C(F)(F)F)ccc2=O)c2ccccc2n1	799010323	XGMZFOOCZSNCCN-FQEVSTJZSA-N	448.401	1.936	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)c(C)c(OC)c1	800621969	CVZCWTMVBYRECL-UHFFFAOYSA-N	447.444	1.438	50	20	IDGD	
COc1ccc(S(=O)(=O)CCC(=O)NNc2ccc3c(=O)[nH]ccc3c2)cc1OC	803432742	FIOUSZAXRKPUCK-UHFFFAOYSA-N	431.470	1.852	50	20	IDGD	
COC(=O)Cc1c(C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)[nH]c2ccccc12	803712363	FUEYQFWNFMZIIE-UHFFFAOYSA-N	434.408	1.373	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(NC(=O)NNC(=O)COc2ccc(F)cc2)ccc1F	806544158	WCEJSWMLNPVJAN-UHFFFAOYSA-N	428.417	1.447	50	20	IDGD	
CCOC(=O)C(C)(C)c1csc(NC(=O)C(=O)NNC(=O)c2cccc(N(C)C)c2)n1	806974207	ZHHHVGBLDWFBDF-UHFFFAOYSA-N	447.517	1.450	50	20	IDGD	
CN(CC(=O)N([C@@H]1CCS(=O)(=O)C1)N(C)C)c1cc(Br)ccc1[N+](=O)[O-]	808023857	AZGUZNBRNAZRBF-GFCCVEGCSA-N	449.327	1.286	50	20	IDGD	
CCCNS(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)CCc2ccccc2O)cc1	808089712	WUCJJSNMQDZOKB-UHFFFAOYSA-N	441.531	1.023	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccccc1F)NNc1nc(Br)cn2ccnc12	810483970	JOZHQTAYLJRQPC-UHFFFAOYSA-N	443.258	1.053	50	20	IDGD	
CN1CCN(Cc2ccc(C(=O)NNc3ccc(S(=O)(=O)N(C)C)cc3)cc2)CC1	812727044	DXOZHCSFDWTPAR-UHFFFAOYSA-N	431.562	1.441	50	20	IDGD	
O=C(NNC(=O)C1(S(=O)(=O)c2ccc(F)cc2)CCCCC1)C(=O)N1CCCC1	813429223	NQXGQCISGZPWCW-UHFFFAOYSA-N	425.482	1.072	50	20	IDGD	
CC(=NNC(=O)COc1ccccc1O)c1cccc(S(=O)(=O)N2CCOCC2)c1	814951824	XTXDBMVSEFUGAK-UHFFFAOYSA-N	433.486	1.332	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)nc2)cc1)[C@@H]1C[C@H]1C	815567620	FUQQRZUNYVDCHD-BDJLRTHQSA-N	429.864	1.896	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)CNC(=O)OCc2ccccc2)cc(OC)c1C	815630242	ASUDDVHYQCUTPV-UHFFFAOYSA-N	444.444	1.025	50	20	IDGD	
CC(=O)N(C)c1ccc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)N(C)C)cc1	815751511	CENSGXZAMDEGQJ-UHFFFAOYSA-N	433.490	1.001	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)C(=O)Nc2cccc(C(N)=O)c2)c1	815866451	BOSMMZIUVBMDOK-UHFFFAOYSA-N	435.234	1.416	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@H]1CCO[C@H](c2ccccc2)O1	816827745	CWGLEDCVGHWKAF-BEFAXECRSA-N	432.502	1.553	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccccc1F)NNC(=S)NCCc1cccs1	849366478	BVEGQNHXYZCWQV-UHFFFAOYSA-N	430.552	1.294	50	20	IDGD	
CC(=O)Nc1cccc(-n2nnnc2SCC(=O)NNC(=O)c2ccc(Cl)cc2)c1	913123025	ATQIQGHBQPQMSZ-UHFFFAOYSA-N	445.892	1.827	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)c2cc(C3CC3)nc3c2c(O)nc(=O)n3C)c1	914163900	FTTGXTVRWUEQRQ-UHFFFAOYSA-N	437.456	1.368	50	20	IDGD	
CC(=O)Nc1cccc([C@H](C)NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1	916380057	AITLDLXQYLTPGQ-ZDUSSCGKSA-N	447.517	1.601	50	20	IDGD	
Cn1ccnc1[C@](O)(CCNC(=O)NNC(=O)c1cn(C)c2ccccc12)C(F)(F)F	916381844	WLQXHTJQIAJNMZ-GOSISDBHSA-N	438.410	1.696	50	20	IDGD	
C[C@@H]1CCCCN1[C@H](C)CNC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	916446916	DGQBXASUKSZGQP-WOJBJXKFSA-N	430.597	1.792	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)COc1ccc(F)cc1)c1ccc(OCC(=O)NC2CC2)cc1	916488327	BKBWTJORLOSMHG-CQSZACIVSA-N	444.463	1.954	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)NCCN1CCN(c2ccc(F)cc2)CC1	916513936	VYMWQEUVNNPGGB-UHFFFAOYSA-N	433.459	1.496	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)NCCCN2CCN(C(=O)OC(C)(C)C)CC2)c1	916644829	YAXSPYKOOGBVDU-UHFFFAOYSA-N	449.552	1.647	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)c2cccc(NC(=O)[C@@H]3Cc4ccccc4O3)c2)n1	917392140	RPNIDFWGTXHJLE-FQEVSTJZSA-N	433.468	1.903	50	20	IDGD	
Cc1ccc(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1F	917717680	JOQXUTRLDHUHEZ-UHFFFAOYSA-N	441.506	1.542	50	20	IDGD	
Cc1cc(C)cc(N2CC[C@@H](C(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)C2=O)c1	919712819	SFTLDGOXDWIMLP-SFHVURJKSA-N	429.498	1.521	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)[C@H]1CC(=O)N(c2ccc3c(c2)OCCO3)C1	919819971	CRLJYTAUWNQPQA-HNNXBMFYSA-N	425.441	1.209	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H](C)OC[C@H]2CCCCO2)c1	921165047	HIQPPKHVBKQPAT-DOTOQJQBSA-N	441.550	1.452	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2csc(-c3ccco3)n2)CC1	1306648122	CJTRRVRAVZJDOV-UHFFFAOYSA-N	448.530	1.491	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1n[nH]c3c(F)cccc13)CCO2	1779297115	RSZPWKAFOFPPFO-HXUWFJFHSA-N	434.544	1.997	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@]2(C1)CN(C(=O)c1ccc3c(c1)CC(=O)N3)CCO2	1779297175	UKPNUKGEKFBCBZ-NRFANRHFSA-N	431.565	1.476	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2)c1ccn(-c2ccccc2)n1	1780182608	SVOXKBIJKDYNHZ-NNMXDRDESA-N	446.935	1.600	50	20	IDGD	
C[C@@H](NC(=O)c1ccc(F)cc1)C(=O)N1CC[C@@]2(CN(C(=O)C(Cl)Cl)CCO2)C1	1780907410	YJIIKPAGYLRVQE-BLVKFPJESA-N	446.306	1.578	50	20	IDGD	
O=C(c1noc2c1CCCC2)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781331066	KLGGUVCPFPBIAB-PBHICJAKSA-N	430.274	1.687	50	20	IDGD	
COc1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](F)Br)C3)C2)ccc1F	1781335097	TXIMCUYGWZYILH-WMLDXEAASA-N	433.249	1.968	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H]2Cc3ccccc3N2)C1	1781589216	TZJGQZNOUMKAOP-ITBLURSFSA-N	435.952	1.791	50	20	IDGD	
COc1cc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](F)Cl)CCO3)c(F)c(OC)c1F	1781950303	FLZQMMASBKOOFT-QAPCUYQASA-N	436.814	1.960	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3cccn4nccc34)C2)C1	1782328302	BFGWAWAXOTUUEQ-LIRRHRJNSA-N	435.322	1.809	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cnc4[nH]ncc4c3)CCO2)C1	1783348860	CNHTWYRXPZAECL-KSSFIOAISA-N	436.310	1.575	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(N(C)C)nc3)CCO2)C1	1783352066	MSNGHILHAMXJBO-DNVCBOLYSA-N	439.354	1.765	50	20	IDGD	
COc1cncc(CCC(=O)N2CCO[C@]3(CCN(C(=O)[C@H](C)Br)C3)C2)c1	1783529971	PZNCSHUZMOQJOV-IFXJQAMLSA-N	440.338	1.636	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)N3C[C@H]4C[C@@H]4C3)C[C@@H]21	1783967816	XOEUVPVPTMJBDQ-VCWNUMGPSA-N	442.398	1.337	50	20	IDGD	
C[C@@H](Sc1cccs1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]2C1	1784091805	CPFZZNNAMGXVSQ-FQKPHLNHSA-N	432.995	1.808	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cn3cc(Cl)cn3)[C@H]2C1	1787002101	XOJKJVMNFASHPO-DHMWGJHJSA-N	447.761	1.547	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4cncn4c3)[C@H]2C1	1788424599	FFEOVMRAQOHZCZ-IKICRFKJSA-N	449.349	1.959	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccn4nccc4c3)C[C@@H]21	1788764820	WWNSYKJGNOJNQI-WDSOQIARSA-N	430.581	1.779	50	20	IDGD	
Cc1nccnc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)CBr)C[C@@H]21	1789032058	GIVDDCSHWRHHRW-UNQGMJICSA-N	425.327	1.409	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)c1cc2cccnn2n1	1789141562	JGMVBQDUAVZRKJ-NOLJZWGESA-N	436.310	1.108	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)COc3ccccc3)C[C@@H]21)[C@H](F)Br	1789922161	DNPJIKOQWFFGMP-QEWYBTABSA-N	429.286	1.736	50	20	IDGD	
C[C@H](Cn1ccnc1)C(=O)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1	1791868480	BRIRLHRVNHSAPJ-QGZVFWFLSA-N	446.316	1.647	50	20	IDGD	
CC(C)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ncn(-c3cccc(F)c3)n1)C2	1792782423	OXFBVABIESNHGE-XOIINTDNSA-N	449.914	1.875	50	20	IDGD	
CC(C)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nc3cc([N+](=O)[O-])ccc3[nH]1)C2	1792784869	YJLYFQMOIWJAIJ-DRXBFXEBSA-N	449.895	1.939	50	20	IDGD	
COc1cccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)CBr)c1	1792868371	XBVHTKHJKDLNDD-JNNRSPCRSA-N	439.350	1.858	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)CBr	1792872078	LMKCRVBLOUTSLK-NAWOPXAZSA-N	440.176	1.781	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1csnn1	1793501362	AFLHBXFRJIWSLX-XSDCOXNMSA-N	445.451	1.627	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1COc2ccccc2O1	1793842337	IMDASVNUHMDIOC-UZSUOLLMSA-N	443.327	1.652	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc2[nH]ncc12	1796160587	OBKQBCDMPQNAAY-DJZPMSPPSA-N	435.322	1.940	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1c[nH]c2nccc-2c1	1796200307	UTMFHQXVLHOMMN-QKPAOTATSA-N	435.322	1.891	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1ccc(F)cn1	1796238341	WIJQQVQCBMZLDQ-DIWZVOJHSA-N	440.479	1.535	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(Br)c(O)c1)C2)[C@@H](F)Cl	1796366844	ISSCTMYLXGRGLT-RDBQEKCUSA-N	435.677	1.892	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCC(F)(F)F)C2	1796440147	FXXHEMSTXFIBKS-OQLCOEBBSA-N	443.426	1.053	50	20	IDGD	
CC(C)(C)c1cnc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCBr)C3)cn1	1796757825	VFTFWRLIWJLUCK-FVCICTRLSA-N	439.354	1.762	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2cc(OC)ccc2n1	1797004210	YNGNWPUKBBQIJJ-DOHHPOSVSA-N	447.919	1.700	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cn2cccnc2n1	1797389711	GDZIVIOZNCZJSR-AZGFTEDZSA-N	426.304	1.169	50	20	IDGD	
CC(C)N1CCC(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CO[Si](C)(C)C)CC1	1797952609	AIFRZPHSGDWOJL-OPVJXMOQSA-N	425.646	1.548	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)COC(=O)C(F)(F)F	1798338968	DQHNEUUHVSQINP-CHWFTXMASA-N	429.233	1.761	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnc[nH]1)C2	1799220132	SWHAYLRIWPLCKX-BTTYYORXSA-N	427.417	1.809	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@](C)(Cl)CCl	1799273526	JTGOJTCRIBKRRO-BJIWRROBSA-N	430.170	1.843	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc2c(c1)NC(=O)[C@@H](C)O2	1799293752	LRSRGIDTVFFRKH-JZYAIQKZSA-N	435.908	1.912	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cccnc1Cl)C2)[C@H](F)Br	1799344550	NQMOEEGNRQABMO-XCCSTKFXSA-N	434.693	1.558	50	20	IDGD	
C[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Br)c1ccc(O)cc1	1799348218	DNMUBBNFRXRGRW-LLKOPVJYSA-N	429.286	1.776	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CCCN1C(=O)OC(C)(C)C	1800784571	WRTANDHWSBAAPB-NNXHMXCWSA-N	443.972	1.993	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc([N+](=O)[O-])cc1F)C2	1800979760	ZDTGELCVLYFTKI-HRJSJKBJSA-N	443.859	1.120	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cc(F)ccc1[N+](=O)[O-])C2	1800982691	JDABGCXFAMTQJF-ZFHGCVPZSA-N	443.859	1.120	50	20	IDGD	
C[C@@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](O)NC(=O)OC(C)(C)C)C2	1801965337	HCJNJQSPVLEVNN-YGEZULPYSA-N	434.331	1.251	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)COc1ccccc1C#N	1801991758	NCPIEXASVGVUIV-BAAGSCJXSA-N	440.327	1.763	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(F)c(F)cc1F)C2	1802337913	GTBJEIBXJVCNHC-CLLJXQQHSA-N	426.439	1.729	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC2(CCCN(C(=O)[C@H]3CCC(F)(F)C3)C2)CC1	1804770235	ZFPIQDMZNSPHCK-HNNXBMFYSA-N	449.502	1.965	50	20	IDGD	
C=CCNC(=O)/C=C\C(=O)N1CC[C@H](CNC(=O)CCBr)[C@@H]1c1cccnc1	1806337193	GTWDTXPMKPMHAH-VPCYTDGVSA-N	449.349	1.731	50	20	IDGD	
Cc1noc(C)c1CC(=O)N1CCCC2(CCN(C(=O)CCC(=O)NN(C)C)CC2)C1	1806765671	WDSNMMDWLWMFRM-UHFFFAOYSA-N	433.553	1.438	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)c(C)o1	1807369418	JFMWAIUZGUETGZ-DENIHFKCSA-N	447.300	1.605	50	20	IDGD	
COCCOCCOCCC(=O)N1CC[C@H](CNC(=O)[C@@H](F)Cl)[C@@H]1c1cccnc1	1808320239	IHNZHHFLYQUZOS-NZSAHSFTSA-N	445.919	1.692	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)[C@H]2C[C@H]2F)[C@H]1c1cccnc1	1808416188	GPBFKUXVZXGEPR-QUODBWSBSA-N	440.479	1.579	50	20	IDGD	
CN1C(=O)CC[C@H]1C(=O)NC[C@H]1CCN(C(=O)CO[Si](C)(C)C)[C@@H]1c1cccnc1	1808768666	BKFULTGBSUVPFL-FUHIMQAGSA-N	432.597	1.560	50	20	IDGD	
Cc1ncc(C(=O)NC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)s1	1808907071	HPHJXIBRPGQQEQ-OXJNMPFZSA-N	444.561	1.539	50	20	IDGD	
CC(=O)Nc1cc(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)ccn1	1808920287	WZOOFDFCTKLTTD-JENIJYKNSA-N	445.907	1.354	50	20	IDGD	
Cc1ccc(C(=O)N2CCC3(CCCN(C(=O)c4cccc(B(O)O)c4)C3)CC2)s1	1809975089	SLIBUKBLVSGGMR-UHFFFAOYSA-N	426.347	1.895	50	20	IDGD	
CC[S@](=O)CCC(=O)NC[C@@H]1CCN(C(=O)[C@H](Cl)COC)[C@@H]1c1cccnc1	1810119981	BXRBGPDLPCUFCA-RJMGVLRKSA-N	429.970	1.500	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1CCN(C(=O)c2c[nH]c(=O)cn2)[C@H]1c1cccnc1	1810544407	MDJSXRUCGFQCAB-KXBFYZLASA-N	429.553	1.336	50	20	IDGD	
Cc1ccc(CC(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2ccc(B(O)O)cc2)CC3)cc1	1813978256	BIFUXQOKDYKTRY-SFHVURJKSA-N	449.341	1.600	50	20	IDGD	
Cc1ccncc1C(=O)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1	1815354620	MQBQIFWVSCZFFS-OAHLLOKOSA-N	436.302	1.066	50	20	IDGD	
CCn1ccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)n1	1816556375	BAZSWXRHEYEARS-INIZCTEOSA-N	430.513	1.305	50	20	IDGD	
O=C(Cc1ccccn1)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1817637439	RPZDLLOXJNELHZ-LJQANCHMSA-N	433.277	1.033	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)C2=COCC2)[nH]n1	1818114277	QPSCBZBBIGWXMN-ZRWQFTNJSA-N	439.476	1.840	50	20	IDGD	
CC(=O)N1CCN(CC(=O)Nc2nc3c(s2)C[C@H](NC(=O)C(Cl)Cl)CC3)CC1	1818898395	KMWSIRDUNAVJNG-LLVKDONJSA-N	448.376	1.023	50	20	IDGD	
C=CCO[C@@H](C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819401620	LCAYALLYDUHBJZ-SUMWQHHRSA-N	441.492	1.305	50	20	IDGD	
C[C@](O)(CC(=O)O)CC(=O)N1CCCC[C@H]1c1cc(NC(=O)CO[Si](C)(C)C)n[nH]1	1819597418	YIKNVTAEHQEGGT-IFXJQAMLSA-N	440.573	1.869	50	20	IDGD	
C[Si](C)(C)OCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(O)nc(O)n1)CC2	1820165016	PVQPYYYQOBANPU-SECBINFHSA-N	437.554	1.422	50	20	IDGD	
CC[C@@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1820857093	YNUFCSRKGAMIGN-HIFRSBDPSA-N	433.900	1.732	50	20	IDGD	
CNC(=S)NCCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](F)Br)n[nH]1	1820934981	DWSUFBASWNUKBK-ZWNOBZJWSA-N	449.350	1.576	50	20	IDGD	
CN1CCC[C@H](C(=O)N2CCCC[C@@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)C1	1822415440	HEKWUNCRNVGQRP-DOTOQJQBSA-N	433.557	1.117	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1nc[nH]c1[N+](=O)[O-])CC2	1825641088	MTBUHGINSLZEKH-NKWVEPMBSA-N	443.283	1.784	50	20	IDGD	
CCn1nccc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1	1826097636	KDCNSMWOOLAKKE-FQEVSTJZSA-N	438.337	1.130	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(F)n3)C2)C1	1830540083	MQUKOHIKTOANID-ACJLOTCBSA-N	444.301	1.322	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCC([C@H]2CCCCN2C(=O)CN(CCO)CCO)CC1	1831481645	FTVHVJSZYRXYAX-GOSISDBHSA-N	432.005	1.158	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)CN2CCCCC2=O)CC1	1831768527	NIXPKCODESEGHN-ZWKOTPCHSA-N	427.973	1.872	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(C)o3)CCO2)C1	1831801869	WDDRJYDUELQSPT-KDOFPFPSSA-N	429.311	1.832	50	20	IDGD	
Cc1cc(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)ccn1	1832627293	HWJFTXYIIZORHR-IBGZPJMESA-N	430.332	1.583	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)/C=C/c3ccco3)CCO2)C1	1833078130	JADDCTLUOLRTGC-RIOIIYTLSA-N	441.322	1.923	50	20	IDGD	
CC(C)(CCl)C(=O)NC1CCN(C2CCN(C(=O)[C@H]3CCCS3(=O)=O)CC2)CC1	1833215621	SIJQMCWAGPNQNU-QGZVFWFLSA-N	448.029	1.400	50	20	IDGD	
CCc1cc(C(=O)N2CCC(N3CCC(NC(=O)[C@H](O)CCl)CC3)CC2)cc(C)n1	1833310780	SBYVBGJVRDSTRI-HXUWFJFHSA-N	436.984	1.737	50	20	IDGD	
Cc1cc(CC(=O)NC2CCN(C3CCN(C(=O)[C@H](C)Br)CC3)CC2)on1	1833734198	DGHRKLPWFQLVAY-AWEZNQCLSA-N	441.370	1.881	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)c(C)o1	1834096718	RDBUDJCZOCUFNI-ACJLOTCBSA-N	429.311	1.750	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)C3CCOCC3)CC2)CC1	1834547500	IEUJCYOBQFGKPC-CQSZACIVSA-N	430.387	1.768	50	20	IDGD	
Cc1ccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)cc1	1835085614	MBDZLBDKZBVDSJ-OXQOHEQNSA-N	439.350	1.777	50	20	IDGD	
O=C(c1cc[nH]c2nccc1-2)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836718411	XELNEDQETBNVFA-GOSISDBHSA-N	434.924	1.726	50	20	IDGD	
O=C(CCc1cccc(O)c1)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836720646	ZBFWEZAODQIDCJ-HXUWFJFHSA-N	438.952	1.923	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@@H]3CCCCN3C)CC2)CC1	1836728620	CIZJCIJZYUSCIJ-MOPGFXCFSA-N	429.989	1.723	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc4cccnc4n3)CCO2)C1	1836826858	RAJPELNOHXJQDK-JOCHJYFZSA-N	446.935	1.965	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cccn(C)c3=O)CC2)CC1	1836970002	ANSISMGUOJQKBA-SFHVURJKSA-N	439.940	1.251	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(NC(C)=O)o3)CCO2)C1	1837453040	AVXWSDOEMRHLGW-KUHUBIRLSA-N	427.885	1.325	50	20	IDGD	
CCNC(=O)N[C@@H](C)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](Cl)CC)CC2)CC1	1838383020	VOXTUTJLPMQRDJ-YOEHRIQHSA-N	430.977	1.710	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(C#N)c3)CCO2)C1	1838907892	UUODPTFYAAHRLG-UXHICEINSA-N	440.327	1.865	50	20	IDGD	
CC(C)c1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)no1	1839197786	IHWUVKWXYDJVPD-WMLDXEAASA-N	448.289	1.559	50	20	IDGD	
O=C(Cc1cccs1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839198725	ARANCFITJWXVAS-GDBMZVCRSA-N	435.315	1.438	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)c(F)c1	1839261867	ZUUUWSLEUQTTCG-YJBOKZPZSA-N	447.276	1.895	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(O)c(C)c3)CCO2)C1	1839309773	SGUOYYSDBPZDST-OXQOHEQNSA-N	426.897	1.024	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H](C)CN(CC)CC)CCO2)C1	1839675077	QOFPGOWAROWHDZ-WFXMLNOXSA-N	432.005	1.828	50	20	IDGD	
COc1cc(Cl)ccc1CC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1839752970	FFIPDIXGENECHF-PKOBYXMFSA-N	449.306	1.882	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3ccc[nH]3)C2)C1	1839963948	AXEJWOHWXMGJGE-VQIMIIECSA-N	442.354	1.577	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C(C)C)no3)C2)C1	1840154116	LWJRJCFQUBDYDM-LIRRHRJNSA-N	429.901	1.122	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)C34CCC(CC3)CC4)C2)C1	1840156374	NIRPQKYRCOHMJH-BWGXQHLSSA-N	428.957	1.667	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc([C@@H](C)C#N)c3)C2)C1	1840156958	YWKHGLDKRORKJR-BPXKWBHBSA-N	449.935	1.637	50	20	IDGD	
COc1ccc(COCC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)cc1	1840253899	NWSLUNLFJGUYPT-ICSRJNTNSA-N	444.887	1.203	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3ccoc3)CCO2)C1	1840512559	DEASECYRXPYITI-BEFAXECRSA-N	443.338	1.700	50	20	IDGD	
O=C(c1cccc(Br)c1[N+](=O)[O-])N1CC2(CCCN2C(=O)[C@H](O)CCl)C1	1841352648	CPTSGRNDZAUGHL-GFCCVEGCSA-N	446.685	1.774	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)Cc2cc(F)ccc2Cl)C1	1841831562	ZRQJXWOMPRTHDS-UHFFFAOYSA-N	430.672	1.219	50	20	IDGD	
Cn1nc(C(=O)N2CCCC23CN(C(=O)/C(C#N)=C/c2ccc(F)cc2F)C3)cc1O	1842192532	OBIPNUBROFNBOO-VGOFMYFVSA-N	427.411	1.828	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)Cc2ccccc2Cl)C1	1842701755	GASCSIXPXVZCCB-UHFFFAOYSA-N	427.892	1.398	50	20	IDGD	
COc1ncc(C(=O)N2CC3(CCCN3C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)cc1C	1843415509	MVOATKUSDQDLEE-MFKUBSTISA-N	438.488	1.350	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)[C@@](C)(Cl)CCl)C2	1843416662	KOLLTSCOHQFCFN-QQZPLFJDSA-N	428.320	1.560	50	20	IDGD	
COc1cc(C(=O)N2CC3(CCCN3C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)ccc1F	1843417224	KIMFYIUOJQRILR-AFUMVMLFSA-N	441.463	1.785	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)[C@H]2C[C@@H]2c2ccc(Cl)cc2)C1	1843872765	BBBKMFUCACVWKU-UXHICEINSA-N	438.720	1.641	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)c1cccc(-c3cnccn3)c1)C2	1846385278	LJMRPQQITJAHMI-UHFFFAOYSA-N	436.516	1.334	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)C(C)(C)CCl)C1	1847437875	APEPJRVALFLYFL-YHUYYLMFSA-N	443.972	1.681	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)CN1C(=O)COc2ccc([N+](=O)[O-])cc21	24298184	XTBSMWCBMWHBGH-NSHDSACASA-N	432.364	1.074	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)c1cc2c([nH]c1=O)CC(C)(C)CC2=O	111140992	GWZPUVZQMJFLJX-UHFFFAOYSA-N	427.457	1.769	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)N2CCN(CC(=O)NC3CC3)CC2)c(C)n1C[C@@H]1CCCO1	302646811	DYPZWRPTHYTZFC-WLJFKGHSSA-N	439.560	1.614	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CC[C@@H](CNC(=O)OC(C)(C)C)C2)cc1OC	725808604	DNWIAMCYZVIZIU-AWEZNQCLSA-N	436.509	1.311	50	20	IDGD	
COc1ccccc1[C@H](NC(=O)NNC(=O)CNC(=O)c1cccs1)c1nccn1C	725874293	YIOGGBRIXGOYQB-KRWDZBQOSA-N	442.501	1.340	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)CCOc3ccc(S(N)(=O)=O)cc3)cc2C1	726382550	VKBNHHOVOSYALM-LBPRGKRZSA-N	437.543	1.750	50	20	IDGD	
CN1CCN(C[C@H](NC(=O)NNC(=O)COc2ccccc2C#N)c2ccccc2)CC1	727945767	MLLXEXQCHDFFDX-FQEVSTJZSA-N	436.516	1.256	50	20	IDGD	
O=C(Cn1cnc2ccc(Br)cc2c1=O)NNc1nc(-c2cccnc2)no1	728076386	BPVYEKOQKLWCMG-UHFFFAOYSA-N	442.233	1.747	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)CCC(=O)c3cccs3)cc2)CC1	728213180	GATUKDQSQJRSMV-UHFFFAOYSA-N	436.559	1.790	50	20	IDGD	
COc1ccc(OC)c(CC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)c1	728213497	MJPAMAGDKFXZGV-UHFFFAOYSA-N	448.545	1.326	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNS(=O)(=O)c2c(Cl)nc3sccn23)cc1C	728503143	KGODQFDTMPRBAG-UHFFFAOYSA-N	427.895	1.614	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)Cc2csc(-n3c(C)ccc3C)n2)n1	728727275	ANDLNSXDHWIZMY-UHFFFAOYSA-N	447.542	1.791	50	20	IDGD	
CC(C)N1CCC[C@H](CNC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)C1	729619163	OHWZLYAJDGTYOB-HXUWFJFHSA-N	430.597	1.650	50	20	IDGD	
CC[C@H]1Nc2ccc(C(=O)OCC(=O)NNC(=O)Cc3nc(C)cs3)cc2NC1=O	729720812	PACQMKZFLLJTFE-GFCCVEGCSA-N	431.474	1.141	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)N[C@@H]1CCN(c2ccc(F)cc2F)C1	730140040	NQSCYOPHSSXNGW-CYBMUJFWSA-N	435.387	1.861	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)c1cccc(S(=O)(=O)Cc2ccccc2)c1	730750155	DMBVSFHILCOTCX-UHFFFAOYSA-N	441.465	1.445	50	20	IDGD	
Cc1c(C(=O)NNC(=O)[C@H]2COc3ccccc3O2)nnn1-c1ccc(F)c(Cl)c1	731165094	JCZUCFAELYRSPL-MRXNPFEDSA-N	431.811	1.969	50	20	IDGD	
Cc1noc(C)c1S(=O)(=O)N1CCC(C(=O)NNC(=O)C(C)(C)c2ccccc2)CC1	731172954	DTEYHCCEJGHWHV-UHFFFAOYSA-N	448.545	1.817	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(C)c(C(=O)NNc2ccccc2S(C)(=O)=O)c1	732303928	OOPLZBZPRMHSKE-UHFFFAOYSA-N	441.531	1.080	50	20	IDGD	
COc1ccc(S(=O)(=O)C[C@H](C)C(=O)NNC(=O)Cn2ccc3ccccc32)cc1	735010610	WAAXHQLUWVRYAY-HNNXBMFYSA-N	429.498	1.907	50	20	IDGD	
CCc1nc(C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)nn1-c1ccccc1	735543092	NOUSWQDSOQMURN-UHFFFAOYSA-N	438.400	1.356	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)CN(Cc2cccnc2)c2ccccc2)C[C@@H](C)O1	735687628	PKJSVAVGZUPYTP-KDURUIRLSA-N	425.533	1.735	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)N[C@H](C)C(=O)N2CCCC[C@H]2C)nc1	737048064	RSDNMGKSKTWWMA-ZIAGYGMSSA-N	426.543	1.184	50	20	IDGD	
COc1cc(C(=O)NNC(=O)N[C@@H]2CCC[C@H](S(C)(=O)=O)C2)cc(OC)c1OC	740902934	SXRWNVOGJUIYSY-OLZOCXBDSA-N	429.495	1.012	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)[C@@H]1CCCN(C(=O)COc2ccccc2)C1	741182188	CTHOEZFOZJLSKC-GOSISDBHSA-N	425.485	1.703	50	20	IDGD	
O=C(COC(=O)Cc1ccc(OC(F)F)cc1)NNC(=O)[C@@H]1COc2ccccc2O1	742389146	FNTBOGSHSAPBQA-INIZCTEOSA-N	436.367	1.361	50	20	IDGD	
O=C(NNC(=O)c1cccc(Br)c1)Nc1ccc(CN2C(=O)CNC2=O)cc1	743812755	CONNJQXBXMQNHG-UHFFFAOYSA-N	446.261	1.967	50	20	IDGD	
COc1ccc(C(=O)NNc2ccc(Cl)nc2)cc1S(=O)(=O)N1CCOCC1	743819189	FSNDHMQJVYYSJB-UHFFFAOYSA-N	426.882	1.521	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)N[C@@H]2CCN(c3cc(C)nn3C)C2=O)cc1	745907096	YGOWEDPYQHJXFT-WMLDXEAASA-N	444.492	1.030	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2cc(F)ccc2Br)cn1C	745978474	FBUXFOLSLHJCHT-UHFFFAOYSA-N	434.243	1.337	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2cc(OC)ccc2Br)cn1C	745978729	LCIGBOMMQTZOLQ-UHFFFAOYSA-N	446.279	1.206	50	20	IDGD	
Cc1nc(C(=O)NNC(=O)Cn2ccc3ccccc32)nn1-c1n[nH]c(C(F)(F)F)n1	747380406	MLCXVILXQGCTBM-UHFFFAOYSA-N	433.354	1.129	50	20	IDGD	
O=C(CNC(=O)NCc1ccc([N+](=O)[O-])cc1)NNC(=S)NCCc1cccs1	748359679	GQEFYDSJHXLVPA-UHFFFAOYSA-N	436.519	1.194	50	20	IDGD	
CCn1nc(C)c(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)c1Cl	748619987	NQGPFOXATKPTFO-UHFFFAOYSA-N	440.957	1.558	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNS(=O)(=O)c2cc(F)cc(C(=O)O)c2)c1	749141667	IBQITXUOWDCQRW-UHFFFAOYSA-N	447.238	1.918	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N(C)C[C@H]2CCOC2)cc1	749433605	WDCLNFMCHGHNRN-YCPFAOKUSA-N	437.500	1.836	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)CSCc1ccc(Br)cc1	751211799	KXSOPHHNSZWPRC-UHFFFAOYSA-N	426.292	1.853	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)CCc3ccc(F)cc3F)cc2)CC1	752143132	AVGUPVVRDKEGQF-UHFFFAOYSA-N	438.500	1.977	50	20	IDGD	
C[C@H]1C[C@@H](CCNC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)CCO1	753336943	RYMHWHVRFBNNID-HOTGVXAUSA-N	438.550	1.620	50	20	IDGD	
NC(=O)[C@@H](c1ccc(Cl)cc1)N1CCN(CC(=O)NNC(=O)c2cccs2)CC1	754237645	LDEZLNTVBZXBSG-QGZVFWFLSA-N	435.937	1.007	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)nc1)Nc1cccc(S(=O)(=O)N2CCOCC2)c1	755355188	YPODNOJYTUTBEN-UHFFFAOYSA-N	439.881	1.222	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2ccc3c(c2)NC(=O)[C@@H](C)O3)c2ccccc2c1=O	755556569	HDQFMMJBSKXZEC-LLVKDONJSA-N	436.428	1.602	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)Nc1ccc(NC(=O)C2CC2)cc1C(F)(F)F	755591816	DPWSQWITPUFVPD-JTQLQIEISA-N	448.423	1.641	50	20	IDGD	
O=C(NNc1nc(C(F)(F)F)cs1)c1ccc(S(=O)(=O)N2CCOCC2)cc1	755852672	KGDUJXBNLBUTIJ-UHFFFAOYSA-N	436.437	1.940	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)Nc2cc(-n3cnnn3)ccc2F)cc1	756335970	OLSJJMCEOZAUFQ-GFCCVEGCSA-N	427.396	1.624	50	20	IDGD	
CCCS(=O)(=O)Nc1cccc(NC(=O)NNC(=O)COc2ccc(C#N)cc2)c1	756685512	MQKYRUSIDNBZTP-UHFFFAOYSA-N	431.474	1.942	50	20	IDGD	
CNC(=O)c1cc(Oc2ccccc2NC(=O)NNC(=O)[C@@H](C)OCCOC)ccn1	756866467	UVZVGYSDKSPORT-CYBMUJFWSA-N	431.449	1.438	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2cnc3c(c2)COCC3)c1	757929103	NHNCMBTZTGQZPU-UHFFFAOYSA-N	447.517	1.651	50	20	IDGD	
CC[C@@H]1CN(CC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)CCN1Cc1ccccc1	759892275	WXLHIWUJPXPCAJ-LJQANCHMSA-N	425.489	1.952	50	20	IDGD	
Cc1ccc(C(=O)N2C[C@@H](C)C[C@@H](C)C2)cc1NC(=O)C(=O)NNC(=O)c1ccccn1	763464007	PVGPMJZJMGVJTR-GASCZTMLSA-N	437.500	1.908	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1cccc(C#Cc2ccccn2)c1	763467105	OMZFAIXGOMPKNE-UHFFFAOYSA-N	429.392	1.789	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cc(F)ccc2Cl)cc(OC)c1OC	763539352	KQRGIIZFLKJCEO-UHFFFAOYSA-N	425.800	1.905	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)Nc1cccc(-c2noc(C3CC3)n2)c1	763570857	JESAPHSZVCZZGD-QGZVFWFLSA-N	449.423	1.540	50	20	IDGD	
Cn1c(=O)oc2cc(NC(=O)C(=O)NNC(=O)COc3ccc(C(C)(C)C)cc3)ccc21	763594854	NEISSKPVNVNUOR-UHFFFAOYSA-N	440.456	1.594	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1ccc2c(cnn2C(F)F)c1	763630413	ZYTXUKAPVFUBDQ-UHFFFAOYSA-N	427.371	1.787	50	20	IDGD	
C#CCOc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(Br)cc2)cc1	763694966	MRDRIVPPAXBXIZ-UHFFFAOYSA-N	446.257	1.626	50	20	IDGD	
CCCCOC(=O)c1ccc(NC(=O)C(=O)NNC(=O)C2=S=C3CCCC3=C2)cc1	763775231	PVOCIURVDVHHEM-UHFFFAOYSA-N	429.498	1.931	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)C(=O)Nc2ccc(OCC3CC3)cc2)c2ccccc2c1=O	763790781	OMQUJTRDSQTXHJ-UHFFFAOYSA-N	435.440	1.122	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)N2C[C@H](C)Oc3ccccc32)cc1	763859445	BCLRSVIJYUZZOC-LSDHHAIUSA-N	427.457	1.814	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3cccc(OCC(N)=O)c3)cc2C1	763948478	KKPYHCLYCLSCHA-LLVKDONJSA-N	430.486	1.137	50	20	IDGD	
CCCCN(C)S(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2C)cc1	763959202	ACTUQIOPLMVDAK-UHFFFAOYSA-N	446.529	1.815	50	20	IDGD	
Cn1nc(C2CCCCC2)cc1NC(=O)C(=O)NNC(=O)c1cc(Br)c[nH]1	763995885	ASFWOCVCSMLUCA-UHFFFAOYSA-N	437.298	1.958	50	20	IDGD	
CC(C)(C)c1nc2ccc(NC(=O)C(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)cc2s1	764001968	IBLPNMLOUYKMFW-SNVBAGLBSA-N	438.531	1.114	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1ccnc(OCC(F)(F)F)c1	764006731	UDCWYTSNTDLNHG-UHFFFAOYSA-N	440.334	1.194	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc4c(c3)NC(=O)CC4)n[nH]2)cc1	764112253	ULZIHQCWFPLCFM-UHFFFAOYSA-N	432.440	1.670	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2scnc2C)cc1I	764246188	XKKQBDPKSZXYJH-UHFFFAOYSA-N	444.254	1.764	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)C(=O)Nc1cc(F)ccc1OC[C@@H]1CCCO1	764314000	QDRWSOIFDVGJFF-HNNXBMFYSA-N	433.411	1.851	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)ccc1N1CCOCC1	764349729	UKBXIVAFLIPMTP-UHFFFAOYSA-N	432.864	1.590	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)C(=O)Nc1cc(C(F)(F)F)ccc1-n1cccn1	764352734	CODFTDCTRVJVFL-UHFFFAOYSA-N	432.362	1.615	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(-c2cn3ccsc3n2)cc1	764400597	QSIYTEQYZAYPLM-GFCCVEGCSA-N	431.474	1.200	50	20	IDGD	
CS(=O)(=O)c1cc(C(=O)NNC(=O)CSc2ccccc2O)cc([N+](=O)[O-])c1	765251058	WSFBXFWXCPLQOO-UHFFFAOYSA-N	425.444	1.257	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc(F)cc1)NNC(=O)c1cc(-c2cccs2)[nH]n1	765566520	ZXWMFJAKKRFPIT-UHFFFAOYSA-N	437.478	1.407	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)c3ccc(C)c(C)c3)CC2)cc1	765727865	JFBIMDYZVDRPEQ-UHFFFAOYSA-N	444.557	1.379	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765736387	QPBGNQLZNZYPCZ-UHFFFAOYSA-N	430.892	1.568	50	20	IDGD	
Cc1cc(N(C)C)cc(C)c1NC(=O)C(=O)NNC(=O)c1cc(Br)cn1C	766258871	NWWZMXRNNXKZOP-UHFFFAOYSA-N	436.310	1.870	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)CSc1ccc2c(c1)OCCO2	767257349	MVSXAUVVMUXYDS-UHFFFAOYSA-N	430.482	1.792	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)c1ccc2c(=O)n3c(nc2c1)CCC3	767263877	XJKFJMKQYJFNEF-UHFFFAOYSA-N	434.452	1.198	50	20	IDGD	
Cc1nc2[nH]n(C)c(=O)c2c(C)c1CCC(=O)NNC(=O)c1cc(-c2cccs2)[nH]n1	768260771	NUOZXOCQDNJYGF-UHFFFAOYSA-N	439.501	1.724	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cc(C(=O)NNC(=O)c3cc(C)[nH]n3)ccc2F)cc1	768277434	LAYPGKAKPSVGFP-UHFFFAOYSA-N	447.448	1.741	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)CN1C(=O)N[C@@]2(CCCC(C)(C)C2)C1=O	768565197	CYUYIUGVHUSRPF-JOCHJYFZSA-N	446.504	1.502	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)CCN1CCN(c2ccccc2)CC1	768634793	PFNAADGHSKTSGE-UHFFFAOYSA-N	432.546	1.754	50	20	IDGD	
COc1ccc(CN2C[C@@H](C(=O)NNc3c(OC)cccc3S(C)(=O)=O)CC2=O)cc1	768639600	RRLCIUQWSSCIDU-HNNXBMFYSA-N	447.513	1.599	50	20	IDGD	
CCOC(=O)Cc1nnc(NC(=O)NNc2c(OC)cccc2S(C)(=O)=O)s1	769241560	PFDPXPBCQFSQHX-UHFFFAOYSA-N	429.480	1.204	50	20	IDGD	
CC(C)n1ncc2c(C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)cc(C3CC3)nc21	769596330	DOFUJXVIHHFQFX-UHFFFAOYSA-N	431.460	1.940	50	20	IDGD	
C[C@H](NC(=O)c1ccc(S(=O)(=O)N(C)C)cc1)C(=O)OC[C@@H](C)CBr	770337602	SPAZZUKNKLOOQB-RYUDHWBXSA-N	435.340	1.629	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)C(=O)Nc1ccnn1-c1cccc(F)c1	770772335	XDDBVJPOSSQQFG-UHFFFAOYSA-N	435.213	1.502	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)Cn3c(S)nc4ccccc4c3=O)nc21	771007789	FSXLYVRSUOPGMB-UHFFFAOYSA-N	440.489	1.429	50	20	IDGD	
COc1ccc(C)cc1[C@]1(C)NC(=O)N(CC(=O)NNC(=O)c2cccc(C#N)c2)C1=O	771258243	WWYMMWHVBIIBTA-QFIPXVFZSA-N	435.440	1.104	50	20	IDGD	
CN(CCC1CCN(c2ccncc2)CC1)CC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	771461969	HEPHCZSLHDSVNB-UHFFFAOYSA-N	440.504	1.989	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1cccc(S(=O)(=O)N2CCCCCC2)c1	771891868	VPUCJFAASGPCGQ-AWEZNQCLSA-N	425.507	1.354	50	20	IDGD	
COc1ccc([C@H](OC)[C@@H](C)NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1	771906772	XLBQTHMAPOCNQT-FZKQIMNGSA-N	425.449	1.391	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)Nc1cnn(Cc2nnc3n2CCCC3)c1	772636292	NXXQNDKMMHADRV-UHFFFAOYSA-N	448.285	1.416	50	20	IDGD	
O=C(COc1ccc(OCc2ccccc2)cc1)NNC(=O)C(=O)Nc1ccc(F)cn1	773526259	WZTPCJXZJWNUDV-UHFFFAOYSA-N	438.415	1.965	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1cccc(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2)c1	773656524	NGXCHSABPQFQHK-UHFFFAOYSA-N	435.462	1.753	50	20	IDGD	
O=C(NNc1c(F)cccc1F)C(=O)Nc1ccc(C(=O)NCCN2CCOCC2)cc1	773708031	OKKFCOFMTLINCY-UHFFFAOYSA-N	447.442	1.109	50	20	IDGD	
CC(C)Cc1cc(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)cc(O)n1	777404924	DUXKYUAIFJOZNM-UHFFFAOYSA-N	434.518	1.764	50	20	IDGD	
COC(=O)c1cc(Br)c(S(=O)(=O)NNC(=O)c2ccc(C#N)cc2)s1	777620828	WIOXMGWHLCIJIF-UHFFFAOYSA-N	444.288	1.792	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2ccc(NNC(=O)c3ccncn3)c([N+](=O)[O-])c2)cc1	778278830	RDHSWYKYKRQJOS-UHFFFAOYSA-N	444.429	1.951	50	20	IDGD	
CC(C)Oc1cc(NC(=O)C(=O)NNC(=O)c2cc(Br)ccc2O)ccn1	778710923	RXEPNOOYQUQYBS-UHFFFAOYSA-N	437.250	1.737	50	20	IDGD	
Cc1cc(N2C[C@@H](C(=O)NNC(=O)C(=O)NCc3ccc(Cl)cc3)CC2=O)ccc1F	779950431	NNXDQLMTNCYADG-AWEZNQCLSA-N	446.866	1.604	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)c1cc(O)cc([N+](=O)[O-])c1	780645939	GGZSTYSHUZQWCN-UHFFFAOYSA-N	447.879	1.533	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)[C@@H]1C[C@]12CCN(C(=O)OC(C)(C)C)C2	780715525	JUSXCCHOQJUHSM-RBZFPXEDSA-N	441.529	1.489	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C(=O)Nc2cc(C#N)ccc2OC(F)F)nc2ccccc21	782886479	LIYCNAFHTBHUIB-UHFFFAOYSA-N	442.382	1.375	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2ccc(C(=O)NCC(=O)N(C)C)c(Cl)c2)cc1	783039308	LEAOVVQKJCYUTI-UHFFFAOYSA-N	447.879	1.248	50	20	IDGD	
CCCOc1ccc(C(F)(F)F)cc1NC(=O)C(=O)NN[C@]1(C)CCS(=O)(=O)C1	783427218	NDQXKCUXAPWZLL-MRXNPFEDSA-N	437.440	1.631	50	20	IDGD	
CCOC(=O)c1cc(C(C)(C)C)sc1NC(=O)C(=O)NN[C@@]1(C)CCS(=O)(=O)C1	783428840	XYUVPZRIIIMOED-SFHVURJKSA-N	445.563	1.359	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)CCS(=O)(=O)C1	783429111	ZXXZHUPXIXKCGJ-HXUWFJFHSA-N	428.470	1.487	50	20	IDGD	
CN(NC(=O)Cn1ccc(C(F)(F)F)n1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	783703852	HFXFGKATHWLJOW-UHFFFAOYSA-N	434.419	1.538	50	20	IDGD	
O=C1COc2cc(NC(=O)C(=O)NNc3nc(-c4ccc(Cl)cc4)no3)ccc2N1	784794419	FWKJCNSJGHCOPC-UHFFFAOYSA-N	428.792	1.803	50	20	IDGD	
COCCS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2cc(F)c(F)cc2F)cc1	784886388	HLHRABNFZHPPMW-UHFFFAOYSA-N	431.392	1.606	50	20	IDGD	
COC(=O)c1c(NC(=O)C(=O)NNc2ccnc(N(C)C)n2)sc2c1CCCCC2	784970730	ZFUCRELGSJKUNE-UHFFFAOYSA-N	432.506	1.741	50	20	IDGD	
CN(C)c1nccc(NNC(=O)C(=O)Nc2ccc(C(=O)NCc3ccccc3)cc2)n1	784971317	YKQYTBVQYNXHGR-UHFFFAOYSA-N	433.472	1.554	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2ccc(-c3nnc(N(C)C)o3)cc2)n1	785225955	MIINJVVFPKBCGY-UHFFFAOYSA-N	439.480	1.521	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(C#N)c2)cc1C(=O)N1CCCCC1	787541693	CBWVLWBESYQNAB-UHFFFAOYSA-N	433.468	1.893	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)Cc1ccc(F)cc1)[C@@H](C)C(=O)NNC(=O)Cc1ccc(F)cc1	790125766	TVGKWDRKFIDJGZ-ZIAGYGMSSA-N	446.454	1.317	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)[C@H]2Cc3cc(Br)ccc3O2)c2ccccc2c1=O	792015583	DELFNTYHRIZVAN-OAHLLOKOSA-N	443.257	1.461	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)Cn2nnc(-c3ccc(Cl)cc3)n2)cc1	794717487	NQQCULGNGBFBJO-UHFFFAOYSA-N	435.897	1.387	50	20	IDGD	
CN(C)S(=O)(=O)C[C@H](NS(=O)(=O)c1ccc(CCCCl)cc1)C(F)(F)F	795602525	FALUWWYDDYJNLL-ZDUSSCGKSA-N	436.905	1.959	50	20	IDGD	
CCCc1c(NC(=O)C(=O)NNC(=O)c2cccc(C)n2)cnn1-c1cccc(C#N)c1	797369673	DGHOSLNDSIJSNC-UHFFFAOYSA-N	431.456	1.800	50	20	IDGD	
Cc1cccc(-c2nnc(S)n2CC(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)c1	798308183	SKMSKXQKVSDNTM-UHFFFAOYSA-N	438.513	1.945	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2cnc3c(c2)c(O)nc(=O)n3C2CC2)c2ccccc2n1	799009760	KQFUGKRRLTVUJR-UHFFFAOYSA-N	430.424	1.763	50	20	IDGD	
Cc1cc(O[C@@H]2CCN(C)C2=O)ccc1NC(=O)C(=O)NNc1cccc(F)c1[N+](=O)[O-]	799262858	FGUMBZUPGYYJEA-MRXNPFEDSA-N	445.407	1.734	50	20	IDGD	
O=C(/C=C\c1ccccc1)NCCCNC(=O)NNC(=O)c1cc([N+](=O)[O-])ccc1O	800759879	UQUVOAUALAZPCE-YFHOEESVSA-N	427.417	1.464	50	20	IDGD	
COc1ccc([C@H]2[C@@H](C(=O)NNC(=O)C(=O)Nc3ccc(C)cc3)CCC(=O)N2C)cc1	801106225	PVLZRTHTECSCBG-ICSRJNTNSA-N	438.484	1.699	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2ccc(S(=O)(=O)NC[C@H]3CCCO3)cc2)cc1	802052150	LBSHYMNUFBRMDY-QGZVFWFLSA-N	448.501	1.619	50	20	IDGD	
CC1(C)CC(=O)c2cc(NC(=O)C(=O)NNC(=O)COc3ccc(C#N)cc3)ccc2O1	806974002	OWPSCTCYVVAKAW-UHFFFAOYSA-N	436.424	1.467	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1ccc2c(C)cc(O)nc2c1	809557240	RAVUXFAMSDTCPY-UHFFFAOYSA-N	427.486	1.925	50	20	IDGD	
O=C(CNS(=O)(=O)c1cc(C(F)(F)F)ccc1Cl)NNC(=O)C1CCCC1	810098757	ZYXAWHOVDYLBSA-UHFFFAOYSA-N	427.832	1.975	50	20	IDGD	
Cc1c(NC(=O)NNc2ccccc2S(=O)(=O)N(C)C)c(=O)n(-c2ccccc2)n1C	814474931	JAGHHIYRUJHTRF-UHFFFAOYSA-N	444.517	1.883	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCc2nncn2C1)C(=O)Nc1ccc(COCc2ccccc2)cc1	815692644	XHIXKTJPLILPQM-SFHVURJKSA-N	448.483	1.343	50	20	IDGD	
CC(=O)N1c2ccccc2C[C@H]1C(=O)NNC(=O)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	816510471	WRQLHRUDJDAZLX-AEFFLSMTSA-N	430.505	1.759	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)N2CCN(CC(=O)NC(C)C)CC2)c(C)n1C[C@@H]1CCCO1	843328390	LUZRRHSHXIEGSY-YRUATGHUSA-N	441.576	1.860	50	20	IDGD	
Nc1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1[N+](=O)[O-]	912642917	JABAXOHJKCSQIF-UHFFFAOYSA-N	433.446	1.036	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N[C@@H](CCSC)C(=O)NNc2ncccn2)cc1	913044279	HYOZRSMIMRMSRX-HNNXBMFYSA-N	425.536	1.419	50	20	IDGD	
COCCN1C[C@@H](C(=O)NNC(=O)COc2ccccc2Cc2ccccc2)CC1=O	914458914	RCMXBMAULXAREB-IBGZPJMESA-N	425.485	1.299	50	20	IDGD	
C[C@@H]1CN(Cc2ccc(C(=O)NNC(=O)[C@H]3COc4ccccc4O3)cc2)C[C@@H](C)O1	914775515	RXYWRVARZIAOPU-WHSLLNHNSA-N	425.485	1.897	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NN=C(C)c1ccccn1)N(S(C)(=O)=O)CC2	916356336	SEDJSGZVRRNGON-GOSISDBHSA-N	446.529	1.888	50	20	IDGD	
CCOc1cc(C=NNC(=O)CN2CCCC2=O)ccc1OCC(=O)N1CCCCC1	916357603	AFGYEDBEEAQCJZ-UHFFFAOYSA-N	430.505	1.549	50	20	IDGD	
O=C(NCCCN1CCN(c2ccccc2)CC1)NNC(=O)c1cc(Br)c[nH]1	916489890	SQPDHSOMSSQWDF-UHFFFAOYSA-N	449.353	1.934	50	20	IDGD	
C[C@@H]1CCCC[C@H]1OCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	916514336	MMJPAUZYANSYHK-RHSMWYFYSA-N	426.539	1.476	50	20	IDGD	
C[C@H](c1nc(-c2ccccc2)no1)N1CCN(CC(=O)NNC(=O)c2cccs2)CC1	917112061	CXEGVTKGDOHZDG-OAHLLOKOSA-N	440.529	1.938	50	20	IDGD	
CC[S@@](=O)c1ccccc1C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	917510699	IUTSQZRXUOZQPL-SSEXGKCCSA-N	428.558	1.787	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)CCn1cc(Br)cn1	917917680	FNJIEZGCQLADHF-UHFFFAOYSA-N	443.327	1.098	50	20	IDGD	
O=C(NNC(=O)N1CCCN(c2ccccc2)CC1)c1csc(N2CCOCC2)n1	918002191	UMOHERSKIVHBCW-UHFFFAOYSA-N	430.534	1.546	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3C[C@H](C)O[C@H](C)C3)cc2)c(O)c1	918340960	HCUZXICSYJCHJG-GASCZTMLSA-N	447.513	1.573	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NNC(=O)c2cc(Br)c[nH]2)cc1OC	918778868	QKIGACHGMVKXTN-UHFFFAOYSA-N	426.227	1.083	50	20	IDGD	
COc1ccc(-n2ccc(C(=O)NNC(=O)c3cc(OC)c(OC)c(OC)c3)n2)cc1	919806152	OBJCJBVIJCYQCG-UHFFFAOYSA-N	426.429	1.982	50	20	IDGD	
O=C(CCCCc1ccc(Br)cc1)NNC(=O)N[C@H]1CCS(=O)(=O)C1	919886764	UPZWNVPGIZZNKX-AWEZNQCLSA-N	432.340	1.679	50	20	IDGD	
Cc1cc(CNC(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)no1	920235920	ZBANONVQTCMDRV-UHFFFAOYSA-N	432.444	1.829	50	20	IDGD	
CCNC(=O)NNC(=O)[C@@H](CCSC)NS(=O)(=O)c1cc(Cl)ccc1Cl	920858799	DHHLXAGILGBBHH-LLVKDONJSA-N	443.378	1.744	50	20	IDGD	
CC(C)(C)OC(=O)N1CCc2ccc(C(=O)NNC(=O)CNC(=O)c3ccco3)cc2C1	1320629758	ZEGFACGFAOJMAQ-UHFFFAOYSA-N	442.472	1.764	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ccc3nncn3n2)CC1)c1ccc(Br)cc1	1322423341	INBCQHHDNCQGPO-UHFFFAOYSA-N	444.293	1.564	50	20	IDGD	
Cc1nc2nc(C(F)(F)F)nn2c(C)c1CCC(=O)NNc1nncc(N)c1Cl	1333507273	HIJNEDLYDCHZGU-UHFFFAOYSA-N	429.794	1.861	50	20	IDGD	
CN(C)N(C(=O)CC[C@H]1NC(=O)N(c2ccc(Cl)cc2)C1=O)[C@@H]1CCS(=O)(=O)C1	1343773145	CIOGIUWTRCSTKO-HUUCEWRRSA-N	442.925	1.037	50	20	IDGD	
Cc1ccc(=O)n(C(C)(C)C(=O)N2CC[C@]3(CN(C(=O)C(C)(C)CCl)CCO3)C2)n1	1779233832	YIPCAOVFWMWWSX-OAQYLSRUSA-N	438.956	1.382	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](COC)NC(C)=O)C1	1779552826	AIMZZDCRIUIXIW-AXVVYFOYSA-N	431.961	1.059	50	20	IDGD	
O=C(/C=N/O[C@@H]1CCCCO1)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781331185	GECXQGMWDUYLNH-OLGKWTEQSA-N	436.278	1.036	50	20	IDGD	
O=C(c1cccc2[nH]ncc12)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781331414	QCXLNPBZZYNTRP-WMLDXEAASA-N	425.258	1.697	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cc4cn[nH]c4cn3)CCO2)C1	1783349860	USBLLVNZPJNGAB-ACJLOTCBSA-N	436.310	1.575	50	20	IDGD	
CC(=O)N[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(C)(C)CCl)[C@H]2C1)C(C)(C)C	1783847213	HFKHNOCDTJNLAH-LUKYLMHMSA-N	429.989	1.782	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccnc(F)c3)C[C@@H]21	1783970163	SEDNPCPVINZIPT-UNQGMJICSA-N	428.302	1.845	50	20	IDGD	
O=C([C@H]1CCc2nc[nH]c2C1)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1784351709	NARYTIJZIJHXBG-YLVFBTJISA-N	429.290	1.035	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)C34CCC(CC3)CC4)C2)C1	1784729653	OHFCXGMERXIDQC-KKOYGPPHSA-N	441.532	1.099	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCn3c(=O)oc4ccccc43)[C@H]2C1	1785195201	SHGYAQSICOGENE-GGXPGOJBSA-N	449.935	1.982	50	20	IDGD	
O=C(Cc1cccc(C(F)(F)F)n1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21	1785281967	BTSPHZVCTWRVTM-MXAVVETBSA-N	449.857	1.222	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3cccc(Cl)n3)[C@H]2C1	1785430090	XMWKSPRLMVTPGT-HNKHHVNMSA-N	430.332	1.511	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)C3CCSCC3)C2)C1	1785635796	MFNRDRNZHQCIFV-VQYZLWMVSA-N	447.561	1.094	50	20	IDGD	
Cc1cnn([C@@H](C)C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCBr)[C@H]3C2)c1	1786407844	XMCOCGDTHXUQGJ-VGWMRTNUSA-N	427.343	1.517	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CC(C)(C)C)C[C@@H]21	1787509018	XBYJVCYQZCHMFC-SMKMMKTPSA-N	431.537	1.536	50	20	IDGD	
Cc1cc(C)n(CCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]3C2)n1	1788766156	RCDZULVUYLMWQL-FHWLQOOXSA-N	436.629	1.721	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3sc4nccnc4c3N)C[C@@H]21	1789860226	LVZPIXIVHGCIGC-RVMXOQNASA-N	437.953	1.884	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccnc4c3OCO4)C[C@@H]21	1789870603	QBIPZMQNCZBBTH-LDBIXWDDSA-N	444.315	1.640	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN3CCCCC3=O)C[C@@H]21	1789872943	LYVBSWPPBMOUIU-XMDUPGNXSA-N	434.364	1.215	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnn4cccc(C)c34)[C@H]2C1	1790507854	OCJPUKOLBYBYLG-DKIMLUQUSA-N	434.924	1.490	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/c3cccs3)C[C@@H]21	1791289071	IBCKMNBRXYCFSM-VTYOKWPHSA-N	434.562	1.114	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC1(c2ccc(NC(=O)CN(CCO)CCO)cc2)CCC1	1791323405	GFIXSNDVQLFMFD-GOSISDBHSA-N	425.957	1.815	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1ccc(Cl)c(F)c1)c1cccc(B(O)O)c1	1792839636	FXQLHOYSCJTQKX-BCDXTJNWSA-N	444.699	1.653	50	20	IDGD	
CC[C@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)CBr)C2)N(CC)CC	1793454573	NGMLGMOJSHEDBY-SIRPWMCASA-N	432.403	1.727	50	20	IDGD	
COc1cc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CO[Si](C)(C)C)C3)ccn1	1793900800	RLDKGJOJAYHCJP-UPHUGPLXSA-N	435.597	1.464	50	20	IDGD	
COc1ncccc1CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@](C)(Cl)CCl)C2	1794094404	GXYHXLWQIGHVSN-MQJTVSLUSA-N	444.359	1.849	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCNC(=O)c1ccc[nH]1	1794308905	KIUORPIELNNCDY-LXTVHRRPSA-N	439.354	1.946	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](N)c1cccc(Cl)c1	1795629889	KJNJJECNDFKHKH-GIRXQMHSSA-N	444.757	1.713	50	20	IDGD	
Cc1nnc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)CBr)C3)s1	1795819236	DZXJASJKTZTBKM-ADGXKJENSA-N	431.356	1.010	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)c1cnccc1C(F)(F)F	1796187071	KVOWKJJVKWCZIW-MUJYYYPQSA-N	447.222	1.346	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)Nc1nccs1	1796418253	ZMGTUENPSSQXHQ-OFTGVCEQSA-N	431.356	1.317	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2cn[nH]c2cn1	1797581795	PTOJIDVZXYITER-OQMKEHIESA-N	436.310	1.335	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1c(F)cncc1F	1798238814	UOKKPUOMOZXXGZ-ZVXAKGHKSA-N	432.265	1.594	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](NC(C)=O)c1ccc(F)cc1)C2	1799269375	YGZIKAGCAHZKKB-CSFFLVESSA-N	439.915	1.610	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cccc([N+](=O)[O-])c1)C2)[C@@H](F)Br	1799343076	MNCQYYQUUXLGTO-NOXHYTERSA-N	444.257	1.417	50	20	IDGD	
Cc1ccc(OCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Br)cc1	1799346438	QQALEJSYZSAVHH-DLTLXFJOSA-N	429.286	1.654	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c(F)ccc(O)c1F)C2	1800759851	LZBBWOSXHXEJKR-AMDHYVTDSA-N	433.249	1.657	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cn1ccc3c(F)cccc31)C2	1800971242	RMIKKTFYLVFRIX-IDLUEMFASA-N	437.899	1.624	50	20	IDGD	
COC(=O)c1ccccc1CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(Cl)Cl	1801015289	BPWBVCVTTYZNSW-XOIINTDNSA-N	443.327	1.799	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCO)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C(Cl)Cl	1802342776	OQFOHJPVNGTDIS-RNJOBUHISA-N	438.352	1.704	50	20	IDGD	
CC(=O)Nc1ccccc1C(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]1c1cccnc1	1803145555	FCRZISDYNKARFZ-LSTHTHJFSA-N	444.919	1.959	50	20	IDGD	
CN(C)c1ccc(C(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)nc1	1805090558	HMSCZXGIYRTYEQ-KFKAGJAMSA-N	431.924	1.462	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(C(=O)N2CCC3(CCCN(C(=O)[C@@H](O)CCl)C3)CC2)C1	1805523812	DBNHBIJZDXDRJW-INIZCTEOSA-N	443.972	1.684	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2nccs2)[C@@H]1c1cccnc1	1805942574	XLPRWWWPTJXHBQ-QAPCUYQASA-N	430.534	1.231	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC2(CCCN(C(=O)c3cnnc(Cl)c3)C2)CC1	1807279610	PZBJAHNCRXMOIQ-UHFFFAOYSA-N	436.944	1.348	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)Cc2ccsc2)[C@@H]1c1cccnc1	1807565319	ZITRBSQACYVQGT-AVRDEDQJSA-N	443.573	1.765	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC2(CCCN(C(=O)c3cc(=O)n4[nH]nnc4n3)C2)CC1	1810489184	INZPVYHZIRLBOF-ZDUSSCGKSA-N	435.916	1.065	50	20	IDGD	
Cn1c(C(=O)N2CC[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]2c2cccnc2)cccc1=O	1810539629	DPALDVADWZTQES-LAUBAEHRSA-N	442.592	1.951	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1CCN(C(=O)Cc2ncccn2)[C@H]1c1cccnc1	1810540427	NJYSGSTWPBRQGY-UWJYYQICSA-N	427.581	1.972	50	20	IDGD	
Cn1nc2c(c1C(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)CCC2	1812223307	SZXFYNSBTLBSOZ-WBAXXEDZSA-N	431.924	1.223	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)CCc2ccc(O)nn2)[C@@H]1c1cccnc1	1812328329	MWFMVFYHMNRTDS-SYNHAJSKSA-N	447.923	1.470	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)c2cccc(=O)n2C)[C@H]1c1cccnc1	1812865204	SWOSEYNRDRUMFQ-JOQOYGCGSA-N	447.333	1.883	50	20	IDGD	
Cc1cnoc1C(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1813073859	PKGWVSAYDIAXTB-LPHOPBHVSA-N	428.493	1.071	50	20	IDGD	
CO[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@@H]1c1cccnc1	1813105347	KFBGGVHDSWIYBO-HKPSGPMNSA-N	440.504	1.256	50	20	IDGD	
C[C@H](Nc1nccs1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](O)CCl)n[nH]1	1814871516	RJSNJTLLZUZHAX-CYZMBNFOSA-N	426.930	1.959	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@@H](F)Br)[nH]n1)c1cc(O)ncn1	1815359175	PWODHSNZENKBMQ-ZWNOBZJWSA-N	427.234	1.902	50	20	IDGD	
CNc1ccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)cc1	1817474370	DYEJPAUEDXYJND-FQEVSTJZSA-N	447.304	1.751	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cncs1)CC2	1819795958	WHNVMGMTHUSFNS-VIFPVBQESA-N	443.514	1.138	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3ccc([N+](=O)[O-])[nH]3)sc2C1	1821746603	BXDOMQCQVLFUAL-DTWKUNHWSA-N	427.870	1.859	50	20	IDGD	
COCCn1nccc1C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@H](O)CCl)CC1	1824183549	YYCIPGABVMTSRZ-SJLPKXTDSA-N	426.945	1.363	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnn3cccnc13)CC2	1826000666	ZWHANRAPBPNQAV-PWSUYJOCSA-N	434.909	1.665	50	20	IDGD	
Cc1cn(CC(=O)N2CCC([C@@H]3CCCCN3C(=O)[C@@H](F)Cl)CC2)c(=O)nc1O	1827615224	DAALDCGCJKXADC-GOEBONIOSA-N	428.892	1.411	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)cn1C	1830538267	AFJBBPKWPXNJJF-AUUYWEPGSA-N	442.354	1.435	50	20	IDGD	
C=CCO[C@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](Br)CC)C2)C1	1831434512	YNKAAJWJXJCTOL-IIDMSEBBSA-N	433.343	1.207	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnn4ncccc34)C2)C1	1831645380	AMELPKINLJDOHY-JXFKEZNVSA-N	435.912	1.207	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H](F)Br)CC1	1831874793	WDNVAQUEXHNJPF-RHSMWYFYSA-N	449.365	1.670	50	20	IDGD	
Cc1onc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)c1C	1831984290	HGRFJSIZJIMPTF-SJCJKPOMSA-N	430.299	1.145	50	20	IDGD	
CCc1ncccc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1	1833518991	IQIZMVVKFVQSBI-VQTJNVASSA-N	444.359	1.950	50	20	IDGD	
O=C(c1ccnc(C(F)(F)F)c1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1833794810	QSZMEJRDBKOXKO-BBRMVZONSA-N	439.793	1.705	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccoc3C)CCO2)C1	1834143017	MFJPFEVXUOQZEB-YJBOKZPZSA-N	429.311	1.832	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)c3ccno3)CC2)CC1	1834183364	KINRYHZSUISSRJ-CYBMUJFWSA-N	427.343	1.891	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)N1CCC(N2CCC(NC(=O)CCBr)CC2)CC1	1834424113	YNFXVCDDFYJGPJ-CQSZACIVSA-N	443.386	1.034	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)COc3ccccc3)CCO2)C1	1834954872	BQNKWMNTISTRCC-HNAYVOBHSA-N	441.322	1.305	50	20	IDGD	
CC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)c3cn4cccnc4n3)CC2)CC1	1836397203	UIDRMYVITDSZDH-KRWDZBQOSA-N	432.956	1.932	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](C)NC=O)CC2)CC1	1836672919	GEROJIMRIGGQJZ-UONOGXRCSA-N	432.359	1.151	50	20	IDGD	
O=C(Cc1ncccn1)N1CCC(OC2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1837211293	GCPADIDOQVHKMY-QGZVFWFLSA-N	443.317	1.708	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)c3cncnc3)CC2)CC1	1837509455	BQJWQYJUZYMCSU-ZDUSSCGKSA-N	425.327	1.872	50	20	IDGD	
O=C(CCBr)N1CCC(OC2CCN(C(=O)c3cc[n+]([O-])cc3)CC2)CC1	1837654488	RTTRJCSTECXWRR-UHFFFAOYSA-N	440.338	1.717	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3c(F)cncc3F)C2)C1	1837715452	QWCMCYCRJULPLN-LJQANCHMSA-N	443.523	1.281	50	20	IDGD	
O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)c1cnccc1Cl)CCO2	1837774764	HJPWWJZFLHNNER-KRWDZBQOSA-N	446.729	1.590	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cncnc3C)CCO2)C1	1838098562	SFEJHZYOPOQGDF-QAPCUYQASA-N	441.326	1.029	50	20	IDGD	
O=C(c1cc(-c2ccccc2)[nH]n1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1838688881	KRMCVMAFZPEJMC-FXAWDEMLSA-N	436.871	1.681	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)C(=O)c3cccn3C)CC2)CC1	1838786905	RWTUOFWVVGVAIJ-QGZVFWFLSA-N	439.940	1.460	50	20	IDGD	
CC[C@H](C)[C@H](O)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2	1839150394	LDMHCOYIMDFHNY-USJZOSNVSA-N	425.353	1.086	50	20	IDGD	
Cc1ccc(F)c(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)c1	1839314160	TUZMLMYTFPABLW-KUHUBIRLSA-N	443.313	1.988	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)C(F)(F)c1ccco1)CCO2	1839690320	DRNDPAZCGVBDEI-SFHVURJKSA-N	446.523	1.679	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cscn3)C2)C1	1839963486	LRJHINQNYGXXOH-WBMJQRKESA-N	432.340	1.387	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(OC)c3F)C2)C1	1840156227	LCIZZMNMABMLPX-FOIQADDNSA-N	444.887	1.158	50	20	IDGD	
CN(C)c1ccncc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840186113	BHIUHADAHCCXIU-GOSISDBHSA-N	431.320	1.021	50	20	IDGD	
CSC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1	1841354520	FOCBVFOLCRCDNO-QWHCGFSZSA-N	435.974	1.046	50	20	IDGD	
CCc1cc(C(=O)N2CCCC23CN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C3)cc(C)n1	1843573004	UYYUDQDWJBTACN-WGOQTCKBSA-N	436.516	1.903	50	20	IDGD	
CC[C@H](C)[C@H](O)C(=O)N1CC2(CCCN2C(=O)c2cc([N+](=O)[O-])ccc2OC(C)=O)C1	1844692016	YGTJHPMDWXIYHM-UGSOOPFHSA-N	433.461	1.744	50	20	IDGD	
COc1ccc(CCC(=O)N2CCCC23CN(C(=O)CCC(=O)NN(C)C)C3)c(OC)c1	1845929746	QHGBVJDHUQQNLQ-UHFFFAOYSA-N	446.548	1.213	50	20	IDGD	
CCc1nn(C)c(C(=O)N2CC3(CCCN3C(=O)[C@@H](Cl)COC)C2)c1Br	1846361739	MIFNWVVDBWATJS-NSHDSACASA-N	447.761	1.816	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)(C)O)C1	1847091812	XNHDOLSXNYGDAW-UONOGXRCSA-N	431.961	1.871	50	20	IDGD	
O=C(CCc1ccc(F)c(F)c1)N1CC[C@H]2[C@@H]1CCN2C(=O)c1ccc(B(O)O)cc1	1847411530	RMGYKOMGWUOPBI-PMACEKPBSA-N	428.244	1.093	50	20	IDGD	
COC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)C(C)(C)CCl	1847437787	CTGAKOHRTOVFJY-KKUMJFAQSA-N	431.961	1.993	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2c(C)nsc2NC)c1	12606399	FJXPZJHZRQZONB-UHFFFAOYSA-N	425.536	1.599	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=O)c2ccc(Cl)cc2OC)n(C)c1	24630356	DBWJQADQYHKSFW-UHFFFAOYSA-N	442.925	1.792	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2ccc3c(c2)C[C@H](C)N3C(C)=O)cc1OC	28686688	DZMHNDPEQJZNRM-LBPRGKRZSA-N	433.486	1.625	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)C2=NO[C@H](c3ccccc3)C2)cc1	108756346	RPYNKOZCJLJNBT-SFHVURJKSA-N	430.486	1.281	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NCc2cccc(OCC(F)F)c2)c2ccccc2c1=O	726715762	PZDJLMCLLQFEIF-UHFFFAOYSA-N	431.399	1.722	50	20	IDGD	
CCOc1ccccc1[C@@H](CC(=O)NNC(=O)Cc1nc2ccccc2n1C)NC(C)=O	728264362	GQFHOVGOKCHHQD-GOSISDBHSA-N	437.500	1.929	50	20	IDGD	
COc1ccc(-n2nnc(C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)c2C)cc1	728847440	FMZXBNBCGONJNC-UHFFFAOYSA-N	436.476	1.052	50	20	IDGD	
COCCOc1cn(-c2ccccc2)nc1C(=O)NNC(=O)COc1ccc(C#N)cc1	729297992	MWBKZYJJIFFDIG-UHFFFAOYSA-N	435.440	1.609	50	20	IDGD	
CCN(CC)[C@H](C(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1)c1ccccc1	729511821	VZFVQQYVXQDHHU-NRFANRHFSA-N	446.573	1.846	50	20	IDGD	
CC[C@@H](NC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1)c1nc(C)cs1	729623082	CYWRTKXMRZDZEG-OAHLLOKOSA-N	439.563	1.862	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)[C@@H]2CCN(c3ccc4c(c3)OCCO4)C2=O)cc1	730590802	YQBOOWGCKOWIGV-SFHVURJKSA-N	439.468	1.600	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)CC[C@@H]2NC(=O)N(c3cccc(C)c3)C2=O)c1	730738668	HBDBMSQIDHOMSB-SFHVURJKSA-N	440.456	1.678	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COc2ccccc2O)cc1S(=O)(=O)N1CCCC1	730781007	BJQMZUJNRGICAU-UHFFFAOYSA-N	449.485	1.025	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)NCCC(=O)N1CCN(c2ccccc2)CC1	731404886	HHSSOFIYBNMFHX-UHFFFAOYSA-N	427.480	1.438	50	20	IDGD	
O=C(CSc1ccc(Cl)cc1)NNC(=O)NCCS(=O)(=O)NCC1CCC1	731761126	TXIXYKCDTBKVKU-UHFFFAOYSA-N	434.971	1.482	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)c2c[nH]nc2C)ccc1OCC(=O)N1CCCCC1	731853266	WWHMFMPCBPIUMP-UHFFFAOYSA-N	429.477	1.583	50	20	IDGD	
O=C(C[C@@H]1OCCc2ccccc21)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	734416974	GBSUVOIPBFRPFZ-FQEVSTJZSA-N	443.525	1.936	50	20	IDGD	
COc1ccc(CN2CC[C@@H](NC(=O)NNC(=O)Cc3ccccc3OC)C2=O)cc1	734541371	HUZHGZWFOOUSNK-GOSISDBHSA-N	426.473	1.378	50	20	IDGD	
C=CC[C@@H](NC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1)c1ccncc1	734678174	FIPZGYZTUATCDR-GOSISDBHSA-N	431.518	1.658	50	20	IDGD	
Cn1cc(N2CC[C@@H](NC(=O)NNc3ccc(S(=O)(=O)C(F)(F)F)cc3)C2=O)cn1	735584464	UMJDMMMBNVTQMC-CYBMUJFWSA-N	446.411	1.145	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)CN1C(=O)COc2cc(Br)ccc21	737637614	HRYUOANOZOWMRN-UHFFFAOYSA-N	448.273	1.539	50	20	IDGD	
Cc1cc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)COCc3ccccc3)c2)no1	738545706	LTJWQWVHSCZFAJ-UHFFFAOYSA-N	444.469	1.762	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2cccc(C(=O)NNc3ccnc(N(C)C)n3)c2)C[C@@H](C)O1	740104689	PVXSPSDLITYNGL-OKILXGFUSA-N	434.522	1.097	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)CC[S@@](=O)c1ccc2c(c1)OCCO2	740749408	XXXJRPYBBQLFJC-BRRNQIAESA-N	436.461	1.710	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)[C@@H]2CCCCN2C(=O)c2ccc(O)nn2)cc1OC	741741258	SPFBEZOITQQIAQ-HNNXBMFYSA-N	443.460	1.045	50	20	IDGD	
CN(C)C(=O)CS(=O)(=O)c1ccc(C(=O)NNC(=O)c2ccc3ccccc3n2)cc1	742031951	UFGAFACVRJLDQX-UHFFFAOYSA-N	440.481	1.172	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)c2c[nH]cc2-c2ccc3c(c2)OCCO3)c2ccccc2c1=O	742034917	ZWVASIKBKZUIPH-UHFFFAOYSA-N	445.435	1.775	50	20	IDGD	
COc1ccc([N+](=O)[O-])cc1CNC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	743542026	GFYDMDFJWOKCLG-UHFFFAOYSA-N	437.434	1.543	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)CNC(=O)Cc2cccc3ccccc23)c1	744504986	KSMVLPYELAWRDR-UHFFFAOYSA-N	444.447	1.375	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)c2ccc3c(c2)CCCN3S(C)(=O)=O)c1	744586813	MVARENUANHNMTD-UHFFFAOYSA-N	445.497	1.325	50	20	IDGD	
O=C(NNC(=O)N1CCOCC1)c1ccc(NS(=O)(=O)c2ccc(Cl)s2)cc1	745993008	SJASASNCOUDQBD-UHFFFAOYSA-N	444.922	1.889	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2ccc[nH]2)cc1S(=O)(=O)N[C@@H]1CCCC[C@H]1C	747662309	KEKZINZOFYVEHD-UKRRQHHQSA-N	434.518	1.955	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNS(=O)(=O)c1ccc2c(c1)CCN2C(C)=O	747847658	RZUKKYAKRPZKAK-UHFFFAOYSA-N	433.486	1.383	50	20	IDGD	
O=C(NNC(=O)c1cc(S(=O)(=O)N2CCC2)ccc1Cl)c1ccc2c(c1)OCO2	748690872	GFINQRSUSMCDFV-UHFFFAOYSA-N	437.861	1.538	50	20	IDGD	
COc1cc(S(=O)(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c(Cl)cc1C(=O)O	749142861	SBXWRSQEUDNHAC-UHFFFAOYSA-N	429.794	1.578	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)Cn1c(Cc2ccccc2)nc2ccccc21	751204073	BZJTVHKKXGKEQZ-UHFFFAOYSA-N	431.452	1.798	50	20	IDGD	
CCn1c(=O)c(C(=O)/C(C#N)=C\c2ccc(C(=O)OC)[nH]2)c(N)n(Cc2ccccc2)c1=O	751512753	KIXQLYLCJDZGAZ-PTNGSMBKSA-N	447.451	1.565	50	20	IDGD	
O=C(C[C@H]1CSCCS1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	751539785	ZOYWSJNEEFHIKO-AWEZNQCLSA-N	429.589	1.471	50	20	IDGD	
CC(C)C[C@H](C(=O)NNc1nc2ccccc2c(=O)n1C)N1C(=O)[C@H]2CC=CC[C@@H]2C1=O	752907915	PARXJDXYGGXNEF-RLFYNMQTSA-N	437.500	1.743	50	20	IDGD	
Cc1oc(S(=O)(=O)N(C)C)cc1C(=O)NNC(=O)Nc1ccc(OC(F)F)cc1	753428242	KXFZDXBATPSNMY-UHFFFAOYSA-N	432.405	1.906	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)N[C@H]2CCN(c3ccccn3)C2)c2ccccc2c1=O	753733188	UTVNCTKDFVJFIG-HNNXBMFYSA-N	435.488	1.595	50	20	IDGD	
CCOc1nc(C(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)co1	753981108	HSFYPOWPDHTLDI-UHFFFAOYSA-N	444.469	1.627	50	20	IDGD	
COc1cc(-c2noc(CCC(=O)NNC(=O)Cc3cc[nH]n3)n2)cc(Cl)c1OC	755285320	ORKSLGOBFWMSEZ-UHFFFAOYSA-N	434.840	1.453	50	20	IDGD	
CCCn1nc(C(=O)NN=Cc2c(C)nn(C)c2N2CCOCC2)c2ccccc2c1=O	755545692	KHORKJVCURBCHN-UHFFFAOYSA-N	437.504	1.449	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)Nc2cccc(OCC(=O)N(C)C)c2)cc1	755960286	JUNZXZCJAZALOH-HNNXBMFYSA-N	442.472	1.976	50	20	IDGD	
O=C(NC[C@H]1CSCCS1)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	756052108	FJHJCDKCIBXMQQ-AWEZNQCLSA-N	444.604	1.264	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)Nc1ccc(CCN2CCOCC2)cc1	756163709	HYOKDDSWBPCSQT-UHFFFAOYSA-N	426.473	1.799	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCC[C@@H]2CN2C[C@H](C)O[C@H](C)C2)cc1OC	756502300	SBADYQDYYSGAGR-SOLBZPMBSA-N	434.537	1.038	50	20	IDGD	
CS(=O)(=O)c1ccccc1-n1cc(NC(=O)NNC(=O)Cc2ccccc2F)cn1	756704583	HYUQPNCYYZGOSL-UHFFFAOYSA-N	431.449	1.810	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NN=Cc2ccc(Br)nc2)cc1	756877547	UUEVNSJFVIWDKB-UHFFFAOYSA-N	425.308	1.923	50	20	IDGD	
NC(=O)c1ccc(NNC(=O)c2ccc(S(=O)(=O)Nc3ccc(F)cc3)cc2)nn1	757404627	UJTQTNUUBYLDSA-UHFFFAOYSA-N	430.421	1.272	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)CCc1c(-c2ccc(F)cc2)[nH]c2ccccc12	758048748	VIZVAWKQBHJQLK-ZDUSSCGKSA-N	446.504	1.992	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N[C@H]1CCCS(=O)(=O)C1	758661490	XSMCINQGKRLHTF-PWSUYJOCSA-N	434.312	1.124	50	20	IDGD	
O=C(NNC(=O)[C@@H]1C[C@H]2CCCC[C@H]2N1C(=O)c1ccccc1)C(=O)Nc1ccccn1	758835728	YFUKYDXBUJFLID-KURKYZTESA-N	435.484	1.641	50	20	IDGD	
O=C(NN=Cc1ccc(OCCN2CCOCC2)c(Cl)c1)C(=O)Nc1ccccn1	759204659	HNWMYZQTNSFNTH-UHFFFAOYSA-N	431.880	1.535	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)NC[C@@H]2CSCCN2Cc2ccccc2)cc1	759322494	KPBZSJVSLLLUHG-LJQANCHMSA-N	439.541	1.885	50	20	IDGD	
COc1cc(F)cc(NNC(=O)C2CCN(S(=O)(=O)c3cn(C)c(C)n3)CC2)c1	759323466	YMFOYBUNWYODNK-UHFFFAOYSA-N	425.486	1.420	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3ccnc(OCC(F)F)c3)CC2)cc1	759607350	IRNLHQKCZJRPDX-UHFFFAOYSA-N	447.486	1.613	50	20	IDGD	
C[C@@H](O)C[C@H](CNC(=O)NNC(=O)c1csc(N2CCOCC2)n1)c1ccccc1	759608782	CSWBKLUYWSWPQF-GDBMZVCRSA-N	433.534	1.478	50	20	IDGD	
Cc1cncc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)c1	760850897	IFIDQNDTBFOTKK-UHFFFAOYSA-N	431.518	1.709	50	20	IDGD	
C[C@H]1CN(c2ccc(CNC(=O)NNC(=O)CSc3ccccc3O)cn2)CCO1	763471565	BVMIIERHZWGADY-AWEZNQCLSA-N	431.518	1.635	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2Br)c(F)c1	763483563	QXWIAGKUNCCHPG-UHFFFAOYSA-N	438.209	1.775	50	20	IDGD	
O=C(NNC(=O)c1cc2ccccc2cc1O)C(=O)Nc1ccc2c(c1)S(=O)(=O)CC2	763528656	WTYBLCNZOOHOIM-UHFFFAOYSA-N	439.449	1.275	50	20	IDGD	
CN(C)c1nnc(-c2ccc(NC(=O)C(=O)NNC(=O)c3c[nH]c4ccccc34)cc2)o1	763536977	YYUSBVLAHUWWHN-UHFFFAOYSA-N	433.428	1.684	50	20	IDGD	
CCC(=O)Nc1ccc(C)c(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1	763570784	HVFHNOXRZOCSQN-QGZVFWFLSA-N	426.429	1.269	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)C(=O)Nc2ccnn2-c2ccncc2)c1	763597273	NHCHVRMWFHOMRC-UHFFFAOYSA-N	436.472	1.864	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(-n3nc(C)cc3C)c2)cc1	763660100	XGPXRKOEDGTHEK-UHFFFAOYSA-N	437.456	1.663	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cc(C)nn2Cc2ccccc2)cc1	763662441	WFIIJDZENJSXLR-UHFFFAOYSA-N	437.456	1.413	50	20	IDGD	
CC(C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)cc1	763684186	GPIKGIMPKPLIPQ-UHFFFAOYSA-N	432.864	1.643	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc2cnn(CCOC)c2c1	763712096	KXSREJAZYIRTIR-UHFFFAOYSA-N	439.472	1.410	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(Cl)c(C(=O)N(C)C)c1	763713221	MDCAXWVMIUASDN-UHFFFAOYSA-N	446.891	1.769	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1csc(-c2ccccn2)n1	763717194	QDELWUMPGXWSIJ-UHFFFAOYSA-N	425.470	1.932	50	20	IDGD	
COCCn1ncc2ccc(NC(=O)C(=O)NNC(=O)COc3ccc(C)cc3)cc21	763810866	CTAMKLWLXFSICD-UHFFFAOYSA-N	425.445	1.156	50	20	IDGD	
O=C(CCCc1nc(-c2ccc(Cl)cc2)no1)NNC(=O)CNC(=O)c1cccnc1	763824482	LQDPTEOWXXSEIC-UHFFFAOYSA-N	442.863	1.685	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1cccc(OCCN(C)C)c1	763852762	YRPUOZDNQZPVTM-AWEZNQCLSA-N	432.452	1.320	50	20	IDGD	
C#CCOc1cc(F)ccc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccc(OCC)cc1	763861332	OISRNMMZYAKBII-AWEZNQCLSA-N	443.431	1.790	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccc(-n2cncn2)c(Cl)c1	763874135	ZUYYOVGRGHSWLK-NSHDSACASA-N	446.826	1.613	50	20	IDGD	
COCCn1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2c(C)cc(Cl)cc2C)n1	763876036	CFEYDHNJDTZBLJ-ZDUSSCGKSA-N	437.884	1.353	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(Br)c2)c(O)n1	763883794	QQOWSKLYWPJTPM-SNVBAGLBSA-N	437.250	1.412	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cnn(Cc3ccccn3)c2)cc1OC	763900302	CXBIKQPTWKYZTQ-UHFFFAOYSA-N	438.444	1.133	50	20	IDGD	
Cc1coc(-c2cccc(NC(=O)C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)c2)n1	763921879	RFBFKNUNACISPS-UHFFFAOYSA-N	432.400	1.025	50	20	IDGD	
C[C@H]1CCC2=S=C(C(=O)NNC(=O)C(=O)Nc3cc(CC(C)(C)C)nn3C)C=C2C1	763938187	BCAYEKNLXVEIGU-LBPRGKRZSA-N	431.562	1.933	50	20	IDGD	
CCN(Cc1ccccc1NC(=O)C(=O)NNC(=O)c1cnccn1)C(=O)OC(C)(C)C	764024313	KHJOCYSFQMHIPS-UHFFFAOYSA-N	442.476	1.633	50	20	IDGD	
Cn1cnnc1-c1cccc(NC(=O)C(=O)NNC(=O)c2cccc(C(F)(F)F)c2)c1	764039852	ARPAOQDXRYQTHS-UHFFFAOYSA-N	432.362	1.901	50	20	IDGD	
CS(=O)(=O)c1cccc(NC(=O)C(=O)NNC(=O)Cc2ccc3ccccc3c2)c1	764083245	ARXLNJDZRPXVKD-UHFFFAOYSA-N	425.466	1.572	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(C)cc3)[nH]n2)cc1[N+](=O)[O-]	764113469	ZXLJMMACBIIMQN-UHFFFAOYSA-N	438.400	1.702	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)C(=O)Nc1csc(-c2ccccn2)n1	764203739	BYAOUASUNSUVPV-UHFFFAOYSA-N	448.505	1.596	50	20	IDGD	
COCCOc1c(Cl)cc(NC(=O)C(=O)NNC(=O)Cc2ccccn2)cc1Cl	764266330	BBMIZTVUDHRFFH-UHFFFAOYSA-N	441.271	1.742	50	20	IDGD	
CCOCC(=O)NNC(=O)C(=O)Nc1cc(-c2nc3cc(F)ccc3n2C)ccc1C	764325300	IKURYJIRPWCIBY-UHFFFAOYSA-N	427.436	1.810	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)C(=O)Nc1ccc(S(=O)(=O)N(C)OC)cc1)c1ccccc1	764329917	QUWCJDDETABOBU-QGZVFWFLSA-N	448.501	1.148	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNC(=O)C2CCC2)cc1S(=O)(=O)N(CC)CC	764338871	MNYRXFRNLDAJFD-UHFFFAOYSA-N	440.522	1.002	50	20	IDGD	
Cc1ccc2c(c1)[C@H](NC(=O)NNc1ccc(S(=O)(=O)N3CCN(C)CC3)cn1)CO2	764377831	ZMWFQVLGLBYIFP-QGZVFWFLSA-N	446.533	1.086	50	20	IDGD	
COc1ccccc1OC[C@H](C)CNC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	764459513	PDEZARMXMYWINS-CQSZACIVSA-N	439.472	1.601	50	20	IDGD	
CN1CCO[C@@H]([C@H](NC(=O)NNc2nc(O)c3cnn(C)c3n2)c2ccc(Cl)cc2)C1	766319495	LVPSDXMADYJVMR-HUUCEWRRSA-N	446.899	1.420	50	20	IDGD	
CC(C)n1nc(C(=O)NN=C(CNS(C)(=O)=O)c2ccccc2)c2ccccc2c1=O	766687029	IUDDZQLQSAMHGP-UHFFFAOYSA-N	441.513	1.661	50	20	IDGD	
Cc1cc(F)ccc1-n1cc(C(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)nn1	767350627	MQIROTWCTDVJCJ-UHFFFAOYSA-N	432.437	1.585	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)Cc2ccc(C(=O)NNC(=O)C(C)(C)C(N)=O)cc2)cc1	767409829	JCFLNPLKLJEOKL-UHFFFAOYSA-N	446.529	1.088	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)CCC(=O)c2ccc3c(c2)CCC(=O)N3)c1	767611136	RVEFQNLDUJVDOA-UHFFFAOYSA-N	437.452	1.847	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)[C@@H]3CC(=O)N(Cc4ccccn4)C3)n[nH]2)cc1	768269057	GIXVTMWTBLSCMR-QGZVFWFLSA-N	432.484	1.844	50	20	IDGD	
CC(C)C[C@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	769044600	BEOHSVCQSJEGFQ-HNNXBMFYSA-N	431.493	1.634	50	20	IDGD	
Cc1noc(C)c1S(=O)(=O)NCC(=O)NNC(=O)c1cc2c(s1)CC[C@@H](C)C2	769375120	JIIHECQTPRIGHA-SECBINFHSA-N	426.520	1.217	50	20	IDGD	
C[C@@H](C(=O)NNc1cc(Cl)nc(N)n1)N1C(=O)c2ccc(Br)cc2C1=O	769652323	YQLQJYWXOOWKSU-LURJTMIESA-N	439.657	1.603	50	20	IDGD	
O=C1CN(S(=O)(=O)c2ccc(C(=O)NNc3c(F)cccc3Cl)cc2)CCN1	770196839	GUXPUQRFSPXDSX-UHFFFAOYSA-N	426.857	1.357	50	20	IDGD	
Cc1cc(N2CC[C@H](NC(=O)NNC(=O)[C@@H](C)Oc3cccc(Cl)c3)C2=O)n(C)n1	770648360	GDKMTQDPCWSKJQ-DOMZBBRYSA-N	434.884	1.285	50	20	IDGD	
CC(=NNC(=O)N[C@@H]1CCS(=O)(=O)C1)c1ccc(OC[C@H]2CCCCO2)c(F)c1	771099914	HKSNMCVFOMTRFR-HZPDHXFCSA-N	427.498	1.984	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1cccc(S(=O)(=O)N(C)C2CCCCC2)c1	771905267	SQDVNBRISSVRAT-AWEZNQCLSA-N	439.534	1.743	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1ccc(S(=O)(=O)N2CCCC[C@H]2C)cc1	771939436	OPYJJTYYDMNOEC-ZIAGYGMSSA-N	425.507	1.352	50	20	IDGD	
Cn1ccnc1[C@@H](O)C1CCN(C(=O)NNC(=O)c2cccc(Br)c2)CC1	771993752	OGCHYMGHZVNPOK-HNNXBMFYSA-N	436.310	1.983	50	20	IDGD	
CCc1ccccc1N1C[C@@H](C(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)CC1=O	772201272	UOYQDPRWEWJGOG-INIZCTEOSA-N	442.903	1.719	50	20	IDGD	
COc1ccc(C(=O)O[C@@H](C)C(=O)NNC(=O)CC(C)C)nc1I	772238471	URGPIYBNPSYQSL-VIFPVBQESA-N	449.245	1.434	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)N[C@H]1CC(=O)N(C2CCCCC2)C1	772563676	CSGWCEOXUSPBPB-AWEZNQCLSA-N	426.477	1.456	50	20	IDGD	
Cc1[nH]c(-c2ccncc2)nc(=O)c1CC(=O)NNC(=O)[C@H](C)Oc1cccc(Cl)c1	772970307	BQCCFDKNJBBVAP-ZDUSSCGKSA-N	441.875	1.951	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)C(=O)N2C[C@H](CC(=O)N(C)C)c3cc(Cl)ccc32)n1	773479592	ARSWQHGMTRFLRL-ZDUSSCGKSA-N	430.896	1.799	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2ccc(S(=O)(=O)c3ccc(F)cc3)cc2)n1	773724677	UMAGMTOIYFGIEY-UHFFFAOYSA-N	445.432	1.539	50	20	IDGD	
Cc1nn(C)c2ncc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc3cccc(Cl)c3)cc12	774003512	WPLSMHCIGSBLAK-LLVKDONJSA-N	430.852	1.484	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1nn(C(C)(C)C)cc1C#N	774009407	PASOJDYEMVKLAQ-NSHDSACASA-N	432.868	1.717	50	20	IDGD	
COC(=O)CCc1cccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)c1	774010609	YJHRVKACTNCIPG-ZDUSSCGKSA-N	447.875	1.999	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)Nc1ccc(C[C@@H]2NC(=O)NC2=O)cc1	775705993	LHRRIJBJOUQUIT-ABAIWWIYSA-N	429.408	1.196	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)N[C@@H]2CCO[C@@]3(CCS(=O)(=O)C3)C2)c1C	776075521	BEHRVZVRPYOXLS-QINHECLXSA-N	439.534	1.137	50	20	IDGD	
COC(=O)[C@H]1CCC[C@H](C(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)C1	776204867	HCELMJVPEBGHAG-GJZGRUSLSA-N	426.514	1.602	50	20	IDGD	
CN(NC(=O)c1cn(C)nc1-c1ccncc1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776213337	ODCOEDSVDXCJFE-UHFFFAOYSA-N	443.508	1.731	50	20	IDGD	
COc1cccc([C@H]2[C@H](C(=O)NNC(=O)Cn3nc(C)cc3C)CC(=O)N2C2CC2)c1	776448348	SBAAUZNVEQKHMF-NQIIRXRSSA-N	425.489	1.408	50	20	IDGD	
O=C(NNC(=O)N1CC[C@@H](n2cncn2)C1)[C@H]1Cc2ccccc2CN1Cc1ccccc1	776868315	ZGHDKCRTHUTMEB-FGZHOGPDSA-N	445.527	1.893	50	20	IDGD	
COC(=O)Cc1cccc(C(=O)OCC(=O)NNC(=O)c2cc(Cl)ccc2OC)c1	778510344	IWPDUSXETOKIIC-UHFFFAOYSA-N	434.832	1.682	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)NCc1ccccc1CN1CC[C@@H](O)C1	781824800	LXROGDTWTSSJRL-QGZVFWFLSA-N	430.530	1.582	50	20	IDGD	
CNC(=O)NNC(=O)COc1c(I)cc(Cl)c2cccnc12	781929355	CGZJSYLGFLNUFC-UHFFFAOYSA-N	434.621	1.832	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)[C@@H]1C[C@]12CCN(C(=O)OC(C)(C)C)C2	781969183	CZELMDGEKZNLIX-RBZFPXEDSA-N	426.514	1.696	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)c(OC)c1	782121047	QJEGVCJVTBQVFC-AWEZNQCLSA-N	443.456	1.652	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2cnc3c(c2)CN(C(=O)OC(C)(C)C)CC3)nc1	782148027	BEVNHLRISSLVJM-UHFFFAOYSA-N	442.476	1.860	50	20	IDGD	
CC(=O)Nc1cc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)ccc1C	783263095	HHTGQSPTBRLMKV-UHFFFAOYSA-N	448.505	1.117	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2cc(F)c(F)c(F)c2)nc1	783264986	VLCHXUPAGNGIFO-UHFFFAOYSA-N	431.396	1.267	50	20	IDGD	
COC[C@H](C)NS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccc(Cl)cc2)cc1	783339664	MIURNTDYBACRAP-LBPRGKRZSA-N	440.909	1.735	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NN=c2sc3ccccc3n2C)cc1S(=O)(=O)N(C)C	783349840	RAKZGAKDANGYJY-UHFFFAOYSA-N	447.542	1.369	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNS(=O)(=O)c2c(F)c(F)c(F)c(F)c2F)cc1C	783805372	GFFZYZRHPWPREV-UHFFFAOYSA-N	437.346	1.947	50	20	IDGD	
COCCn1ccc(C(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)n1	784332866	MSFLPMSVESEPST-UHFFFAOYSA-N	446.471	1.306	50	20	IDGD	
CS(=O)(=O)c1ccc(F)c(NC(=O)C(=O)NNc2ccc(Br)cn2)c1	784339360	HJWBSEDEJDUXGR-UHFFFAOYSA-N	431.243	1.469	50	20	IDGD	
O=C(NNc1ccc(Cl)nn1)C(=O)Nc1ccccc1S(=O)(=O)N1CCCCC1	784793779	UTZSRZNVUYOYSL-UHFFFAOYSA-N	438.897	1.386	50	20	IDGD	
CCCNS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccc(C(F)(F)F)nn2)cc1	784891035	BAXHLPZOERZIMR-UHFFFAOYSA-N	446.411	1.266	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)C(=O)Nc3cnn(CC(F)(F)F)c3)n[nH]2)c1	785130596	UZNHZVOGOXUSFU-UHFFFAOYSA-N	449.393	1.852	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)[C@H]2CCC[C@@H](C(N)=O)C2)c2ccccc2c1=O	786688719	RWFMXIHXCQMAJD-CABCVRRESA-N	427.505	1.639	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3cnc(O)c4ccccc34)cc2)CC1	787135304	VDVQCSRANXNZKB-UHFFFAOYSA-N	441.513	1.633	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1nc(Br)sc1C	788267988	SVJOCJHGKIREAQ-UHFFFAOYSA-N	446.352	1.890	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c(OCC2CC2)c1	788444534	FJDRFTCRKDCPIT-UHFFFAOYSA-N	425.489	1.952	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@@H](C)C(=O)NNC(=O)Cc1c(C)nc2nc(N)nn2c1C	788985915	RDDODSYARJZPGB-ZDUSSCGKSA-N	445.911	1.751	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)C(=O)Nc2nc(C)c(C)s2)c2ccccc2c1=O	789731358	CYJYQQHKOLXXNR-UHFFFAOYSA-N	442.501	1.670	50	20	IDGD	
COC(=O)c1cc(Cl)cc(S(=O)(=O)NNC(=O)COc2ccccc2O)c1OC	790185903	SCEMKKZRPGQKBT-UHFFFAOYSA-N	444.849	1.229	50	20	IDGD	
Cc1ccc(C(=O)NNS(=O)(=O)c2cccc(S(=O)(=O)N3CCCCCC3)c2)o1	790393332	GJPMIMRBSLLGLG-UHFFFAOYSA-N	441.531	1.776	50	20	IDGD	
CS(=O)(=O)c1ccc(C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)cc1[N+](=O)[O-]	791040671	IESIOPYBTCSDRX-YOEHRIQHSA-N	433.442	1.332	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNc2nc3ccccn3n2)cccc1S(=O)(=O)NC(C)(C)C	792394725	NBMAEYKKUIGMEX-UHFFFAOYSA-N	445.505	1.196	50	20	IDGD	
COc1ccc(CNC(=O)NNC(=O)CNC(=O)OCc2ccccc2)cc1[N+](=O)[O-]	792825381	USTNIQSHXKZCGU-UHFFFAOYSA-N	431.405	1.360	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)NCc2ccccc2OCC(=O)NC[C@H]2CCCO2)n1	792842192	GJYAJTXPBGXQMO-QGZVFWFLSA-N	441.488	1.208	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)N2CCN(C(=O)c3ccccc3OC(F)F)CC2)n1	793220401	OIZWEFVJCVJLOA-UHFFFAOYSA-N	433.415	1.804	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)N2CCC[C@H](S(=O)(=O)N3CCc4ccccc43)C2)n1	793228773	QMSPROIHVIYBIR-KRWDZBQOSA-N	443.529	1.601	50	20	IDGD	
O=C(CN1C(=O)C(F)(F)Oc2ccccc21)NNC(=S)NCCc1cccs1	794217824	PLBQRWCFVVJHMX-UHFFFAOYSA-N	426.470	1.804	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NN=C(CS(=O)(=O)N(C)C)C(C)C)c1	794855156	OOWUWOTZQGUPPY-UHFFFAOYSA-N	446.595	1.350	50	20	IDGD	
NS(=O)(=O)c1ccc(C(=O)NNc2ccc(C(F)(F)F)nn2)cc1Br	798335605	OHBWDCOLVAWVDU-UHFFFAOYSA-N	440.201	1.662	50	20	IDGD	
C[C@]1(C2CC2)NC(=O)N(CC(=O)NNc2cc([N+](=O)[O-])ccc2Br)C1=O	800618706	UOBGZCDURABWGN-OAHLLOKOSA-N	426.227	1.521	50	20	IDGD	
Cn1cc(NS(=O)(=O)c2ccsc2C(=O)NNc2ccc3c(=O)[nH]ccc3c2)cn1	803436860	ATXIWAZRNOKMJZ-UHFFFAOYSA-N	444.498	1.881	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)c1cc(N)cc(I)c1	803851562	NLHFYIPGVLKIKZ-SECBINFHSA-N	433.246	1.612	50	20	IDGD	
O=C(COC(=O)c1cc(=O)c2ccc(F)cc2o1)NNC(=O)c1cccc([N+](=O)[O-])c1	803926871	CMXQGIURKXRKOV-UHFFFAOYSA-N	429.316	1.458	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)NC2C[C@@H]3CC[C@H](C2)N3CC(=O)N(C)C)c1C	804643926	TVCWMUKMUZJZRG-GYYGDMSJSA-N	441.576	1.858	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3nc(COC)cs3)n[nH]2)cc1	806979544	ZNTNEIDFEUBCRY-UHFFFAOYSA-N	428.474	1.642	50	20	IDGD	
CCC(CC)NC(=O)[C@H]1CN(C(=O)C(=O)NNc2cccc(F)n2)c2ccccc2O1	807393028	STPTWZJZWYZSOX-MRXNPFEDSA-N	429.452	1.763	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)C(=O)Nc1cc(F)cc(Br)c1F	807428633	GNMZCZPOZRZOJP-UHFFFAOYSA-N	438.192	1.785	50	20	IDGD	
O=C(CNS(=O)(=O)c1cc(C(F)(F)F)ccc1Cl)NNC(=O)CC(F)(F)F	810179112	GWOMWRRAVSFJGG-UHFFFAOYSA-N	441.737	1.737	50	20	IDGD	
O=C(CCSc1ccc(F)cc1)NNC(=O)C(=O)Nc1cccc2c1OCC(=O)N2	810386226	QYDICVCIXXLBKM-UHFFFAOYSA-N	432.433	1.425	50	20	IDGD	
C[C@@H]1Oc2ccccc2[C@H]1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	812432157	VHERNMNYQRXFIU-LIRRHRJNSA-N	444.513	1.937	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)cc1	812730778	WDONTUQASPGRER-UHFFFAOYSA-N	430.446	1.788	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N2CCC[C@@H](CS(C)(=O)=O)C2)cc1Br	814300031	IIFMTICIMASDST-LLVKDONJSA-N	448.339	1.569	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)C2CCC(OC[C@H]3CCCO3)CC2)c2ccccc2c1=O	814729828	FEUGKRKMAHWLID-UYSNPLJNSA-N	428.489	1.449	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)N2CCC[C@H](n3cc(CO)nn3)C2)N(C)c2ccccc21	818155564	JLGFWZVODJHBQZ-KRWDZBQOSA-N	449.515	1.605	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)CCNC(=O)C12CC3CC(CC(C3)C1)C2	825631165	XZOYJGQAJOSJAK-UHFFFAOYSA-N	428.533	1.977	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1cn(Cc2ccccc2)nn1	844263875	LTQIPGXPSHWIBI-UHFFFAOYSA-N	427.490	1.003	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNC(=O)c2cnc3c(c2)c(O)nc(=O)n3C)cc1	879458617	AKXJCZFOLZWTMY-UHFFFAOYSA-N	425.445	1.534	50	20	IDGD	
Cc1noc(CSc2ccccc2C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)n1	894390817	KFYHSDSJPDYZGC-UHFFFAOYSA-N	436.457	1.721	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)NCC(=O)NNC(=S)Nc2cc(C)ccc2C)cc1	913423116	OOYXCBSFEDVJHY-UHFFFAOYSA-N	434.543	1.802	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)c2cccc(S(=O)(=O)NCC3CC3)c2)c1	914595053	IUGRIVHGRFRBOC-UHFFFAOYSA-N	431.514	1.832	50	20	IDGD	
COc1ccc(Cn2ncc3cc(C(=O)NNC(=O)c4ccncc4)cnc32)c(OC)c1	914836866	SOFLNBFVTYUDBV-UHFFFAOYSA-N	432.440	1.967	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(N3C[C@H](C)O[C@H](C)C3)nc2)cc1	915037495	PYPQTDYFTLNUGS-IYBDPMFKSA-N	426.473	1.622	50	20	IDGD	
COc1ccc([C@H](CNC(=O)NNC(=O)c2ccc3c(c2)OCCO3)N(C)C)cc1OC	915893789	BXZUNFXZLNYVIU-INIZCTEOSA-N	444.488	1.722	50	20	IDGD	
O=C(NNC(=O)c1cc(S(=O)(=O)Nc2ccccc2F)c[nH]1)c1ccc2c(c1)OCO2	916102517	CLGDZBPSOIBIJW-UHFFFAOYSA-N	446.416	1.758	50	20	IDGD	
O=C(CCCOc1ccc(Cl)cc1Cl)NNC(=O)NC[C@@H]1CCS(=O)(=O)C1	916376000	RWZVYXCXYZCQOM-NSHDSACASA-N	438.333	1.918	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)CCn2cc([N+](=O)[O-])cn2)c2ccccc2c1=O	919838639	BSTYXGBYMFQAHT-UHFFFAOYSA-N	441.448	1.543	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)/C(=C\c2cccc(OC)c2)n2nnnc2C)cc1	920011954	FIMWAWUQKMXPNM-XSFVSMFZSA-N	436.472	1.777	50	20	IDGD	
C[C@H](Cc1cccc(Br)c1)NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	920811265	FNPRCJRSTCKJEA-GFCCVEGCSA-N	444.293	2.000	50	20	IDGD	
Cc1ccc(S(=O)(=O)Nc2ccccc2F)cc1C(=O)NNC(=O)CN1CCCC1=O	920825333	AAUXXUQNDMNNOR-UHFFFAOYSA-N	448.476	1.318	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CNS(=O)(=O)c2ccc(Br)s2)cc1	1318256459	UVJMGSMTMYBQAX-UHFFFAOYSA-N	448.320	1.259	50	20	IDGD	
Cn1cc([C@@H](NC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)c2ccccc2)cn1	1320205812	UACLKWVVNWYADV-SFHVURJKSA-N	442.501	1.949	50	20	IDGD	
C[C@@H]1CCCN(S(=O)(=O)c2cc(C(=O)NNc3nncc(N)c3Cl)n(C)c2)C1	1322654593	BXGYNEQLGCZWCI-SNVBAGLBSA-N	427.918	1.228	50	20	IDGD	
COc1ccc(C(=O)NCCNC(=O)NNC(=O)c2ccc(Br)cc2)cc1	1337618939	FQLKVVCSSNSVQK-UHFFFAOYSA-N	435.278	1.832	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnc4ccccn34)C2)C1	1777827438	JDEUUPYEHVRNGQ-LIRRHRJNSA-N	435.322	1.951	50	20	IDGD	
CCOC(=O)c1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)ccn1	1779297830	AQCRTZBDYLVINK-OAQYLSRUSA-N	449.580	1.553	50	20	IDGD	
COCCn1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@](C)(Cl)CCl)C3)C2)n1	1781229575	JAFMUXBXXSJRGH-MSOLQXFVSA-N	433.336	1.209	50	20	IDGD	
O=C(c1cnc2[nH]ncc2c1)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781329271	CILXNHGUJVYDJE-BLLLJJGKSA-N	426.246	1.092	50	20	IDGD	
CCOc1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)nn1	1781333245	FIBXVDAUDQMQIS-CJNGLKHVSA-N	431.262	1.009	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)CC(N)=O)C2	1781897138	CVINIAUMVPRGQZ-UYAYXHRUSA-N	432.359	1.185	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(=O)cco1)C2	1781900183	MVOZCLGMXUTVSK-ZSZQSSIHSA-N	441.322	1.941	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CCC(=O)NN(C)C)C2)c(C)c1	1782212107	HXHOWXNFPCUPRZ-HYBUGGRVSA-N	444.576	1.804	50	20	IDGD	
N[C@H](CC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C(Cl)Cl)C1)c1cccnc1	1782215019	GDNRNLWFQZCNOI-SPYBWZPUSA-N	429.348	1.789	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3cccc4ccnn34)C2)C1	1782221130	YRVYOYSWXAVJFG-LIRRHRJNSA-N	435.322	1.809	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cccc4c3NC(=O)C4)C2)C1	1782410328	KDEKPTRONYVJOW-BUXKBTBVSA-N	436.306	1.408	50	20	IDGD	
CCCCCc1ncc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)s1	1782712433	HWNKSTUHSLGJCR-KUHUBIRLSA-N	429.970	1.919	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)[C@@H](N)Cc3cscn3)CCO2)C1	1783348128	VPVAIBQXSPCKCI-ZQIUZPCESA-N	445.383	1.016	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1CCCN1Cc1ccccc1)CCO2	1783878619	IFYRHFSONWTVSQ-JTAQYXEDSA-N	449.979	1.735	50	20	IDGD	
C[C@@H](NC(=O)c1ccc(F)cc1)C(=O)N1CCO[C@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783948261	GXFIARDPJKUKMZ-BLVKFPJESA-N	446.306	1.578	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C[C@@H]3CCCCO3)C[C@@H]21	1783969416	MAEKSFZAXOHBHL-XAJHFOFHSA-N	431.371	1.956	50	20	IDGD	
COC(=O)CCCCCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2	1784047699	DGLGPUCSQXZQRJ-RDTXWAMCSA-N	433.343	1.723	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3c(F)ccc(Cl)c3F)C[C@@H]21)[C@@H](O)CCl	1784095483	IZCBTCHESSYPBQ-NUZBWSBOSA-N	437.270	1.811	50	20	IDGD	
CC#C[C@H](CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]2C1)c1ccc(O)cc1	1784096508	YYGHRMJIGHPYRQ-OHNKGQGDSA-N	448.947	1.469	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(=O)n3C)[C@H]2C1	1785872843	LJXLAIIFQPKFAF-AYDFFVQHSA-N	440.338	1.152	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc4nc[nH]c34)[C@H]2C1	1787297940	UOHFYVYCJCYBDQ-DUPGQFARSA-N	435.322	1.940	50	20	IDGD	
O=C(NC1(c2ccc(NC(=O)c3cnccc3F)cc2)CCC1)c1cccc(B(O)O)c1	1788354464	JATRFQRBHCSVPV-UHFFFAOYSA-N	433.248	1.962	50	20	IDGD	
CCN1CCC(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]3C2)CC1	1788766295	ZKRQFVFIMIHPEB-FHWLQOOXSA-N	425.646	1.550	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccncc3O)[C@H]2C1	1788827476	AOIYZPQSFCWNET-PCBIJLKTSA-N	426.311	1.554	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc4snnc4c3)[C@H]2C1	1789203611	MCUDLVVNTPLNRV-WHOFXGATSA-N	437.953	1.945	50	20	IDGD	
CC[S@](=O)CCC(=O)Nc1ccc(C2(NC(=O)CCC(=O)NN(C)C)CCC2)cc1	1789424445	KRTZZEPNRWHZLS-PMERELPUSA-N	436.578	1.652	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1ccc(C2(NC(=O)[C@@H]3[C@H]4COC[C@H]43)CCC2)cc1	1789523476	BBIFRGXZXADHGU-BWTSREIZSA-N	435.484	1.325	50	20	IDGD	
C[C@@H](NC(=O)c1ccc(F)cc1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Cl)C[C@@H]21	1789695222	WARJPPOOXBVEJT-NOTNWKISSA-N	443.878	1.458	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc([N+](=O)[O-])cc3F)[C@H]2C1	1790029566	IEKSUYYCJCHNEX-SIUGBPQLSA-N	443.859	1.581	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1ccc(C2(NC(=O)c3cnccc3C(=O)NN)CCC2)cc1	1791568770	IHRNTAUALQQCTO-KRWDZBQOSA-N	445.907	1.687	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(C2CC2)on1	1792709654	WTPXBUVGLLHYRY-OQMKEHIESA-N	426.311	1.929	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2	1792867751	KMZBMHPRPBKBBW-HNCHTBHHSA-N	426.149	1.392	50	20	IDGD	
Cc1ccc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)CBr)cn1	1792868726	NDRQYLSRWSFZMV-KUZCPNRJSA-N	438.366	1.943	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)CBr	1792872125	NDMPUIGXWIPRLG-XGFWRYKXSA-N	435.315	1.169	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@@H](O)CCl)c[nH]2)cc1	1792975655	SYEWXTSHMSKUCE-HNJRGHQBSA-N	431.920	1.793	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)[C@@H]1C[C@@H]1c1ccc(F)c(F)c1	1793044303	FHYLUAZGDAXXMZ-WHGULVMYSA-N	428.863	1.258	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cn1ccc2c(F)cccc21)c1cccc(B(O)O)c1	1793056802	VEOPJMOBUKEMFX-REPLKXPHSA-N	449.291	1.412	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccnc(Cl)c1	1794753706	WVADIYXBGMLBSD-IKVITTDRSA-N	430.730	1.969	50	20	IDGD	
O=C1Cc2cc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)CCBr)ccc2N1	1795114395	DJHHOKUZUPGMCE-ZSBFGKGUSA-N	436.306	1.169	50	20	IDGD	
CC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1795140472	SVLFQWOMVHIFBU-IVSAIRAKSA-N	445.944	1.077	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)c1ccoc1C(F)(F)F	1796189296	VJGNLUPJZRRSHC-QDMKHBRRSA-N	436.195	1.544	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cc1c(C)noc1C)C2	1796890651	CUQVVGQUPQXCHU-XTUBRDOVSA-N	440.504	1.606	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(-c2cccnc2)[nH]n1	1798160598	XLOPWDVDMFZOPW-MBMVNNNZSA-N	448.321	1.458	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)c1c2ccccc2n2ccsc12	1798437949	JFVKLSAXCQENKS-ZDFLXESQSA-N	447.944	1.957	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(Cl)ccc1OC	1799022522	IUJWLJKFIHJIKG-RBNVPPIJSA-N	431.316	1.806	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2)c1cc(Cl)c(O)cc1O	1799442444	CABGINNBFUMXJQ-WRBXQSRGSA-N	447.713	1.739	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2)c1cccc(F)c1[N+](=O)[O-]	1799630705	WUDPMUWMZBTLJD-QHBPRCKVSA-N	444.257	1.722	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)CBr)C2	1800637624	FLMGRFIAWATAOE-UJPOAAIJSA-N	440.176	1.781	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1cccc(O)c1)C2	1800762857	HNNQZZDIYXMWEB-FRQROOTJSA-N	425.323	1.698	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc(C)c([N+](=O)[O-])c1)C2	1800977571	STCXWNPEDFQKQW-RCJHGTSTSA-N	439.896	1.289	50	20	IDGD	
Cc1cccc2cc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)CCC(=O)NN(C)C)[nH]c12	1801011331	HMGIUMDGHQBXJI-FAQVEIGNSA-N	441.532	1.053	50	20	IDGD	
N#C/C(=C\c1ccc(Br)cc1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](N)CN)C2	1801441488	UMNQSHLXDAGHJE-DBDMEFSLSA-N	446.349	1.280	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc(N3CCOCC3)n1)C2	1802274510	YWDQNVAEEWWNRX-YYIAUSFCSA-N	436.940	1.424	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1CCN(C(=O)CCn2cncn2)[C@@H]1c1cccnc1	1803018177	XOBGTFAXCGIKFE-UWWQBHOKSA-N	449.353	1.800	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cccc3c2OCC3)[C@H]1c1cccnc1)[C@@H](O)CCl	1803139068	KBEBKOJMCVTCQD-WDSOQIARSA-N	429.904	1.936	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cn3ncccc3n2)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803142275	CPGSUPDVJOMXTN-QILLFSRXSA-N	428.880	1.044	50	20	IDGD	
O=C(CN1CCOC1=O)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@H]1c1cccnc1	1803337819	ROPVXWOUEBJSPO-QEJZJMRPSA-N	443.273	1.230	50	20	IDGD	
Cc1nc(CC(=O)NC[C@@H]2CCN(C(=O)CCBr)[C@H]2c2cccnc2)no1	1804489352	LTNXKLOXWJXYOH-KSSFIOAISA-N	436.310	1.807	50	20	IDGD	
O=C(CCN1C(=O)C=CC1=O)N1CCCC2(CCN(C(=O)[C@@H](F)Br)CC2)C1	1806385446	FAYNMBYJGXXTCT-MRXNPFEDSA-N	444.301	1.223	50	20	IDGD	
C[C@]1(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)CC=CCC1	1807368687	XCANPKAYKUFCMY-KJWPAHLWSA-N	447.344	1.827	50	20	IDGD	
CC1=C(C(=O)NC[C@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)CCO1	1807766593	ZCXDDRPKNQNARQ-UTKZUKDTSA-N	429.521	1.155	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2cc(=O)n3[nH]cnc3n2)[C@@H]1c1cccnc1	1808260833	YNVMZAAFVJXRSS-JKIFEVAISA-N	443.895	1.150	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)Cn2nccn2)[C@H]1c1cccnc1)[C@H](F)Br	1808676541	UFKNVKHXIWCNID-QEJZJMRPSA-N	425.262	1.070	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC2(CCCN(C(=O)CCN3CCN(C)CC3)C2)CC1	1809554433	IQCJANFMWJOSKF-KRWDZBQOSA-N	443.430	1.639	50	20	IDGD	
Cc1ccc(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)cc1	1811959114	IHQBRDDNXJVKRH-GGAORHGYSA-N	443.312	1.703	50	20	IDGD	
Cc1cc(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)nc2nccn12	1812167964	NHSUYODZNFBXRX-SZMVWBNQSA-N	442.907	1.352	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)c1cccc2nccn12	1812172552	FECBUPBJBMVHTI-WDYCEAGBSA-N	427.892	1.649	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2cc3n(n2)CCCO3)[C@@H]1c1cccnc1	1813030425	JTDREXYQGSMEGP-JTDSTZFVSA-N	447.923	1.634	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)Cc2ccsc2)[C@H]1c1cccnc1	1813070444	GUIDTMGODOJTHK-AVRDEDQJSA-N	443.573	1.765	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H]2CCCCN2C)n[nH]1	1814897715	UHRJXIAWGSOHNO-SJORKVTESA-N	433.557	1.259	50	20	IDGD	
CC(C)CNC(=O)C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1	1823005331	WZKMWEABFDCRAM-GZMMTYOYSA-N	435.319	1.518	50	20	IDGD	
CC(=O)Nc1cc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)[C@H](O)CCl)CC2)ccn1	1824183306	TVIJGUPWXRETBL-ZWKOTPCHSA-N	436.940	1.873	50	20	IDGD	
C=CCSCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1	1824957659	QRKHDTVUHPCZTL-FQEVSTJZSA-N	430.379	1.519	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCN1CCOC1=O)CC2	1825640025	CUJXBSISNQEJRO-NXEZZACHSA-N	445.339	1.681	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)Cn1cc(Cl)cn1)CC2	1825998333	FLGOWSLJHQYZKB-MNOVXSKESA-N	432.333	1.859	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H]1[C@@H]3C=CS[C@@H]13)CC2	1826089713	MFOWWFOZIMMRKC-ZWUPXRALSA-N	435.575	1.303	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H]2CCOC2)CC1	1827679829	WNJDJHHVGVWVSS-SQPFYLMHSA-N	443.548	1.777	50	20	IDGD	
COCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Cl)CCN2C(=O)OCc1ccccc1	1829052241	ITMMKGFEQVYZBZ-YLJYHZDGSA-N	441.887	1.619	50	20	IDGD	
CC(C)N[C@H](C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2)C(C)C	1830358003	OCCRRYFNHBEXLK-UWJYYQICSA-N	432.005	1.730	50	20	IDGD	
C[C@H](Nc1nccs1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830358053	OSHWZHNNCVDCEH-LIRRHRJNSA-N	444.985	1.665	50	20	IDGD	
Cc1c(Cl)cccc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1830720334	XLXHZPXOYNFIMC-LPHOPBHVSA-N	431.316	1.318	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2[C@@H]3C=CS[C@@H]23)CC1	1831153161	OVQOANRCJIYITC-UWHLTILDSA-N	440.374	1.475	50	20	IDGD	
COc1ccc([C@@H]2C[C@@H]2C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)cc1	1831302637	VRYWLCLUORKJCO-RYLXDESZSA-N	440.899	1.790	50	20	IDGD	
Cc1ccn2ncc(C(=O)N3CCC(N4CCC(NC(=O)[C@H](O)CCl)CC4)CC3)c2c1	1833310522	LSDTVLPIQMZMDX-HXUWFJFHSA-N	447.967	1.428	50	20	IDGD	
CC(C)c1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)no1	1834499834	GAFMRTVWKHYMSG-UGSOOPFHSA-N	444.326	1.651	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccsc3)CCO2)C1	1836102047	ZVNUOOAFCVYJHJ-YJBOKZPZSA-N	445.379	1.921	50	20	IDGD	
CC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)c3cc(O)nc(O)n3)CC2)CC1	1836394399	UTMNAELWLCQWOT-AWEZNQCLSA-N	425.917	1.090	50	20	IDGD	
NC(=O)c1ccccc1C(=O)NC1CCN(C2CCN(C(=O)C(Cl)Cl)CC2)CC1	1836451100	NGEINPFXCUQYTC-UHFFFAOYSA-N	441.359	1.774	50	20	IDGD	
O=C(c1ccc2nc[nH]c2c1)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1836934212	JCVBGCUCHMQHIN-SFHVURJKSA-N	427.288	1.437	50	20	IDGD	
CN1N=C(C(=O)N2CCC(OC3CCN(C(=O)C(Cl)Cl)CC3)CC2)CCC1=O	1837059118	ZENDBTFBRXGXBC-UHFFFAOYSA-N	433.336	1.397	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccoc3Cl)C2)C1	1837714879	QVXYGHZWOIAKFZ-GOSISDBHSA-N	430.961	1.855	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCC(OC2CCN(C(=O)CN3CCCC3=O)CC2)CC1	1837809806	ZLKIAAFFXPCWFE-FQEVSTJZSA-N	448.391	1.844	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(Cl)cn1)CCO2	1837897699	GRUBTYXAUQQADX-IBGZPJMESA-N	441.988	1.657	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3[nH]cc4c3CCC4)CCO2)C1	1838456569	JBQLNTIBVBEVPB-DJJJIMSYSA-N	440.338	1.357	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)c(O)c1	1838887391	AOAQMOYXZGFNOV-NRFANRHFSA-N	440.924	1.736	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(C#N)cc3)CCO2)C1	1838952603	CTVUFOYZSLARGU-VQTJNVASSA-N	440.327	1.865	50	20	IDGD	
Cc1nscc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2	1839151660	ZPHXZQDLFVSGKO-DLBZAZTESA-N	436.361	1.758	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)c(O)n1	1839153405	HMVFMRNXQSIMHJ-RBUKOAKNSA-N	446.331	1.402	50	20	IDGD	
O=C(c1ccnc2c(O)cccc12)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1839606886	YLHBOJDAPMJSAK-YLJYHZDGSA-N	437.855	1.545	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)cn1	1840031535	SWGIFYRKKKSZEC-KSSFIOAISA-N	426.311	1.243	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3ccc[nH]3)C2)C1	1840031771	BVHRHTWYRZMYAS-KSSFIOAISA-N	428.327	1.187	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(OC)s3)C2)C1	1840150591	NSWXMODLIJALDE-ACJLOTCBSA-N	432.926	1.081	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3nc4ccccc4o3)C2)C1	1840154601	ADGXRVXLSAKDLM-VLIAUNLRSA-N	437.880	1.152	50	20	IDGD	
O=C(c1cc2cccnn2c1)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840189648	DRYFVCSTYYTGSW-SFHVURJKSA-N	427.288	1.208	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1C[C@H]1c1ccccc1)CCO2	1840288981	DZYZOLCAYYFHTP-WEMPKCCASA-N	436.936	1.500	50	20	IDGD	
Cc1cccc(C)c1N1C[C@@H](C(=O)N2CC3(CCCN3C(=O)[C@H](O)CCl)C2)CC1=O	1841350325	VNZSXBLQTNEYCM-DLBZAZTESA-N	433.936	1.459	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC2(CCCN2C(=O)c2ccc3c(c2)n(C)c(=O)n3C)C1	1843735041	RRSYBCXVZBZMCE-GFCCVEGCSA-N	435.322	1.477	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC2(CCCN2C(=O)Cn2c(=O)n(C)c3ccccc32)C1	1843860901	ZVIJXOWMFKFQJZ-CYBMUJFWSA-N	435.322	1.327	50	20	IDGD	
Cc1nccn1CC(=O)N1CCCC12CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1845819118	GZFRDDHDBNWUAU-HNNXBMFYSA-N	439.944	1.527	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC12CN(C(=O)c1cnc3cc(C)ccn3c1=O)C2	1846070394	GVXJNXHFWYRKEK-HNNXBMFYSA-N	447.333	1.993	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@H]2C[C@@H]3C[C@@H]3N2C(=O)OC(C)(C)C)C1	1847080238	ICNZZSSOYAKESA-YHUYYLMFSA-N	441.956	1.842	50	20	IDGD	
O=C(O)CCSSCCNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	2088605395	WQVVCGFGSSUOAD-UHFFFAOYSA-N	434.561	1.293	50	20	IDGD	
N#Cc1ccc(C=NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)cc1	12728092	OKTAMQUFWRBKGS-UHFFFAOYSA-N	426.498	1.662	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)Cn2c(=O)n(CC)c(=O)c3ccccc32)cc1OC	15761878	LUXQZSDGHBFDSR-UHFFFAOYSA-N	440.456	1.052	50	20	IDGD	
O=C(COC(=O)CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)NNC(=O)c1cccs1	19430496	TVKKWRCCGWRICY-UHFFFAOYSA-N	448.413	1.349	50	20	IDGD	
CC(C)c1n[nH]c(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)c1Br	111130968	YZNKNYXUXDFMOX-UHFFFAOYSA-N	443.327	1.664	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)c1ccc(OS(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1	115208469	QCOJFQIXUNAAOO-UHFFFAOYSA-N	444.425	1.776	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)CCNC(=O)c1ccc(F)cc1	115703469	QNIJHIKQGYKJHV-UHFFFAOYSA-N	435.481	1.008	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NC1CCN(C(=O)c2ccccc2F)CC1	726088348	GBBIVXOLOFFEPJ-UHFFFAOYSA-N	447.492	1.252	50	20	IDGD	
CC(=O)N1CCN(c2ccccc2CNC(=O)NNC(=O)COc2ccc(F)cc2)CC1	726275046	XUZFMEGZIZIERF-UHFFFAOYSA-N	443.479	1.404	50	20	IDGD	
Cc1ccc([C@@]2(C)NC(=O)N(CC(=O)NNC(=O)c3ccc4ccccc4n3)C2=O)cc1	726712623	MRZLIAOMDOEIKK-HSZRJFAPSA-N	431.452	1.771	50	20	IDGD	
O=C(CSC[C@@H]1CCCCO1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	727293050	HLORGLMPVZTNSS-INIZCTEOSA-N	441.575	1.534	50	20	IDGD	
Cn1ccc(S(=O)(=O)NNC(=O)[C@@H]2Cc3ccccc3CN2Cc2ccccc2)n1	727359035	IIFFESTTZUEDOX-IBGZPJMESA-N	425.514	1.357	50	20	IDGD	
CN(CCCOc1ccc(S(C)(=O)=O)cc1)C(=O)NNC(=O)c1cccc(C#N)c1	728953879	YEYZXNQAVXEFBG-UHFFFAOYSA-N	430.486	1.717	50	20	IDGD	
O=C(NNC(=O)N1CCN(CCc2cccs2)CC1)C1CCN(c2ncccn2)CC1	728959781	PLZADUMKSBFZQT-UHFFFAOYSA-N	443.577	1.356	50	20	IDGD	
C#CCNS(=O)(=O)c1cccc(C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)c1	728974611	WSDCOLDKXTWLAF-UHFFFAOYSA-N	443.453	1.351	50	20	IDGD	
COC(=O)C1CCC(NC(=O)NNC(=O)COc2ccc(Br)cc2)CC1	730129991	DZSAUGGEEQZUBE-UHFFFAOYSA-N	428.283	1.890	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)COc1ccccc1O)N1CCN(c2ccccc2)CC1	730820668	SIYLBDLPCSCMLM-KRWDZBQOSA-N	427.505	1.312	50	20	IDGD	
COc1ccc(C(=O)N2CCCC2)cc1NC(=O)NNC(=O)COc1ccccc1O	730898787	CYCOZQXPSIAFIO-UHFFFAOYSA-N	428.445	1.869	50	20	IDGD	
Cc1c(C(=O)NNC(=S)NCCc2cccs2)nnn1-c1ccc2c(c1)OCCO2	731501543	WKYRCHRMHWVGLT-UHFFFAOYSA-N	444.542	1.760	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)[C@H]1CC(=O)N(C[C@@H]2CCCN2CC)C1	733125432	HMGFDAFEGAJXSM-IRXDYDNUSA-N	440.548	1.079	50	20	IDGD	
Cc1ccc(C#N)cc1S(=O)(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	734119016	YZIPBQXIDJYZBI-UHFFFAOYSA-N	448.526	1.275	50	20	IDGD	
CC(C)[C@H](NC(=O)c1cccs1)C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C	734241213	IHXSNCRGEHTJDI-ZDUSSCGKSA-N	427.527	1.358	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)N2CCC(C(=O)NNc3nccnc3Cl)CC2)cc1	734261263	IXZJFXUPMWDFHP-UHFFFAOYSA-N	437.909	1.877	50	20	IDGD	
CCOCCCN1CC[C@@H](NC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)[C@@H](C)C1	734545023	VERVMBKSGFJBDM-FXAWDEMLSA-N	428.537	1.953	50	20	IDGD	
CN(C)[C@H](CNC(=O)NNC(=O)CNC(=O)c1cccs1)c1c(F)cccc1F	734676427	WIIQNMLNYZTSQV-CYBMUJFWSA-N	425.461	1.389	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)C(=O)N1CCCC[C@H]1C	737047089	HGIFNNJGBZHZMG-RTBURBONSA-N	444.580	1.319	50	20	IDGD	
O=C(COCc1ccccc1)NNS(=O)(=O)c1ccc(I)cc1	737756649	SDOQBVRCUDWYPS-UHFFFAOYSA-N	446.266	1.818	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCCC[C@H]2C)cc1C(=O)NNc1ncnc2[nH]cnc12	740746643	YWYVTBBXAQZBII-CYBMUJFWSA-N	429.506	1.981	50	20	IDGD	
CC(C)CNC(=O)N1CCC[C@H](CC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)C1	741207195	JYTKJYMOUSQYMM-OAHLLOKOSA-N	442.520	1.162	50	20	IDGD	
CC(C)NC(=O)C(=O)NNC(=O)C1(c2ccc(OCc3ccccc3)cc2)CCOCC1	742036749	NTFFJWOXJWKDAT-UHFFFAOYSA-N	439.512	1.986	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=S)N[C@H]1CCc2ccccc2C1	742977750	HOARFKODSGQAAN-INIZCTEOSA-N	431.587	1.955	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)[C@@]2(C)CCCN(C(=O)c3ccccc3)C2)C[C@@H](C)O1	743289194	PMCWUTOBZMFCHA-PNCHPQGNSA-N	430.549	1.576	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCCc2cccc(C(=O)N(C)C)c2)cc(OC)c1OC	743506427	NUGVGIXRWGYJQW-UHFFFAOYSA-N	444.488	1.601	50	20	IDGD	
C[C@H]1Oc2ccccc2N(CC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)C1=O	743829366	NLNONDOUNYXSHL-GFCCVEGCSA-N	432.458	1.057	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)OCCNS(=O)(=O)c2cnn(C)c2)c(C)n1CC(C)C	744499959	RIGYSDDZNSWHDJ-GIJQJNRQSA-N	433.534	1.923	50	20	IDGD	
Cc1cccn2cc(CC(=O)NNc3ccccc3S(=O)(=O)N3CCOCC3)nc12	744621576	UFEXIHONFWNVRX-UHFFFAOYSA-N	429.502	1.349	50	20	IDGD	
Cc1c(C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)cnn1-c1ccc(F)cc1F	744732259	QCAJHDUAFLRJTQ-UHFFFAOYSA-N	439.378	1.949	50	20	IDGD	
CSCC[C@H](NC(=O)NNC(=O)c1cc([N+](=O)[O-])ccc1O)c1nnc2ccccn12	745392394	ZYJNOICLPVLHRL-ZDUSSCGKSA-N	445.461	1.782	50	20	IDGD	
CC[C@@H](C)NC(=O)c1cccc(CNC(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)c1	745503264	JZVVNFUDLCIOSE-GFCCVEGCSA-N	429.433	1.973	50	20	IDGD	
C[C@H](CC(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1)C(=O)c1cccc(F)c1	746084148	BVXPIZFURFVHAZ-FZKQIMNGSA-N	444.415	1.565	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)N2CCN(c3cnn(C)c3)CC2)N(C)c2ccccc21	746349343	APMCEJLKZPAXCV-UHFFFAOYSA-N	433.516	1.739	50	20	IDGD	
C[C@@H](CS(C)(=O)=O)C(=O)NNC(=O)c1cn(-c2ccccc2)nc1-c1ccccc1	746825454	VFTRFSHPMGPQBF-HNNXBMFYSA-N	426.498	1.981	50	20	IDGD	
N#CCCCS(=O)(=O)c1ccc(C(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1	748165719	GGERALQZXFGGTR-UHFFFAOYSA-N	429.454	1.610	50	20	IDGD	
COc1cc(S(=O)(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c(Cl)cc1C(=O)O	749140578	AMEWVPMKOHIXCW-AWEZNQCLSA-N	442.833	1.196	50	20	IDGD	
Cc1nccn1C[C@@H](C)CNC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	749195537	GCWBLOPLXRONMH-SFHVURJKSA-N	427.553	1.370	50	20	IDGD	
O=C1Nc2c(I)cccc2C1=NNC(=O)[C@@H]1COc2ccccc2O1	750917785	MRSORKWTZSXXAA-ZDUSSCGKSA-N	449.204	1.904	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2occc2Br)cc1	751298115	XCBIIGZCDJKNCA-UHFFFAOYSA-N	430.280	1.432	50	20	IDGD	
CCOC(=O)c1ccc(N2CC(NC(=O)NNC(=O)COc3cc(C)cc(C)c3)C2)nc1	753280599	VDINGJAFENWMCZ-UHFFFAOYSA-N	441.488	1.473	50	20	IDGD	
COc1ccc([C@@H]2[C@H](C(=O)NNC(=O)CO)CCC(=O)N2c2ccc(C)cc2)cc1OC	753442283	CVZUUCHDJYJPAN-VGOFRKELSA-N	441.484	1.636	50	20	IDGD	
Cc1oc(C(=O)NNc2nc(Br)cn3ccnc23)cc1S(=O)(=O)N(C)C	754017969	PCOIWNOTFSOPLL-UHFFFAOYSA-N	443.283	1.400	50	20	IDGD	
CCNC(=O)N(C)NS(=O)(=O)c1cc(Br)c(C)c([N+](=O)[O-])c1OC	755133176	OBBFKTUMSYKUKB-UHFFFAOYSA-N	425.261	1.529	50	20	IDGD	
CCc1nn(C)c(CC)c1C=NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	755467541	PTNWMZMKEHLOEA-UHFFFAOYSA-N	433.534	1.330	50	20	IDGD	
O=C(CNC(=O)c1ccccc1C(F)(F)F)NNC(=O)c1nn(-c2ccccc2)cc1O	755678375	RCIZXQHZFSAYPA-UHFFFAOYSA-N	447.373	1.788	50	20	IDGD	
CC(C)Oc1cc(Br)cc(NC(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)c1	756865819	LPAGKEBGDFDUHT-SECBINFHSA-N	437.316	1.327	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)CN2C(=O)NC3(C[C@@H](C)C[C@H](C)C3)C2=O)cc1	756868521	WTAIOTDJEDCAOV-GJZGRUSLSA-N	432.546	1.981	50	20	IDGD	
O=C(NC[C@@H](c1ccccc1Cl)N1CCCC1)NNC(=O)C(=O)Nc1ccccn1	758671590	BUZZGSXPNCQBEH-INIZCTEOSA-N	430.896	1.841	50	20	IDGD	
CN(NC(=O)COc1ccc([N+](=O)[O-])cc1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758782309	OVLACIHKWMWIFG-UHFFFAOYSA-N	437.453	1.609	50	20	IDGD	
O=C(CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])NNC(=O)C(=O)Nc1ccccn1	758834785	RPDDCIKXNPJKDV-UHFFFAOYSA-N	440.338	1.597	50	20	IDGD	
N#CCOc1cccc(CC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1	760246662	KVTIUTBANYNXBY-UHFFFAOYSA-N	442.497	1.377	50	20	IDGD	
CC1(C)C(=O)N(C[C@](C)(O)C(=O)NNC(=O)CSc2ccccc2O)c2ccccc21	760482877	DQGPQQIOXLSOLA-QFIPXVFZSA-N	443.525	1.707	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)c2ccc(S(=O)(=O)NC[C@H]3CCCO3)cc2)n1	762906949	MXMZCYKEWHKAHQ-MRXNPFEDSA-N	448.549	1.537	50	20	IDGD	
CCC[C@@H](C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)C(C)C	763285868	ZYLXKXMVHBTBCP-LJQANCHMSA-N	439.578	1.860	50	20	IDGD	
CCCCOC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1	763442583	BENPZYVDHCOERA-UHFFFAOYSA-N	428.401	1.951	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cnc3c(c2)CCCC3)cc(OC)c1OC	763540112	QXBXXSWSJDUQOU-UHFFFAOYSA-N	428.445	1.386	50	20	IDGD	
CCOc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NNC(=O)c1c[nH]c2ccccc12	763541288	RXNPAEBCRWUTJN-UHFFFAOYSA-N	437.456	1.668	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2ccc(N3CCOCC3)nc2C)c1	763648633	FNJFSABPNLTAOX-UHFFFAOYSA-N	441.488	1.008	50	20	IDGD	
CCc1cccc(CC)c1NC(=O)C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	763718913	SEMLBUXITSMICF-UHFFFAOYSA-N	446.529	1.461	50	20	IDGD	
C[C@@H]1Oc2ccc(NC(=O)C(=O)NNC(=O)CSc3ccc(Cl)cc3)cc2NC1=O	763734358	KGEAGGHIOXWLRX-JTQLQIEISA-N	448.888	1.938	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)CC23CC4CC(CC(C4)C2)C3)cc1	763735975	QBRQGNMMRMDWSP-UHFFFAOYSA-N	433.530	1.783	50	20	IDGD	
CCOc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NNC(=O)c1cccc(Cl)c1	763750619	PUAHWDZPKJZLKO-UHFFFAOYSA-N	432.864	1.840	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)C(=O)N2CCc3ccc(Br)cc32)c1	763754452	RCVAFXSNJXOHJE-UHFFFAOYSA-N	431.290	1.865	50	20	IDGD	
Cc1ccc(C(=O)NC2CC2)cc1NC(=O)C(=O)NNC(=O)c1cc2c(s1)CCC2	763782412	UCBSBARQWZKSAC-UHFFFAOYSA-N	426.498	1.837	50	20	IDGD	
CCN1CCc2ccc(NC(=O)C(=O)NNC(=O)COc3ccccc3[N+](=O)[O-])cc21	763802341	BJVKFXHMFBFHDZ-UHFFFAOYSA-N	427.417	1.142	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)C(=O)Nc1ccc2[nH]ncc2c1	763882641	KKIPOAVCJYCDRW-JTQLQIEISA-N	446.261	1.879	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2cccc(NC(=O)C3CCCCC3)c2)n1	763885392	KUFUTHZKVNCCON-UHFFFAOYSA-N	440.504	1.805	50	20	IDGD	
O=C(NNC(=O)c1ccc(Br)s1)C(=O)Nc1ccc(-n2ccnc2)nc1	763939571	NMFVPGVDNNSXKH-UHFFFAOYSA-N	435.263	1.491	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)n(-c2ccc(F)cc2)n1	763998592	QFFGSNORXRVWPV-UHFFFAOYSA-N	449.240	1.810	50	20	IDGD	
Cc1cccc(Oc2ccc(NC(=O)C(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)cc2)c1	763999392	WMQYNCJQYKIASM-AWEZNQCLSA-N	431.470	1.308	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1ccc(F)cc1OC(F)F	764006637	RTZAQLIVSMYEIS-UHFFFAOYSA-N	425.319	1.598	50	20	IDGD	
NC(=O)CCOc1ccccc1NC(=O)C(=O)NNC(=O)Cc1cccc2ccccc12	764028701	OAPPAWQFJHEYAJ-UHFFFAOYSA-N	434.452	1.423	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)ccc1OC(C)C	764077109	HFSJMJYPDWMZAM-UHFFFAOYSA-N	433.486	1.585	50	20	IDGD	
CC[C@H](C)C(=O)NNC(=O)C(=O)Nc1cnc2c(c1)C[C@@H](NC(=O)OC(C)(C)C)CC2	764082481	NQIQOCAUAZKXAN-JSGCOSHPSA-N	433.509	1.596	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)NCc3ccccc3F)cc2)n[nH]1	764106562	MVNHOTVAVYMSBW-UHFFFAOYSA-N	438.419	1.187	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(N3CCc4sccc4C3)nc2)n[nH]1	764106604	NCENFYIIHPZLCF-UHFFFAOYSA-N	425.474	1.137	50	20	IDGD	
CS(=O)(=O)c1ccc(Oc2ccc(NC(=O)C(=O)NNC(=O)c3ccoc3)cc2)cc1	764162448	BVTLGHVGAASEHI-UHFFFAOYSA-N	443.437	1.875	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)c(OCCN(C)C)c1	764163772	MGRIXYLZSKJZBV-IBGZPJMESA-N	426.473	1.025	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccccc2F)cc1N1CCCCC1=O	764319551	MOKTWOFDOSAJSU-UHFFFAOYSA-N	442.447	1.680	50	20	IDGD	
Cc1nnc(-c2cccc(NC(=O)C(=O)NNC(=O)c3cnn(-c4ccccc4)c3)c2)o1	764351518	SIXHKOMWLPFLQX-UHFFFAOYSA-N	431.412	1.630	50	20	IDGD	
Cc1ccc(N2CCOC2=O)cc1NC(=O)C(=O)NNC(=O)COCc1ccccc1	764366649	DFORDBYRKHKENE-UHFFFAOYSA-N	426.429	1.254	50	20	IDGD	
CN(C)c1nc2cc(NC(=O)C(=O)NNC(=O)c3cc(-c4cccs4)[nH]n3)ccc2o1	764377812	QLCSNAVICRXJBH-UHFFFAOYSA-N	439.457	1.745	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1)C(=O)Nc1cccc(-n2ccnn2)c1	764388435	SDFOFTSPTPUHRD-UHFFFAOYSA-N	434.391	1.196	50	20	IDGD	
Cc1nnc(-c2cccc(NC(=O)C(=O)NNC(=O)CSc3ccccc3O)c2)o1	764402384	ZTBUOFOGEOIVJM-UHFFFAOYSA-N	427.442	1.629	50	20	IDGD	
O=C(NNC(=O)[C@H]1COCCO1)C(=O)Nc1ccc(Oc2ccnc3ccccc23)cc1	764435343	UNNRKHYSWJNKJK-LJQANCHMSA-N	436.424	1.528	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)c1cc(Br)c(C)n(C)c1=O	765185845	OVYXPKIFVAZGMX-UHFFFAOYSA-N	446.305	1.830	50	20	IDGD	
CCOC(=O)NNC(=O)C(=O)Nc1ccc(CN2CCN(c3ccccn3)CC2)cc1	765412907	AOATVORGMIHQBA-UHFFFAOYSA-N	426.477	1.120	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)CN3C(=O)c4ccccc4C3=O)n[nH]2)cc1OC	765597215	QGKVELRHRXQMKF-UHFFFAOYSA-N	449.423	1.151	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1cccc(-n2cccc2)c1	765735258	IYRBNDTVJDYADQ-UHFFFAOYSA-N	431.496	1.696	50	20	IDGD	
COc1ccc(COCC(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)cc1	765753933	FMRYAONYZKOVHT-UHFFFAOYSA-N	440.544	1.485	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNc2nccnc2OC)sc2c1CC[C@@H](C)C2	766268950	CFVDTLLHLKTITB-SNVBAGLBSA-N	433.490	1.930	50	20	IDGD	
NC(=O)c1ccc(/C=C\C(=O)N2CCC[C@@H]2C(=O)NNc2ncnc3ccsc23)cc1	766671377	JDRVRPUDKOYFGB-KQQSKNTNSA-N	436.497	1.938	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNS(=O)(=O)c1cc(Cl)c(F)c(C(=O)O)c1	767736905	SBOUNUSKQLXUQY-UHFFFAOYSA-N	446.840	1.965	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)CO[C@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1	767852249	FFJUIHBEMQKCFF-KRWDZBQOSA-N	436.509	1.671	50	20	IDGD	
CC(C)(O)C(=O)NNC(=O)c1cccc(Br)c1I	768248366	WRTVVPWTBFENJA-UHFFFAOYSA-N	427.036	1.586	50	20	IDGD	
COc1ccc(S(=O)(=O)NCC(=O)NNC(=S)Nc2cccc(C)c2)cc1OC	768255873	PKNMANHGYFMZRB-UHFFFAOYSA-N	438.531	1.308	50	20	IDGD	
C[C@H](OCc1ccccc1)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	768965728	LZPVZCAZGTYYCR-INIZCTEOSA-N	431.514	1.837	50	20	IDGD	
CCOC(=O)C(C)(C)n1cc(NC(=O)NNc2c(OC)cccc2S(C)(=O)=O)cn1	769240412	MAYJVBFKGCFAJY-UHFFFAOYSA-N	439.494	1.742	50	20	IDGD	
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N([C@@H]1CCS(=O)(=O)C1)N(C)C	769621059	LWYXMWPIXKQSCP-APWZRJJASA-N	434.562	1.344	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCN(C(=O)OCc2ccccc2)C1)c1nn(-c2ccccc2)cc1O	770132215	PGLWUADBAFGFAJ-QGZVFWFLSA-N	449.467	1.998	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)N[C@H]3CCN(c4ccc(Br)cc4)C3)nc21	770383322	GGLZTZLDEOEGQB-NSHDSACASA-N	447.297	1.736	50	20	IDGD	
C=CCNc1ncc(C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)s1	771046019	QOSVMLPVWWWQIK-UHFFFAOYSA-N	448.980	1.973	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNS(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-]	771609210	WPTHFISKENYRBY-UHFFFAOYSA-N	447.256	1.528	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)CN(C)C(=O)c1ccc(Br)o1	772036773	NQNMFFORSCSNGD-JTQLQIEISA-N	432.271	1.239	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2ccn(Cc3ccccc3)n2)cc1OC	772469861	XLMDDAXESFENBR-UHFFFAOYSA-N	438.440	1.567	50	20	IDGD	
CC(C)c1nccnc1NNC(=O)CCCNS(=O)(=O)c1ccc2c(c1)OCCCO2	772866341	KHUQQTANJLACHG-UHFFFAOYSA-N	449.533	1.963	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)[C@H]1CSCN1C(=O)c1ccccc1	772897404	HJEZKIIBUMMZCE-MRXNPFEDSA-N	446.916	1.319	50	20	IDGD	
CCNS(=O)(=O)c1ccc2c(c1)N(C(=O)C(=O)NNc1ccc3ccccc3n1)CC2	773662734	ZYEAGTYMWUFUJH-UHFFFAOYSA-N	439.497	1.565	50	20	IDGD	
COc1ncc(/C=C/C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)cn1	773857394	JMXAYJOUBCEUSK-QPJJXVBHSA-N	444.923	1.117	50	20	IDGD	
COC(=O)c1ccc(OC)cc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1cccc(Cl)c1	774000970	BFBKASTZEBKJMF-NSHDSACASA-N	449.847	1.689	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN[C@@H](C)c2ccc3c(c2)CC(=O)N3C)cc1OC	775350077	ILRMMBGFALFZIL-ZDUSSCGKSA-N	426.473	1.335	50	20	IDGD	
C[C@@H](NCC(=O)NNC(=O)c1ccc(C#N)cc1)c1cc(F)ccc1N1CCC(O)CC1	775355166	ADMTUXICRLPMSD-OAHLLOKOSA-N	439.491	1.770	50	20	IDGD	
CC1C[C@@H](C(=O)NNC(=O)c2ccccc2F)[C@H](C(=O)NNC(=O)c2ccccc2F)C1	775764079	AXODXWOGAXDWTP-HZPDHXFCSA-N	444.438	1.849	50	20	IDGD	
CC[C@@]1(O)CCN(C(=O)/C(C#N)=C/c2cn(CCC(N)=O)nc2-c2ccc(OC)cc2)C1	779341819	JBBBEXANSXLMDZ-XUUSCSPLSA-N	437.500	1.714	50	20	IDGD	
O=C(NNC(=O)[C@@H](O)[C@H](O)c1nc2ccccc2s1)c1ccc(Br)s1	779488142	CUGWDESRWKDWKX-RYUDHWBXSA-N	442.316	1.976	50	20	IDGD	
Cc1onc(CC(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)c1C#N	779491622	RDKRKTALPCNKAG-UHFFFAOYSA-N	442.435	1.617	50	20	IDGD	
C[C@H]1C(=O)CC[C@H](C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)C1(C)C	780951594	ZTRCOHOURCOFOL-MAUKXSAKSA-N	436.578	1.707	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)C(=O)Nc2cccnc2-c2ccc(C)s2)c1	782702897	TZLROIQTFRDDTK-UHFFFAOYSA-N	438.469	1.872	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNc2ncccc2C(F)(F)F)c(OC)c(OC)c1	783120546	TXDRIIYRQPYYLJ-UHFFFAOYSA-N	442.350	1.986	50	20	IDGD	
Cc1nnnn1-c1cc(NC(=O)C(=O)NNc2ccc(Cl)cc2[N+](=O)[O-])ccc1F	783290902	IQJFQMMEFMUHTR-UHFFFAOYSA-N	434.775	1.753	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)C(=O)Nc1cc(F)ccc1SCC(F)F	784002963	YJAKRWPBIYBIQC-UHFFFAOYSA-N	444.391	1.292	50	20	IDGD	
CO[C@@H](C)C(=O)Nc1cccc(NC(=O)C(=O)NNc2ccc(Br)cn2)c1	784340648	FLTXWKDBYSYYLP-JTQLQIEISA-N	436.266	1.899	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)C(C)C)cc1NC(=O)C(=O)NNc1nccnc1Cl	784780834	PKVUPWCPQIGBAQ-UHFFFAOYSA-N	440.913	1.549	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2ccc(F)cc2Br)ccc1-n1cnnn1	784802524	JSJVEDRKVXVYMX-UHFFFAOYSA-N	434.229	1.954	50	20	IDGD	
CC(C)(C)c1ncc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)cn1	784835689	SXMLCKGGOSOHJA-UHFFFAOYSA-N	427.433	1.852	50	20	IDGD	
CCNC(=O)N(C)NC(=O)C(=O)Nc1cc(F)c(I)c(F)c1	784916839	XUHTXSVBYHQAHB-UHFFFAOYSA-N	426.161	1.200	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)Nc1cc(F)ccc1Br	785024326	WTEQLQZAPZHPOJ-UHFFFAOYSA-N	441.169	1.602	50	20	IDGD	
CN(C)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)cc1Cl	785059798	AOXLFBNIXWYKQQ-UHFFFAOYSA-N	442.863	1.018	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1cccnc1-c1cnn(C)c1	786415095	WNLRIWXVGVUWCK-LBPRGKRZSA-N	426.408	1.175	50	20	IDGD	
Cc1cc(C(=O)N2CCC[C@@H]2C(=O)NNc2ccccc2S(N)(=O)=O)ccc1[N+](=O)[O-]	788228926	QTDJCACZRAOLOU-MRXNPFEDSA-N	447.473	1.299	50	20	IDGD	
CN(C)[C@H]1CCOc2c(NC(=O)C(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)cccc21	789729514	AATSZXRNYQJLNB-INIZCTEOSA-N	427.417	1.380	50	20	IDGD	
C[C@@H]1CCC2=S=C(C(=O)NNC(=O)C(=O)Nc3cc([C@H]4CCCO4)nn3C)C=C2C1	789731418	HEXDWIGUHVQBTE-BXUZGUMPSA-N	431.518	1.196	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)c3ccccc32)cc1	790126832	MDSINVZMENGQNJ-RDTXWAMCSA-N	432.498	1.961	50	20	IDGD	
CC(C)(C(=O)NNC(=O)C(=O)Nc1ccc(Cc2nnc3n2CCC3)cc1)c1ccccc1	792267244	XXHZLOXUSNSQPA-UHFFFAOYSA-N	446.511	1.879	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)C[C@H](CC#N)c2ccccc2)cc1	792805795	AYMPGTPHXJKBIC-SFHVURJKSA-N	428.514	1.851	50	20	IDGD	
COc1ccc(Cn2cc(NC(=O)C(=O)NNC(=O)[C@H]3Cc4ccccc4O3)cn2)cc1	793027075	XDYZKNDJCVGGKF-LJQANCHMSA-N	435.440	1.030	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)N2CCC[C@@H](S(=O)(=O)N3CCc4ccccc43)C2)n1	793228774	QMSPROIHVIYBIR-QGZVFWFLSA-N	443.529	1.601	50	20	IDGD	
CSc1nc2nc(C)c(CC(=O)NNc3ccccc3S(=O)(=O)N(C)C)c(C)n2n1	795177621	OIMWVVDYALUQSE-UHFFFAOYSA-N	449.562	1.399	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)CN[C@H](CO)c1ccc(Br)c(F)c1	795336747	SVPACNCNQYOXPZ-QGZVFWFLSA-N	438.297	1.910	50	20	IDGD	
CC(C)c1nn([C@H]2CCS(=O)(=O)C2)cc1C(=O)NNC(=O)Nc1ccc(N(C)C)cc1	802121311	YAKIFJVIVSDECK-INIZCTEOSA-N	448.549	1.899	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(OC(F)F)nc2)ccc1OC(C)C	802566317	IYEFKMBQWXLVKC-UHFFFAOYSA-N	438.387	1.879	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)N2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)cc1	805026854	DJLXPCTVLQPFIG-QFIPXVFZSA-N	432.528	1.805	50	20	IDGD	
CCc1nnc(NC(=O)[C@H](C)[C@@H](C)NC(=O)NNC(=O)COc2ccccc2O)s1	805880620	ICHHMJVRQVLDSA-GHMZBOCLSA-N	436.494	1.179	50	20	IDGD	
COCCOc1ccc(S(C)(=O)=O)cc1NC(=O)C(=O)NNc1ccccc1Cl	806967694	SFXUUCBOMWVBMV-UHFFFAOYSA-N	441.893	1.851	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)NCc1ccccc1CS(=O)(=O)N1CCOCC1	806970565	GHINPDRELURIMB-UHFFFAOYSA-N	446.529	1.301	50	20	IDGD	
COc1ccc(-n2c(C)cc(/C=C(/C#N)C(=O)NNC(=O)N3CCN(C)CC3)c2C)cc1	807383161	MUBQUVTWMMELCO-RGEXLXHISA-N	436.516	1.998	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NN=C1C(=O)N(CCN(C)C)c2ccccc21	807951891	CHDSQKDIDXTDGT-UHFFFAOYSA-N	442.545	1.330	50	20	IDGD	
NC(=O)C[C@@H]1CCN(C(=O)NNC(=O)[C@@H]2Cc3ccccc3CN2Cc2ccccc2)C1	808256047	KBUCGGOXSPLIMQ-RXVVDRJESA-N	435.528	1.552	50	20	IDGD	
O=C1COc2c(cccc2NC(=O)C(=O)NNc2nc(-c3ccc(Cl)cc3)no2)N1	810397749	ZZEQXHWMGLZDKS-UHFFFAOYSA-N	428.792	1.803	50	20	IDGD	
CC(C)(C)n1cnc(C(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)n1	812532461	SYQRQWFFLKQGCM-UHFFFAOYSA-N	445.483	1.866	50	20	IDGD	
COC(=O)c1cn(-c2cccc(NC(=O)NNC(=O)c3cccc(OC)c3O)c2)nn1	812980939	FYRJHXFYZKEAHY-UHFFFAOYSA-N	426.389	1.235	50	20	IDGD	
Cc1nc(-c2ccc(NC(=O)C(=O)NNc3ccc(S(=O)(=O)N(C)C)cc3)cc2)n[nH]1	813033046	BMPYQBIWKRRROT-UHFFFAOYSA-N	443.489	1.112	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@@H](O)c1ccc(Cl)cc1F	813367225	XDWHLLVGSGLLLZ-ZDUSSCGKSA-N	428.873	1.575	50	20	IDGD	
NS(=O)(=O)c1ccc(NC(=O)NN=Cc2cc(O)c(O)c(Br)c2)cc1	814968067	MOYBHMIOPYMYOO-UHFFFAOYSA-N	429.252	1.663	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)C(=O)Nc1ccn(-c2ccc(Br)cc2)n1	815569458	USYDPEXUTFGKDV-UHFFFAOYSA-N	443.261	1.358	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)cccc1-c1ncco1	815656590	AFVNWWDEYRYCDW-UHFFFAOYSA-N	443.485	1.982	50	20	IDGD	
O=C(CCC(=O)Nc1nnc(C2CCCCC2)s1)NNC(=O)[C@H]1CCc2nncn2C1	816879721	UUWBGGBNECFZAC-ZDUSSCGKSA-N	446.537	1.306	50	20	IDGD	
Cc1nnc(O)c(C(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)c1C	915131291	AMNVKQZBZXSDLX-UHFFFAOYSA-N	444.451	1.632	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)Nc1cccc(Cl)c1	915879561	WBUKJYDMRMTQJW-UHFFFAOYSA-N	438.893	1.827	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NCc2ccccc2CN2CCOCC2)cc1	915927400	LGOMXPLUKSKRCP-UHFFFAOYSA-N	428.489	1.437	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NCCCN2CCN(c3ncccn3)CC2)cc1C	916267534	UBYDECXPRZATDN-UHFFFAOYSA-N	441.536	1.015	50	20	IDGD	
COc1cccc(/C=C(/C#N)C(=O)OCC(=O)NCCc2ccc(S(N)(=O)=O)cc2)c1	916598982	DPTDVPIEAOUINQ-BOPFTXTBSA-N	443.481	1.152	50	20	IDGD	
CNC(=O)c1cccc(CNC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c1	916603634	ZXHSLWKSNNMHEL-UHFFFAOYSA-N	438.532	1.089	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C2(OC)CCN(C(=O)OC(C)(C)C)CC2)cc1OC	917906383	USYHNVCPAWRQOK-UHFFFAOYSA-N	437.493	1.881	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)OCc2nnc3n(C)c(=O)c4sccc4n23)cc(C#N)n1C	919047360	XJFDFLRUALQOQO-MLPAPPSSSA-N	433.453	1.812	50	20	IDGD	
O=C(Cc1csc(-c2cc(Br)cs2)n1)NNC(=O)CN1CCCC1=O	920433081	MULVQUYUDFBGQC-UHFFFAOYSA-N	443.348	1.946	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@@H](CCSC)N2C(=O)[C@H]3CCCC[C@H]3C2=O)cc1	1115817504	IPQHTQRMGGTREL-IXDOHACOSA-N	433.530	1.753	50	20	IDGD	
O=C(COC(=O)c1cn(-c2ccc(Br)cc2)nn1)NNC(=O)c1ccccc1	1318595044	HUPJFVIRIRWMLR-UHFFFAOYSA-N	444.245	1.648	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2cccc(C(=O)NNc3nncc(N)c3Cl)c2)C[C@H](C)O1	1319208798	NJSLSEXYFKGNIJ-QWRGUYRKSA-N	440.913	1.267	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)[C@H]3COc4ccc(F)cc4C3)cc2)CC1	1336204079	FMDDBNRHOQLTCE-MRXNPFEDSA-N	448.520	1.456	50	20	IDGD	
CC[C@@]1(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)CCN(C(=O)OC(C)(C)C)C1	1340878775	WAJJMGKKCKBXHM-HXUWFJFHSA-N	429.481	1.461	50	20	IDGD	
O=C(c1cc2cc(F)c(F)cc2[nH]1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1778400483	XNZJZAYDSSQDMM-QFBILLFUSA-N	427.835	1.489	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](C)Nc3cnccn3)C2)C1	1779053103	ZEQWEOFRCMSNQH-HBUWYVDXSA-N	440.342	1.138	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCO[C@]2(CCN(C(=O)c3ncon3)C2)C1	1779870055	SPCMAFSCLFGLEE-FZXOMJPYSA-N	429.383	1.398	50	20	IDGD	
COc1ccc2[nH]cc(C(=O)N3CC[C@]4(CN(C(=O)CO[Si](C)(C)C)CCO4)C3)c2n1	1780046254	VPNCEUSSUGVYDI-NRFANRHFSA-N	446.580	1.867	50	20	IDGD	
Cc1onc(-c2ccncn2)c1C(=O)N1CC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1780051413	FARDWMSKNWQJKP-GOSISDBHSA-N	440.287	1.687	50	20	IDGD	
COc1cc(C#N)cc(C(=O)N2CC[C@@]3(CN(C(=O)CCBr)CCO3)C2)c1	1780167798	GOIGOXATWXBYLN-LJQANCHMSA-N	436.306	1.795	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1ccc3ncnn3c1)C2	1780708270	RUKUSFLZWFOGMI-CBGDNZLLSA-N	433.940	1.803	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](F)Cl)CCO3)C1	1781162619	RPYXYAXVYRSOBL-AVYPCKFXSA-N	447.935	1.998	50	20	IDGD	
O=C(c1ccc2cnccc2n1)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781329951	ONHFWIAUGLDFML-MAUKXSAKSA-N	437.269	1.764	50	20	IDGD	
O=C(c1cc2ncsc2[nH]1)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781332457	YYPKSFWLPMVZOR-IAQYHMDHSA-N	431.287	1.758	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(NC(=O)C4CC4)cc3)C2)C1	1781470574	RTXYIOWWKGHXIB-AVRDEDQJSA-N	449.935	1.732	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(CCN(C(=O)c3c(F)ccc(O)c3F)C2)C1	1781931537	HBKXJAOEQNLOAL-LJQANCHMSA-N	428.508	1.965	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(F)c(C)n1)C2	1782170910	FSADZKMCLRQJOG-WIBUTAKZSA-N	427.904	1.910	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4nn(C)cc4c3)C2)C1	1782244727	QKXLLASKEVMJAL-ORAYPTAESA-N	435.322	1.800	50	20	IDGD	
COc1ccccc1CC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1783328093	BICBFXIVFCWQDF-AEFFLSMTSA-N	429.286	1.758	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)COc3ccc(F)cc3)CCO2)C1	1783532618	LIDMKVFOLPXSIK-SCLBCKFNSA-N	429.286	1.818	50	20	IDGD	
COc1ncc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](C)Br)C3)C2)cc1F	1783532678	RHJUINFAIFWOMC-APPDUMDISA-N	430.274	1.456	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)CCNC(=O)OC(C)(C)C)CCO2)C1	1783537233	JREKRZGKPZNQNM-FZKQIMNGSA-N	448.358	1.515	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(C4CC4)on3)[C@H]2C1	1783760525	CZICFNVNKMERPV-SDPXSBNPSA-N	426.311	1.929	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN3CCCCC3)C[C@@H]21	1783967646	HTUHVRYWOWRLRM-QAETUUGQSA-N	430.387	1.483	50	20	IDGD	
O=C(Cc1cc(F)ccc1Cl)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21	1784925346	QMWHDTZVZIZUKD-WPUCRFQZSA-N	433.307	1.601	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(CO)c(F)c3)C2)C1	1785268690	UIVIOXQVQSXQEI-MOPGFXCFSA-N	433.307	1.998	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3CCC(CO)CC3)C[C@@H]21	1786401208	UIDKVFPCBGVZSC-YOTSKQKMSA-N	431.371	1.550	50	20	IDGD	
NC[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)c1ccccc1	1786924247	GWGQIXNRYHCBNJ-WOYTXXSLSA-N	442.329	1.399	50	20	IDGD	
Cc1ccc2cc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)[C@H](O)CCl)C[C@@H]43)ccc2n1	1787984383	DRSQGGVLQAGHTR-XEYPJELSSA-N	431.920	1.736	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnn4ccccc34)C[C@@H]21	1788762779	WRASQQYKAOFBOS-IEZWGBDMSA-N	430.581	1.779	50	20	IDGD	
Cc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCBr)C[C@@H]32)nn1C(F)F	1789329457	LTNFDDADCGPLDU-OBJOEFQTSA-N	449.296	1.965	50	20	IDGD	
CCOC(=O)N[C@@H](O)C(=O)Nc1ccc(C2(NC(=O)CCBr)CCC2)cc1	1789405523	VLBQZJOQHQLHOR-INIZCTEOSA-N	442.310	1.970	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4c(n3)NC(=O)CC4)C[C@@H]21	1789859895	DYBIFFXVGPPSGK-MPTYRVRUSA-N	434.924	1.577	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)c1ccc(O)cc1F	1790080825	QNSBIXSMCDDJOP-PJODQICGSA-N	429.286	1.910	50	20	IDGD	
Cc1ccc(C(=O)Nc2ccc(C3(NC(=O)c4cccc(B(O)O)c4)CCC3)cc2)c(O)n1	1790115507	JHTZGHULYTXULE-UHFFFAOYSA-N	445.284	1.837	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3C[C@@H]3F)[C@H]2C1	1790731987	NCVZWAJXYKKIHN-SRLWMKERSA-N	449.435	1.471	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)N3C[C@H]4C[C@H]4C3)C[C@@H]21	1790961251	XOUHJYZOYQNHCO-WSKJNLASSA-N	442.398	1.480	50	20	IDGD	
Cc1ccc(F)cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnccc1C(=O)NN)C2	1792714567	FZTIZVVHLKDDBM-MUJYYYPQSA-N	425.464	1.698	50	20	IDGD	
COc1ccc(OCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)Br)C3)cc1	1792725921	JCNQEWDOCMAJMM-FLTUCWPJSA-N	441.322	1.447	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc3nc[nH]c13)C2	1792867429	AIKLBWNJIQJCDD-NFFDBFGFSA-N	435.322	1.797	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Nc1ccccn1)C2	1792870688	IIVNRSPCDJWAGF-WVCIDPQESA-N	439.354	1.503	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C=C/c1ccc([N+](=O)[O-])o1	1793107593	YSCCHBXTGQDVCY-HILMWPRSSA-N	437.525	1.642	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CC(=O)N(C2CCCC2)C1	1793777705	ADBQRSWNIOLGIS-LSIDRNEPSA-N	425.957	1.385	50	20	IDGD	
COc1cccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCBr)n1	1795111548	WEBBBJWOYJJDCW-IVWMJMPLSA-N	426.311	1.007	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccncn1	1796522543	ZPPCBRIFCRZAFI-AHHPBITISA-N	439.422	1.565	50	20	IDGD	
Cc1c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCBr)C3)nc2ccccn12	1796845380	UPZFEGVFUUABBS-ZSBFGKGUSA-N	435.322	1.631	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C=C/C(=O)NCc1ccco1)C2	1798627574	QHISCDBSJJMXGU-RFVJJRFUSA-N	433.581	1.942	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc([N+](=O)[O-])cc1F)C2	1800759921	QLAXMSJQUYDPAN-YYHMBLRTSA-N	444.257	1.721	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(-n3cccn3)cc1)C2	1800977163	KGGCAUUXNBNPOS-UKBAYJJMSA-N	432.908	1.329	50	20	IDGD	
CC(C)n1nc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C(Cl)Cl)cc1C(=O)O	1801015915	PMWOONBISVZRCG-DDFAGTSDSA-N	433.292	1.169	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1cccc(F)c1F	1801828069	YDWNFVYCUNJIGW-QDMKHBRRSA-N	443.454	1.458	50	20	IDGD	
COc1ccc(F)cc1CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc(B(O)O)c1)C2	1802499190	NABHVVFTJGCHIU-ACDBMABISA-N	440.280	1.009	50	20	IDGD	
COc1cc(CCC(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]2c2cccnc2)ccn1	1803135717	GESVPCVQIOHMTL-DBXWQHBBSA-N	446.935	1.724	50	20	IDGD	
C[C@H](Oc1cccnc1)C(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1	1803145843	JCATXGOKJPQKRB-FXECBMLZSA-N	432.908	1.550	50	20	IDGD	
Cc1cccn2ncc(C(=O)N3CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]3c3cccnc3)c12	1803147332	HCUWTZCJGQCFBO-IMFGXOCKSA-N	441.919	1.957	50	20	IDGD	
CCOCCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN(C)NC(=O)NCc1ccccc1)C2	1803202308	SHZBJSUCRSURKT-ACDBMABISA-N	445.564	1.397	50	20	IDGD	
CC(=O)N(C)CCC(=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@H]1c1cccnc1	1804073161	QJPQVBXMNVZRJX-BHYGNILZSA-N	443.317	1.646	50	20	IDGD	
C=CCSCC(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1804172653	DVEHDLJWRSCTHD-RXVVDRJESA-N	439.346	1.000	50	20	IDGD	
Cc1ccnc(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)c1	1807362594	MFXXBXYWEZXJLB-UGKGYDQZSA-N	444.300	1.098	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)CCN2CCN(C)CC2)[C@H]1c1cccnc1	1808260578	WZSOBWBFOIRKNN-DYXWJJEUSA-N	436.000	1.742	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cc(=O)nc3cccnn23)[C@H]1c1cccnc1)[C@@H](F)Cl	1808315097	KDABPDKIQSORJJ-DOPJRALCSA-N	444.854	1.339	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)c1ccc2c(c1)OCO2	1808981086	DXULSJVLOCAIMO-BXWFABGCSA-N	431.876	1.730	50	20	IDGD	
O=C(CCc1cccnc1)N1CCCC2(CCN(C(=O)c3ccc(B(O)O)cc3)CC2)C1	1810178819	BUHMCAOIXZONLL-UHFFFAOYSA-N	435.333	1.239	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@@H](CNC(=O)c2nccnc2C(N)=O)[C@H]1c1cccnc1	1811183609	UYVKBJWZNNSXTP-WMLDXEAASA-N	444.923	1.555	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2ccc(OC)nn2)[C@H]1c1cccnc1	1811210630	YOIHXKGPWULOPC-RLFYNMQTSA-N	433.896	1.454	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)CN2CCCCC2=O)[C@H]1c1cccnc1	1813033977	YKZYHWUDPXOLGG-UWVAXJGDSA-N	436.940	1.354	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)[C@H](C)S)[C@H]1c1cccnc1	1813036925	MYINBRJVXADFRM-OZLXWWKBSA-N	442.545	1.540	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)CN3CCOCC3)sc2C1	1814572672	VMORZOSNDULJFK-GHMZBOCLSA-N	431.356	1.171	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc3n(n2)CCNC3=O)n[nH]1	1816625799	IHPIJLNOTCRGMW-RISCZKNCSA-N	433.900	1.673	50	20	IDGD	
CNc1ccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)cc1	1817274434	UIQXGASYENBMKO-FQEVSTJZSA-N	447.304	1.751	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)C1(C)CC1)CC2	1817276919	FWIQLOKCZVBHHM-JBBSTVMTSA-N	428.518	1.989	50	20	IDGD	
COc1cccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)c1	1817476906	SXDLBZJEKZPHJJ-FQEVSTJZSA-N	448.288	1.718	50	20	IDGD	
COc1cccc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)CCC(=O)NN(C)C)CC3)c1	1822099763	FHDUEGKHHKKIBH-AWEZNQCLSA-N	445.545	1.751	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(O)cn2)[nH]n1	1822413304	SDCCCAVJPLIVDX-MRXNPFEDSA-N	429.481	1.189	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CN1C(=O)C=CC1=O)CC2	1822868974	DHTHJGKGJIHUHB-XLFHBGCDSA-N	445.328	1.216	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1	1824010546	DVPXYACCCWVHOO-LJQANCHMSA-N	434.773	1.865	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc[nH]n2)CC1	1824668873	DVABTNHSBYQCNC-QVWJKXSPSA-N	439.520	1.777	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(=O)n1O)CC2	1825637157	TUZMMKZUMVDQHK-BDAKNGLRSA-N	441.307	1.551	50	20	IDGD	
O=C(CN1CCOC1=O)N1CCC([C@@H]2CCCCN2C(=O)CCBr)CC1	1826353363	XJUVLOIBEWVYRN-HNNXBMFYSA-N	430.343	1.843	50	20	IDGD	
C=C[C@@H](O)C(C)(C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827052138	PQYDOIZEFTXDAH-LEWJYISDSA-N	442.365	1.173	50	20	IDGD	
Cc1nccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)n1	1827052947	POFZIYRCMPJIFB-OAQYLSRUSA-N	436.321	1.012	50	20	IDGD	
CC(=O)Nc1ccccc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](O)CCl)CC2	1827717809	AAWSKVMQFDRKSA-XHDPSFHLSA-N	436.921	1.927	50	20	IDGD	
CN1CCC[C@H]1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1	1828923362	GGZHKBSCAADZRU-UXHICEINSA-N	442.564	1.013	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3nnsc3C3CC3)C2)C1	1830357851	MOZBYTNCQNRWBR-LJQANCHMSA-N	442.969	1.751	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)C3CCC(CO)CC3)C2)C1	1830358703	RBIKOWMZUBDXCO-BPZDKFOGSA-N	430.973	1.507	50	20	IDGD	
C[C@@H](Cc1ccccn1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830370290	POIUASYVMXYFET-JTSKRJEESA-N	437.968	1.982	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(CN(C(=O)CCc3ccccn3)CCO2)C1	1833187860	ZMWADPWOGIPBMU-OAQYLSRUSA-N	435.597	1.322	50	20	IDGD	
CC(C)(CCl)C(=O)NC1CCN(C2CCN(C(=O)[C@H]3CCC(=O)NC3)CC2)CC1	1833213879	GRVCLPUTWLXUSM-HNNXBMFYSA-N	426.989	1.349	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3ccc(F)nc3F)CC2)CC1)[C@@H](O)CCl	1833306857	IQSUKLAVJHMZOF-HNNXBMFYSA-N	430.883	1.145	50	20	IDGD	
Cn1c(C(=O)N2CCC(N3CCC(NC(=O)[C@H](O)CCl)CC3)CC2)cc2ccccc21	1833310132	KDGWOHCMCTYKBF-OAQYLSRUSA-N	446.979	1.963	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ncc(OC)cc3F)CCO2)C1	1833630079	WZKGMNZMQVQKIV-MGPUTAFESA-N	443.903	1.707	50	20	IDGD	
Cc1ccncc1CCC(=O)NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1833827470	OHNWLJRRJYXIJL-HXUWFJFHSA-N	436.984	1.494	50	20	IDGD	
Cc1occc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)CBr)C2)C1	1834134097	VXDDOFDEOGQAES-FZKQIMNGSA-N	429.311	1.689	50	20	IDGD	
Cc1cc(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](F)Br)CC3)CC2)n(C)n1	1834189286	QXLOJWXVRPWLIB-MRXNPFEDSA-N	444.349	1.604	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)c3ccncn3)CC2)CC1	1835143900	DCFPGJFIKQLSSU-CQSZACIVSA-N	438.370	1.693	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3ccncn3)CC2)CC1	1835146919	OVPPCGPFOBPKSQ-INIZCTEOSA-N	438.370	1.835	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(-n4cnnc4)cc3)CCO2)C1	1835498511	JGYQICLGKROEIW-WIYYLYMNSA-N	447.923	1.355	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC1CCN(C2CCN(C(=O)[C@H]3CCCOC3)CC2)CC1	1835837907	RQYBPBWADAQEBX-KRWDZBQOSA-N	425.646	1.836	50	20	IDGD	
Cc1cc(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](F)Br)CC3)CC2)n[nH]1	1836147078	BALPDOVUFZHEBV-OAHLLOKOSA-N	430.322	1.594	50	20	IDGD	
CCc1ncsc1C(=O)NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836204149	HXMPBWWSRMXDBC-MRXNPFEDSA-N	428.986	1.490	50	20	IDGD	
Cc1ccc(C(=O)NC2CCN(C3CCN(C(=O)[C@H](O)CCl)CC3)CC2)cc1F	1836262941	CAZKHIAHOUCBTM-LJQANCHMSA-N	425.932	1.919	50	20	IDGD	
Cc1noc(CC(=O)N2CCC(N3CCC(NC(=O)[C@@H](F)Br)CC3)CC2)n1	1836412423	GBAWSNVHHAUGKZ-MRXNPFEDSA-N	446.321	1.183	50	20	IDGD	
CC[C@@H](Br)C(=O)NC1CCN(C2CCN(C(=O)c3[nH]nnc3C)CC2)CC1	1836541983	QEMKLEFBGVZDPN-OAHLLOKOSA-N	441.374	1.472	50	20	IDGD	
CCNC(=S)NCC(=O)N1CCC(OC2CCN(C(=O)C(C)(C)CCl)CC2)CC1	1836624605	OXAQNSFBLXTGSA-UHFFFAOYSA-N	447.045	1.734	50	20	IDGD	
COC(OC)C(=O)N1CCC(OC2CCN(C(=O)[C@](C)(Cl)CCl)CC2)CC1	1836789825	OQQJNCCUXMKPHB-GOSISDBHSA-N	425.353	1.840	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)/C(C)=C/c3ccc(C)o3)CCO2)C1	1837582534	OUBDJAIQUGTTTH-LJGRONJBSA-N	440.924	1.702	50	20	IDGD	
O=C(CCBr)N1CCC(OC2CCN(C(=O)c3cccnn3)CC2)CC1	1837653605	ILKDAMZEXPVRLK-UHFFFAOYSA-N	425.327	1.874	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)C3CCSCC3)C2)C1	1837717660	LNQWBLGVHORHNM-IBGZPJMESA-N	430.643	1.438	50	20	IDGD	
O=C(c1cc2cc[nH]c2cc1F)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1838571750	AXEFJPGNEKBJIK-VQIMIIECSA-N	427.835	1.911	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(Cl)c(O)cc3O)C2)C1	1839147273	LYKAHJYFIODARK-DJJJIMSYSA-N	447.315	1.839	50	20	IDGD	
CC[C@H](C)[C@H](O)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2	1839150392	LDMHCOYIMDFHNY-DFEHZGFQSA-N	425.353	1.086	50	20	IDGD	
O=C([C@@H](F)c1ccccc1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839198624	LIGVRGROEHABJE-MPGHIAIKSA-N	447.276	1.844	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc4cccnc4nc3O)CCO2)C1	1839514142	XMVVUSIFIVRQKR-IIBYNOLFSA-N	448.907	1.423	50	20	IDGD	
CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](Br)Cc1ccccc1)CCO2	1839802427	WXTPHQWNPILQOA-PXNSSMCTSA-N	439.350	1.859	50	20	IDGD	
C=CCC(F)(F)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)CBr)C2)C1	1839886644	HFCHQENSYHMGHP-XJKSGUPXSA-N	439.297	1.685	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3conc3C)C2)C1	1839963666	RGKIVBIHTSZYMQ-YOEHRIQHSA-N	430.299	1.227	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CCCSC3)C2)C1	1840035848	HYDJGTRYFASZAQ-ZQIUZPCESA-N	435.384	1.369	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)C3Cc4ccccc4C3)C2)C1	1840155862	DZDSSMMILUKRHI-UGKGYDQZSA-N	436.936	1.112	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)C3=COCCC3)CCO2)C1	1840213947	CJHHOZXCGPKTNZ-RDTXWAMCSA-N	431.327	1.168	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1C[C@]1(F)Cl)CCO2	1840247739	HTHINSIBLYCKSV-NOXHYTERSA-N	441.725	1.541	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(F)c(F)c3C)CCO2)C1	1840705567	UBKDIVOQPRJAEX-YWZLYKJASA-N	446.878	1.597	50	20	IDGD	
CC(=O)Nc1ccccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1840724258	UDNFUGKGERJTLE-LPHOPBHVSA-N	427.860	1.249	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@H](F)C[C@H]1C(=O)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1	1841354552	GVBSOPFNWYLEDK-IHRRRGAJSA-N	433.908	1.137	50	20	IDGD	
C[C@H](C(=O)N1CC2(CCCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C1)n1cncn1	1841925421	TWBNKSHOPCNKKP-KGLIPLIRSA-N	440.932	1.175	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC2(CCCN2C(=O)c2cccnc2CS(C)(=O)=O)C1	1842240761	VGMBIFSJDMKKER-UHFFFAOYSA-N	439.610	1.295	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)CCS(=O)(=O)c2ccccc2)C1	1842744889	LSGMMAISTRANIA-MRXNPFEDSA-N	428.938	1.308	50	20	IDGD	
Cc1cccc2c(C(=O)N3CC4(CCCN4C(=O)c4cnccc4C(=O)NN)C3)n[nH]c12	1844265084	TXWICHARYYFNEF-UHFFFAOYSA-N	433.472	1.001	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)c2c[nH]c3c(Cl)cccc23)C1	1845682139	XBWSLZVPAYTNMR-UHFFFAOYSA-N	437.692	1.632	50	20	IDGD	
Cn1nc(C(=O)N2CC3(CCCN3C(=O)[C@@H](Br)Cc3ccccc3)C2)cc1O	1845940354	KTGRNXREQIKBMQ-HNNXBMFYSA-N	447.333	1.949	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCCC12CN(C(=O)C(F)(F)C(F)(F)C(=O)O)C2	1846068906	USGVPFNPOZOZSK-MRVPVSSYSA-N	433.196	1.719	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H]2CC[C@@H](C2)[C@@H]1C(=O)N1CCCC12CN(C(=O)[C@H](O)CCl)C2	1846143376	YTGXTTBSBKLGNB-CAOSSQGBSA-N	441.956	1.578	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)c1ccc(Cl)nc1Cl)C2	1846385264	KBNDSXMXWMOOCG-UHFFFAOYSA-N	428.320	1.578	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)Cc1cc(F)ccc1Cl	1848017689	GKPWQPXTHWJUDV-ROUUACIJSA-N	445.882	1.536	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cnn(Cc3ccccc3)c2)cc1	14844757	YCGSROAXROWLKL-UHFFFAOYSA-N	441.513	1.322	50	20	IDGD	
CCOc1ccc(C(=O)NNS(=O)(=O)c2ccc3c(c2)CCN3C(C)=O)cc1OC	15245568	BWENQJRNWJADHC-UHFFFAOYSA-N	433.486	1.626	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2ccc(C(C)(C)C)cc2)cc1	26070073	MCGOBBSLBQMBSD-UHFFFAOYSA-N	433.530	1.984	50	20	IDGD	
O=C(Cc1cccc2ccccc12)NNC(=O)CN1C(=O)N[C@]2(CCc3ccccc32)C1=O	29612418	CLHGIDMTKMELRQ-VWLOTQADSA-N	442.475	1.923	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)[C@H]1CCCN1S(=O)(=O)c1cccs1	109905546	OZHAEYWCLKGEFS-IUODEOHRSA-N	441.506	1.655	50	20	IDGD	
CC(C)C[C@H](NC(=O)c1ccc(Cl)cc1)C(=O)NNC(=O)CNC(=O)c1ccco1	725739320	BWSJHYOMAMPXMY-HNNXBMFYSA-N	434.880	1.655	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NCc1cccc(OCC(F)(F)F)c1	725873287	MFGHUGFHTLBSQH-UHFFFAOYSA-N	430.408	1.950	50	20	IDGD	
O=C(NNC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)c1ccc(Cl)cc1)C(=O)N1CCCC1	726160884	MTEDPDJSEMFPQT-SZMVWBNQSA-N	446.935	1.883	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2cc(Br)c[nH]2)cc1C	726292681	FFJRJYGJMZBVKE-UHFFFAOYSA-N	429.296	1.134	50	20	IDGD	
CN(C)N(C(=O)c1ccc2c(c1)C(=O)N(Cc1ccccc1)C2=O)[C@@H]1CCS(=O)(=O)C1	728178447	AURDVOXWKAHBMU-QGZVFWFLSA-N	441.509	1.589	50	20	IDGD	
COC(=O)c1ccc(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)cc1	728212821	GQRDGTRBBSPMNZ-UHFFFAOYSA-N	432.502	1.166	50	20	IDGD	
CC(C)(C)CC(=O)NNC(=O)NCc1ccccc1CS(=O)(=O)N1CCOCC1	728598882	VBVDGQPSTXQHRK-UHFFFAOYSA-N	426.539	1.115	50	20	IDGD	
COc1cccc([C@@H](C)N2CCN(CC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)CC2)c1	728930030	FINJGZSDJFSXFS-MRXNPFEDSA-N	441.488	1.743	50	20	IDGD	
O=C(NNC(=O)N1CCO[C@@H](c2ccccc2F)C1)C1CCN(c2ncccn2)CC1	728961439	HYOIGYMKCHEYQS-GOSISDBHSA-N	428.468	1.646	50	20	IDGD	
CC[C@H](NC(=O)NNC(=O)c1cccc2cccnc12)c1cccc(S(N)(=O)=O)c1	729227941	UUSNLNXYXSBDQR-KRWDZBQOSA-N	427.486	1.978	50	20	IDGD	
Cc1cccc(N2C(=O)N[C@H](CCC(=O)NNC(=O)c3nnc(O)c4ccccc34)C2=O)c1	730767745	KRTRJYFNRNJILO-MRXNPFEDSA-N	448.439	1.310	50	20	IDGD	
Cc1ccc(N2C(=O)/C(=C/NNC(=O)[C@@H]3CCS(=O)(=O)C3)c3ccccc3C2=O)cc1	730999602	ZYGKZMXAAZNOCD-IYSPOMMRSA-N	439.493	1.578	50	20	IDGD	
Cc1nc2c(cc1C(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)c(C)nn2C	732325222	ZGDXCLAHBFSZGX-UHFFFAOYSA-N	426.389	1.111	50	20	IDGD	
CN(CCNC(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1)C1CC1	732891583	ODTAXSOEQXSSKB-UHFFFAOYSA-N	434.504	1.427	50	20	IDGD	
CN(C)c1ncc(Br)cc1C(=O)OCC(=O)NNC(=O)c1cccs1	733604986	OGYJBHSVDYVTAD-UHFFFAOYSA-N	427.280	1.590	50	20	IDGD	
CCCC(=O)N1CCC[C@H]1C(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	734825221	WDHSPPJOJVAYRQ-HNNXBMFYSA-N	425.530	1.507	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)COc2ccc3c(c2)CCC3)CC1	735117999	MIPRZRLWTVNVDY-UHFFFAOYSA-N	445.545	1.029	50	20	IDGD	
COc1cc(OC)cc([C@H](O)CNC(=O)NNC(=O)c2cc(Br)c[nH]2)c1	735677406	FYOHKNAOCAECNV-CQSZACIVSA-N	427.255	1.472	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccccc1	737636677	BPCQUFNBTQNMNW-IBGZPJMESA-N	431.514	1.594	50	20	IDGD	
Cc1ccc(O[C@@H](C)C(=O)N2CCN([C@@H](C)C(=O)NNC(=O)CC(C)C)CC2)c(C)c1	738333434	VUXOZMAAYQZOJL-OALUTQOASA-N	432.565	1.797	50	20	IDGD	
Cc1noc(C)c1C[C@H](C)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	739049308	IJGXHHZNUYJVHG-ZDUSSCGKSA-N	449.533	1.651	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)C[C@@H](C)/N=C2/NS(=O)(=O)c3ccccc32)c(C)c1	743294931	BJIHQOSTJMFPAA-OAHLLOKOSA-N	443.529	1.380	50	20	IDGD	
Cc1cc(CN2C(=O)c3ccccc3C2=O)cc(C(=O)NNc2ncnc3[nH]cnc23)c1O	743471534	MHNDKPLFDBQKPU-UHFFFAOYSA-N	443.423	1.920	50	20	IDGD	
CCc1ccc(N2C[C@@H](C(=O)OCC(=O)NNC(=O)c3ccc(C#N)cc3)CC2=O)cc1	744497123	AQXQVKRABKMRCO-SFHVURJKSA-N	434.452	1.478	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)NC1CCN(CCc2ccccc2)CC1	745453378	KPRYFGMAOHEZRG-UHFFFAOYSA-N	427.461	1.952	50	20	IDGD	
CN(C)C(=O)CN1CCC(NC(=O)NNc2c(F)cc(F)cc2Br)CC1	745813082	XKDPCMKTUYUIFD-UHFFFAOYSA-N	434.285	1.906	50	20	IDGD	
CCOc1ccc(NS(=O)(=O)c2ccc(C(=O)NNC(=O)N3CCOCC3)cc2)cc1	745993071	WFHLGEXIELJJIH-UHFFFAOYSA-N	448.501	1.573	50	20	IDGD	
O=C(CCOc1ccccc1)NNC(=O)c1ccc(F)c(S(=O)(=O)Cc2ncon2)c1	746184869	IAQDRTUCBRHWQB-UHFFFAOYSA-N	448.432	1.413	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)[C@@H]1CN(Cc2nc(O)c3ccccc3n2)CCO1)c1ccccc1	746247806	PJSWIURTTGEREP-PXNSSMCTSA-N	449.511	1.877	50	20	IDGD	
CCS(=O)(=O)c1ccc(N2CCC(NC(=O)NNC(=O)CC(F)(F)F)CC2)cc1	746972644	LRHAAAGKGDNZCV-UHFFFAOYSA-N	436.456	1.732	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(-n2cnnn2)cc1)c1ccc(COc2ccccc2)o1	747406802	JSKJECLLOUFIOJ-UHFFFAOYSA-N	440.441	1.458	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)Nc2cnn(CC#N)c2)cc1	747434008	AZCCQBYFBYSDES-YBEGLDIGSA-N	444.455	1.700	50	20	IDGD	
CC[C@](C)(CNC(=O)OC(C)(C)C)C(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	747727221	JVJABYDIQLWGPE-OAQYLSRUSA-N	431.493	1.636	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)c1ccc(S(N)(=O)=O)s1	748603279	VUKYFLIUROHHCH-UHFFFAOYSA-N	432.549	1.229	50	20	IDGD	
CCc1cc(N2CCC(NC(=O)NNC(=O)Cc3nc4ccccc4n3C)CC2)ncn1	748662243	SACOWNBRHYBZOB-UHFFFAOYSA-N	436.520	1.468	50	20	IDGD	
O=C(Cn1cnc2ccccc21)NNC(=O)c1cc(S(=O)(=O)N2CCC2)ccc1Cl	748690013	VGFZPHIBCLHWNS-UHFFFAOYSA-N	447.904	1.545	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@](F)(C(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)C1	748867107	VGKAOTKDIJFZRE-GOSISDBHSA-N	444.485	1.592	50	20	IDGD	
NC(=O)c1c[nH]c(C(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)c1	749334910	HEPAAVGNIOFREH-UHFFFAOYSA-N	433.471	1.051	50	20	IDGD	
CS(=O)(=O)Cc1ccccc1CNC(=O)NNC(=O)c1cnn(-c2ccccc2)c1	749586825	OJCZWKRAEPFABV-UHFFFAOYSA-N	427.486	1.561	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)CNC(=O)OC(C)(C)C	749867638	BYZJAFHIAOAOCX-GFCCVEGCSA-N	428.511	1.195	50	20	IDGD	
COc1ccccc1N1CC[C@@H](CNC(=O)NNC(=O)c2nnc(O)c3ccccc23)C1	750331706	WYSDZSXUPGKJBZ-AWEZNQCLSA-N	436.472	1.815	50	20	IDGD	
CC(C)(C)C(=O)Nc1ccc(S(=O)(=O)NNC(=O)CNC(=O)c2cccs2)cc1	751279569	LTZKLBRIPORQSB-UHFFFAOYSA-N	438.531	1.472	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2cccnc2SC(F)F)ccc1Cl	751391198	HKDWNOYQEIRTCW-UHFFFAOYSA-N	436.849	1.772	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCc1ccc(C(N)=O)nc1	753952774	BNDJXOLZXGOGHF-JTQLQIEISA-N	436.266	1.241	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1S(=O)(=O)N(C)C	755391867	FAKTVNAWEWSJLW-INIZCTEOSA-N	434.474	1.238	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)Nc1nnc(Cc2ccccc2)s1	755408690	OHEMQAPHKCHQDD-UHFFFAOYSA-N	438.517	1.988	50	20	IDGD	
CC(C)n1nc(C(=O)NN=Cc2cnc(N3CCN(C)CC3)nc2)c2ccccc2c1=O	755547553	YQPROXDZEYJCLJ-UHFFFAOYSA-N	434.504	1.283	50	20	IDGD	
CCOC(=O)c1cc2cc(NC(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)ccc2s1	755862231	OTNWFHPXEUIPRX-VIFPVBQESA-N	428.492	1.168	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)Nc1cnn(-c2ccccc2S(C)(=O)=O)c1	756705524	KZLDFTSILKRFCI-UHFFFAOYSA-N	443.485	1.680	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)Nc1cc(C(=O)OC)c(F)cc1Br	756741876	YDXPCGXKEMMRFC-MRVPVSSYSA-N	436.234	1.579	50	20	IDGD	
COC(=O)[C@@H](C)Oc1ccc(C=NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1	758368609	YWSUKGWQPQQCAK-CQSZACIVSA-N	433.486	1.641	50	20	IDGD	
O=C(NNC(=O)c1ccn(-c2cccc(Br)c2)n1)C(=O)Nc1ccccn1	758834583	RFJQADAFOYOJCZ-UHFFFAOYSA-N	429.234	1.430	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cnn(-c3cccnc3)c2)c1	759679937	XIUMSRWWSWGTNH-UHFFFAOYSA-N	442.501	1.373	50	20	IDGD	
CSCCNC(=S)NNC(=O)C1=NOC2(CCN(C(=O)OC(C)(C)C)CC2)C1	760481960	BMJXLBUCDGLESF-UHFFFAOYSA-N	431.584	1.391	50	20	IDGD	
CCOC(=O)c1cc(S(=O)(=O)NNC(=O)c2ccc(Br)s2)cn1C	760508491	COSQXLQQGBHDDH-UHFFFAOYSA-N	436.309	1.649	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NCCOc1ccc(C(F)(F)F)cn1	760749920	IFUGCDCDETYGHD-UHFFFAOYSA-N	431.396	1.301	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)c1cccc(C2OCCO2)c1	763385932	JKWZUOHXJQUWMT-UHFFFAOYSA-N	445.497	1.591	50	20	IDGD	
CC(C)(C)c1ccc(OCC(=O)NNC(=O)C(=O)Nc2cnn(C[C@@H]3CCCO3)c2)cc1	763594058	GBJAQAVEOFBFTC-SFHVURJKSA-N	443.504	1.525	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)COc2ccc(C(C)(C)C)cc2)cn1C	763601390	YJGQILOXQMXTAP-UHFFFAOYSA-N	430.461	1.274	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2ccc(C)c(S(C)(=O)=O)c2)c1	763647152	KHSIGIXDNSIWLQ-UHFFFAOYSA-N	433.486	1.180	50	20	IDGD	
CCNS(=O)(=O)c1ccc(CNC(=O)NNC(=O)CCc2ccc(OC)cc2)cc1	763655497	SFODOBAQVGAAHS-UHFFFAOYSA-N	434.518	1.457	50	20	IDGD	
O=C(CN1CCCc2ccccc21)NNC(=O)C(=O)Nc1cc2c(cc1F)CCC(=O)N2	763745996	NGCJQZGPIXRJFN-UHFFFAOYSA-N	439.447	1.249	50	20	IDGD	
COC(=O)[C@@H](C)Cc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(N(C)C)c2)cc1	763760206	HCVQVDARWQEZEY-AWEZNQCLSA-N	426.473	1.504	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2nnc(O)c3ccccc23)n(-c2ccccc2C)n1	763790239	HMTLJZRJHJXPMI-UHFFFAOYSA-N	445.439	1.538	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)C(=O)Nc2ccccc2C(F)(F)F)c2ccccc2c1=O	763790501	JIRRCECTFXCTQI-UHFFFAOYSA-N	433.346	1.352	50	20	IDGD	
CCOC(=O)c1cc(F)c(F)cc1NC(=O)C(=O)NNC(=O)COc1ccc(C)cc1	763822137	WGDYMOCXQYRMGZ-UHFFFAOYSA-N	435.383	1.615	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)ccc1-n1cnnn1	763840063	HYAWZNBGLWTRMZ-OAHLLOKOSA-N	437.460	1.141	50	20	IDGD	
COc1ccc(OC(F)F)c(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)c1	763840591	VGIVPCXCVXVVPI-UHFFFAOYSA-N	427.335	1.601	50	20	IDGD	
CCc1c(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(C(C)=O)cc2)cnn1CC(C)C	763875885	BMJIJFBQWUBPCB-OAHLLOKOSA-N	443.504	1.858	50	20	IDGD	
CCNC(=O)COc1cccc(NC(=O)C(=O)NNC(=O)CSc2ccc(C)cc2)c1	763896618	PFSSFLQELHDZOW-UHFFFAOYSA-N	444.513	1.388	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3cnn(-c4ncccc4C#N)c3)cc2C1	763943109	RBBKLRLKJHXTKK-GFCCVEGCSA-N	449.496	1.725	50	20	IDGD	
CCCCn1ncc(NC(=O)C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)c1C	763949688	QYIKHXYZPHYNFR-UHFFFAOYSA-N	425.449	1.283	50	20	IDGD	
CCOC(=O)c1cc(C)sc1NC(=O)C(=O)NNC(=O)c1ccc2c(c1)OCCO2	764003361	CEJQLTUOOFFGIU-UHFFFAOYSA-N	433.442	1.404	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cccc(Br)c2)ccc1-n1cnnn1	764059266	QDLCPIXWLRPLDY-UHFFFAOYSA-N	444.249	1.133	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccccc2CN2CCSCC2)c1O	764130367	FVLCHJMHZNKCNG-UHFFFAOYSA-N	444.513	1.349	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccc(NC(=O)[C@@H]2CCCO2)cc1	764130441	IAKCERLKBXRESP-SFHVURJKSA-N	440.456	1.141	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2O1)C(=O)Nc1cc(F)c(N2CCCC2)c(F)c1	764164481	QBVJEDULTTXJJI-QGZVFWFLSA-N	430.411	1.655	50	20	IDGD	
Cc1ccc(-c2nc3cc(F)ccc3n2C)cc1NC(=O)C(=O)NNC(=O)CN(C)C	764210389	CZGFBUOAXVIYRD-UHFFFAOYSA-N	426.452	1.335	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)ccc1O)C(=O)Nc1ccn(-c2ccncc2)n1	764280392	OBNUJTNUERYNGS-UHFFFAOYSA-N	445.233	1.135	50	20	IDGD	
CCOc1cc2c(cc1NC(=O)C(=O)NNC(=O)COc1ccccc1O)O[C@@H](C)C2	764280591	QCDDHGSFNKPEPS-LBPRGKRZSA-N	429.429	1.279	50	20	IDGD	
CC(C)(C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)C(=O)N(CC1CC1)C2=O)c1ccccc1	764302577	NVXAFQFOLGZUTP-UHFFFAOYSA-N	448.479	1.756	50	20	IDGD	
COCCOC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)Cc2ccccc2F)c1	764321326	VEGRBLRYYVUXIK-UHFFFAOYSA-N	432.408	1.349	50	20	IDGD	
CCc1noc(-c2ccc(C)c(NC(=O)C(=O)NNC(=O)COCc3ccccc3)c2)n1	764367192	JTJIGOGTMDNRAF-UHFFFAOYSA-N	437.456	1.910	50	20	IDGD	
Cc1ccc([C@@H](C)[C@@H](O)C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)cc1	765198231	KZNFHTLSJLQZLA-DYESRHJHSA-N	446.573	1.539	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)cc1F	765463248	DAZOTMVZKNUHNI-UHFFFAOYSA-N	449.508	1.477	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C2CCN(S(=O)(=O)c3c(C)c(C)cc(C)c3C)CC2)n[nH]1	765582597	DEXUZRFHNUUXQB-UHFFFAOYSA-N	447.561	1.814	50	20	IDGD	
COc1ccc(N2C[C@H](C(=O)NNC(=O)c3cc(-c4ccccc4OC)[nH]n3)CC2=O)cc1	765598814	AHWJMSGEGSJVMN-CQSZACIVSA-N	449.467	1.908	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1)c1ccc(N2CCCS2(=O)=O)cc1	765618041	HLRBVJVMKOLSMM-UHFFFAOYSA-N	443.460	1.831	50	20	IDGD	
NC(=O)C1CCN(c2ncccc2CNC(=O)NNc2ncnc3ccsc23)CC1	765751078	JHFORHJPJSXAIL-UHFFFAOYSA-N	426.506	1.614	50	20	IDGD	
O=C(CNC(=O)C1CCCCC1)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	765758971	ROCXCORJAOSRHE-UHFFFAOYSA-N	449.983	1.302	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)C[C@H]3C(=O)Nc4ccccc43)CC2)cc1	766648915	LRVGWRJIUQKKQQ-HXUWFJFHSA-N	435.528	1.386	50	20	IDGD	
COc1cc2c(cc1OC)CN(C(=O)CCC(=O)NNC(=S)NCCSC)CC2	770240220	NXBFORLGTZZAFG-UHFFFAOYSA-N	440.591	1.227	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)NCCc3nc(-c4cccc(Cl)c4)no3)nc21	770394458	CJCHFGLKPHWTAD-UHFFFAOYSA-N	429.828	1.641	50	20	IDGD	
COc1cc(C=NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)ccc1[N+](=O)[O-]	770599648	XANFZDQLFAFQCF-UHFFFAOYSA-N	448.457	1.388	50	20	IDGD	
C[C@H](C(=O)NNc1nc(O)c2cnn(C(C)(C)C)c2n1)N1C(=O)[C@@H]2CCCC[C@H]2C1=O	770958039	GWCIWSCMGRKBHC-IJLUTSLNSA-N	429.481	1.294	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)CCc2nc(-c3ccccn3)no2)C1	773421085	QVOIRUAPPJFVOD-AWEZNQCLSA-N	444.492	1.859	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)ncc1Br	773544909	FVYHGGLDYTWEII-UHFFFAOYSA-N	443.204	1.910	50	20	IDGD	
N#Cc1cccc(NNC(=O)C(=O)Nc2cccc(Cn3nc4ccccn4c3=O)c2)c1	773688914	RDDFPKCZJFLFHW-UHFFFAOYSA-N	427.424	1.498	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NNc2cccc(S(C)(=O)=O)c2)cc1	776530283	UYYVNFXSIUCAPH-SFHVURJKSA-N	437.543	1.695	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)N[C@H]1CCN(c2ccc(F)c(Cl)c2)C1	778641532	RMXNECODCCJCED-NSHDSACASA-N	439.900	1.880	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCc2cccc(C(F)(F)F)c2)cc1-n1cnnn1	781684777	SYDGRYVGUKQQCO-UHFFFAOYSA-N	435.366	1.834	50	20	IDGD	
Cc1n[nH]cc1-c1nnc(NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)s1	782093706	WTBMXQIPBKCAQR-UHFFFAOYSA-N	428.482	1.096	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)Cc3ccn(C)n3)c2)c(C)c1	782550122	YDONMEIWHGSFIN-UHFFFAOYSA-N	441.513	1.841	50	20	IDGD	
Cc1cc(Br)cc(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)c1	782886956	MKNSGSINHIIXFH-UHFFFAOYSA-N	444.289	1.973	50	20	IDGD	
O=C(NNc1ccc(-n2cccn2)nn1)C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F	783437312	WYSFIQBPYPCPPV-UHFFFAOYSA-N	434.319	1.254	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)C2(Cc3ccc(F)cc3)CC2)ccc1Cl	783511618	RMCIQTUYUDFIMM-UHFFFAOYSA-N	425.869	1.910	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1ccc(N2CCCC2)c(Cl)c1	784004193	BWFFGWJKNLPNJK-UHFFFAOYSA-N	449.920	1.518	50	20	IDGD	
Cc1c(NNC(=O)C(=O)Nc2cccc(N3C(=O)CN(C)C3=O)c2)cccc1[N+](=O)[O-]	784353007	PDJRZTTWFRDCMN-UHFFFAOYSA-N	426.389	1.383	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H]2CN(CC(=O)NNC(=O)c3ccc(C#N)cc3)C[C@H]21	784503835	FRQUIWDNWHWIHW-GUDVDZBRSA-N	441.532	1.944	50	20	IDGD	
O=C(NNc1ccccc1Cl)C(=O)Nc1ccccc1OCC(=O)N1CCOCC1	784775772	YPFRKBNHBVGLHQ-UHFFFAOYSA-N	432.864	1.659	50	20	IDGD	
Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)NNC(=O)CNC(=O)c1cccs1	786053305	DQJADNFKUFCHCP-UHFFFAOYSA-N	441.263	1.918	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cnn(-c3ccc(F)cc3)n2)cc1OC	786145167	OXUPLPDVQOIWTC-UHFFFAOYSA-N	443.391	1.042	50	20	IDGD	
C[C@@H]1[C@H](C(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)CCN1C(=O)OC(C)(C)C	786250210	OHDAORQBMFELHR-IUODEOHRSA-N	440.522	1.888	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ccc(C#N)cc2)cc1S(=O)(=O)N1CCCC1	787556134	SVGWCWXLCHWTPW-UHFFFAOYSA-N	443.485	1.433	50	20	IDGD	
CC(C)(C)OC(=O)N1CC2(C[C@@H]2C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)C1	789292689	MRYCWJMAINMKRG-CQSZACIVSA-N	448.432	1.156	50	20	IDGD	
CNS(=O)(=O)c1ccc(C)c(NC(=O)C(=O)NNc2ccc(Cl)c(OC)c2)c1	789796239	PEQVQBUXCYVJRG-UHFFFAOYSA-N	426.882	1.647	50	20	IDGD	
COc1ccc(NCC(=O)NN=C[C@H]2CCCN(C(=O)CNC(=O)OC(C)(C)C)C2)cc1	794464913	QBNWYPRTMGTCCT-MRXNPFEDSA-N	447.536	1.972	50	20	IDGD	
CC[C@H](C)[C@H](NC(C)=O)C(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	794767834	ORXGTHOGGXHPTD-YWZLYKJASA-N	449.511	1.757	50	20	IDGD	
CO[C@H](CNC(=O)OC(C)(C)C)CC(=O)NNc1ccccc1S(=O)(=O)N(C)C	795169275	LCTTXQOOLBVLNQ-ZDUSSCGKSA-N	430.527	1.310	50	20	IDGD	
C[C@H]1CN(c2ccc(C(=O)NNc3ccccc3S(=O)(=O)N(C)C)cn2)C[C@H](C)O1	795177588	NDQAHGLOJMZFDK-GJZGRUSLSA-N	433.534	1.702	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCCC[C@H]2COC(=O)NC(C)C)cc1OC	796705193	DCBSJPRRMWGHIN-INIZCTEOSA-N	436.509	1.454	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc3c2CCO3)cc1Br	797000382	AKLMZVRRROUYIL-UHFFFAOYSA-N	434.246	1.792	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)[C@H]2CC(C(=O)OC(C)(C)C)=NO2)c2ccccc2c1=O	798272773	FVCFNBGXVLSEHQ-OAHLLOKOSA-N	443.460	1.054	50	20	IDGD	
CCCCCn1nc(C(=O)NNS(=O)(=O)c2cncc(OC)c2)c2ccccc2c1=O	799120849	SEECUTLTWXYURI-UHFFFAOYSA-N	445.501	1.614	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NN=C3CCCC34CCOCC4)CC2)cc1	799882938	JWIGMFCUJMNUHK-UHFFFAOYSA-N	448.589	1.754	50	20	IDGD	
CCCn1nc(C(=O)NNS(=O)(=O)c2cccc3c2OCO3)c2ccccc2c1=O	800831723	ZBOGYLWZMVETTA-UHFFFAOYSA-N	430.442	1.159	50	20	IDGD	
C[C@](O)(CCc1ccccc1)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	801102399	PNDFAFLGJGDWSW-QFIPXVFZSA-N	445.541	1.616	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)c1nccn1-c1ccccc1	805068870	SMRYPGYMWJBDRX-MRXNPFEDSA-N	434.504	1.970	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)N(C)CC(=O)NNc2nccnc2C2CCC2)cc1	805469350	LKNSYDQRZLSORA-UHFFFAOYSA-N	432.506	1.466	50	20	IDGD	
CN(C)S(=O)(=O)C[C@H](NC(=O)NNC(=O)Cc1ccc(Cl)cc1)C(F)(F)F	805769094	JTJQAVSMTFCSSO-NSHDSACASA-N	430.836	1.035	50	20	IDGD	
COC(=O)c1cc(C)c(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)c(Cl)c1	806972942	SMFHPHRJQMTRSQ-UHFFFAOYSA-N	433.804	1.563	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)C(=O)Nc2cc(Cl)cc3c2OCC(=O)N3)cc1	806974442	ASSCTKRPVBBVNR-UHFFFAOYSA-N	448.888	1.858	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)Nc1ccc2c(c1)C(=O)N(CC1CC1)C2=O	808831111	YZNIAPDGEQATTL-UHFFFAOYSA-N	436.424	1.930	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cccnc2)c(C(=O)NCC(F)(F)F)cc1F	810385605	VOFRGCUSZYTWPY-UHFFFAOYSA-N	441.341	1.221	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)C(=O)Nc2ccc(C#N)c(F)c2)c2ccccc2c1=O	810386243	RIOMIWBIEBTYBA-UHFFFAOYSA-N	436.403	1.388	50	20	IDGD	
NS(=O)(=O)c1ccc(C=NNC(=O)CN2c3cccc4cccc(c34)S2(=O)=O)cc1	811635940	REXRVCWQJAWFGX-UHFFFAOYSA-N	444.494	1.146	50	20	IDGD	
CC(=NNC(=O)Cc1csc(N2CCOCC2)n1)c1cccc(N2CCOCC2)c1	812447467	LVZISTPFMGDRBF-UHFFFAOYSA-N	429.546	1.899	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)F)cc1)C(=O)N1CCN(c2ccccc2)CC1	812500545	ZIRVICKVRMZPEB-UHFFFAOYSA-N	438.456	1.475	50	20	IDGD	
CCOC(=O)c1ccc(NNC(=O)C2=NN(c3ccc(F)cc3)[C@H](C(N)=O)C2)cc1C	812717373	ZQOGCBZEMCHIAE-SFHVURJKSA-N	427.436	1.874	50	20	IDGD	
COC(=O)c1n[nH]c2ccc(NC(=O)NNc3ccc(S(=O)(=O)N(C)C)cc3)cc12	812941432	IEQOZVODGLTLCU-UHFFFAOYSA-N	432.462	1.748	50	20	IDGD	
O=C1CN(Cc2cccc(NC(=O)C(=O)NNc3ncc(Cl)cc3Cl)c2)CCN1	812981109	MELTUMWIZRHOFV-UHFFFAOYSA-N	437.287	1.402	50	20	IDGD	
CCCc1nnc(SCC(=O)NNC(=O)c2cc(C)n(-c3ccccc3)c2C)n1N	813364221	KKDNSALAYMHFKF-UHFFFAOYSA-N	427.534	1.905	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)[C@H](Cc1cnc[nH]1)NC(=O)CC(C)C	813366485	SSZSNWITBQUVAU-KRWDZBQOSA-N	439.520	1.243	50	20	IDGD	
COCc1cc(C(=O)OC)cc(S(=O)(=O)NNC(=O)CSc2ccccc2O)c1	813686548	JAMJBIZNCYMNRR-UHFFFAOYSA-N	440.499	1.427	50	20	IDGD	
COC(=O)[C@]1(c2ccccc2)CCN(C(=O)NNC(=O)c2ccc(OC)cc2OC)C1	814298462	JWSMOZJQUQJFEU-JOCHJYFZSA-N	427.457	1.875	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)[C@H]2CCCCN2C2CCCC2)cc1OC	815447225	NZAHREITMVMSPB-QGZVFWFLSA-N	433.505	1.805	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cc(C)c3nccn3c2)cc(OC)c1OC	815563452	CIMNYNKRXSNKEE-UHFFFAOYSA-N	427.417	1.068	50	20	IDGD	
Cc1cc(OCc2ccccc2)ccc1NC(=O)C(=O)NNC(=O)[C@@H]1CCc2nncn2C1	815691207	IJKMABJGQPSUND-QGZVFWFLSA-N	448.483	1.514	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1NC(=O)C(=O)NNC(=O)[C@H]1CCc2nncn2C1	815692081	IUSLLUXNZAPGBP-ZDUSSCGKSA-N	425.474	1.059	50	20	IDGD	
Cn1c(=O)n(CC(=O)NNC(=O)[C@H]2CCCN(C(=O)OC(C)(C)C)C2)c2ccccc21	816509549	UVYBKHJCKDKDET-AWEZNQCLSA-N	431.493	1.135	50	20	IDGD	
COc1cccc(/C=C(\C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)n2nnnc2C)c1	818029922	RAQBBODCIUYGKP-HTMJNSLASA-N	440.435	1.742	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)N2CCC(n3cnc(C(N)=O)c3N)CC2)c1C	819680893	RWEWQHHSNDQPCJ-GZTJUZNOSA-N	439.520	1.400	50	20	IDGD	
O=C(COC(=O)c1ccc2c(=O)n3c(nc2c1)CCC3)NNC(=O)c1cccc(Cl)c1	849183861	WZFHNISJMUGSFX-UHFFFAOYSA-N	440.843	1.614	50	20	IDGD	
CCc1nnsc1C(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	849208754	RXBVZNRADBVLBA-UHFFFAOYSA-N	434.485	1.877	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccccc1)[C@H]1COc2ccccc2O1	859440156	GJKHMQJRQOPZCI-VQIMIIECSA-N	445.497	1.217	50	20	IDGD	
N#Cc1ccc(-c2ccc(OCC(=O)NNC(=O)Cn3nc4ccccn4c3=O)cc2)cc1	889017556	WRRVVXAVSIXCKR-UHFFFAOYSA-N	442.435	1.261	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)c2cc(-c3ccco3)nc3c(C(N)=O)ncn23)c1	913081832	IFIBUQNQBCOODW-UHFFFAOYSA-N	433.428	1.229	50	20	IDGD	
CN(C)c1nc(N)nc(COC(=O)/C(C#N)=C/c2cn(CCC#N)nc2-c2ccccc2)n1	913215944	DZZPVDITAYEKCU-LFIBNONCSA-N	443.471	1.947	50	20	IDGD	
O=C(NN=Cc1cnc(N2CCCC2)nc1)c1ccc(S(=O)(=O)N2CCCC2)cc1	914771760	DQPUFGQCECMDPB-UHFFFAOYSA-N	428.518	1.625	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)Cc2ccc(C(=O)NNC(=O)c3cn[nH]c3)cc2)cc1	916145032	KTLOBQHCZJLNCX-UHFFFAOYSA-N	427.486	1.614	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NCc2nnc3ccc(C(F)(F)F)cn23)cc1	916222702	LTMPYBJGPDTMLL-UHFFFAOYSA-N	438.366	1.666	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)NCc2ccc(N3CCO[C@@H](C)C3)nc2)cc1OC	916392512	ABAORYVQENCQGK-HNNXBMFYSA-N	443.504	1.858	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2cccnc2OC2CCCC2)c1	916395545	SVFZECCHMCYQMF-UHFFFAOYSA-N	432.502	1.951	50	20	IDGD	
CCS(=O)(=O)N(C)CCCNC(=O)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1	916580360	RHUBZQYBZRQJJF-UHFFFAOYSA-N	446.473	1.278	50	20	IDGD	
CSCC[C@H](NC(=O)c1ccccc1)C(=O)NNC(=O)CCN1C[C@@H](C)O[C@H](C)C1	917362877	PPFGXNIUCYHYLZ-NUJGCVRESA-N	436.578	1.185	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)Cc1c(C)nc(-c2cccnc2)nc1O	918199957	KJVYOMDYRLXONY-UHFFFAOYSA-N	437.456	1.720	50	20	IDGD	
Cc1[nH]nc(C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)c1Br	919692262	KCXUMUXJDGQOEV-UHFFFAOYSA-N	433.266	1.846	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)c1cccc(S(=O)(=O)NC[C@@H]2CCCO2)c1	919820318	SMEYOMRSSCHPCD-KRWDZBQOSA-N	447.513	1.156	50	20	IDGD	
Cc1ccc(-c2nn(CCC#N)cc2C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)cc1C	920852786	WEBBJVNUQBUCQW-MRXNPFEDSA-N	429.502	1.276	50	20	IDGD	
CSCC[C@H](C(=O)NNc1nncc(N)c1Cl)N1C(=O)[C@H]2CCCC[C@H]2C1=O	1116297422	MXBJDHLKAYFDLT-JFGNBEQYSA-N	426.930	1.452	50	20	IDGD	
CCCCn1c(CCC(=O)NNc2ccn(C)n2)nc2cc(S(=O)(=O)N(C)C)ccc21	1116837602	IIMIREJSFCCVOD-UHFFFAOYSA-N	447.565	1.896	50	20	IDGD	
CN(CC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)Cc1ccccc1	1318005095	DKCZUWIYFYTIRQ-UHFFFAOYSA-N	430.530	1.364	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccccc1F)NNC(=O)c1cncn1-c1ccccc1	1321491006	LEBVQHPRDAJWJO-UHFFFAOYSA-N	431.449	1.141	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)c2cc(CN(C)C)on2)c2ccccc2c1=O	1341602809	CSBJOLSKIXAWPW-UHFFFAOYSA-N	426.477	1.711	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1)NC(=O)OC(C)(C)C	1344378466	QVBWWMKSWPNBAY-CYBMUJFWSA-N	443.545	1.877	50	20	IDGD	
O=C1Nc2c(cccc2C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](F)Cl)C2)C1=O	1778025413	ALIWFNCTPVKQIB-OWDMVUQNSA-N	437.855	1.483	50	20	IDGD	
N[C@@H](Cc1cccnc1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(Cl)Cl)C2	1778056645	QJHNAKHNYFRSQJ-QMTMVMCOSA-N	429.348	1.269	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(CCN(C(=O)c3ccnc4c3OCO4)C2)C1	1780031809	PSGWMWDLKNXKNN-KRWDZBQOSA-N	426.267	1.039	50	20	IDGD	
N#Cc1ccc(F)c(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)c1	1781331925	BGCOKXLWPYHOOT-RHSMWYFYSA-N	428.233	1.831	50	20	IDGD	
O=C(c1cc2ccoc2cn1)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781334566	YOUQLDGKDQCFEK-YOEHRIQHSA-N	426.242	1.962	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@](C)(O)C(F)(F)F)C2	1782172035	LQAXKEBLXCNHJT-SHUKQUCYSA-N	430.851	1.067	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc3ncccn3n1)C2)C(Cl)Cl	1782218067	PRSJHGXGOSCOAT-FZKQIMNGSA-N	426.304	1.661	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(CCN(C(=O)c3n[nH]c4cccc(F)c34)C2)C1	1782479412	DDGBSDPGDSCXKF-GOSISDBHSA-N	439.285	1.931	50	20	IDGD	
COc1cc(Cl)ccc1CC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1782897739	SDVUYDCVEFLBJU-DNVCBOLYSA-N	431.316	1.321	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)CC3CCN(C)CC3)CCO2)C1	1783339556	SYBGEFRAJHUZGK-APWZRJJASA-N	430.387	1.722	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H]1COc3ccccc3O1)CCO2	1783530292	WLGKEXBEQVRPHD-IYJAJMOOSA-N	439.306	1.440	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3nn(C)c4c3CCC4)CCO2)C1	1783533626	CHMAJKLJVNJOFN-KPZWWZAWSA-N	425.327	1.136	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](C)Br)C3)C2)nn1C(F)F	1783539227	ZIYRELXQRPCQLA-MEDUHNTESA-N	435.269	1.814	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](C)Sc1ccccn1)CCO2	1783879938	ZXQYTYKZYLMHJA-VCBZYWHSSA-N	427.954	1.646	50	20	IDGD	
C[C@H](Cc1ccc(F)cc1)C(=O)N1CCO[C@@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1	1783937008	MUYKLIDKCONHBO-UZUQRXQVSA-N	448.539	1.207	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](C)n3cc(C)cn3)C2)C1	1784451824	NRNYQZAGOIVRQJ-RLFYNMQTSA-N	427.343	1.756	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)COc3cccnc3)[C@H]2C1	1785146606	FQOQCXQGXYNGHY-QBWPOKONSA-N	430.332	1.676	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)N1CC[C@]2(CN(C(=O)CCBr)CCO2)C1	1785336902	BCYFSAAGDPDFMB-GOSISDBHSA-N	448.358	1.516	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CNc4ccccc43)C[C@@H]21	1786406084	QIYSQKUWPVPBDE-DNMXQMFDSA-N	436.350	1.960	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)c1c[nH]c2nccc-2c1	1787330445	AVWAVCQDVIZXKP-BPUTZDHNSA-N	435.322	1.893	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(Cl)c4nncn4c3)C[C@@H]21)[C@H](F)Cl	1787446305	CBFMTEFZAIQWTL-RETIQXCHSA-N	430.267	1.510	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CCC[C@@H]3C)C[C@@H]21	1787508377	HJFBPIZKGFCFNN-KJYUKMNNSA-N	443.548	1.536	50	20	IDGD	
C[C@@H](Br)C(=O)NC1(c2ccc(NC(=O)CC[C@@H](N)C(N)=O)cc2)CCC1	1788058821	HPLHDFDYGYQUSR-BXUZGUMPSA-N	425.327	1.497	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)c1cn2ccc(Cl)cc2n1	1788080510	CZWCKZPYKCXNJG-MZGVZZPPSA-N	441.315	1.181	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3noc4c3CCCC4)C[C@@H]21	1788765221	VSJAMHAXCVTWPU-ZVZYQTTQSA-N	435.597	1.998	50	20	IDGD	
Cc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Br)C[C@@H]32)c(O)n1	1789311024	NSCKWGPQHWTGDB-PYJNHQTQSA-N	430.274	1.379	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CCC[C@@H](C(=O)OC)C3)C[C@@H]21	1789864420	BTUWBMOUGOWDAW-COZGXFGHSA-N	428.957	1.963	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)Nc1ccc(C2(NC(=O)CC[C@H](N)C(N)=O)CCC2)cc1	1790492566	JLIBPOQBLQHISX-KBXCAEBGSA-N	429.348	1.950	50	20	IDGD	
CC(C)=NO[C@@H](C)C(=O)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1	1790564723	MWXMMIXLDXDKQY-INIZCTEOSA-N	437.305	1.915	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21)c1cnc2c(c1)CCNCC2	1790620756	JLWBVAHTCKGJIF-QRTARXTBSA-N	441.359	1.167	50	20	IDGD	
CN1CCCn2nc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]4C3)cc2C1	1791296222	NRENUULUQULTNG-NOLJZWGESA-N	444.363	1.116	50	20	IDGD	
C#CCCCCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C[C@@H]21	1791439857	ZUGHOKORULPNQQ-RWRPXTCXSA-N	441.532	1.294	50	20	IDGD	
Cc1nccn1CCCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)Br)C[C@@H]21	1791571804	CDEJFMAXHOCHTG-HJWJTTGWSA-N	441.370	1.735	50	20	IDGD	
O=C(/C=C/c1cnccn1)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1	1791925062	WXYZDFVTLNAKQO-MDZDMXLPSA-N	442.284	1.618	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C=C/c3ccc(O)c(O)c3O)[C@H]2C1	1792218145	RMPWYRWFIZKBQR-AIMMBMPESA-N	438.908	1.814	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1(c2cccc(F)c2)CC1	1794034875	MDHJFGZJGYNTIT-REPLKXPHSA-N	430.524	1.869	50	20	IDGD	
N[C@@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2)c1cccc(Cl)c1	1795624980	IIUCVTBGRIHPTF-DLTLXFJOSA-N	444.757	1.714	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2cnccc2n1	1796891694	OPNTVKVRPHIQQF-FRQROOTJSA-N	447.333	1.864	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccn(C(C)C)n1)C2	1796891972	SAYKPPRMZAOKSG-GSWMANSFSA-N	439.520	1.850	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1occc1Br)c1cccc(B(O)O)c1	1797008271	DGMBPNZSVPKVOP-QDMKHBRRSA-N	447.094	1.288	50	20	IDGD	
O=C(CS[C@@H]1CCCCO1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2	1797799847	TVBLRNPXZPUDSP-OBRUSBNWSA-N	439.347	1.526	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCCC(F)(F)F)C2	1798439527	FVBQSFSJOITRIA-CLLJXQQHSA-N	427.427	1.670	50	20	IDGD	
Cc1cc(F)c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)cc1F	1798443718	YURAKLJFACZFKX-BTTYYORXSA-N	443.454	1.837	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(C)nc1O	1798657328	WWBPEELLZQSGNT-AYRXBEOTSA-N	426.311	1.472	50	20	IDGD	
CC(C)(C)n1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@](C)(Cl)CCl)C3)nn1	1798708016	CAQUVLFBWXNDPC-AZGFTEDZSA-N	432.352	1.473	50	20	IDGD	
Cc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Br)n(C(F)F)n1	1799348912	RXHNUNKWAYRZHE-RBLKWDMZSA-N	439.232	1.480	50	20	IDGD	
CC(C)Oc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](O)CCl)C3)c(F)c1	1799804069	XZHRLDMAKCZWIZ-JGTCGTHISA-N	428.888	1.416	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2)[C@H]1C[C@@]12C(=O)Nc1ccccc12	1800737624	YXDRKXWUBLSJBA-FTJMNEKSSA-N	438.311	1.290	50	20	IDGD	
C[C@@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1nc3ccccc3n(C)c1=O)C2	1801962522	MWVHOFSRILMMCJ-YIYPIFLZSA-N	447.333	1.969	50	20	IDGD	
C=C1CC(C(=O)NC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)C1	1802414398	ORUCXGKKDHQMPL-OXJNMPFZSA-N	434.500	1.366	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)NC=O)[C@@H]1c1cccnc1	1803016020	WGHCIQIAORITAM-LUYZLQTOSA-N	425.327	1.253	50	20	IDGD	
Cn1ncc(C(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)c1Cl	1803140378	FBQLKIXVRPHPOC-VHDGCEQUSA-N	426.304	1.388	50	20	IDGD	
O=C1Cc2cc(C(=O)N3CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]3c3cccnc3)ccc2N1	1803143234	XMINEGIZZKLBSY-XFQXTVEOSA-N	442.903	1.496	50	20	IDGD	
C[C@@H]1[C@@H](C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](O)CCl)C3)CCN1C(=O)OC(C)(C)C	1804630017	CJJBSWCOZHZTBA-JHMPBIJASA-N	443.972	1.870	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)c2ccc[n+]([O-])c2)[C@H]1c1cccnc1	1804781708	CRVGHDQGKXNSFI-JLJPHGGASA-N	433.306	1.818	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC2(CCCN(C(=O)C3CC(F)(F)C3)C2)CC1	1805000136	FFLDTXVSZMZTII-UHFFFAOYSA-N	435.475	1.575	50	20	IDGD	
Cc1cc(C(=O)NC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)on1	1805709729	QRWODURLNRORHK-OXJNMPFZSA-N	428.493	1.071	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC2(CCCN(C(=O)[C@@H](C)CS(C)(=O)=O)C2)CC1	1806047654	NWFIFZMLRSUPBW-KBPBESRZSA-N	437.400	1.682	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@H]1CCN(C(=O)Cn2cnnn2)[C@H]1c1cccnc1	1808294741	CEDYKVBHKZZTJJ-KMFMINBZSA-N	426.308	1.010	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1CCN(C(=O)[C@H]2CCNC(=O)C2)[C@@H]1c1cccnc1	1810548119	OMYFIAZGIDHXSG-RIFZZMRRSA-N	432.597	1.465	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)/C=C/c2ccco2)[C@@H]1c1cccnc1	1813070677	KTSPDBMNSWYMDO-LOVSVLDDSA-N	439.516	1.767	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2ccn(C)c2)[C@@H]1c1cccnc1	1813070787	LXFFIUGCHFSGGY-DYESRHJHSA-N	426.521	1.113	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)C(Cl)Cl)[C@H]1c1cccnc1	1813073958	MOWPDNHTKDOSRF-CJNGLKHVSA-N	430.336	1.264	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)C1CC(F)(F)C1	1814537987	ZIMMHUILYKCWFA-MRXNPFEDSA-N	432.236	1.441	50	20	IDGD	
COCCOCCOCCC(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](O)CCl)n[nH]1	1814877728	JMEYOYJFHLQGPV-HOTGVXAUSA-N	446.932	1.071	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@H](C(=O)N2CCCC[C@@H]2c2cc(NC(=O)[C@@H](O)CCl)n[nH]2)C1	1814877845	LZNWYPUISOIRKY-XNISGKROSA-N	440.928	1.981	50	20	IDGD	
COc1ccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)cn1	1817470297	OEYRIPDBWWUGHW-SFHVURJKSA-N	449.276	1.113	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)Cc2ccsc2)[nH]n1)c1cccc(B(O)O)c1	1817474284	CBRNWNZXABCYCQ-SFHVURJKSA-N	438.318	1.700	50	20	IDGD	
CCOC(=O)N[C@H](O)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCBr)[nH]n1	1819239131	CQCRPTDGBLCJJN-XHDPSFHLSA-N	446.302	1.251	50	20	IDGD	
CCC(=O)N[C@@H](C)C(=O)N[C@H]1CCc2nc(NC(=O)CO[Si](C)(C)C)sc2C1	1820160482	NHZOMAKMQOWXBD-RYUDHWBXSA-N	426.615	1.821	50	20	IDGD	
Cc1nc(C(=O)N[C@@H]2CCc3nc(NC(=O)CO[Si](C)(C)C)sc3C2)c(=O)[nH]c1C	1820160927	KMXWIIIMIAAJOE-GFCCVEGCSA-N	449.609	1.921	50	20	IDGD	
CCOC(=O)N[C@H](O)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](C)Br)n[nH]1	1822188699	HVKKXDGMMWEVJB-GLXFQSAKSA-N	446.302	1.250	50	20	IDGD	
C[C@H](Br)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H]2CCNC(=O)C2)[nH]n1	1822191243	DYHKYFWFSRKYKH-GMXVVIOVSA-N	426.315	1.711	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCN2CCOC2=O)[nH]n1	1822370316	MLARHOSKDBYPCR-JSGCOSHPSA-N	427.889	1.498	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)CCl)CC2)c1cn2c(F)cccc2n1	1824134931	VWRZPRDHGHIUBG-SKDRFNHKSA-N	437.884	1.755	50	20	IDGD	
O=C(COC(=O)C(F)(F)F)N1CCC([C@@H]2CCCCN2C(=O)[C@H](O)CCl)CC1	1824186581	OYSVDHLSMROMDA-QWHCGFSZSA-N	428.835	1.311	50	20	IDGD	
CC[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CN1CCCC1=O)CC2	1825446227	AAILLEMNGUCRHX-WDEREUQCSA-N	443.367	1.851	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)/C=C\C(=O)NC1CC1)CC2	1825642508	QOYOWIUBLOHVFO-RWTFEVOBSA-N	441.351	1.673	50	20	IDGD	
O=C(c1cccc(O)n1)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827055884	IMJHCDZCIMKDIE-HXUWFJFHSA-N	437.305	1.014	50	20	IDGD	
Cc1cc(NC(=O)CC(=O)N2CCCC[C@@H]2C2CCN(C(=O)[C@@H](O)CCl)CC2)no1	1827660090	LXWNJSOKHAQYQP-CVEARBPZSA-N	440.928	1.531	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)CCN2CCOC2=O)CC1	1828386277	OTXNWHAZDUTWFC-IAGOWNOFSA-N	429.945	1.702	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(Cl)nc3)CCO2)C1	1829511791	FOEPRJKJRYYNGH-SJCJKPOMSA-N	446.729	1.588	50	20	IDGD	
CS(=O)(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H](F)Br)CC1	1830380908	CADFQSGMOSYFQV-ZFWWWQNUSA-N	441.363	1.731	50	20	IDGD	
CC(C)(C)c1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)cn1	1830720117	TUTOCOQSEGRLTN-HRAATJIYSA-N	439.940	1.049	50	20	IDGD	
CC(C)(C)c1ncccc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1830722482	CELDUYJNDJNNPO-KKSFZXQISA-N	439.940	1.049	50	20	IDGD	
Cc1cc2cccc(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)[C@H](O)CCl)CCO4)c2[nH]1	1830728042	NNBQHTMNTKMEAX-DYESRHJHSA-N	435.908	1.146	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccnc(Cl)n3)C2)C1	1831652368	ZJGGWFSDIUTYAL-UGSOOPFHSA-N	431.320	1.608	50	20	IDGD	
Cc1cc(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](C)CBr)C3)C2)on1	1832563781	LAIMFRORITVBLX-FZKQIMNGSA-N	444.326	1.013	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)/C=C/c3cccnc3)CCO2)C1	1833103087	NWVMKYKLMDQUQZ-UHDDOPSISA-N	442.343	1.788	50	20	IDGD	
O=C(CCc1cccs1)NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1833871334	DUYNZMIJKYCPFG-GOSISDBHSA-N	427.998	1.852	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3cnc[nH]3)CC2)CC1	1834170541	XOCJRLQUAKNIFJ-OAHLLOKOSA-N	426.359	1.768	50	20	IDGD	
CCc1oncc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)CBr)C2)C1	1834514380	WTJNSAKMZIJCOL-ACJLOTCBSA-N	444.326	1.338	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)CN3CCOCC3)CC2)CC1	1834619033	ATRQCNYUNGXQOJ-IBGZPJMESA-N	429.005	1.298	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)Cc1ccccc1F)CCO2	1835005279	VEKGJDKCRCOYOT-NRFANRHFSA-N	438.572	1.676	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccsc3)CCO2)C1	1836101729	DEEVNJZVRPOAMH-QZTJIDSGSA-N	435.373	1.983	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)c3ccc(F)cc3)CC2)CC1	1836291821	RMQODWVVPUIXNA-UHFFFAOYSA-N	447.555	1.384	50	20	IDGD	
CC(C)NCCC(=O)N1CCC(N2CCC(NC(=O)[C@H](F)Br)CC2)CC1	1836412754	SMJDRMNWDABDGD-KRWDZBQOSA-N	435.382	1.637	50	20	IDGD	
CC(=O)N/C(C)=C/C(=O)N1CCC(N2CCC(NC(=O)[C@H](F)Br)CC2)CC1	1836414130	YIJPNKOECUQVRB-FLVLSHQESA-N	447.349	1.288	50	20	IDGD	
O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)C1(C(F)(F)F)CC1)CCO2	1836716471	WQCGAOQOVDCCET-CQSZACIVSA-N	443.260	1.570	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(-n4cccn4)nc3)CCO2)C1	1838120250	QJVHDUCPFOMHAH-UWJYYQICSA-N	447.923	1.355	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cccc([N+](=O)[O-])c3)C2)C1	1839141957	ZFJSMNSEYYCDJO-PXNSSMCTSA-N	439.896	1.611	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(CC(C)C)nn3C)C2)C1	1839144333	VOGRMGPONMBGHA-LAUBAEHRSA-N	440.972	1.706	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCN3CCCC3)C2)C1	1839156132	CJDHHGRXBVUALY-OALUTQOASA-N	436.380	1.165	50	20	IDGD	
CC(C)n1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)n1	1839201982	PMVOZRIOCWWRJV-PBHICJAKSA-N	447.305	1.225	50	20	IDGD	
C#CC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](Br)Cc1ccccc1)CCO2	1839802255	PUGOZDKUONVEQE-PXNSSMCTSA-N	435.318	1.082	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccsc3)C2)C1	1839964020	CRULYWXZMATNND-YJBOKZPZSA-N	445.379	1.921	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccccc3F)C2)C1	1840034500	NUONUKNSAIFJBH-FZKQIMNGSA-N	429.286	1.679	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(C)c(O)c(C)c3)C2)C1	1840156051	HRFPXDBARJVXFE-UTKZUKDTSA-N	440.924	1.333	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@H]1C(=O)N1CCOC[C@@]2(CN(C(=O)C(Cl)Cl)CCO2)C1	1840190727	KCZDNBPJMMRPOA-LPMFXHHGSA-N	449.331	1.002	50	20	IDGD	
Cc1nccn1[C@@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1840489108	JXHVGRHFRRGSJF-YWZLYKJASA-N	426.945	1.474	50	20	IDGD	
Cc1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)c1Cl	1840690050	LXQNRVZZKFPGPG-BEFAXECRSA-N	431.316	1.318	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC12CN(C(=O)[C@H](C)[C@H]1SC(=N)NC1=O)C2	1841286722	WHRFCXZJXATOPO-GMTAPVOTSA-N	431.356	1.023	50	20	IDGD	
C=CCO[C@H](C)C(=O)N1CCCC12CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1841607934	RCJQIXMSIAMNTI-CABCVRRESA-N	429.945	1.913	50	20	IDGD	
O=C(c1cc2cccc(F)c2s1)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843011210	CWGBDOQYAHYDDN-UHFFFAOYSA-N	438.289	1.851	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@H]2CN(Cc3ccccc3)CCO2)C1	1843925290	BBXPCWVSFLZPQA-MOPGFXCFSA-N	435.952	1.345	50	20	IDGD	
O=C(NC1(C(=O)N2CCCC23CN(C(=O)[C@@H](O)CCl)C3)CC1)OCc1ccccc1	1843927477	OOEBDWQVQXZNQQ-INIZCTEOSA-N	435.908	1.249	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@H]2CN(C(=O)OC(C)(C)C)C[C@@H]2C)C1	1843972768	WHUXBNBGPMFQQD-HRCADAONSA-N	443.972	1.947	50	20	IDGD	
C[C@H](NC(=O)c1cnccn1)C(=O)N1CCCC12CN(C(=O)[C@](C)(Cl)CCl)C2	1844333189	XLIILIJDBGSFGO-YVEFUNNKSA-N	428.320	1.035	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@H]2CN(C(=O)OC(C)(C)C)C[C@@H]2O)C1	1845107820	NHINRYXFIPAQHH-KKUMJFAQSA-N	429.945	1.435	50	20	IDGD	
CCOC(=O)c1ncn2c1CC[C@@H](C(=O)N1CCCC13CN(C(=O)[C@@H](F)Cl)C3)C2	1845862475	ULUJWUZFPKSRJD-IUODEOHRSA-N	426.876	1.360	50	20	IDGD	
C[C@H](CC(=O)N1CCCC12CN(C(=O)c1cnccc1C(=O)NN)C2)Oc1ccccc1	1845878826	UXGAITZPDSITBV-MRXNPFEDSA-N	437.500	1.360	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)Cc1ccc(C#N)cc1	1847309281	OVBUPWIDFSRHDC-BLXYJZHJSA-N	432.484	1.437	50	20	IDGD	
CCOc1c(Br)cc(C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)cc1OC	15639597	FPRRLEHYSFNRJE-VIFPVBQESA-N	435.296	1.052	50	20	IDGD	
CC1CCN(S(=O)(=O)c2ccc(C(=O)NNC(=O)c3ccc4c(c3)OCO4)cc2)CC1	15793463	HILWZFRJNYTLPQ-UHFFFAOYSA-N	445.497	1.911	50	20	IDGD	
Cc1nc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)nn1-c1ccc(F)cc1	16178059	PVJLJNWMUBSHHJ-UHFFFAOYSA-N	446.464	1.040	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CCCc2nc3ccccc3c(=O)[nH]2)cc(OC)c1OC	27068010	WGDCYHSQCJGKHP-UHFFFAOYSA-N	440.456	1.733	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1	109313089	GXDQRNNQMDERCU-UHFFFAOYSA-N	433.384	1.747	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)N2CCN(C(=O)Cn3cnnn3)CC2)c(C)n1CCC(C)C	725882993	IFCBKNMNWDVCEA-NDENLUEZSA-N	438.536	1.416	50	20	IDGD	
COc1ccccc1[C@H](CNC(=O)NNC(=O)CNC(=O)c1cccs1)N1CCCC1	726085161	YZIREJGFFIXSHG-INIZCTEOSA-N	445.545	1.654	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)N[C@@H](c1ccccc1)[C@@H]1CCCO1	726711881	KTKZFVGGLBZJDD-IRXDYDNUSA-N	431.518	1.844	50	20	IDGD	
COc1cccc(N2CC[C@H](NC(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)C2)c1	728221309	RHHZNWLNSMIMTP-HNNXBMFYSA-N	432.502	1.322	50	20	IDGD	
CC(C)NC(=O)NNS(=O)(=O)c1ccc(S(=O)(=O)N2C[C@H](C)C[C@@H](C)C2)cc1	728263365	XECQEEOZWDRBCD-ZIAGYGMSSA-N	432.568	1.254	50	20	IDGD	
C[C@H]1CCCN(S(=O)(=O)c2ccc(CNC(=O)NNC(=O)Cc3cccnc3)cc2)C1	728946046	WTWCABABTVWQBG-INIZCTEOSA-N	445.545	1.575	50	20	IDGD	
O=C(NCc1cccc(N2CCCC2=O)c1)NNC(=O)C1CCN(c2ncccn2)CC1	728947941	GYLWHMURKNXCFU-UHFFFAOYSA-N	437.504	1.350	50	20	IDGD	
Cc1ncsc1C(=O)NNC(=O)CCCCCC(=O)NNC(=O)c1scnc1C	729831487	MYNLMQNWLUUNLP-UHFFFAOYSA-N	438.535	1.389	50	20	IDGD	
C[C@@]1(c2ccc(CNC(=O)NNC(=O)c3cccc4ncccc34)cc2)NC(=O)NC1=O	730127227	LIRPFEBZONNYCV-QFIPXVFZSA-N	432.440	1.434	50	20	IDGD	
CN(C)N(C(=O)c1ccn(-c2cccc(Br)c2)n1)[C@H]1CCS(=O)(=O)C1	730162786	VQHIEUQRYIHXFY-AWEZNQCLSA-N	427.324	1.741	50	20	IDGD	
C[C@@]12CCC(=O)N1c1ccccc1C(=O)N2CC(=O)NNC(=O)c1cccc2ncccc12	730286541	ONZMCXYBGBLXFY-DEOSSOPVSA-N	443.463	1.995	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)NNC(=O)c1ccc(Br)s1	730822142	VATKQGURVWUJES-UHFFFAOYSA-N	429.252	1.270	50	20	IDGD	
COc1ccccc1C(=O)NNS(=O)(=O)c1ccc([N+](=O)[O-])c(Br)c1	731494217	QUKXTMBGAWKNAJ-UHFFFAOYSA-N	430.236	1.989	50	20	IDGD	
CCOC(=O)N1CCC(NC(=O)CCCNC(=O)NNC(=O)c2ccccc2OC)CC1	731499854	LGXNLGUWHAELCN-UHFFFAOYSA-N	449.508	1.157	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)[C@@H]1CCCN1S(=O)(=O)c1cccs1	732301764	IOJBXCUIHVNSCD-ZDUSSCGKSA-N	429.545	1.448	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)NCc2ccc(N(C)S(C)(=O)=O)cc2)c1	732476135	ZPAPXRFILNXZCD-UHFFFAOYSA-N	434.518	1.609	50	20	IDGD	
O=C(NNC(=O)c1cc(F)ccc1Br)N[C@H]1CCN(CC(F)(F)F)C1=O	732589801	FMNUCGTUNIMFAP-JTQLQIEISA-N	441.179	1.695	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CSc2ccccc21)c1cccc(S(=O)(=O)N2CCOCC2)c1	735632117	XTRLHPFGLTVWRT-QGZVFWFLSA-N	447.538	1.358	50	20	IDGD	
O=C(COC(=O)Cc1ccccc1OC(F)F)NNC(=O)[C@H]1COc2ccccc2O1	735733663	RGIAJSIUJAABRJ-MRXNPFEDSA-N	436.367	1.361	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@@H]2CCCO[C@@H]2C(C)(C)C)c1	735762457	MPQNDUOGNWMXFL-RDJZCZTQSA-N	440.566	1.722	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)[C@@H]2CC[C@H](C(F)(F)F)NC2=O)cc1C	736775039	ITEWKWOIXBGNNT-BXKDBHETSA-N	435.424	1.380	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)N[C@H](CNC(=O)OC(C)(C)C)C2CC2)cc1C	741425930	NDSVXUGFFAZWFL-MRXNPFEDSA-N	433.509	1.876	50	20	IDGD	
CCOc1ccc(/C=C(/C#N)C(=O)N2CCN(S(=O)(=O)Cc3ccon3)CC2)cc1	742804572	FHZVGRRCRGALIP-LGMDPLHJSA-N	430.486	1.654	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)[C@@H]2CCCN(c3ncnc4sccc34)C2)C[C@@H](C)O1	743291254	OUOJKAZSYHIGKF-OWCLPIDISA-N	446.577	1.554	50	20	IDGD	
O=C(CN1CCN(c2ccccn2)CC1)NNc1ccc(S(=O)(=O)C(F)F)cc1	743334571	ATBFFGWJYDOXIC-UHFFFAOYSA-N	425.461	1.343	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c(Cl)c1	743509790	KGQQXBNBJVAGHU-UHFFFAOYSA-N	429.828	1.305	50	20	IDGD	
COc1ccc(Cn2cc(C(=O)OCC(=O)NNC(=O)c3cccc(C#N)c3)cn2)cc1	745001442	MLVGBCXUUPJFFQ-UHFFFAOYSA-N	433.424	1.430	50	20	IDGD	
CC(C)S(=O)(=O)c1ccc(F)c(C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)c1	745001652	DENSIHZREXKZHZ-UHFFFAOYSA-N	447.444	1.497	50	20	IDGD	
C[C@]1(C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)CCCN(C(=O)c2ccccc2)C1	745350975	RQQXWQSKCSHJTL-DEOSSOPVSA-N	448.479	1.805	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)[C@H]2CCN(c3cccc(Cl)c3)C2=O)cc1	745432159	IWEOIROUZMYNEP-KRWDZBQOSA-N	440.843	1.569	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1cc([N+](=O)[O-])ccc1O)[C@@H]1CN(Cc2ccccc2)CCO1	745836633	UAJWEIVKSBNZFZ-LIRRHRJNSA-N	443.460	1.534	50	20	IDGD	
CN(C)C1(CNC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])Cc2ccccc2C1	745842978	WIBRZZGCIPDCSZ-UHFFFAOYSA-N	427.461	1.403	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2ccc(C(=O)NNC(=O)N3CCOCC3)cc2)cc1C	745993035	UJUNJNUOWDUSSH-UHFFFAOYSA-N	432.502	1.791	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)c1ccc(Sc2ccccc2Cl)nn1	746102409	CLIMUYWWXOAVPI-JTQLQIEISA-N	426.907	1.477	50	20	IDGD	
Cc1ccc(-c2nnc(-c3ccc(C(=O)NNC(=O)[C@@H]4CCS(=O)(=O)C4)cc3)o2)cc1	746368002	SOAJUAUQSTZJHT-QGZVFWFLSA-N	440.481	1.908	50	20	IDGD	
CC(C)(C)NS(=O)(=O)Cc1cccc(C(=O)NNC(=O)Cc2cn3ccccc3n2)c1	746553331	JLLUINXIPFUAHV-UHFFFAOYSA-N	443.529	1.556	50	20	IDGD	
C[C@@H](NC(=O)OC(C)(C)C)C(Cc1ccccc1)=NNC(=O)N[C@@H]1CCS(=O)(=O)C1	746563984	FPNZWURYYUSVNI-GDBMZVCRSA-N	438.550	1.985	50	20	IDGD	
CC(C)[C@H](NC(=O)NC(C)(C)C)C(=O)OCC(=O)NNC(=O)c1ccc(Cl)cc1	747044161	ONRYXDZFWWPRDE-HNNXBMFYSA-N	426.901	1.767	50	20	IDGD	
NC(=O)[C@H]1CC(C(=O)NNc2nc(-c3ccccn3)nc3c2CCC3)=NN1c1ccccc1	747982488	BSXUOLMKFPXUTO-LJQANCHMSA-N	442.483	1.591	50	20	IDGD	
COC(=O)c1cc2c(C=NNC(=O)CSc3nnc(O)nc3O)ccc(OC)c2o1	748779932	BPYNGRXODNRVHC-UHFFFAOYSA-N	433.402	1.067	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H]2CCCN2C2CCCC2)c1	749174670	CPSFXJQXAXSBQX-LJQANCHMSA-N	436.578	1.885	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNS(=O)(=O)c2cnn(C3CCOCC3)c2)cc1	749753875	ANUAPQOSHASMOD-CQSZACIVSA-N	438.506	1.410	50	20	IDGD	
O=C(CCc1ccccc1)NNC(=O)Cc1ccc(S(=O)(=O)N2CCOCC2)s1	749804407	WVLWNWHJLFVLNG-UHFFFAOYSA-N	437.543	1.092	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2ccc(C(=O)NNC(=S)N[C@@H](C)C3CC3)cc2)C[C@@H](C)O1	751619255	LVGAKPUAJYIURX-MJBXVCDLSA-N	440.591	1.392	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](CC(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1)C1CC1	752737482	YPBNUQONSBOGOF-OAHLLOKOSA-N	438.912	1.797	50	20	IDGD	
Cc1oc(S(=O)(=O)N(C)C)cc1C(=O)NNC(=O)CCSc1ccc(F)cc1	753275976	BHYCRZAFQPCKIP-UHFFFAOYSA-N	429.495	1.921	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCS(=O)(=O)[C@@H]2CCCC[C@@H]21	753852006	SQHJAIWGZWCGNI-GOEBONIOSA-N	429.926	1.151	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)Nc1ccc(N2CCCS2(=O)=O)cc1	755592350	GODGHDGOMJLGPV-UHFFFAOYSA-N	442.295	1.784	50	20	IDGD	
COC(=O)CCNC(=O)c1ccc(NC(=O)NNC(=O)COc2ccc(F)cc2)cc1	755603542	KNGUGQSOIDPTHN-UHFFFAOYSA-N	432.408	1.350	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)Nc1cc(Cl)ccc1N1CCSCC1	756281347	SADPYSAJUDUDHC-NSHDSACASA-N	432.955	1.481	50	20	IDGD	
O=C(NNC(=O)c1cnccn1)Nc1ccc(CCn2nnc(-c3ccccc3)n2)cc1	756294256	FVFIBFIYSAMPMI-UHFFFAOYSA-N	429.444	1.839	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)Nc1cccc2[nH]ccc12	756300369	LYWPBFVKUPUDDY-UHFFFAOYSA-N	443.485	1.655	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)Nc2ccc(S(=O)(=O)NC3CC3)cc2)c1	756774255	BIROCRKLZHICPB-UHFFFAOYSA-N	432.502	1.976	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)Nc1cc(C2CC2)nn1[C@@H]1CCS(=O)(=O)C1	756854987	IKJJLIABXGHXSS-OAHLLOKOSA-N	447.517	1.524	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@H](NC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)[C@H](C#N)C1	758768033	HRKWHEHTSCUPON-RHSMWYFYSA-N	439.476	1.575	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)C(=O)Nc1ccccn1)n1nnc(-c2ccc(Cl)cc2)n1	758833836	JDHUNXSSODRSOL-ZDUSSCGKSA-N	428.840	1.126	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)NC[C@@]1(Cc2ccc(F)cc2)CCC[C@H]1O	759672027	NFGPVCBOFPPZJY-UTKZUKDTSA-N	432.452	1.253	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)CCNS(=O)(=O)c1ccccc1F	761636005	HYQUXAZUWLZWFX-UHFFFAOYSA-N	441.506	1.442	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(-n3cncn3)c(Cl)c2)cc1OC	763552219	XJJUVMZNLLBMEO-UHFFFAOYSA-N	444.835	1.338	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(Cl)c(C(N)=O)c2)c2ccccc2n1	763615080	AFJXKOGQJWDGDX-UHFFFAOYSA-N	425.832	1.695	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(Cl)c(C(=O)N(C)C)c2)c1	763619846	ZKYILPORTANFKR-UHFFFAOYSA-N	432.864	1.515	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(CN3CCOC3=O)c2)c1	763622253	AQKJAURAFDPLIQ-UHFFFAOYSA-N	426.429	1.112	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)N2CCc3ccc(Br)cc32)c1	763773582	ZCBIJKUVDAFRBU-UHFFFAOYSA-N	448.273	1.817	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)c1ccc(NC(=O)OCC(F)(F)F)cc1	763824388	IPFGFWBAEDNKOK-UHFFFAOYSA-N	439.350	1.383	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccc(Cl)cc2C(=O)N2CCCC2)n1	763893751	YPDZGBKIWRKJNK-UHFFFAOYSA-N	446.895	1.175	50	20	IDGD	
O=C(Cn1cc(NC(=O)C(=O)NNC(=O)c2cccc3ccccc23)cn1)NC1CCCC1	764052851	YBHJRIGHOCDJJJ-UHFFFAOYSA-N	448.483	1.495	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1OC(C)C	764076576	BJDUMHMKYYUOQD-UHFFFAOYSA-N	449.485	1.286	50	20	IDGD	
CNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2ccc(F)cc2Br)c1	764084167	FGDJTUHYVQVNFP-UHFFFAOYSA-N	437.225	1.348	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2cnn(-c3ccccc3Cl)c2)c1O	764132340	ULOQIEMXLYNGIB-UHFFFAOYSA-N	429.820	1.640	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)ccc1Br	764164816	UCXIDPHWMCQYMS-OAHLLOKOSA-N	434.246	1.547	50	20	IDGD	
Cc1ccc(C)c(-n2ncc(NC(=O)C(=O)NNC(=O)[C@H]3Cc4ccccc4O3)c2C)c1	764167366	JBMXWXJMZQQPIR-HXUWFJFHSA-N	433.468	1.887	50	20	IDGD	
COC(=O)c1ccc(C(F)(F)F)cc1NC(=O)C(=O)NNC(=O)CCc1ccco1	764170893	ZIJKPWUULMHVQG-UHFFFAOYSA-N	427.335	1.804	50	20	IDGD	
Cc1cccc(NC(=O)C(=O)NNC(=O)Cc2ccccc2F)c1C(=O)N1CCCC1	764319297	NYHCSJICGWDJDY-UHFFFAOYSA-N	426.448	1.699	50	20	IDGD	
CN1CCCN(c2ccc(NC(=O)C(=O)NNC(=O)CCCc3cccs3)cc2)CC1	764342987	LFAVBUMPGNHNEE-UHFFFAOYSA-N	443.573	1.999	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1cc(Br)c(F)cc1Cl	764398584	UNYWORQFGTWNAN-SSDOTTSWSA-N	440.653	1.379	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)CSC[C@@H]3CCCCO3)CC2)cc1	765749280	WMWJGAKJNQBNMM-FQEVSTJZSA-N	434.606	1.562	50	20	IDGD	
O=C(CCNC(=O)c1ccco1)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	765755427	HCXDHOALCXXRBB-UHFFFAOYSA-N	447.923	1.018	50	20	IDGD	
COc1cc(NC(C)=O)c(C(=O)OCC(=O)NNC(=O)Cc2ccccc2C)cc1OC	767242648	XQXXBBVWTNYFQP-UHFFFAOYSA-N	443.456	1.518	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)Cn1cccc(C(F)(F)F)c1=O	767267637	ONTSAICKPCWUBE-UHFFFAOYSA-N	425.363	1.109	50	20	IDGD	
CC(C)(C)OC(=O)N1CCO[C@@H](C(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)C1	767446161	XNTQTMOBSYJKGR-CQSZACIVSA-N	441.868	1.280	50	20	IDGD	
CCN1CCC[C@@H]1CN1C[C@H](C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)CC1=O	768261852	XIHAGUQLKYWAOH-ZIAGYGMSSA-N	430.534	1.232	50	20	IDGD	
COc1ccc(-n2cc(O)c(C(=O)NNc3c(OC)cccc3S(C)(=O)=O)n2)cc1	768637381	AAMAIPLUHQFHRX-UHFFFAOYSA-N	432.458	1.756	50	20	IDGD	
O=C(COC(=O)CCc1nc(C2CCCC2)no1)NNC(=O)[C@H]1COc2ccccc2O1	770051101	BZKMAVPBFGLHGJ-MRXNPFEDSA-N	444.444	1.190	50	20	IDGD	
Nc1cc(C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)ccc1OC(F)(F)F	770534058	LVKZZVJREVOKBD-UHFFFAOYSA-N	442.306	1.694	50	20	IDGD	
COCCC(=O)N1CCC(NC(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)CC1	770544733	SMUDVGMBSKWHNW-ZDUSSCGKSA-N	426.901	1.465	50	20	IDGD	
CS(=O)(=O)c1cc(S(=O)(=O)NNC(=O)c2ccc(Cl)cc2O)c(Cl)s1	770631900	ISIMTMZDAOYWJV-UHFFFAOYSA-N	445.327	1.787	50	20	IDGD	
C[C@H]1CN(c2nccnc2C#N)CCN1C(=O)NNC(=O)[C@@H](C)Oc1cccc(Cl)c1	770647521	MQVGAXDLVMJRMC-UONOGXRCSA-N	443.895	1.720	50	20	IDGD	
CO[C@H](c1ccc(F)cc1)[C@H](C)NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1	770768817	ALOVAWJDVBFVNG-KSSFIOAISA-N	430.484	1.939	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)N[C@H]2CCO[C@@]3(CCOC3)C2)c2ccccc2c1=O	771432503	ASHZXGWNWQBCRO-NYHFZMIOSA-N	443.504	1.479	50	20	IDGD	
COc1ccc(C)cc1[C@]1(C)NC(=O)N(CC(=O)NNc2ncccc2[N+](=O)[O-])C1=O	771623967	YHYZTPNEARTXIW-IBGZPJMESA-N	428.405	1.217	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCCO1)c1ccc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1	772221867	WOBAVSAABQUSAF-QGZVFWFLSA-N	448.457	1.726	50	20	IDGD	
Cc1nc2ncnn2c(C)c1CCC(=O)NNC(=O)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	773413152	GUJZBDHNFWAGKK-OAHLLOKOSA-N	445.524	1.468	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)NCc1ccc(N2CCCS2(=O)=O)c(F)c1	773576941	FAEIDKZOJKHITL-UHFFFAOYSA-N	438.456	1.578	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)N(C)CCO2	774010235	WRWADHPWJAEWJB-LBPRGKRZSA-N	432.864	1.722	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)N[C@@H]2CCN(c3ccccc3C(F)(F)F)C2=O)n1	776184003	XNJXVENYRBCRBW-CQSZACIVSA-N	438.410	1.655	50	20	IDGD	
CN(C(=O)OC(C)(C)C)[C@@H](C(=O)NNC(=O)c1ccc2c(c1)OCCO2)c1cnn(C)c1	776323677	OXTYTGYDJQNBJF-QGZVFWFLSA-N	445.476	1.561	50	20	IDGD	
COCCO[C@H]1COCC[C@@H]1NC(=O)NNC(=O)c1ccc(F)cc1Br	777274225	HVYXYQWISOGIAT-KBPBESRZSA-N	434.262	1.353	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNS(=O)(=O)c1cc(C(=O)O)c(Cl)cc1Cl	777940131	WVOFWSAWOTUFDB-UHFFFAOYSA-N	442.277	1.526	50	20	IDGD	
CC[C@@]1(O)CCN(C(=O)/C(C#N)=C\c2cn(CCC(N)=O)nc2-c2ccc(OC)cc2)C1	779341818	JBBBEXANSXLMDZ-QUDXMAFCSA-N	437.500	1.714	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@H](C(=O)NNC(=O)c2cc3ccccc3o2)[C@@H](C)O)cc1	779529866	QFGHSYGEWIVFNT-ACJLOTCBSA-N	431.470	1.230	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)c(OC)c1	782119923	BHWUGKYXNAAWFS-UHFFFAOYSA-N	429.473	1.784	50	20	IDGD	
Cc1ccccc1NC(=O)NNC(=O)C(=O)Nc1ccccc1C(=O)N1CCN(C)CC1	783412747	CCIPCXUVCUJJEN-UHFFFAOYSA-N	438.488	1.174	50	20	IDGD	
CC(C)COC(=O)Nc1cccc(NC(=O)C(=O)NN[C@]2(C)CCS(=O)(=O)C2)c1	783427603	PEZSOQIIGBUMFY-GOSISDBHSA-N	426.495	1.028	50	20	IDGD	
CCOC(=O)Cn1ccc2cc(NC(=O)C(=O)NNc3ccc(-n4cccn4)nn3)ccc21	783433385	SDQQNHIMXFMUFD-UHFFFAOYSA-N	448.443	1.262	50	20	IDGD	
COC(=O)c1cc(N2CCOCC2)ccc1NC(=O)C(=O)NNc1ccc(F)cc1C	783448057	VMBHGIHRXFMBRF-UHFFFAOYSA-N	430.436	1.839	50	20	IDGD	
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)NNC(=O)c1cnn(-c2ccccc2)c1	783828637	VPPOLLFNJRLKEQ-UHFFFAOYSA-N	445.413	1.190	50	20	IDGD	
CCC(C)(C)OCc1cccc(NC(=O)C(=O)NNC(=O)CNC(=O)c2ccco2)c1C	784004763	TWBTWNURRCMGDU-UHFFFAOYSA-N	444.488	1.809	50	20	IDGD	
O=C(NC1CC1)c1cc(F)c(NNC(=O)[C@@H]2CC=CC[C@@H]2C(=O)N2CCOCC2)c(F)c1	784448087	FMBABBSXOVWXPZ-CVEARBPZSA-N	448.470	1.741	50	20	IDGD	
CNS(=O)(=O)CCNC(=O)NNC(=O)c1ccc(COc2ccc(Cl)cc2)cc1	784657191	HBQAFLQWXHKOEE-UHFFFAOYSA-N	440.909	1.412	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc2c(c1)CCN2C(=O)C(=O)NNc1ccc(F)cc1	784783932	REBSSZOGVKSUPV-UHFFFAOYSA-N	434.493	1.889	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(NC(=O)C(=O)NNc2ccnc(F)c2)ccc1Cl	784852374	XNVBOGVYNLJMJD-UHFFFAOYSA-N	443.888	1.986	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)C(=O)Nc3cccc([S@](C)=O)c3)n[nH]2)c1	785125155	BINGVDAWXLQKKK-HKBQPEDESA-N	439.497	1.831	50	20	IDGD	
O=C1CN(c2ccnc(C(=O)NNC(=O)NCc3cccc(C(F)(F)F)c3)c2)CCN1	786839946	BKHGRHAEMHTWGJ-UHFFFAOYSA-N	436.394	1.181	50	20	IDGD	
C[C@H](Nc1ccc(C(=O)NNC(=O)N2CCN(C)CC2)cc1[N+](=O)[O-])c1ccccn1	788169086	IHOIKKNCWSYYKH-AWEZNQCLSA-N	427.465	1.765	50	20	IDGD	
COc1cc(F)ccc1NNC(=O)c1cc(S(=O)(=O)N2CCOCC2)ccc1OC	788188752	MLTTVVCLFDOXAU-UHFFFAOYSA-N	439.465	1.621	50	20	IDGD	
CS(=O)(=O)c1cc(NC(=O)NNC(=O)[C@H]2COc3ccccc3O2)ccc1Cl	788308672	BGQICLMGSYYDLL-CQSZACIVSA-N	425.850	1.736	50	20	IDGD	
CCn1nc(C)c(S(=O)(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)c1C	788915422	KUOSIFDZQFWYOH-UHFFFAOYSA-N	444.558	1.318	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)ccc1Cl	789732850	ZETNERXWMJRZGP-UHFFFAOYSA-N	429.820	1.640	50	20	IDGD	
CCc1[nH]nc(C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)c1Br	789925246	YRJAKMUYUWVYQE-UHFFFAOYSA-N	428.312	1.932	50	20	IDGD	
C[C@@]1(NNC(=O)NCc2nc(-c3cccc(Br)c3)no2)CCS(=O)(=O)C1	790898065	TWXXONVCMALNRZ-OAHLLOKOSA-N	444.311	1.380	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)c2cnc(Br)c(Cl)c2)cc1	792598968	XQCAKVMPRUKLQO-UHFFFAOYSA-N	437.637	1.987	50	20	IDGD	
Cn1c(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)cc2ccccc2c1=O	796840250	LZTSAZQZQLLZSK-UHFFFAOYSA-N	442.497	1.316	50	20	IDGD	
C[S@](=O)c1ccc(CC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc1	797791746	FTAUBHCQDFBYKJ-LJAQVGFWSA-N	449.554	1.212	50	20	IDGD	
CCn1ncc2cc(C(=O)OCC(=O)NNC(=O)c3ccc(OC)c(OC)c3)c(C)nc21	799572736	NIKALZCKLQBGCY-UHFFFAOYSA-N	441.444	1.395	50	20	IDGD	
CCCCNS(=O)(=O)c1ccc(C)c(NC(=O)C(=O)NNC(=O)c2ccc(O)cc2)c1	799834356	BMYNMIQTZNBATO-UHFFFAOYSA-N	448.501	1.179	50	20	IDGD	
O=C(NNC(=O)c1ccncc1C(F)(F)F)c1cccc(S(=O)(=O)N2CCCC2)c1	800687602	CEWOHMWKJMVBNB-UHFFFAOYSA-N	442.419	1.960	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2C)cc1C(=O)OC	807456472	NQQKPLGIRIHZAP-UHFFFAOYSA-N	430.373	1.558	50	20	IDGD	
O=C(NNc1ccc2c(=O)[nH]ccc2c1)c1cccc(S(=O)(=O)NC[C@@H]2CCCO2)c1	807505196	IHEXNWIODHUVII-KRWDZBQOSA-N	442.497	1.742	50	20	IDGD	
COC[C@]1(CNC(=O)NNC(=O)Cn2nc(C)cc2C)CCCN1C(=O)OC(C)(C)C	807553239	HAWZGTLJEWAXCS-HXUWFJFHSA-N	438.529	1.246	50	20	IDGD	
O=C(COc1ccccc1Cc1ccccc1)NNC(=O)NC[C@H]1CCCS(=O)(=O)C1	807582408	YZRUXWYRBYOQBT-GOSISDBHSA-N	445.541	1.811	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)CNS(=O)(=O)c1ccc(C)c(C)c1	811102574	AUAWLCDQXQJSTR-UHFFFAOYSA-N	441.531	1.137	50	20	IDGD	
C[C@@H]1CN(c2ccc(C(=O)NNc3ccc(S(=O)(=O)N(C)C)cc3)cn2)C[C@@H](C)O1	812729395	LEEQYDWYGLYNEU-HUUCEWRRSA-N	433.534	1.702	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)[C@@H]1OCCc2sccc21	813870266	UMRNCVLSADXHLD-GUYCJALGSA-N	430.534	1.787	50	20	IDGD	
CC(=NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C)c1nc(-c2ccccc2)cs1	814877632	SXVSAMBTCGXMQL-UHFFFAOYSA-N	437.485	1.098	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)cc1)[C@H]1C[C@@H]1C	815564420	IKSQBUUZOYZGOT-SJCJKPOMSA-N	438.440	1.576	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(N(C(C)=O)[C@@H]3C[C@H]3C)cc2)c1O	815568634	OYFLCUWRQQRATM-SJKOYZFVSA-N	440.456	1.562	50	20	IDGD	
CCS(=O)(=O)N1CCC[C@@H](C(=O)NNc2cc(C(=O)OC)ccc2Br)C1	818756950	MTVDRUDFHJCDBG-GFCCVEGCSA-N	448.339	1.741	50	20	IDGD	
O=C(NN=Cc1ccc(-n2cccn2)cc1)C(=O)NN=Cc1ccc(-n2cccn2)cc1	873850106	BUDXVLAEZOHVGP-UHFFFAOYSA-N	426.440	1.658	50	20	IDGD	
CCCCN1C(=O)c2ccc(C(=O)NNC(=O)CCN3C[C@@H](C)O[C@H](C)C3)cc2C1=O	912921358	NOGKXGBRISWQFA-HUUCEWRRSA-N	430.505	1.343	50	20	IDGD	
Cn1nc(SCC(=O)NN=C2CCCc3[nH]c4ccc(F)cc4c32)c(=O)n(C)c1=O	914555035	HGRNPWOPDLPOBZ-UHFFFAOYSA-N	430.465	1.048	50	20	IDGD	
CC(=NNC(=O)c1ccc2ccccc2n1)c1ccc(S(=O)(=O)N2CCNCC2)cc1	916244407	WYDRPVPHCFZHOB-UHFFFAOYSA-N	437.525	1.983	50	20	IDGD	
CCS(=O)(=O)N1CCC(NC(=O)NNC(=O)CCSc2ccc(F)cc2)CC1	916260261	VRTFPSGWWGDKKP-UHFFFAOYSA-N	432.543	1.452	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)N(C)c1ccccc1	916451134	DEWAAMRUDUGQAI-HNNXBMFYSA-N	433.534	1.406	50	20	IDGD	
O=C(Cc1cccc2ccccc12)NNC(=O)NCCNS(=O)(=O)Cc1ccccc1	916516359	LWDHLXQJJUTUAK-UHFFFAOYSA-N	440.525	1.832	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)c2cc3c(=O)n4ccccc4nc3n2C)cc1	917059706	GPPFJBBFFUZWAW-AWEZNQCLSA-N	449.467	1.813	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NCc1cccc(CN2CCOCC2)c1	918223234	GCCLIGHGVCDHRY-INIZCTEOSA-N	430.480	1.956	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCC(=O)NCC(F)(F)F	918235218	OUZBLQZPNVVKTI-MRVPVSSYSA-N	441.204	1.225	50	20	IDGD	
CCOc1ccc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)c3cnn[nH]3)cc2)cc1	918291155	TUHHMXHMGLRVGH-UHFFFAOYSA-N	430.446	1.079	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)[C@H]2CCCN(S(=O)(=O)c3ccc(C)s3)C2)c(O)c1	918337506	OMIAVAVSTVIGHO-AWEZNQCLSA-N	437.543	1.932	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@H]2CCN(c3ccc(F)cc3)C2=O)cc(OC)c1OC	919689817	DEAJMTPYQYALRD-OAHLLOKOSA-N	431.420	1.666	50	20	IDGD	
CCCCOc1c(Cl)cc(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)cc1OC	919885820	RWIWULXRCVYZLB-GFCCVEGCSA-N	433.914	1.659	50	20	IDGD	
NC(=O)CC[C@@H](NC(=O)OCc1ccccc1)C(=O)NNC(=O)c1c[nH]c2ccccc12	920211741	WOPHVYXKROKUDK-GOSISDBHSA-N	437.456	1.489	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2cccn(Cc3ccccc3)c2=O)c2ccccc2c1=O	920425152	SFGREOAHTOOTBW-UHFFFAOYSA-N	443.463	1.701	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2cnn(-c3ccccc3S(C)(=O)=O)c2)cc1	1320134109	USMUXMYVHGFWDT-UHFFFAOYSA-N	429.458	1.751	50	20	IDGD	
O=C(c1c[nH]c2cc(Cl)ccc12)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1777787644	SPOYRKNPYRBGBJ-LPHOPBHVSA-N	426.300	1.865	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc(CO)o2)C1	1779713561	YJMDMENIKCUAMA-CDHAZOANSA-N	429.311	1.683	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc4cccnn4n3)C2)C1	1779961173	NJQCEJRYEDHJIQ-ROUUACIJSA-N	426.304	1.409	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)Cc2ccc3ncnn3c2)C1	1780551984	KVJFSLQRNPJUNI-CBGDNZLLSA-N	449.939	1.040	50	20	IDGD	
COCCOCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@](C)(Cl)CCl)C1	1780713524	WSTCNSPWCBWOHK-FHLIZLRMSA-N	425.353	1.400	50	20	IDGD	
Cn1cccc1C(=O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Br)C1	1780777259	PQVIUISIDIODKW-QIIPPGSGSA-N	444.301	1.412	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(N4CCOCC4)cn3)CCO2)C1	1781213633	LFKYCLVJAUBHTM-UWJYYQICSA-N	436.940	1.379	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cn1nnc3ccccc31)C2	1782172459	VKOZHIWSSZEUHZ-FQELHTAISA-N	449.939	1.199	50	20	IDGD	
COc1ccc([C@@H](C)C(=O)N2CCO[C@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc1	1783933004	OGJCRXHZQQYMOM-HXOBKFHXSA-N	446.548	1.002	50	20	IDGD	
Cn1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]3C2)c(C(F)(F)F)c1	1784091288	YOWSLCDXKMZVCI-GVARAGBVSA-N	437.846	1.237	50	20	IDGD	
Cc1noc(C)c1CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)Br)C[C@@H]21	1785087073	TXMQHKZKEABGPH-AFCVYNCWSA-N	428.327	1.597	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(O)nc(O)c3)[C@H]2C1	1787291944	IYBADMWPOUUVAV-IMIFBBOLSA-N	442.310	1.117	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccnc(Cl)n3)[C@H]2C1	1788875552	YBSXMEGGYMHORT-UHXUPSOCSA-N	445.745	1.754	50	20	IDGD	
C[C@H](C(=O)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1)N1C[C@@H]2C[C@H]2C1	1789440675	GCUJJSBAQFKLNE-NEWSRXKRSA-N	447.344	1.454	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3CCCN(C)C3)[C@H]2C1	1789744967	KUVOSIPREQSAGK-HMDCTGQHSA-N	430.387	1.481	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccnn3CC)C[C@@H]21	1790961647	SXKKJKORMTWTIZ-YXWQFLTLSA-N	427.343	1.670	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4cn[nH]c4cn3)C[C@@H]21	1791055791	IDGLURNVJHTQNL-GPMKHBRKSA-N	436.310	1.335	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4c(c3)OCO4)C[C@@H]21	1791057636	NIQKNQDHANJIIA-YSLLHCQFSA-N	439.306	1.792	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3n[nH]c(C4CC4)c3F)C[C@@H]21	1791252401	JZFPYFMISVIZOF-FQUUOJAGSA-N	428.892	1.273	50	20	IDGD	
C[C@H](Oc1ccccn1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CO[Si](C)(C)C)C[C@@H]21	1791622750	FBLYVSJDBQBZRS-XSLAGTTESA-N	435.597	1.680	50	20	IDGD	
CCC[C@@H](NC(C)=O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](Br)CC)C[C@@H]21	1792188402	GFSIUTNAZMZNMP-SIRPWMCASA-N	446.386	1.444	50	20	IDGD	
COc1ccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CO[Si](C)(C)C)C3)cc1O	1792728954	MBZLNEMEDUBNQN-VPTLXERWSA-N	436.581	1.384	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CS[C@H]1CCCCO1)C2	1792871208	RIBGFOUMURBMTH-QZLJAVCYSA-N	449.411	1.867	50	20	IDGD	
O=C(Cc1cnc2ccccn12)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2	1792934804	PPTPALWSMUMBEC-CZAMWMTLSA-N	439.285	1.157	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(-n3cnnc3)cc1)C2	1793447516	SCIRRTNWOADEBX-UKBAYJJMSA-N	431.924	1.878	50	20	IDGD	
CN(C)CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](Br)Cc1ccccc1)C2	1795185913	PVDVTHHBYVFYDX-ZMMAXQRCSA-N	438.366	1.144	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(N3CCCOC3=O)cc1)C2)[C@H](F)Cl	1796366975	QQQDFTLNWXSMFM-FSDCSDTHSA-N	439.871	1.771	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1Cc3ccccc3CN1)C2	1797955768	ACJATQDILFBIAP-RCLSDMTESA-N	431.609	1.142	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COc1ccccc1C#N)C2	1797958955	CSMDRQWFIZTXHB-UPHUGPLXSA-N	431.565	1.378	50	20	IDGD	
CC(C)n1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)CBr)C3)n1	1798721406	SPOYXQHIVPIEQN-HGTKMLMNSA-N	427.343	1.698	50	20	IDGD	
C#CCO[C@@H](C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O	1799219483	MEBCLOYDHUZOFZ-LLLHUVSDSA-N	443.456	1.810	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CCN(C(=O)OC(C)(C)C)C1)C2	1799267790	FXIHTJZICQTESE-UHDSXZAQSA-N	443.972	1.850	50	20	IDGD	
Cc1ccc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Br)c(C)n1	1799352484	YXYNVZMHSPLGJR-MVJTYMMSSA-N	442.329	1.911	50	20	IDGD	
CC(=O)Nc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)C(Cl)Cl)C3)ccc1C	1799716247	PEVGLFFKFWMIIA-MIFYACCESA-N	428.316	1.960	50	20	IDGD	
CN1CCCn2nc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)[C@H](F)Br)cc2C1	1800161328	DPYWYKSIHLEBHG-ZWUHOBOKSA-N	442.333	1.661	50	20	IDGD	
COc1ccc(F)c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Br)C3)c1	1801716723	XWQZKSZCYIDATF-ANGCBRKESA-N	433.249	1.728	50	20	IDGD	
COc1c(Cl)cccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCC(=O)NN(C)C	1802343653	HUUGGUIGYUTIGU-QDMKHBRRSA-N	436.940	1.973	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1CCC(O)CC1	1802566827	DTJNQMGFQZLQBW-XSNQLHRBSA-N	429.521	1.310	50	20	IDGD	
COc1ccc([C@H](O)C(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)cc1	1803137902	VMPQMLQKJFETSL-LMCOJAPRSA-N	447.919	1.429	50	20	IDGD	
CCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](O)CCl)C2	1804378615	FLTHVZKMOIEXJF-XFIYOXNOSA-N	431.961	1.918	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC2(CCN(C(=O)C[C@@](C)(O)CC(=O)O)CC2)C1	1805389260	KROCGFAIKZHCNA-KBXCAEBGSA-N	447.370	1.864	50	20	IDGD	
C[C@]1(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)CC1(F)F	1807375607	UGFOQZARIAAKLX-DJPFJPOOSA-N	443.259	1.126	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)c2cnc[nH]2)[C@H]1c1cccnc1	1808414317	HEMIOWUCUOMDQM-ZUPKNDBLSA-N	448.487	1.258	50	20	IDGD	
COC(=O)CCC(=O)N1CC[C@H](CNC(=O)[C@H](F)Br)[C@H]1c1cccnc1	1808661544	LTBGNLFRMZEBCX-WQVCFCJDSA-N	430.274	1.731	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)c1cnc2ccccc2n1	1808966104	YUANNMYVHXFZPN-YSSFQJQWSA-N	439.903	1.944	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC2(CCCN(C(=O)Cc3ccc(F)cc3)C2)CC1	1809261193	ZJHPEBGUKILZDH-UHFFFAOYSA-N	432.540	1.972	50	20	IDGD	
Cc1cccc(CC(=O)N2CCC3(CCCN(C(=O)c4ccc(B(O)O)cc4)C3)CC2)n1	1809967293	BXFXZDWJVCZSBY-UHFFFAOYSA-N	435.333	1.157	50	20	IDGD	
O=C(CCCc1ccncc1)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1	1809975190	WZVGUSPMPBNTIH-UHFFFAOYSA-N	449.360	1.629	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)n3)C2)CC1	1810890612	HOIVWXHKLMHEDO-LBPRGKRZSA-N	441.326	1.906	50	20	IDGD	
COc1nccnc1C(=O)N1CC[C@H](CNC(=O)[C@H](C)Br)[C@@H]1c1cccnc1	1812864736	KJJPAVKVHHQBLF-BJJXKVORSA-N	448.321	1.983	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)CC[C@@H]2CCOC2)[C@H]1c1cccnc1	1813073447	ISGCWLVMWZUJDW-FHJLPGHOSA-N	445.564	1.277	50	20	IDGD	
C/C(=C/C(=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@H]1c1cccnc1)C(=O)O	1814097021	ZLHNVHSECUBOCV-FPSHHQLOSA-N	428.258	1.809	50	20	IDGD	
COc1nccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)[C@@H](O)CCl)n[nH]2)c1F	1814870529	VSMDZBNEPIDVMN-OLZOCXBDSA-N	425.848	1.858	50	20	IDGD	
Cc1cccc(CC(=O)N[C@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)c1	1815339588	IQSMFOLUOGJUSO-SFHVURJKSA-N	449.341	1.600	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1cncs1	1816581432	GMUVUJKQBUZUEY-HNNXBMFYSA-N	425.279	1.166	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCBr)n[nH]1	1816780750	IZRMFEKAMKUMBY-JQWIXIFHSA-N	429.319	1.634	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)CCl)CC2)c1n[nH]c2c(F)cccc12	1819228051	OIHGMZOINGMRLL-PELKAZGASA-N	437.884	1.984	50	20	IDGD	
CC[C@H](C)CC(=O)N[C@@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1	1819792972	FPJFODJHTBKSIF-NWDGAFQWSA-N	430.534	1.804	50	20	IDGD	
CCC(=O)N[C@H](C)C(=O)N[C@@H]1CCc2nc(NC(=O)CO[Si](C)(C)C)sc2C1	1820160483	NHZOMAKMQOWXBD-VXGBXAGGSA-N	426.615	1.821	50	20	IDGD	
CC(=O)C[C@@H](C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1822335441	JKFSMCPCXRTOOM-ACJLOTCBSA-N	426.282	1.011	50	20	IDGD	
Cc1ccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)nc1C	1825620010	MTCGTRNZAOOSGY-QHCPKHFHSA-N	449.360	1.925	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(O)nn1)CC2	1825637398	ZDYDGJIJDCWCQK-SFYZADRCSA-N	426.296	1.648	50	20	IDGD	
CCc1cc(C(=O)N[C@H]2CCc3nc(NC(=O)[C@@H](Cl)COC)sc3C2)nn1C	1826003602	OECYWQWIDJXTCE-JQWIXIFHSA-N	425.942	1.919	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)Cc1cccnc1)CC2	1826085392	QHQYCZDVYUQYQR-CQSZACIVSA-N	430.534	1.066	50	20	IDGD	
Cc1nccn1CCCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](O)CCl)CC2	1826692092	LIPSDKPBWSGPBG-TZMCWYRMSA-N	425.942	1.640	50	20	IDGD	
CN[C@H](CC(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@](C)(Cl)CCl)CC1)C(=O)O	1830317646	WQBKIJUJADHSJF-VCBZYWHSSA-N	436.380	1.905	50	20	IDGD	
COc1cccc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)c1	1830358360	AWHLDZPYLDZOSH-JOCHJYFZSA-N	438.952	1.959	50	20	IDGD	
O=C(Cn1ccc2c(F)cccc21)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1830653206	YHMGDYWWHOKHGB-UYAOXDASSA-N	441.862	1.771	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3nn(C)c4c3CCC4)C2)C1	1831646623	LVCWMMKHNAUJEY-IIBYNOLFSA-N	438.956	1.386	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)C(C)(F)F)CCO2	1831684170	GTEIMBXXLUOZDJ-SJCJKPOMSA-N	441.313	1.908	50	20	IDGD	
CCOC(=O)/C=C/C(=O)N1CCC([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1	1831872022	KTDMQOKPXVTDOW-ZGKFYVQTSA-N	436.553	1.098	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1	1831874424	JFAXPFGUMRODAK-GOEBONIOSA-N	445.402	1.763	50	20	IDGD	
Cc1ccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@](C)(Cl)CCl)C3)C2)cn1	1833132378	BFRRGFIYWQEXOQ-UXHICEINSA-N	444.359	1.625	50	20	IDGD	
CC(C)(C)[C@H](O)C(=O)NC1CCN(C2CCN(C(=O)CO[Si](C)(C)C)CC2)CC1	1833286616	PNKGZGYYCNWPMW-LJQANCHMSA-N	427.662	1.817	50	20	IDGD	
Cc1nc(CC(=O)NC2CCN(C3CCN(C(=O)CO[Si](C)(C)C)CC3)CC2)no1	1833809594	GTGDHXIYASFXSQ-UHFFFAOYSA-N	437.617	1.344	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)c1scnc1C1CC1	1834034708	XRYXYHCZRJBJMS-MRXNPFEDSA-N	440.997	1.805	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3sc(C)nc3C)CCO2)C1	1834079410	KEBHEQPOLYAZNB-RDTXWAMCSA-N	431.942	1.084	50	20	IDGD	
O=C(c1cnccc1C(F)(F)F)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1834111920	RMAWPCNJXXDPIR-BBRMVZONSA-N	439.793	1.705	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3c(F)cncc3F)CC2)CC1	1835998511	QFIHRYTVRSXECF-OAHLLOKOSA-N	444.910	1.799	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC1CCN(C2CCN(C(=O)Cn3ccnn3)CC2)CC1	1836398581	OBWRKVHTCPWMTK-SFHVURJKSA-N	431.368	1.086	50	20	IDGD	
CCc1cnc(C(=O)N2CCC(OC3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)s1	1836717086	HKXNVXREZCTMIM-INIZCTEOSA-N	429.970	1.917	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)CCc3cn[nH]c3)CC2)CC1	1837160044	ALILIIJVUFJAAT-SFHVURJKSA-N	426.945	1.595	50	20	IDGD	
CCc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](Br)CC)C3)C2)no1	1838129552	VDRFBDRUIIXBNX-KBXCAEBGSA-N	444.326	1.481	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ncccc3F)CCO2)C1	1838252644	ZWGUWXFCSDZSEQ-YVEFUNNKSA-N	430.274	1.074	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3sccc3OC)CCO2)C1	1838299326	HDMGKIAUMRUTCL-FZKQIMNGSA-N	432.926	1.081	50	20	IDGD	
CC(=O)N[C@H](C)C(=O)N1CCC(OC2CCN(C(=O)[C@H](F)Br)CC2)CC1	1838647992	DSCMSYNAYAHMLE-ABAIWWIYSA-N	436.322	1.200	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccoc1Cl)CCO2	1838844464	QPIROLREIDKNGX-SFHVURJKSA-N	430.961	1.855	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(-n4cccn4)cc3)C2)C1	1839147045	FXJBXBDHUXOULE-KNQAVFIVSA-N	446.935	1.960	50	20	IDGD	
C=CCC(CC=C)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839199345	UQJGDQLVWMYMHD-MAUKXSAKSA-N	433.318	1.902	50	20	IDGD	
CCc1noc(C)c1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839200896	RSYISEHBFIUHPU-WMLDXEAASA-N	448.289	1.306	50	20	IDGD	
O=C(c1cnc2ccc(F)cn12)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1839591584	JIUFCHIMRBBMOS-QAPCUYQASA-N	428.823	1.078	50	20	IDGD	
C=C(C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)CBr)C2)C1)C(F)(F)F	1839891072	JWVPBXUNUNFCGL-NHYWBVRUSA-N	443.260	1.592	50	20	IDGD	
Cc1ccncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2	1840032794	KFXQYYUSZUTCHO-RDTXWAMCSA-N	426.311	1.243	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3CCc4ccoc4C3)C2)C1	1840150487	LTQGBIVQORDQIG-FIKGOQFSSA-N	440.924	1.095	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C#N)ccc3F)C2)C1	1840155393	ZWJWIKWEVDXIJO-OXQOHEQNSA-N	439.871	1.021	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3ccccc3F)CCO2)C1	1840547816	WWZMGJRYIQCZPG-UTKZUKDTSA-N	442.915	1.469	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)CCOCCOCCOCCOC)C2	1841668876	CALNXIPYOSCELG-SFHVURJKSA-N	448.988	1.684	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)C2(NC(=O)OCc3ccccc3)CC2)C1	1843928376	INZLVWLQVAZLGQ-QGZVFWFLSA-N	449.935	1.903	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC2(CCCN2C(=O)[C@H]2ON=C(c3ccccc3)O2)C1	1844195457	PFUBQLQNIKLTTJ-FZKQIMNGSA-N	436.306	1.956	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2cc(Cl)ccn2)C1	1844434599	DGKGFTGWPSVRME-ZMOGYAJESA-N	428.880	1.686	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(OC)cc(OC)c2)c1	3609792	GHHZGUGPGXQGIC-UHFFFAOYSA-N	435.502	1.809	50	20	IDGD	
O=C(COC(=O)CCNC(=O)C12CC3CC(CC(C3)C1)C2)NNC(=O)c1ccccc1	7413820	QGIPJFNHRLKSBU-UHFFFAOYSA-N	427.501	1.714	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)Nc2ccc(C(=O)NNc3nnc(C)c(=O)[nH]3)cc2)cc1	10899188	SYKSMLXHYBERSD-UHFFFAOYSA-N	442.457	1.234	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1OC	11028737	FJQYXEMPIQWWJF-UHFFFAOYSA-N	437.792	1.883	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)SC1=NS(=O)(=O)CCN12)c1ccc([N+](=O)[O-])cc1	12698913	YVVFXKRSTIZUEU-UHFFFAOYSA-N	447.454	1.281	50	20	IDGD	
Cc1nc(COc2ccc(C(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)cc2)no1	14044427	OLHYZGOAOUFICB-UHFFFAOYSA-N	434.412	1.279	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNS(=O)(=O)c2ccc(OC)cc2[N+](=O)[O-])cc1	23393578	KRYPJHWBQMRSKD-LBPRGKRZSA-N	439.446	1.779	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCN(Cc3cccc(Cl)c3)CC2)cc1OC	29053476	NYQAJRBQGOVEDP-UHFFFAOYSA-N	446.935	1.936	50	20	IDGD	
Cc1ccccc1CC(=O)N1CCN(CC(=O)NNC(=O)c2ccccc2Cl)CC1	109961178	UFHCGUVDOMBESV-UHFFFAOYSA-N	428.920	1.796	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)[C@H](C)N2C(=O)NC3(CCCC3)C2=O)cc1OC	726522596	PPWRZWFDTJWUAN-ZDUSSCGKSA-N	432.477	1.498	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)c1nc(N2CCCC2)ncc1Cl	726863353	OXBFCRMSRUNKJG-UHFFFAOYSA-N	436.925	1.928	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)CCNC(=O)c1n[nH]c2ccccc12	726883947	PDSKGAMAYQZZPD-UHFFFAOYSA-N	425.445	1.308	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)C(=O)c1ccc(Cl)cc1	727061847	PFXYEGVWXGYRPB-UHFFFAOYSA-N	435.889	1.768	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)NCc1cccc(NC(=O)NCc2ccncc2)c1	728958250	YWDNFOHNWQNGIO-UHFFFAOYSA-N	433.472	1.871	50	20	IDGD	
CS(=O)(=O)c1ccc(OCCNC(=O)NNC(=O)Cc2c[nH]c3ccccc23)cc1	730067011	SFRXYLXZJAGAQB-UHFFFAOYSA-N	430.486	1.523	50	20	IDGD	
CCOc1cc2c(cc1[C@@H]1C[C@@H]1C(=O)NNC(=O)c1ccc(-n3cnnn3)cc1)O[C@H](C)C2	730515565	PUJOCTHEDMZQIO-FMEYXAORSA-N	448.483	1.949	50	20	IDGD	
COc1cc(C=NNC(=O)[C@@H]2CCS(=O)(=O)C2)ccc1OC(=O)c1ccccc1F	730576661	TZWMCICEORSIQY-CQSZACIVSA-N	434.445	1.938	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)c1cccnc1	730781594	UCPBKMFGQAFTGS-SFHVURJKSA-N	434.452	1.355	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)NCc1ccc(NC(=O)c2ccncc2)cc1	730907364	ISLMDVIXUIAMIB-UHFFFAOYSA-N	435.440	1.949	50	20	IDGD	
C[C@@H]1CCCCN1CCOc1ccccc1C(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1	731186533	OTZCBQHHXVYYCE-HZPDHXFCSA-N	438.550	1.071	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)N1CCN(Cc2ccc3c(c2)OCCO3)CC1	731499876	MWYFKNOPHBJSBL-UHFFFAOYSA-N	426.473	1.639	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2cc(C)on2)c1	731500909	KHPGDTJBVITDKJ-UHFFFAOYSA-N	430.442	1.867	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)N[C@@H]1CCN(c2ccccc2Cl)C1=O	732236105	PCMOSRGZPYQJCP-CQSZACIVSA-N	432.864	1.863	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)CCCNC(=O)c2ccc(F)cc2F)C[C@@H](C)O1	732260725	GWAHUOSDSDUJMG-OKILXGFUSA-N	426.464	1.122	50	20	IDGD	
Cc1ccc(S(=O)(=O)n2ccc(C(=O)NNC(=O)COc3ccccc3O)c2)cc1	732290156	RECNJTZRPJWKDA-UHFFFAOYSA-N	429.454	1.579	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)N[C@H](Cc1ccccc1)CN1CCOCC1	732476594	PSYJBVXRPFPVKT-LJQANCHMSA-N	440.500	1.345	50	20	IDGD	
C[C@H](CS(C)(=O)=O)N(C)C(=O)NNC(=O)c1ccc(Br)cc1Cl	732677584	QSBOKSRKIHDZLN-MRVPVSSYSA-N	426.720	1.822	50	20	IDGD	
CSCC[C@@H](NC(=O)c1ccco1)C(=O)NNC(=O)c1cnn(-c2ccccc2)c1	733170198	SAFXEMBNBIIABW-MRXNPFEDSA-N	427.486	1.778	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NN=Cc2cccc(OCC(=O)O)c2)c1	733201276	QRMAAMISDLQIHF-UHFFFAOYSA-N	433.486	1.944	50	20	IDGD	
C=CCNS(=O)(=O)c1cc(C(=O)NNc2nc3ccccc3c(=O)n2C)ccc1F	733260905	DUEWXCGMKWKZCG-UHFFFAOYSA-N	431.449	1.294	50	20	IDGD	
CN(CC(=O)NNC(=O)c1ccccc1)C[C@H](O)COc1ccc(C(F)(F)F)cc1	733996357	GARHKHRTJWJGFX-INIZCTEOSA-N	425.407	1.838	50	20	IDGD	
COc1cc(OC)cc([C@@H](O)CNC(=O)NNC(=O)c2cccc(OC(F)F)c2)c1	735682285	GEZUVDUQKINYFT-INIZCTEOSA-N	425.388	1.983	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@]2(O)CCN(Cc3ccccc3)C2)ccc1OC(C)C	735840973	RHZCIHPMAOHEQO-QHCPKHFHSA-N	427.501	1.880	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CSc2nnnn2-c2ccc3c(c2)OCO3)cc1C	735979466	GKQSVFODOSINHP-UHFFFAOYSA-N	446.514	1.877	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)c2cc(-n3cccn3)ccn2)CC1	736111551	JCJOTJWMFHUJKP-UHFFFAOYSA-N	429.481	1.611	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)cc1C	736743415	ATLNTGLWLZVZNF-UHFFFAOYSA-N	435.414	1.874	50	20	IDGD	
O=C(COCc1ccccc1)NNS(=O)(=O)c1ccc(Br)cc1[N+](=O)[O-]	737756443	MJRWHXYQQIKWHK-UHFFFAOYSA-N	444.263	1.884	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)nn1	737778364	KNZNZZRYUYDVHB-UHFFFAOYSA-N	433.471	1.422	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)NCc1nc(-c2ccc(F)cc2)n[nH]1	741412298	AEUKXJMTCVVJPU-UHFFFAOYSA-N	429.368	1.428	50	20	IDGD	
COc1ccc(Br)cc1C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	741534585	JICFIGNLEOWQBL-UHFFFAOYSA-N	427.276	1.936	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(Br)c(F)c1)c1ccc2c(c1)OCCO2	743251468	QJQDLYDTGODRKC-UHFFFAOYSA-N	431.239	1.983	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)N1CCN(c2ncnc3ccsc23)CC1	743508361	OLPMODIQOUKYEQ-UHFFFAOYSA-N	436.501	1.824	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)N[C@@H]1CC(=O)N([C@H]2C[C@@H]2c2ccccc2)C1	743509950	NRXQRQGKQUUKGP-KURKYZTESA-N	438.484	1.561	50	20	IDGD	
COc1cccc(O[C@@H](C)CNC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)c1	743674354	VOHQHVFELQEUEJ-ZDUSSCGKSA-N	436.490	1.902	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCCc2nc(C(F)(F)F)cs2)c1	743701079	NNJSLHDGXFKCGF-UHFFFAOYSA-N	436.437	1.752	50	20	IDGD	
C[C@@H](NC(=O)c1n[nH]c2ccccc12)C(=O)NNC(=O)c1cc(Br)ccc1O	743733934	UYPIAUAYYJYKMI-SECBINFHSA-N	446.261	1.611	50	20	IDGD	
CCN(CC(=O)NNC(=O)c1cccc(C)c1)CC(=O)Nc1ccc(NC(C)=O)cc1	744383812	DEDORTWEGFFKPV-UHFFFAOYSA-N	425.489	1.675	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)c2cc(S(N)(=O)=O)c(Br)s2)cc1	744463756	OREKKMFAMKUEJI-UHFFFAOYSA-N	448.320	1.306	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)[C@@H]2CC(=O)N(c3ccccc3Cl)C2)cc1	744564587	NQCHRVUSZLCTLN-OAHLLOKOSA-N	440.843	1.569	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)c2cc(S(=O)(=O)NC3CC3)ccc2C)c1	744635831	XXLPYDJXPFNHOE-UHFFFAOYSA-N	445.497	1.362	50	20	IDGD	
CCc1c(C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)cnn1Cc1ccccc1	744744411	GIRHKQFPOFTFKJ-UHFFFAOYSA-N	431.452	1.983	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H]2CCN(C)[C@H](C)C2)c1	745855744	YIEHYBMVWUFNEQ-GDBMZVCRSA-N	425.555	1.144	50	20	IDGD	
COc1ccc2c(c1)OCC[C@H]2NC(=O)NNc1ccc(S(=O)(=O)NC(C)C)cn1	745861843	PHNDVTQBALIDPZ-MRXNPFEDSA-N	435.506	1.927	50	20	IDGD	
Cc1nn(CCCl)c(C)c1C(=O)N(C)C1CCN(CC(=O)N2CCN(C)CC2)CC1	746228670	ISHNVXFPSWWCMO-UHFFFAOYSA-N	439.004	1.049	50	20	IDGD	
O=C(CNc1ccccc1)NNC(=O)c1ccc(S(=O)(=O)Nc2nccs2)cc1	746292138	ANQGIEPRFVPXFD-UHFFFAOYSA-N	431.499	1.817	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)o2)o1	746393140	XTCFTYMDIBNJIE-UHFFFAOYSA-N	438.506	1.574	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)c2cc(S(N)(=O)=O)ccc2O)cc1OC	747336353	GEXGCWCQJLGNDH-UHFFFAOYSA-N	437.474	1.302	50	20	IDGD	
C[C@@H]1CCCC[C@]12NC(=O)N(CC(=O)NNc1nc(-c3ccccn3)nc3c1CCC3)C2=O	747983135	RGJYDDUDEDNCRV-FATZIPQQSA-N	449.515	1.971	50	20	IDGD	
CCc1cccc(NC(=O)CNC(=O)NNc2ccc(S(=O)(=O)N(CC)CC)cn2)c1	748460442	FNYKBQHSYVNXHW-UHFFFAOYSA-N	448.549	1.939	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)[C@](C)(O)Cc3ccccc3)cc2)CC1	748619549	KBALCRVZGWOAIB-OAQYLSRUSA-N	432.546	1.060	50	20	IDGD	
COCCOCC(=O)NC1CCC(C(=O)NNC(=O)Cc2cccc3ccccc23)CC1	748700982	JCVXRAPDYVLODS-UHFFFAOYSA-N	441.528	1.868	50	20	IDGD	
C[C@H](c1ccncc1)N1CCC(NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)CC1	749237497	SDCCEABGCPKXMM-OAHLLOKOSA-N	449.515	1.498	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)[C@@H](Cc2c[nH]c3cc(F)ccc23)NC(C)=O)c1	749330221	LWVFCPOMZQOOCG-HXUWFJFHSA-N	442.447	1.833	50	20	IDGD	
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	749583413	LVXMBHUMHOPOMB-JXFKEZNVSA-N	444.557	1.945	50	20	IDGD	
COc1cc(OC)cc(-n2nnnc2CN(C)C(=O)NNC(=O)c2ccc(C#N)cc2)c1	752007457	QDMZJQAAJCHYKZ-UHFFFAOYSA-N	436.432	1.038	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)c1noc(Cc2ccccc2)n1	753053124	YGPACJZKVNCDFU-CYBMUJFWSA-N	443.485	1.769	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)Cc2ccc(I)cc2)C[C@@H](C)O1	754174815	XZIHKXZUQNUEHJ-BETUJISGSA-N	445.301	1.480	50	20	IDGD	
N#C/C(=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)NC[C@]1(O)CCOC1	755219243	QAAXHOQDCVUFOD-WHIQYKQFSA-N	443.891	1.253	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(CCC(=O)NNC(=O)Cc2cc[nH]n2)c2ccccc2)cc1	755283985	HWCDWWATGNYVRK-UHFFFAOYSA-N	441.513	1.694	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2ccc(CC(=O)N(C)C)cc2)c2ccccc2c1=O	755916820	NSNACVNSRZQMDS-UHFFFAOYSA-N	436.472	1.514	50	20	IDGD	
COc1ccc(C(F)(F)C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1	756344507	JQRJSHJFOMBMMT-INIZCTEOSA-N	436.367	1.318	50	20	IDGD	
CCn1nnnc1-c1cccc(NC(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)c1	756686118	PRMIIDLBBQSTCQ-UHFFFAOYSA-N	432.485	1.818	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CCc2ncc(NC(=O)NNC(=O)c3cnccn3)cc2C1	757929324	QEXGZJMBZOHUGO-CYBMUJFWSA-N	427.465	1.720	50	20	IDGD	
COCCCOc1ccc(C(=O)N2CCN(S(=O)(=O)CBr)CC2)cc1	758516561	DHGJLKQYOJHGSZ-UHFFFAOYSA-N	435.340	1.542	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)N[C@@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1C#N	758753534	PRUBFJKEEQAQGX-UONOGXRCSA-N	449.533	1.877	50	20	IDGD	
CC(=O)c1cccc(OCC(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)c1	758781446	DOWFENPXVSNXJZ-UHFFFAOYSA-N	434.493	1.904	50	20	IDGD	
C[C@H](O)C[C@H](CNC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)c1ccccc1	759610938	MWEAVGGZSLHMAI-GOEBONIOSA-N	434.518	1.981	50	20	IDGD	
O=C(NC[C@@]1(Cc2ccc(F)cc2)CCC[C@@H]1O)NNC(=O)C(=O)Nc1ccccn1	759690976	YKLFKQRVOCHQOK-KKSFZXQISA-N	429.452	1.264	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NC[C@@]1(Cc2ccc(F)cc2)CCC[C@H]1O	759691233	BAODJMQRCQUVNO-UTKZUKDTSA-N	448.520	1.721	50	20	IDGD	
Cc1cc(O)cc(=O)n1CC(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1	759770427	YEXBEDILAXEASS-JOCHJYFZSA-N	446.507	1.637	50	20	IDGD	
CC(C)NC(=O)N1CCC[C@H]1C(=O)NNC(=O)[C@@H](C)Oc1cccc(Br)c1	760295779	SKQAHNNMODTNAA-DOMZBBRYSA-N	441.326	1.946	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@@H](CCC(N)=O)C(=O)NNc2cccc(C#N)c2)cc1C	760461015	WRNJMXYKRCRCCA-SFHVURJKSA-N	429.502	1.231	50	20	IDGD	
COCCCNC(=S)N(C)NC(=O)c1ccc2c(=O)n(-c3ccccc3)c(O)nc2c1	761789028	AZUZMYRJGAITHN-UHFFFAOYSA-N	441.513	1.579	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)NCc1cccnc1N1CCOCC1	763462927	OJIZLJWZDDHCJL-UHFFFAOYSA-N	436.513	1.054	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cccc3c2CCCC3)cc(OC)c1OC	763540644	XQFMHCGTRAQGAO-UHFFFAOYSA-N	427.457	1.991	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)C(=O)Nc1ccc(OC[C@@H]2CCCO2)cc1	763549309	XECZLFSBIQZUGV-INIZCTEOSA-N	427.413	1.373	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)C(=O)Nc1cccc2c1CN(c1ccccn1)C2	763559821	WEIXSSQULOLHRY-UHFFFAOYSA-N	445.435	1.730	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2c(C)nc3ccccn23)n([C@H]2C[C@H]3CC[C@H]2C3)n1	763629812	UCQPBCSUQRJHNF-JYJNAYRXSA-N	435.488	1.908	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(CS(=O)(=O)C(C)C)c2)c1	763630466	MCKLPFVQAKGHAU-UHFFFAOYSA-N	447.513	1.483	50	20	IDGD	
COc1ccncc1NC(=O)C(=O)NNC(=O)COc1ccccc1Cc1ccccc1	763718153	IDDDVUMXNLPTTA-UHFFFAOYSA-N	434.452	1.846	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)C(=O)Nc2cc3c(cc2[N+](=O)[O-])OCCCO3)c1	763758020	LAHNHQLJRYAHBK-UHFFFAOYSA-N	443.416	1.222	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(-c3nnc(N(C)C)o3)cc2)c1	763759252	YEDKXTCYOYZSBK-UHFFFAOYSA-N	437.460	1.268	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccnn1CCc1ccccc1	763864408	IMVRHNLNTNJTMC-HNNXBMFYSA-N	439.447	1.818	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(C(C)=O)cc2)c(F)c1	763872623	PAIBGAKEPJYPOH-LBPRGKRZSA-N	445.403	1.368	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(C(C)=O)c(C)c2)cc1	763877978	NGNNZEQALMEOJR-OAHLLOKOSA-N	425.441	1.954	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccccc2O[C@@H](C)C#N)cc1OC	763900115	ANUJKAKGSURBEJ-ZDUSSCGKSA-N	426.429	1.784	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(N)=O)c(F)c2)cc1OC	763911300	KCGBIHATLZVPRP-UHFFFAOYSA-N	432.408	1.122	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)OC)cc2)cc1OC	763911888	PSZUVWIQJCMUIY-UHFFFAOYSA-N	429.429	1.670	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(F)c2C(=O)OC)cc1OC	763911904	QRDCEZNGWVZVEQ-UHFFFAOYSA-N	447.419	1.809	50	20	IDGD	
O=C(NNC(=O)c1ccc(Br)s1)C(=O)Nc1cnn(-c2ccncc2)c1	763939129	JQEWAFYPVPKIFZ-UHFFFAOYSA-N	435.263	1.491	50	20	IDGD	
COC(=O)COc1cccc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CC[C@H](C)C3)c1	763942854	PDGDZRAOXZMVHA-LBPRGKRZSA-N	445.497	1.824	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)C(=O)N1CCc2cc(F)c(F)cc21	763945064	UGYNAAZLBYWDRT-UHFFFAOYSA-N	427.367	1.206	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)cc1C(=O)NC(C)C	763977341	OFMOPHPFQGARSO-UHFFFAOYSA-N	432.864	1.892	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)c(OC)cc1Cl	764003713	LJVOAOJNCWPQGB-UHFFFAOYSA-N	435.820	1.528	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1cc(F)c(N2CCCC2)c(F)c1	764004632	ZSYJJAZETBTIAS-UHFFFAOYSA-N	446.410	1.736	50	20	IDGD	
C=CCN(CC=C)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)Cc2ccsc2)cc1	764033005	CYDHTQRFCKKXEQ-UHFFFAOYSA-N	426.498	1.891	50	20	IDGD	
COCC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(Br)c2)cc1	764063073	KKPHULRMJQIVKX-UHFFFAOYSA-N	449.261	1.434	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)OC2(CCCC2)O3)c1O	764133966	ZKGZMJWTIMEAFC-UHFFFAOYSA-N	427.413	1.842	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(CC(C)(C)C)nn2C)o1	764139219	OGUNOZWVJHKMIJ-UHFFFAOYSA-N	432.525	1.843	50	20	IDGD	
Cc1cc(C(=O)N2CCCC2)ccc1NC(=O)C(=O)NNC(=O)[C@@H]1Cc2ccccc2O1	764167550	KSURPAYVYPBJSJ-IBGZPJMESA-N	436.468	1.321	50	20	IDGD	
CCOC(=O)c1cn(C)nc1NC(=O)C(=O)NNC(=O)c1c(Cl)cccc1Cl	764221010	GBRHWYBIALKBOK-UHFFFAOYSA-N	428.232	1.303	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)C(=O)Nc1cc2c(cc1[N+](=O)[O-])OCCCO2	764314482	XZPZZSVSWLKEBT-UHFFFAOYSA-N	432.364	1.224	50	20	IDGD	
N#Cc1ccccc1COc1ccc(C(=O)NNC(=O)CNC(=O)c2cccnc2)cc1	764342019	BVPPPVNDSMRDTC-UHFFFAOYSA-N	429.436	1.723	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)c(C)c1	764349212	LKMVJMVCMWYMFF-UHFFFAOYSA-N	435.820	1.306	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1)C(=O)Nc1ccc(Cn2cncn2)cc1	764387678	MBRSFVROIUHCKG-UHFFFAOYSA-N	448.418	1.255	50	20	IDGD	
N#C[C@H](c1ccccc1)c1ccc(NC(=O)C(=O)NNC(=O)[C@H]2COCCO2)cc1Cl	764427440	ZSOIZPFLRJDDDS-SJLPKXTDSA-N	442.859	1.497	50	20	IDGD	
CC(=NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1)c1ccc(C#N)cc1	764816619	MFAQEVQSVHCHOX-UHFFFAOYSA-N	439.541	1.713	50	20	IDGD	
CC(C)(C)OC(=O)NCC1(CC(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)CCCCC1	766107679	VMIJKSWAIBGPKL-AWEZNQCLSA-N	431.555	1.434	50	20	IDGD	
CN(C1CCCCC1)S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2cnccn2)cc1	766256047	DAZYUWOZQDBPDS-UHFFFAOYSA-N	432.506	1.512	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)CN1CCN(C(=O)Cc2ccccc2Cl)CC1	766859687	SLNGKIOEAUJSSH-UHFFFAOYSA-N	442.947	1.725	50	20	IDGD	
O=C(CCC(=O)N1CCN(c2ccccc2)CC1)NNC(=O)c1cc(Cl)ccc1O	767841018	VXBKFJBKOURKBT-UHFFFAOYSA-N	430.892	1.936	50	20	IDGD	
CC(C)c1cc(NC(=O)C(=O)NNC(=O)c2cccc3ncccc23)n(-c2ncccn2)n1	768240490	XFRSSDDDRIVDOX-UHFFFAOYSA-N	444.455	1.734	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)Cc2c(C)nc3cc(O)nn3c2C)n[nH]1	768274721	XMRURVHIFWJAMC-UHFFFAOYSA-N	435.444	1.454	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@H](C(=O)NNC(=O)c2cc(-c3ccc(OC)c(OC)c3)[nH]n2)C1	768275635	DMPPWPKIMJJAQL-UONOGXRCSA-N	430.461	1.834	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCN(c3ccc(C#N)cc3Cl)CC2)n1	769920274	HGMZWRFYYRORCP-UHFFFAOYSA-N	432.937	1.489	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)NC[C@@H](c3ccc(Cl)cc3)N3CCOCC3)nc21	770364701	NGWWIYOSPZZDBH-HNNXBMFYSA-N	446.899	1.422	50	20	IDGD	
Cc1nc(NCC(=O)NNC(=O)C(=O)N2CCCC2)c2cc(-c3ccccc3)sc2n1	770950051	ZALUAIYCRTYALU-UHFFFAOYSA-N	438.513	1.848	50	20	IDGD	
COc1cc(C(=O)NNc2ccnc(Br)c2)cc(NS(C)(=O)=O)c1OC	771560730	IYKNMSYIZNJCPV-UHFFFAOYSA-N	445.295	1.990	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2nccnc2C(C)C)c(C)c1S(=O)(=O)NC1CC1	773992535	PTPVJZQUCGDJME-UHFFFAOYSA-N	446.533	1.739	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccc(Cn2cncn2)cc1	774008641	KFRWKAXGVFFRFO-CYBMUJFWSA-N	442.863	1.533	50	20	IDGD	
O=C(CCSc1ccc(F)cc1)NNC(=O)N[C@@H]1CCO[C@]2(CCS(=O)(=O)C2)C1	776077189	SFRRRJJNBHMPII-RDTXWAMCSA-N	445.538	1.375	50	20	IDGD	
O=C(NNC(=O)c1c[nH]nc1-c1ccsc1)c1cccc(S(=O)(=O)N2CCCC2)c1	780155267	ZYEJPZYFFDIMEC-UHFFFAOYSA-N	445.526	1.998	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(CNC(=O)NNc2cccc(C(=O)OC)c2)cc1	780822095	XNGGPAHOAPOWBU-UHFFFAOYSA-N	436.490	1.224	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)CCC(=O)N2CC(F)(F)F	782120592	JZACLXWTERTEQJ-UHFFFAOYSA-N	437.378	1.266	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2cccc(C(=O)Nc3ccc(OC)nc3)c2)nc1	782148470	WFTIMXOAOHENEO-UHFFFAOYSA-N	436.428	1.828	50	20	IDGD	
NC(=O)c1n[nH]c2ccc(NC(=O)C(=O)NNc3ncc(C(F)(F)F)cc3Cl)cc12	782853253	APBUYBCHQMHUQK-UHFFFAOYSA-N	441.757	1.811	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C(=O)Nc2cc(F)ccc2Br)nc2ccccc21	782893634	KHZDUPRYTCLNQU-UHFFFAOYSA-N	448.252	1.804	50	20	IDGD	
O=C(NNc1ncnc2ccsc12)C(=O)Nc1ccc(F)c(-n2nnnc2C2CC2)c1	783254597	GKMNHCZCBOWCKP-UHFFFAOYSA-N	439.436	1.765	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)C(=O)N2CCCc3ccc(F)cc32)nc1	783264391	ORKRNVNLQMUADP-UHFFFAOYSA-N	435.481	1.330	50	20	IDGD	
CC(=O)N1CCN(Cc2cccc(NC(=O)C(=O)NNc3ccc(F)cc3F)c2)CC1	783342806	MAMLLKRIXPETFX-UHFFFAOYSA-N	431.443	1.711	50	20	IDGD	
O=C(CSc1nnc(O)nc1O)NN=Cc1ccc(OCc2ccccc2)cc1O	783823064	ZTJQRPGYGMGUCQ-UHFFFAOYSA-N	427.442	1.810	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)C(=O)Nc1cc(F)c(F)c(F)c1	784210255	KQIKKTKWCKQZNM-UHFFFAOYSA-N	428.392	1.626	50	20	IDGD	
COCCOc1cc(NC(=O)C(=O)NNc2ccc(Br)cn2)ccc1OC	784339565	MIWKWYMMFPMNNJ-UHFFFAOYSA-N	439.266	1.960	50	20	IDGD	
O=C1C[C@H](Cc2ccc(NC(=O)C(=O)NNc3ccc([N+](=O)[O-])cc3Cl)cc2)C(=O)N1	784392896	PSTNRXVLBZXMMU-NSHDSACASA-N	445.819	1.535	50	20	IDGD	
COc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NNc1ccc(Br)nc1	784807295	YRALKHVOVQTFFK-UHFFFAOYSA-N	436.266	1.636	50	20	IDGD	
CCN1CCN(C(=O)c2ccc(NC(=O)C(=O)NNc3cc(Cl)ccn3)cc2)CC1	784856050	DIOJWRGXITXQQP-UHFFFAOYSA-N	430.896	1.595	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)C(=O)Nc1ccc(Br)cc1F	785065034	INDUMKZUABDPET-UHFFFAOYSA-N	434.225	1.565	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1cccc(C(=O)NC2CC2)c1	785330350	FSOKYPPABXDQRN-UHFFFAOYSA-N	446.485	1.073	50	20	IDGD	
Cc1c(NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cccc1N1CCNC1=O	786345859	QACGKDORWIZXHE-UHFFFAOYSA-N	438.492	1.384	50	20	IDGD	
Cn1cc(-c2ncccc2NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)cn1	786414727	QKXBBAMHOZCYBU-UHFFFAOYSA-N	433.472	1.021	50	20	IDGD	
O=C(COC(=O)CCc1nnc(C2CCCC2)o1)NNC(=O)[C@@H]1COc2ccccc2O1	786747124	AZBBYNXNPRDUCB-INIZCTEOSA-N	444.444	1.190	50	20	IDGD	
O=C(O)c1cc([N+](=O)[O-])cc(S(=O)(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)c1	788500235	ITXGHHZCFCDDEX-HOTGVXAUSA-N	435.414	1.175	50	20	IDGD	
Cc1ccccc1CS(=O)(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	788917873	XBQFDDAYJFXNKM-UHFFFAOYSA-N	426.539	1.934	50	20	IDGD	
CC[C@@H]1CCc2nc(NC(=O)C(=O)NNC(=O)Cc3nc4ccccc4n3C)sc2C1	789749476	QAFUOQQKHPRMEQ-GFCCVEGCSA-N	440.529	1.873	50	20	IDGD	
O=C(NNC(=O)[C@H]1OCC[C@H]1c1ccccc1)C(=O)Nc1csc(-c2ccccn2)n1	789811220	XNLIWADXTMJEJV-YOEHRIQHSA-N	437.481	1.864	50	20	IDGD	
C[C@@H]1CC(=O)C[C@H](C(=O)NNC(=O)c2ccccc2)[C@H]1C(=O)NNC(=O)c1ccccc1	791122371	YJEWVUFTULXBIS-CCKFTAQKSA-N	436.468	1.140	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc3nccnc3cc2F)c1	792012036	LOCNPXPARJOOCX-UHFFFAOYSA-N	445.476	1.874	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C2(NC(=O)NC(C)C)CCCCC2)c2ccccc2c1=O	792018370	XGNVDRPNUGBUCT-UHFFFAOYSA-N	442.520	1.588	50	20	IDGD	
O=C(NNc1cnc2ccccc2n1)C(=O)Nc1ccc(Cc2nnc3n2CCC3)cc1	792273638	NNVGUWWURXNLEJ-UHFFFAOYSA-N	428.456	1.840	50	20	IDGD	
CCOC(=O)CON=C(C(=O)NNC(=S)Nc1ccccc1C(C)C)c1cc[nH]n1	792490746	NXLVAQHAJIENTQ-UHFFFAOYSA-N	432.506	1.835	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)c(F)cc1C	793021897	NQJCWSHADJLVHM-UHFFFAOYSA-N	435.383	1.615	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)c(F)cc1C	793022907	FCRZACGBUIKISU-UHFFFAOYSA-N	442.403	1.347	50	20	IDGD	
C[C@@](O)(CN1C(=O)NC2(CCCC2)C1=O)C(=O)NNc1ccc(OC(F)(F)F)cc1	793707426	WNPHDSPBQNNUFR-MRXNPFEDSA-N	430.383	1.644	50	20	IDGD	
COCCNC(=O)c1cccc(S(=O)(=O)NNC(=O)c2c(Cl)cccc2Cl)c1	795321280	VLPSQMFEHFPMSH-UHFFFAOYSA-N	446.312	1.993	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)C[C@@H]2CN(Cc3ccccc3)CCO2)cc1	802065404	YSCTUUXHWIUCKL-GOSISDBHSA-N	446.529	1.534	50	20	IDGD	
O=C(NNc1cccc(F)n1)C1CCN(S(=O)(=O)c2ccc3c(c2)OCCO3)CC1	804770635	LITMQUUEVQIZRA-UHFFFAOYSA-N	436.465	1.536	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCCC(=O)NNc1ccc(-n2ccnc2)nn1	804958164	MEVVNLPXPVRBEA-CQSZACIVSA-N	444.496	1.011	50	20	IDGD	
C[C@@H](C#N)S(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1	806458997	RZJHOVFPBBRDJY-SJCJKPOMSA-N	430.442	1.365	50	20	IDGD	
COC(=O)c1cc(C)c(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)c(Cl)c1	806972861	PDHRJIBQTWWZBK-OAHLLOKOSA-N	447.831	1.361	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@@H](C)C(=O)NNC(=O)C(=O)N=c1ccnc2n(C)[nH]cc1-2	806974513	CLYAFODPMWTPQY-LBPRGKRZSA-N	444.879	1.165	50	20	IDGD	
COCc1csc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc3ccccc3c2)n1	806975127	OOZUMJSQTMQMPG-GFCCVEGCSA-N	428.470	1.996	50	20	IDGD	
CC[C@H]1[C@@H](C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)CCN1C(=O)OC(C)(C)C	810348682	QXXHIYFZKUISRR-IRXDYDNUSA-N	446.552	1.876	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)[C@H]2CCN(c3ccccc3F)C2)cc1OC	811375256	CJYYQQFVOVOMQD-HNNXBMFYSA-N	445.447	1.674	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N2CCN(c3snc(C)c3C#N)CC2)c(OC)c1	811876528	QLXHYFBXIDNLDK-UHFFFAOYSA-N	430.490	1.517	50	20	IDGD	
Cc1ccc(S(=O)(=O)NC2CC2)cc1C(=O)NNC(=O)[C@@H](C)Oc1ccc(F)cc1	811884884	DNKAQKATHVNDBL-CYBMUJFWSA-N	435.477	1.803	50	20	IDGD	
COC(=O)c1ccc(NC(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)c(N(C)C)c1	812966539	SSTJOHNTKZOWPT-UHFFFAOYSA-N	435.506	1.938	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)Nc3cn(C)nn3)c2)c(C)c1	813011809	OLXGNQJYINIVDL-UHFFFAOYSA-N	443.489	1.699	50	20	IDGD	
Cc1ccc(-c2nnco2)cc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	813033864	OOTZXNDQYKWPIM-UHFFFAOYSA-N	444.473	1.377	50	20	IDGD	
COc1ccc(Br)c(C(=O)NCCCNC(=O)NNc2ncncc2F)c1	814324172	ZBFAKATVCUOKDS-UHFFFAOYSA-N	441.261	1.833	50	20	IDGD	
O=C(NNC(=O)c1cccc(C(F)(F)F)c1)C(=O)Nc1cn(Cc2ccccc2)nn1	815567726	JIJWUUBOMWLHHR-UHFFFAOYSA-N	432.362	1.745	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)cccc1-c1ncco1	815582781	PEYQSPDITZCSGD-UHFFFAOYSA-N	432.440	1.865	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)c2ccnc(-c3ncc[nH]3)c2)CC1	815634369	JLFJEFNPYQCBPE-UHFFFAOYSA-N	429.481	1.815	50	20	IDGD	
COC(=O)c1cc(N2CCOCC2)ccc1NC(=O)C(=O)NNc1cccc(Cl)n1	815728551	IOBVCKBCYWBXBU-UHFFFAOYSA-N	433.852	1.440	50	20	IDGD	
COc1ccc(COc2cccc(F)c2)cc1NC(=O)C(=O)NNC(=O)[C@H]1CCCO1	815779836	YAPNGNDTRMDNCV-GOSISDBHSA-N	431.420	1.678	50	20	IDGD	
CN1CCN(C(=O)NNC(=O)C2(c3ccc(Br)cc3)CCOCC2)CC1	819720756	GRVBBEVZLPYXBS-UHFFFAOYSA-N	425.327	1.486	50	20	IDGD	
C=Cc1ccc(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1	821118971	JFNGLDZJNONIRK-UHFFFAOYSA-N	435.527	1.737	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCCCN1CCOCC1	838499148	ZQNANMSRZUSCDV-CYBMUJFWSA-N	429.315	1.269	50	20	IDGD	
O=C(COC(=O)c1cccc(OC[C@H]2CCCO2)c1)NNC(=O)c1cccc([N+](=O)[O-])c1	844475296	ZYMOIUOTQPQQDW-GOSISDBHSA-N	443.412	1.771	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)CNS(=O)(=O)c2c(F)cccc2F)c(C)c1	913164195	ACGDZURLRCAYLV-UHFFFAOYSA-N	426.445	1.119	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N(C)c2ccc(OCC(=O)NNC(=O)OC)cc2)cc1	913176644	AMHTZZMZFYWCRY-UHFFFAOYSA-N	437.474	1.676	50	20	IDGD	
CCOC(=O)c1ccc(C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)nc1C	915044714	SRKHNZMIULEFHF-UHFFFAOYSA-N	430.373	1.093	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2oc3c(c2C)C(=O)CCC3)cc1OC	915453395	NHYAFDCQWPIPLQ-UHFFFAOYSA-N	430.413	1.742	50	20	IDGD	
O=C(CCOC[C@@H]1CCCO1)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	915618288	FICFIPNEZMUEBM-KRWDZBQOSA-N	439.534	1.208	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2cn3ccccc3n2)c1	915907248	FXDTZQSGVPVLKZ-UHFFFAOYSA-N	444.517	1.509	50	20	IDGD	
COc1cc(-n2cnnn2)c(Cl)cc1C(=O)NNC(=O)Cc1nc2ccccc2n1C	916116490	DRFOCVSCDFKYCT-UHFFFAOYSA-N	440.851	1.215	50	20	IDGD	
CCOc1ccc(NC(=S)NNC(=O)CNC(=O)c2c[nH]c3ccccc3c2=O)cc1	916163102	PKXFZACNPSGBAD-UHFFFAOYSA-N	439.497	1.674	50	20	IDGD	
CNS(=O)(=O)Cc1ccc(CNC(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)cc1	916228870	NJCNBTJXEBRJDH-INIZCTEOSA-N	448.545	1.651	50	20	IDGD	
O=C(CSCc1ccncc1)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	916734419	FYYQMFIAIGOOHA-UHFFFAOYSA-N	434.543	1.561	50	20	IDGD	
CCCn1c(C)cc(/C=C(/C#N)C(=O)NS(=O)(=O)c2cccc(-n3cnnn3)c2)c1C	916763900	ANSIZDKOSMRYIE-YVLHZVERSA-N	439.501	1.903	50	20	IDGD	
O=C(COC(=O)c1cncn1-c1ccc(F)cc1)NNC(=O)[C@@H]1COc2ccccc2O1	917248138	HRZDQRWTBHJXQV-SFHVURJKSA-N	440.387	1.156	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)COc1ccc(C#N)cc1)c1cccc(NS(C)(=O)=O)c1	918086772	OXVDJRZNROCMIH-CYBMUJFWSA-N	431.474	1.400	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cnc3n[nH]c(C)c3c2)c1	918186705	GWJXBAWTIABDHM-UHFFFAOYSA-N	430.490	1.372	50	20	IDGD	
CS(=O)(=O)N1CCN(C(=O)/C(C#N)=C/c2cn(CCC#N)nc2-c2ccccc2)CC1	918218803	RQHKOFAMLONGON-NBVRZTHBSA-N	438.513	1.475	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(F)c(S(=O)(=O)N(C)C)c2)cc1	919445505	RBHAUKPTVCHZCR-UHFFFAOYSA-N	437.449	1.002	50	20	IDGD	
O=C(NNC(=O)c1cc2ccccc2n1Cc1ccccc1F)N[C@@H]1CCS(=O)(=O)C1	919884628	HEWUFGZUEKNIQY-MRXNPFEDSA-N	444.488	1.960	50	20	IDGD	
Cc1cc(C(=O)NNS(=O)(=O)c2cc3c(c(C(=O)O)c2)OCCO3)c2ccccc2n1	919955025	ZZLDNEOWDQEBRB-UHFFFAOYSA-N	443.437	1.636	50	20	IDGD	
O=C(CN1CCCC1=O)NNC(=O)[C@H]1CCCN1C(=O)c1cc(Cl)ccc1Cl	920435054	BKKBECXIFWHSRJ-CQSZACIVSA-N	427.288	1.368	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)Nc2nc(CN3C[C@H](C)O[C@@H](C)C3)cs2)cc1	920930234	BMQFMXIJHSFSIJ-KBPBESRZSA-N	449.533	1.993	50	20	IDGD	
CCC1CC(=O)C(=CNNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)C(=O)C1	920975337	DUKXOTULZFBOKU-UHFFFAOYSA-N	433.530	1.938	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)CNC(=O)OCc2ccccc2)c2ccccc2c1=O	921301024	JEENVBMTBGTCKQ-UHFFFAOYSA-N	437.456	1.665	50	20	IDGD	
COc1ccc(-c2cc(NC(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)ccc2OC)cc1	1320106084	MLOMLQZMRVWLOK-LBPRGKRZSA-N	436.490	1.461	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cnn1C1CCCC1	1336289963	QSRHRAPAKOHERA-UHFFFAOYSA-N	425.898	1.682	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(O)nc(O)n2)C1	1778018592	VNOQRZUPCNCXOK-NXOUGTEYSA-N	447.319	1.252	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)[C@@]3(F)CCCCC3(F)F)C2)C1	1778222690	JOXJQNFYWJGYKE-OALUTQOASA-N	448.486	1.107	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc3n(n2)CCC3)C1	1779123548	IONVBJYLKQPCGM-URKNILKWSA-N	439.354	1.740	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)C[C@@H](O)CNC(=O)OC(C)(C)C)C2)C1	1781354415	FAVXBHFZUJSFHI-QEEYODRMSA-N	447.960	1.109	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)Cc2ccc(O)cn2)C1	1782633744	USTOMMTVIBYRKP-WIYYLYMNSA-N	435.597	1.695	50	20	IDGD	
CO[C@H](C)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](Br)Cc3ccccc3)C2)C1	1783021733	GMTZVGBWWDAEDQ-MDYRTPRTSA-N	439.350	1.857	50	20	IDGD	
CCC[C@H]1CC[C@H](C(=O)N2CC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)CC1	1783362307	LQLRMAQTENXAJU-KHCICDEESA-N	442.365	1.416	50	20	IDGD	
Cc1nc(CC(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](C)Br)C3)C2)c(C)s1	1783532186	JUOSBULNACWRHU-PIGZYNQJSA-N	430.368	1.916	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)CSc3ncccn3)CCO2)C1	1783533501	YFZREYNJOCZZIX-WBMJQRKESA-N	429.340	1.182	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](C)n1ccccc1=O)CCO2	1783534313	SNIXXLMTDIFAQP-SUNYJGFJSA-N	426.311	1.023	50	20	IDGD	
CC(C)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc4ncnn4c3)C[C@@H]21	1783851806	ILPJTJYFKNGTSA-ULQDDVLXSA-N	433.940	1.517	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(-n4cccn4)cc3)CCO2)C1	1783882494	ZWIWHQBZRCDZTC-GHTZIAJQSA-N	432.908	1.570	50	20	IDGD	
O=C(c1nnc(-c2ccccc2)o1)N1CCO[C@@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783946825	UNSNPLCBCCRYAF-GOSISDBHSA-N	425.272	1.984	50	20	IDGD	
COc1cnc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)Br)C[C@@H]32)c(F)c1	1785738633	CATFPZOBIWKUMS-MPXAEWJHSA-N	444.301	1.606	50	20	IDGD	
Cc1nn(C)c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]32)c1F	1785778801	HRGNLMZBRWXQPB-PAKFGRKTSA-N	435.327	1.697	50	20	IDGD	
O=C(Cc1ccc(C(F)(F)F)cc1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21	1786548044	MFXUEEMKFHDVHX-HJWJTTGWSA-N	448.869	1.827	50	20	IDGD	
CC(=O)N/C(C)=C/C(=O)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1	1788150407	JHYBLHSCVJGKHT-FYWRMAATSA-N	435.289	1.154	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc4c3NC(=O)C4=O)[C@H]2C1	1788436198	UHBBBNBSNDVUCE-KSYCFECVSA-N	433.892	1.432	50	20	IDGD	
CCOC(=O)c1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](Cl)CC)C[C@@H]32)ccn1	1789339066	ZXJOQDWQTOBJLV-CUSZFKRNSA-N	437.924	1.869	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3CCCN(C)C3)[C@H]2C1	1789740776	KKPNBLRBLWZIRF-XAJHFOFHSA-N	430.387	1.339	50	20	IDGD	
Cc1ncncc1C(=O)Nc1ccc(C2(NC(=O)c3cnccc3C(=O)NN)CCC2)cc1	1789830320	MJJUWIIGLWSJTJ-UHFFFAOYSA-N	445.483	1.845	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cn3cnc4ccccc43)C[C@@H]21	1791257682	OCWCBEYMHDPOSG-GGXPGOJBSA-N	434.924	1.270	50	20	IDGD	
COC(=O)[C@H]1CC=CC[C@H]1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]2C1	1791298143	DRVLZYGDMPXFNC-AICCOOGYSA-N	433.332	1.525	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CSc3nc[nH]n3)[C@H]2C1	1791558044	JSOSTFOVLWQLSD-CENBSLRLSA-N	436.365	1.113	50	20	IDGD	
CC(C)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(O)c([N+](=O)[O-])c1)C2	1792784728	RBKKVEUHIZQGFX-YWVIFJGQSA-N	425.869	1.769	50	20	IDGD	
C[C@H]1C[C@@]1(C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1793879054	CWUASWKSYAVJMF-PYWNROJRSA-N	443.972	1.754	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CNC(=O)c1cccnc1	1794226504	RMHLGNQQGLXFFV-YGTYGHESSA-N	427.332	1.686	50	20	IDGD	
CO[C@@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnccc1C(=O)NN)C2)c1ccccc1	1795564502	DYRCYOWABYECMT-AXVVYFOYSA-N	437.500	1.325	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc[nH]c2nccc1-2	1796181282	FBUUJRRXBMYHCH-JFILPPLUSA-N	435.322	1.749	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)c1c(F)ccc(Cl)c1F	1796192350	CDIULBVOEZJSCK-QDMKHBRRSA-N	448.662	1.864	50	20	IDGD	
CC(C)(C)c1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)[nH]n1	1798439977	QSNCRGGATUHRJM-BTTYYORXSA-N	439.520	1.271	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C(Cl)(Cl)Cl)C2	1798443038	NTRYWOQYCKUDQJ-ILWJIGKKSA-N	434.711	1.307	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(Cl)cc(Cl)n1)c1ccc(B(O)O)cc1	1798986151	LAGOGPVHIFNGLK-MUJYYYPQSA-N	448.115	1.634	50	20	IDGD	
COc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Br)C3)c(C)c1	1799024474	CSTSAHLVHJCTGF-VZAMPYOESA-N	429.286	1.897	50	20	IDGD	
O=C(Cc1cc2cccnc2cc1F)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2	1799240875	GLJGTYGSNVZDTC-ZDUSMZPESA-N	435.883	1.106	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(C(=O)O)n(C(C)C)n1)C2	1799264012	AFBKLHRZRWMVSA-OQMKEHIESA-N	426.901	1.383	50	20	IDGD	
COc1ccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Br)cc1O	1799343400	UZWXDRQJJFYBTA-CZAMWMTLSA-N	445.285	1.223	50	20	IDGD	
CN(C)c1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Br)nc1	1799347463	LNMRHEUFTXSVDU-JLUCKKNBSA-N	429.290	1.041	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CC1CCC(C)(C)CC1	1799402490	LPEDKBUTKLPPSC-OPMZPASUSA-N	436.597	1.556	50	20	IDGD	
CN(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1(F)CC1)C2)NC(=O)NCc1ccccc1	1799869599	UFRFHCRQAKVKBM-BCDXTJNWSA-N	431.512	1.473	50	20	IDGD	
CN1CCN(C2(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)[C@H](F)Br)C4)CC2)CC1	1799977918	LRKHYIGKNKIEHS-XGUBFFRZSA-N	431.350	1.095	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(-c2cnco2)c1)c1ccc(B(O)O)cc1	1800547242	FPPNBZQLVUJPGA-WKCHPHFGSA-N	445.284	1.587	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccc2c(c1)CCO2	1800689318	AWFQSXLUKYGETP-ZSKVKKPNSA-N	437.334	1.537	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1C[C@@]12C(=O)Nc1ccccc12	1800733885	YMIAFFTXKMTSMV-OORABABHSA-N	445.947	1.894	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H]1CCC[C@@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2	1802142150	OWSXGNDUOVKJCK-PLZKBRGSSA-N	447.935	1.804	50	20	IDGD	
COc1ccnc(C(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)c1OC	1803140866	IOWMZMDBDUTZDD-RVKKMQEKSA-N	448.907	1.413	50	20	IDGD	
C#CCO[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@H]1c1cccnc1	1803549652	CHYMHOLKYDJPHP-SYAUCNOPSA-N	426.286	1.816	50	20	IDGD	
Cc1ccc(C(=O)NC[C@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)o1	1803781923	GILGIFAXDQTWHL-UZLBHIALSA-N	448.483	1.615	50	20	IDGD	
COc1cncc(CCC(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)c1	1804482123	QGUYXHRGQUMMFD-FBBABVLZSA-N	446.935	1.724	50	20	IDGD	
O=C1CC[C@@H](C(=O)NC[C@@H]2CCN(C(=O)[C@H](F)Br)[C@H]2c2cccnc2)N1	1806641579	OYMTZNFPSNQDBB-JURCDPSOSA-N	427.274	1.057	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)c2cnoc2)[C@H]1c1cccnc1	1808521662	MTCCXVLHLQULSN-CPJWQURSSA-N	449.471	1.523	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)c2ccc[n+]([O-])c2)[C@H]1c1cccnc1	1812864578	ISFKUPLNUWUVRK-LXZKKBNFSA-N	433.306	1.818	50	20	IDGD	
COCCOCCOCCC(=O)NC[C@@H]1CCN(C(=O)[C@H](F)Cl)[C@H]1c1cccnc1	1812932391	XURSEBGHFQGNEK-WDSOQIARSA-N	445.919	1.692	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](N)c2ccccn2)[C@H]1c1cccnc1	1813032215	VCXWYMNWFKWQEG-CAMMJAKZSA-N	431.924	1.436	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)no1	1813070429	IWZOTNTURTZXSK-UZLBHIALSA-N	428.493	1.071	50	20	IDGD	
O=C(/C=C/c1ccoc1)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1	1815337280	QLVNQAJYWWYHIE-WJLRQCOBSA-N	437.286	1.355	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)Cn3cncn3)sc2C1	1815670316	HRKAPFCXLAIYFA-NXEZZACHSA-N	427.328	1.520	50	20	IDGD	
CC[C@@H](NC(N)=O)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCBr)n[nH]1	1816780752	IZRMFEKAMKUMBY-ZYHUDNBSSA-N	429.319	1.634	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@H]1CCc2nc(NC(=O)c3cc(O)nc(O)n3)sc2C1	1817104115	VPRKOBJDADQQTJ-GYKQLYQFSA-N	446.316	1.806	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CN2CCOCC2)n[nH]1	1817144189	GBOVUGGGVHLRBZ-HIFRSBDPSA-N	442.358	1.765	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](C)CN)[nH]n1	1818112045	RRCDOCJVUQCSAE-CKOWOVDISA-N	428.497	1.131	50	20	IDGD	
O=C1Cc2cc(C(=O)Nc3cc([C@@H]4CCCCN4C(=O)[C@H](O)CCl)[nH]n3)ccc2N1	1818979326	BQRVAXPFIPYFOY-JKSUJKDBSA-N	431.880	1.810	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CN2C(=O)C=CC2=O)[nH]n1	1820869099	PVAWKHINIGGYGF-XIKOKIGWSA-N	442.303	1.563	50	20	IDGD	
C[C@H](Br)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H]2CCNC(=O)C2)[nH]n1	1822191244	DYHKYFWFSRKYKH-GVXVVHGQSA-N	426.315	1.711	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)C[C@](C)(O)CC(=O)O)[nH]n1	1822374113	DHRNEIMFDTWFIS-SRBZOADZSA-N	430.889	1.271	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](C)S)n[nH]1	1822382162	ZMURHFZKWWHSSZ-HLPBRAGLSA-N	431.522	1.854	50	20	IDGD	
CC(C)N[C@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1)C(C)C	1822413942	IYMIHPXWLMBWLJ-UTKZUKDTSA-N	449.600	1.797	50	20	IDGD	
CSCC[C@H](O)C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1	1823013523	CMYZEJOLEBSHPM-OVYXKVPISA-N	440.360	1.860	50	20	IDGD	
CC(C)(C)[C@@H](O)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1	1824134788	NWEPYRHMTVSSKY-MOPGFXCFSA-N	445.564	1.325	50	20	IDGD	
O=C(c1ccc2c(n1)OCCO2)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)CC1	1824182473	DIBCAIDEYWGZEY-IRXDYDNUSA-N	437.924	1.686	50	20	IDGD	
Cc1cccc(CC(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)n1	1824282386	GQLUDEIHYMNLOQ-HSZRJFAPSA-N	449.360	1.546	50	20	IDGD	
CCS(=O)(=O)N[C@@H](C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)C(Cl)Cl)CC1	1824461602	HKLJFIAJIOHVDD-GXTWGEPZSA-N	442.409	1.738	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ncnn1C)CC2	1825444788	BVPTWBNHLKWRJK-BDAKNGLRSA-N	427.328	1.671	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccncc2)CC1	1825830723	VJBHZGOHEBJFLV-FQEVSTJZSA-N	436.516	1.627	50	20	IDGD	
Cc1nocc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1	1826042765	BUIVZBATFRCLNZ-LJQANCHMSA-N	440.504	1.529	50	20	IDGD	
CNCCCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)CC1	1826888064	GVFJRYRUMPOPQH-ZFOBRQHDSA-N	444.580	1.740	50	20	IDGD	
O=C(c1ccc(O)cc1)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827056833	XREJRAOYWPPNOF-JOCHJYFZSA-N	436.317	1.619	50	20	IDGD	
Cc1cnoc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827057251	AHQAWAJJTJPZPS-IBGZPJMESA-N	425.294	1.210	50	20	IDGD	
Cc1nccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)n1	1827888500	RVEHGKZLDFDZSU-IBGZPJMESA-N	430.553	1.391	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnn4ncccc34)C2)C1	1830357574	HGOXZBIHZMYVFT-FQEVSTJZSA-N	435.912	1.064	50	20	IDGD	
Cc1n[nH]c(C)c1CC(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1	1830437568	QEMHEUYXRQIPRC-HXUWFJFHSA-N	446.596	1.562	50	20	IDGD	
Cc1csc(C(=O)N2CCO[C@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)c1	1831777809	NGUCBKKKJWTAIK-IBGZPJMESA-N	426.611	1.978	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(=O)oc2)CC1	1831872389	TWSYNYAEFFZZDO-GOSISDBHSA-N	432.521	1.246	50	20	IDGD	
O=C1NCc2cc(C(=O)N3CCC(N4CCC(NC(=O)[C@@H](F)Cl)CC4)CC3)ccc21	1835080741	WGNAYODYFJZZTR-GOSISDBHSA-N	436.915	1.650	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CC3CCOCC3)CCO2)C1	1835424572	SAJKHOXNQNIJNE-KBXCAEBGSA-N	433.343	1.043	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](F)Cl)CC2)CC1)c1cc2n(n1)CCCC2	1835571614	NPCDMHVLOFXDHB-SFHVURJKSA-N	425.936	1.939	50	20	IDGD	
Cc1nc[nH]c1C(=O)N1CCC(N2CCC(NC(=O)[C@@H](F)Br)CC2)CC1	1836412719	RIVMFAASTIGEOF-OAHLLOKOSA-N	430.322	1.594	50	20	IDGD	
O=C(C1Cc2ccccc2C1)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836721519	POQNPMYKCMXYCU-NRFANRHFSA-N	434.964	2.000	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC(OC2CCN(C(=O)c3ccc[n+]([O-])c3)CC2)CC1	1837240708	FQRGUHBGCUMYPX-UHFFFAOYSA-N	435.597	1.784	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(-n4cccn4)nc3)CCO2)C1	1838120249	QJVHDUCPFOMHAH-UTKZUKDTSA-N	447.923	1.355	50	20	IDGD	
C[C@@H]1CCC[C@@H]1C(=O)N1CCC(OC2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1	1838298158	SXFQUGKPGZBGCA-XLIONFOSSA-N	436.597	1.794	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)cc1O	1839267239	OVIWAVRFILJFQD-QAPCUYQASA-N	445.285	1.461	50	20	IDGD	
O=C(c1cccc2ccnn12)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840189877	QYQDKZJONLJEJN-GOSISDBHSA-N	427.288	1.208	50	20	IDGD	
C[C@H](Oc1ccccn1)C(=O)N1CCOC[C@@]2(CN(C(=O)C(Cl)Cl)CCO2)C1	1840190603	DFIHYXWKBPRWBP-UGSOOPFHSA-N	432.304	1.109	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1CCCSC1)CCO2	1840867067	CUGIVSZAZUSZHU-JJRVBVJISA-N	435.384	1.369	50	20	IDGD	
Cc1ccc2nc(C(=O)N3CCCC34CN(C(=O)c3cccc(B(O)O)c3)C4)sc2c1	1842565640	BMXBXAPKTQTSQH-UHFFFAOYSA-N	435.314	1.415	50	20	IDGD	
CCN(CC)[C@@H](C(=O)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1)c1ccccc1	1843012147	JGKROGKRVHMHKT-JOCHJYFZSA-N	449.360	1.267	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC2(CCCN2C(=O)c2ccc3c(c2)n(C)c(=O)n3C)C1	1843734860	JPKAOPOMDMZIFN-AWEZNQCLSA-N	449.349	1.868	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2ccc3c(c2)CCCC3=O)C1	1843759654	TTYBSHQELMUJEI-UHFFFAOYSA-N	447.495	1.335	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCCC12CN(C(=O)Cc1ccc(S(C)(=O)=O)cc1)C2	1844377820	XEDYPHJNFHJYOK-UHFFFAOYSA-N	438.622	1.688	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC12CN(C(=O)c1ccc(N3CCOCC3)cn1)C2	1846176120	NOZSVWXKWFKPRV-CQSZACIVSA-N	437.338	1.519	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H]1CC[C@@H]2CCC(=O)N2C1	1847500325	FAACWHKVKUGVQW-SUJAAXHWSA-N	426.355	1.620	50	20	IDGD	
Cc1ccn2c(=O)c(C(=O)N3CC[C@H]4[C@@H]3CCN4C(=O)[C@@H](C)CBr)cnc2c1	1847500755	FNFWGNYCINYDDA-BPUTZDHNSA-N	447.333	1.849	50	20	IDGD	
C=C1c2ccccc2C(=O)N1[C@H](C)C(=O)NNC(=O)c1cc(OC)c(OC)c(OC)c1	14074835	QXQBCXLTTZYPFK-CYBMUJFWSA-N	425.441	1.989	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)c1ccc(Cl)c(S(=O)(=O)N(C)C)c1	14842200	FPEMGUQOEVIGIH-UHFFFAOYSA-N	435.893	1.621	50	20	IDGD	
O=C(CN1CCN(S(=O)(=O)c2ccccc2Cl)CC1)NNC(=O)c1cccs1	15485031	ISMWDQCCJFPLBD-UHFFFAOYSA-N	442.950	1.169	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2cc(S(C)(=O)=O)ccc2C)c2ccccc2c1=O	15939605	CSBKDDVZJJJGMD-UHFFFAOYSA-N	428.470	1.203	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccccc1)[C@@H]1COc2ccccc2O1	22084902	GJKHMQJRQOPZCI-APWZRJJASA-N	445.497	1.217	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)CN2C(=O)N[C@]3(C[C@@H](C)CC(C)(C)C3)C2=O)c1	23154007	TYYANNWSMQGJLH-HJPURHCSSA-N	444.532	1.966	50	20	IDGD	
CCOc1ccccc1OS(=O)(=O)c1cccc(C(=O)NNc2nnc(C)c(O)n2)c1	23311562	BPAZLAUXWLEENB-UHFFFAOYSA-N	445.457	1.809	50	20	IDGD	
CCCC(=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O)c1cccc(C(F)(F)F)c1	726424189	QMBZRBLBHNBOFQ-UHFFFAOYSA-N	443.451	1.911	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cnc(-c3ccccn3)s2)c1	727671759	LQQQOIOUDVXCAT-UHFFFAOYSA-N	431.499	1.530	50	20	IDGD	
C[C@H](Oc1cccc(F)c1)C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	728214898	UQGFYVNLAQHTCB-HNNXBMFYSA-N	436.509	1.672	50	20	IDGD	
CCCC(=O)N1CSC[C@@H]1C(=O)NNC(=O)c1cc(OC)ccc1Br	728527055	ZIQTZGYZJZCATJ-CYBMUJFWSA-N	430.324	1.920	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)Nc2ccc(OCC(N)=O)cc2)c1	728742563	IZCKHOJILXIXFI-UHFFFAOYSA-N	437.250	1.788	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cccc(C#N)c2)cc1S(=O)(=O)N1CCCC1	728827854	BAUVDCSXKCDJGI-UHFFFAOYSA-N	428.470	1.426	50	20	IDGD	
CSCC[C@H](C(=O)NNC(=O)c1cccc(C#N)c1)N1C(=O)[C@H]2CCCC[C@H]2C1=O	728828190	KMWGUUSYVSPLCK-IXDOHACOSA-N	428.514	1.616	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@@H]2C(=O)NNC(=O)Cc2cccnc2)cc1	728852227	UQMYSEWMXZNBQA-LJQANCHMSA-N	444.513	1.218	50	20	IDGD	
CC(=O)Nc1cccc([C@H](C)NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1	728944295	TUSYCWILGINEPR-AWEZNQCLSA-N	425.493	1.743	50	20	IDGD	
CS(=O)(=O)CCNC(=S)NNC(=O)c1cc(-c2ccncc2)nc2ccccc12	729157716	GRDFRWWJCGREMZ-UHFFFAOYSA-N	429.527	1.450	50	20	IDGD	
CCN(CCNC(=O)NNC(=O)c1nn(-c2ccccc2)cc1O)C(=O)OC(C)(C)C	729233325	CWHOUUBNDMARMX-UHFFFAOYSA-N	432.481	1.779	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)c1cn(Cc2ccccc2)nc1-c1ccccc1	729276186	YRUHWOBANAUEET-OAHLLOKOSA-N	441.513	1.297	50	20	IDGD	
CC(=O)Nc1cc(F)c(S(=O)(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1Cl	729661970	DVIHTTWVJIZFSS-OAHLLOKOSA-N	443.840	1.587	50	20	IDGD	
CC(C)c1[nH]nc(C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c1Br	730276808	UISCWWWOQQSSKK-UHFFFAOYSA-N	429.296	1.774	50	20	IDGD	
CS(=O)(=O)Cc1nc2ccccc2n1CC(=O)NNc1nc(-c2ccccc2)no1	732113664	ZSPLJQJLFAJHPU-UHFFFAOYSA-N	426.458	1.774	50	20	IDGD	
CCOC(=O)C1=NN(c2ccccc2)[C@@H](C(=O)NNc2ccccc2S(C)(=O)=O)C1	732302609	KJYYNJCKISDWHB-QGZVFWFLSA-N	430.486	1.731	50	20	IDGD	
C[C@H]1CN(C(=O)NNC(=O)CNC(=O)c2cccs2)C[C@@H](C)N1C(=O)OC(C)(C)C	733342883	PDLLNYCSBCWJJY-BETUJISGSA-N	439.538	1.548	50	20	IDGD	
C[C@@]1(CNC(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)CCOC1	733654290	LGORAZYFXJAHNZ-QFIPXVFZSA-N	435.488	1.759	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1	734239488	DRRRVZCGPGJVQO-UHFFFAOYSA-N	433.425	1.249	50	20	IDGD	
C[C@H](NC(=O)c1ccc(Cl)cc1)C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C	734241917	MYJMTBRPXYWKGV-NSHDSACASA-N	427.889	1.313	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NC2CCN(C[C@@H]3CCCO3)CC2)nc1	734284242	WLJAUPIBYGWURV-INIZCTEOSA-N	440.570	1.038	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)N[C@H](CCN(C)C)C(C)(C)C	734854819	MEFGOKVLMQLEIW-CQSZACIVSA-N	426.587	1.599	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)CCCN2C(=O)c3ccc(Br)cc3C2=O)cn1	735445074	DYWYKKYZGPCSRY-UHFFFAOYSA-N	434.250	1.020	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2cc(S(=O)(=O)CC)ccc2F)c2ccccc2c1=O	735833480	GLIDKTHFJSUVHG-UHFFFAOYSA-N	446.460	1.424	50	20	IDGD	
COc1cc(OC)cc(C(=O)NN=C(C)c2cccc(S(=O)(=O)N3CCOCC3)c2)c1	739400163	MPKVDKCBEMXNCJ-UHFFFAOYSA-N	447.513	1.879	50	20	IDGD	
COc1ccc(S(=O)(=O)CCC(=O)NNC(=O)c2cccc3ncccc23)cc1OC	740823803	LAPGQBWDVYYUKQ-UHFFFAOYSA-N	443.481	1.877	50	20	IDGD	
COCC[C@H](Cc1cccc(Br)c1)C(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1	741176466	VCYMYDONRYLANU-KGLIPLIRSA-N	447.351	1.226	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)N[C@@H](C)[C@@H]2CN(Cc3ccccc3)CCO2)cc1	741437274	XVLCNAVKCUVRQZ-RXVVDRJESA-N	426.517	1.994	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2ccc(OC(C)C)c(OC)c2)cs1	743251945	ZXULFERUCPVOLP-UHFFFAOYSA-N	428.488	1.954	50	20	IDGD	
C[C@H](NC(=O)c1ccc(Cl)cc1)C(=O)OCC(=O)NNC(=O)c1ccc(C#N)cc1	744483197	ZJJGVJQIIDKNLB-LBPRGKRZSA-N	428.832	1.334	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)C1=NO[C@@H](c2ccccc2)C1	744621728	FOVSMNWFDZCFIA-GOSISDBHSA-N	430.486	1.668	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)NCC(C)(C)N2CCN(C)CC2)cc1Cl	745430270	VIMOVNSIWQFZAY-UHFFFAOYSA-N	442.948	1.719	50	20	IDGD	
O=C(NNC(=O)N1CCOCC1)c1cccc(S(=O)(=O)N2CCCc3ccccc32)c1	745992681	IFJVKCZRBFVPBG-UHFFFAOYSA-N	444.513	1.515	50	20	IDGD	
O=C(CC[S@](=O)c1ccc2c(c1)OCCO2)NNC(=O)c1cccc2ncccc12	746229472	QNHOWZDRGWYTOQ-PMERELPUSA-N	425.466	1.965	50	20	IDGD	
Cn1cc(S(=O)(=O)N2CCC(NC(=O)NNc3ccc(Cl)c(F)c3)CC2)cn1	746768467	WYNBJTSGMTVHBB-UHFFFAOYSA-N	430.893	1.692	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)N[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	748637263	ZCFGSJWKHDLSED-CJNGLKHVSA-N	432.443	1.662	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)c2cc(S(=O)(=O)N3CCC3)ccc2Cl)c1	748691602	UHXULYHFWGQCQF-UHFFFAOYSA-N	437.905	1.883	50	20	IDGD	
C[C@@]1(NNC(=O)NCc2ccc(NC(=O)c3ccc(F)cc3)cc2)CCS(=O)(=O)C1	749183212	LFLQIWMTLUUSJW-HXUWFJFHSA-N	434.493	1.959	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CN(Cc2nc(O)c3ccccc3n2)CCO1)c1cc2ccccc2o1	749475078	XCTQPFHWVRBKJP-IBGZPJMESA-N	447.451	1.744	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)[C@H]1CCCN1C(=O)c1ccc2c(c1)OCO2	749504779	JUUVJCXEWFIFJV-MRXNPFEDSA-N	425.441	1.419	50	20	IDGD	
C[C@H](Cc1ccncc1)NC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	749617679	AMRPWVFUZDKKQN-OAHLLOKOSA-N	431.518	1.441	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)CNS(=O)(=O)c2ccc(Cl)s2)cc1	749839071	ZUDGMNKUADFFFN-UHFFFAOYSA-N	433.964	1.928	50	20	IDGD	
COc1ccc(C2(C(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)CCC2)cc1	751291317	UNDQJFGGFRBJHL-UHFFFAOYSA-N	431.514	1.828	50	20	IDGD	
CCOc1ccc(/C=C(/C#N)C(=O)N2CCC[C@H](S(=O)(=O)N(C)CCOC)C2)cc1	754707762	FWADIJWNSVZMFP-BXWQOUMASA-N	435.546	1.891	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(F)c(F)c(O)c2F)c1	754830599	RQGCPSXGVNHNFE-UHFFFAOYSA-N	445.419	1.915	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)Nc2ccc(C)c(S(=O)(=O)N(C)C)c2)c1	755391719	GBPAPJIDFMQFAG-UHFFFAOYSA-N	434.478	1.065	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)Nc1ccc(S(=O)(=O)NC2=NCCCCC2)cc1	755499792	LUWRLVFMFJYHQY-UHFFFAOYSA-N	432.506	1.742	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NN=Cc1cnc([C@H]2CCCO2)s1	755786552	BBHIUHDVBYJTPZ-GOSISDBHSA-N	427.530	1.903	50	20	IDGD	
CN1CCC/C1=N\S(=O)(=O)c1cccc(NC(=O)NNC(=O)c2ccc(C#N)cc2)c1	756028778	HNRNPGOTFJJPTR-XIEYBQDHSA-N	440.485	1.838	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1ccc(OCc2cccc(C#N)c2)c(F)c1	756355703	RFFOUKPHFDPMCH-LBPRGKRZSA-N	449.464	1.367	50	20	IDGD	
CS(=O)(=O)CCn1ccc(NC(=O)NNC(=O)CSc2ccc(Cl)cc2)n1	756763119	YYGLDCXHGZICND-UHFFFAOYSA-N	431.927	1.526	50	20	IDGD	
CCS(=O)(=O)c1ccc(CCC(=O)NNC(=O)c2nnc(O)c3ccccc23)cc1	756864591	SBMDYUZRKYNMOU-UHFFFAOYSA-N	428.470	1.523	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)c2cncc(N3CCOCC3)c2)c2ccccc2c1=O	756864991	ZNDMLGOTRNJZRX-UHFFFAOYSA-N	436.472	1.284	50	20	IDGD	
Cc1sc2ncnc(N3CCC(C(=O)NNc4ccc(C(N)=O)nn4)CC3)c2c1C	757403025	TYXGHEHTZSWFHQ-UHFFFAOYSA-N	426.506	1.557	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1cc(-c2cccs2)n(-c2ccccc2)n1	758035886	OJEGZQCHQCIIGN-LBPRGKRZSA-N	433.515	1.300	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NN=C1CCC2(CC1)NC(=O)NC2=O	758117372	JIQUJUCXBGXFNT-UHFFFAOYSA-N	446.939	1.082	50	20	IDGD	
O=C(NNc1nc(O)c2ccccc2n1)c1cc(S(=O)(=O)N2CCSCC2)c[nH]1	758300281	SVLSTPBMJWBIBE-UHFFFAOYSA-N	434.503	1.158	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)NCCC2(C)OCCO2)c2ccccc2c1=O	760159080	NCBFNBVGMWDLJN-UHFFFAOYSA-N	431.493	1.684	50	20	IDGD	
CCOC(=O)c1cc(S(=O)(=O)NNC(=O)[C@H](C)Oc2ccc(OCC)cc2)cn1C	760511012	WDWVXMUTFDJPQR-ZDUSSCGKSA-N	439.490	1.378	50	20	IDGD	
COCCS(=O)(=O)c1ccc(CNC(=O)/C(C#N)=C/c2cc(C#N)n(C)c2C)cc1	760564358	ZFTIZVGZSAFZFW-VCHYOVAHSA-N	426.498	1.849	50	20	IDGD	
C[C@H](NC(=O)OC(C)(C)C)[C@@H]1CN(C(=O)NNC(=O)Cn2ccc3ccccc32)CCO1	760758268	XJNNMHVFHZCLNK-YJBOKZPZSA-N	445.520	1.996	50	20	IDGD	
Cc1cc(Oc2ncccn2)ccc1NC(=O)C(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	763443070	WYPGEOXWTOBERA-UHFFFAOYSA-N	436.384	1.885	50	20	IDGD	
O=C(NNC(=O)c1ccccc1O)C(=O)Nc1cc(C(F)(F)F)ccc1-n1cccn1	763525440	BNHHVJWZMBGMLL-UHFFFAOYSA-N	433.346	1.996	50	20	IDGD	
O=C(NNC(=O)c1ccccc1O)C(=O)Nc1ccc(-n2nccc2C(F)(F)F)cc1	763529498	WXWXJUCSIGWOAB-UHFFFAOYSA-N	433.346	1.996	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(F)cc(N2CCOCC2)c1	763717272	UHIUAIXABQQWFE-UHFFFAOYSA-N	444.463	1.390	50	20	IDGD	
CCCN1C(=O)CCc2cc(NC(=O)C(=O)NNC(=O)c3cccc(N(C)C)c3)ccc21	763757827	KLUZUJYYJHWDLA-UHFFFAOYSA-N	437.500	1.842	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)OC(F)(F)O2	763848181	AKNYHZDANUCCHS-SECBINFHSA-N	425.319	1.701	50	20	IDGD	
CNC(=O)c1ccc(OC)c(NC(=O)C(=O)NNC(=O)CCSc2ccc(F)cc2)c1	763903383	RDHAPUBWIBSNBY-UHFFFAOYSA-N	448.476	1.462	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cc(C(N)=O)ccc2C)ccc1OC(C)C	763916843	VXTDCNSVKBBTJA-UHFFFAOYSA-N	428.445	1.289	50	20	IDGD	
O=C(NNC(=O)c1cc2c(s1)CCCCC2)C(=O)Nc1ccc(-n2nccn2)nc1	763968507	QBGGASRIXHVSPB-UHFFFAOYSA-N	425.474	1.392	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)C(=O)Nc1ccc(Br)nc1	763996230	XKLIWCCVPNMTMN-UHFFFAOYSA-N	431.044	1.334	50	20	IDGD	
CC(C)OC(=O)NCc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)nc2)cc1	764093307	RSMZNQCCRNQGIU-UHFFFAOYSA-N	433.852	1.769	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2cccc(OC[C@H]3CCCO3)c2)c1O	764131367	FTGFAPOUKNKAQF-OAHLLOKOSA-N	429.429	1.358	50	20	IDGD	
COC(=O)c1ccc(OC(C)C)c(NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)c1	764154060	OANKTITUGVOOOM-GOSISDBHSA-N	441.440	1.350	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cccc3ncccc23)c(F)cc1F	764257287	BLKUDBGONOCWSD-UHFFFAOYSA-N	428.351	1.699	50	20	IDGD	
CCc1nnc(-c2ccc(NC(=O)C(=O)NNC(=O)COc3ccccc3O)cc2)o1	764275249	KZJDKTDBRLIVDC-UHFFFAOYSA-N	425.401	1.170	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)ccc1O)C(=O)Nc1ccc(-n2nccn2)cc1	764280758	SKCRRDJGFIADGE-UHFFFAOYSA-N	445.233	1.135	50	20	IDGD	
CCn1c(=O)n(CC)c2nc(NC(=O)CCC(=O)NNc3ccc(Cl)nn3)ccc21	764302008	FMKSTJIZDHAVPH-UHFFFAOYSA-N	432.872	1.543	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)C(=O)Nc2ccc(Cl)c(C(=O)Nc3ccccc3)c2)cn1	764357768	ABXMMEFFRBDTHW-UHFFFAOYSA-N	440.847	1.726	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)n(-c2ccc(F)cc2)n1	764404713	NNNHPVIEIBBMOL-UHFFFAOYSA-N	443.460	1.904	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1cccc(C(=O)N2CCc3ccccc32)c1	766263811	BHTUEFSXRPWQHH-UHFFFAOYSA-N	432.440	1.770	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)c1nccnc1C(=O)NCc1ccc(F)cc1	766661385	BHWMFYZJXHJLPM-UHFFFAOYSA-N	443.460	1.706	50	20	IDGD	
CN(C)c1ccc(Br)c(S(=O)(=O)NNC(=O)COc2ccccc2O)c1	766799324	KTPFGLKJVBVMOW-UHFFFAOYSA-N	444.307	1.609	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)CN1CCC(C(=O)NCC(C)(C)CN(C)C)CC1	766898228	XFSDWVIPUMFISJ-UHFFFAOYSA-N	445.608	1.101	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)[C@@H]1CSCN1C(=O)OC(C)(C)C	768612631	PTAIXXDBRKFOHA-NSHDSACASA-N	431.536	1.852	50	20	IDGD	
NC(=O)c1n[nH]c2ccc(NC(=O)C(=O)NNc3ccc(Br)c(F)c3)cc12	770815224	DGCZFNLGVITLPP-UHFFFAOYSA-N	435.213	1.645	50	20	IDGD	
C[C@H](CS(=O)(=O)c1ccc(F)cc1)C(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	770949724	GBMLFGYXLOWYLO-CYBMUJFWSA-N	446.460	1.588	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)N[C@H]1CCO[C@]2(CCOC2)C1	771442540	MRLKUIAZMCGXTE-SUMWQHHRSA-N	428.283	1.496	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)[C@H]1CC(=O)N(c2ccc(F)c([N+](=O)[O-])c2)C1	771973286	IYMXXBJHGHTGCN-RYUDHWBXSA-N	438.412	1.212	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)[C@]1(F)CCN(C(=O)OCc2ccccc2)C1	772241649	RMGLBNQWLDCLKP-VFNWGFHPSA-N	437.468	1.862	50	20	IDGD	
Cc1ccc(-n2nccc2NC(=O)C(=O)NNC(=O)c2cccc(Br)c2)nn1	773496881	QAQWAUAVAVFJBB-UHFFFAOYSA-N	444.249	1.133	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cn(C)nc2C(F)(F)F)cc1	773527752	MWWBWMGPFXCASL-SNVBAGLBSA-N	441.366	1.195	50	20	IDGD	
CCn1c(NNC(=O)c2cc(Cl)sc2S(N)(=O)=O)nc2ccccc2c1=O	773752633	IAXFTRFMSSRJOQ-UHFFFAOYSA-N	427.895	1.536	50	20	IDGD	
CC(C)(O)c1ccc(CNC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1	776190517	BYBLAKPCXBDHTO-UHFFFAOYSA-N	439.560	1.957	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)NCCCCCS(C)(=O)=O)c1	776265954	SYEGNFRSJUQXAO-UHFFFAOYSA-N	436.328	1.617	50	20	IDGD	
CC(C)(C)OC(=O)N(CC(=O)NNc1cccc(S(C)(=O)=O)c1)C[C@@H]1CCCO1	776527278	DKYNVKVCPNNWLR-HNNXBMFYSA-N	427.523	1.949	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN([C@H]2CCCN(C(=O)NNC(=O)c3ccccc3)C2)C(=O)C1	776846028	HXMWZKVVRGLRNP-KRWDZBQOSA-N	445.520	1.585	50	20	IDGD	
COCCO[C@@H]1COCC[C@@H]1NC(=O)NNC(=O)c1ccc(OC)c(Br)c1	776876167	AQCMATHRQYQAEV-DZGCQCFKSA-N	446.298	1.222	50	20	IDGD	
CCOC(=O)N1CCC[C@@H]([C@@H](C)NC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)C1	776934442	GZJKYOYYUNWHTD-HUUCEWRRSA-N	444.492	1.779	50	20	IDGD	
O=C(NNC(=O)c1cnc2[nH]nnc2c1)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	777792068	OQMSRNPWMMNUTE-UHFFFAOYSA-N	440.427	1.130	50	20	IDGD	
COCc1nc(OC)c2c(C)c(C(=O)NNC(=O)CNC(=O)OC(C)(C)C)sc2n1	778440508	IDNZXNDRGZXOBE-UHFFFAOYSA-N	439.494	1.440	50	20	IDGD	
Cn1cc([C@H](CO)NC(=O)NNC(=O)[C@@H]2Cc3ccccc3CN2Cc2ccccc2)cn1	778643077	YFGMKOPDNZFNNY-VXKWHMMOSA-N	448.527	1.411	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccc(NC(=O)NNc3ncncc3Cl)c2)CC1	782030347	LMBRQUJOIGMADR-UHFFFAOYSA-N	425.902	1.215	50	20	IDGD	
CC(=O)N1CCN(Cc2ccccc2NC(=O)C(=O)NNc2cnc3ccccc3n2)CC1	782124642	RJPWGBKIILSKLW-UHFFFAOYSA-N	447.499	1.376	50	20	IDGD	
Cc1nc2cc(NC(=O)C(=O)NNc3ccc(S(=O)(=O)NC(C)C)cn3)ccc2n1C	783262977	GFUUMRWZOYMTJI-UHFFFAOYSA-N	445.505	1.045	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)C(=O)Nc2cccc(CCN3CCCC3)c2)c1	784839191	GNAXYXAOQQMZRW-UHFFFAOYSA-N	430.530	1.810	50	20	IDGD	
O=C(COC(=O)[C@H]1CC=CC[C@H]1C(=O)N1CCOCC1)NNC(=O)c1ccc(Cl)cc1	785721671	LAMFSVJLSKQEEV-SJORKVTESA-N	449.891	1.085	50	20	IDGD	
Cn1cc(-c2ncccc2NC(=O)C(=O)NNC(=O)CCSc2ccc(F)cc2)cn1	786415048	UYIWCGGRLVISCQ-UHFFFAOYSA-N	442.476	1.890	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)[C@@H]1CCCN1c1ccccc1	787438816	FKSHJSSMBHAZIL-NRFANRHFSA-N	435.528	1.261	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)c1ccc(OC)cc1I	788158758	PMHFDBDCAOCKKF-UHFFFAOYSA-N	436.246	1.850	50	20	IDGD	
Cc1cc(F)cc(-n2cc(C(=O)NNC(=O)C(=O)NCc3ccc(Cl)cc3)nn2)c1	788758218	HAFPCNDSMSIFOL-UHFFFAOYSA-N	430.827	1.446	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN(C)[C@H](C)c2cccc(N3CCOC3=O)c2)n1	789367246	SPBTUZFGYCSPJH-CQSZACIVSA-N	431.518	1.791	50	20	IDGD	
O=C(COc1cccc(NC(=O)C(=O)NNc2nc3ccccn3n2)c1)Nc1ccccc1	792394755	NFJAFIKPZHEPLX-UHFFFAOYSA-N	445.439	1.829	50	20	IDGD	
O=C(NNC(=O)[C@@H]1[C@H]2[C@H]3C[C@@H]4[C@@H]5[C@H]3[C@H]1[C@@H]5C[C@H]42)c1cccc(S(=O)(=O)N2CCCC2)c1	792773392	HHULZLRMLZSAFO-QRXYLLQBSA-N	441.553	1.626	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@H](C)c3ccc4c(c3)OCO4)CC2)cc1	794392904	KEPWAOUXOSDJGK-GOSISDBHSA-N	438.528	1.792	50	20	IDGD	
COCCNC(=O)c1cccc(S(=O)(=O)NNC(=O)c2cccc3ccccc23)c1	795323223	FMGPBTVOXMXKOG-UHFFFAOYSA-N	427.482	1.839	50	20	IDGD	
CNC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)CSc2ccc(C)cc2)c(C)c1	796999475	MWAUYOHRVWIGEM-UHFFFAOYSA-N	444.513	1.306	50	20	IDGD	
Cn1cc(-c2cc(F)ccc2NC(=O)C(=O)NNC(=O)CCc2ccccc2O)cn1	797009425	RUDGKIADVKNMLY-UHFFFAOYSA-N	425.420	1.651	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NCCCNC(=O)/C=C\c2ccccc2)c2ccccc2c1=O	800758603	BBDISPBTCRHOSK-SEYXRHQNSA-N	448.483	1.097	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)[C@H]2CC(=O)N(Cc3ccccn3)C2)c(OC)cc1Cl	802080038	LWBQZKMVUZCOIR-LBPRGKRZSA-N	447.879	1.954	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(Br)c2cccnc12	802567781	XQAJADVDTDAGNU-JTQLQIEISA-N	439.266	1.135	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cc4ccccc4c(=O)n3C)CC2)cc1	802763396	VCCMJSUHFFOBBL-UHFFFAOYSA-N	447.539	1.426	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@H](C(=O)NNc2ccc(-n3ccnc3)nn2)C(C)C)cc1	804956773	YCYYDMRZFAJPHP-SFHVURJKSA-N	429.506	1.417	50	20	IDGD	
C[C@]1(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)CC(c2ccccc2Cl)=NO1	806339351	YGECNKYBYKBDSQ-LJQANCHMSA-N	449.920	1.977	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2cccc(Cl)c2OCC(F)F)CCS(=O)(=O)C1	807000720	HMJSAEUWVSOZJF-HNNXBMFYSA-N	425.841	1.120	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)NCCCn1cc(Br)cn1	807613082	WLZSKRACPKQSKX-NSHDSACASA-N	428.262	1.973	50	20	IDGD	
Cc1nnc(NNC(=O)Cc2sc(N3CCOCC3)nc2-c2ccccc2)nc1O	810007000	STJCKTCMNCDEHC-UHFFFAOYSA-N	427.490	1.532	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2ncc(Cl)cc2C)n[nH]1	812979620	CLRILHVWGGUMAF-UHFFFAOYSA-N	428.836	1.842	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)cc2cccnc12	815582732	OCNWVRPWXNJMOI-UHFFFAOYSA-N	432.440	1.459	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)CN1C(=O)N[C@]2(C[C@H](C)CC(C)(C)C2)C1=O	871631303	CHNNYPOGEJRZJA-CMJOXMDJSA-N	444.532	1.912	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)NCCCN2C(=O)NC3(CCCC3)C2=O)c2ccccc21	913636288	ZLOWGWLQOQYYDT-UHFFFAOYSA-N	426.477	1.377	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)c2cccc(S(=O)(=O)NCC3CC3)c2)cc1	914595784	ZAAWBVKQKUGZDF-UHFFFAOYSA-N	428.470	1.087	50	20	IDGD	
CC(C)NS(=O)(=O)c1cc(C(=O)OCC(=O)NNC(=O)c2cccs2)ccc1F	914941076	GHFPDVRLEKUSMT-UHFFFAOYSA-N	443.478	1.192	50	20	IDGD	
CCN(CC)CCNC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	915879059	FLNBSTPUHNLUSD-UHFFFAOYSA-N	447.561	1.451	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCc2ccc3c(c2)OCCO3)nc1	915894192	HUMIHCNVHZZUPT-UHFFFAOYSA-N	435.506	1.710	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)N[C@H](C)c2cccc(S(N)(=O)=O)c2)cc1OC	916197047	LQOCNLCJFPMGKH-GFCCVEGCSA-N	436.490	1.447	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)NCc2nnc3c(Cl)cc(C(F)(F)F)cn23)n1	916221436	KGDJKNPUJBMIJW-UHFFFAOYSA-N	444.805	1.745	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)NCCCN1CCN(Cc2ccccc2)CC1	916488096	GMLCHLUOWSYRKM-UHFFFAOYSA-N	449.559	1.795	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)COc1ccccc1F)c1ccc(OCC(=O)NC2CC2)cc1	916489416	LFOGZJMNEDNVRA-CQSZACIVSA-N	444.463	1.954	50	20	IDGD	
CCN(CCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)c1ccccc1C	916513605	GUZBOLKAPVBZJO-UHFFFAOYSA-N	447.561	1.716	50	20	IDGD	
CNC(=O)CN1CCC(NC(=O)NNC(=O)COc2ccccc2-c2ccccc2)CC1	916517175	WIRTYKJJGWSOHF-UHFFFAOYSA-N	439.516	1.273	50	20	IDGD	
Cc1nn([C@@H]2CCS(=O)(=O)C2)c2nc(C3CC3)cc(C(=O)NNC(=O)C(C)(C)C)c12	918584997	PGRRVFMTMUQVRE-CYBMUJFWSA-N	433.534	1.784	50	20	IDGD	
COc1ccc(-n2ccc(CNC(=O)NNC(=O)c3nn(-c4ccccc4)cc3O)n2)cc1	919917220	VTAVSKJOQJLVBX-UHFFFAOYSA-N	447.455	1.916	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCN(c2ccc(Cl)cn2)CC1	921192401	JCBHPNFQLWUQCJ-UHFFFAOYSA-N	438.315	1.980	50	20	IDGD	
CCOc1ccc(NC(=S)NNC(=O)c2nc(S(C)(=O)=O)n3ccccc23)cc1	921202625	WFQUQQJHNYUWHG-UHFFFAOYSA-N	433.515	1.768	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)Cc2ccc(S(=O)(=O)CCO)cc2)c1C	1116423291	WYJCATSSEPFUGO-INIZCTEOSA-N	434.514	1.227	50	20	IDGD	
CCOCCCn1c(NNC(=O)Cn2c(=O)oc3ccccc32)nc2ccccc2c1=O	1318520847	BLMDXXTWJSGKKQ-UHFFFAOYSA-N	437.456	1.874	50	20	IDGD	
O=C(COC(=O)C1(Sc2ccccc2)CC1)NNC(=O)[C@@H]1COc2ccccc2O1	1319639116	MIWKYFJOACVDAU-KRWDZBQOSA-N	428.466	1.842	50	20	IDGD	
CNC(=O)Cc1ccccc1NC(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1	1321012114	ZHWSGFYJPMWHSA-UHFFFAOYSA-N	433.509	1.775	50	20	IDGD	
CNC(=O)c1cccc(C(=O)NNc2ccc(S(=O)(=O)Nc3ccccc3)cc2)n1	1333195856	IIYYUMQZCQTHLX-UHFFFAOYSA-N	425.470	1.999	50	20	IDGD	
Cc1nc[nH]c1CSCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1778914430	RWKBVOROKJJIEA-HOCLYGCPSA-N	449.346	1.472	50	20	IDGD	
CC(=O)O[C@H](C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CO[Si](C)(C)C)C2)C(C)C	1779208360	QJSIYVZXKIKWCI-SLYNCCJLSA-N	442.629	1.940	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)c3cc4ncccn4n3)CCO2)C1	1781229766	JDWHZOVUSNYAIQ-ZWKOTPCHSA-N	426.304	1.409	50	20	IDGD	
CN1CCc2cc(C(=O)N3CCO[C@]4(CCN(C(=O)[C@H](F)Br)C4)C3)ccc21	1781330155	ROEDQMJZAIHOLD-LPHOPBHVSA-N	440.313	1.813	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@H](C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](F)Br)C3)C2)C1	1781334163	MPSFIQWCCIRRRM-AHXJXLJNSA-N	449.317	1.486	50	20	IDGD	
COc1cc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](F)Br)C3)C2)ccc1F	1781335099	TXIMCUYGWZYILH-YOEHRIQHSA-N	433.249	1.968	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1n[nH]cc1[N+](=O)[O-])C2	1781998089	SHIKOJAXWMFLAP-KANYHAFZSA-N	444.286	1.229	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1n[nH]cc1[N+](=O)[O-])C2	1781998092	SHIKOJAXWMFLAP-NSODJVPESA-N	444.286	1.229	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C(Cl)Cl)C1	1782221507	XLOXTHYHXOLOAF-PSTGCABASA-N	425.309	1.866	50	20	IDGD	
C[C@H](CC(=O)N1CC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2)c1ccccc1	1783280584	OPOQXIPUIUAYOL-KOSHJBKYSA-N	436.317	1.004	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)Cc3csc(C)n3)CCO2)C1	1783343876	KGBDXDLKENZCRZ-PBHICJAKSA-N	430.368	1.997	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3n[nH]c4c3CCCC4)CCO2)C1	1783347779	OSXDGQKVJKMAJH-AUUYWEPGSA-N	439.354	1.906	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cn(C(C)(C)C)nn3)CCO2)C1	1783351877	MQTRGIWZMSXUJV-UGSOOPFHSA-N	442.358	1.650	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccc4nn[nH]c4c3)CCO2)C1	1783355483	UARISGOWKSYNIB-FZKQIMNGSA-N	436.310	1.575	50	20	IDGD	
O=C(/C=C/c1cc(F)c(F)c(F)c1)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1783716810	VAWSVFCYTYECCK-MNYSWUDSSA-N	432.826	1.547	50	20	IDGD	
CC[C@@H](C(=O)N1CCO[C@@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1)c1ccccc1	1783936360	MGBOGWRWOUXSCL-AUSIDOKSSA-N	430.549	1.383	50	20	IDGD	
Cc1noc(C)c1CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCBr)[C@H]2C1	1786400890	DERYSXMJRAQUSP-BPUTZDHNSA-N	428.327	1.599	50	20	IDGD	
O=C(CCS(=O)(=O)c1ccccc1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21	1786586863	YOBMZJPAOVMFIK-MBGYTDRXSA-N	446.928	1.365	50	20	IDGD	
CC(C)N[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)Br)C[C@@H]21)C(C)C	1786961978	FNIUNUKAAIIZFT-XAJHFOFHSA-N	432.403	1.772	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(-n4ccnc4)ccn3)[C@H]2C1	1789373016	QRRGTONHDYXSBG-XPYUAMARSA-N	431.924	1.878	50	20	IDGD	
COC(=O)C12CC(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]4C3)(C1)C2	1789872352	SQPXFXNUEIWQBJ-FRPHYYAGSA-N	447.359	1.546	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1ccc(C2(NC(=O)c3cnc4ncccn34)CCC2)cc1	1791601714	QLAHTLBTVNUUGV-UHFFFAOYSA-N	449.515	1.850	50	20	IDGD	
C[C@@H](C(=O)Nc1ccc(C2(NC(=O)CCC(=O)NN(C)C)CCC2)cc1)n1cncn1	1791860891	GXQKBPWCCGZXBS-HNNXBMFYSA-N	427.509	1.346	50	20	IDGD	
Cc1nc(C)c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)CBr)s1	1792870166	JRXMSLGECSNFQW-WBMYTEFPSA-N	430.368	1.994	50	20	IDGD	
COc1cccc(N2C[C@H](C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)[C@H](O)CCl)CC2=O)c1	1793106603	OPLUPBYBNUKARZ-PVTMFURFSA-N	449.935	1.286	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C#CC1CC1	1793262496	SNWJKDRHGXZIOR-VPTLXERWSA-N	441.440	1.137	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1ccc2ncccc2c1)c1cccc(B(O)O)c1	1793854532	RRCFIOORFSAGQO-KOUNCHBCSA-N	443.312	1.409	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1noc2c1CCCC2	1796154659	DNJDTNILWZBQKK-YJKIEOBBSA-N	430.274	1.447	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(CS(C)(=O)=O)nc1	1796538956	ATQICWZZZQBWDM-YYIAUSFCSA-N	427.954	1.895	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CO[Si](C)(C)C)C2	1796836568	ZPHGJCBAZOWNJT-HGKCTWBKSA-N	430.581	1.697	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc2cnccc12)c1cccc(B(O)O)c1	1798129722	VECPJTFPGCREAP-ACDBMABISA-N	429.285	1.480	50	20	IDGD	
COc1cc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Cl)C3)ccc1[N+](=O)[O-]	1799249484	NUBOMEQXAXSMTE-CZAMWMTLSA-N	429.832	1.270	50	20	IDGD	
C[C@@H](Sc1ccccn1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Br	1799352433	WTRRXUSIWOGXFM-AMVBZWJASA-N	446.342	1.842	50	20	IDGD	
Cc1cc2nnc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)[C@@H](F)Br)c(C)n2n1	1800159871	RMVDGACBNNWVTE-NWJSVONSSA-N	439.289	1.683	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Nc1nccs1)C2	1800639026	GCZMXFHVVRQLMB-PEBLQZBPSA-N	445.383	1.707	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(-n3cnnc3)cc1)C2	1800756401	MDGOFTOUURAZMH-JJAZEVLHSA-N	448.321	1.254	50	20	IDGD	
Cc1nc2sccn2c1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)Br	1800759191	KMDDMBSSAKTZNI-FOUMNBMASA-N	441.351	1.691	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CC=CC[C@@H]1C(=O)OC	1800951388	CWKWLKAYGBNMOJ-COZGXFGHSA-N	426.941	1.739	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C(Cl)Cl)c1	1801014094	FNFGUOIEAIVMLS-DABQJJPHSA-N	435.329	1.097	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cn1cnc2ccccc21	1802158622	LOCWBTDRLYFQOE-BJWYYQGGSA-N	426.521	1.048	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnn3cccc(F)c13)C2	1802338036	JBZLKPQDUNCBFB-QDMKHBRRSA-N	430.484	1.098	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC2(CCCN(C(=O)CNC(=O)N(C)C)C2)CC1	1805032260	AATLAMPMDPALQE-CQSZACIVSA-N	431.375	1.520	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)NC[C@@H]1CCN(C(=O)[C@H](C)Br)[C@H]1c1cccnc1	1808233338	LJMGUOCCIURCJF-MXAVVETBSA-N	440.342	1.318	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)CCN2C(=O)C=CC2=O)[C@H]1c1cccnc1	1808249824	DMSUJZNTTNUEBG-GUXCAODWSA-N	432.908	1.420	50	20	IDGD	
C[C@H](CC(N)=O)C(=O)N1CC[C@H](CNC(=O)[C@@H](F)Br)[C@H]1c1cccnc1	1808649423	RLIVLVZAIVUIHL-PZTHBURQSA-N	429.290	1.289	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)[C@H]3CCCSC3)CC2)C1	1809972425	IVMLYSAVERTIIR-SFHVURJKSA-N	430.379	1.354	50	20	IDGD	
O=C(c1ccnc(Cl)c1)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1	1809976648	MIMKKSPTMVBFNV-UHFFFAOYSA-N	441.724	1.573	50	20	IDGD	
Cc1cc(/C=C/C(=O)N2CCC3(CCCN(C(=O)c4cccc(B(O)O)c4)C3)CC2)no1	1809978664	JHBIZCFZDBHBNP-VOTSOKGWSA-N	437.305	1.221	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)[C@H](C)Br)[C@H]1c1cccnc1	1810533383	OOOGBMVMIPJRKR-YXPYIKCWSA-N	437.338	1.562	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)C(C)(C)CNC(C)=O)[C@@H]1c1cccnc1	1813027954	HEHWIMAHKJYFKP-OKZBNKHCSA-N	438.956	1.504	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CNC(=O)C(F)(F)F)[C@@H]1c1cccnc1)C(Cl)Cl	1813081976	IIPWVEOXIXPABD-CMPLNLGQSA-N	441.237	1.570	50	20	IDGD	
C[C@H](C(=O)NC[C@H]1CCN(C(=O)CO[Si](C)(C)C)[C@H]1c1cccnc1)n1cnnn1	1813471431	YFYXLIFILZCGOS-KYJSFNMBSA-N	431.573	1.187	50	20	IDGD	
CN(CC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](O)CCl)n[nH]1)C(=O)OC(C)(C)C	1814869560	SJORPPZKHIWVEF-KGLIPLIRSA-N	443.932	1.868	50	20	IDGD	
Cc1ccn(C)c1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2	1821727781	PITCCUWOPGQAOP-OAHLLOKOSA-N	438.318	1.009	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@](C)(Cl)CCl)sc2C1	1822863941	UXRBOOGKZFOOHH-YNEJBJPTSA-N	436.365	1.738	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@H](O)CCl)CC2)c1cc2cccnc2nc1O	1823981022	VPNRWGVVEHJUFT-ZWNOBZJWSA-N	447.904	1.617	50	20	IDGD	
CC(C)(C)[C@H](O)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1	1824135395	ZUFJSXOKTYORIR-WOJBJXKFSA-N	430.354	1.007	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H](O)N2CCOCC2)CC1	1824616941	RIXNBCMEDOOUQS-UEXGIBASSA-N	429.989	1.664	50	20	IDGD	
CCS(=O)(=O)CC(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](C)Br)sc2C1	1825635392	FBZFYSKMJNMACC-BDAKNGLRSA-N	438.369	1.273	50	20	IDGD	
Cc1cncc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)c1	1826002927	HDDWMVLNQVTEAM-JOCHJYFZSA-N	435.333	1.617	50	20	IDGD	
O=C([C@@H](O)CCl)N1CCC([C@H]2CCCCN2C(=O)c2cnc3snnc3c2)CC1	1829623866	RVBLRTBUXKRHBF-CVEARBPZSA-N	437.953	1.919	50	20	IDGD	
CCN(CC)C[C@H](C)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830366119	KIJSZXGTYSQCSK-UWJYYQICSA-N	432.005	1.686	50	20	IDGD	
Cc1ccn(C)c1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2	1830542768	DPNKNMVPKZHYIQ-KXBFYZLASA-N	442.354	1.435	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3n[nH]c(C4CC4)c3F)C2)C1	1831643420	BNQHNGMJYHLKNI-VBKZILBWSA-N	442.919	1.904	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H]2C[C@@]2(F)Cl)CC1	1831963635	KNBWTHCFIDFNGA-GUXCAODWSA-N	430.952	1.904	50	20	IDGD	
C[C@@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)[C@@]3(C)CCCN3)CC2)CC1	1833264987	TUKRDCOSAWZECF-MGPUTAFESA-N	443.430	1.731	50	20	IDGD	
Cc1ccsc1C(=O)N1CCO[C@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1	1833948314	OVBAKBXGODWTDF-IBGZPJMESA-N	426.611	1.978	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnc(C)cn3)CCO2)C1	1834087130	BYTKNYYEWOHWPB-KBXCAEBGSA-N	441.326	1.029	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)CCc3cncnc3)CC2)CC1	1834845025	BOEZTOOFGSJXKJ-LJQANCHMSA-N	437.972	1.235	50	20	IDGD	
Nc1nc2cc(C(=O)N3CCO[C@]4(COCCN(C(=O)[C@@H](F)Cl)C4)C3)ccc2s1	1835784683	KJELUJIQVHDVQH-RDTXWAMCSA-N	442.900	1.483	50	20	IDGD	
Cn1cc2cc(C(=O)N3CCC(OC4CCN(C(=O)[C@H](O)CCl)CC4)CC3)ccc2n1	1836718746	CKRWNQCHCSADCF-HXUWFJFHSA-N	448.951	1.785	50	20	IDGD	
CCOC(=O)O[C@@H](C)C(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836719494	UEXCIXXTXOBAAE-XJKSGUPXSA-N	434.917	1.146	50	20	IDGD	
COC(OC)C(=O)N1CCC(OC2CCN(C(=O)[C@@](C)(Cl)CCl)CC2)CC1	1836789826	OQQJNCCUXMKPHB-SFHVURJKSA-N	425.353	1.840	50	20	IDGD	
CCc1noc(C)c1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1838058602	NGGBCNRWHRKJPA-WMLDXEAASA-N	448.289	1.306	50	20	IDGD	
Cc1nc(F)ccc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1838268079	ZGRYEQNEHLFJKK-RHSMWYFYSA-N	448.264	1.290	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3c[nH]c4ccccc34)CCO2)C1	1839071848	NTPAXQYJMAAOBK-GCJKJVERSA-N	449.935	1.421	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3c(C)noc3C)C2)C1	1839142742	YRVKEMZYSRJGBV-FXAWDEMLSA-N	427.929	1.698	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3cncnc3)C2)C1	1839151810	DUDLUXHWPOIYIB-RBUKOAKNSA-N	445.347	1.102	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H](F)Br)CCO2)C1	1839199424	WHKYSXRGGSRCNG-YWPYICTPSA-N	429.714	1.541	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccccn3)C2)C1	1839963161	BOSFHZLDKKYWIR-KBXCAEBGSA-N	426.311	1.325	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(F)nc3)C2)C1	1839964766	BUQVNONJBQGMGB-KDOFPFPSSA-N	444.301	1.464	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)CC(C)=O)C2)C1	1839966956	VBKOHNBTXZDPDU-YEWWUXTCSA-N	433.343	1.232	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(Cl)c3C)C2)C1	1840149782	ZXMDXLWFQVLATP-YLJYHZDGSA-N	445.343	1.972	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)C3(C(F)(F)F)CCC3)C2)C1	1840152074	WJPMDLWLYBSIBB-XJKSGUPXSA-N	442.862	1.429	50	20	IDGD	
C[C@H](Cc1ccccn1)C(=O)N1CCOC[C@]2(CN(C(=O)C(Cl)Cl)CCO2)C1	1840190761	LNJMKKHWSGZFPQ-AUUYWEPGSA-N	430.332	1.520	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3ccoc3)CCO2)C1	1840516885	QUFZMSMIAHTGMX-KDOFPFPSSA-N	429.311	1.452	50	20	IDGD	
CC(=O)Nc1ccccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1840725968	QATBJXUNMGDMTC-IBGZPJMESA-N	444.315	1.519	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)C1Cc3ccccc3C1)CCO2	1840943691	QROQYPKFEZTPQQ-QHCPKHFHSA-N	446.620	1.709	50	20	IDGD	
O=C(/C=C/c1ccc(Cn2ccnc2)cc1)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1	1841350404	ZQKAXJKSYBKBOM-OVKVCFKUSA-N	428.920	1.748	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC2(CCCN2C(=O)c2cncc(S(C)(=O)=O)c2)C1	1842189436	FIFCQLMGYFDCMN-INIZCTEOSA-N	434.345	1.538	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)CC13CCCN1CCC3)C2	1843416605	FCOBSUHHOUSMCF-KOEQRZSOSA-N	440.548	1.342	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)c1ccccc1N1CCCCC1)C2	1846385802	XPLSPNDWMBWLOF-UHFFFAOYSA-N	441.576	1.867	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)C(C)(C)CNC(=O)OC(C)(C)C)C1	1847158451	XBIWCYWGNKUVSH-AWEZNQCLSA-N	431.961	1.995	50	20	IDGD	
Cc1ccc(C(=O)NCC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](C)CBr)cc1	1847502111	LICCJBLMXUKCCK-PVAVHDDUSA-N	436.350	1.958	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)Cn1ccc(C)n1	1848234550	MELYPZZFFVGSSX-ROUUACIJSA-N	441.444	1.541	50	20	IDGD	
Cc1ccc(N2C(=O)C[C@@H](C(=O)NNC(=O)C(=O)NC3CC3)[C@H]2c2cccs2)cc1	11684130	JHFAVOVRPURSTG-QAPCUYQASA-N	426.498	1.577	50	20	IDGD	
CCOc1ccc(NC(=S)NNC(=O)c2cc(OC)c(OCC(N)=O)c(OC)c2)cc1	15667553	SJKXMCGFLRYHEY-UHFFFAOYSA-N	448.501	1.598	50	20	IDGD	
O=C(NNC(=O)C12CC3CC(CC(C3)C1)C2)c1ccc(S(=O)(=O)N2CCOCC2)cc1	15900720	SFQWINGTUNBTLX-UHFFFAOYSA-N	447.557	1.685	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)[C@@H]2CC(=O)N(c3ccc(C)c(F)c3)C2)cc1	26448505	LAZZGTGRLUQJEQ-MRXNPFEDSA-N	427.432	1.800	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)CNC(=O)c1ccco1)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	726271889	XZCUPEGFCGVGRA-UONOGXRCSA-N	437.497	1.375	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)c2oc3ccccc3c2CS(C)(=O)=O)nc2ccccc21	726523268	HQQUIVXYUQLOLI-UHFFFAOYSA-N	440.481	1.868	50	20	IDGD	
O=C(NNC(=O)C1CC1)c1ccccc1COc1ccccc1C(=O)NNC(=O)C1CC1	727722781	OVLGVGHGXLUKOR-UHFFFAOYSA-N	436.468	1.608	50	20	IDGD	
COc1ccc([C@]2(C)NC(=O)N(CC(=O)NNc3nc(-c4ccccc4)no3)C2=O)cc1	728080199	KGDROMYHFJQTEW-NRFANRHFSA-N	436.428	1.656	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)Cn2nnc(-c3ccc(C)cc3)n2)c1	728528559	FTUGVBNSCMMRIC-UHFFFAOYSA-N	445.277	1.881	50	20	IDGD	
Cc1cc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)c3cccc(C#N)c3)c2)no1	728977470	PBOATHDPJQNBBY-UHFFFAOYSA-N	425.426	1.730	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@@H]2C[C@@H](O)CN2C(=O)OCc2ccccc2)cc1OC	729511013	KVGLHWGAGSDOLY-SJORKVTESA-N	443.456	1.237	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1ccc(N2CCOCC2)c(F)c1	730180128	XXMRRUAFYOBSAZ-UHFFFAOYSA-N	428.468	1.130	50	20	IDGD	
C[C@@H](NC(=O)NN[C@@]1(C)CCS(=O)(=O)C1)c1cc(F)ccc1N1CCC(O)CC1	730677361	IFZFLDDGLHUIGA-YJYMSZOUSA-N	428.530	1.229	50	20	IDGD	
CS(=O)(=O)Nc1cc2ccccc2cc1C(=O)NNC(=O)COc1ccccc1O	730781618	VCEUBHFLTDAJTP-UHFFFAOYSA-N	429.454	1.757	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NC[C@H](C(C)C)N2CCOCC2)cc1Br	732237783	HWPBGBUBEUJVKN-OAHLLOKOSA-N	443.342	1.759	50	20	IDGD	
O=C(COC[C@@H]1CCCO1)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	733251507	XLYYXIAPQRHDNL-KRWDZBQOSA-N	436.468	1.401	50	20	IDGD	
CN(C)C(=O)C1(CNC(=O)NNC(=O)COc2ccc(Br)cc2)CCCC1	733352474	DPBJOKKPVUIKEW-UHFFFAOYSA-N	441.326	1.807	50	20	IDGD	
Cc1nc(-c2ccccn2)nc(NNC(=O)CCNS(=O)(=O)c2ccccc2)c1C	734256142	LYHGBHFUBSSEKV-UHFFFAOYSA-N	426.502	1.967	50	20	IDGD	
CCOCCCN1CC[C@@H](NC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)[C@H](C)C1	734542035	KGHONLLIUPSIQJ-SJLPKXTDSA-N	444.536	1.659	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)C[C@H](NC(N)=O)c2ccccc2)CC1	734825100	UMSIVUBTHQUELV-INIZCTEOSA-N	448.524	1.516	50	20	IDGD	
Cc1ccc(O[C@@H](C)C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)cc1	735117318	QPRPOCOACHJOOO-INIZCTEOSA-N	433.534	1.237	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2cc(O)nc3ccccc23)CC1	735117921	JDXXTBCOJFUHSN-UHFFFAOYSA-N	442.501	1.028	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2ccnc(N3CCCCC3)n2)cc1OC	740312358	UTNCIWHXRNIHQR-UHFFFAOYSA-N	443.460	1.102	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1)NNC(=O)c1cccc2ccccc12	741695476	GPFCNNPCKHFGSZ-UHFFFAOYSA-N	442.453	1.878	50	20	IDGD	
CN(CC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)Cc1ccc(N2CCOCC2)cc1	741734287	BUPWCWOIPBVWKN-UHFFFAOYSA-N	427.461	1.324	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)CCS(=O)(=O)c2ccc(Cl)cc2)c1	741834992	GYHHIJCTSDQENF-UHFFFAOYSA-N	449.872	1.380	50	20	IDGD	
Cc1nn(C)c2sc(C(=O)N[C@H](C)C(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)cc12	742031779	OGYDIPLYTLLWFX-SNVBAGLBSA-N	430.446	1.431	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCN(c2cccc(Cl)c2)C1=O)c1nnc(O)c2ccccc12	742034275	LHUNWBQLHRTIHH-HNNXBMFYSA-N	425.832	1.803	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCc2ccccc2-n2cccn2)c2ccccc2c1=O	743358991	PPXXYXYIIXBULC-UHFFFAOYSA-N	431.456	1.746	50	20	IDGD	
Cc1nn(-c2ccccc2)c(C)c1CC(=O)OCC(=O)NNC(=O)c1ccc(C#N)cc1	744589181	NFSAUYIZWWCFJO-UHFFFAOYSA-N	431.452	1.908	50	20	IDGD	
O=C(COc1ccc(Cl)cc1)NNc1ccccc1S(=O)(=O)N1CCOCC1	744618797	CPVVYXFDDQJFSG-UHFFFAOYSA-N	425.894	1.883	50	20	IDGD	
CCc1ccc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1[N+](=O)[O-]	747013078	QNYAPZKOPNTOAL-QGZVFWFLSA-N	429.385	1.301	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)Cc2ccncc2)ccc1OCC(=O)N1CCCCC1	747319106	ICYLJRCTZILIOI-UHFFFAOYSA-N	440.500	1.875	50	20	IDGD	
O=C(CN1C(=O)NC2(CCCC2)C1=O)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1	748522561	VJHOMLVFLDPWCG-UHFFFAOYSA-N	434.396	1.288	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)Cc3cccc4cccnc34)cc2)CC1	748620490	QGRXLEDGRXRPKZ-UHFFFAOYSA-N	439.541	1.857	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)c1cc(S(=O)(=O)N2CCC2)ccc1Cl	748713773	SODUCTFLHOMMLX-UHFFFAOYSA-N	437.905	1.712	50	20	IDGD	
O=C(NN=C1C(=O)Nc2cccc(Cl)c21)C(=O)NN=C1C(=O)Nc2cccc(Cl)c21	750916569	NPKPIYKBZKOBCU-UHFFFAOYSA-N	445.222	1.238	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)N[C@H]1CCN(c2cccc(Cl)c2)C1	751101719	GZNWJXZBNIUQDL-KRWDZBQOSA-N	443.939	1.956	50	20	IDGD	
Cc1cc(S(=O)(=O)NNC(=O)[C@H]2COc3ccccc3O2)sc1Br	751202346	KRPPPVZVSQQTSH-LLVKDONJSA-N	433.305	1.969	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNc2nc3ccccc3c(=O)n2C)c1	752916164	QZSVRGPXUOCDJY-UHFFFAOYSA-N	429.502	1.721	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN2CC[S@](=O)C[C@@H]2c2cnn(CC)c2)cc1C	753814245	WUJKOUSINYIDEW-HOLBHBGLSA-N	437.591	1.402	50	20	IDGD	
CC(=O)N1CC[C@H](CN(C)C(=O)NNC(=O)[C@H](C)Oc2cccc(Br)c2)C1	754837849	GWYMUBSOWMWJII-GXTWGEPZSA-N	441.326	1.757	50	20	IDGD	
COc1ccc(S(=O)(=O)NC2CC2)cc1NC(=O)NNC(=O)c1cccc(N(C)C)c1	755611987	LBMODXMTVVEZMQ-UHFFFAOYSA-N	447.517	1.668	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)C(=O)Nc2ncc(CC)s2)c2ccccc2c1=O	756163399	HORHRHBTYKFLJN-UHFFFAOYSA-N	442.501	1.615	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)Nc1ccc(CCC(=O)N2CCCC2)cc1	756207449	PQYQZRWDDQOPAT-UHFFFAOYSA-N	448.487	1.684	50	20	IDGD	
O=C(NNC(=O)C(F)(F)c1nccs1)c1cccc(S(=O)(=O)N2CCCCC2)c1	756441983	CZBLBMMMRVFCNS-UHFFFAOYSA-N	444.485	1.871	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)Nc2cccc(S(=O)(=O)NC3CC3)c2C)c1	756704445	HXYHVTAOHLIRSR-UHFFFAOYSA-N	432.502	1.976	50	20	IDGD	
CC[C@@H](NC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1)c1c(C)noc1C	757780079	IROGWFDGQXOJJT-MRXNPFEDSA-N	437.522	1.702	50	20	IDGD	
O=C(CSc1nnc(-c2ccc(Cl)cc2)o1)NNC(=O)C(=O)Nc1ccccn1	758841908	YPJAWFGCQWOUQW-UHFFFAOYSA-N	432.849	1.663	50	20	IDGD	
Cc1ccc(CNC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c(O[C@@H]2CCOC2)c1	758901197	OUWCTYJSMGRVIA-OXQOHEQNSA-N	427.457	1.833	50	20	IDGD	
NC(=O)c1cc(C(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)co1	759391669	YTQCOSNMTDKEMM-UHFFFAOYSA-N	434.455	1.316	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(\C#N)C(=O)N2CCC3(CC2)NC(=O)N(C)C3=O)c1C	759621364	HNVOZCPBPVKPGP-LZNAANCOSA-N	427.505	1.762	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)CCC(=O)C(C#N)=C2N(C)c3ccccc3N2C)nc1	759738446	MFZWTQDSYDGOQX-UHFFFAOYSA-N	434.456	1.982	50	20	IDGD	
Cn1cc(-n2cc(C(=O)NNC(=O)c3cc(Br)ccc3O)ccc2=O)cn1	761091640	HVBAYPFUAILMAQ-UHFFFAOYSA-N	432.234	1.114	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)Nc1nc(CN2CCOCC2)cs1	761221827	FQMPVLCQUGLGLC-UHFFFAOYSA-N	437.547	1.929	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)[C@H]1CN(C(=O)OC(C)(C)C)CCO1	761636934	LCAIHRQLYJKHSF-CQSZACIVSA-N	425.507	1.571	50	20	IDGD	
CN(C)C(=O)C[C@@H]1CN(C(=O)C(=O)NNC(=O)c2ccncc2)c2ccc(Cl)cc21	763462626	QTQAOIFMAIATKW-CYBMUJFWSA-N	429.864	1.105	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1ccnn1Cc1ccccc1F	763472045	RWATTYLNUXVAPG-UHFFFAOYSA-N	426.364	1.378	50	20	IDGD	
CCc1nc2cc(NC(=O)C(=O)NNC(=O)c3cc(OC)c(OC)c(OC)c3)ccc2o1	763538408	BBERKSUXSILMJJ-UHFFFAOYSA-N	442.428	1.816	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)c(OC[C@H]2CCCO2)c1	763550689	FQRHALYEJIDGTM-OAHLLOKOSA-N	441.440	1.681	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)Nc1cccc(CCN2CCCC2)c1	763579066	TWTNIWFRBFMGPW-HXUWFJFHSA-N	438.484	1.251	50	20	IDGD	
Cc1nccc(-c2cccc(NC(=O)C(=O)NNC(=O)c3c(C)nc4ccccn34)c2)n1	763630396	ZAXUYKMGLHUPBW-UHFFFAOYSA-N	429.440	1.808	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2csc3ccccc23)c1	763719022	TZSDPSPUIJTXKV-UHFFFAOYSA-N	446.510	1.551	50	20	IDGD	
CCN(CC)C(=O)COc1cccc(NC(=O)C(=O)NNC(=O)c2cccc(Cl)c2)c1	763750278	MDGMOFBRVJIRDI-UHFFFAOYSA-N	446.891	1.987	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(N3CCSCC3)cc2)c1	763753015	CQKXFPIZHXNSIH-UHFFFAOYSA-N	427.530	1.706	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(CN3CCOC3=O)c2)cc1	763808615	DGEZXDIIDDFQHF-UHFFFAOYSA-N	426.429	1.112	50	20	IDGD	
Cc1sc2ncnc(SCC(=O)NNC(=O)CNC(=O)c3cccnc3)c2c1C	763825646	UKUKIBRAWMUOEW-UHFFFAOYSA-N	430.515	1.373	50	20	IDGD	
CCCNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)c1	763848234	AYMNSLGDVNBNJW-ZDUSSCGKSA-N	430.436	1.519	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)C[C@H](OC)C3)cc1OC	763900266	HZCGUJMZWJSWCO-QGZVFWFLSA-N	427.457	1.607	50	20	IDGD	
CNC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CC[C@H](C)C3)cc1	763941137	KCZUQTSAYOVDCG-LBPRGKRZSA-N	444.513	1.397	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc(S(C)(=O)=O)c(C(F)F)c1	763959421	GYMVWVIMSKOGCK-UHFFFAOYSA-N	425.413	1.736	50	20	IDGD	
Cn1c(=O)n(C)c2cc(NC(=O)C(=O)NNC(=O)c3cc4c(s3)CCCCC4)ccc21	763969677	ZYGFHGPABKHMKM-UHFFFAOYSA-N	441.513	1.607	50	20	IDGD	
CN(C)C(=O)C[C@H]1CN(C(=O)C(=O)NNC(=O)c2cccn2C)c2ccc(Cl)cc21	763992476	FKQNYWXRJOVWEZ-LBPRGKRZSA-N	431.880	1.048	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc4c(c3)C(=O)N(C)CC4)n[nH]2)cc1	764110458	JZPUQFSSXDHUTM-UHFFFAOYSA-N	446.467	1.413	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccc([C@H](C)N2CCOCC2)cc1	764137146	ZYCQLXWMHXOGNU-INIZCTEOSA-N	440.500	1.417	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C)c(C(=O)N(C)C)c2)o1	764139087	NMMVJGNLDWRDQF-UHFFFAOYSA-N	443.504	1.531	50	20	IDGD	
CCOCCOc1ccc(Br)cc1NC(=O)C(=O)NNC(=O)CC1CC1	764142297	NYYYZYNIPTWFBL-UHFFFAOYSA-N	428.283	1.750	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CCC(C)C)cc1S(=O)(=O)N1CCCCC1	764199505	UMXCGXGKJCNKHH-UHFFFAOYSA-N	438.550	1.692	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)C(=O)Nc2ccc(SC)nc2)c1	764231281	NTVQODWQJTVMCW-UHFFFAOYSA-N	439.291	1.974	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)ccc1O)C(=O)Nc1cccc(-n2cccn2)c1	764278000	PMJANSDMHGJDKO-UHFFFAOYSA-N	444.245	1.740	50	20	IDGD	
COC(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c1	764343950	WFAWOCLXIMTPIM-UHFFFAOYSA-N	441.831	1.712	50	20	IDGD	
CC(C)CNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)COCc2ccccc2)cc1	764367565	XZNTYSFXTYLSRU-UHFFFAOYSA-N	426.473	1.375	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc(C(N)=O)c(C)c3)n[nH]2)cc1C	764387247	IBEZPDDMYJFHFE-UHFFFAOYSA-N	434.456	1.501	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H]2CCO[C@@H](C(C)(C)C)C2)c1	764512256	ITKDGCYREXHQCR-GDBMZVCRSA-N	426.539	1.475	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1ccc(C#N)cc1)C(=O)NNC(=O)Cc1cccc2ccccc12	764639117	DETNILHQKZNPPM-OAHLLOKOSA-N	436.493	1.768	50	20	IDGD	
O=C(NCc1ccc(N2CCCS2(=O)=O)cc1)NNc1ccc(-n2cccn2)nn1	764781168	WIPLKRCWTMNDFA-UHFFFAOYSA-N	428.478	1.029	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1cc(NC(=O)C(=O)NNC(=O)OC(C)(C)C)ccc1F	765388868	FSNVETAXEZYBPA-UHFFFAOYSA-N	432.474	1.397	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(OC)c(NC(=O)C(=O)NNC(=O)OC(C)(C)C)c1	765391346	RHLHVBMLJGDVPF-UHFFFAOYSA-N	444.510	1.220	50	20	IDGD	
O=C(NNC(=O)c1ccc(=O)n(Cc2ccccc2)n1)c1cc(-c2ccc(F)cc2)[nH]n1	765620683	ZOAJDPLBXTTWJJ-UHFFFAOYSA-N	432.415	1.896	50	20	IDGD	
C[C@@H](CCc1ccccc1F)C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765736805	AZHDIMVQPWMUGH-SFHVURJKSA-N	440.519	2.000	50	20	IDGD	
CS[C@H](C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1)c1ccccc1	766636765	URDVEZWPZFBLIV-FQEVSTJZSA-N	426.542	1.696	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)CN1CCN(Cc2cccc(Cl)c2)C(=O)C1	766942349	PEOOUNBNELRJLH-UHFFFAOYSA-N	428.920	1.683	50	20	IDGD	
COc1ccc(C2(C(=O)OCC(=O)NNC(=O)Cc3ccccc3C)CCOCC2)cc1	767310891	ZVSQSKKPCWOCNT-UHFFFAOYSA-N	440.496	1.985	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)CSc1nnc(COc2ccccc2)n1N	768286344	PFRSEKDYRBSNLO-UHFFFAOYSA-N	426.502	1.362	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@H](C(=O)NNC(=O)c2ccc3c(c2)OCCO3)C(C)C)cc1	770404209	GFDPSKKIIRZYLH-IBGZPJMESA-N	447.513	1.530	50	20	IDGD	
COC(=O)C[C@]1(NC(=O)CCC(=O)C(C#N)=C2N(C)c3ccccc3N2C)CCCOC1	771658147	XNHNZTYUBDSQJL-HSZRJFAPSA-N	440.500	1.886	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)c1cc(N2CCOC2=O)ccc1F	772193169	QITCYWDKJWJDMN-UHFFFAOYSA-N	434.811	1.513	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2ccc(NC(=O)N(C)C)cc2Cl)C[C@H](C)O1	772371834	BZSWAOMHIQDRLJ-STQMWFEESA-N	425.917	1.694	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)[C@@H]1CN(Cc2ccccc2)CCO1	772885270	YJMCZYCYJAAECV-SFHVURJKSA-N	430.892	1.005	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)ncc1Br	773523322	BTDNZIZKGJMCMV-UHFFFAOYSA-N	441.669	1.971	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)C(=O)Nc1ccc(Br)cn1	773526850	DAKCOHHEFPBIEA-UHFFFAOYSA-N	431.044	1.334	50	20	IDGD	
Nc1nc(Cl)cc(NNC(=O)c2cc(S(=O)(=O)NCc3ccccc3)ccc2O)n1	773864465	YFOJIBXCJMBXHR-UHFFFAOYSA-N	448.892	1.653	50	20	IDGD	
CCS(=O)(=O)c1cc(F)ccc1NC(=O)C(=O)NNC(=O)c1ccc(C)c(F)c1	773889135	MWINJCIQISQEDP-UHFFFAOYSA-N	425.413	1.467	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)N[C@@H](c1ccc(OC(F)F)cc1)C(F)(F)F	776011791	BHDSZKPIVPWHGN-XCBNKYQSSA-N	448.370	1.160	50	20	IDGD	
Cn1cc([C@H](NC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])c2ccc(F)cc2)cn1	776196187	GLAPTFKPBLEGRP-LJQANCHMSA-N	442.407	1.966	50	20	IDGD	
CC(C)N1C(=O)C[C@@H](C(=O)NNc2ccc(C(N)=O)nn2)[C@H]1c1ccc(Cl)c(F)c1	776488407	NONVBTAFJXCBOY-PIGZYNQJSA-N	434.859	1.809	50	20	IDGD	
CN1C(=O)C[C@@H](C(=O)NNC(=O)CNC(=O)OC(C)(C)C)[C@@H]1c1ccc(Cl)c(F)c1	778443480	UAMBHLYKTJCGMX-BZNIZROVSA-N	442.875	1.671	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)NCc1cc(Cl)c2c(c1)OCCCO2	778583741	PGJYLBYCUIJQPS-UHFFFAOYSA-N	428.873	1.856	50	20	IDGD	
O=C(Cn1cc(NC(=O)C(=O)NNc2ccccc2OC(F)(F)F)cn1)NC1CC1	778804994	YYJDJQAKPUPSKH-UHFFFAOYSA-N	426.355	1.142	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)[C@H]1CCN(Cc2ccccc2)C1	779413646	UDXXBQIZRFRKHG-WMZOPIPTSA-N	448.527	1.788	50	20	IDGD	
CS(=O)(=O)N1CC(CNC(=O)NNc2ccc(Br)cc2C(F)(F)F)C1	779696467	OAZIYVLIDCRKGS-UHFFFAOYSA-N	445.261	1.985	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCC[C@H]2CCCCO2)c1	780908178	RIOKLBWBNKTJDH-MRXNPFEDSA-N	426.539	1.620	50	20	IDGD	
CC(=O)Nc1ccc(C)c(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)c1	780926721	NRJJXCCMDGQWEQ-UHFFFAOYSA-N	437.500	1.172	50	20	IDGD	
COc1cccc(NNC(=O)[C@H](CCS(C)(=O)=O)NC(=O)c2ccccc2Cl)n1	781024069	PROUZSJIJXEDQN-AWEZNQCLSA-N	440.909	1.420	50	20	IDGD	
CS(=O)(=O)CC[C@@H](NC(=O)c1ccccc1Cl)C(=O)NNc1ccnc(F)c1	781365468	OZDGZNZVSRXVQE-CQSZACIVSA-N	428.873	1.551	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)NC[C@@H](C)C#N)c2)cc1	781943761	FJFPMNZINBJZGP-ZDUSSCGKSA-N	431.474	1.600	50	20	IDGD	
COc1ccc(Cl)cc1S(=O)(=O)NNC(=O)c1sc(N2CCOCC2)nc1C	782461771	HROVIPPEINWNMJ-UHFFFAOYSA-N	446.938	1.573	50	20	IDGD	
CN(C)CCn1c(=O)oc2ccc(NC(=O)C(=O)NNc3nc4ccccc4s3)cc21	782814361	YJNCCJFIBGEYTQ-UHFFFAOYSA-N	440.485	1.848	50	20	IDGD	
Cc1nc(Cn2nnc(C(=O)NNC(=O)[C@H](C)Oc3c(C)cc(Cl)cc3C)c2C)no1	784725260	XVWPUEWVPHMMDQ-LBPRGKRZSA-N	447.883	1.825	50	20	IDGD	
CN1C(=O)COc2ccc(NC(=O)C(=O)NNc3nc(-c4ccc(Cl)cc4)no3)cc21	784799505	HVZRFDOJFCKHAT-UHFFFAOYSA-N	442.819	1.827	50	20	IDGD	
O=C1C[C@H](Cc2ccc(NC(=O)C(=O)NNc3ccc(Br)nc3)cc2)C(=O)N1	784813035	QFAUMBBWEVEYCF-NSHDSACASA-N	446.261	1.131	50	20	IDGD	
CCc1nnc(-c2ccc(NC(=O)C(=O)NNC(=O)Cc3cn4ccccc4n3)cc2)o1	785068659	ZKGJHTNYRHAUHP-UHFFFAOYSA-N	433.428	1.275	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)N2CCCN(c3nnc(C(F)(F)F)s3)CC2)cc1	786118200	YQQMFOQEKMMEQP-UHFFFAOYSA-N	439.423	1.995	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)CCCC(N)=O)c2)c(C)c1	786613266	HHZLUIILZUMHJH-UHFFFAOYSA-N	432.502	1.521	50	20	IDGD	
Cn1nc([C@@H]2CCCO2)cc1NC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	788720934	SFCGPUMURUVLCW-IBGZPJMESA-N	441.536	1.637	50	20	IDGD	
O=C(NC[C@@H](Cc1cccc(F)c1)C(=O)N1CCOCC1)NNC(=O)c1ccccc1F	789310468	OBADKDLCKMKSKS-MRXNPFEDSA-N	446.454	1.627	50	20	IDGD	
COc1cc(NNC(=O)C(=O)Nc2cccc(N3C(=O)CN(C)C3=O)c2)ccc1Cl	789804671	KHMPCLRFDULMNE-UHFFFAOYSA-N	431.836	1.829	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cn(C)nc3-c3ccoc3)CC2)cc1	789991079	PMXXOMHAAOSJQP-UHFFFAOYSA-N	436.516	1.567	50	20	IDGD	
COC(=O)c1cc(Cl)cc(S(=O)(=O)NNC(=O)NCCc2cccs2)c1OC	790053193	DWWZICJJUBJUCT-UHFFFAOYSA-N	447.922	1.932	50	20	IDGD	
COc1cc(Cl)c(S(=O)(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1C(=O)O	790382630	YDXJJQDUZXBQET-UHFFFAOYSA-N	429.794	1.578	50	20	IDGD	
CO[C@@H]1CCOc2c(NC(=O)C(=O)NNC(=O)[C@H]3OCC[C@H]3c3ccccc3)cccc21	790965272	LJAIFKUSYZXKQS-CVAIRZPRSA-N	439.468	1.815	50	20	IDGD	
COc1cc(C(F)(F)F)ncc1NC(=O)C(=O)NNC(=O)c1ccc2c(c1)OCO2	792268499	NCNGTFCERJJNGI-UHFFFAOYSA-N	426.307	1.237	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2F)cc(Cl)c1F	792269089	UUBAXKZJTVPUMD-UHFFFAOYSA-N	441.774	1.570	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2cccc3ncccc23)cc(-n2cccn2)c1	792356931	VWXOTDCHAJGSDM-UHFFFAOYSA-N	430.424	1.829	50	20	IDGD	
CNS(=O)(=O)c1ccc(NC(=O)NNC(=O)CSc2ccc(Cl)cc2)nc1	792392289	YYIVBILXTFWXFK-UHFFFAOYSA-N	429.911	1.588	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H](C)N(C)CC(F)(F)F)c1	792774771	WALFWWGROICUAM-LBPRGKRZSA-N	438.472	1.361	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)[C@@]1(O)CCc2ccccc2C1	792790274	KHIPDTIRUSAKCG-OAQYLSRUSA-N	432.860	1.573	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)c1ccc(Br)cn1	793409231	CSWVEYLDEUTOGA-SNVBAGLBSA-N	445.277	1.796	50	20	IDGD	
COCCOC1CCC(C(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)CC1	793679956	CRQQAVRYRWQOSV-UHFFFAOYSA-N	446.592	1.482	50	20	IDGD	
C[C@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)c1ccc2c(c1)OCO2	794196927	WYCWTDCVPGBQMD-AWEZNQCLSA-N	445.497	1.765	50	20	IDGD	
O=C(NNC(=O)[C@@H](O)c1cccc(C(F)(F)F)c1)c1csc(N2CCOCC2)n1	794779240	FNYFSORMWNITLA-ZDUSSCGKSA-N	430.408	1.493	50	20	IDGD	
C=CCNC(=S)NNC(=O)CCC(=O)N[C@H](C)C(=O)c1ccc(Br)cc1	798305006	QFSSQQVIXPHYOH-LLVKDONJSA-N	441.351	1.598	50	20	IDGD	
Cc1cc(O[C@@H]2CCN(C)C2=O)ccc1NC(=O)C(=O)NNC(=O)Cc1ccccc1F	799259071	MYYAYGQCMWJIML-GOSISDBHSA-N	442.447	1.072	50	20	IDGD	
CCc1cc(C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)c2c(CC(C)(C)C)noc2n1	800328948	XGVNDOUHFDDBAY-LBPRGKRZSA-N	437.522	1.505	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)NCCOc1ccc(I)cc1	801013369	SVSQMKPEMOQNOC-UHFFFAOYSA-N	440.241	1.638	50	20	IDGD	
COc1ccc([C@@H]2[C@@H](C(=O)NNC(=O)C(=O)Nc3ccc(C)cc3)CCC(=O)N2C)cc1	801106224	PVLZRTHTECSCBG-AZUAARDMSA-N	438.484	1.699	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CN2CCOc3ccc(Br)cc3C2)c1	801968432	UBZPUJOQNUDABZ-UHFFFAOYSA-N	429.274	1.976	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2sccc2S(=O)(=O)N2CCOCC2)cc1	802056928	HBSVQTKGERMWCZ-UHFFFAOYSA-N	440.503	1.244	50	20	IDGD	
NS(=O)(=O)c1ccc(C(=O)NNc2ccc(-c3cccc(C(F)(F)F)c3)nn2)cn1	804209330	VJTVLRCAKFNWCZ-UHFFFAOYSA-N	438.391	1.962	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)O[C@@H](C)c2nncn2C)cc1	805361298	VJINYRMMWNIXGC-KNGSKEOJSA-N	449.471	1.774	50	20	IDGD	
CNS(=O)(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3c2)ccc1F	806976292	MFUJTAOIGNKFIZ-UHFFFAOYSA-N	444.444	1.287	50	20	IDGD	
O=C(NC[C@H](c1cccs1)N1CCCC1)NNC(=O)c1ccc(-n2cnnn2)cc1	807005795	NFAQNIHTGGXLNI-MRXNPFEDSA-N	426.506	1.505	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)C(=O)Nc1nc(-c2ccc(F)cc2)cs1	807019902	NDMZRQGVXJSSEN-UHFFFAOYSA-N	438.444	1.926	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)c1ccc2c(c1)S(=O)(=O)c1ccccc1C2=O	807371624	PDYIAAUYPHQTGC-UHFFFAOYSA-N	446.481	1.614	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)[C@@H](c1ccccc1)N(C)C	807399031	GYUIVHVULQCFMP-LPHOPBHVSA-N	425.537	1.715	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)N[C@@H]2c3ccccc3CC23CCOCC3)c2ccccc2c1=O	812562368	RKGKGKQNBDWMIB-HXUWFJFHSA-N	447.495	1.972	50	20	IDGD	
Cc1sc2ncn(CC(=O)NNc3ccc(S(=O)(=O)N(C)C)cc3)c(=O)c2c1C	812730203	AZELMLCMJKKQSW-UHFFFAOYSA-N	435.531	1.468	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc3c(C)nn(C)c3c2)cc1	812979565	XDYXMYFUOSCYAM-AWEZNQCLSA-N	439.472	1.834	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccc(OC(F)F)c(F)c2)cc1	813033328	NXCXJHXCFBUHEB-UHFFFAOYSA-N	446.407	1.759	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)COc1ccc(C#N)cc1)c1ccc(N2CCCNC2=O)cc1	813240516	SKVGQPDTICZFJP-OAHLLOKOSA-N	436.472	1.948	50	20	IDGD	
Cc1cc(C)nc(SCc2ccc(C(=O)NNC(=O)[C@H]3CCCS(=O)(=O)C3)cc2)n1	816815586	YNAPNYONUARQJN-KRWDZBQOSA-N	448.570	1.972	50	20	IDGD	
CS(=O)(=O)CC[C@@H](NS(=O)(=O)/C=C/c1ccccc1)C(=O)NNc1ccccc1	821694140	XCLQENQKLMISJZ-NKAIQICCSA-N	437.543	1.523	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc2ccccc2c1)NNC(=O)CNc1ccccc1	823328296	AWVSOVIPEDJEGF-UHFFFAOYSA-N	426.498	1.768	50	20	IDGD	
O=C(NNC(=O)C1(c2cccc(Br)c2)CCCC1)[C@H]1CCS(=O)(=O)C1	887555005	NVTKWRFOPGTMMX-LBPRGKRZSA-N	429.336	1.843	50	20	IDGD	
CCN1CCC[C@H]1Cn1c(C)cc(C=NNC(=O)CSc2nnc(O)nc2O)c1C	914695486	XSEUDRSZHCUJOX-HNNXBMFYSA-N	433.538	1.428	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2ccc(-n3cnnn3)c(C)c2)c2ccccc2c1=O	914750572	OAHNQUYICFIPLN-UHFFFAOYSA-N	432.444	1.165	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)NCCN2CCS(=O)(=O)CC2)c(C)n1C[C@@H]1CCCO1	915264198	OFTAHXOSTXGYEU-ACSPXDACSA-N	434.562	1.038	50	20	IDGD	
Cc1ccc(OCCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c(C)c1	915929994	NYPFRNCABOEXCV-UHFFFAOYSA-N	434.518	1.577	50	20	IDGD	
Cc1cc(O)cc2c1C(=O)C(=NNC(=O)c1ccc(S(=O)(=O)N3CCCC3)cc1)O2	915946485	KUKRHINVFINMID-UHFFFAOYSA-N	429.454	1.804	50	20	IDGD	
O=C(NCc1cccc(OCC(F)(F)F)c1)NNC(=O)c1ccc(-n2cnnn2)cc1	916388806	JEEONAGNHIFXFC-UHFFFAOYSA-N	435.366	1.748	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)NCc2ccccc2CN2CCCC2=O)nc2ccccc21	916413431	CCWXDUCBZWSGQC-UHFFFAOYSA-N	434.500	1.769	50	20	IDGD	
CCNC(=O)c1cccc(CNC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)c1	916644911	CCRZIXHHXGBRDY-UHFFFAOYSA-N	446.533	1.182	50	20	IDGD	
CCNS(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)c2ccc(Cl)cc2OC)c1	917975796	AAIJSECIAUIQLG-UHFFFAOYSA-N	429.857	1.861	50	20	IDGD	
C[C@]1(NNC(=O)NCc2ccc(OCCOc3ccccc3)nc2)CCS(=O)(=O)C1	918222438	WNEOSDGJFWAUCH-FQEVSTJZSA-N	434.518	1.420	50	20	IDGD	
O=C(NNS(=O)(=O)c1cccc2c1COC2=O)c1ccc(F)cc1Br	918728955	UGUBMLPNGYSXAF-UHFFFAOYSA-N	429.223	1.882	50	20	IDGD	
COC[C@@H](C)n1c(C)cc(/C=C(/C#N)C(=O)OCC(=O)N2CCC(C(N)=O)CC2)c1C	1317690041	VELPVUGAELHHIH-SMLKNPDNSA-N	430.505	1.486	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2ccc(Cl)cc2OC)cc1	1317719146	ZFSCZKQBBHXESZ-UHFFFAOYSA-N	441.893	1.487	50	20	IDGD	
Cc1cn(CC(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)c2ccccc12	1333467284	SUXVURBKQKDZAG-UHFFFAOYSA-N	433.512	1.555	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1nn[nH]c1C(F)(F)F)C2)[C@@H](F)Cl	1778024871	AVYKGZOOSVNILU-XPLICSAQSA-N	427.786	1.485	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)o1	1779031205	QZIXHTZDDOTPQQ-APPDUMDISA-N	428.283	1.465	50	20	IDGD	
CSCC[C@H](O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@](C)(Cl)CCl)C1	1780714897	KJOMKJBVNPGLLO-IHETXDGRSA-N	441.421	1.851	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)CCS(=O)(=O)c3ccccc3)CCO2)C1	1781213065	LAEIBKZEEQFRCA-PXNSSMCTSA-N	442.965	1.698	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)c3cnc4ncccn34)CCO2)C1	1781229115	CCPUNPQWRMSGNV-MSOLQXFVSA-N	426.304	1.409	50	20	IDGD	
O=C(c1cnc2snnc2c1)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781333267	FJBWXWDBVJLFAO-XHDPSFHLSA-N	444.286	1.220	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCc1ncc[nH]1)C2	1782002601	RYPGEWCFAVBMTL-PMUMKWKESA-N	427.343	1.640	50	20	IDGD	
Cc1ccc(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CCC(=O)NN(C)C)C2)cc1	1782210915	ZFIDFTQCNNEONM-HYBUGGRVSA-N	444.576	1.424	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)[C@@H]3CCCN3C(C)C)CCO2)C1	1783354019	LZJOTGPONDPRKO-JTDSTZFVSA-N	430.387	1.863	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)CNC(=O)OC(C)(C)C)CCO2)C1	1783354808	GBWDTQWHVGNXJX-ACJLOTCBSA-N	448.358	1.515	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cccc3ncccc13)CCO2	1783935610	WLSHONPRGGDHDX-HSZRJFAPSA-N	439.516	1.051	50	20	IDGD	
O=C(CC(=O)N1CCO[C@@]2(CCN(C(=O)C(Cl)Cl)C2)C1)Nc1ccc(F)cc1	1783948182	FEHINIMMHASLHZ-SFHVURJKSA-N	432.279	1.788	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(C(F)(F)F)cc3)C[C@@H]21)[C@H](O)CCl	1784093228	SCOCQEWCSFCZMB-HNKHHVNMSA-N	434.842	1.898	50	20	IDGD	
CC(C)(C)OC(=O)CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]21	1784781247	ZTYUYBVZOLFXOW-MNUAXYBXSA-N	437.364	1.934	50	20	IDGD	
C[C@@H](Cn1cccn1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21	1785442566	UEEMVVAHKSYKKM-YTFOTSKYSA-N	431.306	1.189	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)C2)C1	1785503721	OSYMXEUJMNOBFH-KOXUSJRISA-N	438.908	1.912	50	20	IDGD	
O=C(CN1C(=O)CSC1=S)NC1(c2ccc(NC(=O)[C@@H](O)CCl)cc2)CCC1	1786137645	VNZMZCJTVRDMCK-ZDUSSCGKSA-N	441.962	1.581	50	20	IDGD	
COCCn1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]32)n1	1787637174	PQCNDCYZFPNOHB-IWKLRQMXSA-N	447.363	1.359	50	20	IDGD	
CN[C@H](CC(=O)Nc1ccc(C2(NC(=O)[C@@H](C)Br)CCC2)cc1)C(=O)O	1788065392	QIZDOFUITMRMDB-BXUZGUMPSA-N	426.311	1.967	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)Cn3cncn3)[C@H]2C1	1788728015	XJGVMFADNLIMDI-GVRJEKJASA-N	442.358	1.067	50	20	IDGD	
Cc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Cl)C[C@@H]32)c(-n2nccn2)c1	1789291126	LITFADOFEUIGFY-QXRTWZOPSA-N	435.887	1.703	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)c1ccc([N+](=O)[O-])[nH]1	1789390530	HTDXVFYVQOUPNW-PZEZNAACSA-N	433.234	1.207	50	20	IDGD	
Cn1ccnc1C(=O)NC1(c2ccc(NC(=O)c3cnccc3C(=O)NN)cc2)CCC1	1789521142	KYICDEYULLCCNE-UHFFFAOYSA-N	433.472	1.480	50	20	IDGD	
COC(=O)c1ccc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Cl)C[C@@H]32)s1	1789689787	UBOABTMTAXKMTM-RKOGSIPDSA-N	432.901	1.591	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CC(=O)Nc3cc(C)on3)C[C@@H]21	1789860295	OEWLBPNFGIHWAI-AJNGGQMLSA-N	426.901	1.309	50	20	IDGD	
Cn1nc2c(c1C(=O)N1CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]3C1)CCC2	1789925015	KVEHKJLUROSHSF-ZAJUMQRFSA-N	443.317	1.193	50	20	IDGD	
COc1ccc(C(=O)Nc2ccc(C3(NC(=O)c4ccc(B(O)O)cc4)CCC3)cc2)nn1	1789960604	NJXMBROYOZCAMB-UHFFFAOYSA-N	446.272	1.227	50	20	IDGD	
NC(=O)c1ccccc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21	1790128699	VKCIMHGBKWCDLB-HJPIBITLSA-N	442.285	1.069	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc4nccn34)[C@H]2C1	1790419023	VKIWZPJOXGPOOY-HOSILWTGSA-N	435.322	1.711	50	20	IDGD	
CC(=O)N[C@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)CBr)C2)C(C)(C)C	1793190145	GSSKOAMNNZROOS-HVQZGBDUSA-N	446.386	1.158	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(F)cc1F	1793921566	TWVGZCDAKRFHFM-QGHCGXIDSA-N	434.487	1.989	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2)c1ccc(N2CCOCC2)cc1	1796491642	ZEEFPWMQDPCMKS-SCAQPMJSSA-N	442.343	1.530	50	20	IDGD	
CC(=O)Nc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)Br)C3)ccn1	1796747178	YPZNYRUNZQMPOA-BWPSIRRCSA-N	439.310	1.027	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(N3CCOCC3)n1)C2	1799270107	QDVMINRRDZXOMM-RCJHGTSTSA-N	436.940	1.139	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@](C)(Cl)CCl	1799279371	LIVSUSKTEQUZFF-NVGYGPBWSA-N	430.170	1.986	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc3ccccc3n1)C2)[C@H](F)Br	1799346876	DGEAVXILPCACAD-OJXGSEEGSA-N	437.269	1.524	50	20	IDGD	
CCOc1cccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](Cl)COC)C3)c1O	1799756806	YBJMAWWKACJNLO-IARIHHJXSA-N	426.897	1.248	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cn1cc(Cl)cn1)C2	1800638906	CMSDUHPRGFTSOQ-WJNVRWDZSA-N	433.734	1.300	50	20	IDGD	
CC(C)(CCl)C(=O)NC[C@H]1CCN(C(=O)COc2ccc(O)nn2)[C@@H]1c1cccnc1	1802904683	NFGKRERWMIYGJA-DNVCBOLYSA-N	447.923	1.927	50	20	IDGD	
CCS(=O)(=O)CC(=O)NC[C@@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1	1803511435	BAUFERRYSRRPHE-YOEHRIQHSA-N	446.367	1.307	50	20	IDGD	
COc1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)c(Cl)c1	1803739275	RCCYVQFYBYFCTD-BJWYYQGGSA-N	442.708	1.594	50	20	IDGD	
Cc1cc(C(=O)NC[C@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)c(C)o1	1805566850	MXKQHCZNXUMHRA-XMSQKQJNSA-N	441.532	1.984	50	20	IDGD	
Cc1occc1C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1805615385	LCARKUCXAHWFAH-RXVVDRJESA-N	433.273	1.296	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)Cn2ccnn2)[C@@H]1c1cccnc1	1807694258	YWXGQOYGRTWHEB-ZOBUZTSGSA-N	435.326	1.553	50	20	IDGD	
Cc1ccn2ncc(C(=O)NC[C@@H]3CCN(C(=O)[C@H](O)CCl)[C@@H]3c3cccnc3)c2c1	1808157757	BWPZTPCORMMHOB-PWIZWCRZSA-N	441.919	1.957	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)[C@H](C)NS(=O)(=O)CC)[C@H]1c1cccnc1	1808244765	OJFITGRTCVSLST-HJWJTTGWSA-N	444.985	1.433	50	20	IDGD	
Cc1cc(C(=O)NCC(=O)N2CC[C@H](CNC(=O)[C@@H](F)Cl)[C@H]2c2cccnc2)no1	1808313629	IZNMNRXMDPUFFC-KBRIMQKVSA-N	437.859	1.348	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)C(C)(C)F)[C@H]1c1cccnc1	1808414200	GDGJIKBXCXXNLT-QRTPEGJISA-N	442.495	1.970	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)c1ccc2cnccc2n1	1809140803	MWNDWIFHVWKVHX-VDGAXYAQSA-N	439.903	1.944	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H](CNC(=O)CCC(N)=O)[C@@H]1c1cccnc1	1812625958	CRMWWVUIRGMRTN-MRRJBJDNSA-N	425.327	1.384	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)c2cc[n+]([O-])cc2)[C@H]1c1cccnc1	1812866779	KJMWDUVTGSWNJS-XKQJLSEDSA-N	433.306	1.818	50	20	IDGD	
CCc1cc(C(=O)N2CC[C@H](CNC(=O)[C@H](Cl)COC)[C@H]2c2cccnc2)n(C)n1	1813033022	YWYDPQKYJJNBDC-SZVBFZGTSA-N	433.940	1.951	50	20	IDGD	
C[C@H](C(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1)n1cccc1	1813074991	WPVAPTPXCOFOHY-LZNRXBQRSA-N	440.548	1.523	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)COCCOC)sc2C1	1814312589	SAVWSDIVYBSGNL-WDEREUQCSA-N	434.356	1.892	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CN2CCOCC2)n[nH]1	1817150508	GFCVNQZHQXAPGX-JSGCOSHPSA-N	428.331	1.517	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@H]2CCCS2)[nH]n1)c1cccc(B(O)O)c1	1817479870	VZFSZTKJCIOGLO-DLBZAZTESA-N	428.323	1.291	50	20	IDGD	
O=C(CCN1CCOC1=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](F)Br)[nH]n1	1818848439	FPJBTSRTQOIFMN-FZMZJTMJSA-N	446.277	1.935	50	20	IDGD	
C[C@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)C(Cl)Cl)[nH]n1)N1CCN(C)CC1	1820790152	XUGHJEZTTLCWOD-OCCSQVGLSA-N	431.368	1.841	50	20	IDGD	
C[C@H](C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1)n1cccc1	1822416981	UONYMPSELNIJEF-WBVHZDCISA-N	429.525	1.838	50	20	IDGD	
CS(=O)(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](F)Br)[nH]n1	1822973184	UPMAYBHZGBZPJY-ZWNOBZJWSA-N	439.307	1.527	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)C2CCSCC2)n[nH]1	1823548504	RPWGFQTXAKNTPN-MRXNPFEDSA-N	436.582	1.918	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(=O)n1C)CC2	1825636422	FUHMCBWSPKEJHT-VHSXEESVSA-N	439.335	1.851	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)Cc1ccccc1)CC2	1826085009	ARQUZAIKFKFJIR-HNNXBMFYSA-N	429.546	1.671	50	20	IDGD	
Cc1cc(C(=O)N[C@@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)ccn1	1826087444	CGRSUDMVSADCTM-CQSZACIVSA-N	430.534	1.445	50	20	IDGD	
CCc1cc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)n[nH]1	1827288966	YWIQHTQBTJZXMB-NRFANRHFSA-N	438.337	1.199	50	20	IDGD	
CO[C@H](C)C(=O)N1CCC([C@H]2CCCCN2C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)CC1	1827679884	ZJMTUDFYKRQUPM-JPBTYYRWSA-N	431.537	1.775	50	20	IDGD	
N#Cc1c[nH]c(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)c1	1829776374	RTMWLJHLDVOLSJ-NRFANRHFSA-N	434.305	1.113	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)n3cccc3)C2)C1	1830545897	ODETZOHXUCZMQA-GPMSIDNRSA-N	442.354	1.537	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4n(n3)CCCC4)C2)C1	1831650218	FQCMRZNRRQGONE-UTKZUKDTSA-N	438.956	1.697	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)/C=C/c2cnc[nH]2)CC1	1831874878	NTLYYWJYCDDDER-ZLQZBKBYSA-N	430.553	1.416	50	20	IDGD	
O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)C1CCC(CO)CC1)CCO2	1832518511	ZHBXRJQCNAYPAJ-LADRWXRNSA-N	447.370	1.027	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)[C@H](C)C3(O)CCC3)CC2)CC1	1833069006	BKYYFMQZFUOPEF-GJZGRUSLSA-N	444.414	1.893	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3cccn3C)CC2)CC1	1834100858	HMIWTZQAOBZCHN-AWEZNQCLSA-N	425.371	1.994	50	20	IDGD	
Cc1nc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)cs1	1834457200	QDAUPJUYILOXKJ-DOMZBBRYSA-N	436.303	1.212	50	20	IDGD	
CCOc1ccc(C(=O)NC2CCN(C3CCN(C(=O)C(Cl)Cl)CC3)CC2)nn1	1836201241	UDBUPDWASZQRMQ-UHFFFAOYSA-N	444.363	1.864	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(CC(C)C)nn3C)CCO2)C1	1836338212	PSNMIWRFKHULFZ-LAUBAEHRSA-N	440.972	1.706	50	20	IDGD	
C[C@]1(C(=O)N2CCC(N3CCC(NC(=O)[C@@H](F)Br)CC3)CC2)CCCN1	1836414011	UHYKHJQKOSUWKK-CRAIPNDOSA-N	433.366	1.391	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(F)n3)CCO2)C1	1837910464	TWVWBVAGMAQJDV-SJKOYZFVSA-N	430.274	1.074	50	20	IDGD	
C[C@H]1C[C@@]1(C)C(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1	1837921588	RCWPCKOKHPOJJS-QMHKHESXSA-N	428.338	1.025	50	20	IDGD	
O=C(c1cc(-c2ccccc2)no1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1837996603	KTWQJGLRMQJHOG-XLIONFOSSA-N	437.855	1.946	50	20	IDGD	
COc1nc(C)ccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1838177921	JRASYKSSIKGLLX-SFHVURJKSA-N	432.304	1.272	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)Cc3cc[nH]n3)CC2)CC1	1838732555	FZACAFSEWHEHBH-ZDUSSCGKSA-N	427.343	1.734	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(F)c(F)c3)CCO2)C1	1839011740	XXZDVUFATJTICL-KPZWWZAWSA-N	447.276	1.818	50	20	IDGD	
Cc1ccnc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)c1	1839152453	ZUGBMOMDCUMRRH-RTBURBONSA-N	430.332	1.696	50	20	IDGD	
COCc1c[nH]c(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)c1	1839153648	MXAKPPXOVGGMCA-RBUKOAKNSA-N	448.347	1.467	50	20	IDGD	
COc1cc(F)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)c(F)c1	1839333263	YGINKWBMLZGXHU-QAPCUYQASA-N	436.814	1.578	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1	1840033650	MJGFLWDNUGNLSI-XJKSGUPXSA-N	437.407	1.078	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4cccc(C)c4[nH]3)C2)C1	1840153395	NENPVSBSXIJRPH-VGOFRKELSA-N	449.935	1.800	50	20	IDGD	
C[C@H](Nc1ccccn1)C(=O)N1CCOC[C@@]2(CN(C(=O)C(Cl)Cl)CCO2)C1	1840188636	VBVSCYMXEDSGMR-UGSOOPFHSA-N	431.320	1.142	50	20	IDGD	
O=C(c1ccc2ccnn2c1)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840189977	WDPNTUJBELCVSB-GOSISDBHSA-N	427.288	1.208	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)COCc2ccccc2)C1	1842816091	WPJYPYWXBVSJAA-KOEQRZSOSA-N	437.500	1.541	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC2(CCCN2C(=O)CC(=O)Nc2cc(C)on2)C1	1843401508	YYAAXHFFSKIYPG-GFCCVEGCSA-N	427.299	1.689	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)Cc1ccc(Br)cn1)C2	1846360964	QLUXDNGMLWDWKH-AWEZNQCLSA-N	430.730	1.844	50	20	IDGD	
CC(C)N(C)S(=O)(=O)c1cccc(C(=O)OCC(=O)NNC(=O)c2ccccc2)c1	9751465	OXVQISVLLSZFTB-UHFFFAOYSA-N	433.486	1.334	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)CCOc2ccccc2OC)c1	25376751	PQTDZLCTOIILKY-UHFFFAOYSA-N	449.529	1.956	50	20	IDGD	
Cc1c(C(=O)NNC(=O)COc2ccccc2-c2ccccc2)cnn1-c1ccc(=O)[nH]n1	25597689	OYGMUTAIQBMDNC-UHFFFAOYSA-N	444.451	1.771	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)NCc1ccc(N2CCc3ccccc3C2)nc1	725872108	KILHJDUXQGHLCK-UHFFFAOYSA-N	448.483	1.498	50	20	IDGD	
C=CCNC(=S)NNC(=O)c1cc(S(=O)(=O)N(C)C)ccc1N1CCCCC1	725908811	VDQSJGVSMWAXIL-UHFFFAOYSA-N	425.580	1.222	50	20	IDGD	
COc1ccc(CN2C[C@@H](C(=O)NNC(=O)[C@H]3COc4ccccc4O3)CC2=O)cc1	726496694	GRBBKOJSWSFIJC-HNAYVOBHSA-N	425.441	1.031	50	20	IDGD	
O=C(COC(=O)c1ccc2c(c1)CCCC(=O)N2)NNC(=O)[C@H]1COc2ccccc2O1	728325408	NKMWVRHXUBHZKS-GOSISDBHSA-N	439.424	1.106	50	20	IDGD	
CCCn1c(C)cc(/C=C(/C#N)C(=O)O[C@H](C)C(=O)N(C)[C@@H]2CCS(=O)(=O)C2)c1C	729236007	KBNBUOKVBDJPOC-PEYDCBHGSA-N	435.546	1.999	50	20	IDGD	
Cc1nc2cc(O)nn2c(C)c1CC(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	729532410	ZLZHWPRMVXGJND-UHFFFAOYSA-N	430.490	1.178	50	20	IDGD	
CC(C)NS(=O)(=O)c1cc(C(=O)NNC(=O)COc2ccccc2O)ccc1F	730778059	BADQMIKAABQZJO-UHFFFAOYSA-N	425.438	1.058	50	20	IDGD	
CCn1c(=O)nc(O)c2c(C(=O)NNC(=O)COc3ccccc3O)cc(C(C)C)nc21	730781430	MKBMLTLUPIXGES-UHFFFAOYSA-N	441.444	1.186	50	20	IDGD	
CS(=O)(=O)CCCC(=O)NNC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1	731186781	UTENTQPHJRAVLH-UHFFFAOYSA-N	427.486	1.520	50	20	IDGD	
C[C@H](NC(=O)/C(C#N)=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)N(C)C	733163334	JYPHHKONEQJSIR-OJNRTJSBSA-N	442.907	1.579	50	20	IDGD	
C[C@H]1CN(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)C[C@@H](C)N1C(=O)OC(C)(C)C	733335860	FNOYKFKXOCSBPK-OKILXGFUSA-N	444.496	1.346	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)c1cc(Br)c2c(c1)OCO2	734241855	WQHKUFKZSSWWHA-UHFFFAOYSA-N	445.270	1.647	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)c2ccc(Cl)c(S(=O)(=O)NCc3ccccc3)c2)cn1	735522306	NZYGNLZRZAFCTM-UHFFFAOYSA-N	447.904	1.627	50	20	IDGD	
CC(=O)NCC(=O)N1CCc2cc(C(=O)NNC(=O)Cc3ccc4ccccc4c3)ccc21	735688162	STCHNKBJCRCHHY-UHFFFAOYSA-N	444.491	1.869	50	20	IDGD	
COc1ccccc1NC(=S)NNC(=O)c1ccc2c(c1)CCN2C(=O)CNC(C)=O	735702995	DVBQKMAIZJGBLH-UHFFFAOYSA-N	441.513	1.352	50	20	IDGD	
O=C(CSc1nnnn1CC(F)(F)F)NNC(=O)c1cccc(Br)c1	742772308	YBNBQWFTGJIPFA-UHFFFAOYSA-N	439.217	1.551	50	20	IDGD	
COc1ccc2c(c1)OCC[C@H]2NC(=O)NNC(=O)c1sc(N2CCOCC2)nc1C	743510517	XSMWLOZGCHSJFE-OAHLLOKOSA-N	447.517	1.765	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(Br)cc2O)c1	744305715	ODIGHRKWNABJEZ-UHFFFAOYSA-N	442.291	1.480	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CN2CCN(C(=O)c3c(F)cccc3Cl)CC2)c1	744395436	XRLNBCSBQPGLFW-UHFFFAOYSA-N	443.866	1.570	50	20	IDGD	
COc1ccc(Br)c(C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)c1	744557612	IYUFMPLDHLOWCK-UHFFFAOYSA-N	432.230	1.947	50	20	IDGD	
CCCC(=O)N1CCC[C@H](C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)C1	744619768	XVNILAVNNGOZOA-INIZCTEOSA-N	438.550	1.189	50	20	IDGD	
C[C@H]1C[C@@H](NC(=O)NNC(=O)CSc2ccc(Cl)cc2)C(=O)N1c1cnn(C)c1	745919026	QDERVKWVPURPHH-XHDPSFHLSA-N	436.925	1.690	50	20	IDGD	
COCCNS(=O)(=O)c1c[nH]c(C(=O)NNC(=O)CSc2ccc(Cl)cc2)c1	746094425	XDSWTZXYRMWUGB-UHFFFAOYSA-N	446.938	1.146	50	20	IDGD	
COc1cc(OC)cc([C@H](NC(=O)NNc2nc(C)cc(OC)n2)c2nccn2C)c1	746747140	LIXFRKVSNODNGJ-KRWDZBQOSA-N	427.465	1.960	50	20	IDGD	
O=C(NNC(=O)c1cccc2[nH]ccc12)c1cccc(S(=O)(=O)N2CCOCC2)c1	747348164	DDFWVSABHXNMIJ-UHFFFAOYSA-N	428.470	1.264	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)[C@@H](C)NS(=O)(=O)c2cccs2)o1	747715842	PPJFOURKLKPPIX-GFCCVEGCSA-N	428.536	1.311	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F	748614353	KKILUOMSEFJQTF-CYBMUJFWSA-N	448.442	1.424	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)/C=C\c3ccccc3C#N)cc2)CC1	748619518	JEAYQLBFONAOPV-WDZFZDKYSA-N	425.514	1.651	50	20	IDGD	
COc1ccc([C@]2(C)NC(=O)N(CC(=O)NNc3cccc([N+](=O)[O-])c3C)C2=O)cc1	748686754	WOSRHGPQZYVRHI-FQEVSTJZSA-N	427.417	1.822	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)c1nn(-c2ccc(F)c(F)c2)c2c1CCC2	751206179	FZLWZKWOGSKWGF-UHFFFAOYSA-N	445.451	1.892	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNS(=O)(=O)c1ccc(OC(F)F)c(Cl)c1	751281365	DBDGHCWWGZELTE-UHFFFAOYSA-N	439.849	1.742	50	20	IDGD	
CCN1C(=O)[C@@H]2CN(C(=O)/C(C#N)=C/c3cc(C)n([C@@H](C)COC)c3C)CCN2C1=O	752507885	KFIFNTAISVMYBQ-GAFVEGQGSA-N	427.505	1.714	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)NNC(=O)N[C@@H]1CCCN(Cc2ccccn2)C1=O	753287442	CJROXLMQZLWNRM-QGZVFWFLSA-N	430.896	1.940	50	20	IDGD	
C[C@H](NC(=O)OC(C)(C)C)[C@@H](C)C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	755314716	ZKAOEJNGBXBDPL-OLZOCXBDSA-N	442.538	1.247	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NN=Cc2c(-n3ccnc3)nc3ccccn23)ccc1Cl	755552687	PQYYRCOEKZNUNW-UHFFFAOYSA-N	443.876	1.585	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)NC2CCN(S(=O)(=O)C(C)(C)C)CC2)c1	755876272	HFNUUHFXKVJNRC-UHFFFAOYSA-N	440.566	1.605	50	20	IDGD	
COC(=O)Nc1cccc(NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)c1	756002579	WJIDTPKTLPXTBT-UHFFFAOYSA-N	449.489	1.647	50	20	IDGD	
C[C@@H](CNC(=O)OC(C)(C)C)NC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	756002599	RHTXBFIERWMDSB-KRWDZBQOSA-N	448.568	1.442	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)Nc1nnc(Cc2ccccc2F)s1	756483454	REBFJLRCJGGGAE-UHFFFAOYSA-N	439.436	1.710	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)cc1-n1cnnn1	756747067	MMZFXWUVERPJGJ-UHFFFAOYSA-N	434.457	1.129	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1nc(-c2ccccc2)oc1-c1ccccc1	758047366	MWVSOJNSHNBDIM-ZDUSSCGKSA-N	428.470	1.707	50	20	IDGD	
Cc1cc(S(C)(=O)=O)cc(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)c1C	758079928	WHAGEJCUFDNXDM-UHFFFAOYSA-N	438.531	1.075	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)c2cnn(CCO[C@H]3CCCCO3)c2C)cc1	758623633	LSYADYVVBNWOTP-FQEVSTJZSA-N	444.488	1.661	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H](C#N)[C@@H](NC(=O)NNC(=O)COc2ccc(C#N)cc2)C1	758752252	MECSLELMWGWWLK-HOCLYGCPSA-N	428.449	1.027	50	20	IDGD	
NC(=O)[C@@H]1CC[C@@H](CNC(=O)NNC(=O)c2cn(-c3ccccc3)nc2-c2ccccc2)O1	760205193	XLRBNVCXJYLBEE-HKUYNNGSSA-N	448.483	1.516	50	20	IDGD	
O=C(CSc1nnnn1CC(F)(F)F)NNC(=O)c1cc(-c2ccccc2)[nH]n1	762932451	NUARDWBJGWDOBU-UHFFFAOYSA-N	426.384	1.179	50	20	IDGD	
CC(C)(C)OC(=O)NCc1cccc(NC(=O)C(=O)NNC(=O)c2ccccc2O)c1	763528752	SOFXKLYHMPOOBS-UHFFFAOYSA-N	428.445	1.817	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)Nc1cccc(OC(F)(F)F)c1	763572318	QMSBZEMKQHIDJB-AWEZNQCLSA-N	425.319	1.511	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc2cnn(C(C)C)c2c1	763657496	NQQYLMDFUZXSNP-UHFFFAOYSA-N	425.445	1.791	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(NC(C)=O)c(F)cc1F	763712375	FTJCHEYGHMSOIU-UHFFFAOYSA-N	434.399	1.651	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(NS(=O)(=O)CC)cc1	763716451	GXUIHZPPYPZKFO-UHFFFAOYSA-N	448.501	1.176	50	20	IDGD	
Cn1ccnc1-c1csc(NC(=O)C(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)n1	763735730	RKCPTOSNIBSVGK-UHFFFAOYSA-N	428.518	1.846	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2cc(F)c(F)cc2Cl)c2ccccc2c1=O	763787380	YYWYAERQJVFYAC-UHFFFAOYSA-N	449.801	1.748	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)C(=O)Nc1ccccc1N1CCCCC1	763790596	KQKCNEULYSUBQK-UHFFFAOYSA-N	434.456	1.725	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)C(=O)Nc2cc(C(C)C)on2)c2ccccc2c1=O	763801108	GGDLJFCNWOZKSO-UHFFFAOYSA-N	440.460	1.708	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccc([S@@](=O)C(F)(F)F)cc1	763838888	WEJZMVRJTHXJHY-SSEXGKCCSA-N	447.366	1.618	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)C(=O)Nc1cccc(NC(=O)c2ccoc2)c1	763839263	IDYHWJKKQUVUBA-UHFFFAOYSA-N	440.387	1.836	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccn(-c2ncccc2F)n1	763857278	MIEVTKAHQWPJMM-LLVKDONJSA-N	430.371	1.099	50	20	IDGD	
Cc1ccccc1-n1nccc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccc(F)cc1	763867531	WJHZQMMALRDXHF-AWEZNQCLSA-N	425.420	1.873	50	20	IDGD	
CS(=O)(=O)c1ccccc1NC(=O)C(=O)NNC(=O)CCSc1ccc(F)cc1	763896005	WDPNMYWIGGLRLS-UHFFFAOYSA-N	439.490	1.498	50	20	IDGD	
O=C(NNC(=O)c1ccc(Br)s1)C(=O)Nc1ccccc1-n1ccnn1	763940598	KKUSHQOGWOTQKQ-UHFFFAOYSA-N	435.263	1.491	50	20	IDGD	
C[C@H](c1cccc(NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)c1)N1CCOCC1	763978883	OEHDKJMPWIAWQT-CYBMUJFWSA-N	446.891	1.839	50	20	IDGD	
COc1cc(Oc2ccccc2)ccc1NC(=O)C(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1	764002678	PVVIKPKLUGODFM-CYBMUJFWSA-N	447.469	1.008	50	20	IDGD	
CC(=O)N(C)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(Br)cn2C)cc1	764005058	SYMYXMBUIIIEBW-UHFFFAOYSA-N	436.266	1.170	50	20	IDGD	
O=C(Cc1cccc2ccccc12)NNC(=O)C(=O)Nc1cccc(N2CCNC2=O)c1	764020353	WBGWUCFVIGRHJI-UHFFFAOYSA-N	431.452	1.698	50	20	IDGD	
O=C(Cc1ccsc1)NNC(=O)C(=O)Nc1ccc(CCC(=O)N2CCCC2)cc1	764035097	SSXULWFSBYCLAP-UHFFFAOYSA-N	428.514	1.632	50	20	IDGD	
C=CCN(CC=C)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2OC)cc1	764047673	KCCAGYYTEIFGOU-UHFFFAOYSA-N	436.468	1.909	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2cccc(Br)c2)ccc1NC(C)=O	764058188	DXXCIXJWQUXFPI-UHFFFAOYSA-N	449.261	1.816	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2cc(F)ccc2OCC(F)(F)F)c1O	764131194	HJEWLXOZMWUJFO-UHFFFAOYSA-N	445.325	1.881	50	20	IDGD	
O=C(CCc1ccco1)NNC(=O)C(=O)Nc1ccc(Cl)c(-n2nnnc2C2CC2)c1	764170831	BVMVCMSXYADIDH-UHFFFAOYSA-N	443.851	1.505	50	20	IDGD	
Cc1ccc(C(=O)N2CCOCC2)cc1NC(=O)C(=O)NNC(=O)CCc1ccccc1	764202185	OHTJCUKHWDJQIQ-UHFFFAOYSA-N	438.484	1.186	50	20	IDGD	
COC(=O)c1ccc(F)c(NC(=O)C(=O)NNC(=O)c2cccc(OC(F)F)c2)c1	764249450	ADINNBVMAJAUQB-UHFFFAOYSA-N	425.319	1.613	50	20	IDGD	
COc1ccc(C#N)cc1NC(=O)C(=O)NNC(=O)c1cc(F)ccc1Br	764270769	SXMZTAOOSCRSSJ-UHFFFAOYSA-N	435.209	1.868	50	20	IDGD	
O=C(Cc1cc[nH]n1)NNC(=O)C(=O)Nc1ccccc1S[C@H](Cl)C(F)(F)F	764293050	KXHUZSCSDIERJN-AWEZNQCLSA-N	435.815	1.958	50	20	IDGD	
CCOCC(=O)NNC(=O)C(=O)Nc1ccc(Cl)cc1C(=O)N1[C@@H](C)CCC[C@H]1C	764317072	IMQHZXAXPSJTCU-BETUJISGSA-N	438.912	1.866	50	20	IDGD	
CCS(=O)(=O)c1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)Cc1ccccc1F	764320339	YCUATILNPZDQKG-UHFFFAOYSA-N	441.868	1.601	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C(=O)Nc1ccc(C[C@H]2CC(=O)NC2=O)cc1)c1ccccc1	764327811	FMVYYJVMYIYMRH-WMZOPIPTSA-N	436.468	1.172	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1ccc2cc(Br)ccc2c1	764401463	WYAOZBROSRWGJH-LLVKDONJSA-N	438.278	1.740	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)c1ccc(CN(C)S(=O)(=O)c2ccc(C)cc2)cc1)N(C)C	764519791	YEKAMCQHTZJSSU-FQEVSTJZSA-N	446.573	1.917	50	20	IDGD	
CC(C)n1ncc2cc(/C=C/C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)c(=O)[nH]c21	765320498	OHMOTFOQKIDFBJ-CMDGGOBGSA-N	446.508	1.771	50	20	IDGD	
CC(C)CCn1cc(C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)nn1	765755440	HHZSSTXBXBEBKV-UHFFFAOYSA-N	447.971	1.556	50	20	IDGD	
Cc1ccc(C(=O)NCCC(=O)OCC(=O)NNC(=O)Cc2ccccc2C)c(O)c1	767323262	XYERSRUVHZEVEH-UHFFFAOYSA-N	427.457	1.062	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2cccc(OC(C)(C)C)n2)c1	768102204	BGNLHXMHTUREOZ-UHFFFAOYSA-N	449.533	1.653	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)C(=O)Nc1cnn(C(F)F)c1	768238657	SGEIBQZYMIYMLA-QMMMGPOBSA-N	446.208	1.594	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)[C@H](C)NC(=O)c2n[nH]c3ccccc23)n[nH]1	768281799	PTAKNYYGCBXBCI-LBPRGKRZSA-N	447.455	1.541	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)c1cc2c(cc1O)OCO2	768292113	VBYVGSUZHZADCU-UHFFFAOYSA-N	446.891	1.353	50	20	IDGD	
C[C@]1(c2cccc(C(=O)NNC(=O)NCc3cccc(C(F)(F)F)c3)c2)NC(=O)NC1=O	769150151	QPDVIWOPYCHQOH-LJQANCHMSA-N	449.389	1.904	50	20	IDGD	
CN(C)C(=O)COc1ccc(C(F)(F)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1	769353647	HPJHZPHFNJXAQC-QGZVFWFLSA-N	449.410	1.233	50	20	IDGD	
CN(C)C(=O)COc1ccc(C(F)(F)C(=O)NNC(=O)COc2ccccc2O)cc1	769380407	YYXWDRMHYHDQQS-UHFFFAOYSA-N	437.399	1.177	50	20	IDGD	
CCCCNC(=O)NNS(=O)(=O)c1cc(C(=O)OC)cc(F)c1Br	769864662	HTPAQILUZKZGRX-UHFFFAOYSA-N	426.264	1.667	50	20	IDGD	
O=C(NNc1cnccn1)Nc1cc(S(=O)(=O)N2CCOCC2)ccc1N1CCCC1	769926032	UHXLWPVLZSMFRH-UHFFFAOYSA-N	447.521	1.246	50	20	IDGD	
CCCCn1cc(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)c(C)n1	771431557	HSYHFKXUPVYZJP-UHFFFAOYSA-N	434.566	1.685	50	20	IDGD	
C[C@H](C(=O)NNc1ccc(Br)c(F)c1)N1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O	771691156	PVUXXVJIPSSEHL-FVJKAEFOSA-N	426.242	1.582	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)CN1C(=O)NC2(CCC(C(C)(C)CC)CC2)C1=O	771855795	NSKYLTHXAVWEAO-FHDQPZTMSA-N	438.525	1.393	50	20	IDGD	
CC(=O)N(CCc1ccccc1)CC(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772195454	MNJMBIWCBSKTHU-UHFFFAOYSA-N	430.892	1.195	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)c(=O)c2ccccc21	772884410	KYFPIHSENZUJGS-UHFFFAOYSA-N	427.848	1.147	50	20	IDGD	
CCC(CC)n1nc(C)cc1C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	775947834	NEVOPNQVVRZGKJ-SFHVURJKSA-N	430.461	1.697	50	20	IDGD	
COc1cccc([C@@H]2[C@@H](C(=O)NNc3nc(O)c4cnn(C)c4n3)CC(=O)N2C2CC2)c1	776475204	DEUPFRBMPBLREL-WMLDXEAASA-N	437.460	1.273	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NC[C@@H]2COC3(CCCCCC3)O2)c2ccccc2c1=O	777764149	LLRKIHXPMNOFRM-CQSZACIVSA-N	429.477	1.343	50	20	IDGD	
C[C@H]1CCN(C(=O)OC(C)(C)C)[C@@H](C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)C1	778296260	VCKCHTMPEBKDQX-XJKSGUPXSA-N	443.504	1.730	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N[C@@H](CO)c1cnn(C)c1	778589752	RNRGTEFUIJNZEA-YGRLFVJLSA-N	426.271	1.014	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)NCCN2CCN(C(=O)C3CCCCC3)CC2)c1	780828954	PHUCOXVDTBWEBX-UHFFFAOYSA-N	431.537	1.824	50	20	IDGD	
C[C@H]1C[C@@H](C)CN(C(=O)c2ccccc2NC(=O)C(=O)NNC(=O)c2ccc(O)cc2)C1	782830077	FMLRWEOVKJKGAF-GASCZTMLSA-N	438.484	1.910	50	20	IDGD	
COC(=O)c1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)Cc1nc2ccccc2n1C	782888575	VASHGICRQOELEF-UHFFFAOYSA-N	443.847	1.342	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1ccc(F)cc1OC1CCCC1	784005391	YIKYTAFHCNPWNR-UHFFFAOYSA-N	448.476	1.725	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)NCCCc1nc(-c2ccc(F)cc2)no1	784264107	XGQMCNCOAAEKIR-UHFFFAOYSA-N	430.396	1.162	50	20	IDGD	
COc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NNc1ccc(Br)cn1	784340012	SQMKJAPGCZJBPM-UHFFFAOYSA-N	436.266	1.636	50	20	IDGD	
CC[C@@H](C)NS(=O)(=O)c1cccc(NC(=O)C(=O)NNc2ccc(Cl)nn2)c1	784790398	ZCRWBRYFWBSVJW-SNVBAGLBSA-N	426.886	1.289	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ccc(Cl)nn2)cc1NC(=O)CN1CCCCC1	784792361	QMLNQPHIVJWPEE-UHFFFAOYSA-N	445.911	1.945	50	20	IDGD	
O=C(NNc1ncccc1Cl)C(=O)Nc1ccc(F)c(N2CCCS2(=O)=O)c1	784814191	JHTOBRMVCPXAFQ-UHFFFAOYSA-N	427.845	1.496	50	20	IDGD	
CN1CCC[C@H](N(C)C(=O)c2ccc(NC(=O)C(=O)NNc3ccc(Cl)nc3)cc2)C1	784874751	LNBOWXAACYUAHZ-KRWDZBQOSA-N	444.923	1.983	50	20	IDGD	
CC1CCN(CCc2cccc(NC(=O)C(=O)NNc3ccnc(N(C)C)n3)c2)CC1	784969830	AMMRWTFSMSIUNF-UHFFFAOYSA-N	425.537	1.899	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccn(-c4ccncc4)n3)n[nH]2)c1	785131005	WMQCZPFFLLFAGW-UHFFFAOYSA-N	444.455	1.674	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1c(C)ccc([N+](=O)[O-])c1C	785331405	UFPRMNUBWLEVKH-UHFFFAOYSA-N	436.446	1.706	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NN[C@H](C(=O)OC)c2ccsc2)c1	788406396	PULSGEPLGWIEHV-INIZCTEOSA-N	425.532	1.927	50	20	IDGD	
NC(=O)[C@@H]1CC(C(=O)NNc2nnc(-c3ccccn3)s2)=NN1c1ccc(F)cc1	788566955	OPWQADBRMQHNON-AWEZNQCLSA-N	426.437	1.303	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)CC3OCCCO3)c2)cc1	788630179	HZVFBUPLUNPHIN-UHFFFAOYSA-N	449.485	1.410	50	20	IDGD	
CC(C)n1nc(-c2ccco2)cc1NC(=O)C(=O)NNC(=O)c1ccc2c(c1)OCCO2	789732266	SGBMFECNKLCESS-UHFFFAOYSA-N	439.428	1.895	50	20	IDGD	
CC(C)Cc1ncc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)cn1	792365948	XPIFSYLJHWDRRN-UHFFFAOYSA-N	432.506	1.198	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NN=C2CCCc3c2cnn3-c2ncccn2)cc1	793016444	NZZMKJTTYGAGAR-UHFFFAOYSA-N	425.474	1.928	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)nc1Br	793021394	DJPUFBAOCGRMML-JTQLQIEISA-N	439.241	1.845	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1	794070206	QXWQTIKUZLWARR-UHFFFAOYSA-N	438.343	1.884	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)Nc1ccc(F)c(N2CCOC2=O)c1	797661380	CNPZHBNLPRFBRD-UHFFFAOYSA-N	426.368	1.225	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2[C@H](C)OC(C)(C)N2C(=O)OC(C)(C)C)cc1	801106333	UUDDHLGINCHDBS-ZFWWWQNUSA-N	434.493	1.841	50	20	IDGD	
C[C@@H](CCNS(=O)(=O)c1ccccc1)NC(=O)NNC(=O)c1cccc(N(C)C)c1	801797944	QIRMWFRZKJYWQF-HNNXBMFYSA-N	433.534	1.454	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@H](O)Cc2cccc(C(F)(F)F)c2)cc1	802063476	GNKPMOBGPBBJML-OAHLLOKOSA-N	445.419	1.865	50	20	IDGD	
CC(C)c1nn([C@H]2CCS(=O)(=O)C2)cc1C(=O)NNC(=O)Nc1ccc2c(c1)OCO2	802100705	YOWOMYBVXUPFPX-ZDUSSCGKSA-N	449.489	1.561	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Nc2ccc3c(c2)OCO3)ccc1OCC(=O)NC(C)C	802103824	JYRXCHVWNKQVPY-UHFFFAOYSA-N	444.444	1.794	50	20	IDGD	
O=C(COC(=O)[C@H](O)c1cccc(C(F)(F)F)c1)NNC(=O)c1ccc([N+](=O)[O-])cc1	803811607	UNKKKOYOLKEOFT-OAHLLOKOSA-N	441.318	1.651	50	20	IDGD	
O=C(COC(=O)c1cc(=O)c2ccc(F)cc2o1)NNC(=O)[C@@H]1COc2ccccc2O1	803928785	QGRNRQPHFPAKKY-SFHVURJKSA-N	442.355	1.076	50	20	IDGD	
Cc1cc(Cl)ccc1S(=O)(=O)NCCNC(=O)NNC(=O)c1ccccc1F	805388445	DFJNOQHCZCIOSK-UHFFFAOYSA-N	428.873	1.710	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)CCCS(=O)(=O)c2ccc(Cl)cc2)C[C@@H](C)O1	806340190	OKQSYUXBHQGJOT-GASCZTMLSA-N	445.969	1.541	50	20	IDGD	
COCCNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCC3)c1	806974408	KBZWHRKRFCSYKG-UHFFFAOYSA-N	430.486	1.013	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)[C@@H](Cc2cnc[nH]2)NC(=O)CC(C)C)c1C	809961302	DAEPOKKJIOJURO-FUHWJXTLSA-N	429.521	1.715	50	20	IDGD	
CC(=NNC(=O)CN1CCN(Cc2ccc(C)cc2)CC1)c1ccc2[nH]c(=O)c(=O)[nH]c2c1	811645714	WHGWAKCTDLEPON-UHFFFAOYSA-N	448.527	1.183	50	20	IDGD	
O=C(NC[C@H]1CCN(c2ccccc2F)C1)NNC(=O)c1csc(N2CCOCC2)n1	812866996	BKWRZDOANCVDLP-CQSZACIVSA-N	448.524	1.589	50	20	IDGD	
Cc1cnc(Br)c(NC(=O)C(=O)NNc2ccc(S(C)(=O)=O)cc2)c1	812983396	PQXUCACDDHLHKZ-UHFFFAOYSA-N	427.280	1.638	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NN=Cc2cn(C)nc2O)c1	814212630	VHTMANDRQQNAGU-UHFFFAOYSA-N	429.458	1.699	50	20	IDGD	
O=C(NNc1cccc(Cl)n1)C(=O)Nc1ccc(C(=O)N2CCOCC2)c(Cl)c1	815726524	HZOQAFRZONKXAK-UHFFFAOYSA-N	438.271	1.943	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)c2cnn(C)c2I)cc1	816771807	BCIJLAAPFNCLOH-UHFFFAOYSA-N	428.230	1.427	50	20	IDGD	
Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCC(C(=O)NNc2ncncc2F)CC1	817081754	BWALIWZDTGQRDH-UHFFFAOYSA-N	438.441	1.376	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)Cn1c(S)nnc1-c1ccc(C)cc1	825644211	YLMIPIMDPDOVCF-UHFFFAOYSA-N	426.502	1.810	50	20	IDGD	
O=S(=O)(c1c(Br)cc(F)cc1Br)N1CC[C@@H](B(O)O)C1	864231172	JOWOGJKHHSZINV-ZCFIWIBFSA-N	430.886	1.588	50	20	IDGD	
CCOC(=O)N1CCC(C(=O)NNC(=O)COc2ccc(Br)cc2)CC1	871023508	BJAKIWUAALAIME-UHFFFAOYSA-N	428.283	1.844	50	20	IDGD	
CCOc1ccc(-c2noc(CCC(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)n2)cc1	914406169	QTUMFQKRLBRRBG-UHFFFAOYSA-N	448.443	1.505	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)CCc1c(C)c2c(C)nn(C)c2[nH]c1=O	914857701	SMEOLUNREBPDNH-UHFFFAOYSA-N	426.477	1.079	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCC(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)cc1C	915788129	VIKVBYWCIOPLQQ-KRWDZBQOSA-N	433.530	1.813	50	20	IDGD	
O=C(NCCc1ccccc1F)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	915908663	JHZWTNSCDRRUFC-UHFFFAOYSA-N	434.493	1.797	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2ccc(OC(F)F)cc2)c1	915916667	MEXLBJJFJAWLKC-UHFFFAOYSA-N	442.444	1.683	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)NCc2nnc3ccc(C(F)(F)F)cn23)cc1	916222599	GXTSVSXPTDNJPI-UHFFFAOYSA-N	433.350	1.529	50	20	IDGD	
C[C@H]1CN(c2ccc(CNC(=O)NNC(=O)[C@H](C)Oc3ccc(F)cc3)cn2)CCO1	916392942	QCBRYMLLGUOVFT-GJZGRUSLSA-N	431.468	1.744	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)NCc1ccc(S(=O)(=O)NC[C@@H]2CCCO2)cc1	916649085	ICHHVODHXKSOOP-KRWDZBQOSA-N	446.529	1.597	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NNC(=O)c2ccc(Cl)nc2)s1	917252087	AZXDPXWJKQVLJM-LBPRGKRZSA-N	428.923	1.719	50	20	IDGD	
COc1ccc([C@@H](CNC(=O)NNC(=O)CC(F)(F)F)N2CCOCC2)cc1OC	918057347	JNUYBCABCCUMGB-CYBMUJFWSA-N	434.415	1.360	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)[C@H]2CCCN(S(=O)(=O)c3ccc(F)cc3)C2)c(O)c1	918337129	CQCADEOZIKSSEF-AWEZNQCLSA-N	435.477	1.702	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCC(=O)N2CCCc3ccccc32)nc1	920045620	QVHBFSYTGODXKH-UHFFFAOYSA-N	446.533	1.374	50	20	IDGD	
O=C(NCc1cccc(NC(=O)[C@@H]2CCCO2)c1)NNC(=O)[C@@H]1COc2ccccc2O1	920236306	AJDMGGLVIHXXEU-OALUTQOASA-N	440.456	1.475	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NN=Cc1ccccc1OCC(=O)N(C)C	920363641	FHEWDZUKBORIQA-UHFFFAOYSA-N	431.518	1.519	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NN=Cc2cc3c(cc2[N+](=O)[O-])OCCO3)ccc1Cl	920369595	XKTQHOQIRLTMPA-UHFFFAOYSA-N	440.821	1.431	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1)NNC(=O)NCC1CC1	920889422	WZUUDFBTXPJLGS-UHFFFAOYSA-N	442.847	1.768	50	20	IDGD	
CN1CCN(c2ccccc2NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)CC1	920928595	UEGNEMACIGCKSH-UHFFFAOYSA-N	435.488	1.152	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)NC[C@H]2COC3(CCCC3)O2)CC1	1319893676	AAYDFEQRWBBSEQ-HNNXBMFYSA-N	426.514	1.650	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2n[nH]cc2I)ccc1OC(C)C	1320607916	QBCPVHPAIGLELY-UHFFFAOYSA-N	444.229	1.885	50	20	IDGD	
CN1C(=O)C[C@H](C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)c2ccccc21	1322177867	HNNQJCMQMVYGEY-INIZCTEOSA-N	444.513	1.301	50	20	IDGD	
O=C(NNC(=O)c1cncn1-c1ccccc1)NC1CCN([C@@H]2CCCC[C@H]2O)CC1	1324087208	KAQCANIFWHLUAQ-UYAOXDASSA-N	426.521	1.584	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCc2ccc(C[S@@](C)=O)cc2)c2ccccc2c1=O	1326920273	QBBDONDJWLDUPC-WJOKGBTCSA-N	441.513	1.439	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CSc1nc[nH]n1)C2	1779545889	NTSHCWLWDBMICZ-RDTXWAMCSA-N	441.630	1.262	50	20	IDGD	
C=C(CC(=O)OCC)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CO[Si](C)(C)C)C1	1779546851	SYTAWDYJYMYJFV-DYESRHJHSA-N	440.613	1.861	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)cc1OC	1780657033	XRYMBIZPXNFXDC-NRFANRHFSA-N	436.581	1.999	50	20	IDGD	
O=C(C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Br)C1)c1ccco1	1780771042	RDFBXONZNNGUFT-SUYBPPKGSA-N	431.258	1.667	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc(Cl)nc3)[C@H]2C1	1783378656	OTHUVFYTTADPIN-QEJZJMRPSA-N	426.977	1.575	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)COc3ccccc3C#N)CCO2)C1	1783535923	BUWYPPSIUHIIFM-LIRRHRJNSA-N	436.306	1.550	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](O)Cc1ccccc1)CCO2	1783539589	MDPUUSXFZWCGAY-GMBSWORKSA-N	425.323	1.203	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)c(Cl)c1	1783938137	VOICBFLIRLDCOJ-OAQYLSRUSA-N	436.940	1.465	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(F)nc3F)C[C@@H]21	1783963829	AJKCVLPGQHBMRL-XWUBHJNHSA-N	446.292	1.984	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)CCn3nc(C)cc3C)C2)C1	1784321154	KOVLOAHORNTOPD-VQIMIIECSA-N	441.370	1.893	50	20	IDGD	
CCc1[nH]nc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCBr)C[C@@H]32)c1F	1785792914	YLFVVQPNCJQDGN-GVXVVHGQSA-N	431.306	1.490	50	20	IDGD	
CCS(=O)(=O)N[C@@H](C)C(=O)NC1(c2ccc(NC(=O)[C@@H](O)CCl)cc2)CCC1	1786129462	MZHVNGMQPITWGW-WFASDCNBSA-N	431.942	1.048	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)c1cc2ccccn2n1	1787845795	XJOMFQMIKHVRFD-DLKVLKDVSA-N	439.285	1.618	50	20	IDGD	
CCn1nc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCBr)C[C@@H]32)cc1C	1788998448	KRVXIZLAZGJRPV-DZKIICNBSA-N	427.343	1.590	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccn(-c4ccccc4)n3)[C@H]2C1	1789349584	PRDALGSZSCNGTG-BOLBYERCSA-N	446.935	1.719	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@]3(C)C[C@H]3C)[C@H]2C1	1789778733	PKVKZDLXXVDOPY-HDBZRWKTSA-N	429.521	1.146	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(C(F)(F)F)nc3)C[C@@H]21	1791251768	VKZLNKMVQMOMHF-AJNGGQMLSA-N	449.857	1.948	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCn3nc(C)cc3C)C[C@@H]21	1791256839	YCGQVBXEWOFRPC-XSLAGTTESA-N	426.945	1.124	50	20	IDGD	
CCOC(CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)OCC	1791418850	ZJQLJOSXJFMPNV-KKUMJFAQSA-N	435.359	1.540	50	20	IDGD	
CC(=O)N[C@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)CBr)C2)C(C)(C)C	1793190155	GSSKOAMNNZROOS-YMILTQATSA-N	446.386	1.158	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](CCO)NC(=O)OC(C)(C)C	1793250845	HYSBJRXNSQOBKJ-YIDVYQOGSA-N	431.961	1.918	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H]1CCc3ccccc3C1)C2	1798443186	WKPLUDGDHFVHMD-YSTOQKLRSA-N	447.539	1.742	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(N(C)C)ccc1[N+](=O)[O-]	1798539737	LSMHSVZXHBOCQX-ZDFLXESQSA-N	438.912	1.881	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2)[C@@H](O)c1cccc(Br)c1	1799096936	CQIPTYIDBOVGEQ-FONWIUJUSA-N	449.704	1.607	50	20	IDGD	
Cc1ccncc1CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Br	1799344366	JNGNOMCDKYWBFI-YALNPMBYSA-N	428.302	1.603	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(C(F)(F)F)c[nH]1)C2)[C@H](F)Br	1799347764	RIPDKQDBTIIESI-VVJJBPBLSA-N	442.207	1.927	50	20	IDGD	
CCOCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](Br)Cc1ccccc1	1800435231	BVRSRXOBMXDTLD-ZMMAXQRCSA-N	439.350	1.619	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1CCc2ccccc2O1)c1cccc(B(O)O)c1	1802234589	OTQNMGZOUVOCAJ-XAPVIXHLSA-N	434.301	1.012	50	20	IDGD	
CC1(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)CCCC1	1802618655	GULLEYUICJXCJD-TZIWHRDSSA-N	435.333	1.661	50	20	IDGD	
CC(C)c1nc(CC(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)no1	1803135787	HNAHTBDQOYHZIM-RKVPGOIHSA-N	435.912	1.436	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc3ncncc3c2)[C@H]1c1cccnc1)[C@H](O)CCl	1803143284	YWRSXUHXMKXBHI-DBVUQKKJSA-N	439.903	1.944	50	20	IDGD	
Cc1cccnc1C(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1803806995	UGZDIOHJOMBJJY-GCJKJVERSA-N	438.532	1.478	50	20	IDGD	
O=C(Cc1cccc(Cl)n1)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1	1804698252	DTIFMKLLTXZFIB-QOKNQOGYSA-N	437.327	1.978	50	20	IDGD	
O=C(CN1CCSCC1)N1CCCC2(CCN(C(=O)[C@@H](F)Br)CC2)C1	1804820514	GWUOTJADJYAISW-OAHLLOKOSA-N	436.391	1.957	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2cncc(F)c2)[C@@H]1c1cccnc1	1805849613	LFIDMYIPGHQLCN-KKSFZXQISA-N	442.495	1.308	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H](CNC(=O)C(=O)N(C)C)[C@H]1c1cccnc1	1806946727	PYMQQZQZNFXXSG-QLFBSQMISA-N	425.327	1.349	50	20	IDGD	
Cn1ccc(CC(=O)NC[C@@H]2CCN(C(=O)CO[Si](C)(C)C)[C@@H]2c2cccnc2)n1	1807511093	AERDQBXDODZYOP-LAUBAEHRSA-N	429.597	1.915	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@H]1CCN(C(=O)CS(C)(=O)=O)[C@H]1c1cccnc1	1808297296	YTQUDZYDDBOAQB-KMFMINBZSA-N	436.361	1.368	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC2(CCCN(C(=O)c3coc(C)n3)C2)CC1	1808391692	UTLFIAGYWBMUNI-MFKUBSTISA-N	440.504	1.962	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)c1ccc2ncnn2c1	1810052581	QYJJLIDEYZYSCQ-ZVZYQTTQSA-N	428.880	1.044	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1CCN(C(=O)CCS(C)(=O)=O)[C@@H]1c1cccnc1	1810548112	NMTJTLNCZHOHJQ-QFBILLFUSA-N	441.626	1.374	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)C2CC(F)(F)C2)[C@H]1c1cccnc1	1813068617	PEIICEFPOARRKY-BEFAXECRSA-N	437.491	1.506	50	20	IDGD	
COc1cc(C(=O)N2CC[C@@H](CNC(=O)C(Cl)Cl)[C@@H]2c2cccnc2)nn1C	1813079825	NNONNFMOIRRPSF-WFASDCNBSA-N	426.304	1.947	50	20	IDGD	
Cn1cc(CC(=O)NC[C@@H]2CCN(C(=O)[C@H](F)Br)[C@@H]2c2cccnc2)cn1	1813458812	AEJLHVMEXSFMAK-UAGQMJEPSA-N	438.301	1.754	50	20	IDGD	
Cc1nc[nH]c1CSCC(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](O)CCl)n[nH]1	1814873378	QFGIIVDRYUOCDG-LSDHHAIUSA-N	440.957	1.966	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(C(=O)O)ncn2)n[nH]1	1816156374	WQFHZKFBHBLHCA-YGRLFVJLSA-N	436.856	1.458	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](N)CCC(N)=O)n[nH]1	1817249016	BVUIPDUWZGOHMR-MDZLAQPJSA-N	443.346	1.168	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ncc[nH]1)CC2	1817277167	LRWVNFAISTUDBT-YBGGJHSQSA-N	440.489	1.226	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CN2CCNC2=N)n[nH]1	1817299076	WWXABZHQPNTHPK-AAEUAGOBSA-N	440.346	1.415	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](F)Br)[nH]n1	1819354799	ZPERVZHGXRQJOW-SUZMYJTESA-N	447.309	1.800	50	20	IDGD	
CCCNC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](Cl)COC)n[nH]1	1822371876	URCFRHACICRCJO-ZFWWWQNUSA-N	427.933	1.962	50	20	IDGD	
CCc1noc(C)c1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1	1822414779	LWOXDYDFJYADJQ-MRXNPFEDSA-N	445.524	1.947	50	20	IDGD	
CC(C)[C@@H](S)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1	1824536946	BBQWSSOJCYDTQO-VQTJNVASSA-N	432.395	1.554	50	20	IDGD	
CC(=O)N[C@H](C)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](C)CBr)CC2	1825210943	DQVJSVPZKBKLLS-KKZNHRDASA-N	431.356	1.611	50	20	IDGD	
CC[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(O)n(C)n1)CC2	1825445385	UYOMJGDUFZYUKW-RKDXNWHRSA-N	442.339	1.982	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1nc(C)c(C)[nH]c1=O)CC2	1825992993	BUNYFXXEMZELJW-QWRGUYRKSA-N	439.925	1.323	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)CC(F)(F)F)CC1	1826674134	HLYSYIMUQZZGIP-QGZVFWFLSA-N	426.244	1.552	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC([C@H]2CCCCN2C(=O)CC[C@H](N)C(N)=O)CC1	1826938286	SPQZQFFOMMEKRI-HRCADAONSA-N	445.402	1.372	50	20	IDGD	
CCc1ccnc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)c1	1827054414	AKQUKZPVWQYVSJ-HSZRJFAPSA-N	449.360	1.871	50	20	IDGD	
O=C([C@@H](O)CCl)N1CCC([C@@H]2CCCCN2C(=O)CSc2ncccn2)CC1	1827170391	JVDRUTXSHXNMAE-HOTGVXAUSA-N	426.970	1.788	50	20	IDGD	
Cc1ccnc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)c1	1830538536	IQLPGYYPLXVROH-DNVCBOLYSA-N	440.338	1.491	50	20	IDGD	
Cc1ccnc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)c1	1830538537	IQLPGYYPLXVROH-HNAYVOBHSA-N	440.338	1.491	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](C)CBr)CCO2)C1	1830543299	PGJBBKQWZOEPKP-WWGRRREGSA-N	425.751	1.491	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3(C#N)CCC3)C2)C1	1830546994	YXWWBFPVWXBZRT-KSSFIOAISA-N	428.327	1.168	50	20	IDGD	
CC(C)(C)c1ncccc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1830722480	CELDUYJNDJNNPO-IIBYNOLFSA-N	439.940	1.049	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1	1831834516	DIXVKJRFDYSOHS-DLBZAZTESA-N	430.977	1.233	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@](C)(O)C(F)(F)F)CCO2	1832148601	AGOIPYYYVPDRLB-CVEARBPZSA-N	430.851	1.021	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)CCN2CCCC2)CC1	1832970132	LTXACWOZDLMLKX-HXUWFJFHSA-N	435.613	1.465	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCC(N2CCC(NC(=O)[C@H]3CCC(=O)NC3)CC2)CC1	1833118296	NJVMLLNMGGSJQM-HNNXBMFYSA-N	426.989	1.349	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)Cc3ccc(F)cc3)CC2)CC1)[C@H](O)CCl	1833309186	RBIUSUIEDRFHNQ-LJQANCHMSA-N	425.932	1.540	50	20	IDGD	
Cc1noc(C)c1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1834068688	IHWUBTJWAQGOLM-BBRMVZONSA-N	434.262	1.052	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)c3cnc[nH]3)CC2)CC1	1834167730	USMXCKJXIFULDC-CYBMUJFWSA-N	426.359	1.626	50	20	IDGD	
CC[C@@H](C)[C@H](N)C(=O)N1CCC(N2CCC(NC(=O)CCBr)CC2)CC1	1834421891	RQGRTERKAIKTIV-KDOFPFPSSA-N	431.419	1.716	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)c3ccoc3Cl)C2)C1	1834823752	IJPWDMWGNHGZLK-MRXNPFEDSA-N	435.702	1.788	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccc4c(c3)OCO4)CCO2)C1	1835171294	WIFJRFFQHQOMHE-KKSFZXQISA-N	438.908	1.432	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3cccnc3)CCO2)C1	1836162719	XVIXWZYNEQMILE-LPHOPBHVSA-N	440.338	1.254	50	20	IDGD	
COc1ccc(C)c(C(=O)NC2CCN(C3CCN(C(=O)[C@H](O)CCl)CC3)CC2)c1	1836452691	XFSILVVVWBDRIL-HXUWFJFHSA-N	437.968	1.789	50	20	IDGD	
O=C(C[C@@H]1CNc2ccccc2O1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1837352209	ZDBKAIHYVVYVOS-HEFCMCLBSA-N	441.887	1.240	50	20	IDGD	
CCc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)no1	1838128300	KNYPVIOKPDQWKD-ZWKOTPCHSA-N	434.320	1.543	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@@H]3C[C@H]4CC[C@@H]3O4)CC2)CC1	1838776165	UJTPAKRKEAHQSF-YRXWBPOGSA-N	428.957	1.806	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc([N+](=O)[O-])[nH]3)CCO2)C1	1838827508	RFBBHICPZSTAQW-SJORKVTESA-N	449.291	1.229	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc4c3NC(=O)C4)C2)C1	1839148193	QGEXSRALYIQYQI-IERDGZPVSA-N	435.908	1.269	50	20	IDGD	
CC(C)n1nccc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2	1839153579	KULFPXSYBZUQJP-OALUTQOASA-N	447.363	1.770	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(O)ccc3O)C2)C1	1839154242	IEXGALUDQOJDJQ-MOPGFXCFSA-N	447.315	1.404	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(O)cc3)C2)C1	1839154274	IVQPSUFFSWEPEW-MOPGFXCFSA-N	431.316	1.699	50	20	IDGD	
Cc1onc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)c1C	1839198442	DMEZBSPHVWURSU-CZUORRHYSA-N	434.262	1.052	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3conc3C)C2)C1	1839963664	RGKIVBIHTSZYMQ-RHSMWYFYSA-N	430.299	1.227	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)COC3CCCCC3)C2)C1	1840030447	MSCCYYSCJZMRHN-HNAYVOBHSA-N	447.370	1.576	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(C#N)c3)C2)C1	1840034871	ZMIYGUIZIQRPNK-KUHUBIRLSA-N	436.306	1.412	50	20	IDGD	
C=CCC(F)(F)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](C)Br)CCO2)C1	1840035377	PFWAMNXTUQELTG-SWLSCSKDSA-N	425.270	1.438	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(OC)s3)C2)C1	1840150594	NSWXMODLIJALDE-UGSOOPFHSA-N	432.926	1.081	50	20	IDGD	
O=C(c1ccc2c(c1)OCO2)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840187569	JYMVAKKKTIQJLP-GOSISDBHSA-N	431.272	1.289	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@H]1C(=O)N1CCOC[C@]2(CN(C(=O)C(Cl)Cl)CCO2)C1	1840190728	KCZDNBPJMMRPOA-PJIJBLCYSA-N	449.331	1.002	50	20	IDGD	
COc1cc(F)ccc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840190815	OUNUYIXSNDVGNT-GOSISDBHSA-N	435.279	1.708	50	20	IDGD	
C[C@H](Cc1ccco1)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1840471699	HBUQSFQSZDCLGF-XUWXXGDYSA-N	447.301	1.605	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)[C@H]2C[C@@H]2c2ccc(F)cc2)C1	1841242768	NVBOHZXFSAVRSZ-MSOLQXFVSA-N	437.475	1.445	50	20	IDGD	
Cc1noc(CC(=O)N2CCCC23CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C3)n1	1843058457	ZUZFRYOGZOHZPN-ZDUSSCGKSA-N	441.916	1.256	50	20	IDGD	
O=C([C@@H](O)CCl)N1CC2(CCCN2C(=O)c2cnn3c(-c4cccs4)ccnc23)C1	1843302034	WGMQRHFXPNEZJE-HNNXBMFYSA-N	445.932	1.875	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)c1csnn1)C2	1844691863	IXMFSYJYMCRSQS-UHFFFAOYSA-N	431.430	1.502	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)[C@@H](O)C(C)(C)C)C2	1844691960	SKUJDSFQZMRQBI-QGZVFWFLSA-N	433.461	1.744	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CN(C(=O)OC(C)(C)C)C1CC1	1847350086	SXMZKLQKFHDFKF-PMPSAXMXSA-N	429.945	1.842	50	20	IDGD	
C=C[C@@H]1C[C@]1(NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl	1847568784	LEQLGEYNEOXPKC-HOJQFNHUSA-N	427.929	1.257	50	20	IDGD	
Cc1ccc2[nH]cc(CC(=O)N3CC[C@H]4[C@@H]3CCN4C(=O)CCC(=O)NN(C)C)c2c1	1848143477	UOWDPRWLMIJXCI-PMACEKPBSA-N	425.533	1.594	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1	17406926	WMOUYGZJNYXFIJ-UHFFFAOYSA-N	427.486	1.262	50	20	IDGD	
N#Cc1ccc(CN2CCCN(CC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)CC2)cc1	21404810	RJFPDWRBUXSOIS-UHFFFAOYSA-N	436.472	1.435	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)CN1C(=O)N[C@](C)(c2ccc(F)cc2)C1=O	23750573	QSHLPAREZDUBII-LAJNKCICSA-N	446.410	1.347	50	20	IDGD	
CCOc1ccccc1C(=O)NCCCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	26977225	SBXJAHZRSBOCOP-LJQANCHMSA-N	427.457	1.583	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c1	28196060	JJGRMUVOVAUSEC-UHFFFAOYSA-N	441.513	1.978	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)c2cc(Cl)c(-n3cnnn3)cc2OC)cc1OC	107919701	RFCLMKVKTMGWCF-UHFFFAOYSA-N	446.851	1.806	50	20	IDGD	
CN(C(=O)OC(C)(C)C)[C@@H]1CCCN(CC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)C1	725815199	ZVAJMNDLVDNQMM-MRXNPFEDSA-N	435.481	1.687	50	20	IDGD	
CCOc1cc(CNC(=O)NNC(=O)CNC(=O)c2ccco2)ccc1OC(F)F	725871329	JMVJEORYDAZWQF-UHFFFAOYSA-N	426.376	1.540	50	20	IDGD	
COCCCNC(=S)N(C)NC(=O)C[C@@H](NC(C)=O)c1ccc(Br)cc1	726076865	HPQUDQCFNBJWQV-OAHLLOKOSA-N	445.383	1.890	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)NCc1ccc(Oc2cccc(F)c2)nc1	726251159	CJXLWNVDALYXLA-UHFFFAOYSA-N	427.392	1.866	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NNc2nc(-c3ccncc3)no2)cc1	726370700	GRSNJOGHJJVCER-INIZCTEOSA-N	428.474	1.736	50	20	IDGD	
CN(C)N(C(=O)c1ccc(F)c(S(=O)(=O)N2CCCCC2)c1)[C@@H]1CCS(=O)(=O)C1	728176415	OHDLCMZDXKUTKL-OAHLLOKOSA-N	447.554	1.106	50	20	IDGD	
O=C(COC(=O)Cc1cccc(Br)c1)NNC(=O)[C@H]1COc2ccccc2O1	728344440	KVWCDLUJKAEHEL-MRXNPFEDSA-N	449.257	1.522	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NN=Cc1cn(Cc2ccccc2)nc1-c1cccnc1	728436506	GSUMFGQQLWDGMP-OAHLLOKOSA-N	426.502	1.381	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NC[C@@H]2CCN(CCc3ccccc3)C2)cc1	728753715	BXDKYAOQJYUZNQ-IBGZPJMESA-N	426.517	1.969	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1cccc(OC[C@H]2CCCO2)c1	728846113	VJAHJONXFWWVIG-LJQANCHMSA-N	425.489	1.712	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2ccc(NNC(=O)[C@H]3CCOC3)c([N+](=O)[O-])c2)cc1	729295514	ZKEWOBOYMXPWQI-LBPRGKRZSA-N	436.446	1.884	50	20	IDGD	
Cc1c(NNC(=O)NCc2cccnc2N2CCC(C(N)=O)CC2)cccc1[N+](=O)[O-]	729610893	DTRYECVYAUZESC-UHFFFAOYSA-N	427.465	1.826	50	20	IDGD	
O=C(COC(=O)CCc1nc(-c2cccs2)no1)NNC(=O)c1ccc([N+](=O)[O-])cc1	730003429	ZSAZLLPARCOJRY-UHFFFAOYSA-N	445.413	1.643	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCN(c2ccc3c(c2)OCCO3)C1=O)c1cccc([N+](=O)[O-])c1	730512464	QGSGZUDOAZJPIL-OAHLLOKOSA-N	426.385	1.180	50	20	IDGD	
O=C(NN=Cc1ccc(OC(F)(F)C(=O)O)cc1)c1csc(N2CCOCC2)n1	730727139	NCIGKSYLLJMBGO-UHFFFAOYSA-N	426.401	1.800	50	20	IDGD	
O=C(COC(=O)CNC(=O)c1c(F)cccc1Cl)NNC(=O)c1cccc(Cl)c1	731080419	SMIGMJAAKFNDME-UHFFFAOYSA-N	442.230	1.867	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)c1cccc(S(=O)(=O)NC[C@H]2CCCO2)c1	731501582	XETFTUSWQYVRPZ-OAHLLOKOSA-N	433.486	1.227	50	20	IDGD	
COc1cc(C=O)c([N+](=O)[O-])cc1OCC(=O)NNC(=O)c1cc(-c2ccccc2)on1	731601486	ZBGWALGGVFXHSM-UHFFFAOYSA-N	440.368	1.911	50	20	IDGD	
O=C(CCS(=O)(=O)c1ccc2c(c1)OCCO2)NNc1nc(-c2cccnc2)no1	732110725	LSCAORIVYOMCRW-UHFFFAOYSA-N	431.430	1.210	50	20	IDGD	
CCOc1ccc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)c3cnc(C)[nH]3)cc2)cc1	732260255	RHUVVBQNFCPOCW-UHFFFAOYSA-N	443.485	1.992	50	20	IDGD	
O=C(CCc1ccco1)NNC(=O)[C@H]1CCCN1S(=O)(=O)c1cccc([N+](=O)[O-])c1	732956210	GCKQXLHRWGNOSE-MRXNPFEDSA-N	436.446	1.121	50	20	IDGD	
COCCCNC(=O)NNC(=O)[C@H]1CCC(=O)N(C)[C@@H]1c1ccc(C(F)(F)F)cc1	734427105	AQXRWAMBSWETDC-GOEBONIOSA-N	430.427	1.982	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)C(=O)Nc2ccc(Br)cc2C(F)(F)F)cn1	735470459	AHPMRDJFMLRTFJ-UHFFFAOYSA-N	434.172	1.601	50	20	IDGD	
Cn1ccnc1[C@](O)(CCNC(=O)NNC(=O)COCc1ccccc1)C(F)(F)F	738462090	VIIUGGAGEASZOA-QGZVFWFLSA-N	429.399	1.107	50	20	IDGD	
C[C@@H]1CN(CC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)CC[C@H]1NC(=O)OC(C)(C)C	740880350	XASIQKHIOGJSDN-CZUORRHYSA-N	435.481	1.591	50	20	IDGD	
O=C(NNC(=O)C12CC3CC(CC(C3)C1)C2)[C@@H]1CCCCN1C(=O)c1ccc(O)nn1	741742393	GOZQEXGHQJUDDR-LEJIWSMMSA-N	427.505	1.541	50	20	IDGD	
Cn1nnnc1-c1cccc(S(=O)(=O)NNC(=O)c2ccc(Cl)cc2Cl)c1	742026145	LNZPNGFSGVHXNH-UHFFFAOYSA-N	427.273	1.807	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@H]2SCCc3ccccc32)cc1	742471805	KKSPTASRXDBMEP-IBGZPJMESA-N	433.555	1.794	50	20	IDGD	
Cc1nnnn1[C@@H](Cc1ccccc1)C(=O)NNC(=O)c1cccc(Br)c1	742770200	WGPHVAVQQJFCDX-INIZCTEOSA-N	429.278	1.989	50	20	IDGD	
O=C(NNC(=O)[C@H](Oc1ccc(Cl)cc1)c1ccccc1)N[C@H]1CCS(=O)(=O)C1	743885373	WBCDELREZCMIHC-DOTOQJQBSA-N	437.905	1.978	50	20	IDGD	
CCN(CC)CCN1C(=O)C(=NNC(=O)Cn2nnc(-c3ccccc3)n2)c2ccccc21	744634983	KEPOUDHRAUDNDF-UHFFFAOYSA-N	446.515	1.549	50	20	IDGD	
O=C(Cc1cc(O)nc(S)n1)NN=C1CCC[C@H](N2C(=O)c3ccccc3C2=O)C1	745199479	IDXVKOLDNUIYJI-ZDUSSCGKSA-N	425.470	1.724	50	20	IDGD	
CO[C@@]1(C)C[C@@H](NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)C1(C)C	745930374	DCZWODBUVGLPJY-UZLBHIALSA-N	438.550	1.619	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(C(=O)O)c(Br)c1)c1ccc2c(c1)OCO2	747596721	RELYJUGNXZYPBJ-UHFFFAOYSA-N	443.231	1.499	50	20	IDGD	
Cc1nn([C@@H]2CCS(=O)(=O)C2)c2nc(C3CC3)cc(C(=O)NNC(=O)c3ccc[nH]3)c12	747663213	DBOGOIAPBQGCRW-CYBMUJFWSA-N	442.501	1.380	50	20	IDGD	
C[C@]1(c2ccc(C(=O)NNC(=O)c3cccc(Br)c3)cc2)NC(=O)NC1=O	748545911	CEBFIFUZMREYHY-GOSISDBHSA-N	431.246	1.579	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CN2CCN(c3c(C#N)cnc4ccccc34)CC2)cc1	748809779	ALZIFUMJUIMKIO-UHFFFAOYSA-N	428.496	1.998	50	20	IDGD	
COc1ccc(-n2c(C)cc(/C=C(/C#N)C(=O)NS(=O)(=O)N3CCOCC3)c2C)cc1	750732316	SJJDPRCMJHSJAV-AQTBWJFISA-N	444.513	1.703	50	20	IDGD	
Cc1oc(-c2cnn(C)c2)nc1C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	752266600	ZLEGTKAPVPEZSE-UHFFFAOYSA-N	437.504	1.357	50	20	IDGD	
C[C@@H](C[S@@](C)=O)NC(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	753357754	HVUVBRQDWXJXNA-AOYOOGHLSA-N	441.517	1.099	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)Nc2cc(S(=O)(=O)N(C)C)ccc2N(C)C)c1	755531909	KCWSBOVDULOCHY-UHFFFAOYSA-N	448.549	1.535	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CN2CCC[C@H](NC(=O)c3cc4ccccc4o3)C2)c1	756043353	ZZDQRILMJUZIEX-IBGZPJMESA-N	445.479	1.960	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)Nc2ccc(S(=O)(=O)/N=C3\CCCN3C)cc2)n1	756074343	XZALFKXZADNCTE-JJIBRWJFSA-N	447.521	1.166	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)Nc1cccc(N2CCS(=O)(=O)CC2)c1	756208090	UZGCKJSHOCADHI-UHFFFAOYSA-N	432.502	1.413	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2ccccc2CN2C(=O)CCC2=O)cc1OC	756220794	KPEABMJJKXCELA-UHFFFAOYSA-N	426.429	1.819	50	20	IDGD	
C[C@@H](c1cccc(NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c1)N1CCOCC1	756420325	IQDMSHYJHCRXCN-HNNXBMFYSA-N	446.529	1.950	50	20	IDGD	
C[C@H]1CN(c2nccnc2C#N)CCN1C(=O)NNC(=O)c1cccc(OC(F)F)c1	756932866	OUXGOKHBNDSDMF-LBPRGKRZSA-N	431.403	1.515	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)c2cncc(I)c2)cc1	757735338	QGTRYIIMZODLHJ-UHFFFAOYSA-N	426.214	1.568	50	20	IDGD	
Cc1cccc(-n2nnc(C(=O)N3CCN(S(=O)(=O)CBr)CC3)c2C)c1	758522838	KKPPWMUJECQJRJ-UHFFFAOYSA-N	442.339	1.324	50	20	IDGD	
Cc1c([C@H](C)NC(=O)NNC(=O)C(=O)Nc2ccccn2)cnn1-c1ccc(F)cc1	758693145	ALRVCNXFRSRELO-LBPRGKRZSA-N	425.424	1.745	50	20	IDGD	
CCS(=O)(=O)N1CCC(CNC(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)CC1	758746640	XJXKOAQXXWCRJA-MRXNPFEDSA-N	440.566	1.463	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)CCCCC/N=C2/NS(=O)(=O)c3ccccc32)nc1	759728288	AMOOHAHJXRUDNE-UHFFFAOYSA-N	445.501	1.610	50	20	IDGD	
CC(=O)c1ccc(Cl)c(S(=O)(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c1	761888172	ZSQGKLPVSKEEDE-UHFFFAOYSA-N	430.891	1.569	50	20	IDGD	
Cc1nn(-c2ccc(F)cc2)c(C)c1CC(=O)NNc1nccc(N2CCOCC2)n1	762858127	ZPUNUIBTNZJRCP-UHFFFAOYSA-N	425.468	1.941	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)c1	763173989	SVCMFBKSJNGMFJ-UHFFFAOYSA-N	449.439	1.680	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)c2cccnc2)sc2c1CCCS2	763487591	DQPWLLPBWKNWGH-UHFFFAOYSA-N	434.499	1.758	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(O[C@H]2CCOC2)cc1	763657520	OGBBKNOHCXSOSN-INIZCTEOSA-N	429.429	1.028	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccc2c1OCCC2=O	763680894	CIDVWMALDVKXFB-UHFFFAOYSA-N	427.413	1.215	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)c(C)c1	763735689	QXZNLJSAJLRTFA-UHFFFAOYSA-N	443.500	1.849	50	20	IDGD	
O=C(CN1CCCc2ccccc21)NNC(=O)C(=O)Nc1ccc(F)cc1OC(F)F	763736496	VDIOSRROURVHFT-UHFFFAOYSA-N	436.390	1.966	50	20	IDGD	
CCN(CC)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)Cn2nc(C)cc2C)cc1Cl	763880596	IQNMHDCCSNOUGC-UHFFFAOYSA-N	448.911	1.421	50	20	IDGD	
COCCCn1ccc(NC(=O)C(=O)NNC(=O)c2sc(-c3ccccc3)nc2C)n1	763902093	QAMQAMYFBAGVMO-UHFFFAOYSA-N	442.501	1.751	50	20	IDGD	
CCOC(=O)[C@@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2C)cc1	763960939	BBAXIFJTKZNHAZ-CQSZACIVSA-N	440.456	1.076	50	20	IDGD	
O=C(NNC(=O)c1cccc2ccccc12)C(=O)Nc1ccccc1CN1CCNC1=O	764058954	WQAMBQVNLKNZLV-UHFFFAOYSA-N	431.452	1.765	50	20	IDGD	
CC[C@@H](C)C(=O)NNC(=O)C(=O)Nc1cccc(CS(=O)(=O)Cc2ccccc2)c1	764081893	KNCQZRWOYCHIFP-OAHLLOKOSA-N	431.514	1.934	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)nc1)C(=O)Nc1ccnc(OCC(F)(F)C(F)F)c1	764100232	JXWKHLFQSRTZQY-UHFFFAOYSA-N	449.748	1.809	50	20	IDGD	
CC(C)(C)NC(=O)c1ccccc1NC(=O)C(=O)NNC(=O)c1ccc(Cl)cc1O	764126737	OYLSELAKPHTSOC-UHFFFAOYSA-N	432.864	1.974	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccc(N2CCSCC2)cc1	764133605	WRXGVBSXCFWKOH-UHFFFAOYSA-N	428.514	1.577	50	20	IDGD	
C[C@H]1CN(c2ccccc2NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)C[C@@H](C)O1	764152304	CZABNOSTWZKJHZ-QEEYODRMSA-N	438.484	1.390	50	20	IDGD	
CO[C@H](C)C(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2cccc3ncccc23)c1	764257481	HYQATWYWIAVDES-CYBMUJFWSA-N	435.440	1.608	50	20	IDGD	
Cc1ccc(CN(C)C)cc1NC(=O)C(=O)NNC(=O)c1cc(Br)ccc1O	764281128	ZJYMJXZVUWYIHN-UHFFFAOYSA-N	449.305	1.924	50	20	IDGD	
CC(C)(C)OC(=O)Cc1ccccc1NC(=O)C(=O)NNC(=O)CCc1ccccc1O	764288923	OOJPWTFPUVAZCL-UHFFFAOYSA-N	441.484	1.995	50	20	IDGD	
COCCOc1c(Cl)cc(NC(=O)C(=O)NNC(=O)Cc2cc[nH]n2)cc1Cl	764293010	KBZTVJNHWOUAMY-UHFFFAOYSA-N	430.248	1.070	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)C(=O)Nc1cc(C)n(-c2ccc(Cl)c(Cl)c2)n1	764298149	OXOZTYJZSBYKHU-UHFFFAOYSA-N	436.259	1.919	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cccc(F)c3C)n[nH]2)cc1OC	764379101	QMOZTSPLADBYST-UHFFFAOYSA-N	441.419	1.941	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1ccc(-n2ccnn2)cc1	764393902	UAXMCSRMVSHHNL-UHFFFAOYSA-N	426.458	1.154	50	20	IDGD	
Cc1cc(OCc2cccc(F)c2)ccc1NC(=O)C(=O)NNC(=O)[C@H]1COCCO1	764433284	MEAGCFLQBNPAFH-GOSISDBHSA-N	431.420	1.214	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)CSc2ccccc2O)c1	765247829	CEFDIDNNYGJRGQ-UHFFFAOYSA-N	427.479	1.335	50	20	IDGD	
CC(C)C[C@H](C(=O)NNC(=O)CSc1ccccc1O)N1C(=O)[C@H]2CC=CC[C@@H]2C1=O	765248304	PWNLIDVLVGHIFX-HRCADAONSA-N	445.541	1.998	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)c1ccc2c(c1)nc(O)n2CC(F)(F)F	765381864	KGRNKVVXPBYXQC-UHFFFAOYSA-N	425.323	1.088	50	20	IDGD	
Cc1nc2ccccc2cc1C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765739504	WDARBIGNOVHOAH-UHFFFAOYSA-N	431.496	1.762	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1cccc(C[S@@](=O)c2ccccc2)c1	766261237	QCANHOKKWMPPQG-SSEXGKCCSA-N	425.470	1.875	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cnn3ccc(C)cc23)c1	766832610	KDNBKPROTSTJPM-UHFFFAOYSA-N	429.502	1.748	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)CCC(=O)Nc1ccc2nc(O)[nH]c2n1	767163615	OQQUCWFQTCNPNJ-JTQLQIEISA-N	430.396	1.136	50	20	IDGD	
C[C@@](O)(C1CCN(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)CC1)C(F)(F)F	767299797	XSOLPPXZNPDTLL-MRXNPFEDSA-N	427.387	1.042	50	20	IDGD	
Cc1oc(C)c(C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1C	768232778	RYZIKGWQWCJIBZ-UHFFFAOYSA-N	449.529	1.620	50	20	IDGD	
CC(C)(O)C(=O)NNC(=O)CSc1nnc(COc2ccccc2)n1-c1ccccc1	768241027	JOYPCIQRLIBIND-UHFFFAOYSA-N	441.513	1.857	50	20	IDGD	
Cc1cnn(Cc2ccccc2F)c1NC(=O)C(=O)NNC(=O)COCc1ccccc1	769267404	RKPLPXXNHMIQPH-UHFFFAOYSA-N	439.447	1.682	50	20	IDGD	
CC(C)NC(=O)C(=O)NNS(=O)(=O)c1cc(Br)c(Cl)cc1Cl	769858955	HVVUCRFGKUWSLD-UHFFFAOYSA-N	433.111	1.590	50	20	IDGD	
CN(C)C(=O)Nc1ccc(C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c(Cl)c1	772056958	LEOXYAIVRAOPMV-UHFFFAOYSA-N	438.893	1.912	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)C(=O)Nc2ccc(Cl)cn2)c2ccccc2c1=O	773525344	OZUXRHXSOVGSAK-UHFFFAOYSA-N	442.863	1.645	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2c(F)cccc2F)cc1OCC(=O)NC1CC1	773707967	NUENQETWEYDWCY-UHFFFAOYSA-N	434.399	1.713	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)NCc2ccc(S(N)(=O)=O)cc2C)c2ccccc2n1	775212634	PFHPUPWRMWLOCN-UHFFFAOYSA-N	427.486	1.643	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)Nc3ccnn3[C@H]3CCS(=O)(=O)C3)cc2C1	776053460	CRBSUIUZLCLOJA-YPMHNXCESA-N	437.547	1.896	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)Nc2ccnn2[C@H]2CCS(=O)(=O)C2)cc1	776059968	STDBTCGDECYKNQ-ZFWWWQNUSA-N	449.489	1.066	50	20	IDGD	
C[C@H]1[C@@H](C)N(C(=O)OC(C)(C)C)CCN1C(=O)NNC(=O)CNC(=O)c1cccs1	776322400	ZLAQPYPDYNKMST-QWHCGFSZSA-N	439.538	1.548	50	20	IDGD	
O=C(Cc1cccnc1)NNS(=O)(=O)c1cc(Br)c(Cl)c(C(=O)O)c1	777623903	OHJIASHQRGYXSR-UHFFFAOYSA-N	448.682	1.748	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)N[C@@H]2CCCOc3c(F)cccc32)c2ccccc2c1=O	779399233	MOOWOAHHPHQAJM-MRXNPFEDSA-N	425.420	1.931	50	20	IDGD	
COC(=O)c1ccccc1NNC(=O)c1cc(S(=O)(=O)N2CCC[C@@H](C)C2)cn1C	780739763	QXCJYQVLIJOBMW-CQSZACIVSA-N	434.518	1.989	50	20	IDGD	
Cc1nc(Cn2nnc(C(=O)NNC(=O)c3ccc(OCCC(C)C)cc3)c2C)no1	781863920	YDRXNGRTHSGIJL-UHFFFAOYSA-N	427.465	1.826	50	20	IDGD	
CN(NC(=O)c1c[nH]nc1-c1cnn(C)c1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	781983067	DSWPQBOUOYWYHK-UHFFFAOYSA-N	432.485	1.060	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)Nc2cc(Br)cnc2-n2cccn2)n1	782065307	PYQCNTWEAQVEMB-UHFFFAOYSA-N	433.270	1.696	50	20	IDGD	
CS(=O)(=O)CCc1ccc(NC(=O)C(=O)NNc2ncccc2C(F)(F)F)cc1	783121463	MLJGUFSLAZSWEH-UHFFFAOYSA-N	430.408	1.769	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2cccc(-n3ccnc3)c2)nc1	783264432	POBWLTVGQZIINT-UHFFFAOYSA-N	443.489	1.036	50	20	IDGD	
COC[C@H](C)NS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2cc(C)cc(C)c2)cc1	783356808	PNMPZUYGRGJXFT-HNNXBMFYSA-N	434.518	1.698	50	20	IDGD	
NC(=O)c1ccc(S(=O)(=O)NNC(=O)c2nc(Cl)c(Cl)c(N)c2Cl)cc1	784090559	YHVRZFATFPDRNP-UHFFFAOYSA-N	438.680	1.346	50	20	IDGD	
CCN1CCN(C(=O)c2ccc(NC(=O)C(=O)NNc3cccc([N+](=O)[O-])c3)cc2)CC1	784828777	KAJGBUVRNZOVIP-UHFFFAOYSA-N	440.460	1.454	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)C(=O)Nc2ccc(S(=O)(=O)N(C)C(C)C)cc2)c1	784851956	FNPOFHSJWNIBSI-UHFFFAOYSA-N	448.501	1.584	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@H]2CCC(=O)c3ccccc32)cc1	785687545	YJVJQVFADRMGIJ-SFHVURJKSA-N	429.498	1.523	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)CSc2ccccc2OC)c(C)cc1C	788332201	BGXLZSKYFVTQOS-UHFFFAOYSA-N	445.497	1.977	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1cccc2c1OCC[C@@H]2N(C)C	789732940	VNLQXJLKYBXVBA-INIZCTEOSA-N	436.472	1.428	50	20	IDGD	
O=C(NNC(=O)[C@H]1OCC[C@H]1c1ccccc1)C(=O)Nc1ccc2c(c1)OCCCO2	789809926	HCNOGQQWMHYBKG-LPHOPBHVSA-N	425.441	1.507	50	20	IDGD	
O=C(NNc1cccc(F)c1[N+](=O)[O-])C(=O)Nc1cc(C2CC2)nn1-c1ncccn1	790993944	MPBRHAXWEFLWEH-UHFFFAOYSA-N	426.368	1.669	50	20	IDGD	
O=C(NNC(=O)C(=O)Nc1ccccn1)N[C@@H]1C[C@H]1c1ccc(Br)c(F)c1	792308342	WAWKVERAYAMBHS-GXFFZTMASA-N	436.241	1.808	50	20	IDGD	
O=C(Cc1ccccn1)NNC(=O)C(=O)Nc1ccc(N2CCCCC2)c2ncccc12	792356168	NBTJNQQEPWSRAD-UHFFFAOYSA-N	432.484	1.949	50	20	IDGD	
Cc1nc(CC(C)C)c(NC(=O)C(=O)NNC(=O)CNC(=O)OCc2ccccc2)s1	797368583	DTFDQUZWMJQERR-UHFFFAOYSA-N	447.517	1.662	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)Nc1ccc(OCC(F)(F)F)c(Cl)c1	800570201	HFFNOSCVZCFPQM-MRVPVSSYSA-N	429.804	1.869	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3ccncc3C(F)(F)F)CC2)cc1	800693197	BPVFZLHJQVKKQT-UHFFFAOYSA-N	435.450	1.988	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](Cc2cccnc2)NC(=O)c2ccccc2)cc1	801111600	TZRJRAGLJDGRNP-HXUWFJFHSA-N	445.479	1.517	50	20	IDGD	
O=C(CN1C(=O)N[C@@]2(CCc3ccccc32)C1=O)NNC(=O)Nc1cc(F)cc(F)c1	801999547	DRESRSHCKATOOD-HXUWFJFHSA-N	429.383	1.511	50	20	IDGD	
Cc1c(/C=C(\C#N)C(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)cc(C#N)n1C	802063804	QFPOSZDJPNAUQG-RIYZIHGNSA-N	426.458	1.369	50	20	IDGD	
CCOC(=O)C1(S(C)(=O)=O)CCN(C(=O)/C(C#N)=C\c2ccc(OCC)cc2)CC1	804715304	DXKYJSQPVFRFCU-VKAVYKQESA-N	434.514	1.961	50	20	IDGD	
O=C(NNC(=O)c1cc2c(s1)CCC2)C(=O)Nc1ccc(F)c(N2CCCNC2=O)c1	806974821	UQNRIKDTPXOMPC-UHFFFAOYSA-N	445.476	1.695	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ccc(-n3ccnc3)nn2)c(Br)c1	807428340	BABGHHYQDPPQPY-UHFFFAOYSA-N	432.238	1.515	50	20	IDGD	
Cc1ccc2c(c1)=CC(C(=O)NNC(=O)c1ccc(S(=O)(=O)N3CCCC3)cc1)=S=2	809983758	SBPWBCLCSUHTSW-UHFFFAOYSA-N	443.550	1.191	50	20	IDGD	
CCOc1cc(Br)c(F)cc1NC(=O)C(=O)NNC(=O)Cc1cc[nH]n1	810387403	UYABSLOPTISCNP-UHFFFAOYSA-N	428.218	1.039	50	20	IDGD	
Cc1c(Cl)c(C(F)(F)F)nn1CC(=O)OCC(=O)NNC(=O)c1cccc(C#N)c1	811244837	FMBSZZGYEFNECB-UHFFFAOYSA-N	443.769	1.740	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCC2(SC)CCN(C)CC2)nc1	812550337	ZXTRLDZXRGFKRN-UHFFFAOYSA-N	444.627	1.566	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2cccc(-c3cnco3)c2)cc1	813034020	VKIREQCRAAZJMJ-UHFFFAOYSA-N	429.458	1.674	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)C1CCN(c2noc3ccc(Cl)cc23)CC1	814801776	LYOVPDSRHDGGAD-LBPRGKRZSA-N	440.909	1.280	50	20	IDGD	
O=C(NNc1ncc(F)cn1)C(=O)Nc1cc(Cl)ccc1I	815604200	HKZMNWBDNWMRJF-UHFFFAOYSA-N	435.584	1.956	50	20	IDGD	
CCCNC(=O)c1cccc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)N(C)C)c1	815751869	RUDFWHSZNUCZDJ-UHFFFAOYSA-N	447.517	1.159	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)Cc2ccc(S(N)(=O)=O)cc2)c1	818767489	KIDMFLUDDYCXFA-UHFFFAOYSA-N	442.291	1.569	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2ccc(S(C)(=O)=O)cc2)ccc1OC(C)C	874074047	ALRMISRLQQCYKU-UHFFFAOYSA-N	442.515	1.509	50	20	IDGD	
O=C(CN1CCCN(C(=O)c2cccc(F)c2)CC1)NNC(=O)c1cccc([N+](=O)[O-])c1	913203202	BEQMAYVGLIMXCD-UHFFFAOYSA-N	443.435	1.343	50	20	IDGD	
O=C(COc1ccc(F)cc1F)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	914457310	VQFFZVGONFYPKH-UHFFFAOYSA-N	439.440	1.589	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)CNC(=O)Cc2cccc3ccccc23)c1	915077239	QVTYJRXENQUUNZ-UHFFFAOYSA-N	439.493	1.363	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@H](c2ccccc2)N2CCCC2)c1	915877853	FCXAVOSYEWBHCC-LJQANCHMSA-N	430.530	1.871	50	20	IDGD	
CC(=NNC(=O)[C@H](C)Oc1ccccc1F)c1ccc(S(=O)(=O)N2CCNCC2)cc1	916334571	CMSXUIROBUUKCU-INIZCTEOSA-N	448.520	1.727	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)NCCCNc1ccccn1	916576490	DDWXHUAIDOTNRX-UHFFFAOYSA-N	425.537	1.426	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)NCc3ccco3)cc2)c(O)c1	918337393	KVGHTWSFPSIBSM-UHFFFAOYSA-N	429.454	1.847	50	20	IDGD	
COc1cc(CNC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)ccc1C	919791133	CGBHVBPYKUIDDM-UHFFFAOYSA-N	434.518	1.463	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CC(F)(F)F)cc1S(=O)(=O)Cc1cc(C)no1	919816746	GDTVHCOVPDGYDP-UHFFFAOYSA-N	435.380	1.679	50	20	IDGD	
O=C(NNC(=O)C1=NN(c2ccccc2)[C@@H](c2ccccc2)C1)N[C@@H]1CCS(=O)(=O)C1	919888911	HPJYRCNKTUVDTM-VQIMIIECSA-N	441.513	1.512	50	20	IDGD	
O=C(C[C@H]1CCS(=O)(=O)C1)NNc1ccc(S(=O)(=O)Nc2nccs2)cc1	1252518986	QCDYLDJWJDOXOV-LLVKDONJSA-N	430.533	1.212	50	20	IDGD	
CO[C@H](CNC(=O)NNc1ccc(S(=O)(=O)NC(C)C)cn1)c1ccc(F)cc1	1252728623	ZFMHMSUBZZHDDA-MRXNPFEDSA-N	425.486	1.921	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)NCc2ccc(-n3ccnc3)nc2)CC1	1318562175	ISANRUYISHBIBM-UHFFFAOYSA-N	443.508	1.745	50	20	IDGD	
Cc1ccccc1OCCC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	1319369614	CUUDEQVPIVQKDA-UHFFFAOYSA-N	432.546	1.843	50	20	IDGD	
C[Si](C)(C)c1cc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)co1	1779004004	VFGFFLTVCXHRLK-PBHICJAKSA-N	447.377	1.959	50	20	IDGD	
C=CCCC(C)(C)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1	1779029588	UUSNGLIWUCOHOJ-JOCHJYFZSA-N	429.521	1.121	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CC1CCCC1)C2	1779371042	JBQGRDLEMPOMDW-AUSIDOKSSA-N	443.548	1.393	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)n(C(F)F)n1	1780312182	CPEIQZVFLILNKS-GOSISDBHSA-N	430.528	1.882	50	20	IDGD	
Cc1nccn1CC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@](C)(Cl)CCl)C1	1780716650	KYHXLSKDIFXHQJ-ATZDWAIDSA-N	431.364	1.942	50	20	IDGD	
CN1C(=O)CC[C@H]1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@](C)(Cl)CCl)C2	1780794018	UWJDGKKYAUUJJD-WTVLQJKYSA-N	434.364	1.357	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(CCN(C(=O)[C@H]3CC[C@@H]4CCC(=O)N4C3)C2)C1	1781053120	NMFIGLQTIKOLFQ-QMTMVMCOSA-N	442.354	1.002	50	20	IDGD	
O=C(c1ccc2ccnn2c1)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1782404377	CDUALQXRPAMHER-PBHICJAKSA-N	425.258	1.468	50	20	IDGD	
Cc1cc(C)n(CCC(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](O)CCl)C3)n1	1782433829	OTAFHMZXMSTMBR-MBOZVWFJSA-N	426.945	1.004	50	20	IDGD	
CCc1cc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](Br)CC)C3)C2)nn1C	1783353750	ZYEUDKKYMMJDIA-KSSFIOAISA-N	427.343	1.600	50	20	IDGD	
COC(=O)c1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](C)Br)C3)C2)cn1	1783534039	CXCNXPISCBTBTQ-KZULUSFZSA-N	440.294	1.095	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)CCc3cccnc3OC)CCO2)C1	1783872617	DLYKFRISPLZPES-OXQOHEQNSA-N	425.913	1.107	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3CCC(O)CC3)C[C@@H]21	1783974237	JIXDRLVPVDCRGY-NHHQPVPPSA-N	431.371	1.548	50	20	IDGD	
O=C(C1Cc2ccccc2C1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1785683400	DSSLKNWQLSQPNP-VQIMIIECSA-N	425.298	1.922	50	20	IDGD	
C[C@H](Oc1ccccn1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCBr)[C@H]2C1	1786407671	HDJHYFINXMIADT-VGWMRTNUSA-N	440.338	1.614	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccccc3)C[C@@H]21	1787508862	XGLUNAZVEWHAOH-QXDWZXEQSA-N	437.500	1.414	50	20	IDGD	
C[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Cl)C[C@@H]21)N1CSCSC1	1788682931	MXEYAQBUZADWDS-HTVCTNPSSA-N	425.979	1.544	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)c1cc(Cl)ncn1	1789058366	CGSUIBCSBBXORC-LKAMGYQZSA-N	435.681	1.414	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(O)nc3)[C@H]2C1	1789298038	OKLKDGVZLWPOCA-MXAVVETBSA-N	426.311	1.412	50	20	IDGD	
Cc1nc(N)sc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]2C1	1789922865	SKVBGQKBSAXTHY-QFOLPQNPSA-N	435.319	1.318	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3[nH]nc4ncccc34)C[C@@H]21)[C@@H](F)Br	1789923183	WQAOTXLOSSQVAG-QVSJOPQTSA-N	440.273	1.242	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)[C@@H](O)CCl)CCC2)cc1)c1cc(=O)nc2cccnn12	1790031550	NANUYGMOEOOJHD-INIZCTEOSA-N	441.875	1.437	50	20	IDGD	
COc1ccc(/C=C(\C)C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](O)CCl)C[C@@H]32)cc1	1790664920	AOBBLZYGBOHEBI-GJSUTMHOSA-N	436.936	1.678	50	20	IDGD	
CCOC(CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]21)OCC	1791420577	SERXYHIRWBTRSD-XMDUPGNXSA-N	439.380	1.992	50	20	IDGD	
O=C(CCc1cnc2ccccc2c1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2	1792819983	SOAWBIONMYPTGH-SHJAMOMRSA-N	431.920	1.357	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(Br)cc1F)C2)[C@H](O)CCl	1792975233	NLUUGKLUXDTZCE-ANGCBRKESA-N	449.704	1.391	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(F)(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](O)CCl)C1	1793117170	DVAONOYRUCYRQS-CRWXNKLISA-N	433.908	1.183	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CC[C@H]3CCC(=O)N3C1)C2	1793452344	ZOLNTRBMTFARTE-YNNDZGMISA-N	425.957	1.385	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCc1cc(F)ccn1	1794027150	SKUQKICGWGPACN-JRATXPSKSA-N	428.302	1.526	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cncc(S(C)(=O)=O)c1	1794623245	WAUYLLNTMHQWEH-MUJYYYPQSA-N	439.610	1.588	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccc(F)c(F)c1	1795298466	OFIWGGONXWGVKA-AKENFEQQSA-N	431.277	1.880	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cn(C)nc1C(F)F	1796705806	TYZQXBCMIYWNIY-LFSVMHDDSA-N	449.296	1.734	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cocn1)C2	1798522783	ZOCKYXXADMNVCI-IVWMJMPLSA-N	444.400	1.025	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](NC(C)=O)c1ccc(F)cc1)C2	1799269376	YGZIKAGCAHZKKB-HAYURNKSSA-N	439.915	1.610	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2cccnn2c1	1800010099	IAMANRVSDQYUCL-YALNPMBYSA-N	435.322	1.711	50	20	IDGD	
CC[C@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](CCN)NC(=O)OC(C)(C)C)C2	1800070331	CUYDLQLACFDQIO-XFIYOXNOSA-N	430.977	1.884	50	20	IDGD	
CCOCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](Br)Cc1ccccc1	1800435226	BVRSRXOBMXDTLD-SFNKJDCFSA-N	439.350	1.619	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)COc1ccccc1F	1800647336	GVOIQLNIZRBZIQ-JRATXPSKSA-N	429.286	1.578	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(Cl)c(O)cc1O)C2	1800976962	DZOKCWVBQMKGNN-HMVGFALLSA-N	433.288	1.208	50	20	IDGD	
COC[C@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](NC(=O)OC)c1ccccc1)C2	1802271868	XNGMKGOEZJUXSI-FLXSYLCISA-N	437.924	1.976	50	20	IDGD	
NC(=O)c1ccccc1C(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]1c1cccnc1	1803140996	JWIZRMFRQXUWIF-OLMNPRSZSA-N	430.892	1.100	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC2(CCCN(C(=O)c3ccnc(F)c3)C2)CC1	1806305380	PRIFDZMRNIUVNF-UHFFFAOYSA-N	425.269	1.059	50	20	IDGD	
Cn1nc(C(=O)N2CC[C@H](CNC(=O)CCBr)[C@H]2c2cccnc2)cc1O	1806338468	AIBVTOQROKIKRS-CXAGYDPISA-N	436.310	1.625	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC2(CCCN(C(=O)CCC(=O)N3CCCC3)C2)CC1	1806653969	LYTLAKIKZUEHNJ-KRWDZBQOSA-N	427.973	1.874	50	20	IDGD	
CC(F)(F)C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1	1806962817	LUDYVRAVLRZXNW-CJNGLKHVSA-N	432.431	1.055	50	20	IDGD	
O=C(c1cnn(-c2cccnc2)c1)N1CCCC2(CCN(C(=O)[C@@H](O)CCl)CC2)C1	1807705200	FTNFLBBSHANVEP-SFHVURJKSA-N	431.924	1.712	50	20	IDGD	
CCc1cc(C(=O)NC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)n[nH]1	1807776778	WYCSIYAZLBRVQR-HRAATJIYSA-N	441.536	1.060	50	20	IDGD	
NC(=O)c1ncccc1C(=O)N1CCC2(CCCN(C(=O)CCBr)C2)CC1	1809066615	QDKVYFVCFCCYLV-UHFFFAOYSA-N	437.338	1.810	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)c1ccc2[nH]ccc2n1	1809788747	VQEJSMJYIXKGKA-JVPBZIDWSA-N	427.892	1.877	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)CCc3cnn(C)c3)sc2C1	1815438072	WUKCBKULRIZWRB-QWHCGFSZSA-N	425.942	1.675	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CN2CCS(=O)(=O)CC2)n[nH]1	1815672977	NKMCQORXVQGRCC-HIFRSBDPSA-N	445.973	1.150	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@](C)(Cl)CCl)CC2	1817020627	BKPQYKHOEOYTAR-OMQMVUIESA-N	436.365	1.738	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)Cc2ccc(F)cn2)n[nH]1	1817544754	ZUCXVMPXONJOSM-QGZVFWFLSA-N	445.499	1.552	50	20	IDGD	
CC[C@@H](NC)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)n[nH]1	1818112182	VJOAVLLFXBJPEY-VBANEENCSA-N	442.524	1.534	50	20	IDGD	
Cc1ccncc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819402538	AYTNVHHCECVQMH-SFHVURJKSA-N	448.487	1.731	50	20	IDGD	
C[Si](C)(C)OCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(=O)n2O)[nH]n1	1819592232	OBXSFYVDUJQISJ-AWEZNQCLSA-N	433.541	1.966	50	20	IDGD	
COC[C@@H](NC(C)=O)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)C(C)(C)CCl)[nH]n1	1819605651	FKAXDQHRZMGDOP-CABCVRRESA-N	427.933	1.818	50	20	IDGD	
C[C@H](Br)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(CO)on2)[nH]n1	1822190649	SPGNPKLLPQUCRD-ZANVPECISA-N	426.271	1.979	50	20	IDGD	
O=C(Cn1ccccc1=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1	1823002375	DAGGVOIAYCXURJ-YMTOWFKASA-N	443.298	1.608	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](O)CCl)CC2)c1cc(O)cc([N+](=O)[O-])c1	1823640455	OQXQKTJLFJXLIJ-ZANVPECISA-N	440.865	1.582	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CN2CCNC2=N)CC1	1824092896	IFGBVGYKJHXXFJ-ZBFHGGJFSA-N	442.402	1.477	50	20	IDGD	
Cc1noc(CC(=O)N[C@H]2CCc3nc(NC(=O)[C@H](C)Br)sc3C2)n1	1825642873	WHROSTCUDXEZRQ-CBAPKCEASA-N	428.312	1.773	50	20	IDGD	
C[C@@H](C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCBr)CC2)n1cnnn1	1826971657	ITZSLNUKIDLSMX-IUCAKERBSA-N	428.316	1.088	50	20	IDGD	
Cc1nccn1[C@@H](C)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCC(=O)NN(C)C)CC2	1827042394	CUPCADYQEFIDNY-JSGCOSHPSA-N	447.565	1.194	50	20	IDGD	
O=C(C1=CCCS1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827050314	MIYHVWJJTCSQNX-IBGZPJMESA-N	428.363	1.621	50	20	IDGD	
CS(=O)(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCBr)CC2	1827203767	BTYQRNLBPATKSC-VIFPVBQESA-N	438.369	1.275	50	20	IDGD	
O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(F)nc1F)CCO2	1829527983	QFZUTWQDZKVBSR-QGZVFWFLSA-N	448.264	1.215	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnoc3C3CC3)C2)C1	1830359005	JIIKHYCFMFKGBY-FQEVSTJZSA-N	425.913	1.887	50	20	IDGD	
CC(C)N1CCC[C@H]1C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830370270	OQBRRIFZEUASOP-UWJYYQICSA-N	429.989	1.581	50	20	IDGD	
CN1CCCC[C@@H]1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1	1830760766	OTYCXUOYVHFNDX-ATZDWAIDSA-N	436.380	1.163	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)C3CCN(CC)CC3)C2)C1	1831658398	DSFXWJUNNIYXSL-RXVVDRJESA-N	429.989	1.582	50	20	IDGD	
C[C@@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1)c1ccccn1	1832330544	UDPHGIGHVUQUJQ-WZONZLPQSA-N	449.360	1.798	50	20	IDGD	
Cc1noc(C)c1CCC(=O)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1833068241	FWWGKYVYSZAXAK-SFHVURJKSA-N	434.320	1.484	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnnc(Cl)c3)CCO2)C1	1833204822	HPDBYQIDAVXRHS-RDTXWAMCSA-N	431.320	1.608	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)CSc3ccccc3)CC2)CC1)[C@H](O)CCl	1833308941	DXLBIODMZFKIAL-LJQANCHMSA-N	440.009	1.950	50	20	IDGD	
C[C@@H](Cc1ccccn1)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)CCl)CC2)CC1	1833313152	XULYTQCDUBMULB-JXFKEZNVSA-N	436.984	1.432	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3nccn3C)CC2)CC1	1834270833	DCEHFXRRKSBDMY-MRXNPFEDSA-N	440.386	1.779	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)C(=O)c3ccccc3)CC2)CC1	1834381282	NOMCFZWQTAFXJV-LJQANCHMSA-N	435.952	1.695	50	20	IDGD	
Cc1ccc(F)cc1C(=O)N1CCOC[C@@]2(CN(C(=O)CCBr)CCO2)C1	1834820237	RQIIAJNUYBFPDG-LJQANCHMSA-N	443.313	1.989	50	20	IDGD	
COC(=O)C12CC(C(=O)N3CCC(N4CCC(NC(=O)[C@H](F)Cl)CC4)CC3)(C1)C2	1835083694	QMMTUYRYLBVFNZ-VMEOHVCESA-N	429.920	1.436	50	20	IDGD	
C[C@@H](Cn1cccn1)C(=O)N1CCC(N2CCC(NC(=O)CO[Si](C)(C)C)CC2)CC1	1835835390	XYTYGTVATPWMKG-SFHVURJKSA-N	449.672	1.942	50	20	IDGD	
CC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)c3cccn4c(O)nnc34)CC2)CC1	1836393973	DTAMVJZYDRSZJF-KRWDZBQOSA-N	448.955	1.638	50	20	IDGD	
O=C(c1csc2c1CCCC2)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1	1836896344	ZXUNXHNQERUGSS-UZLBHIALSA-N	442.965	1.297	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](COC)NC(C)=O)CC2)CC1	1836923485	ZJPPEGYRZXNONP-RTBURBONSA-N	445.988	1.544	50	20	IDGD	
Cn1nc(C(F)(F)F)cc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1838078431	NSXHEBJBCWWLCV-IUODEOHRSA-N	442.797	1.043	50	20	IDGD	
C[C@@H](C(=O)N1CCC(OC2CCN(C(=O)CO[Si](C)(C)C)CC2)CC1)n1cnnn1	1838432439	VSYISSNVTDPMCS-HNNXBMFYSA-N	438.605	1.084	50	20	IDGD	
O=C(CNC(=O)C(F)(F)F)N1CCC(OC2CCN(C(=O)C(Cl)Cl)CC2)CC1	1838788921	DPWIXVQCFUMEIO-UHFFFAOYSA-N	448.269	1.467	50	20	IDGD	
O=C(c1ccoc1Cl)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1838844814	MEXULBUUOPOXOI-XHDPSFHLSA-N	439.665	1.694	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccoc3Cl)CCO2)C1	1838845324	NBHYGYLVQSJPPN-BZNIZROVSA-N	435.702	1.786	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc([N+](=O)[O-])cc3F)C2)C1	1839147402	PKZKQANEKVPQML-BEFAXECRSA-N	443.859	1.821	50	20	IDGD	
Cc1nscc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839197877	KOKRGLCMRKXYQK-IUODEOHRSA-N	436.303	1.212	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(O)cc3F)CCO2)C1	1839317553	IUNZHZRINGPCTP-XIKOKIGWSA-N	445.285	1.385	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ncccc3C)C2)C1	1839962320	AMYCOAWMDDZSGI-KXBFYZLASA-N	440.338	1.634	50	20	IDGD	
C=CCOCCCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)Br)CCO2	1840030278	HOTBCOTWOORCIO-MAUKXSAKSA-N	433.343	1.209	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)c(F)c1	1840034651	SBFBHUIOHNCCDF-AUUYWEPGSA-N	443.313	1.988	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4sccn4c3)C2)C1	1840151969	SLKDFRYAFTZYOK-HNAYVOBHSA-N	441.937	1.325	50	20	IDGD	
COc1cnc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)c(F)c1	1840186935	XMBPNHTYRGKRKU-KRWDZBQOSA-N	436.267	1.103	50	20	IDGD	
O=C(CCCc1cccnc1)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840190914	VGRHXOCWFBUCHJ-LJQANCHMSA-N	430.332	1.664	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCCCCC(=O)OC)CCO2)C1	1840233924	CTLXNKHMOWYICD-DYESRHJHSA-N	446.972	1.974	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)/C=C/c3cnccn3)CCO2)C1	1840488187	XFIDJYSJYXCVPW-WTJLDUFHSA-N	443.331	1.183	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CCCSC1)CCO2	1840867069	CUGIVSZAZUSZHU-ZQIUZPCESA-N	435.384	1.369	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC12CN(C(=O)CNC(=O)c1cccs1)C2	1841286072	GSFAEPQMGUWTIQ-GFCCVEGCSA-N	428.352	1.712	50	20	IDGD	
O=C(Cc1cc(Br)ccc1O)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1	1841352617	AZFBTGRABRHTLY-CQSZACIVSA-N	431.714	1.500	50	20	IDGD	
Cc1nccnc1C(=O)N1CC2(CCCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C1	1841924583	CXBPCPBOLVENSN-AWEZNQCLSA-N	437.928	1.734	50	20	IDGD	
COc1ccc([N+](=O)[O-])c(C(=O)N2CCCC23CN(C(=O)[C@H](C)Br)C3)n1	1843586696	FLVOIYNYRZYLNA-JTQLQIEISA-N	427.255	1.599	50	20	IDGD	
Cn1c(=O)n(C)c2cc(C(=O)N3CCCC34CN(C(=O)CCBr)C4)ccc21	1843733754	TZSWQPUOUCOSQA-UHFFFAOYSA-N	435.322	1.479	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC2(CCCN2C(=O)c2cn3[nH]cnc(=O)c3c2C)C1	1844657105	QWHZWKPNAPNJSU-ZDUSSCGKSA-N	436.310	1.322	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)C[C@H](O)CNC(=O)OC(C)(C)C)C1	1845229038	YZDWDBOLKGFUNY-LSDHHAIUSA-N	431.961	1.873	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)[C@@H](C)Oc2ccccc2)C1	1845241606	SJYZWWALBRQOPO-GZPJKGAFSA-N	437.500	1.791	50	20	IDGD	
COC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)[C@@H](C)Br)C1	1846176737	AEJMGPSGRCVTEW-CHWSQXEVSA-N	448.358	1.513	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)CCc2cnc3[nH]ccc3c2)C1	1846255009	XSODSQASFKIGRX-UHFFFAOYSA-N	447.499	1.011	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@H]1C[C@H]3C[C@H]3N1C(=O)OC(C)(C)C)C2	1846365693	PGULBBMVQVAKKQ-FPCVCCKLSA-N	441.956	1.842	50	20	IDGD	
CC(C)(C)OC(=O)NCCOCCC(=O)N1CC2(CCCN2C(=O)C(Cl)Cl)C1	1846386695	NXHNMWVQSQXEJI-UHFFFAOYSA-N	438.352	1.925	50	20	IDGD	
CCn1c(=O)n(CC(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)c2ccccc21	10708490	XDBZHECBUPBXJB-UHFFFAOYSA-N	448.483	1.575	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)c2cc(Cl)c3c(c2)OCCCO3)c2ccccc2c1=O	14887972	LYDBXNMTFRSQHW-UHFFFAOYSA-N	428.832	1.823	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)NNC(=O)c1ccc(S(=O)(=O)N2CCOCC2)cc1	16073623	MHOCTTLHDFKTHR-UHFFFAOYSA-N	442.497	1.193	50	20	IDGD	
CC(C)COC(=O)N1CCC(C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)CC1	726190716	WQDINHNJOARZMV-UHFFFAOYSA-N	429.477	1.844	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc([C@H](C)NCC(=O)NNC(=O)c2cccs2)cc1	727239106	DEDOKDSSSOWFAU-AWEZNQCLSA-N	438.575	1.890	50	20	IDGD	
COCc1cccc(S(=O)(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)c1	727351079	DFCVITNVGFMZMP-UHFFFAOYSA-N	426.520	1.058	50	20	IDGD	
O=C(CN1CCN(C(=O)c2c(F)cccc2F)CC1)NNC(=O)c1ccc([N+](=O)[O-])cc1	727831606	LAWPBFOLNYHDNU-UHFFFAOYSA-N	447.398	1.092	50	20	IDGD	
CC[C@H](C)C(=O)NNS(=O)(=O)c1ccc(S(=O)(=O)N2C[C@@H](C)C[C@H](C)C2)cc1	728259516	FRSDPLOBTGKYPZ-KKUMJFAQSA-N	431.580	1.709	50	20	IDGD	
O=C(NNC(=O)c1cc2c(s1)CCOC2)c1cccc(S(=O)(=O)N2CCCC2)c1	728455578	LTIWFAXWBNGLOI-UHFFFAOYSA-N	435.527	1.680	50	20	IDGD	
N#Cc1cccc(C(=O)NNS(=O)(=O)c2ccc([N+](=O)[O-])c(Br)c2)c1	728853569	SSYUUUYVNWVPCG-UHFFFAOYSA-N	425.220	1.852	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)[C@H](CC)N=c2nn[nH]n2-c2ccccc2)cc1OC	729281967	IAOZXMSEGUOAHY-INIZCTEOSA-N	439.476	1.143	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cc3ccccc3n2CC#N)cc1	729298678	RWYBUDONSFJICA-UHFFFAOYSA-N	439.497	1.555	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@@H]2CCCCN2C(=O)c2ccccc2)c2ccccc2c1=O	729300856	XTHOWUDWIJWVDV-IBGZPJMESA-N	447.495	1.872	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)[C@H]1CC(=O)N(c2ccc(F)c([N+](=O)[O-])c2)C1	729662901	ZFHARXFOGCKIPQ-AWEZNQCLSA-N	439.403	1.889	50	20	IDGD	
Cc1n[nH]cc1S(=O)(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	730088446	GMHUVPGCCXOFDC-UHFFFAOYSA-N	441.516	1.204	50	20	IDGD	
NC(=O)c1ccc(/C=C/C(=O)N2CCC[C@@H]2C(=O)NN=c2cc[nH]c3ccccc23)cc1	730288696	WXKSDXIVUBYXJT-VZOQVYJPSA-N	429.480	1.903	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)c1sccc1S(=O)(=O)C(F)F	730998216	PFZKWPXIJUUESQ-UHFFFAOYSA-N	428.398	1.468	50	20	IDGD	
CCn1c(=O)nc(O)c2c(C(=O)NNC(=O)c3ccccc3OC)cc(C(C)C)nc21	731493735	DUTWFEDSVRHQNS-UHFFFAOYSA-N	425.445	1.724	50	20	IDGD	
CCCn1c(=O)n(C)c(=O)c2c(S[C@@H](C)C(=O)NNC(=O)CC)nc(C(C)C)nc21	731904074	FBJQMQKDFIWJRC-NSHDSACASA-N	436.538	1.062	50	20	IDGD	
COc1ccc(C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1OC(F)F	732325221	LHZPXUGLBHTBML-UHFFFAOYSA-N	439.327	1.823	50	20	IDGD	
CC1CCC(N2C[C@H](C(=O)OCC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)CC2=O)CC1	732346011	LEJJQLZXHKVPAB-OGVSOVDVSA-N	446.460	1.326	50	20	IDGD	
O=C(NNC(=O)[C@@H]1C[C@H]1c1ccc(OCc2ccccc2)cc1)[C@H]1CCS(=O)(=O)C1	732535120	RTBWUHUEXSUVKO-YSIASYRMSA-N	428.510	1.951	50	20	IDGD	
Cc1cc(NNC(=O)[C@@H](NS(=O)(=O)c2ccc3c(c2)OCCCO3)C(C)C)ncn1	734254467	VOVHMDSXGQRAIQ-SFHVURJKSA-N	435.506	1.393	50	20	IDGD	
Cc1ccc(CCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1	734947637	XBXCFNFIFBPFGJ-UHFFFAOYSA-N	430.530	1.966	50	20	IDGD	
CSCCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	737056742	XXYUXNVZCKYKFU-UHFFFAOYSA-N	436.559	1.862	50	20	IDGD	
C[C@H]1CC(C)(C)C[C@]2(C1)NC(=O)N(CC(=O)NNC(=O)COCc1ccccc1)C2=O	737636113	BXFDNDZFUJUVBE-NYHFZMIOSA-N	430.505	1.487	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)[C@H](NC(=O)c1ccc(OC)cc1)c1ccccc1	740850201	ZCVQJTQANMGAJE-LJQANCHMSA-N	440.500	1.619	50	20	IDGD	
CC(C)CC(=O)NCCC(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	741666588	AHRHEKWBULRSCI-UHFFFAOYSA-N	449.515	1.702	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)Cc2ccc(S(N)(=O)=O)cc2)cc1Cl	743833655	ADOAUVMWPXWHSF-UHFFFAOYSA-N	442.881	1.400	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)c1	743855995	PMOPIOXHVZYHEN-QGZVFWFLSA-N	433.505	1.902	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)C(O)(c2ccccc2)c2ccccc2)cc1	744450855	IXWOTFVMIVPAGE-UHFFFAOYSA-N	429.432	1.799	50	20	IDGD	
CC(=O)N[C@@H](CC(=O)OCC(=O)NNC(=O)c1cccc(C#N)c1)c1ccc(Cl)cc1	744511934	HNBWDIPMCQQSTI-SFHVURJKSA-N	442.859	1.783	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)c2cccn(Cc3ccccc3)c2=O)cc1	744866518	PLNBYPOYFMCKPV-UHFFFAOYSA-N	430.420	1.386	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)N[C@H]2C[C@H](C)N(c3cnn(C)c3)C2=O)c1	745917990	MNINQRGASDAPKC-YJBOKZPZSA-N	442.520	1.755	50	20	IDGD	
O=C(NCc1csc(-c2ccc(C(F)(F)F)cc2)n1)NNC(=O)C(=O)NC1CC1	745921127	IPOXMWURTULRTN-UHFFFAOYSA-N	427.408	1.938	50	20	IDGD	
Cc1ccc(-n2c(NNC(=O)c3nccnc3C(N)=O)nc3ccccc3c2=O)c(C)c1	746258029	KMWPKDKDRASDEY-UHFFFAOYSA-N	429.440	1.648	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@@H]2C(=O)NNC(=O)Cc2cn3ccccc3n2)s1	746549516	QSHCXAGVCBNPHG-OAHLLOKOSA-N	447.542	1.247	50	20	IDGD	
O=C(NCCOc1ncccc1C(F)(F)F)NNC(=O)c1cc([N+](=O)[O-])ccc1O	747446596	BLLOKGRVEOCXIL-UHFFFAOYSA-N	429.311	1.737	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N2CCN(C3CCOCC3)CC2)cc1Br	747502610	VJILOHKJZYWVHN-UHFFFAOYSA-N	441.326	1.609	50	20	IDGD	
Cc1c(C(=O)NNc2ccc(C#N)c(C(F)(F)F)c2)cnc2c1c(=O)n(C)c(=O)n2C	748623531	OJRKLJVINSTEQQ-UHFFFAOYSA-N	432.362	1.588	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(\C#N)C(=O)N2CCN(CCn3cncn3)CC2)c1C	749397992	XGHCLGRQHDCUAN-IUOVYFEOSA-N	425.537	1.655	50	20	IDGD	
Cc1cc(N2CCC(NC(=O)NNC(=O)c3cnn(-c4ccccc4)c3)CC2)nc(C)n1	749616076	CZFDHGCYQZIITO-UHFFFAOYSA-N	434.504	1.892	50	20	IDGD	
NS(=O)(=O)c1ccc(Br)c(C(=O)NNC(=O)CCc2ccccc2)c1	749851204	AFCPQSDLDATXDN-UHFFFAOYSA-N	426.292	1.490	50	20	IDGD	
Cc1onc(-c2cccc(Br)c2)c1C(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1	751561635	DJEJXPOXGHYIQU-LLVKDONJSA-N	442.291	1.608	50	20	IDGD	
Nc1cc(Br)ccc1C(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	751774468	VNZGKBBSBISQBL-UHFFFAOYSA-N	437.206	1.558	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)NCc1ccc(COC2CCOCC2)cc1	752206854	OTBRGWIXIXQLNR-UHFFFAOYSA-N	429.473	1.997	50	20	IDGD	
CO[C@@H](C)c1nc(CN2CCCN(CC(=O)NNC(=O)c3ccc(F)cc3)CC2)cs1	752354160	COZRXTTVFFBGNE-HNNXBMFYSA-N	449.552	1.959	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)c2cc(S(=O)(=O)N3CCOCC3)ccc2Cl)o1	752524391	DUWXSFBMZXMQOX-UHFFFAOYSA-N	427.866	1.337	50	20	IDGD	
C[C@H](CC(=O)NNc1ccc(C(F)(F)F)nn1)/N=C1/NS(=O)(=O)c2ccccc21	755191779	RDNLGRPAGUPKJI-SECBINFHSA-N	428.396	1.456	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)c2coc(S(=O)(=O)N(C)C)c2)cc1OC	755414989	MMBZLNRCKSNTOO-UHFFFAOYSA-N	425.463	1.402	50	20	IDGD	
CN(C)c1ccc(S(=O)(=O)N2CCCCC2)cc1NC(=O)NNC(=O)c1cccnc1	755436756	VWAUZZOVFACJES-UHFFFAOYSA-N	446.533	1.789	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)Nc1ccc2c(ccn2CC(=O)N2CCOCC2)c1	756294245	PYIFYZNTRAGKHQ-UHFFFAOYSA-N	436.472	1.291	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN(Cc2ccc(C(N)=O)cc2)C2CC2)cc1OC	756480457	FAQZJUWFULDIIO-UHFFFAOYSA-N	426.473	1.228	50	20	IDGD	
CCCC(O)(CCC)CC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	756784193	RSRSEERYGRWHRR-UHFFFAOYSA-N	425.551	1.954	50	20	IDGD	
Cc1nc(-c2ccc(C)c(NC(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)c2)n[nH]1	756872651	UQUJEQBSTYCPOO-UHFFFAOYSA-N	432.444	1.802	50	20	IDGD	
O=C(CN1C(=O)COc2cc(Br)ccc21)NNc1nc(O)c2ccccc2n1	758299947	OBJGPNRIYKMLLV-UHFFFAOYSA-N	444.245	1.967	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)C(=O)Nc1ccccn1)c1nc(-c2ccc(Cl)cc2)no1	758825693	KXSDBOHSWAQOFZ-SNVBAGLBSA-N	429.824	1.815	50	20	IDGD	
O=C(NNC(=O)[C@H]1CSCN1C(=O)c1ccc(Cl)cc1)C(=O)Nc1ccccn1	758841664	QMTYCNAIPPLVBQ-CYBMUJFWSA-N	433.877	1.036	50	20	IDGD	
COC(=O)[C@H](C)Cc1ccc(NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1	760090435	RYELXTZUIYTTQZ-CYBMUJFWSA-N	437.456	1.752	50	20	IDGD	
Cc1cccc(N2C(=O)N[C@H](CCC(=O)NNC(=O)CCNC(=O)OC(C)(C)C)C2=O)c1	760442279	HCMOFWANTZGJLZ-OAHLLOKOSA-N	447.492	1.262	50	20	IDGD	
C[C@@H](NC(=O)OC(C)(C)C)[C@H]1CN(C(=O)NNC(=O)COCc2ccccc2)CCO1	760775443	GGOHTPYAMQDWMO-NVXWUHKLSA-N	436.509	1.558	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCCC(=O)NNC(=O)NC1CCCCC1	760797634	CMSWCZYKSYCXAT-HNNXBMFYSA-N	425.530	1.555	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)Nc2ccc(CN3C(=O)CCCC3=O)cc2)c1	760957323	DOGTYIUFOWUZSP-UHFFFAOYSA-N	438.444	1.546	50	20	IDGD	
Cc1cc(S(=O)(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)cc(C(=O)O)c1F	763439817	VAWQRHXXYISVBD-UHFFFAOYSA-N	433.458	1.447	50	20	IDGD	
CC(C)(C)NC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c1	763442961	VGSJLYTXYNXPID-UHFFFAOYSA-N	427.417	1.523	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccccn2)n(-c2cccc(C(F)(F)F)c2)n1	763465087	RSQOBTXIRNLUOT-UHFFFAOYSA-N	432.362	1.994	50	20	IDGD	
O=C(NNC(=O)c1ccccc1Br)C(=O)Nc1ccc(Cn2cncn2)cc1	763484289	WCMWGXZNIXKLOJ-UHFFFAOYSA-N	443.261	1.489	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2c[nH]c3ccccc23)ccc1-n1nnnc1C(C)C	763535429	CFQIKVZVAZREJC-UHFFFAOYSA-N	446.471	1.975	50	20	IDGD	
CC(C)Cn1ncc(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1C(F)F	763570909	GXDVOLFXZGSFKT-AWEZNQCLSA-N	437.403	1.403	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)N(C)C(=O)CO3)c2ccccc2n1	763613591	AMMKXRLTRUBREO-UHFFFAOYSA-N	433.424	1.298	50	20	IDGD	
COc1cc(C(=O)N(C)C)ccc1NC(=O)C(=O)NNC(=O)COc1cc(C)ccc1C	763667917	FFHVPFIDAQYNCN-UHFFFAOYSA-N	442.472	1.179	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(NC(=O)C(C)C)cc1	763682747	VRZBBIHSXBCBSG-UHFFFAOYSA-N	442.472	1.845	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(Cl)cc1C(=O)OC	763684401	KVOWYNZQYUWEGV-UHFFFAOYSA-N	449.847	1.690	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)C(=O)Nc2cccc(Cl)c2)cc1	763739101	ZKSRETIJBPQDCX-UHFFFAOYSA-N	438.893	1.055	50	20	IDGD	
CS(=O)(=O)CCc1ccc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCC3)cc1	763784514	YQAZPVHPZLQJQB-UHFFFAOYSA-N	435.527	1.224	50	20	IDGD	
CC(C)Oc1cc(F)ccc1NC(=O)C(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	763791682	XFWZWDKFCSKSGT-UHFFFAOYSA-N	441.419	1.260	50	20	IDGD	
CCOc1cc2c(cc1[C@@H]1C[C@@H]1C(=O)NNC(=O)CNC(=O)c1cccnc1)O[C@@H](C)C2	763825421	WVLJRWFGOKTUOO-OWQGQXMQSA-N	438.484	1.485	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(C(N)=O)c(Cl)c2)c1C	763854372	PRKHEFDUENUZFK-GFCCVEGCSA-N	432.864	1.609	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1cc2c(cc1F)CCC(=O)N2	763871193	FCECJRIOFZBYOY-JTQLQIEISA-N	432.383	1.403	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)Nc1ccccc1CN1C(=O)CCC1=O	763939845	BWMAYWCNXOBFIK-UHFFFAOYSA-N	428.470	1.986	50	20	IDGD	
CCn1cnnc1-c1ccccc1NC(=O)C(=O)NNC(=O)c1cc(Br)c[nH]1	763995059	LEFFPFCDSCJZIR-UHFFFAOYSA-N	446.265	1.455	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2O1)C(=O)Nc1cc(F)ccc1OC[C@@H]1CCCO1	764166624	FDAAWFQJJCAALS-KXBFYZLASA-N	443.431	1.473	50	20	IDGD	
CCOC(=O)[C@@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)CC2CCCC2)cc1	764189194	YHWJYISUPDVCCZ-CYBMUJFWSA-N	432.477	1.034	50	20	IDGD	
CC(C)CCC(=O)NNC(=O)C(=O)Nc1cccc(CS(=O)(=O)NC(C)(C)C)c1	764202666	HIRHTJXWXASQPC-UHFFFAOYSA-N	426.539	1.427	50	20	IDGD	
Cc1cc(C(=O)N2CCCC2)ccc1NC(=O)C(=O)NNC(=O)Cn1ccc2ccccc21	764239257	IXHVIRXKZLGMHS-UHFFFAOYSA-N	447.495	1.972	50	20	IDGD	
COC(=O)[C@@H](C)Cc1ccc(NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)cc1	764239757	SFWPHVUUTOYWBS-HNNXBMFYSA-N	436.468	1.779	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2O)ccc1OC1CCOCC1	764275742	SVSREVHQLZMXFM-UHFFFAOYSA-N	443.456	1.423	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)Cc2cc[nH]n2)sc2c1CCCS2	764286320	RSJKHFLLTCDUCX-UHFFFAOYSA-N	437.503	1.015	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)C(C)(C)c2ccccc2)cc1NS(C)(=O)=O	764313641	MUWNVQWWYFWZRG-UHFFFAOYSA-N	432.502	1.430	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(\C#N)C(=O)NNC(=O)CNC(=O)c2cccnc2)c1C	764344211	UZQUTZFFUJHTJM-OMPOGXFXSA-N	438.488	1.192	50	20	IDGD	
C[C@@H]1COCCN1c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)cc1	764346131	UKGIRMFFWGJAAA-GFCCVEGCSA-N	432.864	1.670	50	20	IDGD	
CCC(C)(C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)COCc2ccccc2)cc1	764363169	LHHWRJJYSUVQQP-UHFFFAOYSA-N	440.500	1.908	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)Nc1ccc2c(c1)OCCO2	765312537	IMSMTZRUTBEAHN-UHFFFAOYSA-N	439.472	1.069	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)CNC(=O)CC3CCCC3)n[nH]2)cc1OC	765596273	IJPLNVKZHQAAQF-UHFFFAOYSA-N	429.477	1.551	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1cc2ccccc2nc1O	765735364	KXXGFLIYVDIHMU-UHFFFAOYSA-N	433.468	1.159	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NN=C[C@H](C)CCC#N)N(S(C)(=O)=O)CC2	766000955	BSWWEVZYDJSMMT-PBHICJAKSA-N	436.534	1.995	50	20	IDGD	
O=C(CCOC1CCOCC1)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	766660591	NZZBFHBZRKBDJY-UHFFFAOYSA-N	438.956	1.191	50	20	IDGD	
CC(=O)c1ccc(N2CCN(CC(=O)NNC(=O)Cc3ccccc3C)CC2)c(F)c1	766838031	FNBVGTCJZZJCOF-UHFFFAOYSA-N	426.492	1.849	50	20	IDGD	
O=C(Cc1cc(F)c(F)cc1F)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	767804540	WCIZTADWEHEDAM-UHFFFAOYSA-N	441.431	1.892	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CN2C(=O)N[C@@]3(CCCC(C)(C)C3)C2=O)cc1C	768571907	YMIOZEAOCLPDSQ-JOCHJYFZSA-N	443.504	1.280	50	20	IDGD	
CCOc1ccc(NC(=O)NNC(=O)C(C)(C)C)cc1S(=O)(=O)N1CCOCC1	769943570	TXSAJITUYKNXES-UHFFFAOYSA-N	428.511	1.305	50	20	IDGD	
Cn1ccnc1[C@@H](O)[C@@H]1CCCN(C(=O)NNC(=O)c2cccc(Br)c2)C1	770017479	ACVRCLDRATZLCE-HIFRSBDPSA-N	436.310	1.983	50	20	IDGD	
COc1ccc([C@@H](CNC(=O)NNc2nc(O)c3cnn(C)c3n2)N(C)C)cc1OC	770336092	NIYKEEWNIXHVHH-CYBMUJFWSA-N	430.469	1.015	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)Nc1ccnn1[C@@H]1CCS(=O)(=O)C1	770759244	NPDCZDOXTIEQRR-DGCLKSJQSA-N	441.897	1.516	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)CCCCOc3ccc(S(C)(=O)=O)cc3)nc21	770974231	KIAXRAWHAHOODU-UHFFFAOYSA-N	434.478	1.165	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)c1cc(S(C)(=O)=O)ccc1Br	772086177	BOMPRHPGGAZSNQ-JTQLQIEISA-N	449.323	1.591	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)[C@H]1C[C@H]1c1ccc2c(c1)OCCO2	772194768	DJEUTTUVOHMOJU-HOTGVXAUSA-N	429.860	1.679	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1cnn([C@@H]2CCCN(C(=O)OC(C)(C)C)C2)c1	772300795	NWCNZFQRLKZCLN-DZGCQCFKSA-N	437.497	1.558	50	20	IDGD	
CC(C)[C@H](C(=O)NNC(=O)Cc1nc(-c2ccccc2)cs1)N1CCCS1(=O)=O	772632413	ZDBVPJWRBKTZKS-GOSISDBHSA-N	436.559	1.560	50	20	IDGD	
COC(=O)COc1ccc(S(=O)(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)cc1	773263097	DQOKBKMUKWLOPC-LBPRGKRZSA-N	442.877	1.669	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)C(=O)N2C[C@H](C(=O)N3CCCCC3)Oc3ccccc32)n1	773481616	UWTDIYPWBQZSGX-GOSISDBHSA-N	438.488	1.343	50	20	IDGD	
CN(c1ccccc1)S(=O)(=O)c1cccc(NC(=O)C(=O)NNc2ncccn2)c1	773721641	QZCRCGQZCNIYAC-UHFFFAOYSA-N	426.458	1.384	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2ccc(C(=O)N3CCCC[C@@H]3C)cc2C)n1	773725976	DFPAGVRCGAEUJF-AWEZNQCLSA-N	426.477	1.890	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)c1cnc2sc(C)c(C)n2c1=O	775951015	HGEFAYBWXBPCKY-UHFFFAOYSA-N	428.470	1.228	50	20	IDGD	
O=C(CN1CCN(Cc2ccc3c(c2)OCCO3)CC1)NNC(=O)c1cccc(Cl)c1	776249046	RJDWGHVVVZCUGT-UHFFFAOYSA-N	444.919	1.690	50	20	IDGD	
CCOC(=O)N1CCC[C@H]([C@@H](C)NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)C1	777266146	NWODYCHQJZMUDP-KGLIPLIRSA-N	444.492	1.135	50	20	IDGD	
COc1ccc(N2CCN(C(=O)/C=C\C(=O)NNC(=O)c3cccc(C#N)c3)CC2)cc1	778261806	LVYDBHNHPXYJBL-KTKRTIGZSA-N	433.468	1.233	50	20	IDGD	
Cc1c(C(=O)NNC(=O)CNC(=O)OC(C)(C)C)nnn1-c1ccc(OC(F)F)cc1	778437919	HDHVICKLQQSNMV-UHFFFAOYSA-N	440.407	1.463	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)c2c(C)nn(C)c2-n2cccn2)c1	778708042	ZUKIHUKICJRWJM-UHFFFAOYSA-N	433.266	1.760	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)N[C@H]2CCCOc3c(F)cccc32)c2ccccc2c1=O	779399232	MOOWOAHHPHQAJM-INIZCTEOSA-N	425.420	1.931	50	20	IDGD	
CCCn1c(CCC(=O)NNc2ccc(OC)cn2)nc2cc(S(N)(=O)=O)ccc21	781518629	IUCVXFHTXAOVRK-UHFFFAOYSA-N	432.506	1.573	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)n([C@H]2C[C@H]3CC[C@H]2C3)n1	782894163	NNTPKIIKSGIULW-MPGHIAIKSA-N	449.515	1.768	50	20	IDGD	
CN1C(=O)c2ccc(NC(=O)C(=O)NNC(=O)c3ccc(Cl)cc3Cl)cc2C1=O	782926442	TWSVWSAZWBKEGE-UHFFFAOYSA-N	435.223	1.619	50	20	IDGD	
COC(=O)[C@H]1CN(C(=O)C(=O)NN=c2sc3ccccc3n2C)c2ccccc2O1	783351983	RCPGHGXIEUFNCD-OAHLLOKOSA-N	426.454	1.139	50	20	IDGD	
CCOCCOc1ccc(Cl)cc1NC(=O)C(=O)NNc1ccc(-n2cccn2)nn1	783435935	CYLVEZQDMXKWIG-UHFFFAOYSA-N	445.867	1.813	50	20	IDGD	
COc1ccc(C(=O)N2CCCC2)cc1NC(=O)C(=O)NNc1cccc([N+](=O)[O-])c1	784833328	IOZGTEAHAYXZCF-UHFFFAOYSA-N	427.417	1.921	50	20	IDGD	
CCC[C@@H]1CCc2nc(NC(=O)C(=O)NNC(=O)[C@H]3COc4ccccc4O3)sc2C1	789731595	FZBHGRDNTMYBFA-MLGOLLRUSA-N	444.513	1.974	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)CC(=O)N3C)cc1OC	789740946	LDISCDZMPZMYQE-UHFFFAOYSA-N	426.429	1.013	50	20	IDGD	
COc1cccc(NNC(=O)[C@@H]2CC(=O)C[C@@H](C)[C@H]2C(=O)NNc2cccc(OC)n2)n1	791141827	XHNYWNVSHLFBKG-BBEGDGIKSA-N	442.476	1.312	50	20	IDGD	
COc1ccc(C(=O)CCC(=O)N([C@H]2CCS(=O)(=O)C2)N(C)C)c(OC)c1OC	792853059	CDXNXGVYBOPPHL-ZDUSSCGKSA-N	428.507	1.168	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cc(C(C)(C)C)nn2-c2ccc(C#N)cc2)n[nH]1	793026362	QKJDCUUNPKDYDC-UHFFFAOYSA-N	434.460	1.473	50	20	IDGD	
COc1c(NC(=O)C(=O)NNC(=O)CCOc2ccccc2)cc(Cl)cc1C(N)=O	793026407	QMAIUCBFWIXEDY-UHFFFAOYSA-N	434.836	1.003	50	20	IDGD	
Cn1ccnc(NNC(=O)C(=O)Nc2cc(C(C)(C)C)nn2-c2ccc(C#N)cc2)c1=O	793049650	HAYGKHMVQZALRR-UHFFFAOYSA-N	434.460	1.217	50	20	IDGD	
COC(=O)/C=C\c1cc(OC)c(OC)c(S(=O)(=O)NNC(=O)c2cccc(C)n2)c1	794601003	MZHABXKIMINEJE-HJWRWDBZSA-N	435.458	1.217	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NN=Cc2ccc(O[C@@H](C)C(=O)O)cc2)cc1	794872030	RWYFRINXULABPW-HNNXBMFYSA-N	433.486	1.618	50	20	IDGD	
COC(=O)Cn1ncc(NC(=O)C(=O)NNc2nc3cc(Cl)ccc3cc2C)c1C	797099722	QZXVYXVPPNWMEG-UHFFFAOYSA-N	430.852	1.956	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CCc2c(C)nc3[nH]n(C)c(=O)c3c2C)cc1C	798310464	YYGSZVKKBIMORL-UHFFFAOYSA-N	438.488	1.214	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)N1CCC(CNC(=O)C(F)(F)F)CC1	798530808	UNWZBMONGYQJPH-UHFFFAOYSA-N	425.411	1.773	50	20	IDGD	
CCCCNS(=O)(=O)c1ccc(C)c(NC(=O)C(=O)NNC(=O)c2ncccc2C)c1	799835626	WKUPYLRTWKBTLB-UHFFFAOYSA-N	447.517	1.177	50	20	IDGD	
C[C@H](c1ccc(S(N)(=O)=O)cc1)N(C)C(=O)NNC(=O)c1cnn(-c2ccccc2)c1	799927274	XOSVAXQWUZAWMB-CQSZACIVSA-N	442.501	1.567	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2cccc(CN3CCOCC3)c2)cc1	802066335	URCDHIKSOVLBDE-UHFFFAOYSA-N	432.502	1.389	50	20	IDGD	
CC(C)NS(=O)(=O)Cc1ccccc1CNC(=O)NNc1ccc(-n2ccnc2)nn1	804870113	PVXKKBQWLFQUIQ-UHFFFAOYSA-N	444.521	1.316	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)[C@H]2CCCN2C(=O)C(F)(F)F)c1	806786175	ZCOASCQIJXUBDI-LLVKDONJSA-N	438.200	1.772	50	20	IDGD	
Cc1cc(Cl)ccc1OCCCC(=O)NNC(=O)C(=O)Nc1cccc2c1CNC2=O	806972724	IZITXFMUIRIABY-UHFFFAOYSA-N	444.875	1.837	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1	807368394	CVVSPGMSTZQAOA-LLVKDONJSA-N	428.467	1.198	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)N1CCN([C@@H]2CCN(C(=O)OC(C)(C)C)C2)CC1	808268622	UMIPOEOEYCINIH-MRXNPFEDSA-N	447.536	1.677	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc3c2COC3=O)cc1Br	808935117	JSPNYJDNOPKLSC-UHFFFAOYSA-N	448.229	1.528	50	20	IDGD	
Cc1c(Cl)c(C(F)(F)F)nn1CC(=O)NNC(=O)c1nnc(O)c2ccccc12	809933124	RSYBPIDLPKEELK-UHFFFAOYSA-N	428.758	1.974	50	20	IDGD	
O=C1CC(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)(c2ccccc2)C1	809957768	XSJSNUTZAOMOQS-UHFFFAOYSA-N	441.509	1.533	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)Nc2ccc(C(N)=O)cc2OCC(F)F)c1	810306030	FIHCXSADEGDPEJ-UHFFFAOYSA-N	436.375	1.249	50	20	IDGD	
C[C@@H](NC(=O)c1n[nH]c2ccccc12)C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	812732802	BFMXVUNJGASHIT-GFCCVEGCSA-N	430.490	1.075	50	20	IDGD	
O=C(NNC(=O)c1c[nH]c(C(F)(F)F)c1)c1cccc(S(=O)(=O)N2CCCC2)c1	814105667	IHRATDGMCZCOCQ-UHFFFAOYSA-N	430.408	1.893	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN[C@@H](C)c2ccc(N3CCCOC3=O)cc2)n1	814657406	DEIZXNBUEYSDGK-AWEZNQCLSA-N	431.518	1.839	50	20	IDGD	
COC(=O)c1cnn(C)c1NC(=O)C(=O)NNC(=O)c1ccc(OCCC(C)C)cc1	815565891	CVENJCOWPFJWAP-UHFFFAOYSA-N	431.449	1.031	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(OC)c(C)c(OC)c2)o1	815568628	OSJZICFFBXTDMR-UHFFFAOYSA-N	432.477	1.847	50	20	IDGD	
COC(=O)N1CCN(c2ccc(NC(=O)C(=O)NNc3cc(C)cc(C)c3)cn2)CC1	815588823	ZZOSKGDELQOOHN-UHFFFAOYSA-N	426.477	1.669	50	20	IDGD	
C[C@H]1Cc2c[nH]nc2[C@@H](C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)C1	816829934	JYNITXFPNPLPQO-GUYCJALGSA-N	431.518	1.321	50	20	IDGD	
O=C(CNc1ccccc1)NNC(=O)c1ccc(S(=O)(=O)NCc2ccco2)cc1	823328608	PHQUONWTXWHEPS-UHFFFAOYSA-N	428.470	1.631	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)c2ccc3c(c2)C[C@H](C)N3S(C)(=O)=O)cc1	825542399	MSPKWUIXXSXDTJ-ZDUSSCGKSA-N	432.502	1.279	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)c2ccc(COc3ccccc3)o2)o1	914846811	UTUXCSGGPPAKIC-UHFFFAOYSA-N	433.442	1.777	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)CS(=O)(=O)CC(C)C)c2ccccc2c1=O	915688990	BGSOIPDWSPYWSU-UHFFFAOYSA-N	436.534	1.419	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)NC[C@H](C(C)C)N2CCN(C)CC2)cc1	916258257	PVPYMBZZMWHTIJ-FXAWDEMLSA-N	435.569	1.455	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)NCc2ccc(N3CCO[C@H](C)C3)nc2)cc1C	916393025	QSCFODXVPZVMPQ-MRXNPFEDSA-N	440.504	1.393	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)NCc2ccc(-n3cncn3)nc2)cc1OC	916395082	AVEXKZLQKFNOAP-UHFFFAOYSA-N	439.476	1.994	50	20	IDGD	
Cc1cccc(NC(=O)[C@H]2CCCN(CC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)C2)n1	917400211	JKYDLQKEUGVNKN-INIZCTEOSA-N	440.460	1.410	50	20	IDGD	
C[C@H](Sc1nncn1C)C(=O)NNC(=O)[C@@H](C)Oc1cccc(Br)c1	917921830	DOKXDWIWWDOXHM-ZJUUUORDSA-N	428.312	1.673	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)N[C@H](C)c1ccc(S(=O)(=O)N(C)C)cc1	918103933	FSDCAQZYLFZIAA-CYBMUJFWSA-N	444.517	1.598	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(F)cc2)C1	919820504	JIVNJEZUTGWVNL-MRXNPFEDSA-N	449.504	1.625	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)N[C@@H]2CCCN(S(C)(=O)=O)C2)c(C)n1C[C@@H]1CCCO1	920292072	LPSDMOATFQKZJO-BXWLARMLSA-N	434.562	1.731	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)[C@H](C(C)C)n2nnc(-c3ccccc3)n2)cc1	920584781	QENXLOTVUJEAJZ-IBGZPJMESA-N	436.472	1.850	50	20	IDGD	
C=CCNC(=S)NNC(=O)c1cc(S(=O)(=O)NC2CC2)ccc1Br	921159852	VQNUESCVZBQGAY-UHFFFAOYSA-N	433.353	1.185	50	20	IDGD	
Cc1ccc([N+](=O)[O-])cc1C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	921301065	MHWUFFONXXHZCV-UHFFFAOYSA-N	432.458	1.763	50	20	IDGD	
COC(=O)c1cc(C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)n(-c2ccccc2)n1	1115977086	FBYQQKAOTVQMBE-UHFFFAOYSA-N	442.453	1.137	50	20	IDGD	
O=C(CCC(=O)N1CCN(c2ccccn2)CC1)NNc1cncc(Br)c1	1116394387	WOEFWMPKPJHXBS-UHFFFAOYSA-N	433.310	1.811	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN(C(=O)CCOc2ccccc2)C1)c1n[nH]c2c1CCCC2	1317953113	HWFTXNNBHYONTH-INIZCTEOSA-N	439.516	1.757	50	20	IDGD	
Cc1cc(C)nc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C3)c1	1777749683	RHQVKXICDYEOOH-AUSIDOKSSA-N	445.564	1.199	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2noc3c2CCCC3)C1	1777866936	AQLNOPBTIZKVPY-QLVMHMETSA-N	439.940	1.935	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4nccnc4c3)C2)C1	1777980988	PADDQYABXJDIKK-ORAYPTAESA-N	433.306	1.857	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1cncnc1)C2)[C@H](F)Br	1780770858	GVWQGIHMJZIWQY-UKPHBRMFSA-N	429.290	1.224	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)COC(=O)C(F)(F)F)CCO2)C1	1781230088	MVJXFAONHAAOGX-ZIAGYGMSSA-N	435.226	1.158	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(-n4cccn4)cc3)C2)C1	1781719923	WXDKHIXKQJZBIN-GHTZIAJQSA-N	432.908	1.570	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1cncnc1)C2	1781900875	HDMJTFBRASOTAO-FRQCXROJSA-N	439.354	1.707	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(OC)nc3)CCO2)C1	1783344474	TVHWMEVJIAZGKX-KDOFPFPSSA-N	426.311	1.707	50	20	IDGD	
CCOC(CC(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](Br)CC)C2)C1)OCC	1783355920	ZWKOQZQUPSLPFO-KSSFIOAISA-N	435.359	1.779	50	20	IDGD	
COC(=O)C12CC(C(=O)N3CC[C@]4(CN(C(=O)[C@@H](C)CBr)CCO4)C3)(C1)C2	1783440210	AFXMAKAQXFYAOP-KSBHDHOUSA-N	443.338	1.191	50	20	IDGD	
CN1Cc2ccccc2C[C@@H]1C(=O)N1CCO[C@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783942390	NMVUMZVGCKTYAC-UZLBHIALSA-N	426.344	1.677	50	20	IDGD	
COc1cc(C)c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]3C2)cc1OC	1784092154	HXBFBXIVQQYGKY-AMVTXUCVSA-N	440.924	1.205	50	20	IDGD	
C[C@@H](Nc1cccnc1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CO[Si](C)(C)C)C[C@@H]21	1786862258	KPMNZWWPNPEKHZ-NEPXVJNWSA-N	434.613	1.713	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Cl)C[C@@H]21)C1CC1	1787440822	PHLXORMEXLLPEY-UVPYHEFZSA-N	447.935	1.804	50	20	IDGD	
Cn1ncc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Br)C[C@@H]32)c1Cl	1789084394	OYHDCPGMRDSCCF-PDEGPIFNSA-N	437.697	1.357	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](CN)c3ccccc3)C[C@@H]21	1789865674	BDCZMBJIIGWSQI-SOADLSRISA-N	442.387	1.945	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(C)n(CC)n3)C[C@@H]21	1790961064	WEFQNYVUHXBDCG-MPTYRVRUSA-N	441.370	1.978	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3n[nH]c4c(F)cccc34)C[C@@H]21	1791253832	HIEQBTHSYNJJPF-ZIEJDFEHSA-N	438.887	1.549	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3ccsc3)C[C@@H]21	1791289010	AXQMEEVNYNQITD-BZSNNMDCSA-N	436.578	1.033	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C#Cc1ccc(Cl)cc1)c1ccc(B(O)O)cc1	1792942355	GEZHLMNVDPDQAJ-WKCHPHFGSA-N	436.704	1.323	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)c1cccc(Br)c1)C2)[C@@H](F)Cl	1796367712	QUGKSUKYTQDGLA-OBRUSBNWSA-N	449.704	1.607	50	20	IDGD	
COc1ccc(-c2cc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)[C@@H](O)CCl)C4)n[nH]2)cc1	1796950171	IPZJDMPPVNXRBO-YGTYGHESSA-N	432.908	1.937	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(Cl)ncn1	1798308728	CFASUGFUFYCNNM-FBKDDSFISA-N	431.718	1.507	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1nccc3[nH]ccc13)C2	1798440273	KEQOLAZWWPJHHY-BTTYYORXSA-N	433.472	1.127	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc3c1OCCO3)C2	1799274849	DETICAAKJWCDPZ-XBMZAUBUSA-N	443.327	1.897	50	20	IDGD	
CCOc1c(F)cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](O)CCl)C3)cc1Cl	1799677026	KFMCHEQGNTYERZ-NOXHYTERSA-N	449.306	1.681	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3[nH]ccc3n1)C2	1800641323	YOPJNBNRRXGMOU-LKQDWFRTSA-N	435.322	1.940	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(Cl)cc3nn[nH]c13)C2	1800978392	CIVCKFPWIVTKCV-YJKIEOBBSA-N	442.303	1.068	50	20	IDGD	
CC[C@@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](O)NC(=O)OC(C)(C)C)C2	1801803809	NULOMFOGYGSKRV-OKWIKPQFSA-N	448.358	1.641	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc3c(c1)CCCO3)C2	1802339820	NRUXBGNCYHVYQK-REPLKXPHSA-N	428.533	1.636	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](C)n1ccnc1C	1803123355	IGMDQRKPEYHFQW-ILMZPKKMSA-N	439.520	1.525	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CSc2ncccn2)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803137929	FDFRLMYRIUKZEF-YQQAZPJKSA-N	435.937	1.269	50	20	IDGD	
Cn1cc2cc(C(=O)N3CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]3c3cccnc3)ccc2n1	1803148510	RIZDQYJJDODDBB-NSISKUIASA-N	441.919	1.888	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2c(F)c(C)nn2C)[C@H]1c1cccnc1	1805150561	QLKYYOXUGZVITN-YQQAZPJKSA-N	437.903	1.836	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H](CNC(=O)c2ccc(O)nn2)[C@H]1c1cccnc1	1805268322	KADNDJFQPDZELM-DNVCBOLYSA-N	429.553	1.748	50	20	IDGD	
O=C(COCc1ccccc1)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1	1806874387	PUWQUQPVEOMVEC-IRFCIJBXSA-N	431.920	1.904	50	20	IDGD	
CC1(C)CC(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)C1	1807363791	BPIKKJJQZQBVKS-WIYYLYMNSA-N	435.333	1.517	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CC2CCCC2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1	1807371562	WZEHDWOOKWAIJA-NZQKXSOJSA-N	435.333	1.661	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)[C@H](O)N2CCOCC2)[C@@H]1c1cccnc1	1810349919	VJWJQVIAXGUXTB-WKRCXCSHSA-N	438.956	1.146	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1ccccc1F	1811673390	NGQBHNPMJDZQOS-AVRDEDQJSA-N	447.275	1.534	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)c2ccc(O)nn2)[C@H]1c1cccnc1	1812865621	XKVBTQOXAAZOJE-GHJWDPDVSA-N	434.294	1.680	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1	1813030534	IZMGQTIBTBBFSR-XUWXXGDYSA-N	434.880	1.461	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](O)CCl)CC2)c1ccc2c(n1)OCCO2	1816951824	DBLLDLVDCQOEGW-CABZTGNLSA-N	438.893	1.135	50	20	IDGD	
Cc1cc2nnc(C(=O)Nc3cc([C@@H]4CCCCN4C(=O)[C@H](O)CCl)[nH]n3)c(C)n2n1	1818587935	LWKDOGXHXZVGST-UONOGXRCSA-N	446.899	1.370	50	20	IDGD	
CC(C)(C)NCC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819402187	SUWUGVZJBDZHRT-INIZCTEOSA-N	442.524	1.102	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2CCCS2)[nH]n1	1819404424	KEIDTDYONKNHGU-HOTGVXAUSA-N	443.533	1.610	50	20	IDGD	
CC(=O)OC[C@H](OC(C)=O)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](F)Cl)CC2	1819855380	JKUZHRRJHIRHCO-GAFUQQFSSA-N	435.861	1.084	50	20	IDGD	
C[C@H](Br)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H]2CCCS2(=O)=O)[nH]n1	1822188446	JOZKJODDYHCERF-UHTWSYAYSA-N	447.355	1.762	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(F)c[nH]2)n[nH]1	1822238873	ZXQFCDKKNKTSKM-INIZCTEOSA-N	440.439	1.495	50	20	IDGD	
CCOC(=O)/C=C/C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1	1823003754	NVIVWSBPXYKJDE-MRIIINAHSA-N	434.287	1.865	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](O)NC(=O)OC(C)(C)C)sc2C1	1823572401	XSVMKXHFXLZPTF-AMJWSMQMSA-N	446.957	1.916	50	20	IDGD	
C=CCNC(=O)/C=C\C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H](Cl)COC)CC1	1823749406	NPEOKNGKDKGOQO-BTFXCVNISA-N	425.957	1.718	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)[C@H]2CCCCO2)CC1	1823818108	KXDHOIIGJDWXIA-NHCUHLMSSA-N	428.338	1.169	50	20	IDGD	
CC1CCN(CC(=O)N2CCCC[C@@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1	1824367023	ZUQWERUORLORJJ-OAQYLSRUSA-N	449.640	1.711	50	20	IDGD	
CC[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ncnn1C)CC2	1825444791	BVPTWBNHLKWRJK-RKDXNWHRSA-N	427.328	1.671	50	20	IDGD	
CC[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CN1CCNC1=N)CC2	1825447253	UJUUPFFHHCAQKN-NXEZZACHSA-N	443.371	1.069	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCC(=O)NN(C)C)CC2	1825647872	VYCYABDHFFYSDD-NXEZZACHSA-N	446.371	1.212	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H](N)c2ccccn2)CC1	1826917978	VKPCNJDXILBRGF-SIKLNZKXSA-N	444.580	1.074	50	20	IDGD	
Cc1cc(C)nc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)c1	1827317732	QBKOREKINOEQGA-HSZRJFAPSA-N	449.360	1.925	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H](N)Cc2cscn2)CC1	1827549840	KCOUIQHCMFOKBF-OKZBNKHCSA-N	443.013	1.886	50	20	IDGD	
CCOc1ncccc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](Cl)CC)C2)C1	1829542477	ZKRMPHUBFODQBL-OXJNMPFZSA-N	425.913	1.568	50	20	IDGD	
O=C(c1cc(=O)c2ccccc2o1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1830310088	QMIBBNMEOXIYIU-XLIONFOSSA-N	438.839	1.397	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)CN(CC)CC)C2)C1	1831657072	LEJCDKAWYIJPHJ-LVCYWYKZSA-N	432.005	1.828	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1)[C@H](O)c1ccco1	1833088722	XBGHRPAPBFGZQG-HZPDHXFCSA-N	446.317	1.575	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)nc1C	1833693145	CQPZVPOKOAXTIJ-YJBOKZPZSA-N	444.301	1.459	50	20	IDGD	
O=C(c1ccnc(C(F)(F)F)c1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1833794813	QSZMEJRDBKOXKO-XJKSGUPXSA-N	439.793	1.705	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cncc(F)c1)CCO2	1834357132	FUNMZTNMWMXBPW-IBGZPJMESA-N	425.533	1.142	50	20	IDGD	
Nc1ncc(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](F)Br)CC3)CC2)s1	1834768041	YSLMZGZEGBAYCE-CYBMUJFWSA-N	448.362	1.601	50	20	IDGD	
O=C(c1ccc2nccnc2c1)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836717353	USJJBDNKYJFZCJ-FQEVSTJZSA-N	446.935	1.842	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnc4snnc4c3)CCO2)C1	1838510043	VOCGNUWVQUDXJW-ACJLOTCBSA-N	439.925	1.174	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cc(=O)ccn3C)CC2)CC1	1838529466	JOHBBZSMFMAFAV-SFHVURJKSA-N	439.940	1.251	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCC(OC2CCN(C(=O)[C@H]3CNC(=O)C3)CC2)CC1	1838639038	SOQHUWXQUAHEQI-YJYMSZOUSA-N	434.364	1.357	50	20	IDGD	
CCOc1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](Cl)COC)C3)C2)c1	1839020224	QYDKTCYZHGZGOK-RXVVDRJESA-N	440.924	1.409	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(=O)c4ccccc4o3)C2)C1	1839141588	NBVDROMTSDTBAN-AOMKIAJQSA-N	448.903	1.880	50	20	IDGD	
C=CCOCCCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2	1839150481	NTXKYFLIDMCQHB-OALUTQOASA-N	437.364	1.662	50	20	IDGD	
O=C(c1ccc(Cl)o1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839200051	BCMZXHDAIDHZAD-IUODEOHRSA-N	439.665	1.694	50	20	IDGD	
Cc1ccc(F)cc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2	1840030659	RSZGTWPMYHSBMF-KUHUBIRLSA-N	443.313	1.988	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)cnc1C	1840031476	RJWXLYPMZGNQEA-LIRRHRJNSA-N	440.338	1.552	50	20	IDGD	
O=C(/C=C/c1ccc([N+](=O)[O-])o1)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840186898	RANYLJXKYJQVNJ-XKKXFUJGSA-N	448.259	1.461	50	20	IDGD	
CCc1nn(C)c(C(=O)N2CC3(CCCN3C(=O)[C@H](O)CCl)C2)c1Br	1841350487	GANDTJYDOKYUDC-LLVKDONJSA-N	433.734	1.162	50	20	IDGD	
CCOC(=O)/C=C/C(=O)N1CCCC12CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1842625146	YLROWLLQJSCBGV-NPQIQWPPSA-N	443.928	1.441	50	20	IDGD	
O=C(c1ccc(OC(F)F)cc1)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843011999	SHELDBATBRRUBN-UHFFFAOYSA-N	430.216	1.099	50	20	IDGD	
Cc1noc(-c2ccccc2)c1C(=O)N1CCCC12CN(C(=O)c1cccc(B(O)O)c1)C2	1843439431	LUSKQAMVBLFGSV-UHFFFAOYSA-N	445.284	1.461	50	20	IDGD	
Cc1cc2nnc(C(=O)N3CCCC34CN(C(=O)[C@](C)(Cl)CCl)C4)c(C)n2n1	1843698108	FUNAOIUXCSWWRT-QGZVFWFLSA-N	425.320	1.794	50	20	IDGD	
Cn1c(=O)c(C(=O)N2CCCC23CN(C(=O)[C@](C)(Cl)CCl)C3)nc2ccccc21	1843744398	XGOGHVBGGLDLFE-LJQANCHMSA-N	437.327	1.987	50	20	IDGD	
Cc1ccc(S/C=C/C(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)cc1	1844233272	ICMHRFRAWQJXKE-JLHYYAGUSA-N	436.342	1.798	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)c2ccc(Br)cn2)C1	1844425417	WKYQNLNSDPKKCY-UHFFFAOYSA-N	438.326	1.034	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1O)C2	1845166229	ITEZGFNCKVWQDS-ILXRZTDVSA-N	429.945	1.435	50	20	IDGD	
CC(=O)N[C@@H](C(=O)N1CC2(CCCN2C(=O)[C@@H](C)Br)C1)c1ccc(F)cc1	1846178297	PBYTWBGMWWMVHR-MLGOLLRUSA-N	440.313	1.990	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)c1cc(Br)cs1)C2	1846384810	LEINWYJGXOLVRH-UHFFFAOYSA-N	443.367	1.701	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@](O)(C(=O)N2CCCC23CN(C(=O)C(Cl)Cl)C3)C1	1846412510	LHDHNZWEMGHWQW-GOSISDBHSA-N	436.336	1.365	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)c2ccc(S(C)(=O)=O)c(F)c2)C1	1846894637	RWLRJPMXACHXCI-ZDUSSCGKSA-N	432.901	1.300	50	20	IDGD	
CN(CC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)C(C)(C)CCl)NC(=O)NCc1ccccc1	1847438105	JHRGMMGSUMDYHM-ROUUACIJSA-N	449.983	1.799	50	20	IDGD	
C[C@@H](CC(N)=O)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](Br)Cc1ccccc1	1847859260	YAZQSMMDXIPBGF-HJWJTTGWSA-N	436.350	1.706	50	20	IDGD	
CSCC[C@@H](NC(=O)c1ccco1)C(=O)NNC(=S)NCCc1cccs1	11515346	DWLKXKINCVJXKY-CYBMUJFWSA-N	426.589	1.931	50	20	IDGD	
COc1cc(C(=O)NNC(=S)NCCc2cccs2)cc(Cl)c1OCC(N)=O	11523841	DJOKSQPWMNSYTR-UHFFFAOYSA-N	442.950	1.626	50	20	IDGD	
O=C(Cn1nnc(-c2cccc(C(F)(F)F)c2)n1)NNC(=O)c1ccc([N+](=O)[O-])cc1	17634184	PVCRXBYJSSGPEB-UHFFFAOYSA-N	435.322	1.728	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccccc1)c1ccc2c(c1)OCO2	26963773	WBLNTNFSZZVVMI-INIZCTEOSA-N	431.470	1.420	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@@H](NC(=O)c2ccc(C)cc2)C(C)C)c2ccccc2c1=O	28580369	HTNUCXHYMBQLGC-IBGZPJMESA-N	449.511	1.940	50	20	IDGD	
Cc1nc2n(n1)C[C@H](NC(=O)NNC(=O)COc1ccccc1Cc1ccccc1)CC2	727228658	HZTJKEGMKXIVPV-LJQANCHMSA-N	434.500	1.902	50	20	IDGD	
C#CCNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2c(Cl)cccc2Cl)cc1	727804678	NFJOJCRGNLSWOL-UHFFFAOYSA-N	426.281	1.980	50	20	IDGD	
N#Cc1ccc(N2CCC[C@H]2C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1	728170839	SEOBJOKJSUJCNP-INIZCTEOSA-N	447.904	1.289	50	20	IDGD	
N#Cc1ccc(C(=O)NNS(=O)(=O)c2ccc(Br)cc2[N+](=O)[O-])cc1	728506211	FSRNUIQHIYNIQQ-UHFFFAOYSA-N	425.220	1.852	50	20	IDGD	
COc1cc([N+](=O)[O-])c(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1SC	728513353	YHCDAWBUEWRZLB-UHFFFAOYSA-N	429.418	1.376	50	20	IDGD	
O=C(Cc1cc[nH]n1)NNC(=O)c1cccc(S(=O)(=O)N2CCc3sccc3C2)c1	730102930	SOCXIBRHBIZEQH-UHFFFAOYSA-N	445.526	1.222	50	20	IDGD	
CCS(=O)(=O)N(C)C1CCN(C(=O)/C(C#N)=C\c2cc(C)n(CCOC)c2C)CC1	731347604	GBYMHBNMQVJASM-RGEXLXHISA-N	436.578	1.931	50	20	IDGD	
Cn1c(N)c(C(=O)/C(C#N)=C/c2cccc(OCc3ccccc3C#N)c2)c(=O)n(C)c1=O	731352192	RLNGSBFFEZNZKW-VCHYOVAHSA-N	441.447	1.907	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)c2nn(-c3ccc(F)cc3)ccc2=O)cc1	731571821	DQLCLJCGAKBHFE-CQSZACIVSA-N	440.431	1.999	50	20	IDGD	
COC(=O)c1sccc1S(=O)(=O)NNC(=O)c1ccc(OC)c(Br)c1	732048846	UEVSOIMVKHMBQB-UHFFFAOYSA-N	449.304	1.929	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCCNc2ncccc2C#N)cc1Br	732255320	CRSWLRCWLFLJOZ-UHFFFAOYSA-N	433.266	1.780	50	20	IDGD	
Cc1cc(-c2noc(CCC(=O)NNC(=O)CCN3C[C@@H](C)O[C@H](C)C3)n2)ccc1F	732262481	UHDLGPRXWYYKRW-HUUCEWRRSA-N	433.484	1.763	50	20	IDGD	
CN(C)c1ncc(Br)cc1C(=O)NNC(=O)CNC(=O)c1cccs1	733219423	MPSKCGRKBSNDSD-UHFFFAOYSA-N	426.296	1.163	50	20	IDGD	
CN(C)C(=O)C1(CNC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)CCCC1	733658989	PWAAKUAWZSKKCR-UHFFFAOYSA-N	444.580	1.178	50	20	IDGD	
C[C@H]1Oc2ccccc2N(CCC(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)C1=O	734240339	OOMSAGBHPHPBPB-CYBMUJFWSA-N	435.481	1.046	50	20	IDGD	
CCc1ccc(C(=O)NNc2nccnc2Cl)cc1S(=O)(=O)N1CCOCC1	734260716	HJGRKIIHCNBISI-UHFFFAOYSA-N	425.898	1.470	50	20	IDGD	
Cc1cc(C(=O)NNS(=O)(=O)c2ccc(CS(C)(=O)=O)cc2)c2ccccc2n1	734806994	PNHBAPMVPQSJNG-UHFFFAOYSA-N	433.511	1.711	50	20	IDGD	
C[C@@H]1OC(C)(C)N(C(=O)OC(C)(C)C)[C@H]1C(=O)NNC(=O)[C@@H]1COc2ccccc2O1	735837511	OYLXUCAJUYHXCE-VBNZEHGJSA-N	435.477	1.734	50	20	IDGD	
Cc1cc(NNC(=O)[C@@H](NS(=O)(=O)c2ccc3c(c2)OCCCO3)C(C)C)nc(C)n1	736717225	VKHNCJMYXGMSIY-IBGZPJMESA-N	449.533	1.701	50	20	IDGD	
COc1ccc(OCC(=O)NN=C(C)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1	739400841	VUXOUWAIZAKHOZ-UHFFFAOYSA-N	447.513	1.635	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCc2cc(F)ccc2N2CCOCC2)cc1OC	740903770	NAXTYKBDDVHWMN-UHFFFAOYSA-N	432.452	1.824	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)[C@@H]1CCCN(C(=O)COc2ccccc2)C1	741283352	FQFQUHFJWJGVAX-QGZVFWFLSA-N	440.500	1.572	50	20	IDGD	
CCCCCn1c(=O)c2ccccc2n2c(SCC(=O)NNC(=O)C3CC3)nnc12	742445749	WBFSCJMNQSOOOK-UHFFFAOYSA-N	428.518	1.884	50	20	IDGD	
COc1ccc(CC[C@@H](C)NC(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1	742760402	OKTWCZYUVXOPTL-CQSZACIVSA-N	433.534	1.954	50	20	IDGD	
COc1cccc(-c2noc([C@@H](C)NC(=O)NNC(=O)CNC(=O)c3ccco3)n2)c1	743578610	XRRGPGHDZDIDII-LLVKDONJSA-N	428.405	1.160	50	20	IDGD	
O=C(NNS(=O)(=O)c1cccc(-n2cnnn2)c1)c1ccc(Br)s1	743729128	BBSLFMUCLMONNO-UHFFFAOYSA-N	429.281	1.110	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)CCNS(=O)(=O)c2ccc(F)c(F)c2)cc1	743828816	IMAQHYGUYBGJMR-UHFFFAOYSA-N	441.460	1.552	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)CN2CCC(n3cc(Br)cn3)CC2)cc1	744401377	WZFOLBIRQZHUER-UHFFFAOYSA-N	431.294	1.615	50	20	IDGD	
CN(C)c1nc2sc(C(=O)OCC(=O)NNC(=O)c3ccc(C#N)cc3)cc2s1	744842671	NVEQFDIRTXCFPJ-UHFFFAOYSA-N	429.483	1.913	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H]2CCN(C)[C@@H](C)C2)c1	745855745	YIEHYBMVWUFNEQ-GOEBONIOSA-N	425.555	1.144	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)N[C@@H](c2ccc(F)cc2)c2cccc(S(C)(=O)=O)c2)cn1	745899450	OXKDZOWLBSQNJM-SFHVURJKSA-N	445.476	1.696	50	20	IDGD	
COc1cc(OC)c(CCNC(=O)NNC(=O)Cc2cn3ccccc3n2)c(OC)c1	746760316	LRFLRFCIYWUVBH-UHFFFAOYSA-N	427.461	1.476	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)c2cc(N)cc(S(C)(=O)=O)c2)cc1C	747727411	MHJXWGFAZXQNIK-UHFFFAOYSA-N	439.515	1.223	50	20	IDGD	
NC(=O)C1CCN(C(=O)NNC(=O)[C@H]2Cc3ccccc3CN2Cc2ccccc2)CC1	747866292	PIKKBSQQFYYYCC-OAQYLSRUSA-N	435.528	1.552	50	20	IDGD	
COc1cc(S(=O)(=O)N2CCOCC2)cc(C(=O)NNc2cccc(C#N)c2)c1OC	748045693	BTCDQQJMSIYJAB-UHFFFAOYSA-N	446.485	1.353	50	20	IDGD	
C[C@@H](Sc1nnnn1C1CC1)C(=O)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1	748517945	AFATZKRZMRODIG-MRVPVSSYSA-N	436.441	1.925	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)NCC2CCN(S(C)(=O)=O)CC2)c(C)n1C[C@@H]1CCCO1	748668354	YMTDFTHMKSAPHQ-HNLWVNFGSA-N	448.589	1.979	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2cc(C(=O)O)cc(C)c2F)cc(OC)c1OC	749142103	PCGKDZFFJKPTQN-UHFFFAOYSA-N	442.421	1.481	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)c1ccc(I)c(Cl)c1	749875493	UVWLGWGEONTFQG-QMMMGPOBSA-N	442.662	1.140	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NCC(=O)NNC(=O)CC2CCCC2)c1	749952051	ULNKUSUCHAXJCJ-UHFFFAOYSA-N	438.550	1.175	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)[C@H]1CCCN(C(=O)Cc2ccccc2)C1	751208564	GZZDCSZTCPIWOB-INIZCTEOSA-N	428.514	1.107	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)c1ccc(=O)n(-c2cccc(F)c2)c1	751297479	HWKKZNLAIOWTBV-UHFFFAOYSA-N	443.460	1.345	50	20	IDGD	
CSCC[C@H](NC(=O)c1ccc([N+](=O)[O-])o1)C(=O)NNc1ccc(C(F)(F)F)nn1	755189536	ONKPUMKCUQWGRL-QMMMGPOBSA-N	448.383	1.991	50	20	IDGD	
Cc1c(NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c(=O)n(-c2ccccc2)n1C	755320575	OBSUBLGOECSOOU-UHFFFAOYSA-N	443.485	1.354	50	20	IDGD	
CNS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2ccc(OC(C)C)c(OC)c2)cc1	756640903	QNYFCAPHQIWXMQ-UHFFFAOYSA-N	436.490	1.857	50	20	IDGD	
Cc1ccc(S(=O)(=O)Nc2cccc(C(=O)NNc3ccc(C(N)=O)nn3)c2)cc1F	757402796	PITFMXCLNRHEDT-UHFFFAOYSA-N	444.448	1.581	50	20	IDGD	
COC(=O)c1cc(NC(=O)NNC(=O)c2cc(Cl)ccc2O)cc(S(C)(=O)=O)c1	757673306	BQWSWOLRAGJJPE-UHFFFAOYSA-N	441.849	1.702	50	20	IDGD	
NS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2cc(Br)ccc2O)cc1	757673536	HQGWSSZIZVJYAQ-UHFFFAOYSA-N	429.252	1.269	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)[C@@H](c1ccc(Br)cc1)N1CCCC1	758200411	IVJUSAACYHXIHU-QGZVFWFLSA-N	449.305	1.756	50	20	IDGD	
O=C(NNc1nc(O)c2ccccc2n1)c1ccc(S(=O)(=O)N=c2cc[nH]cc2)cc1	758296304	XWMBNFDOMHIODY-UHFFFAOYSA-N	436.453	1.710	50	20	IDGD	
COc1ccc(C(=O)N[C@@H](C(=O)NNC(=O)C(=O)Nc2ccccn2)c2ccccc2)cc1	758827789	NJKXBEWJXUEBFY-LJQANCHMSA-N	447.451	1.347	50	20	IDGD	
COCCS(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2cccc3ncccc23)cc1	759262266	WEUSJTYKNYAXJJ-UHFFFAOYSA-N	442.497	1.799	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)[C@H]2CCCN2S(=O)(=O)c2cccc([N+](=O)[O-])c2)nc1	759740659	ZOYZTNLHCIOBNS-OAHLLOKOSA-N	449.445	1.073	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)[C@](C)(O)CN2C(=O)C(C)(C)c3ccccc32)c1	760054304	ULJXCVLALGJQPV-HSZRJFAPSA-N	441.484	1.540	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)c1noc(-c2ccccc2)n1	761791001	LAOMPKJYRXWTSA-LBPRGKRZSA-N	429.458	1.845	50	20	IDGD	
C[C@@H](CCS(C)(=O)=O)NC(=O)NNC(=O)c1ccc(Br)cc1Cl	762026857	BGRUEVCVGTWKJY-QMMMGPOBSA-N	426.720	1.870	50	20	IDGD	
O=C(NNC(=O)c1cc2ccccc2cc1O)C(=O)Nc1ccc(NC(=O)C2CC2)nc1	763526524	HLOKKACCCXDYKG-UHFFFAOYSA-N	433.424	1.689	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)N[C@@H]1CC(=O)N([C@H]2C[C@H]2c2ccccc2)C1	763527161	ZSMLQAGZENZJCG-IKGGRYGDSA-N	440.525	1.972	50	20	IDGD	
C[C@H](c1cccc(NC(=O)C(=O)NNC(=O)c2c[nH]c3ccccc23)c1)N1CCOCC1	763534571	KKSBRIUMXZXDEQ-OAHLLOKOSA-N	435.484	1.961	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)n([C@H]2C[C@H]3CC[C@H]2C3)n1	763552004	UXEQZYBGVRFZAX-YDHLFZDLSA-N	425.445	1.681	50	20	IDGD	
Cc1cc(C)cc(-n2nc(NC(=O)C(=O)NNC(=O)[C@@H]3COc4ccccc4O3)cc2C)c1	763570568	GBLJKVNCNGCXSS-IBGZPJMESA-N	449.467	1.723	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(F)ccc1N1CCCCC1	763663614	LDROXRRCBIFHBE-UHFFFAOYSA-N	444.463	1.990	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(C(N)=O)c(Cl)c1	763685394	UTCMDXVNEDOIPD-UHFFFAOYSA-N	434.836	1.003	50	20	IDGD	
CC(=O)Nc1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])ccc1Cl	763802621	FFQRHLBPPBRLTP-UHFFFAOYSA-N	449.807	1.372	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(C(C)=O)cc2)ccc1C	763873793	YRPMRAGYYMVMNG-CQSZACIVSA-N	441.440	1.538	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cccc(-n3ccnn3)c2)cc1	763879062	WEWFBLFMYOJXOU-CQSZACIVSA-N	436.428	1.023	50	20	IDGD	
CN(C)C(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)CCSc2ccc(F)cc2)cc1	763894946	HXFIYTSEJIHGLY-UHFFFAOYSA-N	446.504	1.725	50	20	IDGD	
Cc1ccnc(-c2ccc(NC(=O)C(=O)NNC(=O)c3ccc4c(c3)OCCO4)cc2)n1	764006774	URDCSNOTFCYJDZ-UHFFFAOYSA-N	433.424	1.623	50	20	IDGD	
CCOc1cc2c(cc1NC(=O)C(=O)NNC(=O)[C@@H]1Cc3ccccc3O1)O[C@H](C)C2	764151408	IMLKLFQYQYOPKC-BLVKFPJESA-N	425.441	1.498	50	20	IDGD	
Cc1ncsc1C(=O)NNC(=O)C(=O)Nc1cnc(Cl)c(Br)c1C	764247034	TYSKQMMDMDZUDI-UHFFFAOYSA-N	432.687	1.971	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1cccc(NC(=O)c2ccoc2)c1	764277687	MWAISUVYSSHCPV-UHFFFAOYSA-N	438.396	1.402	50	20	IDGD	
COC(=O)c1ccc(N2CCCC2)c(NC(=O)C(=O)NNC(=O)Cc2ccccc2F)c1	764312868	AGBVUBVPGINOOX-UHFFFAOYSA-N	442.447	1.541	50	20	IDGD	
O=C(CCC(=O)N1CCN(c2ccccn2)CC1)NNC(=O)c1cc(Br)c[nH]1	764609269	VHOKPTKVZUQUFJ-UHFFFAOYSA-N	449.309	1.062	50	20	IDGD	
CCC1(CC)[C@@H](OC)C[C@H]1NC(=O)NNC(=O)c1sc(N2CCOCC2)nc1C	765635266	QJMYUDMSJIVIBG-KGLIPLIRSA-N	425.555	1.826	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)c1ccc(NC2CC2)nc1	766659875	HMFSJEACGLGGNR-UHFFFAOYSA-N	442.951	1.888	50	20	IDGD	
CCOC(=O)NNC(=O)c1ccc(NC(=O)C[C@H]2SC(N3CCCC3)=NC2=O)cc1	767185512	BQDGAGABMLPVKW-CQSZACIVSA-N	433.490	1.500	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2ccc3c(c2)nc(O)n3CC(F)(F)F)C[C@H](C)O1	767822737	OCCPFNIRRIXXRA-RYUDHWBXSA-N	443.426	1.565	50	20	IDGD	
CN(c1ccc(F)cc1)S(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=O)C(C)(C)O)c1	768261778	OGYQNLLLSPTCEY-UHFFFAOYSA-N	443.884	1.836	50	20	IDGD	
Cc1cc(Br)cc2cc(C(=O)NNC(=O)N[C@@H]3CCS(=O)(=O)C3)oc12	768482236	VQBCXALBZQLAML-LLVKDONJSA-N	430.280	1.635	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)c1nccn2c(Br)cnc12	768627669	CICXMJANGOGPMW-UHFFFAOYSA-N	440.279	1.661	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)c1cnn(CC(=O)NC2CCCCC2)c1	768630442	ZFEHBONEHIRMAJ-UHFFFAOYSA-N	449.533	1.501	50	20	IDGD	
CC(C)(C)[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1ccc(Br)cc1Cl	770541554	FNOBENAUMFFLHW-LLVKDONJSA-N	440.747	1.827	50	20	IDGD	
N#CC1(CS(=O)(=O)N2CCN(S(=O)(=O)CBr)CC2)CCCCC1	772949133	XECUURYHBFHBRW-UHFFFAOYSA-N	428.374	1.090	50	20	IDGD	
Cn1nc(-c2cc(F)cc(F)c2)cc1NC(=O)C(=O)NNC(=O)CCc1ccccc1O	773547732	SKUPJTFWBPVFOQ-UHFFFAOYSA-N	443.410	1.790	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCC(F)(F)CNC(=O)OC(C)(C)C)cc1OC	777413131	GODQUWFSTNFUIR-UHFFFAOYSA-N	432.424	1.808	50	20	IDGD	
COc1cc(S(=O)(=O)NNC(=O)CNC(=O)OC(C)(C)C)ccc1Br	777939940	SRGKXJKOIKILMP-UHFFFAOYSA-N	438.300	1.292	50	20	IDGD	
O=C(NNC(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1)c1csc(N2CCOCC2)n1	778228071	ZLHSTEIRNRVDAM-UHFFFAOYSA-N	427.389	1.441	50	20	IDGD	
C[C@H](NC(=O)OC(C)(C)C)[C@H]1CCN(C(=O)NNC(=O)CNC(=O)c2cccs2)C1	778639804	GWKXNLGBVMNNBA-STQMWFEESA-N	439.538	1.454	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)C(=O)Nc1cc(Cl)ccc1OC[C@@H]1CCOC1	778709727	HXCTXTFFUDEOSH-CQSZACIVSA-N	432.864	1.479	50	20	IDGD	
CN(C)C(=O)COc1ccccc1C(F)(F)C(=O)NNC(=O)Cc1cn2ccccc2n1	778833101	NVTIGRWRSUQWGK-UHFFFAOYSA-N	445.426	1.283	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CC[C@@H]([C@H](C)NC(=O)OC(C)(C)C)C2)n1	778985539	YTGMFWZUYYDDFI-UONOGXRCSA-N	425.555	1.377	50	20	IDGD	
COc1ccc(C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)nc1Br	781756426	ILAVWSHUBWUGHG-UHFFFAOYSA-N	433.218	1.342	50	20	IDGD	
NC(=O)c1cccc(C(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)n1	781934545	RCHBJZQOQCZJOB-UHFFFAOYSA-N	445.482	1.118	50	20	IDGD	
CC(=NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1)c1ccc(N2CCNC2=O)cc1	782252248	JRRDRQDMNDKETK-UHFFFAOYSA-N	448.527	1.514	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)NCc2cccc(S(=O)(=O)N(C)C)c2)c1	782769993	RXYLVXIMYXQTBT-UHFFFAOYSA-N	434.518	1.463	50	20	IDGD	
CCOC(=O)[C@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNc2cccc(F)c2)cc1F	783043374	TVOLKSOPPNYFCK-NSHDSACASA-N	434.399	1.728	50	20	IDGD	
CCCOc1ccc(C(F)(F)F)cc1NC(=O)C(=O)NN[C@@]1(C)CCS(=O)(=O)C1	783427217	NDQXKCUXAPWZLL-INIZCTEOSA-N	437.440	1.631	50	20	IDGD	
COC(=O)COc1ccccc1C(C)=NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1	783804394	NMDKCQFCFXFAOG-UHFFFAOYSA-N	447.513	1.708	50	20	IDGD	
CS(=O)(=O)CCc1ccc(NC(=O)C(=O)NNc2ccc(Br)cn2)cc1	784339031	ICWTVFBYCGPBNK-UHFFFAOYSA-N	441.307	1.513	50	20	IDGD	
CCOC(=O)c1cc(CC)sc1NC(=O)C(=O)NNc1cccc(S(C)(=O)=O)c1	784844856	RHVYJDZMGCKJDP-UHFFFAOYSA-N	439.515	1.973	50	20	IDGD	
O=C(NNc1cccc(C(F)(F)F)n1)C(=O)Nc1ccccc1C(=O)N1CCOCC1	784957975	LJNJIOKWOIFORW-UHFFFAOYSA-N	437.378	1.655	50	20	IDGD	
CN(C)C(=O)c1ccccc1NC(=O)C(=O)NNc1c(F)cc(C(=O)NC2CC2)cc1F	785100688	XRRJZZBPPWVHFQ-UHFFFAOYSA-N	445.426	1.641	50	20	IDGD	
COc1cc(F)cc(NNC(=O)C(=O)Nc2cc(S(=O)(=O)N(C)C)ccc2OC)c1	785247503	WMDMOZNSBIWEHV-UHFFFAOYSA-N	440.453	1.175	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)c1ccc(O[C@H]2CCOC2)cc1	788720790	QLYVPEMMLDQDAP-QFIPXVFZSA-N	438.528	1.828	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)c3[nH]nnc3C)c2)c(C)c1	789867626	UPHVPMLZNIHEGX-UHFFFAOYSA-N	428.474	1.606	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)CCOCC(F)(F)C(F)F)ccc1Cl	790120586	SBQSCVXIWUYSNL-UHFFFAOYSA-N	435.783	1.056	50	20	IDGD	
CN1C(=O)C[C@H](C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)[C@@H]1c1ccc(Cl)c(Cl)c1	790218963	YJENGPQCCNCTKL-PGUXBMHVSA-N	448.328	1.095	50	20	IDGD	
CO[C@H]1CCOc2c(NC(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)cccc21	790577420	QWLQFFLFNVEKJO-KRWDZBQOSA-N	448.501	1.873	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3ccnn3-c3ccccc3)CC2)cc1	792237454	IRKQCOFWTVSJGR-UHFFFAOYSA-N	432.528	1.760	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)NC(=O)OC(C)(C)C	792265955	ZSOIWKXHAOOJJF-LLVKDONJSA-N	429.499	1.339	50	20	IDGD	
O=C(COC(=O)COc1cccc(N2CCCC2=O)c1)NNC(=O)c1cccc(Cl)c1	792318812	OUCGLFHBRFKPNA-UHFFFAOYSA-N	445.859	1.850	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCCCC3)cc2)n1	794090645	YIGJKNOOOYWWPN-UHFFFAOYSA-N	430.530	1.958	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)c1	796380335	CGOQZHZNRJNZGO-QHCPKHFHSA-N	435.572	1.648	50	20	IDGD	
N#Cc1cccc(-n2ccc(C(=O)OCC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)n2)c1	798800710	SVXZOYXUKGBZCV-UHFFFAOYSA-N	434.368	1.270	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)CCN2CCN(C(=O)[C@@H]3CCCO3)CC2)c2ccccc2n1	799009499	ZZIUWQFFCQHIKE-FQEVSTJZSA-N	439.516	1.018	50	20	IDGD	
CC(C)CCC(=O)NNC(=O)C(=O)Nc1cnc(N2CCOCC2)c(Br)c1	799258676	FQTBWJFDUGPJFF-UHFFFAOYSA-N	442.314	1.203	50	20	IDGD	
Nc1cc2c(cc1C(=O)OCC(=O)NNC(=O)[C@@H]1COc3ccccc3O1)CCCC2	801452419	JKOFFHVRHIQIEE-IBGZPJMESA-N	425.441	1.292	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)CNC(=O)c2ccc(C(F)(F)F)cc2)cc1	801986696	RNQCJQOEKQIXBD-UHFFFAOYSA-N	437.374	1.748	50	20	IDGD	
CN(C)CCS(=O)(=O)c1ccccc1C(=O)NNC(=O)Nc1ccc2c(c1)OCO2	802106394	DXYYEFCJTBBPDB-UHFFFAOYSA-N	434.474	1.217	50	20	IDGD	
COc1ccc(Cl)c(NC(=O)NNC(=O)Cc2ccc(S(=O)(=O)N(C)C)cc2)c1	802116588	JRMZNKSETILCDV-UHFFFAOYSA-N	440.909	1.994	50	20	IDGD	
COC(=O)N(C)NC(=O)c1cc(S(=O)(=O)N2CCCCC2)ccc1N1CCOCC1	804124056	YOAXNJCLMLTZIW-UHFFFAOYSA-N	440.522	1.041	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)NCCCN1C(=O)c2ccccc2C1=O	804867536	DTBDPXWHYSMVES-UHFFFAOYSA-N	426.429	1.091	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)Nc1cc(F)c(N2CCOCC2)cc1F	806741748	OTSGAZVXKFJPFC-UHFFFAOYSA-N	444.398	1.917	50	20	IDGD	
COCCOc1ccc(S(C)(=O)=O)cc1NC(=O)C(=O)NNc1cccc(F)c1	806995823	MLHXBDJWRGKLSU-UHFFFAOYSA-N	425.438	1.336	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)[C@H]2CCc3nnn(C)c3C2)c2ccccc2c1=O	809982419	FXVOHJJRBOBAKC-AWEZNQCLSA-N	437.504	1.281	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(=NNC(=O)CNC(=O)c2cccnc2)[C@@H]([C@@H]2CCOC2)C1	812226801	UDCIOYSADZBLIJ-IAGOWNOFSA-N	445.520	1.577	50	20	IDGD	
CC(=NNC(=O)c1cc(-c2ccccc2)[nH]n1)c1ccc(S(=O)(=O)CC(N)=O)cc1	814706813	NFRBKBGYXPTZQE-UHFFFAOYSA-N	425.470	1.490	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3n2)nnn1Cc1ccccc1F	815563755	MZLMWAJVTWBIKQ-UHFFFAOYSA-N	447.430	1.722	50	20	IDGD	
COCc1cc(NC(=O)C(=O)NNc2ccnc(Br)c2)cc(C(=O)OC)c1	815601009	LHZUURCWIPMOOB-UHFFFAOYSA-N	437.250	1.859	50	20	IDGD	
Cc1ccc(Oc2ccc(NC(=O)C(=O)NNC(=O)[C@@H]3CCc4nncn4C3)cc2)cc1	815692300	OANQXMWXRFKJRU-OAHLLOKOSA-N	434.456	1.727	50	20	IDGD	
COc1cc2c(cc1OC)CN(CC(=O)NNc1ccccc1S(=O)(=O)N(C)C)CC2	817054329	FESAPMRGDPICCI-UHFFFAOYSA-N	448.545	1.456	50	20	IDGD	
CCN(CC(=O)N[C@@H]1CCS(=O)(=O)C1)C(=O)/C(C#N)=C\c1cc(C)n(CC(C)C)c1C	912663487	GSNXSYDOABMDIG-KJAJEWJFSA-N	448.589	1.820	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)CNS(=O)(=O)c3ccccc3F)cc2C1	913162502	RRGGLBNCPHMQGO-LLVKDONJSA-N	425.507	1.752	50	20	IDGD	
COc1cc(OC)cc(C(=O)N2CCC(C(=O)NNC(=O)c3ccccc3O)CC2)c1	915638272	CBTMBBXFYYTNIC-UHFFFAOYSA-N	427.457	1.723	50	20	IDGD	
NS(=O)(=O)c1ccc(CCNC(=O)NNC(=O)Cc2cccc3ccccc23)cc1	915884002	OIUXOEXJTRIFKO-UHFFFAOYSA-N	426.498	1.603	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@H](c2ccco2)N2CCCC2)c1	915896956	YGIUGZYTUJOUIC-QGZVFWFLSA-N	449.533	1.311	50	20	IDGD	
CCNC(=O)COc1ccc(CNC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1OC	916389351	RYDAXKXJGKSVJT-UHFFFAOYSA-N	445.432	1.263	50	20	IDGD	
O=C(NNC(=O)C12CC3CC(CC(C3)C1)C2)c1ccc2c(c1)S(=O)(=O)N(C1CC1)C2=O	916742298	CJKBFYFIHGXQPR-UHFFFAOYSA-N	443.525	1.971	50	20	IDGD	
CC(C)(C)n1nc(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1C1CC1	917919158	NSAKXJRTMFDMOG-UHFFFAOYSA-N	439.925	1.891	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCc2cc([N+](=O)[O-])ccc2OC)c2ccccc2c1=O	918114730	ORCLZIWAUYUAEL-UHFFFAOYSA-N	440.416	1.477	50	20	IDGD	
CC(=O)N[C@H](C)c1ccc(S(=O)(=O)NNC(=O)[C@@H]2COc3ccccc3O2)s1	918399389	NCLYMILKPVVYKB-YGRLFVJLSA-N	425.488	1.095	50	20	IDGD	
COc1ccc(C(=O)N2CCN(C(=O)NNC(=O)c3c(C)nc4ccccn34)CC2)cc1	918776597	TWFKQCRGDFSNST-UHFFFAOYSA-N	436.472	1.464	50	20	IDGD	
C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)C1	919786594	XIBXYZYVQHUFBX-YJBOKZPZSA-N	430.530	1.870	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)[C@@H]2CCCN2S(=O)(=O)c2ccc(C)cc2)cc1	919832731	HYYIDDPWGUAYOL-FQEVSTJZSA-N	445.541	1.937	50	20	IDGD	
O=C(Cc1csc(Cc2ccc(F)cc2)n1)NNC(=O)c1ccc(-n2cnnn2)cc1	920884315	HGMMLCDKNMBSBK-UHFFFAOYSA-N	437.460	1.852	50	20	IDGD	
C[S@](=O)CCCNC(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1	1121903523	SGTGQBAJHVYRKX-KEEVHDRGSA-N	428.558	1.713	50	20	IDGD	
C[C@H]1CN(CCCNC(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)C[C@H](C)O1	1318620638	HTKCEQRSERJWFR-HOTGVXAUSA-N	441.573	1.463	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)c2cn(Cc3cccc(F)c3)nn2)CC1	1319100734	RBRHAFXXCHDWIL-UHFFFAOYSA-N	446.483	1.874	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)c2ccc(N3C(=O)CCC3=O)cc2)CC1	1328626940	QFKRVYOHOZJETG-UHFFFAOYSA-N	444.488	1.748	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)ccn1	1338593322	XSIZMPWQQAWPAS-UHFFFAOYSA-N	429.436	1.923	50	20	IDGD	
COc1ccc(Cl)c(NC(=O)NNC(=O)[C@H]2Nc3ccccc3S(=O)(=O)N2)c1	1344719638	YFEYNBSQZTUCFH-AWEZNQCLSA-N	425.854	1.231	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cccc3[nH]ncc23)C1	1777874105	QGONGHLRSQUJJI-HGHGUNKESA-N	434.924	1.944	50	20	IDGD	
C[C@H](Nc1ccccn1)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1779328189	DAZSVIMPNYZIMN-RVSPLBMKSA-N	429.290	1.402	50	20	IDGD	
CN(C)c1ccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)cn1	1779763331	HJISZTHTLLYUTB-RHSMWYFYSA-N	429.290	1.282	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3sccc3Cl)C2)C1	1779787186	YTBGUZNVYLKOOX-LJQANCHMSA-N	449.920	1.157	50	20	IDGD	
COc1ccc(CC(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](O)CCl)C3)c(C#N)c1	1780687698	LVLJBWBDFZMFHQ-WOIUINJBSA-N	449.935	1.223	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(O)c([N+](=O)[O-])c3)C2)C1	1781539980	FRAGCOWOWQPNHM-ZWKOTPCHSA-N	446.287	1.980	50	20	IDGD	
CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1782053720	SWWGTWCQTBBALC-GOSISDBHSA-N	445.303	1.908	50	20	IDGD	
CC(=O)C(=O)N1CCO[C@@]2(CCN(C(=O)/C(C#N)=C/c3ccc(Br)cc3)C2)C1	1782869540	FDXQUNWENVKUBQ-NXZBIGBUSA-N	446.301	1.775	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cc4ncccn4n3)CCO2)C1	1783349093	HESREVRSRUNPRP-ACJLOTCBSA-N	436.310	1.346	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)CCNC(=O)OC(C)(C)C)CCO2)C1	1783537235	JREKRZGKPZNQNM-SCLBCKFNSA-N	448.358	1.515	50	20	IDGD	
C[C@@H](Sc1ccccc1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21	1784348476	HYNSHDLOGHIRRM-SRIISGBFSA-N	426.966	1.747	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(O)nc(Cl)c3)[C@H]2C1	1785692810	WAVOICHJJCVGFE-QEJZJMRPSA-N	441.988	1.885	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cncc(F)c3)[C@H]2C1	1786147026	RQNKAMUHBSICRZ-DDWPSWQVSA-N	428.302	1.988	50	20	IDGD	
Cc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)Br)C[C@@H]32)cc(O)n1	1787457368	GAYSFVXCAVLHAB-JURCDPSOSA-N	426.311	1.472	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)[C@H](O)c3ccco3)CCC2)cc1)c1ccc(B(O)O)cc1	1788140049	FSVHTGAARPTTOZ-HXUWFJFHSA-N	434.257	1.441	50	20	IDGD	
Cn1cccc(C(=O)NC2(c3ccc(NC(=O)c4ccc(B(O)O)cc4)cc3)CCC2)c1=O	1788140269	MREOWXOEZMKKHX-UHFFFAOYSA-N	445.284	1.127	50	20	IDGD	
C[Si](C)(C)OCC(=O)Nc1ccc(C2(NC(=O)CN3C(=O)CNC3=O)CCC2)cc1	1789647488	AAABJXGMWNLREG-UHFFFAOYSA-N	432.553	1.524	50	20	IDGD	
Cc1n[nH]c(C)c1CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]2C1	1789923568	VEDZKVFMCDURKO-ATVPRXPUSA-N	431.306	1.239	50	20	IDGD	
Cc1c(F)cccc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnccc1C(=O)NN)C2	1792755826	CZLXBPDSNOICBG-QDMKHBRRSA-N	425.464	1.698	50	20	IDGD	
Cc1c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)CBr)nc2ccccn12	1792868101	PROBYRKVNXPETG-FRQROOTJSA-N	449.349	1.877	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCC(=O)N1CCCC1	1793803722	VSXOTCGBOCEYJD-BASYENTBSA-N	444.370	1.152	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(=O)cco1	1795382568	MQBLBTXJVXNWRO-NGYDUSEUSA-N	425.445	1.026	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(N2CCOCC2)cc1	1796490840	CDNPWHBAWPGIOQ-PIKOESSRSA-N	435.952	1.744	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCBr)C2	1796889702	BPYXHYSQEXOVMP-ZVMOGAGKSA-N	438.326	1.544	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(O)c(F)c1)C2	1796892643	ALQALXKGEAJUDQ-TWXBYECESA-N	441.463	1.917	50	20	IDGD	
Cc1cc2nnc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)CO[Si](C)(C)C)C4)c(C)n2n1	1797440157	BZIFNSJHOTXMAK-MUJYYYPQSA-N	430.585	1.844	50	20	IDGD	
CC(C)(C)c1cnc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CO[Si](C)(C)C)cn1	1797955769	ADLNWPXOERXDRJ-CCWDJLKJSA-N	434.613	1.829	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1C[C@H]1F	1799177077	VCEOYJZYUKHCQS-HOWPAZRSSA-N	435.408	1.081	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(=O)nc2cccnn12	1799187759	ARBGVARXKSPNCF-FQUUOJAGSA-N	448.321	1.372	50	20	IDGD	
C[C@H](Oc1ccccn1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Br	1799351912	GBDCAFPMHGMYIC-QIRZIZBZSA-N	430.274	1.129	50	20	IDGD	
Cc1ccn2c(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)CCBr)C4)cnc2c1	1800081416	ZBCBXDXJXMEUHR-ZSBFGKGUSA-N	435.322	1.631	50	20	IDGD	
COc1ncc(Cl)cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)Br	1800754533	QXUGSIPLAPLOGN-NJBDSQKTSA-N	446.729	1.730	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nnc(-c3ccccc3)o1)C2	1800759542	UPOJIIXRKBJUOR-REBRKWNGSA-N	449.305	1.723	50	20	IDGD	
COc1ccc(F)cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Br)C2	1801725580	NIXINVGCQVMCJF-LSSIXWDNSA-N	429.286	1.821	50	20	IDGD	
COc1cccc(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)c1C	1802045896	CEPFRERXVVYMOP-WKCHPHFGSA-N	436.317	1.178	50	20	IDGD	
CCOC(=O)N[C@H](O)C(=O)N1CC[C@@H](CNC(=O)C(C)(C)CCl)[C@@H]1c1cccnc1	1802900633	CALCATQSINCROU-HRCADAONSA-N	440.928	1.417	50	20	IDGD	
CC(C)Cc1cc(C(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]2c2cccnc2)n(C)n1	1803138985	QKMPDDUCXSCWRZ-NSISKUIASA-N	447.967	1.933	50	20	IDGD	
Cn1ncc(C(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)c1Cl	1803140374	FBQLKIXVRPHPOC-SNPRPXQTSA-N	426.304	1.388	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccccc1OC(F)F	1803776606	NDBAXLWCIYDJKR-QDMKHBRRSA-N	438.475	1.913	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)c2ccncc2)[C@@H]1c1cccnc1	1805476765	TZDJFYHZOPJUQG-PXNSSMCTSA-N	445.483	1.109	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@@H](C(=O)N2CCC3(CCCN(C(=O)[C@H](O)CCl)C3)CC2)C1	1805527872	FTGBCTBKVYIOCG-BRWVUGGUSA-N	428.957	1.797	50	20	IDGD	
Cc1ccn2ncc(C(=O)NC[C@@H]3CCN(C(=O)[C@H](O)CCl)[C@H]3c3cccnc3)c2c1	1808157750	BWPZTPCORMMHOB-DBVUQKKJSA-N	441.919	1.957	50	20	IDGD	
Cn1cc(CC(=O)N2CC[C@H](CNC(=O)[C@H](F)Br)[C@H]2c2cccnc2)cn1	1808681067	OLLKEOLGGQDYRZ-OIISXLGYSA-N	438.301	1.754	50	20	IDGD	
CN(CC(=O)N1CCC2(CCCN(C(=O)CC#N)C2)CC1)NC(=O)NCc1ccccc1	1809023345	GFRQWHPFZIVPCG-UHFFFAOYSA-N	440.548	1.477	50	20	IDGD	
Cn1ccc(=O)cc1C(=O)N1CC[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]1c1cccnc1	1810543631	DEPZKTLUOITZST-LAUBAEHRSA-N	442.592	1.951	50	20	IDGD	
CC(=O)N/C(C)=C/C(=O)NC[C@@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1	1812317771	YYMIIBOZYSVBRX-XJJOCEFXSA-N	437.338	1.912	50	20	IDGD	
O=C(CCc1ccoc1)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1813522572	FLOFUFYFOZILKG-NFBKMPQASA-N	447.300	1.307	50	20	IDGD	
C[C@@H](C(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1)n1cccc1	1815347680	KJTKQZFIGYOCBP-BBRMVZONSA-N	438.318	1.111	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)C1CC(F)(F)C1)CC2)c1cccc(B(O)O)c1	1815347685	KKBMHBXOKSDNFH-ZDUSSCGKSA-N	435.261	1.094	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCN2CCOCC2)n[nH]1	1817181995	LOWDTELNVXPMNK-ZBFHGGJFSA-N	427.933	1.378	50	20	IDGD	
Cc1nccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)[nH]n2)n1	1818322936	IKUQXMZMDPSFTP-KRWDZBQOSA-N	449.475	1.126	50	20	IDGD	
Cc1cc(C)n2ncc(C(=O)Nc3cc([C@H]4CCCCN4C(=O)[C@H](O)CCl)[nH]n3)c2n1	1818584309	SFROKDSNAYHYPU-HZPDHXFCSA-N	445.911	1.975	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](Cl)COC)[nH]n1	1819355858	XYHHTKDYVJKNKG-MBNYWOFBSA-N	428.921	1.363	50	20	IDGD	
COc1ccnc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)c1	1819768322	SOGNWRWFULSHPY-QGZVFWFLSA-N	443.508	1.492	50	20	IDGD	
Cc1c(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)[C@H](F)Cl)[nH]n2)cn2[nH]cnc(=O)c12	1820117497	HWORVRXRNHIBTQ-WFASDCNBSA-N	435.847	1.894	50	20	IDGD	
O=C(CCBr)N[C@@H]1CCc2nc(NC(=O)c3cc[n+]([O-])cc3)sc2C1	1821047402	MWURHXGBTSDFOC-LLVKDONJSA-N	425.308	1.787	50	20	IDGD	
CCOC(=O)C1(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)[C@H](Cl)COC)n[nH]2)CC1	1822375871	HQDGLKOTMODIEO-TZMCWYRMSA-N	426.901	1.999	50	20	IDGD	
CC(C)[C@@H](S)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1	1824544040	KEJSBOGYNZXPDO-YLJYHZDGSA-N	426.627	1.934	50	20	IDGD	
O=C(CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H](O)CCl)CC1)N1CCCC1	1824944331	ZLOWLZYSRRVHGK-ROUUACIJSA-N	427.973	1.608	50	20	IDGD	
COc1nccnc1C(=O)N[C@H]1CCc2nc(NC(=O)[C@H](C)Br)sc2C1	1825636475	GLRSXLNDCIEFGG-IUCAKERBSA-N	440.323	1.951	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1c(F)c(C)nn1C)CC2	1825993575	KUIDAHLNKIRURF-NXEZZACHSA-N	429.905	1.804	50	20	IDGD	
O=C1C[C@H](C(=O)Nc2nc3c(s2)C[C@H](NC(=O)CCBr)CC3)CCN1	1826215566	UCGXXPGFSICNDC-NXEZZACHSA-N	429.340	1.366	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1CCC(F)(F)C1)CCO2	1829657815	CEEHCUBCQHGUSL-WOSRLPQWSA-N	439.297	1.662	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCN2C(=O)C=CC2=O)CC1	1831829054	XFBLESCABJXXRJ-IAGOWNOFSA-N	439.940	1.175	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnn3c2CCC3)CC1	1831874308	GQPRJFMHPLXIOK-IBGZPJMESA-N	444.580	1.436	50	20	IDGD	
CNc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCBr)C3)C2)cc1	1835602366	SISZETHTLYMJQA-LJQANCHMSA-N	440.338	1.583	50	20	IDGD	
O=C(Cc1cnc2ccccn12)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836701054	AXHCVPUUZCTFRK-LJQANCHMSA-N	448.951	1.475	50	20	IDGD	
C[C@H](Oc1cccnc1)C(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836719628	ATCUCDWCMLHQCG-HNAYVOBHSA-N	439.940	1.447	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cc3cccnc3[nH]1)CCO2	1837007634	CHZSEXWOEJJXSJ-OAQYLSRUSA-N	446.580	1.484	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)C3CCC(CO)CC3)C2)C1	1837710131	KEJMAYWWCDDEMS-NGICGMGXSA-N	442.629	1.093	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3c(F)cncc3F)CCO2)C1	1838161680	PMDBFTZYQMAEEX-LJQANCHMSA-N	431.867	1.695	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3nc4ncccn4n3)CC2)CC1	1838225524	HDQKRAMUUVAKFZ-MRXNPFEDSA-N	434.928	1.754	50	20	IDGD	
CN1CCN(CC(=O)N2CCC(OC3CCN(C(=O)C(Cl)Cl)CC3)CC2)CC1	1838288182	BIXMUDBKIKMHPB-UHFFFAOYSA-N	435.396	1.036	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccccc3Cl)CCO2)C1	1838866947	UYYSTTUMCQXJHA-APWZRJJASA-N	431.316	1.664	50	20	IDGD	
Cc1c(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)cnn1C	1839151180	KGGOTOLSRXLATG-MSOLQXFVSA-N	433.336	1.035	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccncc3O)C2)C1	1839153601	LSKIYURIMIKCLA-ZWKOTPCHSA-N	432.304	1.094	50	20	IDGD	
O=C(c1cc(Cl)c(O)cc1O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1839252081	PLPSTDOAGUOWFY-RHSMWYFYSA-N	437.251	1.356	50	20	IDGD	
O=C(CS[C@H]1CCCCO1)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840188593	RYQPWOXXQJUAMS-WMLDXEAASA-N	441.377	1.506	50	20	IDGD	
O=C([C@H](F)Br)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1C[C@]1(F)Cl)CCO2	1840247416	YRZYXOMUWCWOQF-RDBQEKCUSA-N	431.661	1.058	50	20	IDGD	
O=C([C@H](O)c1cccc(Br)c1)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1	1841352513	SVGVBQYPLJNFRV-ZIAGYGMSSA-N	431.714	1.286	50	20	IDGD	
CC(C)[C@H](CNC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1	1841354185	MFGJWVGDPYPATB-LSDHHAIUSA-N	431.961	1.586	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC12CN(C(=O)[C@H]1CC[C@H](C(F)(F)F)CC1)C2	1843015672	SYCBYIPBQUPTEO-KOMQPUFPSA-N	438.255	1.552	50	20	IDGD	
O=C([C@@H](F)Cl)N1CC2(CCCN2C(=O)c2ccc3nc(Br)nn3c2)C1	1843127773	HEMRBHQLZSNHDR-LLVKDONJSA-N	430.665	1.843	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2cccc3c[nH]nc23)C1	1843270400	QXHMMWTUWWNDCW-AFUMVMLFSA-N	433.472	1.514	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)COc1ccc(C)cc1)C2	1843415728	GCIVPCYRYHKLDR-KOEQRZSOSA-N	437.500	1.711	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)[C@@H](c1ccc(Cl)cc1)N(C)C)C2	1846386017	URTOGEGULMYZTI-HXUWFJFHSA-N	449.983	1.519	50	20	IDGD	
O=C(/C=C\c1c[nH]c2ccccc12)N1CC[C@H]2[C@@H]1CCN2C(=O)c1ccc(B(O)O)cc1	1848141636	SCXIVOYKXFIQLL-GKYCAKGUSA-N	429.285	1.377	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)c2c[nH]nc2-c2ccc3c(c2)OCCO3)c2ccccc2c1=O	14044456	DIQQQCUJNBOYRY-UHFFFAOYSA-N	446.423	1.170	50	20	IDGD	
O=C(COc1ccccc1-c1ccccc1)NNC(=O)C1CCC2(CC1)NC(=O)NC2=O	110746104	DJVJIOMWJOMDRR-UHFFFAOYSA-N	436.468	1.648	50	20	IDGD	
CCN1CCN(CCC(=O)NNC(=O)[C@H]2Cc3ccccc3CN2Cc2ccccc2)CC1	725894972	PUHWTWNGDAULFF-XMMPIXPASA-N	449.599	1.789	50	20	IDGD	
O=C1CN(S(=O)(=O)c2ccc(C(=O)NNc3cccc(C(F)(F)F)c3)cc2)CCN1	727758881	KHWSFTKICLNYIY-UHFFFAOYSA-N	442.419	1.583	50	20	IDGD	
COc1nc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc2ccccc12	728334189	XDQAHQHNRNYOHK-SFHVURJKSA-N	437.408	1.388	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NN=Cc1ccc(OC(F)(F)[C@H](F)C(F)(F)F)cc1	728437235	NVAMPTUBXSVXSS-QPUJVOFHSA-N	435.346	1.946	50	20	IDGD	
COc1ccccc1[C@@H](C)CC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1	728511595	VLVBFKHFAWMZAO-INIZCTEOSA-N	433.530	1.965	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)c2cc(S(N)(=O)=O)ccc2C)c1	728529442	XQCTYUNGWOARME-UHFFFAOYSA-N	442.291	1.488	50	20	IDGD	
CCN(C)[C@H](C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1)c1ccccc1	728606980	SCWUBHCTXGFMCM-NRFANRHFSA-N	445.589	1.759	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1	728845314	GHLMLMBASBZGLE-UHFFFAOYSA-N	436.432	1.248	50	20	IDGD	
COc1ccc(C(=O)NCCCC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1	728848173	YETMPNZDJUTYJS-UHFFFAOYSA-N	440.504	1.059	50	20	IDGD	
C[C@@H](COc1ccc(F)cc1F)NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1	728948919	JZLYEBMGMUFZQD-ZDUSSCGKSA-N	434.447	1.769	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)[C@H]1CC(=O)N(c2ccc3c(c2)OCCO3)C1	729449751	BHJNZRMVBFYXIT-INIZCTEOSA-N	434.452	1.613	50	20	IDGD	
CCOc1ccccc1N1C[C@H](C(=O)NNC(=S)Nc2ccc(OC)nc2)CC1=O	729693088	HZSKSDIAPNFTQF-CYBMUJFWSA-N	429.502	1.860	50	20	IDGD	
O=C(CC[C@H]1NC(=O)N(c2ccc(Cl)c(Cl)c2)C1=O)NNC(=O)N1CCOCC1	730532401	FJPOPAJQYWBLHU-CYBMUJFWSA-N	444.275	1.271	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)CC[C@H]2NC(=O)N(c3ccc(Cl)cc3)C2=O)cc1	730774072	RXDBRBHAVCWTPK-MRXNPFEDSA-N	425.832	1.878	50	20	IDGD	
Cc1nc(-c2c(C)c(C)nn(C)c2=O)sc1C(=O)NNC(=O)CCc1ccccc1O	731229781	AQLGLFWOICCQBN-UHFFFAOYSA-N	441.513	1.928	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])o1)c1ccc2c(c1)OCCO2	731875589	JUTDGYFVWZFOPK-GFCCVEGCSA-N	430.373	1.025	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2cccc(C(=O)O)c2)cc1Br	732048582	PJJBPPKDJGBLAH-UHFFFAOYSA-N	429.248	1.779	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCC(=O)N2CCc3ccccc32)cc1Br	732244060	BMECWYZACGJODO-UHFFFAOYSA-N	447.289	1.991	50	20	IDGD	
COc1cc2cc(C(=O)NNC(=O)CCN3C[C@H](C)O[C@@H](C)C3)[nH]c2c(OC)c1OC	732260569	GCXHTGFSDCCXFV-STQMWFEESA-N	434.493	1.454	50	20	IDGD	
O=C(CCC[S@@](=O)c1ccc(Br)cc1)NNC(=O)C(=O)N1CCCC1	732279862	QVPLLXWDQJPQRM-RUZDIDTESA-N	430.324	1.107	50	20	IDGD	
CCc1cccc2c1NC(=O)C2=NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	733077718	JETILXGXNYQNLG-UHFFFAOYSA-N	442.497	1.356	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)C[C@@H]2OCCc3ccccc32)cc1	734417035	HEPCWKBTCQHZPD-IBGZPJMESA-N	431.514	1.467	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2ccc(OCC3CC3)cc2)CC1	735116761	DWSYUTIFOPCOMJ-UHFFFAOYSA-N	445.545	1.563	50	20	IDGD	
COc1ccc(-c2n[nH]c(CNC(=O)NNC(=O)c3cc(Br)c[nH]3)n2)cc1	741416668	HINLTJKSJDAFLQ-UHFFFAOYSA-N	434.254	1.715	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=S)N[C@@H]2CCOc3ccccc32)c1	741476309	LCSRSIGZHTUBFD-MRXNPFEDSA-N	434.543	1.570	50	20	IDGD	
CCCc1c(C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)nnn1-c1cccc(C(C)C)c1	741523862	SZAQQEBIHYLEEO-OAHLLOKOSA-N	433.534	1.539	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)c1cc(N2CCNC2=O)ccc1Cl	742033473	AMMGSFOQJSXOKV-UHFFFAOYSA-N	426.820	1.593	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)c1ncoc1-c1ccc2c(c1)OCCO2	742077225	TYZDGKGXLLYUIT-UHFFFAOYSA-N	447.448	1.582	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)Cc3cc[nH]n3)c2)c(C)c1	743291300	OWGILDVFIIJZFD-UHFFFAOYSA-N	427.486	1.831	50	20	IDGD	
C[C@H]1C[C@H](NC(=O)NNC(=O)c2csc(N3CCOCC3)n2)C(=O)N1c1ccccc1	743510017	OOQBLOWCDNMSRH-ZFWWWQNUSA-N	444.517	1.118	50	20	IDGD	
Cc1ccc(/C=C(\C#N)C(=O)O[C@@H](C)C(=O)NCCc2ccc(S(N)(=O)=O)cc2)cc1	744502058	MQCYUBVEVOMBIQ-HUCUOGIVSA-N	441.509	1.840	50	20	IDGD	
CC(=NNC(=O)c1cn(C)c2ccccc12)c1ccc(S(=O)(=O)NCC(=O)O)cc1	744780370	LYGMEQGDDHVHLB-UHFFFAOYSA-N	428.470	1.695	50	20	IDGD	
O=C(NCc1cc(F)ccc1N1CCOCC1)NNC(=O)c1cc([N+](=O)[O-])ccc1O	745838657	RTAPHDZQTUCEQH-UHFFFAOYSA-N	433.396	1.420	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)[C@@H]1CC(=O)N(c2cccc(S(N)(=O)=O)c2)C1)c1ccccc1	746247372	MKZZFUMUXALZLM-QAPCUYQASA-N	444.513	1.028	50	20	IDGD	
CC(C)N(C)S(=O)(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	747595604	CILZIMCNLWPUHT-UHFFFAOYSA-N	429.502	1.264	50	20	IDGD	
COC(=O)c1ccc(OC)c(S(=O)(=O)NNC(=O)c2nnc(-c3ccccc3)o2)c1	747610015	ZKCVDSFAPBDLSD-UHFFFAOYSA-N	432.414	1.155	50	20	IDGD	
CC(=O)N1CCN(S(=O)(=O)c2ccc(C(=O)NNc3cccc([N+](=O)[O-])c3)cc2)CC1	747996034	WYNZAFCCSICKLT-UHFFFAOYSA-N	447.473	1.205	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)NCC(=O)N2CCN(c3ccccc3)CC2)c2ccccc2n1	749219613	DOKLWLOHJTYTHE-UHFFFAOYSA-N	446.511	1.836	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)[C@@H]1CCCN1C(=O)c1ccc2c(c1)OCO2	749561982	TURMJTSLLKRORZ-GUYCJALGSA-N	443.431	1.774	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@H](C)NC(=O)CC1CCCCC1	749838897	XNTRPODKUZODFH-AWEZNQCLSA-N	437.566	1.524	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)C[C@H](NC(=O)c1ccccc1)c1ccccc1	751206606	JWFSDGJMKVADIW-SFHVURJKSA-N	434.452	1.718	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)N[C@H]2CC(=O)N(c3cccc(C(F)(F)F)c3)C2)n1	753034144	CYSNAAXVVDOOMY-AWEZNQCLSA-N	438.410	1.655	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)c2cc(S(=O)(=O)N(C)C)c(C)o2)cc1	753565907	MYEAKNSHABAXII-ZDUSSCGKSA-N	439.490	1.466	50	20	IDGD	
Cc1c(C(=O)NNC(=O)CNC(=O)c2ccco2)c(=O)oc2ccc(Br)cc12	755269137	WSKUZGQZHOQYNG-UHFFFAOYSA-N	448.229	1.648	50	20	IDGD	
Cn1c(=O)c2ccccc2n2c(SCC(=O)NNC(=O)c3cccc(Cl)c3)nnc12	755748811	CLKXGVXJADOCIX-UHFFFAOYSA-N	442.888	1.788	50	20	IDGD	
O=C(NC[C@H]1CSCCS1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	756063803	UTKOICOXFUSJLD-AWEZNQCLSA-N	444.604	1.264	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)cc1S(N)(=O)=O	756639478	ZLIYSIBRZUMRBS-UHFFFAOYSA-N	429.499	1.100	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)NNC(=O)C(=O)Nc2ccccn2)c(C)n1C[C@@H]1CCCO1	758822272	PDFFMZPJNLHQKR-RLGUWMIQSA-N	436.472	1.372	50	20	IDGD	
O=C(NNC(=O)c1csc(-c2cnn(-c3ccccc3)c2)n1)C(=O)Nc1ccccn1	758832847	LOKANNUVPDAIPV-UHFFFAOYSA-N	433.453	1.791	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccnn2Cc2ccc(F)cc2)cc1C	760278940	IYISLFYBCSHPDU-UHFFFAOYSA-N	439.447	1.852	50	20	IDGD	
COc1cc(NC(=O)C2CC2)ccc1S(=O)(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	761266106	DNGKSROFPVJPIE-UHFFFAOYSA-N	434.430	1.575	50	20	IDGD	
COc1cc(C(=O)NNc2nccc(N3CCOCC3)n2)cc(OC)c1Br	762864950	GNCYIULVIGPEPL-UHFFFAOYSA-N	438.282	1.850	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)NC1Cc2ccccc2C1	763150661	CZDQQZFMWMRNFW-UHFFFAOYSA-N	442.541	1.973	50	20	IDGD	
O=C(NNC(=O)c1ccccn1)C(=O)Nc1ccc(F)cc1I	763463795	LQPRLQPQUHOUAX-UHFFFAOYSA-N	428.161	1.225	50	20	IDGD	
CCOCCOc1c(Cl)cccc1NC(=O)C(=O)NNC(=O)c1ccc2c(c1)OCO2	763557652	CPNDWIAPDUKWMW-UHFFFAOYSA-N	449.847	1.884	50	20	IDGD	
CCn1cnnc1-c1ccccc1NC(=O)C(=O)NNC(=O)c1c(C)nc2ccccn12	763629699	QYEPFJDREKYSNC-UHFFFAOYSA-N	432.444	1.321	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2ccc(C(=O)NC(C)C)cc2)c1	763644028	DQKZIVNKBCKMDD-UHFFFAOYSA-N	426.473	1.607	50	20	IDGD	
CS(=O)(=O)c1ccccc1NC(=O)C(=O)NNC(=O)CSc1ccc(Cl)cc1	763737067	WVUSVZUKZOKFCM-UHFFFAOYSA-N	441.918	1.622	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)C(=O)Nc2ccc(OC3CCCC3)cc2)c2ccccc2c1=O	763786960	SVOMNNGMKCRJKF-UHFFFAOYSA-N	449.467	1.655	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(N3CCCNC3=O)c2)cc1	763810839	CDLPOFJMAFMIBW-UHFFFAOYSA-N	425.445	1.080	50	20	IDGD	
C[C@H]1CN(Cc2ccccc2NC(=O)C(=O)NNC(=O)Cc2ccc(F)cc2)C[C@@H](C)O1	763918970	NNCVRBRQQMQWEN-IYBDPMFKSA-N	442.491	1.764	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)C(=O)Nc1cccc(CCCc2ccccc2)c1	764001960	HWDXHRSCIVNEAE-SFHVURJKSA-N	443.525	1.383	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cc(Br)cn2C)n(C(C)(C)C)n1	764005309	YAAOCEZYTTULKN-UHFFFAOYSA-N	425.287	1.447	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1ccc(-n2cncn2)c(Cl)c1	764010506	AKEHSKQXINQUOK-UHFFFAOYSA-N	449.254	1.982	50	20	IDGD	
CNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2OC)cc1Cl	764012421	PUJUYPOIKYPIEZ-UHFFFAOYSA-N	439.255	1.761	50	20	IDGD	
O=C(NNC(=O)c1cnccn1)C(=O)Nc1ccnn1Cc1c(Cl)cccc1Cl	764023729	FGSNKNMTUNAIDI-UHFFFAOYSA-N	434.243	1.428	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc(-c2nnnn2C(C)C)c(F)c1	764041074	QHDXMAMWBQPKFB-UHFFFAOYSA-N	441.423	1.468	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3ccc(Cl)cc3O)cn2)C[C@@H](C)O1	764126012	DQHLTYNGDVQECE-TXEJJXNPSA-N	447.879	1.454	50	20	IDGD	
CCN(CC)CCNC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ccoc2)ccc1Cl	764158794	LPOBTRCFIQUKRD-UHFFFAOYSA-N	449.895	1.404	50	20	IDGD	
CCc1cc(O)nc(-c2cccc(NC(=O)C(=O)NNC(=O)CCOc3ccccc3)c2)n1	764160369	AWMQBDSDIPZKMU-UHFFFAOYSA-N	449.467	1.967	50	20	IDGD	
O=C(Cc1ccccn1)NNC(=O)C(=O)Nc1ccnn1Cc1cccc2ccccc12	764266497	FSQVRVVQABHGNZ-UHFFFAOYSA-N	428.452	1.808	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)C(=O)Nc1cccc2c1CCN2C(=O)OC(C)(C)C	764297469	SGCVBMAMERXLJD-UHFFFAOYSA-N	428.449	1.415	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C(=O)Nc1ccc2ccn(CC(=O)NC)c2c1)c1ccccc1	764329669	XXFANTVVOFYVET-SFHVURJKSA-N	435.484	1.667	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)C(=O)Nc1cccc(C(=O)NCc2ccccc2)c1	764352730	CMGLSSLXXXNJFC-UHFFFAOYSA-N	431.452	1.340	50	20	IDGD	
CCNS(=O)(=O)c1ccc(CNC(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)cc1	764371912	ATCSHLIPOOXVRT-INIZCTEOSA-N	448.545	1.900	50	20	IDGD	
Cc1nc(-c2cccc(NC(=O)C(=O)NNC(=O)c3cc(-c4cccs4)[nH]n3)c2)n[nH]1	764377399	OZOXQRXEWDCYSD-UHFFFAOYSA-N	436.457	1.631	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1cc(Br)c(F)cc1Cl	764398585	UNYWORQFGTWNAN-ZETCQYMHSA-N	440.653	1.379	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccc(NC(=O)[C@@H](C)n2cncn2)cc1	764406753	FDZPUABMXYSRNM-OAHLLOKOSA-N	449.471	1.115	50	20	IDGD	
COC(=O)c1cc(F)c(F)cc1NC(=O)C(=O)NNC(=O)c1ccc(Cl)cc1F	764410162	IEIFSDKEDHCLMZ-UHFFFAOYSA-N	429.738	1.944	50	20	IDGD	
C=CCn1c(=O)c2ccccc2n2c(SCC(=O)NNc3nccnc3OC)nnc12	764485988	XUXBEIXETLQNLX-UHFFFAOYSA-N	438.473	1.264	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)ccc1[N+](=O)[O-]	765735248	ISXNPSXDFKIRFL-UHFFFAOYSA-N	425.445	1.122	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)CO[C@H]1CCCN(C(=O)OC(C)(C)C)C1	767852605	JSMZCCYYNWIUEJ-HNNXBMFYSA-N	436.509	1.671	50	20	IDGD	
CC(C)(C)OC(=O)N1CCO[C@H](C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)C1	767956822	BMYRUHMTWGPOJP-ZDUSSCGKSA-N	435.449	1.762	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)[C@@H]3CCCCN3C(=O)C(C)C)n[nH]2)cc1OC	768275890	HYBPGNNFJDTOAF-KRWDZBQOSA-N	443.504	1.892	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)c1ccc(N2C[C@H](C)O[C@H](C)C2)nc1	768641827	WVHOEUIIVZOVIC-OKILXGFUSA-N	434.518	1.864	50	20	IDGD	
CCOC(=O)Cc1nnc(NC(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)s1	770073701	MVQWLFHSDIPTSQ-UHFFFAOYSA-N	435.434	1.789	50	20	IDGD	
CC(C)c1nccnc1NNC(=O)Nc1ccc(F)c(S(=O)(=O)N2CCOCC2)c1	770231468	RCJYIVJTSMARTD-UHFFFAOYSA-N	438.485	1.909	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)c1cccc(Br)n1	770264833	GFQZOHQVNGJCNI-UHFFFAOYSA-N	432.322	1.817	50	20	IDGD	
Cc1ccc(C)c(S(=O)(=O)Oc2ccc(C(=O)NNC(=O)CN3CCCC3=O)cc2)c1	770279344	KPNDVDBIJMWEJG-UHFFFAOYSA-N	445.497	1.455	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)OC[C@H](C)CBr)CC2)cc1	770384756	ZVNOAHGWLOUZQQ-OAHLLOKOSA-N	433.368	1.876	50	20	IDGD	
CCOC(=O)[C@]1(C(C)C)CCN(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)C1	770479847	BMZGIMJGSUROEJ-LJQANCHMSA-N	439.538	1.245	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)N[C@H]1CCO[C@@]2(CCS(=O)(=O)C2)C1	770785441	QJQPLVIKANGYPI-YEWDVWPNSA-N	445.925	1.174	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNS(=O)(=O)c1ccc(CCCl)cc1	771605800	BXKITECISMYGIG-UHFFFAOYSA-N	430.313	1.747	50	20	IDGD	
C[C@@H](CO)NC(=O)/C(C#N)=C/c1cn(CCC(N)=O)nc1-c1ccc(Br)cc1	771779059	LOMUULVLRCGNJU-ACLQVGRQSA-N	446.305	1.592	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)Cc2ccnc(O)c2Br)o1	772144357	BECCJTCPNFWBOP-UHFFFAOYSA-N	425.283	1.988	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)cc(NC(C)=O)c1OC	772183940	RXSYRCFQLARPTL-UHFFFAOYSA-N	448.863	1.393	50	20	IDGD	
CC(=O)N[C@@H](CC(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1)c1ccc(C)cc1	772193218	QWOHHPARKQWVBP-SFHVURJKSA-N	430.892	1.680	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1cc(I)cc([N+](=O)[O-])c1	772231910	QGSORTRLRKJRRU-SSDOTTSWSA-N	435.174	1.302	50	20	IDGD	
COCc1ccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1	772587351	NIEJZXFRJNNPFG-UHFFFAOYSA-N	448.501	1.320	50	20	IDGD	
CN(CCNC(=O)NNC(=O)Cc1c[nH]c2ccccc12)S(=O)(=O)c1cccs1	772621862	AMTLLDDNLWMPCK-UHFFFAOYSA-N	435.531	1.423	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1)S(=O)(=O)c1ccc(F)cc1	772883490	BALMBACSTZVXQA-NSHDSACASA-N	441.868	1.105	50	20	IDGD	
CCCCOc1ccc(NC(=O)C(=O)NNC(=O)c2cc(Br)cn2C)cn1	773500329	STKWLGUAZBBOLO-UHFFFAOYSA-N	438.282	1.761	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2ccnn2Cc2ccccc2Br)n1	773731847	WRCOXVRFCLBAMZ-UHFFFAOYSA-N	446.265	1.574	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)N[C@@H]1CCN(c2cccc(Br)c2)C1=O	775224373	ZXCLOWIOMRFKGB-OAHLLOKOSA-N	432.278	1.523	50	20	IDGD	
Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)C(=O)NNC(=O)C(C)(C)C	775530601	TWRNDYAHNDOGCN-QGZVFWFLSA-N	426.521	1.771	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(OCCC(=O)NNC(=O)c2nnc(O)c3ccccc23)C1	776967883	JCMNPPRTULUGCF-UHFFFAOYSA-N	431.449	1.122	50	20	IDGD	
CC[C@@H](C)Oc1cc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)ccn1	777182812	IUYATOGXDIGZIF-CXAGYDPISA-N	429.429	1.403	50	20	IDGD	
CN(C)C(=O)COc1ccccc1C(F)(F)C(=O)NNC(=O)Cn1cnc2ccccc21	778530680	RGVUFRNOGVAJQB-UHFFFAOYSA-N	445.426	1.443	50	20	IDGD	
Cc1ccc(C(N)=O)cc1NC(=O)C(=O)NNc1ccc([N+](=O)[O-])cc1Br	778754137	FZTCZFMRRFXUHQ-UHFFFAOYSA-N	436.222	1.846	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc(C(=O)O)c(F)c(Cl)c1F)c1ccc(Cl)nc1	779827647	DZJNYUQSRUDDGM-UHFFFAOYSA-N	426.184	1.988	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)c2ccc(-c3ncn(C)n3)cc2)c2ccccc2c1=O	780315490	VCBMCCNITVFUEI-UHFFFAOYSA-N	431.456	1.848	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)c1cnc2ncc(Br)cc2c1	780544565	BTUOTFHSFBJNMR-UHFFFAOYSA-N	434.275	1.645	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)N[C@@H]3CCc4nnc(-c5ccc(F)cc5)n4C3)nc21	780909580	RLJVFMSWFGJBLU-GFCCVEGCSA-N	438.427	1.108	50	20	IDGD	
Cc1cc(C)c(S(=O)(=O)N2CCN(S(=O)(=O)CBr)CC2)c(C)c1	782399039	SFRLETSAEJIVLX-UHFFFAOYSA-N	425.370	1.600	50	20	IDGD	
C[C@@H]1C[C@@H](C)CN(C(=O)c2ccccc2NC(=O)C(=O)NNC(=O)c2ccc(O)cc2)C1	782830079	FMLRWEOVKJKGAF-HUUCEWRRSA-N	438.484	1.910	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCOCC2)cc1NC(=O)C(=O)NNc1ccc(C)cc1	783346572	SAJQTPFZUDJNPT-UHFFFAOYSA-N	448.501	1.106	50	20	IDGD	
C[C@H]1C[C@H](C)CN(S(=O)(=O)c2ccc(NC(=O)C(=O)NN=c3cc[nH]cc3)cc2)C1	783379166	XICRXKORJWXZKR-GJZGRUSLSA-N	431.518	1.252	50	20	IDGD	
CCCOc1ccc(NC(=O)C(=O)NN[C@]2(C)CCS(=O)(=O)C2)cc1OCCC	783424924	GMWSZFXDEBXYNA-LJQANCHMSA-N	427.523	1.401	50	20	IDGD	
Cc1cccc(Oc2ncccc2NC(=O)C(=O)NN[C@@]2(C)CCS(=O)(=O)C2)c1C	783426521	MLKWMJNZAKDHTB-FQEVSTJZSA-N	432.502	1.627	50	20	IDGD	
CCCCN(C)S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccnc(N(C)C)n2)cc1	784970785	MWENRUONBBAMSX-UHFFFAOYSA-N	449.537	1.045	50	20	IDGD	
CC[C@@]1(C)Oc2ccc(NC(=O)C(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)cc2O1	785990232	CVMWLTODUGPFMU-FQEVSTJZSA-N	447.469	1.387	50	20	IDGD	
Nc1ccc([N+](=O)[O-])cc1C(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	787127771	UJWILJRSNZSFOD-UHFFFAOYSA-N	446.895	1.409	50	20	IDGD	
Cc1cccnc1C(F)(F)C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	787441451	QEGMYGGHYGOECI-UHFFFAOYSA-N	431.443	1.087	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3ccn(C4CCN(C)CC4)n3)cc2C1	787542632	CCSWFHHEYFHBKG-ZDUSSCGKSA-N	444.561	1.736	50	20	IDGD	
O=C(O)[C@@H]1CCCN(S(=O)(=O)c2ccc(NS(=O)(=O)CCCCCl)cc2)C1	788062819	ZQIOLMANCJBZSZ-CYBMUJFWSA-N	438.955	1.933	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc3c2OCC[C@H]3N(C)C)cc1OC	789730437	QTYZTEWNYUCWTO-MRXNPFEDSA-N	442.472	1.489	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2cnn(CC(F)F)c2)cc1Br	790067743	BLMJCMVXQJNSMS-UHFFFAOYSA-N	439.238	1.543	50	20	IDGD	
CCCn1c(CCC(=O)NNc2nc3ccccn3n2)nc2cc(S(N)(=O)=O)ccc21	791243458	AOFXTJSTWAPRTE-UHFFFAOYSA-N	442.505	1.212	50	20	IDGD	
COc1cccc(C2=NO[C@H](C(=O)NNC(=O)c3sc(N4CCOCC4)nc3C)C2)c1	792021264	IFONGMLONSJFPF-INIZCTEOSA-N	445.501	1.251	50	20	IDGD	
O=C(NNC(=O)c1cnccn1)C(=O)Nc1ccc(OC(F)(F)F)c(Br)c1	792352724	HQFWBORZSATBLF-UHFFFAOYSA-N	448.155	1.537	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)C[C@@H](CC#N)c2ccccc2)cc1	792805794	AYMPGTPHXJKBIC-GOSISDBHSA-N	428.514	1.851	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cnc(CC3CC3)nc2)cc1	793022302	URNCCTDUMUELDX-CYBMUJFWSA-N	427.461	1.381	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CCC(C)(C)C(=O)NNC(=O)c2cccc(C)n2)n1	794078106	VRORWDLIBKFZLV-UHFFFAOYSA-N	426.477	1.122	50	20	IDGD	
COc1ccc(CCN2C[C@H](C(=O)NNC(=O)c3cccc(C)n3)CC2=O)cc1OC	794080900	SQYZKIGCXDHXMB-MRXNPFEDSA-N	426.473	1.259	50	20	IDGD	
CC(=NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1)c1ccc2c(c1)OCC(=O)N2	794872237	WSXWAMVGBLINMY-UHFFFAOYSA-N	430.486	1.487	50	20	IDGD	
Cc1cc2c(cc1S(=O)(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1)OCO2	794873338	QXVKBHZYKZEKSP-UHFFFAOYSA-N	425.850	1.003	50	20	IDGD	
CC(C)(O)[C@@H](Oc1ccccc1)C(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	795760891	AKZUAQYXHDFCKW-KRWDZBQOSA-N	431.401	1.118	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN2CCN(C(=O)OC(C)(C)C)C[C@H]2C#N)cc1C	796485914	MDCSKNUCGSBNEA-CQSZACIVSA-N	435.550	1.825	50	20	IDGD	
COC(=O)c1cc(F)cc(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3n2)c1F	796992184	SFYJDIZGAJSOBL-UHFFFAOYSA-N	428.351	1.699	50	20	IDGD	
COC(=O)c1ccc(-n2cc(C)cn2)c(NC(=O)C(=O)NNC(=O)c2cccc(C)n2)c1	797369713	FXCLQJVWIZSVIW-UHFFFAOYSA-N	436.428	1.070	50	20	IDGD	
O=C(NC[C@@H]1CCCN1C1CCCCC1)NNC(=O)c1csc(N2CCOCC2)n1	798048307	SLNALGCMDHVECS-INIZCTEOSA-N	436.582	1.721	50	20	IDGD	
CC(=O)N[C@](C)(C(=O)NNC(=O)Nc1ccccc1C)c1ccc(S(C)(=O)=O)cc1	798312853	NEFJQJDEHHCJTP-FQEVSTJZSA-N	432.502	1.603	50	20	IDGD	
Cc1ccccc1NC(=O)NNC(=O)[C@H]1CCCN1C(=O)/C=C/c1ccc(C(N)=O)cc1	798313733	SNASZHRISBHIJI-YFPIXMDGSA-N	435.484	1.951	50	20	IDGD	
COC(=O)c1ccc(S(=O)(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1OC	799123351	VRZMXGAVVLADSJ-UHFFFAOYSA-N	430.442	1.291	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc(O[C@@H]2CCN(C)C2=O)cc1C	799258618	IEFREFVKOPFBHE-GOSISDBHSA-N	440.456	1.013	50	20	IDGD	
O=C(COCc1ccccc1)NNS(=O)(=O)c1ccc(OCCBr)cc1	799532186	NJVXFYNDEPNPSO-UHFFFAOYSA-N	443.319	1.987	50	20	IDGD	
O=C(NCCS(=O)(=O)CCc1ccccc1)NNC(=O)c1cc(Br)c[nH]1	799857674	SRHSLSBSJABQNH-UHFFFAOYSA-N	443.323	1.379	50	20	IDGD	
COc1ccc(-c2nc(C)c(C(=O)NNC(=O)CNC(=O)c3cccnc3)s2)c(F)c1	800335280	YNNSMTSHBYDWTO-UHFFFAOYSA-N	443.460	1.852	50	20	IDGD	
CCOC(=O)COc1ccc(NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1	800561798	MDLFAJHOHYBTPW-UHFFFAOYSA-N	425.405	1.071	50	20	IDGD	
Cc1ccc(F)c(-n2cc(O)c(C(=O)OCC(=O)NNC(=O)c3cccc(C#N)c3)n2)c1	801414953	PHNVLSPIJXCWES-UHFFFAOYSA-N	437.387	1.515	50	20	IDGD	
COc1cccc(C[C@H](C(=O)NNC(=O)Nc2ccc3c(c2)OCO3)n2nnnc2C)c1	802098463	QWQDSLMRKSWRPD-MRXNPFEDSA-N	439.432	1.356	50	20	IDGD	
COc1ccc(Cl)c(NC(=O)NNC(=O)CCN2C(=O)[C@H]3[C@H](C2=O)[C@H]2CC[C@H]3O2)c1	802110861	VVUJAMQYHWIRQK-RRCSTGOVSA-N	436.852	1.054	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@H]2CCN(c3ccc(C#N)cc3F)C2)cc1	804655536	ADKNZZNDCYJBDO-AWEZNQCLSA-N	445.476	1.780	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)C(=O)Nc1cc(CC2CC2)nn1-c1ccccc1	807429072	NFNOBWCVQPXPBG-UHFFFAOYSA-N	443.471	1.882	50	20	IDGD	
Cc1ccc(S(=O)(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)cc1C(=O)OC(C)C	808096885	KLRDHIMFQGSBCL-UHFFFAOYSA-N	437.430	1.797	50	20	IDGD	
COC[C@@]1(C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)CCN(C(=O)OC(C)(C)C)C1	809950818	ZIDSPHXRFMVIAI-HRAATJIYSA-N	435.477	1.247	50	20	IDGD	
O=C(CCc1ccccc1)NNC(=O)CNS(=O)(=O)c1cccc(Br)c1	810284173	LBPMRVFIDUKDGS-UHFFFAOYSA-N	440.319	1.508	50	20	IDGD	
CC1(C)CCCc2sc(NC(=O)C(=O)NNC(=O)[C@@H]3COc4ccccc4O3)nc21	810385685	YUXUWRVHKOVBBQ-ZDUSSCGKSA-N	430.486	1.683	50	20	IDGD	
COc1cc(F)c(F)cc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	810387245	MKQLEWXNLNBOAD-UHFFFAOYSA-N	433.346	1.902	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2cc(CC(C)(C)C)nn2C)cc1	813033582	AGCFPHLBXXEIIL-UHFFFAOYSA-N	436.538	1.341	50	20	IDGD	
COc1ccc(Cl)c(NC(=O)NNC(=O)[C@H](Cc2cnc[nH]2)NC(=O)CC(C)C)c1	813574798	IQEBYZTZVLCXOO-INIZCTEOSA-N	436.900	1.998	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2ccccc2NC(=O)C2CC2)cc1OC	815517970	UVMYYZUPYQNUBC-UHFFFAOYSA-N	441.440	1.670	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)cc2cccnc12	815565956	FQRWTHRNUHRVDE-GFCCVEGCSA-N	426.404	1.936	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(Br)c(C#N)c2)c1O	815568614	OOVULYXKXNEMIR-UHFFFAOYSA-N	433.218	1.435	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNc2ccc(S(C)(=O)=O)cc2)cc1)[C@@H]1C[C@H]1C	815585179	ADPKSNMRPIDWHK-BFUOFWGJSA-N	444.513	1.933	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNc2ccc(C(F)(F)F)nn2)nnn1Cc1ccccc1F	815602515	CMMGQTSKJSRZAC-UHFFFAOYSA-N	438.345	1.665	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCc2nncn2C1)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1	816876559	ZLRABNDKVMHRJN-INIZCTEOSA-N	435.444	1.822	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)N2CCC(NS(C)(=O)=O)CC2)c(C)n1C[C@@H]1CCCO1	843901592	QZZLMHRDRVOYOP-YWFITGJYSA-N	434.562	1.731	50	20	IDGD	
CS(=O)(=O)CC[C@H](NS(=O)(=O)c1ccccc1)C(=O)NNc1ccc(F)cc1	849838716	QABDYSQCTRKEOC-INIZCTEOSA-N	429.495	1.051	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)CN1C(=O)N[C@]2(C[C@@H](C)CC(C)(C)C2)C1=O	871631308	CHNNYPOGEJRZJA-WNSKOXEYSA-N	444.532	1.912	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)[C@H]2CC(=O)N(C3CCCCC3)C2)cc1OC	914934490	YFRRIQGQGVEOPT-HNNXBMFYSA-N	447.488	1.189	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)c1ccccc1S(=O)(=O)C(F)(F)F	915131251	MLSJWFWWRAERGU-CYBMUJFWSA-N	430.360	1.581	50	20	IDGD	
O=C(Cc1csc(Cc2cccc(Cl)c2)n1)NNC(=O)[C@H]1CCS(=O)(=O)C1	915142222	ZYRPNZLBCWBZLM-LBPRGKRZSA-N	427.935	1.512	50	20	IDGD	
O=C(NNC(=O)c1cccc2[nH]ncc12)c1cccc(S(=O)(=O)N2CCCCC2)c1	915188155	CKNGPZUJPJWHBJ-UHFFFAOYSA-N	427.486	1.812	50	20	IDGD	
COc1cccc(C[C@H](C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)n2nnnc2C)c1	915696723	HYRMQBBWSRXKEF-SCLBCKFNSA-N	442.451	1.528	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cc(C(=O)NNC(=O)c2cc[nH]n2)ccc1Cl	916148191	JUUVJVMVNPXFOH-UHFFFAOYSA-N	449.876	1.947	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCCOc2ccc(OC)cc2)c2ccccc2c1=O	916214648	SDHHPYYNCNPVQJ-UHFFFAOYSA-N	425.445	1.448	50	20	IDGD	
CC(=NNC(=O)c1ccccn1)c1ccc(S(=O)(=O)N2CCCC[C@@H]2C(=O)O)cc1	916247087	YWUIBHVIXPYVCZ-GOSISDBHSA-N	430.486	1.863	50	20	IDGD	
COc1ccc2c(c1)C(=NNC(=O)CN1c3cccc4cccc(c34)S1(=O)=O)C(=O)N2	916367934	CWHRYYDEJLOXCU-UHFFFAOYSA-N	436.449	1.830	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)Nc1cccc(CN2C(=O)CNC2=O)c1	920933564	WNWXNWUNPLKKKR-LBPRGKRZSA-N	429.408	1.498	50	20	IDGD	
N#Cc1ccc(N2C[C@H](C(=O)NNC(=O)c3cc(Br)ccc3O)CC2=O)cc1	1116151033	YOIKJEDUIPYRDB-GFCCVEGCSA-N	443.257	1.840	50	20	IDGD	
CCN(CC)c1ccc(S(=O)(=O)N(CC)CC)cc1NC(=O)NNC(=O)CCO	1320277034	ZONFCRNQPVJHBZ-UHFFFAOYSA-N	429.543	1.098	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2ccc(C(=O)NNc3nncc(N)c3Cl)cc2)C[C@H](C)O1	1324009521	RWCZZCKQRLHYAE-QWRGUYRKSA-N	440.913	1.267	50	20	IDGD	
CC1=CC[C@@H](C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C3)CC1	1778750047	KTFWNHJIJJYJEL-DNVFCKCGSA-N	434.581	1.620	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cncc(C(F)(F)F)c3)C2)C1	1779751148	SESVXULAOCVNDN-YOEHRIQHSA-N	435.830	1.798	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)cc1NC(C)=O	1780214178	BDISAIFKLCSEAJ-LJQANCHMSA-N	444.315	1.901	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H]1CCC(=O)NC1)C2	1780706017	DMTPOTIEXIIIDI-WTVLQJKYSA-N	434.364	1.263	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1ccc(F)cn1)C2)[C@H](F)Br	1780771500	IZKQSDOXNZYLRZ-UWWQBHOKSA-N	446.292	1.968	50	20	IDGD	
CCOc1cccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](O)CCl)C3)c1O	1781108842	HGUBDSPVQNTAIW-QLVMHMETSA-N	440.924	1.518	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cc(Cl)c4nncn4c3)CCO2)C1	1781222155	WYNHBYFPCVOQCW-SCLBCKFNSA-N	426.304	1.844	50	20	IDGD	
Cn1ncc2cc(C(=O)N3CCO[C@@]4(CCN(C(=O)[C@H](F)Br)C4)C3)ccc21	1781330167	RXALJFRNVATPRH-MAUKXSAKSA-N	439.285	1.707	50	20	IDGD	
O=C(c1ccnc2ncccc12)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781331959	BRWFSOPELUQERO-KSSFIOAISA-N	437.269	1.764	50	20	IDGD	
CC(=O)N[C@@](C)(C(=O)N1CC[C@@]2(CN(C(=O)[C@H](F)Cl)CCO2)C1)c1ccccc1F	1781415940	IGVAIJQNQWHAFQ-PWIZWCRZSA-N	443.878	1.541	50	20	IDGD	
Cc1n[nH]c(C)c1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)Br)C1	1781997956	OVPLWLWFOHNORD-YRILPIOLSA-N	427.343	1.937	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(O)ccc3O)C2)C1	1782049515	VKSXKTFKSQSCAN-KBXCAEBGSA-N	427.295	1.715	50	20	IDGD	
N[C@@H](Cc1cccnc1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C(Cl)Cl)C1	1782217337	CWQDPWHVRJSGGQ-QMTMVMCOSA-N	429.348	1.269	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)CCc3ccc(O)nn3)C2)C1	1782635170	GUCNBRMKRBZBQP-ZWKOTPCHSA-N	431.320	1.181	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)C1CC2(CCC2)C1	1782794329	RHNGQPWZCCNTBZ-HYBUGGRVSA-N	440.349	1.074	50	20	IDGD	
C/C(=C\c1cccs1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]21	1783492748	YQNNTQORDRKGRU-MXQYBANVSA-N	448.589	1.504	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](C)NC(=O)OC(C)(C)C)CCO2	1783540175	SUNDHWYKVVKZTL-SNUQEOBHSA-N	448.358	1.513	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)N2CC[C@@]3(CN(C(=O)[C@@H](F)Cl)CCO3)C2)C1	1783550075	RPYXYAXVYRSOBL-SXGZJXTBSA-N	447.935	1.998	50	20	IDGD	
CC1(C(=O)N2CC[C@]3(CN(C(=O)c4cnccc4C(=O)NN)CCO3)C2)CCCCC1	1783816553	BESUEVPVHWEQCX-QFIPXVFZSA-N	429.521	1.099	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)C[C@@H](C)NC(=O)OC(C)(C)C)CCO2)C1	1783876024	QTTPZCSEFFLGGM-QEEYODRMSA-N	447.960	1.373	50	20	IDGD	
CC(=O)Nc1ccccc1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1785100929	AMGGIZDZKDBUQG-MAUKXSAKSA-N	442.285	1.779	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3cncnc3)[C@H]2C1	1785392821	XAPUVAAKPUAPFJ-VGWMRTNUSA-N	425.327	1.172	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3ncccn3)[C@H]2C1	1785419490	LLSNOEJSFOPJNP-QPSCCSFWSA-N	425.327	1.030	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccn4nccc34)C[C@@H]21	1786407209	KRSNSHZTXMTVLX-QRTARXTBSA-N	435.322	1.713	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc(N)s3)[C@H]2C1	1786931788	VZUYPLNHDHWGEE-BJDJZHNGSA-N	431.356	1.350	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3cncnc3)[C@H]2C1	1787045821	ODSWSKLDGGUNKK-OEAJRASXSA-N	425.327	1.172	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]3C2)C1	1787451244	CEYHWMWPQUIGKD-JKQORVJESA-N	447.935	1.758	50	20	IDGD	
Cn1cc(CCC(=O)Nc2ccc(C3(NC(=O)c4cccc(B(O)O)c4)CCC3)cc2)cn1	1788175550	GDSGNVJGCUHXND-UHFFFAOYSA-N	446.316	1.480	50	20	IDGD	
CC[C@H](Cl)C(=O)NC1(c2ccc(NC(=O)c3cc(=O)n4[nH]nnc4n3)cc2)CCC1	1788408499	FVXVIVYVEMRMID-ZDUSSCGKSA-N	429.868	1.578	50	20	IDGD	
C[C@H](Cn1cncn1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]21	1788725990	DIQIUIYNDGVVRF-ZFHCCXERSA-N	432.352	1.130	50	20	IDGD	
CCCC(=O)N[C@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)Br)C[C@@H]21	1788743582	DNMGDDSBUYKOPI-AICCOOGYSA-N	432.359	1.054	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(CO)o3)[C@H]2C1	1788898267	ZXZGJRSNBPJTOF-DSPQJCBJSA-N	429.311	1.396	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)c1ccc2nn[nH]c2c1	1790536080	XMHBVOITTOKNFB-LWWSYDQCSA-N	440.273	1.242	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(C)nn3C)C[C@@H]21	1790961895	WPTQJKHVJHWTNF-AYDFFVQHSA-N	427.343	1.495	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4nncn4c3)C[C@@H]21	1791056148	OZSQOPRJZULJIS-MXAVVETBSA-N	436.310	1.106	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3ncccc3OC)C[C@@H]21	1791252375	IHQNYABRYYBYQA-GGXPGOJBSA-N	439.940	1.256	50	20	IDGD	
C[C@@H](Sc1ccccn1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21	1791579685	SVXXIVJYBIODHX-YXMSTPNBSA-N	427.954	1.142	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1C[C@H]1c1ccc(F)c(F)c1	1793047732	CUXOYVZEVNNXFF-GNRYUNBRSA-N	442.890	1.912	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccn(C)n1	1795156324	OCRLSIOQHVGLEI-QDMKHBRRSA-N	441.444	1.819	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H]2C[C@@]21C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Cl	1796369553	YVFCOYSHJHMNGM-QCXOTSQMSA-N	445.919	1.510	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(Cl)nn1)C2	1796891962	RFHYMTVALYXEHO-BQELMUNXSA-N	443.895	1.516	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc2c(c1)CCCC2=O	1797552047	PTQLEDCADIIPGW-REPLKXPHSA-N	440.544	1.830	50	20	IDGD	
COc1ccc2[nH]cc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)CO[Si](C)(C)C)C4)c2n1	1798485640	ZLNMTRLLLONTPK-HBCWATKFSA-N	446.580	1.626	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnc2snnc2c1	1798505288	AQAPXHIPKGPRSP-QTFJUKGGSA-N	444.344	1.526	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)c1ccc(O)cc1	1799301635	VYVUOKSFJOYWQY-ADAAFCRPSA-N	425.323	1.869	50	20	IDGD	
Cc1nc[nH]c1CSCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Br	1799350370	XHZRFXNYCUFSAW-BAESOJJISA-N	449.346	1.231	50	20	IDGD	
CC#C[C@@H](CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](Cl)COC)C2)c1ccc(O)cc1	1801055369	OVHIBZAQJKPRPX-BCOJKNMUSA-N	448.947	1.733	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1[C@@H](O)CCN1Cc1ccccc1	1801385514	SVMLHHMBBFDYLN-ZPLOVTKXSA-N	449.979	1.514	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H]2C[C@@]2(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](O)CCl)C3)C1	1801893809	PLWANFGBJRMXRD-ATCDCCBLSA-N	441.956	1.481	50	20	IDGD	
COc1ccc(CC(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]2c2cccnc2)cc1O	1803136903	GCTMTHXYTYEHJQ-HGHGUNKESA-N	447.919	1.644	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cnn3cccc(F)c23)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803146875	CWFYMLCEXMDGBR-JCGIZDLHSA-N	445.882	1.788	50	20	IDGD	
CC(C)(C)OC(=O)N1CCO[C@@H](C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](F)Cl)C3)C1	1804608607	JWHKUDCLUVSIHF-XLWJZTARSA-N	433.908	1.795	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)Cc2ncccn2)[C@H]1c1cccnc1	1804692915	CTZRQRGJBGMEGS-DHSIGJKJSA-N	432.322	1.904	50	20	IDGD	
Cc1cc(C)n2ncc(C(=O)N3CCC4(CCCN(C(=O)[C@H](O)CCl)C4)CC3)c2n1	1805524503	QEUNENBOBIXXHF-QGZVFWFLSA-N	433.940	1.791	50	20	IDGD	
Cc1cc(C(=O)NC[C@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)on1	1805709731	QRWODURLNRORHK-UZLBHIALSA-N	428.493	1.071	50	20	IDGD	
CC[C@H](C(=O)N1CCCC2(CCN(C(=O)c3cccc(B(O)O)c3)CC2)C1)N(CC)CC	1806170119	WLYLWUXPZZEYQI-OAQYLSRUSA-N	443.397	1.332	50	20	IDGD	
Cc1ncccc1CCC(=O)N1CCCC2(CCN(C(=O)c3cccc(B(O)O)c3)CC2)C1	1806817506	BOFNIJCDZYKEKN-UHFFFAOYSA-N	449.360	1.547	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)NC[C@@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1	1808225372	BILNVEAPSMBVDZ-OFQRWUPVSA-N	440.342	1.319	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)N2CCN(C)CC2)[C@@H]1c1cccnc1	1808273580	DKFBCSYVUCFNNY-BTHPGYMESA-N	436.000	1.741	50	20	IDGD	
CC[C@H](C)[C@H](N)C(=O)N1CCCC2(CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CC2)C1	1809706888	GWDPDUBRGMLZRL-LSEIFRKASA-N	444.580	1.725	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2cc3n(n2)CCC3)[C@H]1c1cccnc1	1809985050	QTBURTWWKXIGRO-VDZJLULYSA-N	431.924	1.798	50	20	IDGD	
Cc1noc(CC(=O)N2CC[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]2c2cccnc2)n1	1810542827	ZZSFMDLSPXXUJK-OXJNMPFZSA-N	431.569	1.873	50	20	IDGD	
Cc1nc(C)c(C(=O)NC[C@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)o1	1810876395	HJXYGWJCTDGBTR-XLIONFOSSA-N	442.520	1.379	50	20	IDGD	
COc1ccc(C(=O)NC[C@@H]2CCN(C(=O)[C@H](C)Br)[C@@H]2c2cccnc2)nn1	1811209428	MAIKWOGRFKEICZ-RVSPLBMKSA-N	448.321	1.983	50	20	IDGD	
Cc1ccccc1C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1811775550	CZPAHTXGTUAMBA-OFNKIYASSA-N	443.312	1.703	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)[C@@H]2CNC(=O)C2)[C@H]1c1cccnc1	1812778653	JBFMZQLZYTYSMY-JKQORVJESA-N	437.338	1.397	50	20	IDGD	
O=C(Cn1cnc2ccccc21)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1	1812966197	KQVJVXWLWGXVGI-LRQRDZAKSA-N	441.919	1.737	50	20	IDGD	
CCC[C@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(=O)n3[nH]nnc3n2)[nH]n1	1815318943	QGQKWQZEEJAAGX-GXFFZTMASA-N	447.887	1.249	50	20	IDGD	
Cc1ccc(C(=O)N[C@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)s1	1815339795	OVUREHGYDNCPAF-AWEZNQCLSA-N	441.343	1.732	50	20	IDGD	
O=C(Cn1nnc2ccccc21)Nc1cc([C@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1	1815546823	WJNQNOOAWBMLQF-GDBMZVCRSA-N	431.884	1.446	50	20	IDGD	
Cc1cc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)c(C)o1	1816414912	NMPMLSONJKOVDO-LJQANCHMSA-N	436.277	1.919	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CN2CCOCC2)n[nH]1	1817150512	GFCVNQZHQXAPGX-TZMCWYRMSA-N	428.331	1.517	50	20	IDGD	
O=C(CN1CCCC1=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](F)Br)[nH]n1	1817160022	PLYZOBHJPWWVFA-NHYWBVRUSA-N	430.278	1.715	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)CCc2ccc[nH]2)[nH]n1)c1cccc(B(O)O)c1	1817475606	VJNXYABXPGQXKV-IBGZPJMESA-N	435.293	1.356	50	20	IDGD	
Cc1ncc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)s1	1818410136	DRQDETBHPLROBO-AWEZNQCLSA-N	433.538	1.854	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc3n(n2)CCCO3)n[nH]1	1819091089	PBDWAMNKLDTQEG-IUODEOHRSA-N	436.900	1.948	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](C)N3C[C@H]4C[C@@H]4C3)sc2C1	1819579503	FJIKDRJMOGYADN-MRTXSQPYSA-N	426.970	1.649	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1[nH]cc2c1CCC2	1820103749	FQPOMSFZXRVBSX-LJQANCHMSA-N	447.304	1.526	50	20	IDGD	
COc1cccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)n1	1822412851	HYISUGHBEFIKKQ-INIZCTEOSA-N	443.508	1.492	50	20	IDGD	
Cc1ccc(CC(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)o1	1822903276	GWIDANTVSPJXPM-IBGZPJMESA-N	436.277	1.540	50	20	IDGD	
O=C(Cn1nnc2ccccc21)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)CC1	1824177834	ADEJCRPUTYAPEB-HKUYNNGSSA-N	433.940	1.651	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)C23CC(F)(C2)C3)CC1	1824577772	ZJKJFGSEFMEKOE-BVVFMGSASA-N	428.313	1.492	50	20	IDGD	
C=CC[C@H](C)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnccc1C(=O)NN)CC2	1825125949	AWWSGQXEZWJOIL-NWDGAFQWSA-N	428.518	1.580	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(O)n(C)n1)CC2	1825445382	UYOMJGDUFZYUKW-BDAKNGLRSA-N	442.339	1.982	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCc1ccc(O)nn1)CC2	1826004854	SMNWQDYXESBWJL-RYUDHWBXSA-N	439.925	1.437	50	20	IDGD	
CC[C@@H](NC)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)CC1	1827037150	OZTGUCDTHJUIDQ-SANVWHIPSA-N	444.580	1.738	50	20	IDGD	
C[C@@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1)n1cccc1	1827055476	YMXPDMLUOIEUDU-PGRDOPGGSA-N	437.349	1.662	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC[C@H]1C1CCN(C(=O)C(F)(F)Cl)CC1	1827060673	WTRYWVKXAFPFRX-INIZCTEOSA-N	428.672	1.431	50	20	IDGD	
CCN(C)[C@H](C)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1	1828924420	QRADGWWAFKUIGC-OXQOHEQNSA-N	444.580	1.259	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ncon2)CC1	1829503290	OLDKCOOENBBTEJ-PTZPRWATSA-N	441.492	1.437	50	20	IDGD	
COc1cc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)nn1C	1829847163	YYKQDNWZRSONAT-SFHVURJKSA-N	448.568	1.035	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCCC(=O)OC(C)(C)C)CCO2)C1	1830803219	GDAKFQBSHPTMPP-IIBYNOLFSA-N	446.972	1.972	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(OC)ccn3)C2)C1	1831650768	KYRGMIKBMQAVFJ-UZLBHIALSA-N	425.913	1.568	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)C2=COCC2)CC1	1832413476	OJQLBMKRMSEIFW-LJQANCHMSA-N	427.505	1.223	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3ncccc3C)CCO2)C1	1832781163	GILYKVBKFXOYAR-DYESRHJHSA-N	439.940	1.033	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)CCN2CCCC2)CC1	1832966146	NWOVRZPNNWRHMO-QFIPXVFZSA-N	441.381	1.086	50	20	IDGD	
O=C(CN1CCCC1)NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1833101122	DFXLIQZDXJSNAG-QGZVFWFLSA-N	433.366	1.344	50	20	IDGD	
C[C@@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](O)C(C)(C)C)CC2)CC1	1833264499	DCTHNMXBRMQTJP-WMLDXEAASA-N	446.430	1.996	50	20	IDGD	
C#CCO[C@H](C)C(=O)NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1	1833463284	FBGFHQKSMXPUOK-OAHLLOKOSA-N	428.371	1.381	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)C(C)(C)NC(C)=O)CC2)CC1	1833485008	WUHTZCPPDAOLLI-SFHVURJKSA-N	429.005	1.880	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)[C@H](F)c1ccccc1	1833652230	BKGONECAXPULJJ-RBUKOAKNSA-N	425.932	1.869	50	20	IDGD	
Cc1ccn(CC(=O)NC2CCN(C3CCN(C(=O)[C@](C)(Cl)CCl)CC3)CC2)n1	1833853892	PQTPUBMWEBMVHY-HXUWFJFHSA-N	444.407	1.999	50	20	IDGD	
CC(=O)N/C(C)=C/C(=O)N1CCC(N2CCC(NC(=O)CCBr)CC2)CC1	1834424073	DXCOBZPBGNHXGQ-BUHFOSPRSA-N	443.386	1.383	50	20	IDGD	
Cc1nc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@](C)(Cl)CCl)C3)C2)cs1	1834456948	FKEAYUAKQASGPF-SJORKVTESA-N	436.361	1.758	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](F)Cl)CC2)CC1)c1ccc2c(n1)OCCO2	1835042110	QMUGVMMEAAUYLC-QGZVFWFLSA-N	440.903	1.572	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cnc(OCF)cn3)CC2)CC1)[C@H](F)Cl	1835078608	OUVCLMVQIUQFQY-INIZCTEOSA-N	431.871	1.502	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)CCN3CCCCC3)CCO2)C1	1835128428	CRABTHMTKHFGJT-NRFANRHFSA-N	429.989	1.584	50	20	IDGD	
Cn1ncc2cc(C(=O)NC3CCN(C4CCN(C(=O)[C@H](O)CCl)CC4)CC3)ccc21	1835414704	PBFGYTOHHGNFBG-HXUWFJFHSA-N	447.967	1.358	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)c1n[nH]c2ccccc12	1835561271	NKIVPZGCUQZLLB-SFHVURJKSA-N	433.940	1.348	50	20	IDGD	
CC(C)N[C@@H](C(=O)N1CCO[C@]2(COCCN(C(=O)CCBr)C2)C1)C(C)C	1835895287	YPFHGJBUCCLARP-MJGOQNOKSA-N	448.402	1.250	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)n1cccc1C=O)CCO2	1835950877	XXOZOPBUQMTRDZ-PLMTUMEDSA-N	439.940	1.726	50	20	IDGD	
CC(C)(C)NCC(=O)N1CCC(N2CCC(NC(=O)[C@@H](F)Br)CC2)CC1	1836412255	AVPCLMCATSKDFJ-MRXNPFEDSA-N	435.382	1.637	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](C)n3cnnn3)CC2)CC1	1836921852	AZWQVVQDHXRSOT-PBHICJAKSA-N	426.949	1.640	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc4ncncc4c3)CCO2)C1	1837022057	CPMNCNVGBZVLEF-QFIPXVFZSA-N	446.935	1.965	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(Cl)cn3)CCO2)C1	1837899824	VOCPRGUBDHQTBC-PXAZEXFGSA-N	446.729	1.588	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(C)n(CC)n3)CCO2)C1	1838147217	WRDBUYXJRCTORH-OXJNMPFZSA-N	426.945	1.689	50	20	IDGD	
Cc1cc(C(=O)N2CCC(OC3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)cn1C	1838151420	GRPLSBAGTDVBFJ-UHFFFAOYSA-N	447.580	1.319	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C)nn3C(F)F)C2)C1	1839146062	JIDPSWWHHWFYHZ-ACJLOTCBSA-N	434.871	1.674	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4c(c3)C(=O)CC4)C2)C1	1839148495	ZKLDPDNRWYEOIH-PGRDOPGGSA-N	434.920	1.903	50	20	IDGD	
Cc1cccnc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2	1839150437	MPDCSGZFJLEWCE-OALUTQOASA-N	430.332	1.696	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CCCn3cccc3)C2)C1	1840036113	FQAAUQGRZXYKQW-APWZRJJASA-N	442.354	1.508	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(Cl)nc3)C2)C1	1840149623	VWJFTHPOYYSFEQ-KBXCAEBGSA-N	432.304	1.059	50	20	IDGD	
C#CCCCCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](Br)CC)C2)C1	1840295114	WXGHVZCCHPFDFL-APWZRJJASA-N	429.355	1.810	50	20	IDGD	
COc1cc(CC(=O)N2CC3(CCCN3C(=O)[C@@H](O)CCl)C2)cc(OC)c1OC	1841350363	XZCZAMSNGZOFSL-AWEZNQCLSA-N	426.897	1.058	50	20	IDGD	
CN(CC(=O)N1CCCC12CN(C(=O)[C@@H]1CCCCO1)C2)NC(=O)NCc1ccccc1	1845038396	YIEBXUHSBUFDNM-IBGZPJMESA-N	443.548	1.105	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC2(CCCN2C(=O)Cc2cc[nH]n2)C1	1845826042	NDKGZBXERHDHHQ-AWEZNQCLSA-N	425.917	1.288	50	20	IDGD	
COCC1(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CC1	1847798392	JFFDLNGTHSJTDN-KKUMJFAQSA-N	429.945	1.747	50	20	IDGD	
CCC1(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)COC1	1848098717	SEVKUCXMOFBHOE-KKUMJFAQSA-N	429.945	1.747	50	20	IDGD	
Cc1onc(-c2ccccc2)c1C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	9457002	OMACHURKUIYNLF-KRWDZBQOSA-N	437.408	1.794	50	20	IDGD	
O=C(COC(=O)c1ccc(Cl)c([N+](=O)[O-])c1)NNC(=O)[C@H]1COc2ccccc2O1	11025149	IJONZUBGQCXWMY-OAHLLOKOSA-N	435.776	1.392	50	20	IDGD	
CCn1c(=O)c2ccccc2n(CC(=O)NNC(=O)CSc2ccc(C)cc2)c1=O	12673744	PLHHPOUOYDOJQL-UHFFFAOYSA-N	426.498	1.431	50	20	IDGD	
O=C(CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)NNC(=O)[C@H]1COc2ccccc2O1	14801188	QRHVNMXTDSNINP-QGZVFWFLSA-N	442.384	1.270	50	20	IDGD	
O=C(CN1CCSC1=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	15427608	QSKIHDUNVXBDLH-UHFFFAOYSA-N	448.526	1.095	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@H](C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)C(C)C)cc1	17329851	KTDAOLBFIRFDLD-KRWDZBQOSA-N	434.474	1.667	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)CN1C(=O)COc2ccc([N+](=O)[O-])cc21	105038567	NZZBILGQAHHFTA-LLVKDONJSA-N	432.364	1.074	50	20	IDGD	
COc1ccc(CN2C[C@H](C(=O)NNC(=O)COc3ccc(C)c(C)c3)CC2=O)cc1	726523332	JDGSPQJLEWYEOH-GOSISDBHSA-N	425.485	1.887	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C[C@H](C)NC(=O)C2CCCCC2)c2ccccc2c1=O	727365242	OYTDQAGMMRNGOL-AWEZNQCLSA-N	427.505	1.653	50	20	IDGD	
Cc1noc(C)c1S(=O)(=O)N1CCC[C@@H](C(=O)NNc2nc(-c3cccnc3)no2)C1	728076011	TTXJLYFMXNNALI-CQSZACIVSA-N	447.477	1.280	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)N[C@@H](C)c2ccc3c(c2)CC(=O)N3C)nc1	728398313	AYSMDPLRYRNECQ-ZDUSSCGKSA-N	446.533	1.675	50	20	IDGD	
O=C(Cc1cccnc1)NN=C1C(=O)N(Cc2ncon2)c2ccc(Br)cc21	728786561	NCKPTUJGAYKIMF-UHFFFAOYSA-N	441.245	1.837	50	20	IDGD	
CC(C)c1c(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cnn1-c1ccccn1	728846142	SIEFEYBDFKJDMV-UHFFFAOYSA-N	434.504	1.858	50	20	IDGD	
COc1cccc([C@H](C)N2CCN(CC(=O)NNC(=O)Cc3nc(C)cs3)CC2)c1	728930961	WROXROHBLCLALB-INIZCTEOSA-N	431.562	1.529	50	20	IDGD	
COCCOc1ccccc1CNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1	728946968	NRFCQGCDAKVBEH-UHFFFAOYSA-N	428.493	1.249	50	20	IDGD	
CCN(CCNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)C(=O)OC(C)(C)C	729229992	QIPAFNIFLATAFJ-UHFFFAOYSA-N	435.529	1.280	50	20	IDGD	
CCc1ccc(C(=O)NN=c2cc[nH]c3ccccc23)cc1S(=O)(=O)N1CCOCC1	730290846	SIJOWSOJPATJBH-UHFFFAOYSA-N	440.525	1.997	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])c1	731058974	JXAKOTYRHJXDFJ-UHFFFAOYSA-N	434.836	1.821	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)CC2CCN(C(=O)OC(C)(C)C)CC2)C[C@@H](C)O1	732259261	BNQSMOOKLDWNQN-HZPDHXFCSA-N	426.558	1.670	50	20	IDGD	
CC[C@@H](C)NS(=O)(=O)c1ccc(C(=O)NNc2ccccc2S(C)(=O)=O)cc1	732303465	FXWPCNSVHPWUKV-CYBMUJFWSA-N	425.532	1.924	50	20	IDGD	
O=C(COC(=O)c1cn(-c2ccc(Cl)cc2)nn1)NNC(=O)c1cccc([N+](=O)[O-])c1	732326979	DBPVZXZCIHRANZ-UHFFFAOYSA-N	444.791	1.447	50	20	IDGD	
CS(=O)(=O)Cc1ccc(S(=O)(=O)NNC(=O)c2cccc(OC(F)F)c2)cc1	734807112	GKXGYHYQLSLHAX-UHFFFAOYSA-N	434.442	1.456	50	20	IDGD	
Cc1nc(-c2cccnc2)nc(NNC(=O)c2cc(NS(C)(=O)=O)ccc2O)c1C	736693877	JQTXYBRHRAOJJG-UHFFFAOYSA-N	428.474	1.989	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)CNC(=O)c2cccc(OC)c2)cc1C	736756687	FJPMIPYEJAPMKI-UHFFFAOYSA-N	433.486	1.362	50	20	IDGD	
CCc1cc(NNC(=O)c2ccc(CCNS(C)(=O)=O)cc2)nc(-c2ccccn2)n1	738531404	ZDVUNGODKQXNCS-UHFFFAOYSA-N	440.529	1.950	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NCC[S@@](=O)C(C)(C)C)c2ccccc2c1=O	741412068	KSDXMWJPQQYMOV-SSEXGKCCSA-N	435.550	1.688	50	20	IDGD	
COC(=O)c1ccc(N2CCN(CC(=O)NNC(=O)c3cccc(C#N)c3)[C@@H](C)C2)cc1	744393336	MFEVRHVETBHUQA-INIZCTEOSA-N	435.484	1.317	50	20	IDGD	
Cc1cc2nc(C)c(CCC(=O)OCC(=O)NNC(=O)c3ccc(C#N)cc3)c(C)n2n1	744587783	OCKLFYXGGDKYSK-UHFFFAOYSA-N	434.456	1.463	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)c2cn(CC(=O)C(C)(C)C)nn2)cc1C	745519004	ROFJHUWQGBPHAY-UHFFFAOYSA-N	435.506	1.444	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H]2CCN(C)[C@H](C)C2)c1	745855747	YIEHYBMVWUFNEQ-ZBFHGGJFSA-N	425.555	1.144	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)c1ccc(F)cc1Br)CN1CCN(C)CC1	745863245	URRGEJTULQNZEX-LBPRGKRZSA-N	430.322	1.416	50	20	IDGD	
Cc1csc([C@@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)C2CC2)n1	745863831	JJAWSLSHNSSEBK-HNNXBMFYSA-N	437.547	1.797	50	20	IDGD	
NS(=O)(=O)c1ccc(O)c(C(=O)NNC(=O)c2ccc(COc3ccccc3)o2)c1	747336375	GHQQSMLSMNWUDB-UHFFFAOYSA-N	431.426	1.286	50	20	IDGD	
O=C(CS[C@@H]1CCS(=O)(=O)C1)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1	748523151	NEYWACNFTPEHKV-SNVBAGLBSA-N	432.467	1.344	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1=O	748632989	FRLPEXSZJGMNPA-IUODEOHRSA-N	444.435	1.165	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)NCC(=O)NNc2cc(F)cc(OC)c2)cc1	748912104	OKOWQWIEULPOLZ-UHFFFAOYSA-N	425.438	1.433	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCn2cncc2C1)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	749568578	OGGJKGRYWVAYSG-IBGZPJMESA-N	442.483	1.609	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN(C(=O)c2ccc3n[nH]cc3c2)C1)c1ccc2c(c1)OCO2	751290642	NYUKBLIEHROADJ-OAHLLOKOSA-N	435.440	1.605	50	20	IDGD	
COc1cc(OC)cc(N2C[C@@H](C(=O)NNC(=O)c3ccc4c(c3)OCO4)CC2=O)c1	752400879	WKDZDTJRRSDQMS-ZDUSSCGKSA-N	427.413	1.247	50	20	IDGD	
CCc1cc(Br)ccc1NNC(=O)CNS(=O)(=O)c1cn(C)c(C)n1	753174199	CCSGZXLWWRHSQK-UHFFFAOYSA-N	430.328	1.475	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)N[C@@H]1CCCN(Cc2ccccn2)C1=O	753297172	HFBQPLWHEKVYGO-QGZVFWFLSA-N	441.488	1.381	50	20	IDGD	
CCCC[C@H](NC(=O)[C@H](C)NC(=O)C(C)(C)C)C(=O)NNc1cc(Cl)nc(N)n1	753450340	TWWSCCRMUOSSML-QWRGUYRKSA-N	427.937	1.381	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2ccc(S(=O)(=O)N(C)OC)cc2)cc1OC	755533069	GWHORUNSJWIFNA-UHFFFAOYSA-N	438.462	1.352	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)Nc1cccc(N2CCCS2(=O)=O)c1	755890424	RNIWJQUOXKFXJL-ZDUSSCGKSA-N	436.465	1.986	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)ccc1NC(=O)OC(C)(C)C	755940945	ZBWPZKXCGURXJH-SNVBAGLBSA-N	445.498	1.133	50	20	IDGD	
CN1CCCCC/C1=N\S(=O)(=O)c1ccc(NC(=O)NNC(=O)c2cnccn2)cc1	756113773	KOUQGYCLXLGLHQ-KOEQRZSOSA-N	445.505	1.536	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1N1CCOC1=O	756812576	FKJZTAXLXXBZKA-UHFFFAOYSA-N	428.401	1.890	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)c2c(F)ccc(S(=O)(=O)NC3CC3)c2F)nc1	759722003	SXSMWYFPWCSITD-UHFFFAOYSA-N	426.401	1.344	50	20	IDGD	
C[C@@H](CC(=O)NNC(=O)Cc1c[nH]c2ccccc12)NS(=O)(=O)c1cccnc1Cl	760282628	QSQHQAWYTCMNIO-LBPRGKRZSA-N	449.920	1.663	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1c[nH]c2ccc(Oc3ccccc3)cc2c1=O	760815011	FLKICBXHBRCESJ-LBPRGKRZSA-N	444.469	1.019	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H]1[C@H]1COCCC1=NNC(=O)CNC(=O)c1cccnc1	762433873	JRIVKTIEZRBKNY-FUHWJXTLSA-N	445.520	1.720	50	20	IDGD	
O=C(NNC(=O)c1ccccc1Br)C(=O)Nc1cccc(N2CCOCC2)c1	763481943	BCDHVSCDXMLLGW-UHFFFAOYSA-N	447.289	1.685	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(C#N)cc2Cl)cc(OC)c1OC	763540636	XMIFQZVSIAYFRY-UHFFFAOYSA-N	432.820	1.637	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc3c(cnn3C(F)F)c2)cc1	763660959	JGUFVIXENCBKQC-UHFFFAOYSA-N	433.371	1.605	50	20	IDGD	
C[S@@](=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)cc1F	763686866	WDXGSMJBTDCCOK-MUUNZHRXSA-N	427.841	1.381	50	20	IDGD	
CNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(OCCC(C)C)cc2)cc1	763770355	XYTFBURGLLYVPL-UHFFFAOYSA-N	426.473	1.871	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)C(=O)Nc2cc(Cl)ccc2Cl)c2ccccc2c1=O	763791361	QJSJJAYMYHFBOS-UHFFFAOYSA-N	434.239	1.640	50	20	IDGD	
CCNC(=O)c1ccc(C)c(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)c1	763840249	JUSFXZRCWIKYAW-INIZCTEOSA-N	440.500	1.915	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1cccc(N2CCCNC2=O)c1	763863693	AWVHAHRYBFQFDE-ZDUSSCGKSA-N	443.435	1.299	50	20	IDGD	
CCN(CC)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)cc1	763867534	WLMZYVRYVKKQDN-AWEZNQCLSA-N	444.463	1.861	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@@H](C)C(=O)NNC(=O)C(=O)Nc1ccn(CC(F)F)n1	763884804	YBVMSPDOKVHNBT-NSHDSACASA-N	443.838	1.972	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cccc1C(F)(F)F	763917286	SWKFFHSHWBIWHO-UHFFFAOYSA-N	433.350	1.389	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3ccc(Cl)nc3)cc2F)C[C@H](C)O1	764099980	FNXNXJWSSPYZQU-RYUDHWBXSA-N	449.870	1.887	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1O)C(=O)Nc1cc(N2CCCC2=O)ccc1F	764116904	KGCWLHNOZNMXIM-UHFFFAOYSA-N	434.811	1.711	50	20	IDGD	
N#Cc1cccc(-c2csc(NC(=O)C(=O)NNC(=O)[C@@H]3Cc4ccccc4O3)n2)c1	764152802	GHVGKELFLBMRMQ-KRWDZBQOSA-N	433.449	1.771	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)C(=O)Nc1ccc2c(c1)CC(C)(C)O2	764204610	YSXITJSNSWUPHE-UHFFFAOYSA-N	434.493	1.791	50	20	IDGD	
O=C(Cc1ccccn1)NNC(=O)C(=O)Nc1ccnc(OCC(F)(F)C(F)F)c1	764267271	QPSGMQYLGXDDIL-UHFFFAOYSA-N	429.330	1.084	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)C(=O)Nc1sc2c(c1C(=O)OC(C)C)CCCC2	764295709	PPKXKMRGTZIBSU-UHFFFAOYSA-N	433.490	1.623	50	20	IDGD	
O=C(CCN1C(=O)NC2(CCCC2)C1=O)NNc1c(F)cc(C(=O)NC2CC2)cc1F	764329274	HDCDKHRYEIVKQQ-UHFFFAOYSA-N	435.431	1.555	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)C1(c2ccc(Br)cc2)CCC1	764342275	FVJSEYHZSDPXPN-UHFFFAOYSA-N	431.290	1.843	50	20	IDGD	
COc1ccc(NC(C)=O)cc1NC(=O)C(=O)NNC(=O)C(F)(F)Oc1ccccc1	764379308	BJXWEVDKRRCHCB-UHFFFAOYSA-N	436.371	1.411	50	20	IDGD	
Cc1c(S(=O)(=O)NNC(=O)c2cc(Br)c[nH]2)cnn1-c1ccccn1	765037618	OFEWVZXUPDWJKA-UHFFFAOYSA-N	425.268	1.290	50	20	IDGD	
COCc1cccc(S(=O)(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)c1	765124599	BYWYIBCOJOFDNI-UHFFFAOYSA-N	446.573	1.269	50	20	IDGD	
CC(C)(C)OC(=O)NNC(=O)C(=O)Nc1cc(Br)cnc1-n1cccn1	765399302	UCVVQXVBYZNOFZ-UHFFFAOYSA-N	425.243	1.524	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)CCn2c(=O)n(C)c3ccccc32)n[nH]1	765588458	PAHQERPHORJHCX-UHFFFAOYSA-N	434.456	1.590	50	20	IDGD	
O=C(NNc1cnccn1)C(=O)Nc1ccc(NC(=O)[C@H]2CCCO2)cc1C(F)(F)F	766259148	RGVZLHYUHNXOQQ-CYBMUJFWSA-N	438.366	1.695	50	20	IDGD	
O=C(COC(=O)CCC(=O)N1CCN(c2ccccc2)CC1)NNC(=O)c1cccs1	767540544	YRLDHCOTCCTBCH-UHFFFAOYSA-N	444.513	1.181	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)C(=O)Nc1cc(C2CC2)nn1-c1ncccn1)c1ccccc1	768241833	LNDRZHUCSSUWCZ-MRXNPFEDSA-N	433.472	1.819	50	20	IDGD	
COC(=O)[C@H]1CCC[C@H](C(=O)NNC(=O)c2cc(-c3ccc(OC)c(OC)c3)[nH]n2)C1	768275633	DMPPWPKIMJJAQL-KBPBESRZSA-N	430.461	1.834	50	20	IDGD	
COc1ccc(NNC(=O)c2cccc(CN3CCS(=O)(=O)CC3)c2)c([N+](=O)[O-])c1	768332380	XCRMWXTVINUXMV-UHFFFAOYSA-N	434.474	1.591	50	20	IDGD	
COc1cccc(-c2nnc(SCC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)n2N)c1	768433312	ADOZLSORGWNQGY-UHFFFAOYSA-N	443.445	1.129	50	20	IDGD	
CCn1c(NNC(=O)CN2CCC(NC(=O)OC(C)(C)C)CC2)nc2ccccc2c1=O	769099896	ONGLMXSTKURMPA-UHFFFAOYSA-N	444.536	1.849	50	20	IDGD	
CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)NNC(=O)CNC(=O)c1cccs1	769535724	RCHUVMVPZVANMC-KRWDZBQOSA-N	431.562	1.965	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)NCCNC(=O)CC3CCCCC3)nc21	770370330	QZHAZRZAGUYCCG-UHFFFAOYSA-N	432.529	2.000	50	20	IDGD	
CCNC(=O)N(C)NC(=O)c1ccc(NS(=O)(=O)c2ccc3c(c2)OCCCO3)cc1	770548529	GOONGFABFBKNOF-UHFFFAOYSA-N	448.501	1.955	50	20	IDGD	
COc1ccc(-n2c(C)nnc2SCC(=O)NNc2nc(O)c3cnn(C)c3n2)cc1	770982380	HIYWJBPIVFJORL-UHFFFAOYSA-N	441.477	1.202	50	20	IDGD	
C[C@H](C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1)c1cn(C)c2ccccc12	772845312	RTDBSHDPKODBJO-VBKZILBWSA-N	437.452	1.812	50	20	IDGD	
CSCC[C@@H](NC(=O)c1ccc([N+](=O)[O-])o1)C(=O)NNC(=O)c1ccc(C)c(F)c1	774057652	FIHPJUFNNDCAFU-CYBMUJFWSA-N	438.437	1.948	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNS(=O)(=O)c2cnn(CC(F)(F)F)c2)cc1	775252344	VZIMCHZTLOGQQU-LLVKDONJSA-N	436.412	1.621	50	20	IDGD	
CC1CCC2(CC1)OC[C@H](CNC(=O)NNC(=O)c1csc(N3CCOCC3)n1)O2	776885609	MOTYMHWQJQQOAT-BIWSTMPVSA-N	439.538	1.246	50	20	IDGD	
COCCO[C@H]1COCC[C@@H]1NC(=O)NNC(=O)c1cc(F)ccc1Br	777276523	XMXVQKARZSNAPZ-KBPBESRZSA-N	434.262	1.353	50	20	IDGD	
COCCN1C(=O)c2ccc(C(=O)NNc3ccc4ccccc4n3)cc2S1(=O)=O	777466962	PFYDBUGYQMUSAM-UHFFFAOYSA-N	426.454	1.783	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(Br)c(C(=O)NNc2ccccn2)c1	777473683	JMOVWNBHJCFBQK-UHFFFAOYSA-N	429.296	1.526	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)NC2CCN(S(=O)(=O)CC(C)C)CC2)c1	777765318	KLYINANIVJRRNA-UHFFFAOYSA-N	440.566	1.463	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)[C@H]2CS[C@@H](Cc3ccccc3F)C(=O)N2)nc1C	778423059	ZPSWNUQULUUFCV-CVEARBPZSA-N	447.492	1.387	50	20	IDGD	
CN(CC(=O)NNC(=O)c1ccccc1Cl)C[C@]1(O)CCN(Cc2ccccc2)C1	778491339	UDGZFCKWBJEIRN-JOCHJYFZSA-N	430.936	1.670	50	20	IDGD	
CC(C)NC(=O)NNC(=O)c1cc(I)ccc1N1CCOCC1	778609459	LPMFLKPWFBJJCV-UHFFFAOYSA-N	432.262	1.480	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)Nc1ccccc1S(=O)(=O)N1CCCCC1	779357366	NPKFWLOSNIPVHM-CQSZACIVSA-N	428.511	1.065	50	20	IDGD	
Cc1cc(N2C[C@H](C(=O)OCC(=O)NNC(=O)c3cccc(C#N)c3)CC2=O)ccc1F	780184987	PXPYDRRMUXYWKE-MRXNPFEDSA-N	438.415	1.363	50	20	IDGD	
O=C(CSc1nnc(O)nc1O)NN=C1CCC[C@H]2CN(Cc3ccccc3)C[C@@H]12	781123790	JMZCQSRPRPLMQH-LSDHHAIUSA-N	428.518	1.779	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2cc(N3CCCS3(=O)=O)ccc2Cl)nc1	782146062	VYSQSKIQUCNAFH-UHFFFAOYSA-N	439.881	1.365	50	20	IDGD	
COC(=O)CN1CCN(c2ccc(NC(=O)C(=O)NNc3cccc(F)c3)cc2)CC1	783040335	LCFINOZFFHSSOW-UHFFFAOYSA-N	429.452	1.203	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H]1CCc2ncc(NC(=O)C(=O)NN=c3cc[nH]cc3)cc2C1	783376936	UFDFPJKEGRCBTF-HNNXBMFYSA-N	426.477	1.362	50	20	IDGD	
Cc1c(F)cccc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	784230023	ITDOHQMQCRDWBN-UHFFFAOYSA-N	449.508	1.152	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)c2cc(N3CCOCC3)ccn2)c1	784396027	OSHLMYQPXAVHNI-UHFFFAOYSA-N	435.278	1.764	50	20	IDGD	
N#Cc1ccc(Cn2cnc(NC(=O)C(=O)NNc3ccc(Br)nc3)n2)cc1	784814045	WAADWQHFWRPKAZ-UHFFFAOYSA-N	441.249	1.437	50	20	IDGD	
CN1CCC[C@@H](N(C)C(=O)c2ccc(NC(=O)C(=O)NNc3ncccc3Cl)cc2)C1	784817506	IEIRPYRTZTTYDD-MRXNPFEDSA-N	444.923	1.983	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)[C@@H]2CCCN2c2ccccc2)cc1OC	785132526	QNJZTRFOVDHPMU-KRWDZBQOSA-N	427.457	1.677	50	20	IDGD	
O=C(NNc1nc(C(F)(F)F)cs1)C(=O)Nc1ccc(CN2C(=O)CCC2=O)cc1	785146462	RSRONHVVINZFHD-UHFFFAOYSA-N	441.391	1.893	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2nn(-c3cccc(F)c3)cc2O)cc(OC)c1OC	785681542	BRZMTINLSNBTTF-UHFFFAOYSA-N	430.392	1.818	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)C(=O)Nc2ccc(-c3ccco3)cc2F)c1	787548857	HOSGTPBTCZRXLM-UHFFFAOYSA-N	425.376	1.839	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1ccc(Cl)c(S(C)(=O)=O)c1	788331934	VIRJVLLTRJRVTP-UHFFFAOYSA-N	449.876	1.099	50	20	IDGD	
O=C(NCc1cccc(C(F)(F)F)c1)NNS(=O)(=O)c1cnn(CC(F)F)c1	790054340	ZBPKIAZHFSCRJI-UHFFFAOYSA-N	427.355	1.860	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCc1cccc([N+](=O)[O-])c1C	790567922	WUPWXOJTUSKNAU-UHFFFAOYSA-N	434.478	1.649	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)N1CCc2c(cccc2S(=O)(=O)N(C)C)C1	790715799	XJZUJSABLVKKEB-UHFFFAOYSA-N	432.502	1.358	50	20	IDGD	
O=C(NCc1ccc(S(=O)(=O)CCO)cc1)NNC(=O)c1ccc2ccccc2c1	791013283	AGKYBPUPKPWWJI-UHFFFAOYSA-N	427.482	1.750	50	20	IDGD	
O=C(CS(=O)(=O)Cc1ccc(Cl)s1)NNC(=O)c1ccc2c(c1)OCCO2	791014741	RXQCHEAZBNHTNU-UHFFFAOYSA-N	430.891	1.549	50	20	IDGD	
COC(=O)c1nc([C@H]2CCCN2CC(=O)NNC(=O)c2cccc(C#N)c2)sc1C	791615532	MNFWQMPXJDWKKM-OAHLLOKOSA-N	427.486	1.708	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNc3nc4ccccn4n3)cc2F)C[C@H](C)O1	792391925	LGNZWPSLZPTTOA-STQMWFEESA-N	427.440	1.564	50	20	IDGD	
CC[C@@H](C)NS(=O)(=O)Cc1cccc(NC(=O)C(=O)NNc2nc3ccccn3n2)c1	792395096	PCQOEKBHYNOXOY-CYBMUJFWSA-N	445.505	1.029	50	20	IDGD	
CSCC[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)NNC(=O)c1cccc(C)n1	794074339	DPMAKVDBVIJSKN-INIZCTEOSA-N	431.474	1.611	50	20	IDGD	
CCOC(=O)c1ccc(OC)c(S(=O)(=O)NNC(=O)c2nnc(-c3ccccc3)o2)c1	795303493	PNNURVDTSPECGD-UHFFFAOYSA-N	446.441	1.545	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCC[C@@H]2COC(=O)NC2CCCCC2)n1	796678141	HPVOKVHLUOBWNZ-MRXNPFEDSA-N	437.566	1.665	50	20	IDGD	
Cc1nc(-c2ccccc2NC(=O)C(=O)NNC(=O)CNC(=O)c2ccco2)cs1	797072416	WIUAJGUVCNREGK-UHFFFAOYSA-N	427.442	1.227	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCC(=O)NNc2ccccc2[N+](=O)[O-])cc1OCC	798145716	PNWABJSNMBTRLU-UHFFFAOYSA-N	438.462	1.814	50	20	IDGD	
COc1ccccc1-n1ncc(C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c1C	798391594	JHRFYEJWQKTSIA-UHFFFAOYSA-N	428.470	1.668	50	20	IDGD	
CC(=NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1)c1coc(C(C)C)n1	799483988	ZWLYXDZNSSKJJP-UHFFFAOYSA-N	447.561	1.953	50	20	IDGD	
COc1cc(C)nc(NNC(=O)NCCNS(=O)(=O)c2ccc(Cl)cc2F)n1	799665738	HTLKVYGZIJFPES-UHFFFAOYSA-N	432.865	1.191	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1)C(=O)NCCF	799904777	RJTABTWNIDVXOW-UZLBHIALSA-N	441.507	1.418	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2ccccc2S[C@@H](C)C(N)=O)cc(OC)c1OC	800797877	ZSQRNDYZCMZYTD-NSHDSACASA-N	433.486	1.753	50	20	IDGD	
O=C(N=c1cc[nH]cc1)NNC(=O)c1ccc2c(c1)C(=O)N(CCc1ccccc1)C2=O	802029597	QQRHENPATXADIK-UHFFFAOYSA-N	429.436	1.809	50	20	IDGD	
COc1ccc(Cl)c(NC(=O)NNC(=O)CCN2C(=O)[C@H]3[C@H]4CC[C@@H](O4)[C@@H]3C2=O)c1	802110862	VVUJAMQYHWIRQK-VDERGJSUSA-N	436.852	1.054	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N[C@H](C)c2n[nH]c(C)n2)cc1	804812660	RCOPJTLTDRLSQK-BVTUPMQUSA-N	448.487	1.645	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N=c1ccnc2n(C)[nH]cc1-2	806484039	ZZDWXIUQVJDLLS-SNVBAGLBSA-N	433.266	1.725	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1cc(F)c(Br)c(Cl)c1	806978872	HZWGDOMLXPOVQX-ZETCQYMHSA-N	440.653	1.379	50	20	IDGD	
COC(=O)c1cc(F)c(Br)cc1NC(=O)C(=O)NNc1ncccc1F	807300353	KGVLKAKMXLSJOO-UHFFFAOYSA-N	429.177	1.991	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)[C@@H]1CCCN1C(=O)c1ccc(OC)cc1OC	807371979	XPPJMWCYAOFKOY-INIZCTEOSA-N	437.493	1.245	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNc2cccc(F)n2)cc(Br)c1F	807391516	WNLQHPSQNQRLBJ-UHFFFAOYSA-N	429.177	1.991	50	20	IDGD	
O=C(NN=Cc1c[nH]c(C(F)(F)F)c1)c1cccc(S(=O)(=O)N2CCOCC2)c1	807944215	UQAZMICZUZEPSA-UHFFFAOYSA-N	430.408	1.818	50	20	IDGD	
O=C(COC(=O)Cc1cncn1Cc1ccccc1)NNC(=O)c1cccc([N+](=O)[O-])c1	811327279	PNKNDRJUTJYHCD-UHFFFAOYSA-N	437.412	1.387	50	20	IDGD	
Cc1cc(=O)cc(C)n1CCCC(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	811354965	WHYKDOUSNWOEOL-UHFFFAOYSA-N	430.417	1.158	50	20	IDGD	
Cc1ccc(CN2C[C@@H](C(=O)NNc3ccc(S(=O)(=O)N(C)C)cc3)CC2=O)cc1	812730907	FNSDAOMIJBROJV-KRWDZBQOSA-N	430.530	1.737	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccc(SC(F)F)nc2)cc1	813033935	RUESZOZKVFJFII-UHFFFAOYSA-N	445.473	1.728	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NN=Cc1cccc(C(=O)O)c1Cl	814878722	HWZUIAFAVLVQII-UHFFFAOYSA-N	428.876	1.946	50	20	IDGD	
CC(C)Oc1ccc(-c2ccc(NC(=O)C(=O)NNC(=O)C(=O)NC3CC3)c(F)c2)cc1	815583447	GBDSCQDBHKCJEI-UHFFFAOYSA-N	442.447	1.644	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNc2ncncc2F)sc2c1CCSC2	815763787	ATZJVRLGBUISPU-UHFFFAOYSA-N	425.467	1.725	50	20	IDGD	
CSCCNC(=S)NNC(=O)Cc1nc(-c2ccc(S(C)(=O)=O)cc2)cs1	815915452	PCPYFYJXGCRCEF-UHFFFAOYSA-N	444.629	1.614	50	20	IDGD	
Cc1nc(Br)sc1C(=O)NNC(=O)c1sc(N2CCOCC2)nc1C	816828300	ZUJVCPYIMBDONC-UHFFFAOYSA-N	446.352	1.890	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)N(C)CCOc2ccc(S(N)(=O)=O)cc2)cc(C#N)n1C	817222553	NOHBLHHLDIXYAR-YBEGLDIGSA-N	427.486	1.297	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NNC(=O)C(=O)NCCCc2ccccc2)C1	819659610	XQVDGJSWTVXQHL-QGZVFWFLSA-N	432.521	1.530	50	20	IDGD	
O=C(CSc1nnc(O)nc1O)NN=C1CCCOc2cc(Br)ccc21	819845509	LNUBHAKUXGCHPR-UHFFFAOYSA-N	440.279	1.831	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)Cc1csc(NC(=O)c2ccco2)n1	825630286	CZCPAPWAQYOPAM-UHFFFAOYSA-N	429.458	1.799	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNS(=O)(=O)c3cc(C(=O)O)cc(C(=O)O)c3)cc2C1	832100108	ZHKBYFDXJFEVEB-SECBINFHSA-N	438.483	1.893	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(Br)cc1)NNC(=O)c1ccccc1F	913415773	GVCHUQUNXFCOAO-UHFFFAOYSA-N	430.255	1.328	50	20	IDGD	
C[C@@H](Oc1cccc(F)c1)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	914457204	SYTBFSBZEIHLLJ-CQSZACIVSA-N	435.477	1.839	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)NC[C@H]1CN(Cc2ccccc2)CCO1	915894811	PWFKBCJMCVQMMN-WMZOPIPTSA-N	430.480	1.824	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)c1sccc1-n1cnnn1	916140130	BSEZRNSZZFDEQF-VIFPVBQESA-N	437.279	1.715	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCCN1C(=O)OCc1ccccc1)c1ccc(-n2cnnn2)cc1	916144924	YMYSDAKFSORPPI-LJQANCHMSA-N	449.471	1.615	50	20	IDGD	
Cc1nc(CCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cs1	916254536	GKDPZAWICDJHLA-UHFFFAOYSA-N	437.547	1.423	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)NCCCN2CCN(c3ccccc3)CC2)cc1	916490266	YUAYQHWHADEEQI-UHFFFAOYSA-N	436.516	1.480	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(S(=O)(=O)NC(C)(C)C)cc2)cc1	916830641	MFBOSWQEKBKDDG-UHFFFAOYSA-N	432.502	1.472	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)C(=O)N(C[C@H]1CCCO1)C2=O)c1ccc(Cl)nc1	917249048	NMSFEKGGHODAOV-CYBMUJFWSA-N	428.832	1.585	50	20	IDGD	
C[C@H](SCc1ccccc1)C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	917284095	DIUDZIQCODLZKT-KBXCAEBGSA-N	430.482	1.839	50	20	IDGD	
O=C(NNC(=O)c1cncc2ccccc12)c1cccc(S(=O)(=O)N2CCOCC2)c1	917528591	GVBLBJKQUZQOEN-UHFFFAOYSA-N	440.481	1.331	50	20	IDGD	
O=C(NCc1cccc(NC(=O)C2CCCC2)c1)NNC(=O)c1ccc(-n2cnnn2)cc1	918103329	DHIYMJXCCHLVCW-UHFFFAOYSA-N	448.487	1.935	50	20	IDGD	
O=C(CCN1C(=O)NC2(CCCC2)C1=O)NNC(=O)c1ccc(F)cc1Br	918340627	WTKSCENSVUFKLI-UHFFFAOYSA-N	441.257	1.604	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)CCNS(=O)(=O)/C=C/c2ccccc2)cc1	919833005	OUXDKRBJSRPHGX-JQIJEIRASA-N	431.514	1.756	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1	919907175	BZENCRYBZSPJPR-UHFFFAOYSA-N	430.480	1.869	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)[C@@H]2CCCN2C(=O)/C=C\c2ccc(C(N)=O)cc2)c1	920019994	FSEQHZRXKIVAAG-IMTHGLKYSA-N	449.511	1.317	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])o1)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	920426357	OUOGMHUJEQBGBN-UHFFFAOYSA-N	433.384	1.964	50	20	IDGD	
CC(C)(C)c1cc(NC(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)n(Cc2ccccc2)n1	1116582477	OKKITQXNHJBBSG-OAHLLOKOSA-N	433.534	1.816	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)[C@H]2CC(=O)N(c3ccc(C#N)cc3)C2)cc1	1318034335	VDJQPRXPTIMTOW-WBVHZDCISA-N	436.468	1.925	50	20	IDGD	
CC(=O)N/C(=C/c1ccccc1)C(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1	1339229777	BITQJKMSKSLFDJ-NBVRZTHBSA-N	430.505	1.958	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3cccn4ccnc34)C2)C1	1778577807	KJQJHVSOCQQHKN-LIRRHRJNSA-N	435.322	1.809	50	20	IDGD	
Cc1nc(CC(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](F)Br)C3)C2)c(C)s1	1781326157	KUZRJNDXTLPEEN-HOCLYGCPSA-N	434.331	1.823	50	20	IDGD	
CCOC(=O)C1(C(=O)N2CC[C@]3(CN(C(=O)[C@@H](C)CBr)CCO3)C2)CC1	1782913121	QWWIWPDFFOQDOY-GUYCJALGSA-N	431.327	1.191	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC1(c2ccc(NC(=O)c3cc(O)ncn3)cc2)CCC1	1786472715	FCLKGLUABHIBTJ-UHFFFAOYSA-N	447.455	1.242	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc4ccccn4n3)[C@H]2C1	1787844868	WVIHCCRHQLUKKW-OAOQPFQOSA-N	449.349	1.959	50	20	IDGD	
NC(=O)[C@H](N)CCC(=O)Nc1ccc(C2(NC(=O)[C@H](F)Br)CCC2)cc1	1788059933	BPWYDPHFDYFXRI-OCCSQVGLSA-N	429.290	1.404	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4cccnc4nc3O)C[C@@H]21	1789865266	OPOURSQAWYHWGI-HJWJTTGWSA-N	432.908	1.946	50	20	IDGD	
Cc1ccc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Cl)C[C@@H]32)cc1[N+](=O)[O-]	1789910810	RSJGMPRKZSSVQF-DNUAJFIVSA-N	427.860	1.960	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3CC(=O)C3)C[C@@H]21	1790695286	JFFTWHUPZOGENL-UWQBARMFSA-N	443.450	1.831	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)n3ccnc3)C[C@@H]21	1790958166	KTMUWCFNZYKPMH-YXMSTPNBSA-N	427.343	1.597	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CC3CCN(C)CC3)C[C@@H]21	1790962059	PBDZGMLKKRKSPM-FJIDUMEYSA-N	444.414	1.872	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21	1791057824	IDROERBLFMZOEM-BJDJZHNGSA-N	426.149	1.535	50	20	IDGD	
COc1ccc(OCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Br)C3)cc1	1792725535	YIZVYZLVTFMBIX-LZDSYCOUSA-N	445.285	1.354	50	20	IDGD	
CC(C)n1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)CBr)n1	1792872377	BZYRRSYITLBHSD-AYDFFVQHSA-N	427.343	1.698	50	20	IDGD	
COc1ccc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Br)C3)cn1	1793894125	YYVSAEFEGRTNQK-RMHZUWNSSA-N	444.301	1.303	50	20	IDGD	
COc1cnc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)Br)C3)c(F)c1	1794453716	ZJLYMGISUOJFQE-DYNIEEOBSA-N	430.274	1.216	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccccc1N	1796103371	JQEUPUHKADONEZ-ORIYUZMUSA-N	434.500	1.233	50	20	IDGD	
Cc1ccn2ncc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@H](F)Br)C4)c2c1	1796273743	WHAKOHNVJAHTPS-VZAMPYOESA-N	439.285	1.536	50	20	IDGD	
CC(C)(C)c1ncccc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc(B(O)O)c1)C2	1796421327	NYDLUMHEPQUUGK-REPLKXPHSA-N	435.333	1.625	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](NC(=O)OC)c1ccccc1)C2	1799264448	KXLUZBLJXJKKHD-FLXSYLCISA-N	437.924	1.691	50	20	IDGD	
C[C@H](Oc1cccnc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@](C)(Cl)CCl	1799278436	GUKJJGBTPPZBOL-MABMQTIPSA-N	430.332	1.675	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@](C)(Cl)CCl)C2	1800642629	SQFSYRNIVYBKJW-NKSTYXRASA-N	430.170	1.986	50	20	IDGD	
CCc1nn(C)c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](Cl)COC)c1Cl	1800973485	AOQRNMDLQYKVRO-OXIQGZBJSA-N	433.336	1.093	50	20	IDGD	
Cc1c(Cl)cccc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCC(=O)NN(C)C	1801009064	NMBMTTYLJDEZSI-YVWYUNDQSA-N	436.940	1.225	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(OC)cc1Cl	1801796579	ZGNORTRGFYMRPQ-CZAMWMTLSA-N	431.316	1.806	50	20	IDGD	
CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](Cl)COC)C2	1801964057	HVZRVNMHAWZDMQ-YIDVYQOGSA-N	447.960	1.133	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(-c3ccccc3)on1)C2	1802328847	GPRIJOKFNAXGKW-BCDXTJNWSA-N	439.516	1.966	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2n[nH]c3ccccc23)[C@H]1c1cccnc1)[C@@H](O)CCl	1803143024	RDVLQJWKJFBECT-FNHZYXHNSA-N	427.892	1.877	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cc3ncccc3[nH]2)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803146405	ASCJMHWHHALYMT-ZOCIIQOWSA-N	427.892	1.877	50	20	IDGD	
C=CCO[C@H](C)C(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1803571092	MOYZEDXQAJSAIM-BLIXFSHQSA-N	431.537	1.052	50	20	IDGD	
CC(=O)OC[C@H](OC(C)=O)C(=O)N1CCC2(CCCN(C(=O)C(C)(C)CCl)C2)CC1	1805262447	VPEPJPKENSIITC-KRWDZBQOSA-N	444.956	1.977	50	20	IDGD	
O=C(c1ccc2nc(CO)[nH]c2c1)N1CCC2(CCCN(C(=O)[C@H](O)CCl)C2)CC1	1805524604	VMLNMYBXENVPAY-QGZVFWFLSA-N	434.924	1.500	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC2(CCCN(C(=O)Cn3cc([N+](=O)[O-])cn3)C2)CC1	1806934890	KGSVGTKNTOZZDJ-CYBMUJFWSA-N	442.314	1.806	50	20	IDGD	
Cc1cc[nH]c1C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1807369619	QKIJATXQPKUGFE-NQIIRXRSSA-N	432.289	1.031	50	20	IDGD	
O=C1CC[C@@H](C(=O)N2CC[C@H](CNC(=O)[C@H](F)Br)[C@H]2c2cccnc2)N1	1808662286	XHPZADGMAVQGGP-OSRDXIQISA-N	427.274	1.057	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC2(CCCN(C(=O)Cc3ccccc3F)C2)CC1	1809220652	GEBMSZCXIHPTFW-UHFFFAOYSA-N	432.540	1.972	50	20	IDGD	
COC[C@H](NC(C)=O)C(=O)NC[C@H]1CCN(C(=O)C(Cl)Cl)[C@H]1c1cccnc1	1810564227	KBHPBYXPHDKEGS-ILXRZTDVSA-N	431.320	1.042	50	20	IDGD	
COC(=O)C1(C(=O)NC[C@H]2CCN(C(=O)CO[Si](C)(C)C)[C@H]2c2cccnc2)CC1	1812689463	FLBYRVSAPUHYGB-AEFFLSMTSA-N	433.581	1.892	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2ccc(C(N)=O)cc2)[C@H]1c1cccnc1	1813033960	XVPQUDAFJPASFK-FHWLQOOXSA-N	444.919	1.754	50	20	IDGD	
CCc1oncc1C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1813071711	UHRVBEFGTCBCPY-IIBYNOLFSA-N	442.520	1.325	50	20	IDGD	
N=C(N)SCCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCBr)CC2	1814938966	DPGOSWHEDWBELK-QMMMGPOBSA-N	434.385	1.857	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CNCP(=O)(O)O)n[nH]1	1817231666	FHZLYBXXTHPSFZ-GFCCVEGCSA-N	435.849	1.392	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccncc2)[nH]n1	1819401854	CHONGLZSFINWAU-KRWDZBQOSA-N	434.460	1.423	50	20	IDGD	
C[C@H](C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1)C1(O)CCC1	1822412598	RRWUJTMBWMDPIN-ZBFHGGJFSA-N	434.541	1.326	50	20	IDGD	
Cc1nccn1[C@H](C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1	1822416585	IWJRVOJADQOZJD-RHSMWYFYSA-N	444.540	1.541	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(O)n(C)n1)CC2	1825637412	ZNCXKWUMNYMBKB-HTQZYQBOSA-N	428.312	1.591	50	20	IDGD	
Cc1ncccc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1	1825845333	QZZDYXNVUSRPLY-HXUWFJFHSA-N	429.565	1.996	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)/C=N/O[C@H]1CCCCO1)CC2	1826000297	QVHZNVOFLYFESH-QJRKHYHYSA-N	444.941	1.838	50	20	IDGD	
CC(C)=NO[C@H](C)C(=O)N[C@@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1	1826088352	DYUBLASGUMAZKB-CHWSQXEVSA-N	438.554	1.229	50	20	IDGD	
O=C(CCBr)N1CCC([C@@H]2CCCCN2C(=O)CN2CCOCC2)CC1	1826715084	KIJFOYSHKQKZEX-KRWDZBQOSA-N	430.387	1.723	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ncon2)CC1	1829503291	OLDKCOOENBBTEJ-ZZQPOVDQSA-N	441.492	1.437	50	20	IDGD	
CN(C)c1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)cn1	1830364692	PULOCDXWJKSZAO-OAQYLSRUSA-N	438.956	1.483	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)/C=N/N3CCCCC3)C2)C1	1831652247	XGGDBTRHJAINIV-HPNSBFNSSA-N	428.961	1.322	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CN2CCSCC2)CC1	1831827427	XOUVIIGIPPJQJK-ZWKOTPCHSA-N	432.030	1.909	50	20	IDGD	
Cc1cncc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)c1	1831872395	UIAPCKFILSYHCE-FQEVSTJZSA-N	429.565	1.996	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)C(F)(F)Cl)CC1	1832018399	KQKZMKSMNIFAEL-OAHLLOKOSA-N	443.882	1.750	50	20	IDGD	
CC(C)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2	1832549294	LTWFMHCKDDVRQH-MGPUTAFESA-N	447.960	1.231	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3cccc(Cl)n3)CCO2)C1	1833174366	WVBLVGUKJOSMHC-HXUWFJFHSA-N	444.359	1.999	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)Cn3ccnc3)CC2)CC1	1834267344	DPIAHDLLNWLWSH-QGZVFWFLSA-N	440.386	1.628	50	20	IDGD	
C[C@H](C(=O)N1CCC(N2CCC(NC(=O)[C@H](F)Cl)CC2)CC1)n1cccc1C=O	1835080276	OPMROULGJMXPAI-KDOFPFPSSA-N	426.920	1.968	50	20	IDGD	
CC(C)(C)[C@H](O)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](F)Br)CC2)CC1	1836413708	MLUQLHNWTOTHEY-HUUCEWRRSA-N	436.366	1.656	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CC[C@@H](C)O1)CCO2	1836609378	OCBAZVYJJCDPOF-FSZRXZPDSA-N	433.343	1.184	50	20	IDGD	
O=C(c1[nH]cnc1-c1cccnc1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1838495894	KHUKMFOVPUYRSB-VQIMIIECSA-N	437.859	1.076	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CNC(C)(C)C)C2)C1	1839963273	GLKVSUWJQNFHPZ-KBXCAEBGSA-N	434.375	1.004	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)n(C(F)F)n1	1840189087	VPTSLMODKXFQCP-INIZCTEOSA-N	441.262	1.460	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC2(CCCN2C(=O)[C@H](O)CNC(=O)OC(C)(C)C)C1	1841298035	QHNPEKCQGIRKEM-CHWSQXEVSA-N	448.358	1.106	50	20	IDGD	
O=C([C@@H]1CC(=O)N(C2CCCC2)C1)N1CC2(CCCN2C(=O)CCBr)C1	1842637356	FOQKTYBIKXXTQM-CQSZACIVSA-N	426.355	1.766	50	20	IDGD	
COc1ccc([N+](=O)[O-])c(C(=O)N2CC3(CCCN3C(=O)CCBr)C2)n1	1842638367	SAOBTLXQVQDAGM-UHFFFAOYSA-N	427.255	1.600	50	20	IDGD	
O=C(c1ccncc1-c1ccccc1)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843011809	VYAQRTQYGNPNHF-UHFFFAOYSA-N	441.296	1.559	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@H](C)NC(=O)c2ccc(F)cc2)C1	1845004550	RKZUSIMKIOARKI-BBRMVZONSA-N	425.888	1.401	50	20	IDGD	
O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)[C@@H](F)Br)C1	1845217686	OVNDTYMUUCAHHQ-OAHLLOKOSA-N	437.269	1.673	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)c2n[nH]c3c(Cl)cccc23)C1	1845591140	IVGYPNJGXQTIRH-UHFFFAOYSA-N	438.680	1.027	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@]2(C(=O)N3CCCC34CN(C(=O)[C@@H](O)CCl)C4)C[C@H]2C1	1846103984	PVYZTAJFCFCBND-GXZWQRSESA-N	441.956	1.437	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)c1cnn(Cc3ccccc3)c1)C2	1846385248	IDSFKKVFNYVSBC-UHFFFAOYSA-N	438.532	1.121	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@](O)(C(=O)N2CCCC23CN(C(=O)C(Cl)Cl)C3)C1	1846412511	LHDHNZWEMGHWQW-SFHVURJKSA-N	436.336	1.365	50	20	IDGD	
O=C(c1cc(Br)cnc1Cl)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl	1847564018	RJTNXMNFHFDRBL-SDDRHHMPSA-N	437.121	1.913	50	20	IDGD	
C=C1c2ccccc2C(=O)N1CC(=O)OCC(=O)NNC(=O)c1ccc(OC)c(OC)c1	11578061	BLPXTNJGTHMGAD-UHFFFAOYSA-N	439.424	1.135	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)NC3CC3)cc2)cc1OC	12694423	OSPBMRQLMDEPLF-UHFFFAOYSA-N	433.486	1.609	50	20	IDGD	
COC[C@@H](C)n1c(C)cc(/C=C(/C#N)C(=O)N2CCN(CC(=O)NC(C)C)CC2)c1C	105584728	QSNWVLKBTZDFRB-UZQMFHLOSA-N	429.565	1.888	50	20	IDGD	
C[C@]1(NNC(=O)NC2CCN(Cc3coc(-c4ccccc4)n3)CC2)CCS(=O)(=O)C1	726274574	FMXRHYWOMBBSJI-NRFANRHFSA-N	447.561	1.687	50	20	IDGD	
C[C@H]1Oc2ccccc2N(CC(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)C1=O	726862875	GUCYMBKMRDPKAW-CYBMUJFWSA-N	430.486	1.385	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@H](C(=O)NNc2nc(-c3ccncc3)no2)C(C)C)cc1	728073849	UZVJITCJTTUCGF-INIZCTEOSA-N	430.490	1.886	50	20	IDGD	
O=C(NNC(=O)[C@H]1CC(=O)N(c2ccccc2Cl)C1)C1CCN(c2ncccn2)CC1	728845039	FFPDHXJIRGWFCO-HNNXBMFYSA-N	442.907	1.547	50	20	IDGD	
C[C@@H]1Sc2ccc(C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)cc2NC1=O	728847964	GMCXQHSAGRYVJM-LBPRGKRZSA-N	426.502	1.587	50	20	IDGD	
N#Cc1ccc(CN2CCCN(C(=O)NNC(=O)CNC(=O)c3cccs3)CC2)cc1	728952115	SWQFSQRXFSORKF-UHFFFAOYSA-N	440.529	1.298	50	20	IDGD	
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC[C@H](C(=O)NNC(=O)NC2CCCCC2)C1	729297994	MZQKXZQMVQAMFO-AWEZNQCLSA-N	426.543	1.090	50	20	IDGD	
CN(C)c1ccc(NC(=S)NNC(=O)c2ccc(CN3C(=O)CNC3=O)cc2)cc1	729689169	BFGTZBWTCXHKFK-UHFFFAOYSA-N	426.502	1.436	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)Cc3c(C)nc4[nH]n(C)c(=O)c4c3C)n[nH]2)cc1	730278471	NIRXTGJYBKNCTM-UHFFFAOYSA-N	433.472	1.581	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)[C@@H](C)N1C(=O)c2ccc(Br)cc2C1=O	731492343	GWXNRPXBOZKJBZ-SNVBAGLBSA-N	446.257	1.903	50	20	IDGD	
C=CCn1c(SCC(=O)NNC(=O)C(=O)N2CCCC2)nnc1-c1ccc(Cl)cc1	732066644	VLRSBSYVAXNZRY-UHFFFAOYSA-N	448.936	1.646	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)NCC(=O)NCCN2CCOCC2)c(C)n1CCC(C)C	732157013	RWVRDSFWLNMKQB-STZFKDTASA-N	429.565	1.623	50	20	IDGD	
Cc1csc([C@](O)(CC(=O)NNC(=O)CCN2C[C@H](C)O[C@H](C)C2)C(F)(F)F)n1	732260592	VRMZRSCYRRBXCF-BFQNTYOBSA-N	438.472	1.238	50	20	IDGD	
CCOC(=O)c1ccc(-c2ccc(/C=C(/C#N)C(=O)c3c(N)n(C)c(=O)n(C)c3=O)o2)cc1	732578974	YLQKTGKMXOJHLM-PTNGSMBKSA-N	448.435	1.893	50	20	IDGD	
N#Cc1ccc(-c2ccc(OCC(=O)NNC(=O)C3CCS(=O)(=O)CC3)cc2)cc1	732948891	AXXBXCTVHLLPTR-UHFFFAOYSA-N	427.482	1.576	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)N[C@H]2CCCN(C(=O)OC(C)(C)C)C2)c2ccccc2c1=O	734218337	HZJHGABSCQNLLK-ZDUSSCGKSA-N	444.492	1.277	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NCC(=O)NNc2ncccc2Cl)c1	734247461	MOALNIFGPTYIOE-UHFFFAOYSA-N	439.925	1.639	50	20	IDGD	
COc1ccc([C@@H]2[C@H](C(=O)NNC(=O)c3ccc4c(c3)OCCO4)CCC(=O)N2C)cc1	734316158	KSGBIFXBJFTEPQ-DYESRHJHSA-N	439.468	1.837	50	20	IDGD	
O=C(CCSc1ccc(F)cc1)NNC(=O)N[C@H]1CCN(CCN2CCOCC2)C1	734685454	DPSJPVLFWSIMIL-KRWDZBQOSA-N	439.557	1.045	50	20	IDGD	
COc1cc(OC)cc([C@@H](O)CNC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c1	735681231	BGRSGGGWCBVOQW-IBGZPJMESA-N	425.445	1.567	50	20	IDGD	
C[C@@H]1OC(C)(C)N(C(=O)OC(C)(C)C)[C@@H]1C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	735876491	SCANSHYJTARBLO-WFASDCNBSA-N	445.480	1.184	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COCc2ccccc2)cc1S(=O)(=O)NC1CC1	737923112	LCKZGIAMFOYXAA-UHFFFAOYSA-N	433.486	1.114	50	20	IDGD	
CN(C)Cc1cccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)c1	741276142	JRXKKOPMUFMQHD-UHFFFAOYSA-N	444.557	1.998	50	20	IDGD	
COc1nc(N)nc(N2CCCC2)c1C=NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	741767763	BZOBYYNDWCXDDJ-UHFFFAOYSA-N	433.494	1.227	50	20	IDGD	
CCO[C@@H](C)c1noc(CN2CCN(CC(=O)NNC(=O)c3cccc(C)c3)CC2)n1	744412046	MNHHGWWUUFFMGZ-INIZCTEOSA-N	430.509	1.054	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCc2noc(-c3cccs3)n2)cc(OC)c1OC	745182920	HWNXOGSQCBLEAO-UHFFFAOYSA-N	433.446	1.968	50	20	IDGD	
COc1ccc(Br)c(C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)c1N	745289807	VJIUZUGXUWLYMO-UHFFFAOYSA-N	447.245	1.530	50	20	IDGD	
CCCCN1C(=O)CC[C@H](C(=O)NNC(=O)N2CCOCC2)[C@H]1c1ccccc1OC	745991864	HYVATINLNICVDJ-FXAWDEMLSA-N	432.521	1.848	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)[C@H]1CCCN1Cc1ccccn1	746092574	XNEASDAVLXOPAN-JOCHJYFZSA-N	436.560	1.406	50	20	IDGD	
CC(C)[C@@H](NS(=O)(=O)c1ccc2ccccc2c1)C(=O)NNC(=O)Cc1ccncc1	747429784	TXNSOGLDRYKDBW-OAQYLSRUSA-N	440.525	1.928	50	20	IDGD	
CC(C)c1c(C(=O)NNC(=O)C(=O)N2CCCC2)cnn1-c1ccc(C(F)(F)F)cn1	748240190	BKLHQCNTECOZDR-UHFFFAOYSA-N	438.410	1.793	50	20	IDGD	
COc1ccc([C@@H](C)CC(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1	750539233	NBSRZFPJITWSIQ-LIRRHRJNSA-N	428.441	1.719	50	20	IDGD	
CC[S@](=O)[C@H]1CCC[C@H](NC(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)C1	750671789	VVRYPODTWITZMH-IVAFGUPBSA-N	431.584	1.474	50	20	IDGD	
COC(=O)c1cc2c(cc1NC(=O)C(=O)NNC(=O)Cc1ccc3ccccc3c1)OCO2	753841271	QSDXTDRZISTFNI-UHFFFAOYSA-N	449.419	1.684	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)NC2CCN(S(=O)(=O)C3CC3)CC2)c1C	753968272	UEEYQVDCIGTVJI-OAHLLOKOSA-N	438.550	1.358	50	20	IDGD	
Cc1nc(-c2ccccn2)nc(NNC(=O)c2ccc(S(=O)(=O)CC(N)=O)cc2)c1C	754420562	PNLCMMNOJQMUOZ-UHFFFAOYSA-N	440.485	1.171	50	20	IDGD	
CC(C)(C)c1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)Cc3cc[nH]n3)CC2)cc1	755278975	GNQDTUBVMTXTJO-UHFFFAOYSA-N	447.561	1.498	50	20	IDGD	
CCOC(=O)c1cc(Br)cc(S(=O)(=O)NNC(=O)Cc2cccnc2)c1	756938282	FQKKFCVUJWYWFP-UHFFFAOYSA-N	442.291	1.573	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccc(C)nc2N(C)C)c1	757754599	ULYPNKQQWUCOEN-UHFFFAOYSA-N	448.549	1.953	50	20	IDGD	
CCOC(=O)Cc1nnc(NC(=O)NNC(=O)COc2cccc(C(F)(F)F)c2)s1	757756591	WGDDPUUKXULVHI-UHFFFAOYSA-N	447.395	1.894	50	20	IDGD	
N#Cc1cccc([C@H]2CN(C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)CCO2)c1	762413688	COSGXNOISLQFDJ-LJQANCHMSA-N	435.488	1.379	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)[C@@]2(O)CCN(Cc3ccccc3)C2)n[nH]1	763151859	GSSIMHYVLDYBLM-HSZRJFAPSA-N	435.484	1.483	50	20	IDGD	
CS(=O)(=O)c1c(Cl)cccc1NC(=O)C(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	763456237	YADQFLQDIWWNEV-UHFFFAOYSA-N	440.821	1.051	50	20	IDGD	
Cc1nccn1-c1ncccc1CNC(=O)NNC(=O)CCCNC(=O)OC(C)(C)C	763476259	MVZFXSRLUZHSLI-UHFFFAOYSA-N	431.497	1.711	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)N2CCc3ccc(Br)cc32)cc1OC	763542049	DGLQRDQSRZBIFS-UHFFFAOYSA-N	448.273	1.817	50	20	IDGD	
CCOC(=O)c1cc(CC)sc1NC(=O)C(=O)NNC(=O)[C@H]1COc2ccccc2O1	763573881	VTRVQXJSKHHOLE-OAHLLOKOSA-N	447.469	1.413	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)ccc1Br	763678124	CWBXSULYJLNHDQ-UHFFFAOYSA-N	447.245	1.494	50	20	IDGD	
CCn1cc(NC(=O)C(=O)NNC(=O)COc2ccc(OCc3ccccc3)cc2)cn1	763679304	JWGYBZGOFJFURZ-UHFFFAOYSA-N	437.456	1.647	50	20	IDGD	
O=C(COc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1cnn(Cc2ccncc2)c1	763695408	UCJUTKHRHMUXOH-UHFFFAOYSA-N	428.836	1.145	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)C(=O)Nc2cccc([N+](=O)[O-])c2)c2ccccc2c1=O	763791718	WKDCZABAWFZIED-UHFFFAOYSA-N	438.400	1.285	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(S(=O)(=O)N3CCCC3)cc2)cc1	763829133	BLOLJBTVPHWKPU-UHFFFAOYSA-N	444.513	1.433	50	20	IDGD	
CCCNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)c1	763841210	OWBACSSTJSFAKB-INIZCTEOSA-N	440.500	1.997	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccc(C(=O)NC2CC2)cc1	763850964	RHFRIFKROSYBJE-GFCCVEGCSA-N	428.420	1.271	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ncn(C3CCCCC3)n2)c1C	763851322	SAABAESEQVBZOK-OAHLLOKOSA-N	428.493	1.954	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1cccc(C(=O)NC(C)(C)C)c1	763873502	UNEXZIZSKBKNKK-CYBMUJFWSA-N	444.463	1.907	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(C(C)=O)cc2)cc1OC	763875826	BEWFVAVALKVGRF-CQSZACIVSA-N	443.456	1.850	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)C(=O)Nc2cc(F)cc(N3CCOCC3)c2)cc1	763895880	KDZFKZDPUASKDZ-UHFFFAOYSA-N	446.504	1.849	50	20	IDGD	
COC(=O)COc1cccc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCCCC3)c1	763962140	LYDFIQXBDKMASK-UHFFFAOYSA-N	445.497	1.969	50	20	IDGD	
C[C@@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3cc(Cl)ccc3O)cn2)C[C@@H](C)O1	763973563	BBBQNBODJSYNLM-VXGBXAGGSA-N	447.879	1.454	50	20	IDGD	
COC(=O)CCCOc1ccc(NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)cc1	763977886	AQVZHVUORZJLFC-UHFFFAOYSA-N	449.847	1.777	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)C(=O)Nc1cccc(Br)c1	763994884	IUTITFCPDXJQHK-UHFFFAOYSA-N	430.056	1.939	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2OC)cc1	764012324	PQKUTKBWXWAFGJ-UHFFFAOYSA-N	435.820	1.300	50	20	IDGD	
COCCn1ccc2ccc(NC(=O)C(=O)NNC(=O)c3cccc(OC)c3O)cc21	764132723	QBMUPFAFJNPCKK-UHFFFAOYSA-N	426.429	1.402	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccc(Cl)c(C[S@](C)=O)c1	764139234	PDELNNNZKJGJOT-LJAQVGFWSA-N	437.905	1.556	50	20	IDGD	
C[C@H]1CCCCN1CC(=O)Nc1ccc(F)c(NC(=O)C(=O)NNC(=O)c2ccoc2)c1	764159530	XXLPWGAQEVSCAF-ZDUSSCGKSA-N	445.451	1.631	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)C(=O)Nc1cccc(N2CCCC2=O)c1	764204417	NOHDPKCTFBWMGZ-UHFFFAOYSA-N	447.492	1.204	50	20	IDGD	
CC(=O)N(C)c1ccccc1NC(=O)C(=O)NNC(=O)c1cc(Br)ccc1O	764279893	HBRYUBDHEVWZPG-UHFFFAOYSA-N	449.261	1.537	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@H]2C)ccc1NC(=O)C(=O)NNC(=O)c1c[nH]nc1C	764297642	GSEBOIUUBQEUPO-CYBMUJFWSA-N	426.477	1.441	50	20	IDGD	
CCCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)COCc2ccccc2)cc1	764367583	YCHTZNVKYGIUME-UHFFFAOYSA-N	448.501	1.141	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cccc(C#N)c3)n[nH]2)cc1OC	764378056	IIIURBBUJNFCFW-UHFFFAOYSA-N	434.412	1.365	50	20	IDGD	
COc1ccc(Oc2ccc(Cl)cc2NC(=O)C(=O)NNC(=O)[C@@H]2COCCO2)cc1	764434863	SGLQYXSXRDWTCE-KRWDZBQOSA-N	449.847	1.642	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)N[C@H]1CCN(c2c(F)cccc2F)C1=O	764444761	AUGASLPZUOMSGM-ZDUSSCGKSA-N	436.440	1.898	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)N[C@H](c1ccc(Cl)cc1)[C@H]1CN(C)CCO1	766317849	GDRRGXQAEMVTRA-KBRIMQKVSA-N	428.917	1.094	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNS(=O)(=O)c2ccc3c(c2)oc(=O)n3CC)cc1	767439016	ZOEVMPDICANDMB-ZDUSSCGKSA-N	449.485	1.790	50	20	IDGD	
O=C(CC(F)(F)F)NNC(=O)C(=O)Nc1ccc(Cc2nnc3n2CCCCC3)cc1	768240201	UGRAADNYKZWJLP-UHFFFAOYSA-N	438.410	1.634	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@@H](C(=O)NNC(=S)Nc3ccccn3)C2)s1	768577591	FXHVBGFCKPFNDZ-CYBMUJFWSA-N	439.588	1.870	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)c1nnn(Cc2ccc(F)cc2)c1C	769547025	IRZUDDVJZBGLRS-UHFFFAOYSA-N	439.447	1.629	50	20	IDGD	
CSCCNC(=S)NNC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(C)s2)C1	769768608	FBRZGPGRAUKYJM-LBPRGKRZSA-N	436.650	1.316	50	20	IDGD	
CCCn1c(C)cc(/C=C(/C#N)C(=O)N2CCN(S(=O)(=O)CCCOC)CC2)c1C	770334848	XTHBEZIYDHNNTD-HKWRFOASSA-N	436.578	1.932	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)NNC(=O)[C@@H](C)Oc1cccc(Cl)c1	770480854	KXQCJQUVOMKQEO-GFCCVEGCSA-N	430.852	1.739	50	20	IDGD	
CCNC(=O)N(C)NC(=O)CCc1nc2cc(S(=O)(=O)N(CC)CC)ccc2n1C	770548805	JEWPBGASPQJOIH-UHFFFAOYSA-N	438.554	1.229	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)c3ccc(S(=O)(=O)N4CCCCC4)cc3)nc21	770983576	NATRPTFRPPXORF-UHFFFAOYSA-N	431.478	1.000	50	20	IDGD	
COc1ccccc1[C@@]1(C)NC(=O)N(CC(=O)NNc2ccnc(Br)c2)C1=O	771536864	ABOCPTSHUMQYFD-GOSISDBHSA-N	448.277	1.763	50	20	IDGD	
NC(=O)CS(=O)(=O)c1ccc(C(=O)NNc2ccc(Br)c(F)c2)cc1	771674559	ILNAQXPJOKBJLA-UHFFFAOYSA-N	430.255	1.604	50	20	IDGD	
Cc1cccc(S(=O)(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)c1Br	771902371	JZWOTQJYIVKDAP-UHFFFAOYSA-N	430.236	1.995	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)[C@H]1CCN(c2ccccc2Br)C1=O	772022428	GNMWWOSBKNUEHG-MNOVXSKESA-N	426.267	1.291	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)C2(OCc3ccccc3)CCOCC2)c2ccccc2c1=O	772632144	WVAFUBZGSWRZIG-UHFFFAOYSA-N	436.468	1.461	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)Nc2cnn(Cc3nnc4n3CCCC4)c2)c1	772635550	BGTMTZUWXISGNT-UHFFFAOYSA-N	430.494	1.411	50	20	IDGD	
COc1cc(Br)c(S(=O)(=O)NNC(=O)c2ccc(C)o2)cc1C(=O)O	772857985	LSAAFDKUUPSCGS-UHFFFAOYSA-N	433.236	1.681	50	20	IDGD	
Cc1[nH]c(-c2ccncc2)nc(=O)c1CC(=O)NNC(=O)[C@@H](C)Oc1cccc(Cl)c1	772970304	BQCCFDKNJBBVAP-CYBMUJFWSA-N	441.875	1.951	50	20	IDGD	
O=C(NNc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cc(N2CCCS2(=O)=O)ccc1F	773643244	MTGUSLZBUDSGOM-UHFFFAOYSA-N	437.409	1.356	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2cc(C(=O)N3C[C@@H](C)C[C@H](C)C3)ccc2C)n1	773724074	MKGSKRCKLBRVAY-KBPBESRZSA-N	440.504	1.994	50	20	IDGD	
COc1ccccc1C(=O)NCC(=O)NNC(=O)[C@H]1CCCN(C(=O)OC(C)(C)C)C1	774270377	INNFKRWGPWMSKA-AWEZNQCLSA-N	434.493	1.220	50	20	IDGD	
COc1ccc(S(N)(=O)=O)c(OC)c1C(=O)NNC(=O)C12CC3CC(CC(C3)C1)C2	777840944	RYKIYZDYZAINJP-UHFFFAOYSA-N	437.518	1.329	50	20	IDGD	
Cc1cc(S(=O)(=O)NNC(=O)CNC(=O)OC(C)(C)C)sc1Br	777939894	RWDSYLAEOMGCAO-UHFFFAOYSA-N	428.330	1.653	50	20	IDGD	
COc1ccc2nc(NNC(=O)C(=O)Nc3ccc(S(N)(=O)=O)cc3)c(C)cc2c1	778516493	YWKFLJCEICPSDC-UHFFFAOYSA-N	429.458	1.281	50	20	IDGD	
Cc1ccc(C[C@H](C)C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)cc1	779205450	YMRJGECXRUQSHG-KRWDZBQOSA-N	431.562	1.648	50	20	IDGD	
Cn1cnc(-c2ccc(C(=O)NNC(=O)NC3CCN(C(=O)OC(C)(C)C)CC3)cc2)n1	779914474	BGXJPSMHTYRASN-UHFFFAOYSA-N	443.508	1.826	50	20	IDGD	
COC(=O)c1ccccc1NNC(=O)C1CCN(C2=NS(=O)(=O)c3ccccc32)CC1	780736958	BRORTQKBGJPCOZ-UHFFFAOYSA-N	442.497	1.777	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)CN(C)S(=O)(=O)c2ccc(NC(C)=O)cc2)c1	780802655	ZHTFKZJFOPGJFB-UHFFFAOYSA-N	434.474	1.195	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)NC[C@@H]1CC(=O)N(C2CC2)C1	780890308	FEFXLUKREMBGOL-NSHDSACASA-N	425.283	1.169	50	20	IDGD	
O=C(CN1CCc2c(ncn2-c2ccc(F)cc2)C1)NNC(=O)c1cccc([N+](=O)[O-])c1	781352507	WQZDVBLWRATLHI-UHFFFAOYSA-N	438.419	1.739	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN[C@H](C)c1cccc(S(N)(=O)=O)c1	781427092	HBOWKPWMUHMYCF-LLVKDONJSA-N	440.909	1.108	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)cc1)C(=O)Nc1cc(Cl)ccc1C(=O)N1CCCC1	782833053	BSUWWZUOKQYFSW-UHFFFAOYSA-N	430.848	1.681	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)cc1)C(=O)Nc1ccnn1Cc1cnn(-c2ccccc2)c1	782837396	KHXHWYXLULLKST-UHFFFAOYSA-N	445.439	1.222	50	20	IDGD	
COC(=O)CCNC(=O)c1ccc(NC(=O)C(=O)NNc2ncnc3ccsc23)cc1	783254769	LFIUWEUSXVONJB-UHFFFAOYSA-N	442.457	1.066	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NN=c2sc3ccccc3n2C)cc1NS(C)(=O)=O	783350973	BRRCOURRKJSJON-UHFFFAOYSA-N	433.515	1.490	50	20	IDGD	
CN(c1ccccc1NC(=O)C(=O)NNC(=O)CNC(=O)c1cccs1)C1CCCC1	784003459	GRJFMTWRMYJQAU-UHFFFAOYSA-N	443.529	1.643	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2cccc([N+](=O)[O-])c2)cc1S(=O)(=O)NC1CC1	784833272	GZMKJKPPKBXLNA-UHFFFAOYSA-N	433.446	1.426	50	20	IDGD	
Cc1cn(-c2ccc(C#N)cn2)nc1NC(=O)C(=O)NNc1ccnc(Br)c1	784837275	KYYQXIUPFMUZDT-UHFFFAOYSA-N	441.249	1.687	50	20	IDGD	
CC(=O)N(Cc1ccc(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)cc1)C1CC1	785061384	XFKNAIBYWPMLIP-UHFFFAOYSA-N	448.483	1.174	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2ccc(Cl)c(C(=O)N(C)C)c2)n1	785225110	DBEBLEMTAMLFKZ-UHFFFAOYSA-N	433.900	1.760	50	20	IDGD	
O=C(COC(=O)CCCOc1ccc2c(c1)NC(=O)CC2)NNC(=O)c1cccs1	787186164	YAUDTRTVFDFLLN-UHFFFAOYSA-N	431.470	1.796	50	20	IDGD	
CCN(C(=O)c1cc(NC(=O)C(=O)NNC(=O)Cc2ccncc2)ccc1Cl)C(C)C	787550885	ZCJUXGPWLMFMEB-UHFFFAOYSA-N	445.907	1.934	50	20	IDGD	
COc1ccc(OC)c([C@H]2C[C@@H]2C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1	788091921	UZXBJOGRYBYWQL-AEFFLSMTSA-N	425.489	1.661	50	20	IDGD	
N#CCCNS(=O)(=O)c1ccc(C(=O)NNc2nnc(-c3ccccn3)s2)cc1	788556342	JHKUNQANAPMOQF-UHFFFAOYSA-N	429.487	1.549	50	20	IDGD	
COC(=O)COc1ccc(C=NNC(=O)Cn2c(C)nc3ccccc32)cc1[N+](=O)[O-]	788701061	YADQSQGLUBYLDG-UHFFFAOYSA-N	425.401	1.955	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(C#N)cn2C(C)(C)C)cc1OC	789740963	LLWJFVBREXXWNI-UHFFFAOYSA-N	427.461	1.922	50	20	IDGD	
O=C(NNC(=O)[C@H]1OCC[C@H]1c1ccccc1)C(=O)Nc1ccc(OCC(F)F)cc1	789809917	GPARNVSFTLKHJA-WMZOPIPTSA-N	433.411	1.989	50	20	IDGD	
CSSCCNC(=O)c1ccc(F)c(S(=O)(=O)N2CCN(C(C)=O)CC2)c1	791100625	SDABEAIDSOQEOE-UHFFFAOYSA-N	435.568	1.420	50	20	IDGD	
O=C(NNC(=O)c1cc2c(s1)CCC2)C(=O)Nc1cccc(N2C(=O)CCCC2=O)c1	792356048	YJTKRTRUOUYQCH-UHFFFAOYSA-N	440.481	1.680	50	20	IDGD	
C[C@@H](C(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)[C@H]1OCCc2sccc21	796496798	YVCZKWXSXZHONY-PIGZYNQJSA-N	433.442	1.911	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)C(C)(C)c2ccc3c(c2)OCO3)cc1OC	796528605	CBNMCDYUZHZRPV-UHFFFAOYSA-N	444.440	1.715	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNc2ccc(C(F)(F)F)nn2)c(OC)c(C)c1OC	797081293	NJLXLLYJMDYMLF-UHFFFAOYSA-N	429.355	1.911	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(O[C@H]3CCN(C)C3=O)cc2C)c(O)c1	799258414	BZCOEMMPZHIAKS-SFHVURJKSA-N	440.456	1.018	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)NCCS(=O)(=O)CCc1ccccc1	800065998	XDIGCSCXRDJQKU-UHFFFAOYSA-N	439.921	1.950	50	20	IDGD	
C[C@H]1C[C@@H](C)O[C@@H]1C(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	800320130	RNWJEHRFJASVPQ-KHYOSLBOSA-N	431.514	1.740	50	20	IDGD	
COCN1C(=O)CCc2cc(NC(=O)NNC(=O)c3cncc(NC(C)=O)c3)ccc21	801785333	FNZWWKMAMNOAOA-UHFFFAOYSA-N	426.433	1.390	50	20	IDGD	
Cc1ccc2c(c1)nc(CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)n2C	802322503	PLYIKWXEXCRFHE-UHFFFAOYSA-N	444.517	1.276	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)N3CCC[C@@H](CN(C)S(C)(=O)=O)C3)cc2C1	804868376	GDGAWMSQQXNSSD-KGLIPLIRSA-N	442.607	1.831	50	20	IDGD	
CCOC(=O)C(C)(C)CC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	805153621	FJCONXNWNVRZBM-UHFFFAOYSA-N	439.534	1.602	50	20	IDGD	
Cc1c(C(F)(F)F)nn(C)c1NC(=O)C(=O)NNC(=O)c1cccc(OC(F)F)c1	806978638	IDSDYWYXWQLJOZ-UHFFFAOYSA-N	435.309	1.748	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)c1ccc2c(c1)C(=O)N(Cc1ccncc1)C2=O	807371256	IGKWLYDDSPCJBJ-UHFFFAOYSA-N	440.456	1.428	50	20	IDGD	
CC(=O)N1C[C@@H]2CCC[C@H](NC(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)[C@H]2C1	808357624	LKPCGGFRQBOYNC-JYJNAYRXSA-N	425.530	1.269	50	20	IDGD	
CCc1cc(NNC(=O)CNS(=O)(=O)c2cccc(C#N)c2)nc(-c2ccccn2)n1	810385295	QPDSFDRSZQENKT-UHFFFAOYSA-N	437.485	1.394	50	20	IDGD	
CN(C)S(=O)(=O)CCNC(=O)C(=O)Nc1ccccc1S[C@H](Cl)C(F)(F)F	810494873	DEFOASIXFJLEOP-ZDUSSCGKSA-N	447.888	1.852	50	20	IDGD	
O=C(CNS(=O)(=O)c1cccc(Br)c1)NNc1cnc2ccccc2n1	811462346	WZOCBATWZLZXTH-UHFFFAOYSA-N	436.291	1.814	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)[C@](N)(c2cccc(F)c2)C(F)(F)F)cc1	812730591	OFFPHXWXQLHYBF-MRXNPFEDSA-N	434.415	1.936	50	20	IDGD	
C[C@H](C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1)C1CN(C(=O)OC(C)(C)C)C1	812731754	SPQWIYPBQVNOTQ-ZDUSSCGKSA-N	426.539	1.883	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)C(=O)Nc1cccc(C2CCC2)c1	812982475	MMEUEUZFDORSEO-UHFFFAOYSA-N	429.502	1.647	50	20	IDGD	
CC(C)COC(=O)N1CCC(=NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)CC1	814879686	WWIMBCKVOOJYGW-UHFFFAOYSA-N	443.548	1.805	50	20	IDGD	
C#CCOc1ccc(F)cc1NC(=O)C(=O)NNc1ccccc1S(=O)(=O)N(C)C	815752514	VLLCLFTZNFRQPK-UHFFFAOYSA-N	434.449	1.170	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)C(=O)Nc2ccn(CC(F)F)n2)c1	815866629	JEFPXFHPNVENQC-UHFFFAOYSA-N	446.208	1.779	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)CN2C(=O)[C@H]3CCCC[C@H]3C2=O)c1	818767514	LTLOFVZKBKSDQD-TXEJJXNPSA-N	438.278	1.854	50	20	IDGD	
COCCNC(=O)CSc1ccccc1C(=O)NNC(=O)[C@@H]1COc2ccccc2O1	859414959	OIQQYPIPYQPMJG-KRWDZBQOSA-N	445.497	1.142	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@H](B(O)O)C2)cc1S(=O)(=O)N1CCCc2ccccc21	864232550	AEZJKZWWKWAWKS-KRWDZBQOSA-N	444.318	1.526	50	20	IDGD	
Cc1ccc(-c2nnn(CC(=O)NNC(=O)c3nn(C(C)C)c(=O)c4ccccc34)n2)cc1	906486591	GBERQDJFWQUANW-UHFFFAOYSA-N	446.471	1.401	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)CN2C(=O)N[C@]3(C[C@@H](C)CC(C)(C)C3)C2=O)c(C)c1	913164893	XKMPIRLBVJBPAD-WNSKOXEYSA-N	443.548	2.000	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@@H](C)C(=O)NNC(=O)Cc1ccc(S(N)(=O)=O)s1	915188856	YUJSAJDWKSIJCN-NSHDSACASA-N	445.950	1.823	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)CNS(=O)(=O)c2cccs2)cc1OC	915188907	GEEBMCILGPYGOA-UHFFFAOYSA-N	427.504	1.285	50	20	IDGD	
CC(=O)NNC(=O)Cc1csc(NC(=O)c2ccccc2I)n1	916110859	XMTTVQOJWXAQQX-UHFFFAOYSA-N	444.254	1.710	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)NCc1ccc(CN2CCN(C)CC2)cc1	916387859	IWJDJCZLRXQVEN-UHFFFAOYSA-N	435.532	1.534	50	20	IDGD	
N#Cc1cccc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1	916407007	PDNUSSYMVJHUCE-UHFFFAOYSA-N	427.486	1.487	50	20	IDGD	
CC(C)(C)CCNC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	916630726	DPGOUXCDLVTSSU-UHFFFAOYSA-N	440.566	1.407	50	20	IDGD	
Cc1nn([C@@H]2CCS(=O)(=O)C2)c(C)c1C=NNC(=O)COc1ccccc1[N+](=O)[O-]	917027585	DSGYQISKTHPORE-CQSZACIVSA-N	435.462	1.297	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@H](C)Cc2ccccc2C)cc1	918222859	LAQKMZTXJZUOAY-QGZVFWFLSA-N	432.546	1.886	50	20	IDGD	
COc1ccnc(NNC(=O)NCc2ccc(S(=O)(=O)N3CCC[C@@H](C)C3)cc2)n1	918228116	LKXHAIVQYLSTEZ-CQSZACIVSA-N	434.522	1.732	50	20	IDGD	
CSCC[C@@H](NC(=O)c1ccc([N+](=O)[O-])o1)C(=O)NNC(=O)c1ccc(C)cc1O	919818239	BABIEPOSCPAPLD-GFCCVEGCSA-N	436.446	1.515	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)CCc2c(C)nc(N3CCOCC3)nc2O)cc1	919836492	UGBJJXBVHKDGTR-UHFFFAOYSA-N	443.504	1.049	50	20	IDGD	
Cc1sc2nc(CCC(=O)NNC(=O)[C@H]3COc4ccccc4O3)nc(O)c2c1C	920340660	YSYJBPWQNFFGDR-CQSZACIVSA-N	428.470	1.934	50	20	IDGD	
COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)NNC(=O)CN2CCCC2=O)cc1	920435864	OPJIALJKUPTVRY-UHFFFAOYSA-N	428.401	1.779	50	20	IDGD	
CCNC(=O)CN(C)C(=O)/C(C#N)=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	920855195	YXTZFOVHSMXNEM-XNTDXEJSSA-N	442.907	1.580	50	20	IDGD	
O=C(NC[C@H](O)c1ccccc1C(F)(F)F)NNC(=O)c1ccc(-n2cnnn2)cc1	921070749	CLPQJISAAWTEOX-HNNXBMFYSA-N	435.366	1.359	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)CNC(=O)c1ccc(C)s1	1317690608	PQEVZIIVOCMENC-UHFFFAOYSA-N	439.877	1.453	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1)[C@@H](C)N1CCOCC1	1318971782	DHPKVLBLVPAGGF-HUUCEWRRSA-N	427.546	1.073	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)[C@@H]2Nc3ccccc3S(=O)(=O)N2)cc1OC	1319400923	PHUVJYAAKNMNIP-GOSISDBHSA-N	448.501	1.365	50	20	IDGD	
CC(C)[C@H](NC(=O)OC(C)(C)C)C(=O)NCC(=O)NNc1cncc(Br)c1	1323291608	XMUWSTYUVDMIHI-AWEZNQCLSA-N	444.330	1.953	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N1CCC2(CC1)CNC(=O)O2	1520844779	IWSZBSFQBIEMIW-LLVKDONJSA-N	441.282	1.532	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnnc4ccccc34)C2)C1	1777730463	YSHUXRWGIBKBRH-YJYMSZOUSA-N	433.306	1.857	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cccc4c3cnn4C)C2)C1	1778031228	AZRMMICAQGSDKH-YJYMSZOUSA-N	435.322	1.800	50	20	IDGD	
Cn1cc(C(=O)N2CC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)c(C(F)(F)F)n1	1779544756	VAQPOVDDPOLNKO-CQSZACIVSA-N	429.226	1.686	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc[n+]([O-])cc2)C1	1779946089	PTHFNDDNJOMUSL-GPMSIDNRSA-N	440.338	1.621	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Br)C2)c1ccc(O)nc1	1780129611	VCDZQMVZMFCUDF-HACGYAERSA-N	430.274	1.605	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(Cl)cc4nn[nH]c34)C2)C1	1780224483	NDGLDKRYGKVKDR-ACJLOTCBSA-N	442.303	1.309	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(-n4ccnc4)ccn3)C2)C1	1780392276	ONONQJGICZODPL-AUUYWEPGSA-N	448.321	1.494	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H]2CCCN(C)C2)C1	1780569016	XRYQCJBIKUQBAI-TVKQPGBESA-N	444.414	1.873	50	20	IDGD	
CC(=O)N(C)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Br)C1	1780771055	RLHPOKVXGFMKIK-FRFSOERESA-N	436.322	1.059	50	20	IDGD	
Cc1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C3)ccc1O	1780928789	SPEOYFISVWACFK-AUSIDOKSSA-N	446.548	1.201	50	20	IDGD	
O=C(c1ccc2c(c1)OCCO2)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781330492	YEAGTCBCZMQVTJ-CRAIPNDOSA-N	443.269	1.592	50	20	IDGD	
O=C(c1ccc(-c2cccnc2)cc1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1781448050	DRRRBAPJOORXGZ-SIKLNZKXSA-N	429.904	1.792	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1ccn(C)n1)C2	1781998056	MTLSHHKANPPJKF-DDUZABMNSA-N	427.343	1.260	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4ccoc4c3)C2)C1	1782326913	QSKXLWFJGUCOIS-HSZRJFAPSA-N	449.467	1.189	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@@]2(CN(C(=O)CN3CCCC3)CCO2)C1	1782861106	GPOYKZKWEJUANN-JBSURENYSA-N	444.482	1.797	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)CC(=O)OC(C)(C)C)CCO2)C1	1783342373	IPIHZCRHBJCTOZ-ACJLOTCBSA-N	433.343	1.722	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cn(C)nc3C(F)F)CCO2)C1	1783347550	LALBVWKKLICJEB-PXAZEXFGSA-N	449.296	1.975	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)C3(O)CCC3)[C@H]2C1	1783516158	MNEBOFRANQXWQZ-CWVYHPPDSA-N	431.371	1.691	50	20	IDGD	
COc1cc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](C)Br)C3)C2)cc(Cl)n1	1783538756	VPRXDBWWEDATFT-DIFFPNOSSA-N	446.729	1.971	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(C)(C)CCl)[C@H]2C1	1783853688	SXNNHQWFDDKNAA-AJNGGQMLSA-N	447.960	1.074	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@H](C(=O)N2CC[C@@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)C1	1783863866	NIMIPDXUDJZILC-CSODHUTKSA-N	440.613	1.647	50	20	IDGD	
C[C@@H](Sc1ccccn1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]2C1	1784096258	VARZOQCAZNXXNM-CWVYHPPDSA-N	427.954	1.142	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H]3CCOC3)C2)C1	1784722131	IQQLGBOXXMFYAW-VFNWGFHPSA-N	447.444	1.000	50	20	IDGD	
Cc1noc(C)c1CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)Br)C[C@@H]21	1785361623	UCXIQEMPEXRLEF-GQGQLFGLSA-N	442.354	1.987	50	20	IDGD	
CC[S@](=O)CCC(=O)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1	1788142120	BYQFVPPKWDEFKA-HKBQPEDESA-N	442.346	1.273	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)C3CCC(O)CC3)CCC2)cc1)c1ccc(B(O)O)cc1	1788143424	CQCYOCBKIUQFOY-UHFFFAOYSA-N	436.317	1.665	50	20	IDGD	
C[C@H](C(=O)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1)n1ccnc1	1788145286	WLGIKPVESBJTTO-MRXNPFEDSA-N	432.289	1.572	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)c1cc2c(s1)CCCC2	1788305056	KUPDZBNDJSLCIG-JONQDZQNSA-N	426.966	1.820	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)c1cc2n(n1)CCCC2	1788355467	LHKDUURCKSTBMK-DLKVLKDVSA-N	443.317	1.503	50	20	IDGD	
O=C(Cc1ccc(Br)nc1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21	1789678970	KNJVCLCROUYLIB-QCQGSNGOSA-N	448.720	1.901	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)Cc3ccccc3)[C@H]2C1	1790957036	PIJCXLWMRVXZLY-CURYNPBISA-N	443.371	1.806	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(O)n3)C[C@@H]21	1790960786	GDDRFIWVCMAYHY-ABHRYQDASA-N	426.311	1.554	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc(OC)c(F)c3)C[C@@H]21	1791252613	QAZQVVGNXRJXOG-PCBIJLKTSA-N	429.876	1.076	50	20	IDGD	
CCC(=O)N[C@@H](C)C(=O)NC1(c2ccc(NC(=O)CCC(=O)NN(C)C)cc2)CCC1	1791599546	LJGXMHMIRSKCGY-HNNXBMFYSA-N	431.537	1.408	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c(F)ccc(O)c1F)C2	1792873930	GVMBSUDLWXSMGU-OJLPPKNESA-N	447.276	1.905	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c(Cl)ccc(Cl)c1O)C2)[C@H](O)CCl	1792980067	KUMJJTYKTZSBAZ-XSPYEYLBSA-N	437.707	1.502	50	20	IDGD	
O=C(CSc1ccccc1[N+](=O)[O-])N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCl	1793116062	GCSXBTZKIOPQGV-XFMPKHEZSA-N	427.910	1.925	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CC[C@H](C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](O)CCl)C3)C1	1793335716	BIBKUNCAXTZXFE-NEXGVSGLSA-N	443.972	1.918	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(Cl)c3nncn3c1)C2	1793448738	IEFCWABUMDRWMP-FQLMCAECSA-N	440.331	1.993	50	20	IDGD	
C=CC[C@H](C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1793879116	IYRSMYPGVNGUOZ-KSWRQPAISA-N	443.972	1.920	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cncc(S(C)(=O)=O)c1	1794318774	PVZCFYVMDFFBFZ-YALNPMBYSA-N	443.953	1.096	50	20	IDGD	
CCn1nc(C(C)C)cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1	1796188514	PFYDJAXJOBMQRP-REPLKXPHSA-N	438.337	1.272	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(CCN2CCCC2)nc1	1796504882	ZVUZXZCGPQWALF-YHELAOLJSA-N	448.995	1.941	50	20	IDGD	
COc1cc(C#N)cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCBr)C3)c1	1798574033	HDGXUMMUBPHCOE-JLVBRIDZSA-N	436.306	1.555	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CC13CCCN1CCC3)C2	1800642269	AKETXFUJABWMNV-KYHPRHEASA-N	442.398	1.768	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)[C@@H]1CCc2ccccc2O1	1800954601	WIKXBQOENACJRQ-QMPXSYISSA-N	441.297	1.660	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)COc2ccc(O)cc2)[C@H]1c1cccnc1)[C@H](O)CCl	1803136557	CVAQCZFZBHRXBG-CVAIRZPRSA-N	433.892	1.472	50	20	IDGD	
O=C(c1ccc(N2CCOCC2)cc1)N1CCC2(CCCN(C(=O)[C@@H](O)CCl)C2)CC1	1805523145	IGQGMTJMAOFEHA-FQEVSTJZSA-N	449.979	1.968	50	20	IDGD	
CN(C)C(=O)c1cccc(C(=O)N2CCC3(CCCN(C(=O)[C@H](O)CCl)C3)CC2)c1	1805529080	JMSKDZQTWVNGEO-GOSISDBHSA-N	435.952	1.833	50	20	IDGD	
Cc1noc(CC(=O)NC[C@H]2CCN(C(=O)CO[Si](C)(C)C)[C@@H]2c2cccnc2)n1	1807525941	SNQSLTNGHSUOEX-OXQOHEQNSA-N	431.569	1.873	50	20	IDGD	
Cc1ncccc1C(=O)N1CCCC2(CCN(C(=O)c3cnccc3C(=O)NN)CC2)C1	1808189772	VRSKFISUTNUCBB-UHFFFAOYSA-N	436.516	1.547	50	20	IDGD	
CC(=O)N/C(C)=C/C(=O)N1CC[C@H](CNC(=O)[C@@H](F)Br)[C@@H]1c1cccnc1	1808678025	FBRCYWXLKJIRLY-VTSGDJLPSA-N	441.301	1.818	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CCn2cncn2)[C@H]1c1cccnc1)[C@@H](F)Br	1808681826	VYKBGEHRLGLUAT-CWRNSKLLSA-N	439.289	1.460	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2cccc(F)n2)[C@H]1c1cccnc1	1810769953	XUQRUZAGRCTMRN-IIBYNOLFSA-N	442.495	1.308	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)/C=C/c2cnccn2)[C@H]1c1cccnc1	1813033812	SJDVGIVHNOSVMM-WJTBJXONSA-N	429.908	1.845	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)[C@@H]2CCCS2)[C@@H]1c1cccnc1	1813074452	RVHNFGGKDVBLAO-ABSDTBQOSA-N	433.578	1.356	50	20	IDGD	
Cc1cc(C)cc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)c1	1815343604	CVVZMYUXWCSDAK-GOSISDBHSA-N	449.341	1.979	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(O)nc(O)n3)sc2C1	1817103450	ARZBSPIOCXQUPA-SECBINFHSA-N	437.554	1.422	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](F)Br)CC2)c1nc[nH]c1[N+](=O)[O-]	1817203211	RWXDFHBYPLJGEC-CDUCUWFYSA-N	447.246	1.691	50	20	IDGD	
CCc1ccnc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)c1	1817471087	DSSQDFJTFDJLFT-FQEVSTJZSA-N	447.304	1.667	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3cnc4ncccn34)sc2C1	1818439754	ARGVNRKHBCSATK-WDEREUQCSA-N	434.909	1.665	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc3n(n2)CCCO3)n[nH]1	1819091087	PBDWAMNKLDTQEG-DOMZBBRYSA-N	436.900	1.948	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccncc2)[nH]n1	1819401857	CHONGLZSFINWAU-QGZVFWFLSA-N	434.460	1.423	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H]2C[C@]2(F)Cl)[nH]n1	1819404781	YRRSXDYYTPQGKB-SPKLELGKSA-N	449.874	1.639	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](C)Nc2cnccn2)n[nH]1	1819422771	BWURLINAIDDGBE-IPYPFGDCSA-N	435.916	1.946	50	20	IDGD	
CCNC(=S)NCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](Cl)COC)[nH]n1	1821646437	YAKADNDUEFEVQM-YPMHNXCESA-N	430.962	1.140	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](N)Cc2cccnc2)[nH]n1	1822368927	JPCAKUXRKQNYQE-ZOBUZTSGSA-N	434.928	1.621	50	20	IDGD	
CC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc3n(n1)CCNC3=O)CC2	1822844294	YBFGIGSUVIKXOG-ZJUUUORDSA-N	436.925	1.326	50	20	IDGD	
CCOCCC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1822931614	FANNOXULVDBWSZ-MRXNPFEDSA-N	429.481	1.141	50	20	IDGD	
C[C@H](Cn1cncn1)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1	1823008810	WRQRGEHICYTIOO-LNLATYFQSA-N	445.318	1.673	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@H]2CCC(=O)NC2)CC1	1823842848	GNAKNCDJKJCOPU-CWRNSKLLSA-N	428.371	1.916	50	20	IDGD	
O=C(c1nn[nH]c1C(F)(F)F)N1CCC([C@H]2CCCCN2C(=O)[C@H](O)CCl)CC1	1824185470	JMWHVHIALGRUKZ-VXGBXAGGSA-N	437.850	1.657	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](N)Cc1cscn1)CC2	1825998873	OEDGYKUPASJWSV-JLLWLGSASA-N	443.982	1.335	50	20	IDGD	
CN[C@@H](CC(=O)N1CCC([C@H]2CCCCN2C(=O)CCBr)CC1)C(=O)O	1826357597	BLAGWWQTUIRIPU-LSDHHAIUSA-N	432.359	1.454	50	20	IDGD	
CC(=O)OC[C@H](OC(C)=O)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@H](F)Cl)CC1	1828954401	XUAZLJZOAAFBBP-ULQDDVLXSA-N	434.892	1.635	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CCC(F)(F)C1)CCO2	1829653687	DWXVALHROPVXBB-YJBOKZPZSA-N	434.556	1.730	50	20	IDGD	
O=C(CN1CCOCC1)N1CCC([C@H]2CCCCN2C(=O)[C@H](F)Br)CC1	1830375461	UMCZRLGVMSEMDX-WBVHZDCISA-N	434.350	1.629	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3(C(=O)OCC)CC3)C2)C1	1831656123	AXFOGMRJFKMVQD-KXBFYZLASA-N	430.929	1.194	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2cnccn2)CC1	1832305078	KVQZLPILMJYAES-IEJURRBGSA-N	442.564	1.483	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)/C=C/c3ccoc3)CCO2)C1	1832643950	XGJMKECMTAAJIC-QIGIYGOBSA-N	441.322	1.780	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCCc3ccncc3)CCO2)C1	1833060106	UHAUVVIHFDAGDA-GHTZIAJQSA-N	439.940	1.115	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)C3CC(O)C3)CC2)CC1	1833276216	BJUNXIBLFCIBIX-QWFMPGPPSA-N	430.387	1.502	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3ccc4c[nH]nc4c3)CC2)CC1)[C@@H](O)CCl	1833310669	OEJKHYBWLCSEKZ-IBGZPJMESA-N	433.940	1.348	50	20	IDGD	
C[C@H](C(=O)NC1CCN(C2CCN(C(=O)CO[Si](C)(C)C)CC2)CC1)n1ccnc1	1833377032	WYQJWEKZSVBAHA-QGZVFWFLSA-N	435.645	1.867	50	20	IDGD	
CC[C@H](NC(C)=O)C(=O)N1CCC(N2CCC(NC(=O)CCBr)CC2)CC1	1834421490	KDRRRATWCFMRCR-KRWDZBQOSA-N	445.402	1.258	50	20	IDGD	
O=C(CCBr)NC1CCN(C2CCN(C(=O)C(=O)c3ccco3)CC2)CC1	1834422343	KGIAZOABINFPAQ-UHFFFAOYSA-N	440.338	1.819	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)c3ccc(Cl)cn3)C2)C1	1834823083	HZRMJJHFCGTEHD-KRWDZBQOSA-N	446.729	1.590	50	20	IDGD	
CCc1cc(C(=O)NC2CCN(C3CCN(C(=O)CCBr)CC3)CC2)n[nH]1	1834921667	VSWRPTIQWGZFPU-UHFFFAOYSA-N	440.386	1.942	50	20	IDGD	
Cn1cc(CCC(=O)N2CCO[C@]3(COCCN(C(=O)[C@](C)(Cl)CCl)C3)C2)cn1	1835988517	ZIEIPHWKPAIGPF-RTBURBONSA-N	447.363	1.045	50	20	IDGD	
Cn1ccc(=O)cc1C(=O)NC1CCN(C2CCN(C(=O)C(Cl)Cl)CC2)CC1	1836110382	KQXQCTRGNFFPSX-UHFFFAOYSA-N	429.348	1.374	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1)c1ccc(O)nc1	1836143796	GPBJVPSWWWISNB-INIZCTEOSA-N	443.317	1.663	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)[C@@]3(C)CCCN3)CC2)CC1	1836382257	VYQXFQXVKIOJPW-MGPUTAFESA-N	443.430	1.731	50	20	IDGD	
CC(C)(C)[C@H](O)C(=O)N1CCC(N2CCC(NC(=O)[C@H](F)Br)CC2)CC1	1836413705	MLUQLHNWTOTHEY-CABCVRRESA-N	436.366	1.656	50	20	IDGD	
O=C(C1=NO[C@H](c2ccccc2)C1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1836587279	IDNBBGWISQGRRQ-QKLQHJQFSA-N	439.871	1.495	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3c(C)nc4sccn34)CCO2)C1	1837145531	XPMHGCSVNYPWDJ-KUHUBIRLSA-N	440.953	1.792	50	20	IDGD	
Cn1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)c2cccnc21	1837191217	JVEQFIQXHVCHFU-IBGZPJMESA-N	441.315	1.447	50	20	IDGD	
CC(=O)NCCC(=O)N1CCC(OC2CCN(C(=O)CCBr)CC2)CC1	1837654860	BKQSJKZSDXRYOE-UHFFFAOYSA-N	432.359	1.296	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)COc3ccccc3)C2)C1	1837712235	KPXKHBMKUZFMHD-OAQYLSRUSA-N	436.581	1.373	50	20	IDGD	
COc1cc(OC)c(F)c(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)c1	1838552366	CHNGRRTUCVIYNM-QFBILLFUSA-N	448.850	1.447	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@H](C)n3ccnn3)CC2)CC1	1838730381	OQNYHMUDIPBZDQ-YOEHRIQHSA-N	427.933	1.092	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(OC)c3F)C2)C1	1839149943	WXMIGICHNKSJPJ-YWZLYKJASA-N	428.888	1.922	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3CCSCC3)C2)C1	1839156260	JWNBBJJWYQUBMV-ZWKOTPCHSA-N	439.405	1.822	50	20	IDGD	
Cc1nc(F)ccc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839200076	DBJWYNBJDPQVAR-WMLDXEAASA-N	448.264	1.290	50	20	IDGD	
C[C@H](C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](F)Br)CCO2)C1)c1cccs1	1839203112	AIRDUYPLLLFTEM-JDFRZJQESA-N	449.342	1.999	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)C#Cc3ccccc3)C2)C1	1840032065	MYPXMVKYMXUEPS-JXFKEZNVSA-N	435.318	1.278	50	20	IDGD	
CC(C)(C(=O)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1)c1ccccn1	1840330193	OYAFMTJNFJKTHV-LJQANCHMSA-N	430.332	1.619	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC12CN(C(=O)[C@@H](C)[C@H]1SC(=N)NC1=O)C2	1841286724	WHRFCXZJXATOPO-OUAUKWLOSA-N	431.356	1.023	50	20	IDGD	
COc1cc(N2CCC(C(=O)N3CCCC34CN(C(=O)C(Cl)Cl)C4)CC2)ncn1	1841460992	TYEMDJOPQWQLSD-UHFFFAOYSA-N	442.347	1.709	50	20	IDGD	
O=C(c1cnc2ccc(Cl)cc2c1)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843012210	OZEGACBNBMPRQX-UHFFFAOYSA-N	449.703	1.699	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)CCc2c[nH]c3ccccc23)C1	1843070678	YIHPHDPNCRGQKQ-UHFFFAOYSA-N	446.511	1.616	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCCC12CN(C(=O)c1ccccc1C(=O)OCCO)C2	1844378671	RYNVGUJAYBLGPQ-UHFFFAOYSA-N	434.565	1.504	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H](C(=O)N2CCCC23CN(C(=O)[C@H](O)CCl)C3)C1	1846355772	GWBYXPKVHKHQHA-BZUAXINKSA-N	443.972	1.873	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)C1CCN(C)CC1	1847304498	CQALHIZBNOOSRP-OALUTQOASA-N	444.488	1.677	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CSC1CCCC1	1847795678	QNXKPXIZHKWDEG-YMQCXJOPSA-N	431.562	1.998	50	20	IDGD	
CNS(=O)(=O)Cc1ccc(CNC(=O)NNC(=O)COc2ccc(C)c(C)c2)cc1	9811399	WDWUMJXUYIALTL-UHFFFAOYSA-N	434.518	1.262	50	20	IDGD	
CCn1c(NNC(=O)CS[C@H](C)C(=O)Nc2cc(C)on2)nc2ccccc2c1=O	11155299	BEHIDVMIAVHIOO-GFCCVEGCSA-N	430.490	1.916	50	20	IDGD	
O=C(NNC(=O)C1CCN(S(=O)(=O)c2ccc(Br)s2)CC1)C1CC1	15794083	JCLVHOXEIMMMIR-UHFFFAOYSA-N	436.353	1.469	50	20	IDGD	
CSCC[C@H](NC(=O)c1ccccc1)C(=O)NNC(=O)COc1ccc(C#N)cc1	15888901	OUYNSOWZQGSHKF-SFHVURJKSA-N	426.498	1.636	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)CCn1c(=O)[nH]c(=O)c2ccccc21	18053448	ROIIOEFWVHGBKZ-OAHLLOKOSA-N	446.463	1.848	50	20	IDGD	
COc1ccc(C(=O)NCC(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)cc1[N+](=O)[O-]	25262234	FLHLAQJGOKLWHK-UHFFFAOYSA-N	430.461	1.697	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@@H]2CC(=O)N(c3cc(C)ccc3OC)C2)cc1OC	28776800	RKKXITGWNRNSJG-OAHLLOKOSA-N	427.457	1.835	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cc(C)nc3c2c(C)nn3C)cc1OC	105736683	KTOOYHPAMJVRGI-UHFFFAOYSA-N	441.444	1.220	50	20	IDGD	
O=C(CNS(=O)(=O)c1cccs1)NNC(=O)c1ccc(COc2ccccc2)o1	106028642	HVZUYHGKUJJMCX-UHFFFAOYSA-N	435.483	1.660	50	20	IDGD	
CC(=O)NC1CCC(NC(=O)NNC(=O)COc2ccc(Br)cc2)CC1	725876970	XFIWJHIQPCJMHX-UHFFFAOYSA-N	427.299	1.606	50	20	IDGD	
Cc1ccc([C@@H](CN2CCOCC2)NCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1	727385054	XDVRUNIPYPUJSG-HXUWFJFHSA-N	441.488	1.327	50	20	IDGD	
CN(Cc1ccccc1)CC1CCN(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)CC1	727473908	UFICQIBQDBQAKU-UHFFFAOYSA-N	448.531	1.861	50	20	IDGD	
Cn1nc(Br)c2c(=O)n(CC(=O)NNC(=O)CCCc3ccccc3)cnc21	727715759	XBRXRLGOFSFDFX-UHFFFAOYSA-N	447.293	1.063	50	20	IDGD	
CN(C)CC(=O)NNC(=O)C1CCN(S(=O)(=O)c2cc(Cl)ccc2Cl)CC1	727761563	OWUBHSOIWGOWPL-UHFFFAOYSA-N	437.349	1.103	50	20	IDGD	
CN1CCN(C(=O)c2ccc(CNC(=O)NNC(=O)CCCc3ccccc3)cc2)CC1	727841887	CUVMNMLWCHQUIT-UHFFFAOYSA-N	437.544	1.928	50	20	IDGD	
C[C@@H]1CN(S(=O)(=O)c2cccc(C(=O)NNC(=S)NCC3CCC3)c2)C[C@@H](C)O1	727867001	KRZQLMNBFOSEDR-ZIAGYGMSSA-N	440.591	1.394	50	20	IDGD	
CCCCCCn1nc(C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)c2ccccc2c1=O	728372185	KQACOFYGJRRVML-AWEZNQCLSA-N	434.518	1.173	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)c1occc1CN1C(=O)Cc2ccccc21	728521340	CETVRZHAOIHQKJ-UHFFFAOYSA-N	438.465	1.621	50	20	IDGD	
Cc1ccc(C(=O)N[C@@H](CC(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)c2ccccc2)cc1	729827837	UISSDNDDXWLLBX-MOPGFXCFSA-N	443.525	1.438	50	20	IDGD	
CCN1CCN(c2ccc(CNC(=O)NNC(=O)Cn3nc(C)cc3C)cc2F)CC1	730133790	GCGCAMKKZLHLAX-UHFFFAOYSA-N	431.516	1.312	50	20	IDGD	
Cc1cccc(N2C(=O)N[C@@H](CCC(=O)NNC(=O)COc3ccccc3O)C2=O)c1	730781376	LKKFMKXHRNZZOY-HNNXBMFYSA-N	426.429	1.132	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)[C@H]1CCCN(S(=O)(=O)Cc2ccccc2)C1	730782492	PLDXMVHLXNRZHN-KRWDZBQOSA-N	447.513	1.160	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)c2ccsc2NC(=O)c2ccco2)c2ccccc2c1=O	731470795	JFTKJEKZIBVOQO-UHFFFAOYSA-N	437.437	1.915	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)c1ccc(OC)c(S(=O)(=O)NC2CCCC2)c1	731493446	YPOPWLGLDIFTFU-UHFFFAOYSA-N	447.513	2.000	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2ccc(I)c(F)c2)C[C@H](C)O1	732262072	IKHZYADNXGAIAT-QWRGUYRKSA-N	449.264	1.691	50	20	IDGD	
O=C(CCN1CCN(C(=O)[C@H]2CCCO2)CC1)NNc1nc(-c2ccc(Cl)cc2)no1	732975672	SNNPSZJVUNQYBI-MRXNPFEDSA-N	448.911	1.546	50	20	IDGD	
CN(C)c1ncc(Br)cc1C(=O)NNC(=O)c1nnc(O)c2ccccc12	733251554	ZNASBKFXNRJDRY-UHFFFAOYSA-N	431.250	1.634	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2cc(C(=O)NNC(=O)c3cnn(C)c3)ccc2C)cc1	735471092	NRCANEIGHADQEL-UHFFFAOYSA-N	427.486	1.913	50	20	IDGD	
NS(=O)(=O)Cc1ccc(C(=O)NNC(=O)NCc2cccc(C(F)(F)F)c2)cc1	736554579	SPUBZWJEIWPSDD-UHFFFAOYSA-N	430.408	1.638	50	20	IDGD	
COc1cccc(OCCCNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1	738476563	ZEAXTHSRNUIQNI-UHFFFAOYSA-N	428.493	1.501	50	20	IDGD	
COc1ccc(S(=O)(=O)CCC(=O)NNC(=O)COc2ccc(F)cc2)cc1OC	740813747	SRWOKRKXAJKZKW-UHFFFAOYSA-N	440.449	1.233	50	20	IDGD	
CS(=O)(=O)CC[C@@H](Cc1cccc(Br)c1)C(=O)NNC(=O)C1CCC1	741220529	SJWJMFYOZCRYAW-AWEZNQCLSA-N	431.352	1.990	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCc2cccc(C(F)(F)F)c2)ccc1OCC(N)=O	742459937	YUMPTURREZPNNB-UHFFFAOYSA-N	440.378	1.722	50	20	IDGD	
Cc1ccc(CN2C(=O)CC[C@H]2C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)cc1	742676699	KXYGXBAXOLATLJ-INIZCTEOSA-N	433.509	1.341	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)Cc2c(C)nc3c(c(O)nn3C)c2C)c1	744967740	ONRUJABMMXGJCZ-UHFFFAOYSA-N	425.445	1.146	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)[C@@H](c2cccc(F)c2)N2CCOCC2)cc1	745423524	IBLXKWKZXMOBQI-HXUWFJFHSA-N	429.448	1.512	50	20	IDGD	
COc1ccccc1Cn1c(SCC(=O)NNC(=O)N(C)C)nc2ccccc2c1=O	746007972	IGBAQGSHKINZGH-UHFFFAOYSA-N	441.513	1.848	50	20	IDGD	
NC(=O)c1nccnc1C(=O)NNC(=O)c1ccc(COc2ccc(Cl)cc2)cc1	746094071	RKJHLNZZSVIUOK-UHFFFAOYSA-N	425.832	1.883	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)[C@@H]1CCCN(C(=O)NC2CCCC2)C1	746094395	IODPAIOZZMIDBA-MRXNPFEDSA-N	432.521	1.976	50	20	IDGD	
O=C(NCCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1)NNc1ccc(Cl)c(F)c1	746757517	XRGCKVOLTFRYOA-UHFFFAOYSA-N	431.833	1.992	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2ccc[nH]2)cc1S(=O)(=O)N[C@H]1CCCC[C@H]1C	747662307	KEKZINZOFYVEHD-HIFRSBDPSA-N	434.518	1.955	50	20	IDGD	
NC(=O)N1CCC[C@@H](C(=O)NNC(=O)[C@@H]2Cc3ccccc3CN2Cc2ccccc2)C1	747787458	QMDZORYZEDGMQU-RTWAWAEBSA-N	435.528	1.552	50	20	IDGD	
C[C@H]1CCCC[C@]12NC(=O)N(CC(=O)NNc1nc(-c3ccccn3)nc3c1CCC3)C2=O	747983139	RGJYDDUDEDNCRV-PSLXWICFSA-N	449.515	1.971	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)N2CCC[C@@H]2C(=O)NNC(=O)CC2CCCC2)o1	749945100	MNEWYBPYDFCZKO-CQSZACIVSA-N	441.506	1.337	50	20	IDGD	
CNS(=O)(=O)C[C@H]1CCCN1C(=O)NNC(=O)c1ccc(COc2ccccc2)o1	750265222	AGJVFNGQMWIUBC-CQSZACIVSA-N	436.490	1.227	50	20	IDGD	
CCOC(=O)C1CCC(=NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)CC1	750913103	VVYWSDBISIPAFA-UHFFFAOYSA-N	437.518	1.547	50	20	IDGD	
Cn1cc(NS(=O)(=O)c2ccsc2C(=O)NNC(=O)c2ccc(C#N)cc2)cn1	751397508	TUUQTDDMBXIPBH-UHFFFAOYSA-N	430.471	1.229	50	20	IDGD	
CS(=O)(=O)c1ccc(N2CCN(C(=O)NNC(=O)C3CCCC3)CC2)c([N+](=O)[O-])c1	753336576	PWCNSWQZNWUHPW-UHFFFAOYSA-N	439.494	1.051	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)Nc1cc(S(=O)(=O)N(C)C)ccc1N(C)C	755532738	PGSIGZXIJNUWDR-UHFFFAOYSA-N	435.506	1.478	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)Nc1cccc(N2CCCS2(=O)=O)c1	755890422	RNIWJQUOXKFXJL-CYBMUJFWSA-N	436.465	1.986	50	20	IDGD	
COc1ccc(C(=O)N2CCOCC2)cc1NC(=O)NNC(=O)CCc1ccccc1O	756255861	DSVXPZXLXRFLFR-UHFFFAOYSA-N	442.472	1.659	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)c1cncc(I)c1	756854434	DNZUTHVTUIUVHW-CYBMUJFWSA-N	425.182	1.287	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2ccc(C)c(C(=O)N(C)C)c2)c2ccccc2c1=O	757590138	RIMXPGRMATXIPU-UHFFFAOYSA-N	436.472	1.893	50	20	IDGD	
COC(=O)c1cc(NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cn1C	757671602	ODFIGXJPWFONTE-UHFFFAOYSA-N	449.489	1.063	50	20	IDGD	
CNC(=O)Cn1nc(NC(=O)NNC(=O)COc2cccc(C(F)(F)F)c2)cc1C	757824048	WTSRVKWQWJTLMA-UHFFFAOYSA-N	428.371	1.188	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1ccc(Oc2ccc(C(F)(F)F)cn2)cc1	758035329	KYUSTUJMLOVZBO-JTQLQIEISA-N	446.407	1.591	50	20	IDGD	
Cc1ccc(CNC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c(O[C@H]2CCOC2)c1	758901188	OUVDHXGDNYLORC-KRWDZBQOSA-N	447.513	1.710	50	20	IDGD	
CN1C(=O)C[C@@H](C(=O)NNC(=O)COc2ccccc2O)[C@H]1c1ccc(Cl)c(F)c1	759009916	CZLUPKPOXWVJOU-CWTRNNRKSA-N	435.839	1.931	50	20	IDGD	
CCNS(=O)(=O)c1ccc(CC(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)cc1	759357343	RTNFZVUFHSKNCJ-UHFFFAOYSA-N	427.486	1.379	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)Nc1cc2ccccc2nc1Br	760168011	LQRFLWVKSFVMEZ-SNVBAGLBSA-N	427.280	1.585	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)[C@H]1CCCN(C(=O)COc2ccccc2)C1	760439757	KORZNUVYIAZIKX-INIZCTEOSA-N	448.520	1.366	50	20	IDGD	
CCOC(=O)c1cc(S(=O)(=O)NNC(=O)[C@@H](C)Oc2ccc(OCC)cc2)cn1C	760511011	WDWVXMUTFDJPQR-CYBMUJFWSA-N	439.490	1.378	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)c1ccc(CN2CCN(C)CC2)cc1	762371423	XDVLRFFUWONQAI-UHFFFAOYSA-N	428.558	1.996	50	20	IDGD	
O=C(CC[S@](=O)c1ccc2c(c1)OCCO2)NNC(=O)c1cc(-c2cccs2)[nH]n1	763159737	YISAZOWFESCVJZ-PMERELPUSA-N	446.510	1.868	50	20	IDGD	
C[C@H]1CCS(=O)(=O)CCN1C(=O)NNC(=O)c1ccc(Br)cc1Cl	763248936	HGQLOWGMCLFWEM-VIFPVBQESA-N	438.731	1.966	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)C(=O)Nc1cccc(CCN2CCCC2)c1	763454302	GUQCKYLAGJDUAC-UHFFFAOYSA-N	425.445	1.633	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)C(=O)Nc1cccc2cnccc12	763532403	ZWCKDMYDTHNPLX-UHFFFAOYSA-N	446.511	1.533	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)Nc1cc(C2CC2)nn1-c1ccccc1	763572096	LSDCUQGKWNLZTI-LJQANCHMSA-N	447.451	1.676	50	20	IDGD	
Cc1ccc(C(=O)N2CCOCC2)cc1NC(=O)C(=O)NNC(=O)c1ccccc1F	763575427	UTZLNIYQNHURDP-UHFFFAOYSA-N	428.420	1.006	50	20	IDGD	
COC(=O)c1c(F)cccc1NC(=O)C(=O)NNC(=O)CN1CCCc2ccccc21	763745608	HAGUFICQGQCTPS-UHFFFAOYSA-N	428.420	1.151	50	20	IDGD	
CCn1cnnc1-c1ccccc1NC(=O)C(=O)NNC(=O)COc1ccccc1C#N	763807147	LLBARYSQOASUBG-UHFFFAOYSA-N	433.428	1.002	50	20	IDGD	
CC[C@@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C)cc2)cc1	763811196	GTOMFPNQTVLCAL-OAHLLOKOSA-N	426.473	1.688	50	20	IDGD	
Cc1ccccc1-n1nccc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccccc1F	763864875	LSUCRKKWFIEJBH-AWEZNQCLSA-N	425.420	1.873	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccc(-n3cnc4ccccc43)nc2)n1	763886143	RIZXPWHWXPYFMJ-UHFFFAOYSA-N	432.444	1.020	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc([S@](C)=O)c2)cc1OC	763911027	AVWHGZGHOQCOCI-PMERELPUSA-N	433.486	1.621	50	20	IDGD	
Cc1ccc(Cn2nccc2NC(=O)C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)o1	763948432	JXBGBBIHKWIJFJ-UHFFFAOYSA-N	449.427	1.124	50	20	IDGD	
CC[C@@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(S(=O)(=O)N2C[C@@H](C)C[C@@H](C)C2)cc1	764084771	WGHFSCQSFUNIDP-QLFBSQMISA-N	438.550	1.485	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)CN(C(=O)OC(C)(C)C)CC3)n[nH]1	764110132	ZVHMNXJKXXJRIY-UHFFFAOYSA-N	442.476	1.411	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cccc3cccnc23)cc1S(C)(=O)=O	764147486	AQDKVHLRDGLWDM-UHFFFAOYSA-N	426.454	1.346	50	20	IDGD	
O=C(CCOc1ccccc1)NNC(=O)C(=O)Nc1ccc(-c2n[nH]c(C3CC3)n2)cc1	764166176	GMCAQWJSPUYGNA-UHFFFAOYSA-N	434.456	1.904	50	20	IDGD	
Cc1cc(C)n(-c2ccc(NC(=O)C(=O)NNC(=O)c3cccc4ncccc34)cn2)n1	764252283	DKTHOTUAVDNJJZ-UHFFFAOYSA-N	429.440	1.832	50	20	IDGD	
CN(C)CCCOc1ccc(NC(=O)C(=O)NNC(=O)c2cccc3ncccc23)cc1	764258072	ULUBUGCCBXSVBA-UHFFFAOYSA-N	435.484	1.965	50	20	IDGD	
O=C(NNC(=O)c1cccc2ncccc12)C(=O)Nc1cccc(-c2nnnn2C2CC2)c1	764259413	GSFFHDRYNJIFPH-UHFFFAOYSA-N	442.439	1.623	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)Cc3ccccc3F)cn2)C[C@@H](C)O1	764312946	DYEGCZBFESWIHV-OKILXGFUSA-N	429.452	1.163	50	20	IDGD	
Cc1ccc(I)cc1C(=O)NNC(=O)CCN1C[C@H](C)O[C@@H](C)C1	764321675	YMFDPBWGURSFBR-STQMWFEESA-N	445.301	1.860	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1cnn(Cc2ccccc2)c1	764397410	IRVLLYHXOSSPIA-UHFFFAOYSA-N	439.497	1.818	50	20	IDGD	
Cc1ccccc1-n1nccc1NC(=O)C(=O)NNC(=O)CSc1ccccc1O	764400028	FJWOBHIRLOYZRY-UHFFFAOYSA-N	425.470	1.765	50	20	IDGD	
O=C(NNC(=S)NCc1ccon1)c1ccccc1NS(=O)(=O)c1cccs1	764437120	CTURJQIPAXWTCM-UHFFFAOYSA-N	437.528	1.846	50	20	IDGD	
COc1cc2c(cc1OC)CN(C(=O)CCC(=O)NNC(=O)Cn1nc(C)cc1C)CC2	764565759	GIYHUICJOZMXEU-UHFFFAOYSA-N	443.504	1.030	50	20	IDGD	
CC(=NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1)c1ccc2c(c1)CCC(=O)N2	764829937	IVGWLSJHUHBPEO-UHFFFAOYSA-N	433.512	1.870	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1ccc(C#N)cc1)C(=O)NNC(=O)c1cccc(OC(F)F)c1	765406000	KTNSPPXVUUTZEZ-LLVKDONJSA-N	438.412	1.288	50	20	IDGD	
CC(C)c1ncc(Cl)c(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)n1	766641616	IFACAPWVAJAUBN-UHFFFAOYSA-N	444.923	1.472	50	20	IDGD	
Cc1cc(C)cc(N2CC[C@H](C(=O)OCC(=O)NNC(=O)Cc3ccccc3C)C2=O)c1	767304750	CIKICOIDZPWRPZ-FQEVSTJZSA-N	437.496	1.898	50	20	IDGD	
O=C(NNC(=O)c1cccc(Br)c1)NC1CCN([C@@H]2CCC[C@@H]2O)CC1	767958915	LCLRFDXWBRKJFK-CVEARBPZSA-N	425.327	1.771	50	20	IDGD	
C[C@@H](C(=O)NNc1ccccc1S(=O)(=O)NC(C)(C)C)S(=O)(=O)C1CCOCC1	768064746	QRROVJVPESEIAQ-ZDUSSCGKSA-N	447.579	1.189	50	20	IDGD	
O=C(NNC(=S)Nc1ccccn1)c1cccc(S(=O)(=O)NC[C@@H]2CCCO2)c1	768578086	NILMCEZORXXDHL-AWEZNQCLSA-N	435.531	1.170	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNc3cc(C#N)cc(Cl)n3)CC2)cc1	768711866	YVCSLRMTVFEEEE-UHFFFAOYSA-N	448.936	1.365	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)NC2CCN([C@H]3CCC[C@@H]3O)CC2)cc1	769155282	MUYDAHNGJLZGRE-XPGWFJOJSA-N	434.537	1.561	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)NC3CCN([C@@H]4CCC[C@H]4O)CC3)nc21	770413666	USTIMTUBKMKNTP-HUUCEWRRSA-N	432.529	1.291	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1ccc(-c2nc[nH]n2)cc1	770575884	BJQLCGDDJLDWBK-UHFFFAOYSA-N	429.820	1.752	50	20	IDGD	
CCC(CC)n1ccc(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)n1	771011616	HWFWDDOXPKQMHL-UHFFFAOYSA-N	434.566	1.937	50	20	IDGD	
CCC1(CC)[C@@H](OC)[C@H](C)[C@H]1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	771433672	IOEQXFASSMNANS-XYPHTWIQSA-N	440.566	1.721	50	20	IDGD	
O=C(NNc1ccccc1[N+](=O)[O-])C(=O)Nc1ccc(CC(=O)N2CCOCC2)cc1	773648907	WQWUYJVVIZBDMG-UHFFFAOYSA-N	427.417	1.078	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)N(C)CCO2	774010234	WRWADHPWJAEWJB-GFCCVEGCSA-N	432.864	1.722	50	20	IDGD	
O=C(COC(=O)c1ccc(C(F)(F)F)cc1O)NNC(=O)[C@@H]1COc2ccccc2O1	776400553	WTKXRZADDAWUAM-HNNXBMFYSA-N	440.330	1.555	50	20	IDGD	
COc1ccc2cc(C(=O)N3CCN(S(=O)(=O)CBr)CC3)c(C)nc2c1	777779421	KEHNNJBRWHJBQM-UHFFFAOYSA-N	442.335	1.992	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)[C@@H](NC(=O)c1ccccc1)c1ccccc1	778442594	XSKGNSCMYWUTFA-SFHVURJKSA-N	426.473	1.830	50	20	IDGD	
C[C@@H](C1CC1)n1cc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)cn1	778714067	OYZPASFKSXSNOD-NSHDSACASA-N	425.424	1.783	50	20	IDGD	
O=C(COCC(=O)NNc1ccc([N+](=O)[O-])cc1Br)NCc1cccnc1	779143070	PPIHQAWAHQRIQN-UHFFFAOYSA-N	438.238	1.528	50	20	IDGD	
COc1ccc(Cn2ccc(NC(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)n2)cc1	779509363	MGWAVBKIKNJWGI-UHFFFAOYSA-N	447.455	1.653	50	20	IDGD	
COCc1noc(CN2CCN(C(=O)NNC(=O)c3c(Cl)cccc3Cl)CC2)n1	780977821	SADNVTBISXVZNC-UHFFFAOYSA-N	443.291	1.695	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)cc1)C(=O)Nc1ccc2nc(N3CCOCC3)sc2c1	782833206	YQQUMYLIXFPSSO-UHFFFAOYSA-N	441.469	1.238	50	20	IDGD	
CC(C)Cn1ncc(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)c1C(F)F	782887066	NZWMQHLTGPLSGX-UHFFFAOYSA-N	447.446	1.692	50	20	IDGD	
COCCCS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ncnc3ccsc23)cc1	783252706	BFOKXPFFDFVFTM-UHFFFAOYSA-N	449.514	1.583	50	20	IDGD	
Cn1ncc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)NC(C)(C)C)c1C(F)F	784833206	LOULNZKNKJTAGQ-UHFFFAOYSA-N	444.464	1.516	50	20	IDGD	
COCc1ccccc1NC(=O)C(=O)NNc1ccccc1S(=O)(=O)NC(C)(C)C	784833607	OXBXIGWPJMRYHZ-UHFFFAOYSA-N	434.518	1.992	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CCCCCCC2)cn1)C(=O)Nc1cncnc1	784935191	WQSJOTBKEUQURW-UHFFFAOYSA-N	447.521	1.345	50	20	IDGD	
CC(=O)Nc1ccc(NC(=O)C(=O)NNc2ccnc(N(C)C)n2)c(C(F)(F)F)c1	784970473	HTXKUWUGYHAJMD-UHFFFAOYSA-N	425.371	1.602	50	20	IDGD	
Cn1c(=O)oc2cc(NC(=O)C(=O)NNc3c(F)cc(C(=O)NC4CC4)cc3F)ccc21	785100236	UIRFPMCMKAQZOF-UHFFFAOYSA-N	445.382	1.384	50	20	IDGD	
Cc1cc2ccc(Cl)cc2nc1NNC(=O)C(=O)Nc1cccc(S(N)(=O)=O)c1	785161518	SKAFBABRYUDWMD-UHFFFAOYSA-N	433.877	1.926	50	20	IDGD	
Cc1ccc(NC(=O)[C@H](C)OC(=O)/C(C#N)=C/C2CC2)cc1S(=O)(=O)N1CCOCC1	786679242	YADUCDRNGFAXMF-VUVCFOEZSA-N	447.513	1.746	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)[C@@H]1CCCN(S(=O)(=O)c2ccccc2)C1	788175219	QXPBEVDWQIKARJ-OAHLLOKOSA-N	427.490	1.206	50	20	IDGD	
NS(=O)(=O)c1ccccc1NNC(=O)c1ccc(S(=O)(=O)Nc2ccccc2)cc1	788228441	KHCYUXGPPOADIB-UHFFFAOYSA-N	446.510	1.892	50	20	IDGD	
COc1nn(C)cc1NC(=O)C(=O)NNC(=O)COc1ccccc1Cc1ccccc1	789587414	XPVLEORAUKMHNN-UHFFFAOYSA-N	437.456	1.184	50	20	IDGD	
COc1ccc(CC(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)nc1	789989357	BKHSRXBFPJMJIE-UHFFFAOYSA-N	431.924	1.251	50	20	IDGD	
CCN1CCN(c2ccc(Cl)cc2NC(=O)C(=O)NNc2nc3ccccn3n2)CC1	792393880	IYIMZUKAAIQGFW-UHFFFAOYSA-N	442.911	1.606	50	20	IDGD	
Cc1nc2c(cnn2C(C)C)cc1C(=O)NNC(=O)c1csc(N2CCOCC2)n1	793075524	WWXYECJPMRNDDN-UHFFFAOYSA-N	429.506	1.689	50	20	IDGD	
Cc1ncc(S(=O)(=O)NNC(=O)c2nc(Cl)c(Cl)c(N)c2Cl)cc1C#N	793351358	WQZBEMUFXWZGMS-UHFFFAOYSA-N	435.680	1.822	50	20	IDGD	
CCOC(=O)c1cc(S(=O)(=O)NNC(=O)c2ccc(OC)c(OC)c2)c(F)cc1C	795281156	RCYJUVLXUUSLQR-UHFFFAOYSA-N	440.449	1.951	50	20	IDGD	
O=C(NNc1nc2ccccc2s1)C(=O)Nc1cc(S(=O)(=O)N2CCCC2)ccn1	797028959	WZLPDXMXYXVFIQ-UHFFFAOYSA-N	446.514	1.558	50	20	IDGD	
Cc1ccc([C@@H](NCC(=O)NNC(=O)c2cccc(C#N)c2)[C@@H](C)S(C)(=O)=O)cc1	797997553	NAPKIRFEPSBBTG-QRWLVFNGSA-N	428.514	1.392	50	20	IDGD	
Cc1cn(-c2ccc(Cl)cc2)nc1NC(=O)C(=O)NNC(=O)[C@H]1Cc2ccccc2O1	799258760	IBEREYVDFPBDPK-QGZVFWFLSA-N	439.859	1.924	50	20	IDGD	
CN1CCN(CCNC(=O)NNC(=O)c2ccc(COc3ccccc3)o2)CC1(C)C	799353801	UHXUQXBIZBDGCO-UHFFFAOYSA-N	429.521	1.829	50	20	IDGD	
O=C(CCN1C(=O)NC2(CCCC2)C1=O)NNC(=O)Nc1ccc(Br)cc1	801998232	VJDDGKQSZZGXDW-UHFFFAOYSA-N	438.282	1.857	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H]1C(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	802067684	KABIPEXKVBMGBM-LSDHHAIUSA-N	440.522	1.936	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)NCCNS(=O)(=O)c1cccc(Cl)c1Cl	807453941	INQIFIXTYMIMKT-UHFFFAOYSA-N	446.316	1.240	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2OC)cc2[nH]ccc12	808934536	JYPSAZSWKIGONO-UHFFFAOYSA-N	440.412	1.128	50	20	IDGD	
CC(C)c1nc(C#N)c(NNC(=O)CNS(=O)(=O)c2ccc(Br)cc2)o1	810261560	DOUNAYYHZFPWLW-UHFFFAOYSA-N	442.295	1.854	50	20	IDGD	
CCc1nc2ccc(Cl)cn2c1C(=O)OCC(=O)NNC(=O)Cc1nc(C)cs1	812648752	MOMSBWYYFFZLEX-UHFFFAOYSA-N	435.893	1.862	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2ccc(OC(F)F)c(F)c2)cc1	814723368	CTTYHCWGIZHNLW-UHFFFAOYSA-N	445.419	1.817	50	20	IDGD	
COc1ccc(C(=O)Nc2nc(CC(C)=NNC(=O)Cc3cc[nH]n3)ns2)cc1OC	814956351	STSSQOYZMRWIOI-UHFFFAOYSA-N	443.489	1.808	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)cc1)C1CC1	815569847	JWBHFCIMSGMTLE-UHFFFAOYSA-N	446.410	1.960	50	20	IDGD	
O=C(CCn1cnc2sc3c(c2c1=O)CCCC3)NNC(=O)CNc1ccccc1	823328422	RGEGDYYRDSIBGX-UHFFFAOYSA-N	425.514	1.986	50	20	IDGD	
COc1ccc([C@@H](CNC(=O)NNC(=O)Cc2ccc(F)cc2)N2CCOCC2)cc1	838512847	AHLXLRRMXZVLEN-HXUWFJFHSA-N	430.480	1.781	50	20	IDGD	
COCCN1C[C@H](C(=O)NNC(=O)c2ccccc2OCc2ccc(F)cc2)CC1=O	914458412	SAKRKMKJACFORE-MRXNPFEDSA-N	429.448	1.661	50	20	IDGD	
Cc1nnc(NNC(=O)c2cccc(S(=O)(=O)N3CCc4sccc4C3)c2)nc1O	914832336	VMUGREWQBZQASX-UHFFFAOYSA-N	446.514	1.451	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)CCCc2nc(-c3cccs3)no2)c1	915293685	FUSMEOMIYMWRHY-UHFFFAOYSA-N	434.499	1.986	50	20	IDGD	
C[C@H]1C[C@@H]1C(=O)Nc1cccc(C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c1	915408135	KRJKBFRHZFBUCO-SJCJKPOMSA-N	440.412	1.807	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)NCc2ccccc2CN2CCOCC2)c1	915927694	SMGYORGSTFYENZ-UHFFFAOYSA-N	428.489	1.680	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2[nH]c(-c3ccccc3)nc2C)cc1	916112394	DHCUFWWRYKRNAL-UHFFFAOYSA-N	441.513	1.775	50	20	IDGD	
COc1cc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)ccn1	916256017	ZFADEZFJVKXIDU-UHFFFAOYSA-N	447.517	1.409	50	20	IDGD	
CCn1nc(C(=O)NN=C(C)c2ccc(S(=O)(=O)NC)cc2)c2ccccc2c1=O	916315588	WUOJEOCHVYSLDT-UHFFFAOYSA-N	427.486	1.479	50	20	IDGD	
O=C(NC[C@H](c1ccccc1)N1CCOCC1)NNC(=O)c1ccc2c(c1)OCCO2	916508968	HDUBULFACIGJFW-GOSISDBHSA-N	426.473	1.475	50	20	IDGD	
CC(=NNC(=O)CNc1ccccc1)c1ccc(S(=O)(=O)NCCCN(C)C)cc1	917534276	ROAKPNJZLCDHEC-UHFFFAOYSA-N	431.562	1.869	50	20	IDGD	
CCOC(=O)c1c(S(=O)(=O)NNC(=O)c2ccc(Br)s2)n[nH]c1C	917727942	UFCWPAPMWBNYQC-UHFFFAOYSA-N	437.297	1.342	50	20	IDGD	
CC[C@H](C)NC(=O)CCNC(=O)NNC(=O)[C@@H](C)Oc1cccc(Br)c1	918085417	VEIAYOUSLBDJLD-NWDGAFQWSA-N	429.315	1.852	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2cccc(CN3CCOCC3)c2)c1	918226864	CHEGDDTYOWSWLZ-UHFFFAOYSA-N	446.529	1.067	50	20	IDGD	
O=C(NCCN1C(=O)c2ccccc2C1=O)NNC(=O)c1ccc(F)cc1Br	919786304	SADSDOLSCPMLLR-UHFFFAOYSA-N	449.236	1.828	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)NC[C@H](c1cccc(F)c1)N1CCOCC1	921247609	ISKFSLVPKZCTGL-GOSISDBHSA-N	434.443	1.748	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc2nc(O)cc(C(=O)NNC(=S)NC(C)C)c2c1	1115826865	GSGHQEDOWSYBBA-UHFFFAOYSA-N	439.563	1.488	50	20	IDGD	
Cc1nnnn1[C@H](Cc1cccc(F)c1)C(=O)NNC(=O)c1cncn1-c1ccccc1	1115852726	JWEYVLFLJLTTBW-GOSISDBHSA-N	434.435	1.551	50	20	IDGD	
CNS(=O)(=O)c1ccc(Br)c(C(=O)NNc2nc(C)cc(OC)n2)c1	1116187642	REPFOXFCDQZVOV-UHFFFAOYSA-N	430.284	1.221	50	20	IDGD	
COC[C@@H](C)n1c(C)cc(/C=C(\C#N)C(=O)OCC(=O)N2CCC(C(N)=O)CC2)c1C	1317690034	VELPVUGAELHHIH-GDXCHIGESA-N	430.505	1.486	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)Cn1nc2n(c1=O)CCCCC2	1317786206	AMFLNWXFIUAYBH-UHFFFAOYSA-N	426.502	1.664	50	20	IDGD	
CN1C(=O)C[C@H](C(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)c2ccccc21	1318546844	OBACZHPLYFEJIT-INIZCTEOSA-N	445.520	1.867	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnc4ncccn34)C2)C1	1777930969	BHZAKHYCQWPETG-ROUUACIJSA-N	426.304	1.409	50	20	IDGD	
O=C1Nc2ccccc2/C1=C/C(=O)N1CC[C@@]2(C1)CN(C(=O)CCBr)CCO2	1778901121	KXSZSBFNWKFKIO-UMDONVSZSA-N	448.317	1.637	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)o1	1779027350	OBDLXIDMDHXGQO-ZWKOTPCHSA-N	432.304	1.918	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc[n+]([O-])cc2)C1	1779939850	OLAWZGCCLUDGOJ-IDHHARJASA-N	440.338	1.479	50	20	IDGD	
COc1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)CO[Si](C)(C)C)C3)nn1C	1780246176	YOVLKWMXFLKWKV-OXQOHEQNSA-N	438.601	1.408	50	20	IDGD	
COc1cccc(CC(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)n1	1781326373	OCTWCFMQUXFTJF-NVXWUHKLSA-N	430.274	1.153	50	20	IDGD	
CC1(C)CCC(CC(=O)N2CC[C@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)CC1	1781403863	ICAFJZXNDFQTNG-DEOSSOPVSA-N	442.365	1.416	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(Cl)Cl)C2)[C@H](O)Cc1ccccc1	1781895741	GRAHMSOIJJOOPY-JXXFODFXSA-N	429.344	1.908	50	20	IDGD	
Cc1nn(C)c(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](C)Br)C2)c1F	1781996221	FBSZECJPOJYTNO-WHWRDJHUSA-N	445.333	1.779	50	20	IDGD	
O=C(c1cc2ccoc2cn1)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1782191169	RSIAXXSOSHSFIG-WMLDXEAASA-N	426.242	1.962	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CSCC(=O)O)C1	1782225522	MOOLFFRVSJHYEC-XHBSWPGZSA-N	437.356	1.102	50	20	IDGD	
CCC[C@H]1CC[C@H](C(=O)N2CC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)CC1	1783362489	QVPAFYZJCDBDEI-KHCICDEESA-N	442.365	1.416	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccc4cccnc4n3)CCO2)C1	1783534281	SBTJTALFEHZFCP-ORAYPTAESA-N	433.306	1.857	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cc(-c4ccncc4)[nH]n3)CCO2)C1	1783539183	YOWQKEYJIHDJKF-ORAYPTAESA-N	448.321	1.699	50	20	IDGD	
CC(C)[C@H](C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2)c1ccc(F)cc1	1783732383	XDKXMQLHWWIPIA-WFXMLNOXSA-N	426.916	1.995	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H]1CC[C@H](C(=O)OC)CC1)CCO2	1783870892	JDIQLQUKPIVJOY-ULMVMLMRSA-N	430.929	1.050	50	20	IDGD	
COc1nccnc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]2C1	1783970329	WMEGPQAEAIJJBB-XUXIUFHCSA-N	441.326	1.110	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@]3(F)CCCCC3(F)F)C[C@@H]21)[C@H](O)CCl	1784093478	WCQHPOFUAVFQKQ-LHLGERLTSA-N	426.863	1.483	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CC[C@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)cc1	1785106393	YBZWLMDBGNVBOY-NRFANRHFSA-N	433.581	1.940	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3c(C)noc3C)[C@H]2C1	1785361542	MCVZIHIDFAGQMR-OWLYRPNTSA-N	427.929	1.458	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4nonc4c3)C[C@@H]21	1786406809	GUJXFIVWDONWIP-XEZPLFJOSA-N	437.294	1.601	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)c1cnc2cc(Cl)ccn12	1787239299	RXSYLHKYDPUNMC-YUDUHTQSSA-N	441.315	1.181	50	20	IDGD	
C[C@H](Nc1cnccn1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21	1788626207	MASXMYHOFVHUTJ-AJNGGQMLSA-N	440.342	1.042	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)c1ccc(Cl)nn1	1788836815	OGGMNTGFCIBHHY-LKAMGYQZSA-N	435.681	1.414	50	20	IDGD	
CCCC(=O)N[C@@H](C)C(=O)Nc1ccc(C2(NC(=O)CCC(=O)NN(C)C)CCC2)cc1	1789632407	GGPOCTYUSUUUOZ-INIZCTEOSA-N	445.564	1.798	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)NC(=O)OC(C)(C)C)C[C@@H]21	1789859085	AOANLWJWVWXQOO-QXKUPLGCSA-N	431.961	1.897	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4c[nH]nc4c3)C[C@@H]21)[C@@H](F)Br	1789922272	CMDSEGIEUUWJRV-DARAHFNDSA-N	439.285	1.847	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccn4nccc4c3)C[C@@H]21)[C@H](F)Br	1789925272	CWRIFUBXRWAPJV-TUUVXOQKSA-N	439.285	1.618	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ncccn3)C[C@@H]21	1790961533	PAKVTDZNXBVYTP-XQLPTFJDSA-N	425.327	1.172	50	20	IDGD	
O=C(NCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]2C1)c1cccs1	1791294139	KWNQPHRGVGIJPK-SRVKXCTJSA-N	434.345	1.261	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC1(c2ccc(NC(=O)C(=O)c3cccn3C)cc2)CCC1	1791924127	CWNOOXRNDDKAIY-UHFFFAOYSA-N	439.516	1.715	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CC(c2ccccc2)=NO1	1793281250	OWLMZHDTNVCCOK-NZKYLMMGSA-N	435.908	1.023	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CC(=O)N(C3CCCC3)C1)C2	1793445873	UESJERRCRBBWAL-IMDBMMJGSA-N	439.984	1.775	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnn3c(C)cc(C)nc13)C2	1793449941	UTXYSMORXIRZJV-CYGHRXIMSA-N	433.940	1.957	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1coc(Cl)n1	1794706366	OWVFMWFBAWNREE-PNEZKNQNSA-N	432.868	1.714	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1cc(-c2ccco2)no1	1796126251	DFYAXCUHVXPZGL-ANGCBRKESA-N	442.241	1.828	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)[C@@H]1C[C@H]1c1ccc(F)cc1	1796187920	LVACUJWDKSFNBC-LILSUDLASA-N	436.292	1.561	50	20	IDGD	
COc1ccc(Cl)c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)c1	1796192379	FOONRIJGEOZYIQ-BJWYYQGGSA-N	442.708	1.594	50	20	IDGD	
CN1CCc2cc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)CO[Si](C)(C)C)ccc21	1797955783	BSSJBIXPBTVQIC-RMFSNUHRSA-N	431.609	1.734	50	20	IDGD	
Cn1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)c2cccnc21	1798440528	OUMSKUDUBLCFMD-QDMKHBRRSA-N	447.499	1.137	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c[nH]c3nccc-3c1)C2)[C@@H](F)Br	1799346217	KCCSYINIHKFZDB-XJFOESAGSA-N	425.258	1.408	50	20	IDGD	
CC(=O)Nc1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](F)Br)ccn1	1800159634	LIFLGBXJJJGMPQ-QVHKTLOISA-N	427.274	1.982	50	20	IDGD	
N#CCCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](Br)Cc1ccccc1	1800436389	XAVUMRJQBNIPQA-SFNKJDCFSA-N	434.334	1.886	50	20	IDGD	
Cc1cc(C)n(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)Br)n1	1800763132	POSYWHGDZAXJDI-MPTYRVRUSA-N	427.343	1.263	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c[nH]c3ccc(OC)nc13)C2	1800979178	WCMKMZMLKYCZSV-DMVWFOPNSA-N	436.896	1.029	50	20	IDGD	
O=C(Cn1nccn1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](Br)Cc1ccccc1	1801570747	VNBPJNZNFAZZIA-MHORFTMASA-N	446.349	1.923	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1CCN(C(=O)OCC)CC1	1801987452	CETDMPYGANSUPQ-XMTFNYHQSA-N	443.972	1.852	50	20	IDGD	
CC(C)(C)OC(=O)NCC(C)(C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2	1802243338	LIFMIAHAWSNBLZ-XJFOESAGSA-N	435.924	1.661	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H]1CCc3ccccc3[C@H]1O)C2	1802334451	LETSYBJHSUOVFK-JDHLRREYSA-N	442.560	1.294	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2noc3c2CCCC3)[C@H]1c1cccnc1)[C@@H](O)CCl	1803139782	VUWPMUMAOWDVBM-QOKNQOGYSA-N	432.908	1.868	50	20	IDGD	
CC(C)c1nc(C(=O)N2CCCC3(CCN(C(=O)c4ccc(B(O)O)cc4)CC3)C2)co1	1807411290	XIMRCOHIFBLZBC-UHFFFAOYSA-N	439.321	1.636	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)[C@H](C)Br)[C@H]1c1cccnc1	1808435846	ZQFSUPHKJGASFK-RMHZUWNSSA-N	439.354	1.738	50	20	IDGD	
COCc1oncc1C(=O)NC[C@@H]1CCN(C(=O)[C@H](Cl)COC)[C@H]1c1cccnc1	1808824241	XHIWECGIZOOLNK-LESCRADOSA-N	436.896	1.789	50	20	IDGD	
Cc1ccc(C(=O)N2CCC3(CCCN(C(=O)c4cccc(B(O)O)c4)C3)CC2)c(O)c1	1809977822	KHIOFWOAIFWQMJ-UHFFFAOYSA-N	436.317	1.539	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@H]1CCN(C(=O)c2ccc(O)nn2)[C@@H]1c1cccnc1	1810540997	RJFWKIVAFTYITN-DNVCBOLYSA-N	429.553	1.748	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)CSC(=N)N)[C@@H]1c1cccnc1	1812865700	ZFEHSWDUJXUZOI-ZKYQVNSYSA-N	428.356	1.497	50	20	IDGD	
Cc1occc1C(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1813069854	CXFLSBCZFZMLGE-UWJYYQICSA-N	427.505	1.676	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(C3CC3)on2)n[nH]1	1814628627	LLYZNTOVXVFCBA-INIZCTEOSA-N	443.508	1.954	50	20	IDGD	
COC(=O)NCC(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](C)CBr)n[nH]1	1814783961	YKTRBNDNMPZGSA-JQWIXIFHSA-N	430.303	1.789	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@H]2CC(c3ccccc3)=NN2)[nH]n1)[C@@H](O)CCl	1814875150	QAZRRGXZDVCGQA-SQNIBIBYSA-N	444.923	1.768	50	20	IDGD	
C[C@@H]1CC[C@H](C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)[nH]n2)O1	1818873851	QHUYKPHWTPCXDT-OAUYIBNBSA-N	441.492	1.282	50	20	IDGD	
CC(=O)OC[C@@H](OC(C)=O)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)C(Cl)Cl)[nH]n1	1819432303	GCEJZPVCLBDKIO-QWHCGFSZSA-N	449.291	1.700	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)CCl)CC2)c1nn[nH]c1C(F)(F)F	1821639615	UOGWQGFTRAVVCM-VDTYLAMSSA-N	438.819	1.106	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H]2CCCS2(=O)=O)n[nH]1	1821835700	JUDLVENDQQJUDM-FPMFFAJLSA-N	432.930	1.233	50	20	IDGD	
Cc1ncc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)cn1	1822413251	QHZQRMLFOKEHBK-INIZCTEOSA-N	428.497	1.187	50	20	IDGD	
N#Cc1ccccc1OCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1	1823385503	INEAGJQJOJZYIZ-JKSUJKDBSA-N	431.880	1.952	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CS(C)(=O)=O)CC1	1824093026	KCFQENFJDCSUAT-ZFWWWQNUSA-N	437.400	1.682	50	20	IDGD	
C=CCSCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1	1824957660	QRKHDTVUHPCZTL-HXUWFJFHSA-N	430.379	1.519	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2cccnc2)CC1	1825280332	SVRLWGDCSWEIGC-ZUTVHTERSA-N	447.344	1.708	50	20	IDGD	
C[C@@H](NC(=O)OC(C)(C)C)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](O)CCl)CC2	1825810366	QAFXXFZWXGGBBG-JFGNBEQYSA-N	446.957	1.568	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H]1CCCS1)CC2	1826092076	KTVFRLNYTFAFIS-AAEUAGOBSA-N	425.580	1.324	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CS(C)(=O)=O)CC1	1830317736	SOWRWGQRLPKLSC-YOEHRIQHSA-N	427.394	1.887	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)Nc3cccnc3)C2)C1	1831645716	FKILWHJSUATZRS-PLMTUMEDSA-N	438.956	1.746	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)cn1	1831951248	JLOCJDORDXKZHI-HXUWFJFHSA-N	437.569	1.012	50	20	IDGD	
COC1(CC(=O)N2CCCC[C@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)CCC1	1832498961	DBJDNCKMYZZXFH-IBGZPJMESA-N	436.597	1.938	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)/C=C/c3cccs3)CC2)CC1)[C@@H](O)CCl	1833310874	WZJURDOPRYUGOM-WHLIDYPQSA-N	425.982	1.933	50	20	IDGD	
Cc1nc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)ccc1F	1833465508	DHJYMSHNDMPOJW-PBHICJAKSA-N	448.264	1.290	50	20	IDGD	
O=C(CCBr)NC1CCN(C2CCN(C(=O)c3ccc(O)nn3)CC2)CC1	1834421197	POFUMOMUFCPVJW-UHFFFAOYSA-N	440.342	1.152	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)C(C)(C)NCCC#N)CC2)CC1	1834717036	JRRHKUSRRVGCTB-GOSISDBHSA-N	442.004	1.094	50	20	IDGD	
O=C(c1n[nH]c2ccccc12)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836717298	SREDWZTUFJKZQY-GOSISDBHSA-N	434.924	1.775	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccn(C(F)F)n3)CCO2)C1	1838034301	XCRSCPOIIQGORI-FZKQIMNGSA-N	434.871	1.756	50	20	IDGD	
CCC[C@@H](NC(C)=O)C(=O)N1CCC(OC2CCN(C(=O)[C@H](Cl)COC)CC2)CC1	1838785945	LGKVHVBIHOOIGN-RTBURBONSA-N	445.988	1.544	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@H](Cl)COC)CC2)CC1	1838787629	ZOISDBJXPUPBIQ-HZPDHXFCSA-N	425.353	1.493	50	20	IDGD	
Cc1ccn(C)c1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1	1838821167	ARWUPFCCULDVLF-OALUTQOASA-N	432.348	1.640	50	20	IDGD	
O=C(c1cccc(F)c1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1838911279	JXBGJNMCBQGRIF-WMLDXEAASA-N	433.249	1.586	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(F)cc3)CCO2)C1	1838956377	HFNAEOZQFKKLML-UGSOOPFHSA-N	429.286	1.679	50	20	IDGD	
O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(F)c1F)CCO2	1838997963	VQBMMMMNILKQNF-GOSISDBHSA-N	447.276	1.820	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccnc3Cl)C2)C1	1840149265	KETIRYRHCCYNRO-KSSFIOAISA-N	432.304	1.059	50	20	IDGD	
CC(=O)N[C@H](Cc1cccc(F)c1)C(=O)N1CC2(CCCN2C(=O)CO[Si](C)(C)C)C1	1844379870	UYUSJZGUENZDQZ-LJQANCHMSA-N	449.599	1.928	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@H](C)NC(=O)c2ccc(F)cc2)C1	1845004552	RKZUSIMKIOARKI-CZUORRHYSA-N	425.888	1.401	50	20	IDGD	
CN(CC(=O)N1CCCC12CN(C(=O)[C@@H]1CCC=CO1)C2)NC(=O)NCc1ccccc1	1845038884	CYRXUDJESYQXKA-IBGZPJMESA-N	441.532	1.229	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@H](C)NC(=O)c1ccc(F)cc1)C2	1846363373	FNKKHWHLWCPTIJ-CZUORRHYSA-N	425.888	1.401	50	20	IDGD	
O=C(CCc1cnc2ccccc2c1)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cccc(B(O)O)c1	1847464755	PZFLXBPFFGUBJE-GOTSBHOMSA-N	443.312	1.363	50	20	IDGD	
O=C(c1cn2cc(Br)ccc2n1)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl	1847564136	UGYBSAFNPZNXJL-IHRRRGAJSA-N	441.713	1.512	50	20	IDGD	
COC(=O)c1cc(C(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)cc([N+](=O)[O-])c1	3530159	ZWWTXQXXPCBHQU-UHFFFAOYSA-N	435.776	1.653	50	20	IDGD	
O=C(C[C@@H](C(=O)O)c1ccccc1)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	13254464	QXJGEWIJUMJXTB-GOSISDBHSA-N	445.497	1.491	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cccc(N3CCCS3(=O)=O)c2)cc(OC)c1OC	14289111	KOQQBMDIWWERCT-UHFFFAOYSA-N	449.485	1.327	50	20	IDGD	
C[C@@H]1Oc2ccccc2O[C@@H]1C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	14330731	GEDHXECJKZFIDM-LIRRHRJNSA-N	445.497	1.461	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)c2ccccc2c1=O	105001983	UWKIHPVXCJWXSC-UHFFFAOYSA-N	431.493	1.872	50	20	IDGD	
Cc1ccc(CC(=O)N2CCN(CC(=O)NNC(=O)c3ccccc3Cl)CC2)cc1	110305875	DVVPYLJSJOKDFK-UHFFFAOYSA-N	428.920	1.796	50	20	IDGD	
COc1ccc(-n2ccc(CNC(=O)NNC(=O)CNC(=O)c3cccs3)n2)cc1	725874404	YBELHIZAORDOLJ-UHFFFAOYSA-N	428.474	1.203	50	20	IDGD	
COc1cccc(S(=O)(=O)NNC(=O)c2ccc(CSc3nncn3C)cc2)c1	727350113	GDOSKAYSTZNDAL-UHFFFAOYSA-N	433.515	1.739	50	20	IDGD	
NS(=O)(=O)c1ccc(Br)c(C(=O)NNc2nc(-c3cccnc3)no2)c1	728077021	RJHQSXDRIFEMNC-UHFFFAOYSA-N	439.251	1.298	50	20	IDGD	
CCCC(=O)N1CSC[C@H]1C(=O)NNC(=O)c1cc(OC)ccc1Br	728527056	ZIQTZGYZJZCATJ-ZDUSSCGKSA-N	430.324	1.920	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2sc(-c3ncccn3)nc2C)n1	728728903	DIVQDQVCIQDKMB-UHFFFAOYSA-N	432.487	1.220	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)NC[C@H]1CCN(CCc2ccccc2)C1	728755070	WCXIARWYJLSZRV-GOSISDBHSA-N	441.488	1.869	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)N2CCN(C(=O)c3ccc(O)nc3)CC2)c1C	729363674	QWQAPGJCGSHRSQ-DEDYPNTBSA-N	437.500	1.744	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)Cc2c(C)nc(-c3ncccn3)nc2O)o1	729527143	BCCXJIHSSMZQFA-UHFFFAOYSA-N	439.476	1.386	50	20	IDGD	
CC(C)(C)OC(=O)N(CCCNC(=O)NNC(=O)C(=O)N1CCCC1)Cc1cccnc1	729620229	RRZUGDLQPWQJCW-UHFFFAOYSA-N	448.524	1.162	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)[C@H](CC(C)C)N2C(=O)[C@H]3CC=CC[C@@H]3C2=O)cn1	729692302	FVOHHNFSMSSWKO-JYJNAYRXSA-N	445.545	1.774	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)NCCn1c(=O)oc2ccccc21	730127957	QOLVJDNIHHNTKP-UHFFFAOYSA-N	449.261	1.766	50	20	IDGD	
Cc1c(C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)nnn1-c1ccc2c(c1)OCCO2	731453546	KNHWSYWPQXRTSN-CYBMUJFWSA-N	441.419	1.715	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2cc(Br)c[nH]2)nnn1-c1ccc2c(c1)OCCO2	731454229	YBBJWUHPWLXUKO-UHFFFAOYSA-N	447.249	1.512	50	20	IDGD	
Cc1cc(CSc2ncccc2C(=O)NNC(=O)CCN2C[C@H](C)O[C@H](C)C2)no1	732260158	BNYDYTGTPPERHW-GASCZTMLSA-N	433.534	1.931	50	20	IDGD	
Cc1ccc(-n2nc(C(=O)NNC(=O)CCN3C[C@H](C)O[C@H](C)C3)c3c2CCC3)cc1	732261423	MUZIGOPBZLCGJU-CALCHBBNSA-N	425.533	1.930	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(F)c(C(=O)NNc2nc3ccccc3c(=O)n2C)c1	733260768	AXFALVYFCLYVGO-UHFFFAOYSA-N	433.465	1.516	50	20	IDGD	
CC(C)CNC(=O)N1CCC[C@@H](CC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)C1	741207193	JYTKJYMOUSQYMM-HNNXBMFYSA-N	442.520	1.162	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)[C@@H]2CN(Cc3ccccc3)CCO2)cc1C	741379929	AXXHJCGSGQRQCI-KRWDZBQOSA-N	445.541	1.824	50	20	IDGD	
O=Cc1ccc(OCC(=O)NNC(=O)c2ccc3c(c2)OCCO3)c(Br)c1	742503037	SXJNXJRCNLVUJF-UHFFFAOYSA-N	435.230	1.873	50	20	IDGD	
Cc1ccc(N2CCC[C@@H](NC(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)C2=O)cc1	743510047	PAPPFYMEDXDJEA-GOSISDBHSA-N	434.460	1.110	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)Cc2csc(N3CCCC3=O)n2)cc1	743829949	HTSJOGCNENTDPN-UHFFFAOYSA-N	437.503	1.069	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)Cn2c(=O)cnc3ccccc32)cc1Cl	743834832	WABWFJJAGFGJSY-UHFFFAOYSA-N	431.836	1.920	50	20	IDGD	
C[C@H](C(=O)NNC(=O)CC12CC3CC(CC(C3)C1)C2)N1C(=O)[C@H]2[C@H](C1=O)[C@H]1CC[C@H]2O1	744352857	QEQCGUBSQYXIKG-OEBZWYTDSA-N	429.517	1.291	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CN2CCC(NC(=O)NC3CCCCC3)CC2)c1	744389959	APLPDCPGNSGBKK-UHFFFAOYSA-N	426.521	1.416	50	20	IDGD	
COc1ccc(S(=O)(=O)C[C@H](C)C(=O)OCC(=O)NNC(=O)c2cccc(C)c2)cc1	745054311	XMLINWAQESFWAF-HNNXBMFYSA-N	448.497	1.418	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2CCC[C@H](C(=O)OC)C2)c1	746093723	SOBZQWUBRFTBIF-ZBFHGGJFSA-N	439.534	1.458	50	20	IDGD	
CCC(=O)N1CC[C@H](C(=O)NNc2nc3ccccc3c(=O)n2CCCOC(C)C)C1	746177087	AUFPXAIKCVVGNT-INIZCTEOSA-N	429.521	1.913	50	20	IDGD	
CC(C)(C)OC(=O)N1CCCC[C@@H]1CNC(=O)NNC(=O)Cc1cn2ccccc2n1	746754638	BNNMJVCRBBFRHS-MRXNPFEDSA-N	430.509	1.997	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)CCOc1ccccc1)c1ccc(S(=O)(=O)N(C)C)cc1	747300304	DSBDNWAHVZIMOF-HNNXBMFYSA-N	434.518	1.797	50	20	IDGD	
CC(C)OCCS(=O)(=O)NCC(=O)NNC(=O)c1cc2c(s1)CCCCCC2	747905646	HVDVNUVLANSRSF-UHFFFAOYSA-N	431.580	1.513	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2F)c1)C(=O)N1CCCC1	748247142	UXOKJOCNMMIMBG-UHFFFAOYSA-N	434.449	1.010	50	20	IDGD	
C[C@@H](C(=O)N(C)CC(=O)NNc1ccccc1S(=O)(=O)NC(C)(C)C)n1cccn1	748594053	OHQDOHHZAJUZDZ-AWEZNQCLSA-N	436.538	1.123	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1cnc(-c2ncccn2)s1	749560185	HNXQLHXJLNINKC-UHFFFAOYSA-N	431.503	1.276	50	20	IDGD	
C[C@]1(c2ccc(C(=O)NNc3ccc(S(=O)(=O)C(F)F)cc3)cc2)NC(=O)NC1=O	751060304	BTKUSHCLGASYLG-GOSISDBHSA-N	438.412	1.494	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)N[C@@H]2C[C@@H](C)N(C3CC3)C2)c2ccccc2c1=O	753944908	OPOSDGFCJDEVGP-HUUCEWRRSA-N	426.521	1.766	50	20	IDGD	
CC(CN1Cc2ccccc2C1=O)=NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	754963971	GIUBSOUFUQKMOC-UHFFFAOYSA-N	433.512	1.593	50	20	IDGD	
CCOCC(=O)NNC(=O)Nc1ccc(S(=O)(=O)N[C@H](C)[C@H]2C[C@H]3CC[C@H]2C3)cc1	755512531	MHGZJWVYBYEVJY-LDDOYCOJSA-N	438.550	1.979	50	20	IDGD	
COC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(NC(=O)NNC(=O)CC3CC3)cc2)C1	755556157	BZLPQGRFIALXLF-AWEZNQCLSA-N	438.506	1.213	50	20	IDGD	
CC(=O)Nc1ccc(NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1C	755633409	ATQDWDAQFNUAKU-UHFFFAOYSA-N	447.517	1.735	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)[nH]n1)Nc1ccc(CC(=O)N2CCOCC2)cc1	755862806	UEIDOCZDIAGDJY-UHFFFAOYSA-N	448.483	1.945	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)Nc2cccc(N3CCCS3(=O)=O)c2)cc1	755887853	DVZLKGPNTYXYPE-UHFFFAOYSA-N	434.474	1.467	50	20	IDGD	
COC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2ccccc2O)c1Br	756165458	UHJGHDOOVVTTDT-UHFFFAOYSA-N	436.218	1.341	50	20	IDGD	
CCN(CC(=O)NC)C(=O)/C(C#N)=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	756994398	PUUYXIPDHCSIDR-GDNBJRDFSA-N	442.907	1.580	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)N[C@@H]2CCN(c3ccccc3OC)C2=O)c1	757288513	ZYOUOIQBBNSVQJ-MRXNPFEDSA-N	428.445	1.462	50	20	IDGD	
NS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2ccc(F)cc2Br)cc1	757674343	RPINQTOJBDDISO-UHFFFAOYSA-N	431.243	1.702	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)c2cccc(I)c2O)cc1	757737326	XINUPSCIYYEXNT-UHFFFAOYSA-N	441.225	1.879	50	20	IDGD	
Cc1c(C(=O)NNC(=O)COc2ccc(C#N)cc2)cnn1CCO[C@H]1CCCCO1	758060186	TZIFPWYPLIXSMX-FQEVSTJZSA-N	427.461	1.446	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)NCCN1CCN(c2ccccc2)CC1	761663164	GLUIGTOHHWIURD-UHFFFAOYSA-N	443.573	1.940	50	20	IDGD	
Cc1sc(Cl)nc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	762836323	BGYYGETZMUWRDM-UHFFFAOYSA-N	444.922	1.201	50	20	IDGD	
O=C(NNc1nccc(N2CCOCC2)n1)[C@H]1CC(=O)N(c2cccc3ccccc23)C1	762854272	XOQXEZZXOGXCTE-KRWDZBQOSA-N	432.484	1.963	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNS(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	763439760	RBLSNEFYIMLNRS-UHFFFAOYSA-N	436.874	1.863	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)NC[C@@H](c1cccs1)N1CCOCC1	763444695	AALHJEUCDNEJDE-AWEZNQCLSA-N	436.559	1.950	50	20	IDGD	
COC(=O)N(C)Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)cc1	763559560	TXMDEAYGNSSURG-UHFFFAOYSA-N	428.401	1.013	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2ccc(CS(C)(=O)=O)cc2)c1	763669070	TYVFXLDVENVZCI-UHFFFAOYSA-N	433.486	1.013	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2F)n([C@@H]2C[C@H]3CC[C@H]2C3)n1	763679872	DWRMVDIXZNRDHO-OFQRWUPVSA-N	429.452	1.857	50	20	IDGD	
CC(C)n1nnnc1-c1ccccc1NC(=O)C(=O)NNC(=O)COc1ccccc1F	763682374	MWYHTYWBLIZIGA-UHFFFAOYSA-N	441.423	1.225	50	20	IDGD	
COC(=O)c1c(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)sc(C)c1C	763685626	DQVJAXHPDVCCOB-UHFFFAOYSA-N	439.877	1.970	50	20	IDGD	
CS(=O)(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)CC23CC4CC(CC(C4)C2)C3)c1	763735802	MGHHUQPCDFJKHK-UHFFFAOYSA-N	447.557	1.924	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(C(C)(C)C)cc2)cc1S(N)(=O)=O	763795055	HFSDNQSCBHNNEF-UHFFFAOYSA-N	432.502	1.340	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)C(=O)N1CC2(CCC2)c2c(F)cccc21	763802850	HTNNDDPXZSZSAX-UHFFFAOYSA-N	442.403	1.729	50	20	IDGD	
CCCc1c(C(=O)NNC(=O)CNC(=O)c2cccnc2)nnn1-c1cccc(C(C)C)c1	763824298	HJUUONXMUSJBRO-UHFFFAOYSA-N	449.515	1.929	50	20	IDGD	
Cc1noc(C)c1COc1ccc(CC(=O)NNC(=O)CNC(=O)c2cccnc2)cc1	763824433	PLLBREJMUMBSCI-UHFFFAOYSA-N	437.456	1.385	50	20	IDGD	
Cc1[nH]c2ccc(Br)cc2c1CC(=O)NNC(=O)CNC(=O)c1cccnc1	763825395	VTFXXFFPNJUGOH-UHFFFAOYSA-N	444.289	1.754	50	20	IDGD	
CCOC(=O)/C=C/c1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)cc1	763837276	DIRBGRXMVJWTEB-LFYBBSHMSA-N	429.404	1.567	50	20	IDGD	
COc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NNC(=O)Cc1c[nH]c2ccccc12	763860286	CWKSQCHEASDWPC-UHFFFAOYSA-N	437.456	1.207	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccccc1SCCC(N)=O	763864577	KVGYBWFWIDHXLI-GFCCVEGCSA-N	448.476	1.347	50	20	IDGD	
CC(=O)N1CCc2cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc3ccccc3F)ccc21	763866567	VZNVKWSNAOAUBZ-LBPRGKRZSA-N	428.420	1.288	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)Nc1cc(Br)c(F)c(C(=O)OC)c1	763894832	IVBFASLHZKFIAJ-MRVPVSSYSA-N	436.234	1.579	50	20	IDGD	
C#CC[C@@]1(C(=O)NNC(=O)[C@H]2COc3ccccc3O2)CCCN1C(=O)OC(C)(C)C	763920796	RIUAYTJGUVPKAB-VGSWGCGISA-N	429.473	1.767	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccc(Cl)cc2)cc1N1CCOC1=O	763943017	YUNHCXAXAZLEKO-UHFFFAOYSA-N	430.848	1.934	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)C(=O)Nc1cccc(N2CCCC2=O)c1	763994787	GLCLEFSVYFFKKQ-UHFFFAOYSA-N	434.250	1.304	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)on2)cc1F	764016734	LXJGZQBPVQZPPO-UHFFFAOYSA-N	442.403	1.906	50	20	IDGD	
C[C@H](c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)nc2)cc1)N1CCOCC1	764102410	ZAILTPWEEMRFBO-CYBMUJFWSA-N	431.880	1.528	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc3c2CN(c2ccccn2)C3)cc1	764183400	XWHDUYHUYMXURN-UHFFFAOYSA-N	426.436	1.873	50	20	IDGD	
CN1CCN(c2ccccc2NC(=O)C(=O)NNC(=O)c2cccc3ncccc23)CC1	764252719	KOUZOIIUBQLWAP-UHFFFAOYSA-N	432.484	1.386	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1ccc(F)cc1OCC(F)(F)F	764274713	BEGYWXQYUXDCCT-UHFFFAOYSA-N	445.325	1.637	50	20	IDGD	
COC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)cc1F	764378030	GZVJVCIFPHSEOA-UHFFFAOYSA-N	440.334	1.762	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2cccs2)[nH]n1)C(=O)Nc1ncn(Cc2ccccc2)n1	764382927	SRJNCPPTMCENQQ-UHFFFAOYSA-N	436.457	1.178	50	20	IDGD	
O=C(NNC(=O)[C@H](O)c1ccccc1Cl)c1cccc(S(=O)(=O)N2CCCC2)c1	764584600	GVMNGFDZRSIMAZ-QGZVFWFLSA-N	437.905	1.619	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ccoc2)cc(Br)c1F	764662125	HJCKTVBCCGQRSM-UHFFFAOYSA-N	428.170	1.368	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)c3cc(S(=O)(=O)N(C)C)oc3C)n[nH]2)cc1	765576096	PJOBTFBAYSWJCX-UHFFFAOYSA-N	445.501	1.866	50	20	IDGD	
C[C@H](NC(=O)c1ccoc1)C(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	765755623	IZXLQXLFHHTXIU-HNNXBMFYSA-N	447.923	1.017	50	20	IDGD	
CCCCS(=O)(=O)c1ccc(C(=O)NNC(=O)CCN2C[C@@H](C)O[C@H](C)C2)cc1	765817867	TUCBYZVCPMIINJ-HZPDHXFCSA-N	425.551	1.521	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NN=C(C)c1ccnn1C)N(S(C)(=O)=O)CC2	766003427	XDMZUDCGWRAXHE-QGZVFWFLSA-N	449.533	1.227	50	20	IDGD	
Cc1noc(C)c1S(=O)(=O)NCC(=O)NNC(=O)c1ccc(COc2ccccc2)o1	769678596	CAXOXGAUORAHTM-UHFFFAOYSA-N	448.457	1.203	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCOCC2)cc1NC(=O)NNc1ncccc1Cl	769924752	CINSCHWBNHKAAO-UHFFFAOYSA-N	441.897	1.913	50	20	IDGD	
CC[C@@H](NC(=O)NNc1nc(O)c2cnn(C)c2n1)c1ccccc1OCC(=O)N(C)C	770351680	SWYGZVCKRWXWRF-CQSZACIVSA-N	442.480	1.313	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)c3ccc4c(c3)C(=O)N(Cc3ccccc3)C4=O)nc21	770974406	UDMCSOWJILLRIN-UHFFFAOYSA-N	443.423	1.622	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1ccc(C(N)=O)cc1)C(=O)NNc1ccc(OC(F)(F)F)cc1	771038118	OLFVZUZMAHNKNE-SNVBAGLBSA-N	446.407	1.494	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)NCCN(C)S(=O)(=O)c1cccs1	772015993	MZYXLRZWHSEJCL-UHFFFAOYSA-N	446.938	1.675	50	20	IDGD	
Cc1cc(O)c(C(=O)O)cc1S(=O)(=O)NNC(=O)[C@H](C)Oc1cccc(Cl)c1	773267813	XHBSSTWORQYXTL-JTQLQIEISA-N	428.850	1.829	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNc2cccc(C#N)c2)cc(S(C)(=O)=O)c1	773698383	CDBCJKAIFPHGCS-UHFFFAOYSA-N	430.442	1.220	50	20	IDGD	
O=C(NNc1cccc(Cl)c1)C(=O)Nc1cc(C2CC2)nn1[C@@H]1CCS(=O)(=O)C1	773736704	UAMRFXUVWDMVPI-CQSZACIVSA-N	437.909	1.855	50	20	IDGD	
COC(=O)C1(c2ccc(S(=O)(=O)NNC(=O)c3nnc(-c4ccccc4)o3)cc2)CC1	776275950	IOZLWKKEOGXRLK-UHFFFAOYSA-N	442.453	1.565	50	20	IDGD	
CC[C@H](C)Oc1cc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)ccn1	777759547	RACNYFKUAPDBNU-AWEZNQCLSA-N	449.533	1.653	50	20	IDGD	
O=C(NN=c1cc[nH]cc1)[C@H]1CCCN(S(=O)(=O)c2ccc(Br)s2)C1	780757049	RDHMFEFOACSDLD-NSHDSACASA-N	445.364	1.872	50	20	IDGD	
Cc1ccnc(NNC(=O)CCc2c(C)nn(-c3ccc(S(N)(=O)=O)cc3)c2C)c1	781953082	VXBHXVPYSDSJPX-UHFFFAOYSA-N	428.518	1.916	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2ccccc2CCN(C)C)cc1	782906858	INRMSBUHELKCBP-UHFFFAOYSA-N	447.561	1.573	50	20	IDGD	
COc1ccc(S(=O)(=O)NC2CC2)cc1NC(=O)C(=O)NNc1cc(C)cc(C)c1	783357447	SQBXVGLJLZWQDP-UHFFFAOYSA-N	432.502	1.835	50	20	IDGD	
CNC(=O)[C@H]1CN(C(=O)C(=O)NNc2ccc(Br)c(C)c2)c2ccccc2O1	783921264	QCQJYCNQIRMCQP-MRXNPFEDSA-N	447.289	1.741	50	20	IDGD	
CCOC(=O)c1c(C)csc1NC(=O)C(=O)NNc1cccc(S(C)(=O)=O)c1	784841434	JNMJXMIVVAMHDB-UHFFFAOYSA-N	425.488	1.719	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1cccc(-c2cnco2)c1	785330805	MVAOMMXZEXKHCU-UHFFFAOYSA-N	430.442	1.836	50	20	IDGD	
Cc1nc2cc(C(=O)NNC(=O)N[C@@H]3CCS(=O)(=O)C3)ccc2n1Cc1ccsc1	788500900	CWYXVUQCEDIZGG-OAHLLOKOSA-N	447.542	1.586	50	20	IDGD	
COc1nn(C)cc1NC(=O)C(=O)NNC(=O)c1ccccc1OCc1ccc(F)cc1	789585757	DAJRVAPFNFUXAL-UHFFFAOYSA-N	441.419	1.547	50	20	IDGD	
C[C@@H](Cn1ccc2ccccc21)C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	794763991	PEAANPCMDIJKJP-HNNXBMFYSA-N	428.514	1.989	50	20	IDGD	
Cc1cc(Cn2nnc(C(=O)OCC(=O)C(C#N)=C3N(C)c4ccccc4N3C)c2C)on1	796521084	VQDTZBFXLDOZBT-UHFFFAOYSA-N	447.455	1.979	50	20	IDGD	
CNC(=O)c1cc(Oc2ccccc2NC(=O)C(=O)NNC(=O)c2cccc(C)n2)ccn1	797369973	RVEUATKOYZIJCA-UHFFFAOYSA-N	448.439	1.337	50	20	IDGD	
Nc1c(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)ccnc1-c1ccccc1	797485348	PVKZXUKKSLPICM-SFHVURJKSA-N	448.435	1.475	50	20	IDGD	
COCCOc1cc([N+](=O)[O-])c(C(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1OC	798124333	PDCSWGMJDUVUJL-UHFFFAOYSA-N	447.400	1.475	50	20	IDGD	
C[C@H]1[C@@H](NC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])CC(=O)N1Cc1ccccc1	798530728	SBKNTFDOJFALLJ-HOCLYGCPSA-N	441.444	1.494	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN(S(=O)(=O)c2ccccc2)C1)Nc1ccc2c(c1)OCO2	802106668	PCSKOMYNIYYKGN-AWEZNQCLSA-N	446.485	1.669	50	20	IDGD	
COc1ccc(Cl)c(NC(=O)NNC(=O)[C@H](C)N2C(=O)[C@H]3[C@H]4CC[C@@H](O4)[C@@H]3C2=O)c1	802114072	PJOVEVNLABPGDZ-KVOGPGQGSA-N	436.852	1.052	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)[C@@H]2C[C@@H](O)CN2C(=O)OCc2ccccc2)cc1	802124269	IVCRHRFSVIBKJE-MOPGFXCFSA-N	441.488	1.677	50	20	IDGD	
C[C@](O)(CN1Cc2ccccc2C1=O)C(=O)OCC(=O)NNC(=O)c1ccc(Cl)cc1	803468974	FBDWGORKYJEEEK-NRFANRHFSA-N	445.859	1.051	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1ccc(F)cc1OC1CCOCC1	806979321	XXGNSACVYJFLMS-UHFFFAOYSA-N	447.419	1.254	50	20	IDGD	
CCc1ccc([C@@H](CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)N(C)C)cc1	807006018	KSPPBNKIJQVPKN-GOSISDBHSA-N	446.577	1.789	50	20	IDGD	
CN(CCC(F)(F)F)[C@@H](CNC(=O)NNC(=O)C(=O)NC1CC1)c1ccc(Cl)cc1	807227276	XAWMTSAWBALSFU-AWEZNQCLSA-N	449.861	1.874	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)[C@@H]1CC(=O)N(C)[C@H]1c1ccc(Cl)c(F)c1	807372119	YTHRVDTWCZNEQM-WBMJQRKESA-N	429.876	1.935	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)NCc1ccccc1S(N)(=O)=O	807604886	MPLCYGPFHCMDNF-CQSZACIVSA-N	442.497	1.785	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)Nc1nc(Sc2ccc(OC)cc2)ns1	809922714	HBQPMOWOOLWOQS-JTQLQIEISA-N	427.508	1.902	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)c1c(Br)nnn1C	809981185	BWGICXIKPSWMLR-ZETCQYMHSA-N	447.087	1.569	50	20	IDGD	
COc1ccc2nc(NNC(=O)CNS(=O)(=O)c3cccc(C#N)c3)c(C)cc2c1	810953330	ZVSGABQKJSMETM-UHFFFAOYSA-N	425.470	1.845	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)NCc2ccncc2OCCCN(C)C)cc1C	812395495	BJWLBZMEIFILPL-UHFFFAOYSA-N	442.520	1.498	50	20	IDGD	
CCn1nncc1C(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccc(OC)cc2)c1	814697910	IJNXITYKBYSVRS-UHFFFAOYSA-N	444.473	1.182	50	20	IDGD	
COc1cc(C(=O)NN=C(C)c2ccc(S(=O)(=O)CC(N)=O)cc2)cc(OC)c1OC	814699024	YVKGFILAGPAWOA-UHFFFAOYSA-N	449.485	1.125	50	20	IDGD	
COc1cnc(C(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)nc1	814796705	MEQWTUNQRUWCIZ-UHFFFAOYSA-N	433.471	1.422	50	20	IDGD	
CC(=NNC(=O)Nc1ccc2c(c1)OCO2)c1ccc(S(=O)(=O)NCC(=O)O)cc1	814991992	DEKPOJOCLBRPFC-UHFFFAOYSA-N	434.430	1.324	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCc2nncn2C1)C(=O)Nc1ccccc1C#Cc1ccccc1	815691786	BIYSKMJHRHQRKV-SFHVURJKSA-N	428.452	1.026	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1nc(C(F)(F)F)cs1	815752118	DBUKOXGPAJRHCG-UHFFFAOYSA-N	437.425	1.494	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)CN2C(=O)NC3(CCCC3)C2=O)c1	818764249	ZBDSVMOKWNRKFS-UHFFFAOYSA-N	439.266	1.543	50	20	IDGD	
CSCC[C@@H](NC(=O)c1cccc(C)c1)C(=O)NNC(=O)[C@@H]1COc2ccccc2O1	859420409	XRKFRRDZYNHLNR-APWZRJJASA-N	443.525	1.834	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)CN2C(=O)N[C@]3(C[C@@H](C)CC(C)(C)C3)C2=O)cc1	901393848	OWRRXDKIOONUJG-NYHFZMIOSA-N	430.505	1.658	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)c2cc(-c3ccco3)nc3c(C(N)=O)ncn23)c1	913081305	HMDZIMICCVTNBE-UHFFFAOYSA-N	434.412	1.237	50	20	IDGD	
O=C(CC1CCCC1)NNC(=S)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1	913444484	ZCMFRZUVTLONRB-UHFFFAOYSA-N	426.564	1.605	50	20	IDGD	
CCCCCNC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	915879114	RUIYKFWOEPVUSW-UHFFFAOYSA-N	426.539	1.161	50	20	IDGD	
CC(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc1	916147668	IOJGBKXTBFEXLH-UHFFFAOYSA-N	428.470	1.835	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)NC1CCN(C(=O)c2ccco2)CC1	916244299	RAGBTHNLIGTWAB-UHFFFAOYSA-N	431.405	1.202	50	20	IDGD	
CC(C)[C@H](CNC(=O)NNC(=O)CCSc1ccc(F)cc1)N1CCN(C)CC1	916257936	HGSBXXIECRKPCM-SFHVURJKSA-N	425.574	1.910	50	20	IDGD	
CC[C@@H](NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)c1ccc2c(c1)OCCO2	918132461	FTGWTDLJOPHQFD-MRXNPFEDSA-N	437.456	1.800	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)c2nn(-c3cccc(Cl)c3)cc2O)c2ccccc2c1=O	918757966	RZIACQOOIZRQIK-UHFFFAOYSA-N	438.831	1.553	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)c3cc(NS(C)(=O)=O)ccc3O)n[nH]2)cc1	919815863	XAMJEJKNIBXNNO-UHFFFAOYSA-N	429.458	1.537	50	20	IDGD	
O=C(CCn1cc([N+](=O)[O-])cn1)NNC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1	919838666	FERRTVUAESHMEG-UHFFFAOYSA-N	446.427	1.890	50	20	IDGD	
O=C(NCC(=O)N1CCCC1)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1	1318984913	HZWXMMXYOYKHKL-NRFANRHFSA-N	435.528	1.566	50	20	IDGD	
Cc1c(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)ccc2cncn12	1320101627	KKPAJGMCEGERRL-UHFFFAOYSA-N	428.518	1.336	50	20	IDGD	
Nc1cnnc(NNC(=O)c2ccc(F)c(S(=O)(=O)N3CCCCC3)c2)c1Cl	1322654578	BCMXUFIXPQMABP-UHFFFAOYSA-N	428.877	1.783	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)C[C@@H]2CCCS(=O)(=O)C2)cc1	1324415290	LDAOSWQZYIKAAP-AWEZNQCLSA-N	437.547	1.083	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)N[C@@H]2CC(=O)N(c3ccccc3)C2)CC1	1326250072	VSNNIUSAGFNSJQ-MRXNPFEDSA-N	445.520	1.769	50	20	IDGD	
CCOC(=O)[C@H]1CN(C(=O)OC(C)(C)C)CCN1[C@H](C)C(=O)NNC(=O)CC(C)C	1340800234	COMNRZLGJCKRCO-HUUCEWRRSA-N	428.530	1.053	50	20	IDGD	
NC(=O)[C@@H]1CCCN(c2ccc(C(=O)NNC(=S)NCCc3cccs3)cc2)C1	1347323078	MXFMVDXKENKOKX-OAHLLOKOSA-N	431.587	1.801	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4cccnc4n3)C2)C1	1778432420	MQZBOOOLZJCQLB-NRFANRHFSA-N	428.565	1.925	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(Cl)Cl)C2)c1ccc2ncnn2c1	1779171368	DPLVDXYVECGONB-FZKQIMNGSA-N	426.304	1.661	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc4ncsc4[nH]3)C2)C1	1779341142	JDQXPPNELRVREF-QLJPJBMISA-N	427.324	1.851	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(Cl)nn3)C2)C1	1779432792	PMQNWKZYBUZINQ-MEDUHNTESA-N	431.718	1.747	50	20	IDGD	
CCOC(=O)c1cc(C(=O)N2CC[C@@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)ccn1	1780321402	SOPBXCSFUXCDIW-OAQYLSRUSA-N	437.924	1.967	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)N2CCN(C)CC2)C1	1780637215	QYPRXCWYMXVOEV-VQQMMKBISA-N	443.032	1.544	50	20	IDGD	
Cc1cccc(C)c1NC(=O)C(=O)N1CC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1781242163	JUIJJFNUAHFARW-LJQANCHMSA-N	428.316	1.876	50	20	IDGD	
O=C(c1ccc2nonc2c1)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781330079	PSVZYZIASOVPOK-XJKSGUPXSA-N	427.230	1.357	50	20	IDGD	
Cc1ccn2c(C(=O)N3CCO[C@]4(CCN(C(=O)[C@H](F)Br)C4)C3)cnc2c1	1781331953	BNZVUCHWDBIPLV-YJBOKZPZSA-N	439.285	1.777	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnnn1C)C2	1781901822	XUMUREQREJUOAD-SUYBPPKGSA-N	428.331	1.116	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(C)nc1OC)C2	1782173856	SFMXIVYIWXJZAS-CSODHUTKSA-N	439.940	1.780	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cccn4nccc34)C2)C1	1782328300	BFGWAWAXOTUUEQ-IFXJQAMLSA-N	435.322	1.809	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cn4c(F)cccc4n3)C2)C1	1782373940	ZYYPZEKDEISVBV-XIKOKIGWSA-N	439.285	1.700	50	20	IDGD	
COc1ccc(CCC(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)c(OC)c1	1782991782	UNNVUFUOFOPVAN-DYESRHJHSA-N	440.924	1.066	50	20	IDGD	
O=C([C@@H](F)Br)N1CCO[C@]2(CCN(C(=O)C(Cl)(Cl)Cl)C2)C1	1783266303	XNEOKGGOWLDZEF-GMSGAONNSA-N	426.497	1.877	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3n[nH]c4c3CCCC4)CCO2)C1	1783534579	LUUHWBBRJHGVNY-XIKOKIGWSA-N	425.327	1.515	50	20	IDGD	
CC1(C(=O)N2CC[C@@]3(CN(C(=O)c4cnccc4C(=O)NN)CCO3)C2)CCCCC1	1783816552	BESUEVPVHWEQCX-JOCHJYFZSA-N	429.521	1.099	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)Cn3ccnc3)C[C@@H]21	1783973653	CFLJAJJRLOLNKP-XAJHFOFHSA-N	441.370	1.530	50	20	IDGD	
COc1ccc(CCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]3C2)c(F)c1	1784091755	ANOFMQJQMRIMSX-WQCNXYOZSA-N	442.915	1.346	50	20	IDGD	
C[C@@H](Sc1ccccc1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21	1784348475	HYNSHDLOGHIRRM-KSIDHJATSA-N	426.966	1.747	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(C(N)=O)cc3)C2)C1	1784931822	UYQXOQNMVXRTCH-RBUKOAKNSA-N	428.316	1.465	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc4ncccn34)C[C@@H]21	1786406838	JYDIPVNVBSNZAV-YDHLFZDLSA-N	436.310	1.108	50	20	IDGD	
Cc1ccc(S(=O)(=O)CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]3C2)cc1	1787445753	NYUGTJATHWXYHX-MBGYTDRXSA-N	446.928	1.283	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc4cccn4cn3)[C@H]2C1	1788075983	FAUPXTIKEBIRPU-IEZWGBDMSA-N	430.581	1.779	50	20	IDGD	
CC(C)N1CCC[C@H]1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]2C1	1788765922	FCPTVKPJVJHOKN-VJANTYMQSA-N	425.646	1.690	50	20	IDGD	
CCC[C@H](NC(C)=O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]2C1	1791064789	KROXJHCNEAJHMP-DGVSKKNDSA-N	432.359	1.054	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(Cl)cnc1O	1792390568	GNPXIRRWOMGMNS-DJBIQUGXSA-N	446.729	1.817	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc3[nH]ncc13)C2	1792867892	KARJFSZFBKNVPM-KOFHJDLBSA-N	435.322	1.797	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(N2CCOCC2)cn1	1794441052	FDAAFKGSZRVGGR-LORHWOILSA-N	436.940	1.139	50	20	IDGD	
Cc1ccc(OCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)CBr)C3)cc1	1795305182	BYFPLSBSNOTPMT-OAFZBRQQSA-N	439.350	1.994	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1nc[nH]n1	1796494676	RUKGOIQQPRHIHM-CLLJXQQHSA-N	428.405	1.204	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(Cl)c(O)cc1O)C2	1797956171	GWOJRHIIUSBOFN-KSPBDQMDSA-N	442.972	1.806	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CC13CCCN1CCC3)C2)[C@H](F)Br	1799348579	LHXKREYCCPOQGB-XRGAULLZSA-N	432.334	1.285	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc2nccn12	1799996397	AGXIYYLBBIAFKS-UMPJEAMMSA-N	435.322	1.711	50	20	IDGD	
CC(C)(C)OC(=O)N1CC2(C[C@@H]2C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Cl)C3)C1	1800707611	GQUMJAPYQJHYFT-XLWJZTARSA-N	445.919	1.367	50	20	IDGD	
CCOc1cccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)Br)c1O	1800759859	MFJYWTCUBROBEE-JFILPPLUSA-N	441.322	1.778	50	20	IDGD	
CCOC(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)CBr)C2)OCC	1801147560	UJYMPYNOLBLQIS-VWPFQQQWSA-N	435.359	1.396	50	20	IDGD	
CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](Cl)COC)C2	1801964053	HVZRVNMHAWZDMQ-NPJQDHAYSA-N	447.960	1.133	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1(c2ccccc2F)CC1	1804231911	YZCYCOXSZQQWLO-BJWYYQGGSA-N	430.524	1.869	50	20	IDGD	
Cc1cc[nH]c1C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1805005160	SIVOGPXJWVBPIX-WIYYLYMNSA-N	432.289	1.031	50	20	IDGD	
Cc1cccc(C(=O)NC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)n1	1805521211	UKQIFTBBEGTPKP-AVRDEDQJSA-N	438.532	1.478	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@@H](CNC(=O)Cn2ccnn2)[C@@H]1c1cccnc1	1807674622	MATLCDVAZVHJNQ-KMFMINBZSA-N	435.326	1.410	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1CCN(C(=O)[C@@H]2CNC(=O)O2)[C@@H]1c1cccnc1	1808290349	SOLINDJLVHMVDG-FLTUCWPJSA-N	429.304	1.432	50	20	IDGD	
O=C([C@H](O)CCl)N1CC[C@@H](CNC(=O)C2(Br)CC2)[C@H]1c1cccnc1	1808695666	TXLLNYBUEZQGGF-BFHYXJOUSA-N	430.730	1.615	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)c1cnnc2ccccc12	1809135606	GCQAYIBWTXLVCK-BEVDRBHNSA-N	439.903	1.944	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1CCN(C(=O)c2c[nH]c(=O)cn2)[C@@H]1c1cccnc1	1810544406	MDJSXRUCGFQCAB-HNAYVOBHSA-N	429.553	1.336	50	20	IDGD	
COc1ccnc(C(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@H]2c2cccnc2)c1OC	1811647166	GIXSXPJLEHZYPG-DAYGRLMNSA-N	448.907	1.413	50	20	IDGD	
C[C@H](C(=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@H]1c1cccnc1)n1ccnn1	1812398999	ZTYXZONQEAPSSB-UQOMUDLDSA-N	439.289	1.631	50	20	IDGD	
C[C@H](CBr)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2c[nH]c(=O)cn2)[nH]n1	1814782299	QRUQNESCJOMMES-ZWNOBZJWSA-N	437.298	1.830	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1ccc(F)s1	1816027280	VURIBWZLERZUCT-OAHLLOKOSA-N	442.281	1.910	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccc(=O)n2O)n[nH]1	1816147508	FVDPZBKYKYCYNV-CQSZACIVSA-N	433.541	1.966	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccns2)[nH]n1)c1cccc(B(O)O)c1	1817473485	WBOWLAKXVXZDEI-OAHLLOKOSA-N	425.279	1.166	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1	1817473832	BTMQLEWEPDXNEE-RDJZCZTQSA-N	432.717	1.803	50	20	IDGD	
C[Si](C)(C)OCC(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H]2CCCS2(=O)=O)[nH]n1	1819596684	OOKBELUDUGKIRT-CABCVRRESA-N	442.614	1.831	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1cccc(F)n1	1819735120	RQMBUDXXDYGMIJ-QGZVFWFLSA-N	437.240	1.243	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2c(F)cncc2F)n[nH]1	1819918209	PRJXHRSAIKCEGD-HNNXBMFYSA-N	449.462	1.762	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](C)N2CCN(C)CC2)n[nH]1	1820789966	SLEWRZOYISJLBR-HLLBOEOZSA-N	440.976	1.292	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](F)Br)n[nH]1	1820932768	PGYKXCRYLGXAHX-PTOFAABTSA-N	433.282	1.539	50	20	IDGD	
C[C@@H](Cn1ccnc1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1	1822416413	CWNPLACZTJBCFU-DOTOQJQBSA-N	444.540	1.308	50	20	IDGD	
O=C(N[C@@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1)c1ccc[n+]([O-])c1	1823001457	FYIZKXXWBPSBMF-BXKDBHETSA-N	429.271	1.693	50	20	IDGD	
Cc1ccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)c(O)c1	1823148265	NKHSWKNUAILHJY-LJQANCHMSA-N	448.288	1.723	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)C[C@@H]2NC(=O)NC2=O)CC1	1824610132	WVLVZGNITDYPRV-JYJNAYRXSA-N	426.945	1.612	50	20	IDGD	
O=C([C@@H](O)CCl)N1CCC([C@H]2CCCCN2C(=O)c2cnc(OCF)cn2)CC1	1825545322	RVNODCFODWZRQH-CVEARBPZSA-N	428.892	1.615	50	20	IDGD	
CN1CCN(CC(=O)N2CCCC[C@H]2C2CCN(C(=O)CCBr)CC2)CC1	1828442380	VVZHKPKTWNIYAQ-SFHVURJKSA-N	443.430	1.639	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1	1829102332	PBHGHLJHCHFGPA-HXUWFJFHSA-N	446.429	1.451	50	20	IDGD	
Cc1cccc(/C=C/C(=O)N2CCO[C@@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)n1	1829720452	AJFLUQLYLDDLBR-UVIRAJKCSA-N	447.608	1.711	50	20	IDGD	
O=C(CN1CCCC1=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H](F)Br)CC1	1830374588	IZPFDCJXSLXLLJ-RHSMWYFYSA-N	432.334	1.919	50	20	IDGD	
CC(C)(C)c1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)ccn1	1830725664	QUOIVWYMMSJLAX-HRAATJIYSA-N	439.940	1.049	50	20	IDGD	
O=C(C(Cl)Cl)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2CCCS2(=O)=O)CC1	1831286485	XPWCLCVYYDZLCB-KBPBESRZSA-N	425.378	1.987	50	20	IDGD	
CC(C)c1cc(C(=O)N2CCC(N3CCC(NC(=O)[C@@H](O)CCl)CC3)CC2)no1	1833309148	PZVKYLBPMFFDNN-KRWDZBQOSA-N	426.945	1.583	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cc4ccccn4n3)CC2)CC1)[C@@H](O)CCl	1833310543	RKCKYUAMUWPBRI-IBGZPJMESA-N	433.940	1.119	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ncc(Cl)cn3)CCO2)C1	1833781464	GCYXWGNAIFJYOR-KDOFPFPSSA-N	431.320	1.608	50	20	IDGD	
COc1ncc(C(=O)N2CCO[C@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)cc1C	1834581546	IQODXYZDDVRCOG-GOSISDBHSA-N	432.304	1.272	50	20	IDGD	
COc1cccc(CC(=O)N2CCC(OC3CCN(C(=O)[C@H](O)CCl)CC3)CC2)n1	1836715646	WHPUOKVFOZAXBA-GOSISDBHSA-N	439.940	1.231	50	20	IDGD	
Cc1ccccc1OCC(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836716848	UUKKGPHWFKWNQL-IBGZPJMESA-N	438.952	1.972	50	20	IDGD	
CCC(=O)N[C@@H](C)C(=O)N1CCC(OC2CCN(C(=O)CCBr)CC2)CC1	1836820760	KQBQETRTSICTEL-AWEZNQCLSA-N	446.386	1.685	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(F)nc3)CCO2)C1	1837846889	SXGRBUUYNTYTRF-QZTJIDSGSA-N	434.295	1.527	50	20	IDGD	
CCOC(=O)N[C@H](O)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](Cl)CC)CC2)CC1	1838356955	JGHIQVMSOINNNT-JKSUJKDBSA-N	433.933	1.067	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(=O)c4ccccc4o3)C2)C1	1839141589	NBVDROMTSDTBAN-KSFYIVLOSA-N	448.903	1.880	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3CCCSC3)C2)C1	1839156375	NUEHOAJOXBFYOE-FHLIZLRMSA-N	439.405	1.822	50	20	IDGD	
CN(C)c1c(F)cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)cc1F	1839468859	HVHUYWLQHXNKLT-APWZRJJASA-N	449.857	1.635	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(F)cc(Cl)c3)C2)C1	1840156877	XDHQHRBLRVFJIY-VQIMIIECSA-N	449.306	1.803	50	20	IDGD	
O=C(c1ccnc2ncccc12)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840189982	WJRGDBMAVBAKFK-LJQANCHMSA-N	439.299	1.504	50	20	IDGD	
CCOC(CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2)OCC	1840190838	PYERRRDVAKPJOQ-QGZVFWFLSA-N	427.325	1.036	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)c2cccnc2CS(C)(=O)=O)C1	1842239961	IANJYGMFTWRITH-OAHLLOKOSA-N	427.954	1.851	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2cc(C)c3n[nH]cc3c2)C1	1845604756	IISWOEIACFNCAK-CVKSISIWSA-N	447.499	1.822	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCCC12CN(C(=O)CN1CCOCC1)C2	1845870975	ZCCRDEQBHTZBOT-LICLKQGHSA-N	430.455	1.407	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC12CN(C(=O)c1nnc3cc(C)nn3c1C)C2	1846070311	BOHBTZKIYUSCCD-ZDUSSCGKSA-N	435.326	1.732	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)[C@@H](C)Cc2ccco2)C1	1846640271	RIWXSKCZPFTYIN-HXNWEGJNSA-N	425.489	1.796	50	20	IDGD	
CCC1CCC2(CC1)NC(=O)N(CC(=O)OCC(=O)NNC(=O)c1ccc(C)cc1)C2=O	10133625	KUSCBUFETDZNQS-UHFFFAOYSA-N	444.488	1.190	50	20	IDGD	
CCCCn1c(CCC(=O)NNC(=O)C2CC2)nc2cc(S(=O)(=O)N(C)C)ccc21	26967827	GNHAUGPPSCBBNU-UHFFFAOYSA-N	435.550	1.577	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN1S(=O)(=O)c1cccs1)c1ccc2ccccc2n1	109910297	WOMFQLVKRHUUAE-INIZCTEOSA-N	430.511	1.911	50	20	IDGD	
CC(C)(C)NC(=S)NNC(=O)CN1C(=O)N[C@](C)(c2ccc3ccccc3c2)C1=O	726138661	TUWQXMRJHPARPL-OAQYLSRUSA-N	427.530	1.901	50	20	IDGD	
CCOc1ccccc1CCNC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1	727941819	HSNSVIFJOWKYLI-UHFFFAOYSA-N	448.545	1.587	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)CS[C@@H]2CCS(=O)(=O)C2)c1	728528572	GIPWLSKBHKEGNW-SNVBAGLBSA-N	437.337	1.139	50	20	IDGD	
C[C@H](C(=O)NNC(=O)c1cc(F)ccc1Br)N1C(=O)[C@@H]2CCCC[C@H]2C1=O	728550879	LXDUPGFRDDJDSE-YUSALJHKSA-N	440.269	1.913	50	20	IDGD	
CCOC(=O)c1ccc(CNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1	728958607	BHVXSEMOQYYYII-UHFFFAOYSA-N	426.477	1.400	50	20	IDGD	
O=C(NNC(=O)N1CCC[C@H](OCC(F)(F)F)C1)C1CCN(c2ncccn2)CC1	728958842	FWZAOVJTHOPHRZ-AWEZNQCLSA-N	430.431	1.477	50	20	IDGD	
CC[C@H](NC(=O)NNC(=O)c1c(C)nc2ccccn12)c1cccc(S(N)(=O)=O)c1	729221562	SPORILXMEAIHTP-HNNXBMFYSA-N	430.490	1.385	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)[C@H]2CCCCN2C(=O)c2ccccc2)c2ccccc2c1=O	729299360	BBJOAKZDMYXCNH-GOSISDBHSA-N	433.468	1.389	50	20	IDGD	
CCCCN1C(=O)CC[C@H](C(=O)NNC(=O)Cc2cc[nH]n2)[C@H]1c1ccc(OC)cc1	730102456	DYBZSJRVLKQDOF-GHTZIAJQSA-N	427.505	1.888	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)[C@@H]2CCCN(S(=O)(=O)Cc3ccccc3)C2)c(O)c1	730590485	NTJVLCFUSIECPC-QGZVFWFLSA-N	431.514	1.704	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=O)Cc2ccccc2F)c1	731345158	CJONMXKBKGCQSH-UHFFFAOYSA-N	443.884	1.408	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)[C@H]2COc3ccc(Cl)cc3C2)ccc1Cl	731784871	IZFLJRFUYLPUBK-LLVKDONJSA-N	444.296	1.653	50	20	IDGD	
O=C(NNC(=O)C(=O)N1CCCC1)N[C@H]1CCCN(Cc2ccc(F)cc2Cl)C1	732469804	RAMCIAPGLWRDOH-HNNXBMFYSA-N	425.892	1.396	50	20	IDGD	
Cc1ccccc1-n1cc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cn1	732683026	BBZSJIAKCSWGLI-IBGZPJMESA-N	436.424	1.325	50	20	IDGD	
NC(=O)[C@@H]1CC(C(=O)NNc2nc(-c3ccc(Cl)cc3)no2)=NN1c1ccccc1	732976978	VYDSUJHCMVDANM-HNNXBMFYSA-N	425.836	1.953	50	20	IDGD	
Cc1nc(-c2cccnc2)nc(O)c1CC(=O)NNC(=O)c1cnn(-c2ccccc2)c1	733170247	VBENSYCMXFWWIZ-UHFFFAOYSA-N	429.440	1.742	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)[C@H]1CC(c2cc(F)ccc2F)=NO1	734241355	CBDSHPAPGOSHLR-CQSZACIVSA-N	427.408	1.313	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)C2(c3cccc(Cl)c3)CC2)CC1	735117993	MBFXWPHMMFJNQX-UHFFFAOYSA-N	449.964	1.846	50	20	IDGD	
C[C@@H]1Cc2cc(S(=O)(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)cc(Cl)c2O1	736064564	VEEFBLXEXGUULW-SNVBAGLBSA-N	444.918	1.690	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN(C)[C@@H](c2cccc(F)c2)c2cnn(C)c2)n1	738309280	LMRNBHHNKLOBAD-FQEVSTJZSA-N	430.509	1.735	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)ccc1OC	739671045	RJPVOXRQKIYDFO-UHFFFAOYSA-N	435.458	1.047	50	20	IDGD	
CN(C)C(=O)CS(=O)(=O)c1ccc(C(=O)NNc2nc(-c3ccccc3)no2)cc1	742072725	IPRNDNCVHACLBM-UHFFFAOYSA-N	429.458	1.355	50	20	IDGD	
COc1cccc(O[C@H](C)CNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1	743588551	BZLDDKQOGBRBOG-OAHLLOKOSA-N	428.493	1.500	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NCCOC)c(C(=O)NNC(=O)c2ccncc2)c1	743787227	KGYLQXYSINCJRR-UHFFFAOYSA-N	449.533	1.245	50	20	IDGD	
CC(=O)N1C[C@H](C(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)Oc2ccccc21	743831118	PXIATBJNHIZUEL-QGZVFWFLSA-N	432.458	1.057	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)c2cccc(NC(=O)[C@@H]3CCCO3)c2)c1	744548873	PTKBCEZSZUMUGN-SFHVURJKSA-N	436.424	1.294	50	20	IDGD	
CC(=O)c1cccc(OCC(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)c1	744619550	SFCAYZJXIUSJSI-UHFFFAOYSA-N	433.486	1.432	50	20	IDGD	
O=C(Cc1ccc(NS(=O)(=O)c2ccc(F)cc2)cc1)NNC(=O)N1CCOCC1	745996407	WLMTUBVWIWNNPB-UHFFFAOYSA-N	436.465	1.242	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Cc2cn3ccccc3n2)c([N+](=O)[O-])cc1OC(F)F	746554052	VPNMLJBQBGFTBJ-UHFFFAOYSA-N	435.343	1.856	50	20	IDGD	
COC(=O)c1ccsc1N1CC[C@@H](NC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)C1=O	746778374	APGOOYGKVGKMBL-CYBMUJFWSA-N	447.429	1.192	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@@H](C(=O)NNC(=O)c3ccc(C#N)cc3)C2)s1	747176199	PSZCFBBOPLHILS-MRXNPFEDSA-N	432.527	1.790	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2CN1S(=O)(=O)c1ccc(F)cc1)c1ccc[nH]1	747663794	YPJUQHYQSDSNQX-LJQANCHMSA-N	442.472	1.731	50	20	IDGD	
COc1ccc(C(=O)Oc2ccc(C=NNC(=O)C(=O)N3CCCC3)cc2OC)cc1	748139955	KYCFBAFRLMMQKI-UHFFFAOYSA-N	425.441	1.996	50	20	IDGD	
O=C(CCSCc1nc(O)c2c3c(sc2n1)CCC3)NNC(=O)C(=O)N1CCCC1	748247507	OZAIQXYYYWXTSZ-UHFFFAOYSA-N	449.558	1.279	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)NC[C@@H]1CCN(c2ccccc2OC)C1	750330693	HETKXEBDADRVQJ-INIZCTEOSA-N	428.489	1.940	50	20	IDGD	
CCc1cc(NNC(=O)c2ccc([C@@]3(C)NC(=O)NC3=O)cc2)nc(-c2ccccn2)n1	751068787	WJTHNYJQRQAVBX-JOCHJYFZSA-N	431.456	1.913	50	20	IDGD	
CC[C@@H](C)C(=O)N1CCC[C@H](C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)C1	751295513	ZMWODMDVKVOYCM-HIFRSBDPSA-N	437.566	1.334	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)n1	752503929	QOWNVXXXWCDSJO-UHFFFAOYSA-N	429.436	1.923	50	20	IDGD	
Cc1cc(Cl)ccc1OCCCC(=O)NNC(=O)c1ccc(CNS(C)(=O)=O)o1	753563174	NDJOQJAUXKEHGJ-UHFFFAOYSA-N	443.909	1.911	50	20	IDGD	
O=C(CSc1nnc(-c2ccco2)n1Cc1ccccc1)NNC(=O)Cc1cc[nH]n1	755284693	VUKDTOOSFSCLNC-UHFFFAOYSA-N	437.485	1.792	50	20	IDGD	
Cc1cccc(C)c1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	755410966	TUWONCTTXOMJOZ-UHFFFAOYSA-N	432.502	1.791	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2ccc(NC(=O)NNC(=O)Cc3ccncc3)cc2)C[C@@H](C)O1	755422314	JUXDSJBEYBWZLZ-GASCZTMLSA-N	447.517	1.275	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)Nc2cccc(OCC(=O)N3CCCC3)c2)cc1	755657971	OZEJUYFVYFHFFJ-UHFFFAOYSA-N	442.472	1.928	50	20	IDGD	
CNC(=O)c1ccc(C)c(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1	755661830	CWAIXGQTIZGUTM-UHFFFAOYSA-N	433.490	1.071	50	20	IDGD	
O=C(COC(=O)[C@H](O)c1cc(Cl)cc(Cl)c1)NNC(=O)c1cccc([N+](=O)[O-])c1	756744029	AMBUXHBTYBIINU-OAHLLOKOSA-N	442.211	1.939	50	20	IDGD	
CCOc1ccc(C(=O)N(C)C)cc1NC(=O)NNC(=O)COc1ccccc1[N+](=O)[O-]	756883450	SRONQLSBYQDENS-UHFFFAOYSA-N	445.432	1.927	50	20	IDGD	
O=C(NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1)c1ccc2nnnn2c1	758158030	PIGZZWYZJZVTIN-UHFFFAOYSA-N	443.470	1.061	50	20	IDGD	
O=C(c1ccc(Cn2cccn2)cc1)N1CCN(S(=O)(=O)CBr)CC1	758523965	QOLKUHSMWTVYGS-UHFFFAOYSA-N	427.324	1.371	50	20	IDGD	
CCC(CC)(CC)CNC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	759603091	QODQHIQMMZUBKU-UHFFFAOYSA-N	426.587	1.860	50	20	IDGD	
COc1ccc(S(N)(=O)=O)cc1NC(=O)COC(=O)/C(C#N)=C/c1ccc(C)cc1	759860385	HTFWTSCMKYXBCY-OQLLNIDSSA-N	429.454	1.740	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)/C=C\c1ccccc1)C(=O)NNc1ncc(F)cn1	760921245	UBDYFZGVFTYERT-WWRUEGTHSA-N	425.511	1.771	50	20	IDGD	
C[C@H]1CN(Cc2ccccc2)C[C@H](C)C1NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	761793714	RNHMDONQFOVZFP-IRXDYDNUSA-N	448.531	1.763	50	20	IDGD	
C[C@H](C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1)c1cccc([N+](=O)[O-])c1	763400562	XPYXYVZYIUDOGQ-SJCJKPOMSA-N	429.385	1.229	50	20	IDGD	
C[C@H]1CN(c2ccccc2NC(=O)C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)C[C@H](C)O1	763446731	WKEMZEFBPAICJG-KBPBESRZSA-N	441.444	1.608	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)NCc1ccc(S(C)(=O)=O)cc1	763463632	RIYMQBYIIYFHNN-UHFFFAOYSA-N	428.511	1.225	50	20	IDGD	
CO[C@H]1Cc2ccc(NC(=O)C(=O)NNC(=O)c3ccccc3Br)cc2C1	763483576	ROPBFVAUGQBKNA-AWEZNQCLSA-N	432.274	1.962	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2O)cc1OCC(F)(F)F	763528820	FSSDJVIVFKRWJX-UHFFFAOYSA-N	427.335	1.742	50	20	IDGD	
Cn1ccc2ccc(NC(=O)C(=O)NNC(=O)CCN3CCN(c4ccccc4)CC3)cc21	763532036	UOILSVSGWLADLE-UHFFFAOYSA-N	448.527	1.477	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cccnc2OC(C)C)cc(OC)c1OC	763539182	JWORBTQAWVXXKR-UHFFFAOYSA-N	432.433	1.294	50	20	IDGD	
CCC(=O)Nc1ccc(C)c(NC(=O)C(=O)NNC(=O)c2ccc(OC)c(OC)c2)c1	763549919	BLSHPAGQRLXCEK-UHFFFAOYSA-N	428.445	1.760	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2c(F)cccc2-n2cccn2)cc1OC	763550158	JCDWANMXQBNYPG-UHFFFAOYSA-N	427.392	1.428	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1OCC	763570988	JYDAAOAOZWNQNB-SFHVURJKSA-N	429.429	1.410	50	20	IDGD	
NC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)ccc1Cl	763603945	CUWWJCOQPLLBBN-UHFFFAOYSA-N	426.820	1.229	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2c3c(nn2-c2ccccc2)CCC3)cc1	763660642	FKOOYFVDDLNNKP-UHFFFAOYSA-N	449.467	1.535	50	20	IDGD	
COC(=O)c1cc(Cl)ccc1NC(=O)C(=O)NNC(=O)COc1ccc(C)c(C)c1	763679078	FWTPJXMDAKXSTM-UHFFFAOYSA-N	433.848	1.908	50	20	IDGD	
Cc1nc(C)n(-c2ccccc2NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)n1	763729356	WZHWVVVQQNJUBW-UHFFFAOYSA-N	447.499	1.423	50	20	IDGD	
Cc1cc(Br)ncc1NC(=O)C(=O)NNC(=O)CN1CCCc2ccccc21	763733985	JTIRORRPEGKRRA-UHFFFAOYSA-N	446.305	1.691	50	20	IDGD	
Cc1ccc(Cn2cccc(NC(=O)C(=O)NNC(=O)COc3ccc(C)cc3)c2=O)cc1	763820855	KIBRHQSVKUUAIT-UHFFFAOYSA-N	448.479	1.678	50	20	IDGD	
CNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)CSc2ccc(C)cc2)cc1Cl	763895232	AXUDDPJYVNTVDU-UHFFFAOYSA-N	434.905	1.886	50	20	IDGD	
CCOC(=O)c1ccsc1NC(=O)C(=O)NNC(=O)c1ccc(OCC)c(OC)c1	763900356	IRDLERPCFVQDBK-UHFFFAOYSA-N	435.458	1.732	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)Nc1ccc(N2CCCS2(=O)=O)cc1	763917391	ZMJHJHPEUSEUPA-UHFFFAOYSA-N	436.515	1.877	50	20	IDGD	
COc1ccc(C(=O)N2CCCC2)cc1NC(=O)C(=O)NNC(=O)Cc1ccc(F)cc1	763918277	AFUOBMSGTCGAJX-UHFFFAOYSA-N	442.447	1.399	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)C(=O)Nc1cccc(-c2cccs2)c1	763921852	PLZSCZPBYMCIMP-UHFFFAOYSA-N	433.453	1.791	50	20	IDGD	
COCCOc1cc(C)ccc1NC(=O)C(=O)NNC(=O)c1cc(Br)c[nH]1	763998562	PWSISIMNYTUINI-UHFFFAOYSA-N	439.266	1.511	50	20	IDGD	
COC(=O)c1cc(Br)ccc1NC(=O)C(=O)NNC(=O)Cc1ccsc1	764033624	MEGSGQFCXLMOSU-UHFFFAOYSA-N	440.275	1.626	50	20	IDGD	
CCOCCCNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2ccc(C)cc2O)c1	764111191	NPWVRHPKXLGCKS-UHFFFAOYSA-N	442.472	1.257	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cccc(N4CCNC4=O)c3)n[nH]2)cc1	764112341	WDLBEDRFYTZVFD-UHFFFAOYSA-N	447.455	1.314	50	20	IDGD	
O=C(Cc1ccccn1)NNC(=O)C(=O)Nc1ccc(OC(F)F)cc1OC(F)F	764264635	QTEUMOPYZIZLPF-UHFFFAOYSA-N	430.314	1.613	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1	764298130	OIHKKDCLLYHDQT-UHFFFAOYSA-N	432.440	1.763	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)cccc1C(=O)N1CCCC1	764349663	SAELCZGVXMGCRS-UHFFFAOYSA-N	444.875	1.990	50	20	IDGD	
CC(C)n1cc2c(n1)[C@@H](NC(=O)NNC(=O)c1csc(N3CCOCC3)n1)CCC2	765195453	RBGPFRWZFSADRP-AWEZNQCLSA-N	433.538	1.779	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cc(C)[nH]n2)cc1S(=O)(=O)N[C@@H]1CCCC[C@H]1C	765588383	ZEVMOALNFRKSKT-IUODEOHRSA-N	449.533	1.659	50	20	IDGD	
O=C(CCn1cnc2sccc2c1=O)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	765617065	REHBCVKZNPXIHW-UHFFFAOYSA-N	426.433	1.839	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)NCCN2CCN(c3cccc(Cl)c3)CC2)cc1	765726786	FYGJKRKFNLFPIQ-UHFFFAOYSA-N	426.908	1.978	50	20	IDGD	
Cn1ncc([N+](=O)[O-])c1C(=O)NNC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1	766755764	AOIYGBDMAXDJEH-UHFFFAOYSA-N	432.400	1.651	50	20	IDGD	
Cc1nn(CC(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1-c1ccccc1	767443413	YGKSEZXRJBMGCG-UHFFFAOYSA-N	426.502	1.613	50	20	IDGD	
Cc1cc(S(=O)(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)cc([N+](=O)[O-])c1F	768284196	XZYJNZKYBZPREJ-UHFFFAOYSA-N	434.446	1.657	50	20	IDGD	
O=C(CS(=O)(=O)Cc1cccc(Br)c1)NNC(=S)Nc1ccccn1	768577561	DXCBBMCCOWCZPM-UHFFFAOYSA-N	443.348	1.777	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)CN1C(=O)N[C@]2(CCCC[C@H]2C)C1=O	768635275	XCWAORVZDSHXQL-BLVKFPJESA-N	438.506	1.043	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN(C)CCN(C)C(=O)OC(C)(C)C	768744861	IACIFCXTLQWKAL-UHFFFAOYSA-N	428.917	1.908	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)NCc2ncoc2C)cc1	770886437	NJRYCNZKNZVHSA-CXUHLZMHSA-N	434.456	1.954	50	20	IDGD	
C[C@H](NS(=O)(=O)c1cccs1)C(=O)NNC(=O)c1cc(-c2cccs2)[nH]n1	771043793	AJHTWFWLKHLMIO-VIFPVBQESA-N	425.517	1.328	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(-c3ccc4c(c3)CCO4)no2)c1	771277015	SMPNWUUFZZPCPQ-UHFFFAOYSA-N	427.438	1.755	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNS(=O)(=O)CCOc1ccc(F)cc1	771606255	GLIVIOVVFAKSJW-UHFFFAOYSA-N	429.857	1.125	50	20	IDGD	
N#Cc1ccc(NNC(=O)C(=O)Nc2ccc(N3CCN(C(=O)C4CC4)CC3)nc2)cc1	773692961	OXTTUBSOPZBJLR-UHFFFAOYSA-N	433.472	1.094	50	20	IDGD	
COc1ccc(NC(=O)NNc2ccc(C#N)cc2)cc1S(=O)(=O)N1CCOCC1	775446031	UAPRTLFUGUSQBA-UHFFFAOYSA-N	431.474	1.736	50	20	IDGD	
Cc1noc2nc(C3CC3)cc(C(=O)N3CCN(S(=O)(=O)CBr)CC3)c12	777777871	QQWQHZONZPEJMD-UHFFFAOYSA-N	443.323	1.849	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)N3CCN(S(=O)(=O)CBr)CC3)n[nH]2)cc1	777831609	DUZWUTCNALZKIO-UHFFFAOYSA-N	427.324	1.825	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)N[C@@H]1CCN(CCCc2ccccc2)C1=O	778686930	MRBRYMPFSCEZSW-MRXNPFEDSA-N	433.509	1.075	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@@H](C(=O)NNC(=O)c2cc3ccccc3o2)[C@H](C)O)cc1	779529870	QFGHSYGEWIVFNT-SCLBCKFNSA-N	431.470	1.230	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)CC(=O)NCC(F)(F)F	779643638	XBHZGNVQGLEQJA-QMMMGPOBSA-N	426.189	1.432	50	20	IDGD	
CCCOc1ccc(NC(=O)C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)cc1	782898047	XWLAKAXQMXZQCG-UHFFFAOYSA-N	447.517	1.477	50	20	IDGD	
O=C(NNc1ccc(Cl)cc1)C(=O)N1C[C@H](C(=O)N2CCOCC2)Oc2ccccc21	783339823	ORCNVSVUMFRTSA-GOSISDBHSA-N	444.875	1.436	50	20	IDGD	
CN(C)C(=O)COc1cccc(NC(=O)C(=O)NN=c2sc3ccccc3n2C)c1	783349984	TURJZSJWAGFSKC-UHFFFAOYSA-N	427.486	1.277	50	20	IDGD	
O=C(NN=c1cc[nH]cc1)C(=O)Nc1ccc(NC(=O)[C@@H]2CCCO2)cc1C(F)(F)F	783370480	WCUIRGGJTLOATD-HNNXBMFYSA-N	437.378	1.722	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2cccc(Cl)c2Oc2cccnc2)CCS(=O)(=O)C1	783428024	VYZRJQITIQGDBX-GOSISDBHSA-N	438.893	1.664	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2ccc(NC(=O)C(=O)NN(C)c3ccccc3)cc2)C[C@H](C)O1	783434397	LEBPHEWDRRYBFE-HOTGVXAUSA-N	446.529	1.591	50	20	IDGD	
CCOc1ccc(C(C)(C)C(=O)NNC(=O)CNC(=O)c2cccnc2)cc1OCC	783655421	FNEBHIYMQSGPRJ-UHFFFAOYSA-N	428.489	1.734	50	20	IDGD	
CCn1cnc2c1c(=O)n(CC(=O)NN=C(C)[C@@H]1CCCO1)c(=O)n2Cc1ccccc1	783811908	OBAKRINAVLLAHA-KRWDZBQOSA-N	438.488	1.099	50	20	IDGD	
CC[C@@H](C)NS(=O)(=O)c1cccc(NC(=O)C(=O)NNc2nccnc2Cl)c1	784777957	NWBWKQCBJRBBEL-SNVBAGLBSA-N	426.886	1.289	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)cnc1Br	785073435	GXMFZNGZIPJMFV-UHFFFAOYSA-N	431.250	1.129	50	20	IDGD	
N#Cc1ccc(NNC(=O)C(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)cc1Cl	785085961	HRBWAHGOMIDHRT-UHFFFAOYSA-N	447.904	1.528	50	20	IDGD	
COc1ccc2nc(NNC(=O)C(=O)Nc3cccnc3N3CCOCC3)c(C)cc2c1	785162873	QFRFSBRHOAOKOC-UHFFFAOYSA-N	436.472	1.865	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)N[C@H]2CCCN(C3CCCCC3)C2=O)nc2ccccc21	785920253	BBWHKIIFKMKMFT-KRWDZBQOSA-N	426.521	1.770	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(Oc2cccc(F)c2F)nc1	787550572	VBIKSGOUVKMQBF-NSHDSACASA-N	438.387	1.290	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)c1nnn(-c2cccc(Br)c2)c1C	788162653	CHWQEOSYSUJRFL-UHFFFAOYSA-N	440.298	1.888	50	20	IDGD	
C[C@H](NC(=O)c1ccc(Br)s1)C(=O)NNc1ccc(-n2ccnc2)nn1	788175549	UTHCAUVZAKWFNV-VIFPVBQESA-N	436.295	1.748	50	20	IDGD	
COc1ccc(S(=O)(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)cc1F	788918726	ZQJIJBAWKZJTEA-UHFFFAOYSA-N	446.501	1.632	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)C(=O)Nc1nc(C2CCC2)cs1	789731126	DAJFDWBUDMCMMA-UHFFFAOYSA-N	426.458	1.702	50	20	IDGD	
CN(C)CCC(=O)Nc1ccc(NC(=O)C(=O)NNc2cccc(F)c2[N+](=O)[O-])cc1	790999163	YXDYPKYLXTYXOS-UHFFFAOYSA-N	432.412	1.706	50	20	IDGD	
CC(C)C[C@@H](/N=C1/NS(=O)(=O)c2ccccc21)C(=O)NNc1nc2ccccn2n1	791241709	IXJKJHZMQPWUMI-CQSZACIVSA-N	427.490	1.326	50	20	IDGD	
CCOC(=O)c1ccc(F)c(S(=O)(=O)NNC(=O)COc2ccccc2OCC)c1	795281119	PNVNVORHYDVTGZ-UHFFFAOYSA-N	440.449	1.790	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2cccc(C)n2)cc(OC)c1Br	797371118	PEMAMCRCZORGMT-UHFFFAOYSA-N	437.250	1.569	50	20	IDGD	
Cc1ccccc1NC(=O)NNC(=O)c1ccc(F)c(S(=O)(=O)Cc2ncon2)c1	798310950	ZWNRYNRKTSELGP-UHFFFAOYSA-N	433.421	1.958	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCC(F)(F)C1)c1cccc(S(=O)(=O)N2CCOCC2)c1	799854287	KVCWUOWSRDARGQ-CQSZACIVSA-N	431.461	1.294	50	20	IDGD	
CC(C)(C)c1nnc2ccc(C(=O)NNC(=O)Nc3ccc(S(C)(=O)=O)cc3)cn12	802067206	PQEDFNODVUWRJJ-UHFFFAOYSA-N	430.490	1.897	50	20	IDGD	
COC(=O)c1c(F)cc(NC(=O)C(=O)NNC(=O)CSc2ccc(C)cc2)cc1F	802566448	QJFCFPQSXTVAAW-UHFFFAOYSA-N	437.424	1.938	50	20	IDGD	
COC(=O)c1c(F)cc(NC(=O)C(=O)NNC(=O)c2cccc3ncccc23)cc1F	802567350	SWHMRNHYZHEVRN-UHFFFAOYSA-N	428.351	1.699	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCCC(=O)NNc1ccc2c(=O)[nH]ccc2c1	803439366	CGZOFKBVPPAZRT-KRWDZBQOSA-N	443.504	1.877	50	20	IDGD	
COCCN(CCOC)S(=O)(=O)c1ccc(C(=O)NNc2cccc(F)n2)cc1	804768007	KIZXHASEBSWDIX-UHFFFAOYSA-N	426.470	1.261	50	20	IDGD	
CCc1nnc(NC(=O)[C@H](C)[C@H](C)NC(=O)NNC(=O)COc2ccc(C)cc2)s1	807565566	NHQSZMFYPHJXFN-OLZOCXBDSA-N	434.522	1.781	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNS(=O)(=O)c1nc(C)n(C)c1Br	808068557	CJEFOFMKLBQTJS-UHFFFAOYSA-N	447.311	1.278	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC([C@@H]2C[C@H]2C(=O)NNC(=O)CNC(=O)c2cccnc2)CC1	810571738	DEAJGANKDKWGSG-DLBZAZTESA-N	445.520	1.242	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)CNS(=O)(=O)c1cccc(C#N)c1	811461843	IBTQGRPMLPIURT-GFCCVEGCSA-N	436.877	1.105	50	20	IDGD	
Cc1nc(-c2ccccc2NC(=O)C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)no1	813034120	YLSITLYCYRTOLZ-UHFFFAOYSA-N	444.473	1.377	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)N[C@@H]1CCN(c2ccccc2F)C1	813856315	ZTCQWSUVKINIOF-MRXNPFEDSA-N	427.484	1.441	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NN=C1CCOC1(C)C)N(S(C)(=O)=O)CC2	814758447	AVKLDJIVFMDABA-HNNXBMFYSA-N	439.534	1.624	50	20	IDGD	
Cc1c(C=NNC(=O)CSc2nn(C)c(=O)n(C)c2=O)sc2c(Cl)cccc12	814784732	IQBTYMJDGPLUFT-UHFFFAOYSA-N	437.934	1.898	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)C(=O)Nc1nnn(CCOc2ccc(F)cc2)c1C	815567267	SJDWTQVBQVSJHO-UHFFFAOYSA-N	440.435	1.513	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(O)cc2)cc1S(=O)(=O)C1CCCC1	815582376	DVOHUDGMCAPFAA-UHFFFAOYSA-N	445.497	1.817	50	20	IDGD	
CN(Cc1ccccc1NC(=O)C(=O)NNC(=O)[C@@H]1CCc2nncn2C1)c1ccccc1	815691195	IAZYVHFUCXFKEJ-QGZVFWFLSA-N	447.499	1.263	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@H]2CCCO2)nn1-c1ccc(Cl)cc1Cl	815780298	SARLVTZFEYVAMV-CYBMUJFWSA-N	426.260	1.752	50	20	IDGD	
O=C(NNC(=O)c1cccc2oc(O)nc12)c1ccc(S(=O)(=O)N2CCCC2)cc1	816829990	MBCXFDOMCRDGQK-UHFFFAOYSA-N	430.442	1.393	50	20	IDGD	
CCOc1ccc(N2C[C@@H](C(=O)NNC(=O)CCN3C[C@H](C)O[C@H](C)C3)CC2=O)cc1	912924611	BTNCGCORRSEEOB-BBWFWOEESA-N	432.521	1.085	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cn(-c3ccccc3)nn2)c1	914748557	NGBNWEDXMSBGNP-UHFFFAOYSA-N	442.501	1.373	50	20	IDGD	
O=C(NNC(=O)c1cccc(NC(=O)c2ccc(Br)o2)c1)C(=O)NC1CC1	916040767	FDXOHUNJGQGLSZ-UHFFFAOYSA-N	435.234	1.334	50	20	IDGD	
O=C(NNC(=O)c1n[nH]c2c1CCC2)c1ccccc1NS(=O)(=O)c1cccs1	916148136	FHOVATKGSQVXLS-UHFFFAOYSA-N	431.499	1.836	50	20	IDGD	
CC(=O)Nc1cccc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1	916373515	HRWRZQLPARNUKE-UHFFFAOYSA-N	433.490	1.040	50	20	IDGD	
Cc1cccc([C@@H](CNC(=O)NNC(=O)COc2ccccc2C#N)N2CCOCC2)c1	916435832	OAUBGULFFXYDTI-HXUWFJFHSA-N	437.500	1.649	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)N(C)CC(=O)N2CCN(C)CC2)c(C)n1C[C@@H]1CCCO1	916558347	LHYCMMCJUYYSEC-OABJIQBASA-N	427.549	1.423	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)[C@@H](C)NC(=O)C1CCCC1	919353842	CXJCIVPYZKBQIO-LLVKDONJSA-N	425.869	1.348	50	20	IDGD	
CSCC[C@H](C(=O)NNc1nncc(N)c1Cl)N1C(=O)[C@H]2CCCC[C@@H]2C1=O	1116297421	MXBJDHLKAYFDLT-JBLDHEPKSA-N	426.930	1.452	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)c2ccccc2Cl)cc1F	1116421996	HVBIYFNLIQHCFJ-UHFFFAOYSA-N	435.886	1.864	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNS(=O)(=O)CCOc2ccc(F)cc2)CC1	1323169727	ULUVZEUDITXNNM-UHFFFAOYSA-N	445.513	1.802	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(CCN(C(=O)c3cncc4cnccc34)C2)C1	1780010868	OIUKKZJNSOURKB-IBGZPJMESA-N	433.306	1.858	50	20	IDGD	
Cc1nn(C)c(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](F)Br)C2)c1F	1780771365	ZYVDKVQLALZCJL-HYSWKAIVSA-N	449.296	1.686	50	20	IDGD	
CCOc1cnc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)cn1	1781326961	VOINPOWZZHONRN-CJNGLKHVSA-N	431.262	1.009	50	20	IDGD	
C[C@@H](C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)Br)C2)n1ccnn1	1781552138	JFWRVJVAFGFMLB-UMPJEAMMSA-N	428.331	1.136	50	20	IDGD	
CCOc1cccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](Cl)COC)CCO3)c1O	1781982286	KFMHUCGLRUGREV-FOIQADDNSA-N	426.897	1.488	50	20	IDGD	
COc1cc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](C)Br)C2)n(C)n1	1781996188	DPVDEULBTJMLIO-WPKBUWHJSA-N	443.342	1.340	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCc2cnccn2)C1	1782578639	SJWNJIDLFBZMDP-ZSZQSSIHSA-N	439.354	1.707	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccnc(Cl)n3)CCO2)C1	1783349352	KSTHOKXEJUPMJN-BDJLRTHQSA-N	431.718	1.747	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cn4cc(F)ccc4n3)CCO2)C1	1783533610	BMKRHJRSMFNMQK-KPZWWZAWSA-N	439.285	1.700	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]3C2)cn1C	1783965924	XDYVJFZZJDIRII-CSFVBSKPSA-N	426.355	1.958	50	20	IDGD	
O=C(CCc1c[nH]c2ccccc12)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21	1787069985	IGFVQJXNXBLBML-UHMOLFJZSA-N	433.936	1.680	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ncccc3Br)C[C@@H]21)[C@@H](F)Cl	1787448075	UFXJZDVCJIQZCD-JYYRZZBQSA-N	434.693	1.972	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)c3ccnc(F)c3)CCC2)cc1)c1cccc(B(O)O)c1	1788145166	QEUBNNOEJYKORD-UHFFFAOYSA-N	433.248	1.962	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC1(c2ccc(NC(=O)c3cnccc3C(=O)NN)cc2)CCC1	1789521752	IYAHFBXGDJOMIA-QGZVFWFLSA-N	445.907	1.687	50	20	IDGD	
C[C@@H](Sc1ccccn1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21	1791579674	SVXXIVJYBIODHX-CWVYHPPDSA-N	427.954	1.142	50	20	IDGD	
CCS(=O)(=O)N[C@@H](C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@](C)(Cl)CCl)C2	1793535770	DHSVQLZZNWOGSB-CQUYNDQOSA-N	428.382	1.189	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CSc1ccncc1	1794215996	XFLCRCNGIXMFTO-QDMKHBRRSA-N	440.529	1.124	50	20	IDGD	
N#Cc1ccc2[nH]nc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)CCBr)c2c1	1795115121	KUULGJJYVTYQCZ-FVCICTRLSA-N	446.305	1.423	50	20	IDGD	
O=C(Cc1ccc(C(F)(F)F)cc1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2	1795262306	CETGYSQCJBRFJI-YXPYIKCWSA-N	434.842	1.437	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CSc1ncccn1	1795836048	GCURJIIJFIDVSE-GUIRCDHDSA-N	443.367	1.189	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)c1ccc2cnccc2c1	1796191411	IFPOVDBIWUFPNV-KOUNCHBCSA-N	429.285	1.480	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnn2ccncc12	1797596762	CCKBHQXHTFCZCZ-LCFLCXBCSA-N	448.487	1.115	50	20	IDGD	
Cc1ccn2ncc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)CO[Si](C)(C)C)c2c1	1797955013	YXEOOAYPHKDJDG-CWPLJXCYSA-N	430.581	1.697	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN1C(=O)CSC1=S)C2	1798629971	ZJDWDXXZWCCOLP-CLLJXQQHSA-N	429.640	1.336	50	20	IDGD	
C[C@H](Oc1ccccn1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@](C)(Cl)CCl	1799278772	XNWMZWUTKLEIGJ-MABMQTIPSA-N	430.332	1.675	50	20	IDGD	
COc1ccc(OCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Br)cc1	1799343117	NWGBYILNSUWSGR-LZDSYCOUSA-N	445.285	1.354	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2)c1cccc(N2CCOCC2)c1	1799610982	OXAHTYVRBOYTEX-CYGHRXIMSA-N	425.888	1.261	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnc2ccc(F)cn12	1800064021	KNESNEGJWGMUOB-FIXGWNCBSA-N	443.306	1.913	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1=COCC1)C2	1800334095	HJBXRNFWOOYJEU-GKEMIQDWSA-N	429.423	1.766	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ncon1)C2)[C@H](Br)Cc1ccccc1	1800437236	SOAGTTUUWBYAKI-QKPAOTATSA-N	449.305	1.279	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1n[nH]c3ccc(C#N)cc13)C2	1800761881	IHBTVLYNYPJRSR-YGSHXTJESA-N	446.305	1.421	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(-n3cccn3)cc1)C2	1800977161	KGGCAUUXNBNPOS-NBMJBFSESA-N	432.908	1.329	50	20	IDGD	
Cc1cn2c(=O)c(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)C(Cl)Cl)cnc2s1	1801014763	CSVWWADTSHFQIA-PEGIJTEDSA-N	445.328	1.071	50	20	IDGD	
C[C@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](C)[C@@H]1SC(=N)NC1=O)C2	1801961186	FXXQDFUZTWMCCM-OWSRUXPGSA-N	431.356	1.210	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)COc1ccc(C(=O)OC)cc1	1802229975	IJGIANCZKUNOBF-LORHWOILSA-N	438.908	1.459	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H]2C[C@H]2C[C@@H]1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](O)CCl)C2	1804392589	KCPJBXKFWXFARO-FVSVBAFRSA-N	441.956	1.622	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2cccn2C)[C@@H]1c1cccnc1	1805358964	SBHNGDHPYIITLY-UTKZUKDTSA-N	426.521	1.113	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC2(CCN(C(=O)CN3C(=O)C=CC3=O)CC2)C1	1805389159	KABRVHUAUPADHO-AWEZNQCLSA-N	440.338	1.174	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)c2cnc[nH]2)[C@@H]1c1cccnc1	1805571101	FSOTVUBNZDFTQE-ULJMSJBCSA-N	448.487	1.258	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC2(CCCN(C(=O)[C@@H]3CCc4ccoc4C3)C2)CC1	1805703602	XCWHLYIQEBNMQN-LJQANCHMSA-N	444.576	1.989	50	20	IDGD	
C=CCC(CC=C)C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1807365413	OWFFIWAKVGTNSN-FYYLOGMGSA-N	447.344	1.849	50	20	IDGD	
Cc1noc(CC(=O)NC[C@H]2CCN(C(=O)CCBr)[C@H]2c2cccnc2)n1	1807523139	VNUJPWXYMYQJAA-KDOFPFPSSA-N	436.310	1.807	50	20	IDGD	
CN1CCN(C2(C(=O)N3CC[C@H](CNC(=O)[C@H](F)Cl)[C@H]3c3cccnc3)CC2)CC1	1808314147	CPOGOQLHFYYMPL-KURKYZTESA-N	437.947	1.402	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)CO[Si](C)(C)C)[C@@H]1c1cccnc1	1808430788	KIMPCZIQZRCBMS-MOXGXCLJSA-N	434.613	1.806	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC2(CCCN(C(=O)c3ccon3)C2)CC1	1808728276	LNFMTLZHBLDYKD-HZHRSRAPSA-N	426.477	1.653	50	20	IDGD	
O=Cc1ccc(C(=O)N2CCC3(CCCN(C(=O)c4ccc(B(O)O)cc4)C3)CC2)s1	1809967039	PQFZWUPMRFFWFU-UHFFFAOYSA-N	440.330	1.399	50	20	IDGD	
O=C(CCCc1cccnc1)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1	1809980549	VOPGAPUMYUTKSZ-UHFFFAOYSA-N	449.360	1.629	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)[C@H](O)Cc2ccccc2)[C@H]1c1cccnc1	1812773566	UNUJJDDHCFEJBK-PLACYPQZSA-N	445.947	1.945	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2[nH]nc3ncccc23)[C@@H]1c1cccnc1	1813029900	BALQJQNSUUZNNH-UWWQBHOKSA-N	442.907	1.926	50	20	IDGD	
C[C@H](C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1)n1cccc1	1813315860	QDCOOFXGOWPAPL-LZNRXBQRSA-N	440.548	1.523	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H]2CCC(=O)NC2)n[nH]1	1814519044	YJBMBWOECMOFEH-YRGRVCCFSA-N	440.342	1.959	50	20	IDGD	
CC(C)(CCl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CNCP(=O)(O)O)[nH]n1	1814693828	DMUKKXMGEZDWCQ-GFCCVEGCSA-N	435.849	1.392	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H]2CNC(=O)O2)n[nH]1	1815276070	XNTIMKMRCXQVAY-USWWRNFRSA-N	428.287	1.541	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CN2CCOCC2)n[nH]1	1817148759	CMOLTXSBKOFPMG-KBXCAEBGSA-N	432.352	1.970	50	20	IDGD	
O=C(CC1CCOCC1)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1817164229	FTZPGOMFAZBMLC-LJQANCHMSA-N	440.309	1.212	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)CCc2ccc[nH]2)[nH]n1)c1ccc(B(O)O)cc1	1817470939	AHSIJNQUCVBBGD-LJQANCHMSA-N	435.293	1.356	50	20	IDGD	
CN1CCN(CC(=O)Nc2cc([C@@H]3CCCCN3C(=O)[C@@](C)(Cl)CCl)[nH]n2)CC1	1818913791	MOEKLOLULQLKMM-KXBFYZLASA-N	445.395	1.886	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H]2CCC=CO2)n[nH]1	1819375544	WESSIAZYWUUOHY-DLBZAZTESA-N	439.476	1.407	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H]2[C@H]3SC=C[C@H]32)n[nH]1	1821710584	AZRRQOUWGPPNPN-BXOLDHOESA-N	432.550	1.650	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](F)Cl)CC2)c1cnc2c(c1)CCNCC2	1824640220	QOAFKWZQTMKWGN-LRDDRELGSA-N	437.928	1.987	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H]1CCNC(=O)C1)CC2	1825647234	LEXNBORUSRUDFI-AEJSXWLSSA-N	429.340	1.365	50	20	IDGD	
COc1ccc(C(=O)N[C@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)cc1	1826088676	JBAKUJVKNJDTOO-AWEZNQCLSA-N	445.545	1.751	50	20	IDGD	
O=C(c1nccs1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827051405	XKFRMKFIUTYLHQ-SFHVURJKSA-N	427.335	1.370	50	20	IDGD	
O=C(c1[nH]cc2c1CCC2)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827057899	MLERSZLYRMNDRA-QFIPXVFZSA-N	449.360	1.730	50	20	IDGD	
O=C(Cn1cccc([N+](=O)[O-])c1=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](F)Cl)CC1	1827615187	XHCIMAVRPJGLCN-WMLDXEAASA-N	442.875	1.911	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)Cn3cc(C)c(O)nc3=O)sc2C1	1827994950	WBFYNEBNLPLJDR-WDEREUQCSA-N	439.925	1.343	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)[C@H]3CCCSC3)sc2C1	1828160810	NJMBRZQYQZUHJJ-QWHCGFSZSA-N	439.607	1.571	50	20	IDGD	
CCc1nc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)co1	1829389177	XWPAFEHXKQDFQW-SFHVURJKSA-N	433.553	1.843	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)COc3ccc(O)cc3)C2)C1	1830354291	WBFIKYODQAQGRK-NRFANRHFSA-N	440.924	1.492	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@](C)(O)C(F)(F)F)C2)C1	1830358150	MMHKEFKOHJCKQJ-CVEARBPZSA-N	430.851	1.021	50	20	IDGD	
Cc1ncc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)s1	1830370059	HIYMZPLOKSNBPO-IBGZPJMESA-N	429.970	1.715	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](O)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@H](F)Cl)CC1	1830667993	QMOUNJWWWGEGFS-SOUVJXGZSA-N	435.924	1.984	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H]3CCCCN3C)CCO2)C1	1830775302	LPHKCQCUCYBQNY-JTDSTZFVSA-N	446.386	1.101	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccnc3OC)C2)C1	1831643801	HAKLBSFKPIJXFL-UZLBHIALSA-N	425.913	1.568	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CNC(=O)OC(C)(C)C)C2)C1	1831657990	RVIWUNWHWINIIQ-MGPUTAFESA-N	447.960	1.375	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(O)cc2)CC1	1831874257	KZNKPHRDFGRJEB-HXUWFJFHSA-N	430.549	1.999	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](CC)NC(C)=O)CC2)CC1	1833093878	OECIPCRYIVEIER-RBUKOAKNSA-N	429.005	1.880	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)Cc3cc(C)n(C)n3)CC2)CC1	1836772406	PZWATNRQIZWJCE-IBGZPJMESA-N	440.972	1.523	50	20	IDGD	
O=C(CS[C@@H]1CCCCO1)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1837510633	OXLSKRHUXVEQBJ-PBHICJAKSA-N	441.377	1.506	50	20	IDGD	
Cn1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)c(C(F)(F)F)n1	1837960770	TXVYOMXJFIAVPY-IUODEOHRSA-N	442.797	1.043	50	20	IDGD	
N#Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)cc1	1838953321	YPYFEGKBRLUBDI-CRAIPNDOSA-N	440.269	1.319	50	20	IDGD	
O=C(c1ccccc1O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839197639	CQYPRRCHVLCUAB-YOEHRIQHSA-N	431.258	1.153	50	20	IDGD	
O=C1CCc2ccc(C(=O)N3CCO[C@@]4(COCCN(C(=O)C(Cl)Cl)C4)C3)cc21	1839530243	GGVPLHPMTSQRQZ-FQEVSTJZSA-N	441.311	1.689	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc4ccoc34)C2)C1	1840154754	FNKNVBXTBRUURF-UWJYYQICSA-N	436.892	1.757	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(C)c(F)c3F)C2)C1	1840156867	WWZXISPRVDYFRH-MGPUTAFESA-N	446.878	1.597	50	20	IDGD	
O=C(c1nccc2[nH]ccc12)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840187791	WYPNHSFDQJRQJE-GOSISDBHSA-N	427.288	1.437	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3cc(F)ccc3OC)CCO2)C1	1840250746	MMCGQJGOHGUXJW-LAUBAEHRSA-N	442.915	1.851	50	20	IDGD	
Cc1cnn([C@@H](C)C(=O)N2CCO[C@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)c1	1840404724	BORPLDSDVCDFDW-PXNSSMCTSA-N	438.601	1.060	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC2(CCCN2C(=O)CCc2cnc[nH]2)C1	1842001454	AVOGHPIXLFNRNN-HNNXBMFYSA-N	439.944	1.678	50	20	IDGD	
O=C1CCCN1CC(=O)N1CCCC12CN(C(=O)[C@@H](Br)Cc1ccccc1)C2	1842831699	HWSVOHXISXYDJG-KRWDZBQOSA-N	448.361	1.818	50	20	IDGD	
O=C([C@@H](O)CCl)N1CC2(CCCN2C(=O)c2cc3cc(Br)ccn3n2)C1	1844147902	GSZOCBXXXAYMFA-AWEZNQCLSA-N	441.713	1.514	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)Cn1ccc(C)n1)C2	1844692221	VZSSNOFTEUMFNU-UHFFFAOYSA-N	441.444	1.542	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC2(CCCN2C(=O)[C@@H]2CC[C@@H]3CCC(=O)N3C2)C1	1845068853	UDTBGSBPURDPDM-RBSFLKMASA-N	426.355	1.622	50	20	IDGD	
COc1c(Br)cccc1C(=O)N1CCCC12CN(C(=O)[C@@H](O)CCl)C2	1845324404	LWRXQWXWDQXNGB-ZDUSSCGKSA-N	431.714	1.874	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@H](CC(=O)OC)NC(=O)OC(C)(C)C)C1	1846213100	OYSLUFITJIMWSI-KGLIPLIRSA-N	445.944	1.664	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1ccc2c(c1)n(C)c(=O)n2C	1847501080	LUDBSOMHHRFVPN-KCXAZCMYSA-N	449.349	1.723	50	20	IDGD	
COCc1c(C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)oc2ccccc12	21900240	CTLLMFWMXFGGQM-UHFFFAOYSA-N	445.497	1.969	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCC([C@@H](O)c3ccccc3)CC2)cc1OC	109094256	ZSTZFHHHWPAYCK-QFIPXVFZSA-N	427.501	1.910	50	20	IDGD	
C[C@H]1CCCC[C@]12NC(=O)N(CC(=O)NNc1ccc(S(=O)(=O)NC3CC3)cc1)C2=O	726867217	BCVPDIFQXYAYPV-RBZFPXEDSA-N	449.533	1.071	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cccc(C(=O)N(C)C)c2)cc1OC	728643524	ZFJXWQYMRYPVTQ-UHFFFAOYSA-N	429.429	1.024	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)[C@H]1CCCN1C(=O)c1ccc(Br)cc1	728852495	CTCUMAJUDOICLT-MRXNPFEDSA-N	431.290	1.839	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)c2ccc(S(N)(=O)=O)s2)c1	729371020	FZTMXQNUJRJWBX-UHFFFAOYSA-N	434.293	1.241	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)NCc2cccnc2N2CCC(C(N)=O)CC2)cc(C#N)n1C	729377047	WHZIBAFWPDZFJK-GRSHGNNSSA-N	431.500	1.525	50	20	IDGD	
Cc1cc(S(C)(=O)=O)c(C)c(S(=O)(=O)NNC(=O)CCc2ccccc2O)c1	730203649	VHSAPSOPCUANEI-UHFFFAOYSA-N	426.516	1.355	50	20	IDGD	
O=C(NNC(=O)[C@@H](Oc1ccc(F)c(F)c1)c1ccccc1)N[C@H]1CCS(=O)(=O)C1	730536845	WGJAHRMFJNDOPF-GUYCJALGSA-N	439.440	1.602	50	20	IDGD	
CCS(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c1	731459810	MFYCDOPYMOREQH-UHFFFAOYSA-N	444.918	1.612	50	20	IDGD	
Cc1c(C(=O)NNC(=O)Cn2cnc3ccccc32)nnn1-c1cccc2cccnc12	731470079	MXNOWQXFVSZFFL-UHFFFAOYSA-N	426.440	1.935	50	20	IDGD	
N#CC1(C(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)CCOCC1	731487239	GZSRQENDHWQBRV-UHFFFAOYSA-N	442.497	1.246	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)N1CCN(S(=O)(=O)c2ccc(Cl)s2)CC1	731848867	OVMMHMSTBBQPBG-LBPRGKRZSA-N	436.987	1.290	50	20	IDGD	
COc1ccc(CN2C(=O)c3ccccc3C2=O)cc1C(=O)NNC(=O)c1c[nH]nc1C	731851708	PVZPIEKVYTVVCQ-UHFFFAOYSA-N	433.424	1.598	50	20	IDGD	
O=C(COC(=O)[C@@H]1CCN(c2ccc(F)cc2)C1=O)NNC(=O)c1cccc([N+](=O)[O-])c1	732329660	LFBCIPZQMNSVRS-MRXNPFEDSA-N	444.375	1.091	50	20	IDGD	
CCN1CCCC[C@H]1CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(CC)CC)c1	732470669	FAMTUXFYOLNVLN-KRWDZBQOSA-N	439.582	1.536	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)NCCC(=O)NNc2ccc(Br)nc2)cc1	732836081	GBCGDQAEVNTCHG-UHFFFAOYSA-N	441.307	1.858	50	20	IDGD	
CN(C)c1ncc(Br)cc1C(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	733250896	IQARYFYNTWEAPK-UHFFFAOYSA-N	445.277	1.232	50	20	IDGD	
CCS(=O)(=O)C[C@H](C)NC(=O)NNC(=O)COc1ccccc1Cc1ccccc1	733660145	MTRYHVDTINQVFJ-INIZCTEOSA-N	433.530	1.810	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)CCN2C(=O)CCc3ccccc32)n1	738873271	DANKNOOOVZZHFL-UHFFFAOYSA-N	430.486	1.054	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cc(O)nc3cc(F)ccc23)cc1OC	740255470	NFFGPOJAYYZOMY-UHFFFAOYSA-N	443.387	1.715	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)c2ccc(C[C@@H]3CC(=O)NC3=O)cc2)cc1OC	741144668	YVZRMSLHOGQPGY-QGZVFWFLSA-N	439.468	1.764	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CSc1nnc(C2CCOCC2)n1N	742456268	GOECHUNONRUXJS-UHFFFAOYSA-N	440.913	1.101	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)CN(C)c2ccccc2[N+](=O)[O-])c2ccccc2c1=O	742475121	VXZUZAICBVAWCN-UHFFFAOYSA-N	438.444	1.612	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)c2cn([C@@H]3CCS(=O)(=O)C3)nc2C(C)C)cc1	742477406	PKBZBXWJGPGXQG-OAHLLOKOSA-N	434.518	1.515	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1ccc(Cl)c(N2CCNC2=O)c1	742635151	FMTQFVTWPFXEML-UHFFFAOYSA-N	443.895	1.337	50	20	IDGD	
CN(C)[C@@H](CNC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)c1ccc(F)cc1	743620564	BTKLYIQAALDOTC-KRWDZBQOSA-N	437.497	1.868	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)COc2ccc3ccc(=O)oc3c2)cc1	743830272	ARXWEGXFYNOTLW-UHFFFAOYSA-N	431.426	1.428	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)[C@H](C)N2C(=O)[C@H]3[C@H]4CC[C@@H](O4)[C@@H]3C2=O)c1	744352178	ULEMCRIHBIDMSO-XFUZISPGSA-N	443.500	1.196	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)CN2CCC(C(=O)Nc3cccc(C#N)c3)CC2)cc1	744393419	OHXKEBPNRAEKAL-UHFFFAOYSA-N	430.468	1.542	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)CCS(=O)(=O)c2ccc3c(c2)CCC3)c1	744738488	ZCWJECGUJYJECF-UHFFFAOYSA-N	444.509	1.652	50	20	IDGD	
Cc1c(Br)cccc1C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	745521137	QRIXTPKBUVLAKC-MRXNPFEDSA-N	449.257	1.902	50	20	IDGD	
CN1CCN(c2ccc(C(F)(F)F)cc2CNC(=O)NNC(=O)c2cnn(C)c2)CC1	745850800	WHYMVTYGVFFHGY-UHFFFAOYSA-N	439.442	1.335	50	20	IDGD	
N#Cc1cccc(NC(=O)CSc2ccccc2C(=O)NNC(=O)N2CCOCC2)c1	745993075	WORBRXNVFROUBK-UHFFFAOYSA-N	439.497	1.976	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)Cc2cc(C)on2)c1	746092969	HKIYDDNDRSYJSL-UHFFFAOYSA-N	444.469	1.796	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)C[C@H](C)C(=O)c2cccc(F)c2)cc1	746093769	MBQZAZKKTCGVEE-HNNXBMFYSA-N	449.504	1.811	50	20	IDGD	
COC(=O)c1ccsc1N1CC[C@H](NC(=O)NNC(=O)COc2cccc(C)c2)C1=O	746780048	LYJIXGINEIRLSA-HNNXBMFYSA-N	446.485	1.358	50	20	IDGD	
O=C(NCCOc1ncccc1C(F)(F)F)NNC(=O)c1nnc(O)c2ccccc12	747446751	FTFHTQFEJSSEKD-UHFFFAOYSA-N	436.350	1.772	50	20	IDGD	
C[C@H](c1ccc([S@@](C)=O)cc1)N(C)C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	747491350	UAKGIYVPGATPST-BRRNQIAESA-N	427.490	1.447	50	20	IDGD	
Cc1nn(-c2cccc(C(F)(F)F)c2)c(C)c1C(=O)C(=O)NNc1nccn(C)c1=O	747941792	OQBQFWAFZVEQTR-UHFFFAOYSA-N	434.378	1.928	50	20	IDGD	
O=C(Cc1ccc(NC(=O)c2cc3ccccc3o2)cc1)NNC(=O)C(=O)N1CCCC1	748239221	GGJQWLRMGQQIMX-UHFFFAOYSA-N	434.452	1.997	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CC[C@@H](NC(=O)OC(C)(C)C)C[C@H]2C)n1	749476239	WTLQICBCBNLOIO-ZIAGYGMSSA-N	425.555	1.519	50	20	IDGD	
NS(=O)(=O)c1ccc(Br)c(C(=O)NNC(=O)c2cc3ccccc3o2)c1	749479022	WALOGYBBIIOHDQ-UHFFFAOYSA-N	438.259	1.918	50	20	IDGD	
CN1CCN(C(=O)c2ccc(CNC(=O)NNC(=O)c3cc4ccccc4o3)cc2)CC1	749548236	RWKHDWYAOIFBFY-UHFFFAOYSA-N	435.484	1.965	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)[C@H](Cc2c[nH]c3cc(F)ccc23)NC(C)=O)cn1	750305322	GCIPOCBSGVTKPY-KRWDZBQOSA-N	444.492	1.776	50	20	IDGD	
CC[C@H](C)C(=O)N1Cc2ccccc2C[C@H]1C(=O)NNC(=O)[C@H]1COc2ccccc2O1	751291898	YQWREXFRINGNDE-UQASEVPWSA-N	437.496	1.973	50	20	IDGD	
CN1C(=O)c2cccc3c(S(=O)(=O)NNC(=O)CNC(=O)c4cccs4)ccc1c23	753778911	QVVGPCXDUNHPOE-UHFFFAOYSA-N	444.494	1.231	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NN=Cc1cnc(N2CCOCC2)s1	755480331	AFZFNOQTCHZHFA-UHFFFAOYSA-N	428.562	1.642	50	20	IDGD	
CN1CCC/C1=N/S(=O)(=O)c1cccc(NC(=O)NNC(=O)c2ccccc2O)c1	756027927	ABKQPPGKHAMEPB-QJOMJCCJSA-N	431.474	1.672	50	20	IDGD	
CN1CCC/C1=N\S(=O)(=O)c1ccc(NC(=O)NNC(=O)c2cccc(C#N)c2)cc1	756073763	SJTACBXXUCROSC-XIEYBQDHSA-N	440.485	1.838	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)Nc1cc(C(=O)N2CCOCC2)ccc1OC	756256321	HEEUYUFRPRAJSW-UHFFFAOYSA-N	442.472	1.572	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)Nc2ccc(OC)c(-n3nnnc3C)c2)cc1OC	756317823	BXYSUDFIKYEURI-UHFFFAOYSA-N	441.448	1.853	50	20	IDGD	
COc1ccc(Sc2ccc(NC(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)cc2)cc1	756354738	CETAZXMRSIYWFJ-GFCCVEGCSA-N	438.531	1.937	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccc(O[C@H]3CCOC3)cc2)c1	756683812	VWUYVUDHKNPPQD-KRWDZBQOSA-N	448.501	1.571	50	20	IDGD	
CCC(=O)c1cc(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)ccc1F	756867469	MYPHEIQJCSZORO-UHFFFAOYSA-N	427.841	1.794	50	20	IDGD	
C[C@H](C#N)Oc1ccccc1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	757977256	IOGOPKPMBVMKJS-CYBMUJFWSA-N	431.474	1.694	50	20	IDGD	
Cc1ccc(-n2ncc(C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)c2C2CC2)cc1Cl	758035878	OFIXCBBKIDNFLO-LLVKDONJSA-N	439.925	1.410	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)c(C)n1C1CCCCC1	758039141	HTTSLWUYQKIYJY-SWEABUAFSA-N	435.550	1.602	50	20	IDGD	
COC(=O)[C@H](C)Oc1ccc(C=NNC(=O)c2sc(N3CCOCC3)nc2C)cc1	758364651	HNTWWDRKVJONLZ-AWEZNQCLSA-N	432.502	1.992	50	20	IDGD	
CN(NC(=O)c1ccc(S(C)(=O)=O)cc1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758782039	LLUDIFUYZXMJFT-UHFFFAOYSA-N	440.522	1.339	50	20	IDGD	
C[C@@H]1CN(S(=O)(=O)c2cccc(C(=O)NNc3ncccc3[N+](=O)[O-])c2)C[C@@H](C)O1	759300339	BTWUZNHUFURNSP-CHWSQXEVSA-N	435.462	1.545	50	20	IDGD	
Cn1nc(CNC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c2ccccc21	760173663	HMNHYVJLRQULFJ-UHFFFAOYSA-N	435.532	1.616	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)c1cnn(CC(=O)NC2CCCCC2)c1	760438140	RRYNIMNLANBMBC-UHFFFAOYSA-N	436.513	1.008	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)cc(OC)c1OC	763337672	ZGIDJGXGPQURLO-UHFFFAOYSA-N	441.400	1.881	50	20	IDGD	
COC(=O)C(C)(C)c1ccc(NC(=O)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1	763472498	VBZMPSGUJMDIBE-UHFFFAOYSA-N	428.401	1.445	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)N[C@@H]1CCCC[C@H]1N1CCOCC1	763526768	PAWXOACMVIENKR-HZPDHXFCSA-N	427.546	1.265	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)C(=O)Nc1c(F)cc(F)cc1F	763529456	BOLWCRVJIZLHQF-UHFFFAOYSA-N	449.433	1.402	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)C(=O)Nc1ccccc1CN1CCSCC1	763550769	GPRSYAVVLODORW-UHFFFAOYSA-N	442.497	1.364	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)C2CC2)c(C(=O)N2[C@@H](C)CCC[C@H]2C)cc1OC	763558373	NVJNKHZBFJGJAK-BETUJISGSA-N	446.504	1.603	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2ccc(N3CCO[C@H](C)C3)cc2)c1	763646818	KBMFQYNRYLVOQD-QGZVFWFLSA-N	440.500	1.693	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc2c(c1)CC(C)(C)O2	763679698	CIJFWWHCBQKSHJ-UHFFFAOYSA-N	427.457	1.964	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2cnc(Br)c(C)c2)c1	763774860	HVDLPFJZHJRYJO-UHFFFAOYSA-N	437.250	1.569	50	20	IDGD	
Cc1ccc(-c2ncco2)cc1NC(=O)C(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	763791830	ZBWAQNFQKPBAJJ-UHFFFAOYSA-N	446.423	1.297	50	20	IDGD	
Cc1c(I)cccc1C(=O)NNC(=O)CNC(=O)c1cccnc1	763824305	HMAHSMWFPXYPJW-UHFFFAOYSA-N	438.225	1.186	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)cc1	763838637	ARKHMPLDFZGCAH-HNNXBMFYSA-N	443.456	1.409	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)NNC(=O)C(=O)Nc1ccc(CN2CCCC2=O)cc1	763860056	AMXRWJJJFDVQNQ-UHFFFAOYSA-N	433.468	1.619	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1ccnn1CCc1ccccc1	764007085	ZJWUOTOCHOOUEM-UHFFFAOYSA-N	435.440	1.297	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(OCC3CCOCC3)cc2)c1O	764131567	IHVNGLKKPSNROG-UHFFFAOYSA-N	443.456	1.606	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2O1)C(=O)Nc1cc(C2CC2)nn1-c1ccccc1	764151964	BAQHSXJCNCQFMD-IBGZPJMESA-N	431.452	1.839	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)CCc2ccccc2)ccc1-n1nnnc1C(C)C	764192847	PRSUWNUHHJQYHD-UHFFFAOYSA-N	435.488	1.813	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1ccc(C(=O)Nc2ccccc2)cc1	764277866	JOGHWKAZSBTYAX-UHFFFAOYSA-N	448.435	1.809	50	20	IDGD	
O=C(Cc1cc[nH]n1)NNC(=O)C(=O)Nc1ccccc1S[C@@H](Cl)C(F)(F)F	764293052	KXHUZSCSDIERJN-CQSZACIVSA-N	435.815	1.958	50	20	IDGD	
CC(C)S(=O)(=O)c1ccccc1NC(=O)C(=O)NNC(=O)COCc1ccccc1	764363988	YNPDKDAOYRJVLR-UHFFFAOYSA-N	433.486	1.171	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)cc1[N+](=O)[O-]	764384621	HBWLENOBVOCOQU-UHFFFAOYSA-N	430.402	1.455	50	20	IDGD	
COCCOc1ccc(C#N)cc1NC(=O)C(=O)NNC(=O)CSc1ccccc1O	764405135	QCXDJFFANMVXML-UHFFFAOYSA-N	444.469	1.167	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=S)NCCc1cccnc1	764518806	IQELPDOQGREEEM-UHFFFAOYSA-N	447.008	1.591	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@H](C)C(=O)NNC(=O)Nc1nc(CS(C)(=O)=O)no1	765246440	IJNWCHVXEDDDJM-SNVBAGLBSA-N	445.885	1.505	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)CCNS(=O)(=O)c3cccs3)n[nH]2)cc1	765571397	KUDNAHPWFGHRDE-UHFFFAOYSA-N	447.542	1.830	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)CN3C(=O)NC4(CCCCC4)C3=O)n[nH]2)c1	765577959	ZGHLJYFZMGGEOA-UHFFFAOYSA-N	438.488	1.709	50	20	IDGD	
O=C(NCc1nc2c(s1)C[C@@H](c1ccccc1)CC2)NNC(=O)C(=O)N1CCCC1	768516735	DEWCWHQYAAMQSP-HNNXBMFYSA-N	427.530	1.868	50	20	IDGD	
CNC(=O)Cn1ccc2ccc(NC(=O)NNc3c(OC)cccc3S(C)(=O)=O)cc21	769237830	AXQCZLVDHREKGN-UHFFFAOYSA-N	445.501	1.948	50	20	IDGD	
CCc1c(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cnn1-c1ccccc1OC	769457288	WXQFLGKYLSXDLB-UHFFFAOYSA-N	449.515	1.911	50	20	IDGD	
Cn1ccnc1[C@@H](NC(=O)NNc1nc(O)c2cnn(C)c2n1)c1ccc(Cl)cc1	770342829	JPFMFMLGTNOKFI-ZDUSSCGKSA-N	427.856	1.872	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)N[C@@H]3CCN(CC(F)(F)F)C3=O)nc21	770393153	BIJHNPADABYZLE-SECBINFHSA-N	430.391	1.076	50	20	IDGD	
CCOC(=O)N1CC[C@@H](NC(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)C1	771380661	WVRWHNCOMPSPMZ-CYBMUJFWSA-N	430.465	1.152	50	20	IDGD	
Cc1c(/C=C(\C#N)C(=O)NNC(=O)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)cc(C#N)n1C	773412476	WBKGGCCMTIRRAO-GFHWABCWSA-N	440.504	1.907	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNc2ccccc2[N+](=O)[O-])c(C(=O)N(C)C)cc1OC	773647811	CWDCLZZJTNLITR-UHFFFAOYSA-N	431.405	1.396	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc2c(c1)OCCCO2)NNc1cnc2ccccc2n1	774775351	LERHSWZKPAAJOL-UHFFFAOYSA-N	429.458	1.213	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)NOC2CCOCC2)cc1	775240954	MVRRGTUAPNEGCY-VBKFSLOCSA-N	439.472	1.568	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)Nc1ccnn1[C@@H]1CCS(=O)(=O)C1	776059667	QQBBOIMQQQJZGG-LLVKDONJSA-N	427.870	1.371	50	20	IDGD	
CN(NC(=O)C[C@@H]1OC(=O)c2ccccc21)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776201288	IDDSMBGOLMUVCA-INIZCTEOSA-N	432.477	1.924	50	20	IDGD	
Cc1oc(C(=O)NNc2cccc(S(C)(=O)=O)c2)cc1S(=O)(=O)N1CCCC1	776534798	WKZVZJZPQICQMH-UHFFFAOYSA-N	427.504	1.533	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)c1cccc([N+](=O)[O-])c1N1CCOCC1	776574818	TUUWFFMRPGZHGL-UHFFFAOYSA-N	432.458	1.690	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cccc(SC)c2[N+](=O)[O-])cc1OC	777080288	SUMKWTMAKFLLIG-UHFFFAOYSA-N	449.441	1.952	50	20	IDGD	
COC[C@H](C)n1ccc(NC(=O)C(=O)NNC(=O)c2ccc(OC(C)C)c(OC)c2)n1	778709895	MYGALAVVWCFRDU-ZDUSSCGKSA-N	433.465	1.286	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)N[C@H]1CC(=O)N(c2ccc(Cl)c(F)c2)C1	778717915	GIGPCZRIPVZJTG-JTQLQIEISA-N	443.863	1.440	50	20	IDGD	
CC(C)(C)OC(=O)NCC(F)(F)CNC(=O)NNC(=O)c1nnc(O)c2ccccc12	779670399	RWKQTGOBVWZUSB-UHFFFAOYSA-N	440.407	1.439	50	20	IDGD	
CC(C)(C)OC(=O)N1CC=C(CNC(=O)NNC(=O)COc2ccccc2C#N)CC1	779679312	BYUBFYYTCGEOJN-UHFFFAOYSA-N	429.477	1.835	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN(C)[C@H](C)c2ccc(-n3cncn3)cc2)cc1OC	780724091	AVFIWKCMJQWDKA-OAHLLOKOSA-N	438.488	1.739	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)N[C@@H]1CCCN(c2ccc(C#N)cc2)C1=O	780893901	GSTMPPWGCXRARU-QGZVFWFLSA-N	427.486	1.783	50	20	IDGD	
CC(=O)N1CCN(Cc2ccccc2NC(=O)C(=O)NNc2ccccc2[N+](=O)[O-])CC1	782125091	VGRXQUGMGQDTCX-UHFFFAOYSA-N	440.460	1.341	50	20	IDGD	
COC(=O)COc1ccc(C=NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cc1	782227852	AGUVUCVOBBWXFV-UHFFFAOYSA-N	438.484	1.147	50	20	IDGD	
COc1cc(F)c(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)cc1OC	782893636	KIHQSSUDRBVFGK-UHFFFAOYSA-N	429.408	1.058	50	20	IDGD	
COCC(=O)N1CCc2cc(NC(=O)C(=O)NNc3ncccc3C(F)(F)F)ccc21	783117725	HGCUABODNIWJGS-UHFFFAOYSA-N	437.378	1.718	50	20	IDGD	
O=C(NNc1ncnc2ccsc12)C(=O)Nc1ccc(CN2C(=O)CSC2=O)cc1	783254955	OHVCXTSZTUXJDC-UHFFFAOYSA-N	442.482	1.969	50	20	IDGD	
CCc1cc(Br)ccc1NC(=O)C(=O)NNC(=O)CNC(=O)c1ccco1	784004409	MTLBSMUKOJYMSH-UHFFFAOYSA-N	437.250	1.120	50	20	IDGD	
CN(C)C(=O)Cn1ccc(NC(=O)C(=O)NNc2ccc(Br)cc2Cl)n1	784841458	QVYMHZJXNKSJAB-UHFFFAOYSA-N	443.689	1.469	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2cccnc2Cl)cc1-n1nnnc1C1CC1	784842132	LFTVTEHNOLJABC-UHFFFAOYSA-N	428.840	1.679	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)C(=O)Nc2ccc(CCN3CCOCC3)cc2)c1	784855252	UKYIMNRNLRTNSJ-UHFFFAOYSA-N	426.473	1.430	50	20	IDGD	
CN(C)c1nccc(NNC(=O)C(=O)Nc2ccc(-c3noc(C(F)(F)F)n3)cc2)n1	784971079	SPESGIPHMIDTQD-UHFFFAOYSA-N	436.354	1.693	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)Nc1ccc(OC(F)(F)F)cc1	785024697	XZUPLHRUXQYPFZ-UHFFFAOYSA-N	428.279	1.599	50	20	IDGD	
Cn1cc(-c2ncccc2NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)cn1	786416566	GCERSEGBQZMKQT-UHFFFAOYSA-N	436.457	1.333	50	20	IDGD	
O=C(CCC(=O)Nc1ccc2nc(O)[nH]c2n1)NNC(=O)C(F)(F)Oc1ccccc1	787896870	PJSHOSUTPUSYDX-UHFFFAOYSA-N	434.359	1.201	50	20	IDGD	
CN(NS(=O)(=O)c1cn2c(n1)CCCC2)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	788914150	AVPMJXBACZFZHG-UHFFFAOYSA-N	442.542	1.017	50	20	IDGD	
COC(=O)c1cccc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)c1C	789815211	BUMTWCPFCGLRJB-WMZOPIPTSA-N	425.441	1.440	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NN=Cc2ccc(N(C)CCOC)nc2)c1	790141244	BAXQBYXDOKLRGB-UHFFFAOYSA-N	447.561	1.959	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NC[C@@H](C)NC(=O)OC(C)(C)C)nc1	792261231	DTWOBEUUEDIALL-GFCCVEGCSA-N	430.531	1.308	50	20	IDGD	
COC(=O)NNC(=O)c1cccc(NC(=O)C[C@H]2SC(N3CCCCC3)=NC2=O)c1	792608803	SNKLXIDXKXCLBC-CQSZACIVSA-N	433.490	1.500	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cnc(CC4CC4)nc3)n[nH]2)cc1C	793025637	NEPMWDMZFMCMCQ-UHFFFAOYSA-N	433.472	1.836	50	20	IDGD	
O=C(NNc1ccc2c(=O)[nH]ccc2c1)C(=O)Nc1ccc(N2CCOCC2)c(F)c1	793066718	XPIAPMWZTNDHIG-UHFFFAOYSA-N	425.420	1.586	50	20	IDGD	
O=C(CSc1nnc(O)nc1O)NN=CC1CCN(C(=O)OCc2ccccc2)CC1	797400804	PSDBUYBOPLAXIF-UHFFFAOYSA-N	446.489	1.526	50	20	IDGD	
COC(=O)c1cc(Cl)c(Cl)cc1NC(=O)C(=O)NNC(=O)c1cccc(C)n1	797538555	JZNVVNQIQBVVMA-UHFFFAOYSA-N	425.228	1.883	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C3=NO[C@H](CNC(=O)OC(C)(C)C)C3)n[nH]2)cc1	798895156	URASQDFOBLYMHM-AWEZNQCLSA-N	442.476	1.816	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(S(=O)(=O)CCCC#N)cc2)cc1	801106261	RJIGGXIGYIOANW-UHFFFAOYSA-N	428.470	1.472	50	20	IDGD	
CC(C)c1nnc2ccc(NC(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)cn12	801744140	RQFXQJLXLREUNG-UHFFFAOYSA-N	445.505	1.570	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(C)c(C(=O)NNC(=O)Nc2cc(F)cc(F)c2)c1	802007080	WFGKQTVSCMERLY-UHFFFAOYSA-N	442.444	1.664	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@@H](O)Cc2cccc(C(F)(F)F)c2)cc1	802063475	GNKPMOBGPBBJML-HNNXBMFYSA-N	445.419	1.865	50	20	IDGD	
CC(C)CSc1ccc(S(=O)(=O)NCC(=O)NN=c2cc[nH]cc2)cc1[N+](=O)[O-]	802574006	ABDQCDWUEBRJLL-UHFFFAOYSA-N	439.519	1.581	50	20	IDGD	
Cc1nc(O)c(Br)cc1C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C	802945284	ACMOTROHAUOJOZ-UHFFFAOYSA-N	431.287	1.924	50	20	IDGD	
Cc1ncsc1C(=O)NNC(=O)C(=O)Nc1ccc2nccnc2c1Br	806978998	PBJMIEXWEKLREW-UHFFFAOYSA-N	435.263	1.557	50	20	IDGD	
CNS(=O)(=O)c1cc(NC(=O)C(=O)NNc2ccc(OC(F)F)cc2)ccc1F	807005735	MUYOEXICLVDWNI-UHFFFAOYSA-N	432.380	1.417	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2cccc(F)n2)c(I)c1	807392630	UDCLPPCFZJFBGE-UHFFFAOYSA-N	430.177	1.916	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CN2CCCC[C@H]2COC(=O)NC2CCCC2)c1	810035278	NKABSYCYDZKDTJ-IBGZPJMESA-N	427.505	1.843	50	20	IDGD	
CCc1nc(C)c(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)o1	813876058	SZFVUARUZYQERV-UHFFFAOYSA-N	435.506	1.474	50	20	IDGD	
Cc1c(NC(=O)NNC(=O)[C@@H]2CCc3nncn3C2)cccc1S(=O)(=O)NC(C)(C)C	814647216	RLTVUZRNEDWAQF-CYBMUJFWSA-N	449.537	1.079	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cnn(C)c2I)cc1OC	814715375	SNBGVBUHEGPGAE-UHFFFAOYSA-N	430.202	1.117	50	20	IDGD	
CN(C/C=C\C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1)CC(F)(F)F	815734709	WCDRORQJBAWXEL-DAXSKMNVSA-N	436.456	1.201	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)CCNS(=O)(=O)/C=C\c2ccccc2)c1	825805380	CNYZQADBRBZXEC-QBFSEMIESA-N	432.502	1.235	50	20	IDGD	
C[C@@H]1CC(C)(C)C[C@]2(C1)NC(=O)N(CC(=O)NNC(=O)[C@H]1COc3ccccc3O1)C2=O	859428146	BUPOMHVJDZLSPD-XNVILDLWSA-N	444.488	1.111	50	20	IDGD	
C[C@@H]1CC(C)(C)C[C@@]2(C1)NC(=O)N(CC(=O)NNC(=O)COc1ccc(C#N)cc1)C2=O	864017026	JZLVHKYRKCZKAA-JLCFBVMHSA-N	441.488	1.221	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(-n2ncc(Cl)c(Cl)c2=O)cc1)c1ccc[nH]1	884507282	YXCUBWMTRWBBCG-UHFFFAOYSA-N	428.257	1.491	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Cn2c(C)nc3ccccc3c2=O)cc(OC)c1OC	913396418	IHZWMDCPWJUTGH-UHFFFAOYSA-N	426.429	1.192	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)c2ccccc2S(=O)(=O)N2CCOCC2)cc1C	915187976	CPYDZMYDOUCUFJ-UHFFFAOYSA-N	447.513	1.164	50	20	IDGD	
CN(CC(=O)NNC(=O)Cc1nc(-c2ccccc2)cs1)S(=O)(=O)c1cccnc1	916157836	RIAOCTUHZVMKAW-UHFFFAOYSA-N	445.526	1.216	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H](CN2CCOCC2)c2ccccc2)c1	916215007	VSYCEEFCAAAHEO-IBGZPJMESA-N	446.529	1.108	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NN=Cc1ccc(O)cc1)N(S(C)(=O)=O)CC2	916354542	DZIQSZSPAYBPOL-SFHVURJKSA-N	447.513	1.809	50	20	IDGD	
CCOc1ccc2cc(C(=O)OCC(=O)NNC(=O)[C@H]3COc4ccccc4O3)[nH]c2c1	917313166	OKDUHLZIZZIROW-LJQANCHMSA-N	439.424	1.711	50	20	IDGD	
CSC[C@@H](C(=O)NNC(=O)c1c(C)nc2ccccn12)N1C(=O)[C@H]2CCCC[C@H]2C1=O	917360469	ZHROOIAYHXADMY-ZNMIVQPWSA-N	443.529	1.311	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)[C@H]2CCN(c3ccc(Cl)cc3)C2=O)nc2ccccc21	919690370	RYEOCCFVTBYRIP-OAHLLOKOSA-N	425.876	1.970	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)N2CCC(=NNC(=O)Cc3cc(C)[nH]n3)CC2)cc1	920372104	UBQHIOYSROHRJY-UHFFFAOYSA-N	432.506	1.176	50	20	IDGD	
COc1cc(C=NNC(=O)[C@H](C)CN2CCOCC2)c([N+](=O)[O-])cc1OCC(F)(F)F	921256002	JFHOBERBTXHALK-GFCCVEGCSA-N	448.398	1.963	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2ccc3nnc(C(F)F)n3c2)c2ccccc2c1=O	1319099530	KSHVSIORSTUANA-UHFFFAOYSA-N	427.371	1.472	50	20	IDGD	
COCCn1cc(NC(=O)NNC(=O)c2cc(F)ccc2Br)ccc1=O	1342390056	WTOIGCFVRIJPEZ-UHFFFAOYSA-N	427.230	1.863	50	20	IDGD	
CC1(C)Cc2cccc(S(=O)(=O)NNC(=O)c3csc(N4CCOCC4)n3)c2O1	1344594290	IQAGTIOAKWRSQO-UHFFFAOYSA-N	438.531	1.317	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1nc3ccc(F)cn3n1)C2)[C@H](F)Cl	1778029515	NMWKUBYTQRWPJF-UVBSCNOISA-N	427.839	1.530	50	20	IDGD	
O=C(CCN1Cc2ccccc2C1=O)N1CC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1778187625	XRUFHILTEUCJHD-HXUWFJFHSA-N	440.327	1.666	50	20	IDGD	
Cc1nccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)CCBr)C3)n1	1778309514	KIPXSQNYWOQQIA-CRAIPNDOSA-N	425.327	1.698	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)Nc2ccccn2)C1	1779566721	KXLUFUPQCHEHMQ-ZGPJWRFFSA-N	438.956	1.650	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(-c4cccnc4)[nH]n3)C2)C1	1779611859	WCPXRZRBXRVVLV-YWZLYKJASA-N	433.896	1.169	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)c3cc4cc[nH]c4cc3F)C2)C1	1780161732	CCJBBTDRTBNOLF-QFIPXVFZSA-N	445.495	1.124	50	20	IDGD	
O=C(Cc1ccc2ncnn2c1)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(Cl)Cl)C2	1780551845	BWOYDILGDVSUBH-AUUYWEPGSA-N	440.331	1.589	50	20	IDGD	
CCOC(=O)/C=C/C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@](C)(Cl)CCl)C1	1780713206	MZASANJDVKSERB-YQKSZXILSA-N	435.348	1.856	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](N)c1ccccn1)C2	1780713578	ZAIWCJOAZCJUOQ-XNFNUYLZSA-N	443.375	1.832	50	20	IDGD	
C[C@H](C(=O)N1CCO[C@]2(CCN(C(=O)[C@](C)(Cl)CCl)C2)C1)n1ccccc1=O	1781229687	HZRAFRMTMMNZMQ-NIKGAXFTSA-N	430.332	1.476	50	20	IDGD	
COc1ccnc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@](C)(Cl)CCl)C3)C2)c1OC	1781232470	UYIKHOWCQCIVKS-MOPGFXCFSA-N	446.331	1.779	50	20	IDGD	
CC(C)N1CCC(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](F)Br)C3)C2)CC1	1781325493	DPUXQDHUUDDFBD-MAUKXSAKSA-N	434.350	1.627	50	20	IDGD	
O=C(c1ccc2cnccc2n1)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781329953	ONHFWIAUGLDFML-YJBOKZPZSA-N	437.269	1.764	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(Cl)Cl)C2	1781516205	LJOWDUHAMMKZNI-PSTGCABASA-N	425.309	1.866	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](CC)NC(C)=O)C2	1781897909	UQBHRNGTXBBXPB-YKTARERQSA-N	446.386	1.589	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccnc(OC)c1F)C2	1782170808	ZCAHSMMWMHVDEY-STXHMFSFSA-N	443.903	1.611	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnn4c3OCCC4)C2)C1	1782279434	KZFOUDQPHYMTCN-MSOLQXFVSA-N	431.320	1.345	50	20	IDGD	
O=C(c1ccnc2ncccc12)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1782343188	BFCBJCBQWFTBOJ-RDTXWAMCSA-N	437.269	1.764	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3cccc4nccn34)C2)C1	1782356885	ZKISJFPUZWYDMO-LIRRHRJNSA-N	435.322	1.809	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](N)c1ccccn1)CCO2	1783343336	TVJQQURPGIUHHP-YEWWUXTCSA-N	425.327	1.085	50	20	IDGD	
CCc1nn(C)c(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](C)Br)C3)C2)c1Cl	1783532990	VTQJCDGUFWVPGE-DIFFPNOSSA-N	447.761	1.863	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cncc4cnccc34)CCO2)C1	1783535622	AXGGHUZXZIOOEB-BFUOFWGJSA-N	433.306	1.857	50	20	IDGD	
O=C1Nc2c(cccc2C(=O)N2CCO[C@]3(CCN(C(=O)C(Cl)Cl)C3)C2)C1=O	1783946385	MFDRUOMFRSMVGH-SFHVURJKSA-N	426.256	1.069	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)[C@@H]1C[C@H]1c1ccc(F)c(F)c1	1784155056	MPRSOQDJWMIHTK-KHSMQWPDSA-N	442.890	1.648	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(CO)c(F)c3)C2)C1	1785268691	UIVIOXQVQSXQEI-OALUTQOASA-N	433.307	1.998	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3c(C)noc3C)[C@H]2C1	1785361541	MCVZIHIDFAGQMR-DKIMLUQUSA-N	427.929	1.458	50	20	IDGD	
COC(=O)c1ccc(OCC(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](F)Cl)CCO3)cc1	1785720479	YTEIOTUBSLIACQ-LPHOPBHVSA-N	428.844	1.216	50	20	IDGD	
CCCC(=O)N[C@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](Br)CC)C[C@@H]21	1788743994	OSXRRXQOWVBWNB-YXMSTPNBSA-N	446.386	1.444	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3(Br)CC3)C[C@@H]21	1788763516	KYBRLRZRKQWEHL-IHRRRGAJSA-N	433.419	1.745	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cn4nc(C)sc4n3)C[C@@H]21	1789858320	WCUVJBAERKYWSA-HNKHHVNMSA-N	439.969	1.639	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(C(N)=O)cc3)C[C@@H]21	1791064702	DYPZEVGWRJADEB-DDWPSWQVSA-N	438.322	1.162	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(-n4cncn4)c3)C[C@@H]21	1791257242	TZLJOHAVHHNOFX-KANFNMMFSA-N	447.923	1.114	50	20	IDGD	
C=CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C[C@@H]21	1791275847	LAXIPVVVZDSTAH-FNHZYXHNSA-N	431.445	1.690	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)Sc3ccccn3)[C@H]2C1	1791580777	QWWVVPUIXANGFK-WOYTXXSLSA-N	441.981	1.796	50	20	IDGD	
CC(=O)N[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)CBr)C(C)(C)C	1792868515	CBRDWJSBKPWWHI-HVQZGBDUSA-N	446.386	1.158	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccnc1CS(C)(=O)=O	1794721868	IAXXZDUWPSBBJT-HLPPOEQASA-N	427.954	1.895	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CNc2ccccc21	1795620405	NFENZTOWMKWTKR-ARULTKQDSA-N	436.350	1.816	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnc(N)s1	1796137719	BGZGWRPINDQMDD-PNEZKNQNSA-N	429.506	1.111	50	20	IDGD	
Cn1c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Cl)cc2c[nH]c3nccc-3c21	1796365929	GYPKSJYCLSMVGB-DJZPMSPPSA-N	433.871	1.744	50	20	IDGD	
C#CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Cl	1796369779	DLOKNDPMNVTGQH-AIEDFZFUSA-N	431.892	1.027	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2nonc2c1	1796882719	AOELAFUJEIIRCM-YGSHXTJESA-N	437.294	1.457	50	20	IDGD	
COc1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)nc1	1796892565	QNRHSANAXBXKKA-MVRRYPJTSA-N	438.488	1.476	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1nc2ccccc2[nH]1	1797339752	NQZLIPSPSOIOPN-CWNKPHDYSA-N	447.499	1.949	50	20	IDGD	
Cc1nnc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CO[Si](C)(C)C)s1	1797953012	YSYKVPZWWVSISJ-ZSBFGKGUSA-N	426.615	1.220	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnc(O)c2ccn(C)c12	1798427923	CRNCTHUKHGNNTO-DLTLXFJOSA-N	434.924	1.890	50	20	IDGD	
Cc1ccccc1CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnccc1C(=O)NN	1798442730	BAEKEUDPPSXGLG-REPLKXPHSA-N	435.528	1.878	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1[nH]cnc1-c1cccnc1	1798496055	MZHWNKCWGUNZBR-REBRKWNGSA-N	448.321	1.458	50	20	IDGD	
Cc1nnc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@](C)(Cl)CCl)s1	1799274015	ORRQMOFLJFBDON-RBNVPPIJSA-N	435.377	1.605	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c(c1)CCCO3)C2)[C@@H](F)Br	1799352464	XUHNYODPNIGHSP-YALNPMBYSA-N	441.297	1.905	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCc1cnccn1	1801404805	ZKUCRZOHZXFMOW-ZJOBFFGXSA-N	425.327	1.030	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@](O)(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](F)Cl)C3)C1	1802413458	NNQASKYHQPPKMM-ZRKYPZEGSA-N	433.908	1.531	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)CN2CC(=O)NC2=O)[C@@H]1c1cccnc1	1803686638	RGQVXRMGAVYFRD-RVKKMQEKSA-N	435.912	1.047	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(F)c(F)c(Cl)c1)c1ccc(B(O)O)cc1	1803804098	NUKYVMNFJWGFPC-MUJYYYPQSA-N	448.662	1.864	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@@H]1c1cccnc1)c1ccc[n+]([O-])c1	1804783589	HRMNPJACVHLVJC-NUEKZKHPSA-N	437.269	1.725	50	20	IDGD	
Cc1occc1C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1805619161	NVEQAEIIVZLTIM-UWJYYQICSA-N	427.505	1.676	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@@H](CNC(=O)CNCP(=O)(O)O)[C@H]1c1cccnc1	1807018787	QKCVTIYWBHKFQC-GOEBONIOSA-N	446.872	1.077	50	20	IDGD	
N=C(N)SCCC(=O)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@@H]1c1cccnc1	1807128787	GWDBHNDOLAFKRE-YUTCNCBUSA-N	446.346	1.795	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC2(CCCN(C(=O)c3n[nH]c(C4CC4)c3F)C2)CC1	1807784992	IWXHUJUOPSIIHI-UHFFFAOYSA-N	448.543	1.644	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2nn(C)c3c2CCC3)[C@@H]1c1cccnc1	1809367688	UOKHTIMWDBBGQW-KNBMTAEXSA-N	445.951	1.877	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@@H]1c1cccnc1	1810527275	BHHDSTWEVOHQIE-JMGFVUJMSA-N	441.301	1.469	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@H]1CCN(C(=O)c2ccnnc2O)[C@@H]1c1cccnc1	1810543621	DADAUVDRKSEVAQ-CRAIPNDOSA-N	429.553	1.748	50	20	IDGD	
COc1ccc(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)c(O)c1	1811749780	HYEGZXAYUVRQTD-ZOCIIQOWSA-N	433.892	1.715	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)c2ncnn2C)[C@H]1c1cccnc1	1812775065	PQZAAJLWXQNQLH-KKUMJFAQSA-N	435.326	1.703	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)Cc2ccccn2)[C@@H]1c1cccnc1	1813070034	CTTINRCEPBLWDU-WZONZLPQSA-N	438.532	1.098	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)c2n[nH]cc2[N+](=O)[O-])[C@@H]1c1cccnc1)C(Cl)Cl	1813079243	WPIUCLMMNZOUNW-ZWNOBZJWSA-N	427.248	1.836	50	20	IDGD	
CCNC(=S)NCC(=O)N1CC[C@@H](CNC(=O)C(Cl)Cl)[C@@H]1c1cccnc1	1813081136	JDQHIRXXMRYFAH-JSGCOSHPSA-N	432.377	1.375	50	20	IDGD	
CC(C)[C@@H](S)C(=O)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1	1815350258	MCOGZASEGOOKNJ-XJKSGUPXSA-N	433.364	1.003	50	20	IDGD	
Cc1n[nH]c(C)c1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1819663095	QMZVOXXSLKFARQ-KRWDZBQOSA-N	436.281	1.049	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](C)O)[nH]n1	1820167063	WBJOBBPNZIMUPY-BDJLRTHQSA-N	445.432	1.930	50	20	IDGD	
COc1ccnc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@H](O)CCl)CC3)c1OC	1821792965	BPOABTFJRCSFEI-MWLCHTKSSA-N	440.909	1.381	50	20	IDGD	
C[C@H](Br)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCc2nc(N)n[nH]2)[nH]n1	1822189492	UBNNZYUMAOUUQC-GXSJLCMTSA-N	439.318	1.518	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)C(=O)Nc2cccnc2)[nH]n1	1822368659	CAYHEGUNLUJEOO-UKRRQHHQSA-N	434.884	1.689	50	20	IDGD	
CCc1cc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)no1	1822414330	AZUXDXLQSUXSRH-MRXNPFEDSA-N	431.497	1.639	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H]2CC[C@H](O)CC2)[nH]n1	1822416517	GOCRBGJWJYIYJB-BFYDXBDKSA-N	434.541	1.326	50	20	IDGD	
COc1ccnc(C(=O)N2CCC([C@H]3CCCCN3C(=O)[C@@H](O)CCl)CC2)c1OC	1824184839	RYWHYVBGXCNBJM-CVEARBPZSA-N	439.940	1.932	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H](C)CS(C)(=O)=O)CC1	1824529071	YZFDYNJHWQTSLX-PVAVHDDUSA-N	437.002	1.541	50	20	IDGD	
CCS(=O)(=O)CC(=O)N[C@H]1CCc2nc(NC(=O)[C@H](C)Br)sc2C1	1825635396	FBZFYSKMJNMACC-IUCAKERBSA-N	438.369	1.273	50	20	IDGD	
Cc1cnn([C@@H](C)C(=O)Nc2nc3c(s2)C[C@H](NC(=O)CCC(=O)NN(C)C)CC3)c1	1826752984	WJQLZAAOGBRBPU-UONOGXRCSA-N	447.565	1.194	50	20	IDGD	
C[C@H](C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](F)Br)CC2)n1cncn1	1826799830	VZWJGJRKEUGQLA-SOCHQFKDSA-N	431.291	1.598	50	20	IDGD	
O=C(CCc1ccco1)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827049976	BJCWJYRIQQHIGB-JOCHJYFZSA-N	438.333	1.826	50	20	IDGD	
CC(C)C1(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2ccc(B(O)O)cc2)CC3)CCC1	1827394956	WLKAKOJRAFHBTB-MRXNPFEDSA-N	441.362	1.875	50	20	IDGD	
CNCCCC(=O)N1CCC([C@@H]2CCCCN2C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)CC1	1827681481	XMKPIBUZNYMUHX-UBYGEMSKSA-N	444.580	1.740	50	20	IDGD	
O=C(c1cnc(O)nc1O)N1CCC([C@H]2CCCCN2C(=O)[C@@H](F)Br)CC1	1830378402	MDXJRNIVWMIOLD-CHWSQXEVSA-N	445.289	1.812	50	20	IDGD	
O=C(Cc1ccc2ccccc2c1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1830724886	JEAOIBQTDMGFDE-OFNKIYASSA-N	446.931	1.438	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC([C@@H]2CCCCN2C(=O)Cn2ccncc2=O)CC1	1831107314	IUCYFCRDYCNUBK-HOCLYGCPSA-N	439.354	1.646	50	20	IDGD	
CN(C)c1cccc(OCC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)c1	1832526929	GVQBQONRMVXVAI-QUCCMNQESA-N	443.903	1.122	50	20	IDGD	
CC(C)(C)[C@@H](O)C(=O)NC1CCN(C2CCN(C(=O)CO[Si](C)(C)C)CC2)CC1	1833286612	PNKGZGYYCNWPMW-IBGZPJMESA-N	427.662	1.817	50	20	IDGD	
Cc1cc(CCC(=O)N2CCC(N3CCC(NC(=O)[C@@H](O)CCl)CC3)CC2)ccn1	1833308280	PFRZGTJZWZJWDR-FQEVSTJZSA-N	436.984	1.494	50	20	IDGD	
Cc1ccc2oc(C(=O)N3CCC(N4CCC(NC(=O)[C@@H](O)CCl)CC4)CC3)cc2n1	1833310240	DZEKKIKWHXVZQX-SFHVURJKSA-N	448.951	1.921	50	20	IDGD	
CN(CC(=O)NC1CCN(C2CCN(C(=O)[C@@H](F)Cl)CC2)CC1)C(=O)OC(C)(C)C	1834553291	LCAZDHLVIIJLFP-QGZVFWFLSA-N	448.967	1.959	50	20	IDGD	
CC(C)(C)NCC(=O)NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1834698827	RNJNLDVUULZARO-MRXNPFEDSA-N	435.382	1.637	50	20	IDGD	
C[C@H](C(=O)NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)n1cccc1C=O	1834805605	QIPXUXNEYWJBMV-DNVCBOLYSA-N	438.956	1.033	50	20	IDGD	
O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)Cc1ccccc1F)CCO2	1835003509	OHYLUPXORBADPE-IBGZPJMESA-N	443.313	1.610	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)CCC(F)(F)F)CCO2)C1	1835319134	ODMCEAMZUDYBFR-WFASDCNBSA-N	445.276	1.816	50	20	IDGD	
C=C[C@H](O)C(C)(C)C(=O)NC1CCN(C2CCN(C(=O)[C@H](C)Br)CC2)CC1	1835717596	FDVSADCRIMNHHC-YOEHRIQHSA-N	444.414	1.915	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC1CCN(C2CCN(C(=O)CN3CCOCC3)CC2)CC1	1836398341	GVNFMMKHWQYDAO-FQEVSTJZSA-N	449.423	1.127	50	20	IDGD	
Cc1nccn1CC(=O)N1CCC(OC2CCN(C(=O)CCBr)CC2)CC1	1837655165	VCRXXJBWOBGMDI-UHFFFAOYSA-N	441.370	1.975	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccn4cncc4c3)C2)C1	1837712941	AOZLCVYRBOHUJQ-NRFANRHFSA-N	446.580	1.256	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)[C@H]3CCC(=O)N3)CC2)CC1	1837783405	BVOLPSUGTMFJSW-HZPDHXFCSA-N	444.370	1.437	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3sccc3Cl)CCO2)C1	1838228000	XXFMXMFUZWYRPY-CXAGYDPISA-N	437.345	1.725	50	20	IDGD	
C/C=C(\C)C(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1	1838394482	AEYDRKHFLPUBDJ-CRKCGEKBSA-N	429.521	1.264	50	20	IDGD	
Cc1noc(C)c1CC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2	1839150652	SSVKCNULSYXGIQ-MOPGFXCFSA-N	448.347	1.527	50	20	IDGD	
O=C(c1ccc(O)c([N+](=O)[O-])c1)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1839275062	IXOQMGMUVUCJSV-QGZVFWFLSA-N	448.259	1.174	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3scnc3C)C2)C1	1839963696	SKEHIQQCESPDGN-DYVFJYSZSA-N	446.367	1.695	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3F)C2)C1	1840032005	KUMIAUAYOQZAIU-PXAZEXFGSA-N	430.274	1.074	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@]3(C)CC3(F)F)C2)C1	1840035805	GNLGNOKPBWPKEL-NILFDRSVSA-N	425.270	1.272	50	20	IDGD	
CC[C@H]1CC[C@H](C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](Cl)COC)C3)C2)CC1	1840059201	XHQIHZKPRYIBDK-NTLWEQJWSA-N	430.973	1.913	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CSc3ccccc3)C2)C1	1840151707	MAVQGDJOUZIMCO-XLIONFOSSA-N	442.965	1.489	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)c(O)c1	1840669531	ATHQECLBMDQMQA-IFXJQAMLSA-N	441.322	1.554	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(NC(C)=O)c3)CCO2)C1	1840730113	CKQDCCDAHFWPBK-GHTZIAJQSA-N	437.924	1.732	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@@H](O)C(=O)N1CCCC12CN(C(=O)[C@@](C)(Cl)CCl)C2	1841300851	ZNSBFCHVGQOJKJ-PXAZEXFGSA-N	438.352	1.312	50	20	IDGD	
CC(C)(C)OC(=O)N1CCCC[C@H]1C(=O)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1	1841351869	JTMIJNBRJKOJCV-GJZGRUSLSA-N	429.945	1.579	50	20	IDGD	
COc1ccc(Cn2cc(CC(=O)N3CCCC34CN(C(=O)[C@@H](O)CCl)C4)cn2)cc1	1841994335	ACYJDKGGKHRGRG-IBGZPJMESA-N	446.935	1.286	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC2(CCCN2C(=O)c2csc(N)n2)C1	1842963259	DHWSXBAVCAYSPS-NSHDSACASA-N	443.957	1.674	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1ccc(C(F)(F)F)nc1)C2	1844263785	VNGGXJHJMJVBAI-UHFFFAOYSA-N	448.405	1.230	50	20	IDGD	
C#CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)CO[Si](C)(C)C)C1	1844379799	MNGCUKMLPPFCJU-MRXNPFEDSA-N	437.613	1.958	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC12CN(C(=O)c1nc3ccccc3n(C)c1=O)C2	1846177110	YCKFTEAPALZNOL-LBPRGKRZSA-N	433.306	1.534	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)c1ccc(N3CCN(C)CC3)cc1)C2	1846360181	ZGISTILDKGYWNB-LJQANCHMSA-N	434.968	1.509	50	20	IDGD	
O=C(/C=C/C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](F)Br)NCc1ccccc1	1847540385	GTZKHHUOJNZKJM-AQRPEHNKSA-N	438.297	1.751	50	20	IDGD	
COc1cc(C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc(OC)c1OC	3451831	WHFBBBNFVXLJTM-UHFFFAOYSA-N	433.373	1.239	50	20	IDGD	
C[C@@H]1Oc2ccccc2N(CCC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)C1=O	10159928	ALKUNRNIVXMFOI-AWEZNQCLSA-N	435.440	1.543	50	20	IDGD	
Cc1ccc(CCC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c(C)c1	11771685	AGZNBFIGKKFLSD-UHFFFAOYSA-N	445.541	1.718	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)CCn1c(C)csc1=O	17153512	OOLHAMAOUZRFLJ-UHFFFAOYSA-N	427.866	1.275	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)CCCN2C(=O)NC(C)(C)C2=O)c(C)n1-c1ccccc1	17443197	ZWIGXUZSBNMVQX-UHFFFAOYSA-N	425.489	1.966	50	20	IDGD	
Cc1ccc(C)c(S(=O)(=O)NCCC(=O)NNC(=O)c2cc(Br)c[nH]2)c1	24122288	UBLDPKQTFZOEAV-UHFFFAOYSA-N	443.323	1.524	50	20	IDGD	
CCOC(=O)C1=NN(c2ccccc2)[C@H](C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)C1	110673688	FVJBHVGDODNWLT-LPHOPBHVSA-N	438.440	1.172	50	20	IDGD	
CC(C)N1C(=O)c2ccc(C(=O)NNc3nc(-c4ccncc4)no3)cc2S1(=O)=O	110846520	RWVVVSTUUUVCBX-UHFFFAOYSA-N	428.430	1.441	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)[C@@H](NS(=O)(=O)c1ccc(C)cc1)C(C)C	117651313	LQRLIEFKLIBGOW-FQEVSTJZSA-N	449.529	1.533	50	20	IDGD	
COCCCNC(=S)N(C)NC(=O)C1CCN(C(=O)c2ccc(F)cc2F)CC1	726075795	NOKUDXQPQFCGJJ-UHFFFAOYSA-N	428.505	1.691	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)NCCN2CCO[C@H](C)C2)c2ccccc2c1=O	726262055	XBWJDWCZOMCSTA-MRXNPFEDSA-N	444.536	1.251	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)cn1	726892883	KZZNLUDMCHHKLL-UHFFFAOYSA-N	449.558	1.896	50	20	IDGD	
COC(=O)Nc1cccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1	728511744	ASRVXHTXMUCUOE-UHFFFAOYSA-N	446.485	1.724	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)c2cccnc2N2CCOCC2)c1	728525875	IPQIFKGODZWAIZ-UHFFFAOYSA-N	435.278	1.764	50	20	IDGD	
CCN(Cc1ccc(OC)cc1OC)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	728961816	QOJPWXFVUKHUAP-UHFFFAOYSA-N	442.520	1.973	50	20	IDGD	
CC(C)(C)c1csc(CCNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)n1	729505912	DIKARPNZSPVQOY-UHFFFAOYSA-N	438.579	1.920	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCCC(=O)NNC(=O)CCc2ccccc2O)cc1	730033978	IYPZRBKESMIDMW-UHFFFAOYSA-N	435.502	1.240	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)NCCOc1ccc(S(C)(=O)=O)cc1	730066265	FHRHMZMHPCPERE-CYBMUJFWSA-N	439.465	1.406	50	20	IDGD	
O=C(CSc1nnc(O)nc1O)NN=C1C(=O)N(Cc2ccccc2)c2ccccc21	730557258	ZKEPTHWDENDMDF-UHFFFAOYSA-N	436.453	1.442	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)c1ccccc1SCC(=O)N1CCCC1	730781177	GONXRXKOJOXKFF-UHFFFAOYSA-N	429.498	1.947	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)c2sccc2S(=O)(=O)N(C)C)cc1OC	732052468	WMSODIBBJRLAKG-UHFFFAOYSA-N	441.531	1.871	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)CCC[S@](=O)c2ccc(Br)cc2)n1	732259856	YUBQOAOUWKWFBP-SANMLTNESA-N	441.351	1.998	50	20	IDGD	
C[C@H](NC(=O)c1cccc(Cl)c1Cl)C(=O)NNC(=O)CCN1C[C@@H](C)O[C@H](C)C1	732265078	YTLPTEYJEWDFLH-UPJWGTAASA-N	445.347	1.758	50	20	IDGD	
CCC[C@H](C)C(=O)NNC(=O)Cn1c(=O)c2c(ncn2CC)n(Cc2ccccc2)c1=O	733129243	YZRWYXCRQWZULD-HNNXBMFYSA-N	440.504	1.012	50	20	IDGD	
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)c1cnn(-c2ccccc2)c1	733171674	ULPFAWNXLWSAFB-NRFANRHFSA-N	430.468	1.862	50	20	IDGD	
COc1ccc(-c2nn(CCC#N)cc2/C=C(/C#N)C(=O)NCCNC(N)=O)cc1OC	736108323	XSBLQIUHFMKXJH-GDNBJRDFSA-N	437.460	1.172	50	20	IDGD	
O=C(CCSCc1nc(O)c2ccccc2n1)NNC(=O)[C@@H]1COc2ccccc2O1	739675999	KYPKXIQMAJJYLX-KRWDZBQOSA-N	440.481	1.946	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N(C)Cc2ccon2)cc1	739800025	KGXSRXPNEAMPRL-WJDWOHSUSA-N	434.456	1.988	50	20	IDGD	
O=C(CN[C@@H](c1ccccc1)C(F)(F)F)NNC(=O)c1csc(N2CCOCC2)n1	740739739	HYQKIWAYBLXVII-HNNXBMFYSA-N	443.451	1.634	50	20	IDGD	
CC(=NNC(=O)C[C@H](C(=O)NN=C(C)c1cncs1)N1CCOCC1)c1cncs1	741766497	MFISKENFQNGZRW-CQSZACIVSA-N	449.562	1.071	50	20	IDGD	
C[C@@H](OC(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccccc1)C(=O)N1CCNC1=O	741818877	HCTWOBVDSSINRZ-YHZJOHHESA-N	432.440	1.854	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNS(=O)(=O)c2cnn(-c3ccccc3F)c2)cc1C	742025320	APQMPGYKCLQGRW-UHFFFAOYSA-N	431.449	1.576	50	20	IDGD	
Cc1ccc(-n2c(NNC(=O)C(C)(C)NS(C)(=O)=O)nc3ccccc3c2=O)c(C)c1	742075567	CNNPWJODRLCGLV-UHFFFAOYSA-N	443.529	1.773	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CN(C)CCCOc2ccc(S(C)(=O)=O)cc2)c1	744390167	DJVJMBZBDZITOH-UHFFFAOYSA-N	433.530	1.560	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)Nc1cccnc1N1CCCC1	744450285	QJYQRGOKLKOIHZ-UHFFFAOYSA-N	446.533	1.851	50	20	IDGD	
Cc1c(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)oc2c1C(=O)CCC2	744622260	YSBIXZKVIQHPME-UHFFFAOYSA-N	433.486	1.885	50	20	IDGD	
COc1cccc(N2CC[C@H](CNC(=O)NNC(=O)c3cc([N+](=O)[O-])ccc3O)C2)c1	745800365	PUQVNAASNXDRDM-CYBMUJFWSA-N	429.433	1.780	50	20	IDGD	
COc1cccc2c1OC[C@@H](NC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)C2	745801032	JRYKYQGKJCDARF-AWEZNQCLSA-N	434.474	1.438	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)NCCS(=O)(=O)C(C)(C)C)c2ccccc2c1=O	745898380	RKMDRGFEFUPNEO-UHFFFAOYSA-N	437.522	1.135	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N2CCOCC2)cc1S(=O)(=O)Nc1ccc(C)cc1	745993108	XKTHROXJZDRFQW-UHFFFAOYSA-N	448.501	1.491	50	20	IDGD	
COc1cc(C)nc(NNC(=O)C2CCN(S(=O)(=O)c3ccc(C)cc3C)CC2)n1	746623353	LOQBNSQYYZJFLZ-UHFFFAOYSA-N	433.534	1.954	50	20	IDGD	
C[C@@H](CN(C)C(=O)OC(C)(C)C)C(=O)NNC(=O)c1csc(N2CCOCC2)n1	746821304	HRNXLCJZXDPTTO-LBPRGKRZSA-N	427.527	1.244	50	20	IDGD	
CCS(=O)(=O)CCOc1ccc(S(=O)(=O)NNC(=O)CCc2ccco2)cc1	748214732	UQGYYPFYWGUFEK-UHFFFAOYSA-N	430.504	1.035	50	20	IDGD	
O=C(CN1C(=O)[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1	748523606	XCSICYATNKUSNH-NBLIUIFLSA-N	443.403	1.230	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NC[C@]1(N(C)C)CCSC1	748647568	PNWRLEOBIXWRFT-YVEFUNNKSA-N	445.383	1.984	50	20	IDGD	
COCCNS(=O)(=O)c1cccc(CNC(=O)NNC(=O)c2cc3ccccc3o2)c1	749573817	HKMDBZOBENTEPR-UHFFFAOYSA-N	446.485	1.502	50	20	IDGD	
N#CCCn1cc(/C=C(/C#N)C(=O)NS(=O)(=O)N2CCOCC2)c(-c2ccccc2)n1	750723137	AJORROQXDZJXOA-LGMDPLHJSA-N	440.485	1.064	50	20	IDGD	
CC[C@H](CS(=O)(=O)c1ccccc1)NC(=O)NNC(=O)COc1ccccc1C#N	752708002	ZFSTULVJHGROHT-MRXNPFEDSA-N	430.486	1.520	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc2nc(O)cc(C(=O)NNC(=O)c3ccc(C)o3)c2c1	752780696	GGWWWJXJCQOUJX-UHFFFAOYSA-N	446.485	1.947	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)N[C@@H]1CCN(Cc2ccc(C#N)cc2)C1=O	753733491	QNJOFHADIDOXQQ-RDTXWAMCSA-N	439.447	1.596	50	20	IDGD	
CCc1nc(C(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)co1	753981712	RIPZWVZZXSOQET-UHFFFAOYSA-N	428.470	1.790	50	20	IDGD	
CC(=O)N1CCN(S(=O)(=O)c2cccc(C(=O)NNc3cccnc3Cl)c2)CC1	754483923	QZIAASVRVGMGQL-UHFFFAOYSA-N	437.909	1.345	50	20	IDGD	
O=C(CCS(=O)(=O)c1ccc2c(c1)OCCCO2)NNc1ccc(C(F)(F)F)nn1	755198242	NOHOYEUMWCRJHW-UHFFFAOYSA-N	446.407	1.964	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNS(=O)(=O)c1cc(C(=O)O)c(Cl)cc1Cl	755261865	SECXZEDFOUIQEY-UHFFFAOYSA-N	436.229	1.024	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)NCCN2C(=O)[C@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2=O)c1C	755459099	NRPYAZBRQBLYOJ-CWSVOBMESA-N	436.512	1.582	50	20	IDGD	
CCN1CCN(c2ccc(NC(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)cc2)CC1	755475401	VZXCHBDPMHIGDY-UHFFFAOYSA-N	445.545	1.699	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)Nc1ccc(-c2nnc3n2CCCCCC3)cc1	755585134	ZVRQFCHIBMUBKW-HNNXBMFYSA-N	446.533	1.649	50	20	IDGD	
CN1CCN(C(=O)c2ccccc2NC(=O)NNC(=O)COc2ccccc2C#N)CC1	755622942	KRIJPCZNHOOHKM-UHFFFAOYSA-N	436.472	1.178	50	20	IDGD	
CCN(CCNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)CCC(F)(F)F	755851858	KFYNUKWYOKIRKE-UHFFFAOYSA-N	431.463	1.298	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1ccc(N(C)C2CCCCC2)c(F)c1	755940612	ALILAHQSWKZKSY-GFCCVEGCSA-N	429.518	1.685	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)Nc1ccc(F)c(N2CCCS2(=O)=O)c1	756498272	UMPNAMKUBZHRQF-UHFFFAOYSA-N	437.409	1.740	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)ccc1Cl	757472018	KTASTNKQHFCREL-UHFFFAOYSA-N	446.890	1.153	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)Nc2ccc(C)c(S(=O)(=O)NC3CC3)c2)c1	757865021	FBCFFYPTGCLDNF-UHFFFAOYSA-N	448.501	1.919	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2cccc3c2OCCC3=O)c1	757978060	HKBNUNOQJFXFHQ-UHFFFAOYSA-N	432.458	1.369	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)Nc2cccc3c2CCN3S(C)(=O)=O)cc1C	758301784	XLELZYFJLUTYSJ-UHFFFAOYSA-N	432.502	1.857	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)NC[C@@H]1CN(Cc2ccccc2)CCCO1	758856239	VIRGFFVPOYQOTO-LJQANCHMSA-N	442.516	1.696	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)CN[C@@H](c2ccccc2)C(F)(F)F)c1	761457779	MJRRICCRRZKSCR-SFHVURJKSA-N	434.374	1.756	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H]1[C@H]1COCCC1=NNC(=O)Cc1cc(O)nc(O)n1	762422868	MUVWNWJMTUCSCP-ZFWWWQNUSA-N	435.481	1.339	50	20	IDGD	
CN1C(=O)C[C@H](C(=O)NNc2nccc(N3CCOCC3)n2)[C@H]1c1cccc(Cl)c1	762860691	HGJNRJDUQWFZBK-MAUKXSAKSA-N	430.896	1.629	50	20	IDGD	
CCS(=O)(=O)Nc1ccccc1C(=O)NNC(=O)c1cc(-c2ccccc2OC)[nH]n1	763151845	GQEAGCYQEVPDRU-UHFFFAOYSA-N	443.485	1.922	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)C(=O)Nc1cc(F)cc(Cl)c1	763531862	SLSCJUBBSFGPLB-UHFFFAOYSA-N	447.898	1.777	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(C)n(-c3ccc(C)cc3)n2)cc1OC	763550595	GQKXFROOAMGYOW-UHFFFAOYSA-N	437.456	1.906	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)Nc1ccc(Cl)c2ncccc12	763574454	ZPWDOADHQPICHJ-INIZCTEOSA-N	426.816	1.814	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)ccc1NC(C)=O	763600475	JHVUBPJMAHIAAB-UHFFFAOYSA-N	436.428	1.443	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cnn(-c3ccccc3F)c2)cc1C	763664804	HRKVKAGMWDCVBR-UHFFFAOYSA-N	425.420	1.793	50	20	IDGD	
Cc1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	763717899	CEIHPNYNRIRWCN-UHFFFAOYSA-N	438.893	1.298	50	20	IDGD	
CCOC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)cc1	763732944	DAEUNZCZESCMFT-UHFFFAOYSA-N	443.500	1.931	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)Cc1csc(-c2ccc3c(c2)OCO3)n1	763812965	DPBACXDIRGKDAD-UHFFFAOYSA-N	439.453	1.054	50	20	IDGD	
CCn1nnnc1-c1cccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)c1	763872895	PSTJQTQIUNQXJA-LBPRGKRZSA-N	441.423	1.053	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)C(=O)Nc1cccnc1-c1ccccc1	763921808	PBBKWGHBJIZGQT-UHFFFAOYSA-N	428.412	1.124	50	20	IDGD	
COc1cc(F)c(NC(=O)C(=O)NNC(=O)c2cc(Br)cn2C)cc1OC	764004356	FATXGABOUYHXNU-UHFFFAOYSA-N	443.229	1.344	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1cncc(Br)c1	764012515	ROQQOXIWOFIHKH-UHFFFAOYSA-N	427.642	1.906	50	20	IDGD	
CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)NNC(=O)CSc1ccccc1O	764047070	OXUHOWLCRIHCMS-KRWDZBQOSA-N	444.488	2.000	50	20	IDGD	
CCCNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2cccc(Br)c2)c1	764059308	RJUNCDSOSCAOFR-UHFFFAOYSA-N	447.289	1.989	50	20	IDGD	
CCOCCOCc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)c1	764116827	HYZUAUHYYWXMHM-UHFFFAOYSA-N	435.864	1.998	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2cc(C(F)(F)F)cnc2O)cc1	764125895	DYHUBOXZFLJHLL-UHFFFAOYSA-N	426.351	1.533	50	20	IDGD	
CC[C@H](C)NS(=O)(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)CC2CCCC2)c1	764187093	BGGWRTJBZMPCMD-AWEZNQCLSA-N	438.550	1.571	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)C(=O)Nc1c[nH]nc1-c1ccccc1	764203772	DFJXAXDIDVOSQW-UHFFFAOYSA-N	430.465	1.468	50	20	IDGD	
CCSc1cccc(NC(=O)C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1	764258906	DDENLWAFJOBNJJ-UHFFFAOYSA-N	428.518	1.591	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)C(=O)Nc1ccc(OCCN2CCCCC2)cc1	764264029	NWRVTYVWVICODH-UHFFFAOYSA-N	425.489	1.275	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1F	764267396	UYPZFSGJOKPRQA-UHFFFAOYSA-N	430.440	1.017	50	20	IDGD	
CN(Cc1cccc(NC(=O)C(=O)NNC(=O)Cc2cccnc2)c1)Cc1cscn1	764268560	WWJLHJXUOXDFHX-UHFFFAOYSA-N	438.513	1.499	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)C(=O)Nc2cccnc2Oc2ccccc2)c1	764433207	LSYJFWIRDFQKGW-UHFFFAOYSA-N	434.412	1.627	50	20	IDGD	
CCOc1ccc(C(=O)NCC(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)cc1	765607467	OJYLSWVCNDDBDG-UHFFFAOYSA-N	425.420	1.806	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)N1CC[C@@H]2[C@@H](CCCN2Cc2ccccc2)C1	765731868	DDUNXDFOYSZQPG-RBUKOAKNSA-N	439.516	1.737	50	20	IDGD	
CCn1nc(C)c(C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)c1C	766662750	FDLVBZUBCZMYMF-UHFFFAOYSA-N	432.956	1.752	50	20	IDGD	
Cc1ccc2c(c1)C(=O)N([C@H](C)C(=O)OCC(=O)NNC(=O)Cc1ccccc1C)C2=O	767260419	LYAOFLWBGZWNMP-OAHLLOKOSA-N	437.452	1.221	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)N[C@@H]1CCOC2(CCC2)C1	769192398	AHOVRGXJVXWOLX-MRXNPFEDSA-N	436.534	1.517	50	20	IDGD	
COc1ccc(C(=O)NCCNC(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)cc1	770352164	VAQMVURSIBNKIO-UHFFFAOYSA-N	442.480	1.352	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)N[C@H]1CCCN(c2ccn(C)n2)C1=O	770567250	ITKFJUGBJVEIGE-WFASDCNBSA-N	434.884	1.367	50	20	IDGD	
O=C(CCN1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O)NNc1ccc(Br)c(F)c1	771682793	YTVSRVUJYNKRIV-GBOPCIDUSA-N	426.242	1.584	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1Cl	772885294	ZCXGRGXPXRDQNM-UHFFFAOYSA-N	434.243	1.047	50	20	IDGD	
CC/C=C(\C)C(=O)N1CSC[C@@H]1C(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772897714	LGXUZSOPLHZEPH-HETKQVNLSA-N	438.937	1.361	50	20	IDGD	
COc1ccc(/C=C\C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)cc1O	773229089	HBFNODATHNVAJG-CLFYSBASSA-N	433.486	1.578	50	20	IDGD	
O=C(NNc1ccccc1[N+](=O)[O-])C(=O)Nc1cc(N2CCCS2(=O)=O)ccc1F	773651343	SZDXTOLXVCDOHL-UHFFFAOYSA-N	437.409	1.356	50	20	IDGD	
O=C(NNc1ccc2ccccc2n1)C(=O)Nc1cccc(N2CCS(=O)(=O)CC2)c1	773661050	DDJKPQOFSSDATD-UHFFFAOYSA-N	439.497	1.551	50	20	IDGD	
COC(=O)CCN1CCN(C(=O)NNC(=O)c2ccc(COc3ccccc3)o2)[C@@H](C)C1	774659760	RARIBJDXAOMHHY-INIZCTEOSA-N	444.488	1.782	50	20	IDGD	
O=C(NNc1ncc(Cl)cc1Cl)Nc1ccc(S(=O)(=O)N2CCOCC2)cn1	776061362	HKVABDZMQVGBKY-UHFFFAOYSA-N	447.304	1.953	50	20	IDGD	
COc1ccccc1[C@](N)(C(=O)NNC(=O)CCNC(=O)OC(C)(C)C)C(F)(F)F	776196662	UNQGUFXHYUJWKG-KRWDZBQOSA-N	434.415	1.474	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@H](C)C2CN(C(=O)OC(C)(C)C)C2)cc(OC)c1OC	776318181	QHDJMIUENQZNFN-GFCCVEGCSA-N	437.493	1.976	50	20	IDGD	
COc1cccc([C@@H]2[C@H](C(=O)NNC(=O)Cn3cnc4ccccc43)CC(=O)N2C2CC2)c1	776448733	RZALCOAAFCWORJ-WZONZLPQSA-N	447.495	1.945	50	20	IDGD	
COCCO[C@H]1COCC[C@H]1NC(=O)NNC(=O)c1ccc(OC(C)C)c(OC)c1	776935538	CRDKIFBMERGBEX-QAPCUYQASA-N	425.482	1.247	50	20	IDGD	
COc1ccc(C2(C(=O)NNC(=O)N[C@H]3CCS(=O)(=O)C3)CCCC2)cc1OC	777367238	CUTVPSCLEVDXEY-AWEZNQCLSA-N	425.507	1.033	50	20	IDGD	
COC(=O)[C@H]1CN(C(=O)C(=O)NNc2ccccc2OC(F)(F)F)c2ccccc2O1	778797454	ALIMWDNZWPXLOA-OAHLLOKOSA-N	439.346	1.996	50	20	IDGD	
C[C@@H](NCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)c1cccc(NS(C)(=O)=O)c1	781913035	VTQPJJNJJWLFBF-GFCCVEGCSA-N	435.462	1.078	50	20	IDGD	
CCC[C@@H]1CN(C(=O)OC(C)(C)C)CCN1CC(=O)NNC(=O)Cc1nc(C)cs1	782095707	MJKYEROCDRVCMM-OAHLLOKOSA-N	439.582	1.863	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ccccc2Br)cc1S(N)(=O)=O	782989241	UZALBZBSGTUTGT-UHFFFAOYSA-N	427.280	1.487	50	20	IDGD	
O=C1C[C@@H](Cc2ccc(NC(=O)C(=O)NNc3ccccc3Br)cc2)C(=O)N1	782989482	WELHAAOZLPHFFY-GFCCVEGCSA-N	445.273	1.736	50	20	IDGD	
Cc1cc(C)cc(NNC(=O)C(=O)Nc2cccc(S(=O)(=O)NC3=NCCC3)c2)c1	783357121	OXWXMGBKFCXTRT-UHFFFAOYSA-N	429.502	1.856	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNc2ccc(-n3cccn3)nn2)ccc1Cl	783433535	VVAKDOMGLQZSFW-UHFFFAOYSA-N	429.824	1.574	50	20	IDGD	
CON(C)S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2cc(F)c(F)cc2F)cc1	784892121	TYCBPSYHPINWTJ-UHFFFAOYSA-N	432.380	1.368	50	20	IDGD	
CS(=O)(=O)c1cc(C(=O)NNC(=O)COc2ccc(Br)cc2)ccc1F	785687460	VWENPMVJIRFWFG-UHFFFAOYSA-N	445.266	1.832	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)[C@H](O)Cc1ccccc1Cl	785726338	DBACXXXIXYZVDY-OAHLLOKOSA-N	441.267	1.910	50	20	IDGD	
Cc1occc1-c1cc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)no1	786215064	BEZYOJLIHIBICZ-UHFFFAOYSA-N	433.446	1.960	50	20	IDGD	
CS(=O)(=O)c1cc(NC(=O)C(=O)NNc2ccc(Br)nc2)ccc1Cl	788337844	NERHOTIAXXSQPT-UHFFFAOYSA-N	447.698	1.983	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)c2cccc(NN3C(=O)[C@H]4CC=CC[C@H]4C3=O)c2)n1	788631453	XBJLCVDGVRCTGQ-HDICACEKSA-N	436.472	1.239	50	20	IDGD	
CCOCC(=O)NNC(=O)C(=O)Nc1ccc(Br)cc1OC(F)(F)F	789585536	DHULPVCJNIQQHQ-UHFFFAOYSA-N	428.161	1.470	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1)C(=O)Nc1nc2c(s1)CCCC2	789738189	BEEGJQDPLCRKLK-UHFFFAOYSA-N	428.449	1.951	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)N[C@H](C)c2nnnn2C2CC2)c2ccccc2c1=O	790711999	YMIDEBMQAMLBPT-LLVKDONJSA-N	425.453	1.004	50	20	IDGD	
O=C(CCOCC(F)(F)C(F)(F)F)N1CCN(S(=O)(=O)CBr)CC1	790850028	AQMUNFDOEWXBCR-UHFFFAOYSA-N	447.220	1.417	50	20	IDGD	
CC1C[C@@H](C(=O)NNc2nc3ccccn3n2)[C@H](C(=O)NNc2nc3ccccn3n2)C1	791259520	UUHNTELZDKMTOA-ZIAGYGMSSA-N	434.464	1.021	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C)c(Br)n2)cc1OC	793023334	NPMJYEHNTPAHPM-UHFFFAOYSA-N	437.250	1.569	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NN=C(CS(=O)(=O)N(C)C)C(C)C)CC2)cc1	794920939	YICWNABWFTUYKE-UHFFFAOYSA-N	437.610	1.132	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)[C@@](C)(NC(C)=O)c2ccc(S(C)(=O)=O)cc2)c1	797750644	FQYPGBJJRDOTDS-FQEVSTJZSA-N	433.486	1.371	50	20	IDGD	
CN(CCNC(=O)NNC(=O)c1cccc2ncccc12)S(=O)(=O)c1ccc(F)cc1	798098333	YMUVEBBASAKSOG-UHFFFAOYSA-N	445.476	1.639	50	20	IDGD	
Cc1cc(O[C@H]2CCN(C)C2=O)ccc1NC(=O)C(=O)NNc1nccnc1C(C)C	799263840	YZEGNCVYUYOTBC-INIZCTEOSA-N	426.477	1.600	50	20	IDGD	
C/C(C=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O)=C\c1ccccc1C(F)(F)F	799873216	BKLGZDAGJGBSKG-BWYFZAQFSA-N	441.435	1.795	50	20	IDGD	
Cc1ccc(C2=NO[C@@H](CNC(=O)NNC(=O)c3csc(N4CCOCC4)n3)C2)cc1	800750311	LYWGGIJVPLEFGN-OAHLLOKOSA-N	444.517	1.425	50	20	IDGD	
COC(=O)c1cc(C=NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)n(C)c1C	800804728	BCJODXYGCDZYCV-UHFFFAOYSA-N	432.502	1.669	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)C2=NN(c3ccccc3)C(=O)CC2)cc1	802064291	LJLKYYHYSNWMEF-UHFFFAOYSA-N	429.458	1.426	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(OC(F)F)cc1F	802566491	RXDUVLGUCVJAFT-UHFFFAOYSA-N	441.362	1.991	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)Nc1nc2c(s1)CSCC2	806977015	RVJBQMUGPBHWLG-UHFFFAOYSA-N	444.336	1.433	50	20	IDGD	
CCOC(=O)C(C)(C)c1csc(NC(=O)C(=O)NNC(=O)Cc2ccccc2OC)n1	806977383	GXVJYCDVWXRKDO-UHFFFAOYSA-N	448.501	1.321	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NC[C@H](c1ccccc1)N(C)C	806987953	LKMNFKOPQLHONZ-MRXNPFEDSA-N	432.550	1.535	50	20	IDGD	
O=C(NCC1(N2CCOCC2)CCCCC1)NNC(=O)c1nnc(O)c2ccccc12	806997265	BSFFRIFCHGQAKA-UHFFFAOYSA-N	428.493	1.315	50	20	IDGD	
COc1cc(F)cc(NNC(=O)C(=O)Nc2ccc(F)c(S(=O)(=O)N(C)C)c2)c1	807024432	GXZRMZCLZHCIMR-UHFFFAOYSA-N	428.417	1.306	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)Nc1ccn2ccnc2c1	810230023	AUSIEKYUFUKDGE-UHFFFAOYSA-N	442.501	1.975	50	20	IDGD	
O=C(NNS(=O)(=O)CCCCN1C(=O)c2ccccc2C1=O)c1cccc([N+](=O)[O-])c1	814211061	YTHONGUMXGXLJT-UHFFFAOYSA-N	446.441	1.235	50	20	IDGD	
COc1ccc(NC(=O)NN=C(C)c2ccc(S(=O)(=O)N3CCNCC3)cc2)cc1	814997219	HYWXALBKCPDXMO-UHFFFAOYSA-N	431.518	1.835	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3cn(Cc4ccccc4)nn3)cc2C1	815567001	LQCPPYXATJVWJF-ZDUSSCGKSA-N	438.513	1.912	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNc2ncc(F)cn2)nnn1Cc1ccc(C(F)(F)F)cc1	815604709	YYZOSWHPDGJIIE-UHFFFAOYSA-N	438.345	1.665	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1cc(OC)c2ncccc2c1	815613300	JYOUBSHCYMWPCK-UHFFFAOYSA-N	444.469	1.737	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	825624238	ICCSIGNRTYDCFN-UHFFFAOYSA-N	432.502	1.353	50	20	IDGD	
Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)Oc1ccc(C(=O)N2CC[C@@H](B(O)O)C2)cc1	864233175	FZVVQAJPLGSGEV-CQSZACIVSA-N	434.235	1.360	50	20	IDGD	
CS(=O)(=O)c1ccccc1C(=O)NNC(=O)COc1ccc(Br)cc1	870984477	VAWMDWMKAMOGHI-UHFFFAOYSA-N	427.276	1.693	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)c1cnc2c(c1)c(O)nc(=O)n2C	893732604	SLHZKCSYWURTAE-UHFFFAOYSA-N	436.453	1.541	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)CCNS(=O)(=O)c2cccc(Cl)c2)cc1	913429605	MFDFEBVNPVWFJU-UHFFFAOYSA-N	440.909	1.277	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(Br)cc1)NNC(=O)NC1CCCCC1	913451069	KESMNGULYJCZTJ-UHFFFAOYSA-N	433.328	1.391	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)CCCNC(=O)c1ccc(OC)cc1	914781379	BRLHKQSBXTVKGZ-UHFFFAOYSA-N	437.500	1.965	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)C2(c3ccccc3)CCOCC2)c1	915188436	NIQAYMXRLWAPBD-UHFFFAOYSA-N	431.514	1.446	50	20	IDGD	
Cc1c(NC(=O)[C@H](C)SCC(=O)NNC(=O)C(C)C)c(=O)n(-c2ccccc2)n1C	915776036	RJTTXQVCTPWPLK-AWEZNQCLSA-N	433.534	1.348	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2ccnc(N3CCCCC3)c2)c1	916254838	QAWXXEZXQOCATN-UHFFFAOYSA-N	431.518	1.620	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NCc1ccc(CN2CCN(C)CC2)cc1	916388116	UZPORKPGUUODFA-QGZVFWFLSA-N	443.523	1.871	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)N[C@H]1CCN2CCC[C@H]2C1	916572899	FTCUZWUQYXSHNO-IRXDYDNUSA-N	435.550	1.042	50	20	IDGD	
NNC(=O)C1CCN(S(=O)(=O)c2cc(Br)ccc2Br)CC1	916665554	INOXMGOPTKJUCU-UHFFFAOYSA-N	441.145	1.602	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(C(=O)NNC(=O)CC(F)(F)F)ccc1Br	918704299	YHZHFDOARDLUKR-UHFFFAOYSA-N	432.218	1.413	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CS(=O)(=O)Cc2cccc(Br)c2)c(O)c1	920211428	MSEBAENUSCNSRS-UHFFFAOYSA-N	441.303	1.839	50	20	IDGD	
Cc1nn(-c2ccccc2)c(N2CCCC2)c1C=NNC(=O)N[C@@H]1CCS(=O)(=O)C1	920381124	OFTSHDAIEFMZLR-MRXNPFEDSA-N	430.534	1.601	50	20	IDGD	
C#CCOc1ccc(C=NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1	920987358	ULMPEHPDMZKKLH-UHFFFAOYSA-N	427.482	1.483	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C2=NN(c3ccc(F)cc3)[C@@H](C(N)=O)C2)c1	935068561	GKESLFCQCUMAME-QGZVFWFLSA-N	427.436	1.089	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(=O)n(CC(=O)NNc2ccc(C(C)(C)C)nn2)c1	1321937985	VTJGEWNCUMHSSD-UHFFFAOYSA-N	436.538	1.110	50	20	IDGD	
Cc1ccc(C)c(NC(=S)NNC(=O)c2ccc(S(=O)(=O)NC[C@H](C)O)cc2)c1	1335650567	OYKUEWFJJOWBOQ-AWEZNQCLSA-N	436.559	1.594	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Cl)C2)c1cccn2c(O)nnc12	1777956828	BSUQLBMXPDVZKI-FHSNZYRGSA-N	425.848	1.097	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C1(C)CCC1)C2	1778091670	MJAOXQSYZIWLKS-QZICUBQQSA-N	443.548	1.825	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@]3(F)CCCCC3(F)F)C2)C1	1778222932	MQVKZNCIKNCEQE-XKQJLSEDSA-N	426.863	1.988	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2snnc2C2CC2)C1	1778366076	IGOAAMNBDQMQTJ-PJIJBLCYSA-N	442.969	1.797	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2)c1cnc2ccccc2n1	1778427795	MMKCBROLGKRQBI-DBXWQHBBSA-N	432.908	1.357	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(CCN(C(=O)c3ccc4cccnc4n3)C2)C1	1778430519	BCQGMCAYVZDAIG-LJQANCHMSA-N	433.306	1.858	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)C/N=C/c3ccco3)C2)C1	1779133238	YAGPSWAPGVDQHN-MQFVPBGYSA-N	426.311	1.559	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H]1CC[C@@H]3CCC(=O)N3C1)CCO2	1779300727	WGZGELGNVYUZAC-FVJLSDCUSA-N	437.613	1.069	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](F)Br)C2)cn1	1780770134	CWCOCQHGWSCWFC-QIIPPGSGSA-N	444.301	1.908	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)Cc3ccc(OC)cc3C#N)C2)C1	1781176313	IVDBRHUVUBADDH-GHTZIAJQSA-N	435.908	1.193	50	20	IDGD	
COc1ccc(CC(=O)N2CCO[C@]3(CCN(C(=O)[C@H](F)Br)C3)C2)cc1O	1781325678	PPYPSJQIQVKKBO-FUHWJXTLSA-N	445.285	1.464	50	20	IDGD	
O=C(c1cn2cc(F)ccc2n1)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781331422	KGTJRDJXTWTVDP-PBHICJAKSA-N	443.248	1.607	50	20	IDGD	
Cc1cc(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](C)Br)C2)no1	1782001193	AYWGZVGKEJSUBY-JCKWVBRZSA-N	428.327	1.823	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)c3cccc4ccoc34)C2)C1	1782451223	GPGSHCOWQIDLIA-JOCHJYFZSA-N	428.489	1.249	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@@]2(C1)CN(C(=O)c1cccnn1)CCO2	1782867074	INABXYPVAMUBMJ-JLOHOZFJSA-N	439.422	1.805	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)c1ccc([N+](=O)[O-])o1	1783359741	LEPSBDTWESDENL-GVXVVHGQSA-N	430.255	1.566	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)COc3cc(Cl)ccn3)CCO2)C1	1783878421	YHNCXGXAEBZZGL-KDOFPFPSSA-N	432.304	1.198	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)/C=C/c3cc(F)cc(OC)c3)CCO2)C1	1783879560	XDKYAHOMNZVCHA-ZUNDHMPPSA-N	440.899	1.931	50	20	IDGD	
C[C@H](C(=O)N1CCO[C@@]2(CCN(C(=O)C(Cl)Cl)C2)C1)[S@](=O)c1ccccc1	1783949480	KRLPDUDDDCHFEQ-GOXOYUAHSA-N	433.357	1.816	50	20	IDGD	
O=C([C@@H]1CCCN1Cc1ccccc1)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1784239052	PBVGIMSELLVQPM-IPJJNNNSSA-N	435.952	1.081	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)C1CCC(CO)CC1	1785054311	YDGAFBHPHVWWFM-YOTSKQKMSA-N	431.371	1.550	50	20	IDGD	
CN(C)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]21	1785758654	ZHVTYFGQUJDYBS-NUADTHGBSA-N	443.375	1.977	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4n(n3)CCC4)C[C@@H]21	1786406821	IFGZORSANMKOAO-NOLJZWGESA-N	425.327	1.208	50	20	IDGD	
Cc1nccn1[C@@H](C)C(=O)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1	1788145055	BQIBKURZJGZKOU-INIZCTEOSA-N	446.316	1.880	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1(c2ccc(NC(=O)[C@@H]3C=CCN3)cc2)CCC1	1788535735	FPLYSPVKUBLLEW-UEYIPHHSSA-N	434.500	1.783	50	20	IDGD	
COc1ccnc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCBr)C[C@@H]32)c1	1788890135	SJDSZEJUJWNARN-NOLJZWGESA-N	426.311	1.469	50	20	IDGD	
O=C(CCBr)NC1(c2ccc(NC(=O)[C@H](O)N3CCOCC3)cc2)CCC1	1789555019	YICQCXRBIGFZLD-SFHVURJKSA-N	440.338	1.556	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3C[C@H]3F)[C@H]2C1	1789792799	NCVZWAJXYKKIHN-RRPUIJGBSA-N	449.435	1.471	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3CCC4(CC3)OCCO4)[C@H]2C1	1790738012	FLQSKXKFEPCXHK-FJIDUMEYSA-N	444.956	1.153	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccccc3NC(C)=O)C[C@@H]21	1791256670	UEFOUNXUXYALNM-RMRDIRSESA-N	437.924	1.492	50	20	IDGD	
C[C@H](Br)C(=O)Nc1ccc(C2(NC(=O)CN3CC(=O)NC3=O)CCC2)cc1	1791431726	CTUCNBLPTDFRED-NSHDSACASA-N	437.294	1.456	50	20	IDGD	
COc1ccccc1OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2	1792721142	GOCODRKOJZKKRL-LZDSYCOUSA-N	445.285	1.354	50	20	IDGD	
Cc1ccccc1OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)CBr	1792868238	UVTFWEDRVHGTRO-GGXPGOJBSA-N	439.350	1.994	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@H](O)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCBr)C2	1793007569	IGISFXZYCGUCCT-CRWXNKLISA-N	448.358	1.295	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1COc2ccccc2O1	1793842331	IMDASVNUHMDIOC-GUSVHXROSA-N	443.327	1.652	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1(c2cccc(F)c2)CC1)c1cccc(B(O)O)c1	1794032723	VPFMNTUITOJXFW-WKCHPHFGSA-N	436.292	1.489	50	20	IDGD	
CC(C)[C@H](O)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1794141427	KGMRGQAQEUYTAA-QRJUGERDSA-N	431.961	1.774	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnn(-c2cccnc2)c1	1794442653	INBALZBPAKZYRR-NBMJBFSESA-N	431.924	1.878	50	20	IDGD	
CS(=O)(=O)c1cncc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](F)Br)C3)c1	1794625460	IFUPEAVXIHXNKU-GFQSEFKGSA-N	448.314	1.427	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)[C@@H]1[C@@H]2CCC[C@H]1c1ccccc1N2	1795498829	IGWMXUWYMAKDTF-MAOYOYBYSA-N	447.963	1.554	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)c1cc(Cl)ccc1F	1796189688	PDPQVAJAEIQHMD-BJWYYQGGSA-N	430.672	1.725	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](O)c1ccco1)C2	1796889577	FXCXRBOSWLLFLC-QDGRBWDCSA-N	427.461	1.085	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccn3nccc3c1)C2	1796892557	PPEAABCUFICYDO-BECFQBPISA-N	447.499	1.720	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cc1cc(C)on1)C2	1796893164	MUKXSKJIEXUTSN-KADWPKLNSA-N	426.477	1.298	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccccc1-n1nccn1)C2	1797956345	RLRATGQOCLSTRA-CWPLJXCYSA-N	443.580	1.322	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1=C3c4ccccc4C(=O)N3CC1)C2	1799268887	MVYRPXKLFQAUPM-GTYSZEQSSA-N	443.931	1.864	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](CC)NC(=O)OC(C)(C)C)C2	1799271349	NIRVXBIUXYZAED-YIDVYQOGSA-N	431.961	1.897	50	20	IDGD	
COc1ncccc1CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Br	1799344912	XULGIUSOUWZLKO-XRGAULLZSA-N	444.301	1.303	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3cnccc3[nH]1)C2)[C@H](F)Br	1799349030	GCKGBKPPXWWVJD-JLUCKKNBSA-N	425.258	1.457	50	20	IDGD	
Cc1ccn2c(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@@H](C)Br)C4)cnc2c1	1800085759	JUMZOLJJICPCLJ-VWPFQQQWSA-N	435.322	1.629	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)Cc1ccc(F)cc1	1800373028	YWRVCDCIUDVCGX-DRACIFKTSA-N	426.916	1.848	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3cccnc3[nH]1)C2	1800641756	IYVFSJQQFBUGGB-HLPPOEQASA-N	435.322	1.940	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)[C@@H]1CC=CCC1	1803026616	QQGKMBCSCAFFKT-AGHHOFFYSA-N	433.317	1.437	50	20	IDGD	
COc1cnc(C(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)c(F)c1	1803141247	MEDYYYXUGVWIIP-SKDZVZGDSA-N	436.871	1.544	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC2(CCCN(C(=O)c3ccc(F)nc3F)C2)CC1	1804678939	XRNCBARIUVRPER-UHFFFAOYSA-N	443.259	1.198	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1ccccc1O	1805195557	CPWRBRXWJUYXMJ-AVRDEDQJSA-N	445.284	1.100	50	20	IDGD	
Cc1ccc(CC(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)o1	1807373962	GVHMWWOZVKJANY-XXBNENTESA-N	447.300	1.225	50	20	IDGD	
Cc1noc(CC(=O)NC[C@H]2CCN(C(=O)CO[Si](C)(C)C)[C@H]2c2cccnc2)n1	1807525942	SNQSLTNGHSUOEX-UZLBHIALSA-N	431.569	1.873	50	20	IDGD	
CN1CCN(CCC(=O)N2CC[C@H](CNC(=O)[C@H](F)Cl)[C@@H]2c2cccnc2)CC1	1808308124	ASNMKXOVDTULNK-NEWSRXKRSA-N	425.936	1.259	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)[C@H]2C[C@@H]2F)[C@@H]1c1cccnc1	1808416185	GPBFKUXVZXGEPR-DSCAVJCTSA-N	440.479	1.579	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC2(CCCN(C(=O)c3ncccn3)C2)CC1	1808493493	MTXADODFOXKJDB-WGOQTCKBSA-N	437.504	1.455	50	20	IDGD	
O=C1CC[C@H](C(=O)N2CC[C@H](CNC(=O)[C@@H](F)Br)[C@@H]2c2cccnc2)CN1	1808648737	BDLWFRYOYVDJGG-BFJAYTPKSA-N	441.301	1.304	50	20	IDGD	
NC(=O)c1ccccc1C(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1	1811268571	BJMHGISGCPGKDY-BMGDILEWSA-N	430.892	1.100	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H]1CCN(C(=O)CN)[C@H]1c1cccnc1	1811357939	CMSKEDWEJXDNPB-QRWLVFNGSA-N	441.444	1.193	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)c1c(F)ccc(O)c1F	1811655708	GSAHWEUQBWHPQS-WBHUJUFNSA-N	439.846	1.985	50	20	IDGD	
C=CCC(F)(F)C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1812667490	DKOIDCVSEDUOLY-IEBWSBKVSA-N	443.259	1.292	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)CSC(=N)N)[C@H]1c1cccnc1	1812865698	ZFEHSWDUJXUZOI-SUHUHFCYSA-N	428.356	1.497	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)[C@H](OC(C)=O)C(C)C)[C@H]1c1cccnc1	1813030858	GUVRACFYCSVNHS-CADBVGFASA-N	439.940	1.929	50	20	IDGD	
O=C(NCCC(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](O)CCl)n[nH]1)c1ccc[nH]1	1814866999	BTBZXYOLPGOZJS-LSDHHAIUSA-N	436.900	1.150	50	20	IDGD	
CC1CCN(CC(=O)Nc2cc([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)CC1	1815069829	QQYGTFJHJNADOZ-GOSISDBHSA-N	447.584	1.507	50	20	IDGD	
Cc1c(C(=O)N[C@H]2CCc3nc(NC(=O)[C@H](F)Cl)sc3C2)cn2[nH]cnc(=O)c12	1817125328	LCPJVYJMXZWULC-SDBXPKJASA-N	438.872	1.548	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H]1CCCO1)CC2	1817282377	CYXNLCLHQVSLGM-AAVYNUALSA-N	444.517	1.368	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cccc(F)n2)[nH]n1)c1ccc(B(O)O)cc1	1817472127	JXLJMYNQSUKSEI-QGZVFWFLSA-N	437.240	1.243	50	20	IDGD	
O=C(/C=N/O[C@@H]1CCCCO1)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1	1819450181	HFTLCSRBTOHKBN-VAUGABELSA-N	427.889	1.531	50	20	IDGD	
Cn1nc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)[C@H](F)Br)n[nH]2)cc1O	1820931744	QCEDTAMAKRAQJQ-GWCFXTLKSA-N	429.250	1.845	50	20	IDGD	
O=C(Cn1cccc([N+](=O)[O-])c1=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](F)Cl)[nH]n1	1821736967	HMUUNDXEBIYZOJ-IAQYHMDHSA-N	440.819	1.706	50	20	IDGD	
CC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](C)[C@@H]1SC(=N)NC1=O)CC2	1822846026	VQMXDOFAZDATRD-NHRVJRKFSA-N	443.982	1.875	50	20	IDGD	
CN[C@H](CC(=O)N[C@@H]1CCc2nc(NC(=O)[C@](C)(Cl)CCl)sc2C1)C(=O)O	1822863619	QFSPTZADENKTPW-DOZZXWOPSA-N	437.349	1.354	50	20	IDGD	
O=C([C@@H]1Cc2ccccc2CN1)N1CCC([C@H]2CCCCN2C(=O)[C@@H](O)CCl)CC1	1824182992	NCVTXUUXGDUJRP-HBMCJLEFSA-N	433.980	1.920	50	20	IDGD	
O=C(c1coc(Cl)n1)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827055997	NGLGEQOHMFYSDY-SFHVURJKSA-N	445.712	1.555	50	20	IDGD	
C[C@H](NNc1ccccc1)C(=O)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1829814901	URVVZLZLVGXBRZ-IFXJQAMLSA-N	445.347	1.252	50	20	IDGD	
CN(C)c1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)nc1	1830359247	XXFHQRIPDFIKRA-NRFANRHFSA-N	438.956	1.483	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](O)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@H](O)CCl)CC1	1830666431	NRNUHRNDSDDRNU-ARFHVFGLSA-N	447.960	1.049	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(F)nc3F)C2)C1	1831640014	WUEUXCQFIBFGHY-AUUYWEPGSA-N	431.867	1.837	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3Cc4ccccc4CN3)C2)C1	1831647689	YBHBPFWUXWHXEK-SXWKCWPCSA-N	449.979	1.565	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C34CC(C(=O)OC)(C3)C4)C2)C1	1831657983	RUPCTCJGORSSGE-VWNGAAMTSA-N	442.940	1.194	50	20	IDGD	
O=C(Cc1ccc2ncccc2c1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1832031222	JVMTVAQZSXGSPG-FPOVZHCZSA-N	435.883	1.768	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)C3CCN(C(C)C)CC3)CCO2)C1	1832415010	GUZKJFQTHIPRQK-NQIIRXRSSA-N	429.989	1.581	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3ccco3)CCO2)C1	1833050645	APQNOYXSWPXFTH-RTBURBONSA-N	433.332	1.905	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)Br)CC2)CC1	1835830972	HZTRBWIFKUPIQA-ZIAGYGMSSA-N	443.386	1.032	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3n[nH]cc3[N+](=O)[O-])CC2)CC1	1835869310	PRRHLMGQUJUCLT-CQSZACIVSA-N	426.905	1.521	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cccc4nccn34)CC2)CC1	1836490602	ZHQZTBFMVFHFKJ-GOSISDBHSA-N	447.967	1.773	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)c3cncn3C)CC2)CC1	1837515333	XUFBPYFSQGZOSB-CYBMUJFWSA-N	427.343	1.816	50	20	IDGD	
CN(C)c1cccc(C(=O)N2CCOC[C@@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)c1	1837715111	WIXWUQCSFYDMTG-JOCHJYFZSA-N	449.624	1.674	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)Cn3cc(C)cn3)CC2)CC1	1837980765	IFHGWJIFCLYDKO-SFHVURJKSA-N	426.945	1.444	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)c(C)n1C	1838389706	MLFABAXUXHXKCE-KUHUBIRLSA-N	442.354	1.495	50	20	IDGD	
CC(C)n1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)n1	1838790197	POIQTSXJJMYYGV-KSSFIOAISA-N	443.342	1.317	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(O)cc3)CCO2)C1	1838971647	KGWJNPQBQHTUAR-SCLBCKFNSA-N	427.295	1.246	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(OC)c(F)c3)C2)C1	1839141455	JCGKXTOXWNFXTO-MGPUTAFESA-N	428.888	1.922	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cn(C)nc3C(F)F)C2)C1	1839144824	LKAZZQMKTBIKHO-ACJLOTCBSA-N	434.871	1.445	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cccnc3)C2)C1	1839152252	SGARUOAPYAITCX-MOPGFXCFSA-N	430.332	1.317	50	20	IDGD	
Cc1nc(F)ccc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839200077	DBJWYNBJDPQVAR-YOEHRIQHSA-N	448.264	1.290	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4ccsc4[nH]3)C2)C1	1840154660	BWGYJIHTMCHAPZ-IFXJQAMLSA-N	441.937	1.553	50	20	IDGD	
COc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)cc1F	1840187205	MGVNQBBQBPPFGY-GOSISDBHSA-N	435.279	1.708	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)cc1	1840190045	AMYUYDGOHCPVKY-IBGZPJMESA-N	444.315	1.519	50	20	IDGD	
O=C(c1c(C(F)(F)F)nc2ccc(F)cn12)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1	1841353475	ZWYMMECAEJTWGT-NSHDSACASA-N	448.804	1.909	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)c2cnc(C)[nH]2)C1	1841714813	RRPOHNGXBHZUQF-UHFFFAOYSA-N	427.417	1.682	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)CCCN2C(=O)c3ccccc3C2=O)C1	1841914730	VNFVIMHOERJNMT-KRWDZBQOSA-N	447.919	1.520	50	20	IDGD	
Cc1cc(C(=O)N2CCCC23CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C3)no1	1842496143	TUPJSHODRLWSGL-AWEZNQCLSA-N	426.901	1.932	50	20	IDGD	
O=C(c1cc2sccc2s1)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843011414	BDEAWXXERAJNCC-UHFFFAOYSA-N	426.328	1.773	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1cc(F)cc(F)c1)C2	1843416426	IYFOVVBGQCWWOI-DHRITJCHSA-N	429.427	1.916	50	20	IDGD	
COc1cc(C(=O)N2CC3(CCCN3C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)ccc1O	1843416498	REEAAHUUMKOVFO-ZVHZXABRSA-N	439.472	1.352	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC2(CCCN2C(=O)[C@H]2CN(Cc3ccccc3)CCO2)C1	1843924887	IXOVVTGXWBTJRA-HXUWFJFHSA-N	445.636	1.942	50	20	IDGD	
Cn1cc(C(=O)N2CCCC23CN(C(=O)[C@@H](F)Br)C3)c(C(F)(F)F)n1	1844465018	QORIRGOWDZXFTG-SNVBAGLBSA-N	427.196	1.946	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2cncc(C(F)(F)F)c2)C1	1844545606	NLUVJBBWCHIXTE-UHFFFAOYSA-N	448.405	1.230	50	20	IDGD	
O=C(OCCO)c1ccccc1C(=O)N1CC2(CCCN2C(=O)[C@@H](F)Br)C1	1845218696	WTSYRXZLHSVCIE-CQSZACIVSA-N	443.269	1.343	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC12CN(C(=O)CCn1c(=O)oc3ccccc31)C2	1846175649	KMZQOTBKNXSEIK-CYBMUJFWSA-N	436.306	1.971	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])C1	1847059126	XBLLZMVKNIBUTG-CSKARUKUSA-N	429.477	1.184	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](CO)NC(=O)OC(C)(C)C	1847498212	DHMNGVXGDZAVLL-RFGFWPKPSA-N	448.358	1.105	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H]1ON=C(c2ccccc2)O1	1847499318	WLSHWQNJEHJJDH-MOMAJJCNSA-N	436.306	1.954	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)NNC(=O)CC23CC4CC(CC(C4)C2)C3)ccc1OC	17186202	ZUJBRUSLWJOBIG-UHFFFAOYSA-N	435.546	1.971	50	20	IDGD	
CCCn1c(CCC(=O)NNC(=O)OC(C)(C)C)nc2cc(S(N)(=O)=O)ccc21	17398767	JBGICEOBQAFXHD-UHFFFAOYSA-N	425.511	1.582	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)c1cccc(S(=O)(=O)NC(C)C)c1	26736798	OSWJZUBSUHJOJX-UHFFFAOYSA-N	435.502	1.612	50	20	IDGD	
CCn1c(=O)c2ccccc2n(CC(=O)NNC(=O)c2cc3c(s2)CC[C@H](C)C3)c1=O	27331621	QEXZUTJTRRTZQY-ZDUSSCGKSA-N	440.525	1.831	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)CCNC(=O)OCC(F)(F)F)c2ccccc2c1=O	115784629	QPZYZPNHGCCZRH-UHFFFAOYSA-N	443.382	1.417	50	20	IDGD	
C[C@H]1CN(c2ccc(CNC(=O)NNC(=O)CNC(=O)c3ccco3)cc2F)C[C@@H](C)O1	725871657	PCUVUDLOPJHPON-OKILXGFUSA-N	447.467	1.293	50	20	IDGD	
COC(=O)[C@H](C)CNC(=O)/C(C#N)=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	726177868	XMGSAXXGHUHMKK-MLJKTZRHSA-N	443.891	1.911	50	20	IDGD	
C#CCNS(=O)(=O)c1cccc(C(=O)NNC(=S)Nc2ccc(OC)c(F)c2)c1	727499618	MYTLXPSRGMVBOO-UHFFFAOYSA-N	436.490	1.377	50	20	IDGD	
COc1cc(/C=C/C(=O)N([C@@H]2CCS(=O)(=O)C2)N(C)C)cc(Br)c1O	728178993	GRYNCZUYKKRMOI-ZYOFXKKJSA-N	433.324	1.669	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@@H](C)C(=O)NNC(=O)Cc1ccc(S(N)(=O)=O)cc1	728312305	LUZXBXQLZHIZHK-ZDUSSCGKSA-N	439.921	1.762	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)CCN2C(=O)c3ccccc3C2=O)c1	728529317	YSKSDHYHNYZRQG-UHFFFAOYSA-N	446.257	1.905	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)[C@@H]1CCCN1c1ncnc2sccc12	728600786	SWWBVRWRPMJEEC-HNNXBMFYSA-N	426.502	1.928	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2ccc(Br)cc2O)n1	728730711	GBACWSOAXDIYEM-UHFFFAOYSA-N	428.264	1.467	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)Cc1cccnc1)N1C(=O)c2ccc(Br)cc2C1=O	728852561	GJZGRAGQHMDMOW-JTQLQIEISA-N	431.246	1.219	50	20	IDGD	
Cc1nc2n(n1)C[C@@H](NC(=O)NNC(=O)c1ccc(Br)cc1Cl)CC2	729052750	VWYPHQZFHJHSGU-JTQLQIEISA-N	427.690	1.961	50	20	IDGD	
CC(=O)N1CCCc2cc(S(=O)(=O)NNC(=O)Cn3ccc4ccccc43)ccc21	729667408	OHVZYQPUJXNRCM-UHFFFAOYSA-N	426.498	1.950	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)cn1	729692717	ZKUHZKZTLHZAHU-UHFFFAOYSA-N	437.547	1.656	50	20	IDGD	
CCOCC(=O)NNC(=O)NCc1ccccc1CN1C(=O)NC2(CCCCC2)C1=O	731283211	DOHDDGUIAXZRPS-UHFFFAOYSA-N	431.493	1.308	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)c2nnn(-c3ccc4c(c3)OCCO4)c2C)c1	731454954	WLQVZNOUHGVDKK-UHFFFAOYSA-N	438.444	1.229	50	20	IDGD	
CC(C)(C)c1ccc(C(=O)N[C@@H](CCS(C)(=O)=O)C(=O)NNC(=O)C2CCC2)cc1	732141732	PCXCRIWLTCATHI-KRWDZBQOSA-N	437.562	1.465	50	20	IDGD	
Cc1c(C(=O)NNC(=O)CCN2C[C@H](C)O[C@@H](C)C2)nnn1-c1cccc2cnccc12	732260122	BAJAXGUQXPBFTM-GJZGRUSLSA-N	437.504	1.384	50	20	IDGD	
Cc1nn(C(F)F)c(C)c1CC(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	732332717	XXMIKIDZMTZKSO-UHFFFAOYSA-N	425.348	1.350	50	20	IDGD	
CC(C)C[C@H](C(=O)NNC(=O)c1cnn(-c2ccccc2)c1)N1C(=O)[C@H]2CC=CC[C@H]2C1=O	733108920	YUTLTYSFOFJDFX-HSALFYBXSA-N	449.511	1.999	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCCCC2)cc1S(=O)(=O)NNC(=O)NC1CCCC1	733249723	RBEIPXXJUGGZJM-UHFFFAOYSA-N	444.579	1.605	50	20	IDGD	
Cn1c(NNC(=O)c2ccc(S(=O)(=O)NC(C)(C)C)cc2)nc2ccccc2c1=O	733263629	NTKGWFFMYVAWLK-UHFFFAOYSA-N	429.502	1.767	50	20	IDGD	
Cc1sc(=O)n(CCC(=O)NNC(=O)COc2ccc(Br)cc2)c1C	734314125	NXBKYXMLKYKVQS-UHFFFAOYSA-N	428.308	1.906	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)CCc2cccc(F)c2F)CC1	735118324	RXCDYMGYSLERGL-UHFFFAOYSA-N	439.488	1.372	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)N[C@@H](Cc1ccccc1)CN1CCOCC1	739007007	RLYIZWVCZNCZPJ-NRFANRHFSA-N	426.517	1.477	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNS(=O)(=O)c1ccccc1S(N)(=O)=O	741646392	IDCCPIFDDRDKJY-ZDUSSCGKSA-N	449.510	1.264	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)c1ccc(N2CCCS2(=O)=O)cc1C	741659530	GSXILOUMXSSSCI-UHFFFAOYSA-N	433.486	1.384	50	20	IDGD	
Cc1nn(C)c2sc(C(=O)N[C@H](C)C(=O)NNC(=O)Cn3cnc4ccccc43)cc12	742034440	ZLBUQQLDJXSFEP-GFCCVEGCSA-N	439.501	1.259	50	20	IDGD	
CC[C@H](N=c1nn[nH]n1-c1ccccc1)C(=O)NNC(=O)c1cccc(Br)c1	742771781	APUDDTHKYJYNPC-HNNXBMFYSA-N	444.293	1.498	50	20	IDGD	
COc1ccc(N2CCN(CCNC(=O)NNC(=O)COc3cccc(C)c3)CC2)cc1	742947605	IWGLJUAUIGPNDT-UHFFFAOYSA-N	441.532	1.535	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(F)c(NC(=O)NNC(=O)COc2ccccc2O)c1	743182466	OKKSCBGYCQFVEF-UHFFFAOYSA-N	426.426	1.013	50	20	IDGD	
C[C@H]1C[C@@H](NC(=O)NNC(=O)c2cc3c(s2)CC[C@@H](C)C3)C(=O)N1c1cnn(C)c1	743510747	CZZHBBWFJXUABV-TYNCELHUSA-N	430.534	1.744	50	20	IDGD	
O=C(NCc1ccnc(N2CCOCC2)c1)NNC(=O)c1cccc(Br)c1	743530876	VKLJWTLULRHNSJ-UHFFFAOYSA-N	434.294	1.825	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)N(C)Cc1ccccc1	743606157	ZGHSFTFNRRTULA-OAHLLOKOSA-N	433.534	1.946	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)[C@@H]2CC(=O)N(c3ccc4c(c3)OCCO4)C2)cc1	743827919	UXIWALCBIKRQRJ-CQSZACIVSA-N	439.472	1.730	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2cccc(NC(=O)[C@@H]3CCCO3)c2)cc1	743830374	SYGAOIRGZDAVFJ-KRWDZBQOSA-N	446.485	1.674	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCC(C)(C)C[C@H](C)O)c1	745845060	HFINKYWRONRJES-AWEZNQCLSA-N	428.555	1.458	50	20	IDGD	
C[C@@]1(NNC(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CCS(=O)(=O)C1	745904125	MASFUUJOBHVWMA-FZKQIMNGSA-N	432.493	1.638	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)Cc2csc(NC(=O)c3ccoc3C)n2)c1	746306284	ABJLQAALIGFXSM-UHFFFAOYSA-N	442.457	1.654	50	20	IDGD	
COC(=O)[C@H]1CCC[C@@H](C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)C1	746332846	QHGGARYGCOXWPJ-CABCVRRESA-N	425.507	1.130	50	20	IDGD	
Cc1oc(C(=O)NNC(=O)Cc2cn3ccccc3n2)cc1S(=O)(=O)N1CCCC1	746545473	ORYIUPLUFSFMNS-UHFFFAOYSA-N	431.474	1.024	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)Cc1cn2ccccc2n1)n1nnc(-c2ccc(Cl)cc2)n1	746549151	NSQJGVJPJLEDGB-MRXNPFEDSA-N	438.879	1.982	50	20	IDGD	
Cc1cccc(N2CCN(CCCNC(=O)NNC(=O)Cc3cn4ccccc4n3)CC2)c1	746750435	PPLSNSXPTZICAL-UHFFFAOYSA-N	449.559	1.728	50	20	IDGD	
C[C@@H]1CN(Cc2cccc(CNC(=O)NNC(=O)Cc3cn4ccccc4n3)c2)CCO1	746754259	APMZFIYWTGZLQA-QGZVFWFLSA-N	436.516	1.628	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)N1CCc2ccccc21	746856467	QVCQHWZWKTZMNB-INIZCTEOSA-N	442.541	1.683	50	20	IDGD	
CC(=NNC(=O)Cc1cn2ccccc2n1)c1ccc(OCC(=O)N2CCOCC2)cc1	747636077	CFHBKLURJYPZPY-UHFFFAOYSA-N	435.484	1.655	50	20	IDGD	
COc1cc(OC)cc(N2CC[C@H](NC(=O)NNC(=O)c3cccc(N(C)C)c3)C2=O)c1	747952930	DWTWPQOJGZAMDO-IBGZPJMESA-N	441.488	1.519	50	20	IDGD	
NS(=O)(=O)c1cccc(N2C[C@H](C(=O)NNc3cc(F)c(F)c(F)c3)CC2=O)c1	748811843	JADJSWQIZLQLAA-SECBINFHSA-N	428.392	1.248	50	20	IDGD	
O=C(NNS(=O)(=O)c1cccc(S(=O)(=O)NC2CC2)c1)c1cc2ccccc2o1	749867083	LOAXZKVOTRZVRY-UHFFFAOYSA-N	435.483	1.497	50	20	IDGD	
Cc1cnc([C@@H](C)NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)s1	750665425	XGUCMUREFTWYCS-CYBMUJFWSA-N	437.547	1.941	50	20	IDGD	
O=C(CCCc1nc(-c2ccc(Cl)cc2)no1)NNC(=O)CNC(=O)c1ccco1	751200944	CPWJSSBZYSSNQQ-UHFFFAOYSA-N	431.836	1.883	50	20	IDGD	
C[C@H]1CCCN(c2ccc(C(=O)NNC(=O)CNC(=O)c3ccco3)cc2[N+](=O)[O-])C1	751211694	JITYIGIUXBIWJJ-ZDUSSCGKSA-N	429.433	1.615	50	20	IDGD	
N#Cc1ccc(NNC(=O)[C@H](CCC(N)=O)N2C(=O)c3ccccc3C2=O)cc1Cl	753322134	AXBXJAVHPLCXSL-INIZCTEOSA-N	425.832	1.585	50	20	IDGD	
Cc1oc(S(=O)(=O)N(C)C)cc1C(=O)NNc1nc(-c2ccccn2)nc2c1CCC2	753339258	JKBNAODDKZVBSB-UHFFFAOYSA-N	442.501	1.936	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNc2ccc(C(F)(F)F)nn2)c(C)c([N+](=O)[O-])c1	753853417	SLWKCVBZXZECLX-UHFFFAOYSA-N	442.310	1.580	50	20	IDGD	
CCn1nnnc1-c1cccc(NC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)c1	756674075	FRGFMKNWDSSAJL-UHFFFAOYSA-N	433.432	1.718	50	20	IDGD	
CCNC(=O)N1CCc2ccc(NC(=O)NNC(=O)c3nnc(O)c4ccccc34)cc21	756731221	ZUIQEAOGBXKEGX-UHFFFAOYSA-N	435.444	1.894	50	20	IDGD	
C[C@H]1CN(C(=O)Cn2cc(NC(=O)NNC(=O)c3cc4ccccc4o3)cn2)C[C@H](C)O1	756839012	PABMUGPSDXIPES-KBPBESRZSA-N	440.460	1.732	50	20	IDGD	
C[C@H]1CN(C(=O)Cn2cc(NC(=O)NNC(=O)Cc3ccccc3F)cn2)C[C@@H](C)O1	756840181	ULXXDJDELRVCDI-OKILXGFUSA-N	432.456	1.053	50	20	IDGD	
C[C@H]1CN(c2ccc(CNC(=O)NNC(=O)C(=O)Nc3ccccn3)cc2F)C[C@H](C)O1	758704073	WHFBUXMJXSUMQR-KBPBESRZSA-N	444.467	1.303	50	20	IDGD	
CCS(=O)(=O)N1CCC(CNC(=O)NNC(=O)Nc2ccc(N(C)C)cc2)CC1	758746685	XSRNCDQPGFSEHP-UHFFFAOYSA-N	426.543	1.150	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN(C(=O)c2ccc(Cl)cc2)C1)C(=O)Nc1ccccn1	758829656	FIVLASVEMMLJKW-AWEZNQCLSA-N	429.864	1.373	50	20	IDGD	
Cc1cc(C(=O)O)cc(S(=O)(=O)NNC(=O)c2ccccc2O)c1Br	762463812	WUAZWDLIRSWOSC-UHFFFAOYSA-N	429.248	1.785	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1ccc(C(N)=O)cc1)C(=O)NNC(=O)c1cccc2ccccc12	763051333	GLLHPEHDPCSONB-CYBMUJFWSA-N	440.481	1.067	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3cccnc3-n3cccn3)n[nH]2)cc1OC	763148366	KYQZJDUHQMGGIR-UHFFFAOYSA-N	433.428	1.749	50	20	IDGD	
Cc1c(Br)cc(C(=O)O)cc1S(=O)(=O)NNC(=O)c1cccc(C#N)c1	763282865	VPCIOLUEDBBXAU-UHFFFAOYSA-N	438.259	1.951	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3n2)cc1F	763449737	GWXAGWGISLYFEV-UHFFFAOYSA-N	426.404	1.799	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(C)c(S(=O)(=O)NC3CC3)c2)c(C)o1	763579995	SUHZFKFFAFSTRI-UHFFFAOYSA-N	434.474	1.045	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(N3CCOC[C@@H]3C)cc2)cc1	763659410	NQKMASPOMCBJNJ-HNNXBMFYSA-N	442.472	1.085	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(Br)ccc1F	763662915	MNSMVKHFFXYSHD-UHFFFAOYSA-N	440.225	1.762	50	20	IDGD	
O=C(COc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1cccnc1Br	763685446	VVZDQWZEXDIBNB-UHFFFAOYSA-N	427.642	1.662	50	20	IDGD	
CC(=O)Nc1ccc(Cl)c(NC(=O)C(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])c1	763802897	BVNZNQIZWYJXTG-UHFFFAOYSA-N	449.807	1.372	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(N3C(=O)CCC3=O)c(C)c2)cc1	763808483	BRVFIXWLFSNMKQ-UHFFFAOYSA-N	438.440	1.122	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccc(Br)nc1	763865106	IKTQOHXGKCQVSD-SECBINFHSA-N	425.214	1.537	50	20	IDGD	
N#CCOc1cc(F)ccc1NC(=O)C(=O)NNC(=O)c1ccc(Br)s1	763938243	CKSSODKIDYJSNM-UHFFFAOYSA-N	441.238	1.952	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3ccc4c(c3)NC(=O)[C@@H](C)O4)cc2C1	763943087	QRDHXCNNXYXXRC-WDEREUQCSA-N	442.497	1.992	50	20	IDGD	
O=C(NNC(=O)c1cc(Cl)ccc1O)C(=O)Nc1ccc(N2C(=O)CCCC2=O)cc1	763979401	UYMAUWSXRCRJNH-UHFFFAOYSA-N	444.831	1.489	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)on1)C(=O)Nc1ccccc1Cn1cncn1	764016183	IRIDBZBHJNFATE-UHFFFAOYSA-N	431.412	1.381	50	20	IDGD	
O=C1COc2cc(NC(=O)C(=O)NNC(=O)c3cccc(Br)c3)ccc2N1	764062771	CVIYIJIBEFPQDI-UHFFFAOYSA-N	433.218	1.180	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc([C@@H](C)N3CCOCC3)cc2)c(O)c1	764105618	WJTZQFXHJSHMHH-OAHLLOKOSA-N	426.473	1.494	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)N3CCC(C)CC3)cc2C)n[nH]1	764106549	MSMBACHRPUTXMQ-UHFFFAOYSA-N	426.477	1.298	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccc(N2CCO[C@@H](C)C2)cc1	764135967	KKXRXZAZNVMFOV-HNNXBMFYSA-N	426.473	1.249	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)C(=O)N1C[C@H]2CCCN2c2ccccc21	764204137	SNMIHXKFEZWCER-OAHLLOKOSA-N	445.520	1.454	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(-c3noc(C(F)F)n3)cc2)c1	764242421	QNCPUWAYFXDIFA-UHFFFAOYSA-N	426.339	1.946	50	20	IDGD	
O=C(NNC(=O)c1cccc(OC(F)F)c1)C(=O)Nc1cccc(N2CCCC2=O)c1	764250746	MQWLGVWJLWBXFV-UHFFFAOYSA-N	432.383	1.815	50	20	IDGD	
CCCOc1cc(F)ccc1NC(=O)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	764258892	CJKDIVRRQJXGLA-UHFFFAOYSA-N	444.467	1.407	50	20	IDGD	
NC(=O)c1cnn2c(C(=O)NNc3cc(C(F)(F)F)nc(-c4ccccn4)n3)ccnc12	764279737	LZILZUHVKXQQJG-UHFFFAOYSA-N	443.349	1.456	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)C(=O)Nc1cc(N2CCNC2=O)ccc1Cl	764313270	JVOAXATTWHODMJ-UHFFFAOYSA-N	433.827	1.337	50	20	IDGD	
COCC[S@](=O)Cc1cccc(NC(=O)C(=O)NNC(=O)Cc2ccccc2F)c1	764318252	FNCGMFLOKPRINN-PMERELPUSA-N	435.477	1.049	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)c1	765316992	HOKXYBYEIPXUHV-UHFFFAOYSA-N	446.501	1.142	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)c(F)c1)c1cccc(S(=O)(=O)N2CCOCC2)c1	765513814	XSMPTVHIKQVPRG-UHFFFAOYSA-N	441.868	1.575	50	20	IDGD	
CCS[C@@H](C)c1noc(CN(C)C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)n1	765634780	OPZOPTOYNCRCRE-NSHDSACASA-N	431.482	1.346	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)NCc1cccc(N2CCCS2(=O)=O)c1	765891021	JSFADHACCPHHQL-UHFFFAOYSA-N	436.465	1.275	50	20	IDGD	
O=C(NNc1cnccn1)C(=O)Nc1ccccc1N1CCN(CCc2ccncc2)CC1	766257372	VHKPCOCULJVRQU-UHFFFAOYSA-N	446.515	1.318	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)Cc2ccc(F)cc2Cl)CC1	768093073	IIVVZSCVGSFCMD-UHFFFAOYSA-N	441.916	1.496	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1F)C(=O)Nc1cc(C2CC2)nn1-c1ncccn1	768243426	VQXZCEGVWAQEQZ-UHFFFAOYSA-N	443.826	1.732	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)[C@@H](CCSC)NC(=O)c1ccco1	768634263	HMNWBZSKBOZWCE-GFCCVEGCSA-N	441.531	1.687	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)c2csc(-c3ncccc3F)n2)cc1	768659185	TYFHPSHOFNRNHB-UHFFFAOYSA-N	425.401	1.834	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)N2CCC(C(=O)NCCCO)CC2)c(C)n1C[C@@H]1CCCO1	769333648	FHGGCOFJKPTFPC-AMUNLKFJSA-N	442.560	1.928	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)c2ncccc12	770771850	PBMUUJIXBXJIMW-UHFFFAOYSA-N	445.476	1.634	50	20	IDGD	
CSc1cccc(C)c1NC(=O)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	770772044	SSABRHHGUOMQPM-UHFFFAOYSA-N	428.518	1.509	50	20	IDGD	
COc1ccc(C(=O)NNc2nc(O)c3cnn(C)c3n2)c(I)c1	770984193	UHUQTCYHVQEHDZ-UHFFFAOYSA-N	440.201	1.439	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)CCCNS(=O)(=O)c1ccc2c(c1)CCCC2	771915548	KMQHCKQSUSQOKA-AWEZNQCLSA-N	439.534	1.113	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)[C@@H]1CCCN(C(=O)c2ccccc2OC(F)F)C1	771987638	GHOPILFXEONMPD-CHWSQXEVSA-N	441.431	1.629	50	20	IDGD	
CCn1cnc2c1c(=O)n(CC(=O)NN=C1CCO[C@H](C)C1)c(=O)n2Cc1ccccc1	773193116	ODFUCYZVYNAFSA-OAHLLOKOSA-N	438.488	1.099	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CC(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1ccccc1	773263738	ZTLGHNMCYSFGEM-CABCVRRESA-N	425.507	1.225	50	20	IDGD	
CC(=O)NCCc1ccc(S(=O)(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)cc1	773265917	QIWLBNWZNWNRIL-ZDUSSCGKSA-N	439.921	1.796	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)CNC(=O)OCC(F)(F)F)C1	773411546	NXSHZGZJYMBVFJ-JTQLQIEISA-N	426.392	1.069	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2cccs2)[nH]n1)C(=O)Nc1ccc(Br)cn1	773546997	QYIBWQLLNPAKAP-UHFFFAOYSA-N	435.263	1.695	50	20	IDGD	
O=C(NNc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccccc1S(=O)(=O)N1CCCCC1	773644650	QBALGINQKISYBX-UHFFFAOYSA-N	447.473	1.851	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)NCCCCCS(C)(=O)=O)cc1Cl	773709726	ODXTZUZUEKXUDZ-UHFFFAOYSA-N	436.918	1.908	50	20	IDGD	
CC(=O)N(C)c1cccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)c1	774001913	LIZVHJASZNQYFM-GFCCVEGCSA-N	432.864	1.876	50	20	IDGD	
COc1ccc2c(c1)C[C@@H](C(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1)CO2	776202750	WRDYMATWFZWCHW-MRXNPFEDSA-N	448.520	1.882	50	20	IDGD	
CN(NC(=O)CSC[C@@H]1CCCCO1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776204670	DSHDGWFSDPSJCO-HNNXBMFYSA-N	430.571	1.924	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)N[C@@H]2CC(=O)N(CCOc3ccccc3)C2)c1	776620754	UTKHRBUWEXJJFK-MRXNPFEDSA-N	432.502	1.396	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)c1cc([N+](=O)[O-])c2nsnc2c1	777800825	RTJGYRKNQJQHCQ-UHFFFAOYSA-N	434.459	1.797	50	20	IDGD	
COC(=O)Cc1cccc(C(=O)NNC(=O)c2cc(-c3ccc(OC)c(OC)c3)[nH]n2)c1	777812598	HVVUPUMHSIRVRU-UHFFFAOYSA-N	438.440	1.884	50	20	IDGD	
O=C(CSc1ccc([N+](=O)[O-])cc1)N1CCN(S(=O)(=O)CBr)CC1	777832591	OABUEZHPQXHAIU-UHFFFAOYSA-N	438.325	1.513	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)C(=O)Nc1cc(Cl)ccc1OC[C@H]1CCOC1	778715398	WIWNGYHKPDRMKN-ZDUSSCGKSA-N	432.864	1.858	50	20	IDGD	
O=C(NNc1ccccc1OC(F)(F)F)C(=O)Nc1cnn(CCN2CCOCC2)c1	778798320	CQSKKJCCJPLRIL-UHFFFAOYSA-N	442.398	1.196	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NCC(=O)NNc1ccc([N+](=O)[O-])cc1Br	779148583	WNDBYJHXUMILBG-UHFFFAOYSA-N	446.258	1.441	50	20	IDGD	
Cc1nn(-c2cncc3nnnn23)c(C)c1CC(=O)NNc1ccccc1OC(F)(F)F	779217312	OOTKOLUJCINIQI-UHFFFAOYSA-N	447.381	1.906	50	20	IDGD	
COc1cccc(/C=C(\C#N)C(=O)O[C@H](C(=O)N[C@@]2(C)CCS(=O)(=O)C2)C(C)C)c1	782445005	BNIBDXBDQNJBHP-IGFQPDJCSA-N	434.514	1.863	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)N1CCO[C@H](c2ccc(C(F)(F)F)cc2)C1	782502294	DUFCCWGEZQASHI-HNNXBMFYSA-N	440.378	1.843	50	20	IDGD	
CN(C)C(=O)C[C@H]1CN(C(=O)C(=O)NNC(=O)c2ccc(O)cc2)c2ccc(Cl)cc21	782833183	YCSRIAUOEJRWLH-ZDUSSCGKSA-N	444.875	1.415	50	20	IDGD	
Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)C(=O)NN[C@@]1(C)CCS(=O)(=O)C1	783427937	UVDNRHMQWGLVBI-NRFANRHFSA-N	442.497	1.796	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1ccccc1OC1CCCC1	784005106	OTFFPZRUNQRYIC-UHFFFAOYSA-N	430.486	1.585	50	20	IDGD	
N#Cc1ccc(NNC(=O)C(=O)Nc2cccc(S(N)(=O)=O)c2)cc1C(F)(F)F	784239482	FNCBIAJKQXRVSC-UHFFFAOYSA-N	427.364	1.306	50	20	IDGD	
CNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3cc(C)ccc3C)[nH]n2)cc1	785127964	KHXCCCGYHQULQZ-UHFFFAOYSA-N	434.456	1.453	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2ccc(N3CCOCC3)c(C)c2)n1	785225154	FOPBPKFWFALGSH-UHFFFAOYSA-N	427.509	1.550	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2ccc(C(=O)N(C)C)c(Cl)c2)n1	785225784	LCAYNFALSMYRMP-UHFFFAOYSA-N	433.900	1.760	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)[C@H]3CCCN3c3ccccc3)cc2)CC1	787461142	KQHHDDUDBAMMDJ-OAQYLSRUSA-N	443.573	1.735	50	20	IDGD	
CCS(=O)(=O)CCn1cc(C)c(NC(=O)C(=O)NNc2nc3ccccc3s2)n1	787557957	QBFJWHWYKJQJLU-UHFFFAOYSA-N	436.519	1.318	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)c1cccc(S(=O)(=O)NC2CCCC2)c1	788178473	RCWLRQCHRWLEJU-UHFFFAOYSA-N	427.490	1.640	50	20	IDGD	
CS(=O)(=O)c1cc(NC(=O)NNC(=O)c2nnc(O)c3ccccc23)ccc1Cl	788302027	RUAXSBRSWWKAGI-UHFFFAOYSA-N	435.849	1.859	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2)[C@H]1OCC[C@H]1c1ccccc1	788500544	MIJWDBKPOCLYET-UGSOOPFHSA-N	449.441	1.248	50	20	IDGD	
CC(C)Oc1cc(NC(=O)C(=O)NNC(=O)c2cccc3ncccc23)ccc1C(N)=O	789735525	QZBOKFSHVXNHOZ-UHFFFAOYSA-N	435.440	1.521	50	20	IDGD	
CCOC(=O)c1c(F)cccc1NC(=O)C(=O)NNC(=O)[C@H]1OCC[C@H]1c1ccccc1	789810426	NDRKPMOVTIIONX-KSSFIOAISA-N	443.431	1.661	50	20	IDGD	
COc1cc(Cl)c(S(=O)(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1C(=O)O	790382309	AVXUWUATZCARTG-UHFFFAOYSA-N	442.833	1.441	50	20	IDGD	
CO[C@@H]1CCOc2c(NC(=O)C(=O)NNC(=O)c3cc(Br)c[nH]3)cccc21	790951467	FUXWYCJYKIIIJS-CYBMUJFWSA-N	437.250	1.647	50	20	IDGD	
COCC(=O)N1CCc2cc(NC(=O)C(=O)NNc3cccc(F)c3[N+](=O)[O-])ccc21	790996839	HEIRDYHBULDAPD-UHFFFAOYSA-N	431.380	1.351	50	20	IDGD	
Cc1c(S(=O)(=O)NNC(=O)[C@@H]2Cc3ccccc3CN2Cc2ccccc2)cnn1C	793385766	QTXYDYAUVXJPMY-FQEVSTJZSA-N	439.541	1.665	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1)N(C)CC(F)(F)F	793520470	VWLRSPWLYSRSCE-NSHDSACASA-N	425.452	1.599	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)c2cc(S(=O)(=O)NCCCN(C)C)ccc2C)n1	794072823	QLUXCRBUSIQBLR-UHFFFAOYSA-N	433.534	1.003	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)C[C@@H]1COCCN1C(=O)OC(C)(C)C	794772652	CPUOUOUGAIUKBN-OAHLLOKOSA-N	445.520	1.772	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CCC(=O)Nc2nnc(CC(C)C)s2)cc1C	798307709	CBEFCOYBQHKPKA-UHFFFAOYSA-N	446.533	1.858	50	20	IDGD	
CCOc1cccc(S(=O)(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)c1	800124794	PRUCNFUYGPJICR-UHFFFAOYSA-N	442.538	1.883	50	20	IDGD	
NS(=O)(=O)c1ccc(CCC(=O)NNC(=O)Nc2ccc(Br)cc2)cc1	801995148	ZIZDPURABZIPQG-UHFFFAOYSA-N	441.307	1.882	50	20	IDGD	
CCOC(=O)[C@@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)Nc1cc(OC)ccc1Cl	802113016	ADWZZMWGYRKWTN-ZDUSSCGKSA-N	444.872	1.958	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCCC1(O)CCOCC1	804879341	DMXJUSWDOAEQHB-GFCCVEGCSA-N	430.299	1.478	50	20	IDGD	
CN(C[C@@H]1CCCN(C(=O)NNC(=O)c2c(Cl)cccc2Cl)C1)S(C)(=O)=O	805061502	JTVLUEXPBCOEEI-NSHDSACASA-N	437.349	1.951	50	20	IDGD	
CCc1nnc(NC(=O)[C@@H](C)[C@H](C)NC(=O)NNc2ccc(-n3cccn3)nn2)s1	807565169	HTTJTROGFHZGFN-QWRGUYRKSA-N	430.498	1.366	50	20	IDGD	
CCOC(=O)Cc1csc(NC(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)n1	812313472	HBZPXNVOHJFASK-UHFFFAOYSA-N	427.508	1.648	50	20	IDGD	
CC1(C)NC(=O)N(c2cccc(NC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)c2)C1=O	812973910	MESRHSHNHLPRBO-UHFFFAOYSA-N	426.389	1.896	50	20	IDGD	
Cc1cnc(Br)c(NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)c1	812979492	AEQFSWQOVBBDJQ-UHFFFAOYSA-N	427.642	1.911	50	20	IDGD	
COC(=O)c1cn(-c2cccc(NC(=O)C(=O)NNc3nc4ccccc4s3)c2)nn1	812982418	KOKFJQHOZLUJCR-UHFFFAOYSA-N	437.441	1.745	50	20	IDGD	
COC(=O)c1cn(-c2cccc(NC(=O)C(=O)NNc3ccc(OC(F)F)cc3)c2)nn1	812985214	MDSHKNCGUWITCT-UHFFFAOYSA-N	446.370	1.737	50	20	IDGD	
CCCc1nnc(SCC(=O)NNC(=O)c2ccc(COc3ccccc3)o2)n1N	813369049	WJFOWHLBGBHGKT-UHFFFAOYSA-N	430.490	1.670	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)C1CCC(OC[C@H]2CCCO2)CC1	815346655	LSSPTGSHFBLCBK-LYBXBRPPSA-N	432.517	1.983	50	20	IDGD	
CC[C@@H](C)Sc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2CCc3nncn3C2)c(C)c1	815692588	VNHAXCLKMOPHOT-KGLIPLIRSA-N	430.534	1.826	50	20	IDGD	
N#C/C(=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)OC[C@@H]1CNC(=O)O1	914005698	UTKWRMCKVMICJI-DJXGBFBFSA-N	443.847	1.637	50	20	IDGD	
CN(C)N(C(=O)[C@H]1CC(=O)N(c2cccc(Br)c2)C1)[C@@H]1CCS(=O)(=O)C1	914437343	HSJKPMJABXPWEP-SWLSCSKDSA-N	444.351	1.294	50	20	IDGD	
C[C@H]1NC(C(=O)NNC(=O)c2ccc(Br)s2)=NN(c2ccccc2)C1=O	915189064	ZZAJILCKFKAFJV-SECBINFHSA-N	436.291	1.610	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)NCC2(N3CCOCC3)CCCCC2)cc1C	915896416	DBPIYWDYGDGQLI-UHFFFAOYSA-N	431.537	1.607	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)NC[C@@H](c1cccs1)N1CCN(C)CC1	915902069	PINIJCNTIPOEKO-INIZCTEOSA-N	447.561	1.455	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)c3cccc[n+]3[O-])c2)cc1	916095810	ZXHJFRGWXIWLQU-UHFFFAOYSA-N	442.453	1.204	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NCCNc2ccc(C#N)cn2)c2ccccc2c1=O	916522134	ZENKPDQUTXEKAR-UHFFFAOYSA-N	448.487	1.519	50	20	IDGD	
Cc1ccc(F)c(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1	917718298	QUHYYFNBDFOCGA-UHFFFAOYSA-N	441.506	1.542	50	20	IDGD	
COc1ccccc1C(=O)N[C@@H](CCSC)C(=O)NNC(=O)c1cccc(OC)c1O	919756987	QXDDJMAHEAKTIU-HNNXBMFYSA-N	447.513	1.722	50	20	IDGD	
Cc1ccc(-c2nn(CCC#N)cc2C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)cc1C	920852785	WEBBJVNUQBUCQW-INIZCTEOSA-N	429.502	1.276	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)NCCN2CCN(S(C)(=O)=O)CC2)c(C)n1CCC(C)C	921164968	BRDXYLVUIIXXQU-RCCKNPSSSA-N	449.621	1.751	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)Nc2cccc3c2OCC(=O)N3)CC1	1261201647	JNJNSCKXQGRKOB-UHFFFAOYSA-N	433.465	1.817	50	20	IDGD	
CCc1cc(OCC(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)ccc1Cl	1318295001	IQVKYQOBYQNWGO-GOSISDBHSA-N	448.859	1.812	50	20	IDGD	
NC(=O)C1CCN(C(=O)C2CCN(C(=O)NNC(=O)c3cc4ccccc4o3)CC2)CC1	1323564910	AXSNVKABVYQOJX-UHFFFAOYSA-N	441.488	1.223	50	20	IDGD	
C=C[C@H](COC)NC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	1325634146	FPHZXNBHRHAOQP-QGZVFWFLSA-N	432.502	1.310	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2)c1cc2sccn2c1	1777824362	CEJLWTTUKBRQLZ-SPYBWZPUSA-N	425.938	1.728	50	20	IDGD	
Cc1nc[nH]c1CSCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1778914424	RWKBVOROKJJIEA-GOEBONIOSA-N	449.346	1.472	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnc3[nH]ncc3c2)C1	1778941808	UCCHIROWWQFXEC-RZQQEMMASA-N	435.912	1.339	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)c3ccc4occc4c3)CCO2)C1	1779032717	WVBGSZKRDHNVTC-QHCPKHFHSA-N	449.467	1.189	50	20	IDGD	
O=C(/C=N/O[C@H]1CCCCO1)N1CC[C@]2(C1)CN(C(=O)CCBr)CCO2	1779101144	KHCCEJFXVDVQOK-OTMUCCKHSA-N	432.315	1.130	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(CCN(C(=O)/C=N/O[C@@H]3CCCCO3)C2)C1	1779103792	YZQQOBPFESSDIR-FRJAKYGPSA-N	427.574	1.197	50	20	IDGD	
CN1CCCC[C@H]1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Br)C2	1780593403	QWHILTAHSBDXRH-LUXYFRNMSA-N	434.350	1.675	50	20	IDGD	
COc1cc(OC)cc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)c1	1780662325	VWEGRDLWNMLOQK-BFUOFWGJSA-N	441.322	1.931	50	20	IDGD	
Cc1ncccc1CCC(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781325514	DQGYNCQWHVPAGL-SJLPKXTDSA-N	428.302	1.843	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)C2)C1	1781938246	FFFVBXOETNVRAO-ZWKOTPCHSA-N	446.287	1.980	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(O)ccc3O)C2)C1	1782042589	LAQDFOJPOJWVAF-XIKOKIGWSA-N	427.295	1.572	50	20	IDGD	
Cc1cc(CC(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](F)Br)C3)no1	1782464371	RUJYUZOKYJZIMP-FRFSOERESA-N	432.290	1.730	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)C[C@H]3COc4ccccc4O3)CCO2)C1	1783870850	HIQKPTZCTYNYKB-CKJXQJPGSA-N	438.908	1.300	50	20	IDGD	
C[C@H](C#N)c1cccc(C(=O)N2CCO[C@@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)c1	1783937848	PBLZAMUGIXEAHL-UZUQRXQVSA-N	441.532	1.130	50	20	IDGD	
CN(CC(=O)N1CCO[C@@]2(CCN(C(=O)C(Cl)Cl)C2)C1)C(=O)c1ccccc1	1783943509	ZGYCWTUYHPHYIY-IBGZPJMESA-N	428.316	1.392	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)Cc3cc(F)ccc3OC)C2)C1	1784087810	QRFPLLJJTJOHET-OXJNMPFZSA-N	428.888	1.461	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3cnc[nH]3)[C@H]2C1	1785223539	LXEZNAWAHWSUOR-TUUVXOQKSA-N	427.343	1.496	50	20	IDGD	
Cc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](O)CCl)C[C@@H]32)c(C(F)(F)F)o1	1786063409	ZQCRKQFMYQSDJL-DEQVHRJGSA-N	438.830	1.800	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)COc3ccccc3)[C@H]2C1	1786485952	PPMNCITXZSVGQM-OHFALNGGSA-N	425.323	1.829	50	20	IDGD	
Cn1c(=O)c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Cl)C[C@@H]32)nc2ccccc21	1787974399	HGFPRSGIBFMMTA-HJXMPXNTSA-N	436.871	1.061	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(OC)cc3OC)[C@H]2C1	1789470325	BJLUJWKYGIIQSU-KUZCPNRJSA-N	440.924	1.551	50	20	IDGD	
CCc1cc(C(=O)Nc2ccc(C3(NC(=O)c4ccc(B(O)O)cc4)CCC3)cc2)no1	1789843762	ISWDMYWJIIZZQD-UHFFFAOYSA-N	433.273	1.978	50	20	IDGD	
CC(C)n1cnc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]3C2)n1	1789922915	NVXQQQGECYYENF-CYDGBPFRSA-N	432.294	1.143	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3[C@H]4SC=C[C@H]43)[C@H]2C1	1790622544	NQPYTRYVRZYLKP-TYSGWJLXSA-N	429.380	1.872	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](CC)NC(C)=O)C[C@@H]21	1790958102	INRSOUKKOBDDJC-RBZJEDDUSA-N	432.359	1.054	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4cnccc4[nH]3)C[C@@H]21	1791056161	PGCVFTMTDJKCPN-GWIFVGGISA-N	435.322	1.940	50	20	IDGD	
Cc1ncc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCBr)C[C@@H]32)s1	1791587750	BWEXMYFRJQQVII-QEJZJMRPSA-N	430.368	1.759	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1ccc(C2(NC(=O)CN3CCCC3=O)CCC2)cc1	1791600165	SDWBBMYUQBHZNW-UHFFFAOYSA-N	429.521	1.116	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCCn1ccnc1)C2	1792873056	KDDRFCDLQBBXIW-MPTYRVRUSA-N	427.343	1.284	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccccc1C(N)=O)C2	1792874647	WBLSODBDWVSGNP-NFFDBFGFSA-N	438.322	1.020	50	20	IDGD	
O=C(CCCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2)Nc1ccccc1	1792937139	OADXNMPHRVZXAG-FTUNRGFVSA-N	425.888	1.919	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccnc(C(F)F)c1)c1cccc(B(O)O)c1	1794566299	OLURZFYFYMBTTN-BJWYYQGGSA-N	429.232	1.265	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCOc1ccccc1	1795498484	SDQIOZPXLFISBH-BJWYYQGGSA-N	437.500	1.406	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1noc2ccccc12	1795766250	XKXHFSLCSDDZAN-JWXAPSBJSA-N	436.306	1.743	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1COc3ccccc3O1)C2	1797952714	ICFHPZYQDRVVLF-ZDUSMZPESA-N	434.565	1.268	50	20	IDGD	
C[C@H](Sc1cccs1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc(B(O)O)c1)C2	1798280363	NIAYOXLSCMLAMY-RUGDWHBFSA-N	444.387	1.861	50	20	IDGD	
COc1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)c(F)c1	1798442058	TYUNNVFDSSFTMP-BTTYYORXSA-N	441.463	1.398	50	20	IDGD	
CC(C)n1nccc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnccc1C(=O)NN)C2	1798833415	ONJDLKYNROCGDL-QDMKHBRRSA-N	425.493	1.028	50	20	IDGD	
COc1cc(C)ccc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Br	1799352421	WIEJMYVXKYKYAB-NOXHYTERSA-N	429.286	1.897	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c(O)cc(O)cc1O)C2	1800643243	NGQDOJARZLTWJP-DXCMXYRUSA-N	443.294	1.180	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)Oc1ccccn1)C2	1800643967	ALVFLSAKDBMLQF-XGYYKPKNSA-N	440.338	1.612	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)Cc1ccccc1)C2	1800644479	VTEIWGWCXDOCEY-MDMSPXHWSA-N	439.350	1.353	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3ncsc3[nH]1)C2	1800759150	IUMBTEPQGPBYQU-ORXSELOVSA-N	427.324	1.611	50	20	IDGD	
O=C1CC[C@H](C(=O)NC[C@H]2CCN(C(=O)CCBr)[C@H]2c2cccnc2)CN1	1802609305	JAULJHVHPINOOY-VKJFTORMSA-N	437.338	1.399	50	20	IDGD	
COCCOCC(=O)N1CC[C@H](CNC(=O)[C@H](C)CBr)[C@@H]1c1cccnc1	1803007376	CAKBGUXDTWAACZ-KYJSFNMBSA-N	442.354	1.781	50	20	IDGD	
COc1cccnc1CCC(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1	1804453368	ICXIFBREYAXUQR-MDKPJZGXSA-N	446.935	1.724	50	20	IDGD	
Cc1c(F)cccc1C(=O)N1CCCC2(CCN(C(=O)c3ccc(B(O)O)cc3)CC2)C1	1805110205	ZJDNKXRDKJWTRS-UHFFFAOYSA-N	438.308	1.973	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)[C@H]2CC=CCC2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1	1807374075	XGUFMDRFYGLXLO-UCNVEGJOSA-N	433.317	1.437	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NC[C@H]1CCN(C(=O)C(Cl)Cl)[C@@H]1c1cccnc1	1807595980	NMBWCZBKHLEXQI-CZUORRHYSA-N	439.299	1.914	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@H](CNC(=O)c2cnc(O)nc2O)[C@@H]1c1cccnc1	1808280232	JULOTVLCUXLZNW-YOEHRIQHSA-N	445.552	1.454	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1CCN(C(=O)CN2CCCC2=O)[C@@H]1c1cccnc1	1808295347	GUOVPOPSNRIKDU-CVAIRZPRSA-N	441.359	1.946	50	20	IDGD	
N#Cc1cc(CC(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)ccc1F	1808550359	VGNYPTOREPHFOB-LRQRDZAKSA-N	444.894	1.941	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cnsn2)[C@H]1c1cccnc1)[C@H](F)Br	1808652204	WEYLAMVAKZQHKI-DRZSPHRISA-N	428.287	1.943	50	20	IDGD	
Cc1cccnc1CCC(=O)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1	1809974987	MAPFMDHSVRZOKX-UHFFFAOYSA-N	449.360	1.547	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)c2ccc[nH]2)[C@H]1c1cccnc1	1810303549	VDAHZDCXPJJSML-BEFAXECRSA-N	433.472	1.042	50	20	IDGD	
C#CCCCC(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1	1810305942	QXNLRMVISFTKNX-LAUBAEHRSA-N	434.500	1.203	50	20	IDGD	
C[C@H](Nc1ccccn1)C(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1	1810569691	QQDJRQFSUVIKDN-ITQYTPKQSA-N	431.924	1.583	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2ccc(OC)nn2)[C@@H]1c1cccnc1	1813031866	RZCWSKSQDBBROB-RVKKMQEKSA-N	433.896	1.454	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H]3CCC(=O)N3)sc2C1	1814040086	BINAQLJPWUNRPC-QXEWZRGKSA-N	429.340	1.365	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)C(C)(C)CNC(C)=O)n[nH]1	1815343048	VHJYGLBEJXAEPV-UKRRQHHQSA-N	427.933	1.818	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CNC(=O)c2cccnc2)n[nH]1	1815785892	CUIWVRYTGYARRZ-GOEBONIOSA-N	448.911	1.481	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2[nH]cc3c2CCC3)n[nH]1	1820107026	FATNJPJYCZAGBL-QGZVFWFLSA-N	441.536	1.905	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1)c1cc(-n2ccnc2)ccn1	1820341246	CRISWOBMHXEFGX-SJORKVTESA-N	443.895	1.896	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)CN2CCOCC2)[nH]n1)[C@@H](F)Br	1820931904	ATZPDDIOLQJBRA-IUODEOHRSA-N	432.294	1.425	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1822185206	YYCGYNYKQNSCLU-IAQYHMDHSA-N	449.114	1.179	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(F)nc2)[nH]n1	1822415277	XQHXQPMJJQDERX-OAHLLOKOSA-N	431.472	1.623	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)/C=C/c2cnc[nH]2)n[nH]1	1822664840	OBSDFCFFNNUVLW-MOEXGYKKSA-N	428.497	1.211	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CN1CCOCC1)CC2	1822863466	KVCOFWKNZSSCEK-APPDUMDISA-N	435.377	1.624	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)N[C@H]1CCc2nc(NC(=O)[C@](C)(Cl)CCl)sc2C1	1822868122	SDRZHMHJKYJROW-GPHJXTMHSA-N	433.361	1.982	50	20	IDGD	
CC(C)CNC(=O)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1	1823005336	WZKMWEABFDCRAM-LDYMZIIASA-N	435.319	1.518	50	20	IDGD	
CN1CCCC[C@H]1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827056443	ZRESNRXZXQJSHN-VXKWHMMOSA-N	441.381	1.084	50	20	IDGD	
Cc1nc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)cs1	1827056519	WGROFPQZEWNMQF-FQEVSTJZSA-N	441.362	1.678	50	20	IDGD	
C[C@@H](Nc1nccs1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830358044	OSHWZHNNCVDCEH-AUUYWEPGSA-N	444.985	1.665	50	20	IDGD	
Cc1nn(C)c(C)c1CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830370831	ZNLVPNRWKWTHKW-OAQYLSRUSA-N	440.972	1.301	50	20	IDGD	
Cc1ocnc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2	1830543554	UBNZAJCPPAMITC-SJCJKPOMSA-N	430.299	1.084	50	20	IDGD	
C#CCCCCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2	1830544274	SYGNTVHSSXHJKS-LPHOPBHVSA-N	429.355	1.667	50	20	IDGD	
O=C(c1cc2ccoc2s1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1830723903	TWSSYPNEABJUSP-UGSOOPFHSA-N	428.894	1.164	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)/C=C/c3ccc([N+](=O)[O-])o3)CCO2)C1	1830910030	HSVWCMTVNNSIKP-BTESVEOXSA-N	441.868	1.675	50	20	IDGD	
CC(=O)C[C@@H](C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1	1831798826	ICALQFNBTCBRMI-IERDGZPVSA-N	428.338	1.215	50	20	IDGD	
Cc1onc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@](C)(Cl)CCl)C3)C2)c1C	1831981931	KCLBEMPTWXBGIE-QZTJIDSGSA-N	434.320	1.598	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)CC[C@@H]2CCOC2)CC1	1832452807	NBXAWMXRJILIFQ-GCJKJVERSA-N	442.365	1.416	50	20	IDGD	
Cc1ccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)cn1	1833133533	IGHYADTZXRZFGR-DNVCBOLYSA-N	440.338	1.172	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)Cc3c(F)cccc3F)CC2)CC1)[C@@H](O)CCl	1833313238	BJLXGOISWANAKI-IBGZPJMESA-N	443.922	1.679	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)CCN3CCOC3=O)CC2)CC1	1833532719	GTFNVLKQSYILAX-GOSISDBHSA-N	442.988	1.808	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3csnn3)CC2)CC1	1833559212	UMLPUNGZOAXXEX-LLVKDONJSA-N	430.372	1.507	50	20	IDGD	
O=C(c1cccnc1OCC1CC1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1833625334	PVPALVNGVGSVKR-JXFKEZNVSA-N	441.887	1.475	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)c3cnn(C)c3)CC2)CC1	1834190403	CMYFDPUIPPYTBD-CQSZACIVSA-N	440.386	1.636	50	20	IDGD	
CC(=O)CCC(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)CBr)CC2)CC1	1834435921	CLSANHWFNXOMLE-AWEZNQCLSA-N	430.387	1.958	50	20	IDGD	
Cc1cccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)c1	1835042378	OMOCWKBLOMNMHQ-IEBWSBKVSA-N	443.313	1.684	50	20	IDGD	
C/C=C(/C)C(=O)N1CCC(N2CCC(NC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CC2)CC1	1835117809	MRCRTBDKBHYVHX-BZZJDFHSSA-N	442.564	1.658	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)COc3ccc(C)cc3)CCO2)C1	1835166271	FATJUOPMXKRIIN-GHTZIAJQSA-N	440.924	1.084	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3ccn4nccc4c3)CC2)CC1	1835630633	LEZLWBHMKKWZES-HXUWFJFHSA-N	447.967	1.773	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](CN)c3ccccc3)CCO2)C1	1835813481	QLPPIEUAMLIUOS-XMSQKQJNSA-N	437.968	1.450	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(CN(C(=O)CCc3ccsc3)CCO2)C1	1836005749	KTZNGCDTWMDLBJ-FQEVSTJZSA-N	440.638	1.989	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCC(N2CCC(NC(=O)c3cc[n+]([O-])cc3)CC2)CC1	1836052689	SYIORORPWWGSBX-HXUWFJFHSA-N	443.375	1.742	50	20	IDGD	
N#Cc1ccccc1OCC(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836720107	JFRRPIYVBBSTHX-IBGZPJMESA-N	449.935	1.535	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnn(C)c3Cl)CCO2)C1	1838305626	OCMYXAPHAXIBFN-RDTXWAMCSA-N	433.336	1.551	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(C(C)C)no3)CCO2)C1	1838779015	OEGIZIZSYZWCKN-LIRRHRJNSA-N	429.901	1.122	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cncc(F)c3)C2)C1	1839963371	IWPFQDWGHWXAOW-QAPCUYQASA-N	444.301	1.464	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3ccnc(C)c3)C2)C1	1840149900	AQLXEFYUFKUUFG-NQIIRXRSSA-N	439.940	1.033	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)/C(C)=C/c3cccnc3)C2)C1	1840156121	OFTFOGWKWJKWOG-FCAYMYRWSA-N	437.924	1.195	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3ncc[nH]3)CCO2)C1	1840325784	SKASLRXQEDSDNX-ROUUACIJSA-N	433.336	1.035	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)Oc1ccccn1)CCO2	1840422719	IBRBGUVURWSQOQ-XGHQBKJUSA-N	439.940	1.713	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@]1(C)CC1(F)F)CCO2	1840823348	QFLIBCOCBHTJIJ-DAXOMENPSA-N	439.297	1.519	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)c2c(Cl)cncc2Cl)C1	1840996311	XZDDNPPVGCONGE-UHFFFAOYSA-N	434.088	1.199	50	20	IDGD	
O=C(NC1(C(=O)N2CC3(CCCN3C(=O)[C@@H](O)CCl)C2)CC1)OCc1ccccc1	1841350969	COUKUURTZGGLTJ-INIZCTEOSA-N	435.908	1.249	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC2(CCCN2C(=O)[C@@H]2ON=C(c3ccccc3)O2)C1	1844195456	PFUBQLQNIKLTTJ-ACJLOTCBSA-N	436.306	1.956	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)[C@H](C)C1(O)CCC1)C2	1844691797	AXDBTLNSHANPQV-AWEZNQCLSA-N	445.472	1.888	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)c2ccc(N3C(=O)C=CC3=O)cc2)C1	1846891248	NCAOWTJMXSIPOT-INIZCTEOSA-N	431.876	1.187	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)CCBr)c1	1847382778	VTJPUSWSDRZXCA-GJZGRUSLSA-N	429.336	1.691	50	20	IDGD	
Cn1cc(C[C@@H](NC(=O)OC(C)(C)C)C(=O)NCCSSCCC(=O)O)cn1	2088601294	AXHRUVPPWCYHBL-CYBMUJFWSA-N	432.568	1.828	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)[C@H]1CC(=O)N(Cc2ccco2)C1	13629358	UJDDMRVOGPDUFV-LBPRGKRZSA-N	436.262	1.617	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)C2CCN(c3ccc4nnc(C(F)(F)F)n4n3)CC2)n1	14514613	SVRUDAIYGKEIQS-UHFFFAOYSA-N	435.414	1.910	50	20	IDGD	
C[C@H]1CCCC[C@]12NC(=O)N(CC(=O)NNC(=O)c1cc(Br)c[nH]1)C2=O	28717700	GUTDNAXJHOUTKA-FVMDXXJSSA-N	426.271	1.039	50	20	IDGD	
C[C@H](C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)N1CCC(Cc2ccccc2)CC1	97569841	BEPVMKJDAWLMEP-QGZVFWFLSA-N	433.516	1.767	50	20	IDGD	
O=C(NCCc1cccc(O)c1)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	727239410	DIRQSYJKQQEJBD-UHFFFAOYSA-N	446.529	1.754	50	20	IDGD	
C#Cc1cccc(NC(=S)NNC(=O)CCNS(=O)(=O)c2cccc(C(C)=O)c2)c1	727497611	AVCYMOQQTUSRKG-UHFFFAOYSA-N	444.538	1.557	50	20	IDGD	
CC1CCC(NS(=O)(=O)CC(=O)NNC(=O)c2ccc(Br)s2)CC1	728065033	KYWLTBIPPBLTKL-UHFFFAOYSA-N	438.369	1.770	50	20	IDGD	
CC(C)CC(Cc1cccc(Cl)c1)=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O	728157026	RBLPGIMHEAZQOF-UHFFFAOYSA-N	437.953	1.986	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@H]1CCCN1c1ccc(C#N)cc1	728169984	FCDIIQCKWFUTKM-QGZVFWFLSA-N	440.529	1.590	50	20	IDGD	
CNC(=O)COc1ccc(C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)cc1OC	728211256	OKPCXLGDFSPXMN-UHFFFAOYSA-N	448.501	1.018	50	20	IDGD	
O=C(CCNC(=O)c1ccc2ccccc2c1)NNC(=O)C1CCN(c2ncccn2)CC1	728845476	IVSNBQUFZOONMQ-UHFFFAOYSA-N	446.511	1.814	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)c2cc(S(=O)(=O)Nc3ccccc3F)c[nH]2)c1	728870733	ALZXZLZQASIQIZ-UHFFFAOYSA-N	427.417	1.901	50	20	IDGD	
O=C(NCc1ccc(N2CCCCC2)nc1)NNC(=O)C1CCN(c2ncccn2)CC1	728947637	OZQFCLWLUVAVKJ-UHFFFAOYSA-N	438.536	1.609	50	20	IDGD	
Cc1ccc(Cn2nc(C)c(C=NNC(=O)CSc3nnc(O)nc3O)c2C)cc1	730558783	RFVWZEDFGQWDFH-UHFFFAOYSA-N	427.490	1.695	50	20	IDGD	
C#Cc1cccc(NC(=S)NNC(=O)CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])c1	731059244	FUDSRDVTIFYNTC-UHFFFAOYSA-N	431.861	1.977	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2cccc(NC(=O)CCn3ccnc3)c2)C[C@H](C)O1	732261473	MXYRXUPEFRTIGD-IRXDYDNUSA-N	442.520	1.172	50	20	IDGD	
CC(C)C[C@H](C(=O)NNC(=O)c1cnn(-c2ccccc2)c1)N1C(=O)[C@H]2CC=CC[C@@H]2C1=O	733108921	YUTLTYSFOFJDFX-SLFFLAALSA-N	449.511	1.999	50	20	IDGD	
CC[C@@H](C)C(=O)N1Cc2ccccc2C[C@@H]1C(=O)OCC(=O)NNC(=O)c1ccccc1	733532480	ZWCDWLKWZOORMN-OXQOHEQNSA-N	437.496	1.990	50	20	IDGD	
Cc1nc(-c2cnn(C)c2)sc1C(=O)NNC(=O)c1csc(N2CCOCC2)n1	734419824	YFKAEHHBFHGTLA-UHFFFAOYSA-N	433.519	1.220	50	20	IDGD	
CN1C(=O)C[C@H](C(=O)OCC(=O)NNC(=O)c2cccs2)[C@@H]1c1cccc(Cl)c1	734636051	LOTRGXVMVAATSB-GUYCJALGSA-N	435.889	1.925	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	735117057	NALJDJBSDBVXKV-UHFFFAOYSA-N	439.925	1.437	50	20	IDGD	
C[C@@H](CN1CCN(c2ccccn2)CC1)NC(=O)NNC(=O)c1ccc2c(c1)OCCO2	735517285	BFYLNKFAPVEIBL-INIZCTEOSA-N	440.504	1.008	50	20	IDGD	
O=C(NNc1cccc([N+](=O)[O-])c1)NC1CCN(S(=O)(=O)C2CCOCC2)CC1	737057512	LIAVPIQTBCNZDU-UHFFFAOYSA-N	427.483	1.194	50	20	IDGD	
CN(CC(=O)NNC(=O)c1cccc2ncccc12)S(=O)(=O)c1cccc([N+](=O)[O-])c1	737841121	IXFKXSVURHMGSD-UHFFFAOYSA-N	443.441	1.225	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)NCCNc2nccc(C(F)(F)F)n2)cc1C	739045213	GUYCZGITKVWRME-UHFFFAOYSA-N	439.398	1.493	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)c1ccc(Cn2nc(C)c([N+](=O)[O-])c2C)cc1	740851848	YRCZLYOKIKNTOH-UHFFFAOYSA-N	430.465	1.522	50	20	IDGD	
C[C@H]1CN(CC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)CC[C@@H]1NC(=O)OC(C)(C)C	740880348	XASIQKHIOGJSDN-BBRMVZONSA-N	435.481	1.591	50	20	IDGD	
CS(=O)(=O)[C@@H]1CCCCC1=NNC(=O)CN1c2cccc3cccc(c23)S1(=O)=O	741454338	DMFPPTCTDYRKDV-MRXNPFEDSA-N	435.527	1.808	50	20	IDGD	
COc1cccc(-c2noc([C@@H](C)NC(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)n2)c1	743510832	DWWQSKBGMNRQDS-GFCCVEGCSA-N	449.431	1.426	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)N[C@@H]1CC(=O)N([C@H]2C[C@@H]2c2ccccc2)C1	743702300	OKJWSSHERDIHJZ-KURKYZTESA-N	436.468	1.559	50	20	IDGD	
C[C@](O)(C(=O)OCC(=O)NNC(=O)c1ccc(C#N)cc1)c1cccc(C(F)(F)F)c1	745101859	AXEVPXOWVGKSCJ-LJQANCHMSA-N	435.358	1.789	50	20	IDGD	
O=C(COC(=O)[C@@H]1CCCN(c2ncnc3sccc23)C1)NNC(=O)c1cccs1	745533088	HAOJGNRPKVLVDK-GFCCVEGCSA-N	445.526	1.974	50	20	IDGD	
CN(C)C(=O)NNC(=O)C1CCN(S(=O)(=O)c2cccc(OC(F)(F)F)c2)CC1	746006072	MHXFHTHDCSKUHR-UHFFFAOYSA-N	438.428	1.288	50	20	IDGD	
Cc1cc(=O)c(C(=O)NNC(=O)Cc2ccncc2)nn1-c1ccccc1C(F)(F)F	747326661	RACNQCJAAGHERA-UHFFFAOYSA-N	431.374	1.958	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)c1ccccc1)C(=O)NNc1cc(Cl)nc(C)n1	747979988	LSFLUQORHLZGPP-CYBMUJFWSA-N	429.955	1.982	50	20	IDGD	
CS(=O)(=O)N1CCN(CCNC(=O)NN(Cc2ccccc2)c2ccccc2)CC1	749353639	POLHFIRFRIUZHS-UHFFFAOYSA-N	431.562	1.485	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)[C@@]2(C)CCCN(C(=O)OC(C)(C)C)C2)c2ccccc2c1=O	751546953	GEADEEYNWKDIIH-QFIPXVFZSA-N	443.504	1.732	50	20	IDGD	
N#C/C(=C/c1ccc(F)cc1)C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	752489356	MWPSZOKOSXYTHH-SSZFMOIBSA-N	430.461	1.897	50	20	IDGD	
O=C(CSCc1cc(=O)n2ccsc2n1)NNC(=S)NCCc1cccs1	753076143	GEHBTDAZXWHOKF-UHFFFAOYSA-N	439.613	1.789	50	20	IDGD	
Cc1c(Br)cc(C(=O)NNC(=O)CCN2C[C@H](C)O[C@H](C)C2)cc1[N+](=O)[O-]	753767390	HAGUGPICZYKFCU-PHIMTYICSA-N	443.298	1.926	50	20	IDGD	
C[C@H](CO[C@@H]1CCOC1)NC(=O)NNC(=O)[C@@H](C)Oc1cccc(Br)c1	753814244	XSSZKEQOSMLOHR-LALPHHSUSA-N	430.299	1.741	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN2CC[S@](=O)C[C@H]2c2cnn(CC)c2)cc1C	753814271	WUJKOUSINYIDEW-WNNBVUDTSA-N	437.591	1.402	50	20	IDGD	
O=C(NNC(=O)c1cccc(I)c1O)c1ccc2c(c1)OCCO2	754917909	KGWRCQKWOJCAJI-UHFFFAOYSA-N	440.193	1.843	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2ccc(C(=O)N(C)OC)cc2)c2ccccc2c1=O	756504738	RGQJLVZVPFZOBT-UHFFFAOYSA-N	438.444	1.516	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccc([S@@](C)=O)c(F)c2)c1	756768924	AVEWNYODNHGUDP-MUUNZHRXSA-N	442.494	1.280	50	20	IDGD	
COc1ncc(C)cc1NC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	756847591	FCEVLBJPRDRVNK-UHFFFAOYSA-N	433.490	1.650	50	20	IDGD	
C[C@H]1CN(c2nccnc2C#N)CCN1C(=O)NNC(=O)c1cccc(Br)c1	756947050	HDCPHLWKUOJLNR-LBPRGKRZSA-N	444.293	1.676	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)c2cncc(I)c2)cn1	757645558	DJMPPOGDAUAUPI-UHFFFAOYSA-N	429.243	1.721	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(N2CCOCC2)c(NC(=O)NNC(=O)C2CCCC2)c1	757775142	GCNJKHJYCABXQX-UHFFFAOYSA-N	439.538	1.116	50	20	IDGD	
O=C(NNC(=O)[C@@H](c1ccc(Br)cc1)N1CCCC1)[C@@H]1CCS(=O)(=O)C1	758154971	MVCMDAULQBWTHG-UKRRQHHQSA-N	444.351	1.168	50	20	IDGD	
O=C([C@H]1CCCN(Cc2cccnc2)C1)N1CCN(S(=O)(=O)CBr)CC1	758516636	FACIDMYHIYISMD-INIZCTEOSA-N	445.383	1.120	50	20	IDGD	
O=C(NCc1ccc(Cn2cnc3ccccc32)cc1)NNC(=O)C(=O)Nc1ccccn1	758729929	QTWKIXQKRYDHKV-UHFFFAOYSA-N	443.467	1.949	50	20	IDGD	
Cc1cc(C)nc(-n2nccc2NC(=O)C(=O)NNc2nc(C(F)(F)F)cs2)n1	760315923	WIWGSNKFEHXDCT-UHFFFAOYSA-N	426.384	1.836	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)CCNC(=O)[C@H]2CCCN2C(=O)OC(C)(C)C)c1	760945428	XZANIFQRPCWSEJ-MRXNPFEDSA-N	434.493	1.822	50	20	IDGD	
O=C(NNc1nccc(N2CCOCC2)n1)c1cccc(CN2C(=O)CSC2=O)c1	762856968	ZVMXDWCTNAESHA-UHFFFAOYSA-N	428.474	1.266	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccccn2)n([C@@H]2CCN(Cc3ccccc3)C2)n1	763464906	XVEOELGRDJHOPI-GOSISDBHSA-N	447.499	1.433	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)CCCOc2ccc(Cl)cc2Cl)n(C)n1	763506134	RLZFUJJKXRJKPF-UHFFFAOYSA-N	428.276	1.980	50	20	IDGD	
Cc1cccc2c1N(C(=O)C(=O)NNC(=O)CCN1CCN(c3ccccc3)CC1)CC2	763529947	DKYURWHXHXQOIK-UHFFFAOYSA-N	435.528	1.244	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)C(=O)Nc2ccc3c(c2)oc(=O)n3C)c1	763600663	HFZNPPLMAVSWLZ-UHFFFAOYSA-N	440.456	1.728	50	20	IDGD	
COCCOc1cc(C)ccc1NC(=O)C(=O)NNC(=O)c1c(C)nc2ccccn12	763628929	HQLLEIJMHLHNBS-UHFFFAOYSA-N	425.445	1.376	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(C#N)ccc1OC(C)C	763682382	NBYORXIDHPFCEV-UHFFFAOYSA-N	440.456	1.909	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(F)c(F)cc1C(=O)OC	763713127	VDHHGUWIYZWRIQ-UHFFFAOYSA-N	435.383	1.479	50	20	IDGD	
NC(=O)CCOc1ccc(NC(=O)C(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)cc1	763727239	IVNWQJAKHOGEFZ-UHFFFAOYSA-N	428.489	1.243	50	20	IDGD	
CNC(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)CSc2ccc(Cl)cc2)cc1	763734019	KJPFLRHKTKLCSJ-UHFFFAOYSA-N	434.905	1.507	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(Cl)c2)cc1NS(C)(=O)=O	763748214	OUFZCWLGRUTYGM-UHFFFAOYSA-N	440.865	1.120	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)C(=O)Nc2ccc3ncccc3c2)c2ccccc2c1=O	763791862	XYZPZVDFBZAXLJ-UHFFFAOYSA-N	444.451	1.925	50	20	IDGD	
CCC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])cc1	763802729	GILBVOSVLRTXAO-UHFFFAOYSA-N	429.389	1.108	50	20	IDGD	
CC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])cc1C	763804918	XLNQQAXZNCGFOR-UHFFFAOYSA-N	429.389	1.027	50	20	IDGD	
Cc1ccc(-n2cc(C)cn2)c(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)c1	763814121	PTVDRAAGSOOETL-UHFFFAOYSA-N	432.440	1.526	50	20	IDGD	
CCNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(OCC)cc2)c1	763859684	FAIJDTLKZFFIMZ-AWEZNQCLSA-N	442.472	1.388	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)Cc2c[nH]c3ccccc23)cc(OC)c1OC	763865785	WPRLKUCMNSUKFL-UHFFFAOYSA-N	426.429	1.522	50	20	IDGD	
Cc1ncc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(Br)c2)s1	763880760	ASOKRLKZXGBCAF-QMMMGPOBSA-N	427.280	1.767	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccccc1S(=O)(=O)C(F)F	763932239	LTWWQEVBANRVOB-UHFFFAOYSA-N	429.376	1.151	50	20	IDGD	
O=C(NNC(=O)c1ccc(Br)s1)C(=O)Nc1cccc(-c2nnco2)c1	763942098	UCTHPOQNJXEFFB-UHFFFAOYSA-N	436.247	1.960	50	20	IDGD	
COc1c(F)cc(NC(=O)C(=O)NNC(=O)c2cc(Br)cn2C)cc1F	764002879	VGCZXTHXQAUDRC-UHFFFAOYSA-N	431.193	1.474	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)on1)C(=O)Nc1ccc(N2CCCC2=O)cc1	764016786	NKDWFAZACNBGID-UHFFFAOYSA-N	433.424	1.868	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccc(CNC(=O)OC(C)C)cc1	764131121	FBPQWNUAWSFOTO-UHFFFAOYSA-N	442.472	1.658	50	20	IDGD	
COC(=O)c1ccc(N2CCCC2)c(NC(=O)C(=O)NNC(=O)CCc2ccco2)c1	764168347	DJJPROMBJWNYSC-UHFFFAOYSA-N	428.445	1.385	50	20	IDGD	
CN(C)c1nnc(-c2ccc(NC(=O)C(=O)NNC(=O)CCCc3ccccc3)cc2)o1	764223210	DDZJSWZJDRFCHD-UHFFFAOYSA-N	436.472	1.911	50	20	IDGD	
CS(=O)(=O)c1ccccc1NC(=O)C(=O)NNC(=O)c1cccc(OC(F)F)c1	764259388	GGOGEISGHKBXTE-UHFFFAOYSA-N	427.385	1.091	50	20	IDGD	
COc1c(Br)cc(Cl)cc1NC(=O)C(=O)NNC(=O)c1c[nH]nc1C	764295119	JHJYRXLOYWRUSV-UHFFFAOYSA-N	430.646	1.542	50	20	IDGD	
C[C@@H]1CN(Cc2cccc(NC(=O)C(=O)NNC(=O)Cc3ccccc3F)c2)C[C@@H](C)O1	764319413	QPUPFRLPODWUDT-HZPDHXFCSA-N	442.491	1.764	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)CCCc2cccs2)cc1	764342613	HBXNNAPETWPGEV-UHFFFAOYSA-N	438.531	1.619	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)cc1NS(C)(=O)=O	764349795	QPTWKHNJEUEVFG-UHFFFAOYSA-N	440.865	1.125	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)N[C@@H]2CCCC[C@@H]2N2CCOCC2)cc1	764373978	ILEUVTJITVHZJG-AHRSYUTCSA-N	434.537	1.826	50	20	IDGD	
Cc1ccn(-c2ccccc2NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)n1	764380225	SUGYBVRUSSVNTN-UHFFFAOYSA-N	429.383	1.938	50	20	IDGD	
COc1ccc(Sc2ccc(NC(=O)C(=O)NNC(=O)[C@H]3COCCO3)cc2)cc1	764424233	GTDZDZMTENJKNX-QGZVFWFLSA-N	431.470	1.348	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NN=Cc1ccc(N2CCOCC2)cc1	764829576	YHXHTFDILVTFDY-UHFFFAOYSA-N	435.528	1.431	50	20	IDGD	
CCOC(=O)NNC(=O)C(=O)Nc1ccc(Cl)c(S(=O)(=O)N2CCCCC2)c1	765408145	SAVBARFNXOEPSW-UHFFFAOYSA-N	432.886	1.230	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cc(C)nc4onc(C)c34)CC2)cc1	765747725	GNAGDAXQMNXCPC-UHFFFAOYSA-N	436.516	1.727	50	20	IDGD	
O=C(CCCC(=O)c1ccc2c(c1)OCCO2)NNC(=O)[C@H]1COc2ccccc2O1	766631531	NDXQELXQLYFCFV-HXUWFJFHSA-N	426.425	1.798	50	20	IDGD	
N#CCSc1ccccc1C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	766649682	IYLXQALXMRMEHB-UHFFFAOYSA-N	437.525	1.521	50	20	IDGD	
Cc1nc(-c2ccccc2)[nH]c1C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	766653956	RSPAIUUEEDFSCU-UHFFFAOYSA-N	446.511	1.604	50	20	IDGD	
Cc1nn(C)c(Cl)c1C(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	766664949	YZTPVZVSXPIHBI-UHFFFAOYSA-N	439.347	1.614	50	20	IDGD	
COc1cccc(/C=C(\C(=O)NNc2ccccc2S(C)(=O)=O)n2nnnc2C)c1	766669226	PEPVOIZRVVIEOK-SFQUDFHCSA-N	428.474	1.535	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@H](C)c2cccc(F)c2F)cc1	766847893	HSGBTWATLNEOMX-CYBMUJFWSA-N	440.472	1.985	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)C2CCN(S(=O)(=O)c3ccccc3C(=O)O)CC2)n1	766860749	RPJXFZZVKXWSAM-UHFFFAOYSA-N	433.490	1.336	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)[C@H]1CCC[C@H]1NC(=O)OC(C)(C)C	767343573	BIOAHBKUGAIOAS-DLBZAZTESA-N	433.505	1.922	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCc2cccnc21)c1ccc(S(=O)(=O)N2CCCC2)cc1	767430226	GILYYLTXMZWUKZ-SFHVURJKSA-N	428.514	1.747	50	20	IDGD	
CC1(C)CCC[C@]2(C1)NC(=O)N(CC(=O)NNC(=O)c1cc(-c3ccccc3)[nH]n1)C2=O	768571596	RWOYPVJQESJSEX-JOCHJYFZSA-N	438.488	1.729	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C1=NN(c2ccccc2)[C@@H](C(C)=O)C1	768613611	WWSBOLVOGLHVHZ-MRXNPFEDSA-N	430.486	1.766	50	20	IDGD	
COc1ccccc1[C@H](CNC(=O)NNC(=O)CNC(=O)c1cccs1)OC(C)C	770374356	OONACTMIXMLQJP-INIZCTEOSA-N	434.518	1.983	50	20	IDGD	
Cc1cc(C)c(S(=O)(=O)NCCC(=O)O[C@@H](C)C(=O)NNC(=O)CC(C)C)c(C)c1	771869081	SGNOBAFBYJIQRJ-INIZCTEOSA-N	441.550	1.405	50	20	IDGD	
C=C1c2ccccc2C(=O)N1[C@@H](C)C(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772883487	AVMIMKZMYRZBQR-ZDUSSCGKSA-N	426.860	1.619	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NNC(=O)c2cn(CC(=O)C(C)(C)C)nn2)C1	773418246	SRFZDVLEKQIGIF-CYBMUJFWSA-N	436.513	1.301	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)C(=O)Nc2ccc(S(=O)(=O)N3CCCCC3)cc2)n1	773478353	DRFAHGSXYXEKBC-UHFFFAOYSA-N	432.506	1.350	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2ccc(C(=O)NC3CCCCC3)cc2C)n1	773724417	QSZFQSZJNYBMBJ-UHFFFAOYSA-N	426.477	1.938	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)N[C@@H](CS(C)(=O)=O)c2ccccc2)cc1	774285114	YUEMZAFYBXGVMV-BEFAXECRSA-N	449.529	1.969	50	20	IDGD	
CCOC1CC(CNC(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)(N2CCOCC2)C1	775148116	XZSMIGJUMGVPBJ-MVBMGLOESA-N	448.564	1.671	50	20	IDGD	
CCOC1CC(CNC(=O)NNC(=O)COc2ccc(C)c(C)c2)(N2CCOCC2)C1	775156729	HJBTUCVVCHYSLM-UHFFFAOYSA-N	434.537	1.283	50	20	IDGD	
CO[C@H](c1ccccc1F)[C@@H](C)NC(=O)NNC(=O)c1csc(N2CCOCC2)n1	775712565	CZJBMCZATGWUFM-WBMJQRKESA-N	437.497	1.839	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NC[C@H]2COC3(CCC(C)CC3)O2)cc(OC)c1OC	776885714	RGTOLFZQCCWCSM-FDTVQSNTSA-N	437.493	1.978	50	20	IDGD	
CC[C@H](C)Oc1cc(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)ccn1	777274693	NUIPVPYGTBBRBS-JTQLQIEISA-N	426.882	1.635	50	20	IDGD	
C[C@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	777412754	YSKQIDWSZWNPGX-BBRMVZONSA-N	444.496	1.252	50	20	IDGD	
CCOC(=O)c1cc(F)cc(S(=O)(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)c1	778564935	JPERRLQZIPOAGE-UHFFFAOYSA-N	427.366	1.240	50	20	IDGD	
COC(=O)c1ccccc1NNC(=O)CN1C(=O)N[C@](C)(c2ccccc2OC)C1=O	780733686	XNFPDGVJBNLRTL-OAQYLSRUSA-N	426.429	1.392	50	20	IDGD	
C=CCn1c(=O)c2ccccc2n2c(SCC(=O)NNc3ccnc(F)c3)nnc12	781366718	QOSUDNKGKCFJNX-UHFFFAOYSA-N	425.449	2.000	50	20	IDGD	
CN1CCC/C1=N\S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2cccc(F)c2)cc1	783035848	FKQUJEPUVSBVDM-JJIBRWJFSA-N	433.465	1.720	50	20	IDGD	
Cc1cc(C)cc(NNC(=O)C(=O)Nc2cnn(-c3ccccc3S(C)(=O)=O)c2)c1	783359656	WMOWSTZNKOJARH-UHFFFAOYSA-N	427.486	1.974	50	20	IDGD	
CC(C)c1nccn1Cc1cccc(NC(=O)C(=O)NN[C@]2(C)CCS(=O)(=O)C2)c1	783427924	URFNPSMHOSDSQB-HXUWFJFHSA-N	433.534	1.191	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1ccccc1N1CCCCCC1	784003574	JIQFZUFRHAMJCR-UHFFFAOYSA-N	443.529	1.644	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)C(=O)Nc1ccc2nc(C3CC3)sc2c1	784005048	XWMMNOXDTNJGCO-UHFFFAOYSA-N	427.442	1.283	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1ccc(Cl)nc1	784832918	GWLUBLVSHMGIPC-UHFFFAOYSA-N	425.898	1.894	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)C(=O)Nc2ccc(CCN3CCCC3)cc2)c1	784840058	ZDRWZGDEFUZKTC-UHFFFAOYSA-N	430.530	1.810	50	20	IDGD	
CCOC(=O)c1cnn(-c2cccc(NC(=O)C(=O)NNc3ccnc(F)c3)c2)c1C	784848108	AFHBVLLOKGLUAS-UHFFFAOYSA-N	426.408	1.973	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)C(=O)Nc2cccc(S(=O)(=O)N3CCCC3)c2)c1	784853685	LBWXVOMAARZMMP-UHFFFAOYSA-N	446.485	1.340	50	20	IDGD	
O=C(CN1CCCCCCC1)Nc1ccc(NC(=O)C(=O)NNc2cccnn2)cc1	784862356	DPWHWEDAAXHUGV-UHFFFAOYSA-N	425.493	1.763	50	20	IDGD	
CCN1CCN(C(=O)c2ccc(NC(=O)C(=O)NNc3cc(C)ccc3F)cc2)CC1	784885381	TYLYTTGQRAPZPW-UHFFFAOYSA-N	427.480	1.994	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNc2nccn(C)c2=O)sc2c1CC[C@H](C)C2	785089613	CVTIQJAYYPJBDX-JTQLQIEISA-N	433.490	1.225	50	20	IDGD	
O=C(NNc1c(F)cc(C(=O)NC2CC2)cc1F)C(=O)Nc1ccc2c(c1)OCCO2	785100795	ZNFAKAQHJKJUEI-UHFFFAOYSA-N	432.383	1.710	50	20	IDGD	
CNS(=O)(=O)c1ccc2c(c1)N(C(=O)C(=O)NNc1nc3ccccc3cc1C)CC2	785154364	KZNYTENNRKAANF-UHFFFAOYSA-N	439.497	1.484	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2cc(C(=O)NC3CC3)ccc2C)n1	785226575	IZRGHTOWUCHVOU-UHFFFAOYSA-N	425.493	1.605	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=S)N[C@@H](C)Cc2ccccc2)cc1	786056947	CUAXXRGKXPTFQO-INIZCTEOSA-N	434.587	1.742	50	20	IDGD	
CN(C(=O)OC(C)(C)C)[C@@H](C(=O)OCC(=O)NNC(=O)c1ccccc1)c1cnn(C)c1	786700162	RHRHLHSIWCADKZ-QGZVFWFLSA-N	445.476	1.333	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)Nc1ccc(N2CCNC(=O)C2)c(Cl)c1	787995425	YUTFTNNASWSFRB-UHFFFAOYSA-N	427.889	1.218	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(Cl)c(S(C)(=O)=O)c2)c1	788330877	MRSHCUISDKZVAN-UHFFFAOYSA-N	438.893	1.209	50	20	IDGD	
NC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)NNc1nnc(-c2ccccn2)s1	788556436	MSWBLGLDRKXKSA-AWEZNQCLSA-N	441.473	1.214	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cc([C@H]3CCCO3)nn2C)c1C	789741546	WUVTZZCRROVDID-WMLDXEAASA-N	429.477	1.442	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)NCc2ccc(N3C(=O)N[C@@](C)(C4CC4)C3=O)cc2)o1	790901715	ZNNSPVSRPLCXOW-NRFANRHFSA-N	425.445	1.957	50	20	IDGD	
Cc1cc(Br)c(NC(=O)C(=O)NNc2nc3ccccn3n2)cc1[N+](=O)[O-]	792392234	WEURHGSCCCVARV-UHFFFAOYSA-N	434.210	1.790	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)Cc2ccc(C(=O)NNC(=O)[C@H](O)C(C)C)cc2)cc1	794760552	REDOOOPIXAPWAG-LJQANCHMSA-N	433.530	1.594	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)c2cc3ccccc3c(=O)n2C)c2ccccc2c1=O	794774457	GNGZQHCIOJTEEQ-UHFFFAOYSA-N	431.452	1.904	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)[C@@H](C#N)Cc2ccc(C#N)cc2)cc1OC	795825098	NCHZKLPAYWRFBW-QGZVFWFLSA-N	436.424	1.262	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccn(C(C)C)n3)n[nH]2)cc1OC	797005643	GKNSBKIZENIRDJ-UHFFFAOYSA-N	441.448	1.271	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)C(=O)Nc2cncc(F)c2)cc(OCC)c1OCC	799257752	RKJNJFODHIQELK-UHFFFAOYSA-N	434.424	1.817	50	20	IDGD	
CCn1ncc(NC(=O)C(=O)NNC(=O)COc2ccc(C)c(C)c2)c1C(F)(F)F	799257826	SRRUMDCWQSTSAD-UHFFFAOYSA-N	427.383	1.704	50	20	IDGD	
N#Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)ccc1OC(F)(F)F	799834025	ICTVXJYREKWICT-UHFFFAOYSA-N	436.302	1.585	50	20	IDGD	
Cc1nc(O)c(Br)cc1C(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	803396916	NTSVMHACHYXGCI-UHFFFAOYSA-N	443.279	1.728	50	20	IDGD	
O=C(Cc1ccc(S(=O)(=O)N2CCCCC2)cc1)NNc1ccc(-n2ccnc2)nn1	804956112	AFSLSIFAAKELDA-UHFFFAOYSA-N	441.517	1.523	50	20	IDGD	
COC(=O)Nc1cccc(CNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1	805069514	YDZDMAYYKDNICU-UHFFFAOYSA-N	427.465	1.402	50	20	IDGD	
COCCNC(=O)[C@@H](C)OC(=O)c1ccc(NC(=O)NNC(=O)c2cc(C)oc2C)cc1	806749258	ATOBZGFXUXSPOK-CQSZACIVSA-N	446.460	1.671	50	20	IDGD	
COCCNC(=O)c1cccc(NC(=O)C(=O)NNc2ncc(Cl)cc2Cl)c1	806984645	NQANJVPHTGHSIH-UHFFFAOYSA-N	426.260	1.846	50	20	IDGD	
CCc1nnc(NC(=O)[C@H](C)[C@H](C)NC(=O)NNC(=O)COc2ccccc2C#N)s1	807566111	SFSOZBROQIOKTK-NEPJUHHUSA-N	445.505	1.345	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)NCc1ccncc1OC[C@H]1CCOC1	807616154	PFUCQRWPOXNGTQ-INIZCTEOSA-N	428.489	1.969	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)c2c[nH]nc2-c2ccccn2)cc1	810021981	UKAYDKHQEPETKW-UHFFFAOYSA-N	434.485	1.967	50	20	IDGD	
O=C(CNS(=O)(=O)c1cccnc1)NNc1ccc([N+](=O)[O-])cc1Br	811222505	RPKNGMFWYGHIMJ-UHFFFAOYSA-N	430.240	1.174	50	20	IDGD	
Cc1cnc(Br)c(NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)c1	812980317	PELXIGHONNZWPK-UHFFFAOYSA-N	430.262	1.893	50	20	IDGD	
Cc1cc(CNC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])nc(N2CCCC2)n1	813861353	RHNFTNKZCCZEFX-UHFFFAOYSA-N	429.437	1.203	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2CCCN(c3ccccc3)C2=O)c1	814364195	VKHRCVYGAOJIHO-SFHVURJKSA-N	444.513	1.141	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)Nc1ccccc1CS(C)(=O)=O	814627313	WKRKFNCJLHVVGB-UHFFFAOYSA-N	426.520	1.630	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NNC(=O)CNC(=O)c2ccc(F)cc2F)C1	816509769	BSZLHNQYBWHVJY-GFCCVEGCSA-N	440.447	1.489	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)[C@@H](c1cccc(F)c1)N1CCOCC1	817053680	BVNXPYKZSKFJPR-LJQANCHMSA-N	436.509	1.593	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)c2ccc3c(c2)NC(=O)CNC3=O)c1	818747123	ZHHAZHXGUUOLMJ-UHFFFAOYSA-N	447.245	1.675	50	20	IDGD	
Cc1ccc(-c2n[nH]cc2C=NNC(=O)C(=O)NN=Cc2c[nH]nc2-c2ccc(C)o2)o1	839384241	WJQPAJHVXYPMKN-UHFFFAOYSA-N	434.416	1.870	50	20	IDGD	
O=C(NNC(=O)[C@H](O)[C@H](O)c1nc2ccccc2s1)c1cc(Br)c[nH]1	843450682	PIZMVKNHCCKYGS-NEPJUHHUSA-N	425.264	1.242	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)CNS(=O)(=O)c1cccc(F)c1	913036985	OSENLYMHFOJJLC-UHFFFAOYSA-N	448.501	1.997	50	20	IDGD	
CCOC(=O)NNC(=O)CNS(=O)(=O)c1ccc(SCC(C)C)c([N+](=O)[O-])c1	913180641	STAXAKMQQAHTHE-UHFFFAOYSA-N	434.496	1.399	50	20	IDGD	
COc1cccc2cc(C(=O)NNC(=O)CN(C)S(=O)(=O)c3ccc(C)cc3)oc12	915062157	DQNRFTFSYWVXNY-UHFFFAOYSA-N	431.470	1.832	50	20	IDGD	
O=C(NNC(=O)c1ccccc1OCCOc1ccccc1)N[C@@H]1CCS(=O)(=O)C1	915880282	DQLSLTPDNQQUSU-OAHLLOKOSA-N	433.486	1.276	50	20	IDGD	
Cc1ccc(O[C@H](C)C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c(Br)c1	916144709	JYVQUVGZZSNXJZ-GFCCVEGCSA-N	445.277	1.962	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)NCc2ccnc(N3CCOCC3)c2)c1C	916389294	UZHFPRHYJIRSFT-QGZVFWFLSA-N	427.505	1.833	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)N(C)CCCC(=O)NNC(=O)NC2CCCCC2)cc1	916559467	FWRUZQOGHQQVAK-UHFFFAOYSA-N	438.550	1.953	50	20	IDGD	
O=C(CN1CCN(C(=O)Cc2c[nH]c3ccccc23)CC1)NNC(=O)c1ccc(F)cc1	917152488	PUBBWLYHSBVQEP-UHFFFAOYSA-N	437.475	1.455	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2cccc(C(=O)N(C)C)c2)cc(OC)c1OC	917718154	XTOXHEYSHXTRMQ-UHFFFAOYSA-N	437.474	1.038	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)/C=C\c1ccccc1)C(=O)NNC(=O)NCC1CC1	920859260	RSWVJPJRTRMTIW-UILAEWCASA-N	426.564	1.439	50	20	IDGD	
CS(=O)(=O)Cc1ccc(S(=O)(=O)NNC(=O)c2cncn2-c2ccccc2)cc1	1318880495	SGAQJMPUZGNNTD-UHFFFAOYSA-N	434.499	1.040	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc3cncn3c2C)c1	1320840091	PCMMWGSCSUHOLJ-UHFFFAOYSA-N	429.502	1.748	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2cccc(S(=O)(=O)N3CCOCC3)c2)cc1	1337766668	PJLSSTJWAGGVGE-UHFFFAOYSA-N	434.474	1.183	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccn3c(O)nnc13)C2)[C@H](F)Cl	1778025898	HZMRWIZTWDTVMY-FHSNZYRGSA-N	425.848	1.097	50	20	IDGD	
CC(=O)N(C)[C@@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCBr)C2	1778105567	YSVIZGKJSHTGGI-JCKWVBRZSA-N	432.359	1.152	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@]2(C1)CN(C(=O)Cc1ccc3c(c1)OCO3)CCO2	1779296375	QGDOLVYDYPBQEL-NRFANRHFSA-N	434.565	1.639	50	20	IDGD	
COc1cc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)ccc1O	1780751418	YGVCSCUJHBZPBV-YOEHRIQHSA-N	431.258	1.535	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H]1CCN1C(=O)OC(C)(C)C)CCO2	1781217264	HDVCJDVMEWXZOW-STXHMFSFSA-N	429.945	1.843	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3c(O)cc(O)cc3O)C2)C1	1781818605	NAXRWXOARDBYIO-KZULUSFZSA-N	443.294	1.420	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Br)C2)c1cncc(O)c1	1782040544	KCIQCVVJTYFPGO-JKIFEVAISA-N	430.274	1.605	50	20	IDGD	
COC(=O)[C@@H]1CC[C@@H](C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)C(Cl)Cl)C2)C1	1782214161	MMGALLAURVNWGA-QGDIXAPHSA-N	435.348	1.893	50	20	IDGD	
COc1ccnc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](C)Br)C3)C2)c1OC	1783537469	NUGRIWYGDXQKTQ-KPZWWZAWSA-N	442.310	1.326	50	20	IDGD	
CC[C@H]1CC[C@H](C(=O)N2CC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)CC1	1783605855	PRKZXMGXDOAPGX-PMAPCBKXSA-N	428.338	1.026	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(N4CCCC4)ccn3)CCO2)C1	1783873999	BBTIAAREFYJZNJ-UTKZUKDTSA-N	436.940	1.379	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(-c4cc[nH]n4)cc3)CCO2)C1	1783882079	VBYHGKFNDVBFER-DYESRHJHSA-N	432.908	1.774	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc([N+](=O)[O-])c(OC)c3)CCO2)C1	1783883486	IYGPQKXTFZYXLZ-LIRRHRJNSA-N	441.868	1.301	50	20	IDGD	
O=C(CCc1cnc2ccccc2c1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21	1783900876	UCDRUEKXLGLYKS-QIJZPMMNSA-N	445.947	1.747	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]3C2)nn1C	1783967637	HSPAABWAADPJJW-DSRCVFDASA-N	427.343	1.353	50	20	IDGD	
CCOC(=O)O[C@@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]2C1	1783973866	DLXOCFJYDGBGFL-YTFOTSKYSA-N	449.342	1.559	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3[C@@H]4Sc5ccccc5[C@H]43)C[C@@H]21)[C@H](O)CCl	1784092189	IWAVXAPMYFINQB-ACHSSLTPSA-N	436.961	1.454	50	20	IDGD	
O=C(C[C@H]1COc2ccccc2O1)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21	1784395392	SUFINTRDXFUYMO-WSMBLCCSSA-N	443.327	2.000	50	20	IDGD	
CCc1ncccc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21	1785654177	FAKIWFZQMGEQBU-MZGVZZPPSA-N	428.302	1.928	50	20	IDGD	
CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)Nc1ccc(C2(NC(=O)[C@H](O)CCl)CCC2)cc1	1791809627	OYXASZAEXWPTBV-QZTJIDSGSA-N	447.923	1.191	50	20	IDGD	
CCOc1ccsc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(B(O)O)cc1)C2	1792429749	NKIYPCZDMVREAG-BJWYYQGGSA-N	428.319	1.392	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1(CNC(=O)OC(C)(C)C)CC1	1792546648	WPXCRKKGIWZUPG-QKPAOTATSA-N	443.972	1.898	50	20	IDGD	
Cc1cc(C)n2ncc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)C(C)(C)CCl)c2n1	1792781982	LGFHUWOCJUKDSI-SCAQPMJSSA-N	433.940	1.814	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(C)(C)CCl	1792785519	BHTBDNPMDWWHQM-NNXHMXCWSA-N	426.941	1.596	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3cccn3cn1)C2	1792867608	DFPKDOFFAZJKKE-VWPFQQQWSA-N	435.322	1.569	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCc1cc(F)ccn1	1794023434	DEDHPFLUJIJWFF-ZUMXRPEOSA-N	442.329	1.774	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)c1ccc(Cl)cc1F	1796185698	ICDFUMZWCIUKDH-BJWYYQGGSA-N	430.672	1.725	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1	1796191595	BQSLEZPTWYMZJA-ACDBMABISA-N	431.301	1.342	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nn(-c3ccccc3)c3c1COC3)C2)[C@@H](F)Cl	1796362740	CQVVICAUFRXBTO-OESLAJAZSA-N	448.882	1.640	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Cl	1796368888	RSVVNUFBTSEJIJ-AICCOOGYSA-N	433.908	1.510	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2)c1cc([N+](=O)[O-])cc2c1OCC2	1798518334	WXCQTWLJKVTIES-YHYOWMERSA-N	427.816	1.267	50	20	IDGD	
COc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Br)C3)c(OC)c1	1798822592	ZVCYTYVWSNZIDZ-OJXGSEEGSA-N	445.285	1.598	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(S(C)(=O)=O)c1)C2	1799264149	BPCIGHNPHHDWHT-YALNPMBYSA-N	428.938	1.311	50	20	IDGD	
COc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Br)ccc1O	1799348633	NPAYMWWQEZHERT-BAESOJJISA-N	431.258	1.295	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(C(F)(F)F)cc1)c1cccc(B(O)O)c1	1799704731	HUZLCWRAGKAYHF-REPLKXPHSA-N	446.234	1.951	50	20	IDGD	
CC(C)(C)OC(=O)N1CC2(C[C@H]2C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](O)CCl)C3)C1	1801879965	UMGZQKBXSWBKIX-XFIYOXNOSA-N	441.956	1.481	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H]2COc3ccccc3O2)[C@@H]1c1cccnc1)[C@H](O)CCl	1803135584	FIJFKANWAVULJM-ACZWYYKOSA-N	445.903	1.527	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H](CNC(=O)[C@@H]2CNC(=O)O2)[C@@H]1c1cccnc1	1803649583	DCGMZGOJESMSCL-QPSCCSFWSA-N	439.310	1.369	50	20	IDGD	
COc1cc(C(=O)NC[C@@H]2CCN(C(=O)C(Cl)Cl)[C@H]2c2cccnc2)n(C)n1	1804929108	PUNUMWQKTIKTQV-WFASDCNBSA-N	426.304	1.947	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2c(F)c(C)nn2C)[C@@H]1c1cccnc1	1805150560	QLKYYOXUGZVITN-VYDXJSESSA-N	437.903	1.836	50	20	IDGD	
CCOC(=O)/C=C/C(=O)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@H]1c1cccnc1	1806297589	MGBKNEKXJGIRPK-QKCQTVQESA-N	442.285	1.897	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)COC(=O)C(F)(F)F)[C@H]1c1cccnc1)[C@@H](F)Cl	1808313615	INDYPEPFHIVTTP-WCFLWFBJSA-N	425.766	1.727	50	20	IDGD	
O=C(CS(=O)(=O)N1CCCC1)NC[C@@H]1CCN(C(=O)[C@H](F)Cl)[C@H]1c1cccnc1	1808414935	VWCWDKBAJNXOMA-XIRDDKMYSA-N	446.932	1.047	50	20	IDGD	
CC(C)CNC(=O)C(=O)NC[C@@H]1CCN(C(=O)CO[Si](C)(C)C)[C@@H]1c1cccnc1	1808447167	FHNFHRASCADKCM-PKOBYXMFSA-N	434.613	1.711	50	20	IDGD	
CC(C)CNC(=O)C(=O)NC[C@@H]1CCN(C(=O)[C@H](C)Br)[C@H]1c1cccnc1	1808453373	UYQWDOOUCAUZEE-BPUTZDHNSA-N	439.354	1.643	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)c3cnccc3F)CC2)C1	1809978141	NOLXHCCKQSBYET-UHFFFAOYSA-N	425.269	1.059	50	20	IDGD	
O=C(/C=C\C(=O)NC1CC1)NC[C@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1	1810123632	DZMOWQMIYKNFBM-JTTZZOPQSA-N	449.349	1.707	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1CCN(C(=O)CSCC(=O)O)[C@H]1c1cccnc1	1810549249	ZGZGSINMGXOVPJ-KXBFYZLASA-N	439.610	1.757	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2ccc(OC)nn2)[C@H]1c1cccnc1	1811210632	YOIHXKGPWULOPC-RVKKMQEKSA-N	433.896	1.454	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2nc(C)c(C)[nH]c2=O)[C@H]1c1cccnc1	1813028295	NYDZHEIJWAMGCM-BQFCYCMXSA-N	447.923	1.355	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)C[C@@H]2CCCCO2)[C@@H]1c1cccnc1	1813068190	JQCJZKSVIHMRIU-SFYKDHMMSA-N	445.564	1.420	50	20	IDGD	
Cc1n[nH]c(C)c1C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1813073308	KZJRLLBEEMTLES-DYESRHJHSA-N	441.536	1.114	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)c2nc[nH]c2[N+](=O)[O-])[C@H]1c1cccnc1)C(Cl)Cl	1813080073	MJQPWNBBGDEGHJ-PWSUYJOCSA-N	427.248	1.836	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)CN2C(=O)C=CC2=O)[C@@H]1c1cccnc1	1813175652	LTSGLAGVKVZVBD-GUXCAODWSA-N	432.908	1.420	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc3c(n2)OCCO3)[nH]n1)[C@H](O)CCl	1814870547	WBPVCBZORGPWHP-ZIAGYGMSSA-N	435.868	1.482	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H]2CCC(=O)N2)n[nH]1	1816972718	FWWAXAHEBSLCQJ-MDZLAQPJSA-N	426.315	1.854	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc(C=O)s2)n[nH]1	1817483514	UPIYZTUWQURHHB-OAHLLOKOSA-N	446.533	1.963	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2CC2(F)F)[nH]n1	1819403049	TXBMXVURRFGLLB-JSGCOSHPSA-N	433.419	1.369	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H]2CCC=CO2)[nH]n1	1819403444	MFUVVIOSCQTZRA-DLBZAZTESA-N	439.476	1.407	50	20	IDGD	
COc1ccnc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)c1	1819765575	FEZPWTMPJJHPIV-LJQANCHMSA-N	449.276	1.113	50	20	IDGD	
CCNC(=S)NCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](F)Br)n[nH]1	1820936988	LBZXXOYIBOVCJB-MFKMUULPSA-N	449.350	1.576	50	20	IDGD	
CC[C@@H](Br)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H]2CCC(=O)N2)[nH]n1	1822088625	WVQILIYRYDNZCB-WZRBSPASSA-N	426.315	1.854	50	20	IDGD	
CCCNC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](Cl)COC)n[nH]1	1822371871	URCFRHACICRCJO-HIFRSBDPSA-N	427.933	1.962	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ncn(C)n1)CC2	1825445262	QUBICBANUOFYQS-IUCAKERBSA-N	427.328	1.671	50	20	IDGD	
N[C@@H](Cc1cscn1)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H](O)CCl)CC1	1827546021	WSCPCGHGSXKTJD-GVDBMIGSSA-N	428.986	1.232	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)CN2CCN(C(C)=O)CC2)CC1	1828493673	RTKKROLAMIUELL-VQTJNVASSA-N	441.016	1.788	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2nccnc2C(N)=O)CC1	1829511363	PILVYZJYTUVLME-CABCVRRESA-N	437.928	1.063	50	20	IDGD	
CC(C)(C)[C@H](O)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1	1830631562	YVLAQXPZNBSWQB-BVGQSLNGSA-N	425.353	1.086	50	20	IDGD	
CSCC(C)(C)C(=O)N1CCO[C@@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1	1831534698	CVLDGUISZDJBSK-LJQANCHMSA-N	432.659	1.684	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)COc2ccc(O)nn2)CC1	1831834734	HFDREFVWGBOQEW-CVEARBPZSA-N	440.928	1.435	50	20	IDGD	
CCNC(=S)NCC(=O)N1CCC([C@H]2CCCCN2C(=O)[C@H](Cl)COC)CC1	1831834752	HMLGGPPIPFYRGB-HZPDHXFCSA-N	433.018	1.344	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)CCc2ccc[nH]2)CC1	1831870581	AQJSXDXDZJAYML-FQEVSTJZSA-N	431.581	1.940	50	20	IDGD	
CC(C)N1CCC(C(=O)N2CCO[C@@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)CC1	1832416367	ZYVSXAAUVIPIFI-IBGZPJMESA-N	436.380	1.367	50	20	IDGD	
Cc1cccc(CCC(=O)N2CCO[C@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)n1	1832614903	HOTZJSFFFBMQTH-JOCHJYFZSA-N	449.624	1.631	50	20	IDGD	
COc1cc(C(=O)N2CCC(N3CCC(NC(=O)C(C)(C)CCl)CC3)CC2)nn1C	1833214570	YIJPIQHHESTYIL-UHFFFAOYSA-N	439.988	1.879	50	20	IDGD	
CC[C@@H](C(=O)NC1CCN(C2CCN(C(=O)[C@H](Cl)COC)CC2)CC1)N(CC)CC	1833539327	QOMCVERGXITHCO-UXHICEINSA-N	445.048	1.932	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccncc3)CCO2)C1	1834012274	WKBXSTWLAIPUDA-KDOFPFPSSA-N	426.311	1.183	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)N1CCC(N2CCC(NC(=O)CCBr)CC2)CC1	1834421647	AWCPVGBDRJOCHU-CQSZACIVSA-N	445.402	1.210	50	20	IDGD	
CC(C)c1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)no1	1834497298	QMEQCEVPTYJMFD-HXUWFJFHSA-N	439.585	1.720	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)C3CCOCC3)CCO2)C1	1835193492	GQRDUHIXWRIUFN-CRAIPNDOSA-N	433.343	1.043	50	20	IDGD	
CNc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)cc1	1835609628	BOFQTPXGQDEVLD-IFXJQAMLSA-N	440.338	1.582	50	20	IDGD	
C=C[C@@H](O)C(C)(C)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](Cl)COC)CC2)CC1	1835718183	WCDYCKXUJABDMX-ZWKOTPCHSA-N	429.989	1.385	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(F)c3F)C2)C1	1837714827	PPUPIYBDQXEPIV-FQEVSTJZSA-N	442.535	1.886	50	20	IDGD	
C[C@@H](Nc1ccccn1)C(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1837738180	OYICQEYSSVKZCW-IIBYNOLFSA-N	438.956	1.603	50	20	IDGD	
CCc1nc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCBr)C3)C2)co1	1838132622	JOKAIEQCDFDXRF-QGZVFWFLSA-N	430.299	1.092	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3oncc3C)CCO2)C1	1838400197	QIQCAKFGALDIEI-CXAGYDPISA-N	430.299	1.227	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)[C@@H]3CCNC(=O)C3)CC2)CC1	1838773493	JRZQJEWTFVUTOT-UONOGXRCSA-N	444.370	1.295	50	20	IDGD	
Cc1c(F)cccc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839197273	OIJINGFHSHMOPW-YJBOKZPZSA-N	447.276	1.895	50	20	IDGD	
C[C@H](C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H](F)Br)CCO2)C1)c1ccccn1	1839203797	WOYDXFVWTXRSBC-JOQOYGCGSA-N	444.301	1.332	50	20	IDGD	
O=C(c1cnn2cccc(F)c12)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1839619056	PVKCWNFINYQPJY-QAPCUYQASA-N	428.823	1.078	50	20	IDGD	
COc1ccc(Cl)cc1CC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1839790152	JSFFATJMGNKZMH-PKOBYXMFSA-N	449.306	1.882	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)(Cl)Cl)CCO2	1839923266	VRUOCORZSOFZKO-GWCFXTLKSA-N	438.135	1.067	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4ccccc4n3C)C2)C1	1840152745	RVIIRPWNNAJSIU-HTAPYJJXSA-N	449.935	1.502	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccnc3SC)C2)C1	1840153951	GKWISSSOUTUDHH-HNAYVOBHSA-N	443.953	1.127	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCn3nc(C)cc3C)CCO2)C1	1840345179	BCQBCFYEHRJIQJ-RXVVDRJESA-N	440.972	1.754	50	20	IDGD	
CC(C)N1CCC[C@H]1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)Br)C2)C1	1840584944	OHXINJRQBBOANK-GJYPPUQNSA-N	446.386	1.099	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)c(Cl)c1	1840733624	LDZZKIRDGBTJJS-LPHOPBHVSA-N	447.315	1.018	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)C[C@@H]2OCCc3ccccc32)C1	1841555213	ZIWZWVKXSOEZJI-IBGZPJMESA-N	428.533	1.267	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC2(CCCN2C(=O)c2cn3[nH]cnc(=O)c3c2C)C1	1844657104	QWHZWKPNAPNJSU-CYBMUJFWSA-N	436.310	1.322	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@H]1C[C@](C)(O)CN1C(=O)OC(C)(C)C)C2	1845167847	XDEMQRNRRAROCY-AVYPCKFXSA-N	443.972	1.968	50	20	IDGD	
CCOC(=O)c1c(CCC(=O)N2CC3(CCCN3C(=O)[C@H](Cl)COC)C2)c[nH]c1C	1846360397	KBJBEHCKZWIZGX-MRXNPFEDSA-N	439.940	1.890	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CCC[C@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](O)CCl)C1	1847562864	CPGBZFRFPANBAM-QEOTZNIISA-N	443.972	1.871	50	20	IDGD	
CC(C)[C@@H](NC(=O)c1cccs1)C(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	10159537	ALNNAVMZHFSHBR-MRXNPFEDSA-N	427.486	1.855	50	20	IDGD	
Cc1ccc([C@]2(C)NC(=O)N(CC(=O)NNC(=O)c3cc(Cl)ccc3O)C2=O)cc1	10600870	ORQBJKYQAAMCFK-FQEVSTJZSA-N	430.848	1.582	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)COc1ccccc1[N+](=O)[O-]	11083734	JIYJLYOGNZXKHT-UHFFFAOYSA-N	437.792	1.640	50	20	IDGD	
O=C(CCCc1nc2ccccc2c(=O)[nH]1)NNC(=O)c1csc(N2CCOCC2)n1	12801678	UAPQTNLGMRQMOS-UHFFFAOYSA-N	442.501	1.000	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)cc1	16095346	UXBPICNHCNYCGP-UHFFFAOYSA-N	443.485	1.559	50	20	IDGD	
CCCn1nc(C(=O)NNS(=O)(=O)c2ccc(F)c(F)c2F)c2ccccc2c1=O	16095563	IWYNDMMXIYUDDT-UHFFFAOYSA-N	440.403	1.847	50	20	IDGD	
C[C@@H]1Cc2cc(C(=O)OCC(=O)NNC(=O)c3ccccc3)ccc2N1S(C)(=O)=O	17161663	RELMHFHZWDKJGJ-CYBMUJFWSA-N	431.470	1.015	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNS(=O)(=O)c3ccc(S(N)(=O)=O)cc3)cc2C1	18995915	RCVPHGRBRXLACH-JTQLQIEISA-N	429.545	1.144	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)[C@@H](Cc2ccc(F)cc2)n2nnnc2C)c1	107707637	GPXDIJADHXPNKA-GOSISDBHSA-N	426.452	1.748	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)N[C@H](c1ccc2c(c1)OCCO2)C1CC1	725872377	DNBKODVABNWXPE-SFHVURJKSA-N	430.486	1.731	50	20	IDGD	
C=CCN1C(=O)C(=O)N(CC(=O)OCC(=O)NN=C(c2ccccc2)c2ccccc2)C1=O	726042982	IMHWEURNKPRJDG-UHFFFAOYSA-N	448.435	1.075	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@@H]2CCCC[C@H]2C(=O)N2CCCC2)cc(OC)c1OC	726864973	NCGASQXTOKKELA-HZPDHXFCSA-N	433.505	1.902	50	20	IDGD	
COCc1cccc(S(=O)(=O)NNC(=O)c2ccc(CSc3nncn3C)cc2)c1	727351060	ZEEUFEWIGPLPQW-UHFFFAOYSA-N	447.542	1.877	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=S)NCC2CCC2)ccc1OC	727866329	DRLCYPJNINSARY-UHFFFAOYSA-N	428.580	1.635	50	20	IDGD	
CCCN(C)c1ccc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1	728338506	KUVFULYJOTYUET-IBGZPJMESA-N	427.457	1.677	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)[C@@H]2CC[C@@H](C(F)(F)F)NC2=O)c1	728527773	RZRZVPKRPMTKPA-KCJUWKMLSA-N	438.200	1.676	50	20	IDGD	
Cc1ccc(S(N)(=O)=O)cc1C(=O)NNC(=O)c1cc(F)ccc1Br	728551036	VPMFJIMPBLLDRH-UHFFFAOYSA-N	430.255	1.619	50	20	IDGD	
COc1cc(OC)cc(C(=O)N2CCC(C(=O)NNC(=O)c3cccc(C#N)c3)CC2)c1	728826800	XOGCCPVBHRKGON-UHFFFAOYSA-N	436.468	1.889	50	20	IDGD	
CSc1ccc(C(=O)c2ccccc2C(=O)NNC(=O)c2cnn[nH]2)cc1[N+](=O)[O-]	729456780	HLGXBORDTHOONI-UHFFFAOYSA-N	426.414	1.741	50	20	IDGD	
COc1ccc(-n2cnnc2SCC(=O)NNC(=S)Nc2ccc(OC)nc2)cc1	729692377	SDGVANIKCBXYFD-UHFFFAOYSA-N	445.530	1.789	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)[C@@H]2CCCN(S(=O)(=O)c3ccccc3)C2)cn1	729692751	PIQOQXPZNSMANJ-CQSZACIVSA-N	449.558	1.509	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNS(=O)(=O)c1csc(-c2ccc(Cl)cc2)n1	730512714	KUZPWJLVETUBQE-UHFFFAOYSA-N	440.890	1.796	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)N1CCN(CCCc2nc(-c3cccs3)no2)CC1	732197720	XKZZYPYRAAUFKD-INIZCTEOSA-N	448.593	1.930	50	20	IDGD	
O=C(NCCCC(=O)N1Cc2ccccc2C1)NNC(=O)c1nnc(O)c2ccccc12	732474175	JJGFFJIYGJNVDC-UHFFFAOYSA-N	434.456	1.602	50	20	IDGD	
CCOCCCn1c(NNC(=O)Cn2cc([N+](=O)[O-])nc2C)nc2ccccc2c1=O	733265818	LRORKCVZNFSJFS-UHFFFAOYSA-N	429.437	1.380	50	20	IDGD	
Cn1nnnc1COC(=O)/C(C#N)=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	733381625	NWWPLTSBHLYQCT-MDWZMJQESA-N	440.851	1.253	50	20	IDGD	
COc1cc(F)c([C@H](C)NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1OC	734006692	FUKIUIKRTOIXCJ-NSHDSACASA-N	429.412	1.524	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)N[C@@H]2CCN(C(C)C)C2=O)cc(OCC)c1OCC	734217710	BGSNPLWKNJGHAZ-OAHLLOKOSA-N	436.509	1.836	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)[C@H]2CC(c3ccccc3)=NO2)CC1	734824930	NMNIUXXVUPQJTK-QGZVFWFLSA-N	431.493	1.910	50	20	IDGD	
CN(CC(=O)NNC(=O)c1cccc(Cl)c1)S(=O)(=O)c1cccc([N+](=O)[O-])c1	737469094	DTDRSZGPVVSBNR-UHFFFAOYSA-N	426.838	1.330	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@@H]2C(=O)NNC(=O)COCc2ccccc2)c(OC)c1	737638442	XTHSQLPRSQPMQR-LJQANCHMSA-N	441.484	1.673	50	20	IDGD	
Cc1cc(C#N)ccc1S(=O)(=O)NNC(=O)c1ccc(CSc2nncn2C)cc1	740809853	HFTLWVFSWMNHKE-UHFFFAOYSA-N	442.526	1.911	50	20	IDGD	
Cc1cc(N2CCCS2(=O)=O)ccc1C(=O)NNC(=O)Cc1nc2ccccc2n1C	741661062	RLQKAQNGHVPWEZ-UHFFFAOYSA-N	441.513	1.425	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)CCc2ccc(S(=O)(=O)NC3CC3)cc2)cc1	743828041	XLEZGCLCGSAQJJ-UHFFFAOYSA-N	445.545	1.979	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCC[C@H]2CN(C)C(=O)OC(C)(C)C)n1	744423190	FHGFIFBCZIRUMQ-AWEZNQCLSA-N	425.555	1.473	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)c2nn(-c3ccccc3F)c(C)cc2=O)c1	744594781	JVJWDJGZYAFFFX-UHFFFAOYSA-N	438.415	1.606	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1cccc(N2CCOC2=O)c1	744620749	NDQZQBFEDSIPOX-UHFFFAOYSA-N	446.485	1.421	50	20	IDGD	
COC(=O)c1c(C)[nH]c(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)c1C	744621383	VRAKUECYJQVKGW-UHFFFAOYSA-N	436.490	1.196	50	20	IDGD	
Cc1cc(C)c(N2C[C@@H](C(=O)OCC(=O)NNC(=O)c3ccc(C#N)cc3)CC2=O)c(C)c1	744698060	LWKZDGDACOKWCZ-IBGZPJMESA-N	448.479	1.841	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)NCCCN2CCC[C@@H](C(N)=O)C2)c1	745830167	KBXQCVSJELUNFX-QGZVFWFLSA-N	433.553	1.415	50	20	IDGD	
COc1cc(CCNC(=O)NNC(=O)Cc2cn3ccccc3n2)c([N+](=O)[O-])cc1OC	746741384	MOUIILLHVISROD-UHFFFAOYSA-N	442.432	1.375	50	20	IDGD	
COc1cc(C)nc(NNC(=O)NC[C@@H](c2ccc(OC)c(OC)c2)N2CCOCC2)n1	746741756	AJWOVLXLNKJQOE-INIZCTEOSA-N	446.508	1.510	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)Cc1cn2ccccc2n1)N1CCN(c2ccccc2)CC1	746750246	MHGWKOGJIGXNNZ-GOSISDBHSA-N	435.532	1.418	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1=O	747586821	OKTVADCAUCTZAG-INIZCTEOSA-N	433.415	1.752	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)[C@@H](NS(C)(=O)=O)C(C)(C)C	748594453	SZVJAKSAFBXSAI-CQSZACIVSA-N	434.584	1.170	50	20	IDGD	
CC(C)[C@H](C(=O)NNc1c(F)cc(C(=O)NC2CC2)cc1F)N1CCCS1(=O)=O	748834601	PVZXZAIPRDQOEL-MRXNPFEDSA-N	430.477	1.360	50	20	IDGD	
CCCCO[C@H]1C[C@@H](NC(=O)NNC(=O)c2csc(N3CCOCC3)n2)C1(C)C	748968889	JBBBCKOTFDAMHD-CABCVRRESA-N	425.555	1.908	50	20	IDGD	
Cc1cc(N2CCC(NC(=O)NNC(=O)c3ccc4c(c3)OCCO4)CC2)nc(C)n1	749617131	VNEGCEAUBIZCPL-UHFFFAOYSA-N	426.477	1.478	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc2c(c1)nc(CCC(=O)NNC(=O)CC1CCCC1)n2C	749952198	JYHDDBDQRKCLPL-UHFFFAOYSA-N	435.550	1.484	50	20	IDGD	
COc1cc(OC)cc(N2C[C@H](C(=O)NNC(=O)[C@H]3COc4ccccc4O3)CC2=O)c1	752269324	VIMSDZNECZATOI-BFUOFWGJSA-N	441.440	1.044	50	20	IDGD	
CCOC(=O)c1cn(C)nc1NC(=O)NNc1ccccc1S(=O)(=O)NC(C)(C)C	752806404	WDMKFOOHQFFGAM-UHFFFAOYSA-N	438.510	1.822	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)CCc2c(C)nc3c(c(O)nn3C)c2C)c1	754550676	FWAVOXPZFKDSLA-UHFFFAOYSA-N	439.472	1.536	50	20	IDGD	
O=C(NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12)c1cnc2[nH]nnc2c1	754845905	NPCSVQYHCIIJSF-UHFFFAOYSA-N	440.423	1.186	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)[C@@H](C)CS(=O)(=O)c1ccc(F)cc1	755050042	VENMMQCECYAGAJ-STQMWFEESA-N	426.441	1.990	50	20	IDGD	
Cc1c(NC(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)c(=O)n(-c2ccccc2)n1C	755319124	DKVHUKYMFXZSJN-UHFFFAOYSA-N	446.508	1.942	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N(C)C[C@@H](O)C2CC2)cc1	755519629	XCCDNCYIUFXYLH-ZZODWALSSA-N	437.500	1.570	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1ccc(-c2nnc3n2CCCCCC3)cc1	755582279	CINQUUNXTITJEZ-ZDUSSCGKSA-N	449.537	1.152	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)Nc1cccc(CN2CCCC2=O)c1	755687842	WCDWLGXGCCJMPJ-UHFFFAOYSA-N	437.504	1.668	50	20	IDGD	
Cc1ccnc(NNC(=O)C2CCN(S(=O)(=O)c3ccc4c(c3)OCCO4)CC2)c1	755838547	PGSRBNXJWUKPAL-UHFFFAOYSA-N	432.502	1.705	50	20	IDGD	
CCCS(=O)(=O)Nc1ccc(NC(=O)NNC(=O)c2nnc(O)c3ccccc23)cc1	756572278	MJFVFZWIFJWUTG-UHFFFAOYSA-N	444.473	1.954	50	20	IDGD	
Cc1cc(S(N)(=O)=O)cc(NC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c1C	756634049	LSJRTRGBNBYPDY-UHFFFAOYSA-N	428.474	1.603	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)Nc3ccc(C(N)=O)cc3F)n[nH]2)cc1OC	756821824	UWTDPNCPXNYDBL-UHFFFAOYSA-N	442.407	1.798	50	20	IDGD	
Cn1cc(C#N)c(NC(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)n1	756871321	OKZJBTPZBJDMGL-UHFFFAOYSA-N	442.443	1.460	50	20	IDGD	
CCCCN1C(=O)CC[C@@H](C(=O)NNc2ccc(C(N)=O)nn2)[C@@H]1c1ccccc1OC	757400051	PRSDAMGNIAJHGB-QRWLVFNGSA-N	440.504	1.807	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)Nc1ccccc1N(C)S(C)(=O)=O	757660331	DJEAWVLAVHLMTE-UHFFFAOYSA-N	436.490	1.713	50	20	IDGD	
COC(=O)c1cc(NC(=O)NNC(=O)COCc2ccccc2)cc(S(C)(=O)=O)c1	757673556	HVLSVVSRBRHRBP-UHFFFAOYSA-N	435.458	1.246	50	20	IDGD	
CC(C)(CC(=O)N1CCN(S(=O)(=O)CBr)CC1)NC(=O)OC(C)(C)C	758522780	KBBGZLUBAGDSET-UHFFFAOYSA-N	442.376	1.506	50	20	IDGD	
O=C(CCNC(=O)NNC(=O)C(=O)Nc1ccccn1)Nc1ccc(Br)cc1	758714585	YCUPDPPUCCOJOG-UHFFFAOYSA-N	449.265	1.142	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@H](C#N)[C@@H](NC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)C1	758768032	HRKWHEHTSCUPON-PBHICJAKSA-N	439.476	1.575	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)C(O)(c2ccccc2)c2ccccc2)n1	759152969	KEVOTTJIHVZIMD-UHFFFAOYSA-N	439.493	1.621	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc2c(c1)COC2)NNc1ccc(Cl)cc1[N+](=O)[O-]	759715161	FAXXHZDTZITLBF-UHFFFAOYSA-N	426.838	1.700	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCCCC2)cc1NC(=O)C(=O)NNC(=O)C(C)(C)C	761063296	FLDDADQNVDAZQA-UHFFFAOYSA-N	440.522	1.002	50	20	IDGD	
O=C(NNc1nccc(N2CCOCC2)n1)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1	762851134	BDOLDPNWHQSRFG-GFCCVEGCSA-N	447.477	1.031	50	20	IDGD	
CCC(=O)NNC(=O)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)[C@@H]2C[C@H]3CC[C@H]2C3)cc1	763441566	XJXSLPBLWZTQGG-WSMBLCCSSA-N	436.534	1.286	50	20	IDGD	
COC(=O)c1cc(F)c(F)cc1NC(=O)C(=O)NNC(=O)c1ccc2ccccc2n1	763449892	IODYWFPMWUPNQA-UHFFFAOYSA-N	428.351	1.699	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cc(C3CCCC3)nn2C)cc(OC)c1OC	763538897	GCNXORJNUXQEFA-UHFFFAOYSA-N	445.476	1.503	50	20	IDGD	
CCN(CC)C(=O)c1ccccc1NC(=O)C(=O)NNC(=O)[C@@H]1COc2ccccc2O1	763573895	WEBNEUFBAJQFKH-SFHVURJKSA-N	440.456	1.095	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(C(=O)N3CCCCC3)c2)c1	763619416	WJRAECDNVGSPLE-UHFFFAOYSA-N	438.484	1.786	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2c3c(nn2-c2ccccc2)CCC3)c1	763624960	PZHHLWGFMQWTIC-UHFFFAOYSA-N	433.468	1.834	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(F)c(Br)c1	763645750	ACCMWSMUIKMIMR-UHFFFAOYSA-N	440.225	1.762	50	20	IDGD	
Cc1ccnc(Oc2ccc(NC(=O)C(=O)NNC(=O)COc3ccccc3F)cc2)n1	763682880	QYRPZBWAJFKFPN-UHFFFAOYSA-N	439.403	1.881	50	20	IDGD	
CC(C)C[C@@H](NC(=O)c1ccc(Cl)cc1)C(=O)NNC(=O)CNC(=O)c1cccnc1	763825472	YIGIQHSFMMDBHF-QGZVFWFLSA-N	445.907	1.457	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)cc(OC)c1OC	763856839	ILRAIXSQBODNAA-NSHDSACASA-N	435.408	1.405	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cc3c(cc2C)OCO3)cc1	763866053	NTPIFXJZLIFWCF-CYBMUJFWSA-N	429.429	1.676	50	20	IDGD	
Cc1ccc(S(C)(=O)=O)cc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccc(F)cc1	763872258	LUMMDHYMOKYCRD-LBPRGKRZSA-N	437.449	1.091	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2c(C)cc(Cl)cc2C)ccc1C(N)=O	763881390	DKGFGIXAZOTNMC-CYBMUJFWSA-N	446.891	1.918	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc(C)c(N2CCCS2(=O)=O)c1	763959224	AZLDUMJIXPPUPV-UHFFFAOYSA-N	430.486	1.243	50	20	IDGD	
O=C(NNC(=O)c1cc2c(s1)CCCCC2)C(=O)Nc1cccc(N2CCNC2=O)c1	763961463	FVZHXSTUOHWICH-UHFFFAOYSA-N	441.513	1.946	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)Nc1cccc(-n2ccnc2)c1	764005035	SJTZRBGDXVQXQR-UHFFFAOYSA-N	431.250	1.373	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1cc(C(=O)NC2CC2)ccc1C	764012478	QUTMEUUYLQMICS-UHFFFAOYSA-N	444.875	1.949	50	20	IDGD	
CN1CCN(c2ccc(NC(=O)C(=O)NNC(=O)c3cccc(C#N)c3)cc2Cl)CC1	764234750	ITYAGGGGLVYSAT-UHFFFAOYSA-N	440.891	1.363	50	20	IDGD	
NC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cccc(OC(F)F)c2)ccc1Cl	764251748	YATMOEOAYUCBOV-UHFFFAOYSA-N	426.763	1.440	50	20	IDGD	
CCCS(=O)(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)C(C)(C)c2ccccc2)c1	764308903	HZPUPEVIHVSYSH-UHFFFAOYSA-N	446.529	1.902	50	20	IDGD	
COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NNC(=O)CSc1ccccc1OC	764392621	ILRVXFHIVSGDSI-UHFFFAOYSA-N	434.430	1.490	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COCCO1)C(=O)Nc1ccc(Br)c(Cl)c1Cl	764432679	JILQQENTPUIJAM-QMMMGPOBSA-N	441.065	1.257	50	20	IDGD	
COc1nccnc1NNC(=O)c1ccc(S(=O)(=O)NCCc2cccs2)cc1	764469848	KQUMKRJNUSAZBN-UHFFFAOYSA-N	433.515	1.825	50	20	IDGD	
CC(C)[C@H](NC(=O)C(F)(F)F)C(=O)NNC(=O)COc1ccc(Br)cc1	765974425	REHWJIHVUVSESQ-LBPRGKRZSA-N	440.216	1.678	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(O)c(C(=O)NNC(=O)c2ccc(Br)s2)c1	766967841	CXVYDEOUMUIOBF-UHFFFAOYSA-N	448.320	1.541	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)CN3C(=O)[C@H]4[C@H]5C=C[C@@H](C5)[C@H]4C3=O)n[nH]2)c1	768264337	HPTLLTSIJYBOSB-WZBLMQSHSA-N	433.468	1.262	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C[C@](O)(c1nccn1C)C(F)(F)F	768628936	CGKWSAHCHQDVBE-HNNXBMFYSA-N	436.412	1.116	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1	768639446	QVKUNKRADCVPQG-UHFFFAOYSA-N	431.430	1.950	50	20	IDGD	
COc1ncc(NC(=O)NNc2ccccc2S(=O)(=O)NC(C)(C)C)cc1C(N)=O	770067908	BFUNXFSTAXSALU-UHFFFAOYSA-N	436.494	1.415	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2CCN(C(=O)OCc3ccccc3)C2)c1	770199103	GAMLRGBDLOHFFW-QGZVFWFLSA-N	445.497	1.510	50	20	IDGD	
COc1cc(OC)cc(C(=O)N2CCC(C(=O)NNC(=S)NCCSC)CC2)c1	770240414	OVZOPODIYBGVEH-UHFFFAOYSA-N	440.591	1.414	50	20	IDGD	
COc1ccc(C)cc1N1C[C@H](C(=O)NNC(=O)c2ccc3c(c2)OCCO3)CC1=O	770406002	DJCRQWDXKJBAIU-OAHLLOKOSA-N	425.441	1.589	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3ncccc3C(F)(F)F)cc2)CC1	770811884	QJZTUGRNSMJEMQ-UHFFFAOYSA-N	443.451	1.793	50	20	IDGD	
CNS(=O)(=O)c1csc(C(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)c1	770965002	FOELXVIPEXNJET-UHFFFAOYSA-N	425.496	1.013	50	20	IDGD	
Cc1cc(S(=O)(=O)NCCNC(=O)NNC(=O)c2ccc3ccccc3n2)c(C)s1	772626311	QXKSLNQWRHNBBU-UHFFFAOYSA-N	447.542	1.836	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)[C@@]12CCC(=O)N1c1ccccc1S2	772889971	URWONEMEQINSJG-FQEVSTJZSA-N	444.900	1.733	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@@H]1CN(C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)CCO1	773292236	JQGNJGXCBIHRCB-QGZVFWFLSA-N	444.492	1.452	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)C(=O)Nc1ccc(I)cn1	773549032	DPYCUGZTZIHRSO-UHFFFAOYSA-N	442.188	1.154	50	20	IDGD	
O=C(NNc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(F)c(S(=O)(=O)NC2CC2)c1	773643357	OYCIPERONORIQS-UHFFFAOYSA-N	437.409	1.256	50	20	IDGD	
CC(C)c1nccnc1NNC(=O)C(=O)Nc1ccccc1S(=O)(=O)N1CCCCC1	773991680	KAGLIGILAMLTSX-UHFFFAOYSA-N	446.533	1.856	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@@H](C(=O)NNc2ccc(C(F)(F)F)cn2)[C@H](C)O)cc1	775249277	JZZYXBHIRUMZTG-XHDPSFHLSA-N	432.424	1.580	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)Nc2ccc(C[C@H]3NC(=O)NC3=O)cc2)cc1C	775708027	LZHFYRHRKNMCGN-QGZVFWFLSA-N	425.445	1.286	50	20	IDGD	
COc1cc(OC)cc(C(=O)N2CCN(CC(=O)NNC(=O)c3cccc(C)c3)CC2)c1	777532561	XIMHUZNYPZCOKF-UHFFFAOYSA-N	440.500	1.231	50	20	IDGD	
CC(=O)NC1(c2noc(CCC(=O)NNc3cc(Cl)nc(N)n3)n2)CCCCCC1	779373477	PHDAUXOEOVYAMF-UHFFFAOYSA-N	436.904	1.857	50	20	IDGD	
COc1cccc(NNC(=O)CCNS(=O)(=O)c2cccc(Br)c2)n1	780770315	UDUWUHHXGCSQAD-UHFFFAOYSA-N	429.296	1.664	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)C[C@@](C)(O)c3ccccc3)cc2)CC1	780992524	ZGYMLIXYUCEQSB-OAQYLSRUSA-N	432.546	1.364	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNc2ncncc2Cl)c(Br)cc1F	782159073	MBDJNVGTDFPIHE-UHFFFAOYSA-N	446.620	1.900	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C(=O)Nc2cccnc2-c2ccccc2)nc2ccccc21	782894145	MVPRYJIGCPXDTA-UHFFFAOYSA-N	428.452	1.964	50	20	IDGD	
CCOc1ccc(C(C)(C)C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)cc1OCC	783574581	MKNZAENULFLJLN-CQSZACIVSA-N	427.523	1.279	50	20	IDGD	
COC(=O)[C@H](Cc1ccc(Cl)cc1)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	783575290	XOCYUMCEVIKQSB-KRWDZBQOSA-N	439.921	1.609	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1ccnc(Oc2ccccc2)c1	784005387	YCAZVWUGWGQGRB-UHFFFAOYSA-N	439.453	1.451	50	20	IDGD	
C[C@H](C[S@@](C)=O)NC(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1	784254388	LICXEKYWHNEYKL-IURTXMEQSA-N	428.558	1.711	50	20	IDGD	
CC(=O)N1CCN(Cc2ccc(NC(=O)C(=O)NNc3ccc(F)c(F)c3F)cc2)CC1	784806939	NLYQFMXHTGXIFX-UHFFFAOYSA-N	449.433	1.850	50	20	IDGD	
O=C(NNc1ccnc(Br)c1)C(=O)Nc1ccccc1CN1CCNC1=O	784828348	GBJVJKVYJRJPQR-UHFFFAOYSA-N	433.266	1.451	50	20	IDGD	
Cn1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC3CCCCCCC3)cn2)n1	784932031	CEXJNTUHSBCDHW-UHFFFAOYSA-N	449.537	1.288	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNc2ncc(F)cn2)c(OCC(F)(F)F)c1	784949167	GGVGYKWPFGJWHO-UHFFFAOYSA-N	431.302	1.425	50	20	IDGD	
CN(C)c1nccc(NNC(=O)C(=O)Nc2ccc(C(=O)NCCc3ccccc3)cc2)n1	784970247	FWADZWKRWZZVEX-UHFFFAOYSA-N	447.499	1.597	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)cc1Br	785066537	DCQHRMNLZLMVFB-UHFFFAOYSA-N	446.261	1.434	50	20	IDGD	
Cc1ccc(C(=O)NCC2CC2)cc1NC(=O)C(=O)NNC(=O)Cc1ccccc1F	785990453	HJXWVFNWFRIKMJ-UHFFFAOYSA-N	426.448	1.603	50	20	IDGD	
Cn1cc(-c2ncccc2NC(=O)C(=O)NNC(=O)c2cccc(Br)c2)cn1	786416798	JSIMPNHZAPXPAR-UHFFFAOYSA-N	443.261	1.644	50	20	IDGD	
CC(C)Oc1cc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2F)ccc1C(N)=O	789739240	JQUPPEGVGZQLKI-UHFFFAOYSA-N	436.827	1.765	50	20	IDGD	
Cc1nn[nH]c1C(=O)NNC(=O)CCN1CCN(C(c2ccccc2)c2ccccc2)CC1	789868844	CLYRNZLROCHCJH-UHFFFAOYSA-N	447.543	1.671	50	20	IDGD	
CCOCCCn1c(NNC(=O)[C@@H]2CC(c3cccnc3)=NO2)nc2ccccc2c1=O	790635800	WVHATFVWZNDBJW-IBGZPJMESA-N	436.472	1.854	50	20	IDGD	
O=C(NNc1nc2ccccn2n1)C1CCN(S(=O)(=O)c2cc(F)ccc2F)CC1	791239177	FPOFHVFJHIMJKH-UHFFFAOYSA-N	436.444	1.552	50	20	IDGD	
CCS(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)s1	792218794	XQNYVJGUHBLFRR-UHFFFAOYSA-N	428.448	1.300	50	20	IDGD	
O=C(NNc1nc2ccccn2n1)C(=O)Nc1ccc(N2CCOCC2)cc1C(F)(F)F	792393456	HKNMFHZFPSGJLA-UHFFFAOYSA-N	449.393	1.667	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1cccc(C(F)(F)F)c1)C(=O)NNc1nc2ccccn2n1	792513233	HFWQBMKBKOTXCY-SNVBAGLBSA-N	428.396	1.558	50	20	IDGD	
C[C@@H](CC(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1)S(=O)(=O)c1ccc(F)cc1	794709601	BTGYJOHOGPAOMV-ZDUSSCGKSA-N	443.522	1.772	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@](C)(O)CSc2cccc(F)c2)c2ccccc2c1=O	794774932	JWRHWEKGVPBPRY-OAQYLSRUSA-N	444.488	1.860	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)Cc2nc(-c3ccc(S(C)(=O)=O)cc3)cs2)n1	797245627	MPOYXAWJMYBZAF-UHFFFAOYSA-N	430.511	1.921	50	20	IDGD	
CNC(=O)COc1ccc(NC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])c(C)c1	797681217	ZBOLRWHCDYREBR-UHFFFAOYSA-N	431.405	1.260	50	20	IDGD	
O=C(NCC(F)(F)F)NNC(=O)c1cccc(NN2C(=O)[C@H]3CC=CC[C@H]3C2=O)c1	798315121	ATYDVHBPLGIMJI-BETUJISGSA-N	425.367	1.471	50	20	IDGD	
Cc1nccnc1N1CCN(C(=O)NNC(=O)c2ccc(Br)s2)CC1	799355037	YZTZAMFKXGMBFK-UHFFFAOYSA-N	425.312	1.786	50	20	IDGD	
NC(=O)c1cc(Br)cc(S(=O)(=O)NNC(=O)c2c[nH]c3ccccc23)c1	799519723	PYXGPSZZRJERNQ-UHFFFAOYSA-N	437.275	1.653	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN(C)CC(=O)N(C)[C@@H](C)c2ccccc2)cc1OC	800499167	DDLXVEHVACWABD-INIZCTEOSA-N	442.516	1.616	50	20	IDGD	
O=C(N=c1cc[nH]cc1)NNC(=O)C1CCN(S(=O)(=O)c2ccc3c(c2)CCC3)CC1	802027491	JCKHKOSIEZODJL-UHFFFAOYSA-N	443.529	1.246	50	20	IDGD	
COCCNS(=O)(=O)c1c[nH]c(C(=O)NNC(=O)Nc2ccc(OC(F)F)cc2)c1	802046266	HKMGRBXTMLFLAI-UHFFFAOYSA-N	447.420	1.007	50	20	IDGD	
COc1ccc(Cl)c(NC(=O)NNC(=O)CN2C(=O)N[C@@](C)(c3ccccc3)C2=O)c1	802108335	UUBZCDKWLZDQPW-FQEVSTJZSA-N	445.863	1.969	50	20	IDGD	
CC(C)N1C(=O)c2ccc(C(=O)NNC(=O)Nc3ccc(N(C)C)cc3)cc2S1(=O)=O	802121851	RYTRHVABKMEMQF-UHFFFAOYSA-N	445.501	1.772	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)N[C@@H]2CCN(C(=O)Nc3ccccc3)C2)c2ccccc2c1=O	802500831	WKBQNAIPICXZFW-OAHLLOKOSA-N	449.471	1.184	50	20	IDGD	
COCCNC(=O)c1cccc(NC(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)c1	806629262	VWARDYKOXASEOI-UHFFFAOYSA-N	428.474	1.981	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1nc(C2CCOCC2)cs1	806973520	DZXVQTYGUQEFDZ-UHFFFAOYSA-N	432.502	1.764	50	20	IDGD	
O=C(NNC(=O)N1CCN(c2ccccc2Cl)CC1)c1ccc(-n2cnnn2)cc1	807135516	JYSSQWZJZHPAJN-UHFFFAOYSA-N	426.868	1.492	50	20	IDGD	
COc1cc(CN(C)C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)ccc1OC(F)F	807135578	PVSMNSAGWAQCJQ-UHFFFAOYSA-N	447.402	1.759	50	20	IDGD	
CCOCCOc1ccc(Cl)cc1NC(=O)C(=O)NNc1ccc(-n2ccnc2)nn1	807428658	HSBCPFOTXPPBKR-UHFFFAOYSA-N	445.867	1.813	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)c1nc2ccccc2cc1Br	808406938	OJXRNPRSXWAWJM-UHFFFAOYSA-N	428.246	1.583	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Cc2cccc(Cl)c2F)cc1	809984078	SQAQZZTYZCSGCZ-UHFFFAOYSA-N	427.885	1.798	50	20	IDGD	
N#Cc1ncn(-c2ccccc2NC(=O)C(=O)NNC(=O)c2cccc(C(F)(F)F)c2)n1	810384848	QOIDCNNADSJJSE-UHFFFAOYSA-N	443.345	1.557	50	20	IDGD	
CC(=O)[C@@H]1CC(C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)=NN1c1ccccc1	812729855	VYQFAIWETDTUEM-IBGZPJMESA-N	429.502	1.604	50	20	IDGD	
CC(=NNC(N)=O)c1cccc(S(=O)(=O)N2CCC(C(=O)O)(c3ccccc3)CC2)c1	814686725	XSYRTBBIACGMOT-UHFFFAOYSA-N	444.513	1.886	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)cc1)C1CC1	815570000	NRUFEUUENDNRQC-UHFFFAOYSA-N	430.848	1.961	50	20	IDGD	
O=C(NNc1ncncc1F)C(=O)Nc1ccc(C(=O)NCc2ccc(F)cc2)cc1	815765350	NQCAICWHZVSQJU-UHFFFAOYSA-N	426.383	1.767	50	20	IDGD	
C[C@H](CC(=O)NNC(=O)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1)NC(=O)c1ccccc1	816510428	VZEKNNHOABADAU-NVXWUHKLSA-N	432.521	1.990	50	20	IDGD	
O=C(NNc1nc[nH]n1)c1cccc(S(=O)(=O)N2CCN(c3ccc(F)cc3)CC2)c1	816633908	QQSNBSWXDPDMAU-UHFFFAOYSA-N	445.480	1.212	50	20	IDGD	
Cc1nc(O)c(C(=O)NNc2ccccc2S(=O)(=O)N(C)C)cc1Br	817054586	PCCNTBOPFJTDON-UHFFFAOYSA-N	429.296	1.865	50	20	IDGD	
Cc1nc(CSc2ccc(C(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)cc2)cs1	818028282	BVQIWMLOGGMOCD-ZDUSSCGKSA-N	425.557	1.940	50	20	IDGD	
O=C(COC(=O)c1ccc(NC(=O)C2CC2)cc1)NNC(=O)c1ccc([N+](=O)[O-])cc1	819513158	BBQUZULSBSGQGS-UHFFFAOYSA-N	426.385	1.561	50	20	IDGD	
O=C(CSc1ccccc1C(=O)N1CC[C@@H](B(O)O)C1)Nc1ccc2c(c1)OCO2	864234659	ZAZQJXWIZCHVMT-CYBMUJFWSA-N	428.275	1.835	50	20	IDGD	
Cc1cc(C)n(-c2ccc(Cl)c(C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)n2)n1	913155448	ONQJFZBZGAJBDI-UHFFFAOYSA-N	437.851	1.588	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCCN2CCN(Cc3ccccc3)CC2)cc1OC	915901014	BYXMKUPQIXXEKK-UHFFFAOYSA-N	441.532	1.466	50	20	IDGD	
COc1ccc(C(=O)NN=C(C)c2ccc(S(=O)(=O)N3CCOCC3)cc2)cc1OC	916290328	WREAOHAZZNQDBD-UHFFFAOYSA-N	447.513	1.879	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NC[C@@H](c2ccc(F)cc2)N(C)C)nc1	918087719	GTBHAXRMDVZYFZ-KRWDZBQOSA-N	438.529	1.836	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2nc(C3CC3)no2)c1	918233139	HIXUWNYJEMASTF-UHFFFAOYSA-N	436.494	1.122	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)NCCn2ccnc2)cc1	920855060	VZIXRJCLSOPCCT-SFQUDFHCSA-N	433.472	1.354	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@@H]2CC(=O)N(c3ccccc3)C2)c2ccccc2c1=O	921125832	WMGJGYABVJWRTB-CQSZACIVSA-N	434.456	1.166	50	20	IDGD	
CNC(=O)c1cc(S(=O)(=O)NNC(=O)NCc2cccc(C(F)(F)F)c2)cn1C	921298356	VJMGLCIOMVLQDR-UHFFFAOYSA-N	433.412	1.096	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)NCc1ccccc1NS(C)(=O)=O	1116406282	YUBGDPSXOYQFQT-UHFFFAOYSA-N	438.531	1.689	50	20	IDGD	
CC(C)[C@H](NC(=O)OC(C)(C)C)C(=O)NCC(=O)NNC(=O)c1ccccc1Cl	1319688070	DFVYCHNFHPDTIO-HNNXBMFYSA-N	426.901	1.767	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(CCN(C(=O)c3cnnc4ccccc34)C2)C1	1777724686	AYCNVRDPEQEZQJ-NRFANRHFSA-N	428.565	1.925	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnn(-c3cccnc3)c1)C2)[C@H](F)Cl	1778023636	AEHJHTXDUPEFEI-FUHIMQAGSA-N	435.887	1.929	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnc4[nH]ncc4c3)C2)C1	1778417669	CHWKKXAMMTXLRF-RDTXWAMCSA-N	436.310	1.575	50	20	IDGD	
C[C@H](NC(=O)c1ccc(F)cc1)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Cl)CCO2	1780901616	LYRMYRBPCFMWTA-VRHCTWJESA-N	429.851	1.308	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](C)N(C)C(=O)OC(C)(C)C)C2)C1	1781041990	ZDMAMDLBEOYOHB-SIFCLUCFSA-N	447.960	1.326	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)C(=O)Nc3c(C)cccc3C)C2)C1	1781242427	NTHPFEYGDAZQRY-IIBYNOLFSA-N	437.924	1.326	50	20	IDGD	
Cc1ccc(CCC(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](F)Br)C3)C2)nc1	1781325737	IDZQNKYMIFYQEO-WMZOPIPTSA-N	428.302	1.843	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(CCN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)C2)C1	1781764608	INYPQOXKWWREJE-KRWDZBQOSA-N	444.257	1.962	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(F)nc1C)C2	1782173472	DMJRMOCLIGAGAL-RZQQEMMASA-N	427.904	1.910	50	20	IDGD	
COC(OC)C(=O)N1CCO[C@]2(CCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1	1782861818	KUXXBHUVPMAPQV-NMQRCDEWSA-N	435.427	1.321	50	20	IDGD	
CC(C)(C)CCCCCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2	1783390167	DJMHJTNHWBNKGX-DEOSSOPVSA-N	444.381	1.807	50	20	IDGD	
CC(C)(C)CCCCCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2	1783390171	DJMHJTNHWBNKGX-XMMPIXPASA-N	444.381	1.807	50	20	IDGD	
COCCOCCOCCC(=O)N1CC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1783663560	MXUBFWAHVPJLLO-FQEVSTJZSA-N	434.961	1.151	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)Cn3cccn3)C[C@@H]21	1783969085	INCMQBUZSLXDFR-QEOTZNIISA-N	441.370	1.530	50	20	IDGD	
Cc1nn(C)c(C)c1CC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](C)CBr)CCO2	1784509877	VOPINUYLAHKKOQ-YJYMSZOUSA-N	441.370	1.440	50	20	IDGD	
Cc1noc(C)c1CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)CBr)C[C@@H]21	1785077248	DAFQFRYFFMYCSL-UMPQAUOISA-N	442.354	1.845	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cn3ccc(C)n3)[C@H]2C1	1785373899	HLIKWGNVUFVVMN-JONQDZQNSA-N	427.343	1.345	50	20	IDGD	
C[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(C)(C)CCl)C[C@@H]21)[C@@H]1SC(=N)NC1=O	1787493370	UFJYGGKOWCHCJI-PEDHHIEDSA-N	444.985	1.034	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC1(c2ccc(NC(=O)CN3CCCC3=O)cc2)CCC1	1787917531	DECDPKGTJSQFFV-UHFFFAOYSA-N	429.521	1.116	50	20	IDGD	
CCOC(=O)N1CCC(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](Cl)CC)[C@H]3C2)CC1	1789864182	NMCUYRPABWEFHG-FJIDUMEYSA-N	443.972	1.852	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(C(F)F)no3)C[C@@H]21)[C@H](F)Br	1789922905	NQEWNNAUIGUPFN-OSTYVCCYSA-N	440.216	1.896	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@](C)(O)C(F)(F)F)C[C@@H]21	1790958511	RVXAULRIZGIKMR-QKZHPOIUSA-N	445.276	1.453	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(Cl)ncn3)C[C@@H]21	1791058888	LHRJKJLSAJLYCC-BLFANLJRSA-N	431.718	1.507	50	20	IDGD	
COCCCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1792840311	ISPQVZKDLICZHX-IVSAIRAKSA-N	447.960	1.135	50	20	IDGD	
CCn1nc(C)cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)CBr	1792867683	IUMBNRHLZDCAJE-OEYIWLLWSA-N	427.343	1.446	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1(c3ccc(Cl)cc3)CC1)C2)[C@@H](O)CCl	1792984348	YHNAYXBCRUIOQW-RMHZUWNSSA-N	427.328	1.561	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@H](O)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CO[Si](C)(C)C)C2	1793008744	AIERUGLTRMEFRI-FZKCQIBNSA-N	443.617	1.362	50	20	IDGD	
CC(C)(C)OC(=O)N1CC=C(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](O)CCl)C3)C1	1793423439	WAVGENGNFHCQBO-FZKCQIBNSA-N	427.929	1.401	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1CCC3(CC1)OCCO3)C2	1793453708	SHWTZVCTWNBXJM-XMTFNYHQSA-N	428.957	1.917	50	20	IDGD	
O=C(Cc1cccc(Cl)n1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2	1794195928	DZRULWAZBHFSBV-ANGCBRKESA-N	434.693	1.558	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cc(F)cc(F)c1)C2	1795112531	LMKSZOXAKGNGPL-IVWMJMPLSA-N	431.277	1.882	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ncn(-c2ccccc2)n1	1796541371	JQUBTSFXPWLNBY-HGTKMLMNSA-N	448.321	1.254	50	20	IDGD	
CC1(C)Cc2cccc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)c3cccc(B(O)O)c3)C4)c2O1	1796696339	UAZJVELGGAIVDE-ACDBMABISA-N	448.328	1.646	50	20	IDGD	
C=C1CC(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cc([N+](=O)[O-])ccc2OC(C)=O)C1	1798521376	FFFQRCDGZBCVON-CWPLJXCYSA-N	443.456	1.690	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)Oc1ccccc1	1799379988	XRISSRSVKLMCSO-WVCIDPQESA-N	425.323	1.827	50	20	IDGD	
CC(C)c1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)n[nH]1	1799391387	KPUPVSIXOPBABD-BTTYYORXSA-N	425.493	1.097	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2)[C@H]1CC(c2ccccc2)=NN1	1800153937	VNFQINLJFNRPJY-LORHWOILSA-N	449.349	1.127	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccnc(Cl)n1)C2	1800642054	UBHTWALMUAJBSN-LSCVPOLPSA-N	431.718	1.507	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c(c1)OCO3)C2	1800757234	JYEBJFPGCSNGRD-YGSHXTJESA-N	425.279	1.402	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccnc3c(O)cccc13)C2	1800762140	OOUJVTUSGZHGOK-JRATXPSKSA-N	448.317	1.927	50	20	IDGD	
COc1ccc2cc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)CCC(=O)NN(C)C)[nH]c2c1	1802335983	CUCPPSYHFNUXLE-BJWYYQGGSA-N	441.532	1.801	50	20	IDGD	
Cc1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CCC(=O)NN(C)C)cc(C)c1C(=O)O	1802338480	MMIWODVRISQUBQ-BCDXTJNWSA-N	444.532	1.626	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)CN2CC(=O)NC2=O)[C@H]1c1cccnc1	1803686630	RGQVXRMGAVYFRD-MPGHIAIKSA-N	435.912	1.047	50	20	IDGD	
Cc1cccnc1C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1803799668	KKBLIICTWFOXQL-DENIHFKCSA-N	444.300	1.098	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)C2CC3(CCC3)C2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807366855	HPZXKBLTMHCIMP-SIKLNZKXSA-N	447.344	1.661	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)c(C)o1	1807369419	JFMWAIUZGUETGZ-KNQAVFIVSA-N	447.300	1.605	50	20	IDGD	
Cc1nn[nH]c1C(=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@@H]1c1cccnc1	1807804655	KEMAGDNJFTVREG-IACUBPJLSA-N	425.262	1.518	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)[C@H]1CC=CCC1	1808125554	QLIVTIMXWSBZGO-WEYGHZABSA-N	433.317	1.437	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)[C@@H]2C[C@@H]2F)[C@H]1c1cccnc1	1808408074	GPBFKUXVZXGEPR-KPLCSCQTSA-N	440.479	1.579	50	20	IDGD	
CN1CCN(CCC(=O)N2CCC3(CCCN(C(=O)CCBr)C3)CC2)CC1	1809067299	XRFQKFQPVRHOET-UHFFFAOYSA-N	443.430	1.640	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)[C@@H]1Cc2ccccc2O1	1809579351	FDWOWAGSRNNBPL-KVPLUYHFSA-N	429.904	1.691	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)CN2CCN(C(C)=O)CC2)[C@@H]1c1cccnc1	1809670473	KRMUPHBMQYXPSB-DYXWJJEUSA-N	449.983	1.269	50	20	IDGD	
O=C(CCc1ccccc1)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1	1809976608	KDUMARPHKKWXAN-UHFFFAOYSA-N	434.345	1.844	50	20	IDGD	
C[C@H](NC(=O)c1cnccn1)C(=O)NC[C@@H]1CCN(C(=O)[C@H](F)Cl)[C@H]1c1cccnc1	1810446726	IXZDQLGVENNDPM-CSFVBSKPSA-N	448.886	1.230	50	20	IDGD	
COc1ccc(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](C)Br)[C@H]2c2cccnc2)nn1	1811209425	MAIKWOGRFKEICZ-IFIJOSMWSA-N	448.321	1.983	50	20	IDGD	
CCOC(=O)C1(C(=O)N2CC[C@H](CNC(=O)[C@H](Cl)COC)[C@H]2c2cccnc2)CC1	1813034668	UMELTEVFCSVGBO-BRWVUGGUSA-N	437.924	1.685	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccc(O)n2)n[nH]1	1816461568	ZSPSWHIXFSLLEI-OAHLLOKOSA-N	429.481	1.189	50	20	IDGD	
N=C1NCCN1CC(=O)N1CCCC[C@H]1c1cc(NC(=O)CCBr)n[nH]1	1816782139	KBEUKSPEGOPVIK-LBPRGKRZSA-N	426.319	1.027	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@H]1CCc2nc(NC(=O)CCc3nc(N)n[nH]3)sc2C1	1819560222	UZHJCGJTWVVXIV-ZKANADHPSA-N	446.364	1.625	50	20	IDGD	
C=C[C@H](O)C(C)(C)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCC(=O)NN(C)C)CC2	1819720268	DVPWMAVYCHOWEP-WFASDCNBSA-N	437.566	1.001	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN2CC(=O)NC2=O)[nH]n1	1820862893	WKUFSWGSDYIXCM-APPDUMDISA-N	445.307	1.190	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](C)n2cnnn2)[nH]n1	1822092711	UEUQXGFSYJPQBY-GMXVVIOVSA-N	439.318	1.823	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN2CCCCC2)[nH]n1	1822413452	WVWIQWPTCAHKJY-KRWDZBQOSA-N	433.557	1.261	50	20	IDGD	
C[C@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)n1cccc1	1822672927	UNGULQRFKJNWFD-BEFAXECRSA-N	435.293	1.458	50	20	IDGD	
CC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCN1CCN(C)CC1)CC2	1822844109	URGOGYJTKNSGSN-UONOGXRCSA-N	428.002	1.710	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CN1CCN(C)CC1)CC2	1825642552	XCGXAQZZTZSEPV-NEPJUHHUSA-N	444.399	1.086	50	20	IDGD	
O=C(CCN1C(=O)C=CC1=O)N[C@@H]1CCc2nc(NC(=O)C(Cl)Cl)sc2C1	1826093335	XNCBATXYENQLQB-MRVPVSSYSA-N	431.301	1.174	50	20	IDGD	
C[C@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](C)n3cnnn3)sc2C1	1826985027	PNFJZAMUEHCIBQ-YIZRAAEISA-N	428.316	1.086	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H]3CC=CCC3)CCO2)C1	1830554560	IUILNONXIJMKET-FRQCXROJSA-N	429.355	1.830	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H](C)n2cnnn2)CC1	1831656826	LJLAACYDQXJLOM-KCQAQPDRSA-N	427.347	1.637	50	20	IDGD	
O=C(Cc1ccc(Cl)s1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1832602805	HIOITCACRLIVDG-HOCLYGCPSA-N	425.309	1.935	50	20	IDGD	
CCc1ncccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1833519348	PYVVNQMHPLXGIR-QAPCUYQASA-N	444.301	1.405	50	20	IDGD	
Cc1c(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@](C)(Cl)CCl)C3)C2)cnn1C	1834426419	XVUDRCQTAGDQET-MSOLQXFVSA-N	433.336	1.035	50	20	IDGD	
Cc1ccc(OCC(=O)NC2CCN(C3CCN(C(=O)[C@H](O)CCl)CC3)CC2)cc1	1834535650	LOAYCINAZYYGEI-HXUWFJFHSA-N	437.968	1.545	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)c3cc(O)n[nH]3)CC2)CC1	1834766731	MXOHIDWQEBPGGD-LBPRGKRZSA-N	442.358	1.332	50	20	IDGD	
CC1=CC[C@@H](C(=O)N2CCOC[C@]3(CN(C(=O)CCBr)CCO3)C2)CC1	1834821266	DSTWLCXIYQXAHL-APWZRJJASA-N	429.355	1.974	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)c3cccc(F)c3F)C2)C1	1834823841	MKVQZWGRILZDCH-SFHVURJKSA-N	447.276	1.820	50	20	IDGD	
O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)CCc1ccccc1)CCO2	1834836200	IPKMKUKUWKWXLJ-FQEVSTJZSA-N	439.350	1.861	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CCC(F)(F)F)CCO2)C1	1835328928	FLOJPSSMURRCCP-IUODEOHRSA-N	445.276	1.959	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)c1ccc2cccnc2n1	1835529060	JKPKWKDYAPHTOT-IBGZPJMESA-N	445.951	1.415	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)n1cccc1C=O)CCO2	1835950871	XXOZOPBUQMTRDZ-DJPFJPOOSA-N	439.940	1.726	50	20	IDGD	
Cc1nccnc1C(=O)NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1	1836013380	HBNRWRKLZJKUNG-INIZCTEOSA-N	442.333	1.661	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](C)Cn3cncn3)CC2)CC1	1838421350	OACOXGNHTNBTOL-YJBOKZPZSA-N	441.960	1.167	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccncc3)CCO2)C1	1839060216	VBQNIQRDBQBSHG-OALUTQOASA-N	430.332	1.317	50	20	IDGD	
C[C@H](C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](F)Br)CCO2)C1)n1cccc1	1839202801	QBLQVBRTJVFEFO-JKIFEVAISA-N	432.290	1.196	50	20	IDGD	
Cc1cccc(F)c1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839203756	VJJLGPPHHCKYGS-MAUKXSAKSA-N	447.276	1.895	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(C)cc(F)c3)CCO2)C1	1839285547	DEZDMEPAXJHQRU-PXNSSMCTSA-N	428.888	1.458	50	20	IDGD	
COc1cc(C)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)cc1OC	1839399180	NKFPDAPZBPSOEO-PXNSSMCTSA-N	444.887	1.617	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)CCO2)C1	1839414650	USPWNPBFZMFHFA-APWZRJJASA-N	441.868	1.388	50	20	IDGD	
O=C(C(Cl)Cl)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)(Cl)Cl)CCO2	1839923318	XRUAHRDTAFUDAU-LLVKDONJSA-N	428.527	1.617	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)ON=C(C)C)C2)C1	1839965673	HKTOIQDDOOGNAF-MPGHIAIKSA-N	448.358	1.417	50	20	IDGD	
O=C(Cc1ccc(F)cc1F)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1839979927	NLHNUDVRNIKUJA-SFHVURJKSA-N	437.270	1.767	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(Cl)c3)C2)C1	1840154129	MCGZQNGUGIWKPG-APWZRJJASA-N	431.316	1.664	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCCn3ccnc3C)CCO2)C1	1840388339	UIKAOAFWEZRHFN-PXNSSMCTSA-N	426.945	1.446	50	20	IDGD	
COc1ccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)cc1F	1840527769	HZCSEOWMNNHQJH-LJQANCHMSA-N	449.306	1.637	50	20	IDGD	
O=C(c1ccc(-c2ncc[nH]2)cc1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1840747616	ZXGSOAZPKMCUGX-OXQOHEQNSA-N	436.871	1.681	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C1(C#N)CCC1)CCO2	1840815677	DPKLERTWNCXWIU-KDOFPFPSSA-N	428.327	1.310	50	20	IDGD	
CC(C)[C@@H](C(=O)N1CCCC12CN(C(=O)[C@H](O)CCl)C2)N1Cc2ccccc2C1=O	1841587079	FHOQEXTWXMWBTL-MSOLQXFVSA-N	433.936	1.470	50	20	IDGD	
O=C([C@H]1C[C@@H]1c1ccc(Cl)cc1)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843011342	UCUJPIZIDVRGGM-UXHICEINSA-N	438.720	1.641	50	20	IDGD	
C=CCO[C@H](C)C(=O)N1CC2(CCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)C1	1845038392	XXEFDPJXCNAJQB-GOSISDBHSA-N	443.548	1.127	50	20	IDGD	
CN(C)C(=O)NCC(=O)N1CC2(CCCN2C(=O)/C(C#N)=C/c2ccc(F)cc2F)C1	1845870009	GOCFABRFMRZRKW-OVCLIPMQSA-N	431.443	1.346	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC12CN(C(=O)CC(=O)Nc1cc(C)on1)C2	1846069971	HQKFZKHHSPVPFK-LBPRGKRZSA-N	427.299	1.689	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)c1ccco1	1847280527	QOZDVGFYCCOYLZ-RZLSGREXSA-N	441.912	1.647	50	20	IDGD	
Cc1ccc(=O)n(C(C)(C)C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](C)CBr)n1	1847498852	PHILUYSDDZWYGH-QEJZJMRPSA-N	439.354	1.520	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H]1CC[C@@H]2CCC(=O)N2C1	1847500320	FAACWHKVKUGVQW-LEOABGAYSA-N	426.355	1.620	50	20	IDGD	
O=C(NNC(=S)NCCc1cccs1)[C@H]1CC(=O)N(c2ccc3c(c2)OCCO3)C1	11513760	FLMULBGGZOMJJA-ZDUSSCGKSA-N	446.554	1.610	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CCc2c(C)[nH]c(=O)[nH]c2=O)ccc1OCCC(C)C	27235775	DAMUJRAMXDXSDS-UHFFFAOYSA-N	432.477	1.199	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)[C@H]1CCCN1C(=O)Cc1ccccc1	108987248	CLQUGBMNZQCWMB-GOSISDBHSA-N	425.485	1.845	50	20	IDGD	
O=C(NN=Cc1nc(-c2ccccc2)no1)c1cccc(S(=O)(=O)N2CCOCC2)c1	726417790	JMWXGELRBKNPON-UHFFFAOYSA-N	441.469	1.521	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)C2(NC(=O)OC(C)(C)C)CCCC2)c2ccccc2c1=O	727112837	ALHLBRALDAVKLR-UHFFFAOYSA-N	429.477	1.532	50	20	IDGD	
O=C(NNC(=O)N1CCO[C@H](c2ccc(F)c(F)c2)C1)c1ccc(-n2cnnn2)cc1	727473698	PZVWTIDXCIYPOA-KRWDZBQOSA-N	429.387	1.368	50	20	IDGD	
C#Cc1cccc(NC(=S)NNC(=O)CCNS(=O)(=O)c2ccc(F)c(F)c2)c1	727498138	RTLBVBOJBQTYBJ-UHFFFAOYSA-N	438.481	1.632	50	20	IDGD	
Cc1ccc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)CN(C)C)cc2)cc1[N+](=O)[O-]	727761617	TZXOSSOMNYWZOR-UHFFFAOYSA-N	435.462	1.027	50	20	IDGD	
C[C@@H]1CCCN(S(=O)(=O)c2ccc(C(=O)N([C@@H]3CCS(=O)(=O)C3)N(C)C)cc2)C1	728179344	JTJWKHMQWXOAEQ-NVXWUHKLSA-N	443.591	1.213	50	20	IDGD	
O=C(NNC(=O)c1ccc(Br)cc1Cl)c1ccc2[nH]c(=O)c(=O)[nH]c2c1	728870143	TVKSOBTZIZKWLL-UHFFFAOYSA-N	437.637	1.707	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)[C@@H]2CC(=O)N(C[C@H]3CCCN3CC)C2)cc1	729625935	FDUIEIWZVIDVCH-KZNAEPCWSA-N	446.548	1.333	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)[C@H]2CC(=O)N(c3cc(C)ccc3OC)C2)cn1	729692194	AFORRKGMGJVCLT-ZDUSSCGKSA-N	429.502	1.778	50	20	IDGD	
COc1ccc(C(=O)NN=C(C)c2ccc(S(=O)(=O)NCCC(=O)O)cc2)c(OC)c1	729933583	JUQLMYJGIXWEMC-UHFFFAOYSA-N	449.485	1.611	50	20	IDGD	
O=C(CC[C@@H]1NC(=O)N(c2ccc(Cl)cc2)C1=O)NNC(=O)COc1ccc(F)cc1	730767684	IDPRZTNAXZDTOW-INIZCTEOSA-N	448.838	1.911	50	20	IDGD	
O=C(NCCOCC1CC1)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	731119091	MKHXQEDRYNUKQN-UHFFFAOYSA-N	438.531	1.920	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=O)Cc2ccccc2F)ccc1OC	731330037	LFZNUOBCMKGDSW-UHFFFAOYSA-N	437.493	1.869	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)N[C@@H]2CCN(c3ccccc3C(N)=O)C2)c2ccccc2n1	732595091	MHVUFEFBPDMREI-OAHLLOKOSA-N	432.484	1.865	50	20	IDGD	
O=C1CCCc2cc(S(=O)(=O)NNC(=O)c3cnn(-c4ccccc4)c3)ccc2N1	733122940	JNOFFLFVKZAVBD-UHFFFAOYSA-N	425.470	1.770	50	20	IDGD	
CC(C)(C(=O)NNC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1)S(C)(=O)=O	733126323	QGYQDVUJFAMTLV-UHFFFAOYSA-N	427.486	1.519	50	20	IDGD	
Cc1nn(CCCl)c(C)c1C(=O)N[C@H]1CCCN(c2cc(N3CCOCC3)ncn2)C1	733937081	HRBDHNVOACUIOU-KRWDZBQOSA-N	447.971	1.764	50	20	IDGD	
Cc1cc(NNC(=O)c2ccc(Cl)c(S(=O)(=O)NC[C@H]3CCCO3)c2)ncn1	734256277	AYUQMXPWBSQAQF-CYBMUJFWSA-N	425.898	1.653	50	20	IDGD	
CCOCCCN1CC[C@@H](NC(=O)NNC(=O)Cc2nc3ccccc3n2C)[C@@H](C)C1	734684392	NPNZGHMHDTWFNA-DLBZAZTESA-N	430.553	1.583	50	20	IDGD	
O=C(CSc1ccc(Cl)cc1)NNC(=O)N[C@@H]1CCN(CCN2CCOCC2)C1	734686094	KLWQRCOLVPUHLD-MRXNPFEDSA-N	441.985	1.169	50	20	IDGD	
O=[N+]([O-])c1ccccc1S(=O)(=O)NCCNS(=O)(=O)c1ccc(CCCl)cc1	735083727	XZLVQWHWHXCXLL-UHFFFAOYSA-N	447.922	1.633	50	20	IDGD	
O=C(COC(=O)c1csc(Nc2ccccn2)n1)NNC(=O)c1ccc([N+](=O)[O-])cc1	736896779	OLLYFCLFRPZUDD-UHFFFAOYSA-N	442.413	1.808	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)CCSc2ccc(F)cc2)nc2c1c(=O)n(C)c(=O)n2C	737768031	OCMOMFVFAICMLZ-UHFFFAOYSA-N	445.476	1.023	50	20	IDGD	
CC(=NNC(=O)[C@H](C)CN1C[C@H](C)O[C@@H](C)C1)c1cccc(N2CCCS2(=O)=O)c1	741162637	AYEWETSXVQIARR-IKGGRYGDSA-N	436.578	1.812	50	20	IDGD	
CCc1c(C(=O)NNC(=O)CNC(=O)c2ccco2)nnn1-c1ccc(OC(C)C)cc1	741184644	CXDBQXHOZDOPOW-UHFFFAOYSA-N	440.460	1.401	50	20	IDGD	
C=CCNC(=O)c1cccc(S(=O)(=O)NNC(=O)c2cccc(Br)c2)c1	743263681	JSYPFFPDZIIDET-UHFFFAOYSA-N	438.303	1.988	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)[C@H]2CCCN(c3ncnc4sccc34)C2)C[C@@H](C)O1	743291253	OUOJKAZSYHIGKF-OAGGEKHMSA-N	446.577	1.554	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)[C@@H](CNC(=O)OC(C)(C)C)c2ccccc2)C[C@@H](C)O1	743292311	XLFMPJZIONGDMJ-LMMKCTJWSA-N	448.564	1.942	50	20	IDGD	
CC(C)c1ccccc1NC(=S)NNC(=O)CCN1C(=O)[C@H]2[C@H](C1=O)[C@H]1CC[C@H]2O1	743329770	WQCPZEPLXDPPDM-JOCBIADPSA-N	430.530	1.680	50	20	IDGD	
Cn1ccc(N2CCC[C@@H](NC(=O)NNC(=O)c3cccc(Br)c3)C2=O)n1	743687255	LUYOBXXBEZWACZ-CYBMUJFWSA-N	435.282	1.322	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)[C@@H](c2ccccc2F)N2CCOCC2)cc1	745495058	FFISCFKBKLVITO-HXUWFJFHSA-N	429.448	1.512	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NCc2nc(-c3ccc(F)cc3)n[nH]2)cc1	745832482	YQXNGPZXBWNGDV-UHFFFAOYSA-N	447.452	1.550	50	20	IDGD	
O=C(CCS(=O)(=O)c1ccc2c(c1)CCC2)NNC(=O)Cc1cn2ccccc2n1	746555805	HOGQMVWDKGFYHH-UHFFFAOYSA-N	426.498	1.377	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)N(C)CCCC(=O)NNC(=O)Cc2ccncc2)cc1	747322635	GLUXOOMGMMTYCZ-UHFFFAOYSA-N	432.502	1.075	50	20	IDGD	
COc1ncnc(N)c1C=NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	747626007	PZACBDZORLNEHD-UHFFFAOYSA-N	429.444	1.533	50	20	IDGD	
CC(=O)N1CCN(S(=O)(=O)c2cccc(C(=O)NNc3cccc(C#N)c3)c2)CC1	748045902	VYTSNOUGXIUYGB-UHFFFAOYSA-N	427.486	1.168	50	20	IDGD	
O=C(NN=C1C(=O)N(Cc2ncon2)c2ccc(Br)cc21)c1ccncc1	750911814	HEQKLDMWFQOAGW-UHFFFAOYSA-N	427.218	1.908	50	20	IDGD	
CON(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc3ccccc3cc2O)c1	751026281	VKNZFEQQZDEWLW-UHFFFAOYSA-N	429.454	1.802	50	20	IDGD	
N#Cc1ccc(CN2CC[C@@H](NC(=O)NNC(=O)c3cccc4ncccc34)C2=O)cc1	753289696	OQXAUIFKRKXNLQ-HXUWFJFHSA-N	428.452	1.852	50	20	IDGD	
CC(C)(C)OC(=O)NC1(CNC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)CCC1	753334631	LCBOKWMCJAOWPF-UHFFFAOYSA-N	440.522	1.482	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NCC(=O)NNc2ccc(C#N)c(Cl)c2)c1	753522047	CBBNUCNLSPZYAQ-UHFFFAOYSA-N	435.893	1.335	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNS(=O)(=O)c1cc(C(=O)O)c(C)cc1F	753770410	QETGGUPLLJQXSK-UHFFFAOYSA-N	426.422	1.620	50	20	IDGD	
CCCc1nnc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)s1	755472987	RVBILWBUKMQXAR-UHFFFAOYSA-N	438.535	1.742	50	20	IDGD	
CCOCC(=O)NNC(=O)Nc1ccc(OCC)c(S(=O)(=O)N2CCCCC2)c1	755473735	NNZWLQRZMKHCQJ-UHFFFAOYSA-N	428.511	1.449	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)Nc2cc(F)cc(S(N)(=O)=O)c2)cc1	756514112	DXZRKCQRADCBPE-NSHDSACASA-N	440.453	1.492	50	20	IDGD	
O=C(NNC(=O)c1cc2ccccc2cc1O)Nc1ccn(CC(=O)N2CCOCC2)n1	756659183	OZSABFNIZKOMGZ-UHFFFAOYSA-N	438.444	1.067	50	20	IDGD	
CCn1nnnc1-c1cccc(NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c1	756674124	HXXGTKDELYQRDM-UHFFFAOYSA-N	429.462	1.230	50	20	IDGD	
O=C(NN=c1cc[nH]cc1Cl)C1CCN(c2ccc3nnc(C(F)(F)F)n3n2)CC1	757406398	PXXIOOBHQOIBNV-UHFFFAOYSA-N	440.817	1.973	50	20	IDGD	
Cc1cc(C(=O)N2CCOCC2)ccc1NC(=O)NNC(=O)c1cccc(N(C)C)c1	757829169	CUHXYJZGTQDBRK-UHFFFAOYSA-N	425.489	2.000	50	20	IDGD	
Cc1c(C(=O)NNC(=O)Cn2cnc3ccccc32)cnn1CCO[C@@H]1CCCCO1	758068650	NWIWWUDGQMZZLT-HXUWFJFHSA-N	426.477	1.546	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)N[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1C#N	758774004	SZXVBIJDEWKIPD-HUUCEWRRSA-N	447.492	1.554	50	20	IDGD	
O=C(NNC(=O)c1ncc(Br)cc1Br)C(=O)Nc1ccccn1	759404404	QVWTUJJAKRAPAO-UHFFFAOYSA-N	443.055	1.401	50	20	IDGD	
CCCC[C@@H](/N=C1/NS(=O)(=O)c2ccccc21)C(=O)NNc1ccc(C(=O)OC)cn1	759729149	CJEIJSSYHGXQCK-OAHLLOKOSA-N	445.501	1.609	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N=c2cc[nH]cc2I)cc1OC	760027726	AGUGVVNEEGDYBP-UHFFFAOYSA-N	442.213	1.592	50	20	IDGD	
COc1cc(C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)ccc1Cl	760153800	FJVUGBLHGSDDCD-UHFFFAOYSA-N	439.925	1.437	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)C#Cc1ccc2c(c1)OCO2	761232385	PRPXHHJGKADFAZ-UHFFFAOYSA-N	430.800	1.433	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)N[C@H]1CCN(c2ccccc2C(N)=O)C1	761688767	NVWYNGWNAGFDBL-AWEZNQCLSA-N	443.529	1.496	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)Cc2csc(-c3cccnc3)n2)n1	762220800	MDBWIVVXVIIDPG-UHFFFAOYSA-N	431.499	1.446	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1Cl)C(=O)NC1CC1	763433984	LAHJCDCKGPDOPH-UHFFFAOYSA-N	431.836	1.900	50	20	IDGD	
Cc1cccc(NC(=O)C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c1C(=O)N1CCCC1	763445156	FJOZGVICEGNOBM-UHFFFAOYSA-N	439.428	1.539	50	20	IDGD	
Cc1nn(-c2ccccc2)c2sc(C(=O)NNC(=O)C(=O)Nc3cnn(C)c3C)cc12	763539260	OBWHYSAXXASURG-UHFFFAOYSA-N	437.485	1.837	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)n(-c2cccc(Cl)c2)n1	763549288	WRBXBBGMMIXQDL-UHFFFAOYSA-N	441.831	1.963	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1ccn(-c2ccccc2[N+](=O)[O-])n1	763574219	GFQROBHQQGZHPL-UHFFFAOYSA-N	436.432	1.248	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)C(=O)Nc2ccc(S(C)(=O)=O)cc2)c1	763597531	OQFVAWPSXJLFKW-UHFFFAOYSA-N	447.513	1.687	50	20	IDGD	
COCCCOc1ccccc1NC(=O)C(=O)NNC(=O)c1c(C)nc2ccccn12	763625701	WSBHFJZWXJXDID-UHFFFAOYSA-N	425.445	1.458	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccccc2CS(C)(=O)=O)cc1C	763666490	GGXHFTAKCMDNGI-UHFFFAOYSA-N	433.486	1.013	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2csc(-c3ccccn3)n2)c1	763668055	GYJSUTYPIUHLTF-UHFFFAOYSA-N	425.470	1.987	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)ccc1N1CCOCC1	763695390	SXQWYDBJLGMEGA-UHFFFAOYSA-N	446.891	1.650	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)CSc2ccc(Cl)cc2)cccc1-n1cnnn1	763734077	LJEAPPYNHADRTL-UHFFFAOYSA-N	445.892	1.502	50	20	IDGD	
CC[C@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cccc(N(C)C)c2)cc1	763759609	ZWNOOSIOCPNWKN-AWEZNQCLSA-N	425.489	1.681	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2cc3c(cc2Cl)OCCO3)c1	763772361	QCNRZYXTOVFLFX-UHFFFAOYSA-N	435.820	1.528	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2ccc(N3CCOC[C@H]3C)cc2)c1	763773026	SAIKRSWTONQMHZ-CQSZACIVSA-N	442.472	1.329	50	20	IDGD	
Cn1nc(CC(C)(C)C)cc1NC(=O)C(=O)NNC(=O)COc1ccccc1[N+](=O)[O-]	763804100	KGEPAMUOBBAVKV-UHFFFAOYSA-N	432.437	1.082	50	20	IDGD	
COC(=O)[C@H](C)Cc1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)cc1	763812014	ASOXDKKKQTZJPA-CQSZACIVSA-N	438.440	1.075	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)C(=O)Nc1cc(N2CCCC2=O)ccc1F	763840315	RDPOPLGEPIRFBM-UHFFFAOYSA-N	432.383	1.257	50	20	IDGD	
COC(=O)c1cc(OC)ccc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1cccc(C)c1C	763850960	CGJXSMYNDLROSJ-AWEZNQCLSA-N	443.456	1.652	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)C(=O)Nc1ccc(-c2ccccc2)cc1	763917296	UDHZXJKRKAMKMO-UHFFFAOYSA-N	427.424	1.729	50	20	IDGD	
O=C(CN1CCCCCC1)Nc1cccc(NC(=O)C(=O)NNC(=O)c2ccc[nH]2)c1	763980107	CCAFEAFVRLQTDX-UHFFFAOYSA-N	426.477	1.229	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1ccc(OC[C@H]2CCCO2)cc1	764003238	ADOBHUWKPQJPJE-QGZVFWFLSA-N	441.440	1.415	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1cccc(CS(=O)(=O)C(C)C)c1	764137084	YPFGOQCCOHNSJY-UHFFFAOYSA-N	447.513	1.347	50	20	IDGD	
O=C(CCc1ccco1)NNC(=O)C(=O)Nc1ccnc(OCC(F)(F)C(F)F)c1	764169638	QRTXSTVUVDHEBG-UHFFFAOYSA-N	432.330	1.673	50	20	IDGD	
Cc1nn(CC(F)(F)F)cc1C(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	764185177	NYBVYFCVWGOKTF-UHFFFAOYSA-N	429.311	1.280	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(F)c(NC(=O)C(=O)NNC(=O)CCC2CCCCC2)c1	764215006	KLHUFBLTNXDTSZ-UHFFFAOYSA-N	442.513	1.522	50	20	IDGD	
CCSCc1cccc(NC(=O)C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1	764266508	KRZUPCHNEKSYBQ-UHFFFAOYSA-N	442.545	1.732	50	20	IDGD	
Cn1ccnc1C(=O)c1ccc(NC(=O)C(=O)NNC(=O)CCc2ccccc2O)cc1	764278445	PQPQVOWTGIKKNW-UHFFFAOYSA-N	435.440	1.075	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)C(=O)Nc1ccc(C(=O)NC2CCCC2)cc1	764318622	CGFDGGKVNLMARW-UHFFFAOYSA-N	426.448	1.827	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)ccc1Cl	764346310	WAMYEOYZUSPKCM-UHFFFAOYSA-N	441.831	1.712	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)C(=O)Nc1cccc(-c2nnc3n2CCCCC3)c1	764354506	UUQPXJVKJODYDZ-UHFFFAOYSA-N	433.472	1.395	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C)c(I)c2)o1	764368501	XHRVDTUXPBGHMH-UHFFFAOYSA-N	427.198	1.901	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2cnn(CC(C)C)c2C)n[nH]1	764376530	FHNKQJOPJKGEOI-UHFFFAOYSA-N	439.476	1.646	50	20	IDGD	
COC(=O)c1c(NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)sc(C)c1C	764380129	PLJTYIKPVZPYHB-UHFFFAOYSA-N	441.412	1.909	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1ccc(-n2cccn2)nc1	764398285	RPBYJKZIZLVYBN-UHFFFAOYSA-N	426.458	1.154	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1cnn(-c2ccc(C(F)(F)F)cc2)c1	764400435	PVYXIISSGBMRMQ-NSHDSACASA-N	443.382	1.029	50	20	IDGD	
Cc1c(CS(C)(=O)=O)cccc1NC(=O)C(=O)NNC(=O)c1ccc(Cl)cc1F	764411870	AOQYSEJGLPZEEA-UHFFFAOYSA-N	441.868	1.732	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1F)C(=O)Nc1ccccc1CN1CCOCC1	764412036	DBFHJWFWLDNBCH-UHFFFAOYSA-N	434.855	1.711	50	20	IDGD	
COCCc1ccc(Oc2ccc(NC(=O)C(=O)NNC(=O)[C@H]3COCCO3)cc2)cc1	764435864	YCUUMBMZXROJST-LJQANCHMSA-N	443.456	1.169	50	20	IDGD	
COC(=O)NNC(=O)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)[C@@H]2C[C@H]3CC[C@H]2C3)cc1	765375744	IOQBRTUFOHRYFE-QCQGSNGOSA-N	438.506	1.115	50	20	IDGD	
O=C(CNC(=O)c1c(Cl)cccc1[N+](=O)[O-])NNC(=O)c1cc(-c2cccs2)[nH]n1	765565338	OMSAQHXSCYRVJR-UHFFFAOYSA-N	448.848	1.891	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)CN3C(=O)NC(CC)(CC)C3=O)n[nH]2)cc1	765575222	ICTHSSPJBILHRA-UHFFFAOYSA-N	426.477	1.511	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765732664	JOJWSLWUNHBJLW-UHFFFAOYSA-N	440.500	1.070	50	20	IDGD	
NC(=O)Nc1ccc(C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)cc1	765754899	AJAWWLJZJKDUTH-UHFFFAOYSA-N	444.923	1.409	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)c1nccnc1NC(=O)C(C)(C)C	767354755	CGLAJPZTBKRCOO-UHFFFAOYSA-N	427.461	1.317	50	20	IDGD	
CC1(C)CCC[C@@]2(C1)NC(=O)N(CC(=O)NNC(=O)c1cccc(OC(F)F)c1)C2=O	768570691	IMKDBZBHPVLRBE-FQEVSTJZSA-N	438.431	1.940	50	20	IDGD	
Cc1noc(C)c1S(=O)(=O)N1CCC[C@H](C(=O)NNc2cc(C#N)cc(Cl)n2)C1	768694861	GQBQXLSZXYHIGL-ZDUSSCGKSA-N	438.897	1.756	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)NC3CCN([C@H]4CCC[C@@H]4O)CC3)n[nH]2)cc1	769154318	KGVBWJRENVSMFB-PMACEKPBSA-N	426.521	1.707	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3cccc([N+](=O)[O-])c3O)n[nH]2)cc1OC	769279873	FWCJJVQGBFGNNZ-UHFFFAOYSA-N	427.373	1.783	50	20	IDGD	
O=C(NNC(=O)c1cc(S(=O)(=O)NCc2ccccc2)ccc1O)c1ccncc1	769535722	RATXXIFODTXPHS-UHFFFAOYSA-N	426.454	1.341	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)c2ccc(S(N)(=O)=O)cc2F)cc1C	769858547	SIBYFRSAQZPDFD-UHFFFAOYSA-N	443.478	1.023	50	20	IDGD	
C[C@@]1(c2ccc(F)c(Cl)c2)NC(=O)N(CC(=O)NNC(=O)Cc2ccncc2)C1=O	769972959	RVWLHPOOJJDHBB-IBGZPJMESA-N	433.827	1.031	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCc2nc(CS(=O)(=O)NC3CC3)no2)N(C)c2ccccc21	771639667	DURLXQJXRQPIRE-UHFFFAOYSA-N	442.501	1.474	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)C(=O)Nc2ccnn2Cc2cnn(-c3ccccc3)c2)n1	773481700	JLSAIAHQPDFYFV-UHFFFAOYSA-N	431.460	1.606	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2cccc(-c3ncc4n3CCCC4)c2)n1	773529406	RNDJPVPPSWPBRL-UHFFFAOYSA-N	435.488	1.486	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)C(=O)Nc1ccc(C(F)(F)F)cn1	773542483	ORACPMUDHUGXID-UHFFFAOYSA-N	433.387	1.491	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)Nc2ccnn2[C@@H]2CCS(=O)(=O)C2)cc1	776059964	STDBTCGDECYKNQ-DZGCQCFKSA-N	449.489	1.066	50	20	IDGD	
Cc1cnn(-c2c(C(=O)NNC(=O)Nc3ccc(S(C)(=O)=O)cc3)c(C)nn2C)c1	777799793	CPYPZSPLKBTOKH-UHFFFAOYSA-N	431.478	1.093	50	20	IDGD	
N#Cc1ccc(N2CCC[C@@H](NC(=O)NNC(=O)COc3ccccc3F)C2=O)cc1	779967687	YMCJAIJTULFRBA-QGZVFWFLSA-N	425.420	1.602	50	20	IDGD	
CC(=O)[C@@H]1C[C@H](C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)C1(C)C	780155045	PSRNZXXYXHUZFF-ZWKOTPCHSA-N	435.546	1.874	50	20	IDGD	
CCN1C[C@@H](CN(C)CC(=O)NNC(=O)c2ccc(OC)c(OC)c2)Oc2ccccc21	781437530	YFKDGWAOCLENAZ-QGZVFWFLSA-N	442.516	1.684	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)NCc2cccc(S(=O)(=O)N(C)C)c2)c1	782764623	XLPZJZYDFURYEN-UHFFFAOYSA-N	434.518	1.463	50	20	IDGD	
COC(=O)CCNC(=O)c1ccc(NC(=O)C(=O)NNc2nc3ccccc3s2)cc1	782815669	ADEOQKYAMSYDFN-UHFFFAOYSA-N	441.469	1.671	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2ccc(OCc3ccccc3F)cc2)CCS(=O)(=O)C1	783427947	RIIVVEGARBIOGT-HXUWFJFHSA-N	435.477	1.541	50	20	IDGD	
O=C1CN(c2ccc(NC(=O)C(=O)NNc3nccc4sccc34)cc2Cl)CCN1	783436192	VNLUFJCLZJZAMP-UHFFFAOYSA-N	444.904	1.968	50	20	IDGD	
CNC(=O)COc1ccc(NC(=O)C(=O)NNc2ccc(F)cc2Br)cc1	784802484	HDNKSNAAQXFGEK-UHFFFAOYSA-N	439.241	1.795	50	20	IDGD	
O=C(NNc1ncccc1Cl)C(=O)Nc1cccc(S(=O)(=O)N2CCCCC2)c1	784821635	YKVHEYKETMSZOU-UHFFFAOYSA-N	437.909	1.991	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)C(=O)Nc2ccc(=O)n(Cc3ccccc3)c2)c1	784844156	ICBIORPLNRNAPJ-UHFFFAOYSA-N	440.481	1.382	50	20	IDGD	
O=C(NNc1c(F)cc(C(=O)NC2CC2)cc1F)C(=O)Nc1cnn(C[C@@H]2CCCO2)c1	785099241	BJPNVSOZWYJYCZ-AWEZNQCLSA-N	448.430	1.314	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2ccc(NC(=O)[C@H]3CCCO3)cc2)n1	785225354	HEVVJAWEDYVNNH-MRXNPFEDSA-N	441.492	1.522	50	20	IDGD	
CCNC(=O)N(C)NC(=O)C(=O)Nc1cc(Br)cc(C(=O)N2CCCC2)c1	790959907	OAKAKTFUGFWORK-UHFFFAOYSA-N	440.298	1.316	50	20	IDGD	
COc1c(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)cccc1[N+](=O)[O-]	793711684	LUGHFIJTXOSVPJ-UHFFFAOYSA-N	449.489	1.296	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)COCc2nnc(C)s2)c2ccccc2c1=O	794776930	WASGLDJWACOUNQ-UHFFFAOYSA-N	444.517	1.724	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)CN1C(=O)COc2ccc(Cl)cc21	795176552	CLTOQUYVVUZUTK-UHFFFAOYSA-N	438.893	1.459	50	20	IDGD	
O=C(COC(=O)c1cc(F)ccc1-n1cccn1)NNC(=O)c1ccc([N+](=O)[O-])cc1	796087100	VZGVDHNLRWJMGT-UHFFFAOYSA-N	427.348	1.538	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1cc2ccccc2c(=O)o1	797742410	HIPRIMLPQHGEOM-UHFFFAOYSA-N	434.452	1.012	50	20	IDGD	
CN(CCCOCc1ccccc1)C(=O)NNC(=O)c1csc(N2CCOCC2)n1	798509233	HZEXXWDPNYWWBI-UHFFFAOYSA-N	433.534	1.873	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2cc(F)c(Br)cc2Cl)CCS(=O)(=O)C1	799260821	ABIRXBNPRXQRIE-ZDUSSCGKSA-N	442.694	1.378	50	20	IDGD	
CCCCNS(=O)(=O)c1ccc(C)c(NC(=O)C(=O)NNc2ncncc2Cl)c1	799834913	KTEMCGPSICOLIR-UHFFFAOYSA-N	440.913	1.599	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NCCC(=O)OC2CCCCC2)cc1	802452451	ZSPQYYDRJXWWDT-UHFFFAOYSA-N	426.495	1.692	50	20	IDGD	
CSCCNC(=S)NNC(=O)C1(n2cccn2)CCN(C(=O)OC(C)(C)C)CC1	802985720	MTLNEOXKYSSQHW-UHFFFAOYSA-N	442.611	1.468	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2cnn(C)c2-c2ccccc2)c1	806776740	PDCRHOLPVRRSIV-UHFFFAOYSA-N	442.501	1.804	50	20	IDGD	
CCOC(=O)C(C)(C)c1csc(NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)n1	806977654	SXNQUCWGKGYFSX-CYBMUJFWSA-N	446.485	1.073	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C(=O)Nc2ccc3c(c2)C(=O)CC(C)(C)O3)nc2ccccc21	806993221	UMGFCVLZDOYCHS-UHFFFAOYSA-N	449.467	1.646	50	20	IDGD	
Cc1cccc(NC(=S)NNC(=O)CNS(=O)(=O)c2c[nH]c3ncccc23)c1C	810022591	SAPKOACIZXJZJX-UHFFFAOYSA-N	432.531	1.476	50	20	IDGD	
COC[C@]1(C(=O)NNC(=O)c2cncc(NC(C)=O)c2)CCN(C(=O)OC(C)(C)C)C1	810662534	DTFWXXVOTAJRGR-FQEVSTJZSA-N	435.481	1.075	50	20	IDGD	
O=C(COC(=O)[C@@H](O)c1ccc(Cl)cc1F)NNC(=O)[C@@H]1COc2ccccc2O1	811369521	JAKIKEMUCXHYHV-RDJZCZTQSA-N	438.795	1.043	50	20	IDGD	
COC(=O)N(C)NC(=O)[C@H](CCSC)NS(=O)(=O)c1ccc2ccccc2c1	811521136	DLYOOEXAYVOTTM-INIZCTEOSA-N	425.532	1.969	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)N[C@@H]2CCC[C@H]3CN(C(C)=O)C[C@@H]32)cc1	812433244	IWTYXCIJSZVQNV-MWHZBGGUSA-N	432.521	1.830	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NN=Cc1ncc(Cl)s1	814711004	VVTZBNKEYHAZTK-UHFFFAOYSA-N	442.950	1.900	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cnn(-c3ccccn3)c2N)cc1Br	815564187	AOIUWIRNLSQVMI-UHFFFAOYSA-N	431.250	1.695	50	20	IDGD	
Cc1cnc(S(C)(=O)=O)nc1C(=O)NNC(=O)c1sc(-c2ccccc2)nc1C	816827273	LMYDRWLJHQPEHW-UHFFFAOYSA-N	431.499	1.695	50	20	IDGD	
O=C(CNc1ccccc1)NNC(=O)C1CCN(S(=O)(=O)c2ccccc2F)CC1	823327674	ZAPBWXQWMVJTMU-UHFFFAOYSA-N	434.493	1.486	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1ccc(-n2cccn2)nc1	825831813	CKPKKURNPTYPMC-UHFFFAOYSA-N	429.820	1.547	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCNC(=O)[C@@H]1c1cccc(C)c1	848951374	SPXRKAHNHDLQMN-IBGZPJMESA-N	430.892	1.591	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2ccc3c(c2)C(=O)N(C)C3=O)ccc1OC(C)C	861649103	BSLDJTNEIXOQQQ-UHFFFAOYSA-N	447.469	1.332	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)[C@@H]2CCCN(C(=O)c3ccccc3OC(F)F)C2)n1	914876508	DWXCOWXIVMQENC-OAHLLOKOSA-N	449.458	1.801	50	20	IDGD	
COC(=O)Cc1cc(=O)n(-c2ccc(C(=O)NNC(=O)c3ccc4ccccc4n3)cc2)[nH]1	915190715	NBWLTATWRMAHQV-UHFFFAOYSA-N	445.435	1.504	50	20	IDGD	
O=Cc1cc(Br)ccc1OCC(=O)OCC(=O)NNC(=O)c1cccs1	915591665	PIVHPCABEFZEHZ-UHFFFAOYSA-N	441.259	1.706	50	20	IDGD	
CN1CCN([C@H](CNC(=O)NNC(=O)COc2ccc(F)cc2)c2cccs2)CC1	915902633	XSFBDZQOLWFOLZ-QGZVFWFLSA-N	435.525	1.585	50	20	IDGD	
O=C(CNC(=O)c1ccc(Br)s1)NNC(=O)c1cccc([N+](=O)[O-])c1	916721472	LMNLLGOKSYDEQN-UHFFFAOYSA-N	427.236	1.610	50	20	IDGD	
Cc1ccc(N2C(=O)C[C@@H](C(=O)NNC(=O)CN3CCCC3=O)[C@H]2c2cccs2)cc1	916758499	BISXQHWJSVYUHI-IERDGZPVSA-N	440.525	1.921	50	20	IDGD	
Cc1ccc(C(=O)CCC(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)s1	917235829	XMIZCUQEEGGNOA-MRXNPFEDSA-N	432.454	1.550	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2cc(F)ccc2[N+](=O)[O-])cc(OC)c1OC	917717514	JBFGIHWQUKBXJP-UHFFFAOYSA-N	429.382	1.383	50	20	IDGD	
Cc1cc(S(=O)(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)ccc1OC(C)C	917737026	BVYPIVODKRYNIZ-UHFFFAOYSA-N	426.516	1.809	50	20	IDGD	
COc1cc(-n2cnnn2)c(Cl)cc1C(=O)NNC(=O)C(=O)Nc1ccc(C)c(C)c1	918686790	JBECVYNYKMULRY-UHFFFAOYSA-N	443.851	1.341	50	20	IDGD	
O=C(NCC(F)(F)F)NNC(=O)C1CCN(S(=O)(=O)c2cccnc2Cl)CC1	918707019	BTARMMDFJGOWDY-UHFFFAOYSA-N	443.835	1.028	50	20	IDGD	
COc1ccccc1/C=C(\C(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1)c1ccccc1	919889346	LJPXGJYOYLOFAB-GFWHJHDHSA-N	429.498	1.753	50	20	IDGD	
CCCCNC(=O)NNC(=O)c1cc(I)ccc1-n1cnnn1	920822514	WJPCQIXSRMLUSS-UHFFFAOYSA-N	429.222	1.011	50	20	IDGD	
CO[C@@H](C)c1nc(CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)cs1	1116220230	HJQGVKGNRIFZQO-JTQLQIEISA-N	426.524	1.288	50	20	IDGD	
O=C(NNC(=O)c1ccc(Br)cc1)Nc1ccc(CN2C(=O)CNC2=O)cc1	1116585040	QEZZNXIDUJONFJ-UHFFFAOYSA-N	446.261	1.967	50	20	IDGD	
O=C(COC(=O)Cn1nc2n(c1=O)CCCCC2)NN=C(c1ccccc1)c1ccccc1	1248582527	GTIKCUKPXUFYDV-UHFFFAOYSA-N	447.495	1.883	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)[C@H]3CC34CCS(=O)(=O)CC4)n[nH]2)cc1OC	1324892351	HBQDOUVZJSGCPW-CYBMUJFWSA-N	448.501	1.070	50	20	IDGD	
O=C(Cn1cc(C2CC2)nn1)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1	1332944733	KETBTDDOMAMODI-JOCHJYFZSA-N	430.512	1.930	50	20	IDGD	
Cn1nc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)c2c1CCC2	1777963346	QKRIRCPCIUKMCZ-OALUTQOASA-N	429.348	1.589	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cccn4cncc34)C2)C1	1778680644	JENAACOLDXXAIN-IFXJQAMLSA-N	435.322	1.809	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cccn4cncc34)C2)C1	1778688841	QMNZFFQCJMOKRX-DNVCBOLYSA-N	435.322	1.951	50	20	IDGD	
C[C@H](C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CO[Si](C)(C)C)C2)N1C[C@H]2C[C@@H]2C1	1779249910	ILCLUICHKUIAFM-ACMVSEJYSA-N	437.657	1.692	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccn(C(F)F)n3)C2)C1	1779613638	JGNBLMFPWFSISU-BDJLRTHQSA-N	435.269	1.753	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnc4snnc4c3)C2)C1	1780071813	PLECVNSKRDLWRU-SJORKVTESA-N	444.344	1.766	50	20	IDGD	
CN1CCC(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](F)Br)C2)CC1	1780770478	PHOXSZCDCWLWFS-RVKKMQEKSA-N	434.350	1.533	50	20	IDGD	
O=C(O)CSCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Br)C1	1780777043	KXRKZMSCNHRYPB-RIEGTJTDSA-N	441.319	1.009	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)c3cnn4c3OCCC4)CCO2)C1	1781233775	DPLAOTTYJFWTQS-QZTJIDSGSA-N	431.320	1.345	50	20	IDGD	
O=C(c1ccc(O)c([N+](=O)[O-])c1)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781332924	KKUDPYFPXQCWPE-XJKSGUPXSA-N	446.229	1.434	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)Br)C1	1782002586	RTXSCXGQHIACBU-HNSFDTNUSA-N	449.342	1.845	50	20	IDGD	
O=C(c1ccc2nn[nH]c2c1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1782582379	BGFSQMAUCMQSEI-CZUORRHYSA-N	426.246	1.092	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C=C/c2cnccn2)C1	1782618880	QKSMNLPAIUZBMF-DPTMFGANSA-N	432.597	1.855	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@@]2(C1)CN(C(=O)c1cc[nH]n1)CCO2	1782861204	IEOXQOYPXCXCRX-ZVYZCIRASA-N	427.411	1.739	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](C)Nc1cnccn1)CCO2	1783349660	QOYYEZVSKUHDHC-DEYYWGMASA-N	440.342	1.280	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(OC)c(F)c3)[C@H]2C1	1783733385	SEOYRUAPZXMIAR-AFIMGQEJSA-N	428.888	1.681	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(C4CC4)on3)[C@H]2C1	1783760522	CZICFNVNKMERPV-LESCFKLSSA-N	426.311	1.929	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2	1783854529	OCZJXHDXPIAKQH-IDENBPMYSA-N	447.359	1.808	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3C[C@H]3C3CC3)[C@H]2C1	1783942439	QSZPYPRIDCAJDN-UFTKBXCMSA-N	441.532	1.146	50	20	IDGD	
Cc1nn(C)c(C)c1CC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](C)Br)CCO2	1784515365	SZORMDQMSZRVSH-KPZWWZAWSA-N	427.343	1.193	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@](C)(O)C(F)(F)F)[C@H]2C1	1784877513	PXBJDNQXIYRQBB-IAGXKZSMSA-N	445.276	1.453	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)cc1	1785106873	PIMAAJBJIQPVRH-QAPCUYQASA-N	442.285	1.779	50	20	IDGD	
CC[C@@H](NC)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C[C@@H]21	1786973544	VAEYLVHLJPCEAI-OXMINKDBSA-N	446.498	1.849	50	20	IDGD	
C=CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]2C1	1787443726	RSGAMPWDTLFTPT-QMHWVQJVSA-N	447.935	1.970	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ncn(C(C)C)n3)[C@H]2C1	1787672013	VQSYLJUIGQWAGX-XQLPTFJDSA-N	442.358	1.626	50	20	IDGD	
COCc1oncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]21	1787722503	KVORAUCRWSMDAI-DGBRYZOVSA-N	434.320	1.651	50	20	IDGD	
CSCC[C@H](O)C(=O)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1	1788143693	RMLYYRFSRYPPRB-IBGZPJMESA-N	442.346	1.228	50	20	IDGD	
CN1CCCC[C@H]1C(=O)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1	1788144959	HWCNQDKSWCRIKS-NRFANRHFSA-N	435.333	1.598	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](OC(C)=O)C(C)C)[C@H]2C1	1788479644	LOBZBBJEGXPGLJ-KSWRQPAISA-N	447.370	1.727	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)c1ccc([N+](=O)[O-])[nH]1	1789390527	HTDXVFYVQOUPNW-LKAMGYQZSA-N	433.234	1.207	50	20	IDGD	
Cc1cc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]3C2)nn1C	1789867532	FDARGOBFZWGIGJ-QBWPOKONSA-N	431.364	1.487	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnnc(Cl)c3)C[C@@H]21	1789869232	ZJLXEHPGQJIMKZ-HTWFXAOOSA-N	435.739	1.960	50	20	IDGD	
O=C(NC1(c2ccc(NC(=O)[C@H]3[C@H]4SC=C[C@H]43)cc2)CCC1)c1ccc(B(O)O)cc1	1791087013	JMKRLGNCTAUHSV-ZCNNSNEGSA-N	434.326	1.989	50	20	IDGD	
Cc1cnn([C@@H](C)C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCBr)C[C@@H]32)c1	1791593734	YOAVTENMPRTREO-VGWMRTNUSA-N	427.343	1.517	50	20	IDGD	
CCc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)CBr)n(C)n1	1792871367	WTGFWIVZXWIZRI-JFILPPLUSA-N	427.343	1.217	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CC[C@@H](C(=O)OC)C1	1792970383	BRMUKQHTBMAXHS-AYCBFJCHSA-N	445.354	1.339	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@](F)(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](O)CCl)C1	1793111833	YCTUMGOUFGHRNG-SGQRUEDASA-N	447.935	1.573	50	20	IDGD	
CNC(=O)CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](Br)Cc1ccccc1)C2	1793503287	LMPITEYVCKIVNR-YVSFHVDLSA-N	436.350	1.767	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1nc2ccccn2n1	1796102702	YYLXMVDCTTXPPU-AZGFTEDZSA-N	426.304	1.169	50	20	IDGD	
COc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Cl)cc([N+](=O)[O-])c1OC	1796366950	POEZYPDVDHPYNH-YHYOWMERSA-N	445.831	1.350	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2nc[nH]c2c1	1797407990	YJPHEPZCFOXAND-MBMVNNNZSA-N	435.322	1.797	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)c1cc2cc(F)ccc2s1	1797423686	JHQIBMDQAYBJPN-DMVWFOPNSA-N	426.897	1.843	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc(C(F)(F)F)cn1)C2	1797954865	MUCIZCIPPLDYBX-DRXBFXEBSA-N	446.502	1.550	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(=O)nc2sccn12	1798412407	WVDODWRIKIJJPC-OQMKEHIESA-N	438.937	1.367	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(Cl)cn1	1798749579	BFIOJSAJDYDCMR-BTTYYORXSA-N	428.880	1.299	50	20	IDGD	
COc1cccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@](C)(Cl)CCl)n1	1799273680	GAIZMIDKIGGMJV-OESLAJAZSA-N	430.332	1.459	50	20	IDGD	
COc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Br)c(C)c1	1799348338	FNKWNFWZECIKNC-NOXHYTERSA-N	429.286	1.897	50	20	IDGD	
COc1cc(OC)cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Br)c1	1799348556	KFRGOBHSKJNUGV-VZAMPYOESA-N	445.285	1.598	50	20	IDGD	
C[C@H](NC(=O)c1ccccn1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](F)Br	1800161873	QRNDEIFQSCLKJC-DKBOKBLXSA-N	441.301	1.529	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2snnc2C2CC2)[C@H]1c1cccnc1)[C@H](O)CCl	1803139233	MPGJZXNAOSUPIR-LZWOXQAQSA-N	435.937	1.730	50	20	IDGD	
Cc1cc2nnc(C(=O)N3CCC4(CCCN(C(=O)[C@@H](O)CCl)C4)CC3)c(C)n2n1	1805524557	SJTCQCGDOPMVFR-HNNXBMFYSA-N	434.928	1.186	50	20	IDGD	
O=C(CCBr)NC[C@H]1CCN(C(=O)Cc2cnccn2)[C@@H]1c1cccnc1	1806343039	RNPRHAPMBUAKMJ-DNVCBOLYSA-N	432.322	1.905	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)c3ccoc3Cl)CC2)C1	1809977568	GLKRBCGGERBOAL-UHFFFAOYSA-N	430.697	1.771	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)c3cccc(F)n3)CC2)C1	1809977655	MKOXVOHJAVXDPU-UHFFFAOYSA-N	425.269	1.059	50	20	IDGD	
CC(=O)Nc1ccccc1C(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1	1813884000	UFLSJUPZSHQYGC-PWIZWCRZSA-N	444.919	1.959	50	20	IDGD	
CC(=O)N[C@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](O)CCl)n[nH]1)C(C)(C)C	1814863988	FCSKXMKWLFHJLG-IJEWVQPXSA-N	427.933	1.552	50	20	IDGD	
Cc1ccc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)o1	1815350198	JUJFSEGTZLMVDL-CQSZACIVSA-N	425.275	1.264	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2nccnc2C(N)=O)n[nH]1	1820022822	XXDAUGOGQMUURP-GFCCVEGCSA-N	433.900	1.870	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCBr)[nH]n1	1822412728	GZFXFFRGWFRDTN-ZDUSSCGKSA-N	443.346	1.560	50	20	IDGD	
CN1CCCn2nc(C(=O)Nc3nc4c(s3)C[C@@H](NC(=O)[C@@H](F)Cl)CC4)cc2C1	1824381416	DQPQEHVHQFEBSG-ZUZCIYMTSA-N	440.932	1.935	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)C34CC(C(=O)OC)(C3)C4)sc2C1	1825559147	UXIVPWOAPYUSPT-QSMDCUAPSA-N	441.937	1.652	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CN1CCOC1=O)CC2	1825635629	IZYBCEDYVQNALF-BDAKNGLRSA-N	431.312	1.291	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)no1	1826049249	UBOORAKDSCSDAP-FQEVSTJZSA-N	425.294	1.210	50	20	IDGD	
Cc1nc[nH]c1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1	1827837786	XUAFANOYBGHMSQ-SFHVURJKSA-N	439.520	1.264	50	20	IDGD	
CNC(=S)NCCC(=O)N1CCCC[C@H]1C1CCN(C(=O)CO[Si](C)(C)C)CC1	1828929146	IHWICGMPSJDRJD-KRWDZBQOSA-N	442.702	1.942	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(OC)n(C)n2)CC1	1829847171	ZLTSMBUXWVCHSQ-NVXWUHKLSA-N	426.945	1.916	50	20	IDGD	
CN(C)c1ccncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830358733	RLTFPNUQGIOSQF-NRFANRHFSA-N	438.956	1.483	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)C[C@@H](N)c3cccnc3)C2)C1	1830358900	GIIILZIOJFGKRL-UTKZUKDTSA-N	438.956	1.193	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1830543764	CLDZDVWEMXHRKL-HZMBPMFUSA-N	432.142	1.278	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc(OCF)cn3)C2)C1	1831643994	MPAPEUHTIVJRCT-AUUYWEPGSA-N	444.891	1.260	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)CNC(C)=O)CCO2	1831687331	LRTKIMTZVHOPAL-JXFKEZNVSA-N	431.961	1.013	50	20	IDGD	
C[C@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)c3ccncn3)CC2)CC1	1833263821	UVJZIJDAFQURSL-CQSZACIVSA-N	438.370	1.693	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3ccc4[nH]ccc4n3)CC2)CC1)[C@H](O)CCl	1833309952	FPXQKHIKRHTQJO-LJQANCHMSA-N	433.940	1.348	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)CSCC(=O)OC)CC2)CC1	1833479549	GGBCFEZHHSTHBK-INIZCTEOSA-N	434.002	1.482	50	20	IDGD	
Cc1cnc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](C)CBr)C3)C2)s1	1833796674	LLYRJOXGTBHPJH-PXAZEXFGSA-N	446.367	1.553	50	20	IDGD	
Cc1cnc(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](C)Br)CC3)CC2)cn1	1834162511	BJBMLDJSGAVZBQ-CQSZACIVSA-N	438.370	1.754	50	20	IDGD	
Cc1nc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](C)CBr)C3)C2)co1	1834203789	NQZWQDKQYIVZRG-PXAZEXFGSA-N	430.299	1.084	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)Cc3ccccn3)CC2)CC1	1834891412	DGCVBHFEFCPZHO-OAHLLOKOSA-N	437.382	1.979	50	20	IDGD	
O=C(COc1ccccc1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1834954346	NVIKMIHFVCSIPK-WMZOPIPTSA-N	445.285	1.212	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)Cc3cnc4ccccn34)CC2)CC1)[C@@H](F)Cl	1835079195	NOHDCJHKZPGCRS-HXUWFJFHSA-N	435.931	1.983	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)c1cccc2c1OCC2	1835284740	UGFSSFAJBJVFOC-LJQANCHMSA-N	435.952	1.406	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3cnc(O)[nH]3)CC2)CC1	1835966575	ARTADESOMNELLW-NSHDSACASA-N	428.331	1.084	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@H](C)n3ccnc3)CC2)CC1	1836779966	JQSOSBNQGXAQGB-MAUKXSAKSA-N	426.945	1.697	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc4n(n3)CCC4)CCO2)C1	1837093749	BYDRGYKRHSOOFX-MOPGFXCFSA-N	445.347	1.136	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc4ncnn4c3)CCO2)C1	1837164640	LMYSNKNOXURTAE-JXFKEZNVSA-N	435.912	1.207	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CCC=CO1)CCO2	1837418623	IMFBDCPSQVZRBQ-DAYGRLMNSA-N	431.327	1.309	50	20	IDGD	
Cc1ccc(C(=O)N2CCC(OC3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)cn1	1837421575	KLNBCRKXAMNFQJ-UHFFFAOYSA-N	445.564	1.375	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cnn4ncccc34)CC2)CC1	1838058994	NVVBYTHXMWUSOH-SFHVURJKSA-N	449.939	1.595	50	20	IDGD	
CCc1ncsc1C(=O)N1CCO[C@@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1	1838837618	GDQPDOYEPNQTQW-LJQANCHMSA-N	441.626	1.627	50	20	IDGD	
C[C@@H](Oc1cccnc1)C(=O)N1CCOC[C@]2(CN(C(=O)C(Cl)Cl)CCO2)C1	1840190930	VXTJJPHLENKRBZ-FZKQIMNGSA-N	432.304	1.109	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)[C@@H](C)C2(O)CCC2)C1	1841048005	FHQJMEQJJNXDRE-CQSZACIVSA-N	445.472	1.888	50	20	IDGD	
COC(=O)N[C@@H](C(=O)N1CCCC12CN(C(=O)[C@@H](F)Br)C2)c1ccccc1	1841238855	DQBBUZSEGWAOCW-ZIAGYGMSSA-N	442.285	1.978	50	20	IDGD	
CS(=O)(=O)Cc1ncccc1C(=O)N1CCCC12CN(C(=O)[C@H](F)Br)C2	1842241151	PWBVHZRLISAEDU-ZDUSSCGKSA-N	448.314	1.134	50	20	IDGD	
O=C(c1ncc(Cl)cc1Cl)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843009727	BWQFURHMCUKKDN-UHFFFAOYSA-N	434.088	1.199	50	20	IDGD	
O=C(NCCC(=O)N1CC2(CCCN2C(=O)[C@H](F)Br)C1)c1ccccc1	1845220963	YCKCSUSHYOKYPG-HNNXBMFYSA-N	426.286	1.700	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC2(CCCN2C(=O)[C@H](C)NC(=O)c2ccccn2)C1	1845769090	RBUWZPVPXWTPKI-KGLIPLIRSA-N	437.338	1.434	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cccc(B(O)O)c1)c1ccc(Cl)cc1	1847408326	BZAKDKXFNPHMLS-GKCIPKSASA-N	426.709	1.639	50	20	IDGD	
COc1cc2ncn(CCCC(=O)NNC(=O)c3ccccc3F)c(=O)c2cc1OC	10750649	DVRSJJBQJNILGL-UHFFFAOYSA-N	428.420	1.794	50	20	IDGD	
CCn1ncc2c(C(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)cc(-c3ccccc3)nc21	12799437	UMBKMQYIUCGOIN-CQSZACIVSA-N	427.486	1.314	50	20	IDGD	
Cc1nc(C(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)nn1-c1ccc(F)cc1	16398100	LRTRMXUOVKELSC-UHFFFAOYSA-N	431.811	1.986	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)cc1	18095431	UCVJHUYVRFFNNC-UHFFFAOYSA-N	445.541	1.664	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)c1cc(-c2ccco2)n(-c2ccc(Cl)cc2)n1	25452953	PJWGJOKQDLZWNY-LBPRGKRZSA-N	448.888	1.981	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)CCNS(=O)(=O)c2ccc(C(C)(C)C)cc2)n1	27609360	NIHXARKALNSANE-UHFFFAOYSA-N	435.550	1.313	50	20	IDGD	
O=C(NNC(=O)[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)c1ccc(F)cc1F)C(=O)N1CCCC1	726160901	NGIDUCMFSFZHJU-VHSSKADRSA-N	448.470	1.508	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NC[C@@H](c1cccc(F)c1)N1CCOCC1	726247077	XPWXEGFYALTHQQ-INIZCTEOSA-N	449.508	1.021	50	20	IDGD	
CN1C[C@H](NC(=O)/C(C#N)=C\c2cn(CCC(N)=O)nc2-c2ccc(Cl)cc2)CC1=O	726538110	XGAWUPVWMIJQGT-XMCSSRMMSA-N	440.891	1.333	50	20	IDGD	
C[C@@H](C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1)S(=O)(=O)c1ccc(F)cc1	726863388	RXBJIDTZXZAPLF-LBPRGKRZSA-N	441.506	1.572	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)CN2C(=O)COc3ccc([N+](=O)[O-])cc32)cc1F	727497801	BETRRNVEROLIIU-UHFFFAOYSA-N	449.420	1.486	50	20	IDGD	
CN1CCN(C[C@H](NC(=O)NNC(=O)COc2ccc(F)cc2)c2ccccc2)CC1	727944956	HSOYFABCQRAIFE-FQEVSTJZSA-N	429.496	1.524	50	20	IDGD	
C[C@@H](Oc1ccccc1Cc1ccccc1)C(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1	728188825	PQRQSRYDLPKKEA-CRAIPNDOSA-N	431.514	1.562	50	20	IDGD	
C[C@@H](OCc1ccccc1)C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	728214173	MNCHTEMRUMUWAB-QGZVFWFLSA-N	432.546	1.671	50	20	IDGD	
Cc1oc(-c2ccco2)nc1CC(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	728340134	GZBOVSMUYGETFV-QGZVFWFLSA-N	441.396	1.316	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)c2cnc(-c3ccc4c(c3)OCO4)s2)c2ccccc2c1=O	728512377	RRNPNKXSBCVAJP-UHFFFAOYSA-N	449.448	1.861	50	20	IDGD	
COc1ccc(-n2cnnc2SCC(=O)NNC(=O)c2ccc(OC)c(OC)c2)cn1	728795040	SQVBQYFLWONGCY-UHFFFAOYSA-N	444.473	1.241	50	20	IDGD	
C[C@@H](CC(=O)NNC(=O)CNC(=O)c1cccs1)S(=O)(=O)c1ccc(F)cc1	729180508	CYFHNQGSADKYTJ-NSHDSACASA-N	427.479	1.017	50	20	IDGD	
COC(=O)NCCCC(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	730767755	LBQZKQPZBKCFPJ-UHFFFAOYSA-N	437.456	1.342	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)NC2CCN(CC(=O)N(C)C)CC2)c(C)n1C[C@H]1CCCO1	731655621	QZEXNFLPMNGKQR-VLOXRPPESA-N	441.576	1.860	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)CN3CCC(=O)NC3=O)c3ccccc3n2)cc1	731957374	YAKKVMPJUYXQKA-UHFFFAOYSA-N	431.452	1.913	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)c1cc(S(=O)(=O)NCCOC)ccc1C)c1ccccc1	732134150	NNIJUDSKSRTTNN-GOSISDBHSA-N	433.530	1.875	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)CNC(=O)c1cccc(Br)c1	732304099	ROHUSPVLNIQISA-UHFFFAOYSA-N	426.292	1.726	50	20	IDGD	
O=C(NNC(=O)c1ccc(COc2ccccc2)o1)N[C@H]1CCN(CC(F)(F)F)C1=O	732573427	QZXVKXBSDWJUCO-AWEZNQCLSA-N	440.378	1.966	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)N[C@H]1CCN(c2ccccc2F)C1=O	732892935	JUORAVBCUGISCM-HNNXBMFYSA-N	430.436	1.739	50	20	IDGD	
Cc1cccc(-n2c(NNC(=O)[C@@H](C)NS(C)(=O)=O)nc3ccccc3c2=O)c1C	733366044	YOLRHVNRPHRKAW-CQSZACIVSA-N	429.502	1.383	50	20	IDGD	
CN(C)C(=O)[C@@H]1CCC[C@@H](NC(=O)NNC(=O)COc2ccc(Br)cc2)C1	734221202	MBMOXUAWRUGQHY-TZMCWYRMSA-N	441.326	1.805	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)[C@H]1CC(=O)N(Cc2ccco2)C1	734251939	UJVYPBBELKCRFC-AWEZNQCLSA-N	434.518	1.848	50	20	IDGD	
O=C(NNc1nccnc1Cl)[C@H]1CCCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1	734261319	OIDXZDSLHMPSIH-NSHDSACASA-N	440.869	1.582	50	20	IDGD	
COc1ccc(CN2CC[C@@H](NC(=O)NNC(=O)COc3ccc(F)cc3)C2=O)cc1	734685894	XBNBABUBUFQUAS-GOSISDBHSA-N	430.436	1.345	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@@H](C(=O)NNC(=O)c3cnn(C)c3)C2)c2ccccc12	735446257	IODSJFMRTRJQME-OAHLLOKOSA-N	435.484	1.895	50	20	IDGD	
CCN(CC)S(=O)(=O)CC(=O)NNC(=O)[C@H](C)Oc1cccc(Br)c1	735840518	JFYWDLCAQUFFQW-NSHDSACASA-N	436.328	1.035	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)NC2CCN(C[C@H]3CCOC3)CC2)cc1OC	736392912	UKHIGSUKWLKJTF-MRXNPFEDSA-N	434.537	1.929	50	20	IDGD	
CN1CC[C@H](NC(=O)/C(C#N)=C\c2cn(CCC(N)=O)nc2-c2ccc(Cl)cc2)C1=O	737993280	GRKGIJBGSOQVMT-QXSWTLKVSA-N	440.891	1.333	50	20	IDGD	
C[C@H]1CN(CC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)CC[C@@H]1NC(=O)OC(C)(C)C	740881705	AYMXNLKOMRIWDQ-BBRMVZONSA-N	435.481	1.591	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)[C@@H]1CCCN(C(=O)COc2ccccc2)C1	741206390	CSDUXRWPHJRYBG-QGZVFWFLSA-N	441.484	1.539	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)c1ccnc(C(=O)NNC(=O)c2ccccc2C)c1	741447117	PEOOHPQINHSJTD-UHFFFAOYSA-N	431.452	1.848	50	20	IDGD	
COc1ccc(-c2nnc(SCC(=O)NNC(=O)C3CC3)n2C[C@H]2CCCO2)cc1	742449548	GOGGLIAMWQPRTO-MRXNPFEDSA-N	431.518	1.782	50	20	IDGD	
CC(C)c1nc(C(=O)NNC(=O)CCN2C[C@H](C)O[C@@H](C)C2)nn1-c1ccccc1F	743289363	SCIXBLXKXMWSIQ-GJZGRUSLSA-N	432.500	1.790	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)N[C@H]2CCN(Cc3ccccc3)C2=O)cc1	743576793	JBUMSQXYERMYIK-KRWDZBQOSA-N	445.501	1.227	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)N1CCc2c(cccc2N2CCOC2=O)C1	743577274	CZOLVVBAVHABPD-UHFFFAOYSA-N	443.485	1.234	50	20	IDGD	
O=C(NNC(=O)c1cccc(Br)c1)NC1CCN(C[C@H]2CCOC2)CC1	743620081	AHODSYUZYIMTAI-CYBMUJFWSA-N	425.327	1.894	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H]2CC[C@H](SC)C2)c1	745893771	GMOJFOWABGHLIO-GJZGRUSLSA-N	428.580	1.945	50	20	IDGD	
C[C@@](O)(Cc1ccccc1)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	746093321	PIWTWHUKHHRVAE-OAQYLSRUSA-N	431.514	1.226	50	20	IDGD	
CC1(C)C(C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)C1(C)C	746100074	BWYBOPVGEBTUOS-UHFFFAOYSA-N	437.562	1.470	50	20	IDGD	
COc1cc(C)nc(NNC(=O)c2cc(S(=O)(=O)NCc3ccco3)ccc2C)n1	746630689	LPGDPIQYMMMKSO-UHFFFAOYSA-N	431.474	1.930	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)[C@@H]1CS[C@@H](Cc2ccccc2F)C(=O)N1	746636759	FOTFTBPDISIYNV-IRXDYDNUSA-N	441.488	1.006	50	20	IDGD	
Cc1ccc(C)c(S(=O)(=O)NCCC(=O)NNC(=O)Cc2cn3ccccc3n2)c1	746641626	QODCMOAFCDXVMG-UHFFFAOYSA-N	429.502	1.010	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)C1CCN(S(=O)(=O)/C=C/c2ccccc2)CC1	747323725	LSPRCKOIHHVMBO-XNTDXEJSSA-N	428.514	1.484	50	20	IDGD	
O=C(CCC(=O)Nc1nnc(C2CC2)o1)NNc1ccc(S(=O)(=O)NC2CC2)cc1	747378421	KFYNKXUUHOHZQP-UHFFFAOYSA-N	434.478	1.250	50	20	IDGD	
CCN(C[C@H]1CCN(CC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)C1)CC(F)(F)F	747966215	FSIQYTCMIYOASZ-CYBMUJFWSA-N	431.415	1.562	50	20	IDGD	
CNS(=O)(=O)c1ccc(C(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)cc1	748520007	JDKWJHRGSUCZOL-UHFFFAOYSA-N	437.421	1.645	50	20	IDGD	
O=C(NNC(=O)c1sccc1S(=O)(=O)N1CCOCC1)c1cc2ccccc2o1	749467537	MWUIFUNJRDCYEV-UHFFFAOYSA-N	435.483	1.590	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(n2cc(C(=O)NNC(=O)c3ccc(C#N)cc3)nn2)CC1	751397816	YWMVTMQLJBJWDT-UHFFFAOYSA-N	439.476	1.797	50	20	IDGD	
O=C(NNc1nc(-c2ccncc2)no1)c1cc(Cn2cc(Br)cn2)on1	751833024	VXHKCXXLPBYWLQ-UHFFFAOYSA-N	431.210	1.884	50	20	IDGD	
CN1C(=O)N[C@@]2(CCC[C@@H]2CNC(=O)NNC(=O)Nc2ccc(OC(F)F)cc2)C1=O	752022628	HJTCACACMZDNCS-MLCYQJTMSA-N	440.407	1.344	50	20	IDGD	
C[C@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)c1ccc([N+](=O)[O-])cc1F	754848163	WQHDGFBWEYALOM-NSHDSACASA-N	438.437	1.549	50	20	IDGD	
CCCC[C@H](NC(=O)[C@H](C)NC(=O)C(C)(C)C)C(=O)NNC(=O)c1ccc(C#N)cc1	755252574	BYKSBVBRPCSKPZ-YOEHRIQHSA-N	429.521	1.545	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)Nc2nnc(Cc3ccccc3)s2)c2ccccc2c1=O	755408619	MKRHXBXRCLRRHP-UHFFFAOYSA-N	435.469	1.842	50	20	IDGD	
CCOc1ccc(NC(=O)NNC(=O)c2cccn2C)cc1S(=O)(=O)N1CCCC1	755469633	GVRSIUBGJKSKQN-UHFFFAOYSA-N	435.506	1.675	50	20	IDGD	
COc1cc(C=NNC(=O)CSc2nc(C)cc(C)n2)c([N+](=O)[O-])cc1OCC(=O)O	755490886	SHXJDHZDXKYTAL-UHFFFAOYSA-N	449.445	1.716	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)cc(C(F)(F)F)c1)N[C@H]1CCS(=O)(=O)C1	755646685	YHIPDTRMWWTMNT-JTQLQIEISA-N	444.229	1.599	50	20	IDGD	
CCc1c(C(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)cnn1CC(C)C	756002907	LERSCJAZQGLOQC-UHFFFAOYSA-N	440.592	1.989	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1cccc(CO[C@@H]2CCC[C@@H](C)C2)c1	756255685	AJEHAVIFNSOYPV-JKIFEVAISA-N	426.539	1.872	50	20	IDGD	
COc1ccc(C(=O)N2CCOCC2)cc1NC(=O)NNC(=O)COc1cccc(C)c1	756255814	CGTCNPQIJLMXKX-UHFFFAOYSA-N	442.472	1.708	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)Nc2cccc(OCCS(C)(=O)=O)c2)c1	756298381	WDAPWHJFGDGGHB-UHFFFAOYSA-N	435.502	1.959	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)Nc1cnn(-c2ccccn2)c1	756707045	SKDIHWQANVELCE-UHFFFAOYSA-N	434.504	1.632	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)Nc2cnn(CCN3CCOCC3)c2)c1C	756826491	GMBFVOHVALOPRJ-QGZVFWFLSA-N	430.509	1.452	50	20	IDGD	
CCOC(=O)C(C)(C)n1cc(NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cn1	757719660	BDCVTYNBTGUYOS-UHFFFAOYSA-N	437.478	1.051	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)[C@@H](Sc1cc(F)ccc1F)c1ccccc1	758029419	KSDIACOSBLAIAC-BZNIZROVSA-N	443.497	1.883	50	20	IDGD	
O=C(NNC(=O)c1nc(Cl)ccc1F)c1cccc(S(=O)(=O)N2CCCC2)c1	758044173	VFVJLZZANOSVEX-UHFFFAOYSA-N	426.857	1.733	50	20	IDGD	
CC(C)C(=O)Nc1ccc(C(=O)N2CCN(S(=O)(=O)CBr)CC2)cc1	758519064	WVCFDVVXIHWNCL-UHFFFAOYSA-N	432.340	1.721	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccc(Br)cc2)[nH]n1)C(=O)Nc1ccccn1	758839428	NETNCEGNNXQGPW-UHFFFAOYSA-N	429.234	1.634	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)NCCOc1cccc(C(F)(F)F)n1	759624564	BILDWBSCZSJYGX-UHFFFAOYSA-N	443.338	1.797	50	20	IDGD	
O=C(N=c1cc[nH]cc1I)NNC(=O)c1ccc(O)c(Cl)c1	760028123	DRQIKQJINZFLKS-UHFFFAOYSA-N	432.605	1.934	50	20	IDGD	
NC(=O)[C@H]1CC[C@H](CNC(=O)NNC(=O)c2ccc(COc3ccc(Cl)cc3)cc2)O1	760204224	PCDZNGUCPAYAEW-QZTJIDSGSA-N	446.891	1.896	50	20	IDGD	
Cc1ccnc(-n2nccc2NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c1	760292829	ZFHLNZYRODUPLC-UHFFFAOYSA-N	430.428	1.161	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)C(=O)Nc1cc(Br)ccc1F	763443268	ZIJSLERZWBVSMW-UHFFFAOYSA-N	425.170	1.896	50	20	IDGD	
C[C@@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)cn2)C[C@@H](C)O1	763468492	LHEDHANXQRNETB-CHWSQXEVSA-N	442.432	1.003	50	20	IDGD	
C=CCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2Br)cc1	763484347	XIHRGQHNICYGIO-UHFFFAOYSA-N	445.273	1.765	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(Cl)ccc2C(=O)N(C)C)cc1OC	763550777	RNOBIAXNLUVION-UHFFFAOYSA-N	448.863	1.459	50	20	IDGD	
CC(C)(C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)cc1	763552196	XQNHINXJOCLNPR-UHFFFAOYSA-N	426.429	1.343	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)C(=O)Nc1ccc(OCc2ccncc2)cc1	763559863	XLLGFBPLASTQDV-UHFFFAOYSA-N	434.408	1.789	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccccn2)cc1I	763561586	KJLTXRHIHSDVNT-UHFFFAOYSA-N	440.197	1.095	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)Nc1cccc(-c2noc(C3CC3)n2)c1	763570856	JESAPHSZVCZZGD-KRWDZBQOSA-N	449.423	1.540	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)nn1-c1cccc(F)c1	763572478	ROXQCXHHGHERNW-QGZVFWFLSA-N	439.403	1.246	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc2nn(C(C)C)cc2c1	763662215	GFQXUHMLRJQFBU-UHFFFAOYSA-N	425.445	1.791	50	20	IDGD	
CN1CCN(c2ccccc2NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCC3)CC1	763784265	DUYXAETXAIZQMH-UHFFFAOYSA-N	427.530	1.388	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccn(-c2ccccc2Cl)n1	763814970	YEKYPTIFBSDNNV-UHFFFAOYSA-N	438.831	1.562	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccnc(Sc2ccccn2)c1	763838174	PDDHDIOQJDUWSF-UHFFFAOYSA-N	441.444	1.932	50	20	IDGD	
CC(=O)Nc1cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)ccc1F	763838797	CCFJBJWZJWPQCE-CYBMUJFWSA-N	430.436	1.954	50	20	IDGD	
CCn1cnnc1-c1ccccc1NC(=O)C(=O)NNC(=O)Cc1c[nH]c2ccccc12	763865985	YTRZWVZMSNQJTC-UHFFFAOYSA-N	431.456	1.775	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cccc([S@](C)=O)c2)cc1	763872602	OWNPMOUHZVYKRY-FZPQWHJUSA-N	431.470	1.180	50	20	IDGD	
COC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(C(C)=O)cc2)cc1	763877107	HOKZLBPIUMOATF-ZDUSSCGKSA-N	442.428	1.621	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2cc(C(=O)Nc3ccccc3)ccc2C)n1	763880526	GUTBFZRDAGPNRG-UHFFFAOYSA-N	448.483	1.847	50	20	IDGD	
COCCOC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)Cc2ccc(F)cc2)c1	763921831	WMOSRMYNTQYJNJ-UHFFFAOYSA-N	432.408	1.349	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2ccccc2C)c(C(=O)N(C)C)cc1OC	763958189	RDMHESFMQIGLLK-UHFFFAOYSA-N	428.445	1.114	50	20	IDGD	
CCS(=O)(=O)c1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)c1ccc(C)cc1O	764109792	LBMPWWONZNWWLC-UHFFFAOYSA-N	439.877	1.547	50	20	IDGD	
C=CCN(CC=C)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(C#N)cc2)cc1	764181236	ADAHEHJSOYCXEP-UHFFFAOYSA-N	431.452	1.772	50	20	IDGD	
CCC(CC)NC(=O)[C@H]1CN(C(=O)C(=O)NNC(=O)CC2CCCC2)c2ccccc2O1	764185014	UQCFDEQXVRZHQC-LJQANCHMSA-N	444.532	1.813	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2cccc3ncccc23)cccc1N1CCOC1=O	764252585	IUQSRXQDSOPUOT-UHFFFAOYSA-N	433.424	1.900	50	20	IDGD	
CCC(=O)Nc1ccc(Cl)c(NC(=O)C(=O)NNC(=O)COc2ccccc2O)c1	764276927	FKFDBIMMPSWIQX-UHFFFAOYSA-N	434.836	1.559	50	20	IDGD	
Cc1ccccc1-n1ncc(C(=O)NNC(=O)CNC(=O)c2cccnc2)c1C(F)(F)F	764344981	MZPUYMAMBOTLBO-UHFFFAOYSA-N	446.389	1.786	50	20	IDGD	
COc1cccc([C@H](O)C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)c1	765175479	IYSPLNKWVWGPIU-NRFANRHFSA-N	446.935	1.347	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)c1cccc(S(=O)(=O)NC2CC2)c1	765319385	WVNVFLDTCZULKF-UHFFFAOYSA-N	440.522	1.193	50	20	IDGD	
O=C(CCC(=O)N1CCN(c2ccccn2)CC1)NNC(=O)c1cnn(-c2ccccc2)c1	765535548	PCSGXCQLIDZJBT-UHFFFAOYSA-N	447.499	1.157	50	20	IDGD	
O=C(Cc1noc2ccccc12)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	765751518	MKZBGQIAFZLXSY-UHFFFAOYSA-N	441.919	1.989	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)[C@@H](NC(=O)C(F)(F)F)C(C)C)c2ccccc2c1=O	766003976	VMVQTPRWHWOIRV-ZDUSSCGKSA-N	441.410	1.271	50	20	IDGD	
COc1ccc(CNC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)c(C)c1	767136615	DWZGVAUXZYIXGA-UHFFFAOYSA-N	434.518	1.463	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2cnc(-c3ccccc3)nc2C)n1	767636535	KISBGNUNVMHVEZ-UHFFFAOYSA-N	425.470	1.764	50	20	IDGD	
CCn1c(SCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)nnc1-c1cnccn1	768413886	JQGIVLBYRHBYTB-UHFFFAOYSA-N	428.434	1.217	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)c1nc2ncc(Br)cn2n1	768644834	HSJSNUXIPUOMNS-UHFFFAOYSA-N	441.267	1.056	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)NC2CCN([C@@H]3CCCC[C@@H]3O)CC2)nc2ccccc21	769158970	CHZAMNNJMDNSBM-MOPGFXCFSA-N	428.537	1.214	50	20	IDGD	
COc1ccc(C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)cc1C1CC1	769999835	IRXZMKKINXIWNX-UHFFFAOYSA-N	445.545	1.661	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)c1ccc2c(c1N)C(=O)c1ccccc1C2=O	771882160	MSHKVFZRNBZSQS-LBPRGKRZSA-N	437.452	1.783	50	20	IDGD	
NC(=O)c1cc(OC2CCN(C(=O)NNC(=O)c3cccc(OC(F)F)c3)CC2)ccn1	771958159	ANSQIVCEOBJKIG-UHFFFAOYSA-N	449.414	1.680	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)[C@@H]1CC(=O)N(c2cccc(Br)c2)C1	771984178	FKCIXUUJAWUSOV-WDEREUQCSA-N	426.267	1.291	50	20	IDGD	
COc1ncc(/C=C\C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)cn1	773763258	OLGLLBRJHBLDDT-HJWRWDBZSA-N	445.501	1.134	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)ccc1C	774010257	XCGWRRLBLZHWTH-LBPRGKRZSA-N	433.848	1.988	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)N1CCCN(c2nc3ccc([N+](=O)[O-])cc3[nH]2)CC1	775673134	MULFOLKKKGSCKL-CQSZACIVSA-N	431.497	1.565	50	20	IDGD	
COc1ccc(C(C)=O)cc1CC(=O)N1CCN(S(=O)(=O)CBr)CC1	777777933	UDQBQYULEVNBHZ-UHFFFAOYSA-N	433.324	1.267	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)c1	778592473	KZYQFRDCENOXPY-UHFFFAOYSA-N	429.357	1.675	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@@H](C(=O)NNc2nc(-c3ccccc3)no2)[C@H](C)O)cc1	779514059	JTFAPZIVNDTIEE-XJKSGUPXSA-N	431.474	1.216	50	20	IDGD	
COC(=O)c1ccccc1NNC(=O)Cc1ccc(S(=O)(=O)N2CCOCC2)s1	779546459	YCOVFWRCGJEDIF-UHFFFAOYSA-N	439.515	1.241	50	20	IDGD	
COc1ccc(C[C@@H](C)C(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)cc1OC	781357474	PQCSMIUPURHCEB-CYBMUJFWSA-N	433.892	2.000	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNS(=O)(=O)c3cccc(C)c3F)CC2)cc1	781561356	NWEAGYALWQQFMD-UHFFFAOYSA-N	434.537	1.570	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2ccc(NC(=O)CN3CCCCCC3)cc2)nc1	782142126	QPWCJDISLXOEFA-UHFFFAOYSA-N	440.504	1.987	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)cc1	782895898	HDUBGZQSURSBPJ-UHFFFAOYSA-N	433.490	1.087	50	20	IDGD	
O=C(NNC(=O)C(=O)NC1CC1)C(=O)Nc1ccc(Sc2ccccc2Cl)cc1	782965546	GCZJIWRYVYPURT-UHFFFAOYSA-N	432.889	1.856	50	20	IDGD	
Cn1c(=NNC(=O)C(=O)Nc2cccc(OCCS(C)(=O)=O)c2)sc2ccccc21	783351573	JLXCMSZTBJWHAJ-UHFFFAOYSA-N	448.526	1.234	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)CCS(=O)(=O)C1	783428659	YAKHNLOIEWIBKY-NQIIRXRSSA-N	426.498	1.479	50	20	IDGD	
Cn1cc(C(=O)NS(=O)(=O)c2ccc(S(F)(F)(F)(F)F)cc2)c(=O)n(C)c1=O	783463362	RTVZMLRVOJLSPN-UHFFFAOYSA-N	449.379	1.860	50	20	IDGD	
CC(C)(C)C(=O)N=c1cc[nH]cc1C=NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	783813420	KUHIFAQVJDSSJP-UHFFFAOYSA-N	437.909	1.553	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2cc(C)ncn2)cc1S(=O)(=O)N1CCCCC1	783948917	WAXDKOBZTJFPSL-UHFFFAOYSA-N	448.505	1.050	50	20	IDGD	
O=C(NNC(=O)C(=O)N1CCCC1)C(=O)Nc1cccc(Cl)c1SCC(F)F	783998588	DCYAWRUKJQNLOL-UHFFFAOYSA-N	434.852	1.406	50	20	IDGD	
CCS(=O)(=O)CCn1cc(C)c(NC(=O)NNC(=O)c2cccc(OC(F)F)c2)n1	786733301	OXYIVVXYHDKTJL-UHFFFAOYSA-N	445.448	1.694	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)[C@H]1CC(=O)N(c2ccccc2Br)C1	788177754	JAFMULKGJRNLNW-LBPRGKRZSA-N	442.277	1.921	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNS(=O)(=O)c1ccc(Cl)c(F)c1Cl	788748378	RFHRIZVWUVHGDQ-UHFFFAOYSA-N	426.278	1.934	50	20	IDGD	
CCOC[C@H](NC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)C(C)C	788869472	GTGWSVROROJPQH-KRWDZBQOSA-N	426.539	1.476	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNS(=O)(=O)c1cc(Cl)ccc1F	790046098	WCBXEWLJWJMUIO-UHFFFAOYSA-N	434.902	1.704	50	20	IDGD	
CC(=O)N1CCc2ccc(S(=O)(=O)NNC(=O)c3ccc(Cl)cc3O)cc2CC1	790054427	NOOQGZOPUNDHKH-UHFFFAOYSA-N	437.905	1.616	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(=O)n(CC(=O)NNc2cccc(F)c2[N+](=O)[O-])c1	790587956	LWEGSDCXPUBIOD-UHFFFAOYSA-N	441.441	1.069	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)NCc1nc(-c2cccc(Br)c2)no1	790898006	RBMDYZUIKWLUAM-JTQLQIEISA-N	442.270	1.381	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C[C@H](C)NS(=O)(=O)c1cccnc1Cl	792797285	AEJJAMVYGFOQDR-LBPRGKRZSA-N	440.909	1.191	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C[C@H]2COCCN2C(=O)OC(C)(C)C)nc2ccccc21	794765599	BBNSYJZBATXXSB-AWEZNQCLSA-N	431.493	1.289	50	20	IDGD	
CN(C(=O)OC(C)(C)C)[C@@H](C(=O)NNC(=O)Cn1cnc2ccccc21)c1cnn(C)c1	794766388	GLUYQLHLAPIFTG-GOSISDBHSA-N	441.492	1.525	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)CN[C@H](CO)c2ccc(Br)c(F)c2)cc1	795350370	RJYOHNIXCKBTEB-MRXNPFEDSA-N	435.253	1.544	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)cc1OC	797357555	PKQWERGFFALUHF-YJBOKZPZSA-N	441.440	1.140	50	20	IDGD	
CC(C)Oc1ccc(NC(=O)C(=O)NNC(=O)CNC(=O)OCc2ccccc2)cc1	797369123	ONQSUKHLPZWGCR-UHFFFAOYSA-N	428.445	1.486	50	20	IDGD	
Cc1ccc(N2CCOCC2)cc1NC(=O)C(=O)NNC(=O)c1ccc(Cl)cc1O	797535303	LUTAUMDSPXIESL-UHFFFAOYSA-N	432.864	1.590	50	20	IDGD	
CN(CCO)S(=O)(=O)c1ccc(C(=O)NNc2ccc(C#N)c(C(F)(F)F)c2)cc1	798335079	DQQMVSVJWHWBRA-UHFFFAOYSA-N	442.419	1.947	50	20	IDGD	
COc1cncc(S(=O)(=O)NNC(=O)c2nc(Cl)c(Cl)c(N)c2Cl)c1	799119538	CFVJYTHBLBZSPW-UHFFFAOYSA-N	426.669	1.651	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C1CCN(C(=O)[C@@H](C)CSC)CC1	799721349	CGEJMNLUXUFFOO-ZDUSSCGKSA-N	443.591	1.780	50	20	IDGD	
NS(=O)(=O)Cc1cccc(CNC(=O)NNC(=O)Cc2cccc3ccccc23)c1	800718198	CROANCBPQMZETR-UHFFFAOYSA-N	426.498	1.701	50	20	IDGD	
CCS(=O)(=O)N1CCC[C@H](C(=O)NNC(=O)Nc2cc(Cl)c(OC)cc2OC)C1	802075924	QTVJZZNSJUISJB-NSHDSACASA-N	448.929	1.572	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)c2ccc(F)c(S(N)(=O)=O)c2)c(OC)cc1Cl	802079909	GNJFJHYCZSUTPH-UHFFFAOYSA-N	446.844	1.610	50	20	IDGD	
CCOC(=O)C1(S(C)(=O)=O)CCN(C(=O)/C(C#N)=C/c2cc(C#N)n(C)c2C)CC1	804717799	XQXVRTUKVUFQCF-MHWRWJLKSA-N	432.502	1.081	50	20	IDGD	
O=C1COC[C@@H](C[C@@H]2CN(C(=O)C(=O)NNc3ncccc3Cl)c3ccccc32)N1	806967353	DPCXJDRDTYANQJ-CHWSQXEVSA-N	429.864	1.214	50	20	IDGD	
CCN(C)C(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c1	806980583	ZZTLQIOZRVSFRH-UHFFFAOYSA-N	434.456	1.364	50	20	IDGD	
Cc1cccn(Cc2c(F)cccc2NC(=O)C(=O)NNc2ncncc2Cl)c1=O	806992835	XZRVNUQLYTYNRM-UHFFFAOYSA-N	430.827	1.869	50	20	IDGD	
O=C(NNc1ccc2c(=O)[nH]ccc2c1)C(=O)Nc1ccc(F)c(N2CCCNC2=O)c1	807080104	NUUSCARHWJJFKF-UHFFFAOYSA-N	438.419	1.669	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NN=Cc2cn(-c3ccccc3C)nn2)cc1	807948991	BEKRDKUIGSZSNS-UHFFFAOYSA-N	426.502	1.655	50	20	IDGD	
O=C(CCc1ccccc1)NNC(=O)CNS(=O)(=O)c1ccc(Br)cc1	810283904	FROPEDFXBCKYER-UHFFFAOYSA-N	440.319	1.508	50	20	IDGD	
COC(=O)c1c(F)ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)c1F	810386057	KLJQQTZXBOORLQ-VIFPVBQESA-N	439.346	1.444	50	20	IDGD	
CCCn1nc(C(=O)NN=C(C)c2ccc3[nH]c(=O)c(=O)[nH]c3c2)c2ccccc2c1=O	811633613	URQCRJWBHWPWQH-UHFFFAOYSA-N	432.440	1.490	50	20	IDGD	
C[C@@H]1CCCN(c2cc(C(=O)N3CCN(S(=O)(=O)CBr)CC3)ccn2)C1	812545280	ZHDDWVSHYZCTMI-CQSZACIVSA-N	445.383	1.758	50	20	IDGD	
N#CCCn1cc(C=NNC(=O)Nc2ccc(S(N)(=O)=O)cc2)c(-c2ccncc2)n1	814967945	HHHYCKHZUPBTGY-UHFFFAOYSA-N	438.473	1.662	50	20	IDGD	
CC(C)(C)c1csc(NC(=O)C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c1C#N	815567337	UUCNXOWYJRXFDC-UHFFFAOYSA-N	438.473	1.293	50	20	IDGD	
O=C(NN=c1cc[nH]cc1)C(=O)Nc1ccc([N+](=O)[O-])c(I)c1	815589217	LQFPLFPDXNGRRO-UHFFFAOYSA-N	427.158	1.098	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)c2c(I)cnn2C)cc1	816772134	OJZBSFSMORQLPB-UHFFFAOYSA-N	428.230	1.427	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C1CCN(C(=O)c2cccnc2)CC1	817055104	MFWJYNAGEPGAEF-UHFFFAOYSA-N	431.518	1.327	50	20	IDGD	
CCn1c(NNC(=O)CCC(=O)N2CC(=O)Nc3ccccc32)nc2ccccc2c1=O	823899752	SBSIJDVUYAPLDJ-UHFFFAOYSA-N	434.456	1.625	50	20	IDGD	
O=C(COC(=O)c1ccc(C(F)(F)F)cn1)NNC(=O)[C@H]1COc2ccccc2O1	844261419	QZIPKQMUJFBWDI-CQSZACIVSA-N	425.319	1.245	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)[C@H]1CC(=O)N(Cc2ccccc2Cl)C1	849366623	QJTJHDJQTUNPOJ-HNNXBMFYSA-N	430.892	1.957	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)[C@@H](C)Oc2ccc3c(c2)CCC3)cc1OC	915482384	XUJGXXUPFIDANS-CQSZACIVSA-N	442.468	1.964	50	20	IDGD	
COc1ccc2c(ccn2CC(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)c1	915594733	WIHNPCOSMCRULZ-UHFFFAOYSA-N	436.877	1.412	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)CNS(=O)(=O)c1ccc(C)c(C)c1	915776474	WZRJWZACPGHYAF-UHFFFAOYSA-N	443.529	1.341	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCCCN2CCCCCC2=O)nc1	915905363	BLYWKTROLQODQD-UHFFFAOYSA-N	440.570	1.531	50	20	IDGD	
CC(=NNC(=O)c1ccc2ccccc2n1)c1ccc(S(=O)(=O)NCC(=O)O)cc1	916243930	CJTZMUWEUUROJG-UHFFFAOYSA-N	426.454	1.752	50	20	IDGD	
Cc1nc2ccnn2c(C)c1CCC(=O)NNC(=O)c1csc(N2CCOCC2)n1	916734422	FZIJGNXKCLUTBS-UHFFFAOYSA-N	429.506	1.033	50	20	IDGD	
CC(C)N1C(=O)c2ccc(C(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)cc2S1(=O)=O	916746231	DQPDFWIBHKFOSD-UHFFFAOYSA-N	432.414	1.223	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CN2C(=O)N[C@]3(C[C@@H](C)CC(C)(C)C3)C2=O)cc1	916830519	DKFHADUYJYKYJD-FPTDNZKUSA-N	443.504	1.218	50	20	IDGD	
CSC[C@H](C(=O)NNC(=O)c1c[nH]c2ccccc12)N1C(=O)[C@@H]2CCCC[C@H]2C1=O	917359050	UIVDIWMAKGPYCW-CKEIUWERSA-N	428.514	1.836	50	20	IDGD	
CCN1C(=O)C(=CNNC(=O)c2ccc(F)cc2Br)C(=O)N(CC)C1=S	917603761	PHPYSFMUOKOZFN-UHFFFAOYSA-N	443.298	1.702	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)C(=O)NC1CC1)c1ccc(NC(=O)c2ccc(F)cc2)cc1	918125281	NDYSEDIUVHBKRN-LBPRGKRZSA-N	427.436	1.748	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1O)c1ccc(S(=O)(=O)N=c2cc[nH]cc2)cc1	918358835	AHDAHHTURMVPML-UHFFFAOYSA-N	446.872	1.738	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1ccc(Cn2cccn2)o1	919111108	OVHGLOQOPYJROX-UHFFFAOYSA-N	432.820	1.804	50	20	IDGD	
CNS(=O)(=O)c1ccc([C@H](C)NC(=O)NNC(=O)COc2ccc(C)c(C)c2)cc1	919778461	BZGWGBZMXAKYPT-HNNXBMFYSA-N	434.518	1.682	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCCNC(=O)c2ccc(F)cc2)ccc1OC(C)C	919916455	LVQCKBBFEPIGCC-UHFFFAOYSA-N	432.452	1.996	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2ccc(C(F)(F)F)n2)cc1)N[C@@H]1CCS(=O)(=O)C1	919995227	WHBRYAAGRHRSEX-LLVKDONJSA-N	431.396	1.022	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)[C@H](Cc2ccc(F)cc2)n2nnnc2C)cc1	920012538	UBHNSTFXXQGLFA-IBGZPJMESA-N	426.452	1.693	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1cc(C(=O)NNC(=O)NCC2CC2)ccc1Br	920858973	GNZUMJUEZLCLGQ-UHFFFAOYSA-N	447.355	1.880	50	20	IDGD	
COc1cc(C=NNC(=O)Cn2nnc(-c3ccccc3)n2)c(Br)cc1O	921252031	XNMMAGXWAROUAK-UHFFFAOYSA-N	431.250	1.967	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)NCc1ccccc1N1CCN(C)CC1	1318262248	LEJQIIXJOVRQAT-UHFFFAOYSA-N	427.505	1.356	50	20	IDGD	
CS(=O)(=O)Nc1ccccc1CC(=O)NNc1c(F)cc(C(=O)NC2CC2)cc1F	1319387516	XUIHIINSUCNRKQ-UHFFFAOYSA-N	438.456	1.914	50	20	IDGD	
Cc1nc2ccccc2c(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1C	1321044259	YHLBKDIUEYRFHV-IBGZPJMESA-N	435.436	1.996	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc2c(c1)nc(CCC(=O)NNc1ccn(C)n1)n2C	1321105495	QISDSXRTTIHNRE-UHFFFAOYSA-N	433.538	1.413	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)c2cncnc2C)c1	1321707999	HKWOBHVHLBBFMW-UHFFFAOYSA-N	441.469	1.669	50	20	IDGD	
Nc1cnnc(NNC(=O)[C@@H]2CCN(c3ccccc3Br)C2=O)c1Cl	1322679280	IGROSWPWMVJXOM-QMMMGPOBSA-N	425.674	1.971	50	20	IDGD	
COc1cccc2c1OC[C@H](NC(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1)C2	1328685114	GBMGUGMZYLIFCU-MRXNPFEDSA-N	448.520	1.976	50	20	IDGD	
O=C(CNC(=O)c1cc(Cl)ccn1)NNC(=O)Cc1nc(-c2ccccc2)cs1	1337105607	UUOCACXPMPEXMR-UHFFFAOYSA-N	429.889	1.978	50	20	IDGD	
CCn1cc(-c2nn(C)cc2C(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)cn1	1338421770	JDEDBGPHJYAJGM-UHFFFAOYSA-N	445.524	1.712	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3nn(C)c4c3CCC4)C2)C1	1777959798	ZDOPYQLAFOYOJR-DJJJIMSYSA-N	439.354	1.383	50	20	IDGD	
O=C([C@@H](O)CCl)N1CCO[C@@]2(CCN(C(=O)C3(c4cccc(Cl)c4)CC3)C2)C1	1778066765	DAHGVUMBHXNLIV-LPHOPBHVSA-N	427.328	1.801	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2)c1ccnn1-c1ccccc1	1778395787	ORMDJRJWGUMKIZ-NNMXDRDESA-N	446.935	1.600	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@H](C(=O)N2CCO[C@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)C1	1779301793	VPQZLTKWTHMZHR-FVJLSDCUSA-N	440.613	1.647	50	20	IDGD	
CCC(C)(C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1	1779374176	HYSVPAYHMGTGLI-VGOFRKELSA-N	431.537	1.249	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnc3[nH]ncc3c1)C2	1779543789	ALYHXCGENJGRSV-DYESRHJHSA-N	445.596	1.937	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(-c4ccccn4)[nH]n3)C2)C1	1779632266	YOMSJYWTQWTFIO-JLTOFOAXSA-N	433.896	1.169	50	20	IDGD	
Cn1cccc1C(=O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@](C)(Cl)CCl)C1	1780715673	ULPBMWBLFFSBEP-CDHQVMDDSA-N	444.359	1.958	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnc(Cl)nc1)C2)[C@H](F)Br	1780770105	BTULTGYVYOEQTM-BFQNTYOBSA-N	449.708	1.948	50	20	IDGD	
O=C(Cc1cc2cccnc2cc1F)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1781176936	DHCPPSUPYOXCBQ-RXVVDRJESA-N	435.883	1.346	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(OC)c(OC)c3O)CCO2)C1	1781216260	BYRIHHFDHOIMKM-VLIAUNLRSA-N	426.897	1.870	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)Cc3ccc(C)c([N+](=O)[O-])c3)C2)C1	1781306055	ACZPKMIPGZRTJO-JXFKEZNVSA-N	439.896	1.529	50	20	IDGD	
O=C(c1cnc2ccccn12)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781330459	XOUGSYKGGHPVJT-PBHICJAKSA-N	425.258	1.468	50	20	IDGD	
O=C(c1cccn2ccnc12)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781331807	QGUZQZZDMLZVOV-CXAGYDPISA-N	425.258	1.468	50	20	IDGD	
Cc1cc(C)n(CCC(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)n1	1781333115	CSJLMOUHZRUBEB-NVXWUHKLSA-N	431.306	1.410	50	20	IDGD	
CCC[C@H](NC(C)=O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](Cl)COC)C1	1782177705	ABGANNVRCUZQKW-MIALQEHNSA-N	431.961	1.059	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3n[nH]c4ccc(C#N)cc34)C2)C1	1782197807	DHWJDLJMHWLKQU-MGPUTAFESA-N	431.880	1.132	50	20	IDGD	
O=C(c1cnn2cccc(F)c12)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1782554240	UMHRNDZBGXCUIO-PBHICJAKSA-N	443.248	1.607	50	20	IDGD	
CC(=O)N[C@@H](C)C(=O)N1CC[C@@]2(CN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)CCO2)C1	1783180585	BKXFQSHTVIZQNK-RABVXATESA-N	446.454	1.226	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)C#CC3(O)CCCCC3)CCO2)C1	1783349645	QBADVMNWOOACEJ-OXJNMPFZSA-N	441.366	1.688	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc4c(c3C)OCCO4)CCO2)C1	1783874987	JJYFVHYUUYNOOI-KKSFZXQISA-N	438.908	1.464	50	20	IDGD	
Cn1ncc(C(=O)N2CCO[C@]3(CCN(C(=O)C(Cl)Cl)C3)C2)c1C(F)(F)F	1783942934	CXADGRKSYOYSNM-AWEZNQCLSA-N	429.226	1.686	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CCCCN3C)C[C@@H]21	1783964517	WNXPBVDLJVTEBE-WOYTXXSLSA-N	430.387	1.481	50	20	IDGD	
O=C(c1ccc(F)cc1C(F)(F)F)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1785203234	LMOXMUBWEYYSET-PBHICJAKSA-N	438.805	1.888	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3c[nH]c4cnccc34)C[C@@H]21	1786407355	YSIGHCVSXFBBKD-NUTKFTJISA-N	435.322	1.941	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(C)(C)NCCC#N)[C@H]2C1	1786859782	GZAGDVKTTLCNAE-AJNGGQMLSA-N	429.359	1.031	50	20	IDGD	
CCc1[nH]nc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](Cl)COC)C[C@@H]32)c1Cl	1787133386	OEMJHSMJLGXAQI-FMSGJZPZSA-N	433.336	1.473	50	20	IDGD	
O=C(CC[C@H]1CCOC1)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1	1788145083	DYYLMBFRUVQFRN-KRWDZBQOSA-N	436.317	1.931	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)c1cc2ncccn2n1	1788301214	IDIGFODEISBZEL-YDHLFZDLSA-N	436.310	1.108	50	20	IDGD	
CC(C)c1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Br)C[C@@H]32)n[nH]1	1789323625	JIIYGGDZVSASGU-GVARAGBVSA-N	431.306	1.817	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)c1cccc(-c2cnco2)c1	1790147034	TZWFUHOVFMLJME-DWRORGKVSA-N	433.892	1.535	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3cn[nH]c3)C[C@@H]21	1790961831	UZYFIIWZDZLTLM-VGWMRTNUSA-N	427.343	1.496	50	20	IDGD	
CCOC(CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](Br)CC)C[C@@H]21)OCC	1791421039	XYQSLIPDAFVIOQ-JONQDZQNSA-N	449.386	1.929	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC1(c2ccc(NC(=O)CN3C(=O)C=CC3=O)cc2)CCC1	1791695756	AMITYUKPGPRFQT-UHFFFAOYSA-N	429.549	1.897	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1[nH]nc3ncccc13)C2	1792868081	OODYHWUXRYIQND-NRWUCQMLSA-N	436.310	1.192	50	20	IDGD	
Cc1nn(C)c(C)c1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)CBr	1792868425	AEFAFRKOEXNTIZ-BWPSIRRCSA-N	427.343	1.271	50	20	IDGD	
Cc1cc(C)n(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)CBr)n1	1792869947	FCQYHPWNZSFZPH-RMIITELYSA-N	427.343	1.121	50	20	IDGD	
COc1cccnc1CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2	1794030412	RKMLQFIJYSRELL-HBCWATKFSA-N	440.338	1.397	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ncc(C)s1	1794889141	BOMFVEQVYOJEPC-NGYDUSEUSA-N	428.518	1.837	50	20	IDGD	
Cc1ccccc1OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)CBr)C2	1795302518	CPTRDTZZJRJCJV-GGXPGOJBSA-N	439.350	1.994	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1nccc2nc[nH]c12	1796236246	MKUYQRVWGSTHFH-FMSGJZPZSA-N	436.310	1.192	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc3nonc3c1)C2	1796892533	MYUNSMDWOIPIDP-XMOXNHLCSA-N	449.471	1.609	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cn2ncccc2n1	1797040667	BXEZPCLBLNOLDA-ABXQLRGKSA-N	426.304	1.169	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)[C@@H]1C[C@@H]1c1ccc(Cl)cc1	1797189785	UZFLAJASROEGCZ-YFXBATGZSA-N	427.328	1.633	50	20	IDGD	
CC(C)Cc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CO[Si](C)(C)C)n(C)n1	1797954720	BRBIFKMBMVMYOM-CWPLJXCYSA-N	436.629	1.673	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1C[C@@]13C(=O)Nc1ccccc13)C2	1799269758	FABVMPSXWMICKI-CEGHFVKMSA-N	431.920	1.503	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c[nH]c3nccc-3c1)C2	1799275426	RMGMUCOPFSUOJE-NXEZDXNNSA-N	425.316	1.954	50	20	IDGD	
CN(C)c1cccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Br)c1	1799349058	UVTXUGADMFKZKH-OCVGTWLNSA-N	428.302	1.646	50	20	IDGD	
CN(C)c1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)cc1	1799683926	FUTQFKCFMYWXCA-VBUUOAMHSA-N	436.516	1.317	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1onc2ccccc12	1799984026	FERAIUJWNXBHNM-YJKIEOBBSA-N	426.242	1.722	50	20	IDGD	
Cc1cn(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@](C)(Cl)CCl)c(=O)nc1O	1800085144	SZLXHOVFXIOVHG-SJBDTSRBSA-N	431.320	1.132	50	20	IDGD	
CC(C)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1CCC2(CC1)OCCO2	1800379183	FBUKGXSKDUTXFJ-BJWYYQGGSA-N	428.957	1.774	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)Br	1800754960	YYWFQKUINPKTHU-PZWNZHSQSA-N	426.149	1.390	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1)c1cc(O)ncn1	1803739404	VWODJMLSOGVPDB-DYVFJYSZSA-N	434.294	1.682	50	20	IDGD	
O=C(Cn1cncn1)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@H]1c1cccnc1	1807602736	HNEDZBXEYMCNMU-AEGPPILISA-N	425.262	1.070	50	20	IDGD	
Cc1nc(C(=O)N2CCCC3(CCN(C(=O)c4ccc(B(O)O)cc4)CC3)C2)cs1	1808690660	YRADYZDGULDJJM-UHFFFAOYSA-N	427.335	1.290	50	20	IDGD	
O=C(Cc1cccs1)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1	1809967083	SECIDXMPVIPHIL-UHFFFAOYSA-N	426.347	1.515	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)c3cnc(Cl)s3)CC2)C1	1809977561	GBEGNXNVUUNAAW-UHFFFAOYSA-N	447.753	1.635	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)C2CCCC2)[C@@H]1c1cccnc1	1810298600	KGHYNBYDODJZDG-YLJYHZDGSA-N	436.516	1.590	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)[C@H]2CCC(=O)N2)[C@@H]1c1cccnc1	1812774695	CWWLAUBMLLZFIH-JYYAWHABSA-N	437.338	1.540	50	20	IDGD	
CSCC(C)(C)C(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1813068981	RDUMRFOBFKOQTM-PXNSSMCTSA-N	449.621	1.850	50	20	IDGD	
CN1N=C(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)[C@H](F)Br)[nH]n2)CCC1=O	1815622618	NKIVDMRIYMLMMH-FZMZJTMJSA-N	443.277	1.701	50	20	IDGD	
CCc1oncc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1	1817470960	NWTGHOVCQOABDR-QGZVFWFLSA-N	437.265	1.260	50	20	IDGD	
C[C@]1(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)CC1(F)F	1817474950	IAVAKKCHCFWNRK-HNAYVOBHSA-N	432.236	1.441	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)CCl)CC2)c1ccc2nc(CO)[nH]c2c1	1818150030	FAGJUSAJLMYTIQ-YGRLFVJLSA-N	449.920	1.337	50	20	IDGD	
CC1(C)CC(C(=O)N[C@H]2CCc3nc(NC(=O)c4cnccc4C(=O)NN)sc3C2)C1	1819801045	XXWUSHDWYVAOLG-LBPRGKRZSA-N	442.545	1.804	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1	1822117001	FMRRJERNRSKNFP-OLZOCXBDSA-N	429.905	1.526	50	20	IDGD	
CC(C)=NO[C@@H](C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1	1822415691	PDSNMFKRRZJTQB-GOEBONIOSA-N	435.529	1.576	50	20	IDGD	
N#Cc1cc(CC(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@H](O)CCl)CC3)ccc1F	1822960427	VMNMNVXQICKCIB-IUODEOHRSA-N	436.896	1.908	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)C2CN(C)C2)n[nH]1	1822999801	VAQQGJFFUDUVFB-ZRWQFTNJSA-N	440.508	1.097	50	20	IDGD	
N[C@H](C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1)c1ccccn1	1823002274	CCRZKUVMYGTUTI-AQUOVQTQSA-N	442.314	1.841	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(=O)ccn1C)CC2	1825645845	JTRQHKQEAHROBD-NXEZZACHSA-N	439.335	1.851	50	20	IDGD	
COc1nn(C)cc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1	1825734118	BOYKUYDGVKHAEQ-SFHVURJKSA-N	448.568	1.035	50	20	IDGD	
CCOC(=O)C1(C(=O)N[C@H]2CCc3nc(NC(=O)[C@@H](Cl)COC)sc3C2)CC1	1826004637	PPMKEDZEUQQOKY-QWRGUYRKSA-N	429.926	1.652	50	20	IDGD	
O=C(Cc1ccncc1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827052677	WZYYUGJHBBOZPV-QFIPXVFZSA-N	435.333	1.237	50	20	IDGD	
Cc1ccnc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)c1	1827757340	GYVUWINQOLVPOZ-JOCHJYFZSA-N	435.333	1.617	50	20	IDGD	
Cc1cnc2c(C(=O)N3CCCC[C@H]3C3CCN(C(=O)[C@H](O)CCl)CC3)cnn2c1	1828594018	GRLPIYAVIPNKNP-ZWKOTPCHSA-N	433.940	1.871	50	20	IDGD	
CN1CCN(CC(=O)N2CCC([C@H]3CCCCN3C(=O)[C@H](F)Br)CC2)CC1	1830378434	NMYQDOVSIHKUDI-AEFFLSMTSA-N	447.393	1.544	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(CN(C(=O)COC3CCCCC3)CCO2)C1	1830378871	JTABZCIEEMRJFY-NRFANRHFSA-N	442.629	1.644	50	20	IDGD	
O=C(Cc1ccc(F)cc1Cl)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1830726666	SOAGHUKZXKUCEJ-LPHOPBHVSA-N	449.306	1.078	50	20	IDGD	
Cc1cccc2cc(C(=O)N3CCOC[C@]4(C3)CN(C(=O)[C@@H](O)CCl)CCO4)[nH]c12	1830732134	VFMYKZFOMQYPJA-UWJYYQICSA-N	435.908	1.146	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)CN(CC)CC)C2)C1	1831657069	LEJCDKAWYIJPHJ-LQWHRVPQSA-N	432.005	1.828	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3ccc(C)nc3)CCO2)C1	1832912905	LHMCHPASEZOWIA-NQIIRXRSSA-N	439.940	1.033	50	20	IDGD	
Cc1ccncc1CCC(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)CCl)CC2)CC1	1833308097	IHDKOECNVJKHQD-FQEVSTJZSA-N	436.984	1.494	50	20	IDGD	
COC(=O)[C@@H]1CC[C@@H](C(=O)NC2CCN(C3CCN(C(=O)[C@H](F)Cl)CC3)CC2)C1	1833309743	JDLGIOWTZUGIRF-CPUCHLNUSA-N	431.936	1.682	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cc(F)cc(F)c3)CC2)CC1)[C@@H](O)CCl	1833313506	IDBNAQKKDDJBGY-SFHVURJKSA-N	429.895	1.750	50	20	IDGD	
CC(=O)N[C@@H](C(=O)NC1CCN(C2CCN(C(=O)[C@H](F)Cl)CC2)CC1)C(C)(C)C	1833402535	QUYRUTSJKQTMKE-IRXDYDNUSA-N	432.968	1.643	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)C(C)(C)CNC(C)=O)CC2)CC1	1833545055	WXTWCUDTPLPTKZ-GOSISDBHSA-N	429.005	1.738	50	20	IDGD	
O=C(c1ccccc1O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1833758437	SJQWDBTXLFPQPU-RHSMWYFYSA-N	431.258	1.153	50	20	IDGD	
O=C(CSc1ncccn1)NC1CCN(C2CCN(C(=O)C(Cl)Cl)CC2)CC1	1834865652	WSJDBHRPROHGLK-UHFFFAOYSA-N	446.404	1.944	50	20	IDGD	
O=C1Cc2cc(C(=O)N3CCC(N4CCC(NC(=O)[C@H](F)Cl)CC4)CC3)ccc2N1	1835080159	FRNUBLKAIAOQIS-IBGZPJMESA-N	436.915	1.901	50	20	IDGD	
CC(C)CNC(=O)C(=O)NC1CCN(C2CCN(C(=O)[C@](C)(Cl)CCl)CC2)CC1	1835130339	AOEGNAUQLRWPNF-HXUWFJFHSA-N	449.423	1.567	50	20	IDGD	
CC[C@H](C)[C@@H](N)C(=O)N1CCC(N2CCC(NC(=O)CO[Si](C)(C)C)CC2)CC1	1835833541	PGBVXHYPBSNNEU-OXJNMPFZSA-N	426.678	1.783	50	20	IDGD	
Cc1nc(CC(=O)N2CCC(N3CCC(NC(=O)[C@H](F)Br)CC3)CC2)no1	1836413362	DDOITJXVJWJIKM-INIZCTEOSA-N	446.321	1.183	50	20	IDGD	
O=C(Cc1cccc(Cl)n1)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836715308	PFGOFOMNJPWAQG-QGZVFWFLSA-N	444.359	1.876	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(CC)n(C)n3)CCO2)C1	1838271662	RQMATTZPHNWLOY-OXJNMPFZSA-N	426.945	1.460	50	20	IDGD	
C[C@@H](C(=O)N1CCC(OC2CCN(C(=O)[C@@](C)(Cl)CCl)CC2)CC1)n1cnnn1	1838637731	AWAJHYZQRTWDQG-UGSOOPFHSA-N	447.367	1.469	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cn(C(C)(C)C)nn3)CCO2)C1	1838757723	FEDUNOMUCCCJRJ-IFXJQAMLSA-N	427.933	1.121	50	20	IDGD	
CCc1ncsc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)Br)C2)C1	1838839117	PUXUKWKQHLPXNP-SJCJKPOMSA-N	446.367	1.559	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnnc4ccccc34)C2)C1	1839145199	YPWFXAVYTINBRO-LAUBAEHRSA-N	432.908	1.717	50	20	IDGD	
O=C(C1CCSCC1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839203474	LZRQVKRARGXMKI-XJKSGUPXSA-N	439.347	1.277	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(Cl)o3)C2)C1	1840032967	OYPMNLKZHXTDID-BDJLRTHQSA-N	435.702	1.786	50	20	IDGD	
C[C@@H](Cc1ccccn1)C(=O)N1CCOC[C@]2(CN(C(=O)C(Cl)Cl)CCO2)C1	1840190762	LNJMKKHWSGZFPQ-IFXJQAMLSA-N	430.332	1.520	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(CN(C(=O)CCCc3cccnc3)CCO2)C1	1840511767	LDKQNTQUBWHAEM-JOCHJYFZSA-N	449.624	1.712	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)c1ccc(-n3c(O)nnc3O)cc1)C2	1841669560	LKKDCCKRJWFWKT-OAHLLOKOSA-N	433.896	1.903	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)C[C@H](O)CNC(=O)OC(C)(C)C)C2	1841669865	XZZYRYFWWFMLPR-GJZGRUSLSA-N	431.961	1.873	50	20	IDGD	
Cn1c(=O)n(C)c2cc(C(=O)N3CCCC34CN(C(=O)[C@H](F)Br)C4)ccc21	1843734487	JZZNPTMYBBLEHG-AWEZNQCLSA-N	439.285	1.385	50	20	IDGD	
CN1C(=O)CC[C@H]1C(=O)N1CCCC12CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)C2	1845238925	DRXXWEHAWCYCTI-DWCFMXGVSA-N	428.439	1.696	50	20	IDGD	
Cc1cc(=O)c(C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)nn1-c1ccccc1F	10159725	UUFGPXSTCZABCX-UHFFFAOYSA-N	448.414	1.646	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@H](C(=O)NNC(=O)COc2ccc(C#N)cc2)C(C)C)cc1	26694415	FRQOLSJKYNPGGD-FQEVSTJZSA-N	444.513	1.396	50	20	IDGD	
Cc1nc(-c2ccco2)ccc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	726157349	PUGXGERARCVHSV-UHFFFAOYSA-N	428.470	1.975	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1ccc(C(F)F)cc1	726495542	PJAMYDGAWXJJJV-UHFFFAOYSA-N	439.440	1.720	50	20	IDGD	
CCOC(=O)N(C)C1CCN(CC(=O)NNC(=O)c2cc(Cl)ccc2OC)CC1	726970645	SXKUACLFSRJZGQ-UHFFFAOYSA-N	426.901	1.662	50	20	IDGD	
Cc1nc(S(=O)(=O)NNC(=O)[C@@H]2Cc3ccccc3CN2Cc2ccccc2)cn1C	727112903	MBSQOTXKRPPXOE-FQEVSTJZSA-N	439.541	1.665	50	20	IDGD	
CC(C)NC(=O)C(=O)NNC(=O)c1ccc(Cl)cc1NS(=O)(=O)c1ccccc1	727800502	PIWLOZYRWZVNEW-UHFFFAOYSA-N	438.893	1.426	50	20	IDGD	
COc1ccnc(NNC(=O)NCc2cccc(OCCN(C)C3CCOCC3)c2)n1	728134853	OXKQWKGREDQKKZ-UHFFFAOYSA-N	430.509	1.801	50	20	IDGD	
C[C@@H](C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1)N1C(=O)[C@H]2CCCC[C@H]2C1=O	728210073	QFAUNQHLYFQVJG-AFAVFJNCSA-N	434.518	1.134	50	20	IDGD	
COc1ccccc1OCC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	728214051	WEPXVEGITKAMIW-UHFFFAOYSA-N	434.518	1.153	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)c2cccc(CS(N)(=O)=O)c2)c1	728526089	LXWZGVBMLKQYPR-UHFFFAOYSA-N	442.291	1.321	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1ccc(C(=O)NNC(=O)Cc2cccnc2)cc1	728892263	SDASPXUTNIOPCH-UHFFFAOYSA-N	440.481	1.895	50	20	IDGD	
COc1ccccc1OCCCNC(=O)NNC(=O)c1csc(N2CCOCC2)n1	729221612	UAAMEJVAKGEPDO-UHFFFAOYSA-N	435.506	1.401	50	20	IDGD	
CCc1ccccc1OCC(=O)NNS(=O)(=O)c1cc(C)cc(S(C)(=O)=O)c1C	730203544	SPCDPLCJGVDEKS-UHFFFAOYSA-N	440.543	1.658	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H](C(C)C)N(C)C)c1	730272589	GLIOXPIZUIVFHE-LJQANCHMSA-N	448.545	1.843	50	20	IDGD	
CC(=O)N1CCN(c2ccc(C(=O)NN=c3cc[nH]c4ccccc34)cc2[N+](=O)[O-])CC1	730288310	CIVVFXJEGVXEQV-UHFFFAOYSA-N	434.456	1.990	50	20	IDGD	
CC(C)(C)CC(=O)N1CSC[C@H]1C(=O)OCC(=O)NNC(=O)c1ccc(Cl)cc1	730328064	NMNNBYOJYXVZTF-AWEZNQCLSA-N	441.937	1.982	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Cc2ccc(S(N)(=O)=O)cc2)cc1Br	732175046	GSUBPRIQGIXFGR-UHFFFAOYSA-N	442.291	1.109	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)NCCC(=O)N1CCN(c2ccccn2)CC1)c1ccccc1	732459327	TUFHWXSTNLSHQK-LJQANCHMSA-N	438.532	1.645	50	20	IDGD	
CN1C(=O)C[C@@H](C(=O)NNC(=O)c2nnc(O)c3ccccc23)[C@H]1c1cccc(Cl)c1	734417767	UJEPLWPBBYBDNW-CRAIPNDOSA-N	439.859	1.969	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)N[C@@H]2CC(=O)N(CCN3CCOCC3)C2)c(C)n1CC(C)C	736153576	RFYXDEPRUCABDF-BYUJNSPJSA-N	441.576	1.717	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)[C@]2(C)CCCN(C(=O)c3ccccc3)C2)c2ccccc2c1=O	742034885	YLZCDQDZAWDRQI-XMMPIXPASA-N	447.495	1.637	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)N[C@@H]1CC(=O)N(CCOc2ccccc2)C1	743609239	ROPSMYOZPVBXMD-GOSISDBHSA-N	448.483	1.496	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)CCNS(=O)(=O)c2cccc(Cl)c2)cc1	743828469	NBQUIFNERJAMOE-UHFFFAOYSA-N	439.925	1.927	50	20	IDGD	
Cc1c(C=NNC(=O)c2ccc(-n3cnnn3)cc2)c(=O)n2c([nH]c3ccccc32)c1C#N	744755671	HTWXATJFCUVUJX-UHFFFAOYSA-N	437.423	1.701	50	20	IDGD	
CCO[C@@H](C)c1ncc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)s1	745449686	SAZVUIFGYLZQOI-SMDDNHRTSA-N	435.458	1.385	50	20	IDGD	
C[C@@H](CCc1cccn1C)NC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	745875033	JBZXYWQEIMGSOT-INIZCTEOSA-N	449.581	1.004	50	20	IDGD	
CO[C@@]1(C)C[C@H](NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)C1(C)C	745930213	BMRLATROQSDYRZ-KXBFYZLASA-N	426.539	1.150	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(CNC(=O)NNc2nc(C)cc(OC)n2)s1	746747885	VQIQBZWBSOHXNP-UHFFFAOYSA-N	428.540	1.712	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)CN2C(=O)N[C@](C)(c3ccccc3)C2=O)o1	747715876	RWUTVDAVTCKDPI-JOCHJYFZSA-N	441.488	1.350	50	20	IDGD	
CN(C)C(=O)NNC(=O)CCCc1nnc(-c2ccccc2I)o1	747721396	DUAVRMAFOPUKQR-UHFFFAOYSA-N	443.245	1.966	50	20	IDGD	
Cc1ccc(C)c(S(=O)(=O)Nc2ccccc2C(=O)NNC(=O)C(=O)N2CCCC2)c1	748247555	ROXPRVBROCFYTM-UHFFFAOYSA-N	444.513	1.488	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Cc2coc3cc(F)ccc23)cc1	748286618	VEOIDAOGCBHSMV-UHFFFAOYSA-N	433.461	1.891	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)N2CCCC2)cc1S(=O)(=O)Nc1ccc(F)cc1	748342310	FDWPFMVMAIIZEV-UHFFFAOYSA-N	448.476	1.318	50	20	IDGD	
Cc1ccc(OCC(=O)N2CCN(CC(=O)NNC(=O)c3ccccc3Cl)CC2)cc1	748806598	CZANIRHVKZYIQU-UHFFFAOYSA-N	444.919	1.633	50	20	IDGD	
COC(=O)c1csc(S(=O)(=O)NNC(=O)c2ccc(Br)s2)c1	749150788	FHSGLGTZKHMPBM-UHFFFAOYSA-N	425.307	1.982	50	20	IDGD	
NC(=O)c1ccc(/C=C\C(=O)N2CCC[C@H]2C(=O)NNC(=O)c2cc3ccccc3o2)cc1	749477335	YSNUTKOQXOXCNH-DVESRUBUSA-N	446.463	1.997	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)[C@H]1CCCN1C(=O)c1ccc2c(c1)OCO2	749561947	STAFSVFLPUISKN-MRXNPFEDSA-N	429.404	1.385	50	20	IDGD	
O=C(NNc1nc(Br)cn2ccnc12)c1ccc(CN2C(=O)CCC2=O)cc1	750242876	APBYMRUAKVDQDA-UHFFFAOYSA-N	443.261	1.898	50	20	IDGD	
Cc1nc(S(=O)(=O)NCC(=O)NNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cn1C	750665307	WWIHTQTYTVBPIW-UHFFFAOYSA-N	436.372	1.077	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1ccc(Br)cc1[N+](=O)[O-]	750826711	BIJRJGHUJXEYBJ-UHFFFAOYSA-N	449.265	1.825	50	20	IDGD	
CC[C@@H](C)C(=O)N1CCC[C@H](C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)C1	751292836	BCLMJXRNBZTLIJ-YPMHNXCESA-N	444.941	1.033	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN(C(=O)c2ccc3n[nH]cc3c2)C1)c1ccc2c(c1)OCCO2	751304430	PDNJHLBCXRDUSZ-MRXNPFEDSA-N	449.467	1.648	50	20	IDGD	
CCOC(=O)[C@@H]1Cc2cc(S(=O)(=O)NNC(=O)CCc3ccccc3O)ccc2O1	751549004	TZQXHZOEEPRYQF-SFHVURJKSA-N	434.470	1.201	50	20	IDGD	
COc1cc(OC)cc(N2C[C@@H](C(=O)NNC(=O)Cc3c[nH]c4ccccc34)CC2=O)c1	752399680	SYBOKLSUBUVSQD-HNNXBMFYSA-N	436.468	1.928	50	20	IDGD	
COc1cc(OC)cc(OCCCNC(=O)NNC(=O)Cc2nc3ccccc3n2C)c1	753946762	KXRIYHGALCHNJP-UHFFFAOYSA-N	441.488	1.933	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCCC(C)(C)CO)c1	754918809	IMOCRQLWHCGMNM-UHFFFAOYSA-N	428.555	1.460	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(N2CCCC2)c(NC(=O)NNC(=O)COC)c1	755400937	MGJNTDVHEWPITE-UHFFFAOYSA-N	427.527	1.116	50	20	IDGD	
CN(C)c1ccc(S(=O)(=O)N(C)C)cc1NC(=O)NNC(=O)Cc1ccc(F)cc1	755534748	WMIUURYEYKXXMZ-UHFFFAOYSA-N	437.497	1.537	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)Nc1ccc(S(=O)(=O)N(C)C2CC2)cc1	756400146	BOXJPTSNOCMMSR-UHFFFAOYSA-N	432.502	1.874	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)[C@@H](C)CS(=O)(=O)c2ccc(F)cc2)cc1	756713451	RJQNTPZDWUWPIQ-AWEZNQCLSA-N	436.461	1.548	50	20	IDGD	
CC(C)(C)n1cc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cn1	756795085	NWGGGTHJRQMCLX-UHFFFAOYSA-N	434.522	1.889	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N[C@H]2CCN(C(=O)CCc3ccccc3)C2)cc1OC	756915513	KYPIYZRZFBXYEK-SFHVURJKSA-N	440.500	1.882	50	20	IDGD	
COc1ccccc1N1CC[C@H](NC(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)C1=O	757288324	XGIHQYVNQRRJQN-INIZCTEOSA-N	439.472	1.386	50	20	IDGD	
NC(=O)c1ccc(NNC(=O)[C@H](Cc2ccccc2)NC(=O)OCc2ccccc2)nn1	757393526	ZOBDUJJOKWFRRA-SFHVURJKSA-N	434.456	1.556	50	20	IDGD	
COCCCS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2ccc3c(c2)OCO3)cc1	757822808	NMKNDOBOGHQKLC-UHFFFAOYSA-N	435.458	1.692	50	20	IDGD	
CCOCCCn1c(NNC(=O)c2cc([N+](=O)[O-])cnc2N)nc2ccccc2c1=O	758167989	JPKRIZMTDNQDSF-UHFFFAOYSA-N	427.421	1.465	50	20	IDGD	
CC(C)Cn1cnc2c1c(=O)n(CC(=O)NN=C[C@H]1C[C@@H]1C)c(=O)n2Cc1ccccc1	758366648	SBHSZHJINJXKSX-FUHWJXTLSA-N	436.516	1.822	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)NC[C@H]1CN(Cc2ccccc2)CCCO1	758856238	VIRGFFVPOYQOTO-IBGZPJMESA-N	442.516	1.696	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NCCCc2ccc3c(c2)OCCO3)c2ccccc2c1=O	758893680	CULGUXJWYBOGON-UHFFFAOYSA-N	437.456	1.282	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)NCCc1cccc([N+](=O)[O-])c1	759680318	BXCUXKLANANDMP-UHFFFAOYSA-N	440.504	1.680	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCCC(=O)NNC(=O)c1ccc2c(c1)OCO2	760798977	JYVRSLIXCIGHFP-CQSZACIVSA-N	448.476	1.082	50	20	IDGD	
CCCCS(=O)(=O)NCC(=O)NNC(=O)[C@H](C)Oc1cccc(Br)c1	761121188	SMHFTQCULXBSJD-NSHDSACASA-N	436.328	1.083	50	20	IDGD	
COC(=O)c1c(CC(=O)NNC(=O)CSc2ccccc2OC)[nH]c(C(C)=O)c1C	761626199	UMGJPZCBARXJEU-UHFFFAOYSA-N	433.486	1.803	50	20	IDGD	
C[C@@H](CN1CCOCC1)C(=O)NN=C1CCOc2c1cc(Br)cc2[N+](=O)[O-]	761803908	HEDZTCCSQGLEKR-NSHDSACASA-N	441.282	1.928	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)c1cnc2c(c1)c(O)nc(=O)n2C1CC1	762410323	URUXMAIYPHBHRQ-UHFFFAOYSA-N	441.469	1.394	50	20	IDGD	
O=C(NNc1nccc(N2CCOCC2)n1)c1cnn(-c2ccccn2)c1C(F)(F)F	762862458	SVHMYBVFIRRLLY-UHFFFAOYSA-N	434.382	1.670	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3c(C)nc(O)nc3SC)n[nH]2)cc1OC	763149025	NSQAPAGDSAUKLF-UHFFFAOYSA-N	444.473	1.695	50	20	IDGD	
O=C(NNC(=O)c1ccccc1O)C(=O)Nc1ccc(Cl)c(-n2nnnc2C2CC2)c1	763526639	DDLLSGBEOJEUCH-UHFFFAOYSA-N	441.835	1.298	50	20	IDGD	
CCCCOc1ccc(OC)cc1NC(=O)C(=O)NNC(=O)[C@@H]1COc2ccccc2O1	763572591	MVDSFOXYOGBENN-IBGZPJMESA-N	443.456	1.800	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(-n3cnc4ccccc43)nc2)c1	763618860	GKVWOJADTRPSNG-UHFFFAOYSA-N	444.451	1.894	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)N2CCc3ccc(Br)cc32)c1	763618879	GYTULHOLCBBWKL-UHFFFAOYSA-N	432.274	1.873	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cnc2c(cnn2C(C)C)c1	763646602	IOPXKLVHXUBUJI-UHFFFAOYSA-N	426.433	1.186	50	20	IDGD	
COC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(OC)cc2)cc1F	763662678	YUMJHFHQNKKJNW-UHFFFAOYSA-N	434.380	1.178	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(Cl)cc2OC(F)F)cc1	763673584	HBSJPCKEENBETL-UHFFFAOYSA-N	438.774	1.978	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2cccc(C(F)F)c2)c1	763718892	QUXFPCYNHBVWBF-UHFFFAOYSA-N	440.428	1.274	50	20	IDGD	
O=C(NNC(=O)c1cccc(Cl)c1)C(=O)Nc1ccc2c(c1)C(=O)N(CC1CC1)C2=O	763752134	DJVVWKHHSQETIW-UHFFFAOYSA-N	440.843	1.746	50	20	IDGD	
CC(C)S(=O)(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCC3)c1	763784478	XUXWBPKGXGENBK-UHFFFAOYSA-N	449.554	1.960	50	20	IDGD	
C[C@@H]1CN(c2ccccc2NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)C[C@@H](C)O1	763840342	SSMVMKDDMXWKKV-HUUCEWRRSA-N	444.463	1.604	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(OC)cc2OC)cc1	763859737	FPDNIUMZFLRESJ-ZDUSSCGKSA-N	431.445	1.656	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(Cl)c(C(N)=O)c2)cc1	763860514	IFWLTSVHSZVHCD-NSHDSACASA-N	448.863	1.391	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccc(OC[C@H]2CCCO2)cc1	763866905	RMYXHCPGHVVDBS-IFXJQAMLSA-N	445.447	1.937	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cc(C)n(-c3ccccc3)n2)cc1	763870979	CAYJVEDTHWLTAH-MRXNPFEDSA-N	449.467	1.937	50	20	IDGD	
CCN1CCc2ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc3ccc(C(C)=O)cc3)cc21	763879589	YYZQMCIAYFWDAS-HNNXBMFYSA-N	438.484	1.825	50	20	IDGD	
COc1cc(OC)c(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1Cl	764006908	VMYYMDRDBUHPKG-UHFFFAOYSA-N	435.820	1.528	50	20	IDGD	
CN(Cc1ccccc1NC(=O)C(=O)NNC(=O)c1cnccn1)C(=O)OC(C)(C)C	764025885	ZVIXBWREAAOHHS-UHFFFAOYSA-N	428.449	1.243	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3c2)cc1OCC(N)=O	764065315	ZGODUAHKERCSCJ-UHFFFAOYSA-N	436.424	1.112	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cc(C(=O)N3C[C@@H](C)C[C@@H](C)C3)ccc2C)n[nH]1	764106590	NBHGKSSLBUHJRO-BETUJISGSA-N	440.504	1.544	50	20	IDGD	
CCOC(=O)Cn1ccc2cc(NC(=O)C(=O)NNC(=O)c3ccc(C#N)cc3)ccc21	764177704	UEBZAMSSIKAPRP-UHFFFAOYSA-N	433.424	1.476	50	20	IDGD	
O=C(NNC(=O)c1cccc(OC(F)F)c1)C(=O)Nc1ccn(Cc2ccncc2)n1	764260411	XSVPILGGGANFLX-UHFFFAOYSA-N	430.371	1.328	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1ccc(Cl)c(Br)c1	764276780	BHGZDAPGMQFQMC-UHFFFAOYSA-N	442.653	1.973	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)C(=O)Nc1ccccc1C(=O)N1C[C@H](C)C[C@@H](C)C1	764298123	OABVVEXCOCJQRE-CHWSQXEVSA-N	426.477	1.236	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C(=O)Nc1cc(C(=O)OC)cc(OC)c1OC)c1ccccc1	764327490	ADICCSKQOWCQGN-HNNXBMFYSA-N	443.456	1.770	50	20	IDGD	
COCCCOc1cccc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c1	764345289	FGKXAQKKRQPKEZ-UHFFFAOYSA-N	437.456	1.687	50	20	IDGD	
CCOC(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)c1	764376259	AIJGCQVOVMZLBB-UHFFFAOYSA-N	441.469	1.644	50	20	IDGD	
O=C(NNC(=O)C(F)(F)Oc1ccccc1)C(=O)Nc1ccnn1Cc1ccccc1F	764379341	CDRIZKDECIUDHN-UHFFFAOYSA-N	447.373	1.828	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1cccnc1Br	764396857	CRSRPLSXCURASX-UHFFFAOYSA-N	439.291	1.731	50	20	IDGD	
C[C@H](NS(=O)(=O)c1cccc(C#N)c1)C(=O)NNC(=O)c1cc(-c2ccccc2)on1	764635087	ISSLYPNLDKDDJQ-ZDUSSCGKSA-N	439.453	1.341	50	20	IDGD	
COCc1ccc(C=NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)o1	764658919	KURKUJKGMNRGCE-UHFFFAOYSA-N	435.502	1.530	50	20	IDGD	
O=C(NCc1cccc(Br)c1O)NNC(=O)c1ccc(-n2cnnn2)cc1	764757576	NYECFGPAOWGOOY-UHFFFAOYSA-N	432.238	1.275	50	20	IDGD	
COC(=O)NNC(=O)C(=O)Nc1cc(Br)ccc1I	765364281	DNXYZGJATQQVQJ-UHFFFAOYSA-N	442.007	1.379	50	20	IDGD	
NS(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)c1	765568202	NMNHXUJWYNBPIY-UHFFFAOYSA-N	425.879	1.514	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cnn(Cc4ccccc4)c3)CC2)cc1	765749219	VJQIDPQOKKQYNQ-UHFFFAOYSA-N	446.555	1.819	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CN2CCO[C@H](c3ccc(OC(F)F)cc3)C2)c1	766266927	PJVPCWZNTFZLST-SFHVURJKSA-N	430.411	1.994	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)Nc1ccc(CCS(C)(=O)=O)cc1	769239554	HEVKPBIUQQSTHT-UHFFFAOYSA-N	441.531	1.834	50	20	IDGD	
Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	769607479	LMJAPRPXBXBYDL-UHFFFAOYSA-N	434.474	1.845	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)NC3CCN([C@@H]4CCCC[C@@H]4O)CC3)nc21	770411320	GDHMFFDOICVUTR-CVEARBPZSA-N	446.556	1.681	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1cccc(S(=O)(=O)N2CCCC[C@@H]2C)c1	771938875	MKVQYEASPPGIMG-UONOGXRCSA-N	425.507	1.352	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)[C@@H]1CCCN(C(=O)c2ccc3n[nH]cc3c2)C1	772068675	NFMBFCGYWLYDLZ-GOEBONIOSA-N	443.504	1.540	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNS(=O)(=O)c1ccc([N+](=O)[O-])c(C(=O)O)c1	773250213	AXQXFFGIYYJWKK-VIFPVBQESA-N	443.821	1.723	50	20	IDGD	
Cc1ccc(S(=O)(=O)C[C@@H](C)NC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1	773289865	DTRFQVMXQXRSRG-MRXNPFEDSA-N	441.513	1.987	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)c2cn(Cc3ccccc3)nn2)C1	773412527	WJRGUWDBHSIYFD-INIZCTEOSA-N	428.493	1.735	50	20	IDGD	
C#CCOc1ccccc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccccc2OC)[nH]n1	773496619	LIDAGKCROUPFJK-UHFFFAOYSA-N	433.424	1.497	50	20	IDGD	
CC[C@H](NCC(=O)NNC(=O)c1ccc(C)cc1)c1ccccc1OCC(=O)N(C)C	775052970	HFLFGWXBYVMEBN-IBGZPJMESA-N	426.517	1.964	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN[C@H](C)c2ccc(N3CCOC3=O)cc2)cc1OC	775264997	ZMZPIWVDKZNNJJ-CQSZACIVSA-N	442.472	1.772	50	20	IDGD	
CC1(C)OCC(C)(C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)CO1	775616338	GUPGAPWDLUYUJE-UHFFFAOYSA-N	438.956	1.394	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)c1cc(OC(F)F)cc(OC(F)F)c1	775792119	TZHVZPUFPMNWGF-UHFFFAOYSA-N	430.314	1.475	50	20	IDGD	
O=C(NC[C@@H]1COC2(CCCCCC2)O1)NNC(=O)C1CCN(c2ncccn2)CC1	776907098	KKEXFMVVZCIWFY-QGZVFWFLSA-N	432.525	1.489	50	20	IDGD	
Cc1ccc(C)c(S(=O)(=O)N2CCN(C(=O)CCC(=O)NNc3ccccn3)CC2)c1	777472592	QVSXDLLCSJDYIR-UHFFFAOYSA-N	445.545	1.455	50	20	IDGD	
CNC(=O)CN(CC(=O)NNC(=O)c1cccs1)Cc1cccc(C(F)(F)F)c1	777617083	GRYHJJDZCXMYGB-UHFFFAOYSA-N	428.436	1.776	50	20	IDGD	
O=C(CCCNc1ccc([N+](=O)[O-])cc1)N1CCN(S(=O)(=O)CBr)CC1	777836844	LIEWDNGQIYFBMQ-UHFFFAOYSA-N	449.327	1.613	50	20	IDGD	
C[C@@H](c1cccc(N2CCCS2(=O)=O)c1)N(C)CC(=O)NNC(=O)c1ccccc1	778226438	RLLUMXFYFJVUBU-INIZCTEOSA-N	430.530	1.681	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccc(C(=O)NNC(=O)CNC(=O)OC(C)(C)C)cc1	778433678	PLJMVLJOGVMLQB-UHFFFAOYSA-N	428.511	1.049	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)[C@@H]1CCCN(C(=O)c2ccc3n[nH]cc3c2)C1	778441286	QZZRAPFALITHLU-CQSZACIVSA-N	444.492	1.087	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)c1csc(CNC(=O)OC(C)(C)C)n1	778445298	HKBYJTFMVDWODJ-UHFFFAOYSA-N	429.499	1.454	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)[C@@H]1CCN(Cc2ccccc2)C1	778806108	KWPVSIMNZYYMLP-VQIMIIECSA-N	444.557	1.945	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN([C@H]2CCCN(S(=O)(=O)CCCCCl)C2)C(=O)C1	780856770	XOUGWENIYOOCRX-HNNXBMFYSA-N	437.990	1.879	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C(=O)Nc2ccccc2C(=O)N2CCCC2)nc2ccccc21	782894618	QQIWGVTXWZYJRL-UHFFFAOYSA-N	448.483	1.138	50	20	IDGD	
COC(=O)COc1ccccc1C(C)=NNC(=O)c1sc(N2CCOCC2)nc1C	783813455	LUXOHFPRHHWKQG-UHFFFAOYSA-N	432.502	1.994	50	20	IDGD	
N#Cc1cccc(Oc2ccc(NC(=O)C(=O)NNC(=O)CNC(=O)c3ccco3)cc2)c1	784002502	QTSCXFAEEVMHBK-UHFFFAOYSA-N	447.407	1.459	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccc(C(C)(C)C)cc2)cc1	784805665	PYOWCNJJGZZZJQ-UHFFFAOYSA-N	448.545	1.991	50	20	IDGD	
COC[C@@H](C)NS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccc(Cl)nc2)cc1	784871446	KTBPRANQHDNWCH-LLVKDONJSA-N	441.897	1.130	50	20	IDGD	
Cn1ccnc(NNC(=O)C(=O)Nc2ccc(C(F)(F)F)cc2Br)c1=O	785085670	BOBUZMFTPWFGMF-UHFFFAOYSA-N	434.172	1.643	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2cc(C(F)(F)F)ccc2F)cc1-n1cnnn1	785166389	BCQRBGOWDQBAPD-UHFFFAOYSA-N	439.329	1.911	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)[C@@H]2CCCN(C(=O)NC3CCCC3)C2)c1	786807458	YPDBUOKJGCBTBJ-QGZVFWFLSA-N	441.488	1.227	50	20	IDGD	
NC(=O)[C@H]1CC(C(=O)NNC(=O)NCc2ccc(Cl)cc2)=NN1c1ccc(F)cc1	787436024	ICBPQOCLKFKQBF-MRXNPFEDSA-N	432.843	1.430	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccn(C2CCN(C)CC2)n1	787583092	ZVJRYTKYAMLIMM-ZDUSSCGKSA-N	448.911	1.357	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)[C@@H](NC(=O)C(F)(F)F)C(C)C)c1	789929190	ZIDIBFZWOODENV-NSHDSACASA-N	440.216	1.922	50	20	IDGD	
Cn1c(C(=O)NNC(=O)c2cc(-c3ccccc3)on2)cc2c(=O)n3ccccc3nc21	791042047	PLXICLOEDBZKAK-UHFFFAOYSA-N	428.408	1.916	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)cc(Cl)c1F	792266692	BSRIITFVKOVBKZ-CQSZACIVSA-N	435.795	1.355	50	20	IDGD	
CC(=O)NC[C@H]1CCn2ncc(C(=O)NNC(=O)[C@H](C)Oc3cccc(C)c3C)c2C1	792736673	OLGNGJOLRCJOHJ-RDJZCZTQSA-N	427.505	1.427	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N(C)C)c(Br)c2)n1	794086022	OYWNOZZBSCHAIJ-UHFFFAOYSA-N	441.307	1.478	50	20	IDGD	
COC(=O)c1csc(C(C)=NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)c1	794920349	KLIYCSSVESSRAL-UHFFFAOYSA-N	428.514	1.833	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CN2CCC[C@@H](CNC(=O)OCc3ccccc3)C2)c1	796466656	NUSLTKOZKHJPEN-FQEVSTJZSA-N	449.511	1.958	50	20	IDGD	
CCNC(=O)N(C)c1cccc(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)c1	796991720	ICOYDPJMGZVTFQ-UHFFFAOYSA-N	447.879	1.671	50	20	IDGD	
CNC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3c2)c(C)c1	796998226	HUAYWMQUYQVSIJ-UHFFFAOYSA-N	434.452	1.673	50	20	IDGD	
CCc1cc(C)cc(CC)c1NC(=O)C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	797000247	XWIWLSOPLZJGAM-UHFFFAOYSA-N	431.514	1.923	50	20	IDGD	
Cc1ccc(N2CCOCC2)cc1NC(=O)C(=O)NNC(=O)C(F)(F)Oc1ccccc1	797534972	IQQRAQFOQZJTQC-UHFFFAOYSA-N	448.426	1.589	50	20	IDGD	
COc1cc2c(cc1OC)CN(C(=O)CCC(=O)NNC(=O)NCC(F)(F)F)CC2	798315839	CECISVDSRANNON-UHFFFAOYSA-N	432.399	1.261	50	20	IDGD	
CCOCC1(C(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)CC1	799519490	ZCUURIBNCHGQLF-UHFFFAOYSA-N	431.514	1.743	50	20	IDGD	
O=S(=O)(CBr)N1CCN(S(=O)(=O)c2c[nH]c3cccc(F)c23)CC1	799797156	ASIQGJDDZLLAIQ-UHFFFAOYSA-N	440.316	1.296	50	20	IDGD	
O=C(COC(=O)CCCS(=O)(=O)c1ccc(Cl)cc1)NNC(=O)c1cccs1	803761059	BLDBIZDTJRUDDZ-UHFFFAOYSA-N	444.918	1.960	50	20	IDGD	
CCS(=O)(=O)N1CCN(C(=O)NNC(=O)c2cc3c(s2)CC[C@@H](C)C3)[C@H](C)C1	804868671	NIVOKRKSVSXYBN-CHWSQXEVSA-N	428.580	1.583	50	20	IDGD	
COc1ccc(CN2CC[C@@H](NC(=O)NNC(=O)c3ccccc3OC)C2=O)c(OC)c1	805096811	CDIZHMYKFBXJCL-QGZVFWFLSA-N	442.472	1.458	50	20	IDGD	
Cc1cc(I)cc(NC(=O)C(=O)NNC(=O)c2ccc(C)o2)c1	806978989	KKOXPMNVWWAWNZ-UHFFFAOYSA-N	427.198	1.901	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)NC[C@@H](c1ccc(F)cc1)N1CCOCC1	807000091	IYTDIMZIYKMJEO-IBGZPJMESA-N	441.463	1.480	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)CCc1c(C)nc2c3cccnc3nn2c1C	807370520	LCZBHFBLRPROEJ-UHFFFAOYSA-N	428.493	1.764	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)Nc1ccc(-n2ccc(C(F)(F)F)n2)cc1	810314633	DLMFHJCKEJMIKU-SNVBAGLBSA-N	431.396	1.479	50	20	IDGD	
COC(=O)c1c(F)ccc(NC(=O)C(=O)NNc2ccnc(Br)c2)c1F	810397679	XFIYHJZQBBSKPT-UHFFFAOYSA-N	429.177	1.991	50	20	IDGD	
CC(C)Nc1ccc(S(=O)(=O)NCC(=O)NNc2cc(Cl)ccn2)cc1[N+](=O)[O-]	810942680	TWUCIFIHYVKZDU-UHFFFAOYSA-N	442.885	1.885	50	20	IDGD	
Cc1cc(C)c(S(=O)(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)s1	814211548	JCQTUSOTPPXFJC-UHFFFAOYSA-N	436.559	1.132	50	20	IDGD	
Cc1cc(C)nc(SCc2ccc(C(=O)NNC(=O)[C@@H]3CCCS(=O)(=O)C3)cc2)n1	816815587	YNAPNYONUARQJN-QGZVFWFLSA-N	448.570	1.972	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)CN2C(=O)[C@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2=O)c1	861638050	VJWHSZFDWMTLII-LATRNWQMSA-N	425.485	1.452	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccccc1	863998887	WTMXEQARJWJUGP-QGZVFWFLSA-N	447.513	1.465	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)CNS(=O)(=O)c2cc(C)ccc2C)cc1	912843501	KQHXRCUFDKBZGR-MRXNPFEDSA-N	449.529	1.595	50	20	IDGD	
O=C(NNc1ncccn1)C1CCN(S(=O)(=O)c2ccc3c(c2)OCCCO3)CC1	913044273	HRNOWUHHTHFPIW-UHFFFAOYSA-N	433.490	1.182	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	914748214	OAUUADVBBCAIAN-UHFFFAOYSA-N	446.529	1.671	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@H]1CC(=O)N(C2CCCCC2)C1	914831158	CUBLLUSUPHLGNU-AWEZNQCLSA-N	435.550	1.230	50	20	IDGD	
Cc1oc(C(=O)NNC(=O)COc2ccccc2F)cc1S(=O)(=O)N1CCCC1	916093341	QBYIPCJHKYFECV-UHFFFAOYSA-N	425.438	1.352	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(F)cc1)c1cccc(S(=O)(=O)N2CCCCC2)c1	916107920	RSPMYXFISYMSGT-UHFFFAOYSA-N	441.506	1.624	50	20	IDGD	
O=C(CC12CC3CC(CC(C3)C1)C2)NNC(=O)NCCNS(=O)(=O)c1ccccc1	916294530	AZHYEPQOVILAQO-UHFFFAOYSA-N	434.562	1.902	50	20	IDGD	
CC(=NNC(=O)[C@H](C)CN1C[C@H](C)O[C@@H](C)C1)c1ccc(O)c(CN2CCOCC2)c1	916365904	MOTIGTYSPLDUKU-SQNIBIBYSA-N	432.565	1.810	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)[C@H]2CCCCN2S(=O)(=O)CCC)cc1OC	919683252	UXLUFYSSQXTOAX-MRXNPFEDSA-N	441.550	1.839	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Cn2c(C)c(C)sc2=O)c1	919807563	XHFXSSMKUQWQTI-UHFFFAOYSA-N	440.547	1.018	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)NCc2cccc(CN3CCOCC3)c2)cc1	919908379	ZHWNWCUDHWBBRO-UHFFFAOYSA-N	426.517	1.991	50	20	IDGD	
CC(C)(CNC(=O)/C(C#N)=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(N)=O	920852260	SXYHRHNLAJVOOC-NTEUORMPSA-N	442.907	1.614	50	20	IDGD	
C[C@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1)n1cccc1	1116351805	IBFTTXSZQIZAEK-MRXNPFEDSA-N	426.498	1.989	50	20	IDGD	
COc1ccccc1[C@@]1(C)NC(=O)N(CC(=O)NNc2cncc(Br)c2)C1=O	1116399675	IYOCDQXYQXCWCA-GOSISDBHSA-N	448.277	1.763	50	20	IDGD	
O=C(CCl)NC1CCN(S(=O)(=O)c2ccc(I)cc2)CC1	1116437496	FDIBQIPVKOVOTO-UHFFFAOYSA-N	442.706	1.799	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)c1cn(-c2ccc(Br)cc2)nn1	1323105419	VVDQWKNBSMMYJW-UHFFFAOYSA-N	426.271	1.580	50	20	IDGD	
Cc1ccc(C)c(NC(=S)NNC(=O)c2ccc(S(=O)(=O)N(C)CCO)cc2)c1	1330710601	NTUMOPZXVQMZSE-UHFFFAOYSA-N	436.559	1.548	50	20	IDGD	
Cc1cc(C)n2ncc(C(=O)N3CC[C@]4(CN(C(=O)CO[Si](C)(C)C)CCO4)C3)c2n1	1777776856	NBFHTSJULBSLAU-NRFANRHFSA-N	445.596	1.641	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc3nonc3c2)C1	1778526055	SXPGTJIKAJINQH-JNAXZKDPSA-N	436.896	1.604	50	20	IDGD	
C[C@@H](C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCBr)C2)N1C[C@H]2C[C@H]2C1	1779246188	GDRQMHNYHOQIEX-GXAQHZSOSA-N	442.398	1.626	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccc3c(c1)CNC3=O)CCO2	1779297132	SLBOKWMAKSOLCX-OAQYLSRUSA-N	431.565	1.225	50	20	IDGD	
O=C([C@H](F)Cl)N1CCO[C@@]2(CCN(C(=O)[C@H](O)c3cccc(Br)c3)C2)C1	1780972817	XJVIWPUQLVHZOZ-JKIFEVAISA-N	449.704	1.847	50	20	IDGD	
C[C@H](Nc1ccccn1)C(=O)N1CCO[C@]2(CCN(C(=O)[C@](C)(Cl)CCl)C2)C1	1781230333	RACVGIIKROAUJY-GDIGMMSISA-N	429.348	1.948	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781332784	FMBFKBGRMYDXBW-OUJBWJOFSA-N	430.112	1.680	50	20	IDGD	
Cc1ncc(/C=C/C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](F)Br)C3)C2)s1	1781334258	JUXYOICTZHWKRR-JCSQBOLZSA-N	432.315	1.985	50	20	IDGD	
CC(C)(O)CC(=O)N1CCO[C@]2(CCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1	1782864660	QQNGMECRKNGDOH-KYIYGJGQSA-N	433.455	1.863	50	20	IDGD	
CCC[C@@H](NC(C)=O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)Br)C2	1783190858	UKLSADRRZRXOAL-GKDNMFGBSA-N	446.386	1.589	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc4nccnc4c3)CCO2)C1	1783534558	WEMZVBZZZVRUCG-YJYMSZOUSA-N	433.306	1.857	50	20	IDGD	
Cc1c(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](C)Br)C3)C2)nc2ccccn12	1783535060	XCKVUFUOHSSENN-BFUOFWGJSA-N	435.322	1.870	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3nc4ccc(F)cn4n3)CCO2)C1	1783535623	FVJHHNTWZBYRGO-PIGZYNQJSA-N	440.273	1.095	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H]3C[C@@]34C(=O)Nc3ccccc34)C2)C1	1783548089	XNYYESGUNWTTNM-LDHQQMMRSA-N	431.920	1.744	50	20	IDGD	
CC(C)Cc1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc1	1783935506	VMONZJJIHRJJCI-XMMPIXPASA-N	444.576	1.702	50	20	IDGD	
CCCNC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]21	1784374935	DRWWTRUFKFYRPV-XMDUPGNXSA-N	436.380	1.509	50	20	IDGD	
CCOc1ncccc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCBr)[C@H]2C1	1786404748	MHECUMXIMIUXKI-BPUTZDHNSA-N	440.338	1.859	50	20	IDGD	
CCN1CCC(C(=O)NC2(c3ccc(NC(=O)c4ccc(B(O)O)cc4)cc3)CCC2)CC1	1788145387	NUMFVVFHPDGYCV-UHFFFAOYSA-N	449.360	1.846	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3nnc(-c4ccccc4)o3)[C@H]2C1	1788664962	KIZFBBMUIYAVKT-QAETUUGQSA-N	448.907	1.584	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CC(c4ccccc4)=NN3)C[C@@H]21	1789865273	OVZFOJYNHLMZNA-CAVMOMJPSA-N	432.952	1.750	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cn3ccccc3=O)C[C@@H]21	1789866357	PUVPCJJBHXUQAT-XMDUPGNXSA-N	430.332	1.064	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(OC)nn3)C[C@@H]21	1790961280	XXQRRZXASKYKGX-XPCVCDNBSA-N	441.326	1.252	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C=C/c3cnc[nH]3)[C@H]2C1	1791506612	RIVSUKCBFFSNQG-SNXWUPKKSA-N	425.327	1.576	50	20	IDGD	
O=C(Cc1ccc2ncccc2c1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1	1796188039	WYXSUCNNIVLPFZ-KOUNCHBCSA-N	443.312	1.409	50	20	IDGD	
Cc1ccc2[nH]cc(CC(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3ccc(B(O)O)cc3)c2c1	1796188323	PLTUGZCWRZPQQJ-WKCHPHFGSA-N	445.328	1.651	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)c1ccccc1C(F)(F)F	1796188537	RRBUBOVKFSVJPJ-BJWYYQGGSA-N	446.234	1.951	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)c1cc(-c2ccccc2)on1	1796189584	FAZZZACZKXBNMG-ACDBMABISA-N	445.284	1.587	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1(c3ccccc3)CC1)C2)[C@@H](F)Br	1799342292	HXAXSIPTZXDRSU-OCVGTWLNSA-N	425.298	1.998	50	20	IDGD	
Cc1ccccc1OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Br	1799346661	VGKDSDQRWOWUGE-DLTLXFJOSA-N	429.286	1.654	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc3ccnn13)C2)[C@@H](F)Br	1799348512	JZHSGNFTUBXTMT-BAESOJJISA-N	425.258	1.228	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc([N+](=O)[O-])c(O)cc1C	1799830302	QIAMKRLFVRMNDB-DMVWFOPNSA-N	441.868	1.066	50	20	IDGD	
CN(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc[nH]1)C2)NC(=O)NCc1ccccc1	1799869545	LIFLKXRNIKNEFN-REPLKXPHSA-N	438.532	1.613	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccnc1OC)C2	1800639288	MRFVARZAYSNCDH-NEBZKDRISA-N	426.311	1.467	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c(F)ccc(O)c1F)C2	1800759852	LZBBWOSXHXEJKR-KFRQHLNQSA-N	433.249	1.657	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cn1cnc2ccccc21	1800889377	DKYQNMBRLFVMGP-VLBMKZOESA-N	439.343	1.862	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cc(F)ccc1F	1801977278	HKYZHULMSHVNMV-MMPOEDRJSA-N	431.277	1.880	50	20	IDGD	
Cc1cccc(C(=O)N2CCCC3(CCN(C(=O)c4cccc(B(O)O)c4)CC3)C2)c1F	1805073849	LGSUTTMPMUSJME-UHFFFAOYSA-N	438.308	1.973	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@@H]1c1cccnc1)c1ccc(O)nn1	1805274758	GTXATFRUDLMRNY-NILFDRSVSA-N	438.257	1.587	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)C[C@@H](N)c2cccnc2)[C@@H]1c1cccnc1	1807267653	TYABDTYQBVJRPG-HDAAZOAOSA-N	445.951	1.826	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@H]1c1cccnc1)c1cc(O)n[nH]1	1807289520	OGXVRYYLNXGASM-BPNCWPANSA-N	426.246	1.520	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H]2C[C@@]2(F)Cl)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807367037	JLTAJVOFFPJZMG-DBSRCYSRSA-N	445.687	1.006	50	20	IDGD	
Cc1cc(C(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)ncc1[N+](=O)[O-]	1808659542	LIOFBGIVOLJUKN-BMGDILEWSA-N	447.879	1.613	50	20	IDGD	
C[C@]1(C(=O)N2CC[C@H](CNC(=O)[C@@H](F)Br)[C@@H]2c2cccnc2)CCCN1	1808675495	BWKNOWKAJYWJSG-BASYENTBSA-N	427.318	1.920	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)[C@H](C)Nc2cnccn2)[C@H]1c1cccnc1	1810325450	NTAHOFGEAGBVIF-LKCYJCQHSA-N	446.939	1.632	50	20	IDGD	
CS(=O)(=O)N1CCC(C(=O)N2CCC3(CCCN(C(=O)[C@@H](F)Cl)C3)CC2)CC1	1810906534	UOIGYMMEGBMCOI-OAHLLOKOSA-N	437.965	1.424	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)c2ccnnc2O)[C@@H]1c1cccnc1	1812866449	GBVVNZXRCWRVBH-NJZAAPMLSA-N	434.294	1.680	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)c2c[nH]c(=O)cn2)[C@@H]1c1cccnc1	1812868072	YLDHQAPLHDQYOU-NORZTCDRSA-N	434.294	1.268	50	20	IDGD	
COC(=O)NCC(=O)N1CC[C@H](CNC(=O)[C@@H](C)Br)[C@H]1c1cccnc1	1812868308	YAASURNGTGIXTG-UXIGCNINSA-N	427.299	1.227	50	20	IDGD	
C[C@@H](C(=O)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1)n1cccc1	1815361997	XVJPOLXYAUPWMZ-BBRMVZONSA-N	438.318	1.111	50	20	IDGD	
Cc1cccnc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1	1815400126	RFQHAZLUMGQRBE-INIZCTEOSA-N	427.509	1.792	50	20	IDGD	
CCc1ncccc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1816162073	BWSRCKVXBCULHY-HXUWFJFHSA-N	447.304	1.667	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H]2CCC(=O)N2)n[nH]1	1817084675	IMMDGECXUCUOAS-NQBHXWOUSA-N	426.315	1.711	50	20	IDGD	
CC(C)O[C@H](C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1	1817472332	QNKGAWYPPCQQNP-RDTXWAMCSA-N	428.298	1.209	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1)c1nc(O)n2c1CCCC2	1819628030	JPESPLKUUSUJHT-TZMCWYRMSA-N	436.900	1.554	50	20	IDGD	
CCc1ccc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2cccc(B(O)O)c2)CC3)cc1	1822287445	LOCKPAYLIRDAGO-GOSISDBHSA-N	449.341	1.925	50	20	IDGD	
O=C(N[C@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1)c1ccnnc1O	1823006845	IWYFXHOQPZMDFU-QUBYGPBYSA-N	430.259	1.555	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@](C)(O)C(F)(F)F)CC2	1825993941	FVZZMSSNNVZMNM-KXEKKFMESA-N	429.848	1.622	50	20	IDGD	
CC(C)[C@H](S)C(=O)N[C@@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1	1826083945	VTHSBFDPVRQHCR-BZNIZROVSA-N	427.596	1.383	50	20	IDGD	
O=C([C@H](O)CCl)N1CCC([C@H]2CCCCN2C(=O)[C@@H]2Cc3ccccc3CN2)CC1	1827566724	XXVSFINHSJJCOD-PWRODBHTSA-N	433.980	1.920	50	20	IDGD	
Cc1nnsc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1	1827816486	IOQTYCUJUPDDJD-SFHVURJKSA-N	442.350	1.073	50	20	IDGD	
CCOC(=O)N[C@H](O)C(=O)N1CCCC[C@H]1C1CCN(C(=O)C(C)(C)CCl)CC1	1828760395	OFWJILZAPOTHHQ-JKSUJKDBSA-N	431.961	1.936	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)/C=N/N2CCCCC2)CC1	1828918457	MMVWZIFDHMNPNZ-CTNNYUBMSA-N	448.612	1.451	50	20	IDGD	
CCN1CCC(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)CC1	1830371017	VKCHPTYGAXTIHQ-NRFANRHFSA-N	429.989	1.440	50	20	IDGD	
Cc1cnc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)s1	1830535971	WANHKYKVQZXWEC-PXAZEXFGSA-N	446.367	1.553	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cn4cccnc4n3)C2)C1	1831650473	IDLHZOPMMJJVCC-FOIQADDNSA-N	435.912	1.207	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CCc4nc[nH]c4C3)C2)C1	1831657956	RTVWJBSTSJZLEA-CKJXQJPGSA-N	438.956	1.379	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(O)ccc2O)CC1	1831873871	CICKMWWYVDOFJI-IBGZPJMESA-N	446.548	1.704	50	20	IDGD	
Cc1nccn1[C@@H](C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1	1831877262	VXPKESCJVDVYJA-PXNSSMCTSA-N	446.596	1.745	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3cccnc3OC)CCO2)C1	1833003751	SCMANDWBVOSCDS-UTKZUKDTSA-N	439.940	1.497	50	20	IDGD	
C[C@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)C(=O)C3CC3)CC2)CC1	1833264432	BFQANHQCMYQEGZ-CYBMUJFWSA-N	428.371	1.568	50	20	IDGD	
N#Cc1ccc(CC(=O)N2CCC(N3CCC(NC(=O)[C@@H](O)CCl)CC3)CC2)cc1	1833306259	OUHZALZYVDPBRE-FQEVSTJZSA-N	432.952	1.272	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cc(O)nc(Cl)c3)CC2)CC1)[C@@H](O)CCl	1833308624	YAQYAMDILFTTNH-HNNXBMFYSA-N	445.347	1.226	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)COc3ccccc3F)CC2)CC1)[C@@H](O)CCl	1833312397	SJJNHGDOWBHEBP-SFHVURJKSA-N	441.931	1.376	50	20	IDGD	
CC(C)c1nc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)co1	1833346443	JYOIJCLUXKUIFP-DYVFJYSZSA-N	448.289	1.559	50	20	IDGD	
O=C([C@H](O)CCl)N1CCC(N2CCC(NC(=O)C3(C(F)(F)F)CCC3)CC2)CC1	1834643865	ZEFOHSJOYDSQBX-OAHLLOKOSA-N	439.906	1.890	50	20	IDGD	
CC(C)(C)n1cc(C(=O)N2CCC(N3CCC(NC(=O)[C@H](F)Cl)CC3)CC2)nn1	1835081993	JSIFNWXNJSSESQ-INIZCTEOSA-N	428.940	1.753	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cnn4ccncc34)CC2)CC1	1835406428	OCFWITIDKIERBR-GOSISDBHSA-N	432.956	1.932	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H](CN)c3ccccc3)CCO2)C1	1835813479	QLPPIEUAMLIUOS-PGRDOPGGSA-N	437.968	1.450	50	20	IDGD	
O=C(c1cc(O)ccc1O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836717991	NDHBAISWTKFESS-SFHVURJKSA-N	426.897	1.310	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)c3cccnc3)CC2)CC1	1837423068	GNOMWPSTXPFOEQ-UHFFFAOYSA-N	431.537	1.067	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccc4c(c3)CCO4)C2)C1	1839147712	AGNUYGIQISYZJR-PGRDOPGGSA-N	436.936	1.638	50	20	IDGD	
C[C@H](Cn1cccn1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2	1839150575	QFSMRQHXCZYFPB-MNEFBYGVSA-N	447.363	1.212	50	20	IDGD	
C=CCC(F)(F)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2	1839155246	PJQZROQNHWJALI-HOTGVXAUSA-N	429.291	1.891	50	20	IDGD	
CC(C)=NO[C@H](C)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H](C)Br)CCO2)C1	1840034419	KVBNOWRXDXOUGX-CKEIUWERSA-N	434.331	1.027	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(C)c(C)n3)C2)C1	1840151078	VXHUUTXOAIRUOT-OXQOHEQNSA-N	425.913	1.022	50	20	IDGD	
C[C@@H](Oc1cccnc1)C(=O)N1CCOC[C@@]2(CN(C(=O)C(Cl)Cl)CCO2)C1	1840190929	VXTJJPHLENKRBZ-ACJLOTCBSA-N	432.304	1.109	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)C2(c3ccc(O)cc3)CC2)C1	1841380228	AQWZCEULZLSAED-WGOQTCKBSA-N	449.511	1.761	50	20	IDGD	
N=C(N)SCC(=O)N1CCCC12CN(C(=O)[C@@H](Br)Cc1ccccc1)C2	1842865175	GNVZFQIBEBWRCG-AWEZNQCLSA-N	439.379	1.823	50	20	IDGD	
CC(C)(C)c1ccc(C(=O)N2CC3(CCCN3C(=O)c3ccc(B(O)O)cc3)C2)s1	1843011205	BXVKPDCIGFRRGT-UHFFFAOYSA-N	426.347	1.856	50	20	IDGD	
O=C(c1cc2cccc(F)c2s1)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843014036	QITMKCGPYGFLNQ-UHFFFAOYSA-N	438.289	1.851	50	20	IDGD	
O=C([C@H](F)Br)N1CC2(CCCN2C(=O)[C@@H]2ON=C(c3ccccc3)O2)C1	1844198662	WVPJPYUGYGMFRR-LRDDRELGSA-N	426.242	1.615	50	20	IDGD	
Cc1nccnc1C(=O)N1CCCC12CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1844557586	XQKWBIFJNCPZLZ-AWEZNQCLSA-N	437.928	1.734	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)c1cncnc1C)C2	1844692918	ZQMHIMJDVNQBGH-UHFFFAOYSA-N	439.428	1.749	50	20	IDGD	
CN[C@H](CC(=O)N1CC2(CCCN2C(=O)/C(C#N)=C/c2ccc(F)cc2F)C1)C(=O)O	1845870829	GTDAVEWDDLTOMJ-OEXZBZRSSA-N	432.427	1.138	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)CCCc2cccnc2)C1	1846672392	KORHRRVLWFCNPK-YZSQISJMSA-N	436.516	1.742	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CNC(=O)OC(C)(C)C	1847510953	ITLYMHMBXJDGOL-RFGFWPKPSA-N	448.358	1.247	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H](CC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](O)CCl)C1	1847564388	VCYYFUDPJIVYSC-VGWMRTNUSA-N	429.945	1.435	50	20	IDGD	
CN(CC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](F)Br)C(=O)c1ccccc1	1847730478	PCYUDQKMJSGRGK-DZKIICNBSA-N	426.286	1.651	50	20	IDGD	
O=C(COC(=O)c1ccc(I)cc1)NNC(=O)c1cccs1	10751839	WIAQOSSESRHRNP-UHFFFAOYSA-N	430.223	1.971	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(Cl)cc2)c1	16005479	XPRASXQCRCGDJB-UHFFFAOYSA-N	425.894	1.495	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)Cn1c(=O)ccn(Cc2ccccc2)c1=O	21027749	PZWHLESKTDMZPH-UHFFFAOYSA-N	442.859	1.182	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)c1ccccc1F	25166689	KDTZUVUEJHUAJC-UHFFFAOYSA-N	435.477	1.240	50	20	IDGD	
O=C(NNC(=S)NCCc1ccc(Cl)cc1Cl)N[C@@H]1CCS(=O)(=O)C1	726476313	HOCDGNINUBDCAZ-LLVKDONJSA-N	425.363	1.401	50	20	IDGD	
Cc1ccc(C(=O)N2CCC(NC(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)CC2)cc1	727606583	PXRZABOWYWCTTG-UHFFFAOYSA-N	448.487	1.220	50	20	IDGD	
CN(C)C(=O)c1cccc(C(=O)NNC(=O)c2ccc(CSc3nncn3C)cc2)c1	728511165	BIDJCLSMOLCPIF-UHFFFAOYSA-N	438.513	1.884	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccccc1F)NNC(=O)c1cccc(OC(F)F)c1	728545591	QIZRRZUJHVHDSV-UHFFFAOYSA-N	431.392	1.557	50	20	IDGD	
Cc1nc(COc2ccc(Cl)cc2)sc1C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O	729274980	IMNQUPCASNXYII-JTQLQIEISA-N	446.938	1.383	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@@H]2C(=O)NNC(=O)CCc2ccccc2O)s1	730033519	BRQAGTQGELNLMJ-OAHLLOKOSA-N	437.543	1.695	50	20	IDGD	
CCNS(=O)(=O)CCNC(=O)C(=O)Nc1ccccc1S[C@H](Cl)C(F)(F)F	731763398	OBVXJWFEOZVRJP-ZDUSSCGKSA-N	447.888	1.900	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])o1	731874867	SHBCJZWOTRIRKZ-WCQYABFASA-N	434.380	1.546	50	20	IDGD	
C#CCNC(=O)C1CCN(C(=O)NNC(=O)c2ccc(OC)c(Br)c2)CC1	732255844	OYISFGZDZOSQSC-UHFFFAOYSA-N	437.294	1.274	50	20	IDGD	
COc1cc(-n2cnnn2)c(Cl)cc1C(=O)NNc1nc2ccccc2c(=O)n1C	733260582	INFJRSWFDHHVHQ-UHFFFAOYSA-N	426.824	1.328	50	20	IDGD	
CCN1CCC[C@H]1CN1C[C@@H](C(=O)NNC(=O)c2cc(-c3ccc(C)cc3)[nH]n2)CC1=O	733358592	BHXGOXFTZJPLPX-ROUUACIJSA-N	438.532	1.479	50	20	IDGD	
C[C@H]1CN(c2ccc(C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)cn2)C[C@@H](C)O1	734242226	XUAOCWCCXCWSLJ-OKILXGFUSA-N	436.513	1.164	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H]2CCCN(c3ccccc3)C2)c1	734676507	QFTVWQFMJKYDPU-QGZVFWFLSA-N	445.545	1.550	50	20	IDGD	
CCOCCCN1CC[C@@H](NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)[C@@H](C)C1	734682531	BXDIBUMYSFFOOB-MAUKXSAKSA-N	444.536	1.015	50	20	IDGD	
CC(=O)Nc1cc(C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)ccc1C	735117553	WXUSKOAPDYGIRC-UHFFFAOYSA-N	446.533	1.041	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NC[C@@H](O)C1CCOCC1	736650548	WLBXEANXTWNTNX-IAQYHMDHSA-N	430.299	1.334	50	20	IDGD	
Cc1nc(O)nc(O)c1CCC(=O)NN=c1cc(C(F)(F)F)[nH]c(-c2ccncc2)n1	736707596	FHXLTZOVHJIFJD-UHFFFAOYSA-N	435.366	1.565	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CC[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)C2)n1	740879005	CUZFJFPIZORYNJ-GXTWGEPZSA-N	425.555	1.377	50	20	IDGD	
Cc1cc(C)nc(-n2[nH]c(C(=O)NNC(=O)c3cc4c(s3)CCCCC4)cc2=O)n1	741746844	MFOOTNMYKNMYAD-UHFFFAOYSA-N	426.502	1.978	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)[C@H](c1cccc(F)c1)N1CCOCC1	742033742	BOKNSMKGNHFXHI-QFIPXVFZSA-N	439.491	1.959	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cnc(O)c(Br)c2)cc(OC)c1OC	742033973	WPZGAENYYRSOKX-UHFFFAOYSA-N	426.223	1.650	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cc(Cl)ccc2O)cc(NS(C)(=O)=O)c1OC	743295374	IFEMVNDHRGKVAQ-UHFFFAOYSA-N	443.865	1.509	50	20	IDGD	
O=C(C[C@@H]1CN(Cc2ccccc2)CCO1)NNc1ccc(S(=O)(=O)NC2CC2)cc1	743327632	GZXXCJXBOZERHE-HXUWFJFHSA-N	444.557	1.862	50	20	IDGD	
CCOc1cc([N+](=O)[O-])c(C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)cc1OC	744520247	FTYGAIBBDGEUFI-UHFFFAOYSA-N	442.384	1.492	50	20	IDGD	
Cc1ccc([N+](=O)[O-])c(OCCC(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)c1	744722672	ONKRJJZSLHNNKD-UHFFFAOYSA-N	426.385	1.548	50	20	IDGD	
COc1cc(C=NNC(=O)C(=O)NC(C)C)ccc1OS(=O)(=O)c1ccc(C)cc1	744818480	YFMOGQJSRVTNDU-UHFFFAOYSA-N	433.486	1.746	50	20	IDGD	
O=C(NNC(=O)N1CCOCC1)c1ccc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1	745993065	VWAHRKJLMPSZSK-UHFFFAOYSA-N	449.445	1.082	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NN=C(Cc1ccccc1)[C@@H](C)NC(=O)OC(C)(C)C	746576800	RAKGKLROUNRPIJ-KGLIPLIRSA-N	426.539	1.552	50	20	IDGD	
Cn1ccnc(NNC(=O)c2ccc(S(=O)(=O)Nc3ccc(Cl)cc3)cc2)c1=O	747937550	IBWSWOQLUGCDPU-UHFFFAOYSA-N	433.877	1.991	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)NCCCN1CCN(c2ccncc2)CC1	748342732	BQYMHHYXNZOMDO-UHFFFAOYSA-N	426.521	1.175	50	20	IDGD	
COc1ccccc1CC(=O)N1CCC(NC(=O)NNC(=O)c2ccccc2O)CC1	749019072	UTLHZCATTFAEJY-UHFFFAOYSA-N	426.473	1.579	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CNC(=O)CCc2ccc(C)cc2)cc(OC)c1OC	749161253	WCZLCLSQMBMBRF-UHFFFAOYSA-N	429.473	1.531	50	20	IDGD	
CN(C)C(=O)CN1C(=O)C(=NNC(=O)c2ccccn2)c2cc(Br)ccc21	750912209	LMWPHENRIZUYMH-UHFFFAOYSA-N	430.262	1.413	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)c1cnn(-c2ccccc2F)c1-n1cccc1	751202836	XHCREVUXSRRQDG-UHFFFAOYSA-N	436.403	1.586	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)c2cccc(CN3CCS(=O)(=O)CC3)c2)c1	751296570	JSENFNSQLOJQPJ-UHFFFAOYSA-N	430.530	1.058	50	20	IDGD	
C[C@@H](NC(=S)NNC(=O)c1ccc(S(=O)(=O)N(C)C)c(Br)c1)C1CC1	751616369	CCYHKUITSGFSOE-SECBINFHSA-N	449.396	1.607	50	20	IDGD	
CS(=O)(=O)N1CCC[C@@H]1CNC(=O)NNC(=O)COc1ccccc1-c1ccccc1	753690025	SHLHVCPIUQDUOR-QGZVFWFLSA-N	446.529	1.487	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)N[C@@H]2CCN(Cc3ccc(C#N)cc3)C2=O)c1	753722827	LMBXMUUAQDUSAC-HXUWFJFHSA-N	435.484	1.685	50	20	IDGD	
Cc1ccc(-n2cnc3c2CCN(CC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)C3)cc1	753794883	UEKVIFKNZCMBQM-UHFFFAOYSA-N	434.456	1.908	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)[C@@H](C)n1nnnc1C(C)(C)C	754975245	NXCGQNKSNFMPLQ-SNVBAGLBSA-N	438.872	1.198	50	20	IDGD	
O=C(COC(=O)c1cccc(I)c1O)NNC(=O)c1ccccc1	755149368	SIAGCHMOZWOVPR-UHFFFAOYSA-N	440.193	1.615	50	20	IDGD	
CC[C@@H](C)C(=O)NNC(=O)Nc1ccc(S(=O)(=O)N2CCC[C@H](C(=O)OC)C2)cc1	755559294	SJBBNOFIWPCXCR-KGLIPLIRSA-N	440.522	1.459	50	20	IDGD	
CCc1c(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)cnn1CCC(C)C	756199406	SBKKUMIEMQSYDK-UHFFFAOYSA-N	425.493	1.468	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)N[C@H]1CCN(c2c(F)cccc2F)C1=O	756213784	YOZINRONELLDAF-HNNXBMFYSA-N	448.426	1.878	50	20	IDGD	
CN(C1CC1)S(=O)(=O)c1ccc(NC(=O)NNC(=O)COCc2ccccc2)cc1	756400102	BGFWZCBSYKKJRM-UHFFFAOYSA-N	432.502	1.839	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)Nc3ccc(C)c(S(N)(=O)=O)c3)n[nH]2)cc1	756638182	NHXRYILJYIMBRE-UHFFFAOYSA-N	428.474	1.807	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)c1cncc(I)c1	756866159	XMXBKATUVYJNEP-UHFFFAOYSA-N	441.225	1.925	50	20	IDGD	
COCCN(CCOC)S(=O)(=O)c1ccc(C(=O)NN=c2cc[nH]cc2Cl)cc1	757404674	BSWZGPDQWAEVSR-UHFFFAOYSA-N	442.925	1.197	50	20	IDGD	
COC(=O)c1cc(NC(=O)NNC(=O)COc2ccc(F)cc2)cc(S(C)(=O)=O)c1	757673176	ADQMZRFAZHFROA-UHFFFAOYSA-N	439.421	1.248	50	20	IDGD	
COCCOc1c(Cl)cc(NC(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)cc1Cl	757890735	UDOKYCQXCSVDJN-QMMMGPOBSA-N	443.309	1.109	50	20	IDGD	
CN(NC(=O)[C@@H]1CCCN(C(=O)C2CC2)C1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758787744	VLGGQDZNMKLIOX-MRXNPFEDSA-N	437.541	1.271	50	20	IDGD	
Cc1cc(-c2noc([C@@H](C)NC(=O)NNC(=O)CNC(=O)c3ccco3)n2)ccc1F	760748282	CGISABPFLRMMJR-LLVKDONJSA-N	430.396	1.599	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)c2cc(I)ccc2F)C[C@@H](C)O1	762442625	HTDDIEXIAPHPAT-GHMZBOCLSA-N	449.264	1.691	50	20	IDGD	
O=C(CCc1ccccc1O)NNS(=O)(=O)c1cc(Br)cc(C(=O)O)c1	762474297	DQOMEUIFNPIKCJ-UHFFFAOYSA-N	443.275	1.795	50	20	IDGD	
CC(C)C[C@H](C(=O)NNc1nccc(N2CCOCC2)n1)N1C(=O)[C@@H]2CC=CC[C@H]2C1=O	762869311	VMBPPUKDVZWBQL-BRWVUGGUSA-N	442.520	1.122	50	20	IDGD	
COC(=O)c1cc(F)ccc1NC(=O)C(=O)NNC(=O)c1cc2ccccc2cc1O	763528740	YSTPQNMIOMJTMA-UHFFFAOYSA-N	425.372	1.871	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)C(=O)Nc1ccc2c(c1)COC2	763531825	RXZFGXGNAQRYJZ-UHFFFAOYSA-N	437.500	1.015	50	20	IDGD	
N#Cc1cccc(Oc2ccc(NC(=O)C(=O)NNC(=O)c3ccc4c(c3)OCO4)cn2)c1	763548604	NPSRSHCHNKRDLF-UHFFFAOYSA-N	445.391	1.874	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccnn2Cc2ccc(C)s2)cc1OC	763551911	TZGQHPRDQOEXFT-UHFFFAOYSA-N	443.485	1.718	50	20	IDGD	
O=C(NNC(=O)c1ccccc1F)C(=O)Nc1cccc(S(=O)(=O)N2CCCCC2)c1	763555366	CYYLLKWBCFCAOT-UHFFFAOYSA-N	448.476	1.400	50	20	IDGD	
O=C(CC[C@H]1NC(=O)NC1=O)NNC(=O)c1cn(-c2ccccc2)nc1-c1ccccc1	763607562	FLXFOPVPJWEGKG-QGZVFWFLSA-N	432.440	1.289	50	20	IDGD	
Cn1nc2c(c1NC(=O)C(=O)NNC(=O)COc1ccccc1-c1ccccc1)CCC2	763644199	PAHNEWUMKIEBHE-UHFFFAOYSA-N	433.468	1.741	50	20	IDGD	
Cc1cccc(Cn2nccc2NC(=O)C(=O)NNC(=O)COc2ccccc2F)c1	763681725	HVROOZBTFPNSON-UHFFFAOYSA-N	425.420	1.544	50	20	IDGD	
Cc1nc(C)n(-c2ccccc2NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)n1	763686503	MSAKRMYOLABNJC-UHFFFAOYSA-N	442.863	1.702	50	20	IDGD	
O=C(CSc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1cccc(N2CCNC2=O)c1	763734632	MKJQOBWHBHVZCK-UHFFFAOYSA-N	447.904	1.748	50	20	IDGD	
CCNC(=O)N1CCc2ccc(NC(=O)C(=O)NNC(=O)c3cccc(Cl)c3)cc21	763748172	OAMUSCLLHPGJMF-UHFFFAOYSA-N	429.864	1.832	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2ccc(-n3cccn3)c(Cl)c2)c1	763774839	HNSUELPSCUHZKL-UHFFFAOYSA-N	443.847	1.943	50	20	IDGD	
CCOC(=O)C(C)(C)n1cc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCC3)cn1	763783423	NXNHAGWQKMZUBT-UHFFFAOYSA-N	433.490	1.131	50	20	IDGD	
CCCn1ccc2ccc(NC(=O)C(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)cc21	763791571	VXYBBEIDVZMNRS-UHFFFAOYSA-N	446.467	1.698	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)c(F)cc1F	763863638	ATEZXQWVSNZTNN-SECBINFHSA-N	439.346	1.444	50	20	IDGD	
O=C(CCSc1ccc(F)cc1)NNC(=O)C(=O)Nc1cccc(-n2ccnn2)c1	763894638	DMJYJLMMOMYNSW-UHFFFAOYSA-N	428.449	1.675	50	20	IDGD	
CCS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)C2=S=C3CCCCCC3=C2)cc1	763967799	IIXBDKLEZFYADV-UHFFFAOYSA-N	449.554	1.548	50	20	IDGD	
C[C@H](c1ccccc1)n1ccc(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)n1	763994553	DZKAWKYEAZGGSF-LLVKDONJSA-N	445.277	1.983	50	20	IDGD	
Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)C(=O)NNC(=O)c1cnccn1	764024038	HNWHNOZIZDYOIB-UHFFFAOYSA-N	430.424	1.635	50	20	IDGD	
CS(=O)(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)c2cccc(C(F)(F)F)c2)c1	764041227	YFHCKWWKGYWUOL-UHFFFAOYSA-N	443.403	1.650	50	20	IDGD	
O=C(CC1CCCC1)NNC(=O)C(=O)Nc1ccc2nc(N3CCOCC3)sc2c1	764185979	YOCHHANDOLADFY-UHFFFAOYSA-N	431.518	1.799	50	20	IDGD	
Cc1cccc(-n2c(NNC(=O)[C@H]3CN4CCCN3CC4)nc3ccccc3c2=O)c1C	764237789	ORNZFNNJKLDQKX-OAQYLSRUSA-N	432.528	1.836	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1ccc(-c2cn3ccccc3n2)cc1	764274714	BFSWVVVJUAFZOR-UHFFFAOYSA-N	445.435	1.872	50	20	IDGD	
CC(C)Cc1noc(-c2cc(Cl)ccc2NC(=O)C(=O)NNC(=O)Cc2cc[nH]n2)n1	764296976	KVFFLLBTJZOAOE-UHFFFAOYSA-N	445.867	1.640	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)C(=O)Nc1cc(C)n(CCCOc2ccc(F)cc2)n1	764298736	ZOAQNXJUUNSCGI-UHFFFAOYSA-N	443.439	1.231	50	20	IDGD	
O=C(Cn1nc(-c2ccccc2)oc1=O)NNc1c(F)cc(C(=O)NC2CC2)cc1F	764335287	POYMIRYJYLFSPF-UHFFFAOYSA-N	429.383	1.817	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)cc1C(=O)OC	764350121	YHMXRVQJMBXWQS-UHFFFAOYSA-N	449.803	1.019	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cnn1-c1ccccc1F	764351387	RDFCEDRSHBLNIW-UHFFFAOYSA-N	447.430	1.905	50	20	IDGD	
O=C(NNC(=O)C(F)(F)Oc1ccccc1)C(=O)Nc1ccnn1Cc1ccccn1	764370048	MCZZPZWDQYHUMY-UHFFFAOYSA-N	430.371	1.084	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCCC(=O)NNC(=O)CSc2ccccc2O)cc1C	765251664	JCKXVEUBSHFSIK-UHFFFAOYSA-N	437.543	1.617	50	20	IDGD	
O=C(CCCOc1ccc(F)cc1)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765739280	RUTUKDQNXVSBEF-UHFFFAOYSA-N	442.491	1.590	50	20	IDGD	
Cc1cc(N(C)C)cc(C)c1NC(=O)C(=O)NNC(=O)COc1ccccc1[N+](=O)[O-]	766258533	GVDRHPAGUSENGR-UHFFFAOYSA-N	429.433	1.443	50	20	IDGD	
O=C(Cc1cccc(OCCCOc2ccccc2)c1)NNC(=O)[C@H]1CCS(=O)(=O)C1	766310811	MFIWKEPRZYFOJH-SFHVURJKSA-N	446.525	1.659	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2cnn(-c3ccccc3)c2C(F)(F)F)n1	769264203	CCFJIYLCVWVVLO-UHFFFAOYSA-N	449.393	1.491	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1c(C)cnn1Cc1ccccc1F	769264213	CFYUGPJITOOERM-UHFFFAOYSA-N	425.420	1.787	50	20	IDGD	
Cc1cc2c(N3CCC[C@H]3C(=O)NNC(=O)[C@@H]3COc4ccccc4O3)ncnc2s1	770446090	FJOASENRBHMUBQ-YOEHRIQHSA-N	439.497	1.956	50	20	IDGD	
Cc1cc(C(=O)N2CCC[C@@H]2C(=O)NNc2nc(O)c3cnn(C)c3n2)ccc1[N+](=O)[O-]	770979093	CLRYTAYOJGKOLT-CQSZACIVSA-N	440.420	1.033	50	20	IDGD	
COc1ccccc1[C@@]1(C)NC(=O)N(CC(=O)NNC(=O)c2cccc3ncccc23)C1=O	771265891	HZXZKFZRTDYHBB-HSZRJFAPSA-N	447.451	1.472	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1ccc(S(=O)(=O)N2CCC(C)CC2)cc1	771940404	RMYJQDZSWCPQES-CQSZACIVSA-N	425.507	1.210	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)c1ccc2c(c1)C[C@@H](C)N2S(C)(=O)=O	771967894	ITMFHCZSZRYSSB-OLZOCXBDSA-N	425.507	1.136	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@H]12	772990154	KQGLFKGHSBNNQV-ZUFFMMDNSA-N	440.953	1.981	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(S(=O)(=O)C(F)F)cc2)cc1F	773888966	NZPCLXZFBPNGRE-UHFFFAOYSA-N	429.376	1.530	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)NC[C@@H]1COC2(CCCC2)O1	774309190	NPSKOEFIXXBBAX-LJQANCHMSA-N	431.537	1.215	50	20	IDGD	
COC(=O)CC(C)(C)CC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	775757597	INVDTSWZNFYDEV-UHFFFAOYSA-N	425.507	1.212	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)c2cnc3sc(C)cn3c2=O)cc1C	775896800	PXYJMQKTOGOSCB-UHFFFAOYSA-N	434.499	1.615	50	20	IDGD	
O=C(COC(=O)[C@@H]1CCc2c(Cl)cccc21)NNC(=O)[C@@H]1COc2ccccc2O1	775932103	POUQPVZIQYCZBA-KDOFPFPSSA-N	430.844	1.900	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)N[C@H](C)CN(C)Cc2ccccc2)nc1	776080563	KWIFRMDBMNGCFD-MRXNPFEDSA-N	434.566	1.915	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)[C@](N)(c2ccccc2OC)C(F)(F)F)c1	776102428	LZTMMKKKWJBDIQ-GOSISDBHSA-N	427.379	1.890	50	20	IDGD	
CCOC(=O)N1CCC[C@H]([C@H](C)NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)C1	777266145	NWODYCHQJZMUDP-KBPBESRZSA-N	444.492	1.135	50	20	IDGD	
CCOc1ccc(NS(=O)(=O)c2cc(C(=O)NNC(=O)CO)ccc2Cl)cc1	777781931	SOCGFQUXAVPYTF-UHFFFAOYSA-N	427.866	1.293	50	20	IDGD	
COC[C@@H](C)n1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc3ccccc3c2)n1	778707191	HVTSULUCTCTNFM-HUUCEWRRSA-N	439.472	1.797	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CSc2n[nH]c3nc4ccccc4n23)cc1OC	779335650	HFUJOHBLVRKMNJ-UHFFFAOYSA-N	426.458	1.781	50	20	IDGD	
O=C(NNC(=O)c1ccc(-c2ccccc2OC(F)(F)F)o1)N[C@H]1CCS(=O)(=O)C1	780460735	WCZYLZKMFCUTMI-JTQLQIEISA-N	447.391	1.976	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)[C@@H]1CCCN1C(=O)c1ccccc1O	781011958	BHSKFYHHPAMRPX-INIZCTEOSA-N	444.875	1.114	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cnn(C)c3C(F)(F)F)n[nH]2)cc1	782118730	ZQDKAZAGPLMTJC-UHFFFAOYSA-N	435.366	1.537	50	20	IDGD	
CCN(CC)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(O)cc2)cc1Cl	782832642	QNQYSVWLKYNTEU-UHFFFAOYSA-N	432.864	1.927	50	20	IDGD	
CNC(=O)[C@H]1CN(C(=O)C(=O)NNc2ccc(Br)cc2)c2ccccc2O1	783005659	BRHUJJCFEZFFQG-OAHLLOKOSA-N	433.262	1.432	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccn(-c3ccccc3)n2)nc1	783263101	HOCZFWAZKYWUIN-UHFFFAOYSA-N	443.489	1.036	50	20	IDGD	
O=C(NNc1ccc(F)cc1F)C(=O)N1C[C@H](C(=O)N2CCOCC2)Oc2ccccc21	783347793	YJOZZLXTULXJRA-GOSISDBHSA-N	446.410	1.061	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNc2ccc(-n3cccn3)nn2)sc(C)c1C	783435944	DFCQRAFYIDDFIA-UHFFFAOYSA-N	429.462	1.599	50	20	IDGD	
O=C(NNc1ccc([N+](=O)[O-])cc1Cl)C(=O)Nc1ccc(C(=O)N2CCOCC2)cc1	784380548	WUBANNNMBKXPQX-UHFFFAOYSA-N	447.835	1.802	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ncccc2Cl)cc1S(=O)(=O)NC1CC1	784814718	IYEQIHIKIJTVPF-UHFFFAOYSA-N	439.881	1.266	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ccnc(Br)c2)cc1-n1nnnc1C	784837471	UKZLRTBLKYPLOS-UHFFFAOYSA-N	447.253	1.219	50	20	IDGD	
COc1cccc(NNC(=O)C(=O)Nc2cccc(S(=O)(=O)NC(C)(C)C)c2C)n1	784848401	QHNUIRHJNCZMOI-UHFFFAOYSA-N	435.506	1.557	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NN[C@]2(C)CCS(=O)(=O)C2)c(OCc2ccccc2)c1	785991907	HLACDTQHYHWYQA-OAQYLSRUSA-N	447.513	1.411	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CN2CCCN(c3nnc(C(F)(F)F)s3)CC2)cc1	786445223	PEQCEJQPNNOPRG-UHFFFAOYSA-N	442.467	1.839	50	20	IDGD	
O=C(CCC(=O)Nc1ccc2nc(O)[nH]c2n1)NNC(=O)Cc1ccc2ccccc2c1	787879407	SDHQBVDUNLUBAU-UHFFFAOYSA-N	432.440	1.926	50	20	IDGD	
COc1cc(Cl)c(S(=O)(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)cc1OC	790340949	ORGHZZLTNHFDFL-UHFFFAOYSA-N	441.893	1.922	50	20	IDGD	
O=C(NNc1cccc(F)c1[N+](=O)[O-])c1ccc(F)c(S(=O)(=O)Cc2ncon2)c1	791147568	DWIAXKMINDAVEV-UHFFFAOYSA-N	439.356	1.987	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2cc(Br)ccc2O1)c1nnc(O)c2ccccc12	792015925	IGUVXAQEMXYGQZ-AWEZNQCLSA-N	429.230	1.863	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NC[C@H]2CCN(Cc3ccccc3)C2)nc1	792228817	FONFNLLMZCJFOG-GOSISDBHSA-N	446.577	1.917	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(NC(=O)C(=O)NNc2nc3ccccn3n2)ccc1C	792394913	RWZADWCGJTZNMX-UHFFFAOYSA-N	445.505	1.150	50	20	IDGD	
CCS(=O)(=O)c1ccc([C@@H](C)NCC(=O)NNC(=O)c2ccc(OC)c(OC)c2)cc1	792949475	OAIIVDGIBVWEMG-CQSZACIVSA-N	449.529	1.609	50	20	IDGD	
COc1c(NC(=O)C(=O)NNc2cccc(C(F)(F)F)n2)cc(Cl)cc1C(N)=O	793049735	RUZNHZVJLFMGIO-UHFFFAOYSA-N	431.758	1.943	50	20	IDGD	
O=C(NNS(=O)(=O)c1c(Cl)cc(Cl)cc1[N+](=O)[O-])[C@H]1CCc2nncn2C1	793450444	MHEUNIZVYSDNEG-ZETCQYMHSA-N	435.249	1.065	50	20	IDGD	
CCC(=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O)c1ccc(OC(F)(F)F)cc1	794886230	GLRSHRAPWBLQJL-UHFFFAOYSA-N	445.423	1.400	50	20	IDGD	
C[C@H](Oc1ccc(C=NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cc1)C(=O)O	794920839	VMMQKLMCTJAHNV-KRWDZBQOSA-N	438.484	1.447	50	20	IDGD	
Cc1cnc(COCC(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)o1	794961485	VHXURBMIOSJCDZ-UHFFFAOYSA-N	447.455	1.663	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNS(=O)(=O)c1cncc(Br)c1	795342740	AZHLPHPPSNNGKQ-UHFFFAOYSA-N	447.698	1.123	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2C[C@H](c3ccccc3)[C@H]3COCC[C@@H]32)cc1OC	796357074	BHHDKIXHRKMHBM-AQNXPRMDSA-N	439.512	1.969	50	20	IDGD	
CC(C)(C(=O)NNC(=O)C(=O)Nc1ccc(F)c(N2CCOC2=O)c1)c1ccccc1	797007017	MPQLLHLYKLEPEU-UHFFFAOYSA-N	428.420	1.846	50	20	IDGD	
COC(=O)Cn1ncc(NC(=O)C(=O)NNc2nc3ccc(OC)cc3cc2C)c1C	797099107	QEKDJYRBQHYKOV-UHFFFAOYSA-N	426.433	1.312	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NN=C3CCC34CCOCC4)CC2)cc1	799882689	AKAZKGCOCWVRKX-UHFFFAOYSA-N	434.562	1.364	50	20	IDGD	
COc1cccc(/C=C(/C(=O)NNC(=O)C(=O)Nc2ccc(C)cc2)n2nnnc2C)c1	801107167	ONPFJLZCYDLMDG-PDGQHHTCSA-N	435.444	1.083	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)[C@@](C)(O)CN2C(=O)C(C)(C)c3ccccc32)cc1	802121331	ZCFVZZQAVSQXNL-QHCPKHFHSA-N	439.516	1.981	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)N[C@@H]1CCCN(C(=O)Cc2ccccc2)C1	802474648	OHVDNKSLMUVTBS-QGZVFWFLSA-N	425.445	1.773	50	20	IDGD	
CCN(C)C(=O)OC[C@H]1CCCCN1CC(=O)NNC(=O)c1ccc(OC)c(OC)c1	805762021	CINGATABMYHOED-MRXNPFEDSA-N	436.509	1.408	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cnc(C3CCCC3)nc2N)cc1	806343655	LYJVTNIYPJQCHH-UHFFFAOYSA-N	446.533	1.107	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)C(=O)Nc2cc(F)c(N3CCOCC3)cc2F)c1	806973521	FBFYCXCFQCOLJO-UHFFFAOYSA-N	447.442	1.267	50	20	IDGD	
Cc1nn(-c2ccccn2)c2nc(C3CC3)cc(C(=O)NNC(=O)N3CCN(C)CC3)c12	807379430	ZPCKXGQHYVLDNZ-UHFFFAOYSA-N	434.504	1.603	50	20	IDGD	
O=C(NNC(=O)c1ccccn1)C(=O)Nc1cnn(-c2ccc(F)cc2)c1C(F)(F)F	810384473	CPVVTZRPTZHXLX-UHFFFAOYSA-N	436.325	1.825	50	20	IDGD	
CC(C)Nc1ccc(S(=O)(=O)NCC(=O)NNc2ccc(C#N)cc2)cc1[N+](=O)[O-]	810681501	RHNFEFFLALCQSU-UHFFFAOYSA-N	432.462	1.708	50	20	IDGD	
COC[C@@]1(CNC(=O)NNC(=O)c2ccc(OC)c(OC)c2)OCCc2ccccc21	811853558	DTHKPNZIHAXJNO-JOCHJYFZSA-N	429.473	1.762	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cc(CN4CCCC4)on3)CC2)cc1	812533306	AJJCGDINPDZXON-UHFFFAOYSA-N	440.548	1.158	50	20	IDGD	
O=C(Cn1cc(Cl)cn1)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	813367029	UAFWLXBFSTYZHP-UHFFFAOYSA-N	436.859	1.756	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNC(=O)C(=O)Nc1ccc([C@@H]2CCOC2)cc1	815630593	OUQBONLZDUPTIQ-QGZVFWFLSA-N	440.456	1.203	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)c1cccn(Cc2ccccc2)c1=O	817052821	RJJXUGSBAGVELH-UHFFFAOYSA-N	426.498	1.904	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	843446204	CELSNILRFZPUDY-PXAZEXFGSA-N	434.832	1.638	50	20	IDGD	
COc1ccc(C(=O)NNc2nc(C)cc(C)n2)cc1S(=O)(=O)NCc1ccccn1	849366819	SHFBAJQHBCEOQJ-UHFFFAOYSA-N	442.501	1.732	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)c1ccco1)N(S(C)(=O)=O)CC2	913161092	FFRRXWPPLRPENU-CQSZACIVSA-N	437.474	1.007	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)NCc2cccc(S(=O)(=O)NC(C)C)c2)c1	913625765	GIZQFRBBAXJSJA-UHFFFAOYSA-N	434.518	1.591	50	20	IDGD	
CCNC(=O)COc1ccc(C=NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1OC	916316617	YMPBQMNRKNLEJX-UHFFFAOYSA-N	437.456	1.221	50	20	IDGD	
O=C(NCCN1CCN(c2ccc(F)cc2)CC1)NNC(=O)[C@@H]1COc2ccccc2O1	916513990	ZAEXZRYWRXGJMK-FQEVSTJZSA-N	443.479	1.118	50	20	IDGD	
COc1ccc2c(c1)C(=NNC(=O)CN1CCN(Cc3ccccc3Cl)CC1)C(=O)N2	916663496	DHBJCJRUFJEDLP-UHFFFAOYSA-N	441.919	1.939	50	20	IDGD	
Cc1ccc(C(=O)N2CCN(CC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)CC2)s1	917837379	PKRDFFJIFCFYHG-UHFFFAOYSA-N	431.474	1.184	50	20	IDGD	
CCc1ccc(C(=O)Nc2sccc2C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)cc1	918208681	HTPVZNMJDWAERH-AWEZNQCLSA-N	435.527	1.759	50	20	IDGD	
CCCOc1ccccc1Oc1ncccc1CNC(=O)NNC(=O)C(=O)NC1CC1	918229295	YQLYGTPDGGCCEW-UHFFFAOYSA-N	427.461	1.772	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=O)Cc2ccccc2OC)ccc1OC	919820419	ZWVBRBNJLSKEJL-UHFFFAOYSA-N	449.529	1.738	50	20	IDGD	
CC(C)CNS(=O)(=O)c1ccc(Br)c(C(=O)NNC(=O)NC2CC2)c1	920766490	HICJBFYIKKBZQB-UHFFFAOYSA-N	433.328	1.490	50	20	IDGD	
Cc1nc2c(c(O)nn2C)c(C)c1CCC(=O)NNC(=O)c1cncn1-c1ccccc1	1116179611	YXEQEKPZBAJKQP-UHFFFAOYSA-N	433.472	1.870	50	20	IDGD	
CC(=NNC(=O)c1cncn1-c1ccccc1)c1ccc(S(=O)(=O)CC(N)=O)cc1	1261236188	YHKUCSHKXQDDKS-UHFFFAOYSA-N	425.470	1.285	50	20	IDGD	
O=C(CC[C@@H]1NC(=O)N(c2ccc(Cl)cc2)C1=O)NNC(=O)c1n[nH]c2c1CCCC2	1318326989	MPLGYHMMROTIIB-HNNXBMFYSA-N	444.879	1.608	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc(F)c(Br)cc1F)c1n[nH]c2c1CCCC2	1323025061	UPBCELXLCXAYOD-UHFFFAOYSA-N	435.250	1.953	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2)c1ccc2nccnc2c1	1778679071	MAQLWQWNZVCEEI-DBXWQHBBSA-N	432.908	1.357	50	20	IDGD	
COc1nccnc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CO[Si](C)(C)C)C1	1779540352	GEZKQFQVKDCRLN-FOIQADDNSA-N	436.585	1.464	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(OC)n(C)n3)C2)C1	1780436340	PCQGOEKALZUABZ-SJCJKPOMSA-N	429.315	1.046	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C=C/c1cnccn1)C2)[C@H](F)Br	1780776599	ACJCNUPDCNFBPF-UVHFPMRFSA-N	441.301	1.694	50	20	IDGD	
Cc1nccn1[C@@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Br)C1	1780777298	QNSYWHIBQGXUKZ-KDQZPGIASA-N	445.333	1.957	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1CC(=O)N(Cc3ccccc3)C1)CCO2	1781210959	FEUVPLLJHFLGAM-MSYCTHLASA-N	447.963	1.882	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc([N+](=O)[O-])[nH]1)C2	1782174061	ZOVJQDZTMUXFRR-RVZJWNSFSA-N	428.873	1.304	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@@]2(C1)CN(C(=O)c1cncnc1)CCO2	1782863642	GBYWDWVQHDUKPY-QESPPMFYSA-N	439.422	1.805	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cnc(OC)cn3)CCO2)C1	1783342667	DBWJAYFEGFDSJT-SJKOYZFVSA-N	427.299	1.102	50	20	IDGD	
CC(C)(C)OC(=O)NC12CC(C(=O)N3CC[C@]4(CN(C(=O)[C@H](F)Cl)CCO4)C3)(C1)C2	1783437020	QMOZZNAJWUBZTQ-MIQYMNNUSA-N	445.919	1.798	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](C)Br)C3)C2)n1	1783532988	VLKWEESYTZKNLM-XIKOKIGWSA-N	439.310	1.267	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc4c(n3)OCCO4)CCO2)C1	1783534168	FWDZGLUIHYCKHN-SGTLLEGYSA-N	440.294	1.080	50	20	IDGD	
COC(=O)C12CC(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)C(C)(C)CCl)[C@H]4C3)(C1)C2	1783852895	STUYAYGJCQAWRW-DYDXAHRQSA-N	426.941	1.574	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cnc(-c4ccccn4)nc3)CCO2)C1	1783873179	LWSFRTUBHZNKHE-IIBYNOLFSA-N	445.907	1.236	50	20	IDGD	
Cc1nc(N)sc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]2C1	1783968169	QZERIINKWMZMJN-BQUFFADESA-N	445.383	1.658	50	20	IDGD	
COc1ccc2c(CC(=O)N3CC[C@H]4CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]4C3)c[nH]c2c1	1784083585	CMHLWRBYXAISDT-KGUHOSCRSA-N	449.935	1.298	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4c(n3)OCCO4)[C@H]2C1	1787382732	CYAIIHAERRPZMC-MPGHIAIKSA-N	449.580	1.298	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=N/O[C@H]3CCCCO3)C[C@@H]21	1788764268	IXKFAOQVDSYAOL-IQHHBFBMSA-N	441.601	1.347	50	20	IDGD	
COC(=O)[C@@H]1CC[C@H](C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]3C2)C1	1789921160	ADRUUHHAIPBTKR-JLZCTACVSA-N	449.317	1.246	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(F)nc3F)C[C@@H]21	1791054321	AGWUQKHUVPXZFW-UKJIMTQDSA-N	432.265	1.737	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)Nc3nccs3)C[C@@H]21	1791254412	MIGLSYVHDPIUCI-FQKPHLNHSA-N	430.958	1.177	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCOc1ccc(F)cc1	1792815071	PBEPAWBHXUQEAQ-BCDXTJNWSA-N	434.512	1.606	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc(F)cn1)C2	1792867481	CHLNFYKGQWHWFA-JRATXPSKSA-N	428.302	1.384	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnccc1N(C)C)C2	1792870791	UVRDGNAPCOUUCT-ZJOBFFGXSA-N	439.354	1.382	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1nc(Cl)ccc1F	1794234821	SIRXINRVLDXXMS-ORXSELOVSA-N	434.693	1.861	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cncn1-c1ccncc1	1794462947	BDYLBDBJZHBREW-HIRMHNASSA-N	431.924	1.878	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(F)cnc1Cl)C2	1795115888	RFCMZKZIIMMYNY-WDAIWFPHSA-N	434.693	1.862	50	20	IDGD	
O=C(COc1cccc(Cl)c1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1	1796185699	IEZLHRKSLMXJGP-REPLKXPHSA-N	442.708	1.351	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Cl)C1	1796367752	SUKMXDOTMRGDGW-QMHWVQJVSA-N	447.935	1.758	50	20	IDGD	
CN(CCCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Cl)C(=O)OC(C)(C)C	1796370621	JSMMEIHPYDTICI-OCVGTWLNSA-N	435.924	1.758	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@](C)(O)C[C@H]1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](F)Cl	1796810227	KHFFJSZLIJKPEU-HKQPUQOZSA-N	447.935	1.919	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc(C#N)c1)C2	1796892807	VPQIESOPEBIPLG-OLGCSEPZSA-N	432.484	1.944	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2c(F)cc(F)cc2[nH]1	1796936210	UHFIHGFPDSUBDR-MSNRECKUSA-N	441.862	1.903	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(C)(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Cl)C3)C1	1797275246	FAFUZMRXRCTTLH-CRWXNKLISA-N	433.908	1.367	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)Nc1ccccn1	1797976387	MLPACWIUUKFCON-OWVAZHOYSA-N	439.354	1.645	50	20	IDGD	
COc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCBr)C3)cc1OC	1798891111	KOYYRZPBZIHWQB-ZSBFGKGUSA-N	441.322	1.692	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](C)CC(N)=O)C2	1799219215	BENHBSLVCHVTES-MHEUCROKSA-N	446.460	1.283	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Br)c1	1799344948	ZPCVNVNAAXMQDH-LTCOOKNTSA-N	443.313	1.962	50	20	IDGD	
C[C@H](Cc1ccncc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Br	1799347229	NCWQWQLOENNIOV-JZYAIQKZSA-N	428.302	1.540	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CCc3ccccc3O1)C2)[C@H](F)Br	1799352399	UPTLVQFQIMHWFG-KUHBDSFDSA-N	441.297	1.660	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(C2CC2)cc1	1799779361	RDJKHENRZCATMA-HATOLVCRSA-N	428.533	1.140	50	20	IDGD	
CC(C)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2cccnc2nc1O	1799919252	GVEATGQUWHXVEV-MIFYACCESA-N	432.908	1.804	50	20	IDGD	
O=C([C@H](F)Br)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C(F)(F)C(F)(F)C(=O)O)C2	1800156999	MTOSCRGFVMHPSL-YWIQKCBGSA-N	437.159	1.670	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CC1CCN(C)CC1)C2	1800637756	HVEUXQAQNKFFIK-DFGXFYAUSA-N	430.387	1.481	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCCCCC(=O)OC	1801075003	NXBUZYKGODPEPL-KRXQYRFLSA-N	447.370	1.873	50	20	IDGD	
O=C(O)C#CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](Br)Cc1ccccc1)C2	1801993362	QXHNISOTLXBVTA-YYIAUSFCSA-N	433.302	1.719	50	20	IDGD	
CCN1CCC(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)CBr)C3)CC1	1802171143	WWDHZXNXKKHGOR-MXASKKJJSA-N	430.387	1.339	50	20	IDGD	
CC(C)(CCl)C(=O)NC[C@@H]1CCN(C(=O)[C@@H]2CCCS2(=O)=O)[C@H]1c1cccnc1	1802902003	IJFDDZXFQQZYOY-ULQDDVLXSA-N	441.981	1.930	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2ccnc(F)c2)[C@@H]1c1cccnc1	1803848413	YDFNBMOCPBFENW-UTKZUKDTSA-N	442.495	1.308	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)ccn1	1807361457	QAHCTMXKCLHEIN-RBBKRZOGSA-N	444.300	1.098	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)c2ccc(F)cc2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807368112	YZNOODCCNHLLNV-DENIHFKCSA-N	447.275	1.534	50	20	IDGD	
CC(C)CNC(=O)C(=O)NC[C@@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1	1808444383	RYICCTXIXGZEKB-RDJZCZTQSA-N	439.354	1.645	50	20	IDGD	
COCCn1ccc(C(=O)NC[C@@H]2CCN(C(=O)[C@H](Cl)COC)[C@H]2c2cccnc2)n1	1808659042	GARWDFMFJHBRQI-SCTDSRPQSA-N	449.939	1.498	50	20	IDGD	
O=C(Cc1ccccc1F)N1CCCC2(CCN(C(=O)c3cccc(B(O)O)c3)CC2)C1	1809215414	KPDOKSDORCEVOJ-UHFFFAOYSA-N	438.308	1.593	50	20	IDGD	
CCc1ncsc1C(=O)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1	1809978030	OVTADGORYRGGBP-UHFFFAOYSA-N	441.362	1.544	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2cnncc2C(=O)O)[C@@H]1c1cccnc1	1810804520	PVHPGWFZSXSWRE-JQFCIGGWSA-N	447.879	1.143	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC2(CCCN(C(=O)c3cnc(O)nc3O)C2)CC1	1810873888	XKAGTOWURNLFJN-CYBMUJFWSA-N	441.326	1.906	50	20	IDGD	
CCOC(CC(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)OCC	1813201430	HNJSIPCKQQYOCS-FRQCXROJSA-N	427.929	1.476	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)Cc3cccc(F)c3)sc2C1	1813881006	MHHUGDQLYQXKTR-HNNXBMFYSA-N	447.536	1.810	50	20	IDGD	
C[C@@H](CBr)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](N)CCC(N)=O)[nH]n1	1814780868	UAFRAVQXKGFLTK-GMXVVIOVSA-N	443.346	1.026	50	20	IDGD	
CN[C@H](CC(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](C)CBr)CC2)C(=O)O	1815073853	YCOFHKACXONGCG-IQJOONFLSA-N	447.355	1.149	50	20	IDGD	
O=C(CCNC(=O)c1ccc[nH]1)Nc1cc([C@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1	1815848680	NGFMRZHTNHQKRX-HUUCEWRRSA-N	436.900	1.150	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)CC2CCOCC2)[nH]n1)c1ccc(B(O)O)cc1	1817470976	AYUCLVBAHLVZJW-IBGZPJMESA-N	440.309	1.212	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cnoc2C2CC2)[nH]n1)c1cccc(B(O)O)c1	1817473395	RBDBAHGIDMCLPV-SFHVURJKSA-N	449.276	1.575	50	20	IDGD	
C[C@]1(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)CC1(F)F	1817474949	IAVAKKCHCFWNRK-DNVCBOLYSA-N	432.236	1.441	50	20	IDGD	
Cc1ccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)cc1O	1817477327	SQWGKAWJQPDRTL-IBGZPJMESA-N	448.288	1.723	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cncnc2)[nH]n1	1818111397	IZQGSWDUPGOSRU-FCLYZYNOSA-N	449.475	1.640	50	20	IDGD	
C[C@H](Br)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnc(O)nc2O)[nH]n1	1822187630	YBAYXKZPBMJINN-KWQFWETISA-N	439.270	1.700	50	20	IDGD	
Cc1cnn([C@@H](C)C(=O)N2CCCC[C@@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)c1	1822416556	HSFSGRZWBNMBJT-DOTOQJQBSA-N	444.540	1.541	50	20	IDGD	
Cc1nccn1[C@H](C)C(=O)N[C@@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1	1826091803	DFRZBGAYEGOHAV-TZMCWYRMSA-N	447.565	1.194	50	20	IDGD	
Cc1ccc(CC(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2cccc(B(O)O)c2)CC3)o1	1827081153	YRVILFFMESJNDU-OAHLLOKOSA-N	439.302	1.193	50	20	IDGD	
CC1=C(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CCO1	1827281135	LZESDCNVXVXRCZ-OAQYLSRUSA-N	426.322	1.294	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H]3CCCS3)sc2C1	1827297830	NCTQFYFYCXEXIL-YPMHNXCESA-N	425.580	1.324	50	20	IDGD	
CC(C)O[C@@H](C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1	1829021486	KBBZRQVSYQJEKY-JXFKEZNVSA-N	445.564	1.732	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(C)=O)C2)C1	1829339802	CCDAHIJNKXFLAS-NQIIRXRSSA-N	437.924	1.712	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CN2CCOC2=O)CC1	1831649534	VTVBBMHMUWCYQS-DZGCQCFKSA-N	430.343	1.842	50	20	IDGD	
CO[C@H](C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)CC1	1831906234	PBFLGSTVQKGSSQ-YLGWQQNMSA-N	431.537	1.775	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(F)(F)C(F)F)CCO2	1832183865	XZGOCXIQXZOWRF-QMTHXVAHSA-N	449.239	1.374	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3ccc(F)nc3)CCO2)C1	1832837743	QNFJSIMLFUOIQO-UZLBHIALSA-N	427.904	1.627	50	20	IDGD	
CC[C@H](C)CC(=O)NC1CCN(C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1	1833393989	HISFCDDNNUTLPZ-INIZCTEOSA-N	444.580	1.307	50	20	IDGD	
Cc1nnc(CCC(=O)N2CCC(OC3CCN(C(=O)[C@H](O)CCl)CC3)CC2)s1	1836714940	DXJBSCPMRSFVQX-MRXNPFEDSA-N	444.985	1.377	50	20	IDGD	
O=C(Cc1cccc(F)c1)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836716883	WGRKHRHHFVCEKJ-LJQANCHMSA-N	426.916	1.967	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cccc(F)c3)C2)C1	1837712429	QDJVGKOVSLOIIQ-OAQYLSRUSA-N	438.572	1.676	50	20	IDGD	
C[C@@H](Nc1ccccn1)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1837738178	OYICQEYSSVKZCW-IERDGZPVSA-N	438.956	1.603	50	20	IDGD	
O=C(c1cc(O)nc(O)n1)N1CCC(OC2CCN(C(=O)C(Cl)Cl)CC2)CC1	1838081254	WCQHTIGEIRYCQF-UHFFFAOYSA-N	433.292	1.304	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(=O)c3ccccc3)C2)C1	1839151410	QPBMXVJHKSDVMH-VQTJNVASSA-N	443.327	1.562	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3cncnc3)C2)C1	1839151808	DUDLUXHWPOIYIB-MOPGFXCFSA-N	445.347	1.102	50	20	IDGD	
Cc1ccc(F)c(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)c1	1839202154	WELNUQXLMMKWTH-CRAIPNDOSA-N	447.276	1.895	50	20	IDGD	
CC(C)=NO[C@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)Br)C2)C1	1839228022	QLPREDLLQAGEKN-VBQJREDUSA-N	434.331	1.027	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCC(F)(F)F)C2)C1	1840032332	VNCBPTQENYDKIM-SMDDNHRTSA-N	431.249	1.569	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3nc(C(C)C)cs3)C2)C1	1840150243	IICYRHHIZPGDFX-AUUYWEPGSA-N	445.969	1.590	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cc(F)ccc3F)C2)C1	1840155658	CCNXTZDAJKTKKU-JXFKEZNVSA-N	446.878	1.218	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3C[C@H]3c3ccccc3)C2)C1	1840156560	VEUQFDQICRPXDQ-LMVRJCEZSA-N	436.936	1.500	50	20	IDGD	
Cc1occ(C(F)(F)F)c1C(=O)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843013769	KVNMHCMVNWIPSP-UHFFFAOYSA-N	436.195	1.417	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1ccc3ncncc3c1)C2	1843416212	MCFHREUDBRFIED-JFLMPSFJSA-N	445.483	1.581	50	20	IDGD	
Cc1onc(-c2ccncn2)c1C(=O)N1CC2(CCCN2C(=O)[C@H](F)Br)C1	1845218669	UETZAKCPZQTFQU-AWEZNQCLSA-N	438.257	1.948	50	20	IDGD	
Cc1cc(O)c(C(=O)N2CCCC23CN(C(=O)[C@H](O)CCl)C3)cc1Br	1845481944	TXIIDBYUCQOLOX-CQSZACIVSA-N	431.714	1.880	50	20	IDGD	
O=C(COC(=O)c1ccc(Cl)c([N+](=O)[O-])c1)NNC(=O)[C@@H]1COc2ccccc2O1	11025150	IJONZUBGQCXWMY-HNNXBMFYSA-N	435.776	1.392	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)CC1	24291490	WNVPXKJFWVWDNO-UHFFFAOYSA-N	439.538	1.388	50	20	IDGD	
CC[C@H](C)NS(=O)(=O)c1ccc(C(=O)OCC(=O)NNC(=O)c2ccc(C)cc2)cc1	26013641	KJUORKXXPXSFBW-HNNXBMFYSA-N	447.513	1.690	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)c1ccc(S(=O)(=O)N(C)C(C)C)cc1	26075240	XFIFGFULLPIOPN-UHFFFAOYSA-N	429.502	1.746	50	20	IDGD	
Cc1nn(C)c(C)c1CCC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	29710339	CHIFDNJMLBCYFU-UHFFFAOYSA-N	433.534	1.215	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)c3ccc(S(N)(=O)=O)c(Cl)c3)n[nH]2)cc1	725907672	QRPZIHKBXKMIAM-UHFFFAOYSA-N	433.877	1.761	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCCNC(=O)CC2CCCCC2)c2ccccc2c1=O	726261782	UUJYJJQALOOVEF-UHFFFAOYSA-N	442.520	1.447	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc2c(c1)CCCC2)NNc1nc(-c2cccnc2)no1	728075869	QRILTDWTBYIESQ-UHFFFAOYSA-N	442.501	1.822	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)CSc2nnnn2C2CC2)c1	728529914	TYSNSELNTDYYPP-UHFFFAOYSA-N	427.284	1.332	50	20	IDGD	
O=C(NNC(=O)N1CCN(C(=O)c2ccccc2O)CC1)c1cccc(OC(F)F)c1	728599146	YSHJRRZFNAEOSD-UHFFFAOYSA-N	434.399	1.806	50	20	IDGD	
Cc1c(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)nnn1-c1cccc(Cl)c1	728846861	UHDWAWTXSBXBMZ-UHFFFAOYSA-N	440.895	1.697	50	20	IDGD	
COC(=O)c1ccc(Br)c(S(=O)(=O)NNC(=O)c2cccc(C#N)c2)c1	728853293	BMACBJJFEICOBN-UHFFFAOYSA-N	438.259	1.731	50	20	IDGD	
CCOc1ccc(-c2nc(C)c(C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)s2)cc1	729275102	KYUSLNQQAPARHH-LLVKDONJSA-N	426.520	1.216	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1sccc1S(=O)(=O)C(F)F	730969784	QIUHRZLPNJJGDI-UHFFFAOYSA-N	445.473	1.212	50	20	IDGD	
Cn1c(N)c(C(=O)/C(C#N)=C\c2cccc(OCc3ccccc3C#N)c2)c(=O)n(C)c1=O	731352193	RLNGSBFFEZNZKW-ZDLGFXPLSA-N	441.447	1.907	50	20	IDGD	
O=C(NNc1nc(-c2cccnc2)no1)c1cc(S(=O)(=O)N2CCOCC2)ccc1F	732110956	VBUQZGNYYWBGNR-UHFFFAOYSA-N	448.436	1.049	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NC2CCN(C(=O)C3CC3)CC2)cc1Br	732238796	RPKIOQUMDJAJIR-UHFFFAOYSA-N	439.310	1.803	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)[C@H]1CC(=O)N(c2ccc3c(c2)OCCO3)C1	732304899	YTJVBCYUYODZMM-ZDUSSCGKSA-N	431.470	1.358	50	20	IDGD	
CCOCCCn1c(NNC(=O)CNC(=O)c2ccc(O)cc2)nc2ccccc2c1=O	733365758	QTQSEFNMNFDGAW-UHFFFAOYSA-N	439.472	1.402	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)C(=O)c2cnn(-c3ccccc3)c2)c2ccccc2c1=O	733756746	IEYYMTCPMDYIMH-UHFFFAOYSA-N	444.451	1.636	50	20	IDGD	
CN1C(=O)C[C@@H](C(=O)NNC(=O)CNC(=O)c2cccs2)[C@H]1c1cccc(Cl)c1	734391885	NRWDYSDHQVJDJN-CXAGYDPISA-N	434.905	1.498	50	20	IDGD	
COc1ccc(CN2CC[C@@H](NC(=O)NNC(=O)COc3ccccc3OC)C2=O)cc1	734515999	CMLSRFSSFVJTGG-QGZVFWFLSA-N	442.472	1.214	50	20	IDGD	
CCC(COC)=NNC(=O)C[C@H]1c2cc(OC)c(OC)cc2CCN1S(C)(=O)=O	735972867	WMXDRADUTZBQEH-INIZCTEOSA-N	427.523	1.481	50	20	IDGD	
C[C@H]1CN(C(=O)NNC(=O)CNC(=O)c2cccs2)CC[C@H]1NC(=O)OC(C)(C)C	740912934	JKUGERVFBVTAGO-QWHCGFSZSA-N	439.538	1.454	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)[C@@H](C)n2nnc(-c3ccccc3)n2)cc1C	745683641	HGYUEYAPKKIRHL-CYBMUJFWSA-N	442.501	1.838	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)N[C@@H]3CC[C@H]4CCC[C@H]4C3)nc2)CC1	745875404	GERGSQVTECVIJZ-IXDOHACOSA-N	436.582	1.613	50	20	IDGD	
CCCNC(=O)NNC(=O)CN1CCN(Cc2ccc(Br)cc2F)CC1	746170535	IMIYKKVSGWPMEI-UHFFFAOYSA-N	430.322	1.446	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)[C@@H](Cc1ccccc1)NC(=O)c1cccnc1	746637000	JSWGBYVZWRAWMJ-HXUWFJFHSA-N	442.479	1.461	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@@H]2CCCN2Cc2ccc(F)cc2)c2ccccc2c1=O	747345241	LFZKPBYLQKWIDO-IBGZPJMESA-N	437.475	1.981	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCOC[C@@H]2C[C@H](O)c2ccccc2)cc1OC	747656384	IRCYNTVKYPGDAH-OALUTQOASA-N	443.500	1.289	50	20	IDGD	
CCCCN1C(=O)CC[C@H](C(=O)NNC(=O)C(=O)N2CCCC2)[C@@H]1c1ccc(OC)cc1	748240259	DFGNYLCEDLJQNZ-ICSRJNTNSA-N	444.532	1.545	50	20	IDGD	
C[C@@H](Sc1ccnc2cc(Cl)ccc12)C(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1	749874233	MODAEBPTNCUQIP-GHMZBOCLSA-N	427.935	1.951	50	20	IDGD	
O=C(NNc1nc(Br)cn2ccnc12)[C@H]1CCCN(C(=O)c2ccncc2)C1	750248720	SQYVDVRNTNYZFX-ZDUSSCGKSA-N	444.293	1.882	50	20	IDGD	
CC(CC(=O)NNC(=O)c1ccoc1)(CC(=O)NNC(=O)c1ccoc1)c1ccccc1	751787229	UKHGPPLANCMKJR-UHFFFAOYSA-N	438.440	1.833	50	20	IDGD	
O=C(NNC(=O)N1CC[C@H](Oc2ccccc2Cl)C1)c1ccc(-n2cnnn2)cc1	752126853	LTFHVLHTRZXFNB-HNNXBMFYSA-N	427.852	1.823	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)N[C@@H]2CCN(Cc3ccc(C#N)cc3)C2=O)c1	753290679	DMSDLALHZPDIBH-LJQANCHMSA-N	437.456	1.321	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)c2cc(-c3ccccc3)on2)n([C@H]2CCS(=O)(=O)C2)n1	755536695	UHNXGSDXDYKRQP-AWEZNQCLSA-N	444.473	1.673	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)Nc1ccc(C(=O)N2CCOCC2)cc1	755932795	DWNVQZOWMLXURG-UHFFFAOYSA-N	434.456	1.811	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)Nc2ccccc2OCCC(N)=O)n[nH]1	756064154	CFHKEVKFZJHLAE-UHFFFAOYSA-N	438.444	1.806	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)Nc1ccc(N2CCOC2=O)cc1	756161561	WNFLFELPGCDEBA-UHFFFAOYSA-N	425.449	1.503	50	20	IDGD	
CCCNC(=O)c1ccc(NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1Cl	756185706	CUCMQZODCHKXSM-UHFFFAOYSA-N	442.867	1.922	50	20	IDGD	
Cc1c(NC(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)cccc1C(=O)Nc1ccccc1	756278957	ARLZLSUTDUUIAR-ZDUSSCGKSA-N	433.490	1.338	50	20	IDGD	
O=C(Cc1cc[nH]n1)NNC(=O)Nc1cc(Br)cnc1OCC(F)(F)F	756572041	LFHAMBIJWBZOPI-UHFFFAOYSA-N	437.176	1.904	50	20	IDGD	
COC(=O)c1cc(NC(=O)NNC(=O)COc2ccccc2OC)c(OC)c(OC)c1	756744208	ZNBOPKVODPEJTD-UHFFFAOYSA-N	433.417	1.731	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)N[C@H]2CCc3nc(COC)nn3C2)cc1OC	757773515	CRNUHTRHLCCRIQ-HNNXBMFYSA-N	446.508	1.571	50	20	IDGD	
CCOc1ccc(C2(CNC(=O)NNC(=O)C(=O)Nc3ccccn3)CCOCC2)cc1	758708180	BHNWAYBMMLHBEB-UHFFFAOYSA-N	441.488	1.498	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2nnc(C(C)(C)C)s2)c1	758878370	CXZAXXXDBHNZSS-UHFFFAOYSA-N	440.551	1.230	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NCC3CCC(C)(C)CC3)nc2)CC1	759682332	CYQNBXYACNVKCB-UHFFFAOYSA-N	438.598	1.860	50	20	IDGD	
O=C(NC[C@]1(Cc2ccc(F)cc2)CCC[C@H]1O)NNC(=O)C(=O)Nc1ccccn1	759690975	YKLFKQRVOCHQOK-IIBYNOLFSA-N	429.452	1.264	50	20	IDGD	
O=C(Cc1cccc(I)c1)NNC(=O)c1nnc(O)c2ccccc12	760273642	BRFMNJPMSMADGK-UHFFFAOYSA-N	448.220	1.944	50	20	IDGD	
CC(C)CCn1nc(C(=O)NNC(=S)NCC2CCN(C)CC2)c2ccccc2c1=O	760466483	QNICXMZTYNPBDV-UHFFFAOYSA-N	444.605	1.893	50	20	IDGD	
CC(C)(C)C(=O)NNC(=O)C(=O)Nc1ccc(NC(=O)[C@@H]2CCCO2)cc1C(F)(F)F	761071274	AUJHENZATUBQRH-ZDUSSCGKSA-N	444.410	1.955	50	20	IDGD	
CCC(=O)NNC(=O)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)[C@H]2C[C@H]3CC[C@H]2C3)cc1	763441562	XJXSLPBLWZTQGG-AYMQEEERSA-N	436.534	1.286	50	20	IDGD	
O=C(NNC(=O)c1ccncc1)C(=O)Nc1ccc(N2CCOCC2)cc1C(F)(F)F	763463374	COKWAXWVWXFHTO-UHFFFAOYSA-N	437.378	1.337	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)C(=O)Nc1cc(F)c(Br)c(F)c1	763551902	UEGGEYHKVGIPIF-UHFFFAOYSA-N	442.172	1.856	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)Nc1ccnn1-c1cccc(Cl)c1	763574488	ZVWNOQOKYXWCAI-MRXNPFEDSA-N	441.831	1.452	50	20	IDGD	
CC(C)(C)c1ccc(OCC(=O)NNC(=O)C(=O)Nc2cnc3c(c2)COCC3)cc1	763600229	OFDLTONSDSZCEW-UHFFFAOYSA-N	426.473	1.617	50	20	IDGD	
CCn1cnnc1-c1cccc(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)c1	763681596	LUHDMMJQDLIOQQ-UHFFFAOYSA-N	433.428	1.002	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(C2CCCC2)nn1C	763682368	MSXVPYSOUGOIIE-UHFFFAOYSA-N	429.477	1.641	50	20	IDGD	
CCCCCn1nc(C)cc1NC(=O)C(=O)NNC(=O)CN1CCCc2ccccc21	763746468	XNAGXQQSNXHVDP-UHFFFAOYSA-N	426.521	1.920	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)C(=O)Nc2ccc(Br)cc2)c2ccccc2c1=O	763785647	KLQHQKAILJJVEB-UHFFFAOYSA-N	444.245	1.096	50	20	IDGD	
CCCOc1cc(C)ccc1NC(=O)C(=O)NNC(=O)COc1ccccc1[N+](=O)[O-]	763804902	WSCXMIUTJTZMCH-UHFFFAOYSA-N	430.417	1.857	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccc(CN2CCCCC2)c1	763806893	HKFDJFRVQYQTKJ-UHFFFAOYSA-N	435.484	1.709	50	20	IDGD	
CCOC(=O)c1c(C)csc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccccc1F	763855859	BTQVFCTTYXGHCV-NSHDSACASA-N	437.449	1.926	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1cccc(-c2nncn2C)c1	763866333	OSBVXJMLRAMPBS-GFCCVEGCSA-N	426.408	1.175	50	20	IDGD	
C[C@H]1CN(c2ccccc2NC(=O)C(=O)NNC(=O)Cc2ccc(F)cc2)C[C@@H](C)O1	763919971	XEVXEBMLGFCHJD-GASCZTMLSA-N	428.464	1.768	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3ccccc3CS(C)(=O)=O)cc2C1	763943039	PQOWRIRYMFYSIB-LBPRGKRZSA-N	449.554	1.817	50	20	IDGD	
CC[C@H](C)n1ncc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)c1C1CC1	764006252	NJSAPMUJLYWUBC-LBPRGKRZSA-N	427.461	1.902	50	20	IDGD	
CCOC(=O)C1=NN(c2ccccc2)[C@H](C(=O)NNC(=O)CSc2ccccc2O)C1	764038244	OFVZKLFGKSMJBF-INIZCTEOSA-N	442.497	1.830	50	20	IDGD	
O=C(NNC(=O)C1CCCC1)C(=O)Nc1ccnn1Cc1ccccc1Br	764075991	ACSUZEKDQJMIGY-UHFFFAOYSA-N	434.294	1.970	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CC(F)(F)F)cc1I	764111801	GASHLQCUBRQDQV-UHFFFAOYSA-N	429.136	1.638	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cccc([S@@](C)=O)c3)n[nH]2)cc1	764111802	QLABMIQPZNGBJQ-SSEXGKCCSA-N	425.470	1.522	50	20	IDGD	
CNC(=O)c1cc(NC(=O)C(=O)NNC(=O)CCc2ccc(OC)cc2)ccc1Cl	764127936	VKYDQIYKSJXJLJ-UHFFFAOYSA-N	432.864	1.427	50	20	IDGD	
NC(=O)c1cnn2c(C(=O)NNC(=O)c3ccc(Br)cc3Cl)ccnc12	764157044	KKPLXUIKFCWTIR-UHFFFAOYSA-N	437.641	1.319	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H]1CCc2ncc(NC(=O)C(=O)NNC(=O)c3ccoc3)cc2C1	764168717	SOBNZQLMARDXSO-AWEZNQCLSA-N	443.460	1.456	50	20	IDGD	
COC(=O)c1ccc(C(F)(F)F)cc1NC(=O)C(=O)NNC(=O)Cc1ccccc1F	764312925	DHVDCWSMKXRCOW-UHFFFAOYSA-N	441.337	1.960	50	20	IDGD	
CO[C@H](C)C(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)C(C)(C)c2ccccc2)c1	764313078	IMPFTXRPAFNINH-CQSZACIVSA-N	426.473	1.724	50	20	IDGD	
Cc1ccc([C@H](CNC(=O)NNC(=O)CSc2ccccc2O)N2CCOCC2)o1	764321276	CQMFBCJXRVGRPR-HNNXBMFYSA-N	434.518	1.790	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C(=O)Nc1cccc(CS(C)(=O)=O)c1C)c1ccccc1	764330295	UBLBXOGTUSATHB-KRWDZBQOSA-N	431.514	1.819	50	20	IDGD	
CCOCCOc1ccc(Br)cc1NC(=O)C(=O)NNC(=O)C1CCC1	764343921	XAVBQLSNLFWAHR-UHFFFAOYSA-N	428.283	1.750	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)C(=O)Nc1cccc(C(=O)OCc2ccccc2)c1	764355776	IMCIYDUIZMLTKQ-UHFFFAOYSA-N	432.436	1.767	50	20	IDGD	
CC(C)(C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)cc1	764379631	GIPVIFDAEMLLBH-UHFFFAOYSA-N	448.426	1.973	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)C(=O)Nc2cccc(Oc3ccccn3)c2)c1	764432544	FWJILQHWRPGXJA-UHFFFAOYSA-N	434.412	1.627	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)[C@H]1CN(C(=O)OC(C)(C)C)CCO1	764547273	IQCDFUYUADLZEG-MRXNPFEDSA-N	431.493	1.382	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2cccc(OCC(F)F)n2)c2ccccc2c1=O	765322380	OGFWRTFTHIAJIQ-UHFFFAOYSA-N	432.387	1.922	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)c1ccc2c(c1)nc(O)n2CC(F)(F)F	765381892	KWJVMORVPUMZNS-UHFFFAOYSA-N	441.391	1.557	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)C[C@@H]2CN(C(=O)OC(C)(C)C)CCO2)cn1	765450922	YQFYTYAWFZQFBM-CYBMUJFWSA-N	425.511	1.434	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)c3cc(S(N)(=O)=O)ccc3C)n[nH]2)cc1	765575160	GQHDIPRNPQEIIV-UHFFFAOYSA-N	427.486	1.670	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)c2cccc(CS(C)(=O)=O)c2)n[nH]1	765601819	VBOZOQBMJMJHLW-UHFFFAOYSA-N	428.470	1.705	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)c2cc(S(=O)(=O)N(C)C)c(C)o2)n[nH]1	765601871	UWIYBSGKBWTDRD-UHFFFAOYSA-N	447.473	1.312	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@@H](C)Oc3cccc(F)c3)CC2)cc1	765749741	SJJKUYDNGQGCGY-GOSISDBHSA-N	428.508	1.867	50	20	IDGD	
C[C@@H](NC(=O)OC(C)(C)C)[C@@H]1COCCC1=NNC(=O)Cc1cc(O)nc(S)n1	766016530	AZGHJYCUXPWANI-PWSUYJOCSA-N	425.511	1.435	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)c2ccc(N3C(=O)CCC3=O)c([N+](=O)[O-])c2)c1	766342857	GURVAVCLXOBDTG-UHFFFAOYSA-N	442.384	1.340	50	20	IDGD	
C[C@H]1CN(Cc2ccccc2)[C@H](C)CN1C(=O)NNC(=O)CNC(=O)c1cccs1	766528468	JDUUGBJYAWGWNN-CVEARBPZSA-N	429.546	1.814	50	20	IDGD	
O=C(COC(=O)CCc1cc2ccccc2nc1O)NNC(=O)c1ccc([N+](=O)[O-])cc1	767787535	MBZRNCSOKNAPHE-UHFFFAOYSA-N	438.396	1.786	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)c2nccc3c(S(N)(=O)=O)cccc23)c1C	768465300	ZIALCWLWCDYKIC-CQSZACIVSA-N	442.497	1.728	50	20	IDGD	
CCNc1nc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(CC)CC)c2)cs1	768919188	WVFFKXARFLOMNJ-UHFFFAOYSA-N	425.536	1.680	50	20	IDGD	
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N([C@H]1CCS(=O)(=O)C1)N(C)C	769621062	LWYXMWPIXKQSCP-LPHOPBHVSA-N	434.562	1.344	50	20	IDGD	
O=C(NNC(=O)c1ccoc1Br)c1cccc(S(=O)(=O)N2CCCC2)c1	770082245	GHCHJJWFCVPOFT-UHFFFAOYSA-N	442.291	1.901	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)COc1ccc(OCc2ccccc2)cc1)[C@H]1CN(C)CCO1	770435309	MLEUOVZUWWGRAC-DYESRHJHSA-N	442.516	1.694	50	20	IDGD	
CN1CCN([C@H](C(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)c2ccccc2)CC1	770955776	OVSSAVJXMXJYOM-KRWDZBQOSA-N	438.536	1.719	50	20	IDGD	
CCN(CC)C(=O)N1CCC(C(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)CC1	770966099	RNGVJRMFAXCDNX-UHFFFAOYSA-N	432.529	1.904	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)[C@H]3CC(=O)N(c4cccc(Br)c4)C3)nc21	770968724	LUXMUMMPAXELFR-VIFPVBQESA-N	446.265	1.328	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCc2nc3cc(OC)ccc3n2C)c2ccccc2c1=O	771391432	IVYIEKZPHHQYRP-UHFFFAOYSA-N	449.471	1.456	50	20	IDGD	
O=C(NCC(=O)N1CCOCC1)NNC(=O)Nc1ccc(Br)cc1Cl	776336837	LAOVXVWHXBTPTG-UHFFFAOYSA-N	434.678	1.297	50	20	IDGD	
CCOC(=O)[C@H](NC(=O)OC(C)(C)C)C(=O)NNc1nc2ccccc2c(=O)n1CC	776616373	XXEJDWAZVWYZIC-CQSZACIVSA-N	433.465	1.316	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)N[C@H]2CCN(CCCc3ccccc3)C2=O)c1	776627988	UPQANPAQWXWVSA-IBGZPJMESA-N	430.530	1.950	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)c1ccc2c(c1)C(=O)N(Cc1ccco1)C2=O	778440161	BAJCTKZDQUHAGT-UHFFFAOYSA-N	442.428	1.362	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)NCc1ccc(C(=O)N2CCCCC2)cc1	778582517	LAXKLUGYXZVHFB-UHFFFAOYSA-N	433.509	1.668	50	20	IDGD	
COc1cc(OC)cc(N2CC[C@H](NC(=O)NNC(=O)CNC(=O)OC(C)(C)C)C2)c1	778687845	FQNMINZMTLLDLG-ZDUSSCGKSA-N	437.497	1.138	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)[C@H](O)[C@H](O)c3nc4ccccc4s3)nc21	779518344	WYWYBFIIOLFUMC-OLZOCXBDSA-N	443.489	1.434	50	20	IDGD	
COc1ccc(-c2nn(CCC#N)cc2/C=C(/C#N)C(=O)OCc2nnnn2C)cc1OC	781865941	VUWKDGIMOARQOY-DHDCSXOGSA-N	448.443	1.655	50	20	IDGD	
CCOCCCn1c(NNC(=O)c2cc3nn[nH]c3cc2F)nc2ccccc2c1=O	781928933	HOXHAXPFALJERU-UHFFFAOYSA-N	425.424	1.990	50	20	IDGD	
COCCS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2nc3ccccc3s2)cc1	782811971	FXOJMHAKDZHRKH-UHFFFAOYSA-N	434.499	1.798	50	20	IDGD	
CCC(CC)NC(=O)[C@@H]1CN(C(=O)C(=O)NNc2cc(C)ncn2)c2ccccc2O1	783940387	SEYVYIXFDCGUDE-KRWDZBQOSA-N	426.477	1.327	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)c1cc2c(=O)n3ccccc3nc2n1C	784457475	TVGZRNLQVOSUGQ-UHFFFAOYSA-N	437.481	1.748	50	20	IDGD	
CNS(=O)(=O)c1ccc2c(c1)N(C(=O)C(=O)NNc1ccc(C(C)(C)C)cc1)CC2	784803753	SPTNOYHHTDNFPT-UHFFFAOYSA-N	430.530	1.925	50	20	IDGD	
CCNC(=O)N(C)NC(=O)C(=O)Nc1ccc(Cl)c(S(=O)(=O)N2CCCCC2)c1	784915941	KHDMTSCNBXTQDX-UHFFFAOYSA-N	445.929	1.146	50	20	IDGD	
N#Cc1ccc(NNC(=O)C(=O)Nc2ccc(CC(=O)N3CCOCC3)cc2)cc1Cl	785092197	CWBAIEWHYGCLGN-UHFFFAOYSA-N	441.875	1.695	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1cccnc1N1CCCCC1	785331155	PMTRBDAXELRKDW-UHFFFAOYSA-N	447.517	1.566	50	20	IDGD	
Cc1ccc(CNC(=O)NNC(=O)CNC(=O)c2ccco2)c(-n2cc(Cl)cn2)n1	786832616	XHEXRMFAEMKSFN-UHFFFAOYSA-N	431.840	1.083	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)C(=O)Nc1ccc(Cl)cc1-n1cccn1	788331900	VARPKRZBYKQTNQ-UHFFFAOYSA-N	427.804	1.654	50	20	IDGD	
O=C(CN1CCC(c2ncc3n2CCCC3)CC1)NNC(=O)c1ccc([N+](=O)[O-])cc1	789355616	DZVOTLUJJPZJTD-UHFFFAOYSA-N	426.477	1.768	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccc3c2OCC[C@H]3N(C)C)cc1	789733302	YYBNRSJGWWUGFD-GOSISDBHSA-N	426.473	1.545	50	20	IDGD	
CCOC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)cc1	789809947	HXCQBYZTMDZVJP-ROUUACIJSA-N	440.456	1.914	50	20	IDGD	
COC(=O)c1ccc(OC)cc1NC(=O)C(=O)NNC(=O)[C@H]1OCC[C@H]1c1ccccc1	789811030	BVSXVUHYGJAQDT-YJBOKZPZSA-N	441.440	1.140	50	20	IDGD	
O=C(NNC(=O)[C@H]1OCC[C@H]1c1ccccc1)C(=O)Nc1cc2c(cc1Cl)OCO2	789811530	CUPWZMSYMQSITC-SJCJKPOMSA-N	431.832	1.727	50	20	IDGD	
CCOC(=O)c1ccsc1NC(=O)C(=O)NNC(=O)[C@H]1OCC[C@H]1c1ccccc1	789816968	HLCNERXFSBOPQD-ZFWWWQNUSA-N	431.470	1.583	50	20	IDGD	
COc1cc(Cl)c(S(=O)(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1C(=O)O	790381884	GFTKZRVXBBAHLV-UHFFFAOYSA-N	429.794	1.578	50	20	IDGD	
Cc1c(Cl)cccc1N1CCCN(C(=O)NNC(=O)CNC(=O)c2ccco2)CC1	790693047	UIFPKHOJCHEZKR-UHFFFAOYSA-N	433.896	1.924	50	20	IDGD	
N#Cc1ccc(C[C@H](C#N)C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1	791449502	QMEUGNMVNHJEMA-OAQYLSRUSA-N	430.512	1.600	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)[C@@](C)(O)Cn1cc(C(F)(F)F)ccc1=O	792024239	YJYFXAPUFKBCCB-VOJFVSQTSA-N	445.369	1.372	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cnc(CC(C)C)nc2)cc(OC)c1OC	792352093	ZJKIIWNKSFQXME-UHFFFAOYSA-N	431.449	1.101	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)c2cnn3c2C[C@@H](CNC(C)=O)CC3)cc1	792736842	RPGDXXNHBGVDRO-ZBFHGGJFSA-N	443.504	1.209	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)NCc2ccccc2S(=O)(=O)N2CCCCC2)n1	792787509	PYVYDEFVFDITDL-UHFFFAOYSA-N	431.518	1.709	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CC[C@]3(CCN(Cc4ccccc4)C3)C2)n1	796445426	UKQDFSHNGNEVIB-QFIPXVFZSA-N	427.574	1.739	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cnn(CC)c1C(F)(F)F	799257988	XPLAYEFTIOZILI-UHFFFAOYSA-N	443.382	1.485	50	20	IDGD	
CCn1ncc(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)c1C(F)(F)F	799259017	QXYCOWJWWIMCIW-UHFFFAOYSA-N	437.176	1.412	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN(C)CC(=O)N(C)[C@H](C)c2ccccc2)cc1OC	800499168	DDLXVEHVACWABD-MRXNPFEDSA-N	442.516	1.616	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NC[C@@H]3CCCC(F)(F)C3)nc2)CC1	800718204	CTXBDKDURAFMLW-CQSZACIVSA-N	446.524	1.469	50	20	IDGD	
COC(=O)[C@@H]1C[C@@H]2[C@@H](CC[C@H](C)N2CC(=O)NNC(=O)c2cc(Cl)ccc2OC)O1	801601293	LRMSFKSVYQESIU-WQFMGJDKSA-N	439.896	1.293	50	20	IDGD	
COC(=O)Nc1cccc(CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)c1	804867858	MTJMIOMOGHFKNW-UHFFFAOYSA-N	434.478	1.302	50	20	IDGD	
Cc1ccc([C@@H](CNC(=O)NNC(=O)c2c(C)nc3ccccn23)N2CCOCC2)o1	807023366	KMXQBAFZZGLTFJ-MRXNPFEDSA-N	426.477	1.562	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)CNS(=O)(=O)c1ccc(OC)c(OC)c1)c1ccccc1	810379152	QMSUXEKRWFVZDV-MRXNPFEDSA-N	435.502	1.323	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(Br)c([N+](=O)[O-])c2)c1	810386595	IRQRFNUPCLCVFQ-UHFFFAOYSA-N	432.190	1.629	50	20	IDGD	
Cc1onc(N)c1S(=O)(=O)NC(=O)/C(C#N)=C/c1cc(C)n(C[C@@H]2CCCO2)c1C	810828354	QBJYLGOYPRUJON-AHQMPEJBSA-N	433.490	1.575	50	20	IDGD	
C[C@H]1CN(c2ccc(C(=O)NNc3ccc(S(=O)(=O)N(C)C)cc3)cn2)C[C@@H](C)O1	812729392	LEEQYDWYGLYNEU-GASCZTMLSA-N	433.534	1.702	50	20	IDGD	
COC(=O)c1cn(-c2cccc(NC(=O)NNC(=O)[C@H](C)Oc3ccc(F)cc3)c2)nn1	812979224	CKVOOXJTSDNIOD-LBPRGKRZSA-N	442.407	1.813	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)NCC[C@]2(O)C[C@H]3CC[C@H]2C3)c2ccccc2c1=O	813786433	OLSLIOCJUVTKIM-DFFLPILJSA-N	427.505	1.863	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc([C@H]2CCOC2)cc1	815565489	QHJRUOAYCOANGG-INIZCTEOSA-N	427.457	1.754	50	20	IDGD	
Cc1cc(N2CCCC[C@H]2C)ccc1NC(=O)C(=O)NNC(=O)[C@H]1CCc2nncn2C1	815692404	QGSPOAJKENFVMZ-CVEARBPZSA-N	439.520	1.314	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1ccc(OCC(F)F)cc1	815752342	OCZABCMWVSNJIM-UHFFFAOYSA-N	442.444	1.663	50	20	IDGD	
Cc1nn(C)c(Br)c1C(=O)NNC(=O)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	816510226	PQBUYFJBANJOHQ-LLVKDONJSA-N	444.330	1.899	50	20	IDGD	
N#C/C(=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)N1C[C@@H]2[C@@H](CO)[C@@H]2C1	816860899	CNKZIKXHNFWFAM-ZVCABBEFSA-N	439.903	1.683	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)c2cc(S(N)(=O)=O)ccc2C)c1	818763506	PGXIHXAONIWBQB-UHFFFAOYSA-N	442.291	1.948	50	20	IDGD	
O=C(NNC(=O)[C@H]1CC(=O)N(C2CC2)C1)c1nc(-c2ccccc2)n(-c2ccccc2)n1	828952784	PSGSZHLPXIGJQY-INIZCTEOSA-N	430.468	1.706	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc(Cl)c1O	912852148	LUSDVAPIQUSGCY-UHFFFAOYSA-N	426.882	1.812	50	20	IDGD	
C=CCNC(=S)NNC(=O)c1ccc(NS(=O)(=O)c2ccc(C(C)=O)cc2)cc1	913435816	WLUZVAYJMRPUDA-UHFFFAOYSA-N	432.527	1.985	50	20	IDGD	
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC(=NNC(=O)[C@@H](C)Oc2ccc(F)cc2)CC1	914559402	MGDIULKGUPINQF-CQSZACIVSA-N	437.497	1.890	50	20	IDGD	
COc1cc2cc(C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)[nH]c2c(OC)c1OC	914781711	MIMZSFNHCJDQFT-UHFFFAOYSA-N	437.416	1.244	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)[C@@H]2CC(=O)N(C3CCCCC3)C2)c2ccccc2c1=O	914829660	JVVZDSJRHBZAAO-OAHLLOKOSA-N	439.516	1.920	50	20	IDGD	
COc1cccc(C[C@H](C(=O)NNC(=O)COc2cc(C)cc(C)c2)n2nnnc2C)c1	915695568	SBLCHURAOQUBPP-HXUWFJFHSA-N	438.488	1.617	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2cccnc2)on1)c1cccc(S(=O)(=O)N2CCCC2)c1	915802981	YZVFDDFLLOSLMU-UHFFFAOYSA-N	441.469	1.596	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCC(=O)OC(C)C)c1	916219701	JZHWLDLEOZZUAW-UHFFFAOYSA-N	428.511	1.003	50	20	IDGD	
COc1cc(OC)cc([C@@H](NC(=O)NNC(=O)c2ccccc2O)c2nccn2C)c1	916229723	WWBZSAZRJQDOSP-GOSISDBHSA-N	425.445	1.877	50	20	IDGD	
CN1CCN(c2ccc(CNC(=O)NNC(=O)C34CC5CC(CC(C5)C3)C4)cn2)CC1	916247198	HSBUPHXIUJQKHO-UHFFFAOYSA-N	426.565	1.880	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)NCCNC(=O)c2ccc(C)c(F)c2)cc1OC	916272294	KUOFJSNRAWGAPQ-UHFFFAOYSA-N	432.452	1.915	50	20	IDGD	
CC(=NNC(=O)c1csc(N2CCOCC2)n1)c1ccc(S(=O)(=O)N(C)C)cc1	916338944	XMWQFOZLKJIMNA-UHFFFAOYSA-N	437.547	1.384	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)NCC[C@](O)(c1nccn1C)C(F)(F)F	916378600	PRKUWMDAJAUSQP-KRWDZBQOSA-N	439.398	1.160	50	20	IDGD	
C[C@H](CN1CCCCC1)NC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	916462114	QXRWXGNKSWUXJW-MRXNPFEDSA-N	437.566	1.290	50	20	IDGD	
CC(=O)NNC(=O)C1(c2ccccc2)CCN(S(=O)(=O)c2ccc(F)c(F)c2)CC1	916556291	GCRPKHOQTVEQGC-UHFFFAOYSA-N	437.468	1.855	50	20	IDGD	
CCNC(=O)c1cccc(CNC(=O)NNC(=O)c2nn(CC)c(=O)c3ccccc23)c1	916645010	KTXRHNGKCCBRJH-UHFFFAOYSA-N	436.472	1.310	50	20	IDGD	
Cc1ccc(C(=O)N2CCN(CC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)CC2)cc1F	917154529	LGBLWFOLQZYCIB-UHFFFAOYSA-N	443.435	1.261	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)c2cc3c(=O)n4ccccc4nc3n2C)cc1	917349959	BLGIPBNBGCCCLH-UHFFFAOYSA-N	433.424	1.113	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)[C@H](C)NS(=O)(=O)c2cccs2)cc1	917918000	ISXYZZASWQJYMO-QWHCGFSZSA-N	441.531	1.429	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)Cn1cccn1	919779257	OPMSSQOBEPJLPH-MRXNPFEDSA-N	448.549	1.338	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)c1ccc(OC)c(S(=O)(=O)NC(C)C)c1	919819989	DWIAVDLPFSTRMZ-UHFFFAOYSA-N	435.502	1.394	50	20	IDGD	
C[C@@H]1CN(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)C[C@@H](c2ccccc2)O1	920313929	GIESQLCZLWUQDX-PBHICJAKSA-N	431.518	1.796	50	20	IDGD	
COc1ccccc1CC(=O)NN=C(C)c1ccc(S(=O)(=O)NCCC(=O)O)cc1	920376358	QXIHGJUGOCSQEI-UHFFFAOYSA-N	433.486	1.531	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)c1ccc(CS(=O)(=O)c2ccccc2)o1	921305603	SMPVMPKYNBVJSN-UHFFFAOYSA-N	437.474	1.539	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(Cl)cc1)NNC(=O)c1ccc(Br)cc1	1317707849	SCBRYRGDEVFKOD-UHFFFAOYSA-N	446.710	1.842	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])c(C)c2)cc1	1318319520	WCSOVESZGNCAMV-GOSISDBHSA-N	426.429	1.978	50	20	IDGD	
C[C@@H](O)CNS(=O)(=O)c1ccc(C(=O)NNC(=O)CC23CC4CC(CC(C4)C2)C3)cc1	1336954973	AJOSPFRDGRWSBF-XSXQVXRUSA-N	449.573	1.713	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](C)Nc3cnccn3)C2)C1	1779062831	WRYISLBHZFZHLC-GLJUWKHASA-N	440.342	1.280	50	20	IDGD	
O=C(c1cc(-c2cccs2)on1)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1779563704	GLNUYMXECKMBSP-UGSOOPFHSA-N	425.894	1.446	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(CO)on2)C1	1780219366	DKDNSAKNILICTC-DDUZABMNSA-N	444.326	1.468	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)c(O)c1	1780552946	KGQQHRKVSHYUEF-RHSMWYFYSA-N	431.258	1.535	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1nn[nH]c1C(F)(F)F)C2	1780706138	PVFQUMAIGUXVAV-LYOVBCGYSA-N	437.850	1.968	50	20	IDGD	
C[C@H](Nc1nccs1)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781332112	ZUYPGTSOVGWJDD-ZIBATOQPSA-N	435.319	1.464	50	20	IDGD	
Cc1nccn1CCCC(=O)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781334382	MXJHOVRJQDIFQS-DOTOQJQBSA-N	431.306	1.492	50	20	IDGD	
CCN(C)[C@@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)CBr)C2	1781451338	WZERAKTTXINGLD-YIOZNXECSA-N	432.403	1.872	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H]1CCNC(=O)C1)C2	1781905657	SSILMHGMEJGNAO-NRTGNBEESA-N	444.370	1.200	50	20	IDGD	
Cc1nc(N)sc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)Br)C1	1781998473	WOFDUQSFFWGVMR-ILMHXZGMSA-N	445.383	1.945	50	20	IDGD	
O=C(c1ccc(-c2ccc(O)nn2)cc1)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Cl)CCO2	1782115828	ODEHMXBFXMWSKV-PXNSSMCTSA-N	434.855	1.827	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Cl)C2	1782160683	QMEIZWMXXITDJU-CAFLLTJSSA-N	430.904	1.790	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccc4c(c3)OCCO4)CCO2)C1	1783534876	QMRVTIBLBWVIKW-BFUOFWGJSA-N	439.306	1.685	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(-c4ccncc4)[nH]n3)CCO2)C1	1783539184	YOWQKEYJIHDJKF-YJYMSZOUSA-N	448.321	1.699	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)C3CC4(CCC4)C3)C2)C1	1784843957	UKKXPYOXMUBXTC-AJPHYDNBSA-N	441.532	1.531	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)N1CC[C@@]2(C1)CN(C(=O)CO[Si](C)(C)C)CCO2	1785336605	IDCJMKDMJSZCME-HXUWFJFHSA-N	443.617	1.583	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)c1ccc2nonc2c1	1787879508	FIWAEHGNIXGJHT-XEZPLFJOSA-N	437.294	1.601	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)c1ccnc2c(O)cccc12	1790498324	ALZKNPXXRSNGOE-HZCDGDGTSA-N	433.892	1.133	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccnc(OC)c3F)C[C@@H]21	1791253610	CADMAXXRKYEDHK-MXAVVETBSA-N	429.876	1.076	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4nn(C)cc4c3)C[C@@H]21	1791256872	KWWOSDSNSQITDF-RMRDIRSESA-N	434.924	1.420	50	20	IDGD	
CN1CCC[C@@H](C(=O)NC2(c3ccc(NC(=O)CCC(=O)NN(C)C)cc3)CCC2)C1	1791600771	BENDHSNTJUZCJH-QGZVFWFLSA-N	429.565	1.835	50	20	IDGD	
C[C@H](CBr)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CNC(=O)c1ccco1)C2	1792989090	AFLZLTXBTGZBIN-YIYPIFLZSA-N	426.311	1.679	50	20	IDGD	
CN(C)c1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCBr)cn1	1795115960	WXSXUZZTXOJAIB-XOIINTDNSA-N	425.327	1.136	50	20	IDGD	
CO[C@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1ccccc1	1795376873	FALNUKURDVIKPS-XFIYOXNOSA-N	429.286	1.654	50	20	IDGD	
Cc1c(F)ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)c1N	1796155976	BEEFROMXFYEQHK-BTTYYORXSA-N	440.479	1.280	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1cccc2[nH]ncc12	1796159381	YYXTZTMOGLMUTD-ANGCBRKESA-N	425.258	1.457	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)[C@@H]1CCc2ccccc2O1	1796192113	JZERBEYABIFNBP-IIZPIQPGSA-N	434.301	1.012	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)c1cc2cc(F)ccc2s1	1797423687	JHQIBMDQAYBJPN-IFOZYUSPSA-N	426.897	1.843	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)c1c[nH]c2cccc(Cl)c12	1797566778	OKAVYQUNWSIJMA-VODVUFLWSA-N	426.300	1.624	50	20	IDGD	
CCCC(=O)N[C@H](C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](Br)CC)C2	1797929628	PLDNXQKUPCEBKW-XYFZXANASA-N	432.359	1.054	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CC(c3ccccc3)=NO1)C2	1797953689	CXLDIIHOBTYJTD-NZGUISNBSA-N	445.592	1.621	50	20	IDGD	
Cc1nc2ccncc2cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CO[Si](C)(C)C	1797956957	RUTDVRNVMBTDBS-UPHUGPLXSA-N	442.592	1.993	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1cc2ncsc2[nH]1	1797981358	RDKVSDMQHIFAIY-IWXIMVSXSA-N	431.287	1.518	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1ccn(C(F)F)n1	1798163557	JEWPWVCQGWXXRA-JZSSXWJLSA-N	425.205	1.172	50	20	IDGD	
Cc1cccn2ncc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)CCBr)C4)c12	1800105674	XLUNMVVQTQWTQT-XOIINTDNSA-N	435.322	1.631	50	20	IDGD	
CC(C)c1ccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCC(=O)NN(C)C)cc1	1801013044	RQCHJRBBPRWANQ-IRJINJETSA-N	444.576	1.315	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)Sc1ccccn1	1801321992	IMMFFEAHSUPFSB-IPVBOJNNSA-N	442.379	1.935	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)CC(N)=O)[C@H]1c1cccnc1	1803011104	NEFYQZZOPRGVPE-YXPYIKCWSA-N	439.354	1.630	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CCc2ccc(F)nc2)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803135544	FBUNSMVCLXOGMP-ABSDTBQOSA-N	434.899	1.854	50	20	IDGD	
COc1ccccc1OCC(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]1c1cccnc1	1803136582	DBTZOXDSTOOYGD-CBGDNZLLSA-N	447.919	1.775	50	20	IDGD	
Cn1cc(C(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]2c2cccnc2)c2cccnc21	1803143264	XYRNSFWEJRGMBF-ATZDWAIDSA-N	441.919	1.888	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)CCN2C(=O)C=CC2=O)[C@H]1c1cccnc1	1803912801	KGZICDCFXCNUBL-LLGFUMIMSA-N	446.935	1.810	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)CCc2cnn(C)c2)[C@@H]1c1cccnc1	1807430924	DQQRUIUEYKDHBO-BJLQDIEVSA-N	433.940	1.708	50	20	IDGD	
O=C(COC(=O)C(F)(F)F)NC[C@@H]1CCN(C(=O)C(Cl)Cl)[C@@H]1c1cccnc1	1810190890	ZNDZONVIPGIODV-CMPLNLGQSA-N	442.221	1.997	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@@H]1c1cccnc1)c1c[nH]c(=O)cn1	1811457793	ZQZCVQYUOLSPPA-GLQYFDAESA-N	438.257	1.175	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)C(=O)c2cccn2C)[C@@H]1c1cccnc1	1813478292	GXSDSMQPLMHUHX-RYRKJORJSA-N	432.908	1.563	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CN2CCSCC2)n[nH]1	1814416749	FCPHZJHLXHAOAX-DZGCQCFKSA-N	429.974	1.704	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)Cc2ccc3ncnn3c2)[nH]n1)[C@@H](O)CCl	1814871614	APETXZYORPZNCW-GJZGRUSLSA-N	431.884	1.287	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1sccc1F)CC2)c1ccc(B(O)O)cc1	1815337602	UMSSZCHMBZLYLY-LBPRGKRZSA-N	445.306	1.563	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)CNC(=O)c3ccco3)sc2C1	1815655978	IZUQHDWVURJYIX-QWRGUYRKSA-N	440.909	1.332	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)C1(C#N)CC1)CC2	1817279738	AQFSTAZWXRBRLK-ZVYABZQBSA-N	439.501	1.493	50	20	IDGD	
Cc1cc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)cn1C	1818298380	GZQIDVSKMVGZIS-LJQANCHMSA-N	435.293	1.356	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3cnn4cc(C)cnc34)sc2C1	1819091731	NQYVBYBRUNVYDU-AAEUAGOBSA-N	448.936	1.974	50	20	IDGD	
O=C(/C=C\C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](F)Br)n[nH]1)NC1CC1	1820935501	NJURNCUNAMWXMY-OPXNRTNISA-N	442.289	1.927	50	20	IDGD	
Cc1ccn(C)c1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCC(=O)NN(C)C)CC2	1821735642	SIUJRMZJTCCULV-CYBMUJFWSA-N	432.550	1.389	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2)c1ccc(O)cc1	1822230210	ZDDXEGOELNDMPQ-OAHLLOKOSA-N	437.286	1.068	50	20	IDGD	
CCc1cc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)n[nH]1	1822414368	TYAWXXUFUYDZKX-INIZCTEOSA-N	430.513	1.374	50	20	IDGD	
CCC[C@@H](NC(C)=O)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1	1823442221	JUKOAJNOLREONN-NVXWUHKLSA-N	449.556	1.080	50	20	IDGD	
CCNC(=S)NCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCBr)CC2	1824498507	BWILDKYZHDVZJF-SECBINFHSA-N	448.412	1.324	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)COc3ccc(O)nn3)sc2C1	1824561468	SDODDDAGVCPVTG-NXEZZACHSA-N	425.898	1.647	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc3ncnn3c1)CC2	1825999628	AWNUZOQQARCJOJ-RYUDHWBXSA-N	434.909	1.665	50	20	IDGD	
C[C@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)[C@H](C)n3cnnn3)sc2C1	1826985024	PNFJZAMUEHCIBQ-CIUDSAMLSA-N	428.316	1.086	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3cccc(C#N)c3)CCO2)C1	1830462341	BSYWTTGFTJQTSM-UGKGYDQZSA-N	449.935	1.201	50	20	IDGD	
CC(=O)C[C@@H](C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1	1831801007	YXUBXQLNACZBMN-FOIQADDNSA-N	443.548	1.534	50	20	IDGD	
COc1cccnc1CCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1832864236	KEPXHZFKJKSDCS-PKOBYXMFSA-N	429.876	1.014	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3nc(Cl)ccc3F)CCO2)C1	1833242195	ADLZUIMCGMSXKU-KZULUSFZSA-N	434.295	1.962	50	20	IDGD	
CCC1(C(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)CCC1	1834800224	ZRLXWNMJXVDPJK-UHFFFAOYSA-N	441.381	1.132	50	20	IDGD	
O=C(/C=C/c1cccs1)NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1834809132	IGPVLCSRACEOEK-WHLIDYPQSA-N	425.982	1.933	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)/C=N/O[C@@H]3CCCCO3)CC2)CC1)[C@@H](F)Cl	1835083935	AAVKHMZCDHUHFD-QLCJNQITSA-N	432.924	1.621	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)/C=C/c3ccccc3)CCO2)C1	1835114824	XAYBFEZFQHEYDI-BATQEMGPSA-N	437.334	1.940	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3snnc3C)CC2)CC1	1835185858	OEKOLFQSMUORTC-OAHLLOKOSA-N	429.974	1.286	50	20	IDGD	
CCc1noc(C)c1C(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836718166	IJJZGDZMOQVGIB-KRWDZBQOSA-N	427.929	1.757	50	20	IDGD	
O=C(c1cc2ncsc2[nH]1)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836718522	QQZHQOILKQEFCM-MRXNPFEDSA-N	440.953	1.836	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccn4cncc34)CCO2)C1	1837107569	IQWHLTXUIHYNDD-UWJYYQICSA-N	434.924	1.812	50	20	IDGD	
Cc1ccn(CC(=O)N2CCC(OC3CCN(C(=O)[C@@H](C)Br)CC3)CC2)n1	1837192966	AUSNHGNVAMHZKN-OAHLLOKOSA-N	441.370	1.974	50	20	IDGD	
O=C(Cc1cncnc1)N1CCC(OC2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1837197752	GLILLJGBRCBRTI-QGZVFWFLSA-N	443.317	1.708	50	20	IDGD	
C/C(=C\c1ccc(C)o1)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1	1837575849	FWQKZHJQUKOHIM-FZKUXKMZSA-N	426.897	1.047	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)COc3cc(Cl)ccn3)CCO2)C1	1837654020	IFMYIWVPWMIFNY-BEFAXECRSA-N	446.331	1.588	50	20	IDGD	
C/C(=C/C(=O)N1CCC(OC2CCN(C(=O)[C@@H](C)Br)CC2)CC1)C(=O)O	1838773533	MTADKXMFEFPNHX-YLGBQOPLSA-N	431.327	1.799	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cn(C)c4ncccc34)C2)C1	1839146241	WVXASCTUFLUTAF-UTKZUKDTSA-N	434.924	1.661	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)/C=C/C3CCCCC3)CCO2)C1	1839184355	IWAOTCDUMCWSMW-SSPLKJMRSA-N	428.957	1.833	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc4c3NC(=O)C4)CCO2)C1	1839572224	MHKGJVFFASDHCY-VGSWGCGISA-N	449.935	1.659	50	20	IDGD	
C=CCSCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](Br)CC)CCO2	1839962779	QTESHQUKBYTRAO-WMLDXEAASA-N	435.384	1.536	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(=O)c3ccccc3)C2)C1	1840031955	HRGHVRAMQUZMQC-KUHUBIRLSA-N	439.306	1.109	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)N2CC3(CCCN3C(=O)[C@H](O)CCl)C2)C1	1841353015	ZBKSAVRYLUDWAE-LSDHHAIUSA-N	429.945	1.437	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@H]2C=C[C@H](NC(=O)OC(C)(C)C)C2)C1	1841922111	KRININJMBRNDCZ-OWCLPIDISA-N	441.956	1.913	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)c2cccc3c2OC(C)(C)CC3)C1	1843299371	IPXBAPPQBJNAFB-UHFFFAOYSA-N	442.560	1.980	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC2(CCCN2C(=O)c2nc3ncccn3n2)C1	1843719831	YZPFEOJIUYVKFH-OQLLNIDSSA-N	449.421	1.827	50	20	IDGD	
Cc1ccn2c(=O)c(C(=O)N3CC4(CCCN4C(=O)[C@@H](F)Br)C3)cnc2c1	1845217840	YMOHFRWWUFWUJT-CQSZACIVSA-N	437.269	1.510	50	20	IDGD	
CC(=O)NC(C)(C)C(=O)N1CC2(CCCN2C(=O)/C(C#N)=C/c2ccc(F)cc2F)C1	1845870360	GEIMHIZBBMXCOR-CXUHLZMHSA-N	430.455	1.990	50	20	IDGD	
O=C([C@@H](O)CCl)N1CC2(CCCN2C(=O)[C@H](Br)Cc2ccccc2)C1	1845940176	BFHSLLWVTDLEJB-CABCVRRESA-N	429.742	1.796	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)c1ccc(S(C)(=O)=O)c(F)c1)C2	1846365138	CADMVQSFQVOQPU-ZDUSSCGKSA-N	432.901	1.300	50	20	IDGD	
CN1CCC(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CC1	1847303252	GISIADVEGLCMNT-ULQDDVLXSA-N	442.988	1.662	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](O)CCl)CC1	1847558300	BMALSZLYGZEOIL-LUKYLMHMSA-N	443.972	1.825	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)Cc1ccncc1	1848099929	VCDQLDNXUTZXBR-ULQDDVLXSA-N	436.940	1.958	50	20	IDGD	
O=C(COC(=O)c1ccc([N+](=O)[O-])cc1Cl)NNC(=O)[C@@H]1COc2ccccc2O1	11028634	GYLZAQXEKZVLCY-HNNXBMFYSA-N	435.776	1.392	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)CNC(=O)NCc2ccc(C)cc2)cc1	11238252	AMLICGFLGKCBMO-MRXNPFEDSA-N	428.489	1.808	50	20	IDGD	
CCOc1ccc(S(=O)(=O)Nc2ccc(C(=O)NNc3nnc(C)c(=O)[nH]3)cc2)cc1	11266155	JEFNWBYVNMDGBT-UHFFFAOYSA-N	444.473	1.430	50	20	IDGD	
Cc1cc(S(=O)(=O)Nc2ccc(C(=O)NNc3nnc(C)c(=O)[nH]3)cc2)ccc1F	11266171	RMAMDSQULZPPJV-UHFFFAOYSA-N	432.437	1.479	50	20	IDGD	
CC(=O)N[C@@H](C)C(=O)NNC(=O)c1ccc(CN(C)S(=O)(=O)c2ccc(C)cc2)cc1	26752638	XBUSTEGOTSIGHM-HNNXBMFYSA-N	446.529	1.101	50	20	IDGD	
COCCOc1cc([N+](=O)[O-])c(C(=O)NNC(=O)c2c(C)nc3ccccn23)cc1OC	28714702	WPABUAVPTAEQLW-UHFFFAOYSA-N	443.416	1.660	50	20	IDGD	
COCCCNC(=S)N(C)NC(=O)c1cccc(S(=O)(=O)N2CCCC[C@@H]2C)c1	726077529	YPPQGJXOQMKRFL-HNNXBMFYSA-N	442.607	1.737	50	20	IDGD	
NS(=O)(=O)c1ccc(CNC(=S)NNC(=O)CCSc2ccc(F)cc2)cc1	726445002	OECXMYDPPKRKOR-UHFFFAOYSA-N	442.563	1.651	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1	726522413	JDRDYMRCIOLRTG-JTQLQIEISA-N	440.254	1.904	50	20	IDGD	
C[C@@H](CC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1ccccc1F	726750503	SXPSXMIKHFJBCU-HNNXBMFYSA-N	449.504	1.801	50	20	IDGD	
Cc1[nH]c2ccccc2c1CCNC(=O)NNC(=O)c1csc(N2CCOCC2)n1	726979588	NOWLNBQDYKMYMA-UHFFFAOYSA-N	428.518	1.956	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1ccc(Br)cn1	727365231	AYXTYIGQBXOYOG-UHFFFAOYSA-N	426.296	1.520	50	20	IDGD	
CCCS(=O)(=O)Nc1ccc(C(=O)NNC(=O)c2nnc(O)c3ccccc23)cc1	728018504	NIRJHGOVHKWJNJ-UHFFFAOYSA-N	429.458	1.562	50	20	IDGD	
COc1ccc(C(=O)NNc2nc(-c3cccnc3)no2)cc1S(=O)(=O)NC(C)(C)C	728078419	FXCHJRURPQHTHG-UHFFFAOYSA-N	446.489	1.974	50	20	IDGD	
CN(C)N(C(=O)c1cccc(N2C(=O)c3ccccc3C2=O)c1)[C@@H]1CCS(=O)(=O)C1	728178793	VEDQPUPCHMHTLA-MRXNPFEDSA-N	427.482	1.593	50	20	IDGD	
CNS(=O)(=O)c1ccc(C)c(C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)c1	728209645	KPEYHKUJMZGJOB-UHFFFAOYSA-N	438.531	1.101	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3ccc(Cn4cccn4)o3)cc2)CC1	728214153	MHGVMDBRCXRFFR-UHFFFAOYSA-N	444.517	1.217	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2)c1cccc2cccnc12	728262804	MLEBMKWJJMNKBZ-UHFFFAOYSA-N	430.398	1.538	50	20	IDGD	
CCCCNC(=O)NNS(=O)(=O)c1cc(C(=O)OC)c(F)cc1Br	728507354	RIEKPZZNIIIGDQ-UHFFFAOYSA-N	426.264	1.667	50	20	IDGD	
CC(C)(C)OC(=O)Nc1cc(C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)ccc1F	730536826	WBUFUHNMYHPYPH-NSHDSACASA-N	430.458	1.304	50	20	IDGD	
O=C(CC[C@@H]1NC(=O)N(c2ccc(Cl)cc2)C1=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	730769088	XEVUXTNBGBRUAT-HNNXBMFYSA-N	445.819	1.914	50	20	IDGD	
COC1CCN(C2(CNC(=O)NNC(=O)C(=O)Nc3ccc(C)c(C)c3)CCCC2)CC1	730913632	HOLDTAUBMVCSMD-UHFFFAOYSA-N	445.564	1.996	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)c1csc(-c2ccc3c(c2)OCCO3)n1	731331002	JPMYVIAATZFHPA-UHFFFAOYSA-N	444.494	1.834	50	20	IDGD	
CCn1c(=O)nc(O)c2c(C(=O)NNC(=O)Cc3ccccc3F)cc(C3CC3)nc21	731344532	PHRYZMVYKWQSJI-UHFFFAOYSA-N	425.420	1.537	50	20	IDGD	
COc1ccc(CCN2C[C@H](C(=O)NNC(=O)c3ccccc3OC)CC2=O)cc1OC	731490993	GHMGYQSNOIUXGL-MRXNPFEDSA-N	441.484	1.565	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)N1CCN(CC(=O)N[C@H]2CCC[C@H](C)C2)CC1	731499960	SVUBDBGCQKYMEM-IRXDYDNUSA-N	431.537	1.362	50	20	IDGD	
C[C@@]12CCC(=O)N1c1ccccc1C(=O)N2CC(=O)NNC(=O)Cn1cnc2ccccc21	732259791	KJFSFPWYSPGWGB-QHCPKHFHSA-N	446.467	1.183	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)N[C@H](Cc2ccccc2)CN2CCOCC2)c1	732476757	VNOGTNUBHHCPLA-LJQANCHMSA-N	442.516	1.591	50	20	IDGD	
Cc1nnnn1[C@@H](Cc1ccc(F)cc1)C(=O)NNC(=O)c1cnn(-c2ccccc2)c1	733110304	HGIWYKHIIIMWBO-IBGZPJMESA-N	434.435	1.551	50	20	IDGD	
CC(C)c1ccc(-n2c(NNC(=O)CN3CCC(=O)NC3=O)nc3ccccc3c2=O)cc1	733364720	COQZGIVWQTZWSU-UHFFFAOYSA-N	448.483	1.894	50	20	IDGD	
O=C(NC[C@H]1CCCN1Cc1ccccc1)NNC(=O)c1csc(N2CCOCC2)n1	734162670	GFLSGNWUSZQYMR-QGZVFWFLSA-N	444.561	1.588	50	20	IDGD	
COCCOC1CCN(C(=O)NNC(=O)c2ccc(OC)c(Br)c2)CC1	735100981	NWWYLIMGYVOGFI-UHFFFAOYSA-N	430.299	1.940	50	20	IDGD	
C[C@H](CC(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1)c1ccc(F)cc1	735118327	RZZASKPMJDWHBM-OAHLLOKOSA-N	435.525	1.794	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCC(C(=O)NNc3cc(C)nc(C)n3)CC2)cc1OC	736718283	HLLAQDSDXLNAQH-UHFFFAOYSA-N	449.533	1.655	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)CNC(=O)c2ccc3c(c2)OCO3)cc1C	736757312	NCRQCNDLANCYNJ-UHFFFAOYSA-N	447.469	1.082	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)CCS(=O)(=O)C2CCCC2)cc1C	736787871	WCNROCQVWGXBMG-UHFFFAOYSA-N	430.548	1.671	50	20	IDGD	
O=C(NNC(=O)[C@H](c1cccc(F)c1)N1CCOCC1)c1cc(Br)c[nH]1	742036983	RGTYWUNBRUMCMZ-HNNXBMFYSA-N	425.258	1.751	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H]1CC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	742535372	QKURIUJACHVANY-AWEZNQCLSA-N	425.507	1.641	50	20	IDGD	
NC(=O)c1cc(C(=O)NNC(=O)c2cccc(Br)c2)nn1-c1ccccc1	742772822	GDLTYYWUFVPDGY-UHFFFAOYSA-N	428.246	1.809	50	20	IDGD	
Cc1ccc([C@H](CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)N(C)C)cc1	743334346	UZVSZFDUKORMCJ-KRWDZBQOSA-N	432.550	1.535	50	20	IDGD	
CCO[C@H](C)c1noc(CN2CCN(C(=O)NNC(=O)COCc3ccccc3)CC2)n1	743625977	ZYPPAJMPJJDKEY-MRXNPFEDSA-N	446.508	1.242	50	20	IDGD	
O=C(NCc1ccco1)NNC(=O)c1ccc(S(=O)(=O)NCc2cccs2)cc1	743900675	AFEWBHOQTPDQLC-UHFFFAOYSA-N	434.499	1.964	50	20	IDGD	
Cc1ccc(/C=C(\C#N)C(=O)O[C@H](C)C(=O)NCCc2ccc(S(N)(=O)=O)cc2)cc1	744502057	MQCYUBVEVOMBIQ-CXDFQFJYSA-N	441.509	1.840	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)NC[C@@H](c2ccc(Cl)cc2)N2CCOCC2)n1	744866032	OKQSJYWHBBKMIP-SFHVURJKSA-N	434.928	1.557	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)c2ccc(Cl)c(NS(C)(=O)=O)c2)c2ccccc2c1=O	747145401	YHUKUPCTGPYPCJ-UHFFFAOYSA-N	449.876	1.033	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)CNC(=O)c2ccco2)ccc1NS(=O)(=O)C(F)(F)F	747373194	WINORYYEQGHFQU-UHFFFAOYSA-N	448.379	1.041	50	20	IDGD	
COc1cc(OC)cc(N2CC[C@H](NC(=O)NNC(=O)Cc3ccccc3F)C2=O)c1	747954681	KPFXHFAGXMFLQY-SFHVURJKSA-N	430.436	1.521	50	20	IDGD	
CN(CC(=O)NNc1ccc([N+](=O)[O-])cc1Cl)S(=O)(=O)c1cccc([N+](=O)[O-])c1	748725757	MEDYSOMGUFKGLX-UHFFFAOYSA-N	443.825	1.920	50	20	IDGD	
CCn1cc(S(=O)(=O)NC(=O)/C(C#N)=C\c2cc(C)n(C[C@H]3CCCO3)c2C)cn1	749216278	GYZSQCOSBIGBTA-ZTXRYZOMSA-N	431.518	1.912	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NCCNC(=O)c2cccc(Br)c2)cc1	750331680	VHCHRPXDDHNSGJ-UHFFFAOYSA-N	449.305	1.897	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2ccc(OCCCOC)nc2)c2ccccc2c1=O	750717990	LCNQLGOMOLJXBO-UHFFFAOYSA-N	439.472	1.692	50	20	IDGD	
C[C@@H]1C[C@@H](NC(=O)NNC(=O)CNC(=O)c2cccs2)CCN1Cc1ccccc1	751098325	GADRMQZQCFUBCG-WBVHZDCISA-N	429.546	1.861	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NN=C1CN(C)C[C@@H]1C)N(S(C)(=O)=O)CC2	752163334	VGKIQOKNGQPFPJ-SUMWQHHRSA-N	438.550	1.006	50	20	IDGD	
O=C(CNc1ccccc1)NNC(=O)[C@H]1CC(=O)N(CCOc2ccccc2Cl)C1	752610790	GVFWDDSMHXVTFK-HNNXBMFYSA-N	430.892	1.827	50	20	IDGD	
CN1C(=O)N[C@@]2(CCC[C@H]2CNC(=O)NNC(=O)CSc2ccc(Cl)cc2)C1=O	753024645	OQEVBTAOBFCVPD-BBATYDOGSA-N	439.925	1.483	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)N[C@H]2CCN(Cc3ccc(C#N)cc3)C2=O)cc1	753291497	WYRLIKUHABHECI-FQEVSTJZSA-N	435.484	1.631	50	20	IDGD	
Cc1oc(C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)cc1S(=O)(=O)N(C)C	753602030	PRIDTOFCRLDTGI-UHFFFAOYSA-N	442.519	1.036	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNc2ncnc3ccsc23)c(C)c([N+](=O)[O-])c1	753839685	BGPLTHTUFSLQNI-UHFFFAOYSA-N	430.402	1.776	50	20	IDGD	
Cc1nn(C)c(C)c1S(=O)(=O)N[C@@H](C)C(=O)NNc1ccc(-c2ccccc2)nn1	754471073	WHBBVXOCMVJTTO-ZDUSSCGKSA-N	429.506	1.304	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)Nc1ccc(I)cc1	755361161	HUIUSDHCQQHNCY-UHFFFAOYSA-N	449.212	1.733	50	20	IDGD	
COC(=O)CCNC(=O)c1ccc(NC(=O)NNC(=O)COc2cc(C)cc(C)c2)cc1	755601885	AODKUAZVPZKMLZ-UHFFFAOYSA-N	442.472	1.828	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)Nc1cccc(OCC(=O)N2CCCC2)c1	755655760	LWOJPUUAAAIWGA-UHFFFAOYSA-N	437.456	1.791	50	20	IDGD	
CC(C)S(=O)(=O)c1ccccc1NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1	756525464	BUSWAUIFPQQISR-UHFFFAOYSA-N	446.533	1.728	50	20	IDGD	
Cc1cc(S(N)(=O)=O)cc(NC(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)c1C	756633374	HTUGILKPRFQXPZ-UHFFFAOYSA-N	434.503	1.869	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1cccc(CN(C)C(=O)OC(C)(C)C)c1	756665959	XJWUVABLIVJBKG-LBPRGKRZSA-N	443.526	1.144	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2cncc(NC(C)=O)c2)cc1N1CCOC1=O	756813914	UYJWMDNKWAYKDS-UHFFFAOYSA-N	428.405	1.472	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)Nc2cc(C(N)=O)ccc2CN(C)C)cc1	756827141	PCWHSWAAISCTAI-AWEZNQCLSA-N	441.488	1.670	50	20	IDGD	
CC(C)(C)OC(=O)NCC1(C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)CCCC1	757174795	DIOHUWCKVJENFF-UHFFFAOYSA-N	444.488	1.948	50	20	IDGD	
NC(=O)c1ccc(NNC(=O)c2ccccc2NS(=O)(=O)c2ccc(Cl)cc2)nn1	757403625	DLRHEWUIEGPIBG-UHFFFAOYSA-N	446.876	1.787	50	20	IDGD	
CNC(=O)Cn1nc(NC(=O)NNC(=O)c2ccc(OC)c(Br)c2)cc1C	757824042	WMQVPGNEESLTGZ-UHFFFAOYSA-N	439.270	1.175	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)Nc2c(C)nn([C@@H]3CCS(=O)(=O)C3)c2C)cc1C	757870827	ACACYHYYXACODN-MRXNPFEDSA-N	449.533	1.708	50	20	IDGD	
O=C(c1ccnc(Br)c1)N1CCN(S(=O)(=O)CBr)CC1	758522310	FQRLFGLUVWIYJU-UHFFFAOYSA-N	427.118	1.284	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)N[C@H]1CN(C(=O)OC(C)(C)C)C[C@H]1C#N	758772106	PLKBUTVGCPMQBC-KGLIPLIRSA-N	433.465	1.163	50	20	IDGD	
CCCC(=O)N1CCC[C@@H]1C(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758785181	BWOUTXTYGFFLDX-OAHLLOKOSA-N	425.530	1.413	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCN(c2cc(Cl)ccc2Cl)C1=O)C(=O)Nc1ccccn1	758831610	RNJGVBDEDKHNDA-LLVKDONJSA-N	436.255	1.527	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2cc(C(=O)NNc3ncc(F)cn3)ccc2Cl)C[C@@H](C)O1	760922060	AUZBDAHXRUSXEK-PHIMTYICSA-N	443.888	1.824	50	20	IDGD	
COc1ccc(C(=O)OCC(=O)NNC(=O)Cc2nc(C)cs2)cc1Br	762318091	XCRGWMNXEXUEJW-UHFFFAOYSA-N	442.291	1.770	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)Nc3nccs3)cc2)cc1	763030994	RMLGWOCFIPEOGB-UHFFFAOYSA-N	427.467	1.890	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(N2CCCC2=O)c(F)c1	763442024	KJKKJVHBEYMZIA-UHFFFAOYSA-N	429.364	1.260	50	20	IDGD	
Cn1ccnc1[C@](O)(CCNC(=O)NNC(=O)CSc1ccccc1O)C(F)(F)F	763477527	RXAXRUQXWWTIFJ-MRXNPFEDSA-N	447.439	1.388	50	20	IDGD	
CON(C)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2Br)cc1	763482558	HXJKIOPVHGJCRB-UHFFFAOYSA-N	449.261	1.482	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(OCCCC#N)c2)cc1OC	763551407	WMSHHKWDVOPLNK-UHFFFAOYSA-N	426.429	1.786	50	20	IDGD	
CC(C)(C)c1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc3c(c2)C(=O)NCC3)cc1	763596268	TWIWRXSQHHLNDE-UHFFFAOYSA-N	438.484	1.435	50	20	IDGD	
CC(C)(C)c1ccc(OCC(=O)NNC(=O)C(=O)Nc2cnn(-c3ccccc3)n2)cc1	763599041	ADVDKTPFSKDUNO-UHFFFAOYSA-N	436.472	1.730	50	20	IDGD	
COC(=O)COc1cccc(NC(=O)C(=O)NNC(=O)COc2ccc(C)c(C)c2)c1	763668072	YGNNPRDJWCLRNL-UHFFFAOYSA-N	429.429	1.020	50	20	IDGD	
CCOc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NNC(=O)COc1ccccc1F	763681905	KJVMELCFOMHLSO-UHFFFAOYSA-N	446.435	1.091	50	20	IDGD	
CCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2CC)c(C)c1	763712391	GDYXRTRRRREGQR-UHFFFAOYSA-N	426.473	1.472	50	20	IDGD	
COc1ncncc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccco2)nc2ccccc12	763763565	LHOHTPOEPFVYSO-UHFFFAOYSA-N	432.396	1.693	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)C(=O)Nc1ccc(F)c(C(F)(F)F)c1	763804443	SRHJVKIEPZDAKJ-UHFFFAOYSA-N	444.297	1.918	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(NC(=O)[C@H](C)n3cncn3)cc2)cc1	763831332	VJZUUTNJEKXCAI-AWEZNQCLSA-N	449.471	1.440	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2nn(C(C)(C)C)cc2C#N)cc1	763859307	AJUMDIROSORDEG-ZDUSSCGKSA-N	442.476	1.462	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cccc(N(C)C(C)=O)c2)cc1	763859722	FLYNWOINLCTQOW-AWEZNQCLSA-N	442.472	1.621	50	20	IDGD	
Cc1ncc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(Br)c2)s1	763880759	ASOKRLKZXGBCAF-MRVPVSSYSA-N	427.280	1.767	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)C(=O)Nc2ccc3c(c2)NC(=O)[C@@H](C)O3)cc1	763898223	NUAJENWJZIPQDT-GFCCVEGCSA-N	428.470	1.593	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(F)c2C(=O)OC)cc1OC	763902717	PEKLJIJWHVGAFB-UHFFFAOYSA-N	433.392	1.419	50	20	IDGD	
CC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)cc1Cl	763994931	ARGUETWWVGLZTB-UHFFFAOYSA-N	442.657	1.789	50	20	IDGD	
CNC(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)c1	763995288	PKKWTOVXWQRTLL-UHFFFAOYSA-N	442.657	1.190	50	20	IDGD	
COCCn1nc(C)c(NC(=O)C(=O)NNC(=O)c2cccc(Br)c2)c1C	764062759	CPCUEWWMQFJGSH-UHFFFAOYSA-N	438.282	1.309	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)CCc2ccccc2)cc1N1CCOC1=O	764202547	VJYJMVRWAJKZJI-UHFFFAOYSA-N	426.429	1.371	50	20	IDGD	
Cc1ncsc1C(=O)NNC(=O)C(=O)Nc1ccccc1CN1C[C@@H](C)O[C@H](C)C1	764245673	IQYGEEAOXKZYMX-CHWSQXEVSA-N	431.518	1.460	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)Cc2ccccn2)sc2c1CC[C@@H](C)C2	764263772	IWMGBQUHGLNHKS-GFCCVEGCSA-N	444.513	1.773	50	20	IDGD	
C[S@@](=O)c1cccc(NC(=O)C(=O)NNC(=O)c2cc(Br)ccc2O)c1	764276877	HPTVSQVHPSLUAA-AREMUKBSSA-N	440.275	1.292	50	20	IDGD	
O=C(Cc1cc[nH]n1)NNC(=O)C(=O)Nc1ccc(Br)c(Cl)c1Cl	764297371	PTYIJFMRZQKTBM-UHFFFAOYSA-N	435.065	1.808	50	20	IDGD	
Cc1cc(C(=O)NC(C)C)ccc1NC(=O)C(=O)NNC(=O)c1ccc(O)c(Cl)c1	764346371	YIPVMXOQZJAVIT-UHFFFAOYSA-N	432.864	1.892	50	20	IDGD	
COC(=O)c1cc(F)ccc1NC(=O)C(=O)NNC(=O)CSc1ccccc1OC	764392644	JOVLVEWKNGMNMZ-UHFFFAOYSA-N	435.433	1.499	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1ccccc1O[C@H]1CCOC1	764393513	PQQFAFNWZLCADE-AWEZNQCLSA-N	445.497	1.741	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)cn1	764518607	GDDKJSYRMAWFHN-UHFFFAOYSA-N	448.980	1.879	50	20	IDGD	
COc1ccc(CCCC(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cc1	765739527	XDMFYAITOCQEKH-UHFFFAOYSA-N	438.528	1.623	50	20	IDGD	
COCCc1noc(-c2cc(Cl)ccc2NC(=O)C(=O)NNc2nccnc2OC)n1	766261375	WIISFXSRHUJGDJ-UHFFFAOYSA-N	447.839	1.459	50	20	IDGD	
Cc1nc2nc(N)nn2c(C)c1CCC(=O)NNC(=O)c1cc(-c2cccs2)[nH]n1	768260636	LYOXIICNCSBIDS-UHFFFAOYSA-N	425.478	1.169	50	20	IDGD	
COc1ccc(NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c([N+](=O)[O-])c1	768332523	WHTZYLIOFOFYAI-UHFFFAOYSA-N	436.446	1.381	50	20	IDGD	
NS(=O)(=O)c1cccc2c(C(=O)NNC(=S)NCCc3cccs3)nccc12	768469173	RHTDJMDZQOGERZ-UHFFFAOYSA-N	435.556	1.295	50	20	IDGD	
O=C(NNC(=S)Nc1ccccn1)c1cccc(S(=O)(=O)NC[C@H]2CCCO2)c1	768578087	NILMCEZORXXDHL-CQSZACIVSA-N	435.531	1.170	50	20	IDGD	
O=C(Cc1ccccn1)NNC(=O)C(=O)Nc1cnn(-c2ccccc2)c1C(F)(F)F	769263966	ACNLSGSNISUDAJ-UHFFFAOYSA-N	432.362	1.615	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)N[C@H](C)CNC(=O)OC(C)(C)C)c2ccccc2c1=O	769532829	RJBWVHSFGLFOTB-CYBMUJFWSA-N	446.508	1.835	50	20	IDGD	
O=C(Cc1cc(F)ccc1Br)NNC(=O)C1CCN(c2ncccn2)CC1	771256221	MGONSGUSWJLRRW-UHFFFAOYSA-N	436.285	1.985	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)N[C@H]1CCO[C@@]2(CCOC2)C1	771442538	MRLKUIAZMCGXTE-GUYCJALGSA-N	428.283	1.496	50	20	IDGD	
O=C(NNc1ccnc(Br)c1)c1sccc1S(=O)(=O)N1CCOCC1	771561168	LSSSPJUBBDTTHT-UHFFFAOYSA-N	447.336	1.683	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1cc(I)c(F)cc1F	772209140	YGRBJKXOIMYJBU-LURJTMIESA-N	426.157	1.672	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2)cc1N1CCCS1(=O)=O	773642855	GUFUYECSIXJJNF-UHFFFAOYSA-N	433.446	1.525	50	20	IDGD	
N#Cc1cccc(NNC(=O)C(=O)N2C[C@@H](C(=O)N3CCCCC3)Oc3ccccc32)c1	773686252	ULNSCNBQXVXOHO-FQEVSTJZSA-N	433.468	1.808	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)NCCC(=O)NNc2cnc3ccccc3n2)cc1	774773440	FSYRVVQIZJTGFS-UHFFFAOYSA-N	428.474	1.400	50	20	IDGD	
Cc1nc(-c2c(C)c(C)nn(C)c2=O)sc1C(=O)NNc1cccc(S(C)(=O)=O)c1	776528894	ZHFWZINLBYHGJJ-UHFFFAOYSA-N	447.542	1.989	50	20	IDGD	
CCc1cnccc1CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	779409462	LBVWEOFPRXRXLQ-UHFFFAOYSA-N	445.545	1.963	50	20	IDGD	
COc1cc(OC)c(Cn2nccc2NC(=O)NNC(=O)c2cnccn2)c(OC)c1	779484144	XVOHQSAXOLRZTK-UHFFFAOYSA-N	427.421	1.214	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@@H](C(=O)NNC(=O)c2cccc3ncccc23)[C@H](C)O)cc1	779513703	IJNCXRVVRSXBBW-IFXJQAMLSA-N	442.497	1.032	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2CC(=O)N(c3ccc(F)c(C)c3)C2)cc1C	779871294	FLQPMZORNUYSNT-OAHLLOKOSA-N	426.448	1.890	50	20	IDGD	
O=C(NN=c1cc[nH]cc1)c1cccc(S(=O)(=O)NCc2ccc3c(c2)OCO3)c1	780756592	OJUVWHGJQMGIRX-UHFFFAOYSA-N	426.454	1.468	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CCC[C@H](NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)C1	782547575	XWSPVGNQMVHZRZ-LSDHHAIUSA-N	444.496	1.442	50	20	IDGD	
CCCNC(=O)[C@@H]1CN(C(=O)C(=O)NNc2cccc([N+](=O)[O-])c2)c2ccccc2O1	784832005	WZMMQSBSUZFYPV-KRWDZBQOSA-N	427.417	1.358	50	20	IDGD	
CCN(CC)CCNC(=O)c1cccc(NC(=O)C(=O)NNc2cc(Cl)ccn2)c1	784856842	XFKPZIZBPTWHRL-UHFFFAOYSA-N	432.912	1.888	50	20	IDGD	
N#CCOc1cc(F)ccc1NC(=O)C(=O)NNc1c(F)cc(C(=O)NC2CC2)cc1F	785100713	YBEXUMOLGARZAN-UHFFFAOYSA-N	447.373	1.980	50	20	IDGD	
CC(C)(O)C(=O)NNC(=O)C1CCN(S(=O)(=O)c2cccc(C(F)(F)F)c2)CC1	787947294	NHGAKGKGUCBQGN-UHFFFAOYSA-N	437.440	1.024	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@H]2C[C@@H]2c2cc(OC)ccc2OC)c2ccccc2c1=O	788084131	YTKHYYOTAZUABK-AEFFLSMTSA-N	436.468	1.998	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)c2cnc(Br)c(Cl)c2)c1	790240655	BZOMVAPBEAVGPU-UHFFFAOYSA-N	432.683	1.976	50	20	IDGD	
COc1cc(C(F)(F)F)ncc1NC(=O)C(=O)NNC(=O)COc1ccc(C#N)cc1	792267999	JSRKJWDUQSKRCC-UHFFFAOYSA-N	437.334	1.146	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)CC(F)(F)F)cc(N2CCN(C(C)C)CC2)c1	792268161	JTTPCCQJBYLSJC-UHFFFAOYSA-N	429.443	1.564	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)[C@H]3CCN(CC(F)(F)F)C3)n[nH]2)cc1OC	792280191	DHQKQEDIKKBAEM-LBPRGKRZSA-N	441.410	1.739	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)[C@H]2CC(c3cc(OC)ccc3OC)=NO2)nc1C	792301592	QZQKQWWGMLASKX-QGZVFWFLSA-N	429.433	1.615	50	20	IDGD	
O=C(NNc1nc2ccccn2n1)C(=O)Nc1ccnc(OCC(F)(F)C(F)F)c1	792391466	APDQFNQVIFQSIM-UHFFFAOYSA-N	427.318	1.485	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)[C@@](C)(O)CSc2cccc(F)c2)c2ccccc2c1=O	794774070	CDGGFJSZHJCZRR-FQEVSTJZSA-N	430.461	1.377	50	20	IDGD	
Cc1cc(Cn2nnc(C(=O)OCC(=O)NNC(=O)c3cccc(Cl)c3)c2C)on1	796531666	WOTJJBMTYRVRNC-UHFFFAOYSA-N	432.824	1.203	50	20	IDGD	
CC1(C)Cc2cccc(NC(=O)C(=O)NNC(=O)CNC(=O)OCc3ccccc3)c2O1	797369400	UXGOXPGDJDDBLZ-UHFFFAOYSA-N	440.456	1.412	50	20	IDGD	
C[C@@H](c1cccc(S(N)(=O)=O)c1)N(C)C(=O)NNC(=O)c1cc(Br)c[nH]1	799856614	CKISQXLRJHVRJQ-VIFPVBQESA-N	444.311	1.472	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N[C@H]2CCN(C(=O)Nc3ccccc3)C2)cc1OC	800987371	WSIYGUPWHLOTMV-INIZCTEOSA-N	427.461	1.954	50	20	IDGD	
O=C(N=c1cc[nH]cc1)NNC(=O)c1cccc(S(=O)(=O)Nc2ccc(F)cc2)c1	802031749	LHNNJBSRNNRLMR-UHFFFAOYSA-N	429.433	1.910	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)[C@H](Cc2cccc(OC)c2)n2nnnc2C)cc1	802055476	RHWZUOCKRCSWAR-SFHVURJKSA-N	425.449	1.635	50	20	IDGD	
Cc1ccc(C)c(S(=O)(=O)NCCC(=O)NNC(=O)Nc2ccc3c(c2)OCO3)c1	802102193	GPHXSIYOIUVVQM-UHFFFAOYSA-N	434.474	1.553	50	20	IDGD	
C[C@H](CCNS(=O)(=O)c1ccccc1)NC(=O)NNC(=O)COc1ccc(F)cc1	802529056	OTAXOQWZLKYTGB-CQSZACIVSA-N	438.481	1.292	50	20	IDGD	
C[C@H](NS(=O)(=O)c1ccc(Cl)cc1)C(=O)NNC(=O)c1cc(Cl)ccc1O	802592571	GWYGBNLFASIXQG-VIFPVBQESA-N	432.285	1.827	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)c1ccc(F)c(S(=O)(=O)N2CCCC2)c1	804951794	YRDTYPWOCILLNZ-UHFFFAOYSA-N	431.453	1.343	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(C#N)c(Br)c2)cc1	806973372	NKXQUWHWZBRUBJ-UHFFFAOYSA-N	447.245	1.494	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)C(=O)Nc2c(C)c(C(F)(F)F)nn2C)cc1	806975445	ZEXIKDAFFDNRIW-UHFFFAOYSA-N	429.424	1.934	50	20	IDGD	
COc1ccnc(NNC(=O)NCc2cccc(N3C(=O)N[C@@](C)(C4CC4)C3=O)c2)n1	807236398	LEQLHPQTWRABOE-FQEVSTJZSA-N	425.449	1.536	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCc2ccc(C[S@@](C)=O)cc2)nc1	807559914	YCVUXGFUMLVPLT-MUUNZHRXSA-N	439.563	1.473	50	20	IDGD	
Cc1nn(C)cc1S(=O)(=O)NNC(=O)c1nn(CCC(C)C)c(=O)c2ccccc12	808069639	CWRDLWXFDPSUKJ-UHFFFAOYSA-N	432.506	1.108	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](N2CCN(C(=O)NNC(=O)c3ccc(C#N)cc3)CC2)C1	808255319	GYCTXUUXFHFFGB-SFHVURJKSA-N	442.520	1.540	50	20	IDGD	
Cc1nc2ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc3ccc4ccccc4c3)cn2n1	810386435	ZUSIYDRWOBCPHA-ZDUSSCGKSA-N	432.440	1.744	50	20	IDGD	
O=C(NC[C@@H]1COc2ccccc21)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	812443464	SWZXUPRYMJYJIV-MRXNPFEDSA-N	444.513	1.591	50	20	IDGD	
CC(C)CC(=O)NNC(=O)C(=O)Nc1ccc2c(c1)CN(C(=O)OC(C)(C)C)CCO2	812978766	BVUKMURXYHMWPK-UHFFFAOYSA-N	434.493	1.948	50	20	IDGD	
COC(=O)c1cn(-c2cccc(NC(=O)NNC(=O)COc3ccc(C)c(C)c3)c2)nn1	812980996	IGGMBYGYYKADLS-UHFFFAOYSA-N	438.444	1.902	50	20	IDGD	
COC(=O)c1cn(-c2cccc(NC(=O)NNC(=O)CCc3ccc(OC)cc3)c2)nn1	812982702	YHFHMOGGOZPPMY-UHFFFAOYSA-N	438.444	1.848	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NN=C1CCOC1(C)C)N(S(C)(=O)=O)CC2	814758451	AVKLDJIVFMDABA-OAHLLOKOSA-N	439.534	1.624	50	20	IDGD	
O=C(CSc1nnc(O)nc1O)NN=C1COc2cc(OCc3ccccc3)ccc21	814785495	ZOENDXDMRWNRTM-UHFFFAOYSA-N	439.453	1.867	50	20	IDGD	
Cc1nc(Cn2nnc(NC(=O)C(=O)NNC(=O)c3ccc(C(C)(C)C)cc3)c2C)no1	815565799	ARHZRYGWMWASQH-UHFFFAOYSA-N	440.464	1.023	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCc2nncn2C1)C(=O)Nc1ccccc1Sc1ccccc1	815691994	HBNFENXRVLQYAA-AWEZNQCLSA-N	436.497	1.778	50	20	IDGD	
CCc1nc(C(C)C)ccc1C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	815826995	ICXNTVVBNQSRNX-UHFFFAOYSA-N	437.544	1.986	50	20	IDGD	
CC(C)[C@@H](NS(=O)(=O)c1ccc2c(c1)OCCCO2)C(=O)NNC(=O)CC1CC1	819123120	QAGYKWAVFULKEY-GOSISDBHSA-N	425.507	1.098	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(/C#N)C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c1C	894394034	IPUNJPIDOMWIGI-HNIBHBHRSA-N	448.487	1.656	50	20	IDGD	
C[C@@H](Oc1ccccc1Cl)C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	914587032	MYJGOFQIWUBMFO-PXAZEXFGSA-N	434.832	1.638	50	20	IDGD	
O=C(NCc1ccc(C(=O)N2CCOCC2)cc1)NNC(=O)c1cccc([N+](=O)[O-])c1	916247792	BDYXRQBYJKJDJH-UHFFFAOYSA-N	427.417	1.211	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)NCc1ccccc1CN1CCCC1=O	916413702	JKKQIOBJSADMLG-UHFFFAOYSA-N	441.444	1.627	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NC[C@H](C)N2CCC[C@@H](C)C2)nc1	916450226	HNYBOPLFWQPCMY-CVEARBPZSA-N	426.587	1.859	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCc1cccc(C(=O)N(C)C)c1	916484120	TVVLZVIGJLFMAC-UHFFFAOYSA-N	446.533	1.134	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)NC[C@@H](c2ccccc2)N2CCOCC2)cc1C	916511234	OSOKSEIFKXJHHB-FQEVSTJZSA-N	439.516	1.646	50	20	IDGD	
Cc1cccc(N2CCN(CCCCNC(=O)NN[C@@]3(C)CCS(=O)(=O)C3)CC2)c1	916513529	AYJPPHGTXSPART-NRFANRHFSA-N	437.610	1.278	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCCCN(C)CC(F)(F)F)c2ccccc2c1=O	916581121	JXGJVGGXZFSNCB-UHFFFAOYSA-N	428.415	1.245	50	20	IDGD	
CCOc1ccc(/C=C(\C#N)C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1	916599090	GGMZLLJJDDWXOT-LFIBNONCSA-N	438.396	1.905	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2cc(C(=O)O)c(C)cc2C)cc(OC)c1OC	917717616	LCUZTDQPIYLHLK-UHFFFAOYSA-N	438.458	1.651	50	20	IDGD	
Cc1nccc(CNC(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)n1	918106823	PRMSHXMDHDCGBL-UHFFFAOYSA-N	446.514	1.792	50	20	IDGD	
Cc1ccn2cc(CNC(=O)NNC(=O)c3sc(N4CCOCC4)nc3C)nc2c1	918236250	YZTZWBBRWQZIRZ-UHFFFAOYSA-N	429.506	1.388	50	20	IDGD	
CCOc1ccc(NC(=S)NNC(=O)c2nc3ncc(Br)cn3n2)cc1	919810958	AKLVBQFVDQRDNJ-UHFFFAOYSA-N	436.295	1.917	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)[C@@H]2CCCN2C(=O)/C=C/c2ccc(C(N)=O)cc2)cc1	920023254	YMBYYNOFTCXRCO-PCLFDXGNSA-N	434.496	1.813	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@@H]2CCCN(C(=O)C(C)(C)C)C2)c2ccccc2c1=O	920338021	FZZKWPQHKNQACQ-CQSZACIVSA-N	427.505	1.462	50	20	IDGD	
Cc1cccc(C(=O)Nc2ccccc2C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)c1	920745868	QIMLYNAYMQUQCN-OAHLLOKOSA-N	430.486	1.378	50	20	IDGD	
CC(C)CO[C@@H](C)C(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	920805938	VUTNQUUGNXIWKC-INIZCTEOSA-N	433.530	1.987	50	20	IDGD	
CCCNC(=O)NNC(=O)c1ccc(Cl)c(S(=O)(=O)N2C[C@H](C)O[C@@H](C)C2)c1	921042959	XAIYACJDVDGUJB-RYUDHWBXSA-N	432.930	1.492	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2ccc(S(C)(=O)=O)c(Br)c2)cc1	1116446148	YHKKCMKUGBFBJH-UHFFFAOYSA-N	427.276	1.936	50	20	IDGD	
CS(=O)(=O)c1ccc(OCCCCC(=O)NNC(=O)c2n[nH]c3c2CCCC3)cc1	1318114937	GBYALAFUWKQEDY-UHFFFAOYSA-N	434.518	1.702	50	20	IDGD	
COC(=O)c1ccc(CCNC(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1	1318918149	DOHJVILUNXOJMC-UHFFFAOYSA-N	448.520	1.993	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)Cc2ccc(S(=O)(=O)NC)cc2)cc1	1320158198	IYRBKZONFZVTBQ-CQSZACIVSA-N	435.502	1.151	50	20	IDGD	
C[C@@H](Cn1cncn1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@](C)(Cl)CCl)C2	1779500547	QDTDPLXXGHZLHT-OSGQAZFXSA-N	446.379	1.664	50	20	IDGD	
CSCC[C@H](O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Br)C1	1780777467	SQEMDZYGBZXYCF-RSUWNVLCSA-N	441.363	1.305	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(OC)c(N(C)C)c3)C2)C1	1781129045	ZSASMHQTLGIPJY-KKSFZXQISA-N	439.940	1.459	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)C(=O)Nc3cccnc3)CCO2)C1	1781229784	JLFLZCMGYXCVDM-ROUUACIJSA-N	429.304	1.086	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)Cc3ccc(C)c([N+](=O)[O-])c3)C2)C1	1781306061	ACZPKMIPGZRTJO-OXQOHEQNSA-N	439.896	1.529	50	20	IDGD	
O=C(c1ccc(C(F)(F)F)c(F)c1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1781619498	DWRRLICADNQWPC-WMLDXEAASA-N	438.805	1.888	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C[C@](C)(O)CC(=O)O)C1	1782203192	NROVIGPRTXDXJQ-XWYPRVOQSA-N	432.945	1.524	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H]3Cc4ccccc4N3)C2)C1	1782838034	WVMNNCDTUNDRPE-CFLQYTFWSA-N	436.350	1.884	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)C(C)(C)CNC(C)=O)CCO2	1783343476	NJAOJALYGIGPNR-KBXCAEBGSA-N	432.359	1.152	50	20	IDGD	
COc1cccc(CC(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](C)Br)C3)C2)n1	1783530385	XDFWWEFZQTVBEU-UGSOOPFHSA-N	426.311	1.246	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)COCc3ccc(OC)cc3)CCO2)C1	1783879431	SVQDFBISDDHEAK-GHTZIAJQSA-N	440.924	1.296	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]3C2)c(C(F)(F)F)o1	1784087149	ZSAUGSGAYOLNEP-PYJNHQTQSA-N	438.830	1.800	50	20	IDGD	
CN(C)c1ccc([N+](=O)[O-])c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]3C2)c1	1787447694	CPBLCBLJHMYIGO-GQGQLFGLSA-N	442.875	1.789	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc4c3OCCO4)[C@H]2C1	1787941787	OIHZQBWGFURJST-IEZWGBDMSA-N	448.592	1.903	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CC[S@@](=O)CC)[C@H]2C1	1788490373	BPSFLEPAIQSSBH-SHNGGNKPSA-N	437.400	1.298	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(C)(C)n3nc(C)ccc3=O)[C@H]2C1	1788731562	PUNBEHQEXHOMOB-NXOAAHMSSA-N	438.956	1.284	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cncc4cnccc34)[C@H]2C1	1789173023	JSIFPLDSASWABD-YFYLHZKVSA-N	432.908	1.477	50	20	IDGD	
C[C@]1(C(=O)NC2(c3ccc(NC(=O)c4cnccc4C(=O)NN)cc3)CCC2)CCCN1	1789521674	CFDVDTPAYQAERB-JOCHJYFZSA-N	436.516	1.575	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(C(=O)O)n(C(C)C)n3)C[C@@H]21	1789858753	MOHYXESIGPCOAV-WSMBLCCSSA-N	440.928	1.773	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)C[C@@H]21	1789864492	UIIOLIHPKPVTFF-AIMMBMPESA-N	438.908	1.814	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccn4cncc34)C[C@@H]21)[C@@H](F)Br	1789926052	LMEVVOPROFPVSI-DLKVLKDVSA-N	439.285	1.618	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)Cc3ccccc3)[C@H]2C1	1790956107	PZZMNJZSCAMVAB-HAGHYFMRSA-N	434.609	1.421	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)n3cccn3)C[C@@H]21	1790963737	LAPKLXVYIKGKNJ-GVRJEKJASA-N	427.343	1.597	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/c3cnc[nH]3)C[C@@H]21	1790963920	OJJUFIUBBADMST-ZDQDDMNOSA-N	425.327	1.576	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3CCc4ccccc4O3)[C@H]2C1	1791231221	ZOZWXAFDFMKNPT-GCLMUHHRSA-N	436.936	1.614	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3(c4ccc(O)cc4)CC3)C[C@@H]21	1791248950	CNHXSTQMAAMSGL-QZHFEQFPSA-N	436.936	1.657	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)nc4ccccc34)C[C@@H]21	1791253611	GEXOACOAKWEBQD-UHEFJODHSA-N	447.919	1.788	50	20	IDGD	
CC(C)(C)OC(=O)N1CC2(C[C@@H]2C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](O)CCl)C1	1793116051	FXMDVBYJODJHCB-YIDVYQOGSA-N	441.956	1.481	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccn(C(F)F)c1=O)C2	1793449539	YABOYPPCDIPBEW-NEBZKDRISA-N	431.867	1.854	50	20	IDGD	
COc1ccc(CCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)cc1	1795511734	KVTCVURRAKJNBT-WKCHPHFGSA-N	436.317	1.260	50	20	IDGD	
C=CC[C@H](C(=C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1	1796442065	PPSVGOAMXIEQLX-KNTBSYDBSA-N	441.532	1.478	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2)c1csc(Br)n1	1796689504	SINXGGGJSDXCMX-BKFJMODKSA-N	426.695	1.643	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2ncnn2c1	1797561506	JOEKUTKUVMPWTI-HLPPOEQASA-N	436.310	1.106	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCCC#C[Si](C)(C)C	1797730514	JOAMKAMVWMJALV-ZMMAXQRCSA-N	429.033	1.881	50	20	IDGD	
CC(=O)N[C@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](O)CCl)C2)c1ccc(F)cc1	1799813814	IRXPOEPYDDOUIB-ADHGMGHFSA-N	425.888	1.241	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C[C@@H]1OCCc3ccccc31)C2	1800971444	YZWUYAHDTBFDNN-KHWKGDQTSA-N	436.936	1.534	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc2occc2c1O	1801053885	ZLWJQUXFMWSNKM-QDMKHBRRSA-N	428.489	1.763	50	20	IDGD	
COC(=O)CCCCCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@](C)(Cl)CCl)C2	1801075206	KFRZXURQUPNQGL-QOIYZWAUSA-N	437.364	1.936	50	20	IDGD	
COc1ccc(F)cc1CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Br)C2	1801101698	RJTWTVRTMDNQGB-GNTLTTKYSA-N	443.313	1.750	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cn1cccc([N+](=O)[O-])c1=O	1801358710	GYYOWTLWELNAFU-FVCCEPFGSA-N	441.282	1.178	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1	1803012102	WCAHDGDZPOXFOP-FAAHXZRKSA-N	432.746	1.718	50	20	IDGD	
COC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)[C@H](C)Br)[C@H]1c1cccnc1	1806380898	PSQFZRVGCDCUTR-JDFRZJQESA-N	426.311	1.824	50	20	IDGD	
CC(C)CNC(=O)C(=O)NC[C@H]1CCN(C(=O)CO[Si](C)(C)C)[C@@H]1c1cccnc1	1808447161	FHNFHRASCADKCM-IEBWSBKVSA-N	434.613	1.711	50	20	IDGD	
C=C(CC(=O)OCC)C(=O)NC[C@@H]1CCN(C(=O)[C@H](Cl)COC)[C@H]1c1cccnc1	1808463157	CFPKOYNGXRXHMM-SCTDSRPQSA-N	437.924	1.851	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2cc(F)cn2C)[C@H]1c1cccnc1	1808872542	QCVAZFAVJHIBMV-HRAATJIYSA-N	444.511	1.252	50	20	IDGD	
CCC1(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)CCC1	1809644608	GSAVHRMPRKOBAB-PZJWPPBQSA-N	435.333	1.661	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)c2cc(=O)ccn2C)[C@@H]1c1cccnc1	1811368077	YDDFGIWSOGCJOD-JOQOYGCGSA-N	447.333	1.883	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)Cc2ccsc2)[C@@H]1c1cccnc1	1813070452	GUIDTMGODOJTHK-XMSQKQJNSA-N	443.573	1.765	50	20	IDGD	
O=C(CCC(F)(F)F)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2	1814431816	CBWWNOIBLTXLIW-GFCCVEGCSA-N	441.240	1.391	50	20	IDGD	
O=C(/C=C/c1ccco1)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1	1815350570	YBSRKWPFGIAJHZ-LOWQCSRCSA-N	437.286	1.355	50	20	IDGD	
O=C(CN1CCCC1=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](F)Br)[nH]n1	1817160023	PLYZOBHJPWWVFA-XHDPSFHLSA-N	430.278	1.715	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(F)cn2)[nH]n1)c1cccc(B(O)O)c1	1817473467	VMDXQQSVIIBPLY-SFHVURJKSA-N	437.240	1.243	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccc(F)n2)n[nH]1	1819739425	CHWSZVDQMHIVFR-OAHLLOKOSA-N	431.472	1.623	50	20	IDGD	
Cc1cc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)ccc1O	1821096384	GMQWSWHLVQEUEA-IBGZPJMESA-N	448.288	1.723	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)CCl)CC2)c1[nH]cnc1-c1cccnc1	1821257472	YSCBJKUFBYNWFT-YPMHNXCESA-N	446.920	1.754	50	20	IDGD	
CCNC(=S)NCC(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](Cl)COC)[nH]n1	1821646426	YAKADNDUEFEVQM-DGCLKSJQSA-N	430.962	1.140	50	20	IDGD	
COc1ccc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@@H](O)CCl)CC3)cc1OC	1822102611	WDIBSTNIIIYWTB-YPMHNXCESA-N	439.921	1.986	50	20	IDGD	
C[C@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)Cc3cnn(C)c3)sc2C1	1826948859	JDSSAUVXHJOLQF-ONGXEEELSA-N	426.340	1.815	50	20	IDGD	
O=C(N[C@@H]1CCc2nc(NC(=O)C3CC4(CCC4)C3)sc2C1)c1cccc(B(O)O)c1	1827369420	OGGDPIWBHCXSKZ-MRXNPFEDSA-N	439.346	1.629	50	20	IDGD	
CC(C)O[C@@H](C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1	1829020183	LPPKHKYNIIKRFI-LAUBAEHRSA-N	430.354	1.413	50	20	IDGD	
CN1CCC(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)CC1	1830353589	GGWITWJXSFBYEY-NRFANRHFSA-N	429.989	1.440	50	20	IDGD	
C[C@H](Cn1cccn1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830358626	PSXRQGHAWCKCPZ-UZLBHIALSA-N	426.945	1.241	50	20	IDGD	
CCn1nc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)cc1C	1830365576	ZXWCFOUFYGAREI-FQEVSTJZSA-N	426.945	1.546	50	20	IDGD	
Cc1ncsc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2	1830537806	PAUKERKNWJOZJB-YVEFUNNKSA-N	446.367	1.553	50	20	IDGD	
Cc1cc(C)cc(CCC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)c1	1830738665	RRFJSBGACVOVPW-UGKGYDQZSA-N	438.952	1.292	50	20	IDGD	
CC(=O)C(C)(C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)CBr)C2)C1	1831117199	RLHPJVFAKNMHAT-ACJLOTCBSA-N	433.343	1.089	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4cccnn4n3)C2)C1	1831654025	HLLKHAQZOGNALM-OXQOHEQNSA-N	435.912	1.207	50	20	IDGD	
CCn1nc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)cc1C	1831873528	NPGGHPUSZGYLHY-FQEVSTJZSA-N	446.596	1.818	50	20	IDGD	
N#Cc1ccc(CCC(=O)NC2CCN(C3CCN(C(=O)[C@H](O)CCl)CC3)CC2)cc1	1833038775	FFNPYYFVYRQTDZ-OAQYLSRUSA-N	446.979	1.662	50	20	IDGD	
CCc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)cn1	1833893938	SMIXMGBHGSTRTM-IFXJQAMLSA-N	440.338	1.497	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccs3)CCO2)C1	1833940500	NYNAORVGCULSSS-SUMWQHHRSA-N	431.352	1.992	50	20	IDGD	
Cc1cnn(CC(=O)NC2CCN(C3CCN(C(=O)[C@](C)(Cl)CCl)CC3)CC2)c1	1834894538	BTTOJQIQBDMTGA-HXUWFJFHSA-N	444.407	1.999	50	20	IDGD	
CNc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)cc1	1835608230	UNVTVHFZZVXVBX-CRAIPNDOSA-N	444.301	1.489	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccc(F)cn3)CCO2)C1	1836030269	WHDMSGHRRNLAEH-FXAWDEMLSA-N	427.904	1.627	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3cccnc3)CCO2)C1	1836162720	XVIXWZYNEQMILE-QFBILLFUSA-N	440.338	1.254	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](N)Cc3cscn3)CC2)CC1	1836394229	OHESJQKTAKIRQP-MSOLQXFVSA-N	442.029	1.602	50	20	IDGD	
O=C(c1ccc2ncncc2c1)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1837026878	CGPRUDDRCYIFLU-IBGZPJMESA-N	439.299	1.504	50	20	IDGD	
CCn1ccc(C(=O)N2CCC(OC3CCN(C(=O)[C@H](Cl)COC)CC3)CC2)n1	1837539474	CXJHXEWEHOQDIF-QGZVFWFLSA-N	426.945	1.769	50	20	IDGD	
CN(C)c1ccc(C(=O)N2CCOC[C@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)cc1	1837714454	HCWULJPDIMPXEE-QFIPXVFZSA-N	449.624	1.674	50	20	IDGD	
Cc1nc(C)c(C(=O)N2CCOC[C@@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)o1	1837715550	WQGPCTABCMBVOP-LJQANCHMSA-N	425.558	1.213	50	20	IDGD	
C#CC(=O)N1CCC(OC2CCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)CC2)CC1	1838530538	WNEXFFKAXRJNAF-UHFFFAOYSA-N	443.456	1.766	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)COc3cccnn3)CC2)CC1	1838785613	IYTGHUAATCDTPA-QGZVFWFLSA-N	440.928	1.108	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3c(C)nc4ncccn34)C2)C1	1839144512	CQRZLFUUJDWEPT-FOIQADDNSA-N	435.912	1.125	50	20	IDGD	
Cn1cc(CCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)cn1	1839152266	TWJJMXVRBSXQJZ-RBUKOAKNSA-N	447.363	1.045	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ncccc3F)C2)C1	1839153949	WHPIYFPIKFDHJW-ZWKOTPCHSA-N	434.295	1.527	50	20	IDGD	
COc1cccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)c1	1839201523	ABMYUBDJILCEMP-MAUKXSAKSA-N	445.285	1.456	50	20	IDGD	
CC[C@H](C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H](C)Br)CCO2)C1)N(CC)CC	1840030199	DCPHJRNDEDQTAT-GPMSIDNRSA-N	448.402	1.347	50	20	IDGD	
CCc1ncccc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)Br)CCO2	1840031554	UETWXCIZSYJTGU-IFXJQAMLSA-N	440.338	1.497	50	20	IDGD	
COc1ccccc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)Br)CCO2	1840034214	DTVDJGVYHBGPEB-LIRRHRJNSA-N	441.322	1.549	50	20	IDGD	
CC(C)c1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)n[nH]1	1840034461	MFFCJILDHMIHGI-SCLBCKFNSA-N	443.342	1.387	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@]3(F)CCCC=C3F)C2)C1	1840156856	WGHZXGHUVSLOOP-KYNGSXCRSA-N	436.883	1.442	50	20	IDGD	
COc1ccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)cc1F	1840526503	IXWMLVMELKMASA-MJGOQNOKSA-N	432.851	1.368	50	20	IDGD	
C=CCO[C@@H](C)C(=O)N1CCCC12CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1841607935	RCJQIXMSIAMNTI-GJZGRUSLSA-N	429.945	1.913	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)Cc1cnc3ccccn13)C2	1843415186	WATJMXABMQGOPB-WGOQTCKBSA-N	447.499	1.214	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@H](C(=O)N2CCCC23CN(C(=O)[C@H](O)CCl)C3)C[C@@H](F)C1	1843887912	NGNOIWHVZUPPPE-RRFJBIMHSA-N	447.935	1.385	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2ccn(-c3ccccc3)n2)C1	1844798865	MZQRPZSRMPJKKL-UHFFFAOYSA-N	445.483	1.002	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC2(CCCN2C(=O)c2cc3n(n2)CCCN(C)C3)C1	1845725941	IRUROWLUFXIAPC-CQSZACIVSA-N	438.370	1.567	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)Cc1ncccn1	1848259743	XAQGBGOWTQNIBQ-IRXDYDNUSA-N	439.428	1.368	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)c2ccc(CS(C)(=O)=O)cc2)c2ccccc2c1=O	17196616	ZKUROCUKGKXBOG-UHFFFAOYSA-N	442.497	1.597	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(C(F)(F)F)nc2)cc1OC	26435003	BIQBOAPMYJHHML-UHFFFAOYSA-N	427.335	1.736	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)c1cn(-c2ccc(C(F)(F)F)cn2)nn1	725878365	UGZYEWQFDOXHCM-UHFFFAOYSA-N	436.350	1.530	50	20	IDGD	
O=C(CCn1nc(O)c2ccccc2c1=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	726862255	HKKSCLQJJCMZKR-UHFFFAOYSA-N	443.485	1.076	50	20	IDGD	
C#Cc1cccc(NC(=S)NNC(=O)c2ccc(OC)c(S(=O)(=O)N(C)C)c2)c1	727498434	UWPNCOKDUMDEHU-UHFFFAOYSA-N	432.527	1.558	50	20	IDGD	
O=C(NCCS(=O)(=O)Cc1ccccc1)NNC(=O)c1cccc(OC(F)F)c1	728596447	JXBWCGPCAUFOFJ-UHFFFAOYSA-N	427.429	1.847	50	20	IDGD	
O=C(NCCc1c[nH]c2cc(F)ccc12)NNC(=O)C1CCN(c2ncccn2)CC1	728962026	VCUXQWVUDPSEHG-UHFFFAOYSA-N	425.468	1.887	50	20	IDGD	
COc1cc(-n2cnnn2)c(Cl)cc1C(=O)NNC(=O)Cn1ccc2ccccc21	729450800	SSKZNOGNDVFFKP-UHFFFAOYSA-N	425.836	1.740	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)NCC2(N3CCCC3)CCOCC2)cc1	729623916	QEEOCJXMVKXKAC-QGZVFWFLSA-N	434.537	1.828	50	20	IDGD	
CN(C)c1ccc(NC(=S)NNC(=O)CCNS(=O)(=O)c2ccc(F)cc2)cc1	729690707	HCGHKMCVAQKKQA-UHFFFAOYSA-N	439.538	1.578	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCCNC(=O)NNC(=O)c2cccc3ncccc23)cc1	730114106	GEIUHXOTTDFMMO-UHFFFAOYSA-N	427.486	1.466	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(N2CCCS2(=O)=O)cc1)c1cccc2ncccc12	730203688	ARTCFVUHTBHOFD-UHFFFAOYSA-N	446.510	1.398	50	20	IDGD	
Cc1ccc(-n2cnnc2SCC(=O)NNC(=O)COc2ccccc2O)cc1C	730777683	ABGOXDPORGJTOX-UHFFFAOYSA-N	427.486	1.908	50	20	IDGD	
O=C(NNC(=O)c1cc(F)cc([N+](=O)[O-])c1)c1ccc(S(=O)(=O)N2CCCC2)cc1	731453094	BGAOAJVYZAGAKB-UHFFFAOYSA-N	436.421	1.593	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)c2cn(-c3cccc([N+](=O)[O-])c3)nn2)cc1OC	731454171	VAANYTZYRLCMQP-UHFFFAOYSA-N	426.389	1.658	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN1S(=O)(=O)c1cccc([N+](=O)[O-])c1)NC1CCCC1	732957964	CQESDWCUHFMDCZ-OAHLLOKOSA-N	425.467	1.021	50	20	IDGD	
CC[C@@H](Nc1ccccc1)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	733123549	RKJOFMJOPGHXEK-LJQANCHMSA-N	446.529	1.359	50	20	IDGD	
CCOCCCn1c(NNC(=O)c2ccc(CS(C)(=O)=O)o2)nc2ccccc2c1=O	733268589	PSDWIJCBWYCPSQ-UHFFFAOYSA-N	448.501	1.718	50	20	IDGD	
CNS(=O)(=O)c1ccc(C(=O)NNc2ccccc2S(=O)(=O)NC(C)(C)C)o1	734250857	MKKZUIHHDRZPCC-UHFFFAOYSA-N	430.508	1.021	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)Cn1nnc2ccccc2c1=O	734251119	ZVQZFNQWHLRYKC-UHFFFAOYSA-N	430.490	1.012	50	20	IDGD	
COc1ccc([C@H]2[C@H](C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)CCC(=O)N2C)cc1	734419467	SAWFKSLYPUWXMX-QUCCMNQESA-N	449.471	1.042	50	20	IDGD	
O=C(NNS(=O)(=O)c1cccc(I)c1)c1cccc([N+](=O)[O-])c1	739667412	NTHLREHTXXMBKI-UHFFFAOYSA-N	447.210	1.823	50	20	IDGD	
CN(C)c1nccc(NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)n1	740102992	JYLFIRSBZGODIV-UHFFFAOYSA-N	426.502	1.778	50	20	IDGD	
O=C(NNc1cccc(C(F)(F)F)n1)c1ccc2c(c1)S(=O)(=O)N=C1N=CNN12	740132118	BTNACQFLUSVRSK-UHFFFAOYSA-N	425.352	1.269	50	20	IDGD	
O=C(NNC(=O)c1cc(N2CCOC2=O)ccc1F)c1csc(N2CCOCC2)n1	741663082	XCQKZGKVCXOYGW-UHFFFAOYSA-N	435.437	1.150	50	20	IDGD	
O=C(NCc1cccc(C(F)(F)F)c1)NNC(=O)[C@H]1CC(=O)N(Cc2ccccn2)C1	742452804	GDMZRRBKXWPCDW-AWEZNQCLSA-N	435.406	1.980	50	20	IDGD	
CS(=O)(=O)N1CCc2cc(C(=O)NNC(=O)c3cccc(Br)c3)ccc21	742771099	BLTQQTHBHZKUCO-UHFFFAOYSA-N	438.303	1.846	50	20	IDGD	
O=C(O)COc1ccc(S(=O)(=O)NNC(=O)c2cccc(Br)c2)cc1F	743263321	CGSLHYXNUVSDIR-UHFFFAOYSA-N	447.238	1.675	50	20	IDGD	
C[C@@H](CCc1cccc(F)c1)C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	743419975	REZCODRQIXZDHO-INIZCTEOSA-N	449.552	1.869	50	20	IDGD	
COc1ccc(Cl)cc1NCCC(=O)NNC(=O)c1csc(N2CCOCC2)n1	743845595	VNYSNPRKECUEGD-UHFFFAOYSA-N	439.925	1.905	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)C(=O)C2)c1	744404505	TXSHKRVFJPUEKC-UHFFFAOYSA-N	425.876	1.317	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1cc(-n2cccn2)ccn1	744620072	BITULMFFCNJIPK-UHFFFAOYSA-N	428.474	1.045	50	20	IDGD	
CC(=O)N[C@H](CC(=O)OCC(=O)NNC(=O)c1ccc(C#N)cc1)c1ccc(F)cc1F	745143244	ZFONLLHZJMJCMT-GOSISDBHSA-N	444.394	1.408	50	20	IDGD	
O=C(CNC(=O)[C@H]1c2ccccc2C(=O)N1Cc1ccccc1)NNC(=O)c1ccc[nH]1	745838351	LOBCVBLCEJSRRS-HXUWFJFHSA-N	431.452	1.289	50	20	IDGD	
CC(C)OC(=O)[C@H](C)CNC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	745905594	LQDYUTOQGVDTKE-CQSZACIVSA-N	440.522	1.003	50	20	IDGD	
CN(C)C(=O)NNC(=O)c1ccc(N2CCCCC2)c(S(=O)(=O)N2CCCCC2)c1	746003923	VYSMFFRMTCBOJY-UHFFFAOYSA-N	437.566	1.768	50	20	IDGD	
CC[S@](=O)[C@@H]1CCC[C@@H](NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)C1	750669835	DSSAMXYPFZMJRV-ZDKQTTCGSA-N	449.621	1.609	50	20	IDGD	
COc1ccc(-c2nnc(SCC(=O)NNC(=O)CNC(=O)c3cccs3)o2)cc1	751210449	FULYQHKHNYEHCN-UHFFFAOYSA-N	447.498	1.476	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)N[C@H]1CCN(Cc2ccc(C#N)cc2)C1=O	753034170	UMGJEIMKORDAMT-KRWDZBQOSA-N	437.456	1.077	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)N[C@H]1CCN(Cc2ccc(C#N)cc2)C1=O	753736990	AKGBUVHANKJNFS-KUHUBIRLSA-N	439.447	1.596	50	20	IDGD	
O=C(NNC(=O)N1CCS(=O)(=O)C2(CCCCC2)C1)c1cnn(-c2ccccc2)c1	753919288	LVEUVWZFFQHJKE-UHFFFAOYSA-N	431.518	1.660	50	20	IDGD	
N#C/C(=C/c1ccc(O)cc1)C(=O)OCC(=O)NCc1ccc(C(=O)N2CCOCC2)cc1	754550025	NXGQGMFYRDEACZ-MOSHPQCFSA-N	449.463	1.631	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2ccc(NC(=O)NNC(=O)c3cccnc3)cc2)C[C@H](C)O1	755423103	NZVSGHXMOHCRET-KBPBESRZSA-N	433.490	1.346	50	20	IDGD	
COc1ccccc1NC(=O)c1ccc(NC(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)cc1	755493386	BUCJUONNXPELJC-LBPRGKRZSA-N	449.489	1.038	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)Nc2ccc(C)c(S(=O)(=O)NC)c2)o1	755514333	GNLVTXRSPOTXCI-UHFFFAOYSA-N	437.522	1.804	50	20	IDGD	
Cn1cc(S(=O)(=O)N2CCOCC2)cc1C(=O)NNc1nc(C(F)(F)F)cs1	755858092	KKLBGVFAUQPHKQ-UHFFFAOYSA-N	439.441	1.278	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)NCCN2C(=O)[C@@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2=O)c2ccccc2n1	756099178	UVANELDOTIHDAV-YXUGBTPSSA-N	433.468	1.294	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN(Cc2ccccc2O)C[C@H]2CCCO2)cc1OC	756337384	WLYPLUHJJKVFCG-GOSISDBHSA-N	443.500	1.852	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1cccc(C[S@](=O)c2ccccc2)c1	756593446	ZFFSWSZICUUYLI-OIJAAMDRSA-N	438.531	1.085	50	20	IDGD	
CN(CC(=O)NNC(=O)c1cccc(C#N)c1)[C@@H]1CS(=O)(=O)c2ccc(Cl)cc21	756620160	UKKNKVKTRLMXCL-MRXNPFEDSA-N	432.889	1.433	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)CN1C(=O)NC2(C[C@H](C)C[C@@H](C)C2)C1=O	756901246	LZWSYZRCLXHWHE-VXGBXAGGSA-N	436.896	1.856	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)Nc3ccc(-n4ncn(C)c4=O)cc3)n[nH]2)cc1	757862972	MHHGISPZVABTQR-UHFFFAOYSA-N	432.444	1.736	50	20	IDGD	
Cc1ncc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c(Cl)c1Cl	758500858	YSHLXIMGOGKDJH-ZDUSSCGKSA-N	440.239	1.841	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN2CCC(N3CCN(C(C)C)CC3)CC2)cc1C	761123547	QSYZGXHPPYMHPD-UHFFFAOYSA-N	435.638	1.870	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)c1ccc(S(=O)(=O)NC2CC2)cc1	761625885	JKPNZIPGZJXWFH-UHFFFAOYSA-N	435.527	1.689	50	20	IDGD	
CC(=NNC(=O)[C@H](C)CN1CCC(C)CC1)c1c(C)nn(CCS(C)(=O)=O)c1C	763136826	HCTGPBDBOPIWPM-OAHLLOKOSA-N	425.599	1.753	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2Br)cc1-n1cnnn1	763482925	OBSHDOOIGUNQSB-UHFFFAOYSA-N	444.249	1.133	50	20	IDGD	
COC(=O)CCSCc1cccc(NC(=O)C(=O)NNC(=O)c2ccccc2O)c1	763525606	CROPPPTYUOTWIZ-UHFFFAOYSA-N	431.470	1.588	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)C(=O)Nc1ccc2ncccc2c1	763530835	IMXYOSPBECGVNO-UHFFFAOYSA-N	446.511	1.533	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)Nc1ccc(N2CCCC2)c(F)c1	763571342	MJGHZHJSPRNYGH-SFHVURJKSA-N	428.420	1.352	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(N3CCOCC3)cc2C)cc1	763659143	JMECZTYNNZJXIT-UHFFFAOYSA-N	442.472	1.005	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccc(Cl)c1-n1cncn1	763663742	NLJSUHOMVNLYNA-UHFFFAOYSA-N	444.835	1.094	50	20	IDGD	
CC(C)(C)NC(=O)c1ccccc1NC(=O)C(=O)NNC(=O)COc1ccccc1F	763678367	DTCKHXMMBTXPHJ-UHFFFAOYSA-N	430.436	1.519	50	20	IDGD	
CCN(Cc1ccccc1NC(=O)C(=O)NNC(=O)COc1ccc(Cl)cc1)C(C)=O	763685934	FEAXBIPEACNQIX-UHFFFAOYSA-N	446.891	1.873	50	20	IDGD	
COCCOc1cc(C)ccc1NC(=O)C(=O)NNC(=O)COc1ccc(Cl)cc1	763694465	JSUJODYYACPQJO-UHFFFAOYSA-N	435.864	1.839	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)C(=O)Nc2ccc(Cl)nc2)c2ccccc2c1=O	763801027	AXJJHRWGGOLRPW-UHFFFAOYSA-N	442.863	1.645	50	20	IDGD	
CC(C)C[C@H](C)n1nccc1NC(=O)C(=O)NNC(=O)COc1ccccc1[N+](=O)[O-]	763803340	LOHRJJFTIFIBFJ-ZDUSSCGKSA-N	432.437	1.563	50	20	IDGD	
C[C@@H](Sc1ccc(Br)cc1)C(=O)NNC(=O)CNC(=O)c1cccnc1	763819399	AIKDMNWKPIZSHY-LLVKDONJSA-N	437.319	1.902	50	20	IDGD	
COc1ccc(OC(F)F)c(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)c1	763849563	KFKUNRHGQKNVFJ-JTQLQIEISA-N	441.362	1.989	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ncn(Cc3ccccc3)n2)c1C	763851100	QPNLBITUFXJTMF-MRXNPFEDSA-N	436.472	1.497	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3ccc(OCC(N)=O)cc3)cc2C1	763947419	BHODZHPCFYPFHK-LLVKDONJSA-N	430.486	1.137	50	20	IDGD	
COc1ccncc1NC(=O)C(=O)NNC(=O)c1ccc(Br)cc1Cl	764057883	KXZVAEAKTSPFFU-UHFFFAOYSA-N	427.642	1.906	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc([S@@](=O)C(F)(F)F)cc2)c(O)c1	764105765	XXYZVNQUEPJLMW-GDLZYMKVSA-N	429.376	1.728	50	20	IDGD	
O=C(CCc1ccco1)NNC(=O)C(=O)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1	764172264	TXYQLJZSCJGWGR-UHFFFAOYSA-N	448.501	1.173	50	20	IDGD	
Cc1ccc(C(=O)N2C[C@@H](C)C[C@H](C)C2)cc1NC(=O)C(=O)NNC(=O)Cc1cc[nH]n1	764293452	PFNMHXDGPRYLJY-KBPBESRZSA-N	440.504	1.165	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)C(=O)Nc1cc(Br)ccc1Br	764298503	UTSRHBBGTLVWMY-UHFFFAOYSA-N	445.071	1.643	50	20	IDGD	
O=C(Cn1cc(NC(=O)C(=O)NNC(=O)c2cc3ccccc3o2)cn1)NC1CCCC1	764331257	SBMBKMCTIRINHZ-UHFFFAOYSA-N	438.444	1.088	50	20	IDGD	
CCOc1cc2c(cc1NC(=O)C(=O)NNC(=O)c1cnn(-c3ccccc3)c1)O[C@@H](C)C2	764342252	FQUMIQXVPZFVEW-AWEZNQCLSA-N	449.467	1.994	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])cc2c1OCCO2)c1cc(-c2ccc(F)cc2)[nH]n1	765616053	KIURSNHZAOMUJZ-UHFFFAOYSA-N	427.348	1.970	50	20	IDGD	
CNC(=O)[C@@H]1CCC[C@H]1NC(=O)NNC(=O)[C@@H](C)Oc1cccc(Br)c1	765649961	XMVXSUMKPGQPKM-LERXQTSPSA-N	427.299	1.462	50	20	IDGD	
Cc1c(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cccc1[N+](=O)[O-]	765737549	GJFZTGMSPJFSIO-UHFFFAOYSA-N	425.445	1.122	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNS(=O)(=O)c1cc(Cl)ccc1OCC(N)=O	766313036	UONQCFOXSNEMLC-UHFFFAOYSA-N	448.284	1.489	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNS(=O)(=O)CCc2ccccc2[N+](=O)[O-])cc1	766313038	UOQUGINZSDZIAB-CQSZACIVSA-N	437.474	1.954	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)C(=O)Nc2cc(C3CC3)nn2-c2ncccn2)c1	768236306	AHSVITSBPUQHHW-UHFFFAOYSA-N	434.460	1.005	50	20	IDGD	
CCNC(=O)N(C)NC(=O)/C(C#N)=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	768409798	LMDUGCBXAZDNHP-UVTDQMKNSA-N	443.895	1.678	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)CN2C(=O)N[C@]3(CCCC(C)(C)C3)C2=O)cc1C	768561157	ULJAHSIJTMDZSM-QFIPXVFZSA-N	430.505	1.720	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)[C@H]1CCCN1C(=O)Cc1ccccc1	768613751	YDGYOJUVEALATR-MRXNPFEDSA-N	431.514	1.776	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)c2cccc([C@]3(C)NC(=O)NC3=O)c2)cc1OC	768930477	SPVMBQFQFSPPBX-NRFANRHFSA-N	426.429	1.223	50	20	IDGD	
N#Cc1ccc(OC2CCC(NC(=O)NNC(=O)Cc3cn4ccccc4n3)CC2)nc1	769024055	RPVGZNVJIHPPDD-UHFFFAOYSA-N	433.472	1.864	50	20	IDGD	
CC[C@@H](C)NS(=O)(=O)c1ccc(C(=O)O[C@H](C)C(=O)NNC(=O)CC(C)C)cc1	771933664	XEBTUXRRPBLJQA-ZIAGYGMSSA-N	427.523	1.502	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)c1ccc(S(C)(=O)=O)c(Br)c1	772234706	DDAFDXYFMKWSNE-SNVBAGLBSA-N	449.323	1.591	50	20	IDGD	
CC(C)[C@@H](C(=O)NNC(=O)[C@@H](C)Oc1ccc2ccccc2c1)N1CCCS1(=O)=O	772630777	MJGTZLOXCDPZFM-BEFAXECRSA-N	433.530	1.815	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)c1ccc(Br)cc1O	772888130	GCQAOLODOJWSTP-UHFFFAOYSA-N	426.654	1.886	50	20	IDGD	
CC(=O)NCCc1ccc(S(=O)(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)s1	773251655	NUUVURWZORBSEP-LLVKDONJSA-N	445.950	1.857	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cn(C)nc2C(F)(F)F)cc1	773527386	KKTUFINZWKOYPZ-JTQLQIEISA-N	443.382	1.391	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(Br)cn2)o1	773539721	CJLBIRJLBUKNNE-UHFFFAOYSA-N	438.282	1.679	50	20	IDGD	
Cc1nc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)ccc1Br	773551420	AEUQEUDFKZLTEY-UHFFFAOYSA-N	439.291	1.736	50	20	IDGD	
CC(=O)N1CCN(Cc2cccc(NC(=O)C(=O)NNc3nccnc3C(C)C)c2)CC1	773992305	IDFRZPOUELPFLB-UHFFFAOYSA-N	439.520	1.346	50	20	IDGD	
Cc1cc(CNC(=O)NNC(=O)c2ccc(Br)s2)ccc1S(N)(=O)=O	775224808	MBBWJRBJGWNKLC-UHFFFAOYSA-N	447.336	1.611	50	20	IDGD	
NS(=O)(=O)c1ccc(N2CCOCC2)c(C(=O)NNc2ncc(Cl)cc2Cl)c1	775266579	WZPIHWFNQLSRMD-UHFFFAOYSA-N	446.316	1.629	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)N[C@H](c1cccc2ccccc12)C(F)(F)F	776009680	MYSFYAHPDDTOIE-IINYFYTJSA-N	432.424	1.711	50	20	IDGD	
CCOC(=O)N1CCC[C@@H]([C@H](C)NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)C1	776874553	LNDNBRBUWZQUMG-DOTOQJQBSA-N	447.540	1.280	50	20	IDGD	
COc1c(F)cc(S(=O)(=O)NNC(=O)CSc2ccccc2O)cc1[N+](=O)[O-]	778037647	HUEBIRMROZISTL-UHFFFAOYSA-N	431.423	1.550	50	20	IDGD	
O=C(NNC(=O)c1ccc(Br)s1)N[C@H](CO)C[C@H](O)c1ccccc1	778590610	MYECFDYUAUKEIW-RYUDHWBXSA-N	428.308	1.939	50	20	IDGD	
CC[C@]1(O)CCN(C(=O)/C(C#N)=C\c2cn(CCC(N)=O)nc2-c2ccc(OC)cc2)C1	779341820	JBBBEXANSXLMDZ-ZDALTALBSA-N	437.500	1.714	50	20	IDGD	
CC(C)[C@H]1CN(CC(=O)NNC(=O)c2ccc(C#N)cc2)CCN1C(=O)OC(C)(C)C	781988648	NYIQBCGQRBNSIV-GOSISDBHSA-N	429.521	1.897	50	20	IDGD	
Cc1cc(C)c(S(=O)(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c(C)c1CC(=O)O	782248996	GRNNSJUTRYYOJF-KRWDZBQOSA-N	434.470	1.388	50	20	IDGD	
Cc1ccc(-n2nc(C)cc2NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2Cl)nn1	782927621	VIYLEHSPFDKDLJ-UHFFFAOYSA-N	448.270	1.986	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)c2cnc(NC(=O)OC(C)(C)C)cn2)cc1	783239173	NXDFGIQUYYYCJG-UHFFFAOYSA-N	429.433	1.750	50	20	IDGD	
CCOc1ccc(Oc2ccccc2NC(=O)C(=O)NNC(=O)C(=O)N2CCCC2)cc1	784002363	DBTLOSIKNNEKTH-UHFFFAOYSA-N	440.456	1.586	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1ccc2c(c1)Cc1ccccc1-2	784003839	CDELNVBSEAVQMG-UHFFFAOYSA-N	434.477	1.835	50	20	IDGD	
CCN1CCN(C(=O)c2ccc(NC(=O)C(=O)NNc3ncccc3Cl)cc2)CC1	784817609	HOMIINUQTYDASS-UHFFFAOYSA-N	430.896	1.595	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNc2cccnc2Cl)cc(S(C)(=O)=O)c1	784842332	OXGNDXVRFHGLNE-UHFFFAOYSA-N	440.865	1.397	50	20	IDGD	
CN(C)c1nccc(NNC(=O)C(=O)Nc2ccccc2-n2cc(Br)cn2)n1	784970165	SLEBHAYAVUOUCW-UHFFFAOYSA-N	445.281	1.573	50	20	IDGD	
CS(=O)(=O)c1ccc(F)c(NC(=O)C(=O)NNc2nc(C(F)(F)F)cs2)c1	785144171	HJWBTYCKONXASM-UHFFFAOYSA-N	426.373	1.786	50	20	IDGD	
CCOc1cc(C(=O)N(C)C)ccc1NC(=O)C(=O)NNc1nccc(N(CC)CC)n1	785238536	YFSAJAUSYWPALR-UHFFFAOYSA-N	443.508	1.505	50	20	IDGD	
COC(=O)c1ccc(S(=O)(=O)NNC(=O)c2cc(Br)c[nH]2)c(OC)c1	785480900	IPHRNRMMSCJQOC-UHFFFAOYSA-N	432.252	1.196	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)N[C@H]1CCN(c2cccc(Br)c2)C1	787369612	LHKNUFFNMGKXRM-JSGCOSHPSA-N	429.315	1.410	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)C(=O)Nc2ccc(C)c(N3CCNC3=O)c2)cc1	787542607	BOTFMOYTHGUZKT-UHFFFAOYSA-N	441.513	1.711	50	20	IDGD	
CCNC(=O)Nc1ccc(C)c(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)c1	787543634	KIOAJKNAZIQPTJ-UHFFFAOYSA-N	431.424	1.440	50	20	IDGD	
CNc1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)cn1	788266502	WEMYDXOKPZUNKL-UHFFFAOYSA-N	439.497	1.677	50	20	IDGD	
CN(C)C(=O)CNC(=O)c1ccc(NC(=O)NNc2cc(Cl)nc(N)n2)cc1Cl	789151760	COJPXROPLAVKOC-UHFFFAOYSA-N	441.279	1.332	50	20	IDGD	
CC[C@@H]1CCc2nc(NC(=O)C(=O)NNC(=O)c3cc([N+](=O)[O-])ccc3O)sc2C1	789768375	MOIOTZPXCZOWDU-SECBINFHSA-N	433.446	1.672	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2cccc(F)c2[N+](=O)[O-])cc1N1CCOC1=O	791001235	ZJVBWGSJDNEMQX-UHFFFAOYSA-N	433.352	1.781	50	20	IDGD	
O=C(CN1CCNC(=O)[C@@H]1c1ccc(OC(F)(F)F)cc1)NNC(=O)c1ccccc1	792359903	NMZWGPURUTVALP-KRWDZBQOSA-N	436.390	1.519	50	20	IDGD	
CSSCCNC(=O)C(=O)Nc1cc(S(=O)(=O)N2CCOCC2)ccc1C	793078255	DIRITKWTZFCRLM-UHFFFAOYSA-N	433.577	1.082	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccccc1S(=O)(=O)C(F)F)c1ccc2ccccc2n1	794576916	KKWJCGWTHQIVQD-UHFFFAOYSA-N	441.437	1.854	50	20	IDGD	
CC(C)(C)OC(=O)N1CCOC[C@H]1CC(=O)NNC(=O)c1nnc(O)c2ccccc12	794774513	HDGAFDSTMKXAQI-GFCCVEGCSA-N	431.449	1.122	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)[C@@H]1CC(=O)N(c2c(F)cccc2F)C1	795181009	FTEFOIJDRCLJQC-GFCCVEGCSA-N	438.456	1.711	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H]2[C@@H](C1)[C@@H]2C(=O)OCC(=O)NNC(=O)c1cccc(Cl)c1	796091358	DWBBACJCDUPNPK-FOLVSLTJSA-N	437.880	1.757	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)Cc3ccc([S@](C)=O)cc3)CC2)cc1	797940392	PCDSMVLXELDUOX-HKBQPEDESA-N	442.585	1.240	50	20	IDGD	
Cc1ccc(-c2ccnn2C)cc1NC(=O)C(=O)NNC(=O)[C@@H]1COc2ccccc2O1	799257724	RANRZRLJCBKEIH-IBGZPJMESA-N	435.440	1.321	50	20	IDGD	
CCn1ncc(NC(=O)C(=O)NNC(=O)CCc2ccc(OC)cc2)c1C(F)(F)F	799258896	OIRILEKQBBDOOD-UHFFFAOYSA-N	427.383	1.649	50	20	IDGD	
CCS(=O)(=O)N1CCC[C@@H](C(=O)NNC(=O)Nc2ccc(Br)cc2)C1	801996390	DHSZAYBGAWFPBW-LLVKDONJSA-N	433.328	1.664	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2ccc(-c3ccccn3)nc2O)cc1	802064085	VXTUNBFTSUTJTK-UHFFFAOYSA-N	427.442	1.719	50	20	IDGD	
C[C@@H](Oc1ccc(C=O)cc1)C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	802828053	UIHNFQXXGAHGMC-MRXNPFEDSA-N	446.529	1.346	50	20	IDGD	
COC(=O)N(C)NC(=O)c1ccccc1COc1ccccc1C(=O)NN(C)C(=O)OC	804123903	KFDFIJLKNLWYPU-UHFFFAOYSA-N	444.444	1.952	50	20	IDGD	
CCCN(NC(=O)c1cc(S(=O)(=O)N2CCOCC2)cn1C)C(=O)OC(C)(C)C	804593757	UFQCANZOPSFPPS-UHFFFAOYSA-N	430.527	1.338	50	20	IDGD	
Cc1c(C(F)(F)F)nn(C)c1NC(=O)C(=O)NNC(=O)C1=S=C2CC[C@H](C)CC2=C1	806975993	YBYBICLJIOMHMS-QMMMGPOBSA-N	443.451	1.671	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1c(C)c(C(F)(F)F)nn1C	806979511	YBEDDECKTRSHIB-UHFFFAOYSA-N	445.423	1.634	50	20	IDGD	
Cc1cc(=O)cc(C)n1CCCC(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	809982847	QTMQGBLLOLMXNR-UHFFFAOYSA-N	440.909	1.007	50	20	IDGD	
N#Cc1cncc(S(=O)(=O)NNC(=O)[C@@H]2Cc3ccccc3CN2Cc2ccccc2)c1	811683867	KDKHRVDZKHRBOM-QFIPXVFZSA-N	447.520	1.890	50	20	IDGD	
C=CCN(C)S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccc(OCC)cc2)cc1	815816392	UNHMECSVIYJSBN-UHFFFAOYSA-N	432.502	1.974	50	20	IDGD	
Cc1nnnn1/C(=C\c1ccc(F)cc1)C(=O)NNC(=O)c1nnc(O)c2ccccc12	818028275	BAIQSXNRKZQTPK-YBEGLDIGSA-N	434.391	1.229	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)CNS(=O)(=O)c2c(Cl)cccc2Cl)c1	913445753	WUQPVIAUEMFEDJ-UHFFFAOYSA-N	446.312	1.807	50	20	IDGD	
CN(CC(=O)NNC(=O)c1ccc(CSc2nncn2C)cc1)C(=O)c1cccs1	914747871	RZCNKYCNYVRBCV-UHFFFAOYSA-N	444.542	1.702	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)o1	914879104	KLNXISGEUSECQZ-UHFFFAOYSA-N	436.534	1.512	50	20	IDGD	
Cc1nc(COc2ccc(C(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)cc2)no1	915077207	LWQRIXWQONHVDN-UHFFFAOYSA-N	430.442	1.435	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)c2ccccc2c1=O	915356645	ULGMCEUALIZXLK-UHFFFAOYSA-N	447.411	1.585	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)NCc2ccc(N3CCN(C)CC3)nc2)cc1	916245503	DMGRPIAUONWTRP-UHFFFAOYSA-N	428.562	1.765	50	20	IDGD	
CC(=NNC(=O)c1cccc([N+](=O)[O-])c1)c1ccc(S(=O)(=O)N2CCOCC2)cc1	916247218	JLDBQUYUPXFPGK-UHFFFAOYSA-N	432.458	1.770	50	20	IDGD	
COc1ccc(O)c(C(C)=NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c1	916258591	GRVQMXIJEUGWPM-UHFFFAOYSA-N	433.486	1.576	50	20	IDGD	
CCOc1cc(C=NNC(=O)[C@@H](C)CN2CCOCC2)ccc1O[C@H](C)C(=O)N(C)C	916362068	ILNMAVKQCXWYKF-DLBZAZTESA-N	434.537	1.359	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NCC(=O)N2CCCCC2)c2ccccc2c1=O	916473590	SXEIKBSMSUYCPC-UHFFFAOYSA-N	428.493	1.153	50	20	IDGD	
COc1ccc(CNC(=O)NNC(=O)Cc2nc3ccccc3n2C)c(OC)c1OC	918227026	PVHILOSHJZPJSI-UHFFFAOYSA-N	427.461	1.672	50	20	IDGD	
COc1ccc(CC(=O)O)cc1S(=O)(=O)NNC(=O)c1cc(C)nc2ccccc12	919954030	AVNOCOUFWSZXBW-UHFFFAOYSA-N	429.454	1.802	50	20	IDGD	
O=C(CCNS(=O)(=O)c1cccc([N+](=O)[O-])c1)NNC(=O)c1cc(Cl)ccc1O	920340679	PJBROIGXFMSBLS-UHFFFAOYSA-N	442.837	1.083	50	20	IDGD	
O=C(COC(=O)C1(c2ccc(F)cc2)CCOCC1)NNC(=O)c1ccc([N+](=O)[O-])cc1	920665326	DQZPDDVCTYPEKO-UHFFFAOYSA-N	445.403	1.787	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)c2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1	1116171319	RKYZDIZVRGPUAH-GOSISDBHSA-N	438.484	1.315	50	20	IDGD	
CCOCCCNC(=O)c1cccc(NC(=O)NNC(=O)c2n[nH]c3c2CCCC3)c1	1116563693	QRFUEZQFJSRQCD-UHFFFAOYSA-N	428.493	1.911	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCCC(=O)N2CCC[C@H](C)C2)nc1	1123723450	RRFDIIOVQQQOJL-AWEZNQCLSA-N	426.543	1.043	50	20	IDGD	
O=C(NC[C@H](N1CCOCC1)C(F)(F)F)NNC(=O)c1cncn1-c1ccccc1	1261099092	IPPMUVJYTULLET-HNNXBMFYSA-N	426.399	1.079	50	20	IDGD	
O=C(NC[C@H]1CCOC1)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	1317883021	KOAOSOSTJVSWIH-MRXNPFEDSA-N	432.502	1.146	50	20	IDGD	
O=C(NN=Cc1c(N2CCOCC2)nc2ccccn2c1=O)c1cncn1-c1ccccc1	1321515688	NFMVLDBVOWUUIZ-UHFFFAOYSA-N	443.467	1.481	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2cncn2-c2ccccc2)ccc1Cl	1323769878	GGQPLFJUAULDQF-UHFFFAOYSA-N	434.861	1.936	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)c2ccc(NC(=O)c3ccc(O)nc3)cc2)nc2ccccc21	1337502404	FPTLNXIBGQZIFC-UHFFFAOYSA-N	444.451	1.930	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4nc(CO)[nH]c4c3)C2)C1	1777702942	OEAALKUQBXZMNX-OAQYLSRUSA-N	434.924	1.764	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)c3csc4c3CCCC4)C2)C1	1778486936	VOWIUPPWJXPCJN-QFIPXVFZSA-N	448.589	1.443	50	20	IDGD	
C=CC(=O)N[C@@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)CBr)C2	1779529068	XVJVUZKUXBJCCC-NXEZDXNNSA-N	444.370	1.222	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CO[Si](C)(C)C)C1)n1ccccc1=O	1779545311	BOJCCVUUWQQXLJ-JBYIUTFZSA-N	449.624	1.775	50	20	IDGD	
CC(C)(C)c1cc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)[nH]n1	1779575747	UPOPOQWIJVLHLE-GUYCJALGSA-N	431.306	1.841	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCNC(=O)c1ccc[nH]1)C2	1780700581	UHJKEWGUGKMVLZ-QLVMHMETSA-N	438.956	1.666	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)ncn1)C2	1780707947	XOQUJSYIFISIIZ-FSPWUOQZSA-N	431.320	1.546	50	20	IDGD	
CC(=O)N(C)[C@@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@](C)(Cl)CCl)C1	1780712208	XIKFXVCBQNQMIK-ARKSPBFVSA-N	436.380	1.603	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C2(Br)CC2)C1	1780784351	FZLLFCOQAOBHFR-XJKCOSOUSA-N	437.762	1.682	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)Cc3ccc([N+](=O)[O-])c(OC)c3)C2)C1	1781192863	QWTMXXZTALGOAN-QRWLVFNGSA-N	439.896	1.993	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnc(N(C)C)o1)C2	1781996574	NPNBLBDUEUZPPC-WPKBUWHJSA-N	443.342	1.652	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)n1cccn1)C2	1782002896	WUEWBWRRKYLVQI-LUXYFRNMSA-N	427.343	1.741	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Br)C2	1782003839	WUGHNKPHEVXPPI-BBGACYKPSA-N	444.139	1.974	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc([N+](=O)[O-])c(O)cc3C)C2)C1	1782103928	DIACGCOKUQSZCL-AUUYWEPGSA-N	441.868	1.306	50	20	IDGD	
CCOc1ncccc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](Cl)COC)C1	1782168157	QZXFSDVZHNXKID-CSODHUTKSA-N	439.940	1.862	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccnc3c1OCO3)C2	1782174008	XVZZLYHTNQSXHT-BXTJHSDWSA-N	439.896	1.192	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CCC(=O)NN(C)C)C2)cc1	1782212051	FAFGJOVGZFFMDE-AUSIDOKSSA-N	446.548	1.196	50	20	IDGD	
O=C(Cc1cccc(C(F)(F)F)c1)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1782979459	MEXNXHPHNXOLSB-QAPCUYQASA-N	434.842	1.678	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(OC)nn3)CCO2)C1	1783353691	ZFZPTKNIRVNIKT-PXAZEXFGSA-N	427.299	1.102	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(C)nc3O)CCO2)C1	1783353709	ZIDMNSDMEFATKI-KSSFIOAISA-N	426.311	1.713	50	20	IDGD	
COc1ccnc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](C)Br)C3)C2)c1OC	1783537479	NUGRIWYGDXQKTQ-XIKOKIGWSA-N	442.310	1.326	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3n[nH]c4cccc(F)c34)CCO2)C1	1783538500	XRRLZPODKLZCSI-ZMZPIMSZSA-N	439.285	1.929	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)COCc3ccc(OC)cc3)CCO2)C1	1783879432	SVQDFBISDDHEAK-NQIIRXRSSA-N	440.924	1.296	50	20	IDGD	
C[C@H](NC(=O)c1ccc(F)cc1)C(=O)N1CCO[C@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783948262	GXFIARDPJKUKMZ-BUXKBTBVSA-N	446.306	1.578	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccn4cncc4c3)C[C@@H]21	1783966713	KTVMWJNAGZBMAR-KCMWZYNZSA-N	449.349	1.959	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H]3CCOC3)C2)C1	1784721447	TWHDXACTSPJVES-NDPADWDBSA-N	431.439	1.738	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)C1CCC(CO)CC1	1785055047	BEXUIJNURPCXEK-YHHCBVJFSA-N	435.334	1.455	50	20	IDGD	
COc1cc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)cc(OC)c1C	1785173794	WCZATKCYMCPHND-FOIQADDNSA-N	426.897	1.055	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3CCCCC3)[C@H]2C1	1786334813	BXSUPWSNDLDOBP-QXDWZXEQSA-N	443.548	1.680	50	20	IDGD	
O=C(Cc1ccccc1C(F)(F)F)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21	1786518228	AYOHIQQXMMZLBO-DIECFANBSA-N	448.869	1.827	50	20	IDGD	
CC[C@H](Br)C(=O)NC1(c2ccc(NC(=O)CC[C@H](N)C(N)=O)cc2)CCC1	1788062395	ZJLGBBOHAVKLLI-GJZGRUSLSA-N	439.354	1.887	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc4ncccn34)C[C@@H]21	1788762472	BBFGROPPIRUYFP-ZOBUZTSGSA-N	431.569	1.174	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cn3nnc4ccccc43)C[C@@H]21	1788765966	XPFQNNFRTFSYLT-BXWFABGCSA-N	445.596	1.263	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(Cl)ncn3)[C@H]2C1	1789058649	OFSRRQWKEDROSO-NDBFUVGKSA-N	435.739	1.960	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4c(c3)C(=O)CC4)[C@H]2C1	1790385670	GZKXROUUGSHJMG-CAIZAGQASA-N	434.920	1.663	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)Oc3cccnc3)C[C@@H]21	1791256905	YNBJUEQQHFAOFT-IAVJCBSLSA-N	425.913	1.082	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1ccccc1C1CC1	1791905840	NPHCAVREMBUOFP-TZYHBYERSA-N	448.328	1.151	50	20	IDGD	
CC(C)(C)[C@@H](O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)C2	1792919799	QHGUKGQLSCWUSY-DRZPZYELSA-N	447.482	1.868	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccccc1C(F)(F)F)C2)[C@@H](O)CCl	1792976520	WGDGTCSAZNWNAP-YXPYIKCWSA-N	434.842	1.437	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2)C1CC1	1793064176	SPMDVQFHPNGELI-SSRUIJIPSA-N	447.935	1.804	50	20	IDGD	
C[C@H](NC(=O)c1ccc(F)cc1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCl	1793115780	XUUSUGGEKPTJMW-DBRALVMTSA-N	425.888	1.182	50	20	IDGD	
Cc1nnc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CO[Si](C)(C)C)C3)s1	1794107003	MVFVMRLKGZOZRX-ZSBFGKGUSA-N	426.615	1.220	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ncc(Cl)cn1	1794542481	IUNULPZLEIRDLZ-LFSVMHDDSA-N	431.718	1.507	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1cc2sccn2c1	1796113209	XXTVJUGYTBGQRC-XCCSTKFXSA-N	430.299	1.895	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)c1ccc2c(c1)CCCO2	1796190468	AEPCDIOBHACTHL-WKCHPHFGSA-N	434.301	1.257	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)c1ccc(-c2cc[nH]n2)cc1	1796193194	SZKMYKNMIDLULV-WKCHPHFGSA-N	444.300	1.322	50	20	IDGD	
CCc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Br)C3)cc(C)n1	1796698608	PEPYEQVZWQVZQW-OCVGTWLNSA-N	428.302	1.846	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2)[C@H]1CN(Cc2ccccc2)CCO1	1797245421	JSDMLONLDFXPQE-ZRSRNVLSSA-N	439.915	1.011	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccn2ccnc2c1	1797443523	JOAGSMCHDBWKCO-FAYQHZLMSA-N	435.322	1.569	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(Cl)ncn1	1798305990	JAXILSRDKFWYMI-DYNIEEOBSA-N	431.718	1.364	50	20	IDGD	
COc1ccc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Br)cn1	1799344658	PSCSOHMDZRIVNL-RMHZUWNSSA-N	444.301	1.303	50	20	IDGD	
COc1c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CCC(=O)NN(C)C)C3)ccc(F)c1F	1800586851	DFAVSHSOJNKXCP-BTTYYORXSA-N	438.475	1.598	50	20	IDGD	
C[C@H](Oc1ccccc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2	1800625903	KPDIKVZHMJWLMG-PLPKTUSISA-N	429.286	1.734	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCCn1ccnc1)C2	1800644051	FZCCSGWFQNBLKN-JYYAWHABSA-N	427.343	1.426	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CCc3ccoc3C1)C2	1800754510	QEURBBHWWKOILC-MOVJQLJTSA-N	425.323	1.758	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(OC(F)F)cn1)C2	1800758389	WHBHEYOORNNMRV-DYNIEEOBSA-N	448.264	1.670	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C[C@@H]1CNc3ccccc3O1)C2	1800976683	BZLPWKPPNDKCGK-HWEQFAERSA-N	437.924	1.093	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)[S@](=O)c1ccccc1)C2	1800979517	NUEDGSAGGBZMDM-WDTOCKOWSA-N	442.965	1.026	50	20	IDGD	
Cc1cc(C)n(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)CBr)C3)n1	1801243992	OCZHWIYMLHBWGS-PTOXDTDZSA-N	441.370	1.511	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccc(OC)c(F)c1	1801503208	UOZFVIMLFBWPPJ-NXEZDXNNSA-N	428.888	1.220	50	20	IDGD	
COC[C@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCN1C(=O)c3ccccc3C1=O)C2	1802272828	GXUYKKKJAVNGHH-KRXQYRFLSA-N	447.919	1.565	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cc3ncsc3[nH]2)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803142536	DZLIMJAXQSWTCA-VBNZEHGJSA-N	433.921	1.939	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@H](CNC(=O)CN2CCOCC2)[C@@H]1c1cccnc1	1806905410	MPVZUGCHTQELLB-RXVVDRJESA-N	434.613	1.271	50	20	IDGD	
N#CC1(C(=O)N2CC[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)CCC1	1810309415	QWPFHTGNFBVQTN-LPHOPBHVSA-N	447.499	1.094	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)c2cc[n+]([O-])cc2)[C@H]1c1cccnc1	1811197391	CDWQGLXIERVHTA-IAOVAPTHSA-N	433.306	1.818	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)c1cc(O)cc([N+](=O)[O-])c1	1811677510	VITTZZOTLNSNBF-MORSLUCNSA-N	448.863	1.615	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2ccc(C#N)cc2)[C@H]1c1cccnc1	1811893497	IFAJBUKGMIIQKN-NZQKXSOJSA-N	448.527	1.646	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H](CNC(=O)COc2ccc(O)nn2)[C@@H]1c1cccnc1	1812349071	AJKXIVCQEBAVIV-BEFAXECRSA-N	447.923	1.927	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2ccnc3c2OCO3)[C@@H]1c1cccnc1	1813031340	LUUDEGXCIUZGDK-HYVNUMGLSA-N	446.891	1.779	50	20	IDGD	
Cc1c[nH]cc1C(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1813070541	JZWFJLWSZSGIQB-LAUBAEHRSA-N	426.521	1.411	50	20	IDGD	
Cc1cnoc1C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1813073865	PKGWVSAYDIAXTB-VQIMIIECSA-N	428.493	1.071	50	20	IDGD	
O=C(Cc1cnc2ccccn12)Nc1cc([C@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1	1814833777	LLAGEFQFJSYCFG-HZPDHXFCSA-N	430.896	1.892	50	20	IDGD	
CN(CC(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1)C(=O)c1ccccc1	1815086125	BRECWPBXUJPAOI-SJORKVTESA-N	447.923	1.774	50	20	IDGD	
O=C(CCc1ccco1)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1	1815336879	HDBXJSYTAUZAMI-OAHLLOKOSA-N	439.302	1.275	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)Cc3nnc(C)s3)sc2C1	1815583608	MHEGOTPWZNAQET-NXEZZACHSA-N	429.955	1.712	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@H]1CCc2nc(NC(=O)c3cc(O)nc(O)n3)sc2C1	1817104117	VPRKOBJDADQQTJ-HYORBCNSSA-N	446.316	1.806	50	20	IDGD	
Cc1ccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)cc1O	1817477328	SQWGKAWJQPDRTL-LJQANCHMSA-N	448.288	1.723	50	20	IDGD	
Cc1ncc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)s1	1818410139	DRQDETBHPLROBO-CQSZACIVSA-N	433.538	1.854	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](O)CCl)CC2)c1cc(-c2ccccn2)[nH]n1	1820639319	HJNZIXYWFGEVDI-BONVTDFDSA-N	446.920	1.754	50	20	IDGD	
CN1CCN(C2(C(=O)Nc3cc([C@H]4CCCCN4C(=O)[C@H](F)Cl)[nH]n3)CC2)CC1	1820794617	CEGTWEHFUSOSIY-ZBFHGGJFSA-N	426.924	1.716	50	20	IDGD	
CN1C(=O)CC[C@H]1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](F)Br)[nH]n1	1820955330	LCBQONABUHXGTC-COPLHBTASA-N	430.278	1.713	50	20	IDGD	
CCOC(=O)C1(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)[C@@H](Cl)COC)n[nH]2)CC1	1822375859	HQDGLKOTMODIEO-GXTWGEPZSA-N	426.901	1.999	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ncc(Cl)cn2)[nH]n1	1822412654	BGODBWUJFWQEQK-CQSZACIVSA-N	448.915	1.532	50	20	IDGD	
CCC[C@@H](NC(C)=O)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1	1822418175	VUXCGTIOORKLPP-WBVHZDCISA-N	449.556	1.080	50	20	IDGD	
CCOCCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1822931613	FANNOXULVDBWSZ-INIZCTEOSA-N	429.481	1.141	50	20	IDGD	
O=C1Nc2c(cccc2C(=O)N2CCC([C@@H]3CCCCN3C(=O)[C@@H](O)CCl)CC2)C1=O	1824184887	AOJBJZLGHICTTM-IRXDYDNUSA-N	447.919	1.654	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)[C@H](O)CCl)CC2)n1	1825409097	QQGSDYYNUTYHBF-ZWKOTPCHSA-N	436.940	1.873	50	20	IDGD	
O=C1C[C@H](C(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@@H](F)Br)CC3)CCN1	1826222514	ZYKNZBCHMVLTNW-DNSOKLHBSA-N	433.303	1.272	50	20	IDGD	
C[C@H](C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](F)Br)CC2)n1cncn1	1826799832	VZWJGJRKEUGQLA-VHSKPIJISA-N	431.291	1.598	50	20	IDGD	
O=C([C@@H]1C[C@]1(F)Cl)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827060723	YHIDALPHTMNLFR-BBTUJRGHSA-N	436.720	1.524	50	20	IDGD	
C[C@@H]1CC[C@H](C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)O1	1828402224	GPECVVSJNXEGLC-TYCQWZJGSA-N	428.338	1.167	50	20	IDGD	
O=C(c1c(Cl)cncc1Cl)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1829599127	OECKVCJGGDPRLH-BBRMVZONSA-N	440.686	1.993	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)C3CC(F)(F)C3)CCO2)C1	1829993341	ZXZPRDFZRFUHNN-CJNGLKHVSA-N	439.297	1.662	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3[nH]nc4ncccc34)C2)C1	1830357382	AUUBUKWBKQQNOT-HXUWFJFHSA-N	435.912	1.293	50	20	IDGD	
C[C@H](Nc1cccnc1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830359703	SWZNJSSFAVFYJK-KKSFZXQISA-N	438.956	1.603	50	20	IDGD	
CC1=C(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)CCO1	1830538875	SQBSATYUWRQMRT-ACJLOTCBSA-N	431.327	1.168	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CC(c3ccccc3)=NO1)CCO2	1831263737	VZSFJPRBGDUWPP-LRXVAGHRSA-N	449.935	1.653	50	20	IDGD	
C=CCC(F)(F)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1	1831444950	SVZJNLFZOHTHFC-LJQANCHMSA-N	434.292	1.811	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)[C@H]2CCCOC2)CC1	1832867138	DUGZMCACRBJDQH-PZJWPPBQSA-N	428.338	1.026	50	20	IDGD	
COc1ccc([C@@H](O)C(=O)NC2CCN(C3CCN(C(=O)[C@@H](F)Cl)CC3)CC2)cc1	1833184417	QEHLVACVAIPSPD-RTBURBONSA-N	441.931	1.835	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3nnsc3C3CC3)CC2)CC1)[C@H](O)CCl	1833310930	YBBUHDNZCJDJCQ-OAHLLOKOSA-N	441.985	1.200	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)Cc3cccc(C)n3)CC2)CC1	1833361452	HJLXYZWSCPCQFL-FQEVSTJZSA-N	436.984	1.758	50	20	IDGD	
C[C@@H](CC(N)=O)C(=O)NC1CCN(C2CCN(C(=O)[C@@](C)(Cl)CCl)CC2)CC1	1833521975	DNDVKSIBTXCBCS-DJJJIMSYSA-N	435.396	1.306	50	20	IDGD	
O=C(c1cnccc1C(F)(F)F)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1834111926	RMAWPCNJXXDPIR-CZUORRHYSA-N	439.793	1.705	50	20	IDGD	
CC(C)N1CCC[C@H]1C(=O)N1CCOC[C@]2(CN(C(=O)CCBr)CCO2)C1	1834826106	BHYUZSCXCXHMNH-LPHOPBHVSA-N	446.386	1.101	50	20	IDGD	
O=C(Cn1cccn1)NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1	1834881613	NPBPJRDIMDBCEA-UHFFFAOYSA-N	426.359	1.240	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)CN3CCN(C)CC3)CC2)CC1	1835479515	HLPKMLLDJONWDX-FQEVSTJZSA-N	442.048	1.213	50	20	IDGD	
C[C@H](Nc1cccnc1)C(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1835685646	RCOFVACSHOHOEG-HRAATJIYSA-N	438.956	1.603	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccnc(OC)c3F)CCO2)C1	1836237917	OJYKSFFNFDQBRE-AUUYWEPGSA-N	429.876	1.317	50	20	IDGD	
O=C(c1cnnc(Cl)c1)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836714928	DMEYLCZCAJTGRE-OAHLLOKOSA-N	431.320	1.342	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)CSCC(=O)OC)CC2)CC1	1836872322	RVAVCILOMCORJD-MRXNPFEDSA-N	434.986	1.909	50	20	IDGD	
O=C(c1nnc(-c2ccccc2)o1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1837537093	MXRCSEYMTUBIME-AUUYWEPGSA-N	438.843	1.341	50	20	IDGD	
Cc1cc(/C=C/C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@](C)(Cl)CCl)C3)C2)no1	1837557034	CCOBLQMPXXPPJD-FKDQEEMOSA-N	446.331	1.689	50	20	IDGD	
CCOC(=O)/C=C/C(=O)N1CCC(OC2CCN(C(=O)[C@@H](Cl)COC)CC2)CC1	1837639074	KPMDACKRGZSFEQ-BDUNBXCCSA-N	430.929	1.358	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)C3(C(F)(F)F)CC3)C2)C1	1837713261	RFXAJTHZIGFDFY-MRXNPFEDSA-N	438.519	1.637	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccn(C(F)F)n3)C2)C1	1837715581	YLZJMFRIKQHDBI-GOSISDBHSA-N	446.527	1.200	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)c3cc(O)n[nH]3)CC2)CC1	1837904119	WBYMJGYXNCPBAT-NSHDSACASA-N	429.315	1.511	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@H](F)Br)CC2)CC1	1838648563	ZDGBSBCUOJPABL-KBPBESRZSA-N	443.741	1.929	50	20	IDGD	
CC(C)n1cnc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)n1	1839152583	DYIWDOXYGIIINK-QZTJIDSGSA-N	448.351	1.165	50	20	IDGD	
Cc1nccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)n1	1839152589	FAPHAXCKVLBWBT-ZWKOTPCHSA-N	431.320	1.091	50	20	IDGD	
CC(C)[C@H](S)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H](F)Br)CCO2)C1	1839199680	ZKAGUINLIBAFFW-YWPYICTPSA-N	427.336	1.088	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(C#N)c3)C2)C1	1840034872	ZMIYGUIZIQRPNK-LIRRHRJNSA-N	436.306	1.412	50	20	IDGD	
Cc1nc2sccn2c1C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840188615	TYSXHKSBSRUDPJ-KRWDZBQOSA-N	447.344	1.578	50	20	IDGD	
N#CCc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)cc1	1840189250	GHARPIJTFJZSOB-LJQANCHMSA-N	426.300	1.626	50	20	IDGD	
O=C(C(Cl)Cl)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CCc4ccccc43)C2)C1	1840190848	QJJICZFLIOPHSU-UZLBHIALSA-N	427.328	1.977	50	20	IDGD	
COC(=O)CCCCCC(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1840234347	NKNJVIHSKUNKOH-NRFANRHFSA-N	446.972	1.831	50	20	IDGD	
C[C@H](Cn1ccnc1)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1	1840433607	ZJFKNPPLBNRRQY-ATZDWAIDSA-N	447.363	1.212	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)/C=C/c3cnc(C)s3)CCO2)C1	1840519613	OSXYPDLTVQYLQE-YKTDSXCKSA-N	443.953	1.175	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CO)C(=O)N1CCCC12CN(C(=O)[C@@](C)(Cl)CCl)C2	1843326047	PUIDDEDSQIKJPW-SJCJKPOMSA-N	438.352	1.312	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1occc1Br)C2	1844264133	ISXATGVQRVEJPV-UHFFFAOYSA-N	448.277	1.171	50	20	IDGD	
CCOC(=O)c1ncn2c1CC[C@H](C(=O)N1CC3(CCCN3C(=O)[C@H](Cl)CC)C1)C2	1845167110	JATODEMPTGAVDF-LSDHHAIUSA-N	436.940	1.843	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)[C@@H]2CCCOC2)C1	1847033226	DHUNXQQWDNKHAV-OAHLLOKOSA-N	431.445	1.764	50	20	IDGD	
CC1(CC(=O)N2CCCC23CN(C(=O)[C@@H](O)CCl)C3)CN(C(=O)OC(C)(C)C)C1	1847142253	VRLMHVSOUHILDS-AWEZNQCLSA-N	429.945	1.437	50	20	IDGD	
COc1ccc(-c2noc(CCC(=O)OCC(=O)NNC(=O)c3cccs3)n2)cc1	12262762	FEILGQANYYZOQY-UHFFFAOYSA-N	430.442	1.744	50	20	IDGD	
Cc1nn(C)c(C)c1CC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	24576581	YYCWWZCJKHOMDL-UHFFFAOYSA-N	433.534	1.215	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](CNC(=O)NNC(=O)COc2ccccc2C#N)C1	726269473	ZXJNVXXOEUTYOQ-OAHLLOKOSA-N	431.493	1.915	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)COc1ccc(Br)cc1	727060389	WKEBSKFJYSKWTB-UHFFFAOYSA-N	431.287	1.683	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)N[C@H](C)c2cccc(S(=O)(=O)N(C)C)c2)cc1	727610420	QMLBQNICLZXVHQ-OAHLLOKOSA-N	448.545	1.970	50	20	IDGD	
Cn1ccnc1[C@@](O)(CCNC(=O)NNC(=O)CCCc1ccccc1)C(F)(F)F	727843120	SJEAPPOJELJQBF-SFHVURJKSA-N	427.427	1.913	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cnc(-c3ccccn3)s2)cc1OC	727886702	RHNHIHSYKNWYCG-UHFFFAOYSA-N	442.453	1.840	50	20	IDGD	
O=C(CCNC(=O)c1n[nH]c2ccccc12)NNC(=O)c1ccc(Br)s1	728065603	RKHZVMUQWMRKFM-UHFFFAOYSA-N	436.291	1.968	50	20	IDGD	
O=C(NNc1nc(-c2ccccc2)no1)c1cccc(S(=O)(=O)NC[C@H]2CCCO2)c1	728081120	ADOMJOOZZKJULO-MRXNPFEDSA-N	443.485	1.951	50	20	IDGD	
CCO[C@H](C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1)c1ccccc1	728216155	SYKJLMXKCMWAQN-FQEVSTJZSA-N	432.546	1.844	50	20	IDGD	
COc1cc(CNC(=O)NNC(=O)c2cccc(OC(F)F)c2)ccc1OCCO	728599943	TVGGGAQNFGAIFY-UHFFFAOYSA-N	425.388	1.812	50	20	IDGD	
Cc1cc(C)c(S(=O)(=O)N2CCC(C(=O)NNC(=O)Cc3cccnc3)CC2)c(C)c1	728850904	GMZDBXMDJIFCBZ-UHFFFAOYSA-N	444.557	1.798	50	20	IDGD	
C[C@@H]1CCCC[C@@]12NC(=O)N(CC(=O)NNc1ccc(S(=O)(=O)C(F)F)cc1)C2=O	728976139	IJQPOKCPZVXLBP-ADLMAVQZSA-N	444.460	1.627	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)NCc1ccccc1NS(=O)(=O)c1ccccc1	729053626	QBSHJIXJRRDKQA-UHFFFAOYSA-N	439.497	1.956	50	20	IDGD	
C[C@@H](CC(=O)OCC(=O)NNC(=O)c1cccs1)S(=O)(=O)c1ccc(F)cc1	729136876	ZITKHOMZUABLQC-NSHDSACASA-N	428.463	1.444	50	20	IDGD	
O=C(COC(=O)Cc1coc(-c2cccs2)n1)NNC(=O)[C@H]1COc2ccccc2O1	730053870	BAQIACYTSJTIQF-OAHLLOKOSA-N	443.437	1.476	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCc2c(C)noc2C)c1	730676347	BWWAQDWHJSIBER-UHFFFAOYSA-N	437.522	1.509	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)c2nnn(-c3ccc4c(c3)OCCO4)c2C)c(C)c1	731454753	MEFGUIQPDMHYBI-UHFFFAOYSA-N	436.472	1.837	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)[C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])o2)c1	731957750	ACYWDVQKCQOCIS-CQSZACIVSA-N	432.389	1.271	50	20	IDGD	
O=S(=O)(CCNS(=O)(=O)c1ccc(CCCCl)cc1)NC[C@@H]1CCCCO1	732227523	FOOROKBALMOIFM-INIZCTEOSA-N	438.999	1.625	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CCN2C[C@H](C)O[C@@H](C)C2)ccc1OCc1cscn1	732264000	QSDOUDAMEDMWLN-GJZGRUSLSA-N	448.545	1.991	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NCC1(N2CCSCC2)CCCCC1	732703298	RHZYTMSASIQZAO-UHFFFAOYSA-N	439.607	1.560	50	20	IDGD	
Cc1ccc(-n2c(NNC(=O)Cn3ccc(O)nc3=O)nc3ccccc3c2=O)c(C)c1	733265189	KXTPDVDNEMHWJC-UHFFFAOYSA-N	432.440	1.408	50	20	IDGD	
CCOCCCn1c(NNC(=O)c2ccc(S(=O)(=O)NC)o2)nc2ccccc2c1=O	733267678	AIFQITMQFKAZEV-UHFFFAOYSA-N	449.489	1.081	50	20	IDGD	
O=C(NNC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1)c1cnn(-c2ccccc2)c1	733349601	DRBAPADRAIUHJH-UHFFFAOYSA-N	435.444	1.957	50	20	IDGD	
C[C@@H]1CCCC[C@@H]1CCNC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	734071642	NTOXWELMZKWOID-IAGOWNOFSA-N	438.598	1.860	50	20	IDGD	
C[C@@H]1CN(S(=O)(=O)c2cc(C(=O)NNc3cnccn3)ccc2Cl)C[C@@H](C)O1	734245494	IIYHAFOBHCCWPO-VXGBXAGGSA-N	425.898	1.685	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(Br)c(C(=O)NNc2cc(C)ncn2)c1	734256284	BIPHOCHYEWQKSM-UHFFFAOYSA-N	444.311	1.229	50	20	IDGD	
Cc1[nH]c2c(C(=O)NNc3ncccc3S(=O)(=O)N3CCN(C)CC3)cccc2c1C	735118010	MTNGAGVGTYREJX-UHFFFAOYSA-N	442.545	1.873	50	20	IDGD	
COCCNS(=O)(=O)c1cccc(CNC(=O)NNC(=O)CCc2ccccc2)c1	735518882	NWWMXGZXDVUHAX-UHFFFAOYSA-N	434.518	1.075	50	20	IDGD	
COc1cc(C(=O)NCC(=O)NNc2cccc(C(F)(F)F)n2)cc(OC)c1OC	740138028	XIXAIQRSIQDXPX-UHFFFAOYSA-N	428.367	1.999	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)[C@H]1CSCN1C(=O)c1ccc(C(C)(C)C)cc1	740853183	XHTVWUYXQVSRTC-QGZVFWFLSA-N	448.589	1.951	50	20	IDGD	
CN(CCCC(=O)NNc1nc(-c2cccnc2)no1)C1=NS(=O)(=O)c2ccccc21	742073072	RHUMIEOSTYRHND-UHFFFAOYSA-N	441.473	1.436	50	20	IDGD	
CCN1CCN(CC(=O)NNc2c(Cl)cc(Br)cc2Cl)C(=O)C1=O	742133020	DNLZXIJQUAYUFU-UHFFFAOYSA-N	438.109	1.890	50	20	IDGD	
CCn1c(=O)c2ccccc2n(CC(=O)NNC(=O)c2cccc(Br)c2)c1=O	742768737	JKGYCUVQNVSWFE-UHFFFAOYSA-N	445.273	1.407	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)[C@H](C)NC(=O)OC(C)(C)C	743115362	JSMUCMOLWTWFJV-JTQLQIEISA-N	429.857	1.566	50	20	IDGD	
COCCOc1ncccc1CNC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	743548543	LJQRMCJNJIKZSO-UHFFFAOYSA-N	437.478	1.046	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NCCCOCC2CCOCC2)cc1	743622973	CEXBKYIXIOCUHG-UHFFFAOYSA-N	428.511	1.259	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@@H]2CCCN(C(=O)c3ccccc3)C2)cc1	743829975	IWHJHPDSWRFPRD-MRXNPFEDSA-N	444.513	1.795	50	20	IDGD	
CCn1c(SCC(=O)OCC(=O)NNC(=O)c2cccc(C)c2)nnc1-c1ccco1	744456004	SXLZNYUNDBAJMN-UHFFFAOYSA-N	443.485	1.963	50	20	IDGD	
COc1ccc([N+](=O)[O-])cc1C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	744620057	BANBHXDZANPFCH-UHFFFAOYSA-N	436.446	1.381	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1cc2c(nc1O)CCCC2	744621298	OGGLYBPXMZVJDU-UHFFFAOYSA-N	432.502	1.444	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCCCC(=O)OCC(=O)NNC(=O)c2cccc(C)c2)cc1	744827751	BYRMWMHSCDVJDJ-UHFFFAOYSA-N	447.513	1.366	50	20	IDGD	
COc1ccc([N+](=O)[O-])cc1NS(=O)(=O)c1ccc(C(=O)NNC(=O)N(C)C)cc1	746007815	CHCHWMWSAVTCMA-UHFFFAOYSA-N	437.434	1.320	50	20	IDGD	
CN(C)C(=O)NNC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc(Br)s1	746014257	ABVRKIBCQAPUQS-SECBINFHSA-N	439.357	1.356	50	20	IDGD	
C[C@H](C(=O)NNc1nc(-c2ccc(Cl)cc2)no1)N1C(=O)[C@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O	746256386	PFBBBTWTGCYIJI-ZPTNNJSTSA-N	431.836	1.384	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(Br)nc2)c1	746579564	JGZIWGNGZJRXJM-UHFFFAOYSA-N	427.280	1.169	50	20	IDGD	
O=C(CNC(=O)NNC(=O)c1ccc(Br)s1)NCCc1ccccc1	746718936	SIYIVIKEKCLPFI-UHFFFAOYSA-N	425.308	1.814	50	20	IDGD	
CC(C)c1nnc(CCC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)o1	746813836	WJAXCRZDPABERL-UHFFFAOYSA-N	449.533	1.761	50	20	IDGD	
CC(=NNC(=O)c1cccc2cccnc12)c1ccc(S(=O)(=O)NCC(=O)O)cc1	747356009	JOTKGHRKVNUHIE-UHFFFAOYSA-N	426.454	1.752	50	20	IDGD	
C[C@@H]1CN(C(=O)c2ccc(CNC(=O)NNC(=O)Cc3ccncc3)cc2)C[C@@H](C)O1	747581914	RHSVZSUWFHXRFO-HZPDHXFCSA-N	425.489	1.404	50	20	IDGD	
O=C(CCc1nc(-c2ncccn2)no1)NNc1nc(Br)cn2ccnc12	750247731	SGGJEUYLTSFKHN-UHFFFAOYSA-N	430.226	1.408	50	20	IDGD	
N#C/C(=C/c1ccc(F)cc1)C(=O)NC1CN(S(=O)(=O)c2ccc3c(c2)OCCO3)C1	752756631	DFNZYXSOFVOTJV-DHDCSXOGSA-N	443.456	1.693	50	20	IDGD	
C[C@@H](C[S@](C)=O)NC(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	753359670	RJIKPOZLXIWXMV-PSKUBERUSA-N	441.513	1.156	50	20	IDGD	
O=C(NNC(=O)c1cc2c(s1)CCCCC2)NC1CCN(S(=O)(=O)C2CC2)CC1	753967872	ROHJWUAWRIDAFF-UHFFFAOYSA-N	440.591	1.918	50	20	IDGD	
Nc1ccc(C(=O)OCC(=O)NNC(=O)c2ccccc2)c(I)c1	754588680	RQIJKUTZTRHPRI-UHFFFAOYSA-N	439.209	1.491	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)Nc2nc(CN3CCOCC3)cs2)cc1	755452323	GMAKRLMAFAIKCZ-CQSZACIVSA-N	447.517	1.798	50	20	IDGD	
Cn1cc(C=NNC(=O)CN(Cc2ccccc2)S(=O)(=O)c2ccc(Cl)cc2)nn1	755526675	ONQIUOXCICRZAQ-UHFFFAOYSA-N	446.920	1.810	50	20	IDGD	
COC(=O)CNC(=O)c1ccc(NC(=O)NNC(=O)COc2cc(C)cc(C)c2)cc1	755542717	AIIQORXEDCPZSJ-UHFFFAOYSA-N	428.445	1.438	50	20	IDGD	
CN1CCC/C1=N\S(=O)(=O)c1cccc(NC(=O)NNC(=O)c2cccc(C#N)c2)c1	756032335	SLZGSDKPKIQRIU-XIEYBQDHSA-N	440.485	1.838	50	20	IDGD	
CNS(=O)(=O)c1ccc(C)c(NC(=O)NNC(=O)c2cc(Br)c[nH]2)c1	756529297	XHUHBFCLIFQIOY-UHFFFAOYSA-N	430.284	1.460	50	20	IDGD	
O=C(NNC(=O)c1cccc2ncccc12)Nc1ccccc1OCC(=O)N1CCOCC1	756872080	AMYRWMWKAXUOEK-UHFFFAOYSA-N	449.467	1.939	50	20	IDGD	
Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	757624040	PIAJDXZODROAAA-UHFFFAOYSA-N	435.462	1.928	50	20	IDGD	
Cc1ccccc1-n1nc(C)c2cc(C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)sc21	758045861	QBKXPQZSJADUSI-GFCCVEGCSA-N	435.531	1.403	50	20	IDGD	
O=C(NNC(=O)c1cccc(OCc2cn3ccccc3n2)c1)C(=O)Nc1ccccn1	758824722	ZYRSDHPNXLLKCM-UHFFFAOYSA-N	430.424	1.708	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1CC(CC(=O)NNC(=O)C(=O)Nc1ccccn1)C2	758841367	ZMTSUCNMEGZZOD-GJZGRUSLSA-N	431.493	1.736	50	20	IDGD	
COCCN(CCI)c1c(O)nc(=O)n(Cc2ccccc2)c1N	759382592	ASWXGQWFONQMOF-UHFFFAOYSA-N	444.273	1.467	50	20	IDGD	
Cc1cc(S(=O)(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc(C(=O)O)c1C	760363672	PYIRPFSUQPJZFV-UHFFFAOYSA-N	433.490	1.018	50	20	IDGD	
O=C(NNC(=O)c1ccncc1)C(=O)Nc1ccnn1Cc1ccc(C(F)(F)F)cc1	763462558	OYZBYGOGZZMKFB-UHFFFAOYSA-N	432.362	1.745	50	20	IDGD	
COc1ccc(NC(=O)c2cccc(NC(=O)C(=O)NNC(=O)c3ccccc3O)c2)cn1	763527739	QYBBEDQSTJZHHQ-UHFFFAOYSA-N	449.423	1.448	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)C(=O)Nc1ccc(-c2n[nH]c(C3CC3)n2)cc1	763557644	CPHOTYMSMFFPDM-UHFFFAOYSA-N	434.412	1.478	50	20	IDGD	
Cc1cc(C(=O)NC(C)C)ccc1NC(=O)C(=O)NNC(=O)[C@H]1COc2ccccc2O1	763574383	ZJWWEDAUYFRKEW-GOSISDBHSA-N	440.456	1.059	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cnn(-c3ccccc3F)c2C)cc1	763811252	HODJIAYDTVLAGY-UHFFFAOYSA-N	425.420	1.793	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)C(=O)Nc1ccc(-n2nccn2)cc1	763849289	IAYILUODCARVBA-HNNXBMFYSA-N	444.451	1.974	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccc(F)c(C(=O)N(C)C)c1	763864343	AZVOGDGLRSXHHA-NSHDSACASA-N	434.399	1.220	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)NNC(=O)C(=O)Nc1cccn(Cc2ccccc2)c1=O	763865952	XWXSLWCXZSNMJZ-UHFFFAOYSA-N	443.463	1.707	50	20	IDGD	
COc1ccc(OC)c(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(C(C)=O)cc2)c1	763873161	RYBJMPLJWWOSRU-ZDUSSCGKSA-N	429.429	1.460	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(-c3nnc(C)o3)c2)cc1OC	763899838	CSHHFYFBULTFCR-UHFFFAOYSA-N	439.428	1.852	50	20	IDGD	
COC(=O)CNC(=O)c1ccc(NC(=O)NNC(=O)CSc2ccccc2O)cc1	763916548	VMOHIUDAQSZKDV-UHFFFAOYSA-N	432.458	1.240	50	20	IDGD	
Cc1nn(C)c2ncc(NC(=O)C(=O)NNC(=O)c3cc4c(s3)CC[C@H](C)C4)cc12	763940492	SFPVXIPWPFHPIG-JTQLQIEISA-N	426.502	1.863	50	20	IDGD	
CN(C)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)C2=S=C3CCCCCC3=C2)cc1	763961050	BSQQKZXGQQSBLU-UHFFFAOYSA-N	428.514	1.456	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1ccc(N2CCSCC2)cc1	764003450	DJKVEJSBJPWKIJ-UHFFFAOYSA-N	442.497	1.411	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccnc(OCC(F)(F)C(F)F)c1	764040095	CSWCMAPNPXVDLI-UHFFFAOYSA-N	444.341	1.769	50	20	IDGD	
C[C@H]1Cc2cc(C(=O)NNC(=O)CSc3ccccc3O)ccc2N1S(C)(=O)=O	764045227	FLNGYCIVXFNAHL-LBPRGKRZSA-N	435.527	1.656	50	20	IDGD	
O=C(CCc1ccccc1)NNC(=O)C(=O)Nc1cc2c(cc1Br)OCCO2	764192901	QHBUIUMKGXCYIP-UHFFFAOYSA-N	448.273	1.939	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)C(=O)Nc1cccc(-c2ncco2)c1	764204062	RQGQSOLEDASEBV-UHFFFAOYSA-N	431.449	1.732	50	20	IDGD	
CO[C@@H]1Cc2ccc(NC(=O)C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)cc2C1	764204526	XRPLLBCNMIXUPH-MRXNPFEDSA-N	434.493	1.191	50	20	IDGD	
C#CCOc1ccc(NC(=O)C(=O)NNC(=O)c2cc(OC)ccc2Br)cc1	764231048	LVCLMYLOHISJBA-UHFFFAOYSA-N	446.257	1.869	50	20	IDGD	
COCCSc1ccc([N+](=O)[O-])cc1C(=O)NNC(=O)Cc1cn2ccccc2n1	764279016	IHXPCUCNHWVTCE-UHFFFAOYSA-N	429.458	1.985	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C(=O)Nc1ccc(C[C@@H]2CC(=O)NC2=O)cc1)c1ccccc1	764327805	FMVYYJVMYIYMRH-AEFFLSMTSA-N	436.468	1.172	50	20	IDGD	
C[C@]1(c2ccc(C(=O)NNc3c(F)cc(C(=O)NC4CC4)cc3F)cc2)NC(=O)NC1=O	764334148	IRAACXCIWCEZMT-OAQYLSRUSA-N	443.410	1.669	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3OC)[nH]n2)cc1OC	764378016	VIEOHKORSCAZGZ-UHFFFAOYSA-N	439.428	1.502	50	20	IDGD	
CCCCn1ncc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)c1C	764387688	MEEBOTGJCKIOID-UHFFFAOYSA-N	427.440	1.921	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1ccc2c(c1)NC(=O)CS2	764392773	KXBKUHHRPVLEED-UHFFFAOYSA-N	446.510	1.618	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1cncc(Br)c1	764394138	WYUCFWHLNBMTID-UHFFFAOYSA-N	439.291	1.731	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1cccnc1Oc1cccc(C)c1C	764398929	YRPKQGGPHZVIBK-HNNXBMFYSA-N	430.461	1.628	50	20	IDGD	
COC(=O)[C@H]1CN(C(=O)C(=O)NNC(=O)c2ccc(Cl)cc2F)c2ccccc2O1	764412003	CLTHFENAVXECGF-OAHLLOKOSA-N	435.795	1.207	50	20	IDGD	
O=C(C[C@@H]1OCCc2ccccc21)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765733616	NYPGEHHTICQZPS-NRFANRHFSA-N	436.512	1.296	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)CCn3cnc4ccccc43)CC2)cc1	766647265	CMIKNCXRLMOCBH-UHFFFAOYSA-N	434.544	1.700	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)C(=O)Nc1ccccc1	766663061	IYSMXIMWFPSUJJ-UHFFFAOYSA-N	429.908	1.244	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)c2c([N+](=O)[O-])cnn2C)c2ccccc2c1=O	766756076	CVVWEWVRZSPKCF-UHFFFAOYSA-N	427.421	1.303	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNc1ccc([N+](=O)[O-])cc1	768247367	LNMTWLBAVUVIQH-UHFFFAOYSA-N	434.474	1.692	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)[C@H]3Cc4cc(F)ccc4O3)n[nH]2)cc1OC	768275442	BVWDMGZVGSQHEZ-LJQANCHMSA-N	426.404	1.998	50	20	IDGD	
CS(=O)(=O)CC[C@@H](NC(=O)c1ccccc1Cl)C(=O)NN=c1cc[nH]cc1Cl	768453292	YNLIXBCOSGNZPN-OAHLLOKOSA-N	445.328	1.487	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)NCCn2cc([N+](=O)[O-])cn2)c1	769227781	LUMXWDXRJIDITG-UHFFFAOYSA-N	427.215	1.207	50	20	IDGD	
COC(=O)CNC(=O)c1ccc(NC(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)cc1	770110917	PGXKMGPSFUVYHX-GFCCVEGCSA-N	448.863	1.863	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)N[C@H]1CCCN(CC(F)(F)F)C1=O	770659362	RDODQYSTUBTRBC-MFKMUULPSA-N	436.818	1.991	50	20	IDGD	
CCN1CCN(c2cccc(NC(=O)C(=O)NNC(=O)Cn3ccc4ccccc43)c2)CC1	770770630	AXDNUYGNPUXSBZ-UHFFFAOYSA-N	448.527	1.569	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)[C@@H]3CS[C@]4(c5ccc(F)cc5)CCC(=O)N34)nc21	770973597	NMHWFPANYLZXAC-DJJJIMSYSA-N	443.464	1.242	50	20	IDGD	
O=C(Cc1cc(Br)ccc1F)NNC(=O)c1csc(N2CCOCC2)n1	771229319	UMNKFRHOZKXJAQ-UHFFFAOYSA-N	443.298	1.885	50	20	IDGD	
CCc1c(C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)cnn1-c1ccc(Cl)cc1	771267361	UDWKTWXSGIFQKQ-LBPRGKRZSA-N	425.898	1.219	50	20	IDGD	
COCCOc1cccc(CC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)c1	772219853	LWRUVPSNYBVKFG-UHFFFAOYSA-N	434.518	1.317	50	20	IDGD	
N#CCCn1cc(/C=C(\C#N)C(=O)OCCN2CCCS2(=O)=O)c(-c2ccccc2)n1	773096461	OYKGGJXWEBLXNV-NBVRZTHBSA-N	439.497	1.949	50	20	IDGD	
COC(=O)c1ccccc1S(=O)(=O)N1CCC(C(=O)NCCCSC#N)CC1	773587651	JMYKNDGIQRYXJQ-UHFFFAOYSA-N	425.532	1.594	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1cccc(-n2ccnn2)c1	774008444	IUVPNXCLIWUNIB-GFCCVEGCSA-N	428.836	1.474	50	20	IDGD	
CN(C)C(=O)[C@@H]1CC[C@H](CNC(=O)NNC(=O)COc2ccccc2-c2ccccc2)O1	775455895	XTZDQXMYWJOAAK-XLIONFOSSA-N	440.500	1.699	50	20	IDGD	
Cc1cnc(Br)cc1NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	776051552	ALHMRVDFVQLUAN-UHFFFAOYSA-N	431.250	1.866	50	20	IDGD	
O=C(COC(=O)CCc1nc(O)c2ccccc2n1)NNC(=O)c1cccc(Cl)c1	776065162	GBNDWPZLKARROS-UHFFFAOYSA-N	428.832	1.926	50	20	IDGD	
O=C(O)c1cc(S(=O)(=O)NNC(=O)N2CCOCC2)cc(Br)c1Cl	777618317	DKRWHSZTZRXZOA-UHFFFAOYSA-N	442.675	1.036	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)NC[C@H]1CCCN(Cc2cccs2)C1	778640010	LGMKGJSSXZXJFX-CQSZACIVSA-N	425.555	1.815	50	20	IDGD	
O=C(NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12)N[C@H]1CCC[C@@H]1CCO	779710318	CHKUTMVYQKQYPZ-XLIONFOSSA-N	449.511	1.940	50	20	IDGD	
CCNC(=O)N(C)NC(=O)c1ccc(OC)c(S(=O)(=O)N(C)Cc2ccccc2)c1	780709986	VCTNCJJZDBLJQC-UHFFFAOYSA-N	434.518	1.822	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)N[C@H]1CCCN(c2ccc(C#N)cc2)C1=O	780893995	IHYJWMCAVJXLPT-KDOFPFPSSA-N	439.447	1.991	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)[C@H]1C[C@]12CCN(C(=O)OC(C)(C)C)C2	781281966	MDHIZFRSPYQNIA-HXOBKFHXSA-N	445.516	1.875	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)NCc1ccccc1CN1CC[C@H](O)C1	781954858	OJNZQVIWQMIQJY-SFHVURJKSA-N	444.557	1.885	50	20	IDGD	
O=C(NNc1ncncc1Cl)C(=O)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1	782160411	SFAXMQVYUWHGRC-UHFFFAOYSA-N	438.897	1.386	50	20	IDGD	
COc1ccccc1[C@](N)(C(=O)NNC(=O)c1ccc2c(c1)OCCO2)C(F)(F)F	782164868	WNCFDEVVAWDJPX-SFHVURJKSA-N	425.363	1.644	50	20	IDGD	
CS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNc2ncnc3ccsc23)cc1Cl	783254967	OYNJZSJWUSDFPH-UHFFFAOYSA-N	440.894	1.798	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)C(=O)N2CCc3cc(F)c(F)cc32)nc1	783262284	CFBPLFSFZUEDNH-UHFFFAOYSA-N	439.444	1.079	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2ccc(OC(F)F)cc2OC(F)F)CCS(=O)(=O)C1	783425895	JWKUEBJVBBDHNU-OAHLLOKOSA-N	443.375	1.026	50	20	IDGD	
O=C(NNc1ccc(-n2cccn2)nn1)C(=O)Nc1ccc(F)cc1OCC(F)(F)F	783432923	IDKPTYNDOHGAFI-UHFFFAOYSA-N	439.329	1.824	50	20	IDGD	
CCCCN(C)c1ccc(NC(=O)C(=O)NNC(=O)CNC(=O)c2cccs2)cc1	784003661	KYYBREVOZFRPMF-UHFFFAOYSA-N	431.518	1.500	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)c2nnn(Cc3ccc(C(F)(F)F)cc3)c2C)n1	784731628	BYXSAJFIVZACGB-UHFFFAOYSA-N	435.410	1.928	50	20	IDGD	
COc1cc(Br)c(NC(=O)C(=O)NNc2ccc(Cl)nn2)cc1OC	784789734	OITPKPRIKRFZPO-UHFFFAOYSA-N	430.646	1.992	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)F)cc1)C(=O)Nc1ccccc1-n1cccn1	784835259	KNDKWZCEKUSMGC-UHFFFAOYSA-N	435.412	1.950	50	20	IDGD	
O=C1CN(c2ccc(NC(=O)C(=O)NNc3c(Cl)cc(F)cc3Cl)cn2)CCN1	784877879	DZYFNTHVLNBQRR-UHFFFAOYSA-N	441.250	1.546	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NN=C(C)c1ncc[nH]1)N(S(C)(=O)=O)CC2	790151567	NHOZEBSPILHXEH-OAHLLOKOSA-N	435.506	1.216	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NN=C[C@H]2CCCN(C(=O)CNC(=O)OC(C)(C)C)C2)cc1	794484741	ROIBQEDRTRNJOU-MRXNPFEDSA-N	445.520	1.799	50	20	IDGD	
CC[C@@H](C)n1ncc(NC(=O)C(=O)NNC(=O)CNC(=O)OCc2ccccc2)c1C	797368785	GYFAPECDBWQVRC-CYBMUJFWSA-N	430.465	1.175	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc(N3C[C@H](C)O[C@H](C)C3)ccn2)cc1C	798308942	FAWZENXJXDFLNK-IYBDPMFKSA-N	425.489	1.712	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)Cn2c(CS(C)(=O)=O)nc3ccccc32)cc1	802054349	JOTCBPVIJMMPCD-UHFFFAOYSA-N	431.474	1.442	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(N2C[C@H](C(=O)NNc3cccc(F)n3)CC2=O)cc1	804772709	OEXZVAVJRYNNOM-CQSZACIVSA-N	449.508	1.747	50	20	IDGD	
O=C(NNC(=O)c1ccc2ncn(-c3ccc(Cl)cc3)c2c1)N[C@@H]1CCS(=O)(=O)C1	805168204	NLLXMTZSQLFSSY-CQSZACIVSA-N	447.904	1.810	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@](N)(c2cccc(F)c2)C(F)(F)F)c1	806444667	CIRGCWGVKDXRNH-MRXNPFEDSA-N	433.383	1.407	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cnn(C)c2-c2ccccc2)cc1OC	806975014	KGKVKOMYZSGEIT-UHFFFAOYSA-N	437.456	1.894	50	20	IDGD	
Cn1c(=NNC(=O)C(=O)Nc2cc(F)c(N3CCOCC3)cc2F)sc2ccccc21	806997731	UEEVGQWESBKMHZ-UHFFFAOYSA-N	447.467	1.925	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCc2noc3c2CCCC3)cc1	807618290	LLQGCEDSEACIMA-UHFFFAOYSA-N	435.506	1.013	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](N2CCN(CC(=O)NNC(=O)c3cccs3)CC2)C1	808774555	VUEJYFVTXXWFFS-HNNXBMFYSA-N	437.566	1.136	50	20	IDGD	
CCOc1cc(Br)c(F)cc1NC(=O)C(=O)NNc1nccc(OC)n1	810387811	HXRAKWGNRPVEPC-UHFFFAOYSA-N	428.218	1.867	50	20	IDGD	
Cc1noc(C)c1S(=O)(=O)NCC(=O)NNc1nc(-c2ccccn2)nc2c1CCC2	810442073	GWGXKZBMILCHRF-UHFFFAOYSA-N	443.489	1.054	50	20	IDGD	
O=C([C@H]1CCN(c2ccccc2F)C1)N1CCN(S(=O)(=O)CBr)CC1	810911580	DSWKIDFDBRQKTE-ZDUSSCGKSA-N	434.331	1.478	50	20	IDGD	
CN1CCN(S(=O)(=O)N2CCN(Cc3ccc(OCCCCl)cc3)CC2)CC1	811456326	LOSLHTZMAVZPOP-UHFFFAOYSA-N	431.002	1.304	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)c1sccc1S(=O)(=O)N1CCc2ccccc2C1	812203544	FNNXJHHPWNMQBM-UHFFFAOYSA-N	444.538	1.908	50	20	IDGD	
Cc1cnc(Br)c(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)c1	812982823	SHNXAMTVJAMKGL-UHFFFAOYSA-N	445.277	1.368	50	20	IDGD	
Cn1cnnc1COCC(=O)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1	815157729	VQGNZPQHUDVMGK-FQEVSTJZSA-N	434.500	1.106	50	20	IDGD	
O=C(c1ccc(Br)c(F)c1)N1CCC[C@@H](C(=O)N2CC[C@H](B(O)O)C2)C1	864231074	IRSCBWYUPJKHQM-OLZOCXBDSA-N	427.079	1.516	50	20	IDGD	
O=C(Cc1ccc(Br)cc1)N[C@@H](C(=O)N1CC[C@H](B(O)O)C1)c1ccccc1	864233829	KNFNEHISZWXBIS-QFBILLFUSA-N	445.122	1.924	50	20	IDGD	
O=C(NNc1ncccn1)c1ccc(Br)c(S(=O)(=O)N2CCOCC2)c1	913040215	LLFCVTXNIAOOAT-UHFFFAOYSA-N	442.295	1.017	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)CCc1ccc(S(=O)(=O)NC2CC2)cc1	913476891	LTVJNLGWJHFCQF-UHFFFAOYSA-N	446.529	1.328	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)/C(C#N)=C/c1cc(C#N)n(C)c1C	914504923	IPSPXBQRLJKSFM-OVCLIPMQSA-N	439.501	1.175	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)ccc1OCc1cccnc1	915262007	ONWOGCHQZQGHCW-INIZCTEOSA-N	433.486	1.255	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)c1cc(S(=O)(=O)N(C)C)ccc1F	915776405	NSIMUBKVNGZRAE-UHFFFAOYSA-N	447.492	1.449	50	20	IDGD	
CSC[C@H](C(=O)NNC(=O)Cc1c[nH]c2ccccc12)N1C(=O)[C@@H]2CCCC[C@H]2C1=O	915787681	OEIMQFQBOOIGSY-JFIYKMOQSA-N	442.541	1.765	50	20	IDGD	
CN1CCN([C@@H](CNC(=O)NNC(=O)COc2ccccc2C#N)c2cccs2)CC1	915902687	ZSFARDXUYAWJOO-KRWDZBQOSA-N	442.545	1.318	50	20	IDGD	
CN(CC(=O)NNC(=O)NCCc1cccs1)S(=O)(=O)c1ccc(Cl)cc1	915905668	QUDDAQJHJMDANO-UHFFFAOYSA-N	430.939	1.595	50	20	IDGD	
C[C@@H](CCc1ccco1)NC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	915914170	OJMZPTUNTYSGMN-HNNXBMFYSA-N	436.538	1.258	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NCc2cccc(NC(=O)C3CCC3)c2)c2ccccc2c1=O	916380810	RUBDZZZBEXVLFY-UHFFFAOYSA-N	448.483	1.816	50	20	IDGD	
CC(=NNC(=O)C(=O)Nc1ccc(C)c(C)c1)c1ccc(S(=O)(=O)NCC(=O)O)cc1	916544036	PJTNZKYNKBRDFI-UHFFFAOYSA-N	446.485	1.145	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)[C@H]2CC(=O)N(c3ccc(OC)cc3OC)C2)cc1	919833797	CESYKWPYOBTWHC-INIZCTEOSA-N	441.484	1.846	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)[C@H](CSC)N2C(=O)[C@H]3CCCC[C@H]3C2=O)cc1	919836524	VWZCPKUBVSGPES-KSZLIROESA-N	447.557	1.682	50	20	IDGD	
NC(=O)c1ccc(/C=C\C(=O)N2CCC[C@@H]2C(=O)NNC(=O)c2c[nH]c3ccccc23)cc1	920031240	AAAGSZIZPQOKCD-FNUUXAGOSA-N	445.479	1.732	50	20	IDGD	
Cn1c(C=NNC(=O)c2cc(-c3ccco3)nc3ccccc23)nc2c1c(O)nc(=O)n2C	920364209	RSDMCYLVUCHMEB-UHFFFAOYSA-N	443.423	1.945	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1nnc(O)c2ccccc12)c1ccc(N2CCOCC2)cc1	920921671	OZKIJPKZUVJLEG-CQSZACIVSA-N	436.472	1.877	50	20	IDGD	
CCCNC(=O)NNC(=O)c1ccc(Br)c(S(=O)(=O)NC(C)(C)C)c1	921038205	JQTNOBLEFFCVHV-UHFFFAOYSA-N	435.344	1.880	50	20	IDGD	
O=C(N[C@H](Cc1ccccc1)C(=O)NNC(=O)[C@H]1COc2ccccc2O1)c1cccnc1	921299407	RNBQCNVCEBMPOR-WIYYLYMNSA-N	446.463	1.410	50	20	IDGD	
CCS(=O)(=O)c1cccc(NC(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)c1	1116564960	CCBVLBXCDPAKCZ-UHFFFAOYSA-N	437.474	1.973	50	20	IDGD	
O=C(NCc1cccc(OCC(F)(F)F)n1)NNC(=O)[C@H]1COc2ccccc2O1	1116849740	GNHJZBILQXCOBT-CQSZACIVSA-N	426.351	1.693	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)OCC(=O)N[C@@H]2CCS(=O)(=O)C2)c(C)n1C[C@H]1CCCO1	1317696650	KWQOZOIWCLPFLH-FQCNOMQSSA-N	449.529	1.037	50	20	IDGD	
N#Cc1ccc(N2C[C@H](C(=O)OCC(=O)NNC(=O)c3cccc(Cl)c3)CC2=O)cc1	1318156796	LHZGKPLMMNNESF-OAHLLOKOSA-N	440.843	1.569	50	20	IDGD	
Cc1ccc(CN2CC[C@H](NC(=O)NNC(=O)c3cncn3-c3ccccc3)C2=O)cc1	1320701932	NBDMOTQQSJOTDY-IBGZPJMESA-N	432.484	1.926	50	20	IDGD	
Cn1c(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc(Br)c1C=O	1323407512	PHZJVIUIIQAPPO-UHFFFAOYSA-N	435.282	1.068	50	20	IDGD	
COc1nc(Cl)c(C=NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)n1C	1324254121	RKFVFBFNTSBOJS-UHFFFAOYSA-N	425.898	1.631	50	20	IDGD	
CN(C)N(C(=O)CC[C@H]1NC(=O)N(c2ccc(Cl)cc2)C1=O)[C@H]1CCS(=O)(=O)C1	1343773146	CIOGIUWTRCSTKO-LSDHHAIUSA-N	442.925	1.037	50	20	IDGD	
CCOC(=O)c1cc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](F)Cl)C2)ccn1	1778025523	RMAKHYFIBWNPQN-JXXFODFXSA-N	441.887	1.920	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cccc4c3cnn4C)C2)C1	1778031223	AZRMMICAQGSDKH-BFUOFWGJSA-N	435.322	1.800	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2)c1cccc2cccnc12	1778461487	VHZPPXVDZUAKMN-NJNPRVFISA-N	431.920	1.962	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@]2(C1)CN(C(=O)c1ccc3c(n1)OCCO3)CCO2	1779296019	ZMVJHKSZPMUROU-FQEVSTJZSA-N	435.553	1.148	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnn(C)c2Cl)C1	1779929844	CLKCBAOWHXQZRL-XTQGRXLLSA-N	447.761	1.984	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3nccc(OC)c3OC)C2)C1	1780444859	GQGWEPWUXOZEMF-VLIAUNLRSA-N	425.913	1.950	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)c3cnn4c3OCCC4)CCO2)C1	1781233779	DPLAOTTYJFWTQS-ZWKOTPCHSA-N	431.320	1.345	50	20	IDGD	
Cn1ncc2cc(C(=O)N3CCO[C@@]4(CCN(C(=O)[C@@H](F)Br)C4)C3)ccc21	1781330166	RXALJFRNVATPRH-CRAIPNDOSA-N	439.285	1.707	50	20	IDGD	
O=C(c1c[nH]c2cnccc12)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781331940	SIBQDIBYDTZXOR-WMLDXEAASA-N	425.258	1.697	50	20	IDGD	
COc1nc(C)ccc1C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781332163	UYDZSJZYBDBENO-CXAGYDPISA-N	430.274	1.533	50	20	IDGD	
CC[C@@H](NC(C)=O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)Br)C1	1781995534	OXVDVANMEYBMCX-SCFUHWHPSA-N	432.359	1.198	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)Nc1ccccn1)C2	1782176218	YHFJBGZGURQWHW-BIZBXSGISA-N	438.956	1.650	50	20	IDGD	
C=CC[C@H](C(=C)C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCC(=O)NN(C)C)C1	1782214128	FGXADVYBTNBWNT-DNVFCKCGSA-N	434.581	1.642	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnc4ccc(F)cn34)C2)C1	1782464808	IEXVZJWJLZSMML-XIKOKIGWSA-N	439.285	1.700	50	20	IDGD	
C=C(CC(=O)OCC)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](Br)CC)C2)C1	1783353270	NZCADPALZQGFPJ-KDOFPFPSSA-N	431.327	1.499	50	20	IDGD	
COc1ccnc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]3C2)c1	1783970204	OATJCKPKKORCBW-RMRKRWHISA-N	440.338	1.715	50	20	IDGD	
CCN(CC)C[C@@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]2C1	1783974640	UIIAHPMWGCHVJF-ADHGMGHFSA-N	446.430	1.975	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)CCc3cnccn3)C2)C1	1784560822	GRJUUMCSONTKNU-YJBOKZPZSA-N	425.327	1.413	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)[C@H]3SC(=N)NC3=O)C[C@@H]21	1784618732	QZQOZLUVTIKWPW-WCBJTDJXSA-N	444.985	1.176	50	20	IDGD	
Cc1ccc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Br)C[C@@H]32)cn1	1785399670	IDMZWGURYFTBBI-QBYUYEEZSA-N	428.302	1.603	50	20	IDGD	
C[C@H](NC(=O)c1ccccc1)C(=O)N1CC[C@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1785557465	LLWQYMSTBBTUBE-JTSKRJEESA-N	447.608	1.486	50	20	IDGD	
COc1nn(C)cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]21	1785863987	FUYNZBOIXYKSMM-MMNXLFCMSA-N	433.336	1.258	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC1(c2ccc(NC(=O)[C@H](O)CCl)cc2)CCC1	1786134446	ILNBZFKHKBZALH-MRXNPFEDSA-N	431.880	1.033	50	20	IDGD	
CCn1nc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](O)CCl)C[C@@H]32)c2ccccc21	1787213134	VEXFNAZHGVEOJD-IKICRFKJSA-N	434.924	1.249	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3n[nH]c4c3CCc3ncccc3-4)C[C@@H]21)[C@@H](F)Cl	1787447960	NZMWPLWACZSICA-WNZPGNDNSA-N	447.898	1.698	50	20	IDGD	
CCOC(=O)/C=C/C(=O)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1	1788145942	JFNBZNSSSYQBJZ-VAWYXSNFSA-N	436.273	1.233	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3cnc4[nH]ccc4c3)C[C@@H]21	1791257342	AXERGQDVKONUIV-OKYOBFRVSA-N	448.951	1.729	50	20	IDGD	
CCOc1ccsc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc(B(O)O)c1)C2	1792429751	NOKBDRWJTXIXLT-BJWYYQGGSA-N	428.319	1.392	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3cccnc3[nH]1)C2	1792870846	LUPTUZLVTQMAFI-OEYIWLLWSA-N	435.322	1.797	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(-c3ccccc3)n1)C2)[C@H](O)CCl	1792978415	UGCFNAJUUZWSRL-WOUAJJJCSA-N	429.904	1.552	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC=C(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](O)CCl)C3)C1	1794133622	LCYAYKMPSPMECX-YVSFHVDLSA-N	441.956	1.792	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)c1cc(O)nc2ccccc12	1796190944	GWPAMGSIYSFEDL-BCDXTJNWSA-N	445.284	1.186	50	20	IDGD	
O=C(/C=C/c1ccccc1[N+](=O)[O-])N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1	1796192331	ASJFMJYOHTVXEI-FCJRBGQTSA-N	449.272	1.240	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2ncncc2c1	1797469115	XLMUUYCQLGNMHL-RMIITELYSA-N	433.306	1.616	50	20	IDGD	
COC(=O)C12CC(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@](C)(Cl)CCl)(C1)C2	1799279309	HOCBYGWWHBEXDI-APCPSTPWSA-N	433.332	1.156	50	20	IDGD	
Cc1cc(C)n(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Br)n1	1799352298	OQTZHCHLPRIKKE-XRGAULLZSA-N	431.306	1.170	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(OC(F)F)cc1	1799588975	HYBNZMHFLZWEPQ-XRGAULLZSA-N	432.851	1.745	50	20	IDGD	
COCCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN(C)NC(=O)NCc1ccccc1	1799864992	WRMAXJCIJIOWND-REPLKXPHSA-N	431.537	1.007	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Nc1ccccn1)C2	1800642015	RAKJKGRGCXHMCP-LFYQSXPISA-N	439.354	1.645	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccn(C(F)F)c1=O)C2	1800759540	ULJIVZVWBMVIQX-KQXIARHKSA-N	448.264	1.230	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Br)C3)c1	1801788325	IHZJLTWYZGHZHM-XRGAULLZSA-N	442.285	1.539	50	20	IDGD	
C[C@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](C)NC(=O)c1ccccn1)C2	1801966891	UEHQDOZKSYVYHP-LXFSFDBISA-N	437.338	1.622	50	20	IDGD	
C[C@@H]1[C@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Cl)C3)CCN1C(=O)OC(C)(C)C	1802259186	YHVAVXCJFVDUNU-AQGHMYMLSA-N	447.935	1.756	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@H]1CCN(C(=O)[C@@H]2CCC(=O)N2)[C@H]1c1cccnc1	1803010029	ZKDIHNKFAMIWTN-UTXMOHQDSA-N	437.338	1.397	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1c(F)ccc(Cl)c1F)c1cccc(B(O)O)c1	1803798572	WKTGIWJCEHENGM-QDMKHBRRSA-N	448.662	1.864	50	20	IDGD	
COc1nn(C)cc1C(=O)NC[C@@H]1CCN(C(=O)CO[Si](C)(C)C)[C@@H]1c1cccnc1	1805303130	JIGOHDMRZMGQBK-QFBILLFUSA-N	445.596	1.995	50	20	IDGD	
N=C(N)SCC(=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@@H]1c1cccnc1	1807005814	HWUHYFOMIZGVCB-CYZMBNFOSA-N	432.319	1.405	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC2(CCCN(C(=O)c3cncn3C)C2)CC1	1808534497	VMPJMWURSUKZKR-PCLIKHOPSA-N	439.520	1.399	50	20	IDGD	
CN1CCc2cc(C(=O)NC[C@@H]3CCN(C(=O)[C@@H](O)CCl)[C@@H]3c3cccnc3)ccc21	1809317874	ZJENGHJOFUPCLV-SESVDKBCSA-N	442.947	1.993	50	20	IDGD	
O=C(c1ccc2c[nH]nc2c1)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1	1809966727	KXBCJPRGCTZVKA-UHFFFAOYSA-N	446.316	1.401	50	20	IDGD	
O=C(COC(=O)C(F)(F)F)NC[C@@H]1CCN(C(=O)[C@H](F)Cl)[C@@H]1c1cccnc1	1810183304	PQSZTAVKXVFBKN-UHTWSYAYSA-N	425.766	1.727	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)c2ccccc2)[C@@H]1c1cccnc1	1811670321	OQAVNQCIMGSQOB-NQIIRXRSSA-N	444.495	1.714	50	20	IDGD	
C=CCO[C@H](C)C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1813069065	UESUUICGLHVCGP-BLIXFSHQSA-N	431.537	1.052	50	20	IDGD	
C[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](O)CCl)n[nH]1	1814878068	SUQPDZOUJFDKIU-XBFCOCLRSA-N	443.932	1.915	50	20	IDGD	
Cc1noc(C)c1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1	1816404761	YNHAJUBDBZXPLA-HNNXBMFYSA-N	431.497	1.693	50	20	IDGD	
O=C(Cc1cccs1)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1817576253	JMXDXJQJFLCNDW-SFHVURJKSA-N	438.318	1.700	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CN2CCN(C)CC2)n[nH]1	1818915219	PDBHYFFQALPHJV-ZFWWWQNUSA-N	441.374	1.433	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cnccc3C(=O)NN)n[nH]2)no1	1819402044	KEPZKPGZOPDKTB-MRXNPFEDSA-N	438.448	1.324	50	20	IDGD	
COc1ccc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@@H](O)CCl)CC3)cc1OC	1822102608	WDIBSTNIIIYWTB-AAEUAGOBSA-N	439.921	1.986	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CNC(=O)c2cccnc2)[nH]n1	1822366985	GFENZSGXPDBQDT-ZBFHGGJFSA-N	448.911	1.481	50	20	IDGD	
O=C(Cn1ccncc1=O)N[C@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1	1823009648	RWPSGGZWJDYXQN-SDBXPKJASA-N	444.286	1.003	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)Cc1ccc3ncnn3c1)CC2	1826005942	BQLXTLIIQRMFBD-OLZOCXBDSA-N	448.936	1.594	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)/C=C/c1ccco1)CC2	1826080543	PZDBWUGMVZCDQA-STMXVASLSA-N	431.518	1.735	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc([N+](=O)[O-])o3)CCO2)C1	1829481110	HZBULAHOGMJBFQ-UGSOOPFHSA-N	429.857	1.665	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cccnc1Cl)CCO2	1829498647	YHOJMMHWZLTNTI-LJQANCHMSA-N	441.988	1.657	50	20	IDGD	
O=C(c1cc(-c2ccccc2)on1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1	1829589624	VFECQIQVPDQXFB-UWJYYQICSA-N	449.891	1.011	50	20	IDGD	
Cc1csc(CCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)c1	1830726834	UEVDOCQKHKVBCQ-VQIMIIECSA-N	430.954	1.045	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1C[C@@H]1F)CCO2	1832128350	BPIFVCGKEKTVAO-QUZUAECRSA-N	449.429	1.686	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC([C@H]2CCCCN2C(=O)CCS(C)(=O)=O)CC1	1832399042	HBRXPZJSQFCLEJ-UKRRQHHQSA-N	437.400	1.824	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3coc(Cl)n3)CC2)CC1	1833987100	OIQGRVAYWMHIJZ-CQSZACIVSA-N	433.336	1.767	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)C1CCCCC1	1834375245	LQVNZMOUEYQCSV-UHFFFAOYSA-N	441.381	1.132	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnoc3C3CC3)CCO2)C1	1834617419	PXTFJLIXPYPITF-RTBURBONSA-N	446.331	1.858	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)C3CC(F)(F)C3)C2)C1	1834820207	PQQTXMFYJZVNMJ-OAHLLOKOSA-N	425.270	1.273	50	20	IDGD	
COCCn1nccc1C(=O)NC1CCN(C2CCN(C(=O)[C@H](F)Cl)CC2)CC1	1835179809	VYMRTTLDTZIPBE-KRWDZBQOSA-N	429.924	1.249	50	20	IDGD	
CCc1noc(C)c1C(=O)NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1835958796	KTOADBZTTPCXJV-QGZVFWFLSA-N	426.945	1.330	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](F)Cl)CC2)CC1)c1cnc2snnc2c1	1836100768	HGHWAIYYTLDGGL-HNNXBMFYSA-N	440.932	1.806	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC1CCN(C2CCN(C(=O)Cn3cncn3)CC2)CC1	1836398643	PNFKYODDJKSJEF-SFHVURJKSA-N	431.368	1.086	50	20	IDGD	
Cn1ccc(CC(=O)N2CCC(N3CCC(NC(=O)[C@](C)(Cl)CCl)CC3)CC2)n1	1836398660	QMJTXKYDLYEJBF-HXUWFJFHSA-N	444.407	1.771	50	20	IDGD	
CC(C)(C)n1cc(C(=O)N2CCC(OC3CCN(C(=O)[C@H](O)CCl)CC3)CC2)cn1	1836715141	KFRJWQMFTQLCKH-GOSISDBHSA-N	440.972	1.850	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)CC34CCCN3CCC4)CCO2)C1	1839117107	ZJTWWJZSBXJWIS-QFIPXVFZSA-N	442.000	1.726	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3cccc(OC)n3)C2)C1	1839142421	NVIZJYBDTUGPIW-UWJYYQICSA-N	439.940	1.497	50	20	IDGD	
CCc1nn(C)c(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](Cl)CC)CCO3)c1Cl	1839143167	NLKODSHHUBOTHH-DJJJIMSYSA-N	447.363	1.723	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(-n4cnnc4)cc3)C2)C1	1839144282	UIIAILVGZNKOPC-GHTZIAJQSA-N	447.923	1.355	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3n[nH]c4ccc(F)cc34)C2)C1	1839145955	RWIDMAOMIFOTFD-MGPUTAFESA-N	438.887	1.789	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnn4cccc(C)c34)C2)C1	1839148512	ZOUBMLLOAURIOA-DYESRHJHSA-N	434.924	1.730	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3csc(N)n3)C2)C1	1839152203	RAYUNWVRLHPPST-JKSUJKDBSA-N	437.349	1.032	50	20	IDGD	
C[C@]1(C(=O)N2CCOC[C@]3(CN(C(=O)[C@H](F)Br)CCO3)C2)CC=CCC1	1839203890	ZQLSHTUKWHVGGC-WBAXXEDZSA-N	433.318	1.880	50	20	IDGD	
CC(=O)C[C@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)CBr)C2)C1	1840126734	KFAFVZDAFUSTTG-SUNYJGFJSA-N	433.343	1.089	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)Oc3ccccc3)C2)C1	1840154771	FVFMTFWVLURMQY-BLIXFSHQSA-N	440.924	1.164	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(OC)c3C)C2)C1	1840155958	GNFVMJIUMRLCOM-UTKZUKDTSA-N	440.924	1.327	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(C)cc3OC)C2)C1	1840156645	ROUYMEKEMWVUFD-UTKZUKDTSA-N	440.924	1.327	50	20	IDGD	
C[C@@H](C(=O)N1CCCC12CN(C(=O)c1cnccc1C(=O)NN)C2)c1ccc(Cl)cc1	1841198278	TXXOXGJRYJQLRU-CQSZACIVSA-N	441.919	1.959	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)CCCc1ccncc1)C2	1843415576	PFVJCQMUSYOILT-YZSQISJMSA-N	436.516	1.742	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)Cc1cnn(C)c1)C2	1844693394	ZRXDKIGDAVOAGG-UHFFFAOYSA-N	441.444	1.313	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCCC12CN(C(=O)Cn1cccc([N+](=O)[O-])c1=O)C2	1845172327	CAVDSSSKTMJAPM-INIZCTEOSA-N	431.276	1.196	50	20	IDGD	
O=C([C@H](Br)Cc1ccccc1)N1CC2(CCCN2C(=O)Cn2nccn2)C1	1845266366	CKQSOPZYHOVILM-MRXNPFEDSA-N	432.322	1.488	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@]13C[C@H]1CCN3C(=O)OC(C)(C)C)C2	1846364811	KQACJYZDYRZPED-WIEQDCTASA-N	441.956	1.843	50	20	IDGD	
Cc1ccc(C(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)c(Cl)c1	1846812140	JUUNBMXTBCDCJC-UHFFFAOYSA-N	427.892	1.778	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(O)(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](F)Cl)CC1	1847977967	JEECFQNNWNBNDU-MELADBBJSA-N	433.908	1.485	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cnc(N)s1	1848099621	PWQMPGCGJLSLRC-SRVKXCTJSA-N	443.957	1.673	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)[C@@H]2Oc3ccccc3O[C@H]2C)cc1OC	10948485	DAKNFVOOLLVJGW-HXPMCKFVSA-N	430.413	1.237	50	20	IDGD	
CC(C)n1ncc2cc(C(=O)NNC(=O)CCN3CCN(c4ccccc4)CC3)cnc21	11775328	KFQDQOLXHKSPDF-UHFFFAOYSA-N	435.532	1.986	50	20	IDGD	
CCn1c(=O)c2ccccc2n(CC(=O)NNC(=O)c2cc(-c3ccccc3)n[nH]2)c1=O	17519486	ARRJNWAAMTUPET-UHFFFAOYSA-N	432.440	1.034	50	20	IDGD	
COC[C@@H](C)n1c(C)cc(/C=C(\C#N)C(=O)NNC(=O)c2n[nH]c(=O)c3ccccc23)c1C	25351707	YJOXONYSKKSKPM-NGWPFTMJSA-N	448.483	1.917	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)c1ccc(CNC(=O)C2CCCC2)cc1	727799830	ULVPVZHSWHMSJJ-UHFFFAOYSA-N	433.472	1.544	50	20	IDGD	
Cn1c(=O)nc(O)c2cc(C(=O)NNC(=O)c3cc(F)ccc3Br)cnc21	728550671	AONVXGIUOBSHPS-UHFFFAOYSA-N	436.197	1.011	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(C(=O)NNC(=O)Cc2cccnc2)ccc1Br	728851943	GUFSFFQOLNZWKC-UHFFFAOYSA-N	441.307	1.098	50	20	IDGD	
Cc1nc2nc(N)nn2c(C)c1CC(=O)NNc1ccc(S(=O)(=O)C(F)F)cc1	728974270	KMRSXZAGBAINKU-UHFFFAOYSA-N	425.421	1.005	50	20	IDGD	
Cn1c(CCC(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)nc2ccccc2c1=O	729988940	YADVEJBMNXWCNY-UHFFFAOYSA-N	442.859	1.524	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCN(c2ccc3c(c2)OCCO3)C1=O)c1cc(-c2ccccc2)[nH]n1	730584893	GXAZCGDUYVLSAP-INIZCTEOSA-N	447.451	1.662	50	20	IDGD	
CCOC(=O)c1cnn(-c2ccc(C(=O)NNC(=O)COc3ccccc3O)cc2)c1C	730781154	FWXDIUAQHOXQNL-UHFFFAOYSA-N	438.440	1.903	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)Cc2ccccc2F)sc1Br	731366215	JNXWSMWKVMZOCO-UHFFFAOYSA-N	436.284	1.301	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)c3cn(-c4cccc([N+](=O)[O-])c4)nn3)n[nH]2)cc1	731453312	CEUHBWMSEXTBLZ-UHFFFAOYSA-N	432.400	1.949	50	20	IDGD	
O=C(O)COc1ccc(C=NNC(=O)C2CCN(c3ncccn3)CC2)cc1[N+](=O)[O-]	731558300	QKRALURCQKHKKP-UHFFFAOYSA-N	428.405	1.215	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2cccc3c2OCCO3)cc1Br	732048193	DHSJBIQOHLHGIV-UHFFFAOYSA-N	443.275	1.852	50	20	IDGD	
COc1ccc(C)cc1N1C[C@@H](C(=O)NNC(=O)CCN2C[C@H](C)O[C@H](C)C2)CC1=O	732261319	MCZIZFJZKNGQDG-BBWFWOEESA-N	432.521	1.003	50	20	IDGD	
C[C@H](CC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1)C(=O)c1ccccc1	732829577	AWQBCIKSFFIBJI-QGZVFWFLSA-N	444.557	1.975	50	20	IDGD	
CN1CCC(N2CC[C@@H](NC(=O)NNC(=O)c3cc(F)ccc3Br)C2)CC1	734284448	VJGPGOQYKQGRSP-CYBMUJFWSA-N	442.333	1.701	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)c2ccnc(-n3cncn3)c2)CC1	734821456	KKCYVCBUYUFYIJ-UHFFFAOYSA-N	430.469	1.006	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)c1ccccc1F)C(=O)NNc1cc(C)nc(C)n1	736717272	YWDKNWHIKLGDSH-CQSZACIVSA-N	427.527	1.776	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)[C@@H]2CC(=O)N(Cc3ccccc3)C2)cc1C	736729939	NAJYFNFOQZFRKY-MRXNPFEDSA-N	443.525	1.972	50	20	IDGD	
COc1ccc(N2C[C@H](C(=O)NNC(=O)COCc3ccccc3)CC2=O)c(OC)c1	737637330	WHLQEFRQEZSHRU-MRXNPFEDSA-N	427.457	1.421	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccnc(N3CCCC3)n2)c1	739675577	FUEYQSDHEHOTQZ-UHFFFAOYSA-N	446.533	1.182	50	20	IDGD	
CCOc1ccc(C(=O)NNS(=O)(=O)c2ccc(N3CCOC3=O)cc2)cc1OC	740809936	LRUUONZQPVYHMB-UHFFFAOYSA-N	435.458	1.674	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNS(=O)(=O)c2ccc3ncccc3c2)cc1	741648316	ZAVHGGAWCOGAQY-UHFFFAOYSA-N	448.526	1.173	50	20	IDGD	
CCn1c(=O)c(=O)[nH]c2cc(C(=O)NNC(=O)c3cccc(Br)c3)ccc21	742771439	USXFBWKMBPZOKV-UHFFFAOYSA-N	431.246	1.547	50	20	IDGD	
COc1ccccc1-n1cc(S(=O)(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)cn1	743251472	RLKKWWNRFPSJHB-UHFFFAOYSA-N	443.485	1.446	50	20	IDGD	
CC(C)[C@@H](NS(=O)(=O)c1ccc2ccccc2c1)C(=O)NNc1ncnc2[nH]cnc12	743473013	IRMQXIHTHNHREM-MRXNPFEDSA-N	439.501	1.952	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)Cc2ccc(S(N)(=O)=O)s2)cc1Cl	743834171	UCHKNLMCARZXCQ-UHFFFAOYSA-N	448.910	1.462	50	20	IDGD	
Cn1cc(-c2cncc(C(=O)NNc3ccccc3S(=O)(=O)N3CCOCC3)c2)cn1	744621380	QYJQZYHOISIRQF-UHFFFAOYSA-N	442.501	1.260	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)N[C@@H]2C[C@H](C)N(c3cnn(C)c3)C2=O)c1	745917984	MNINQRGASDAPKC-MAUKXSAKSA-N	442.520	1.755	50	20	IDGD	
Cc1cccc(NS(=O)(=O)c2ccc(C)c(C(=O)NNC(=O)N3CCOCC3)c2)c1	745992933	OAKOKEKGFBBLQC-UHFFFAOYSA-N	432.502	1.791	50	20	IDGD	
O=C(CN[C@@H](c1ccccc1)C(F)(F)F)NNC(=O)C1CCN(c2ncccn2)CC1	746218408	HKMQZLOAZDHXSB-KRWDZBQOSA-N	436.438	1.734	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)c2cnn(CC(=O)NC3CCCCC3)c2)c1	746580185	PRYRYPYUDWXFCE-UHFFFAOYSA-N	427.505	1.789	50	20	IDGD	
COC(=O)[C@H](O)C1CCN(C(=O)/C(C#N)=C/c2cc(C)n(C[C@@H]3CCCO3)c2C)CC1	747517386	JZGCXHUYQBNVCU-LDZGDMBKSA-N	429.517	1.963	50	20	IDGD	
COc1ccc(Br)c(S(=O)(=O)NNC(=O)c2cccc(OC)c2O)c1	747609781	UJIXKGFDWPMWCB-UHFFFAOYSA-N	431.264	1.795	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2cc(C(=O)NNC(=O)c3ccc[nH]3)ccc2Cl)C[C@H](C)O1	747663599	NDOXIRDHTNRRSU-RYUDHWBXSA-N	440.909	1.541	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)NCCC(=O)N2CCN(c3ccccn3)CC2)c2ccccc21	748465198	LPJWRWHBXLZKSA-UHFFFAOYSA-N	449.515	1.256	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)C2=C(C)C(C)(C)OC2=O)c2ccccc2c1=O	748547803	YYVFKMUSTITBIC-UHFFFAOYSA-N	426.473	2.000	50	20	IDGD	
O=C(CCc1ccccc1)NNC(=O)Cn1cnc2ccc(Br)cc2c1=O	749800950	PFJUUZJNTJXFOJ-UHFFFAOYSA-N	429.274	1.939	50	20	IDGD	
CCNS(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(-c3ccc(C)cc3)[nH]n2)c1	751375931	SNTDNUFPHVTPTI-UHFFFAOYSA-N	427.486	1.758	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NC[C@@H]2CCC[C@]23NC(=O)N(C)C3=O)ccc1OC(C)C	752023259	KIVCHLGIFPDWLG-QKKBWIMNSA-N	447.492	1.147	50	20	IDGD	
N#Cc1ccc(CN2CC[C@@H](NC(=O)NNC(=O)c3ccc4ccccc4n3)C2=O)cc1	753290420	QMVKCCBWDDMQGM-HXUWFJFHSA-N	428.452	1.852	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)CN2C(=O)N[C@@]3(CCc4ccccc43)C2=O)c2ccccc2n1	754778624	YYHVUIBNBNHTMG-XMMPIXPASA-N	443.463	1.698	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1cc(Br)cc(C(F)(F)F)c1	755424718	GSNBIOSPIZBJDC-SSDOTTSWSA-N	429.214	1.664	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(N(C)C)c(NC(=O)NNC(=O)CC(F)(F)F)c1	755433291	CSWMZPBIEQUGLH-UHFFFAOYSA-N	439.460	1.888	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)Nc1ccc(C(=O)N2CCOCC2)cc1	755933311	JYEYWCJRDCWXNW-UHFFFAOYSA-N	426.473	1.953	50	20	IDGD	
CCCCNC(=O)[C@@H]1CC[C@H](C)N(CC(=O)NNC(=O)c2ccc(OC)c(OC)c2)C1	756499709	CFZQLGKRROFJQV-DOTOQJQBSA-N	434.537	1.482	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)Nc1ccc(Oc2ccc(Cl)nn2)cc1	756561206	CKGCEKNQNMSCIE-JTQLQIEISA-N	425.854	1.510	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)Cc2cccnc2)ccc1S(=O)(=O)N1CCCC1	756584802	GRLFEVNQADCWQK-UHFFFAOYSA-N	433.490	1.270	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)Nc2ccc(S(=O)(=O)NCC3CC3)cc2)c1	756784584	OONBPFQUZUHXTC-UHFFFAOYSA-N	446.489	1.195	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccn(-c3ccc(Cl)cc3)n2)c1	756862333	ALOOMGODCHIQNX-UHFFFAOYSA-N	447.904	1.851	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)[C@@](C)(O)CN2Cc3ccccc3C2=O)n[nH]1	756882649	YPDCJCLALIUYPU-QHCPKHFHSA-N	449.467	1.253	50	20	IDGD	
COC(=O)c1ccc(-n2cc(C)cn2)c(NC(=O)NNC(=O)Cn2nc(C)cc2C)c1	757770481	MSLHGUKUCCBSCF-UHFFFAOYSA-N	425.449	1.634	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NC[C@@H](C[C@H](C)O)c2ccccc2)c2ccccc2c1=O	759612508	SLHMPLFVNFYZMO-DOTOQJQBSA-N	437.500	1.915	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)NC[C@@H]1CC(=O)N(Cc2ccccc2)C1	759682418	GUJHAXJPQNGBDV-INIZCTEOSA-N	441.444	1.353	50	20	IDGD	
O=C(N=c1cc[nH]cc1F)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	760000832	AHQLPSKRKMOCMW-UHFFFAOYSA-N	435.462	1.971	50	20	IDGD	
CN(C)CC1(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)CCCC1	760163090	HHMHKCDLTLFFQO-UHFFFAOYSA-N	425.555	1.003	50	20	IDGD	
C[C@H](C[C@H]1CCOC1)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	760194068	MYGOQUIUYNWUIS-HZPDHXFCSA-N	438.550	1.620	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc([N+](=O)[O-])c(C(=O)O)c1)c1cccc(Br)c1	760363409	WITZCIMMCXQDMA-UHFFFAOYSA-N	444.219	1.679	50	20	IDGD	
C[C@@H](CC(=O)NNC(=O)C(C)(C)c1ccccc1)NS(=O)(=O)c1cccnc1Cl	760556305	QSHUKNDOYBZBGO-ZDUSSCGKSA-N	438.937	1.917	50	20	IDGD	
O=C(CCc1ccc(O)cc1)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	760917592	DOXNFFWDZXTLJR-UHFFFAOYSA-N	430.936	1.943	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)C2CC2)cc1)[C@H]1C[C@H]2CC[C@H]1C2	763558364	NPIGHHJWRJMKDS-VAGZCVSGSA-N	448.545	1.286	50	20	IDGD	
Cc1ccc(NC(=O)C(C)C)cc1NC(=O)C(=O)NNC(=O)[C@@H]1COc2ccccc2O1	763569481	ACLMTEAYNVYITK-SFHVURJKSA-N	440.456	1.515	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)Nc1ccnc(Oc2ccccc2)c1	763569704	ATYVUVGFVFIOAV-SFHVURJKSA-N	434.408	1.800	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)Nc1ccc(OC(F)(F)F)cc1	763572615	SRFHZCYRWKUQQA-AWEZNQCLSA-N	425.319	1.511	50	20	IDGD	
CCC(=O)Nc1ccc(Cl)c(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1	763572735	OIRBGNXJFMNURN-MRXNPFEDSA-N	446.847	1.614	50	20	IDGD	
COC(=O)c1cc(F)c(F)cc1NC(=O)C(=O)NNC(=O)c1c(C)nc2ccccn12	763629740	RTCLHANILSJEMG-UHFFFAOYSA-N	431.355	1.107	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)ccc1F	763732619	CXOIKEYWEYOJTR-UHFFFAOYSA-N	428.420	1.151	50	20	IDGD	
COC(=O)Nc1cc(NC(=O)C(=O)NNC(=O)c2cc(OC)cc(OC)c2)ccc1F	763772435	MIEFIHQDZXFOGY-UHFFFAOYSA-N	434.380	1.421	50	20	IDGD	
CCC(C)(C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)cc1	763843628	SKFUUOFLFLELDI-UHFFFAOYSA-N	444.463	1.909	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)NNC(=O)C(=O)Nc1ccc(C(=O)N2CCCC2)cc1	763860255	CIDHCXBKESWTBG-UHFFFAOYSA-N	433.468	1.733	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cc(CC(C)C)nn2C)cc1	763875787	AUOMOKVERUUHBH-AWEZNQCLSA-N	429.477	1.375	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(Cl)c(C(=O)OC)c2)cc1OC	763902883	RNFIKFJBZAUDJS-UHFFFAOYSA-N	449.847	1.934	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccccc2O[C@@H]2CCOC2)cc1OC	763903523	RXZAPPHCFSAXTN-OAHLLOKOSA-N	443.456	1.661	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccc(OCC(F)(F)C(F)F)nc1	763932873	UKINURXPIQAXSF-UHFFFAOYSA-N	446.332	1.829	50	20	IDGD	
CCOC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)cc1	763995975	SMXBZRCTIBGAAJ-UHFFFAOYSA-N	438.238	1.745	50	20	IDGD	
C[C@@H]1C[C@@H](C)CC2(C1)NC(=O)N(CC(=O)NNC(=O)CSc1ccccc1O)C2=O	764045261	HJXNTEYSTKNAOA-CHWSQXEVSA-N	434.518	1.378	50	20	IDGD	
COC(=O)c1ccc(OC(C)C)c(NC(=O)C(=O)NNC(=O)c2ccc(Cl)nc2)c1	764092534	KUJDHSVWBAJUCE-UHFFFAOYSA-N	434.836	1.709	50	20	IDGD	
O=C(CC(F)(F)F)NNC(=O)C(=O)Nc1cccc(NC(=O)CN2CCCCCC2)c1	764112888	QODFKWQMSDZUKG-UHFFFAOYSA-N	443.426	1.539	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(OC)c(OC)cc2C)o1	764139405	SSBAROCJJLWKCK-UHFFFAOYSA-N	432.477	1.847	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccc(OCCN(C)C)c(Cl)c1	764139582	VYZFTTUFMVQEOV-UHFFFAOYSA-N	448.907	1.618	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)CN(C)C)n(-c2cc(C(F)(F)F)ccc2Cl)n1	764213351	WCUYGKCYLKHXBV-UHFFFAOYSA-N	446.817	1.500	50	20	IDGD	
CN1CCN(Cc2cccc(NC(=O)C(=O)NNC(=O)Cn3ccc4ccccc43)c2)CC1	764239232	HXZDEHQMNIUIFR-UHFFFAOYSA-N	448.527	1.175	50	20	IDGD	
CCOC(=O)c1cc(Br)ccc1NC(=O)C(=O)NNC(=O)Cc1cccnc1	764268327	HLMXGFICLJJTCI-UHFFFAOYSA-N	449.261	1.349	50	20	IDGD	
Cc1cccc(NC(=O)C(=O)NNC(=O)CCc2ccccc2O)c1C(=O)N1CCCC1	764277349	CGNDIVWBCHLHLR-UHFFFAOYSA-N	438.484	1.655	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)c2c[nH]nc2C)sc2c1CCCS2	764296884	HXWWFGUNCZDESP-UHFFFAOYSA-N	437.503	1.394	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)nn1-c1ccccc1	764380305	UVRLXDNEQMNHIQ-UHFFFAOYSA-N	429.383	1.938	50	20	IDGD	
CN(C)CCC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2F)cc1	764412554	HFJIJNYFVUXVQL-UHFFFAOYSA-N	449.870	1.769	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)N[C@H]1CCN(c2ccc(Cl)c(F)c2)C1=O	764516998	ZYIJDVUPCVNWSX-AWEZNQCLSA-N	436.827	1.699	50	20	IDGD	
Cc1ccccc1-n1nc(C)c2cc(C(=O)NNC(=O)N[C@H]3CCS(=O)(=O)C3)sc21	765070603	LSKGNSURRXEXDL-ZDUSSCGKSA-N	447.542	1.835	50	20	IDGD	
N#Cc1cccc(OCC(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)c1	765754061	HZQHZDHGEOAMJD-UHFFFAOYSA-N	441.919	1.556	50	20	IDGD	
Cc1nc(CC(C)C)c(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)s1	766641749	JIPFNDUOELBMBQ-UHFFFAOYSA-N	443.573	1.869	50	20	IDGD	
CC(=O)N1CCc2c(NC(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)cccc21	769247558	BYDGZFZJUQPJQP-UHFFFAOYSA-N	445.501	1.312	50	20	IDGD	
CCc1c(C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cnn1-c1ccccc1OC	769444100	LWLZAAYSXWWACV-UHFFFAOYSA-N	442.497	1.922	50	20	IDGD	
O=C(CCC(=O)N1CCN(S(=O)(=O)CBr)CC1)c1ccc(Cl)cn1	769620105	SMTNJUCEYVZQOO-UHFFFAOYSA-N	438.731	1.524	50	20	IDGD	
CSCCNC(=S)NNC(=O)C1CCN(S(=O)(=O)/C=C/c2ccccc2)CC1	769767687	SEHMCWMULBASMA-NTEUORMPSA-N	442.632	1.557	50	20	IDGD	
CN(NC(=O)c1cccc(NC(=O)C[C@H]2SC(N3CCCCC3)=NC2=O)c1)C(N)=O	770537137	VZVMZBBPWOPFEX-CQSZACIVSA-N	432.506	1.154	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)NCCC(=O)NNc2ccnc(Br)c2)cc1	771746562	URMZCMATWWFIJF-UHFFFAOYSA-N	441.307	1.858	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)[C@H](NS(=O)(=O)c1ccc2ccccc2c1)C(C)C	771881668	BRKBNCOCFMPUPJ-AUUYWEPGSA-N	449.529	1.632	50	20	IDGD	
Cc1csc([C@](O)(CC(=O)O[C@@H](C)C(=O)NNC(=O)CC(C)C)C(F)(F)F)n1	772064611	OECMCRNSYLZRHQ-ZUZCIYMTSA-N	425.429	1.717	50	20	IDGD	
CC(C)(C)OC(=O)N1CCSC[C@@H]1CC(=O)NNC(=O)c1nnc(O)c2ccccc12	772219325	BFGVPEXBIBTYEH-LBPRGKRZSA-N	447.517	1.839	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNS(=O)(=O)c1cc(C(=O)O)cc(C(=O)O)c1	773252546	VDGNJQABHYMMFX-SECBINFHSA-N	442.833	1.513	50	20	IDGD	
Cc1nc(NC(=O)C(=O)NNc2cccc(S(C)(=O)=O)c2)ccc1Br	773488583	JHRPPRPGNYEFER-UHFFFAOYSA-N	427.280	1.638	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)nn1-c1ccc(Cl)cc1Cl	776707452	ZAMOCKQRUAFUHY-NSHDSACASA-N	446.316	1.619	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2cc(C)n(-c3ccc(F)cc3)n2)n1	777152932	MHLDGHCSRXJCJU-UHFFFAOYSA-N	431.449	1.632	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(N2CCOC2=O)c([N+](=O)[O-])c1)c1ccc(Cl)nc1	777607784	MPLCZKAZTMIHJY-UHFFFAOYSA-N	441.809	1.223	50	20	IDGD	
COC(=O)Nc1ccc(S(=O)(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)cc1	777644945	RNUPIVFXOQQUDS-UHFFFAOYSA-N	430.483	1.479	50	20	IDGD	
C[C@@H](CN1CCN(c2ccccc2)CC1)NC(=O)NNC(=O)CNC(=O)OC(C)(C)C	778676516	PTPNXJPUAQVQPA-INIZCTEOSA-N	434.541	1.052	50	20	IDGD	
COc1cccc(Cn2nccc2NC(=O)NNC(=O)Cn2nc(C)cc2C)c1OC	779462014	MIIUCJAUTMRRLJ-UHFFFAOYSA-N	427.465	1.615	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@@H](O)[C@@H](O)c2nc3ccccc3s2)ccc1OC(C)C	779488691	ICBCZCCFVYODNT-ZWKOTPCHSA-N	445.497	1.948	50	20	IDGD	
CCCn1c(CCC(=O)NNc2cccc(OC)n2)nc2cc(S(N)(=O)=O)ccc21	780770722	QBFZKRHKAXQOSQ-UHFFFAOYSA-N	432.506	1.573	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1c[nH]nc1-c1ccsc1	780842355	XYLRZDASZFPKQK-UHFFFAOYSA-N	433.515	1.916	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1)c1cccn2c(O)nnc12	780922187	USCJTZDUYFXEGA-FQEVSTJZSA-N	442.479	1.823	50	20	IDGD	
O=C(NN=c1cc[nH]cc1)c1cc(S(=O)(=O)N2CCOCC2)ccc1N1CCCCC1	781020181	SBDHZQSXEOGOLG-UHFFFAOYSA-N	445.545	1.272	50	20	IDGD	
CC(C)S(=O)(=O)c1ccc(CC(=O)NNC(=O)CCN2C[C@H](C)O[C@H](C)C2)cc1	781417710	MFNVIBZRDNGMLJ-IYBDPMFKSA-N	425.551	1.058	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C(=O)Nc2ccc(CCN3CCCC3)cc2)nc2ccccc21	782888122	SOHPGSRNVXPQCD-UHFFFAOYSA-N	448.527	1.540	50	20	IDGD	
Cc1cc2cc[nH]c2cc1NC(=O)C(=O)NNC(=O)c1sc(N2CCOCC2)nc1C	782895902	APWZPJYXWMITPA-UHFFFAOYSA-N	442.501	1.478	50	20	IDGD	
O=C(NNc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1ccc2nc3n(c(=O)c2c1)CCC3	783291257	NGYVICPISPEOLU-UHFFFAOYSA-N	442.819	1.986	50	20	IDGD	
CC(=O)N1CCN(Cc2ccccc2NC(=O)C(=O)NNc2ccc(F)cc2F)CC1	783343530	XAHFKWUEOHCORI-UHFFFAOYSA-N	431.443	1.711	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2ccnc(Oc3ccccc3Cl)c2)CCS(=O)(=O)C1	783425881	JLVMJUABKKJOTC-SFHVURJKSA-N	438.893	1.664	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2ccc(-n3ncn(C)c3=O)cc2)ccc1Br	783922770	FAGMPMCQZRJYQJ-UHFFFAOYSA-N	445.277	1.724	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)C(=O)Nc1cc(F)ccc1Oc1ccccc1	784001664	AIYRNXXURWGOGA-UHFFFAOYSA-N	440.387	1.727	50	20	IDGD	
CC(C)COC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)CNC(=O)c2ccco2)c1	784002163	KSWFPMIGAXRWPX-UHFFFAOYSA-N	445.432	1.000	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNc2cc(F)c(F)c(F)c2)c(OC)c(OC)c1	785088594	UMLPUFVDDYVWDF-UHFFFAOYSA-N	427.335	1.990	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccccc3-n3cncn3)n[nH]2)c1	785125679	FLZKLYMMAYWEOE-UHFFFAOYSA-N	444.455	1.674	50	20	IDGD	
CNC(=O)COc1ccc(NC(=O)C(=O)NNc2nc3ccc(OC)cc3cc2C)cc1	785163616	XXHJPLLPICDROM-UHFFFAOYSA-N	437.456	1.758	50	20	IDGD	
CN(C)Cc1ccc(NC(=O)C(=O)NNc2ccnc(N(C)C)n2)cc1Br	786429071	KRFYKOSSKMIMDL-UHFFFAOYSA-N	436.314	1.449	50	20	IDGD	
CCOc1ccc(-c2noc(CCC(=O)NNc3ccccc3S(N)(=O)=O)n2)cc1	788223677	LZOZVWOXMBRLNF-UHFFFAOYSA-N	431.474	1.859	50	20	IDGD	
CCNC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)c1C	789741458	VCFDGODWMWJMPL-ZDUSSCGKSA-N	445.451	1.829	50	20	IDGD	
N#Cc1cccc(-c2cc(C(=O)N3CCN(S(=O)(=O)CBr)CC3)on2)c1	790013616	GWIPBOVTKYPFEP-UHFFFAOYSA-N	439.291	1.653	50	20	IDGD	
O=C(COC(=O)CCC(=O)c1ccc(Cl)cc1)NNC(=O)[C@H]1COc2ccccc2O1	791313655	IBXHHRJVIANYRN-GOSISDBHSA-N	446.843	1.834	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)[C@](C)(O)CN1C(=O)C(C)(C)c2ccccc21	792797503	DLFVEARXGWXWDH-HSZRJFAPSA-N	425.485	1.461	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NN=C[C@@H]2CCCN(C(=O)CNC(=O)OC(C)(C)C)C2)c1	794522887	GSJUAWNERRUDGJ-HNNXBMFYSA-N	446.508	1.519	50	20	IDGD	
COC(=O)c1cc(F)cc(NC(=O)C(=O)NNc2ccc(Br)cn2)c1F	797067743	QNZBXOJGOKPAIM-UHFFFAOYSA-N	429.177	1.991	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)N1CCC(O)(c2scnc2Br)CC1	797524339	NZKYISSKPYTFQB-NSHDSACASA-N	433.372	1.771	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)[C@@](C)(O)C3CC3)c2)cc1	804146378	RGYQMYCMPZXWKG-FQEVSTJZSA-N	433.486	1.418	50	20	IDGD	
CC(C)Cn1ncc(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)c1C1CC1	806976804	MQPGLCCOLFIRRW-UHFFFAOYSA-N	437.298	1.907	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2ccc3c(c2)CCCCC3=O)ccc1Cl	809982583	KNLKOPDQFSTEET-UHFFFAOYSA-N	435.889	1.971	50	20	IDGD	
CC(C)(C)CCS(=O)(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	811674956	CVNVMULUCRNYEF-UHFFFAOYSA-N	431.580	1.862	50	20	IDGD	
COCCOc1ccc(C#N)cc1NC(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	812963153	XUTIDYLSGHULMK-UHFFFAOYSA-N	433.490	1.982	50	20	IDGD	
C[C@@](O)(C(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1)C1CCC1	813363959	AIMGAZZDMRXWTB-NRFANRHFSA-N	431.514	1.477	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)[C@H](O)c1ccc(Cl)cc1F	813488311	SPLPRAYDLFANAO-LJQANCHMSA-N	448.882	1.118	50	20	IDGD	
O=C(NNS(=O)(=O)CCCCN1C(=O)c2ccccc2C1=O)c1c[nH]c2ccccc12	814210683	RQBZVVJVPJJUKZ-UHFFFAOYSA-N	440.481	1.809	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)C2(Cc3ccc(F)cc3)CCOCC2)c2ccccc2c1=O	814214767	IATLVFIGAJPEIU-UHFFFAOYSA-N	438.459	1.873	50	20	IDGD	
CC(=NNC(=O)N=c1cc[nH]cc1)c1ccc(S(=O)(=O)N(C)CCCC(=O)O)cc1	815001451	KQLXRFUJMLBZLM-UHFFFAOYSA-N	433.490	1.535	50	20	IDGD	
COCc1cc(NC(=O)C(=O)NNC(=O)COc2ccc(C)cc2)cc(C(=O)OC)c1	815566326	QIJDIARDWHFDJS-UHFFFAOYSA-N	429.429	1.093	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1)C(=O)Nc1cn(Cc2ccccc2)nn1	815570035	OQAGRDWOXBJCDB-UHFFFAOYSA-N	448.418	1.255	50	20	IDGD	
COCc1cc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)cc(C(=O)OC)c1	815570944	PRVZYRURCTWZAX-UHFFFAOYSA-N	447.469	1.203	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNc2ccc(-n3cccn3)nn2)cc1)[C@@H]1C[C@@H]1C	815589721	BLBFYEVHIQZFNQ-SUMWQHHRSA-N	434.460	1.505	50	20	IDGD	
CC(=O)Nc1cc(NC(C)=O)cc(C(=O)NNc2ccccc2S(=O)(=O)N(C)C)c1	817052532	FOHZCQLNWGBENN-UHFFFAOYSA-N	433.490	1.611	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)COc1cccc(NC(=O)C2CC2)c1	817054261	BDOGMIHRKRWYCV-UHFFFAOYSA-N	432.502	1.808	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)CNS(=O)(=O)c2cccc(F)c2)c1	913419354	KFWGLAMIZGIGGL-UHFFFAOYSA-N	437.493	1.762	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)N[C@H](CN1CCOCC1)c1ccccc1	914598809	STIWJHBBONFPJX-GOSISDBHSA-N	428.489	1.478	50	20	IDGD	
COc1ccnc(NNC(=O)c2ccc(Cl)c(S(=O)(=O)NC[C@H]3CCCO3)c2)n1	914763005	JLJDIXNYRHHWNR-GFCCVEGCSA-N	441.897	1.353	50	20	IDGD	
COC(=O)Cc1cc(=O)n(-c2ccc(C(=O)NNC(=O)Cc3ccc(Cl)cc3)cc2)[nH]1	915189034	VCFYEPAOXHJXGL-UHFFFAOYSA-N	442.859	1.538	50	20	IDGD	
O=C(Cn1nnc(-c2ccccc2)n1)NN=Cc1c(Cl)cccc1N1CCOCC1	915938177	REXNCCCVLAGHOX-UHFFFAOYSA-N	425.880	1.980	50	20	IDGD	
CC(C)(C)OC(=O)NNC(=O)NCc1ccccc1CS(=O)(=O)N1CCOCC1	916228980	KATCGYNOIKIIHF-UHFFFAOYSA-N	428.511	1.088	50	20	IDGD	
O=C(CN1CCN(C(=O)COc2ccc(F)cc2)CC1)NNC(=O)c1cccc(Cl)c1	917108463	AICXRPDIPQYTHP-UHFFFAOYSA-N	448.882	1.463	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)c3ccc(CN4C(=O)CNC4=O)cc3)n[nH]2)cc1	917178027	FLZSWZJZTXMRFZ-UHFFFAOYSA-N	432.440	1.512	50	20	IDGD	
O=C(CN1CCC[C@H](C(=O)Nc2ccccn2)C1)NNC(=O)c1cccc([N+](=O)[O-])c1	917396692	KFMAWRVOHJDETC-HNNXBMFYSA-N	426.433	1.102	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c2ccccc12	917737320	IIJMSLDJXVAXBP-UHFFFAOYSA-N	434.495	1.875	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCc2cn3ccc(C)cc3n2)nc1	918234483	IOQOEDIJXOEWSM-UHFFFAOYSA-N	431.522	1.895	50	20	IDGD	
NC(=O)c1cn(CC(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)c2ccccc12	919567362	FKLGKLRNBIVBEW-UHFFFAOYSA-N	428.832	1.398	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)NCCS(=O)(=O)NC(C)(C)C)N(C)c2ccccc21	919713111	JGVMGGMCLPMWQC-UHFFFAOYSA-N	447.561	1.491	50	20	IDGD	
O=C(C[C@H](NC(=O)c1ccccc1)c1ccccc1)NNC(=O)N[C@@H]1CCS(=O)(=O)C1	919885346	OSXVIIBNDAZMRS-MSOLQXFVSA-N	444.513	1.065	50	20	IDGD	
O=C(NCc1cccc(C(=O)NC[C@@H]2CCCO2)c1)NNC(=O)c1ccc([N+](=O)[O-])cc1	920346777	CCXYDWSROBFIEC-SFHVURJKSA-N	441.444	1.648	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)C(F)(F)c2ccc(F)cc2)cc1	920850283	UNPKUTPTWAOWAN-UHFFFAOYSA-N	429.420	1.694	50	20	IDGD	
NC(=O)[C@H]1CCCN1Cc1cccc(NC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c1	920929710	KMJZEVUFAJPABI-QGZVFWFLSA-N	426.433	1.511	50	20	IDGD	
CN(C(=O)OC(C)(C)C)[C@H](C(=O)NNC(=O)COc1ccc(C#N)cc1)c1cnn(C)c1	1117103007	SLNGEBBVINOTKG-SFHVURJKSA-N	442.476	1.426	50	20	IDGD	
COC(=O)c1nc(Cl)ccc1S(=O)(=O)NNC(=O)c1cncn1-c1ccccc1	1319561706	FYNKPWGAPUTKKF-UHFFFAOYSA-N	435.849	1.331	50	20	IDGD	
Cc1ccc(C(=O)NCC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](F)Cl)C2)cc1	1778028330	WEUOMNOLQRNQND-PLMTUMEDSA-N	439.915	1.773	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(C)nc(O)c2)C1	1778038732	HANGUWUGZINCEX-RZQQEMMASA-N	425.913	1.477	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4c(c3)NC(=O)[C@@H](C)O4)C2)C1	1780179595	SGKZVMISCCJRBH-VWVPQACVSA-N	435.908	1.867	50	20	IDGD	
CC(=O)N/C(C)=C/C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Br)C1	1780777206	TVZBHDYRESYJQY-NLLZUWNASA-N	434.306	1.231	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](C)NC(=O)c3ccc(F)cc3)C2)C1	1780907213	VHEACKVIZSONST-FNXXIHLHSA-N	439.915	1.791	50	20	IDGD	
CN(CC(=O)N1CC[C@]2(C1)CN(C(=O)C(C)(C)C)CCO2)NC(=O)NCc1ccccc1	1780968592	BYZAHLBATHHVTM-QHCPKHFHSA-N	445.564	1.209	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)CCn3c(=O)oc4ccccc43)CCO2)C1	1781215587	RXYOZVWHJVNSGK-VFNWGFHPSA-N	435.908	1.832	50	20	IDGD	
COc1cccc(CCC(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)n1	1781327068	WUMLKPPPUFIKMB-SJLPKXTDSA-N	444.301	1.543	50	20	IDGD	
O=C([C@@H]1Cc2ccccc2CN1)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781332086	ZQNMNENRWADXKC-BXWFABGCSA-N	440.313	1.221	50	20	IDGD	
C[C@H](NC(=O)c1ccccn1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Cl)C2	1781489628	ISJLJNBTZHAWFM-NOUYOMCBSA-N	440.903	1.248	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1cnn(C)c1)C2	1781904378	RIPULNMUFVGHMJ-FRQCXROJSA-N	441.370	1.650	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1sc(N)nc1C)C2	1782170246	DKNQSDDDWYHZDQ-VEVIJQCQSA-N	430.958	1.415	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc3nccn3c1)C2	1782175651	OKELMGGPUQZPIT-CSODHUTKSA-N	434.924	1.716	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnoc1C1CC1)C2	1782210798	MLNDGJQYKKGXQR-VGOFRKELSA-N	447.536	1.053	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCCn2ccnc2C)C1	1782491255	XYBOBGXEUAPKJP-DBXWQHBBSA-N	440.972	1.739	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3n[nH]c4cccc(F)c34)CCO2)C1	1783538483	XRRLZPODKLZCSI-ADLMAVQZSA-N	439.285	1.929	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)Cc3ccc(OC)cc3C#N)CCO2)C1	1783882236	WVDIHNVXOHFBKA-RXVVDRJESA-N	435.908	1.193	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cc3[nH]ccc3s1)CCO2	1783936053	QQGKXMFKAPHSFF-FQEVSTJZSA-N	433.534	1.046	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21	1783968704	ZHFMDTWHCQMKBE-VOAKCMCISA-N	440.176	1.782	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)n3cccn3)C[C@@H]21	1783974439	NUZJXDFTKDBROY-YXMSTPNBSA-N	427.343	1.455	50	20	IDGD	
O=C(NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])o3)cc2)CCC1)c1cccc(B(O)O)c1	1785748602	UFYZFUWKDCPNQE-UHFFFAOYSA-N	449.228	1.929	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4c(n3)NC(=O)CC4)[C@H]2C1	1787265164	CPMBFJHDIYNZEO-OVWQWFNUSA-N	448.951	1.967	50	20	IDGD	
Cc1ccc(C(=O)NCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]3C2)cc1	1787451448	QJOGHISYDNQAIN-OVWQWFNUSA-N	425.888	1.239	50	20	IDGD	
C#CCCCCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)[C@H]2C1	1787508212	QBOUKGXMMHXQAY-RWRPXTCXSA-N	441.532	1.294	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc4ncccn34)[C@H]2C1	1788006327	SAVPCUWSDHSEQR-OSFYFWSMSA-N	436.310	1.106	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4n(n3)CCCC4)C[C@@H]21	1788764356	MRYHEAGNZCJPGL-IEZWGBDMSA-N	434.613	1.664	50	20	IDGD	
CCc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Br)C[C@@H]32)nn1C	1789067678	SPHUHCXKNJIAIO-HQRZJTNHSA-N	431.306	1.266	50	20	IDGD	
C[C@H](C(=O)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1)N1C[C@@H]2C[C@H]2C1	1789440439	DCFHSSQKXJCOBL-NEWSRXKRSA-N	447.344	1.454	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnn(-c4cccnc4)c3)C[C@@H]21	1789858803	QDUAJKIDXHRZQJ-FZDIXFNVSA-N	431.924	1.878	50	20	IDGD	
C[C@](O)(C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]2C1)C(F)(F)F	1789868306	BAFROPZMLUAQHU-HKWCOGSCSA-N	435.270	1.516	50	20	IDGD	
CN(C)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]2C1	1789868707	JOHRYKFIYIZLNU-GGLFYADGSA-N	443.375	1.977	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](O)C(=O)Nc1ccc(C2(NC(=O)[C@@H](O)CCl)CCC2)cc1	1790729018	CPOZOJCSHOGFLI-YOEHRIQHSA-N	441.912	1.563	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc(Cl)nc3)C[C@@H]21	1791054821	SUFQYFVTRLPXJT-UKJIMTQDSA-N	431.718	1.507	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3c[nH]c4nccc-4c3)C[C@@H]21	1791057687	NYTHFXNOJDRJSG-MZGVZZPPSA-N	435.322	1.891	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3n[nH]c4c(C)cccc34)C[C@@H]21	1791256742	GOGDEIHXIADNPB-LLLHUVSDSA-N	434.924	1.718	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CSc3nc[nH]n3)[C@H]2C1	1791558045	JSOSTFOVLWQLSD-YWDSYVAPSA-N	436.365	1.113	50	20	IDGD	
Cc1ccc(C(=O)NCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Cl)C[C@@H]32)cc1	1792251675	FUMPUNRZGSYZMW-OVWQWFNUSA-N	425.888	1.239	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c(c1)OCO3)C2	1792868211	RFLGSKAFMLPEBG-MBMVNNNZSA-N	439.306	1.650	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1CCN(c3ccccc3)CC1)C2)[C@@H](O)CCl	1792975774	YCADAGQIITVIPU-HNJRGHQBSA-N	435.952	1.092	50	20	IDGD	
CC(C)N1CCC(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)CBr)C3)CC1	1793797126	ZMGCTKQAWWLTTK-NRSFXHEJSA-N	444.414	1.727	50	20	IDGD	
O=C(NCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](F)Br)C2)c1cccnc1	1794226488	QMTXCFLTADUWCN-XFMPKHEZSA-N	427.274	1.140	50	20	IDGD	
C[C@H]1[C@@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Cl)CCN1C(=O)OC(C)(C)C	1796370882	OJHLHBAXVJXANQ-KXKVQDCLSA-N	447.935	1.756	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Cl)C1	1796371209	SUKMXDOTMRGDGW-IBEHDNSVSA-N	447.935	1.758	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2)c1cnnc2ccccc12	1796887347	DLIDPEKUPLYIPZ-IVWMJMPLSA-N	433.306	1.618	50	20	IDGD	
C[C@H]1CCc2c(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@](C)(Cl)CCl)C4)n[nH]c21	1796972413	SHPBDTGQHCYHMT-MVNYESKYSA-N	429.348	1.899	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)[C@@H]1Cc2ccccc2O1	1797227073	NTBDBAFMMSXLJD-PTNZTPPNSA-N	427.270	1.270	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cnc3ccccn13)C2	1799273958	XCKFXGXAYPENCZ-ZZXMYQEDSA-N	439.343	1.703	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc2c(c1)NC(=O)[C@H](C)O2	1799293753	LRSRGIDTVFFRKH-SLZITWOASA-N	435.908	1.912	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1[nH]nc2c(Cl)cccc12)[C@@H](O)CCl	1799844377	JHGIAKXGIHPFCR-BUWBCJGYSA-N	425.316	1.997	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@](C)(Cl)CCl)C2	1800959109	DMRJOELGLSOABG-LZMFIQLBSA-N	447.359	1.568	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2	1800959263	KHMNNPUOJLIVSO-DEPYFDJDSA-N	447.301	1.022	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cc(F)ccc1[N+](=O)[O-]	1802093696	FNISKCRSWLZVGD-ZFHGCVPZSA-N	427.860	1.883	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnc3c(c1)NC(=O)CS3)C2	1802280381	NTSBZJKECJBWKC-XJFOESAGSA-N	438.937	1.631	50	20	IDGD	
O=C(CN1CCSCC1)NC[C@@H]1CCN(C(=O)C(Cl)Cl)[C@@H]1c1cccnc1	1802448989	MUIAZQQQPDNMSQ-GOEBONIOSA-N	431.389	1.940	50	20	IDGD	
CN(C)C(=O)NCC(=O)NC[C@@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1	1802675684	SVWDGQVQQCAJSQ-WMLDXEAASA-N	440.342	1.144	50	20	IDGD	
Cc1ccn2c(C(=O)N3CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]3c3cccnc3)cnc2c1	1803146570	BQCUSYHFKUUDPE-YVWKXTFCSA-N	441.919	1.957	50	20	IDGD	
COc1ccccc1CC(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]1c1cccnc1	1803148230	PJUDCZLOMKFQKS-OPYAIIAOSA-N	431.920	1.938	50	20	IDGD	
O=C(CCC1CCC1)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1803370460	QNDSHZXJDDKZSE-NFBKMPQASA-N	435.333	1.661	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)CN(C)C(=O)C(=O)O)[C@H]1c1cccnc1	1803694765	LPKGCQUXKSFLKI-VYDXJSESSA-N	438.912	1.038	50	20	IDGD	
COc1ccc(CCC(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)cn1	1804261081	SFFSOOBPAZQQEN-WAOWUJCRSA-N	446.935	1.724	50	20	IDGD	
Cc1c[nH]cc1C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1807375530	PVRYLPUYXRCQHX-WIYYLYMNSA-N	432.289	1.031	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)c3cc(C(F)F)no3)CC2)C1	1809966754	LOWBPFVKSMOOBH-UHFFFAOYSA-N	447.247	1.451	50	20	IDGD	
Cc1ccc(F)cc1C(=O)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1	1809967450	HTVIVWWBNAQHBI-UHFFFAOYSA-N	438.308	1.973	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)[C@H](F)c3ccccc3)CC2)C1	1809974892	GJOZLRFLGGQGRL-OAQYLSRUSA-N	438.308	1.922	50	20	IDGD	
Cc1ccccc1NCC(=O)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1	1809976812	RMMBKORKZFEWIX-UHFFFAOYSA-N	449.360	1.632	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)[C@@H](O)NC(=O)OCC)[C@@H]1c1cccnc1	1810089508	JOFPTUBGMOPZJW-MUQADHOPSA-N	440.928	1.559	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)[C@@H](C)n2ccccc2=O)[C@H]1c1cccnc1	1810518314	NJWWWPOXBALOQI-PHXBYCTMSA-N	446.935	1.764	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1CCN(C(=O)[C@H]2CCNC(=O)C2)[C@H]1c1cccnc1	1810548116	OMYFIAZGIDHXSG-KNBMTAEXSA-N	432.597	1.465	50	20	IDGD	
CCOC(=O)C(C)(C)C(=O)N1CC[C@H](CNC(=O)[C@H](Cl)COC)[C@H]1c1cccnc1	1813036981	AAYQLNLGWYYIMB-BRWVUGGUSA-N	439.940	1.931	50	20	IDGD	
C[C@H](Oc1cccnc1)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1	1813437026	YWGLLACHOCJKRS-CBVHJVASSA-N	432.908	1.550	50	20	IDGD	
O=C(Cc1ccccc1)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2	1813805438	UFMLASCXCXVYNE-QGZVFWFLSA-N	435.314	1.291	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1ccsc1)CC2)c1ccc(B(O)O)cc1	1815339753	OELBNEAIRXPVTD-CQSZACIVSA-N	427.316	1.424	50	20	IDGD	
NC(=O)c1ncccc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCBr)[nH]n1	1816076267	XAMMJUHJUBNEGR-CYBMUJFWSA-N	449.309	1.995	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)[C@H](CC)NC(N)=O)sc2C1	1817023833	KCVASMOJFGMGIV-GUBZILKMSA-N	446.371	1.676	50	20	IDGD	
CC(=O)OC[C@H](OC(C)=O)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](F)Cl)sc2C1	1817125367	MSAGNNDXGDJZPG-SUZMYJTESA-N	435.861	1.084	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)C(C)(C)F)CC2	1817280539	ZARILJGLJCRSDA-DLDHGHKKSA-N	434.497	1.937	50	20	IDGD	
CN[C@H](CC(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@](C)(Cl)CCl)[nH]n1)C(=O)O	1817370505	FPWVCLBUMDJKJF-QFSBIZTOSA-N	434.324	1.701	50	20	IDGD	
Cc1cnc2c(C(=O)Nc3cc([C@H]4CCCCN4C(=O)[C@H](O)CCl)[nH]n3)cnn2c1	1819070969	JNZAYPZQRUIAEP-HUUCEWRRSA-N	431.884	1.666	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(C#N)c[nH]2)n[nH]1	1820310485	SIXWVGWTNHLLPD-MRXNPFEDSA-N	426.481	1.288	50	20	IDGD	
CNC(=S)NCCC(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](Cl)COC)n[nH]1	1822369146	DAWSUCRXPATQAT-AAEUAGOBSA-N	430.962	1.140	50	20	IDGD	
O=C(N[C@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1)c1cccc(=O)n1O	1823002454	RBZZSKSTJUQIBH-JVXZTZIISA-N	445.270	1.458	50	20	IDGD	
O=C(N[C@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1)c1cc[n+]([O-])cc1	1823007708	RZLCWTVKVQOFIE-CABZTGNLSA-N	429.271	1.693	50	20	IDGD	
CSCC[C@H](O)C(=O)N[C@H]1CCc2nc(NC(=O)[C@H](C)Br)sc2C1	1825646654	BDAOTZOKHWQKBS-QXEWZRGKSA-N	436.397	1.953	50	20	IDGD	
C[C@]1(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2ccc(B(O)O)cc2)CC3)CC=CCC1	1827221565	SDAIHAYQTUYPPT-ZHRRBRCNSA-N	439.346	1.795	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)CCN2CCOC2=O)CC1	1828386274	OTXNWHAZDUTWFC-DLBZAZTESA-N	429.945	1.702	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CN)CC1	1829637148	WSPBMGFTLACDHD-GOSISDBHSA-N	432.477	1.712	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cscn3)C2)C1	1830538111	VZIFGCOFVVEJKY-BLLLJJGKSA-N	432.340	1.244	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccncc3F)C2)C1	1830538456	FXNPOTYASMUTFP-FZKQIMNGSA-N	444.301	1.322	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2CCCO2)CC1	1831620582	IJYOFTAASBXBNC-OALUTQOASA-N	429.521	1.097	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccn4nccc4c3)C2)C1	1831650253	GJZRYCQFCAFQFL-GHTZIAJQSA-N	434.924	1.812	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)Cc3noc(C)n3)CC2)CC1	1833530346	UPXHPBUOGFRGAQ-KRWDZBQOSA-N	425.961	1.900	50	20	IDGD	
CCc1[nH]nc(C(=O)N2CCO[C@@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)c1F	1833732879	NRQOLBUABBSLHG-IBGZPJMESA-N	430.908	1.446	50	20	IDGD	
Cc1noc(C)c1C(=O)N1CCO[C@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1	1834066306	OIJHSHMQEYQBGQ-IBGZPJMESA-N	425.558	1.213	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3ccnn3C)CC2)CC1	1834214091	SSPVRYZBNJRBSI-MRXNPFEDSA-N	440.386	1.779	50	20	IDGD	
C[C@H](C(=O)NC1CCN(C2CCN(C(=O)[C@@H](F)Cl)CC2)CC1)n1cccc1C=O	1834806936	VGKQYWFETAMBFI-RDTXWAMCSA-N	426.920	1.968	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CCBr)CCO2)C1	1834824629	CRGUCBKMGGEMPJ-RISCZKNCSA-N	442.148	1.011	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](COC)NC(C)=O)CC2)CC1	1835840437	QGOMUVSSCJENLM-RTBURBONSA-N	445.004	1.117	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H]3CCCOC3)CC2)CC1)[C@H](F)Br	1836414405	JJWCEBNKAFVNNV-CJNGLKHVSA-N	434.350	1.675	50	20	IDGD	
CC(C)n1ccc(C(=O)N2CCC(OC3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)n1	1836718518	QNMHJHBDAZTESX-SFHVURJKSA-N	426.945	1.676	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc4nncn4c3)CCO2)C1	1837011654	SJARDWXVNNFOAR-UZLBHIALSA-N	435.912	1.207	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3c(F)cncc3F)C2)C1	1837715451	QWCMCYCRJULPLN-IBGZPJMESA-N	443.523	1.281	50	20	IDGD	
CC(C)n1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)n1	1838788095	KQJFMHOJFLAUJG-PBHICJAKSA-N	447.305	1.225	50	20	IDGD	
Cc1ccn(C)c1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839201720	HKRIOUBEXRIHDI-WMLDXEAASA-N	432.290	1.094	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(-n4cccn4)cc3)CCO2)C1	1839337275	ABMACCPMMLCLGA-SIKLNZKXSA-N	446.935	1.960	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4cnccc4c3)C2)C1	1840152456	IZPKHLGDUMZQLS-KNQAVFIVSA-N	447.919	1.559	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)Cc1ccco1)CCO2	1840472333	BXFWXOMTXFIUAK-ZRGWGRIASA-N	443.338	1.698	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(OC)ccc3F)CCO2)C1	1840686679	ZOJJNBQUXLRTNP-JXFKEZNVSA-N	428.888	1.922	50	20	IDGD	
Cn1cc(C(=O)N2CCCC23CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C3)cn1	1842443260	ARKDGNCJQAEGFH-AWEZNQCLSA-N	425.917	1.369	50	20	IDGD	
O=C([C@H](O)CCl)N1CC2(CCCN2C(=O)c2n[nH]c3ccc(Br)cc23)C1	1843262232	RSRDFHIKCXJIFP-CYBMUJFWSA-N	441.713	1.742	50	20	IDGD	
CC1(C)Cc2cccc(C(=O)N3CCCC34CN(C(=O)c3cccc(B(O)O)c3)C4)c2O1	1843300425	UFNZJUHVQYELSU-UHFFFAOYSA-N	434.301	1.211	50	20	IDGD	
Cn1c(=O)n(CC(=O)N2CCCC23CN(C(=O)[C@@H](F)Br)C3)c2ccccc21	1843860421	RSRAAXVRIYXFDO-OAHLLOKOSA-N	439.285	1.234	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC12CN(C(=O)c1cnc3c(c1)CCNCC3)C2	1846072358	SZRXLHYVIKZKOG-INIZCTEOSA-N	435.366	1.760	50	20	IDGD	
C[C@H]1Oc2ccccc2O[C@@H]1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	14287688	JCSMCEHKSYGYRT-KUHUBIRLSA-N	445.497	1.461	50	20	IDGD	
CCCn1nc(C(=O)NNS(=O)(=O)c2ccc(OCC)cc2)c2ccccc2c1=O	15736950	JTTQOCKZSNTEJV-UHFFFAOYSA-N	430.486	1.829	50	20	IDGD	
C[C@H]1Cc2cc(C(=O)OCC(=O)NNC(=O)c3ccccc3)ccc2N1S(C)(=O)=O	17161667	RELMHFHZWDKJGJ-ZDUSSCGKSA-N	431.470	1.015	50	20	IDGD	
COc1cccc([C@H](CNC(=O)NNC(=O)CNC(=O)c2ccco2)N2CCCC2)c1	726085528	IZERWVJUARPASL-KRWDZBQOSA-N	429.477	1.186	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)N[C@@H](c1ccccc1)[C@H]1CCCO1	726711882	KTKZFVGGLBZJDD-SJORKVTESA-N	431.518	1.844	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2ccccc2O)c(Br)cc1F	728501959	YBHOHKRQXHZVIK-UHFFFAOYSA-N	447.238	1.704	50	20	IDGD	
COC(=O)c1ccccc1S(=O)(=O)N1CCC(C(=O)NNC(=O)CC(C)(C)C)CC1	728607587	COXNPRBTPDSGTE-UHFFFAOYSA-N	439.534	1.458	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)C[C@@H](c2ccccc2)N2CCOC2=O)n1	728732298	HIQVHXUXNKIECF-HNNXBMFYSA-N	446.485	1.268	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@H](C(=O)NNC(=O)c3cccc(C#N)c3)C2)s1	728825105	GGUVEMSILXVIEY-INIZCTEOSA-N	432.527	1.790	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)C1=NN(Cc2ccccc2)C(=O)CC1	728845903	PEKAWOALEXWQIO-UHFFFAOYSA-N	435.488	1.019	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)N2CCN(CC(=O)N3CCc4ccccc43)CC2)c1	728954765	MYLLKWYACILRQB-UHFFFAOYSA-N	432.484	1.120	50	20	IDGD	
CCN(C)C(=O)c1cccc(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c1	729166714	WDRACPJBOXNGEK-UHFFFAOYSA-N	437.544	1.752	50	20	IDGD	
Cc1cc(C)c(S(=O)(=O)NCCC(=O)NNC(=O)CCc2ccccc2O)c(C)c1	730033890	ALJHOBCYQHXALQ-UHFFFAOYSA-N	433.530	1.766	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)c1ccc2c(c1)SC1=NS(=O)(=O)CCN12	730034341	MOFYEQKFOZAHIC-UHFFFAOYSA-N	446.510	1.398	50	20	IDGD	
CSCC[C@H](NC(=O)c1ccc2ccccc2n1)C(=O)NNC(=O)c1c[nH]nc1C	732084044	HPXKRIJLFNRUBP-KRWDZBQOSA-N	426.502	1.579	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cccc(NS(C)(=O)=O)c2)cc1Br	732175317	KHKLWVABQSJDIG-UHFFFAOYSA-N	442.291	1.904	50	20	IDGD	
N#Cc1ccc(N2C(=O)N[C@@H](CCC(=O)NNC(=O)NCCc3cccs3)C2=O)cc1	733777071	ZYGOIFGMTXURFO-INIZCTEOSA-N	440.485	1.398	50	20	IDGD	
C[C@H](c1cccnc1)N1CCN(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)CC1	734169138	NBSFXZLHOKGKSV-QGZVFWFLSA-N	438.536	1.208	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)[C@H]1CCCN1c1ncnc2sccc12	734239693	WGASILZBEFZUNJ-CYBMUJFWSA-N	449.537	1.515	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)CCCc3nc(C4CC4)no3)cc2)CC1	740082268	NOHBDNZCWQGAOT-UHFFFAOYSA-N	448.549	1.349	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Cc2c[nH]c3c(C)cccc23)cc1	741207477	NJSXGCCGEPTWSL-UHFFFAOYSA-N	428.514	1.795	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N[C@@H](C)c2cnn(C)c2)cc1	741700055	DUJXNCYDJCAFFX-HAKPAVFJSA-N	447.499	1.952	50	20	IDGD	
C[C@@H](CC(=O)NNC(=O)c1c[nH]c2ccccc12)/N=C1/NS(=O)(=O)c2ccccc21	742487046	IXZMWALUZPVGDJ-LBPRGKRZSA-N	425.470	1.446	50	20	IDGD	
C[C@H]1Cc2cc(C(=O)NNC(=O)Nc3ccc(N(C)C)cc3)ccc2N1S(C)(=O)=O	743828734	CNBAZBMZNQUISE-ZDUSSCGKSA-N	431.518	1.930	50	20	IDGD	
C[C@H](CCc1cccn1C)NC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	745876309	YKUFXUQTKIQQLA-LJQANCHMSA-N	426.565	1.889	50	20	IDGD	
Cc1ccc(N2CCC[C@@H](NC(=O)NNC(=O)c3cc([N+](=O)[O-])ccc3O)C2=O)cc1	745885742	WHGGHCZGEMBIRG-MRXNPFEDSA-N	427.417	1.748	50	20	IDGD	
CCCCOc1ccc(C(=O)NNS(=O)(=O)c2ccc(-n3cnnn3)cc2)cc1OC	747407603	SXQMOSGSTSUQPU-UHFFFAOYSA-N	446.489	1.473	50	20	IDGD	
CSCC[C@H](NC(=O)c1ccc2ccccc2n1)C(=O)NNc1nccn(C)c1=O	747937659	JCTHGBJXFBJXEU-INIZCTEOSA-N	426.502	1.323	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2ccc(C(=O)NNc3nccn(C)c3=O)cc2)cc1C	747941697	CVRFNYWTDUFEMK-UHFFFAOYSA-N	427.486	1.955	50	20	IDGD	
O=C(NNC(=O)c1ccc(NC(=O)c2cc(F)cc(F)c2)cc1O)C(=O)N1CCCC1	748343141	KQHTYVUYDDDQFE-UHFFFAOYSA-N	432.383	1.306	50	20	IDGD	
Cc1nn(C)c2ncc(S(=O)(=O)NNC(=O)NCc3cccc(C(F)(F)F)c3)cc12	751270358	ABQYAPMXRMQCSB-UHFFFAOYSA-N	442.423	1.988	50	20	IDGD	
CCOC(=O)[C@H]1Cc2cc(S(=O)(=O)NNC(=O)COc3ccccc3CC)ccc2O1	751539399	XJTVQWPMPODEPA-LJQANCHMSA-N	448.497	1.504	50	20	IDGD	
CCOC(=O)[C@@H]1Cc2cc(S(=O)(=O)NNC(=O)c3ccc(Cl)nc3)ccc2O1	751540312	GJSQHOFQLKLNFG-AWEZNQCLSA-N	425.850	1.225	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)CCCCCC(=O)NNC(=O)c1ncccc1C	752238494	QMBGSVOVYVBJAB-UHFFFAOYSA-N	426.477	1.266	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(C(=O)O)c(C(F)(F)F)c1)c1ccc([N+](=O)[O-])cc1	754738428	BOJWMNVMETYWDU-UHFFFAOYSA-N	433.320	1.935	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)c2cc(Br)c[nH]2)cc1S(=O)(=O)N(C)C	755391676	CJGVPTRMGPOQAM-UHFFFAOYSA-N	444.311	1.802	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cccc(-n4ccnn4)c3)CC2)cc1	756003749	VELMDJYMBZKAAY-UHFFFAOYSA-N	433.516	1.155	50	20	IDGD	
C[C@H]1CN(C(=O)Cn2cc(NC(=O)NNC(=O)c3cccc(Cl)c3)cn2)C[C@@H](C)O1	756838483	MZVWFUPQMBLSDL-BETUJISGSA-N	434.884	1.639	50	20	IDGD	
O=C(NNC(=O)C(=O)N1CCCC1)N[C@H]1CCN(c2ncc(C(F)(F)F)cc2Cl)C1	757760115	BSCFQOKZVWXNAM-NSHDSACASA-N	448.833	1.285	50	20	IDGD	
COc1ccc([C@@H](CNC(=O)NNC(=O)C(=O)Nc2ccccn2)N2CCCCC2)cc1	758666370	TYYZQKAWILUDMP-GOSISDBHSA-N	440.504	1.586	50	20	IDGD	
COc1cccc2c1CC[C@H]2NC(=O)NNC(=O)c1sc(N2CCOCC2)nc1C	759718768	PLQOAMRLUUGXOA-OAHLLOKOSA-N	431.518	1.928	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COc2ccccc2O)c(I)c1	760551659	OFGHZPXWKOYGAT-UHFFFAOYSA-N	442.209	1.845	50	20	IDGD	
C[C@@H](CC(=O)NNC(=O)COCc1ccccc1)NS(=O)(=O)c1cccnc1Cl	760613440	CUOKROQTYGYALK-ZDUSSCGKSA-N	440.909	1.156	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2ccc3c(c2)NC(=O)CCS3)n1	761687336	LAVXPIKFINLRQE-UHFFFAOYSA-N	434.499	1.433	50	20	IDGD	
O=C(NNC(=O)c1ccccn1)C(=O)Nc1ccnn1Cc1ccccc1Br	763463813	MHSOPOCWWBCQQU-UHFFFAOYSA-N	443.261	1.489	50	20	IDGD	
CN1CCCN(c2ccc(NC(=O)C(=O)NNC(=O)c3ccc4ccccc4n3)cc2)CC1	763465878	DPXCYVDFMCGUIO-UHFFFAOYSA-N	446.511	1.776	50	20	IDGD	
CN(C)C1(CNC(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)Cc2ccccc2C1	763508569	KVARSHDDJDBSHA-UHFFFAOYSA-N	433.553	1.721	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(C)nn2-c2ccc(F)cc2)cc1OC	763552318	YQHGXTUZTSGORO-UHFFFAOYSA-N	441.419	1.737	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)COc2cc(C)ccc2C(C)C)cn1C	763594617	LAEQODZWZLXLHY-UHFFFAOYSA-N	430.461	1.408	50	20	IDGD	
O=C(COc1cccc(C(F)(F)F)c1)NNC(=O)C(=O)Nc1cnn(-c2ccccn2)c1	763639345	LURHJLVJNHAAFC-UHFFFAOYSA-N	448.361	1.451	50	20	IDGD	
CN(C)C(=O)COc1cccc(NC(=O)C(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)c1	763724001	UYZFXJPJCVPYIU-UHFFFAOYSA-N	442.516	1.456	50	20	IDGD	
COc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NNC(=O)C12CC3CC(CC(C3)C1)C2	763727176	GGEHBJFNGLCSIS-UHFFFAOYSA-N	442.516	1.699	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)c(F)c1	763791563	VSIWJDKPEBYKLV-UHFFFAOYSA-N	425.420	1.825	50	20	IDGD	
CCNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(OCC)cc2)c1	763859685	FAIJDTLKZFFIMZ-CQSZACIVSA-N	442.472	1.388	50	20	IDGD	
CCS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)cc1	763872831	PEUOLSZQAAIYIK-GFCCVEGCSA-N	437.449	1.173	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(C(F)(F)F)nc2)cc1	763876500	FRTZBEOYVNDMDJ-NSHDSACASA-N	438.362	1.856	50	20	IDGD	
CCNC(=O)c1ccc(C)c(NC(=O)C(=O)NNC(=O)CSc2ccc(C)cc2)c1	763891605	PSIZZZJQHQYMIN-UHFFFAOYSA-N	428.514	1.931	50	20	IDGD	
O=C(Cc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1ccc(CCN2CCOCC2)cc1	763937079	WGQPVCUDLPDUOR-UHFFFAOYSA-N	444.919	1.543	50	20	IDGD	
Cc1c(COc2ccccc2)cccc1NC(=O)C(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1	763996580	DQCWJRDHKQUQAO-MRXNPFEDSA-N	445.497	1.095	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1cccc(N2CCCNC2=O)c1	764013288	ZBDDCLGYUIKIOI-UHFFFAOYSA-N	445.863	1.668	50	20	IDGD	
C[C@@H]1CN(C(=O)c2ccc(NC(=O)C(=O)NNC(=O)CCc3ccco3)cc2)C[C@@H](C)O1	764170876	ZDAHEBHMRZDIGM-HUUCEWRRSA-N	442.472	1.248	50	20	IDGD	
O=C(CCc1ccccc1)NNC(=O)C(=O)Nc1cc(N2CCCS2(=O)=O)ccc1F	764193312	ZBVIGRJDPNVDDG-UHFFFAOYSA-N	448.476	1.084	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)C(=O)Nc1cccc(C(=O)N2CCCCC2)c1	764279220	YZHMCHYEYSUHJA-UHFFFAOYSA-N	438.484	1.737	50	20	IDGD	
CCOCC(=O)NNC(=O)C(=O)Nc1ccc(Oc2cccc(Br)c2)nc1	764317481	IYTMZKPNKBSKQX-UHFFFAOYSA-N	437.250	1.759	50	20	IDGD	
O=C1CSc2ccc(NC(=O)C(=O)NNC(=O)c3cnn(-c4ccccc4)c3)cc2N1	764351095	OSQATOJVGFJOOH-UHFFFAOYSA-N	436.453	1.316	50	20	IDGD	
CC[C@@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1	764351473	RUVOAXQFGACJFU-OAHLLOKOSA-N	448.483	1.800	50	20	IDGD	
COC(=O)c1ccc(F)c(NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)c1	764379040	PFRXJTYROSDOCO-UHFFFAOYSA-N	425.319	1.370	50	20	IDGD	
Cc1cc(C)n(-c2ccc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc3ccccc3)cn2)n1	764380399	ZMQGBEBECGLEJR-UHFFFAOYSA-N	444.398	1.642	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)CCC(=O)N2CCN(c3ccccn3)CC2)c1	764524490	MSGBJQCYWCEEKU-UHFFFAOYSA-N	439.516	1.354	50	20	IDGD	
C[C@H]1CN(CCCNC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)CCCO1	764587708	SBJCSWOOPARJKM-FQEVSTJZSA-N	446.596	1.030	50	20	IDGD	
CCOC(=O)c1cnn(-c2ccc(NC(=O)C(=O)NNC(=O)OC)cc2)c1C(F)(F)F	765374144	QZRVXIDEMZXALB-UHFFFAOYSA-N	443.338	1.394	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)OC(C)(C)C)ccc1NC(=O)c1cccnc1	765385519	ADFHGQYZYAWJMZ-UHFFFAOYSA-N	429.433	1.837	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)Cc3ccc(S(N)(=O)=O)cc3)n[nH]2)c1	765580283	BAGYFUHLASUYPG-UHFFFAOYSA-N	427.486	1.345	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)CNC(=O)c3ccoc3C)n[nH]2)cc1OC	765596757	LKTUXIJHKZQSAL-UHFFFAOYSA-N	427.417	1.186	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)c2ccc(Cl)nc2)cc1F	765639606	AQONCJPGHVQJTD-UHFFFAOYSA-N	436.874	1.259	50	20	IDGD	
Cc1ccccc1-n1cc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cn1	765734918	FMXGGLNWXOLBCE-UHFFFAOYSA-N	446.511	1.400	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1cnc(-c2ccco2)s1	765737451	FOMMDEDLLOMHLO-UHFFFAOYSA-N	439.497	1.622	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)N1CCNC(=O)[C@H]1c1cccc(Br)c1	766246366	CIQIVVSIELQBRT-BLLLJJGKSA-N	425.327	1.504	50	20	IDGD	
CC(C)[C@@H](C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1)N1CCCCC1	766636537	PQYDTLXPYVDEJX-NRFANRHFSA-N	429.565	1.102	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)CO[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)C[C@@H](C)O1	767822659	MOIYRKYGBBINPI-IXDOHACOSA-N	442.557	1.049	50	20	IDGD	
Cc1ccc2cccc(S(=O)(=O)N3CCN(S(=O)(=O)CBr)CC3)c2n1	767851261	QESJXYURHFNHDA-UHFFFAOYSA-N	448.364	1.532	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)C(=O)Nc2cnn(C(F)F)c2)c1	768240151	SNMZISVDESZNNE-UHFFFAOYSA-N	432.181	1.449	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)CCc3nc(O)c4cnn(C)c4n3)n[nH]2)cc1	768268504	BYTZDHXPYNYUBR-UHFFFAOYSA-N	434.460	1.415	50	20	IDGD	
Nn1c(SCC(=O)NNC(=O)c2ccc(Cl)cc2)nnc1-c1n[nH]c2c1CCC2	768425813	DHSSLBNRQOKWSL-UHFFFAOYSA-N	432.897	1.077	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@]2(CC(=NNC(=O)C(=O)NC3CC3)c3ccccc3O2)C1	769569234	FYLMDYQAXHJWPK-QFIPXVFZSA-N	428.489	1.948	50	20	IDGD	
CS(=O)(=O)c1ccc(C(=O)NNC(=O)COc2ccc(F)cc2)cc1Br	769617349	OEURNXINJYABTF-UHFFFAOYSA-N	445.266	1.832	50	20	IDGD	
CSCCNC(=S)NNC(=O)[C@H]1CS[C@]2(c3ccc(F)cc3)CCC(=O)N12	770241167	VUQTWVBLARLEBY-DYVFJYSZSA-N	428.580	1.575	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNS(=O)(=O)c1ccc(CCNC(=O)C(C)(C)C)s1	770633759	DTVHLIBJCXUTLA-UHFFFAOYSA-N	446.595	1.067	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3n[nH]c(C(C)C)c3[N+](=O)[O-])CC2)cc1	771646950	BUHKOGBSQZXYJN-UHFFFAOYSA-N	443.508	1.329	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)c1cc(S(C)(=O)=O)ccc1Br	772086179	BOMPRHPGGAZSNQ-SNVBAGLBSA-N	449.323	1.591	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NNC(=O)C[C@@H]2Oc3ccccc3NC2=O)C1	773411760	QYDHHILBUVFAKX-CJNGLKHVSA-N	432.477	1.571	50	20	IDGD	
COC(=O)c1cc(F)ccc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1cccc(Cl)c1	774008313	GDBINTUXXHAVAZ-JTQLQIEISA-N	437.811	1.819	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)NC[C@H]2CC[C@H](C(=O)N(C)C)O2)c(C)n1-c1ccccc1	775460367	IXFQYIRRECDADL-IEBWSBKVSA-N	427.505	1.674	50	20	IDGD	
CC[C@H](C)Oc1cc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)ccn1	777420621	WGQIUEWOKUKLFF-KRWDZBQOSA-N	439.516	1.478	50	20	IDGD	
C[C@H]1C(=O)N(C)CCN1C(=O)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1	777485672	MRVUKCGKJARNOZ-UWJYYQICSA-N	435.528	1.517	50	20	IDGD	
O=C([C@H]1COc2ccc(Cl)cc2C1)N1CCN(S(=O)(=O)CBr)CC1	777780127	WAQMTOQXOBNPKM-GFCCVEGCSA-N	437.743	1.718	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)c2cc(S(=O)(=O)NCCCN(C)C)ccc2C)c1	781039718	OURCMETZHKJNLK-UHFFFAOYSA-N	448.545	1.769	50	20	IDGD	
O=S(=O)(CBr)N1CCN(S(=O)(=O)c2ccc3c(c2)CCCC3)CC1	782398348	JONPEZGVEFFDGC-UHFFFAOYSA-N	437.381	1.554	50	20	IDGD	
COc1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)c1csc(N2CCOCC2)n1	782898080	YLJCMRIHRMHEFI-UHFFFAOYSA-N	439.881	1.041	50	20	IDGD	
CCCc1cc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)n(C)n1	783408565	LTZKLGUXEJQWMY-UHFFFAOYSA-N	433.412	1.748	50	20	IDGD	
O=C(NNc1ccc(-n2cccn2)nn1)C(=O)Nc1ccc(C(=O)NC2CCCCC2)cc1	783433379	RYXXKPBAFFHCJF-UHFFFAOYSA-N	448.487	1.807	50	20	IDGD	
NS(=O)(=O)[C@H]1CCN(C(=O)C(=O)Nc2ccccc2S[C@@H](Cl)C(F)(F)F)C1	784793753	QQCFTBNBJQMSFK-ISVAXAHUSA-N	445.872	1.734	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1ccc(S(=O)(=O)Nc2ccccc2F)cc1	785422694	PLAJBBCVBCLJSO-GFCCVEGCSA-N	437.449	1.729	50	20	IDGD	
C[C@H](O)C(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2cccc(C(F)(F)F)c2)c1	786682927	MRYNWZXRZXDHLW-JTQLQIEISA-N	431.392	1.648	50	20	IDGD	
CCc1c(C(=O)OCC(=O)NNC(=O)c2ccc(C)cc2)nnn1Cc1ccc(F)cc1	787165799	UYZZWHKBNBUTCV-UHFFFAOYSA-N	439.447	1.954	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2nccnc2C(C)C)cc1C(=O)N1CCOCC1	787582182	STSUOKFOXPPXNH-UHFFFAOYSA-N	426.477	1.463	50	20	IDGD	
O=C(NNS(=O)(=O)CCCCCl)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	788047357	LINRUAYQMUQPQJ-UHFFFAOYSA-N	448.936	1.972	50	20	IDGD	
NC(=O)c1cc2c(nc1O)CCCC2=NNC(=O)COc1ccc(Br)cc1	788953825	FSQSHQPCZILBIP-UHFFFAOYSA-N	433.262	1.884	50	20	IDGD	
O=C(NC[C@H](Cc1cccc(F)c1)C(=O)N1CCOCC1)NNc1nc2ccccn2n1	789311898	VXFMQXKFJOTEQF-INIZCTEOSA-N	441.467	1.212	50	20	IDGD	
Cc1nc(NC(=O)C(=O)NNC(=O)COc2ccc(Br)cc2)sc1C	789732530	RFNQOTURXNPDRV-UHFFFAOYSA-N	427.280	1.687	50	20	IDGD	
Cn1nc([C@H]2CCCO2)cc1NC(=O)C(=O)NNC(=O)c1cccc(Br)c1	789733547	NFMJHHHZRZXUSB-CYBMUJFWSA-N	436.266	1.434	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)ccc1Cl	789735180	MFKSVTLBZALNME-UHFFFAOYSA-N	432.868	1.141	50	20	IDGD	
Cn1c(N)c(C(=O)/C(C#N)=C/c2cc(Br)c(Cl)s2)c(=O)n(C)c1=O	790099697	LMUYFWVNBICUNR-ZZXKWVIFSA-N	429.683	1.933	50	20	IDGD	
COc1cc(C(F)(F)F)ncc1NC(=O)C(=O)NNC(=O)c1cc(Cl)ccc1O	792269674	TXOARAVGMAJFGW-UHFFFAOYSA-N	432.742	1.868	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2F)cc(-n2cccn2)c1	792352126	BFUXYXKPSYPDAC-UHFFFAOYSA-N	427.392	1.185	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1F)C(=O)Nc1cccc(N2C(=O)CCCC2=O)c1	792356714	RXWVAVSIQKXFJT-UHFFFAOYSA-N	446.822	1.922	50	20	IDGD	
CC(=O)NC[C@H]1CCn2ncc(C(=O)NNC(=O)COc3cc(C)ccc3C(C)C)c2C1	792732634	LDFIISDNOVCIKD-KRWDZBQOSA-N	441.532	1.853	50	20	IDGD	
CN(C(=O)OC(C)(C)C)[C@@H](C(=O)NNC(=O)c1ccc2c(c1)OCO2)c1cnn(C)c1	794756749	CJXOIZCZXRWARD-MRXNPFEDSA-N	431.449	1.518	50	20	IDGD	
CC(C)Oc1ccc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)cc1C(N)=O	797012980	UNAWTMDMHFFGQA-UHFFFAOYSA-N	446.485	1.157	50	20	IDGD	
O=C(Cc1ccc(Cl)cc1)NNC(=O)Nc1cc(S(=O)(=O)N2CCCC2)ccn1	797675504	ZFTINMYHLJONJH-UHFFFAOYSA-N	437.909	1.915	50	20	IDGD	
C[C@@](O)(CSc1cccc(F)c1)C(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	803000966	YESPXFMJPQOKTJ-LJQANCHMSA-N	439.896	1.786	50	20	IDGD	
COC(=O)N(C)NC(=O)CCc1nc2cc(S(=O)(=O)N3CCCCC3)ccc2n1C	804121169	CNTAMCCWJDDQQX-UHFFFAOYSA-N	437.522	1.410	50	20	IDGD	
CCc1nnc(NC(=O)[C@@H](C)[C@@H](C)NC(=O)NNC(=O)COCc2ccccc2)s1	805141397	DKIVLWODVUJDCM-QWHCGFSZSA-N	434.522	1.611	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(=O)n(CC(=O)NNc2nccnc2C2CCC2)c1	805468515	GXBUTMDXGVTEOG-UHFFFAOYSA-N	434.522	1.080	50	20	IDGD	
C[C@H](C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1)n1ccc2ccccc2c1=O	806341637	NIEGWDAAOGKACZ-LLVKDONJSA-N	448.888	1.325	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2ccc(S(=O)(=O)[C@H](C)C#N)cc2)c(OC)c1	806458922	QWOCGXLMZKYHLU-GFCCVEGCSA-N	432.458	1.856	50	20	IDGD	
N#Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)cc1Br	806977326	DVKYXBZBZNUHJX-HNNXBMFYSA-N	429.230	1.410	50	20	IDGD	
O=C(Cc1ccccn1)NNC(=O)C(=O)Nc1cc(F)c(Br)c(Cl)c1	806978968	OKVYHINPJMDSHK-UHFFFAOYSA-N	429.633	1.965	50	20	IDGD	
COCCOc1ccc(S(C)(=O)=O)cc1NC(=O)C(=O)NNc1ccc(F)cc1F	806997788	VUOARHQIIHDNBF-UHFFFAOYSA-N	443.428	1.475	50	20	IDGD	
COc1ccc(CNS(=O)(=O)c2ccc(CCCCl)cc2)cc1S(N)(=O)=O	808337090	DOKASXAVAXJMES-UHFFFAOYSA-N	432.951	1.993	50	20	IDGD	
COc1ccc(S(=O)(=O)NCC(=O)NNc2cccc(C(F)(F)F)n2)cc1OC	810428226	UCQXYIJOLYRXGD-UHFFFAOYSA-N	434.396	1.539	50	20	IDGD	
CC[C@@H]1[C@H](C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)CCN1C(=O)OC(C)(C)C	811298998	FMJLVCQBLLSXCQ-IAGOWNOFSA-N	444.488	1.898	50	20	IDGD	
COc1cc(Cl)ccc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	813033889	QAAHBKNXYVUPMH-UHFFFAOYSA-N	426.882	1.681	50	20	IDGD	
O=C(CSc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1cn(Cc2ccccc2)nn1	815565118	CWCXDPPEDFJRCN-UHFFFAOYSA-N	444.904	1.858	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCO1)C(=O)Nc1ccc(Cl)c(C(=O)NC2CCCCC2)c1	815778080	AVEOBQVYLSZHOK-MRXNPFEDSA-N	436.896	1.667	50	20	IDGD	
COCCCn1c(O)nnc1SCC(=O)NNC(=O)c1cc(Cl)ccc1OC	844262315	GXWJCMZODURJIH-UHFFFAOYSA-N	429.886	1.236	50	20	IDGD	
Cc1ccc(/C=C(/C#N)C(=O)OCC(=O)N2CCN(c3ncnc4c3cnn4C)CC2)cc1	855350486	WLXZPQHELXPNGQ-WQRHYEAKSA-N	445.483	1.471	50	20	IDGD	
CN1CC[C@H](C(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)CC1=O	906376908	DOVYDIHXYAIAQU-INIZCTEOSA-N	433.468	1.074	50	20	IDGD	
O=C(NCCN1CCN(c2ccc(F)cc2)CC1)NNC(=O)[C@H]1COc2ccccc2O1	916513991	ZAEXZRYWRXGJMK-HXUWFJFHSA-N	443.479	1.118	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCc2nncn2-c2ccccc2)c2ccccc2c1=O	916580644	NMJWSTPWQBVWPJ-UHFFFAOYSA-N	432.444	1.141	50	20	IDGD	
CC[C@H](NC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)c1ccc2c(c1)OCCO2	918129448	GGTPEMXXBMOLMO-INIZCTEOSA-N	433.486	1.957	50	20	IDGD	
C[C@H]1CN(Cc2cccc(CNC(=O)NNC(=O)[C@@H]3COc4ccccc4O3)c2)CCO1	920236726	GBSZIBWEIQJQKW-KKSFZXQISA-N	440.500	1.578	50	20	IDGD	
CC(=O)N1CCN(c2ccc(C(=O)NNC(=O)c3ccccc3C)cc2[N+](=O)[O-])CC1	920300619	GATSZKJRVIEWDO-UHFFFAOYSA-N	425.445	1.647	50	20	IDGD	
CCC(=O)N[C@@H](C)C(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccc(OC)cc2)c1	920400211	FSHUVJOTGXAAHQ-ZDUSSCGKSA-N	448.501	1.172	50	20	IDGD	
COC(=O)Cc1csc(NC(=O)NNC(=O)COc2ccc(Br)cc2)n1	920931435	QIZVKKZQYAAZAV-UHFFFAOYSA-N	443.279	1.853	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)Nc1cccc(CN2CCC[C@@H]2C(N)=O)c1	920940689	UWJFECYJNCUGJE-GOSISDBHSA-N	425.489	1.540	50	20	IDGD	
O=C(NNC(=O)c1sccc1S(=O)(=O)N1CCSCC1)c1ccccc1F	921273357	LBRRZPKGWNEDBS-UHFFFAOYSA-N	429.520	1.700	50	20	IDGD	
COc1cc(C#N)ccc1OCC(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1	1116084910	KECMJFXLCVRNEB-UHFFFAOYSA-N	432.477	1.740	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCCNS(=O)(=O)c2cccc(Cl)c2)cc1	1251311177	QOCVCAKGVORLCB-UHFFFAOYSA-N	426.882	1.271	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)C23C[C@H]4C[C@@H](CC(O)(C4)C2)C3)cc1OC	1317691068	UNGWSPDNOSKWPX-CFYSCFQDSA-N	432.473	1.339	50	20	IDGD	
Cc1cn(CC(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)c2ccccc12	1318555600	QHSFBARTGNNJJJ-UHFFFAOYSA-N	442.545	1.424	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)C(=O)c2cnn(-c3ccccc3)c2)cc1	1321773783	FTPAJVMBMVTBCP-UHFFFAOYSA-N	427.442	1.311	50	20	IDGD	
O=C(NNC(=O)c1cncn1-c1ccccc1)N[C@H]1CC(=O)N(CCOc2ccccc2)C1	1323369685	OMAJYIYGYXAOLI-KRWDZBQOSA-N	448.483	1.496	50	20	IDGD	
Cn1c(=O)c(C(=O)N2CC[C@@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)nc2ccccc21	1777887392	ZPTHAMFMFAZRGQ-JOCHJYFZSA-N	446.935	1.642	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@]3(F)CCCCC3(F)F)C2)C1	1778222931	MQVKZNCIKNCEQE-RRQGHBQHSA-N	426.863	1.988	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(CCN(C(=O)/C=N/O[C@H]3CCCCO3)C2)C1	1779103798	YZQQOBPFESSDIR-WPWRXMBVSA-N	427.574	1.197	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)n(C(F)F)n1	1779297951	CSSGAXXYSAMFSN-GOSISDBHSA-N	430.528	1.882	50	20	IDGD	
Cc1cccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2ccc(B(O)O)cc2)C3)c1	1780394286	AWMZVEXBDNXEOH-ZJSXRUAMSA-N	436.317	1.116	50	20	IDGD	
COc1cnc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@](C)(Cl)CCl)C2)cn1	1780710118	IPLKVDSGJDHONO-MDASCCDHSA-N	445.347	1.849	50	20	IDGD	
COc1cc(OC)cc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)c1	1781332908	CKIKRBAUQLUNOF-CRAIPNDOSA-N	445.285	1.838	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)C2)C1	1781938282	AEXUHFDVEWPUAO-PIGZYNQJSA-N	442.266	1.527	50	20	IDGD	
C[C@@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)Br)C1)n1ccnn1	1782002864	YMPPZYYAJRJBPQ-UMPJEAMMSA-N	428.331	1.136	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cccc4c3NC(=O)C4)C2)C1	1782411983	MNODMKXDJXHLLB-WOJBJXKFSA-N	440.327	1.861	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)CNC(=O)c3ccco3)CCO2)C1	1783343638	WDMDVFNUIWHKJQ-SCLBCKFNSA-N	442.310	1.013	50	20	IDGD	
O=C(Cn1cnc2ccccc21)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1783750791	LZBJBYYHGHOHTF-SJLPKXTDSA-N	439.285	1.557	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cn4c(Cl)cccc4n3)CCO2)C1	1783876242	XIGJGKPIAMIFQE-YJYMSZOUSA-N	441.315	1.685	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H]3CCCN3Cc3ccccc3)C2)C1	1784241181	AAWOQKVRXDNINQ-ZRCGQRJVSA-N	449.979	1.735	50	20	IDGD	
CC(=O)Nc1ccccc1C(=O)N1CC[C@@]2(CN(C(=O)CCBr)CCO2)C1	1785098816	QAUIWHJQCWAUCJ-LJQANCHMSA-N	438.322	1.874	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccn4ccnc34)C[C@@H]21	1786406991	LYTQGWXZXOXSAW-BPUTZDHNSA-N	435.322	1.713	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CC3CCOCC3)[C@H]2C1	1786735373	KUCHRXQRVZBZGY-IWCQGFGOSA-N	431.371	1.814	50	20	IDGD	
Cc1ccn(CC(=O)Nc2ccc(C3(NC(=O)c4ccc(B(O)O)cc4)CCC3)cc2)n1	1786917112	GPQRXXSNDBQZHA-UHFFFAOYSA-N	432.289	1.319	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cn4ccsc4n3)[C@H]2C1	1788392786	LLYNQTAVEUZDGS-XPCVCDNBSA-N	426.926	1.243	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC1(c2ccc(NC(=O)c3cc(O)nc(O)n3)cc2)CCC1	1788577961	OPGWXHBEIIMIGT-UHFFFAOYSA-N	442.476	1.009	50	20	IDGD	
CC[S@@](=O)CCC(=O)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1	1789420399	WVEXVSZBEPNMNS-WJOKGBTCSA-N	442.346	1.273	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)COC(=O)C(F)(F)F)C[C@@H]21	1789868102	MREQLCJGDPFDKS-USXUVBGUSA-N	449.253	1.308	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nc4ccccc4[nH]3)C[C@@H]21	1791057192	HUZUPQVPJSSZSK-QCQGSNGOSA-N	435.322	1.940	50	20	IDGD	
C[C@H](C(=O)Nc1ccc(C2(NC(=O)c3cnccc3C(=O)NN)CCC2)cc1)n1ccnn1	1791099340	BZUOPEHOPJXXQM-CQSZACIVSA-N	448.487	1.286	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3cnc4[nH]ccc4c3)[C@H]2C1	1791142333	ZYMKXLHXJYVKHJ-VJANTYMQSA-N	448.951	1.729	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(C)nn3C(F)F)C[C@@H]21	1791253373	APHGOPYQZYBERP-ABHRYQDASA-N	434.871	1.434	50	20	IDGD	
Cc1cnn([C@@H](C)C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)CBr)C[C@@H]32)c1	1791592529	GUGICHDPVRTEAR-XAJHFOFHSA-N	441.370	1.763	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)n3cccn3)[C@H]2C1	1791642099	AYTBQJQXMMRJQJ-GVRJEKJASA-N	427.343	1.597	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)C(Cl)Cl)C3)c1	1792697149	LQHAYQWLDSDSAE-DABQJJPHSA-N	435.329	1.097	50	20	IDGD	
COC(=O)c1ccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C(C)(C)CCl)s1	1792784733	RLYFFUVJENMDCO-FVCICTRLSA-N	442.965	1.932	50	20	IDGD	
N#Cc1cccc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCBr)C3)c1	1792831308	SHEXXPFHNWNDMO-XEMDLRDOSA-N	434.334	1.865	50	20	IDGD	
COc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)CBr)ccn1	1792870699	IXTONCITICDBFT-OEYIWLLWSA-N	426.311	1.324	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3nc(CO)[nH]c3c1)C2	1793449533	DMKDHDNVHXECCJ-YGTYGHESSA-N	434.924	1.666	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnc(O)[nH]1)C2	1794142340	HFGRKLRPDAWSPJ-RNJOBUHISA-N	441.916	1.499	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1c[nH]c2nccc-2c1	1796197459	MBAIOWDEFWMLCQ-XJFOESAGSA-N	425.258	1.408	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H]1CCCCN1C)C2	1796889786	RGMFSXSJIFECRT-WZAKMNGYSA-N	428.537	1.243	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2c(c1)CC(=O)N2	1797333259	ZINKBNWZOJAMSP-ACNBBOPNSA-N	440.327	1.621	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1cc2ncsc2[nH]1	1797981359	RDKVSDMQHIFAIY-VVJJBPBLSA-N	431.287	1.518	50	20	IDGD	
C[C@@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCC(=O)NN(C)C)C2)N1CSCSC1	1798527678	ZSYNBWXQHGTEJU-JONQDZQNSA-N	443.639	1.041	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccc(Br)nc1	1799031463	XXSHGDKAOSBXQT-UMPJEAMMSA-N	444.757	1.994	50	20	IDGD	
COc1ccc2[nH]cc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)CCC(=O)NN(C)C)C4)c2n1	1799177894	CSCOYLFRDNHMAK-QDMKHBRRSA-N	442.520	1.196	50	20	IDGD	
O=C1Cc2cccc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@H](F)Br)C4)c2N1	1800031115	DSPKMNFQUUFDSH-VAECKANCSA-N	440.269	1.075	50	20	IDGD	
COc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)Br)ccc1C	1800760585	UXUUZZXIJKKFAJ-JJAZEVLHSA-N	425.323	1.990	50	20	IDGD	
CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2	1801964318	MQKLHQGHQBKMOR-YVECIDJPSA-N	438.352	1.683	50	20	IDGD	
CCn1nc(C(C)C)cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCC(=O)NN(C)C	1802336011	BDQNVJBJTMPHOP-BJWYYQGGSA-N	432.569	1.651	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)N1CC[C@H](CNC(=O)CCBr)[C@@H]1c1cccnc1	1806340669	JJOHRXDZJUDKIW-QBIMZIAESA-N	439.354	1.739	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)C#Cc2ccccc2)[C@H]1c1cccnc1	1806621515	ADBACZSLBQBLCO-SQJMNOBHSA-N	447.539	1.512	50	20	IDGD	
C[C@H](Cn1cccn1)C(=O)N1CCCC2(CCN(C(=O)CCC(=O)NN(C)C)CC2)C1	1807270036	HTPIWPVHBXMQLB-GOSISDBHSA-N	432.569	1.123	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)[C@H]2C[C@H]2F)[C@H]1c1cccnc1	1807821158	WAGNJVIXONUZGJ-QVFLAULMSA-N	440.479	1.579	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)[C@H](F)Cl)[C@H]1c1cccnc1	1808416706	CYLJKDUSZMIFRH-OOSRNYNBSA-N	448.886	1.756	50	20	IDGD	
O=C(O)c1cnncc1C(=O)N1CCC2(CCCN(C(=O)CCBr)C2)CC1	1809067220	QPZQEIFTYDFOOD-UHFFFAOYSA-N	439.310	1.805	50	20	IDGD	
O=C(Cc1cccc(F)c1)N1CCCC2(CCN(C(=O)c3ccc(B(O)O)cc3)CC2)C1	1809233579	MNQFRMXRENJNAC-UHFFFAOYSA-N	438.308	1.593	50	20	IDGD	
C=C(C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)C(F)(F)F	1812676685	CKIZKTAKNLUQPC-AEFFLSMTSA-N	447.222	1.200	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H](CNC(=O)CCn2cncn2)[C@@H]1c1cccnc1	1813321759	PDUGSDAFXSDWCB-RYRKJORJSA-N	449.353	1.943	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)c1	1813894893	KFFUVQVVHVSSCU-YSIASYRMSA-N	444.919	1.959	50	20	IDGD	
Cc1nn[nH]c1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](C)CBr)CC2	1815931648	JQJYJXYTDDBRSE-APPZFPTMSA-N	427.328	1.826	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)C[C@H]2CCCCO2)[nH]n1)c1ccc(B(O)O)cc1	1817470505	SUHCZVNQHJOUSL-MJGOQNOKSA-N	440.309	1.355	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)CN3CCN(C)CC3)sc2C1	1818796499	RMZDZFUQKCIRKS-KGLIPLIRSA-N	428.002	1.710	50	20	IDGD	
CC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CN1CCN(C(C)=O)CC1)CC2	1822848015	OLZJRIVEUMNCFB-UONOGXRCSA-N	441.985	1.237	50	20	IDGD	
CC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CNC(=O)C(F)(F)F)CC2	1822856855	WHHDSSFIGTZFSU-HTQZYQBOSA-N	426.848	1.751	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@H]2CCCCO2)CC1	1823818742	NIEUYLKXECYRSX-WOJBJXKFSA-N	443.548	1.488	50	20	IDGD	
CCn1nccc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1	1826101962	LYONEDPIJHRTFH-SFHVURJKSA-N	432.569	1.509	50	20	IDGD	
O=C(CS(=O)(=O)N1CCCC1)N1CCC([C@H]2CCCCN2C(=O)[C@H](F)Cl)CC1	1827613959	WLJOBICATMKXKG-WBVHZDCISA-N	437.965	1.566	50	20	IDGD	
C#CC(=O)N1CC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCN2C(=O)OCc1ccccc1	1829359772	FRULLLSAEQVESR-FQEVSTJZSA-N	438.311	1.875	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(F)nc3F)C2)C1	1830352851	SJLNQWZPPVGHFH-IBGZPJMESA-N	431.867	1.695	50	20	IDGD	
COc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)ccn1	1830364360	HHCRPBVTQOBOPC-FQEVSTJZSA-N	425.913	1.425	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](O)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H](O)CCl)CC1	1830666433	NRNUHRNDSDDRNU-BZUAXINKSA-N	447.960	1.049	50	20	IDGD	
O=C(c1cc2c(s1)CCCC2)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1830730784	DTRUVUGWWRBCFY-MGPUTAFESA-N	442.965	1.297	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ncn(C(C)C)n3)C2)C1	1831647369	UNOJHQLUJKRVAR-DNVCBOLYSA-N	427.933	1.337	50	20	IDGD	
CN1CCC(C(=O)N2CCC([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)CC1	1831869932	PNPXHJQSJISODE-HXUWFJFHSA-N	435.613	1.321	50	20	IDGD	
Cc1ccc(CC(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)o1	1832331704	UMVKJZZSVFQKFR-JOCHJYFZSA-N	438.333	1.744	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)COCc3ccccc3)CC2)CC1)[C@H](O)CCl	1833309037	JVYSAOYCXYMFGC-HXUWFJFHSA-N	437.968	1.375	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccccc3O)CCO2)C1	1833759054	WFNYBVGSFMVNLT-ACJLOTCBSA-N	427.295	1.246	50	20	IDGD	
CC[C@H](C)[C@@H](N)C(=O)NC1CCN(C2CCN(C(=O)CO[Si](C)(C)C)CC2)CC1	1834688217	KTHYCBFVJDUEQG-OXJNMPFZSA-N	426.678	1.783	50	20	IDGD	
O=C(CCCn1cccc1)N1CCOC[C@]2(C1)CN(C(=O)CCBr)CCO2	1834826624	SFQBHMRBWAIBLP-IBGZPJMESA-N	442.354	1.510	50	20	IDGD	
O=C(Cc1ccccc1F)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1835005770	QEOVFPCZLKHXDF-WMZOPIPTSA-N	447.276	1.515	50	20	IDGD	
Cc1cnc2c(C(=O)N3CCC(N4CCC(NC(=O)[C@@H](F)Cl)CC4)CC3)cnn2c1	1835080558	NSKRFFORINFYPV-QGZVFWFLSA-N	436.919	1.757	50	20	IDGD	
Cc1cnoc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)CBr)C2)C1	1838389324	BUAYBOSFIFDRHU-YVEFUNNKSA-N	430.299	1.084	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(C#N)cc1)CCO2	1838951238	FXYXFLZZGGWMRZ-NRFANRHFSA-N	431.565	1.480	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccccc3C(N)=O)CCO2)C1	1839349612	GTCBXKFFFAWNEO-DYESRHJHSA-N	437.924	1.263	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)CCO2)C1	1839354874	YHYVIXAWLNIFTG-APWZRJJASA-N	443.859	1.821	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3c(O)cc(O)cc3O)CCO2)C1	1839371758	NZKYOIHCMARBRQ-JLTOFOAXSA-N	442.896	1.281	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cn4c(F)cccc4n3)CCO2)C1	1839555483	CPLCOHCEXGWIGC-VLIAUNLRSA-N	438.887	1.561	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ncoc3C)C2)C1	1839966246	ZBJSOPPTVWIZOY-DYVFJYSZSA-N	430.299	1.227	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(F)cc3)C2)C1	1840034819	XWASQYMCHQJBTK-SCLBCKFNSA-N	429.286	1.679	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)c(O)c1	1840036885	RVEJBKYUQWBWMC-AUUYWEPGSA-N	441.322	1.554	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3ccc(F)cc3)CCO2)C1	1840056238	UDMXPTAQCYTLRM-RXVVDRJESA-N	442.915	1.469	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3onc4ccccc34)C2)C1	1840154766	FSPGQTFLWOFWKR-YWZLYKJASA-N	437.880	1.152	50	20	IDGD	
O=C(c1csc2c1CCCO2)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840187784	WTKUJACOKYKXDT-SFHVURJKSA-N	449.356	1.947	50	20	IDGD	
O=C(c1n[nH]c2cccc(F)c12)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840189592	AGJOBBFEEOZBMZ-SFHVURJKSA-N	445.278	1.576	50	20	IDGD	
O=C(COc1ccccc1F)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840189610	BYVIJXQFQMYTLK-SFHVURJKSA-N	435.279	1.465	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)Cn2ccnc2)C1	1842509425	ZJESJWSXIZENQV-UHFFFAOYSA-N	427.417	1.234	50	20	IDGD	
Cc1cc(C(=O)N2CC3(CCCN3C(=O)c3cccc(B(O)O)c3)C2)c2cc(O)ccc2n1	1843013909	BLPAFHNJYKFSLS-UHFFFAOYSA-N	445.284	1.059	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1ccc(Cl)nc1F)C2	1843415440	HZJFWCYNTCYKBQ-BRJLIKDPSA-N	446.870	1.825	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)[C@@H](C)c1ccc(O)cc1)C2	1843416766	XZEJCLNLYGMSPG-BDKXHVGHSA-N	437.500	1.833	50	20	IDGD	
CN(CC(=O)N1CCCC12CN(C(=O)[C@H]1C[C@H]1C1CC1)C2)NC(=O)NCc1ccccc1	1845038210	FFWYCIROJRBULO-PMACEKPBSA-N	439.560	1.582	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)c1ncn3nc(N4CCOCC4)ccc13)C2	1845164623	QLPUKMZWOQIFMG-OAHLLOKOSA-N	446.939	1.400	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC2(CCCN2C(=O)c2ccc(S(C)(=O)=O)c(F)c2)C1	1846894595	PANFACDZPUKMNF-LLVKDONJSA-N	447.326	1.830	50	20	IDGD	
Cc1cccc(C)c1N1C[C@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](O)CCl)CC1=O	1847556248	FVLHEYRICTYPEM-VSZNYVQBSA-N	433.936	1.458	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1ccc(Cl)nc1F	1848287702	DATRANLXHLDIQT-IBSSICKUSA-N	446.870	1.824	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)Cn2c(=O)n(C)c3ccccc32)c2ccccc2c1=O	14222505	BRFXSVKXGYYINE-UHFFFAOYSA-N	434.456	1.092	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)c1ccccc1F)C(=O)NNC(=O)c1ccccc1F	15794548	WNKDTTJMALCWBI-OAHLLOKOSA-N	443.497	1.826	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)[C@@H](NS(=O)(=O)c2ccc3c(c2)OCCCO3)C(C)C)n1	22233993	GDCSCZXDQVPMIX-SFHVURJKSA-N	449.533	1.701	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](NS(=O)(=O)c1ccc2c(c1)OCCCO2)C(C)C	24607604	UPHLSBOMKXORDM-GOSISDBHSA-N	427.523	1.344	50	20	IDGD	
O=C(Cn1c(S)nnc1-c1ccc(Cl)cc1)NNC(=O)[C@H]1COc2ccccc2O1	26977035	LHRDMEAEBVIWJQ-OAHLLOKOSA-N	445.888	1.875	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)Cc1[nH]c(C(C)=O)c(C)c1C(=O)OC	726098128	WLHXTTYBOXEIMZ-UHFFFAOYSA-N	439.472	1.615	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NC[C@H]1CCN(c2ccc(F)c(F)c2)C1	726243584	AZFVVINVVLNLMQ-GFCCVEGCSA-N	437.472	1.613	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)NCc2cccc(C(=O)NCCN(C)C)c2)c1	727603916	KWYBAXXUDPUIHM-UHFFFAOYSA-N	441.532	1.504	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)N[C@@H](C)c2cccc(S(=O)(=O)N(C)C)c2)cc1	727608604	BFXZQMWQGCZJIK-HNNXBMFYSA-N	434.518	1.716	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)N[C@H](CN1CCN(C)CC1)c1ccccc1	727944516	DUNGOWUYJMZKKC-HXUWFJFHSA-N	425.533	1.557	50	20	IDGD	
CC(C)(C)CC(=O)NNC(=O)c1cccc(NS(=O)(=O)c2ccc3nnn(O)c3c2)c1	728607860	KHKFCPWNMGLASD-UHFFFAOYSA-N	446.489	1.667	50	20	IDGD	
COc1cc(C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)ccc1OCC(N)=O	728974528	SERDPHRDBKVYFI-UHFFFAOYSA-N	429.401	1.313	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)c2ccc(OCC(=O)NC(C)C)c(OC)c2)cn1	729692143	LDSZNFTVIDPZLD-UHFFFAOYSA-N	447.517	1.634	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)NCCS(=O)(=O)NCC3CCC3)cc2C1	731679376	JTBUBOBQSNNOAM-LBPRGKRZSA-N	428.580	1.536	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)NCc1ccc(OCCN2CCCC2)cc1	732244127	CFTSKKRXNKKKJD-UHFFFAOYSA-N	429.477	1.015	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCC2CCN(C(C)=O)CC2)cc1Br	732246967	YLQRTCQDACKKJM-UHFFFAOYSA-N	427.299	1.660	50	20	IDGD	
CC(=O)NCCNC(=O)CCC(=O)NNC(=O)c1cc2c(s1)CC[C@H](C(C)(C)C)C2	732258794	HOMWOKXAGSXUAX-HNNXBMFYSA-N	436.578	1.693	50	20	IDGD	
O=C(COC(=O)C1(c2cccc(F)c2)CCOCC1)NNC(=O)c1cccc([N+](=O)[O-])c1	732331536	DPHPXWLUDCHQLG-UHFFFAOYSA-N	445.403	1.787	50	20	IDGD	
CCc1nc(C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)nn1-c1ccccc1	735546455	MBKSNERCDKDYAY-UHFFFAOYSA-N	438.400	1.356	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N1CC[S@](=O)[C@@H](C)[C@H]1C	736649436	FFRWSGCSLSAETG-ZDIPAKHZSA-N	432.340	1.799	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)C2(c3ccccc3F)CC2)CC1	736684215	UPTHMBHZHOJSHU-UHFFFAOYSA-N	433.509	1.332	50	20	IDGD	
O=C(CCN1C(=O)CCc2ccccc21)NNC(=O)c1csc(N2CCOCC2)n1	737765240	CHQHNDUQMOZBJM-UHFFFAOYSA-N	429.502	1.110	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)[C@@H]1CC12CCN(C(=O)OC(C)(C)C)CC2	740843394	SIQKAXQHTHFNLP-ZDUSSCGKSA-N	426.514	1.696	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)C1CCN(C(=O)CCOc2ccccc2)CC1	740851131	ROXYLDFNICQLLX-UHFFFAOYSA-N	432.521	1.146	50	20	IDGD	
O=C(CCS(=O)(=O)c1ccc2c(c1)OCCCO2)NNC(=S)NCC1CCC1	741303552	LPBAMQXPFVSDMT-UHFFFAOYSA-N	427.548	1.307	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NCCCc2nc3ccccc3[nH]2)cc1	743519683	FSANABLMZHSGOT-UHFFFAOYSA-N	430.490	1.935	50	20	IDGD	
C[C@@H](CN1CCN(c2ccccc2)CC1)NC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	743632433	GRGUGXRNNNZEON-UWJYYQICSA-N	439.516	1.368	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)NC[C@@](C)(O)C2CC2)cc1	743776073	WNXZJTABPSJSDV-UUFSLDAJSA-N	437.500	1.618	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)CN2C(=O)[C@H]3CCCC[C@@H]3C2=O)cc1Cl	743834668	OWHJFIBRTHESDJ-QWRGUYRKSA-N	438.868	1.685	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)c2cccc(S(=O)(=O)NC(C)C)c2)c1	744458531	FTXQAOYVOMHREN-UHFFFAOYSA-N	433.486	1.300	50	20	IDGD	
CS(=O)(=O)c1cc(C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)ccc1Cl	744547479	FKNKTTUKLJDGIL-UHFFFAOYSA-N	435.845	1.233	50	20	IDGD	
COc1ccc(OCCC(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)cc1	744619932	AMYVSVCCOFWAFP-UHFFFAOYSA-N	435.502	1.628	50	20	IDGD	
COc1ccc(N2C[C@H](C(=O)OCC(=O)NNC(=O)c3cccc(C)c3)CC2=O)cc1	744665150	AXSOEKDXWKPOQC-MRXNPFEDSA-N	425.441	1.361	50	20	IDGD	
C[C@@H]1CN(c2ccc(C(=O)OCC(=O)NNC(=O)c3cccc(C#N)c3)cn2)C[C@@H](C)O1	744714115	APFFHTDKIXJCJI-HUUCEWRRSA-N	437.456	1.185	50	20	IDGD	
Cc1ccc(N2CCC[C@@H](NC(=O)NNC(=O)Cc3nc4ccccc4n3C)C2=O)cc1	745881939	RQNCTEFJHLLRAX-GOSISDBHSA-N	434.500	1.950	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)c1cc(Br)c2c(c1)OCCO2	746556223	NKPXSULAMXOYGZ-UHFFFAOYSA-N	431.246	1.872	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)N1CCC(C(=O)NNC(=O)Cc2ccncc2)CC1	747324582	CQOOHYMUQHGCRB-UHFFFAOYSA-N	430.892	1.986	50	20	IDGD	
O=C(NNc1ccc(F)cc1Br)[C@H]1CC(=O)N([C@H]2CCS(=O)(=O)C2)C1	748073771	YHLQOGGMIOSIAI-ONGXEEELSA-N	434.287	1.067	50	20	IDGD	
O=C(Cn1c(=O)cnc2ccccc21)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1	748520194	LPQIMNLQIYHKLC-UHFFFAOYSA-N	426.376	1.833	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)[C@@H]2CCCN2S(=O)(=O)c2cccs2)cc1C	749160261	IJBHPSHPPAUVLS-INIZCTEOSA-N	437.543	1.744	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)[C@H]2CCCN2C(=O)c2ccc3c(c2)OCO3)cc1C	749561455	LHQCVQOGBXGLFI-GOSISDBHSA-N	439.468	1.863	50	20	IDGD	
O=C(CCc1nc[nH]n1)NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2Cl)c1	750604703	MLGALPRKOIVFDS-UHFFFAOYSA-N	448.892	1.653	50	20	IDGD	
COc1ccc2c(C)c(CCC(=O)NNC(=O)CNC(=O)c3cccs3)c(=O)oc2c1	751209829	VWBIERUYHOGSKH-UHFFFAOYSA-N	443.481	1.682	50	20	IDGD	
COc1cc(OC)cc(N2C[C@H](C(=O)NNC(=O)c3ccc(OC)c(OC)c3)CC2=O)c1	752268138	KRKMALDOHDVITE-CQSZACIVSA-N	443.456	1.535	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)N[C@H]2CCCN(Cc3ccccn3)C2=O)cc1	753300187	UQCZXRVKBYSPAE-IBGZPJMESA-N	425.489	1.544	50	20	IDGD	
CN1C(=C(C#N)C(=O)COC(=O)c2ccc(CNS(C)(=O)=O)o2)N(C)c2ccccc21	754136368	WIEGSANMKKHAOP-UHFFFAOYSA-N	444.469	1.376	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1cccc(NC(=O)C2CCCCC2)c1	756887977	XPJHDEYDPOIEMW-LBPRGKRZSA-N	425.511	1.296	50	20	IDGD	
O=C(NCc1cc2c(cc1OC(F)F)OCO2)NNC(=O)c1ccc(-n2cnnn2)cc1	756914459	QPIKPAGLZLKBMZ-UHFFFAOYSA-N	447.358	1.137	50	20	IDGD	
COCc1nc2n(n1)C[C@@H](NC(=O)NNC(=O)c1sc(-c3ccccc3)nc1C)CC2	757772114	LLVBUXGSIUKDBM-AWEZNQCLSA-N	441.517	1.815	50	20	IDGD	
CNC(=O)Cn1nc(NC(=O)NNC(=O)[C@@H](C)Oc2c(C)cc(Cl)cc2C)cc1C	757824005	VWYKRPHXCAJMID-CYBMUJFWSA-N	436.900	1.828	50	20	IDGD	
O=C(NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)Nc1cccc2c1OCO2	757994981	KAPWWZMZVLSLJQ-UHFFFAOYSA-N	432.458	1.666	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)[C@H](Sc1ccc(F)cc1)c1ccccc1	758049229	YRIJIAOGNVMTIY-BLLLJJGKSA-N	425.507	1.744	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@H](NC(=O)NNC(=O)COc2ccc(C#N)cc2)[C@H](C#N)C1	758752245	MECSLELMWGWWLK-GDBMZVCRSA-N	428.449	1.027	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCCOc1ncccc1Cl	760714633	IJJFVVAABQOJKE-UHFFFAOYSA-N	440.913	1.360	50	20	IDGD	
COC(=O)c1cn([C@H]2CCCN(C(=O)NNC(=O)Cn3ccc4ccccc43)C2)nn1	762576146	CBLWVVXUDOPRRF-HNNXBMFYSA-N	425.449	1.097	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)NCc1cccc(N2CCCC2=O)c1	763464838	ZIYOLSYYCOSSQX-UHFFFAOYSA-N	433.509	1.949	50	20	IDGD	
CC(C)(C)Oc1cc(F)ccc1NC(=O)C(=O)NNC(=O)[C@@H]1COc2ccccc2O1	763572572	SCGGAYQTEQWIGG-KRWDZBQOSA-N	431.420	1.929	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)C(=O)Nc2cnn(-c3ccncc3)c2)c1	763594841	NAYXGQGZPRICIE-UHFFFAOYSA-N	436.472	1.864	50	20	IDGD	
CNC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)ccc1Cl	763604220	ISHXKHQMDOIIIY-UHFFFAOYSA-N	440.847	1.489	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cc(S(C)(=O)=O)ccc2C)c2ccccc2n1	763615166	BNKLMHKXYYXVPQ-UHFFFAOYSA-N	440.481	1.655	50	20	IDGD	
NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2cccc(C(F)(F)F)c2)cc1F	763641263	SBTBFTWKIACMAN-UHFFFAOYSA-N	442.325	1.108	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(C)c(NS(C)(=O)=O)c2)cc1C	763666149	CEFHMJUHXXXBLH-UHFFFAOYSA-N	448.501	1.148	50	20	IDGD	
COC(=O)c1c(NC(=O)C(=O)NNC(=O)c2cc(OC)cc(OC)c2)sc(C)c1C	763773438	XMPYUQUMXOIWLL-UHFFFAOYSA-N	435.458	1.568	50	20	IDGD	
O=C(CCSc1ccc(Br)cc1)NNC(=O)CNC(=O)c1cccnc1	763818112	AGMGXACEZFEIHK-UHFFFAOYSA-N	437.319	1.904	50	20	IDGD	
COC(=O)c1cc(F)c(F)cc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1cccc(C)c1C	763850747	PFHPIXAAKXHSEC-LBPRGKRZSA-N	449.410	1.922	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1Cl	763917219	RMGKWDFYRYHVBL-UHFFFAOYSA-N	429.824	1.114	50	20	IDGD	
O=C(NNC(=O)c1ccc[nH]1)C(=O)Nc1ccc(CC(=O)N2CCc3ccccc32)cc1	763980381	FGPULPKCYWLDFS-UHFFFAOYSA-N	431.452	1.546	50	20	IDGD	
O=C1C[C@@H](c2cccc(NC(=O)C(=O)NNC(=O)Cc3cccc4ccccc34)c2)CN1	764037562	ZBTDAYQWUFYKEH-GOSISDBHSA-N	430.464	1.772	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)[C@H]1CS[C@@H](Cc2ccccc2F)C(=O)N1	764049602	KQWGDWDJHMSLOP-PBHICJAKSA-N	449.529	1.614	50	20	IDGD	
CCc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3c2)cc1S(N)(=O)=O	764061918	OXETUNDTJAXRSF-UHFFFAOYSA-N	440.481	1.449	50	20	IDGD	
COC(=O)c1cc(Cl)cc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)c1	764117954	WCKODLFRDOLJRU-UHFFFAOYSA-N	426.212	1.885	50	20	IDGD	
CN(C)CCOc1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)cc1Cl	764164781	TTYPGLRUBPAZNB-SFHVURJKSA-N	446.891	1.370	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cnn(-c3cnc4ccccc4n3)c2)cc1	764177856	XCJIMHIQMJIXKK-UHFFFAOYSA-N	426.396	1.087	50	20	IDGD	
O=C(CCC1CCCCC1)NNC(=O)C(=O)Nc1ccc(S(=O)(=O)NC2CC2)cc1	764215411	RGINFMAMRCVYPX-UHFFFAOYSA-N	436.534	1.574	50	20	IDGD	
O=C(NNC(=O)c1cccc(OC(F)F)c1)C(=O)Nc1ccc(CN2CCCC2=O)cc1	764259714	MYDIPEFTGDQTBA-UHFFFAOYSA-N	446.410	1.810	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3ccn(C4CCCC4)n3)cc2)CC1	764322218	NZTLETAHIDFMPX-UHFFFAOYSA-N	432.550	1.691	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C(=O)Nc1ccc(C(=O)N2CCOCC2)cc1)c1ccccc1	764328008	ISEACFUTQHUKNL-IBGZPJMESA-N	438.484	1.439	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cnc4c(c3)c(C)nn4C)n[nH]2)cc1C	764388389	QYZSTSJUEDJSAR-UHFFFAOYSA-N	446.471	1.683	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1ccccc1CN1CCc2ccccc21	764397425	JKUBMUKWERMZDK-INIZCTEOSA-N	440.500	1.387	50	20	IDGD	
O=C(/C=C\c1nc2ccccc2s1)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765734612	AHDHRCQWGAZOKU-KHPPLWFESA-N	449.536	1.915	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)NCc2ccn(C)n2)cc1	765914867	SMMLAEXLNVXBQR-WJDWOHSUSA-N	433.472	1.391	50	20	IDGD	
O=C(NNC(=O)c1cnn2ncccc12)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	765973895	HUBUZQIHZFTJGK-UHFFFAOYSA-N	439.439	1.506	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)N[C@H]1CC(=O)N(c2ccc(Cl)c(F)c2)C1	766555325	YDJMEWXLSHCCIR-GTNSWQLSSA-N	448.838	1.755	50	20	IDGD	
O=Cc1cccc(OCC(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)c1	766661504	WNULFWRSYDNNJB-UHFFFAOYSA-N	444.919	1.497	50	20	IDGD	
C[C@H](OC[C@H]1CCCO1)C(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	766670327	XMQHKSIEJDBSAI-FUHWJXTLSA-N	438.956	1.189	50	20	IDGD	
CCc1nn(C)c(Cl)c1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	767187446	REHYXMODHHCBOZ-UHFFFAOYSA-N	439.925	1.495	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CCC(=O)c2ccc3c(c2)CCC(=O)N3)cc1C	767250310	TWYYUVYJIXJZNO-UHFFFAOYSA-N	436.468	1.937	50	20	IDGD	
COc1ccc(OCC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)cc1C	767959596	AXNFYQPTKILTSH-UHFFFAOYSA-N	448.545	1.462	50	20	IDGD	
COC(=O)C[C@]1(NC(=O)CCC(=O)C(C#N)=C2N(C)c3ccccc3N2C)CCOC1	768546457	CESXYPUZOWQXEW-JOCHJYFZSA-N	426.473	1.495	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)[C@@H]1CCCN1C(=O)OCC(F)(F)F	768612505	NUOYTQPASBQNHJ-JTQLQIEISA-N	439.412	1.705	50	20	IDGD	
NS(=O)(=O)c1ccc(C(=O)NNC(=O)COc2ccccc2-c2ccccc2)c(F)c1	769738042	GBBKUVUWKJOCHC-UHFFFAOYSA-N	443.456	1.980	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)c2ccc3nc(C(F)(F)F)cn3c2)c2ccccc2c1=O	770207182	CQBFTXXLQZSNQJ-UHFFFAOYSA-N	430.346	1.675	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)[C@]3(O)CCN(Cc4ccccc4)C3)nc21	770957783	FNSWCDVVPWWQAX-NRFANRHFSA-N	425.493	1.367	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNS(=O)(=O)c1ccc(Cl)c(C(=O)O)c1	771606896	YVQFDHXNWXYHQY-UHFFFAOYSA-N	446.268	1.318	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1ccc(Cl)c(S(=O)(=O)N2CCCCC2)c1	771880577	HSTBZVMZZRQLNJ-GFCCVEGCSA-N	445.925	1.617	50	20	IDGD	
CNC(=O)COc1cccc(CC(=O)NNC(=O)c2ccc(Br)s2)c1	772044888	BFIAABURNIIBGK-UHFFFAOYSA-N	426.292	1.639	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)CCC[C@@]1(C)NC(=O)NC1=O	772710127	ZTGTXNRAORUZQQ-BMLIUANNSA-N	441.282	1.132	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)Cc1cccc(NS(C)(=O)=O)c1	772964509	RXUGQBVXOOYPQD-GFCCVEGCSA-N	425.894	1.869	50	20	IDGD	
Cc1ccc(CCC(=O)NCC(=O)NNC(=O)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1	773413081	ZUQJCAOCYWAHNW-GOSISDBHSA-N	446.548	1.838	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cnn1C1CCCC1	773531136	KQSJPYRFSAZLIQ-UHFFFAOYSA-N	437.460	1.598	50	20	IDGD	
COC(=O)c1ccc(-n2cc(C)cn2)c(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2)c1	773644015	VNPGZFMBEIHJCC-UHFFFAOYSA-N	438.400	1.957	50	20	IDGD	
Cc1ccc(N(C)S(=O)(=O)c2cccc(C(=O)NNC(=O)N3CCN(C)CC3)c2)cc1	773672766	JFCBEWDXPKAXKO-UHFFFAOYSA-N	445.545	1.422	50	20	IDGD	
O=C(NNc1ncccn1)C(=O)Nc1ccc(CCn2nnc(-c3ccccc3)n2)cc1	773718816	GQSIVZSYPINFGJ-UHFFFAOYSA-N	429.444	1.455	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NN=C3CCO[C@@H](C(C)C)C3)CC2)cc1	776777501	SRNVXIJDUOMRSB-HXUWFJFHSA-N	436.578	1.609	50	20	IDGD	
COCCO[C@H]1COCC[C@@H]1NC(=O)CCC(=O)C(C#N)=C1N(C)c2ccccc2N1C	777395201	UYJDELJKBYMWDQ-UWJYYQICSA-N	442.516	1.594	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)Nc1ccnn1Cc1ccc(C(F)(F)F)cc1	779465819	KDTVVZXAODBHSV-LBPRGKRZSA-N	445.423	1.538	50	20	IDGD	
CSc1ccccc1S(=O)(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1	780365350	LLUIAGFMSVDPQG-UHFFFAOYSA-N	443.572	1.347	50	20	IDGD	
O=C1CN(CCNC(=O)C(=O)Nc2ccccc2S[C@H](Cl)C(F)(F)F)CCN1	781541751	ORCFCSJYXRLBRV-HNNXBMFYSA-N	438.859	1.392	50	20	IDGD	
COc1nccnc1NNC(=O)CCc1c(C)nn(-c2ccc(S(N)(=O)=O)cc2)c1C	781981175	IBULYMCBSPSQNY-UHFFFAOYSA-N	445.505	1.011	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2cn(C)nc2C(F)(F)F)cc1	782803422	ZLYYXNAGHCQQHT-UHFFFAOYSA-N	448.427	1.221	50	20	IDGD	
CC(C)CCc1ccccc1NC(=O)C(=O)NNC(=O)c1csc(N2CCOCC2)n1	782897386	OMVCQGQDWIFSFO-UHFFFAOYSA-N	445.545	1.968	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2ccc(NC(=O)NC[C@H]3CCCO3)cc2)nc(C)n1	783325115	SRSSNXBACCKVMX-MRXNPFEDSA-N	427.465	1.476	50	20	IDGD	
Cc1nc2cc(NC(=O)C(=O)NNc3ccc(S(=O)(=O)NC4CC4)cc3)ccc2n1C	784210189	HHKYCCGXOSMHIN-UHFFFAOYSA-N	442.501	1.404	50	20	IDGD	
COC(=O)c1cc(Br)c(F)cc1NC(=O)C(=O)NNc1cccc(OC)n1	784845769	AIFFGXGVMHBDJI-UHFFFAOYSA-N	441.213	1.860	50	20	IDGD	
NC(=O)C1CCN(c2ccccc2NC(=O)C(=O)NNc2cc(F)c(F)cc2F)CC1	784891745	AEFDYOXCLMEAHR-UHFFFAOYSA-N	435.406	1.887	50	20	IDGD	
CCOC(=O)c1cn(C)nc1NC(=O)C(=O)NNc1nc2ccc(OC)cc2cc1C	785163694	ZOAMEFVEBMUHKU-UHFFFAOYSA-N	426.433	1.544	50	20	IDGD	
COC(=O)c1cc(C)ccc1NC(=O)C(=O)NNc1c(OC)cccc1S(C)(=O)=O	785330722	KTNDQYWVLLWELD-UHFFFAOYSA-N	435.458	1.276	50	20	IDGD	
CCOC(=O)Cc1cccc(NC(=O)C(=O)NNc2c(OC)cccc2S(C)(=O)=O)c1	785338715	NPDOHFODKLJHQO-UHFFFAOYSA-N	449.485	1.286	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2nc(Br)ccc2C)n1	786389960	RSEUMSZCARJYCK-UHFFFAOYSA-N	427.280	1.464	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)COc1ccc(I)cc1	788159329	WAAMEYXQANTVQJ-UHFFFAOYSA-N	436.246	1.607	50	20	IDGD	
CCNC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)COc2cccc(C)c2)c1C	789733022	WTTWAUWKCVZVNP-UHFFFAOYSA-N	427.461	1.610	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)C(=O)Nc1nc([C@@H]2C[C@H]3CC[C@H]2C3)cs1	789758443	UNXWWSOXWYKJDG-SDDRHHMPSA-N	431.474	1.156	50	20	IDGD	
CC(C)[C@H](NC(=O)C(F)(F)F)C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	789866843	GPZCPIDMKAWHBK-KRWDZBQOSA-N	443.470	1.049	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)c1cc(S(=O)(=O)N2CCCCC2)ccc1C	790066020	WCKAJHCNQOPTMF-UHFFFAOYSA-N	441.550	1.720	50	20	IDGD	
O=C(NCc1ccc(S(=O)(=O)N2CCCCC2)cc1)NNc1nc2ccccn2n1	790119883	DDJUDIDVHZFMCF-UHFFFAOYSA-N	429.506	1.730	50	20	IDGD	
CSSCCNC(=O)N1CCN(S(=O)(=O)c2cc([N+](=O)[O-])ccc2C)CC1	790877226	XPPZVEXXTCJVLN-UHFFFAOYSA-N	434.565	1.930	50	20	IDGD	
Cc1cccnc1NNC(=O)Nc1ccc(S(=O)(=O)N[C@H]2CCS(=O)(=O)C2)cc1	792219324	XRHQDKQTZBWHMN-AWEZNQCLSA-N	439.519	1.004	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2cc3c[nH]nc3cc2C)n[nH]1	792266341	QDZZPQXVYWQXFD-UHFFFAOYSA-N	433.428	1.670	50	20	IDGD	
CNC(=O)c1cc2cc(NC(=O)C(=O)NNC(=O)c3cccc(C(F)(F)F)c3)ccc2[nH]1	792355885	WSAPXZLXWPSVKA-UHFFFAOYSA-N	447.373	1.946	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)C(=O)Nc1cccc(Cl)n1	793023074	HCLLAVDFUZLUDQ-UHFFFAOYSA-N	430.896	1.033	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)C(=O)Nc1cccc(-c2cccc(Cl)c2)c1	793024864	GYJGRNJKGZPAPV-NSHDSACASA-N	438.893	1.031	50	20	IDGD	
CC(C)(C)OC(=O)N1CCc2c(ccc(NC(=O)C(=O)NNc3ncccn3)c2F)C1	793030026	WSAJJUDGGSAEAA-UHFFFAOYSA-N	430.440	1.991	50	20	IDGD	
CSCC[C@@H](NC(=O)c1ccco1)C(=O)NNc1ccccc1S(=O)(=O)N(C)C	795168824	FEMINBPNTQGXSS-CQSZACIVSA-N	440.547	1.525	50	20	IDGD	
CNC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)c2cc(C)nc3ccccc23)c(C)c1	796991186	AAZVJQMPICFWDL-UHFFFAOYSA-N	449.467	1.376	50	20	IDGD	
CCn1cc(C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c(C(F)(F)F)n1	797935037	WFXMMYZWEVZXLF-UHFFFAOYSA-N	429.311	1.448	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)C2(c3cncc(Br)c3)CC2)c1	798392389	VYRQAUXQAYWVAN-UHFFFAOYSA-N	438.303	1.740	50	20	IDGD	
CNS(=O)(=O)c1ccccc1S(=O)(=O)NNC(=O)c1cc2c(s1)CC[C@H](C)C2	799519943	AUFABRKNNQDNPP-NSHDSACASA-N	443.572	1.404	50	20	IDGD	
C[C@@H](Sc1ccccc1C(=O)OCC(=O)NNC(=O)c1cccc(C#N)c1)C(N)=O	801487073	MGHRGMQOSAQJAG-GFCCVEGCSA-N	426.454	1.142	50	20	IDGD	
COc1ccc(Cl)c(NC(=O)NNC(=O)[C@H](C)N2C(=O)[C@H]3[C@H](C2=O)[C@H]2CC[C@H]3O2)c1	802114073	PJOVEVNLABPGDZ-LMYWXWJPSA-N	436.852	1.052	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)N[C@H]1CCN(C(=O)Nc2ccccc2)C1	802499988	JIDQYRYQYKCVAE-HNNXBMFYSA-N	442.432	1.610	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N2CCOC[C@H]2[C@H]2CCCO2)cc1Br	805104482	SRDJBXRFJNEOID-DZGCQCFKSA-N	428.283	1.692	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)C3CCN(CC(F)F)CC3)cc2)CC1	806781286	AVAQOIFMGJCFHF-UHFFFAOYSA-N	445.536	1.043	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)C(=O)Nc3cccc4c3CNC4=O)n[nH]2)c1	807020630	ADTWHACNBKPIGW-UHFFFAOYSA-N	432.440	1.337	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)CNS(=O)(=O)c1cccnc1	809979023	LFODXEPSABVLPG-UHFFFAOYSA-N	431.499	1.253	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)C(=O)Nc2c3c(cc4c2CCC4)CCC3)c2ccccc2c1=O	810386133	MZALJULKRJECQD-UHFFFAOYSA-N	445.479	1.311	50	20	IDGD	
O=C(COC(=O)[C@@H]1CCN(c2ccccc2F)C1)NNC(=O)[C@@H]1COc2ccccc2O1	811378639	RUYBPTAMSLJBAF-KUHUBIRLSA-N	443.431	1.183	50	20	IDGD	
Cc1nnc(CCNC(=O)NNC(=O)[C@@H](C)Oc2cccc(Br)c2)s1	811853240	RFYRXZRCPUOPJI-SECBINFHSA-N	428.312	1.949	50	20	IDGD	
COc1ccc(CNC(=O)NNC(=O)c2ccc3ccccc3n2)cc1S(N)(=O)=O	812429227	HPYQSUWCKLPEFT-UHFFFAOYSA-N	429.458	1.035	50	20	IDGD	
Cc1cc(CNC(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)cc(N2CCCC2)n1	812540715	UNAAHMCXVGFQMJ-UHFFFAOYSA-N	447.565	1.898	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccc(Br)nc2)cc1	813033618	BUPVAADPFKXYML-UHFFFAOYSA-N	442.295	1.176	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCc2cc3ccccc3n(C)c2=O)c2ccccc2c1=O	813835502	RPAAAJJMVBQHCC-UHFFFAOYSA-N	446.467	1.413	50	20	IDGD	
CCOC(=O)[C@@H](CC(=O)NNC(=O)[C@@H](C)Oc1cccc(Br)c1)C(C)=O	816828549	IQZOWYJPJGSFLS-RISCZKNCSA-N	429.267	1.522	50	20	IDGD	
CN(C)CCc1ccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc1	816829897	IYIUDJHSAUFDPY-UHFFFAOYSA-N	444.557	1.650	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)c1cccc(OC[C@H]2CCCO2)c1	844256637	DJWVUXZRBNAZBX-MRXNPFEDSA-N	432.502	1.612	50	20	IDGD	
O=C(C1CCN(S(=O)(=O)c2c(Cl)cccc2Cl)CC1)N1CC[C@@H](B(O)O)C1	864232940	DISZRABPXIWYPG-GFCCVEGCSA-N	435.138	1.469	50	20	IDGD	
CCOc1ccc(N(C)S(=O)(=O)c2ccc(C)c(C(=O)N3CC[C@@H](B(O)O)C3)c2)cc1	864234414	VAPSYOFHIWIXKF-MRXNPFEDSA-N	446.334	1.908	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)c2c[nH]nc2-c2ccc3c(c2)OCCO3)c1	915077257	XEOCUABIIAGZLC-UHFFFAOYSA-N	442.453	1.326	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)NCCCN2CCN(c3ncccn3)CC2)c1	916267126	DOMLORLSMWUOGE-UHFFFAOYSA-N	441.536	1.015	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)NCC[C@](O)(c2nccn2C)C(F)(F)F)c1	916378283	LMWWPVWTLYGSJA-SFHVURJKSA-N	443.426	1.586	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)NNC(=O)Cc2ccc3ccccc3c2)ccc1OC	917195390	KZUJAFHCJZMWIP-UHFFFAOYSA-N	427.482	1.760	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)c1ccccc1SCc1cn2ccccc2n1	918208630	DLQSTOVVCGIGEM-AWEZNQCLSA-N	444.538	1.822	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)C(=O)c1cnn(C(C)(C)C)c1	919439933	UVVQCFCJGGLSBF-UHFFFAOYSA-N	436.852	1.487	50	20	IDGD	
NC(=O)c1csc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)c1	919687318	QTLSJIWYTSPEHY-UHFFFAOYSA-N	436.515	1.096	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccc(C)s1	919822555	VUSIRZPMBZELJO-OAHLLOKOSA-N	437.543	1.608	50	20	IDGD	
C[C@H]1CN(Cc2cccc(CNC(=O)NNC(=O)COc3ccccc3F)c2)CCO1	920236759	GGACSXBCQWCVOM-INIZCTEOSA-N	430.480	1.956	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)NNC(=O)COc2ccc(F)cc2)cc1OC	920932860	FASJROJGIASUFS-UHFFFAOYSA-N	440.453	1.828	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNS(=O)(=O)c1cnn(-c2ccccc2)c1	921018057	WXGQMRQAPGZOOH-UHFFFAOYSA-N	448.530	1.097	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)C1=CC=CN2CCS(=O)(=O)N=C12	921236563	XZNFDPHFGUDVRJ-CQSZACIVSA-N	440.481	1.252	50	20	IDGD	
C[S@](=O)CCCNC(=O)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1	1121903530	SGTGQBAJHVYRKX-WRGVRERRSA-N	428.558	1.713	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCCNC(=O)NNC(=O)c2cncn2-c2ccccc2)cc1	1319026135	RSQILDWOMRTNSL-UHFFFAOYSA-N	442.501	1.103	50	20	IDGD	
CCN1CCOC[C@@H]1C(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	1335336306	JZGPNPGWABDJGS-OAHLLOKOSA-N	438.531	1.031	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(C(=O)CCC(=O)NNc3ccc(F)cc3)CC2)cc1	1337254168	LWLMVJYYCHSUHS-UHFFFAOYSA-N	448.520	1.891	50	20	IDGD	
COc1ccc([N+](=O)[O-])c(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](F)Cl)C3)n1	1778376275	KZMXSFKCZAHELL-CDHAZOANSA-N	444.847	1.660	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(CCN(C(=O)c3ccc4cccnc4n3)C2)C1	1778430518	BCQGMCAYVZDAIG-IBGZPJMESA-N	433.306	1.858	50	20	IDGD	
CC(=O)O[C@H](C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2)C(C)C	1778792326	NSSWZYHCXPMPKQ-DHSIGJKJSA-N	433.343	1.435	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc([N+](=O)[O-])c4c3OCO4)C2)C1	1780237499	PJEIHZHFSDQDPM-ORAYPTAESA-N	439.852	1.784	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)C3(Br)CC3)CCO2)C1	1781234512	NUPCLNPHFSNSPK-KGLIPLIRSA-N	428.154	1.980	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cncn1C)C2	1781900505	RJVGYFPTQVKAFR-DDUZABMNSA-N	427.343	1.721	50	20	IDGD	
O=C1CCc2ccc(C(=O)N3CC[C@@]4(C3)CN(C(=O)[C@H](F)Br)CCO4)cc21	1782313337	VBLVKRHIJZKPRE-QFBILLFUSA-N	439.281	1.950	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)/C=N/O[C@@H]3CCCCO3)CCO2)C1	1783349549	NGOMCZOXSLOACD-QAXHHPHWSA-N	446.342	1.519	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)CCc3ccc4c(c3)OCO4)CCO2)C1	1783876066	LRXLDKAPVADEJT-KKSFZXQISA-N	438.908	1.432	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)/C=C/c3ccc(OC)cc3F)CCO2)C1	1783879352	QOHRSOCJPPVCNP-RKUWUGLRSA-N	440.899	1.931	50	20	IDGD	
Nc1c(C(=O)N2CCO[C@@]3(CCN(C(=O)C(Cl)Cl)C3)C2)sc2nccnc12	1783947466	UPTAQLMBHVOOPS-MRXNPFEDSA-N	430.317	1.521	50	20	IDGD	
O=C(COc1cccnc1)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1	1786756721	BLNNQFPHBJAEHT-UHFFFAOYSA-N	445.284	1.588	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C[C@H](N)c3cccnc3)[C@H]2C1	1786929695	FAQFVVCKIVBQMG-VJANTYMQSA-N	434.613	1.303	50	20	IDGD	
Cc1nnc(CC(=O)Nc2ccc(C3(NC(=O)c4ccc(B(O)O)cc4)CCC3)cc2)o1	1788193659	SHYUBJKUWWHTGJ-UHFFFAOYSA-N	434.261	1.048	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(C(F)(F)F)[nH]3)[C@H]2C1	1788795238	KWUHBTZBOSCDAX-FMSGJZPZSA-N	437.846	1.881	50	20	IDGD	
COC(=O)c1ccc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)C(Cl)Cl)C[C@@H]32)s1	1789690515	MLZRXXSMXHWAIQ-DRZSPHRISA-N	449.356	1.861	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1)c1ccc(F)nc1	1789712706	QBVBPAQIKXUGQF-UHFFFAOYSA-N	433.248	1.962	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc4ncccc4[nH]3)[C@H]2C1	1790336885	JYKQXAKPTKZIPP-XREXNNHRSA-N	435.322	1.940	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1ccc2ccoc2c1	1790395509	MASAUNYCAPWKTR-VCOUNFBDSA-N	448.284	1.020	50	20	IDGD	
CCOC(=O)O[C@@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](Br)CC)[C@H]2C1	1790964757	YSESTTZSEGTQBK-YTFOTSKYSA-N	449.342	1.701	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCN3CCCC3)[C@H]2C1	1792314591	XXRNDIOGMHKOQF-QAETUUGQSA-N	430.387	1.626	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc3c1OCC3)C2	1792867667	FNYCXSUOSCGEMV-FAYQHZLMSA-N	437.334	1.856	50	20	IDGD	
C[C@H](CBr)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](O)NC(=O)OC(C)(C)C)C2	1792990639	BSQIYQCEBFTNDS-ZHZXCYKASA-N	448.358	1.499	50	20	IDGD	
CC(=O)N[C@@](C)(C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCl)c1ccccc1F	1793115142	AHWCJKAXBDROCP-TZRWPXCGSA-N	439.915	1.415	50	20	IDGD	
O=C(COc1ccc(Cl)c(F)c1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2	1793292653	WRNWZYYRRCMKCC-VODVUFLWSA-N	435.279	1.047	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(S(C)(=O)=O)cn1)C2	1793445483	JTSOXKVBHSOOBQ-YXPYIKCWSA-N	443.953	1.096	50	20	IDGD	
CS(=O)(=O)c1cncc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CCBr)C3)c1	1794623547	OVADQVTYTPBBBE-BTTYYORXSA-N	444.351	1.522	50	20	IDGD	
COc1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)s1	1794638841	NHRKQTKGVVYZPT-CLLJXQQHSA-N	429.502	1.321	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1cccc2c[nH]nc12	1796183446	WBBGIXPXGFNUOZ-NDPMZMCLSA-N	425.258	1.457	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)c1ccccc1OC(F)F	1796190681	XUZCFWHUSNDTQD-BJWYYQGGSA-N	444.243	1.533	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)c1cccc(C(F)(F)F)n1	1796191966	VUTRXVRFNXXLJC-MUJYYYPQSA-N	447.222	1.346	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cc1cnc(C)s1)C2	1796892957	AUAQFQGGVLSCKW-XMOXNHLCSA-N	442.545	1.766	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H]1CNc3ccccc31)C2	1798439254	SQAPOBZKPUAMAH-BASYENTBSA-N	434.500	1.146	50	20	IDGD	
Cc1cc(C(=O)NCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](C)CBr)C3)no1	1798504933	CGVPKLJMRHZKMV-DEQVHRJGSA-N	441.326	1.382	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@](C)(Cl)CCl	1799273528	JTGOJTCRIBKRRO-OVKLUEDNSA-N	430.170	1.843	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cn3ccsc3n1)C2	1799276303	IUEKDQHVEIMERD-QTFJUKGGSA-N	431.345	1.835	50	20	IDGD	
CCOc1cnc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@](C)(Cl)CCl)cn1	1799277746	XATHINVCGJHXBC-TYYYEBLRSA-N	431.320	1.315	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc[nH]c3nccc1-3)C2)[C@H](F)Br	1799346150	FPUHEPNLQALZHM-DJBIQUGXSA-N	425.258	1.408	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COc1ccccc1F)C2)[C@@H](F)Br	1799347667	ULIYKFMGUURSNX-OXUXUCFPSA-N	433.249	1.485	50	20	IDGD	
CC(C)(C)OC(=O)N[C@]1(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](F)Cl)C3)CCOC1	1800139864	DKNNLAVJNRJSJP-QEAYJNAZSA-N	433.908	1.843	50	20	IDGD	
Cc1cc(C)n2ccc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)C(Cl)Cl)c2n1	1801016410	AGAHNVOSZKSWIW-AGGWBTHJSA-N	425.316	1.958	50	20	IDGD	
Cc1ccc2oc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)CCC(=O)NN(C)C)cc2n1	1802333140	LJJHISWGQXZUPK-MUJYYYPQSA-N	427.505	1.761	50	20	IDGD	
C[C@H](C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1)C1(O)CCC1	1802469725	VHOTWNUXSFXNEW-MMOPVJDHSA-N	445.564	1.012	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCc1ccccc1F	1803254220	SMWRSPLSCFBLFU-BJWYYQGGSA-N	439.491	1.709	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H](CNC(=O)CN2CCOC2=O)[C@H]1c1cccnc1	1803337168	NCBAPFLAKOHCQU-OGWOLHLISA-N	443.331	1.776	50	20	IDGD	
C[C@H](CC(N)=O)C(=O)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@H]1c1cccnc1	1803672650	ZEBZGHOZGALKIX-WCUVEOEZSA-N	429.290	1.289	50	20	IDGD	
CS(=O)(=O)c1ccc(Cl)c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](O)CCl)C3)c1	1803978457	BWIIOXGPUAJERS-BUWBCJGYSA-N	449.356	1.595	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)[C@@H]1COc2ccccc2O1	1804195871	JGMZWRQOGPYNJG-ACZWYYKOSA-N	445.903	1.527	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCN1CCCC1	1804534813	RJDYXMJSWUKLTD-DPEPCVEMSA-N	428.537	1.245	50	20	IDGD	
Cc1cc(C(=O)NC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)c(C)o1	1805566849	MXKQHCZNXUMHRA-PGRDOPGGSA-N	441.532	1.984	50	20	IDGD	
O=C(CCBr)NC[C@H]1CCN(C(=O)COc2cccnn2)[C@@H]1c1cccnc1	1806347105	SXJCTPZIQDNVLY-DNVCBOLYSA-N	448.321	1.741	50	20	IDGD	
CC1=CC[C@H](C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)CC1	1807363543	OZVZHKYVPQGBGX-XKCSPQBFSA-N	447.344	1.827	50	20	IDGD	
CC(C)=CCCC(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1807373143	NGWKONIVGBMFBA-REWPJTCUSA-N	435.333	1.827	50	20	IDGD	
C[C@H](CC(N)=O)C(=O)N1CC[C@H](CNC(=O)[C@@](C)(Cl)CCl)[C@@H]1c1cccnc1	1808289582	FQCNMTXEKBGLBV-FYHWNKSOSA-N	429.348	1.835	50	20	IDGD	
Cc1cc2nnc(C(=O)N3CC[C@H](CNC(=O)[C@H](F)Cl)[C@H]3c3cccnc3)c(C)n2n1	1808312837	JXAKRKQUXGCMHI-OLMNPRSZSA-N	445.886	1.990	50	20	IDGD	
O=C(CC[C@@H]1CCOC1)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1	1809972115	BXCNTUARTXFHIS-GOSISDBHSA-N	428.338	1.028	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)/C=C\C(=O)NC2CC2)[C@H]1c1cccnc1	1810134951	SCNQTLZETLGGMK-PWCCKZLBSA-N	434.924	1.176	50	20	IDGD	
C[C@H](Cn1cncn1)C(=O)NC[C@@H]1CCN(C(=O)C(Cl)Cl)[C@@H]1c1cccnc1	1810480026	LWVYWRZTIPWUNY-VHDGCEQUSA-N	425.320	1.819	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1CCN(C(=O)c2cc(CO)on2)[C@@H]1c1cccnc1	1810543503	CVDGTULWSHKNEA-HNAYVOBHSA-N	432.553	1.733	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1CCN(C(=O)c2cc[n+]([O-])cc2)[C@@H]1c1cccnc1	1810543946	IBEGVGNEMDTHBG-AZUAARDMSA-N	428.565	1.886	50	20	IDGD	
CSCC[C@H](O)C(=O)N1CC[C@H](CNC(=O)[C@H](C)Br)[C@@H]1c1cccnc1	1812868016	RAUKRSFWMZVQQN-UKMLZYKCSA-N	444.395	1.985	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)C2CC(C)(C)C2)[C@@H]1c1cccnc1	1813074386	QLMDCYUDZSQSQJ-LAUBAEHRSA-N	429.565	1.897	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H]3CCC(=O)N3)sc2C1	1814040085	BINAQLJPWUNRPC-NGZCFLSTSA-N	429.340	1.365	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](O)c2ccco2)n[nH]1	1814463686	IYGPHSCDIGGRMM-IFXJQAMLSA-N	432.481	1.101	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1ccnc(F)c1	1815418906	HNAGQTXXXDNIMJ-QGZVFWFLSA-N	437.240	1.243	50	20	IDGD	
Cn1cc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@@H](O)CCl)CC3)c2cccnc21	1819428292	OSIMXEWKNXKWIQ-HZMBPMFUSA-N	433.921	1.855	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccnnc3O)sc2C1	1821101654	AGRDNAUFZBYVOZ-HTQZYQBOSA-N	426.296	1.648	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnnc(Cl)c2)[nH]n1	1822410914	RZKNADGOWFWWGL-AWEZNQCLSA-N	448.915	1.532	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)C2CCC(O)CC2)n[nH]1	1822552769	QKRRVOIZWXBBIN-VMBOVVBDSA-N	434.541	1.326	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)C(O)O)CC2	1824799917	CWLNDKMCEWNFRQ-DJTWPOEFSA-N	434.424	1.251	50	20	IDGD	
O=C(C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1)c1ccco1	1825057367	KTPBHWMSKRWETD-LJQANCHMSA-N	438.289	1.076	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccns2)CC1	1825677065	WOVHULPPRCJHMM-QGZVFWFLSA-N	442.545	1.689	50	20	IDGD	
Cc1ncsc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1	1825990802	WKAXCURDXAXJLS-LJQANCHMSA-N	441.362	1.678	50	20	IDGD	
C[C@H](C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2)n1cccc1	1826589198	ZLSNBSIKXVCVJH-CZUORRHYSA-N	438.318	1.111	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)CN3C(=O)CSC3=S)sc2C1	1828247172	NKRRDURLXKQYSC-RKDXNWHRSA-N	447.007	1.933	50	20	IDGD	
CC(C)[C@@H](S)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1	1828923553	LRQFUZLLMUCASO-RTBURBONSA-N	447.605	1.873	50	20	IDGD	
CCc1[nH]nc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)c1Cl	1830357950	NPPFGZOMEZNERM-LJQANCHMSA-N	447.363	1.961	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3[nH]nc4ncccc34)C2)C1	1831646975	PFWFKOAANCVVOY-QRWLVFNGSA-N	435.912	1.435	50	20	IDGD	
Cc1cccc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)n1	1831871402	DGGVITQESVCQIJ-FQEVSTJZSA-N	429.565	1.996	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)CN3CCCC3)CC2)CC1	1833102751	DYEVLXBAZCDAEO-OAHLLOKOSA-N	429.403	1.437	50	20	IDGD	
CC(C)N1CCC(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)CC1	1833697433	UUHGGZWNPRWCOV-FQEVSTJZSA-N	443.032	1.278	50	20	IDGD	
Cc1c(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)cnn1C	1834426427	XVUDRCQTAGDQET-ZWKOTPCHSA-N	433.336	1.035	50	20	IDGD	
CCNC(=O)N[C@@H](C)C(=O)NC1CCN(C2CCN(C(=O)C(Cl)Cl)CC2)CC1	1835711403	MIBVGNYARHBLKD-LBPRGKRZSA-N	436.384	1.069	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC1CCN(C2CCN(C(=O)CCc3ncc[nH]3)CC2)CC1	1835837345	CIHJBYDETZMOCP-UHFFFAOYSA-N	435.645	1.765	50	20	IDGD	
CC(C)c1cc(C(=O)NC2CCN(C3CCN(C(=O)[C@H](O)CCl)CC3)CC2)on1	1836179466	XRSQXSAYTZBSTP-QGZVFWFLSA-N	426.945	1.583	50	20	IDGD	
C/C(=C/C(=O)N1CCC(N2CCC(NC(=O)[C@@H](F)Br)CC2)CC1)C(=O)O	1836414632	VELLEZIRJQGUIB-JQPIKURYSA-N	434.306	1.279	50	20	IDGD	
COc1cccc(CC(=O)N2CCC(OC3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)n1	1836715663	WHPUOKVFOZAXBA-SFHVURJKSA-N	439.940	1.231	50	20	IDGD	
O=C(c1ccc2c[nH]nc2c1)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836718069	RHHKVMPJKVJCAG-LJQANCHMSA-N	434.924	1.775	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccn4ccnc34)CCO2)C1	1836995027	GLQDRPGTOMQUAM-LAUBAEHRSA-N	434.924	1.812	50	20	IDGD	
C=CC[C@H](C(=C)C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1837311080	YSKHYDKZQURQLS-VKJFTORMSA-N	433.318	1.902	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)/C=C3\C(=O)Nc4ccccc43)CCO2)C1	1837325581	WYHYKXYFXINCES-APJKMFDXSA-N	447.919	1.496	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)o1	1837448156	BGOSEEUPRGCLOV-FQEVSTJZSA-N	441.912	1.573	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3sccc3OC)CCO2)C1	1838299327	HDMGKIAUMRUTCL-SCLBCKFNSA-N	432.926	1.081	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccoc3Cl)CCO2)C1	1838845323	NBHYGYLVQSJPPN-BDJLRTHQSA-N	435.702	1.786	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(C#N)c3)CCO2)C1	1838908580	ILRBIPQVKMXRBF-AUUYWEPGSA-N	436.306	1.412	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(C)nc3OC)C2)C1	1839145856	GDGODHLJGOUKKN-OXQOHEQNSA-N	425.913	1.486	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4c(c3)CNC4=O)C2)C1	1839145984	SNVUJYNIUDFAIR-DYESRHJHSA-N	435.908	1.017	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1	1839147573	VWYRDEPOEUOUPA-YJYMSZOUSA-N	447.315	1.839	50	20	IDGD	
O=C(/C=C/c1cccs1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839198764	ATRDKQAMUDJZBZ-PKOQZONYSA-N	447.326	1.908	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccccc3O)C2)C1	1840035445	RNWIELOXMFUZOT-KUHUBIRLSA-N	441.322	1.175	50	20	IDGD	
O=C(c1cccc2nccn12)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840189699	HUDWLFFVPNQDIR-GOSISDBHSA-N	427.288	1.208	50	20	IDGD	
O=C(c1cnn2cccc(F)c12)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840189848	ORIJDNVTGJKLQP-SFHVURJKSA-N	445.278	1.347	50	20	IDGD	
Cc1nn2cc(CC(=O)N3CC4(CCCN4C(=O)[C@@H](C)CBr)C3)nc2s1	1841285559	BXOCWNZJMPMIMX-NSHDSACASA-N	440.367	1.876	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)Cc2noc(C)n2)C1	1842029250	KRLINDZUKPQBHX-UHFFFAOYSA-N	443.416	1.271	50	20	IDGD	
Cn1nc(C(=O)N2CCCC23CN(C(=O)[C@@H](Br)Cc2ccccc2)C3)cc1O	1842192423	CIROVWCBDPAQNL-HNNXBMFYSA-N	447.333	1.949	50	20	IDGD	
CS(=O)(=O)c1ccc(CC(=O)N2CC3(CCCN3C(=O)CCBr)C2)cc1	1842637909	WTHGSAFKAOQLED-UHFFFAOYSA-N	443.363	1.621	50	20	IDGD	
O=C([C@@H](O)CCl)N1CC2(CCCN2C(=O)c2ccc3[nH]nc(Br)c3c2)C1	1844134421	ABGZLHJHAVPOFX-ZDUSSCGKSA-N	441.713	1.742	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2cc(C(C)(C)C)n[nH]2)C1	1844476024	XGEGMMZTZGWPIN-ZVHZXABRSA-N	439.520	1.658	50	20	IDGD	
O=C(c1cc(=O)nc2sccn12)N1CC2(CCCN2C(=O)[C@@H](F)Br)C1	1845218731	YMPOXPXBOAABEH-LLVKDONJSA-N	429.271	1.264	50	20	IDGD	
N#C/C(=C\c1ccc(Br)cc1)C(=O)N1CCCC12CN(C(=O)CCC(N)=O)C2	1845873096	JATBYUKUXHKZAN-XNTDXEJSSA-N	445.317	1.825	50	20	IDGD	
O=C1CCCN1CC(=O)N1CC2(CCCN2C(=O)[C@@H](Br)Cc2ccccc2)C1	1845940916	QOUKDLIMIIQSOW-KRWDZBQOSA-N	448.361	1.818	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H]1CC(=O)CN1C(=O)OC(C)(C)C	1847642306	CPURUPQWSQZAOS-UGUYLWEFSA-N	427.929	1.784	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)OC	1847944368	MJAGUTBDIHWOHZ-OWYFMNJBSA-N	447.960	1.370	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1ccc(O)nn1	1848095862	VXVPCPABZRYFQI-IHRRRGAJSA-N	439.900	1.130	50	20	IDGD	
CCn1c(NNC(=O)CN(C)S(=O)(=O)c2ccc(Cl)cc2)nc2ccccc2c1=O	9857108	WRSMOPRJQNVSLY-UHFFFAOYSA-N	449.920	1.834	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)OC)c1	21027525	SXXWDKXXJVXHBZ-UHFFFAOYSA-N	427.866	1.605	50	20	IDGD	
Cc1cc(C(=O)NNS(=O)(=O)c2cccc(S(N)(=O)=O)c2)c(C)n1-c1ccccc1	22410075	VWBNFPCPSYDAFJ-UHFFFAOYSA-N	448.526	1.365	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCCCOCCc1ccccc1	117608790	LZILKYFJPFIKAX-UHFFFAOYSA-N	447.561	1.882	50	20	IDGD	
CC(C)NC(=O)C(=O)NNC(=O)[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)c1ccc(Cl)cc1	726155800	BONFXNDLKIICPW-UAGQMJEPSA-N	434.924	1.785	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)CCCCN1CCOCC1	726868995	LVTFXACIKYJSHI-AWEZNQCLSA-N	428.327	1.866	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)CN2C(=O)N[C@@]3(CCCC[C@@H]3C)C2=O)cc1F	727498290	HYFGCVASOCZJDH-JEOXALJRSA-N	437.497	1.653	50	20	IDGD	
Cn1cc(S(=O)(=O)N2CCCCC2)cc1C(=O)NNc1nc(-c2cccnc2)no1	728075590	JLOKXRBXESFRBX-UHFFFAOYSA-N	431.478	1.402	50	20	IDGD	
CCOc1ccccc1[C@H](CC(=O)NNC(=O)c1nnc(O)c2ccccc12)NC(C)=O	728265245	QJEYRHSSCJTCQO-KRWDZBQOSA-N	437.456	1.763	50	20	IDGD	
O=C(NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)o1)c1cccc(OC(F)F)c1	728487129	UABBDAHZJZEMTE-UHFFFAOYSA-N	429.401	1.740	50	20	IDGD	
CCOC(=O)c1ccc(Br)c(S(=O)(=O)NNC(=O)c2ccccc2O)c1	728501568	OAIGOYHDWKNMHL-UHFFFAOYSA-N	443.275	1.955	50	20	IDGD	
Cc1noc(C)c1S(=O)(=O)N1CCC[C@@H](C(=O)NNC(=O)c2cccc(C#N)c2)C1	728828357	NNUSMKQMBXVSSU-MRXNPFEDSA-N	431.474	1.025	50	20	IDGD	
C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)C1	728949844	VSJBPBKOROAGTG-YLJYHZDGSA-N	437.548	1.859	50	20	IDGD	
Cc1ccc([C@@]2(C)NC(=O)N(CC(=O)NNC(=O)Cn3ccc4ccccc43)C2=O)cc1	729449749	DKBTWDAJPAJFCS-HSZRJFAPSA-N	433.468	1.564	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)Cc2cc[nH]n2)ccc1OCC(=O)N1CCCCC1	730102500	PKCGDVUNZSRSBD-UHFFFAOYSA-N	429.477	1.203	50	20	IDGD	
C[C@H]1CCCN(S(=O)(=O)c2cc(C(=O)NNC(=O)CCc3ccccc3O)n(C)c2)C1	730285998	TUQOPFQRBPOAIS-HNNXBMFYSA-N	448.545	1.545	50	20	IDGD	
CCCCC(=O)N1CSC[C@H]1C(=O)OCC(=O)NNC(=O)c1ccc(Cl)cc1	730329622	AAEQBLQXNAEDEK-AWEZNQCLSA-N	427.910	1.736	50	20	IDGD	
COc1cc(C=NNC(=O)[C@H]2CCS(=O)(=O)C2)ccc1OC(=O)c1ccccc1F	730576659	TZWMCICEORSIQY-AWEZNQCLSA-N	434.445	1.938	50	20	IDGD	
CN(C)N(C(=O)c1cccc(S(=O)(=O)Cc2ccccc2)c1)[C@@H]1CCS(=O)(=O)C1	730741654	QBCIBXJZNFFGGA-GOSISDBHSA-N	436.555	1.766	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)[C@@H]2CC(=O)N(C3CCC(C)CC3)C2)n1	731382759	MKYSOQBZXWPCOC-HNFVBEJKSA-N	436.534	1.112	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)[C@@H]2CCCN(C(=O)Cc3ccccc3)C2)C[C@@H](C)O1	732260868	IPDAANRZRYNFJF-QWFCFKBJSA-N	430.549	1.114	50	20	IDGD	
Cc1nc(N2CCOCC2)nc(O)c1CCC(=O)NNC(=O)NCc1ccc(Cl)cc1	733003957	WIFIOVGDCOETDX-UHFFFAOYSA-N	448.911	1.444	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCc2ccc(F)cc2Cl)c1	733658832	NHUBYDKJDFOXJK-UHFFFAOYSA-N	442.900	1.916	50	20	IDGD	
O=C(NCCN1C(=O)CCC1=O)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1	733800602	BIVHSNJZQWBSOF-FQEVSTJZSA-N	449.511	1.093	50	20	IDGD	
COc1ccc(S(=O)(=O)C[C@H](C)C(=O)NNC(=O)c2nnc(O)c3ccccc23)cc1	735029106	SWWFHWYXUQQGDT-LBPRGKRZSA-N	444.469	1.215	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)CNC(=O)c1cccs1)[C@H]1CN(Cc2ccccc2)CCO1	741273155	GGVPNTOCSHQUDU-NVXWUHKLSA-N	445.545	1.098	50	20	IDGD	
COc1cc(NC(C)=O)c(C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)cc1OC	741830578	ZURISGSFTWFOFA-UHFFFAOYSA-N	440.412	1.152	50	20	IDGD	
Cn1c(=O)c2ccc(C(=O)NNc3c(F)cc(F)cc3Br)nc2n(C)c1=O	741980634	NSDJTRHINIFUBD-UHFFFAOYSA-N	440.204	1.430	50	20	IDGD	
CCCCCCOc1ccc(C(=O)NNC(=O)CN2C(=O)[C@@H]3[C@H]4CC[C@@H](O4)[C@@H]3C2=O)cc1	742516729	HZUKGFSJBFLTKX-LFGUQSLTSA-N	443.500	1.569	50	20	IDGD	
Cc1ccc(N2CCC[C@H](NC(=O)NNC(=O)CNC(=O)c3cccs3)C2=O)cc1	743579335	QBUWYAGFVFZAQC-HNNXBMFYSA-N	429.502	1.312	50	20	IDGD	
C[C@@H]1C[C@@H](NC(=O)NNC(=O)c2c(Cl)cccc2Cl)C(=O)N1c1cnn(C)c1	743586051	TWZFCZLNMVMIDZ-NOZJJQNGSA-N	425.276	1.865	50	20	IDGD	
CS(=O)(=O)c1ccc(OCCCC(=O)NNC(=O)NCCc2cccs2)cc1	743901034	VEVLTQOZKIYCGQ-UHFFFAOYSA-N	425.532	1.884	50	20	IDGD	
C[C@@H](C(=O)NNc1c(F)cc(F)cc1Br)N1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O	744368535	ZTFLBMUEFZVRAZ-MCNNAKBESA-N	444.232	1.721	50	20	IDGD	
O=C(Cc1cc2ccccc2nc1O)NNc1ccccc1S(=O)(=O)N1CCOCC1	744622001	UNRCDOYTONLYRM-UHFFFAOYSA-N	442.497	1.647	50	20	IDGD	
CC(C)C(=O)Nc1cccc(F)c1C(=O)OCC(=O)NNC(=O)c1ccc(C#N)cc1	745034699	UJWJHFAJCPOAFM-UHFFFAOYSA-N	426.404	1.910	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H]1C(=O)OCC(=O)NNC(=O)c1cccc(C#N)c1	745074881	SOWRPOGIGUZUKM-JKSUJKDBSA-N	430.461	1.556	50	20	IDGD	
CCO[C@H]1C[C@H](NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)C12CCC2	745851331	OVLVBSUVSLIKEX-PMACEKPBSA-N	429.565	1.877	50	20	IDGD	
CCOc1cc(C=NNC(=O)C(=O)N2CCCC2)ccc1OCC(=O)N1CCCCC1	748137542	LNTCGCLBESVZON-UHFFFAOYSA-N	430.505	1.549	50	20	IDGD	
CC1=C(C(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)C(=O)OC1(C)C	748546061	DXQPMQIDYYZOTN-UHFFFAOYSA-N	449.510	1.962	50	20	IDGD	
CCOc1ccc(C(=O)NNS(=O)(=O)c2cc(C(=O)O)cc(C)c2F)cc1OC	749144047	USIBWDVFFNFXIH-UHFFFAOYSA-N	426.422	1.863	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCc2ccc([C@@H](C)O)cc2)cc1	749347912	DZDWYSXDBBNTHK-OAHLLOKOSA-N	434.518	1.199	50	20	IDGD	
CC[S@](=O)[C@@H]1CCC[C@H](NC(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)C1	750265269	BJIVBEAUCFJSMR-ODNVZBEZSA-N	427.523	1.736	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)CCCc2cccs2)c(C)c([N+](=O)[O-])c1	753841879	VFVJYROZNMSTAH-UHFFFAOYSA-N	448.457	1.860	50	20	IDGD	
C[C@@H](CS(=O)(=O)c1ccc(F)cc1)C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	755160994	UFSSQYXBSBOQLM-LBPRGKRZSA-N	442.490	1.100	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(N(C)C)c(NC(=O)NNC(=O)c2ccncc2)c1	755435226	RJXKSBWGGIBCBO-UHFFFAOYSA-N	434.522	1.645	50	20	IDGD	
CN(CC(=O)O)c1ccc(C(F)(F)F)cc1C=NNC(=O)c1ccc(-n2cnnn2)cc1	755569870	PJJDBVKHMTWXBF-UHFFFAOYSA-N	447.377	1.966	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)[C@H]1CCC(=O)N1Cc1ccc(Br)cc1	755719185	DANOZRQMYXOFIY-BXUZGUMPSA-N	440.294	1.429	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)Nc1ccc(OCc2ccccn2)c(Cl)c1	756253016	NFFSLRHEFSURQN-LBPRGKRZSA-N	438.893	1.901	50	20	IDGD	
CC(C)N(C)C(=O)c1ccc(Cl)c(NC(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)c1	756434399	MTMKLHYZIQAHFC-GFCCVEGCSA-N	430.914	1.408	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)c1cc(-c2ccccc2)n(-c2ccccc2)n1	758041526	ZOSGYCPPSSTXRY-CQSZACIVSA-N	427.486	1.238	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1cn(C(C)(C)C)nc1-c1ccc(F)cc1F	758048492	TUXZVWSCCJIDQL-JTQLQIEISA-N	443.476	1.282	50	20	IDGD	
O=C(c1c[nH]nc1-c1c(F)cccc1F)N1CCN(S(=O)(=O)CBr)CC1	758512025	GNMJAOADQKPPOJ-UHFFFAOYSA-N	449.277	1.795	50	20	IDGD	
CC(=NNC(=O)[C@H](C)NS(C)(=O)=O)c1ccc(CNC(=O)OC(C)(C)C)nc1C	760249317	OQTFMUUTFLSTBX-ZDUSSCGKSA-N	427.527	1.193	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)C(=O)Nc2cnccc2-c2ccccc2)c2ccccc2c1=O	760278276	BPWIFAMKSSIWAX-UHFFFAOYSA-N	442.435	1.395	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2Br)C[C@H](C)O1	760787893	MUYKMXXMZCGLJL-QWRGUYRKSA-N	429.271	1.618	50	20	IDGD	
CC(=O)N1CCCc2cc(NC(=O)C(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)ccc21	763466123	GUGYBIWMSIYJPT-UHFFFAOYSA-N	425.401	1.294	50	20	IDGD	
O=C(NNC(=O)c1ccccc1Br)C(=O)Nc1cccc(N2CCNC2=O)c1	763482154	FWKKEEMNCWZKDI-UHFFFAOYSA-N	446.261	1.378	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](CNC(=O)NNC(=O)CNC(=O)c1cccs1)C1CC1	763485041	KPLHIMGZRBELJI-GFCCVEGCSA-N	425.511	1.112	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc3nc(C(F)F)[nH]c3c2)cc1	763675466	WVDQGAJVPIITET-UHFFFAOYSA-N	428.355	1.537	50	20	IDGD	
CCOC(=O)c1c(C)csc1NC(=O)C(=O)NNC(=O)COc1ccc(C#N)cc1	763678970	KHEDQKYDXOQNRC-UHFFFAOYSA-N	430.442	1.270	50	20	IDGD	
COCCOc1cc(C)ccc1NC(=O)C(=O)NNC(=O)COc1ccc(C)c(C)c1	763680425	PIPJZWWNSNVWNX-UHFFFAOYSA-N	429.473	1.802	50	20	IDGD	
O=C(CCSc1ccccc1Br)NNC(=O)CNC(=O)c1cccnc1	763823395	APVAZRNNBFSBMW-UHFFFAOYSA-N	437.319	1.904	50	20	IDGD	
CC(=O)Nc1c(C)ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)c1C	763850420	NCPKQEHDTJBMNP-ZDUSSCGKSA-N	430.436	1.954	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(OC)c(OC)c2)cc1	763861370	OPJANTVSOYIYDS-CYBMUJFWSA-N	431.445	1.656	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)NC3CC3)cc2)cc1OC	763902189	RSZLUIVJQDLDFL-UHFFFAOYSA-N	440.456	1.386	50	20	IDGD	
COC(=O)c1ccc(OC(C)C)c(NC(=O)C(=O)NNC(=O)Cc2ccc(F)cc2)c1	763919779	UVUZGIXWZGDUFF-UHFFFAOYSA-N	431.420	1.728	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ncn(C3CCCCC3)n2)ccc1OC(C)C	763922679	YPOCWAJPSYXJQF-UHFFFAOYSA-N	444.492	1.979	50	20	IDGD	
CN1C(=O)c2ccc(NC(=O)C(=O)NNC(=O)c3cc4c(s3)CCCCC4)cc2C1=O	763967398	BXRBOKOSJWNUOU-UHFFFAOYSA-N	440.481	1.643	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)C(=O)Nc1cccc(COCC(F)(F)C(F)F)c1	763997076	VEOHSWZRFHYXHY-UHFFFAOYSA-N	430.358	1.842	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1ccccc1S(C)(=O)=O	764011675	KJMWIRAKJHVPKM-UHFFFAOYSA-N	425.850	1.152	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)c2cnccn2)sc2c1CC[C@H](C)C2	764033388	XGTKVUHYNWMUIR-JTQLQIEISA-N	431.474	1.239	50	20	IDGD	
O=C(Cc1ccsc1)NNC(=O)C(=O)Nc1cccc(OCC(=O)N2CCCC2)c1	764035077	ZVUNEGWSDYCBDR-UHFFFAOYSA-N	430.486	1.078	50	20	IDGD	
CS(=O)(=O)c1c(F)cc(NC(=O)C(=O)NNC(=O)c2cccc3ccccc23)cc1F	764050830	HVTWIWNGKZUTAT-UHFFFAOYSA-N	447.419	1.921	50	20	IDGD	
O=C(NNC(=O)c1cccc(Br)c1)C(=O)Nc1cccc(Cn2cncn2)c1	764062729	BWKBNFWOMFWGGY-UHFFFAOYSA-N	443.261	1.489	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(I)c2)cc1	764177616	RRZLOZDPZMMAJF-UHFFFAOYSA-N	434.193	1.563	50	20	IDGD	
CC(C)CNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)cc1	764239079	DKKHJLZUPPGMJC-UHFFFAOYSA-N	435.484	1.813	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)Cc2cc[nH]n2)cccc1-c1nnc2n1CCCCC2	764296637	DBVDFPVQFNCIHG-UHFFFAOYSA-N	436.476	1.032	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)c(Cl)c1)C(=O)Nc1ccc(CCN2CCOCC2)cc1	764349986	WLSCZOMCFACGPL-UHFFFAOYSA-N	446.891	1.320	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2ccc(-n3cccn3)cc2)n[nH]1	764376569	FQYNTTGVDDFBPZ-UHFFFAOYSA-N	445.439	1.671	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(Oc2ccc(Cl)nn2)cc1	764398117	CXOJPOIXYXZKRY-LLVKDONJSA-N	437.840	1.060	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NN=C(C)c3cccc(S(N)(=O)=O)c3)n[nH]2)cc1OC	764801361	ZAMZPCYAGWWOHC-UHFFFAOYSA-N	443.485	1.895	50	20	IDGD	
CC(C)(C)OC(=O)NNC(=O)C(=O)N1C[C@@H](C(=O)N2CCCCC2)Oc2ccccc21	765391046	NYIOLUXQUUVDMR-INIZCTEOSA-N	432.477	1.349	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)c3ccc(C)c(S(N)(=O)=O)c3)n[nH]2)c1	765577792	XDKQWOMFLOYDOI-UHFFFAOYSA-N	427.486	1.724	50	20	IDGD	
O=C(Cc1c[nH]c2ncccc12)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	765755249	QOPGJHPGCCDUOD-UHFFFAOYSA-N	440.935	1.724	50	20	IDGD	
COc1cc(C#N)ccc1S(=O)(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12	766355241	UDISGLCTFWSDCD-UHFFFAOYSA-N	441.469	1.481	50	20	IDGD	
C[C@@H](c1ccccc1)[C@](C)(O)C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	766636572	QJTJCQTXSNFGMQ-UUOWRZLLSA-N	438.528	1.147	50	20	IDGD	
CNC(=O)Cn1nc(NC(=O)CCC(=O)C(C#N)=C2N(C)c3ccccc3N2C)cc1C	767995920	VENKENSCFXIUJO-UHFFFAOYSA-N	435.488	1.547	50	20	IDGD	
COc1cc2c(cc1NC(=O)C(=O)NNC(=O)c1ccc3ccccc3n1)NC(=O)CC2	768234592	VPLRGYARUCNDEK-UHFFFAOYSA-N	433.424	1.528	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)c3ccc([C@@]4(C)NC(=O)NC4=O)cc3)n[nH]2)cc1	768268405	PMXNWGJEKUKGOB-HSZRJFAPSA-N	446.467	1.769	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@H]2CCOc3ccc(OC)cc32)c2ccccc2c1=O	768529708	SRIUYOWTKGYOFW-KRWDZBQOSA-N	437.456	1.893	50	20	IDGD	
COCCOc1ccccc1N1CCN(CC(=O)NNC(=O)c2ccc(C)cc2)CC1	768551804	LUQONFVMAOXUSP-UHFFFAOYSA-N	426.517	1.603	50	20	IDGD	
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N([C@H]1CCS(=O)(=O)C1)N(C)C	769621064	LWYXMWPIXKQSCP-QFBILLFUSA-N	434.562	1.344	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)[C@@H](C)NS(=O)(=O)c3cccs3)n[nH]2)c1	771045194	MPFUTJKLAGMGPM-CYBMUJFWSA-N	447.542	1.883	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)c1ccc(C[C@@H]2CC(=O)NC2=O)cc1	772971375	ZCOLACIDZAXYNU-IUODEOHRSA-N	429.860	1.774	50	20	IDGD	
CC(C)OCCCn1c(NNC(=O)[C@H]2CCCCS2(=O)=O)nc2ccccc2c1=O	772991279	LDVCDDZHZAJGIH-QGZVFWFLSA-N	436.534	1.622	50	20	IDGD	
COc1ccc(I)c(NC(=O)C(=O)NNc2nccc(OC)n2)c1	773731426	RPHCIXAVLVAVGW-UHFFFAOYSA-N	443.201	1.180	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(N3CCC(C(N)=O)CC3)cc2)cc1F	773890149	SSCWZBYHLJKVOX-UHFFFAOYSA-N	441.463	1.236	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1N1CCOCC1	776096881	RXQJWZFLGLHWME-UHFFFAOYSA-N	428.445	1.834	50	20	IDGD	
Cc1ccc(S(=O)(=O)C[C@H](C)NC(=O)NNC(=O)CSc2ccccc2O)cc1	776196517	UBTGTMGIQAARGC-AWEZNQCLSA-N	437.543	1.986	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NCc2cc(COC(C)(C)C)on2)c2ccccc2c1=O	777270067	POPIKMVVEHCNOT-UHFFFAOYSA-N	428.449	1.381	50	20	IDGD	
O=C(C1CCN(Cc2ccccc2)CC1)N1CCN(S(=O)(=O)CBr)CC1	777778007	VRYWQKWHDYNMSG-UHFFFAOYSA-N	444.395	1.725	50	20	IDGD	
Cc1cc(N2C[C@H](C(=O)NNC(=O)Nc3ccc(S(C)(=O)=O)cc3)CC2=O)ccc1F	779921534	UMJSJPIZWOUOOO-CYBMUJFWSA-N	448.476	1.743	50	20	IDGD	
CC(C)[C@@H]1C[C@H](CC(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)CCO1	781996789	WQCMNKGZRWJSJY-AEFFLSMTSA-N	425.551	1.992	50	20	IDGD	
CCOC(=O)/C=C\c1ccc(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)cc1	782893477	IZWWXVIKSLFMQM-RAXLEYEMSA-N	449.467	1.478	50	20	IDGD	
COC(=O)c1cc(N2CCOCC2)ccc1NC(=O)C(=O)NNc1ccc(OC)cc1	783039319	LSBYQOBXBZKZBX-UHFFFAOYSA-N	428.445	1.400	50	20	IDGD	
COCCNC(=O)c1ccc(NC(=O)C(=O)NNc2ncnc3ccsc23)cc1Cl	783253407	NVCWOTWVEMVABV-UHFFFAOYSA-N	448.892	1.803	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2cccc(COCCc3ccccc3)c2)CCS(=O)(=O)C1	783423944	BRCWPTMMFMZOFE-JOCHJYFZSA-N	445.541	1.582	50	20	IDGD	
CCN(CC)Cc1cccc(NC(=O)C(=O)NNC(=O)CNC(=O)c2cccs2)c1	784004895	LRKHLDQWOKNRBG-UHFFFAOYSA-N	431.518	1.106	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)C(=O)Nc1ccc2ncsc2c1	784210185	HDVNIJQDWGGVIZ-UHFFFAOYSA-N	431.499	1.819	50	20	IDGD	
Cc1c(NNC(=O)C(=O)Nc2cccc(S(=O)(=O)NC3CC3)c2C)cccc1[N+](=O)[O-]	784355292	SFXYSCVQHFNTNT-UHFFFAOYSA-N	447.473	1.734	50	20	IDGD	
CN1CCN(Cc2cccc(NC(=O)C(=O)NNc3ccc(Br)nc3)c2)CC1	784806480	INRKDNKJUOGZME-UHFFFAOYSA-N	447.337	1.673	50	20	IDGD	
COCCOc1ccccc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)C(F)F)cc1	784835215	IBKOONIIOQRKKN-UHFFFAOYSA-N	443.428	1.790	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNc3ccnc(N(C)C)n3)cc2F)C[C@@H](C)O1	784970793	NEZACLMUJPPXMB-BETUJISGSA-N	431.472	1.377	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)CCOc1ccccc1I	785174770	SATHZILDHUWRCR-JTQLQIEISA-N	434.230	1.549	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1ccccc1-c1noc(C)n1	785330755	LHRNKZSCWYHDDZ-UHFFFAOYSA-N	445.457	1.539	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1ccc(C(=O)NC2CC2)cc1	785331268	RLDOOHGOSADTDV-UHFFFAOYSA-N	446.485	1.073	50	20	IDGD	
Cc1cscc1CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	787333382	ZOIATDBAHILGAV-UHFFFAOYSA-N	438.531	1.222	50	20	IDGD	
O=C(NNC(=O)C(=O)Nc1ccccn1)N[C@@H]1CSc2ccc(Br)cc21	787397586	WAYPEDQHEGOFFV-LLVKDONJSA-N	436.291	1.960	50	20	IDGD	
CC(C)N1C(=O)c2ccc(C(=O)NNc3nnc(-c4ccccn4)s3)cc2S1(=O)=O	788563557	KDQUIEPLTDPJDK-UHFFFAOYSA-N	444.498	1.910	50	20	IDGD	
COc1ccc(C(=O)OCC(=O)NNC(=O)Cc2nc(C)cs2)c(OC(F)F)c1	789231942	DYOWXFJIAPNENI-UHFFFAOYSA-N	429.401	1.608	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1cccc2c1OCC[C@H]2N(C)C	789740306	FLRHTOOBHVRYMJ-CXAGYDPISA-N	444.463	1.764	50	20	IDGD	
COc1ccc(OC)c(C2=NO[C@H](C(=O)NNC(=O)COc3ccccc3OC)C2)c1	792015047	SEOCGXLARKOSOF-IBGZPJMESA-N	429.429	1.432	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2cnc(CC(C)C)nc2)n[nH]1	792356465	RKFMEJXQYRLJJQ-UHFFFAOYSA-N	437.460	1.474	50	20	IDGD	
NS(=O)(=O)c1cc(C(=NNC(=O)Cc2cc(O)nc(S)n2)C2CC2)ccc1Cl	794488165	JVSSHTANLSTMDW-UHFFFAOYSA-N	441.922	1.245	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2ccoc2C2(O)CCOCC2)c2ccccc2c1=O	798272922	KDELNEWKCGZMES-UHFFFAOYSA-N	440.456	1.472	50	20	IDGD	
CCOc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccc(F)cc1	799258369	AHCWSZRAAIUTDJ-LLVKDONJSA-N	434.380	1.686	50	20	IDGD	
O=C(NNS(=O)(=O)c1c(Cl)nc2ccc(Br)cn12)c1ccccn1	799913796	YYVSSKRKXJSQRK-UHFFFAOYSA-N	430.671	1.769	50	20	IDGD	
NS(=O)(=O)[C@@H]1CCCN(C(=O)NNC(=O)c2ccc(Br)cc2Cl)C1	799916129	IJZJMYOSHDIENC-SECBINFHSA-N	439.719	1.210	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@]2(F)CCN(C(=O)OCc3ccccc3)C2)cc1	801108011	DDLBLPALRRBVJU-JOCHJYFZSA-N	442.447	1.832	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1ccc(Br)c(OC(F)(F)F)c1	801615779	PRUKPOPHZXXBEV-LURJTMIESA-N	448.217	1.046	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2cnn(CCO)c2-c2ccccc2)cc1	802066541	YQLRPRZDFYBWAJ-UHFFFAOYSA-N	443.485	1.412	50	20	IDGD	
O=C(COC(=O)CNC(=O)c1cccc(Br)c1)NNC(=O)c1ccccc1	802069888	QKRABVQTHGIABB-UHFFFAOYSA-N	434.246	1.183	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(NC(=O)NNC(=O)COc2ccc(Cl)cc2)ccc1F	806542205	NBCPECBYNLOQFY-UHFFFAOYSA-N	444.872	1.961	50	20	IDGD	
O=C(NCC1CCN(S(=O)(=O)C(F)(F)F)CC1)NNc1ccc2c(=O)[nH]ccc2c1	806792066	AWWYHJYWNOAMAL-UHFFFAOYSA-N	447.439	1.716	50	20	IDGD	
COCCNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2cccc3ccccc23)c1	806976703	VQHLGTFKJGQJGK-UHFFFAOYSA-N	434.452	1.616	50	20	IDGD	
O=C(NNc1ccc(C(F)(F)F)nn1)C(=O)Nc1cc(F)c(N2CCOCC2)cc1F	807014078	PZTXUCSVNBZMLO-UHFFFAOYSA-N	446.336	1.692	50	20	IDGD	
CN(C)CCn1ncc(C(=O)NNc2nccc(N3CCOCC3)n2)c1-c1ccccc1	807075589	DZFODKQNWYQCOO-UHFFFAOYSA-N	436.520	1.495	50	20	IDGD	
CC(C)(C)OC(=O)N1CCc2ccccc2[C@H]1CNC(=O)NNC(=O)C(=O)N1CCCC1	807436416	GAMWNIQYGPBRGX-QGZVFWFLSA-N	445.520	1.474	50	20	IDGD	
O=C(NNC(=O)c1ccccc1F)C(=O)Nc1ccc(Br)c([N+](=O)[O-])c1	810385052	KOCLXCVHPJFPPD-UHFFFAOYSA-N	425.170	1.896	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCC(=O)NNc2nc(-c3ccccn3)nc(C)c2C)cc1	810408077	UWRZMGGJIMDTDW-UHFFFAOYSA-N	426.502	1.885	50	20	IDGD	
COC(=O)Cc1cccc(S(=O)(=O)NNC(=O)c2cccc(Br)c2)c1	811686258	SBOBFTMHSQQSHB-UHFFFAOYSA-N	427.276	1.788	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NC[C@]2(C)OCCc3sccc32)c2ccccc2c1=O	812550403	BMZLTVCSJXELCV-FQEVSTJZSA-N	427.486	1.427	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)C(=O)Nc1ncc(C(F)(F)F)s1	812979534	WJZMSXPLNRGAPU-UHFFFAOYSA-N	426.174	1.652	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccccc2OC(F)(F)F)cc1	813033420	RWGQTELJWBXKJR-UHFFFAOYSA-N	446.407	1.917	50	20	IDGD	
CCN(CC)Cc1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)cc1	813033605	BENGYQTZKATWRF-UHFFFAOYSA-N	447.561	1.861	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)c1cc([N+](=O)[O-])c(N(C)C)cc1F	814482934	GJOHGWZAMJOMMP-UHFFFAOYSA-N	432.408	1.655	50	20	IDGD	
CC[C@]1(C)Oc2ccc(NC(=O)C(=O)NNc3ccccc3S(=O)(=O)N(C)C)cc2O1	815751921	UOHJRPZWVQOEKD-HXUWFJFHSA-N	448.501	1.916	50	20	IDGD	
Cc1c(CC(=O)NNC(=O)[C@H]2CCCN(C(=O)OC(C)(C)C)C2)nnn1-c1ccccc1	816510036	KRMCTMKMDOBWDU-INIZCTEOSA-N	442.520	1.913	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc2c(c1)nc(CCC(=O)NNc1cccc(Cl)n1)n2C	817008682	DAMDIHCETFMEDI-UHFFFAOYSA-N	436.925	1.948	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)Cc2ccccc2S(C)(=O)=O)C1	819658861	PXTQSSVBVOJJFR-HNNXBMFYSA-N	439.534	1.427	50	20	IDGD	
O=C(COC(=O)[C@H]1CCCN1C(=O)c1ccccc1)NNC(=O)c1cccc([N+](=O)[O-])c1	912681421	FTLRMLNEHYKHFZ-QGZVFWFLSA-N	440.412	1.204	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)c2cc(S(=O)(=O)N(C)C)ccc2F)cc1	913033485	DLWZIQXCCSHKAJ-UHFFFAOYSA-N	425.507	1.938	50	20	IDGD	
CCN(CCNC(=O)NNC(=O)c1csc(N2CCOCC2)n1)c1cccc(C)c1	913630165	BZVBWARANIZBFO-UHFFFAOYSA-N	432.550	1.759	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)c1cccc(S(=O)(=O)NCC2CC2)c1	914595019	FZERBCVXCUZSQB-UHFFFAOYSA-N	431.470	1.221	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)[C@H](C)Oc2ccc3c(c2)CCC3)cc1OC	915482383	XUJGXXUPFIDANS-AWEZNQCLSA-N	442.468	1.964	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NC[C@H](c2cccs2)N(C)C)c2ccccc2c1=O	915898469	XPKSTQHDZSZSEB-OAHLLOKOSA-N	428.518	1.725	50	20	IDGD	
CC(C)(CNC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)N1CCc2ccccc2C1	916591707	FHKZQTSAGBLTNE-UHFFFAOYSA-N	434.504	1.443	50	20	IDGD	
COC(=O)[C@@H](C)Sc1ccccc1C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	917665166	JWPVHCGWEZYJMX-GFCCVEGCSA-N	436.511	1.819	50	20	IDGD	
CCN(CC)S(=O)(=O)N1CCN(C(=O)NNC(=O)c2ccc3ccccc3c2)CC1	918013386	AIXOATQQDVEQHG-UHFFFAOYSA-N	433.534	1.398	50	20	IDGD	
CCCN1CC[C@@H](CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)C1	919792927	XOOAXEGCEDOYEK-INIZCTEOSA-N	437.566	1.147	50	20	IDGD	
CS(=O)(=O)N1CCC[C@@H](NC(=O)NNC(=O)COc2ccccc2-c2ccccc2)C1	920238739	JULMMFXJFIVYSU-QGZVFWFLSA-N	446.529	1.487	50	20	IDGD	
CCCNC(=O)NNC(=O)CCCCCNS(=O)(=O)c1ccc2c(c1)OCCO2	921042728	NOCKZEUHNHRJTG-UHFFFAOYSA-N	428.511	1.037	50	20	IDGD	
O=C(NNC(=O)c1cncn1-c1ccccc1)N[C@@H]1CC(=O)N([C@H]2C[C@H]2c2ccccc2)C1	1116176452	YUCFZDHFZXVIKF-HOJAQTOUSA-N	444.495	1.973	50	20	IDGD	
O=C(NNC(=O)c1c[nH]c(Br)c1)c1cccc(S(=O)(=O)N2CCCC2)c1	1251866529	OOHYSZIMNTYRGD-UHFFFAOYSA-N	441.307	1.637	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)CSc1nc2ccccc2[nH]1	1253685444	FBWPWZZVIBVWKO-UHFFFAOYSA-N	432.531	1.718	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)CSCc2csc(C)n2)cc1	1317745795	NIUVUSRVTLIRCA-UHFFFAOYSA-N	442.588	1.461	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)NCCC(=O)N2CCCCCC2)CC1	1318668788	QKEYTSLDPWLTJL-UHFFFAOYSA-N	439.557	1.757	50	20	IDGD	
COc1ccc(CCN2C[C@@H](C(=O)NNc3nncc(N)c3Cl)CC2=O)cc1OC	1319217921	AKDOPZSJJODNIA-LBPRGKRZSA-N	434.884	1.264	50	20	IDGD	
COc1cc(Cl)c(Br)cc1C(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1	1321919399	YPQDIWLBIMISHG-SSDOTTSWSA-N	425.688	1.307	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)c3cc4ccccc4o3)CCO2)C1	1779029907	BHZDFPNNTQCNKP-QHCPKHFHSA-N	449.467	1.189	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@]2(CN(C(=O)CNC(=O)c3cccs3)CCO2)C1	1779296180	INUNVCOBPWHLTC-LJQANCHMSA-N	439.610	1.159	50	20	IDGD	
CCNC(=O)N[C@@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CO[Si](C)(C)C)C2	1779322257	CSQKEMDVXFTLPJ-RZQQEMMASA-N	442.633	1.059	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CN1CCCC1=O)C2	1780713029	KQMYJNPKKLEXHQ-NIKGAXFTSA-N	434.364	1.359	50	20	IDGD	
O=C(COc1ccc(O)cc1)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781326245	VOESQDOMLLTMOI-DOTOQJQBSA-N	431.258	1.291	50	20	IDGD	
Cc1cccc(Cl)c1C(=O)N1CC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1	1781723531	RHABGTMKKGXDEI-JOCHJYFZSA-N	442.708	1.086	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cn1cc(C)cn1)C2	1781899893	CNZGCXUAEPIBLJ-GPMSIDNRSA-N	441.370	1.879	50	20	IDGD	
CCN1CCC(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](F)Br)C3)CC1	1783298337	NRRJKSRSWMONFR-GPMSIDNRSA-N	448.377	1.923	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)COc3cc(Cl)ccn3)CCO2)C1	1783533687	FOIMWZXRQJOKLN-SJCJKPOMSA-N	446.729	1.727	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](C)Br)C3)C2)o1	1783533747	GVPHXNMSNAPOPK-DIFFPNOSSA-N	428.283	1.465	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@H](C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](C)Br)C3)C2)C1	1783539851	OHYVKMMZECYGBP-ZTENYAIWSA-N	445.354	1.579	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cn(C)cc3C(F)(F)F)CCO2)C1	1783874986	NHACKHQVWUVNOJ-PBHICJAKSA-N	437.846	1.741	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccc3ccoc3c1)CCO2	1783937932	YQEIXNVLDNDFQA-JOCHJYFZSA-N	428.489	1.249	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)Cn3ccnc3)C[C@@H]21	1783973629	CFLJAJJRLOLNKP-NRKLIOEPSA-N	441.370	1.530	50	20	IDGD	
O=C(NCCC(=O)N1CC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2)c1ccccc1	1785333271	KDRGMFZZNIRKGK-IBGZPJMESA-N	428.316	1.440	50	20	IDGD	
CN(C)C(=O)c1cccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]3C2)c1	1787451441	QBKILVTXQAMIIV-QAETUUGQSA-N	425.888	1.516	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)c1ccc2nccn2c1	1788058798	QISRDRDMGPCKRX-YXWQFLTLSA-N	439.285	1.618	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)c3ccc[n+]([O-])c3)CCC2)cc1)c1ccc(B(O)O)cc1	1788140308	RZLINSWYOXYBKA-UHFFFAOYSA-N	431.257	1.061	50	20	IDGD	
C[C@H](Br)C(=O)NC1(c2ccc(NC(=O)[C@@H](O)N3CCOCC3)cc2)CCC1	1789557037	OFIUFTGVQVUJQJ-SCLBCKFNSA-N	440.338	1.555	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Cl)C[C@@H]21)C1CCN(c2ccccn2)CC1	1789720528	ZAYGGLUAMCPHJA-LSTDLKDCSA-N	438.931	1.812	50	20	IDGD	
CC[S@](=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]2C1	1789867730	DWDACLMNMINJNL-NWDBNUKMSA-N	427.394	1.361	50	20	IDGD	
Cc1cc(C(=O)Nc2ccc(C3(NC(=O)c4cnccc4C(=O)NN)CCC3)cc2)n[nH]1	1790111088	JZSWUGSYNVKFMR-UHFFFAOYSA-N	433.472	1.778	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Cl)C[C@@H]32)cc1O	1790304197	SIKQTGPUICWVPH-PYTWLRIVSA-N	427.860	1.478	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21)c1cnn2cccc(F)c12	1790520667	TYUZDODJUVGFNB-JKOKRWQUSA-N	429.279	1.870	50	20	IDGD	
C/C=C/C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C[C@@H]21	1790798978	LLEUWEIFPTWDRC-TZTOCFSCSA-N	431.445	1.690	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(-c4ccccc4)[nH]n3)C[C@@H]21	1791253773	JHQJFWGUUKZSKV-LJCCNALRSA-N	446.935	1.924	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc([N+](=O)[O-])cc3F)C[C@@H]21	1791257152	QSLMREJJMGISSB-RMIITELYSA-N	443.859	1.581	50	20	IDGD	
COC(=O)N[C@@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2)c1ccccc1	1792799950	NSAGYADDBMCOLS-YIDVYQOGSA-N	427.860	1.208	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3cnccc3n1)C2	1792868421	YVWYVICYKZMNLB-FRQROOTJSA-N	447.333	1.864	50	20	IDGD	
Cc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](O)CCl)ccc1Br	1792978624	JKEVMAZXUZYZPJ-XRGAULLZSA-N	445.741	1.560	50	20	IDGD	
CC(C)[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](O)CCl)c1ccc(F)cc1	1792982892	VSOCXHSJPGSMLO-XWCCPHMRSA-N	426.916	1.755	50	20	IDGD	
COc1cccc(N2C[C@@H](C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)[C@@H](O)CCl)CC2=O)c1	1793106607	OPLUPBYBNUKARZ-ZFSSFNRBSA-N	449.935	1.286	50	20	IDGD	
O=C1CSc2cc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@H](F)Cl)ccc2N1	1796363634	UWVSNNIPEPQBJT-OJXGSEEGSA-N	427.885	1.468	50	20	IDGD	
COc1ccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CO[Si](C)(C)C)cc1O	1797953877	NKQYLEIJHVWMQK-VPTLXERWSA-N	436.581	1.384	50	20	IDGD	
Cc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CO[Si](C)(C)C)n(C(F)F)n1	1797957657	VAOYSQPFJYFTOG-YWVIFJGQSA-N	430.528	1.641	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3n(n1)CCCC3)C2	1799277225	UBTUYHDXVHDRHZ-UESRRSCYSA-N	429.348	1.659	50	20	IDGD	
CCCc1onc(C)c1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Br	1799347920	XIVZHUOBSXKHKM-JLUCKKNBSA-N	432.290	1.829	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Br	1799352459	XOUDKUKQUXWKLZ-RBTXIFOQSA-N	447.301	1.022	50	20	IDGD	
COc1cc(F)c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)c(F)c1	1800476954	KZDKJORCESACAW-MUJYYYPQSA-N	444.243	1.219	50	20	IDGD	
CCC[C@H]1CC[C@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2ccc(B(O)O)cc2)C3)CC1	1800649399	GZFGFSFBHKWDLT-IIHZSMLWSA-N	442.365	1.176	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccnc(OCC(C)C)c1)C2	1800975937	YKDRMPWBOMVDEF-SFNKJDCFSA-N	439.940	1.573	50	20	IDGD	
Cn1nc(C(F)(F)F)cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(Cl)Cl	1801016892	BLZZGNPGQIXHPW-AKZRSSKFSA-N	429.226	1.446	50	20	IDGD	
CC(C)Oc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](O)CCl)C3)cc1C#N	1801846771	YNFYQPWAEYWRPU-SFNKJDCFSA-N	435.908	1.148	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1cnccn1	1803110750	MSFDSDAJEOOQIB-LSGQOIPPSA-N	435.488	1.262	50	20	IDGD	
Cc1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)c(F)c1F	1803642688	ZRJWCLHAISBATB-BJWYYQGGSA-N	428.244	1.519	50	20	IDGD	
Cn1ccc(C(=O)NC[C@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)c1	1805287606	BEFLYOWHDZCZNN-UZLBHIALSA-N	447.499	1.052	50	20	IDGD	
O=C(COc1ccc(F)cc1)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1	1806475396	UFJJUJWQJTUQAW-ZAAXVRCTSA-N	435.883	1.905	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)nc1	1807361629	BYJJPFCRCQKPCI-DENIHFKCSA-N	444.300	1.098	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)Cc2cccnc2)[C@@H]1c1cccnc1	1807626770	JKAZURHXUNIBDA-XXBNENTESA-N	438.532	1.098	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)c1nc2ccccn2n1	1807928240	HTRGCSKZFSETJJ-YQQAZPJKSA-N	428.880	1.044	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)C#CC2CC2)[C@H]1c1cccnc1	1808408440	IPEOUTCMGZIXFJ-IOMHJHRISA-N	446.511	1.635	50	20	IDGD	
Cc1nc(C(=O)N2CCCC3(CCN(C(=O)c4cnccc4C(=O)NN)CC3)C2)cs1	1808696004	CNBQXFJJWFMDOV-UHFFFAOYSA-N	442.545	1.609	50	20	IDGD	
CC(=O)C(=O)N1CCCC2(CCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CC2)C1	1808985740	XEVQGSLNRCFCKP-HNNXBMFYSA-N	429.945	1.939	50	20	IDGD	
Cc1cc(C)nc(C(=O)N2CCC3(CCCN(C(=O)c4cccc(B(O)O)c4)C3)CC2)c1	1809977864	KGMLAZYCUVQLIV-UHFFFAOYSA-N	435.333	1.537	50	20	IDGD	
N#Cc1ccc(CC(=O)N2CCC3(CCCN(C(=O)c4cccc(B(O)O)c4)C3)CC2)cc1	1809977993	QUIMLYTWYHBEMC-UHFFFAOYSA-N	445.328	1.326	50	20	IDGD	
Cc1n[nH]c(C)c1C(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1810652076	KPVLOFGRSJQDLC-UTKZUKDTSA-N	441.536	1.114	50	20	IDGD	
O=C(COc1ccccc1F)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1	1812779484	XWRMAYSHQQTNSU-XAUMDUMWSA-N	435.883	1.905	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](O)c2ccco2)n[nH]1	1814463685	IYGPHSCDIGGRMM-AUUYWEPGSA-N	432.481	1.101	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1)c1cnn(-c2cccnc2)c1	1816206360	STCPAEGXADKLBS-SJORKVTESA-N	443.895	1.896	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)Cc2cccnc2)[nH]n1)c1ccc(B(O)O)cc1	1817470933	AHATWVJGJIXPRZ-LJQANCHMSA-N	433.277	1.033	50	20	IDGD	
O=C(N[C@H]1CCc2nc(NC(=O)c3ccc(Cl)o3)sc2C1)c1ccc(B(O)O)cc1	1817918990	ZSFXTRTZGCECGM-LBPRGKRZSA-N	445.693	1.609	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](C)S)[nH]n1	1818113057	AMZBMYBSUYQBOB-AHSDNHKASA-N	431.522	1.854	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3nn(C)c4c3CCC4)sc2C1	1818476390	QVIIDBZKRXEVCX-ZYHUDNBSSA-N	437.953	1.845	50	20	IDGD	
Cc1ccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cnccc3C(=O)NN)n[nH]2)nc1	1819402257	XEWUHYKCMKUJPA-GOSISDBHSA-N	448.487	1.731	50	20	IDGD	
Cc1cc(C(=O)NCC(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@@H](F)Cl)CC3)no1	1819931072	CMLSUCPGGKFNRH-ISVAXAHUSA-N	429.861	1.316	50	20	IDGD	
C[C@H](Br)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(CO)on2)[nH]n1	1822190648	SPGNPKLLPQUCRD-TVQRCGJNSA-N	426.271	1.979	50	20	IDGD	
Cc1nc(CC(=O)N[C@@H]2CCc3nc(NC(=O)[C@@H](F)Br)sc3C2)no1	1823001322	CRXOOGAHBSIFLO-JMCQJSRRSA-N	432.275	1.680	50	20	IDGD	
N[C@H](C(=O)N[C@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1)c1ccccn1	1823002276	CCRZKUVMYGTUTI-HJIKLVIJSA-N	442.314	1.841	50	20	IDGD	
COc1nccnc1C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](C)Br)sc2C1	1825636471	GLRSXLNDCIEFGG-BDAKNGLRSA-N	440.323	1.951	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc3cn[nH]c3cn1)CC2	1825999988	HNKJAFYWAMNWLT-WDEREUQCSA-N	434.909	1.894	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)Cc1ccsc1)CC2	1826085135	GPHHHDLORHQERD-CYBMUJFWSA-N	435.575	1.732	50	20	IDGD	
Cc1ccncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827053214	YPTIPQKRNGVMQA-JOCHJYFZSA-N	435.333	1.617	50	20	IDGD	
N#Cc1cccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)c1	1827056975	ZMNWCXZFBGGGRP-HSZRJFAPSA-N	445.328	1.785	50	20	IDGD	
Cc1ccc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)c(C)n1	1827057549	IESNKDHVIIYKGF-QHCPKHFHSA-N	449.360	1.925	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H](F)Cl)CC1	1828926965	VFKSEEMDFQSOIY-HZPDHXFCSA-N	425.892	1.453	50	20	IDGD	
Cc1cc2[nH]c(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)[C@@H](O)CCl)CCO4)cc2s1	1830736614	VFJNKOCYKQWNKC-HNAYVOBHSA-N	441.937	1.208	50	20	IDGD	
CSc1ccc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)cc1	1830738648	RNAZGFSJXKJBGJ-FXAWDEMLSA-N	442.965	1.007	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cn(C)nc3C(F)F)C2)C1	1831645839	DVDKKOPBIAZLLN-KUHUBIRLSA-N	448.898	1.835	50	20	IDGD	
C[C@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1)c1ccccn1	1832330541	UDPHGIGHVUQUJQ-MBSDFSHPSA-N	449.360	1.798	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3cccnc3C)CCO2)C1	1832640219	NWPFBWZIPADBGZ-WIYYLYMNSA-N	439.940	1.033	50	20	IDGD	
Cc1c[nH]c(C)c1CCC(=O)NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1833352527	DRLXUYUJUZVIHP-HXUWFJFHSA-N	439.000	1.735	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)CSCC(=O)OC)CC2)CC1	1833476219	GVKLBENWFOZUDY-KRWDZBQOSA-N	448.029	1.872	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)Cn3ccnc3)CC2)CC1	1834267343	DPIAHDLLNWLWSH-KRWDZBQOSA-N	440.386	1.628	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)C/N=C/c3ccco3)CC2)CC1	1835781903	SKHBLHGQLSIJQT-QNDYCBLQSA-N	438.956	1.524	50	20	IDGD	
Cc1cc(C)n(CC(=O)N2CCC(N3CCC(NC(=O)CO[Si](C)(C)C)CC3)CC2)n1	1835835274	OOKVTNFCBPEXJX-UHFFFAOYSA-N	449.672	1.923	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](F)Cl)CC2)CC1)c1cc(-n2ccnc2)ccn1	1836185892	IJOGPIZLYZFJTM-IBGZPJMESA-N	448.930	1.987	50	20	IDGD	
Cc1nc2ncccn2c1C(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836716988	CIQCDRJUVIKIPB-KRWDZBQOSA-N	449.939	1.250	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cccn(C)c3=O)CC2)CC1	1836970001	ANSISMGUOJQKBA-GOSISDBHSA-N	439.940	1.251	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc4cnccc34)CCO2)C1	1837036748	ZEWPIIHETIIXPR-DENIHFKCSA-N	447.919	1.559	50	20	IDGD	
CCOC(=O)O[C@@H](C)C(=O)N1CCC(OC2CCN(C(=O)[C@H](Cl)COC)CC2)CC1	1838726977	NKDVSCPJNRSFFU-WMLDXEAASA-N	448.944	1.800	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4c(cnn4C)c3)C2)C1	1839145202	YRBLXBFROBJDCZ-DYESRHJHSA-N	434.924	1.661	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C1(Br)CC1)CCO2	1839205572	MMQOJIBOPWDFIO-MRXNPFEDSA-N	437.762	1.635	50	20	IDGD	
C[C@H](Cc1ccc(F)cc1)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1839764622	HSDCUKZONLXFBH-ZTQAJYAQSA-N	430.879	1.995	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)C3CCC(O)CC3)CCO2)C1	1840275384	BDXBIRGPOUWOMT-GETDIDHLSA-N	447.370	1.167	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@]1(F)CCCC=C1F)CCO2	1840950769	AVHAIOXKDGOQCT-KYNGSXCRSA-N	436.883	1.442	50	20	IDGD	
COc1ccc([C@@H](O)C(=O)N2CC3(CCCN3C(=O)[C@H](C)CBr)C2)cc1	1841285416	UQWHYVUOIXRZCX-CZUORRHYSA-N	425.323	1.963	50	20	IDGD	
CC[C@@H](C)[C@H](N)C(=O)N1CC2(CCCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C1	1841924434	MFROIMPPHLIWQG-ILXRZTDVSA-N	430.977	1.695	50	20	IDGD	
C[Si](C)(C)C#CCCCC(=O)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843011541	OAAHEHUIBMUHPV-UHFFFAOYSA-N	426.398	1.235	50	20	IDGD	
Cc1cccc(C)c1SCC(=O)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843014152	CVUYDSPEHOALKA-UHFFFAOYSA-N	438.358	1.593	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1ccc3c(c1)CCN3C)C2	1843416099	YTYJIQUPWFJTHN-WGOQTCKBSA-N	448.527	1.630	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)c2cccc(OC3CCOCC3)n2)C1	1844606761	XJQDLRCQIYMBRC-INIZCTEOSA-N	437.924	1.710	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)c1conc1C)C2	1844692087	DYNLLBOMLIMUIM-UHFFFAOYSA-N	428.401	1.947	50	20	IDGD	
O=C([C@@H](O)CCl)N1CC2(CCCN2C(=O)Cc2ccc(Br)c(F)c2)C1	1845944792	YDZXEXCZAVIGCC-AWEZNQCLSA-N	433.705	1.934	50	20	IDGD	
C#CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)[C@@H](Cl)COC)C1	1846365807	WUIIZCLWZDYEOT-GJZGRUSLSA-N	427.929	1.360	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](CC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](O)CCl)C1	1847568297	RHHLPIXJDPDNQO-LTIDMASMSA-N	443.972	1.825	50	20	IDGD	
COc1cc(Br)c(/C=C(\C#N)C(=O)c2c(N)n(C)c(=O)n(C)c2=O)cc1OC	16881503	IUEGRRQXIYVFBW-BJMVGYQFSA-N	449.261	1.236	50	20	IDGD	
O=C(NCC(=O)N1CCc2ccccc2C1)NNC(=O)c1nn(-c2ccccc2)cc1O	726618447	IZIVIIICGDQCAF-UHFFFAOYSA-N	434.456	1.107	50	20	IDGD	
CCc1nc(CCNC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cs1	726717319	RHCLDIGYVJCFNI-UHFFFAOYSA-N	439.563	1.208	50	20	IDGD	
Cn1c(SCC(=O)NNC(=O)c2nnc(O)c3ccccc23)nnc1-c1cccs1	726767415	UTLMHSDFSUKERA-UHFFFAOYSA-N	441.498	1.746	50	20	IDGD	
CCCC(=O)N1CSC[C@H]1C(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12	727365073	KMBIARVQSFWYPQ-HNNXBMFYSA-N	431.518	1.440	50	20	IDGD	
CCNS(=O)(=O)c1ccc(C(=O)NNC(=S)Nc2ccc(OC)c(F)c2)cc1	727498596	CTSIYVMBHHTZPC-UHFFFAOYSA-N	426.495	1.764	50	20	IDGD	
C#Cc1cccc(NC(=S)NNC(=O)CN2C(=O)N[C@](C)(c3ccc(F)cc3)C2=O)c1	727500896	AYQJCDNFPKWLNS-OAQYLSRUSA-N	439.472	1.592	50	20	IDGD	
CC(=O)N[C@H](CC(=O)OCC(=O)NNC(=O)c1cccs1)c1c(F)cccc1F	727569926	KTWLXJWXOFBVAN-CYBMUJFWSA-N	425.413	1.598	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2CCCOC2)c1	727723469	YLRRJBPXHBGEPB-OAHLLOKOSA-N	433.486	1.684	50	20	IDGD	
O=C(NNc1nc(-c2cccnc2)no1)[C@H]1CCCN(S(=O)(=O)c2ccccc2)C1	728078935	CDXXFGYQBVYYIO-HNNXBMFYSA-N	428.474	1.676	50	20	IDGD	
COC(=O)c1ccccc1S(=O)(=O)NNC(=O)c1cc(OC)ccc1Br	728508050	APOQXFOERUJAMS-UHFFFAOYSA-N	443.275	1.868	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)CCCS(=O)(=O)N2CCCC2)c1	728526499	XDNQZHBQZWNWKK-UHFFFAOYSA-N	448.339	1.425	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cc(F)ccc2Br)ccc1OCC(N)=O	728550056	VGHFDGVQIHOLIR-UHFFFAOYSA-N	440.225	1.536	50	20	IDGD	
CCOC(=O)C1=NN(c2ccccc2)[C@H](C(=O)NNC(=O)c2nnc(O)c3ccccc23)C1	728712851	HDPPDJPAGAOYPP-KRWDZBQOSA-N	448.439	1.294	50	20	IDGD	
CCC[C@H](C)NC(=O)[C@@H]1CCCN(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)C1	728961321	GGYGHLFWUCMBJJ-FUHWJXTLSA-N	445.568	1.451	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NNC(=O)CCc2ccccc2O)s1	730033518	BRQAGTQGELNLMJ-HNNXBMFYSA-N	437.543	1.695	50	20	IDGD	
CC(C)(C)CC(=O)N1CSC[C@@H]1C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	730076903	CKVWTMPHVBGBRL-OAHLLOKOSA-N	434.566	1.178	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)CN1C(=O)N[C@](C)(c2ccc(OC)cc2)C1=O)c1ccccc1	731995902	CRZMJHFGBVSBLW-FDDCHVKYSA-N	438.484	1.803	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@H]2CC(=O)N(Cc3ccccn3)C2)cc1Br	732033567	ROYPMYPGRVOXNR-ZDUSSCGKSA-N	447.289	1.662	50	20	IDGD	
Cc1cccc(-n2c(NNC(=O)CCN3C(=O)CCC3=O)nc3ccccc3c2=O)c1C	733264212	GOEWEFYMGXWHER-UHFFFAOYSA-N	433.468	1.985	50	20	IDGD	
CCOCCCn1c(NNC(=O)Cn2ncc3ccccc3c2=O)nc2ccccc2c1=O	733269009	XHIZAFPPJMFBGN-UHFFFAOYSA-N	448.483	1.676	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)N[C@H]2CCC[C@H](C(=O)N(C)C)C2)nc1	734221605	NMSUMDQSNIBJEX-GJZGRUSLSA-N	440.570	1.385	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)nc2)CC1)NNC(=O)c1cccc([N+](=O)[O-])c1	734838246	UVGYZXVACBNJCF-UHFFFAOYSA-N	432.868	1.222	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)N[C@@H]1CCCN(c2cccc(F)c2)C1	734861288	JYFUCRDNZORBKQ-GOSISDBHSA-N	441.511	1.832	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)NC2CCN(C[C@@H]3CCOC3)CC2)cc1	737055715	FEWVWJNWFOWLDI-SJORKVTESA-N	434.537	1.684	50	20	IDGD	
COC[C@@H]1CCN(C(=O)/C(C#N)=C/c2cn(CCC(N)=O)nc2-c2ccc(OC)cc2)C1	739757108	OJNFKZJDWZINKO-YCPFAOKUSA-N	437.500	1.836	50	20	IDGD	
C[C@H]1C[C@@H](C)CN(CCCNC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)C1	743549009	TZRHBRSSCIHUPA-GASCZTMLSA-N	425.555	1.794	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)c1cccc(S(=O)(=O)N2CCCC2)c1	743813035	LLMGXAZYZNYVHJ-UHFFFAOYSA-N	434.430	1.160	50	20	IDGD	
CC(C)(C)c1ccc(C(=O)NCC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)cc1	743829122	AVBDPDUUTUXGRO-UHFFFAOYSA-N	446.529	1.970	50	20	IDGD	
CC(=O)N[C@H](CC(=O)OCC(=O)NNC(=O)c1ccc(C#N)cc1)c1ccc(Cl)cc1	744513362	RHSRLTKMFOUWER-GOSISDBHSA-N	442.859	1.783	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1cc([N+](=O)[O-])ccc1O)c1ccc(N2CCOCC2)cc1	745778918	JNAQLWZJYLOSIO-CYBMUJFWSA-N	429.433	1.842	50	20	IDGD	
CC[C@@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1ccncc1	745836204	NJYZGIJYHVCFJI-GOSISDBHSA-N	447.517	1.198	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)N[C@@H]2C[C@H](C)N(c3cnn(C)c3)C2=O)c1C	745917073	HINSZLDEUPNDES-YSVLISHTSA-N	428.493	1.329	50	20	IDGD	
O=C(Cn1cc(Br)c(O)nc1=O)NNc1ccc(Br)cc1F	748185651	YGYFZLOMSWMYRA-UHFFFAOYSA-N	436.035	1.756	50	20	IDGD	
C[C@]1(c2ccc(C(=O)NNC(=O)NCc3cccc(C(F)(F)F)c3)cc2)NC(=O)NC1=O	748532053	COUMCWIIVFOYLS-LJQANCHMSA-N	449.389	1.904	50	20	IDGD	
CCCOc1ccc(C(=O)NNS(=O)(=O)c2ccc(C(=O)OCC)o2)cc1OC	748641057	QVZNWQKGSNEVQI-UHFFFAOYSA-N	426.447	1.877	50	20	IDGD	
CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)NNC(=O)c1c(C)nc2ccccn12	749334398	DROUHKGZZZMRRU-SFHVURJKSA-N	436.447	1.772	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)[C@H]1CCCN1C(=O)c1ccc2c(c1)OCO2	749468449	DIPKVWOMBFRRNK-XJKSGUPXSA-N	443.431	1.774	50	20	IDGD	
CC(C)[C@H](NC(=O)OCc1ccccc1)C(=O)NNC(=O)[C@@H]1COc2ccccc2O1	750554572	XSICAVGWJJLJKB-OALUTQOASA-N	427.457	1.925	50	20	IDGD	
O=C(CCSc1ccnc2cc(Cl)ccc12)NNC(=O)[C@H]1CCS(=O)(=O)C1	751225650	XYWVEUPZOUTKQR-NSHDSACASA-N	427.935	1.953	50	20	IDGD	
Cn1cnc(S(=O)(=O)NNC(=O)[C@@H]2Cc3ccccc3CN2Cc2ccccc2)c1	751276290	MVUHUAUAQHLJJI-IBGZPJMESA-N	425.514	1.357	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNS(=O)(=O)c1ccc(Br)c(Cl)c1	751547157	IUHCRQLEPWSHLE-UHFFFAOYSA-N	436.671	1.435	50	20	IDGD	
CS(=O)(=O)Cc1nc2ccccc2n1CC(=O)NNC(=O)c1c[nH]c2ccccc12	754552303	RMFSFIQDLNTLJA-UHFFFAOYSA-N	425.470	1.523	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)cc1OCc1ccncc1	755664868	AVAKJNBLROGWHR-CQSZACIVSA-N	434.474	1.257	50	20	IDGD	
COC(=O)c1ccc(F)c(NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c1	755846716	AYFMTRGAJXRZAJ-UHFFFAOYSA-N	443.479	1.977	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1ncc(Cc2ccccc2)s1	756190901	VYZYSTLPIGAANR-UHFFFAOYSA-N	443.510	1.311	50	20	IDGD	
CN(C1CC1)S(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1	756405224	YBMLIMOPIIDYRD-GOSISDBHSA-N	446.485	1.462	50	20	IDGD	
CCn1cnnc1-c1ccccc1NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1	756525604	JLARRZZPVWPXFW-UHFFFAOYSA-N	435.492	1.824	50	20	IDGD	
CS(=O)(=O)Nc1ccc(NC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1Cl	756709543	ZJXHSGSYJRWIIY-OAHLLOKOSA-N	440.865	1.704	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)[C@H](C)Oc2ccccc2F)cc1NS(C)(=O)=O	756782316	PGWBBPYKCUBZMQ-NSHDSACASA-N	440.453	1.826	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)Cc1ccn(-c2ccccc2)n1	756901841	VMRXIHGBPXYYTJ-UHFFFAOYSA-N	432.528	1.775	50	20	IDGD	
O=C(CN1CCN(c2ccc(F)cc2Cl)CC1)NNC(=O)c1ccc([N+](=O)[O-])cc1	757164248	QWXNGDUREPBIFA-UHFFFAOYSA-N	435.843	1.971	50	20	IDGD	
NC(=O)c1ccc(NNC(=O)[C@@H](c2ccc(Cl)cc2Cl)N2CCOCC2)nn1	757403802	FVWLNDZUACWXPF-OAHLLOKOSA-N	425.276	1.399	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)Nc2ccc3c(c2)S(=O)(=O)CC3)n[nH]1	757710468	YLRJYECKSVGDLV-UHFFFAOYSA-N	441.469	1.882	50	20	IDGD	
COCc1nc2n(n1)C[C@H](NC(=O)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1)CC2	757789937	SVMBYZKFVJLVFU-LLVKDONJSA-N	448.427	1.359	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)nc1	758000737	WTOSWQHDNSCEHO-UHFFFAOYSA-N	447.517	1.196	50	20	IDGD	
COC(=O)C[C@H](C)C(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2OC)c1	758354221	CLFSZQVIQNIWEG-ZDUSSCGKSA-N	449.485	1.456	50	20	IDGD	
CCn1cc(C(=O)NNC(=O)CNC(=O)c2cccnc2)c(=O)c2cc(Cl)ccc21	758357491	SHPKEGNDKHAESA-UHFFFAOYSA-N	427.848	1.261	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NC[C@H](C)c2ncc(C)s2)cc1	758744047	GRVOHWZNWAIHJV-ZDUSSCGKSA-N	439.563	1.515	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2cc(C)c(Cl)c(C(=O)O)c2)cc1OC	759092474	VRNMSVKXAOMLIM-UHFFFAOYSA-N	428.850	1.987	50	20	IDGD	
COC(=O)c1[nH]c(C)cc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)C(F)F)cc1	759404330	WXBFGCKBQGEQBE-UHFFFAOYSA-N	430.389	1.188	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)[C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])c(C)c2)nc1	759740067	RYAXZDQEWIDNCV-MRXNPFEDSA-N	427.417	1.833	50	20	IDGD	
Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	760794566	SFSIBNWCBFSNAA-OAHLLOKOSA-N	449.803	1.701	50	20	IDGD	
COC(=O)[C@H](C)Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1	763441250	AGVCLSMQAIPTLR-GFCCVEGCSA-N	428.401	1.346	50	20	IDGD	
C[S@@](=O)Cc1cc(NC(=O)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)ccc1Cl	763468943	YXRWVVXGKXLIAL-GDLZYMKVSA-N	438.849	1.526	50	20	IDGD	
CC(=O)NNC(=O)C(=O)Nc1ccc(S(=O)(=O)Nc2cccc(C(F)(F)F)c2)cc1	763513037	XQTGTQVEWFLMMX-UHFFFAOYSA-N	444.391	1.612	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)N[C@@H]1CC(=O)N([C@@H]2C[C@H]2c2ccccc2)C1	763527166	ZSMLQAGZENZJCG-IXDOHACOSA-N	440.525	1.972	50	20	IDGD	
C[C@@H](c1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)cc1)N1CCOCC1	763552351	YRKMHDQHSGDEAN-AWEZNQCLSA-N	440.456	1.208	50	20	IDGD	
C[C@H]1CN(Cc2ccccc2NC(=O)C(=O)NNC(=O)c2ccccc2F)C[C@H](C)O1	763568459	LDCASLLEFMRAOU-GJZGRUSLSA-N	428.464	1.835	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(S(C)(=O)=O)ccc1C	763712497	SUGFZMAVXLABLU-UHFFFAOYSA-N	433.486	1.126	50	20	IDGD	
O=C(NNC(=O)c1cc2c(s1)CCC2)C(=O)Nc1ccccc1S(=O)(=O)C(F)F	763782839	GLQHZJFCFWCXKK-UHFFFAOYSA-N	443.453	1.633	50	20	IDGD	
CCOC(=O)c1c(C)csc1NC(=O)C(=O)NNC(=O)c1nnc(O)c2ccccc12	763790870	PBINSKXPKRYUNK-UHFFFAOYSA-N	443.441	1.282	50	20	IDGD	
COC(=O)c1[nH]c(C)cc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccc2ccccc2c1	763855378	VYXLQAOCKWSITG-CYBMUJFWSA-N	438.440	1.816	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(-n3cccn3)cc2)cc1	763859848	GKDDOTUBMVYGCT-OAHLLOKOSA-N	437.456	1.824	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(NC(=O)OC)cc2)cc1	763862253	WTURRDHZJHZQIM-ZDUSSCGKSA-N	444.444	1.817	50	20	IDGD	
CCN(Cc1ccccc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccccc1F)C(C)=O	763866851	XZSVIRKGKGVVQA-CQSZACIVSA-N	444.463	1.748	50	20	IDGD	
CCn1nnnc1-c1cccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)c1	763872892	PSTJQTQIUNQXJA-GFCCVEGCSA-N	441.423	1.053	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)C(=O)Nc1ccccc1CCC(F)(F)F	763916558	GIGSVWAXRJVJCW-UHFFFAOYSA-N	447.377	1.557	50	20	IDGD	
C[C@@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)Cc3ccc(F)cc3)cc2F)C[C@@H](C)O1	763918385	GCRSQRCQGYIQFM-ZIAGYGMSSA-N	446.454	1.907	50	20	IDGD	
O=C(NNC(=O)c1ccc(COc2ccccc2)o1)C(=O)Nc1ccc(-n2nccn2)nc1	763955815	SFINFVDSSNQLQJ-UHFFFAOYSA-N	447.411	1.234	50	20	IDGD	
CC(C)(C)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1	764076692	FHPHMSALZPWGIO-UHFFFAOYSA-N	445.497	1.719	50	20	IDGD	
CON(C)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)Cc2ccc3ccccc3c2)cc1	764092036	LTSJRECICIBDOR-UHFFFAOYSA-N	434.452	1.802	50	20	IDGD	
CCc1cc(NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3CN2Cc2ccccc2)no1	764179009	MMEVVVQGFMXTBZ-HXUWFJFHSA-N	447.495	1.950	50	20	IDGD	
Cc1nc2cc(NC(=O)C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)ccc2n1C	764203487	ABLYMTVFOQGIMC-UHFFFAOYSA-N	432.481	1.273	50	20	IDGD	
CCS(=O)(=O)c1cc(F)ccc1NC(=O)C(=O)NNC(=O)c1cccc2ncccc12	764252554	INBNLTCSBKPJJP-UHFFFAOYSA-N	444.444	1.567	50	20	IDGD	
CCOC(=O)c1c(C(C)C)csc1NC(=O)C(=O)NNC(=O)COc1ccccc1O	764277028	GGRMSLNJJITOTO-UHFFFAOYSA-N	449.485	1.919	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)C(=O)Nc1ccc(C(=O)N2CCCC2)cc1	764351582	SYDYBCXPYUANMP-UHFFFAOYSA-N	446.467	1.508	50	20	IDGD	
COCC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)CSc2ccccc2OC)cc1	764392160	BFJVKRKTVXVTJH-UHFFFAOYSA-N	446.485	1.158	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)C(=O)Nc2ccc(Cl)c3cccnc23)c1	764434952	ZNLFUAOXHLJEGE-UHFFFAOYSA-N	426.820	1.641	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(C#N)cc2OC)cc1	766259297	XHUYXMLYAOOCJP-CYBMUJFWSA-N	426.429	1.519	50	20	IDGD	
COc1cccc(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)c1[N+](=O)[O-]	768089846	GKFMELDDWMZPBH-UHFFFAOYSA-N	449.489	1.296	50	20	IDGD	
COc1ccc(NC(=O)NNc2ccc(Cl)nn2)cc1S(=O)(=O)N1CCOCC1	769924801	DLDBVAWNRFRVFN-UHFFFAOYSA-N	442.885	1.308	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)NCc1cccnc1N1CCN(C)CC1	770364157	KFSSPOOCRYOKAB-OAHLLOKOSA-N	446.939	1.785	50	20	IDGD	
O=C(NNC(=O)c1ncccc1C(F)(F)F)c1ccc(S(=O)(=O)N2CCCC2)cc1	770578832	NVLFOCWFVAJZIY-UHFFFAOYSA-N	442.419	1.960	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccnn1-c1cccc(F)c1	770774513	OVBJFTOARYZYQB-LBPRGKRZSA-N	429.383	1.704	50	20	IDGD	
Cc1ccc(CCC(=O)NCC(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)cc1	770955952	RRXWATQIMOXWLT-UHFFFAOYSA-N	425.493	1.787	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)C3CCN(C(=O)c4ccc(Cl)s4)CC3)nc21	770972866	WMLPJHJCZLAZSO-UHFFFAOYSA-N	435.897	1.779	50	20	IDGD	
COCc1nc(OC)c2c(C)c(C(=O)O[C@H](C)C(=O)NNC(=O)CC(C)C)sc2n1	771912168	COHPAHGVSKOFNI-LLVKDONJSA-N	438.506	1.894	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(CS(C)(=O)=O)c(F)c2)cc1F	773885885	SMVYKSUIBUVJSI-UHFFFAOYSA-N	425.413	1.218	50	20	IDGD	
CCOC1CC(CNC(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)(N2CCOCC2)C1	775160165	WNFUVLQPCKJPNM-AZOSJMHDSA-N	438.500	1.193	50	20	IDGD	
CCOC(=O)N1CCC[C@H]([C@@H](C)NC(=O)NNC(=O)Cc2nc3ccccc3n2C)C1	777266717	QHDWVBWJZQJYJS-CABCVRRESA-N	430.509	1.703	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)Cc2csc(NC(=O)c3ccco3)n2)nc1C	778423739	GGRKGUBQWXRFIB-UHFFFAOYSA-N	430.446	1.949	50	20	IDGD	
COC(=O)c1cnc(C(=O)NNc2nc3ccccc3c(=O)n2CCCOC(C)C)cn1	779667268	RKSKJZDJXXGBGM-UHFFFAOYSA-N	440.460	1.545	50	20	IDGD	
CCC[C@@H]1C[C@H](C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)CCO1	779713073	KCKUHDUUKFPCAF-IAGOWNOFSA-N	439.534	1.064	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(Cl)cc1	781932852	IJUYJORULFYPGE-PBHICJAKSA-N	437.905	1.234	50	20	IDGD	
CON(C)S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2nc3ccccc3s2)cc1	782811863	AKRFQLRCFWBNLO-UHFFFAOYSA-N	435.487	1.560	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(O)cc2)cc1OCC(F)(F)F	782837210	GFPCQXIKSSUCBQ-UHFFFAOYSA-N	427.335	1.742	50	20	IDGD	
Cc1ccnn1-c1ccccc1NC(=O)C(=O)NNC(=O)Cc1nc2ccccc2n1C	782892325	BWAARAHLVXHUQP-UHFFFAOYSA-N	431.456	1.396	50	20	IDGD	
Cc1cccc(Oc2ccc(Cl)cc2NC(=O)C(=O)NNC(=O)C(=O)NC2CC2)c1	782967036	RDCXWHRHZFEVSW-UHFFFAOYSA-N	430.848	1.805	50	20	IDGD	
Cc1ccc(C)c(NNC(=O)C(=O)Nc2cc(S(=O)(=O)N(C)C)ccc2N(C)C)c1	783366395	FZPHRQCPJXCZJE-UHFFFAOYSA-N	433.534	1.702	50	20	IDGD	
Cc1cccc(-n2nc(C(C)(C)C)cc2NC(=O)C(=O)NN[C@]2(C)CCS(=O)(=O)C2)c1	783428670	YGAZERHVGHNZHU-OAQYLSRUSA-N	447.561	1.615	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2cccc(CSc3ccccn3)c2)CCS(=O)(=O)C1	783428787	XIPZQCUAVXZMCM-IBGZPJMESA-N	434.543	1.510	50	20	IDGD	
COC(=O)CCNC(=O)c1ccc(NC(=O)C(=O)NNc2nccc3sccc23)cc1	783437236	DLIPGOOIOUKCNL-UHFFFAOYSA-N	441.469	1.671	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2ccnn2Cc2cccc(Br)c2)ncn1	783944067	CXJSFNKXVAOIML-UHFFFAOYSA-N	430.266	1.874	50	20	IDGD	
Cc1ccc(NNC(=O)C(=O)Nc2cc(S(=O)(=O)N3CCCCC3)ccc2C)nn1	783950072	JWUSEHXCFSBHHR-UHFFFAOYSA-N	432.506	1.350	50	20	IDGD	
COC[C@@H]1CN(C(=O)NNC(=O)[C@H](C)Oc2cccc(Br)c2)C[C@@H](C)O1	784058633	YBJSAETXDGKYJU-XUJVJEKNSA-N	430.299	1.693	50	20	IDGD	
O=C(NNc1ccccc1Cl)C(=O)Nc1ccc(C(=O)NCCN2CCOCC2)cc1	784770228	DNAIYFGZFWWFCC-UHFFFAOYSA-N	445.907	1.484	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ncccc2Cl)c(C)c1S(=O)(=O)NC1CC1	784819513	SPBHTCKJZKODHG-UHFFFAOYSA-N	437.909	1.874	50	20	IDGD	
CCN1CCN(Cc2ccc(NC(=O)C(=O)NNc3cccc([N+](=O)[O-])c3)cc2)CC1	784833000	BJPUWSDCQBYJFG-UHFFFAOYSA-N	426.477	1.814	50	20	IDGD	
CC(C)n1nnnc1-c1ccccc1NC(=O)C(=O)NNc1cccc(S(C)(=O)=O)c1	784844562	MQLASNBBLMGHIO-UHFFFAOYSA-N	443.489	1.406	50	20	IDGD	
CN(C)c1nccc(NNC(=O)C(=O)Nc2cc(Cl)ccc2OC[C@H]2CCCO2)n1	784971208	VVHBXZODDUNCLW-CYBMUJFWSA-N	434.884	1.836	50	20	IDGD	
COc1cc(F)cc(NNC(=O)C(=O)Nc2ccc(NC(=O)[C@@H](C)n3cncn3)cc2)c1	785237600	UZTQKRHWESTUNR-GFCCVEGCSA-N	441.423	1.707	50	20	IDGD	
CC(C)Sc1cccc(Cl)c1C=NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C	786035958	IUXDVCFAEQVJRC-UHFFFAOYSA-N	448.936	1.738	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)C(=O)Nc1cccc(C(F)(F)F)n1	786427287	RTPWRLXMSRWHFD-UHFFFAOYSA-N	443.407	1.623	50	20	IDGD	
O=C(CNC(=O)c1c[nH]c2ccccc2c1=O)NNC(=O)NCc1ccc(Cl)cc1	787433969	OCJCNRHOLIAJEO-UHFFFAOYSA-N	427.848	1.442	50	20	IDGD	
Cc1ccc(N2CCNC2=O)cc1NC(=O)C(=O)NNC(=O)c1cccc(C(F)(F)F)c1	787544606	XFZSUIAUYKXKBF-UHFFFAOYSA-N	449.389	1.943	50	20	IDGD	
COCCS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccc(Cl)c(OC)c2)cc1	789804967	UBTXZUUMEDBINJ-UHFFFAOYSA-N	441.893	1.851	50	20	IDGD	
Cn1c(NNC(=O)[C@@](C)(O)Cn2cc(C(F)(F)F)ccc2=O)nc2ccccc2c1=O	792177482	DUBGEFSQQGNUPQ-SFHVURJKSA-N	437.378	1.008	50	20	IDGD	
CNS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2cc(C)n(-c3ccccc3)c2C)nc1	792399623	IBUVSSRVJMQMSY-UHFFFAOYSA-N	442.501	1.864	50	20	IDGD	
Cc1cccnc1NNC(=O)c1cccc(NS(=O)(=O)c2ccc3nnn(O)c3c2)c1	792513179	FXVZLRHXMMAINB-UHFFFAOYSA-N	439.457	1.930	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)Cc1csc2ccc(Br)cc12	792644002	WXSJBYBDHXOHNV-QMMMGPOBSA-N	434.337	1.291	50	20	IDGD	
CN(C)N(C(=O)[C@@H]1C[C@H]1C1CCN(C(=O)OC(C)(C)C)CC1)[C@@H]1CCS(=O)(=O)C1	792851430	VFNVNEMACJZYJE-IXDOHACOSA-N	429.583	1.762	50	20	IDGD	
Cn1ccnc1[C@H]1CN(C(=O)OC(C)(C)C)CCN1CC(=O)NNC(=O)c1cccs1	792910772	GVVXXOMUJWRVLA-CQSZACIVSA-N	448.549	1.537	50	20	IDGD	
O=C(NNC(=O)c1ccccc1O)C(=O)Nc1ccc2c(c1)N(CC(F)F)CCS2	793023522	PPDKIXYVFHAKTH-UHFFFAOYSA-N	436.440	1.969	50	20	IDGD	
CN(NC(=O)[C@@H]1COCCN1C1CCCC1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	793815846	ZKNZAKHQTBBIAN-KRWDZBQOSA-N	439.557	1.266	50	20	IDGD	
O=C(NNC(=O)c1sccc1Cl)c1cccc(S(=O)(=O)N2CCOCC2)c1	794743286	XUGVLDRFIUFJCP-UHFFFAOYSA-N	429.907	1.497	50	20	IDGD	
CC(C)n1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(Br)c2)n1	796999817	OPOKYSGUNCWHEU-LLVKDONJSA-N	438.282	1.780	50	20	IDGD	
O=C(NNc1cccc2c1CCCC2)C(=O)Nc1cc(S(=O)(=O)N2CCCC2)ccn1	797054743	KYWQUOVOCOITFS-UHFFFAOYSA-N	443.529	1.827	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2cc([N+](=O)[O-])c(C)cc2Br)n1	797371414	UDBGQDFOUCMKHK-UHFFFAOYSA-N	436.222	1.769	50	20	IDGD	
Cc1cc(O[C@@H]2CCN(C)C2=O)ccc1NC(=O)C(=O)NNC(=O)Cc1ccc(F)cc1	799258486	FOWCVXLVELXJFZ-GOSISDBHSA-N	442.447	1.072	50	20	IDGD	
Cn1cc(C(=O)NNS(=O)(=O)c2c(Cl)nc3ccc(Br)cn23)cn1	799921235	JHPPPRMXYWFZSP-UHFFFAOYSA-N	433.675	1.107	50	20	IDGD	
O=C(COC(=O)c1ccnc(C(F)(F)F)c1)NNC(=O)[C@@H]1COc2ccccc2O1	808667556	YRYCHKZEFLVTKT-ZDUSSCGKSA-N	425.319	1.245	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccccc1C(F)(F)F)NNC(=O)COCc1ccccc1	810424873	XKHHHYGQHPRBOM-UHFFFAOYSA-N	445.419	1.348	50	20	IDGD	
Cc1cc(S(N)(=O)=O)cc(NC(=O)NNc2ccccc2S(=O)(=O)N(C)C)c1C	814641166	CHRBTSDVZVLWIB-UHFFFAOYSA-N	441.535	1.350	50	20	IDGD	
CC(=NNC(=O)c1cc2ccccc2cc1O)c1ccc(S(=O)(=O)CC(N)=O)cc1	814694723	WGSRAQRWWRVNKR-UHFFFAOYSA-N	425.466	1.958	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)c2ccc(C(=O)OC)n2C)c2ccccc2c1=O	814733399	GWUUVRMXLVSIIN-UHFFFAOYSA-N	439.472	1.787	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc([C@@H]3CCOC3)cc2)cc1	815566033	HEUIVOKJNXOQLM-MAUKXSAKSA-N	439.468	1.947	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)C(=O)Nc2cncnc2N(C)C)c1	815866704	LEZANPIBWOGKSQ-UHFFFAOYSA-N	437.254	1.174	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)CN2C(=O)[C@@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2=O)c1	816716199	BKCSYAQHMZUJLG-VCXDHIOWSA-N	448.273	1.486	50	20	IDGD	
O=C1CC[C@@](C(=O)NNC(=O)COc2ccc(Br)cc2)(c2ccccc2)CN1	816810356	JENAUGZBVVTOFC-FQEVSTJZSA-N	446.301	1.823	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)[C@H]2CCCN(S(=O)(=O)c3ccc(F)cc3)C2)cc1	825600634	NOVPGEKDERRJAP-INIZCTEOSA-N	448.520	1.794	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNS(=O)(=O)c3ccc4c(c3)C(=O)N(C)C4=O)cc2C1	861655726	BKDWXLOIIZALRA-JTQLQIEISA-N	433.511	1.722	50	20	IDGD	
O=C(COC(=O)CCCOc1ccc(F)cc1)NNC(=O)[C@@H]1COc2ccccc2O1	875620697	QCIBLOOMMDQGTH-SFHVURJKSA-N	432.404	1.515	50	20	IDGD	
COc1ccc2c(c1)C[C@H](C(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1)CO2	914782015	XXJHLIDNFPGOKC-INIZCTEOSA-N	447.513	1.023	50	20	IDGD	
COc1ccc(C=NNC(=O)CSc2nnc(O)nc2O)cc1OCc1cccnc1	915049782	XTWTYLHDDFGNRK-UHFFFAOYSA-N	442.457	1.508	50	20	IDGD	
O=C(COC(=O)C1(c2ccccc2)CCOCC1)NNC(=O)[C@H]1COc2ccccc2O1	915255939	DULLSXKADNKYNN-LJQANCHMSA-N	440.452	1.265	50	20	IDGD	
Cc1cc(C)nc(SCc2ccc(C(=O)NNC(=O)Cc3nc4ncccn4n3)cc2)n1	915808470	SATLFARIOPONEA-UHFFFAOYSA-N	448.512	1.827	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)CS(=O)(=O)Cc2ccc(C#N)cc2)cc1OC	916141322	SIAODMWHMJXWOF-UHFFFAOYSA-N	431.470	1.342	50	20	IDGD	
O=C(NN=C1CCS(=O)(=O)c2ccccc21)c1ccc(S(=O)(=O)N2CCCC2)cc1	916320808	KQAXHDHSRJJGKH-UHFFFAOYSA-N	447.538	1.783	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)c3ccc4c(=O)n(C)c(S)nc4c3)n[nH]2)cc1	917178078	JHTHPPDYKITYHZ-UHFFFAOYSA-N	434.481	1.996	50	20	IDGD	
C=CCNC(=O)c1cccc(S(=O)(=O)NNC(=O)[C@@H](C)Oc2ccc(OCC)cc2)c1	917725673	SFCBPXXTCWGFEC-OAHLLOKOSA-N	447.513	1.778	50	20	IDGD	
O=C(NCc1nccs1)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	918218127	CLBIFUNNQIENGY-UHFFFAOYSA-N	434.485	1.989	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)NCc1cccc(OCC(=O)N(C)C)c1	918223810	NCOYEKLTIFJOMN-UHFFFAOYSA-N	428.489	1.625	50	20	IDGD	
CCCS(=O)(=O)N1CCCC[C@@H]1C(=O)NNC(=O)c1cc(OC)c(OC)c(OC)c1	918543783	PYMCLDWQBPDZAC-CQSZACIVSA-N	443.522	1.068	50	20	IDGD	
O=C(CCSc1ccc(F)cc1)NNC(=O)NCCN1C(=O)c2ccccc2C1=O	919788281	ICANPIRPHJEHHM-UHFFFAOYSA-N	430.461	1.935	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)c3nc4ncc(Br)cn4n3)n[nH]2)cc1	919815146	ARUKLOMODNNTAC-UHFFFAOYSA-N	441.249	1.660	50	20	IDGD	
CC(=O)N1c2ccc(S(=O)(=O)NNC(=O)c3nnc(-c4ccccc4)o3)cc2C[C@H]1C	919961398	DWWQYCQNXVWVIH-GFCCVEGCSA-N	441.469	1.657	50	20	IDGD	
O=C(NN=Cc1cn2cc(Cl)ccc2n1)c1cccc(S(=O)(=O)N2CCOCC2)c1	920357098	AXNKENPCFDPOQU-UHFFFAOYSA-N	447.904	1.773	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)c2c[nH]c(C(=O)N3CCCC3)c2)CC1	1116092156	MGJZBGQRJDRTLE-UHFFFAOYSA-N	433.509	1.659	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2cccc(I)c2)cc1	1116108674	DDVQFHRRCPCPKL-UHFFFAOYSA-N	432.239	1.923	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)CNS(=O)(=O)c2ccccc2)c1	1323943012	XWTLJVAWVQGYNL-UHFFFAOYSA-N	442.291	1.197	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)N[C@H]2COc3c(F)cc(F)cc3C2)nc1	1346929598	SHRWIDPLKKSHCF-CYBMUJFWSA-N	441.460	1.676	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H]1CC(=O)N(C3CCCC3)C1)C2)[C@H](F)Cl	1778021946	FCGCWMVOOZICMV-MZTCLCMBSA-N	443.947	1.826	50	20	IDGD	
O=C(c1cc2n(n1)CCCC2)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1778561798	OQQCJPRRNICYTK-WMLDXEAASA-N	429.290	1.353	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccn4nccc4c3)C2)C1	1778727133	CAPLHWIHXVUPJI-IFXJQAMLSA-N	435.322	1.809	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@]2(CN(C(=O)COc3cc(Cl)ccn3)CCO2)C1	1779299356	YPQBXXDCYQGQOX-IBGZPJMESA-N	441.988	1.795	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc4ncsc4[nH]3)C2)C1	1779341137	JDQXPPNELRVREF-HWPZZCPQSA-N	427.324	1.851	50	20	IDGD	
Cc1cc(C(=O)NCC(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)C(Cl)Cl)C3)no1	1779434550	CHGQRZIHHUQXBM-FZKQIMNGSA-N	447.319	1.030	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(CN(C(=O)CC(C)(C)O)CCO2)C1	1780097288	VVNUBFSWLBMUPQ-OAQYLSRUSA-N	449.460	1.125	50	20	IDGD	
COc1ccnc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)c1OC	1780452996	SNVJIOKSLILFFL-PBHICJAKSA-N	446.273	1.233	50	20	IDGD	
Cc1cc(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](F)Br)C2)n[nH]1	1780774678	IAVQRYPJQBPUIK-UKPHBRMFSA-N	431.306	1.465	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(O)ccc2O)C1	1781144904	MDECZURGPOIFHP-WRWLIDTKSA-N	426.897	1.479	50	20	IDGD	
COc1cc(CC(=O)N2CC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)ccc1[N+](=O)[O-]	1781191197	BMQRMDWJSVSVSX-GOSISDBHSA-N	446.287	1.780	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3c(Br)cnn3C)CCO2)C1	1781219597	VLFYPERUDBYJNB-BLLLJJGKSA-N	433.734	1.644	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)CCN3Cc4ccccc4C3=O)CCO2)C1	1781220253	ZXXVBEKQSHTEBP-AVRDEDQJSA-N	433.936	1.880	50	20	IDGD	
COc1nccc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)c1F	1781228133	WZEDOIOUUBQEOY-ZWKOTPCHSA-N	434.295	1.909	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H]3CC(c4ccccc4)=NN3)C2)C1	1782606602	WXMXNFGTBDQKNZ-PGRDOPGGSA-N	432.952	1.848	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cccnc3S)CCO2)C1	1783338640	JQVUHZJCXIOEMX-DYVFJYSZSA-N	428.352	1.987	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)N1CC[C@@]2(C1)CN(C(=O)CO[Si](C)(C)C)CCO2	1783398738	QXSFKRFHIKROEX-LJQANCHMSA-N	429.590	1.193	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H]1Cc3ccccc3CN1)CCO2	1783533997	CPZPZSOZVLSWHJ-GZRFBZBPSA-N	436.350	1.314	50	20	IDGD	
CC(C)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cn3cc([N+](=O)[O-])cn3)C[C@@H]21	1783846372	QOTQOBMVGKSXDF-QEJZJMRPSA-N	427.889	1.036	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2	1783854528	OCZJXHDXPIAKQH-BWMZKYQQSA-N	447.359	1.808	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)N3CCN(C)CC3)C[C@@H]21	1784620645	GBBOTHUCTPQRMT-BCYZHJNNSA-N	429.005	1.010	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)C34CCC(CC3)CC4)C2)C1	1784729652	OHFCXGMERXIDQC-AWYJXPRZSA-N	441.532	1.099	50	20	IDGD	
CCc1[nH]nc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]32)c1F	1785794576	WBWVBHLSQZMGCC-WVPLEHFKSA-N	435.327	1.941	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](N)Cc3cscn3)[C@H]2C1	1787397416	YIEGWMNZQWWLRJ-TUUVXOQKSA-N	428.986	1.258	50	20	IDGD	
C[C@@H](Cn1cccn1)C(=O)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1	1788140275	RFOQXIIRGDWVJW-KRWDZBQOSA-N	446.316	1.647	50	20	IDGD	
CC(C)(C)OC(=O)CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]2C1	1788765694	PHZSTVZPSODXNE-JYJNAYRXSA-N	428.602	1.549	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Cl)C[C@@H]21)c1cc(Cl)cc2nn[nH]c12	1789283285	UWCFHXJIYDFOEF-ZUVQAIGSSA-N	430.267	1.739	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4cccnn4n3)C[C@@H]21	1789870685	ROYLOVZHHSWESW-HAHWVIBASA-N	440.331	1.559	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Cl)C[C@@H]32)cc1O	1790304196	SIKQTGPUICWVPH-MGBSGCIJSA-N	427.860	1.478	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1ccc(C2(NC(=O)CN3CCCCC3)CCC2)cc1	1791600215	UKNQCYIRKSHHQX-UHFFFAOYSA-N	429.565	1.979	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC1(c2ccc(NC(=O)Cc3cnn(C)c3)cc2)CCC1	1791906720	OSWUZBHTDOSNRT-UHFFFAOYSA-N	426.521	1.470	50	20	IDGD	
CC(C)N(CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCl)C(=O)OC(C)(C)C	1793106679	QASSYBUHDFUALU-FZKCQIBNSA-N	431.961	1.870	50	20	IDGD	
Cc1cccc(Cl)c1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1	1796191744	TXVIYBTUGMQYID-BCDXTJNWSA-N	426.709	1.894	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc2nc[nH]c12	1796606175	QLJXRWSYXWIVKP-BTTYYORXSA-N	433.472	1.127	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCc1cnc[nH]1)C2	1796890747	JXOXGJZARDDUGR-FWKYCFCSSA-N	425.493	1.115	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc3cccnn3c1)C2	1796893574	IXICPUYPZYAPPO-BECFQBPISA-N	447.499	1.720	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc2c1OCCO2	1796963532	BPVVEIIXAIGVOB-NFFDBFGFSA-N	439.306	1.444	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc2scnc2c1)c1cccc(B(O)O)c1	1798155096	PNLYXHHTGOTOBH-BCDXTJNWSA-N	435.314	1.542	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1Cc3ccccc3CN1)C2	1799275274	OBLJHHXSRKJENS-VPMQLGLMSA-N	440.371	1.527	50	20	IDGD	
Cn1nc2c(c1C(=O)N1C[C@@H]3COC[C@H](C1)[C@@H]3NC(=O)[C@](C)(Cl)CCl)CCC2	1799279321	IGGDDYMRBFFDQP-CVGJEZRXSA-N	429.348	1.348	50	20	IDGD	
C[Si](C)(C)c1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Br)co1	1799349892	MUGFQBACEFWHBY-AYRXBEOTSA-N	447.377	1.719	50	20	IDGD	
Cc1nc[nH]c1CSCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)Br	1800759155	IZCSRMGYWVKFGC-VFFTVRQLSA-N	445.383	1.324	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)N(C)C(=O)OC(C)(C)C)C2	1800977498	RZQGSYOKPNYWDF-RBGFHDKUSA-N	447.960	1.085	50	20	IDGD	
Cc1ccc([C@H](C)C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCC(=O)NN(C)C)cc1	1801013265	YWLJANDDUINVAI-UYZIEWPDSA-N	430.549	1.061	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)CN2C(=O)C=CC2=O)[C@H]1c1cccnc1	1803694728	LVFGZBNPBZAQGM-GUXCAODWSA-N	432.908	1.420	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H](CNC(=O)[C@@H]2CCC(=O)N2)[C@@H]1c1cccnc1	1806631030	BBKZPLLVOUYEJH-UTXMOHQDSA-N	437.338	1.397	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H](CNC(=O)CN2CCCC2=O)[C@H]1c1cccnc1	1806924094	PWYJQHUJODYDIP-DYESRHJHSA-N	432.597	1.561	50	20	IDGD	
Cc1ccsc1C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1807365540	YLZWZKNHSBRUMD-AZUAARDMSA-N	449.341	1.765	50	20	IDGD	
C#CCCCCC(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1807366880	HXVAGOMHHOSIDM-NZQKXSOJSA-N	433.317	1.275	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)S)[C@@H]1c1cccnc1	1808416875	SFSSNBWMGZMURH-GTPXHXMWSA-N	442.545	1.540	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)c1cnnc2ccccc12	1809135609	GCQAYIBWTXLVCK-YSSFQJQWSA-N	439.903	1.944	50	20	IDGD	
CCC1(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)CCC1	1809647516	QMLXNNNNRQSLHX-CTNGQTDRSA-N	435.333	1.661	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)c3ccc(F)nc3F)CC2)C1	1809973142	XAKXPEXATACJCE-UHFFFAOYSA-N	443.259	1.198	50	20	IDGD	
CCCC(=O)N[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)[C@H](Cl)COC)[C@@H]1c1cccnc1	1810513877	IGNOIDOJDKPLOJ-NOCIGQNYSA-N	438.956	1.646	50	20	IDGD	
Cn1ccc(CC(=O)N2CC[C@H](CNC(=O)CO[Si](C)(C)C)[C@H]2c2cccnc2)n1	1810542738	XPKDPDMTSGCCIZ-DYESRHJHSA-N	429.597	1.915	50	20	IDGD	
Cn1ccc(=O)cc1C(=O)NC[C@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1	1811361094	UBGAVWUOKKBASF-DNVCBOLYSA-N	447.333	1.885	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)c1cn2c(F)cccc2n1	1812178038	OQEUWPAGXQEPFP-ZSZQSSIHSA-N	445.882	1.788	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)[C@H](O)Cc2ccccc2)[C@@H]1c1cccnc1	1813034762	WVVHLBKCYJDJSP-UWHLTILDSA-N	445.947	1.945	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2sccc2F)[C@H]1c1cccnc1	1813069008	RNQIWFZNKCDODZ-KXBFYZLASA-N	447.536	1.975	50	20	IDGD	
O=C(O)c1cc(C(=O)N2CC[C@H](CNC(=O)C(Cl)Cl)[C@H]2c2cccnc2)ncn1	1813078213	RGRRCMKBJOUZDI-BXUZGUMPSA-N	438.271	1.693	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](O)CCl)CC2)c1ccc(-n2cnnc2)cc1	1814699766	XPYUATXEQPNPMR-WFASDCNBSA-N	446.920	1.549	50	20	IDGD	
Cc1cccc(C)c1C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1	1815343875	UEPYLLZTTSKMBB-QGZVFWFLSA-N	449.341	1.979	50	20	IDGD	
Cc1ccnc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)c1	1817474310	CXOBQNMRRGVOIS-LJQANCHMSA-N	433.277	1.413	50	20	IDGD	
COc1ccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)cc1	1817476538	JFQNFOBMZCXZRZ-FQEVSTJZSA-N	448.288	1.718	50	20	IDGD	
Cc1ncc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)CCC(=O)NN(C)C)CC3)s1	1817894772	YIKUAKFIWBPUSK-LLVKDONJSA-N	436.563	1.507	50	20	IDGD	
Cc1nc[nH]c1CSCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](O)CCl)CC2	1819627185	KOMMLQORQADHAQ-GXFFZTMASA-N	443.982	1.620	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc(O)nc2)n[nH]1	1820255273	SCEIFOGKOGZDIJ-HNNXBMFYSA-N	429.481	1.189	50	20	IDGD	
CCN(C)[C@H](C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1821626431	HDNGDEVWSQHCBF-CXAGYDPISA-N	442.524	1.054	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)C(O)O)[nH]n1	1821775685	KJVVJPPZYWRLML-MZTACXPWSA-N	431.399	1.598	50	20	IDGD	
CCCC(=O)N[C@@H](C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1	1822414910	NUIBSDHCELQKPJ-HOCLYGCPSA-N	449.556	1.080	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)C2=COCC2)n[nH]1	1822984863	KXIWAVUNDXOJEU-PDERCVKFSA-N	439.476	1.840	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](O)CCl)CC2)c1ccc(O)c([N+](=O)[O-])c1	1823222574	KGJSDKPPAJOGJX-ZANVPECISA-N	440.865	1.582	50	20	IDGD	
C[C@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1)C1(O)CCC1	1823732615	JZJFVWCWOHVJOT-UTKZUKDTSA-N	442.365	1.151	50	20	IDGD	
Cc1ccc(C(=O)NCC(=O)N2CCC([C@H]3CCCCN3C(=O)[C@H](O)CCl)CC2)cc1	1824188219	PUQAILSPVOFYOQ-WOJBJXKFSA-N	449.979	1.944	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc3ncccn3n1)CC2	1826000101	KWEUTJVUBRKYDN-WDEREUQCSA-N	434.909	1.665	50	20	IDGD	
Cc1ccc(C(=O)N[C@@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)c(O)c1	1826092144	OAKIGFWXDQNNCG-CYBMUJFWSA-N	445.545	1.756	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)CSc3nc[nH]n3)sc2C1	1826674344	BYQMQBACGFSBKW-HTQZYQBOSA-N	445.368	1.749	50	20	IDGD	
CCC1(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)COC1	1827060168	BTOPLHTXLSCKSH-FQEVSTJZSA-N	428.338	1.026	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1	1827428955	MNNRZBFUPIZSMU-HOTGVXAUSA-N	425.913	1.980	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cn[nH]c2)CC1	1827680806	WWAANAGHMIKJKC-CRXVIZHGSA-N	439.520	1.777	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2nccs2)CC1	1828925978	VUIAZZKFLSYPNX-KRWDZBQOSA-N	442.545	1.689	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2nccnc2C(N)=O)CC1	1829106032	HMFFCQUSNOXZLJ-MRXNPFEDSA-N	447.612	1.660	50	20	IDGD	
CC(C)[C@H](S)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)CBr)C2)C1	1831482999	JEHFRYOAYJYZBQ-JKIFEVAISA-N	437.400	1.428	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCCC(F)(F)F)CCO2)C1	1832264963	GRAVVRFJOAYBIF-BBRMVZONSA-N	430.851	1.429	50	20	IDGD	
O=C([C@H](F)Cl)N1CCOC[C@@]2(C1)CN(C(=O)C1(c3ccc(F)cc3)CC1)CCO2	1832386871	DNZLIMCRPPIGBU-QFBILLFUSA-N	428.863	1.848	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)CN3CCCC3)CC2)CC1	1833102734	CVHHOFPYHXCFAN-SFHVURJKSA-N	443.430	1.827	50	20	IDGD	
COc1cnc(C(=O)N2CCC(N3CCC(NC(=O)[C@H](O)CCl)CC3)CC2)c(F)c1	1833308289	PTEWMRSLIXYDBE-QGZVFWFLSA-N	442.919	1.014	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)C(Cl)(Cl)Cl)CC2)CC1)[C@@H](O)CCl	1833312581	YLYBUHCRDRUNMQ-LBPRGKRZSA-N	435.179	1.528	50	20	IDGD	
O=C(c1ccccc1O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1833758438	SJQWDBTXLFPQPU-WMLDXEAASA-N	431.258	1.153	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cc(C)n(C)n3)CC2)CC1	1834175867	OPRQTWZUKQZXMD-QGZVFWFLSA-N	425.961	1.168	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](C)N(C)C(C)=O)CC2)CC1	1835120392	BIXMDQUJGJLBMC-BEFAXECRSA-N	429.005	1.832	50	20	IDGD	
N[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1)c1cccc(Cl)c1	1835730977	PZEYIZGQKHDZOM-DAYGRLMNSA-N	434.295	1.331	50	20	IDGD	
Cn1cccc1C(=O)C(=O)N1CCC(N2CCC(NC(=O)CO[Si](C)(C)C)CC2)CC1	1835837321	BSSSKKZFFIMAJO-UHFFFAOYSA-N	448.640	1.631	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC1CCN(C2CCN(C(=O)[C@@H]3CCC(=O)N3)CC2)CC1	1836398452	KOGVDBOEAKDMLW-HNAYVOBHSA-N	433.380	1.073	50	20	IDGD	
Cc1nn[nH]c1C(=O)N1CCC(OC2CCN(C(=O)[C@@H](C)CBr)CC2)CC1	1836671269	UDCFYTCMKPJPES-LBPRGKRZSA-N	442.358	1.756	50	20	IDGD	
O=C([C@H](O)CCl)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CCC[C@H]3CCCC[C@H]31)CCO2	1836697295	KSGNXZQFCSETDC-ACMVSEJYSA-N	442.984	1.649	50	20	IDGD	
CCOC(CC(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1)OCC	1836719655	BEZZFHLIXWAUFV-QGZVFWFLSA-N	434.961	1.374	50	20	IDGD	
Cc1nc(C(=O)N2CCC(OC3CCN(C(=O)[C@@H](F)Cl)CC3)CC2)c(=O)[nH]c1C	1837266379	VUGNTXQGEKRPJR-MRXNPFEDSA-N	428.892	1.533	50	20	IDGD	
Cc1cc(/C=C/C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)no1	1837557290	GVDRSKSOZPEHAO-YTUMRWECSA-N	446.273	1.143	50	20	IDGD	
O=C(c1cc(O)n[nH]1)N1CCC(OC2CCN(C(=O)[C@H](F)Br)CC2)CC1	1837902971	TUZMXVMCDCFODO-AWEZNQCLSA-N	433.278	1.418	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(F)n3)CCO2)C1	1837910068	DZVVUXONRBNJCT-FZKQIMNGSA-N	444.301	1.464	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)[C@@H]3C=CCN3)CC2)CC1	1838065904	TUPRRVNOGHAPAL-SJORKVTESA-N	428.371	1.687	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(N(C)C)c3)CCO2)C1	1838925450	UQIPEOXZDOHQSI-NQIIRXRSSA-N	439.940	1.076	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccnn3-c3ccccc3)C2)C1	1839145064	SIBZCUIQJAZJJA-PGRDOPGGSA-N	446.935	1.960	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)nc1C	1839197574	BGQHBJPZLBLGFL-QAPCUYQASA-N	444.301	1.459	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCBr)C2)C1	1840031737	AZKIBFPFOXAOPU-BXUZGUMPSA-N	442.148	1.011	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3cncc(C)c3)C2)C1	1840150727	PRQRIIYMMKIMLU-GHTZIAJQSA-N	439.940	1.033	50	20	IDGD	
CCCc1onc(C)c1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](Cl)COC)CCO2	1840152320	FNHRPJXQCLCAMO-MGPUTAFESA-N	443.928	1.259	50	20	IDGD	
O=C(c1c[nH]c2nccc-2c1)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840187749	UMECYDRTCUMLKM-GOSISDBHSA-N	427.288	1.388	50	20	IDGD	
O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)CC[C@H]1CCOC1)CCO2	1840587822	IHCIWXILONLJAR-MAUKXSAKSA-N	433.343	1.045	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H](C(=O)N2CCCC23CN(C(=O)[C@@H](O)CCl)C3)[C@H](F)C1	1841517439	UZGZDFRGENBRHR-KFWWJZLASA-N	447.935	1.385	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)[C@H](C)n1cccc1C=O)C2	1843415790	MWEQVSIEAIJPLX-WTJYETQFSA-N	438.488	1.199	50	20	IDGD	
COc1ccc(C2(C(=O)N3CCCC34CN(C(=O)c3cccc(B(O)O)c3)C4)CCC2)cc1	1845161342	PJMCPAOVBRAMPF-UHFFFAOYSA-N	448.328	1.314	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCCC12CN(C(=O)CCNC(=O)c1ccc[nH]1)C2	1846069132	JXICCSXJJGUVHX-CYBMUJFWSA-N	425.327	1.512	50	20	IDGD	
COc1cc(C(=O)N2CC3(CCCN3C(=O)[C@H](C)Br)C2)c([N+](=O)[O-])cc1O	1846177673	CLGGKFFEHZTANO-JTQLQIEISA-N	442.266	1.909	50	20	IDGD	
COc1ccc(-c2cc(N)c(C(=O)NNC(=S)NCCCN3CCOCC3)s2)cc1	10836467	NQBUSCSRTUVUJL-UHFFFAOYSA-N	449.602	1.837	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C1CCN(C(=O)/C=C/c2ccccc2)CC1	15795087	BIADLKCJPZZOLR-ZJVMWOEPSA-N	435.480	1.926	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2ccc(C(=O)NNC(=O)c3ccccc3F)cc2)C[C@H](C)O1	15991479	DLCCCJVVVZOURS-KBPBESRZSA-N	435.477	1.698	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NN/C=C2/C(=O)NC(=O)c3ccccc32)c1	16719281	KAPFAUMEOYMMGI-QGOAFFKASA-N	442.497	1.263	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(C(=O)NNC(=O)CSc2ccc(C)cc2)cc1	26070730	TUCYSWPEVULEFA-UHFFFAOYSA-N	437.543	1.473	50	20	IDGD	
C#CCNS(=O)(=O)c1ccc(C(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)cc1	26531660	VKJXNPCKSYADQK-MRXNPFEDSA-N	429.498	1.443	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCN(CCc3ccccc3)CC2)cc1OC	29157118	WSXDCWJUWJMEPI-UHFFFAOYSA-N	426.517	1.325	50	20	IDGD	
COc1ccccc1S(=O)(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	104761093	YXLOGXSFYUPRSC-UHFFFAOYSA-N	439.515	1.103	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)c(C)c2)cc1C	105658357	XQDSOSKLSSLGNP-UHFFFAOYSA-N	433.530	1.767	50	20	IDGD	
Cc1cc(C)n2nc(NC(=O)NNC(=O)COc3ccc(Br)cc3)nc2n1	725852774	FZUNDELNJYMZOH-UHFFFAOYSA-N	434.254	1.735	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)NNC(=O)CNC(=O)c3cccs3)cc2C1	725873205	UZJJYYBOGULFNN-SNVBAGLBSA-N	435.531	1.340	50	20	IDGD	
NS(=O)(=O)c1ccc(OCCC(=O)NNC(=O)c2cc3c(s2)CCCCC3)cc1	726381447	BWNNLSFYPQEFKN-UHFFFAOYSA-N	437.543	1.895	50	20	IDGD	
CC[C@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	727116122	XONGBJBQXNIDNI-NSHDSACASA-N	434.902	1.052	50	20	IDGD	
CC(C)CC(=O)N1CCN(C(=O)CCCCCNC(=O)NNC(=O)C(C)(C)C)CC1	727481073	PRWZVHNRUJLYIW-UHFFFAOYSA-N	425.574	1.640	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NCCN(C(=O)OC(C)(C)C)C2CC2)c2ccccc2c1=O	727605880	FSUVCEWSVQQTKH-UHFFFAOYSA-N	444.492	1.277	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)c1cccc(S(=O)(=O)N(C)C)c1	727609132	HJHIOUCLEWMMDA-LBPRGKRZSA-N	435.462	1.550	50	20	IDGD	
O=C(NNc1nc(-c2ccccc2)no1)c1ccc(S(=O)(=O)N2CCOCC2)cc1	728080310	DRGLDQRDENNQDL-UHFFFAOYSA-N	429.458	1.514	50	20	IDGD	
COc1ccc(/C=C(/C#N)C(=O)O[C@H](C)C(=O)Nc2cccc(S(N)(=O)=O)c2)cc1	728881756	OSMXUHVLGFXGRD-NWFCWYBLSA-N	429.454	1.820	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)F)cc1)c1cccc(S(=O)(=O)NC2CC2)c1	728974561	UULUAJDEAQHCNX-UHFFFAOYSA-N	445.469	1.881	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCCCNC(=O)OC(C)(C)C)nc1	729052878	AWAJRNFDYJQVDS-UHFFFAOYSA-N	430.531	1.309	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)CCCc1ccc2c(c1)CC(=O)N2	729299987	IVJJHMZISBSKRL-UHFFFAOYSA-N	443.529	1.567	50	20	IDGD	
O=C(CNc1ccccc1)NNC(=O)Cn1cnc2ccc(Br)cc2c1=O	729513821	RUTVGFNWJNVQQA-UHFFFAOYSA-N	430.262	1.419	50	20	IDGD	
CC[C@@H](N=c1nn[nH]n1-c1ccccc1)C(=O)NNC(=O)Cc1ccc2ccccc2c1	729521781	BHRMQXPJUYSHLB-HXUWFJFHSA-N	429.484	1.818	50	20	IDGD	
C[C@H]1CCCC[C@@]12NC(=O)N(CC(=O)NNC(=S)Nc1ccc(N(C)C)cc1)C2=O	729689922	WPGKWFGINYYCIB-RNODOKPDSA-N	432.550	1.571	50	20	IDGD	
O=C(Cc1cc[nH]n1)NNC(=O)C1CCN(S(=O)(=O)c2ccc3c(c2)CCCC3)CC1	730102803	NEHWXJWGWZARQW-UHFFFAOYSA-N	445.545	1.079	50	20	IDGD	
O=C(CNC(=O)N1CCc2ccccc2C1)NNC(=O)c1nn(-c2ccccc2)cc1O	732261759	LUSRIXBLZZRTCC-UHFFFAOYSA-N	434.456	1.107	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)C1CCN(C(=O)COc2ccccc2)CC1	732302411	YLXVGLUPVQYAGV-UHFFFAOYSA-N	431.514	1.851	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)NCCCCN1C(=O)c2ccccc2C1=O	732472356	QZZHPNWUHLKMNS-CQSZACIVSA-N	442.447	2.000	50	20	IDGD	
COc1cc(C(=O)NCC(=O)NNc2ccc(Br)nc2)cc(OC)c1OC	732838002	DXMYZZFGXLYVFI-UHFFFAOYSA-N	439.266	1.743	50	20	IDGD	
CCc1cc(N2CCC[C@H](NC(=O)NNC(=O)[C@H](C)Oc3ccccc3F)C2)ncn1	732914590	UIXMOBPXKORZFD-HOCLYGCPSA-N	430.484	1.945	50	20	IDGD	
CC(C)[C@@H](C(=O)NNC(=O)c1cnn(-c2ccccc2)c1)N1C(=O)c2ccccc2C1=O	733108329	MKVAOCPOBKWCAB-IBGZPJMESA-N	431.452	1.954	50	20	IDGD	
COCCOC(=O)c1c(C)[nH]c(C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c1C	733110717	QITDOOCZRNMMAQ-UHFFFAOYSA-N	425.445	1.695	50	20	IDGD	
Cn1c(NNC(=O)c2ccc3c(c2)C(=O)N(C[C@H]2CCCO2)C3=O)nc2ccccc2c1=O	733260565	HREQLPBMXNXPMG-CQSZACIVSA-N	447.451	1.465	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)Cn1nc(-c2ccccc2)oc1=O	734249883	LPKZRVDPMQLBLR-UHFFFAOYSA-N	445.501	1.723	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)[C@@H]2CSc3ccccc32)CC1	735685969	HPRQUABENUYQII-OAHLLOKOSA-N	433.559	1.350	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)Cc3cc(C)on3)c2)cc1	735837693	UUXWLRSLCWUKHS-UHFFFAOYSA-N	444.469	1.796	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)[C@@H]2CCCN(C(=O)COc3ccccc3)C2)c1O	741279956	SOLYTHHINFVSBP-OAHLLOKOSA-N	427.457	1.479	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)N2CCN(CC[S@](C)=O)CC2)c(C)n1C[C@H]1CCCO1	741297473	SUNSCSHTZGDNFF-KKTSHXMHSA-N	432.590	1.714	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)[C@H](c1cccc(F)c1)N1CCOCC1	742075571	FBALKIXQABUOCO-INIZCTEOSA-N	439.488	1.054	50	20	IDGD	
CC(C)=CC(=O)NCc1ccc(C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1	742473908	JNRHPRQGRZNCRM-UHFFFAOYSA-N	433.468	1.591	50	20	IDGD	
COc1cccc(O[C@H](C)CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)c1	743509967	OECSQPPSDPQYSI-CYBMUJFWSA-N	435.506	1.400	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)NCCN2CCN(Cc3ccccc3)CC2)cc1	743543909	MRLVAXRZCGYIQK-UHFFFAOYSA-N	439.564	1.906	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)[C@@H](C)NC(=O)c2cc3c(C)nn(C)c3s2)cn1	743823460	ORJXHCBVKAIAKK-SNVBAGLBSA-N	447.546	1.483	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCOCC3)o2)c(Cl)c1	743824552	PFJAJLYGJQOBDF-UHFFFAOYSA-N	442.881	1.729	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCCN2c3ccccc3C[C@H]2C)c2ccccc2c1=O	744886207	VXVCTOPSGWJEAC-OAHLLOKOSA-N	434.500	1.812	50	20	IDGD	
Cc1cc(N2CC[C@H](NC(=O)NNC(=O)CSc3ccc(Cl)cc3)C2=O)n(C)n1	745904767	DDRIKQJMTCOUSB-AWEZNQCLSA-N	436.925	1.610	50	20	IDGD	
C[C@H]1C[C@H](NC(=O)NNC(=O)CSc2ccc(Cl)cc2)C(=O)N1c1cnn(C)c1	745919024	QDERVKWVPURPHH-NHYWBVRUSA-N	436.925	1.690	50	20	IDGD	
COc1cc(C(=O)NNC(=O)N2CCOCC2)c([N+](=O)[O-])cc1OCc1cscn1	745996388	VSPFSWVECVQBFW-UHFFFAOYSA-N	437.434	1.326	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)[C@@H]2CCCN(C(=O)NC3CCCC3)C2)c2ccccc2c1=O	746096510	IRPNMKRTLHFRLU-CQSZACIVSA-N	440.504	1.059	50	20	IDGD	
O=C(CCN/C(O)=C1\N=CC=CC1=O)NNC(=O)NCc1cccc(C(F)(F)F)c1	746173225	RUSNQXKCPDEYAZ-FOCLMDBBSA-N	425.367	1.452	50	20	IDGD	
Cc1cccc(C)c1NCC(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	746690017	WNNRLJWJMCBVEC-UHFFFAOYSA-N	432.550	1.190	50	20	IDGD	
Cc1nc([N+](=O)[O-])cn1CCC(=O)NNC(=O)COc1ccc(Br)cc1	747120479	IIVDSBRRYXGCJP-UHFFFAOYSA-N	426.227	1.479	50	20	IDGD	
COCCOCC(=O)NC1CCC(C(=O)NNC(=O)c2cn(C)c3ccccc23)CC1	748700039	WEILTXSYRKEOHQ-UHFFFAOYSA-N	430.505	1.277	50	20	IDGD	
COCCS(=O)(=O)c1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)cc1	750093400	ZSVYSVFDVOWWMR-UHFFFAOYSA-N	433.486	1.123	50	20	IDGD	
O=C(CC1CCCCC1)NC1CCC(C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)CC1	751061288	DTDIKLZYHWGRGQ-CGZBRXJRSA-N	427.567	1.214	50	20	IDGD	
O=C(O)c1cc([N+](=O)[O-])cc(S(=O)(=O)NNC(=O)c2cccc(OC(F)F)c2)c1	751142166	HXYLEADUIOWHDH-UHFFFAOYSA-N	431.329	1.518	50	20	IDGD	
CS(=O)(=O)N1CCC[C@@H]1CNC(=O)NNC(=O)c1ccc(COc2ccccc2)o1	752997973	ITZSTTZENISRQU-CQSZACIVSA-N	436.490	1.227	50	20	IDGD	
CC[C@@H](CNC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)Oc1cccc(F)c1	753349387	XYFYGRNYTXCVRQ-AWEZNQCLSA-N	427.436	1.874	50	20	IDGD	
CCn1c(=O)nc(O)c2c(C(=O)NNc3ccccc3S(C)(=O)=O)cc(C3CC3)nc21	754419107	FJWRVYPJHPITRT-UHFFFAOYSA-N	443.485	1.555	50	20	IDGD	
COc1cc(C(=O)NNC(=O)N[C@@H]2CCN(c3ncccc3F)C2)cc(OC)c1OC	755075253	PDFFCQGIXZGNFA-CYBMUJFWSA-N	433.440	1.469	50	20	IDGD	
Cc1sc2nc(CS[C@@H](C)C(=O)NNc3ccc(C(N)=O)nn3)nc(O)c2c1C	757393017	TYDZTBYJHUDLGC-VIFPVBQESA-N	433.519	1.668	50	20	IDGD	
C[C@H]1C[C@H](C)CC2(C1)NC(=O)N(CC(=O)NNC(=S)Nc1ccc(N(C)C)cc1)C2=O	757649853	XGTNHEZYXVMLMH-KBPBESRZSA-N	446.577	1.817	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)Nc2ccc(F)cc2CS(C)(=O)=O)c1	757677440	HGCROPUAYARZGN-UHFFFAOYSA-N	425.438	1.854	50	20	IDGD	
COc1c(F)cc(F)cc1NC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1	757686448	HHZISKIEACAXIQ-UHFFFAOYSA-N	442.444	1.755	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)C(C)(C)NC(=O)C(F)(F)F)c2ccccc2c1=O	757820268	WPYGARXMMNTSBP-UHFFFAOYSA-N	427.383	1.025	50	20	IDGD	
Cc1ccc(-c2nnc(S)n2CCC(=O)NNC(=O)C(=O)Nc2ccccn2)cc1	758829417	DKQAALWTGPFDOY-UHFFFAOYSA-N	425.474	1.113	50	20	IDGD	
COCCS(=O)(=O)c1ccc(CNC(=O)NNC(=O)Nc2ccc(N(C)C)cc2)cc1	759290481	DYVYIZRNAZDUAA-UHFFFAOYSA-N	449.533	1.709	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)c1cnn(CC(=O)NC2CCCC2)c1	762371261	UANFNLXIEGGGMZ-UHFFFAOYSA-N	431.518	1.504	50	20	IDGD	
Cc1ccc(C(=O)N2C[C@@H](C)C[C@@H](C)C2)cc1NC(=O)C(=O)NNC(=O)c1cccnc1	763490682	BHZYCDXPHHLTLW-GASCZTMLSA-N	437.500	1.908	50	20	IDGD	
Cc1cc(C(=O)N2CCCC2)ccc1NC(=O)C(=O)NNC(=O)c1ccc2c(c1)OCO2	763551397	NOWSHASJIARXEX-UHFFFAOYSA-N	438.440	1.359	50	20	IDGD	
CC1(C)CN(C(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c2cccc(Cl)c21	763570903	GUURWICCXHBKCI-INIZCTEOSA-N	429.860	1.952	50	20	IDGD	
CC[C@@H](C)NS(=O)(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2cc(C)oc2C)c1	763585432	AOKOJPSCJOWENN-LLVKDONJSA-N	436.490	1.373	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C(C)(C)C)cc2)c(OC)n1	763600639	RUNRBVIAPHCNTG-UHFFFAOYSA-N	430.461	1.561	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)c(Br)n1	763601179	PRHMRBRFUCOJEE-UHFFFAOYSA-N	443.261	1.942	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)NCc1ccc(N2CCCS2(=O)=O)cc1	763642115	OVQBDJPLZCJXKN-UHFFFAOYSA-N	436.465	1.275	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)C(=O)Nc1c(F)cccc1Br	763680678	VDHBYYWRLLCJOD-UHFFFAOYSA-N	428.189	1.892	50	20	IDGD	
COC(=O)c1cc(F)c(F)cc1NC(=O)C(=O)NNC(=O)COc1ccc(Cl)cc1	763685956	GJWQOXJRHARGBQ-UHFFFAOYSA-N	441.774	1.570	50	20	IDGD	
O=C(COc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1ccn(Cc2ccccc2)n1	763686988	YCGQOAWUTFUNFJ-UHFFFAOYSA-N	427.848	1.750	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F	763838994	XDAJNOTZZCUWEX-UHFFFAOYSA-N	442.306	1.500	50	20	IDGD	
COC(=O)c1c(C2CC2)csc1NC(=O)C(=O)NNC(=O)COc1ccc(F)cc1	763843468	QQMMZTYYDDZWKP-UHFFFAOYSA-N	435.433	1.716	50	20	IDGD	
CNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc3ccccc3c2)cc1	763848330	BTWKHFYYBOFCDS-AWEZNQCLSA-N	434.452	1.753	50	20	IDGD	
CCN(CC)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)cc1	763852357	WUYFHZXEALBOAU-AWEZNQCLSA-N	444.463	1.861	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(C(N)=O)c(C)c2)cc1	763859636	DEGPADYULYNFDU-ZDUSSCGKSA-N	428.445	1.046	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccc([S@](C)=O)c(F)c1	763863868	DRHJPBTYJUQIHC-WIONRGSFSA-N	425.413	1.256	50	20	IDGD	
COC(=O)c1ccc(OC)cc1NC(=O)C(=O)NNC(=O)CSc1ccc(C)cc1	763896489	NYEIOBDTXIXQPY-UHFFFAOYSA-N	431.470	1.668	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)C(=O)Nc1ccc(Br)cc1	763951104	YZFHGOAWQGFTKI-UHFFFAOYSA-N	444.245	1.740	50	20	IDGD	
O=C(CC(F)(F)F)NNC(=O)C(=O)Nc1cccc(F)c1I	764115821	XLEHUYIHUXNHKD-UHFFFAOYSA-N	433.099	1.469	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2cc(NC(=O)C(C)C)ccc2C)c1O	764133850	YCXPCFKZFMCHEY-UHFFFAOYSA-N	428.445	1.703	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CCCc2ccccc2)cc1S(=O)(=O)N(C)C	764224282	NMSJTULPFJWIJR-UHFFFAOYSA-N	446.529	1.354	50	20	IDGD	
COc1cc(OC)c(OC)cc1NC(=O)C(=O)NNC(=O)c1cccc(OC(F)F)c1	764250175	KTAGEEVUXJAPED-UHFFFAOYSA-N	439.371	1.714	50	20	IDGD	
CS(=O)(=O)CCc1ccc(NC(=O)C(=O)NNC(=O)CCCc2cccs2)cc1	764342044	AASBYIALTDDJKY-UHFFFAOYSA-N	437.543	1.444	50	20	IDGD	
CS(=O)(=O)c1ccc(OCCNC(=O)NNC(=O)CSc2ccccc2O)cc1	764403467	JBYPRPHWECSQCJ-UHFFFAOYSA-N	439.515	1.297	50	20	IDGD	
O=C(NNC(=O)[C@H]1COCCO1)C(=O)Nc1cccc(Sc2ccc(Cl)cc2)c1	764425014	MJFDOOJINWOFMV-MRXNPFEDSA-N	435.889	1.993	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N2CCC(C(=O)NNc3nccnc3OC)CC2)cc1	764463859	JSCJDHZITUITMC-UHFFFAOYSA-N	435.506	1.428	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)Nc3ccc([N+](=O)[O-])cc3)CC2)cc1	765313893	WONUWVATRWAZKG-UHFFFAOYSA-N	426.477	1.874	50	20	IDGD	
COc1cc(C)c(Br)cc1NC(=O)C(=O)NNC(=O)[C@H]1Cc2ccccc2O1	765375349	CGANKEHYDREJRB-MRXNPFEDSA-N	448.273	1.856	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2nccnc2OC)c(I)c1	765699493	TUSKTIOUJAOZIM-UHFFFAOYSA-N	443.201	1.180	50	20	IDGD	
C[C@H](Oc1ccccc1Cl)C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765737185	XFAPATVVSINONK-INIZCTEOSA-N	444.919	1.713	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)c1cc(F)cc([N+](=O)[O-])c1	765755473	HTXOETWAISUJSX-UHFFFAOYSA-N	449.870	1.966	50	20	IDGD	
C[S@](=O)c1ccc(C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)cc1	765757855	XVKQMSQDSGUBRQ-PMERELPUSA-N	448.976	1.656	50	20	IDGD	
CN1CCO[C@@H]([C@@H](NC(=O)NNC(=O)CNC(=O)c2ccco2)c2ccc(Cl)cc2)C1	766321923	SVSLZIYAXAWZAF-AEFFLSMTSA-N	449.895	1.065	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)c1cc(F)cc2nc[nH]c12	766661707	YLQLSJHHSVBKFI-UHFFFAOYSA-N	444.898	1.934	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)c2csc(S(C)(=O)=O)c2)c2ccccc2c1=O	766759077	PGNKRPDXKNMPFI-UHFFFAOYSA-N	434.499	1.517	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)NCCS(=O)(=O)c1ccc(Cl)cc1	766885435	NXLPIOGYXFIODI-UHFFFAOYSA-N	431.923	1.844	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(O)c(C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)c1	766949704	HNAKTTBFVZQXNQ-UHFFFAOYSA-N	429.458	1.107	50	20	IDGD	
COc1cc2c(cc1NC(=O)C(=O)NNC(=O)COc1ccc(C)c(C)c1)NC(=O)CC2	768233293	MWPHWBMINONETA-UHFFFAOYSA-N	440.456	1.362	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)[C@H](Cc1ccc(F)cc1)n1nnnc1C	768635511	CWTMFMFKVIAPJT-HNNXBMFYSA-N	448.480	1.460	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)CCNC(=O)c1ccc([N+](=O)[O-])cc1	768641294	REQLYJPANRENDH-UHFFFAOYSA-N	436.446	1.270	50	20	IDGD	
O=C(COc1ccc(OCc2ccccc2)cc1)NNC(=O)c1cnc2c(c1)NC(=O)CO2	770574206	IDMZTGJCBGPOQX-UHFFFAOYSA-N	448.435	1.832	50	20	IDGD	
CC/C=C(/C)C(=O)N1CSC[C@@H]1C(=O)NNc1nc(O)c2cnn(C(C)(C)C)c2n1	770959790	ZSKZGXMIIKBQOL-LWMSPQMPSA-N	433.538	1.988	50	20	IDGD	
Cc1nn(Cc2ccc(C(=O)NNc3nc(O)c4cnn(C)c4n3)cc2)c(C)c1[N+](=O)[O-]	770980727	TYNXRYVNHMUGNV-UHFFFAOYSA-N	437.420	1.596	50	20	IDGD	
CCCOc1cccc(CCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1	771555260	HQTCNAZUIXETGM-UHFFFAOYSA-N	448.545	1.912	50	20	IDGD	
Cc1nn(C)c(C)c1S(=O)(=O)N[C@@H](C)C(=O)NNc1ccc(Br)c(F)c1	771691419	TWEDZFFWFSHREE-VIFPVBQESA-N	448.318	1.749	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Cc2cc(F)ccc2OC)c1	772868280	OYZAFXXYERKYNW-UHFFFAOYSA-N	437.493	1.869	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2ccc3occ(C)c3c2)c2ccccc2c1=O	773494459	RZEJFBASSGTACP-UHFFFAOYSA-N	433.424	1.871	50	20	IDGD	
Cn1cc(NC(=O)C(=O)NNC(=O)c2ccc(Br)s2)c(C(F)(F)F)n1	773530469	JTHBFDDKHNMBBK-UHFFFAOYSA-N	440.201	1.663	50	20	IDGD	
O=C(NNc1nc2ccccn2n1)N[C@@H]1CCN(c2cccc(Br)c2)C1=O	775220087	AQGVKVSLOOJHEZ-CYBMUJFWSA-N	430.266	1.923	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNS(=O)(=O)c2cc(OC)ccc2O)c1	775671553	HNTWCOQOXZPHPP-UHFFFAOYSA-N	431.264	1.795	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1ccc(Br)cc1C(F)(F)F	776292517	ASDAFLQAPRGEPZ-SSDOTTSWSA-N	429.214	1.664	50	20	IDGD	
CCc1ccccc1S(=O)(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	777639884	MKQPGEXGPDBPHC-UHFFFAOYSA-N	430.530	1.017	50	20	IDGD	
Cc1ccccc1C1(C(=O)N2CCN(S(=O)(=O)CBr)CC2)CCOCC1	777831636	GGHJOXUVQXPGEW-UHFFFAOYSA-N	445.379	1.870	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNC(=O)c2cc(S(=O)(=O)N(C)C)cn2C)cc1	778530297	NBTUOSCODLCNBZ-UHFFFAOYSA-N	436.534	1.775	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)NC[C@@H]1CCN(c2ccc(F)c(F)c2)C1	778629932	BIVYHGJZAOIEKZ-LBPRGKRZSA-N	427.452	1.646	50	20	IDGD	
O=C(NNc1ccc(F)c(F)c1F)C(=O)Nc1ccc(C(=O)N2CCOCC2)c(F)c1	778697973	VWTJTLFRFHIXHN-UHFFFAOYSA-N	440.353	1.797	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)Nc1ccnn1Cc1cccc(Br)c1	779473980	SADDBEPVQLMAEP-LBPRGKRZSA-N	440.298	1.898	50	20	IDGD	
CCOC(=O)N1CCC([C@@H](C)NC(=O)NNC(=O)Cc2nc3ccccc3n2C)CC1	779668372	AZTZGOOWMPFAOY-CQSZACIVSA-N	430.509	1.703	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNS(=O)(=O)c2cn3c(n2)CCCC3)c1	779831421	AGYYOVYUATZFBA-UHFFFAOYSA-N	429.296	1.614	50	20	IDGD	
CS(=O)(=O)N1CCN(C(=O)c2ccc(OS(=O)(=O)CCCCCl)cc2)CC1	780781788	FUPXGEAYWHKJHY-UHFFFAOYSA-N	438.955	1.132	50	20	IDGD	
CN(C1CCCCC1)S(=O)(=O)c1ccc(NC(=O)C(=O)NN=c2cc[nH]cc2)cc1	783378314	FDPFKEDPUJMHSA-UHFFFAOYSA-N	431.518	1.539	50	20	IDGD	
COC[C@@H](C)n1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)n1	783409765	VFRGJFCHVQSUFM-SNVBAGLBSA-N	449.411	1.466	50	20	IDGD	
Cc1csc(Sc2ccc(NC(=O)C(=O)NN[C@]3(C)CCS(=O)(=O)C3)cc2)n1	783428518	WUTMPHQZDKQZLL-QGZVFWFLSA-N	440.572	1.739	50	20	IDGD	
C[C@@H](C#N)CSc1ccccc1NC(=O)C(=O)NNC(=O)CNC(=O)c1cccs1	784005337	WEMDMXCRERNBBT-LBPRGKRZSA-N	445.526	1.516	50	20	IDGD	
O=C(NNc1ccc(Br)cn1)C(=O)Nc1ccn(CCc2ccncc2)n1	784341491	OQHMKUVJRNROCC-UHFFFAOYSA-N	430.266	1.760	50	20	IDGD	
CS(=O)(=O)c1ccc(F)c(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2Cl)c1	784381399	GFLMLBDQEPXKFJ-UHFFFAOYSA-N	430.801	1.873	50	20	IDGD	
CNC(=O)[C@H]1CN(C(=O)C(=O)NNc2ccc(OC(F)(F)F)cc2)c2ccccc2O1	784803720	LNKSWESXPRPVRL-OAHLLOKOSA-N	438.362	1.569	50	20	IDGD	
Cc1ccc(-n2cc(C)cn2)c(NC(=O)C(=O)NNc2cccc(S(C)(=O)=O)c2)c1	784841367	GDDYXBJXFBMKOR-UHFFFAOYSA-N	427.486	1.974	50	20	IDGD	
CCN(C(=O)Cc1ccc(NC(=O)C(=O)NNc2nccn(C)c2=O)cc1)c1ccccc1	785090827	YQQGGOLWUFQXQK-UHFFFAOYSA-N	448.483	1.458	50	20	IDGD	
C[C@H]1[C@@H](C(=O)NNC(=O)c2csc(N3CCOCC3)n2)CCN1C(=O)OC(C)(C)C	786258019	XMDLKNNZSHLKFH-STQMWFEESA-N	439.538	1.386	50	20	IDGD	
C[C@H]1CN(C2CCOCC2)CCN1C(=O)NNC(=O)c1cccc(Br)c1	787859547	RKGKTPUALVWECZ-ZDUSSCGKSA-N	425.327	1.989	50	20	IDGD	
COC(=O)c1cc(NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c(C)cc1C	788313227	POPGLKKFZPVUBK-UHFFFAOYSA-N	426.477	1.949	50	20	IDGD	
N#Cc1cnc2c(c1)CCCC2=NNC(=O)C(=O)NN=C1CCCc2cc(C#N)cnc21	788407888	HMNVTGKTUOAKID-UHFFFAOYSA-N	426.440	1.233	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)Nc2ccc3c(c2)CC(=O)N3C)c2ccccc2c1=O	788707409	KOQBHXDWEMCTTB-UHFFFAOYSA-N	434.456	1.963	50	20	IDGD	
Cn1nc(-c2ccc(F)cc2F)cc1NC(=O)C(=O)NNC(=O)CCc1ccccc1O	789734146	DJCJPYODJOFLQV-UHFFFAOYSA-N	443.410	1.790	50	20	IDGD	
CCCc1csc(NC(=O)C(=O)NNC(=O)c2cc(Br)ccc2O)n1	789735251	WHUJCYICYARANO-UHFFFAOYSA-N	427.280	1.963	50	20	IDGD	
O=C(NNC(=O)[C@H]1OCC[C@H]1c1ccccc1)C(=O)Nc1ccn(CC(F)(F)F)n1	789820622	SKTXKJWNRDBNAM-JSGCOSHPSA-N	425.367	1.104	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)N[C@H]1CCN(Cc2ccc(F)cc2)C1=O	790677428	ODJVXUJXOVOMSR-HNNXBMFYSA-N	431.380	1.185	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)c1cn(C)c2c(cnn2C)c1=O	791196686	SICSBADTCXUVRU-SNVBAGLBSA-N	448.277	1.263	50	20	IDGD	
Cc1nc2cc(C(=O)NNc3ccc(S(=O)(=O)N4CCN(C)CC4)cc3)ccc2o1	792267545	MOSGSJJVJRIQNX-UHFFFAOYSA-N	429.502	1.829	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)[C@@H]2Cc3cc(Br)ccc3O2)C[C@@H](C)O1	792629483	POSSMLFIULHAQF-HSMVNMDESA-N	426.311	1.399	50	20	IDGD	
COc1ccc(CCN2C[C@@H](C(=O)NNC(=O)c3cccc(C)n3)CC2=O)cc1OC	794080898	SQYZKIGCXDHXMB-INIZCTEOSA-N	426.473	1.259	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(-n3nccc3C(F)(F)F)cc2)n1	797371440	UTSKZTDASKWQAA-UHFFFAOYSA-N	432.362	1.994	50	20	IDGD	
COc1cc2c(cc1S(=O)(=O)NNC(=O)C13CC4CC(CC(C4)C1)C3)OCC(=O)N2	797427967	MEZZOTXSLBCGPV-UHFFFAOYSA-N	435.502	1.552	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)C(C)(C)c3c(C)noc3C)CC2)cc1	797742401	GVCDCXOZAQDADY-UHFFFAOYSA-N	427.549	1.843	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2SCCO)cc1C	798308371	WZRDSLLKRUXRHC-UHFFFAOYSA-N	432.458	1.696	50	20	IDGD	
O=C(NCC(F)(F)F)NNC(=O)c1sccc1S(=O)(=O)NCc1cccs1	798314208	BHDNDHJKTJMWPY-UHFFFAOYSA-N	442.466	1.794	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)NCc2ccc(I)c(Cl)c2)cn1	800025288	LPAJRWDXCLJSCK-UHFFFAOYSA-N	433.637	1.822	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)Nc1cc2c(cc1N1CCCCC1)n(C)c(=O)n2C	800593090	UKKRQZQWGZTEAJ-AWEZNQCLSA-N	448.524	1.072	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)c2ccc(S(N)(=O)=O)s2)c(OC)cc1Cl	802084469	WXFHLAAWDQXMES-UHFFFAOYSA-N	434.883	1.533	50	20	IDGD	
CCN1CCC[C@H]1CN1C[C@@H](C(=O)NNC(=O)Nc2cc(OC)ccc2Cl)CC1=O	802107986	FFACXBXYWWLDPL-KBPBESRZSA-N	437.928	1.834	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(OC(F)F)nc2)cc1	802566211	DVYMPDCQLFRPGF-LLVKDONJSA-N	438.387	1.635	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)N2CCC[C@@H]2C[C@]2(C)NC(=O)NC2=O)c1C	804555473	PNIVZBWIGBWVEM-HQEPXSAESA-N	427.505	1.638	50	20	IDGD	
O=C(Cc1ccccn1)NNC(=O)C(=O)Nc1ccc2nccnc2c1Br	806978946	NVXKTPBNRMPCIW-UHFFFAOYSA-N	429.234	1.116	50	20	IDGD	
COc1cc(OC)c(Cn2nccc2NC(=O)C(=O)NNc2ncccc2F)c(OC)c1	807301779	ILLYYFFYKABPAN-UHFFFAOYSA-N	444.423	1.573	50	20	IDGD	
CN(NC(=O)Nc1ccc2c(c1)C(=O)OC2)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	808895778	RPUCEVLPAITSGJ-UHFFFAOYSA-N	433.465	1.998	50	20	IDGD	
NC(=O)c1ccc(OCC(F)F)c(NC(=O)C(=O)NNc2ncccc2C(F)(F)F)c1	810391689	GXPVIPWSERGHJZ-UHFFFAOYSA-N	447.320	1.925	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)NCC(=O)NNc2ccc(OC(F)F)cc2)cc1	810686001	HHMBSTASNRJZPH-UHFFFAOYSA-N	428.417	1.668	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)NCC(=O)NNc2ccccc2OC(F)(F)F)cc1	811221974	RZOFDBGZLGGPLD-UHFFFAOYSA-N	446.407	1.965	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NN=C3COc4cc(F)ccc43)CC2)cc1	814878673	GKUHZTSYNUSFTF-UHFFFAOYSA-N	446.504	1.353	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1ccc(NC(=O)C2CC2)cc1	815752357	ORFQEDUFTYQSAX-UHFFFAOYSA-N	445.501	1.367	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1cncc(Br)c1	815752545	WPALWWFZAQJKRC-UHFFFAOYSA-N	442.295	1.176	50	20	IDGD	
C[C@H](C(=O)NNc1ccccc1S(=O)(=O)N(C)C)C1CN(C(=O)OC(C)(C)C)C1	817053364	OCPSWIMNJLEKAU-ZDUSSCGKSA-N	426.539	1.883	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)[C@H](O)[C@H](O)c1nc2ccccc2s1	817054077	RWHFWERRWNAGTC-CVEARBPZSA-N	436.515	1.084	50	20	IDGD	
NC(=O)N[C@H](CC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)c1cccs1	821892735	PHPZYYWDIQTEII-QGZVFWFLSA-N	444.561	1.207	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)CCNS(=O)(=O)c2cc(C)ccc2C)c1	825777356	VMSWDIWPMPZKQJ-UHFFFAOYSA-N	434.518	1.240	50	20	IDGD	
CCCCOc1ccc(C(=O)NNS(=O)(=O)c2ccc3c(c2)oc(=O)n3C)cc1OC	903952606	RYCWRPZLGYIFNH-UHFFFAOYSA-N	449.485	1.942	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2ccncc2)cc1S(=O)(=O)NCc1ccccn1	912768770	JCRQEFQVFFWUKB-UHFFFAOYSA-N	441.469	1.039	50	20	IDGD	
CCCCN(C(=O)COC(=O)/C(C#N)=C\c1cc(C#N)n(C)c1C)[C@H]1CCS(=O)(=O)C1	913286904	MWGVQRPXNSZXKK-XUKORKDYSA-N	446.529	1.471	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)C[C@@H]2CCCO2)c1	915636542	OSNPQGBDIYBEKS-HNNXBMFYSA-N	433.486	1.826	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cnn1C(C)(C)C	915657886	HRLXOKFEUKPJCN-UHFFFAOYSA-N	433.534	1.806	50	20	IDGD	
COc1ccccc1OCCNC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	915890166	XHBZBLGWKWXMGC-UHFFFAOYSA-N	441.532	1.617	50	20	IDGD	
CCCn1nc(C(=O)NN=C2C(=O)Nc3cc(OC)c(OC)cc32)c2ccccc2c1=O	915946180	BJWSXPVDHVJPAV-UHFFFAOYSA-N	435.440	1.910	50	20	IDGD	
CCN1CCN(CC(=O)NNC(=O)c2cc3c(s2)CC[C@H](C(C)(C)C)C3)C(=O)C1=O	916144988	DVIZKFLBPLIRAA-AWEZNQCLSA-N	434.562	1.351	50	20	IDGD	
O=C(COc1ccc(OCc2ccccc2)cc1)NNC(=O)NC[C@@H]1CCS(=O)(=O)C1	916375231	PJBYIEIVEINIQI-KRWDZBQOSA-N	447.513	1.410	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1)c1nncn1C	916580447	AHOGDDBZZYOZOE-AWEZNQCLSA-N	446.475	1.222	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2ccc(C#N)c(Cl)c2)cc(OC)c1OC	917718157	XUKQBSOVWDTADT-UHFFFAOYSA-N	425.850	1.861	50	20	IDGD	
COc1ccc([C@@H]2CCCN2C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1OC	918779492	XBATYNLPVIEJBE-KRWDZBQOSA-N	437.460	1.871	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)c2ccc3c(=O)n(-c4ccccc4)c(O)nc3c2)c1O	919755707	VWUARKPEQKJJMB-UHFFFAOYSA-N	446.419	1.880	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NCc2ccc(F)cc2Br)c2ccccc2c1=O	919786250	LYCKXFJUZVABJF-UHFFFAOYSA-N	448.252	1.979	50	20	IDGD	
Cc1nc([N+](=O)[O-])cn1CCC(=O)NNC(=O)[C@@H](C)Oc1cccc(Br)c1	921059380	VHVCOJUOAKFVKK-SNVBAGLBSA-N	440.254	1.867	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)[C@H](C)OC[C@@H]1CCCCO1	921225869	KXGSJZCGVYHQSP-JSGCOSHPSA-N	428.869	1.627	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)NCc2cccnc2N2CCN(C)CC2)c1	921247146	BIYPQKICEXPUGP-UHFFFAOYSA-N	426.521	1.360	50	20	IDGD	
Cc1ccn(-c2cccc(C(=O)N3CCN(S(=O)(=O)CBr)CC3)c2)n1	1116593726	YWXQNVJDNAMJET-UHFFFAOYSA-N	427.324	1.621	50	20	IDGD	
Cc1nnc(O)c(CNC(=O)NNC(=O)[C@@H](C)Oc2cccc(Br)c2)c1C	1318567720	VYQGBOJMAZMTPF-LLVKDONJSA-N	438.282	1.859	50	20	IDGD	
O=C(CN1C(=O)N[C@]2(CCc3ccccc32)C1=O)NNc1cncc(Br)c1	1320252692	UNAGLNHFGLSIDZ-SFHVURJKSA-N	430.262	1.681	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)NCCc2cn3c(n2)SCC3)CC1	1320755077	HUAUQTGJIVOVFC-UHFFFAOYSA-N	438.554	1.509	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCCCN2C(=O)NC(C)(C)C2=O)ccc1OC(C)C	1342020211	SORKHPPJITVCQX-UHFFFAOYSA-N	435.481	1.147	50	20	IDGD	
CCc1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1	1779032683	QZJYBOSWXKHHCM-QHCPKHFHSA-N	437.500	1.005	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(-c4cccnc4)[nH]n3)C2)C1	1779611874	XIZDUCXADYFPRI-ORAYPTAESA-N	448.321	1.699	50	20	IDGD	
CN(C)c1ccc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)cn1	1779763328	HJISZTHTLLYUTB-PBHICJAKSA-N	429.290	1.282	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)c(O)c1	1780552950	KGQQHRKVSHYUEF-YOEHRIQHSA-N	431.258	1.535	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cnc4sc(C)cn4c3=O)CCO2)C1	1781218463	HVWJATKTRCNVDT-KUHUBIRLSA-N	438.937	1.525	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)c3ccnc4c3OCO4)CCO2)C1	1781231189	HERJAJSPPQTAQO-MSOLQXFVSA-N	430.288	1.490	50	20	IDGD	
Cc1cncc(CCC(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)c1	1781325673	GYBMTPZMHVSIAF-AEFFLSMTSA-N	428.302	1.843	50	20	IDGD	
O=C(c1ccc(OCC2CC2)cc1F)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1781435518	VIBUJMWNAIAUGV-WIYYLYMNSA-N	440.899	1.658	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)c3cccc(F)c3Cl)C2)C1	1781683791	UILPOIWVQWLLFP-HXUWFJFHSA-N	440.903	1.296	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CN1CCSCC1)C2	1781995193	CWPUVACOQBNDPR-IIDMSEBBSA-N	448.427	1.333	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(F)c(N(C)C)c(F)c3)C2)C1	1782110396	VDPVODCYTYOMNX-XOBRGWDASA-N	445.894	1.728	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(OC)nc1)C2	1782172008	KKVQCFKEDTWFCM-RZQQEMMASA-N	425.913	1.472	50	20	IDGD	
Cc1cc(CC(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)CCBr)C3)no1	1782460613	DNNGIBHJINFXGY-CRAIPNDOSA-N	428.327	1.824	50	20	IDGD	
CCOCC(=O)N1CCO[C@]2(CCN(C(=O)[C@H](Br)Cc3ccccc3)C2)C1	1783024174	VBQUDXLVBJYWBK-YLJYHZDGSA-N	439.350	1.859	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCN2CCCC2)C1	1783319808	GEZONKJTOBBAKF-FRQCXROJSA-N	430.387	1.770	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cnoc3COC)CCO2)C1	1783348303	XXJOXTFQHFZCBM-GUYCJALGSA-N	430.299	1.438	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc4cnccc4n3)CCO2)C1	1783534802	OYXNZHBKBAEIPK-YJYMSZOUSA-N	433.306	1.857	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)CCc3ccc(F)c(F)c3)CCO2)C1	1783869207	OLHPKADFMZYOJG-FOIQADDNSA-N	430.879	1.981	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cc([N+](=O)[O-])c(O)cc3C)CCO2)C1	1783880268	GXTJFTJLXXUPFI-IFXJQAMLSA-N	441.868	1.306	50	20	IDGD	
O=C(c1cc(Cl)nc2n[nH]cc12)N1CCO[C@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783946235	YZPVIALGCFJZBI-INIZCTEOSA-N	432.695	1.859	50	20	IDGD	
Cc1cccc(C)c1NC(=O)C(=O)N1CCO[C@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783947730	YMTKQZFMPVDHBF-IBGZPJMESA-N	428.316	1.876	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](NC(C)=O)C(C)(C)C)C[C@@H]21	1784615115	IBFHEBKAVRVAMD-KFGODFMUSA-N	429.989	1.924	50	20	IDGD	
O=C(c1ccc(C(F)(F)F)cc1F)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1785198736	HMSWFWBZTKGRHI-PBHICJAKSA-N	438.805	1.888	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](N)Cc3cscn3)[C@H]2C1	1787398348	VYOPZUIIVUXQRC-GKHXFJEZSA-N	449.404	1.229	50	20	IDGD	
C[C@@H](C(=O)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1)N1C[C@H]2C[C@H]2C1	1789440445	DCFHSSQKXJCOBL-YTQUADARSA-N	447.344	1.454	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN3CCSCC3)C[C@@H]21	1789868028	ORXRBXRGMIPSAD-YRBFXIGRSA-N	438.421	1.251	50	20	IDGD	
Cc1n[nH]c(C)c1CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]2C1	1789872307	QCLVDEHTOOOBRB-QBWPOKONSA-N	431.364	1.785	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)c1ccc(O)cc1F	1790084435	SJWKIIVKXPESRZ-MOUXYMJCSA-N	433.249	1.815	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nnsc3C3CC3)C[C@@H]21	1791058013	VOVJSLJPSFLINB-IXOXFDKPSA-N	443.367	1.792	50	20	IDGD	
Cc1nccn1CC(=O)Nc1ccc(C2(NC(=O)c3cnccc3C(=O)NN)CCC2)cc1	1791108957	RKCNGGYFMWWMAK-UHFFFAOYSA-N	447.499	1.638	50	20	IDGD	
COc1ccc(COCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Cl)C[C@@H]32)cc1	1791386059	IMXRJOOQUWQDHF-XPYUAMARSA-N	428.888	1.726	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1cccc2ncccc12)c1ccc(B(O)O)cc1	1793547763	XQZWUCNSHAXBND-WKCHPHFGSA-N	443.312	1.409	50	20	IDGD	
Cc1ccn2ncc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@H](C)CBr)C4)c2c1	1796269023	JATQYOVINCRZCI-ZXFNITATSA-N	449.349	1.877	50	20	IDGD	
COc1ccc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Cl)cc1OC	1796364901	OKRRRHMYJMCKTB-GTYSZEQSSA-N	428.888	1.760	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C[C@@H](C)NC(=O)OC(C)(C)C	1796390703	WAUJJWSOOUTGSR-OWVAZHOYSA-N	447.960	1.133	50	20	IDGD	
CC(C)(C)OC(=O)N1CCO[C@H](C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](F)Cl)C1	1796805086	YUGMNISGNLSEMO-AICCOOGYSA-N	433.908	1.795	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnc2ccccn12	1796953863	MXHRSVCDQOOLJB-UESRRSCYSA-N	425.316	1.774	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(-n3cncn3)c1)C2	1797956515	ZRYBIPSRDZVRPP-XEMDLRDOSA-N	443.580	1.322	50	20	IDGD	
CC(=O)OC[C@@H](OC(C)=O)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](C)CBr)C2	1798470257	MUUMVIYZRROBAD-LMXXTMHSSA-N	447.326	1.150	50	20	IDGD	
COC(C)(C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O	1798521692	USSOKIMIDVAITD-ZSBFGKGUSA-N	449.460	1.148	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(Cl)ccc1OC	1799022521	IUJWLJKFIHJIKG-DJZPMSPPSA-N	431.316	1.806	50	20	IDGD	
O=C(Cc1[nH]nc2c(Cl)cccc12)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2	1799075732	MNUFVDNCQJFFPG-CWWXITJESA-N	429.279	1.883	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CC12CCCN1CCC2	1799214638	LWRDQNJXOCUDDP-LORHWOILSA-N	432.392	1.831	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c(c1)SCC(=O)N3)C2	1799269704	KJCZQCQRTQQDMO-AHXJXLJNSA-N	437.949	1.951	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CC(=O)Nc1ccc(F)cc1	1799794121	DUJLSQDJVYZIHX-BCDXTJNWSA-N	447.511	1.166	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)n[nH]1)C2	1800332984	KESDECJYUFQVRL-RMRMTIIFSA-N	443.410	1.204	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1[nH]nc3ncccc13)C2	1800639947	QZJZPFKZAZJNKR-XCCSTKFXSA-N	436.310	1.335	50	20	IDGD	
CCOC(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](Br)CC)OCC	1800644451	UMMMBCHXJSGLEZ-LOUJCGABSA-N	435.359	1.539	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)C1CC(F)(F)C1	1802632658	OOSAHMKUHPKSGR-VQIMIIECSA-N	443.259	1.126	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)[C@H]1C[C@H]1C1CC1	1802991557	YQOVEXPDSHYKCR-JKLQHZFJSA-N	433.317	1.127	50	20	IDGD	
Cc1cc(C(=O)NC[C@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)no1	1805837403	NXGGJFJFPXKZRZ-DNVCBOLYSA-N	449.471	1.010	50	20	IDGD	
Cc1cc[nH]c1C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1807361669	HBPLVSFEGIYYEQ-NQIIRXRSSA-N	432.289	1.031	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)C(Cl)Cl)[C@@H]1c1cccnc1)c1cnc(O)nc1O	1808283030	ZAQPCMSUMGJCNU-ZYHUDNBSSA-N	426.260	1.406	50	20	IDGD	
COC(=O)NCC(=O)N1CC[C@H](CNC(=O)[C@H](F)Br)[C@@H]1c1cccnc1	1808680113	HVKFMUDECPPKCL-XBFCOCLRSA-N	431.262	1.134	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)c1snnc1C1CC1	1808850361	KUZMSNRUNXJEFH-SQWLQELKSA-N	435.937	1.730	50	20	IDGD	
O=C(NCC(=O)N1CCCC2(CCN(C(=O)[C@@H](F)Br)CC2)C1)c1ccco1	1810144424	UWPMBFOWWDPARZ-OAHLLOKOSA-N	444.301	1.931	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@H](CNC(=O)Cn2ccncc2=O)[C@@H]1c1cccnc1	1812342739	BRMCYQWQEFOYNY-UWJYYQICSA-N	443.580	1.196	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)CC(F)(F)F)[C@@H]1c1cccnc1	1813071890	VSUSWHCTVNSPPR-RDTXWAMCSA-N	429.443	1.413	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H]2CCCCO2)n[nH]1	1814505824	HPNUUECYHQXIHN-SJORKVTESA-N	441.492	1.283	50	20	IDGD	
O=C(CCC(=O)N1CCCC1)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1	1815639327	XLZCGDWUXHOTSU-CABCVRRESA-N	425.917	1.404	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](F)Br)CC2	1817305908	ZTAFTVIANLVBOM-GMEUVTARSA-N	435.319	1.612	50	20	IDGD	
Cc1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2	1817766942	GCXUXGRJPZSOIE-OAHLLOKOSA-N	436.302	1.066	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1)c1ccc2nc(CO)[nH]c2c1	1818538444	JIZIDWFZVVSZPV-HZPDHXFCSA-N	446.895	1.684	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc(O)cc2)n[nH]1	1820579901	SXQXPEUWYJNUOV-KRWDZBQOSA-N	428.493	1.794	50	20	IDGD	
CC[C@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](C)NS(=O)(=O)CC)[nH]n1	1820855775	WXVPJMJHMZXSPR-SGMGOOAPSA-N	433.962	1.747	50	20	IDGD	
C=C[C@H](O)C(C)(C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1	1822416147	RWGMIYSUMSFTOU-CVEARBPZSA-N	434.541	1.348	50	20	IDGD	
CN(C)C(=O)NCC(=O)N[C@@H]1CCc2nc(NC(=O)[C@@](C)(Cl)CCl)sc2C1	1822858038	TWYXJXUBKLYPII-ABKXIKBNSA-N	436.365	1.563	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)[C@H]1CCCS1	1823010395	YQBVAMKPWQLLDF-IAGOWNOFSA-N	428.323	1.291	50	20	IDGD	
C=CCC(F)(F)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(B(O)O)cc1)CC2	1825249991	BLHITWLODGPTKR-ZDUSSCGKSA-N	435.261	1.260	50	20	IDGD	
COc1cc(C(=O)N[C@@H]2CCc3nc(NC(=O)[C@H](C)Br)sc3C2)n(C)n1	1825636120	AQFPNARLHYPHCE-DTWKUNHWSA-N	442.339	1.894	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)Cn1ccncc1=O)CC2	1825646503	DAXLSKRSOFOKPL-NXEZZACHSA-N	440.323	1.095	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CNC(=O)c1ccco1)CC2	1825999011	LKAAJCVLWKHKFE-WDEREUQCSA-N	440.909	1.332	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)C13CC(C(=O)OC)(C1)C3)CC2	1826005055	ZHPCEJIBUFHWHM-VYKCNYFWSA-N	441.937	1.652	50	20	IDGD	
C[C@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1)n1cccc1	1827055477	YMXPDMLUOIEUDU-XMSQKQJNSA-N	437.349	1.662	50	20	IDGD	
C[C@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1)c1ccccn1	1827060340	YEMRVIWIVJATPK-FDDCHVKYSA-N	449.360	1.798	50	20	IDGD	
CC(C)(C#N)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1	1828922333	SPQAOMPTKNWUPU-GOSISDBHSA-N	426.521	1.468	50	20	IDGD	
Cc1ncc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)s1	1830538541	IRKZIBOFOUNTFG-SJKOYZFVSA-N	446.367	1.553	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)ccn1	1830539143	CMRBHGUSAJRBLU-AUUYWEPGSA-N	440.338	1.491	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3ccoc3)C2)C1	1830545688	LRPQBRNUJVVHOX-KXBFYZLASA-N	443.338	1.700	50	20	IDGD	
O=C([C@@H](O)CCl)N1CCC([C@H]2CCCCN2C(=O)c2c(O)cc(O)cc2O)CC1	1830642449	DGCJQSMYDWFCFE-PBHICJAKSA-N	426.897	1.636	50	20	IDGD	
O=C(c1c(F)cccc1Cl)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1830731201	HTXUFHGKFLIZBP-KDOFPFPSSA-N	435.279	1.149	50	20	IDGD	
O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)CSC1CCCC1)CCO2	1831357184	IPMWMSCPYWLQHT-SFHVURJKSA-N	449.411	1.904	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4cccnn4n3)C2)C1	1831654023	HLLKHAQZOGNALM-OXJNMPFZSA-N	435.912	1.207	50	20	IDGD	
C=CCSCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)CBr)C2)C1	1832446967	NMVYJASWLUCZTH-WMLDXEAASA-N	435.384	1.393	50	20	IDGD	
CC(C)N[C@@H](C(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)CCl)CC2)CC1)C(C)C	1833310803	SYMITLZXSUUPLY-RBUKOAKNSA-N	431.021	1.180	50	20	IDGD	
O=C(c1ccnc(C(F)F)c1)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1833324566	UURVNYYASILLRL-QGZVFWFLSA-N	438.258	1.893	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCC(N2CCC(NC(=O)c3cnc(O)nc3O)CC2)CC1	1835069612	PNROXYQXIPHZEK-UHFFFAOYSA-N	439.944	1.338	50	20	IDGD	
Cc1cnc2c(C(=O)N3CCC(N4CCC(NC(=O)[C@H](F)Cl)CC4)CC3)cnn2c1	1835080557	NSKRFFORINFYPV-KRWDZBQOSA-N	436.919	1.757	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3nn[nH]c3C(F)(F)F)CC2)CC1)[C@@H](F)Cl	1835082155	UQRRNLOFWICQQM-CYBMUJFWSA-N	440.829	1.543	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](N)Cc3cccnc3)CC2)CC1	1835099424	XPYILSDNQUKZFX-PMACEKPBSA-N	436.000	1.540	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC(OC2CCN(C(=O)[C@@H]3CNC(=O)O3)CC2)CC1	1836669720	GGJIWOYCAZPBFK-DOMZBBRYSA-N	446.342	1.124	50	20	IDGD	
O=C1Cc2cccc(C(=O)N3CCC(OC4CCN(C(=O)[C@@H](O)CCl)CC4)CC3)c2N1	1836719598	ZXRWJYLTBDKFPF-SFHVURJKSA-N	449.935	1.393	50	20	IDGD	
CC(C)n1nccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1838018233	BBZXTPQSTSQCRG-FQEVSTJZSA-N	426.945	1.799	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(=O)c4ccccc4o3)C2)C1	1839141590	NBVDROMTSDTBAN-OPAMFIHVSA-N	448.903	1.880	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3CC(c4ccccc4)=NO3)C2)C1	1839141791	SISNNWOEKHNREK-LRXVAGHRSA-N	449.935	1.653	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(O)c(F)c3)CCO2)C1	1839305647	UTMRVZCPZYBCKT-RTBURBONSA-N	449.306	1.838	50	20	IDGD	
Cc1cccn2ncc(C(=O)N3CCO[C@]4(COCCN(C(=O)C(Cl)Cl)C4)C3)c12	1839612215	FKYHQYJMISNLIK-LJQANCHMSA-N	441.315	1.516	50	20	IDGD	
CCc1nc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)co1	1840033531	IHICUIJXYNJZTC-PXAZEXFGSA-N	430.299	1.090	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3c(C)cc(C)cc3C)CCO2)C1	1840673567	IVKCNTPZXCWDRX-AVRDEDQJSA-N	438.952	1.936	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)c2cccn2C)C1	1842363262	AXYLNFCDJXWWTE-UHFFFAOYSA-N	426.429	1.989	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)Cc2ccc(C(F)(F)F)cc2)C1	1842722381	WLZKLDOEDRPUIY-UHFFFAOYSA-N	446.234	1.445	50	20	IDGD	
O=C(CN1C(=O)C2(CCOCC2)c2ccccc21)N1CC2(CCCN2C(=O)[C@H](F)Cl)C1	1843365375	MNDXSIPOESLNCK-SFHVURJKSA-N	449.910	1.819	50	20	IDGD	
CC(C)C[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)[C@H](O)CCl)C2	1847087571	YOZYVDQEKCLUAO-LSDHHAIUSA-N	431.961	1.729	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)c2ccc(S(=O)(=O)NCc3ccco3)cc2)c1	17199079	FRPMDEJGLAHUOK-UHFFFAOYSA-N	443.481	1.907	50	20	IDGD	
O=C(NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12)c1cc([N+](=O)[O-])c[nH]1	24120313	KOFDSLAEPRNMKR-UHFFFAOYSA-N	432.396	1.756	50	20	IDGD	
COc1ncccc1C(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	46542794	UOQHJBRHFAEADZ-UHFFFAOYSA-N	440.481	1.644	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1ccc2c(c1)OCCO2)c1cccc(S(=O)(=O)N(C)C)c1	727608658	CUTPHFONZXCSQC-ZDUSSCGKSA-N	448.501	1.413	50	20	IDGD	
Cc1c(NNC(=O)NCCC(=O)N2CCN(c3ccccn3)CC2)cccc1[N+](=O)[O-]	728132419	QSFCCIITEXQYIK-UHFFFAOYSA-N	427.465	1.663	50	20	IDGD	
CN(C)N(C(=O)COc1ccc(I)cc1)[C@H]1CCS(=O)(=O)C1	728180662	VUMMJIIUSBKLAJ-LBPRGKRZSA-N	438.287	1.162	50	20	IDGD	
C#CCNC(=O)CN1CCN(C(=O)/C(C#N)=C/c2cc(C)n(C[C@@H]3CCCO3)c2C)CC1	728533496	KVXKYEVAGIVWRK-AMUNLKFJSA-N	437.544	1.085	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CCc2nc(O)c3cnn(-c4ccccc4)c3n2)c1	728828057	IKIDMHOUEPWLRR-UHFFFAOYSA-N	427.424	1.787	50	20	IDGD	
C[C@@H]1CN(c2ccc(C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)cn2)C[C@@H](C)O1	728848223	ZYBKIXRNUKTJTJ-HZPDHXFCSA-N	439.520	1.163	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)nnn1-c1ccccc1Cl	728856092	QSSHUJSFVFCXTK-UHFFFAOYSA-N	437.847	1.551	50	20	IDGD	
CC[C@H](NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)c1ccc2c(c1)OCCO2	728959289	JHNJASNVSVSKSL-KRWDZBQOSA-N	440.504	1.946	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Cc2ccccc2C(F)(F)F)c1	729297883	KNFPADMWXPOMRV-UHFFFAOYSA-N	429.420	1.959	50	20	IDGD	
CC(=NNC(=O)c1ccc(C)cc1O)c1cccc(N(S(C)(=O)=O)S(C)(=O)=O)c1	729816896	UWDKWXDPLJNFHG-UHFFFAOYSA-N	439.515	1.580	50	20	IDGD	
O=C(COC(=O)[C@H]1CC(=O)N(c2ccc(F)cc2)C1)NNC(=O)c1cccc(Cl)c1	730367790	KRJVOEXNRIWSQG-ZDUSSCGKSA-N	433.823	1.836	50	20	IDGD	
CN(C(=O)c1ccco1)c1ccccc1C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	730999581	ZCVCRKXBQKJBJK-UHFFFAOYSA-N	431.412	1.607	50	20	IDGD	
N#CC1(C(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)CCOCC1	731487253	HRYNSMSLJOLELA-UHFFFAOYSA-N	431.456	1.470	50	20	IDGD	
Cc1nn(CCO)c2ncc(C(=O)OCC(=O)NNC(=O)c3ccc(Cl)cc3)cc12	732334392	HUBWYSNMIMOEGJ-UHFFFAOYSA-N	431.836	1.003	50	20	IDGD	
CCc1cc(N2CCC[C@H](NC(=O)NNC(=O)C(=O)Nc3ccc(C)c(C)c3)C2)ncn1	732915020	YCOHKBGVCJPACI-SFHVURJKSA-N	439.520	1.594	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCCOC[C@H]1CCCO1	734518987	MJNBXXXDVIEXGG-IUODEOHRSA-N	430.299	1.742	50	20	IDGD	
CCOCCCN1CC[C@H](NC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)[C@H](C)C1	734542022	KGHONLLIUPSIQJ-AEFFLSMTSA-N	444.536	1.659	50	20	IDGD	
O=C(NC[C@H]1COCCO1)NNc1ccc(S(=O)(=O)NC2CCCCCCC2)cn1	735582524	PKSYRMDHCOTVMF-INIZCTEOSA-N	441.554	1.514	50	20	IDGD	
CN1CC[C@H](NC(=O)/C(C#N)=C/c2cn(CCC(N)=O)nc2-c2ccc(Cl)cc2)C1=O	737993281	GRKGIJBGSOQVMT-SHRNQRGKSA-N	440.891	1.333	50	20	IDGD	
CCc1cc(NNC(=O)C2CCN(c3ccc4nnnn4n3)CC2)nc(-c2ccccn2)n1	738532356	VCKHESUURURNEU-UHFFFAOYSA-N	445.491	1.293	50	20	IDGD	
Cc1cc(CNC(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)n[nH]1	739020687	PUURVFOWAMBSJB-UHFFFAOYSA-N	431.456	1.621	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)cc1NC(=O)Nc1ccccc1	741214575	YIKQYUFXKMQRAH-MRXNPFEDSA-N	445.501	1.770	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)N[C@H](C)[C@@H]2CN(Cc3ccccc3)CCO2)cc1	741425202	KSJNCFSEZFXXDS-UTKZUKDTSA-N	442.516	1.694	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2ccc(C(=O)O)c(F)c2)ccc1OC(C)C	742231600	OUJYZKYFHATQBO-UHFFFAOYSA-N	426.422	1.943	50	20	IDGD	
O=C(Cc1cccc(F)c1)NCCNC(=O)NNC(=O)c1cccc(Br)c1	743685483	BEQJSWAVWQMIAA-UHFFFAOYSA-N	437.269	1.891	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)nc1	743805071	DQFYNPAEZQPWMW-UHFFFAOYSA-N	441.535	1.664	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1	743805302	TZKDZESDJHSHAO-UHFFFAOYSA-N	445.545	1.455	50	20	IDGD	
COc1ccc([C@@H](CC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)NC(C)=O)cc1	743830446	FHCVJSDBZMPTMZ-GOSISDBHSA-N	448.501	1.519	50	20	IDGD	
COC(=O)COc1ccc(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)cc1	744621006	LYUPPPRFLLIHHA-UHFFFAOYSA-N	449.485	1.016	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])cc1	745049993	JXDPCYNWUQLGQZ-UHFFFAOYSA-N	446.803	1.893	50	20	IDGD	
O=C(COC(=O)c1csc(-c2ccccc2)n1)NNC(=O)[C@@H]1COc2ccccc2O1	746244044	NCRUYTSHOLRIPG-KRWDZBQOSA-N	439.449	1.954	50	20	IDGD	
COc1ccccc1[C@@H](NC(=O)NNC(=O)Cc1cn2ccccc2n1)c1nccn1C	746740025	GIKFTXIYROZUKT-HXUWFJFHSA-N	433.472	1.739	50	20	IDGD	
O=C(COC(=O)C1CC(OCc2ccccc2)C1)NNC(=O)[C@@H]1COc2ccccc2O1	747050956	CIZHSSPTOVLHRU-UHYCVJNDSA-N	440.452	1.512	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNc3nccn(C)c3=O)c2)cc1	747942436	VOGZWYFULGSVMI-UHFFFAOYSA-N	429.458	1.347	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)[C@]1(F)CCN(C(=O)OC(C)(C)C)C1	748542801	RZJAURDNZZDZBP-SFHVURJKSA-N	433.481	1.191	50	20	IDGD	
CN(C(=O)OC(C)(C)C)[C@H]1CCN(C(=O)NNC(=O)CNC(=O)c2cccs2)C1	750274571	GJQQLGIBIQLIMI-LBPRGKRZSA-N	425.511	1.160	50	20	IDGD	
O=C(O)CCC(=O)c1ccc(S(=O)(=O)NNC(=O)c2nnc(-c3ccccc3)o2)cc1	751210062	ALSQDGZOVPWEEW-UHFFFAOYSA-N	444.425	1.407	50	20	IDGD	
NC(=O)c1cc(CNC(=O)NNC(=O)[C@H]2Cc3ccccc3CN2Cc2ccccc2)on1	752157327	ZDTLMJATQCREAL-HXUWFJFHSA-N	448.483	1.231	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)NCc2ccc(S(=O)(=O)NC[C@H]3CCCO3)cc2)o1	752364985	QOZYUEWVPJQLBO-OAHLLOKOSA-N	436.490	1.190	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)[C@H](CCS(C)(=O)=O)NC(=O)c2ccccc2Cl)o1	752523446	XDCXARDPWJLROY-AWEZNQCLSA-N	441.893	1.236	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cc(C)nc3ccccc23)cc1S(=O)(=O)N(C)C	754777353	FBCNIGZPODLVMP-UHFFFAOYSA-N	442.497	1.877	50	20	IDGD	
CCCCCc1nnc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)s1	755427726	DIJFYLGPJDJHCU-UHFFFAOYSA-N	440.551	1.988	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)Nc2ccc(NC(=O)CN3CCOCC3)cc2)c1	755599124	LQMTWCAJXFJXOR-UHFFFAOYSA-N	440.504	1.490	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1ccc(N2C[C@H]3CC[C@H]2C3)cc1	756189199	KAWNAEBUUKMWIE-BBRMVZONSA-N	441.513	1.253	50	20	IDGD	
CC[C@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)[C@@H]1CCCO1	756736224	DFCIXMJUHROHAG-ROUUACIJSA-N	438.550	1.763	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)Nc1cccc(S(=O)(=O)Nc2nccs2)c1	756873804	KHSORANUAKNFJG-UHFFFAOYSA-N	432.487	1.734	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)n(C2CCN(C)CC2)n1	756919963	JZCIEYXRPJLLNY-UHFFFAOYSA-N	438.492	1.816	50	20	IDGD	
CCCSc1nsc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)n1	757695073	CTASCLAELFDNPM-UHFFFAOYSA-N	444.564	1.757	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NC[C@@H](C)c2nc(C)cs2)cc1	758682938	BVTNJBKRJRZHSD-CYBMUJFWSA-N	439.563	1.515	50	20	IDGD	
COc1ccc(N2C[C@@H](C(=O)NNC(=O)CSc3ccccc3OC)CC2=O)cc1	761624949	NBFSVJPGJDNDSW-AWEZNQCLSA-N	429.498	1.996	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)Cn1cc(Br)ccc1=O	761627833	SQFXVAVXHIJXAY-UHFFFAOYSA-N	426.292	1.559	50	20	IDGD	
Cc1sc(Cl)nc1C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	762844542	YGASFFRSNFVJRN-UHFFFAOYSA-N	428.923	1.964	50	20	IDGD	
O=C(NNc1nccc(N2CCOCC2)n1)c1ccc2c(c1)C(=O)N(Cc1ccco1)C2=O	762861237	KUGYDAVJWDKEKD-UHFFFAOYSA-N	448.439	1.459	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccncc2Br)c1	763117607	WLMHEOGFCIDSSG-UHFFFAOYSA-N	427.280	1.169	50	20	IDGD	
O=C(Cc1ccncc1)NN=Cc1ccc(OCCn2cc(C(=O)O)nn2)c(Cl)c1	763180282	VGKGCDQOJMVGRK-UHFFFAOYSA-N	428.836	1.797	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)Nc1ccc(CN2C(=O)CNC2=O)cc1	763484933	XXRTXFAJYOZSFY-UHFFFAOYSA-N	448.480	1.196	50	20	IDGD	
O=C(NNC(=O)c1cccnc1)C(=O)Nc1cccc(C(=O)Nc2ccc(Cl)cn2)c1	763489214	WWTUBDCGUNRVFT-UHFFFAOYSA-N	438.831	1.782	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(-c2nnco2)ccc1C	763662838	KUJXSBLCGRJJDN-UHFFFAOYSA-N	425.401	1.219	50	20	IDGD	
CC[C@@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)cc1	763680160	CVBOPKZVSIMCKJ-CQSZACIVSA-N	437.456	1.251	50	20	IDGD	
O=C(Cc1ccc(Cl)cc1)NNC(=O)NCc1ccc(N2CCCS2(=O)=O)cc1	763703587	DXSYOSJZSGFEST-UHFFFAOYSA-N	436.921	1.953	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)C(=O)Nc1ccc(F)c(Br)c1	763791689	XMSIBKZKGQGJRF-UHFFFAOYSA-N	448.208	1.637	50	20	IDGD	
CC(C)(C)Cc1nc(-c2cccc(C(=O)NNC(=O)CNC(=O)c3cccnc3)c2)no1	763823734	KVYJCGPIZITUNH-UHFFFAOYSA-N	436.472	1.911	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)Nc2ccccc2N2CCC(C(N)=O)CC2)cc1	763831278	IBVHMNLEPTYRQB-UHFFFAOYSA-N	437.500	1.350	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)cc1C	763849287	KRMWHCSXQXXUPF-HNNXBMFYSA-N	427.457	1.952	50	20	IDGD	
Cc1cc(C)n(-c2ccc(NC(=O)C(=O)NNC(=O)Cc3c[nH]c4ccccc34)cn2)n1	763860982	NDCKTICGXSNVNS-UHFFFAOYSA-N	431.456	1.694	50	20	IDGD	
CC(=O)Nc1ccc(Cl)c(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)c1	763868036	ZWJDDVVRMYSDQC-JTQLQIEISA-N	436.827	1.991	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)N2C[C@H](C)Oc3ccccc32)cc1	763870657	BIWOKISSPVMFJQ-ZFWWWQNUSA-N	425.441	1.618	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(-c3cc[nH]n3)cc2)cc1	763873005	QYOOTIWRIOVVFM-AWEZNQCLSA-N	435.440	1.833	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cccc(-c3nnco3)c2)cc1	763873701	XUGABUVJVBQFPJ-CYBMUJFWSA-N	437.412	1.493	50	20	IDGD	
CCC(C)(C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cccn2C)cc1Cl	763998051	FCSICXXTNFDDCZ-UHFFFAOYSA-N	433.896	1.997	50	20	IDGD	
NC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cccc(C(F)(F)F)c2)ccc1Cl	764037555	OAGFJINWQMUJAJ-UHFFFAOYSA-N	428.754	1.857	50	20	IDGD	
CCNC(=O)N1CCc2ccc(NC(=O)C(=O)NNC(=O)c3ccc(Cl)nc3)cc21	764100271	LEDUZNPNXYKIKD-UHFFFAOYSA-N	430.852	1.227	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cccc(-n4cccn4)c3)n[nH]2)cc1	764111814	QZKYWEQKISISMJ-UHFFFAOYSA-N	429.440	1.971	50	20	IDGD	
O=C(CCc1ccccc1)NNC(=O)C(=O)Nc1ncn(Cc2ccc(Cl)cc2)n1	764201771	BPPSILPYRRNIDD-UHFFFAOYSA-N	426.864	1.699	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)C(=O)Nc2cnn(C(C)(C)C)c2)c1	764230435	IDBSUIMDZKOBNJ-UHFFFAOYSA-N	438.282	1.809	50	20	IDGD	
COCCCn1ccc(NC(=O)C(=O)NNC(=O)c2cc(F)ccc2Br)n1	764276439	DOYGUXASVBNTKU-UHFFFAOYSA-N	442.245	1.221	50	20	IDGD	
CNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2ccc(OC)c(Br)c2)c1	764327428	ZVIIXHNDIMBUCM-UHFFFAOYSA-N	449.261	1.217	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)C(=O)Nc1ccnc(OCC(F)(F)C(F)F)c1	764354438	QMAQGFDQUFOSPS-UHFFFAOYSA-N	429.330	1.084	50	20	IDGD	
C[C@H]1CN(c2ccccc2NC(=O)C(=O)NNC(=O)COCc2ccccc2)C[C@H](C)O1	764366154	KHJCXHGCPFAFNT-IRXDYDNUSA-N	440.500	1.603	50	20	IDGD	
CC(=O)Nc1cc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)ccc1Cl	764401131	LHIYOCXTCRPMEA-UHFFFAOYSA-N	436.877	1.882	50	20	IDGD	
CC(=NNC(=O)CN1CCN(Cc2ccc(C)cc2)CC1)c1cccc(-n2cnnn2)c1	764826552	FRIKTISPBADNCG-UHFFFAOYSA-N	432.532	1.629	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)[C@H]1CCCN(S(=O)(=O)c2ccccc2)C1	765248466	SHQBWSQKHFULIY-HNNXBMFYSA-N	449.554	1.733	50	20	IDGD	
C[C@H](C(=O)NNC(=O)CSc1ccccc1O)N1CCN(c2ccc(F)cc2)CC1	765252551	MURZAAOVCSYGEU-OAHLLOKOSA-N	432.521	1.982	50	20	IDGD	
CNC(=O)[C@@H]1CCC[C@H]1NC(=O)NNC(=O)[C@H](C)Oc1cccc(Br)c1	765649963	XMVXSUMKPGQPKM-ZLKJLUDKSA-N	427.299	1.462	50	20	IDGD	
O=C(/C=C\c1ccc(Cl)cc1)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765739249	RMPGIYJEQORSKB-FLIBITNWSA-N	426.904	1.959	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cnc4c(cnn4C(C)C)c3)CC2)cc1	765753967	HEYZENAAOWLRAX-UHFFFAOYSA-N	449.559	1.899	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1ccccc1C(=O)N(C)C1CCCCC1	766271761	PNVORYQUQMWRKI-UHFFFAOYSA-N	426.477	1.972	50	20	IDGD	
CCC[C@H]1CN(CC(=O)NNC(=O)c2cc(Cl)ccc2OC)CCN1CCOC	766966476	DMHOAJGXZVBLIN-INIZCTEOSA-N	426.945	1.542	50	20	IDGD	
O=C(NNC(=O)c1cccnc1C(F)(F)F)c1ccc(S(=O)(=O)N2CCCC2)cc1	767163892	TWVUEOHOKGHTAH-UHFFFAOYSA-N	442.419	1.960	50	20	IDGD	
O=C(NNc1ccc([N+](=O)[O-])cc1)c1ccc2c(c1)S(=O)(=O)N(C[C@@H]1CCCO1)C2=O	768255315	NRENXDHPPPBJHZ-HNNXBMFYSA-N	446.441	1.675	50	20	IDGD	
CCNC(=O)N(C)NC(=O)[C@H]1Cc2ccccc2CN1S(=O)(=O)c1ccc(F)cc1	768412987	MELNMJKWUSSYSM-GOSISDBHSA-N	434.493	1.634	50	20	IDGD	
N#Cc1cc(Cl)nc(NNC(=O)[C@H]2CCCN2C(=O)/C=C/c2ccc(C(N)=O)cc2)c1	768707237	KTQUOMSSKYXNCX-CDVVCGDMSA-N	438.875	1.853	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N[C@H](C)CCN2CCN(C)CC2)cc1Br	770405195	YWGHPUJFNJHMDB-CYBMUJFWSA-N	442.358	1.428	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)Nc1cc(F)cc(S(N)(=O)=O)c1	770460731	KJRPEMLHIJQLQE-VIFPVBQESA-N	430.845	1.747	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@H](NS(C)(=O)=O)C(C)(C)C)ccc1OCCC(C)C	770646024	XEKNFVRJKGNNBE-KRWDZBQOSA-N	443.566	1.845	50	20	IDGD	
CCOC(=O)[C@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNc2c(C)cccc2F)cc1	770816527	XHTCKEUJMHSYTP-ZDUSSCGKSA-N	430.436	1.897	50	20	IDGD	
COC(=O)CNC(=O)c1ccc(NC(=O)C(=O)NNc2c(Cl)cccc2Cl)cc1	773692192	ZDLOXNFSXZWJDD-UHFFFAOYSA-N	439.255	1.978	50	20	IDGD	
O=C(NCC(=O)N1CCOCC1)NNC(=O)c1cn(-c2ccccc2)nc1-c1ccccc1	776637249	LFWMWYYUQBKUEC-UHFFFAOYSA-N	448.483	1.342	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CN2CCN(c3nnc(C(F)(F)F)s3)CC2)cc1	776862803	YYJFRBNRDSKLLT-UHFFFAOYSA-N	428.440	1.449	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc2c(c1)OCCCO2)NNc1ccc2ccccc2n1	777532037	LYDRRNPULYLGKE-UHFFFAOYSA-N	428.470	1.818	50	20	IDGD	
COC(=O)c1ccccc1NNC(=O)c1cc(S(N)(=O)=O)ccc1Br	777829052	ZAVMHLQMSZIFPR-UHFFFAOYSA-N	428.264	1.640	50	20	IDGD	
CCCN(CC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)C[C@@H]1COc2ccccc2O1	778513343	CTXJESVGLSLMGT-QGZVFWFLSA-N	428.445	1.908	50	20	IDGD	
O=C(NCC1CCN(CC(F)(F)F)CC1)NNC(=O)c1nnc(O)c2ccccc12	780627306	FVCLFFMVKAKUAU-UHFFFAOYSA-N	426.399	1.554	50	20	IDGD	
COC(=O)c1ccccc1NNC(=O)c1ccc(S(=O)(=O)N=c2cc[nH]cc2)cc1	780737304	KICXZRBVFGRUDS-UHFFFAOYSA-N	426.454	1.848	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)c2ccc(OC)c(S(=O)(=O)N3CCOCC3)c2)c1	780796190	MYHAUYYKZYMYMJ-UHFFFAOYSA-N	449.485	1.260	50	20	IDGD	
Cc1cc(OCc2cccc(F)c2)ccc1NC(=O)C(=O)NNC(=O)C(=O)NC1CC1	782964203	AVGKBVZAXKSMFW-UHFFFAOYSA-N	428.420	1.078	50	20	IDGD	
CCOC(=O)Cn1cccc(NC(=O)C(=O)NNc2ccc(Br)cc2)c1=O	783005839	GKQUZAYCYOUDRA-UHFFFAOYSA-N	437.250	1.256	50	20	IDGD	
CCOc1cc(C(=O)N(C)C)ccc1NC(=O)C(=O)NNc1ncnc2ccsc12	783261683	IHAUSMDBNDEAIU-UHFFFAOYSA-N	428.474	1.874	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)CNC(=O)c2cccs2)n([C@H]2C[C@H]3CC[C@H]2C3)n1	784005130	QAHHTTPELTYJOW-IHRRRGAJSA-N	444.517	1.130	50	20	IDGD	
Cc1ccc(F)c(NC(=O)C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)c1	784231133	XBDHVORDZDGTPK-UHFFFAOYSA-N	449.508	1.152	50	20	IDGD	
CCn1nnnc1-c1cccc(NC(=O)C(=O)NNc2ccc(Br)cn2)c1	784341018	URXALNNZCILKGH-UHFFFAOYSA-N	431.254	1.599	50	20	IDGD	
Cc1ccc(C(=O)N2CCOCC2)cc1NC(=O)C(=O)NNc1cccc([N+](=O)[O-])c1C	784357868	MJMGUWFOPYNHQE-UHFFFAOYSA-N	441.444	1.766	50	20	IDGD	
CN1Cc2ccc(NC(=O)C(=O)NNc3ccccc3S(=O)(=O)NC(C)(C)C)cc2C1	784833196	KPJRUIHIXLOWKZ-UHFFFAOYSA-N	445.545	1.791	50	20	IDGD	
CCNC(=O)N(C)NC(=O)C(=O)Nc1cc(NC(=O)CN2CCCC[C@H]2C)ccc1F	784915830	PRBLVWJAIOZXJR-CYBMUJFWSA-N	436.488	1.270	50	20	IDGD	
O=C([C@H]1[C@H](C(F)(F)F)[C@H]2CC[C@H]1O2)N1CCN(S(=O)(=O)CBr)CC1	785626686	XJBIHTIDNCSVDH-GWOFURMSSA-N	435.262	1.169	50	20	IDGD	
C[C@@H]1[C@@H](C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)CCN1C(=O)OC(C)(C)C	786378311	RRVVKYLAPSSJHR-CJNGLKHVSA-N	430.461	1.508	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(C)c(N3CCNC3=O)c2)c2ccccc2n1	787541935	YGYYBVMKUVFYIV-UHFFFAOYSA-N	446.467	1.781	50	20	IDGD	
CCc1c(C(=O)NNC(=O)CNc2cccc(OC)c2)nnn1Cc1ccc(F)cc1	787866027	JCBZZIYGHRZVRB-UHFFFAOYSA-N	426.452	1.910	50	20	IDGD	
COc1ccc(OC)c([C@@H]2C[C@H]2C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c1	788203404	XRJSKJPNQIVAOI-DOTOQJQBSA-N	443.412	1.720	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(C(=O)OC)c(C)cc1C	788331543	SIEUZXYOKDBSCA-UHFFFAOYSA-N	427.457	1.817	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)Cn2c(S)nc3ccccc3c2=O)cc1OC	788840124	OXEQGSHFHQGMLQ-UHFFFAOYSA-N	442.497	1.944	50	20	IDGD	
C[C@](O)(Cn1cc(C(F)(F)F)ccc1=O)C(=O)NNC(=O)NCc1ccc(Cl)cc1	792474500	GQFGEAGYYWOTKK-KRWDZBQOSA-N	446.813	1.802	50	20	IDGD	
CC(=O)NC[C@@H]1CCn2ncc(C(=O)NNC(=O)CSc3ccc(Cl)cc3)c2C1	792735111	LDLHHVOKALYTKJ-CYBMUJFWSA-N	435.937	1.788	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)Cc2ccc(C(=O)NNC(=O)C3=CCOCC3)cc2)cc1	792787118	MOGJIXONNQFNCH-UHFFFAOYSA-N	443.525	1.923	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NN=C1CSC[C@H]1C)N(S(C)(=O)=O)CC2	794881588	LNFCNJNUXYTQOO-MLGOLLRUSA-N	441.575	1.808	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)CN1CCN([C@@H]2CCN(Cc3ccccc3)C2)CC1	796383704	LXJWQYZOUVXLJE-XMMPIXPASA-N	449.599	1.577	50	20	IDGD	
CCNC(=O)N(C)c1cccc(NC(=O)C(=O)NNC(=O)COc2cc(C)ccc2C)c1	796992395	PSHVODOSMRTZDB-UHFFFAOYSA-N	441.488	1.634	50	20	IDGD	
C[S@](=O)c1ccc(CC(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)cc1	797877591	XRHYIGYPSQIDRT-PMERELPUSA-N	438.550	1.696	50	20	IDGD	
CCOc1ccc(-c2nnc(S)n2CCC(=O)NNC(=O)NCC(F)(F)F)cc1	798314321	GTWZPUJYJRPPBI-UHFFFAOYSA-N	432.428	1.915	50	20	IDGD	
COCN1C(=O)CCc2cc(NC(=O)NNC(=O)[C@@H]3COc4ccccc4O3)ccc21	801782159	IQSBXBFIXXFXFS-SFHVURJKSA-N	426.429	1.562	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)Nc1ccc(OC(F)F)cc1)N1C(=O)NC2(CCCC2)C1=O	802044586	VZAKZRQXVSZUID-JTQLQIEISA-N	425.392	1.694	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)C[C@H]2CN(Cc3ccccc3)CCO2)cc1	802065405	YSCTUUXHWIUCKL-SFHVURJKSA-N	446.529	1.534	50	20	IDGD	
N#Cc1ccc(N2CC[C@@H](C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)C2)c(F)c1	804347312	CYZNEHGMTILREC-QGZVFWFLSA-N	437.479	1.378	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)N[C@@H]1CCCN(C(=O)CCC(F)(F)F)C1	804866965	AEGJHNDYXLCYTM-CYBMUJFWSA-N	440.426	1.920	50	20	IDGD	
C[C@H](CCNS(=O)(=O)c1ccccc1)NC(=O)NNc1ccc(-n2ccnc2)nn1	805468108	NNHXZLINJGKFRT-CQSZACIVSA-N	430.494	1.046	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)c2cc(Br)ncc2Cl)c2ccccc2c1=O	806272380	FSOVBOKNLPDVRE-UHFFFAOYSA-N	436.653	1.819	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1nc(-c2ccco2)cs1	806973852	MAOGRSCVRPWZLL-UHFFFAOYSA-N	430.442	1.967	50	20	IDGD	
Cn1nc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)cc1C1CC1	810277708	VWYFNMUEMPEKQV-UHFFFAOYSA-N	446.533	1.939	50	20	IDGD	
Cc1nn(-c2ccccc2)c2nc(Cl)c(C=NNC(=O)[C@H](C)NS(C)(=O)=O)cc12	814835459	RBWSIIIRXYCVER-LBPRGKRZSA-N	434.909	1.770	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1)NNC(=O)c1ccccc1Cl	815269327	ROVIUWJQLKJTKS-UHFFFAOYSA-N	445.863	1.467	50	20	IDGD	
N#Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)ccc1Br	815566238	MYDFCGCAYVGOKQ-UHFFFAOYSA-N	435.209	1.625	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	844260377	IDMVEJMQQWMLKJ-UHFFFAOYSA-N	427.486	1.123	50	20	IDGD	
CSCC[C@H](NC(=O)c1ccccc1Br)C(=O)N1CC[C@H](B(O)O)C1	864233171	HPXPFUGESSLOQI-FZMZJTMJSA-N	429.145	1.376	50	20	IDGD	
O=C(NNC(=O)c1nc2ccccc2s1)c1cccc(S(=O)(=O)N2CCOCC2)c1	912638404	HYJQCSMHCXLYOJ-UHFFFAOYSA-N	446.510	1.392	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)c1ccc(N2CCCCCC2)nc1	914602179	BGUBIXDYMKSULB-UHFFFAOYSA-N	430.534	1.830	50	20	IDGD	
O=C(NNC(=O)c1cn(-c2ccccc2Br)nn1)c1ccc2c(c1)OCO2	914709713	UYLLNTIXPRGJRM-UHFFFAOYSA-N	430.218	1.833	50	20	IDGD	
COc1cccc([C@@H](CNC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)N(C)C)c1	915902677	ZMFFIXKAUZLAJW-GOSISDBHSA-N	438.488	1.189	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)C1CCN(C(=O)N2CCCC2)CC1	916132669	HQOHXKDMZYBUPU-UHFFFAOYSA-N	426.521	1.674	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)c2c(C)oc(C)c2S(N)(=O)=O)cc1	916134304	KKXZIWFWWHSEDE-LBPRGKRZSA-N	425.463	1.171	50	20	IDGD	
CC(C)[C@H](CNC(=O)NNC(=O)c1ccc(Br)s1)N1CCN(C)CC1	916258176	MNYUWEMLCFJVFO-LBPRGKRZSA-N	432.388	1.727	50	20	IDGD	
CCn1cnc2c1c(=O)n(CC(=O)NN=Cc1ccccc1O)c(=O)n2Cc1ccccc1	916331661	JDFLGSAQUBXGMJ-UHFFFAOYSA-N	446.467	1.284	50	20	IDGD	
CC(=NNC(=O)c1csc(N2CCOCC2)n1)c1ccc(O)c(CN2CCOCC2)c1	916337852	MWOICSNHQPKMSZ-UHFFFAOYSA-N	445.545	1.672	50	20	IDGD	
CSc1ncc(C(=O)NNC(=O)CCN2C[C@H](C)O[C@H](C)C2)n1-c1ccc(F)cc1	917362909	RMTMHSHMVKWMAR-OKILXGFUSA-N	435.525	1.994	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2ccc(Cl)cc2O)cc1S(=O)(=O)N(C)C	918358000	SNMGSGCWAYJNEB-UHFFFAOYSA-N	427.866	1.379	50	20	IDGD	
CNS(=O)(=O)c1ccc([C@H](C)NC(=O)NNC(=O)c2cc(Br)c[nH]2)cc1	919778691	HGULMIHMYFMLJF-VIFPVBQESA-N	444.311	1.391	50	20	IDGD	
N#CCOc1ccccc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	919807284	CGHOJPRUGZSABN-UHFFFAOYSA-N	428.470	1.448	50	20	IDGD	
C[C@@H]1C[C@@H](C)CN(C[C@@H](C)NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)C1	919924795	XLCBXCJMNWXGMW-BZUAXINKSA-N	439.582	1.247	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)NC[C@]2(N3CCOCC3)CCSC2)c1C	919980813	RKQOYECKNNVTOG-VLOXRPPESA-N	432.590	1.982	50	20	IDGD	
CC(=O)N1CCN(S(=O)(=O)c2ccc(C(=O)NNc3cc(C)ccc3C)cc2)CC1	920093749	FUBBEDYFHJRYCC-UHFFFAOYSA-N	430.530	1.913	50	20	IDGD	
O=C(N[C@@H](Cc1ccccc1)C(=O)NNC(=O)[C@H]1COc2ccccc2O1)c1cccnc1	921299402	RNBQCNVCEBMPOR-GHTZIAJQSA-N	446.463	1.410	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)c2cc3c(c(S(N)(=O)=O)c2)CCC3)cc1	1318660237	KFJWPGGVOZNRAM-ZDUSSCGKSA-N	447.513	1.450	50	20	IDGD	
CC(=O)N1CCCc2ccc(S(=O)(=O)NNC(=O)c3cncn3-c3ccccc3)cc21	1318961154	BHUIMESJEISSCG-UHFFFAOYSA-N	439.497	1.795	50	20	IDGD	
CN1CCN(Cc2cccc(CNC(=O)NNC(=O)c3ccc4c(c3)OCCO4)c2)CC1	1322422708	FXQUXUBOTUAREL-UHFFFAOYSA-N	439.516	1.349	50	20	IDGD	
COc1ccc2nc(C(=O)N3CC[C@@]4(C3)CN(C(=O)[C@H](O)CCl)CCO4)ccc2c1	1777891999	TWHDSXNTZOWNPT-WIYYLYMNSA-N	433.892	1.287	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4c(c3)CCN4C)C2)C1	1777921618	JQMAIYHSTKUOTC-VBKZILBWSA-N	436.350	1.906	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)c3cccc(Cl)c3)CCO2)C1	1779032182	FPXXMFDQRKXPIG-NRFANRHFSA-N	443.891	1.096	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@]2(C1)CN(C(=O)CS[C@@H]1CCCCO1)CCO2	1779296828	HKGKOMZXTBUYAH-MOPGFXCFSA-N	430.643	1.928	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2n[nH]cc2[N+](=O)[O-])C1	1779602422	DKQMZXBZYYSZNI-RDTXWAMCSA-N	439.545	1.297	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(C)n(CC)n3)C2)C1	1779718876	LNBLLXSUSDCSBY-KSSFIOAISA-N	427.343	1.828	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(C)=O)C2	1780054281	GZVNBEXILOOCHR-WIYYLYMNSA-N	447.444	1.237	50	20	IDGD	
C[C@@H]1Oc2ccc(C(=O)N3CC[C@]4(C3)CN(C(=O)C(Cl)Cl)CCO4)cc2NC1=O	1780181615	XQMICXVHDGGBEL-WLRWDXFRSA-N	442.299	1.653	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)c(O)c1	1780551504	YGNFJDCELDCGGO-BFUOFWGJSA-N	441.322	1.875	50	20	IDGD	
COc1cncc(CCC(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)c1	1781327027	WGTTZBHWYPBRBI-SJLPKXTDSA-N	444.301	1.543	50	20	IDGD	
COc1cc(C)c(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)cc1OC	1781889674	VXZOLIPNKAYTSD-QRWLVFNGSA-N	426.897	1.055	50	20	IDGD	
O=C([C@H](F)Br)N1CCO[C@@]2(CCN(C(=O)C(Cl)(Cl)Cl)C2)C1	1783266311	XNEOKGGOWLDZEF-XVKPBYJWSA-N	426.497	1.877	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)CSc3ncccn3)CCO2)C1	1783341278	CMXWRFNXUIIKSU-GUYCJALGSA-N	443.367	1.572	50	20	IDGD	
CCc1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](Br)CC)C3)C2)n(C)n1	1783349219	KAQQBQLGTNPLEJ-RDTXWAMCSA-N	427.343	1.600	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc4sc(N)nc4c3)CCO2)C1	1783876285	NSPPMAWUZBZVMQ-BFUOFWGJSA-N	438.937	1.576	50	20	IDGD	
O=C(CN1CCCCC1=O)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1	1788143505	KCGAFXQPYWLAOG-UHFFFAOYSA-N	449.316	1.127	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)COCc3ccccc3)C[C@@H]21)[C@H](F)Br	1789922481	KWGBJLGUGGHQLL-OVWQWFNUSA-N	443.313	1.873	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)COc3ccccc3F)C[C@@H]21)[C@@H](F)Br	1789924975	KNPGESKCOALTLT-WXRXAMBDSA-N	447.276	1.875	50	20	IDGD	
CC(=O)O[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]2C1)C(C)C	1789925708	HQFFTDKZJIUIAJ-BTFPBAQTSA-N	437.306	1.244	50	20	IDGD	
CCN1CCC(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](C)Br)[C@H]3C2)CC1	1791065192	SBBGQLCPYYHXSI-HJWJTTGWSA-N	430.387	1.481	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nnsc3C3CC3)C[C@@H]21	1791254397	LVCABZJNACIVQZ-FQUUOJAGSA-N	428.942	1.263	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCN3CCCC3)[C@H]2C1	1792311762	ZRNWQPHIEVMCLS-QZWWFDLISA-N	430.387	1.483	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)C1CCN(c2ccccc2)CC1	1792904121	AIXNNNACALTJGY-HNJRGHQBSA-N	435.952	1.092	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CNC(=O)OC(C)(C)C	1793006080	CAMXNPNESFPAOC-JKJDWNRSSA-N	431.961	1.918	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1COc2ccccc2O1	1793842335	IMDASVNUHMDIOC-ULAROXBWSA-N	443.327	1.652	50	20	IDGD	
CC(C)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2nc(CO)[nH]c2c1	1796868971	OEVNZTBIOGDGIO-ZSBFGKGUSA-N	434.924	1.523	50	20	IDGD	
COc1ncc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CO[Si](C)(C)C)cc1F	1797954605	YKXBRNCFWSELLH-XOIINTDNSA-N	425.533	1.284	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3ncccn3n1)C2	1799277116	RYNLXWUJBGONDS-TYYYEBLRSA-N	426.304	1.169	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CCc3ccccc3O1)C2)[C@@H](F)Br	1799352398	UPTLVQFQIMHWFG-IMPMIVQMSA-N	441.297	1.660	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CC[C@@H]2CCC(=O)N2C1)[C@H](F)Br	1799930545	AUIFXNSWDPXXCJ-VHYSLAALSA-N	430.318	1.716	50	20	IDGD	
Cc1cc(C)n2ccc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)C(Cl)Cl)C4)c2n1	1800138479	WNLQYLFVKJAJFS-AGGWBTHJSA-N	425.316	1.958	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)CBr)C2	1800226434	YPRZNIMHHWQLLP-VJTDZRGJSA-N	435.315	1.169	50	20	IDGD	
C[C@@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2	1800744222	HAGGQOQOSDBYHA-CMZRPVNOSA-N	441.887	1.425	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cn(C)c3ncccc13)C2	1800759057	FKSSZRRHQVBFRI-NFFDBFGFSA-N	435.322	1.560	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(C(C)(C)C)n[nH]1)C2	1800760218	JBWTXQAJOMCDLA-OHTBPHCPSA-N	427.343	1.694	50	20	IDGD	
C[C@H](Cc1ccccn1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)CBr)C2	1801223454	ZLWFBMUZSHORQM-RIUYPTKQSA-N	438.366	1.881	50	20	IDGD	
C#CC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](Cl)CC)C2	1802129075	YSRTYDQNOITMRV-QEOTZNIISA-N	441.956	1.510	50	20	IDGD	
COC[C@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(N3C(=O)C=CC3=O)cc1)C2	1802284403	RCSHSCOAEAIMLK-RANZSIQMSA-N	445.903	1.622	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1CCN(C(=O)c2ccnnc2O)[C@@H]1c1cccnc1	1803013562	DZHZMRKEWZZHHX-IVMMDQJWSA-N	448.321	1.928	50	20	IDGD	
Cc1cccnc1C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1803800425	RJYVXKHHHOFGLV-UGKGYDQZSA-N	444.300	1.098	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2nc(C)c(C)nc2O)[C@H]1c1cccnc1	1804875817	WTXVMKXBDISXHE-SOLBZPMBSA-N	447.923	1.767	50	20	IDGD	
CN(CC(=O)N1CCC2(CCCN(C(=O)[C@H](O)CCl)C2)CC1)C(=O)c1ccccc1	1805517457	ISPVUAPBNAGXBA-GOSISDBHSA-N	435.952	1.590	50	20	IDGD	
O=C(CCBr)NC[C@H]1CCN(C(=O)Cc2ncccn2)[C@@H]1c1cccnc1	1806341766	HFPQBYUWTZVSKG-DNVCBOLYSA-N	432.322	1.905	50	20	IDGD	
O=C(Cc1ccccc1)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1806515821	PVCZULXKXYNEFT-QPPBQGQZSA-N	443.312	1.324	50	20	IDGD	
C=CCSCC(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1807363390	OMCSKFFSWUFWOQ-NQIIRXRSSA-N	439.346	1.000	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](F)Cl)[C@H]1c1cccnc1)c1cccn2c(O)nnc12	1808189674	WSJRGAVTCIAHIW-QEJZJMRPSA-N	432.843	1.684	50	20	IDGD	
Cc1cc(C(=O)NC[C@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)c[nH]1	1808778266	LJWUPRBKAOWBND-DYESRHJHSA-N	426.521	1.411	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)c1cn2ncccc2n1	1809349067	CTYPBIWCWWFUPR-ZVZYQTTQSA-N	428.880	1.044	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC2(CCCN(C(=O)CCN3CCOCC3)C2)CC1	1809584018	IUXKITRZHOLZBO-KRWDZBQOSA-N	444.414	1.971	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)c2cc[n+]([O-])cc2)[C@H]1c1cccnc1	1811197393	CDWQGLXIERVHTA-RRQGHBQHSA-N	433.306	1.818	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2ccc([N+](=O)[O-])[nH]2)[C@@H]1c1cccnc1	1811619363	PNNVKDMEGSFMGV-ZQIUZPCESA-N	435.868	1.891	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)N1CC[C@H](CNC(=O)[C@@H](C)Br)[C@H]1c1cccnc1	1812866124	BDFIFAPWPSHFIU-GKLJAUDBSA-N	437.338	1.562	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2ncn(C(C)C)n2)[C@H]1c1cccnc1	1813030706	LNGQERYJZGYKLI-ULQDDVLXSA-N	434.928	1.827	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CCN2C(=O)C=CC2=O)[C@@H]1c1cccnc1)C(Cl)Cl	1813075284	AESXGVPHMUPHJO-SUMWQHHRSA-N	439.299	1.206	50	20	IDGD	
Nc1n[nH]c(CCC(=O)N2CC[C@@H](CNC(=O)C(Cl)Cl)[C@H]2c2cccnc2)n1	1813078449	PWSLZLDLEJHAKB-SMDDNHRTSA-N	426.308	1.224	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)C2(F)CCC2)[C@H]1c1cccnc1	1813684223	NRCMXQVSXOZBJV-MAUKXSAKSA-N	440.479	1.292	50	20	IDGD	
Cc1cc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)c(C)o1	1815355136	OFGBBZKKWYNJEH-HNNXBMFYSA-N	439.302	1.572	50	20	IDGD	
Cc1cc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)c(C)o1	1815355137	OFGBBZKKWYNJEH-OAHLLOKOSA-N	439.302	1.572	50	20	IDGD	
C[C@H]1CC[C@H](C(=O)N[C@@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)CC1	1815361568	KIKFKQZIGVZVMI-CKEIUWERSA-N	441.362	1.875	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1ccccc1O	1816263371	KJBNIAPBTBQLGI-GOSISDBHSA-N	434.261	1.415	50	20	IDGD	
Cc1cccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)n1	1816394253	TXNOURGPXKJDQI-IBGZPJMESA-N	433.277	1.413	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3cc(O)nc(O)n3)sc2C1	1817099608	YQFXWDAOIPBXBV-IUCAKERBSA-N	425.898	1.978	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CC[C@H](N)C(N)=O)n[nH]1	1817351222	ALWPTLADLFBGJS-MDZLAQPJSA-N	443.346	1.026	50	20	IDGD	
COc1cccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)c1	1817472586	NUVHGEVTTBFKRL-FQEVSTJZSA-N	448.288	1.718	50	20	IDGD	
Cc1n[nH]c(C)c1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCC(=O)NN(C)C)CC2	1820317535	JZWJGZKHURNIIV-LBPRGKRZSA-N	433.538	1.082	50	20	IDGD	
CO[C@H](C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[nH]n1	1822450307	OPIZYLSPDKQTEE-CEYZDJRHSA-N	429.481	1.571	50	20	IDGD	
O=C(CN1C(=O)C=CC1=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](F)Br)[nH]n1	1822529542	CIAUBILLNSTHKK-BMIGLBTASA-N	442.245	1.017	50	20	IDGD	
CC(C)(C)[C@H](O)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1	1824133022	JHWMXNKJEXQKQJ-VQTJNVASSA-N	430.354	1.007	50	20	IDGD	
CN1CCCC[C@@H]1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1	1824199025	HLNZYFCHIXTHPP-FGZHOGPDSA-N	441.381	1.084	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H]1CNC(=O)C1)CC2	1825451792	RFQWZFCEFDLXMU-GUBZILKMSA-N	429.340	1.365	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ncc[nH]2)CC1	1825637732	DZHYKSPNEPAIST-CMPFEXHJSA-N	439.520	1.777	50	20	IDGD	
O=C(CC[C@@H]1CCOC1)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827060024	MIPHALPTUCJEEY-GCJKJVERSA-N	442.365	1.416	50	20	IDGD	
O=C(CCBr)N1CCC([C@@H]2CCCCN2C(=O)c2cnc(O)nc2O)CC1	1827589043	ODSSGRCHCCUOSL-AWEZNQCLSA-N	441.326	1.906	50	20	IDGD	
Cc1nc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)ccc1F	1830358107	LXJOKAYRFRAKBG-FQEVSTJZSA-N	427.904	1.864	50	20	IDGD	
Cc1nccn1[C@@H](C)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830370230	MUTIRDJKGJZVRI-MGPUTAFESA-N	426.945	1.474	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccccc3)C2)C1	1830543140	KLQUHZZPQAISFL-KXBFYZLASA-N	425.323	1.788	50	20	IDGD	
C#CCCCCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)CBr)CCO2	1830544273	SYGNTVHSSXHJKS-APWZRJJASA-N	429.355	1.667	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2n[nH]cc2[N+](=O)[O-])CC1	1831830986	KYMURTWCUIBKOV-ZIAGYGMSSA-N	427.889	1.805	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H](C)N2CCN(C)CC2)CC1	1831833383	NMMXEEFPKZKOLK-DFQSSKMNSA-N	443.032	1.496	50	20	IDGD	
C[C@@H](Cn1ccnc1)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1	1831876947	NTBQOGSXDHNEKL-ICSRJNTNSA-N	446.596	1.512	50	20	IDGD	
COc1cc(C(=O)N2CCC(N3CCC(NC(=O)[C@H](O)CCl)CC3)CC2)ccc1F	1833312840	HKCSDJISZSMKCU-GOSISDBHSA-N	441.931	1.619	50	20	IDGD	
Cc1cc(C)nc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)c1	1836312150	ZXJXWZUKZGRTJJ-CRAIPNDOSA-N	444.301	1.459	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC1CCN(C2CCN(C(=O)CN3CCCC3=O)CC2)CC1	1836398409	JDXQTBMRSBDBHJ-HXUWFJFHSA-N	447.407	1.417	50	20	IDGD	
Cc1nnc(CC(=O)N2CCC(N3CCC(NC(=O)[C@H](F)Br)CC3)CC2)o1	1836412593	NGHVLRPJWNSZGB-INIZCTEOSA-N	446.321	1.183	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@H](C)Cn3cccn3)CC2)CC1	1837222717	XEGARZDJVZGPOO-APWZRJJASA-N	440.972	1.772	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCC(OC2CCN(C(=O)[C@@H]3CNC(=O)C3)CC2)CC1	1838639037	SOQHUWXQUAHEQI-ORAYPTAESA-N	434.364	1.357	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)nn1C	1839150873	AHJGORHZDAJCGU-QZTJIDSGSA-N	433.336	1.035	50	20	IDGD	
CCc1oncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2	1839151516	VCJQMDBLRFLETA-MSOLQXFVSA-N	434.320	1.543	50	20	IDGD	
O=C([C@H](F)Br)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3CCC(F)(F)C3)C2)C1	1839196958	AHTFXENMEPYGEO-TYNCELHUSA-N	443.260	1.569	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc4ccoc34)CCO2)C1	1839588164	POGXJLJDGRNZBC-UWJYYQICSA-N	436.892	1.757	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnc4cc(C)ccn34)CCO2)C1	1839602049	IBMFKPCIUIFPPN-IIBYNOLFSA-N	434.924	1.730	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)nc1	1840031596	VZQVIDPDHAFJSY-RDTXWAMCSA-N	426.311	1.243	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C)cc(F)c3)C2)C1	1840154843	HOVIDDHRBZZPSK-FXAWDEMLSA-N	428.888	1.458	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(F)c(F)c3C)C2)C1	1840156870	XCSGETACDOLBSV-FOIQADDNSA-N	446.878	1.597	50	20	IDGD	
Cn1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)c2cccnc21	1840188595	RZPYCORBWXWXBP-IBGZPJMESA-N	441.315	1.447	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@]1(C)CC1(F)F)CCO2	1840827980	JIWXESGZNATSLE-PMPSAXMXSA-N	429.291	1.724	50	20	IDGD	
O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CCCSC1)CCO2	1840863821	UQLYKRKYVPVSKR-PBHICJAKSA-N	435.384	1.371	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H](F)C[C@@H](C(=O)N2CCCC23CN(C(=O)[C@@H](O)CCl)C3)C1	1843887910	NGNOIWHVZUPPPE-KFWWJZLASA-N	447.935	1.385	50	20	IDGD	
C[C@@H]1CC[C@H](C(=O)N2CC3(CCCN3C(=O)CN(C)NC(=O)NCc3ccccc3)C2)O1	1845038897	FFQNERMNAUEMSR-IEBWSBKVSA-N	443.548	1.104	50	20	IDGD	
C#CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)[C@H](F)Br)C1	1845220808	OVXHOVSKKOFCPS-STQMWFEESA-N	446.317	1.797	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC12CN(C(=O)[C@H](CO)NC(=O)OC(C)(C)C)C2	1846069899	BZHDVYLJGTURPZ-STQMWFEESA-N	448.358	1.249	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@H](C)NC(=O)c1ccc(F)cc1)C2	1846363371	FNKKHWHLWCPTIJ-BBRMVZONSA-N	425.888	1.401	50	20	IDGD	
C[C@H]1CN(C(C)(C)CNC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)C[C@H](C)O1	9732201	MASAZAQSYIRONU-GJZGRUSLSA-N	430.509	1.410	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(F)cc2)C1	14940097	QHMVOHLOECTFMX-OAHLLOKOSA-N	437.468	1.756	50	20	IDGD	
COc1cc(/C=C(\C#N)C(=O)NCc2ccco2)ccc1OCC(=O)N1CCOCC1	20922110	XEKBXHPZJVBNHF-GZTJUZNOSA-N	425.441	1.749	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)CN1C(=O)COc2ccccc21	24303880	LOHYQDGFDRBSLE-UHFFFAOYSA-N	447.831	1.078	50	20	IDGD	
O=C(CN1C(=O)COc2ccc([N+](=O)[O-])cc21)NNC(=O)c1cc(-c2ccccc2)on1	28792285	ZCTAWMKKCQALPY-UHFFFAOYSA-N	437.368	1.436	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2ccc(OC[C@H]3CCCO3)cc2)n1	105213223	FCELUFNWJACWQA-MRXNPFEDSA-N	433.486	1.556	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)NCCN2CCS(=O)(=O)CC2)c(C)n1-c1ccc(F)cc1	725886033	QWKRWUHBJMBCHE-XMHGGMMESA-N	444.532	1.987	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NN(C)C(=S)NCCCOC)ccc1OC	726077038	MLOSRVXURMAJHF-UHFFFAOYSA-N	446.595	1.213	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)N[C@H](C)c2nc(C)no2)c2ccccc2c1=O	726277542	CQSHFAYQXJRDOG-GFCCVEGCSA-N	427.465	1.983	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)N[C@H](C)CC(=O)Nc2cccc(N3CCCC3)c2)n1	726279835	LHBMEJKCOWBCHV-OAHLLOKOSA-N	441.536	1.848	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)N[C@@H]1C[C@@H]1c1cccc(Br)c1	726609771	CVXBGAHFMUPVBA-HZPDHXFCSA-N	442.277	1.925	50	20	IDGD	
O=C(NCc1nccn1C(F)F)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	726710049	RLFDIVPMHNZTBO-UHFFFAOYSA-N	442.448	1.207	50	20	IDGD	
CC(C)CC(=O)N1CCN(C(=O)CCCCCNC(=O)NNC(=O)c2ccc[nH]2)CC1	727605625	RJKAWUXPQSAYFR-UHFFFAOYSA-N	434.541	1.236	50	20	IDGD	
COc1cc(N2C[C@@H](C(=O)NNC(=S)NCC3CCC3)CC2=O)cc(OC)c1OC	727866155	RPZGICNQSFICGM-ZDUSSCGKSA-N	436.534	1.361	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCCC2)cc1)NNc1nc(-c2ccncc2)no1	728072451	LBWCPIWGPSWFCB-UHFFFAOYSA-N	442.501	1.992	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)OCC(=O)c2ccc(NS(C)(=O)=O)cc2)cc(C#N)n1C	728322227	QCYRQRQYHDXEIG-PXNMLYILSA-N	426.454	1.910	50	20	IDGD	
COc1ccc(CN(C)C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c(OC)c1	728961778	PAHCEGBSDNTJHE-UHFFFAOYSA-N	428.493	1.583	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNC(=O)[C@H]2CC(=O)N(CCN3CCOCC3)C2)cc1	729300591	SVFOZNWQDRFNJO-IBGZPJMESA-N	446.548	1.053	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(CCC(=O)NNC(=O)COc2ccccc2O)cc1	730782282	LTXDGYNCNNLMJR-UHFFFAOYSA-N	449.529	1.582	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)NCc1cccc(NC(=O)[C@H]2CCCO2)c1	730825774	WYWYGIRXNGLVAF-GOSISDBHSA-N	428.445	1.419	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)COc1ccccc1O)c1cccc(S(=O)(=O)N(C)C)c1	730910490	KMBITZAWJYJSMN-CYBMUJFWSA-N	436.490	1.113	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)N[C@@H](C)C(=O)N2CCS(=O)(=O)CC2)c(C)n1CC(C)C	731477100	QRHZOZLASVUGQW-ZVCOJXFSSA-N	434.562	1.430	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)Cn1cnc2c(c(Br)nn2C)c1=O)c1ccccc1	731999244	NNLCXDRESFCZNA-GFCCVEGCSA-N	447.293	1.234	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)CCC/N=C1/NS(=O)(=O)c2ccccc21)c1ccccc1	732133103	PWZWFYBAEWJMOL-MRXNPFEDSA-N	428.514	1.847	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)Cc2cn3cc(Cl)cc(Cl)c3n2)C[C@H](C)O1	732259022	JXPKSUNNUKLBSX-RYUDHWBXSA-N	428.320	1.830	50	20	IDGD	
O=C(NNC(=O)c1sccc1S(=O)(=O)N1CCCC1)c1cnn(-c2ccccc2)c1	733107984	FELVSYOHEFKSHX-UHFFFAOYSA-N	445.526	1.793	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)[C@H](C)C(C)C)N(S(C)(=O)=O)CC2	733358161	PIQPGMXUTGUOQO-CJNGLKHVSA-N	441.550	1.392	50	20	IDGD	
COc1cc(F)c([C@@H](C)NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1OC	734013821	SVUCEZNMSWWNBT-LLVKDONJSA-N	439.465	1.952	50	20	IDGD	
CC1CCC(=CC(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)CC1	734099801	XREINUKACQVWNM-UHFFFAOYSA-N	449.573	1.924	50	20	IDGD	
CC(=O)N1CCc2ccccc2[C@H]1CC(=O)NNC(=O)NCCNC(=O)OC(C)(C)C	734242144	VIUYELKXFSBGKD-QGZVFWFLSA-N	433.509	1.378	50	20	IDGD	
O=C(NNc1ncccc1Cl)c1ccc2c(c1)S(=O)(=O)N(C[C@H]1CCCO1)C2=O	734247731	YGSFRALPBRCVGR-GFCCVEGCSA-N	436.877	1.815	50	20	IDGD	
NC(=O)c1ccc(N2CCN(C(=O)NNC(=O)c3cccc(OC(F)F)c3)CC2)cc1	735514462	ZXCVWHANQPIBMF-UHFFFAOYSA-N	433.415	1.564	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)CCN2C(=O)[C@H]3CCCC[C@@H]3C2=O)cc1C	736735607	VLPNRXXQGINWGL-KBPBESRZSA-N	449.529	1.488	50	20	IDGD	
CC[C@H]1CCCCN1CCNC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	737065632	BQKUJYQYTPVASB-FQEVSTJZSA-N	430.597	1.794	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)NCCNc2nccc(C(F)(F)F)n2)c1	739046968	ZVDVQAKWMORHHJ-UHFFFAOYSA-N	426.399	1.934	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)[C@H]2CCCCN2C(=O)c2ccc(O)nn2)c1	742242362	ZFQCPNGNRZTTTL-MRXNPFEDSA-N	427.461	1.020	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)cc1OCC	743268144	FJRDRYCKFLTZAU-UHFFFAOYSA-N	425.419	1.721	50	20	IDGD	
CC(C)[C@H](C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1)c1ccccc1	743419946	QHGQXLUIMXWYRA-IBGZPJMESA-N	431.562	1.901	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)N[C@@H](C)CN1CCN(c2ccccc2)CC1	743509600	HUZLOQCXYAELIH-SFHVURJKSA-N	441.532	1.615	50	20	IDGD	
COc1ccccc1-c1noc([C@@H](C)NC(=O)NNC(=O)COc2ccccc2O)n1	743705402	SWWLBTIKDHPJMI-GFCCVEGCSA-N	427.417	1.921	50	20	IDGD	
O=C(NNC(=O)[C@H]1CC(=O)N(Cc2ccccc2)C1)c1cc(Br)ccc1O	743733714	PYDRXJACBGPCJH-ZDUSSCGKSA-N	432.274	1.964	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)c2ccc(CCNS(C)(=O)=O)s2)cc1	743827310	FARHJSJUMMVWJW-UHFFFAOYSA-N	425.536	1.372	50	20	IDGD	
O=C(CCNS(=O)(=O)c1cccc(Br)c1)NNC(=O)NC1CCCC1	744052443	CLTPZODXWMOBAV-UHFFFAOYSA-N	433.328	1.391	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)COc2cccc(N3CCCC3=O)c2)c1	744524727	JZJZKZKFPWNMBO-UHFFFAOYSA-N	436.424	1.068	50	20	IDGD	
COC(=O)c1ccc(CCC(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)cc1	744621584	UMNFCJULZALTMZ-UHFFFAOYSA-N	447.513	1.570	50	20	IDGD	
CN1C(=C(C#N)C(=O)COC(=O)c2cn(CC(=O)C(C)(C)C)nn2)N(C)c2ccccc21	745517630	DJKXCPOTWNVGBM-UHFFFAOYSA-N	436.472	1.941	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(CNC(=O)NNC(=O)Cc2cn3ccccc3n2)CC1	746761898	NNRDTCIILGCSCX-UHFFFAOYSA-N	430.509	1.854	50	20	IDGD	
COc1ccc(CNC(C)=O)cc1S(=O)(=O)NNC(=O)c1ccc(Cl)cc1F	747617384	DGCVQSHCYSCBNO-UHFFFAOYSA-N	429.857	1.747	50	20	IDGD	
Cc1ccc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)C(=O)N3CCCC3)cc2)cc1C	748247379	YYTURLJOXVMZLU-UHFFFAOYSA-N	444.513	1.488	50	20	IDGD	
Cc1[nH]c(-c2ccncc2)nc(=O)c1CC(=O)NNc1ccc(S(=O)(=O)C(F)F)cc1	748610951	WZPJLLSWMGXMFU-UHFFFAOYSA-N	449.439	1.822	50	20	IDGD	
Cc1cc(Br)ccc1NNC(=O)c1cnc2c(c1C)c(=O)n(C)c(=O)n2C	748744065	MWRAGDSMTBYUBK-UHFFFAOYSA-N	432.278	1.768	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NC2CCC(C)(O)CC2)c1	749607421	LCNKPWRWWAAUKF-UHFFFAOYSA-N	426.539	1.355	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCCN1C(=O)CSC1=O	749703760	UYSWSWAASJKADJ-SECBINFHSA-N	445.295	1.242	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N[C@@H]1CC(=O)N(C2CC2)C1	750654559	CVMAZADFKKSKCJ-ZYHUDNBSSA-N	425.283	1.310	50	20	IDGD	
Cc1ccc(S(=O)(=O)C2(C(=O)NNC(=O)CNC(=O)c3ccco3)CCCC2)cc1	750827246	XGSOFDYEKJYMCF-UHFFFAOYSA-N	433.486	1.252	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cc(C(=O)NNC(=O)Cc3cc[nH]n3)ccc2F)cc1	755288166	GZRRCMLYYQASBL-UHFFFAOYSA-N	447.448	1.362	50	20	IDGD	
C[C@H]1CCCN(S(=O)(=O)c2ccc(NC(=O)NNC(=O)Cc3ccncc3)cc2)C1	755446261	BPLRJGURDZFIFF-HNNXBMFYSA-N	431.518	1.898	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)Nc1ccc(CC)c(S(N)(=O)=O)c1	756523162	BGKMHKDVFSHBNG-UHFFFAOYSA-N	436.490	1.527	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)Nc1ccc(OCC2CCOCC2)cc1	756676796	SVJQULMHQMQZAA-UHFFFAOYSA-N	437.460	1.934	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)Nc2ccc(NS(C)(=O)=O)c(Cl)c2)c1	756709904	ZVBPVTQVURGHTK-UHFFFAOYSA-N	440.869	1.531	50	20	IDGD	
O=C(NNC(=O)c1cc2c(s1)CCCCC2)Nc1cnn(CC(=O)N2CCOCC2)c1	756836871	YANGSNDTYRODMV-UHFFFAOYSA-N	446.533	1.539	50	20	IDGD	
NC(=O)c1ccc(NNC(=O)c2ccc(NC(=O)c3ccc(Br)o3)cc2)nn1	757400039	PNXUQNBLPFUZOJ-UHFFFAOYSA-N	445.233	1.940	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)CN2C(=O)N[C@]3(C[C@@H](C)C[C@@H](C)C3)C2=O)cc1	757734262	MUDODKDWHNTSML-GFENJXEQSA-N	431.493	1.001	50	20	IDGD	
O=C(CSc1nnc(O)nc1O)NN=C1CCc2c(F)ccc(Br)c21	758098258	QGFFTAYNEAZFQK-UHFFFAOYSA-N	428.243	1.743	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCc2cccc([N+](=O)[O-])c2)c1	759674151	KRUHIWZAUGJAAN-UHFFFAOYSA-N	435.462	1.032	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNS(=O)(=O)c1cnn(-c2ccccc2F)c1	763439900	XVJGUFURYKDSKY-UHFFFAOYSA-N	441.485	1.626	50	20	IDGD	
Cc1ccc(C(N)=O)cc1NC(=O)C(=O)NNC(=O)COc1ccc(C(C)(C)C)cc1	763594010	FTYBGARVTGNHNA-UHFFFAOYSA-N	426.473	1.556	50	20	IDGD	
CC[C@H](C)n1ncc(NC(=O)C(=O)NNC(=O)COc2ccccc2OC)c1C1CC1	763662485	IHYGXIIAYKHTEK-ZDUSSCGKSA-N	429.477	1.905	50	20	IDGD	
CCOc1cc2c(cc1NC(=O)C(=O)NNC(=O)COc1ccc(C#N)cc1)O[C@H](C)C2	763673585	HDAYDYYWOLWKFD-CYBMUJFWSA-N	438.440	1.445	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)cc1	763675190	UGAXYGKYBBZBRI-UHFFFAOYSA-N	431.330	1.614	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cnn(-c2ccccc2F)c1	763713670	NSJXEAVEWIEHSO-UHFFFAOYSA-N	425.420	1.739	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)C(=O)Nc2ccc(SC(F)F)cc2)c2ccccc2c1=O	763789796	DJNHSJJSGXBZBF-UHFFFAOYSA-N	447.423	1.648	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cc(C)[nH]c2C(=O)OC)cc1	763860630	JKLRSWQALYJXPR-LBPRGKRZSA-N	432.433	1.062	50	20	IDGD	
CCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)c(C)c1	763864697	GBOQMWOMCFLKGO-ZDUSSCGKSA-N	430.436	1.437	50	20	IDGD	
COC(=O)c1csc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(C(C)=O)cc2)c1	763878223	OGSQQZGICMCJHG-NSHDSACASA-N	433.442	1.291	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)Nc1cccc(-n2cccc2)c1	764004865	PKMMHJXGEVZXAC-UHFFFAOYSA-N	430.262	1.978	50	20	IDGD	
CC(C)c1nc2cc(NC(=O)C(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)ccc2o1	764077723	MORBQZNTCZZUDA-UHFFFAOYSA-N	444.469	1.754	50	20	IDGD	
CC[C@H](C)C(=O)NNC(=O)C(=O)Nc1cc(I)cc(C(=O)OC)c1	764081462	HJHINZKFELBSBC-QMMMGPOBSA-N	447.229	1.210	50	20	IDGD	
CN1CCc2ccc(NC(=O)C(=O)NNC(=O)Cc3ccc4ccccc4c3)cc2C1=O	764084390	KDDGYACGZHTLGP-UHFFFAOYSA-N	430.464	1.797	50	20	IDGD	
COC(=O)c1cc(C)ccc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccc(C)cc2)[nH]n1	764112125	WIPLKAMSLKXANW-UHFFFAOYSA-N	435.440	1.880	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(NC(=O)C3CC3)c2)o1	764139376	RQTWIDLFMFJUFK-UHFFFAOYSA-N	441.488	1.870	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2O1)C(=O)Nc1ccc(F)cc1OCC(F)(F)F	764169510	WLEYEDXYNDTJHF-OAHLLOKOSA-N	441.337	1.856	50	20	IDGD	
C[C@@H](c1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)cc1)N1CCOCC1	764170141	ZKVMHRNXRKMWJN-YWZLYKJASA-N	438.484	1.169	50	20	IDGD	
C[C@@H](C(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)CCc2ccccc2)cc1)n1cncn1	764187131	CWDZSZWTVLYMEP-HNNXBMFYSA-N	449.471	1.197	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)C(=O)Nc2cc3c(cc2Br)OCCO3)c1	764238217	QSCCKNAPVNSNTP-UHFFFAOYSA-N	445.229	1.492	50	20	IDGD	
C[C@H]1CN(Cc2ccccc2NC(=O)C(=O)NNC(=O)c2cccc(C#N)c2)C[C@@H](C)O1	764241873	MYKNKMXPBZIBNO-IYBDPMFKSA-N	435.484	1.567	50	20	IDGD	
Cc1nc(C)n(-c2ccccc2NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)n1	764243335	UCLRPBLUXGNZSF-UHFFFAOYSA-N	431.456	1.625	50	20	IDGD	
COC(=O)Nc1cc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)ccc1F	764379375	CVDMBIOHWPGCRC-UHFFFAOYSA-N	440.334	1.762	50	20	IDGD	
CCn1cnnc1-c1cccc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)c1	764379690	HPWHHYNWRFCHNA-UHFFFAOYSA-N	444.398	1.723	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)N1C[C@H]2CCCN2c2ccccc21	764392615	IIXQVPHTHLKIKF-OAHLLOKOSA-N	440.525	1.950	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3n[nH]c(C)c3Br)CC2)cc1	766647228	BOCJCQQJOMSKTP-UHFFFAOYSA-N	449.353	1.368	50	20	IDGD	
CC1=NN(c2ccc(C(=O)NNC(=O)CN3CCN(C(=O)c4ccccc4)CC3)cc2)CC1	766654731	UZWIZLGQCMWQAU-UHFFFAOYSA-N	448.527	1.492	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)c1ccccc1OCC(=O)N(C)C	767272871	AUVYHFTZKNMGFS-UHFFFAOYSA-N	427.457	1.009	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)Cc1csc(NC(=O)C(C)(C)C)n1	767354293	UATFJKNZLCYPEL-UHFFFAOYSA-N	446.529	1.912	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c2ncccc12	768234597	VUCGVTXBYJRSCL-SFHVURJKSA-N	436.424	1.559	50	20	IDGD	
COc1cc2c(cc1NC(=O)C(=O)NNC(=O)c1cccc(N(C)C)c1)NC(=O)CC2	768237456	KZZSFIKTBNBNPQ-UHFFFAOYSA-N	425.445	1.046	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3c[nH]nc3-c3ccncc3)n[nH]2)cc1OC	768275878	HRFLCGZKQFCELW-UHFFFAOYSA-N	433.428	1.954	50	20	IDGD	
COC(=O)c1ccc(S(=O)(=O)NNC(=O)c2ccc(Br)cc2Cl)cn1	769632668	JXOHKDQNUVDSSQ-UHFFFAOYSA-N	448.682	1.907	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)NCC3(N4CCOCC4)CCCCC3)nc21	770334927	DKJMZFORYPPISA-UHFFFAOYSA-N	446.556	1.948	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)NCc3ccc(NC(=O)c4ccncc4)cc3)nc21	770369385	NHTSQOLACGUODF-UHFFFAOYSA-N	433.432	1.543	50	20	IDGD	
CC[C@@H](C#N)Oc1cc(CNC(=O)NNc2nc(O)c3cnn(C)c3n2)ccc1OC	770394616	KUWLKHYMMFMHCV-LBPRGKRZSA-N	426.437	1.585	50	20	IDGD	
Cc1nn(C)c(N2CCN(C(=O)NNC(=O)[C@@H](C)Oc3cccc(Cl)c3)CC2)c1C#N	770649227	NKLCRPWCIWKBEL-CQSZACIVSA-N	445.911	1.584	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)CS(=O)(=O)CCCc3ccccc3)nc21	770959563	XNRBFBFMEWPRGG-UHFFFAOYSA-N	446.533	1.778	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNS(=O)(=O)c1ccccc1OC(F)F	771607652	OYNIRHPCSPMLIE-UHFFFAOYSA-N	433.820	1.567	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)NCCN(C)S(=O)(=O)c2cccs2)c1	772015282	GOUFMRLFQWELQK-UHFFFAOYSA-N	442.519	1.030	50	20	IDGD	
CSCC[C@H](NC(=O)c1ccc([N+](=O)[O-])o1)C(=O)NNC(=O)c1ccc(C)c(F)c1	774057653	FIHPJUFNNDCAFU-ZDUSSCGKSA-N	438.437	1.948	50	20	IDGD	
CCCn1nc(C(=O)NNS(=O)(=O)c2ccc(COC)cc2)c2ccccc2c1=O	774611381	QURNLXXSTPUSEM-UHFFFAOYSA-N	430.486	1.576	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)c1cnc(O)c([N+](=O)[O-])c1	776323747	REZZAZYMQHXIJU-MRVPVSSYSA-N	425.195	1.686	50	20	IDGD	
CC[C@@H](NC(=O)NNc1cccc(S(C)(=O)=O)c1)c1ccccc1OCC(=O)NC	776612928	KMOMGHHGNYOIDT-QGZVFWFLSA-N	434.518	1.992	50	20	IDGD	
COc1nc(C)ccc1C(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	777419455	KWUOBRVKIPEJTG-UHFFFAOYSA-N	431.924	1.631	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(N2CCOC2=O)c([N+](=O)[O-])c1)NC1CCCCC1	777595548	HCECDCUMWHCNGI-UHFFFAOYSA-N	427.439	1.377	50	20	IDGD	
O=C(NNc1ncccn1)c1cc(I)ccc1N1CCOCC1	778413338	JNMQOSMVFMDGNY-UHFFFAOYSA-N	425.230	1.675	50	20	IDGD	
COCC(=O)N1CCc2cc(NC(=O)C(=O)NNC(=O)CCCc3cccs3)ccc21	778714187	QNZXWYASXKCLIY-UHFFFAOYSA-N	444.513	1.392	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)N3CCOCC3)c(F)c2)cc1F	778726665	RWVWQILTARUTOL-UHFFFAOYSA-N	446.410	1.145	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCOCC2)cc1NC(=O)NNc1ncncc1Cl	782007164	WTJUHQRFUONVOE-UHFFFAOYSA-N	442.885	1.308	50	20	IDGD	
COC(=O)c1scc(C)c1NC(=O)C(=O)NNC(=O)c1cnn(-c2ccccc2)c1	782116807	GMOYWWDIMZHWBL-UHFFFAOYSA-N	427.442	1.429	50	20	IDGD	
COc1cc(C(=O)N(C)C)ccc1NC(=O)C(=O)NN=c1sc2ccccc2n1C	783352145	ZDMWFDKWKOQHFE-UHFFFAOYSA-N	427.486	1.521	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CNC(=O)c2ccco2)cc1NC(=O)C(C)(C)C	784004733	RLDFIVOYZCWMRE-UHFFFAOYSA-N	443.460	1.089	50	20	IDGD	
CCN(CC)c1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)cn1	784210595	XGLIPIPIKHOHDT-UHFFFAOYSA-N	446.533	1.450	50	20	IDGD	
Cn1cc(Br)cc(NC(=O)C(=O)NNc2ccc(Br)nc2)c1=O	784807162	VHSDQTDMCJTGPX-UHFFFAOYSA-N	445.071	1.387	50	20	IDGD	
CC[C@@H](C)NS(=O)(=O)Cc1cccc(NC(=O)C(=O)NNc2cccc([N+](=O)[O-])c2)c1	784831365	KSQVEAVGJYXFQX-CYBMUJFWSA-N	449.489	1.895	50	20	IDGD	
O=C(NNc1ncc(F)cn1)C(=O)Nc1cc(F)c(F)cc1I	784956574	LVMMYBKEEGQBSI-UHFFFAOYSA-N	437.119	1.580	50	20	IDGD	
CNC(=O)Cn1nc(NC(=O)C(=O)NNc2c(F)cc(F)cc2Br)cc1C	785008369	NDFOVBFLWKBTFX-UHFFFAOYSA-N	445.224	1.060	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)COc1cccc(I)c1	785130469	CTMBYHHJDJCPEK-UHFFFAOYSA-N	433.246	1.122	50	20	IDGD	
COc1ccc(Cl)c(NC(=O)C(=O)NNc2c(OC)cccc2S(C)(=O)=O)c1	785337577	HSMPLOQOAUAWDC-UHFFFAOYSA-N	427.866	1.843	50	20	IDGD	
O=C(NNC(=O)c1ccc2cncn2c1)c1cccc(S(=O)(=O)N2CCCCC2)c1	785669573	FTUVLYIFAPVOOW-UHFFFAOYSA-N	427.486	1.584	50	20	IDGD	
O=C(CCc1ccc(O)nc1)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	786825405	DYXOAXRNAUIILO-UHFFFAOYSA-N	443.467	1.883	50	20	IDGD	
C[C@@H]1CC(C)(C)C[C@@]2(C1)NC(=O)N(CC(=O)NNc1ccc(-n3ccnc3)nn1)C2=O	788177739	MBLHQQHKBIJNNR-ZUOKHONESA-N	426.481	1.242	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(C)c(C(=O)NNc2ccccc2S(N)(=O)=O)c1	788232757	XMCJCFINYCEWTI-UHFFFAOYSA-N	440.547	1.430	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNS(=O)(=O)c1ccc(C#N)c(Br)c1	788478647	SCEUMKNNPODIID-UHFFFAOYSA-N	434.275	1.900	50	20	IDGD	
CN(C)[C@@H]1CCOc2c(NC(=O)C(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)cccc21	789729515	AATSZXRNYQJLNB-MRXNPFEDSA-N	427.417	1.380	50	20	IDGD	
NS(=O)(=O)c1ccc(OCCSCC(=O)NNc2cccc(F)c2[N+](=O)[O-])cc1	791148186	SDBMPSPIXLFLAL-UHFFFAOYSA-N	444.466	1.637	50	20	IDGD	
CC[C@@H](C)n1ncc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)c1C	792283967	SIERFGUYDYRTQX-GFCCVEGCSA-N	434.522	1.685	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ncccc2Br)c1	792807249	OLQAZTCSBKQSGY-UHFFFAOYSA-N	427.280	1.169	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1	794064657	GBCOKWHBXUICAK-UHFFFAOYSA-N	438.400	1.468	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc(Cl)ccc1C(F)(F)F)c1ccc(-n2cnnn2)cc1	795283948	OBIRUDHIXJTFIZ-UHFFFAOYSA-N	446.798	1.958	50	20	IDGD	
CC(C)(C)c1cc(CS(=O)(=O)NNC(=O)c2csc(N3CCOCC3)n2)no1	795285831	ZTPUQIOQKTYCFU-UHFFFAOYSA-N	429.524	1.030	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)NCC2(C#N)CC2)c1	797581315	RLGQVQWDIVLMNS-UHFFFAOYSA-N	443.485	1.744	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)Nc3ccc(S(=O)(=O)N(C)C)cn3)n[nH]2)cc1	797653116	FDDMFUJYKYUKLY-UHFFFAOYSA-N	443.489	1.497	50	20	IDGD	
Cc1nn(CCS(C)(=O)=O)c(C)c1COC(=O)/C(C#N)=C\c1cc(C#N)n(C)c1C	797859918	XAAHQEZGNXDOAJ-IUXPMGMMSA-N	429.502	1.714	50	20	IDGD	
COc1cccc(/C=C(/C(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)n2nnnc2C)c1	798310506	ZRQSZNCCFGKTFR-UNOMPAQXSA-N	449.471	1.391	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NCc2ccncc2OCC(F)(F)F)cc1	798525587	YRNNRUHYNYNWLU-UHFFFAOYSA-N	428.367	1.941	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2ccccc2S(=O)(=O)CCN(C)C)c2ccccc2n1	799010706	NTZDAZTUQZJRPF-UHFFFAOYSA-N	440.525	1.953	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)c1nc2cccnc2s1	801171696	ISUAKUYTAQVZCJ-UHFFFAOYSA-N	444.948	1.924	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)Cn2cc(Br)c(O)nc2=O)c(Cl)c1	802048367	OSMGZAPMWWJDLO-UHFFFAOYSA-N	430.646	1.526	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)CCCS(=O)(=O)N2CCCC2)c(OC)cc1Cl	802077249	NJIPBBNUIVTEJW-UHFFFAOYSA-N	448.929	1.716	50	20	IDGD	
COc1cc(OC)cc(C(=O)NCC(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)c1	802287363	APIOLFRDJOGGHS-UHFFFAOYSA-N	449.847	1.091	50	20	IDGD	
C[C@@H](CCNS(=O)(=O)c1ccccc1)NC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	802528148	RLVJIDZMZNYSCX-ZDUSSCGKSA-N	435.462	1.296	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)c1cccc(NN2C(=O)[C@H]3CC=CC[C@@H]3C2=O)c1	804955976	YULAJEWLQZKCDP-IRXDYDNUSA-N	444.455	1.697	50	20	IDGD	
COC(=O)c1cc(CNC(=O)NNC(=O)c2nnc(O)c3ccccc23)ccc1OC	806968682	GUJSRQLGWAVYAA-UHFFFAOYSA-N	425.401	1.275	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)CC[C@H]1NC(=O)N(c2ccc(Cl)cc2)C1=O	807371053	BXRILUSWAHLJNR-CQSZACIVSA-N	440.884	1.482	50	20	IDGD	
O=C1CN(c2ccc(NC(=O)C(=O)NNc3nccnc3C3CCC3)cc2Cl)CCN1	807462017	GNJBINKWVGJFFS-UHFFFAOYSA-N	443.895	1.416	50	20	IDGD	
C#CC[C@]1(C(=O)NNC(=O)CCN2C[C@H](C)O[C@H](C)C2)CCCN1C(=O)OC(C)(C)C	809556915	PERPMDAESFHYNJ-HYFFOGBASA-N	436.553	1.426	50	20	IDGD	
O=C(NCc1cccc(-c2nc(CC(F)(F)F)no2)c1)NNC(=O)C(=O)N1CCCC1	812478751	VXOHMJLXKNENLP-UHFFFAOYSA-N	440.382	1.294	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NN=Cc2ccc(Cl)c(S(N)(=O)=O)c2)c1	814724760	AELKLDRPBFHRLW-UHFFFAOYSA-N	444.922	1.002	50	20	IDGD	
O=C(CSc1nnc(O)nc1O)NN=C1COc2c(Br)cc(Cl)cc21	814784028	CADRYWTXCPXRBW-UHFFFAOYSA-N	446.670	1.704	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NN=C3CCC(CS(C)(=O)=O)CC3)CC2)cc1	814878600	DEXQNPKMBUPHPF-UHFFFAOYSA-N	434.606	1.820	50	20	IDGD	
CC1(C)C(=O)Nc2cc(C(=O)OCC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)ccc21	815410688	NNAKCQMRYYJQLZ-UHFFFAOYSA-N	426.385	1.443	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1)[C@@H]1C[C@H]1C	815563763	NJCQHVKCHMFSOJ-KZULUSFZSA-N	439.428	1.756	50	20	IDGD	
CN(C/C=C/C(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1)CC(F)(F)F	815634637	OHTFYBDQFJUXJZ-AATRIKPKSA-N	437.463	1.767	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2CCc3nncn3C2)cc1OCCC(C)C	815692146	KFVFSZBPTJSKHM-OAHLLOKOSA-N	428.493	1.360	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)[C@@H]2CCCN(C(=O)c3ccc(F)cc3)C2)c1	825801069	JJOTUBDGNGYHCA-MRXNPFEDSA-N	428.464	1.946	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)c2ccc(S(=O)(=O)NC(C)(C)C)cc2)c1	825805987	VDYZGJYHUVENKV-UHFFFAOYSA-N	434.518	1.645	50	20	IDGD	
O=C(Nc1nc(CC(=O)N2CC[C@@H](B(O)O)C2)cs1)c1ccc(Br)o1	864231545	PCQTYHCHFCSZOQ-MRVPVSSYSA-N	428.073	1.369	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2ccc(I)cc2)C[C@H](C)O1	912921763	WAMCPUGFHCUWCZ-RYUDHWBXSA-N	431.274	1.552	50	20	IDGD	
Cc1cccc(OCCC(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1C	914592190	VVAUPTRAQKUFFY-LJQANCHMSA-N	428.441	1.603	50	20	IDGD	
O=C(COC(=O)c1cccnc1OCC(F)(F)F)NNC(=O)c1ccc([N+](=O)[O-])cc1	914660775	SREIHSWFLHLIHA-UHFFFAOYSA-N	442.306	1.549	50	20	IDGD	
COc1ccccc1C(=O)N1CCN(CC(=O)NNC(=O)c2cccc(Cl)c2)CC1	914789383	NGOFYICYGLITCN-UHFFFAOYSA-N	430.892	1.568	50	20	IDGD	
C[C@@]12CCC(=O)N1c1ccccc1C(=O)N2CC(=O)NNC(=O)c1cc2c(s1)CCC2	914830652	NHLGXRYMFLPIPQ-QFIPXVFZSA-N	438.509	1.997	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NC[C@@H]1CN(Cc2ccccc2)CCO1	915894109	HWMIDMIQGXZITC-OXJNMPFZSA-N	430.480	1.824	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1csc(N2CCOCC2)n1)c1ccc2c(c1)CC(=O)N2	916649106	IMMPPHPZCGOCGL-NSHDSACASA-N	430.490	1.180	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)CCc2nc3ccccc3o2)cc1	916829286	VVINFPMEQMYIQC-UHFFFAOYSA-N	430.486	1.537	50	20	IDGD	
CCN1C(=O)C(=NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)c2cc(C)ccc21	917027070	ZVPKNTOFGIZXRJ-UHFFFAOYSA-N	428.514	1.811	50	20	IDGD	
COc1cc(S(=O)(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)cc(C(=O)O)c1OC	917721507	XFJSQBLQUVYBHC-UHFFFAOYSA-N	438.502	1.928	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNS(=O)(=O)c2ccc(O)c(C(=O)OC)c2)cc1	917724837	APBFPENWGKIFLW-GFCCVEGCSA-N	438.458	1.355	50	20	IDGD	
O=C(CCn1cc(Cl)cn1)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	917901994	CSZVTFDDYDSFHU-UHFFFAOYSA-N	439.925	1.562	50	20	IDGD	
CS(=O)(=O)C[C@@H]1CCCN(C(=O)NNC(=O)c2ccc(COc3ccccc3)o2)C1	918002367	DTESKUKUTGSOTD-OAHLLOKOSA-N	435.502	1.970	50	20	IDGD	
CCCC(=O)N1CCC[C@H](C(=O)OCC(=O)NNC(=O)c2cc(Cl)ccc2OC)C1	919614296	ATLSBQZOYBWBTM-ZDUSSCGKSA-N	439.896	1.692	50	20	IDGD	
CN(C)C(=O)COc1ccccc1/C=C(/C#N)C(=O)Nc1ccc(S(N)(=O)=O)cc1	920397780	PUAZWSALKGWTFH-PTNGSMBKSA-N	428.470	1.347	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)Nc2ccc(=O)n(C)c2)cc1	920853671	DNXPREDKRRAFGB-LFIBNONCSA-N	446.467	1.678	50	20	IDGD	
NC(=O)[C@H]1CCCN1Cc1cccc(NC(=O)NNC(=O)COc2ccccc2F)c1	920930538	OFEGFIBVWNISQQ-QGZVFWFLSA-N	429.452	1.507	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)N[C@@H]2CCO[C@@]3(CCS(=O)(=O)C3)C2)c2ccccc2n1	1319831598	JSFQWAIWDCWEJM-VLIAUNLRSA-N	432.502	1.224	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@H]1CCCCN1Cc1cccnc1	1338792226	DMZLZQQDPIBFJY-QGZVFWFLSA-N	444.561	1.499	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)N1CCO[C@]2(CCN(C(=O)CO[Si](C)(C)C)C2)C1	1779295242	BWDCKEPNCBIGCV-NRFANRHFSA-N	430.581	1.938	50	20	IDGD	
C=C[C@@H](O)C(C)(C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)Br)C2	1779339205	GVCCFMMTZOISQX-DEXNDLTESA-N	431.371	1.857	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccnn2C(C)C)C1	1779750454	GILNTIHWOLLLDZ-WRWLIDTKSA-N	426.945	1.845	50	20	IDGD	
O=C(c1cnn2ccccc12)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781330318	WHDIPBVCQGARCP-PBHICJAKSA-N	425.258	1.468	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)C[C@@H]3OCCc4ccccc43)CCO2)C1	1783871531	SSIUQZHWLVXGPQ-IPJJNNNSSA-N	436.936	1.774	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)CCc3ccc(N(C)C)cc3)CCO2)C1	1783879531	WPDCQLNMSWFSLS-KNQAVFIVSA-N	437.968	1.769	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccn(C(F)F)n3)C[C@@H]21	1783970715	ZAVHCMLTRBXKBP-UHXUPSOCSA-N	449.296	1.903	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccccc3OC(F)F)C2)C1	1785149166	YDKWANNVJCXNAE-AUUYWEPGSA-N	432.851	1.985	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(CO)c(F)c3)C2)C1	1785263110	LSXBMYIHYZKVQH-ORAYPTAESA-N	443.313	1.793	50	20	IDGD	
CC(C)OC(=O)c1ncccc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21	1785583033	SSFVGRHPXIKNLC-QEWYBTABSA-N	441.887	1.775	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)c1cnn2ccccc12	1787851556	CKTHHVDTOINOHE-QRTARXTBSA-N	435.322	1.713	50	20	IDGD	
CCC(=O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)[C@H]2C1	1789221894	NRCHLVOBQONKGO-AXHNFQJDSA-N	447.444	1.093	50	20	IDGD	
C#CCO[C@@H](C)C(=O)NC1(c2ccc(NC(=O)c3cnccc3C(=O)NN)cc2)CCC1	1789519877	OVNSHAQJYIBFAJ-HNNXBMFYSA-N	435.484	1.471	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3[C@H]4C=CS[C@@H]43)[C@H]2C1	1790622540	NQPYTRYVRZYLKP-SBXGDREPSA-N	429.380	1.872	50	20	IDGD	
CCC(=O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C(C#N)=C/c3ccc(F)cc3F)[C@H]2C1	1790695059	APSJJMMJNUSDBF-GOFCJJFNSA-N	431.439	1.831	50	20	IDGD	
CCC[C@H](NC(C)=O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)Br)[C@H]2C1	1791064791	KROXJHCNEAJHMP-YDMUCJKGSA-N	432.359	1.054	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN3CCCCC3=O)[C@H]2C1	1791183018	CFLLGZQYWFYGAF-VGWMRTNUSA-N	444.370	1.152	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)nc4ccccc34)C[C@@H]21	1791253609	GEXOACOAKWEBQD-KUZCPNRJSA-N	447.919	1.788	50	20	IDGD	
Cc1nnsc1C(=O)NC1(c2ccc(NC(=O)CCC(=O)NN(C)C)cc2)CCC1	1791601665	NCDRAKDNUIKJNL-UHFFFAOYSA-N	430.534	1.967	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCl	1793116802	URYZRSXCXSJHMQ-QRJUGERDSA-N	429.945	1.624	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2)[C@H]1CC(c2ccccc2)=NO1	1793281495	WVQREDMPTXCYHY-OCVGTWLNSA-N	426.300	1.573	50	20	IDGD	
O=C(Cc1cccnc1Cl)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2	1793954396	NIXNDZKZDDVKHZ-ZMJPVWNMSA-N	434.693	1.558	50	20	IDGD	
CCc1[nH]nc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C3)c1F	1794848858	RIXJPSAZOWCOIH-MGGJZVGQSA-N	443.483	1.497	50	20	IDGD	
COc1ccc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCBr)cn1	1795111419	KNHXFPJQNMNJJV-CCWDJLKJSA-N	440.338	1.397	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)Nc1cccnc1	1795610918	HRGVIDKGPKYZPB-BDLOOMQFSA-N	439.354	1.645	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](NC(=O)OC(C)(C)C)C1CC1	1796363875	WGJGUANPOOFVEV-QEOTZNIISA-N	443.972	1.897	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnn2cccnc12	1797369100	ZIDUKKOGTQZCLB-AZGFTEDZSA-N	426.304	1.169	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C=N/N1CCCCC1	1797744086	LHZSCYMVZKRHSR-UIARLXCXSA-N	429.359	1.221	50	20	IDGD	
COc1ccc(F)cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnccc1C(=O)NN	1798443580	JYLFCYKXKFJLKR-QDMKHBRRSA-N	441.463	1.398	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C13CC(C1)C3)C2	1798523156	USTWNTSUAUMPMU-KYOJRIDYSA-N	443.456	1.523	50	20	IDGD	
CC(C)NC(=O)OC(C)(C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Br)C2	1799130609	KCNSWEWYEIDERV-YIYPIFLZSA-N	448.358	1.273	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc3c(c1)CCO3)C2)[C@H](F)Br	1799346531	BHAHCOQIFYCGPX-DACLVMHWSA-N	441.297	1.444	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(NC(C)=O)c(O)c1	1799846976	KSIFDANGGLZUIG-YYAJDYIMSA-N	437.924	1.961	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1Cc2[nH]nc(C(F)(F)F)c2C1	1800320347	CTCCDJLQXJXVHN-UWSPEPLBSA-N	448.873	1.750	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)NC(=O)OC(C)(C)C)C2	1800762504	CMNLZTMAYYJMHW-XGFWRYKXSA-N	448.358	1.273	50	20	IDGD	
CC(C)Cc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCC(=O)NN(C)C)cc1	1801012721	WNHSHNUCWUPMAD-JHDGKUDLSA-N	444.576	1.461	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)Oc1ccccn1	1801362669	QCZVPFDIPFUCNK-SVZOTFJBSA-N	440.338	1.470	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1=COCC1	1801547812	DNBQHIDQSPEJRY-GKEMIQDWSA-N	429.423	1.766	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCOc1ccc(F)cc1)C2	1802334554	MQHUZLHOQPPMBT-BCDXTJNWSA-N	434.512	1.606	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(C(F)(F)F)c[nH]1)C2	1802336151	HQTDLSVXOCXIPT-BTTYYORXSA-N	429.443	1.658	50	20	IDGD	
CC(C)N1CCC(C(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)CC1	1803136038	MBCDSWTUIMAACV-HSALFYBXSA-N	436.984	1.808	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2[nH]nc3ncccc23)[C@H]1c1cccnc1)[C@H](O)CCl	1803140237	YQKLNFOECUKHRX-LXZKKBNFSA-N	428.880	1.272	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H](CNC(=O)[C@@H]2CNC(=O)O2)[C@H]1c1cccnc1	1803649581	DCGMZGOJESMSCL-CBBWQLFWSA-N	439.310	1.369	50	20	IDGD	
Cc1nc(CC(=O)NC[C@H]2CCN(C(=O)CCBr)[C@H]2c2cccnc2)no1	1804489351	LTNXKLOXWJXYOH-KDOFPFPSSA-N	436.310	1.807	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC2(CCN(C(=O)CCC(=O)NN(C)C)CC2)C1	1805389329	MHMNWNPDAMTIMF-OAHLLOKOSA-N	445.402	1.622	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)CCSC(=N)N)[C@H]1c1cccnc1	1807127024	MQJVSSIHRXYVBJ-IJEWVQPXSA-N	427.958	1.358	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)c2ncc[nH]2)[C@@H]1c1cccnc1	1808414449	IEJOZJCZEVLIOV-YCIBLXSWSA-N	448.487	1.258	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)c1cn2ccsc2n1	1809938551	OJTRPGXXOFEXSQ-IMJJTQAJSA-N	433.921	1.710	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)COCCO)[C@@H]1c1cccnc1	1812776264	CQKFYVLNJZTOCE-HLLBOEOZSA-N	428.327	1.270	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2cnn3ccncc23)[C@@H]1c1cccnc1	1813031283	RZFNFCFFBIVVJK-VDZJLULYSA-N	442.907	1.698	50	20	IDGD	
C[C@H](CS(C)(=O)=O)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCBr)[nH]n1	1815226461	DHTILOJLIMMNIV-DGCLKSJQSA-N	449.371	1.868	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccnc2C(N)=O)n[nH]1	1816077161	JSYSZIJLWCITFA-GXFFZTMASA-N	449.309	1.993	50	20	IDGD	
COc1nccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)[C@@H](O)CCl)[nH]n2)c1F	1817664102	GOFIGJCKZWQKSF-OLZOCXBDSA-N	425.848	1.858	50	20	IDGD	
O=C(CS(=O)(=O)N1CCCC1)Nc1cc([C@H]2CCCCN2C(=O)[C@H](F)Cl)[nH]n1	1818108677	QFPXOISZQOOKLK-DOMZBBRYSA-N	435.909	1.362	50	20	IDGD	
O=C(/C=C/C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1)NCc1ccco1	1819532265	KFNSFGCFWVPHPB-MIVXPEEVSA-N	449.895	1.467	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)CCc2cnccn2)n[nH]1	1822824978	PIIXBQJAJLSLMU-KRWDZBQOSA-N	442.524	1.198	50	20	IDGD	
CC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)C1(N3CCN(C)CC3)CC1)CC2	1822849320	HVRGAZZUIWZQOD-ZIAGYGMSSA-N	440.013	1.853	50	20	IDGD	
Cc1cn(CC(=O)Nc2cc([C@@H]3CCCCN3C(=O)C(Cl)Cl)[nH]n2)c(=O)nc1O	1823369650	CICLOWZPIYNXFS-NSHDSACASA-N	443.291	1.476	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CN2C(=O)CNC2=O)CC1	1824609664	OAIOQVMRWIMDIR-HZPDHXFCSA-N	426.945	1.565	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)C[C@H]2NC(=O)NC2=O)CC1	1825069817	ATNULYLPPYDEIR-XHSDSOJGSA-N	426.945	1.612	50	20	IDGD	
CCOc1cnc(C(=O)N[C@@H]2CCc3nc(NC(=O)[C@@H](Cl)COC)sc3C2)cn1	1825993544	JTWXZJQVWULCGG-MNOVXSKESA-N	439.925	1.811	50	20	IDGD	
CO[C@@H](C)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1)CC2	1826155412	ZLXUOQVYKWMILT-ISZNBHMKSA-N	432.506	1.224	50	20	IDGD	
CN1N=C(C(=O)N2CCC([C@H]3CCCCN3C(=O)CCBr)CC2)CCC1=O	1826353329	WKJCGOWNPHSDPK-MRXNPFEDSA-N	441.370	1.999	50	20	IDGD	
O=C(Cc1cccc([N+](=O)[O-])c1)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1829626757	NIHDRYZNDSOSPP-GOSISDBHSA-N	446.287	1.397	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)CSC1CCCC1)CCO2	1831362210	ZDIOTJPUFQOWFS-FQEVSTJZSA-N	444.670	1.970	50	20	IDGD	
C=CCC(F)(F)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1	1831444948	SVZJNLFZOHTHFC-IBGZPJMESA-N	434.292	1.811	50	20	IDGD	
COC(=O)C12CC(C(=O)N3CCCC[C@H]3C3CCN(C(=O)[C@H](O)CCl)CC3)(C1)C2	1831601733	VWTVQXJSHFEVHS-QIRGFQQVSA-N	426.941	1.549	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccn(C(F)F)n3)C2)C1	1831651163	NQTOTLCOIRMCME-SCLBCKFNSA-N	434.871	1.756	50	20	IDGD	
Cc1cccnc1C(=O)N1CCO[C@]2(COCCN(C(=O)CCBr)C2)C1	1831826105	ZPYHMOLMNYSGOB-SFHVURJKSA-N	426.311	1.245	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(F)cn2C)CC1	1831873165	LZSIXQIYIFVQNA-GOSISDBHSA-N	435.544	1.771	50	20	IDGD	
C[C@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1)n1cccn1	1832237300	XYHSDYXZYGXTPO-DYESRHJHSA-N	438.337	1.057	50	20	IDGD	
CC(=O)C(C)(C)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1833410912	RRMAOPJCFBIMRJ-OAHLLOKOSA-N	434.350	1.864	50	20	IDGD	
CC[C@@H](C)[C@H](O)C(=O)NC1CCN(C2CCN(C(=O)CO[Si](C)(C)C)CC2)CC1	1833499166	WZHKDZDPPMOKBK-UZLBHIALSA-N	427.662	1.817	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3cncnc3)CC2)CC1	1834237831	FQEDHRYXIMWZQE-KRWDZBQOSA-N	438.370	1.835	50	20	IDGD	
CCc1oncc1C(=O)N1CCOC[C@]2(CN(C(=O)CCBr)CCO2)C1	1834819464	SRXQJGMAHYYENX-KRWDZBQOSA-N	430.299	1.092	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)C#Cc3ccccc3)CCO2)C1	1835102145	MMHALQXYKORMON-UZLBHIALSA-N	435.318	1.278	50	20	IDGD	
CCC(=O)N[C@H](C)C(=O)N1CCC(N2CCC(NC(=O)CO[Si](C)(C)C)CC2)CC1	1835834691	FDKOTOJKBNQQNU-MRXNPFEDSA-N	440.661	1.324	50	20	IDGD	
Cn1cc(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)cn1	1835988515	ZIEIPHWKPAIGPF-OALUTQOASA-N	447.363	1.045	50	20	IDGD	
CCc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](C)CBr)C3)C2)no1	1838121967	RLPSFNZSDWYRHD-SCLBCKFNSA-N	444.326	1.338	50	20	IDGD	
COc1ccccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1	1838877213	STFBAFMMHASSOY-OAQYLSRUSA-N	436.581	1.617	50	20	IDGD	
COc1cccc(OC)c1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1838881961	DOEABAGSIFBAQU-LPHOPBHVSA-N	430.860	1.308	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccc(F)c(C#N)c3)C2)C1	1839147074	GEYUMMYYBAFOOK-UTKZUKDTSA-N	437.899	1.714	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCCn3ccnc3C)C2)C1	1839149152	VFFSLZBINFDZFC-FXAWDEMLSA-N	426.945	1.446	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccccc3O)C2)C1	1839155401	SHHQFIZQVJDIBG-VQTJNVASSA-N	445.343	1.627	50	20	IDGD	
Cc1cccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)c1F	1839197445	WOVMWWAAHPCGKY-YJBOKZPZSA-N	447.276	1.895	50	20	IDGD	
Cc1n[nH]c(C)c1CC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1	1839241339	KEDHXJGLXWGWBA-OALUTQOASA-N	447.363	1.262	50	20	IDGD	
O=C(c1cnc2ccc(F)cn12)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1839591583	JIUFCHIMRBBMOS-MAUKXSAKSA-N	428.823	1.078	50	20	IDGD	
CC[C@@H](O)C(=O)N1CCOC[C@]2(CN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)CCO2)C1	1839741799	BNYBLHWVBYOCMK-ALNQAOQGSA-N	449.454	1.099	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cncs3)C2)C1	1839963617	QGJNFMKKFJDXMW-MLGOLLRUSA-N	432.340	1.387	50	20	IDGD	
O=C(C(Cl)Cl)N1CCO[C@]2(COCCN(C(=O)[C@H]3Cc4ccccc4O3)C2)C1	1840188649	VYWNBCPLSWWYFP-BEFAXECRSA-N	429.300	1.250	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(F)ccc3OC)CCO2)C1	1840691067	SQUYHPVGYQYSFS-OXJNMPFZSA-N	444.887	1.158	50	20	IDGD	
CCOC(=O)C(C)(C)C(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1840882093	FIEQBJQHLFOGAS-FQEVSTJZSA-N	432.945	1.297	50	20	IDGD	
C[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1C(=O)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1	1841351149	HDJWEFZUGQBOLG-SOUVJXGZSA-N	429.945	1.293	50	20	IDGD	
C[C@H]1[C@@H](C(=O)N2CC3(CCCN3C(=O)[C@@H](O)CCl)C2)CCCN1C(=O)OC(C)(C)C	1841352977	XHODJWNNCQMUOD-JYJNAYRXSA-N	443.972	1.825	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CCCC[C@H]1C(=O)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1	1841354837	ZKHITEGUYAKHKU-OAGGEKHMSA-N	443.972	1.873	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1nc(Cl)ccc1F)C2	1844263720	MZFQPPCYNWREEA-UHFFFAOYSA-N	432.843	1.003	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)[C@@H]2CCCN(C)C2)C1	1845055275	WLGQYXZFQUCOLM-MRXNPFEDSA-N	444.488	1.679	50	20	IDGD	
O=C([C@H](Br)Cc1ccccc1)N1CC2(CCCN2C(=O)COCCO)C1	1845213317	ZRVRUWCAFHEFIN-MRXNPFEDSA-N	425.323	1.205	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@H]2Cc3[nH]nc(C(F)(F)F)c3C2)C1	1845858688	KDYXPMFHTMVFON-CMPLNLGQSA-N	434.846	1.601	50	20	IDGD	
CCOC(=O)N1CCC(C(=O)N2CCCC23CN(C(=O)[C@@H](C)Br)C3)CC1	1846978462	RTCLDGMQWRTOLJ-CYBMUJFWSA-N	430.343	1.842	50	20	IDGD	
COc1ccc(CC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](O)CCl)c(Br)c1	1847559539	SMUFXTTZXCPPAF-HRCADAONSA-N	445.741	1.802	50	20	IDGD	
CC1(C)C=C(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](O)CCl)CN1C(=O)c1ccccc1	1847564843	ZTDLMPQTDHOHAZ-GBESFXJTSA-N	445.947	1.649	50	20	IDGD	
C[C@@H](CNC(=O)OCc1ccccc1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl	1847565757	XANZXUIMPGIGOO-DKIMLUQUSA-N	437.924	1.350	50	20	IDGD	
COc1ccc(Br)cc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl	1847565806	YURDTTRDZOXAGC-MELADBBJSA-N	431.714	1.873	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)N2CCC(C(=O)NNc3nc(C)cc(C)n3)CC2)cc1	14511384	ITWYNVLIIJRABA-UHFFFAOYSA-N	431.518	1.840	50	20	IDGD	
Cc1cc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)c3cccc(N(C)C)c3)c2)no1	17252957	ZURLZEXOFFLZSQ-UHFFFAOYSA-N	443.485	1.925	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)CNS(=O)(=O)c1ccc2ccccc2c1	725910572	YKPJFZZOIUZLBN-UHFFFAOYSA-N	437.481	1.535	50	20	IDGD	
C[C@@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)NNc2nc(-c3ccncc3)no2)C1=O	726376153	GHBDWDZNMZFYCC-IBGZPJMESA-N	425.380	1.181	50	20	IDGD	
O=C(Cc1csc(N2CCOCC2)n1)NNC(=S)Nc1ccc2c(c1)OCCCO2	727271154	ZFUOIUUWFZEPAI-UHFFFAOYSA-N	449.558	1.701	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)COc1ccccc1C#N)c1cccc(S(=O)(=O)N(C)C)c1	727610491	RFNZIHRMEOAPHX-AWEZNQCLSA-N	445.501	1.279	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(\C#N)C(=O)NCCCN2CCC[C@@H](C(N)=O)C2)c1C	728077410	IQABOSSMGNSPHR-JPDNKWTCSA-N	429.565	1.923	50	20	IDGD	
COc1ccc(CN2C[C@H](C(=O)NNC(=O)CNc3cccc(OC)c3)CC2=O)cc1	728207753	GMNDTVKZLHSHEJ-MRXNPFEDSA-N	426.473	1.312	50	20	IDGD	
CS(=O)(=O)N1CCc2cc(C(=O)NNC(=O)c3cccc(OC(F)F)c3)ccc21	728487981	HQSBQXSOPANFCG-UHFFFAOYSA-N	425.413	1.685	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)[C@H]2CCCN2c2ccc(C#N)cc2)n1	728732889	TZTJQGXWGZEQBI-MRXNPFEDSA-N	427.486	1.225	50	20	IDGD	
CC1(C)CN([C@@H](CNC(=O)NNC(=O)C(=O)NC2CC2)c2ccc(Cl)cc2)CCO1	729054744	JVHXWMVCEXFIQI-INIZCTEOSA-N	437.928	1.101	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1ccc(SCc2cn3ccccc3n2)cc1	729275747	REUODCKLBVNYOE-ZDUSSCGKSA-N	447.542	1.325	50	20	IDGD	
C=CCOCC(=O)NNC(=O)c1ccc(NS(=O)(=O)c2ccc(OCC)cc2)cc1	729296850	IYZWNWPZOPIKEP-UHFFFAOYSA-N	433.486	1.850	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCC([C@@H](C)NC(=O)OC(C)(C)C)CC2)n1	730267055	KONULHMYBXARNN-CQSZACIVSA-N	439.582	1.767	50	20	IDGD	
CN(C)c1cc(C(=O)NN=C2C(=O)Nc3c(I)cccc32)ccn1	731561227	UTJRBGYWFXTYFR-UHFFFAOYSA-N	435.225	1.838	50	20	IDGD	
Cc1c(C(=O)NNC(=O)CCN2C[C@@H](C)O[C@H](C)C2)nnn1-c1cccc2cccnc12	732260875	IRGALEZWOOTAJK-HUUCEWRRSA-N	437.504	1.384	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CCN2C[C@@H](C)O[C@H](C)C2)cc1I	732261358	MMPBQMYWGYCOSB-CHWSQXEVSA-N	445.301	1.860	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)NCc2ccc(N(C)S(C)(=O)=O)cc2)c1C	732476146	ZTRRLKUQMJJMIV-INIZCTEOSA-N	448.545	1.997	50	20	IDGD	
Cn1c(NNC(=O)c2cn(-c3ccc(C(F)(F)F)cn3)nn2)nc2ccccc2c1=O	733262008	NGXXQCLWAOCQKO-UHFFFAOYSA-N	430.350	1.685	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)CC[C@H]2NC(=O)N(c3ccc(C#N)cc3)C2=O)cc1	733758479	BKFMRNOXDOIPOB-LJQANCHMSA-N	449.467	1.552	50	20	IDGD	
CC[C@@H](C#N)Oc1cccc(CNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1	733801143	LKLGDJHVRPRDSA-SFHVURJKSA-N	437.504	1.905	50	20	IDGD	
C[C@H]1CCCC[C@H]1CCNC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	734071643	NTOXWELMZKWOID-IRXDYDNUSA-N	438.598	1.860	50	20	IDGD	
CCOC(=O)c1cc(S(=O)(=O)NNC(=O)c2ccccc2F)cc([N+](=O)[O-])c1C	734806884	NZPZSQMZVKNIKH-UHFFFAOYSA-N	425.394	1.842	50	20	IDGD	
COCCOc1ccc(-n2nc(C)c(C(=O)NNC(=O)COc3cccc(C)c3)n2)cc1	735029139	SJPGRMNTXFILDV-UHFFFAOYSA-N	439.472	1.749	50	20	IDGD	
C[C@@H](CN1CCN(c2ccccn2)CC1)NC(=O)NNC(=O)Cn1ccc2ccccc21	735517366	CTTXNQJBXCLSQY-SFHVURJKSA-N	435.532	1.577	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)C3(c4ccccc4F)CC3)cc2)CC1	736677216	XEFMNPWXCCUMQT-UHFFFAOYSA-N	432.521	1.937	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)CN2C(=O)c3ccc(C)cc3C2=O)cc1C	736762093	OHWXGRKQPPJPGX-UHFFFAOYSA-N	443.481	1.528	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H]1CCC[C@@H]1C(=O)NNC(=O)c1csc(N2CCOCC2)n1	739679857	DPIKSWYHARLERO-STQMWFEESA-N	439.538	1.434	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NC[C@@H](O)c1c(Cl)cccc1Cl	740913190	PXGAZJRVFJOAPG-LLVKDONJSA-N	431.301	1.849	50	20	IDGD	
CCCNC(=O)c1cccc(C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c1	741368388	HDJRMMQFTSNOFR-UHFFFAOYSA-N	428.401	1.353	50	20	IDGD	
COc1ccccc1-n1c(SCC(=O)NNC(=O)C2CC2)nnc1N1CCCCC1	742450926	JGGOPIBPMDJQKD-UHFFFAOYSA-N	430.534	1.916	50	20	IDGD	
NS(=O)(=O)c1ccc(CC(=O)NNC(=O)NCc2cccc(C(F)(F)F)c2)s1	742453811	ZPARFHABMBHOMA-UHFFFAOYSA-N	436.437	1.487	50	20	IDGD	
Cc1ccc(CN2C(=O)CC[C@@H]2C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1	742473767	IKHLPWUAFZBHAC-GOSISDBHSA-N	433.468	1.194	50	20	IDGD	
C[C@@H](CC(=O)NNC(=O)c1cc(Cl)ccc1O)/N=C1/NS(=O)(=O)c2ccccc21	743296966	RRZMVBVUTLYBTK-JTQLQIEISA-N	436.877	1.324	50	20	IDGD	
CN(C)C(=O)CS(=O)(=O)c1ccc(C(=O)NNc2cccc(C(F)(F)F)n2)cc1	743486275	YOASKRFJPOQCCP-UHFFFAOYSA-N	430.408	1.719	50	20	IDGD	
C[C@@H]1Oc2ccccc2N(CCC(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)C1=O	744531592	PGYXBKTXLRQEQQ-AWEZNQCLSA-N	436.424	1.067	50	20	IDGD	
Cc1nc(-c2ccc(C(=O)NNC(=O)CCN3CCN(c4ccccc4)CC3)cc2)n[nH]1	746092470	RSTBAPWTJWNEDT-UHFFFAOYSA-N	433.516	1.753	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H](C)N2CCc3ccccc32)c1	746855154	GLMMFXJYONOTHV-INIZCTEOSA-N	444.557	1.929	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@H]1CCCN1C(=O)CC(C)(C)C	748211953	APVYGSFORUUARX-CQSZACIVSA-N	437.566	1.476	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)NNC(=O)[C@H](C)Oc2ccc(OCC)cc2)o1	748641341	UAHIPUUAPOABRJ-LBPRGKRZSA-N	426.447	1.632	50	20	IDGD	
O=C(O)COc1ccc(S(=O)(=O)NNC(=O)CCOc2ccccc2)cc1Cl	748692006	DIBQSZCXHOVRMF-UHFFFAOYSA-N	428.850	1.582	50	20	IDGD	
Cc1cc(Br)ccc1NNC(=O)[C@H]1CC(=O)N([C@H]2CCS(=O)(=O)C2)C1	748730169	KJMVIBPDHBORHY-AAEUAGOBSA-N	430.324	1.236	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)COc3ccccc3OC)n[nH]2)cc1OC	751297264	KYOBAFBWSSRLSI-UHFFFAOYSA-N	426.429	1.943	50	20	IDGD	
Cc1oc(-c2cnn(C)c2)nc1C(=O)NNC(=O)COc1ccc(Br)cc1	752269303	UTUWCDCLWKEFFL-UHFFFAOYSA-N	434.250	1.986	50	20	IDGD	
N#Cc1ccc(CN2CC[C@H](NC(=O)NNC(=O)c3cnn(-c4ccccc4)c3)C2=O)cc1	753134294	CXNJKDGIEKAPHI-FQEVSTJZSA-N	443.467	1.489	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)C[C@](C)(O)C2CC2)c1	755381730	QJOWEQUDZCXVSN-NRFANRHFSA-N	447.513	1.808	50	20	IDGD	
COc1cc(CN2CC[C@H](NC(=O)NNC(=O)COc3ccc(C)cc3)C2)cc(OC)c1	756103981	WHUUMOAVFOBOKO-SFHVURJKSA-N	442.516	1.996	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)N[C@@H]1CCN(c2c(F)cccc2F)C1=O	756210377	DGYYDKCWGIHLDL-OAHLLOKOSA-N	429.383	1.351	50	20	IDGD	
CCc1ccc(NC(=O)NNC(=O)CSc2ccccc2OC)cc1S(N)(=O)=O	756523241	CNXYAGVRQAZEEY-UHFFFAOYSA-N	438.531	1.850	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)Nc2ccc(S(=O)(=O)NC3CC3)cc2)c1	756777095	UTOQOLFUFGPOPR-UHFFFAOYSA-N	434.474	1.611	50	20	IDGD	
NC(=O)c1ccc(NNC(=O)CCc2ccc(S(=O)(=O)N3CCCCCC3)cc2)nn1	757399846	PBSVZENGJXYOQL-UHFFFAOYSA-N	446.533	1.216	50	20	IDGD	
CCOc1ccc(OCC)c(NC(=S)NNC(=O)c2coc(S(N)(=O)=O)c2)c1	757642391	SCNZNJAJSWDIMW-UHFFFAOYSA-N	428.492	1.356	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2cccc(-n3ccnn3)c2)cc1	757734733	MFKPQLNFULYSMZ-UHFFFAOYSA-N	443.489	1.049	50	20	IDGD	
COc1cccc(OC)c1CC(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758785300	DSPNBVJNBHFOPQ-UHFFFAOYSA-N	436.509	1.882	50	20	IDGD	
COc1ccc(OC)c(S(=O)(=O)N2CCN(CCI)CC2)c1	759320935	CVRUBDGTGKWFDZ-UHFFFAOYSA-N	440.303	1.445	50	20	IDGD	
COc1ccc(C(=O)N([C@H]2CCS(=O)(=O)C2)N(C)C)c(I)c1	760318853	UMBYPKPSSRONRH-JTQLQIEISA-N	438.287	1.406	50	20	IDGD	
CCS(=O)(=O)Nc1cc(OC)ccc1S(=O)(=O)NNC(=O)c1ccc(C)cc1O	761275047	YQYOZUKRFHUABL-UHFFFAOYSA-N	443.503	1.094	50	20	IDGD	
O=C(CN1CCCCCC1)Nc1ccc(NC(=O)C(=O)NNC(=O)c2cccnc2)cc1	763494933	LPAFSNANKGNEHF-UHFFFAOYSA-N	438.488	1.296	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2nc(C(C)(C)C)ns2)cc(OC)c1OC	763539542	NBNAZAAGMCQDHG-UHFFFAOYSA-N	437.478	1.261	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)C(=O)Nc1cccc(NC(=O)c2ccncc2)c1	763551426	NVXJGKUJRBSKSL-UHFFFAOYSA-N	447.407	1.462	50	20	IDGD	
COCCn1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2-c2ccccc2)n1	763642127	PVJFIDBYYGTIMZ-UHFFFAOYSA-N	437.456	1.361	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNC(=O)COc2ccc(OC)cc2)ccc1Cl	763659343	MPFQUQXCFPOEDW-UHFFFAOYSA-N	449.847	1.690	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cc(F)c(N3CCCC3)c(F)c2)cc1	763661772	PETKNZZSTTYMPA-UHFFFAOYSA-N	448.426	1.739	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccc(NC(=O)C2CC2)c1	763679660	CBNRQIBYPYKCNO-UHFFFAOYSA-N	440.456	1.599	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(OC[C@@H]2CCCO2)cc1	763713227	MITKSAYGLBDOKN-IBGZPJMESA-N	441.484	1.972	50	20	IDGD	
CN(C)c1ncc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccco3)nc3ccccc23)cn1	763763132	HPWHXGXGFQOFGC-UHFFFAOYSA-N	445.439	1.751	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(CN3C(=O)CCCC3=O)cc2)cc1	763831747	MEDCVRSLIXXITE-UHFFFAOYSA-N	436.468	1.688	50	20	IDGD	
CCN(CC)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)cc1	763839792	LYNIIAGEBDREQW-UHFFFAOYSA-N	430.436	1.473	50	20	IDGD	
COCCOc1cc(C)ccc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccccc1F	763858480	SVMONHIMSZXFAN-AWEZNQCLSA-N	433.436	1.713	50	20	IDGD	
CN(C)C(=O)Cn1cc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCCCCC3)cn1	763911813	NQJIIQWECPDZCP-UHFFFAOYSA-N	446.533	1.092	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)n(Cc2ccccc2)n1	764005986	HPCKFEDPRNSVNB-UHFFFAOYSA-N	435.440	1.411	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(F)c(-n3nnnc3C3CC3)c2)c(O)c1	764109870	LXLLAFSYZRAQEX-UHFFFAOYSA-N	439.407	1.093	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccc(NC(=O)OC(C)(C)C)nc1	764130914	BICNABBTEUYZCN-UHFFFAOYSA-N	443.460	1.766	50	20	IDGD	
O=C(CCc1ccco1)NNC(=O)C(=O)Nc1ccc(OCCN2CCCCC2)cc1	764176545	DFVPKCDFJFLZHY-UHFFFAOYSA-N	428.489	1.863	50	20	IDGD	
O=C(CCC1CCCCC1)NNC(=O)C(=O)Nc1ccccc1C(=O)N1CCOCC1	764214959	HZSKWWIZAOOKAZ-UHFFFAOYSA-N	430.505	1.605	50	20	IDGD	
Cc1cc(C)cc(Oc2ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)cc2)c1	764226139	GERJCRINLPZDRR-CQSZACIVSA-N	448.501	1.119	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@@H]2C)ccc1NC(=O)C(=O)NNC(=O)Cc1cc[nH]n1	764294105	VDDYWTWYCNYLBF-AWEZNQCLSA-N	426.477	1.061	50	20	IDGD	
CCOC(=O)COc1cccc(NC(=O)C(=O)NNC(=O)c2cc3ccccc3o2)c1	764331012	LWLYJGKZKSZCOJ-UHFFFAOYSA-N	425.397	1.774	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)C(=O)Nc2ccnn2Cc2c(Cl)cccc2Cl)cn1	764359945	QXOWUZFWJARUBO-UHFFFAOYSA-N	436.259	1.371	50	20	IDGD	
O=C(NNC(=O)C(F)(F)Oc1ccccc1)C(=O)Nc1cccc(Cn2cncn2)c1	764379334	WALVZTRILKDAHG-UHFFFAOYSA-N	430.371	1.084	50	20	IDGD	
COC(=O)c1csc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)c1C	764389029	WOEKBBXTYGDJKE-UHFFFAOYSA-N	445.432	1.772	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cccnc3-n3cncn3)n[nH]2)cc1C	764389108	WYWHXFYGJJEIAG-UHFFFAOYSA-N	445.443	1.069	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1ccccc1C(=O)N(C)C1CCCCC1	764401887	YXEAJZATWOTQKV-HNNXBMFYSA-N	448.520	1.229	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccc(NC(=O)[C@H](C)n2cncn2)cc1	764406752	FDZPUABMXYSRNM-HNNXBMFYSA-N	449.471	1.115	50	20	IDGD	
COc1ccccc1CSc1ccccc1NC(=O)C(=O)NNC(=O)[C@H]1COCCO1	764423545	BGMYGDOHIUXDGH-QGZVFWFLSA-N	445.497	1.489	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNc2nccnc2Cl)cc(Br)c1F	764674260	YEPZJOHTSPAOJW-UHFFFAOYSA-N	446.620	1.900	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)c1ccccc1S(=O)(=O)CCN(C)C	767162315	XURVCJFDRRDWAS-CQSZACIVSA-N	437.493	1.390	50	20	IDGD	
COCc1c(C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)cnn1-c1ccccc1	768147341	MTOHVJMBGYEVAG-UHFFFAOYSA-N	432.481	1.487	50	20	IDGD	
CC(C)c1cc(NC(=O)C(=O)NNC(=O)CCc2ccccc2O)n(-c2ncccn2)n1	768241795	JZQLWDLIXSPEFI-UHFFFAOYSA-N	437.460	1.210	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3n[nH]c(C)c3Br)n[nH]2)cc1OC	768278622	ILSXOGAWRKKKQO-UHFFFAOYSA-N	449.265	1.963	50	20	IDGD	
CCCCC(=O)N1CSC[C@H]1C(=O)NNC(=O)c1cc(-c2ccccc2OC)[nH]n1	768280682	CJDYEPNMDHZCPI-INIZCTEOSA-N	431.518	1.938	50	20	IDGD	
N#Cc1cc(Cl)nc(NNC(=O)[C@@H]2CCCC[C@@H]2C(=O)N[C@H]2CCS(=O)(=O)C2)c1	769055355	GJTPJNDQOHHIOY-MELADBBJSA-N	439.925	1.159	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)N[C@H](C)c1cccc(S(N)(=O)=O)c1	770102894	MJBRWKRUUZTWIZ-NEPJUHHUSA-N	440.909	1.846	50	20	IDGD	
CSCCNC(=S)NNC(=O)c1cccnc1S[C@@H](C)C(=O)N1CCCC1	770244818	AAPMYZAWBDSPDB-LBPRGKRZSA-N	427.621	1.657	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)NCc1cccnc1N1CCN(C)CC1	770364155	KFSSPOOCRYOKAB-HNNXBMFYSA-N	446.939	1.785	50	20	IDGD	
CNS(=O)(=O)c1ccc(C)c(C(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)c1	770966389	QMYBLKFGGXUKPX-UHFFFAOYSA-N	433.494	1.260	50	20	IDGD	
O=C(COC(=O)c1ncccc1C(F)(F)F)NNC(=O)[C@@H]1COc2ccccc2O1	771115730	PUUNCRNJWINHOM-ZDUSSCGKSA-N	425.319	1.245	50	20	IDGD	
O=C(NCc1ccco1)NNS(=O)(=O)c1cc(C(=O)O)c(F)cc1Br	771145526	YNWGIPDPUJAOPI-UHFFFAOYSA-N	436.215	1.572	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)CNC(=O)c1cccc(O)c1	771605050	CMTBAPNJUHPDLF-NSHDSACASA-N	436.262	1.499	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNS(=O)(=O)c1ccc(S(C)(=O)=O)cc1	773263854	ITXAGIXFYVGEND-LLVKDONJSA-N	432.907	1.521	50	20	IDGD	
CC(C)[C@@H](C(=O)NNC(=O)[C@H]1CCCN(C(=O)OC(C)(C)C)C1)N1C[C@H](C)O[C@H](C)C1	773417824	IHKDGZMVEGBKSJ-MHORFTMASA-N	440.585	1.915	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NNC(=O)c2ccnc(O[C@H]3CCOC3)c2)C1	773420768	PLLYNDZICOEPKZ-CVEARBPZSA-N	434.493	1.657	50	20	IDGD	
O=C(NNc1ccccc1C(F)(F)F)C(=O)Nc1cnn(Cc2nnc3n2CCCC3)c1	773488614	JXPZKIMREPCJGK-UHFFFAOYSA-N	448.409	1.960	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN[C@H](CS(C)(=O)=O)c1ccccc1	775549234	MSCZARMHEWIEIA-MRXNPFEDSA-N	439.921	1.485	50	20	IDGD	
CCC(=O)N1CCC[C@H](C(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)C1	776200925	CWBHNIMIHAYHEP-HNNXBMFYSA-N	425.530	1.271	50	20	IDGD	
Cc1c(NC(=O)CSCC(=O)NNc2ccccn2)c(=O)n(-c2ccccc2)n1C	777472523	NIURDCWFPLBSEQ-UHFFFAOYSA-N	426.502	1.694	50	20	IDGD	
COCCN1C(=O)CCc2cc(NC(=O)C(=O)NNC(=O)c3ccc(C)cc3O)ccc21	778712567	HXEYBXONSVXEIO-UHFFFAOYSA-N	440.456	1.026	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)CNS(=O)(=O)c2ccc(OC(F)(F)F)cc2)c1	781034942	UJJKUADGMKECFH-UHFFFAOYSA-N	447.391	1.793	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N2CC[C@H]([C@@H](C)O)C2)cc1	781044162	VJFNPMFHFBRZKX-HVVZCKNESA-N	437.500	1.570	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CN[C@@H](CCO)c2ccccc2Br)c1	782103696	SUZSXAVDNIKUCV-KRWDZBQOSA-N	431.290	1.795	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2ccc(C(=O)N3CCSCC3)cc2C)nc1	782140381	HNKYBDCTHKTZSH-UHFFFAOYSA-N	429.502	1.669	50	20	IDGD	
CS(=O)(=O)NCCc1ccc(C(=O)COC(=O)/C(C#N)=C/c2ccc(O)cc2)cc1	784020698	KHOJBXRHNQTJCN-LDADJPATSA-N	428.466	1.817	50	20	IDGD	
Cc1ccc(C(=O)NC2CC2)cc1NC(=O)C(=O)NNc1cccc(S(C)(=O)=O)c1	784841622	MVCYBZULMVXPRM-UHFFFAOYSA-N	430.486	1.373	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)C(=O)N2CCc3ccc(Br)cc32)c1	784844904	SUYGBVQISFRDPH-UHFFFAOYSA-N	438.303	1.885	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)C(=O)Nc2ccc(N3CCCS3(=O)=O)cc2)c1	784851148	HCDHASIARWRYIN-UHFFFAOYSA-N	432.458	1.095	50	20	IDGD	
CC(C)(C)N1C(=O)C[C@H](C(=O)NNC(=O)C(=O)NC2CC2)[C@H]1c1ccc(Cl)c(F)c1	785066375	OIIZQTHYRVJCRE-BLLLJJGKSA-N	438.887	1.593	50	20	IDGD	
CC(C)Oc1cc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)ccc1C(N)=O	789733343	JKWSSFJATCDLIT-UHFFFAOYSA-N	434.836	1.331	50	20	IDGD	
CN(C)[C@H]1CCOc2c(NC(=O)C(=O)NNC(=O)c3cnn(-c4ccccc4)c3)cccc21	789735481	YRHGZEQHGDGWRK-IBGZPJMESA-N	448.483	1.657	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1cc([C@@H]2CCCOC2)nn1C	790953160	XHOBEVQHRKIRND-CYBMUJFWSA-N	447.517	1.201	50	20	IDGD	
Cc1cc(I)ccc1NC(=O)C(=O)NNc1nc2ccccn2n1	792395920	WKZBRWXLGAVEOL-UHFFFAOYSA-N	436.213	1.724	50	20	IDGD	
C[C@@](O)(Cn1cc(C(F)(F)F)ccc1=O)C(=O)NNc1ccc(Br)nc1	792643741	SXZPSCOELXHAHS-CQSZACIVSA-N	435.200	1.919	50	20	IDGD	
COc1ccc(Cn2cc(NC(=O)C(=O)NNC(=O)COc3cccc(C)c3)cn2)cc1	793023142	IJQDHUQOWKFRIF-UHFFFAOYSA-N	437.456	1.413	50	20	IDGD	
CCOC(=O)c1cc(Cl)cc(S(=O)(=O)NNC(=O)c2cccc(OC)c2O)c1	793368069	QHOHFMCGPIQVDE-UHFFFAOYSA-N	428.850	1.854	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)c2cc(I)cc([N+](=O)[O-])c2)n1	794088371	ZGKHGTHFNNTUQW-UHFFFAOYSA-N	426.170	1.978	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NN=C[C@@H]1CCCN(C(=O)CNC(=O)OC(C)(C)C)C1	794527297	XRNZMONNKZKNDM-AWEZNQCLSA-N	441.529	1.376	50	20	IDGD	
CC(=NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1)c1ccc2c(c1)OCC(=O)N2	794920466	LWFUTMIMSFRLLM-UHFFFAOYSA-N	435.484	1.316	50	20	IDGD	
C[C@H]1[C@@H](NCC(=O)NNC(=O)c2ccc(C#N)cc2)[C@H](C)CCN1C(=O)OC(C)(C)C	796658525	MWRZIPJMNDPKJT-VCBZYWHSSA-N	429.521	1.943	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2ccc(F)c(N3CCOC3=O)c2)c1	796992078	LUXVEQFJYDYYHT-UHFFFAOYSA-N	444.419	1.564	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COCCO1)C(=O)Nc1ccc(-c2csc(C(F)(F)F)n2)cc1	797011493	JXQCPYAXRDIJHW-LBPRGKRZSA-N	444.391	1.330	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2c(C)cnn2Cc2cc(F)ccc2F)n1	797370351	ZRXJAPVTMYADOA-UHFFFAOYSA-N	428.399	1.621	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2cc(N3CCOCC3)ccc2C)c1	797534992	IYJJFGURDRNHMT-UHFFFAOYSA-N	442.472	1.249	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(S(=O)(=O)NNC(=O)COc2ccccc2O)CC1	799770397	ZPMORSMFLZKBBE-UHFFFAOYSA-N	429.495	1.121	50	20	IDGD	
O=C(NC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1)NNC(=O)c1nnc(O)c2ccccc12	802332159	VABPJRMPSLPQTG-AWEZNQCLSA-N	448.439	1.408	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)c1ccc(F)c(S(=O)(=O)N2CCCCC2)c1	804957367	HYDIYRZYHXRRQM-UHFFFAOYSA-N	445.480	1.733	50	20	IDGD	
NS(=O)(=O)c1ccc(C(=O)NNc2nccnc2C2CCC2)cc1Br	805475563	UFLKEKYXEBFDHL-UHFFFAOYSA-N	426.296	1.911	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)Nc1ccc(F)cc1OC1CCOCC1	806645528	IMKBPHGDSMHMQI-UHFFFAOYSA-N	441.423	1.826	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)N[C@@H]1CCN(Cc2ccccc2)C1	807007321	CCMMDCGGXOHZCU-MRXNPFEDSA-N	430.534	1.198	50	20	IDGD	
COCc1cnc(NC(=O)C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)s1	807020925	VTPWHFFOMNCIPP-UHFFFAOYSA-N	425.417	1.542	50	20	IDGD	
Cc1cc(CNC(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)n(C)n1	807223721	CIVFNKDTFDBDQM-UHFFFAOYSA-N	445.487	1.575	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2n[nH]c3c(OC)cccc23)cc1OC	808672785	FTMPVNFUYQPGQQ-UHFFFAOYSA-N	428.401	1.207	50	20	IDGD	
N#Cc1cccc(S(=O)(=O)NCC(=O)NNc2ccc(Br)c(F)c2)c1	811139476	APHDEACCCFOKMJ-UHFFFAOYSA-N	427.255	1.881	50	20	IDGD	
C[C@H](C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1)S(=O)(=O)c1ccc(F)cc1	812728838	BMONNCFGSNBJJC-GFCCVEGCSA-N	429.495	1.382	50	20	IDGD	
Cn1ncc(C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)c1I	814716240	FCYKCBRXDUGQJM-UHFFFAOYSA-N	436.213	1.490	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2ncncc2F)n([C@H]2CCN(Cc3ccccc3)C2)n1	815764804	VOHBYXXTLZJDHL-INIZCTEOSA-N	438.467	1.649	50	20	IDGD	
CCOC(=O)c1ccc(C(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)nc1	815827424	YSMRSAYEHSQSQB-UHFFFAOYSA-N	439.516	1.146	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)CCNS(=O)(=O)/C=C/c1ccccc1	825649614	YYXFJCLWVYTYNU-WYMLVPIESA-N	432.502	1.235	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)CNC(=O)CC23CC4CC(CC(C4)C2)C3)C[C@H](C)O1	912920141	VWUCACFVJFRCDP-RCRSHMOFSA-N	434.581	1.356	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1	912992011	XCLQZUNZBBHJGA-GOSISDBHSA-N	446.485	1.908	50	20	IDGD	
COCCNC(=S)NNC(=O)c1cccc(S(=O)(=O)Nc2ccc(C)cc2C)c1	913445782	LJRGVZHCTAUWGW-UHFFFAOYSA-N	436.559	1.860	50	20	IDGD	
Cc1ccc(-n2ncc(C(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)c2C2CC2)cc1Cl	914720186	VNFOZNJNLJZXHJ-ZDUSSCGKSA-N	436.921	1.907	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)CS(=O)(=O)Cc2ccc(C#N)cc2)cc1	915813991	WZMNEPVFTIAXPY-HNNXBMFYSA-N	445.497	1.487	50	20	IDGD	
COc1cc(OC)cc(C(=O)NN=C(C)c2ccc(S(=O)(=O)NCC(=O)O)cc2)c1	916314436	CJNVJXAZNBVJPR-UHFFFAOYSA-N	435.458	1.221	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNS(=O)(=O)c2ccc(CCCl)cc2)nc1	917736702	AXMREWDCSFYMME-UHFFFAOYSA-N	432.955	1.855	50	20	IDGD	
C=CC(=O)Nc1ccc(C(=O)OCC(=O)NNC(=O)c2ccc(OC)c(OC)c2)cc1	919348583	PXZFTWBDZAKHRH-UHFFFAOYSA-N	427.413	1.446	50	20	IDGD	
CCC(=O)N1CCCC[C@@H]1C(=O)OCC(=O)NNC(=O)c1cc(Cl)ccc1OC	919476550	WJTKSNGGALDWOV-CQSZACIVSA-N	425.869	1.444	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)CN2C(=O)COc3ccc(Cl)cc32)o1	920248600	KNBTXLLZEGOZFC-UHFFFAOYSA-N	434.880	1.961	50	20	IDGD	
CN(C)C(=O)CN(C)C(=O)/C(C#N)=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	920852572	QTVVZXIVJJYUKX-XNTDXEJSSA-N	442.907	1.532	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@@H](C(=O)NNC(=O)NCc3ccco3)C2)s1	920857824	PXPZZHWYLFKILN-CYBMUJFWSA-N	426.520	1.581	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)Nc1ccc(CN2C(=O)CNC2=O)cc1	920933475	QMCOWHRUGIWVEM-GFCCVEGCSA-N	429.408	1.498	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)c1ccccc1N1CCCC1=O	1317724190	NBZMEEZHBMJMDU-UHFFFAOYSA-N	435.528	1.787	50	20	IDGD	
CCOC(=O)N1CCC(NC(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)CC1	1318921571	VBLDPWNYKXVBFM-UHFFFAOYSA-N	441.529	1.585	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3c[nH]c4ccc(OC)cc34)C2)C1	1778509542	MCZUQOZHXNFVPT-UTKZUKDTSA-N	435.908	1.874	50	20	IDGD	
CCC(=O)N[C@@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@](C)(Cl)CCl)C1	1780706695	NYWHSUXOCDVFRB-QABNGEJJSA-N	436.380	1.651	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cccc3ccnn23)C1	1781227031	RXQKGSRLAXJFDM-YRISNDGFSA-N	434.924	1.716	50	20	IDGD	
CCOC(CC(=O)N1CCO[C@]2(CCN(C(=O)[C@@](C)(Cl)CCl)C2)C1)OCC	1781232447	FYJZVSMHFDECMN-ZWKOTPCHSA-N	425.353	1.842	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(C(N)=O)cc3)CCO2)C1	1781233950	PAORADIRYISRKG-OALUTQOASA-N	428.316	1.465	50	20	IDGD	
Cc1cc(CCC(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)ccn1	1781325626	GJIIWPBNKOTTMO-SJLPKXTDSA-N	428.302	1.843	50	20	IDGD	
COc1cc(F)ccc1CC(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781337735	VEYATKZILSJLKX-SJLPKXTDSA-N	447.276	1.897	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc[n+]([O-])cc1)C2	1781998034	RBZJQOQJQBFSJT-JCKWVBRZSA-N	426.311	1.231	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCc1ccco1)C2	1782209079	JZEBGILSPSRYPV-XMSQKQJNSA-N	434.537	1.099	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3n[nH]c4c3CC[C@H]4C)CCO2)C1	1783534545	WDUGTSMKTJEQSH-FTLABTOESA-N	425.327	1.686	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3ccc(C#N)cc3)[C@H]2C1	1783604137	AGPJREWANWEUGX-QCSYZSNVSA-N	434.334	1.864	50	20	IDGD	
CC(C)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4nc(CO)[nH]c4c3)C[C@@H]21	1783849815	KDEKQVHHDYGTCB-MPGHIAIKSA-N	448.951	1.914	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cc3c(s1)CCC3)CCO2	1783936141	GZRAQKWVBVOUOT-OAQYLSRUSA-N	434.562	1.053	50	20	IDGD	
CC(C)COc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]3C2)ccn1	1784090993	SIPDPEVANIBRCD-XSLAGTTESA-N	439.940	1.309	50	20	IDGD	
C[C@H](Sc1cccs1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]2C1	1784091808	CPFZZNNAMGXVSQ-YTFOTSKYSA-N	432.995	1.808	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cn3nc(C)cc3C)[C@H]2C1	1785343046	PBECALHVDQUCFK-NXOAAHMSSA-N	441.370	1.653	50	20	IDGD	
CCC(=O)N[C@@H](C)C(=O)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1	1786294217	SVQGBVMPOFLXLC-HNNXBMFYSA-N	437.305	1.029	50	20	IDGD	
Cn1nc(C(F)(F)F)cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]2C1	1787448214	YICJCNMGQAIWMB-PZEZNAACSA-N	426.798	1.567	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(C)(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Cl)C[C@@H]32)C1	1788222328	XOWJVIKGPYMQGE-ZQDZILKHSA-N	447.935	1.758	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc4n(n3)CCC4)[C@H]2C1	1788413047	RUQRMABJIPKHTO-HPZZRFSDSA-N	439.354	1.454	50	20	IDGD	
COC(=O)[C@@H]1CC[C@H](C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]3C2)C1	1788761923	HDXNITNYLPFGDL-ADHGMGHFSA-N	440.613	1.407	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Cl)C[C@@H]21)c1cc([N+](=O)[O-])cc2c1OCC2	1789218450	RZDMDFVHYAKGLX-JIRONKKISA-N	441.843	1.657	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc([N+](=O)[O-])[nH]3)C[C@@H]21	1789872736	VMKHRJAMTRANCS-NDBFUVGKSA-N	433.292	1.753	50	20	IDGD	
CCc1ncsc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]2C1	1789924569	MJOUNBNGZPALIS-WRZDFSGXSA-N	434.331	1.989	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(O)ccc3O)[C@H]2C1	1790265146	MMPJAQPAOBPPEL-AZLWOZFGSA-N	427.295	1.475	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccnc4ncccc34)[C@H]2C1	1790403020	HXQNYNYSCXWOEA-MGHWNKPDSA-N	432.908	1.477	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)n3cc(C)cn3)C[C@@H]21	1790963774	LXPUBLKFIVOSBZ-XAJHFOFHSA-N	441.370	1.906	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3n[nH]c4ccccc34)C[C@@H]21	1791056031	MGNMAVNOPJYFNJ-DSPQJCBJSA-N	435.322	1.940	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)COc1ccc(O)cc1	1792778744	YBGLKAYQZRYCRA-VLWCASSMSA-N	441.322	1.534	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cn3ccsc3n1)C2	1792870705	IYHBTGHPSBEICE-NRWUCQMLSA-N	441.351	1.630	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(N(C)C)cc1)C2	1792872446	IIWKVNKEMDNAFQ-SCNOPHJPSA-N	438.366	1.987	50	20	IDGD	
O=C(CCBr)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CNC(=O)c1cccs1	1794392659	SZPUUMLEQVDTIT-CLLJXQQHSA-N	428.352	1.901	50	20	IDGD	
C[C@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCBr)[C@H]1SC(=N)NC1=O	1795492351	KAEXAINRECIMKV-XPORZQOISA-N	431.356	1.212	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)C(=O)c1ccc(Cl)cc1	1796189628	JLTKLNZNRAITLC-REPLKXPHSA-N	440.692	1.155	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)c1occc1Br	1796191001	NCWNXSCLGXSFAZ-QDMKHBRRSA-N	447.094	1.288	50	20	IDGD	
Cc1nn[nH]c1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1796439315	MMKYWJAURVHAIU-CRWXNKLISA-N	440.932	1.497	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc2c1OCC2	1796792347	YPZNYCAMEFRWSC-JJAZEVLHSA-N	437.334	1.856	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@](C)(O)C(F)(F)F)C2	1796890700	GCVRGPOKAOAWBQ-LLMVKABESA-N	443.426	1.072	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(C)nc(O)c1)C2	1796892121	JJPXVPKHXZBWTB-FWKYCFCSSA-N	438.488	1.481	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1n[nH]c2c1CC[C@@H]2C	1796968231	XHEYYJRBPYHFHO-SMTWKSNJSA-N	439.354	1.694	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cn1c(=O)n(C)c2ccccc21	1797171359	GFPYQDAJYUKWBU-QOIOWGMHSA-N	448.951	1.337	50	20	IDGD	
C[C@@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(C)(C)CCl)C2)N1CSCSC1	1797840830	YIQHZVSOHWSDKU-XQLPTFJDSA-N	436.043	1.884	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cc1c[nH]c3ccccc13)C2	1798441995	RGHCTXYHOGZRCP-BJWYYQGGSA-N	446.511	1.661	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)COc1cc(Cl)ccn1	1798586181	WWPBZDKXAVPNKJ-MUJYYYPQSA-N	437.928	1.125	50	20	IDGD	
COc1cccc(/C=C/C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Br)c1	1799346909	IXOSZFDBKQOXHQ-IUGBXOKJSA-N	441.297	1.989	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](NC(C)=O)c1ccc(F)cc1	1799822827	DGSIDIBLQKXQKN-XCDZQEORSA-N	439.915	1.895	50	20	IDGD	
CCOC(=O)O[C@@H](C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)CBr)C2	1800226441	YPRZNIMHHWQLLP-YHQUGGNUSA-N	435.315	1.169	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](CN)c1ccccc1)C2	1800639626	KTHXMYUSIKXONZ-CWQOZTLDSA-N	438.366	1.492	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](O)CCl)C3)C1	1801974881	FZCIHMVTAJDBRG-UUAJXVIYSA-N	443.972	1.871	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H]2C[C@]21C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](O)CCl)C2	1801980592	YTUQJYYTBSJLSC-ATCDCCBLSA-N	441.956	1.624	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cn1ccc3sccc3c1=O)C2	1802274695	WVFBDTOYLVFEJY-HLPPOEQASA-N	437.949	1.955	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H]1CCc3ccccc3[C@@H]1O)C2	1802334458	LETSYBJHSUOVFK-JMGGBPHFSA-N	442.560	1.294	50	20	IDGD	
Cc1cc(C)cc(CCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)c1	1802657199	NXPYZZXBANEFBP-NUNAXRQHSA-N	434.345	1.868	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cccc3c[nH]nc23)[C@@H]1c1cccnc1)[C@H](O)CCl	1803138825	FQELDGUTMGEHPC-KVSKMBFKSA-N	427.892	1.877	50	20	IDGD	
CCC(=O)N[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1	1803429936	GCVFCGGNBOYHQB-QIIPPGSGSA-N	439.354	1.787	50	20	IDGD	
COc1ccc(CCC(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)cn1	1804261076	SFFSOOBPAZQQEN-BBTUJRGHSA-N	446.935	1.724	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)c2ccc(O)nn2)[C@H]1c1cccnc1	1805271162	VBDWTHRQNRLORH-DETPVDSQSA-N	434.294	1.680	50	20	IDGD	
O=C([C@@H](O)CCl)N1CCC2(CCCN(C(=O)C(F)(F)C(F)(F)C(=O)O)C2)CC1	1806533737	SLQHRPMAYQEJLH-JTQLQIEISA-N	432.798	1.173	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC2(CCCN(C(=O)C3CCC(CO)CC3)C2)CC1	1806727641	UKRHBQIESPYORK-UHFFFAOYSA-N	442.365	1.010	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)c1cc[nH]c2nccc1-2	1808068060	YAENGZHELIGVNZ-JCGIZDLHSA-N	427.892	1.829	50	20	IDGD	
Cc1ccc(OCC(=O)N2CCCC3(CCN(C(=O)CCC(=O)NN(C)C)CC3)C2)cc1	1809346929	KTKWOXPJDKRXLJ-UHFFFAOYSA-N	444.576	1.978	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@H]1CCN(C(=O)c2ccc[n+]([O-])c2)[C@H]1c1cccnc1	1810541542	UVNZSBUEJPVSNA-XLIONFOSSA-N	428.565	1.886	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2n[nH]cc2[N+](=O)[O-])[C@@H]1c1cccnc1	1810638395	MCEGVFNBRAUOFQ-XEZPLFJOSA-N	436.856	1.286	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H]2CCCS2(=O)=O)[C@H]1c1cccnc1)C(Cl)Cl	1813081729	ZKPMCLMDUFHMKQ-MJBXVCDLSA-N	434.345	1.468	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H](CNC(=O)[C@@H]2CCNC(=O)C2)[C@@H]1c1cccnc1	1813135900	MTHGAUMNWJADFT-HMPASCQOSA-N	441.359	1.850	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)[C@@H]2CCCS2)[C@@H]1c1cccnc1	1813615324	FPTLPPZUKPHYAZ-UWVAXJGDSA-N	433.578	1.356	50	20	IDGD	
CC(C)Cc1cc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@@H](O)CCl)CC3)n(C)n1	1815992840	GNJSCAQRXOXQCV-NHYWBVRUSA-N	439.969	1.901	50	20	IDGD	
C[C@H](NC(=O)c1ccccn1)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](F)Cl)sc2C1	1817132888	AMWJWQIACSVJPF-RBZYPMLTSA-N	439.900	1.803	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cscn2)[nH]n1	1819401908	FUEMSCPDLCFFNX-HNNXBMFYSA-N	440.489	1.484	50	20	IDGD	
C[Si](C)(C)OCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2nccnc2C(N)=O)[nH]n1	1819595657	UTFHMQJHMUQDSP-ZDUSSCGKSA-N	445.556	1.456	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H]2C[C@H](O)CN2)n[nH]1	1820746652	OSCGYDKTDOMFPG-AUZPSNTRSA-N	428.331	1.156	50	20	IDGD	
CCNC(=S)NCC(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](F)Br)n[nH]1	1820936987	LBZXXOYIBOVCJB-GXFFZTMASA-N	449.350	1.576	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(OC)nn3)sc2C1	1821073510	YARRSDZQPQQBBC-VHSXEESVSA-N	425.898	1.421	50	20	IDGD	
NC(=O)c1nccnc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)C(Cl)Cl)n[nH]1	1822423791	LOCGHWOEWQQGJK-SECBINFHSA-N	426.264	1.408	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H]2CCCCO2)CC1	1823818741	NIEUYLKXECYRSX-VQTJNVASSA-N	443.548	1.488	50	20	IDGD	
Cc1nn(C)c(C)c1CC(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](O)CCl)CC2	1826836011	CTJOULXDUFBREY-BXUZGUMPSA-N	425.942	1.248	50	20	IDGD	
Cc1n[nH]cc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1	1828924294	OPIICWYOQUGORP-IBGZPJMESA-N	439.520	1.264	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H](COC)NC(C)=O)CC1	1829117356	GVZFCKCXKRRRPX-RCCFBDPRSA-N	431.961	1.011	50	20	IDGD	
O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)c1ccccc1)CCO2	1832215062	AOTFNFHBBMZCTN-MJGOQNOKSA-N	443.313	1.939	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)c1ccc(Cl)nc1F	1833904594	LUEINZUMNLWYOO-OAHLLOKOSA-N	447.338	1.659	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)cn1	1833998377	GSXBIIZKXDWFGP-KSSFIOAISA-N	426.311	1.243	50	20	IDGD	
CCn1ccc(C(=O)NC2CCN(C3CCN(C(=O)[C@H](C)Br)CC3)CC2)n1	1834274471	PAQIUWRLLHMTKN-AWEZNQCLSA-N	440.386	1.872	50	20	IDGD	
C=C[C@H](O)C(C)(C)C(=O)N1CCC(N2CCC(NC(=O)CCBr)CC2)CC1	1834424008	UKUKGCOXLCXRKY-KRWDZBQOSA-N	444.414	1.916	50	20	IDGD	
O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)Cc1ccccc1F)CCO2	1835003510	OHYLUPXORBADPE-LJQANCHMSA-N	443.313	1.610	50	20	IDGD	
CC[C@@H](Br)C(=O)NC1CCN(C2CCN(C(=O)[C@H]3C[C@@H](O)C3)CC2)CC1	1836541773	DLYTYTWHOMGCSR-XOKHGSTOSA-N	430.387	1.502	50	20	IDGD	
O=C(CCBr)N1CCC(OC2CCN(C(=O)CN3CCOC3=O)CC2)CC1	1836786166	ZFVGZRHDHQLIFD-UHFFFAOYSA-N	446.342	1.222	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(-c4cccnc4)[nH]n3)CCO2)C1	1838031040	IADGNPGFDLMQJF-HRAATJIYSA-N	447.923	1.559	50	20	IDGD	
Cc1ocnc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)CBr)C2)C1	1838199633	LUQQQQLQTZLNEM-YVEFUNNKSA-N	430.299	1.084	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3nccnc3C)CCO2)C1	1838216086	BBLPHIKCEPAKOO-KBXCAEBGSA-N	441.326	1.029	50	20	IDGD	
Cc1ccn(C)c1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1838821356	KQFFGGIAMYGVEZ-WMLDXEAASA-N	432.290	1.094	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)c(OC)c1	1838879866	MAPLUTZZJQLPDC-VQIMIIECSA-N	430.860	1.308	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3COc4ccccc4O3)C2)C1	1839142465	PWPRNDSWAKPYSO-XERREHJYSA-N	438.908	1.300	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](N)c3cccc(Cl)c3)C2)C1	1839144330	VJHLANADEZBTMO-SQGPQFPESA-N	444.359	1.814	50	20	IDGD	
C=CCSCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2	1839150422	MFZAMYJTAVUBDZ-IRXDYDNUSA-N	425.378	1.598	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(=O)c3ccccc3)C2)C1	1839151411	QPBMXVJHKSDVMH-WOJBJXKFSA-N	443.327	1.562	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CCC(F)(F)C3)C2)C1	1840029542	JALBQCLNLUKFGZ-WOSRLPQWSA-N	439.297	1.662	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2	1840036419	JSGBXJPVJTYMLW-WDMOLILDSA-N	442.148	1.010	50	20	IDGD	
CCCc1onc(C)c1C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840187706	RICGBWAILKHMAO-SFHVURJKSA-N	434.320	1.809	50	20	IDGD	
CCOc1cccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)c1	1840189281	JDWODPTUAVKCHH-IBGZPJMESA-N	431.316	1.959	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)C3=COCCC3)CCO2)C1	1840217699	OSZSYSOAQNQVHI-YJBOKZPZSA-N	431.327	1.311	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1C[C@H]1c1ccccc1)CCO2	1840288979	DZYZOLCAYYFHTP-JYLXEMOASA-N	436.936	1.500	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CC3(OC)CCC3)CCO2)C1	1840617396	AZKAITPSENSDIG-HNAYVOBHSA-N	447.370	1.576	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1O)C2	1845166230	ITEZGFNCKVWQDS-KKUMJFAQSA-N	429.945	1.435	50	20	IDGD	
COC(=O)NCC(=O)N1CC2(CCCN2C(=O)[C@@H](Br)Cc2ccccc2)C1	1845942378	CBXADKLILOLLCQ-HNNXBMFYSA-N	438.322	1.552	50	20	IDGD	
CCOC(=O)C[C@@H](NC(=O)NNC(=O)CNC(=O)c1cccs1)c1ccc(F)cc1	725873099	KEQWDWJOPAFGDJ-CQSZACIVSA-N	436.465	1.642	50	20	IDGD	
CN(C)C(=O)[C@@H]1CCCN1CCCNC(=O)NNC(=O)Cc1cccc2ccccc12	726278802	YYDFALAMRJVTBJ-FQEVSTJZSA-N	425.533	1.655	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)c1cc([N+](=O)[O-])cc2c1OCCO2	727365516	UJCWFJBEQNEJJX-UHFFFAOYSA-N	425.401	1.739	50	20	IDGD	
COc1ccc(COCCCNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1	727474144	ZZPNGKORUGQDLX-UHFFFAOYSA-N	449.533	1.539	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)NNC(=O)[C@@H]1C[C@@H](O)CN1C(=O)OCc1ccccc1	727765031	ZUZSWCOBNMMAPY-XLIONFOSSA-N	436.468	1.630	50	20	IDGD	
CC/C=C(/C)C(=O)N1CSC[C@H]1C(=O)NNC(=O)c1cc(OC)c(OC)c(OC)c1	727982488	HZCCKXFDJIDTOR-VDBIKXPHSA-N	437.518	1.731	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)[C@H](C)Sc2nnnn2C2CC2)c1	728525495	AYEULVYTSACGAH-QMMMGPOBSA-N	441.311	1.721	50	20	IDGD	
COc1cc(Br)c(S(=O)(=O)NNC(=O)Cc2cccnc2)cc1OC	728856528	UCLXLSNXVCTAHH-UHFFFAOYSA-N	430.280	1.414	50	20	IDGD	
CC(C)[C@@H](NS(=O)(=O)c1ccc2ccccc2c1)C(=O)NNC(=O)Cc1cccnc1	728892200	QKENMCSRWUNLNA-OAQYLSRUSA-N	440.525	1.928	50	20	IDGD	
O=C(NCC1(N2CCOCC2)CCCCC1)NNC(=O)C1CCN(c2ncccn2)CC1	729043285	CLIGNKADNIKDNG-UHFFFAOYSA-N	445.568	1.059	50	20	IDGD	
CC(C)(C)CC(=O)N1CSC[C@@H]1C(=O)OCC(=O)NNC(=O)c1ccc(Cl)cc1	730328065	NMNNBYOJYXVZTF-CQSZACIVSA-N	441.937	1.982	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NC[C@H]2CCOc3ccccc32)cc1	731284715	GEPPOBSNEKVRNF-MRXNPFEDSA-N	446.529	1.512	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)c1cc(F)cc([N+](=O)[O-])c1	731453600	NVBPBASYFCDIGX-UHFFFAOYSA-N	436.421	1.593	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)F)cc1)c1cn(-c2cccc([N+](=O)[O-])c2)nn1	731810213	CWRQLQWPIDMUKT-UHFFFAOYSA-N	438.372	1.929	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)CCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1ccccc1	732133407	YMZSRDXXVYSHQE-QGZVFWFLSA-N	434.474	1.604	50	20	IDGD	
Cc1cccc(-n2c(NNC(=O)[C@H]3CCS(=O)(=O)C3)nc3ccccc3c2=O)c1C	733264388	KLXICFCJPCYJLU-HNNXBMFYSA-N	426.498	1.880	50	20	IDGD	
C[C@@]1(NNC(=O)N[C@H]2CCN(c3cccc(OC(F)(F)F)c3)C2)CCS(=O)(=O)C1	734067327	JQFGFINCZZNMQE-BLLLJJGKSA-N	436.456	1.545	50	20	IDGD	
C[C@H](CN1CCN(c2ccccn2)CC1)NC(=O)NNC(=O)NCc1ccc(Cl)cc1	735519205	QTRWNIQHASENDK-MRXNPFEDSA-N	445.955	1.959	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)c1csc(Nc2ccccn2)n1	736065973	XXLBANJVOOINKQ-UHFFFAOYSA-N	431.503	1.650	50	20	IDGD	
Cn1cnnc1Sc1ccc(C(=O)NNC(=O)COCc2ccccc2)cc1[N+](=O)[O-]	737634612	JCSDWFDVGBTPHO-UHFFFAOYSA-N	442.457	1.852	50	20	IDGD	
CC(C)(C)OC(=O)N(CC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)CC1CC1	742534505	HZWRYXWURVXGHX-UHFFFAOYSA-N	425.507	1.498	50	20	IDGD	
Cc1ccc(S(=O)(=O)NNC(=O)c2ccccn2)cc1S(=O)(=O)N1CCCCC1	743249134	JRFNBVHGHVLZOY-UHFFFAOYSA-N	438.531	1.188	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2ccc(=O)n(Cc3ccccc3)n2)cc1	743831363	VMKNUWKYRVOMIX-UHFFFAOYSA-N	441.469	1.162	50	20	IDGD	
O=C(COc1ccccc1Cl)NNc1ccccc1S(=O)(=O)N1CCOCC1	744620859	PJHDCPAUODZXML-UHFFFAOYSA-N	425.894	1.883	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)c2nn(-c3ccc(F)cc3)c3c2CCC3)c1	744626588	NHQVRUMLJKMECR-UHFFFAOYSA-N	447.426	1.990	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)c1cc(Cl)ccc1Cl)C(=O)NNC(=O)N(C)C	746012796	LREOTPMADOKJNO-LLVKDONJSA-N	443.378	1.696	50	20	IDGD	
N#Cc1ccc(NNC(=O)C2=NN([C@@H]3CCS(=O)(=O)C3)C(=O)CC2)cc1C(F)(F)F	746897499	ZXLNCSGIXVNAPG-GFCCVEGCSA-N	443.407	1.186	50	20	IDGD	
COc1cc(OC)cc(N2CC[C@@H](NC(=O)NNC(=O)COc3ccc(C)cc3)C2=O)c1	747954310	LBGVOKHOIMSSKK-LJQANCHMSA-N	442.472	1.527	50	20	IDGD	
O=C(NCC(=O)N1CCCCC1)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1	747981532	QUKWPVSXJCPBQN-JOCHJYFZSA-N	449.555	1.956	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)CSCC(=O)c2ccccc2)cc1	748554826	FIDNAAVRWQVKNR-UHFFFAOYSA-N	449.554	1.379	50	20	IDGD	
COc1ccccc1NC(=O)CN1CCN(C(=O)NNC(=O)c2cccc(C#N)c2)CC1	749818705	DWJDDSAPRMNAKH-UHFFFAOYSA-N	436.472	1.178	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)CNS(=O)(=O)c2ccc(Br)s2)cc1	749837059	CZJOBSPYGDBUJL-UHFFFAOYSA-N	446.348	1.813	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)c2cc(-c3ccc(OC)c(OC)c3)[nH]n2)cc1	751297636	OHBMJMJLQONVPO-UHFFFAOYSA-N	426.429	1.943	50	20	IDGD	
CC(=O)Nc1ncc(S(=O)(=O)NNC(=O)c2ccc(COc3ccccc3)o2)s1	753016298	HESDDHQSHPCXOW-UHFFFAOYSA-N	436.471	1.897	50	20	IDGD	
C[C@@H](C(=O)OCC(=O)NNC(=O)c1cccc(Cl)c1)c1ccc(S(C)(=O)=O)cc1	753489483	QNSPYEBHYFHOHA-GFCCVEGCSA-N	438.889	1.851	50	20	IDGD	
Cc1c(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c(=O)oc2ccccc12	754613106	GVQGUVKVFOWWTR-KRWDZBQOSA-N	438.392	1.246	50	20	IDGD	
COC(=O)CNC(=O)Cc1ccc(NC(=O)NNC(=O)COc2cc(C)cc(C)c2)cc1	755863887	XANMFZJRANGVQL-UHFFFAOYSA-N	442.472	1.367	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)CNC(=O)C1CCCCC1	756550970	SVDDBBFBOHBECX-UHFFFAOYSA-N	425.869	1.349	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCc2n[nH]cc2C1)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	756906176	XRACTDCDNQMQBC-SFHVURJKSA-N	442.483	1.678	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2ccc(-n3cc(C)cn3)c(F)c2)cc1OC	757643554	ASPYJTDWZAZGTF-UHFFFAOYSA-N	434.449	1.960	50	20	IDGD	
COC(=O)c1cc(NC(=O)NNC(=O)Cn2ccc3ccccc32)cc(S(C)(=O)=O)c1	757674020	NRZAXEYYDBJGJE-UHFFFAOYSA-N	444.469	1.684	50	20	IDGD	
C[C@H]1C[C@@H](NC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])CN1Cc1ccccc1	757769031	VICJQFZCHJUHHS-DOTOQJQBSA-N	427.461	1.967	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)Cc1cccc(OCc2ccccc2Cl)c1	758029322	KHEJJWFHHCOGQM-ZDUSSCGKSA-N	439.921	1.547	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@H](C#N)[C@@H](NC(=O)NNC(=O)Cn2ccc3ccccc32)C1	758749457	BAKZINMITAAWIS-CVEARBPZSA-N	426.477	1.731	50	20	IDGD	
O=C(NNC(=O)C1(c2ccc(Br)cc2)CCOCC1)C(=O)Nc1ccccn1	758835461	VBEGGXQHKYLTIK-UHFFFAOYSA-N	447.289	1.678	50	20	IDGD	
COc1cc(C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc2c1O[C@H](C)C2	761065978	PQXPAEVSJRADMO-LLVKDONJSA-N	429.385	1.545	50	20	IDGD	
O=C(NNc1nccc(N2CCOCC2)n1)c1cc(Br)c2c(c1)OCCO2	762860036	BFBXECSFPDHQBG-UHFFFAOYSA-N	436.266	1.604	50	20	IDGD	
Cc1ccc(-n2c(NNC(=O)Cn3cc([C@@H](C)O)nn3)nc3ccccc3c2=O)c(C)c1	763046974	FNGNJSDZNISDPA-OAHLLOKOSA-N	433.472	1.791	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NN=Cc1cc(Br)cc(Br)c1N	763406995	UDTQLDXHNUYHLU-ZCFIWIBFSA-N	442.133	1.182	50	20	IDGD	
CCC(=O)NNC(=O)C(=O)Nc1ccccc1CN1CCc2cc(OC)c(OC)cc2C1	763438981	YRXYCAIIBIKDAF-UHFFFAOYSA-N	440.500	1.758	50	20	IDGD	
CN1CCN(Cc2cccc(NC(=O)C(=O)NNC(=O)c3ccc4ccccc4n3)c2)CC1	763450802	QRHMSNUYLCRGOB-UHFFFAOYSA-N	446.511	1.382	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccncc2)nn1CCCOc1ccc(F)cc1	763464225	MVIIGTKZJPXGPA-UHFFFAOYSA-N	440.435	1.594	50	20	IDGD	
O=C(NNC(=O)c1ccccc1Br)C(=O)Nc1cccnc1OCC(F)F	763482745	KUJRHIWAIFMCDW-UHFFFAOYSA-N	443.204	1.888	50	20	IDGD	
N#Cc1ccc(OC(F)F)c(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)c1	763686006	HSKGMDGFSCRRTR-UHFFFAOYSA-N	438.774	1.978	50	20	IDGD	
CCCOc1cc(C)ccc1NC(=O)C(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	763789835	FQXYYCYRCYUNLL-UHFFFAOYSA-N	437.456	1.430	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)CCCC(=O)N2	763864232	HHGZBPBVFQFQAD-LBPRGKRZSA-N	428.420	1.654	50	20	IDGD	
C=CCNC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)cc1	763866615	QFFLFOIUTGYQCH-ZDUSSCGKSA-N	443.435	1.687	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccccc2N(C)C(C)=O)cc1OC	763910306	CZHONQZUCXXVOU-UHFFFAOYSA-N	442.472	1.866	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C)c(NC(C)=O)c2)cc1OC	763912025	KSGNHDUACBMQLW-UHFFFAOYSA-N	428.445	1.760	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3ccc(-n4cncn4)nc3)cc2C1	763941899	YUWPMVWBVPAHSK-LLVKDONJSA-N	425.474	1.248	50	20	IDGD	
CC(C)C[C@@H](C)n1nccc1NC(=O)C(=O)NNC(=O)c1cc(Br)c[nH]1	763994865	IGWOAMRGMASCQV-SNVBAGLBSA-N	425.287	1.981	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)Nc1ccc(OC(F)F)cc1	764002623	OUILYNMHZCBLAZ-UHFFFAOYSA-N	431.193	1.789	50	20	IDGD	
CNC(=O)c1ccc(OC)c(NC(=O)C(=O)NNC(=O)Cc2cccc3ccccc23)c1	764028624	MVKBDOQFJXWLPC-UHFFFAOYSA-N	434.452	1.537	50	20	IDGD	
CC[C@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(OCC(=O)N(CC)CC)c(Cl)c1	764081580	IENPUGOSYKSVAH-LBPRGKRZSA-N	426.901	1.719	50	20	IDGD	
CC[C@H](C)C(=O)NNC(=O)C(=O)Nc1cccc(S(=O)(=O)NC2=NCCCCC2)c1	764081972	LSPNSCNKFIARPN-ZDUSSCGKSA-N	437.522	1.069	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)N3CCc4ccccc43)cc2)n[nH]1	764106316	IOLWVUVSLDVEFR-UHFFFAOYSA-N	432.440	1.321	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2ccc(C(=O)NC(C)C)cc2)cc1	764125323	UERBQZPZAWJCJJ-UHFFFAOYSA-N	426.473	1.552	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2nc(-c3nccn3C)cs2)cc1	764132181	QDLVECMRJQIYPX-UHFFFAOYSA-N	428.474	1.271	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)C(=O)Nc1ccc2c(c1)C(=O)CCC2	764204409	NLKSVDLPQJTGIF-UHFFFAOYSA-N	432.477	1.596	50	20	IDGD	
CS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccccc2F)cc1Cl	764320355	YQRRZHSDJCNBOU-UHFFFAOYSA-N	442.856	1.179	50	20	IDGD	
Cc1ccc(C(=O)N2C[C@@H](C)C[C@@H](C)C2)cc1NC(=O)C(=O)NNC(=O)c1cnn(C)c1	764360456	YGALHEWGVLDSEL-OKILXGFUSA-N	440.504	1.246	50	20	IDGD	
COC(=O)c1ccc(F)c(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)c1	764387255	IICUARQWZAGERD-UHFFFAOYSA-N	443.366	1.541	50	20	IDGD	
COc1ccc(C)cc1N1C[C@H](C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)CC1=O	765321417	XZRQFNLGCBKQET-OAHLLOKOSA-N	448.520	1.809	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2cccs2)[nH]n1)c1cccc(N2CCCS2(=O)=O)c1	765570123	RVHCEJWMOYYCJZ-UHFFFAOYSA-N	431.499	1.753	50	20	IDGD	
CC[C@H](O[C@@H]1CCC[C@H](C)C1)C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765735329	JWKDCHRHALSUHS-TYPHKJRUSA-N	444.576	1.966	50	20	IDGD	
COc1ccccc1[C@@H](C)CC(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765737192	XHPDHESSUAUNMV-SFHVURJKSA-N	438.528	1.794	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)c2ccnc(CNC(=O)OC(C)(C)C)c2)c1	766153006	MDIYOTVPZSWBHJ-UHFFFAOYSA-N	428.449	1.535	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C#N)cc2OC)cc1OC	766259352	YJGXAFPJBFCXNC-UHFFFAOYSA-N	426.429	1.764	50	20	IDGD	
COC1(C(=O)NNc2ccccc2S(C)(=O)=O)CCN(C(=O)OC(C)(C)C)CC1	766661589	FNXOUKQKKSXIQE-UHFFFAOYSA-N	427.523	1.949	50	20	IDGD	
CN(CC(=O)NNC(=O)c1cccc(C#N)c1)[C@H](CO)c1cccc(Br)c1	767045497	OZYPAVMHKZTXBG-QGZVFWFLSA-N	431.290	1.747	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)c1ccc(N2C(=O)CCC2=O)c([N+](=O)[O-])c1	767415410	OGQHWRANKYAEIX-UHFFFAOYSA-N	442.384	1.097	50	20	IDGD	
O=C(CCC(=O)N1CCN(c2ncccn2)CC1)NNC(=O)c1cc2ccccc2cc1O	767828020	PNEVYQWOSCBROU-UHFFFAOYSA-N	448.483	1.225	50	20	IDGD	
COc1cc(C(=O)NNC(=O)N[C@H](C)CNC(=O)OC(C)(C)C)cc(OC)c1OC	768923891	VOQWAYRFIMYUSN-LLVKDONJSA-N	426.470	1.570	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)c1nccn2c(Br)cnc12	769881502	LIFYJPFNIBRCKF-UHFFFAOYSA-N	446.261	1.347	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2cc(C)n(-c3ccc(OC)cc3)n2)c2ccccc2c1=O	770579469	TWHJHBBHYAFRHL-UHFFFAOYSA-N	446.467	1.994	50	20	IDGD	
CCCNC(=O)[C@@H]1CN(C(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2)c2ccccc2O1	773643338	OOSNKMNGDSPPIX-KRWDZBQOSA-N	427.417	1.358	50	20	IDGD	
CO[C@@H](c1ccc(Br)cc1)[C@H](C)NC(=O)NNC(=O)C(=O)N1CCCC1	774341373	PHASAMANLMPISE-SMDDNHRTSA-N	427.299	1.478	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)c2ccc(Cl)cc2OC)cc1CC(=O)O	774606564	UNUMKURXTNKZKD-UHFFFAOYSA-N	428.850	1.608	50	20	IDGD	
CN(C)CC(=O)NNC(=O)Nc1cc(I)ccc1Br	775595788	ABKFVMSKSAZONP-UHFFFAOYSA-N	441.067	1.768	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(N2C[C@@H](C(=O)NNc3ccccn3)CC2=O)cc1	777473625	FYTCOJNGVFQSHS-HNNXBMFYSA-N	431.518	1.608	50	20	IDGD	
COc1ccc(Cn2ccc(NC(=O)C(=O)NNC(=O)c3c(C)nc4ccccn34)n2)cc1	778706729	DLAHHOOBASPRBD-UHFFFAOYSA-N	447.455	1.296	50	20	IDGD	
O=C(CN1C(=O)[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)NNc1ccc([N+](=O)[O-])cc1Br	779140238	FWRWRWVBDNHPOZ-PVFTVIPPSA-N	435.234	1.608	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)cc1Br	779504755	GSXJDLXZCIDYSB-MRVPVSSYSA-N	436.284	1.054	50	20	IDGD	
CN1C(=O)CN(NC(=O)/C(C#N)=C/c2cn(CCC#N)nc2-c2ccc(Cl)cc2)C1=O	779541437	MBFJKKBPMPTZML-NTEUORMPSA-N	437.847	1.949	50	20	IDGD	
CCn1cc(CC(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)cn1	780160002	KJVYDRUSHVXATB-UHFFFAOYSA-N	441.513	1.385	50	20	IDGD	
COCC(=O)N1CCc2cc(NC(=O)C(=O)NNc3cccc([N+](=O)[O-])c3C)ccc21	784351125	BQKJDLLCXIWMBF-UHFFFAOYSA-N	427.417	1.521	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)Nc1ccnn1CCc1ccccc1	785023585	NSUFIGSZENLTSB-UHFFFAOYSA-N	438.400	1.139	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2ccc(N3CCO[C@H](C)C3)cc2)n1	785227493	UKGSIKOZDZCSME-OAHLLOKOSA-N	427.509	1.630	50	20	IDGD	
Cc1ccc(C(=O)NCC2CC2)cc1NC(=O)C(=O)NNc1ccc(-n2cccn2)nn1	785991302	DIAVJRUSMYEJJU-UHFFFAOYSA-N	434.460	1.192	50	20	IDGD	
O=C(CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@H]12)NNC(=O)NCc1ccc(Cl)cc1	787424159	HUEUOZQKNZNLFV-DZKIICNBSA-N	425.942	1.896	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)cc1C(=O)N(C)C(C)C	787543410	VSJQMFDGYLJAQW-IBGZPJMESA-N	438.484	1.565	50	20	IDGD	
NS(=O)(=O)c1ccccc1NNC(=O)C1CCN(C(=O)COc2ccccc2)CC1	788228637	NYHGSEFORYFTQJ-UHFFFAOYSA-N	432.502	1.095	50	20	IDGD	
O=C(CN1C(=O)N[C@]2(CCc3ccccc32)C1=O)NNc1nnc(-c2ccccn2)s1	788564709	BQDKDEQHNSUVSJ-FQEVSTJZSA-N	435.469	1.437	50	20	IDGD	
O=C(NNc1nnc(-c2ccccn2)s1)c1ccc(F)c(S(=O)(=O)NC2CC2)c1	788566424	AITQERFCKWAABP-UHFFFAOYSA-N	434.478	1.937	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc4c(c3)CC(=O)N4C)n[nH]2)cc1	789738624	FLVWIUPRNXHHSR-UHFFFAOYSA-N	446.467	1.558	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccc2c1OCC[C@@H]2OC	790951060	BRYYPRUUNMKCES-INIZCTEOSA-N	443.456	1.720	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccc(Cc2nnc3n2CCC3)cc1	792269321	QAGOPNJMYNDOQY-UHFFFAOYSA-N	436.447	1.283	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2cnc(Br)c(Cl)c2)n1	792598214	UULRYYURTPLWPY-UHFFFAOYSA-N	447.698	1.809	50	20	IDGD	
CN(CCC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)C(=O)OCc1ccccc1	793032019	IBQVYWPDQAZWCD-UHFFFAOYSA-N	433.486	1.510	50	20	IDGD	
O=C(NNc1ccc2c(=O)[nH]ccc2c1)C(=O)Nc1cc2c(cc1[N+](=O)[O-])OCCCO2	793069647	GTHFVWSVEWKFOU-UHFFFAOYSA-N	439.384	1.679	50	20	IDGD	
CS(=O)(=O)C1(C(=O)NNC(=O)[C@@H]2Cc3ccccc3CN2Cc2ccccc2)CCC1	793305143	QCTMHUIYBKMMQM-FQEVSTJZSA-N	441.553	1.728	50	20	IDGD	
C[C@H]1CN(C[C@@H](C)O)CCN1C(=O)CCC(=O)C(C#N)=C1N(C)c2ccccc2N1C	793873480	GZUKDZDQOMBUOQ-DLBZAZTESA-N	425.533	1.571	50	20	IDGD	
CC(C)[C@@H](C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1)N1C(=O)c2ccccc2C1=O	794716592	DHRLHSUEHURDTL-SFHVURJKSA-N	444.513	1.701	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccc(C(F)(F)F)cc2)c1)N[C@@H]1CCS(=O)(=O)C1	795526628	BKEOBAQQULFIQC-GFCCVEGCSA-N	431.396	1.022	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2cccc(CN3C[C@H](C)O[C@H](C)C3)c2)n1	797371134	PJWVRDFVFZWLRP-IYBDPMFKSA-N	425.489	1.399	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)Nc1cc(S(=O)(=O)N2CCCC2)ccn1	797674473	WPCRGSQSBYWQRZ-UHFFFAOYSA-N	443.489	1.289	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cc(C)ccc3-n3cnnc3)CC2)cc1	797940099	NMGONFWCDCURHU-UHFFFAOYSA-N	447.543	1.463	50	20	IDGD	
C=CCNC(=S)NNC(=O)c1cc(O)nc2ccc(S(=O)(=O)N(CC)CC)cc12	798305602	WYKKSYJKXRLIIU-UHFFFAOYSA-N	437.547	1.266	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(CN3C(=O)CSC3=O)c2)cc1C	798306969	FDMQARNEDVFHLT-UHFFFAOYSA-N	440.481	1.899	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)C1(c2cncc(Br)c2)CC1	799102505	FXPGHSJNTBWQGQ-UHFFFAOYSA-N	427.299	1.938	50	20	IDGD	
NS(=O)(=O)Cc1cccc(CNC(=O)NNC(=O)Nc2ccc(OC(F)F)cc2)c1	800718843	OAYOOJCIWHHDEJ-UHFFFAOYSA-N	443.432	1.612	50	20	IDGD	
Cc1ccc(C)c(N2C(=O)c3ccc(C(=O)NNC(=O)N4CCN(C)CC4)cc3C2=O)c1	807383438	WGWVLFGODZOANE-UHFFFAOYSA-N	435.484	1.706	50	20	IDGD	
COC(=O)C[C@@H](C)CC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	809556784	KWWOCKXBVWMNPS-HNNXBMFYSA-N	447.513	1.515	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2cc(C3CC3)n(C)n2)c1	810277590	NPSMPOYBSKRZLL-UHFFFAOYSA-N	434.522	1.795	50	20	IDGD	
CC(C)CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)NNc1nc(-c2ccccn2)nc2c1CCC2	810442304	OGRPHSYEHAMNMS-LJQANCHMSA-N	448.531	1.967	50	20	IDGD	
COc1ccc(S(=O)(=O)NCC(=O)NNc2ccc([N+](=O)[O-])cc2Cl)cc1OC	810686925	OHOMEVBEMQNNDY-UHFFFAOYSA-N	444.853	1.687	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)CNS(=O)(=O)c1c(Cl)cccc1Cl	811399226	MLYZJFKQQZLBSY-UHFFFAOYSA-N	442.321	1.208	50	20	IDGD	
COC[C@@]1(CNC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)OCCc2ccccc21	811923742	XJVRXTFWBOJKQR-OAQYLSRUSA-N	447.513	1.149	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cc(C)nc3ccccc23)cc1	811969050	WHDDWMRXUSTNRR-UHFFFAOYSA-N	442.497	1.543	50	20	IDGD	
Cc1cccc2c1OC[C@@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)C2	812639297	GRUOJNZKIFSQSW-INIZCTEOSA-N	432.502	1.193	50	20	IDGD	
Cc1cc(N(C)C)cc(C)c1NC(=O)C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	813033814	MRKARYWWBJWBIW-UHFFFAOYSA-N	433.534	1.702	50	20	IDGD	
Cc1cccc(-n2c(NNC(=O)[C@H](CO)NC(=O)C(C)C)nc3ccccc3c2=O)c1C	813452677	PSSSJMSPFIUTLW-SFHVURJKSA-N	437.500	1.579	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)NCC(=O)NCCN1CCCCCC1	814423479	FOPLURWQRJMQPZ-UHFFFAOYSA-N	425.917	1.285	50	20	IDGD	
CNC(=O)Cn1ccc2ccc(NC(=O)NNc3ccccc3S(=O)(=O)N(C)C)cc21	814649060	ZOJMXHJGMBOCPO-UHFFFAOYSA-N	444.517	1.786	50	20	IDGD	
N#Cc1cc(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)ccc1Br	815564880	WCHCFHWWDULXLF-OAHLLOKOSA-N	445.229	1.247	50	20	IDGD	
CNC(=O)c1cc(Oc2cccc(NC(=O)C(=O)NNC(=O)c3cccc(C)n3)c2)ccn1	815630560	NMBBTEGDXUWNPL-UHFFFAOYSA-N	448.439	1.337	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCc2nncn2C1)C(=O)Nc1cc(Cl)ccc1N1CCCCC1	815692398	QDODBZKBTCKNKT-CYBMUJFWSA-N	445.911	1.270	50	20	IDGD	
COc1c(F)cc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)N(C)C)cc1F	815751550	DLJXZSIOADILNC-UHFFFAOYSA-N	428.417	1.306	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)N1CC2(CCC2)c2c(F)cccc21	815751826	PYDQFYLRIZPPDD-UHFFFAOYSA-N	446.504	1.988	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1cc(F)c(F)cc1Cl	815751997	XNLDJJDQQPHMDG-UHFFFAOYSA-N	432.836	1.950	50	20	IDGD	
CCOc1ccc(NNC(=O)C(=O)Nc2cccc(CN3CCN(C(C)=O)CC3)c2)cc1	815816586	CVZJYZVJACDQMW-UHFFFAOYSA-N	439.516	1.831	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)[C@@]12CCC(=O)N1CCS2	849201893	CMAHKADKJCLIAG-HWPZZCPQSA-N	428.308	1.429	50	20	IDGD	
O=C(COC(=O)C1CCN(C(=O)c2ccoc2)CC1)NNC(=O)c1ccc([N+](=O)[O-])cc1	913312701	HHOLAPBPNKSUKZ-UHFFFAOYSA-N	444.400	1.044	50	20	IDGD	
CC(C)NS(=O)(=O)c1cccc(CNC(=O)NNC(=O)COc2ccccc2F)c1	913627953	IVRXJNXMBUEKMO-UHFFFAOYSA-N	438.481	1.422	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@@H]2CC(=O)N(Cc3ccccn3)C2)ccc1OC(C)C	914881269	GKVDDMIFHBJORR-MRXNPFEDSA-N	426.473	1.687	50	20	IDGD	
CC(C)NC(=O)C(=O)NNC(=O)c1cnn(-c2ccc(C(F)(F)F)cn2)c1C(C)C	915139729	GUXQASYQRSKSMM-UHFFFAOYSA-N	426.399	1.695	50	20	IDGD	
COc1cccc(C[C@@H](C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)n2nnnc2C)c1	915696719	HYRMQBBWSRXKEF-ACJLOTCBSA-N	442.451	1.528	50	20	IDGD	
Cc1ccc(C)n1-c1nc(CC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cs1	916124742	DQPRDIPPQWTDFB-UHFFFAOYSA-N	436.497	1.801	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)NCc2ccccc2S(=O)(=O)N(C)C)c1	916237885	STBXKNIGZQADAU-UHFFFAOYSA-N	434.518	1.463	50	20	IDGD	
O=C(C(=O)N1CCN(CCP(=O)(c2ccccc2)c2ccccc2)CC1)N1CCCC1	917131481	RCGOTOYOONRBKR-UHFFFAOYSA-N	439.496	1.767	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)Cc2ccc(C(=O)NNC(=O)c3cnn[nH]3)cc2)cc1	917393695	TZALMDHCQKAKGW-UHFFFAOYSA-N	428.474	1.009	50	20	IDGD	
COC(=O)c1ccc(S(=O)(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)s1	917717512	IZTZEMWNGJZHLW-UHFFFAOYSA-N	430.460	1.184	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NCc2ccc(CN3CCCC3=O)cc2)c2ccccc2c1=O	918125200	UUBFDURTRBLWTN-UHFFFAOYSA-N	448.483	1.200	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)c1cc2c(=O)n3ccccc3nc2n1C	919659268	KTZQNSXAKXPUJZ-UHFFFAOYSA-N	435.440	1.425	50	20	IDGD	
CNS(=O)(=O)c1ccc([C@@H](C)NC(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)cc1	919779073	NGMFSVMMWIPJOG-CQSZACIVSA-N	447.517	1.242	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)[C@H](CSC)N1C(=O)[C@@H]2CCCC[C@H]2C1=O	919822965	XMBPJIOQAVOWLQ-OAGGEKHMSA-N	433.530	1.292	50	20	IDGD	
Cc1csc(SCc2ccc(C(=O)NNC(=O)N[C@@H]3CCS(=O)(=O)C3)cc2)n1	919888464	DFRGQMPXZQVSOV-CQSZACIVSA-N	440.572	1.875	50	20	IDGD	
O=C(NCCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1)NNC(=O)c1ccc(Cl)cc1	920051764	SLDVLNCWUMXLEB-UHFFFAOYSA-N	441.853	1.171	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)[C@H](Cc2ccccc2)NC(=O)c2cccnc2)c1	921305408	PFBARKFCWOFVHS-NRFANRHFSA-N	431.496	1.950	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)CO[C@@H]3CCOC3)c2)c(C)c1	1116199096	LLOALZXSWSLAKA-QGZVFWFLSA-N	447.513	1.671	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)c2n[nH]cc2I)cc1OC	1320313805	QQASDVKDUPXPKC-UHFFFAOYSA-N	444.229	1.887	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(C)nc4ccc(O)cc34)C2)C1	1778429211	HPKQWSZAPBKUIG-XMSQKQJNSA-N	447.919	1.946	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cn3c(F)cccc3n1)CCO2	1779299562	XEZGYNMAKJHZTJ-HXUWFJFHSA-N	434.544	1.768	50	20	IDGD	
COc1cccc(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CO[Si](C)(C)C)C2)n1	1779539984	YMBIDRNWWPIRBI-XMSQKQJNSA-N	449.624	1.998	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(Cl)Cl)C2)c1nc(O)n2c1CCCC2	1779576534	FIBNVEQRZAYBED-BFUOFWGJSA-N	445.347	1.856	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(Cl)Cl)C2)[C@@H]1CC[C@@H]2CCC(=O)N2C1	1780613030	UBKIZFUJSSSKQK-RDNQGFKOSA-N	446.375	1.705	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H]1CC[C@H]3CCC(=O)N3C1)C2	1780707235	FFLWUSKOIUPURD-UDDBWUTJSA-N	439.984	1.919	50	20	IDGD	
CSCC[C@@H](O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@](C)(Cl)CCl)C1	1780714900	KJOMKJBVNPGLLO-KJWYOANISA-N	441.421	1.851	50	20	IDGD	
O=C(CSc1ccncc1)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781326788	UMODYRWZLPEOAT-HOCLYGCPSA-N	432.315	1.694	50	20	IDGD	
COC(=O)c1ccc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](F)Cl)CCO3)c([N+](=O)[O-])c1	1782090121	NOXUSAYFLNELQW-KSSFIOAISA-N	443.815	1.359	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnn4cccc(F)c34)C2)C1	1782552334	WOKLAIRIDOFNNQ-KZULUSFZSA-N	439.285	1.700	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](O)CCl)C3)cc1	1782989263	KGUMSRGWHXSEAS-DBXWQHBBSA-N	437.924	1.372	50	20	IDGD	
Cc1ccc([C@@H](C)C(=O)N2CC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)cc1	1783315805	HXMXTLXVMZLOBY-JPYJTQIMSA-N	430.549	1.301	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cnc(OC)cn3)CCO2)C1	1783342655	DBWJAYFEGFDSJT-PXAZEXFGSA-N	427.299	1.102	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)C[C@H](N)c3cccnc3)CCO2)C1	1783344081	YQOIKRTVWJGDGH-BXWFABGCSA-N	439.354	1.475	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@H]2[C@H](C(=O)N3CC[C@]4(CN(C(=O)[C@@H](F)Cl)CCO4)C3)[C@@H]2C1	1783467320	MXPDOFWFPXGDLF-SGQRUEDASA-N	445.919	1.464	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)Cc3cccc(C(F)(F)F)n3)CCO2)C1	1783873205	MBWLOUGPYOWVRV-KSSFIOAISA-N	449.857	1.727	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@]2(CN(C(=O)CCCc3ccccc3F)CCO2)C1	1783933467	ZXIFPQZSXLRMFO-HSZRJFAPSA-N	448.539	1.351	50	20	IDGD	
CCC[C@H]1CC[C@H](C(=O)N2CCO[C@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)CC1	1783937927	YPBZYYXCQVMSGO-YDHSSHFGSA-N	436.597	1.796	50	20	IDGD	
CC(=O)c1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]3C2)n[nH]1	1783969519	NLFSRCHOCZCJHT-LESCFKLSSA-N	441.326	1.237	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](C)Oc3cccnc3)C2)C1	1784547498	PIUZLDCPDSZCQC-PMUMKWKESA-N	426.311	1.462	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)NC(=O)OC(C)(C)C)C[C@@H]21	1784620055	ICZMTQARILKECG-WNZSCWOMSA-N	447.960	1.217	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC1(c2ccc(NC(=O)C(O)O)cc2)CCC1	1786020746	AGDLTXYGSLHPGD-UHFFFAOYSA-N	443.412	1.579	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)[C@@H]1CNc2ccccc21	1786876939	XZJDTXLBISLPQL-LPZDXIQQSA-N	440.313	1.866	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)c1cn2ccccc2n1	1787841325	RYAWPRIKXRVVIH-DZKIICNBSA-N	435.322	1.713	50	20	IDGD	
O=C(CCc1cnc[nH]1)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1	1788144977	JJVXRWGFTNHSND-UHFFFAOYSA-N	432.289	1.470	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3n[nH]c4ccc(C#N)cc34)C[C@@H]21	1791256590	CTKXNAOFYHWMRU-SCNOPHJPSA-N	445.907	1.282	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)COc3ccccc3C#N)[C@H]2C1	1792148680	XMKVHVRAFVWETM-BMFAXAFESA-N	435.908	1.171	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cncc(N(C)C)c1)C2	1792870193	LXOPPWLERTVOEL-JJAZEVLHSA-N	439.354	1.382	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=N/N1CCCCC1)C2	1792871249	SFCHTQOQYRZUBT-OEVURZHNSA-N	429.359	1.079	50	20	IDGD	
O=C(CSc1ccc(F)cc1F)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2	1793291149	XUDXUUKKYPSQQA-KOZDUTSQSA-N	434.892	1.246	50	20	IDGD	
CC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1793880932	LRGGWODUFSISPL-IVSAIRAKSA-N	445.944	1.077	50	20	IDGD	
O=C(CCc1cnccc1C(F)(F)F)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2	1793970390	VJCDVFYJFWTLIM-YXPYIKCWSA-N	449.857	1.222	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnc2c(Cl)cccn12	1796066604	VSHNGTJMGKXBSF-FAXLKDOZSA-N	441.315	1.445	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)n1ccccc1=O	1797937345	KOFAQPOHVGTNJS-LFYQSXPISA-N	440.338	1.172	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(F)nc1C	1798315075	ZAUVHFIGIHWIAH-FAXLKDOZSA-N	428.302	1.906	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CSC(=N)N)C2	1799218074	WOFRFHVFZJMGQR-CLLJXQQHSA-N	449.489	1.399	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nn(C)c(C)c1Br)C2	1799269275	VWIVIPFKVFFVHL-OPDFLTKYSA-N	447.761	1.712	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c(c1)OCCO3)C2	1799275569	YFMVUAOBRNKILU-HXFPYSNGSA-N	443.327	1.897	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3cccnc3[nH]1)C2)[C@@H](F)Br	1799350427	ZZYDLGODPYANPS-ZMJPVWNMSA-N	425.258	1.457	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(F)c(F)c1OC	1799677208	PDCWOQWGTYQHGE-DDFXLWFNSA-N	432.851	1.430	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1nc2cc([N+](=O)[O-])ccc2[nH]1	1799875576	HZOCXHBSBPHESR-DZJQYVJYSA-N	435.868	1.692	50	20	IDGD	
CCOCCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2	1801497171	YWNZMVJVTRMJKZ-YVWYUNDQSA-N	449.460	1.150	50	20	IDGD	
COc1ncc(Cl)cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCC(=O)NN(C)C	1802329855	UHOUWVAPIPSKJY-QDMKHBRRSA-N	437.928	1.368	50	20	IDGD	
CC[C@@H](NC(C)=O)C(=O)NC[C@@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1	1802879773	IQKDSNQHSSNKDD-JZXOWHBKSA-N	439.354	1.787	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)c2cccn(C)c2=O)[C@@H]1c1cccnc1	1803835052	HDKCEXGPVRHKIR-QRTARXTBSA-N	447.333	1.883	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@H](CNC(=O)CN)[C@@H]1c1cccnc1	1807041690	IRCZVOIMPLYTJA-MTNVJAPISA-N	425.439	1.931	50	20	IDGD	
Cc1c[nH]cc1C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1807361123	HKGRULNWPSMUJE-WIYYLYMNSA-N	432.289	1.031	50	20	IDGD	
C=CCSCC(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1807369867	XKFDZDAKZORBKI-WIYYLYMNSA-N	439.346	1.000	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)Cc2cnccn2)[C@@H]1c1cccnc1)[C@@H](F)Br	1808649479	SEPCDANUXATQDC-IAOVAPTHSA-N	436.285	1.811	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccnnc2O)[C@H]1c1cccnc1)[C@H](F)Br	1808675678	DDAWHGFNWDNQPO-UBHSHLNASA-N	438.257	1.587	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)c1cc2ccccn2n1	1809052999	FUMQITXLZQJFAI-IPELMVKDSA-N	427.892	1.649	50	20	IDGD	
Nc1n[nH]c(CCC(=O)N2CCC3(CCCN(C(=O)CCBr)C3)CC2)n1	1809066723	ITGHQXSIZNBFTM-UHFFFAOYSA-N	427.347	1.336	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)NC[C@H]1CCN(C(=O)C(Cl)Cl)[C@@H]1c1cccnc1	1810242039	ZSNPNNLTMMSJLB-MRVWCRGKSA-N	430.336	1.599	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2ccc3ncnn3c2)[C@@H]1c1cccnc1	1813030733	GDNQOWPENOXMLQ-HHXXYDBFSA-N	442.907	1.698	50	20	IDGD	
C#CCCCCC(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1813223820	UVHFNMHIVXQMRN-REWPJTCUSA-N	433.317	1.275	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cnc3snnc3c2)[nH]n1)[C@@H](O)CCl	1814872589	DPKQBFHGFWBIKT-STQMWFEESA-N	435.897	1.715	50	20	IDGD	
COC(=O)[C@H]1CC[C@H](C(=O)Nc2cc([C@H]3CCCCN3C(=O)[C@H](O)CCl)[nH]n2)CC1	1815465317	FNDABNNDDBHLFM-RRCSTGOVSA-N	440.928	1.981	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(=O)n3[nH]cnc3n2)n[nH]1	1817465243	VVIPJEJWIMRTJV-ZDUSSCGKSA-N	446.899	1.712	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](O)CCl)CC2)c1cnnc2ccccc12	1818179022	FYUXNKYIUFZZNB-ZUZCIYMTSA-N	431.905	1.912	50	20	IDGD	
CC1=C(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cnccc3C(=O)NN)n[nH]2)CCO1	1819402733	IXWYIBFUBMPRFY-KRWDZBQOSA-N	439.476	1.408	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cnccc3C(=O)NN)n[nH]2)ccn1	1819403501	PSGXXYPPRSBNJZ-SFHVURJKSA-N	448.487	1.731	50	20	IDGD	
C[C@](O)(CC(=O)O)CC(=O)N[C@H]1CCc2nc(NC(=O)CO[Si](C)(C)C)sc2C1	1820169621	ZUIIYZUIJVSSJM-BBATYDOGSA-N	443.598	1.522	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1ccccc1F	1820409051	NAUSLCKSFJJPLA-IBGZPJMESA-N	436.252	1.848	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1ccc(F)cc1	1820555242	UHDDSMALHTUFEX-LJQANCHMSA-N	436.252	1.848	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](F)Br)n[nH]1	1820932742	OKNHGMBLPWFIPJ-GAJTVXKRSA-N	432.294	1.959	50	20	IDGD	
CC(=O)C[C@H](C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1822345320	XBVMTNWRKJZHNT-SJCJKPOMSA-N	441.492	1.329	50	20	IDGD	
CC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](C)N1CCN(C)CC1)CC2	1822849043	FPSYFAQXXJMBAC-MJBXVCDLSA-N	428.002	1.708	50	20	IDGD	
CCS(=O)(=O)CC(=O)N[C@@H]1CCc2nc(NC(=O)[C@](C)(Cl)CCl)sc2C1	1822861129	WGOKOWMCTMFRAF-RFAUZJTJSA-N	442.390	1.726	50	20	IDGD	
O=C(CCc1ccoc1)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1822918517	ITBYYNMITXUGQY-LJQANCHMSA-N	436.277	1.621	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(=O)n1O)CC2	1825637159	TUZMMKZUMVDQHK-DTWKUNHWSA-N	441.307	1.551	50	20	IDGD	
Cc1ccncc1C(=O)N[C@@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1	1826086291	QHJFLCFZNUEMIU-CYBMUJFWSA-N	430.534	1.445	50	20	IDGD	
CC(C)n1nccc1C(=O)N[C@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1	1826087483	DZXDZYFCPQEUIS-ZDUSSCGKSA-N	447.565	1.519	50	20	IDGD	
Cn1cc(CC(=O)Nc2nc3c(s2)C[C@H](NC(=O)CCBr)CC3)cn1	1826936841	VUPQRDZLPAQOCD-LLVKDONJSA-N	426.340	1.816	50	20	IDGD	
CCc1ccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)cn1	1827055902	JGYBFWLBBTVCAU-HSZRJFAPSA-N	449.360	1.871	50	20	IDGD	
Cc1nccc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)n1	1827059485	RFTUPCBPFVECSX-NRFANRHFSA-N	436.321	1.012	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnnc(Cl)c3)C2)C1	1830357778	GLHJNICWYYPTOJ-GOSISDBHSA-N	431.320	1.465	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H](F)Br)CC1	1830381583	HVCZKYVWFVRPLV-INWMFGNUSA-N	432.334	1.987	50	20	IDGD	
O=C([C@H](O)CCl)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CCC[C@@H]4CCCC[C@@H]43)C2)C1	1830732065	UFGQTDMCIIKGCT-JUMAPTCESA-N	442.984	1.649	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cc(C)n(C)n3)C2)C1	1831639842	FCAMRXPORFDIIB-FXAWDEMLSA-N	426.945	1.135	50	20	IDGD	
Cc1csc(C(=O)N2CCO[C@]3(COCCN(C(=O)CCBr)C3)C2)c1	1831773618	OSFRMRSTYYZGEB-KRWDZBQOSA-N	431.352	1.912	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H](C)CS(C)(=O)=O)CC1	1831827743	JLHMQLITXCRJFD-XIRDDKMYSA-N	437.002	1.541	50	20	IDGD	
C[C@@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1)n1cccc1	1832107257	DXXHSCPJULLGNB-PGRDOPGGSA-N	437.349	1.662	50	20	IDGD	
C=CCSCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1	1832458678	VHFOCVVFKYBCBH-SJORKVTESA-N	425.378	1.598	50	20	IDGD	
C=CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2	1832552068	XDYVUFLTZCDYLH-YWZLYKJASA-N	445.944	1.151	50	20	IDGD	
CN1C(=O)CC[C@H]1C(=O)N1CCC(N2CCC(NC(=O)C(C)(C)CCl)CC2)CC1	1833214567	XYWDENAZOHGYFF-KRWDZBQOSA-N	426.989	1.444	50	20	IDGD	
C/C(=C\c1cccnc1)C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)CCl)CC2)CC1	1833313074	ULMNHQWXXLVCOL-MQMQVCBVSA-N	434.968	1.656	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)Cc3cnccn3)CC2)CC1	1833372738	DZHFDRNZHRONED-CQSZACIVSA-N	438.370	1.374	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@](C)(Cl)CCl)C3)C2)nn1C	1834122563	VQONGTQZZPIYOQ-QZTJIDSGSA-N	433.336	1.035	50	20	IDGD	
COCCOCC(=O)NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1	1834564335	HJDAKQUBEVHXOC-UHFFFAOYSA-N	434.375	1.006	50	20	IDGD	
CC(C)n1ccc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCBr)CCO3)C2)n1	1834823671	BQGQQLHPKDZCDS-GOSISDBHSA-N	443.342	1.319	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@]3(CN(C(=O)CCBr)CCO3)C2)ccc1F	1834823816	LSTBUOYYUBWIJI-IBGZPJMESA-N	443.313	1.989	50	20	IDGD	
Cc1nccc(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](C)Br)CC3)CC2)n1	1835219932	XGMNMVNQMZHQCM-CYBMUJFWSA-N	438.370	1.754	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CCNC(C)C)CCO2)C1	1835888916	BWLVVSZWRAOZLL-MAUKXSAKSA-N	434.375	1.004	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cc(C(C)C)[nH]n3)CC2)CC1	1836159136	HWWMHCQQXRXIMU-KRWDZBQOSA-N	439.988	1.972	50	20	IDGD	
COCc1c[nH]c(C(=O)N2CCC(OC3CCN(C(=O)[C@H](O)CCl)CC3)CC2)c1	1836718551	SGHDCGYULYESTK-GOSISDBHSA-N	427.929	1.373	50	20	IDGD	
COc1ccc(C(=O)N2CCOC[C@@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)s1	1837710034	DCILJPPQJXPKGN-LJQANCHMSA-N	442.610	1.678	50	20	IDGD	
Cc1noc(C)c1C(=O)N1CCOC[C@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1837712220	KAGUSBFOPRLOMV-IBGZPJMESA-N	425.558	1.213	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)C3(F)CCCCC3)C2)C1	1837713068	FMROUOZOCYSUHP-IBGZPJMESA-N	430.593	1.967	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(F)nc3)CCO2)C1	1837846892	SXGRBUUYNTYTRF-ZWKOTPCHSA-N	434.295	1.527	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(C)n(C(F)F)n3)CCO2)C1	1838707969	CKJLAZIVOPNFHE-FZKQIMNGSA-N	434.871	1.674	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(=O)c4ccccc4o3)C2)C1	1839141591	NBVDROMTSDTBAN-ZHRRBRCNSA-N	448.903	1.880	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)COc3ccccc3)C2)C1	1839151114	ILNSJNWDKRPFCY-VQTJNVASSA-N	445.343	1.758	50	20	IDGD	
COc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)nc1	1839153022	RUYYRBPCHNFNLY-MOPGFXCFSA-N	446.331	1.397	50	20	IDGD	
Cc1c(F)cccc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839197271	OIJINGFHSHMOPW-MAUKXSAKSA-N	447.276	1.895	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)Oc1ccccc1)CCO2	1839219826	XIGSHMMXYYPVKI-BLIXFSHQSA-N	440.924	1.164	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H]2CC[C@@H]1[C@@H](C(=O)N1CC3(CCCN3C(=O)[C@@H](O)CCl)C1)C2	1841354661	NDYZHUSLLIQMLK-JONQDZQNSA-N	441.956	1.578	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1ccc3nccn3c1)C2	1843415907	AXUSLVBBWACZHU-MFKUBSTISA-N	433.472	1.285	50	20	IDGD	
CCc1cnc(C(=O)N2CC3(CCCN3C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)s1	1843416198	KHIDEYBEESLIAY-YDZHTSKRSA-N	428.518	1.657	50	20	IDGD	
COc1cc(Cl)ccc1CC(=O)N1CCCC12CN(C(=O)c1cccc(B(O)O)c1)C2	1845890562	DXRBZTHDUMQXKP-UHFFFAOYSA-N	442.708	1.088	50	20	IDGD	
C[C@@H](C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1ccc(B(O)O)cc1)c1ccc(Cl)cc1	1847409085	LHAAHZDFEQNQQO-UAOJZALGSA-N	426.709	1.639	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC=C(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](O)CCl)C1	1847557438	YNRRMNYCHPQRAN-JYJNAYRXSA-N	427.929	1.355	50	20	IDGD	
O=C(c1cccc(I)c1)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl	1847565306	LLXWYZAFRCEYCS-MELADBBJSA-N	448.688	1.706	50	20	IDGD	
C=CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](Cl)COC	1847942335	SHNXRVIIEKFUKW-UGUYLWEFSA-N	429.945	1.911	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NN[C@H](C(=O)NC1CC1)c1ccc(F)cc1	10830449	YAQALMVPGNRSME-INIZCTEOSA-N	433.509	1.682	50	20	IDGD	
O=C(CN1CCN(S(=O)(=O)c2ccc(Cl)s2)CC1)NNC(=O)c1cccs1	15451778	NYCMOIPXKJACTA-UHFFFAOYSA-N	448.979	1.231	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COc2ccc(C)c(C)c2)cc1S(=O)(=O)N(C)C	15886572	MWSBJBRBFGOIMJ-UHFFFAOYSA-N	435.502	1.402	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2ccc3ccccc3n2)cc(Cl)c1OCC(N)=O	21438689	ACZADBRNBXMODZ-UHFFFAOYSA-N	428.832	1.836	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCCC(=O)NNC(=O)COc2ccccc2F)cc1	26696741	PGABWQRWBPEHBE-UHFFFAOYSA-N	439.465	1.119	50	20	IDGD	
CC(C)Oc1ccc(NC(=S)NNC(=O)CCn2nnc3ccccc3c2=O)cc1	727497581	ZGLMTVYIIFZAJM-UHFFFAOYSA-N	426.502	1.987	50	20	IDGD	
CC(=NNC(=O)[C@H](C)NS(C)(=O)=O)c1cccc(OCc2cn3ccccc3n2)c1	728435348	ZAMKTUSOYNHNLP-HNNXBMFYSA-N	429.502	1.691	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)NCCC(=O)N2CCCCC2)c1	728744440	BBFKRCLMBRWAKB-UHFFFAOYSA-N	427.299	1.804	50	20	IDGD	
CC(C)N(CC(N)=O)C(=O)/C(C#N)=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	728856965	PXOIWKYZIJEIPM-DHDCSXOGSA-N	442.907	1.708	50	20	IDGD	
CN(CCCCNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)c1ccccc1	728948956	KVBZCVJKDIVCCE-UHFFFAOYSA-N	425.537	1.940	50	20	IDGD	
O=C(O)COc1ccc(S(=O)(=O)NNC(=O)Cn2ccc3ccccc32)cc1Cl	729667215	JEWVVRZAPVPVDN-UHFFFAOYSA-N	437.861	1.768	50	20	IDGD	
CC(=NNC(=O)Cc1nc(C)cs1)c1cccc(N(S(C)(=O)=O)S(C)(=O)=O)c1	729816556	OMRDQMKMGXCGOY-UHFFFAOYSA-N	444.560	1.260	50	20	IDGD	
CNC(=O)C1(C(=O)NNC(=O)c2cccc(S(=O)(=O)Nc3ccc(C)cc3C)c2)CC1	729964948	HMXLIWZNPYAEIY-UHFFFAOYSA-N	444.513	1.391	50	20	IDGD	
CCCCN1C(=O)CC[C@@H](C(=O)NNC(=O)Cc2cc[nH]n2)[C@H]1c1ccccc1OC	730102460	FCVFKFPHGPIOOC-DYESRHJHSA-N	427.505	1.888	50	20	IDGD	
C[C@H](CN1CCN(C)CC1)NC(=O)NNC(=O)c1ccc(Br)cc1Cl	730132658	XTCVOJRPADNOMM-LLVKDONJSA-N	432.750	1.682	50	20	IDGD	
O=C(CC[C@@H]1NC(=O)N(c2ccc(Cl)cc2)C1=O)NNC(=O)COc1ccccc1F	730768563	CDNHJCOUHDOEKP-HNNXBMFYSA-N	448.838	1.911	50	20	IDGD	
COc1ccc(C2(CNC(=O)NNC(=O)COc3ccccc3O)CCOCC2)cc1	730825784	XNALJPPMGBNIQD-UHFFFAOYSA-N	429.473	1.858	50	20	IDGD	
CC(C)(C(=O)NNC(=O)CCNS(=O)(=O)c1ccc(F)c(F)c1)c1ccccc1	731201868	VMMWQYZEYMBYEG-UHFFFAOYSA-N	425.457	1.758	50	20	IDGD	
CC1CCC(N2C[C@@H](C(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)CC2=O)CC1	731341313	AKDHLOYWYZHVGS-SLTAFYQDSA-N	425.489	1.122	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)c1sccc1S(=O)(=O)N(C)C	731956571	DCDZEVYVSAKEAN-UHFFFAOYSA-N	427.504	1.237	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])o1)c1cc(-c2ccccc2)on1	732054713	DDIAKQWVNLRHQQ-AWEZNQCLSA-N	439.384	1.909	50	20	IDGD	
Cc1c(C(=O)OCC(=O)NNC(=O)c2cccs2)nnn1-c1cccc2cnccc12	732344794	ZDMQTJLHOJPMPI-UHFFFAOYSA-N	436.453	1.803	50	20	IDGD	
Cn1c(=O)c2cc(C(=O)NNc3nc(-c4ccc(Cl)cc4)no3)cnc2n(C)c1=O	732978309	MCDTWZWCKATBQN-UHFFFAOYSA-N	427.808	1.093	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)[C@@H](c1ccccc1)N1CCCCC1=O	734241551	IFSFIHISEQDTSF-QGZVFWFLSA-N	433.509	1.595	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)CN(CC)C(=O)OC(C)(C)C)c2ccccc2c1=O	734312758	NUGZYBOEXWFJEV-UHFFFAOYSA-N	431.493	1.825	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)c1ccc(C)cc1)C(=O)NNc1ccc(Cl)nn1	735687471	KNHAXTNIIKYCOJ-CYBMUJFWSA-N	429.955	1.982	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)NCCCOCC1CCOCC1	740918621	KMEPIHUSPGSBHY-UHFFFAOYSA-N	444.326	1.992	50	20	IDGD	
CCCNC(=O)NNC(=O)[C@@H](CCS(C)(=O)=O)Cc1cccc(Br)c1	741211236	FVUKBXFVPXBDBF-ZDUSSCGKSA-N	434.356	1.783	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NCc2ccc(-n3ccnc3)c(F)c2)cc1	743563161	OCKWVUNCXKZRHN-UHFFFAOYSA-N	446.464	1.951	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)N[C@@H]2CC(=O)N(CCOc3ccccc3)C2)c1	743635346	CBDLHPUZGAXFFU-MRXNPFEDSA-N	442.472	1.328	50	20	IDGD	
CN(CC(=O)NNC(=O)c1ccc(C#N)cc1)Cc1cc2c(cc1OC(F)F)OCO2	744405057	KRABORPREPZQKD-UHFFFAOYSA-N	432.383	1.781	50	20	IDGD	
COC(=O)CCN(CC(=O)NNC(=O)c1cc(Cl)ccc1OC)C1CCOCC1	744427357	SHJURYGGRXKTGE-UHFFFAOYSA-N	427.885	1.154	50	20	IDGD	
C[C@H](CN1CCN(c2ccccc2)CC1)NC(=O)NNC(=O)COc1ccccc1C#N	745840066	TWLXVQKKBYZYTR-GOSISDBHSA-N	436.516	1.478	50	20	IDGD	
Cc1nnc(-c2ccc(C(=O)NNC(=O)c3sc(N4CCOCC4)nc3C)cc2)o1	746097598	LDKPZSURIIGBCZ-UHFFFAOYSA-N	428.474	1.721	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNc3ncccc3S(=O)(=O)N3CCN(C)CC3)n[nH]2)o1	747519276	XEAOFPXVEPMOEI-UHFFFAOYSA-N	445.505	1.066	50	20	IDGD	
Cc1c(/C=C(\C#N)C(=O)NCCC(=O)N2CCN(c3ccccc3)CC2)cc(C#N)n1C	748233812	DGUMDWSLNHKZAX-XSFVSMFZSA-N	430.512	1.967	50	20	IDGD	
CS(=O)(=O)CC[C@@H](NS(=O)(=O)c1ccccc1)C(=O)NNc1ccccc1Cl	748314888	LFYIJNFMYYZHCI-MRXNPFEDSA-N	445.950	1.565	50	20	IDGD	
O=C(CN1C(=O)[C@H]2CCCC[C@H]2C1=O)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1	748521613	WWPWHSMGZQDXCP-BETUJISGSA-N	433.408	1.598	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3cc(F)c(F)c(F)c3F)cc2)CC1	748624233	VUJWXFNYHOKWEP-UHFFFAOYSA-N	446.426	1.936	50	20	IDGD	
N#C/C=C(\c1cccc([N+](=O)[O-])c1)N1CCN(S(=O)(=O)c2ccc(C(N)=O)o2)CC1	750037340	YRVLHIMGSKPERH-GIDUJCDVSA-N	431.430	1.158	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)c1ccc(Br)cc1[N+](=O)[O-]	750827433	ZADRPNXOPSDOEN-UHFFFAOYSA-N	427.236	1.610	50	20	IDGD	
C[C@@H](CN1CCOCC1)C(=O)NN=C1C(=O)Nc2c(I)cccc21	750935364	RADJDCBAIXFVKW-JTQLQIEISA-N	442.257	1.032	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)c1cc(Cn2cc(Br)cn2)on1	752611472	NRMDHTVGHLZDBT-UHFFFAOYSA-N	449.265	1.564	50	20	IDGD	
O=C(CCc1cccc([N+](=O)[O-])c1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	755037149	NVPWRMAGZSLJQB-UHFFFAOYSA-N	446.485	1.773	50	20	IDGD	
O=C(NCCN1C(=O)[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)NNC(=O)Nc1ccc(OC(F)F)cc1	755261588	YLMMBFKQCKPCCL-UOVKNHIHSA-N	449.414	1.431	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)Nc1ccccc1C(=O)N1CCOCC1	755625292	XRZGMQLTTPSEDD-UHFFFAOYSA-N	434.456	1.811	50	20	IDGD	
CCOc1ccc(OCC)c(NC(=S)NNC(=O)c2coc(S(=O)(=O)NC)c2)c1	756137259	NVUUPQXRUDVSRO-UHFFFAOYSA-N	442.519	1.617	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(N2C[C@H]3CC[C@H]2C3)cc1	756165535	YGDAVBALCFKSSX-YJBOKZPZSA-N	438.484	1.849	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2ccc(C)nc2Br)n1	756434487	TZPOXJOIVJXPMI-UHFFFAOYSA-N	427.280	1.464	50	20	IDGD	
COCCS(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1	756548717	CWPCISVPIZTLBG-KRWDZBQOSA-N	435.458	1.099	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)Nc2cnn(-c3ncccn3)c2)c2ccccc2c1=O	756758646	JEDHBRDATSQOLR-UHFFFAOYSA-N	433.432	1.420	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1	756812905	HEXYYRWJCFFWFD-NSHDSACASA-N	435.437	1.580	50	20	IDGD	
COC(=O)c1cc(NC(=O)NNC(=O)c2cccc(N(C)C)c2)cc(S(C)(=O)=O)c1	757673822	KSOXSXDVBCZFTD-UHFFFAOYSA-N	434.474	1.409	50	20	IDGD	
CS(=O)(=O)CCc1ccc(NC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc1	757749155	NGBUJCMDMLKZKR-UHFFFAOYSA-N	443.485	1.632	50	20	IDGD	
CC(=O)N1CC[C@H](NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c2ccccc21	757789409	UUALUDPCBSQPTP-KRWDZBQOSA-N	434.456	1.375	50	20	IDGD	
CCS(=O)(=O)NCC(=O)NNC(=O)c1ccc(COc2ccc(Cl)cc2)cc1	758055991	SELNYTIEEYRQBR-UHFFFAOYSA-N	425.894	1.619	50	20	IDGD	
COC(=O)[C@H](C)Oc1ccc(C=NNC(=O)Cc2csc(N3CCOCC3)n2)cc1	758373746	IVDPNNCETVNCIH-AWEZNQCLSA-N	432.502	1.613	50	20	IDGD	
C[C@@H](CC(=O)N1CCN(S(=O)(=O)CBr)CC1)C(=O)c1cccc(F)c1	758513807	ULNTVBURZJLMOV-LBPRGKRZSA-N	435.315	1.861	50	20	IDGD	
CCO[C@@H]1C[C@@H](NC(=O)NNC(=O)c2nn(CC)c(=O)c3ccccc23)[C@]12CCCO2	760141718	HGPGRMIEZINXBH-WHSLLNHNSA-N	429.477	1.087	50	20	IDGD	
O=C(Cn1c(C2CCCCC2)nc2ccccc21)NNC(=O)N[C@@H]1CCS(=O)(=O)C1	761383211	ULOBRUMCRRKXCU-OAHLLOKOSA-N	433.534	1.602	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)CS(=O)(=O)Cc1ccc(C#N)cc1	761635791	DPURFINYKSHHSI-UHFFFAOYSA-N	433.511	1.421	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)NCc1cccc(NS(C)(=O)=O)c1	763460585	MYSOBIKUFHGUFY-UHFFFAOYSA-N	443.526	1.193	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)n([C@H]2C[C@H]3CC[C@H]2C3)n1	763573864	VKOJRRKTDVXART-YRBFXIGRSA-N	439.472	1.479	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(NC(=O)C3CC3)c2)cc1	763659189	KXBGOQKYCHXBJW-UHFFFAOYSA-N	426.429	1.209	50	20	IDGD	
COC(=O)[C@@H](C)Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCC3)cc1	763782340	BLOMYBLMHVYRPI-LBPRGKRZSA-N	429.498	1.988	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1cccc(Oc2cnccn2)c1	763870636	BFKXSESDTKAGFU-CYBMUJFWSA-N	439.403	1.961	50	20	IDGD	
CN(C1CCCCC1)S(=O)(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2ccc[nH]2)c1	763979398	HCZJFJVXIKHFDR-UHFFFAOYSA-N	447.517	1.368	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2cccn2C)cccc1-c1nnc2n1CCCCC2	763995326	GTEJMWPMNLMYDF-UHFFFAOYSA-N	435.488	1.718	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)C(=O)Nc1ccc(OC(F)F)c(F)c1	763996067	UJDZJNZSRPIPTG-UHFFFAOYSA-N	435.156	1.917	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)on1)C(=O)Nc1ccc(Br)nc1	764003773	NNSGHFRTGHBYDC-UHFFFAOYSA-N	430.218	1.899	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(CCN3CCCCC3)cc2)c1O	764130227	DTYPQLQPZNSCPX-UHFFFAOYSA-N	440.500	1.829	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)c2cccc(OC)c2O)sc(C)c1CC	764133593	XLTBJKAOHYJWEQ-UHFFFAOYSA-N	449.485	1.910	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2O1)C(=O)Nc1ncn(Cc2ccc(Cl)cc2)n1	764164624	RMSGFKJCJAPWKT-INIZCTEOSA-N	440.847	1.069	50	20	IDGD	
Cc1ncsc1C(=O)NNC(=O)C(=O)Nc1ccccc1CN1C[C@H](C)O[C@H](C)C1	764245672	IQYGEEAOXKZYMX-BETUJISGSA-N	431.518	1.460	50	20	IDGD	
O=C(Cc1ccccn1)NNC(=O)C(=O)Nc1ccc(CCN2CCSCC2)cc1	764264699	RGHQXKUOJLLMJI-UHFFFAOYSA-N	427.530	1.002	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)C(=O)Nc1cccc(C[S@](=O)C2CCCCC2)c1	764269092	VLSHAHRFFFJWDL-HKBQPEDESA-N	442.541	1.992	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)ccc1O)C(=O)Nc1ccnn1C1CCCC1	764279844	FRBWJKQWMARTKX-UHFFFAOYSA-N	436.266	1.866	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)C(=O)Nc1cccc(S(=O)(=O)N(C)C)c1)c1ccccc1	764327307	XCPKNEPMBILGEP-QGZVFWFLSA-N	432.502	1.217	50	20	IDGD	
CC(C)n1ncc2cc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc3ccccc3)cnc21	764370541	SBYUMZPGWRLDTJ-UHFFFAOYSA-N	432.387	1.770	50	20	IDGD	
CCNS(=O)(=O)c1ccc(CNC(=O)NNC(=O)Cc2c[nH]c3ccccc23)cc1	764372912	FFKIAYRPBXFELM-UHFFFAOYSA-N	429.502	1.539	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)N[C@H]2CCCC[C@@H]2N2CCOCC2)nc1	764377851	ZQJFYWDFRFXSJG-IRXDYDNUSA-N	440.570	1.038	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cccnc2)cc(Br)c1F	764662350	JBMFVBIMYNHBCB-UHFFFAOYSA-N	439.197	1.170	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)c1ccc(N2CCCS2(=O)=O)cc1	765323387	NUQPQCDRSVVOLL-UHFFFAOYSA-N	440.522	1.292	50	20	IDGD	
Cc1cc(C)c(OCC(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)c(C)c1	765737682	IBNZAHQMUUKKJH-UHFFFAOYSA-N	438.528	1.596	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cc4c(s3)CCOC4)CC2)cc1	765754530	MAXAQKAHLGNEIL-UHFFFAOYSA-N	428.558	1.708	50	20	IDGD	
COc1cc(S(=O)(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)cnc1Cl	767438670	XEHFUEYXXZKRNJ-UHFFFAOYSA-N	431.854	1.393	50	20	IDGD	
CC1CCN(C(=O)C(=O)NNc2nc3ccccc3c(=O)n2CCCOC(C)C)CC1	767921572	KQWIHWYJTVNCMI-UHFFFAOYSA-N	429.521	1.913	50	20	IDGD	
CC(C)(C)[C@@H](Br)C(=O)Nc1ccc(N2CCN(S(C)(=O)=O)CC2)nc1	768098721	HNQYFTWAJKVIBY-AWEZNQCLSA-N	433.372	1.911	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)c2cccc([C@]3(C)NC(=O)NC3=O)c2)o1	768977287	RHEVTGPHNDONGT-NRFANRHFSA-N	427.461	1.251	50	20	IDGD	
CC(C)(C)OC(=O)N1CCc2ccccc2[C@@H]1C(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1	769077644	LHTMGORCLOWPQU-GOEBONIOSA-N	437.518	1.103	50	20	IDGD	
CNS(=O)(=O)c1cccc(NC(=O)NNc2c(OC)cccc2S(C)(=O)=O)c1C	769238978	ATWOHCTVXLXPJS-UHFFFAOYSA-N	442.519	1.464	50	20	IDGD	
Cc1nn(CC(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1-c1ccccc1	769350635	BIFQSQUJEIQQLP-UHFFFAOYSA-N	437.412	1.771	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)N[C@H]3CCN(C4CCCCC4)C3=O)nc21	770413697	WBYHNGAUJGGECL-AWEZNQCLSA-N	430.513	1.847	50	20	IDGD	
C[C@H](NS(=O)(=O)c1ccc(C(N)=O)cc1)C(=O)NNc1cc(Cl)ccc1Cl	771027173	GYHPTCXJQWDHCT-VIFPVBQESA-N	431.301	1.902	50	20	IDGD	
COc1ccccc1[C@]1(C)NC(=O)N(CC(=O)NNC(=O)c2ccc(Cl)cc2F)C1=O	771261714	DRXNKAJAZMVUEA-FQEVSTJZSA-N	448.838	1.716	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)CSc1nc(O)cc(C(F)(F)F)c1C#N	771904292	RHNFAZDXYHETMQ-VIFPVBQESA-N	448.423	1.895	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)[C@@H](C)NC(=O)c1ccc(Br)s1	772036990	MSRPBQNHGAQXBT-NXEZZACHSA-N	448.339	1.754	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3O)CC2)cc1	773395038	ZKPDUPOXOSZVKS-UHFFFAOYSA-N	427.461	1.188	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)ncc1Br	773530220	UJCHJQUKBOKKQS-UHFFFAOYSA-N	427.642	1.911	50	20	IDGD	
O=C(COC(=O)[C@@H]1CCN(C(=O)OCc2ccccc2)C1)NNC(=O)c1ccccc1	773584029	OCTGITWWOLCGGF-GOSISDBHSA-N	425.441	1.650	50	20	IDGD	
O=C(NNc1cnc2ccccc2n1)C(=O)Nc1cccc(OCC(=O)N2CCCC2)c1	773717657	DVMBVSPJLRAHRO-UHFFFAOYSA-N	434.456	1.713	50	20	IDGD	
CC(C)Cc1cc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc(O)n1	777141681	CPQJPLFBJROAHL-KRWDZBQOSA-N	429.429	1.130	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCO[C@H](c3ccc(F)cc3F)C2)cc1OC	778283862	ZQACQJCZKIOTBY-IBGZPJMESA-N	435.427	1.817	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)cc1)C(=O)Nc1ccc(F)cc1-c1nc(C2CC2)no1	782834414	VIHFCYYOTBIRCN-UHFFFAOYSA-N	425.376	1.858	50	20	IDGD	
COC(=O)c1ccc(N2CCCC2)c(NC(=O)C(=O)NNC(=O)c2ccc(O)cc2)c1	782834458	WVGBMTFPJITNEV-UHFFFAOYSA-N	426.429	1.179	50	20	IDGD	
COc1ccc(Sc2ccc(NC(=O)C(=O)NNC(=O)C(=O)NC3CC3)cc2)cc1	782965609	HHGRIGAZTFPNST-UHFFFAOYSA-N	428.470	1.211	50	20	IDGD	
CC(C)(C)NS(=O)(=O)Cc1cccc(NC(=O)C(=O)NNc2cncc(Cl)n2)c1	783259600	GFYJSPFJIPBEJP-UHFFFAOYSA-N	440.913	1.430	50	20	IDGD	
Cc1cc2cc(NC(=O)C(=O)NNc3ccc(S(=O)(=O)NC(C)C)cn3)ccc2[nH]1	783263744	KUSGWOKUMAUXRG-UHFFFAOYSA-N	430.490	1.640	50	20	IDGD	
Cc1ccc(NNC(=O)C(=O)Nc2ccc(C)c(S(=O)(=O)N3CCCCC3)c2)nn1	783950539	RZRGPZNJUHOIRJ-UHFFFAOYSA-N	432.506	1.350	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCCc1ccc(F)c(F)c1F	784171495	LTIXWTSMMRYRKU-UHFFFAOYSA-N	443.451	1.892	50	20	IDGD	
Cc1nc(N2CCOCC2)ccc1NC(=O)C(=O)NNc1ccc(Br)nc1	784806468	HVHHTAMRWRXXRM-UHFFFAOYSA-N	435.282	1.466	50	20	IDGD	
Cc1nnc(-c2ccccc2C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)o1	786383090	VCBGVZRWWBIPOH-KRWDZBQOSA-N	438.396	1.189	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)/C(C#N)=C\c3ccc(O)cc3)cc2)CC1	787465467	ZGVWDJGSXCCDPC-VKAVYKQESA-N	441.513	1.379	50	20	IDGD	
COc1cc(C)c(S(=O)(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1Cl	788491451	CAGUKFPYYRFCJX-UHFFFAOYSA-N	439.925	1.673	50	20	IDGD	
CN(NS(=O)(=O)c1cccnc1Cl)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	788917686	SFAPEDJUASRWKZ-UHFFFAOYSA-N	433.918	1.533	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1nc2c(s1)CCC2	789727598	WKDIPWMGEXFDKE-UHFFFAOYSA-N	437.547	1.790	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@@H]2CCC3(CCCCC3)O2)c1	790631346	DFWQWQQKSVVXFF-INIZCTEOSA-N	438.550	1.763	50	20	IDGD	
CNS(=O)(=O)c1cc(NC(=O)C(=O)NNc2cccc(F)c2[N+](=O)[O-])ccc1C	790993296	DOQSESWHLAMGAT-UHFFFAOYSA-N	425.398	1.032	50	20	IDGD	
O=C(NNc1cccc(F)c1[N+](=O)[O-])[C@@H]1CN(Cc2nc(O)c3ccccc3n2)CCO1	791067484	VRSBPEVAVUACLR-INIZCTEOSA-N	442.407	1.727	50	20	IDGD	
CC(=O)NC[C@H]1CCn2ncc(C(=O)NNC(=O)[C@@H](C)Oc3cccc(C)c3C)c2C1	792736675	OLGNGJOLRCJOHJ-WBVHZDCISA-N	427.505	1.427	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)[C@@](C)(O)CN3C(=O)NC4(CCCC4)C3=O)cc2C1	792828782	XOVVFONBBJJXFV-YUNKPMOVSA-N	448.545	1.250	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)[nH]n1)C(=O)Nc1cccc(Br)n1	793023529	PTGVKKHYPZGIHD-UHFFFAOYSA-N	429.234	1.634	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)c(C)cc1F	793354529	XUFWMDPYAZMGRN-UHFFFAOYSA-N	437.449	1.486	50	20	IDGD	
O=C(c1cc(F)ccc1-n1cccn1)N1CCN(S(=O)(=O)CBr)CC1	793775296	KZXMCBPEAAWURC-UHFFFAOYSA-N	431.287	1.451	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)Cc2c[nH]c3ccccc23)c(OC)c(C)c1OC	796989543	GVYLJCHYPAYEJC-UHFFFAOYSA-N	440.456	1.831	50	20	IDGD	
C[C@H]1C[C@@H](C)O[C@H]1C(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	800320131	RNWJEHRFJASVPQ-QMTMVMCOSA-N	431.514	1.740	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)[C@@H](C)S(=O)(=O)C2CCOCC2)c(OC)cc1Cl	802082310	QEMKERFIHSFGMR-SNVBAGLBSA-N	449.913	1.492	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1ccc(C#N)cc1)C(=O)NNC(=O)Nc1ccc(N(C)C)cc1	802123617	PHWBEXJLFYISNC-CYBMUJFWSA-N	430.490	1.144	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@@H]1CC(C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)=NO1	802428046	LPUBKLCFACGKMP-ZDUSSCGKSA-N	444.448	1.009	50	20	IDGD	
CCOC(=O)[C@@H](C)NC(=O)c1ccc(NC(=O)NNc2ccc(-n3ccnc3)nn2)cc1	806311470	RGKULLJHZFZMOG-CYBMUJFWSA-N	438.448	1.492	50	20	IDGD	
CN(C)S(=O)(=O)C[C@@H](NC(=O)NNC(=O)c1cc(-c2ccccc2)on1)C(F)(F)F	806565584	PENDFNUNCJDLLD-CYBMUJFWSA-N	449.411	1.108	50	20	IDGD	
CC1(C)CC(=O)c2cc(NC(=O)C(=O)NNC(=O)CNC(=O)c3cccs3)ccc2O1	807004289	KHWKWQYKOFJKPJ-UHFFFAOYSA-N	444.469	1.008	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)C3CCN(CC(F)F)CC3)CC2)cc1	807093135	JPTKFKWTPWDRFM-UHFFFAOYSA-N	437.535	1.237	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ncccc2F)c(I)c1	807301794	IQXCRQZPCQSLBO-UHFFFAOYSA-N	430.177	1.916	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)C(=O)Nc1cc(C2CC2)nn1-c1ccccc1	807428875	IZUGEUIONBTAER-UHFFFAOYSA-N	429.444	1.807	50	20	IDGD	
CC(C)N(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1	811337660	RPGJXBYQPVPZEV-UHFFFAOYSA-N	433.486	1.562	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)Nc2ccccc2CN2C(=O)CNC2=O)cc1	812313974	URHBHDVJSHFWJO-UHFFFAOYSA-N	446.489	1.137	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)C(=O)N3CCN(c4ccccc4)CC3)n[nH]2)c1	812534627	PJXKWUKKTUOKPA-UHFFFAOYSA-N	446.511	1.803	50	20	IDGD	
CC(=NNC(=O)CSc1nnc(O)nc1O)c1ccc(OCc2nccn2C)cc1	814785001	WAVFBWPRZMDDRG-UHFFFAOYSA-N	429.462	1.228	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCc2nncn2C1)C(=O)Nc1cc(Cl)c(Cl)cc1Cl	815692084	IWOXALDULWIMNI-SSDOTTSWSA-N	431.667	1.587	50	20	IDGD	
CCOc1cc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)N(C)C)ccc1OC	815752494	UUZHZNYYJOCTNE-UHFFFAOYSA-N	436.490	1.426	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)CNC(=O)c1cc(-c2ccccc2)on1	817052778	PBDQIXDZYHHTMT-UHFFFAOYSA-N	443.485	1.465	50	20	IDGD	
CCOc1ccc(NNC(=O)CNC(=O)c2cccc(S(=O)(=O)N(CC)CC)c2)cc1	817889403	DXDUBNROECKGEK-UHFFFAOYSA-N	448.545	1.989	50	20	IDGD	
CCCn1c(=O)n(CCC(=O)NNC(=O)CNc2cccc(OC)c2)c2ccccc21	825801953	UMMRAZUEVIYYMD-UHFFFAOYSA-N	425.489	1.871	50	20	IDGD	
O=C([C@H]1CCCCN1C(=O)c1ccc(Br)c(F)c1)N1CC[C@H](B(O)O)C1	864234692	TZBMQOILXTULTQ-SWLSCSKDSA-N	427.079	1.658	50	20	IDGD	
COc1ccc2c(c1)C(=NNC(=O)c1cccc(S(=O)(=O)N3CCOCC3)c1)CCO2	912776440	BAGYHRSEQPKEAG-UHFFFAOYSA-N	445.497	1.633	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)CN2C(=O)N[C@@]3(C[C@@H](C)CC(C)(C)C3)C2=O)c(C)c1	913164892	XKMPIRLBVJBPAD-NPMXOYFQSA-N	443.548	2.000	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CNS(=O)(=O)c2ccc(Cl)cc2)cc1OC	913415725	WLXAKQFCBKMREJ-UHFFFAOYSA-N	427.866	1.097	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)Cc1ccc(-n2cccn2)cc1	915636264	CPYVWWQFOQVKEQ-UHFFFAOYSA-N	426.502	1.478	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)NCc2ccc(S(N)(=O)=O)s2)c(C)n1-c1ccccc1	915906237	UIKSUXSFYUACCE-UHFFFAOYSA-N	447.542	1.947	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)NCc1ccnc(N2CCN(C)CC2)c1	916390451	RCXUKOUVZKYIIV-HNNXBMFYSA-N	430.484	1.270	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)N2CCN(C(=O)C(=O)NC3CC3)CC2)c(C)n1CC(C)C	916409193	YBHPGWNCEVQCLH-UNOMPAQXSA-N	425.533	1.617	50	20	IDGD	
CCN1CCN(Cc2ccc(CNC(=O)NNC(=O)c3c(C)nc4ccccn34)cc2)CC1	916418077	ATEZFJLKLNWAIO-UHFFFAOYSA-N	449.559	1.924	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)C[C@@H]1Oc2ccccc2NC1=O	916826348	LKVKNMWHKXWJTK-HNNXBMFYSA-N	434.246	1.765	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)Nc1cccc(S(N)(=O)=O)c1	919896658	HQFISQZUXLWWAF-UHFFFAOYSA-N	441.535	1.559	50	20	IDGD	
CCc1c(C(=O)NNC(=O)CN2CCCC2=O)cnn1-c1ccc(Br)cc1	920433603	WQNZCIZQPUGNKB-UHFFFAOYSA-N	434.294	1.581	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)Nc2ccc(CN3C(=O)CNC3=O)cc2)cc1	920940415	IMGLJQRXMQCYMX-UHFFFAOYSA-N	425.445	1.533	50	20	IDGD	
Cc1ccc(OCCC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c(Br)c1	921303024	FXVGZZUAMONXDF-UHFFFAOYSA-N	445.277	1.963	50	20	IDGD	
CC(=NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)c1ccnc(C)n1	1255778440	CPUSBSVPDLCFNR-UHFFFAOYSA-N	431.518	1.279	50	20	IDGD	
COc1ccc(S(=O)(=O)CCC(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)cc1	1319482194	IMAGXDHNUCBIRH-UHFFFAOYSA-N	448.469	1.999	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1cnn(-c2ccncc2)c1C	1320282443	VLFWYIDNHBWIAW-UHFFFAOYSA-N	427.490	1.252	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(C(F)F)no2)C1	1777705256	YFZLEDTXPVHKHM-UCMVZMLTSA-N	435.855	1.994	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4c(c3)n(C)c(=O)n4C)C2)C1	1777864952	QXMKJRIFTUQTBR-ZHRRBRCNSA-N	448.951	1.728	50	20	IDGD	
CCC[C@H](C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2)n1cccc1	1778041338	CRHBZEMJXGERCJ-NEYJZJCJSA-N	425.957	1.943	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ncccc3Br)C2)C1	1779652432	CSXNBQPNKAKFOI-CXAGYDPISA-N	446.729	1.541	50	20	IDGD	
CCc1cc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](Br)CC)CCO3)nn1C	1779832184	CDAQERBSEMCSDM-RDTXWAMCSA-N	427.343	1.600	50	20	IDGD	
Cn1ccc(=O)cc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@](C)(Cl)CCl)C1	1780715222	OSFBWBQSOOHVJL-LSTHTHJFSA-N	444.359	1.749	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)c3[nH]nc4ncccc34)CCO2)C1	1781226795	ACQSIXVPHCRPHG-ZWKOTPCHSA-N	426.304	1.638	50	20	IDGD	
O=C(COc1ccc(F)cc1)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781328651	VJBZZEAYWAEZEP-DOTOQJQBSA-N	433.249	1.725	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2)c1cnc2ccc(F)cn12	1781381789	XGFFHIYBMBVUPL-RZQQEMMASA-N	438.887	1.201	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@]1(C)CCCN1)C2	1781903217	PFWYVBMDDOSEIW-OHDICMOHSA-N	430.387	1.816	50	20	IDGD	
O=C(Cc1ccc(F)cc1F)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2	1781917491	BUJLCVWMMGVKBC-MBOZVWFJSA-N	430.879	1.621	50	20	IDGD	
CCCC(=O)N[C@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](Cl)COC)C1	1782176214	YGROYVDOCQUKID-UIVXKWKOSA-N	431.961	1.059	50	20	IDGD	
O=C(NCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C(Cl)Cl)C1)c1cccs1	1782214543	KCXQBGVKWBCBNA-FZKQIMNGSA-N	448.372	1.796	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1782861048	GGNLMTQFFUJPSP-AJELSMBFSA-N	439.846	1.301	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3[nH]nc4ccncc34)CCO2)C1	1783347273	DXTTYQKTELISRA-FZKQIMNGSA-N	436.310	1.575	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)C3CCN(CC)CC3)CCO2)C1	1783352385	GAQRDTWUXJIHJR-LPHOPBHVSA-N	430.387	1.722	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cnn4c3OCCC4)CCO2)C1	1783353211	NPZPTIRQHHITJU-KDOFPFPSSA-N	441.326	1.283	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)Cc3ccc(OC)c(O)c3)CCO2)C1	1783867751	AEMNOHBMECFAHX-MGPUTAFESA-N	426.897	1.027	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)[C@@H](C)CNC(=O)OC(C)(C)C)CCO2)C1	1783870464	CGXFPGIMTPMYLG-MDOVXXIYSA-N	447.960	1.231	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)CCCC(=O)OC(C)(C)C)CCO2)C1	1783872071	ZYPAGOQECFDKDM-MGPUTAFESA-N	432.945	1.582	50	20	IDGD	
Cc1ccc2cc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]4C3)ccc2n1	1784092533	MNHKKBQCLNNOLH-ZULIPRJHSA-N	431.920	1.736	50	20	IDGD	
C[C@H](Sc1ccccc1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21	1784348474	HYNSHDLOGHIRRM-IAVJCBSLSA-N	426.966	1.747	50	20	IDGD	
CCC[C@H](NC(C)=O)C(=O)N1CC[C@]2(CN(C(=O)[C@@H](Br)CC)CCO2)C1	1785446374	GCPCQYHJIBDLMS-RLFYNMQTSA-N	432.359	1.295	50	20	IDGD	
Cc1[nH]nc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)CBr)C[C@@H]32)c1F	1785761546	VYUOFUKFEHVPNF-BQUFFADESA-N	431.306	1.482	50	20	IDGD	
Cc1ccc(S(=O)(=O)CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Cl)C[C@@H]32)cc1	1786607749	WFDYEDXRVWXCEX-MBGYTDRXSA-N	446.928	1.283	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(-n4cnnc4)cc3)[C@H]2C1	1786769160	CKMDKNGJVFSUGQ-WNHJNPCNSA-N	431.924	1.878	50	20	IDGD	
C[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)n1cccc1C=O	1786991431	BBBCQLLGQHSRHL-OTRWWLKZSA-N	440.338	1.626	50	20	IDGD	
CC1=CC[C@@H](C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)CC1	1788103610	XSWVUAYDNGRFQL-LPWQTFTOSA-N	441.532	1.025	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4n(n3)CCCO4)C[C@@H]21	1788764681	RMZMBBSWTKNGEX-ZOBUZTSGSA-N	436.585	1.110	50	20	IDGD	
COc1cc(OC)c(F)c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](O)CCl)C[C@@H]32)c1	1789237399	ZQCSOPKOYZPXKC-RMIITELYSA-N	444.887	1.036	50	20	IDGD	
Cn1cc(C(=O)NC2(c3ccc(NC(=O)c4cnccc4C(=O)NN)cc3)CCC2)cn1	1789521228	NYYQLINGGWZHDL-UHFFFAOYSA-N	433.472	1.480	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)Nc1ccc(C2(NC(=O)CCC(=O)NN(C)C)CCC2)cc1	1789644488	TUUWIKDBZZSRDU-OAHLLOKOSA-N	429.521	1.184	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)C[C@@H]21	1789859960	FUHZQAVWXNAQTD-RMRDIRSESA-N	446.935	1.776	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21	1790991360	OUETVMJLIMMRRO-IHRRRGAJSA-N	448.358	1.276	50	20	IDGD	
CC1CCN(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](C)Br)[C@H]3C2)CC1	1791055579	XSUXSJSZIHDANF-QAETUUGQSA-N	430.387	1.481	50	20	IDGD	
Cc1n[nH]c(C)c1CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)Br)[C@H]2C1	1791061597	YJENPQKQWAFAGK-NZBMOFRJSA-N	427.343	1.332	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc4c(c3)CCC4)C[C@@H]21	1791252441	MENDOQAPFHXSQY-BURNTYAHSA-N	434.964	1.951	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1ccc(C2(NC(=O)[C@H](N)c3ccccn3)CCC2)cc1	1791599354	INDKUZQDACOMKY-OAQYLSRUSA-N	438.532	1.589	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCCc1ccccc1F)c1ccc(B(O)O)cc1	1793087190	YRGYTXCQEMOXEX-WKCHPHFGSA-N	438.308	1.780	50	20	IDGD	
CC(C)c1csc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)n1	1794549336	XPBRBZZJBZHQPJ-BTTYYORXSA-N	442.545	1.831	50	20	IDGD	
COc1ncc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)CBr)C3)cc1C	1794983192	WXLSDVHRGSSEDM-DMRZNYOFSA-N	440.338	1.633	50	20	IDGD	
C[Si](C)(C)c1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)co1	1796188680	IOCAAXKIOASAAP-REPLKXPHSA-N	440.381	1.070	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)c1cccc2c1CCCC2	1796190556	LMLLMRRGMZEWGA-WKCHPHFGSA-N	432.329	1.811	50	20	IDGD	
CCCOc1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)cc1	1796191644	JBJDDIUTDGNTGS-WKCHPHFGSA-N	436.317	1.721	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)c1ccccc1OC(F)F	1796192602	KVFATDMLSYHYHG-BJWYYQGGSA-N	444.243	1.533	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(C)(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Cl)C1	1796365464	SIPVJVLOZUQLII-XJFOESAGSA-N	433.908	1.367	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc2c(cnn2C)c1	1797629735	LIYMOIODAKAZCU-BCDXTJNWSA-N	426.521	1.198	50	20	IDGD	
COc1nccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Br)c1F	1799346233	LSTMKCXXQABXHV-OTMMVIPVSA-N	434.237	1.123	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CCc3ccccc31)C2)[C@@H](F)Br	1799352316	PQRQZAMUAGRJQZ-IMPMIVQMSA-N	425.298	1.997	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3cc(F)c(F)cc3[nH]1)C2	1800977225	UWVIDXXGUVMWPR-YFQWEKLQSA-N	441.862	1.903	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCc1c[nH]c2ncccc12	1802067830	PFEFXNMHGQEAJG-LJGDNWOOSA-N	449.349	1.869	50	20	IDGD	
CCNC(=S)NCC(=O)N1CC[C@@H](CNC(=O)C(C)(C)CCl)[C@@H]1c1cccnc1	1802904906	PANOGQPYJHOJGG-RDJZCZTQSA-N	440.013	1.836	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cc3cccnn3c2)[C@@H]1c1cccnc1)[C@H](O)CCl	1803148851	XXXLMVCROIGMQS-KFKAGJAMSA-N	427.892	1.649	50	20	IDGD	
Cn1ncc(C(=O)N2CCCC3(CCN(C(=O)[C@@H](O)CCl)CC3)C2)c1C(F)(F)F	1807393668	ISAMBGKVWIPCQT-ZDUSSCGKSA-N	436.862	1.883	50	20	IDGD	
O=C(c1ccc(O)c(F)c1)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1	1809979832	BRTRFINXWHKARE-UHFFFAOYSA-N	440.280	1.370	50	20	IDGD	
CC1(C(=O)N2CC[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)CCC1	1810293743	GTEXMVRMINLXHP-LPHOPBHVSA-N	436.516	1.590	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)N1CC[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]1c1cccnc1	1810545645	BWNNURIGJVHBBO-OXFYSEKESA-N	432.597	1.630	50	20	IDGD	
O=C(CCBr)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)n3)C2)CC1	1810887574	JDRRTWLKEASTFL-UHFFFAOYSA-N	427.299	1.518	50	20	IDGD	
CN(C)c1ccc(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)cn1	1811060042	KOXVYQJRGVKMNG-VDZJLULYSA-N	431.924	1.462	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)Cc2nnc(C)s2)[C@@H]1c1cccnc1	1813030802	LMMPSGVCRBSGEY-RLFYNMQTSA-N	437.953	1.744	50	20	IDGD	
C[C@H](CBr)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CC[C@@H](N)C(N)=O)[nH]n1	1814781087	WAGKHAVMXZEHOK-WZRBSPASSA-N	443.346	1.026	50	20	IDGD	
Cc1cc2nnc(C(=O)N3CCCC[C@H]3c3cc(NC(=O)[C@H](O)CCl)n[nH]3)c(C)n2n1	1814870746	BMCZMFVFJDCUEN-UONOGXRCSA-N	446.899	1.370	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1	1815337208	OPAOERWCWNDNLO-UONOGXRCSA-N	435.742	1.456	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](O)CCl)CC2)c1ccc2c(c1)OCCO2	1817977857	MJDWCFDIVCYOEV-AAEUAGOBSA-N	437.905	1.740	50	20	IDGD	
Cc1nccnc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1	1819955562	LVYJYYXRJCJNSU-HNNXBMFYSA-N	428.497	1.187	50	20	IDGD	
O=C(Nc1cccnc1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)C(Cl)Cl)CC2	1820052120	MOBVGQBXXYWWST-MRVPVSSYSA-N	428.301	1.893	50	20	IDGD	
CC(C)CNC(=O)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](F)Br)n[nH]1	1820931842	AHGVUQPSLYOOIM-DGCLKSJQSA-N	432.294	1.865	50	20	IDGD	
O=C(O)CSCC(=O)N[C@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1	1823014246	RBLAHTDEJFUTHN-KGFZYKRKSA-N	440.316	1.563	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)Cc1cc(C)n(C)n1)CC2	1825995168	UIGZFZPJLONJLN-AAEUAGOBSA-N	425.942	1.594	50	20	IDGD	
CC(C)O[C@@H](C)C(=O)N[C@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1	1826088078	RDWZUKFUMRSUEB-STQMWFEESA-N	425.555	1.242	50	20	IDGD	
Cc1cc(C)nc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)c1	1827052877	LHKNVGVFGVWCNC-QHCPKHFHSA-N	449.360	1.925	50	20	IDGD	
O=C(CC[C@H]1CCOC1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827054405	DKUWGIKIHZCGLB-AVRDEDQJSA-N	442.365	1.416	50	20	IDGD	
C[C@@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1)n1cccn1	1827055089	PNUVLWACUBUKFC-LAUBAEHRSA-N	438.337	1.057	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)CCc2ccc[nH]2)CC1	1827111426	LADXFJIMKJDQNY-FQEVSTJZSA-N	431.581	1.940	50	20	IDGD	
Cc1cnn(CC(=O)N2CCCC[C@@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)c1	1827233579	PTLZPULXVGAWHI-LJQANCHMSA-N	432.569	1.184	50	20	IDGD	
Cc1cccnc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)CBr)CCO2	1830535429	NVPLEFZHDGXRQJ-BEFAXECRSA-N	440.338	1.491	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C=C/c3ccco3)C2)C1	1830536145	YVQHENGLMMMDDX-IHMJFIQFSA-N	441.322	1.780	50	20	IDGD	
C[C@@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)[C@@H]3CCOC3)CC2)CC1	1833266258	XCFPMNFBJWYFTN-LSDHHAIUSA-N	430.387	1.626	50	20	IDGD	
Cn1nc(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](F)Br)CC3)CC2)cc1O	1833944817	SIUBBZOMTWEUHO-OAHLLOKOSA-N	446.321	1.001	50	20	IDGD	
Cc1cccc(CC(=O)N2CCOC[C@@]3(CN(C(=O)CCBr)CCO3)C2)c1	1834822203	DIWFWXUTIRFTPK-HXUWFJFHSA-N	439.350	1.779	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)C(Cl)Cl)CC2)CC1)c1cc(O)nc(O)c1	1834988097	DBQDAOZRWLRPKR-UHFFFAOYSA-N	431.320	1.482	50	20	IDGD	
Cc1c(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)nc2ccccn12	1835309203	BMYWOAAMJYPTPT-SFHVURJKSA-N	447.967	1.428	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3csc(N)n3)CCO2)C1	1835796658	BDLKBABCCRGAMR-JKSUJKDBSA-N	437.349	1.032	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC1CCN(C2CCN(C(=O)Cc3cnccn3)CC2)CC1	1835834721	HCTOJDASKFSMQN-UHFFFAOYSA-N	433.629	1.442	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1)c1cc(O)no1	1835976367	YBNLZCPACHAOAQ-CQSZACIVSA-N	433.278	1.256	50	20	IDGD	
CC(=O)N(C)[C@@H](C)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](F)Br)CC2)CC1	1836412304	DCWKEDQEAJHQDI-BLLLJJGKSA-N	449.365	1.115	50	20	IDGD	
C[C@H](C(=O)N1CCC(N2CCC(NC(=O)[C@@H](F)Br)CC2)CC1)n1cccn1	1836414378	HGVMJYUNDOEILH-CZUORRHYSA-N	444.349	1.706	50	20	IDGD	
O=C([C@H](O)CCl)N1CCC(OC2CCN(C(=O)[C@@H]3CNc4ccccc43)CC2)CC1	1836716913	XMWQERVWOPDBBC-UYAOXDASSA-N	435.952	1.794	50	20	IDGD	
O=C(Cc1cnccn1)N1CCC(OC2CCN(C(=O)[C@H](F)Br)CC2)CC1	1836775186	HNOTYTKVLDIHKI-KRWDZBQOSA-N	443.317	1.708	50	20	IDGD	
C[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1)N1CSCSC1	1837573009	SRZSTHSYNGGZIX-XJKCOSOUSA-N	441.978	1.020	50	20	IDGD	
CCc1cnc(C(=O)N2CCOC[C@@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)s1	1837715428	PGTSQDCTXNBTPZ-LJQANCHMSA-N	441.626	1.627	50	20	IDGD	
Cc1cnn(CC(=O)N2CCC(OC3CCN(C(=O)[C@H](F)Br)CC3)CC2)c1	1837980191	UITXMYHDXHXOFQ-KRWDZBQOSA-N	445.333	1.881	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCC(OC2CCN(C(=O)Cn3ccnn3)CC2)CC1	1837981994	JIWPILKWCLGYHW-GOSISDBHSA-N	432.352	1.513	50	20	IDGD	
O=C(c1cncc2cnccc12)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1838466816	UDSLZOQKUQZVCQ-LJQANCHMSA-N	439.299	1.504	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)[C@@H]3CCNC(=O)C3)CC2)CC1	1838773494	JRZQJEWTFVUTOT-ZIAGYGMSSA-N	444.370	1.295	50	20	IDGD	
CN1CCC(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)CC1	1839150106	ZIRNJGXYKJCLBX-OALUTQOASA-N	436.380	1.021	50	20	IDGD	
Cc1[nH]nc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)c1F	1839151279	MLUARMTVFVEQKT-SJORKVTESA-N	437.299	1.164	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)ccc1O	1839201751	IFJIJRQIDKQDTB-MAUKXSAKSA-N	445.285	1.461	50	20	IDGD	
CC(C)C1(C(=O)N2CCOC[C@@]3(CN(C(=O)[C@H](F)Br)CCO3)C2)CCC1	1839203661	RKKFWVZBKYJSEH-WMLDXEAASA-N	435.334	1.960	50	20	IDGD	
O=C1Cc2cccc(C(=O)N3CCO[C@@]4(COCCN(C(=O)C(Cl)Cl)C4)C3)c2N1	1839574628	UMXJQQTTYBLIBN-IBGZPJMESA-N	442.299	1.055	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CCCCO3)C2)C1	1839962045	RTEAGBIFZPEIJX-DAYGRLMNSA-N	433.343	1.185	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@]1(C)C(=O)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1	1841350329	VPUHNAIGVKADLA-KUHUBIRLSA-N	429.945	1.579	50	20	IDGD	
COc1c(Br)cccc1C(=O)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1	1841352911	TYZLDMFAKIUXKP-ZDUSSCGKSA-N	431.714	1.874	50	20	IDGD	
Cn1nncc1C(=O)N1CCCC12CN(C(=O)[C@H](Br)Cc1ccccc1)C2	1842134825	XGWMRFAXOHSKPI-OAHLLOKOSA-N	432.322	1.638	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)C(=O)NCC(C)C)C2	1844692664	WCOJLWJQRHYBTR-UHFFFAOYSA-N	446.460	1.109	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1O)C2	1845162931	VXTVYYVCKKJXFF-HRCADAONSA-N	443.972	1.825	50	20	IDGD	
O=C1CSc2ncc(C(=O)N3CCCC34CN(C(=O)CCBr)C4)cc2N1	1845669219	APHMGJVYGXYTFY-UHFFFAOYSA-N	439.335	1.728	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC2(CCCN2C(=O)Cn2cccc([N+](=O)[O-])c2=O)C1	1845825201	CYTKATHSMCPCOQ-LBPRGKRZSA-N	441.282	1.133	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)CCS(=O)(=O)c1ccccc1)C2	1846361489	XRHCKTZVACFCGG-MRXNPFEDSA-N	428.938	1.308	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@H]2CCC(=O)N2C(=O)OC(C)(C)C)C1	1846485944	ZUJGYLFGTYGFOF-KBPBESRZSA-N	443.928	1.370	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)c2cc(F)c(F)c(Cl)c2)C1	1846871565	PHLNITIACDYREN-UHFFFAOYSA-N	434.635	1.429	50	20	IDGD	
C[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl	1847558415	DJVSUXAVFXRKBG-UVPYHEFZSA-N	429.945	1.291	50	20	IDGD	
O=C(COc1ccc(Cl)c(F)c1)N1CC[C@H]2[C@@H]1CCN2C(=O)c1ccc(B(O)O)cc1	1847770085	UKEPLXQGDRYOFE-OALUTQOASA-N	446.671	1.053	50	20	IDGD	
CC(C)N(C)CC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1848099098	WGBGKKRHNHSRQO-JYJNAYRXSA-N	430.977	1.661	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)Cc1ccc(Br)cn1	1848243960	CINRIUDJRASMFE-KKUMJFAQSA-N	430.730	1.842	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(Br)cc2F)c1	16594213	NCHDXCYAZXTBAZ-UHFFFAOYSA-N	444.282	1.913	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)CN(C)C2=NS(=O)(=O)c3ccccc32)cc1	23786385	DSGCLNRYKCQXEB-UHFFFAOYSA-N	432.527	1.315	50	20	IDGD	
Cc1cc(-n2c(C)cc(C(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)c2C)no1	26745618	KOJYNTUABHYYMN-UHFFFAOYSA-N	445.501	1.716	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)NNC(=O)CNC(=O)c3cccs3)cc2C1	725873200	UZJJYYBOGULFNN-JTQLQIEISA-N	435.531	1.340	50	20	IDGD	
COc1ccc([C@@H](CNC(=O)NNC(=O)CNC(=O)c2ccco2)N2CCCCC2)cc1	726083098	FKUVECKCSDVBHU-GOSISDBHSA-N	443.504	1.576	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)CSc1nnc(-c2cccs2)n1C	726804097	SMJMZSGCJDFIES-UHFFFAOYSA-N	433.515	1.871	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)N[C@@H](CN1CCN(C)CC1)c1ccccc1	727843395	JGZDZFUZOWPMTF-IBGZPJMESA-N	441.532	1.393	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)Cc3c[nH]c4ccccc34)cc2)CC1	728213491	MHPIPQIKKCUCKE-UHFFFAOYSA-N	427.530	1.790	50	20	IDGD	
CCOc1ccccc1[C@@H](CC(=O)NNC(=O)[C@H]1COc2ccccc2O1)NC(C)=O	728230008	CQHKDXVRYAPGNC-OXQOHEQNSA-N	427.457	1.640	50	20	IDGD	
Cc1nc(-c2ccccc2)[nH]c1C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	728727400	LTKHGXIMCHPQLW-QGZVFWFLSA-N	436.424	1.529	50	20	IDGD	
Cn1ccnc1SCc1ccc(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)o1	728890552	VSJUYBBHTPGLRB-UHFFFAOYSA-N	441.517	1.773	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)Cc3c(C)nc4c(c(O)nn4C)c3C)n[nH]2)cc1	729520547	OBXGXDYMPDOTBF-UHFFFAOYSA-N	433.472	1.993	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)N(C)CC(=O)NN=c2cc[nH]c3ccccc23)cc1	730287702	PGOROFPACARJJE-UHFFFAOYSA-N	427.486	1.379	50	20	IDGD	
COc1ccccc1C[C@@H](C)CC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	730517641	YMBSIMDCALTCLA-OAHLLOKOSA-N	433.530	1.975	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H]1CNC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	730820873	KCKSSSQQBDTZSH-HNNXBMFYSA-N	430.469	1.006	50	20	IDGD	
COc1ccc(Cn2cc(C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)cn2)cc1	731578529	MCPAVQPWINCSMO-UHFFFAOYSA-N	435.488	1.408	50	20	IDGD	
CC(C)NC(=O)Nc1ccc(C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1	732330543	VCZNDKVOLIEHRG-UHFFFAOYSA-N	443.416	1.743	50	20	IDGD	
COc1cccc(C[C@@H](C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)n2nnnc2C)c1	733107056	UOMSMCLACRPMIH-FQEVSTJZSA-N	446.471	1.421	50	20	IDGD	
O=C(CCCOc1ccc(Cl)cc1Cl)NNC(=O)NCCN1C(=O)CCC1=O	733847636	DUHAMUIMSWMQHZ-UHFFFAOYSA-N	431.276	1.632	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2cc(C(=O)NNc3cnccn3)ccc2Cl)C[C@H](C)O1	734245492	IIYHAFOBHCCWPO-RYUDHWBXSA-N	425.898	1.685	50	20	IDGD	
Cc1ccccc1[C@@H](C)CC(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	735117982	LONCHGXDLHKPDI-KRWDZBQOSA-N	431.562	1.963	50	20	IDGD	
CC(=O)NCC(=O)N1CCc2cc(C(=O)NNC(=O)Cc3ccc(Cl)cc3)ccc21	735647706	ZYQLBSZHGWNKTM-UHFFFAOYSA-N	428.876	1.369	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)C[C@H]2CCOC2)c1	739676323	SVVSYWJCCVLNQO-CQSZACIVSA-N	433.486	1.684	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)[C@@H]2CN(Cc3ccccc3)CCO2)cc1	741174039	YZTUULBWPJCPLK-UTKZUKDTSA-N	427.501	1.901	50	20	IDGD	
CC(=O)N[C@H](C)c1ccc(S(=O)(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)s1	743268578	ZEZYTMQLSYKMGO-MRVPVSSYSA-N	428.448	1.182	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NC[C@H](c2ccc(C)cc2)N(C)C)c2ccccc2c1=O	743334338	UVBIDHYPWMHBDI-LJQANCHMSA-N	436.516	1.972	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)N[C@@H]1CC(=O)N([C@H]2C[C@H]2c2ccccc2)C1	743702308	OKJWSSHERDIHJZ-SQNIBIBYSA-N	436.468	1.559	50	20	IDGD	
CCCS(=O)(=O)Nc1ccccc1C(=O)OCC(=O)NNC(=O)c1cccc(C)c1	744828770	KGXDOVYHNMAATG-UHFFFAOYSA-N	433.486	1.765	50	20	IDGD	
C[C@@H]1CN(c2ccc(CNC(=O)NNC(=O)c3cc([N+](=O)[O-])ccc3O)cn2)CCO1	745466908	FQLGWPBZJOONQO-GFCCVEGCSA-N	430.421	1.065	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)COc1ccccc1-c1ccccc1)CN1CCN(C)CC1	745862722	NKWLUNCCITWMDY-IBGZPJMESA-N	439.560	1.946	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)NCC2(N3CCCCC3)CCN(C)CC2)cc1C	745878384	NOKHEJVQSSNVQP-UHFFFAOYSA-N	444.580	1.523	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F)[C@@H]1COc2ccccc2O1	746590585	AXTXEJNNEABRDW-ZDUSSCGKSA-N	447.347	1.763	50	20	IDGD	
Cc1cc(C)c(S(=O)(=O)NCCC(=O)NNC(=O)Cc2cn3ccccc3n2)c(C)c1	746637418	NYQKOYYPBXMIDO-UHFFFAOYSA-N	443.529	1.318	50	20	IDGD	
O=C(CCOc1ccccc1)NNC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(F)cc2)C1	747180610	LZUUMWWXAJJVHR-MRXNPFEDSA-N	449.504	1.843	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)c1cc(Br)cc(S(N)(=O)=O)c1C	747199707	AAKAMOLFKADPGH-UHFFFAOYSA-N	426.292	1.788	50	20	IDGD	
CCN1CCN(c2ccc(F)cc2[C@@H](C)NC(=O)NNC(=O)[C@H](C)OCCOC)CC1	748628023	PCJPZICSFJSFQU-CVEARBPZSA-N	439.532	1.411	50	20	IDGD	
Cc1nc(-c2ccccn2)nc(NNC(=O)c2cnc3c(c2C)c(=O)n(C)c(=O)n3C)c1C	749239186	CUQVFFLVMMTGIH-UHFFFAOYSA-N	446.471	1.166	50	20	IDGD	
COCCS(=O)(=O)c1ccc(C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc1	749719251	ODVJGRYZDMBLQK-UHFFFAOYSA-N	444.469	1.073	50	20	IDGD	
COc1cc(OCC(=O)NNc2nc(Br)cn3ccnc23)ccc1[N+](=O)[O-]	750248843	XICOTUBGJNBGGU-UHFFFAOYSA-N	437.210	1.931	50	20	IDGD	
CC(C)NC(=O)CN(C)CC(=O)NNC(=O)Nc1ccc(Br)cc1Cl	750305312	FMQJXRXYJAVWRU-UHFFFAOYSA-N	434.722	1.712	50	20	IDGD	
Cc1nc(SCC(=O)NNC(=O)CNC(=O)c2ccco2)c2c(C)c(C)sc2n1	751206999	PHKLIBJNDFSPED-UHFFFAOYSA-N	433.515	1.879	50	20	IDGD	
CCSc1ccc(CC(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)cc1	752621428	GALQJSRTQBPDHQ-UHFFFAOYSA-N	449.602	1.816	50	20	IDGD	
CCn1cc([C@H]2C[S@](=O)CCN2C(=O)NNC(=O)c2cc(Br)c[nH]2)cn1	753035446	ZIZVWRDDKNNFNK-ZBSNKRKSSA-N	443.327	1.154	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H]2COc3cc(F)cc(F)c32)c1	753420464	RCNDUHBOABWYHX-CQSZACIVSA-N	440.428	1.293	50	20	IDGD	
Cc1oc(C(=O)NNC(=S)Nc2ccc(N(C)C)cc2)cc1S(=O)(=O)N(C)C	754205464	SVVPXLDHHXWTLQ-UHFFFAOYSA-N	425.536	1.536	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)[C@@H]2CN(Cc3nc(O)c4ccccc4n3)CCO2)c(O)c1	754424587	QCDISTNDNVJHNC-SFHVURJKSA-N	437.456	1.011	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2ccc(C#N)c(Cl)c2)cc1	755426101	ZNRJTNQIQSBAKL-UHFFFAOYSA-N	435.893	1.994	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)Nc1ccc(CC(=O)N2CCOCC2)cc1	755861922	JRAQOKJIZSBIQP-UHFFFAOYSA-N	442.472	1.328	50	20	IDGD	
CC(C)(C)c1nc(CN2CCN(CC(=O)NNC(=O)c3ccccc3Cl)CC2)no1	755946415	JIFVXQSVKUXDSS-UHFFFAOYSA-N	434.928	1.599	50	20	IDGD	
COc1ccc(C(F)(F)C(=O)OCC(=O)NNC(=O)c2ccc(OC)c(OC)c2)cc1	756328272	MPTCFHNUOIPUHZ-UHFFFAOYSA-N	438.383	1.809	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Nc2cnn(CC(=O)NC3CC3)c2)ccc1OC(C)C	756796411	OJCRCVZPRBXJRU-UHFFFAOYSA-N	430.465	1.424	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)c1cncc(N2CCOCC2)c1	756866582	ZFONWHILOVZIEL-UHFFFAOYSA-N	435.278	1.521	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)c2cc(Cl)ccc2O)ccc1S(=O)(=O)N(C)C	757775922	NFUKEZMXGFZIJX-UHFFFAOYSA-N	442.881	1.771	50	20	IDGD	
CNC(=O)Cn1nc(NC(=O)NNC(=O)c2cc(OC)ccc2Br)cc1C	757822305	HXKUZUSUJUOEGH-UHFFFAOYSA-N	439.270	1.175	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc(Br)cc2c1OCC2)c1ccc2c(c1)OCO2	758148066	NTMZBEDCBAGISE-UHFFFAOYSA-N	441.259	1.736	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCCN1C(=O)OCc1ccccc1)C(=O)Nc1ccccn1	758818875	BGVLSGSNJKKQFF-INIZCTEOSA-N	425.445	1.359	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)c2ccc(Br)c(S(C)(=O)=O)c2)nc1	759739686	RRESBRZNDIBFHB-UHFFFAOYSA-N	428.264	1.791	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCCC(=O)NNC(=O)CCc1ccccc1O	760815110	ZINBHGISRBRXMX-INIZCTEOSA-N	448.520	1.378	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCC([C@@H](O)c2nccn2C)CC1	760876784	TWRIWJOXPGBZRN-GOSISDBHSA-N	435.912	1.289	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1ccc(C(N)=O)cc1)C(=O)NNc1ccccc1C(F)(F)F	763021420	RIGKLSDHFDCUPF-SNVBAGLBSA-N	430.408	1.614	50	20	IDGD	
O=C(NNC(=O)c1c[nH]c2ccccc12)C(=O)Nc1ccc2nc3n(c(=O)c2c1)CCC3	763534485	GQOJNZZEWLSIEY-UHFFFAOYSA-N	430.424	1.224	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(-c3nnc(C)n3C)c2)cc1OC	763551260	UUFGRUMKSBQWQP-UHFFFAOYSA-N	438.444	1.207	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)C(=O)Nc1ccc(C(=O)NC2CCCC2)cc1	763557612	CBSARKVLXHCMTQ-UHFFFAOYSA-N	438.440	1.487	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)C(=O)Nc2ccc(-n3ccnc3)nc2)c1	763596746	ZJPBCRQBGVYSHX-UHFFFAOYSA-N	436.472	1.864	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc2c(c1)CCN2C(C)=O	763680601	HBSYBXAQIZOCIB-UHFFFAOYSA-N	440.456	1.159	50	20	IDGD	
CN(C)c1ccc(NC(=O)C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1Cl	763786370	MRSYKNWGCVMFCT-UHFFFAOYSA-N	442.863	1.053	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(F)c(S(=O)(=O)NC3CC3)c2)cc1	763829566	BZFYMRRIJAJYLE-UHFFFAOYSA-N	448.476	1.229	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc([S@](C)=O)c(F)c2)c1C	763847552	DCVCIOBGTZSOSU-FZPQWHJUSA-N	435.477	1.733	50	20	IDGD	
CC(C)C(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)c1	763864431	JCCLODWFUPIZIV-ZDUSSCGKSA-N	430.436	1.974	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)CCC(=O)N3)cc1	763872643	PEDBUYDCUJALFM-CYBMUJFWSA-N	438.440	1.327	50	20	IDGD	
COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccc(C(C)=O)cc1	763878702	SXKNTMFHHZVGIH-GFCCVEGCSA-N	444.400	1.359	50	20	IDGD	
COC(=O)[C@@H]1CN(C(=O)C(=O)NNC(=O)CSc2ccc(C)cc2)c2ccccc2O1	763891925	SKMHXGWLYCBSOO-KRWDZBQOSA-N	443.481	1.202	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccc(N2CCCC2=O)c(Cl)c1	763918473	DRKICTVYBDMEDC-UHFFFAOYSA-N	432.839	1.935	50	20	IDGD	
COc1ccc(Cn2nccc2NC(=O)C(=O)NNC(=O)c2ccccc2C)c(OC)c1	763960436	OCJKCKBEKZJJQF-UHFFFAOYSA-N	437.456	1.657	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)ccc1C(=O)NC(C)C	763974705	WAALCVWFDQWYRE-UHFFFAOYSA-N	432.864	1.892	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl	763995356	QGDGBMLSOGYZML-UHFFFAOYSA-N	430.602	1.739	50	20	IDGD	
Cc1cccc(Oc2ncccc2NC(=O)C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)c1C	764001575	BFFSSPIJNPFMAB-AWEZNQCLSA-N	446.485	1.011	50	20	IDGD	
O=C(Cc1cccc2ccccc12)NNC(=O)C(=O)Nc1ncn(Cc2ccccc2)n1	764037474	XUMRBPVIEUGIGN-UHFFFAOYSA-N	428.452	1.808	50	20	IDGD	
O=C(NNC(=O)c1cccc(C(F)(F)F)c1)C(=O)Nc1ncn(Cc2ccccc2)n1	764037543	NOPXORJIWNUYBS-UHFFFAOYSA-N	432.362	1.745	50	20	IDGD	
O=C(NNC(=O)c1cccc(C(F)(F)F)c1)C(=O)Nc1cnn(Cc2ccccn2)c1	764040192	HECIFCKCKLUJKG-UHFFFAOYSA-N	432.362	1.745	50	20	IDGD	
COC(=O)C(C)(C)c1ccc(NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)cc1	764155384	ZTSUZBKPOOWMJM-QGZVFWFLSA-N	425.441	1.227	50	20	IDGD	
COC(=O)CSCc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(C#N)cc2)c1	764176395	DFUHYSXQVZOORN-UHFFFAOYSA-N	426.454	1.364	50	20	IDGD	
Cc1cccc(NC(=O)C(=O)NNC(=O)COc2ccccc2O)c1C(=O)N1CCCC1	764276876	DNDLQUKVWIIWNP-UHFFFAOYSA-N	440.456	1.102	50	20	IDGD	
CCn1ncc2ccc(NC(=O)C(=O)NNC(=O)c3cc(Br)ccc3O)cc21	764279627	AAIDWUQDGDTNGE-UHFFFAOYSA-N	446.261	1.924	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)C(C)(C)Oc2ccc(C#N)cc2)cc1	764533151	ITRMSQIYIOKUML-UHFFFAOYSA-N	444.513	1.492	50	20	IDGD	
CC(=NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1)c1ccc2c(c1)NC(=O)CO2	764828615	SGUDCQWQKGDSTQ-UHFFFAOYSA-N	435.484	1.316	50	20	IDGD	
Cc1nc2[nH]n(C)c(=O)c2c(C)c1CCC(=O)NNC(=O)CSc1ccccc1O	765247984	MJULEQJNBJELEG-UHFFFAOYSA-N	429.502	1.456	50	20	IDGD	
NC(=O)c1ccc(SCC(=O)NNC(=O)CSc2ccccc2O)c([N+](=O)[O-])c1	765251464	ILDZKYTWLQFOMQ-UHFFFAOYSA-N	436.471	1.431	50	20	IDGD	
Cc1ccc(C)c(S(=O)(=O)N2CCN(C(=O)CCC(=O)N3CC=C(C#N)CC3)CC2)c1	767159403	CSBGQNHCLCFREN-UHFFFAOYSA-N	444.557	1.599	50	20	IDGD	
COc1ccc2c(c1)[C@@H](NC(=O)NNC(=O)c1csc(N3CCOCC3)n1)CCO2	767300063	ZDSRXPAMWXDRLW-AWEZNQCLSA-N	433.490	1.456	50	20	IDGD	
COc1ccccc1-c1nnc(SCC(=O)NNC(=O)Cc2ccccc2C)n1N	767811792	VWQYLDWBOLOQMF-UHFFFAOYSA-N	426.502	1.458	50	20	IDGD	
COc1cc(O)c(C=NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1OC	768356751	AKBIXAFCWIMYJV-UHFFFAOYSA-N	433.486	1.958	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NCc1nc(COc2ccccc2)n[nH]1	771374693	BBITUOSIKHIVPY-CYBMUJFWSA-N	428.424	1.821	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)c1cn(C)c2ccccc12	771869828	ZHHCHORXDJTFIU-CQSZACIVSA-N	428.514	1.993	50	20	IDGD	
CC(=O)c1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)n(C)c1	772190700	MOBJPMYXVJOQBI-UHFFFAOYSA-N	432.502	1.477	50	20	IDGD	
CC(C)[C@H](C(=O)NNC(=O)[C@@H](C)Oc1ccc2ccccc2c1)N1CCCS1(=O)=O	772630780	MJGTZLOXCDPZFM-DNVCBOLYSA-N	433.530	1.815	50	20	IDGD	
COc1ccccc1C(=O)NCC(=O)NNC(=O)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	774270380	INNFKRWGPWMSKA-CQSZACIVSA-N	434.493	1.220	50	20	IDGD	
CCN(C)C(=O)CNC(=O)/C(C#N)=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	775953328	GXYLFAIFWYTHQK-GDNBJRDFSA-N	442.907	1.580	50	20	IDGD	
COc1cccc(COCC(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)c1	776204730	FCABTBDUSATTEB-UHFFFAOYSA-N	436.509	1.848	50	20	IDGD	
CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)NNc1cccc(S(C)(=O)=O)c1	776541196	JSBBWMGTDGMCHO-IBGZPJMESA-N	432.477	1.901	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)NNC(=O)[C@H]2COc3ccccc3O2)c2ccccc12	777906524	BSBYMRBKLFFPJN-LJQANCHMSA-N	441.465	1.948	50	20	IDGD	
COc1ccc(Cn2ccc(NC(=O)C(=O)NNC(=O)CCc3ccccc3O)n2)cc1	778709188	AJLACLWTXYIEJS-UHFFFAOYSA-N	437.456	1.364	50	20	IDGD	
CCOc1cc(/C=C/C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)ccc1O	780848644	QVIDNXHJTWRQFG-PKNBQFBNSA-N	433.486	1.516	50	20	IDGD	
COc1ccc(CN2C[C@@H](C(=O)NNC(=O)CCNC(=O)OC(C)(C)C)CC2=O)cc1	780973854	IBZNUVRZLUKXRK-HNNXBMFYSA-N	434.493	1.106	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)C(=O)c3cc(F)ccc3C)CC2)cc1	782016127	YANFDYKMPZARAP-UHFFFAOYSA-N	426.492	1.590	50	20	IDGD	
O=c1c(Cl)c(N2CCN(S(=O)(=O)CBr)CC2)cnn1-c1ccccc1	782403632	AMFZACZDRVSXJO-UHFFFAOYSA-N	447.742	1.690	50	20	IDGD	
COc1ccc(Sc2ccc(NC(=O)C(=O)NN[C@@]3(C)CCS(=O)(=O)C3)cc2)cc1	783425035	HIBMWEWBGNPOEI-FQEVSTJZSA-N	449.554	1.983	50	20	IDGD	
COCCOC(=O)c1c(NC(=O)C(=O)NN(C)c2ccccc2)sc(C(N)=O)c1C	783430141	ZSQWBNZHUDHEHM-UHFFFAOYSA-N	434.474	1.065	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2nccnc2Cl)c(C)c1S(=O)(=O)NC1CC1	784780930	UGESSFVEORGRPU-UHFFFAOYSA-N	438.897	1.269	50	20	IDGD	
O=C(COC(=O)[C@@H]1CC=CC[C@H]1C(=O)N1CCOCC1)NNC(=O)c1ccc(Cl)cc1	785721669	LAMFSVJLSKQEEV-IAGOWNOFSA-N	449.891	1.085	50	20	IDGD	
CS(=O)(=O)c1ccccc1CC(=O)NNC(=O)c1ccc(F)cc1Br	785898161	VLBUZWPQVMQYEU-UHFFFAOYSA-N	429.267	1.995	50	20	IDGD	
CCN(C(=O)c1cc(NC(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)ccc1Cl)C(C)C	786466458	QUNISSNIHPERGU-GFCCVEGCSA-N	444.941	1.798	50	20	IDGD	
COCC(=O)NNC(=O)C(=O)Nc1cc(CNC(=O)OC(C)(C)C)cc(C(F)(F)F)c1	787541663	BRLLTSZPJXTLPT-UHFFFAOYSA-N	448.398	1.462	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)C(=O)Nc2cccc3c2OCC[C@H]3N(C)C)c1	789731334	CIMPPDPXWIRZQE-GOSISDBHSA-N	425.489	1.538	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccccc2CN(C)c2ccccc2)n1	789741009	MQOJHVSJTINGCX-UHFFFAOYSA-N	434.500	1.922	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)N2CCC(C(=O)NNc3ncccc3C)CC2)o1	791217456	RVGVOOACUSLBLF-UHFFFAOYSA-N	436.490	1.704	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)C2CCC(O)CC2)c1	792012600	PMJGMIOJYALSIL-UHFFFAOYSA-N	447.513	1.808	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cccc(Br)n2)cc1	793021264	AUZKLPIJWFBBOP-NSHDSACASA-N	449.261	1.600	50	20	IDGD	
NS(=O)(=O)c1cc(C(=NNC(=O)c2ccc(-n3cnnn3)cc2)C2CC2)ccc1Cl	794487137	YRHRJFIYYFVVNN-UHFFFAOYSA-N	445.892	1.507	50	20	IDGD	
CN(CCN1CCN(Cc2ccccc2)CC1)CC(=O)NNC(=O)c1ccc(F)cc1	796276419	MCMVFNRZOXWYDE-UHFFFAOYSA-N	427.524	1.336	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNS(=O)(=O)c2ccc(C#N)s2)cc1	797815725	XBBOAJSGUKRSMR-UHFFFAOYSA-N	434.528	1.664	50	20	IDGD	
O=C(NCC(F)(F)F)NNC(=O)[C@H]1CCCN1C(=O)c1ccc(Br)cc1	798313579	JLRBAOQCZSGPOX-LLVKDONJSA-N	437.216	1.946	50	20	IDGD	
CCS(=O)(=O)N1CCC(C(=O)NNC(=O)NCC(F)(F)F)(c2ccccc2)CC1	798313719	MWXNGIHZSYRZRS-UHFFFAOYSA-N	436.456	1.263	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)Nc2ccc(O[C@@H]3CCN(C)C3=O)cc2C)cc1	799241869	VWQSYAGKLVUGIR-LJQANCHMSA-N	442.472	1.845	50	20	IDGD	
CNC(=O)CNC(=O)c1cccc(NC(=O)NNC(=O)COc2ccc(Cl)cc2)c1	800596481	NAOPBBZWSJHGMX-UHFFFAOYSA-N	433.852	1.048	50	20	IDGD	
COc1ccc(S(N)(=O)=O)c(OC)c1C(=O)NNC(=O)Nc1ccc(Cl)cc1	802016061	JQHHZNWZAAYLOZ-UHFFFAOYSA-N	428.854	1.471	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@@H]2CN(Cc3ccccc3)CCO2)cc1	802063913	DQKZRDHDWKLLOG-SFHVURJKSA-N	432.502	1.144	50	20	IDGD	
CCN1CCN(S(=O)(=O)c2ccc(Cl)c(C(=O)NNc3ncccc3F)c2)CC1	804215629	YXEOGDGWMFPXNS-UHFFFAOYSA-N	441.916	1.957	50	20	IDGD	
CNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2ccc(C)cc2O)c1Br	806976143	GHPLGPMKAPJBJW-UHFFFAOYSA-N	449.261	1.222	50	20	IDGD	
COCCNC(=O)c1cccc(NC(=O)C(=O)NNc2cccc(C(F)(F)F)n2)c1	807015854	HXCJKYLWMMUQEA-UHFFFAOYSA-N	425.367	1.558	50	20	IDGD	
CCN(C)C(=O)c1cccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)c1	807065651	NOJIEKOORRGAJY-CYBMUJFWSA-N	446.891	1.985	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)c1cc(S(=O)(=O)NC(C)(C)C)ccc1C	807371608	OQJVUPNVFSFANV-UHFFFAOYSA-N	429.539	1.622	50	20	IDGD	
CCc1nnc(NC(=O)[C@H](C)[C@@H](C)NC(=O)NNC(=O)COc2ccc(F)cc2)s1	807565850	QWVOFRURJHBQOB-GHMZBOCLSA-N	438.485	1.612	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)N[C@H]1CCN(S(=O)(=O)c2ccccc2)C1	807610205	XXIXELHYRAUMKR-AWEZNQCLSA-N	433.446	1.002	50	20	IDGD	
Cc1cc(=NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c2ccccc2[nH]1	809887022	QYBQCEPPFZSQCS-UHFFFAOYSA-N	427.486	1.682	50	20	IDGD	
O=C(COc1cc(F)cc(F)c1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	809957379	LVBLCUMEEMCSDI-UHFFFAOYSA-N	439.440	1.589	50	20	IDGD	
Cn1nc(NC(=O)C(=O)NNC(=O)COc2ccc(Br)cc2)cc1C1CC1	810384257	BLKKVNAWQCQHQP-UHFFFAOYSA-N	436.266	1.225	50	20	IDGD	
CC[C@@H]1[C@H](C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)CCN1C(=O)OC(C)(C)C	811300374	GBDHKAFRJSHGJL-IAGOWNOFSA-N	444.488	1.898	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C2=NN(c3ccc(F)cc3)[C@@H](C(N)=O)C2)cc1C	913081185	DCLLQXVXBPXFSD-GOSISDBHSA-N	427.436	1.089	50	20	IDGD	
NC(=O)[C@@H]1CC(C(=O)NNC(=O)Cc2cccc3ccccc23)=NN1c1ccc(F)cc1	913084007	YQAGPDBJIUHERY-FQEVSTJZSA-N	433.443	1.789	50	20	IDGD	
CC(C)n1nc(C(=O)NNS(=O)(=O)c2cccc([N+](=O)[O-])c2)c2ccccc2c1=O	913108724	HLDXRVQEETWBSJ-UHFFFAOYSA-N	431.430	1.509	50	20	IDGD	
Cn1cc(S(=O)(=O)N2CCCCC2)cc1C(=O)NNC(=O)COc1ccccc1F	914846474	LPMYCRPKUZSSNJ-UHFFFAOYSA-N	438.481	1.179	50	20	IDGD	
CN(C)N(C(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-])[C@H]1CCS(=O)(=O)C1	915828520	LLPBPSWHWPCZAA-JTQLQIEISA-N	425.385	1.642	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)NCc3ccc(S(N)(=O)=O)cc3)n[nH]2)cc1	915884558	FQVWHOZLGOOUTA-UHFFFAOYSA-N	428.474	1.177	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2nc(C)cs2)c1	916233066	PIQLJJRCAZMPDT-UHFFFAOYSA-N	425.536	1.626	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)NCC1(NS(C)(=O)=O)CCCCC1	916253973	WNOPFKODUBFQLQ-CYBMUJFWSA-N	430.502	1.176	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(CNC(=O)NN=c2sc3ccccc3n2C)cc1	916649724	QXBIZKTXNVZQDR-UHFFFAOYSA-N	449.558	1.480	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CN2C(=O)N[C@]3(C[C@H](C)CC(C)(C)C3)C2=O)cc1	916830521	DKFHADUYJYKYJD-PEBXRYMYSA-N	443.504	1.218	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCCC2)cc1)NNC(=O)c1ccc(Cl)nc1	917251148	SJBBRNIOCDSNMX-UHFFFAOYSA-N	436.921	1.913	50	20	IDGD	
O=C1Nc2ccc(S(=O)(=O)NNC(=O)[C@@H]3COc4ccccc4O3)c3cccc1c23	917716959	GQXGQPXVWGQDKF-INIZCTEOSA-N	425.422	1.555	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNS(=O)(=O)c2ccc3c4c(cccc24)C(=O)N3)cc1C	917728751	KUIZPMFPORBRSL-UHFFFAOYSA-N	438.465	1.971	50	20	IDGD	
COc1ccc(Br)c2[nH]c(C(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)cc12	918208156	BLDHJDXIWBGPJA-MRVPVSSYSA-N	430.280	1.135	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H]2CCCN2Cc2ccccc2)c1	918758322	MRZDWBKNOPRYCP-LJQANCHMSA-N	430.530	1.363	50	20	IDGD	
CC(=O)NC1(c2noc(CCC(=O)NNC(=O)Cn3nc(C)cc3C)n2)CCCCCC1	919810017	QXZFETQGSOERKF-UHFFFAOYSA-N	445.524	1.349	50	20	IDGD	
O=C(NN=Cc1cn(Cc2ccccc2)nc1-c1cccnc1)N[C@H]1CCS(=O)(=O)C1	920381982	UWKGMZQMQJBOJZ-IBGZPJMESA-N	438.513	1.814	50	20	IDGD	
CNc1ccc([N+](=O)[O-])cc1C(=O)NNC(=O)CN1CCN(Cc2ccc(C)cc2)CC1	1116298353	NFMHJFYPCKYWCA-UHFFFAOYSA-N	440.504	1.524	50	20	IDGD	
Cc1cccc(N2N=C(C(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)CCC2=O)c1	1248632185	UFVLKJJISNMJGA-UHFFFAOYSA-N	428.470	1.343	50	20	IDGD	
O=C1CN(C(=O)c2ccc(CNC(=O)NNC(=O)c3ccccc3Cl)cc2)CCN1	1317890074	ZTWFYVGWUMLIPP-UHFFFAOYSA-N	429.864	1.056	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNS(=O)(=O)c2cnc3c(cnn3C)c2)c1	1338373662	MSIIEWWNMWKZBU-UHFFFAOYSA-N	440.279	1.363	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(O)nc(O)c2)C1	1777851370	YUFKZQXBQFIASW-AEDCBLDQSA-N	442.310	1.404	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnc4ncccn34)C2)C1	1777935874	GPCAKHWBBJPWKJ-SCLBCKFNSA-N	436.310	1.346	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(CCN(C(=O)/C=N/O[C@H]3CCCCO3)C2)C1	1779103796	YZQQOBPFESSDIR-VIEQMYLGSA-N	427.574	1.197	50	20	IDGD	
C[C@H](C(=O)N1CC[C@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1)N1CSCSC1	1779148301	XSWFJIYJPKWXTN-QAPCUYQASA-N	447.699	1.711	50	20	IDGD	
O=C(c1n[nH]c2c1CCc1ncccc1-2)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Cl)CCO2	1780037135	FXFCWDTXXWIJBT-PXNSSMCTSA-N	433.871	1.548	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(OC)c(O)cc3[N+](=O)[O-])C2)C1	1780198972	WPUPKQGTGXUVGJ-ORAYPTAESA-N	441.868	1.770	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3nn[nH]c3C(F)(F)F)C2)C1	1780365870	SQISZOVVWKHYPV-AMIZOPFISA-N	440.220	1.050	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)CC(C)(C)C(=O)OC(C)(C)C)C2)C1	1780889415	DNNIRMSTNFJZKF-QVKFZJNVSA-N	446.972	1.828	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)Cc3ccc4ncnn4c3)C2)C1	1780951797	DMHZUAJWCUKMKM-MOPGFXCFSA-N	440.331	1.338	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)/C(=C/c3ccco3)NC(C)=O)C2)C1	1781858768	ADMCVGZTYRNXQY-YWLMLEGGSA-N	437.924	1.994	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(=O)n1C)C2	1781996640	OWAWSWDJNNRPNR-ZXYWRSMDSA-N	440.338	1.296	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCCCCC(=O)OC)C1	1782277825	JDWXJGMCDZRVLN-CSODHUTKSA-N	446.972	1.878	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H]1CCOC1)CCO2	1782867626	MPVAVKPTKGCBOJ-CUDMSMGSSA-N	431.439	1.738	50	20	IDGD	
CC(=O)N[C@@H](C)C(=O)N1CCO[C@@]2(CCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1	1782867660	WNLJEKNNAQBICB-VTKMWWQSSA-N	446.454	1.226	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)CCBr)CCO2)C1	1783342157	JHPKMKVSVRDKHG-RISCZKNCSA-N	426.149	1.775	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cccnc3OC)CCO2)C1	1783344414	QBFPILKABDKWGJ-RDTXWAMCSA-N	426.311	1.707	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(NC(C)=O)c(O)c3)CCO2)C1	1783881835	NDODQQQAXMDYGF-FOIQADDNSA-N	439.896	1.048	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1ccc3cnccc3c1)CCO2	1783934577	HWDOLFRWPUTXCU-QHCPKHFHSA-N	439.516	1.051	50	20	IDGD	
Cc1ccn(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)CBr)C[C@@H]32)n1	1785368785	MJLGIKLFVULYHK-OEAJRASXSA-N	427.343	1.202	50	20	IDGD	
C[C@@H](Cn1ccnc1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCBr)[C@H]2C1	1786407834	XLBWAQICFXAIGC-VGWMRTNUSA-N	427.343	1.284	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H](C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]3C2)C1	1787447108	LEYFJFWSNFWMTP-YXMSTPNBSA-N	447.935	1.758	50	20	IDGD	
COc1cc(C(=O)NC2(c3ccc(NC(=O)c4cccc(B(O)O)c4)cc3)CCC2)n(C)n1	1788145892	BZXOTXQEVWSOPR-UHFFFAOYSA-N	448.288	1.170	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccn4nccc4c3)[C@H]2C1	1788447836	PITMJSAICGJQON-WDSOQIARSA-N	430.581	1.779	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCSC(=N)N)C[C@@H]21	1789866795	YLNLKAJIHHZXFT-CENBSLRLSA-N	425.382	1.219	50	20	IDGD	
COc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]3C2)n(C)n1	1789868931	SRPUDUNFTUSGEQ-XBPIAWKYSA-N	433.336	1.258	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc([N+](=O)[O-])[nH]3)C[C@@H]21	1790962986	IFIWZHYSAQJDSI-FMSGJZPZSA-N	443.298	1.690	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CC[C@H]3CCOC3)C[C@@H]21	1790964281	WGAQIEVIFUEKGX-WOYTXXSLSA-N	431.371	1.956	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccccc3C(N)=O)C[C@@H]21	1791060895	LJDJCVYSMOQWPS-KNPMLCFXSA-N	438.322	1.162	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc4cc(C)ccn34)C[C@@H]21	1791257304	XYNJZZWODSLMNK-CUSZFKRNSA-N	434.924	1.490	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(F)nc1F)C2	1792867111	XEFVOOXXGPUMNX-DYNIEEOBSA-N	432.265	1.594	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCl)c1n[nH]c2c1CCc1ncccc1-2	1793113930	YSMHFOAMJIPIOO-IPJQOSJUSA-N	429.908	1.422	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(F)(F)C(F)(F)C(=O)O)C2	1793447582	INBPGXHJEVSJAI-LMLFDSFASA-N	432.798	1.339	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](O)CNC(=O)OC(C)(C)C)C2	1793677544	PFZHOMSLKDIERQ-XFIYOXNOSA-N	431.961	1.918	50	20	IDGD	
Cn1ncnc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1794141255	PMINNCGIDAUMLA-CRWXNKLISA-N	440.932	1.199	50	20	IDGD	
Cc1nc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCBr)c(C)s1	1795111451	OPYVOBVKJZKAQI-FVCICTRLSA-N	430.368	1.677	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COc1ccc(F)cc1)C2	1795112962	ZMYSLPOFRFJFHS-IVWMJMPLSA-N	429.286	1.579	50	20	IDGD	
COCCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN(C)NC(=O)NCc1ccccc1)C2	1795778064	LTBPOAFBYFUABD-REPLKXPHSA-N	431.537	1.007	50	20	IDGD	
COc1ccc([C@@H]2C[C@@H]2C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)cc1	1796188003	STKGUSHJZVODIK-QWCYLASJSA-N	448.328	1.431	50	20	IDGD	
Cc1ncc(/C=C/C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)s1	1796192726	PRWALFVVLHKLSR-UUOOTRITSA-N	425.319	1.097	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cn(C)nc1C(F)F	1796705811	TYZQXBCMIYWNIY-LYIQGSDWSA-N	449.296	1.734	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1ccc2c(c1)OCCO2	1796791229	AZRHGDTYCIWIDP-NOXHYTERSA-N	443.269	1.352	50	20	IDGD	
C[C@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](F)Br)C2)[C@H]1SC(=N)NC1=O	1796879382	NHBWQXDILBULPL-IMHINIOTSA-N	435.319	1.118	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccn(CCOC)n1	1797070382	REWGNIZOQQFERH-XGUBFFRZSA-N	427.343	1.955	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2nccn2c1	1797080928	UYHXSNWURZVVBI-IVSAIRAKSA-N	435.322	1.711	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1Cc3ccccc3C1)C2	1798442604	GPVBVVJGFWQUQE-REPLKXPHSA-N	433.512	1.352	50	20	IDGD	
C[C@H](Oc1ccccc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2	1800622698	KIXLQUWSRDSJMS-AFIMGQEJSA-N	425.323	1.829	50	20	IDGD	
COc1ccccc1OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)Br	1800754137	GIGVULXHXRXSON-ZUMXRPEOSA-N	441.322	1.447	50	20	IDGD	
C[C@@H](CNC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(Cl)Cl	1801015279	AVJXUJGVYZFKBY-RVMXOQNASA-N	438.352	1.541	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1nc2ccc(F)cn2n1)[C@H](F)Br	1801190236	IKXNZYPMASOYPV-NOHGZBONSA-N	428.237	1.811	50	20	IDGD	
CCOC(=O)c1ncn2c1CC[C@@H](C(=O)N1[C@H]3CC[C@@H]1C[C@H](NC(=O)[C@@H](F)Cl)C3)C2	1801422428	URZKFJQPOLIWRA-GODIYZJISA-N	440.903	1.795	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccccc1C1CC1	1801671035	DYOSAURBCPSFHM-FAQVEIGNSA-N	428.533	1.140	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc([N+](=O)[O-])c(OC)c1	1801838198	OXXXTRVWWICMLP-LOUJCGABSA-N	425.869	1.824	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)c1ccc(C(F)(F)F)cc1F	1801850553	CYLXCYMPWSGLNI-ANGCBRKESA-N	438.805	1.647	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1n[nH]c3c(Cl)cccc13)C2	1802338655	WYLKUOVRHHAAJO-BTTYYORXSA-N	446.939	1.841	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@@H](CNC(=O)[C@H](C)CC(N)=O)[C@@H]1c1cccnc1	1803664267	YIKDMWRKTWEWET-LGWLGOQQSA-N	439.354	1.630	50	20	IDGD	
N=C(N)SCC(=O)NC[C@@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1	1807003741	DJGPDASZEMMDGG-SWLSCSKDSA-N	428.356	1.499	50	20	IDGD	
C[C@@H]1CCC[C@@H]1C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1807361079	GRDJHGISQMMQRR-ZKMOHVOUSA-N	435.333	1.517	50	20	IDGD	
Cc1ccsc1C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1807369912	YVDZLHMLMBYDPV-ICSRJNTNSA-N	449.341	1.765	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)cn1C	1807374841	JPGZNYQWMDUTSG-SIKLNZKXSA-N	446.316	1.042	50	20	IDGD	
Cc1nscc1C(=O)N1CCCC2(CCN(C(=O)c3cccc(B(O)O)c3)CC2)C1	1807849217	UKBFUXHMWBBQDF-UHFFFAOYSA-N	427.335	1.290	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1CCN(C(=O)CN2CCNC2=N)[C@H]1c1cccnc1	1808295860	MTFOMMLMLLDWFJ-QOKNQOGYSA-N	441.363	1.164	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)Cc2ccc3ncnn3c2)[C@@H]1c1cccnc1)[C@H](F)Cl	1808314969	LOOVFASBQLLAKP-IPELMVKDSA-N	430.871	1.907	50	20	IDGD	
CCc1cnc(C(=O)N2CCC3(CCCN(C(=O)c4ccc(B(O)O)cc4)C3)CC2)s1	1809971426	WXKGCBNRGDEDJV-UHFFFAOYSA-N	441.362	1.544	50	20	IDGD	
CN1CCCn2nc(C(=O)NC[C@@H]3CCN(C(=O)[C@H](F)Cl)[C@H]3c3cccnc3)cc2C1	1812286545	ZLDQDZDYCWXBKV-SNRMKQJTSA-N	448.930	1.968	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)c1nc2ccc(F)cn2n1	1812288458	KFOJKJNEQONZQU-JLJPHGGASA-N	446.870	1.183	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2[nH]nc3ccncc23)[C@H]1c1cccnc1	1813031152	OVXMERWMGMLXPY-QOKNQOGYSA-N	442.907	1.926	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)[C@@H]2C[C@]2(F)Cl)[C@H]1c1cccnc1	1813074003	NPWDPLQJKRYXOL-BPQOCRPUSA-N	439.919	1.385	50	20	IDGD	
COCCCC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1814747224	FYFXXPYRJJDWQH-MRXNPFEDSA-N	429.481	1.141	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cnc(OCF)cn2)[nH]n1)[C@@H](O)CCl	1814869598	USQOEKKVPNNXJW-STQMWFEESA-N	426.836	1.411	50	20	IDGD	
O=C(/C=C/C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](O)CCl)n[nH]1)NCc1ccco1	1814874198	YVBYFEWAUPPWCA-BUWFCSEKSA-N	449.895	1.467	50	20	IDGD	
O=C([C@H](O)CCl)N1CCCC[C@H]1c1cc(NC(=O)C(F)(F)C(F)(F)C(=O)O)n[nH]1	1815563306	KJKCYSFNCWNCOJ-DTWKUNHWSA-N	444.769	1.357	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@H]1CCc2nc(NC(=O)c3cnc(O)nc3O)sc2C1	1817086651	AAXWCOSRJYLXKA-GYKQLYQFSA-N	446.316	1.806	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)cnc1C	1817471391	XWLKJXVRMNCKDJ-HXUWFJFHSA-N	447.304	1.721	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H]2C=CCN2)n[nH]1	1817983623	HCKKFWKBFGXCOG-UIVFFXIBSA-N	438.492	1.064	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](O)CCl)CC2	1818081068	JOCWVQLOOYRZED-DGCLKSJQSA-N	433.921	1.925	50	20	IDGD	
Cc1cc(C)n2ncc(C(=O)Nc3nc4c(s3)C[C@H](NC(=O)[C@@H](O)CCl)CC4)c2n1	1818237280	WKRICVKYDHRVQF-RISCZKNCSA-N	448.936	1.628	50	20	IDGD	
Cc1oncc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819402105	NFVDAFKYPHRXCX-INIZCTEOSA-N	438.448	1.324	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1ccc(F)nc1	1819692598	YGHGGNJNUQMVST-QGZVFWFLSA-N	437.240	1.243	50	20	IDGD	
Cn1ccc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cnccc4C(=O)NN)sc3C2)c1	1819794814	FFVDQDALCFBJAZ-LBPRGKRZSA-N	439.501	1.020	50	20	IDGD	
C=C1CC(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)C1	1823701799	DMEPCQGIUQJXCM-FQEVSTJZSA-N	425.533	1.885	50	20	IDGD	
O=C(NCC(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)CC1)c1cccs1	1824180664	LKGIKOJVDDPEEH-HOTGVXAUSA-N	441.981	1.697	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccco2)CC1	1825263889	WQRGXCOQOICPDS-CZQLGGELSA-N	436.317	1.906	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CC(F)(F)C(=O)O)CC2	1825642497	WITIJAKAASQYFF-NKWVEPMBSA-N	440.266	1.949	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1CCc2nc(NC(=O)CCS(C)(=O)=O)sc2C1	1827208956	SGDCVNGMMJSJGP-LLVKDONJSA-N	433.628	1.341	50	20	IDGD	
COCCCC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1	1828923560	MFRPFBRVUPRPRE-IBGZPJMESA-N	431.537	1.345	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3Cc4ccccc4O3)C2)C1	1830362395	UYSWZUQKPVNHSI-GCJKJVERSA-N	436.936	1.712	50	20	IDGD	
Cc1nc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)co1	1830537888	RUTRPEYTYLRBMK-SJCJKPOMSA-N	430.299	1.084	50	20	IDGD	
CCOC(=O)N[C@H](O)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H](C)Br)CC1	1831655657	XHSOUKXXNXHVJO-BPLDGKMQSA-N	448.358	1.454	50	20	IDGD	
C=CCOCCCC(=O)N1CCC([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1	1831870873	IFFATLKYIINCKG-FQEVSTJZSA-N	436.597	1.962	50	20	IDGD	
O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)c1ccnc(F)c1)CCO2	1831897494	HKKFDODKYVYPRD-QGZVFWFLSA-N	430.274	1.076	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3ccccn3)CCO2)C1	1833190557	NHARPXKSFMTHGG-KXBFYZLASA-N	440.338	1.254	50	20	IDGD	
CC(C)(CCl)C(=O)NC1CCN(C2CCN(C(=O)CN3CCOC3=O)CC2)CC1	1833213065	AIJXTCGMQNVIMU-UHFFFAOYSA-N	428.961	1.275	50	20	IDGD	
Cn1cc(C(=O)NC2CCN(C3CCN(C(=O)[C@](C)(Cl)CCl)CC3)CC2)cn1	1834194463	CHKGGLAAZUWMPM-LJQANCHMSA-N	430.380	1.842	50	20	IDGD	
Cc1nn[nH]c1C(=O)NC1CCN(C2CCN(C(=O)[C@@](C)(Cl)CCl)CC2)CC1	1834933645	WRLRJGAZZVQFOU-SFHVURJKSA-N	431.368	1.535	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3ccsc3)CCO2)C1	1836008491	DHRDRKGLEZJCRJ-APWZRJJASA-N	430.954	1.391	50	20	IDGD	
CC(=O)N(C)CCC(=O)N1CCC(N2CCC(NC(=O)[C@H](F)Br)CC2)CC1	1836413477	GHSMOWADAMFYFT-KRWDZBQOSA-N	449.365	1.117	50	20	IDGD	
C[C@@H](Oc1ccccc1)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836416572	SEHBPNTVSGEFJP-UZLBHIALSA-N	437.968	1.625	50	20	IDGD	
CN[C@@H](CC(=O)N1CCC(OC2CCN(C(=O)C(C)(C)CCl)CC2)CC1)C(=O)O	1836623573	SYBSHRLRNHWZPY-INIZCTEOSA-N	431.961	1.313	50	20	IDGD	
CC[C@H](C(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1)N(CC)CC	1836713542	GGBKQERWXSKHJX-RTBURBONSA-N	432.005	1.705	50	20	IDGD	
COc1cc(C#N)cc(C(=O)N2CCC(OC3CCN(C(=O)[C@H](O)CCl)CC3)CC2)c1	1836717981	GTJFRSLDDDPSSR-HXUWFJFHSA-N	449.935	1.779	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(-c4ccccn4)[nH]n3)CCO2)C1	1838051216	DSHUVPFMPBEUIZ-YCRPNKLZSA-N	447.923	1.559	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3nccc(Cl)c3OC)CCO2)C1	1838727561	KDXPRSURXFCDNT-DJJJIMSYSA-N	446.331	1.831	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccc(OC)c(O)c3)C2)C1	1839141586	MZQWPOVREAGBPC-IIBYNOLFSA-N	440.924	1.417	50	20	IDGD	
CCn1nc(C)cc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2	1839152164	PSAIGWBNHLSWBS-MOPGFXCFSA-N	447.363	1.518	50	20	IDGD	
Cc1cscc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839200531	JMMORNCBSQPVIV-XJKSGUPXSA-N	435.315	1.817	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cncnc3C)C2)C1	1839965996	RCTPQANGLUXJEQ-YJBOKZPZSA-N	441.326	1.029	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3cccc(F)c3F)CCO2)C1	1839982804	BMWVYIGNEYHUBS-MGPUTAFESA-N	446.878	1.218	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3CC(F)(F)C3)C2)C1	1840030855	YSKNLLLFYRMARG-NHYWBVRUSA-N	425.270	1.272	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(O)cc3)C2)C1	1840034693	UJCCUFKDTKGSKX-SCLBCKFNSA-N	427.295	1.246	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4ccoc4s3)C2)C1	1840151659	JRWZEANBDOUHMV-KUHUBIRLSA-N	442.921	1.818	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(F)(F)c3ccco3)C2)C1	1840156040	MLMZFOPFCMFGQL-GUYCJALGSA-N	436.839	1.082	50	20	IDGD	
Cc1ccn2c(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)C(Cl)Cl)CCO4)cnc2c1	1840189676	GCFMTIJCNDYSBK-LJQANCHMSA-N	441.315	1.516	50	20	IDGD	
CSc1ccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)cc1	1840302048	RXCJRBUGVYRDLJ-FXAWDEMLSA-N	442.965	1.007	50	20	IDGD	
O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1840898844	XGOGCIILXPFHSB-DDUKWOAZSA-N	441.843	1.599	50	20	IDGD	
CN1CCCC[C@@H]1C(=O)N1CCCC12CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1841362897	IKSFJUBZKMZTQG-JKSUJKDBSA-N	442.988	1.806	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](CCO)C(=O)N1CCCC12CN(C(=O)C(C)(C)CCl)C2	1841429225	QZNIRAPGBKHADT-CQSZACIVSA-N	431.961	1.731	50	20	IDGD	
C[C@@H]1CC[C@H](C(=O)N2CC3(CCCN3C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)O1	1841924853	IZOGEYULUTVIBW-QLFBSQMISA-N	429.945	1.889	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](O)[C@H](C(=O)N2CC3(CCCN3C(=O)[C@@H](F)Cl)C2)C1	1843363856	CTHUZSNORSEDGI-HZSPNIEDSA-N	433.908	1.342	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)[C@@H](C)n1cccc1C=O)C2	1843415789	MWEQVSIEAIJPLX-DTVDJLOLSA-N	438.488	1.199	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](F)Br)c1	1847381953	CLQYFIXIRMVDSD-IHRRRGAJSA-N	433.299	1.596	50	20	IDGD	
CC1(CC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](O)CCl)CN(C(=O)OC(C)(C)C)C1	1847568701	IVSOQRJAMFSKKJ-SOUVJXGZSA-N	429.945	1.435	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@H]2CC(=O)Nc3cc(F)ccc32)cc1	10471377	DCAUYYVRDYANTI-INIZCTEOSA-N	448.476	1.028	50	20	IDGD	
COc1ccccc1N1C[C@H](C(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)CC1=O	23684758	KITJCUNLKLOIGH-CQSZACIVSA-N	443.456	1.535	50	20	IDGD	
O=C(NN=c1c(=O)c2cccc3cccc1c32)c1cccc(S(=O)(=O)N2CCOCC2)c1	254869179	BADRCFLABQSHNQ-UHFFFAOYSA-N	449.488	1.495	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)N[C@H](CN2CCN(C)CC2)c2ccccc2)cc1	727945458	JMTUJMZJKVSIAP-JOCHJYFZSA-N	439.560	1.947	50	20	IDGD	
O=C(NNc1nc(-c2cccnc2)no1)c1cccc(CN2CCS(=O)(=O)CC2)c1	728074426	DAZNAPNCRDEHKD-UHFFFAOYSA-N	428.474	1.119	50	20	IDGD	
N#Cc1ccc(CN2CCN(C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)CC2)cc1	728959448	LYPQISBDIFTUPS-UHFFFAOYSA-N	448.531	1.123	50	20	IDGD	
COc1ccc([C@]2(C)NC(=O)N(CC(=O)NNC(=O)Cn3ccc4ccccc43)C2=O)cc1	729449779	CAEHSWNUECCLBQ-QHCPKHFHSA-N	449.467	1.265	50	20	IDGD	
CC(=NNC(=O)CCc1ccccc1)c1cccc(N(S(C)(=O)=O)S(C)(=O)=O)c1	729819267	HGOPSXNMKFSJRP-UHFFFAOYSA-N	437.543	1.885	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)NCCCN2CCCCC2=O)c1	730129348	MEADMHJCEKZGFK-UHFFFAOYSA-N	427.299	1.804	50	20	IDGD	
O=C(COCC(=O)NNC(=O)c1cc(F)ccc1Br)NCc1cccnc1	731192276	XFACFNVUOQZUIZ-UHFFFAOYSA-N	439.241	1.077	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)c1ccc(F)c(S(=O)(=O)N2CCOCC2)c1)c1ccccc1	731999435	UIWQFDAFWZQNRR-QGZVFWFLSA-N	449.504	1.801	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])C[C@H](C)O1	732264207	REDZSVCTQMCGPU-RYUDHWBXSA-N	448.398	1.796	50	20	IDGD	
Cc1ccc(N2CCC(C(=O)OCC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)CC2)nc1	732328719	BPVUUCJDJABBQQ-UHFFFAOYSA-N	441.444	1.519	50	20	IDGD	
CCCCn1c(C)cc(/C=C(\C#N)C(=O)N[C@@H]2CC(=O)N(CCN3CCOCC3)C2)c1C	736150838	BEISJWSPXGWODY-QJUACMODSA-N	441.576	1.861	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)c2ccc(C)c(S(N)(=O)=O)c2)cc1C	736750550	GSHBFOAAFSIVTC-UHFFFAOYSA-N	439.515	1.193	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)[C@@H]1CC(=O)N(c2ccc3c(c2)OCCO3)C1	737636062	AVLSAIGOWOQDTO-MRXNPFEDSA-N	425.441	1.175	50	20	IDGD	
O=C(COC(=O)c1ccc(N2CCC(O)CC2)cc1)NNC(=O)c1cccc([N+](=O)[O-])c1	740962006	CTVPGAXHPMMTBN-UHFFFAOYSA-N	442.428	1.174	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)[C@@H](C)NC(=O)c2cc3c(C)nn(C)c3s2)c1	742033347	MFFICTTVGYXZSW-CQSZACIVSA-N	443.529	1.905	50	20	IDGD	
Cn1c(=NNC(=O)[C@@H](CCC(N)=O)N2C(=O)c3ccccc3C2=O)sc2ccccc21	742243375	ZGOWFLLJWOLEMG-OAHLLOKOSA-N	437.481	1.102	50	20	IDGD	
O=C(CSCC(=O)N1CCOCC1)NNC(=O)NCc1cccc(C(F)(F)F)c1	742457798	PFDCFZVERHQRCQ-UHFFFAOYSA-N	434.440	1.128	50	20	IDGD	
CC(C)c1ccccc1NC(=S)NNC(=O)CCN1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O	743329768	WQCPZEPLXDPPDM-AHCXZYCDSA-N	430.530	1.680	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CN2CCN(C(=O)Cc3ccc(Cl)cc3)CC2)c1	744386512	GXLFPTKSMNECTP-UHFFFAOYSA-N	428.920	1.796	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@H](C)CCOc2ccccc2)cc1	744455774	MGORBFJRLJESGQ-QGZVFWFLSA-N	433.530	1.868	50	20	IDGD	
COc1ccc(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-]	744620681	MSPZOIRYFRWDKZ-UHFFFAOYSA-N	436.446	1.381	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)[C@H](C)Cc2c(C)nn(C)c2C)cc1OC	745274797	GHRUUVLYVZOGIV-GFCCVEGCSA-N	432.477	1.237	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)NCCCN2C(=O)COc3ccccc32)c1	745856648	IMAPHWAQTYQEMK-UHFFFAOYSA-N	426.473	1.828	50	20	IDGD	
CC(=O)Nc1ccccc1CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	745858597	SCOINDQFRSZJHS-UHFFFAOYSA-N	433.490	1.040	50	20	IDGD	
Cn1ccc(N2CCC[C@@H](NC(=O)NNC(=O)c3ccc(Cl)cc3Cl)C2=O)n1	745881798	BSTLHUXQWUOXAI-CYBMUJFWSA-N	425.276	1.867	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)N[C@@H]2CC(=O)N([C@H]3C[C@@H]3c3ccccc3)C2)nc2ccccc21	745914123	IZYUBECAFITKOA-HLIPFELVSA-N	446.511	1.603	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)CSc2n[nH]c(C)n2)c2ccccc2c1=O	746096248	RAPUFHQWPWXEQH-UHFFFAOYSA-N	429.506	1.567	50	20	IDGD	
CC(C)c1nc(C#N)c(NNC(=O)[C@@H]2CN(Cc3nc(O)c4ccccc4n3)CCO2)o1	746185533	RTLXLQXIZOOHJZ-INIZCTEOSA-N	437.460	1.663	50	20	IDGD	
CC(C)CN1CCC[C@H](CNC(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)C1	746327826	FRYZGFAPMCFTMT-MRXNPFEDSA-N	426.587	1.762	50	20	IDGD	
COc1cc(C)nc(NNC(=O)CNS(=O)(=O)c2ccc(Br)s2)n1	746624996	DQXIWDHMDAWABK-UHFFFAOYSA-N	436.313	1.039	50	20	IDGD	
O=C(C[C@@H]1CCS(=O)(=O)C1)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1	747787306	NCYAJFIGUDBTOW-GHTZIAJQSA-N	441.553	1.586	50	20	IDGD	
CCc1ccc(C(=O)NNc2cc(Cl)nc(C)n2)cc1S(=O)(=O)N1CCOCC1	747980498	QYGLZFLSIKULJU-UHFFFAOYSA-N	439.925	1.779	50	20	IDGD	
CC(C)OCCS(=O)(=O)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1	749010625	GSJHJONWCKGOAY-NRFANRHFSA-N	431.558	1.989	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)CCc2cccc(F)c2F)cc1	749837742	HJXMREGOZHLZKY-UHFFFAOYSA-N	425.457	1.674	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cc(-c3ccccn3)no2)cc1OC	750953200	CDQIUQIXMNCRSX-UHFFFAOYSA-N	426.385	1.372	50	20	IDGD	
C[C@]1(c2ccc(C(=O)NNc3nc(-c4ccccn4)nc4c3CCC4)cc2)NC(=O)NC1=O	751069910	SCRWYBDUTROORY-HSZRJFAPSA-N	443.467	1.839	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NN=CC2(CN3CCOCC3)CCCCC2)ccc1Cl	751129621	IVHXOIZLORZMQI-UHFFFAOYSA-N	442.969	1.986	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)c1ccc(CNC(=O)c2cccs2)cc1	751200886	BQRYGGZTRSQWOM-UHFFFAOYSA-N	426.454	1.462	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)c1cn(-c2ccc(C(F)(F)F)cn2)nn1	751294774	SUPCNJQECIRRTP-UHFFFAOYSA-N	444.333	1.405	50	20	IDGD	
COc1cc(OC)cc(N2C[C@H](C(=O)NNc3nc4ccccc4c(=O)n3C)CC2=O)c1	752627673	QDBMSGOEMFSWOV-CYBMUJFWSA-N	437.456	1.447	50	20	IDGD	
O=C(CO)NNC(=O)c1ccccc1NC(=O)c1ccccc1I	753442296	DBDNCDIPLRTKNV-UHFFFAOYSA-N	439.209	1.297	50	20	IDGD	
CCN(CC)C(=O)CCC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	755037743	WVESCFYKKJIZAT-UHFFFAOYSA-N	438.550	1.271	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)c(C(F)F)n1	755178750	IRQQDRZGKJFONZ-UHFFFAOYSA-N	440.882	1.590	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)NCCN1C(=O)[C@@H]2[C@@H](C1=O)[C@H]1C=C[C@H]2C1	755262168	YSMOUWNMXQZQGT-GREKMHCPSA-N	432.864	1.100	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)Nc2ccc(N3C[C@@H](C)O[C@H](C)C3)nc2)cc1	755867015	UMQLLNKOWVCHOT-HUUCEWRRSA-N	429.477	1.936	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)Nc2ccccc2OCCC(N)=O)cc1	756067995	VQZINHYQBTYXAJ-AWEZNQCLSA-N	428.445	1.764	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)Nc1ccc(F)c(S(=O)(=O)NC(C)(C)C)c1	756706167	PGIGFNVNFUWZFR-NSHDSACASA-N	434.490	1.107	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)N[C@H]2CCN(C(=O)CCc3ccccc3)C2)cc1	757272175	FWXKWXJQGYNJAR-IBGZPJMESA-N	435.484	1.501	50	20	IDGD	
COC(=O)c1cc(NC(=O)NNC(=O)Cc2ccc(Cl)cc2)cc(S(C)(=O)=O)c1	757673572	IAMBWJRBCFLQNY-UHFFFAOYSA-N	439.877	1.926	50	20	IDGD	
CN1CCc2ccc(NC(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)cc2C1=O	757691615	ZFZOOUPHRSWVJX-UHFFFAOYSA-N	445.501	1.032	50	20	IDGD	
CCc1ccc(S(C)(=O)=O)cc1C(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	758938119	ZZMFOGCLCXRPLG-UHFFFAOYSA-N	449.441	1.179	50	20	IDGD	
CO[C@](C)(C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1)c1ccccc1F	760394121	PWKOLCKEMYZDCP-FQEVSTJZSA-N	437.493	1.852	50	20	IDGD	
Cn1cc(-n2cc(C(=O)NNc3nc(-c4ccccn4)nc4c3CCC4)ccc2=O)cn1	761095349	WPDWBIVKRJSIGL-UHFFFAOYSA-N	428.456	1.669	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNS(=O)(=O)c1ccc(Cl)c(Br)c1	761970785	SDPHPBRNPOZJRW-UHFFFAOYSA-N	442.719	1.937	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)cc1S(=O)(=O)NCC#N	762933204	UZNIFYZWKUCSNQ-UHFFFAOYSA-N	438.469	1.262	50	20	IDGD	
CN(Cc1cccc(NC(=O)C(=O)NNC(=O)c2ccccn2)c1)C(=O)OC(C)(C)C	763466421	IDICSESHMUHJKR-UHFFFAOYSA-N	427.461	1.848	50	20	IDGD	
COC(=O)c1c(NC(=O)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)sc2c1CCCC2	763468699	RZRXATWHVYSRND-UHFFFAOYSA-N	446.441	1.721	50	20	IDGD	
O=C(NNC(=O)c1cc2ccccc2cc1O)C(=O)Nc1ccc(CN2CCOC2=O)cc1	763525714	BOMDGZLPRUDIAV-UHFFFAOYSA-N	448.435	1.897	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NCc2cccnc2OCC(F)F)cc1	763573074	RKQPDSPKVOURFX-UHFFFAOYSA-N	443.432	1.665	50	20	IDGD	
CC(C)(C)c1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(OCC(N)=O)cc2)cc1	763601275	WXHGFXUMRLHCKW-UHFFFAOYSA-N	442.472	1.013	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)NCc1ccc(N2CCCS2(=O)=O)cc1	763641600	JIARXTNZOKMEID-UHFFFAOYSA-N	442.501	1.327	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccc(-c2ccnc(C)n2)c1	763664497	XIWZEEYLKMFDGT-UHFFFAOYSA-N	435.440	1.626	50	20	IDGD	
CCCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)cc1	763685312	TVCIDDMGIWCHMC-UHFFFAOYSA-N	432.864	1.645	50	20	IDGD	
Cc1cccc(Cn2nccc2NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)c1	763858456	SJUPHPPOGRRVOT-HNNXBMFYSA-N	439.447	1.932	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1cncc(Br)c1	763865928	SXVKFOLFGVWBGX-SECBINFHSA-N	425.214	1.537	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccc(-n2cccn2)c(F)c1	763866625	QLAIPSNLWJVCAX-GFCCVEGCSA-N	429.383	1.704	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(C(=O)OC)c2C)cc1OC	763901314	NHSPTPTZHPAHBF-UHFFFAOYSA-N	429.429	1.589	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cnc(C(C)(C)C)nc2)ccc1OC(C)C	763922428	XCXZUNGTXVVGNA-UHFFFAOYSA-N	429.477	1.970	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)c(Cl)n1	763949397	OSLIWQNSIDVPHT-UHFFFAOYSA-N	430.808	1.035	50	20	IDGD	
O=C(NNC(=O)c1cc(Cl)ccc1O)C(=O)Nc1ccc(NC(=O)[C@@H]2CCCO2)cc1	763978183	FPDBHQRDOLUXIS-INIZCTEOSA-N	446.847	1.563	50	20	IDGD	
CN(C)CCOc1cccc(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)c1	763996305	PHAJGZXTRBPREO-UHFFFAOYSA-N	438.282	1.117	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1cccc(N2CCNC2=O)c1	764012559	STAXRVOCMYQGAJ-UHFFFAOYSA-N	431.836	1.278	50	20	IDGD	
COC(=O)[C@H]1CN(C(=O)C(=O)NNC(=O)Cc2ccc3ccccc3c2)c2ccccc2O1	764083381	QZJFBKJVTVTKPM-HXUWFJFHSA-N	447.447	1.497	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2ccc(OC)c(NC(C)=O)c2)cc1	764125372	WDWLZOIKZXYAMW-UHFFFAOYSA-N	428.445	1.381	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)C(=O)Nc1cccc(N2CCCC2)c1	764203017	HMUAJFBNBHWDAG-UHFFFAOYSA-N	433.509	1.678	50	20	IDGD	
CCS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)cc1	764239020	ACJIAQNUVGJEAE-UHFFFAOYSA-N	428.470	1.221	50	20	IDGD	
O=C(Cc1cc[nH]n1)NNC(=O)C(=O)Nc1ccc(Br)cc1Br	764285686	KCYCYCVDIVGOOJ-UHFFFAOYSA-N	445.071	1.263	50	20	IDGD	
Cc1ccc(I)cc1C(=O)NNC(=O)CCN1C[C@H](C)O[C@H](C)C1	764321673	YMFDPBWGURSFBR-BETUJISGSA-N	445.301	1.860	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)c1cc(-c2ccncc2)nc2ccccc12	764342186	DCJMRQTWRQUMBA-UHFFFAOYSA-N	426.436	1.883	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)C(=O)Nc1ccccc1CN1CCSCC1	764367849	NWHLQGKFSXTWSS-UHFFFAOYSA-N	442.541	1.538	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)cc1C(=O)N(C)C	764376835	IXTXFXFFEMURPV-UHFFFAOYSA-N	440.485	1.548	50	20	IDGD	
COCCOc1cc(C)ccc1NC(=O)C(=O)NNC(=O)c1cc(-c2cccs2)[nH]n1	764384732	KJBCQWGMFGYCBU-UHFFFAOYSA-N	443.485	1.872	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccccc3-n3ccnn3)n[nH]2)cc1C	764387204	HCSUEGQYRIXFLV-UHFFFAOYSA-N	444.455	1.674	50	20	IDGD	
CNC(=O)CCOc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2F)cc1	764411314	VOVLPLIPCOMDBW-UHFFFAOYSA-N	436.827	1.394	50	20	IDGD	
Cc1ccc(S(=O)(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)cc1	765119964	WGSBRJSXHRMODG-UHFFFAOYSA-N	436.965	1.776	50	20	IDGD	
COC(=O)NNC(=O)C(=O)Nc1ccc(CNC(=O)c2ccc(C(F)(F)F)cc2)cc1	765372130	JZBKEHCAWMUYIK-UHFFFAOYSA-N	438.362	1.961	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)CC(C)(C)C)c(I)c1	765699448	RQPIPAAEGCPNLH-UHFFFAOYSA-N	433.246	1.822	50	20	IDGD	
Cc1cc(N2CC[C@@H](NC(=O)NNC(=O)c3cnn(C)c3)C2=O)ccc1Br	765918583	RZOHMLCKTSCEAI-CQSZACIVSA-N	435.282	1.241	50	20	IDGD	
CC(C)CCC(=O)NCC(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	766663616	KOZHLSPSXALULC-UHFFFAOYSA-N	437.972	1.157	50	20	IDGD	
CCCn1nc(C(=O)NNS(=O)(=O)c2csc([N+](=O)[O-])c2)c2ccccc2c1=O	768868260	ZDEUNJSUZKYXJH-UHFFFAOYSA-N	437.459	1.400	50	20	IDGD	
COc1ccc2c(c1)nc(CNC(=O)NNC(=O)c1nn(-c3ccccc3)cc1O)n2C	770565349	YDIPFCZVKZGZGC-UHFFFAOYSA-N	435.444	1.617	50	20	IDGD	
Cc1c(C(=O)NNc2nc(O)c3cnn(C)c3n2)nnn1-c1cccc(Br)c1	770970557	AINCAVINBZNCOU-UHFFFAOYSA-N	444.253	1.477	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1ccc(C)c(S(=O)(=O)NCc2ccccc2)c1	771903500	TURYJVTWGIMGIK-OAHLLOKOSA-N	447.513	1.576	50	20	IDGD	
O=C(CS(=O)(=O)c1ccc(Cl)cc1)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772196933	TYUPVDMIOBYKEI-UHFFFAOYSA-N	444.296	1.231	50	20	IDGD	
CC(C)(C)OC(=O)N1CCSC[C@H]1CC(=O)OCC(=O)NNC(=O)c1cccs1	772287102	OUPQWSZIQWTZFD-GFCCVEGCSA-N	443.547	1.795	50	20	IDGD	
CC(C)[C@H]1C[C@@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)CCO1	772622072	SXWWAFYFEVGVPT-FUHWJXTLSA-N	438.550	1.619	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCCNC(=O)NNc2ccccc2S(C)(=O)=O)s1	772630252	HOQGVRVZFODNRO-UHFFFAOYSA-N	432.549	1.065	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)[C@H](C(C)C)N2CCCS2(=O)=O)cc1	772631415	RIZQCXCIWHJASP-YOEHRIQHSA-N	427.523	1.060	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)C(=O)Nc1cccc2cncc(Br)c12	773546391	LWVUPHXNKMZKDM-UHFFFAOYSA-N	428.246	1.721	50	20	IDGD	
O=C(Cn1cc(NC(=O)C(=O)NNc2ncc(Cl)cc2Cl)cn1)NC1CCCC1	773677766	JMRCLPWFDPYAEM-UHFFFAOYSA-N	440.291	1.726	50	20	IDGD	
COC(=O)C1(c2ccc(S(=O)(=O)NNC(=O)C(=O)Nc3ccc(C)c(C)c3)cc2)CC1	776271274	JQCKETMWASPPFQ-UHFFFAOYSA-N	445.497	1.456	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)C1(S(=O)(=O)c2ccc(Cl)cc2)CC1	778437091	VBINUHZCBLYOJU-UHFFFAOYSA-N	431.898	1.318	50	20	IDGD	
CC(C)C[C@H](C(=O)NNC(=O)CNC(=O)OC(C)(C)C)N1C(=O)[C@@H]2CC=CC[C@H]2C1=O	778445872	VIQADZOWKGLKAM-RBSFLKMASA-N	436.509	1.024	50	20	IDGD	
O=C(NNc1ccc(Cl)nn1)[C@H]1CC[C@H](C(=O)NNc2ccc(Cl)nn2)CC1	778506104	LGUYLOQGIZGAFQ-MGCOHNPYSA-N	425.280	1.966	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)[C@H](O)[C@H](O)c2nc3ccccc3[nH]2)c(C)n1-c1ccccc1	779580413	ZGSKDZODBOCOBM-VQTJNVASSA-N	433.468	1.826	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)[C@H]2CCCN2S(=O)(=O)c2cccc([N+](=O)[O-])c2)c1	780797249	XQJHCLJZQPJRST-QGZVFWFLSA-N	448.457	1.678	50	20	IDGD	
O=C(NNC(=O)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(F)cc1)c1cc2ccccc2o1	780857358	XMOGVICWHQRKAT-ZBFHGGJFSA-N	447.444	1.157	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNc2ncncc2Cl)cc(OC)c1Br	782159886	YDJPNBVNYQQTPE-UHFFFAOYSA-N	430.646	1.992	50	20	IDGD	
CSc1cccc(C)c1NC(=O)C(=O)NNc1ccc(S(=O)(=O)NC(C)C)cn1	783259342	ZAKFDGVKUUDALK-UHFFFAOYSA-N	437.547	1.880	50	20	IDGD	
O=C(NNC(=O)C(=O)N1CCCC1)C(=O)Nc1cccc(CSC2CCCCC2)c1	783999533	POWPUEVBLXBSET-UHFFFAOYSA-N	432.546	1.961	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)C(=O)Nc1ccccc1Oc1cccc(F)c1	784005076	YYISOHSDIAEPCZ-UHFFFAOYSA-N	440.387	1.727	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNc2ccccn2)cc1S(=O)(=O)N1CCCC1	784797933	KXOVRNHTBBEWQZ-UHFFFAOYSA-N	433.490	1.347	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)C(=O)Nc2ccnc(OCC(F)(F)F)c2)c1	784839924	UEFINSOEGGOVOW-UHFFFAOYSA-N	432.380	1.508	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2ccc(N3CCCC3=O)c(OC)c2)n1	785227457	SBYNQKXEASALOJ-UHFFFAOYSA-N	441.492	1.540	50	20	IDGD	
CC[C@H](C)NS(=O)(=O)c1cccc(NC(=O)C(=O)NNc2cc(F)cc(OC)c2)c1	785235255	RLHBHYCBFWRSDB-LBPRGKRZSA-N	438.481	1.993	50	20	IDGD	
CCS(=O)(=O)CCn1cc(C)c(NC(=O)NNC(=O)CCc2ccc(OC)cc2)n1	786729594	FSIXVFWKFLBOGU-UHFFFAOYSA-N	437.522	1.420	50	20	IDGD	
CS(=O)(=O)[C@H]1CCCC(=NNC(=O)CN2c3cccc4cccc(c34)S2(=O)=O)C1	788420205	GXRADUPOKNCTAQ-HNNXBMFYSA-N	435.527	1.808	50	20	IDGD	
CC(C)n1nc(C(=O)NN=C2CCCc3nc(O)c(C(N)=O)cc32)c2ccccc2c1=O	788964203	CFFSHLPGHJLMAY-UHFFFAOYSA-N	434.456	1.647	50	20	IDGD	
CO[C@H]1CCOc2c(NC(=O)C(=O)NNC(=O)c3cc([N+](=O)[O-])ccc3O)cccc21	790958370	BDFLNNIYICSWJU-HNNXBMFYSA-N	430.373	1.170	50	20	IDGD	
CCS(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)s1	792214114	ZSYWVSZBPGSCEE-UHFFFAOYSA-N	449.514	1.577	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cc3ccccc3cc2O)cc1S(=O)(=O)N(C)C	792516702	MXLXZCZWRSJSKQ-UHFFFAOYSA-N	443.481	1.879	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)[C@](C)(O)Cn2cc(C(F)(F)F)ccc2=O)c(C)c1	792632529	FSSDAZNTQPPXQG-LJQANCHMSA-N	440.422	1.494	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N1CCO[C@@]2(CCO[C@H]2C)C1	792779238	DSOJNJLLAHSKKE-LXIYXOSZSA-N	442.310	1.837	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)CNC(=O)c2ccc(Br)cc2)cc1	793043032	OTIPVUONEOKOQL-UHFFFAOYSA-N	448.273	1.492	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1cn2ccc(Br)cc2n1	796140184	FSJJRWTXIWKMJB-UHFFFAOYSA-N	444.293	1.564	50	20	IDGD	
CN(C)Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)ccc1Cl	799259016	QVSCRBCPZXFENF-UHFFFAOYSA-N	432.864	1.573	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCCc2ccc3[nH]ccc3c2)cc1	799716826	YUSSYTCFOYCXFJ-UHFFFAOYSA-N	443.529	1.670	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)c2nnn(CCOc3ccc(F)cc3)c2C)nc1C	800530255	MUSOEMYYDHAPMB-UHFFFAOYSA-N	443.439	1.837	50	20	IDGD	
C[C@H]1C[C@H](C)CN(S(=O)(=O)c2ccc(C(=O)NNC(=O)N=c3cc[nH]cc3)cc2)C1	802031492	GCENDHSCBKIGQH-GJZGRUSLSA-N	431.518	1.637	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2cc(S(=O)(=O)N3CCSCC3)c[nH]2)cc1	802065345	WNOYRDPJZOYODU-UHFFFAOYSA-N	439.519	1.227	50	20	IDGD	
CN1CCN(Cc2cccc(C(=O)NNC(=O)Nc3ccc(S(C)(=O)=O)cc3)c2)CC1	802067055	JQCKIBDDJMGVDM-UHFFFAOYSA-N	445.545	1.304	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(OC(F)F)nc2)cc1	802566533	UJIWZNIIBUCQTF-NSHDSACASA-N	436.371	1.439	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCC(C(=O)NNc3ncccc3F)CC2)cc1OC	804219596	AZYQYTQMMAHMTE-UHFFFAOYSA-N	438.481	1.782	50	20	IDGD	
Cc1cc(-c2csc(NC(=O)C(=O)NNC(=O)COc3ccccc3O)n2)c(C)o1	806978450	BZMOQZKJPYRSGQ-UHFFFAOYSA-N	430.442	1.890	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)C(=O)Nc1ccc(F)c(N2CCCNC2=O)c1	806978814	LMNNAXBBFRBPMU-UHFFFAOYSA-N	443.435	1.170	50	20	IDGD	
O=C(NNc1ncccc1F)C(=O)Nc1cnc(N2CCOCC2)c(Br)c1	807300848	WWFNJFYRDCYNFP-UHFFFAOYSA-N	439.245	1.297	50	20	IDGD	
Cc1nn(Cc2cccc(Br)c2)c(C)c1C(=O)NNC(=O)N1CCN(C)CC1	807382553	GAKNTGHWLTWVIJ-UHFFFAOYSA-N	449.353	1.913	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)N[C@H](c2nncn2C)C(C)C)c2ccccc2c1=O	807431295	CWFCICLAXXLLRN-INIZCTEOSA-N	440.508	1.666	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2nccnc2C2CCC2)cc1	807461371	ADUMXHMBTGOXBY-UHFFFAOYSA-N	432.506	1.513	50	20	IDGD	
N#Cc1ccncc1N1CCN(C(=O)NNC(=O)c2ccc(Br)s2)CC1	814271814	UTOKNJJLPPZVQW-UHFFFAOYSA-N	435.307	1.954	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCC3)nnn1Cc1ccccc1F	815566208	LUTMKQQFMSHENB-UHFFFAOYSA-N	442.476	1.724	50	20	IDGD	
CCn1nc(C)c(CC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)c1C	815854492	FCDYJDZAKHRLOZ-UHFFFAOYSA-N	434.566	1.142	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)c2cc(S(C)(=O)=O)ncc2Cl)cc1	816817722	IMGCMTSJTJVGJJ-LLVKDONJSA-N	441.893	1.766	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@H](O)[C@H](O)c2nc3ccccc3s2)cc(OC)c1OC	825457257	QQXABQCJUVHILM-CVEARBPZSA-N	447.469	1.178	50	20	IDGD	
CN(CC(=O)NNC(=O)Cc1cccc2ccccc12)C1=NS(=O)(=O)c2ccccc21	827040909	BNCBSARDECOGQG-UHFFFAOYSA-N	436.493	1.611	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)Cn1nnc(-c2ccc(Cl)cc2)n1	835739680	UYDYIKSLIFEKDJ-UHFFFAOYSA-N	430.852	1.619	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CSc1nnc(O)n1C[C@H]1CCCO1	844261561	QQAQGVKNIJWIFA-LLVKDONJSA-N	441.897	1.378	50	20	IDGD	
C=CCNS(=O)(=O)c1cc(C(=O)NNC(=O)Cc2c[nH]c3ccccc23)ccc1F	914595717	MGLNQWZINHWECG-UHFFFAOYSA-N	430.461	1.775	50	20	IDGD	
CNS(=O)(=O)c1cccc(CNC(=O)/C(C#N)=C\c2cc(C)n(CCOC)c2C)c1	915197513	URTPMJMYJAFAGO-UNOMPAQXSA-N	430.530	1.883	50	20	IDGD	
Cc1ccc(SCCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1	915929156	KFSYDMRGGKMEDR-UHFFFAOYSA-N	436.559	1.982	50	20	IDGD	
CCCCS(=O)(=O)N1CCC(C(=O)NNC(=O)c2cc(-c3ccccc3)on2)CC1	918225525	NEIJUAGFRJUEGL-UHFFFAOYSA-N	434.518	1.945	50	20	IDGD	
COC(=O)N(C)CC(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccc(C)cc2C)c1	919687353	VDJIPZKLGQAELM-UHFFFAOYSA-N	448.501	1.563	50	20	IDGD	
COCCOc1cccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1	919691883	CSTKWFAWSZJMIS-UHFFFAOYSA-N	447.513	1.571	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Nc2cccc(N3C(=O)CNC3=O)c2)cc(OC)c1OC	920929192	BLQLIYSGMQNQHG-UHFFFAOYSA-N	443.416	1.235	50	20	IDGD	
CC(C)NC(=S)NNC(=O)CNS(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1	1317703945	FKXWMOKSQQEGOL-UHFFFAOYSA-N	432.877	1.541	50	20	IDGD	
COc1ccccc1C1(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)CCC1	1318296351	XLJQLHFVRHDCNH-IBGZPJMESA-N	440.452	1.648	50	20	IDGD	
COc1ccc(CNC(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)c(OC)n1	1323999856	CUQASICZZZSYLB-UHFFFAOYSA-N	437.497	1.576	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)[C@H]2CC(=O)N(c3ccc(C#N)cc3)C2)cc1	1343636100	UHIJLGICDFRFBE-HNNXBMFYSA-N	427.486	1.305	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H]3Cc4ccccc4O3)C2)C1	1778243398	ZUTMXIVBEATBQT-CFLQYTFWSA-N	437.334	1.851	50	20	IDGD	
O=C(c1cc([N+](=O)[O-])cc2c1OCC2)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Cl)CCO2	1780093581	NULOHNFWGHPCFN-MAUKXSAKSA-N	427.816	1.508	50	20	IDGD	
COc1cc(C#N)cc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)c1	1780175470	JWGBRJVJZLXCRT-ORAYPTAESA-N	436.306	1.794	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)ncc1[N+](=O)[O-]	1781230216	QNCRFRNBUFRMTR-ZWKOTPCHSA-N	445.303	1.978	50	20	IDGD	
O=C(c1ccc2nccn2c1)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781330170	SANOBCBEJJCIIW-PBHICJAKSA-N	425.258	1.468	50	20	IDGD	
O=C(c1ccc2c(c1)OCCO2)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781330500	YEAGTCBCZMQVTJ-YJBOKZPZSA-N	443.269	1.592	50	20	IDGD	
CCOC(CC(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1)OCC	1781334354	LZUJZFJRCRZKOK-ZBFHGGJFSA-N	425.295	1.296	50	20	IDGD	
CCn1nc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](Cl)COC)C2)cc1C	1782173726	NNSHIERZEZIRKA-WRWLIDTKSA-N	426.945	1.593	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)n1ccccc1=O)C2	1782175691	PCRMBHKFRNETGW-KYFSNAEOSA-N	439.940	1.177	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4nn(C)cc4c3)C2)C1	1782244724	QKXLLASKEVMJAL-DJJJIMSYSA-N	435.322	1.800	50	20	IDGD	
CCC[C@H](NC(C)=O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)Br)C2	1783190862	UKLSADRRZRXOAL-HWLIBYHHSA-N	446.386	1.589	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)CNC(=O)OC(C)(C)C)C2)C1	1783401675	TUMQTUKUMPPNQZ-UGSOOPFHSA-N	448.358	1.515	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H]1CCc3ccoc3C1)CCO2	1783530165	UIBZTHADXUYHII-RFUYNDQBSA-N	425.323	1.998	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cncc(N(C)C)c3)CCO2)C1	1783531893	FIGLMVNRJDRZEU-ACJLOTCBSA-N	425.327	1.375	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cn4ccccc4n3)C[C@@H]21	1783965778	RBLLZBATLLHMFB-AESZEHBQSA-N	449.349	1.959	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(CCN(C(=O)c3ccc(CO)c(F)c3)C2)C1	1785264256	UJZYTOFQSPECGT-GOSISDBHSA-N	429.286	1.547	50	20	IDGD	
COc1nn(C)cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)CBr)C[C@@H]21	1785860560	PLHGGFSXYHTLFS-OSFYFWSMSA-N	443.342	1.053	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cn3ccccc3=O)[C@H]2C1	1787016218	HIYNKESHUQEERS-XMDUPGNXSA-N	430.332	1.064	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CSc3ncccn3)[C@H]2C1	1787077144	NUDRXJCMPICXJS-XUXIUFHCSA-N	443.367	1.332	50	20	IDGD	
Cc1cn2c(=O)c(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]4C3)cnc2s1	1787447004	IAILARHVWXAISA-DOERSZECSA-N	442.900	1.192	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnn4cccnc34)[C@H]2C1	1788292563	HMIYDDBBZRVHQJ-JURCDPSOSA-N	436.310	1.106	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)c1ccc2[nH]ccc2n1	1788319494	RYXWVERFQRSVCQ-GREKMHCPSA-N	439.285	1.847	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1ccc(C2(NC(=O)Cn3nccn3)CCC2)cc1	1788646096	YCVVBZJHJAOUFE-RWPZCVJISA-N	448.487	1.546	50	20	IDGD	
CCCC(=O)N[C@@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]2C1	1789870229	ABWYKHJUYKGKNT-OXMIBSBGSA-N	436.380	1.507	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nccc4nc[nH]c34)C[C@@H]21)[C@H](F)Br	1789923154	VEIBBJQBFXFPON-OUCVZQCGSA-N	440.273	1.242	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)[C@H](O)Cc1ccccc1	1790956232	GHWGZRKVKBJVFL-KSWRQPAISA-N	443.313	1.260	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)Cn3cccn3)C[C@@H]21	1791056964	JFRFYEPNDVRZHL-YXMSTPNBSA-N	427.343	1.282	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4cc(O)ccc4n3)C[C@@H]21	1791254876	WBNXAUHQRVBJPQ-REGYPHIPSA-N	447.919	1.788	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3coc([Si](C)(C)C)c3)C[C@@H]21	1791255048	BNXRTVHKDJNBPZ-HJWJTTGWSA-N	443.016	1.672	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3c(F)cc(OC)cc3F)C[C@@H]21	1791257155	QVVMHFBJBZOKMC-MJFSBKNWSA-N	446.878	1.821	50	20	IDGD	
CCOc1cccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]3C2)c1	1791290688	LJSOUKCMDLBCMW-IHPCNDPISA-N	446.548	1.052	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(=O)c3cccn3C)[C@H]2C1	1791690358	VFLAJHSUYRIHNY-YXWQFLTLSA-N	440.338	1.219	50	20	IDGD	
COC(=O)[C@H]1CC[C@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)Br)C3)CC1	1793609341	NOZRJQHFYUBEJA-SBOZNWLOSA-N	445.354	1.339	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](O)CNC(=O)OC(C)(C)C)C2	1793677542	PFZHOMSLKDIERQ-JKJDWNRSSA-N	431.961	1.918	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(OC(F)F)cn1	1794787082	WQHVMZVOVGHEHR-BTTYYORXSA-N	439.463	1.308	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)n[nH]1	1795694535	JZAWNABTTLDVHW-RMRMTIIFSA-N	443.410	1.204	50	20	IDGD	
O=C(Cc1ccc(F)c(F)c1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1	1796186987	DRULOTOHWLNEIF-BCDXTJNWSA-N	428.244	1.139	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C[C@@H]1CNc3ccccc3O1)C2	1797956729	AWLCAOQNHCNRQM-MPWIWIEXSA-N	447.608	1.691	50	20	IDGD	
COc1cccc(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)c1	1798439294	VIUIXQSRZXQKHF-BJWYYQGGSA-N	437.500	1.188	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(C)ccc1-n1ccnn1)C2	1799271853	DBUNOVSLUAKXAD-LORHWOILSA-N	431.924	1.796	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccn(-c2ccccc2)n1)c1cccc(B(O)O)c1	1799426470	RBWAVCNHUKCCRT-NUZGMZIFSA-N	444.300	1.118	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cn1cccn1)C2	1800332913	ATTUYZUQMJHRMV-RNCDSHHQSA-N	441.438	1.358	50	20	IDGD	
Cc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)Br)n(C(F)F)n1	1800760280	MJSILGSZVOXVJE-KQXIARHKSA-N	435.269	1.573	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1c[nH]c3ccccc13)C2	1800975788	TWOAVFNTGJNABY-VWFIUDSGSA-N	433.936	1.944	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN1CCc3sccc3C1)C2	1802274664	WSJVOXTYOOHATE-YYIAUSFCSA-N	425.982	1.998	50	20	IDGD	
Cc1nnc(CCC(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]2c2cccnc2)s1	1803142405	WRFUFXDGMSNGMO-IIDMSEBBSA-N	437.953	1.480	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cn3cccnc3n2)[C@H]1c1cccnc1)[C@@H](O)CCl	1803143115	UJVVUXGEWAURHI-XIRDDKMYSA-N	428.880	1.044	50	20	IDGD	
Cc1cccnc1C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1803800416	RJYVXKHHHOFGLV-DENIHFKCSA-N	444.300	1.098	50	20	IDGD	
CN1N=C(C(=O)NC[C@@H]2CCN(C(=O)CO[Si](C)(C)C)[C@@H]2c2cccnc2)CCC1=O	1804120572	KADZJECWCMUSRZ-OXJNMPFZSA-N	445.596	1.547	50	20	IDGD	
CN(C)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1	1805104802	XZFXYWUDMKKNNN-ZYSHUDEJSA-N	431.924	1.462	50	20	IDGD	
CN1Cc2ccccc2C[C@@H]1C(=O)N1CCC2(CCCN(C(=O)[C@H](O)CCl)C2)CC1	1805518193	PTCPMUFKPPECDD-WOJBJXKFSA-N	433.980	1.874	50	20	IDGD	
CN1C(=O)CC[C@H]1C(=O)N1CC[C@H](CNC(=O)CCBr)[C@H]1c1cccnc1	1806343928	LKHFKDBYGZNXSS-RVKKMQEKSA-N	437.338	1.493	50	20	IDGD	
O=C(CN1CCCC1=O)NC[C@@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1	1806921964	XUOBRFLNAJEANN-KXBFYZLASA-N	437.338	1.495	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)CCc2ccco2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1	1807369854	XGKJAHVNTUIVCB-XXBNENTESA-N	447.300	1.307	50	20	IDGD	
Cc1nc(C)c(C(=O)N2CCCC3(CCN(C(=O)c4ccc(B(O)O)cc4)CC3)C2)s1	1808232677	XMXWFMJRLLWSDM-UHFFFAOYSA-N	441.362	1.598	50	20	IDGD	
CN[C@H](CC(=O)N1CC[C@H](CNC(=O)[C@@](C)(Cl)CCl)[C@@H]1c1cccnc1)C(=O)O	1808294926	CWQCWVSYANPHJD-ZLHSVIROSA-N	445.347	1.386	50	20	IDGD	
CC(=O)N[C@H](C)C(=O)N1CC[C@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]1c1cccnc1	1808317991	PUQGJTBUMXWIEQ-BGIGGGFGSA-N	429.348	1.848	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)[C@H]1Cc2ccccc2CN1	1808321787	WNNNOFOEODNIGE-BQJUDKOJSA-N	442.947	1.402	50	20	IDGD	
C/C(=C/C(=O)N1CC[C@H](CNC(=O)[C@@H](F)Br)[C@@H]1c1cccnc1)C(=O)O	1808681485	UBMKBVSDAJPGJF-UESZGFSCSA-N	428.258	1.809	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)c1cn2ncccc2n1	1809349066	CTYPBIWCWWFUPR-YXJHDRRASA-N	428.880	1.044	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)CS(C)(=O)=O)[C@@H]1c1cccnc1	1812774733	FHONKTHJKQXSGN-IJEWVQPXSA-N	446.367	1.306	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2ccc(OC)nn2)[C@H]1c1cccnc1	1813031861	RZCWSKSQDBBROB-MPGHIAIKSA-N	433.896	1.454	50	20	IDGD	
Cc1occc1C(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1813069852	CXFLSBCZFZMLGE-LAUBAEHRSA-N	427.505	1.676	50	20	IDGD	
O=C(CCn1cncn1)NC[C@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1	1813318988	ZKRZPDODQOVAPP-CRAIPNDOSA-N	435.326	1.554	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)CN3CCNC3=N)sc2C1	1814927977	QDFXBFCWHYNPJS-ZJUUUORDSA-N	443.371	1.069	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CN2CCOC2=O)n[nH]1	1815023885	VSIDNZSZVYFABG-YPMHNXCESA-N	442.314	1.885	50	20	IDGD	
CCC[C@@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1815317719	HATYFQUWJIJTQX-NVXWUHKLSA-N	432.717	1.803	50	20	IDGD	
Cc1ccc(CC(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)cn1	1815976356	DYEKVFVNTFPXDJ-FQEVSTJZSA-N	447.304	1.342	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3[nH]nc4ncccc34)sc2C1	1816874484	NEXUCHUEBVRXPE-GXSJLCMTSA-N	434.909	1.894	50	20	IDGD	
Cc1ccc(CC(=O)Nc2cc([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)cc1	1816943547	GLHSISCGCFLDAN-OAQYLSRUSA-N	446.316	1.947	50	20	IDGD	
O=C(CC(F)(F)C(=O)O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](F)Br)CC2	1817096353	MQMJJCUEYZPUCY-ANLVUFKYSA-N	444.229	1.856	50	20	IDGD	
O=C(Cn1ccccc1=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](F)Br)[nH]n1	1817520337	PLPVAMIIVMNDTE-LRDDRELGSA-N	440.273	1.954	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(=O)nc3cccnn23)[nH]n1)[C@H](F)Cl	1818041883	XKAMOSBWDVRETL-ZBEGNZNMSA-N	433.831	1.653	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccnc2)[nH]n1	1819402040	JYXJXTCUMUATDT-QGZVFWFLSA-N	434.460	1.423	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@H]1CCc2nc(NC(=O)c3ccnnc3O)sc2C1	1821093307	YYESRNYCRNFKPE-BDAKNGLRSA-N	440.323	1.896	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnccc2F)[nH]n1	1822414232	NEKOYBFZKWBYED-INIZCTEOSA-N	431.472	1.623	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)/C=N/N2CCCCC2)[nH]n1	1822416185	UIRRXDDHFCNEBA-HINJULBWSA-N	446.556	1.247	50	20	IDGD	
O=C(CSc1ncccn1)N1CCC([C@H]2CCCCN2C(=O)[C@@H](O)CCl)CC1	1824182323	XXXYHYCVXXEGTH-CVEARBPZSA-N	426.970	1.788	50	20	IDGD	
C=CCOCCCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1	1824499034	FFJHQJWYTBASLC-JOCHJYFZSA-N	442.365	1.583	50	20	IDGD	
CCCC(=O)N[C@H](C)C(=O)N[C@H]1CCc2nc(NC(=O)[C@H](Cl)COC)sc2C1	1826000446	SXCFZWYIOAKLSN-GRYCIOLGSA-N	430.958	1.614	50	20	IDGD	
Cc1ncoc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827056375	UQRQVCLSTXUJNE-IBGZPJMESA-N	425.294	1.210	50	20	IDGD	
C[C@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H](O)CCl)CC1)[C@H]1SC(=N)NC1=O	1827665619	ZARDIDKTFJLHSQ-ZGKBOVNRSA-N	444.985	1.008	50	20	IDGD	
O=C1COc2ccc(C(=O)N3CCCC[C@@H]3C3CCN(C(=O)[C@@H](O)CCl)CC3)cc2N1	1828624269	BEPGGPZNPRSNQJ-MSOLQXFVSA-N	449.935	1.851	50	20	IDGD	
Cc1cc(/C=C/C(=O)N2CCCC[C@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)no1	1828992839	AYMDDDQJKUCBEH-JCOOBLOPSA-N	445.564	1.989	50	20	IDGD	
Cc1ncc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)s1	1830538540	IRKZIBOFOUNTFG-SJCJKPOMSA-N	446.367	1.553	50	20	IDGD	
CC(C)c1ccc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)cc1	1830734943	BEJTYRVOOGNDAN-KNQAVFIVSA-N	438.952	1.409	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3Cc4ccccc4CN3)C2)C1	1831647700	YBHBPFWUXWHXEK-ZRCGQRJVSA-N	449.979	1.565	50	20	IDGD	
CCOC(=O)N[C@H](O)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](C)Br)CC1	1831655659	XHSOUKXXNXHVJO-VHDGCEQUSA-N	448.358	1.454	50	20	IDGD	
C[C@@H](Cn1cccn1)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1	1831872047	MEJJGLDXTOCDNW-ICSRJNTNSA-N	446.596	1.512	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)c3cccc(=O)n3O)CC2)CC1	1833531529	RZMOBFRBIVCPGV-QGZVFWFLSA-N	438.956	1.678	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)[C@H](C)NC(=O)NCC)CC2)CC1	1833534037	YGOOCAOGXPHVFK-YJBOKZPZSA-N	444.020	1.673	50	20	IDGD	
Cc1nn(C)cc1C(=O)NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1833583512	VGPYDGSLCCWTKB-MRXNPFEDSA-N	444.349	1.604	50	20	IDGD	
CC(=O)N(C)CCC(=O)NC1CCN(C2CCN(C(=O)[C@H](C)Br)CC2)CC1	1833671030	DTTKYPUYFZZIPK-AWEZNQCLSA-N	445.402	1.210	50	20	IDGD	
CCc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)cn1	1833892743	PXGIOKLSIVFDHL-YJBOKZPZSA-N	444.301	1.405	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCBr)CCO3)C2)nc1	1834819700	YRMIVRNYROVSDT-GOSISDBHSA-N	426.311	1.245	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)Cc1cccc(F)c1)CCO2	1835023951	WDTDNVFYPPEJRA-NRFANRHFSA-N	438.572	1.676	50	20	IDGD	
O=C([C@@H](F)Br)N1CCOC[C@@]2(C1)CN(C(=O)C1(F)CCCCC1)CCO2	1836617635	NHPMZMRMNLFWCL-CZUORRHYSA-N	439.297	1.806	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC(OC2CCN(C(=O)C(=O)N(C)C)CC2)CC1	1836670211	BYDZIDITVRUBOO-CYBMUJFWSA-N	432.359	1.104	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)C#CC3(O)CCCCC3)CCO2)C1	1837492075	ABFQUYZAYRJWMU-LAUBAEHRSA-N	426.941	1.159	50	20	IDGD	
O=C(c1csc(C(F)(F)F)n1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1838189330	LKMKBJNPVSMJRJ-IINYFYTJSA-N	445.822	1.766	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)c(C)n1C	1838389707	MLFABAXUXHXKCE-LIRRHRJNSA-N	442.354	1.495	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cncc(O)c3)CC2)CC1	1838777012	QSRNIMXYRXMOLS-GOSISDBHSA-N	425.913	1.653	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3cncc(OC)c3)C2)C1	1839142414	NVHVHPZJFPTDCA-GHTZIAJQSA-N	439.940	1.497	50	20	IDGD	
C[C@H](C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2)c1ccccn1	1839203798	WOYDXFVWTXRSBC-YEWWUXTCSA-N	444.301	1.332	50	20	IDGD	
CNc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)cc1	1840032285	UAZBYRIWPARTAD-AUUYWEPGSA-N	440.338	1.582	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccccc3F)C2)C1	1840032390	XNWCYJFNGUOXRK-IFXJQAMLSA-N	443.313	1.608	50	20	IDGD	
C[C@@H](Nc1ccccn1)C(=O)N1CCOC[C@]2(CN(C(=O)C(Cl)Cl)CCO2)C1	1840188634	VBVSCYMXEDSGMR-FZKQIMNGSA-N	431.320	1.142	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@H]2CC(=O)N(c3cccc(OC)c3)C2)C1	1841009803	LVROYFZIFUAYBA-YJBOKZPZSA-N	449.935	1.505	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@H](O)CC(=O)N1CC2(CCCN2C(=O)C(C)(C)CCl)C1	1841226983	QADORFOXYHITCG-CQSZACIVSA-N	431.961	1.731	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC12CN(C(=O)c1ccc(S(C)(=O)=O)c(F)c1)C2	1846179892	CLPGFLGKLRAMKW-NSHDSACASA-N	447.326	1.830	50	20	IDGD	
COc1cccc(Cl)c1C(=O)N1CCCC12CN(C(=O)c1ccc(B(O)O)cc1)C2	1846850260	NZWNQGJKPWOODC-UHFFFAOYSA-N	428.681	1.159	50	20	IDGD	
O=C(c1cc(Br)cc2[nH]ncc12)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl	1847562611	BQRRKIMOZQIXOV-KKUMJFAQSA-N	441.713	1.741	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc1	10160044	BWDCMSSXSHSCBN-AWEZNQCLSA-N	443.485	1.014	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)[C@H]1CC(=O)N(Cc2ccccc2)C1	15314969	MTDLYNZIGLSTHM-NRFANRHFSA-N	449.555	1.395	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)COc2ccc(N3CCCC3=O)cc2)cc1	16465029	LLFLYNXITHIRSM-UHFFFAOYSA-N	425.441	1.505	50	20	IDGD	
Cc1c(NC(=O)[C@@H](C)SCC(=O)NNC(=O)CC(C)C)c(=O)n(-c2ccccc2)n1C	25635513	YWZSOGZZFGSOJE-OAHLLOKOSA-N	447.561	1.738	50	20	IDGD	
CC(=NNC(=O)c1cccn1C)c1ccc(S(=O)(=O)N2CCCC[C@@H]2C(=O)O)cc1	725847698	QSIKXHHORXMVPD-GOSISDBHSA-N	432.502	1.807	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)NCc1ccc([C@]2(C)NC(=O)NC2=O)cc1	726282735	QZPOHEAPNQVWQY-FQEVSTJZSA-N	445.863	1.547	50	20	IDGD	
COc1ccc(OC)c(-n2nnnc2SCC(=O)NNC(=O)c2ccc(C)cc2)c1	726432222	CQPJGSYADIXCHG-UHFFFAOYSA-N	428.474	1.541	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)[C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])c(C)c2)c1O	726622096	SLMSRTCRULELJZ-MRXNPFEDSA-N	442.428	1.683	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)Nc1ccc(Cl)nc1	726871616	XUBLYTJZYGZMTG-UHFFFAOYSA-N	439.881	1.222	50	20	IDGD	
Cc1ccc(C(=O)NNc2nc(-c3ccncc3)no2)cc1S(=O)(=O)N1CCOCC1	728073533	KZYPKLPBDDBXIH-UHFFFAOYSA-N	444.473	1.218	50	20	IDGD	
COC(=O)c1c(C)[nH]c(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)c1C	728212980	OZNMXDHQBADWLB-UHFFFAOYSA-N	449.533	1.111	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)[C@@H]2CC(=O)N(CC(F)(F)F)C2)c1	728527448	JFXIIRFZNYOPMJ-MRVPVSSYSA-N	438.200	1.630	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2nnn(-c3ccccc3Cl)c2C)n1	728998069	FQECAHBVSHTCOC-UHFFFAOYSA-N	448.892	1.541	50	20	IDGD	
COc1ccccc1OCCCNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1	729230437	XRBILIOSZPFQDZ-UHFFFAOYSA-N	428.493	1.501	50	20	IDGD	
COCc1cc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)ccc1F	730906879	QAKMNRDMYSFQOH-UHFFFAOYSA-N	438.481	1.367	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])o1)c1cccc(OC(F)F)c1	731988828	LSTNFNVMEDWEGS-LBPRGKRZSA-N	438.343	1.855	50	20	IDGD	
O=C(NCCS(=O)(=O)NC[C@@H]1CCCCO1)NNC(=O)c1ccc2ccccc2c1	732240238	QICFBXWZNWTXGC-SFHVURJKSA-N	434.518	1.272	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)N[C@H]1CCN(c2ccccc2C(N)=O)C1	732589531	CNOSRKPMDUTDSD-KGLIPLIRSA-N	429.452	1.301	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)c1ccccc1NS(=O)(=O)C(F)(F)F	732751009	HVCAVGVULOGGLQ-UHFFFAOYSA-N	441.391	1.979	50	20	IDGD	
Cn1c(NNC(=O)c2ccc(F)c(S(=O)(=O)N3CCCC3)c2)nc2ccccc2c1=O	733261309	OBLKXEUMSAOKAJ-UHFFFAOYSA-N	445.476	1.614	50	20	IDGD	
COc1ccc(CN2CC[C@H](NC(=O)NNC(=O)Cn3ccc4ccccc43)C2=O)cc1	734527399	SOBQDPPTETYNNT-IBGZPJMESA-N	435.484	1.781	50	20	IDGD	
Cc1ccc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)c3cnn(C)c3)cc2)cc1C	735470988	IWNZOAWNNKIYLE-UHFFFAOYSA-N	427.486	1.913	50	20	IDGD	
Cc1cc(NNC(=O)CNC(=O)c2ccccc2I)nc(C)n1	736716760	MGYQIHXIFFINJU-UHFFFAOYSA-N	425.230	1.571	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)cc1	740887058	PFMCNNNFWUZSJO-UHFFFAOYSA-N	425.445	1.122	50	20	IDGD	
CN(CCCC(=O)NNC(=O)c1cccc(N(C)C)c1)C1=NS(=O)(=O)c2ccccc21	741885280	MTAXNLPWFIHKBD-UHFFFAOYSA-N	443.529	1.375	50	20	IDGD	
CC(C)(C)C(=O)Nc1ccc(S(=O)(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)cc1	743268697	GGKCMZRGNSNPBW-UHFFFAOYSA-N	436.446	1.908	50	20	IDGD	
Cc1cc(NNC(=O)[C@H](C)NS(=O)(=O)c2c(C)nn(C)c2C)ccc1Br	743416407	NDHIBYCKYZPSKK-NSHDSACASA-N	444.355	1.918	50	20	IDGD	
CN(CC(=O)NNC(=O)c1cccc(C#N)c1)[C@H]1CCN(c2ccccc2Cl)C1=O	744400014	BJTDNHJQHHDUNV-SFHVURJKSA-N	425.876	1.710	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CN2CCN(CC(=O)N[C@H]3CCC[C@H](C)C3)CC2)c1	744402042	HSPDXLUCAJRZAQ-ICSRJNTNSA-N	429.565	1.069	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)CCNS(=O)(=O)c2ccc(C)c(C)c2)c1	744454913	NZTHCKYRFLQYEW-UHFFFAOYSA-N	447.513	1.285	50	20	IDGD	
C[C@@H](OC[C@H]1CCCCO1)C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	744619869	BHRNOAILKQAVQN-HZPDHXFCSA-N	427.523	1.125	50	20	IDGD	
COC(=O)c1ccsc1N1CC[C@H](NC(=O)NNC(=O)c2cccc(Cl)c2)C1=O	746778395	BCPMFQJLDXATRO-ZDUSSCGKSA-N	436.877	1.938	50	20	IDGD	
COc1ccc2c(c1)OC[C@H](C(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1)C2	747409027	MWJBWBSDUJKIRZ-MRXNPFEDSA-N	447.513	1.023	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)c1ccc([C@]2(C)NC(=O)NC2=O)cc1	748517275	RGMZKYUFMQENST-QFIPXVFZSA-N	434.456	1.115	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)NNC(=O)CNC(=O)c2cccs2)cc1Cl	748641260	HDYVPKFRIVNIAK-UHFFFAOYSA-N	430.895	1.099	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2ccc(C(=O)NNC(=O)CCc3ccccc3)cc2)C[C@@H](C)O1	749804444	YQBSQJBXLXHXGO-CALCHBBNSA-N	445.541	1.878	50	20	IDGD	
O=C(Cc1csc(N2CCOCC2)n1)NN[C@@H](C(=O)N1CCCCC1)c1ccccc1	750198129	MFRVEBXXEZZHCL-HXUWFJFHSA-N	443.573	1.897	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)c1cccn2c(I)cnc12	750613706	NASSYYYZXDZPFQ-UHFFFAOYSA-N	443.245	1.005	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C1CCN(C(=O)OCc2ccccc2)CC1	751206259	IRHWDXLEOANVQC-UHFFFAOYSA-N	444.513	1.674	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(OC)c(C(=O)NNC(=S)N[C@H](C)C2CC2)c1	751616579	FQJQMWGHWVBZKC-GFCCVEGCSA-N	428.580	1.633	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)c2ccc(F)c(S(=O)(=O)NC)c2)cc1	752399713	UUZOWDNTSRMHIH-LBPRGKRZSA-N	439.465	1.361	50	20	IDGD	
Cc1cc(Cl)c(S(=O)(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1[N+](=O)[O-]	753067034	BMRQYLASXJPHFL-UHFFFAOYSA-N	427.822	1.951	50	20	IDGD	
C[C@@H](NCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)[C@H]1CCCN(C(=O)OC(C)(C)C)C1	754319183	PMTLPFPEAXRYOU-ZBFHGGJFSA-N	449.508	1.981	50	20	IDGD	
CN(C)c1ccc(S(=O)(=O)N(C)C)cc1NC(=O)NNC(=O)c1cccc(C#N)c1	755532733	PEESIZJCTLTZOR-UHFFFAOYSA-N	430.490	1.341	50	20	IDGD	
CCCCNS(=O)(=O)c1cccc(NC(=O)NNC(=O)COc2ccc(C#N)cc2)c1	755535983	MVMNXVKJQRGFED-UHFFFAOYSA-N	445.501	1.868	50	20	IDGD	
COc1ccc(C(=O)N2CCOCC2)cc1NC(=O)NNC(=O)c1ccc(Cl)nc1	756258337	RUPYGHMJYSPEQZ-UHFFFAOYSA-N	433.852	1.683	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Nc2cccc(CS(C)(=O)=O)c2)cc(OC)c1OC	756268277	ABPYQAFMLNYORC-UHFFFAOYSA-N	437.474	1.724	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)Nc2ccc(F)c(-n3nnnc3C3CC3)c2)cc1	756778657	OSDBCNIPUPCKPI-UHFFFAOYSA-N	441.423	1.919	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N[C@H]2CCN(c3ccccc3OC)C2=O)cc1OC	756916039	UNFXGMBYJFHYPF-AWEZNQCLSA-N	428.445	1.462	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccn(-c3cccc(F)c3C#N)n2)c1	757986606	QCQHLUMRJYXFIO-UHFFFAOYSA-N	442.432	1.753	50	20	IDGD	
COCCS(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2cccc(Cl)c2)cc1	759261389	RSAPZFXMJFMQFM-UHFFFAOYSA-N	425.894	1.904	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)c2sccc2S(=O)(=O)Nc2cnn(C)c2)nc1	759731407	UEDJEFXSJWHRRX-UHFFFAOYSA-N	436.475	1.221	50	20	IDGD	
CCC1(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)CCCC1	761779260	PQRLBQRWCICPSX-UHFFFAOYSA-N	438.550	1.622	50	20	IDGD	
CCCS(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)c2ccc(C#N)cc2)cc1F	762471672	JGKLZXALTBBSHU-UHFFFAOYSA-N	440.478	1.472	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)C(C)C)cc1NC(=O)C(=O)NNC(=O)c1ccccc1	763430373	FSUQBIYVHSCADP-UHFFFAOYSA-N	432.502	1.424	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)cc2)C[C@@H](C)O1	763445831	LJFOARNGXNPLCS-OKILXGFUSA-N	441.444	1.608	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3n2)cc1N1CCOC1=O	763465893	FBNINYABMFPXPB-UHFFFAOYSA-N	433.424	1.900	50	20	IDGD	
O=C(NNC(=O)c1ccccn1)C(=O)Nc1ccc(C(=O)NCc2ccccc2F)cc1	763466384	HNKKYRXZMBRSEN-UHFFFAOYSA-N	435.415	1.550	50	20	IDGD	
CCCOc1ccc(NC(=O)C(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)cc1	763538385	AUYFUQYZJHUTRV-UHFFFAOYSA-N	431.445	1.901	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cc(NC(C)=O)ccc2C)cc(OC)c1OC	763538585	DLWLSBQHWASMFL-UHFFFAOYSA-N	444.444	1.379	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(N(C)C)cc2C)cc(OC)c1OC	763538626	FFASZUYZGRPDAN-UHFFFAOYSA-N	430.461	1.487	50	20	IDGD	
COC(=O)c1cc(Cl)ccc1NC(=O)C(=O)NNC(=O)COc1cc(C)cc(C)c1	763650862	RJJDCHRQDVXDCJ-UHFFFAOYSA-N	433.848	1.908	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(N2CCOC2=O)cc1	763714494	XHHSPQMYFUEQFN-UHFFFAOYSA-N	426.429	1.371	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccco3)nc3ccccc23)cn(C)c1=O	763762922	GKKNRCYFKJNWFR-UHFFFAOYSA-N	445.435	1.902	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2ccc(NC(C)=O)c(Cl)c2)c1	763770978	DCINMCYKDFGTOG-UHFFFAOYSA-N	434.836	1.715	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2ccccc2O[C@H]2CCOC2)c1	763772627	NXPCOQPHYGYWDX-AWEZNQCLSA-N	429.429	1.271	50	20	IDGD	
COC(=O)CCOc1ccc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCC3)cc1	763784268	DWJZRNKYPMBVND-UHFFFAOYSA-N	431.470	1.578	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)nc(C)n3C)c2ccccc2c1=O	763786994	ULAQEITXCRCQLW-UHFFFAOYSA-N	447.455	1.011	50	20	IDGD	
Cc1nc(-c2ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc3cccc(C)c3C)cc2)n[nH]1	763848433	HOXHXHFTILSRTD-AWEZNQCLSA-N	436.472	1.950	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)N2C[C@@H](C)Oc3ccccc32)cc1	763859443	BCLRSVIJYUZZOC-HUUCEWRRSA-N	427.457	1.814	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)C(=O)Nc2ccc(CN3CCOC3=O)cc2)cc1	763897534	ZZESXKIHVKBJKI-UHFFFAOYSA-N	442.497	1.825	50	20	IDGD	
Cc1ncc(-c2ccc(NC(=O)C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)cc2)o1	763921047	GRSOLNQLJONIKH-UHFFFAOYSA-N	432.400	1.025	50	20	IDGD	
COC(=O)N(C)Cc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccc(Cl)cc2)cc1	763936695	PFSKZYBZAHEQOO-UHFFFAOYSA-N	432.864	1.867	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3ccc4c(c3)C(=O)N(C)CC4)cc2C1	763944116	WHJZADRJDNLLAB-LBPRGKRZSA-N	440.525	1.901	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)N1C[C@@H]2CCCN2c2ccccc21	764004854	PBSOMOGDJJYGOS-ZDUSSCGKSA-N	446.305	1.564	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1ccc(OC2CCC2)c(F)c1	764005333	WTKSKWYYNCDPEZ-UHFFFAOYSA-N	429.404	1.928	50	20	IDGD	
CCOC(=O)C(C)(C)n1cc(NC(=O)C(=O)NNC(=O)c2cccc3ccccc23)cn1	764059041	YGHAWOWOUIEMDI-UHFFFAOYSA-N	437.456	1.734	50	20	IDGD	
CC[C@@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(C)c(S(=O)(=O)N2CCCCCC2)c1	764086097	SPZMTXXCAFEITD-CQSZACIVSA-N	438.550	1.692	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)nc1)C(=O)Nc1ccc(OCCN2CCCCC2)cc1	764102249	XAYMRVPRQMHAGH-UHFFFAOYSA-N	445.907	1.999	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2ccc(-n3cncn3)c(Cl)c2)cc1	764131654	LVWIQQIGNQBTGX-UHFFFAOYSA-N	442.863	1.648	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2cc(Br)ccc2O)cnn1CC(C)C	764281077	WYJYBSWVHSUHHD-UHFFFAOYSA-N	438.282	1.715	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@H]2C)ccc1NC(=O)C(=O)NNC(=O)Cc1cc[nH]n1	764294108	VDDYWTWYCNYLBF-CQSZACIVSA-N	426.477	1.061	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)C(=O)Nc1ccc(OCCNC(=O)OC(C)(C)C)cc1	764297632	GIQOORRSGYHBLV-UHFFFAOYSA-N	446.464	1.021	50	20	IDGD	
CC[C@@H](Cc1cccc(Br)c1)C(=O)NNC(=O)CNC(=O)c1cccnc1	764344875	KLQFDPHZAWPITL-AWEZNQCLSA-N	433.306	1.990	50	20	IDGD	
CC(C)(C)NC(=O)c1cccc(NC(=O)C(=O)NNC(=O)COCc2ccccc2)c1	764366516	MVSBINYPULDFRF-UHFFFAOYSA-N	426.473	1.518	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2cccs2)[nH]n1)Nc1ccc(CN2C(=O)CNC2=O)cc1	765306339	BPWIPEMQCLEUSS-UHFFFAOYSA-N	439.457	1.657	50	20	IDGD	
C[C@H](NS(=O)(=O)c1ccc(C#N)cc1)C(=O)NNC(=O)c1cccc(OC(F)F)c1	765406006	KTNSPPXVUUTZEZ-NSHDSACASA-N	438.412	1.288	50	20	IDGD	
Cn1nccc1S(=O)(=O)NC(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccccc1	765658330	OZSQCHDVALRQDI-FOWTUZBSSA-N	435.469	1.609	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cn(-c4cccc(C)c4)nn3)CC2)cc1	765748136	JPOMJQMNHNTUTL-UHFFFAOYSA-N	447.543	1.463	50	20	IDGD	
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	765895654	XNNBZGXCUXKMMC-HNAYVOBHSA-N	434.500	1.398	50	20	IDGD	
CC(C)n1cc2c(n1)[C@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)CCC2	765917968	PUVNKIFKFKTIJD-QGZVFWFLSA-N	448.549	1.736	50	20	IDGD	
CCOc1c(Cl)cc(NC(=O)C(=O)NNC(=O)Cn2nc(C)cc2C)cc1Cl	768237536	MHPDYXPDGQLSBM-UHFFFAOYSA-N	428.276	1.992	50	20	IDGD	
O=C(NNc1ccc([N+](=O)[O-])cc1)[C@@H]1CCCN1S(=O)(=O)c1cccc([N+](=O)[O-])c1	768247885	ZFUNBBAXQBXIJY-INIZCTEOSA-N	435.418	1.799	50	20	IDGD	
CC1CCC(NS(=O)(=O)CC(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)CC1	768262493	JGDCPPGNQMWLGT-UHFFFAOYSA-N	425.536	1.397	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)[C@H](C)N2C(=O)[C@H]3CCCC[C@@H]3C2=O)n[nH]1	768273674	ISWYKEIQUZTAOU-IHRRRGAJSA-N	439.472	1.410	50	20	IDGD	
COc1cc(C(=O)NNc2cc(C#N)cc(Cl)n2)cc(NS(C)(=O)=O)c1OC	768703397	RLLQAHDMXXAFNM-UHFFFAOYSA-N	425.854	1.752	50	20	IDGD	
CCc1ccc(NC(=O)NNc2c(OC)cccc2S(C)(=O)=O)cc1S(N)(=O)=O	769231398	FOGUZHXVBBUUGL-UHFFFAOYSA-N	442.519	1.457	50	20	IDGD	
C[C@@H]1C[C@@H](NC(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)CCO1	770356473	WPVSTGGTVVYWBJ-BEFAXECRSA-N	435.488	1.900	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccccc1)c1ccc2c(c1)OCCO2	770406270	MHLRPOBRXJVHTM-KRWDZBQOSA-N	445.497	1.462	50	20	IDGD	
Cc1cc(NC(=O)[C@@H](C)SCC(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)no1	770966025	JFGMNMLPDFWZHI-SNVBAGLBSA-N	448.509	1.787	50	20	IDGD	
CC(C)CNS(=O)(=O)c1ccc(C(=O)O[C@@H](C)C(=O)NNC(=O)CC(C)C)cc1	771995840	GOUOXKPSBPFXRY-AWEZNQCLSA-N	427.523	1.360	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCCNC(=O)NNC(=O)c2cccc(N(C)C)c2)s1	772631002	NVZPYWGFEBIKCM-UHFFFAOYSA-N	425.536	1.045	50	20	IDGD	
CCn1cnc2c1c(=O)n(CC(=O)NN=C1CC3(CCC3)C1)c(=O)n2Cc1ccccc1	772837347	RJTSRUDLAMTRDC-UHFFFAOYSA-N	434.500	1.864	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)CCNS(=O)(=O)c1ccccc1F	772971160	JLNJGXLZXCGXDB-LBPRGKRZSA-N	443.884	1.762	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)CCOc2cccc(C(N)=O)c2)C1	773411375	KAPFTOXUBILULA-HNNXBMFYSA-N	434.493	1.349	50	20	IDGD	
Cc1nc(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)ccc1Br	773522184	WOOWXVQOMLHVNT-CYBMUJFWSA-N	435.234	1.078	50	20	IDGD	
O=C(NC[C@H]1CCCO1)Nc1ccc(NC(=O)C(=O)NNc2ccccc2[N+](=O)[O-])cc1	773654555	XWJDPYPBTKUWLE-OAHLLOKOSA-N	442.432	1.977	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccc(C(N)=O)c(Cl)c1	774010020	UJMOVCUKCXGEEO-SECBINFHSA-N	439.255	1.646	50	20	IDGD	
C[C@@H](NCC(=O)NNC(=O)c1cccc(C#N)c1)c1ccc(OCC(=O)NC2CC2)cc1	774967051	IDMKBTOLAOQYGQ-OAHLLOKOSA-N	435.484	1.327	50	20	IDGD	
CCOC1CC(CNC(=O)NNC(=O)COc2cc(C)ccc2C)(N2CCOCC2)C1	775159628	RWIKWDBYDGMOEA-UHFFFAOYSA-N	434.537	1.283	50	20	IDGD	
C[C@H]1C[C@H](C(=O)NNc2nccnc2Cl)[C@H](C(=O)NNc2nccnc2Cl)C1	776148710	TWDYEMSEWGHVHA-OWUUHHOZSA-N	425.280	1.822	50	20	IDGD	
CCOC(=O)c1ccc(C(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)nc1C	776202210	RHLABMXIBXOGBR-UHFFFAOYSA-N	449.508	1.816	50	20	IDGD	
C[C@H]1CN(C(=O)NNC(=O)c2ccc(COc3ccccc3)o2)CCN1S(C)(=O)=O	776317750	WVSLTYYMNYNTAA-AWEZNQCLSA-N	436.490	1.179	50	20	IDGD	
COc1cc(OC)c(C(=O)N2CCN(S(=O)(=O)CBr)CC2)cc1OC	777836082	FGWGMNUYLTUQNJ-UHFFFAOYSA-N	437.312	1.152	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)c1	778217781	KHEMXJXTYMJPSK-UHFFFAOYSA-N	442.400	1.398	50	20	IDGD	
COc1ccc(Cl)cc1N1C[C@@H](C(=O)NNC(=O)CNC(=O)OC(C)(C)C)CC1=O	778433228	GRCQLWOBZKLBTN-NSHDSACASA-N	440.884	1.374	50	20	IDGD	
Nc1nc(Cl)cc(NNC(=O)CCNS(=O)(=O)c2ccc(Br)cc2)n1	779374066	DBSVFJNYPNOMCZ-UHFFFAOYSA-N	449.718	1.286	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)Cc2ccc(S(=O)(=O)N3CCOCC3)s2)c1	781035062	YJDPGPBWMIKOLI-UHFFFAOYSA-N	439.515	1.241	50	20	IDGD	
C[C@H]1CN(Cc2ccccc2NC(=O)C(=O)NNC(=O)c2ccc(O)cc2)C[C@H](C)O1	782833041	XHDNAQVRZBYWCZ-GJZGRUSLSA-N	426.473	1.401	50	20	IDGD	
COc1cccc(Cn2nccc2NC(=O)C(=O)NNc2cc(C)nc(C)n2)c1OC	783325285	IJOBVQVQXBVBBA-UHFFFAOYSA-N	425.449	1.437	50	20	IDGD	
O=C(NNc1ccc(Cl)cc1)C(=O)Nc1cccc(S(=O)(=O)N2CCOCC2)c1	783336328	JTGXGXINBWHOEK-UHFFFAOYSA-N	438.893	1.443	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2cc(Cl)ccc2Cl)cc1OCC(N)=O	783368968	DYHSGMCHSAJHJX-UHFFFAOYSA-N	427.244	1.948	50	20	IDGD	
Cc1cc(C)c(NNC(=O)C(=O)Nc2c(C)nn([C@@H]3CCS(=O)(=O)C3)c2C)c(C)c1	783369146	JQHBLIRGQXYXLM-MRXNPFEDSA-N	433.534	1.867	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)[C@H](CC(C)C)NC(C)=O)c2ccccc2c1=O	783379419	OVWLKSZJJCEOFT-SFHVURJKSA-N	429.521	1.899	50	20	IDGD	
CCOC(=O)[C@@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNc2ncccc2Cl)cc1	784814726	JNOOKEDBGKFJGB-LLVKDONJSA-N	433.852	1.498	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNc2cccc([N+](=O)[O-])c2)cc1OC	784828031	DMWMCSFPRKBWAY-UHFFFAOYSA-N	437.434	1.447	50	20	IDGD	
Cc1nc2nc(C(F)(F)F)nn2c(C)c1CCC(=O)NNc1ccc(-n2ccnc2)nn1	788181542	UUVZQKHDAJMAQZ-UHFFFAOYSA-N	446.397	1.812	50	20	IDGD	
COc1ccc(F)c(C(=O)N2CCN(S(=O)(=O)CBr)CC2)c1OC	788526708	XANPEGXWRDSILY-UHFFFAOYSA-N	425.276	1.283	50	20	IDGD	
CCOC(=O)c1ccc(C)c(S(=O)(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1	788749209	UABXCEBNAILVRI-UHFFFAOYSA-N	447.517	1.188	50	20	IDGD	
O=C(NNC(=O)C(=O)NC1CC1)C(=O)Nc1ccc(-c2ccc(Cl)cc2Cl)nc1	789594291	IFMJKBDTRDNHTC-UHFFFAOYSA-N	436.255	1.420	50	20	IDGD	
Cc1cc(F)c(Br)cc1NC(=O)C(=O)NNC(=O)Cc1cn2ccccc2n1	789597928	ZIYWCXKKGKNVFT-UHFFFAOYSA-N	448.252	1.873	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(C(N)=O)c(OC(C)C)c2)cc1C	789731117	ABKJDFUSHZDCSV-UHFFFAOYSA-N	442.472	1.354	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)C1CCN(c2oc(-c3ccco3)nc2C#N)CC1	790062943	DFUOLLLFTJSWKI-UHFFFAOYSA-N	445.476	1.959	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)Nc1nnc(-c2ccc(Cl)cc2F)s1	791899668	JUGDXQPQGUHIIO-SSDOTTSWSA-N	433.874	1.585	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)CCN2CCN(C(=O)OC(C)(C)C)CC2)cc1C	792014150	GIIRFCSAJLGHIY-UHFFFAOYSA-N	434.537	1.772	50	20	IDGD	
COc1ccc(OC)c(C2=NO[C@@H](C(=O)NNc3c(OC)cccc3S(C)(=O)=O)C2)c1	792328706	RMMZXLBRZRCRGM-QGZVFWFLSA-N	449.485	1.752	50	20	IDGD	
COCCOC1CCC(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)CC1	792778139	RQSUGVVCZKQPRX-UHFFFAOYSA-N	432.565	1.568	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)cc1)C(=O)Nc1ccc2c(c1)N(CC(F)F)CCS2	793034812	JBGVXFWQNUATAT-UHFFFAOYSA-N	436.440	1.969	50	20	IDGD	
CCC(CC)N(CCNS(=O)(=O)CBr)S(=O)(=O)CBr	795380784	ZOYMUWQAOSPFID-UHFFFAOYSA-N	444.211	1.431	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc3nc(N4CCOCC4)sc3c2)n1	797370348	LCRUAHVLXPGKFP-UHFFFAOYSA-N	440.485	1.236	50	20	IDGD	
CN(CCO)S(=O)(=O)c1ccc(C(=O)NNc2ccccc2OC(F)(F)F)cc1	798340301	CQLRJIDEFIARQM-UHFFFAOYSA-N	433.408	1.955	50	20	IDGD	
Cc1cc(O[C@H]2CCN(C)C2=O)ccc1NC(=O)C(=O)NNC(=O)Cc1ccc(F)cc1	799258531	FOWCVXLVELXJFZ-SFHVURJKSA-N	442.447	1.072	50	20	IDGD	
CN(C)c1ncn(-c2cccc(NC(=O)NNC(=O)c3nnc(O)c4ccccc34)c2)n1	799418695	JZILAFZTLJAFSW-UHFFFAOYSA-N	433.432	1.449	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)NCc3cccc(CS(N)(=O)=O)c3)cc2C1	799856812	FWVUBTSWBVIBFL-LBPRGKRZSA-N	436.559	1.806	50	20	IDGD	
O=C(N=c1cc[nH]cc1)NNC(=O)c1ccc2c(=O)n(Cc3ccco3)c(S)nc2c1	802035750	KWYJTMQDLXEBIJ-UHFFFAOYSA-N	436.453	1.610	50	20	IDGD	
O=C(Cn1cc(Br)c(O)nc1=O)NNC(=O)Nc1ccc(OC(F)F)cc1	802044767	DXOYNICJBPFLNJ-UHFFFAOYSA-N	448.180	1.166	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)[C@H]1CCN(c2ccc(C#N)cc2F)C1	804381039	GOVOTYBZAUBAJS-AWEZNQCLSA-N	434.472	1.379	50	20	IDGD	
CC1(C)CC(=O)c2cc(NC(=O)C(=O)NNC(=O)[C@@H]3COc4ccccc4O3)ccc2O1	806972986	VCDNCVNWEBBNLG-SFHVURJKSA-N	439.424	1.356	50	20	IDGD	
COCCNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)c1	806974106	UQISVXNIXOFIKH-UHFFFAOYSA-N	442.516	1.365	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)C(=O)Nc1cc(CS(C)(=O)=O)ccc1OC)c1ccccc1	806979801	GKLZDFACIKCQSA-MRXNPFEDSA-N	447.513	1.520	50	20	IDGD	
COc1cc(C)c(CN(C)C(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1OC	807130698	KWULFAFGHWNZRG-UHFFFAOYSA-N	449.533	1.792	50	20	IDGD	
CCC(CC)NC(=O)[C@@H]1CN(C(=O)C(=O)NNc2ncccc2F)c2ccccc2O1	807301648	FIVFUPVNDWFMQK-KRWDZBQOSA-N	429.452	1.763	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)NCCCn1cc(Br)cn1	807614113	WVVGWDFQZKPTJN-UHFFFAOYSA-N	428.312	1.864	50	20	IDGD	
O=C(NN=Cc1ccc(C(F)(F)F)[nH]1)c1cccc(S(=O)(=O)N2CCOCC2)c1	807943458	GUJQYCWOCNNZEE-UHFFFAOYSA-N	430.408	1.818	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNS(=O)(=O)c1nc(C)n(C)c1Br	808071366	WNWMWEYBCWBQHW-UHFFFAOYSA-N	437.703	1.776	50	20	IDGD	
Cc1nc(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)ccc1-c1ccccc1	810384285	BTQJRVJGQNEPQZ-LJQANCHMSA-N	432.436	1.983	50	20	IDGD	
CNC(=O)c1cc(Oc2ccc(NC(=O)C(=O)NNc3ncccn3)cc2F)ccn1	810388687	ZRUIELCOYJIHTM-UHFFFAOYSA-N	425.380	1.244	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1cccc2c1OCC(=O)N2	810407205	PFICQQVMAFMVJE-JTQLQIEISA-N	432.820	1.224	50	20	IDGD	
CO[C@H](CNC(=O)OC(C)(C)C)CC(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	812725220	AQVXRBAYZCKOFL-AWEZNQCLSA-N	430.527	1.310	50	20	IDGD	
Cc1cc(S(C)(=O)=O)cc(C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)c1C	812732000	QICQTXHKNUJPLD-UHFFFAOYSA-N	425.532	1.714	50	20	IDGD	
Cc1ccc([C@H](CN2CCOCC2)NC(=O)NNC(=O)COc2ccccc2F)cc1	813493441	APJSTKIEOBUNSI-IBGZPJMESA-N	430.480	1.917	50	20	IDGD	
O=C(NNC(=O)C1(S(=O)(=O)c2ccccc2)CCOCC1)Nc1ccc2c(c1)OCO2	813575431	UPZDBCWYKOSPGQ-UHFFFAOYSA-N	447.469	1.591	50	20	IDGD	
CC(=NNC(=O)CNC(=O)c1cccnc1)c1cc(Br)ccc1OCC(=O)O	814873979	YRDCVRZZABQDJA-UHFFFAOYSA-N	449.261	1.578	50	20	IDGD	
CC(=NNC(=O)Nc1ccc(S(N)(=O)=O)cc1)c1nnn(-c2ccc(F)cc2)c1C	814963637	FUMNVENIJZSMMR-UHFFFAOYSA-N	431.453	1.908	50	20	IDGD	
Cc1nc(Cn2nnc(NC(=O)C(=O)NNc3c(Cl)cccc3Cl)c2C)no1	815574335	MJZRLKCRDCSSSA-UHFFFAOYSA-N	425.236	1.715	50	20	IDGD	
C=C(C)COc1cccc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)N(C)C)c1	815751955	VXKSYCFQUULTIL-UHFFFAOYSA-N	432.502	1.974	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCO1)C(=O)Nc1cccc(CS(=O)(=O)C2CCCCC2)c1	815779671	QELRVOLRGBDCIB-QGZVFWFLSA-N	437.518	1.199	50	20	IDGD	
CCOc1ccc(NNC(=O)C(=O)Nc2cccc(N3CCN(C(C)=O)CC3)c2)cc1	815815708	NVFPXYMTKDHXCE-UHFFFAOYSA-N	425.489	1.836	50	20	IDGD	
Cc1nn(C)c2nc(-c3ccccc3)cc(C(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)c12	836699908	KLZMTEJACJMIDJ-CQSZACIVSA-N	427.486	1.139	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)Cc1ccc(-n2cnnc2)cc1	857431150	CUXPIODGPXKNAL-UHFFFAOYSA-N	433.516	1.170	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)[C@H](CC(C)C)N1C(=O)[C@H]2CC=CC[C@H]2C1=O	864001384	ZETSQZQEUOVHOB-BBWFWOEESA-N	443.500	1.587	50	20	IDGD	
O=C(COC(=O)c1cccc(NC(=O)C2CC2)c1)NNC(=O)[C@H]1COc2ccccc2O1	899131928	ZFXGJAVNHASMAE-GOSISDBHSA-N	439.424	1.179	50	20	IDGD	
C[C@@H](CCC(=O)NNC(=O)c1ccccc1F)CC(=O)NNC(=O)c1ccccc1F	915806195	IWJARNKFMJZYSX-ZDUSSCGKSA-N	432.427	1.993	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1ccccc1N(C)C(=O)C1CC1	916134491	NACMJGYMCDSBAD-UHFFFAOYSA-N	443.529	1.736	50	20	IDGD	
C[C@@H]1CN(c2ccc(CNC(=O)NNC(=O)c3ccc4c(c3)OCCO4)cn2)CCO1	916393051	RGKWXXSYSIMVKH-CQSZACIVSA-N	427.461	1.222	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)COc1ccc(C#N)cc1)N1CCN(c2ccccc2)CC1	916515047	YTMWJFXBOACHJF-SFHVURJKSA-N	436.516	1.478	50	20	IDGD	
CCS(=O)(=O)N(C)CCCNC(=O)NNC(=O)c1sc(-c2ccccc2)nc1C	916580147	GDMDPCJIUQDWKM-UHFFFAOYSA-N	439.563	1.734	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)CCNS(=O)(=O)/C=C\c1ccccc1	917360465	YWHUEBOFNLAIMX-KAMYIIQDSA-N	427.486	1.384	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2cc(F)cc3nc(S)[nH]c23)c2ccccc2c1=O	917494841	WIVYUPYTOVVUJA-UHFFFAOYSA-N	426.433	1.795	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)c2cc(I)ccc2-n2cnnn2)n1	918007744	WFVRLESHCYLTST-UHFFFAOYSA-N	436.217	1.431	50	20	IDGD	
Cc1nn(Cc2ccc(F)cc2)c(Cl)c1C(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1	919888912	HQEAWSNLSBDCHC-CYBMUJFWSA-N	443.888	1.163	50	20	IDGD	
C[C@@H](COc1ccc(F)cc1F)NC(=O)NNC(=O)c1csc(N2CCOCC2)n1	919922383	VVDOWGGSMBIESL-NSHDSACASA-N	441.460	1.669	50	20	IDGD	
O=C(NNS(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-])c1csc(N2CCOCC2)n1	920310422	PNWXYYJXKPGCMJ-UHFFFAOYSA-N	447.882	1.165	50	20	IDGD	
Cn1c(C=NNC(=O)c2nc(Cl)c(Cl)c(N)c2Cl)nc2c1c(O)nc(=O)n2C	920364105	PAXHCVDOBNQFSW-UHFFFAOYSA-N	445.654	1.074	50	20	IDGD	
CCN(c1ccccc1)S(=O)(=O)c1ccc(C(=O)NNC(=O)CN2CCCC2=O)cc1	920825465	BCYPINNVKJELMU-UHFFFAOYSA-N	444.513	1.285	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)c1ccccc1)C(=O)NNC(=O)NCc1ccco1	920856643	YMWMAPOEPJQXER-OAHLLOKOSA-N	426.520	1.210	50	20	IDGD	
O=C(CS(=O)(=O)c1cccc(Br)c1)NNC(=O)NCCc1cccs1	920859796	DECXVKHOUCKBAQ-UHFFFAOYSA-N	446.348	1.857	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)C(F)(F)c2ccc(F)cc2)cc1OC	920894980	HPTGPMPCRSTRGQ-UHFFFAOYSA-N	426.347	1.939	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)Nc1nc(CN2CCOCC2)cs1	920931285	JOPMHWPUWPGDQI-UHFFFAOYSA-N	435.506	1.606	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1ccc(Br)cc1)c1cccc(S(N)(=O)=O)c1	1115854959	UADGFHCOKBEWIM-SNVBAGLBSA-N	441.307	1.802	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@H](C(=O)NNC(=O)c2ccccc2Cl)[C@H](C)O)cc1	1319920863	WBGQKJDJMRJHTI-LRDDRELGSA-N	425.894	1.137	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NC2CCN(C[C@@H]3CCOC3)CC2)cc(OC)c1OC	1328880944	PWTHOAKPAUKRAL-AWEZNQCLSA-N	436.509	1.157	50	20	IDGD	
O=C(c1c[nH]c2ncccc12)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1777710906	NNQFLOJCRHBKGK-CXAGYDPISA-N	425.258	1.697	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Br)C2)c1cc2n(n1)CCC2	1779121643	FLUHJAKRSDRDPU-RVKKMQEKSA-N	443.317	1.647	50	20	IDGD	
Cn1ccc2c(O)ncc(C(=O)N3CCO[C@]4(CCN(C(=O)CO[Si](C)(C)C)C4)C3)c21	1779298957	QXMNQJUYSDJNQO-NRFANRHFSA-N	446.580	1.574	50	20	IDGD	
COc1ccc(CC(=O)N2CCO[C@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)c(C#N)c1	1779300705	VIKYJIPUMGYWJN-QFIPXVFZSA-N	445.592	1.791	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(-c4ccncc4)[nH]n3)C2)C1	1779593809	WFUQPAYLWHXWPD-QRWLVFNGSA-N	433.896	1.169	50	20	IDGD	
Cn1ccc(=O)cc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Br)C2	1780058923	KMIBEOJWYLTGGF-RVKKMQEKSA-N	444.301	1.203	50	20	IDGD	
CN(C)c1ccc([N+](=O)[O-])c(C(=O)N2CC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)c1	1780124503	SZUPQGFKTFDGGR-SFHVURJKSA-N	445.303	1.908	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)c(O)c1	1780555419	GERXZXTUIALKEC-KZULUSFZSA-N	427.295	1.628	50	20	IDGD	
O=C(c1cccc2c1OCCO2)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781329608	HWPGPAMPEZYDOD-MAUKXSAKSA-N	443.269	1.592	50	20	IDGD	
CC(=O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C(C#N)=C/c2ccc(F)cc2F)C1	1781597005	KRZZLWYOJOXUBC-UNHHPSKZSA-N	431.439	1.975	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(OC(F)F)cc3)C2)C1	1781703307	BFFTYKNQBCXDQZ-KXBFYZLASA-N	432.851	1.985	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1cscn1)C2	1781998262	QAZKZBLGJAMWRQ-SUYBPPKGSA-N	430.368	1.983	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cncc(O)c2)C1	1782042727	YVSVQGKREHXWAH-WBHUJUFNSA-N	426.311	1.698	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnn4c3OCCC4)C2)C1	1782281628	HWFWRKMLOYCARP-KSSFIOAISA-N	441.326	1.283	50	20	IDGD	
O=C([C@@H](F)Br)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H]2CC[C@H](O)CC2)C1	1782325613	BSTFKHUQNDPADR-VFCJXBEMSA-N	435.334	1.742	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)CCCn3ccnc3C)CCO2)C1	1783354719	VBEMFQUIFRCEGA-QFBILLFUSA-N	441.370	1.975	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3snnc3C3CC3)CCO2)C1	1783534360	ICRMKDAAQZGGIJ-QLJPJBMISA-N	429.340	1.642	50	20	IDGD	
CC(C)(C)OC(=O)NCC1(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Cl)C[C@@H]32)CC1	1783592581	JETWOYUCVBAYGH-ZQDZILKHSA-N	447.935	1.805	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cn4c(Cl)cccc4n3)CCO2)C1	1783876239	XIGJGKPIAMIFQE-DJJJIMSYSA-N	441.315	1.685	50	20	IDGD	
Cc1cc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]3C2)on1	1783968541	BHMQKMIYBZUGKJ-XTBFLFJDSA-N	428.327	1.536	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ncccc3C(F)(F)F)C[C@@H]21)[C@H](O)CCl	1784091618	YYCYNLPGGUOKBV-VTPLQMEGSA-N	435.830	1.293	50	20	IDGD	
COc1ccc(CCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]3C2)c(F)c1	1784091753	ANOFMQJQMRIMSX-CBVHJVASSA-N	442.915	1.346	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@](C)(O)C(F)(F)F)[C@H]2C1	1784876000	OMYVXDXDYUCCHL-UQXKVLDMSA-N	435.270	1.516	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H]1C[C@H](C(=O)N2CC[C@@]3(CN(C(=O)[C@@H](F)Cl)CCO3)C2)C1	1785512659	ASMOGDICSFSKNW-FORMXFIPSA-N	433.908	1.654	50	20	IDGD	
CC(C)n1nc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Cl)C[C@@H]32)cc1C(=O)O	1785716704	YXVZYYJZCQNDFU-LWWSYDQCSA-N	430.864	1.290	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)c1cnoc1C1CC1	1786287018	BFFCWBIKEQOISM-QEJZJMRPSA-N	426.311	1.930	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN(C)C(=O)OC(C)(C)C)[C@H]2C1	1786622911	VXOGPOQHLCZYEJ-JONQDZQNSA-N	447.960	1.087	50	20	IDGD	
CCC[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]21)n1cccc1	1787465942	HFVDLIDGVPDSLW-MUGJNUQGSA-N	447.580	1.182	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)[C@@H]3[C@H]4C=CS[C@@H]43)CCC2)cc1)c1ccc(B(O)O)cc1	1788143388	AGYUUORKQMDYJN-AQNXPRMDSA-N	434.326	1.989	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc(OCF)cn3)C[C@@H]21	1789868435	FPGVSNVLPQXKAU-XBPIAWKYSA-N	449.310	1.612	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccn(C(C)(C)C)n3)C[C@@H]21	1791252056	AFSUDCQOKVEXJV-MPTYRVRUSA-N	426.945	1.485	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)COc1ccc(O)cc1	1792777493	JFPXZYMWWRAODT-OESLAJAZSA-N	431.316	1.597	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)[C@H]1CCc2ccoc2C1	1793121154	TUSJSGOZKMZLIX-PLPKTUSISA-N	429.286	1.665	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CC[C@H](C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](O)CCl)C3)C1	1793335719	BIBKUNCAXTZXFE-QROFKTNTSA-N	443.972	1.918	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1nccc2nc[nH]c12	1796241303	BUJUOBSQJPJCSE-GFQSEFKGSA-N	436.310	1.335	50	20	IDGD	
COc1ccc(OC)c(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Cl)c1	1796362478	CABULCNFBJPPCP-GTYSZEQSSA-N	428.888	1.760	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CC[C@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Cl)C1	1796365172	VBJSAUFYRZVSHQ-DERJNBNXSA-N	447.935	1.804	50	20	IDGD	
CCOC(=O)[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](F)Cl	1796811516	RTZMEVUVBJVNBJ-ZUWCUPBKSA-N	449.907	1.615	50	20	IDGD	
C[C@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](F)Br)C2)[C@H]1SC(=N)NC1=O	1796879380	NHBWQXDILBULPL-ALMWHKAHSA-N	435.319	1.118	50	20	IDGD	
C[C@H]1CCc2c(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@@H](C)CBr)C4)n[nH]c21	1796968229	XHEYYJRBPYHFHO-BLXSCJOCSA-N	439.354	1.694	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(Cl)nn1	1798037335	CDWRFDZRPVPVEG-FBKDDSFISA-N	431.718	1.507	50	20	IDGD	
COc1cccnc1CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@](C)(Cl)CCl	1799274325	XSGPIOFZPKPVAJ-VLBMKZOESA-N	444.359	1.849	50	20	IDGD	
CC(=O)N[C@@](C)(C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2)c1ccccc1F	1799407280	WDHIOLVCMGNIOW-RSSYPWKWSA-N	443.878	1.301	50	20	IDGD	
O=C(Cc1cccc(C(F)(F)F)c1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2	1800406855	NTPYLPAHIRNPIE-YXPYIKCWSA-N	434.842	1.437	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)Nc1nccs1)C2	1800757806	QNYBQQWVQMFUDE-NWBUJAPZSA-N	431.356	1.317	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc3ncccc3c1)C2	1800971059	OXUSBUGVJQKENQ-NYUBLWNDSA-N	431.920	1.621	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ncccc1Br)C2	1800976947	MOVNTRWKGFLJCE-ZMJPVWNMSA-N	446.729	1.301	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(Cl)cc(OC)c1	1801813738	QHFOEJSBOPOYAV-RMHZUWNSSA-N	431.316	1.806	50	20	IDGD	
CCN1CCC(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)CBr)C3)CC1	1802171142	WWDHZXNXKKHGOR-LLLHUVSDSA-N	430.387	1.339	50	20	IDGD	
COc1cccc(Cl)c1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCC(=O)NN(C)C	1802343446	CRNYPNQZQCTHRB-QDMKHBRRSA-N	436.940	1.973	50	20	IDGD	
CC(C)(CCl)C(=O)NC[C@@H]1CCN(C(=O)CCN2C(=O)C=CC2=O)[C@@H]1c1cccnc1	1802898557	XTZZKEGZSIUBMB-OXJNMPFZSA-N	446.935	1.668	50	20	IDGD	
COc1ccc(CC(=O)N2CCC3(CCCN(C(=O)[C@@H](O)CCl)C3)CC2)c(C#N)c1	1805525475	SRWLTTISHNVLPU-IBGZPJMESA-N	433.936	1.940	50	20	IDGD	
CC(=O)N[C@H](C)C(=O)N1CC[C@H](CNC(=O)CCBr)[C@@H]1c1cccnc1	1806346207	BLYAZAMCOSELPI-VMGRFDJRSA-N	425.327	1.397	50	20	IDGD	
O=C(Cn1cc([N+](=O)[O-])cn1)N1CCCC2(CCN(C(=O)[C@H](F)Br)CC2)C1	1806934461	WJTTXCGJDOAXJG-AWEZNQCLSA-N	446.277	1.713	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@@H](CNC(=O)C(=O)N(C)C)[C@H]1c1cccnc1	1806936756	RBWFJCUHKYZGCS-VHDGCEQUSA-N	425.327	1.207	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)C2=CCCS2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1	1807365480	OZZRVWHZICLADU-XLIONFOSSA-N	437.330	1.102	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)[C@H]2CC=CCC2)[C@@H]1c1cccnc1	1808147772	LQRQSEMEHOUECY-JLMWRMLUSA-N	427.549	1.817	50	20	IDGD	
CNC(=S)NCCC(=O)NC[C@H]1CCN(C(=O)C(Cl)Cl)[C@@H]1c1cccnc1	1810309660	CDWFKLWPRFTOAY-TZMCWYRMSA-N	432.377	1.375	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2ccc(F)s2)[C@@H]1c1cccnc1	1813070123	GEVGQLLQRKPWFP-FOIQADDNSA-N	447.536	1.975	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)ccn1	1813073261	KJCZDLLBUHPVRR-SIKLNZKXSA-N	438.532	1.478	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)[C@@H]2CCc3nc[nH]c3C2)[C@H]1c1cccnc1	1813327438	VQOLZAYPIWCPRX-DFYYWFRZSA-N	445.951	1.869	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](O)c3ccccc3)sc2C1	1814395301	JXZBYCBZGRJRRV-AUUYWEPGSA-N	445.545	1.162	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cncs2)[nH]n1	1819402041	KALCLQILXXJIMW-AWEZNQCLSA-N	440.489	1.484	50	20	IDGD	
CN1CCN(C2(C(=O)Nc3cc([C@H]4CCCCN4C(=O)[C@@H](F)Cl)[nH]n3)CC2)CC1	1820794610	CEGTWEHFUSOSIY-GDBMZVCRSA-N	426.924	1.716	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)c3[nH]cc4c3CCC4)sc2C1	1821202218	MIHQMOZKFLLRSA-ZDUSSCGKSA-N	444.561	1.559	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](C)O)CC2	1821305037	YZMBRFRORRIXKW-ONGXEEELSA-N	448.457	1.583	50	20	IDGD	
O=C(c1ccc2c(n1)OCCO2)N1CCC([C@H]2CCCCN2C(=O)[C@H](O)CCl)CC1	1824182472	DIBCAIDEYWGZEY-IAGOWNOFSA-N	437.924	1.686	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@H]1CCc2nc(NC(=O)[C@@H]3CCCS3(=O)=O)sc2C1	1824933527	FXILVVGXAFLOLQ-FZMZJTMJSA-N	445.639	1.484	50	20	IDGD	
CC(=O)NC(C)(C)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](C)Br)sc2C1	1825636464	VYOMROJDTJRSPS-PSASIEDQSA-N	431.356	1.753	50	20	IDGD	
Cc1ncc(C(=O)N[C@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)s1	1826086202	MKBHVAAFOFCQLA-NSHDSACASA-N	436.563	1.507	50	20	IDGD	
CC(C)n1ccc(C(=O)N[C@@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)n1	1826088765	NXPWYELIWOIZQU-CYBMUJFWSA-N	447.565	1.519	50	20	IDGD	
Cc1n[nH]c(C)c1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827051907	JRXUSQABJJHUPV-FQEVSTJZSA-N	438.337	1.253	50	20	IDGD	
Cc1cnn(CC(=O)N2CCCC[C@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)c1	1827233578	PTLZPULXVGAWHI-IBGZPJMESA-N	432.569	1.184	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@@H](O)CCl)CC3)cc1	1827726346	CVPIIIULFSBOHL-HIFRSBDPSA-N	436.921	1.927	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3CCSCC3)C2)C1	1830545566	KWZLZYLGWKKTEZ-KSSFIOAISA-N	449.411	1.617	50	20	IDGD	
O=C(/C=C\c1c[nH]c2ccccc12)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1830725067	DHXUAECCUQGUEM-JCHZHDRDSA-N	447.919	1.237	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CN(CCO)CCO)CC1	1831483722	VEOVBMXBVUYNAF-OALUTQOASA-N	432.005	1.300	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(OC)nn2C)CC1	1831826843	AUZDXMBLTPPZNJ-HOTGVXAUSA-N	426.945	1.916	50	20	IDGD	
C[C@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1833264864	MLNAYERZVFLNOD-IUODEOHRSA-N	438.794	1.189	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)Cn3cnc4ccccc43)CC2)CC1)[C@@H](O)CCl	1833312906	LEHCGWGYPHDVOJ-FQEVSTJZSA-N	447.967	1.208	50	20	IDGD	
C/C(=C\c1cccnc1)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)CCl)CC2)CC1	1833313075	ULMNHQWXXLVCOL-YFIXDKARSA-N	434.968	1.656	50	20	IDGD	
Cc1ncc(C(=O)NC2CCN(C3CCN(C(=O)[C@H](C)Br)CC3)CC2)cn1	1834066156	FUFNMSUXPJIVJF-ZDUSSCGKSA-N	438.370	1.754	50	20	IDGD	
COc1ncccc1C(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1834124785	HWLCRSAWCAYBBN-HXUWFJFHSA-N	425.913	1.425	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1)c1ncccn1	1834233169	BAVZSIMPJIYSEY-AWEZNQCLSA-N	428.306	1.352	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CC3CCOCC3)CCO2)C1	1835423767	JPLGTQIICPQBFI-QFBILLFUSA-N	447.370	1.433	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)C3=C(C)OCC3)CCO2)C1	1836274502	FRNJALHEBWXEOR-MAUKXSAKSA-N	431.327	1.311	50	20	IDGD	
CCN1CCC(C(=O)N2CCOC[C@@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)CC1	1837718165	YQLYIZWVEIZFLW-OAQYLSRUSA-N	441.645	1.026	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccoc3Cl)CCO2)C1	1838845325	NBHYGYLVQSJPPN-MEDUHNTESA-N	435.702	1.786	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(F)c[nH]3)C2)C1	1839966412	CVDMICZMXYHCGN-SUMWQHHRSA-N	432.290	1.397	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)[C@H]3CCc4nc[nH]c4C3)CCO2)C1	1840359957	UQWDPTXFWMPOQR-BTYIYWSLSA-N	438.956	1.236	50	20	IDGD	
O=C(CCc1ccoc1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1840516450	RGTCXYCONRSEAA-NVXWUHKLSA-N	433.274	1.359	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)C3CCSCC3)CCO2)C1	1840925045	JWRJGWOURNNTCB-ROUUACIJSA-N	439.405	1.822	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC12CN(C(=O)CNC(=O)c1cccs1)C2	1841286073	GSFAEPQMGUWTIQ-LBPRGKRZSA-N	428.352	1.712	50	20	IDGD	
CCOc1ccc(Cl)cc1C(=O)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843011991	RSAPFVCURPESHU-UHFFFAOYSA-N	442.708	1.549	50	20	IDGD	
O=C1CCCc2cc(C(=O)N3CC4(CCCN4C(=O)c4cccc(B(O)O)c4)C3)ccc21	1843013973	JOEWDPRRIJILNA-UHFFFAOYSA-N	432.285	1.016	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)[C@@H](C)Nc1ccccn1)C2	1843416341	YIVYEELTCPKRDM-SXJXFNOXSA-N	437.504	1.219	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC2(CCCN2C(=O)c2nc(OC)ccc2[N+](=O)[O-])C1	1843586855	WCWOYTQWYXLOJN-LLVKDONJSA-N	441.282	1.989	50	20	IDGD	
CC(C)CCC(=O)N1CC2(CCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)C1	1845039465	RFEFQORDXXHRQR-UHFFFAOYSA-N	429.565	1.972	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)CCOCCOCCOCCOC)C2	1845166794	QLQQRVBPFSYWNB-QGZVFWFLSA-N	434.961	1.294	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CC3(CCCN3C(=O)[C@@H](F)Br)C2)cc1O	1845219304	HLFYHCOIRWLDJN-CQSZACIVSA-N	428.258	1.858	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H]2C[C@H]2C[C@@H]1C(=O)N1CCCC12CN(C(=O)[C@H](O)CCl)C2	1847077854	VTWFTRZPIVGCKY-BYNSBNAKSA-N	427.929	1.187	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(F)(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](O)CCl)CC1	1847283433	JKYLDJIELWZGCX-KKUMJFAQSA-N	447.935	1.527	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1nc(-c2cccs2)n(-c2ccccc2)n1	11002975	XMEIPUDQZPQFKO-GFCCVEGCSA-N	431.499	1.192	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)CCn2c(=O)n(C)c3ccccc32)cc1	14283993	WMBRVETYRLPXGF-OAHLLOKOSA-N	426.473	1.744	50	20	IDGD	
O=C(Cc1csc(N2CCOCC2)n1)NNC(=O)c1ccc(F)cc1Br	17525529	PSNSCUMCSCJFPY-UHFFFAOYSA-N	443.298	1.885	50	20	IDGD	
Cn1c(=O)c2c(ncn2CCC(=O)NNc2c(Cl)cc(Cl)cc2Cl)n(C)c1=O	18228404	AELVAELQAXNMQW-UHFFFAOYSA-N	445.694	1.927	50	20	IDGD	
CN(C)c1ccc(CCC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1	28196507	WIHLEEWSPVBGBO-UHFFFAOYSA-N	444.557	1.931	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CSc2nnc(-c3ccccc3F)n2N)cc1OC	28853980	HMAOVUVCAKBLJA-UHFFFAOYSA-N	446.464	1.369	50	20	IDGD	
O=C(COC(=O)CN1c2cccc3cccc(c23)S1(=O)=O)NNC(=O)c1ccccc1	104594423	WUYIMXQPBLMACJ-UHFFFAOYSA-N	439.449	1.353	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NCc1cc(F)ccc1Br	725874368	XQROZAGBGOOHHP-UHFFFAOYSA-N	429.271	1.910	50	20	IDGD	
Cc1cc(C(=O)N2CCC[C@@H]2C(=O)NNC(=O)c2ccc3c(c2)OCO3)ccc1[N+](=O)[O-]	726521838	WEWYIPBPNMDAHK-MRXNPFEDSA-N	440.412	1.698	50	20	IDGD	
COc1ccc(COCCCNC(=O)NNC(=O)c2nnc(O)c3ccccc23)cc1	727606776	VBGYFTBENVHTKM-UHFFFAOYSA-N	425.445	1.895	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)c1	728213415	KMTDFSURLSBNEG-UHFFFAOYSA-N	432.546	1.762	50	20	IDGD	
O=C(NNS(=O)(=O)c1c[nH]c(C(=O)N2CCCC2)c1)c1cccc(OC(F)F)c1	728510922	YDVWLIASFFJXOH-UHFFFAOYSA-N	428.417	1.475	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)N2CCN(C(=O)Cc3c[nH]c4ccccc34)CC2)c1	728952764	CUEWHAUFVZPEDY-UHFFFAOYSA-N	430.468	1.781	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)NCCN(C)C(=O)OC(C)(C)C)c2ccccc2c1=O	729611941	ZRFFUOOCVICZRF-UHFFFAOYSA-N	446.508	1.788	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)CNC(=O)c2ccc(Br)s2)cn1	729692023	YCNZJIYIRRVXAU-UHFFFAOYSA-N	444.336	1.662	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)c2ccc(C(=O)NNC(=O)Cc3cc[nH]n3)cc2)cc1	730090978	VGJCSXOXYXNVEI-UHFFFAOYSA-N	427.486	1.547	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)c2cc3c(nc2O)CC(C)(C)CC3=O)c2ccccc2c1=O	730095810	HSLQRNRTOMAJFB-UHFFFAOYSA-N	435.440	1.264	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@@H]2CCc3ccc(F)cc32)cc1	730132688	XGVKGAYSNQUFOJ-GOSISDBHSA-N	434.493	1.773	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNS(=O)(=O)c2cc(C)cc(S(C)(=O)=O)c2C)c1	730202943	CIVLOUBGUODYRJ-UHFFFAOYSA-N	442.515	1.347	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@H]1CC(=O)N(c2ccc(F)cc2)C1	730204958	GVVLWAHAEBZWSH-ZDUSSCGKSA-N	447.492	1.241	50	20	IDGD	
CC(C)(C)OC(=O)N1CCCC[C@H]1C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	730525218	KPGMOCBTRXRMFN-HNNXBMFYSA-N	425.507	1.641	50	20	IDGD	
CC(=NNC(=O)[C@H]1CCS(=O)(=O)C1)c1ccc(S(=O)(=O)NCc2ccco2)cc1	730577412	SLIKRTJMQGLCFK-HNNXBMFYSA-N	439.515	1.033	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)c2cn(-c3cccc([N+](=O)[O-])c3)nn2)cc1	731453658	PDXVWAOMIGAHJJ-ZDUSSCGKSA-N	440.416	1.803	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)CN1C(=O)c2ccc(Br)cc2C1=O	731491107	LKMBMGQZHAJLFR-UHFFFAOYSA-N	432.230	1.515	50	20	IDGD	
Cc1n[nH]cc1S(=O)(=O)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1	732045556	LSSZPPOWOHWBOE-IBGZPJMESA-N	425.514	1.655	50	20	IDGD	
O=C(NNC(=O)C1CCC1)c1ccccc1NS(=O)(=O)c1ccc2nc(O)[nH]c2c1	732142637	FZXDZWOMZHICFI-UHFFFAOYSA-N	429.458	1.630	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2ccc(S(N)(=O)=O)c(C)c2)cc1Br	732306911	DQRCYMJTPVMUGC-UHFFFAOYSA-N	442.291	1.488	50	20	IDGD	
C[C@H](Oc1ccccc1Br)C(=O)NNC(=O)CNC(=O)c1cccs1	732735720	JNTRUKWXUZZUCI-JTQLQIEISA-N	426.292	1.855	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)/C(=C\c1cccnc1)NC(=O)c1ccccc1	733152641	PJGBVEOYLHWZPZ-QGOAFFKASA-N	432.436	1.785	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)C1	734174021	XNEOVQXVFDFXSC-AWEZNQCLSA-N	440.522	1.434	50	20	IDGD	
COC(=O)CCCOc1ccc(CNC(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1	734175868	WGOBPCZCLFXRCJ-UHFFFAOYSA-N	443.456	1.934	50	20	IDGD	
O=C(COc1ccccc1C=NNC(=O)Cn1nnc(-c2ccccc2)n1)NCC1CC1	734743873	PAUDBHHQMOKYQU-UHFFFAOYSA-N	433.472	1.395	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cnn(C)c2)cc1S(=O)(=O)N[C@H]1CCCC[C@H]1C	735446111	WYNZSFQAVHDDKC-CJNGLKHVSA-N	449.533	1.361	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)N1CCN(Cc2ccc3c(c2)OCCO3)CC1	738497530	XTNLJLLTFGRXJF-UHFFFAOYSA-N	440.500	1.533	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1	739681298	VONYBRDTCMAGIR-UHFFFAOYSA-N	433.490	1.935	50	20	IDGD	
Cc1cccc(NC(=S)NNC(=O)CN2CCN(C(=O)OC(C)(C)C)CC2=O)c1C	741284945	VXMQANVZTXGFLB-UHFFFAOYSA-N	435.550	1.700	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)c1c[nH]cc1-c1ccc2c(c1)OCCO2	742077699	ZPANOOYHWCSTMH-UHFFFAOYSA-N	445.476	1.922	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)[C@]2(C)CCCN(C(=O)c3ccccc3)C2)C[C@@H](C)O1	743289193	PMCWUTOBZMFCHA-PMAPCBKXSA-N	430.549	1.576	50	20	IDGD	
CCc1cccc(C)c1NC(=S)NNC(=O)CCN1C(=O)[C@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O	743820493	DOMOYVIJXVRRNJ-JHNDHUHGSA-N	430.530	1.428	50	20	IDGD	
O=C(CN1C(=O)[C@H]2[C@H](C1=O)[C@H]1CC[C@H]2O1)NNC(=O)Nc1ccc(-c2ccccc2)cc1	743826279	XCNQJJAHCUJZHW-HNBVOPMISA-N	434.452	1.669	50	20	IDGD	
Cc1sc2nc(CS[C@H](C)C(=O)NNC(=O)C(=O)NC(C)C)nc(O)c2c1C	744446647	GYOKSMPOYUQKHQ-SNVBAGLBSA-N	425.536	1.307	50	20	IDGD	
C[C@@H](CCOc1ccccc1)C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	744456103	YRPAWIZBBKKPTJ-LBPRGKRZSA-N	425.894	1.854	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)NCCN2Cc3ccccc3C2)c2ccccc2c1=O	744886180	UPBKPZXCEBTHHV-UHFFFAOYSA-N	434.500	1.937	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(-n3cncn3)cc2C)cc1OC	745414351	OXSFZFROCCDCEP-UHFFFAOYSA-N	439.428	1.211	50	20	IDGD	
Cc1cc(N2CC[C@H](NC(=O)NNC(=O)c3cc(C)n(-c4ccccc4)c3C)C2=O)n(C)n1	745906731	UAQUYLPGQSGRPZ-IBGZPJMESA-N	449.515	1.886	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(CNC(=O)c2c(C)nn(CCCl)c2C)cc1	746129667	WUFUYNGACBTUCU-UHFFFAOYSA-N	428.942	1.593	50	20	IDGD	
C[C@@H](CCc1ccc2c(c1)OCO2)NC(=O)NNC(=O)c1csc(N2CCOCC2)n1	746232368	PKXQLPCOHGARAB-ZDUSSCGKSA-N	447.517	1.674	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)N[C@H]2CCCN(CC(F)(F)F)C2=O)c1C	746339235	LVCRCSJVTLSVKF-KGLIPLIRSA-N	430.427	1.954	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN(C)[C@H]1CCCC[C@H]1S(C)(=O)=O	746469922	FDCRXWNNPHDGKP-GOEBONIOSA-N	431.942	1.397	50	20	IDGD	
C[C@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)N1CCc2ccccc21	746856468	QVCQHWZWKTZMNB-MRXNPFEDSA-N	442.541	1.683	50	20	IDGD	
COc1cc(C(C)=NNC(=O)c2nn(C)c(=O)c3ccccc23)ccc1S(C)(=O)=O	747046021	RMQXVBPSLDMLFT-UHFFFAOYSA-N	428.470	1.500	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)N2CCC[C@@H](CN3CCN(c4ccccn4)CC3)C2)cc1	748330076	UEMGVZRVSWVBPQ-FQEVSTJZSA-N	447.543	1.842	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2C[C@@H](NC(C)=O)Cc3ccccc32)cc1OC	749549647	FQNQVKPRWYHUNC-KRWDZBQOSA-N	426.473	1.032	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NNC(=O)CC2CCCC2)o1	749945099	MNEWYBPYDFCZKO-AWEZNQCLSA-N	441.506	1.337	50	20	IDGD	
CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)OCC(=O)NNC(=O)c1ccccc1	750411199	UXJUIWAVRLIUIY-LJQANCHMSA-N	440.431	1.359	50	20	IDGD	
Cc1occc1C(=O)Nc1nc(CC(=O)NNC(=O)CNC(=O)c2ccco2)cs1	751204060	VJSKNSNSEBWLOT-UHFFFAOYSA-N	431.430	1.010	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNS(=O)(=O)c2cnc3c(c2)c(C)nn3C)cc1	751263224	ITVJRKSQJZLKSD-CYBMUJFWSA-N	433.490	1.452	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)[C@H](CCS(C)(=O)=O)NC(=O)c2ccc(Cl)cc2)o1	752779856	UQWGGFLJSOCGPY-AWEZNQCLSA-N	441.893	1.236	50	20	IDGD	
CCOc1ccc(NC(=O)NNC(=O)CC(C)C)cc1S(=O)(=O)N1CCOCC1	755542784	AUIUEUBWHLOFEB-UHFFFAOYSA-N	428.511	1.305	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)Nc1ccc(S(=O)(=O)N(C)C2CC2)cc1	756402588	LXPGJVNLPSLYCI-UHFFFAOYSA-N	448.501	1.710	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2csc([C@H]3CCCO3)n2)cc1OC	756446697	RMMPXHIKUSQUKC-CQSZACIVSA-N	435.458	1.630	50	20	IDGD	
COc1ccc(C)cc1NC(=O)[C@@H]1CCCN1CC(=O)NNC(=O)c1cccc(C#N)c1	756599226	RRTYNOWVALDXSL-IBGZPJMESA-N	435.484	1.739	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)Nc2ccn(CCS(C)(=O)=O)n2)c(C)n1-c1ccccc1	756758043	DROJGJJVKNDSBB-UHFFFAOYSA-N	444.517	1.802	50	20	IDGD	
CN(C)C(=O)CNC(=O)c1ccc(NC(=O)NNC(=O)CCc2ccccc2)cc1Cl	757726191	UQMWWXMDVPLRAT-UHFFFAOYSA-N	445.907	1.944	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)Nc1cccc2c1CCN2S(C)(=O)=O	758296602	ROQJONPCNAFIBO-LBPRGKRZSA-N	436.465	1.768	50	20	IDGD	
CS(=O)(=O)N1CCc2c(NC(=O)NNC(=O)c3cc(Br)c[nH]3)cccc21	758301057	TXXZTQDKEPGMKC-UHFFFAOYSA-N	442.295	1.566	50	20	IDGD	
CCOC(=O)c1cnc(C)c(C(=O)N2CCN(S(=O)(=O)CBr)CC2)c1	758527356	JPVMUNNVNPJAFT-UHFFFAOYSA-N	434.312	1.007	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)N1CCN(S(=O)(=O)CBr)CC1	758534405	GIFUYNFYQKCMJV-UHFFFAOYSA-N	429.340	1.425	50	20	IDGD	
O=C(N[C@@H](C(=O)NNC(=O)C(=O)Nc1ccccn1)c1ccccc1)OCc1ccccc1	758834711	QHWVNAOHXGMLER-LJQANCHMSA-N	447.451	1.835	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NC[C@H]1CSCCN1Cc1ccccc1	758958711	WTRCABGLOPUOCZ-INIZCTEOSA-N	447.586	1.426	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)c1ccc(C)cc1)C(=O)NNc1ncccc1[N+](=O)[O-]	759303377	JBRJXSWOTBFKDU-CQSZACIVSA-N	439.519	1.842	50	20	IDGD	
Cc1ccc(-c2noc(CCC(=O)NNc3nccc(N4CCOCC4)n3)n2)cc1F	762854078	DDDRCUPRHSPNLB-UHFFFAOYSA-N	427.440	1.887	50	20	IDGD	
CCCNC(=O)[C@@H]1CN(C(=O)C(=O)NNC(=O)c2c[nH]c3ccccc23)c2ccccc2O1	763539874	BFGKVLGWMGOYFS-IBGZPJMESA-N	449.467	1.249	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(OCc3nc(C)no3)cc2)c1	763622420	DGKOJHZYFYJXFZ-UHFFFAOYSA-N	439.428	1.430	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccc(CC(F)(F)F)c1	763649107	ZGOXTJBEIKZMJN-UHFFFAOYSA-N	425.363	1.965	50	20	IDGD	
CCOC(=O)c1cc(CC)sc1NC(=O)C(=O)NNC(=O)COc1ccccc1F	763679780	PCLNXHBZYUYBHO-UHFFFAOYSA-N	437.449	1.791	50	20	IDGD	
Cc1cnn(-c2ccc(C(N)=O)cc2NC(=O)C(=O)NNC(=O)c2cccc(Cl)c2)c1	763750100	IRCJTWHHHSPOSI-UHFFFAOYSA-N	440.847	1.333	50	20	IDGD	
O=C(NNC(=O)C1=S=C2CCCC2=C1)C(=O)Nc1ccc(C(=O)N2CCCC2)cc1	763785248	MLQUEJJDBQRMKF-UHFFFAOYSA-N	426.498	1.210	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)C(=O)Nc1cc(C(F)(F)F)ccc1F	763790785	ONHPHJZLTOLWOJ-UHFFFAOYSA-N	437.309	1.893	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)cc1F	763848457	IAQKNMFWRVLEDW-CYBMUJFWSA-N	431.420	1.783	50	20	IDGD	
COC(=O)[C@H](C)Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)cc1	763858494	SYJCOKNRASVAGZ-ZIAGYGMSSA-N	445.447	1.731	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cc(CC(C)(C)C)nn2C)cc1	763860701	KXNVIVXCXGVVBN-AWEZNQCLSA-N	445.520	1.961	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@H](C)C(=O)NNC(=O)C(=O)Nc1cc(C)c(=O)n(C)c1	763884796	YBGMHZPFIQLGNX-CYBMUJFWSA-N	434.880	1.517	50	20	IDGD	
COC(=O)c1[nH]c(C)cc1NC(=O)C(=O)NNC(=O)c1ccc(OC(C)C)c(OC)c1	763916851	WEEJOYMSIZFZDW-UHFFFAOYSA-N	432.433	1.305	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc(OC)c1C(C)C	764005651	DWNJHHXIHICVJK-UHFFFAOYSA-N	443.456	1.998	50	20	IDGD	
Cc1nc(-c2ccc(NC(=O)C(=O)NNC(=O)c3cc(-c4ccccc4)on3)cc2)n[nH]1	764017570	ZSFRPCVUTRZCNF-UHFFFAOYSA-N	431.412	1.835	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3c2)c1	764061526	FRJZBONDSXYNIH-UHFFFAOYSA-N	440.481	1.490	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2cccc(-c3nccs3)c2)c1	764077039	GRLMZHGMGNGVKV-UHFFFAOYSA-N	444.494	1.613	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)c(OCCN(C)C)c1	764124417	GIEWHRKUJKQCRX-UHFFFAOYSA-N	434.880	1.694	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2cc(S(C)(=O)=O)ccc2C)cc1	764127970	WKCMPBRTHRWUPT-UHFFFAOYSA-N	433.486	1.126	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(C#N)cc2)cc1NC(=O)c1ccncc1	764181470	DJGJPZOBKYFLJJ-UHFFFAOYSA-N	442.435	1.914	50	20	IDGD	
CNC(=O)c1cc(Oc2ccccc2NC(=O)C(=O)NNC(=O)CC2CCCC2)ccn1	764188577	QDRRPFGVVUQGIV-UHFFFAOYSA-N	439.472	1.900	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)CC(C)(C)C)c(C(=O)N2CCCC2)cc1OC	764202390	SFUCKYDDXZRXDP-UHFFFAOYSA-N	434.493	1.462	50	20	IDGD	
Cc1ccc(C(=O)NCC(F)(F)F)cc1NC(=O)C(=O)NNC(=O)Cc1cccnc1	764268391	LNOWZRJFJHEJIO-UHFFFAOYSA-N	437.378	1.011	50	20	IDGD	
O=C(NNC(=O)c1cc(F)ccc1Br)C(=O)Nc1ccc2c(c1)C(=O)NCC2	764271193	XORFSJCBHUUIHH-UHFFFAOYSA-N	449.236	1.274	50	20	IDGD	
CCn1cnnc1-c1ccccc1NC(=O)C(=O)NNC(=O)C(F)(F)Oc1ccccc1	764379323	BSXVZJVLFTXVMI-UHFFFAOYSA-N	444.398	1.723	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(Oc2ccc(Cl)cc2)nc1	764401753	XDWZIIBQEKGAGP-GFCCVEGCSA-N	436.852	1.665	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1F)C(=O)Nc1ccc2c(c1)S(=O)(=O)CC2	764410245	BKTHBVHUKGOTPB-UHFFFAOYSA-N	425.825	1.209	50	20	IDGD	
Cc1cc(-c2nc3ccc(F)cc3n2C(C)C)ccc1NC(=O)C(=O)NNC(=O)CO	764421564	MVFLAYSIWKWVOT-UHFFFAOYSA-N	427.436	1.810	50	20	IDGD	
C[C@@H]1CN(Cc2ccccn2)CCC1=NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	764827883	LHSSXDPVLFNSEF-HXUWFJFHSA-N	448.571	1.854	50	20	IDGD	
Cc1cc(N2CC[C@@H](NC(=O)NNC(=O)Cc3cccnc3)C2=O)ccc1Br	765244766	PRAUVTKERXBNFC-MRXNPFEDSA-N	446.305	1.831	50	20	IDGD	
C[C@H](SCc1ccccc1)C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765738856	PFBNKQVOECSVDF-SFHVURJKSA-N	440.569	1.914	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)N[C@@H]1CC(=O)N([C@H]2C[C@@H]2c2ccccc2)C1	765799326	GWAKHXJLRUWPIH-NUJGCVRESA-N	428.514	1.873	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)[C@H]1CC(=O)N(c2ccc(Cl)c(F)c2)C1	766486224	QBQUMKLMQMBOAP-LBPRGKRZSA-N	429.839	1.870	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1	766880087	JGTYHWXDAOYJEL-MRXNPFEDSA-N	445.545	1.618	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)CN(C)CCN1CCN(C(=O)OC(C)(C)C)CC1	766897987	VSXQZBLJGXGHIA-UHFFFAOYSA-N	447.580	1.169	50	20	IDGD	
CC(=O)N1CCc2ccccc2[C@H]1CC(=O)OCC(=O)NNC(=O)Cc1ccccc1C	767264482	AXQIYBSCZACQBH-OAQYLSRUSA-N	437.496	1.764	50	20	IDGD	
COc1cc2c(cc1NC(=O)C(=O)NNC(=O)COc1cc(C)cc(C)c1)NC(=O)CC2	768234562	UQOBVSUXRZMNJB-UHFFFAOYSA-N	440.456	1.362	50	20	IDGD	
CC(C)(O)C(=O)NNC(=O)C1CCN(S(=O)(=O)c2cc(Cl)ccc2Cl)CC1	768259147	FOPKQLPHVSCIHC-UHFFFAOYSA-N	438.333	1.312	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C3=NN(c4ccccc4)[C@@H](C(N)=O)C3)n[nH]2)cc1	768268730	TZOUZMVQWGMYAO-HXUWFJFHSA-N	445.483	1.520	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)CCNC(=O)c2n[nH]c3ccccc23)n[nH]1	768274741	YOUHUKDPEZNSLZ-UHFFFAOYSA-N	447.455	1.543	50	20	IDGD	
CCc1cc(NNC(=O)c2cccc([C@@]3(C)NC(=O)NC3=O)c2)nc(-c2ccccn2)n1	769083886	RHGATZXVOCLHRU-JOCHJYFZSA-N	431.456	1.913	50	20	IDGD	
CC(C)(C)OC(=O)N1CCc2ccccc2[C@H]1C(=O)NNC(=O)C(=O)Nc1ccccn1	769263163	WCIMJPXRFNBOEI-KRWDZBQOSA-N	439.472	1.702	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)c2ccc(S(C)(=O)=O)c(Br)c2)c1O	769742010	OYXDCSUBRKIOSA-UHFFFAOYSA-N	443.275	1.642	50	20	IDGD	
CSCCNC(=S)NNC(=O)C1CCN(S(=O)(=O)c2ccc(C)cc2C)CC1	769767482	MRRBTBPLNMHLDS-UHFFFAOYSA-N	444.648	1.562	50	20	IDGD	
CN(C)c1cnc(C(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)cn1	770550457	SZZLDBUPZPOALD-UHFFFAOYSA-N	443.471	1.319	50	20	IDGD	
CC/C=C(\C)C(=O)N1CSC[C@@H]1C(=O)NNc1nc(O)c2cnn(C(C)(C)C)c2n1	770959791	ZSKZGXMIIKBQOL-SVTZGKHISA-N	433.538	1.988	50	20	IDGD	
CC(C)c1[nH]nc(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c1[N+](=O)[O-]	771221173	UYBCVSNNFYCAAU-UHFFFAOYSA-N	429.481	1.415	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12	771808037	QVLWQBXADJOXHQ-UHFFFAOYSA-N	430.446	1.752	50	20	IDGD	
Cc1c(C(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)nnn1-c1ccccc1Cl	772195964	URVLRBUADPMVMW-UHFFFAOYSA-N	447.282	1.960	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)[C@H](O)Cc1ccccc1Cl	773234089	XRAKTRAQFJGOLG-QGZVFWFLSA-N	439.921	1.408	50	20	IDGD	
O=C(NNc1ccc(C(F)(F)F)cn1)c1cc(S(=O)(=O)N2CCSCC2)c[nH]1	775265204	GSGJVDSQLBHMMW-UHFFFAOYSA-N	435.453	1.923	50	20	IDGD	
COc1ccc(C(=O)NC2=S=C(C(=O)NNc3cccc(S(C)(=O)=O)c3)C=C2)cc1	776535515	DSATVVYVOHBPLN-UHFFFAOYSA-N	445.522	1.577	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc(Cl)ccc1OC[C@H]1CCCCO1)N1CCOCC1	777619435	YMLYSTFVEGIMOL-CQSZACIVSA-N	433.914	1.523	50	20	IDGD	
O=C(CN1CCNC(=O)[C@@H]1c1ccc(C(F)(F)F)cc1)NNC(=O)c1cccs1	777713495	JKEYVDLHGJQVQO-HNNXBMFYSA-N	426.420	1.701	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NN=Cc1cc(Br)ccc1OCC(=O)O	777904862	WDFKVPWTLCSMGK-UHFFFAOYSA-N	430.255	1.887	50	20	IDGD	
CN1C(=O)C[C@H](C(=O)NNC(=O)CNC(=O)OC(C)(C)C)[C@@H]1c1ccc(Cl)c(F)c1	778443482	UAMBHLYKTJCGMX-ZBEGNZNMSA-N	442.875	1.671	50	20	IDGD	
O=C(CSc1nnc(O)nc1O)NN=C1CCC[C@H]2CN(Cc3ccccc3)C[C@H]12	781123788	JMZCQSRPRPLMQH-GJZGRUSLSA-N	428.518	1.779	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2cnc3ncc(Br)cc3c2)C[C@@H](C)O1	781886840	USMGRYLHWPBGNM-TXEJJXNPSA-N	436.310	1.653	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCOC[C@@H]2CC(=O)c2ccco2)cc1OC	781929303	BRHCVCNMPLXJAR-HNNXBMFYSA-N	431.445	1.032	50	20	IDGD	
CC(=O)N1CCN(Cc2ccccc2NC(=O)C(=O)NNc2c(F)cccc2F)CC1	782123731	JNBNCGPPBQGYIB-UHFFFAOYSA-N	431.443	1.711	50	20	IDGD	
COC(=O)c1scc(C)c1NC(=O)C(=O)NNC(=O)c1cc(-c2cccs2)[nH]n1	782125306	ZTAXZSMMWMIZGQ-UHFFFAOYSA-N	433.471	1.694	50	20	IDGD	
Cc1occc1C(=O)Nc1nc(CC(=O)OCC(=O)NNC(=O)c2ccccc2)cs1	782361961	OOSGCVVCAKATLA-UHFFFAOYSA-N	442.453	1.844	50	20	IDGD	
CC(C)Oc1ccc(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)cc1C#N	782892316	BNEONWUEDNYXGA-UHFFFAOYSA-N	434.456	1.561	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N1CCC2(CC1)COC(=O)N2	784174942	HBCYWAWIUPQSQC-LLVKDONJSA-N	441.282	1.532	50	20	IDGD	
CO[C@H](C)C(=O)Nc1cccc(NC(=O)C(=O)NNc2ccc(Br)cn2)c1	784340650	FLTXWKDBYSYYLP-SNVBAGLBSA-N	436.266	1.899	50	20	IDGD	
Cc1c(NNC(=O)C(=O)Nc2ccc3c(c2)C(=O)N(CC2CC2)C3=O)cccc1[N+](=O)[O-]	784351093	JUEXIUIDACFQQI-UHFFFAOYSA-N	437.412	1.991	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ccccc2)cc1S(=O)(=O)N1CCCCC1	784769596	FQWNPBKVBRCLGF-UHFFFAOYSA-N	432.502	1.952	50	20	IDGD	
N#Cc1ccc(Cn2cnc(NC(=O)C(=O)NNc3ccnc(Br)c3)n2)cc1	784836846	DDHDOBQRXFBBJI-UHFFFAOYSA-N	441.249	1.437	50	20	IDGD	
CC(C)NC(=O)C(=O)NNC(=O)[C@@H]1CC(=O)N(C(C)(C)C)[C@@H]1c1ccc(Cl)c(F)c1	785064148	CRVISJWCIMBDTO-MLGOLLRUSA-N	440.903	1.839	50	20	IDGD	
COc1ccc2nc(NNC(=O)C(=O)Nc3c(OC)ncnc3N(C)C)c(C)cc2c1	785163829	KRCUBTCTECQZCF-UHFFFAOYSA-N	425.449	1.498	50	20	IDGD	
CCNC(=O)Nc1ccc(C)c(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)c1	787543337	IGZIXVGTQFEIGX-ZDUSSCGKSA-N	445.451	1.829	50	20	IDGD	
CCN(CC)Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc(OC)cc(OC)c2)cc1	787890338	YNQYBRHYZPREDE-UHFFFAOYSA-N	428.489	1.945	50	20	IDGD	
O=C(NC[C@@H](Cc1cccc(F)c1)C(=O)N1CCOCC1)NNC(=O)c1ccccc1O	789311888	VMSJGWWZBWXBAW-MRXNPFEDSA-N	444.463	1.193	50	20	IDGD	
CN(C)CCOc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)cc1	789814059	ZCIUIEKAMZRIOG-PMACEKPBSA-N	440.500	1.286	50	20	IDGD	
COC(=O)c1scc(C)c1NC(=O)C(=O)NNC(=O)[C@H]1OCC[C@H]1c1ccccc1	789818595	MLMDYCURJNUKFK-ZFWWWQNUSA-N	431.470	1.502	50	20	IDGD	
CCc1cncc(C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1	789875244	UBKNKSAFAGTNGG-UHFFFAOYSA-N	446.529	1.059	50	20	IDGD	
Cc1csc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c1Cl	790103864	MLCJCTOBMQYYDV-UHFFFAOYSA-N	443.934	1.806	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)[C@@H]2CCC(=O)c3ccccc32)cc1OC	792662944	LVXUNIASUIYSSF-MRXNPFEDSA-N	426.425	1.768	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(Br)n2)cc1OC	793021813	KSCRDGYLUOTWSD-UHFFFAOYSA-N	437.250	1.651	50	20	IDGD	
COC(=O)Cn1ncc(NC(=O)CCC(=O)C(C#N)=C2N(C)c3ccccc3N2C)c1C	793852311	SQNJHTPUCSDEAX-UHFFFAOYSA-N	436.472	1.974	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)c1cccc(N2CCCS2(=O)=O)c1	795182879	ZUGJEXLSVCVYPX-UHFFFAOYSA-N	438.531	1.234	50	20	IDGD	
COC(=O)c1cc(F)c(Br)cc1NC(=O)C(=O)NNC(=O)CC(C)(C)C	797005097	ODBWZFNQWUYBLT-UHFFFAOYSA-N	432.246	1.897	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)[C@](C)(NC(C)=O)c2ccc(S(C)(=O)=O)cc2)cc1	797412430	MOSDTXZDINYJCF-OAQYLSRUSA-N	431.514	1.465	50	20	IDGD	
O=C(NNC(=O)N1CCC(S(=O)(=O)N2CCCC2)CC1)c1cc(Br)c[nH]1	799857107	KMBLCYYVEGQKSQ-UHFFFAOYSA-N	448.343	1.022	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)NCC2(OCCO)CCOCC2)c(C)n1C[C@H]1CCCO1	800670036	YUDGQCCYJHKXQC-NNVROAHOSA-N	431.533	1.865	50	20	IDGD	
Cc1[nH]c(C=NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)cc1C(=O)O	800804617	FGOSVHXSQXRDMG-UHFFFAOYSA-N	448.501	1.125	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])cc1	801109115	VOGBRHZPARVINJ-UHFFFAOYSA-N	433.808	1.073	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)NC1CCC2(CC1)NC(=O)NC2=O	804872884	VOXNOHBVJSXWRF-UHFFFAOYSA-N	442.501	1.583	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@@H]2C(=O)NNc2ccc(-n3ccnc3)nn2)c(OC)c1	804957697	QRYFOOLEJBDOKF-MRXNPFEDSA-N	437.460	1.427	50	20	IDGD	
C[C@]12CCC(=O)N1c1ccccc1C(=O)N2CC(=O)NNc1ccc(-n2ccnc2)nn1	804958596	DYDPKEYFGHCYHD-OAQYLSRUSA-N	432.444	1.104	50	20	IDGD	
CCN(C)C(=O)OC[C@@H]1CCCCN1CC(=O)NNC(=O)c1ccc(OC)c(OC)c1	805762020	CINGATABMYHOED-INIZCTEOSA-N	436.509	1.408	50	20	IDGD	
Cc1cc([N+](=O)[O-])ccc1NNC(=O)Nc1cnn(CC(=O)N2C[C@H](C)O[C@@H](C)C2)c1	806326124	LOKKTOLGBACIEC-KBPBESRZSA-N	431.453	1.884	50	20	IDGD	
CC(C)(C)OC(=O)NNC(=O)NCC(=O)Nc1ccc(I)cc1	807242996	XWERYHSDPRVFEX-UHFFFAOYSA-N	434.234	1.969	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)[C@H]1CCCN(S(=O)(=O)Cc2ccccc2)C1	807369854	MQRCHXLZZBQGEX-KRWDZBQOSA-N	441.550	1.165	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)C(=O)Nc1cc(C(N)=O)ccc1OCC(F)F	810389254	CUSVKKPEFKQWOT-UHFFFAOYSA-N	434.399	1.066	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1cnnc(-c2ccccc2)c1	810461652	CQGVOTMXWVDBAF-UHFFFAOYSA-N	439.497	1.921	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)[C@@H]2CSCN2C(=O)CC(C)(C)C)cc1	812728328	KBFUYRWQUMDQFB-HNNXBMFYSA-N	428.580	1.718	50	20	IDGD	
Cc1cccc(C(C)C)c1NNC(=O)c1ccc(S(=O)(=O)N2CCNC(=O)C2)cc1	812767659	OQSRAQYVVWUTED-UHFFFAOYSA-N	430.530	1.996	50	20	IDGD	
COc1ccc([C@H](O)C2CCN(CC(=O)NNC(=O)Cc3nc(C)cs3)CC2)cc1	812858838	CYBUVADYBRLTBE-NRFANRHFSA-N	432.546	1.596	50	20	IDGD	
COC(=O)C(C)(C)c1csc(NC(=O)C(=O)NNC(=O)C(C)(C)c2ccccc2)n1	815569568	YUCJXBIFRNNMBF-UHFFFAOYSA-N	432.502	1.657	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1ccc(OC(F)F)c(F)c1	815751595	FYQZNJZTKIDNDC-UHFFFAOYSA-N	446.407	1.759	50	20	IDGD	
COC(=O)c1cc(C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)c[nH]1	815827839	QGJXTFCWSBZWEM-UHFFFAOYSA-N	433.896	1.034	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)c2cc(S(C)(=O)=O)ncc2Cl)cc1	816817723	IMGCMTSJTJVGJJ-NSHDSACASA-N	441.893	1.766	50	20	IDGD	
Cc1ccc(C(=O)NNc2nnc(C)c(O)n2)cc1S(=O)(=O)Nc1ccc(F)cc1	817282815	ODSSSNPNQMSZPR-UHFFFAOYSA-N	432.437	1.891	50	20	IDGD	
COc1cccc(/C=C(\C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)n2nnnc2C)c1	818029923	RAQBBODCIUYGKP-RNEAKCBISA-N	440.435	1.742	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)CN2C(=O)N[C@](C)(c3ccc(F)cc3)C2=O)cc1	818431485	NVVWQZKZRFUXMO-OAQYLSRUSA-N	428.420	1.128	50	20	IDGD	
CC(C)(C)c1ccc(C(=O)N[C@H](CCS(C)(=O)=O)C(=O)NNC(=O)CC2CC2)cc1	819131692	LXDZUEDFVREACF-QGZVFWFLSA-N	437.562	1.465	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=O)CNc2ccccc2OC)ccc1C	825614923	BMEFXNGIGPRHNA-UHFFFAOYSA-N	448.545	1.907	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)c3cccc(C)n3)CC2)cc1	889062242	BLXHTJBCELYSOD-UHFFFAOYSA-N	446.529	1.651	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)CN1C(=O)[C@@H]2[C@@H](C1=O)[C@H]1C=C[C@H]2C1	913037239	RELACPOXTUUQTL-OTRWWLKZSA-N	436.493	1.687	50	20	IDGD	
Cc1nnnn1[C@H](Cc1cccc(F)c1)C(=O)NNC(=O)[C@H](C)Oc1ccccc1F	915697599	SNPDAXNQKZKSNL-YVEFUNNKSA-N	430.415	1.658	50	20	IDGD	
COc1cc(C=NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc2c1OCO2	916262162	ZYNHJENDBNBTBW-UHFFFAOYSA-N	431.470	1.972	50	20	IDGD	
CCn1cnc2c1c(=O)n(CC(=O)NN=C(C)c1ccc[nH]1)c(=O)n2Cc1ccccc1	916332190	QOOWMSJKTVGXCY-UHFFFAOYSA-N	433.472	1.296	50	20	IDGD	
CC(=NNC(=O)[C@@H](C)Oc1ccccc1F)c1ccc(S(=O)(=O)NCC(=O)O)cc1	916335898	SJQMKYWZHIFUGI-CYBMUJFWSA-N	437.449	1.496	50	20	IDGD	
COC(=O)CCOc1ccc(S(=O)(=O)NNC(=O)c2c(C)nc3ccccn23)cc1	917720774	MIVDRWMVFUCBSS-UHFFFAOYSA-N	432.458	1.208	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NCc2cccc(OCC(=O)N(C)C)c2)cc1	918223242	GCHFIZGOUDDLFZ-UHFFFAOYSA-N	430.461	1.072	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CC(F)(F)F)cc1S(=O)(=O)N1CCCCCC1	918366062	SEGGRFRYWCAHOV-UHFFFAOYSA-N	437.440	1.973	50	20	IDGD	
O=C(CC(F)(F)F)NNC(=O)c1ccc(S(=O)(=O)NCCc2cccs2)cc1	918366164	LAGPHNGLJASBMV-UHFFFAOYSA-N	435.449	1.983	50	20	IDGD	
Nc1c(Br)cccc1C(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	919309695	DZOPPURJXBVKJW-UHFFFAOYSA-N	437.206	1.558	50	20	IDGD	
CCCCS(=O)(=O)N1CCC[C@@H]1C(=O)OCC(=O)NNC(=O)c1ccc(Cl)cc1	919360982	IMTMHQNCYTYVMA-OAHLLOKOSA-N	445.925	1.239	50	20	IDGD	
COCCn1cc(C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)c2ccccc21	920031318	CMQOVXAGWBOOED-UHFFFAOYSA-N	443.529	1.964	50	20	IDGD	
CCNC(=O)NNC(=O)[C@H](CCSC)NS(=O)(=O)c1ccc(Cl)c(Cl)c1	920858705	JAONCAUPKQCGIQ-LBPRGKRZSA-N	443.378	1.744	50	20	IDGD	
NC(=O)[C@@H]1CCCN1Cc1cccc(NC(=O)NNC(=O)c2ccc3c(c2)OCO3)c1	920929163	AEFNCHKHBMLEHK-INIZCTEOSA-N	425.445	1.332	50	20	IDGD	
C[C@H](O)CNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2c(Cl)cccc2Cl)cc1	1120571427	DVJFKSSTKPSQKB-JTQLQIEISA-N	446.312	1.727	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)NCc1ccccc1N1CCN(C)CC1	1251636787	RJPMSLYGWNWQTB-UHFFFAOYSA-N	441.532	1.747	50	20	IDGD	
CSC[C@H](C)C(=O)N1CCC(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)CC1	1327031378	MROZHLWUXBNDIX-HNNXBMFYSA-N	448.593	1.078	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)o1	1779027945	TWFXWDAJTYDUMX-CJNGLKHVSA-N	432.246	1.372	50	20	IDGD	
Cc1cc(/C=C/C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)no1	1779125787	OVCUBXXMWSIAOW-LHNBFNSWSA-N	426.311	1.857	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C=C/c1cnccn1)C2	1779545947	USARWTMQHOJVMP-DPTMFGANSA-N	432.597	1.855	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(OC)cc3OC)C2)C1	1780536860	PTORVUADVJQCGD-UZLBHIALSA-N	426.897	1.401	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C13CC(C(=O)OC)(C1)C3)C2	1780709829	WTRKUHIOXHVCBR-ROIMBAQASA-N	426.941	1.861	50	20	IDGD	
C=C(CC(=O)OCC)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCBr)C2	1780736742	NIRMPPCRQWXDHM-DNVCBOLYSA-N	445.354	1.795	50	20	IDGD	
Cc1cc(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](F)Br)C2)n[nH]1	1780774677	IAVQRYPJQBPUIK-FRFSOERESA-N	431.306	1.465	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C=N/N1CCCCC1)C2)[C@@H](F)Br	1780774765	LNEBBOINUNINIW-ZNZVRDGBSA-N	447.349	1.663	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCc1cnccn1)C2)[C@H](F)Br	1780776687	DNIRUGUAXJJXIP-UWWQBHOKSA-N	443.317	1.614	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(N4CCOCC4)cc3)CCO2)C1	1781218266	MUUVSXAOLWLGON-SIKLNZKXSA-N	435.952	1.984	50	20	IDGD	
COc1ccc([C@H](O)C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](F)Br)C3)C2)cc1	1781325826	RSJWMKUAWWHTIT-MPGHIAIKSA-N	445.285	1.249	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Cl)C2)c1cnc2c(c1)CCNCC2	1781525673	HWYIXOQUNOWJTR-LVCYWYKZSA-N	438.931	1.432	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1[nH]nnc1C)C2	1781900576	NISIZZORCFZGRR-PBFPGSCMSA-N	428.331	1.414	50	20	IDGD	
CC(=O)c1cc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](C)Br)C2)n[nH]1	1781996659	PMVUWNZHQYTUOT-PZDGAKPMSA-N	441.326	1.523	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCc1ccc(F)nc1)C2	1782172087	OAMPSMAAHXFWHX-CBGDNZLLSA-N	441.931	1.921	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H]2CCNC(=O)C2)C1	1782268957	HYZFQDUJMPUXKU-TUFGIGEDSA-N	434.364	1.263	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)CNC(=O)OC(C)(C)C)CCO2)C1	1783354815	GBWDTQWHVGNXJX-UGSOOPFHSA-N	448.358	1.515	50	20	IDGD	
COc1cccc(OC)c1C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](C)Br)C2)C1	1783536264	FRIRDAVGMMNEBO-ORAYPTAESA-N	441.322	1.931	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3c[nH]c4nccc-4c3Cl)CCO2)C1	1783874996	JWINHRRIRFYLME-AUUYWEPGSA-N	441.315	1.865	50	20	IDGD	
O=C(c1cnc2c(c1)CCNCC2)N1CCO[C@@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783950571	YHQVCZZOZYXDIQ-LJQANCHMSA-N	427.332	1.017	50	20	IDGD	
COc1cc(C(=O)N2CCO[C@]3(CCN(C(=O)C(Cl)Cl)C3)C2)ccc1[N+](=O)[O-]	1783951846	KZTBWRXJXKLQFZ-KRWDZBQOSA-N	432.260	1.851	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cn3cc(Cl)cn3)C[C@@H]21	1783965189	ABEAOJZDGNSCMC-DHMWGJHJSA-N	447.761	1.547	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4cccnn4c3)C[C@@H]21	1783972720	OMAFXDIRCZJTBY-USJZOSNVSA-N	449.349	1.959	50	20	IDGD	
CCc1oncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)CBr)C[C@@H]21	1786232895	DABOWRBBMXNBGC-DUPGQFARSA-N	428.327	1.861	50	20	IDGD	
CN(C)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCBr)[C@H]2C1	1786400902	DXYLFXINQPBSNS-QRTARXTBSA-N	439.354	1.526	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3nc4ccccn4n3)[C@H]2C1	1787265830	NKPJSRIIHWFIDY-RFGFWPKPSA-N	436.310	1.106	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3CCCC3)C[C@@H]21	1787508899	QCLRVVYWRQWHQE-QECDCCOMSA-N	429.521	1.290	50	20	IDGD	
C[C@H](Br)C(=O)NC1(c2ccc(NC(=O)CNCP(=O)(O)O)cc2)CCC1	1787970093	FYVUBCVDQZEEOK-NSHDSACASA-N	448.254	1.629	50	20	IDGD	
CN[C@@H](CC(=O)Nc1ccc(C2(NC(=O)[C@@H](F)Br)CCC2)cc1)C(=O)O	1788063903	CQIDHUZTJWOLOU-GXTWGEPZSA-N	430.274	1.874	50	20	IDGD	
CCc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)Br)C[C@@H]32)nn1C	1789069292	VJCQGWODHFELIZ-DSPQJCBJSA-N	427.343	1.359	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)C[C@@H]21	1789866976	TZKSUDSZODPZGY-SPOWBLRKSA-N	425.869	1.911	50	20	IDGD	
Cc1nccn1[C@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)Br)C[C@@H]21	1791707142	AFQQIJVIBJGICE-URLPEUOOSA-N	427.343	1.516	50	20	IDGD	
Cc1ccc(C(=O)NCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Cl)C[C@@H]32)cc1	1792251674	FUMPUNRZGSYZMW-NBOOPKSLSA-N	425.888	1.239	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc(F)cc1)C2	1792867978	PCROGYVUUORNAB-FRQROOTJSA-N	427.314	1.989	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccn(C(C)(C)C)n1)C2	1792870571	SAAOXIYMSMAMAU-AYDFFVQHSA-N	441.370	1.872	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc3nccn13)C2	1792873587	DVFYLYNHUHIPSK-ZJOBFFGXSA-N	435.322	1.569	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CCCCC1(F)F	1793716044	IXEXMQBZBMJZBV-LOUJCGABSA-N	435.475	1.762	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCN1C(=O)C=CC1=O	1793854514	AVGWJCSNOOZKJH-XJFOESAGSA-N	426.311	1.113	50	20	IDGD	
Cc1nnc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)Br)C3)s1	1794110611	XVUUEUNLTCNSAT-BTABJRDXSA-N	431.356	1.152	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ncc(Cl)cn1	1794542482	IUNULPZLEIRDLZ-LYIQGSDWSA-N	431.718	1.507	50	20	IDGD	
COc1cccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C3)n1	1794866341	NGTWKXJEEDBIFO-MVRRYPJTSA-N	438.488	1.476	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1ccccc1Cl)c1cccc(B(O)O)c1	1795627660	SOQUROSRPRYOPI-REPLKXPHSA-N	426.709	1.514	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccc(F)cn1	1795794693	YYCUUCKUQAKMTA-KOFHJDLBSA-N	428.302	1.384	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)[C@@H]1C[C@@H]1c1ccc(F)cc1	1796187921	LVACUJWDKSFNBC-PVIWCNJMSA-N	436.292	1.561	50	20	IDGD	
CC(C)(C)OC(=O)N1CCCC[C@@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Cl	1796368579	NNWCAHQLGYVQMV-YIDVYQOGSA-N	447.935	1.900	50	20	IDGD	
O=C(/C=C/C(=O)c1cccs1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2	1796446842	ISFAOHPEGCVGGC-YDMSQTBBSA-N	445.310	1.767	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc2[nH]ncc12	1796622833	VNVTYZSFUPOLKI-LCFLCXBCSA-N	447.499	1.949	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1ccc2c(c1)COC2	1797014802	HRYFLPSEQZTKPZ-QKPAOTATSA-N	427.270	1.611	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CSc1ccccc1)C2	1798439145	HSXPGIYYUNOELL-MUJYYYPQSA-N	439.541	1.729	50	20	IDGD	
CCOc1cccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Br)C3)c1	1799017026	NZHPRPUKFZJDDV-OCVGTWLNSA-N	429.286	1.979	50	20	IDGD	
COc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)C(Cl)Cl)C3)cc1N(C)C	1799209244	ULRAUGHQLCPYHP-YWVIFJGQSA-N	430.332	1.768	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc(C(=O)OC)s1)C2	1799269075	SLXSTTSGGBRYHC-IFOZYUSPSA-N	428.938	1.684	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cccc(F)c1F)C2)[C@H](F)Br	1799347285	OPBMPWCOKQAITN-OJXGSEEGSA-N	435.240	1.787	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccccc1C(N)=O	1799625713	IYDOEURDESIUIG-NOXHYTERSA-N	438.322	1.162	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(-n2cccn2)cc1)c1cccc(B(O)O)c1	1800484847	ASWIZLUCJQSJBH-QQFNCUIESA-N	444.300	1.118	50	20	IDGD	
Cc1nc2ncccn2c1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)Br	1800756888	GHVUSWGUKSEFFA-RUZUBIRVSA-N	436.310	1.024	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/c1ccc(F)cc1F)C2	1800971103	PYLNKFLDMTWNQT-KPEMIJLNSA-N	428.863	1.821	50	20	IDGD	
C[C@H](NC(=O)c1ccccn1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCBr)C2	1801261517	BGUREWIYGBRHHO-XQLPTFJDSA-N	437.338	1.623	50	20	IDGD	
Cc1ncc(/C=C/C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCBr)C3)s1	1801488091	JKFUGFRPPPKZLO-BNNGIJEPSA-N	428.352	1.839	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Br)C3)cc1	1801783838	CUBSMOXLXWQKLW-OCVGTWLNSA-N	442.285	1.539	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2c(O)cc(O)cc2O)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803141904	VLLHCHHCVBDJOL-ULFGMLNVSA-N	435.864	1.118	50	20	IDGD	
CCOC(=O)N1CCC(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](Cl)COC)C3)CC1	1804125703	BSNLHXNYRUBUQT-YVSFHVDLSA-N	429.945	1.747	50	20	IDGD	
COC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@H]1c1cccnc1	1806377688	RSZQQDKMHIJYNR-VBNZEHGJSA-N	430.274	1.731	50	20	IDGD	
CN1N=C(C(=O)N2CCCC3(CCN(C(=O)CCBr)CC3)C2)CCC1=O	1806621108	OMWSRZRJSUSJOM-UHFFFAOYSA-N	427.343	1.611	50	20	IDGD	
Cc1nnc(CC(=O)N2CC[C@H](CNC(=O)[C@@H](F)Br)[C@H]2c2cccnc2)o1	1808661274	HQTGYIXDXHZRTQ-DAXOMENPSA-N	440.273	1.712	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1CCN(C(=O)Cc2cncnc2)[C@@H]1c1cccnc1	1810542209	XMAJXDZCTWPBEP-GHTZIAJQSA-N	427.581	1.972	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1CCN(C(=O)CCn2cncn2)[C@@H]1c1cccnc1	1810547377	FQHXXLTXRLSXED-FXAWDEMLSA-N	430.585	1.621	50	20	IDGD	
Cn1ccc(=O)cc1C(=O)NC[C@@H]1CCN(C(=O)CO[Si](C)(C)C)[C@@H]1c1cccnc1	1811369069	KDWOGFBHRUECET-LAUBAEHRSA-N	442.592	1.951	50	20	IDGD	
CC(C)CCC(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1	1812601203	XAZCOUZUTOKHNW-UWJYYQICSA-N	438.532	1.836	50	20	IDGD	
CC(=O)NCC(=O)NC[C@@H]1CCN(C(=O)[C@H](C)CBr)[C@H]1c1cccnc1	1812614641	OAPAPIIJHOWEFU-PVUWLOKVSA-N	425.327	1.255	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H](CNC(=O)C[C@@](C)(O)CC(=O)O)[C@@H]1c1cccnc1	1813064579	ZNBCNZGGCSDXIN-FYINFDKHSA-N	439.940	1.968	50	20	IDGD	
C#CCCCCC(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1813073660	LVJMVTRPFLFBDS-AUSIDOKSSA-N	427.549	1.654	50	20	IDGD	
C#CCCCCC(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1813228221	UCNLCGMBUWTRGS-XXBNENTESA-N	427.549	1.654	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)/C=C/c2cnccn2)[C@@H]1c1cccnc1	1813486766	LZWWJNKJQAHMKH-MZUXGMSXSA-N	429.908	1.845	50	20	IDGD	
CC1CCN(CC(=O)Nc2cc([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)CC1	1815069830	QQYGTFJHJNADOZ-SFHVURJKSA-N	447.584	1.507	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1	1815337205	OPAOERWCWNDNLO-KBPBESRZSA-N	435.742	1.456	50	20	IDGD	
CCc1ncccc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1	1817471294	UGVNENISZZGZSD-FQEVSTJZSA-N	447.304	1.667	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cscn2)[nH]n1)c1ccc(B(O)O)cc1	1817471364	WJXIKTKCIIEBDG-INIZCTEOSA-N	425.279	1.166	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)C3(C(F)(F)F)CC3)sc2C1	1818849619	KRPLSPQMKBHDSD-SNVBAGLBSA-N	447.483	1.771	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1)c1nc(O)n2c1CCCC2	1819628029	JPESPLKUUSUJHT-OCCSQVGLSA-N	436.900	1.554	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@](C)(Cl)CCl)CC2	1820148867	WRXRHFIQBLPIMV-YHTYYEMMSA-N	433.361	1.982	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2c[nH]c(=O)cn2)n[nH]1	1820242046	IPHBJOXDXWVQIT-GXFFZTMASA-N	437.298	1.830	50	20	IDGD	
Cc1ccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)cc1O	1821033363	GUCLLRZLPQKXAM-LJQANCHMSA-N	448.288	1.723	50	20	IDGD	
COc1ccc2[nH]cc(C(=O)Nc3nc4c(s3)C[C@H](NC(=O)[C@@H](O)CCl)CC4)c2n1	1821244451	VMPCNXFYUJBDDK-RNCFNFMXSA-N	449.920	1.854	50	20	IDGD	
CC(C)c1cc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)CCC(=O)NN(C)C)CC3)on1	1821665087	OMWDKUGHAKKLRY-LBPRGKRZSA-N	448.549	1.853	50	20	IDGD	
C[C@@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1)C1(O)CCC1	1823732617	JZJFVWCWOHVJOT-UWJYYQICSA-N	442.365	1.151	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H]1CC[C@H](C(=O)OC)C1)CC2	1825994417	LEDJWRWIOHJACN-RVMXOQNASA-N	443.953	1.898	50	20	IDGD	
O=C(CNC(=O)C(F)(F)F)N[C@H]1CCc2nc(NC(=O)C(Cl)Cl)sc2C1	1826103716	YMYAAFNQWGIHGV-YFKPBYRVSA-N	433.239	1.537	50	20	IDGD	
CSCC[C@H](O)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](F)Br)CC2	1826134307	ZKGGVHZGPDUCIV-HDBBIHSSSA-N	440.360	1.860	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC([C@H]2CCCCN2C(=O)C[C@@H](NC)C(=O)O)CC1	1826947259	CSQVNAOFARKNSQ-ARFHVFGLSA-N	446.386	1.842	50	20	IDGD	
O=C(N[C@@H]1CCc2nc(NC(=O)C3CCSCC3)sc2C1)c1ccc(B(O)O)cc1	1828335935	ITHSJDAEODFLJF-OAHLLOKOSA-N	445.375	1.192	50	20	IDGD	
Cc1cnc2c(C(=O)N3CCCC[C@@H]3C3CCN(C(=O)[C@H](O)CCl)CC3)cnn2c1	1828594011	GRLPIYAVIPNKNP-QZTJIDSGSA-N	433.940	1.871	50	20	IDGD	
Cc1ccoc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2	1830538753	OWCBPJZVOFGXCT-KSSFIOAISA-N	429.311	1.689	50	20	IDGD	
CC(C)O[C@H](C)C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](C)CBr)CCO2)C1	1830539439	GRYZZJKABZALIV-RKVPGOIHSA-N	435.359	1.287	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3c[nH]c4nccc-4c3)C2)C1	1831647806	YZMLMRKFWLTJMD-UTKZUKDTSA-N	434.924	1.992	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CC34CCCN3CCC4)C2)C1	1831653610	BIPZCXHUPJKHDW-PGRDOPGGSA-N	442.000	1.869	50	20	IDGD	
O=C(CCCC(F)(F)F)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1832261608	LFUKCYBROGTWMC-GXTWGEPZSA-N	449.239	1.866	50	20	IDGD	
O=C(CCc1ccccn1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1833188339	LEVBEMKPGGTFQT-WMZOPIPTSA-N	444.301	1.161	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3ccc4nonc4c3)CC2)CC1)[C@@H](O)CCl	1833310260	NTQHHRUNJSGIPE-SFHVURJKSA-N	435.912	1.008	50	20	IDGD	
Cc1nc(C(=O)NC2CCN(C3CCN(C(=O)[C@H](C)Br)CC3)CC2)co1	1834205295	KNRBHWUFLGQGCE-LBPRGKRZSA-N	427.343	1.952	50	20	IDGD	
O=C(c1scnc1C(F)(F)F)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1834571639	XDHTXWBFAZMAOQ-BXUZGUMPSA-N	445.822	1.766	50	20	IDGD	
CC[C@H](C)[C@H](N)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)Br)CC2)CC1	1834689374	IHEIDKULMTUAPB-VBQJREDUSA-N	431.419	1.715	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3cccc(F)c3)CCO2)C1	1835028884	XZLWIUSPBIWBRU-YLJYHZDGSA-N	428.888	1.078	50	20	IDGD	
CC(=O)N[C@H](C(=O)N1CCC(N2CCC(NC(=O)[C@H](F)Cl)CC2)CC1)C(C)(C)C	1835079383	VIHKNXMPABQZER-SJORKVTESA-N	432.968	1.643	50	20	IDGD	
COCCn1nccc1C(=O)NC1CCN(C2CCN(C(=O)C(Cl)Cl)CC2)CC1	1835180046	ULCSWPLJVMNHER-UHFFFAOYSA-N	446.379	1.518	50	20	IDGD	
Cc1cc(C(=O)N2CCC(N3CCC(NC(=O)CO[Si](C)(C)C)CC3)CC2)n(C)n1	1835833584	UVNBBQOCCDXDSD-UHFFFAOYSA-N	435.645	1.765	50	20	IDGD	
C[C@@H](C(=O)N1CCC(N2CCC(NC(=O)CO[Si](C)(C)C)CC2)CC1)n1ccnc1	1835835402	YNIYKEHTZPEYOY-KRWDZBQOSA-N	435.645	1.867	50	20	IDGD	
COc1cc(C#N)cc(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)c1	1836123229	VRWWSABPGDUIEY-FQEVSTJZSA-N	448.951	1.352	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@H](C)N3C[C@@H]4C[C@H]4C3)CC2)CC1	1838370712	SWEOUTYVMHIALC-BOSXTWCSSA-N	442.000	1.579	50	20	IDGD	
C[C@H]1C[C@@]1(C)C(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1	1838394797	YHYSRJOOVSJGLZ-NPMXOYFQSA-N	443.548	1.343	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnnc4ccccc34)C2)C1	1839145201	YPWFXAVYTINBRO-UWJYYQICSA-N	432.908	1.717	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(OC)cc(OC)c3)C2)C1	1839146071	JLYYJHBNUOFJJL-NQIIRXRSSA-N	440.924	1.791	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccccn3)C2)C1	1839152329	WOQAERVWOSBOPD-OALUTQOASA-N	430.332	1.317	50	20	IDGD	
C#CCCCCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](Br)CC)CCO2	1839967760	XXNYVCWSKRDVBL-QFBILLFUSA-N	429.355	1.810	50	20	IDGD	
C[C@@H]1OCCN(C(=O)OC(C)(C)C)[C@H]1C(=O)N1CCCC12CN(C(=O)[C@H](F)Cl)C2	1841691109	YZYJEOJDHLINIC-MJBXVCDLSA-N	433.908	1.749	50	20	IDGD	
CC[C@@H](C(=O)N1CC2(CCCN2C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C1)N(CC)CC	1843415399	OWTCMQHOXWQAKX-MRSJDWDVSA-N	430.553	1.444	50	20	IDGD	
Cc1c[nH]cc1C(=O)N1CCCC12CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2	1843494248	NBHWWJXPVUZHGF-UHFFFAOYSA-N	438.532	1.486	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)N1CC2(CCCN2C(=O)c2cc([N+](=O)[O-])ccc2OC(C)=O)C1	1844692773	IZSCNRXRJWDARQ-CYBMUJFWSA-N	444.444	1.028	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC12CN(C(=O)c1ccc([N+](=O)[O-])c3c1OCO3)C2	1846177788	LRHAHMKVCGNZIZ-SNVBAGLBSA-N	440.250	1.924	50	20	IDGD	
COc1cccc2c1C[C@@H](C(=O)N1CC3(CCCN3C(=O)CCC(=O)NN(C)C)C1)CC2	1846385956	OZWFHDKCACPHPS-SFHVURJKSA-N	442.560	1.377	50	20	IDGD	
CC(C)(C)OC(=O)N1CCCC[C@@H](C(=O)N2CCCC23CN(C(=O)[C@H](O)CCl)C3)C1	1847159601	KAEYHEANMKFHSP-HZPDHXFCSA-N	443.972	1.827	50	20	IDGD	
Cn1nc(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](Br)Cc2ccccc2)cc1O	1848331381	FFUMVTBOQLOESF-XIRDDKMYSA-N	447.333	1.947	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NCc1ccccc1CN1CCOCC1	9872409	PBMQIHKCYHQGRT-INIZCTEOSA-N	430.480	1.956	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)cc1	15025258	ZDWYIKRQTRENSA-UHFFFAOYSA-N	441.400	1.377	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)c1ccc(CCNS(C)(=O)=O)s1	27199966	OJQFZCZNEOKARW-LLVKDONJSA-N	429.495	1.207	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)NC1CCN(Cc2ccc(F)c(F)c2)CC1	725872692	ZZDKGDGFUIKOEZ-UHFFFAOYSA-N	435.431	1.283	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)NCC1(c2ccc3c(c2)OCO3)CCCCC1	726241216	VRBXAGLPJMTWKR-UHFFFAOYSA-N	442.472	1.971	50	20	IDGD	
Cc1sc2nc(CC(=O)NNC(=S)Nc3ccc(C(N)=O)cc3)nc(O)c2c1C	726438514	ABMNLWLRQHJWOF-UHFFFAOYSA-N	430.515	1.673	50	20	IDGD	
COC(=O)CCCN1CCC(=NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)CC1	727059305	NHLSWZDQHIZNHG-UHFFFAOYSA-N	438.550	1.137	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)NC1CCN(c2ccc(C#N)cn2)CC1	727605506	LWWOLFTWZSRDQM-AWEZNQCLSA-N	426.452	1.859	50	20	IDGD	
O=C(NNC(=S)NCC1CCC1)c1ccc(S(=O)(=O)NC[C@H]2CCCO2)cc1	727867230	WZWRNKBFJVSSRK-OAHLLOKOSA-N	426.564	1.053	50	20	IDGD	
O=C(CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)NNc1nc(-c2cccnc2)no1	728079599	YWKJJBFFOIUOHK-UHFFFAOYSA-N	425.361	1.871	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)NCCCNC(=O)c1ccc(Br)cc1	728957690	HQPHCRKLLFNUNE-UHFFFAOYSA-N	434.294	1.537	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NNC(=O)Cn2ccc3ccccc32)cc1	729448066	AECOZKCOXMONJN-FQEVSTJZSA-N	440.525	1.950	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@@H]2C(=O)NNC(=O)COc2ccccc2O)s1	730779112	UHLXFIMLEQDZFY-CYBMUJFWSA-N	439.515	1.142	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)CN1C(=O)NC2(CCC(C(C)(C)C)CC2)C1=O	731494551	UABXHXQWQIZVHE-UHFFFAOYSA-N	430.505	1.983	50	20	IDGD	
O=C(O)COc1ccc(C=NNC(=O)c2nn(-c3ccccc3)cc2O)cc1[N+](=O)[O-]	731559272	WYTIOFDECCUVSW-UHFFFAOYSA-N	425.357	1.713	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)/C=C/c1ccccc1)C(=O)NNC(=O)c1c[nH]nc1C	732084203	QUFWASFNHJWAGW-PXUDHTSWSA-N	437.547	1.191	50	20	IDGD	
CC[C@@H](C)C(=O)N1CCC[C@@H](C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)C1	732334841	APVWZUUMPRYCAT-UKRRQHHQSA-N	434.449	1.184	50	20	IDGD	
O=C(NNC(=O)c1ccc(F)cc1Br)N[C@@H]1CCN(CC(F)(F)F)C1=O	732590926	XGMAIAGCAHXWES-SNVBAGLBSA-N	441.179	1.695	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1)C1CCS(=O)(=O)CC1	732957198	PEKWJFUXLZELTJ-NRFANRHFSA-N	441.553	1.586	50	20	IDGD	
CNS(=O)(=O)c1ccc([C@@H](C)NC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1	733343507	QZMPGKLLLOPIFV-CQSZACIVSA-N	442.501	1.486	50	20	IDGD	
CCOc1ccc(NC(=S)NNC(=O)[C@H]2CC(=O)N(C[C@@H]3CCCN3CC)C2)cc1	733358373	UBGAUSGCGNNCBN-RDJZCZTQSA-N	433.578	1.736	50	20	IDGD	
CCCn1nc(C(=O)NNS(=O)(=O)c2cc(C#N)ccc2C)c2ccccc2c1=O	734118891	SCTBUXBJMMNMGU-UHFFFAOYSA-N	425.470	1.610	50	20	IDGD	
O=C(NNC(=O)c1cc2c(s1)CCCCC2)N[C@H]1CCN(CCN2CCOCC2)C1	734684857	AMXIVOQHVBIHGJ-KRWDZBQOSA-N	435.594	1.368	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N2CCS(=O)(=O)[C@H](C)[C@H]2C)cc1Br	736387423	QALYQTXIKJMNQT-NXEZZACHSA-N	434.312	1.320	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)[C@@H]2CC[C@@H](C(F)(F)F)NC2=O)cc1C	736775042	ITEWKWOIXBGNNT-SKDRFNHKSA-N	435.424	1.380	50	20	IDGD	
CC[C@@H](C)[C@H](NC(=O)N1CCCC1)C(=O)OCC(=O)NNC(=O)c1cccc(Cl)c1	736835533	NEYZQGULEDMNAQ-DYVFJYSZSA-N	438.912	1.864	50	20	IDGD	
CC(C)(C)OC(=O)N(CC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)CC1CC1	742635340	LNPUTRJJHUVRCP-UHFFFAOYSA-N	432.525	1.488	50	20	IDGD	
C[C@H](CN1CCN(c2ccccc2)CC1)NC(=O)NNC(=O)Cc1nc2ccccc2n1C	745839178	OKFXAVMRAJPTAL-GOSISDBHSA-N	449.559	1.657	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)Oc1ccccc1F	745889835	KXIPHOQGDJEZBF-ZDUSSCGKSA-N	438.481	1.488	50	20	IDGD	
COc1ccc(CN2C(=O)c3ccccc3C2=O)cc1C(=O)NNC(=O)N1CCOCC1	745993116	YBFSRVXBAPLGNX-UHFFFAOYSA-N	438.440	1.178	50	20	IDGD	
O=C(CCCOc1ccc(I)cc1)NNC(=O)N1CCOCC1	745995961	FRZXUOJWQVUHBJ-UHFFFAOYSA-N	433.246	1.523	50	20	IDGD	
Nc1c(O)nc(O)nc1C(=O)NNC(=O)c1cn(-c2ccccc2)nc1-c1ccccc1	746106158	FRBHTHCFJCFLED-UHFFFAOYSA-N	431.412	1.398	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)CSc1nnc(S)s1	747345955	SEUHMOZKFUKXOA-UHFFFAOYSA-N	435.350	1.908	50	20	IDGD	
O=C(CCCCCn1c(S)nc2ccccc2c1=O)NNC(=O)C(=O)N1CCCC1	748343579	OIPSMTMGWRUTSD-UHFFFAOYSA-N	431.518	1.015	50	20	IDGD	
O=C(NC[C@@H](c1ccccc1)N1CCc2sccc2C1)NNC(=O)C(=O)N1CCCC1	748453949	OVBKQMYLPYYYRA-SFHVURJKSA-N	441.557	1.800	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)NNC(=O)NCCC(=O)N1CCN(c2ccccc2)CC1	748465812	SEZALRQVTONTAP-UHFFFAOYSA-N	448.527	1.780	50	20	IDGD	
Cc1c(NNC(=O)[C@@H]2CCCC[C@H]2C(=O)N[C@@H]2CCS(=O)(=O)C2)cccc1[N+](=O)[O-]	748687223	XCWOQGUKJNMCEM-RBSFLKMASA-N	438.506	1.456	50	20	IDGD	
O=C(NNC(=S)NC[C@@H]1CCOC1)c1cccc(S(=O)(=O)NCc2ccccc2)c1	749694965	ZQFQYKMLURTPOD-INIZCTEOSA-N	448.570	1.311	50	20	IDGD	
CN1CC[C@H](C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c2ccccc21	750712982	BVYNRVIKWHANBU-IBGZPJMESA-N	442.541	1.856	50	20	IDGD	
C[C@@]1(c2ccc(C(=O)NNC(=O)c3cc(Br)ccc3O)cc2)NC(=O)NC1=O	751069957	UIKYUIOUWDWEIX-SFHVURJKSA-N	447.245	1.284	50	20	IDGD	
Cn1c(O)nc2ccc(C(=O)NNC(=O)c3cccc(S(=O)(=O)N4CCCC4)c3)cc21	751539722	XJKDRAMLIHVJDQ-UHFFFAOYSA-N	443.485	1.138	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)NC[C@@H]2CCN(S(C)(=O)=O)C2)c(C)n1C[C@H]1CCCO1	753130445	YVCKRQHWKOLYRF-YUHPSRBCSA-N	434.562	1.589	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)c1ccccc1F)C(=O)NNc1cc(Cl)nc(N)n1	753453245	BVHLVWSAHUPQPG-SNVBAGLBSA-N	448.933	1.395	50	20	IDGD	
COC(=O)c1ccc(F)c(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1	755848305	UIUOFGKGXRFWKK-UHFFFAOYSA-N	438.437	1.329	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)Nc2cccc(OCCS(C)(=O)=O)c2)cc1C	756297627	NHFJUJULCCYAKW-UHFFFAOYSA-N	435.502	1.959	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)Nc2ccc(S(=O)(=O)NCC3CC3)cc2)c1O	756785441	UXTZGHDAKTVCSL-UHFFFAOYSA-N	434.474	1.556	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1O)Nc1ccccc1OCC(=O)N1CCOCC1	756872074	AGOZFUBHCKLYAJ-UHFFFAOYSA-N	448.863	1.750	50	20	IDGD	
NC(=O)c1ccc(NC(=O)NNC(=O)c2nc(-c3ccccc3)n(-c3ccccc3)n2)cn1	757700934	WRELLOLNNBDESF-UHFFFAOYSA-N	442.439	1.895	50	20	IDGD	
CCCC1(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)CCC1	758899320	UJUMVYVNQSSXFT-UHFFFAOYSA-N	438.550	1.622	50	20	IDGD	
Cn1ccc(NC(=O)/C(C#N)=C/c2ccc(OCCn3cc(C(=O)O)nn3)c(Cl)c2)n1	759088596	CCUPXTSUJDONTJ-MDWZMJQESA-N	441.835	1.988	50	20	IDGD	
COc1cc(F)cc(NNC(=O)CN2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)c1	759311568	WSIJIDHDUOYQEU-UHFFFAOYSA-N	436.509	1.592	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1cnn(C)c1Br	759643931	XWFUGQKURDNHAU-UHFFFAOYSA-N	445.657	1.463	50	20	IDGD	
Cc1cc(Cl)c([N+](=O)[O-])cc1S(=O)(=O)NNC(=O)CNC(=O)c1cccs1	761893101	CLLFFTPJTLXPIC-UHFFFAOYSA-N	432.867	1.358	50	20	IDGD	
C[C@@H](CC(=O)NNC(=O)CNC(=O)c1ccco1)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	763325236	YXDMSGOQBRZCTB-LSDHHAIUSA-N	436.509	1.830	50	20	IDGD	
COCc1cc(NC(=O)C(=O)NNC(=O)CCCOc2ccc(Cl)cc2C)ncn1	763502626	YFXAKVRRCPYKMC-UHFFFAOYSA-N	435.868	1.530	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)C(=O)Nc1cccc(Cl)c1-n1cccn1	763551910	UIJSDBDXBOSNKN-UHFFFAOYSA-N	427.804	1.654	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2ccccc2C(=O)NC(C)(C)C)c1	763623440	MECUFSLPFNGTAY-UHFFFAOYSA-N	426.473	1.688	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1cccc(Cl)c1-n1cccn1	763627905	FSBQFMWZWRURPR-UHFFFAOYSA-N	437.847	1.882	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2cc(C(=O)NC3CC3)ccc2C)c1	763646142	BWJFRAPIUGYAHF-UHFFFAOYSA-N	438.484	1.669	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(C(=O)N(C)C)c(Cl)c1	763664217	SVEDQZGSBHOHPE-UHFFFAOYSA-N	448.863	1.215	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccc(N2CCCC2=O)c1	763681352	JWUUYKQEOGYFLU-UHFFFAOYSA-N	440.456	1.377	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2cccc(N3CCOC3=O)c2C)c1	763771510	HUNDRZRYEFFTMP-UHFFFAOYSA-N	442.428	1.369	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2cccnc2N2CCCCC2)c1	763773520	YWFADTUHROSQGO-UHFFFAOYSA-N	427.461	1.489	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2ccnn2Cc2ccc(C)s2)c1	763775919	YUZHZEOZHGTEFO-UHFFFAOYSA-N	443.485	1.718	50	20	IDGD	
COC(=O)N(C)Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCC3)cc1	763782452	CWMNBKPPJMKCLW-UHFFFAOYSA-N	430.486	1.835	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cccnc2OC(C)C)cc1	763859454	BLUQPXRLNNAKEW-AWEZNQCLSA-N	430.461	1.821	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cccc(NC(=O)OC)c2)cc1	763859753	FSUXKLCGNSLTKO-ZDUSSCGKSA-N	444.444	1.817	50	20	IDGD	
Cc1nc(-c2cccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc3ccc(F)cc3)c2)no1	763871928	ITMQNQNNHYEXMQ-LLVKDONJSA-N	427.392	1.738	50	20	IDGD	
CC(C)Sc1ccccc1NC(=O)C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	763916203	CVQRRPWQBUZHAO-UHFFFAOYSA-N	425.474	1.563	50	20	IDGD	
Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)C(=O)NNC(=O)c1ccc[nH]1	763980712	ZQODASZNOZGQBR-KRWDZBQOSA-N	435.488	1.366	50	20	IDGD	
COc1ccc(NC(=O)c2ccc(NC(=O)C(=O)NNC(=O)c3cccn3C)cc2)cc1	763999973	YCNNZXVTIOMFRQ-UHFFFAOYSA-N	435.440	1.686	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)c(OC(F)F)c1	764166248	AESWWHGAVCTNML-OAHLLOKOSA-N	449.366	1.164	50	20	IDGD	
O=C(CCc1ccccc1)NNC(=O)C(=O)Nc1ccc2c(c1)C(=O)N(CC1CC1)C2=O	764192806	NPCNINFLZSKBDW-UHFFFAOYSA-N	434.452	1.411	50	20	IDGD	
CO[C@H]1Cc2ccc(NC(=O)C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)cc2C1	764204525	XRPLLBCNMIXUPH-INIZCTEOSA-N	434.493	1.191	50	20	IDGD	
N#CCCCOc1cccc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c1	764350724	JBNVTLSPGOTNNA-UHFFFAOYSA-N	432.440	1.955	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(C)o2)c2ccccc12	764371364	NUCZTWYKZPRTEK-UHFFFAOYSA-N	425.397	1.693	50	20	IDGD	
COC(=O)C(C)(C)c1ccc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)cc1	764380387	YVUWNPSFBYEJAE-UHFFFAOYSA-N	449.410	1.895	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1)C(=O)Nc1cccc(-c2nnco2)c1	764386948	FRNOVSDEUHHNRC-UHFFFAOYSA-N	435.375	1.666	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1)C(=O)Nc1ccnn1C1CCCC1	764387018	GBFAGJCTGPOLOJ-UHFFFAOYSA-N	425.424	1.927	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCc2cccc(N3CCCS3(=O)=O)c2)cc1OC	765200921	JVGAELFVOBZHTD-UHFFFAOYSA-N	448.501	1.388	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1ccc2nc(S)oc2c1	766640809	GIGMDIGNUFETFE-UHFFFAOYSA-N	439.497	1.336	50	20	IDGD	
C[C@@H]1CN(S(=O)(=O)N2CCN(C(=O)[C@H](Br)C(C)(C)C)CC2)C[C@@H](C)O1	767028358	CNPXUDPOIZGLFX-MCIONIFRSA-N	440.404	1.294	50	20	IDGD	
Cc1ccc([C@@H](CN2CCOCC2)NC(=O)NNc2nc(O)c3cnn(C)c3n2)cc1	770343650	NWYLHCMZXAUAFI-MRXNPFEDSA-N	426.481	1.077	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(OC)c2cccnc12	770773387	IJGDRKOWPBTFLL-UHFFFAOYSA-N	438.440	1.807	50	20	IDGD	
COC(=O)c1ccc(C)c(S(=O)(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)c1	771607699	QNWNBMUTTLXACC-UHFFFAOYSA-N	439.877	1.061	50	20	IDGD	
Cn1cc(NC(=O)C(=O)NNC(=O)CCSc2ccc(F)cc2)c(C(F)(F)F)n1	773530292	VPQHBJQPVVJMCC-UHFFFAOYSA-N	433.387	1.846	50	20	IDGD	
CC(C)C(CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)C(C)C	775027102	FZFQDLOGJNAHNR-UHFFFAOYSA-N	440.566	1.580	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2ccccc2OC(F)(F)F)cc1	775128859	FKNZQHLRPVWBLD-UHFFFAOYSA-N	445.419	1.975	50	20	IDGD	
CCOC(=O)N1CCC[C@H]([C@@H](C)NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)C1	776874564	LNDNBRBUWZQUMG-WBVHZDCISA-N	447.540	1.280	50	20	IDGD	
CCS(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1	776911481	GEXFGBPWSJLHPP-UHFFFAOYSA-N	427.486	1.810	50	20	IDGD	
O=C(COc1cn(-c2ccccc2)nc1C(=O)NNc1ccccn1)NNc1ccccn1	777470593	YQQIGHBOVPBVTH-UHFFFAOYSA-N	444.455	1.941	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C(=O)Nc2cnn(Cc3ccccc3)c2)nc2ccccc21	782893333	HKIBGXIECUCYED-UHFFFAOYSA-N	431.456	1.147	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2ncn(Cc3cccc(Br)c3)n2)nc(C)n1	783326632	LRSAHPKLULOMFO-UHFFFAOYSA-N	445.281	1.578	50	20	IDGD	
Cc1ccc(NNC(=O)C(=O)Nc2ccc(S(=O)(=O)N3C[C@@H](C)O[C@H](C)C3)cc2)cc1	783348413	DTLBCJBLSYBRHN-HZPDHXFCSA-N	446.529	1.875	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NN=C2CCOc3c2cc(F)cc3[N+](=O)[O-])ccc1Cl	783813601	QUCHBSOQEWQLTB-UHFFFAOYSA-N	442.812	1.951	50	20	IDGD	
O=C(NNC(=O)C(=O)N1CCCC1)C(=O)Nc1ccc(Oc2cccc(Cl)c2)cc1	784000298	YCLFJKUJZACUMC-UHFFFAOYSA-N	430.848	1.841	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNc2cccc(S(C)(=O)=O)c2)cccc1C(=O)N1CCCC1	784844817	PQAXEMWCMTXBJR-UHFFFAOYSA-N	444.513	1.716	50	20	IDGD	
CCNC(=O)N(C)NC(=O)C(=O)Nc1cccc(C(=O)N2CCc3sccc3C2)c1C	784916751	BNUCFFHNABAMEJ-UHFFFAOYSA-N	443.529	1.886	50	20	IDGD	
Nc1ccc([N+](=O)[O-])cc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	786689767	XTCJPCOWSBIKJI-UHFFFAOYSA-N	447.473	1.426	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)N2CCN(c3c(C#N)c(C)nn3C)CC2)c1C	788475954	JPSUGCPBAKCSIW-MOSHPQCFSA-N	435.532	1.921	50	20	IDGD	
C[C@H](CC(=O)NNc1nnc(-c2ccccn2)s1)/N=C1/NS(=O)(=O)c2ccccc21	788556313	IQIFSYSXNAKFOV-LLVKDONJSA-N	443.514	1.561	50	20	IDGD	
COC[C@H](Cc1ccccc1)N(C)C(=O)NNC(=O)c1csc(N2CCOCC2)n1	788987906	AGHVRGTUJZTSRS-INIZCTEOSA-N	433.534	1.524	50	20	IDGD	
COc1c(C)cnc(Cn2cnc(NC(=O)C(=O)NNc3cc(C)ccc3F)n2)c1C	789761566	JSIVMNWVPHCNDY-UHFFFAOYSA-N	427.440	1.876	50	20	IDGD	
COC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)c1	789809972	JILSULIIEFPRLY-IRXDYDNUSA-N	426.429	1.524	50	20	IDGD	
COc1ccccc1NC(=S)NNC(=O)Cn1c(CS(C)(=O)=O)nc2ccccc21	792952651	IUOFAUXRKRDEJD-UHFFFAOYSA-N	447.542	1.607	50	20	IDGD	
CC(C)(C)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2O)cc1[N+](=O)[O-]	793026114	PUBKTYPEKFONMG-UHFFFAOYSA-N	430.417	1.763	50	20	IDGD	
C=C(CBr)COC(=O)c1cc(S(=O)(=O)N2CCOCC2)ccc1OC	795359243	CUKHWISRLMHXLG-UHFFFAOYSA-N	434.308	1.824	50	20	IDGD	
CC(=O)N[C@](C)(C(=O)NNc1ccc(C(F)(F)F)cn1)c1ccc(S(C)(=O)=O)cc1	797752405	DSNKZLIGXYKYPP-KRWDZBQOSA-N	444.435	1.999	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)C(=O)Nc1cccc(NC(=O)c2ccccc2)c1	807428828	HEPACNMNIMZODS-UHFFFAOYSA-N	442.439	1.996	50	20	IDGD	
CN(C1CCN(C(=O)OC(C)(C)C)CC1)S(=O)(=O)NNC(=O)c1ccccc1O	808069127	QELDYVZXEJWXPQ-UHFFFAOYSA-N	428.511	1.203	50	20	IDGD	
NC(=O)c1ccccc1NCC(=O)NNc1ccc(S(=O)(=O)Nc2nccs2)cc1	809706420	YASQMBJCEUBNLW-UHFFFAOYSA-N	446.514	1.598	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)NCC(=O)NNc2ccc(Br)cc2)cc1	810041964	GSMBFPNXEUZEDA-UHFFFAOYSA-N	441.307	1.829	50	20	IDGD	
Cn1nncc1NC(=O)C(=O)NNC(=O)c1cn(-c2ccccc2)nc1-c1ccccc1	810385488	VDIRBUJHHBVRMA-UHFFFAOYSA-N	430.428	1.068	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)NCc2cc(C)nc(N3CCCC3)n2)cc1OC	813855106	KYYFWFMHHJBXQM-UHFFFAOYSA-N	428.493	1.937	50	20	IDGD	
Cc1nccc(CCC(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)n1	814421380	DBSRSUDYLHWHAV-UHFFFAOYSA-N	442.483	1.881	50	20	IDGD	
O=C(CNC(=O)NNC(=O)Cc1ccc2ccccc2c1)NCCN1CCCCCC1	814421728	JTGUFWKUBPDSGN-UHFFFAOYSA-N	425.533	1.705	50	20	IDGD	
C[C@@H]1SCCC1=NNC(=O)C[C@@H](C(=O)NN=C1CCS[C@H]1C)N1CCOCC1	814855815	UJWYZPPXVPEKHW-XEZPLFJOSA-N	427.596	1.073	50	20	IDGD	
CCOCCCn1c(NNC(=O)C[C@H]2CCCS(=O)(=O)C2)nc2ccccc2c1=O	815604151	FYWSQCXLSASLLF-OAHLLOKOSA-N	436.534	1.481	50	20	IDGD	
Cc1cc(C#N)cnc1C(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	815827188	PFJAPCRCCKYCLC-UHFFFAOYSA-N	426.908	1.494	50	20	IDGD	
COC(=O)c1cc(NNC(=O)CN2C(=O)N[C@](C)(c3ccc(F)cc3)C2=O)ccc1C	816688191	HKXBYKDUTZWACY-OAQYLSRUSA-N	428.420	1.831	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@]2(c3ccccc3)CCC(=O)NC2)cc(OC)c1OC	816814388	PHWZMLPZHDUOPF-JOCHJYFZSA-N	427.457	1.321	50	20	IDGD	
C[C@H](NC(=O)c1n[nH]c2ccccc12)C(=O)NNc1ccccc1S(=O)(=O)N(C)C	817053239	JSLQOUJLSSGUAX-LBPRGKRZSA-N	430.490	1.075	50	20	IDGD	
COc1cccc(/C=C(/C(=O)NNC(=O)c2ccc(OC)c(OC)c2)n2nnnc2C)c1	818011933	FAZUGTIWCAGXAT-BOPFTXTBSA-N	438.444	1.467	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)cc1	825542495	PXRAWNUBRPGVTN-UHFFFAOYSA-N	443.416	1.551	50	20	IDGD	
CS(=O)(=O)Nc1ccc(C(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)cc1	842150264	BBTGJUGRLLMUCS-UHFFFAOYSA-N	425.850	1.330	50	20	IDGD	
Cc1cc(F)ccc1S(=O)(=O)Nc1ccccc1C(=O)NNC(=O)C(=O)NC(C)C	843406829	XATITOKZUFUYDW-UHFFFAOYSA-N	436.465	1.221	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCc2ccccc21)c1cccc(S(=O)(=O)N2CCOCC2)c1	906446769	ANKDFICQRIFECO-FQEVSTJZSA-N	443.525	1.589	50	20	IDGD	
COc1ccc(-n2nnc(C(=O)NNC(=O)c3nn(-c4ccccc4)cc3O)c2C)cc1	915061935	ABGXXKIXHWXTBL-UHFFFAOYSA-N	433.428	1.550	50	20	IDGD	
CC(=NNC(=O)c1ccc(N)cc1)c1ccc(S(=O)(=O)N2CCC(C(=O)O)CC2)cc1	916264261	HAIZSVYUXZLKPN-UHFFFAOYSA-N	444.513	1.908	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NCC[C@@](O)(c2nccn2C)C(F)(F)F)cc1	916378215	JRUPVRKMSCBJHH-QGZVFWFLSA-N	429.399	1.278	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NC[C@H](C)N2CCCC[C@@H]2C)cc1	916446931	DTJLFPZZZAOPON-IRXDYDNUSA-N	439.582	1.209	50	20	IDGD	
CSC[C@@H](C(=O)NNC(=O)c1c[nH]c2ccccc12)N1C(=O)[C@H]2CCCC[C@H]2C1=O	917359053	UIVDIWMAKGPYCW-VBQJREDUSA-N	428.514	1.836	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCc2cccc(OCC(=O)N(C)C)c2)cc1OC	918224657	XXLHCTWUHMOFLT-UHFFFAOYSA-N	430.461	1.315	50	20	IDGD	
CC(C)[C@H](Oc1ccccc1C#N)C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	918277598	IWZWOUQRPATAFZ-IBGZPJMESA-N	444.513	1.673	50	20	IDGD	
Cc1nn(C)c(C)c1-c1cc(C(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)n[nH]1	919326421	MBCILSHDEJCVPI-UHFFFAOYSA-N	430.852	1.698	50	20	IDGD	
O=C(NC[C@@H](O)c1ccccc1C(F)(F)F)NNC(=O)c1ccc(-n2cnnn2)cc1	921070750	CLPQJISAAWTEOX-OAHLLOKOSA-N	435.366	1.359	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2ccnc(OC3CCC3)c2)CC1	1116418215	RLZQJSYVRKMLJG-UHFFFAOYSA-N	446.533	1.101	50	20	IDGD	
CC(=O)NC1CCC(NC(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)CC1	1323414439	XDYOUZYAGYCNCZ-UHFFFAOYSA-N	428.493	1.369	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)[C@@H]2CC(=O)N(Cc3ccco3)C2)CC1	1328626986	RUXAUHALVOQKEG-OAHLLOKOSA-N	434.493	1.423	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)CCCCN2C(=O)c3ccccc3C2=O)cc1	1347600674	PBQFXJLTVVLJPC-UHFFFAOYSA-N	431.470	1.336	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc3ccccn3n2)C1	1778483399	SCGYAWALRNLQLQ-HGHGUNKESA-N	434.924	1.716	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(CCN(C(=O)[C@H]3ON=C(c4ccccc4)O3)C2)C1	1778873531	QIYPUJZSTAKAKQ-RTWAWAEBSA-N	447.564	1.403	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3c(F)cncc3F)C2)C1	1779731708	FJIRPANFPRPYTP-PIGZYNQJSA-N	432.265	1.977	50	20	IDGD	
O=C(c1cc(Cl)cnc1O)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781325233	FMIRKELBAAYPNP-IAQYHMDHSA-N	436.665	1.575	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781325269	LPYIZTVDTHUEHZ-NRUUGDAUSA-N	430.112	1.538	50	20	IDGD	
COc1cnc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](F)Br)C3)C2)c(F)c1	1781328142	JCXDQOJWGMSHEI-XJKSGUPXSA-N	434.237	1.363	50	20	IDGD	
CCC1(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](C)CBr)C3)COC1	1781642996	NOPXZUXYJWAKKI-QMTMVMCOSA-N	431.371	1.958	50	20	IDGD	
Cc1cccn2ncc(C(=O)N3CC[C@]4(C3)CN(C(=O)[C@@H](C)Br)CCO4)c12	1782522108	YJHXPTAUIFMNRV-KUHUBIRLSA-N	435.322	1.870	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCO[C@@]2(CCN(C(=O)Cc3cc[nH]n3)C2)C1	1782793835	DHSITRZAIBWPOW-KYIYGJGQSA-N	441.438	1.667	50	20	IDGD	
COc1ccc(CC(=O)N2CCO[C@]3(CCN(C(=O)[C@H](C)Br)C3)C2)cc1F	1783540108	RSWXVWITQPMSDO-ORAYPTAESA-N	443.313	1.990	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1ccc(C#N)cc1Cl)CCO2	1783934792	MWGBYBWGOMOTNC-NRFANRHFSA-N	447.923	1.028	50	20	IDGD	
C=CC[C@@H](NC(=O)OC(C)(C)C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Cl)C[C@@H]21	1784786007	QFTKDSIYWOSKEP-ARKGTOAJSA-N	447.935	1.970	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3ccc(F)cn3)[C@H]2C1	1787034599	YEQCSYWUMZNVBF-DLLGKBFGSA-N	432.323	1.979	50	20	IDGD	
Cn1c(=O)c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Cl)C[C@@H]32)nc2ccccc21	1787974415	HGFPRSGIBFMMTA-WXRXAMBDSA-N	436.871	1.061	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccn4cncc4c3)[C@H]2C1	1788409044	XCVAXDYKVJEOCA-WDSOQIARSA-N	430.581	1.779	50	20	IDGD	
C[C@H](Nc1cnccn1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]21	1788629750	XBMMCYLCEBJPFR-OXMIBSBGSA-N	444.363	1.493	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(Cl)c3)[C@H]2C1	1789525069	QVQDWJRKKTZZEG-SZMVWBNQSA-N	436.940	1.306	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3cnccn3)C[C@@H]21	1789872976	MVXVCIRANZNPAQ-QBWPOKONSA-N	429.348	1.625	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3cccc(O)c3)C[C@@H]21)[C@@H](F)Br	1789925935	YXNLBGUBUCJMFX-OWIUFQIYSA-N	443.313	1.995	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(NC(C)=O)cc3)[C@H]2C1	1792005155	RSFGZOZHKPPUJO-KANFNMMFSA-N	437.924	1.492	50	20	IDGD	
Cc1c(F)ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)CBr)C3)c1N	1795699957	DVTDEYGVGHALOZ-AKENFEQQSA-N	442.329	1.951	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)n1cccc1C=O	1795746764	QWMCBJKOMBOFEM-SVZOTFJBSA-N	440.338	1.482	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C(C)(C)NCCC#N	1796044407	FGRAQSMQKYNIMO-CKFWPPNZSA-N	441.536	1.040	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1[nH]nc2ccncc12	1796214577	YXHMADHFSYHMID-WJNVRWDZSA-N	436.310	1.335	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2nccnc2c1	1797054359	HGNVFVKKBFIEQU-LJGDNWOOSA-N	447.333	1.864	50	20	IDGD	
C[Si](C)(C)c1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCBr)C3)co1	1797723847	XPHGKBWXRFVQFV-XOIINTDNSA-N	443.414	1.813	50	20	IDGD	
NC(=O)NCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCCCCCCCCCCl	1799225062	HTBQIJMAOJHQEF-XEMDLRDOSA-N	445.004	1.994	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)c1ccc(OC(F)(F)F)cc1	1799493334	KHSAJBCHWOCDQM-AYRXBEOTSA-N	436.814	1.388	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)c1ccc(N2CCCCC2)cc1	1799594119	QAKGNOLUPHYQTM-HNJRGHQBSA-N	435.952	1.480	50	20	IDGD	
CN(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ncc[nH]1)C2)NC(=O)NCc1ccccc1	1799864942	URASDEZBBIZCGK-BCDXTJNWSA-N	439.520	1.008	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(C)(C)NCCC#N)C2	1800639005	FYJYIFVGCCTADW-XGUBFFRZSA-N	429.359	1.031	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(C)nn1CC)C2	1800640001	SBIABZCTTLIJCS-HLPPOEQASA-N	427.343	1.588	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)Cc1ccc(F)cc1)C2	1800979736	YAVHHRQYUNERIL-OMVTVGPASA-N	426.916	1.848	50	20	IDGD	
C[C@H](Cc1ccc(F)cc1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc(B(O)O)c1)C2	1801490728	BJRGZQCHTFHVSD-ZHHJKBAOSA-N	438.308	1.636	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2	1801953544	HOSSYKPGIJZDMF-YWVIFJGQSA-N	448.358	1.276	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1CCN(C(=O)Cn2nccn2)[C@H]1c1cccnc1	1803015796	OQKGRZZACNISFA-KMFMINBZSA-N	435.326	1.410	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc3nccnc3c2)[C@H]1c1cccnc1)[C@@H](O)CCl	1803142915	MSLKSCXBGBKPMB-VDGAXYAQSA-N	439.903	1.944	50	20	IDGD	
COc1ncccc1CCC(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1	1804540520	KJVMBHDXSKGXGO-CMKODMSKSA-N	446.935	1.724	50	20	IDGD	
C[C@H](C(=O)N1CCC2(CCCN(C(=O)[C@@H](O)CCl)C2)CC1)N1CSCSC1	1805522772	LBVTZVSOXKVWSH-CABCVRRESA-N	436.043	1.860	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCCC2(CCN(C(=O)[C@@H](C)NS(=O)(=O)CC)CC2)C1	1806154017	QWONPCZRWAXZIE-HZPDHXFCSA-N	436.018	1.953	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)N1CC[C@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]1c1cccnc1	1808302933	MXHZKSCIYMPBLB-NXEZDXNNSA-N	444.363	1.771	50	20	IDGD	
Cc1ccoc1C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1	1808498172	RGHWNFDQWUPOCD-APWZRJJASA-N	448.483	1.615	50	20	IDGD	
Cc1ccoc1C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1	1808498181	RGHWNFDQWUPOCD-VQIMIIECSA-N	448.483	1.615	50	20	IDGD	
O=C([C@H](O)CCl)N1CC[C@@H](CNC(=O)C2(Br)CC2)[C@@H]1c1cccnc1	1808695669	TXLLNYBUEZQGGF-MJBXVCDLSA-N	430.730	1.615	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)c2ccncc2)[C@H]1c1cccnc1	1810299184	NXFKWJNDXRGWRY-XLIONFOSSA-N	445.483	1.109	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H](CNC(=O)[C@H](C)NC(C)=O)[C@H]1c1cccnc1	1812651987	JIAMSDDGWDUCJK-NKKGCODLSA-N	439.354	1.786	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2CC[C@H]3CCC(=O)N3C2)[nH]n1)[C@H](O)CCl	1814872413	JTZYOMICPRJACB-BFJAYTPKSA-N	437.928	1.403	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)C1CC3(CCC3)C1)CC2)c1cccc(B(O)O)c1	1815361603	LDQDYXNUQLHEQV-INIZCTEOSA-N	439.346	1.629	50	20	IDGD	
O=C(Cc1ccsc1)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2	1815606088	MCPUAIWDAAYQQU-OAHLLOKOSA-N	441.343	1.353	50	20	IDGD	
O=C(CCC(F)(F)F)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1817094395	FTFPIHIAAMOQRJ-HNNXBMFYSA-N	438.215	1.738	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CS(=O)(=O)N2CCCC2)n[nH]1	1818108979	HVUPDICOEYUPJS-ZFWWWQNUSA-N	445.973	1.845	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cscn1)CC2	1819795284	LRLOZLFGDQISGE-VIFPVBQESA-N	443.514	1.138	50	20	IDGD	
O=C(Nc1cccnc1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)C(Cl)Cl)CC2	1820052126	MOBVGQBXXYWWST-QMMMGPOBSA-N	428.301	1.893	50	20	IDGD	
CC[C@@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](Cc2cnc[nH]2)NC(C)=O)[nH]n1	1820859952	IBAIVCAMFNHUKO-OIISXLGYSA-N	449.943	1.890	50	20	IDGD	
C[C@H](Br)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](C)n2cnnn2)[nH]n1	1822192720	VWHJGVXFZVKCPM-HOSYDEDBSA-N	425.291	1.433	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)CNC(=O)C(F)(F)F)n[nH]1	1822441683	PDYVQFOBCIEHQS-GFCCVEGCSA-N	449.506	1.932	50	20	IDGD	
O=C(CN1C(=O)CSC1=S)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](F)Cl)[nH]n1	1823497125	ADMIIFRNHSTIJL-NOZJJQNGSA-N	433.918	1.797	50	20	IDGD	
Cc1ccncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1	1827902698	ZPZKGSRIRXXRMO-HXUWFJFHSA-N	429.565	1.996	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2nc3ncccn3n2)CC1	1828179566	BZZBFFBCIRSWNT-HZPDHXFCSA-N	434.928	1.611	50	20	IDGD	
COC[C@H](NC(C)=O)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CCBr)CC1	1829112758	DBDMCYIADLWPCP-IRXDYDNUSA-N	446.386	1.542	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CS(C)(=O)=O)CC1	1830317733	SOWRWGQRLPKLSC-PBHICJAKSA-N	427.394	1.887	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccccc3)C2)C1	1830538072	VDAZJDTWXIJCCL-OXJNMPFZSA-N	439.350	1.717	50	20	IDGD	
Cc1cc(Cl)cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)c1	1830738600	QMYPWJHDCVLXJZ-APWZRJJASA-N	431.316	1.318	50	20	IDGD	
CCC(=O)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)CC1	1831354592	CKAJILXCUYDKRT-LSPPGFKNSA-N	429.521	1.719	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H](N)CCC(N)=O)CC1	1831549038	MGAQVRFNKUBDKX-JYJNAYRXSA-N	445.402	1.372	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(O)ccc3O)C2)C1	1831653779	LTOZLOWSXPJGIL-OXJNMPFZSA-N	426.897	1.575	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3ccc(F)cc3F)CC2)CC1)[C@H](O)CCl	1833313990	YKCBUSCQDBXRJV-GOSISDBHSA-N	429.895	1.750	50	20	IDGD	
C[C@H](CC(N)=O)C(=O)NC1CCN(C2CCN(C(=O)[C@](C)(Cl)CCl)CC2)CC1	1833521973	DNDVKSIBTXCBCS-BFUOFWGJSA-N	435.396	1.306	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3csnn3)CC2)CC1	1833559144	OGTKWNBWUMFCKH-AWEZNQCLSA-N	444.399	1.897	50	20	IDGD	
Cc1cccc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCBr)CCO3)C2)c1	1834823700	DOQVIDHWUHKGSF-LJQANCHMSA-N	425.323	1.850	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cccn4c(O)nnc34)CC2)CC1	1835046067	PHESKTRVIHNPBS-KRWDZBQOSA-N	448.955	1.638	50	20	IDGD	
C[C@@H](Nc1cnccn1)C(=O)N1CCC(N2CCC(NC(=O)[C@H](F)Cl)CC2)CC1	1835084080	KDUSFERPRIAAHK-DYVFJYSZSA-N	426.924	1.383	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccc(F)cn3)CCO2)C1	1836030271	WHDMSGHRRNLAEH-XLIONFOSSA-N	427.904	1.627	50	20	IDGD	
C[C@H](Oc1ccccn1)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836720373	RTBUBDWLDCEXCW-YJBOKZPZSA-N	439.940	1.447	50	20	IDGD	
Cc1cccc2[nH]c(C(=O)N3CCO[C@@]4(COCCN(C(=O)[C@@H](O)CCl)C4)C3)cc12	1836912667	GTJBBUNMSDTMFX-RXVVDRJESA-N	435.908	1.146	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)CNC(=S)NCC)CC2)CC1	1836923083	WPOJZNHRFODRGV-KRWDZBQOSA-N	447.045	1.877	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc4c(c3)CNC4=O)CCO2)C1	1837152502	QBUDFHGKDIILES-DYESRHJHSA-N	435.908	1.017	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)Cc3noc(C)n3)CC2)CC1	1837156874	SWIDNCXODAEKAZ-INIZCTEOSA-N	428.917	1.173	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(Cl)ncn3)CCO2)C1	1838254858	YCJYAKFHLGRKPU-ACJLOTCBSA-N	431.320	1.608	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)C(Cl)Cl)CC2)CC1	1838789701	UIFOCWRTUBUIRL-UHFFFAOYSA-N	437.368	1.162	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3Cc4ccccc4CN3)C2)C1	1839144521	CVGBGZCWBKQZEL-NNMXDRDESA-N	435.952	1.175	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3n[nH]c4c(C)cccc34)C2)C1	1839148357	WLWCOZCBISWFEJ-KKSFZXQISA-N	434.924	1.959	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C=C/c3cnccn3)C2)C1	1839156403	OMAZQSFNPGGXQB-CJIROOEOSA-N	443.331	1.183	50	20	IDGD	
O=C(CCc1cccs1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839197657	DSXQBCAQWTUHHX-NVXWUHKLSA-N	449.342	1.828	50	20	IDGD	
O=C(/C=C/C1CCCC1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839202014	QQBBAMACIFCUMG-BHMLKFMNSA-N	433.318	1.880	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1[C@@H]3C=CS[C@@H]13)CCO2	1839694900	VPULATLGUMYYEB-VTWRMFPLSA-N	445.379	1.349	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3[nH]ccc3C)C2)C1	1839962328	ATSXYVIBLAGPIG-RDTXWAMCSA-N	428.327	1.567	50	20	IDGD	
Cc1ccc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)o1	1840036818	RMQFBPSRBXGKIO-KBXCAEBGSA-N	429.311	1.370	50	20	IDGD	
COc1ccc(CCC(=O)N2CCOC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)cc1	1840187871	BYKOYPRYSWLUMA-FQEVSTJZSA-N	445.343	1.888	50	20	IDGD	
Cc1cn2c(=O)c(C(=O)N3CC4(CCCN4C(=O)CCBr)C3)cnc2s1	1842638327	LSAKZGQUGFUNRO-UHFFFAOYSA-N	439.335	1.666	50	20	IDGD	
CC[C@@H](C)[C@H](N)C(=O)N1CCCC12CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1842888734	AEKVNHBLPZNJBX-ILXRZTDVSA-N	430.977	1.695	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)[C@@H]2Cc3ccccc3O2)C1	1843908302	YNQCOOPLSBLQIS-QVWJKXSPSA-N	435.484	1.328	50	20	IDGD	
CCSc1cccnc1C(=O)N1CCCC12CN(C(=O)c1ccc(B(O)O)cc1)C2	1844846328	SXALCOSDBWUZTO-UHFFFAOYSA-N	425.319	1.004	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)c2ccccc2C(F)(F)F)C1	1844887439	NZRYYFHHXBJUNI-UHFFFAOYSA-N	426.439	1.895	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@H]2CN(C(=O)OC(C)(C)C)C[C@@H]2O)C1	1845104037	RQURVMHVDVGOTO-PMPSAXMXSA-N	443.972	1.825	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCCC12CN(C(=O)c1cncc(S(C)(=O)=O)c1)C2	1845169357	DTBJXHAADJENAY-INIZCTEOSA-N	434.345	1.538	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@H]1[C@@H](O)CCN1Cc1ccccc1)C2	1846364454	QCFAQEAFIVKXQT-QYZOEREBSA-N	435.952	1.079	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@H]1CCCN1C(=O)OC(C)(C)C)C2	1846364981	UECXUPGSQYHASX-GJZGRUSLSA-N	429.945	1.843	50	20	IDGD	
CC(C)(C)OC(=O)N1CCOC[C@@H]1C(=O)N1CC2(CCCN2C(=O)C(Cl)Cl)C1	1846386835	BPUZXGYDJLMCHS-GFCCVEGCSA-N	436.336	1.629	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H]1C[C@@H]1c1ccc(F)c(F)c1	1847608202	VGYWJMIGAAOYBP-JYWFKMLOSA-N	440.255	1.264	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)CCC(=O)N2CCC(c3ccccc3)=N2)cc1	10016026	NJFSBQFHRFQSTN-UHFFFAOYSA-N	436.468	1.716	50	20	IDGD	
CC(C)NS(=O)(=O)c1cccc(C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)c1	10159957	LPOBSXWHNZZVLL-UHFFFAOYSA-N	443.485	1.339	50	20	IDGD	
COC(=O)/C=C\c1cc(OC)c(OC)c(S(=O)(=O)NNC(=O)c2ccccc2C)c1	210916826	QLWYYUFDMYHQJY-KTKRTIGZSA-N	434.470	1.822	50	20	IDGD	
Cc1sc2nc(CCC(=O)NNC(=O)CNC(=O)c3cccs3)nc(O)c2c1C	725740423	VACHWIROMRWNBM-UHFFFAOYSA-N	433.515	1.585	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCC(=O)Nc1cccnc1	725859768	GEDFQQSCSVLHLR-LLVKDONJSA-N	436.266	1.581	50	20	IDGD	
C[C@H]1CN(Cc2cccc(CNC(=O)NNC(=O)CNC(=O)c3cccs3)c2)CCO1	726241963	QHNISQVGHKTBHL-HNNXBMFYSA-N	445.545	1.229	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)CNC(=O)c1cccs1)c1cccc(N2CCOC2=O)c1	726243758	JKLCMOISPLJSOO-LBPRGKRZSA-N	431.474	1.526	50	20	IDGD	
C[C@@]1(c2ccc(CNC(=O)NNC(=O)c3cc4c(s3)CCC4)cc2)NC(=O)NC1=O	726282180	KHQITHDFTOTHCE-FQEVSTJZSA-N	427.486	1.436	50	20	IDGD	
CCCn1nc(C(=O)NNS(=O)(=O)c2ccc3c(c2)COC3)c2ccccc2c1=O	727719882	CQRVLEKKPHLMND-UHFFFAOYSA-N	428.470	1.460	50	20	IDGD	
CCC[C@](C)(NC(=O)OC(C)(C)C)C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	727729653	VZBMBOODSMKLOJ-IBGZPJMESA-N	427.523	1.935	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)[C@@H]2CSCN2C(=O)C(C)(C)C)c2ccccc2c1=O	728150829	KSZKONUHZYZJSP-HNNXBMFYSA-N	445.545	1.515	50	20	IDGD	
N#C/C(=C/c1c[nH]nc1-c1ccc2c(c1)OCO2)C(=O)Nc1ccc(S(N)(=O)=O)cc1	728157196	MFHPUXBNWBDRSV-QPEQYQDCSA-N	437.437	1.998	50	20	IDGD	
CC(=O)Nc1cccc(OCCNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1	729229455	BJIZAEHPJICBQS-UHFFFAOYSA-N	441.492	1.061	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCCNC(=O)NNC(=O)Cn2ccc3ccccc32)cc1	729496555	VKRDRSJLQYIXMY-UHFFFAOYSA-N	429.502	1.259	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)N2CCC[C@@H](NS(=O)(=O)c3cccc(F)c3)C2)cc1	729499271	CSUKHFYNNBKAOD-QGZVFWFLSA-N	445.476	1.495	50	20	IDGD	
O=C(CC1(CC(=O)Nc2nccs2)CCCCC1)NNC(=O)[C@@H]1CCS(=O)(=O)C1	730273600	ZNDMEUQHTDTDGS-CYBMUJFWSA-N	442.563	1.394	50	20	IDGD	
CC(C)(C(=O)NNC(=O)NCCC(=O)N1CCN(c2ccccn2)CC1)c1ccccc1	731282171	HRPCLJZAZKRNEW-UHFFFAOYSA-N	438.532	1.429	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=O)c2ccccc2OC)ccc1OC	731492889	JOOYRUCBVDFIKW-UHFFFAOYSA-N	435.502	1.809	50	20	IDGD	
CS(=O)(=O)CCN1CCC(NC(=O)NNC(=O)c2cc3c(s2)CCCCC3)CC1	731685974	GBGAIMHRZWTUDW-UHFFFAOYSA-N	442.607	1.470	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCC(C)(C)NS(C)(=O)=O)ccc1OCCC(C)C	731761643	WQZFLVLOTKOFNA-UHFFFAOYSA-N	444.554	1.392	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])o1)c1ccc2c(c1)OCCO2	731875590	JUTDGYFVWZFOPK-LBPRGKRZSA-N	430.373	1.025	50	20	IDGD	
Cc1sc2nc(CCC(=O)NNC(=O)CCN3C[C@H](C)O[C@H](C)C3)nc(O)c2c1C	732261626	FEAJCJUNLQEKJT-TXEJJXNPSA-N	435.550	1.593	50	20	IDGD	
CN1CCN(C)[C@H](CNC(=O)NNC(=O)c2cn(-c3ccccc3)nc2-c2ccccc2)C1	732475029	QEMPRWIIPPKHNK-HXUWFJFHSA-N	447.543	1.729	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)N[C@@H]2CCN(CC(F)(F)F)C2=O)cc1	732589818	FUZFIXXUVJTPQJ-BXUZGUMPSA-N	432.399	1.346	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)N[C@H]2CCN(c3ccccc3C(N)=O)C2)c1C	732595413	QQIDMQFQHOZRMU-IRXDYDNUSA-N	439.516	1.779	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)[C@@H](C)Oc2ccccc2Br)C[C@@H](C)O1	732828905	WJTKJXZSBKZBIE-HZSPNIEDSA-N	428.327	1.863	50	20	IDGD	
CS(=O)(=O)NC1(CNC(=O)NNC(=O)NCc2ccc(Cl)cc2)CCCCC1	733037415	XNRWIDKYNIWPQP-UHFFFAOYSA-N	431.946	1.606	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2C[C@@H](C)N(C(=O)OC(C)(C)C)[C@H](C)C2)n1	733202823	TYEZALWINRYBDQ-ZIAGYGMSSA-N	425.555	1.471	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)[C@@H]2C[C@@H]2c2c(F)cccc2F)ccc1Cl	734809243	JHPKBGDEMSINHE-VHSXEESVSA-N	429.832	1.830	50	20	IDGD	
O=C(NN=Cc1occc1Br)C(=O)NN=Cc1occc1Br	735224817	WQYLFTVXLFVXKK-UHFFFAOYSA-N	432.028	1.998	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN2Cc3c(OC)ccc(OC)c3[C@@H](O)C2)cc1C	736308497	OGRJARXACYBIKG-AWEZNQCLSA-N	433.530	1.946	50	20	IDGD	
C[C@@H]1CC(C)(C)C[C@]2(C1)NC(=O)N(CC(=O)NNC(=O)COCc1ccccc1)C2=O	737636121	BXFDNDZFUJUVBE-QRQCRPRQSA-N	430.505	1.487	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)c1cc(C)nc2c1cnn2Cc1cccs1	740852016	GYQVXPLVYCHWOK-UHFFFAOYSA-N	428.518	1.915	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)COc2ccccc2O)c(C)c1S(=O)(=O)NC1CC1	741071621	WCBWJCUGDGCDAU-UHFFFAOYSA-N	448.501	1.681	50	20	IDGD	
C[C@@]1(c2ccccc2)NC(=O)N(CC(=O)NNC(=O)c2cccc(Br)c2)C1=O	742768886	BNSYEPCTYRFQOH-IBGZPJMESA-N	445.273	1.677	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2cc(Cl)c3c(c2)OCCO3)cc1	743829677	AKQBHWAZYGODNE-UHFFFAOYSA-N	425.850	1.981	50	20	IDGD	
Cc1ccccc1[C@@H](CC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)NC(N)=O	743830057	LWLGROYKJQIEKP-MRXNPFEDSA-N	433.490	1.351	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(/C#N)C(=O)NC[C@@H]2CCC[C@]23NC(=O)NC3=O)c1C	744625542	AWRWMULFTPFWAY-APFQNWTJSA-N	427.505	1.714	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)c2cc(F)ccc2N2CCOCC2)c1	744984029	GRFUQMYSHXMEHP-UHFFFAOYSA-N	426.404	1.152	50	20	IDGD	
C[C@@H]1CN(C(C)(C)CNC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)C[C@@H](C)O1	745408888	NMKGSWUCPVYMNJ-ZIAGYGMSSA-N	441.554	1.314	50	20	IDGD	
COc1cc(C)nc(NNC(=O)NC[C@H](c2ccc(OC)c(OC)c2)N2CCOCC2)n1	746741757	AJWOVLXLNKJQOE-MRXNPFEDSA-N	446.508	1.510	50	20	IDGD	
CCCN(CC)CCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	746772142	XGQAAARPXGTHHK-UHFFFAOYSA-N	425.555	1.147	50	20	IDGD	
CSCC[C@H](NC(=O)COc1ccccc1)C(=O)NNC(=O)c1ccc(C#N)cc1	747175656	CTAYYYOSGQFYGP-SFHVURJKSA-N	426.498	1.636	50	20	IDGD	
COc1cc(Cl)c(C)cc1NC(=O)CCNC(=O)NNC(=O)Cn1nc(C)cc1C	747594376	PYFIPFOXDJBFNV-UHFFFAOYSA-N	436.900	1.830	50	20	IDGD	
CN(C)[C@@]1(CNC(=O)NNC(=O)COc2ccc(Br)cc2)CCSC1	748646471	FZSWNRMLXWXYJG-MRXNPFEDSA-N	431.356	1.596	50	20	IDGD	
COc1cc(OC)cc(N2CC[C@@H](NC(=O)NNC(=O)[C@@H]3COc4ccccc4O3)C2)c1	748662997	YGSXUINYAYFNAI-VLIAUNLRSA-N	442.472	1.453	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)c1occc1CS(=O)(=O)c1ccccc1	751204144	DWSUDAHHERJAIN-UHFFFAOYSA-N	431.426	1.038	50	20	IDGD	
O=C(NNC(=O)c1ncoc1-c1cccc(C(F)(F)F)c1)N[C@@H]1CCS(=O)(=O)C1	751461072	PMORWQCZMOYQSF-LLVKDONJSA-N	432.380	1.492	50	20	IDGD	
C[C@H](NC(=S)NNC(=O)CS(=O)(=O)Cc1ccc(Br)cc1)C1CC1	751616209	ARCKPEDKOHVRHA-JTQLQIEISA-N	434.381	1.658	50	20	IDGD	
O=C(NCC1(CN2CCOCC2)CCCCC1)NNC(=O)c1ccc2c(c1)OCCO2	751817325	FYUMJLCMGJMLGH-UHFFFAOYSA-N	432.521	1.685	50	20	IDGD	
COc1ccc([C@H](NC(=O)NNC(=O)C(=O)N2CCCC2)c2ccccc2OC)cc1	752697916	GJBGYWGOLRJEJC-IBGZPJMESA-N	426.473	1.746	50	20	IDGD	
CC[C@H](NC(=O)NNC(=O)c1cc(OC)ccc1Br)C(=O)N1CCOCC1	753047515	URYHZJVGYYBGAC-AWEZNQCLSA-N	443.298	1.039	50	20	IDGD	
C[C@@]1(CCC(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)CCC(=O)N1	753428483	GANPUXOLOPCKNF-NRFANRHFSA-N	435.956	1.054	50	20	IDGD	
Cc1c(NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cccc1-n1cnnn1	755443676	IPRVRXCCRQLCOT-UHFFFAOYSA-N	449.519	1.336	50	20	IDGD	
CCc1noc(CC)c1CNC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1	756078200	LLRQVPAWVRXRDK-UHFFFAOYSA-N	437.522	1.259	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Nc2ccccc2Cn2cncn2)cc(OC)c1OC	756152670	QGBRAOVHMRJSPS-UHFFFAOYSA-N	426.433	1.819	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)N[C@@H]1CCN(c2c(F)cccc2F)C1=O	756213371	VKLHNYXREGZRFU-CQSZACIVSA-N	442.382	1.363	50	20	IDGD	
C[C@H](NS(=O)(=O)c1cccc(C(=O)NNc2ccc(C(N)=O)nn2)c1)c1ccccc1	757399520	NYSWPYDVTNIUBC-ZDUSSCGKSA-N	440.485	1.372	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)Nc2ccccc2N(C)S(C)(=O)=O)cc1OC	757660688	GZKQKJMZRRBDGW-UHFFFAOYSA-N	436.490	1.956	50	20	IDGD	
CC[C@@H](C)NS(=O)(=O)c1cccc(NC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1	757709633	OOSLEWBMLXYTFS-FZKQIMNGSA-N	448.501	1.756	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2cccc(I)c2O)C[C@H](C)O1	757714233	BGJOXPZFCYTPOW-QWRGUYRKSA-N	447.273	1.257	50	20	IDGD	
Cc1nn([C@@H]2CCS(=O)(=O)C2)c(C)c1NC(=O)NNC(=O)c1cccc(N(C)C)c1	757870874	AXBRLZOYDZLZOL-MRXNPFEDSA-N	434.522	1.392	50	20	IDGD	
Cc1ccc(Cl)c(OCC(=O)N2CCN(S(=O)(=O)CBr)CC2)c1	758536361	UKKJRYULYDKTMC-UHFFFAOYSA-N	425.732	1.854	50	20	IDGD	
CC(C)(C)OC(=O)NC1(C(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)CC1	760604903	SMWSIGTUBXWTMZ-UHFFFAOYSA-N	441.529	1.774	50	20	IDGD	
CC[C@H](NC(=O)NNC(=O)CNC(=O)c1ccco1)[C@H]1CN(Cc2ccccc2)CCO1	760751414	NASAPIYQDHAYKV-PKOBYXMFSA-N	443.504	1.019	50	20	IDGD	
Cc1nc(Cl)cc(NNC(=O)CCNC(=O)[C@H]2CCCN2C(=O)OC(C)(C)C)n1	761095091	ULLUHKOYHMPVNP-GFCCVEGCSA-N	426.905	1.787	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NN=C1C[C@@H](C)N(C)C1)N(S(C)(=O)=O)CC2	761805898	YEBRKXYVMPBJJE-CXAGYDPISA-N	438.550	1.149	50	20	IDGD	
O=C(NNC(=O)c1ccccc1)C(=O)Nc1ccccc1S(=O)(=O)N1CCCCC1	763420126	MDYJDOVNRZOPLB-UHFFFAOYSA-N	430.486	1.261	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1cccc(OCc2cccnc2)c1	763471818	MAXOLXNVWNJXKR-UHFFFAOYSA-N	435.396	1.969	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(C)nc2C)c1	763508359	GWBCZDBCCINDPJ-UHFFFAOYSA-N	447.517	1.129	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2ccc(=O)n(Cc3ccccc3)c2)c1	763644063	FCTHGSIHXVZZBS-UHFFFAOYSA-N	448.479	1.678	50	20	IDGD	
Cc1ccc(S(C)(=O)=O)cc1NC(=O)C(=O)NNC(=O)C12CC3CC(CC(C3)C1)C2	763727749	MVZZHLYEYIQNQS-UHFFFAOYSA-N	433.530	1.701	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccnc(OCC(F)(F)F)c2)c1	763760356	KSFGQYSVKGXSCA-UHFFFAOYSA-N	425.367	1.488	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(CS(C)(=O)=O)c2C)cc1	763809108	JXDYLHRZBFFVAK-UHFFFAOYSA-N	433.486	1.013	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)N(C)C(=O)CO3)c1C	763840022	HLKKRCXBUJEXFV-CQSZACIVSA-N	440.456	1.212	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)CC(=O)N2	763850975	CHYPZFGLZWYZIN-ZDUSSCGKSA-N	432.436	1.888	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cccc([S@](C)=O)c2)cc1	763862704	ZIBQLPPDUOBKBH-FZPQWHJUSA-N	433.486	1.376	50	20	IDGD	
COC(=O)[C@@H](C)Cc1ccc(NC(=O)C(=O)NNC(=O)Cc2c[nH]c3ccccc23)cc1	763865484	QSTYASYWFBYKSE-AWEZNQCLSA-N	436.468	1.848	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)cc1N1CCOC1=O	763871606	GHPPCSHGUCLNRZ-ZDUSSCGKSA-N	444.419	1.644	50	20	IDGD	
CCCOC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)cc1	763873999	YPCAONHZYKCEJK-CYBMUJFWSA-N	431.420	1.946	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)C(=O)Nc2ccc(C(=O)NC3CC3)cc2)cc1	763891225	MOBJQJNTCMNMFD-UHFFFAOYSA-N	426.498	1.765	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(C(N)=O)c(C)c2)ccc1OC(C)C	763916382	OJXYBVHJZYLCFL-UHFFFAOYSA-N	428.445	1.289	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)on1)C(=O)Nc1cnn(Cc2ccccc2)c1	764003342	GCVMDCOGSAYETN-UHFFFAOYSA-N	430.424	1.986	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc(OCCN2CCCCC2)cc1	764049499	ZQEJJOWQYWBAHM-UHFFFAOYSA-N	440.500	1.960	50	20	IDGD	
COc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NNC(=O)c1cccc2ccccc12	764050245	DKGLDAXUGNWTRB-UHFFFAOYSA-N	434.452	1.950	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cccc(Br)c2)cc1	764062746	CNBKMXBQTZZNSD-UHFFFAOYSA-N	440.275	1.252	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc([C@H](C)N3CCOCC3)c2)c(O)c1	764110000	NOWFZLVYAQCKNT-HNNXBMFYSA-N	426.473	1.494	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ncn(Cc3ccccc3)n2)o1	764138726	ISCXVNJFEXZAAS-UHFFFAOYSA-N	439.476	1.161	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)CCc2ccco2)ccc1Br	764168638	GEWYUINOJOLTBO-UHFFFAOYSA-N	438.234	1.547	50	20	IDGD	
CC1CCN(C(=O)c2ccccc2NC(=O)C(=O)NNC(=O)c2cccc(C#N)c2)CC1	764233325	XCWIBKKGRIFXCM-UHFFFAOYSA-N	433.468	1.830	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(CN(C)C(=O)C(F)(F)F)c2)o1	764371008	MARMVFBGSPENKQ-UHFFFAOYSA-N	426.351	1.508	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1cc(C(C)(C)C)nn1-c1ccc(C)cc1	764398569	UHCAWFRLITVJDR-HNNXBMFYSA-N	445.520	1.616	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2c(C)cccc2C)c1	764461212	BTGLEMLSGNSTOO-UHFFFAOYSA-N	446.529	1.734	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CC[C@H](N2CCN(C)CC2)[C@@H](C)C1	764470019	RYYWVQNWXRUGQU-YJBOKZPZSA-N	437.972	1.067	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NC[C@@H](NC(=O)OC(C)(C)C)C2CC2)c2ccccc2c1=O	764557908	LEJZUQVSVUGTMT-OAHLLOKOSA-N	444.492	1.181	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)c1ccc(CN2CCC(CO)CC2)cc1	764950634	KWNVNUHAWJIULC-UHFFFAOYSA-N	430.530	1.143	50	20	IDGD	
CC(C)(C)OC(=O)NNC(=O)C(=O)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1	765398648	LCHKBZGMHYHQRI-UHFFFAOYSA-N	426.495	1.356	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(C(=O)CCC(=O)N3CC=C(C#N)CC3)CC2)cc1	767159462	DOVYLGRFWKQXJX-UHFFFAOYSA-N	430.530	1.290	50	20	IDGD	
COc1cc2c(cc1NC(=O)NNC(=O)c1nn(C)c(=O)c3ccccc13)NC(=O)CC2	767958035	NYPLFKWKXBHBHE-UHFFFAOYSA-N	436.428	1.293	50	20	IDGD	
CC(C)c1cc(NC(=O)C(=O)NNC(=O)COCc2ccccc2)n(-c2ncccn2)n1	768244328	ZTWBIBJHJBFSIR-UHFFFAOYSA-N	437.460	1.088	50	20	IDGD	
CSCCNC(=S)NNC(=O)c1ccc(S(=O)(=O)N2CCC(C)CC2)s1	769770845	ZIXAXGMTZSWIFK-UHFFFAOYSA-N	436.650	1.641	50	20	IDGD	
CCC(CC)n1ccc(C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)n1	771015379	JKAMZDKCKCOPFJ-UHFFFAOYSA-N	435.554	1.332	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2c(C)nc3ccccn23)ncc1Br	773521488	UTWPOHZVGJBEKE-UHFFFAOYSA-N	431.250	1.508	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)nc1)C(=O)Nc1ccc(I)cn1	773539762	DKGPGIZTVSNEAD-UHFFFAOYSA-N	445.604	1.134	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2ccc(F)cc2I)n1	773731796	VNVKJLYLJAHZPL-UHFFFAOYSA-N	431.165	1.311	50	20	IDGD	
CCc1ccc(C(=O)NNS(=O)(=O)c2cc(C(=O)NCC(F)(F)F)n(C)c2)cc1	775669577	LZGJULRSXGQQSA-UHFFFAOYSA-N	432.424	1.503	50	20	IDGD	
CN(NC(=O)c1ccc(OC(F)F)cn1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776212274	IRLFCRRMHTUHGD-UHFFFAOYSA-N	429.424	1.932	50	20	IDGD	
COc1cc(C(=O)CCC(=O)NNC(=O)Cn2cnc3ccccc32)cc(OC)c1OC	776966822	WGEMFRZDOBOKLG-UHFFFAOYSA-N	440.456	1.873	50	20	IDGD	
COc1cc(C=NNC(=O)c2ccc(-n3cnnn3)cc2)c([N+](=O)[O-])cc1OCC(F)F	778540081	KFJLTAUFGGVURR-UHFFFAOYSA-N	447.358	1.987	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccnc(OC(C)C)c2)cc1	778707562	NEVQVNSEZWOQDG-CQSZACIVSA-N	430.461	1.821	50	20	IDGD	
Cc1cc(F)c2nc(O)cc(C(=O)N3CCN(S(=O)(=O)CBr)CC3)c2c1	778977139	YUZNAPKTPXLKIV-UHFFFAOYSA-N	446.298	1.828	50	20	IDGD	
O=C(NNc1cnccn1)c1cc(I)ccc1N1CCOCC1	779100070	DRURDZWFVMMSMC-UHFFFAOYSA-N	425.230	1.675	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)N2CCC[C@@H]2C(=O)NNc2ccc(OC)cn2)o1	781537461	PLLVHZMACCHKIU-CYBMUJFWSA-N	438.462	1.156	50	20	IDGD	
O=C(COC(=O)C1(Cc2ccc(F)cc2)CC1)NNC(=O)[C@@H]1COc2ccccc2O1	782472800	IXGXVLNAYMYXDN-SFHVURJKSA-N	428.416	1.679	50	20	IDGD	
CCc1ccc(NC(=O)C(=O)NNc2ccccc2Br)cc1S(N)(=O)=O	782988000	BKPUMKNWDKAGEL-UHFFFAOYSA-N	441.307	1.741	50	20	IDGD	
O=C(NNC(=O)C(=O)N1CCCC1)C(=O)Nc1ccc(Oc2ccccc2Cl)cc1	784000247	SFASWFXKBKSADI-UHFFFAOYSA-N	430.848	1.841	50	20	IDGD	
CC(C)C(C)(C)C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	784018642	XCNSCLMALJGRSK-UHFFFAOYSA-N	425.551	1.470	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)C(=O)Nc1cc(F)c(F)cc1F	784213084	KEUOESRRPUIWKE-UHFFFAOYSA-N	428.392	1.626	50	20	IDGD	
CCNS(=O)(=O)c1ccc2c(c1)N(C(=O)C(=O)NNc1cc(F)c(F)c(F)c1)CC2	785086661	DMXBEYNHAOUYFB-UHFFFAOYSA-N	442.419	1.435	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2cc(N3CCCC3=O)ccc2F)n1	785226068	NVHHWXOCRRJJOL-UHFFFAOYSA-N	429.456	1.671	50	20	IDGD	
CCn1ncc2ccc(NC(=O)C(=O)NNc3c(OC)cccc3S(C)(=O)=O)cc21	785330550	KAAMGBGDAONURX-UHFFFAOYSA-N	431.474	1.550	50	20	IDGD	
N#Cc1ccc(S(=O)(=O)NNC(=O)c2nnc(-c3ccccc3)o2)cc1Br	788480035	LRSLLZFJNBUKSE-UHFFFAOYSA-N	448.258	1.994	50	20	IDGD	
CN(C)[C@@H]1CCOc2c(NC(=O)C(=O)NNc3ccc(S(C)(=O)=O)cc3)cccc21	789746216	JFRDUSGPNPGZKG-QGZVFWFLSA-N	432.502	1.557	50	20	IDGD	
Cc1ccn(C[C@@](C)(O)C(=O)NNC(=O)[C@@H](C)Oc2c(C)cc(Cl)cc2C)c(=O)c1	790483080	IBMNRBDZMKYPPO-QVKFZJNVSA-N	435.908	1.793	50	20	IDGD	
Cc1noc(C)c1S(=O)(=O)N1CCC(C(=O)NNc2cccc(F)c2[N+](=O)[O-])CC1	790585052	KBFMSIJRQOYFIT-UHFFFAOYSA-N	441.441	1.883	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2nc3ccccn3n2)cc1OCc1ccncc1	792393797	GRTWJDYKACLQBY-UHFFFAOYSA-N	433.428	1.794	50	20	IDGD	
CNS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2cc(-c3ccc(C)cc3)[nH]n2)nc1	792400596	PLMKWNRQJXQYDQ-UHFFFAOYSA-N	429.462	1.155	50	20	IDGD	
O=C(COCc1ccccc1)NNS(=O)(=O)c1ccc(C(=O)O)cc1OC(F)(F)F	792696653	GHDICVNBWRRZHR-UHFFFAOYSA-N	448.375	1.810	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCC1(S(C)(=O)=O)CC1	792779836	KQJZCGWJWONZRG-JTQLQIEISA-N	434.312	1.124	50	20	IDGD	
COc1cccc(C(=O)CCCC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1	794291879	ALPVARXFYFUMKW-UHFFFAOYSA-N	425.489	1.902	50	20	IDGD	
CC(=NNC(=O)CNC(=O)c1cccs1)c1cc(S(N)(=O)=O)c(Cl)cc1Cl	794501178	CZEPQVVJVHPDLX-UHFFFAOYSA-N	449.341	1.973	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H](C)Oc2ccc(C=O)cc2)c1	794740837	ISJIZUZBKGFMEY-HNNXBMFYSA-N	447.513	1.758	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN([C@@H]2CCN(CC(=O)NNC(=O)c3ccc(F)cc3)C2)CC1	796614326	NPIXFGAARWLHGS-GOSISDBHSA-N	449.527	1.214	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccccc2C(=O)N2C[C@@H](C)C[C@@H](C)C2)n1	797369596	AKXWYXONVRGBMH-GASCZTMLSA-N	437.500	1.908	50	20	IDGD	
COC(=O)c1cc(Cl)c(Cl)cc1NC(=O)C(=O)NNC(=O)Cn1nc(C)cc1C	797535645	PHYFMVOICWIRNC-UHFFFAOYSA-N	442.259	1.379	50	20	IDGD	
CCCCNS(=O)(=O)c1ccc(C)c(NC(=O)C(=O)NNC(=O)CC(C)(C)C)c1	799834802	IWIBBMYEFKEHIN-UHFFFAOYSA-N	426.539	1.596	50	20	IDGD	
CNC(=O)CNC(=O)c1cccc(NC(=O)/C(C#N)=C\c2cc(C)n(CCOC)c2C)c1	800370243	DOKDRAYKOCPNJY-ODLFYWEKSA-N	437.500	1.773	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2[C@@H](C)OC(C)(C)N2C(=O)OC(C)(C)C)cc1	801106330	UUDDHLGINCHDBS-HIFRSBDPSA-N	434.493	1.841	50	20	IDGD	
CS(=O)(=O)c1cc(Br)cc(C(=O)NNC(=O)N=c2cc[nH]cc2)c1F	802033351	VGHHFBCFZKMRDU-UHFFFAOYSA-N	431.243	1.275	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)[C@](C)(O)CSc2cccc(F)c2)n1	803802102	MXMOKWSYCLRRGX-GOSISDBHSA-N	441.506	1.367	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)C1CCN(CC(F)F)CC1	806974172	XRMQXVVBKGFAEN-UHFFFAOYSA-N	432.493	1.128	50	20	IDGD	
O=C(NNC(=O)c1cccc(Cl)c1)C(=O)Nc1cc(F)c(N2CCOCC2)cc1F	806974175	XSDGLIYETHIIGQ-UHFFFAOYSA-N	438.818	1.855	50	20	IDGD	
COc1ccc2cc(NC(=O)C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)ccc2c1	806978413	AGHGPMZDOMHDHJ-UHFFFAOYSA-N	448.483	1.641	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)NCCn3cc(Br)cn3)n[nH]2)cc1	807530747	BBLOORITHIHSJH-UHFFFAOYSA-N	432.282	1.988	50	20	IDGD	
C=C(CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1ccccc1	807578706	GPTSTUBNGQPXRG-UHFFFAOYSA-N	444.513	1.365	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)[C@H]2CCc3nnn(C)c3C2)cc(OCC)c1OCC	809949531	QMLAOWKNTYEGAK-ZDUSSCGKSA-N	431.493	1.577	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2cnc(C(F)(F)F)cc2C)c1	810385850	CATUBZMMZDFLTP-UHFFFAOYSA-N	426.351	1.826	50	20	IDGD	
O=C(COC(=O)[C@H](O)c1ccc(Cl)cc1F)NNC(=O)c1ccc([N+](=O)[O-])cc1	811369419	FKNSGKJPVYDIRJ-OAHLLOKOSA-N	425.756	1.425	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H]2CCN(c3ccccc3F)C2)c1	813853858	LIEHZJKQGUEHMU-HNNXBMFYSA-N	449.508	1.299	50	20	IDGD	
CN1CC(=O)N(c2cccc(NC(=O)NNc3ccccc3S(=O)(=O)N(C)C)c2)C1=O	814606345	CPMRHXQXVSGQTL-UHFFFAOYSA-N	446.489	1.484	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCc2nncn2C1)C(=O)Nc1ccccc1SCC(F)(F)F	815691015	CJRACHHKRMVTHC-JTQLQIEISA-N	442.423	1.281	50	20	IDGD	
CC(C)C[C@H](C)n1nccc1NC(=O)C(=O)NNc1ccccc1S(=O)(=O)N(C)C	815751852	RDHVYRWUPIABTJ-AWEZNQCLSA-N	436.538	1.822	50	20	IDGD	
Cc1cc(OCc2ccc(C(=O)NNC(=O)C3(S(N)(=O)=O)CC3)cc2)ccc1Cl	816814734	AYIOHVHVWUAKNN-UHFFFAOYSA-N	437.905	1.810	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCc2nncn2C1)c1cccc(NC(=O)c2ccc3nc[nH]c3c2)c1	816883651	HLHXSLHGXOQRNM-OAHLLOKOSA-N	444.455	1.430	50	20	IDGD	
Cc1cccc(-c2nnc(S)n2CC(=O)NNc2ccccc2S(=O)(=O)N(C)C)c1	817055173	PLLOAVSCANIAHD-UHFFFAOYSA-N	446.558	1.936	50	20	IDGD	
N#Cc1cc(F)ccc1NC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	818378698	VQSKBAVGNYETEQ-UHFFFAOYSA-N	431.449	1.948	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NNC(=O)CCOc2ccc(C(N)=O)cc2)C1	819657279	BCRPDJHNYRGCQQ-OAHLLOKOSA-N	434.493	1.349	50	20	IDGD	
COC(=O)Cc1cc(=O)n(-c2ccc(C(=O)NNC(=O)Cc3c[nH]c4ccccc34)cc2)[nH]1	915188791	SCGXHTZUKOBEIK-UHFFFAOYSA-N	447.451	1.366	50	20	IDGD	
O=C(NN=C1CCN(c2ccccn2)CC1)C(=O)NN=C1CCN(c2ccccn2)CC1	915936505	OXKPJOKIGBCKDH-UHFFFAOYSA-N	434.504	1.322	50	20	IDGD	
CC(C)c1ncncc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	916096507	TZSWHVKFHHSZBL-UHFFFAOYSA-N	431.518	1.849	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NC2CCN(C3CC3)CC2)c1	916240214	YBSBDCBTDXKSCO-UHFFFAOYSA-N	437.566	1.288	50	20	IDGD	
Cn1c(=NNC(=O)NCc2ccc(C(=O)N3CCNC(=O)C3)cc2)sc2ccccc21	916392490	ZIFCWXOURNALRR-UHFFFAOYSA-N	438.513	1.127	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)Cn2nc(-c3ccccc3)ccc2=O)cc1	916743013	BMNBRVKWKFMKNQ-MRXNPFEDSA-N	436.468	1.924	50	20	IDGD	
CSCC[C@@H](NC(=O)c1ccccc1)C(=O)NNC(=O)C(=O)Nc1ccc(C)cc1	916830687	PCVXFCGEVGLTBV-QGZVFWFLSA-N	428.514	1.633	50	20	IDGD	
CN(CC(=O)NNC(=O)Cc1c[nH]c2ccccc12)C(=O)c1ccc(Br)o1	917393209	BMBXHHIFHHHYLC-UHFFFAOYSA-N	433.262	1.986	50	20	IDGD	
COc1cc(C=NNC(=O)Cc2csc(N3CCOCC3)n2)c([N+](=O)[O-])cc1OC	917566370	KEXLXVNXXOYOFZ-UHFFFAOYSA-N	435.462	1.598	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(NC(=O)C(F)(F)F)cc1)c1cccc([N+](=O)[O-])c1	917716534	ISNTWUNUKGGFFX-UHFFFAOYSA-N	432.336	1.719	50	20	IDGD	
O=C(Cc1cccc(F)c1)NCC(=O)NNC(=O)c1ccc(F)cc1Br	918341782	CJJHFQBEOVJMQX-UHFFFAOYSA-N	426.217	1.847	50	20	IDGD	
Cc1ccc(N2CCC(C(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)CC2)nc1	919806075	KSXMKZSQOLFEOY-UHFFFAOYSA-N	445.545	1.318	50	20	IDGD	
Cc1noc2nc(-c3ccc(F)cc3)cc(C(=O)NNC(=O)N[C@@H]3CCS(=O)(=O)C3)c12	919889557	ODWVNIRELYAOPW-CYBMUJFWSA-N	447.448	1.468	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)NCc1cccc(CN2CCO[C@H](C)C2)c1	920236641	DXLHHEMNGAAHDI-QGZVFWFLSA-N	426.517	1.989	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCC(=NNC(=O)[C@H]3COc4ccccc4O3)CC2)cc1	920359854	ICHZYYGCRPWAQH-HXUWFJFHSA-N	445.497	1.792	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1nc(O)n3c1CCCC3)C2)[C@H](F)Cl	1778030907	NVJPPOGASJIGDG-FRIZHTMISA-N	428.892	1.587	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)NC(=O)NCC)C1	1779315906	XBYCAQWZTXRLHV-AXHMDWHKSA-N	430.977	1.615	50	20	IDGD	
O=C(c1cnc2snnc2c1)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1780071550	KHOIKUQILQIOJN-ABAIWWIYSA-N	444.286	1.220	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(CN(C(=O)c3ncc[nH]3)CCO2)C1	1780095057	DGNANZAKIPIFAN-HXUWFJFHSA-N	443.416	1.001	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)Cn3ccc4sccc4c3=O)CCO2)C1	1781215111	HZEQWRPGRIGEAS-YWZLYKJASA-N	437.949	1.910	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)c3n[nH]c4c3CCCC4)CCO2)C1	1781228202	ZOKBPBPUNZDFPH-MOPGFXCFSA-N	429.348	1.968	50	20	IDGD	
C[C@H](Oc1ccccn1)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@](C)(Cl)CCl)C2)C1	1781234612	XCXDNKADCGXZMD-KYNGSXCRSA-N	430.332	1.915	50	20	IDGD	
Cc1nc2sccn2c1C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781331541	MUCGIJPCPBLUMY-MLGOLLRUSA-N	445.314	1.838	50	20	IDGD	
COc1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)ccc1F	1781335096	TXIMCUYGWZYILH-RHSMWYFYSA-N	433.249	1.968	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnc(O)[nH]1)C2	1781901198	IFHVFJDDFOWMMJ-XTQGRXLLSA-N	429.315	1.416	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)Nc1cnccn1)C2	1782176026	URUPTVSLWHMHGO-ZFCANOHDSA-N	439.944	1.045	50	20	IDGD	
COc1ccc(/C=C/C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)c(F)c1	1783655944	PSNOOHGMOQLGHI-FULGTSKZSA-N	426.872	1.277	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)Cc3ccc(Cl)cc3OC)CCO2)C1	1783880173	CRTFHIBJCOPDTM-OXJNMPFZSA-N	445.343	1.975	50	20	IDGD	
CN(CCCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2)C(=O)OC(C)(C)C	1785582561	SGMJBPXCPUWKNO-QRWLVFNGSA-N	447.960	1.063	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)Nc3cnccn3)[C@H]2C1	1788630314	LRCHGRBTHWUALS-YTFOTSKYSA-N	440.342	1.040	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)c1ccnc2c1OCO2	1789181017	QBNSQAYWWYAHJY-QVSJOPQTSA-N	444.257	1.094	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(C(=O)N(C)C)c3)C[C@@H]21	1789864131	KMNVKIHZKLTGMM-VJANTYMQSA-N	435.952	1.999	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)c3ccccc3)C[C@@H]21	1789866902	ZPHPCOCXPAYXNY-LLYLOPHFSA-N	429.344	1.936	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3c(F)cncc3F)C[C@@H]21	1791058840	IPWAZMBHYWERTO-RMIALFOJSA-N	432.265	1.737	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)c3ccccc3Cl)[C@H]2C1	1791473473	YUVHJGRJJAYUQB-FSXCVOIBSA-N	445.343	1.607	50	20	IDGD	
CC(C)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CC(=O)N(C2CCCC2)C1	1793775423	HHDPBNXBZPKZRD-OAFZBRQQSA-N	439.984	1.632	50	20	IDGD	
COc1cccc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)Br)C3)n1	1794015676	FQGRCADOTAEFDK-ZUMXRPEOSA-N	440.338	1.396	50	20	IDGD	
Cc1nc2ccncc2cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCBr	1795115749	KUJZCTFDDYAJHE-CCWDJLKJSA-N	447.333	1.926	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CCCO1	1795900825	BYBHFXHDIOCOQY-UHVSXOQYSA-N	431.439	1.640	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1c[nH]c2nccc-2c1	1796200305	UTMFHQXVLHOMMN-FZKCQIBNSA-N	435.322	1.891	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCCn1c(O)nc3ccccc31)C2)[C@@H](F)Cl	1796367872	YQLXPPPQTJRJLP-JGTCGTHISA-N	438.887	1.646	50	20	IDGD	
COc1ccc2[nH]cc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)c3ccc(B(O)O)cc3)C4)c2c1	1798061309	LGLHSBTTZJRVFL-BCDXTJNWSA-N	447.300	1.422	50	20	IDGD	
COc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)CBr)C3)cc1	1798940571	OGMOWJVPSHLJEV-FAYQHZLMSA-N	425.323	1.929	50	20	IDGD	
CC(C)NC(=O)OC(C)(C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2	1799127980	VRTUWOPOPNDWBK-AGGWBTHJSA-N	448.358	1.274	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnn3cccnc13)C2	1799275699	AOSJHHMPUSNIDA-AZGFTEDZSA-N	426.304	1.169	50	20	IDGD	
COc1cc(OC)cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Br)c1	1799348554	KFRGOBHSKJNUGV-NOXHYTERSA-N	445.285	1.598	50	20	IDGD	
C[C@H](NC(=O)c1cnccn1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@](C)(Cl)CCl	1800080905	SVJYPZYTTCYWBN-ROOHJGOOSA-N	442.347	1.469	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1C[C@@]13C(=O)Nc1ccccc13)C2)C(Cl)Cl	1801018151	OXFBDPUCDGRURK-AYFJUFKTSA-N	438.311	1.290	50	20	IDGD	
COCCOCCOCCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](C)Br	1801967139	ZACCFTUSUYLSHY-LVQVYYBASA-N	435.359	1.478	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1scnc1C(F)(F)F)C2	1802332937	GULHKZXMDDOFNG-ZSBIGDGJSA-N	447.483	1.787	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@H](CNC(=O)c2cc(O)ncn2)[C@H]1c1cccnc1	1803744515	PJPSULHCAWAZMN-HNAYVOBHSA-N	429.553	1.748	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)COC(C)(C)C)[C@H]1c1cccnc1	1804085323	SRQKPHHSCLTFMV-DYESRHJHSA-N	433.553	1.276	50	20	IDGD	
COC(=O)CCC(=O)N1CC[C@H](CNC(=O)CCBr)[C@H]1c1cccnc1	1806339493	MWGSTDSGAGKKSG-RDTXWAMCSA-N	426.311	1.826	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC2(CCCN(C(=O)c3ccc(F)s3)C2)CC1	1807282139	WVMPBSYHIPJVSG-UHFFFAOYSA-N	430.310	1.726	50	20	IDGD	
Cc1cc[nH]c1C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1807361675	HBPLVSFEGIYYEQ-WIYYLYMNSA-N	432.289	1.031	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)Cc2ccsc2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1	1807370370	CBOGJXCINCGFCB-KNQAVFIVSA-N	449.341	1.385	50	20	IDGD	
C[C@]1(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](F)Br)[C@H]2c2cccnc2)CCCN1	1808088622	OMMWQHMFOCVETB-OIPACUDHSA-N	427.318	1.920	50	20	IDGD	
Cc1cnc2c(C(=O)NC[C@@H]3CCN(C(=O)[C@@H](O)CCl)[C@@H]3c3cccnc3)cnn2c1	1809830178	AZFUWZPCARVPNI-RYQLBKOJSA-N	442.907	1.352	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)CSC(=N)N)[C@@H]1c1cccnc1	1812775558	ACZXHPBDZNVACL-KCQAQPDRSA-N	442.383	1.888	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)c2cc(CO)on2)[C@@H]1c1cccnc1	1812866395	FHUMUGUISPZOAG-NORZTCDRSA-N	437.294	1.665	50	20	IDGD	
Cc1nc(C(=O)N2CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)cs1	1813070439	JATYFPWSWSISHS-JXFKEZNVSA-N	444.561	1.539	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)CNC(=O)C(F)(F)F)[C@H]1c1cccnc1)C(Cl)Cl	1813081978	IIPWVEOXIXPABD-PWSUYJOCSA-N	441.237	1.570	50	20	IDGD	
O=C(CCn1cncn1)NC[C@@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1	1813318993	ZKRZPDODQOVAPP-YJBOKZPZSA-N	435.326	1.554	50	20	IDGD	
COCCOCCOCCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](O)CCl)n[nH]1	1814877729	JMEYOYJFHLQGPV-HZPDHXFCSA-N	446.932	1.071	50	20	IDGD	
CN1N=C(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)[C@@H](F)Br)[nH]n2)CCC1=O	1815622620	NKIVDMRIYMLMMH-SMDDNHRTSA-N	443.277	1.701	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)Cc2cccnc2)[nH]n1)c1ccc(B(O)O)cc1	1817470932	AHATWVJGJIXPRZ-IBGZPJMESA-N	433.277	1.033	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2C[C@@]2(F)Cl)[nH]n1)c1cccc(B(O)O)c1	1817479344	LCLVIDHWAWFTQV-RFUYNDQBSA-N	434.664	1.320	50	20	IDGD	
Cc1cc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)[C@@H](O)CCl)[nH]n2)ncc1[N+](=O)[O-]	1818262469	UDCGJUJZWXIXBM-ZFWWWQNUSA-N	436.856	1.927	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1CCc2nc(NC(=O)CCN3CCOC3=O)sc2C1	1818693721	VEVKVPCQQPWLHY-GFCCVEGCSA-N	440.598	1.749	50	20	IDGD	
CC(=O)C(C)(C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819401918	XGLLPZVHIVMHRP-INIZCTEOSA-N	441.492	1.329	50	20	IDGD	
C=CC[C@@H](C(=C)C)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(B(O)O)cc1)CC2	1819598127	UJSUZKWPHGHIFQ-IRXDYDNUSA-N	439.346	1.817	50	20	IDGD	
C[Si](C)(C)OCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H]1CCCS1(=O)=O)CC2	1820169669	REYLJYZJBBWCEN-FZMZJTMJSA-N	445.639	1.484	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1)[C@@H]1CC[C@H]2CCC(=O)N2C1	1820758033	VXRSSSAMTXKJEY-BFJAYTPKSA-N	437.928	1.403	50	20	IDGD	
O=C([C@@H]1Cc2ccccc2CN1)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)CC1	1824182991	NCVTXUUXGDUJRP-ACRUOGEOSA-N	433.980	1.920	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCn1cncn1)CC2	1825453287	VEKPVWDALIFAOQ-QWRGUYRKSA-N	441.355	1.910	50	20	IDGD	
C[C@H](Cc1ccco1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCC(=O)NN(C)C)CC2	1826966597	USCIGFIRLVZWAU-ZIAGYGMSSA-N	447.561	1.900	50	20	IDGD	
N#Cc1ccccc1OCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)CCl)CC2	1828025773	STQRKWROECHSLI-OCCSQVGLSA-N	434.905	1.605	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)NC(=O)OC(C)(C)C)CCO2	1830303716	KTLXNOSLLYSMKC-AVYPCKFXSA-N	447.960	1.373	50	20	IDGD	
CC(C)N1CCC(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)CC1	1830358406	MURHEHFAOTZNGX-QFIPXVFZSA-N	444.016	1.828	50	20	IDGD	
O=C(CCc1c[nH]c2ccccc12)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1830722568	DGRGBAPGRBDIPQ-SIKLNZKXSA-N	449.935	1.157	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H](N)CCC(N)=O)CC1	1831549040	MGAQVRFNKUBDKX-OWCLPIDISA-N	445.402	1.372	50	20	IDGD	
C=CCSCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](Br)CC)C2)C1	1832461529	YKPDYNKHHMPHOM-YOEHRIQHSA-N	435.384	1.536	50	20	IDGD	
CC(C)n1ccc(C(=O)N2CCC(N3CCC(NC(=O)[C@@H](O)CCl)CC3)CC2)n1	1833312221	JXLDTPPZJAVNJZ-SFHVURJKSA-N	425.961	1.249	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)CCN(C)C(C)=O)CC2)CC1	1833529489	BRLRNPHPSDFUDM-LJQANCHMSA-N	429.005	1.834	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cc(O)n(C)n3)CC2)CC1	1833942932	WWGQORPGASDGRG-MRXNPFEDSA-N	425.961	1.718	50	20	IDGD	
Cc1ncsc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1	1834267867	KKVKRXJZZNUYOB-IRXDYDNUSA-N	436.361	1.758	50	20	IDGD	
Cc1ccc(O)c(C(=O)N2CCOC[C@@]3(CN(C(=O)CCBr)CCO3)C2)c1	1834823776	KCRZMKJPQTXRJZ-LJQANCHMSA-N	441.322	1.556	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3[nH]nc4ncccc34)CC2)CC1	1835022584	QWMVUMDULBDOEM-KRWDZBQOSA-N	448.955	1.397	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](C)N(C)C(C)=O)CC2)CC1	1835120393	BIXMDQUJGJLBMC-DNVCBOLYSA-N	429.005	1.832	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](C)n3ccccc3=O)CC2)CC1	1835824676	AKBXECRZQSVQRI-VQIMIIECSA-N	436.984	1.998	50	20	IDGD	
C[C@H](C(=O)NC1CCN(C2CCN(C(=O)[C@H](F)Cl)CC2)CC1)n1ccccc1=O	1835826535	VIXAPUHRXYESEP-KDOFPFPSSA-N	426.920	1.515	50	20	IDGD	
CC1=C(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)CBr)C3)C2)CCO1	1836268277	OKAXVIUUBZVFOE-FZKQIMNGSA-N	431.327	1.168	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)CCN3CCCC3)CC2)CC1)[C@@H](F)Br	1836414694	YLTGANLUEOQLNZ-GOSISDBHSA-N	447.393	1.734	50	20	IDGD	
O=C(c1ccc2c[nH]nc2c1)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836718067	RHHKVMPJKVJCAG-IBGZPJMESA-N	434.924	1.775	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc4ncncc4c3)CCO2)C1	1837026025	PBCKJUDFPMFPOV-UWJYYQICSA-N	432.908	1.717	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(Cl)ncn3)C2)C1	1837715323	KAIDPQBYQHNQGI-GOSISDBHSA-N	442.976	1.052	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cnc(O)nc3O)CC2)CC1	1838077008	UECRNFIYKKSCLE-OAHLLOKOSA-N	426.901	1.517	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](C)S)CC2)CC1	1838103193	NOXMNIORFWQWJQ-QKIXXSFTSA-N	449.577	1.437	50	20	IDGD	
CCOC(=O)N[C@H](O)C(=O)N1CCC(OC2CCN(C(=O)[C@H](Cl)CC)CC2)CC1	1838356954	JGHIQVMSOINNNT-HZPDHXFCSA-N	433.933	1.067	50	20	IDGD	
O=C(CSc1nc[nH]n1)N1CCC(OC2CCN(C(=O)C(Cl)Cl)CC2)CC1	1838790840	AYLKYGFEYISLAJ-UHFFFAOYSA-N	436.365	1.699	50	20	IDGD	
CCc1ncsc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)Br)C2)C1	1838839119	PUXUKWKQHLPXNP-YVEFUNNKSA-N	446.367	1.559	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(OC)c(OC)c3)CCO2)C1	1838932168	SLUOVCSDJXQQTF-IERDGZPVSA-N	440.924	1.791	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3csc(N)n3)C2)C1	1839152201	RAYUNWVRLHPPST-HOTGVXAUSA-N	437.349	1.032	50	20	IDGD	
CCc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)cn1	1839197815	JDDUEDAAVLVWIG-YJBOKZPZSA-N	444.301	1.405	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)C3=C(C)OCC3)C2)C1	1839964172	JAFOJDCEYYFZIY-YJBOKZPZSA-N	431.327	1.311	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(Cl)c(F)c3)C2)C1	1840155070	OUVLXCYKIIDPPE-KXBFYZLASA-N	449.306	1.803	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(F)c(OC)c3)C2)C1	1840155772	DFRCOQLIPIQETP-QRWLVFNGSA-N	444.887	1.158	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)C2CCN(c3cc(OC)ncn3)CC2)C1	1841460341	JYQGLULSDXGGJD-MRXNPFEDSA-N	435.956	1.922	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2cccc3c2cnn3C)C1	1843799352	RCGCHEFGMKZPDC-CVKSISIWSA-N	447.499	1.524	50	20	IDGD	
C[C@H](NC(=O)c1ccccc1)C(=O)N1CC2(CCCN2C(=O)[C@@H](F)Br)C1	1845220693	IQJKYYLOIVVZHV-GXTWGEPZSA-N	426.286	1.699	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC2(CCCN2C(=O)[C@@H](O)NC(=O)OC(C)(C)C)C1	1845436456	JQCOQVOGGVMTQH-NWDGAFQWSA-N	434.331	1.064	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)C(C)(C)CNC(=O)OC(C)(C)C)C1	1847158455	XBIWCYWGNKUVSH-CQSZACIVSA-N	431.961	1.995	50	20	IDGD	
O=C([C@H](O)CCl)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)c1cccc(Br)c1	1847564846	DPGGTSJIBKLBEM-XQLPTFJDSA-N	431.714	1.284	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](CCO)NC(=O)OC(C)(C)C	1847639138	NQQHTDMVJOPNRV-FZKCQIBNSA-N	431.961	1.871	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)COc2cccc(C(F)(F)F)c2)c1	15877804	AEEFNLHIAXWFHP-UHFFFAOYSA-N	445.419	1.796	50	20	IDGD	
CNS(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=S)NCCc2cccs2)c1	21125145	TWQPRMFJWYJEKO-UHFFFAOYSA-N	432.980	1.661	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)CSc2ccc(C(F)(F)F)cn2)c2ccccc2c1=O	115134409	WNXXDUPOMNZWQD-UHFFFAOYSA-N	437.403	1.901	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)NCc1ccc(Oc2cccnc2)c(F)c1	726242018	IEVHQXIWQSTIRQ-UHFFFAOYSA-N	427.392	1.866	50	20	IDGD	
O=C(COc1cccnc1)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	726868943	KXPRFWPWSRROPP-UHFFFAOYSA-N	429.440	1.623	50	20	IDGD	
C[C@@]1(NNC(=O)NCc2cccc(NC(=O)NCc3ccncc3)c2)CCS(=O)(=O)C1	727031820	YVAGLLILTYODAP-HXUWFJFHSA-N	446.533	1.284	50	20	IDGD	
Cc1ccc(C(=O)NNc2nc(-c3ccccc3)no2)cc1S(=O)(=O)N1CCOCC1	728081377	VBLWUAZENFASAN-UHFFFAOYSA-N	443.485	1.823	50	20	IDGD	
CN(C)N(C(=O)c1ccc(S(=O)(=O)Nc2ccccc2)cc1)[C@@H]1CCS(=O)(=O)C1	728175865	HRDULLWSSRFJBP-QGZVFWFLSA-N	437.543	1.593	50	20	IDGD	
COc1cc(/C=C/C(=O)N([C@H]2CCS(=O)(=O)C2)N(C)C)cc(Br)c1O	728178990	GRYNCZUYKKRMOI-ITKZLYELSA-N	433.324	1.669	50	20	IDGD	
Cc1nn(C)c(C)c1[C@H](C)C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	728214008	IJEMKGBCSWAYOD-AWEZNQCLSA-N	434.566	1.220	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@H](C)c2ccc3c(c2)CC(=O)N3C)c2ccccc2c1=O	728398612	CPHVLQMIJNWJGU-CYBMUJFWSA-N	448.483	1.641	50	20	IDGD	
CN1CCN(c2ncccc2CNC(=O)NNC(=O)c2cccc(OC(F)F)c2)CC1	728596243	BZNRVPAXMFBTPF-UHFFFAOYSA-N	434.447	1.579	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2cc(C)cc(S(C)(=O)=O)c2C)cc1OC	730202986	DJCLCRHFKOSOHM-UHFFFAOYSA-N	442.515	1.347	50	20	IDGD	
CCOc1cc2c(cc1[C@@H]1C[C@H]1C(=O)NNC(=O)c1ccc(-n3cnnn3)cc1)O[C@@H](C)C2	730515567	PUJOCTHEDMZQIO-SOVGHPHASA-N	448.483	1.949	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)N[C@H](C)C(=O)N2CCS(=O)(=O)CC2)c(C)n1CCC(C)C	731477582	XVBHJGOWWVBZQB-UOBPLZBXSA-N	448.589	1.820	50	20	IDGD	
CC(C)(C)OC(=O)NCc1nc(C(=O)NNC(=O)[C@H]2COc3ccccc3O2)cs1	732727810	ULYBWDIHADIUOE-CQSZACIVSA-N	434.474	1.769	50	20	IDGD	
CCOc1ncc(C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)cc1Cl	732751595	RCIWZOOOGIVGIP-UHFFFAOYSA-N	425.898	1.810	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)[C@@H]2CCCN2S(=O)(=O)c2cccc([N+](=O)[O-])c2)c1	732936379	LPRVHTRDPTYUKO-KRWDZBQOSA-N	443.441	1.081	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)NNC(=O)NC[C@]1(N2CCOCC2)CCSC1	732996346	GYSHCNNYZCQOEJ-GOSISDBHSA-N	427.958	1.561	50	20	IDGD	
CN(C)CC(=O)NNC(=O)Cc1ccc(NC(=O)c2cccc(Br)c2)cc1	733359187	FZCRMRQCZQMDLE-UHFFFAOYSA-N	433.306	1.953	50	20	IDGD	
O=C(CCc1nc(-c2nc[nH]n2)no1)NNc1cc(C(F)(F)F)nc(-c2ccccn2)n1	734259647	ABKVKFBDVYXTAS-UHFFFAOYSA-N	446.353	1.801	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNS(=O)(=O)c1ccc2c(c1)C(=O)NCC2	734807244	WNYHUAANYCUZDE-CQSZACIVSA-N	439.493	1.903	50	20	IDGD	
Cc1nn(CC(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)c(C)c1Cl	734820991	CTPMHJGGGNCQFI-UHFFFAOYSA-N	428.921	1.883	50	20	IDGD	
COc1ccc(-c2nn(CCC#N)cc2/C=C(/C#N)C(=O)NCC[S@](C)=O)cc1OC	735044728	BUJCNRXBYMLELT-IWWZGYLZSA-N	441.513	1.883	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)Cc2ccc(S(=O)(=O)C(F)F)cc2)cc1	740997356	KMFOAHJXHDOWND-UHFFFAOYSA-N	440.424	1.538	50	20	IDGD	
COc1cc(C(=O)NNC(=O)COc2cccc(C)c2)cc(NS(C)(=O)=O)c1OC	742472324	ONSJLBRSNZODLR-UHFFFAOYSA-N	437.474	1.224	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)c2ncccn2)c1	743290168	CMIRSIVUJHCIIC-UHFFFAOYSA-N	427.442	1.361	50	20	IDGD	
CN(CC(=O)NNC(=O)c1ccc(C#N)cc1)[C@H]1CCN(c2ccccc2Cl)C1=O	744400947	RNCVDZREXVBDMH-SFHVURJKSA-N	425.876	1.710	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1	744493707	HLFWSUGJZOCZAS-UHFFFAOYSA-N	445.497	1.398	50	20	IDGD	
CC(C)(C)C(=O)Nc1nccnc1C(=O)OCC(=O)NNC(=O)c1cccc(Cl)c1	745563648	OWOCWSMGEBCXKY-UHFFFAOYSA-N	433.852	1.733	50	20	IDGD	
COCCNC(=O)CSc1ccccc1C(=O)NNC(=O)Cc1cn2ccccc2n1	746550412	MNZCYOZYUOVODR-UHFFFAOYSA-N	441.513	1.193	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NN=Cc2cccc(O[C@@H](C)C(=O)O)c2)cc1	746679423	RODBIUPOGUMUEX-HNNXBMFYSA-N	433.486	1.618	50	20	IDGD	
CCO[C@@H](CCNC(=O)NNC(=O)c1csc(N2CCOCC2)n1)C1CCCC1	747490721	BPISWOFZHPAUJE-INIZCTEOSA-N	425.555	1.909	50	20	IDGD	
O=C(NC[C@H]1CCCN(Cc2cccs2)C1)NNC(=O)c1ccc(-n2cnnn2)cc1	747544581	OHQZONULIIUUNA-OAHLLOKOSA-N	440.533	1.580	50	20	IDGD	
COc1ccc(CNC(=O)NNC(=O)CNC(=O)c2ccco2)c(OC2CCCC2)c1	747961938	UAOBNOQZIIWINB-UHFFFAOYSA-N	430.461	1.870	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2ccc(C(=O)c3cc[nH]c3)cc2)ccc1Cl	748688896	DYNPCXKXSOAQGK-UHFFFAOYSA-N	446.872	1.621	50	20	IDGD	
CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)NNc1nc2ccccc2c(=O)n1C	749390745	YKASRCLUDLPAPJ-IBGZPJMESA-N	436.447	1.744	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CC(=O)N(CCOc2ccccc2Cl)C1)c1cccc([N+](=O)[O-])c1	751524045	MHSIRAWXENKQNU-CQSZACIVSA-N	446.847	1.937	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)c1cnn(-c2ccc(Cl)cc2)n1	751819664	ITRKNHMWYOMMOG-UHFFFAOYSA-N	427.848	1.776	50	20	IDGD	
COc1cccc(/C=C(/C#N)C(=O)OCC(=O)N2CCc3cc(S(N)(=O)=O)ccc32)c1	752868333	VRVFXUGFTOHKAU-SXGWCWSVSA-N	441.465	1.382	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)N[C@@H]3CCC[C@@H]4CN(Cc5ccccc5)C[C@@H]43)nc21	753317635	XAHDRTYCKQDGBH-BPQIPLTHSA-N	436.520	1.996	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)[C@H](NC2CCOCC2)C(C)C)cc1C	754512267	MVIYQBHUOGMTOO-GOSISDBHSA-N	425.551	1.716	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)Nc1ccc2c(ccn2CCN2CCOCC2)c1	756399471	PQHXZFPVYZAMKI-MRXNPFEDSA-N	433.509	1.178	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)COc1ccccc1[N+](=O)[O-])c1ccc(-n2ccnn2)cc1	756760659	XNPTYWHBPMKFAY-ZDUSSCGKSA-N	425.405	1.646	50	20	IDGD	
NC(=O)c1ccccc1Oc1ccc(NC(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)cc1	756859590	TWANNZYOSWBTSQ-LBPRGKRZSA-N	432.458	1.165	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)C(F)(F)c2c(F)cccc2F)c1	756862545	DYTKLPWLTZVHTC-UHFFFAOYSA-N	433.383	1.768	50	20	IDGD	
C[C@@H]1C[C@@H](C)CC2(C1)NC(=O)N(CC(=O)NNC(=O)[C@@H](C)Oc1ccccc1F)C2=O	756866539	DTYWZFWXQVIHIX-MGPQQGTHSA-N	434.468	1.487	50	20	IDGD	
O=C(COc1ccccc1O)NNS(=O)(=O)c1cc(Br)cc2c1OCC2	758457207	KURKOROXISYDRG-UHFFFAOYSA-N	443.275	1.478	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)c1cccc(S(N)(=O)=O)c1	763453775	NQIGQWNILCGSGC-LBPRGKRZSA-N	443.526	1.030	50	20	IDGD	
N#CCOc1cc(F)ccc1NC(=O)C(=O)NNC(=O)c1ccccc1Br	763482044	DALRMGOYOJTLPH-UHFFFAOYSA-N	435.209	1.890	50	20	IDGD	
O=C(NNC(=O)c1ccccc1O)C(=O)Nc1cccc(C(=O)NCc2ccccc2)c1	763528456	YYLOIDHMBQIYCL-UHFFFAOYSA-N	432.436	1.722	50	20	IDGD	
CO[C@@H](C)C(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)COc2cccc(C)c2)c1	763631088	UTRAPIGPKIKLQX-AWEZNQCLSA-N	428.445	1.133	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2ccccc2-n2nc(C)nc2C)c1	763771727	FLKQHHUBAHXWAS-UHFFFAOYSA-N	438.444	1.301	50	20	IDGD	
CC(C)C(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])cc1	763805676	VOEWTKCULHETRB-UHFFFAOYSA-N	443.416	1.354	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)Nc2cccn(Cc3ccc(F)cc3)c2=O)cc1	763831014	GFSXYELSAYNIOK-UHFFFAOYSA-N	436.443	1.998	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cnn(C[C@@H]3CCCO3)c2)c1C	763842316	YNORVPZVEOXZJL-WBVHZDCISA-N	429.477	1.232	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1csc(-c2ccccn2)n1	763864263	HQXCNCSYYNFYGM-NSHDSACASA-N	429.433	1.898	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccc(N2CCCC2=O)cc1	763872857	PMUIUCXTTXOLLI-CYBMUJFWSA-N	428.420	1.506	50	20	IDGD	
O=C(Cc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1ccccc1CN1CCOCC1	763932809	SEZRTPGDVURNIL-UHFFFAOYSA-N	430.892	1.501	50	20	IDGD	
Cc1coc(-c2cccc(NC(=O)C(=O)NNC(=O)c3nn(-c4ccccc4)cc3O)c2)n1	763949548	PKSIMLWAJBKPSA-UHFFFAOYSA-N	446.423	1.941	50	20	IDGD	
CCOc1cc(NC(=O)C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)ccc1OC	763950065	SHTMKJBIUAUGST-UHFFFAOYSA-N	439.428	1.385	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3ccc4[nH]nc(C(N)=O)c4c3)cc2C1	763951026	YPZRJQVGKOTSBT-SECBINFHSA-N	440.485	1.248	50	20	IDGD	
C[S@@](=O)Cc1cc(NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)ccc1Cl	763977254	LMRJLYSLUUFHIT-MUUNZHRXSA-N	444.296	1.977	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1cc(F)ccc1OC[C@@H]1CCCO1	764040294	DVLOPEHKBCXJEU-AWEZNQCLSA-N	431.420	1.792	50	20	IDGD	
O=C(NNC(=O)c1ccc2ccccc2c1)C(=O)Nc1ccc(CN2C(=O)CCC2=O)cc1	764064963	SRBAQIDHAVKQOG-UHFFFAOYSA-N	444.447	1.889	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(NC(C)=O)ccc2C)o1	764139084	NRZVSYKUHRMHOB-UHFFFAOYSA-N	429.477	1.788	50	20	IDGD	
CC1CCN(S(=O)(=O)c2ccc(NC(=O)C(=O)NNC(=O)c3ccoc3)cc2)CC1	764158375	CZTIZLPBBDMTLT-UHFFFAOYSA-N	434.474	1.100	50	20	IDGD	
CC(C)NC(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)c1	764162266	BKPORPMYVWRZNS-KRWDZBQOSA-N	444.875	1.568	50	20	IDGD	
Cc1ccccc1-c1cc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)n(C)n1	764345272	DYOQGAALCWMJPO-UHFFFAOYSA-N	443.467	1.981	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COCCO1)C(=O)Nc1cc(Cl)ccc1Sc1ccccc1	764434807	RTXVSFGBXZSFHD-HNNXBMFYSA-N	435.889	1.993	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)[C@H]1CCCN1C(=O)Cc1ccccc1	765312894	GLTFQVZBVCNFFR-QGZVFWFLSA-N	432.521	1.672	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)/C=C/c1ccc(NS(C)(=O)=O)cc1	765316996	HXSRJUWAXRANST-FMIVXFBMSA-N	440.522	1.524	50	20	IDGD	
COC(=O)c1cc(C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)cc([N+](=O)[O-])c1	765615357	GATLQQJWVGZFJR-UHFFFAOYSA-N	427.348	1.985	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1ccc(NC(=O)NCc2ccco2)cc1	766269719	DOXAZYUPTNTINT-UHFFFAOYSA-N	425.405	1.482	50	20	IDGD	
Cc1ccc(C(=O)C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)cc1	766663801	ODFPSMHMWJBRRP-UHFFFAOYSA-N	428.920	1.796	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](OCC(=O)NNc2nccc(N3CCOCC3)n2)C1	768242298	ANCUTUBQFWNXOQ-OAHLLOKOSA-N	436.513	1.172	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)CCc2c(C)nc3nc(N)nn3c2C)n[nH]1	768274352	RJRUGKLDPBEROI-UHFFFAOYSA-N	449.475	1.116	50	20	IDGD	
COC(=O)c1c(C)[nH]c(C(=O)NNC(=O)c2cc(-c3ccc(OC)c(OC)c3)[nH]n2)c1C	768276393	JSGOYIDHXIYDLT-UHFFFAOYSA-N	441.444	1.900	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)CN1C(=O)N[C@@]2(CCCC(C)(C)C2)C1=O	768559688	GVMVCPYVVSOSNH-OAQYLSRUSA-N	432.477	1.112	50	20	IDGD	
CSCCNC(=S)NNC(=O)c1cccc(S(=O)(=O)NCc2ccco2)c1	769770601	WQMJZHZYKLZADE-UHFFFAOYSA-N	428.561	1.230	50	20	IDGD	
O=S(=O)(CBr)N1CCN(S(=O)(=O)c2cnc3ccccc3c2)CC1	770328197	WDPJNPSSZZNABU-UHFFFAOYSA-N	434.337	1.223	50	20	IDGD	
Cc1cc(C)cc(CCC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c1	771217944	VJPRKPMNXHRHHQ-UHFFFAOYSA-N	445.541	1.718	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)COc1ccc(I)cc1	771889773	DFNASTNBJRZAKK-NSHDSACASA-N	448.257	1.795	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCc2cnc(C)s2)c1	772626660	FDXUFXJZKOFEPW-UHFFFAOYSA-N	439.563	1.669	50	20	IDGD	
CC(C)(C)OC(=O)N1CCSC[C@@H]1CC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	772632177	XCEZPNOEZAKKMV-HNNXBMFYSA-N	447.521	1.166	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2cccc(S(C)(=O)=O)c2)ncc1Br	773491087	TWZOGTIHPIFRQI-UHFFFAOYSA-N	427.280	1.638	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)C(=O)N(CC2CC2)C3=O)cc1F	773885107	HPFFBTCXTBNBAS-UHFFFAOYSA-N	438.415	1.540	50	20	IDGD	
Cc1nn(C)c(C)c1-c1cc(C(=O)NNC(=O)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)n[nH]1	774272881	SZAZHQNTCNJDMF-CQSZACIVSA-N	445.524	1.835	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@H]1CN(CC(=O)NNC(=O)c2cccc(Cl)c2)CCO1	775850550	NBNCHHQVTTYVEP-HNNXBMFYSA-N	426.901	1.327	50	20	IDGD	
COc1cccc([C@@H]2[C@@H](C(=O)NNC(=O)c3ccc4c(c3)OCO4)CC(=O)N2C2CC2)c1	776447825	OWRXKVLDIWTLBB-LAUBAEHRSA-N	437.452	1.937	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1)N[C@H]1CCCOCC1	776632914	HIEAGCXBLMKVCK-SFHVURJKSA-N	446.529	1.678	50	20	IDGD	
CCc1ccccc1-n1cnnc1SCC(=O)NNC(=O)CNC(=O)OC(C)(C)C	778433148	GFLMLXTZWUCPGI-UHFFFAOYSA-N	434.522	1.594	50	20	IDGD	
COC(=O)[C@@H]1CN(C(=O)C(=O)NNc2ccccc2OC(F)(F)F)c2ccccc2O1	778797453	ALIMWDNZWPXLOA-HNNXBMFYSA-N	439.346	1.996	50	20	IDGD	
COc1cc(OC)c(Cn2nccc2NC(=O)NNc2nccc(OC)n2)c(OC)c1	779482648	JZYLISYBGZNODQ-UHFFFAOYSA-N	429.437	1.904	50	20	IDGD	
COC(=O)CNC(=O)NNS(=O)(=O)c1ccc(Br)c(C(F)(F)F)c1	779846249	KLHDBELPDNJSEA-UHFFFAOYSA-N	434.190	1.133	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)N2CC[C@H](C(=O)OC)C[C@H]2C(=O)OC)c1C	780138075	URXSQHZJYKXYFZ-POCPDCKQSA-N	431.489	1.612	50	20	IDGD	
O=C(Cc1ccccn1)NNC(=O)C(=O)Nc1ccc2c(c1)CCC(=O)N2CC(F)(F)F	782118626	YFFDZDBJNRESAV-UHFFFAOYSA-N	449.389	1.252	50	20	IDGD	
Cc1ccc(S(=O)(=O)NC[C@@H]2CCCN(S(=O)(=O)CBr)C2)cc1	782432764	MRSVXYBGKITUHD-ZDUSSCGKSA-N	425.370	1.668	50	20	IDGD	
CCOC(=O)[C@@H](Cc1ccccc1)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	783571282	KJHGVNXCHBYQLO-HXUWFJFHSA-N	445.541	1.880	50	20	IDGD	
CN(NC(=O)[C@@H]1CCCN1c1ncccn1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	783704247	MSXMWUVUFUAKAI-HNNXBMFYSA-N	433.513	1.081	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)C(=O)Nc1ccnn1C1CCCCC1	784210058	AFEYMZKKBVEPOM-UHFFFAOYSA-N	446.533	1.911	50	20	IDGD	
O=C(NNc1ccc(Br)cn1)C(=O)Nc1cccc(CN2CCOC2=O)c1	784338584	BUDZDCKNDWGFBW-UHFFFAOYSA-N	434.250	1.878	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ccc(Br)cn2)cc1-n1nnnc1C	784342029	XGDMMDFIJITYGR-UHFFFAOYSA-N	447.253	1.219	50	20	IDGD	
CS(=O)(=O)c1cc(Br)ccc1NC(=O)C(=O)NNc1cccnc1Cl	784848748	NUXDARXVSYDRDD-UHFFFAOYSA-N	447.698	1.983	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ccc(Cl)nc2)cc1OCC(=O)NC1CC1	784870171	FKDSCHDFPDAVAS-UHFFFAOYSA-N	433.852	1.483	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)N1CCc2ccc(Br)cc21	785023964	SFYXYGCIJIVYQR-UHFFFAOYSA-N	449.217	1.413	50	20	IDGD	
COc1cc(F)cc(NNC(=O)C(=O)Nc2cc(OC)c(OC)cc2C(=O)N(C)C)c1	785247921	ZAKAXPNDZXFPAQ-UHFFFAOYSA-N	434.424	1.635	50	20	IDGD	
CCC(=O)c1ccc(OCCCCC(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)cc1	788500934	DCTCLLUBLUPNIX-OAHLLOKOSA-N	425.507	1.346	50	20	IDGD	
O=C(NNC(=O)c1ccnc(Oc2ccc(F)cc2F)c1)N[C@@H]1CCS(=O)(=O)C1	788744223	XDARLFSEFFEORN-GFCCVEGCSA-N	426.401	1.283	50	20	IDGD	
CN(C)[C@@H]1CCOc2c(NC(=O)C(=O)NNC(=O)Cn3ccc4ccccc43)cccc21	789735735	UKISCYKLCVWYOB-LJQANCHMSA-N	435.484	1.813	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1nc(C(C)(C)C)cs1	789776398	OOPOIRNAKJBJFT-UHFFFAOYSA-N	426.520	1.935	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)C(=O)Nc1ccccc1N1C[C@H]2CC[C@H]1C2	790951734	KPWSLUZIHWONOC-YOEHRIQHSA-N	446.471	1.051	50	20	IDGD	
CC(C)(C)c1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)cc1[N+](=O)[O-]	793027269	ZKSZPPJRURXNNS-KRWDZBQOSA-N	426.429	1.982	50	20	IDGD	
CC(=O)N1CCc2ccccc2[C@@H]1CC(=O)NNc1ccccc1S(=O)(=O)N(C)C	795169431	PTZZQBIPKPJDFZ-IBGZPJMESA-N	430.530	1.916	50	20	IDGD	
CCCNC(=O)NNS(=O)(=O)c1cc(C(=O)OCC)c(Br)cc1F	795301286	GICLIAJOAJTKQH-UHFFFAOYSA-N	426.264	1.667	50	20	IDGD	
O=C(Cc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1ccc(F)c(N2CCOC2=O)c1	796999449	LWXMWJDRXSIAQN-UHFFFAOYSA-N	434.811	1.764	50	20	IDGD	
C[C@H](CCNS(=O)(=O)c1ccccc1)NC(=O)NNC(=O)COCc1ccccc1	801753523	WLHQZNGSICSYJQ-MRXNPFEDSA-N	434.518	1.291	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc2c(c1)COC2)NNC(=O)Cc1ccc2ccccc2c1	802479057	LBUKUJUZIXZOLJ-UHFFFAOYSA-N	439.493	1.538	50	20	IDGD	
C[C@H](CC(=O)NNc1ccc2c(=O)[nH]ccc2c1)/N=C1/NS(=O)(=O)c2ccccc21	803428937	JDTLXLGGMAENIH-GFCCVEGCSA-N	425.470	1.489	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)NCCNS(=O)(=O)c2ccc(Cl)cc2C)n1	805405386	IVANZJYPAQIYQN-UHFFFAOYSA-N	425.898	1.274	50	20	IDGD	
CN(C1CC1)S(=O)(=O)c1ccc(NC(=O)NNc2ccc(-n3ccnc3)nn2)cc1	806258351	KXUXKCHWRUGNDS-UHFFFAOYSA-N	428.478	1.594	50	20	IDGD	
O=C(NCCNS(=O)(=O)c1cccc(Cl)c1Cl)NNC(=O)c1ccccc1O	807455212	HPBZJDSNPWCRAG-UHFFFAOYSA-N	447.300	1.622	50	20	IDGD	
O=C(NNc1nccnc1C1CCC1)C(=O)Nc1ccc(I)cn1	807460309	NEYRPSCMDCPNAG-UHFFFAOYSA-N	438.229	1.826	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C1=NN(Cc2ccccc2)C(=O)CC1	817054208	YRDSRLCVHAOIJW-UHFFFAOYSA-N	429.502	1.559	50	20	IDGD	
CNS(=O)(=O)NC1CCN(C(=O)/C(C#N)=C\c2cc(C)n(C[C@@H]3CCCO3)c2C)CC1	819579690	GYWHHEYNUCKNKD-SQWSFHKJSA-N	449.577	1.236	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@H](O)[C@@H](O)c2nc3ccccc3s2)cc(OC)c1OC	825457259	QQXABQCJUVHILM-HZPDHXFCSA-N	447.469	1.178	50	20	IDGD	
O=C(COc1ccccc1Cc1ccccc1)NNC(=O)CN1C(=O)[C@H]2CCCC[C@@H]2C1=O	871734534	RZEWBRYGRIIGKW-PMACEKPBSA-N	449.507	1.979	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)CCNS(=O)(=O)/C=C\c2ccccc2)c1	913446024	HFJDXOZKWXGFAE-LUAWRHEFSA-N	431.514	1.810	50	20	IDGD	
COc1cccc(COCC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1	915616366	JCACXANTCWNQIR-UHFFFAOYSA-N	447.513	1.458	50	20	IDGD	
COc1cc(OC)cc([C@@H](NC(=O)NNC(=O)Cn2nc(C)cc2C)c2nccn2C)c1	916229090	LVIIVJIHMJBKHF-LJQANCHMSA-N	441.492	1.371	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC(NC(=O)NNC(=O)c3ccccc3O)CC2)cc1	916235803	VORNRYLUMBNDJG-UHFFFAOYSA-N	432.502	1.498	50	20	IDGD	
CS(=O)(=O)NC1(CNC(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)CCCCC1	916253740	JFKXQFDVQMQVRE-UHFFFAOYSA-N	426.583	1.785	50	20	IDGD	
CO[C@H](CNC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)c1ccccc1	916271839	GKMBBNQSRGGXCG-LJQANCHMSA-N	446.529	1.803	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)NCC[C@](O)(c2nccn2C)C(F)(F)F)c1	916377199	ADQFZFHDABNBOA-KRWDZBQOSA-N	429.399	1.278	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)NC[C@H](c1ccccc1)N1CCOCC1	916509415	OBYTYFRRQAIDMI-QFBILLFUSA-N	430.480	1.997	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)N1CCN(c2ccccc2)CC1	916514857	QICHPDMBYSLIMD-MRXNPFEDSA-N	426.477	1.750	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)COc1ccccc1[N+](=O)[O-])N1CCc2sccc2C1	916620019	LIAKBUBKOORWSP-ZDUSSCGKSA-N	433.490	1.812	50	20	IDGD	
CCOc1ccc2cc(C(=O)OCC(=O)NNC(=O)[C@@H]3COc4ccccc4O3)[nH]c2c1	917313165	OKDUHLZIZZIROW-IBGZPJMESA-N	439.424	1.711	50	20	IDGD	
O=C(NNC(=O)C1CCN(S(=O)(=O)/C=C\c2ccccc2)CC1)c1ccccc1O	917372018	DWALRTBQTJFZLI-QINSGFPZSA-N	429.498	1.866	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)S(=O)(=O)N(C[C@@H]1CCCO1)C2=O)c1ccccc1	918550203	QWZSJQWBKYSQGI-HNNXBMFYSA-N	429.454	1.085	50	20	IDGD	
O=C(NCC(F)(F)F)NNC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(F)cc2)C1	918707228	ITLANZWHKWZGBC-SNVBAGLBSA-N	426.392	1.119	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)[C@@H](NS(=O)(=O)c1ccc(C)cc1)C(C)C	919820500	IXGZGYKETVAHMY-FQEVSTJZSA-N	433.530	1.697	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)[C@H](C)NS(=O)(=O)c2ccc(OC)cc2)cc1	919836538	XFHFFIGLZQDQGU-AWEZNQCLSA-N	435.502	1.151	50	20	IDGD	
O=C(/C=C\c1cc(C(F)(F)F)ccc1Cl)NNC(=O)N[C@H]1CCS(=O)(=O)C1	919885725	QYJPEARSVXJHST-WYEHYUNLSA-N	425.816	1.890	50	20	IDGD	
O=C(NNC(=O)c1ccc(NC2CC2)nc1)c1ccc(S(=O)(=O)N2CCCC2)cc1	919972024	DXPSYSBACBPJGI-UHFFFAOYSA-N	429.502	1.515	50	20	IDGD	
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC(=NNC(=O)c2cncn2-c2ccccc2)CC1	1317809933	UQTVFOHOSNRMKS-UHFFFAOYSA-N	441.517	1.783	50	20	IDGD	
CNC(=O)c1cccc(C(=O)NNC(=O)[C@@H]2Cc3ccccc3CN2Cc2ccccc2)n1	1319158311	UXCDYKJDAVAEDW-QFIPXVFZSA-N	443.507	1.829	50	20	IDGD	
O=C(NNC(=S)NCc1ccon1)c1cccc(NC(=S)NCc2ccon2)c1	1319184347	UTLGZOOJHQENKH-UHFFFAOYSA-N	431.503	1.458	50	20	IDGD	
CCOC(=O)COc1ccc(C=NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1	1319401255	RDQQPWABPLVKQG-UHFFFAOYSA-N	447.513	1.708	50	20	IDGD	
C[C@H](O)CNS(=O)(=O)c1ccc(C(=O)NNC(=O)Cc2cccc3ccccc23)cc1	1335672380	DLWMVZOBSAVYBC-HNNXBMFYSA-N	441.509	1.503	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)NCCc2nc(Cc3ccccc3)no2)c1	1340543004	BRMJIUZPQSKHJD-UHFFFAOYSA-N	425.445	1.864	50	20	IDGD	
C[C@H](C(=O)N1CC[C@]2(CN(C(=O)CCBr)CCO2)C1)n1ccccc1=O	1779267367	ZTGZPAGYIRSAPG-KDOFPFPSSA-N	426.311	1.024	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cc(-n3ccnc3)ccn1)CCO2	1779299352	YIFPICNPXXIDKV-OAQYLSRUSA-N	443.580	1.562	50	20	IDGD	
CC(C)c1ccc(C(=O)N2CC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)cc1	1780767363	UCQBLNZAGIHXRJ-QHCPKHFHSA-N	430.549	1.627	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](F)Br)C2)nn1	1780773328	AAUUUUMMOOKKCK-SUYBPPKGSA-N	445.289	1.303	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3c(Br)cnn3C)CCO2)C1	1781219599	VLFYPERUDBYJNB-MLGOLLRUSA-N	433.734	1.644	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cc([N+](=O)[O-])cc4c3OCC4)CCO2)C1	1781220710	CHPDENXUHLNIPN-UZLBHIALSA-N	437.880	1.991	50	20	IDGD	
N#Cc1ccc(F)c(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](F)Br)C3)C2)c1	1781331926	BGCOKXLWPYHOOT-WMLDXEAASA-N	428.233	1.831	50	20	IDGD	
O=C(c1cc(O)cc([N+](=O)[O-])c1)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781333435	OJGLHFLICHLIMC-BBRMVZONSA-N	446.229	1.434	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H]1Cc3ccccc3O1)C2	1782176163	WXZRAMXJTZPQJD-WGQQHEPDSA-N	436.936	1.758	50	20	IDGD	
COCCn1ccc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)C(Cl)Cl)C2)n1	1782217400	HPXSCUXYILSCBH-RDTXWAMCSA-N	433.336	1.461	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H]2CCNC(=O)C2)C1	1782273635	IWYVBRINUZGFFA-NRTGNBEESA-N	444.370	1.200	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4nn[nH]c4c3)C2)C1	1782582713	HFAMIARRMOBWCV-ROUUACIJSA-N	426.304	1.638	50	20	IDGD	
Cn1ncnc1C(=O)N1CCO[C@]2(CCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1	1782864413	VUYYBZKLMCFVBE-OMKLEDIQSA-N	442.426	1.144	50	20	IDGD	
COc1ccc(F)c(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](O)CCl)C3)c1	1782920709	IRYZFJSBZCGMKA-SQGPQFPESA-N	428.888	1.562	50	20	IDGD	
O=C(c1nc[nH]n1)N1CCO[C@]2(CCN(C(=O)[C@@H](Br)Cc3ccccc3)C2)C1	1783021779	BAZSQKMSLCDOPE-KXBFYZLASA-N	448.321	1.254	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)CC3CCN(C)CC3)CCO2)C1	1783339560	SYBGEFRAJHUZGK-VQIMIIECSA-N	430.387	1.722	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)Cc3ccc(OC)cc3Cl)CCO2)C1	1783873760	UISISQQFLJMPHC-FXAWDEMLSA-N	445.343	1.975	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)C(Cl)Cl)C3)C2)c(-n2nccn2)c1	1783948147	COPBBSDHGCCAGG-IBGZPJMESA-N	438.315	1.823	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C[C@@H]3OCCc4ccccc43)C[C@@H]21)[C@@H](O)CCl	1784085834	PQCANAROVOJUOT-JBDAPHQKSA-N	436.936	1.270	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(C(N)=O)cc3)C2)C1	1784931186	CHEZWDRXAUUSBI-HNAYVOBHSA-N	438.322	1.403	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3ccc4c(c3)CCC4)[C@H]2C1	1785047393	IFPFSKJLSRMZFH-BURNTYAHSA-N	434.964	1.951	50	20	IDGD	
C#CCCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)[C@H]2C1	1785078895	DGEVPAQZORMXCS-QAETUUGQSA-N	441.956	1.512	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(CC(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](F)Cl)CCO3)C1	1785480195	IHMFOCHIBBIKQG-KXBFYZLASA-N	433.908	1.608	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)NC1(c2ccc(NC(=O)C(O)O)cc2)CCC1	1786018099	VSYRIEGNCOMXGQ-AWEZNQCLSA-N	441.912	1.563	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)C(=O)c1ccccc1	1786342230	DKNDZBWJXHCARH-RZLSGREXSA-N	427.270	1.540	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(C=O)s3)[C@H]2C1	1786989642	IISGPJAMLPMYGF-IMIFBBOLSA-N	429.336	1.937	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cn3ccc4sccc4c3=O)C[C@@H]21)[C@@H](F)Cl	1787444077	LWNUFRFAPKFGCS-PLNCSYRRSA-N	441.912	1.577	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnn4ccccc34)[C@H]2C1	1787850961	KLBPMDSDJAQPJY-OAOQPFQOSA-N	449.349	1.959	50	20	IDGD	
CCCC(=O)N[C@@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)CBr)C[C@@H]21	1788738717	GLLCIZKEPBTRHB-QXKUPLGCSA-N	446.386	1.302	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3c(F)cncc3F)C[C@@H]21	1788764810	WNZQWRKKQHLHPD-XEZPLFJOSA-N	427.524	1.805	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4ncccn4n3)C[C@@H]21	1788765017	ZYLLRMVQVKJUES-ZOBUZTSGSA-N	431.569	1.174	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(-c4cccnc4)[nH]n3)[C@H]2C1	1788936249	SBBHYFALFVECLA-GGXPGOJBSA-N	447.923	1.319	50	20	IDGD	
C[C@H](Cn1cncn1)C(=O)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1	1789614780	NNKFHTIBUSCOEZ-MRXNPFEDSA-N	447.304	1.042	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CCN3C(=O)OC(C)(C)C)C[C@@H]21	1789857900	KQJLJKLJUFNFFZ-SIRPWMCASA-N	443.972	1.993	50	20	IDGD	
Cc1cccnc1CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]2C1	1789922279	JRECLYJSPYHQPO-DNUAJFIVSA-N	442.329	1.993	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C[C@@H]21	1791256595	CUKTXJWEMPBBOU-ZAJUMQRFSA-N	447.315	1.598	50	20	IDGD	
CN[C@H](CC(=O)NC1(c2ccc(NC(=O)[C@@H](C)Br)cc2)CCC1)C(=O)O	1791434809	ZVMUXHSTEZTKLL-BXUZGUMPSA-N	426.311	1.967	50	20	IDGD	
Cc1nn(C)c(C(=O)NC2(c3ccc(NC(=O)CCC(=O)NN(C)C)cc3)CCC2)c1F	1791599746	UGAIUYMWWGRVLD-UHFFFAOYSA-N	444.511	1.988	50	20	IDGD	
CC(C)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ncn(-c3ccccc3)n1)C2	1792781954	JWSHRDIMWOOEPE-SCAQPMJSSA-N	431.924	1.736	50	20	IDGD	
Cc1ccccc1OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)CBr	1792868241	UVTFWEDRVHGTRO-OAFZBRQQSA-N	439.350	1.994	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1csc(-c3ccccc3)n1)C2)[C@H](O)CCl	1792978399	SYZGHLVFOFIHOH-YALNPMBYSA-N	435.933	1.613	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CC(=O)N(Cc2ccccc2)C1	1793404535	ZQSYIKAOERQYHZ-OBKDMQGPSA-N	447.963	1.927	50	20	IDGD	
COc1ncccc1CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCC(=O)NN(C)C)C2	1794366194	GYSMNRDQRGVEPK-BCDXTJNWSA-N	431.537	1.034	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccn(C(C)(C)C)n1	1794420919	FZCIUVJZXRHLNH-XPCVCDNBSA-N	427.343	1.625	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1CCC1	1795016649	QVJZDRCTYUSFOB-FZKCQIBNSA-N	429.945	1.508	50	20	IDGD	
CC(C)(C)OC(=O)NCCCCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Cl	1796365162	UVQWKTHLNTZGBF-XRGAULLZSA-N	435.924	1.805	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H]1CNc3ccccc31)C2	1796892243	RMXMZNIORFOSJD-FZAPOCCLSA-N	448.527	1.968	50	20	IDGD	
CC(C)n1nccc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)CBr)C2	1798152777	UQBYPVZHQFVBPN-HGTKMLMNSA-N	427.343	1.698	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc2ncsc12)c1cccc(B(O)O)c1	1798164511	NGIAHXFLJLFTBP-BJWYYQGGSA-N	435.314	1.542	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccc(F)c(C#N)c1	1799326972	MTDPNQVTCWDJMB-ZKRNXSKHSA-N	438.297	1.613	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc([N+](=O)[O-])c2c1OCO2	1799345332	XDJMPYWXLUOEBR-GFQSEFKGSA-N	439.852	1.829	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nccc3occc13)C2)[C@H](F)Br	1799346719	YBGGVDVYWGDIKE-FJHTZYQYSA-N	426.242	1.722	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1CCC3(CC1)OCCO3)C2)[C@H](F)Br	1799347248	NJTZRKYUZKGDPE-XGUBFFRZSA-N	449.317	1.200	50	20	IDGD	
COc1ccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Br)cc1F	1799352448	XGKPAVXBYNAWPU-LZDSYCOUSA-N	447.276	1.657	50	20	IDGD	
CCCCC[C@@H](C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2	1800562188	MSADWUXVMMBWOJ-XEBLMJKWSA-N	445.564	1.926	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1(Br)CC1)C2	1800642509	MAVNMFRAEPIHAK-WRWGMCAJSA-N	438.160	1.677	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(OC)c(OC)cc1C)C2	1800977452	PGVBXUJXIGEZPX-QHHYFVSCSA-N	440.924	1.469	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(Cl)Cl	1801015905	WYOGBQMUWOUIGF-YVECIDJPSA-N	436.336	1.389	50	20	IDGD	
COC(=O)c1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CCC(=O)NN(C)C)C3)c(C)c1	1803967483	IEDPGNLLBUCTHT-BCDXTJNWSA-N	444.532	1.406	50	20	IDGD	
CC(=O)N(C)CCC(=O)NC[C@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1	1804068148	SLDVUMYEQFYKEJ-APWZRJJASA-N	439.354	1.741	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](F)Cl)C3)CC1	1804088104	AGRULWVAVIOJJC-JYYAWHABSA-N	446.951	1.712	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC2(CCCN(C(=O)CCNC(=O)c3ccc[nH]3)C2)CC1	1806978645	BXWIPZYDNDDFNW-MRXNPFEDSA-N	438.956	1.620	50	20	IDGD	
C[C@H](Nc1cccnc1)C(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1	1807149630	AJNRVVFONPWHJJ-IAAVTCLWSA-N	431.924	1.583	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CN2CCCC2=O)[C@@H]1c1cccnc1)[C@@H](F)Br	1808661977	UDEHRBRTCCWYLD-IAOVAPTHSA-N	441.301	1.400	50	20	IDGD	
CC(=O)Nc1cc(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)ccn1	1808920292	WZOOFDFCTKLTTD-LNLFQRSKSA-N	445.907	1.354	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H](CNC(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)no1	1810297824	FFJYFQDGIFJHJW-BEFAXECRSA-N	449.471	1.010	50	20	IDGD	
Cc1c[nH]cc1C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1	1810301942	DYPSUDSADNXTRV-OXQOHEQNSA-N	447.499	1.350	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1CCN(C(=O)c2ccnnc2O)[C@H]1c1cccnc1	1810543628	DADAUVDRKSEVAQ-YJBOKZPZSA-N	429.553	1.748	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)c1cccc2nccn12	1812172549	FECBUPBJBMVHTI-IEZWGBDMSA-N	427.892	1.649	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)CCc2ccc(O)nn2)[C@H]1c1cccnc1	1813034092	AHLIUGMVBCTMCX-SYNHAJSKSA-N	447.923	1.470	50	20	IDGD	
C[C@H](C(=O)NC[C@@H]1CCN(C(=O)CO[Si](C)(C)C)[C@H]1c1cccnc1)n1cncn1	1813402447	QRMDXVCDEWOPCL-AYBZRNKSSA-N	430.585	1.792	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)C1CC3(CCC3)C1)CC2)c1ccc(B(O)O)cc1	1815347904	WWAUTDIGGXKGTH-INIZCTEOSA-N	439.346	1.629	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)CCBr)[nH]n1)c1cccc(B(O)O)c1	1817473198	LMVFIVMVDSYLTE-OAHLLOKOSA-N	449.114	1.180	50	20	IDGD	
Cc1cccnc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1	1817473963	IMCXDCPLFWSYPE-SFHVURJKSA-N	433.277	1.413	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H]2C[C@@H](O)C2)[nH]n1	1818112869	REYDWDZZPCSCLT-SRXFQKJYSA-N	441.492	1.307	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)Cc2cccnc2)[nH]n1	1819402922	NVHXJDLPLOPJQN-SFHVURJKSA-N	448.487	1.352	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](C)Br)CC2	1819694333	CUNDZNABQJBDIE-OPRDCNLKSA-N	446.371	1.546	50	20	IDGD	
CC(=O)c1cc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)n[nH]1	1822412681	DJCMQYAWVKEKKO-INIZCTEOSA-N	444.496	1.014	50	20	IDGD	
C[C@@H](C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)C(C)(C)CCl)CC2)N1CCN(C)CC1	1822685290	YAALCBCVBVHCFS-KBPBESRZSA-N	442.029	1.956	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CN1CCOC1=O)CC2	1822861406	ZJNJVRXMFLURLO-JDNHERCYSA-N	435.333	1.744	50	20	IDGD	
Cc1cccnc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1	1824697243	NFHVTUWOBCYXKP-OAQYLSRUSA-N	435.333	1.617	50	20	IDGD	
CCc1ncccc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1	1825513366	KFNNALAPWFENRZ-HSZRJFAPSA-N	449.360	1.871	50	20	IDGD	
Cc1ccc(C(=O)N[C@@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)nc1C	1826080533	PLAGPGQAIYJOOV-CQSZACIVSA-N	444.561	1.754	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)Cc3ccccc3)C2)C1	1830366241	LRPCZNDEQLDCTH-PGRDOPGGSA-N	438.952	1.311	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(Cl)ncn3)C2)C1	1831654425	KTRKVIGAKWQZKD-SCLBCKFNSA-N	431.320	1.608	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](CCC)NC(C)=O)C2)C1	1831659478	SLLDOLFJPRKESY-QKLQHJQFSA-N	431.961	1.155	50	20	IDGD	
C=CCSCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1	1832458677	VHFOCVVFKYBCBH-IRXDYDNUSA-N	425.378	1.598	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1)[C@@H]1CCCCO1	1833109225	GWGCZEMKKMCEED-KRWDZBQOSA-N	430.387	1.912	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)C3(C(F)(F)F)CCC3)CC2)CC1)[C@H](O)CCl	1833309465	WTVRJCYSGSAGPN-OAHLLOKOSA-N	439.906	1.890	50	20	IDGD	
C=CCO[C@H](C)C(=O)NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1	1833477739	RFEZZMABMRIBGS-CJNGLKHVSA-N	434.350	1.840	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnc(OCF)cn3)CCO2)C1	1833567088	GNTJNKURKOQRRS-IFXJQAMLSA-N	444.891	1.260	50	20	IDGD	
Cn1nncc1C(=O)NC1CCN(C2CCN(C(=O)[C@@](C)(Cl)CCl)CC2)CC1	1833898875	FLBWQTXMRMQLMP-SFHVURJKSA-N	431.368	1.237	50	20	IDGD	
COc1nccnc1C(=O)NC1CCN(C2CCN(C(=O)C(C)(C)CCl)CC2)CC1	1833967676	FXCAXWPLQIVAHV-UHFFFAOYSA-N	437.972	1.935	50	20	IDGD	
CCn1ccc(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](Cl)COC)CC3)CC2)n1	1834274452	NAUMRQKRUPXOFU-KRWDZBQOSA-N	425.961	1.342	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(O)cn3)CCO2)C1	1834588036	FAFLFYNGORSDEL-ROUUACIJSA-N	432.304	1.094	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)CCN3CCOCC3)CC2)CC1	1834635102	RRLZSTMZPTULNF-FQEVSTJZSA-N	443.032	1.688	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](CC)NC)CC2)CC1	1834794864	JFWPOWMOFOIHHS-DLBZAZTESA-N	431.419	1.730	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC1CCN(C2CCN(C(=O)CCSC(=N)N)CC2)CC1	1835833599	WJTNSUMZWAVWPJ-UHFFFAOYSA-N	443.690	1.426	50	20	IDGD	
C#CCO[C@@H](C)C(=O)N1CCC(OC2CCN(C(=O)[C@H](F)Br)CC2)CC1	1836860735	DDLFVXLCVWOARO-BBRMVZONSA-N	433.318	1.714	50	20	IDGD	
Cc1ccn(CC(=O)N2CCC(OC3CCN(C(=O)[C@H](C)Br)CC3)CC2)n1	1837192964	AUSNHGNVAMHZKN-HNNXBMFYSA-N	441.370	1.974	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)cc(O)n1	1837711600	LRHFNAKRGZBAOE-FQEVSTJZSA-N	437.569	1.017	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)CCc3ccccc3)C2)C1	1837711948	AXFOCBCYVVGQNX-QFIPXVFZSA-N	434.609	1.927	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccncc3O)CCO2)C1	1837820839	DHOLYJJTPCNYFW-KDOFPFPSSA-N	442.310	1.031	50	20	IDGD	
O=C(c1cc(-c2ccccc2)no1)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1	1837994519	QFOPLIPUXGENAC-DYESRHJHSA-N	449.891	1.011	50	20	IDGD	
COc1ccsc1C(=O)N1CCO[C@@]2(COCCN(C(=O)CCBr)C2)C1	1838292192	ZEHBXKFNEATUGY-QGZVFWFLSA-N	447.351	1.612	50	20	IDGD	
CCOC(=O)N[C@@H](O)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](Cl)CC)CC2)CC1	1838356953	JGHIQVMSOINNNT-HOTGVXAUSA-N	433.933	1.067	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)c(C)n1C	1838384893	MSMSGVWXLRYVJH-MAUKXSAKSA-N	446.317	1.402	50	20	IDGD	
COc1cc(C#N)cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)c1	1838584565	YWLJHBDVRBWWRO-IBGZPJMESA-N	442.299	1.441	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)COc3ccccc3)C2)C1	1839151113	ILNSJNWDKRPFCY-UXHICEINSA-N	445.343	1.758	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccccc3O)C2)C1	1839155399	SHHQFIZQVJDIBG-PMACEKPBSA-N	445.343	1.627	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(F)(F)c1ccco1)CCO2	1839690319	DRNDPAZCGVBDEI-GOSISDBHSA-N	446.523	1.679	50	20	IDGD	
CCc1oncc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](Br)CC)CCO2	1839963611	QFUBUSYVBCVIHL-KBXCAEBGSA-N	444.326	1.481	50	20	IDGD	
O=C(c1nn(-c2ccccc2)c2c1COC2)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1	1841350807	YQPUUWYHWUXORP-KRWDZBQOSA-N	430.892	1.319	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)c2cc(CO)on2)C1	1844820691	JVRLKYPBOJSUKP-UHFFFAOYSA-N	444.400	1.131	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cccc(S(C)(=O)=O)c1	1847384533	HSUMVNXDDBZQBZ-UGFHNGPFSA-N	429.336	1.689	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)C1=CCN(C(=O)OC(C)(C)C)C1	1847728400	UVJZHXWRGXGCIG-PMPSAXMXSA-N	427.929	1.619	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1848099924	CNGKWPFKFIPFOK-OEAJRASXSA-N	444.960	1.187	50	20	IDGD	
Cn1nc(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](Br)Cc2ccccc2)cc1O	1848331378	FFUMVTBOQLOESF-PVAVHDDUSA-N	447.333	1.947	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)c1ccc(Cl)c(NC(=O)c2cccs2)c1	9930891	ZYWSPIMOCDOPND-NSHDSACASA-N	441.918	1.850	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@H](C)C(=O)NNC(=O)Cn1c(=O)[nH]c(=O)c2ccccc21	10403167	ADUSVZSHBGSABH-CYBMUJFWSA-N	444.875	1.575	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)c1cc(S(=O)(=O)NC(C)(C)C)ccc1C	15879605	MUMCGXNSSLGQCB-UHFFFAOYSA-N	449.529	1.920	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)CCc2nc3ccccc3c(=O)[nH]2)c2ccccc2c1=O	17161692	XSSGKQWVVPCTAO-UHFFFAOYSA-N	446.467	1.437	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccccc1)c1ccc2c(c1)OCO2	26963785	WBLNTNFSZZVVMI-MRXNPFEDSA-N	431.470	1.420	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NCCOc1ccc(C(F)(F)F)cc1	725872216	BZYIYFYDSHRSDL-UHFFFAOYSA-N	430.408	1.906	50	20	IDGD	
O=C(NNc1nc(-c2ccncc2)no1)c1ccc2c(c1)SC1=NS(=O)(=O)CCN12	726377149	LQEGHGHQTNVDAN-UHFFFAOYSA-N	443.470	1.500	50	20	IDGD	
NC(=O)c1ncn2c(C(=O)NNC(=O)CCCc3ccccc3)cc(-c3ccco3)nc12	727741003	AXZVWQMJHVSXSC-UHFFFAOYSA-N	432.440	1.872	50	20	IDGD	
C[C@]12CCC(=O)N1c1ccccc1C(=O)N2CC(=O)NNc1nc(-c2ccncc2)no1	728072400	IBYJLGVYLWHGFF-OAQYLSRUSA-N	433.428	1.574	50	20	IDGD	
CCOc1ccccc1C(=O)N1CCC[C@H]1C(=O)NNC(=O)CNc1cccc(OC)c1	728205916	LSEFNUFFGBZLRY-IBGZPJMESA-N	440.500	1.958	50	20	IDGD	
C=CCOc1ccc(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)cc1	728214480	PPRXJERSJGUVPA-UHFFFAOYSA-N	430.530	1.944	50	20	IDGD	
Cc1nn2c(nc(N3CCCC3)c3ccccc32)c1C=NNC(=O)[C@@H](C)NS(C)(=O)=O	728434710	PDNIQCLJUWGKRV-CQSZACIVSA-N	443.533	1.179	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1CNC(=O)NNC(=O)c1cccc(C#N)c1	728950217	GQFBMWIDEOVEKX-UHFFFAOYSA-N	429.502	1.779	50	20	IDGD	
O=C(Cn1[nH]cc2c(=O)ncnc1-2)NNC(=O)c1cc(-c2ccco2)nc2ccccc12	730517398	WGRGFHQPVSKIMK-UHFFFAOYSA-N	429.396	1.341	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)/C(=C/c1ccco1)n1nnnc1-c1ccccc1	730778262	MAGHPYVYCNZUOJ-LGMDPLHJSA-N	446.423	1.863	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)COc1ccccc1O)n1nnc(-c2ccc(Cl)cc2)n1	730782612	QISLRYQBGGBSDI-CQSZACIVSA-N	430.852	1.877	50	20	IDGD	
Cc1ccc(-c2nnc(S)n2CCC(=O)NNC(=O)COc2ccccc2O)cc1	730782948	YJEZOIAPMYRCEG-UHFFFAOYSA-N	427.486	1.864	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNS(=O)(=O)c1ccc(Oc2cccc(Cl)c2)cc1	731177032	BCRUDAXKWYGRLJ-LLVKDONJSA-N	447.922	1.380	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)c1nn(-c2ccc(F)cc2)ccc1=O	731571380	RXZULQCCTNKUAF-UHFFFAOYSA-N	426.404	1.610	50	20	IDGD	
O=C(Cn1cnc2ccccc21)NNC(=O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1	732051080	UDLOAXQRINEWGQ-AWEZNQCLSA-N	442.457	1.458	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])o1	732054949	OMQSQHPYKFNZKM-GFCCVEGCSA-N	436.808	1.916	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cc(C(=O)NNC(=O)c3c[nH]nc3C)ccc2C)cc1	732084465	JCKMLKLOZMBNBN-UHFFFAOYSA-N	443.485	1.911	50	20	IDGD	
CCCCn1c(=O)nc(O)c2c1nc(CCC(=O)NNC(=O)C1CCC1)n2CC(C)C	732141830	RAAJEGLCUFXMJH-UHFFFAOYSA-N	432.525	1.635	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)Cc1nc2ccccc2n1C)N1CCN(c2ccc(F)cc2)CC1	732260423	SWHGONHVKYWICT-INIZCTEOSA-N	438.507	1.613	50	20	IDGD	
CCOc1ccccc1C(=O)N1CCC[C@@H]1C(=O)NNC(=O)CCN1C[C@H](C)O[C@H](C)C1	732261357	CFKHUKLZCXKDOM-ZIFCJYIRSA-N	446.548	1.337	50	20	IDGD	
CC(C)N(C)S(=O)(=O)c1ccc(C(=O)NNc2ccccc2S(C)(=O)=O)cc1	732304704	YROOZSYSVKNYQH-UHFFFAOYSA-N	425.532	1.876	50	20	IDGD	
O=C(NNC(=O)[C@@H]1C[C@@H]1c1ccc(OCc2ccccc2)cc1)N[C@H]1CCS(=O)(=O)C1	732554147	ZGBVTCVQAOHCDB-DFQSSKMNSA-N	443.525	1.887	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)Oc1ccccc1	733849133	DTSVIQXPFUAWQD-INIZCTEOSA-N	446.529	1.883	50	20	IDGD	
Cc1nc(S(=O)(=O)N2CCC(C(=O)NNc3cc(F)c(F)cc3F)CC2)cn1C	734552356	UCPBEUNBNSMGLO-UHFFFAOYSA-N	431.440	1.690	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N2CCS(=O)(=O)[C@H](C)[C@@H]2C)cc1Br	736387425	QALYQTXIKJMNQT-VHSXEESVSA-N	434.312	1.320	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)Cn1cnc2ccc(Br)cc2c1=O	737636201	DHGBQQBYWAPBLQ-UHFFFAOYSA-N	445.273	1.523	50	20	IDGD	
CCCCSCCC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	739471206	HPYXOJYXJQEPDU-UHFFFAOYSA-N	429.564	1.392	50	20	IDGD	
O=C(CCS(=O)(=O)c1ccc2c(c1)OCCCO2)NNC(=O)NC1CCCCC1	741207736	YXORAJMXVLVZFG-UHFFFAOYSA-N	425.507	1.675	50	20	IDGD	
CC(C)C(=O)N(C)Cc1ccc(C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1	741659905	GMDLQWGNIFUKQI-UHFFFAOYSA-N	435.484	1.623	50	20	IDGD	
O=C(CCNc1ncc(C(F)(F)F)cc1Cl)NNC(=O)[C@H]1CCS(=O)(=O)C1	742037378	ZITWGALSEGSCLR-QMMMGPOBSA-N	428.820	1.138	50	20	IDGD	
C[C@H](C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1)n1nnc(-c2ccccc2)n1	742618480	JAJNVEWWRGTXKK-CYBMUJFWSA-N	427.490	1.485	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)[C@H](C)Oc2cccc(Br)c2)C[C@@H](C)O1	743290692	IXBCBSNFFLAMFO-MJBXVCDLSA-N	428.327	1.863	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)N[C@@H]3CCCN(c4ccn(C)n4)C3=O)cc2C1	743512894	ZTRGFLYIDFHWHE-TZMCWYRMSA-N	430.534	1.746	50	20	IDGD	
CN(C1CCN(C(=O)NNC(=O)c2cccc(Br)c2)CC1)S(C)(=O)=O	743686420	LNDQNNYEBVGCFB-UHFFFAOYSA-N	433.328	1.159	50	20	IDGD	
CCCS(=O)(=O)NC1CCN(C(=O)NNC(=O)c2cccc(Br)c2)CC1	743686719	FSNIESUDEIWXBR-UHFFFAOYSA-N	447.355	1.597	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)c2cc(S(=O)(=O)N(C)C)c[nH]2)cc1Cl	743834268	XZRUBEJXHQQRPG-UHFFFAOYSA-N	445.885	1.402	50	20	IDGD	
CCOC(=O)c1ccc(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)nc1C	744619492	QVQLBCRFPXCYOI-UHFFFAOYSA-N	448.501	1.345	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)CCNC(=O)c2ccc3ccccc3c2)cc1	744676677	ALFHTHSEDAEUBH-UHFFFAOYSA-N	444.447	1.836	50	20	IDGD	
Cc1noc(C)c1S(=O)(=O)NC1(C(=O)NNC(=O)NC2CCCCC2)CCCC1	746094370	HTXIHBXGYLXBSX-UHFFFAOYSA-N	427.527	1.546	50	20	IDGD	
CS(=O)(=O)c1ccc(OCCC(=O)NNC(=S)NCCc2cccs2)cc1	746516183	FEIGARBUPUIVBF-UHFFFAOYSA-N	427.573	1.659	50	20	IDGD	
Cc1[nH]nc(C(F)(F)F)c1C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	746618041	XYWNZYGGHVXNCQ-UHFFFAOYSA-N	433.412	1.515	50	20	IDGD	
CCc1cccc(NC(=O)CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)c1	748328364	KWTGMWNWLLHTAG-UHFFFAOYSA-N	432.506	1.125	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3ccc4nccnc4c3)cc2)CC1	748618209	AVIVFMXQTUGQRY-UHFFFAOYSA-N	426.502	1.323	50	20	IDGD	
O=C(NCC(=O)N1CCN(c2ccccc2)CC1)NNC(=O)c1cc(Br)c[nH]1	749221617	RTDATNXBCNRJEK-UHFFFAOYSA-N	449.309	1.070	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1)N1CCSCC1	750913968	IBODSLSNTRURRD-INIZCTEOSA-N	440.013	1.042	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)NCc1nccn1CCc1ccccc1	751809556	HNAFTQCURXLOIS-UHFFFAOYSA-N	438.444	1.943	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)c1nc(Cc2ccccc2)no1	753035852	CBUNHNNUDMJPBO-ZDUSSCGKSA-N	443.485	1.769	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)N[C@H]1CCCN(Cc2ccccn2)C1=O	753297402	IFUOASWSNSSEDC-KDOFPFPSSA-N	429.452	1.510	50	20	IDGD	
C[C@H](CCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)N1CCCCC1	753411842	UMIVQKZQTZCLES-OAHLLOKOSA-N	425.555	1.145	50	20	IDGD	
CCNC(=O)C1(CNC(=O)NNc2ccc(S(=O)(=O)N(CC)CC)cn2)CCC1	753747303	YQDLMLZSPMRHAH-UHFFFAOYSA-N	426.543	1.045	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCOC[C@@H]2C[C@@H](O)c2cccs2)cc1OC	753867207	JRWOLSXZFPTGNS-JKSUJKDBSA-N	449.529	1.351	50	20	IDGD	
Cc1ccc(CNC(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)c(N2CCOCC2)c1	753947370	QIDOXLAGZDRBOB-UHFFFAOYSA-N	429.433	1.590	50	20	IDGD	
C[C@@H]1CC(=NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)CN1C1CC1	753955097	KJUNYGTXRAEEJQ-MRXNPFEDSA-N	434.562	1.369	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)[C@H]2CCCCS2(=O)=O)c2ccccc2c1=O	753981740	RQVGKOOQGJTNLM-MRXNPFEDSA-N	434.518	1.315	50	20	IDGD	
COC[C@](C)(O)C(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2Cl)c1	754973437	HEMBCWJPSGKJRD-SFHVURJKSA-N	441.893	1.299	50	20	IDGD	
CCOc1ccc(NC(=O)NNC(=O)c2cnccn2)cc1S(=O)(=O)N1CCCC1	755468711	AQXWXETVASINDL-UHFFFAOYSA-N	434.478	1.126	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)Nc1ccc(S(=O)(=O)c2ccc(F)cc2)cc1	756073607	QDOCLYALGJXQRH-CYBMUJFWSA-N	439.465	1.863	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)Nc2cccc(C(=O)N3CCSCC3)c2)cc1	756273386	CHJZIKZIPKGCIW-UHFFFAOYSA-N	439.497	1.979	50	20	IDGD	
O=C(COC(=O)c1c[nH]nc1-c1ccccc1F)NNC(=O)[C@H]1COc2ccccc2O1	756607674	PHJYCVOOPFMSKD-QGZVFWFLSA-N	440.387	1.360	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)Nc1ccc(O[C@@H]2CCOC2)cc1	756681544	LHLUIZXFKUNDKY-GOSISDBHSA-N	426.477	1.714	50	20	IDGD	
CC(C)c1noc2nc(-c3ccco3)cc(C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)c12	758035150	JYXVIHLQVHZUHD-SNVBAGLBSA-N	435.462	1.305	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)[C@@]1(Cc2ccc(Cl)cc2)C[C@H]2CC[C@H]1C2	758048801	WSJJIERWNRIULZ-XPVILTJLSA-N	427.954	1.774	50	20	IDGD	
CCOC(=O)N1[C@H](C(=O)NNC(=O)C(=O)Nc2ccccn2)CC[C@H]1c1ccc(C)o1	758832675	IHHFGFBUOCKOMM-KBPBESRZSA-N	429.433	1.431	50	20	IDGD	
C[C@]1(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)CCCS1	758861216	KWNZCUVTMTWFMY-GOSISDBHSA-N	426.564	1.701	50	20	IDGD	
CO[C@@](C)(C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1)c1ccccc1F	760066257	LRKBLUAZEIPVFT-QGZVFWFLSA-N	429.857	1.449	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)CN[C@@H](c2ccccc2)C(F)(F)F)cc1	761452759	TYMAAKCRZUFNPJ-SFHVURJKSA-N	434.374	1.756	50	20	IDGD	
CC(=O)N(CCc1ccccc1)CC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	761478726	WAWCLOPHLLVTHY-UHFFFAOYSA-N	432.502	1.334	50	20	IDGD	
Cc1cc(N2CCOCC2)ccc1NC(=O)C(=O)NNC(=O)c1c(C)nc2ccccn12	763630070	WCNVFGWZWJTNPR-UHFFFAOYSA-N	436.472	1.187	50	20	IDGD	
COc1c(NC(=O)C(=O)NNC(=O)CSc2ccc(Cl)cc2)cccc1C(N)=O	763737418	YHOFXBDAWPGWDC-UHFFFAOYSA-N	436.877	1.326	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)C(=O)Nc2cnc3c(c2)CCCC3)c2ccccc2c1=O	763790656	MNNBNVURSGEMNB-UHFFFAOYSA-N	448.483	1.651	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)C(=O)Nc2c(CC)noc2C)c2ccccc2c1=O	763801025	ASMKJOPIKFPDET-UHFFFAOYSA-N	440.460	1.455	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(OC[C@H]3CCCO3)cc2)cc1	763808943	HYNDTKPWBAOSHI-LJQANCHMSA-N	427.457	1.718	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)ccc1C(=O)NC(C)C	763839073	FDHJLPSJBDZQIU-UHFFFAOYSA-N	430.436	1.437	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)cc1	763859483	CGSRZTAYYNIIFM-LBPRGKRZSA-N	446.416	1.556	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(COc3ccccc3)o2)c(OC)n1	763955223	KGBPTXCWYAJKKO-UHFFFAOYSA-N	440.412	1.671	50	20	IDGD	
O=C(NNC(=O)c1ccc(COc2ccccc2)o1)C(=O)Nc1ccc(-n2ccnn2)cc1	763956290	YVBVPAMRMZYPNQ-UHFFFAOYSA-N	446.423	1.839	50	20	IDGD	
O=C(NNC(=O)c1cc2c(s1)CCCCC2)C(=O)Nc1ccc2c(c1)C(=O)NCC2	763968570	RDKCJVSXULQADG-UHFFFAOYSA-N	426.498	1.703	50	20	IDGD	
COCCn1nc(C)c(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)on2)c1C	764010921	FFEUCSFABUURNF-UHFFFAOYSA-N	426.433	1.201	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1cccc(NC(=O)C(=O)NNC(=O)Cc2ccsc2)c1	764024231	CELWVLVYLSBXFH-UHFFFAOYSA-N	438.531	1.154	50	20	IDGD	
CCCCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccsc2)cc1	764034830	WCPKIZZYCLRLMP-UHFFFAOYSA-N	438.531	1.619	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2cccc(SC(F)F)c2)c1	764077971	PIPMJZAWUOIDII-UHFFFAOYSA-N	443.453	1.805	50	20	IDGD	
N#Cc1c(F)cccc1-n1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)nc2)n1	764093349	UMSBWDYQYZQUPE-UHFFFAOYSA-N	427.783	1.331	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2ccc(C(=O)N(C)C)c(C)c2)cc1	764124468	ICQPUVRUTAQUJP-UHFFFAOYSA-N	426.473	1.424	50	20	IDGD	
COC(=O)C(C)(C)c1ccc(NC(=O)C(=O)NNC(=O)c2cccc(OC)c2O)cc1	764131520	HXZMWCIAXYOSAJ-UHFFFAOYSA-N	429.429	1.251	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)NCC(C)C)cc2)c1O	764131554	IETNUIWWLRAXBJ-UHFFFAOYSA-N	428.445	1.186	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C)c(NC(C)=O)c2)o1	764139698	YZCQKKGRRLUYIW-UHFFFAOYSA-N	429.477	1.788	50	20	IDGD	
Cc1cnn(Cc2cc(F)ccc2F)c1NC(=O)C(=O)NNC(=O)c1ccc(C#N)cc1	764176871	IBBAOKRRRQZLDP-UHFFFAOYSA-N	438.394	1.789	50	20	IDGD	
N#Cc1c(F)cccc1-n1ccc(NC(=O)C(=O)NNC(=O)CCCc2ccccc2)n1	764226950	UZPMHCBILAISFG-UHFFFAOYSA-N	434.431	1.992	50	20	IDGD	
CCn1nnnc1-c1cccc(NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)c1	764239048	BXCSQKOQQDYZJC-UHFFFAOYSA-N	432.444	1.101	50	20	IDGD	
CC(=O)Nc1cc(NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)c(F)cc1F	764377876	RLTBRWZDFXMYKF-UHFFFAOYSA-N	448.411	1.775	50	20	IDGD	
Cc1ccc(-c2nnco2)cc1NC(=O)C(=O)NNC(=O)c1cc(-c2cccs2)[nH]n1	764381905	BRJJMGZAHKPPMX-UHFFFAOYSA-N	437.441	1.896	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)CCC(=O)N2CCN(c3ncccn3)CC2)cc1	764565238	AMFIUQYQNHLPAY-UHFFFAOYSA-N	442.545	1.154	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)NCc1ccc(C(=O)N2CCOCC2)cc1	765641219	NGRHQDNSQXPNQK-UHFFFAOYSA-N	432.502	1.389	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)N[C@@H](c2ccc(Cl)cc2)[C@@H]2CN(C)CCO2)n1	766320649	QOKXJMKQQOWGTO-HKUYNNGSSA-N	434.928	1.556	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)CSc1nnnn1-c1ccc2c(c1)OCO2	768396776	JIQVHIPCMWEDRQ-UHFFFAOYSA-N	426.458	1.182	50	20	IDGD	
COc1ccc(C(=O)NNc2nc3ccccc3[nH]2)cc1S(=O)(=O)N1CCOCC1	768503315	CHVBCFHXNPCCCN-UHFFFAOYSA-N	431.474	1.349	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2n[nH]c(C)c2Br)cc1OC	768616376	DDLRRXGIGMUGAL-UHFFFAOYSA-N	441.238	1.116	50	20	IDGD	
CNC(=O)C1CN(C(=O)/C(C#N)=C\c2cn(CCC(N)=O)nc2-c2ccc(Cl)cc2)C1	768651181	KKADWQDOEFWBBZ-ZSOIEALJSA-N	440.891	1.190	50	20	IDGD	
CC1(C)C(=O)Nc2ccc(C(=O)OCC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)cc21	768701966	OZRYJCHMNIIZGC-UHFFFAOYSA-N	426.385	1.443	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)NC1CCN([C@@H]2CCCC[C@H]2O)CC1	769158848	ATVSKZBAPXFZLV-QZTJIDSGSA-N	434.537	1.562	50	20	IDGD	
CN(C)C(=O)COc1ccc(C(F)(F)C(=O)NNc2cccc(S(C)(=O)=O)c2)cc1	769619838	NUSSXXSHWAFKHZ-UHFFFAOYSA-N	441.456	1.792	50	20	IDGD	
C[C@H](CBr)CN1CCN(S(=O)(=O)c2ccc3c(c2)NC(=O)CO3)CC1	770667712	SEUWZHABERKVFV-GFCCVEGCSA-N	432.340	1.355	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)/C(=C/c3cccnc3)NC(=O)c3ccccc3)nc21	770973225	CGBWOAGULQKBQF-YBEGLDIGSA-N	430.428	1.378	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)N1CCO[C@@H](CN2C(=O)c3ccccc3C2=O)C1	771215709	IMMPYDGQUGKIHN-CQSZACIVSA-N	438.440	1.047	50	20	IDGD	
Cn1cc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c(-c2ccccc2)n1	772166412	UVMKBGLGFRUZQV-GOSISDBHSA-N	436.424	1.231	50	20	IDGD	
CN(NC(=O)Cn1ncc2ccccc2c1=O)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776213931	RNNARYAKBIQBMZ-UHFFFAOYSA-N	444.492	1.032	50	20	IDGD	
O=C(NNC(=O)c1ccc(Br)s1)N[C@@H](CO)C[C@@H](O)c1ccccc1	778590613	MYECFDYUAUKEIW-VXGBXAGGSA-N	428.308	1.939	50	20	IDGD	
O=C(NNC(=O)C(=O)N1CCCC1)N[C@@H]1CCN(c2ccc(Cl)c(Cl)c2)C1=O	779379775	IPNJFZDYCBWBGL-CYBMUJFWSA-N	428.276	1.052	50	20	IDGD	
Cn1cc(-c2nn(C)cc2C(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)cn1	780725571	ARFUEULQGFWUFX-UHFFFAOYSA-N	446.512	1.164	50	20	IDGD	
O=C1CN(CCNC(=O)NNC(=O)c2ccc(COc3ccc(Cl)cc3)cc2)CCN1	781406677	QXVYBTSQLCYNSA-UHFFFAOYSA-N	445.907	1.295	50	20	IDGD	
O=C(NNc1ncncc1Cl)C(=O)Nc1cccc(F)c1I	782158631	GMTQLDSYTPYDCW-UHFFFAOYSA-N	435.584	1.956	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)N[C@@H]1CCC[C@H](NC(=O)OC(C)(C)C)C1	782647240	CQRJVWDXLJDUKK-OLZOCXBDSA-N	429.518	1.677	50	20	IDGD	
CC(C)C[C@H](C)n1nccc1NC(=O)C(=O)NNC(=O)Cc1nc2ccccc2n1C	782887069	NZWRVKOUGCKONK-AWEZNQCLSA-N	425.493	1.706	50	20	IDGD	
CN(C)C(=O)CNC(=O)c1ccc(NC(=O)C(=O)NNc2cccc(F)c2)cc1Cl	783037187	KKTXZJNYCPEKCB-UHFFFAOYSA-N	435.843	1.379	50	20	IDGD	
CCCOc1ccccc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)NC(C)C)cn1	783262359	CVUNPNYDEPMJFN-UHFFFAOYSA-N	435.506	1.639	50	20	IDGD	
Cc1c(COC(C)(C)C)cccc1NC(=O)C(=O)NNC(=O)CNC(=O)c1cccs1	784003874	QTXIVCSHHSINCF-UHFFFAOYSA-N	446.529	1.888	50	20	IDGD	
O=C(COC(=O)c1cccc(C(=O)NC2CC2)c1)NNC(=O)c1cccc([N+](=O)[O-])c1	784260565	BHROBFHXBDRKSA-UHFFFAOYSA-N	426.385	1.105	50	20	IDGD	
O=C(NNc1ccc(Cl)nn1)C(=O)Nc1ccnn1Cc1cnn(-c2ccccc2)c1	784788995	BYIHJNWJTVEXLB-UHFFFAOYSA-N	437.851	1.642	50	20	IDGD	
COC(=O)[C@H]1CN(C(=O)C(=O)NNc2ccc(OC(F)(F)F)cc2)c2ccccc2O1	784804140	VNAARGDHSMSYCZ-OAHLLOKOSA-N	439.346	1.996	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1cccnc1Cl	784832660	CNRAYMLJLUANOT-UHFFFAOYSA-N	425.898	1.894	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)C(=O)Nc2ccc(-n3cncn3)c(Cl)c2)c1	784841468	RHRAJVYUSZTLOZ-UHFFFAOYSA-N	434.865	1.406	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2c[nH]nc2-c2ccc3c(c2)OCO3)c2ccccc2c1=O	785013171	FVSFCPMPKKJIKY-UHFFFAOYSA-N	446.423	1.610	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)Cc2cc(OC)c(O)c(OC)c2)c2ccccc2c1=O	789868584	JXNGPZLGIRSGRY-UHFFFAOYSA-N	440.456	1.533	50	20	IDGD	
CC[C@@H](C)n1ncc(NC(=O)C(=O)NNC(=O)c2nn(CC)c(=O)c3ccccc23)c1C	792269247	VQDDNVWKSBAPMY-GFCCVEGCSA-N	439.476	1.292	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NN=Cc1c(Br)n[nH]c1Br	792997204	WZPWHICCHZYDPN-UHFFFAOYSA-N	435.101	1.876	50	20	IDGD	
CC(C)(C)c1ccc(OCC(=O)NNC(=O)C(=O)Nc2cnc(CC3CC3)nc2)cc1	793023725	UWZGGPQZEGZBAF-UHFFFAOYSA-N	425.489	1.892	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN[C@H]2[C@H](C)N(C(=O)OC(C)(C)C)CC[C@H]2C)n1	796649847	IQBLEQMDFYDCKF-UVBSCNOISA-N	439.582	1.765	50	20	IDGD	
O=C(/C=C\c1ccccc1)NCCCNC(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	800069636	AAAQKIGBMVOWEW-SEYXRHQNSA-N	448.483	1.742	50	20	IDGD	
Cc1c(C(=O)NNC(=O)CCN2C[C@@H](C)O[C@H](C)C2)nnn1CCOc1ccc(F)cc1	800688278	SGSNIJHMHOGUKL-HUUCEWRRSA-N	448.499	1.065	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)cc1	801109345	KEMLXLOIWWEXAH-ZDUSSCGKSA-N	445.457	1.355	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(I)c2O)cc1	801110081	NUAPJGKLGXKFBL-UHFFFAOYSA-N	439.209	1.705	50	20	IDGD	
C[C@@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)NNC(=O)Nc2cc(F)cc(F)c2)C1=O	802005486	JVTFYSFMIGIFDN-IBGZPJMESA-N	435.362	1.724	50	20	IDGD	
CC(=O)NC[C@H]1CCn2ncc(C(=O)NNC(=O)Nc3ccc(OC(F)F)cc3)c2C1	802046450	CHMSYRLXZDRLNY-LBPRGKRZSA-N	436.419	1.650	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)CN2C(=O)Cn3c(cc4ccccc43)C2=O)cc1	802121744	NUVSLVLMQOGSGQ-UHFFFAOYSA-N	434.456	1.543	50	20	IDGD	
Cc1ccc2c(c1)nc(CNC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)n2C	802321659	HMQSMFNTCMSRKP-UHFFFAOYSA-N	430.490	1.821	50	20	IDGD	
CC(C)(C)C(=O)NNC(=O)CN1CCCN(S(=O)(=O)c2cccc3cnccc23)CC1	805748052	LKKODMDEEGHOKX-UHFFFAOYSA-N	447.561	1.125	50	20	IDGD	
CN1CCOc2ccc(C(=O)NNC(=O)c3cccc(S(=O)(=O)N4CCCC4)c3)cc21	806307226	ZPDWVRNHURVAOW-UHFFFAOYSA-N	444.513	1.375	50	20	IDGD	
Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)NNC(=O)CCN1C[C@@H](C)O[C@H](C)C1	806338813	AFRURPTZJFHLDN-GHMZBOCLSA-N	443.298	1.926	50	20	IDGD	
CN(C)[C@H](CNC(=O)NNC(=O)c1csc(N2CCOCC2)n1)c1cccc(F)c1	807005871	HGVCPHLWRTZMKB-MRXNPFEDSA-N	436.513	1.366	50	20	IDGD	
Cc1ccc([C@@H](CNC(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)N2CCOCC2)o1	807023248	GRWWNCCVUVSJSV-MAUKXSAKSA-N	434.468	1.898	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1nc(-c2ccco2)cs1	807026977	JOTOEASRGMCWLK-UHFFFAOYSA-N	436.471	1.897	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)C(=O)Nc1ccc(F)cc1OCC(F)(F)F	807428639	GSSFGQLZTIJIJM-UHFFFAOYSA-N	439.329	1.824	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@H](C)c2c(F)cncc2F)cc1	807556868	RJHAQOQZINDROX-GFCCVEGCSA-N	441.460	1.380	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)NCc2ccccc2S(N)(=O)=O)cc1	807604920	GLQJVYRAVPWVHS-CYBMUJFWSA-N	436.490	1.031	50	20	IDGD	
C[C@@H]1[C@H](NC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])CCN1Cc1ccccc1	807621774	JYAYMDWBJKTBOS-NVXWUHKLSA-N	427.461	1.967	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)N1CCN([C@@H]2CCN(C(=O)OC(C)(C)C)C2)CC1	808769876	DONPPBYXSMOYSX-DLBZAZTESA-N	425.574	1.195	50	20	IDGD	
CC[C@H]1[C@H](C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)CCN1C(=O)OC(C)(C)C	810107064	VLFPHHMFDLIOFN-CVEARBPZSA-N	439.534	1.887	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(Br)s1)NNc1ccc(Cl)nc1	810460790	CPFWTBPHCQVYSF-UHFFFAOYSA-N	425.717	1.981	50	20	IDGD	
N#Cc1ccc(S(=O)(=O)NCC(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)cc1	810563236	AGKMXTFMASRAMA-UHFFFAOYSA-N	449.439	1.150	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(=NNC(=O)CNC(=O)c2ccco2)[C@H]([C@@H]2CCOC2)C1	812227250	WHQGXUPFEIOCKU-CABCVRRESA-N	434.493	1.775	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N1CC[C@@H](CS(C)(=O)=O)C1	814271480	MXYAZGDQIMDMKZ-VXGBXAGGSA-N	448.339	1.324	50	20	IDGD	
CCOC(=O)c1cnn(-c2ccc(C(=O)N3CC[C@H](B(O)O)C3)cc2)c1C(F)(F)F	864231162	JKMITLOLGWIVJN-LBPRGKRZSA-N	425.172	1.757	50	20	IDGD	
Cc1cc([N+](=O)[O-])c(C)c(S(=O)(=O)Nc2ccccc2C(=O)N2CC[C@@H](B(O)O)C2)c1	864234639	YELHTZMYXZQMGT-CQSZACIVSA-N	447.278	1.701	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)CN2C(=O)[C@@H]3CCCC[C@H]3C2=O)cc1OC	913069657	ZPLAKEJWCSKJCA-HZPDHXFCSA-N	431.489	1.810	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCC(=O)NNC(=O)CSc2ccc(Cl)cc2)cc1	913496536	OSFCZENSAYKHMG-UHFFFAOYSA-N	427.935	1.866	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)CSc2cccc[n+]2[O-])c2ccccc2c1=O	914333586	ICDRDOMTPFQPFV-UHFFFAOYSA-N	441.513	1.773	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)[C@@H](Cc2cccc(F)c2)n2nnnc2C)c1	915695237	FIHJJLHXXLKWOU-GOSISDBHSA-N	426.452	1.748	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)NCCCN2CCOCC2)c2ccccc2c1=O	915880571	NFXAPPSEDKYQOU-UHFFFAOYSA-N	444.536	1.253	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)NC[C@@H](c1cccs1)N1CCOCC1	915893357	IPLQPIYSGTUBEU-HNNXBMFYSA-N	449.489	1.439	50	20	IDGD	
O=C(NCCc1cccc(F)c1)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	916201568	STMPHVNHLRGNMQ-UHFFFAOYSA-N	434.493	1.797	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NC[C@@H](c1ccccc1)N1CCOCC1	916509523	QUCIMHRYBZFLAD-UZLBHIALSA-N	430.480	1.997	50	20	IDGD	
COc1ccc(C)cc1CNC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	916601085	KJJJLYPEBDNOOC-UHFFFAOYSA-N	448.549	1.161	50	20	IDGD	
C[C@@H](Cn1ccnc1)NC(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	916623222	KPZTZWCAKDGTIW-INIZCTEOSA-N	445.483	1.674	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NCCOc2ccc(C(F)(F)F)cc2)c2ccccc2c1=O	916650916	WMVLJPVBFYENBX-UHFFFAOYSA-N	449.389	1.975	50	20	IDGD	
CCN(CC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)c1ccccc1	917496789	NZZMPYSSERQNRI-UHFFFAOYSA-N	430.530	1.759	50	20	IDGD	
CCN1C(=O)c2ccc(C(=O)NNC(=O)[C@H](C)Oc3cccc(C)c3C)cc2S1(=O)=O	917520071	UOFJCFGMTIHKGC-AWEZNQCLSA-N	445.497	1.696	50	20	IDGD	
CN(CC(=O)N([C@H]1CCS(=O)(=O)C1)N(C)C)C(=O)c1ccc(Br)s1	917621919	KSODXVSXMGTTAA-JTQLQIEISA-N	438.369	1.075	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2cc(C)on2)c1	919819957	BKPMBIJAAZDSKJ-UHFFFAOYSA-N	444.469	1.796	50	20	IDGD	
COCCCNC(=O)NNC(=O)CNC(=O)OCC1c2ccccc2-c2ccccc21	920862435	DIEGHIHWDHSGKI-UHFFFAOYSA-N	426.473	1.892	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)CCn2cc([N+](=O)[O-])nc2C)c2ccccc2c1=O	920926367	YMMMVLHYVCFOTC-UHFFFAOYSA-N	427.421	1.071	50	20	IDGD	
CCOC(=O)c1c(S(=O)(=O)NNC(=O)NCc2cccc(C(F)(F)F)c2)n[nH]c1C	921298387	WLAKHYUBZUYAHZ-UHFFFAOYSA-N	449.411	1.606	50	20	IDGD	
CCOc1ccc(N2CCN(CC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)CC2)cc1	1116415917	OZCBXSNQUOSRRA-UHFFFAOYSA-N	427.461	1.577	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)NCCNC(=O)c1ccccc1C(F)(F)F	1317870886	FHUQPGPOTOVCQT-UHFFFAOYSA-N	449.389	1.716	50	20	IDGD	
COC(=O)c1ccc(Br)c(S(=O)(=O)NNC(=O)c2ccc(OC)cc2)c1	1323442247	STMVXPGJIQIXKG-UHFFFAOYSA-N	443.275	1.868	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)Cc2ccc(C(=O)NNC(=O)[C@@]3(F)CCOC3)cc2)cc1	1324062821	TXSMDYDHQVHNLW-OAQYLSRUSA-N	449.504	1.705	50	20	IDGD	
COc1ccc(-c2cc(NC(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)ccc2OC)cc1	1325338671	JOOIAZVCRWIUOZ-AWEZNQCLSA-N	433.486	1.958	50	20	IDGD	
CN(C)[C@H]1CCCC[C@@H]1NC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	1327831555	IJAKCAAAXTXNDZ-ROUUACIJSA-N	437.566	1.288	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)[C@@H]1CC(=O)N(c2ccc(C#N)cc2)C1	1337953384	XXGUUJRRSJNQAE-MRXNPFEDSA-N	430.468	1.671	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ncccc3Br)C2)C1	1779652435	CSXNBQPNKAKFOI-SUMWQHHRSA-N	446.729	1.541	50	20	IDGD	
C[C@@H](C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(C)(C)CCl)C2)N1CCN(C)CC1	1780636879	PVYLAHMFAOGJRZ-NJNPRVFISA-N	443.032	1.401	50	20	IDGD	
NC[C@H](C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1)c1ccccc1	1781331359	PAOHLWQATCLCLM-RLFYNMQTSA-N	428.302	1.249	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](F)Br)C3)C2)c(OC)c1	1781335226	VQKHFLHGDWEPGG-MAUKXSAKSA-N	445.285	1.838	50	20	IDGD	
COc1ccccc1CC(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781335381	XVFZNQDEOTWTSX-WMZOPIPTSA-N	429.286	1.758	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccccc3C(N)=O)C2)C1	1781761172	YZAKYCMTSYEBBR-OALUTQOASA-N	428.316	1.465	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)Br)C1	1782002938	XUNRMXOPVUKCEC-OQMKEHIESA-N	425.751	1.538	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnn4cccc(F)c34)C2)C1	1782552333	WOKLAIRIDOFNNQ-KPZWWZAWSA-N	439.285	1.700	50	20	IDGD	
C[C@H](C(=O)N1CC[C@@]2(CN(C(=O)C(Cl)Cl)CCO2)C1)[S@](=O)c1ccccc1	1782685221	FQCFITJGFGPRMO-HEVVRDHBSA-N	433.357	1.816	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](O)Cc3ccccc3)C2)C1	1783335830	CTPFGXYTPKCKMR-WRWLIDTKSA-N	439.350	1.451	50	20	IDGD	
CNc1nsnc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)CBr)C[C@@H]21	1783518877	CWGSGGDYAWHRJP-RHYQMDGZSA-N	446.371	1.204	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cnn(-c4cccnc4)c3)CCO2)C1	1783533291	YWXLHYWTRDFKNO-KUHUBIRLSA-N	448.321	1.494	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ncn(-c4ccccc4)n3)CCO2)C1	1783534196	GKCYTQKRIBYTSZ-AUUYWEPGSA-N	448.321	1.494	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)Cc3c(F)ccc(F)c3F)CCO2)C1	1783871030	LVSMFHRSRUQAGL-ORAYPTAESA-N	434.842	1.730	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3cnc[nH]3)C[C@@H]21	1783969056	IKIDDRHJMGIVNQ-VRKREXBASA-N	427.343	1.353	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)Nc3cccnc3)[C@H]2C1	1786866453	WXEYZPFMGFTQRV-AUOOEQCUSA-N	439.354	1.645	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)[C@H]1CNc2ccccc21	1786876733	GBNVXIUXDRHMLT-MBGYTDRXSA-N	436.350	1.960	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4c(c3)CC(=O)N4)[C@H]2C1	1788263815	XAVUIKCIKSPOJP-MBGYTDRXSA-N	435.908	1.028	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21)c1ccc([N+](=O)[O-])c2c1OCO2	1789288168	JPHMHLURQXXQDT-ZMZMUDBPSA-N	443.815	1.451	50	20	IDGD	
Cc1nc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]3C2)ccc1F	1789922252	IZHAYLNCOOYHAM-LWWSYDQCSA-N	432.265	1.813	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CNc4ccccc43)C[C@@H]21	1791057514	FAJACTOWGPRGAI-LHAWGNPOSA-N	436.350	1.959	50	20	IDGD	
CC(C)c1nn2ccccc2c1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](O)CCl	1792977361	UDJWMONOFMRJDH-MVWRLGRASA-N	434.924	1.261	50	20	IDGD	
COc1cc(N2CCC(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)[C@@H](F)Cl)C4)CC2)ncn1	1793307555	NTZXLTYSBVEWMF-BASYENTBSA-N	439.919	1.874	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CC1CCCC1	1795031565	FIYDDHWPCAESGC-NAMOIKSGSA-N	429.521	1.290	50	20	IDGD	
COc1ccc(C(=O)CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Cl)C3)cc1	1795136897	XVBGIULZJZUMOY-GTYSZEQSSA-N	426.872	1.782	50	20	IDGD	
CC(C)(C)OC(=O)N(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Cl)C1CC1	1796360854	BSWILFCCNYAGPD-VZAMPYOESA-N	433.908	1.510	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H](CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Cl)C1	1796368045	BETZKWTZCOLZIP-QZLJAVCYSA-N	447.935	1.758	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc2ncncc2c1	1798128606	OEEQQRZWWOOUPK-BJWYYQGGSA-N	445.483	1.194	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1(c3ccc(O)cc3)CC1)C2	1798439572	JNBURDGFGFSYML-BJWYYQGGSA-N	449.511	1.374	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cccnc1Cl)C2)[C@@H](F)Br	1799344551	NQMOEEGNRQABMO-ZMJPVWNMSA-N	434.693	1.558	50	20	IDGD	
CCCCC[C@H](C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnccc1C(=O)NN)C2	1800562379	QCRBJBLOTYBREQ-GGXPGOJBSA-N	431.537	1.105	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnn(Cc3ccccc3)c1)C2	1800976672	BLMBHKFYUFFSQM-YRPNKDGESA-N	446.935	1.388	50	20	IDGD	
C#CCCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1802017956	RPQPYVJXAZQKMW-IVSAIRAKSA-N	427.929	1.122	50	20	IDGD	
Cc1ccc(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)o1	1803778538	BYAFDVOMCUWVDA-RXVVDRJESA-N	433.273	1.296	50	20	IDGD	
CS(=O)(=O)c1ccc(Cl)c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](O)CCl)C3)c1	1803978456	BWIIOXGPUAJERS-AZKPJATDSA-N	449.356	1.595	50	20	IDGD	
C#CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](Cl)COC)C2	1804376055	HVQFPKRGXNQXRQ-QEOTZNIISA-N	441.956	1.795	50	20	IDGD	
O=C(c1cc(-c2ccncc2)[nH]n1)N1CCC2(CCCN(C(=O)[C@@H](O)CCl)C2)CC1	1805523106	OOKLZUHUFAJKFL-SFHVURJKSA-N	431.924	1.916	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)c2cccs2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1	1807369773	UTJKNHAOUDWYMJ-YLJYHZDGSA-N	435.314	1.456	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)C2(C#N)CC2)[C@@H]1c1cccnc1	1808415401	VQMMCPYZFZRAFO-WXBYGLBUSA-N	447.499	1.525	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)c1cnn2ccncc12	1809381216	MXGRCRZSYKJCOG-JCGIZDLHSA-N	428.880	1.044	50	20	IDGD	
N#CCc1ccc(C(=O)N2CCC3(CCCN(C(=O)c4ccc(B(O)O)cc4)C3)CC2)cc1	1809969369	GCILVKHKZFTICW-UHFFFAOYSA-N	445.328	1.591	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)[C@H]3CCc4ccccc43)CC2)C1	1809980202	LTQTXROCIILGGC-QHCPKHFHSA-N	446.356	1.941	50	20	IDGD	
O=C1NCCCn2nc(C(=O)N3CCC4(CCCN(C(=O)[C@H](F)Cl)C4)CC3)cc21	1810905689	NHRJVPMWWKCRJF-HNNXBMFYSA-N	425.892	1.396	50	20	IDGD	
Cc1cc(C(=O)N2CCCC3(CCN(C(=O)CCC(=O)NN(C)C)CC3)C2)cc(O)n1	1810931849	XXTIVQCTVZZLRM-UHFFFAOYSA-N	431.537	1.313	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@@H]1c1cccnc1)c1cc(CO)on1	1811590948	AJLXYBUFDRMOTR-GLQYFDAESA-N	441.257	1.572	50	20	IDGD	
CN1CCN(CC(=O)N2CC[C@@H](CNC(=O)C(Cl)Cl)[C@@H]2c2cccnc2)CC1	1813077201	DVPLPULXAVTGHJ-RDJZCZTQSA-N	428.364	1.139	50	20	IDGD	
Cc1cc(C)n2ncc(C(=O)N3CCCC[C@H]3c3cc(NC(=O)[C@@H](O)CCl)n[nH]3)c2n1	1814871693	VQIODEKZBONMQI-HOTGVXAUSA-N	445.911	1.975	50	20	IDGD	
Cc1cnc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)s1	1817473427	STONJNMPBPOQBZ-MRXNPFEDSA-N	439.306	1.474	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccncc2F)[nH]n1)c1cccc(B(O)O)c1	1817474828	IDWRNYMMCRPYCU-GOSISDBHSA-N	437.240	1.243	50	20	IDGD	
CC(C)O[C@H](C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819403599	WMEXKIXUILGAGR-DYVFJYSZSA-N	443.508	1.528	50	20	IDGD	
CC[C@@H](NC(N)=O)C(=O)N[C@@H]1CCc2nc(NC(=O)CO[Si](C)(C)C)sc2C1	1820165073	SSDFVLQHWSNWKL-GHMZBOCLSA-N	427.603	1.354	50	20	IDGD	
CN1CCN(C2(C(=O)Nc3cc([C@@H]4CCCCN4C(=O)C(Cl)Cl)[nH]n3)CC2)CC1	1820800841	BVPQMLOEABTMCY-AWEZNQCLSA-N	443.379	1.986	50	20	IDGD	
Cc1nc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)ccc1F	1822411035	XKGRKQSKQCQTAM-QGZVFWFLSA-N	445.499	1.931	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@]2(C)CC2(F)F)[nH]n1	1822417161	BJIOFGWRIUKOPQ-UGSOOPFHSA-N	426.468	1.820	50	20	IDGD	
COc1cnc(C(=O)N[C@@H]2CCc3nc(NC(=O)[C@H](F)Br)sc3C2)cn1	1823003129	IUBXFDXVZRTDCI-KRTXAFLBSA-N	444.286	1.858	50	20	IDGD	
Cc1ccc(C(=O)NCC(=O)Nc2cc([C@H]3CCCCN3C(=O)[C@@H](O)CCl)[nH]n2)cc1	1823510937	TVJHMWORMMYYJY-SJORKVTESA-N	447.923	1.740	50	20	IDGD	
C#CC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)CC2	1825020168	XTFXFVBPMZOEPM-LLVKDONJSA-N	428.426	1.836	50	20	IDGD	
Cc1ccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)cn1	1825818807	YYWJSYSQLIXQRY-HXUWFJFHSA-N	429.565	1.996	50	20	IDGD	
O=C(CCn1ccnn1)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](F)Br)CC2	1826878129	VDYHHHDACZMZKA-PELKAZGASA-N	431.291	1.427	50	20	IDGD	
CN[C@@H](CC(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCBr)CC1)C(=O)O	1826941153	NKJZZPIPPTUSLF-LSDHHAIUSA-N	432.359	1.454	50	20	IDGD	
CN[C@H](CC(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@](C)(Cl)CCl)CC1)C(=O)O	1826946805	ZTWFVDQRILSQLA-SPYBWZPUSA-N	436.380	1.905	50	20	IDGD	
CCn1ccc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)n1	1827050878	GQEZHSUJAHNMDG-NRFANRHFSA-N	438.337	1.130	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(Cl)cc3C)CCO2)C1	1830124570	MFAJKLNFMHZXHL-FXAWDEMLSA-N	445.343	1.972	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnn4cc(C)cnc34)C2)C1	1831651421	PJNKCRZVNVTOPL-LAUBAEHRSA-N	449.939	1.515	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)CNC(C)=O)CCO2	1831687333	LRTKIMTZVHOPAL-OXQOHEQNSA-N	431.961	1.013	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCc2cnn(C)c2)CC1	1831870701	CFYQPZKHTWFNPS-HXUWFJFHSA-N	446.596	1.345	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccnc(F)c3)CCO2)C1	1831894955	HNBILDFVVVQREY-FZKQIMNGSA-N	444.301	1.322	50	20	IDGD	
O=C(CCCC(F)(F)F)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1832261616	LFUKCYBROGTWMC-TZMCWYRMSA-N	449.239	1.866	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)Cc3ccc(F)cc3)CC2)CC1)[C@@H](O)CCl	1833309184	RBIUSUIEDRFHNQ-IBGZPJMESA-N	425.932	1.540	50	20	IDGD	
Cc1cc(F)cc(CC(=O)N2CCC(N3CCC(NC(=O)[C@H](O)CCl)CC3)CC2)c1	1833312753	BKXGXCWCRSMHTM-HXUWFJFHSA-N	439.959	1.848	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3ccc(OC)nc3)CC2)CC1	1833600884	XOYSXYZQXRAOMF-GOSISDBHSA-N	438.956	1.529	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccccc3)CCO2)C1	1834998935	AYANTKFBVDGVSF-KXBFYZLASA-N	425.323	1.469	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccc(F)cn3)CCO2)C1	1836034669	OYFOOJXFJJLJPA-OALUTQOASA-N	448.322	1.456	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3ccc4nn[nH]c4c3)CC2)CC1	1836500567	BQDBPNSNSHVZDK-KRWDZBQOSA-N	448.955	1.397	50	20	IDGD	
COc1ccc(CC(=O)N2CCC(OC3CCN(C(=O)[C@H](O)CCl)CC3)CC2)cc1	1836716695	JKLWOKRMJISJPK-HXUWFJFHSA-N	438.952	1.836	50	20	IDGD	
O=C(c1[nH]nc2ccncc12)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836718013	PDHUVQKGKBDYLC-KRWDZBQOSA-N	435.912	1.170	50	20	IDGD	
CCC(=O)N[C@@H](C)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](C)Br)CC2)CC1	1836817730	IRLMXKBXYDYVTP-KGLIPLIRSA-N	446.386	1.683	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc4cccnc4[nH]3)CCO2)C1	1837005271	YXDATFGPEFWXIZ-NRFANRHFSA-N	434.924	1.898	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCC(OC2CCN(C(=O)[C@H]3CCNC(=O)C3)CC2)CC1	1838637961	LVURUEPLKHQLPV-VBKZILBWSA-N	448.391	1.748	50	20	IDGD	
CCOC(=O)O[C@@H](C)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](Cl)COC)CC2)CC1	1838726979	NKDVSCPJNRSFFU-YOEHRIQHSA-N	448.944	1.800	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)CNC(=O)OC)CC2)CC1	1838765887	PVFRWSUEQYRHKE-OAHLLOKOSA-N	448.358	1.515	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(Cl)nc3F)C2)C1	1839142609	UEDFCQGHJBHPIV-UGSOOPFHSA-N	434.295	1.962	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3nc4ccccn4c3C)C2)C1	1839144813	LITKMOJTVZIMSL-IERDGZPVSA-N	434.924	1.730	50	20	IDGD	
C[C@H](Cc1ccco1)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H](F)Br)CCO2)C1	1839203449	LMXNHEOSPLAAQG-SIIHOXLZSA-N	447.301	1.605	50	20	IDGD	
CC1=CC[C@H](C(=O)N2CCOC[C@@]3(CN(C(=O)[C@H](C)Br)CCO3)C2)CC1	1840033242	YKYCYYXAUBPFMI-TXPKVOOTSA-N	429.355	1.973	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccc(C)c(C)c3)C2)C1	1840150961	URGZLFHZQVDFMY-SIKLNZKXSA-N	438.952	1.556	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(C(N)=O)cc3)CCO2)C1	1840646075	BLXJADSCSOBQPF-LAUBAEHRSA-N	437.924	1.263	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H]2C[C@H](C(=O)N3CC4(CCCN4C(=O)[C@@H](F)Cl)C3)O[C@H]2C1	1843366704	LOAZIBXOLXAUKH-APIJFGDWSA-N	445.919	1.749	50	20	IDGD	
CCCN1CCN(c2ccc(C(=O)N3CCCC34CN(C(=O)[C@@H](O)CCl)C4)cc2)CC1	1845564798	LHOGZTZNKUPJSI-FQEVSTJZSA-N	448.995	1.635	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)CCc2c[nH]c3ccc(F)cc23)C1	1846252185	MHLYXLQTRFXRMN-UHFFFAOYSA-N	449.291	1.437	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)Cc1ccc([N+](=O)[O-])c(OC)c1)C2	1846363313	BFAWRWUFOKKCRE-AWEZNQCLSA-N	425.869	1.603	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)Cn1ccc3c(F)cccc31)C2	1846383909	HUCREVDKMIOENU-UHFFFAOYSA-N	429.496	1.357	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1[C@@H](C(=O)N1CCCC13CN(C(=O)[C@@H](O)CCl)C3)C2	1847091058	LYPZXMPBUVPAOW-VGWMRTNUSA-N	441.956	1.578	50	20	IDGD	
C[C@H]1CC[C@@H](C(=O)N2CCCC23CN(C(=O)[C@H](O)CCl)C3)CN1C(=O)OC(C)(C)C	1847149524	YADDYJKPFHCGKY-ARFHVFGLSA-N	443.972	1.825	50	20	IDGD	
O=C(c1cc(Br)ncc1Cl)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl	1847557129	VYDCSYRTJLKUFF-SDDRHHMPSA-N	437.121	1.913	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)n[nH]1)c1cccc(N2CCCS2(=O)=O)c1	14307640	MQWANKWONZPXLI-UHFFFAOYSA-N	425.470	1.691	50	20	IDGD	
CCOc1ccc(N2C[C@H](C(=O)NNC(=O)c3cc(Br)c[nH]3)CC2=O)cc1	23914364	MTZCGEPATCZVJK-LLVKDONJSA-N	435.278	1.990	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1	725740831	ZGYZHKCRRWEATE-UHFFFAOYSA-N	437.412	1.991	50	20	IDGD	
C[C@@H](NC(=O)NNc1ccc(-n2cccn2)nn1)c1cc(F)ccc1N1CCN(C)CC1	726278661	LMXUWJWKNMSDNA-OAHLLOKOSA-N	439.499	1.941	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)NCc1ccc([C@@]2(C)NC(=O)NC2=O)cc1	726283383	YIUKBKISOMJPKX-LAJNKCICSA-N	443.435	1.178	50	20	IDGD	
O=C(COc1ccc(N2CCCC2=O)cc1)NNc1ccc(S(=O)(=O)NC2CC2)cc1	726862041	AORXUIGZTIFJKW-UHFFFAOYSA-N	444.513	1.776	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)N[C@@H](c1nc(C2CC2)no1)C(C)C	727943831	RUOMVSFZYWJJQS-CYBMUJFWSA-N	449.537	1.890	50	20	IDGD	
COc1ccccc1CN1CCN(CC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)CC1	728055888	PANMVBLAARMZMJ-UHFFFAOYSA-N	427.461	1.182	50	20	IDGD	
O=C(COC(=O)c1cc(F)c(F)cc1[N+](=O)[O-])NNC(=O)[C@@H]1COc2ccccc2O1	728344892	SFIPQCCZEPYWOI-HNNXBMFYSA-N	437.311	1.017	50	20	IDGD	
CC(=O)N(c1nc(C=NNC(=O)[C@H](C)NS(C)(=O)=O)cs1)c1ccc(F)cc1F	728435602	FOUUHKJLEDZJFS-VIFPVBQESA-N	445.473	1.494	50	20	IDGD	
O=C(NNC(=O)N1CCO[C@H](c2ccccc2Cl)C1)c1ccc(-n2cnnn2)cc1	728944621	HRBFHIVUNQPQBN-KRWDZBQOSA-N	427.852	1.744	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)ccc1OC	728974603	WGLZILGATNEKCT-UHFFFAOYSA-N	449.457	1.357	50	20	IDGD	
COc1cc(Cl)c(S(=O)(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1Cl	729835820	GAINGUUPXYYOOF-UHFFFAOYSA-N	443.272	1.601	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H](CCNC(=O)NNC(=O)COc2ccc(C#N)cc2)C1	730139206	MQEJMKMSGHBIHA-MRXNPFEDSA-N	431.493	1.915	50	20	IDGD	
COc1cc(C(=O)NNC(=O)COc2ccccc2O)c([N+](=O)[O-])cc1OC(F)F	730780797	VXISLVXEXQHAEI-UHFFFAOYSA-N	427.316	1.750	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)[C@@H]1CSCN1C(=O)c1ccc(Cl)cc1	730782413	MVOPXCOMJPBQJP-AWEZNQCLSA-N	435.889	1.787	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)NCCN1CCN(c2ccc(F)cc2)CC1	730821955	APNWJVIAWGYDMK-UHFFFAOYSA-N	431.468	1.063	50	20	IDGD	
CCCCN1CCCC[C@H]1CNC(=O)NNC(=O)c1sc(N2CCOCC2)nc1C	731219272	WRFCNTHEHLQUKL-INIZCTEOSA-N	438.598	1.887	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)N2CCC[C@H](CS(N)(=O)=O)C2)c(C)n1C[C@H]1CCCO1	732093170	SEYOYZIDFLBZJY-GHEFCESTSA-N	434.562	1.718	50	20	IDGD	
O=C(NNC(=O)C1CCC1)c1ccc(NS(=O)(=O)c2ccc3c(c2)OCCO3)cc1	732142623	FHQLCAGJJKAMHN-UHFFFAOYSA-N	431.470	1.820	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CCN2C[C@H](C)O[C@@H](C)C2)c1I	732264216	REOLVSUUJRIWDL-STQMWFEESA-N	445.301	1.860	50	20	IDGD	
Cc1cc(NC(=O)[C@H](C)SCC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)no1	733110807	VFYYJAPNMOASHQ-ZDUSSCGKSA-N	428.474	1.690	50	20	IDGD	
COc1ccc(Cl)cc1NCC(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	733502419	RXYDGMBFWFDWHE-UHFFFAOYSA-N	436.808	1.673	50	20	IDGD	
CC(C)[C@H](C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)S(=O)(=O)C1CCCCC1	734239366	NPBURCSMSHPMHN-OAHLLOKOSA-N	448.586	1.614	50	20	IDGD	
O=C(NNc1cnccn1)[C@H]1CCCCN1S(=O)(=O)c1ccc(Br)s1	734242720	XEDJXBYWBHGSAW-SNVBAGLBSA-N	446.352	1.987	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H]2CCCN(c3cccc(F)c3)C2)c1	734949600	CMRHWYBRKXTLOW-INIZCTEOSA-N	434.493	1.842	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(CNC(=O)NNC(=O)COCc2ccccc2)cc1	738450778	RKTHYNSKYBCQGM-UHFFFAOYSA-N	448.545	1.764	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)c1ccccc1F)C(=O)NNc1ccnc(N(C)C)n1	740118399	QTXLZEVYPUSGFF-ZDUSSCGKSA-N	442.542	1.225	50	20	IDGD	
CN(C)S(=O)(=O)c1c[nH]c(C(=O)NNC(=O)NCc2cccc(C(F)(F)F)c2)c1	742452793	FNPMGMSNYXPYRV-UHFFFAOYSA-N	433.412	1.428	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)cc(NC(C)=O)c1OC	742675839	CTDDSFADCVWMHA-UHFFFAOYSA-N	439.469	1.131	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(F)cc1Br)c1cc([N+](=O)[O-])ccc1O	743268472	TXXBEGDEPPZQJX-UHFFFAOYSA-N	434.199	1.825	50	20	IDGD	
COCCCn1c(S)nc2cc(C(=O)NNc3ncnc4[nH]cnc34)ccc2c1=O	743471601	RELCZUGCDZJXKA-UHFFFAOYSA-N	426.462	1.145	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)N[C@@H]1CC(=O)N([C@H]2C[C@H]2c2ccccc2)C1	743509952	NRXQRQGKQUUKGP-SQNIBIBYSA-N	438.484	1.561	50	20	IDGD	
CCN(C[C@H]1CCN(Cc2ccccc2)C1)C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	743511430	LEBSMHPRPDSBQT-IBGZPJMESA-N	448.531	1.861	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)NCCS(=O)(=O)N2CCSCC2)c(Cl)c1	743597722	BRWGBAQPVIMIPZ-UHFFFAOYSA-N	435.959	1.363	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CN2CCN(CC(=O)N[C@H]3CCC[C@@H](C)C3)CC2)c1	744402043	HSPDXLUCAJRZAQ-QUCCMNQESA-N	429.565	1.069	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)c2nn(-c3ccc(F)cc3)c3c2CCC3)cc1	744625233	BKYPEELUOHPADZ-UHFFFAOYSA-N	447.426	1.990	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)NC[C@H](C)CN2CCOCC2)cc1Cl	745833920	GNDZTYHIBBXRBC-LBPRGKRZSA-N	429.905	1.661	50	20	IDGD	
COc1cc(C=NNC(=O)c2nnc(O)c3ccccc23)cc(Cl)c1OCC(N)=O	745985844	ZHOZVVGLMHCZHK-UHFFFAOYSA-N	429.820	1.625	50	20	IDGD	
COc1cc(OC)cc(N2CC[C@@H](NC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)C2=O)c1	747955308	PGFRAZOZQORJQZ-QGZVFWFLSA-N	443.416	1.362	50	20	IDGD	
CN(C1CCCCC1)S(=O)(=O)c1ccc(C(=O)NNC(=O)C(=O)N2CCCC2)cc1	748246618	DZGAUQOWXBRNHP-UHFFFAOYSA-N	436.534	1.023	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)NCC(=O)NNc2cc(F)c(F)cc2F)cc1	748796414	ZLOCFVRSCUDETH-UHFFFAOYSA-N	431.392	1.702	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCCCNC(=O)C1CCC1	749118039	WBIOIJBBUYLTPK-GFCCVEGCSA-N	441.326	1.853	50	20	IDGD	
O=C(COC(=O)c1cnc(-c2ncccn2)s1)NNC(=O)c1ccc([N+](=O)[O-])cc1	750202827	RYTGENCNAAXUIL-UHFFFAOYSA-N	428.386	1.126	50	20	IDGD	
CCOC(=O)c1sc(CNC(=O)NNC(=O)c2nnc(O)c3ccccc23)nc1C	750671687	OLDCTNKUVKBJHB-UHFFFAOYSA-N	430.446	1.421	50	20	IDGD	
C[C@H]1C[C@@H](CCNC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)CN1Cc1ccccc1	752996900	HVTKUWADHPRIIV-PKOBYXMFSA-N	448.531	1.907	50	20	IDGD	
O=C(NNC(=O)N1CCS(=O)(=O)[C@@H]2CCCC[C@H]21)c1cccc(Br)c1	753919572	VHMQEIRLZFRIFX-ZIAGYGMSSA-N	430.324	1.845	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1ccccc1S[C@@H](Cl)C(F)(F)F	755612925	FNWJGOBFXJODNQ-RDDDGLTNSA-N	448.876	1.996	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)N[C@H]1CCN(C(=O)CCc2ccccc2)C1	757284543	FHJFVJNHDSOGKE-IBGZPJMESA-N	435.484	1.501	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)Nc1ccn(-c2ncccc2F)n1	757783093	SFQKPRPHMJPTML-UHFFFAOYSA-N	425.428	1.266	50	20	IDGD	
O=C(COC(=O)[C@@H]1COc2ccc(Br)cc21)NNC(=O)c1cccs1	758649203	CQRYSBCVXXTILP-LLVKDONJSA-N	425.260	1.991	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)NC2COC(C)(C)OC2)cc(OCC)c1OCC	758735028	JPNLKGJUBPVCMK-UHFFFAOYSA-N	425.482	1.978	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)[C@H]1CC(=O)N(C)[C@H]1c1ccc(Cl)c(F)c1	759154148	UMZYOCRYJCVQOE-LRDDRELGSA-N	426.876	1.451	50	20	IDGD	
CCS(=O)(=O)c1cccc(S(=O)(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c1	760357721	YJSWPCDKRXHRNC-UHFFFAOYSA-N	434.499	1.289	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)[C@@H]1CCCN(C(=O)NC2CCCC2)C1	760440120	RBYKMFUXKUWYJG-CQSZACIVSA-N	425.530	1.413	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)N[C@@H]2CC[C@@H]3SCCS[C@@H]32)cc1	762636196	YKLTZPPUYCLGTB-HZSPNIEDSA-N	430.577	1.805	50	20	IDGD	
Cc1cc(C)c(S(=O)(=O)NCCC(=O)NNc2nccc(N3CCOCC3)n2)c(C)c1	762851467	PVYDTGCXESUBJS-UHFFFAOYSA-N	448.549	1.050	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)[C@H]2CCCN2C(=O)c2ccc3c(c2)OCO3)n1	762912055	FYJHGECUVKFAMO-OAHLLOKOSA-N	426.477	1.799	50	20	IDGD	
Cc1cc(C)nc(SCc2ccc(C(=O)NNC(=O)Cn3cc([C@@H](C)O)nn3)cc2)n1	762963214	ABVUNWJBDAFBBN-CQSZACIVSA-N	441.517	1.492	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNS(=O)(=O)c1cc(C)c(F)c(C(=O)O)c1	763278183	KXYRWFNCXRCPIY-UHFFFAOYSA-N	426.422	1.620	50	20	IDGD	
CS(=O)(=O)c1cc(Br)ccc1NC(=O)C(=O)NNC(=O)c1ccccc1	763423805	VWQDKVJEUFLFCY-UHFFFAOYSA-N	440.275	1.252	50	20	IDGD	
CCN1CCN(c2ccc(NC(=O)C(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)cc2)CC1	763472599	ZSLTXFGATKOBAA-UHFFFAOYSA-N	440.460	1.136	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(OC)c(OC(C)C)c2)cc1OC	763550654	PEDPWRNHLUVYSI-UHFFFAOYSA-N	431.445	1.899	50	20	IDGD	
O=C(CN1CCCc2ccccc21)NNC(=O)C(=O)Nc1cc2c(cc1Cl)OCCO2	763727391	DSHAYWVIINYUMI-UHFFFAOYSA-N	444.875	1.650	50	20	IDGD	
COCCOc1ccc(F)cc1NC(=O)C(=O)NNC(=O)c1cc(OC)cc(OC)c1	763773119	VQDJLPUZIGTGDB-UHFFFAOYSA-N	435.408	1.268	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2cc(F)cc(F)c2OC)c2ccccc2c1=O	763785596	JONXNWXZCAKUAQ-UHFFFAOYSA-N	445.382	1.103	50	20	IDGD	
CCn1nnnc1-c1cccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)c1	763863694	AWVSPVGASKGKNU-GFCCVEGCSA-N	441.423	1.053	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(C(C)=O)cc2)c(Cl)n1	763870514	AERMNMHFANUOOU-NSHDSACASA-N	434.836	1.500	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)C(=O)Nc1cc(C(F)F)ccc1Cl	763916647	IKOGKNDMMDTWOV-UHFFFAOYSA-N	435.778	1.653	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1ccc(OCc2ccncc2)cc1	764003208	CEZSJCMCKDIVDR-UHFFFAOYSA-N	448.435	1.832	50	20	IDGD	
COc1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)c1cc(Br)cn1C	764004619	IZCZZVJHJJKBQZ-UHFFFAOYSA-N	429.658	1.849	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)c(C)c1	764006334	PAZPHKNTMLIQCO-UHFFFAOYSA-N	429.429	1.191	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1cccc(-c2nncn2C)c1	764012459	RHQAHHKVMIZKBQ-UHFFFAOYSA-N	428.836	1.544	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c2cccnc2c1C	764077162	IARXDMGSZNYCLH-UHFFFAOYSA-N	440.481	1.655	50	20	IDGD	
CN(C)CCOc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)cc1Cl	764164777	TTYPGLRUBPAZNB-GOSISDBHSA-N	446.891	1.370	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)cc1N1CCOC1=O	764244952	LDFSNYBYOFPTAR-UHFFFAOYSA-N	435.440	1.692	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)ccc1O)C(=O)Nc1cccc2c1OCCO2	764281003	VPLMWCISBXCTPI-UHFFFAOYSA-N	436.218	1.326	50	20	IDGD	
O=C(Cc1cc[nH]n1)NNC(=O)C(=O)Nc1cccc(COc2ccc3c(c2)OCO3)c1	764293062	KZVSPNPKFRNSNH-UHFFFAOYSA-N	437.412	1.046	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)C(=O)Nc1cccc(COc2ccc3c(c2)OCO3)c1	764294803	CTJWTVUEFXSJBD-UHFFFAOYSA-N	437.412	1.426	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)C(=O)Nc1cccc(OCC(=O)N2CCCC2)c1	764313197	IBBCJLBIGJNKIX-UHFFFAOYSA-N	442.447	1.156	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CNC(=O)c2cccnc2)c1NC(=O)c1ccccc1F	764344573	ZYLBVLLPOFWGTE-UHFFFAOYSA-N	449.442	1.972	50	20	IDGD	
COc1cc(Br)c(NC(=O)C(=O)NNC(=O)Cc2ccncc2)cc1OC	764355113	ZSVZHFKZFLAWJY-UHFFFAOYSA-N	437.250	1.190	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2cnn(-c3ncccc3C#N)c2)c2ccccc2c1=O	764748869	ZCCPSJOQEQHHRT-UHFFFAOYSA-N	443.427	1.335	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)cc1	765757541	VIQVAOJFNBRALG-UHFFFAOYSA-N	443.935	1.877	50	20	IDGD	
O=S(=O)(CBr)N1CCN(S(=O)(=O)c2cc(F)c(F)c(F)c2)CC1	767848540	BCTJAARUPICASX-UHFFFAOYSA-N	437.259	1.092	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2ccc(F)c(Cl)c2)CC1	768095733	YISJSZPHFIEZNH-UHFFFAOYSA-N	427.889	1.567	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)c2nccc3c(S(N)(=O)=O)cccc23)c1	768460157	KRDSECKCSLWRIS-UHFFFAOYSA-N	428.470	1.339	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2ccc([N+](=O)[O-])c(Cl)c2)cc1	768686225	ISAGWCWILGZXEW-UHFFFAOYSA-N	440.865	1.638	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3cccc([S@](C)=O)c3)n[nH]2)cc1OC	770245911	NDHHNFVYZKTZAC-PMERELPUSA-N	428.470	1.906	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)Nc1ncccc1OCc1cccc(Cl)c1	771821657	LHCBJIPTRLXDSV-ZDUSSCGKSA-N	438.893	1.901	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)CN1C(=O)N[C@](C)(c2ccccc2)C1=O	772971183	JZQNTTWBGPCBES-YEJXKQKISA-N	444.875	1.722	50	20	IDGD	
O=C(NNc1ncc(Cl)cc1Cl)C(=O)Nc1cccc(S(=O)(=O)NC2CC2)c1	773679639	JMAGVAKSHQJUCF-UHFFFAOYSA-N	444.300	1.911	50	20	IDGD	
CC(C)Oc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)C(=O)NNc1ccc(C#N)cc1	773700858	PIIKKIGOKRQFDD-UHFFFAOYSA-N	445.501	1.678	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2cccc(C[S@@](=O)c3ccccc3)c2)n1	773724602	VHYNYLZPYLSMKY-SSEXGKCCSA-N	425.470	1.875	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccc(-n2ccnn2)cc1	774008258	KPCSXSLEAAZOSK-GFCCVEGCSA-N	428.836	1.474	50	20	IDGD	
O=C(NNC(=O)C12CC3CC(CC(C3)C1)C2)Nc1ccc(C[C@H]2NC(=O)NC2=O)cc1	775705810	FSPLISWQZQHXBR-DCJJRUGTSA-N	425.489	1.806	50	20	IDGD	
O=C(CCOc1cccc(Cl)c1)N1CCN(S(=O)(=O)CBr)CC1	777836502	JZTNFWFVXONXFO-UHFFFAOYSA-N	425.732	1.935	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)c1occc1CN1C(=O)Cc2ccccc21	778442720	ZSTHBLRHZVXKJN-UHFFFAOYSA-N	428.445	1.655	50	20	IDGD	
COc1cccc(NNC(=O)NCc2ccc(S(=O)(=O)NC[C@@H]3CCCO3)cc2)n1	779979693	GCWWMMUSXHYVDU-HNNXBMFYSA-N	435.506	1.374	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)NCc2ccccc2CN2CC[C@H](O)C2)c1	781957500	ZUYLXYRMEVXWFF-FQEVSTJZSA-N	426.517	1.779	50	20	IDGD	
COc1c(C)ccc(NC(=O)C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)c1C	782898006	VVMAZAXDDCVHFN-UHFFFAOYSA-N	447.517	1.313	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2ccc(OCCN3CCN(C)CC3)cc2)cc1	783021979	IXZPCCQRZKUHJJ-UHFFFAOYSA-N	427.505	1.403	50	20	IDGD	
CN(C)C1CCN(c2ccc(NC(=O)C(=O)NNc3cncc(Cl)n3)cc2F)CC1	783268437	SDDVWOWTLPVXAQ-UHFFFAOYSA-N	435.891	1.881	50	20	IDGD	
O=C(NNc1ccc(-n2cccn2)nn1)C(=O)Nc1ccc(OCC2CCOCC2)cc1	783433664	XJUBAKQPPVUTLN-UHFFFAOYSA-N	437.460	1.550	50	20	IDGD	
Cc1cc(F)ccc1NNC(=O)C(=O)Nc1cc(S(=O)(=O)N(C)C)ccc1N(C)C	783448064	WESQWHUEOZJLAO-UHFFFAOYSA-N	437.497	1.532	50	20	IDGD	
COC(=O)[C@H]1CCCCN1C(=O)c1cccc(NC(=O)C(=O)NNc2cc(C)ncn2)c1	783945874	QNOFKBHLLRRIOU-MRXNPFEDSA-N	440.460	1.035	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)C(=O)Nc1ccc(CCC(F)(F)F)cc1	784001710	CBNUHAGCOFKIQN-UHFFFAOYSA-N	426.351	1.290	50	20	IDGD	
Cc1cc(C)c(NC(=O)C(=O)NNC(=O)CNC(=O)c2ccco2)c(Br)c1	784002901	WUTVCVXVJGZIOH-UHFFFAOYSA-N	437.250	1.175	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](n2cc(C(=O)NNC(=O)Cc3ccncc3)cn2)C1	784681378	ZSEVQQAMZNJCIX-QGZVFWFLSA-N	428.493	1.854	50	20	IDGD	
CN1CCN(C(=O)Cc2ccc(NC(=O)C(=O)NNc3ncccc3Cl)cc2)CC1	784815287	TUZQDECPFMTCGK-UHFFFAOYSA-N	430.896	1.133	50	20	IDGD	
C[C@@H]1CN(c2ccc(NC(=O)C(=O)NNc3cccc(S(C)(=O)=O)c3)cn2)C[C@@H](C)O1	784841413	IRGIZYPRVWVOJY-ZIAGYGMSSA-N	447.517	1.181	50	20	IDGD	
CN1CCCN(c2ccc(NC(=O)C(=O)NNc3cccc(S(C)(=O)=O)c3)cc2)CC1	784842353	YXSBKOGGVHNJET-UHFFFAOYSA-N	445.545	1.314	50	20	IDGD	
O=C(NNc1cccnc1Cl)C(=O)Nc1ccc(C(=O)N2CCOCC2)c(Cl)c1	784843158	AYVCGAVPAHDCCL-UHFFFAOYSA-N	438.271	1.943	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)Nc1cccc(COCC2CC2)c1	785023682	NUMTYLUAVURSTD-UHFFFAOYSA-N	428.401	1.627	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)n(Cc2ccccc2)n1	785060551	IOHARZSKMDIXEJ-UHFFFAOYSA-N	431.456	1.216	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2ccccc2CN2CCSCC2)n1	785226465	UVDOPVZLMHIAPI-UHFFFAOYSA-N	443.577	1.953	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1cccc(-c2nccn2C)c1	785338958	QEYUYZJLHLAHPO-UHFFFAOYSA-N	443.485	1.581	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1ccc2c(c1)OC(C)(C)O2	785340133	WVJINGPITDLFRU-UHFFFAOYSA-N	435.458	1.688	50	20	IDGD	
CC[C@]1(C)Oc2ccc(NC(=O)C(=O)NNC(=O)c3ccc4c(c3)OCCO4)cc2O1	785990596	JYABEYONOUPMTI-OAQYLSRUSA-N	427.413	1.755	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(c2ncc(NC(=O)NNC(=O)CC(F)(F)F)cn2)CC1	786182670	MNNDZJBSCMFOEA-UHFFFAOYSA-N	447.418	1.639	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)C(=O)Nc1cccc(C(F)(F)F)n1	786414850	SNKADGVOUZCQRM-UHFFFAOYSA-N	434.334	1.391	50	20	IDGD	
CCS(=O)(=O)CCn1cc(C)c(NC(=O)NNC(=O)c2cc(Br)c[nH]2)n1	786741731	ZDAXYIODAMGEHU-UHFFFAOYSA-N	447.315	1.183	50	20	IDGD	
N#C/C(=C/c1ccc(O)cc1)C(=O)N[C@H]1CCCN(c2cc(N3CCOCC3)ncn2)C1	787352158	ZYDYFKVDCUQDEC-OVCORXIESA-N	434.500	1.711	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@@H]3CCCN3c3ccccc3)CC2)cc1	787439271	IQSPUSVHQSJHDM-QHCPKHFHSA-N	435.572	1.929	50	20	IDGD	
CCc1nc(NC(=O)C(=O)NNC(=O)COc2ccc(Br)cc2)sc1C	789733267	WUNKTUQQXXAEIG-UHFFFAOYSA-N	441.307	1.941	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)CN1C(=O)N[C@]2(C[C@H](C)CC(C)(C)C2)C1=O	790064274	ZQAWZDWXBXOERL-XCLFUZPHSA-N	426.514	1.060	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2cc(OC)cc(-n3cccn3)c2)c1	792354816	LSKDZCFVMITIJU-UHFFFAOYSA-N	439.428	1.298	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNC(=O)COc2ccc(OC)cc2)c(F)cc1C	793023018	GCICOXYBHMGIOC-UHFFFAOYSA-N	447.419	1.484	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C2CCN(S(=O)(=O)c3cccnc3Cl)CC2)n1	794089829	KTGSBNVSPAJKCG-UHFFFAOYSA-N	437.909	1.300	50	20	IDGD	
COC(=O)[C@@]1(c2ccccc2)CCN(CC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)C1	794809444	WDHVUAQWPDLHSP-NRFANRHFSA-N	426.429	1.173	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)N2CCN(CC(=O)N3CCCC3)CC2)c1C	798114073	OZULKQVDSRMXJW-RCCKNPSSSA-N	427.549	1.425	50	20	IDGD	
COc1ccc([C@@H]2[C@@H](C(=O)NNC(=O)C(=O)Nc3ccc(C)c(C)c3)CC(=O)N2C)cc1	798309002	SUUBIQKBPVNFNY-AZUAARDMSA-N	438.484	1.618	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)N1CCC(CNC(=O)C(F)(F)F)CC1	798509838	ZZQRSDMWBNJHFJ-UHFFFAOYSA-N	426.399	1.388	50	20	IDGD	
CC(C)N(C)S(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=O)N=c2cc[nH]cc2)c1	802032526	SPSALSWTUXCPBZ-UHFFFAOYSA-N	425.898	1.652	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2cnc(O)c(Br)c2)cc1	802064490	SFUHHSXYGWXIAE-UHFFFAOYSA-N	429.252	1.420	50	20	IDGD	
Cc1cc(F)cc2c(=O)c(C(=O)NNC(=O)C(=O)NCc3ccc(Cl)cc3)c[nH]c12	804533722	HDLWKEAFLRMGOW-UHFFFAOYSA-N	430.823	1.706	50	20	IDGD	
COc1cc(C(=O)NNC(=O)N[C@@H]2CCCN(C(=O)N3CCCC3)C2)cc(OC)c1OC	804866344	XGUYTWHXBLAAKP-OAHLLOKOSA-N	449.508	1.337	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)N3CCC[C@@H](CN(C)S(C)(=O)=O)C3)cc2C1	804868375	GDGAWMSQQXNSSD-KBPBESRZSA-N	442.607	1.831	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)c1cc(S(=O)(=O)NC(C)(C)C)ccc1Cl	807370079	UXBWBOQJZMDNHK-UHFFFAOYSA-N	449.957	1.967	50	20	IDGD	
CC1(C)CC[C@@H]1NC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	807575875	SMTOABRXQJAKCC-KRWDZBQOSA-N	438.550	1.159	50	20	IDGD	
O=C(NN=Cc1cc(I)cc([N+](=O)[O-])c1)[C@H]1CCS(=O)(=O)C1	811636579	JKUZPOXYFIHCTP-VIFPVBQESA-N	437.215	1.084	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)c2c(C)nc3ccccn23)cc1)[C@H]1C[C@@H]1C	815564379	HJJNHRKRIIZKFK-UGSOOPFHSA-N	448.483	1.804	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCc2nncn2C1)C(=O)Nc1ccc(OC2CCCC2)c(F)c1	815692356	PELUSIYWOJYDDZ-GFCCVEGCSA-N	430.440	1.087	50	20	IDGD	
Cc1ncc(-c2ccc(NC(=O)C(=O)NNc3ccccc3S(=O)(=O)N(C)C)cc2)o1	815752285	LZNCMOOOINVXAQ-UHFFFAOYSA-N	443.485	1.982	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)N2CCC(O)(c3nn[nH]n3)CC2)c(C)n1C[C@@H]1CCCO1	819615090	WLIVLYUKOOAFBJ-PNDHZVEESA-N	425.493	1.214	50	20	IDGD	
COc1ccc(O)c(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)c1	821998944	RWLBDHKQLLICAA-UHFFFAOYSA-N	433.486	1.650	50	20	IDGD	
Cc1ccc(-n2cnnc2SCC(=O)OCC(=O)NNC(=O)c2ccccc2)cc1C	829481372	JEZJIOHYGIXZTK-UHFFFAOYSA-N	439.497	1.981	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)c1ccc(N2C(=O)CCC2=O)cc1	856535285	UKODDORATAEMDX-UHFFFAOYSA-N	449.511	1.313	50	20	IDGD	
CCC1CCC2(CC1)NC(=O)N(CC(=O)NNC(=O)COc1ccccc1OC)C2=O	863998990	IJIKHBMANMLCBS-UHFFFAOYSA-N	432.477	1.112	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)Cc2ccc(S(=O)(=O)N3CCCC3)s2)cc1	864016989	GZOJOTZPFUEHSG-UHFFFAOYSA-N	448.526	1.173	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)C(=O)N(Cc1ccncc1)C2=O)c1cccc([N+](=O)[O-])c1	866676604	GNLDRHSVXQLYJG-UHFFFAOYSA-N	445.391	1.861	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)CCc2ccc(S(=O)(=O)NC3CC3)cc2)cc1C	914163850	CMJMMNVMQQYFMS-UHFFFAOYSA-N	445.541	1.903	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)N2CCC[C@@H]2C(=O)NNc2ccc(F)cc2)o1	915065530	DGGCZGVTZKQRJI-CQSZACIVSA-N	425.438	1.892	50	20	IDGD	
COc1ccccc1NCC(=O)NN=C(C)c1ccc(S(=O)(=O)NCCC(=O)O)cc1	915920220	MCXLQUCBDPITHJ-UHFFFAOYSA-N	448.501	1.401	50	20	IDGD	
CCN(CC)[C@@H](CNC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)Cc1ccccc1	916443401	PMCFXBYNFDDFHS-HXUWFJFHSA-N	436.520	1.559	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)NCc1cccc(NC(=O)CCN2CCOCC2)c1	918094502	ZNBGZQFPUXDNTL-UHFFFAOYSA-N	439.516	1.800	50	20	IDGD	
O=C(CN1C(=O)NC2(CCCC2)C1=O)NNC(=O)c1ccc(F)cc1Br	918339193	LUUUJWQLCWSFTK-UHFFFAOYSA-N	427.230	1.214	50	20	IDGD	
O=C(CC1(CC(=O)N2CCOCC2)CCCC1)NNC(=O)c1nnc(O)c2ccccc12	1317764667	XJTGQRCTSTUVKP-UHFFFAOYSA-N	441.488	1.296	50	20	IDGD	
O=C(NCc1ccc(CN2CCCC2=O)cc1)NNC(=O)c1nnc(O)c2ccccc12	1317920407	JAHLUCIYLAGNQK-UHFFFAOYSA-N	434.456	1.602	50	20	IDGD	
O=C(NC1CC1)c1cc(F)c(NNC(=O)c2n[nH]cc2I)c(F)c1	1320621115	XRNCHEJXLFTNPQ-UHFFFAOYSA-N	447.183	1.942	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)Cc1ccccc1NS(C)(=O)=O	1321229003	KUISMWBAXJYBMK-UHFFFAOYSA-N	427.504	1.156	50	20	IDGD	
O=C(NNC(=O)N1CCC([C@@H]2C(=O)Nc3ccccc32)CC1)c1ccc(-n2cnnn2)cc1	1338325649	USOJPPGLJZTHID-IBGZPJMESA-N	446.471	1.465	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cccc3c[nH]nc23)C1	1777891778	MQJHCNOOUHRISZ-CSODHUTKSA-N	434.924	1.944	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2	1778484711	ODYYPXVPBRHKHB-WHSLLNHNSA-N	434.924	1.370	50	20	IDGD	
CN(CC(=O)N1CCO[C@@]2(CCN(C(=O)CO[Si](C)(C)C)C2)C1)C(=O)c1ccccc1	1779294641	VWWQTNJFZQJUJT-JOCHJYFZSA-N	447.608	1.440	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnn(Cc4ccccc4)c3)C2)C1	1779599162	IHKINTZIZUVDSY-SIKLNZKXSA-N	446.935	1.629	50	20	IDGD	
Cc1nccnc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)CBr)C2	1779871414	HDAWPVRZYUOVLH-ZXYWRSMDSA-N	439.354	1.944	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cncc4cnccc34)C2)C1	1780014866	UHKVOZGYASZAPC-ORAYPTAESA-N	433.306	1.857	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc([N+](=O)[O-])cc3F)C2)C1	1781555377	ZHNDPYDRQZGICC-KBXCAEBGSA-N	429.832	1.431	50	20	IDGD	
O=C(CSc1nc[nH]n1)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCBr)C2	1782479175	BALNPMAMZAXXNL-MLGOLLRUSA-N	446.371	1.196	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)COc2cccnn2)C1	1782519164	AUQJIUXALSVVRH-HBUWYVDXSA-N	441.326	1.153	50	20	IDGD	
COc1ccccc1CC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2	1783330765	SNUFMEZSRAPQCI-KUHUBIRLSA-N	425.323	1.851	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@](C)(O)C(F)(F)F)CCO2	1783343455	NCNBODYGBCXROC-LEWSCRJBSA-N	431.249	1.303	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cccc4nccn34)CCO2)C1	1783354253	XBJPIOOPJCPYFK-IFXJQAMLSA-N	435.322	1.951	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)[C@@H](C)CN(CC)CC)CCO2)C1	1783355250	MVHQSIDJACBRDN-TXPKVOOTSA-N	432.403	1.968	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(OC)c(OC)c3)CCO2)C1	1783882801	RWIPXOULLFCOGD-QRWLVFNGSA-N	426.897	1.401	50	20	IDGD	
CN1CCC(CC(=O)NC2(c3ccc(NC(=O)c4ccc(B(O)O)cc4)cc3)CCC2)CC1	1788140378	OZFNVLNLGRGZQZ-UHFFFAOYSA-N	449.360	1.846	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)N3C[C@H]4C[C@@H]4C3)[C@H]2C1	1788507414	VVFJTUMCKVZANU-VCWNUMGPSA-N	442.398	1.337	50	20	IDGD	
COc1cc(OC)c(F)c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Cl)C[C@@H]32)c1	1789236343	LJVSHKADTRNKSL-MSMFTSAESA-N	432.851	1.971	50	20	IDGD	
Cc1nnc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]3C2)s1	1789865761	FKTVYEXHTCYSFH-MRHIQRDNSA-N	435.377	1.605	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3c(C)noc3N)C[C@@H]21	1790961965	SUBXLKORAFSRKB-CYDGBPFRSA-N	429.315	1.332	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1ccc(C2(NC(=O)c3cn4cccnc4n3)CCC2)cc1	1791601504	FDPATHUXZOJDJQ-UHFFFAOYSA-N	449.515	1.850	50	20	IDGD	
COc1ccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C(C)(C)CCl)c(C#N)c1	1792784678	OYMUGGHNZGBGPT-XEMDLRDOSA-N	433.936	1.964	50	20	IDGD	
Cc1cnn([C@H](C)C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)CBr)c1	1792873340	UGSLEJKEVQUDRX-NPJQDHAYSA-N	427.343	1.373	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1C[C@@]13C(=O)Nc1ccccc13)C2	1793452730	HVLVGUSOXISVGX-WJVNXMQGSA-N	445.947	1.894	50	20	IDGD	
O=C(CCCOc1ccc(Cl)cc1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2	1793849538	JSLPRKQBDMHLOV-CSHUHZATSA-N	445.343	1.688	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)COc1cccnc1	1793933657	FUNMDDIWRSCZHU-ZJOBFFGXSA-N	426.311	1.081	50	20	IDGD	
Cc1nnc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)CBr)C3)s1	1794104142	ONBZGAPPKNLXEG-YGSHXTJESA-N	445.383	1.400	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCNC(=O)c1ccc[nH]1	1794305280	TXXQGNDZZMPIFK-APIJFGDWSA-N	439.354	1.804	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1n[nH]c3cccc(F)c13)C2	1795116620	XWJJULUSNVUDNJ-CULMDFNYSA-N	439.285	1.690	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cn1cncn1	1796290781	OWDXHAKQMCEDEE-QDMKHBRRSA-N	442.432	1.064	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3ccnn3c1)C2	1799279920	XMVBZLONECSFFM-QHHYFVSCSA-N	425.316	1.774	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1n[nH]c3cccc(F)c13)C2)[C@@H](F)Br	1799347827	XDZVBMVVLSNKBB-NWIKQPOISA-N	443.248	1.596	50	20	IDGD	
Cc1cc(C(=O)NCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](F)Br)no1	1800158309	JFNUNROGGRPWMU-MIJXAVMKSA-N	431.262	1.042	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc2ccnn12	1800898295	RMDUZZCBCLREDP-SSYSSCGSSA-N	447.499	1.720	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C=C/c1ccc(O)cc1Cl	1800906421	MKALLNKJMFOBTE-FTBITFSUSA-N	443.327	1.902	50	20	IDGD	
C[C@@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](O)NC(=O)OC(C)(C)C)C2	1801965335	HCJNJQSPVLEVNN-DIACKHNESA-N	434.331	1.251	50	20	IDGD	
C#CCCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](Br)Cc1ccccc1)C2	1802023519	DKMNGRWJJPNESR-AJYBTWMASA-N	433.346	1.996	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H](CNC(=O)[C@@H]2CCC(=O)NC2)[C@@H]1c1cccnc1	1802611313	SUFXWOWAGQYYPA-UOSKARGWSA-N	441.359	1.850	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1CCN(C(=O)Cn2nccn2)[C@@H]1c1cccnc1	1803015798	OQKGRZZACNISFA-UKPHBRMFSA-N	435.326	1.410	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cnn3ccccc23)[C@H]1c1cccnc1)[C@H](O)CCl	1803138667	CZICHEKKNUVUCA-IPELMVKDSA-N	427.892	1.649	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cn3ncccc3n2)[C@H]1c1cccnc1)[C@H](O)CCl	1803142274	CPGSUPDVJOMXTN-LESCRADOSA-N	428.880	1.044	50	20	IDGD	
CS(=O)(=O)c1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](O)CCl)C3)cc1F	1803882634	KBELVVICVTVDQI-QVHKTLOISA-N	432.901	1.081	50	20	IDGD	
O=C1CC[C@H](C(=O)N2CC[C@H](CNC(=O)CCBr)[C@H]2c2cccnc2)CN1	1806338196	RTFOCEXSLWDBCB-RVKKMQEKSA-N	437.338	1.399	50	20	IDGD	
Cc1ncccc1CCC(=O)N1CCCC2(CCN(C(=O)c3ccc(B(O)O)cc3)CC2)C1	1806817539	FEIVMJQZWIBACN-UHFFFAOYSA-N	449.360	1.547	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CCc2ccoc2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807363847	BVFCWGYICCPUDV-NZQKXSOJSA-N	447.300	1.307	50	20	IDGD	
Cc1cc(C(=O)NCC(=O)N2CC[C@H](CNC(=O)[C@@H](F)Cl)[C@@H]2c2cccnc2)no1	1808313630	IZNMNRXMDPUFFC-XOKHGSTOSA-N	437.859	1.348	50	20	IDGD	
O=C(CCN1CCCCC1)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1	1809976588	IYHPNHICYUZDIB-UHFFFAOYSA-N	441.381	1.087	50	20	IDGD	
O=C(c1n[nH]c2c1CS(=O)(=O)C2)N1CCCC2(CCN(C(=O)[C@@H](F)Cl)CC2)C1	1810260486	FBVHTCNUQAYXIO-CQSZACIVSA-N	432.905	1.217	50	20	IDGD	
Cc1cc(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)ccn1	1810786056	ANAQYJOCHGVBNA-IRLDBZIGSA-N	444.300	1.098	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)[C@@](C)(O)C(F)(F)F)[C@@H]1c1cccnc1	1813028398	PWHBMALYDZPZAY-SZOQZIPDSA-N	437.846	1.655	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2nn(C)c3c2CCC3)[C@H]1c1cccnc1	1813030163	GOBYFTBACCDNCD-SYNHAJSKSA-N	445.951	1.877	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)C2=COCCC2)[C@H]1c1cccnc1	1813118280	HKXCHBATGWFNGQ-LAUBAEHRSA-N	429.521	1.155	50	20	IDGD	
COc1ncc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)[C@H](O)CCl)[nH]n2)cc1F	1816149778	FQKGOXFYGLBYNU-ZIAGYGMSSA-N	425.848	1.858	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)CCc2ccccn2)[nH]n1)c1ccc(B(O)O)cc1	1817470431	BETAYVJEGSXPHW-HXUWFJFHSA-N	447.304	1.423	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1)[C@@H]1Cc2ccccc2CN1	1817997646	VCJXRMOOJWPYLG-KSZLIROESA-N	431.924	1.716	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)[C@H](C)Cn3cncn3)sc2C1	1820078499	MSHCIFQROSSFTM-WOPDTQHZSA-N	426.930	1.237	50	20	IDGD	
CCc1cc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@H](Cl)COC)CC3)n(C)n1	1820636487	LEBZJVUWXXMVSV-VXGBXAGGSA-N	425.942	1.919	50	20	IDGD	
Cc1ccn2c(C(=O)Nc3nc4c(s3)C[C@@H](NC(=O)[C@@H](O)CCl)CC4)cnc2c1	1824298908	CBDRUQDXQHBRMF-FZMZJTMJSA-N	433.921	1.925	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CN1CCNC1=N)CC2	1825447256	UJUUPFFHHCAQKN-ZJUUUORDSA-N	443.371	1.069	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1[nH]nc3ncccc13)CC2	1825997943	DROYTGYGMIIPPY-KOLCDFICSA-N	434.909	1.894	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H]1CCCS1)CC2	1826092079	KTVFRLNYTFAFIS-YPMHNXCESA-N	425.580	1.324	50	20	IDGD	
O=C(CCc1ccoc1)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827059438	BEAMYTOQNDXUKJ-JOCHJYFZSA-N	438.333	1.826	50	20	IDGD	
CCOC(=O)N[C@H](O)C(=O)N1CCC([C@H]2CCCCN2C(=O)CO[Si](C)(C)C)CC1	1829102895	QWGIXQCLMQNILN-SJLPKXTDSA-N	443.617	1.522	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)COc3ccc(O)cc3)CCO2)C1	1830339466	SONWZMQQERDATJ-WIYYLYMNSA-N	440.924	1.635	50	20	IDGD	
O=C(c1cc(-c2ccccc2)on1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1830719396	CONYIGBEHJJLHR-LAUBAEHRSA-N	449.891	1.011	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccnc2C(N)=O)CC1	1831827872	LRWAGKUISJSQMZ-DLBZAZTESA-N	436.940	1.668	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCC(N2CCC(NC(=O)Cc3cnccn3)CC2)CC1	1833371972	DJDCTBVUFQQVOE-HXUWFJFHSA-N	442.391	1.827	50	20	IDGD	
Cc1c(C(=O)N2CCC(N3CCC(NC(=O)CCBr)CC3)CC2)cnn1C	1834421164	MMWQEFVFIVLTTC-UHFFFAOYSA-N	440.386	1.699	50	20	IDGD	
O=C(/C=C/c1ccoc1)N1CCOC[C@@]2(C1)CN(C(=O)CCBr)CCO2	1834818996	GIAOWGSACFJKEB-ZMXQLYDGSA-N	427.295	1.534	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)Cc3ccccc3)CC2)CC1)[C@H](F)Cl	1835083785	UVXYEPVCFWVXDF-OALUTQOASA-N	425.932	1.696	50	20	IDGD	
C[C@@H]1CC[C@H](C(=O)NC2CCN(C3CCN(C(=O)[C@H](F)Br)CC3)CC2)O1	1835464854	XCTGAYHFVBFFNI-WQVCFCJDSA-N	434.350	1.816	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@H](C)N3C[C@@H]4C[C@H]4C3)CC2)CC1	1835671887	AWVSGXSVMOFANG-BOSXTWCSSA-N	425.017	1.916	50	20	IDGD	
C[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1)n1cccc1C=O	1835957657	CSRCRLNBWOHPAG-FZKQIMNGSA-N	432.304	1.122	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cn3cc(Cl)cn3)CCO2)C1	1835969552	PLMBFFWUMOSMAG-GOSISDBHSA-N	433.336	1.258	50	20	IDGD	
Cn1ccc(=O)cc1C(=O)NC1CCN(C2CCN(C(=O)CO[Si](C)(C)C)CC2)CC1	1836108450	OFJHXXIGAIWCKF-UHFFFAOYSA-N	448.640	1.422	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc4cccc(C)c4[nH]3)CCO2)C1	1836856557	KPKWTPJLDNTNDH-JTSKRJEESA-N	449.935	1.800	50	20	IDGD	
C#CCO[C@@H](C)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](C)Br)CC2)CC1	1836861496	BQZQBKCBBAECLY-CABCVRRESA-N	429.355	1.807	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@](C)(O)C(F)(F)F)CC2)CC1	1837018752	PFGZKCDSVCTTGX-PBHICJAKSA-N	444.878	1.552	50	20	IDGD	
Cc1nc(CC(=O)N2CCC(OC3CCN(C(=O)[C@H](C)Br)CC3)CC2)no1	1837156203	FMZBWQIIMBTREV-LBPRGKRZSA-N	443.342	1.703	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(C)nc3OC)CCO2)C1	1838176381	FMAHFMCNYBWVPX-OXJNMPFZSA-N	425.913	1.486	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3sccc3Cl)CCO2)C1	1838228001	XXFMXMFUZWYRPY-DYVFJYSZSA-N	437.345	1.725	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)C/N=C/c3ccco3)CC2)CC1	1838409365	LUPPQGFXPBGWGB-QNDYCBLQSA-N	439.940	1.951	50	20	IDGD	
Cc1cnn([C@H](C)C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)c1	1839155195	NLPZHMVSKNNYRU-LZQZEXGQSA-N	447.363	1.445	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)CN(CC)CC)CCO2	1839675075	QOFPGOWAROWHDZ-LQWHRVPQSA-N	432.005	1.828	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)C3(O)CCC3)C2)C1	1839961767	ICDALWUSBIEILW-MPGHIAIKSA-N	447.370	1.167	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(F)c3)C2)C1	1840034751	WOOYFAVYARPWKN-ACJLOTCBSA-N	429.286	1.679	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(Cl)cn3)C2)C1	1840153368	MADFOCODTWQJFF-RDTXWAMCSA-N	432.304	1.059	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3sccc3OC)C2)C1	1840153981	HCTDHIKWFOIOJE-ACJLOTCBSA-N	432.926	1.081	50	20	IDGD	
C[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1C(=O)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1	1841350359	XTSVFDTZYODNMF-BZUAXINKSA-N	443.972	1.683	50	20	IDGD	
COc1ccc([C@@H]2C[C@H]2C(=O)N2CCCC23CN(C(=O)CCC(=O)NN(C)C)C3)cc1	1841576236	OUQLPFKCFWVTNZ-RBUKOAKNSA-N	428.533	1.375	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@]1(O)CCN(C(=O)OC(C)(C)C)C1)C2	1841670638	JIUFNWHTKRJELI-YCRPNKLZSA-N	443.972	1.969	50	20	IDGD	
O=C([C@@H](F)Br)N1CC2(CCCN2C(=O)[C@@H]2CC(=O)N(C3CCCC3)C2)C1	1841859654	XWUVYJCISCHAFD-IUODEOHRSA-N	430.318	1.671	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCCC12CN(C(=O)c1cnc(O)[nH]1)C2	1841924574	CHDMQSSCYHMXRF-NSHDSACASA-N	427.889	1.064	50	20	IDGD	
CN1CCC[C@H](C(=O)N2CC3(CCCN3C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)C1	1841925039	HXBPNKPHUDAFJD-HOTGVXAUSA-N	442.988	1.664	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCCC12CN(C(=O)[C@@H]1CCCOC1)C2	1841925591	MCLBJILEEXNOOW-CABCVRRESA-N	429.945	1.749	50	20	IDGD	
O=C([C@@H](O)CCl)N1CC2(CCCN2C(=O)c2cc(-c3cc[nH]n3)n3ccccc23)C1	1843995633	BAPURGCXWPJPAZ-SFHVURJKSA-N	427.892	1.746	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2ccc(-c3cc[nH]n3)cc2)C1	1845447704	FTLKDYJFAIQZTA-UHFFFAOYSA-N	445.483	1.206	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cnccc1C(=O)NN)c1ccc(Cl)cc1	1847408745	ZIWFFLXQPURWIT-AGRHKRQWSA-N	441.919	1.958	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)Cn1ccc(C(F)(F)F)n1	11394423	SDWIRASRZKDWGL-UHFFFAOYSA-N	434.758	1.568	50	20	IDGD	
O=C(CCn1c(=O)oc2cc(Cl)ccc21)NNC(=O)c1n[nH]c(=O)c2ccccc12	14854961	RFKBEFYXIOAGSP-UHFFFAOYSA-N	427.804	1.336	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c1	17329551	RLSYZYVXMIQIAD-UHFFFAOYSA-N	426.838	1.573	50	20	IDGD	
Cc1cccc(C)c1NC(=O)CN1CCN(CC(=O)NNC(=O)c2cccs2)CC1	23302526	ZVICXHOUVVHHJB-UHFFFAOYSA-N	429.546	1.382	50	20	IDGD	
CCS(=O)(=O)N1CCC(C(=O)NNC(=O)c2ccc(COc3ccccc3)o2)CC1	23794178	SZKSVPITMKIKDR-UHFFFAOYSA-N	435.502	1.681	50	20	IDGD	
C=CCNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cc(-c3ccccc3)on2)cc1	27261278	JCOCJCCLDGLBRX-UHFFFAOYSA-N	426.454	1.881	50	20	IDGD	
CC(C)Cn1nc(C(=O)NNC(=O)CCN2C[C@H](C)O[C@@H](C)C2)c2ccccc2c1=O	38686879	FHAACJAHFKZZBW-HOTGVXAUSA-N	429.521	1.313	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)cc1	105009851	SCVQIHQSKVWRCA-UHFFFAOYSA-N	427.417	1.851	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)c2c1CCC2)c1csc(N2CCOCC2)n1	105454561	RYWBMLYXWLWSAS-UHFFFAOYSA-N	438.513	1.729	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)CCN2C(=O)[C@H]3CCCC[C@H]3C2=O)cc1	195489981	SULPVFAUSADPCR-JCGIZDLHSA-N	431.489	1.565	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)c2ccc(S(N)(=O)=O)c(Cl)c2)cc1	725907375	IWVUSTDQFJLNGT-NSHDSACASA-N	441.893	1.615	50	20	IDGD	
CCOc1c(OC)cc(CNC(=O)NNC(=O)CNC(=O)c2cccs2)cc1OC	726250567	YRYLAGITBOOBTQ-UHFFFAOYSA-N	436.490	1.424	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@@H](c2ccccc2)N2CCC(O)CC2)c2ccccc2c1=O	727765301	SMORPRBRDGRFIZ-OAQYLSRUSA-N	449.511	1.375	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)[C@@H]2CCCN2C(=O)/C=C\c2ccc(C(N)=O)cc2)c1	728825636	IPBMNPUGVPBIPS-POGDKVGISA-N	431.452	1.123	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCCCCC2)cc1)NNC(=O)Cc1cccnc1	728852206	SNAMDBDXMYCATJ-UHFFFAOYSA-N	444.557	1.969	50	20	IDGD	
NS(=O)(=O)c1ccc(CC(=O)NNC(=S)Nc2cccc(Br)c2)s1	728984584	IXFDAQPESJUADA-UHFFFAOYSA-N	449.377	1.718	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(Cl)s1)NNC(=O)Cn1ccc2ccccc21	729451952	KYIPZJUUNXNLGX-UHFFFAOYSA-N	426.907	1.482	50	20	IDGD	
Cc1ncsc1C(=O)NNC(=O)CC[C@@H](C)CC(=O)NNC(=O)c1scnc1C	729662575	VUPJVAGZGIRTIR-SECBINFHSA-N	438.535	1.245	50	20	IDGD	
COc1cccc(C[C@H](C(=O)NNC(=O)c2cccc3ncccc23)n2nnnc2C)c1	730226991	WMGGFDIVLUCNOV-HXUWFJFHSA-N	431.456	1.783	50	20	IDGD	
C[C@H]1CCCN(S(=O)(=O)c2cc(C(=O)NNc3nc(-c4ccncc4)no3)n(C)c2)C1	730283450	YCCFERPBOHDOMP-ZDUSSCGKSA-N	445.505	1.648	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)CNC(=O)N2CCc3ccccc3C2)o1	732277396	IRTOSYSNHHVUGJ-UHFFFAOYSA-N	427.505	1.650	50	20	IDGD	
CCN(CC)[C@@H](C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1)c1ccccc1	732351225	YACNYXPNDPZMGC-PZJWPPBQSA-N	441.484	1.600	50	20	IDGD	
Cn1c(NNC(=O)CC[C@H]2NC(=O)N(c3ccc(C#N)cc3)C2=O)nc2ccccc2c1=O	733775922	WWBTWXHWLMEICA-QGZVFWFLSA-N	445.439	1.153	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCN(CC(F)(F)C(F)F)CC1	734002881	RRWITPVZPBQIRH-UHFFFAOYSA-N	440.825	1.628	50	20	IDGD	
O=C(CSc1ccc(Cl)cc1)NNC(=O)N[C@H]1CCN(CCN2CCOCC2)C1	734686093	KLWQRCOLVPUHLD-INIZCTEOSA-N	441.985	1.169	50	20	IDGD	
Cn1cc(N2CC[C@@H](NC(=O)NNC(=O)COc3ccccc3-c3ccccc3)C2=O)cn1	735583839	HPGOTQRLTHASLE-LJQANCHMSA-N	448.483	1.602	50	20	IDGD	
CC[C@H](C)[C@H](NC(=O)N1CCCC1)C(=O)OCC(=O)NNC(=O)c1cccc(Cl)c1	736835536	NEYZQGULEDMNAQ-GUYCJALGSA-N	438.912	1.864	50	20	IDGD	
CC(C)(C)OC(=O)N(CC(=O)NNC(=O)[C@H]1COc2ccccc2O1)C[C@H]1CCCO1	741882703	KPQOHWFPOFIVTL-RHSMWYFYSA-N	435.477	1.390	50	20	IDGD	
Cc1ccc(S(=O)(=O)NNC(=O)CC(C)(C)C)cc1S(=O)(=O)N1CCCCC1	743258056	VURURXHPOBWKJI-UHFFFAOYSA-N	431.580	1.915	50	20	IDGD	
CN(C)C(=O)C1(CNC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)CCCC1	743609771	GFVPDYIIQFOFLM-UHFFFAOYSA-N	425.511	1.074	50	20	IDGD	
Cc1nc(N2CCOCC2)nc(O)c1CCC(=O)NNC(=O)Nc1ccc(N(C)C)cc1	743827109	XLOQPTFMUFQZAE-UHFFFAOYSA-N	443.508	1.179	50	20	IDGD	
CCN(CC)S(=O)(=O)CC(=O)NNC(=O)CCCOc1ccc(Cl)cc1Cl	746094105	ZSQUUZLFQLYVGD-UHFFFAOYSA-N	440.349	1.971	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)CSCc3cscn3)CC2)cc1	746857710	RFTJHBFODPBZDY-UHFFFAOYSA-N	433.603	1.650	50	20	IDGD	
CN(c1ccc(OCC(=O)NNC(=O)c2cccn2C)cc1)S(=O)(=O)c1cccs1	747597110	FZVLUTYWSNEQKA-UHFFFAOYSA-N	448.526	1.752	50	20	IDGD	
O=C(NNc1ccc(OCC(F)(F)F)cc1)C1=NN([C@H]2CCS(=O)(=O)C2)C(=O)CC1	748694411	MSEGIWGXWVURKI-LBPRGKRZSA-N	448.423	1.236	50	20	IDGD	
CC(C)S(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)NCc2ccco2)cc1F	749770651	ZCIPGMRXFVVPNX-UHFFFAOYSA-N	434.471	1.262	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)N[C@@H]1CCN(CCCc2ccccc2)C1=O	750274215	BTGKZDPLUGLBEL-MRXNPFEDSA-N	443.529	1.042	50	20	IDGD	
Cc1c(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)cnn1CCC(C)C	750427916	HULCTHNAPDBYGF-UHFFFAOYSA-N	448.593	1.931	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2ccc([N+](=O)[O-])c(OC)c2)c2ccccc2c1=O	751054706	MFZITQSVSPARQW-UHFFFAOYSA-N	425.401	1.798	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)[C@@H]1CC(=O)N(c2ccc3c(c2)CCC3)C1	751209259	MTNTUPXIKRVEKE-OAHLLOKOSA-N	426.498	1.167	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2cnn(-c3ccc(Cl)cc3)n2)c2ccccc2c1=O	751548343	PYVCFXYMWFLUHY-UHFFFAOYSA-N	437.847	1.725	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)[C@@H]3CC(=O)N(CCOc4ccccc4Cl)C3)nc21	751966732	YJFMJAXTPWFCCU-LLVKDONJSA-N	445.867	1.093	50	20	IDGD	
C[C@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(NC(=O)NNC(=O)Cc3cc[nH]n3)cc2)C1	755421049	QQDMMQHJSYFBBG-OKILXGFUSA-N	434.522	1.472	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2ccc(NC(=O)NNC(=O)CC(F)(F)F)cc2)C[C@@H](C)O1	755422271	JOSXDEXZKYWEEG-PHIMTYICSA-N	438.428	1.590	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2ccc(NC(=O)NNC(=O)CC(F)(F)F)cc2)C[C@H](C)O1	755422276	JOSXDEXZKYWEEG-QWRGUYRKSA-N	438.428	1.590	50	20	IDGD	
CON(C)S(=O)(=O)c1ccc(NC(=O)NNC(=O)c2cc(Cl)ccc2O)cc1	755535533	PSLFLIKGEVPEIM-UHFFFAOYSA-N	428.854	1.694	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccc(NC(=O)C3CC3)cc2)c1	755597126	BJBSARIIFDWGLA-UHFFFAOYSA-N	445.501	1.752	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)Nc1ccc(-n2nccn2)cc1	755917324	WYZFBGJBXLBOOZ-UHFFFAOYSA-N	434.504	1.632	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)Nc2cnn(CC(=O)N3CCOCC3)c2)c2ccccc2n1	756836153	TVJLTAGXDNVGOJ-UHFFFAOYSA-N	437.460	1.065	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)Nc2cc(C3CC3)nn2[C@H]2CCS(=O)(=O)C2)c1	756857921	YMCCGMBOVRYIQI-HNNXBMFYSA-N	428.474	1.458	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)COc1ccc(Cl)cc1C1CCCCC1	758034971	JBIJTAHDXRUYSV-GFCCVEGCSA-N	431.942	1.852	50	20	IDGD	
O=C(NNc1nc(O)c2ccccc2n1)c1ccc2c(c1)SC1=NS(=O)(=O)CCN12	758310770	KORSGAQETHMXMM-UHFFFAOYSA-N	442.482	1.704	50	20	IDGD	
Cc1sc2ncnc(SCCC(=O)NNC(=O)C(=O)Nc3ccccn3)c2c1C	758839153	MHPYZRMXATZILD-UHFFFAOYSA-N	430.515	1.971	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)c2cnc(OCc3ccccc3)cn2)c1	759055492	AAKNWDYLLQAWQZ-UHFFFAOYSA-N	431.408	1.545	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@@H]2CCCN2C(=O)NC(C)C)cc1Br	760572732	QQDOEGCCZUSSEJ-ZDUSSCGKSA-N	427.299	1.801	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1ccc(-c2cc[nH]n2)s1	762085792	FFBQCMVGRVDYNB-UHFFFAOYSA-N	438.513	1.357	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)CNS(=O)(=O)c1ccc(Cl)s1	762370297	JLIKHMSEPLWPCQ-UHFFFAOYSA-N	449.963	1.628	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)[C@@H]2CC(=O)N(c3cc(OC)cc(OC)c3)C2)n1	762900326	CDZXIUNSGOKGOI-CQSZACIVSA-N	428.493	1.836	50	20	IDGD	
O=C(COc1ccccc1O)NNS(=O)(=O)c1ccc(C(=O)N2CCCC2)c(F)c1	763386468	CFELREVJLASTDT-UHFFFAOYSA-N	437.449	1.156	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)NCc1ccnc(N2CCOCC2)c1	763463641	QSIDDJYKSHWXRQ-UHFFFAOYSA-N	436.513	1.054	50	20	IDGD	
O=C(NNC(=O)c1ccccc1Br)C(=O)Nc1cnn(-c2ccccc2)n1	763481986	BXAGCOVTRDMKEQ-UHFFFAOYSA-N	429.234	1.430	50	20	IDGD	
O=C(NNC(=O)c1ccccc1Br)C(=O)Nc1cccc(-c2nnco2)c1	763484264	ZEIPJDFNXCSAFV-UHFFFAOYSA-N	430.218	1.899	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)C(=O)Nc1cccc(CN2CCCCC2=O)c1	763548579	NDFDYTFKHYPJHA-UHFFFAOYSA-N	438.440	1.328	50	20	IDGD	
Cc1ccc(C)c(-n2ncc(NC(=O)C(=O)NNC(=O)c3ccc4c(c3)OCO4)c2C)c1	763550920	IXSURMPZCYAXNH-UHFFFAOYSA-N	435.440	1.926	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(Cl)c2-n2cccn2)cc1OC	763551394	WHFCQJRWDSHANL-UHFFFAOYSA-N	443.847	1.943	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cc(C(=O)N3CCOCC3)ccc2C)c(C)o1	763601770	IFLFDRTUBDCAHR-UHFFFAOYSA-N	428.445	1.077	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1c(F)cccc1Br	763657383	LDEVTAIZNAOVJH-UHFFFAOYSA-N	440.225	1.762	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)COc2ccc(OC)cc2)ccc1Cl	763660638	DWKDICJUHCPLDJ-UHFFFAOYSA-N	435.820	1.300	50	20	IDGD	
COC(=O)N(C)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)cc1	763686170	KVRRSWZWHPEXSL-UHFFFAOYSA-N	434.836	1.708	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2ccccc2-n2cccn2)c2ccccc2c1=O	763785540	HJQJFHMDMIPTMO-UHFFFAOYSA-N	445.439	1.002	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(OCc3nc(C)no3)cc2)cc1	763810943	FHWKDIUPLUZIEK-UHFFFAOYSA-N	439.428	1.430	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(C(=O)NC(C)(C)C)c2)cc1	763812058	OBZRCQGZKUTKGO-UHFFFAOYSA-N	426.473	1.688	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(CC(=O)N3CCOCC3)cc2)cc1	763829226	DPVCQBIUCDVANE-UHFFFAOYSA-N	438.484	1.050	50	20	IDGD	
CN1CCN(c2ccccc2NC(=O)C(=O)NNC(=O)Cc2c[nH]c3ccccc23)CC1	763856215	FKTVPKWWLVQKCL-UHFFFAOYSA-N	434.500	1.248	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(C(N)=O)c(Cl)c2)cc1	763867189	SNWHCROLPLRDJY-LLVKDONJSA-N	448.863	1.391	50	20	IDGD	
CN(C)C(=O)c1cc(NC(=O)C(=O)NNC(=O)CCSc2ccc(F)cc2)ccn1	763895781	SQBYLCGZWAEETP-UHFFFAOYSA-N	433.465	1.191	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)CSc2ccc(C)cc2)c(F)cc1F	763896670	QVTXHYUNGUXABB-UHFFFAOYSA-N	437.424	1.938	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(C)c(=O)n(C)c2)cc1OC	763911460	DYAGEWDTTYXFBF-UHFFFAOYSA-N	430.461	1.281	50	20	IDGD	
COCCCn1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Br)s2)n1	763939837	OIBHZJLCUMQWFK-UHFFFAOYSA-N	430.284	1.143	50	20	IDGD	
CCOC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(Br)cn2C)cc1	764002880	VGSIAASWTYKWEK-UHFFFAOYSA-N	437.250	1.364	50	20	IDGD	
COC(=O)N(C)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1	764006923	VQIGRYUXWHSYAS-UHFFFAOYSA-N	428.401	1.060	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(C(F)(F)F)c2)cc1S(C)(=O)=O	764041223	XZKVESSYHORGES-UHFFFAOYSA-N	443.403	1.817	50	20	IDGD	
CN(C)CC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3c2)cc1	764066273	DTYLDHRWPBUCOZ-UHFFFAOYSA-N	433.468	1.740	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccc(OC[C@H]2CCCO2)cc1	764131436	GWHQSSAXZNKNFC-GOSISDBHSA-N	427.457	1.582	50	20	IDGD	
CCOC(=O)/C=C/c1ccc(NC(=O)C(=O)NNC(=O)c2cccc(OC)c2O)cc1	764131821	SDTQGRLKNSTXTI-FMIVXFBMSA-N	427.413	1.377	50	20	IDGD	
O=C(CCc1ccco1)NNC(=O)C(=O)Nc1ccc(NC(=O)NCc2ccco2)cc1	764170842	BWKFNOLMZLGASU-UHFFFAOYSA-N	439.428	1.913	50	20	IDGD	
N#Cc1cccc(COc2ccc(NC(=O)C(=O)NNC(=O)Cc3ccccn3)cc2F)c1	764268447	UEUOZWHXKGUVGL-UHFFFAOYSA-N	447.426	2.000	50	20	IDGD	
C[C@@H]1CCCN(Cc2ccc(NC(=O)C(=O)NNC(=O)COc3ccccc3O)cc2)C1	764279878	GSPLLLBOOUJGSF-MRXNPFEDSA-N	440.500	1.789	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)C(=O)Nc1ccc(-c2nnc3n2CCCC3)cc1	764288845	NFHMWBCXHDBMBH-UHFFFAOYSA-N	448.483	1.706	50	20	IDGD	
O=C(Cc1cc[nH]n1)NNC(=O)C(=O)Nc1cc(C(=O)N2CCCCC2)ccc1Cl	764293930	QVRPCBUUZHPJMD-UHFFFAOYSA-N	432.868	1.018	50	20	IDGD	
COCCOc1c(Cl)cc(NC(=O)C(=O)NNC(=O)Cc2ccncc2)cc1Cl	764353908	LZLZBWOCGQNCDD-UHFFFAOYSA-N	441.271	1.742	50	20	IDGD	
CN(C)C(=O)c1cc(NC(=O)C(=O)NNC(=O)COCc2ccccc2)ccc1Cl	764363541	RNEWHQGZDLTSMO-UHFFFAOYSA-N	432.864	1.345	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1ccc(C)c(C(=O)N(C)C)c1	764397368	HNWBCLBYJGINOC-UHFFFAOYSA-N	444.513	1.584	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(C(=O)N2CCCC[C@@H]2C)cc1C	764399939	NYIDUTQUISMGSX-JKSUJKDBSA-N	448.520	1.147	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)C(=O)Nc1ccn(Cc2ccccc2)n1	764400870	KDVFCVMGGJCWMZ-UHFFFAOYSA-N	425.470	1.515	50	20	IDGD	
Cc1ccc(-c2cccc(C=NNC(=O)Cn3cnc4c3c(=O)n(C)c(=O)n4C)c2)cc1	764820205	YJVABQQMBAZQRB-UHFFFAOYSA-N	430.468	1.559	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1cccc(Br)c1	765732523	IVSCWQPGCHAHKL-UHFFFAOYSA-N	445.317	1.668	50	20	IDGD	
Cc1nc2cc(F)ccc2cc1C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765737533	GGTKIZUSAQPGIL-UHFFFAOYSA-N	449.486	1.901	50	20	IDGD	
C[S@@](=O)c1ccc(C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)cc1	765757230	ANUVGOLECCULPA-SSEXGKCCSA-N	448.976	1.656	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1ccc(C(=O)NCc2ccc(F)cc2)cc1	766261380	WLSCGMGDUKTDCD-UHFFFAOYSA-N	438.419	1.636	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(/C#N)C(=O)N2CCN(C(=O)[C@@H]3CCCN3C)CC2)c1C	766332306	AZQPYHDVHGCAEI-FUZGZPPTSA-N	441.576	1.984	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cnn(CC(C)C)c2C)c1	766336722	GCPVEMFOAVYZHD-UHFFFAOYSA-N	435.550	1.953	50	20	IDGD	
CC(=O)N[C@@H](CC(=O)OCC(=O)NNC(=O)Cc1ccccc1C)c1c(F)cccc1F	767327610	CJVBNKCRVNJNAM-SFHVURJKSA-N	447.438	1.774	50	20	IDGD	
CC(C)(C)OC(=O)N1CCO[C@@H](C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)C1	767956820	BMYRUHMTWGPOJP-CYBMUJFWSA-N	435.449	1.762	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)N[C@H]2CC(=O)N(c3c(F)cccc3F)C2)cc1C	771433720	JKZBXOVOLNRUOT-AWEZNQCLSA-N	445.426	1.656	50	20	IDGD	
Cc1cc(C(=O)N2CCC[C@H]2C(=O)O[C@@H](C)C(=O)NNC(=O)CC(C)C)ccc1[N+](=O)[O-]	772076657	RPKIHHUKPYMLAU-YOEHRIQHSA-N	448.476	1.633	50	20	IDGD	
CC(C)(C)OC(=O)N1CCCC[C@@H]1C(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772897396	HFGGFVLZZTYGND-OAHLLOKOSA-N	438.912	1.893	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)Nc1ccc(OCCN2C(=O)c3ccccc3C2=O)cc1	775872426	RLNHDNGFIGECFM-UHFFFAOYSA-N	448.439	1.860	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)Cc2sc(N)nc2-c2ccccc2)c1	775875191	CPZYEWVYFHIWPC-UHFFFAOYSA-N	435.465	1.811	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2c(Cl)cccc2S(C)(=O)=O)n1	775915240	ZIAJXPGKVFQLBL-UHFFFAOYSA-N	445.906	1.055	50	20	IDGD	
Cc1[nH]nc(C(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)c1Br	776202371	SYMCXUJPEMGVOK-UHFFFAOYSA-N	445.318	1.730	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cnc(C(F)(F)F)nc2)cc1OC	778444118	PSWFWDZQPCMCCI-UHFFFAOYSA-N	428.323	1.131	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)Nc1ccnn1Cc1ccc(Br)cc1	779458240	CLXKKNAFPRTEPY-GFCCVEGCSA-N	440.298	1.898	50	20	IDGD	
O=C(NNC(=O)[C@@H](O)[C@H](O)c1nc2ccccc2s1)c1cc(-c2ccc(F)cc2)[nH]n1	779540568	RXOLQTCUBQGZNP-IRXDYDNUSA-N	441.444	1.681	50	20	IDGD	
CCNC(=O)N(C)NC(=O)c1ccc(CNS(=O)(=O)c2ccc(C(C)=O)cc2)cc1	780708114	BEIRQFSPLUXJEC-UHFFFAOYSA-N	432.502	1.674	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)CSc2nnc3ccccn23)c2ccccc2c1=O	782549813	UTMFAPBLQMDMCV-UHFFFAOYSA-N	437.485	1.403	50	20	IDGD	
CS(=O)(=O)CCOc1ccc(Cl)cc1NC(=O)C(=O)NNc1cccc(F)c1	783039401	AWFGPNBJGAMEEW-UHFFFAOYSA-N	429.857	1.984	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2cc(Br)c(F)cc2N)n1	783217329	YRCMZGHRGNWTBM-UHFFFAOYSA-N	445.270	1.482	50	20	IDGD	
COC(=O)c1cc(Br)c(F)cc1NC(=O)C(=O)NNc1cncc(Cl)n1	783258952	RGYKJLPISIUTNC-UHFFFAOYSA-N	446.620	1.900	50	20	IDGD	
CSc1cccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)c1C	783262923	DZVAXSHVVHOFJT-UHFFFAOYSA-N	437.547	1.880	50	20	IDGD	
Cc1cnn(Cc2ccccc2F)c1NC(=O)C(=O)NNc1ccc(-n2cccn2)nn1	783435862	ATJSPIGHNLLHPF-UHFFFAOYSA-N	435.423	1.436	50	20	IDGD	
CC(=O)NC1(C(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)CCCCC1	783703803	FFHBPQGGOSBAAX-UHFFFAOYSA-N	425.530	1.461	50	20	IDGD	
CCCNC(=O)[C@@H]1CN(C(=O)C(=O)NNc2cccc([N+](=O)[O-])c2C)c2ccccc2O1	784351261	MHRRYXZNCSSXBW-SFHVURJKSA-N	441.444	1.667	50	20	IDGD	
O=C(NNc1ccc([N+](=O)[O-])cc1Cl)C(=O)Nc1ccccc1C(=O)N1CCOCC1	784383983	PBMDXOSSBIRWMP-UHFFFAOYSA-N	447.835	1.802	50	20	IDGD	
CCN(CC)CCNC(=O)c1cc(NC(=O)C(=O)NNc2ccccn2)ccc1Cl	784801004	IGLRSDUYYPUMPZ-UHFFFAOYSA-N	432.912	1.888	50	20	IDGD	
CCNC(=O)COc1ccc(NC(=O)C(=O)NNc2ccnc(Br)c2)cc1	784838260	UIRMGTNKNGOQQM-UHFFFAOYSA-N	436.266	1.441	50	20	IDGD	
CCC(CC)NC(=O)[C@H]1CN(C(=O)C(=O)NNc2cccc(OC)n2)c2ccccc2O1	784842295	LKOQQGQYPZHQHF-QGZVFWFLSA-N	441.488	1.632	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2ccccc2S(=O)(=O)C(C)C)n1	785227077	NXJGKZPNYQCOKT-UHFFFAOYSA-N	434.522	1.587	50	20	IDGD	
COC[C@H](C)n1ccc(NC(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)n1	785865104	VVJHKGOUIBEHEJ-AWEZNQCLSA-N	439.517	1.732	50	20	IDGD	
Cc1ccc(N2CCNC2=O)cc1NC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	786243831	CNBXOODKCOMDMK-UHFFFAOYSA-N	431.474	1.395	50	20	IDGD	
CCOC(=O)[C@@](C)(CNC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)c1ccccc1	787254748	JRNKOCUIZZXLRA-NRFANRHFSA-N	437.460	1.127	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)Nc1ccc(Cl)cc1-n1cccn1	788330097	DFSYNPHPOLADLM-QGZVFWFLSA-N	441.831	1.452	50	20	IDGD	
COC[C@H](Cc1ccccc1)N(C)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	789014254	ZISKBEKRWWIGOH-IBGZPJMESA-N	426.521	1.623	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)C(=O)Nc1c2c(nn1-c1ccc(Cl)cc1)CCC2	792269757	XJHULMNJRHGCRD-UHFFFAOYSA-N	438.875	1.738	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)cccc1NC(=O)N(C)C	792356066	ZBUBYLKZLUUEDJ-UHFFFAOYSA-N	438.444	1.125	50	20	IDGD	
O=C(NNC(=O)[C@@H](O)Cc1ccccc1)c1cccc(S(=O)(=O)N2CCCCC2)c1	792774821	XUWCJWCLCWMOIB-IBGZPJMESA-N	431.514	1.226	50	20	IDGD	
CCS(=O)(=O)Nc1ccccc1C(=O)NNC(=O)CNC(=O)OCc1ccccc1	794070278	RVBMFHLIBVHTRK-UHFFFAOYSA-N	434.474	1.136	50	20	IDGD	
COc1cc2c(cc1OC)CN(C(=O)CCC(=O)NNC(=O)c1cccc(C)n1)CC2	794089969	MMDIXWKKKAVGCL-UHFFFAOYSA-N	426.473	1.533	50	20	IDGD	
CCc1ccc(C(=O)NNc2ccccc2S(=O)(=O)N(C)C)cc1S(C)(=O)=O	795169718	UUXKWDCMMVUHIZ-UHFFFAOYSA-N	425.532	1.660	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@H](C(=O)NN=c2sc3ccccc3n2C)[C@H](C)O)cc1	798304109	JTXIZUMCGUXKMC-GUYCJALGSA-N	434.543	1.208	50	20	IDGD	
CCCC[C@H](/N=C1/NS(=O)(=O)c2ccccc21)C(=O)NNC(=O)NCC(F)(F)F	798314860	DKMZQBBTUKMDPM-NSHDSACASA-N	435.428	1.177	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2cc(Cl)c(Cl)cc2F)c1	799259189	VCHIBEPVLZKPNV-UHFFFAOYSA-N	448.259	1.936	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(OC)cc(OC)c2C)cc1OC	800623441	PHVYIZPAUTXLAG-UHFFFAOYSA-N	431.445	1.819	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)NC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1	802338347	VTIHNUSIVAHMRN-MRXNPFEDSA-N	434.456	1.715	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)N[C@@H]1CCCN(C(=O)Cc2ccccc2)C1	802472221	HXKIZKHTXFPFKU-QGZVFWFLSA-N	430.530	1.950	50	20	IDGD	
O=C(Cc1ccc(S(=O)(=O)N2CCOCC2)s1)NNc1ccc2c(=O)[nH]ccc2c1	803435043	HUPHREUPUPBQLT-UHFFFAOYSA-N	448.526	1.296	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)N2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)c1	805067294	OKMJRTIXEQAVFA-QFIPXVFZSA-N	432.528	1.805	50	20	IDGD	
Cc1ccc(NC(=O)NNc2ccc(-n3ccnc3)nn2)c(C)c1S(=O)(=O)NC1CC1	806294122	BGFSMVJXNNASFM-UHFFFAOYSA-N	442.505	1.868	50	20	IDGD	
O=C(NNC(=O)c1cnn(CCF)c1)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	806347841	RSRRJUWMXDXIBT-UHFFFAOYSA-N	434.435	1.629	50	20	IDGD	
COC(=O)c1c(C)csc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccccc2)[nH]n1	806973381	NVQJMCBFLDORLL-UHFFFAOYSA-N	427.442	1.633	50	20	IDGD	
O=C(CNS(=O)(=O)c1cccc(F)c1)NNC(=O)c1cc(F)ccc1Br	810344723	DPOOJMOEZLBUJO-UHFFFAOYSA-N	448.245	1.467	50	20	IDGD	
COC[C@]1(C(=O)OCC(=O)NNC(=O)c2ccccc2)CCN(C(=O)OC(C)(C)C)C1	811399468	NDXWKGRKUHYHDZ-NRFANRHFSA-N	435.477	1.264	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NC/C=C\CNC(=O)OC(C)(C)C)nc1	812469512	OXKSRZONWSACSX-SREVYHEPSA-N	442.542	1.475	50	20	IDGD	
Cc1nn(C)c2cc(NC(=O)C(=O)NNC(=O)c3cc(-c4ccc(F)cc4)[nH]n3)ccc12	812979896	GAJOQNZTZREOPY-UHFFFAOYSA-N	435.419	1.811	50	20	IDGD	
O=C1CN(Cc2cccc(NC(=O)C(=O)NNc3ccc([N+](=O)[O-])cc3Cl)c2)CCN1	812985176	KRFWBILMYMZMOY-UHFFFAOYSA-N	446.851	1.262	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)[C@@H]1OCCc2sccc21	813870265	UMRNCVLSADXHLD-DYVFJYSZSA-N	430.534	1.787	50	20	IDGD	
O=C(COC(=O)C1CCC(OC[C@@H]2CCCO2)CC1)NNC(=O)c1ccc([N+](=O)[O-])cc1	815347615	FXLCUGIRIRYHBJ-VJFUWPCTSA-N	449.460	1.653	50	20	IDGD	
Cc1nc(NC(=O)C(=O)NNC(=O)c2ccccc2OCc2ccc(F)cc2)nn1C	815564823	UFRZJELTEIQVIP-UHFFFAOYSA-N	426.408	1.241	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2CCc3nncn3C2)cc1Cc1ccccc1	815692466	RQPWGNQXRASVJX-INIZCTEOSA-N	448.483	1.226	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)N(C)C)c2ncccc12	815750948	NRRXJFLLVSQLJZ-UHFFFAOYSA-N	443.485	1.576	50	20	IDGD	
Cn1nc(C(=O)NN=Cc2c[nH]nc2-c2ccc3c(c2)OCCO3)c2ccccc2c1=O	839396179	WRMSTWVQJNLCFD-UHFFFAOYSA-N	430.424	1.859	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)on1)c1cnc2c(c1)c(O)nc(=O)n2C1CC1	880368253	UQDBKOCLYVDHLL-UHFFFAOYSA-N	432.396	1.562	50	20	IDGD	
C=CCNC(=S)NNC(=O)c1ccc(Cl)c(S(=O)(=O)N2C[C@@H](C)O[C@H](C)C2)c1	913435559	ASSXPOVOQLKEDA-VXGBXAGGSA-N	446.982	1.433	50	20	IDGD	
O=C(NNC(=O)C1CCN(C2=NS(=O)(=O)c3ccccc32)CC1)NC1CCCCC1	913451284	RKLUPCBRDGZTCB-UHFFFAOYSA-N	433.534	1.511	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)N[C@H]2CCN(Cc3ccccc3)C2)nc1	915903218	XHKJGTLEYDFDTB-KRWDZBQOSA-N	432.550	1.669	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NCc2ccc(CS(=O)(=O)NC(C)C)cc2)cc1	916227807	MMCDNFLPOFHFEX-UHFFFAOYSA-N	448.545	1.732	50	20	IDGD	
Cn1ccnc1[C@](O)(CCNC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)C(F)(F)F	916381756	RRKZOGIPLIRALV-OAHLLOKOSA-N	430.343	1.113	50	20	IDGD	
Cc1cc(NC(=O)c2cccc(F)c2)sc1C(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1	917625721	XEENNZSXGMBIEY-GFCCVEGCSA-N	439.490	1.644	50	20	IDGD	
C[C@@H]1C[C@@H](C)CN(S(=O)(=O)c2cccc(C(=O)NNC(=O)NCC(F)(F)F)c2)C1	918707050	KQCXIAUWTNGJSR-VXGBXAGGSA-N	436.456	1.860	50	20	IDGD	
O=C(NNC(=O)c1[nH]c2ccc(Br)cc2c1Cl)N[C@H]1CCS(=O)(=O)C1	919885762	NOCJOJMCNPDDOH-QMMMGPOBSA-N	449.714	1.715	50	20	IDGD	
C=CCN(C(=O)CCC(=O)C(C#N)=C1N(C)c2ccccc2N1C)[C@@H]1CCS(=O)(=O)C1	919989585	NQYPSQQPOZPMNP-MRXNPFEDSA-N	442.541	1.859	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)[C@H](CC(N)=O)NC(=O)c2ccccc2Cl)cc1	920011916	CRZAIENBAFZCIU-KRWDZBQOSA-N	446.891	1.103	50	20	IDGD	
O=C(NCc1cccc(C(=O)N2CCOCC2)c1)NNC(=O)c1cc2c(s1)CCC2	920419805	LDKQYIOAWOCKMV-UHFFFAOYSA-N	428.514	1.853	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)Nc1nc(CN2CCOCC2)cs1	920928621	WMKRACMODRJASP-UHFFFAOYSA-N	443.489	1.333	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)CCS(=O)(=O)C2CCCC2)CC1	1251911607	UOORMFRVXNMANH-UHFFFAOYSA-N	431.555	1.528	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)N[C@@H](C)C(=O)NCC(F)(F)F)cc1Cl	1252256158	MDMLPQAWIKTRTE-ZETCQYMHSA-N	441.794	1.760	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)N[C@@H]2CCO[C@]3(CCOC3)C2)c2ccccc2c1=O	1254071325	YZQQLNPOKFRBGL-SPLOXXLWSA-N	429.477	1.260	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2ccc(Br)cc2)cc1	1317705811	RCZXQUKVKJOSCR-UHFFFAOYSA-N	426.292	1.497	50	20	IDGD	
NC(=O)[C@H]1CC(C(=O)NNC(=O)c2ccc(Br)cc2)=NN1c1ccc(F)cc1	1317775427	CSAZXJCZXZRDFN-OAHLLOKOSA-N	448.252	1.469	50	20	IDGD	
CC(C)NC(=S)NNC(=O)CCC(=O)N[C@H](C)C(=O)c1ccc(Br)cc1	1318369796	HTWDZMNQWXZBNR-LLVKDONJSA-N	443.367	1.820	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)c2cc3c(nc2O)CCCC3=O)CC1	1318563011	QTTPTHNCQFGQMB-UHFFFAOYSA-N	432.477	1.714	50	20	IDGD	
Cc1nc2ncccn2c1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2	1777901243	AMHQVCHFFBCRCZ-OALUTQOASA-N	440.331	1.718	50	20	IDGD	
Cn1nc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)c2c1CCC2	1777963648	TZVSNJSSKRWRMA-WMLDXEAASA-N	429.290	1.043	50	20	IDGD	
Cc1n[nH]c(C)c1CC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CO[Si](C)(C)C)C1	1779546725	DLYTWMZWBMOAHE-WIYYLYMNSA-N	436.629	1.934	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccccc2)C1	1780267361	QXAOFESEODHXRL-AUSIDOKSSA-N	437.500	1.126	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H]1CCC(=O)NC1)C2	1780706010	DMTPOTIEXIIIDI-QABNGEJJSA-N	434.364	1.263	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)[C@@H](N)Cc3cscn3)CCO2)C1	1781227044	FXTREVNTVKFDJV-XKQJLSEDSA-N	435.377	1.079	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)[C@@H]3Cc4ccccc4CN3)CCO2)C1	1781227482	MJFFZSARQWGEQY-DZFGPLHGSA-N	440.371	1.767	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)[C@@H]3Cc4ccccc4CN3)CCO2)C1	1781227485	MJFFZSARQWGEQY-YYWHXJBOSA-N	440.371	1.767	50	20	IDGD	
Cc1nc2ncccn2c1C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@](C)(Cl)CCl)C2)C1	1781229299	FYILOIQNWJEMQP-OALUTQOASA-N	440.331	1.718	50	20	IDGD	
C[C@H](Sc1ccccn1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2	1782495772	RMXLELDFKVAXLQ-QCBUCWTNSA-N	441.981	1.676	50	20	IDGD	
CCN1CCC(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](Cl)COC)C3)CC1	1783300437	CZVXOEGMIJZPOI-WAOWUJCRSA-N	429.989	1.486	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc([N+](=O)[O-])o3)[C@H]2C1	1783364255	GDUPURPPLLOMSR-ZPFDUUQYSA-N	430.255	1.565	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc(Cl)nc3)[C@H]2C1	1783374661	CZKQYDPVKMUKNN-XWUBHJNHSA-N	445.745	1.754	50	20	IDGD	
C=CCCC(C)(C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21	1783541023	QZHHEYWOYYVDJU-SNRMKQJTSA-N	443.548	1.271	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]3C2)n(C)n1	1783967104	BLHNTVUPYKVAOY-DSRCVFDASA-N	427.343	1.353	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3cn4nc(C)sc4n3)[C@H]2C1	1784851395	JOMWPGXJALLXPS-HNKHHVNMSA-N	439.969	1.639	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3CCC(CO)CC3)[C@H]2C1	1785051500	DBZMMURBCSQOHW-AVLMTOMQSA-N	445.398	1.796	50	20	IDGD	
C[C@H](C(=O)NC1(c2ccc(NC(=O)[C@H](O)CCl)cc2)CCC1)[C@@H]1SC(=N)NC1=O	1786132370	MFYILGLSBJGANO-GDLCADMTSA-N	438.937	1.523	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)c3ccncc3F)CCC2)cc1)c1ccc(B(O)O)cc1	1788141350	VAIRFGCRBPBVJL-UHFFFAOYSA-N	433.248	1.962	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3nccnc3C)[C@H]2C1	1789037129	VLJMCBHTEKZKFB-AJNGGQMLSA-N	425.327	1.552	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(=O)ccn3C)[C@H]2C1	1789222048	DJJKXIFXIJSBLL-RMRKRWHISA-N	440.338	1.010	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4nc(CO)[nH]c4c3)C[C@@H]21	1789859798	ORGRFRMAWUTXJQ-XSWJXKHESA-N	434.924	1.666	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C/N=C/c3ccco3)C[C@@H]21)[C@@H](F)Br	1789926348	UFLQNWZHQKMEME-JTZBESRQSA-N	430.274	1.369	50	20	IDGD	
CCOC(=O)C(C)(C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](Br)CC)[C@H]2C1	1790962528	FURGHSQTOQYKKH-AJNGGQMLSA-N	447.370	1.729	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(-n4cccn4)nc3)C[C@@H]21	1791255697	YOEDHTMMPAFOTI-FJIDUMEYSA-N	447.923	1.114	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CC(c4ccccc4)=NN3)C[C@@H]21)C(Cl)Cl	1791295812	BIWAGPFQMQCBCB-OTRWWLKZSA-N	439.343	1.536	50	20	IDGD	
O=C(NCCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]2C1)c1ccccc1	1791297999	YKOLTFLMNDBLQK-JYJNAYRXSA-N	442.343	1.590	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3CCc4nc[nH]c4C3)[C@H]2C1	1791530485	UOJZHRQGUFPVKI-QDEPRCCBSA-N	439.354	1.278	50	20	IDGD	
O=C(Cc1cccc([N+](=O)[O-])c1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2	1792421257	ZURDREBDQWAWMQ-VZAMPYOESA-N	444.257	1.417	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3n(n1)CCC3)C2	1792870840	LQPNWBLNQYDLAK-NFFDBFGFSA-N	425.327	1.064	50	20	IDGD	
COc1cc(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](O)CCl)ccc1[N+](=O)[O-]	1793115367	LHHWJBYFCUQURR-HLPPOEQASA-N	425.869	1.384	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CNC(=O)c1cccs1)C2	1793445462	JDEJEHJZQHSLFV-LOUJCGABSA-N	427.954	1.475	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2)c1cnn(-c2cccnc2)c1	1794444374	MGQFXCFVZXOVJW-JLVBRIDZSA-N	448.321	1.256	50	20	IDGD	
CO[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCBr)c1ccccc1	1795112768	UCECYUMUSONUNV-CYGHRXIMSA-N	425.323	1.749	50	20	IDGD	
COc1ccc([C@H]2C[C@@H]2C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)cc1	1796188001	STKGUSHJZVODIK-PMNYKWLYSA-N	448.328	1.431	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)[C@H]1Cc2ccccc2O1	1797227072	NTBDBAFMMSXLJD-IPQWEPCOSA-N	427.270	1.270	50	20	IDGD	
CC(C)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc2c1NC(=O)C2=O	1797538513	IQDOKPYGGWGIQH-JJLQDPRZSA-N	433.892	1.290	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnccn1)C2	1799220019	FVRFNKJVAVQBPO-QDMKHBRRSA-N	439.428	1.876	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3nccn3c1)C2)[C@H](F)Br	1799347263	KHERLPARGRTHRJ-NEBZKDRISA-N	425.258	1.228	50	20	IDGD	
CN(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H]1CC1(F)F)C2)NC(=O)NCc1ccccc1	1799871434	DVYRBMDVOLOOME-MHORFTMASA-N	449.502	1.626	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1C=CCN1)C2)[C@H](Br)Cc1ccccc1	1800436595	ZDQXRFVXHPEWTN-MTHXSQLBSA-N	448.361	1.110	50	20	IDGD	
COc1cccc(OC)c1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)Br	1800760629	XECDHKWDFQFSHJ-KOFHJDLBSA-N	441.322	1.690	50	20	IDGD	
O=C1CC(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](Br)Cc2ccccc2)=NN1	1801569388	GDJOPFPHDCCRGD-FZKCQIBNSA-N	447.333	1.507	50	20	IDGD	
CC1(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)CCCC1	1802618652	GULLEYUICJXCJD-PZJWPPBQSA-N	435.333	1.661	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc3c(c2)OCO3)[C@H]1c1cccnc1)[C@@H](O)CCl	1803138718	DWFSKTGYCZJHNN-BXWFABGCSA-N	431.876	1.730	50	20	IDGD	
C[C@H](Oc1ccccn1)C(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]1c1cccnc1	1803146307	NBAKLDXUTLYYIV-WFEDQXDTSA-N	432.908	1.550	50	20	IDGD	
CC(=O)C(C)(C)C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1803405165	CRFLATARLIBISU-PXNSSMCTSA-N	431.537	1.076	50	20	IDGD	
O=C(CCBr)N1CCC2(CCCN(C(=O)CCN3C(=O)C=CC3=O)C2)CC1	1806385232	VYSDNHFSMWQPMI-UHFFFAOYSA-N	440.338	1.318	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC2(CCCN(C(=O)c3cnccc3F)C2)CC1	1810335132	NLORCJCVRRYRIL-UHFFFAOYSA-N	425.269	1.059	50	20	IDGD	
O=C([C@@H](F)Cl)N1CCCC2(CCN(C(=O)[C@H]3CCc4nc(O)nc(O)c4C3)CC2)C1	1810899837	VWJHNVLMJUWTJY-SWLSCSKDSA-N	440.903	1.758	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H](CNC(=O)[C@@H](C)NC(C)=O)[C@@H]1c1cccnc1	1812651994	JIAMSDDGWDUCJK-VZEFYGNVSA-N	439.354	1.786	50	20	IDGD	
CC(=O)NCCC(=O)NC[C@@H]1CCN(C(=O)[C@H](C)Br)[C@H]1c1cccnc1	1812663375	JZIPOVINJFDEFA-NUTKFTJISA-N	425.327	1.397	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)CCC(N)=O)[C@@H]1c1cccnc1	1812779262	QWLFIGMZEWZMDY-GRDNDAEWSA-N	425.327	1.526	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)CSCC(=O)O)[C@@H]1c1cccnc1	1812867142	FGRRPXAEFGSUNI-NORZTCDRSA-N	444.351	1.689	50	20	IDGD	
CSCC[C@H](O)C(=O)NC[C@@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1	1813092516	WGXMJNNRYMABEN-ZOBUZTSGSA-N	444.395	1.986	50	20	IDGD	
O=C(CCn1cncn1)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@@H]1c1cccnc1	1813319954	CBNKVAWQVWROSY-IMJJTQAJSA-N	439.289	1.460	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnccn2)n[nH]1	1816361312	HAAAWFDWACYCBH-FCLYZYNOSA-N	449.475	1.640	50	20	IDGD	
Nc1n[nH]c(CCC(=O)N2CCCC[C@@H]2c2cc(NC(=O)CCBr)n[nH]2)n1	1816781546	CCBUBYCVJLXCTD-LLVKDONJSA-N	439.318	1.520	50	20	IDGD	
Cc1cc(NC(=O)CC(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@H](F)Cl)CC3)no1	1817240318	IGBIHELQUZDAMJ-CLAHSXSESA-N	429.861	1.915	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cocn1)CC2	1817277598	ZDROMWXTKMTTHA-DLDHGHKKSA-N	441.473	1.491	50	20	IDGD	
C[C@H](Nc1nccs1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1	1818083242	CFECMJILTVZMPI-UHTWSYAYSA-N	426.930	1.959	50	20	IDGD	
CC(C)O[C@@H](C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819403600	WMEXKIXUILGAGR-GUYCJALGSA-N	443.508	1.528	50	20	IDGD	
Nc1n[nH]c(CCC(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@@H](F)Br)CC3)n1	1819559599	AXBRPKIVTXWEJS-KSBSHMNSSA-N	446.306	1.079	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc(O)nn2)[nH]n1)[C@H](F)Br	1820930831	DKCIYDKGYCUXON-MFKMUULPSA-N	427.234	1.902	50	20	IDGD	
COc1ccc([C@H](O)C(=O)N2CCC([C@H]3CCCCN3C(=O)[C@H](O)CCl)CC2)cc1	1824176443	OENAZFDFMYNUET-AQNXPRMDSA-N	438.952	1.948	50	20	IDGD	
O=C1CCc2ccc(C(=O)Nc3nc4c(s3)C[C@H](NC(=O)[C@@H](O)CCl)CC4)cc2N1	1824329032	FKDDHFRHKAMXRW-DOMZBBRYSA-N	448.932	1.853	50	20	IDGD	
CSCC(C)(C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1	1824560265	HTKZXPZBTVUKIB-HXUWFJFHSA-N	446.422	1.989	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccnc(F)c2)CC1	1824724086	AWHPFZUEQLWEMX-GOSISDBHSA-N	433.528	1.827	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](C)n1cncn1)CC2	1825648060	XEDPAIAXVHAYLY-IVZWLZJFSA-N	427.328	1.691	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1c(C)nc3ncccn13)CC2	1826000624	YRSGEHHVOFTSLE-NEPJUHHUSA-N	448.936	1.974	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)CO[Si](C)(C)C)CC2	1826087737	JUPLFKCLUNEQID-GFCCVEGCSA-N	441.630	1.280	50	20	IDGD	
C=C[C@@H](O)C(C)(C)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827052140	PQYDOIZEFTXDAH-NHCUHLMSSA-N	442.365	1.173	50	20	IDGD	
N#Cc1cccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)c1	1827052584	PVPFKMUDWWBVJI-HSZRJFAPSA-N	445.328	1.785	50	20	IDGD	
O=C(c1coc(Cl)n1)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827055996	NGLGEQOHMFYSDY-GOSISDBHSA-N	445.712	1.555	50	20	IDGD	
C=C[C@@H](O)C(C)(C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1	1828889739	VCHQQKYFBVDBJX-RBUKOAKNSA-N	436.597	1.552	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc4ccnn34)C2)C1	1830365233	BNRAVWZXWMVAGC-OAQYLSRUSA-N	434.924	1.669	50	20	IDGD	
C[C@H](Oc1ccccn1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830370508	SHUQILIUXXXBDW-HRAATJIYSA-N	439.940	1.570	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1830543765	CLDZDVWEMXHRKL-IINYFYTJSA-N	432.142	1.278	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)Nc3cccnc3)C2)C1	1831645710	FKILWHJSUATZRS-MDKPJZGXSA-N	438.956	1.746	50	20	IDGD	
C[C@@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)c3nc[nH]n3)CC2)CC1	1833263705	RLADZYXKSGXYQZ-LBPRGKRZSA-N	427.347	1.021	50	20	IDGD	
COC[C@@H](C)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](C)CBr)CC2)CC1	1833265502	ZBYLDFRFRYJPOO-LSDHHAIUSA-N	432.403	1.872	50	20	IDGD	
CC[C@H](C)[C@@H](O)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1833499720	SKVVEDPYYRNNCN-APHBMKBZSA-N	436.366	1.656	50	20	IDGD	
Cc1cnc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)s1	1833805288	MJFJEFQOZISUTQ-BLLLJJGKSA-N	432.340	1.305	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3cnn(C)c3)CC2)CC1	1834192697	GKQURKUHEJBDNF-ZDUSSCGKSA-N	426.359	1.389	50	20	IDGD	
Cc1oc(C(C)(C)C)cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1	1834195639	OMWYAGHREXFBKN-IERDGZPVSA-N	442.940	1.555	50	20	IDGD	
CC1=CC[C@H](C(=O)N2CCOC[C@]3(CN(C(=O)CCBr)CCO3)C2)CC1	1834821269	DSTWLCXIYQXAHL-LPHOPBHVSA-N	429.355	1.974	50	20	IDGD	
Cc1cccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)c1	1835042278	DUVLAHNEHIPIFY-UZLBHIALSA-N	439.350	1.777	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCC(N2CCC(NC(=O)CCc3nc(N)n[nH]3)CC2)CC1	1835664703	HPUSWLSQSUGGAO-UHFFFAOYSA-N	439.992	1.156	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](F)Cl)CC2)CC1)c1nc(O)n2c1CCCC2	1835852179	DFLJVGNMMKBAKF-QGZVFWFLSA-N	441.935	1.645	50	20	IDGD	
CN1CCc2cc(C(=O)N3CCC(OC4CCN(C(=O)[C@@H](O)CCl)CC4)CC3)ccc21	1836717178	LSMCNWRXWYBEBB-NRFANRHFSA-N	449.979	1.891	50	20	IDGD	
O=C(c1csnn1)N1CCC(OC2CCN(C(=O)[C@H](F)Br)CC2)CC1	1836943789	OMJOJHHLMCNTSU-ZDUSSCGKSA-N	435.319	1.841	50	20	IDGD	
O=C(c1c[nH]c2cnccc12)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1837179846	OXTJAWWGGDLSRD-GOSISDBHSA-N	427.288	1.437	50	20	IDGD	
CC(C)=CCCC(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1	1837921347	BUUVLIDOWZXEHW-UHFFFAOYSA-N	442.365	1.725	50	20	IDGD	
C=CC[C@H](C)C(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1	1838394810	ZITUTISPFFWLSP-INIZCTEOSA-N	443.548	1.510	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cnn(C)c3Cl)CC2)CC1	1838507253	QAUAYLHXNXKKCX-INIZCTEOSA-N	447.363	1.940	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)/C=C/c3cnccn3)CC2)CC1	1838786829	RAKOKCAJNNCTJN-LSTKMXGYSA-N	436.940	1.742	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccccc3F)CCO2)C1	1838856972	KBLYSVGDNZABGJ-UGSOOPFHSA-N	429.286	1.679	50	20	IDGD	
CC(C)O[C@H](C)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2	1839153169	CQFVQQLFGSMCBG-JLSDUUJJSA-N	425.353	1.493	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(O)cc3)C2)C1	1839154277	IVQPSUFFSWEPEW-RTBURBONSA-N	431.316	1.699	50	20	IDGD	
O=C(CCc1cccs1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839197659	DSXQBCAQWTUHHX-WBVHZDCISA-N	449.342	1.828	50	20	IDGD	
Cc1cc(F)cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)c1	1839284421	CWWPSHRXDKGBFS-AUUYWEPGSA-N	443.313	1.988	50	20	IDGD	
Cc1cc2[nH]c(C(=O)N3CCO[C@@]4(COCCN(C(=O)[C@H](O)CCl)C4)C3)cc2s1	1839523573	PPNSSTLRAMXWPC-BEFAXECRSA-N	441.937	1.208	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1839986268	KUMKLWWAYRFEAI-FQEVSTJZSA-N	447.960	1.233	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3sccc3OC)C2)C1	1840153983	HCTDHIKWFOIOJE-SCLBCKFNSA-N	432.926	1.081	50	20	IDGD	
O=C(c1cn2ccsc2n1)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840188642	VKEJLUUAVXKCBA-MRXNPFEDSA-N	433.317	1.270	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccc(C)o3)CCO2)C1	1840508726	LRWHILGFGPZZLG-VQIMIIECSA-N	443.338	1.760	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)CC[C@@H]3CCOC3)CCO2)C1	1840589852	VPUHULIXPIJHAO-AYOQOUSVSA-N	437.364	1.496	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC2(CCCN2C(=O)CCNC(=O)c2ccc[nH]2)C1	1842014287	CTARAIACLUXSKQ-CYBMUJFWSA-N	425.327	1.369	50	20	IDGD	
O=C(CCc1cnc2ccccc2c1)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843012915	SJDROZHBGUXMCD-UHFFFAOYSA-N	443.312	1.364	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(C(=O)N2CCCC23CN(C(=O)CCBr)C3)C1	1843841179	NJRYYFKRAWOXET-UHFFFAOYSA-N	430.343	1.842	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)C1=NO[C@H](c3ccccc3)C1)C2	1844264420	RENSDGHAJAFPGD-IBGZPJMESA-N	448.483	1.020	50	20	IDGD	
CC#CC[C@H](C(=O)N1CCCC12CN(C(=O)c1ccc(B(O)O)cc1)C2)c1ccccc1	1844334997	GYFHXRNUDBXPKD-QFIPXVFZSA-N	430.313	1.381	50	20	IDGD	
CN(CC(=O)N1CCCC12CN(C(=O)COC(C)(C)C)C2)NC(=O)NCc1ccccc1	1845038277	LOCAORKFAMOSMV-UHFFFAOYSA-N	445.564	1.351	50	20	IDGD	
COc1cccc(C(=O)N2CCCC23CN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C3)c1F	1846929892	PGRNOLWQTAUUIX-AFUMVMLFSA-N	441.463	1.785	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H]1C[C@@H]1c1ccc(F)c(F)c1	1847612346	DAOJLIBMMDBEKU-PDWMJMLSSA-N	434.487	1.643	50	20	IDGD	
CCn1c(SCC(=O)OCC(=O)NNC(=O)c2ccc(C)cc2)nnc1-c1ccco1	9398385	VWDXQZAJLXVKRU-UHFFFAOYSA-N	443.485	1.963	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)Cc1c(C)nc2nc(N)nn2c1C	12689788	AGTJFEVZDOAVPQ-UHFFFAOYSA-N	436.501	1.759	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2cccc(C(=O)NNC(=O)Cc3ccc(F)cc3)c2)C[C@@H](C)O1	15529021	RWCLXCQIMZZUOJ-GASCZTMLSA-N	449.504	1.627	50	20	IDGD	
O=C(COC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)NNC(=O)c1ccccc1	20817246	AOCLZPIKVTWCTI-UHFFFAOYSA-N	431.470	1.089	50	20	IDGD	
O=C(Cc1csc(-c2cccnc2)n1)NNC(=O)c1csc(N2CCOCC2)n1	105179938	BSMPCXBFSAKCNC-UHFFFAOYSA-N	430.515	1.502	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)N[C@H]2CCCN(S(C)(=O)=O)C2)N(C)c2ccccc21	109047989	QHNJGNRXVDSKCM-HNNXBMFYSA-N	445.545	1.197	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNS(=O)(=O)c2cccc3ncccc23)ccc1Cl	726519816	MSDCCCWHKHVWGM-UHFFFAOYSA-N	440.890	1.159	50	20	IDGD	
O=C(NNC(=S)NC1CCOCC1)c1ccccc1NS(=O)(=O)c1cccs1	727780463	LVISWPQDAWIIAA-UHFFFAOYSA-N	440.572	1.837	50	20	IDGD	
COc1ccc(-c2nc(CC(=O)N([C@@H]3CCS(=O)(=O)C3)N(C)C)cs2)cc1OC	728179045	NRYVRVQAKVDIAP-OAHLLOKOSA-N	439.559	1.862	50	20	IDGD	
Cc1cc(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)ccc1[N+](=O)[O-]	728213296	JALUGROZFBNCAQ-UHFFFAOYSA-N	433.490	1.596	50	20	IDGD	
COc1ccc(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)cc1OC	728213453	LIDKFELHKZXXCN-UHFFFAOYSA-N	434.518	1.397	50	20	IDGD	
Cc1nc(COc2ccccc2C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)no1	728847728	NBAJEEWSLQUZKB-UHFFFAOYSA-N	437.460	1.425	50	20	IDGD	
COc1cccc([C@@H](C)N2CCN(CC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)CC2)c1	728930427	OFOWAYQJPFTPGD-MRXNPFEDSA-N	441.488	1.743	50	20	IDGD	
O=C(NCc1noc(-c2cccs2)n1)NNC(=O)C1CCN(c2ncccn2)CC1	728951189	ACGPVNILICGPHI-UHFFFAOYSA-N	428.478	1.335	50	20	IDGD	
C[C@H]1CC(C)(C)C[C@@]2(C1)NC(=O)N(CC(=O)NNC(=O)Cn1ccc3ccccc31)C2=O	729450440	VFRZQPJKQDAAFC-NPMXOYFQSA-N	439.516	1.926	50	20	IDGD	
COC(=O)Nc1ccccc1C(=O)OCC(=O)NNC(=O)c1ccc(OC)c(OC)c1	729750225	LPCNZUBQGASCDK-UHFFFAOYSA-N	431.401	1.500	50	20	IDGD	
COc1ccc(C=NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1[N+](=O)[O-]	730144184	HUMLPITUYHAJTN-UHFFFAOYSA-N	448.457	1.388	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N2CCC(CNC(C)=O)CC2)cc1Br	732255861	QBWVMYQSHZCJNT-UHFFFAOYSA-N	427.299	1.660	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(O)nc3ccc([N+](=O)[O-])cc23)c1	732268801	CDUWCNLIMBHNLF-UHFFFAOYSA-N	430.398	1.327	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N[C@@H]2CCN(c3ccccc3C(N)=O)C2)cc1OC	732573519	SJWZUCBTKDQFDB-CQSZACIVSA-N	427.461	1.026	50	20	IDGD	
CC1(C)C[C@@H]1CNC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	732892435	BVCAXIJFXMMNON-MRXNPFEDSA-N	438.550	1.017	50	20	IDGD	
Cn1c(NNC(=O)c2cccc(CS(=O)(=O)NC(C)(C)C)c2)nc2ccccc2c1=O	733260567	HTUHJNQJWFWLKM-UHFFFAOYSA-N	443.529	1.908	50	20	IDGD	
C[C@@H]([C@@H](C)S(C)(=O)=O)N(C)C(=O)CCC(=O)C(C#N)=C1N(C)c2ccccc2N1C	733277143	YAOGNSQNCGDSEA-LSDHHAIUSA-N	432.546	1.937	50	20	IDGD	
COc1ccc(CN2CC[C@H](NC(=O)NNC(=O)COc3ccc(C#N)cc3)C2=O)cc1	734682470	APFRNGLKXRHTPF-IBGZPJMESA-N	437.456	1.077	50	20	IDGD	
COCCOc1ccc(-n2nc(C)c(C(=O)NNc3nc4ccccc4c(=O)n3C)n2)cc1	735054620	VYJWMZJXMJGQBS-UHFFFAOYSA-N	449.471	1.605	50	20	IDGD	
CC[C@H](Cc1ccccc1)C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	735117905	IMQKLKFQDJCYFH-GOSISDBHSA-N	431.562	1.730	50	20	IDGD	
C[C@H](CN1CCN(c2ccccn2)CC1)NC(=O)NNC(=O)[C@@H](C)Oc1ccccc1F	735585265	CTOYGFKNLKUKAJ-IAGOWNOFSA-N	444.511	1.529	50	20	IDGD	
CC(C)(CCC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)NC(=O)OC(C)(C)C	737544207	NBUQCEANQXQBNL-UHFFFAOYSA-N	434.541	1.924	50	20	IDGD	
O=C(COC(=O)CNC(=O)N1CCc2ccccc2C1)NNC(=O)c1ccc(Cl)cc1	740976558	WQUHQCFHCZIPTO-UHFFFAOYSA-N	444.875	1.412	50	20	IDGD	
CN(CC(=O)NNC(=O)NCc1cccc(C(F)(F)F)c1)S(=O)(=O)c1cccnc1	742453107	MSEHPTPYTPUVAY-UHFFFAOYSA-N	445.423	1.252	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CN2CCN(Cc3nc(O)c4ccccc4n3)CC2)c1	744384146	GBMCPANYZTVIEH-UHFFFAOYSA-N	434.500	1.223	50	20	IDGD	
CCO[C@@H](C)c1noc(CN2CCN(CC(=O)NNC(=O)c3ccc(C)cc3)CC2)n1	744412104	NUWSQFWLECGYQM-INIZCTEOSA-N	430.509	1.054	50	20	IDGD	
CCCC(=O)N1CCC[C@@H](C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)C1	744619769	XVNILAVNNGOZOA-MRXNPFEDSA-N	438.550	1.189	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1cn(Cc2cccs2)nn1	745560236	AGXSAWDEHYWSCO-UHFFFAOYSA-N	449.876	1.668	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H](CCNC(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)C1	745809677	LDATWEJMELNPML-GFCCVEGCSA-N	437.453	1.892	50	20	IDGD	
CC[C@@H](Nc1c([N+](=O)[O-])c(C)nn1C)C(=O)NNC(=O)c1cnn(-c2ccccc2)c1	746258389	CKCZSUYROYYIJB-OAHLLOKOSA-N	426.437	1.474	50	20	IDGD	
CC(=O)N1CC[C@@](C)(C(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)C1	746827277	MSMMBYLZBLRUFH-HSZRJFAPSA-N	447.499	1.408	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN1C(=O)c1cc(Cl)ccc1Cl)C(=O)N1CCCC1	748240634	HWYZSIVXSLBALA-CQSZACIVSA-N	427.288	1.368	50	20	IDGD	
CON=Cc1ccc(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)cc1	748619559	KKRBBZRHNLMDJG-UHFFFAOYSA-N	431.518	1.360	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)NCC(=O)N2CCN(c3ccccc3)CC2)c1	749222413	XELPHZPGYBCHBS-UHFFFAOYSA-N	439.516	1.361	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)N[C@@H]1CC(=O)N(c2cccc(C(F)(F)F)c2)C1	753034103	CSFKBZNLTOCDMJ-WCQYABFASA-N	432.399	1.193	50	20	IDGD	
CCCOc1ccc(C(=O)NNS(=O)(=O)c2cc(C(=O)OC)oc2C)cc1OC	754746252	XJHXJYMKOKFQNX-UHFFFAOYSA-N	426.447	1.795	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2ccc(C)nc2Br)c2ccccc2c1=O	755408408	ZIGICFCYXQEBGS-UHFFFAOYSA-N	430.262	1.957	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)Nc2ccc(S(=O)(=O)N3C[C@@H](C)C[C@H](C)C3)cc2)n[nH]1	755419452	DMOKAJZJQTWRNC-STQMWFEESA-N	434.522	1.851	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@H]2CCN(c3ncccc3F)C2)c2ccccc2c1=O	756151189	KUKXOFSNOLSYCZ-ZDUSSCGKSA-N	439.451	1.173	50	20	IDGD	
COC(=O)C[C@@H]1CN(CC(=O)NNC(=O)c2ccc(OC)c(OC)c2)c2ccccc21	756602835	ZABOYVLCDBZGTG-OAHLLOKOSA-N	427.457	1.632	50	20	IDGD	
COCC[S@@](=O)Cc1cccc(NC(=O)NNC(=O)COc2ccc(C#N)cc2)c1	756613737	QLLDJHODNHISPS-SSEXGKCCSA-N	430.486	1.685	50	20	IDGD	
O=C(c1ccc([N+](=O)[O-])c2cccnc12)N1CCN(S(=O)(=O)CBr)CC1	758521939	AVEADFMKJGABDL-UHFFFAOYSA-N	443.279	1.583	50	20	IDGD	
COc1ccc(C[C@H](C)C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1	758567015	BYRZJRIAAISQPC-LIRRHRJNSA-N	428.441	1.404	50	20	IDGD	
COC1CCC(CCNC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)CC1	758713822	HUFZFRZFQOFKBO-UHFFFAOYSA-N	440.566	1.541	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@H](C)c2nccs2)c1	758721583	BCDIRHFXKPGSLA-ZDUSSCGKSA-N	439.563	1.921	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNS(=O)(=O)c1ccc([N+](=O)[O-])c(OC)c1	759163190	JJRLFZVHNYUMJN-UHFFFAOYSA-N	425.419	1.391	50	20	IDGD	
O=C(Cc1cccc(I)c1)NNC(=O)[C@@H]1COc2ccccc2O1	760242101	PZDVEIDHOORVCB-HNNXBMFYSA-N	438.221	1.821	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)Cc1cccc(I)c1	760550847	GGISIMPDMQHQJY-UHFFFAOYSA-N	426.210	1.766	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Br)cc2F)CC1)NNc1ncc(F)cn1	760914669	IWDFUXYDVWLWTI-UHFFFAOYSA-N	441.280	1.778	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H]1[C@@H]1COCCC1=NNC(=O)N[C@@H]1CCS(=O)(=O)C1	762418670	RNWOSPZFFWTNBW-IIAWOOMASA-N	444.554	1.265	50	20	IDGD	
CC(=O)N1C=Cc2ccccc2[C@H]1CC(=O)OCC(=O)NNC(=O)Cc1nc(C)cs1	762421430	LXCFNLRNSBYEOL-QGZVFWFLSA-N	442.497	1.649	50	20	IDGD	
COc1ccc(I)c(NC(=O)C(=O)NNC(=O)c2ccccn2)c1	763464591	OMALBZAFGSEPCZ-UHFFFAOYSA-N	440.197	1.095	50	20	IDGD	
CCS(=O)(=O)c1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)c1ccccc1O	763525705	FMHCCLGGKWUSOI-UHFFFAOYSA-N	425.850	1.239	50	20	IDGD	
O=C(NNC(=O)c1ccccc1O)C(=O)Nc1ccc(-n2nccn2)cc1C(F)(F)F	763528085	VKJKNNXLPNYTKG-UHFFFAOYSA-N	434.334	1.391	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(CCN(C)C)cc2)cc(OC)c1OC	763540634	XMCIHQBMACOSEZ-UHFFFAOYSA-N	444.488	1.216	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)C(=O)Nc1cccc(-c2n[nH]c(C3CC3)n2)c1	763551254	NFHJTEFZCRLWNK-UHFFFAOYSA-N	434.412	1.478	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2cc(F)cc(N3CCOCC3)c2)c1	763630427	KYVWYEZZIRMWEF-UHFFFAOYSA-N	430.436	1.136	50	20	IDGD	
COC(=O)c1cc(Cl)cc(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)c1	763675278	UQMDQFWGSLBNOB-UHFFFAOYSA-N	430.804	1.163	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccn(Cc2ccccc2)c1=O	763717498	WHUASCGKRWZMRL-UHFFFAOYSA-N	448.479	1.624	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(S(N)(=O)=O)c2)cc1	763768538	TYXQDXQQWXNXFU-UHFFFAOYSA-N	448.501	1.159	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(S(C)(=O)=O)nc2)cc1	763768928	XJADNHOIKCKZPK-UHFFFAOYSA-N	448.501	1.310	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)C(=O)Nc2ccc(C#N)cc2F)c2ccccc2c1=O	763791537	UYKGCQAUZBRKKP-UHFFFAOYSA-N	436.403	1.388	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C)cc2)c(C)c1	763822059	VGZVDEJETFFMMD-UHFFFAOYSA-N	429.429	1.020	50	20	IDGD	
C[S@@](=O)Cc1ccccc1NC(=O)C(=O)NNC(=O)CCSc1ccc(F)cc1	763903444	RXFZDPNQUCERSM-GDLZYMKVSA-N	437.518	1.973	50	20	IDGD	
COC(=O)c1ccc(C)c(NC(=O)C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)c1	763943274	CFAZJVMACKQDDC-UHFFFAOYSA-N	437.412	1.073	50	20	IDGD	
CC[C@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(S(=O)(=O)N2C[C@H](C)C[C@@H](C)C2)cc1	764084764	WGHFSCQSFUNIDP-KFWWJZLASA-N	438.550	1.485	50	20	IDGD	
O=C(CN1CCCCCCC1)Nc1ccc(NC(=O)C(=O)NNC(=O)c2ccoc2)cc1	764160020	KZFGEEFMCDJGAN-UHFFFAOYSA-N	441.488	1.884	50	20	IDGD	
Cc1ccnc(Oc2ccc(NC(=O)C(=O)NNC(=O)[C@H]3Cc4ccccc4O3)cc2)n1	764163734	LMOVXKLNXKJFNE-GOSISDBHSA-N	433.424	1.667	50	20	IDGD	
Cc1cc(C(=O)NC2CCCC2)ccc1NC(=O)C(=O)NNC(=O)c1cccc(C#N)c1	764234670	HOKCYNZOVHMVGS-UHFFFAOYSA-N	433.468	1.939	50	20	IDGD	
Cc1cc(Cl)ncc1NC(=O)C(=O)NNC(=O)c1cc(Br)ccc1O	764279172	YZPNCJKFIXUETI-UHFFFAOYSA-N	427.642	1.911	50	20	IDGD	
N#Cc1ccc(Cn2cnc(NC(=O)C(=O)NNC(=O)CCCc3cccs3)n2)cc1	764338863	FIYNVXYSNVGUQE-UHFFFAOYSA-N	437.485	1.368	50	20	IDGD	
CCCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)cc1	764378262	XLGQWKKZJDDQAI-UHFFFAOYSA-N	440.485	1.678	50	20	IDGD	
Cc1cc(O[C@@H](C)c2ccccc2)ccc1NC(=O)C(=O)NNC(=O)[C@H]1COCCO1	764424965	LGMPFYANNUEDLN-HNAYVOBHSA-N	427.457	1.636	50	20	IDGD	
Cc1cc(OCc2cccc(Cl)c2)ccc1NC(=O)C(=O)NNC(=O)[C@H]1COCCO1	764425422	POAKDKXYCJOKAE-GOSISDBHSA-N	447.875	1.729	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)[C@H](C)NC(=O)C3CCCCC3)n[nH]2)cc1OC	765596143	GIGXZQYYWAKYLB-ZDUSSCGKSA-N	443.504	1.940	50	20	IDGD	
CCOc1ccc(CCC(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cc1	765738687	MQEQPQVIOCSYIV-UHFFFAOYSA-N	438.528	1.623	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)CN1CCC(n2cc(Br)cn2)CC1	766885588	WJUUMQDFJAEQQY-UHFFFAOYSA-N	434.338	1.981	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2ncc3ccccc32)cc1Cl)N[C@@H]1CCS(=O)(=O)C1	767682947	HETQKTNFUYUFBY-CYBMUJFWSA-N	447.904	1.810	50	20	IDGD	
COC(=O)c1ccc(S(=O)(=O)NNC(=O)NCc2cccc(C(F)(F)F)c2)cn1	769623696	DOIKQEROMWRWNB-UHFFFAOYSA-N	432.380	1.580	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)[C@@H]1CCN(C(=O)OCc2ccccc2)C1	770073272	LQOUBMWYCDQXEA-QGZVFWFLSA-N	427.457	1.880	50	20	IDGD	
CNS(=O)(=O)c1cccc(CNC(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)c1	770168363	OQLPDDDUEMYWMI-LBPRGKRZSA-N	440.909	1.546	50	20	IDGD	
COCCOc1ccc(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)c(Cl)c1	770207192	DEWUHXKCELIXDV-UHFFFAOYSA-N	440.909	1.733	50	20	IDGD	
C[C@@]1(c2ccc(F)c(Cl)c2)NC(=O)N(CC(=O)NNC(=O)NCc2ccco2)C1=O	770221265	AIYWRPJHRQDYAQ-SFHVURJKSA-N	437.815	1.370	50	20	IDGD	
COc1ccc([C@@H](CNC(=O)NNc2nc(O)c3cnn(C)c3n2)N2CCCCC2)cc1	770337066	UFOBDIAYAKKFIE-QGZVFWFLSA-N	440.508	1.931	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)c3cc(Cl)ccc3-n3cnnn3)nc21	770958878	REEGFGIWEHFURQ-UHFFFAOYSA-N	428.844	1.673	50	20	IDGD	
C[C@@]1(c2ccc(F)c(Cl)c2)NC(=O)N(CC(=O)NNc2cc(Cl)nc(N)n2)C1=O	771738014	GXENGOGKJJKQJM-INIZCTEOSA-N	442.238	1.415	50	20	IDGD	
CCCCCCn1cc(S(=O)(=O)NNC(=O)c2ccc3ccccc3n2)c(O)nc1=O	772568162	GBDLACMMYXAZAX-UHFFFAOYSA-N	445.501	1.701	50	20	IDGD	
COc1cc(C(=O)NNC(=O)N[C@@H]2CCCN(CC(F)(F)F)C2=O)cc(OC)c1OC	772972935	ZUTVAFPVWIGLHR-LLVKDONJSA-N	448.398	1.210	50	20	IDGD	
COc1cc(C=NNC(=O)CN2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)ccc1C	773066577	BQIRSUZWBSCOKS-UHFFFAOYSA-N	444.557	1.769	50	20	IDGD	
COc1c([N+](=O)[O-])ccc(C=NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)c1O	773069627	VAUYFCBEFKSACC-UHFFFAOYSA-N	441.488	1.885	50	20	IDGD	
CC(C)(C)OC(=O)NC1(C(=O)NNC(=O)[C@H]2CCCN(C(=O)OC(C)(C)C)C2)CC1	773411641	OYSRSZRDYWKNKQ-ZDUSSCGKSA-N	426.514	1.838	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)CC[S@](=O)c2ccc3c(c2)OCCO3)nc1C	778423911	ITIRCLOHNRGAPK-PMERELPUSA-N	434.474	1.374	50	20	IDGD	
O=C(NNc1ncncc1Cl)C(=O)Nc1cc2c(cc1Br)OCCO2	782158812	DLNMAHYQPUEGNE-UHFFFAOYSA-N	428.630	1.746	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-]	783114173	YVWXKBWCJNFINL-UHFFFAOYSA-N	438.396	1.958	50	20	IDGD	
O=C(NNc1ccc(-n2cccn2)nn1)C(=O)Nc1ccc(OCc2cccnc2)cc1	783432848	GBFUNYQMAYJENJ-UHFFFAOYSA-N	430.428	1.718	50	20	IDGD	
O=C(NNc1ccc(Br)cn1)C(=O)Nc1cccc(N2CCCNC2=O)c1	784340838	FXPDVWFTLNIVDW-UHFFFAOYSA-N	433.266	1.846	50	20	IDGD	
O=C(Cn1cc(NC(=O)C(=O)NNc2ccc(OC(F)(F)F)cc2)cn1)NC1CC1	784801620	GCCQXHURENMWTE-UHFFFAOYSA-N	426.355	1.142	50	20	IDGD	
CC(=O)N(C)c1ccccc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)C(F)F)cc1	784835199	HHWNYAQALQPENG-UHFFFAOYSA-N	440.428	1.747	50	20	IDGD	
COc1cccc(NNC(=O)C(=O)Nc2cc(N3CCCS3(=O)=O)ccc2Cl)n1	784849275	VDNJJIMSRXWNQU-UHFFFAOYSA-N	439.881	1.365	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2ccnn2Cc2ccc(OC)cc2)n1	785238483	XYACFNKHOQDZTJ-UHFFFAOYSA-N	438.492	1.658	50	20	IDGD	
Cn1c(=O)ccc2ccc(NC(=O)C(=O)NNC(=O)c3cccc(C(F)(F)F)c3)cc21	787544259	PTPVOSNHIGMHGM-UHFFFAOYSA-N	432.358	1.957	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1ccc(Cl)cc1-n1cccn1	788332907	HWYXBJGOZBNFMR-UHFFFAOYSA-N	429.820	1.396	50	20	IDGD	
COc1cc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc([N+](=O)[O-])c1C	791689900	PZTDFBSFEWBHAL-QGZVFWFLSA-N	445.384	1.056	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2ccc(N3CCCCC3)c3ncccc23)CCS(=O)(=O)C1	792354329	YETCAUBZWYMJOR-NRFANRHFSA-N	445.545	1.362	50	20	IDGD	
Cc1ccc2c(c1)CC[C@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)N3CCCC3)c1)O2	792774798	WOCLLPZGCOYWIX-HXUWFJFHSA-N	443.525	1.934	50	20	IDGD	
CC(=NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1ccc2n[nH]cc2c1	794855383	QXLYLFXQDMBMBO-UHFFFAOYSA-N	427.486	1.738	50	20	IDGD	
C[C@@H](Oc1ccc(C=NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1)C(=O)O	794880003	OZTBHQOGDZLBAX-SNVBAGLBSA-N	425.850	1.603	50	20	IDGD	
CC(C)(C)c1cc(CS(=O)(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)no1	795343575	LUBNTGIIDZOGLF-UHFFFAOYSA-N	428.898	1.393	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)NCc1ccc(I)c(C)c1	798477782	QXRMZEBQJXMYBE-LLVKDONJSA-N	435.262	1.482	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)N[C@@H]1COc2cc(F)c(Br)cc21	800052895	MMVVXUFLIQCBAZ-LLVKDONJSA-N	447.261	1.877	50	20	IDGD	
CC(C)[C@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1ccc(Br)cc1Cl	802041460	WYSIPRGSHHAEJP-NSHDSACASA-N	441.735	1.829	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)CCC(=O)N2CCN(c3ccccn3)CC2)cc1	802121165	SNQANDSPWGQXQP-UHFFFAOYSA-N	439.520	1.429	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)NC[C@H]2CC(c3ccc4c(c3)CCO4)=NO2)nc2ccccc21	802338266	SLCOIIVKUXDOOZ-MRXNPFEDSA-N	448.483	1.574	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1	804952509	PQENKSQFADFOMM-NSHDSACASA-N	428.434	1.380	50	20	IDGD	
Cc1nc(S(=O)(=O)NNC(=O)CSc2ccccc2O)c(Br)n1C	805052517	XJWVCUJORJINMR-UHFFFAOYSA-N	435.325	1.298	50	20	IDGD	
CCOC(=O)C1(S(C)(=O)=O)CCN(C(=O)NNC(=O)CCCc2ccccc2)CC1	805060266	XNRZQMLETBSSRR-UHFFFAOYSA-N	439.534	1.192	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)N1CCC[C@@H](CN(C)S(C)(=O)=O)C1	805369220	PTBNHMRGVARFGU-KBPBESRZSA-N	446.957	1.452	50	20	IDGD	
CC(C)(C(=O)NNC(=O)C(=O)Nc1cc(Cl)cc2c1OCC(=O)N2)c1ccccc1	806980357	WCWSBPVRFDUQDK-UHFFFAOYSA-N	430.848	1.735	50	20	IDGD	
O=C1COC[C@H](C[C@H]2CN(C(=O)C(=O)NNc3cc(Cl)ccn3)c3ccccc32)N1	807013229	LPYXHYQAEQNHGF-JSGCOSHPSA-N	429.864	1.214	50	20	IDGD	
COc1ccnc(NNC(=O)NCc2ccc(N3C(=O)N[C@](C)(C4CC4)C3=O)cc2)n1	807240035	MHQZCNGXRYBEHM-HXUWFJFHSA-N	425.449	1.536	50	20	IDGD	
CC(C)[C@H](NS(=O)(=O)c1ccc2ccccc2c1)C(=O)NNC(=O)N1CCN(C)CC1	807382979	XIRCAZGPMPABMG-IBGZPJMESA-N	447.561	1.131	50	20	IDGD	
COc1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2ccc(Cl)cc2F)cc1OC	810468464	QPTFWKYFQZLWKU-UHFFFAOYSA-N	445.856	1.236	50	20	IDGD	
O=C(NNC(=O)N1CCC[C@H](CNC(=O)C(F)(F)F)C1)c1cc(Br)c[nH]1	811851570	JFXNLJVLGIDWRA-MRVPVSSYSA-N	440.220	1.522	50	20	IDGD	
CCc1nc2ccc(Cl)cn2c1C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	812445844	BUGXECMSFJUMLB-UHFFFAOYSA-N	449.920	1.875	50	20	IDGD	
COc1ccc([C@@H](O)C2CCN(CC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)CC2)cc1	812857175	IBPKKXODLDWOKS-OAQYLSRUSA-N	442.472	1.810	50	20	IDGD	
O=C(NN=C1COC1)c1ccc(S(=O)(=O)N2CCN(Cc3ccccc3)CC2)cc1	814767769	UJVJVNFSSWFTIC-UHFFFAOYSA-N	428.514	1.309	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1ccn(-c2ccc(Br)cc2)n1	815572293	ZNFGASJELGLRFH-UHFFFAOYSA-N	432.238	1.515	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNc2ccccc2[N+](=O)[O-])nnn1CCOc1ccc(F)cc1	815573552	NIRHFIMPMFAVGU-UHFFFAOYSA-N	443.395	1.795	50	20	IDGD	
COC(=O)c1c(F)cccc1NNC(=O)c1cc(S(=O)(=O)N2CCCCC2)cn1C	819704609	BIRAIGBAXVRMMD-UHFFFAOYSA-N	438.481	1.882	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)NC[C@]1(N2CCOCC2)CCSC1	915257868	MSUDSCBGBGZNJE-GOSISDBHSA-N	428.942	1.501	50	20	IDGD	
O=C(NNC(=O)c1ccccc1F)c1ccc(C(=O)NNC(=O)c2ccccc2F)nc1	915806059	FLIDGGXTFIZYFY-UHFFFAOYSA-N	439.378	1.509	50	20	IDGD	
COC(=O)c1ccccc1S(=O)(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12	916102455	TWFFBNJFRXFTSL-UHFFFAOYSA-N	444.469	1.387	50	20	IDGD	
CO[C@@H](CNC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)c1ccccc1	916271838	GKMBBNQSRGGXCG-IBGZPJMESA-N	446.529	1.803	50	20	IDGD	
CN(C)c1ccc(CNC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cn1	916444584	YGVCLDHFGWLODM-UHFFFAOYSA-N	446.533	1.076	50	20	IDGD	
CCn1cnnc1CNC(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	916580506	HAYQYCDWJDWRIJ-UHFFFAOYSA-N	446.475	1.144	50	20	IDGD	
N#Cc1cccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c1	916968937	QXTYTNIYOXTYDF-UHFFFAOYSA-N	429.458	1.046	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)NCCCN(C)S(C)(=O)=O)N(C)c2ccccc21	919714234	XGCFOJNWGRWEFA-UHFFFAOYSA-N	433.534	1.055	50	20	IDGD	
O=C(C[C@H](NC(=O)c1ccccc1)c1ccccc1)NNC(=O)N[C@H]1CCS(=O)(=O)C1	919885350	OSXVIIBNDAZMRS-ROUUACIJSA-N	444.513	1.065	50	20	IDGD	
C=CC(=O)NCc1ccc(C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)cc1	919971914	AXIRCMPPSWNDAT-UHFFFAOYSA-N	433.468	1.854	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1cnc2c(c1)c(C1CC1)nn2-c1ccccc1	1115871235	ZLFHYLQOVUMVAX-CQSZACIVSA-N	439.497	1.494	50	20	IDGD	
Nc1cnnc(NNC(=O)CS(=O)(=O)Cc2cccc(Br)c2)c1Cl	1253123095	BQBBRHMDKFBUSI-UHFFFAOYSA-N	434.703	1.533	50	20	IDGD	
Cc1nn([C@H]2CCS(=O)(=O)C2)c(C)c1C=NNC(=O)c1nnc(-c2ccccc2)o1	1317992690	FXCNBIIQFXDPDS-HNNXBMFYSA-N	428.474	1.673	50	20	IDGD	
CO[C@H](CNC(=O)NNC(=O)c1sc(N2CCOCC2)nc1C)c1ccc(F)cc1	1319008200	WOISASJWLXJPAD-OAHLLOKOSA-N	437.497	1.759	50	20	IDGD	
Cc1ccc([C@H](CNC(=O)NNC(=O)c2cncn2-c2ccccc2)N2CCOCC2)o1	1323179348	ARIPOQGBYDXUIL-SFHVURJKSA-N	438.488	1.791	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NCc2ccc(Br)o2)cc1	1324312750	FBUIKGPYVGFJON-UHFFFAOYSA-N	431.268	1.982	50	20	IDGD	
CCS(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2cncn2-c2ccccc2)s1	1339565193	QWPXSBQHAKCWCU-UHFFFAOYSA-N	433.515	1.872	50	20	IDGD	
CC1=CC[C@@H](C(=O)N2CC[C@@]3(CN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)CCO3)C2)CC1	1778103076	XYZJIBOXALUOGH-UAZFOLIYSA-N	441.532	1.697	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](C)N3CSCSC3)C2)C1	1779147539	CCSLMQATBPJUMC-KEYYUXOJSA-N	438.015	1.113	50	20	IDGD	
CC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1	1780096678	DITYYVRKXYERBD-OAQYLSRUSA-N	447.444	1.333	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)C#CC3(O)CCCCC3)CCO2)C1	1781230710	YDLJYNHNDHYKRQ-AZUAARDMSA-N	431.360	1.751	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)C[C@H](O)CNC(=O)OC(C)(C)C)C2)C1	1781354414	FAVXBHFZUJSFHI-AVYPCKFXSA-N	447.960	1.109	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(F)nc3F)CCO2)C1	1783340471	YMLHPEWJINFETG-SJCJKPOMSA-N	432.265	1.977	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)CCOc3ccc(F)cc3)CCO2)C1	1783869055	NJXWYHBOOMGSDV-FXAWDEMLSA-N	428.888	1.678	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3CC(c4ccccc4)=NO3)[C@H]2C1	1784406907	DRSIQBATJIUTTM-GCLMUHHRSA-N	449.935	1.413	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cn3nnc4ccccc43)[C@H]2C1	1784896222	QZLYROJHPYFBMT-FPXQBCRKSA-N	433.940	1.819	50	20	IDGD	
Cc1noc(C)c1CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21	1785083428	JEISYIFXNYIEIU-ATVPRXPUSA-N	432.290	1.504	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]2C1	1787451383	LYDYPKJAVRYKIQ-YXWQFLTLSA-N	435.924	1.805	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)c1cc2c(s1)CCCC2	1788305057	KUPDZBNDJSLCIG-VGWMRTNUSA-N	426.966	1.820	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(NC(C)=O)c(O)c3)[C@H]2C1	1790306247	KCTNFKXRVHVMGK-GGXPGOJBSA-N	437.924	1.961	50	20	IDGD	
CCn1nc(C)cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]2C1	1791057288	KDKRVGJLCMJDJT-HOSILWTGSA-N	427.343	1.588	50	20	IDGD	
COC(=O)[C@H]1CCC[C@H](C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)C(Cl)Cl)C[C@@H]32)C1	1791247574	LASRWUIJWYWQIK-YTFOTSKYSA-N	435.348	1.749	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(C)c([N+](=O)[O-])cn3)C[C@@H]21	1791253900	FMBOSICYMCKAAE-WSMBLCCSSA-N	440.884	1.145	50	20	IDGD	
Cc1cc(CC(=O)NC2(c3ccc(NC(=O)CCC(=O)NN(C)C)cc3)CCC2)n[nH]1	1791601119	MEPQZEWQTXMEIC-UHFFFAOYSA-N	426.521	1.768	50	20	IDGD	
C=CC(=O)N[C@@H](C)C(=O)NC1(c2ccc(NC(=O)CCC(=O)NN(C)C)cc2)CCC1	1791601159	QNVVOSISAFWRDY-HNNXBMFYSA-N	429.521	1.184	50	20	IDGD	
Cc1nn(C)c(C)c1CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]21	1791636201	GGAWBDJYDKYWQV-JWWIWJDOSA-N	445.391	1.795	50	20	IDGD	
O=C(/C=C/c1cnc[nH]1)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1	1791775773	ALBTXYCHANPAAV-MDZDMXLPSA-N	430.273	1.551	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(C3CC3)on1)C2	1792867163	ZHDPXDPBJMGWQR-VFFTVRQLSA-N	426.311	1.786	50	20	IDGD	
COc1ccccc1CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)CBr	1792872117	MPDJVWXMCTVYSO-JNNRSPCRSA-N	439.350	1.858	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc([N+](=O)[O-])[nH]1)C2	1792872367	BHIRPSGVZVZGDQ-DYNIEEOBSA-N	429.271	1.157	50	20	IDGD	
Cc1cnn([C@H](C)C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)CBr)c1	1792873338	UGSLEJKEVQUDRX-DGXTUMSLSA-N	427.343	1.373	50	20	IDGD	
COc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)CBr)C3)cn1	1793567611	FFJDAXHZJGLHNG-ZIEJDFEHSA-N	426.311	1.324	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1ccccc1Cl	1795628712	ONPVJDUKQSBXGS-MUJYYYPQSA-N	441.919	1.833	50	20	IDGD	
C[C@H](Cc1ccc(F)cc1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1	1796193202	UEZRMDOPJKNQIK-ZHHJKBAOSA-N	438.308	1.636	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1n[nH]c3c1CCc1ncccc1-3)C2)[C@H](F)Cl	1796366540	ZWQVWRGQGJXZHA-WQKDULPXSA-N	433.871	1.308	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1nc(O)n2c1CCCC2	1797985580	RZJFWAKASMCBRZ-MAAUKKLOSA-N	445.347	1.365	50	20	IDGD	
COc1cc(OC)c(F)c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)C(Cl)Cl)C3)c1	1798547551	JKIKNLXEUYWCLB-KEODLESXSA-N	435.279	1.850	50	20	IDGD	
Cn1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@](C)(Cl)CCl)c(C(F)F)n1	1799275435	RVCPZBJWWUNWIW-SKCRNORWSA-N	439.290	1.797	50	20	IDGD	
N#CC1(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](Br)Cc2ccccc2)CC1	1800436580	YLIWHKPRCJJLEC-XMTFNYHQSA-N	446.345	1.886	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1C[C@H]1F)C2)[C@@H](Br)Cc1ccccc1	1800436709	NBPIQLWGOQLARJ-MULDDASSSA-N	439.325	1.940	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1C[C@@H]1F)C2)[C@H](Br)Cc1ccccc1	1800436714	NBPIQLWGOQLARJ-RFSXOUPVSA-N	439.325	1.940	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1n[nH]c3ccc(C#N)cc13)C2	1800761877	IHBTVLYNYPJRSR-VFFTVRQLSA-N	446.305	1.421	50	20	IDGD	
CC[C@@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1(N3CCN(C)CC3)CC1)C2	1801804393	ZFENOWMNDDTROC-YYIAUSFCSA-N	441.414	1.578	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)COCc2ccccc2)[C@@H]1c1cccnc1)[C@H](O)CCl	1803139114	STFAXJKFVWYDLY-QKNQBKEWSA-N	431.920	1.904	50	20	IDGD	
Cc1cccnc1C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1803806992	UGZDIOHJOMBJJY-AVRDEDQJSA-N	438.532	1.478	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2cn(C)nc2OC)[C@H]1c1cccnc1	1805308895	WPBBTIGOJAZHJF-BHYGNILZSA-N	435.912	1.397	50	20	IDGD	
O=C(c1ccc(-n2cnnc2)cc1)N1CCC2(CCCN(C(=O)[C@H](O)CCl)C2)CC1	1805519426	PNRXBKVGHBKBHG-GOSISDBHSA-N	431.924	1.712	50	20	IDGD	
CSCC(C)(C)C(=O)N1CCCC2(CCN(C(=O)c3ccc(B(O)O)cc3)CC2)C1	1806092801	CBXWOCZKBQTWIX-UHFFFAOYSA-N	432.395	1.600	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)CN2CCOCC2)[C@H]1c1cccnc1	1806913068	PPNNQCXPQRLBIT-QILLFSRXSA-N	439.354	1.203	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)c3ncccc3F)CC2)C1	1809977530	CLUQQDDOOWDVDI-UHFFFAOYSA-N	425.269	1.059	50	20	IDGD	
Cc1ccc(C(=O)N2CCC3(CCCN(C(=O)c4cccc(B(O)O)c4)C3)CC2)c(F)c1	1809980807	VEBOOAGBXDXFDR-UHFFFAOYSA-N	438.308	1.973	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)c1cnc2snnc2c1	1811342568	NEJORTNJPJNRFB-RCBQFDQVSA-N	446.920	1.401	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)[C@@H]2CCC(=O)N2C)[C@@H]1c1cccnc1	1812869187	SIGIDSORJJXKFB-PWXKEOIMSA-N	437.338	1.492	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2cn3ncccc3n2)[C@@H]1c1cccnc1	1813031288	SBEOMUDUMFDUDH-JTDSTZFVSA-N	442.907	1.698	50	20	IDGD	
CC(C)[C@H](S)C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1813069089	UZCXVONTEVTVMF-AHRSYUTCSA-N	435.594	1.415	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)Cc2ccncc2)[C@H]1c1cccnc1	1813073294	OGOIQWXEXJPMQO-CVDCTZTESA-N	438.532	1.098	50	20	IDGD	
CC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819402227	VPZHKGPAYBMUFY-INIZCTEOSA-N	427.465	1.083	50	20	IDGD	
O=C(/C=C/C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1)NCc1ccco1	1819532264	KFNSFGCFWVPHPB-BUWFCSEKSA-N	449.895	1.467	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccnn2)n[nH]1	1819714006	CBZOQORYXVCORI-GDQCRLHRSA-N	449.475	1.640	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)Cn2cc([N+](=O)[O-])cn2)CC1	1825128186	DBVUSRKGTCIYJD-DLBZAZTESA-N	441.916	1.665	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1sccc1F)CC2	1826083119	KCGMYWMHLYKSRF-JTQLQIEISA-N	439.538	1.943	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)CC2CCOCC2)CC1	1826733088	SSIGAVBLXMMNHF-QFIPXVFZSA-N	442.365	1.416	50	20	IDGD	
O=C(Cc1ccsc1)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827054826	MKSMHSXPOXWTLD-NRFANRHFSA-N	440.374	1.904	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)C1(O)CCC1)CCO2	1829731526	NRRNCTLVDKFNAF-IIDMSEBBSA-N	447.370	1.025	50	20	IDGD	
C[C@H](C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2)N1C[C@@H]2C[C@H]2C1	1830361995	IFIGXRPKEICFIP-JJDSTIRJSA-N	427.973	1.048	50	20	IDGD	
CN1C(=O)CC[C@H]1C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@H](F)Br)CC1	1830380426	NBPWNTDMFITFHW-YCPHGPKFSA-N	432.334	1.917	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H](F)Br)CC1	1830381006	DJKMZLWRMUNFEC-RHSMWYFYSA-N	449.365	1.670	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3C[C@H]4CC[C@@H]3O4)C2)C1	1830543896	HCGXHIMYQJWEBR-GMKVZWAMSA-N	445.354	1.041	50	20	IDGD	
CCC1(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)COC1	1831276150	QVOOBWGLHVSFCK-LJQANCHMSA-N	443.548	1.345	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cn4ccccc4n3)C2)C1	1831647481	VTIAAMRBWAMKRM-KKSFZXQISA-N	434.924	1.812	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(OC)cn3)C2)C1	1831647597	XYXYFOPSDMPCPG-OXJNMPFZSA-N	425.913	1.568	50	20	IDGD	
CNC(=S)NCCC(=O)N1CCC([C@H]2CCCCN2C(=O)[C@H](C)Br)CC1	1831654713	GRJWDRWAPFDIFC-DZGCQCFKSA-N	447.443	1.874	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(F)c[nH]2)CC1	1831708849	UHZXZMVAPHPLLK-IBGZPJMESA-N	442.495	1.699	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1	1831871438	QHLSZFRJPKWAQT-QGZVFWFLSA-N	447.536	1.099	50	20	IDGD	
C[C@H](Cn1cccn1)C(=O)N1CCC([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1	1831872049	MEJJGLDXTOCDNW-UYAOXDASSA-N	446.596	1.512	50	20	IDGD	
C[C@@H](C(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)CCl)CC2)CC1)n1cccc1C=O	1833310477	KSGBUHCTXKTEIM-KXBFYZLASA-N	438.956	1.033	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)CCN3CCOC3=O)CC2)CC1	1833532720	GTFNVLKQSYILAX-SFHVURJKSA-N	442.988	1.808	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3ccc(O)cn3)CC2)CC1	1834337839	LIMUOJHHOQOYBV-ZDUSSCGKSA-N	439.354	1.756	50	20	IDGD	
CC(C)N1CCC[C@H]1C(=O)N1CCOC[C@@]2(CN(C(=O)CCBr)CCO2)C1	1834826108	BHYUZSCXCXHMNH-QFBILLFUSA-N	446.386	1.101	50	20	IDGD	
C[C@@]1(C(=O)N2CCOC[C@@]3(CN(C(=O)CCBr)CCO3)C2)CC=CCC1	1834826326	LIKJPZIMJLYLAY-RTBURBONSA-N	429.355	1.974	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3c(O)cc(O)cc3O)CC2)CC1)[C@H](F)Cl	1835081479	SFJHAZVAPRLFNN-KRWDZBQOSA-N	429.876	1.523	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)c3cccnn3)CC2)CC1	1835891592	ZGOCZWNLLWRRMJ-CQSZACIVSA-N	438.370	1.693	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)Cn3cccn3)CC2)CC1)[C@H](F)Br	1836412466	HRJLEAQVZMJULH-INIZCTEOSA-N	430.322	1.145	50	20	IDGD	
CC[C@H](C)[C@H](O)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](F)Br)CC2)CC1	1836414169	XECFJGGAILHZEQ-VBNZEHGJSA-N	436.366	1.656	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC(OC2CCN(C(=O)Cc3cnc[nH]3)CC2)CC1	1836670168	BFMPACSHMVDJBT-CQSZACIVSA-N	441.370	1.982	50	20	IDGD	
C[C@H](C(=O)N1CCC(OC2CCN(C(=O)[C@@H](F)Br)CC2)CC1)n1cncn1	1838647947	ARCYJTRHKWQEJX-IUODEOHRSA-N	446.321	1.528	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccc(OC)cc3C#N)CCO2)C1	1839133010	XUUZMRWZJZJKMO-DENIHFKCSA-N	449.935	1.583	50	20	IDGD	
Cc1ccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)cc1[N+](=O)[O-]	1839189299	VDJWKYCFLMGOBR-PKOBYXMFSA-N	443.859	1.437	50	20	IDGD	
O=C(CCCC(F)(F)F)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839198458	DUKXGRWHQCUQLG-OCCSQVGLSA-N	449.239	1.866	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)CCO2)C1	1839354875	YHYVIXAWLNIFTG-LPHOPBHVSA-N	443.859	1.821	50	20	IDGD	
C[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1)[S@@](=O)c1ccccc1	1839672448	KLNUIWJGCHKHFW-ITPVJGHXSA-N	446.928	1.174	50	20	IDGD	
C=C(C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1)C(F)(F)F	1839893994	CJUNHQBPRMFLGV-MFKMUULPSA-N	433.196	1.252	50	20	IDGD	
O=C(Cc1ccccc1O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1839908903	GAJWAOCLRGULPC-WMZOPIPTSA-N	445.285	1.082	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccnc(C)c3)C2)C1	1839965399	XNESEKVLFPEZLS-QFBILLFUSA-N	440.338	1.634	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3(CC)COC3)C2)C1	1839966350	BNNLWPMHRZIKMX-KDOFPFPSSA-N	433.343	1.043	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)nc1C	1840031325	MKUDULJMCUANJQ-AUUYWEPGSA-N	440.338	1.552	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(F)s3)C2)C1	1840031490	RRGXMZVKTCPHHV-BZNIZROVSA-N	435.315	1.741	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(F)c(F)c3)C2)C1	1840034337	IHJCIBZABIHWQL-SGTLLEGYSA-N	447.276	1.818	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(F)c3F)C2)C1	1840034567	PRYKNDOLOKUYHG-KPZWWZAWSA-N	447.276	1.818	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)c3ccc(C)cc3)C2)C1	1840155654	GBIMKJKUQBYNRG-ZWCUEREDSA-N	438.952	1.809	50	20	IDGD	
O=C(c1cc[nH]c2nccc1-2)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840187587	LEMYBWLXLZFZMU-GOSISDBHSA-N	427.288	1.388	50	20	IDGD	
CN1CCc2cc(C(=O)N3CCOC[C@]4(C3)CN(C(=O)C(Cl)Cl)CCO4)ccc21	1840188363	FYYWGUOMNQIQFH-FQEVSTJZSA-N	442.343	1.553	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)C3CCC(O)CC3)CCO2)C1	1840272113	GWKWGZUMURFQSP-QAVIERHMSA-N	447.370	1.025	50	20	IDGD	
CCSc1cccnc1C(=O)N1CCCC12CN(C(=O)c1cccc(B(O)O)c1)C2	1844846289	OOFBVXGNGXBAFY-UHFFFAOYSA-N	425.319	1.004	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)N2CCCC23CN(C(=O)[C@H](O)CCl)C3)C1	1845128612	SNUFKSHXOAVUDD-LSDHHAIUSA-N	429.945	1.437	50	20	IDGD	
CC(=O)N/C(=C\c1ccco1)C(=O)N1CCCC12CN(C(=O)[C@@H](F)Br)C2	1845442141	UNCFFMFTJRNPMG-YLHGKKIISA-N	428.258	1.651	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC2(CCCN2C(=O)[C@@H]2CCCOC2)C1	1847030656	FJSHNRPBWIONJV-CABCVRRESA-N	429.945	1.749	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)n(C)n1	1848095649	IZRKRPRACBBSQF-KKUMJFAQSA-N	439.944	1.676	50	20	IDGD	
O=C(C[C@@H](C(=O)O)c1ccccc1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	13254716	NBVFHMMCGPCYFX-GOSISDBHSA-N	445.497	1.491	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)c1ccc(S(=O)(=O)N2C[C@H](C)O[C@@H](C)C2)cc1	15692591	VCBHMPSJQACACN-HOTGVXAUSA-N	431.514	1.868	50	20	IDGD	
CCOc1ccc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)[C@H](C)NC(C)=O)cc2)cc1	21776184	VYFRKDYUEGBRLM-ZDUSSCGKSA-N	448.501	1.172	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(Cl)c(S(=O)(=O)NNC(=O)CC(C)C)c1	728260163	CNZQCYDDYUPIRL-UHFFFAOYSA-N	425.960	1.726	50	20	IDGD	
CC(C)COc1ncccc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	728455663	NFODOUQVJFPJPW-UHFFFAOYSA-N	446.529	1.976	50	20	IDGD	
O=C(NNS(=O)(=O)c1cccc(C(=O)NC2CC2)c1)c1cccc(OC(F)F)c1	728510807	VBXDAIUORFRLCV-UHFFFAOYSA-N	425.413	1.804	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(F)cc1C(F)(F)F)C1CCN(c2ncccn2)CC1	728854536	XJHHUYYDKPSBMG-UHFFFAOYSA-N	447.414	1.861	50	20	IDGD	
CN(CCCOc1cccc(S(C)(=O)=O)c1)C(=O)NNC(=O)c1cccc(C#N)c1	728954282	WCLZLOJLJLCSEV-UHFFFAOYSA-N	430.486	1.717	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)c2cc(S(N)(=O)=O)c(Br)s2)c1	728985243	DINJNNIGJOJETI-UHFFFAOYSA-N	429.277	1.104	50	20	IDGD	
CCC(CC)N1C[C@@H](C(=O)NNC(=O)c2ccc(CSc3nncn3C)cc2)CC1=O	729297052	RPBGIFPXPBOVQF-INIZCTEOSA-N	444.561	1.906	50	20	IDGD	
CC[C@H](NC(=O)NNC(=O)[C@@H](C)Oc1ccc(F)cc1)c1cccc(S(N)(=O)=O)c1	729612188	BJGBUELYVPWNIB-PXAZEXFGSA-N	438.481	1.722	50	20	IDGD	
CC[C@@H](NC(=O)NNC(=O)[C@H](C)Oc1ccc(F)cc1)c1cccc(S(N)(=O)=O)c1	729612191	BJGBUELYVPWNIB-YVEFUNNKSA-N	438.481	1.722	50	20	IDGD	
C[C@H]1COCCN1CCNC(=O)NNC(=O)COc1ccccc1Cc1ccccc1	729614865	SRLASAROHHIUDA-SFHVURJKSA-N	426.517	1.707	50	20	IDGD	
NC(=O)c1cc(C(=O)NNC(=O)c2ccc(Br)s2)nn1-c1ccccc1	732259042	KNLRVGWGXGWPAI-UHFFFAOYSA-N	434.275	1.870	50	20	IDGD	
CN(C)S(=O)(=O)c1ccsc1C(=O)OCC(=O)NNC(=O)c1ccc(Cl)cc1	732366864	LIBJQWHVERTDCF-UHFFFAOYSA-N	445.906	1.270	50	20	IDGD	
CCOCCCn1c(NNC(=O)c2ccc3c(c2)OCC(=O)N3)nc2ccccc2c1=O	733268920	VBLANVMNJMLQJI-UHFFFAOYSA-N	437.456	1.911	50	20	IDGD	
CCc1nc(COc2ccc(C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)cc2)no1	734418877	JBGIMICXNVJHHJ-UHFFFAOYSA-N	434.416	1.262	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNc3cc(F)c(F)cc3F)CC2)cc1	734552453	SAWONKCCOPYXEC-UHFFFAOYSA-N	442.463	1.862	50	20	IDGD	
Cc1cccc(C2(C(=O)NNc3ncccc3S(=O)(=O)N3CCN(C)CC3)CC2)c1	735116843	IGHQOUNSXHLFKZ-UHFFFAOYSA-N	429.546	1.501	50	20	IDGD	
CC[C@@H](Cc1cccc(Br)c1)C(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1	735271379	BKXOVGYVKSKUIG-GXTWGEPZSA-N	432.340	1.535	50	20	IDGD	
COc1ccc(CC(=O)NNc2c(F)cccc2F)cc1S(=O)(=O)N1CCOCC1	735692934	STENETRQBQKKJI-UHFFFAOYSA-N	441.456	1.680	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)N2C[C@@H](C)C[C@@H](C)C2)c1	739667535	PMKRPVRFBWNMAL-GASCZTMLSA-N	446.595	1.174	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)c1ccc(CNC(=O)C(C)(C)C)cc1	741693217	MAECWPKJGOXUAA-UHFFFAOYSA-N	435.525	1.818	50	20	IDGD	
O=C(CN1C(=O)c2cccc([N+](=O)[O-])c2C1=O)NNC(=O)c1cccc(Br)c1	742771383	REGAOVGUWVAKIZ-UHFFFAOYSA-N	447.201	1.415	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)NNC(=O)c2cccc(Br)c2)ccc1OC	742771415	SVIHQJZAUCDDNL-UHFFFAOYSA-N	442.291	1.441	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)NC[C@](C)(O)C2CC2)cc1	743776071	WNXZJTABPSJSDV-NYURDRINSA-N	437.500	1.618	50	20	IDGD	
C#CCNS(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccc(OC(F)F)cc2)c1	743832769	AKQPYCWGUFPIAQ-UHFFFAOYSA-N	438.412	1.666	50	20	IDGD	
O=C(COC(=O)c1ccc(OC2CCOCC2)cc1)NNC(=O)c1ccc([N+](=O)[O-])cc1	745249387	ITYIHLBXXKOOLO-UHFFFAOYSA-N	443.412	1.771	50	20	IDGD	
CCc1ccc(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)cc1[N+](=O)[O-]	746689142	RPYUXNUAQCYLEB-UHFFFAOYSA-N	447.517	1.850	50	20	IDGD	
O=C(CCc1nc(-c2ncccn2)no1)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1	748518973	UNHUWEVSSKVDTJ-UHFFFAOYSA-N	442.379	1.896	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2ccsc2C(=O)NNC(=O)C(=O)N2CCCC2)cc1	749851050	YQDVYXORQPGTON-UHFFFAOYSA-N	436.515	1.241	50	20	IDGD	
O=C(NCC(=O)N1CCN(c2ccc(Cl)cc2)CC1)NNC(=O)c1ccccc1O	750334471	CFQGECVZIASVDY-UHFFFAOYSA-N	431.880	1.338	50	20	IDGD	
Cc1cc(=O)oc2cc(OCC(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)ccc12	750603017	ZVEWGRTUCSLCBH-UHFFFAOYSA-N	433.461	1.933	50	20	IDGD	
CCOC(=O)[C@@H]1Cc2cc(S(=O)(=O)NNC(=O)NCCc3cccs3)ccc2O1	751541331	WIBDXWTYPWZKNO-INIZCTEOSA-N	439.515	1.350	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H]2CCOC2)c1	752703306	HNTZWAKYQYYOPN-CQSZACIVSA-N	434.474	1.229	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)[C@@H](CCS(C)(=O)=O)NC(=O)OCc2ccccc2)o1	752781205	JLRHLFCXWWXAIQ-OAHLLOKOSA-N	437.474	1.079	50	20	IDGD	
CCn1cc([C@@H]2C[S@](=O)CCN2C(=O)NNC(=O)c2cccc(OC(F)F)c2)cn1	753130509	MICCTJMJIHIHAM-INCQDFKNSA-N	441.460	1.664	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNS(=O)(=O)c2cc(Cl)cnc2N)CC1	754754000	DRHUENDXUIWANM-UHFFFAOYSA-N	448.933	1.209	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H]2[C@H]3CCO[C@H]3C23CCCC3)c1	755088498	MQBXVJITVIBFBM-BRWVUGGUSA-N	436.534	1.229	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)NCC(=O)NNc2ccc(C(F)(F)F)nn2)cc1	755188943	BLISSFUUOLPPFY-UHFFFAOYSA-N	447.395	1.094	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2ccc3c(c2)OCCCO3)cc1	755453790	UAXOTVBJSMVGAC-UHFFFAOYSA-N	448.501	1.630	50	20	IDGD	
COC(=O)CNC(=O)Cc1ccc(NC(=O)NNC(=O)c2cc(Cl)ccc2O)cc1	755863915	YMVBIZYGTHUEIX-UHFFFAOYSA-N	434.836	1.344	50	20	IDGD	
COc1cc(CN2CC[C@@H](NC(=O)NNC(=O)COc3ccc(F)cc3)C2)cc(OC)c1	756093324	FRYUAPUYESIRKT-QGZVFWFLSA-N	446.479	1.827	50	20	IDGD	
N#CCc1ccc(OCc2ccccc2NC(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)cc1	756113075	YANVEMMYBPSOLZ-QGZVFWFLSA-N	442.497	1.919	50	20	IDGD	
COCCS(=O)(=O)c1ccc(NC(=O)NNC(=O)COc2ccc(Cl)cc2)cc1	756555775	VREPBBDXKDKSEM-UHFFFAOYSA-N	441.893	1.992	50	20	IDGD	
O=C(COc1ccccc1-c1ccccc1)NNC(=O)NCC1CCS(=O)(=O)CC1	756754258	PFJSRERCACRPLO-UHFFFAOYSA-N	431.514	1.888	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)C2(CNC(=O)OC(C)(C)C)CCCC2)C[C@H](C)O1	757371203	MTIZBGJFPXLREO-HOTGVXAUSA-N	426.558	1.718	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)n1	758732448	PVWINDWIFPMCJC-UHFFFAOYSA-N	431.430	1.317	50	20	IDGD	
Cc1nc(COc2cccc(C(=O)OCC(=O)NNC(=O)c3cccc(C#N)c3)c2)no1	758775886	JSGUNCRUKVCWLT-UHFFFAOYSA-N	435.396	1.447	50	20	IDGD	
COCCOc1cc(C(=O)NNC(=O)CCN2C[C@H](C)O[C@@H](C)C2)nc2ccccc12	760119182	ATKUXMOHOUTKDX-HOTGVXAUSA-N	430.505	1.520	50	20	IDGD	
CCn1c(SCC(=O)OCC(=O)NNC(=O)Cc2nc(C)cs2)nc2ccccc21	760168691	WHNGSCZVULYHKH-UHFFFAOYSA-N	447.542	1.847	50	20	IDGD	
NC(=O)[C@H](Cc1ccc(Cl)cc1)NNC(=O)CCN1CCN(c2ccccc2)CC1	760576661	KHLMGVNAFCXBJW-FQEVSTJZSA-N	429.952	1.570	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)CCNC(=O)[C@@H]2CCCN2C(=O)OC(C)(C)C)c1	760798440	HDWUZTMMLPQKQM-KRWDZBQOSA-N	448.520	1.427	50	20	IDGD	
Cn1cc(-n2cc(C(=O)NNc3ccccc3S(=O)(=O)NC(C)(C)C)ccc2=O)cn1	760915254	IFMNMZZBZAZXAH-UHFFFAOYSA-N	444.517	1.405	50	20	IDGD	
CN1CC[C@H](CNC(=O)NN[C@]2(C)CCS(=O)(=O)C2)[C@@H]1c1ccc(Cl)c(F)c1	763091486	KSAOEBGMWZKCFC-RPVQJOFSSA-N	432.949	1.853	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)[C@H]3CS[C@]4(C)CCC(=O)N34)n[nH]2)cc1OC	763149026	NTQQSCVFMNGMRV-JLTOFOAXSA-N	445.501	1.309	50	20	IDGD	
O=C(NNC(=O)c1ccncc1)C(=O)Nc1ccc(C(=O)NCc2ccc(F)cc2)cc1	763464915	QILROODOAWFZDJ-UHFFFAOYSA-N	435.415	1.550	50	20	IDGD	
O=C(CN1CCCCCC1)Nc1cccc(NC(=O)C(=O)NNC(=O)c2ccncc2)c1	763467014	QCXQXEBYQLRHKC-UHFFFAOYSA-N	438.488	1.296	50	20	IDGD	
O=C(NNC(=O)c1ccccc1Br)C(=O)Nc1ccc(-n2ccnc2)nc1	763482930	OKPHPRQVVRJVFI-UHFFFAOYSA-N	429.234	1.430	50	20	IDGD	
CC(=O)NNC(=O)C(=O)Nc1ccc(C(=O)OC[C@H]2CCCN2C(=O)OC(C)(C)C)cc1	763516495	JRKJPNVMVCBJFB-MRXNPFEDSA-N	448.476	1.349	50	20	IDGD	
CCOc1cc2c(cc1NC(=O)C(=O)NNC(=O)[C@@H]1COc3ccccc3O1)O[C@@H](C)C2	763574876	LEYYMAQNFGDWGA-BUXKBTBVSA-N	441.440	1.335	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2c(C)nc3ccccn23)c(OCCN(C)C)c1	763630384	YRYGZAJADWAODV-UHFFFAOYSA-N	438.488	1.291	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(NC(C)=O)c(Cl)c1	763648754	VCNKKMOXCRDJGW-UHFFFAOYSA-N	434.836	1.472	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)C(=O)Nc1cccc(-c2noc(C3CC3)n2)c1	763681129	KJVMSHFJMKIKNT-UHFFFAOYSA-N	439.403	1.918	50	20	IDGD	
CCN1CCC(n2nccc2NC(=O)C(=O)NNC(=O)COc2ccc(C)c(C)c2)CC1	763681233	UQGXDRBTIKFRBD-UHFFFAOYSA-N	442.520	1.322	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccc(C(=O)OC)c1C	763681856	JWEHNYKXJLXKGV-UHFFFAOYSA-N	429.429	1.345	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)C(=O)Nc2cc(C)cc(C)c2)cc1	763738696	WPBQQIYSYRLJLT-UHFFFAOYSA-N	432.502	1.018	50	20	IDGD	
CS(=O)(=O)c1c(F)cc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCC3)cc1F	763782152	PJMIFQAQYYHGPD-UHFFFAOYSA-N	443.453	1.318	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)C(=O)Nc2cccc(C)c2C#N)c2ccccc2c1=O	763804627	NSOQMSNDVHNUST-UHFFFAOYSA-N	446.467	1.776	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)C(=O)Nc1ccccc1OCC1CC1	763804653	OIUQMBQLVSRXLF-UHFFFAOYSA-N	428.401	1.549	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(-n2cccn2)c(Cl)c1	763813698	NSKJVBVZGLVDPM-UHFFFAOYSA-N	438.831	1.562	50	20	IDGD	
COc1ccc(OC(C)C)c(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)c1	763814086	OTJXRKOBEJLIMQ-UHFFFAOYSA-N	426.429	1.519	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(C)c(C(=O)NC(C)C)c2)cc1	763820308	FINVCHUOSNXQMU-UHFFFAOYSA-N	426.473	1.607	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccc(=O)n(Cc2ccccc2)c1	763839032	DOCIXRNHMOZKTJ-UHFFFAOYSA-N	438.415	1.201	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)C(=O)N(C)CC3)c1C	763849657	LRCHHMQOOCRWDP-HNNXBMFYSA-N	438.484	1.485	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)COc2ccccc2Br)cc1	763859724	JDBPQLQBFKEYDT-UHFFFAOYSA-N	432.230	1.704	50	20	IDGD	
C[C@@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)Cc3ccc(Cl)cc3)cn2)C[C@@H](C)O1	763936087	CMINCGAHCGOHQK-ZIAGYGMSSA-N	445.907	1.677	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc(COc3ccccc3)o2)nn1CCC#N	763955224	KHFZADNGCAIFDB-UHFFFAOYSA-N	436.428	1.677	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccc3c4c(cccc24)CC3)c1	764077271	LQLZERMTHBXSBB-UHFFFAOYSA-N	437.477	1.742	50	20	IDGD	
CCOC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(C)cc2O)cc1C#N	764110619	RTRQBNPHLGFRQK-UHFFFAOYSA-N	425.401	1.540	50	20	IDGD	
C[C@@H](c1cccc(NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)c1)N1CCOCC1	764243104	LZEICKALYGYYMH-KRWDZBQOSA-N	449.511	1.821	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2scnc2C)cc1N1CCCCC1=O	764247113	UQFBIUBSXPZCTF-UHFFFAOYSA-N	431.474	1.377	50	20	IDGD	
C[C@@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3cccc4ncccc34)cc2)CCO1	764257448	GWLCXGNLUONMSL-OAHLLOKOSA-N	433.468	1.860	50	20	IDGD	
O=C(Cc1ccccn1)NNC(=O)C(=O)Nc1cccc(C(=O)N2CCc3ccccc32)c1	764263675	HSJKNHFSBOUTIC-UHFFFAOYSA-N	443.463	1.613	50	20	IDGD	
C[C@H]1CN(c2ccccc2NC(=O)C(=O)NNC(=O)COc2ccccc2O)C[C@@H](C)O1	764278117	RNAPBVJILLJPJH-GASCZTMLSA-N	442.472	1.171	50	20	IDGD	
Cc1ccc(Oc2ccc(NC(=O)C(=O)NNC(=O)COCc3ccccc3)cc2)nn1	764364057	ZPAMARWGQFXUBY-UHFFFAOYSA-N	435.440	1.880	50	20	IDGD	
CCNS(=O)(=O)c1ccc(CNC(=O)NNC(=O)COc2ccccc2CC)cc1	764375073	UVNRZDQVCHEKSK-UHFFFAOYSA-N	434.518	1.457	50	20	IDGD	
Cc1nc(-c2ccc(NC(=O)C(=O)NNC(=O)c3cc(-c4ccc(F)cc4)[nH]n3)cc2)n[nH]1	764389062	XPDWTSDEFYGFHM-UHFFFAOYSA-N	448.418	1.709	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)CSc2ccccc2OC)cc1F	764393607	REPPFDUBMCPSBN-UHFFFAOYSA-N	435.433	1.499	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)CCC(=O)N2CCN(c3ccccn3)CC2)c1	764525489	SMLZJCJEPNTQDM-UHFFFAOYSA-N	439.516	1.354	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1ccc(C#N)cc1)C(=O)NNC(=O)c1ccc(Cl)cc1Cl	764573013	NERLATGFQORBFZ-SNVBAGLBSA-N	441.296	1.993	50	20	IDGD	
C[S@@](=O)c1ccc(C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)cc1	765757860	XVKQMSQDSGUBRQ-SSEXGKCCSA-N	448.976	1.656	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)Cn2cc(Br)cc([N+](=O)[O-])c2=O)cc1C	767209332	VKGARACFVTUCCN-UHFFFAOYSA-N	443.279	1.913	50	20	IDGD	
CC(=O)N[C@H](CC(=O)OCC(=O)NNC(=O)Cc1ccccc1C)c1ccc(F)cc1F	767349487	XNPSVWKYKLAUQM-LJQANCHMSA-N	447.438	1.774	50	20	IDGD	
O=C(NNC(=O)c1ccccc1O)C(=O)Nc1ccc(Cc2nnc3n2CCCCC3)cc1	768232068	JUTQNGNOXBZMLZ-UHFFFAOYSA-N	448.483	1.701	50	20	IDGD	
C[C@@H](C(=O)NNc1c(F)cc(C(=O)NC2CC2)cc1F)S(=O)(=O)C1CCOCC1	768242649	HCWQNAYDPDMGRN-JTQLQIEISA-N	431.461	1.282	50	20	IDGD	
Cc1c([N+](=O)[O-])cccc1S(=O)(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	771608106	RODVHWZGDCYYEQ-UHFFFAOYSA-N	426.838	1.183	50	20	IDGD	
CC(C)c1ncc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)s1	772951115	VUKWUGSJVUSUEA-UHFFFAOYSA-N	438.531	1.362	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)c1nccc2c(S(N)(=O)=O)cccc12	772994224	JODNSOUSCVRTTJ-LLVKDONJSA-N	448.888	1.764	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)c1cnc(Oc2ccccc2)cn1	773325643	UPLUPBNIZJQMMD-UHFFFAOYSA-N	425.832	2.000	50	20	IDGD	
COc1cc(C#N)ccc1OCC(=O)NNC(=O)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	773415224	MVEAYXRDEYMHOL-OAHLLOKOSA-N	432.477	1.740	50	20	IDGD	
COC(=O)NCc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)cc1	774010051	VCEQCFRIGABTEL-GFCCVEGCSA-N	448.863	1.749	50	20	IDGD	
O=C(NNC(=O)N1CC[C@@]2(C1)C(=O)Nc1ccccc12)C1CCN(c2ncccn2)CC1	777508229	MAHNWSNXWIPIFW-QFIPXVFZSA-N	435.488	1.030	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@H](C)NC(=O)CC(C)(C)C)CC2)cc1	778998376	SXQWBZYMELIXHC-SFHVURJKSA-N	431.581	1.201	50	20	IDGD	
COC(=O)CN1CCN(c2ccc(NC(=O)NNc3cccc(C(=O)OC)c3)cc2)CC1	780562922	PNUVZWGHVSVJGT-UHFFFAOYSA-N	441.488	1.917	50	20	IDGD	
CCOC(=O)c1cc(F)c(F)cc1NC(=O)C(=O)NNc1cccc(S(C)(=O)=O)c1	784839886	SDYHZOLBLNWJLF-UHFFFAOYSA-N	441.412	1.627	50	20	IDGD	
CC(=O)N1CCN(Cc2cccc(NC(=O)C(=O)NNc3cc(F)c(F)cc3F)c2)CC1	784886889	VGNGNRUHDPYURM-UHFFFAOYSA-N	449.433	1.850	50	20	IDGD	
CN(c1ccccc1NC(=O)C(=O)NNc1cccc(C(F)(F)F)n1)S(C)(=O)=O	784951870	BMRPECARAVICOQ-UHFFFAOYSA-N	431.396	1.578	50	20	IDGD	
CC(=O)N(C)c1cccc(NC(=O)C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)c1	785100237	UJCNCPOOYHOUTF-UHFFFAOYSA-N	445.426	1.922	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc4c(c3)NC(=O)CO4)n[nH]2)c1	785129678	PSINXVNVWGQJBQ-UHFFFAOYSA-N	448.439	1.424	50	20	IDGD	
COC(=O)CCc1cccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)c1	786413552	BUJLWCOIQBXMRA-INIZCTEOSA-N	441.484	1.962	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@H]2CCCN2c2ccccc2)cc1	786639661	NOHTYFWORVYKFL-LJQANCHMSA-N	430.530	1.432	50	20	IDGD	
CCNC(=O)Nc1ccc(C)c(NC(=O)C(=O)NNc2ccc(S(C)(=O)=O)cc2)c1	787555974	LKNJRVBWFGLXGQ-UHFFFAOYSA-N	433.490	1.622	50	20	IDGD	
O=C(CCC(=O)N1CCN(c2ccccn2)CC1)NNc1nnc(-c2ccccn2)s1	788558540	OECIPLWPHHYFBO-UHFFFAOYSA-N	438.517	1.567	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)c1cccc(NN2C(=O)[C@H]3CC=CC[C@@H]3C2=O)c1	788619494	RFLGMGINOYKUSV-ROUUACIJSA-N	449.423	1.948	50	20	IDGD	
CC(C)Oc1cc(NC(=O)C(=O)NNc2ccnc(Br)c2)ccc1C(N)=O	789763856	RDBGELFDORKXML-UHFFFAOYSA-N	436.266	1.812	50	20	IDGD	
Cn1nc([C@@H]2CCCOC2)cc1NC(=O)C(=O)NNC(=O)C1=S=C2CCCCCC2=C1	790952933	XYABHQPTGUCRHZ-CQSZACIVSA-N	445.545	1.382	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1N1CCOCC1)c1ccc2c(c1)OCCO2	791012695	QUESCWAPSATJHD-UHFFFAOYSA-N	428.401	1.277	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(OCC(=O)NNc2ncccc2C)c([N+](=O)[O-])c1	791210695	AQDYPCWIDXYPNT-UHFFFAOYSA-N	437.478	1.851	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NCCCCn2cc(Br)cn2)cc1	792225602	JYERWDHEAQRJOY-UHFFFAOYSA-N	440.298	1.844	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NC[C@H](C)NC(=O)OC(C)(C)C)c2ccccc2c1=O	792250295	JMXUIRNPFQDXBC-LBPRGKRZSA-N	432.481	1.274	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1cccc(Cl)c1Br	792266892	DTLJUHVIPKRFDJ-UHFFFAOYSA-N	442.653	1.973	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNS(=O)(=O)c2cnc(C)c(C(=O)OC)c2)cc1	793350252	KERFDNFMWHVZEI-ZDUSSCGKSA-N	437.474	1.352	50	20	IDGD	
CC(C)(C)C(=O)Nc1nccnc1C(=O)NNC(=O)CNC(=O)OCc1ccccc1	794075138	LOULHVQBHCKQOB-UHFFFAOYSA-N	428.449	1.149	50	20	IDGD	
Cn1cc(-c2cc(F)ccc2NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)cn1	796992051	LDOXAFXXEZDTBS-GOSISDBHSA-N	439.403	1.152	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2cc(N3CCOCC3)ccc2C)c1	797535552	NUKQIINKGZUTMB-UHFFFAOYSA-N	440.500	1.613	50	20	IDGD	
COC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2cccc(OC)c2O)c1OC(C)C	799258596	HCMVVIIQTDPBAL-UHFFFAOYSA-N	445.428	1.374	50	20	IDGD	
N#Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)ccc1OC(F)(F)F	799834427	MBVJQSWXROJYHJ-UHFFFAOYSA-N	437.290	1.765	50	20	IDGD	
Cc1c(NC(=O)NNC(=O)[C@H]2COc3ccccc3O2)nnn1Cc1ccccc1F	801804585	NUTFRTAMNBWENL-QGZVFWFLSA-N	426.408	1.767	50	20	IDGD	
Cn1cc(S(=O)(=O)N2CCCCC2)cc1C(=O)NNC(=O)Nc1cc(F)cc(F)c1	802002580	TWGVZZWIKJERBS-UHFFFAOYSA-N	441.460	1.944	50	20	IDGD	
O=C1C[C@@H](Cc2ccc(C(=O)NNC(=O)Nc3ccc(OC(F)F)cc3)cc2)C(=O)N1	802044930	GZHMCDJLIUFADT-CYBMUJFWSA-N	432.383	1.960	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2ccc(=O)n(-c3ccc(F)cc3)n2)cc1	802068018	WSEMFLXUSQLOTM-UHFFFAOYSA-N	445.432	1.242	50	20	IDGD	
CS(=O)(=O)Nc1cc(C(=O)NNC(=O)Nc2ccc3c(c2)OCO3)ccc1Cl	802103922	MHRZUZGEPRPQJU-UHFFFAOYSA-N	426.838	1.907	50	20	IDGD	
Cc1ccc(/C=C(/C#N)C(=O)OCC(=O)Nc2cc(C)nn2[C@H]2CCS(=O)(=O)C2)cc1	802399575	CXWPHJNJAMEGLO-BHEJFATLSA-N	442.497	1.948	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)c2ccnc3c2ncn3C)c2ccccc2c1=O	805152219	NQBWLJMSWTYWMJ-UHFFFAOYSA-N	433.472	1.943	50	20	IDGD	
CC1(C)CC(=O)c2cc(NC(=O)C(=O)NNC(=O)c3cc(Br)c[nH]3)ccc2O1	806976921	OGYAALSTBUNMKL-UHFFFAOYSA-N	449.261	1.921	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(NC(=O)C(=O)NNc2ncccc2C(F)(F)F)ccc1F	806995608	XUVWAVVDAUZKJS-UHFFFAOYSA-N	449.386	1.572	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C)c(C)c(NC(=O)C(=O)NNc2ncccc2F)c1	807301703	FVSBDUVQCNMEGJ-UHFFFAOYSA-N	437.497	1.950	50	20	IDGD	
O=C(NNc1cccc(F)n1)C(=O)Nc1ncn(Cc2cccc(Br)c2)n1	807390346	ANOGEMCQSSQCLX-UHFFFAOYSA-N	434.229	1.705	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NC2C[C@@H]3CC[C@H](C2)N3CC(=O)N(C)C)cc1C	807514668	MPQUAETZMTXKBQ-AYHJJNSGSA-N	431.537	1.096	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NC[C@@]2(C)OCCc3sccc32)c2ccccc2c1=O	812551206	VNTVOTODLKVCFU-OAQYLSRUSA-N	441.513	1.910	50	20	IDGD	
Cc1nc2ccccc2n1CCNC(=O)NNC(=O)c1csc(N2CCOCC2)n1	813496510	YEIYAIPBNSYHRM-UHFFFAOYSA-N	429.506	1.282	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)CCc2ccco2)nnn1CCOc1ccc(F)cc1	815568895	YCRVCPWUPQZBMB-UHFFFAOYSA-N	444.423	1.116	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2O)cc1)C1CC1	815569245	LWIDNWXZGRJNLQ-UHFFFAOYSA-N	426.429	1.072	50	20	IDGD	
CS(=O)(=O)c1ccc(Oc2ccc(NC(=O)C(=O)NNc3ncncc3F)cc2)cc1	815764715	RYWHFKLVMUMWMM-UHFFFAOYSA-N	445.432	1.893	50	20	IDGD	
CN(NC(=O)c1cc(C#N)cc(N(C)C)c1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	816087968	SIVGUMNKXSXQER-UHFFFAOYSA-N	430.509	1.874	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNS(=O)(=O)c1ccc2c(c1)NC(=O)CO2	818788558	PXSSTEHORCMXNU-ZDUSSCGKSA-N	441.465	1.948	50	20	IDGD	
O=C(C1CCN(S(=O)(=O)c2c(Cl)cccc2Cl)CC1)N1CC[C@H](B(O)O)C1	864232943	DISZRABPXIWYPG-LBPRGKRZSA-N	435.138	1.469	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)[C@@H]2CS[C@H](Cc3ccccc3F)C(=O)N2)c1	888346190	BFHTVWMUABJAKU-RBUKOAKNSA-N	445.516	1.812	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)[C@@H]1CC[C@H](C(F)(F)F)NC1=O	914829709	NHLUYTGSIBWVJV-GHMZBOCLSA-N	438.200	1.432	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)CSCc1ccc(C#N)cc1	916134179	DWXKCQRFTGCTSP-UHFFFAOYSA-N	431.543	1.854	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)NCC(C)(C)N2CCN(C)CC2)cc1OC	916258707	DXVDLSVUWYOILX-UHFFFAOYSA-N	435.569	1.844	50	20	IDGD	
CCOc1cc(C=NNC(=O)C(N)=O)ccc1OCc1cc([N+](=O)[O-])cc2c1OCOC2	916274299	KWFXMMRJZFJFPL-UHFFFAOYSA-N	444.400	1.374	50	20	IDGD	
O=C(NCCCn1cccn1)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	916376788	HZQUNOGZLJZIEN-UHFFFAOYSA-N	448.530	1.780	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H](CN2CCCC2=O)c2ccccc2)c1	916463396	ZMNGYKVOHRVPIW-GOSISDBHSA-N	444.513	1.398	50	20	IDGD	
C[C@@H](CN1CCOCC1)NC(=O)NNC(=O)[C@H](C)Oc1cccc(Br)c1	916470110	JKVMDPZYJURHDY-STQMWFEESA-N	429.315	1.268	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@@H]2CCN(c3ccc(F)cc3)C2)c1	920046510	LVTOSLANVGZDTK-AWEZNQCLSA-N	434.493	1.700	50	20	IDGD	
O=C(COC(=O)CN1C(=O)CSc2ccccc21)NNC(=O)c1cccc([N+](=O)[O-])c1	921180141	ISBSTPZHRZJXHW-UHFFFAOYSA-N	444.425	1.038	50	20	IDGD	
O=C(O)COc1ccc(S(=O)(=O)NNC(=O)c2ccc(Br)cc2)cc1F	1325425090	UNKHINJEKNMSGT-UHFFFAOYSA-N	447.238	1.675	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)Cn2cnc3sccc3c2=O)CC1	1339190719	PUHHLTVQCRIHLU-UHFFFAOYSA-N	435.506	1.253	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnc4ncccn34)C2)C1	1777930169	NCRVIICSPKVKQD-ACJLOTCBSA-N	436.310	1.204	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2)c1cncc2cnccc12	1780013866	GXEHPNRVAPQQFV-DBXWQHBBSA-N	432.908	1.357	50	20	IDGD	
O=C(c1cc(Br)ccc1O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1780556686	NPXVPNLKNKFOFH-WMLDXEAASA-N	447.713	1.198	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(CO)c(F)c3)CCO2)C1	1781234788	ZCLIGTUKUAQDGG-RBUKOAKNSA-N	433.307	1.998	50	20	IDGD	
O=C(Cc1cccnc1Cl)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781325695	HMKNDBMXHZIWKM-XJKSGUPXSA-N	434.693	1.798	50	20	IDGD	
O=C([C@H](F)Br)N1CC[C@]2(C1)CN(C(=O)C(Cl)(Cl)Cl)CCO2	1781332939	GGWOPLKXVQJUNH-XVKPBYJWSA-N	426.497	1.877	50	20	IDGD	
COc1cccc(OC)c1C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781333648	HSQCOUCENNYDCK-YJBOKZPZSA-N	445.285	1.838	50	20	IDGD	
COc1cc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](C)Br)C2)nn1C	1782002988	AKLYDQODLUQLLO-RVZJWNSFSA-N	443.342	1.340	50	20	IDGD	
CCCNC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](Cl)COC)C1	1782172322	SXJWBUUVHGTQCP-JXXFODFXSA-N	431.961	1.061	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](C)NC(=O)c3ccccn3)C2)C1	1782665874	CCBJYCTXLSHUEW-CKJXQJPGSA-N	436.940	1.437	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)CCc3cc(F)ccn3)CCO2)C1	1783529807	NPUDTGBSCLETDQ-FZKQIMNGSA-N	428.302	1.767	50	20	IDGD	
Cc1ncncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]2C1	1783970171	NXLBQNFMLFDGDT-MZGVZZPPSA-N	425.327	1.409	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCCc3ccccc3F)C[C@@H]21)[C@H](O)CCl	1784083961	ILOSPAPMDCTDJZ-DKKFBQAASA-N	426.916	1.728	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(F)cn3)[C@H]2C1	1786215724	ZGYDXBNRTWYDRS-ZIEJDFEHSA-N	428.302	1.988	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnn4ccc(C)cc34)[C@H]2C1	1787373601	FESULIBGIVIPHD-XPYUAMARSA-N	434.924	1.490	50	20	IDGD	
COC(=O)Nc1cccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]3C2)c1	1787448595	AWSBMKKGRPEVPI-TUUVXOQKSA-N	427.860	1.993	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CC3CCCC3)C[C@@H]21	1787509104	ZUEKAZIIXNHZMP-QXDWZXEQSA-N	443.548	1.680	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccn4ccnc4c3)[C@H]2C1	1788358321	VCAGYMAMSWOQCZ-HJWJTTGWSA-N	449.349	1.959	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnn4c(C)cc(C)nc34)C[C@@H]21	1789860021	RPTMIFVWNHABGK-OWLYRPNTSA-N	433.940	1.957	50	20	IDGD	
Cn1cccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]3C2)c1=O	1789867570	FYCHVLAGWNZFJF-VFSPDHHESA-N	430.332	1.215	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(CO)o3)C[C@@H]21	1790961106	WKWUMUMHRZPPIO-ZIEJDFEHSA-N	429.311	1.539	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3cncnc3)C[C@@H]21	1790961751	PWGXEESYDMBKCP-NXOAAHMSSA-N	439.354	1.562	50	20	IDGD	
Cc1cnn([C@@H](C)C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)Br)C[C@@H]32)c1	1791597908	FIVSFQQQWGYSFR-YXMSTPNBSA-N	427.343	1.516	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc3c1OCC3)C2	1792867668	FNYCXSUOSCGEMV-JJAZEVLHSA-N	437.334	1.856	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cn1ccc2c(F)cccc21	1792928908	RZBHUECSUKSQQN-IDLUEMFASA-N	437.899	1.624	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(S(C)(=O)=O)cn1	1794748949	BAJYHASLKPDRAH-QDMKHBRRSA-N	439.610	1.588	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1[nH]nc2ncccc12	1796216990	SCFXOHKKBZESJW-ZSMOCIRGSA-N	426.304	1.397	50	20	IDGD	
Cn1c(=O)n(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)C(Cl)Cl)C3)c2ccccc21	1797750286	OSLDOVDGYLDZSE-CLLJXQQHSA-N	425.316	1.782	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@](C)(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](O)CCl)C3)C1	1797757896	NICAUCCHCJSSDU-CKBPBPHLSA-N	443.972	1.871	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(-n2cccn2)nc1	1798213792	AKULNHKBDSIYFN-JJAZEVLHSA-N	448.321	1.254	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(C)n(CC)n1	1798232584	PCPLSERIHZOGEQ-FQLMCAECSA-N	427.343	1.588	50	20	IDGD	
CSc1ncccc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)Br)C2	1798329883	MPKKGFZFLKQLHS-FMSGJZPZSA-N	428.352	1.790	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(Cl)cc2nn[nH]c12	1798620210	XDWJCZHZAKOAFX-FJHTZYQYSA-N	442.303	1.068	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccn(-c2ccccc2)n1	1798698717	XQHGHANDARMDAE-LORHWOILSA-N	432.908	1.329	50	20	IDGD	
COc1ccnc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)C(C)(C)CCl)C3)c1OC	1798765217	VKXZXANTDFXMBX-AGGWBTHJSA-N	425.913	1.567	50	20	IDGD	
C#CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](Cl)CC	1799273849	ROCXHTGOECIKHU-ZHCJQAHYSA-N	441.956	1.510	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1c[nH]c2cccc(OC)c12	1800004388	YWYWWBOZKMSUQS-QPWUGHHJSA-N	435.908	1.634	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc[nH]c3nccc1-3)C2	1800639811	NPDYJWZLQOGIFD-VZAMPYOESA-N	435.322	1.891	50	20	IDGD	
CC(C)(C)OC(=O)N1CC2(C[C@H]2C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Cl)C3)C1	1800707609	GQUMJAPYQJHYFT-AIEDFZFUSA-N	445.919	1.367	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ncn(-c3ccccc3)n1)C2	1800758220	VCEYREGOWOHNIS-HGTKMLMNSA-N	448.321	1.254	50	20	IDGD	
O=C(CSc1ccccc1[N+](=O)[O-])N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2	1800908300	MWQGVPXAKJWCQM-OJXGSEEGSA-N	431.873	1.811	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c(Cl)ccc3c1OCO3)C2	1800978714	ZDCHLZRXKLZUEE-DDFXLWFNSA-N	445.299	1.526	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCc1cnc2[nH]ccc2c1)c1ccc(B(O)O)cc1	1802095164	UGMKAUQVMWLQKU-WKCHPHFGSA-N	446.316	1.127	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)c1cc(Cl)cnc1O	1802331704	YQQZDQDCRNFOEH-MAZHCROVSA-N	439.299	1.755	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cc1ccc([N+](=O)[O-])cc1F)C2	1802338672	YUNCTTKAKHZKIS-MUJYYYPQSA-N	449.483	1.288	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)C(Cl)Cl)[C@H]1c1cccnc1)c1cccc(=O)n1O	1804951683	PGUIBYPZEYBHJA-DOMZBBRYSA-N	425.272	1.604	50	20	IDGD	
Cc1nscc1C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1805192979	MYAUIRVOZQJZRK-JXFKEZNVSA-N	444.561	1.539	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CC(F)(F)F)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1	1807370338	ARRJKYITRAVDSI-MAUKXSAKSA-N	435.211	1.033	50	20	IDGD	
COc1nn(C)cc1C(=O)N1CCCC2(CCN(C(=O)[C@H](F)Br)CC2)C1	1807977219	NOPJXZNISXEAKB-ZDUSSCGKSA-N	431.306	1.964	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)c1n[nH]c2c1CCCC2	1808041066	RAAZHULQAYNJJP-UCLAIMLFSA-N	431.924	1.603	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H](CNC(=O)CCN2CCOC2=O)[C@H]1c1cccnc1	1809532626	NMOHKMPRSUFXRU-YLJYHZDGSA-N	448.596	1.781	50	20	IDGD	
CC(C)(F)C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1	1810302447	KFJWUXILOBCJOQ-YOEHRIQHSA-N	428.468	1.148	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)N1CC[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]1c1cccnc1	1810546005	KPSCDOVTSHTXIU-HHXXYDBFSA-N	449.628	1.647	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)[C@H]2[C@H]3SC=C[C@H]32)[C@@H]1c1cccnc1	1812385963	ASNJHUIIZCZBSE-HZDRLRHHSA-N	443.573	1.336	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@H](O)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](F)Cl)[nH]n1	1814795644	GTQDSGYUQMVHHQ-SGMGOOAPSA-N	447.895	1.822	50	20	IDGD	
COC(=O)[C@H]1CC[C@H](C(=O)N2CCCC[C@@H]2c2cc(NC(=O)[C@H](O)CCl)n[nH]2)CC1	1814866982	BQKPKRBYLBLMFQ-RRCSTGOVSA-N	440.928	1.981	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)c3cc(O)n[nH]3)sc2C1	1815217358	DMVHZMIMRCVISM-JGVFFNPUSA-N	428.312	1.971	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(O)n[nH]3)sc2C1	1815217359	DMVHZMIMRCVISM-SFYZADRCSA-N	428.312	1.971	50	20	IDGD	
Cc1nnc(CC(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@@H](C)Br)CC3)o1	1815494884	GTBGSPHCALCVTG-APPZFPTMSA-N	428.312	1.773	50	20	IDGD	
Cc1occc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1816436537	VODJOPDXVMEBFH-KRWDZBQOSA-N	437.460	1.929	50	20	IDGD	
Cc1cc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)[nH]n2)on1	1816473353	MJTOYUYGKACAJD-HNNXBMFYSA-N	438.448	1.324	50	20	IDGD	
C=CCC(F)(F)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1	1817475777	SUNUARLSRPBULE-INIZCTEOSA-N	432.236	1.607	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@H](O)CCl)CC2)c1ccc2c(c1)CNC2=O	1819362758	FWWZHVAWRPKKQQ-BXUZGUMPSA-N	434.905	1.212	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819401670	NHRHGSSPTOJHGX-OAHLLOKOSA-N	447.927	1.979	50	20	IDGD	
C[Si](C)(C)OCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(C(=O)O)ncn1)CC2	1820160852	HIDGDSPZQFGJIC-JTQLQIEISA-N	449.565	1.709	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](O)CCl)CC2)c1cc2ncsc2[nH]1	1820217168	QVYNQUNGKSOKMF-CPCISQLKSA-N	425.923	1.906	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CN2C(=O)C=CC2=O)[nH]n1	1820869095	PVAWKHINIGGYGF-KZULUSFZSA-N	442.303	1.563	50	20	IDGD	
CC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](C)N1CCN(C)CC1)CC2	1822849040	FPSYFAQXXJMBAC-MCIONIFRSA-N	428.002	1.708	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](O)CCl)CC2)c1cnc2ccc(F)cn12	1824268959	RGUHOOWQTVSGCT-GXFFZTMASA-N	437.884	1.755	50	20	IDGD	
O=C(COc1ccccc1F)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)CCl)CC2	1825455216	QAKURUUWNZFYAI-MFKMUULPSA-N	427.885	1.873	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)c2ccns2)CC1	1825676868	WKPJKGYWTCNBFA-SFHVURJKSA-N	427.335	1.370	50	20	IDGD	
Cc1nocc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1	1826041860	IDWVNHBIZXHLFS-FQEVSTJZSA-N	425.294	1.210	50	20	IDGD	
CCc1oncc1C(=O)N[C@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1	1826080495	NLHXYOOOLODSMN-NSHDSACASA-N	434.522	1.292	50	20	IDGD	
CN[C@@H](CC(=O)N1CCCC[C@@H]1C1CCN(C(=O)CO[Si](C)(C)C)CC1)C(=O)O	1826947040	SBBBDFFUPMWFBG-DLBZAZTESA-N	427.618	1.520	50	20	IDGD	
O=C(C1CCSCC1)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827060014	LYKLWGORKKRLLN-OAQYLSRUSA-N	444.406	1.743	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC([C@H]2CCCCN2C(=O)Cn2cnnn2)CC1	1827193218	QWOFMFAENDWQKB-UKRRQHHQSA-N	427.347	1.324	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C34CC(C(=O)OC)(C3)C4)C2)C1	1831657969	RUPCTCJGORSSGE-DTBAYKQASA-N	442.940	1.194	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3CCN(CC)CC3)C2)C1	1831658399	DSFXWJUNNIYXSL-WIYYLYMNSA-N	429.989	1.582	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCc2ccc[nH]2)CC1	1831870584	AQJSXDXDZJAYML-HXUWFJFHSA-N	431.581	1.940	50	20	IDGD	
Cc1nn(C)cc1C(=O)NC1CCN(C2CCN(C(=O)CO[Si](C)(C)C)CC2)CC1	1833582384	ZPHQWFFFTDGDQY-UHFFFAOYSA-N	435.645	1.765	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(N2CCC(NC(=O)[C@@H]3C[C@@H]3F)CC2)CC1	1833632463	QUEKKIVALUJTGR-UTMDGHJCSA-N	446.527	1.050	50	20	IDGD	
O=C(CCc1cn[nH]c1)NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1833813338	XSWMHHYWBYVREA-QGZVFWFLSA-N	444.349	1.604	50	20	IDGD	
Cc1ccn(CC(=O)NC2CCN(C3CCN(C(=O)[C@@H](C)Br)CC3)CC2)n1	1833854643	IFTUHSAQEMNQPY-OAHLLOKOSA-N	440.386	1.547	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1)c1ccc[n+]([O-])c1	1833910068	KZWPJVJUAXTKFF-MRXNPFEDSA-N	443.317	1.196	50	20	IDGD	
CCc1oncc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)Br)C2)C1	1834522120	FPGIPCVZHREZSP-SJCJKPOMSA-N	430.299	1.090	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3ccccc3C(N)=O)CC2)CC1	1836450591	OHKWXKYDZVKKAC-LJQANCHMSA-N	434.968	1.988	50	20	IDGD	
CC(=O)N[C@@H](C(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1)C(C)(C)C	1836713326	DQNGPFBNELPNOM-MSOLQXFVSA-N	445.988	1.136	50	20	IDGD	
Cc1ncccc1CCC(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836714903	BXQZKRUXVBZVFK-FQEVSTJZSA-N	437.968	1.921	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc3[nH]ccc3n1)CCO2	1836906146	CFBSEYMNKNDQLZ-OAQYLSRUSA-N	446.580	1.484	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)Nc1ccccn1)CCO2	1837738724	XXPBDHJBKWNBPD-FIKGOQFSSA-N	438.956	1.746	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(F)n1)CCO2	1837907711	AMFPSZLFLPHKDS-IBGZPJMESA-N	425.533	1.142	50	20	IDGD	
CCn1nc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)cc1C	1838152619	OVRVDIIQOQSOHG-KSSFIOAISA-N	443.342	1.065	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1839021438	JTMIEFZNRWHCEL-QAPCUYQASA-N	435.279	1.953	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](NC(C)=O)C(C)(C)C)C2)C1	1839141705	QJZHIXJFJJBESK-RZQQEMMASA-N	431.961	1.011	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CSc3ccncc3)C2)C1	1839142205	JHLUIOBYRFWCLZ-VQIMIIECSA-N	427.954	1.648	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cn4c(F)cccc4n3)C2)C1	1839148091	LXXXXSNKVZQBJB-XOBRGWDASA-N	438.887	1.561	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cccs3)C2)C1	1839152399	YCYNAWUGNATEAD-QZTJIDSGSA-N	435.373	1.983	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)c(F)c1	1839261864	ZUUUWSLEUQTTCG-CRAIPNDOSA-N	447.276	1.895	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cncc(F)c3)C2)C1	1839963372	IWPFQDWGHWXAOW-YJBOKZPZSA-N	444.301	1.464	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc[nH]c3C)C2)C1	1839963978	BMLKQGHCOXOXOF-MAUKXSAKSA-N	428.327	1.567	50	20	IDGD	
CCc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](Cl)COC)CCO3)cc(C)n1	1840152772	SLTBNBVYNYOJNI-WIYYLYMNSA-N	439.940	1.276	50	20	IDGD	
CCOc1ccccc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](Cl)COC)CCO2	1840154197	PCHPVUIAZFXMAU-DYESRHJHSA-N	440.924	1.409	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(CN(C(=O)CC[C@@H]3CCOC3)CCO2)C1	1840588770	POYLOXYERGRJMJ-YLJYHZDGSA-N	428.602	1.111	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)COc3ccccc3C#N)CCO2)C1	1840818781	WYFOIDFICMAMEU-PGRDOPGGSA-N	449.935	1.801	50	20	IDGD	
COc1ccc([N+](=O)[O-])c(C(=O)N2CCCC23CN(C(=O)[C@H](F)Br)C3)n1	1843586538	MFUWVFYIMJRWGU-LBPRGKRZSA-N	431.218	1.506	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)c1ncoc1C)C2	1844692735	FMIBTIGEKIHGLD-UHFFFAOYSA-N	428.401	1.947	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H]1C(=O)N1CC2(CCCN2C(=O)[C@H](F)Br)C1	1845216237	DHWWHHBXKWSDMF-NEPJUHHUSA-N	434.306	1.890	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)c2ccc(NC(=O)C3CC3)cc2)C1	1845285601	WOVUEUPFBVDZDJ-UHFFFAOYSA-N	441.532	1.225	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)c2c(F)ccc(Cl)c2F)C1	1846867068	LNAPVSGJXSFBHO-UHFFFAOYSA-N	434.635	1.429	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)C(=O)c1ccco1	1848095579	AHMCIEDDCUCLKH-IHRRRGAJSA-N	439.896	1.796	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cncc(S(C)(=O)=O)c1	1848329550	MJWBQMQIZMBPCQ-KKUMJFAQSA-N	444.351	1.474	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)c2ccc(CCNS(C)(=O)=O)cc2)cc1OC	16201380	RGXREIDKYCSFRX-UHFFFAOYSA-N	435.502	1.260	50	20	IDGD	
Cc1cccc2c(=O)n(CC(=O)NNC(=O)COc3ccc(Br)cc3)cnc12	16225681	JOOBMYFXTXTGQU-UHFFFAOYSA-N	445.273	1.694	50	20	IDGD	
CCCn1c(C)cc(/C=C(\C#N)C(=O)O[C@H](C)C(=O)N(C)[C@@H]2CCS(=O)(=O)C2)c1C	16793208	KBNBUOKVBDJPOC-AZPZLGTESA-N	435.546	1.999	50	20	IDGD	
Cc1ccc(CNC(=O)N[C@@H](CC(C)C)C(=O)NNC(=O)CNC(=O)c2ccco2)cc1	725741670	UCLAEFWZXMFRKD-KRWDZBQOSA-N	443.504	1.379	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NC1CCN(Cc2ccc(F)cc2)CC1	725873412	MTYVDQFZNKCEQD-UHFFFAOYSA-N	433.509	1.612	50	20	IDGD	
O=C(NNC(=O)[C@@H]1C[C@H]2CCCC[C@H]2N1C(=O)c1cccc(Cl)c1)C(=O)N1CCCC1	726161930	YNRJPOVTQNUIMB-OLMNPRSZSA-N	446.935	1.883	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2ccc(Cl)cc2O)c(C(=O)OC)s1	726520779	NKAAGBSANURRHE-UHFFFAOYSA-N	448.862	1.304	50	20	IDGD	
COc1ccc(CN2C[C@@H](C(=O)NNC(=O)COc3ccccc3OC)CC2=O)cc1	726621193	QFFUFLYLRNQXPT-INIZCTEOSA-N	427.457	1.279	50	20	IDGD	
COc1cc(F)c(S(=O)(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)c(F)c1	726765302	YQUCOLUXAYIFBT-UHFFFAOYSA-N	448.473	1.198	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)CCc3ccc(C#N)cc3)cc2)CC1	728214435	PAPNXAPMZCNCGL-UHFFFAOYSA-N	427.530	1.570	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)NCCN2CCOCC2(C)C)N(C)c2ccccc21	728282481	BAXMDCXDYZBYPE-UHFFFAOYSA-N	425.533	1.884	50	20	IDGD	
CC(C)(C)CC(=O)NNC(=O)c1ccc(C(=O)NNC(=O)CC(C)(C)C)c([N+](=O)[O-])c1	728606977	RZRCKZMZKKHHCN-UHFFFAOYSA-N	435.481	1.989	50	20	IDGD	
N#Cc1ccc(SCC(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1	728675302	BLQFMPFQJQPRDX-KRWDZBQOSA-N	427.438	1.181	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCC2(N3CCCC3)CCOCC2)cc(OC)c1OC	729623441	LOGUFPHGZVTBID-UHFFFAOYSA-N	436.509	1.301	50	20	IDGD	
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)COc1ccccc1O	730779490	BCHMKOZMLUOTGO-SFHVURJKSA-N	438.484	1.783	50	20	IDGD	
COc1cc(C=NNC(=O)c2ccccc2OC)ccc1OCC(=O)N1CCOCC1	731488455	GJYYRTPOPABOCZ-UHFFFAOYSA-N	427.457	1.705	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2cc(Br)c3c(c2)OCCO3)C[C@H](C)O1	732260202	PTVYRHKMUZPAOK-RYUDHWBXSA-N	442.310	1.481	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)NCCCCN1C(=O)c2ccccc2C1=O	732471302	INNCCYGMCMLEDP-UHFFFAOYSA-N	428.420	1.611	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@H](C(=O)NNC(=O)C(=O)NC(C)C)C2)c2ccccc12	732644588	XQYNQFPEWQIGPK-HNNXBMFYSA-N	440.500	1.373	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2ccc(-n3nc(C)cc3C)c(F)c2)n1	732689868	VZPWBPIVZRJMGL-UHFFFAOYSA-N	445.476	1.940	50	20	IDGD	
Cc1c(C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)cnn1-c1ccc(F)cc1F	734241482	GSTNGFYEKZHVLJ-UHFFFAOYSA-N	438.435	1.928	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)NCc1cc(S(N)(=O)=O)ccc1F	734674271	SKPZDIKFHSDVIK-UHFFFAOYSA-N	430.845	1.279	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NN=C(C)c1ccc(S(=O)(=O)NCc2ccco2)cc1	740762417	PXXJNBFHKQPQHQ-UHFFFAOYSA-N	434.518	1.903	50	20	IDGD	
O=C1C[C@@H](Cc2ccc(C(=O)NNC(=O)c3ccc(Br)s3)cc2)C(=O)N1	743291510	QHSLZTIPTCUMOG-LLVKDONJSA-N	436.287	1.791	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C[C@@H](C)/N=C2/NS(=O)(=O)c3ccccc32)cc1	743320783	RBPARIOKONQESH-CQSZACIVSA-N	444.513	1.293	50	20	IDGD	
C[C@H]1C[C@H](C)CN(S(=O)(=O)c2ccc(C(=O)NNc3ncnc4[nH]cnc34)cc2)C1	743471560	OHYICQBIJVIXHM-STQMWFEESA-N	429.506	1.776	50	20	IDGD	
O=C(CCc1nc(-c2ccccn2)no1)NNC(=O)c1cc(Br)ccc1O	743731989	GUJKVWXLIZSRKG-UHFFFAOYSA-N	432.234	1.994	50	20	IDGD	
CCC[C@H](C)N1C[C@@H](C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)CC1=O	744619042	FWRNIFQGAWZVNE-HOTGVXAUSA-N	438.550	1.188	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)NCCNS(=O)(=O)c3cccs3)cc2C1	746701190	FOKZYUHTXBJIKZ-LLVKDONJSA-N	442.588	1.857	50	20	IDGD	
C[C@H](CCNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)N(C)Cc1ccccc1	746774228	NFMYSEJZAQPROU-GOSISDBHSA-N	439.564	1.934	50	20	IDGD	
Cc1cccc(NS(=O)(=O)c2ccc(C(=O)NNc3nccn(C)c3=O)cc2)c1C	747941828	PPQNLKHSZLOAOL-UHFFFAOYSA-N	427.486	1.955	50	20	IDGD	
Cn1ccc(CNC(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)c1	747953189	BPYAZELKSAKMMB-UHFFFAOYSA-N	430.472	1.871	50	20	IDGD	
COc1ccc(CC(=O)NNc2cccc(C#N)c2)cc1S(=O)(=O)N1CCOCC1	748031143	PQPLHKDPBSXDTC-UHFFFAOYSA-N	430.486	1.274	50	20	IDGD	
N#Cc1cccc(NNC(=O)c2ccc3c(c2)S(=O)(=O)N(C[C@@H]2CCCO2)C3=O)c1	748031638	YBMDFXVMLBTWMY-INIZCTEOSA-N	426.454	1.639	50	20	IDGD	
CC[C@H](Oc1ccccc1F)C(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1	748285913	MHLRJLNTFLYPCE-KRWDZBQOSA-N	437.493	1.760	50	20	IDGD	
C[C@@H](CC(N)=O)NC(=O)/C(C#N)=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	748719523	PEVLSKRPKBRAOJ-IGVUGNCQSA-N	428.880	1.366	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1CN(CC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)CC2	750057652	TTWHCWMTVFSWQU-RDJZCZTQSA-N	447.492	1.830	50	20	IDGD	
NC(=O)[C@H]1CC(C(=O)NNc2nc(Br)cn3ccnc23)=NN1c1ccccc1	750247826	UXXQRUJWWISKNL-GFCCVEGCSA-N	443.265	1.055	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNS(=O)(=O)c2ccc3[nH]c(=O)ccc3c2)cc1	751142860	UFTDJAVYBKZQSV-CYBMUJFWSA-N	431.470	1.704	50	20	IDGD	
CCOC(=O)[C@@H]1Cc2cc(S(=O)(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)ccc2O1	751538426	JYMAFTQGTXMEIR-INIZCTEOSA-N	435.414	1.085	50	20	IDGD	
N#Cc1ccc(S(=O)(=O)N2CCC(C(=O)NNc3cc(Cl)nc(N)n3)CC2)cc1	753453203	BDRQFVXZIJKDKZ-UHFFFAOYSA-N	435.897	1.128	50	20	IDGD	
Cc1nc2c(C(N)=O)cnn2c(C)c1CCC(=O)NNc1ccc(-c2ccccc2)nn1	754473230	GOAMDLWYXJZVEJ-UHFFFAOYSA-N	430.472	1.978	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2cc([N+](=O)[O-])cc(Cl)c2F)n1	754988471	NQDJVVFUCNBGJL-UHFFFAOYSA-N	430.801	1.699	50	20	IDGD	
CCc1nn(C)c(CC)c1CNC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	755081934	DHBCUSIHHWISCV-UHFFFAOYSA-N	441.580	1.588	50	20	IDGD	
CC(C)(C)S(=O)(=O)N1CCC(NC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)CC1	755898532	IFYJICGKARRPPC-UHFFFAOYSA-N	427.483	1.132	50	20	IDGD	
CN1CCC/C1=N/S(=O)(=O)c1cccc(NC(=O)NNC(=O)c2ccc(C#N)cc2)c1	756028757	HNRNPGOTFJJPTR-BWAHOGKJSA-N	440.485	1.838	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)CN2C(=O)N[C@]3(C[C@@H](C)C[C@@H](C)C3)C2=O)c1	756863299	IEAHUOQUUMWEDV-YEZVWNJWSA-N	430.505	1.576	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)c2ccc(C)c(S(=O)(=O)NCC#N)c2)c(OC)c1	757187000	JUNPVDQSDSZTJE-UHFFFAOYSA-N	432.458	1.349	50	20	IDGD	
NC(=O)c1ccc(NNC(=O)Cc2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2)nn1	757398267	FMGBSMOBZPKWQM-UHFFFAOYSA-N	444.448	1.201	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)Nc1c(-c2cnn(C)c2)nc2ccccn12	757666294	RVCHCUPYYINOFR-UHFFFAOYSA-N	435.444	1.975	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)Nc2cncnc2OC)c2ccccc2c1=O	757690149	KBZBMZMFCIMIED-UHFFFAOYSA-N	425.449	1.852	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1cc(Br)ccc1N1CCCC1	757710698	MHUPZBKVXCNPOE-SNVBAGLBSA-N	448.343	1.140	50	20	IDGD	
CCOC(=O)Cn1cccc(NC(=O)NNC(=O)[C@@H](C)Oc2ccc(C(C)=O)cc2)c1=O	757765579	SXRXTMAOWBWWIK-CQSZACIVSA-N	444.444	1.234	50	20	IDGD	
COc1ccc(C(C)(C)C(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1OC	758156705	BUVATTJDTVLYAP-UHFFFAOYSA-N	434.518	1.736	50	20	IDGD	
Cc1nn(CC(F)(F)F)cc1C(=O)N1CCN(S(=O)(=O)CBr)CC1	758511592	BLTUXCMOYYFUFT-UHFFFAOYSA-N	433.250	1.194	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)[C@@H]1CC(=O)N(C)[C@@H]1c1ccc(Cl)c(F)c1	759154476	UMZYOCRYJCVQOE-MLGOLLRUSA-N	426.876	1.451	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2cc(C(=O)NNc3ncc(F)cn3)ccc2Cl)C[C@H](C)O1	760922064	AUZBDAHXRUSXEK-QWRGUYRKSA-N	443.888	1.824	50	20	IDGD	
Cc1ccc(C(=O)N2CCSCC2)cc1NC(=O)C(=O)NNC(=O)c1ccccc1	763424484	BEWCCBYYZPZDEB-UHFFFAOYSA-N	426.498	1.584	50	20	IDGD	
CN(Cc1ncc(-c2ccccc2)[nH]1)C(=O)NNC(=O)c1csc(N2CCOCC2)n1	763537935	KNAVZVSDZWTOIT-UHFFFAOYSA-N	441.517	1.856	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)sc(C)c1CC	763552098	WICMRFZFRADRDM-UHFFFAOYSA-N	447.469	1.924	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)[nH]n1)C(=O)Nc1ccn(CCc2ccncc2)n1	763604266	KPAUQDBJXCUUCL-UHFFFAOYSA-N	444.455	1.311	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)[nH]n1)C(=O)Nc1ccnn1CCc1ccccc1	763604934	QLFCOQLVIQLBLR-UHFFFAOYSA-N	443.467	1.916	50	20	IDGD	
CCn1cnnc1-c1cccc(NC(=O)C(=O)NNC(=O)COc2cc(C)cc(C)c2)c1	763646163	CDSMBHRIMIHSJS-UHFFFAOYSA-N	436.472	1.747	50	20	IDGD	
CCOC(=O)c1c(F)cccc1NC(=O)C(=O)NNC(=O)COc1cc(C)cc(C)c1	763649980	PBSJGVGVDRRGPI-UHFFFAOYSA-N	431.420	1.784	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)cc1	763722822	KMDRPJOYTYWNJI-UHFFFAOYSA-N	429.473	1.541	50	20	IDGD	
Cc1ccn(-c2ccccc2NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)n1	763745672	HXOMDSBZMPNFAN-UHFFFAOYSA-N	432.484	1.719	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)C(=O)Nc2cc(C(F)F)ccc2Cl)c2ccccc2c1=O	763789714	BAIGKKTYDQWFFZ-UHFFFAOYSA-N	449.801	1.924	50	20	IDGD	
Cc1c(F)cccc1NC(=O)C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	763797490	UBCRXWNHNHMRPK-UHFFFAOYSA-N	448.476	1.318	50	20	IDGD	
C=CCNC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)cc1	763848301	BLQXRBMCNNJSMH-CYBMUJFWSA-N	443.435	1.687	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cccc3c2oc(=O)n3C)ccc1OC(C)C	763915679	DGYNEEURIUOBKX-UHFFFAOYSA-N	442.428	1.327	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)C(=O)Nc1cc(F)c(I)c(F)c1	763997223	ZACMZYZOROGQEB-UHFFFAOYSA-N	448.167	1.308	50	20	IDGD	
CCOC(=O)N(C)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1	764003233	ADIYJQOKUUHMMW-UHFFFAOYSA-N	442.428	1.450	50	20	IDGD	
CCOC(=O)c1cc(CC)sc1NC(=O)C(=O)NNC(=O)c1ccc2c(c1)OCCO2	764004679	QHNVSHWKJKTYSN-UHFFFAOYSA-N	447.469	1.658	50	20	IDGD	
COc1ccc(NC(C)=O)cc1NC(=O)C(=O)NNC(=O)c1ccc(Cl)cc1OC	764011577	JJZACVQFWOVAJM-UHFFFAOYSA-N	434.836	1.715	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)on1)C(=O)Nc1ccc(CN2CCCC2=O)cc1	764017115	QYVVXGNROKUTBD-UHFFFAOYSA-N	447.451	1.864	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cc3c(cc2Br)OCCO3)cc1	764177150	KQGSUPZKBJWYKI-UHFFFAOYSA-N	445.229	1.492	50	20	IDGD	
C[C@@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)CCc3ccccc3)cn2)C[C@@H](C)O1	764193367	VHVWNKUGCCVHMH-HZPDHXFCSA-N	425.489	1.414	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)CCO3)c1	764233213	SWTHSHNDDUVTRT-UHFFFAOYSA-N	434.246	1.792	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)C(=O)Nc2cccc3c2OCO3)c1	764233385	WMKPSYOWYHZBLU-UHFFFAOYSA-N	436.218	1.586	50	20	IDGD	
CCNC(=O)COc1cccc(NC(=O)C(=O)NNC(=O)[C@H](CC)c2ccccc2)c1	764328338	PBCRMDKDVPFBCL-GOSISDBHSA-N	426.473	1.481	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)C(=O)Nc1cccc(CSC2CCOCC2)c1	764356308	UHQKAFUEMNNZEM-UHFFFAOYSA-N	428.514	1.822	50	20	IDGD	
CCOC(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)c1	764370486	ROTVOMLTWSPTOC-UHFFFAOYSA-N	435.383	1.550	50	20	IDGD	
CCn1nc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3OC)[nH]n2)cc1C1CC1	764376908	LIAUCUVGAZPKRH-UHFFFAOYSA-N	437.460	1.579	50	20	IDGD	
NC(=O)NC1(C(=O)NNC(=O)c2ccc(CN3C(=O)c4cccc5cccc3c45)cc2)CC1	767189818	QCSJCDRXXFDHLT-UHFFFAOYSA-N	443.463	1.962	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)c2ccccc2S(=O)(=O)CCN(C)C)cc1	767192116	PEIQMKMXVHSBKG-UHFFFAOYSA-N	435.571	1.884	50	20	IDGD	
Cc1nn(CC(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1-c1ccccc1	767429023	UKPOKAMEMAXPBR-UHFFFAOYSA-N	447.904	1.621	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(C)(C)O)cc1S(=O)(=O)N(C)Cc1ccccc1	768262436	WSNTUHPYQIGBTB-UHFFFAOYSA-N	435.502	1.048	50	20	IDGD	
CCOC(=O)c1[nH]c(C)c(S(=O)(=O)NNC(=O)c2cc(Br)c[nH]2)c1C	768495970	ICZOXMQXPYRGPI-UHFFFAOYSA-N	433.284	1.522	50	20	IDGD	
CSCCNC(=S)NNC(=O)[C@@H]1CC(=O)N(c2ccc(Br)c(C)c2)C1	769768427	AAKRKVYXVWMIOR-LLVKDONJSA-N	445.408	1.969	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)CCc2cccc3c2OCO3)c1	770210516	YSYPDFGYNHHOMY-UHFFFAOYSA-N	447.513	1.840	50	20	IDGD	
Cn1cc(CCNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c2ccc(F)cc21	770388262	LVTMRKNVYMZGMD-UHFFFAOYSA-N	439.495	1.897	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)[C@H]1CCCN1C(=O)c1cc(Cl)ccc1OC	771996032	ZBVUQZODUIGTBV-SMDDNHRTSA-N	425.869	1.442	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1cc(S(=O)(=O)CC)ccc1Br	772258256	NSLITBPGDVCLMA-VIFPVBQESA-N	435.296	1.345	50	20	IDGD	
CC[C@H](N=c1nn[nH]n1-c1ccccc1)C(=O)NNC(=O)[C@H](C)Oc1cccc(Cl)c1	772966831	KYMQBIGSXBPWFY-GUYCJALGSA-N	443.895	1.543	50	20	IDGD	
CCOC(Cn1ncc(C(=O)NNc2nc3ccccc3c(=O)n2CC)c1N)OCC	773754688	VKUACFLHSJGJGG-UHFFFAOYSA-N	429.481	1.351	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCc2nc(C(F)(F)F)n[nH]2)nc1	776256398	PAVKPTODPGPVDX-UHFFFAOYSA-N	436.420	1.075	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(OCC(=O)OCC(=O)NNC(=O)c2ccccc2)CC1	777126887	HVZZCCQBLVILTR-UHFFFAOYSA-N	435.477	1.407	50	20	IDGD	
COC(=O)c1ccccc1NNC(=O)c1cc(S(N)(=O)=O)c(Br)s1	777827454	DGVBLOWYCCWJKR-UHFFFAOYSA-N	434.293	1.702	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)N[C@H](C)CCNC(=O)OC(C)(C)C)nc1	779389281	RDTJYBQOUJJQQO-CYBMUJFWSA-N	444.558	1.698	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N2CC(n3ccnn3)C2)cc1	779552667	QJXZHVWDXFHTSC-YBEGLDIGSA-N	446.471	1.016	50	20	IDGD	
O=C(COC(=O)c1c[nH]nc1-c1ccsc1)NNC(=O)[C@H]1COc2ccccc2O1	781331576	QRCDJVMGXFYCIE-OAHLLOKOSA-N	428.426	1.282	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)C(=O)Nc2cccc(N3CCN(C(C)=O)CC3)c2)c1	782116046	BQUFFEUSTIFVOR-UHFFFAOYSA-N	439.472	1.224	50	20	IDGD	
O=C(NNc1nc2ccccc2s1)C(=O)Nc1cccc(S(=O)(=O)NC2CC2)c1	782814877	ZOUXASJYUBQUDF-UHFFFAOYSA-N	431.499	1.819	50	20	IDGD	
Cc1cc(Br)ncc1NC(=O)C(=O)NNC(=O)Cc1nc2ccccc2n1C	782894375	SJQLZFNDXYNMGD-UHFFFAOYSA-N	445.277	1.368	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(F)c(NC(=O)C(=O)NNc2ncnc3ccsc23)c1	783255258	PWILOFHWOGSUOF-UHFFFAOYSA-N	438.466	1.163	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)(F)F)cc1)C(=O)Nc1ccc2c(c1)OCCO2	783409802	WMOBXZSXLSBASD-UHFFFAOYSA-N	445.375	1.833	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CCC[C@H]2CN(CC(=O)NNC(=O)c3cccc(C#N)c3)C[C@@H]21	784522498	HYRUEQZSPURZPQ-GBESFXJTSA-N	441.532	1.944	50	20	IDGD	
CN(C)c1nccc(NNC(=O)C(=O)Nc2ccn(-c3ccc(C#N)cc3Cl)n2)n1	784970782	MULLUPJEWABGIG-UHFFFAOYSA-N	425.840	1.335	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)Nc1ccnn1-c1cccc(F)c1	785024331	XCQZNOOQKRXZOO-UHFFFAOYSA-N	428.336	1.025	50	20	IDGD	
COC[C@@H](C)Oc1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)[C@@H]1Cc2ccccc2O1	787890093	UJRGHFQJNVZAQY-XIKOKIGWSA-N	447.875	1.843	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1cnnn1-c1cccc(F)c1	789108916	QHNSKDUHQKYHHB-UHFFFAOYSA-N	447.810	1.686	50	20	IDGD	
CC(=O)c1cccc(S(=O)(=O)NCC(=O)NNC(=O)c2cc3c(s2)CCCCC3)c1	789722502	LOKFOQOPGCUUTK-UHFFFAOYSA-N	449.554	1.959	50	20	IDGD	
CCc1nc(NC(=O)C(=O)NNC(=O)c2nn(CC)c(=O)c3ccccc23)sc1C	789733070	VMWYQAHAQNDKOG-UHFFFAOYSA-N	428.474	1.143	50	20	IDGD	
Cn1nc([C@H]2CCCOC2)cc1NC(=O)C(=O)NNC(=O)C(F)(F)Oc1ccccc1	790952222	LKOQSXNBXJWDAJ-LBPRGKRZSA-N	437.403	1.072	50	20	IDGD	
CNC(=O)c1cc2cc(NC(=O)C(=O)NNC(=O)c3cccc4cccnc34)ccc2[nH]1	792352755	IYIBGNMSWDLZDY-UHFFFAOYSA-N	430.424	1.475	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cnc(CC3CC3)nc2)cc1OC	793021774	JCSFPHVBDTUXOR-UHFFFAOYSA-N	427.461	1.626	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)[C@H]1CCCN(C(=O)c2ccccc2)C1	795162141	XHCBLWLJPVUDPV-KRWDZBQOSA-N	430.530	1.932	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2c(C)nc3ccccn23)c(OC)c(C)c1OC	796991219	AUMNBOBGLHVAME-UHFFFAOYSA-N	441.444	1.377	50	20	IDGD	
C[C@H](Sc1ccccc1C(=O)NNC(=O)c1csc(N2CCOCC2)n1)C(N)=O	801104647	VPFMPSZWOSVKFR-NSHDSACASA-N	435.531	1.020	50	20	IDGD	
CCCCC(=O)N1CSC[C@H]1C(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	802069194	XPIOELGCUAMRIW-AWEZNQCLSA-N	428.536	1.335	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)c2c(C)oc3ncn(C)c(=O)c23)c(OC)cc1Cl	802083631	FIQAMUOPZIGXAW-UHFFFAOYSA-N	435.824	1.972	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN([C@H](CNC(=O)NNC(=O)C2CCC2)C(F)(F)F)CC1	802465260	JTKCHDOFUHSVGI-CYBMUJFWSA-N	437.463	1.601	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNc2nc3ccccn3n2)(n2cccn2)CC1	803187321	WLWGVNUNGZGAQA-UHFFFAOYSA-N	426.481	1.795	50	20	IDGD	
Cc1nc(Cl)c(Cl)cc1C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	805720297	UAHAXMNPTNAYDB-AWEZNQCLSA-N	440.239	1.841	50	20	IDGD	
CN(C)S(=O)(=O)C[C@H](NC(=O)NNc1ccnc(Br)c1)C(F)(F)F	806565600	PRCNCQHCBDKTMI-QMMMGPOBSA-N	434.238	1.293	50	20	IDGD	
COCCc1ccnc(NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)c1	806659868	IDQIVCLTZWGMHM-UHFFFAOYSA-N	435.506	1.052	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)[C@H]2CCN(c3ccccc3F)C2)ccc1Cl	809982986	WLIWSKOLRKFJSS-LBPRGKRZSA-N	440.884	1.414	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)n1	809983484	LENVUXGIWOEAFJ-UHFFFAOYSA-N	435.465	1.507	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(Br)s1)NNc1ncccc1Cl	810405925	QUYXZGCQQPHITP-UHFFFAOYSA-N	425.717	1.981	50	20	IDGD	
CC(=NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1cc([N+](=O)[O-])ccc1N	814689221	XBWOPPHNHFGHNO-UHFFFAOYSA-N	447.473	1.352	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)N(C(=O)Cc1ccccc1)CC2	815566794	FUEHXOWFCFKUSX-UHFFFAOYSA-N	445.479	1.557	50	20	IDGD	
O=C(NNc1cccc(Cl)n1)C(=O)Nc1cc(N2CCCS2(=O)=O)ccc1F	815728199	VJQBZVQGEXDTSL-UHFFFAOYSA-N	427.845	1.496	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)N(C)C)nn1[C@H](C)C1CC1	815751751	NEYFCSNWJSIPEN-CYBMUJFWSA-N	434.522	1.495	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)CN2C(=O)N[C@]3(C[C@@H](C)CC(C)(C)C3)C2=O)cc1	913431552	RBWJJYIGLFQNRF-NYHFZMIOSA-N	429.521	1.691	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(NC(=S)NNC(=O)COc2ccccc2C#N)c1	913445717	BPVVHHMCZUAALK-UHFFFAOYSA-N	433.515	1.205	50	20	IDGD	
O=C(NNC(=O)c1ccc2nc(O)[nH]c2c1)c1ccc(S(=O)(=O)N2CCCC2)cc1	914750676	VZNPXRIWXOXCQQ-UHFFFAOYSA-N	429.458	1.128	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C2CCN(C(=O)COc3ccccc3)CC2)cc1	914846247	DFGRMJWBQYRTRY-UHFFFAOYSA-N	425.485	1.839	50	20	IDGD	
COc1ccc2c(c1)C[C@@H](C(=O)OCC(=O)NNC(=O)c1ccc(OC)c(OC)c1)CO2	915011163	APVZXJVJPWCOOK-OAHLLOKOSA-N	444.440	1.268	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)C1=NN(c2ccccc2)C(=O)[C@H](C)N1	915189211	DNSKNPCQSFTLSL-AWEZNQCLSA-N	433.472	1.085	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)[C@@H]2CC[C@H](C(F)(F)F)NC2=O)c2ccccc2c1=O	915190994	ZFNUKXDPDRZZBU-CHWSQXEVSA-N	439.394	1.025	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)C2CCN(C(=O)N(C)C)CC2)c2ccccc2c1=O	916092784	GHDYTTIBDYHOEZ-UHFFFAOYSA-N	428.493	1.132	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NCCc3cccc(F)c3)nc2)CC1	916201046	AQIIXJBUCJRYIS-UHFFFAOYSA-N	436.513	1.026	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)NC[C@@H](c2ccc(C)o2)N2CCOCC2)c1	916229357	OOKIIBNLYJDTTR-SFHVURJKSA-N	432.477	1.623	50	20	IDGD	
CCn1cnc2c1c(=O)n(CC(=O)NN=C(C)c1cccnc1)c(=O)n2Cc1ccccc1	916332399	VCLXLTVCADZGDS-UHFFFAOYSA-N	445.483	1.363	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)NCc2ccc(CN3C[C@@H](C)O[C@H](C)C3)cc2)n1	916385808	GTUBNTAZHALYFA-QZTJIDSGSA-N	428.537	1.640	50	20	IDGD	
C[C@@H]1CCCCN1CCCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	916504411	VUURVYNQUVIHML-MRXNPFEDSA-N	439.582	1.536	50	20	IDGD	
CCNC(=O)c1cccc(CNC(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)c1	916645049	PCWMNICHAUILHX-UHFFFAOYSA-N	430.461	1.606	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Cn2cc(C(N)=O)c3ccccc32)cc(OC)c1OC	917388436	GDOIOPZYFGKRET-UHFFFAOYSA-N	426.429	1.227	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)NCc2ccnc(N3CCN(C)CC3)c2)cc1	919903797	TWQFHPDWRARZFL-UHFFFAOYSA-N	426.521	1.305	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)C1CC1	920054636	SSOBBEDJWGDBNM-OAHLLOKOSA-N	438.550	1.017	50	20	IDGD	
O=C(CN1CCC(CC(=O)NC2CCCC2)CC1)NNC(=O)c1cccc([N+](=O)[O-])c1	920089257	XWFZLFPZFIKRJC-UHFFFAOYSA-N	431.493	1.517	50	20	IDGD	
O=C(NNC(=S)NC1CCN(Cc2ccccc2)CC1)c1ccc(-n2cnnn2)cc1	920213394	PDHVMWTUODQUMB-UHFFFAOYSA-N	436.545	1.436	50	20	IDGD	
O=C(C[C@H]1SC(N2CCCC2)=NC1=O)Nc1ccc(C(=O)NNC(=O)C2CC2)cc1	920953869	GMPHEKNVOMJTLG-OAHLLOKOSA-N	429.502	1.280	50	20	IDGD	
O=C(CCNC(=O)c1ccc([N+](=O)[O-])cc1)NNC(=O)c1ccc(Br)cc1	1317701192	HDIFTQPFQLEBCT-UHFFFAOYSA-N	435.234	1.938	50	20	IDGD	
O=C(NNC(=O)c1cc2c(cn1)OCCC2)c1cccc(S(=O)(=O)N2CCCC2)c1	1337577940	OQIGWZDDNKIEMN-UHFFFAOYSA-N	430.486	1.266	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4c(c3)n(C)c(=O)n4C)C2)C1	1777867691	QXADGSXHICDMLI-VFNWGFHPSA-N	434.924	1.338	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnn3cccnc23)C1	1778963013	NRZBVOYBCNHNGX-JXXFODFXSA-N	435.912	1.111	50	20	IDGD	
Cc1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](O)CCl)C3)nn1C(F)F	1780157532	HPRQGACFHZALDG-PMUMKWKESA-N	434.871	1.314	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCN1CCN(C)CC1)C2	1780702281	MJAOTOHFGCNNAE-DBXWQHBBSA-N	429.005	1.155	50	20	IDGD	
COc1ncc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@](C)(Cl)CCl)C3)C2)cc1F	1781227504	AMLKHFPIUCNXEU-MSOLQXFVSA-N	434.295	1.909	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CSC(=N)N)C2	1781900792	SNCDTQCRIPJHMC-HWWQOWPSSA-N	435.388	1.300	50	20	IDGD	
CC(=O)N/C(C)=C/C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)Br)C1	1782002531	QZNPMBQLIXHEPB-KUEOTADMSA-N	430.343	1.324	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(C3CC3)on1)C2	1782169326	ZXJCLJRILXAEOI-WIBUTAKZSA-N	425.913	1.933	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)CCc3ccc(O)nn3)C2)C1	1782635164	GUCNBRMKRBZBQP-MSOLQXFVSA-N	431.320	1.181	50	20	IDGD	
C=CCC(F)(F)C(=O)N1CC[C@]2(CN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CCO2)C1	1783194495	CUYMBSNEFSGUPE-OEBVFIGYSA-N	437.447	1.162	50	20	IDGD	
Cc1c(F)ccc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](C)Br)C3)C2)c1N	1783532553	KCCYMMLWEDOXBT-SGTLLEGYSA-N	428.302	1.943	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](C)n1cccc1C=O)CCO2	1783532819	NPOKAVXKNIJADF-PMUMKWKESA-N	426.311	1.475	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cnn(C(C)(C)C)c3Cl)CCO2)C1	1783873515	QEYHTOYNMIUQNC-IFXJQAMLSA-N	447.363	1.989	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cccc(C#N)c3Cl)CCO2)C1	1783882908	UOBUACAUBNJNRN-DNVCBOLYSA-N	426.300	1.909	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1C[C@@H]1c1ccc(F)cc1)CCO2	1783932722	BGRHZQNKDADLCO-PWHSHALESA-N	446.523	1.132	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(=O)c3cccn3C)C[C@@H]21	1783973811	DERJUFJEFZJEGW-YXWQFLTLSA-N	440.338	1.219	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(O)nc(Cl)c3)[C@H]2C1	1785694059	DREYZLRORPYZMF-UKJIMTQDSA-N	446.729	1.817	50	20	IDGD	
COC(=O)c1ccc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]3C2)cc1	1787448804	BYJAJMKGHIBXLL-NBOOPKSLSA-N	426.872	1.530	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(C(=O)OC)nc3)[C@H]2C1	1787604082	UGHCJGHWBXJLEG-OVWQWFNUSA-N	437.924	1.869	50	20	IDGD	
CN[C@H](CC(=O)NC1(c2ccc(NC(=O)CCBr)cc2)CCC1)C(=O)O	1787672826	DJQJDVORIDKGDS-CQSZACIVSA-N	426.311	1.968	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc4c3OCC4)[C@H]2C1	1787818544	YWELWPKDDCZCHX-CSFVBSKPSA-N	437.334	1.998	50	20	IDGD	
C[C@@H](Cn1cncn1)C(=O)Nc1ccc(C2(NC(=O)CCC(=O)NN(C)C)CCC2)cc1	1789618898	SOUDAAVPVGNGBZ-INIZCTEOSA-N	441.536	1.421	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(O)c([N+](=O)[O-])c3)C[C@@H]21	1791256954	MOWXHEXUCCPKLK-WSMBLCCSSA-N	441.868	1.148	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)[C@@H]1CCCN1Cc1ccccc1	1791463773	SMIFQTNVZVMHPK-FCMAGTKHSA-N	449.979	1.230	50	20	IDGD	
Cc1cnn([C@H](C)C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)CBr)C[C@@H]32)c1	1791592526	GUGICHDPVRTEAR-NRKLIOEPSA-N	441.370	1.763	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)Oc3cccnc3)[C@H]2C1	1791654671	XANPENNCFOLAIK-KSIDHJATSA-N	425.913	1.082	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Cl)C[C@@H]21)c1ccc(N2C(=O)C=CC2=O)cc1	1792071125	VLKPDYUVRXITKH-QBWPOKONSA-N	449.866	1.244	50	20	IDGD	
Cc1c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](O)CCl)cccc1C(F)(F)F	1792983615	RMSRBINYARAPCG-VZAMPYOESA-N	434.842	1.817	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C=C/c1ccc([N+](=O)[O-])o1	1793109804	VPLHHUIXBOXXHH-VLDRXHLPSA-N	427.841	1.044	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](CO)NC(=O)OC(C)(C)C)C2	1793681230	ILAHTWSMZMBQRM-JKJDWNRSSA-N	431.961	1.918	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(-c3ccco3)no1)C2	1795113055	WFUPHFSBJFTGGF-DPIQGUFMSA-N	438.278	1.923	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)COc1ccc(F)cc1	1795196462	ZVIUCYOAGORZAT-ZUMXRPEOSA-N	443.313	1.825	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CSc1ncccn1	1795837600	CLDHFUOUHPQHBT-DMVWFOPNSA-N	433.361	1.395	50	20	IDGD	
CC[C@H](NC)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2	1796179195	RPGMLWDTXQYIRD-KRXQYRFLSA-N	432.477	1.770	50	20	IDGD	
CC(C)(CCl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1n[nH]c2c1CS(=O)(=O)C2	1796385171	CLKRMBSPDVHAIO-ZSBIGDGJSA-N	428.942	1.355	50	20	IDGD	
Cc1ccc2oc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)c3ccc(B(O)O)cc3)C4)cc2n1	1796398582	WJJNXGYRMGINAY-BCDXTJNWSA-N	433.273	1.382	50	20	IDGD	
Cc1c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCC(=O)NN(C)C)C3)oc2ccccc12	1796906471	FETXNGZYMUYWSO-VPTLXERWSA-N	442.516	1.317	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nc(Cl)ccc1F)C2	1797952791	LMHKZIFGEFVSHS-DRXBFXEBSA-N	429.952	1.929	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cccc(F)c1F)C2	1797957362	LXZBZEARHKETAU-YVWYUNDQSA-N	426.536	1.948	50	20	IDGD	
Cc1ccc(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)cc1C	1798439589	LRULBPXYEDCVJI-REPLKXPHSA-N	435.528	1.796	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(F)c1	1798865700	WGMPCPMJTYBVJP-WVNFENISSA-N	441.463	1.163	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CS[C@H]1CCCCO1)C2)[C@H](F)Br	1799350384	XYTDNERIDFPGAR-HZZBMVKVSA-N	439.347	1.526	50	20	IDGD	
Cc1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CCC(=O)NN(C)C)C3)nn1C(F)F	1799400289	CICKXPPBXAADPX-BTTYYORXSA-N	426.468	1.211	50	20	IDGD	
O=C1Cc2cccc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@@H](F)Br)C4)c2N1	1800031116	DSPKMNFQUUFDSH-YHYOWMERSA-N	440.269	1.075	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnc3sc(C)cn3c1=O)C2	1802273581	PUCJJGLIQBUAJI-QVHKTLOISA-N	438.937	1.570	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc3nn[nH]c3c2)[C@H]1c1cccnc1)[C@@H](O)CCl	1803148503	RDFZBEWJTMVHRJ-WBAXXEDZSA-N	428.880	1.272	50	20	IDGD	
C=CCOCCCC(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1803560699	OGDKNODPHKWBFG-XXBNENTESA-N	445.564	1.443	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)C[C@@H]2CCCCO2)[C@@H]1c1cccnc1	1804105225	YHCZGCWTUFRQKV-MSYCTHLASA-N	445.564	1.420	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccsc2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807365607	ZELJTVZSESFBOB-PXNSSMCTSA-N	435.314	1.456	50	20	IDGD	
CC(=O)N(C)CCC(=O)N1CC[C@H](CNC(=O)[C@H](F)Br)[C@@H]1c1cccnc1	1808652593	YRQPMXWBLJGCBO-PVAVHDDUSA-N	443.317	1.646	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)CCc2nc(N)n[nH]2)[C@@H]1c1cccnc1	1810150708	YPWXWODNHATFKW-VKJFTORMSA-N	433.944	1.828	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)[C@H](C)N2C[C@H]3C[C@H]3C2)[C@H]1c1cccnc1	1810162857	PXMXMEPETMXLGR-IHCSERIDSA-N	434.968	1.681	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1cccc(F)c1	1811800265	KSESSBCITKDUOH-UGKGYDQZSA-N	447.275	1.534	50	20	IDGD	
CCc1cc(C(=O)N2CC[C@H](CNC(=O)[C@@H](Cl)COC)[C@@H]2c2cccnc2)nn1C	1813030392	CTXOEULXAMIDID-AYBZRNKSSA-N	433.940	1.951	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)COC(C)(C)C)[C@@H]1c1cccnc1	1813069154	VIIGVPNPLAHECW-LAUBAEHRSA-N	433.553	1.276	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)COC(C)(C)C)[C@H]1c1cccnc1	1813069157	VIIGVPNPLAHECW-UTKZUKDTSA-N	433.553	1.276	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@@H](CNC(=O)CCS(C)(=O)=O)[C@@H]1c1cccnc1	1813574490	WATYLHXFBBPQGC-RDJZCZTQSA-N	429.970	1.787	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)CCSC(=N)N)sc2C1	1814952165	PQLRYFHWCHKVHK-HTQZYQBOSA-N	434.385	1.855	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1cncs1	1816581434	GMUVUJKQBUZUEY-OAHLLOKOSA-N	425.279	1.166	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)/C=N/N3CCCCC3)sc2C1	1819780848	INWDJCWYFURTMB-RDFRODCOSA-N	427.958	1.781	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(F)nc3)sc2C1	1820371672	RBPMCMRCDHZKIB-GFCCVEGCSA-N	434.497	1.276	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)C2CCSCC2)[nH]n1	1822417442	INNNAJFXLQOWSL-INIZCTEOSA-N	436.582	1.918	50	20	IDGD	
CS(=O)(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](F)Br)[nH]n1	1822973183	UPMAYBHZGBZPJY-MFKMUULPSA-N	439.307	1.527	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](C)Br)sc2C1	1825641583	PRWFVKRBOCBJKR-HLTSFMKQSA-N	432.344	1.285	50	20	IDGD	
Cc1cn(CC(=O)N[C@H]2CCc3nc(NC(=O)C(Cl)Cl)sc3C2)c(=O)nc1O	1826107308	ZTSZWYHCXXSLMJ-QMMMGPOBSA-N	446.316	1.130	50	20	IDGD	
O=C(c1ccc(O)cn1)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827054482	BHLUSOHBPWBXSX-OAQYLSRUSA-N	437.305	1.014	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4cccnn4c3)C2)C1	1830366862	YAGXJHKNHLVFJI-OAQYLSRUSA-N	434.924	1.669	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C=C/c3ccco3)C2)C1	1830536142	YVQHENGLMMMDDX-FKXXJOMMSA-N	441.322	1.780	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccnc3OC)C2)C1	1831643798	HAKLBSFKPIJXFL-OXJNMPFZSA-N	425.913	1.568	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(F)(F)C(F)F)CCO2	1832190953	OIJFBFANZUPBRA-OAHLLOKOSA-N	430.471	1.195	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3ccc(C)cn3)CCO2)C1	1832995360	IUFUIYABSLGUNS-GHTZIAJQSA-N	439.940	1.033	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)C3CCN(C)CC3)CC2)CC1	1833105834	RKWDFSOQGVXHBZ-IBGZPJMESA-N	429.005	1.154	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)Cn3ccc(C)n3)CC2)CC1	1833855493	RPOAPCUMLGLVTM-GOSISDBHSA-N	425.961	1.017	50	20	IDGD	
Cc1cccc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCBr)CCO3)C2)c1F	1834819030	DHPVWSKPIIQUJU-LJQANCHMSA-N	443.313	1.989	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3ccncc3F)CC2)CC1	1835253407	HQIBPIOJCWPJSB-QGZVFWFLSA-N	426.920	1.660	50	20	IDGD	
COCCOCC(=O)N1CCC(N2CCC(NC(=O)CO[Si](C)(C)C)CC2)CC1	1835833489	JGNDBFPRPCTJPG-UHFFFAOYSA-N	429.634	1.073	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3nccc4occc34)CCO2)C1	1836295361	JANLLKVWNYUHAX-MGPUTAFESA-N	437.880	1.152	50	20	IDGD	
CC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)c3cnn4cccnc34)CC2)CC1	1836396559	BGDWGLUHOQDFHT-SFHVURJKSA-N	432.956	1.932	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc4ncnn4c3)CCO2)C1	1837164646	LMYSNKNOXURTAE-UZLBHIALSA-N	435.912	1.207	50	20	IDGD	
Cc1ccc(C(=O)N2CCC(OC3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)cc1	1838600467	MCLOLQZQGPPEBW-UHFFFAOYSA-N	444.576	1.980	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(O)cc3)CCO2)C1	1838971139	DHSZPLQLUCEREX-RBUKOAKNSA-N	431.316	1.699	50	20	IDGD	
CCOc1cccc(C(=O)N2CCO[C@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)c1	1839020287	VCPDBJIQDDHWOQ-LJQANCHMSA-N	431.316	1.959	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4ncncc4c3)C2)C1	1839145406	GTTMBGFSVCWXJW-DYESRHJHSA-N	432.908	1.717	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3c(OC)cccc3OC)C2)C1	1839145839	FMLMHPKMTFMAEW-QVKFZJNVSA-N	440.924	1.791	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3c[nH]c4ncccc34)C2)C1	1839149936	WUCVLUKWHGDHDX-AVRDEDQJSA-N	448.951	1.969	50	20	IDGD	
CCc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)cn1	1839151444	RRLORGRXNFPHSF-PMACEKPBSA-N	444.359	1.950	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(C)cc(C#N)c3)CCO2)C1	1839454193	ZSGHNBBNUNMQBL-NQIIRXRSSA-N	435.908	1.191	50	20	IDGD	
CSCC(C)(C)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H](C)Br)CCO2)C1	1840030297	IDZJEMTVIFAGRO-CXAGYDPISA-N	437.400	1.615	50	20	IDGD	
O=C(Cc1ccc2c(c1)CCC2)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840186245	CPKXMUCILMCHAT-NRFANRHFSA-N	441.355	1.978	50	20	IDGD	
CC(C)(C)OC(=O)N1CC=C(C(=O)N2CC3(CCCN3C(=O)[C@@H](O)CCl)C2)CC1	1841354742	SKZQTZJIAIFMRF-HNNXBMFYSA-N	427.929	1.357	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)CCc2c(C)noc2C)C1	1842074771	CFBCWYPTSXWCTO-BUVRLJJBSA-N	440.504	1.561	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)Cc2cccnc2)C1	1843087304	SYRZYIXWRFXOKC-UHFFFAOYSA-N	438.440	1.975	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC12CN(C(=O)[C@@H](C)[C@@H]1SC(=N)NC1=O)C2	1846070070	MYIBRVCVEWHIED-DCAQKATOSA-N	431.356	1.166	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@]23C[C@H]2CCN3C(=O)OC(C)(C)C)C1	1846192705	PEEHJEJUNUUJNW-LRAJWGHMSA-N	441.956	1.843	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)[C@@H]1C[C@@H]1c1ccc(F)c(F)c1)C2	1846383965	NEORUHGKIGIHAG-HZPDHXFCSA-N	434.487	1.645	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H](O)[C@H](C(=O)N2CC3(CCCN3C(=O)C(Cl)Cl)C2)C1	1846388511	PHRKEGZJLAKCMW-NEPJUHHUSA-N	436.336	1.221	50	20	IDGD	
C[C@@H](C(=O)N1CCCC12CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)n1cncn1	1846598150	SNMYMXRAUVTIFF-KBPBESRZSA-N	440.932	1.175	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)C(C)(C)C(C)=O	1847719065	ADOOLQUFISVKQU-IRXDYDNUSA-N	431.445	1.951	50	20	IDGD	
CCOc1ccc(CCNC(=O)NNC(=O)c2n[nH]c(=O)c3ccccc23)cc1OCC	9754345	GSHXWQIVOOYIQE-UHFFFAOYSA-N	439.472	1.907	50	20	IDGD	
O=C(Cn1cnc2ccccc21)NNC(=O)c1sccc1S(=O)(=O)N1CCCCC1	10099424	XNKVHOGUNKWNPH-UHFFFAOYSA-N	447.542	1.734	50	20	IDGD	
C=C(C)CNC(=S)NNC(=O)c1cc(S(=O)(=O)NCc2ccccc2)ccc1O	18138983	YTMXCNLOGCPBTK-UHFFFAOYSA-N	434.543	1.556	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)CN1C(=O)N[C@]2(C[C@@H](C)CC(C)(C)C2)C1=O	21199804	ZDMSLOGNRWTERV-XMHCIUCPSA-N	440.504	1.541	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)CSCc2ccc(F)cc2)c1	25416506	AABDMEYDIISOCU-UHFFFAOYSA-N	425.507	1.770	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)[C@H]2CCCN(C(=O)c3ccc(F)cc3)C2)cc1	196486264	MJSZETXSCXYSBR-INIZCTEOSA-N	428.464	1.946	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2ccccn2)nnn1C1CCN(C(=O)OC(C)(C)C)CC1	726155538	SCMJDWKXNABEIO-UHFFFAOYSA-N	429.481	1.628	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)CNC(=O)NCc1ccc(Cl)cc1	727364756	DAIBWBCBFRCZKX-UHFFFAOYSA-N	442.907	1.899	50	20	IDGD	
CSC[C@H](C(=O)NNc1nc(-c2ccncc2)no1)N1C(=O)[C@@H]2CCCC[C@H]2C1=O	728073320	FLYNFVNKRCDHPR-MGPQQGTHSA-N	430.490	1.482	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3c[nH]c4ccccc4c3=O)cc2)CC1	728214420	OTNDMTKCCPMRGF-UHFFFAOYSA-N	441.513	1.221	50	20	IDGD	
O=C(CSc1nnc(-c2ccc(Cl)cc2)o1)NNC(=O)[C@@H]1CCS(=O)(=O)C1	728372379	MTYVIMXYBODRBB-SNVBAGLBSA-N	430.895	1.064	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2cc(F)cc(Br)c2)n1	728727479	FQWVZXHYYQOSLR-UHFFFAOYSA-N	430.255	1.900	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)Cc2cccnc2)cc1S(=O)(=O)NCc1ccccc1	728891902	JRIAVQSKTVPTLN-UHFFFAOYSA-N	438.509	1.872	50	20	IDGD	
C#CCNS(=O)(=O)c1ccc(C(=O)NNC(=S)Nc2ccc(N(C)C)cc2)cc1	729689719	QUBOYGIGQJBIMA-UHFFFAOYSA-N	431.543	1.296	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)CC[C@H]1NC(=O)N(c2ccc(Cl)c(Cl)c2)C1=O	730519781	ZGOAZFSVAQNBHF-CYBMUJFWSA-N	438.271	1.998	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)Cc1csc(NC(=O)Cc2cccs2)n1	730781392	LPIOQQCOJRWGLM-UHFFFAOYSA-N	446.510	1.860	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)nnn1-c1ccc(F)c(Cl)c1	731186172	QPCVDZSSQHVFQX-UHFFFAOYSA-N	441.814	1.419	50	20	IDGD	
Cc1c(C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)nnn1-c1ccc(OC(C)C)cc1	731326379	FZYDKWAGQWZVMY-IBGZPJMESA-N	437.456	1.964	50	20	IDGD	
O=C(NCCCN(C(=O)C1CCC1)C1CC1)NNC(=O)c1nnc(O)c2ccccc12	731406837	YIEDSPSASIAVAC-UHFFFAOYSA-N	426.477	1.461	50	20	IDGD	
O=C(NC[C@@H](O)c1ccc2ccccc2c1)NNC(=O)c1csc(N2CCOCC2)n1	731496425	BOYUAAYQCQWZGX-GOSISDBHSA-N	441.513	1.811	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)Cn1c(CS(C)(=O)=O)nc2ccccc21)c1ccccc1	731997607	QZSWNICUKNYRMQ-INIZCTEOSA-N	428.514	1.922	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cc(F)ccc1F	732083140	VLDUNCNGWOCBEY-UHFFFAOYSA-N	435.412	1.872	50	20	IDGD	
COCCNC(=O)CSc1ccccc1C(=O)NNc1ccccc1S(C)(=O)=O	732302406	YLEVAXQALCJFOH-UHFFFAOYSA-N	437.543	1.702	50	20	IDGD	
C[C@@H]1Cc2ccccc2N1C(=O)[C@@H]1CCCC[C@H]1C(=O)NNC(=O)C(=O)N1CCCC1	732755091	ODYCIGIUWIRKAP-KBAYOESNSA-N	426.517	1.540	50	20	IDGD	
CS(=O)(=O)CCCNC(=O)NNC(=O)CCCOc1ccc(Cl)cc1Cl	732891444	IPDFEKCLAGRAKW-UHFFFAOYSA-N	426.322	1.918	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NCC(=O)NNc2nccnc2Cl)c1	734261114	TWJSSTVKVXPAGC-UHFFFAOYSA-N	440.913	1.034	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2ccc(Cl)cc2)cn1	735470764	HSERRHIQBCWYAN-UHFFFAOYSA-N	433.877	1.949	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Cc2csc(-c3ccoc3)n2)c1	737766696	LTXPVEBPTTUSAQ-UHFFFAOYSA-N	434.499	1.657	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)c1ccc(Cl)c(S(=O)(=O)N2CCCC2)c1	740853284	NCHHHFIGRKJVDF-UHFFFAOYSA-N	444.941	1.190	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)[C@@H]2CCCN(C(=O)COc3ccccc3)C2)cc1	741284400	PPOZUVVUCDYTDP-QGZVFWFLSA-N	440.500	1.572	50	20	IDGD	
CC(=O)Nc1cccc(-n2cnnc2SCC(=O)NNC(=O)c2cccc(C#N)c2)c1	741849740	FCTWDEBBLSDUTJ-UHFFFAOYSA-N	435.469	1.651	50	20	IDGD	
CC(C)(C)n1cc(C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)c(-c2ccc(F)cc2F)n1	741894916	NADONGBETJSEHN-NSHDSACASA-N	440.472	1.779	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)CN(C[C@@H]2CCCO2)C(=O)OC(C)(C)C)C[C@@H](C)O1	743290062	ABDZLOOIRQDMFA-BBWFWOEESA-N	442.557	1.049	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)Cn2ncc3ccc([N+](=O)[O-])cc32)cc1	743831197	SGBJZXWLJZYPGN-UHFFFAOYSA-N	432.418	1.201	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1cc(Cl)c2c(c1)OCO2	744621463	XMYVHVBABIRJLZ-UHFFFAOYSA-N	439.877	1.847	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN2CCN(C(=O)c3cccc(O)c3)CC2)cc1C	746461755	OBOLLPOLZAITEV-UHFFFAOYSA-N	430.530	1.544	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc2c(c1)OCCCO2)NNc1cc(F)c(F)c(F)c1	746711288	VAVIPZBGGNGYAS-UHFFFAOYSA-N	431.392	1.687	50	20	IDGD	
C[C@H](CN(C)C(=O)OC(C)(C)C)C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	746815615	AUOYRPDKMQPERX-CYBMUJFWSA-N	442.538	1.201	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)[C@H](c2ccccc2)N2CCSCC2)c2ccccc2c1=O	746818112	ONPUZPPBWFUAGS-IBGZPJMESA-N	437.525	1.485	50	20	IDGD	
COc1cc(C)c(Br)cc1S(=O)(=O)NNC(=O)CNC(=O)c1ccco1	747612371	QQWPTLNQXNPMPN-UHFFFAOYSA-N	446.279	1.099	50	20	IDGD	
C#CCN1C(=O)C(=NNC(=O)CNC(=O)c2cccs2)c2cc(Br)ccc21	750943035	CVAFCWRHIRXFOD-UHFFFAOYSA-N	445.298	1.741	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)[C@@H]1CCCN(C(=O)c2ccc(F)cc2)C1	751208972	JETKSNMYQVDHKN-CQSZACIVSA-N	432.477	1.317	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@](C)(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)C1	751556414	MQMSCMAGPVFIKL-HXUWFJFHSA-N	429.481	1.461	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1)C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	752576823	BXBHWUWSEIJGSV-XMHGGMMESA-N	435.459	1.338	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)Cc2ccc(C(=O)NNC(=O)Cn3cccn3)cc2)cc1	753249901	XNWMXSWABMAUGB-UHFFFAOYSA-N	441.513	1.473	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc(C(F)(F)F)c1	753839791	DUMOWKPINMXAFR-UHFFFAOYSA-N	443.403	1.817	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)N[C@@H]1CCN(c2c(F)cccc2F)C1=O	755084705	GZYSBSBEEKEMLW-CQSZACIVSA-N	428.399	1.670	50	20	IDGD	
Cc1c(NC(=O)NNC(=O)c2cc(Br)ccc2O)cccc1-n1cnnn1	755443362	GFRUDBKGMANIEH-UHFFFAOYSA-N	432.238	1.905	50	20	IDGD	
CCNC(=O)COc1ccc(NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1	755649537	ZQHLOWGSESPAMQ-UHFFFAOYSA-N	441.492	1.061	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Nc2cccnc2N2CCOCC2)cc(OC)c1OC	756184525	ZKEWAFULGNBPEZ-UHFFFAOYSA-N	431.449	1.411	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)Nc1cc(F)cc(N2CCOCC2)c1	756279197	CWLLIPIDTQJTPZ-UHFFFAOYSA-N	443.483	1.522	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2cccc(-c3n[nH]c(C)n3)c2)c2ccccc2c1=O	756354575	FCQXDZBXCQUNIJ-UHFFFAOYSA-N	432.444	1.976	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1cc(NC(=O)OC(C)(C)C)ccc1F	756621904	UPLGKIDGMVDGJW-VIFPVBQESA-N	433.462	1.263	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)Nc2ccc(C)c(S(N)(=O)=O)c2)cc1	756637901	KXKPXAUAWIVFBU-ZDUSSCGKSA-N	436.490	1.661	50	20	IDGD	
C#CCOc1cc(F)ccc1NC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1	756742027	IVZLKKNGWTXRJG-UHFFFAOYSA-N	448.476	1.620	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)Nc1cc(C2CC2)nn1[C@H]1CCS(=O)(=O)C1	756854986	IKJJLIABXGHXSS-HNNXBMFYSA-N	447.517	1.524	50	20	IDGD	
COc1ccccc1N1CC[C@H](NC(=O)NNC(=O)COc2cc(C)cc(C)c2)C1=O	757295497	QEUJUNQIOHUDPX-KRWDZBQOSA-N	426.473	1.827	50	20	IDGD	
CN1C(=O)CCc2cc(C(=O)NNC(=O)CCN3CCN(c4ccccc4)CC3)ccc21	758041434	UWKJSTFDGRVECS-UHFFFAOYSA-N	435.528	1.569	50	20	IDGD	
COC(=O)c1cn(C2CCN(C(=O)NNC(=O)c3cc4c(s3)CC[C@H](C)C4)CC2)nn1	759211133	GMYJQIYQXXOUTE-LBPRGKRZSA-N	446.533	1.943	50	20	IDGD	
Cc1cc(Br)cn2cc(CNC(=O)NNc3nc(O)c4cnn(C)c4n3)nc12	760145316	UVEFNZLAFYBHIW-UHFFFAOYSA-N	446.269	1.614	50	20	IDGD	
NC(=O)CC[C@@H](NC(=O)OCc1ccccc1)C(=O)NNC(=O)c1cc2ccccc2o1	760168280	USZSJQZTMMHMGX-MRXNPFEDSA-N	438.440	1.754	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cccnc2OCC(F)F)c1	760223252	IHZFECAJNJSECK-UHFFFAOYSA-N	428.417	1.051	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)NCc2ccnc(OCCN(C)C)c2)cc1C	763093335	WNKZCPAWGXHCJM-UHFFFAOYSA-N	428.493	1.108	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(C(=O)N2CCCC2)c(F)c1)c1ccc2c(c1)OCCO2	763416021	FIMPHJUBKOGHIC-UHFFFAOYSA-N	449.460	1.456	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)NC[C@H](c1cccs1)N1CCOCC1	763444698	AALHJEUCDNEJDE-CQSZACIVSA-N	436.559	1.950	50	20	IDGD	
C[C@@H](CC(=O)NNC(=O)C(=O)Nc1ccccn1)[C@H]1CCCN(C(=O)OC(C)(C)C)C1	763565307	ZJMBBUIBBHVXEI-GJZGRUSLSA-N	433.509	1.841	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(-c3nnc(C)o3)cc2)cc1	763661917	QTDVPPUDPVANON-UHFFFAOYSA-N	425.401	1.219	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(C(=O)NC(C)C)cc2C)cc1C	763665237	PDCDBFHEPQUQJS-UHFFFAOYSA-N	440.500	1.915	50	20	IDGD	
C[C@@H]1COCCN1c1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)cc1	763684322	JNXXWEQZRXMLIM-CQSZACIVSA-N	446.891	1.730	50	20	IDGD	
CN(C)CCOc1cccc(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)c1	763685494	WOSNUWAZZMKCAE-UHFFFAOYSA-N	434.880	1.445	50	20	IDGD	
CCCN1Cc2cccc(NC(=O)C(=O)NNC(=O)c3cc(OC)cc(OC)c3)c2C1	763772036	KWJAMQSICVWALR-UHFFFAOYSA-N	426.473	1.829	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(=O)n(Cc3ccccc3)c2)cc1	763808385	AFJJTNGFITTXBC-UHFFFAOYSA-N	434.452	1.370	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccn(Cc3ccncc3)n2)c1C	763851137	QWBISKGHKXMTJI-MRXNPFEDSA-N	436.472	1.497	50	20	IDGD	
C#CCOc1cccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(OCC)cc2)c1	763862499	XVGZKBXGFDXKRM-OAHLLOKOSA-N	425.441	1.651	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc3ccc(F)cc3)cc2)CCO1	763871216	FJROHSVMNFIGTN-GJZGRUSLSA-N	444.463	1.604	50	20	IDGD	
CC(C)(C)CC(=O)NNC(=O)C(=O)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1	764197528	CAJUDNPGQQGHPO-QGZVFWFLSA-N	426.521	1.852	50	20	IDGD	
O=C(Cc1cc[nH]n1)NNC(=O)C(=O)Nc1ccc(OCc2cccc(F)c2)c(F)c1	764286387	TZKLBYFSKBTEFV-UHFFFAOYSA-N	429.383	1.596	50	20	IDGD	
CC(C)(C(=O)NNC(=O)C(=O)Nc1ccc(S(=O)(=O)C(F)F)cc1)c1ccccc1	764309545	PWZIDGMBSOZIJB-UHFFFAOYSA-N	439.440	1.747	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)C(=O)Nc1ccc2c(c1)OC(F)(F)O2	764342752	JDDLFIRTCYVEOO-UHFFFAOYSA-N	429.339	1.594	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)CCCN3C(=O)OC(C)(C)C)cn1	764358977	LMHFHFWZAFHGOC-UHFFFAOYSA-N	442.476	1.508	50	20	IDGD	
Cc1ccc2c(c1)[C@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N3CCCC3)c1)CO2	764373957	HXOSOQBIKSMXSJ-GOSISDBHSA-N	444.513	1.857	50	20	IDGD	
CC[C@@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)cc1	764380235	UEODFCJUCBOPOA-CYBMUJFWSA-N	448.426	1.973	50	20	IDGD	
COc1cc(OC)c(OC)cc1NC(=O)C(=O)NNC(=O)c1cc(-c2cccs2)[nH]n1	764381956	DFZHIJYAEMXYKG-UHFFFAOYSA-N	445.457	1.564	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3c[nH]nc3-c3ccccn3)n[nH]2)cc1	764385126	SFHLAXLWRXEONN-UHFFFAOYSA-N	444.455	1.824	50	20	IDGD	
CCOC(=O)c1cnn2c(C(=O)NNC(=O)c3cc(Br)ccc3O)ccnc12	764407622	GTGOQECKUPQRIT-UHFFFAOYSA-N	448.233	1.449	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCC1(N2CCOCC2)CC1	764756859	IMCWXTYXCZNBMZ-ZDUSSCGKSA-N	441.326	1.412	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3c(C)oc4ncnc(O)c34)CC2)cc1	766647219	BKALQEQSGYXGRM-UHFFFAOYSA-N	438.488	1.124	50	20	IDGD	
CC(=O)N1CCc2c(NC(=O)C(=O)NNC(=O)c3cc(-c4ccccc4)on3)cccc21	769264055	ATPSKDKIBYBZEQ-UHFFFAOYSA-N	433.424	1.650	50	20	IDGD	
O=C(CN1CCC(O)(c2ccccc2Cl)CC1)NNC(=O)c1ccc([N+](=O)[O-])cc1	769807599	YGJWNQNELVTIBK-UHFFFAOYSA-N	432.864	1.993	50	20	IDGD	
COc1ccccc1[C@H](CNC(=O)NNc1nc(O)c2cnn(C)c2n1)N1CCCC1	770335530	KGFPYQNNBSMYCQ-HNNXBMFYSA-N	426.481	1.541	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)CCCS(=O)(=O)c1ccc(Br)cc1	772106982	SSYKFCNDEQDZBG-LLVKDONJSA-N	449.323	1.492	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NNC(=O)[C@@H]2CSCN2C(=O)C(C)(C)C)C1	773418362	TYAJXJMQOUIJEX-KGLIPLIRSA-N	442.582	1.729	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cn(C)nc2C(F)(F)F)o1	773542323	WNZHOPCQVZGGFM-UHFFFAOYSA-N	430.387	1.273	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(N3CCCS3(=O)=O)c2)cc1F	773890206	YCIYLCCHCZRKIO-UHFFFAOYSA-N	434.449	1.074	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)N(C)CC(=O)NNc2ccc(C(F)(F)F)cn2)cc1	775255311	PFTVZVBZIRERSN-UHFFFAOYSA-N	445.423	1.823	50	20	IDGD	
C[C@H](CN(C)Cc1ccccc1)NC(=O)NNC(=O)c1csc(N2CCOCC2)n1	775774115	MBEKLJYVDKAIJX-OAHLLOKOSA-N	432.550	1.444	50	20	IDGD	
C[C@]1(NNC(=O)N[C@H]2CCN(c3ccccc3C(F)(F)F)C2=O)CCS(=O)(=O)C1	776183778	WCOLJOYLVVXJMQ-LRDDRELGSA-N	434.440	1.192	50	20	IDGD	
CN(NC(=O)Cn1cc(Br)cn1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776213396	OTQGAGSUNRULFJ-UHFFFAOYSA-N	445.318	1.281	50	20	IDGD	
C[C@H](NC(=O)CC(C)(C)C)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	778282794	LDUOLCAJDMEUKY-AWEZNQCLSA-N	438.550	1.173	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)c1ccc(Cl)c(Cl)c1)C(=O)NN(C)C(N)=O	778417856	GMBHXSMQSOZILS-LLVKDONJSA-N	429.351	1.435	50	20	IDGD	
COc1ccc([C@@H]2[C@@H](C(=O)NNC(=O)CNC(=O)OC(C)(C)C)CCC(=O)N2C)cc1	778437021	RLDFZLUFKJTZEH-MAUKXSAKSA-N	434.493	1.277	50	20	IDGD	
O=C(Cc1ccccn1)NNC(=O)C(=O)Nc1cc(Cl)ccc1OC[C@H]1CCOC1	778711904	XNKJVJZCVWMHIS-ZDUSSCGKSA-N	432.864	1.479	50	20	IDGD	
COCc1cc(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2Br)ncn1	778752141	MYEZFLJEMOUVIK-UHFFFAOYSA-N	425.199	1.376	50	20	IDGD	
COc1ncnc(N(C)C)c1NC(=O)C(=O)NNc1ccc(Br)cc1F	783081650	SZCJBYRHAWGEIY-UHFFFAOYSA-N	427.234	1.535	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNc2ccc(C)cc2)ccc1S(=O)(=O)N1CCCC1	783346414	OLBODXUTIJZCMH-UHFFFAOYSA-N	432.502	1.870	50	20	IDGD	
COc1cccc(CC(=O)N2CCc3ccc(NC(=O)C(=O)NN=c4cc[nH]cc4)cc32)c1	783378781	NKMGYIXUTDYBPY-UHFFFAOYSA-N	445.479	1.726	50	20	IDGD	
Cc1cc(F)ccc1NNC(=O)C(=O)N1C[C@H](C(=O)N2CCOCC2)Oc2ccccc21	783448049	VGWSFHNUHHMWHX-LJQANCHMSA-N	442.447	1.230	50	20	IDGD	
COc1cc(OC)c(Cn2nccc2NC(=O)C(=O)NNc2ccccn2)c(OC)c1	784795346	WFWGKUOARVLZOU-UHFFFAOYSA-N	426.433	1.434	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1ccc(NC(=O)C(C)C)cc1	785339015	QJIHVUNHQCASNO-UHFFFAOYSA-N	448.501	1.775	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccccc2F)cc1C(=O)N(C)C(C)C	787542504	LEYYOHQDAROUNZ-UHFFFAOYSA-N	428.464	1.943	50	20	IDGD	
CC(C)C[C@H](C(=O)NNc1ccccc1S(N)(=O)=O)N1C(=O)[C@H]2CC=CC[C@H]2C1=O	788223414	JEEOBVRVIRODPN-IJEWVQPXSA-N	434.518	1.143	50	20	IDGD	
COC(=O)c1cccc(Cl)c1S(=O)(=O)NNC(=O)c1cnn(-c2ccccc2)c1	790069035	RXOFEUDZJGSJJA-UHFFFAOYSA-N	434.861	1.936	50	20	IDGD	
O=C(NCCCCn1cc(Br)cn1)NNC(=O)c1ccc(-n2cnnn2)cc1	792219996	HWFAHZZNFZSSAS-UHFFFAOYSA-N	448.285	1.046	50	20	IDGD	
CC[C@H](C)CC[C@@H](O)CC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	792774052	MOMGWRHTZITSJT-DOTOQJQBSA-N	425.551	1.809	50	20	IDGD	
COCc1cc(C(=O)OC)cc(S(=O)(=O)NNC(=O)c2ccc(Cl)cc2OC)c1	793354580	YLEQHKHLHJITLO-UHFFFAOYSA-N	442.877	1.905	50	20	IDGD	
CCOC(=O)c1cc(Cl)cc(S(=O)(=O)NNC(=O)CNC(=O)c2cccs2)c1	793387142	BJKWJNSLMJSNNN-UHFFFAOYSA-N	445.906	1.318	50	20	IDGD	
C[C@H](CC(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1)S(=O)(=O)c1ccc(F)cc1	794709600	BTGYJOHOGPAOMV-CYBMUJFWSA-N	443.522	1.772	50	20	IDGD	
CC(C)COC(=O)N1CCC(C(=O)NNc2ccccc2S(=O)(=O)N(C)C)CC1	795150492	CZDXNXBEOPFNNU-UHFFFAOYSA-N	426.539	1.885	50	20	IDGD	
CCOCCCn1c(NNC(=O)c2ccc(S(N)(=O)=O)cc2)nc2ccccc2c1=O	798326263	BYRSQQFUKUFEKC-UHFFFAOYSA-N	445.501	1.227	50	20	IDGD	
Cn1cc2c(n1)CCC[C@@H]2C(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	798980181	GNIDQHFRYCBNGM-SFHVURJKSA-N	444.967	1.459	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)N[C@@H](Cn1ccccc1=O)c1ccccc1	799912534	WVGCPHHHMPHOJB-INIZCTEOSA-N	439.497	1.412	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cnn(CC(=O)NC3CCCCC3)c2)cc1	801105480	GAIDSSTYLWDQMB-UHFFFAOYSA-N	426.477	1.040	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@H](C(=O)NNC(=O)Nc2ccc3c(c2)OCO3)C(C)C)cc1	802093635	UVGJDAXXJRXXMX-SFHVURJKSA-N	448.501	1.880	50	20	IDGD	
CCOc1ccc(C(=O)NCC(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)cc1	802304658	JFXZZTACFYRXMC-UHFFFAOYSA-N	433.848	1.473	50	20	IDGD	
CN(C(=O)OC(C)(C)C)[C@H](C(=O)NNc1ccccc1S(C)(=O)=O)c1cnn(C)c1	802762354	CSEXWJFPNKPHIP-INIZCTEOSA-N	437.522	1.875	50	20	IDGD	
O=C(NNc1ccc2c(=O)[nH]ccc2c1)c1cc(S(=O)(=O)N2CCCC2)ccc1O	803434417	GKNXGZRRGQKQGT-UHFFFAOYSA-N	428.470	1.775	50	20	IDGD	
Cn1nncc1CNC(=O)NNc1ccc(S(=O)(=O)NC2CCCCCCC2)cn1	807614521	SNVUUZCQYMVOKR-UHFFFAOYSA-N	436.542	1.428	50	20	IDGD	
COC(=O)c1c(F)ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C)c(C)c2)c1F	810385616	WNWVTOWAEOJXOB-UHFFFAOYSA-N	435.383	1.533	50	20	IDGD	
COC(=O)c1c(F)ccc(NC(=O)C(=O)NNC(=O)Cc2c[nH]c3ccccc23)c1C	810386043	JZAFJFYDBXZITQ-UHFFFAOYSA-N	426.404	1.731	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)N2CCN(c3ccccc3)CC2)cc1OC	812450374	GPLUFNAZMABZLM-UHFFFAOYSA-N	426.473	1.204	50	20	IDGD	
C[C@H]1Oc2ccccc2N(CCC(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)C1=O	812727464	RJPIMMXUEHXVCB-CQSZACIVSA-N	432.502	1.584	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2cc3c(cn2)CCCC3)cc1	813013596	XCJVMMISZLRFPQ-UHFFFAOYSA-N	431.518	1.742	50	20	IDGD	
CC(C)n1ncc2ccc(NC(=O)C(=O)NNc3ccc(S(=O)(=O)N(C)C)cc3)cc21	813033398	RFVRTNDXMAUBDB-UHFFFAOYSA-N	444.517	1.949	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)Nc1ccc2c(c1)OCCO2	813465455	RKSOTSDQNPUTQI-UHFFFAOYSA-N	446.485	1.709	50	20	IDGD	
N#Cc1ccc(O[C@@H]2CCN(C(=O)NNC(=O)CNC(=O)OCc3ccccc3)C2)nc1	814328492	YQBIPXFFRDJBCT-QGZVFWFLSA-N	438.444	1.074	50	20	IDGD	
COc1ccc(C(CCC(C)C)=NNC(=O)CSc2nn(C)c(=O)n(C)c2=O)cc1	814785316	PXTNASYFCNIRGH-UHFFFAOYSA-N	433.534	1.536	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1)[C@@H]1C[C@H]1C	815564006	UXNMPQFKFWXPFK-KZULUSFZSA-N	439.428	1.756	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(Br)c(C3CC3)n2)cc1	815568391	GEUABYQTYLJEPM-UHFFFAOYSA-N	428.246	1.993	50	20	IDGD	
CN(C)C(=O)COc1ccccc1C(=O)NNC(=O)[C@H]1CCCN(C(=O)OC(C)(C)C)C1	816509729	ABUBDHFEKACLIN-HNNXBMFYSA-N	448.520	1.562	50	20	IDGD	
COCCN(C)NC(=O)c1ccc(NS(=O)(=O)c2ccc3c(c2)OCCCO3)cc1	816561394	WFMMQNWVEWIMMV-UHFFFAOYSA-N	435.502	1.872	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)c1c(I)cnn1C	817054439	JWCWJSJNTYPEKV-UHFFFAOYSA-N	449.274	1.032	50	20	IDGD	
CC[C@@H](C)[C@H](C(=O)OCC(=O)NNC(=O)c1ccccc1)N1C(=O)c2ccccc2C1=O	844204244	MQQUXLPUAWXCHA-AUUYWEPGSA-N	437.452	1.702	50	20	IDGD	
O=C(c1ccc(NS(=O)(=O)c2ccc(F)c(Cl)c2)cc1)N1CC[C@H](B(O)O)C1	864234205	OHZMDDMEIWGCKH-LBPRGKRZSA-N	426.662	1.969	50	20	IDGD	
CC(C)(C)C(=O)NNC(=S)Nc1cc(S(=O)(=O)N2CCOCC2)ccc1Cl	864237732	HWEISWDDVKCBFO-UHFFFAOYSA-N	434.971	1.725	50	20	IDGD	
O=C(Cn1nc2ccccn2c1=O)NNC(=O)c1cc(-c2ccco2)nc2ccccc12	890930588	RVSIYVIDWLJPEA-UHFFFAOYSA-N	428.408	1.765	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@H](C)C(=O)NNC(=O)CN1C(=O)[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O	912868671	JKNGSQRBDMHHCN-ZCHQSPEWSA-N	445.903	1.679	50	20	IDGD	
CCn1c(NNC(=O)c2cccc(S(=O)(=O)NCCOC)c2)nc2ccccc2c1=O	913055281	NTIIZEXUNHEEAZ-UHFFFAOYSA-N	445.501	1.098	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)CNS(=O)(=O)c3cccc(F)c3)cc2C1	913162347	BLBLUYJRWPNMRM-LLVKDONJSA-N	425.507	1.752	50	20	IDGD	
Cc1ccc(/C=C(/C#N)C(=O)OCC(=O)N(C[C@@H]2CCCO2)[C@H]2CCS(=O)(=O)C2)cc1	913229212	VEUWIYHDTOZEBT-CKMYNJMQSA-N	446.525	1.640	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@@H]2CC(=O)N(C3CCCCC3)C2)c2ccccc2c1=O	914829708	MYMTYEGGUWSYSX-CQSZACIVSA-N	425.489	1.359	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)cc1NC(=O)c1ccccc1F	915282388	BJKKLZPSGFOTCQ-AWEZNQCLSA-N	433.461	1.582	50	20	IDGD	
Cc1ccc(-c2nn(CCC#N)cc2C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)cc1C	920852200	VHWSMQXKQZMLBG-MRXNPFEDSA-N	444.517	1.212	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2cccc(OCC(F)(F)F)n2)c1	1116842914	MWMURNBMFMFQFZ-UHFFFAOYSA-N	446.407	1.570	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2ccc(Cl)nc2)sc1Br	1251768279	XNNBTXXNQNGDJE-UHFFFAOYSA-N	439.700	1.281	50	20	IDGD	
O=C(Cn1nc2n(c1=O)CCCCC2)NNC(=O)NCc1cccc(C(F)(F)F)c1	1318017970	LBVZBNFLCKDNIO-UHFFFAOYSA-N	426.399	1.321	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)ccc1-n1cnnn1	1318611719	JQRDNPUJZWDGRU-UHFFFAOYSA-N	429.481	1.379	50	20	IDGD	
CN(C(=O)CNC(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1)C1CCCCC1	1322488743	NOHFEVHCCOVKPR-UHFFFAOYSA-N	439.557	1.755	50	20	IDGD	
CC(=O)Nc1c[nH]nc1[C@@H]1CCCN(C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)C1	1325063008	BHWGSKNMTOAFOX-OAHLLOKOSA-N	436.476	1.788	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)c2nc(C3CC3)n(-c3ccccc3)n2)c2ccccc2c1=O	1325639570	FSHCHHDYCDVJDC-UHFFFAOYSA-N	429.440	1.466	50	20	IDGD	
O=C(CCc1ccc2c(c1)CCO2)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	1331969299	GJVOPRWAYVPSPN-UHFFFAOYSA-N	443.525	1.800	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C(=O)Nc2cccnc2)C1	1779487935	AMOIESPMVFBHHG-CBGDNZLLSA-N	436.940	1.942	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccn(C(F)F)n3)C2)C1	1779615447	CMBOIDLGOKBTIK-HOTGVXAUSA-N	425.263	1.958	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnn(C)c2Cl)C1	1779929843	CLKCBAOWHXQZRL-CJBNDPTMSA-N	447.761	1.984	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H]3CC[C@H]4CCC(=O)N4C3)C2)C1	1781054830	XOWOXPSCYDTFQG-IAGYGMIVSA-N	425.957	1.625	50	20	IDGD	
O=C(CCc1ccc(F)nc1)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781325567	FODQDLSJPFHBBL-DOTOQJQBSA-N	432.265	1.674	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnn3cc(C)cnc13)C2	1782175341	HQYAXVWCIBUIFA-CBGDNZLLSA-N	449.939	1.419	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)Cn1ccnc1)C2	1782178495	NEZDAHVJVVCQRP-AXVVYFOYSA-N	426.945	1.287	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3c4c(nn3C)CCC4)C2)C1	1782434319	HAKUGICWCIMUFQ-ORAYPTAESA-N	439.354	1.383	50	20	IDGD	
CCN(CC)C[C@H](C)C(=O)N1CC[C@@]2(CN(C(=O)[C@H](C)CBr)CCO2)C1	1782685486	DDCMKZSRPLKKGG-GJYPPUQNSA-N	432.403	1.825	50	20	IDGD	
Cn1cnc(C(=O)N2CCO[C@@]3(CCN(C(=O)/C(C#N)=C/c4ccc(F)cc4F)C3)C2)c1	1782863775	MAGMLIIETOUIBQ-XXFFJTNUSA-N	441.438	1.749	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@]2(CN(C(=O)CSC(=N)N)CCO2)C1	1782864523	NJOAKPFBWVFFFF-FZXOMJPYSA-N	449.483	1.328	50	20	IDGD	
COc1ccccc1CC(=O)N1CC[C@@]2(CN(C(=O)CCBr)CCO2)C1	1783326937	KPIKTWFSBYVUAT-IBGZPJMESA-N	425.323	1.853	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cn(C)nc3OC)CCO2)C1	1783344999	VQLZOVOFWKPXRA-GUYCJALGSA-N	429.315	1.046	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](N)c3ccccn3)C[C@@H]21	1783968686	YTXCBZUHWUWZNX-JBJRXJHCSA-N	439.354	1.092	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccnc3OCC3CC3)C[C@@H]21)[C@@H](O)CCl	1784087117	YZEXEFUBDQFPRM-DKIMLUQUSA-N	437.924	1.063	50	20	IDGD	
Cc1snc2sc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]4C3)cc12	1784090977	SBOBJDNWOUPWKD-PYJNHQTQSA-N	443.978	1.859	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3c(F)ccc(Cl)c3F)C[C@@H]21)[C@H](O)CCl	1784095484	IZCBTCHESSYPBQ-ZNIXKSQXSA-N	437.270	1.811	50	20	IDGD	
Cc1nn(C)c(C)c1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCBr)[C@H]2C1	1786400923	GQBNRKNXWQTLGU-KKUMJFAQSA-N	427.343	1.415	50	20	IDGD	
CC1CCN(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCBr)[C@H]3C2)CC1	1786404836	WEVXVQDKDWWRIM-ULQDDVLXSA-N	430.387	1.483	50	20	IDGD	
CCC(C)(C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)[C@H]2C1	1787507615	JFLRIPXUEYLIEB-SMKMMKTPSA-N	431.537	1.536	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C/N=C/c3ccco3)[C@H]2C1	1788679893	ZVUZHHSYIADBSV-KTQGASMTSA-N	430.332	1.915	50	20	IDGD	
Cc1cc2[nH]c(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)[C@H](O)CCl)C[C@@H]43)cc2s1	1790377209	DRDKVAKWYJVENN-RKLWJJNISA-N	425.938	1.731	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)[C@@H]1CCc2cccc(Cl)c21	1790688350	DAWAQQFTGQDHPW-FZMWSMFESA-N	441.355	1.949	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c[nH]c3cc(Cl)ccc13)C2)[C@@H](O)CCl	1792978371	SKJFDSCSJDOZKY-YNHQPCIGSA-N	426.300	1.624	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H]2C[C@@]2(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](O)CCl)C1	1793116176	HUBRGFOQCDKAOF-VUSYMWPTSA-N	441.956	1.481	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCOCCOCCOC)C2	1793453144	SDGVESCHJAZARU-SFNKJDCFSA-N	434.961	1.053	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(C(F)(F)F)nc1)c1ccc(B(O)O)cc1	1795172015	FENBEIUQGDEGBC-BJWYYQGGSA-N	447.222	1.346	50	20	IDGD	
COCc1c[nH]c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)CBr)C3)c1	1798507530	XAZKIIISXMNAPB-ZIEJDFEHSA-N	428.327	1.395	50	20	IDGD	
COc1ncc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Br)cc1C	1799347362	GYIPTCPUPRACII-CRWXNKLISA-N	430.274	1.292	50	20	IDGD	
COc1cc(C)cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Br)c1	1799348678	MHTWEDCMZQSNOA-OCVGTWLNSA-N	429.286	1.897	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc2ccnn2c1	1801059364	VMDUIKQLECWMLA-BECFQBPISA-N	447.499	1.720	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CCc2ccccc2C1)c1cccc(B(O)O)c1	1801840628	PQFCCBVUFSULSC-XBYSBRQOSA-N	432.329	1.423	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCc1ccc(F)cc1	1802017710	OHZIQWIFSHFZCQ-BCDXTJNWSA-N	439.491	1.709	50	20	IDGD	
Cc1ccc(C(=O)NC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)o1	1803781919	GILGIFAXDQTWHL-OXJNMPFZSA-N	448.483	1.615	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2ccc(F)s2)[C@H]1c1cccnc1	1804736367	JETRUYPJNYHMFO-FOIQADDNSA-N	447.536	1.975	50	20	IDGD	
Cn1ccc(CC(=O)NC[C@@H]2CCN(C(=O)[C@H](F)Br)[C@H]2c2cccnc2)n1	1807518329	SXTPPGOUDKCWER-JQFCIGGWSA-N	438.301	1.754	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)c1cn2cc(F)ccc2n1	1809848224	QSTJLRKLVSRWCN-FNHZYXHNSA-N	445.882	1.788	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H](CNC(=O)CCc2nc(N)n[nH]2)[C@H]1c1cccnc1	1810153043	VDVWYOLMOAFYAY-DNVCBOLYSA-N	445.600	1.272	50	20	IDGD	
COc1cc(C(=O)NC[C@H]2CCN(C(=O)CO[Si](C)(C)C)[C@@H]2c2cccnc2)nn1C	1811633288	DYLQKSZYYFSBQS-OXQOHEQNSA-N	445.596	1.995	50	20	IDGD	
O=C(COc1ccccc1F)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1	1812779480	XWRMAYSHQQTNSU-RIFZZMRRSA-N	435.883	1.905	50	20	IDGD	
Cc1oncc1C(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1813071542	UOJHLRLHJPSJRW-OXJNMPFZSA-N	428.493	1.071	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccon2)n[nH]1	1816591468	NAUOEJVAWHPYGM-PLVXZXGYSA-N	438.448	1.838	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnc(O)nc3O)sc2C1	1817090088	SXGCFJORPCJOBW-NKWVEPMBSA-N	442.295	1.354	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(O)nc(O)n3)sc2C1	1817109059	UYGKYFLPYNFNAZ-RNFRBKRXSA-N	442.295	1.354	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CC[C@@H](N)C(N)=O)n[nH]1	1817358157	CABYPEVULPQGGM-LOWVWBTDSA-N	443.346	1.168	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1	1817473833	BTMQLEWEPDXNEE-WBVHZDCISA-N	432.717	1.803	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(Cl)o3)sc2C1	1817924074	HQWDHNLEVAUNCC-SNVBAGLBSA-N	439.925	1.988	50	20	IDGD	
Cc1cccc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2cccc(B(O)O)c2)CC3)c1	1822133672	AFIVMRSLOVEVCQ-QGZVFWFLSA-N	435.314	1.671	50	20	IDGD	
C[C@@H](NC(=O)OC(C)(C)C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1	1822275358	YHRIXSCXBMPNJB-MRVWCRGKSA-N	443.932	1.915	50	20	IDGD	
C[C@@H](CS(C)(=O)=O)C(=O)N1CCCC[C@H]1c1cc(NC(=O)C(Cl)Cl)n[nH]1	1822419400	XLNPBIPQYHICTN-ONGXEEELSA-N	425.338	1.886	50	20	IDGD	
N#Cc1ccccc1OCC(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1	1823385502	INEAGJQJOJZYIZ-HZPDHXFCSA-N	431.880	1.952	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](O)CCl)CC2)c1cc2cccnc2nc1O	1823981016	VPNRWGVVEHJUFT-GXFFZTMASA-N	447.904	1.617	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3cc(C)n4ccnc4n3)sc2C1	1824118852	KEHRPNXJQMKKOW-RYUDHWBXSA-N	448.936	1.974	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@H](O)CCl)CC2)c1cnn2cccc(F)c12	1824366782	YSRGICWIUBNESL-NOZJJQNGSA-N	437.884	1.755	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC([C@H]2CCCCN2C(=O)C[C@@H]2NC(=O)NC2=O)CC1	1825075472	ZWJMIQNQVLVOKX-JKSUJKDBSA-N	438.601	1.056	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cn(C)nc1OC)CC2	1825994449	ULTFQFMPEWUWEY-MWLCHTKSSA-N	427.914	1.365	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1c3c(nn1C)CCC3)CC2	1826004650	PXCCGMHKJFZNLA-ZYHUDNBSSA-N	437.953	1.845	50	20	IDGD	
C=CCSCC(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827056013	NYRQIOVDUYYAPY-HXUWFJFHSA-N	430.379	1.519	50	20	IDGD	
CS(=O)(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCBr)CC2	1827203763	BTYQRNLBPATKSC-SECBINFHSA-N	438.369	1.275	50	20	IDGD	
CCOC(=O)N[C@H](O)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@H](C)Br)CC1	1828763084	JPGVAVREOZFKRG-AEGPPILISA-N	448.358	1.454	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(=O)n3[nH]cnc3n2)CC1	1830305874	FEHOKBGFBCJXKN-HOCLYGCPSA-N	434.928	1.668	50	20	IDGD	
O=C(CCn1cncn1)N1CCC([C@@H]2CCCCN2C(=O)[C@H](F)Br)CC1	1830381103	GYCAXJUZDAQLMD-HOCLYGCPSA-N	430.322	1.978	50	20	IDGD	
Cc1cccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)n1	1830923203	YBPJRDSXKVOOMW-BEFAXECRSA-N	440.338	1.172	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3Cc4ccccc4O3)C2)C1	1831651825	SWGSOWBRBPLEQU-LQBOVUBWSA-N	436.936	1.854	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1Cc3ccccc3CN1C)CCO2	1832472840	SZAZNPDPCXMFFJ-MZKRTTBSSA-N	449.979	1.517	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)C(=O)C3CC3)CC2)CC1	1833280343	SUNHQJZXOLLXBY-MRXNPFEDSA-N	428.371	1.711	50	20	IDGD	
CCC(=O)N[C@H](C)C(=O)NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1	1833421950	PUKCJCWULOBRKZ-WBMJQRKESA-N	449.365	1.163	50	20	IDGD	
Cc1cc(C)n(CC(=O)NC2CCN(C3CCN(C(=O)CO[Si](C)(C)C)CC3)CC2)n1	1833838779	VDRCXFNXKURMMB-UHFFFAOYSA-N	449.672	1.923	50	20	IDGD	
Cc1ncoc1C(=O)NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1	1834258327	CYWCCLAEIHFAQE-UHFFFAOYSA-N	427.343	1.953	50	20	IDGD	
Cn1cncc1C(=O)N1CCC(N2CCC(NC(=O)CCBr)CC2)CC1	1834421180	OADHLCVDSSWWHY-UHFFFAOYSA-N	426.359	1.390	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)NC1CCN(C2CCN(C(=O)CO[Si](C)(C)C)CC2)CC1	1835830842	RGZLTTYEYZVRNV-MRXNPFEDSA-N	438.645	1.100	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)c3ccnn3C)CC2)CC1	1837487968	KNELIZYBSWTDPG-ZDUSSCGKSA-N	427.343	1.816	50	20	IDGD	
Cc1cnoc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)CBr)C2)C1	1838389302	BUAYBOSFIFDRHU-PXAZEXFGSA-N	430.299	1.084	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(OC)cc3)CCO2)C1	1838967410	BTICLBJORAWTHE-XLIONFOSSA-N	426.897	1.019	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3cnc4[nH]ccc4c3)C2)C1	1839148952	OVTJVIUOSJGKHN-AVRDEDQJSA-N	448.951	1.969	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cscn3)C2)C1	1839151823	FAMDMXATXCMMPP-SJORKVTESA-N	436.361	1.378	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3[C@@H]4C=CS[C@@H]34)C2)C1	1839155145	KLUZMZQLCNTEKO-AJRPESIASA-N	435.373	1.554	50	20	IDGD	
O=C(c1ccc(O)cc1F)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839201744	HZISFEJJQVIXPZ-WMLDXEAASA-N	449.248	1.292	50	20	IDGD	
Cc1cc(F)ccc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839203415	KOBIKPFAVBGZFL-CRAIPNDOSA-N	447.276	1.895	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cn4c(F)cccc4n3)CCO2)C1	1839555485	CPLCOHCEXGWIGC-XOBRGWDASA-N	438.887	1.561	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3CCCCN3C)C2)C1	1839961870	LQOWFKDNTUNWQT-GJYPPUQNSA-N	446.386	1.101	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3ccoc3)C2)C1	1839967112	AVWPELXCVRCVDF-LPHOPBHVSA-N	443.338	1.842	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)COc3ccccc3F)CCO2)C1	1839968038	MZPUNRBXVHIDPR-NRFANRHFSA-N	442.915	1.926	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(Cl)c3)C2)C1	1840154131	MCGZQNGUGIWKPG-QFBILLFUSA-N	431.316	1.664	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)CCOc2ccc(F)cc2)C1	1841194383	KJXRTPLDQRVDAB-UHFFFAOYSA-N	441.463	1.110	50	20	IDGD	
O=C(c1cc2cc(Br)ccn2n1)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1	1841351666	WSGQVVMOAVPKGJ-CQSZACIVSA-N	441.713	1.514	50	20	IDGD	
CC[C@@H](C)[C@@H](N)C(=O)N1CC2(CCCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C1	1841924436	MFROIMPPHLIWQG-QLFBSQMISA-N	430.977	1.695	50	20	IDGD	
COc1cc(F)cc(/C=C/C(=O)N2CC3(CCCN3C(=O)c3ccc(B(O)O)cc3)C2)c1	1843012316	BELVLCWBEGRWFC-FPYGCLRLSA-N	438.264	1.045	50	20	IDGD	
O=C1CCc2ccc(C(=O)N3CCCC34CN(C(=O)[C@@H](F)Br)C4)nc2N1	1843233060	YDCCWWVUNDBSHB-CYBMUJFWSA-N	425.258	1.474	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)C(=O)NCC(C)C)C1	1843433244	LVWHRMMFFKIAQJ-UHFFFAOYSA-N	446.460	1.109	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)[C@@H]1CCCN1C)C2	1844691951	RUKKVDGXJCONJL-KRWDZBQOSA-N	430.461	1.431	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)c1snnc1C)C2	1844692671	XAZCXLZTOZSRFV-UHFFFAOYSA-N	445.457	1.811	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@H]1C[C@H](F)CN1C(=O)OC(C)(C)C)C2	1846365737	SEYSIAVXGDWNFM-ZNMIVQPWSA-N	447.935	1.791	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC=C(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](O)CCl)C1	1847557435	YNRRMNYCHPQRAN-HRCADAONSA-N	427.929	1.355	50	20	IDGD	
C#CCCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl	1847565404	PHRAPTOTELSANQ-LUKYLMHMSA-N	441.956	1.485	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2n[nH]c(=O)c3ccccc23)cc(OC)c1Br	15855714	GYOZXEASZQGJEG-UHFFFAOYSA-N	447.245	1.778	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2OC)c2ccccc2c1=O	17163333	LVDKHLXMGOFCAJ-UHFFFAOYSA-N	425.401	1.798	50	20	IDGD	
CC[C@@H](C)NS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cc(Br)c[nH]2)cc1	23914923	GMXDWSNYUZUHRY-SNVBAGLBSA-N	443.323	1.929	50	20	IDGD	
O=C(Cn1c(S)nnc1-c1cccs1)NNC(=O)c1cc(Br)c[nH]1	24123942	DTHBAXIBKAQAGN-UHFFFAOYSA-N	427.309	1.847	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)OC)c1	26792813	ISMAGKKLCCWLTK-UHFFFAOYSA-N	445.501	1.242	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)CN2C(=O)N[C@](C)(c3ccc(F)cc3)C2=O)c2ccccc21	26938036	AMKFYZPEDKGJRI-JOCHJYFZSA-N	437.431	1.546	50	20	IDGD	
CCC(=O)N1CCC[C@@H](C(=O)NNC(=O)c2cccc(S(=O)(=O)N(CC)CC)c2)C1	108688850	HJGGRMKRBLESBD-MRXNPFEDSA-N	438.550	1.127	50	20	IDGD	
C[C@H](c1ccc(-n2cncn2)cc1)N(C)C(=O)NNC(=O)CNC(=O)c1cccs1	725871967	MIULTNBXGUEMBO-CYBMUJFWSA-N	427.490	1.492	50	20	IDGD	
CCc1ccc(C(=O)NNS(=O)(=O)c2cc(C(=O)OC)sc2C(=O)OC)cc1	726520147	ZGLIUDJARGUQBH-UHFFFAOYSA-N	426.472	1.507	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)c2cc(-c3ccccc3)on2)cc1S(=O)(=O)NCC#N	726880269	WCQFZNGCYGEDCH-UHFFFAOYSA-N	439.453	1.527	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(N3CCCC3)nc2)c1	727096216	MJXRBQGTCOEYHF-UHFFFAOYSA-N	445.545	1.787	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)c2ccc3c(c2)CCN3S(C)(=O)=O)cc1F	727499246	JAFQTBLGXXJCRY-UHFFFAOYSA-N	438.506	1.788	50	20	IDGD	
CN(C)C(=O)[C@@H]1CCCN1CCCNC(=O)NNC(=O)c1c(Cl)cccc1Cl	727942411	SWWKMYQEJZWYEF-AWEZNQCLSA-N	430.336	1.880	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3cc(Br)c[nH]3)cc2)CC1	728213244	HINYQQSBAZSOEB-UHFFFAOYSA-N	442.339	1.470	50	20	IDGD	
CC(C)CC(=O)NNS(=O)(=O)c1ccc(S(=O)(=O)N2C[C@@H](C)C[C@@H](C)C2)cc1	728261209	OVSCSFNJVUQDIW-GASCZTMLSA-N	431.580	1.709	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)CSCC(=O)N2CCCCC2)c1	728527344	GOEIXDYLMCDJLV-UHFFFAOYSA-N	444.351	1.964	50	20	IDGD	
O=C(CNC(=O)NCc1ccc(F)cc1)NNC(=O)c1cc(F)ccc1Br	728548672	NVSFQSKKEQPMCH-UHFFFAOYSA-N	441.232	1.988	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl)C1CCN(c2ncccn2)CC1	728854331	RETQVHWCHOYGRL-UHFFFAOYSA-N	440.869	1.264	50	20	IDGD	
O=C(CCCc1ccccc1)NNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1	728954721	WWMXDXXXTBBKLS-UHFFFAOYSA-N	425.493	1.078	50	20	IDGD	
CC[C@@H](N=c1nn[nH]n1-c1ccccc1)C(=O)NNC(=O)c1cc2c(s1)CC[C@@H](C)C2	729282336	RRHHQZLSRCTYMU-CZUORRHYSA-N	439.545	1.922	50	20	IDGD	
CCOc1ccc(CN2C(=O)c3ccccc3C2=O)cc1C(=O)NNC(=O)c1cnn[nH]1	729456069	PLEQNZDAZRIWIB-UHFFFAOYSA-N	434.412	1.074	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)NCCS(=O)(=O)N2CCSCC2)c1C	730499638	CLDPHHVABURZMV-QGOAFFKASA-N	440.591	1.153	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCCC2)c1	730780570	OVLGOGYZFCEKFC-UHFFFAOYSA-N	447.513	1.797	50	20	IDGD	
Cc1ccc(S(=O)(=O)NC(C)(C)C)cc1C(=O)NNC(=O)COc1ccccc1O	730782325	MVPBLAKDXUKDNW-UHFFFAOYSA-N	435.502	1.617	50	20	IDGD	
Cc1noc(C)c1S(=O)(=O)N1CCN(C(=O)/C(C#N)=C\c2cc(C#N)n(C)c2C)CC1	730830442	PCOAFWUPQXAZNW-MFOYZWKCSA-N	442.501	1.250	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2c[nH]nc2C)cc1S(=O)(=O)N[C@@H]1CCCC[C@@H]1C	732084080	KDHPWMSYUUFLEZ-BLLLJJGKSA-N	449.533	1.659	50	20	IDGD	
CCOCCCn1c(NNC(=O)Cn2nnc(-c3ccccc3)n2)nc2ccccc2c1=O	733267662	AHBSSRGZWNFTMO-UHFFFAOYSA-N	448.487	1.620	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)CSCC(=O)Nc2cccc(Br)c2)cn1	735520778	ABDMPWIKUQQFJL-UHFFFAOYSA-N	426.296	1.316	50	20	IDGD	
O=C(NNC(=O)c1ccn(-c2c(Cl)cc([N+](=O)[O-])cc2Cl)n1)C(=O)N1CCCC1	736073158	BUHQVBKIYZKPAP-UHFFFAOYSA-N	441.231	1.471	50	20	IDGD	
COc1ccc(C(=O)N2CCN(C(=O)NNC(=O)COCc3ccccc3)CC2)cc1	738496712	VBIJRVUJYMAGBL-UHFFFAOYSA-N	426.473	1.411	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H](CCCO)c2ccccc2)c1	741095138	YZQFBNWJPHEXOL-SFHVURJKSA-N	434.518	1.395	50	20	IDGD	
CC(=NNC(=O)NCCNC(=O)OC(C)(C)C)c1cccc(N2CCCS2(=O)=O)c1	741164224	CCNKJJKPBASRMD-UHFFFAOYSA-N	439.538	1.774	50	20	IDGD	
Cc1cc(N2CCCS2(=O)=O)ccc1C(=O)NNc1nc2ccccc2c(=O)n1C	741690300	DMDXQUIGHQCDDY-UHFFFAOYSA-N	427.486	1.539	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)N2CCSC[C@@H]2S(C)(=O)=O)N(C)c2ccccc21	742179922	RYPHVXDDSOILRC-IBGZPJMESA-N	448.570	1.603	50	20	IDGD	
Cc1oc(C(=O)O)cc1S(=O)(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12	742231810	ZEYSIQMGEHZKOY-UHFFFAOYSA-N	434.430	1.200	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@@H]2CCC(=O)N2Cc2ccc(C)cc2)cc(OC)c1OC	742471242	AWMGCTKJLDLGTP-KRWDZBQOSA-N	441.484	1.973	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc(OC)c1OC(F)F	742473565	DMVVPWNNEJSZQE-UHFFFAOYSA-N	448.382	1.627	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)C(F)(F)C(F)(F)C(=O)NNc2nc(C)cc(C)n2)n1	742510447	CMYCSAWPLSAILH-UHFFFAOYSA-N	430.366	1.357	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)c2cn([C@H]3CCS(=O)(=O)C3)nc2C(C)C)cc1	744361465	AYMIHJGRUTUEDV-INIZCTEOSA-N	448.545	1.769	50	20	IDGD	
CSCC[C@@H](C(=O)NNC(=O)CCOc1ccccc1)N1C(=O)[C@H]2CCCC[C@H]2C1=O	747179399	SBIWTONOHQJMHU-KSZLIROESA-N	447.557	1.900	50	20	IDGD	
Cc1ccc(S(=O)(=O)Nc2ccccc2F)cc1C(=O)NNc1nccn(C)c1=O	747938779	ZFTPBCWJCLQMSU-UHFFFAOYSA-N	431.449	1.786	50	20	IDGD	
CS(=O)(=O)Cc1cccc(CNC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])c1	749192091	OIIFIKYUCJLDIH-UHFFFAOYSA-N	436.446	1.049	50	20	IDGD	
CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	749323279	OZZHHEPYDZAEIB-SFHVURJKSA-N	427.392	1.724	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)[C@@H](Cc1c[nH]c2cc(F)ccc12)NC(C)=O	749330805	WDGUMYDLRCKZLI-GOSISDBHSA-N	442.447	1.589	50	20	IDGD	
O=C(NNC(=O)C1CCN(S(=O)(=O)c2cccnc2)CC1)c1cc2ccccc2o1	749476489	NADKDZJJYVYMQC-UHFFFAOYSA-N	428.470	1.690	50	20	IDGD	
Cc1oc(-c2ccco2)nc1CC(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	749561348	PJTHFMQJHJZZIF-UHFFFAOYSA-N	438.849	1.548	50	20	IDGD	
CC[S@](=O)[C@H]1CCC[C@@H](NC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)C1	750297296	QSYBKCCJTCKHFI-VXKZXEGRSA-N	430.552	1.506	50	20	IDGD	
O=C(O)c1cc([N+](=O)[O-])cc(S(=O)(=O)NNC(=O)C(F)(F)Oc2ccccc2)c1	751141834	HXDLOMKUBHBZEJ-UHFFFAOYSA-N	431.329	1.274	50	20	IDGD	
COc1nc(N2CCN(C(=O)NNC(=O)c3ccccc3C)CC2)ncc1Br	751147455	AYLAHIGYWPOFHI-UHFFFAOYSA-N	449.309	1.733	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)N2CCN(c3ncccc3C(N)=O)CC2)c1C	751388425	VFLYDLRSLRFGCO-RGEXLXHISA-N	436.516	1.501	50	20	IDGD	
O=C(COCCNC(=O)c1ccccc1)NNc1nc(Br)cn2ccnc12	753424808	KXLJETHQWYBJKQ-UHFFFAOYSA-N	433.266	1.382	50	20	IDGD	
O=C(NNC(=O)c1cc2ccccc2o1)NC1CCN(S(=O)(=O)C(F)(F)F)CC1	755189660	VCZWYUDDUPXEFW-UHFFFAOYSA-N	434.396	1.691	50	20	IDGD	
CSc1nnnn1-c1cccc(NC(=O)NNC(=O)c2cncc(NC(C)=O)c2)c1	755734540	OUGRLFWJNSZDFB-UHFFFAOYSA-N	427.450	1.204	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2ccccc2-n2cccn2)cc1	755861454	DAXYOSYNYCWCKN-UHFFFAOYSA-N	442.501	1.654	50	20	IDGD	
Cc1ccc(C)c(N2C(=O)c3ccc(C(=O)NNc4ccc(C(N)=O)nn4)cc3C2=O)c1	757398650	KPCUHKHRRVPLOS-UHFFFAOYSA-N	430.424	1.750	50	20	IDGD	
COC(=O)[C@@H](C)Oc1ccc(/C=C(/C#N)C(=O)Nc2ccc(S(N)(=O)=O)cc2)cc1	758415512	ISQUVSLLOXNMLG-LKKYZFDUSA-N	429.454	1.820	50	20	IDGD	
CC(C)Cn1ncc(C(=O)N2CCN(S(=O)(=O)CBr)CC2)c1C(F)F	758519273	XQRNDEFQAMEBPY-UHFFFAOYSA-N	443.314	1.917	50	20	IDGD	
CN1C(=O)C[C@H](C(=O)NNc2nc(O)c3cnn(C)c3n2)[C@H]1c1ccc(Cl)c(F)c1	759108208	QJWHKPAYILWJHN-LKFCYVNXSA-N	433.831	1.524	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N1CCC(S(C)(=O)=O)CC1	760718684	JOGIIURHFCPBBY-NSHDSACASA-N	448.339	1.466	50	20	IDGD	
O=C(COC(=O)c1cnc(-c2cccnc2)s1)NNC(=O)c1ccc([N+](=O)[O-])cc1	761618797	GVQIBLDMAVJJJJ-UHFFFAOYSA-N	427.398	1.731	50	20	IDGD	
O=C(NNc1nccc(N2CCOCC2)n1)c1cn(-c2ccccc2Br)nn1	762849281	XPZIYQNLZXFZMH-UHFFFAOYSA-N	445.281	1.413	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)c2cc(S(=O)(=O)N3CCCCC3)cn2C)n1	762901628	LCEOXCTVSOKZII-UHFFFAOYSA-N	435.554	1.593	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)CCc2c(C)nc(N3CCOCC3)nc2O)n1	762916063	OQVQHNILYGSWDK-UHFFFAOYSA-N	430.513	1.039	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)NC1CCN(Cc2ccccn2)CC1	763462623	NDDFBEODBSPWEM-UHFFFAOYSA-N	434.541	1.681	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2ccc(OCC(F)(F)F)nc2)c1	763666313	XXKFCPYUBAODNN-UHFFFAOYSA-N	440.378	1.804	50	20	IDGD	
COc1cc(OC)c(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)cc1F	763732417	CFVBTPQLVCVCFV-UHFFFAOYSA-N	430.436	1.382	50	20	IDGD	
O=C(CN1CCCc2ccccc21)NNC(=O)C(=O)Nc1csc(-c2ccccn2)n1	763746455	WNVMALLMTMHOOG-UHFFFAOYSA-N	436.497	1.744	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CC23CC4CC(CC(C4)C2)C3)cc1-n1cnnn1	763752749	NSKYXZFGPKJNII-UHFFFAOYSA-N	437.504	1.663	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2cccc([C@H](C)OC)c2)c2ccccc2c1=O	763786981	TXUYMZSUOAYORO-ZDUSSCGKSA-N	437.456	1.524	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(OC(C)C)nc2)cc1	763878580	RMHZERQCOKXAPP-CQSZACIVSA-N	428.445	1.625	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccc(F)cc2)cc1C	763920054	YMXJIZOUUAEGFF-UHFFFAOYSA-N	436.465	1.224	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)Nc1cnn(Cc2ccccc2)c1	764002087	IUCNXGAPEMXSHN-UHFFFAOYSA-N	445.277	1.432	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)NC(=O)CS2	764010495	ACWACWXVECEPSD-UHFFFAOYSA-N	434.861	1.793	50	20	IDGD	
COC(=O)c1ccc(OC(C)C)c(NC(=O)C(=O)NNC(=O)c2ccccc2OC)c1	764042918	NQDMEMPGFLRVEB-UHFFFAOYSA-N	429.429	1.669	50	20	IDGD	
Cc1ccc(C(F)(F)F)cc1NC(=O)C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	764078404	STLQYHLYHOIJPT-UHFFFAOYSA-N	443.403	1.817	50	20	IDGD	
CC(C)(C)OC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)cn1	764152062	CAIJTXOZOVDXKM-HNNXBMFYSA-N	441.444	1.518	50	20	IDGD	
O=C(CCc1ccco1)NNC(=O)C(=O)Nc1cccc(N2CCN(CC3CC3)CC2)c1	764169538	PWKFDWODZXPNGY-UHFFFAOYSA-N	439.516	1.530	50	20	IDGD	
CC(C)N1CCN(c2cccc(NC(=O)C(=O)NNC(=O)CCc3ccco3)c2)CC1	764172214	RVTJELFLUABDKU-UHFFFAOYSA-N	427.505	1.529	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)C(=O)Nc1ccc(CC(=O)N(C)c2ccccc2)cc1	764296129	VDJNIWORPZDGDU-UHFFFAOYSA-N	434.456	1.323	50	20	IDGD	
CN(C)CCOc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccccc2F)cc1Cl	764313987	PTBSJXSHHVHPSV-UHFFFAOYSA-N	436.871	1.748	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1ccc(NC(C)=O)c(C)c1	764394118	WPMSCIJVBOSBEA-UHFFFAOYSA-N	430.486	1.840	50	20	IDGD	
COc1ccc(-n2c(SCC(=O)NN=Cc3cnnn3C)nc3ccccc3c2=O)cc1	764768430	LRISOWJBKRMPCN-UHFFFAOYSA-N	449.496	1.765	50	20	IDGD	
CC(=NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1)c1ccc(O)c(C)c1	764819324	QXZGVXDMCHDXPB-UHFFFAOYSA-N	444.557	1.856	50	20	IDGD	
Cc1c(Br)cc(C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)c(=O)n1C	764939637	QXVZSJGSTJGEKH-JTQLQIEISA-N	426.242	1.824	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)c2cc(S(N)(=O)=O)ccc2C)n[nH]1	765595291	KEFMTOWQAAYLOD-UHFFFAOYSA-N	429.458	1.116	50	20	IDGD	
CN1CCCCC/C1=N/S(=O)(=O)c1cccc(NC(=O)C(=O)NNc2cnccn2)c1	766260971	ZEMWWUWCTJRWOX-UQQQWYQISA-N	445.505	1.151	50	20	IDGD	
CCCC(=O)N1CCC[C@@H]1C(=O)NNC(=O)CN1CCN(Cc2ccc(C)cc2)CC1	766650380	TVCFDUCAYPZTFG-HXUWFJFHSA-N	429.565	1.051	50	20	IDGD	
CN(C)CCS(=O)(=O)c1ccccc1C(=O)NNC(=O)C12CC3CC(CC(C3)C1)C2	767161376	ISGVTYHMAGEKJV-UHFFFAOYSA-N	433.574	1.999	50	20	IDGD	
CC(C)(C)S(=O)(=O)CC(=O)NNC(=O)COc1ccc(-c2ccc(C#N)cc2)cc1	767191569	GEQBBMBGGKGHKD-UHFFFAOYSA-N	429.498	1.965	50	20	IDGD	
CC(C)(C(N)=O)C(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2Cl)c1	767404177	XFUOZPDWSCZYGG-UHFFFAOYSA-N	438.893	1.413	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)[C@H](C)N2C(=O)[C@@H]3CCCC[C@H]3C2=O)n[nH]1	768273673	ISWYKEIQUZTAOU-BFHYXJOUSA-N	439.472	1.410	50	20	IDGD	
COc1ccc(NNC(=O)[C@H]2CC(=O)N(c3ccc4c(c3)OCCO4)C2)c([N+](=O)[O-])c1	768332402	KXBFXRGZOIQHAN-LBPRGKRZSA-N	428.401	1.871	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@@H]2[C@H]3Cc4ccccc4[C@H]32)c1	769151303	PTZWLZREVKPFRE-GUDVDZBRSA-N	428.514	1.467	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)[C@@H]2CCN(C(=O)OCc3ccccc3)C2)C[C@@H](C)O1	770110956	QEMVSLUCUUHZAO-ZHALLVOQSA-N	432.521	1.292	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)NCC[S@@](=O)Cc3ccccc3)nc21	770402549	YOGRKLJMJLIQLD-SSEXGKCCSA-N	431.522	1.862	50	20	IDGD	
Cn1c(O)nc2ncc(-c3cccc(C(=O)NNC(=O)[C@H]4COc5ccccc5O4)c3)cc21	771823007	YHCGNIMGZSHNFK-LJQANCHMSA-N	445.435	1.942	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)NCCNS(=O)(=O)c2ccc(C)s2)cc1	772630324	JFRXBKGEAWBRAX-UHFFFAOYSA-N	440.547	1.307	50	20	IDGD	
C=CCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)cc1	774007545	BOFISZODKDQGIS-CYBMUJFWSA-N	444.875	1.809	50	20	IDGD	
CCOC1CC(CNC(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)(N2CCOCC2)C1	775160167	WNFUVLQPCKJPNM-SBGRQLAYSA-N	438.500	1.193	50	20	IDGD	
CCOC(=O)c1cnn(-c2cccc(NC(=O)NNC(=O)CN(C)C)c2)c1C(F)(F)F	775510237	XTWLNPHSMLWSLZ-UHFFFAOYSA-N	442.398	1.782	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)[C@](N)(c1ccccc1OC)C(F)(F)F	776107680	PSBNCFRTKWZEKD-GOSISDBHSA-N	426.395	1.680	50	20	IDGD	
C[C@H](c1cccc(N2CCCS2(=O)=O)c1)N(C)CC(=O)NNC(=O)c1cccs1	778228236	YHGIANYASNMTMY-CQSZACIVSA-N	436.559	1.742	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2ccc(C(F)(F)F)cc2F)c1	780376406	IMTIVFBIDFKVHI-UHFFFAOYSA-N	440.396	1.871	50	20	IDGD	
Cc1cc(N2C[C@@H](C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)CC2=O)ccc1F	780683415	IFKKHVJTHPQHGI-AWEZNQCLSA-N	436.484	1.939	50	20	IDGD	
CC(=O)N1CCN(c2cccc(NC(=O)NNC(=O)CCc3ccccc3O)c2)CC1	782082774	QRNILRARWCZAJH-UHFFFAOYSA-N	425.489	1.846	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2cccc(N(C)C(C)C)c2)nc1	783263228	IOFZEBYGGPWENE-UHFFFAOYSA-N	448.549	1.695	50	20	IDGD	
CC[C@@H](C)NS(=O)(=O)Cc1cccc(NC(=O)C(=O)NNc2cc(C)nc(C)n2)c1	783324819	OQWKKHPZCQZJAI-GFCCVEGCSA-N	434.522	1.393	50	20	IDGD	
COc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)C(=O)NNC(=O)Nc1ccccc1C	783415841	LKFPSNAHSOMVPW-UHFFFAOYSA-N	449.489	1.045	50	20	IDGD	
COc1ccc(-c2nn(CCC#N)cc2/C=C(\C#N)C(=O)NN2CCCNC2=O)cc1OC	783602810	JGZPLYLWQHBABZ-LFIBNONCSA-N	449.471	1.834	50	20	IDGD	
CCc1cc(NNC(=O)[C@@H]2CC=CC[C@H]2C(=O)N2CCOCC2)nc(-c2ccccn2)n1	784782621	ZLUHIXDSQUEINF-QZTJIDSGSA-N	436.516	1.985	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2cccc([N+](=O)[O-])c2)c(C)c1S(=O)(=O)NC1CC1	784828860	VLOGDDGGKBVMNM-UHFFFAOYSA-N	447.473	1.734	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)[C@@H](O)Cc2cccc(C(F)(F)F)c2)c1	785744904	LRMZKAJDGJRDHF-INIZCTEOSA-N	435.358	1.485	50	20	IDGD	
NC(=O)C[C@@H](NC(=O)c1ccccc1Cl)C(=O)NNC(=O)C12CC3CC(CC(C3)C1)C2	786143533	JXHKLMCFBRMGJK-DNTLAJCMSA-N	446.935	1.678	50	20	IDGD	
C[C@H](OC(=O)/C(C#N)=C/C1CC1)C(=O)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1	786680072	GNBPOICCTDHYCH-AOHITCTBSA-N	433.486	1.438	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)Cc2ccc(C(=O)NNC(=O)NCCC#N)cc2)cc1	787360246	VNHXOLRHEKZTBE-UHFFFAOYSA-N	429.502	1.673	50	20	IDGD	
CCNC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)c1C	789731936	LAFHVLVBOZCYGM-UHFFFAOYSA-N	438.444	1.173	50	20	IDGD	
CCNC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)Cc2ccccc2OC)c1C	789732692	DLTOKBPJEJYWOU-UHFFFAOYSA-N	427.461	1.474	50	20	IDGD	
Cn1nc(-c2ccc(F)cc2F)cc1NC(=O)C(=O)NNC(=O)[C@@H]1Cc2ccccc2O1	789733400	LLEAKJMEJSOOOJ-KRWDZBQOSA-N	441.394	1.455	50	20	IDGD	
COc1ccc(OC)c(C2=NO[C@@H](C(=O)NNC(=O)[C@H]3COc4ccccc4O3)C2)c1	791450969	ZOJWGNLJLSJYGB-RTBURBONSA-N	427.413	1.184	50	20	IDGD	
Cc1cccnc1NNC(=O)C(=O)Nc1ccc(S(=O)(=O)N2CCC[C@H](C)C2)cc1	792378960	ZRCPUTHFEUDYRT-AWEZNQCLSA-N	431.518	1.892	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cc(=O)c3ccccc3o2)cc1OC	792547888	CIJNCFIWVSHKLI-UHFFFAOYSA-N	426.381	1.428	50	20	IDGD	
CN(C)N(C(=O)CCC(=O)Nc1nnc(C2CCCCC2)s1)[C@H]1CCS(=O)(=O)C1	792851512	XPQZOXRULLGTRU-AWEZNQCLSA-N	443.595	1.797	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)c2sccc2S(=O)(=O)N(C)C)cc1	794711694	OYPXYOCTNXEGMQ-UHFFFAOYSA-N	432.549	1.006	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CN[C@H](CO)c2ccc(Br)c(F)c2)c1	795333199	ICCYQFRFRNFSKC-MRXNPFEDSA-N	435.253	1.544	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccccc2CN2C[C@H](C)O[C@@H](C)C2)n1	797369720	GFCMOTMBCBTNTJ-HOTGVXAUSA-N	425.489	1.399	50	20	IDGD	
CC(=O)N[C@](C)(C(=O)NNC(=O)c1cccc(Cl)c1)c1ccc(S(C)(=O)=O)cc1	797409755	MGRZJPXXRUPKQT-IBGZPJMESA-N	437.905	1.556	50	20	IDGD	
CS(=O)(=O)c1cc(Br)cc(C(=O)NNC(=O)NCC(F)(F)F)c1F	798313343	DUSHEIXJSZFUKV-UHFFFAOYSA-N	436.181	1.498	50	20	IDGD	
COC(=O)c1ccc(S(=O)(=O)NNC(=O)c2nnc(-c3ccccc3)o2)cc1OC	799122777	VGSAFFXMNNMRTI-UHFFFAOYSA-N	432.414	1.155	50	20	IDGD	
Cc1c([N+](=O)[O-])ccc(F)c1NC(=O)C(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	800623816	XIWXWVFMDYDXFI-UHFFFAOYSA-N	442.363	1.333	50	20	IDGD	
CS(=O)(=O)NCc1ccc(C(=O)NNC(=O)Nc2ccc(Br)cc2)o1	801999212	XQGJBTAIEFKXDO-UHFFFAOYSA-N	431.268	1.558	50	20	IDGD	
O=C(CN1C(=O)N[C@]2(CCc3ccccc32)C1=O)NNC(=O)Nc1cc(F)cc(F)c1	801999546	DRESRSHCKATOOD-FQEVSTJZSA-N	429.383	1.511	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)NCC2CC2)c1)Nc1ccc2c(c1)OCO2	802097712	QPKHTUJPOLCJAS-UHFFFAOYSA-N	432.458	1.570	50	20	IDGD	
O=C(COC(=O)[C@H](O)c1cccc(C(F)(F)F)c1)NNC(=O)c1cccc([N+](=O)[O-])c1	803808927	GPWZMMQNDSVHBB-OAHLLOKOSA-N	441.318	1.651	50	20	IDGD	
Cc1c(Br)ccc(NC(=O)C(=O)NNc2ccc(-n3ccnc3)nn2)c1F	807429202	OZMIOZAAJUDNNN-UHFFFAOYSA-N	434.229	1.954	50	20	IDGD	
Cc1cc([N+](=O)[O-])ccc1NNC(=O)C(=O)Nc1ccc(C)c(C(=O)N2CCOCC2)c1	807455428	MRVSNCODTUENJD-UHFFFAOYSA-N	441.444	1.766	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)N[C@H]2CCCN(C(=O)N3CCCC3)C2)cc1	807461236	UTWRAXJTZJBUJT-SJORKVTESA-N	447.536	1.863	50	20	IDGD	
O=C(NNS(=O)(=O)c1c(F)cccc1OC(F)(F)F)[C@@H]1COc2ccccc2O1	808068661	FORINGMOPOIXRJ-ZDUSSCGKSA-N	436.339	1.874	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)Nc1ccc2c(c1)C(=O)N(CC1CC1)C2=O	808831488	DAIYZTUZFOJQSP-SFHVURJKSA-N	436.424	1.685	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCCC[C@@H]1COC(=O)NC1CC1	810039118	QQDCVYWETAMEDW-OAHLLOKOSA-N	438.912	1.853	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)NCC(=O)NNc2ccc(-c3ccccc3)nn2)cc1	810493783	HRQDFCINPKRLDM-UHFFFAOYSA-N	440.485	1.524	50	20	IDGD	
COCc1nnc(-c2cccc(C(=O)NNc3ccc(S(=O)(=O)N(C)C)cc3)c2)o1	812730416	IGHMIMAPOFDYNF-UHFFFAOYSA-N	431.474	1.890	50	20	IDGD	
O=C(NNC(=O)c1c[nH]c(C(F)(F)F)c1)c1cccc(S(=O)(=O)N2CCOCC2)c1	814195069	UBKGJMCYNIMMMB-UHFFFAOYSA-N	446.407	1.129	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2ccccc2)nnn1CCOc1ccc(F)cc1	815557792	FJCCAGZBRUZOSQ-UHFFFAOYSA-N	426.408	1.204	50	20	IDGD	
COC(=O)C(C)(C)c1csc(NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)n1	815567121	PKOLBQCYMQMZOS-UHFFFAOYSA-N	440.865	1.352	50	20	IDGD	
CCOC(=O)c1cc(COC)cc(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)c1	815568667	PQGVQZXGXHWTLU-SFHVURJKSA-N	441.440	1.099	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C(=O)Nc1nc(C(C)(C)C(=O)OC)cs1)c1ccccc1	815570141	SOFUZEDJOLPEHV-ZDUSSCGKSA-N	432.502	1.873	50	20	IDGD	
Cc1ccc(Oc2ccccc2)c(NC(=O)C(=O)NNC(=O)[C@@H]2CCc3nncn3C2)c1	815691292	LJIPRVXTOVCQEC-OAHLLOKOSA-N	434.456	1.727	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)[C@H](NS(=O)(=O)C2CC2)C(C)C)cc1	816818244	VKDHQHAUNALOTJ-SUMWQHHRSA-N	427.523	1.106	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C[C@@H]1CN(Cc2ccccc2)CCO1	817053950	NDPMFNDCAQNQSL-GOSISDBHSA-N	432.546	1.671	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)c2cc(C)ccc2S(N)(=O)=O)c1	818767551	NLSCFNBWSNZKFU-UHFFFAOYSA-N	442.291	1.948	50	20	IDGD	
O=C(CNc1ccccc1)NNC(=O)c1ccc2c(=O)n(-c3ccccc3)c(O)nc2c1	823328421	QUZBLIBFQDLKNE-UHFFFAOYSA-N	429.436	1.964	50	20	IDGD	
CC[C@H](C)[C@H](C(=O)OCC(=O)NNC(=O)c1cccs1)N1C(=O)c2ccccc2C1=O	844205820	ZJXHTOQPTPRJEH-YVEFUNNKSA-N	443.481	1.763	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)c2ccccc2-n2cnnn2)cc(OCC)c1OCC	859279243	MYZHENYISBBNOE-UHFFFAOYSA-N	440.460	1.933	50	20	IDGD	
CC(C)(C)c1ccc(C(=O)N[C@@H](CCS(C)(=O)=O)C(=O)NNc2ncccn2)cc1	913043849	ACVJWVUYBQTESS-INIZCTEOSA-N	433.534	1.451	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)CNS(=O)(=O)c1c(F)cccc1F	913459247	AUFWZAISMJBGFR-UHFFFAOYSA-N	427.429	1.032	50	20	IDGD	
CC(=O)c1cccc(S(=O)(=O)NCC(=O)NNC(=S)Nc2cccc(Cl)c2)c1	913522107	BTXZKCOUHWZGFA-UHFFFAOYSA-N	440.934	1.839	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)Cc2cnn(-c3ccccc3)n2)c2ccccc2c1=O	916091927	MENSZIZCBIWYDF-UHFFFAOYSA-N	431.456	1.562	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)NC[C@H](c2ccc(C)o2)N2CCOCC2)c1	916229682	UVZPREMXQASILL-GOSISDBHSA-N	430.505	1.988	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NN=Cc1cccn1C)N(S(C)(=O)=O)CC2	916356615	YBCQUCICHLEMSY-QGZVFWFLSA-N	434.518	1.442	50	20	IDGD	
CCNC(=O)COc1ccc(CNC(=O)NNC(=O)Cc2ccc(F)cc2)cc1OC	916388812	JJAPLXWWHVOIJQ-UHFFFAOYSA-N	432.452	1.422	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2c[nH]c(C(=O)N3CCCC3)c2)c2ccccc2c1=O	916728255	MVVDHZOJYFUIAK-UHFFFAOYSA-N	436.472	1.445	50	20	IDGD	
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1ccco1)NNC(=O)c1ccc([N+](=O)[O-])cc1	919639958	UZSFXHXESGVKAI-HNNXBMFYSA-N	444.400	1.187	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@H]2CCc3cc(F)ccc32)cc1	919919491	FMSGTAYTZJKKQZ-SFHVURJKSA-N	434.493	1.773	50	20	IDGD	
CN(C)C(=O)COc1ccccc1/C=C(\C#N)C(=O)Nc1ccc(S(N)(=O)=O)cc1	920397781	PUAZWSALKGWTFH-RVDMUPIBSA-N	428.470	1.347	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CSCN1C(=O)c1ccc(Cl)cc1)c1n[nH]c2c1CCCC2	1318302421	OHHYXBNUCOOKHN-HNNXBMFYSA-N	433.921	1.918	50	20	IDGD	
CC(C)(C)c1cnc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](O)CCl)C3)cn1	1778414788	ZHGLBDKKVJMASS-QLVMHMETSA-N	438.956	1.501	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C/N=C/c2ccco2)C1	1779446320	CRLHFYBDZMAXGF-XDGMJCQUSA-N	425.913	1.466	50	20	IDGD	
CCC(=O)N[C@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CO[Si](C)(C)C)C1	1779539898	PZJPCZZXXAJCRB-JXXFODFXSA-N	427.618	1.267	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cncc4cnccc34)C2)C1	1780014865	UHKVOZGYASZAPC-DJJJIMSYSA-N	433.306	1.857	50	20	IDGD	
COc1cc(OC)cc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)c1	1780663034	SHVNWSKUIBPCHH-CRAIPNDOSA-N	445.285	1.838	50	20	IDGD	
Cc1ccn(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](F)Br)C2)n1	1780770881	HYCYRVSGZRGOCP-FRFSOERESA-N	431.306	1.396	50	20	IDGD	
CC(=O)N[C@H](C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Cl)CCO2)c1ccc(F)cc1	1780908942	POZZXJHNLGDKHR-BXWFABGCSA-N	429.851	1.367	50	20	IDGD	
COc1cncc(CCC(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](F)Br)C3)C2)c1	1781327029	WGTTZBHWYPBRBI-WMZOPIPTSA-N	444.301	1.543	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)NC(C)=O)C2	1781904750	BFNSQSJDXALQTP-CTNYNGJSSA-N	432.359	1.198	50	20	IDGD	
Cc1c(F)cccc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCC(=O)NN(C)C)C1	1782210297	NSZIYTCUVCRKAI-AUSIDOKSSA-N	448.539	1.635	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1cccs1)C2	1782211853	BKOOCIQMVOBZOV-DYESRHJHSA-N	436.578	1.178	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCc2ncc[nH]2)C1	1782398353	QRWKUAZOWODJEZ-SPYBWZPUSA-N	441.370	1.887	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@@]2(C1)CN(C(=O)c1cnc(O)[nH]1)CCO2	1782868079	YCWWNXCCAYMXPO-NPZXAABXSA-N	443.410	1.444	50	20	IDGD	
Cc1ccc(/C=C/C(=O)N2CCO[C@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)s1	1783938077	RROZIWPTNMZHMW-PVHVJQTOSA-N	434.562	1.273	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)c3ccccc3)C[C@@H]21	1783968127	QSYGRFVQEDKZGB-PEJOBZMASA-N	439.350	1.731	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)CCc3ccoc3)C2)C1	1784677637	GITGTJJBNYTRTD-ZHNJOBQTSA-N	441.488	1.176	50	20	IDGD	
COc1ccc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](O)CCl)C[C@@H]32)c(Cl)c1	1785065046	AWOIBCUSOICGPT-IKICRFKJSA-N	445.343	1.471	50	20	IDGD	
C=C[C@@H]1C[C@]1(NC(=O)OC(C)(C)C)C(=O)N1CC[C@]2(CN(C(=O)[C@@H](F)Cl)CCO2)C1	1785596493	XCKUTXPSBQCVEB-VPCNSNALSA-N	445.919	1.820	50	20	IDGD	
NC[C@H](N)C(=O)N1CCO[C@@]2(CCN(C(=O)CCCCCCCCBr)C2)C1	1785669098	XZNVZLBPUOHCFT-QFBILLFUSA-N	447.418	1.228	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc[nH]3)[C@H]2C1	1786001647	YIVOQMOWRNSWJE-XSNPIBBVSA-N	441.438	1.888	50	20	IDGD	
O=C(NC1(c2ccc(NC(=O)c3ccc(F)cn3)cc2)CCC1)c1ccc(B(O)O)cc1	1787534050	IWPXSOAZPFZWQC-UHFFFAOYSA-N	433.248	1.962	50	20	IDGD	
CC1CCN(CC(=O)NC2(c3ccc(NC(=O)c4ccc(B(O)O)cc4)cc3)CCC2)CC1	1788140474	SLAREWAQUOPCSM-UHFFFAOYSA-N	449.360	1.846	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3Cc4ccccc4O3)[C@H]2C1	1788185349	BIWYKDPOQLERCA-XEYPJELSSA-N	432.593	1.821	50	20	IDGD	
C[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]21)n1ccccc1=O	1788750081	XODGIYHSJZLRAJ-YPTDYUDTSA-N	444.359	1.625	50	20	IDGD	
COc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)CBr)C[C@@H]32)ccn1	1788904164	RCZMXCFATUNJNF-OEAJRASXSA-N	440.338	1.715	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(C)n(CC)n3)[C@H]2C1	1789003527	QSHMNQVHPSXMJZ-MPTYRVRUSA-N	441.370	1.978	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nnsc3C3CC3)C[C@@H]21)[C@@H](F)Br	1789922605	JDWWXWITTROQIC-AYGWYOGXSA-N	447.330	1.699	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4c(c3)OCO4)C[C@@H]21)[C@@H](F)Br	1789922715	LQZGBAVOZZNYSK-GVAFMPQTSA-N	443.269	1.699	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc4c(c3)CCNCC4)[C@H]2C1	1790619457	ZHILPDMJOOKKSF-CAIZAGQASA-N	434.968	1.381	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3F)C[C@@H]21	1790961354	IXKFKXQEKDICKO-PCBIJLKTSA-N	428.302	1.988	50	20	IDGD	
Cc1ncc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CO[Si](C)(C)C)C[C@@H]32)s1	1791589893	WODIWWVFCRZPST-XIRDDKMYSA-N	425.627	1.825	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1ccc(C2(NC(=O)c3ccc4ncnn4c3)CCC2)cc1	1791601482	CGNOZBLGDJOCHE-UHFFFAOYSA-N	449.515	1.850	50	20	IDGD	
N#CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C#N)=C/c1ccc(Br)cc1)C2	1795084019	WAQKEAYNIQFCHS-MAZHBOQJSA-N	443.301	1.859	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2c(n1)OCCO2	1796284883	XMNBXHYPIRFMQD-RHQBZFHZSA-N	444.315	1.292	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](F)Cl)[C@@H](O)C1	1796803668	AEAAHCBGHHOQKG-KARBZBNUSA-N	447.935	1.777	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cc([N+](=O)[O-])ccc1F)C2	1799263131	GNTVBHVIYVKZNP-HRJSJKBJSA-N	427.860	1.883	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](C)NC(=O)c1ccc(F)cc1	1799815095	AGGJUMPXODWBPX-RPCVNMKUSA-N	439.915	1.836	50	20	IDGD	
Cc1cccn2ncc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@@H](C)Br)C4)c12	1800107817	DFHGALFQNQGQGF-HGTKMLMNSA-N	435.322	1.629	50	20	IDGD	
Cc1nc[nH]c1CSCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)Br	1800759157	IZCSRMGYWVKFGC-YGSHXTJESA-N	445.383	1.324	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cc3ccccc3n1C)C2	1800971294	UUBOWYOLUKIFNX-VWFIUDSGSA-N	433.936	1.564	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(C)nc3ccc(O)cc13)C2	1800976649	AKUJWNQUYCAXAZ-VLBMKZOESA-N	447.919	1.706	50	20	IDGD	
CC[C@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CNC(=O)C(F)(F)F)C2	1801805345	ZFRFSFUFPJGFJB-VLEAKVRGSA-N	428.249	1.477	50	20	IDGD	
O=C1CC(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](Br)Cc2ccccc2)C3)C1	1802009089	IEXFDHAXTYCUMS-NBMJBFSESA-N	449.345	1.561	50	20	IDGD	
CN1CCN(CC(=O)N2CC[C@H](CNC(=O)C(C)(C)CCl)[C@@H]2c2cccnc2)CC1	1802900574	BIVBGCIYXQYATR-QUCCMNQESA-N	436.000	1.600	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cc[nH]c3nccc2-3)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803138514	BOPMQKCQRGNFKF-JCGIZDLHSA-N	427.892	1.829	50	20	IDGD	
C=CCSCC(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1804172647	DVEHDLJWRSCTHD-GHTZIAJQSA-N	439.346	1.000	50	20	IDGD	
COc1nccnc1C(=O)NC[C@@H]1CCN(C(=O)[C@H](C)Br)[C@@H]1c1cccnc1	1804983278	YWNYSAVXZKCSKR-DUVNUKRYSA-N	448.321	1.983	50	20	IDGD	
CN(C)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1	1805104797	XZFXYWUDMKKNNN-IPELMVKDSA-N	431.924	1.462	50	20	IDGD	
CS(=O)(=O)CCC(=O)N1CC[C@H](CNC(=O)CCBr)[C@H]1c1cccnc1	1806345950	KSHDHVFAAAPUNU-RHSMWYFYSA-N	446.367	1.307	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)[C@H](C)NS(=O)(=O)CC)[C@@H]1c1cccnc1	1808244773	OJFITGRTCVSLST-QSPRXWTASA-N	444.985	1.433	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1	1808263939	RHHGJSFMGNGJOD-WBAXXEDZSA-N	444.923	1.417	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@H]1CCN(C(=O)CS(C)(=O)=O)[C@@H]1c1cccnc1	1808297322	YTQUDZYDDBOAQB-UNEWFSDZSA-N	436.361	1.368	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)c2ncc[nH]2)[C@H]1c1cccnc1	1808414447	IEJOZJCZEVLIOV-PVCWEEQBSA-N	448.487	1.258	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)[C@@H]3[C@H]4C=CS[C@@H]43)CC2)C1	1809973369	IZKIUMIFIBIBPU-QRVBRYPASA-N	426.347	1.086	50	20	IDGD	
Cc1cccc(F)c1C(=O)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1	1809978277	OSVRIDYXXZIWCT-UHFFFAOYSA-N	438.308	1.973	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)o1	1810295707	VTMYUCLZYXVFLQ-OXJNMPFZSA-N	448.483	1.615	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)CCNC(C)=O)[C@H]1c1cccnc1	1812779249	QMDNQKKCQFQHOI-RYRKJORJSA-N	439.354	1.787	50	20	IDGD	
CC(=O)N(C)CCC(=O)N1CC[C@H](CNC(=O)[C@H](C)Br)[C@H]1c1cccnc1	1812864166	GBSNJCYCWYORMS-FDQGKXFDSA-N	439.354	1.739	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2nccs2)[C@@H]1c1cccnc1	1813070352	IAZJNDNJJQWOAN-CRAIPNDOSA-N	430.534	1.231	50	20	IDGD	
Cc1oncc1C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1813071546	UOJHLRLHJPSJRW-UZLBHIALSA-N	428.493	1.071	50	20	IDGD	
CCC[C@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1815317718	HATYFQUWJIJTQX-DOTOQJQBSA-N	432.717	1.803	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@](C)(O)C(F)(F)F)n[nH]1	1815533538	NKCRBVHCUYGZDM-ISOBSLSZSA-N	426.823	1.969	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)C[C@@H]2NC(=O)NC2=O)n[nH]1	1815771489	SIKFIVZXTPRNPN-DINDLPBHSA-N	445.307	1.236	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)C(=O)c1ccccc1	1816716268	USVFOURPLSXPMB-LJQANCHMSA-N	446.272	1.278	50	20	IDGD	
Cc1ncsc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1	1817470437	BHNRWKBGJPPBAM-INIZCTEOSA-N	439.306	1.474	50	20	IDGD	
Cc1ccc(CC(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)cc1	1817473388	QUPKVDOWOWPWSD-NRFANRHFSA-N	446.316	1.947	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)CS(=O)(=O)N2CCCC2)[nH]n1)[C@@H](F)Cl	1818037155	GDSVIKHLMDFUDO-SWLSCSKDSA-N	435.909	1.362	50	20	IDGD	
C[C@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1)N1C[C@H]2C[C@H]2C1	1819294814	ATQZLTZFXGGNLT-CBZIJGRNSA-N	445.568	1.115	50	20	IDGD	
Cc1[nH]ccc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819402710	IDBXFSJSIVANCL-QGZVFWFLSA-N	436.476	1.664	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1c[nH]c(=O)cn1)CC2	1822867982	PXAFCOPQUOBNOB-ZKANADHPSA-N	430.317	1.689	50	20	IDGD	
O=C1Cc2cccc(C(=O)Nc3nc4c(s3)C[C@H](NC(=O)[C@@H](O)CCl)CC4)c2N1	1824198854	NJJXDAHWCFFIHP-MFKMUULPSA-N	434.905	1.463	50	20	IDGD	
CCc1oncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1	1826171248	PNIGCNZGLNJTCT-FQEVSTJZSA-N	439.321	1.464	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccnn2)CC1	1828924264	NFGWTWWHKDFKRS-IBGZPJMESA-N	437.504	1.022	50	20	IDGD	
Cc1ccc(F)cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1830077684	CGUBDFVPOGXZNL-QAPCUYQASA-N	447.276	1.895	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H](N)CCC(N)=O)CC1	1830316266	HLNXQIHNZDVZOW-DOXZYTNZSA-N	435.396	1.435	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3CC=CCC3)C2)C1	1830533534	PYLONSZEOWEGFX-FCEWJHQRSA-N	429.355	1.830	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CNC(=O)N(C)C)CC1	1831651100	WVDLLTXJMYLLCY-HIFRSBDPSA-N	431.375	1.661	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3c4c(nn3C)CCC4)C2)C1	1831653136	BAJXNHGKFNSQKG-KKSFZXQISA-N	438.956	1.386	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)CBr)C3)C2)o1	1831785961	PHQXVILYDLUWRQ-FZKQIMNGSA-N	429.311	1.689	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3ccc(F)nc3F)CC2)CC1	1833017319	LTEWPYDMMTWTOT-INIZCTEOSA-N	444.910	1.799	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3cccc(Cl)n3)CCO2)C1	1833176628	OQPNEZVSDKFOQE-DNVCBOLYSA-N	430.332	1.751	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3cnsn3)CC2)CC1	1833980428	NFFIPYLWJYFGOB-LLVKDONJSA-N	430.372	1.507	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccnc3)CCO2)C1	1834009901	NQQLDSARTJRDMJ-YJBOKZPZSA-N	426.311	1.325	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cncc(C)c3)CCO2)C1	1834288115	LDYFQUVQZRLGTE-VQIMIIECSA-N	440.338	1.634	50	20	IDGD	
O=C(CCBr)NC1CCN(C2CCN(C(=O)Cc3cnccn3)CC2)CC1	1834422351	KZVBEZBACJOVMP-UHFFFAOYSA-N	438.370	1.376	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CN(C)C(=O)OC(C)(C)C)CCO2)C1	1835210485	QGHHENMTAPCPJH-YWZLYKJASA-N	447.960	1.327	50	20	IDGD	
C[C@@H](Nc1cccnc1)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1835685647	RCOFVACSHOHOEG-IERDGZPVSA-N	438.956	1.603	50	20	IDGD	
CC(C)n1ccc(C(=O)NC2CCN(C3CCN(C(=O)[C@H](O)CCl)CC3)CC2)n1	1836182827	WWDHKZWWHNKGMR-GOSISDBHSA-N	425.961	1.249	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)C3=C(C)OCC3)CCO2)C1	1836274501	FRNJALHEBWXEOR-CRAIPNDOSA-N	431.327	1.311	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CC[C@@H](C)O1)CCO2	1836601898	UBLBISDUZKYHKG-ATNYBXOESA-N	433.343	1.041	50	20	IDGD	
CC(C)N1CCC(C(=O)N2CCC(OC3CCN(C(=O)[C@H](O)CCl)CC3)CC2)CC1	1836714394	TYHGSPXVQHAIIQ-HXUWFJFHSA-N	444.016	1.705	50	20	IDGD	
O=C(Cn1cc(Cl)cn1)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836716668	IBHYNQZTIKTHAO-INIZCTEOSA-N	433.336	1.135	50	20	IDGD	
CCN(CC)C[C@@H](C)C(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836718722	ATTREBXMPHTOCX-VQIMIIECSA-N	432.005	1.563	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)CN3CCNC3=N)CC2)CC1	1836919082	PXYVXEYQVXHJOM-QGZVFWFLSA-N	427.977	1.232	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)c3cnccn3)CC2)CC1	1837412816	QWSZNEKDQGTGGQ-ZDUSSCGKSA-N	425.327	1.872	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1837714834	PRVGPLHZKLPKGF-DLBZAZTESA-N	441.428	1.531	50	20	IDGD	
CCc1cc(C(=O)N2CCOC[C@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)no1	1837715397	NZPGTYUDUNEEDL-IBGZPJMESA-N	425.558	1.159	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc4ncsc4[nH]3)CCO2)C1	1837752760	FEKHROILYQBXLM-XIKOKIGWSA-N	426.926	1.712	50	20	IDGD	
CCn1nc(C(C)C)cc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1838812673	PORQEKXUQHLJEQ-QFBILLFUSA-N	430.908	1.631	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4cnccc4n3)C2)C1	1839144548	DUESOHCXALVQLM-HRAATJIYSA-N	432.908	1.717	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnn4cc(C)cnc34)C2)C1	1839146350	XKMRGADFUSHRHZ-OXJNMPFZSA-N	435.912	1.125	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cc(F)ccc3F)C2)C1	1839149673	ODYISOBKWSNTNF-JXFKEZNVSA-N	430.879	1.981	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)c(C)n1C	1839153435	HXXVGEVEWPZFNT-WOJBJXKFSA-N	446.375	1.948	50	20	IDGD	
C=CCSCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839199023	QIDDWOJQOBEJHE-ZFWWWQNUSA-N	425.320	1.053	50	20	IDGD	
O=C(c1ccc(OC(F)F)cc1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1839331092	RZNXSGXQGJNZGY-RDTXWAMCSA-N	436.814	1.892	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ncccc3C)C2)C1	1839962317	AMYCOAWMDDZSGI-BEFAXECRSA-N	440.338	1.634	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccnc(F)c3)C2)C1	1839962920	VHYQNMWHJJGBBX-RDTXWAMCSA-N	444.301	1.464	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)C(F)(F)C(F)F)C2)C1	1840030395	KMQMKTOXVVOOHO-TVQRCGJNSA-N	435.212	1.127	50	20	IDGD	
Cc1ncc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)s1	1840032587	CPCUNAQLIUORMC-BDJLRTHQSA-N	432.340	1.305	50	20	IDGD	
O=C(c1ccn(C(F)F)n1)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840188863	HQHKTLYBATVHKL-HNNXBMFYSA-N	427.235	1.152	50	20	IDGD	
Cc1ccc(/C=C/C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)s1	1840394584	UEPOBAAQYJAYEP-CHYGHELMSA-N	428.938	1.126	50	20	IDGD	
O=C(CCCn1cccc1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1840461637	NJZABUPZPSCFEE-SJLPKXTDSA-N	446.317	1.415	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccc(O)cn3)CCO2)C1	1840498007	JMAVBAUPOZYZPQ-RTBURBONSA-N	446.331	1.022	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)c(Cl)c1	1840733625	LDZZKIRDGBTJJS-QFBILLFUSA-N	447.315	1.018	50	20	IDGD	
O=C([C@@H](O)CCl)N1CC2(CCCN2C(=O)Cc2cc(F)ccc2Br)C1	1841838352	DAHVXWGDMCPUNP-AWEZNQCLSA-N	433.705	1.934	50	20	IDGD	
Cc1ncc(C(=O)N2CC3(CCCN3C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)[nH]1	1841924100	VJBGPVICBPXARL-ZDUSSCGKSA-N	425.917	1.667	50	20	IDGD	
COc1cc(F)cc(/C=C/C(=O)N2CC3(CCCN3C(=O)c3cccc(B(O)O)c3)C2)c1	1843015152	NXBWYHBNSJZHGA-VOTSOKGWSA-N	438.264	1.045	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)CCn1ccnn1)C2	1844693330	SDNYZTDZQUWHNN-UHFFFAOYSA-N	442.432	1.019	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)C[C@H]1OCCc3ccccc31)C2	1846383947	LPEPYTGVQNWBDU-LJQANCHMSA-N	428.533	1.267	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)Cc1c(F)cccc1Cl	1847417535	MOUQABICRRYVMK-ROUUACIJSA-N	445.882	1.536	50	20	IDGD	
CC(C)c1ccc(-n2cnnc2SCC(=O)NNC(=O)CNC(=O)c2ccco2)cc1	725741268	NCDUSXZHTCWLCY-UHFFFAOYSA-N	442.501	1.653	50	20	IDGD	
Cc1nccn1-c1ccc(CNC(=O)NNC(=O)CNC(=O)c2cccs2)cc1F	726242570	SIQCXMRXEUDKOL-UHFFFAOYSA-N	430.465	1.642	50	20	IDGD	
COc1ccc(-c2nn(CCC#N)cc2/C=C(/C#N)C(=O)N2CCCNC(=O)C2)cc1OC	726779965	JUWHHLMPBJMDHF-BOPFTXTBSA-N	448.483	1.736	50	20	IDGD	
O=C(NNC(=O)N1CCC[C@@H]1c1cccc2c1OCCO2)c1ccc(-n2cnnn2)cc1	727473661	OIFKVKCUXCPAKD-QGZVFWFLSA-N	435.444	1.625	50	20	IDGD	
CCCCC(=O)N1CSC[C@@H]1C(=O)NNC(=O)c1cc(OC)c(OC)c(OC)c1	727983177	PCTWZKYSDSAIOQ-CYBMUJFWSA-N	425.507	1.565	50	20	IDGD	
CC(=O)c1cccc(O[C@H](C)C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1	728338164	GOCPRWURVWHAII-AUUYWEPGSA-N	442.424	1.187	50	20	IDGD	
CCN(Cc1ccc2c(c1)OCO2)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	728959447	LYAHMGLOSCDKIC-UHFFFAOYSA-N	426.477	1.685	50	20	IDGD	
CCOc1cc2c(cc1[C@@H]1C[C@@H]1C(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1)O[C@@H](C)C2	730535487	PSNRMEOCLZVWLJ-PCBIJLKTSA-N	437.518	1.030	50	20	IDGD	
Cc1cccc([C@H](CNC(=O)NNC(=O)COc2ccccc2O)N2CCOCC2)c1	730819515	FMCYECIVMYYWKH-SFHVURJKSA-N	428.489	1.483	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)NNC(=O)c1ccc(COc2ccccc2)o1	730820846	JGPPEFIQBOJFEY-UHFFFAOYSA-N	440.412	1.618	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)N[C@@H](Cc1ccccc1)CN1CCOCC1	732476312	DFTOSNFHQHAHSP-XLIONFOSSA-N	444.507	1.867	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)NCCCC(=O)N1CCc2ccccc21	732476634	QZRRZKFQAQCCRP-UHFFFAOYSA-N	441.444	1.674	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COCCNC(=O)OC(C)(C)C)cc1Br	732555796	AQUPHIDAYNURCJ-UHFFFAOYSA-N	446.298	1.760	50	20	IDGD	
Cc1cc(NNC(=O)C2CCN(S(=O)(=O)c3cc([N+](=O)[O-])ccc3C)CC2)ncn1	734253966	CNUBPWIBSKMMMW-UHFFFAOYSA-N	434.478	1.546	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)[C@@H]2Cc3ccccc3C(=O)O2)CC1	734825003	PXVNSNXHRZMJAU-INIZCTEOSA-N	432.477	1.498	50	20	IDGD	
CCN(c1ccccc1)S(=O)(=O)c1ccc(C(=O)NNC(=O)c2cnn(C)c2)cc1	735446130	XRHHUOHJJHIYAY-UHFFFAOYSA-N	427.486	1.710	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)[C@@H]1CCC[C@H]1NC(=O)OC(C)(C)C	739734852	YNGQUSFMTKXVTR-CHWSQXEVSA-N	429.518	1.535	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2cc(F)ccc2O1)c1cccc(S(=O)(=O)N2CCCCC2)c1	740812413	HVXRSXIYQKJAJE-IBGZPJMESA-N	447.488	1.765	50	20	IDGD	
CC(C)(C)Cc1nc(-c2ccc(C(=O)NNC(=O)N[C@@H]3CCS(=O)(=O)C3)cc2)no1	741671536	HKBSXJYXRMLDKQ-CQSZACIVSA-N	435.506	1.456	50	20	IDGD	
C[C@H](OC(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccccc1)C(=O)N1CCNC1=O	741818879	HCTWOBVDSSINRZ-ZKMNFCBKSA-N	432.440	1.854	50	20	IDGD	
COc1ccc(-c2nc(SCC(=O)NNC(=O)c3ccc(C#N)cc3)n[nH]2)c(OC)c1	742450548	DJHCGVGTWNSTMA-UHFFFAOYSA-N	438.469	1.914	50	20	IDGD	
O=C(CCN1C(=O)[C@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O)NNC(=O)c1cc2c(s1)CCCCC2	742481804	BXLVNDZWUMHISO-OSLDLMBLSA-N	431.514	1.331	50	20	IDGD	
C[C@H](C(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1)[C@@H](NC(=O)OC(C)(C)C)c1ccccc1	742489410	BKYFFNNGAJPNRT-CWRNSKLLSA-N	439.534	1.471	50	20	IDGD	
COc1ccccc1OCC(=O)NN[C@@H](C(N)=O)c1ccc(Br)cc1F	743464860	ONEDTDVRMOHTKT-MRXNPFEDSA-N	426.242	1.823	50	20	IDGD	
O=C(Cc1cc2c(cc1Br)OCCO2)NNC(=O)[C@H]1COc2ccccc2O1	743818161	QLNSTJWPUFQTQN-QGZVFWFLSA-N	449.257	1.750	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN(C[C@H]2CCCO2)[C@@H]2CCS(=O)(=O)C2)cc1C	744401272	CIPKPMJKPIOBMG-HUUCEWRRSA-N	443.591	1.048	50	20	IDGD	
O=C(NCCN1C(=O)c2ccccc2C1=O)NNC(=O)Nc1ccc(OC(F)F)cc1	745735369	AOGDLPKZXCTWSY-UHFFFAOYSA-N	433.371	1.920	50	20	IDGD	
O=C(NNC(=O)N1CCC([C@H](O)c2ccccc2)CC1)c1csc(N2CCOCC2)n1	746512068	GXEAJBNOBFBVGQ-GOSISDBHSA-N	445.545	1.780	50	20	IDGD	
COC(=O)c1ccsc1N1CC[C@H](NC(=O)NNC(=O)CCCc2ccccc2)C1=O	746781576	SDMIOCWAJYLTAY-INIZCTEOSA-N	444.513	1.993	50	20	IDGD	
CCOc1ccc(/C=C(/C#N)C(=O)N2CCN(S(=O)(=O)CCOC(C)C)CC2)cc1	746871922	NRKUWZLSAZQNQJ-CYVLTUHYSA-N	435.546	1.891	50	20	IDGD	
O=C(NCCCCN1CCN(c2ncccn2)CC1)NNC(=O)c1ccc(Cl)cc1F	747500860	NJRNQHBAZDMOMT-UHFFFAOYSA-N	449.918	1.816	50	20	IDGD	
O=C(NNC(=O)c1nc(-c2cccs2)n(-c2cccc(F)c2)n1)C(=O)N1CCCC1	748246482	ADUYQRQMMWHNHB-UHFFFAOYSA-N	428.449	1.518	50	20	IDGD	
O=C(Cn1cnc2sccc2c1=O)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1	748510207	CLGQALNJOALUFY-UHFFFAOYSA-N	432.405	1.895	50	20	IDGD	
CC[C@H](C(=O)N1CCC(NC(=O)NNC(=O)[C@H](C)OCCOC)CC1)c1ccccc1	748623549	JRPUYGCGNKFZCG-LPHOPBHVSA-N	434.537	1.553	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)NCCNC(=O)Cc2cccc(F)c2)cc1OC	749014377	KFBNWWHXFXBBRK-UHFFFAOYSA-N	432.452	1.536	50	20	IDGD	
O=C(NNC(=O)[C@@H]1OCCc2ccccc21)c1cccc(S(=O)(=O)N2CCCCC2)c1	749889588	ZHORDLSVDBQWOD-HXUWFJFHSA-N	443.525	1.936	50	20	IDGD	
CC(C)NC(=O)CSc1ccccc1C(=O)NNC(=O)CNC(=O)c1cccs1	751211884	XUZRFRMTKVCNCN-UHFFFAOYSA-N	434.543	1.556	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)c1ccc(CS(=O)(=O)C(F)F)cc1	751568188	UWCJQCRZVOZCHB-UHFFFAOYSA-N	428.413	1.673	50	20	IDGD	
COC(=O)COc1c(C)cc(C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)cc1C	752566188	BDOUUHQDXWOREF-UHFFFAOYSA-N	439.424	1.345	50	20	IDGD	
CC1CCN(C2CCC(NC(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)CC2)CC1	752710210	VAIGEWIBRNOWCK-UHFFFAOYSA-N	426.525	1.649	50	20	IDGD	
CCc1ccccc1-n1cc(O)c(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)n1	752797676	SHGBDOOAEZINQW-UHFFFAOYSA-N	435.488	1.608	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)NC[C@@H]1CCN(S(C)(=O)=O)C1	753660548	MEPFEYOIRQNGLJ-GJZGRUSLSA-N	434.518	1.219	50	20	IDGD	
CCc1noc(CC)c1CC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	755036857	JHSLOPCYWNUZSW-UHFFFAOYSA-N	448.545	1.978	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)c2ccnc(O[C@H]3CCOC3)c2)CC1	755354483	MWLGBSXHCMKGAM-INIZCTEOSA-N	449.508	1.593	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1cc(F)c(F)c(O)c1F	755518892	ZXYYYUIOZLOFAH-UHFFFAOYSA-N	436.390	1.029	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2cccc(C(=O)NC3CC3)c2)c2ccccc2c1=O	755556405	DVVWBDAYZOFQHR-UHFFFAOYSA-N	434.456	1.775	50	20	IDGD	
O=C(CN1CCOCC1)Nc1ccc(NC(=O)NNC(=O)c2c[nH]c3ccccc23)cc1	755598624	IQHHBVRIGFTWCL-UHFFFAOYSA-N	436.472	1.905	50	20	IDGD	
Cn1cc(S(=O)(=O)N2CCOCC2)cc1C(=O)NNc1cccc(C(F)(F)F)c1	755948635	FFGWOHRBNQQDOB-UHFFFAOYSA-N	432.424	1.822	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)Nc2cccc(C(=O)NCCC(N)=O)c2)cc1OC	756393677	SAZYCOBEPOWQBJ-UHFFFAOYSA-N	443.460	1.166	50	20	IDGD	
CCOC(=O)Cc1cccc(NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1	756672723	SLVIPABASGYQGT-UHFFFAOYSA-N	426.477	1.652	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])n(C2CCN(C)CC2)n1	756896271	OSONVMZAOLWLAX-UHFFFAOYSA-N	431.453	1.598	50	20	IDGD	
COCc1nc2n(n1)C[C@H](NC(=O)NNC(=O)c1sc(-c3ccccc3)nc1C)CC2	757772118	LLVBUXGSIUKDBM-CQSZACIVSA-N	441.517	1.815	50	20	IDGD	
Cc1nn([C@H]2CCS(=O)(=O)C2)c(C)c1NC(=O)NNC(=O)CCc1ccccc1O	757871892	QTECGWJSCBNBGP-HNNXBMFYSA-N	435.506	1.351	50	20	IDGD	
CCn1nc(C)c(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1C	757872159	UDDCBQSDOJBSLE-UHFFFAOYSA-N	434.522	1.771	50	20	IDGD	
CCOCC(=O)NNC(=O)Nc1sc2c(c1C(=O)OCC)CCN(C(=O)OCC)C2	757987252	WACSEPFOTRXMHT-UHFFFAOYSA-N	442.494	1.629	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2ccnc(Br)c2)ccc1Cl	758158166	NJSXZIGRTBPJAE-UHFFFAOYSA-N	433.671	1.220	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@@H](C)OC2CCCCCC2)cc1	760266178	YPYUCNDVKUHLHZ-MRXNPFEDSA-N	425.551	1.891	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)C(=O)Nc1ccnn1Cc1ccc(F)cc1	760277547	MYANGKVZSULKIZ-UHFFFAOYSA-N	434.431	1.811	50	20	IDGD	
Cc1ccnc(-n2nccc2NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)c1	760278603	ZXJGDNWHJVZLAR-ZDUSSCGKSA-N	426.408	1.268	50	20	IDGD	
CN(C)c1ccc2c(c1)N(C)C(=O)C2=NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	761767986	UDJPECGPMMVPOE-UHFFFAOYSA-N	435.893	1.164	50	20	IDGD	
CCN1CCC[C@H]1CN1C[C@@H](C(=O)NNC(=O)CSc2ccccc2OC)CC1=O	762361601	PHURTORJYDDFRF-HOTGVXAUSA-N	434.562	1.268	50	20	IDGD	
C[C@H]1CN(Cc2ccc(C(=O)NNc3nccc(N4CCOCC4)n3)cc2)C[C@H](C)O1	762848095	NMPMYJUJJSUHHQ-IRXDYDNUSA-N	426.521	1.679	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)NNC(=O)c1cccc2cccnc12	763483088	RLJFBKXOCJHETI-UHFFFAOYSA-N	430.465	1.515	50	20	IDGD	
O=C(NNC(=O)c1cccnc1)C(=O)Nc1ccnn1Cc1ccc(OC(F)(F)F)cc1	763495450	VOXIUXABCJVNSX-UHFFFAOYSA-N	448.361	1.625	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(C)nn2[C@@H]2C[C@H]3CC[C@H]2C3)cc1OC	763551347	VPBMVEWKGCUVIU-OFQRWUPVSA-N	441.488	1.970	50	20	IDGD	
CCOC(=O)c1c(F)cccc1NC(=O)C(=O)NNC(=O)COc1ccc(C#N)cc1	763680917	RTXFIXRKXOFGDM-UHFFFAOYSA-N	428.376	1.039	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)C(=O)Nc1ccc(OC[C@H]2CCCO2)cc1	763681115	ZOIVWSVPLIQLPY-MRXNPFEDSA-N	431.420	1.548	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(OCCC(C)C)cc2)c(OC)n1	763766767	CUHMLHFWDAVPNH-UHFFFAOYSA-N	430.461	1.923	50	20	IDGD	
O=C(NNC(=O)C1=S=C2CCCC2=C1)C(=O)Nc1c2c(nn1-c1ccccc1)CCC2	763784055	UDFDOGPIAOCLDM-UHFFFAOYSA-N	435.509	1.649	50	20	IDGD	
COc1ccccc1SCC(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	763792795	ZOHSMLPOCYHNJK-MRXNPFEDSA-N	432.454	1.318	50	20	IDGD	
CSc1c(F)cc(NC(=O)C(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])cc1F	763802613	FBWUWOYTCBAAHK-UHFFFAOYSA-N	440.384	1.760	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccnn2-c2cccc(Cl)c2)cc1	763811299	IIBPKMYEUCFMSK-UHFFFAOYSA-N	427.848	1.999	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1	763860693	KOTOZAZKSYXARK-CYBMUJFWSA-N	430.417	1.855	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)OCCCO3)cc1OC	763903753	SWEBHPGGZONISU-UHFFFAOYSA-N	429.429	1.655	50	20	IDGD	
COCC[S@@](=O)Cc1cccc(NC(=O)C(=O)NNC(=O)Cc2ccc(F)cc2)c1	763918300	BDNDNPCQKKIGKJ-SSEXGKCCSA-N	435.477	1.049	50	20	IDGD	
CS(=O)(=O)Cc1ccccc1NC(=O)C(=O)NNC(=O)Cc1cccc2ccccc12	764019097	GFWHTHVCDDAPIE-UHFFFAOYSA-N	439.493	1.713	50	20	IDGD	
COc1ccc(Cn2ncc(C)c2NC(=O)C(=O)NNC(=O)C2CCCC2)cc1OC	764071919	ZFPKQEFGXIZCIX-UHFFFAOYSA-N	429.477	1.533	50	20	IDGD	
COc1ccc(Cn2nccc2NC(=O)C(=O)NNC(=O)c2ccc(Cl)nc2)cc1	764098037	JCWAJCLILOMQEL-UHFFFAOYSA-N	428.836	1.388	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)nc2)ccc1N1CCCC1=O	764101369	QDGWYJGBUBBYSE-UHFFFAOYSA-N	431.836	1.270	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cccn(Cc3ccc(F)cc3)c2=O)c(O)c1	764110423	PCOPFYPIQRQFCL-UHFFFAOYSA-N	438.415	1.449	50	20	IDGD	
O=C(CC(F)(F)F)NNC(=O)C(=O)Nc1ccc(NC(=O)CN2CCCCCC2)cc1	764114537	CZTBRRZOHLZNAB-UHFFFAOYSA-N	443.426	1.539	50	20	IDGD	
O=C(CCc1ccco1)NNC(=O)C(=O)Nc1cccc(I)c1	764169541	PWKGQIXPGSHOOB-UHFFFAOYSA-N	427.198	1.603	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2O1)C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F	764169577	WWHIQSHKNCKYPT-CQSZACIVSA-N	436.327	1.286	50	20	IDGD	
O=C(CCc1ccccc1)NNC(=O)C(=O)Nc1ccc(S(=O)(=O)N2CCCC2)cc1	764187481	FXUAUAHJXHDRDW-UHFFFAOYSA-N	444.513	1.190	50	20	IDGD	
CO[C@H](C)C(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)CCc2ccccc2O)c1	764281206	MOICVCWEMWQUAQ-CYBMUJFWSA-N	428.445	1.084	50	20	IDGD	
COC(=O)c1ccc(F)c(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c1	764345976	OXLSILBEPYLCHZ-UHFFFAOYSA-N	425.376	1.198	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)C(=O)Nc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1	764385547	AWKNZTXDNHLPLW-OKILXGFUSA-N	429.452	1.542	50	20	IDGD	
CC(=O)Nc1cc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)c(F)cc1F	764393219	DYCAAOFRGXRHFR-UHFFFAOYSA-N	438.412	1.507	50	20	IDGD	
Cc1csc(Sc2ccc(NC(=O)C(=O)NNC(=O)[C@H]3COCCO3)c(C)c2)n1	764423991	FGSQNXMKMWXIBJ-CQSZACIVSA-N	436.515	1.412	50	20	IDGD	
CCC(=NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C)c1ccc2cc(OC)ccc2c1	764819076	RUSSBBDJCHMNHE-UHFFFAOYSA-N	448.483	1.526	50	20	IDGD	
COc1cccc(-c2cc(C(=O)NNC(=O)Nc3ccc(S(C)(=O)=O)cc3)n[nH]2)c1	765306696	IIJOTDXKYSSTMP-UHFFFAOYSA-N	429.458	1.955	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1ccc(C#N)cc1)C(=O)NNC(=O)c1c(Cl)cccc1Cl	765412834	UUBXUAHUSITMFB-SNVBAGLBSA-N	441.296	1.993	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)CCNS(=O)(=O)c3ccccc3)n[nH]2)c1	765577763	WTACISRKRCOLLB-UHFFFAOYSA-N	441.513	1.823	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)CNC(=O)NCc2ccc(C)cc2)n[nH]1	765596100	QTMHXJAAMLBQBH-UHFFFAOYSA-N	436.472	1.654	50	20	IDGD	
CNc1c(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)cccc1[N+](=O)[O-]	765610524	ZQGYHJPOCBNNOM-UHFFFAOYSA-N	448.505	1.330	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)N1CCO[C@H](c2ccc(OC(F)F)cc2)C1	765668756	JCWNFOXZOFFDAF-HNNXBMFYSA-N	438.387	1.425	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1cc(Br)ccc1-n1cccn1	766261436	ZFNWYJAKPYWPJD-UHFFFAOYSA-N	432.238	1.515	50	20	IDGD	
CS(=O)(=O)c1cc(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cs1	766288304	QZBVVMJGCCXRGP-UHFFFAOYSA-N	436.559	1.125	50	20	IDGD	
COCCOc1cc([N+](=O)[O-])c(C(=O)NNc2ccccc2S(C)(=O)=O)cc1OC	766663579	QUSPPRPAJCLWTO-UHFFFAOYSA-N	439.446	1.789	50	20	IDGD	
O=C(COC(=O)[C@@H]1CC(=O)N(Cc2ccccn2)C1)NNC(=O)c1ccc(Cl)cc1	766923467	JVIFAKUDPNXCIA-CQSZACIVSA-N	430.848	1.088	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)N[C@H]1CC(=O)N(Cc2ccccc2C(F)(F)F)C1	767327089	JDDXHSHXSBULTK-HNNXBMFYSA-N	435.406	1.774	50	20	IDGD	
CN(C)CCS(=O)(=O)c1ccccc1C(=O)NNc1nc2ccccc2c(=O)n1C	767477266	KMQRJNLPJCCYPD-UHFFFAOYSA-N	429.502	1.026	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccccc2COC2CCOCC2)c1	767869970	VYJHDQAYIWHRHX-UHFFFAOYSA-N	432.498	1.861	50	20	IDGD	
CN1CCN(C(=O)CN2CCC(N(C)C(=O)[C@H](Br)C(C)(C)C)CC2)CC1	767978440	DKEWRRKZZOYMPB-KRWDZBQOSA-N	431.419	1.493	50	20	IDGD	
CC[C@H](Nc1c([N+](=O)[O-])c(C)nn1C)C(=O)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	768276389	ICTKPWDYMHSADA-ZDUSSCGKSA-N	444.427	1.818	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)c(O)c1	768292183	WZRDIRAMSACRFB-UHFFFAOYSA-N	432.908	1.633	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)CN1C(=O)N[C@]2(CCCC(C)(C)C2)C1=O	768566446	RZKKDYHZEKUWIO-ASSNKEHSSA-N	434.468	1.631	50	20	IDGD	
O=C(NNC(=O)c1nccn2c(Br)cnc12)c1cnn(-c2ccccc2)c1	769741697	MPKSHMLIUQMYBE-UHFFFAOYSA-N	426.234	1.752	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNc2c(F)cccc2Cl)cc(S(C)(=O)=O)c1	770804896	BWGFBOJKDUWKRI-UHFFFAOYSA-N	443.840	1.751	50	20	IDGD	
COC[C@@H](C)NS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2c(C)cccc2F)cc1	770815890	UXBSAHKIWVHIHC-CYBMUJFWSA-N	438.481	1.529	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccccc1	771847332	VIBXXAMYPDLWOJ-YSKWHIJTSA-N	434.456	1.860	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)[C@H]1CCCN(C(=O)c2ccncc2)C1	772194609	AVOQPCHYUCRTFQ-INIZCTEOSA-N	443.891	1.051	50	20	IDGD	
CC(C)(C)OC(=O)N1CCSC[C@@H]1CC(=O)NNC(=O)Cn1cnc2ccccc21	772221242	JHQWEAVODAEXIS-AWEZNQCLSA-N	433.534	1.926	50	20	IDGD	
CNS(=O)(=O)c1ccc2c(c1)N(C(=O)C(=O)NNc1ccc3ccccc3n1)CC2	773661427	IUCIOEXTYGUQFU-UHFFFAOYSA-N	425.470	1.175	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNc2c(F)cccc2F)cc1OC	773705907	NRQRTJOCEYUMHQ-UHFFFAOYSA-N	428.417	1.817	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2cc(C(=O)NCC(F)(F)F)ccc2C)n1	773724406	QCEXZGDOKVLKPQ-UHFFFAOYSA-N	426.355	1.168	50	20	IDGD	
CCN1CCN(C(=O)c2ccc(NC(=O)C(=O)NNc3nccnc3C(C)C)cc2)CC1	773999150	BGGCYHRIJQZPQN-UHFFFAOYSA-N	439.520	1.460	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccc(-c2ncon2)cc1	774003597	YEWUXMPVQMPWNY-NSHDSACASA-N	429.820	1.943	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)cc1C(=O)N(C)C	774009453	PVZREVVFIHRIFE-ZDUSSCGKSA-N	446.891	1.904	50	20	IDGD	
COc1cc([C@H](NC(=O)NNC(=O)c2cnn(C)c2)C(F)(F)F)cc(OC)c1OC	775999081	HFZQKWQYGKXSDY-AWEZNQCLSA-N	431.371	1.694	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)[C@@H](c2cnn(C)c2)N(C)C(=O)OC(C)(C)C)cc1	776316812	RLRWSIUWMFPOHW-GOSISDBHSA-N	431.493	1.863	50	20	IDGD	
COC(=O)CNC(=O)c1ccc(NC(=O)C(=O)NNc2nc3ccccc3s2)cc1	782812370	KNQULDGSTZXFLX-UHFFFAOYSA-N	427.442	1.281	50	20	IDGD	
Cc1ncc(-c2ccc(NC(=O)C(=O)NNC(=O)Cc3nc4ccccc4n3C)cc2)o1	782894570	PEKJZBQZDNKMHO-UHFFFAOYSA-N	432.440	1.865	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)n(-c2ccccc2F)n1	782895210	XJSZHDADQLJXSM-UHFFFAOYSA-N	449.446	1.535	50	20	IDGD	
CON(C)S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2nccc3sccc23)cc1	783435278	AGBNCMBVDBLCMO-UHFFFAOYSA-N	435.487	1.560	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2nccc3sccc23)cc1	783435372	FNYKAITXHLFWSO-UHFFFAOYSA-N	449.514	1.303	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ccnc(Br)c2)cc1NS(C)(=O)=O	784837433	RUGIHMYGQIFDDG-UHFFFAOYSA-N	442.295	1.606	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)C(=O)Nc2cc(N3CCCC3=O)ccc2F)c1	784844862	RQQDDSMHQKDNJF-UHFFFAOYSA-N	434.449	1.438	50	20	IDGD	
CN(C)CCCOc1ccc(NC(=O)C(=O)NNc2ccc(C(F)(F)F)nn2)cc1	784886827	ZMLVMNUXONFFAA-UHFFFAOYSA-N	426.399	1.908	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1cccc2c1CCN2C(C)=O	785330359	GAHNKQNUCMJZLI-UHFFFAOYSA-N	446.485	1.090	50	20	IDGD	
CN(C)Cc1ccc(NC(=O)C(=O)NNC(=O)CC(F)(F)F)cc1Br	786416532	FILBYGRYAZSUOW-UHFFFAOYSA-N	425.205	1.549	50	20	IDGD	
Cc1[nH]c(-c2ccncc2)nc(=O)c1CC(=O)NNC(=O)NCc1ccc(Cl)cc1	787431650	NENYINRRXNQWIJ-UHFFFAOYSA-N	426.864	1.867	50	20	IDGD	
CN1CCC(n2ccc(NC(=O)C(=O)NNC(=O)CCSc3ccc(F)cc3)n2)CC1	787542571	AVHMZMPXASPZIV-UHFFFAOYSA-N	448.524	1.557	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)cccc1N1CCNC1=O	787550590	VSGBGFUPOYGSFW-UHFFFAOYSA-N	447.398	1.282	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNS(=O)(=O)C1=Cc2ccccc2OC1	788743944	LFXSMIBYJRECFB-UHFFFAOYSA-N	436.515	1.286	50	20	IDGD	
CCC[C@@H]1CCc2nc(NC(=O)C(=O)NNC(=O)[C@@H]3COc4ccccc4O3)sc2C1	789731598	FZBHGRDNTMYBFA-WBMJQRKESA-N	444.513	1.974	50	20	IDGD	
Cn1nc([C@@H]2CCCOC2)cc1NC(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	790542242	PEZDHWMFXLUYAY-CYBMUJFWSA-N	425.449	1.672	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc(-n2cccn2)c1	792354900	MKXNRESGEILQAK-UHFFFAOYSA-N	437.412	1.052	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c(F)cc1C	793022716	BJWMOROHLCBQPE-KRWDZBQOSA-N	445.403	1.237	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)[C@@H]2CCCCN2C(C)=O)c2ccccc2c1=O	794774393	KKBYSDAAGUSSDA-SFHVURJKSA-N	427.505	1.749	50	20	IDGD	
O=C(COC(=O)c1ccccc1Br)NNC(=O)[C@H]1COc2ccccc2O1	797468585	OBOMNQKYHLTPRR-OAHLLOKOSA-N	435.230	1.593	50	20	IDGD	
Cc1ccc(N2CCOCC2)cc1NC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	797689544	QJFITOFKKIMLFH-UHFFFAOYSA-N	432.502	1.702	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)[C@H]1CC[C@H](C(=O)OC)CC1	797931562	KIPGDBLAGZCXBQ-HAQNSBGRSA-N	426.853	1.632	50	20	IDGD	
O=C(COC(=O)c1occc1CS(=O)(=O)c1ccccc1)NNC(=O)c1ccccc1	798087698	PNGXPLCMQXRYHV-UHFFFAOYSA-N	442.449	1.872	50	20	IDGD	
COc1ccc(C(=O)NN=c2sc3ccccc3n2C)cc1S(=O)(=O)NC1CC1	798304010	XJRJBGQSXRWWSG-UHFFFAOYSA-N	432.527	1.935	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CCc2c(C)[nH]c(-c3ccncc3)nc2=O)cc1C	798310940	YFRCTXGGSFBXIX-UHFFFAOYSA-N	448.483	1.476	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)Nc1cc2c(cc1N1CCCCC1)n(C)c(=O)n2C	800592589	ILDYWLAELRJVRG-UHFFFAOYSA-N	426.481	1.365	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)Cn2c(CS(C)(=O)=O)nc3ccccc32)cc1	802119056	WOLGTMZSLMUDRO-UHFFFAOYSA-N	444.517	1.500	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)Nc1ccc(F)c(N2C(=O)CCC2=O)c1	806745885	XNHWHFIBEHELNZ-UHFFFAOYSA-N	445.363	1.619	50	20	IDGD	
O=C1COC[C@H](C[C@H]2CN(C(=O)C(=O)NNc3ncccc3Cl)c3ccccc32)N1	806967356	DPCXJDRDTYANQJ-STQMWFEESA-N	429.864	1.214	50	20	IDGD	
O=C(NNc1nccnc1C1CCC1)C(=O)Nc1cccc(S(=O)(=O)NC2CC2)c1	807459737	DSPXWTSNFYKWGM-UHFFFAOYSA-N	430.490	1.267	50	20	IDGD	
Cc1ccc(C)c(S(=O)(=O)NCC(=O)NNC(=O)c2cccc(OC(F)F)c2)c1	810344240	MQAZAACAZXCOGT-UHFFFAOYSA-N	427.429	1.644	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(Cl)cc1)NNC(=O)c1cccc(Br)c1	810448543	LOTICXCIWVFNFR-UHFFFAOYSA-N	446.710	1.842	50	20	IDGD	
Cn1ccnc(NNC(=O)Cc2sc(N3CCOCC3)nc2-c2ccccc2)c1=O	810470019	PVJCFYDQVNWBTK-UHFFFAOYSA-N	426.502	1.426	50	20	IDGD	
Cc1cc(=O)cc(C)n1CCCC(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	810621565	OKTRZMCQASHCCM-UHFFFAOYSA-N	449.552	1.975	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)[C@@H]2CCCN(C(=O)c3ccccc3)C2)cc1	812730602	OMSKLIQFTWCBOF-QGZVFWFLSA-N	430.530	1.932	50	20	IDGD	
COC(=O)c1cn(-c2cccc(NC(=O)C(=O)NNc3cc(F)cc(OC)c3)c2)nn1	812989549	YGDADABRVLLPEP-UHFFFAOYSA-N	428.380	1.283	50	20	IDGD	
CC(=NNC(=O)COc1ccccc1O)c1ccc(S(=O)(=O)N2CCOCC2)cc1	814951722	RLRDBZFPGLTSGF-UHFFFAOYSA-N	433.486	1.332	50	20	IDGD	
COCc1cc(NC(=O)C(=O)NN=c2sc3ccccc3n2C)cc(C(=O)OC)c1	815588360	LQUOWKUVQJBPFI-UHFFFAOYSA-N	428.470	1.743	50	20	IDGD	
CNC(=O)Oc1cccc(NC(=O)C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)c1	815609084	WMJLVLHSNWBTEN-UHFFFAOYSA-N	447.398	1.657	50	20	IDGD	
N#Cc1ccc(Oc2cccc(NC(=O)C(=O)NNC(=O)[C@@H]3CCc4nncn4C3)c2)cc1	815691783	BFIKHTMGRCKVOC-OAHLLOKOSA-N	445.439	1.291	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCc2nncn2C1)C(=O)Nc1cccnc1-c1ccc(Cl)s1	815692388	PXBUFXJSWGNHRE-SNVBAGLBSA-N	445.892	1.404	50	20	IDGD	
CCOc1cc(N2CCOC(C)(C)C2)ccc1NC(=O)C(=O)NNc1ncncc1F	815765005	CBQPFBLIIXZSRP-UHFFFAOYSA-N	432.456	1.711	50	20	IDGD	
COc1ccc(NNC(=O)C2=NN([C@H]3CCS(=O)(=O)C3)C(=O)CC2)c(C(F)(F)F)c1	816703924	ZDCVZBFYGYADGY-JTQLQIEISA-N	448.423	1.323	50	20	IDGD	
O=C(COC(=O)c1ccc(OC[C@@H]2CCCO2)cc1)NNC(=O)c1ccc([N+](=O)[O-])cc1	844160433	RQVWFUKDTKHVKM-SFHVURJKSA-N	443.412	1.771	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)N1CCCN(C(=O)c2cccc(F)c2)CC1	913463269	ZEAOGSZFPHPKPJ-UHFFFAOYSA-N	438.463	1.984	50	20	IDGD	
CCOc1ccc(OCc2ccc(C(=O)NNC(=O)CN3CCCNC3=O)cc2)cc1	915260533	NGPGEYXDDUZHAH-UHFFFAOYSA-N	426.473	1.841	50	20	IDGD	
COc1ccnc(NNC(=O)NC[C@@H](c2ccc(OC)c(OC)c2)N2CCOCC2)n1	915895381	MSZNNIPRRWXRNS-HNNXBMFYSA-N	432.481	1.202	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc([C@@H](C)NC(=O)NN[C@@]2(C)CCS(=O)(=O)C2)cc1	915901804	LKYQRSHBTFJVGG-KDOFPFPSSA-N	446.595	1.159	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)nc1	915903220	XHKJGTLEYDFDTB-QGZVFWFLSA-N	432.550	1.669	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NCCOCC(F)(F)F)c2ccccc2c1=O	916329228	ZWRFEVFICRCPTN-UHFFFAOYSA-N	429.399	1.720	50	20	IDGD	
C[C@]1(NNC(=O)NC[C@H](c2ccccc2Cl)N2CCOCC2)CCS(=O)(=O)C1	916437927	RCAJVGUDAQLVTM-AEFFLSMTSA-N	430.958	1.094	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)COc1ccc(F)cc1)N1CCN(c2ccccc2)CC1	916514865	QQQXLGAQKHCBHK-QGZVFWFLSA-N	429.496	1.746	50	20	IDGD	
CC(=NNC(=O)Cc1nc(C)cs1)c1ccc(S(=O)(=O)NCCCN(C)C)cc1	917541098	NNZZGQHTZWHGTP-UHFFFAOYSA-N	437.591	1.764	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)N(C)CC(=O)N[C@@H]2CCS(=O)(=O)C2)c(C)n1CCC(C)C	920291456	VKYHEFMWWGXOQV-DEWISIQVSA-N	448.589	1.820	50	20	IDGD	
C[C@@H](OCC1CC1)C(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	920806145	ZEDMOGIJCQNPEZ-OAHLLOKOSA-N	431.514	1.741	50	20	IDGD	
CCOc1ccc(/C=C(\C#N)C(=O)NCCNS(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1	921167651	GMWGOXVCHZVARZ-FOWTUZBSSA-N	444.469	1.995	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCN(C(=O)C3CCCCC3)CC2)cc1OC	921191652	ICYBUGWZFHKKIB-UHFFFAOYSA-N	432.521	1.189	50	20	IDGD	
C[C@@H](C(=O)NNc1nncc(N)c1Cl)N1C(=O)c2ccc(Br)cc2C1=O	1320606353	VPXWRTVXSLLASG-LURJTMIESA-N	439.657	1.603	50	20	IDGD	
Cn1ccc(NNC(=O)[C@@H]2CCCN(S(=O)(=O)c3ccc(Br)cc3)C2)n1	1321389728	ZFPOLFDSOKBDPH-GFCCVEGCSA-N	442.339	1.727	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C=C/C(C)C)C2	1778094679	LTEWSVRQQQGTHJ-VABFRFCASA-N	443.548	1.847	50	20	IDGD	
CC(=O)N(C)[C@@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Br)C2	1778105693	GITZWWUFOUDZRI-ZCTGUTNYSA-N	436.322	1.058	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C(=O)NCC(C)C)C1	1778117246	YXGBRQGJXFEQAG-QMTMVMCOSA-N	446.386	1.446	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H]2Cc3ccccc3O2)C1	1778840598	MQPGFTYWBLYQKZ-FAGZOMQFSA-N	436.936	1.758	50	20	IDGD	
Cc1ccc(=O)n(C(C)(C)C(=O)N2CC[C@@]3(CN(C(=O)C(C)(C)CCl)CCO3)C2)n1	1779233831	YIPCAOVFWMWWSX-NRFANRHFSA-N	438.956	1.382	50	20	IDGD	
COCCCC(=O)N1CCO[C@]2(CCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1	1780095794	WYZHIJJXHWPOPX-OAQYLSRUSA-N	449.460	1.390	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Br)C2)c1ccc(O)nc1	1780129612	VCDZQMVZMFCUDF-SUYBPPKGSA-N	430.274	1.605	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)cc1OC	1780655741	LCBLVWIQSIDFFN-MAUKXSAKSA-N	445.285	1.838	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cccc3ccnn23)C1	1781227028	RXQKGSRLAXJFDM-HGHGUNKESA-N	434.924	1.716	50	20	IDGD	
Cc1noc(C)c1CCC(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781325932	KBMTYDPQXBUJJX-WBVHZDCISA-N	432.290	1.744	50	20	IDGD	
COc1ncc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)cc1F	1781326619	QPKBEYGNGXKWOR-WBMJQRKESA-N	434.237	1.363	50	20	IDGD	
COc1ccccc1CC(=O)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781335377	XVFZNQDEOTWTSX-FUHWJXTLSA-N	429.286	1.758	50	20	IDGD	
CCOC(=O)/C=C/C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)Br)C1	1781996744	STOIUYVZQMIXMK-IBRISWKNSA-N	431.327	1.403	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(CCN(C(=O)c3cc4cccnc4nc3O)C2)C1	1782265598	IMGVHPRGDHXUOJ-OAQYLSRUSA-N	444.564	1.630	50	20	IDGD	
CCC[C@H](NC(C)=O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CO[Si](C)(C)C)C2	1783186205	SHCZJOWXQZRTKU-WAOWUJCRSA-N	441.645	1.657	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)COC(=O)C(F)(F)F)CCO2)C1	1783349653	QMRCWCFLDSYEPZ-IINYFYTJSA-N	445.232	1.095	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3noc4c3CCCC4)CCO2)C1	1783534542	LDJUYCNRAJMYQL-XIKOKIGWSA-N	426.311	1.780	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cccn(C(F)F)c3=O)CCO2)C1	1783539158	XXWGGALVCOWYEY-PIGZYNQJSA-N	448.264	1.470	50	20	IDGD	
N#Cc1ccc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Br)C[C@@H]32)cc1	1783605261	OCQKLHBGSPXJTB-NBOOPKSLSA-N	438.297	1.771	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3CCC(CO)CC3)C[C@@H]21	1783968525	AZTKHLXGXMVQKN-AVLMTOMQSA-N	445.398	1.796	50	20	IDGD	
CC1(C)Cc2cccc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]4C3)c2O1	1784090343	ADNPXPSQYPCHBD-OWLYRPNTSA-N	436.936	1.593	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)n3ccnc3)[C@H]2C1	1784253674	FTPLJDVYPAWMHP-QRJUGERDSA-N	427.343	1.455	50	20	IDGD	
Cc1nn(C)c(C)c1CC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](C)Br)CCO2	1784515367	SZORMDQMSZRVSH-SGTLLEGYSA-N	427.343	1.193	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=N/O[C@H]3CCCCO3)C[C@@H]21	1784618429	ZVSAXVZOXKTWCK-SESMADOESA-N	429.945	1.903	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc[n+]([O-])c3)[C@H]2C1	1785501740	UYGFUIVPWDTVMD-JONQDZQNSA-N	426.311	1.087	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cn4ccccc4n3)C[C@@H]21	1786406802	FYUQNJDLIGFLBY-DZKIICNBSA-N	435.322	1.713	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3(C(F)(F)F)CCC3)[C@H]2C1	1786757913	YKIIEKICLZJWOL-XUXIUFHCSA-N	426.863	1.953	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccnc(Cl)n3)[C@H]2C1	1788878199	ZLQXMXRANCLYFV-ZPFDUUQYSA-N	431.718	1.507	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3c(OC)cccc3OC)[C@H]2C1	1789473869	LLVWETDZHJEBRR-AFIMGQEJSA-N	440.924	1.551	50	20	IDGD	
COC(=O)CSCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]2C1	1789867677	IBLNDKALMXNLFW-NEULZYRMSA-N	441.377	1.109	50	20	IDGD	
COc1cccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]3C2)n1	1789868323	CAHPNAXBDXYHIQ-VODUFIJXSA-N	430.332	1.920	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ncc(Cl)cn3)C[C@@H]21	1789869216	YYMLHUJEYPCBBI-PYERRIOISA-N	435.739	1.960	50	20	IDGD	
CCOc1cnc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]3C2)cn1	1789922017	BGSVEFUFFJPKLO-UHXUCMFUSA-N	445.289	1.159	50	20	IDGD	
Cn1nc2c(c1C(=O)NC[C@@H]1OC[C@@H]3CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]31)CCC2	1790462904	IHRPTHAICXIWAV-DXJCSPRDSA-N	443.375	1.738	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3(c4ccccc4)CC3)C[C@@H]21	1791286359	CVGXHYQYVWCCQT-IHPCNDPISA-N	442.560	1.071	50	20	IDGD	
CN(C)C(=O)c1cccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]3C2)c1	1791297834	FNEYUQAAKFMPBC-JYJNAYRXSA-N	442.343	1.785	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3ncsc3[nH]1)C2	1792870297	BNJLLHNPAPWSSX-DYNIEEOBSA-N	441.351	1.859	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(O)cc1F)C2	1792874098	KSJYAZKUZYWKOH-LSSIXWDNSA-N	429.286	1.766	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C12CC(C(F)(F)F)(C1)C2)c1cccc(B(O)O)c1	1793709335	UAULGYUADLUNSP-CVMQENGJSA-N	436.239	1.351	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1sc(N)nc1C	1796117821	CJQFURJMIDFBTR-MGGJZVGQSA-N	443.533	1.420	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2)c1noc2c1CCCC2	1796151802	NTALNGPLADQLAO-DRXBFXEBSA-N	426.311	1.542	50	20	IDGD	
COc1ccc([C@@H]2C[C@H]2C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)cc1	1796188004	STKGUSHJZVODIK-XLGPZGCCSA-N	448.328	1.431	50	20	IDGD	
CCN(CC)C[C@@H](C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C(C)=N/NC(=O)c1ccc[nH]1	1796893727	OOBIENJDMZJKSG-YMUBQMKBSA-N	444.580	1.737	50	20	IDGD	
Cc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CO[Si](C)(C)C)cc2c[nH]nc12	1797957510	ULFRJEQYKPNORY-XEMDLRDOSA-N	430.581	1.926	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1n[nH]c3c1CCc1ncccc1-3)C2	1799269396	YSNCQQGNVMEIBY-ZDFLXESQSA-N	443.935	1.791	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(N3C(=O)C=CC3=O)cc1)C2	1799271623	VAUFPBCMEGWNCH-MQJTVSLUSA-N	445.903	1.337	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1(c3ccccc3)CC1)C2)[C@H](F)Br	1799342294	HXAXSIPTZXDRSU-XRGAULLZSA-N	425.298	1.998	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc3[nH]ncc13)C2)[C@@H](F)Br	1799346324	PDRNLAMEPFOGAX-ANGCBRKESA-N	425.258	1.457	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(CO)c(F)c1	1801903258	QQQWSSRHAKUPLG-JYYAWHABSA-N	443.313	1.695	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1=NN(c3ccccc3)C(=O)C1)C2	1802277232	RNVALLWOLYIDHW-XLNGHYISSA-N	432.908	1.671	50	20	IDGD	
C=CCNC(=O)/C=C\C(=O)NC[C@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1	1802483359	UDVCYFCGTRAJKI-AQZVRURSSA-N	449.349	1.731	50	20	IDGD	
CC(C)(C)OC(=O)CC(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]1c1cccnc1	1803136703	TZFQQHSWEQUDLE-RKVPGOIHSA-N	425.913	1.419	50	20	IDGD	
C[C@H](Nc1nccs1)C(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]1c1cccnc1	1803139071	KDFQOYPSFVAIPH-DRPJVOAASA-N	437.953	1.644	50	20	IDGD	
CN(C)c1ccc(C(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]2c2cccnc2)nc1	1803140055	ALRFNTVSUVNHGO-ATZDWAIDSA-N	431.924	1.462	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cccn3ccnc23)[C@H]1c1cccnc1)[C@@H](O)CCl	1803142549	FBGQQRQPYXXZLP-SZMVWBNQSA-N	427.892	1.649	50	20	IDGD	
CCCNC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)[C@@H](Cl)COC)[C@@H]1c1cccnc1	1803449219	ZGEHMGQTXNFDPS-ABSDTBQOSA-N	438.956	1.648	50	20	IDGD	
COc1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CCC(=O)NN(C)C)C3)cc(OC)c1C	1803817060	ACOQVJOKIOMNOW-BCDXTJNWSA-N	446.548	1.637	50	20	IDGD	
O=C1CC[C@H](C(=O)N2CC[C@@H](CNC(=O)CCBr)[C@H]2c2cccnc2)CN1	1806338195	RTFOCEXSLWDBCB-RLFYNMQTSA-N	437.338	1.399	50	20	IDGD	
O=C(CCBr)NC[C@H]1CCN(C(=O)c2c[nH]c(=O)cn2)[C@@H]1c1cccnc1	1806344217	YIEDRQNUPCAMML-CXAGYDPISA-N	434.294	1.270	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)Cc2ccsc2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807362782	JGRHCVQVXIULGR-UGKGYDQZSA-N	449.341	1.385	50	20	IDGD	
C[C@H](C(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)n1cccc1C=O	1807392059	UKADXWCMEBPUHD-TWKWOARYSA-N	432.908	1.562	50	20	IDGD	
CCOc1cnc(C(=O)N2CCCC3(CCN(C(=O)CCC(=O)NN(C)C)CC3)C2)cn1	1807518899	ZCUCCKGSMHXIDF-UHFFFAOYSA-N	446.552	1.093	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC2(CCCN(C(=O)c3cnn(C(C)(C)C)c3)C2)CC1	1807540166	SJYSARXEUJSJPA-UHFFFAOYSA-N	446.596	1.856	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H](CNC(=O)Cn2cncn2)[C@@H]1c1cccnc1	1807604834	WYSAOXFWMAQIJU-VYDXJSESSA-N	435.326	1.553	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)Cn2ccnn2)[C@H]1c1cccnc1)[C@@H](F)Br	1808663221	YRWIHCYOYXYZRS-AEGPPILISA-N	425.262	1.070	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)[C@H]2CC=CCC2)[C@H]1c1cccnc1	1810305369	KNUMLXOKZKGGIZ-MDKPJZGXSA-N	448.527	1.756	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CO)C(=O)N1CCC2(CCCN(C(=O)[C@@H](F)Cl)C2)CC1	1810901289	NYDOYSPSURWNFK-UONOGXRCSA-N	435.924	1.638	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)C#Cc2ccccc2)[C@@H]1c1cccnc1	1813071394	PGZRZQDRHYEZMK-SQJMNOBHSA-N	447.539	1.512	50	20	IDGD	
CN1CCN(CCC(=O)N2CC[C@H](CNC(=O)C(Cl)Cl)[C@@H]2c2cccnc2)CC1	1813075577	FOWZTLIWLFFOOE-AEFFLSMTSA-N	442.391	1.529	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](O)CCl)n[nH]1	1814877752	KHDHNQCIJGKYIN-SJXGUFTOSA-N	438.912	1.757	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnn4cccnc34)sc2C1	1818991676	NKIAQAIQWGLRAC-PWSUYJOCSA-N	434.909	1.665	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)/C=C\C(=O)NC3CC3)sc2C1	1819532979	YANIYELWJPVLNH-BCVXMLFPSA-N	441.351	1.673	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)CCl)CC2)c1cc(-c2ccncc2)[nH]n1	1820586113	ITEOYNGRMRFQCT-ABAIWWIYSA-N	446.920	1.754	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](F)Br)CC2)c1c[nH]c(=O)cn1	1821472499	NUVWZYNHPDHPDZ-UPONEAKYSA-N	430.259	1.143	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H]2CCCO2)n[nH]1	1822158450	HKCAKZAJDMPZME-CUPNELQNSA-N	441.492	1.715	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](O)c2ccco2)[nH]n1	1822412200	NFPICZWPXSMNNX-IFXJQAMLSA-N	432.481	1.101	50	20	IDGD	
Cc1c(C(=O)N2CCCC[C@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)cnn1C	1822413420	VKTZCUDAIXSWFP-INIZCTEOSA-N	430.513	1.131	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnoc2C2CC2)[nH]n1	1822413489	YIULSHOOVZDJCD-INIZCTEOSA-N	443.508	1.954	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ncccc2F)[nH]n1	1822415217	WVQYTPVLHGFKGR-OAHLLOKOSA-N	431.472	1.623	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(OC)nn2C)CC1	1825478600	JRKOSUFWGLGUPS-JKSUJKDBSA-N	426.945	1.916	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)COC(=O)C(F)(F)F)CC2	1826000129	LWEKCLMJYRMBEG-YUMQZZPRSA-N	443.831	1.414	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCc1ccco1)CC2	1826080335	BSDPNJZCJUMTQQ-ZDUSSCGKSA-N	433.534	1.654	50	20	IDGD	
C[C@@H](C(=O)N[C@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1)c1ccccn1	1826092179	PUPBAYLTSWGAGI-KGLIPLIRSA-N	444.561	1.627	50	20	IDGD	
O=C1COc2ccc(C(=O)N3CCCC[C@H]3C3CCN(C(=O)[C@H](O)CCl)CC3)cc2N1	1828624272	BEPGGPZNPRSNQJ-ZWKOTPCHSA-N	449.935	1.851	50	20	IDGD	
O=C(CCBr)N1CCC([C@H]2CCCCN2C(=O)[C@H](O)N2CCOCC2)CC1	1828967088	UEAAAELXOZVNFM-AEFFLSMTSA-N	446.386	1.042	50	20	IDGD	
COC[C@@H](NC(C)=O)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCBr)CC1	1829112756	DBDMCYIADLWPCP-IAGOWNOFSA-N	446.386	1.542	50	20	IDGD	
CCOc1ccsc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](Cl)COC)C2)C1	1829554100	GBEDKCWOVSVIAQ-AUUYWEPGSA-N	446.953	1.471	50	20	IDGD	
CCc1[nH]nc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)c1F	1830359205	WGCPDOBSSQSOJE-LJQANCHMSA-N	430.908	1.446	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3n[nH]c(CC)c3F)C2)C1	1831644113	OPSOOIAZBBRFPX-BFUOFWGJSA-N	430.908	1.589	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CCN2CCOC2=O)CC1	1831831426	XXLKFVMKWBCZRL-SJORKVTESA-N	429.945	1.702	50	20	IDGD	
CN1CCC[C@@H](C(=O)N2CCC([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)C1	1831873880	DIPXVKRSWRBUJV-UXHICEINSA-N	435.613	1.321	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(F)s3)CCO2)C1	1833212460	VDMJPEXJMADJBA-YVEFUNNKSA-N	449.342	1.988	50	20	IDGD	
CC(C)c1nc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)co1	1833346154	AREOWEBUBCQQOQ-HXUWFJFHSA-N	439.585	1.720	50	20	IDGD	
CCC(=O)N[C@H](C)C(=O)NC1CCN(C2CCN(C(=O)[C@@](C)(Cl)CCl)CC2)CC1	1833422381	XVPCRPTXRMOLRR-VLIAUNLRSA-N	449.423	1.709	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1)c1csnn1	1833558523	LTXMUTJZKNQLQG-ZDUSSCGKSA-N	434.335	1.414	50	20	IDGD	
C[C@@H](Nc1ccccn1)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](F)Cl)CC2)CC1	1835847116	KNCVHZNJBMMLEJ-RDTXWAMCSA-N	425.936	1.988	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3cnn(C)c3)CCO2)C1	1835985435	OOUHVOYUVCWFTJ-PXNSSMCTSA-N	426.945	1.217	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccsc3)CCO2)C1	1836095006	NQWZUORPIYOQLJ-KDOFPFPSSA-N	445.379	1.778	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3c(C)noc3N)CC2)CC1	1837861105	WTVJCKRQOTYLBN-HNNXBMFYSA-N	428.917	1.431	50	20	IDGD	
O=C([C@@H](F)Br)N1CCC(OC2CCN(C(=O)[C@@H]3[C@H]4COC[C@H]43)CC2)CC1	1838648362	RSWXYHTUIDWJIF-FXUDXRNXSA-N	433.318	1.568	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cn(C(C)(C)C)nn3)CCO2)C1	1838757716	FEDUNOMUCCCJRJ-AUUYWEPGSA-N	427.933	1.121	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3nc(C)sc3C)C2)C1	1839142256	LAVVLGZLOPIZFD-HNAYVOBHSA-N	429.970	1.776	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3n[nH]c(C4CC4)c3F)C2)C1	1839143435	WEXKMLWUGCXCPX-DJJJIMSYSA-N	428.892	1.514	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cn4ccsc4n3)C2)C1	1839145471	IKZWRXNZBPPMEL-FZKQIMNGSA-N	426.926	1.483	50	20	IDGD	
Cc1n[nH]c(C)c1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2	1839153281	DUUPGPVQPLLPDK-ZWKOTPCHSA-N	433.336	1.333	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)nc1C	1839197572	BGQHBJPZLBLGFL-CRAIPNDOSA-N	444.301	1.459	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)C3CC4(CCC4)C3)C2)C1	1840035965	BNHGVBNEORKPSO-AUUYWEPGSA-N	429.355	1.807	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](OC)c3ccccc3)C2)C1	1840151711	MCTFFALBTVNDFJ-OPYAIIAOSA-N	440.924	1.084	50	20	IDGD	
Cc1cncc(CCC(=O)N2CCOC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)c1	1840186813	VKDXDAYRJCSHBT-IBGZPJMESA-N	430.332	1.583	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CCCSC1)CCO2	1840867880	SCLRRVNORFBLSZ-RVKKMQEKSA-N	449.411	1.760	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)[C@@H]2C[C@H]2c2ccc(F)cc2)C1	1841242771	NVBOHZXFSAVRSZ-ZWKOTPCHSA-N	437.475	1.445	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H]2C[C@]21C(=O)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1	1841353951	ZIDRASVRBULKRJ-LAPQFRIASA-N	427.929	1.189	50	20	IDGD	
Cc1n[nH]cc1C(=O)N1CC2(CCCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C1	1841924631	JZSKVFUEJUKEOW-AWEZNQCLSA-N	425.917	1.667	50	20	IDGD	
C[C@H](Br)C(=O)N1CC2(CCCN2C(=O)c2cncc(S(C)(=O)=O)c2)C1	1842189688	IRKLPGDZOCLEME-NSHDSACASA-N	430.324	1.086	50	20	IDGD	
Cn1nccc1C(=O)N1CCCC12CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1842463327	XKXQAEDRXORIBS-ZDUSSCGKSA-N	425.917	1.369	50	20	IDGD	
O=C(c1ccc(N2CCCCC2)cc1)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843014643	JXPODEFWGYSPLO-UHFFFAOYSA-N	447.344	1.488	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)CCn1cncn1)C2	1844693304	QDAAJTOYLUOELG-UHFFFAOYSA-N	442.432	1.019	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)C1=C3c4ccccc4C(=O)N3CC1)C2	1846363006	JRAKCXRSRBJJBC-QGZVFWFLSA-N	429.904	1.714	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@H](C)NC(=O)c1ccc(F)cc1)C2	1846363374	FNKKHWHLWCPTIJ-XJKSGUPXSA-N	425.888	1.401	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)/C=C/C(=O)NCc1ccccc1	1847540882	UNHUUQHYZDWIII-MYQPPDNISA-N	429.593	1.912	50	20	IDGD	
CCS(=O)(=O)N1CCC(C(=O)NNC(=O)c2cc(C)n(-c3ccccc3)c2C)CC1	17443288	DHNLUGLOTQZXDA-UHFFFAOYSA-N	432.546	1.917	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)Cn2cc(C(F)(F)F)ccc2=O)c2ccccc2c1=O	22635091	OUVMDDZVPMCJHV-UHFFFAOYSA-N	449.389	1.619	50	20	IDGD	
COc1ccc([C@@]2(C)NC(=O)N(CC(=O)NNC(=O)CNc3ccc(C)cc3)C2=O)cc1	105009507	UODWGTYQFRHPKR-JOCHJYFZSA-N	439.472	1.030	50	20	IDGD	
CO[C@H](C)CCNC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	726713214	CWFKRKSHFLHBEK-OAHLLOKOSA-N	434.518	1.534	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)CN2C(=O)[C@@H]3[C@@H](C2=O)[C@H]2C=C[C@H]3C2)c1	728528987	QMYSBZLCXRSZKN-NXPNQGMMSA-N	448.273	1.026	50	20	IDGD	
CCOC(=O)C1=NN(c2ccccc2)[C@@H](C(=O)NNC(=O)c2cccc(OC)c2O)C1	728714705	OYRXUWXNPIPHSM-MRXNPFEDSA-N	426.429	1.360	50	20	IDGD	
CS(=O)(=O)c1cc(C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)cc([N+](=O)[O-])c1	728971743	JUCMCYADHYPFER-UHFFFAOYSA-N	449.413	1.752	50	20	IDGD	
CCc1cc(SC#N)cc(CC)c1NC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C	728984653	KVBLNLIFVXUTAW-UHFFFAOYSA-N	426.502	1.770	50	20	IDGD	
C[C@H]1CCCCN1CCOc1ccccc1C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	729629545	LVGGBAVHQLFGIB-KRWDZBQOSA-N	449.515	1.990	50	20	IDGD	
COC(=O)c1cc(C(=O)OC)cc(S(=O)(=O)NNC(=O)c2cccc3ncccc23)c1	730203547	CPTLZJMNZWFIDA-UHFFFAOYSA-N	443.437	1.431	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)N[C@@H](C)C(=O)N2CCS(=O)(=O)CC2)c(C)n1CC(C)C	731477099	QRHZOZLASVUGQW-YLRSXTQRSA-N	434.562	1.430	50	20	IDGD	
C[S@](=O)CCCNC(=O)/C(C#N)=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	732111966	BWQMYGQSFCWDBP-WCRBMVSXSA-N	447.948	1.871	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCCCCN2CCN(C)CC2)cc1Br	732238192	DVNMBIXNQYJWPP-UHFFFAOYSA-N	442.358	1.429	50	20	IDGD	
COc1ccc(C(=O)NNc2ccccc2S(C)(=O)=O)cc1S(=O)(=O)N(C)C	732303314	DACQZXBEBQQLOG-UHFFFAOYSA-N	427.504	1.106	50	20	IDGD	
Cc1cc(C)n2nc(C)c(C(=O)OCC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)c2n1	732329718	PGFOSFDXEZYBHV-UHFFFAOYSA-N	426.389	1.181	50	20	IDGD	
COC(=O)c1c(C)[nH]c(C(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)c1C	734822098	RJXMBOXCRUHSTR-UHFFFAOYSA-N	437.497	1.762	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)c2ccccc2N2CCOCC2)CC1	734824878	LJWZNECERVTWHI-UHFFFAOYSA-N	447.536	1.867	50	20	IDGD	
Cc1nc2c(cc1C(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1)c(C)nn2C	734825947	RQQPFDZAJLKCDW-UHFFFAOYSA-N	445.524	1.929	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)Sc1nnc(N2CCOCC2)n1CC(F)(F)F	734981966	HQVJNHPWKTYHJH-NSHDSACASA-N	438.476	1.351	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)N[C@H](C)CN1CCN(c2ccccn2)CC1	735585558	GBTJYNPFGKNYFQ-SJORKVTESA-N	444.511	1.529	50	20	IDGD	
CC(=O)N1CCN(C(=O)CCNC(=O)NNC(=O)c2ccc(Cl)cc2Cl)CC1	737065249	OSYXXEPEARGLOV-UHFFFAOYSA-N	430.292	1.018	50	20	IDGD	
CC(=NNC(=O)CCc1ccccc1O)c1cccc(S(=O)(=O)N2CCOCC2)c1	739409363	DZBAZTINHKSFQQ-UHFFFAOYSA-N	431.514	1.886	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)NC[C@H]2CN3CCC[C@@H]3CO2)cc1Cl	743593961	KHQBUWWMOZLLAJ-NEPJUHHUSA-N	427.889	1.556	50	20	IDGD	
COc1ccc(C(=O)NCC(=O)NNC(=O)Nc2ccc(OC(F)F)cc2)cc1OC	743834177	UIZXVOWHYCOQSW-UHFFFAOYSA-N	438.387	1.888	50	20	IDGD	
CSCC[C@H](NC(=O)c1ccc(Cl)cc1Cl)C(=O)NNC(=O)C(=O)NC(C)C	744447082	WHSPVXZWMZOVEU-ZDUSSCGKSA-N	449.360	1.517	50	20	IDGD	
COc1cc(CNC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c2ccccc2n1	745878662	SPHSZRBLIDEQQD-UHFFFAOYSA-N	432.440	1.635	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NCCc2ccn(-c3ccc(F)cc3)n2)cc1	745891564	DCDDNXKFVDGHDX-UHFFFAOYSA-N	427.436	1.972	50	20	IDGD	
CC[C@H]1Oc2cc([C@@H](C)NC(=O)NNC(=O)CNC(=O)c3cccs3)ccc2NC1=O	745929301	BXFHJTFODZEHIW-BXUZGUMPSA-N	445.501	1.679	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2N)c1	746284948	GKWHATXRNQMTPV-UHFFFAOYSA-N	435.462	1.282	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)/C(=C/C2=S=CC=C2)n2nnnc2-c2ccccc2)cc1	747176362	UODADAWJGCTHBD-UYRXBGFRSA-N	441.476	1.791	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NCCOc2ncccc2F)c2ccccc2c1=O	747449001	DWMGHCAGGMPBQH-UHFFFAOYSA-N	442.451	1.754	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)NNC(=O)c1ccc(Br)cc1Cl	747501496	XWYFBVMDKQAOGZ-UHFFFAOYSA-N	426.658	1.715	50	20	IDGD	
CS(=O)(=O)CC1(CC(=O)NNc2ccc(S(=O)(=O)Nc3nccs3)cc2)CC1	747943054	IVJBVIRVMJASNV-UHFFFAOYSA-N	444.560	1.602	50	20	IDGD	
CN(C)c1cccc(CNC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1	748467290	RKAGKHHHTGLLCY-UHFFFAOYSA-N	445.545	1.681	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)N[C@@H](C)c1cc2c(cc1Br)OCCO2	748616581	CZJBUYZVMSLGCE-WDEREUQCSA-N	446.298	1.663	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)NCc1cc(OC)c(OC)cc1Br	748628641	XLEKZGBOPWCZFQ-JTQLQIEISA-N	434.287	1.348	50	20	IDGD	
COCCOCC(=O)NC1CCC(C(=O)NNC(=O)c2ccc3ccccc3c2)CC1	748715285	QVOJWAJDVJJVJR-UHFFFAOYSA-N	427.501	1.939	50	20	IDGD	
CS(=O)(=O)N1CCC(CNC(=O)NNC(=O)c2ccc(Br)s2)CC1	748827509	MKIHLXVLCVEPPG-UHFFFAOYSA-N	439.357	1.126	50	20	IDGD	
CC(C)(CNC(=O)NNC(=O)c1ccc(Br)cc1Cl)S(C)(=O)=O	748964933	CZQDJEXFMMHDMT-UHFFFAOYSA-N	426.720	1.870	50	20	IDGD	
C[C@]1(NNC(=O)NCc2cccc(Cn3cnc4ccccc43)c2)CCS(=O)(=O)C1	749220118	IXPPWDMDSNPRTJ-NRFANRHFSA-N	427.530	1.966	50	20	IDGD	
O=C(NCCCCN1CCN(c2ncccn2)CC1)NNC(=O)c1cc2ccccc2o1	749568217	XJRUIWYKIGDYIM-UHFFFAOYSA-N	437.504	1.769	50	20	IDGD	
Cc1nnc2n1C[C@@H](C(=O)NNc1nc3ccccc3c(=O)n1CCCOC(C)C)CC2	750773626	GCVDTPKENLPBIA-INIZCTEOSA-N	439.520	1.817	50	20	IDGD	
CCOc1cc(C(=O)NNS(=O)(=O)c2c[nH]c(C(=O)O)c2)cc(OCC)c1OCC	750838381	WKBZELOEOALYNB-UHFFFAOYSA-N	441.462	1.532	50	20	IDGD	
CN1C(=O)N[C@@]2(CCC[C@H]2CNC(=O)NNC(=O)c2ccc(Br)s2)C1=O	752003226	RXIOZYAMCGSXJF-VXJOIVPMSA-N	444.311	1.175	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)Cc2ccc(OCc3ccccn3)cc2)C[C@@H](C)O1	752611390	ZGWCJGSTDYSCCH-HDICACEKSA-N	426.517	1.850	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cccc(Cl)c2)c(C)c([N+](=O)[O-])c1	753841321	QTHCRYSKJFWNMD-UHFFFAOYSA-N	434.792	1.743	50	20	IDGD	
Cc1sc2ccc(Cl)cc2c1S(=O)(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1	753982256	VXYGTIQHYWCLJY-SNVBAGLBSA-N	437.952	1.543	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N(CC)CC)cc1NC(=O)NNC(=O)c1ccncc1	755442478	RYXCRHHFKCUVFA-UHFFFAOYSA-N	435.506	1.977	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)Nc2cccc(-n3cnnn3)c2C)cc1	755444158	MIEMAWTUHQOJGQ-AWEZNQCLSA-N	425.449	1.990	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)Nc1ccc(S(=O)(=O)N2CCC[C@@H](C)C2)cc1	755447755	RFHKACXRGPVTHQ-CABCVRRESA-N	442.538	1.311	50	20	IDGD	
COC(=O)CNC(=O)c1ccc(NC(=O)NNC(=O)c2cc(-c3ccccc3)on2)cc1	755548205	POBGRDMJNHFZMD-UHFFFAOYSA-N	437.412	1.711	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)Nc2ccc(NC(=O)CN3CCOCC3)cc2)c(O)c1	755599637	MYUUNCVHMBAOSC-UHFFFAOYSA-N	427.461	1.438	50	20	IDGD	
COC(=O)CCNC(=O)c1ccc(NC(=O)NNC(=O)COc2ccccc2C#N)cc1	755603054	HSEXCKOGLPCNFT-UHFFFAOYSA-N	439.428	1.083	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2cc3c(cc2F)CCC(=O)N3)c1	755743510	SBJVRZBCRAITIQ-UHFFFAOYSA-N	449.464	1.427	50	20	IDGD	
Cc1nnnn1-c1cccc(NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c1	755757299	DDONNUDAXHRSPQ-UHFFFAOYSA-N	449.519	1.336	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)Nc2ccc(C)c(S(N)(=O)=O)c2)cc1	756637860	JVSPIHUWIBVBSB-ZDUSSCGKSA-N	434.474	1.465	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)Nc2cc(S(=O)(=O)N(C)C)ccc2F)c1	756681426	BBJRZEUAHWJAOB-UHFFFAOYSA-N	438.481	1.925	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(NC(=O)NNC(=O)Cc2ccc(Cl)cc2)cc1	756784050	KIKYQRSRRUJHLA-UHFFFAOYSA-N	440.909	1.660	50	20	IDGD	
CC(C)(C)OC(=O)NCC(C)(C)C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	756900071	UWSKGRVLBDHJND-UHFFFAOYSA-N	448.929	1.299	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)N[C@@H]2CCN(C(=O)CCc3ccccc3)C2)nc2ccccc21	757273216	JJEFYJVBNNNZQM-GOSISDBHSA-N	448.527	1.680	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccc(Cl)c(C(=O)NNc2ccc(C(N)=O)nn2)c1	757404804	DWOUSCNZNDNRDF-UHFFFAOYSA-N	426.886	1.063	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)c1cnn(CCO[C@@H]2CCCCO2)c1C	758138816	CROVNTKQAMSSQN-GOSISDBHSA-N	426.477	1.766	50	20	IDGD	
COc1ccc([C@@H](CNC(=O)NNC(=O)C(=O)Nc2ccccn2)N2CCCC2)cc1	758462684	XAPWNKFOZPQUCU-QGZVFWFLSA-N	426.477	1.196	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)cc2cccnc12)N[C@@H]1CCS(=O)(=O)C1	758676774	RDWHVBAGNILIRS-LLVKDONJSA-N	427.280	1.128	50	20	IDGD	
CN(NC(=O)CCCNC(=O)c1ccccc1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758782358	RLRLVXXXVXIEOY-UHFFFAOYSA-N	447.536	1.832	50	20	IDGD	
C=C1c2ccccc2C(=O)N1CC(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758785904	GXHLUQDDIGHDPT-UHFFFAOYSA-N	443.504	1.749	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1ccc(OCC(F)F)nc1	761205330	KIYRHINASUDARK-UHFFFAOYSA-N	427.433	1.402	50	20	IDGD	
O=C1COc2cc(NC(=O)C(=O)NNC(=O)c3ccccc3Br)ccc2N1	763482924	NZOIHRCERTVXRG-UHFFFAOYSA-N	433.218	1.180	50	20	IDGD	
Cn1cc(NC(=O)C(=O)NNC(=O)c2c[nH]c3ccccc23)cc(Br)c1=O	763535577	IFLDJKSLRJLAAA-UHFFFAOYSA-N	432.234	1.029	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)C(=O)Nc1ccc(=O)n(Cc2ccccc2)c1	763549380	ZBCBIMKEVZRIRA-UHFFFAOYSA-N	434.408	1.025	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)ccc1C(=O)N(C)C	763602241	XSVIAQRXXMQFRX-UHFFFAOYSA-N	434.456	1.487	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1cc(S(C)(=O)=O)ccc1Cl	763629479	LTYTYCRBMBKPIN-UHFFFAOYSA-N	449.876	1.099	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2cnc(Br)c(C)c2)c1	763649904	LVPYVOXSWKRTKJ-UHFFFAOYSA-N	435.278	1.934	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(C(=O)OC)ccc1Cl	763713662	NPTZVDIRAVDFHH-UHFFFAOYSA-N	433.848	1.854	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2cc(-c3ccccc3)nn2C(C)(C)C)n1	763886015	PUNAVDWHOMUIDS-UHFFFAOYSA-N	437.504	1.905	50	20	IDGD	
CCCCN(C)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1	763917237	RTDUURPTKVGCCN-UHFFFAOYSA-N	436.476	1.298	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccccc2C[S@](C)=O)ccc1OC(C)C	763922175	TXKYNJUXPLTJHO-HKBQPEDESA-N	447.513	1.761	50	20	IDGD	
COCCOc1ccccc1NC(=O)C(=O)NNC(=O)c1ccc(Br)s1	763942322	XWOREWZTCHCVHN-UHFFFAOYSA-N	442.291	1.936	50	20	IDGD	
Cc1ccc(Cn2nccc2NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)on2)o1	764003755	MVCPFOGIWGUOJB-UHFFFAOYSA-N	434.412	1.888	50	20	IDGD	
O=C(NNC(=O)c1ccc(F)cc1Br)C(=O)Nc1ccn(-c2ccncc2)n1	764083821	BLVRIBQSGAXFEZ-UHFFFAOYSA-N	447.224	1.569	50	20	IDGD	
O=C(NNC(=O)c1ccc(F)cc1Br)C(=O)Nc1ccc(-n2cccn2)nc1	764085584	MSZXYRWAAFBROP-UHFFFAOYSA-N	447.224	1.569	50	20	IDGD	
N#Cc1ccc(-n2ccc(NC(=O)C(=O)NNC(=O)CCc3ccco3)n2)c(Cl)c1	764168860	HNMRCFJFGGGHPL-UHFFFAOYSA-N	426.820	1.709	50	20	IDGD	
CCC(C)(C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)Cc2cc[nH]n2)cc1Cl	764286636	YXRXBDQCYGKPPJ-UHFFFAOYSA-N	434.884	1.310	50	20	IDGD	
COc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NNC(=O)C(C)(C)c1ccccc1	764313783	OKBMGVMIJKUXCY-UHFFFAOYSA-N	426.473	1.461	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)C(=O)N(CC1CC1)C2=O)c1ccccc1	764328363	DVPDEUFDLPFOSX-QGZVFWFLSA-N	448.479	1.972	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2ccn(CCC(C)C)n2)n[nH]1	764377426	PQHXUYIBMSNWOT-UHFFFAOYSA-N	439.476	1.728	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)NCc2cccc(N3CCCS3(=O)=O)c2)c1	765304323	JKDIMUNVIGOSDZ-UHFFFAOYSA-N	431.518	1.437	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)[C@H](C)NC(=O)c3cccs3)n[nH]2)cc1OC	765602174	WKRKHYBHUBGJGS-NSHDSACASA-N	443.485	1.735	50	20	IDGD	
O=C(NCC(F)(F)F)NNC(=O)c1cc(I)cc([N+](=O)[O-])c1	765795389	IGFWICXSFFGIHS-UHFFFAOYSA-N	432.096	1.706	50	20	IDGD	
COc1ccc(C(C)(C)C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1	767634921	WCRAJLLWGLKNRB-SFHVURJKSA-N	428.441	1.503	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)ccc1OC(C)C	768240377	VXOYKFIRRIUUKD-UHFFFAOYSA-N	449.485	1.286	50	20	IDGD	
COc1ccc(CN2C(=O)c3ccccc3C2=O)cc1C(=O)NNC(=O)c1cc(C)[nH]n1	768279550	YZPAENMWMATKCH-UHFFFAOYSA-N	433.424	1.598	50	20	IDGD	
COc1ccc(NNC(=O)CCNS(=O)(=O)c2ccc(F)c(F)c2)c([N+](=O)[O-])c1	768329174	PYQDKVVBQNGBHG-UHFFFAOYSA-N	430.389	1.693	50	20	IDGD	
CCCCn1cc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c(C)n1	770209348	SXNNBBBKPNYTPR-UHFFFAOYSA-N	433.534	1.851	50	20	IDGD	
CSCCNC(=S)NNC(=O)[C@H]1CCN(c2ccccc2Br)C1=O	770239120	GKNDHFGQUQNYHM-SNVBAGLBSA-N	431.381	1.660	50	20	IDGD	
CC(C)C(NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)C(C)C	770414717	FNKBGZCFWMTYNG-UHFFFAOYSA-N	426.539	1.332	50	20	IDGD	
Cc1cccc(F)c1NNC(=O)C(=O)Nc1ccc(OCCN2CCN(C)CC2)cc1	770819705	UMVDSOYRVQNEDN-UHFFFAOYSA-N	429.496	1.842	50	20	IDGD	
COc1ccc(C)cc1[C@@]1(C)NC(=O)N(CC(=O)NNC(=O)c2ccc(C#N)cc2)C1=O	771258638	XWWDBOXKQULLNT-JOCHJYFZSA-N	435.440	1.104	50	20	IDGD	
C[C@@H]1C[C@@H](CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)CCO1	771424802	AQCZSKOGMNXYTA-CVEARBPZSA-N	438.550	1.620	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1cccc(S(=O)(=O)N2CCCC[C@@H]2C)c1	771938864	MKVQYEASPPGIMG-KBPBESRZSA-N	425.507	1.352	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)c1ccc(F)c(S(=O)(=O)N(C)C)c1	773171194	HYEXCKWOIRULIC-NSHDSACASA-N	443.884	1.958	50	20	IDGD	
Cc1ccc(-n2nc(C)cc2NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)on2)nn1	773499154	KSUFPVKKZYAZGA-UHFFFAOYSA-N	446.427	1.334	50	20	IDGD	
CN(Cc1ccccc1)[C@@H](CNC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)C1CC1	773716240	JKDIWZMREMNFDY-FQEVSTJZSA-N	444.557	1.945	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NN=Cc2ccc3c(c2)CCC(=O)N3C)cc1	774336858	QNVUZKLBCOWYDA-UHFFFAOYSA-N	428.514	1.675	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(N2CCOCC2)c(NC(=O)NNC(=O)c2ccccc2)c1	775351152	CXHZLVOKLAVTNZ-UHFFFAOYSA-N	447.517	1.240	50	20	IDGD	
O=C(CCCc1ccccc1)NNC(=O)Nc1ccc(S(=O)(=O)N2CCOCC2)cn1	776060941	AQOMCFFXIRYEFC-UHFFFAOYSA-N	447.517	1.278	50	20	IDGD	
CC(=O)Nc1ccc(CC(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)cc1	776202205	RCZQMIUUSLTLIX-UHFFFAOYSA-N	433.509	1.823	50	20	IDGD	
C[C@@H]1OC(C)(C)N(C(=O)OC(C)(C)C)[C@@H]1C(=O)OCC(=O)NNC(=O)c1ccccc1	776477901	LGJGPUKWZDWZQM-BBRMVZONSA-N	435.477	1.751	50	20	IDGD	
C[C@@H]1Sc2ccc(C(=O)N3CCN(S(=O)(=O)CBr)CC3)cc2NC1=O	777777481	JMVNUKFTRZPXII-JTQLQIEISA-N	448.364	1.559	50	20	IDGD	
O=C1CCc2cc(NC(=O)C(=O)NNC(=O)c3cc4ccccc4cc3O)c(F)cc2N1	778706541	VKOIDUGODWBRDS-UHFFFAOYSA-N	436.399	1.969	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1cc(Cl)ncc1Cl	780928272	XTPFZPMBSMVCOB-UHFFFAOYSA-N	436.299	1.607	50	20	IDGD	
CC(C)NS(=O)(=O)c1cccc(C(=O)NNC(=O)CCNC(=O)OC(C)(C)C)c1	780970825	FSXFJIOOWFCWRL-UHFFFAOYSA-N	428.511	1.049	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2ccc(S(=O)(=O)N3CCCCCC3)cc2)nc(C)n1	783324902	RNNBOVAJLQSZRJ-UHFFFAOYSA-N	446.533	1.740	50	20	IDGD	
COC(=O)CNC(=O)Cc1ccc(NC(=O)C(=O)NNc2nccc3sccc23)cc1	783439500	LTNYTIHFPJJRHO-UHFFFAOYSA-N	441.469	1.210	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1ccc(OC(F)F)c(F)c1	784004257	CTXIYGAEDBIKGX-UHFFFAOYSA-N	430.364	1.005	50	20	IDGD	
Cc1cc2cc(NC(=O)C(=O)NNc3ccc(S(=O)(=O)NC4CC4)cc3)ccc2[nH]1	784210665	YZKNHMPGZKNKFW-UHFFFAOYSA-N	427.486	1.999	50	20	IDGD	
CC(=O)N(C)c1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)cc1	784212559	BOXCFYWYRIELPU-UHFFFAOYSA-N	445.501	1.192	50	20	IDGD	
Cc1c(NNC(=O)C(=O)Nc2ccc(N3C[C@@H](C)O[C@H](C)C3)nc2)cccc1[N+](=O)[O-]	784354138	IOQKNZMIROXSKG-CHWSQXEVSA-N	428.449	1.994	50	20	IDGD	
COCCn1ccc(C(=O)NNC(=O)[C@H]2Cc3ccccc3CN2Cc2ccccc2)n1	784377656	GVYPNENSPNTOBZ-JOCHJYFZSA-N	433.512	1.918	50	20	IDGD	
O=C(NNc1ncc(F)cn1)C(=O)Nc1ccc(C(=O)NCc2ccc(F)cc2)cc1	784955732	IYSFUQIOHUUCBO-UHFFFAOYSA-N	426.383	1.767	50	20	IDGD	
CN(C)c1nccc(NNC(=O)C(=O)Nc2cc(Br)ccc2-n2cccn2)n1	784971047	RDGSRLMFLFHWDU-UHFFFAOYSA-N	445.281	1.573	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)C(=O)Nc1cccc(NC(=O)c2ccoc2)c1	785059937	DWBYUWOAWZJSAX-UHFFFAOYSA-N	446.423	1.508	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCc2cccc3cc[nH]c23)cc1	786257805	AXFRKDPISPHUKM-UHFFFAOYSA-N	429.502	1.627	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)c3cc(N4CCNC(=O)C4)ccn3)n[nH]2)c1	787177961	JRBJAYQJZIECEB-UHFFFAOYSA-N	433.472	1.100	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(-c3ccsc3)nn2C)cc1OC	787544585	WAFFOIYOGYSGSI-UHFFFAOYSA-N	443.485	1.956	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)Nc2ccc(-c3cnn(C)c3)nn2)n[nH]1	788789551	NMLUSJSEGXUNGI-UHFFFAOYSA-N	433.432	1.742	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)N[C@H]1CCCN(c2ccc(Cl)cc2Cl)C1=O	788917285	UVCSPXHELSERCM-RISCZKNCSA-N	447.319	1.871	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cn(C)nc2-c2ccoc2)c1	789867582	SFXCMURYZXNCTE-UHFFFAOYSA-N	445.501	1.785	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)cc(-n2cccn2)c1	792352774	JVKPSTLJFIZYMP-CYBMUJFWSA-N	441.419	1.573	50	20	IDGD	
O=C(NNC(=O)[C@H]1[C@@H]2[C@@H]3[C@H]4[C@H]5C[C@@H]3[C@H]1[C@@H]5C[C@H]42)c1ccc(S(=O)(=O)N2CCCC2)cc1	792805102	BQKWNQWZBGBPBX-PIOCQINBSA-N	441.553	1.626	50	20	IDGD	
CN(C)N(C(=O)c1c[nH]c2c(OC(F)(F)F)cccc2c1=O)[C@H]1CCS(=O)(=O)C1	792853493	DYYJMCVXHQDQRR-JTQLQIEISA-N	433.408	1.533	50	20	IDGD	
CN(C)N(C(=O)[C@H]1CCN(c2ccc(Cl)c(Cl)c2)C1=O)[C@H]1CCS(=O)(=O)C1	792853969	HVUSJVFXJDFYPE-STQMWFEESA-N	434.345	1.839	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2cn(C)c3ccccc23)c(OC)c(C)c1OC	796998283	DLJQHAPRUYRNRT-UHFFFAOYSA-N	440.456	1.912	50	20	IDGD	
Cn1cc2c(n1)CCC[C@H]2C(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	798980697	XVTKVKDLZIOPDZ-QGZVFWFLSA-N	444.967	1.459	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2nc3cccnc3s2)c1	801102119	CIZZERPUFOLQMX-UHFFFAOYSA-N	433.515	1.797	50	20	IDGD	
O=C(N=c1cc[nH]cc1)NNC(=O)c1cc(S(=O)(=O)NC2CC2)c(Cl)cc1Cl	802031361	HFOBLKDCDNJNAN-UHFFFAOYSA-N	444.300	1.718	50	20	IDGD	
CS(=O)(=O)NC1CC(NC(=O)NNC(=O)COc2ccccc2Cc2ccccc2)C1	802421843	ZDEAOKUGKHRIKV-UHFFFAOYSA-N	446.529	1.067	50	20	IDGD	
Cc1ccc(Cc2ccccn2)cc1NC(=O)C(=O)NNC(=O)CNC(=O)c1ccco1	802571426	ZUVSBLGHAGNGAM-UHFFFAOYSA-N	435.440	1.090	50	20	IDGD	
O=C(NCc1cccnc1)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	804031228	WVLMAJJFIKLAEJ-UHFFFAOYSA-N	439.497	1.704	50	20	IDGD	
N#Cc1ccc(S(=O)(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)o1	808069472	WLLBJMGZRSAOPW-UHFFFAOYSA-N	449.452	1.476	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)CCc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])cc1	812733360	PFWWOYSLJXWDAL-UHFFFAOYSA-N	437.434	1.829	50	20	IDGD	
COC(=O)c1cn(-c2cccc(NC(=O)C(=O)NNc3cc(F)c(F)cc3F)c2)nn1	812985908	JKOXDZNVEAZMKN-UHFFFAOYSA-N	434.334	1.553	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)NNC(=O)[C@H]2CCc3nncn3C2)cc(C(=O)OCC)c1	814585564	SXXMYEHSHUQENO-LBPRGKRZSA-N	444.448	1.047	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NN=C(C)c1cc[nH]n1)N(S(C)(=O)=O)CC2	814759297	XYJXLSHRQDWVRV-INIZCTEOSA-N	435.506	1.216	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1ccnn1-c1ccccc1	815751465	AFPZUZHYEMWPBU-UHFFFAOYSA-N	428.474	1.204	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCO1)C(=O)Nc1cc(-c2nnc3n2CCCCC3)ccc1F	815778553	WXPFXFXOBMVCDI-OAHLLOKOSA-N	430.440	1.076	50	20	IDGD	
CCOC(=O)[C@@H](CC(=O)NNC(=O)[C@H](C)Oc1cccc(Br)c1)C(C)=O	816828548	IQZOWYJPJGSFLS-FZMZJTMJSA-N	429.267	1.522	50	20	IDGD	
CCCCN(CC(=O)NNC(=O)c1ccc(C)cc1)c1c(O)nc(=O)n(CC(C)C)c1N	841515329	ZCDAVIUEIQVJOP-UHFFFAOYSA-N	444.536	1.563	50	20	IDGD	
O=C(c1cccnc1N1CCN(Cc2cccc(Cl)c2)CC1)N1CC[C@H](B(O)O)C1	864232194	WZFWBLUJEXVSNJ-KRWDZBQOSA-N	428.729	1.746	50	20	IDGD	
Cn1cc(S(=O)(=O)NNC(=O)CCCOc2ccc(Cl)cc2Cl)cc1C(N)=O	912979311	GDQPRJGPVZOBGX-UHFFFAOYSA-N	449.316	1.600	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2cc(C(=O)NNc3ncccn3)ccc2Cl)C[C@H](C)O1	913044315	MIRPOJQELIFKAB-RYUDHWBXSA-N	425.898	1.685	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)NCc1ccccc1CN1CCCC1=O	913463152	POMMPRSPUOKDJD-UHFFFAOYSA-N	426.473	1.727	50	20	IDGD	
N#C/C(=C/c1cn(CCC(N)=O)nc1-c1cccc(Br)c1)C(=O)NCCO	914532840	QKPNAXKDOCYRHF-JYRVWZFOSA-N	432.278	1.203	50	20	IDGD	
CCOc1ccccc1C(=O)N1CCC[C@@H]1C(=O)NNC(=O)[C@@H]1COc2ccccc2O1	914774745	IOAYOMHWHQMTJM-UZLBHIALSA-N	439.468	1.677	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cccc(Cn3ccnc3)c2)c1	915657994	FWXDKWUNANUIIP-UHFFFAOYSA-N	427.486	1.257	50	20	IDGD	
CC(=O)Nc1ccc(O)c(C(C)=NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)c1	915945231	RYPYBSNGTCSGOX-UHFFFAOYSA-N	432.502	1.820	50	20	IDGD	
COc1cccc(C[C@@H](C(=O)NNC(=O)c2c(C)nc3ccccn23)n2nnnc2C)c1	916162067	DSAOWPPWNMYZFH-KRWDZBQOSA-N	434.460	1.191	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)NCCCN2C[C@H](C)O[C@@H](C)C2)c2ccccc2c1=O	916250034	UDYLXQDQMSEMMM-HOTGVXAUSA-N	444.536	1.421	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)SC1=NS(=O)(=O)CCN12)c1ccc(Cl)nc1	917253403	JFOOMBNOGRJOKE-UHFFFAOYSA-N	437.890	1.421	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccncc2)on1)c1cccc(S(=O)(=O)N2CCCC2)c1	917528351	BPMXDYKTNWKOIZ-UHFFFAOYSA-N	441.469	1.596	50	20	IDGD	
O=C(NCCOC1CCCCC1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	918136374	ZLJPTORURBUYGL-UHFFFAOYSA-N	438.550	1.764	50	20	IDGD	
Cc1nc(-c2cccnc2)nc(O)c1CC(=O)NNC(=O)[C@@H](C)Oc1ccccc1F	918203841	LDZFMHHMPSLDMZ-CYBMUJFWSA-N	425.420	1.849	50	20	IDGD	
CCCS(=O)(=O)N1CCCC[C@H]1C(=O)NNC(=O)c1cc(OC)c(OC)c(OC)c1	918543781	PYMCLDWQBPDZAC-AWEZNQCLSA-N	443.522	1.068	50	20	IDGD	
CCC(=O)N1CCCC[C@H]1C(=O)NNC(=O)c1cccc(S(=O)(=O)N(CC)CC)c1	918688683	AMWLJGFVCPVUSV-KRWDZBQOSA-N	438.550	1.269	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)CN2C(=O)N[C@@]3(C[C@H](C)CC(C)(C)C3)C2=O)c1O	919756802	MCLKRQVYOIHREX-XUSGNXJCSA-N	432.477	1.299	50	20	IDGD	
CCCN1CC[C@H](CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(CC)CC)c2)C1	919792813	INUSVSFFGMUZCM-MRXNPFEDSA-N	439.582	1.393	50	20	IDGD	
C[C@H](Cc1ccc(O)cc1)NC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	919911026	FWGLYUGOKOJPHJ-OAHLLOKOSA-N	446.529	1.752	50	20	IDGD	
CCn1c(NNC(=O)/C(=C/c2ccc(F)cc2)n2nnnc2C)nc2ccccc2c1=O	920444223	BTSSDAAQOXOQIK-PDGQHHTCSA-N	434.435	1.992	50	20	IDGD	
CCCNC(=O)NNC(=O)c1cc(S(=O)(=O)N2CCCC2)ccc1Br	921040854	JQFXZWXNCAMAFZ-UHFFFAOYSA-N	433.328	1.588	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)NCCS(=O)(=O)C(C)(C)C)CC1	1252356909	VVFORDPBNFZPBM-UHFFFAOYSA-N	434.559	1.177	50	20	IDGD	
CC(C)CS(=O)(=O)N1CCC(NC(=O)NNC(=O)c2cncn2-c2ccccc2)CC1	1319877256	LKKGTCAZBJBZQS-UHFFFAOYSA-N	448.549	1.267	50	20	IDGD	
Nc1cnnc(NNC(=O)[C@@H]2CC(=O)N(CCOc3ccccc3Cl)C2)c1Cl	1335412732	MPSHVZAHOLMKHH-SNVBAGLBSA-N	425.276	1.736	50	20	IDGD	
CC1=CC[C@@H](C(=O)N2CC[C@]3(CN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)CCO3)C2)CC1	1778103080	XYZJIBOXALUOGH-YRBPKABKSA-N	441.532	1.697	50	20	IDGD	
O=C(c1ccc2ncncc2c1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1778603754	FXMVXTDMZWDEBV-CRAIPNDOSA-N	437.269	1.764	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H]1CCc3nc[nH]c3C1)C2	1779545614	CGGJMYHJFMTYKU-ZWDAVXSWSA-N	448.640	1.880	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2)c1cc2ncsc2[nH]1	1779569535	KJJGTOXWXPSZIO-PMUMKWKESA-N	426.926	1.352	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(C)n(C(F)F)n2)C1	1780162704	MCOBVKJHPONZPY-ZXYWRSMDSA-N	448.898	1.968	50	20	IDGD	
C[C@H](Oc1cccnc1)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@](C)(Cl)CCl)C2)C1	1781233216	KDJZIZCAELSIKI-JVPBZIDWSA-N	430.332	1.915	50	20	IDGD	
O=C(c1cccc2c1OCC2)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781330208	UELIBQFORHHXHD-CRAIPNDOSA-N	427.270	1.756	50	20	IDGD	
O=C(c1cccc(Br)c1F)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1781559541	NVZMHIFNXICDRY-DYVFJYSZSA-N	449.704	1.631	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)Cn1ccnc1)C2	1782002723	UYZUFDDNCLVGOH-YIOZNXECSA-N	441.370	1.817	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cn3ncccc3n1)C2)C(Cl)Cl	1782217442	ITPJZBGWECQZNM-FZKQIMNGSA-N	426.304	1.661	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(F)nc3F)[C@H]2C1	1783383657	HABSQYXGCCOCTM-QEJZJMRPSA-N	427.524	1.805	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(C(C)(C)C)n[nH]3)CCO2)C1	1783536729	IPJQRYSBKCSJGL-SGTLLEGYSA-N	427.343	1.934	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](C)Br)C2)C1	1783539716	MWIUEFKPAWSFGI-NXEZDXNNSA-N	443.338	1.355	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](C)Br)C2)C1	1783539721	MWIUEFKPAWSFGI-ZTENYAIWSA-N	443.338	1.355	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)CCOCCOCCOC)C2)C1	1783661553	KCFGYLMCHVWHOM-YLJYHZDGSA-N	434.961	1.294	50	20	IDGD	
CC(=O)N[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CO[Si](C)(C)C)C[C@@H]21)C(C)(C)C	1784313769	FDPRAUTWWKBINP-LSTDLKDCSA-N	441.645	1.368	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4n(n3)CCCC4)C[C@@H]21	1786406855	KOENDHKANLDEKA-QRTARXTBSA-N	439.354	1.598	50	20	IDGD	
Cn1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]3C2)c(C(F)(F)F)n1	1787447943	MKTZLWIPHJRAGN-LKAMGYQZSA-N	426.798	1.567	50	20	IDGD	
Cn1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CO[Si](C)(C)C)C[C@@H]32)c(C(F)F)n1	1787736479	GVCCOUSVKFAIEW-YDHLFZDLSA-N	444.555	1.803	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)c3ncccc3F)CCC2)cc1)c1ccc(B(O)O)cc1	1788142122	BZXPKDWHSZLXRN-UHFFFAOYSA-N	433.248	1.962	50	20	IDGD	
O=C(CCN1Cc2ccccc2C1=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Cl)C[C@@H]21	1788148670	OZSFKRIPJYRJGO-PCODUJHASA-N	437.899	1.547	50	20	IDGD	
Cc1cc(/C=C/C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)Br)C[C@@H]32)no1	1788674415	SRBNHGVFQZOJTA-HGHKQEFQSA-N	426.311	1.759	50	20	IDGD	
C[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)n1ccccc1=O	1788749965	RNRWSGIQOCXSJK-SMSYFYOWSA-N	444.301	1.080	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21)c1nc(O)n2c1CCCC2	1788794282	XHQXQDJNGXAQLK-GVXVVHGQSA-N	431.320	1.322	50	20	IDGD	
C[C@H](Cc1ccncc1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]2C1	1789925062	MEVKICMDYUGNQT-YYESSZKYSA-N	442.329	1.930	50	20	IDGD	
COCc1oncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)Br)[C@H]2C1	1791057120	CVNDYFKPPNSVGU-IMIFBBOLSA-N	430.299	1.198	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)Cc3ccccc3)C[C@@H]21	1791063592	MFHDHKCRQVRCNX-XNJHUCFUSA-N	439.350	1.353	50	20	IDGD	
C[C@H](Br)C(=O)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1	1791434541	STQPLHIMJHLNRF-ZDUSSCGKSA-N	445.122	1.898	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ncc(Cl)cn1)C2	1792870775	UHEIMCFUYJIDBC-KQXIARHKSA-N	431.718	1.364	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc(C(F)(F)F)cc1)C2)[C@H](O)CCl	1792976034	KAPQFIFDJVUUKJ-IARIHHJXSA-N	434.842	1.437	50	20	IDGD	
Cc1cc(NC(=O)CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](C)CBr)no1	1792988443	ZTYDGEVWPGZSCI-RUZUBIRVSA-N	441.326	1.981	50	20	IDGD	
Cc1cncc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Br)C3)c1	1794073816	LUGBMGREWXEBAL-YALNPMBYSA-N	428.302	1.603	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cn1ccnn1	1796333227	BRKPQTCVKLFHSK-FZBFXSHXSA-N	426.427	1.802	50	20	IDGD	
C=C1C[C@@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Cl)N(C(=O)OC(C)(C)C)C1	1796369373	XECZURNAZOSAOJ-XFIYOXNOSA-N	445.919	1.676	50	20	IDGD	
CC(C)(C)OC(=O)N1CC2(C[C@@H]2C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Cl)C1	1796370093	HFPPOAQAYIXRRA-KHMAMNHCSA-N	445.919	1.367	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(CS(C)(=O)=O)nc1	1796538955	ATQICWZZZQBWDM-YVSFHVDLSA-N	427.954	1.895	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CC[C@H]1CCOC1)C2	1796892960	BTDLHTPQZFIKPD-DXFUESDRSA-N	429.521	1.575	50	20	IDGD	
CCC1(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C3)CCC1	1797283203	IEHPODHOBVRVGD-XLYDMXJNSA-N	429.521	1.290	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2n(n1)CCC2	1797510066	SUWAAHRVRVQOIY-JFILPPLUSA-N	425.327	1.064	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc3c1OCCO3)C2	1797955979	SLXIIRIZRMZFSX-CCWDJLKJSA-N	434.565	1.513	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1CCN(S(C)(=O)=O)CC1)C2	1798626315	WRQWCSQQDSXOOZ-BJWYYQGGSA-N	445.658	1.148	50	20	IDGD	
CCSc1cccnc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCC(=O)NN(C)C)C2	1799512568	XZVRQYOOMCDGSQ-MUJYYYPQSA-N	433.578	1.818	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cnc[nH]1)C2	1800333131	OIPZAMZKAWSVCM-OACMFWKTSA-N	441.438	1.427	50	20	IDGD	
CCN(C)[C@@H](C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C#N)=C/c1ccc(F)cc1F	1800334668	ROFKANYJEODBAT-XVOKVJDBSA-N	446.498	1.802	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccn(C(C)C)n1)C2	1800642652	UTXZMAVDJJUEBW-FQLMCAECSA-N	427.343	1.841	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H]2C[C@@]21C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2	1800772876	QIRBMFFDFAUQKP-QUCNZTJFSA-N	445.919	1.510	50	20	IDGD	
C[C@@H](Sc1ccccn1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2	1801318141	FOAKQAIQSKFKQK-AMVBZWJASA-N	446.342	1.842	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccc(O)cn1	1801463224	GDLFOMLWWWRERY-RBNVPPIJSA-N	426.311	1.093	50	20	IDGD	
COc1cccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Br)C3)c1C	1801650794	GCQNLRJWFAZWIX-VZAMPYOESA-N	429.286	1.897	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cc(Cl)cnc2O)[C@H]1c1cccnc1)[C@H](O)CCl	1803138120	XIDHSCZLDGKHCR-MAZHCROVSA-N	439.299	1.755	50	20	IDGD	
O=C(/C=C/C(=O)N1CCC2(CCCN(C(=O)[C@H](O)CCl)C2)CC1)NCc1ccco1	1805522829	MEUTVHFKRWTCID-LAQIPUCWSA-N	437.924	1.283	50	20	IDGD	
CC(C)[C@H](S)C(=O)N1CCCC2(CCN(C(=O)c3cnccc3C(=O)NN)CC2)C1	1806062703	DWJQFGTZYCUTNW-KRWDZBQOSA-N	433.578	1.484	50	20	IDGD	
O=C(CCBr)NC[C@@H]1CCN(C(=O)[C@@H]2CCNC(=O)C2)[C@H]1c1cccnc1	1806346248	DACLXLKRMYTHFQ-XUWXXGDYSA-N	437.338	1.399	50	20	IDGD	
Cc1ccoc1C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1807375835	QFUUNYPINXQDOJ-ICSRJNTNSA-N	433.273	1.296	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@@H](CNC(=O)C[C@@](C)(O)CC(=O)O)[C@H]1c1cccnc1	1813064580	ZNBCNZGGCSDXIN-RRMPHLOHSA-N	439.940	1.968	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)Cc2ccc3c(c2)OCO3)[nH]n1)[C@H](O)CCl	1814868582	ALERXDZCJPKDIK-HUUCEWRRSA-N	434.880	1.973	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2nn[nH]c2C(F)(F)F)[nH]n1)[C@H](O)CCl	1814873485	OMKKEOKZHAXAIL-RKDXNWHRSA-N	435.794	1.452	50	20	IDGD	
Cc1ccc(CC(=O)Nc2cc([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)cn1	1815979212	PDRRNJKDXPPODJ-SFHVURJKSA-N	441.536	1.721	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCBr)n[nH]1	1816782575	VGJZHBMAOXICLF-YPMHNXCESA-N	426.315	1.878	50	20	IDGD	
O=C(CCNC(=O)c1ccc[nH]1)N[C@H]1CCc2nc(NC(=O)[C@H](F)Cl)sc2C1	1817116499	BLVAEQKABGIBRS-XPTSAGLGSA-N	427.889	1.738	50	20	IDGD	
Cn1ncc2cc(C(=O)Nc3nc4c(s3)C[C@H](NC(=O)[C@@H](O)CCl)CC4)ccc21	1818544024	RVVRBUXJDNMUCL-DOMZBBRYSA-N	433.921	1.855	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)CCN3CCOC3=O)sc2C1	1818696913	BBRZCRCTKQXQAQ-NXEZZACHSA-N	445.339	1.681	50	20	IDGD	
Cc1ccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cnccc3C(=O)NN)n[nH]2)o1	1819401668	NDUQTIPXHOIMAB-MRXNPFEDSA-N	437.460	1.929	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H]1CCCS1)CC2	1819801051	GEYHGKHYNRSEOP-IINYFYTJSA-N	446.558	1.263	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(Cl)ncn2)n[nH]1	1819981304	YXXKLJKLIZMONI-AWEZNQCLSA-N	448.915	1.532	50	20	IDGD	
O=C(CCBr)N[C@H]1CCc2nc(NC(=O)c3n[nH]cc3[N+](=O)[O-])sc2C1	1820295599	LFBXPJNXPQNWRF-ZETCQYMHSA-N	443.283	1.785	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1)[C@H]1CC[C@@H]2CCC(=O)N2C1	1820758037	VXRSSSAMTXKJEY-LQKXBSAESA-N	437.928	1.403	50	20	IDGD	
Cc1ncsc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1	1825990800	WKAXCURDXAXJLS-IBGZPJMESA-N	441.362	1.678	50	20	IDGD	
O=C(C1CCOCC1)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827051212	PXRANQOLFMSOSE-OAQYLSRUSA-N	428.338	1.026	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)Cc2ccccn2)CC1	1827225145	JMNVNFZKBYGYJO-FQEVSTJZSA-N	429.565	1.617	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC([C@H]2CCCCN2C(=O)CCc2nc(N)n[nH]2)CC1	1828806953	UAVLCNBEISXCBY-GXTWGEPZSA-N	441.374	1.723	50	20	IDGD	
C[C@H](NC(=O)c1cnccn1)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@H](F)Cl)CC1	1829026160	KPTXNWIPXWYBTQ-JQFCIGGWSA-N	439.919	1.749	50	20	IDGD	
COC[C@H](NC(C)=O)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H](C)Br)CC1	1829119503	XNAFYYVWECBQOK-RRQGHBQHSA-N	446.386	1.541	50	20	IDGD	
N=C1NCCN1CC(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H](F)Br)CC1	1830375704	WLXQQLWWJAQTPY-UKRRQHHQSA-N	432.338	1.137	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cscn3)C2)C1	1830538996	YDFUULFOCIUEHN-DYVFJYSZSA-N	446.367	1.173	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H]2C[C@H](O)CN2)CC1	1831552135	MOQVQUZTEAUATE-YVSFHVDLSA-N	430.387	1.502	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnn4ncccc34)C2)C1	1831645383	AMELPKINLJDOHY-OXQOHEQNSA-N	435.912	1.207	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnn(C)c3Cl)C2)C1	1831654978	PFSVULWDVTVGLO-RDTXWAMCSA-N	433.336	1.551	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)Cn2cc([N+](=O)[O-])cn2)CC1	1831829010	XBDSUKBFVCPASO-IAGOWNOFSA-N	441.916	1.665	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3n[nH]c(C4CC4)c3F)CC2)CC1)[C@@H](O)CCl	1833308254	MJSYVOKXORCZGH-HNNXBMFYSA-N	441.935	1.211	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cccc4[nH]ncc34)CC2)CC1)[C@@H](O)CCl	1833310855	VYLNORUYHOEZNQ-IBGZPJMESA-N	433.940	1.348	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnc(OC)c(F)c3)CCO2)C1	1833480471	JUBZSOKNZRBTNJ-QRWLVFNGSA-N	443.903	1.707	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3nccs3)CCO2)C1	1834437681	HONJKWPWLNLCJX-BLLLJJGKSA-N	432.340	1.387	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)NC1CCN(C2CCN(C(=O)C(C)(C)CCl)CC2)CC1	1835052539	DKXYPRJQUKQVAI-INIZCTEOSA-N	429.993	1.270	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)CC(C)C)CC2)CC1	1835118333	QPDTWHAIPPJBLS-YZSQISJMSA-N	444.580	1.738	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cnn4ccncc34)CC2)CC1	1835406190	IQCGFHZLNYURCY-GOSISDBHSA-N	448.955	1.168	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@@H]3Cc4ccccc4O3)CC2)CC1	1835478657	CJJUZAYYLGHOCV-FPOVZHCZSA-N	449.979	1.816	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)CCc3nc(N)n[nH]3)CC2)CC1	1835665282	OWODRJXNWQDACB-INIZCTEOSA-N	439.992	1.299	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)Cc1ccc(F)cn1)CCO2	1836033824	HWJDQMYDAOXOTN-FQEVSTJZSA-N	439.560	1.071	50	20	IDGD	
Cc1noc(N)c1C(=O)N1CCC(N2CCC(NC(=O)[C@](C)(Cl)CCl)CC2)CC1	1836398664	QTKLGDOMYZSYTD-LJQANCHMSA-N	446.379	1.987	50	20	IDGD	
COc1ccc(C(=O)N2CCOC[C@@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)nc1	1837713331	XJFIWVFZPKJRLD-HXUWFJFHSA-N	437.569	1.012	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(O)cc3F)C2)C1	1837714803	OULNBSWVLQZXFX-FQEVSTJZSA-N	440.544	1.453	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(Cl)ccn3)CCO2)C1	1837867292	MODPYHALGCVXML-SJCJKPOMSA-N	446.729	1.588	50	20	IDGD	
CCc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](Br)CC)C3)C2)no1	1838129554	VDRFBDRUIIXBNX-KDOFPFPSSA-N	444.326	1.481	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)c(C)n1C	1838380263	KDPWIMCEUHJWAL-OAQYLSRUSA-N	425.957	1.977	50	20	IDGD	
Cc1nc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)sc1C	1838412118	VGGVYLFZWXRQFY-DIFFPNOSSA-N	446.367	1.613	50	20	IDGD	
CCCC(=O)N[C@@H](C)C(=O)N1CCC(OC2CCN(C(=O)[C@H](Cl)COC)CC2)CC1	1838425946	JWVQKKLRNXGWCZ-MAUKXSAKSA-N	445.988	1.544	50	20	IDGD	
O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(F)c1F)CCO2	1838997964	VQBMMMMNILKQNF-SFHVURJKSA-N	447.276	1.820	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3coc([Si](C)(C)C)c3)C2)C1	1839145613	NNECOKQGLBRAQJ-JXFKEZNVSA-N	443.016	1.912	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnn4c3CCC4)CCO2)C1	1839532951	KDYHYHPOAWVFLO-OALUTQOASA-N	445.347	1.136	50	20	IDGD	
CCc1cnc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)s1	1840033488	HHNBAQSALRZORB-SJCJKPOMSA-N	446.367	1.559	50	20	IDGD	
O=C(CS[C@@H]1CCCCO1)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840188591	RYQPWOXXQJUAMS-PBHICJAKSA-N	441.377	1.506	50	20	IDGD	
COc1cccc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)c1C	1840190949	XBNOBQDRJBCGOP-FQEVSTJZSA-N	445.343	1.806	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3cc(C)cc(F)c3)CCO2)C1	1840241689	RBUAOYKAPHLSRG-RXVVDRJESA-N	442.915	1.387	50	20	IDGD	
Cc1cnn([C@H](C)C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)c1	1840406304	SQLQHAXKZHCTEH-MNEFBYGVSA-N	447.363	1.445	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)Cc2c(F)cccc2Cl)C1	1841206076	FWHWUSFUINJFNP-UHFFFAOYSA-N	430.672	1.219	50	20	IDGD	
CC(C)(C)OC(=O)N1CC=C(C(=O)N2CC3(CCCN3C(=O)[C@H](O)CCl)C2)CC1	1841354743	SKZQTZJIAIFMRF-OAHLLOKOSA-N	427.929	1.357	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)[C@@H]2C[C@H]2c2ccc(F)c(F)c2)C1	1841397396	LVEHXNAZZOKIPS-ZWKOTPCHSA-N	440.255	1.265	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@]1(O)CCN(C(=O)OC(C)(C)C)C1)C2	1841670636	JIUFNWHTKRJELI-QVKFZJNVSA-N	443.972	1.969	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)c2cnccc2C(F)(F)F)C1	1842427370	VDBOXHIRQSATKW-UHFFFAOYSA-N	427.427	1.290	50	20	IDGD	
CCn1nc(C)cc1C(=O)N1CCCC12CN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2	1843246785	DRUDHTZDGFSGOY-HZHRSRAPSA-N	425.493	1.162	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1cccc3c1cnn3C)C2	1843416064	UZARRVGRPYQHNF-CVKSISIWSA-N	447.499	1.524	50	20	IDGD	
Cc1nc2cccc(C(=O)N3CCCC34CN(C(=O)c3cccc(B(O)O)c3)C4)c2s1	1843668006	PTMDMBZJTGJPSD-UHFFFAOYSA-N	435.314	1.415	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)[C@H](O)c1ccco1)C2	1844692006	XTJLMCDAADTERE-GOSISDBHSA-N	443.412	1.664	50	20	IDGD	
Cn1c(=O)n(CC(=O)N2CC3(CCCN3C(=O)[C@@H](F)Br)C2)c2ccccc21	1845218062	KWILOZLURWFCNG-OAHLLOKOSA-N	439.285	1.234	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CNC(=O)OC(C)(C)C	1847494367	HFAZFXBFTHKXPO-XUXIUFHCSA-N	448.358	1.105	50	20	IDGD	
CC(C)(C)OC(=O)N1CC2(CC(C(=O)N3CC[C@H]4[C@@H]3CCN4C(=O)[C@@H](O)CCl)C2)C1	1847564628	YHVCJBHDQHXGEB-JYJNAYRXSA-N	441.956	1.435	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cc(Cl)ccc2O)cc1S(=O)(=O)NC(C)C	10627286	TYQDNKODGQAMFD-UHFFFAOYSA-N	441.893	1.816	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)c2ccc(S(N)(=O)=O)c(Cl)c2)cc1OC	725907505	KUCXXTWHKHKCBD-UHFFFAOYSA-N	427.866	1.470	50	20	IDGD	
CC1(C(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)CCOCC1	726765346	JCBOQNWWDKENFG-UHFFFAOYSA-N	431.514	1.743	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)NCc2cccc(CS(N)(=O)=O)c2)c1C	727109661	GDVHNCOFMNQRNS-RGVLZGJSSA-N	430.530	1.763	50	20	IDGD	
CN(C)N(C(=O)CCNC(=O)NC12CC3CC(CC(C3)C1)C2)[C@H]1CCS(=O)(=O)C1	728179564	MDICXJDAHPVKJO-FAKMSMKASA-N	426.583	1.137	50	20	IDGD	
Cc1ccc(OCC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)cc1C	728213041	BZZOGZZEVKCRGV-UHFFFAOYSA-N	432.546	1.762	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(Cl)c(S(=O)(=O)NNC(=O)c2cccn2C)c1	728260146	BYBVTGZBUGNNEQ-UHFFFAOYSA-N	448.954	1.332	50	20	IDGD	
CSCC[C@H](NC(=O)c1ccc([N+](=O)[O-])o1)C(=O)NNC(=O)c1cccc(C#N)c1	728871255	SWPLTMCILUQKAV-ZDUSSCGKSA-N	431.430	1.372	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)[C@@H](CC)N=c2nn[nH]n2-c2ccccc2)cc1OC	729281969	IAOZXMSEGUOAHY-MRXNPFEDSA-N	439.476	1.143	50	20	IDGD	
CN(C)CCCCC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	729282941	AUQTWTYULASJMZ-UHFFFAOYSA-N	432.546	1.658	50	20	IDGD	
C[C@@H]1CC(C)(C)C[C@]2(C1)NC(=O)N(CC(=O)NNC(=O)Cn1ccc3ccccc31)C2=O	729450438	VFRZQPJKQDAAFC-CMJOXMDJSA-N	439.516	1.926	50	20	IDGD	
Cc1nc(-c2ncccn2)nc(O)c1CC(=O)NNC(=O)c1ccc(Br)s1	729512056	BZAZSPJPLOSUHZ-UHFFFAOYSA-N	449.290	1.775	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCN(c2ccc3c(c2)OCCO3)C1=O)c1cc(-c2ccccc2)[nH]n1	730584894	GXAZCGDUYVLSAP-MRXNPFEDSA-N	447.451	1.662	50	20	IDGD	
O=C(NNc1nc(-c2cccnc2)no1)[C@@H]1CCCN(S(=O)(=O)Cc2ccccc2)C1	730588939	MSVQVJNDEUHTIK-QGZVFWFLSA-N	442.501	1.817	50	20	IDGD	
CS(=O)(=O)c1ccc(Br)c(C(=O)NNC(=O)COc2ccccc2O)c1	730779232	YNBBFZGIZHJJOV-UHFFFAOYSA-N	443.275	1.398	50	20	IDGD	
Cc1c(C(=O)NNC(=O)COc2ccccc2O)nnn1-c1cccc(Br)c1	730782446	OFLIXALLDUPOKL-UHFFFAOYSA-N	446.261	1.884	50	20	IDGD	
Cn1nc(Br)c2c(=O)n(CC(=O)NNC(=O)C(C)(C)c3ccccc3)cnc21	731173767	WWYGQRSGLYQNOI-UHFFFAOYSA-N	447.293	1.018	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2ccc(C(=O)NNC(=O)Cc3ccccc3F)cc2)C[C@H](C)O1	731328721	DGKXNBIEHPOPRP-GJZGRUSLSA-N	449.504	1.627	50	20	IDGD	
CSCC[C@H](NC(=O)c1ccc([N+](=O)[O-])o1)C(=O)NNC(=O)Cc1ccccc1F	731345144	BJFARUWONVSLRR-ZDUSSCGKSA-N	438.437	1.569	50	20	IDGD	
COc1ncnc(OC)c1C(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1	732064982	MDSMZUMVEVFULH-LJQANCHMSA-N	447.495	1.882	50	20	IDGD	
O=C(COC(=O)Cc1coc(-c2cccs2)n1)NNC(=O)c1cccc([N+](=O)[O-])c1	732342058	RGEHLDLQEAPBLR-UHFFFAOYSA-N	430.398	1.858	50	20	IDGD	
CC(C)(C)OC(=O)NCCOCC(=O)NNC(=O)c1cc(F)ccc1Br	732553724	JDQYUBJGKKGXGP-UHFFFAOYSA-N	434.262	1.891	50	20	IDGD	
O=C(NCC1CCN(S(=O)(=O)C(F)(F)F)CC1)NNc1cccc([N+](=O)[O-])c1	732702947	FKGCASNQXVSBSS-UHFFFAOYSA-N	425.389	1.783	50	20	IDGD	
CC(C)(C)OC(=O)NCc1nc(C(=O)NNC(=O)c2nnc(O)c3ccccc23)cs1	732750089	IOVOUQZUPBXYPW-UHFFFAOYSA-N	444.473	1.891	50	20	IDGD	
CC(C)(C)[C@H]1CCc2sc(C(=O)NNC(=O)Cn3ncn4nccc4c3=O)cc2C1	732750973	FHIAMLLFXPOEPR-ZDUSSCGKSA-N	428.518	1.565	50	20	IDGD	
O=C(O)COc1ccc(S(=O)(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1F	733123027	NLXHUCAQWIHJKD-UHFFFAOYSA-N	434.405	1.098	50	20	IDGD	
CCNS(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c1	733171116	IPRDRYHMFYCNMG-UHFFFAOYSA-N	431.449	1.384	50	20	IDGD	
C[C@@H]([C@H](C)S(C)(=O)=O)N(C)C(=O)CCC(=O)C(C#N)=C1N(C)c2ccccc2N1C	733277141	YAOGNSQNCGDSEA-GJZGRUSLSA-N	432.546	1.937	50	20	IDGD	
C[C@@H]1C[C@@H](C)CN(S(=O)(=O)NNC(=O)c2ccc(CSc3nncn3C)cc2)C1	733876322	ITMRZOAOWUTMKN-ZIAGYGMSSA-N	438.579	1.565	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)[C@@H]1CC(=O)N(c2ccc(F)cc2F)C1	734240510	PCQOUTWMFPBFMD-LLVKDONJSA-N	441.435	1.173	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)N[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	734685594	UOPFPEBVWQEYNP-LJQANCHMSA-N	440.500	1.768	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(Oc2ccccc2Cl)cc1)[C@@H]1CCS(=O)(=O)C1	734741568	LBAKZWJEZVEFQK-GFCCVEGCSA-N	444.918	1.877	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)CNC(=O)CCC2CCCC2)CC1	734821074	FLRMNHNHRIUFBR-UHFFFAOYSA-N	439.557	1.803	50	20	IDGD	
COc1ccc(S(=O)(=O)C[C@@H](C)C(=O)NNC(=O)Cc2c[nH]c3ccccc23)cc1	735028736	NXSNRDYLLRFEDM-CQSZACIVSA-N	429.498	1.976	50	20	IDGD	
CN(C(=O)CN1CCN(C(=O)NNC(=O)COCc2ccccc2)CC1)C1CCCCC1	738494965	BFBLBOFNDNWCPB-UHFFFAOYSA-N	445.564	1.353	50	20	IDGD	
CCOC(=O)c1ccc(N2CCN(C(=O)NNC(=O)COCc3ccccc3)CC2)nc1	738496960	HHYJGBFKYIEONZ-UHFFFAOYSA-N	441.488	1.338	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2ccc3c(c2)NC(=O)CCN3C)c2ccccc2c1=O	742242284	UNZYCDDYZGMZFF-UHFFFAOYSA-N	448.483	1.660	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@H](C)C(=O)NNC(=O)CN1C(=O)[C@H]2[C@H](C1=O)[C@H]1CC[C@H]2O1	742477023	CJRGWMCQLVEEBC-TXNBRISYSA-N	449.891	1.034	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)CN1C(=O)[C@H]2[C@H](C1=O)[C@H]1CC[C@H]2O1	742481270	RCCZNGFGNIAHDQ-RRCSTGOVSA-N	440.481	1.042	50	20	IDGD	
C=CCNS(=O)(=O)c1cccc(C(=O)NNC(=O)c2cccc(Br)c2)c1	742770103	ZFTNCCYVGONUIZ-UHFFFAOYSA-N	438.303	1.988	50	20	IDGD	
Cc1cccc2oc(CCNC(=O)NNC(=O)c3csc(N4CCOCC4)n3)nc12	743509438	CLEAJYRRTGMOBI-UHFFFAOYSA-N	430.490	1.616	50	20	IDGD	
CN(CC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)C[C@@H]1CCN(Cc2ccccc2)C1	744425988	NKAVAIQVDHNCDL-SFHVURJKSA-N	425.489	1.810	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(Cl)c(N3CCCC3=O)c2)cc1	744589576	ICNMBPWYCKOYSH-UHFFFAOYSA-N	440.843	1.956	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)c2nn(-c3ccccc3F)c3c2CCC3)cc1	744745203	SIWYEKXRPLOYOK-UHFFFAOYSA-N	447.426	1.990	50	20	IDGD	
Cc1nc(SCC(=O)NNc2nc3ccccc3c(=O)n2CCCOC(C)C)n[nH]1	746259017	UDENJQMASMJDHO-UHFFFAOYSA-N	431.522	1.874	50	20	IDGD	
O=C(CCOc1ccccc1)NNC(=O)c1ccc(S(=O)(=O)NC[C@H]2CCCO2)cc1	747181032	GGYKDLUBTUEPTO-GOSISDBHSA-N	447.513	1.374	50	20	IDGD	
Cn1ccnc(NNC(=O)c2cc(S(=O)(=O)NC3CC3)c(Cl)cc2Cl)c1=O	747937666	JZHNXYTZMUCBAQ-UHFFFAOYSA-N	432.289	1.285	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-]	751207005	PKROPUWQWXILEA-UHFFFAOYSA-N	446.363	1.876	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@](C)(C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)C1	751776676	YJDGBIRPSHGUHK-JOCHJYFZSA-N	444.488	1.900	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NC[C@H](C)c2c(C)noc2C)cc1	752699991	KYMZLDLZLCERCH-ZDUSSCGKSA-N	437.522	1.354	50	20	IDGD	
CC(C)c1cccc(-n2cc(O)c(C(=O)NNC(=O)CNC(=O)c3cccs3)n2)c1	752798638	XLQGSONFZWIEOD-UHFFFAOYSA-N	427.486	1.954	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)NCc2cncn2C)cc1	752957029	WBXFJCOTUJNZEI-CXUHLZMHSA-N	433.472	1.391	50	20	IDGD	
Cc1noc(C)c1[C@@H](C)CC(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	754081070	XVUNADTYGNMJRN-HNNXBMFYSA-N	427.505	1.390	50	20	IDGD	
C=CCN(C)S(=O)(=O)c1ccc(NC(=O)NNC(=O)c2ccc(OC)c(OC)c2)cc1	755933672	QREKACCQGVTNEH-UHFFFAOYSA-N	448.501	1.977	50	20	IDGD	
COc1cc(CN2CC[C@@H](NC(=O)NNC(=O)c3cccc(N(C)C)c3)C2)cc(OC)c1	756098329	CMNCMLNNEKCORI-GOSISDBHSA-N	441.532	1.988	50	20	IDGD	
CN(C1CC1)S(=O)(=O)c1ccc(NC(=O)NNC(=O)c2ccc3c(c2)OCO3)cc1	756400926	GIBNULAFHDATCK-UHFFFAOYSA-N	432.458	1.665	50	20	IDGD	
Cc1c(NC(=O)NNC(=O)CCc2ccccc2O)cccc1S(=O)(=O)NC1CC1	756704258	DZHGUHGUMTYQIH-UHFFFAOYSA-N	432.502	1.927	50	20	IDGD	
CCOC(=O)[C@H](C)NC(=O)c1ccc(NC(=O)NNC(=O)COc2ccccc2F)cc1	756789573	IAXZCSHARSQGTK-ZDUSSCGKSA-N	446.435	1.739	50	20	IDGD	
COC(=O)c1ccc(NC(=O)NNC(=O)COc2ccc(C#N)cc2)cc1C(=O)OC	756817283	IYMZOJDMMDGNET-UHFFFAOYSA-N	426.385	1.363	50	20	IDGD	
CNS(=O)(=O)c1cccc(NC(=O)NNC(=O)CSc2ccccc2OC)c1C	757726769	NHEATPJORLUVPD-UHFFFAOYSA-N	438.531	1.857	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)CN1C(=O)NC2(C[C@H](C)C[C@@H](C)C2)C1=O	757736485	ZPKOGOUAKHNHDE-ZIAGYGMSSA-N	431.493	1.001	50	20	IDGD	
CC(=O)c1cccc(S(=O)(=O)NCCC(=O)NNc2nc(O)c3ccccc3n2)c1	758298277	DWCLRNYVOSPCGV-UHFFFAOYSA-N	429.458	1.350	50	20	IDGD	
CCOc1ccc(C(=O)NNS(=O)(=O)c2ccc(F)cc2C(=O)OC)cc1OC	759096542	ZQAJZJSPBCZMIS-UHFFFAOYSA-N	426.422	1.643	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)NC[C@@H]2CC(=O)N(Cc3ccccc3)C2)nc2ccccc21	759682420	GXAFWDLMTMSYOG-KRWDZBQOSA-N	434.500	1.495	50	20	IDGD	
O=C(NNc1nccc(N2CCOCC2)n1)c1cn(-c2cccc(C(F)(F)F)c2)nn1	762851505	RABWNOGUDCMKEL-UHFFFAOYSA-N	434.382	1.670	50	20	IDGD	
CCN(CC)C(=O)COc1ccc(NC(=O)C(=O)NNC(=O)c2ccccn2)cc1Cl	763466003	CHTHFIUOUSZCCD-UHFFFAOYSA-N	447.879	1.382	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c(C)c1	763529468	BYRYDLCIWSRMRN-UHFFFAOYSA-N	439.516	1.302	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2c(C)nn(-c3ccccc3)c2C)cc1OC	763552274	YEMFHNPFRGZQKK-UHFFFAOYSA-N	437.456	1.906	50	20	IDGD	
O=C(NNC(=O)c1ccccc1F)C(=O)Nc1cccc(I)c1	763562438	VZMWALAHXXFDMF-UHFFFAOYSA-N	427.173	1.830	50	20	IDGD	
CC[C@@H](C)n1ncc(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1C1CC1	763570220	DFXWLPZILQLMAL-SJKOYZFVSA-N	427.461	1.657	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc3c(c2)NC(=O)CS3)cc1C	763668080	YKFKDFDNLURXBZ-UHFFFAOYSA-N	428.470	1.513	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)C(=O)Nc1cnn(Cc2ccc(Cl)cc2)c1	763678744	IPPUYLUKJOJYLT-UHFFFAOYSA-N	445.838	1.889	50	20	IDGD	
Cc1coc(-c2cc(NC(=O)C(=O)NNC(=O)COc3ccc(C#N)cc3)ccc2C)n1	763681549	VMMJESIGLDKWRB-UHFFFAOYSA-N	433.424	1.995	50	20	IDGD	
CN1Cc2ccc(NC(=O)C(=O)NNC(=O)COc3ccc(Br)cc3)cc2C1	763692794	CVSIDTRNVVRGSE-UHFFFAOYSA-N	447.289	1.559	50	20	IDGD	
COCCOC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCC3)c1	763784900	JSEFHTGBJPEMHV-UHFFFAOYSA-N	446.485	1.831	50	20	IDGD	
COC(=O)Nc1cc(C(=O)NNC(=O)CNC(=O)c2cccnc2)cc(C(F)(F)F)c1	763818742	OHIZIFORPZYCON-UHFFFAOYSA-N	439.350	1.470	50	20	IDGD	
Cc1nc(-c2cccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc3cccc(C)c3C)c2)n[nH]1	763839947	HGVAETRUJZRDNN-AWEZNQCLSA-N	436.472	1.950	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc3ccccc3c2)n(CCC#N)n1	763855258	VFNBWBRFSMADHL-HNNXBMFYSA-N	434.456	1.812	50	20	IDGD	
CNC(=O)c1cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)ccc1Cl	763870720	BVKOVJQFZOMFHY-SNVBAGLBSA-N	436.827	1.392	50	20	IDGD	
CCC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(C(C)=O)cc2)cc1	763877429	JIAFCWNDDPRULF-CQSZACIVSA-N	440.456	1.791	50	20	IDGD	
O=C(CCSc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccc(-n2cncn2)nc1	763897307	YEPYFDGQNWLQIC-UHFFFAOYSA-N	429.437	1.070	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)n(-c2ccccc2)n1	763943286	CNKYUCRKDMCTOS-UHFFFAOYSA-N	445.439	1.472	50	20	IDGD	
COC(=O)C(C)(C)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1	764004969	VLDOEUWJPGXYAJ-UHFFFAOYSA-N	441.440	1.308	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)CCCC(=O)N2	764005179	WBXLBUNXVQJKIQ-UHFFFAOYSA-N	448.277	1.462	50	20	IDGD	
CN(c1ccccc1NC(=O)C(=O)NNC(=O)c1ccc2ccccc2c1)S(C)(=O)=O	764061616	KLNYEHFAPWHPJK-UHFFFAOYSA-N	440.481	1.635	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)Cc2ccc3ccccc3c2)cccc1-n1cnnn1	764086220	YQXCRRCYRNOJHU-UHFFFAOYSA-N	429.440	1.453	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cccc(C(=O)NC4CC4)c3)n[nH]2)cc1	764110391	IOXJMAXLOSLHBV-UHFFFAOYSA-N	446.467	1.677	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc(-n4nccn4)cc3)n[nH]2)cc1	764110485	KHHJFZYDHPKYKU-UHFFFAOYSA-N	430.428	1.366	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2ccccc2-n2nc(C)nc2C)cc1	764126184	GLICPPOBXGJYPJ-UHFFFAOYSA-N	436.472	1.611	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccccc2N(C)C(C)=O)o1	764139396	SKSFRBHSZRVTAI-UHFFFAOYSA-N	429.477	1.504	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2O1)C(=O)Nc1cnn(-c2ccccc2Cl)c1	764163816	MPXIUYWZNVNFQL-KRWDZBQOSA-N	425.832	1.615	50	20	IDGD	
COC(=O)CCSCc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(C#N)cc2)c1	764176850	HUUKLOUYZLLOAO-UHFFFAOYSA-N	440.481	1.754	50	20	IDGD	
CCC(CC)NC(=O)[C@@H]1CN(C(=O)C(=O)NNC(=O)CC(C)(C)C)c2ccccc2O1	764197541	DFGHFBXCIUVNRN-KRWDZBQOSA-N	432.521	1.669	50	20	IDGD	
CN(C)c1ccc(C(F)(F)F)cc1NC(=O)C(=O)NNC(=O)COc1ccccc1O	764280660	RELKPEFRIYRQHT-UHFFFAOYSA-N	440.378	1.642	50	20	IDGD	
Cc1nn(Cc2ccc(Cl)cc2)c(C)c1C(=O)NNC(=O)CNC(=O)c1cccnc1	764343379	QDCZNWWHAMWPSC-UHFFFAOYSA-N	440.891	1.788	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2csc(-c3ccco3)n2)c1	764371952	BBXYMZRFAOOZJH-UHFFFAOYSA-N	449.514	1.798	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2cccs2)[nH]n1)C(=O)Nc1ccccc1O[C@H]1CCOC1	764382992	UCFOFMOFEBAJMU-LBPRGKRZSA-N	441.469	1.706	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1ccccc1CN1CCc2ccccc21	764397426	JKUBMUKWERMZDK-MRXNPFEDSA-N	440.500	1.387	50	20	IDGD	
Cc1ccc(OCC(=O)N2CCN(CC(=O)NNC(=O)Cc3ccccc3C)CC2)cc1	766862654	CBYGNQRJOFQZMM-UHFFFAOYSA-N	438.528	1.217	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)c2ccccc2NS(C)(=O)=O)n[nH]1	768274040	ODICDTMHBVBUDV-UHFFFAOYSA-N	429.458	1.532	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3ccc4c(c3)C(=O)NC4=O)n[nH]2)cc1OC	768277775	SBKPFSARXJZBGN-UHFFFAOYSA-N	435.396	1.052	50	20	IDGD	
CSCC[C@@H](NC(=O)COc1ccccc1)C(=O)NNC(=S)Nc1ccccn1	768585970	YMLMATIUTSWLJX-OAHLLOKOSA-N	433.559	1.716	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)c1ccc(CN2CCN(C)CC2)cc1	768644683	GDKNNNVJMUOGPS-UHFFFAOYSA-N	432.546	1.603	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@@H]2CCO[C@]3(CCSC3)C2)c2ccccc2c1=O	769235882	RLMAUMPGADJGND-ZUOKHONESA-N	431.518	1.415	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2ccc(O)c(C(=O)NNC(=O)c3c[nH]nc3C)c2)cc1	769781497	BPAONNMIRARFBV-UHFFFAOYSA-N	445.457	1.308	50	20	IDGD	
CCCOc1cccc(CC(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1	770204394	WWXWKKSGSSFCEU-LJQANCHMSA-N	428.441	1.549	50	20	IDGD	
CCOC(=O)Cc1nnc(NC(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)s1	770619860	VXCJVDJCCZGOOD-VIFPVBQESA-N	427.870	1.917	50	20	IDGD	
CC(C)(C)C(=O)NCCc1ccc(S(=O)(=O)NNC(=O)c2cccc(C#N)c2)s1	770636333	SFWQODQWZAGMHJ-UHFFFAOYSA-N	434.543	1.948	50	20	IDGD	
CS(=O)(=O)c1cc(S(=O)(=O)NNC(=O)c2cc3c(s2)CCC3)c(Cl)s1	770636860	UULNAUBEYALLOO-UHFFFAOYSA-N	440.977	1.979	50	20	IDGD	
O=C(CN1C(=O)[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)NNC(=S)Nc1cccc(Br)c1	770994322	SPPKOHMLSVYLSW-FCIDVOKBSA-N	449.330	1.574	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N[C@@H](C)c2nnc(C)o2)cc1	771568793	YTXBLQOCRFSMPG-ATTDUZETSA-N	449.471	1.910	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@@H]2C(=O)O[C@H](C)C(=O)NNC(=O)CC(C)C)s1	771932911	ZJRYBFLFLJYMDD-ZIAGYGMSSA-N	445.563	1.335	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)[C@H]1CSCN1C(=O)c1ccc(Cl)cc1	772095587	KPUJOKGTKDXELN-SWLSCSKDSA-N	441.937	1.980	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)c1cc(I)c(F)cc1F	772103151	VKPUDPFDZDUEJZ-UHFFFAOYSA-N	449.151	1.353	50	20	IDGD	
CS(=O)(=O)c1ccc(CNC(=O)NNC(=O)Cc2ccncc2)cc1C(F)(F)F	772432069	RQHXKMDOUSSMLK-UHFFFAOYSA-N	430.408	1.577	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@H](C(C)C)N2CCCS2(=O)=O)ccc1OC(C)C	772630908	PCGPDWZWWCCZCI-KRWDZBQOSA-N	427.523	1.304	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)c2ccc(S(=O)(=O)CCCC#N)cc2)c1	773074122	WMMIMCLALQMLHB-UHFFFAOYSA-N	429.458	1.192	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)ncc1Br	773527063	FROKBHBQXGJWJT-UHFFFAOYSA-N	445.071	1.643	50	20	IDGD	
CN1CCC/C1=N\S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccc(C#N)cc2)cc1	773693102	VXQLZHOUPZOFEN-XIEYBQDHSA-N	440.485	1.453	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2cccs2)[nH]n1)Nc1ccnn1[C@H]1CCS(=O)(=O)C1	776052769	BBIIGSQESQJSFY-JTQLQIEISA-N	435.491	1.161	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1=O	776180575	FSQWWSQLNGVJGJ-YPMHNXCESA-N	432.399	1.193	50	20	IDGD	
COc1ccc(-c2nnc(SCC(=O)NNC(=O)CNC(=O)OC(C)(C)C)o2)cc1	778433283	JBVQZOYHBVAGBW-UHFFFAOYSA-N	437.478	1.509	50	20	IDGD	
Cc1cccc(N2CCN(CCCNC(=O)NNC(=O)CNC(=O)OC(C)(C)C)CC2)c1	778620275	DNHCNAUQZWLTJZ-UHFFFAOYSA-N	448.568	1.362	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)[C@@H](O)[C@@H](O)c2nc3ccccc3[nH]2)c(C)n1-c1ccccc1	779580412	ZGSKDZODBOCOBM-UXHICEINSA-N	433.468	1.826	50	20	IDGD	
O=C(C[C@@H](O)c1ccc(OCc2ccccc2)cc1)NNC(=O)[C@H]1CCS(=O)(=O)C1	780860070	JSSMYVOJRRXRGR-PKOBYXMFSA-N	432.498	1.271	50	20	IDGD	
COCc1noc(CN2CCN(C(=O)NNC(=O)c3cc4c(s3)CC[C@H](C)C4)CC2)n1	780946612	MQBVARAPDWCBHC-ZDUSSCGKSA-N	448.549	1.575	50	20	IDGD	
CC(C)(C)OC(=O)NCCCCC(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	781664409	ZKPSTTYGLIYRJO-UHFFFAOYSA-N	448.929	1.443	50	20	IDGD	
CCNC(=O)N(C)NS(=O)(=O)c1cc(C(=O)OC)c(Cl)cc1Br	782478065	HDSURESOJPHHKN-UHFFFAOYSA-N	428.692	1.744	50	20	IDGD	
COc1cc(C)c(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)cc1OC	782884453	AHCLXNZVELTNOQ-UHFFFAOYSA-N	425.445	1.228	50	20	IDGD	
CCc1nnc(-c2ccc(NC(=O)C(=O)NNC(=O)Cc3nc4ccccc4n3C)cc2)o1	782893500	JHLCBVYHGGDPJE-UHFFFAOYSA-N	447.455	1.514	50	20	IDGD	
Cc1ccccc1NC(=O)NNC(=O)C(=O)Nc1ccc(NC(=O)[C@@H]2CCCO2)cc1	783415510	FEDWWKDYKYRKIO-KRWDZBQOSA-N	425.445	1.904	50	20	IDGD	
CNS(=O)(=O)c1ccc2c(c1)N(C(=O)C(=O)NNc1cccc3c1CCCC3)CC2	783451264	LNVATFQFHMGJEJ-UHFFFAOYSA-N	428.514	1.506	50	20	IDGD	
CCCNC(=O)[C@@H]1CN(C(=O)C(=O)NNc2cccc(C(=O)OC)c2)c2ccccc2O1	784851516	CAOYSJNKMGSYSJ-SFHVURJKSA-N	440.456	1.237	50	20	IDGD	
CN(Cc1ccccc1)S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2cccnn2)cc1	784858387	LEVFHQDDBIJSRY-UHFFFAOYSA-N	440.485	1.379	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc(C(=O)N(C)C)cc3)n[nH]2)c1	785128015	MENBEFVYJKXBMI-UHFFFAOYSA-N	448.483	1.795	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)c1cnn(CCO)c1-c1ccccc1	788299170	COMVUVODSOGBAU-UHFFFAOYSA-N	441.513	1.740	50	20	IDGD	
CN(NS(=O)(=O)c1ccc2c(c1)COC2)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	788914787	FZYPURNWPCBPSP-UHFFFAOYSA-N	440.522	1.515	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(-n3cccn3)cc2C)cc1	789584102	CXPFCHVLQOMPDV-INIZCTEOSA-N	449.467	1.937	50	20	IDGD	
C[C@@](O)(CN1C(=O)NC2(CCCC2)C1=O)C(=O)NNc1nc(-c2ccc(Cl)cc2)no1	790070987	OBZIABPNOHMTPT-GOSISDBHSA-N	448.867	1.449	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)[C@@H]2CC(c3cc(OC)ccc3OC)=NO2)c1	791457549	DQDIOEYYDTUBRI-IBGZPJMESA-N	429.429	1.675	50	20	IDGD	
Cc1cccc(=O)n1C[C@@](C)(O)C(=O)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1	792266469	BEGYLMJMGCWYQR-MRXNPFEDSA-N	433.408	1.345	50	20	IDGD	
CNC(=O)c1cc2cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc3ccc(F)cc3)ccc2[nH]1	792352165	CXFHCJLVNJZRDP-LLVKDONJSA-N	441.419	1.220	50	20	IDGD	
COc1ccc(Cn2cc(NC(=O)C(=O)NNC(=O)c3ccc(O)c(Cl)c3)cn2)cc1	793024845	GIZJOEPQLQFDGI-UHFFFAOYSA-N	443.847	1.699	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNC(=O)c1cc(O)nc2ccc([N+](=O)[O-])cc12	794063332	MCIKVTKIUNSGCC-UHFFFAOYSA-N	439.384	1.536	50	20	IDGD	
COc1cccc(NCC(=O)NN=C[C@H]2CCCN(C(=O)CNC(=O)OC(C)(C)C)C2)c1	794478433	OJHSYLACZWKXIQ-MRXNPFEDSA-N	447.536	1.972	50	20	IDGD	
Cc1cc(F)c(S(=O)(=O)NNC(=O)CNC(=O)OCc2ccccc2)cc1C(=O)O	794598241	DKWXNPNWHJDIIZ-UHFFFAOYSA-N	439.421	1.068	50	20	IDGD	
CNC(=O)NNC(=O)[C@@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(C)(C)O	795527166	JKBPCFCINZHLNE-GOSISDBHSA-N	426.473	1.625	50	20	IDGD	
O=C(COC(=O)[C@H]1CCCCN1Cc1ccccn1)NNC(=O)c1cccc([N+](=O)[O-])c1	795606253	KJPJEZZIOPYRHN-GOSISDBHSA-N	441.444	1.349	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)N[C@H]1CCCN(C(=O)Cc2ccccc2)C1	800983555	NFUINCNGBSNMDH-SFHVURJKSA-N	434.500	1.820	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)c1nc2cccnc2s1	801172643	VTNGRBVDTOKVGG-UHFFFAOYSA-N	444.948	1.924	50	20	IDGD	
O=C(NNc1ccc2c(=O)[nH]ccc2c1)c1ccc(S(=O)(=O)N=c2cc[nH]cc2)cc1	803434994	FZGUUMGJPWBTPG-UHFFFAOYSA-N	435.465	1.903	50	20	IDGD	
CCc1nnc(NC(=O)[C@@H](C)[C@H](C)NC(=O)NNC(=O)c2ccc3c(c2)OCCO3)s1	805878759	SBLZAMKSABBTKP-QWRGUYRKSA-N	448.505	1.479	50	20	IDGD	
CCn1cc(CNC(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)cn1	807517286	DGRVEGKBKNQGRM-UHFFFAOYSA-N	448.530	1.910	50	20	IDGD	
C#CC[C@]1(C(=O)NNC(=O)Cn2cnc3ccccc32)CCCN1C(=O)OC(C)(C)C	809558557	QURJIIHETHAOBL-JOCHJYFZSA-N	425.489	1.977	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)c2cc(Cl)ncc2Br)c2ccccc2c1=O	809932803	FEAMDXCWBYTGGZ-UHFFFAOYSA-N	436.653	1.819	50	20	IDGD	
COC(=O)c1c(F)ccc(NC(=O)C(=O)NNC(=O)c2ccc(OC)c(OC)c2)c1F	810384509	DADAZHMEFKJMNW-UHFFFAOYSA-N	437.355	1.168	50	20	IDGD	
O=C(Cc1cc[nH]n1)NNC(=O)C(=O)Nc1cnn(-c2ccc(F)cc2)c1C(F)(F)F	810387353	RZXIQPZSRSAXRZ-UHFFFAOYSA-N	439.329	1.082	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@](C(=O)NNC(=O)C(=O)Nc2ccccn2)(C(F)(F)F)C1	813480681	XEJWJLUXFLWZPB-QGZVFWFLSA-N	445.398	1.357	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2nc(CC(F)(F)F)cs2)c1	815566509	WTLSNQPQNPPSAL-UHFFFAOYSA-N	432.380	1.665	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)N(C)C)cc1C	815750853	LVOYUIIDIPFQIE-UHFFFAOYSA-N	434.474	1.114	50	20	IDGD	
CCCN1C(=O)c2ccccc2N2C(=O)CC[C@]12C(=O)NNc1cc(Cl)nc(N)n1	816046953	QGXBFDXYULCFRD-IBGZPJMESA-N	429.868	1.544	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C[C@H]1CN(Cc2ccccc2)CCO1	817053951	NDPMFNDCAQNQSL-SFHVURJKSA-N	432.546	1.671	50	20	IDGD	
CCOC(=O)CC1(S(=O)(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)CC1	821127509	IZIVAAKRODBIKK-UHFFFAOYSA-N	436.490	1.027	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)CSc2nnnn2C2CCCC2)cc1	906487186	WCNAHTVHRQUMAF-CYBMUJFWSA-N	434.522	1.894	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)CN2C(=O)[C@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2=O)c(C)n1-c1ccccc1	913419371	NLLVEAMGMJCXPN-SNHGZMDHSA-N	432.480	1.662	50	20	IDGD	
CC(C)[C@@H](C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)N1C(=O)c2ccccc2C1=O	915163745	AHIITPOHIVJAQM-KRWDZBQOSA-N	443.481	1.172	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)C1CCN(C(=O)c2cccnc2)CC1	915189628	VHRFQVPJBUPBRV-UHFFFAOYSA-N	434.500	1.694	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)NCc2ccc(S(N)(=O)=O)cc2)cc1	915884630	MKNJVHCCGBDPNI-CYBMUJFWSA-N	436.490	1.031	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C3=NN(c4ccc(F)cc4)[C@H](C(N)=O)C3)n[nH]2)cc1	917178214	FLWLAKRJLGHJGX-IBGZPJMESA-N	449.446	1.405	50	20	IDGD	
CCCOc1ccc(C(=O)NNS(=O)(=O)c2ccc(C(=O)OC)s2)cc1OC	917727399	IWTFHEHOFUDKCI-UHFFFAOYSA-N	428.488	1.955	50	20	IDGD	
COC1(C(=O)NNC(=O)c2c(C)nc3ccccn23)CCN(C(=O)OC(C)(C)C)CC1	917938829	QASZDUUQVXFDPZ-UHFFFAOYSA-N	431.493	1.820	50	20	IDGD	
O=C(NCc1ccccc1OCC(F)(F)F)NNC(=O)c1ccc(-n2cnnn2)cc1	918133310	QFLPOVQVKMASRI-UHFFFAOYSA-N	435.366	1.748	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)c2c[nH]n3c2nc(=O)c2ccccc23)cc1	919690578	POGQHSIXRBDMPG-CYBMUJFWSA-N	435.440	1.803	50	20	IDGD	
CN(CCCCNC(=O)NNC(=O)c1csc(N2CCOCC2)n1)c1ccccc1	919782410	WFLOITABHDIJAP-UHFFFAOYSA-N	432.550	1.840	50	20	IDGD	
O=C(NCc1cccc(NC(=O)[C@H]2CCCO2)c1)NNC(=O)c1ccc([N+](=O)[O-])cc1	920236422	BXSBKXGHWQWZHV-QGZVFWFLSA-N	427.417	1.857	50	20	IDGD	
CNC(=O)COc1ccc(C(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)cc1OC	920587487	DIWKHXJFLUGSGB-UHFFFAOYSA-N	449.847	1.091	50	20	IDGD	
Cc1nc(N(C)C)sc1C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	1116433306	RSXAOZVCRDMMCJ-UHFFFAOYSA-N	437.547	1.377	50	20	IDGD	
CCC(CC)[C@H](CNC(=O)NNC(=O)c1cncn1-c1ccccc1)N1CCOCC1	1317889123	JTRDXASBTDRTHO-IBGZPJMESA-N	428.537	1.953	50	20	IDGD	
CN(C)N(C(=O)c1cc(=O)c2cc(Br)ccc2[nH]1)[C@H]1CCS(=O)(=O)C1	1324348977	TYDLCNZCLDEECQ-NSHDSACASA-N	428.308	1.397	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4cnccc4n3)C2)C1	1777734508	XUTIGPNFZPVVPG-OAQYLSRUSA-N	428.565	1.925	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)/C=C/C(=O)NCc3ccco3)C2)C1	1779207752	YKJMZKKYKOUYAB-MOENXHEYSA-N	437.924	1.689	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cccc3c1OCCO3)CCO2	1779295267	DHQHSPQOAJDGAN-OAQYLSRUSA-N	434.565	1.753	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)COC(=O)C(F)(F)F)C2	1780704833	UCOSOEPHBVLMAC-XHBSWPGZSA-N	428.835	1.623	50	20	IDGD	
COc1cc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)ccc1O	1780752263	KZBYHVDEVXEBKE-XIKOKIGWSA-N	427.295	1.628	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Br)C1	1780777252	PMYXBUVGESXZKP-NJBDSQKTSA-N	444.139	1.974	50	20	IDGD	
COC(=O)c1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)cn1	1781229854	MXBIYQQRPSUZIT-OALUTQOASA-N	444.315	1.548	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(C)n3ccnc3n2)C1	1781311964	FOQHWNTXSAAGEM-LUQKVYGDSA-N	449.939	1.419	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)N(C)C(C)=O)C2	1781899926	DGEPLDULCCYHRC-PSFFPDNBSA-N	446.386	1.541	50	20	IDGD	
COc1ccc2oc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]4C3)cc2c1	1784093481	WKYMDDYMCDSVGM-DLLGKBFGSA-N	436.892	1.634	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cn3cc([N+](=O)[O-])cn3)C[C@@H]21	1784615956	DNQPLZJITKFREA-TUUVXOQKSA-N	427.889	1.179	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3C[C@@H]3F)[C@H]2C1	1784854647	YCYRXAVQSFOAMP-KARBZBNUSA-N	447.935	1.456	50	20	IDGD	
Cc1ncccc1CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21	1785127278	QVTWUVPXJVLENN-OVWQWFNUSA-N	442.329	1.993	50	20	IDGD	
CCn1nc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](Cl)COC)C[C@@H]32)c2ccccc21	1787216746	NIWPPPVBLPAKTC-RMRDIRSESA-N	448.951	1.903	50	20	IDGD	
Cn1nccc1C(=O)NC1(c2ccc(NC(=O)c3cnccc3C(=O)NN)cc2)CCC1	1789521345	YNMZNJLULHYFIU-UHFFFAOYSA-N	433.472	1.480	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(-n4ccnc4)ccn3)C[C@@H]21	1789862029	WHRQLDITCNWUTO-RMRDIRSESA-N	431.924	1.878	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)COc3cccnc3)C[C@@H]21	1789868896	ROEDOGDKKYWDQX-FJXLLPKBSA-N	430.332	1.676	50	20	IDGD	
CC(C)(C)n1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]3C2)nn1	1789924602	OQUJEBFTABOMFP-AUZPSNTRSA-N	446.321	1.317	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(-n4cncn4)c3)[C@H]2C1	1790250150	FGUJUCJTZFAAII-KANFNMMFSA-N	431.924	1.878	50	20	IDGD	
Cc1nc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](C)Br)[C@H]3C2)ccc1F	1791056863	GTTBSSZWTTWDMJ-SDPXSBNPSA-N	428.302	1.906	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)C[C@@H]21	1791256751	HCGSBLJPKATCBM-UQCMEYCASA-N	443.859	1.581	50	20	IDGD	
COc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Cl)C[C@@H]32)ccc1[N+](=O)[O-]	1792048860	BXJPUTJCNIZFCZ-GVAFMPQTSA-N	429.832	1.731	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCC(=O)N1CCCC1)C2	1792868675	KBSMLSKRLZCMEK-ZXFNITATSA-N	444.370	1.010	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ncccn1	1794819455	PYXWEXUHKQDEIB-SQABCVSLSA-N	439.422	1.565	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)COCc1ccccc1	1795426624	DYAIWCLOWUHQLK-ZMMAXQRCSA-N	439.350	1.966	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2)c1ccnn1-c1ccccc1	1796738851	XXVRINJUKLBPLA-CCWDJLKJSA-N	447.333	1.861	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@]1(F)CCCCC1(F)F)c1cccc(B(O)O)c1	1797797851	NJUXIBKLNWZPNV-CLWJZODNSA-N	438.255	1.536	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2cc(F)ccc2[nH]1)c1ccc(B(O)O)cc1	1797993719	NCSPYCFLBAUUAY-REPLKXPHSA-N	435.264	1.552	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccnc(OC)c1	1798124888	OLTFWHCCKDNOBQ-FQLMCAECSA-N	426.311	1.467	50	20	IDGD	
CCCC(=O)N[C@@H](C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2	1798597462	DCGQLXISBVTDHB-AGVXFXHOSA-N	444.536	1.063	50	20	IDGD	
CC[C@@H](NC)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O	1799218019	SPTVEZCEUAJZNH-BASYENTBSA-N	432.477	1.770	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)Cc1ccccc1)C2	1799279793	UAYVVDUIUHJQAY-QRXRQMIZSA-N	429.344	1.416	50	20	IDGD	
CCOc1ncccc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Br	1799343132	OGPLGZGSYWJFRI-ZMJPVWNMSA-N	430.274	1.374	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C13CC(C(F)(F)F)(C1)C3)C2)[C@H](F)Br	1799344319	HSQVKKSQTSYVQE-NQSCELDKSA-N	443.235	1.999	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)[S@@](=O)c1ccccc1	1800213872	AEFGTNVEVNIQOM-BVQLZSKCSA-N	442.965	1.026	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](Br)CC)C2	1800644155	KUUQRXJMTRCXRD-OFTGVCEQSA-N	440.176	1.923	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cn(C)nc1C(F)F)C2	1800758162	SUTREIGOFPSYQY-GUDRVLHUSA-N	435.269	1.344	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CSc1ccc(F)cc1F)C2	1800970783	JHFLDZVBBHWQDE-JPVZDGGYSA-N	448.919	1.900	50	20	IDGD	
CC[C@@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CNC(=O)C(F)(F)F)C2	1801805341	ZFRFSFUFPJGFJB-LMLFDSFASA-N	428.249	1.477	50	20	IDGD	
C[C@@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnc3c(c1)CCNCC3)C2	1801967158	ZUCWCVPGKKXEGG-VDNDLQMASA-N	435.366	1.805	50	20	IDGD	
CC(=O)N[C@@H](Cc1cccc(F)c1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](O)CCl)C2	1804215510	BLUCESWOCNKXPB-XCDZQEORSA-N	439.915	1.111	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)/C=C/c2ccco2)[C@@H]1c1cccnc1	1804613026	GDOCUVULDZLHMO-XUERSVHISA-N	439.516	1.767	50	20	IDGD	
NC(=O)c1ncccc1C(=O)NC[C@H]1CCN(C(=O)C(Cl)Cl)[C@H]1c1cccnc1	1804817405	ULZUKQSLODJHGC-DOMZBBRYSA-N	436.299	1.699	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)CS(C)(=O)=O)[C@H]1c1cccnc1	1806772978	WUJZCKSPCAUQKL-OFQRWUPVSA-N	446.367	1.306	50	20	IDGD	
C[C@H](C(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)n1cccc1C=O	1807392061	UKADXWCMEBPUHD-XIVBQZFQSA-N	432.908	1.562	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)[C@@H]1Cc2ccccc2CN1	1808235932	WNNNOFOEODNIGE-XSDIEEQYSA-N	442.947	1.402	50	20	IDGD	
COc1nccc(C(=O)N2CCCC3(CCN(C(=O)CCC(=O)NN(C)C)CC3)C2)c1F	1810236780	ROIRBGWBPNTATB-UHFFFAOYSA-N	449.527	1.447	50	20	IDGD	
CCOc1ccc(C(=O)N2CC[C@H](CNC(=O)[C@@H](Cl)COC)[C@H]2c2cccnc2)nn1	1813033306	PYHCLGCMBRRQNT-JTDSTZFVSA-N	447.923	1.844	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)[C@@]2(C)CC2(F)F)[C@H]1c1cccnc1	1813075195	ZYRRFMPBTUGSDW-ZAAXVRCTSA-N	437.491	1.506	50	20	IDGD	
Cc1nc(C(=O)N2CC[C@H](CNC(=O)C(Cl)Cl)[C@H]2c2cccnc2)c(=O)[nH]c1C	1813077866	OOSDEQVRVLHTIG-UKRRQHHQSA-N	438.315	1.905	50	20	IDGD	
CC(=O)N[C@H](C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](C)CBr)n[nH]1	1814783266	MLVJITOCAYCVPG-GYSYKLTISA-N	428.331	1.957	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H]2CNC(=O)O2)n[nH]1	1815279511	GSCDKFWXJVOGJX-DLOVCJGASA-N	428.287	1.684	50	20	IDGD	
Cc1cnc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)s1	1815355471	SQEPPJOBXUVYGE-CYBMUJFWSA-N	442.331	1.127	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)CN2CCCCC2)n[nH]1	1817136463	FNWXXRPCWATEBG-KRWDZBQOSA-N	433.557	1.261	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3nc[nH]c3[N+](=O)[O-])sc2C1	1817205951	WFPWKXMLAKCGDQ-YUMQZZPRSA-N	428.858	1.254	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CN)n[nH]1	1817237660	IHKYYPIGVIPXBU-STQMWFEESA-N	428.921	1.493	50	20	IDGD	
O=C(CS(=O)(=O)N1CCCC1)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](F)Cl)CC2	1817271470	DEWKMHSXGFBSTA-RNCFNFMXSA-N	438.934	1.015	50	20	IDGD	
Cc1ncccc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827050620	ALZSHMUZPAYMPD-QFIPXVFZSA-N	435.333	1.617	50	20	IDGD	
CCOc1ccsc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](Cl)COC)C2)C1	1829554114	GBEDKCWOVSVIAQ-LIRRHRJNSA-N	446.953	1.471	50	20	IDGD	
O=C([C@H](O)CCl)N1CCC([C@H]2CCCCN2C(=O)Cc2ccc3ncnn3c2)CC1	1830154762	WGGZOXJZMYVGRP-QZTJIDSGSA-N	433.940	1.491	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3c4c(nn3C)CCC4)C2)C1	1831653135	BAJXNHGKFNSQKG-IIBYNOLFSA-N	438.956	1.386	50	20	IDGD	
CC(=O)C[C@@H](C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1	1831798829	ICALQFNBTCBRMI-IIBYNOLFSA-N	428.338	1.215	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)/C=C/c2cnc[nH]2)CC1	1831874876	NTLYYWJYCDDDER-FNQPIQQGSA-N	430.553	1.416	50	20	IDGD	
O=C([C@@H]1CCCS1(=O)=O)N1CCC([C@H]2CCCCN2C(=O)C(Cl)Cl)CC1	1831880998	SGKXMAWVFQEQLP-KGLIPLIRSA-N	425.378	1.987	50	20	IDGD	
CC(C)(CCl)C(=O)NC1CCN(C2CCN(C(=O)c3n[nH]cc3[N+](=O)[O-])CC2)CC1	1833214469	CKHXVEDWWHHGNT-UHFFFAOYSA-N	440.932	1.768	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3nc4ccccc4o3)CC2)CC1)[C@@H](O)CCl	1833311676	CJVZHAARDNUYLN-KRWDZBQOSA-N	434.924	1.613	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)C(OC)OC)CC2)CC1	1833391224	GSBDHUYXGUYYHR-HNNXBMFYSA-N	434.375	1.350	50	20	IDGD	
Cc1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)n1	1834052109	SVQJKLMGYNUJPG-KBXCAEBGSA-N	426.311	1.243	50	20	IDGD	
CC[C@H](C)[C@H](N)C(=O)NC1CCN(C2CCN(C(=O)[C@H](C)Br)CC2)CC1	1834689375	IHEIDKULMTUAPB-ZQIUZPCESA-N	431.419	1.715	50	20	IDGD	
CC[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](Cl)COC)C2)C1)c1ccccc1	1834754321	MNJBFEUFPXNZRV-IPJJNNNSSA-N	438.952	1.890	50	20	IDGD	
CC(C)N[C@@H](C(=O)N1CCOC[C@@]2(CN(C(=O)CCBr)CCO2)C1)C(C)C	1834822572	WEWKOWKKPLWKMX-IEBWSBKVSA-N	448.402	1.250	50	20	IDGD	
Cc1nnc(CC(=O)NC2CCN(C3CCN(C(=O)C(Cl)Cl)CC3)CC2)s1	1834853909	FFHUBGPYINSWPP-UHFFFAOYSA-N	434.393	1.764	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cccn4c(O)nnc34)CC2)CC1)[C@@H](F)Cl	1835079516	BZQVCOVNRLIZAN-OAHLLOKOSA-N	438.891	1.155	50	20	IDGD	
C[C@H](C(=O)N1CCC(N2CCC(NC(=O)CO[Si](C)(C)C)CC2)CC1)n1ccnc1	1835835403	YNIYKEHTZPEYOY-QGZVFWFLSA-N	435.645	1.867	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3ccc[nH]3)CCO2)C1	1836010300	IZAGEKQOMBANMJ-DNVCBOLYSA-N	442.354	1.435	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)N1CCC(N2CCC(NC(=O)[C@](C)(Cl)CCl)CC2)CC1	1836398101	FCLOGMGLGPXMSS-JLTOFOAXSA-N	449.423	1.661	50	20	IDGD	
COC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)[C@@](C)(Cl)CCl)CC2)CC1	1836398492	LQEYAXWFXFRADB-IBGZPJMESA-N	436.380	1.748	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)CC3(O)CCC3)CC2)CC1)[C@H](F)Br	1836414532	PRQHOTGITGZESI-INIZCTEOSA-N	434.350	1.554	50	20	IDGD	
O=C([C@H](F)Br)N1CCOC[C@@]2(C1)CN(C(=O)C1(F)CCCCC1)CCO2	1836617636	NHPMZMRMNLFWCL-XJKSGUPXSA-N	439.297	1.806	50	20	IDGD	
CC(=O)O[C@@H](C(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1)C(C)C	1836717181	MAOGWATYZCUVAK-QZTJIDSGSA-N	432.945	1.172	50	20	IDGD	
C=CC[C@H](C(=C)C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1837311079	YSKHYDKZQURQLS-RVKKMQEKSA-N	433.318	1.902	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)CCCc3ccncc3)C2)C1	1837709965	BPMWWZXFNMPVPU-QFIPXVFZSA-N	449.624	1.712	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CCCSC3)C2)C1	1837717827	OXKWSWQQMKVLLA-LPHOPBHVSA-N	430.643	1.438	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3sccc3Cl)CCO2)C1	1838228003	XXFMXMFUZWYRPY-SUMWQHHRSA-N	437.345	1.725	50	20	IDGD	
CCC[C@H](NC(C)=O)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](Cl)COC)CC2)CC1	1838785941	LGKVHVBIHOOIGN-OALUTQOASA-N	445.988	1.544	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc4cc(C)ccn34)C2)C1	1839148389	XITIWDBTOKYLHR-KKSFZXQISA-N	434.924	1.730	50	20	IDGD	
O=C(c1cccc(F)c1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839201592	BTLIQOJAPOFOAA-WMLDXEAASA-N	433.249	1.586	50	20	IDGD	
C[C@H]1CC[C@H](C(=O)N2CCOC[C@]3(CN(C(=O)[C@H](F)Br)CCO3)C2)CC1	1839203470	LWPVUAPKWDLLGO-YRBFXIGRSA-N	435.334	1.960	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cc(O)ccc1O)CCO2	1839448116	QZJIXSKMPURFQD-FQEVSTJZSA-N	438.553	1.019	50	20	IDGD	
O=C(c1ccnc2c(O)cccc12)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1839606885	YLHBOJDAPMJSAK-XLIONFOSSA-N	437.855	1.545	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(O)cc3)C2)C1	1839966102	VEPISTLWYXAUJU-LPHOPBHVSA-N	441.322	1.636	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(F)nc3)C2)C1	1840033565	IZJIEFIBRJGGHV-SJKOYZFVSA-N	430.274	1.074	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3ccccc3C)C2)C1	1840155425	BPKLZGZPQHBWMO-DENIHFKCSA-N	438.952	1.638	50	20	IDGD	
O=C(C(Cl)Cl)N1CCO[C@]2(COCCN(C(=O)C3Cc4ccccc4C3)C2)C1	1840190483	ZSNBWRQISJOFTN-FQEVSTJZSA-N	427.328	1.662	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc([C@@H](C)C#N)c3)CCO2)C1	1840716724	RCNJIKNZUXKDBA-XWFZLUIHSA-N	449.935	1.637	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccc(F)cc3OC)CCO2)C1	1840934562	FZHVGTICSMRBKU-DYESRHJHSA-N	442.915	1.851	50	20	IDGD	
CC(C)(C)OC(=O)N1CCO[C@H](C(=O)N2CCCC23CN(C(=O)C(Cl)Cl)C3)C1	1841428841	QSZRUONBMIPDMR-LBPRGKRZSA-N	436.336	1.629	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@H](CCO)NC(=O)OC(C)(C)C)C1	1841428942	AONGQVJFJDZUJZ-HUUCEWRRSA-N	431.961	1.873	50	20	IDGD	
Cn1cnc(C(=O)N2CCCC23CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C3)c1	1842526533	UBGJUDLHRLSXNJ-ZDUSSCGKSA-N	425.917	1.369	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)c2cccc(-c3cnco3)c2)C1	1845414309	MSSOKSWVGAZMGU-UHFFFAOYSA-N	431.257	1.152	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)c3cnn(C)c3C)c2)cc1	10099739	OLNLYMIRHRIJQA-UHFFFAOYSA-N	443.485	1.613	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)c1cccnc1N1CCOCC1	14372585	UKLXWIPCYCSSDH-ZDUSSCGKSA-N	449.305	1.909	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1ccc(OCc2cn3ccccc3n2)cc1	16146016	RETDQXOVIIMCMH-OAHLLOKOSA-N	428.470	1.109	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=O)COc2ccc(F)cc2)n(C)c1	16205555	GBZPVWWJXJYHFC-UHFFFAOYSA-N	426.470	1.035	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCCC2)cc1)NNC(=O)c1cccc([N+](=O)[O-])c1	17330280	AJTPYDDFQAKBHS-UHFFFAOYSA-N	446.485	1.773	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)c1cc(-c2ccco2)n(-c2cccc(Cl)c2)n1	25452961	HKWZNUCNSDEUOI-LBPRGKRZSA-N	448.888	1.981	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)C[C@@](O)(c1nc(C)cs1)C(F)(F)F	109466182	UNVRRQTZRUBTQH-MRXNPFEDSA-N	432.424	1.860	50	20	IDGD	
COC(=O)c1c(C)cccc1S(=O)(=O)NNC(=O)c1cc(OC)c(OC)c(OC)c1	116214650	XMIWHSNXLSCLDH-UHFFFAOYSA-N	438.458	1.431	50	20	IDGD	
COc1ccc(Oc2cc(CNC(=O)NNC(=O)CNC(=O)c3ccco3)ccn2)cc1	726091272	GXEPRDLJLKRIHA-UHFFFAOYSA-N	439.428	1.736	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc(CCCl)cc1)N1CCN(c2ncccn2)CC1	726598589	HYMIGCJSBPIJLE-UHFFFAOYSA-N	437.953	1.275	50	20	IDGD	
CCOc1ccc(NS(=O)(=O)c2ccc(C(=O)NNC(=O)C(=O)NC(C)C)cc2)cc1	726614843	UZJJHCDNRKRQDJ-UHFFFAOYSA-N	448.501	1.172	50	20	IDGD	
COc1ccc(CN2C[C@H](C(=O)NNC(=O)c3cc(-c4ccccc4)[nH]n3)CC2=O)cc1	726619641	NVKFTGVAOURJKI-QGZVFWFLSA-N	433.468	1.895	50	20	IDGD	
CO[C@@H](C)CCNC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	726713213	CWFKRKSHFLHBEK-HNNXBMFYSA-N	434.518	1.534	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)NCCCN2C[C@H](C)O[C@H](C)C2)c1	728742785	OOCHRWSCGWUUKF-BETUJISGSA-N	443.342	1.901	50	20	IDGD	
O=C(CCN1C(=O)COc2ccccc21)NNc1ccc(S(=O)(=O)C(F)F)cc1	728974479	PVZBVRRKNLIUEP-UHFFFAOYSA-N	425.413	1.942	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NC[C@@H]1CN2CCC[C@@H]2CO1	729494867	HYGORQCHTFDODB-JGGQBBKZSA-N	441.326	1.410	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCCCOc2ccccc2OC)c2ccccc2c1=O	729611217	KRINLHHAJKBWLX-UHFFFAOYSA-N	439.472	1.838	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)[C@H]2CCN(c3ccc4c(c3)OCCO4)C2=O)c1	730513153	VMBIKFJKIBTDLK-QGZVFWFLSA-N	439.468	1.654	50	20	IDGD	
CCS(=O)(=O)N[C@H](CCSC)C(=O)NNC(=O)c1ccc(Br)s1	730514946	FXXWABVMSRATEY-MRVPVSSYSA-N	444.398	1.333	50	20	IDGD	
CCCc1ccc(N2C[C@@H](C(=O)NNC(=O)CCN3C[C@H](C)O[C@H](C)C3)CC2=O)cc1	732264679	WGQMYZARKDEADY-SCTDSRPQSA-N	430.549	1.639	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)NCCCC(=O)N2Cc3ccccc3C2)c1	732474917	YZJILQYLUKIYJP-UHFFFAOYSA-N	426.473	1.970	50	20	IDGD	
CCCC[C@@H](NNC(=O)Cc1csc(N2CCOCC2)n1)C(=O)Nc1cc(C)on1	732917796	LGDCYFKAXHDSGA-OAHLLOKOSA-N	436.538	1.637	50	20	IDGD	
CCOCCCn1c(NNC(=O)[C@H](NC(C)=O)C2CCCC2)nc2ccccc2c1=O	733268430	LBSHVOMMTPDBAZ-LJQANCHMSA-N	429.521	1.961	50	20	IDGD	
Cc1ccc(-c2nnc(S)n2CC(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)cc1	734239470	DQMCCLURHGFYMO-UHFFFAOYSA-N	449.537	1.397	50	20	IDGD	
O=C(C[C@@H]1OCCc2ccccc21)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	734312373	BEOQSXFTYWKRHC-FQEVSTJZSA-N	443.525	1.936	50	20	IDGD	
COc1ccc(S(=O)(=O)C[C@@H](C)C(=O)NNC(=O)COc2cc(C)ccc2C)cc1	735029011	PVCXVOZOIBRQLB-MRXNPFEDSA-N	434.514	1.948	50	20	IDGD	
C=CCn1c(=O)c2ccccc2n2c(SCC(=O)NNc3cc(C)nc(C)n3)nnc12	736717259	XNNATEDDXYDKDB-UHFFFAOYSA-N	436.501	1.872	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)[C@H]1CC(=O)N(c2cc(Cl)cc(Cl)c2)C1	740851255	WNUKFCDALSSNTJ-JTQLQIEISA-N	429.304	1.799	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2ccc(NC(=O)OC(C)(C)C)cc2O)C[C@H](C)O1	740922006	NJRYOKNWOKJUEP-KBPBESRZSA-N	436.509	2.000	50	20	IDGD	
Cc1nn(C)c2sc(C(=O)N[C@H](C)C(=O)NNC(=O)COCc3ccccc3)cc12	742078323	FADIJRBXOHEPBJ-CYBMUJFWSA-N	429.502	1.426	50	20	IDGD	
CC(C)(C)C(=O)NNC(=O)CSc1nc(C2CC2)nc2c1c(O)nc(=O)n2C1CC1	742451618	YZDGCDFGGNUOJQ-UHFFFAOYSA-N	432.506	1.390	50	20	IDGD	
O=C(CCN1C(=O)[C@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O)NNC(=O)CC12CC3CC(CC(C3)C1)C2	742471289	HDABSBOIJXTYKJ-KSRNCERMSA-N	429.517	1.293	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)c2cn([C@@H]3CCS(=O)(=O)C3)nc2C(C)C)c1	742471880	KSJZSJVEYAJKKD-OAHLLOKOSA-N	434.518	1.515	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)C[C@@H](C)/N=C2/NS(=O)(=O)c3ccccc32)cc1	743293547	BKEMGNPOVWGMBL-CQSZACIVSA-N	429.502	1.072	50	20	IDGD	
O=C(C[C@H]1CN(Cc2ccccc2)CCO1)NNC(=O)C1CCN(c2ncccn2)CC1	743336765	MGYLXTATKCZYHM-FQEVSTJZSA-N	438.532	1.132	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@H]1CCCC[C@H]1NC(=O)NNC(=O)CNC(=O)c1ccco1	743578254	WULCXZLVLGOXBN-ZIAGYGMSSA-N	437.497	1.423	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)N[C@H]1CC(=O)N(CCOc2ccccc2)C1	745846345	GQDNNVLWSMLTSB-INIZCTEOSA-N	430.436	1.215	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)N[C@H]1CC(=O)N(CCOc2ccccc2)C1	745848654	VEYUHYBDDOJPKM-SFHVURJKSA-N	440.500	1.638	50	20	IDGD	
C[C@H](C(=O)NNC(=O)Cc1ccncc1)N1C(=O)c2ccc(Br)cc2C1=O	747323145	KMGRFDXCKUBIPF-SNVBAGLBSA-N	431.246	1.219	50	20	IDGD	
Cc1nc(C(=O)NNC(=O)c2cccc3ncccc23)nn1-c1n[nH]c(C(F)(F)F)n1	747383772	OJROQEAYZDUULL-UHFFFAOYSA-N	431.338	1.336	50	20	IDGD	
CCn1cnnc1CNC(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1	747979222	FERYARFYMAMYOG-HXUWFJFHSA-N	433.516	1.756	50	20	IDGD	
O=C(NCCN1CCOCC1)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1	747980285	VAIAWYHRKSOUOO-JOCHJYFZSA-N	437.544	1.276	50	20	IDGD	
Cc1cc(C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)nc2nc(O)nc(O)c12	748610957	XFQGIBWIDAGACL-UHFFFAOYSA-N	425.373	1.498	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N[C@H]2CC(=O)N(C(C)(C)C)C2)cc1Br	750663511	UROSWGFIGSXJIY-NSHDSACASA-N	427.299	1.801	50	20	IDGD	
CNS(=O)(=O)CC(=O)NNC(=O)c1cc(-c2ccc(Cl)cc2)nc2ccccc12	751560490	ATCIGEMXBXMMBK-UHFFFAOYSA-N	432.889	1.865	50	20	IDGD	
O=C(NNC(=S)NCCc1cccs1)c1sccc1S(=O)(=O)N1CCCC1	753079661	VSICVYRGKQWOCL-UHFFFAOYSA-N	444.629	1.946	50	20	IDGD	
N#Cc1ccc(CN2CC[C@@H](NC(=O)NNC(=O)CSc3ccccc3O)C2=O)cc1	753288801	LPFXIIFADVXCFY-MRXNPFEDSA-N	439.497	1.487	50	20	IDGD	
COc1cccc(C(=O)NNS(=O)(=O)c2ccc(C(=O)O)c(C(F)(F)F)c2)c1O	754746615	BVWIJOZXOJHBGL-UHFFFAOYSA-N	434.348	1.741	50	20	IDGD	
COc1ccccc1[C@]1(C)NC(=O)N(CC(=O)NNc2ccc(C(F)(F)F)nn2)C1=O	755187880	SVBDJSNMESRGGF-KRWDZBQOSA-N	438.366	1.414	50	20	IDGD	
COc1ccc(S(=O)(=O)NC2CC2)cc1NC(=O)NNC(=O)COCc1ccccc1	755614743	SBDYZJHZTLJDKP-UHFFFAOYSA-N	448.501	1.505	50	20	IDGD	
CNC(=O)c1ccc(CN(CC(=O)NNC(=O)c2ccc(OC)c(OC)c2)C2CC2)cc1	756481660	LZOZZUNRQGRHLN-UHFFFAOYSA-N	440.500	1.489	50	20	IDGD	
CNS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2cc(F)ccc2Br)cc1	756641590	WZHUQKYSDWQCMB-UHFFFAOYSA-N	445.270	1.963	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)[C@](C)(O)CN1Cc2ccccc2C1=O	756798507	XYNAGCONMFJPCF-JOCHJYFZSA-N	427.457	1.019	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CN2C(=O)NC3(C[C@H](C)C[C@@H](C)C3)C2=O)cc1C	757633253	JXYHKJVXUVXKKW-CHWSQXEVSA-N	443.504	1.136	50	20	IDGD	
CCS(=O)(=O)N1CCC(CNC(=O)NNC(=O)COc2cc(C)cc(C)c2)CC1	758741713	FVKPEGAJBRFXCK-UHFFFAOYSA-N	426.539	1.074	50	20	IDGD	
CN(NC(=O)[C@H]1CC(=O)Nc2cc(F)ccc21)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758785188	CBXCASOHHLYWEZ-HNNXBMFYSA-N	449.483	1.887	50	20	IDGD	
C[C@H](CC(=O)NNC(=O)Cc1ccccc1F)NS(=O)(=O)c1cccnc1Cl	760555766	LBWVRMOLTUFEBL-LLVKDONJSA-N	428.873	1.321	50	20	IDGD	
Cc1nc(Cl)cc(NNC(=O)c2cc(S(=O)(=O)N3CCOCC3)ccc2F)n1	761570002	WVYKYXWOESZITQ-UHFFFAOYSA-N	429.861	1.355	50	20	IDGD	
Cc1nc(C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)nn1-c1n[nH]c(C(F)(F)F)n1	762933078	SZDSLRIENASGTA-UHFFFAOYSA-N	446.353	1.178	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)N[C@@H]2CC[C@H]3SCCS[C@@H]23)nc1	763059360	BFIFTMNBTIFUJO-NFAWXSAZSA-N	431.609	1.774	50	20	IDGD	
NS(=O)(=O)c1ccc(NC(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)cc1	763266809	UJAPOXMXFKZCRF-UHFFFAOYSA-N	425.417	1.653	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(C)oc2C)cc1	763576459	LBKYRBOTNNXMER-UHFFFAOYSA-N	436.490	1.327	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(OCc3noc(C)n3)cc2)c1	763631060	SZTSGFCMMPOYQI-UHFFFAOYSA-N	439.428	1.430	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1c2c(nn1-c1ccccc1)CCC2	763663455	IZESPWFCCCGIDF-UHFFFAOYSA-N	449.467	1.535	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2cnc(Br)c(C)c2)c1	763664886	LYABVVAIUJSVIB-UHFFFAOYSA-N	435.278	1.934	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(F)cc1OCC#N	763683847	BFVALKNHDOLSHZ-UHFFFAOYSA-N	430.392	1.292	50	20	IDGD	
CSc1ccc(C)c(NC(=O)C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c1	763790509	JNWFQNYBSRXTEY-UHFFFAOYSA-N	425.470	1.364	50	20	IDGD	
Cc1ccc(F)cc1NC(=O)C(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12	763790786	OJQAIVDXLPMGMY-UHFFFAOYSA-N	425.420	1.825	50	20	IDGD	
N#Cc1cccc(OCc2cccc(C(=O)NNC(=O)CNC(=O)c3cccnc3)c2)c1	763825558	ZQVQYFVWNMFTNP-UHFFFAOYSA-N	429.436	1.723	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccc(C(=O)NC2CC2)cc1	763850965	RHFRIFKROSYBJE-LBPRGKRZSA-N	428.420	1.271	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)C(=O)Nc1ccnc(C(=O)N(C)C)c1	763852405	IMWHTTUBZWIZGR-CQSZACIVSA-N	449.467	1.490	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccc(N3CCSCC3)c(C)c2)n1	763882852	WUUFUJQFGYZVAQ-UHFFFAOYSA-N	430.534	1.148	50	20	IDGD	
N#Cc1ccc(-n2ccc(NC(=O)C(=O)NNC(=O)Cc3ccc(F)cc3)n2)c(Cl)c1	763918903	KLFAWTJHZYXIBG-UHFFFAOYSA-N	440.822	1.865	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(OC(C)C)c(OC)c2)cc1F	763920791	DJSPDYLLCDRKGX-UHFFFAOYSA-N	447.419	1.808	50	20	IDGD	
Cc1c(CS(C)(=O)=O)cccc1NC(=O)C(=O)NNC(=O)Cc1ccc(Cl)cc1	763932289	PCWWHJLQTYTDPL-UHFFFAOYSA-N	437.905	1.522	50	20	IDGD	
Cn1cc(Br)cc(NC(=O)NNC(=O)CSc2ccccc2O)c1=O	763968487	CWWBAYUNXQALEK-UHFFFAOYSA-N	427.280	1.798	50	20	IDGD	
O=C1C[C@H](c2cccc(NC(=O)C(=O)NNC(=O)c3cccc(Br)c3)c2)CN1	764063858	YZGQLYNIDUBCQM-ZDUSSCGKSA-N	445.273	1.452	50	20	IDGD	
CCOC(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(C)cc3)[nH]n2)c1	764111900	SJMFXCYOUMQYTR-UHFFFAOYSA-N	449.467	1.890	50	20	IDGD	
COC(=O)c1ccc(-n2cc(C)cn2)c(NC(=O)C(=O)NNC(=O)CC(F)(F)F)c1	764115944	GKLWSLVUMKWJGO-UHFFFAOYSA-N	427.339	1.006	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2cc(C)nn2[C@@H]2C[C@H]3CC[C@H]2C3)c1O	764130938	BUFBWPSUNMRFIJ-KCQAQPDRSA-N	427.461	1.667	50	20	IDGD	
CC(=O)N(Cc1ccc(NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)cc1)C1CC1	764240061	ZAJPAIHICIRXPY-UHFFFAOYSA-N	447.495	1.938	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc3ccccc3o2)cc1	764330540	BBDZVWFXNOEYFX-UHFFFAOYSA-N	444.469	1.519	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)C(=O)Nc1cccc(N2CCOC2=O)c1	764351218	PMKZPCMQTZMIOZ-UHFFFAOYSA-N	434.412	1.229	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)C(=O)Nc1ccccc1CN1C[C@@H](C)O[C@H](C)C1	764386150	RNARJSBFHONAJQ-HZPDHXFCSA-N	425.489	1.399	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COCCO1)C(=O)Nc1cccc(CSCc2ccccc2)c1	764426683	VUJDIOJTYYIGOC-SFHVURJKSA-N	429.498	1.621	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@@H]2C(=O)NNc1nccc(N2CCOCC2)n1	764655825	MMTCENDREMHRJH-OAHLLOKOSA-N	432.525	1.794	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc2c3c(c1)CC(=O)N3CCC2)c1cccc(OC(F)F)c1	764936020	VVCGYEVXZBIOIH-UHFFFAOYSA-N	437.424	1.747	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C)c(C)c(NC(=O)C(=O)NNC(=O)OC(C)(C)C)c1	765392729	KEWFWQXCVNFNHY-UHFFFAOYSA-N	442.538	1.828	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)c2ccc(N3CCNC3=O)c(C)c2)n[nH]1	765592456	MNELSVSQFZKBSJ-UHFFFAOYSA-N	434.456	1.998	50	20	IDGD	
O=C(CCCOc1cccnc1)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	765751591	OACIHHOQIQFJLZ-UHFFFAOYSA-N	445.951	1.859	50	20	IDGD	
COC(=O)c1ccc(C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)nc1	765757560	WKGTZYOZECEZJY-UHFFFAOYSA-N	445.907	1.100	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)c3c(C)cccc3C)CC2)cc1	766635707	DFRKTEQDHNQVMN-UHFFFAOYSA-N	444.557	1.379	50	20	IDGD	
C[C@H](NC(=O)C1CCCC1)C(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	766660498	MTWAAEITMSECAR-INIZCTEOSA-N	449.983	1.300	50	20	IDGD	
CC(C)(C)N1C[C@H](C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)CC1=O	766660644	QJYTZJJPCPPVRG-QGZVFWFLSA-N	449.983	1.252	50	20	IDGD	
COc1ccc(NNC(=O)CCNS(=O)(=O)c2cccc(C(C)=O)c2)c([N+](=O)[O-])c1	768335129	GSVBXWXKGTVMOI-UHFFFAOYSA-N	436.446	1.618	50	20	IDGD	
C[C@H]1CCCC[C@@]12NC(=O)N(CC(=O)NNc1nc(O)c3cnn(C(C)(C)C)c3n1)C2=O	770958076	HMLSLBVHVMKEFX-PRWKNARSSA-N	444.496	1.231	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)Cc3csc(NC(=O)c4cccc(O)c4)n3)nc21	771019926	HCAZMSLLBVPZAV-UHFFFAOYSA-N	440.445	1.169	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)N[C@H]2CCO[C@]3(CCOC3)C2)c2ccccc2c1=O	771432513	ASHZXGWNWQBCRO-OYHNWAKOSA-N	443.504	1.479	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)CNS(=O)(=O)c2c(C)noc2C)c1	771815723	RQTNPIOGFXLZSO-UHFFFAOYSA-N	438.506	1.228	50	20	IDGD	
O=C(Cc1csc(-c2ccccn2)n1)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772188244	IVWFXQSGIVFBDN-UHFFFAOYSA-N	429.889	1.865	50	20	IDGD	
CC(C)[C@H]1C[C@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)CCO1	772622079	SXWWAFYFEVGVPT-SJLPKXTDSA-N	438.550	1.619	50	20	IDGD	
Cc1c(/C=C(\C#N)C(=O)NNC(=O)[C@H]2CCCN(C(=O)OC(C)(C)C)C2)cc(C#N)n1C	773412480	WBKGGCCMTIRRAO-ZUZCKIMGSA-N	440.504	1.907	50	20	IDGD	
O=C(NNc1ccccc1[N+](=O)[O-])C(=O)Nc1ccc(CN2C(=O)CCCC2=O)cc1	773654404	UJFPGBQVDYUYJH-UHFFFAOYSA-N	425.401	1.716	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNc2nccc(OC)n2)sc2c1CC[C@@H](C)C2	773726141	JECYUXKZVRXUQM-SNVBAGLBSA-N	433.490	1.930	50	20	IDGD	
COC(=O)c1ccc(C)c(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)c1	774009456	PWJRFABDSMXKOC-GFCCVEGCSA-N	433.848	1.988	50	20	IDGD	
O=C(CSc1ccc(Cl)cc1)NNC(=O)N[C@H]1CCO[C@@]2(CCS(=O)(=O)C2)C1	776075728	DIHNKNGNKMBKSB-GUYCJALGSA-N	447.966	1.499	50	20	IDGD	
CCO[C@@H]1C[C@H](NC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])[C@H]1Oc1ccccc1	776534404	PNNQAHDAKBJVES-QKYXUNIQSA-N	444.444	1.929	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCC(n3ccc(C(F)(F)F)n3)CC2)n1	778967573	CLVACMZIGSYSNM-UHFFFAOYSA-N	430.456	1.694	50	20	IDGD	
Cn1c(=O)c2cc(C(=O)NNc3ccc([N+](=O)[O-])cc3Br)cnc2n(C)c1=O	779141167	XOLRVXQFWIBBAV-UHFFFAOYSA-N	449.221	1.060	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)[C@H](O)[C@H](O)c3nc4ccccc4s3)n[nH]2)cc1	779499446	HLWSDCNAALTFCU-MSOLQXFVSA-N	437.481	1.850	50	20	IDGD	
CCn1c(=O)c(C(=O)/C(C#N)=C\c2c(Cl)cnn2C)c(N)n(Cc2ccccc2)c1=O	780148307	PRIFYDUONMPVOG-ZROIWOOFSA-N	438.875	1.837	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)NCc1ccccc1CN1CC[C@H](O)C1	781954203	LOJUUIQKQWQYKZ-QAPCUYQASA-N	430.480	1.690	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(N2CCOCC2)c(NC(=O)NN=c2cc[nH]cc2)c1	782006474	JMWUHDCMYPGCBX-UHFFFAOYSA-N	448.549	1.519	50	20	IDGD	
Cc1ccccc1NC(=O)NNC(=O)C(=O)Nc1ccc(S(=O)(=O)N(C)C(C)C)cc1	783417622	XHZPIMLTQUWIAX-UHFFFAOYSA-N	447.517	1.815	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2ccc(NC(=O)C(=O)NNc3ccccc3)cc2)C[C@H](C)O1	784765009	KZVWFQRJSIRQAL-GJZGRUSLSA-N	432.502	1.566	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ccc(OC(F)(F)F)cc2)cc1S(N)(=O)=O	784803623	FWUVLZFCWHKYFR-UHFFFAOYSA-N	432.380	1.623	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)C(=O)Nc2cc3c(cc2Cl)OCCO3)c1	784844813	PJYPJLFDKSLSMT-UHFFFAOYSA-N	425.850	1.597	50	20	IDGD	
Cc1ccc(Oc2ccc(NC(=O)C(=O)NNC(=O)Cc3cn4ccccc4n3)cc2)nn1	785067152	HPBNBFMTRYSMGC-UHFFFAOYSA-N	445.439	1.554	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2cnn(CC(=O)NC3CCCC3)c2)cc1Cl	785117419	PHUMHXOXZJHTHG-UHFFFAOYSA-N	434.884	1.686	50	20	IDGD	
O=C(CN1CCOCC1)Nc1ccc(NC(=O)C(=O)NNc2ccc(Cl)c(F)c2)cc1	785179609	JFIFSKGBJHRUCC-UHFFFAOYSA-N	449.870	1.832	50	20	IDGD	
COc1cc(F)cc(NNC(=O)C(=O)Nc2ccccc2N2CCC(C(N)=O)CC2)c1	785234603	NNGLQNUXNNMNPP-UHFFFAOYSA-N	429.452	1.618	50	20	IDGD	
N#C/C(=C/c1ccc(F)cc1)C(=O)Nc1cccc(S(=O)(=O)N2CCNC(=O)C2)c1	785238791	JGTNGCQRTUFLNX-GDNBJRDFSA-N	428.445	1.492	50	20	IDGD	
C[C@@H]1Cc2cc(S(N)(=O)=O)ccc2N1C(=O)COC(=O)/C(C#N)=C\c1ccccc1	785352739	ZSEIBSJRDGYIKI-AYCSXLNKSA-N	425.466	1.762	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ncccc2OCCCC#N)c1	786149486	JXZBBJMHXMTTCK-UHFFFAOYSA-N	446.489	1.481	50	20	IDGD	
O=C(CCc1ccc(O)nc1)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	786641105	RVTWIDVMIFZGEI-UHFFFAOYSA-N	443.463	1.939	50	20	IDGD	
CCOC(=O)[C@](C)(CNC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)c1ccccc1	787254751	JRNKOCUIZZXLRA-OAQYLSRUSA-N	437.460	1.127	50	20	IDGD	
O=C(NNC(=O)C12CCC(C(=O)NNC(=O)c3cccnc3)(CC1)CC2)c1cccnc1	789867254	PBKCLEJVZHRYAZ-UHFFFAOYSA-N	436.472	1.039	50	20	IDGD	
Cn1nc([C@H]2CCCOC2)cc1NC(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	790542244	PEZDHWMFXLUYAY-ZDUSSCGKSA-N	425.449	1.672	50	20	IDGD	
Cc1nc2c(cnn2C(C)C)cc1C(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	792703036	AUIZDCWMMZRWGY-UHFFFAOYSA-N	440.416	1.847	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C[C@@H]1COCCN1C(=O)OC(C)(C)C	794779931	IGFSQJDGTUFLKQ-UONOGXRCSA-N	425.457	1.766	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)[C@@H](F)CC2CCCCC2)CC1	795109764	QOEDUIILBVRTDC-INIZCTEOSA-N	427.546	1.769	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2cnn(-c3ccccc3Br)c2)n1	797371460	VDDZKVSSWXBMSZ-UHFFFAOYSA-N	443.261	1.738	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)N2CCN(CC(=O)N3C[C@@H](C)C[C@@H](C)C3)CC2)cc(C#N)n1C	798117154	SHIYMQQIXAZRFU-WEMGFAGASA-N	436.560	1.761	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2c(C)nn(C)c2Br)c2ccccc2c1=O	800798723	QXTHJPUJCTZQMU-UHFFFAOYSA-N	447.293	1.686	50	20	IDGD	
Cn1nnc2c(C(=O)NNC(=O)[C@H]3Cc4ccccc4CN3Cc3ccccc3)ccnc21	801145514	AMNIVHLJIBMSKN-HXUWFJFHSA-N	441.495	1.751	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1cccc(NN2C(=O)[C@H]3CC=CC[C@H]3C2=O)c1	801882251	XQRABDPAGFXXQM-VBNZEHGJSA-N	428.445	1.067	50	20	IDGD	
COc1cnc2ccccc2c1C(=O)N1CCN(S(=O)(=O)CBr)CC1	801946642	QSEFLEXOLWNBOA-UHFFFAOYSA-N	428.308	1.683	50	20	IDGD	
O=C(NNC(=O)c1ccc(CN2C(=O)CNC2=O)cc1)Nc1ccc(Br)cc1	801994613	VIMFOMMYVILHEG-UHFFFAOYSA-N	446.261	1.967	50	20	IDGD	
O=C(CCOc1ccccc1I)NNC(=O)N=c1cc[nH]cc1	802025548	BIQIXZKNXITKTN-UHFFFAOYSA-N	426.214	1.730	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2ccc(C#N)c(Cl)c2)c1	802441447	MDQNZSUNUPJWNC-UHFFFAOYSA-N	435.893	1.606	50	20	IDGD	
O=C(NC[C@H](N1CCOCC1)C(F)(F)F)NNC(=O)c1ccc(Br)s1	804872424	KEHPBOUACLZHCJ-VIFPVBQESA-N	445.261	1.718	50	20	IDGD	
COCCNC(=O)[C@@H](C)OC(=O)c1ccc(NC(=O)NNC(=O)c2cccc(C)n2)cc1	806746770	VRHUHZXFILKUHI-CQSZACIVSA-N	443.460	1.164	50	20	IDGD	
O=C(CN1CCCc2ccccc21)NNC(=O)C(=O)Nc1nc(-c2ccco2)cs1	806973916	NWBPIBORPLZPHU-UHFFFAOYSA-N	425.470	1.942	50	20	IDGD	
CSCC[C@@H](NC(=O)c1ccccc1Cl)C(=O)NNC(=O)N1CCN(C)CC1	807380166	QNZYPBUKZOEPCL-OAHLLOKOSA-N	427.958	1.180	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)N=c1cc[nH]c2ccc(Oc3ccccc3)cc12	809892235	PVYVALZYTPUQDJ-ZDUSSCGKSA-N	443.485	1.539	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CC[C@@]3(CCc4ccccc4O3)C2)cc1OC	810048079	VADONOCPMHWNSK-QHCPKHFHSA-N	425.485	1.935	50	20	IDGD	
COc1cc(F)c(F)cc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccccc2OC)[nH]n1	810387513	YXZAORKLTKCHDV-UHFFFAOYSA-N	445.382	1.772	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc2ccccc2c1)NNC(=O)COCc1ccccc1	810424071	MBFYBFNLBKQYHK-UHFFFAOYSA-N	427.482	1.482	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(=NNC(=O)N[C@@H]2CCS(=O)(=O)C2)[C@@H]([C@H]2CCOC2)C1	812227166	SVOBWYFUGIUVJT-RRFJBIMHSA-N	444.554	1.122	50	20	IDGD	
CC(=NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1)c1cc(N)ccc1F	814876637	AFOITIGNQVEBDC-UHFFFAOYSA-N	447.536	1.563	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)c1cn2c(Br)cnc2s1	815623318	UPGJHFPJDHRWHF-UHFFFAOYSA-N	447.315	1.627	50	20	IDGD	
CN(CC(=O)NNC(=O)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1)c1ccccc1[N+](=O)[O-]	819659688	ZJGRIUKRSALFIB-CQSZACIVSA-N	435.481	1.826	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1ccc(Cl)cc1)C(=O)OCC(=O)NNC(=O)c1ccccc1	834691628	RXBHKECTIBTOLK-GFCCVEGCSA-N	439.877	1.011	50	20	IDGD	
COc1ccccc1NC(=S)NNC(=O)c1cc(Cl)c(OCC(N)=O)c(OC)c1	836494045	OTAUNBPSQQATGY-UHFFFAOYSA-N	438.893	1.853	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)[C@@H](C)N2C(=O)c3ccc(C)cc3C2=O)cc1OC	894106676	QWNXHBGKMXQVSH-CYBMUJFWSA-N	425.441	1.848	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)[C@H](C)N2C(=O)c3ccc(C)cc3C2=O)cc1OC	894106677	QWNXHBGKMXQVSH-ZDUSSCGKSA-N	425.441	1.848	50	20	IDGD	
CSC[C@H](C(=O)NNC(=O)COc1ccc(F)cc1)N1C(=O)[C@H]2CCCC[C@H]2C1=O	910865620	WYNGJOISGFUNCR-OWCLPIDISA-N	437.493	1.259	50	20	IDGD	
COc1ccc([C@@H](CNC(=O)NNc2cncc(Cl)n2)N2CCOCC2)cc1OC	915894557	DBCIMBZXPCIJFY-CQSZACIVSA-N	436.900	1.847	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)NCc1ccc(OCC(F)(F)F)nc1	916398505	MJFKBHGZPJOTTL-UHFFFAOYSA-N	428.367	1.941	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCc1nnc2n1CCCC2	916648305	SAKMJQNKPSZBLN-NSHDSACASA-N	437.298	1.675	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCC(C(=O)N3CCC[C@@H](C)C3)CC2)cc1OC	917106101	QRGKTKNPVLJGIJ-MRXNPFEDSA-N	446.548	1.435	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)CCNS(=O)(=O)c3cccs3)n[nH]2)cc1	917175797	LGXLDBOIVRHDKE-UHFFFAOYSA-N	433.515	1.576	50	20	IDGD	
CCN1C(=O)c2ccc(C(=O)NNC(=O)[C@H](C)Oc3ccccc3F)cc2S1(=O)=O	917519001	FVVSUVQJUGFIJM-NSHDSACASA-N	435.433	1.219	50	20	IDGD	
COc1ccc(C(=O)NCCNC(=O)NNC(=O)c2ccc(Br)s2)cc1	918003313	OWXOHFNXEZMXDU-UHFFFAOYSA-N	441.307	1.893	50	20	IDGD	
CS(=O)(=O)c1ccc(C=NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1	918153554	GGLWHLPRTQYGGJ-UHFFFAOYSA-N	435.527	1.639	50	20	IDGD	
O=C(CCn1ccnc1)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	920423388	ONKDEZZAINEGHW-UHFFFAOYSA-N	427.486	1.213	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)[C@H](C)OC[C@@H]2CCCO2)c2ccccc2c1=O	921021468	IPKRTHJOQDZULE-HOTGVXAUSA-N	430.505	1.932	50	20	IDGD	
CC(C)[C@@H](C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)N1C[C@H](C)O[C@H](C)C1	921203187	TXDWDWUCEKFBTQ-MZKRTTBSSA-N	445.608	1.480	50	20	IDGD	
O=C(COC(=O)c1cc2cc(Cl)ccc2[nH]1)NNC(=O)[C@@H]1COc2ccccc2O1	928990804	XYBFIRCLLJIGPQ-KRWDZBQOSA-N	429.816	1.966	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CS[C@@H](Cc2ccccc2F)C(=O)N1)c1ccc2ccccc2n1	935742358	HMWCSKUYIMCRQZ-OALUTQOASA-N	438.484	1.978	50	20	IDGD	
N#C/C(=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)N1C[C@@H]2C[C@@]2(CO)C1	1116724620	YSCYQCHZZNTGLL-ZCKWUANPSA-N	439.903	1.827	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNS(=O)(=O)c2c(F)cc(C#N)cc2F)CC1	1252862427	ZMNLQJRZYVSQKG-UHFFFAOYSA-N	444.460	1.793	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCCOc1ccc2c(c1)CCC2	1317930468	YNDCJHZOSUXVFX-UHFFFAOYSA-N	445.545	1.800	50	20	IDGD	
Cc1ccc(NC(=S)NNC(=O)c2ccc(S(=O)(=O)N(C)CCO)cc2)c(C)c1	1335850257	FXRDAGTXQJGCRJ-UHFFFAOYSA-N	436.559	1.548	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3nc4ccccc4n(C)c3=O)C2)C1	1777889662	BTEWWSREQGDWHK-LHSJRXKWSA-N	432.908	1.394	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](COC)NC(C)=O)C1	1779552830	AIMZZDCRIUIXIW-TVKQPGBESA-N	431.961	1.059	50	20	IDGD	
COc1cc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](F)Cl)CCO3)c([N+](=O)[O-])cc1O	1780193914	AQMXALABBCGFFT-WMLDXEAASA-N	431.804	1.287	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)n1cccn1)C2	1782002898	WUEWBWRRKYLVQI-OIPACUDHSA-N	427.343	1.741	50	20	IDGD	
C/C(=C/C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)CBr)C2)C(=O)O	1783154311	FDEMVBQEPUOATO-CMNNGIEUSA-N	431.327	1.562	50	20	IDGD	
C=CCNC(=O)/C=C\C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]21	1783531143	DHOPURSMNLVQBZ-NWUHITEESA-N	432.348	1.061	50	20	IDGD	
CS(=O)(=O)c1ccc(CC(=O)N2CCO[C@]3(CCN(C(=O)C(Cl)Cl)C3)C2)cc1	1783947289	RLHSYDSKVTUWAX-GOSISDBHSA-N	449.356	1.266	50	20	IDGD	
CCOc1ncc(Cl)cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]2C1	1784091277	MSBQVORKXBEBRU-KSYCFECVSA-N	446.331	1.327	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCNC(=O)c3ccc[nH]3)[C@H]2C1	1785246994	DFVBVVRIMAZETM-OVWQWFNUSA-N	438.956	1.522	50	20	IDGD	
CC(C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C[C@@H]21	1786349694	JWICMHTUUQOPJG-VGWMRTNUSA-N	431.961	1.754	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnn4cccnc34)C[C@@H]21	1786407268	VIWGXLYZJKKDTO-QEJZJMRPSA-N	436.310	1.108	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3C[C@@]34C(=O)Nc3ccccc34)C[C@@H]21)[C@H](F)Cl	1787448728	ACWHGFOOFVMHQL-OKMYWALYSA-N	435.883	1.411	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H]1C[C@H](C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]3C2)C1	1787451229	BMCAFJULACRPMD-OJFNHCPVSA-N	447.935	1.804	50	20	IDGD	
Cc1nn(C)cc1C(=O)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1	1788145354	ZQBVIZYFRPLTOA-UHFFFAOYSA-N	432.289	1.470	50	20	IDGD	
C[C@@H](Sc1cccs1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21	1788483441	ZISZPXPIYIMUMH-FQKPHLNHSA-N	432.995	1.808	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)COC(=O)C(F)(F)F)[C@H]2C1	1788530580	FXKVWOBLLLSMEG-USXUVBGUSA-N	449.253	1.308	50	20	IDGD	
O=C(C/N=C/c1ccco1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21	1788679882	ZEUIGTOOJVMGHM-JTZBESRQSA-N	430.274	1.369	50	20	IDGD	
CC(C)n1cnc(C(=O)Nc2ccc(C3(NC(=O)c4cccc(B(O)O)c4)CCC3)cc2)n1	1788791045	QPHKYVRKCISPPR-UHFFFAOYSA-N	447.304	1.600	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1ccc(C2(NC(=O)CCn3ccnn3)CCC2)cc1	1789523499	CVVVBGPIJOPRPT-UHFFFAOYSA-N	448.487	1.115	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3c(C)c[nH]c3C)C[C@@H]21	1791249557	LSWNAMZSIYZUOM-KANFNMMFSA-N	425.957	1.798	50	20	IDGD	
CCOC(=O)C(C)(C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CO[Si](C)(C)C)C[C@@H]21	1792226999	WAHJEDVUUAKMOT-JYJNAYRXSA-N	428.602	1.407	50	20	IDGD	
Cc1nccn1[C@H](C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)CBr	1792873275	RLJFZXFPMNBSJP-FSNAAORZSA-N	427.343	1.373	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C(=O)C1CC1	1793021197	QRCQUBIWTYJCKL-QDMKHBRRSA-N	429.429	1.751	50	20	IDGD	
Cc1cccc(CCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)c1	1793969288	CLKLVGANGBSSKC-REPLKXPHSA-N	435.528	1.878	50	20	IDGD	
Cc1ncccc1CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnccc1C(=O)NN)C2	1794185655	ITCAWOPPGNDRNF-BCDXTJNWSA-N	436.516	1.273	50	20	IDGD	
Cn1ncnc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1794910225	QBXQQLSOKOOUON-CRWXNKLISA-N	440.932	1.199	50	20	IDGD	
C[C@@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)n1cccc1C=O	1795750718	WDRQEUNOKXUFPB-ZZVJUGKHSA-N	430.274	1.142	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1Cc2ccccc2CN1	1796327819	MZFNISHQFIMZPQ-VPMQLGLMSA-N	440.371	1.527	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CSc1ccccc1[N+](=O)[O-])C2)[C@H](F)Cl	1796369438	YCKQDJMJAZXFOD-OJXGSEEGSA-N	431.873	1.811	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1n[nH]c(C3CC3)c1F)C2	1800757641	HNPQOYZWARIIGO-GMTLJSCSSA-N	429.290	1.413	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCCc1ccccc1F)C2	1801008841	DQNCUBIISUFBQN-FEJSZKPUSA-N	448.539	1.111	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2c(c1)CCCO2	1801673069	MQPCDQBGOPCLMK-GMLZMKKNSA-N	437.334	1.998	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](CC)NC(=O)OC(C)(C)C	1801961037	NMZXLLGMEASTGV-NPJQDHAYSA-N	431.961	1.897	50	20	IDGD	
Cc1cc(NC(=O)CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](C)Br)no1	1801961056	DWZQNNGEEIELNP-FVCCEPFGSA-N	427.299	1.733	50	20	IDGD	
CCSc1ncccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCC(=O)NN(C)C	1802328735	CNNWXLFNMIRWNL-MUJYYYPQSA-N	433.578	1.818	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)C(Cl)Cl)[C@@H]1c1cccnc1)c1cccc(=O)n1O	1804951690	PGUIBYPZEYBHJA-IUODEOHRSA-N	425.272	1.604	50	20	IDGD	
Cc1ccc(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)cn1	1805455576	UTVIGRXQXPQRLZ-SIKLNZKXSA-N	444.300	1.098	50	20	IDGD	
Cn1cnc(C(=O)N2CCC3(CCCN(C(=O)[C@H](O)CCl)C3)CC2)c1C(F)(F)F	1805523765	VDTLCNIOYUHEPP-GFCCVEGCSA-N	436.862	1.883	50	20	IDGD	
CS(=O)(=O)CCC(=O)N1CC[C@@H](CNC(=O)CCBr)[C@H]1c1cccnc1	1806345952	KSHDHVFAAAPUNU-WMLDXEAASA-N	446.367	1.307	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)Cc2ccccc2)[C@@H]1c1cccnc1	1806519406	CHUOBVHBGRXHDQ-RDPSFJRHSA-N	437.544	1.703	50	20	IDGD	
CC(C)=NO[C@H](C)C(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1808869472	RWOJYLDDROROPM-HGHGUNKESA-N	446.552	1.261	50	20	IDGD	
CC(=O)N/C(C)=C/C(=O)N1CC[C@H](CNC(=O)CO[Si](C)(C)C)[C@@H]1c1cccnc1	1810544712	QVKUSEDKTZFFKE-YQUMUYQISA-N	432.597	1.979	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cccn(C(F)F)c2=O)[nH]n1)[C@H](O)CCl	1814873363	QCIMCSJCJFSOKJ-CHWSQXEVSA-N	443.838	1.872	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CS(C)(=O)=O)n[nH]1	1817059483	JVFPWMQGMKKRCO-PWSUYJOCSA-N	435.344	1.620	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1)c1ccc(-n2cnnc2)cc1	1817204031	PHKJKKHIXANGMS-IRXDYDNUSA-N	443.895	1.896	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H]2CCOC2)[nH]n1	1818114421	ZITAVTDXDYKTDB-WLTXSABTSA-N	441.492	1.572	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H]2C[C@H](O)CN2)n[nH]1	1820746675	OSCGYDKTDOMFPG-UVLXDEKHSA-N	428.331	1.156	50	20	IDGD	
CC[C@@H](Br)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H]2CNC(=O)O2)[nH]n1	1822083889	DJRWCTXZXSKMHC-JLLWLGSASA-N	428.287	1.684	50	20	IDGD	
C[C@H](Br)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2CCC(=O)N2C)[nH]n1	1822190676	UQOAVRAZCQJCAJ-DRZSPHRISA-N	426.315	1.806	50	20	IDGD	
C[C@H](Br)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCS(C)(=O)=O)[nH]n1	1822192383	SWBAKMUWASDRFK-CMPLNLGQSA-N	435.344	1.620	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnc[nH]2)CC1	1825884088	KAOJWROABRAWJU-UAHQCSBISA-N	439.520	1.777	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)COc1ccccc1)CC2	1826085461	VFZFILYMRCUAMI-AWEZNQCLSA-N	445.545	1.507	50	20	IDGD	
CN[C@H](CC(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H](C)CBr)CC1)C(=O)O	1826938463	AAOFAWVIOFSYEG-IMJJTQAJSA-N	446.386	1.700	50	20	IDGD	
O=C(C[C@@H]1CCCCO1)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827055596	FGEDHIHVNXWYJG-FCHUYYIVSA-N	442.365	1.559	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)Cc2cccnc2)CC1	1827202302	WOONODWMYXGYFM-JOCHJYFZSA-N	435.333	1.237	50	20	IDGD	
CCN(C)[C@@H](C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1	1828924413	QRADGWWAFKUIGC-JXFKEZNVSA-N	444.580	1.259	50	20	IDGD	
CC(C)O[C@@H](C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1	1829020187	LPPKHKYNIIKRFI-UWJYYQICSA-N	430.354	1.413	50	20	IDGD	
Cc1nccnc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1	1829437566	UHCUXNVIFTVJFE-HXUWFJFHSA-N	436.321	1.012	50	20	IDGD	
Cc1cc(Cl)ccc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1830719801	KSTLKLMYASJJOY-LPHOPBHVSA-N	431.316	1.318	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3[nH]nc4ccncc34)C2)C1	1831647139	RAWGFFQGQUXAFN-FOIQADDNSA-N	435.912	1.435	50	20	IDGD	
COCCOCC(=O)N1CCC(N2CCC(NC(=O)[C@@H](C)CBr)CC2)CC1	1833262070	HUHCPZMSQJWAAU-HNNXBMFYSA-N	448.402	1.252	50	20	IDGD	
C[C@@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)c3cnnn3C)CC2)CC1	1833265448	WOLLIYKYGUCXGS-ZDUSSCGKSA-N	441.374	1.031	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)Cc3ccc(C)nc3)CC2)CC1	1833866425	GQPUFZVREVCZMR-HXUWFJFHSA-N	436.984	1.758	50	20	IDGD	
CSCC(C)(C)C(=O)N1CCOC[C@]2(CN(C(=O)CCBr)CCO2)C1	1834818967	FXWINDAHMISESB-KRWDZBQOSA-N	437.400	1.617	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)c1nccc2occc12	1834928050	JYPUUHVHKHTXIW-KRWDZBQOSA-N	434.924	1.613	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccc(F)cc3)CCO2)C1	1835052100	QWKPTWKHWPDGEL-PXNSSMCTSA-N	428.888	1.078	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC1CCN(C2CCN(C(=O)CCc3cn[nH]c3)CC2)CC1	1835835320	URTORJFNHQKULZ-UHFFFAOYSA-N	435.645	1.765	50	20	IDGD	
CC(C)(C)[C@@H](O)C(=O)N1CCC(N2CCC(NC(=O)CO[Si](C)(C)C)CC2)CC1	1835835369	XKRFAOUTDYEWTB-IBGZPJMESA-N	427.662	1.817	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)c3cccnn3)CC2)CC1	1835891591	ZGOCZWNLLWRRMJ-AWEZNQCLSA-N	438.370	1.693	50	20	IDGD	
O=C(c1ccc2c(c1)COC2)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836717218	NUHSLLVJAKUQSM-FQEVSTJZSA-N	436.936	1.929	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC(OC2CCN(C(=O)C3CCCCC3)CC2)CC1	1837619340	DQPZCXVCPUEHAD-UHFFFAOYSA-N	442.365	1.559	50	20	IDGD	
O=C(Cc1ccccc1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839199900	ZARVQMXXJNSNIE-SJLPKXTDSA-N	429.286	1.376	50	20	IDGD	
Cc1cc2[nH]c(C(=O)N3CCO[C@]4(COCCN(C(=O)[C@H](O)CCl)C4)C3)cc2s1	1839523574	PPNSSTLRAMXWPC-DNVCBOLYSA-N	441.937	1.208	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@]3(C)CC3(F)F)C2)C1	1839967183	CUAKVVHOKVREFN-APHBMKBZSA-N	439.297	1.662	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(F)c(C)c3)C2)C1	1840155056	OHWSJJDWGRVBKG-OXJNMPFZSA-N	428.888	1.458	50	20	IDGD	
COc1ccc(Cl)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)c1	1840653075	NRDOBQWTNRASRN-LPHOPBHVSA-N	447.315	1.018	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3cc(F)ccc3F)CCO2)C1	1840812003	VAKJLGGXCNSPIV-OXQOHEQNSA-N	446.878	1.218	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@](O)(C(=O)N2CC3(CCCN3C(=O)C(C)(C)CCl)C2)C1	1841227388	INUAWHCWFAGBEF-OAQYLSRUSA-N	443.972	1.827	50	20	IDGD	
CC(=O)N(C)CCC(=O)N1CC2(CCCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C1	1841924025	OAWRXLQQMMFTFM-HNNXBMFYSA-N	444.960	1.190	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCCC12CN(C(=O)c1ccc(O)cn1)C2	1841924438	MICIGQDCOGZIGV-HNNXBMFYSA-N	438.912	1.736	50	20	IDGD	
C#CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)CCBr)C1	1842639348	FCVJIIBZCTZPLA-CQSZACIVSA-N	442.354	1.891	50	20	IDGD	
C[C@@H](Sc1cccs1)C(=O)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843011592	UCQZJINRXJXJPK-CQSZACIVSA-N	430.360	1.426	50	20	IDGD	
O=C(c1cc(Cl)c(F)cc1F)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843014649	KMWQZKIQUSCWEO-UHFFFAOYSA-N	434.635	1.429	50	20	IDGD	
O=C([C@@H](Br)Cc1ccccc1)N1CC2(CCCN2C(=O)Cn2cncn2)C1	1843082304	DJKZVGGCLLBTGD-INIZCTEOSA-N	432.322	1.488	50	20	IDGD	
COc1ccc2cc(C(=O)N3CCCC34CN(C(=O)c3cnccc3C(=O)NN)C4)[nH]c2c1	1843693536	NREWHFIUMQNOAI-UHFFFAOYSA-N	448.483	1.306	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](CCN)C(=O)N1CC2(CCCN2C(=O)CO[Si](C)(C)C)C1	1844377674	GLASNVJWPVXTGP-OAHLLOKOSA-N	442.633	1.283	50	20	IDGD	
O=Cc1ccccc1-c1cncc(C(=O)N2CCCC23CN(C(=O)[C@H](O)CCl)C3)c1	1845817157	UCZWVQPSPKBLBW-LJQANCHMSA-N	427.888	1.978	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC12CN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2	1846180007	KHVPBAJQVJFFOR-MALLOTDXSA-N	425.279	1.803	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)C1(C)CN(C(=O)OC(C)(C)C)C1)C2	1846362736	SYXVPTYHHUOCFA-CQSZACIVSA-N	429.945	1.701	50	20	IDGD	
O=C(c1ccoc1I)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl	1847559587	IXUHKALJQIGCSF-DCAQKATOSA-N	438.649	1.299	50	20	IDGD	
COc1ccc(-c2nnc(SCC(=O)NNC(=O)c3cccs3)n2N)cc1OC	21229863	UUQYJMSALNHWST-UHFFFAOYSA-N	434.503	1.291	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)c1cccc(S(=O)(=O)N2CCCC2)c1	26975070	AARARXOOCYQCDM-SFHVURJKSA-N	431.470	1.072	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)c1cccc(CN2CCS(=O)(=O)CC2)c1	116206565	VIJGZOXRUWWHQU-HNNXBMFYSA-N	449.504	1.285	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NCc1ccc(C(=O)N2CCCC2)cc1	725873117	KKCMJZIXAYWYDY-UHFFFAOYSA-N	429.502	1.245	50	20	IDGD	
NC(=O)c1ccc(NC(=S)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1	726433902	BFQKDFBARAQOKV-UHFFFAOYSA-N	447.542	1.201	50	20	IDGD	
NS(=O)(=O)c1ccc(OCCC(=O)NNC(=O)c2cc(-c3ccccc3)on2)cc1	726866542	XOPPYUOHTZFOQL-UHFFFAOYSA-N	430.442	1.219	50	20	IDGD	
CCCNC(=O)CN1CCC(NC(=O)NNC(=O)c2c(Cl)cccc2Cl)CC1	727841367	GXCCEKMMWYPSGI-UHFFFAOYSA-N	430.336	1.928	50	20	IDGD	
CC(=O)Nc1cc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)ccc1C	728327464	AXAIPKWXWRVPSG-SFHVURJKSA-N	427.413	1.098	50	20	IDGD	
C=CCc1cc(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc(OC)c1OC	728847349	BHJYJSTZGZGUKJ-UHFFFAOYSA-N	425.489	1.900	50	20	IDGD	
CON(C)S(=O)(=O)c1cccc(C(=O)NNC(=S)Nc2ccc(N(C)C)cc2)c1	729689167	BEFIRDXZBLGQFN-UHFFFAOYSA-N	437.547	1.566	50	20	IDGD	
C[C@@H](NC(=O)OC(C)(C)C)C1CCN(C(=O)NNC(=O)CNC(=O)c2ccco2)CC1	730273835	ZWUGDMFIHIXNRX-CYBMUJFWSA-N	437.497	1.375	50	20	IDGD	
CC(C)(CNC(=O)NNC(=O)COc1ccccc1Cc1ccccc1)NS(C)(=O)=O	731761656	XMYKUYMXQHLUAW-UHFFFAOYSA-N	448.545	1.314	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NC[C@H]2CN3CCC[C@H]3CO2)cc1Br	732246290	PLKMITCGRBKPPM-STQMWFEESA-N	427.299	1.265	50	20	IDGD	
Cn1c(NNC(=O)C2CCN(C(=O)COc3ccccc3)CC2)nc2ccccc2c1=O	733263630	NXDLMQWABNTZAX-UHFFFAOYSA-N	435.484	1.694	50	20	IDGD	
CN(C)C(=O)COc1ccccc1C(=O)NNc1ccccc1S(=O)(=O)NC(C)(C)C	734250832	LAROIVJKQCVYEU-UHFFFAOYSA-N	448.545	1.987	50	20	IDGD	
COc1ccc(S(=O)(=O)C[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)cc1	735123095	GANJTXMDXRYEFM-OAHLLOKOSA-N	447.513	1.508	50	20	IDGD	
CC(C)(Sc1ccc(Br)cc1)C(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1	735995827	UHQMYKQJZSFAAQ-JTQLQIEISA-N	435.365	1.902	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@@H]2C(=O)NNC(=O)COCc2ccccc2)s1	737636989	JEGXQDNODNEDHW-MRXNPFEDSA-N	437.543	1.574	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)N(C)CC(=O)NNc2ncccc2C(F)(F)F)cc1	740091805	VJEQTMGFHWUGAW-UHFFFAOYSA-N	445.423	1.823	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@H]2C(=O)NNC(=O)CNC(=O)c1cccs1	740842768	FNMDXWDLRKVFDA-ZDUSSCGKSA-N	436.534	1.663	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)[C@@H]2CCN(c3cccc(Cl)c3)C2=O)c2ccccc2c1=O	742034835	WZVALLDNOVOZON-INIZCTEOSA-N	439.859	1.401	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN(c2ncnc3sccc23)C1)[C@@H]1COc2ccccc2O1	742470108	OLZHIBUHWNCENW-DYVFJYSZSA-N	439.497	1.895	50	20	IDGD	
C[C@@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(C(=O)NNc3ncnc4[nH]cnc34)cc2)C1	743471559	OHYICQBIJVIXHM-CHWSQXEVSA-N	429.506	1.776	50	20	IDGD	
Cn1cc([C@H](O)CNC(=O)NNC(=O)[C@H]2Cc3ccccc3CN2Cc2ccccc2)cn1	743574701	WKSOXADXCCWMOO-FGZHOGPDSA-N	448.527	1.411	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)CCCNS(=O)(=O)c2ccc(F)cc2)cc1	743828873	LERBIQRUPJUDQY-UHFFFAOYSA-N	437.497	1.803	50	20	IDGD	
Cc1nc(-c2cnn(C)c2)sc1C(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	743830148	OURLLZUSGRQIFY-UHFFFAOYSA-N	434.503	1.722	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1cc2ccccc2oc1=O	744620561	KRGBVFCCMWQUPJ-UHFFFAOYSA-N	429.454	1.571	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)CCc2c(C)nc3cc(O)nn3c2C)c1	744888853	AWBYDVXHAAPGEM-UHFFFAOYSA-N	425.445	1.297	50	20	IDGD	
C[C@H]1C[C@H](NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)C(=O)N1c1ccccc1	745881750	LWUJVSFAEJCYEE-GUYCJALGSA-N	434.456	1.072	50	20	IDGD	
C[C@@H]1C[C@H](NC(=O)NNC(=O)CSc2ccc(Cl)cc2)C(=O)N1c1cnn(C)c1	745919020	QDERVKWVPURPHH-ABAIWWIYSA-N	436.925	1.690	50	20	IDGD	
COc1cc(C)nc(NNC(=O)CCNS(=O)(=O)c2ccc(Br)cc2)n1	746623922	PGAORCLZPXWLLN-UHFFFAOYSA-N	444.311	1.368	50	20	IDGD	
CCN1CCN(Cc2ccc(CNC(=O)NNC(=O)Cc3cn4ccccc4n3)cc2)CC1	746743620	HZZZSWGQYLOHQL-UHFFFAOYSA-N	449.559	1.545	50	20	IDGD	
CCS(=O)(=O)N1CCC(C(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)CC1	748518597	LZWJOVABRMOSNR-UHFFFAOYSA-N	443.469	1.485	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)[C@H](c2ccccc2)n2cccn2)ccc1Cl	748697804	VZXGABWQYVPKIH-INIZCTEOSA-N	433.877	1.235	50	20	IDGD	
CC[C@@H](Oc1cccc(C)c1)C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	749333234	KINKTMAOJQFOPW-OAHLLOKOSA-N	425.894	1.914	50	20	IDGD	
CN(C)[C@@H]1CCC[C@@H](NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)C1	749591700	QZNUAFHWJOCIRS-IAGOWNOFSA-N	437.566	1.288	50	20	IDGD	
Cc1cccc(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1C#N	749751293	RAYJAZPWWDKNBT-UHFFFAOYSA-N	448.526	1.275	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)CNC(=O)c2cccs2)c(-c2ccc([N+](=O)[O-])cc2)n1	751206813	UQTAXYGVVKSESE-UHFFFAOYSA-N	428.430	1.248	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(C(=O)NNc2nc3ccccc3c(=O)n2C)cc1	752909716	YJOXFEUXYXRCIF-UHFFFAOYSA-N	429.502	1.721	50	20	IDGD	
COc1ccc(OC)c(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1	755388739	DNNIXXKSLNSQJZ-UHFFFAOYSA-N	448.501	1.955	50	20	IDGD	
CC(=O)N1CCc2cc(NC(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)ccc21	755537487	UXZQVTKSQCLGFV-UHFFFAOYSA-N	445.501	1.312	50	20	IDGD	
CN(Cc1ccccc1NC(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1)C(=O)OC(C)(C)C	756617309	HOKFJVGXLRVRIF-CQSZACIVSA-N	440.522	1.641	50	20	IDGD	
COc1cc([N+](=O)[O-])ccc1C(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12	756796999	LHAHMSIKZSAEBH-UHFFFAOYSA-N	425.401	1.969	50	20	IDGD	
O=C(NNC(=O)c1c(Cl)cccc1Cl)Nc1cnn(CC(=O)N2CCOCC2)c1	756835066	LJUMRWJRSRORSK-UHFFFAOYSA-N	441.275	1.515	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)Nc2ccc(C(=O)NC3CCOCC3)cc2)cc1	757622377	UHDQBQCQWBTXTH-UHFFFAOYSA-N	442.472	1.836	50	20	IDGD	
COCCCS(=O)(=O)c1ccc(NC(=O)NNC(=O)CCc2ccccc2O)cc1	757822636	JKPXAKNOWHCDOG-UHFFFAOYSA-N	435.502	1.988	50	20	IDGD	
Cc1nc(COc2cccc(C(=O)OCC(=O)NNC(=O)c3ccc(C#N)cc3)c2)no1	758789727	RXMJZTBRISSWSF-UHFFFAOYSA-N	435.396	1.447	50	20	IDGD	
CC(=O)N[C@@H](CC(=O)NNC(=O)C(=O)Nc1ccccn1)c1ccc(Br)cc1	758829339	YESYHMONFAFNOD-AWEZNQCLSA-N	448.277	1.198	50	20	IDGD	
COCCS(=O)(=O)c1ccc(CNC(=O)NNC(=O)COc2ccc(C)cc2)cc1	759383090	GRWGQJIFUMNHGS-UHFFFAOYSA-N	435.502	1.325	50	20	IDGD	
O=C(NC[C@@H]1CC(=O)N(Cc2ccccc2)C1)NNC(=O)c1cc([N+](=O)[O-])ccc1O	759684717	WYKDIARBDAHXKM-AWEZNQCLSA-N	427.417	1.293	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)NCc2ccc(CS(=O)(=O)CC(=O)OC)cc2)cc1	760199049	KPIVYQHUYYYOOV-UHFFFAOYSA-N	447.513	1.481	50	20	IDGD	
Cc1cc(C)nc(-n2nccc2NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)n1	760289102	BGNKTTVEOSZFLH-UHFFFAOYSA-N	429.824	1.038	50	20	IDGD	
COc1cc(Br)cc(S(=O)(=O)NNC(=O)c2cccc(OC)c2O)c1	760512871	ZDAUAUVQAVLRGR-UHFFFAOYSA-N	431.264	1.795	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCCC(=O)NNC(=O)NC1CCCCC1	760797638	CMSWCZYKSYCXAT-OAHLLOKOSA-N	425.530	1.555	50	20	IDGD	
Cn1cc(-n2cc(C(=O)NNC(=S)Nc3cccc(Br)c3)ccc2=O)cn1	760801846	WESZNJUSCCPGNI-UHFFFAOYSA-N	447.318	1.965	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)CCn1c(=O)nc(O)c2ccccc21	761633870	OAHNDHJPEVITQC-UHFFFAOYSA-N	428.470	1.441	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)c1ccc(S(=O)(=O)NC(C)C)cc1	761633896	OTQHLUPHTYRALU-UHFFFAOYSA-N	437.543	1.935	50	20	IDGD	
O=C(COc1ccc(F)cc1Br)NNc1nccc(N2CCOCC2)n1	762866163	CUYODBPVGJVBOT-UHFFFAOYSA-N	426.246	1.737	50	20	IDGD	
C[C@H]1CCCN(S(=O)(=O)c2ccc(NC(=O)C(=O)NNC(=O)c3ccccc3)cc2)C1	763431801	RBRVRUXNDWBJMB-HNNXBMFYSA-N	444.513	1.507	50	20	IDGD	
COc1ccc(I)c(NC(=O)C(=O)NNC(=O)c2ccncc2)c1	763467991	YFLHZYMFKXTNJA-UHFFFAOYSA-N	440.197	1.095	50	20	IDGD	
Cc1cc(C(=O)N2CCC[C@H](C)C2)ccc1NC(=O)C(=O)NNC(=O)c1ccccc1O	763527674	KLOXJHYMZRZZNJ-AWEZNQCLSA-N	438.484	1.972	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)N2CCc3cc(F)c(F)cc32)cc(OC)c1OC	763539518	MTGBTBPODCGBOF-UHFFFAOYSA-N	435.383	1.341	50	20	IDGD	
Cc1cc(C)cc(-n2nc(NC(=O)C(=O)NNC(=O)c3ccc4c(c3)OCO4)cc2C)c1	763552358	YTBJQIAMKLCORX-UHFFFAOYSA-N	435.440	1.926	50	20	IDGD	
CCNS(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2ccc3ccccc3n2)cc1	763659363	HVZLOFLCLNYKFM-UHFFFAOYSA-N	427.486	1.677	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)CC(C)(C)O3)c2ccccc2c1=O	763785068	CVDMVMYBBKMFJN-UHFFFAOYSA-N	449.467	1.530	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2c[nH]nc2-c2ccccc2)c2ccccc2c1=O	763785614	JXRCJZYNAFWGCI-UHFFFAOYSA-N	445.439	1.206	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cc(F)c(OC)cc2F)cc1	763860517	IGQASVJBNPTKCV-LLVKDONJSA-N	437.399	1.926	50	20	IDGD	
CC[C@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)cc1	763864247	HKCMXGWNOKZINP-KBPBESRZSA-N	444.463	1.907	50	20	IDGD	
Cc1ccc(-c2ccncc2)cc1NC(=O)C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	763922135	SJTVJKFESAJMJI-UHFFFAOYSA-N	442.439	1.432	50	20	IDGD	
CCN(CC)C(=O)Cn1ccc2cc(NC(=O)C(=O)NNC(=O)CC(F)(F)F)ccc21	764116666	NFTOIUCAIAHFGT-UHFFFAOYSA-N	441.410	1.548	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccnn2-c2ccncc2)o1	764138631	GYMWPEXPEBBXMS-UHFFFAOYSA-N	425.449	1.102	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H]1CCc2ncc(NC(=O)C(=O)NNC(=O)CC3CC3)cc2C1	764145253	ZGXYDTQDILBHPU-AWEZNQCLSA-N	431.493	1.350	50	20	IDGD	
CN(C)C(=O)C[C@@H]1CN(C(=O)C(=O)NNC(=O)CC2CCCC2)c2ccc(Cl)cc21	764178497	BHSLISLSTYXGAA-CQSZACIVSA-N	434.924	1.976	50	20	IDGD	
C[C@@H]1CCCN(S(=O)(=O)c2ccc(NC(=O)C(=O)NNC(=O)CC(C)(C)C)cc2)C1	764197760	GZJUIZOUSSYEOE-CQSZACIVSA-N	438.550	1.629	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2cccc(OC(F)F)c2)cccc1N1CCOC1=O	764259043	BKXQXIJBELOVCD-UHFFFAOYSA-N	448.382	1.953	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)C(=O)Nc1cc(Cl)ccc1Cl	764261050	WVOQBGVEJRQDBC-UHFFFAOYSA-N	437.287	1.786	50	20	IDGD	
CSCc1ccccc1NC(=O)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	764265603	BOKZDGUFAMWMMT-UHFFFAOYSA-N	428.518	1.342	50	20	IDGD	
O=C(Cc1ccccn1)NNC(=O)C(=O)Nc1cc(Cl)ccc1C(=O)N1CCCCC1	764266772	LDFVQNKXMKMAEC-UHFFFAOYSA-N	443.891	1.690	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)C(=O)Nc1ccc(-c2n[nH]c(C3CC3)n2)cc1	764289371	RPJSHUMEGOAXSJ-UHFFFAOYSA-N	434.456	1.773	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CCc2ccccc2O)c(OC[C@@H]2CCCO2)c1	764289912	ZKNQAQMBNITVTR-KRWDZBQOSA-N	441.484	1.977	50	20	IDGD	
O=C(CCCc1cccs1)NNC(=O)C(=O)Nc1ccccc1CN1C(=O)CCC1=O	764342220	DNGQKNICOCVOQP-UHFFFAOYSA-N	442.497	1.506	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)c1n[nH]c(-c2ccccc2)c1Br	764344680	HJVUWXYRYBDVAM-UHFFFAOYSA-N	443.261	1.425	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COCCO1)C(=O)Nc1ccccc1S[C@H](Cl)C(F)(F)F	764424995	LYBVPSOZUIPQOX-XPTSAGLGSA-N	441.815	1.407	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)CCC(=O)N2CCN(c3ccccc3)CC2)c1	764523481	HPBXWXCLVVVUMW-UHFFFAOYSA-N	438.528	1.959	50	20	IDGD	
Cn1c(S)nc2cc(C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)ccc2c1=O	765317819	WFQOZXRZNUROBD-UHFFFAOYSA-N	435.506	1.288	50	20	IDGD	
C/C=C(/C=C\C(=O)NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1)CC	766635734	DWVMKZYLJAKYJI-IFBPJYOFSA-N	434.562	1.361	50	20	IDGD	
CC(C)(C)[C@@H](Br)C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	766751948	YNWXHOISAGFMQM-JSGCOSHPSA-N	429.267	1.327	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cnn(CC(C)C)c3C)CC2)cc1	767087519	FAOWBWGEZJYNMO-UHFFFAOYSA-N	426.565	1.735	50	20	IDGD	
O=C(NCCS(=O)(=O)CC1CC1)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1	767234584	QVWNQOYDJNSBTH-UHFFFAOYSA-N	429.442	1.431	50	20	IDGD	
Cc1ccc2cccnc2c1S(=O)(=O)N1CCN(S(=O)(=O)CBr)CC1	767852259	WJIBVOYXNUQRDB-UHFFFAOYSA-N	448.364	1.532	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C3=NN(c4ccccc4)[C@@H](C(N)=O)C3)n[nH]2)cc1C	768261879	CNPJHEKQZGHOFG-HXUWFJFHSA-N	445.483	1.575	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)[C@H]1CSCN1C(=O)CC(C)(C)C	768639746	VIQNWJLZYSFNQU-GFCCVEGCSA-N	429.564	1.880	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)Nc1ccc(CS(C)(=O)=O)c(F)c1	769244051	ZTWCCCNRVBBEMC-UHFFFAOYSA-N	445.494	1.931	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cc(COC(C)(C)C)on2)cc1	770213286	ZBUYQCVTAYCBOZ-UHFFFAOYSA-N	438.506	1.380	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CC(=O)N(c2c(F)cccc2F)C1)c1cnn(-c2ccccc2)c1	770734929	YKQZLAIIOKPUGQ-CYBMUJFWSA-N	425.395	1.965	50	20	IDGD	
O=C(NNc1ccc(Br)c(F)c1)Nc1cnn(CC(=O)N2CCOCC2)c1	771168139	SSVWXCPYXDJOKW-UHFFFAOYSA-N	441.261	1.792	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)CNC(=O)c2ccc(Br)cc2)c1	771447205	MZANRUZQMCFYQW-UHFFFAOYSA-N	426.292	1.726	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN(C)CCC2CCN(c3ccncc3)CC2)n1	771461620	DUJINXFFUIOXHF-UHFFFAOYSA-N	430.578	1.775	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1)Nc1ccc(N2CCOCC2)cn1	772396003	HNBIBKHBYTXCCO-UHFFFAOYSA-N	425.424	1.914	50	20	IDGD	
CC[C@@H](N=c1nn[nH]n1-c1ccccc1)C(=O)NNC(=O)[C@@H](C)Oc1cccc(Cl)c1	772966827	KYMQBIGSXBPWFY-CXAGYDPISA-N	443.895	1.543	50	20	IDGD	
C[C@@H]1Oc2c(cccc2C(=O)NNC(=O)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)NC1=O	773412037	TTXSWDCAVKCEAA-QWHCGFSZSA-N	432.477	1.814	50	20	IDGD	
COc1cc(SC)ccc1NC(=O)C(=O)NNC(=O)c1cc(Br)cn1C	773528672	MXZRLIIYETXMHM-UHFFFAOYSA-N	441.307	1.918	50	20	IDGD	
COC(=O)c1cc(N2CCOCC2)ccc1NC(=O)C(=O)NNc1ccc2ccccc2n1	773654889	IGSFMEHZYNADIN-UHFFFAOYSA-N	449.467	1.940	50	20	IDGD	
CN1CCC/C1=N\S(=O)(=O)c1cccc(NC(=O)C(=O)NNc2cccc(C#N)c2)c1	773680591	CJJCNMTXYCBAOQ-XIEYBQDHSA-N	440.485	1.453	50	20	IDGD	
N#C/C(=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)OCc1nc(O)n[nH]1	774879299	AHTLYOIYAPXTNO-KPKJPENVSA-N	441.835	1.553	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)NCc1nc2ccc([N+](=O)[O-])cc2[nH]1	775173305	PUOGCYOVXGLSLZ-UHFFFAOYSA-N	428.405	1.779	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)NCc1cnn(-c2ccc(Br)cc2)c1	775205318	GEZVDFYPPLXBEW-LBPRGKRZSA-N	440.298	1.517	50	20	IDGD	
CO[C@@H](c1ccccc1F)[C@@H](C)NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	776078321	YKHLVSSCMPZJSG-KZULUSFZSA-N	427.436	1.793	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)COC2CCN(C(=O)OC(C)(C)C)CC2)C[C@@H](C)O1	777087714	ACBSXLBDRILUPY-HZPDHXFCSA-N	442.557	1.049	50	20	IDGD	
CCC[C@@H]1C[C@@H](C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)CCO1	780522445	VBBQSASTJTYBBF-JKSUJKDBSA-N	425.555	1.056	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)N[C@@H]2CCCN(c3ccc(C#N)cc3)C2=O)cc1C	780894032	JAGJHZCYEUMSLY-LJQANCHMSA-N	448.483	1.640	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)N[C@H]2CCCN(c3ccc(C#N)cc3)C2=O)nc2ccccc21	780903108	PPOZNBGFNQACBJ-SFHVURJKSA-N	445.483	1.513	50	20	IDGD	
C[C@@H]1CN(C(=O)CCC(=O)C(C#N)=C2N(C)c3ccccc3N2C)CCN1CC(C)(C)O	781861541	KUGJYSOSSXBDJL-QGZVFWFLSA-N	439.560	1.961	50	20	IDGD	
COC(=O)C1(CNC(=O)CCC(=O)C(C#N)=C2N(C)c3ccccc3N2C)CCOCC1	782063578	NNRPYYUVBOIIDV-UHFFFAOYSA-N	440.500	1.743	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NN=C[C@@H]1CCSC1)N(S(C)(=O)=O)CC2	782168344	CSSTZCIOPBHPRC-XJKSGUPXSA-N	441.575	1.808	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H]1CCC[C@@H](NC(=O)NNC(=O)CNC(=O)c2cccs2)C1	782562565	ZDSLXLGHZABUCB-OLZOCXBDSA-N	439.538	1.644	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ncnc3ccsc23)cc1S(=O)(=O)NC1CC1	783255338	RZLFHIMCRQYUTL-UHFFFAOYSA-N	446.514	1.522	50	20	IDGD	
CS(=O)(=O)Cc1cccc(NC(=O)C(=O)NNc2ccc(Cl)cc2[N+](=O)[O-])c1	783291663	SVWFDLDRUIAENO-UHFFFAOYSA-N	426.838	1.875	50	20	IDGD	
Cc1cnn([C@@H]2CCCc3ccccc32)c1NC(=O)C(=O)NN[C@]1(C)CCS(=O)(=O)C1	783424397	DJRRALIXJPBTDU-DYESRHJHSA-N	445.545	1.254	50	20	IDGD	
CC(=O)N1CCN(Cc2cccc(NC(=O)C(=O)NNc3ccc(F)cc3C)c2)CC1	783444465	HMGWWMYIODFELV-UHFFFAOYSA-N	427.480	1.880	50	20	IDGD	
Cc1cnc(-c2cccc(NC(=O)C(=O)NNC(=O)CNC(=O)c3cccs3)c2)o1	784004661	ZLLNTDFPIHYCRC-UHFFFAOYSA-N	427.442	1.227	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)cc(OC)c1	785099517	HPYIIISPLOGKNR-UHFFFAOYSA-N	434.399	1.956	50	20	IDGD	
CCCN1Cc2cccc(NC(=O)C(=O)NNc3c(OC)cccc3S(C)(=O)=O)c2C1	785337550	HCVUEWLDZOHCOI-UHFFFAOYSA-N	446.529	1.906	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNS(=O)(=O)c1cc(Cl)ccc1O[C@H](C)COC	786723773	JFLPFKRRDMHGDA-LLVKDONJSA-N	435.930	1.368	50	20	IDGD	
COC[C@@H](C)n1c(C)cc(/C=C(\C#N)C(=O)NCCCn2c(=O)ccn(C)c2=O)c1C	788219769	GOEBHXMONVMSTQ-PUMYGXPMSA-N	427.505	1.286	50	20	IDGD	
COC(=O)c1cncc(S(=O)(=O)NNC(=O)c2ccc(COc3ccccc3)o2)c1	788479972	FKGPKBVPDAOABG-UHFFFAOYSA-N	431.426	1.664	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Cc2c(C)nc3nc(N)nn3c2C)ccc1OC(C)C	789042990	YLOJUMUKGYRNFB-UHFFFAOYSA-N	427.465	1.123	50	20	IDGD	
O=C(CCOCC(F)(F)C(F)(F)F)NNC(=O)c1csc(N2CCOCC2)n1	790119959	HDWJDDGJFVSRBZ-UHFFFAOYSA-N	432.371	1.345	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2cc(Br)ccc2O1)c1nnc(O)c2ccccc12	792015927	IGUVXAQEMXYGQZ-CQSZACIVSA-N	429.230	1.863	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)cc(Cl)c1F	792269021	SBKNVUMPEANWTH-UHFFFAOYSA-N	441.774	1.570	50	20	IDGD	
CC(C)Cc1ncc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)cn1	792349703	AYPOJFSSMZHVPX-UHFFFAOYSA-N	427.433	1.753	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNc2ncccc2C)cc(OC)c(OC)c1OC	792374838	DIDVPCWWDWSVNN-UHFFFAOYSA-N	432.433	1.674	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2C(=O)O1)c1ccc(S(=O)(=O)N2CCCC2)cc1	793026613	IPRSTCMYNJSMQM-GOSISDBHSA-N	443.481	1.014	50	20	IDGD	
Cc1nc2c(C#N)cnn2c(C)c1CCC(=O)NNC(=O)CNC(=O)OCc1ccccc1	794061324	WNEJMVDMARUMLD-UHFFFAOYSA-N	449.471	1.224	50	20	IDGD	
Cc1c(CC(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)cnn1C	794212686	SVXKYTBOTKOGCT-UHFFFAOYSA-N	433.515	1.595	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)c2cc(F)ccc2NS(C)(=O)=O)cc1	794718234	XSPOHPBCTJCLHM-UHFFFAOYSA-N	430.483	1.204	50	20	IDGD	
Cc1ccc(N2C[C@H](C(=O)NNc3ccccc3S(=O)(=O)N(C)C)CC2=O)cc1F	795168184	IQRVJINSRNPGJD-CQSZACIVSA-N	434.493	1.881	50	20	IDGD	
CSc1nc(C)c(CCC(=O)NNc2ccccc2S(=O)(=O)N(C)C)c(O)n1	795168661	BGURUGKTEPSFRI-UHFFFAOYSA-N	425.536	1.539	50	20	IDGD	
CCn1ncc(NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1C(F)(F)F	799237497	CGTCNMSKGYLNMI-UHFFFAOYSA-N	426.403	1.781	50	20	IDGD	
Cc1ccc2c(c1)nc(CNC(=O)NNc1ccc(S(=O)(=O)NC(C)C)cn1)n2C	802322291	ITTPWNOUPJFGMG-UHFFFAOYSA-N	431.522	1.790	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc(OC(F)F)nc3)n[nH]2)cc1	802566656	AEQVHGRCUXRQHL-UHFFFAOYSA-N	430.371	1.781	50	20	IDGD	
O=C(CCNS(=O)(=O)c1cccc([N+](=O)[O-])c1)NNc1ccc2c(=O)[nH]ccc2c1	803429832	KYJISCHXHPNKKP-UHFFFAOYSA-N	431.430	1.248	50	20	IDGD	
COc1ccc(CS(C)(=O)=O)cc1NC(=O)C(=O)NNC(=O)CCCc1ccccc1	806977866	BXRMECNZNGBJJS-UHFFFAOYSA-N	447.513	1.349	50	20	IDGD	
COc1ccc(CN(C)C(=O)NNC(=O)c2csc(N3CCOCC3)n2)c(OC)c1	807130156	KEULQPSAUXOGEO-UHFFFAOYSA-N	435.506	1.483	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)CCNS(=O)(=O)c1c(C)cc(C)cc1C	807370299	DQWXDTXNAQCMMU-UHFFFAOYSA-N	429.539	1.217	50	20	IDGD	
Cc1cc([N+](=O)[O-])ccc1NNC(=O)C(=O)Nc1ccc(S(=O)(=O)NC(C)C)cc1	807455678	LIMNQIUJQFIATL-UHFFFAOYSA-N	435.462	1.672	50	20	IDGD	
C=CCN(C)S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2nccnc2C2CCC2)cc1	807460195	LPDOARCXPGRTBP-UHFFFAOYSA-N	444.517	1.632	50	20	IDGD	
O=C(NNc1nccnc1C1CCC1)C(=O)Nc1cc(N2CCCS2(=O)=O)ccc1F	807461759	SOZSGBIHBFXZNW-UHFFFAOYSA-N	448.480	1.505	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)NC2CCC3(CC2)NC(=O)NC3=O)cc1OC	807546391	LKAWCLIUDFMVKK-UHFFFAOYSA-N	447.492	1.339	50	20	IDGD	
NC(=O)c1ccc(NC(=O)C(=O)NNc2nccnc2C2CCC2)c(OCC(F)F)c1	810416066	NPMKQWKINFOHIN-UHFFFAOYSA-N	434.403	1.569	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)CNS(=O)(=O)c2ccc(Cl)cc2)cc1	812733279	LYTILTRILNCMGG-UHFFFAOYSA-N	446.938	1.012	50	20	IDGD	
COc1ccc(NC(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)cc1-n1cnnn1	812947494	QYQAELCEISHVTH-UHFFFAOYSA-N	432.466	1.070	50	20	IDGD	
O=C(NNC(=O)[C@H](O)c1ccc(Cl)cc1)c1cccc(S(=O)(=O)N2CCCC2)c1	813363174	DMLORJOMTNWULT-QGZVFWFLSA-N	437.905	1.619	50	20	IDGD	
O=C(NNS(=O)(=O)CCCCN1C(=O)c2ccccc2C1=O)c1ccc2c(c1)OCO2	814209781	FGDBIOPHIOWAAS-UHFFFAOYSA-N	445.453	1.056	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NN=Cc1nccs1)N(S(C)(=O)=O)CC2	814758847	JRIYILHXDASPNL-AWEZNQCLSA-N	438.531	1.560	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)Nc1nc(CC(F)(F)F)cs1	815564254	CXHJGZAMDSHGFF-LLVKDONJSA-N	430.364	1.174	50	20	IDGD	
Cc1nc(-c2ccc(NC(=O)C(=O)NNC(=O)[C@@H]3CCc4nncn4C3)cc2)cs1	815691593	VGVHPZUDSJZNHG-CYBMUJFWSA-N	425.474	1.059	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)N(C)C)c2cccnc12	815751772	NVRYFMGGQAPWOQ-UHFFFAOYSA-N	443.485	1.576	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@@H](C)C(=O)NNC(=O)CCc1nc(O)c2cnn(C)c2n1	893057038	USIAHZDOCAPJAX-LBPRGKRZSA-N	446.895	1.887	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)CN2C(=O)N[C@@]3(C[C@@H](C)CC(C)(C)C3)C2=O)cc1	901393852	OWRRXDKIOONUJG-OYHNWAKOSA-N	430.505	1.658	50	20	IDGD	
CSC[C@@H](C(=O)NNC(=O)c1ccc2ccccc2n1)N1C(=O)[C@H]2CCCC[C@H]2C1=O	912766813	PUEXULZPJTYIPT-DAYGRLMNSA-N	440.525	1.903	50	20	IDGD	
CC1=NN(c2ccc(C(=O)NNC(=O)CN(C)S(=O)(=O)c3ccc(C)cc3)cc2)CC1	915357477	NVAOWEDJXBRGQL-UHFFFAOYSA-N	443.529	1.663	50	20	IDGD	
Cc1ccc([C@H](CNC(=O)NNC(=O)c2ccc3c(c2)OCCO3)N2CCOCC2)o1	916228142	JKWWGILXBYLEFD-INIZCTEOSA-N	430.461	1.377	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)NCCNS(=O)(=O)Cc2ccccc2)c2ccccc2n1	916517320	QZSCGXXSCDJTJP-UHFFFAOYSA-N	441.513	1.607	50	20	IDGD	
COC(=O)COc1ccc(S(=O)(=O)NNC(=O)c2cc(C)nc3ccccc23)cc1	917719989	DQIRGPYSOWDDTL-UHFFFAOYSA-N	429.454	1.718	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)[C@H](C)NS(=O)(=O)c2cccs2)c1C	917918950	IOMRJEBOSRLCGA-KBPBESRZSA-N	425.532	1.647	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NCCS(=O)(=O)c2ccc(Cl)cc2)cc1	919786306	SDDHKSLVPWASBW-UHFFFAOYSA-N	441.893	1.532	50	20	IDGD	
Cc1nn(-c2ccc(S(N)(=O)=O)cc2)c(C)c1CCC(=O)NNC(=O)CC(F)(F)F	920304522	ORNWVCVWJCGXIW-UHFFFAOYSA-N	447.439	1.169	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)Nc2ccc(CN3C(=O)CNC3=O)cc2)c1	920930024	DSMRIEUGJWSXPZ-UHFFFAOYSA-N	427.417	1.222	50	20	IDGD	
CNc1ccc([N+](=O)[O-])cc1C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	1115975204	DIXWIHBEEAEECY-UHFFFAOYSA-N	448.505	1.330	50	20	IDGD	
CC[C@]1(C(=O)NNC(=O)CCN2C[C@H](C)O[C@H](C)C2)CCN(C(=O)OC(C)(C)C)C1	1116344172	IEWWYBGOMHRTOF-MRUHUIDDSA-N	426.558	1.670	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)C12C[C@H]3C[C@@H](CC(O)(C3)C1)C2	1317651784	HLHICHWJHVLYGK-QQRKTFAASA-N	436.892	1.984	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3ccn(-c4ccncc4)n3)CC2)cc1	1320939752	YXTDKNCXIHGWIM-UHFFFAOYSA-N	433.516	1.155	50	20	IDGD	
Cn1ncc(C(=O)NNC(=O)c2ccc(Br)cc2)c1I	1324243085	HOVWMCYVEHTCAA-UHFFFAOYSA-N	449.046	1.862	50	20	IDGD	
COc1ccc(S(=O)(=O)CCC(=O)NNC(=S)Nc2ccc(N(C)C)cc2)cc1	1330914200	BKAHFJPRYHXNEP-UHFFFAOYSA-N	436.559	1.943	50	20	IDGD	
Cc1occc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1	1779371175	NMZWFTXEUNWMDH-XMSQKQJNSA-N	441.488	1.028	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)Cc3ccc4ncnn4c3)C2)C1	1780951801	DMHZUAJWCUKMKM-RBUKOAKNSA-N	440.331	1.338	50	20	IDGD	
O=C(c1cccc2c1OCCO2)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781329606	HWPGPAMPEZYDOD-CRAIPNDOSA-N	443.269	1.592	50	20	IDGD	
COc1cccc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)c1F	1781335014	RATGDHXUMJXZAT-RHSMWYFYSA-N	433.249	1.968	50	20	IDGD	
C[C@@H](C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Br)C2)n1ccnn1	1781549343	AIPUBNUEEMGVPZ-RSUWNVLCSA-N	432.294	1.044	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)n1ccnn1)C2	1781905230	KZMJZLCANJSXDL-LUXYFRNMSA-N	442.358	1.527	50	20	IDGD	
Cc1c(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)cc(Cl)cc1[N+](=O)[O-]	1781999399	PKBPZJWSUIBOHF-MAUKXSAKSA-N	446.287	1.600	50	20	IDGD	
COC(=O)C1(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](C)Br)C2)CC1	1782002126	MTELLJDOSBNHLD-OGHNNQOOSA-N	431.327	1.237	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc([N+](=O)[O-])[nH]1)C2	1782174062	ZOVJQDZTMUXFRR-WPKBUWHJSA-N	428.873	1.304	50	20	IDGD	
Cc1cccn2ncc(C(=O)N3CC[C@]4(C3)CN(C(=O)[C@H](C)Br)CCO4)c12	1782522109	YJHXPTAUIFMNRV-LIRRHRJNSA-N	435.322	1.870	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)CCN3Cc4ccccc4C3=O)CCO2)C1	1783875550	RNPJAHCJYANYDF-XMSQKQJNSA-N	449.935	1.116	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3nc(C)oc3C(F)(F)F)CCO2)C1	1783876509	WVSOLJGGLJXGSI-ZBEGNZNMSA-N	439.818	1.699	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(OC)c(N(C)C)c3)CCO2)C1	1783880541	JYLCMIWLYSJQFA-IIBYNOLFSA-N	439.940	1.459	50	20	IDGD	
Cc1nn2cc(CC(=O)N3CCO[C@]4(CCN(C(=O)C(Cl)Cl)C4)C3)nc2s1	1783943178	VNIWNNVOCUPTGY-MRXNPFEDSA-N	432.333	1.275	50	20	IDGD	
COc1cc(F)c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]3C2)c(F)c1	1784092804	VZHMLZILHOSEEW-LVLWZLKYSA-N	432.851	1.166	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)CC34CCCN3CCC4)C[C@@H]21	1786408855	HHYBZTUHBLMADE-ULQDDVLXSA-N	442.398	1.770	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(C)(C)F)[C@H]2C1	1786759392	SPTCWPKRVZFLCC-AJNGGQMLSA-N	449.951	1.846	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)c1cc2cn[nH]c2cn1	1788464764	XPGGPJVBAGGKFD-RBOXIYTFSA-N	436.310	1.336	50	20	IDGD	
O=C(/C=C1\C(=O)Nc2ccccc21)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21	1788533849	PIVGZHSWYQOVGT-LYMJBUCYSA-N	438.311	1.806	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(O)nc3)[C@H]2C1	1789298039	OKLKDGVZLWPOCA-UNQGMJICSA-N	426.311	1.412	50	20	IDGD	
CCn1nc(C(C)C)cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](Cl)COC)C[C@@H]21	1789382457	FVDYCANDOWRLMI-GGXPGOJBSA-N	440.972	1.874	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3(N4CCN(C)CC4)CC3)[C@H]2C1	1789805492	NIFMVAUHJGGDSI-OKYOBFRVSA-N	441.016	1.154	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3c(O)cc(O)cc3O)C[C@@H]21	1789872202	MNZPZFSNWRFOLF-JCTLKHEBSA-N	447.315	1.633	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccnc4c3OCO4)C[C@@H]21)[C@H](F)Br	1789924592	NWUUOTIZPYBBCU-HVTMNAMFSA-N	444.257	1.094	50	20	IDGD	
COc1cccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]3C2)n1	1791057167	OIRJTJGWIBLMMC-OSFYFWSMSA-N	426.311	1.467	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4cccnn4n3)C[C@@H]21	1791059399	YXOJCTYYMZXKLK-DUPGQFARSA-N	436.310	1.106	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3=NO[C@H](c4ccccc4)C3)C[C@@H]21	1791253509	BYKBIFNKEHBYRT-TXTPUJOMSA-N	449.935	1.738	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]2C1	1791297835	FQKQLMHXFFFFDZ-AVGNSLFASA-N	438.352	1.685	50	20	IDGD	
C[C@H](Cn1ccnc1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]21	1791628394	NNQOXDQCFOCZJZ-XZLOLGPPSA-N	431.364	1.735	50	20	IDGD	
CCC[C@H](NC(C)=O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)CBr)C[C@@H]21	1792182097	KOZPUXOYFXTTPQ-SRQBIAJPSA-N	446.386	1.302	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@]3(F)CCCC=C3F)[C@H]2C1	1792330852	UJIRMGXMKASGMF-OSAWLIQMSA-N	442.507	1.085	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@](C)(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](O)CCl)C1	1793112629	SJQKJXVXXFDVTN-VPEYGQHGSA-N	443.972	1.871	50	20	IDGD	
COc1ccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Br)C3)cc1	1795259992	QVXINUZWTUWANK-RMHZUWNSSA-N	429.286	1.518	50	20	IDGD	
CN(C)c1ccc(CCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)cc1	1796192151	OIUJBEWBQKFENG-UADZTWIMSA-N	449.360	1.317	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)c1ncccc1-c1ccccc1	1796644844	ATJJWSQJXUICRC-NBMJBFSESA-N	429.904	1.552	50	20	IDGD	
COC(=O)[C@H]1CC=CC[C@@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CO[Si](C)(C)C	1797956765	YGZXFJKPTMBHBR-OREBXVKISA-N	438.597	1.183	50	20	IDGD	
C[C@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCC(=O)NN(C)C)C2)N1CSCSC1	1798527679	ZSYNBWXQHGTEJU-LVQVYYBASA-N	443.639	1.041	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(C)ccc1-n1ccnn1)C2	1799271849	DBUNOVSLUAKXAD-HIRMHNASSA-N	431.924	1.796	50	20	IDGD	
C[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@](C)(Cl)CCl)n1cccc1C=O	1799274665	DIHCOBXSXOBLEZ-TWAUDHPGSA-N	430.332	1.688	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cc3ncccn3n2)[C@H]1c1cccnc1)[C@@H](O)CCl	1803142843	KQPVHAKFACRJED-ZVZYQTTQSA-N	428.880	1.044	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC2(CCCN(C(=O)[C@@H]3CCCCO3)C2)CC1	1804955009	QDBHPBHMPVGPCG-SFHVURJKSA-N	429.521	1.099	50	20	IDGD	
N[C@H](C(=O)N1CC[C@H](CNC(=O)CCBr)[C@H]1c1cccnc1)c1ccccn1	1806341166	ZIZUVDQUKGEYKQ-AYOQOUSVSA-N	446.349	1.967	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)Cc2ccn(C)n2)[C@H]1c1cccnc1	1807516771	GRKAKVBKJGGNHN-JCKWVBRZSA-N	434.338	1.847	50	20	IDGD	
CN1CCN(CC(=O)NC[C@@H]2CCN(C(=O)CO[Si](C)(C)C)[C@@H]2c2cccnc2)CC1	1809598332	HAFOIIYRFRKTNZ-SIKLNZKXSA-N	447.656	1.186	50	20	IDGD	
Cc1ccc(CC(=O)N2CCC3(CCCN(C(=O)c4ccc(B(O)O)cc4)C3)CC2)cn1	1809969512	XHLVDAIYHCEHLO-UHFFFAOYSA-N	435.333	1.157	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC2(CCCN(C(=O)CNC(=O)c3ccco3)C2)CC1	1810138855	CADPYCRTUYLCMY-OAHLLOKOSA-N	425.913	1.494	50	20	IDGD	
CC(C)CCC(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1	1810304238	BGPQDJTWKYIGKW-UTKZUKDTSA-N	438.532	1.836	50	20	IDGD	
CN[C@H](CC(=O)N1CC[C@@H](CNC(=O)CO[Si](C)(C)C)[C@@H]1c1cccnc1)C(=O)O	1810541100	OUDBNAGYTOWMOG-FCEWJHQRSA-N	436.585	1.002	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)c2ccccc2)[C@@H]1c1cccnc1	1811670323	OQAVNQCIMGSQOB-RXVVDRJESA-N	444.495	1.714	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)[C@H]2[C@H]3SC=C[C@H]32)[C@H]1c1cccnc1	1812385962	ASNJHUIIZCZBSE-FVESOWDASA-N	443.573	1.336	50	20	IDGD	
Cc1cccc(C(=O)N2CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)n1	1813070298	GXDKGGMRDOCUIO-PGRDOPGGSA-N	438.532	1.478	50	20	IDGD	
CSCC[C@H](O)C(=O)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@H]1c1cccnc1	1813094439	YVKWGPZGHZNWLG-AJNGGQMLSA-N	448.358	1.892	50	20	IDGD	
O=C(/C=C/c1cccnc1)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1815960056	NKZNUKQFKKLCDY-XTXLJPNXSA-N	445.288	1.504	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H]1C[C@@H]1F)CC2	1817283084	ULTRZHXYZMOCGU-DEPXHDJCSA-N	432.481	1.547	50	20	IDGD	
Cc1ccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)cn1	1817473460	VHLFGVLOKIFWJV-IBGZPJMESA-N	433.277	1.413	50	20	IDGD	
Cc1ccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)nc1	1817473526	ZAJOACFMPHUKNY-LJQANCHMSA-N	433.277	1.413	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ncccc2F)[nH]n1)c1cccc(B(O)O)c1	1817477036	WLZSSPJAQSDRMQ-QGZVFWFLSA-N	437.240	1.243	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCN(C)C)[nH]n1	1818111796	IADVICZEWSCEQC-ZZQPOVDQSA-N	442.524	1.488	50	20	IDGD	
COc1ccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)nc1	1818402640	GXSWXEHTXZLABE-KRWDZBQOSA-N	443.508	1.492	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc[nH]3)sc2C1	1820279923	RJTGYCJDFZWMIJ-BUGPSZFBSA-N	439.501	1.831	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccn3c(O)nnc23)[nH]n1	1822369503	OLRDTVDJYLYUQA-OCCSQVGLSA-N	447.883	1.718	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H](O)N2CCOCC2)CC1	1824013863	VILFIIUARBGRET-MJGOQNOKSA-N	429.989	1.522	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCc1nc(N)n[nH]1)CC2	1825642624	SARSNIQRQYGMGI-SFYZADRCSA-N	442.343	1.172	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1nc3ccccn3n1)CC2	1825998857	NJOKJPSINKGZMC-MNOVXSKESA-N	434.909	1.665	50	20	IDGD	
Cc1ncoc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1	1826064573	VSDFNWNEIQFFRI-SFHVURJKSA-N	440.504	1.529	50	20	IDGD	
NC(=O)c1nccnc1C(=O)N[C@H]1CCc2nc(NC(=O)C(Cl)Cl)sc2C1	1826099755	OPTROIKJKUBHMY-LURJTMIESA-N	429.289	1.062	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H]3CCc4nc[nH]c4C3)sc2C1	1826626153	RQOMJGVYVZBZPT-TUAOUCFPSA-N	437.953	1.837	50	20	IDGD	
O=C(c1coc(Cl)n1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827050359	OFUFGMWHOZEHMF-SFHVURJKSA-N	445.712	1.555	50	20	IDGD	
O=C(CCN1CCCC1)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827055181	RJIUSQXXOJWCRK-JOCHJYFZSA-N	441.381	1.086	50	20	IDGD	
CC[S@](=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1	1828786608	UMKCIHHPOYIGPN-JJCDCTGGSA-N	442.626	1.138	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccc(C#N)cc3)CCO2)C1	1829898943	OQGFYHUUUWAVBX-SIKLNZKXSA-N	433.936	1.965	50	20	IDGD	
O=C(CCc1ccc(F)c(F)c1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1830271933	MENGNWAQFGWKPZ-PKOBYXMFSA-N	434.842	1.888	50	20	IDGD	
CC(C)(C)c1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)ccn1	1830725666	QUOIVWYMMSJLAX-IERDGZPVSA-N	439.940	1.049	50	20	IDGD	
COc1c(Cl)cccc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1830738122	MAHBWCBRXMDNOC-DNVCBOLYSA-N	447.315	1.018	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4cncn4c3)C2)C1	1831651497	PXYCLMJJFARTCD-WIYYLYMNSA-N	434.924	1.812	50	20	IDGD	
O=C(Cc1ccc(F)cc1Cl)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1	1832273894	GUHVMEVGNCJRNC-LPHOPBHVSA-N	449.306	1.078	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)/C=C/c3ccoc3)CCO2)C1	1832643951	XGJMKECMTAAJIC-UCAFPWNGSA-N	441.322	1.780	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(C)nc3)CCO2)C1	1833998685	NHODFEPZIPBOFU-QFBILLFUSA-N	440.338	1.634	50	20	IDGD	
Cc1ccc(C(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)cc1	1834801333	YNOSXLACGUDNEL-UHFFFAOYSA-N	449.360	1.174	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](OC)c1ccccc1)CCO2	1834928135	NUWWGHNNQDZAOA-UEXGIBASSA-N	440.924	1.084	50	20	IDGD	
Cc1cccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)c1	1835042276	DUVLAHNEHIPIFY-OXQOHEQNSA-N	439.350	1.777	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)c1ccc2[nH]ccc2n1	1835550749	MHQVNSITZIJRGI-IBGZPJMESA-N	433.940	1.348	50	20	IDGD	
Nc1nc(C(=O)N2CCC(N3CCC(NC(=O)[C@@H](F)Br)CC3)CC2)cs1	1836412488	IVCYDNROLFZPQB-CYBMUJFWSA-N	448.362	1.601	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)CCc3ncc[nH]3)CC2)CC1)[C@H](F)Br	1836414356	GQPMNFNXUDTGFM-KRWDZBQOSA-N	444.349	1.604	50	20	IDGD	
O=C(c1nn[nH]c1C(F)(F)F)N1CCC(OC2CCN(C(=O)[C@@H](F)Cl)CC2)CC1	1838082677	MZBZVGZFUVGWBJ-CYBMUJFWSA-N	441.813	1.970	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(O)c(F)c3)CCO2)C1	1839305644	UTMRVZCPZYBCKT-MOPGFXCFSA-N	449.306	1.838	50	20	IDGD	
CCC(C)(C)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)C1	1839853714	PPUBUJLZMDBPBT-ZHNJOBQTSA-N	447.536	1.013	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)C[C@H](C)c3ccccc3)CCO2)C1	1839932322	RCELJSUSORHGDV-LQBOVUBWSA-N	438.952	1.890	50	20	IDGD	
COc1cscc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)Br)CCO2	1840032926	NPKKINFKLMRBBM-YVEFUNNKSA-N	447.351	1.610	50	20	IDGD	
COC1(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)CCC1	1840618414	GOKWFGVDILJWLM-KBXCAEBGSA-N	433.343	1.185	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(C)cc3OC)CCO2)C1	1840680224	PUBVMIPSAZOMNM-UTKZUKDTSA-N	440.924	1.327	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(C)c(F)c3F)CCO2)C1	1840702177	IXMWNPCAOVRHOB-YWZLYKJASA-N	446.878	1.597	50	20	IDGD	
Cc1[nH]nc(C(=O)N2CCCC23CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C3)c1F	1842287312	OPDIKMFAUKRLNH-LBPRGKRZSA-N	443.907	1.806	50	20	IDGD	
Nc1c(C(=O)N2CCCC23CN(C(=O)[C@@H](F)Br)C3)sc2nccnc12	1842992442	UDGMHWDDABSLRN-LLVKDONJSA-N	428.287	1.781	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2cc(F)cnc2Cl)C1	1844432083	CNUSRPKNHSJLJW-BRJLIKDPSA-N	446.870	1.825	50	20	IDGD	
CCC1(C(=O)N2CCCC23CN(C(=O)c2cc([N+](=O)[O-])ccc2OC(C)=O)C3)COC1	1845909440	JBZKQZREDPTOJH-UHFFFAOYSA-N	431.445	1.764	50	20	IDGD	
N#Cc1cccc(CCC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2cnccc2C(=O)NN)c1	1847470234	WLDCFNCZQKDZKZ-PMACEKPBSA-N	432.484	1.005	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](CC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](O)CCl)C1	1847564382	VCYYFUDPJIVYSC-FXUDXRNXSA-N	429.945	1.435	50	20	IDGD	
COc1cn(-c2ccccc2)nc1C(=O)NNC(=O)c1csc(N2CCOCC2)n1	12804796	KWLPDQIOQIKZBT-UHFFFAOYSA-N	428.474	1.249	50	20	IDGD	
Cc1[nH]c(=O)[nH]c(=O)c1CCC(=O)NNC(=O)COc1ccc(-c2ccc(C#N)cc2)cc1	14323609	GEWWAVZXHIQARH-UHFFFAOYSA-N	447.451	1.069	50	20	IDGD	
CC(=O)N[C@@H](C(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12)C(C)C	15903404	HFOUWBZLOSZLFL-LJQANCHMSA-N	435.484	1.367	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)c2ccc3c(c2)C(=O)N(C[C@@H]2CCCO2)C3=O)c1	17198728	HVJPTMXAKMJKTB-KRWDZBQOSA-N	437.452	1.610	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(C)c(C(=O)OCC(=O)NNC(=O)c2ccccc2)c1	24196586	CSQSDDQOICHTCP-UHFFFAOYSA-N	447.513	1.644	50	20	IDGD	
CC(C)C(=O)NNC(=O)c1cc(=O)[nH]c2ccc(S(=O)(=O)Nc3ccc(F)cc3)cc12	24587873	MYVAOMGDDICVCE-UHFFFAOYSA-N	446.460	1.885	50	20	IDGD	
COc1ccc(-n2cnnc2SCC(=O)NNC(=O)c2cccc(N(C)C)c2)cc1	26044738	CBHSIWSHJGFAJC-UHFFFAOYSA-N	426.502	1.895	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)c1cccc(S(=O)(=O)N2CCCC2)c1	28196487	UGHXXSRZLLMCPM-UHFFFAOYSA-N	439.497	1.732	50	20	IDGD	
C#CCNS(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc3c(s2)CC[C@H](C)C3)c1	32195163	DQTJQLWWMAPWQV-ZDUSSCGKSA-N	431.539	1.859	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCCC[C@@H]2CNC(=O)Nc2ccccc2)n1	105948087	FPGZIIAXISAKDR-QGZVFWFLSA-N	444.561	1.818	50	20	IDGD	
CCCc1noc(CCCC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)n1	108108185	DFMTYVRYPBSNMW-UHFFFAOYSA-N	449.533	1.591	50	20	IDGD	
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)CNC(=O)c1ccco1	725741450	RHBWOMLZZYKMJD-QGZVFWFLSA-N	439.472	1.022	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)CNS(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1	726538421	JVUSJZSDCXQZDJ-UHFFFAOYSA-N	438.815	1.437	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1	726664142	ZXZNATREQIHBAD-UHFFFAOYSA-N	439.812	1.193	50	20	IDGD	
O=C(CSC[C@H]1CCCCO1)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	727365398	RIKQBZOZJAMVSF-MRXNPFEDSA-N	441.575	1.534	50	20	IDGD	
NC(=O)c1ccc(/C=C\C(=O)N2CCC[C@H]2C(=O)NNc2nc(-c3cccnc3)no2)cc1	728075044	QXLKYCGWYZBBRI-JEZWAEDTSA-N	447.455	1.378	50	20	IDGD	
CC(=NNC(=O)c1cccc(OC(F)F)c1)c1ccc(S(=O)(=O)NCC(=O)O)cc1	728434625	KRGHWJUVAGXKOL-UHFFFAOYSA-N	441.412	1.805	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)NCCCN2C[C@@H](C)O[C@H](C)C2)c1	728742787	OOCHRWSCGWUUKF-CHWSQXEVSA-N	443.342	1.901	50	20	IDGD	
Cc1nc2c(c(O)nn2C)c(C)c1CC(=O)OCC(=O)NNC(=O)c1ccc(Cl)cc1	729756443	YNNCXQPTQHJJFV-UHFFFAOYSA-N	445.863	1.491	50	20	IDGD	
Cc1nnc(NNC(=O)CCCS(=O)(=O)c2ccc(Br)cc2)nc1O	731050274	GQTDTZRFSHYIPZ-UHFFFAOYSA-N	430.284	1.345	50	20	IDGD	
COc1ccc([C@@H](CNC(=O)NNC(=O)c2ccccc2OC)N2CCOCC2)cc1	731541876	DYWRVHNDOWMSSB-LJQANCHMSA-N	428.489	1.721	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)NCCS(=O)(=O)NCC2CCC2)c1	731760868	FGMZSZLRSKSGJY-UHFFFAOYSA-N	440.566	1.547	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)N1CCN(S(=O)(=O)c2c(Cl)cccc2Cl)CC1	731849111	VBOBJJCEGQWGIJ-NSHDSACASA-N	437.349	1.246	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)sc(C)c1C	731880348	KYCLLHRZUXIPKG-AWEZNQCLSA-N	431.470	1.631	50	20	IDGD	
CCOCCCn1c(=O)c2ccccc2n2c(S[C@@H](C)C(=O)NNC(=O)CC)nnc12	731905267	YYESXDFYIRDCSX-ZDUSSCGKSA-N	446.533	1.509	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN(C)[C@H](C)CNC(=O)OC(C)(C)C	732207754	KZRGULSMTPJKTJ-GFCCVEGCSA-N	428.917	1.955	50	20	IDGD	
COc1cccc(C(=O)NCC(=O)NNC(=O)c2ccc(OC)c(Br)c2)c1	732306883	BLSPEDFNKDPXPG-UHFFFAOYSA-N	436.262	1.657	50	20	IDGD	
O=C(NCCN/C(O)=C1\N=CC=CC1=O)NNC(=O)c1ccc(F)cc1Br	732465724	JIYNVXHUWBTKJZ-FYWRMAATSA-N	440.229	1.059	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)N[C@H]1CCN(c2ccccc2Cl)C1=O	732469132	ABWCQPLMGRXHRA-AWEZNQCLSA-N	430.848	1.861	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)N[C@@H]1CCN(c2ccccc2C(N)=O)C1	732575767	JRCIPIKNQCNRNZ-CYBMUJFWSA-N	431.880	1.670	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)CC[C@@H]2NC(=O)N(c3ccc(C#N)cc3)C2=O)c1	733774794	SZFBVJBDBWRZIH-SFHVURJKSA-N	435.440	1.298	50	20	IDGD	
CN(C)C(=O)[C@@H]1CCC[C@H](NC(=O)NNC(=O)COc2ccc(Br)cc2)C1	734221201	MBMOXUAWRUGQHY-OCCSQVGLSA-N	441.326	1.805	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)CNC(=O)c1c(F)cccc1Cl	734262678	PZTYTMGQVLSHNQ-UHFFFAOYSA-N	431.852	1.064	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CN2CCN(C(=O)[C@H](C)Oc3cccc(C)c3)CC2)cc1	736621681	JSZMKDNATUILLE-IBGZPJMESA-N	438.528	1.676	50	20	IDGD	
N#Cc1cc(C(F)(F)F)ccc1S(=O)(=O)NNC(=O)c1ccc2c(c1)OCCO2	737756149	JFEWEVXBVAIQFI-UHFFFAOYSA-N	427.360	1.972	50	20	IDGD	
O=C(NCc1ccc(O)c(F)c1)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	739058281	FFABXCUKSNDZEX-UHFFFAOYSA-N	436.465	1.460	50	20	IDGD	
O=C(CN1C(=O)[C@H]2CCCC[C@H]2C1=O)NNC(=O)NCc1cccc(C(F)(F)F)c1	742457344	FQDQBOKXYDCKQX-OKILXGFUSA-N	426.395	1.711	50	20	IDGD	
CCC[C@H](CC)NC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	744887740	UWLQLBUBIIJQRP-KRWDZBQOSA-N	440.566	1.549	50	20	IDGD	
C[C@@H](CC(=O)c1cccc(F)c1)C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	745398258	BARLAVWGCXJPBC-ORAYPTAESA-N	444.415	1.565	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)N[C@H]2CC(=O)N(CCOc3ccccc3)C2)c1	745848240	SKJQXPMPQVTOHR-SFHVURJKSA-N	440.500	1.693	50	20	IDGD	
CS(=O)(=O)c1ccc(OCCC(=O)NNC(=O)c2cc(Br)c[nH]2)cc1	746516734	UYOZWSXAEOEJED-UHFFFAOYSA-N	430.280	1.411	50	20	IDGD	
COc1ccc([C@@H]2[C@@H](C(=O)NNC(=O)Cc3cn4ccccc4n3)CCC(=O)N2C)cc1	746549602	BMQBNCXOYDBZHU-PGRDOPGGSA-N	435.484	1.643	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)NCCn2cnnc2C)cc1	746607261	QRAZRLIQYXIPCB-GZTJUZNOSA-N	448.487	1.057	50	20	IDGD	
Cc1csc([C@](O)(CC(=O)OCC(=O)NNC(=O)c2ccccc2)C(F)(F)F)n1	747338048	GEKYCWXVHIRIQA-MRXNPFEDSA-N	431.392	1.596	50	20	IDGD	
NC(=O)c1ccc(C(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)o1	747378958	HRBGZADIEKNJFG-UHFFFAOYSA-N	431.412	1.155	50	20	IDGD	
CCCCCCNC(=O)[C@H]1CCCN(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)C1	748329022	OPBFDRMCAPANGQ-KRWDZBQOSA-N	442.524	1.425	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)N[C@H](Cc2ccccc2)C(N)=O)N(C)c2ccccc21	748722024	OBGBCTHEUNTENC-GOSISDBHSA-N	431.496	1.870	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)c1c[nH]nc1-c1ccc2c(c1)OCO2	752149667	AOMRCKFHSVXSLJ-UHFFFAOYSA-N	436.424	1.661	50	20	IDGD	
COc1cc(OC)cc(N2C[C@H](C(=O)NNC(=O)NCCc3cccs3)CC2=O)c1	752517701	WYLMCADCKKUHHX-CYBMUJFWSA-N	432.502	1.691	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1nc(-c2cnn(C)c2)oc1C	752601911	YNGBKXHQLXUZMF-UHFFFAOYSA-N	447.835	1.664	50	20	IDGD	
O=C(NNc1nccc(N2CCOCC2)n1)c1cc(Cn2cc(Br)cn2)on1	752625288	DYIRCCZEWQOYTD-UHFFFAOYSA-N	449.269	1.065	50	20	IDGD	
CSCC[C@H](NC(=O)c1ccccc1)C(=O)NNc1nc2ccccc2c(=O)n1C	752901886	HBYOQFWXSRCNGO-KRWDZBQOSA-N	425.514	1.928	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)N[C@@H]1CCN(Cc2ccc(C#N)cc2)C1=O	753291842	ZYHYFMXPWYYJMJ-QGZVFWFLSA-N	441.875	1.965	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@@H](C)C(=O)NNC(=O)c1ccc(CNS(C)(=O)=O)o1	753565857	LVIFQODZNYBFTD-LBPRGKRZSA-N	443.909	1.828	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)Nc2ccc(C)c(S(=O)(=O)N(C)C)c2)c1	755394761	UFBDPQXSXKPKRF-UHFFFAOYSA-N	436.490	1.729	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)Nc2cccc(S(=O)(=O)NC3CC3)c2)c1	755585048	GCTDDBLGBKGALG-UHFFFAOYSA-N	432.502	1.976	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)Nc2ccc(CC(=O)N3CCSCC3)cc2)c1O	756281257	QUMVQDSEQGRUSI-UHFFFAOYSA-N	444.513	1.985	50	20	IDGD	
COC(=O)CN1CCN(c2ccc(NC(=O)NNC(=O)c3ccccc3F)cc2)CC1	756391006	AUTHRXVQQWWMOB-UHFFFAOYSA-N	429.452	1.587	50	20	IDGD	
COC(=O)c1ccc(NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1F	757696798	UWPNAYDICIUCOQ-UHFFFAOYSA-N	443.479	1.977	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccc(Br)nc2)c1	757716536	VVAUGSFBRGZHKT-UHFFFAOYSA-N	442.295	1.561	50	20	IDGD	
Cc1ccc(-c2nn(CCC#N)cc2C(=O)NNC(=O)C(=O)Nc2ccccn2)cc1C	758831447	BNOVUKNMTABUIY-UHFFFAOYSA-N	431.456	1.875	50	20	IDGD	
C[C@H](CC(=O)NNc1nc(-c2ccncc2)no1)NS(=O)(=O)c1cccnc1Cl	760494125	JGRUZQZZHKDDEE-SNVBAGLBSA-N	437.869	1.380	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc2nc(O)cc(C(=O)NNc3ncc(F)cn3)c2c1	760923337	UROAYKOHXGYDTB-UHFFFAOYSA-N	434.453	1.657	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2ccncc2Br)ccc1Cl	763144332	ZPSQABSTHSOOFA-UHFFFAOYSA-N	433.671	1.220	50	20	IDGD	
O=C1C[C@@H](c2cccc(NC(=O)C(=O)NNC(=O)c3ccccc3Br)c2)CN1	763484385	ZDMKJLYZRNIRBX-GFCCVEGCSA-N	445.273	1.452	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2cc(C)nc3ccccc23)c(OC)c1OC	763616592	VVPCVLPYMOCIHR-UHFFFAOYSA-N	438.440	1.969	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2c(C)nc3ccccn23)cc1N1CCOC1=O	763629867	QBIGPKYQLXQWKM-UHFFFAOYSA-N	436.428	1.307	50	20	IDGD	
COC(=O)Nc1cc(NC(=O)C(=O)NNC(=O)COc2cc(C)cc(C)c2)ccc1F	763647959	RMSZSQGSRVHYRS-UHFFFAOYSA-N	432.408	1.786	50	20	IDGD	
COc1cc(OC)c(NC(=O)C(=O)NNC(=O)COc2ccccc2OC)cc1Cl	763662944	NVLAYZYYDFWIEP-UHFFFAOYSA-N	437.836	1.531	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(N3CCOC3=O)cc2)cc1C	763664855	KIDPIWIHESYZFS-UHFFFAOYSA-N	426.429	1.425	50	20	IDGD	
COc1ccc(NC(C)=O)cc1NC(=O)C(=O)NNC(=O)COc1cc(C)ccc1C	763668439	MHYHHJLLPYCECT-UHFFFAOYSA-N	428.445	1.435	50	20	IDGD	
Cn1ccnc1Sc1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2F)cc1	763678262	BUZHXVSUKJQMDL-UHFFFAOYSA-N	443.460	1.875	50	20	IDGD	
Cc1cc(S(N)(=O)=O)cc(NC(=O)C(=O)NNC(=O)c2ccc(C(C)(C)C)cc2)c1C	763794899	DTSFGTYSSRRSBM-UHFFFAOYSA-N	446.529	1.648	50	20	IDGD	
CC(C)Oc1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])c(F)c1	763802698	FUISPACZCIGXTQ-UHFFFAOYSA-N	434.380	1.686	50	20	IDGD	
CCc1cc(NC(=O)C(=O)NNC(=O)c2nc(-c3ccccc3)n(-c3ccccc3)n2)no1	763804351	LMQUBWLSGWGJQN-UHFFFAOYSA-N	445.439	1.884	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccc(CN2CCCCC2=O)c1	763806853	FOSOEBGXVRUHHJ-UHFFFAOYSA-N	449.467	1.236	50	20	IDGD	
COC(=O)c1cccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)c1C	763838548	AISLPJRSIQALEN-HNNXBMFYSA-N	427.457	1.952	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cnn(C[C@H]3CCCO3)c2)cc1OC	763910327	DTPXOSDEPUCPRY-MRXNPFEDSA-N	445.476	1.259	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)OC(F)(F)O2	764003029	WUFSBWGQVXNRAU-UHFFFAOYSA-N	445.176	1.509	50	20	IDGD	
Cn1cnn(-c2ccc(NC(=O)C(=O)NNC(=O)Cc3cccc4ccccc34)cc2)c1=O	764020378	WMJNTXQNKFTEAJ-UHFFFAOYSA-N	444.451	1.053	50	20	IDGD	
CNC(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(C)cc3)[nH]n2)cc1	764111133	NKNJJBLBSXCCPK-UHFFFAOYSA-N	434.456	1.073	50	20	IDGD	
CCN(Cc1ccccc1NC(=O)C(=O)NNC(=O)CCc1ccc(OC)cc1)C(C)=O	764127968	WJLSDCDXPWGYAH-UHFFFAOYSA-N	440.500	1.782	50	20	IDGD	
Cn1c(C(C)(C)C)nc2cc(NC(=O)C(=O)NNC(=O)[C@@H]3Cc4ccccc4O3)ccc21	764153129	IXTJZJSIXVFPAK-SFHVURJKSA-N	435.484	1.960	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2O1)C(=O)Nc1cccc(NC(=O)c2ccoc2)c1	764153234	KFGDGBGXIIKFSC-SFHVURJKSA-N	434.408	1.622	50	20	IDGD	
O=C1C[C@H](c2cccc(NC(=O)C(=O)NNC(=O)c3cccc(OC(F)F)c3)c2)CN1	764259158	DYJNZOIWYCVWCH-ZDUSSCGKSA-N	432.383	1.291	50	20	IDGD	
Cn1ncc(NC(=O)C(=O)NNC(=O)c2cc(Br)ccc2O)c1C(F)F	764280267	LURWAHRHQKDVDA-UHFFFAOYSA-N	432.181	1.226	50	20	IDGD	
CCCOC(=O)c1cc(Br)ccc1NC(=O)C(=O)NNC(=O)C1CCC1	764338827	LZZZLNOAMXDLKK-UHFFFAOYSA-N	426.267	1.902	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cccc(-n4ccnn4)c3)n[nH]2)cc1	764384583	FEWSYLQMVQUDSX-UHFFFAOYSA-N	444.455	1.620	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)C(=O)Nc1ccccc1OCC(F)F	764402073	XJLLISVPXZTJQC-UHFFFAOYSA-N	425.413	1.914	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)N[C@@H]3CCN(c4ccc(Cl)c(F)c4)C3=O)nc21	764508449	MDXWTRSEUOQJHS-GFCCVEGCSA-N	434.819	1.293	50	20	IDGD	
O=C(CCC(=O)N1CCC(O)CC1)NNC(=O)COc1ccccc1-c1ccccc1	765459857	DUJKQXGNDYJFID-UHFFFAOYSA-N	425.485	1.643	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)COC/C=C\c3ccccc3)CC2)cc1	765747571	DRLANUIOTXEEJN-YVMONPNESA-N	436.556	1.990	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)[C@H]1CC(=O)N(c2ccc(Cl)c(F)c2)C1	766295921	SVCMSWTXZRZFCL-APPDUMDISA-N	433.823	1.819	50	20	IDGD	
CCn1cc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)c2ccccc21	766640788	GDTUUZZGGAGAGZ-UHFFFAOYSA-N	433.512	1.880	50	20	IDGD	
Cc1nc(C#N)c(N2CCN(C(=O)COC(=O)[C@@H](Br)C(C)(C)C)CC2)o1	766748402	GBBXZXRJZYTJIB-CQSZACIVSA-N	427.299	1.856	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)[C@H]2CC(=O)N(Cc3ccccn3)C2)cc1C	766935646	VLKFVKGQINSYBF-AWEZNQCLSA-N	444.513	1.367	50	20	IDGD	
Cc1cc(F)ccc1-n1cc(C(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)nn1	767820736	VNSHJKHVKNSLDN-UHFFFAOYSA-N	431.811	1.986	50	20	IDGD	
Cc1oc2ncn(C)c(=O)c2c1C(=O)NNC(=O)[C@@H](C)Oc1cccc(Br)c1	769421837	CXCRCYSNAQKSIM-SNVBAGLBSA-N	449.261	1.826	50	20	IDGD	
CCSCc1cc(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)no1	771391768	KIZHDBCJUTUKLB-UHFFFAOYSA-N	426.520	1.706	50	20	IDGD	
O=C(CSc1nnc(O)nc1O)NN=Cc1ccc2ccc(Br)cc2n1	771550415	IHNPBJQIPAEICR-UHFFFAOYSA-N	435.263	1.836	50	20	IDGD	
CCc1ccccc1N1C[C@H](C(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)CC1=O	772201275	UOYQDPRWEWJGOG-MRXNPFEDSA-N	442.903	1.719	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C1CCN(c2ccc3nnnn3n2)CC1	772996520	SBECFZUKJQWOOW-GFCCVEGCSA-N	444.883	1.004	50	20	IDGD	
CN1C(=O)c2ccc(C(=O)NNC(=O)[C@H]3CCCN(C(=O)OC(C)(C)C)C3)cc2C1=O	773421573	RKBBUYAZIVSOBQ-ZDUSSCGKSA-N	430.461	1.321	50	20	IDGD	
Cc1ccc(-n2nc(C)cc2NC(=O)C(=O)NNC(=O)CCCc2cccs2)nn1	773496468	KBPDBGJEXLNBHQ-UHFFFAOYSA-N	427.490	1.449	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cnn(-c3cnc4ccccc4n3)c2)cc1F	773888977	KGQPRNVGICEVTQ-UHFFFAOYSA-N	433.403	1.663	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN[C@@H](C)c2cccc(N3CCOC3=O)c2)cc1OC	775259605	CGOUGWWRRPNROY-AWEZNQCLSA-N	442.472	1.772	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNS(=O)(=O)c1ccc(Br)c(C(C)=O)c1	775675903	NXZHRXWOFCMHDF-UHFFFAOYSA-N	434.312	1.266	50	20	IDGD	
COC(=O)N1CCC([C@H](C)NC(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)CC1	776917994	IMEDSIIQKRSPQF-ZDUSSCGKSA-N	429.518	1.489	50	20	IDGD	
CCN(C)C(=O)c1cccc(C(=O)N2CCN(S(=O)(=O)CBr)CC2)c1	777831499	BRFBEGDARGHEOT-UHFFFAOYSA-N	432.340	1.219	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNS(=O)(=O)c1ccc(C(=O)O)c(C(F)(F)F)c1	777938680	BLJPMIOYWTVJFV-UHFFFAOYSA-N	441.384	1.238	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)[C@@H]2CCCN2S(=O)(=O)c2ccc(C)cc2)nc1C	778430609	VBPNKWVEPRCWGP-KRWDZBQOSA-N	447.517	1.567	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)c2cnn(Cc3ccc(OC)c(OC)c3)c2)c1	779369181	VJXGMLDKGYWNPY-UHFFFAOYSA-N	439.472	1.830	50	20	IDGD	
Cc1ccc(C(=O)NNS(=O)(=O)c2ccc(S(=O)(=O)C(F)(F)F)cc2)c(O)c1	780376484	BYHSXDMZACTLNY-UHFFFAOYSA-N	438.405	1.617	50	20	IDGD	
Cn1cc(C(=O)NNS(=O)(=O)c2cc(C(=O)O)c(Cl)cc2Br)cn1	782463453	OREGTQBDWNSVCD-UHFFFAOYSA-N	437.659	1.158	50	20	IDGD	
CN(C)CCc1ccccc1NC(=O)C(=O)NNC(=O)c1cc(Br)ccc1O	782701863	DMGCKYFYQGRSMB-UHFFFAOYSA-N	449.305	1.659	50	20	IDGD	
CO[C@@H](C)c1cccc(NC(=O)C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)c1	782898024	WNNXMOQCEDUNIR-ZDUSSCGKSA-N	447.517	1.395	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2ccc(Cl)cc2OCC(F)(F)F)CCS(=O)(=O)C1	783427231	NLIUMTJAYZYTRD-AWEZNQCLSA-N	443.831	1.418	50	20	IDGD	
C[C@@H](NC(=O)CNC(=O)COC(=O)/C(C#N)=C\c1ccc(O)cc1)c1ccc(F)cc1	784019386	FSRRVXAVUJQDHR-AYCSXLNKSA-N	425.416	1.975	50	20	IDGD	
COc1c(F)cc(F)cc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	784212771	GDNXCXHJVUMFEL-UHFFFAOYSA-N	440.428	1.496	50	20	IDGD	
C[C@@H]1CN(C(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)c2ccccc2O1	784835888	YUEZWYXLZPNGMN-LLVKDONJSA-N	425.413	1.940	50	20	IDGD	
CN1CCN(C(=O)c2ccc(NC(=O)C(=O)NNc3cc(F)c(F)cc3F)cc2)CC1	784893204	MIVPWRWMXHKTCZ-UHFFFAOYSA-N	435.406	1.573	50	20	IDGD	
CNS(=O)(=O)c1cccc(NC(=O)C(=O)NNc2nc3ccccc3cc2C)c1C	785165253	QZWXXDPQPAHJRJ-UHFFFAOYSA-N	427.486	1.842	50	20	IDGD	
COCCOc1ccc(F)cc1S(=O)(=O)NNC(=O)c1ccc2c(c1)OCCO2	786722532	BLDJGZQSFNBMLW-UHFFFAOYSA-N	426.422	1.245	50	20	IDGD	
COC(=O)[C@](C)(CNC(=O)NNC(=O)c1nn(-c2ccccc2)cc1O)c1ccccc1	787304834	HTLMCSLCMPPRFB-JOCHJYFZSA-N	437.456	1.653	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2cc(F)cc(Br)c2F)c1O	787542448	KGAYNZUPMNYQNF-UHFFFAOYSA-N	444.188	1.841	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)cc1N1CCNC1=O	787544749	XPHFTPGIKINWAM-CYBMUJFWSA-N	443.435	1.217	50	20	IDGD	
CCNC(=O)Nc1ccc(C)c(NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)c1	787548204	BIXSLZVEYXSVJJ-UHFFFAOYSA-N	449.414	1.894	50	20	IDGD	
COc1ccc(Cl)cc1N1C[C@H](C(=O)NNc2ccc(-n3ccnc3)nn2)CC1=O	788177146	BQYAGKCIEQEJPA-GFCCVEGCSA-N	427.852	1.821	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N2CC(=O)N(C3CC3)C2)cc1	791184353	LCIWCGRGPZZIPX-YBEGLDIGSA-N	448.483	1.132	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)[C@@H]3COCCN3C3CCCC3)n[nH]2)cc1OC	793749387	KPJBJDJAIMFRPG-SFHVURJKSA-N	443.504	1.498	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)[C@@H](C)N(C)CC(F)(F)F)n[nH]2)cc1OC	793751961	YZPHGITWXGFJHT-SNVBAGLBSA-N	429.399	1.738	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C2CCN(S(=O)(=O)/C=C\c3ccccc3)CC2)n1	794080276	JGCUOXNLDUMRSF-QINSGFPZSA-N	428.514	1.864	50	20	IDGD	
CC(C)n1nc(C(=O)NNS(=O)(=O)c2ccccc2CC#N)c2ccccc2c1=O	794576017	CVUIATHNYXKHBA-UHFFFAOYSA-N	425.470	1.667	50	20	IDGD	
CCOc1ccc(C(=O)NNS(=O)(=O)c2cncc(Br)c2)cc1OC	795285034	SUYTVFGFLWGBJT-UHFFFAOYSA-N	430.280	1.875	50	20	IDGD	
CC1=C(C(=O)NNC(=O)c2cc(-c3ccco3)nc3ccccc23)Cn2nnnc2N1C	798272742	CDIZBEBRMJSHNP-UHFFFAOYSA-N	430.428	1.666	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)NCCS(=O)(=O)CCc1ccccc1	800757645	CPVJDPXSLLEEDK-HNNXBMFYSA-N	437.493	1.581	50	20	IDGD	
CSCC[C@@H](NC(=O)Cc1ccccc1)C(=O)NNC(=O)C(=O)Nc1ccc(C)cc1	801105825	LBGRRFJKCJUYDP-GOSISDBHSA-N	442.541	1.562	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc3c(cc2Br)NC(=O)CO3)cc1	801108409	ICZFWQRGTJKTDP-UHFFFAOYSA-N	447.245	1.488	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCc2ccco2)cc1C(=O)NNC(=O)N=c1cc[nH]cc1	802027744	VJOLUSGWAUOYSJ-UHFFFAOYSA-N	429.458	1.350	50	20	IDGD	
Cc1nc(S(=O)(=O)NCC(=O)NNC(=O)Nc2ccc(-c3ccccc3)cc2)cn1C	802038570	LAFCKAMRJDADSN-UHFFFAOYSA-N	442.501	1.527	50	20	IDGD	
CCn1c(=O)nc(O)c2c(C(=O)NNC(=O)Nc3ccc(OC)cc3)cc(C3CC3)nc21	802055528	KXINOMCOZPKYNP-UHFFFAOYSA-N	438.444	1.870	50	20	IDGD	
CC(C)(C)OC(=O)NCC(C)(C)C(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	802066928	DSTDZPUEJBYEAS-UHFFFAOYSA-N	428.511	1.794	50	20	IDGD	
COC[C@H](O)CNC(=O)/C(C#N)=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	802218201	AIVGUQFBEFWVNW-LEHPZIBWSA-N	431.880	1.109	50	20	IDGD	
CC(C)(C)NS(=O)(=O)Cc1cccc(C(=O)NNc2ccc(-n3ccnc3)nn2)c1	804957921	XTBHSZFCNAXSJL-UHFFFAOYSA-N	429.506	1.637	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(NC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)ccc1F	806543490	YCXVLMWGZNNMHM-UHFFFAOYSA-N	446.464	1.728	50	20	IDGD	
CCOC(=O)C(C)(C)c1csc(NC(=O)C(=O)NNC(=O)CCc2ccccc2)n1	806977917	DQWJDMMSGYHMIK-UHFFFAOYSA-N	432.502	1.703	50	20	IDGD	
CCN(CC)CC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(C#N)cc2)c1	806977931	FLJGKHWGLDMJFP-UHFFFAOYSA-N	436.472	1.238	50	20	IDGD	
O=C1COC[C@H](C[C@H]2CN(C(=O)C(=O)NNc3c(F)cccc3Cl)c3ccccc32)N1	806983327	ODTVQAVQVPZDPP-STQMWFEESA-N	446.866	1.958	50	20	IDGD	
O=C1COC[C@@H](C[C@H]2CN(C(=O)C(=O)NNc3ccc(Cl)cc3)c3ccccc32)N1	806997379	MEADSNYJRUQNFR-XJKSGUPXSA-N	428.876	1.819	50	20	IDGD	
C[C@H]1CCCN(S(=O)(=O)c2ccc(NC(=O)C(=O)NNc3ncccc3F)cc2)C1	807301701	FTYOZFUYOGTNCI-ZDUSSCGKSA-N	435.481	1.723	50	20	IDGD	
CCS(=O)(=O)N1CCC([C@H](C)N(C)C(=O)NNC(=O)c2cccc3cccnc23)CC1	808257392	YTFPVIDYNSIYRV-HNNXBMFYSA-N	447.561	1.971	50	20	IDGD	
COC(=O)c1c(F)ccc(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)c1F	810385485	UUEXBRONOMVJHZ-UHFFFAOYSA-N	441.774	1.570	50	20	IDGD	
CCc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NNC(=O)c1cc(OC)c(OC)c(OC)c1	810385785	ZIHZWEQNMCDLNH-UHFFFAOYSA-N	446.416	1.583	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCc1ccc(CC(N)=O)cc1	811852990	KHYQWBVBLUGQAP-GFCCVEGCSA-N	449.305	1.775	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)C(=O)Nc1nc(CC(F)(F)F)cs1	815567834	NJPWXEGESIAINN-UHFFFAOYSA-N	440.201	1.738	50	20	IDGD	
NC(=O)Cn1cc(NC(=O)C(=O)NNc2cc(C(F)(F)F)cc(C(F)(F)F)c2)cn1	815729952	PTIAIHFQXTVFIN-UHFFFAOYSA-N	438.288	1.488	50	20	IDGD	
COc1cccc(/C=C(/C(=O)NNC(=O)c2cc(OC)cc(OC)c2)n2nnnc2C)c1	818025535	VMPQWSJPGOMGQU-OCKHKDLRSA-N	438.444	1.467	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)CCN2C[C@@H](C)O[C@H](C)C2)c2ccccc2c1=O	912920203	YDCHBPNMLJGMPE-IAGOWNOFSA-N	443.548	1.847	50	20	IDGD	
CCNC(=O)CN1CCN(C(=O)/C(C#N)=C\c2cc(C)n(C[C@H]3CCCO3)c2C)CC1	913010177	UNABPIHXKQJSPP-DMMSUNFISA-N	427.549	1.471	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)CCC/N=C2/NS(=O)(=O)c3ccccc32)cc1	913431293	BWEMKQXGQMMXCP-UHFFFAOYSA-N	429.502	1.073	50	20	IDGD	
COc1ccc(S(=O)(=O)N[C@H](C)C(=O)NNC(=O)COc2ccc(C)c(C)c2)cc1	913450350	ZZTAYCXPVUYXCV-OAHLLOKOSA-N	435.502	1.205	50	20	IDGD	
Cc1cc(C)c(C)c(S(=O)(=O)NCC(=O)NNC(=O)COc2ccc(C#N)cc2)c1C	913455251	ULGGEFRGVJQMJE-UHFFFAOYSA-N	444.513	1.297	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)NCc1ccnc(-n2cccn2)c1	914828305	YDMSAYKCOZNERO-UHFFFAOYSA-N	445.277	1.939	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)CCc1c(C)c2c(C)nn(C)c2[nH]c1=O	914849741	UNZQVDKDNIKQQY-UHFFFAOYSA-N	431.880	1.934	50	20	IDGD	
COc1cc2cc(C(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)[nH]c2c(OC)c1OC	915197180	LEZINSWDZIPODM-UHFFFAOYSA-N	447.469	1.672	50	20	IDGD	
CC(=NNC(=O)COc1ccccc1C#N)c1ccc(S(=O)(=O)N2CCNCC2)cc1	916323750	HAEVLGQWNVLLLJ-UHFFFAOYSA-N	441.513	1.071	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)NCCCn2cccn2)c2ccccc2c1=O	916376820	KJEGGLDREBRQIQ-UHFFFAOYSA-N	425.493	1.818	50	20	IDGD	
CN(CC(=O)NNC(=O)COCc1ccccc1)S(=O)(=O)c1ccc(Cl)cc1	916560064	RUDUZYPCMDEKLW-UHFFFAOYSA-N	425.894	1.325	50	20	IDGD	
CCOc1cccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c1	917520200	WZIRTBQWKIMCJD-UHFFFAOYSA-N	433.486	1.181	50	20	IDGD	
CS(=O)(=O)Cc1ccc(CNC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])cc1	918101841	JPSSRCHGSYCITD-UHFFFAOYSA-N	436.446	1.049	50	20	IDGD	
C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)C1	919785953	NYPBHDBEUIFQCQ-NVXWUHKLSA-N	434.500	1.713	50	20	IDGD	
O=C(NNC(=O)c1cccc(NC(=O)c2ccc(F)cc2)c1)N[C@H]1CCS(=O)(=O)C1	919883463	AKLPKUXKNLYPAW-INIZCTEOSA-N	434.449	1.209	50	20	IDGD	
C[C@@H](CN1C[C@H](C)C[C@@H](C)C1)NC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	919924637	QQWUXHDUWCXCCK-NJYVYQBISA-N	444.624	1.896	50	20	IDGD	
CCOc1cc(C=NNC(=O)N[C@@H]2CCS(=O)(=O)C2)cc(Br)c1OC	920379674	ADNSDFCPIXOIGJ-LLVKDONJSA-N	434.312	1.677	50	20	IDGD	
CCN(CC)C(=O)CCCNC(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1	1318579347	UPNZFBSUNJYYCU-UHFFFAOYSA-N	427.546	1.613	50	20	IDGD	
CC(C)n1cnnc1SCC(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1	1318667639	JGYCJCGSBUZQEX-UHFFFAOYSA-N	426.543	1.746	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1ccn(-c2ccncc2)n1	1320813286	YLLRPUWDFGALOF-UHFFFAOYSA-N	429.820	1.547	50	20	IDGD	
COc1ccc2nc(C(=O)N3CC[C@]4(C3)CN(C(=O)[C@@H](O)CCl)CCO4)ccc2c1	1777891997	TWHDSXNTZOWNPT-RXVVDRJESA-N	433.892	1.287	50	20	IDGD	
CC(=O)N/C(=C\c1ccco1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Cl)C1	1778028729	NSMCXEULUZPYTE-HHTSUVIWSA-N	441.887	1.805	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cccc3c1OCCO3)CCO2	1779295266	DHQHSPQOAJDGAN-NRFANRHFSA-N	434.565	1.753	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](C)Nc3ccccn3)C2)C1	1779330698	MVFYNKHXOMLHPB-IYOUNJFTSA-N	425.327	1.495	50	20	IDGD	
O=C(c1cc2ncsc2[nH]1)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1779338468	OBAKQJLZGCVKPY-NHYWBVRUSA-N	431.287	1.758	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)C1CCC(CO)CC1)C2)[C@@H](F)Br	1780771219	WRESACHTFPRQQU-OIJIEPSESA-N	449.361	1.990	50	20	IDGD	
CCc1cc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](F)Br)C2)nn1C	1780773673	LLBNGYCDGHIFGT-RVKKMQEKSA-N	445.333	1.801	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2c(O)cc(O)cc2O)C1	1781029013	NKHNXMBGQMSHMD-OWDMVUQNSA-N	442.896	1.185	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc4ncnn4c3)CCO2)C1	1781229309	BTMXVUYARLNQBB-MSOLQXFVSA-N	426.304	1.409	50	20	IDGD	
C[C@H](C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1)n1cccc1C=O	1781332123	ZXDGBHDJEKBCTG-MRRJBJDNSA-N	430.274	1.382	50	20	IDGD	
C[C@H](Cc1ccccn1)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781335674	ZCRKSMBSZMIDBV-XUWXXGDYSA-N	428.302	1.781	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cnn4ccccc34)CCO2)C1	1783347565	LBUSNFQMGUXOTI-KXBFYZLASA-N	435.322	1.951	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(C)nc(O)c3)CCO2)C1	1783347877	QEUIYUOVKBANFM-KSSFIOAISA-N	426.311	1.713	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccc4cccnc4n3)CCO2)C1	1783534277	SBTJTALFEHZFCP-BFUOFWGJSA-N	433.306	1.857	50	20	IDGD	
CCc1oncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]2C1	1783967155	CKQDZVZMUGXZJG-DSPQJCBJSA-N	428.327	1.861	50	20	IDGD	
Cc1cc(CCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Br)C[C@@H]32)ccn1	1785120733	ZVCGVRREUJWCBJ-OVWQWFNUSA-N	442.329	1.993	50	20	IDGD	
NC(=O)c1ccccc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCBr)[C@H]2C1	1786409013	OUZUXQZFBXBIDX-RCBQFDQVSA-N	438.322	1.164	50	20	IDGD	
O=C(C[C@@H]1NC(=O)NC1=O)Nc1ccc(C2(NC(=O)CCBr)CCC2)cc1	1786765021	RDHNALCXEFYUNJ-ZDUSSCGKSA-N	437.294	1.504	50	20	IDGD	
CN(CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]2C1)C(=O)c1ccccc1	1787443613	OEYKJDOMBXCMID-NBOOPKSLSA-N	425.888	1.273	50	20	IDGD	
Cn1c(C(=O)NC2(c3ccc(NC(=O)c4ccc(B(O)O)cc4)cc3)CCC2)cccc1=O	1788140139	JMCLQALHDFFXGY-UHFFFAOYSA-N	445.284	1.127	50	20	IDGD	
CCc1[nH]nc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]3C2)c1F	1788760912	GNAKAAAKJGMXOE-YDHLFZDLSA-N	426.565	1.556	50	20	IDGD	
C[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21)[S@](=O)c1ccccc1	1790601274	XOGAUMAVJZATDX-GYQHDJBKSA-N	447.384	1.966	50	20	IDGD	
COc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]3C2)ccc1O	1791058887	LGNRIQDSOUJNSC-YSLLHCQFSA-N	441.322	1.778	50	20	IDGD	
O=C(/C=C/c1cc(F)c(F)c(F)c1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21	1791161726	YSGFWEZDOSVDID-VKOIJASASA-N	446.853	1.697	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c[nH]nc3c1)C2	1792868218	RGEHVKWEURVQPE-RMIITELYSA-N	435.322	1.797	50	20	IDGD	
Cc1nc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)CBr)c(C)s1	1792870828	WEUGOKCTMLJUOL-JAMKOXHTSA-N	444.395	1.923	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3cnccc3[nH]1)C2	1792871452	ZLZIWBXBZQAFEF-DPYKFYPSSA-N	435.322	1.797	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cnc2ccccn12	1792933312	RDJDFGTXELAITG-ZUMXRPEOSA-N	435.322	1.250	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCl)[C@@H]1CN(Cc2ccccc2)CCO1	1793111291	BOELJCDAHSMPJU-IVDHNXQLSA-N	435.952	1.125	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](NC(C)=O)C(C)(C)C	1793197893	WXPYNXCBHKEMLR-QRJUGERDSA-N	446.386	1.300	50	20	IDGD	
C[C@H](Nc1nccs1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCBr	1795112872	REVNQCDEIAIZIZ-FMSGJZPZSA-N	431.356	1.318	50	20	IDGD	
CC#CC[C@@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)c1ccccc1	1796191580	ZZMPWQFHLYYJMJ-UEQSERJNSA-N	444.340	1.815	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2nonc2c1	1796882718	AOELAFUJEIIRCM-VFFTVRQLSA-N	437.294	1.457	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2ccccc2o1	1797487569	SOJHXFLBJSXIIW-MUJYYYPQSA-N	433.468	1.997	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1n[nH]c2c(F)cccc12	1797489946	AILQKQQSWGPWEG-KTBFAXTASA-N	443.248	1.596	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/C(=O)NCc1ccco1	1798571439	CDLNHEHEIHWVBQ-MVGBAZTJSA-N	438.322	1.874	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C[C@@H](N)c1cccnc1)C2	1799275037	LTTBBJMGLRMUGM-MOXHTAKSSA-N	429.348	1.297	50	20	IDGD	
O=C([C@H](O)CCl)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1(c2ccc(Cl)cc2)CC1	1800395806	RICFJZAUNVKYAI-DLTLXFJOSA-N	427.328	1.561	50	20	IDGD	
COc1ccc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Cl)C3)c(OC)c1	1800415779	FSBXJODYVWGNOM-FTUNRGFVSA-N	428.888	1.760	50	20	IDGD	
O=C(CCc1cccc(O)c1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2	1801125206	HAIDIKPUOIQBAR-DLTLXFJOSA-N	429.286	1.605	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)NC(=O)c1ccccc1	1802111358	FKUPRZRSBBDYIT-GYFISPQKSA-N	435.952	1.802	50	20	IDGD	
C=CCNC(=O)/C=C\C(=O)NC[C@@H]1CCN(C(=O)CO[Si](C)(C)C)[C@H]1c1cccnc1	1802480687	DLISUNSGSSRZKW-GGUUDJDBSA-N	444.608	1.797	50	20	IDGD	
COc1cccc(CC(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)n1	1803136358	PKSWXBVIEREZKN-MDYRTPRTSA-N	432.908	1.333	50	20	IDGD	
COC(=O)c1ccc(C(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)cn1	1803139758	VSGBOJKNVHUXIL-JLSDUUJJSA-N	446.891	1.183	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(F)(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](O)CCl)C3)C1	1804547369	VUAQOAKKRCCPDH-XJFOESAGSA-N	433.908	1.183	50	20	IDGD	
O=C(CCCC(F)(F)F)N1CCCC2(CCN(C(=O)c3cccc(B(O)O)c3)CC2)C1	1806539832	ZAPSNHZVAWUDQC-UHFFFAOYSA-N	440.271	1.944	50	20	IDGD	
CN1Cc2ccccc2C[C@@H]1C(=O)N1CCCC2(CCN(C(=O)[C@H](O)CCl)CC2)C1	1806680051	LRXCENNTORHDIY-WOJBJXKFSA-N	433.980	1.874	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)[C@H]2CC=CCC2)[C@@H]1c1cccnc1	1808137188	ZBZSHTYDUZRINX-MDKPJZGXSA-N	448.527	1.756	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)C2(N3CCN(C)CC3)CC2)[C@H]1c1cccnc1	1808275575	SKNBIZOTNATFOE-AABGKKOBSA-N	448.011	1.885	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)c2cc[nH]n2)[C@H]1c1cccnc1	1808407801	DQEJDDBRWKJTID-YRJCQSRDSA-N	448.487	1.258	50	20	IDGD	
Cc1ccoc1C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1	1808498177	RGHWNFDQWUPOCD-LPHOPBHVSA-N	448.483	1.615	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2nc3ncccn3n2)[C@@H]1c1cccnc1	1809230126	IPZRGFWPEYDTJW-JYJNAYRXSA-N	427.896	1.856	50	20	IDGD	
Cn1nc(C(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@H]2c2cccnc2)c2c1CCC2	1809359671	HPBOGRDUJPMBNK-YJLNNSPDSA-N	431.924	1.223	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@H]1c1cccnc1	1810527284	BHHDSTWEVOHQIE-XTBFLFJDSA-N	441.301	1.469	50	20	IDGD	
O=C(NCC(=O)N1CC[C@@H](CNC(=O)C(Cl)Cl)[C@H]1c1cccnc1)c1ccco1	1813075396	AKEIUYHQEIQJDS-XJKSGUPXSA-N	439.299	1.914	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)CCn2ccnn2)[C@H]1c1cccnc1	1813435980	MEVVARSBPALMBK-XYJFISCASA-N	449.353	1.943	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CN2CCOC2=O)n[nH]1	1815028877	RJYBAZYIXSCHTN-PWSUYJOCSA-N	428.287	1.637	50	20	IDGD	
Cc1ccncc1C(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1	1815340037	CBVANTDSYXVAIE-HNNXBMFYSA-N	436.302	1.066	50	20	IDGD	
CC1=C(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cnccc2C(=O)NN)CC3)CCO1	1815882042	YIAVRDRVGPDWGB-NSHDSACASA-N	442.501	1.062	50	20	IDGD	
Cc1cc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)cnc1C	1816069833	GVQHCVZTLOFKPG-FQEVSTJZSA-N	447.304	1.721	50	20	IDGD	
O=C(CCBr)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1816782427	OHGZLLNTONOOFX-OAHLLOKOSA-N	449.114	1.180	50	20	IDGD	
COc1ccccc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1	1817476831	RUTUSFDUMAKLAZ-LJQANCHMSA-N	448.288	1.718	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CN2CCN(C)CC2)n[nH]1	1818915216	PDBHYFFQALPHJV-DZGCQCFKSA-N	441.374	1.433	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3c[nH]c(=O)cn3)sc2C1	1821471938	BOWHGEQIEDXEIH-VPTHRUTESA-N	430.317	1.689	50	20	IDGD	
CN1CCCn2nc(C(=O)Nc3cc([C@H]4CCCCN4C(=O)[C@H](O)CCl)[nH]n3)cc2C1	1821591802	OVRKUIZPQOWSHM-IAGOWNOFSA-N	449.943	1.347	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)C[C@@](C)(O)CC(=O)O)[nH]n1	1822374114	DHRNEIMFDTWFIS-WHWRDJHUSA-N	430.889	1.271	50	20	IDGD	
O=C(CSc1nc[nH]n1)N[C@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1	1823014082	NXFUUVIRSLACKV-WKEGUHRASA-N	449.331	1.656	50	20	IDGD	
O=C(c1nc(O)n2c1CCCC2)N1CCC([C@H]2CCCCN2C(=O)[C@H](O)CCl)CC1	1824186970	WTBYXIJYFQRNEB-NVXWUHKLSA-N	438.956	1.758	50	20	IDGD	
CCc1nc(C(=O)N[C@@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)co1	1826088043	PMEAWULDDWRCSD-LLVKDONJSA-N	434.522	1.292	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)Cc2ccccc2)CC1	1826461406	AUOQMEFYJNFMKZ-QHCPKHFHSA-N	434.345	1.842	50	20	IDGD	
O=C([C@@H](F)Cl)N1CCC([C@H]2CCCCN2C(=O)c2n[nH]c3c2CS(=O)(=O)C3)CC1	1827270643	UITYZNOJWPWRHY-GDBMZVCRSA-N	446.932	1.606	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)C2CN(C)C2)CC1	1827679511	FLTHFZYSPDARIQ-UVPCLOGWSA-N	442.564	1.302	50	20	IDGD	
O=C(CN1C(=O)CSC1=S)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](F)Cl)CC2	1828244595	KXYSQHXXGBWUPG-UPONEAKYSA-N	436.943	1.450	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@H](C)N2CCN(C)CC2)CC1	1830244380	UHZDNFWJALHNQB-DFQSSKMNSA-N	443.032	1.496	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CSC3CCCC3)CCO2)C1	1831363059	ACBFAFBROKEAIV-KDOFPFPSSA-N	449.411	1.902	50	20	IDGD	
CC[S@](=O)CCC(=O)N1CCC(N2CCC(NC(=O)C(C)(C)CCl)CC2)CC1	1833214843	RNUBRNJFDCTULC-NDEPHWFRSA-N	434.046	1.982	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnc(OCF)cn3)CCO2)C1	1833567092	GNTJNKURKOQRRS-LIRRHRJNSA-N	444.891	1.260	50	20	IDGD	
COc1ccc(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)cc1	1834846341	PEMYHPMKZPAEMD-QUCCMNQESA-N	428.888	1.619	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)CNC(=O)c3ccco3)CC2)CC1	1834869969	HCQITFCMKIQOFJ-QGZVFWFLSA-N	438.956	1.598	50	20	IDGD	
Cc1cnn(CC(=O)NC2CCN(C3CCN(C(=O)[C@@H](C)Br)CC3)CC2)c1	1834895216	YXNWPGPNANFLCS-OAHLLOKOSA-N	440.386	1.547	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](N)Cc3cscn3)CC2)CC1	1835049832	YKUVBYYOXFYQBT-ROUUACIJSA-N	442.029	1.602	50	20	IDGD	
C[C@@H](C(=O)N1CCC(N2CCC(NC(=O)[C@@H](F)Cl)CC2)CC1)n1cccc1C=O	1835080274	OPMROULGJMXPAI-KBXCAEBGSA-N	426.920	1.968	50	20	IDGD	
C[C@@H](Nc1nccs1)C(=O)NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1835104938	ROMBVHWHLKOBBU-CZUORRHYSA-N	444.001	1.115	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3ncccc3F)CC2)CC1	1836024683	UBYLFDHTLRSLRX-INIZCTEOSA-N	426.920	1.660	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)CCS(C)(=O)=O)CC2)CC1	1836923528	TYRODRHKSNYWCM-QGZVFWFLSA-N	437.002	1.827	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)Cn3cc([N+](=O)[O-])cn3)CC2)CC1	1837135191	YUCHBKCJQACNRJ-KRWDZBQOSA-N	441.916	1.807	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)OC(C)C)CCO2	1837604045	SFFZWHZJDZJNEW-RVKKMQEKSA-N	435.359	1.430	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3[C@@H]4C=CS[C@@H]34)C2)C1	1837715794	JUKVOPLRBOMWAC-KNIMUDFMSA-N	426.611	1.169	50	20	IDGD	
COc1c(Cl)ccnc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1838727982	CNNRIHHYDXMQHG-WMLDXEAASA-N	436.267	1.348	50	20	IDGD	
Cc1ccc(OC(C)(C)C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)nc1	1839052852	PYVXOYFIGXJZKG-UZLBHIALSA-N	443.903	1.538	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)/C=C/c3ccc([N+](=O)[O-])o3)C2)C1	1839141284	DDBUZNVIWDLOHM-BTESVEOXSA-N	441.868	1.675	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(Cl)nc(OC)c3)C2)C1	1839145926	ICGSKBJEOMCFEA-AUUYWEPGSA-N	446.331	1.831	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc([N+](=O)[O-])cc3F)C2)C1	1839147405	PKZKQANEKVPQML-KXBFYZLASA-N	443.859	1.821	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccc(OC)c(F)c3)C2)C1	1839149222	YAYLPUPMRWDPKS-IIBYNOLFSA-N	442.915	1.851	50	20	IDGD	
C=C(C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1)C(F)(F)F	1839893992	CJUNHQBPRMFLGV-GWCFXTLKSA-N	433.196	1.252	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3occc3C)C2)C1	1839964066	FJQTWWKPNKKHHZ-KDOFPFPSSA-N	429.311	1.832	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cscn3)C2)C1	1839964665	YQRHZQBLDFOXPL-PBHICJAKSA-N	446.367	1.316	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(F)c3Cl)C2)C1	1840155027	NMYJPKQAJPADEF-AUUYWEPGSA-N	449.306	1.803	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)Cc2cnc3ccccn23)C1	1841324188	WWUWWOGFKSMGOX-WGOQTCKBSA-N	447.499	1.214	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2cc3cccnc3s2)C1	1843688353	DVQIKNMXRUPJAR-UHFFFAOYSA-N	436.497	1.426	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2cc3c(s2)CCCC3)C1	1844038145	WBYJQZCNJHDDQF-UHFFFAOYSA-N	439.541	1.756	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)c1cc(C#N)c[nH]1)C2	1844692879	UUTIVTUQKQYPAE-UHFFFAOYSA-N	437.412	1.851	50	20	IDGD	
COc1cccc2[nH]cc(C(=O)N3CCCC34CN(C(=O)CCC(=O)NN(C)C)C4)c12	1845650475	NJFKMMGBTSWUIL-UHFFFAOYSA-N	427.505	1.367	50	20	IDGD	
N#C/C(=C\c1ccc(Br)cc1)C(=O)N1CCCC12CN(C(=O)C#CC(=O)O)C2	1845873237	WKYZFFLFJGRXQZ-XNTDXEJSSA-N	442.269	1.647	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)C1(c2cccc(F)c2)CC1	1848041863	KAFJWDORDUEYNT-OALUTQOASA-N	437.475	1.371	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)[C@H]2Oc3ccccc3O[C@@H]2C)cc1OC	10948495	DAKNFVOOLLVJGW-BLVKFPJESA-N	430.413	1.237	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)CCNS(=O)(=O)c2cccc(Br)c2)n1	22235609	MCXVDAQVMSWCAU-UHFFFAOYSA-N	428.312	1.668	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)C[C@@H](C)NC(=O)c1ccccc1	22905231	JWSDALLEUNWQSV-CYBMUJFWSA-N	431.518	1.258	50	20	IDGD	
C[C@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)NNC(=O)c2cc3c(s2)CCC3)C1=O	26545812	YXQLEQPBOQBHQV-HXUWFJFHSA-N	430.461	1.604	50	20	IDGD	
O=C(NNC(=O)c1ccc2[nH]nnc2c1)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	28814230	TZHVGUJDPAJHHG-UHFFFAOYSA-N	439.439	1.735	50	20	IDGD	
Cc1ccc(-c2nnc(S)n2CCC(=O)NNC(=O)CNC(=O)c2ccco2)cc1	725902224	JSPRYOPHQRYJOP-UHFFFAOYSA-N	428.474	1.103	50	20	IDGD	
CCN1CCC(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)CC1	726279706	QZPNCXZSYOWWQR-UHFFFAOYSA-N	437.566	1.147	50	20	IDGD	
CC(C)NC(=O)CNC(=S)NNC(=O)COc1ccc(OCc2ccccc2)cc1	727269866	AHIBWUYBILHLSB-UHFFFAOYSA-N	430.530	1.664	50	20	IDGD	
Cc1ccc(C)c(CC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c1	727982369	NGWWXSXIPRNRKL-UHFFFAOYSA-N	431.514	1.328	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)nnc1-c1ccccc1	728160955	XHWFHYITGFZRKJ-UHFFFAOYSA-N	447.543	1.384	50	20	IDGD	
O=C(COC(=O)c1cccn1Cc1cccs1)NNC(=O)[C@H]1COc2ccccc2O1	728331748	MDUZHXXHLZIHKW-GOSISDBHSA-N	441.465	1.742	50	20	IDGD	
N#Cc1ccc(N2CCC[C@@H]2C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1	728348268	MJEZOPACGQROPQ-GOSISDBHSA-N	437.412	1.440	50	20	IDGD	
CN(CCOc1cccc(CNC(=O)NNC(=O)Cc2cccnc2)c1)C1CCOCC1	728954619	RWHUNHRJRMIYNJ-UHFFFAOYSA-N	441.532	1.644	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC(NC(=O)NNC(=O)Cc3cccnc3)CC2)cc1	729044994	JZUWWBAZJUOWIS-UHFFFAOYSA-N	431.518	1.116	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)[C@H]1CSCN1C(=O)c1ccc(Cl)cc1	729166935	AXRKAXPSQFOTQI-RHSMWYFYSA-N	447.900	1.843	50	20	IDGD	
CC1CCN(c2ccc(NC(=O)CCC(=O)NNC(=O)C(=O)N3CCCC3)cc2)CC1	730281646	PSWRKGWWBFLNCA-UHFFFAOYSA-N	429.521	1.411	50	20	IDGD	
COc1cc(C=NNC(=O)Cc2cc(O)nc(S)n2)ccc1OC(=O)c1cccnc1	730587882	SRKQVNWCTZWFML-UHFFFAOYSA-N	439.453	1.787	50	20	IDGD	
COc1ccccc1[C@H](CNC(=O)NNC(=O)COc1ccccc1O)N1CCCC1	730904697	OVNZSUHOBBNLGW-KRWDZBQOSA-N	428.489	1.947	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1	730905767	ZLAWGAXNTVOSKA-UHFFFAOYSA-N	432.452	1.402	50	20	IDGD	
CC(=O)Nc1ccc(NS(C)(=O)=O)c(C(=O)NNC(=O)COc2ccc(C)c(C)c2)c1	731434981	TUMXGJNUCOOAKO-UHFFFAOYSA-N	448.501	1.473	50	20	IDGD	
O=C(CCNC(=O)N1CCc2ccccc2C1)NNC(=O)c1cc(-c2ccccc2)[nH]n1	731865089	JXHGCQSXKULGNO-UHFFFAOYSA-N	432.484	1.996	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CCN2C(=O)c3ccccc3C2=O)cc1Br	732035385	AGPBFSYPLMEKTQ-UHFFFAOYSA-N	446.257	1.905	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CNS(=O)(=O)c2cccs2)cc1Br	732175305	JZRYAPCMWFEZNC-UHFFFAOYSA-N	448.320	1.259	50	20	IDGD	
Cc1ccc(S(C)(=O)=O)cc1S(=O)(=O)NNC(=O)c1cnn(-c2ccccc2)c1	733123351	ZWMDYGXVNRQHKJ-UHFFFAOYSA-N	434.499	1.208	50	20	IDGD	
Cn1c(NNC(=O)[C@@H]2CCCN2C(=O)c2ccc3c(c2)OCO3)nc2ccccc2c1=O	733260336	ALLXHJCRIMKYAE-INIZCTEOSA-N	435.440	1.410	50	20	IDGD	
Cn1c(NNC(=O)[C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)nc2ccccc2c1=O	733262451	YXAXRJLFUNIKNR-CYBMUJFWSA-N	442.457	1.651	50	20	IDGD	
Cc1nc([N+](=O)[O-])cn1CC(=O)NNc1nc2ccccc2c(=O)n1CCCOC(C)C	733265118	ZQFABKSPZRPEQK-UHFFFAOYSA-N	443.464	1.768	50	20	IDGD	
O=C(NNc1nccnc1Cl)C1CCN(c2ccc3nnc(C(F)(F)F)n3n2)CC1	734261868	OQBDTLWYXNIJTM-UHFFFAOYSA-N	441.805	1.946	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2csc(Nc3ccccn3)n2)c1	736066684	PXCHDGKHBYLWPC-UHFFFAOYSA-N	446.514	1.607	50	20	IDGD	
CC[C@@H](C)[C@H](NC(=O)N1CCCC1)C(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	736836160	PPVBIZLSJDFZSH-DYVFJYSZSA-N	449.464	1.119	50	20	IDGD	
C[C@H]1CC(C)(C)C[C@@]2(C1)NC(=O)N(CC(=O)NNC(=O)COCc1ccccc1)C2=O	737636116	BXFDNDZFUJUVBE-OYHNWAKOSA-N	430.505	1.487	50	20	IDGD	
O=C(NNC(=O)c1ccn(-c2cccc(C(F)(F)F)c2)n1)c1ccc(-n2cnnn2)cc1	737768691	YXWORFOSGNSGLB-UHFFFAOYSA-N	442.361	1.942	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@@H]2C(=O)NNC(=O)CNC(=O)c1cccs1	740842767	FNMDXWDLRKVFDA-CYBMUJFWSA-N	436.534	1.663	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@@H]2CCCN(C(=O)COc3ccccc3)C2)cc1OC	741172107	JTCBFHUREQTWCD-QGZVFWFLSA-N	441.484	1.782	50	20	IDGD	
Cc1c(NNC(=O)NC2CCN(S(=O)(=O)c3cnn(C)c3)CC2)cccc1[N+](=O)[O-]	741424224	AFEQWHQRPAQPJC-UHFFFAOYSA-N	437.482	1.116	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)[C@@H](c1ccccc1F)N1CCOCC1	742618037	CRKDDNUFJZSTDK-HXUWFJFHSA-N	448.520	1.783	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CCCc2ccccc2)cc(NS(C)(=O)=O)c1OC	742628805	XMDLDNQBXLYRSN-UHFFFAOYSA-N	435.502	1.859	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc(F)cc1)NNC(=O)c1cccc(Br)c1	742772708	DRUPIERTZFJNIV-UHFFFAOYSA-N	444.282	1.718	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NCCC(=O)N2CCCCCC2)cc1	743576485	ZZAZFSCJSMQKMO-UHFFFAOYSA-N	425.511	1.219	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2ccnc(OCC(F)(F)F)c2)cc1	743831249	UFFHBCUJPIFQMP-UHFFFAOYSA-N	432.380	1.893	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)CCC(=O)c2ccc3c(c2)OCCO3)cc1	744450903	KQTIJKFYZOLGHS-UHFFFAOYSA-N	437.408	1.297	50	20	IDGD	
Cc1ccc(CN2C[C@@H](C(=O)OCC(=O)NNC(=O)c3ccc(C#N)cc3)CC2=O)cc1	744461354	AHQZMLYJOGULAD-IBGZPJMESA-N	434.452	1.220	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)N[C@@H]1CC(=O)N([C@@H]2C[C@@H]2c2ccccc2)C1	745915388	YULSNEGICVWNFX-ZTFGCOKTSA-N	446.467	1.436	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)NCC(=O)NNc2oc(C(C)C)nc2C#N)cc1	746185805	YKLXIRALCVEAHF-UHFFFAOYSA-N	435.462	1.268	50	20	IDGD	
CCCn1c(CCC(=O)NNC(=O)CCc2ccco2)nc2cc(S(N)(=O)=O)ccc21	748266702	KITRNCHPMOXVSP-UHFFFAOYSA-N	447.517	1.400	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NC[C@@]2(N(C)C)CCSC2)nc1	748646504	GTOCFBQZORAQFG-KRWDZBQOSA-N	430.600	1.176	50	20	IDGD	
Cc1ccc(-n2cnnc2SCC(=O)NNC(=O)CNC(=O)c2cccs2)cc1	751209643	UCXWWSQUFGNLMM-UHFFFAOYSA-N	430.515	1.307	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1	752237692	CCXAXBZNQWHROT-MRXNPFEDSA-N	447.473	1.303	50	20	IDGD	
O=C(CCC(=O)c1ccc(I)cc1)NNC(=O)Cc1cc[nH]n1	755289726	SCNIYTGOVHGUOC-UHFFFAOYSA-N	426.214	1.367	50	20	IDGD	
CCCNC(=O)NN=Cc1c(Sc2nnnn2-c2ccccc2)nc2ccccn2c1=O	755674609	XKYLHCMFALRMNK-UHFFFAOYSA-N	449.500	1.865	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NN=Cc3cccc(F)c3O)CC2)cc1	755788543	HTQQOTCZQRXKIU-UHFFFAOYSA-N	434.493	1.296	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2cccc(-n3cccn3)c2)c1	755933291	SPWAGNHAPOKVTG-UHFFFAOYSA-N	428.474	1.589	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccc(C)c(C(N)=O)c2)c1	756327470	UMCHFNWYJQZQQD-UHFFFAOYSA-N	447.517	1.591	50	20	IDGD	
COCCS(=O)(=O)c1ccc(NC(=O)NNC(=O)COc2ccc(OC)cc2)cc1	756555009	PNPDCWCPGQZWGK-UHFFFAOYSA-N	437.474	1.347	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)Nc2ccn(CCN3CCOCC3)n2)c1	756645385	FPQNIPPLRAIOIZ-UHFFFAOYSA-N	444.536	1.879	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)NNC(=O)c1ccc(C#N)cc1	756674169	JXAYYPHATHVCQH-UHFFFAOYSA-N	431.474	1.674	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)N[C@H](C)c2ccc([S@](C)=O)cc2)nc1	756721324	GFRKRFCGLWFGGA-QYSRSOONSA-N	439.563	1.893	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)N[C@@H]1CCN(C(=O)CCc2ccccc2)C1	756980630	UPZPLZZXGYSULC-QGZVFWFLSA-N	426.473	1.335	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2ccc3c(c2)OCO3)cc1-n1nnnc1C1CC1	757621625	QHGPWHSUCMBYNR-UHFFFAOYSA-N	437.416	1.744	50	20	IDGD	
COC(=O)c1cc(NC(=O)NNC(=O)c2cccc(OC)c2O)cc(S(C)(=O)=O)c1	757675004	ZJIVKGUBCVVTNR-UHFFFAOYSA-N	437.430	1.057	50	20	IDGD	
Nc1ncc([N+](=O)[O-])cc1C(=O)NNC(=O)COc1ccc(OCc2ccccc2)cc1	757675538	LGFXDRNXWOEPQD-UHFFFAOYSA-N	437.412	1.991	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c2ccccc2c1=O	757781532	PNEGNTSBAQDMQE-UHFFFAOYSA-N	433.512	1.512	50	20	IDGD	
COc1cc(Cl)c(C)cc1NC(=O)CCNC(=O)NNC(=O)C(=O)Nc1ccccn1	758825325	QMVBHDPDFSDVRZ-UHFFFAOYSA-N	448.867	1.350	50	20	IDGD	
CC1(C)C(=O)N(C[C@@](C)(O)C(=O)NNC(=O)c2nnc(O)c3ccccc23)c2ccccc21	760065509	GXNJLYUOADEOFB-HSZRJFAPSA-N	449.467	1.172	50	20	IDGD	
O=C(Cc1csc(N2CCOCC2)n1)NN=C1CCCC[C@H]1n1ccc([N+](=O)[O-])n1	760242424	SPZNENJBARIVAU-OAHLLOKOSA-N	433.494	1.914	50	20	IDGD	
Cc1nn(CC(F)F)c(C)c1C(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	760827913	OIELBIAYFCFODY-UHFFFAOYSA-N	425.348	1.291	50	20	IDGD	
N#C/C(=C\c1ccc(O)cc1)C(=O)OCC(=O)Nc1cc(S(N)(=O)=O)ccc1Cl	761188486	NMAIBUNFPKDWSV-KPKJPENVSA-N	435.845	1.782	50	20	IDGD	
O=C(NN=C1CCOc2c1cc(Br)cc2[N+](=O)[O-])C(=O)Nc1ccccn1	761816032	AXHJMGRVWXMWPZ-UHFFFAOYSA-N	434.206	1.994	50	20	IDGD	
COC[C@@H](C)n1c(C)cc(/C=C(\C#N)C(=O)NNc2nccc(N3CCOCC3)n2)c1C	762852074	QTDSVOIFVYYXPL-PUMYGXPMSA-N	439.520	1.989	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2csc(-c3ccccn3)n2)cc1OC	763550106	FRGYVJCQEHVFNZ-UHFFFAOYSA-N	427.442	1.622	50	20	IDGD	
O=C(NNC(=O)C1CC1)C(=O)Nc1cc(Br)cnc1OCC(F)(F)F	763557111	BPMPSTVEBZQNDL-UHFFFAOYSA-N	425.161	1.281	50	20	IDGD	
CC[C@H](C)NS(=O)(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2ccccc2F)c1	763568523	MMSXZHKIPSDCEF-LBPRGKRZSA-N	436.465	1.302	50	20	IDGD	
COC(=O)c1cc(OC)c(OC)c(OC)c1NC(=O)C(=O)NNC(=O)c1ccccc1F	763569178	ZAFCCKUJPGOGHD-UHFFFAOYSA-N	449.391	1.038	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2ccc(N3CCOCC3)c(C)c2)c1	763649946	NLNHGPKSQRBTIH-UHFFFAOYSA-N	440.500	1.613	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(C#N)ccc1OC(F)F	763713369	YMCCBUXVEDEZLD-UHFFFAOYSA-N	432.383	1.887	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)C(=O)Nc2cccc(N3CCCCC3)c2)c2ccccc2c1=O	763786882	RAZLCGQOCMHNQF-UHFFFAOYSA-N	448.483	1.324	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccc(OC[C@H]2CCCO2)c1	763809700	ZHMZBLWIALGLDN-GOSISDBHSA-N	438.440	1.281	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)[C@H]1CCCN(C(=O)c2ccc(Cl)cc2)C1	763824138	GIUMYAPZRKHCGU-INIZCTEOSA-N	443.891	1.165	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccc(N2CCCC2=O)c(Cl)c1	763838172	PCKWKGRUXNFKTO-UHFFFAOYSA-N	448.838	1.771	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(-c3cc[nH]n3)cc2)cc1	763873006	QYOOTIWRIOVVFM-CQSZACIVSA-N	435.440	1.833	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1cnn(Cc2ccncc2)c1	763874045	YXGDWXSOBNQKAV-CYBMUJFWSA-N	426.408	1.019	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(OC)nc2OC)cc1OC	763911898	QHTATWHYEAMKAR-UHFFFAOYSA-N	432.433	1.296	50	20	IDGD	
Cc1cc(N2CCOCC2)ccc1NC(=O)C(=O)NNC(=O)c1cc(Cl)ccc1O	763978550	LDKUJOUXDXJDDS-UHFFFAOYSA-N	432.864	1.590	50	20	IDGD	
O=C(CN1CCCCCC1)Nc1ccc(NC(=O)C(=O)NNC(=O)c2ccc[nH]2)cc1	763979632	PCTYPGUQZHGYJU-UHFFFAOYSA-N	426.477	1.229	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)Nc1cccc(-c2cnco2)c1	764005047	SVVFQJAJZHYZJM-UHFFFAOYSA-N	432.234	1.842	50	20	IDGD	
CCc1noc(-c2ccc(C)c(NC(=O)C(=O)NNC(=O)c3cccc(OC)c3O)c2)n1	764130940	LJFIZWDYHIXRSA-UHFFFAOYSA-N	439.428	1.721	50	20	IDGD	
O=C1C[C@@H](c2cccc(NC(=O)C(=O)NNC(=O)c3cccc(OC(F)F)c3)c2)CN1	764259156	DYJNZOIWYCVWCH-CYBMUJFWSA-N	432.383	1.291	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)C(=O)Nc1ccc(CN2CCOC2=O)cc1	764288455	GUTUJWKTQUWRDV-UHFFFAOYSA-N	426.429	1.063	50	20	IDGD	
O=C(Cc1cc[nH]n1)NNC(=O)C(=O)Nc1cnccc1-c1ccc(C(F)(F)F)cc1	764297410	RGTMZECODHTEOI-UHFFFAOYSA-N	432.362	1.819	50	20	IDGD	
CCc1ccc(NC(=O)C(=O)NNC(=O)c2cc3ccccc3o2)cc1S(N)(=O)=O	764331252	ADMLMQWEZSMGOP-UHFFFAOYSA-N	430.442	1.042	50	20	IDGD	
O=C(NNC(=O)C(F)(F)Oc1ccccc1)C(=O)Nc1cc2c(cc1Cl)OCO2	764371038	VMUROTRXZJHMFZ-UHFFFAOYSA-N	427.747	1.826	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2ccc3oc(C)nc3c2)n[nH]1	764376756	HDQGXYISSRQYJK-UHFFFAOYSA-N	434.412	1.935	50	20	IDGD	
CC[C@H](C)n1nc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3OC)[nH]n2)cc1C	764377965	UFJLXSIUIRSQMO-LBPRGKRZSA-N	439.476	1.961	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COCCO1)C(=O)Nc1ccccc1SC[C@H]1CC1(Cl)Cl	764430048	RDCSPSKPGBUPMZ-PWSUYJOCSA-N	448.328	1.474	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNS(=O)(=O)c2cccc3nonc23)c1	765076973	FHNLUUHPNAZJGQ-UHFFFAOYSA-N	427.236	1.617	50	20	IDGD	
CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NNC(=O)c1csc(N2CCOCC2)n1	765368206	LMJRSXSQDQNPGQ-CQSZACIVSA-N	433.490	1.918	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)cc1[N+](=O)[O-]	765748918	JIQQPDYGMDIMLE-UHFFFAOYSA-N	441.488	1.491	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1ccc(CN2CCCC2)cc1	766644273	UCDKJJWHCGPDHY-UHFFFAOYSA-N	449.555	1.501	50	20	IDGD	
CCc1noc(CCCC(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)n1	766648651	JOZSBQFTICHRQO-UHFFFAOYSA-N	428.537	1.228	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cccc(Br)n2)c1	767162410	ZRUQNDLAPFITIH-UHFFFAOYSA-N	427.280	1.169	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1cc(C(=O)NNC(=S)Nc2ccccn2)ccc1F	768578235	DVEFCCIALVXHLH-UHFFFAOYSA-N	425.511	1.929	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)CCCN1C(=O)c2ccccc2C1=O	768612073	MXCLUGZIIDFIPS-UHFFFAOYSA-N	431.470	1.618	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2sc(NC3CC3)nc2C)cc1OC	770074957	MPRXOKDXVRJHMY-UHFFFAOYSA-N	434.474	1.661	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)c3ccc(S(=O)(=O)N(C)C)nc3)n[nH]2)cc1	770219669	GXNQXRPGQJLAOQ-UHFFFAOYSA-N	428.474	1.105	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)NCc3cccc(NC(=O)[C@H]4CCCO4)c3)nc21	770354493	FQHAGUJPPPORHO-CQSZACIVSA-N	426.437	1.013	50	20	IDGD	
CCc1c(C(=O)NNC(=O)CNC(=O)c2cccnc2)cnn1-c1ccc(Cl)cc1	771738162	KOCIKKPLOWMFHG-UHFFFAOYSA-N	426.864	1.674	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)CCNS(=O)(=O)c1ccc(F)cc1	772962784	DPOQOVNQPLPVKV-LBPRGKRZSA-N	443.884	1.762	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(F)c(-n3nnnc3C3CC3)c2)cc1F	773889583	UMIMGAQJLMAFAQ-UHFFFAOYSA-N	441.398	1.526	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)c2ccc3nc(O)[nH]c3n2)cc(OCC)c1OCC	774330318	TZNRVGYJSIUMKI-UHFFFAOYSA-N	429.433	1.934	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)c2ccc(-n3cnc4ccccc43)nc2)c1	775009191	NRLLZSUBWYFTMJ-UHFFFAOYSA-N	440.419	1.910	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2ccc(Cl)nc2)nc1	776062361	FTMHPWCIHBDLSG-UHFFFAOYSA-N	426.886	1.673	50	20	IDGD	
Cc1cc(=O)c(C(=O)NNc2cccc(S(C)(=O)=O)c2)nn1-c1ccccc1[N+](=O)[O-]	776715348	SLZAPOQZHNUEDT-UHFFFAOYSA-N	443.441	1.610	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)c2cc(S(=O)(=O)N(C)C)ccc2F)nc1C	778426545	OIRZZSKDBWLZHB-UHFFFAOYSA-N	425.442	1.108	50	20	IDGD	
COc1ccc2nc(NNC(=O)c3c(OC)ccc(S(N)(=O)=O)c3OC)c(C)cc2c1	778476304	GNAZPLDWFNNVTF-UHFFFAOYSA-N	446.485	1.973	50	20	IDGD	
O=C(NNC(=O)[C@H](O)[C@H](O)c1nc2ccccc2[nH]1)c1ccc(COc2ccccc2)o1	779582362	NGQZTHUAFAUXMH-RBUKOAKNSA-N	436.424	1.590	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)NC[C@H]2CC(=O)N(C3CC3)C2)c1	780885058	BAUQOTCRAGUPGE-SNVBAGLBSA-N	425.283	1.413	50	20	IDGD	
Cn1cc(CNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c(-c2ccccc2)n1	782510385	SPKOGTKOFDLVCE-UHFFFAOYSA-N	434.504	1.624	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C(=O)Nc2ccc(N3CCCC3=O)cc2)nc2ccccc21	782892398	CCHZSLMWJYTPBA-UHFFFAOYSA-N	434.456	1.029	50	20	IDGD	
CC(C)COc1ccccc1NC(=O)C(=O)NNC(=O)c1csc(N2CCOCC2)n1	782896213	CKYGHWJFDJZJDQ-UHFFFAOYSA-N	447.517	1.414	50	20	IDGD	
COc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NNc1ncccc1C(F)(F)F	783120027	HURZTYQGHUHTGV-UHFFFAOYSA-N	425.367	1.893	50	20	IDGD	
CCS(=O)(=O)c1cc(F)ccc1NC(=O)C(=O)NN=c1sc2ccccc2n1C	783349157	ABCCFZXTDLPFRE-UHFFFAOYSA-N	436.490	1.743	50	20	IDGD	
COc1cccc(-c2cc(NC(=O)C(=O)NNc3ccc(-n4cccn4)nn3)n(C)n2)c1	783436682	MOEWYGLOVSVVDT-UHFFFAOYSA-N	433.432	1.153	50	20	IDGD	
Cc1ccc(NNC(=O)C(=O)Nc2c(C)cnn2[C@@H]2CCN(Cc3ccccc3)C2)nn1	783952080	OPXCBOZKYQNZAR-GOSISDBHSA-N	434.504	1.819	50	20	IDGD	
CC(C)Cn1ccc2cc(NC(=O)C(=O)NNC(=O)CNC(=O)c3ccco3)ccc21	784004351	LLPXSAAHPHUABK-UHFFFAOYSA-N	425.445	1.406	50	20	IDGD	
CN(C)c1nccc(NNC(=O)C(=O)Nc2nc3cc4c(cc3s2)OC(F)(F)O4)n1	784970825	OIEMKPMRNPQHHB-UHFFFAOYSA-N	437.388	1.556	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)Nc1ccc(OCC(F)(F)F)cc1	785023716	OQCLHOVPGXGLBR-UHFFFAOYSA-N	442.306	1.641	50	20	IDGD	
Cc1ccc(NC(=O)C(C)C)cc1NC(=O)C(=O)NNC(=O)Cc1cn2ccccc2n1	785061573	XZNHTKWUXISLMR-UHFFFAOYSA-N	436.472	1.566	50	20	IDGD	
Cc1nnnn1[C@@H](Cc1ccccc1)C(=O)OCC(=O)NNC(=O)c1ccc(Cl)cc1	786126076	AVOGMHFFZRRQDN-KRWDZBQOSA-N	442.863	1.423	50	20	IDGD	
COC[C@H](C)Oc1ccc(Cl)cc1S(=O)(=O)NNC(=O)COc1ccccc1O	786845980	SCGZEWSPQGGHGK-LBPRGKRZSA-N	444.893	1.848	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)NCc3ncccc3S(C)(=O)=O)n[nH]2)cc1	787387751	PXWQTJGCZGTEEA-UHFFFAOYSA-N	428.474	1.328	50	20	IDGD	
COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NNC(=O)[C@H]1OCC[C@H]1c1ccccc1	789812699	MMIMFVRKBJBDQD-YOEHRIQHSA-N	428.401	1.262	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)[C@@](C)(O)Cn2ccc(C)cc2=O)c1	790647767	UOOZTTKHODJNLT-SFHVURJKSA-N	438.278	1.140	50	20	IDGD	
Cn1nc([C@@H]2CCCOC2)cc1NC(=O)C(=O)NNC(=O)C12CC3CC(CC(C3)C1)C2	790952582	RTIOJIJWYQRSEQ-LBMSDSGBSA-N	429.521	1.616	50	20	IDGD	
Cc1cccc(=O)n1C[C@@](C)(O)C(=O)NNC(=O)c1ccc(F)cc1Br	792065859	CZPHEFTYMINEQH-QGZVFWFLSA-N	426.242	1.271	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NN=C[C@]23C[C@@H]2CN(C(=O)OC(C)(C)C)C3)c1	792901876	YRZRDDOVPJDDLF-QRWLVFNGSA-N	436.534	1.910	50	20	IDGD	
O=C(NNC(=O)C1CCCC1)C(=O)Nc1ccc2c(c1)N(CC(F)F)C(=O)CS2	793025133	IJUJNCGMYGOHIO-UHFFFAOYSA-N	426.445	1.667	50	20	IDGD	
CSSCCNC(=O)C(=O)Nc1ccc(S(=O)(=O)N2C[C@@H](C)O[C@H](C)C2)cc1	793078283	DQQKZWPAJARCQC-CHWSQXEVSA-N	447.604	1.550	50	20	IDGD	
CCOC(=O)c1ccc(NNC(=O)[C@H](NS(=O)(=O)c2ccc(C)cc2)[C@H](C)O)cc1C	794657978	MGHJDFCECPOPGG-HNAYVOBHSA-N	449.529	1.651	50	20	IDGD	
CO[C@@H]1CCC[C@H](CC(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)C1	795107821	FSXJIBBDRWRGMX-JKSUJKDBSA-N	425.555	1.056	50	20	IDGD	
CCOC(=O)c1ccc(OC)c(S(=O)(=O)NNC(=O)CSc2ccccc2O)c1	795901162	IETHOTFXSHWBSD-UHFFFAOYSA-N	440.499	1.679	50	20	IDGD	
O=C(NNC(=O)c1ccccc1O)C(=O)Nc1ccc(Cl)c(CN2CCOCC2)c1	797534982	HCGPAGBJMHQFSI-UHFFFAOYSA-N	432.864	1.278	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCC1([S@](C)=O)CCC1	798048826	SSLOQEVXXGFZBP-FTJNGKRUSA-N	432.340	1.848	50	20	IDGD	
NS(=O)(=O)c1ccc(C(=O)NNc2nc(-c3cccnc3)no2)cc1Br	798325958	GZQTXFMFFQELPG-UHFFFAOYSA-N	439.251	1.298	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2ccncc2C(F)(F)F)cc1	800688283	SLQLQQBMEYMLJU-UHFFFAOYSA-N	430.408	1.491	50	20	IDGD	
NC(=O)C(=O)Nc1cccc(NS(=O)(=O)c2ccc(OCCBr)cc2)c1	800843853	CFQWRANFWHAJKT-UHFFFAOYSA-N	442.291	1.685	50	20	IDGD	
COc1ccc(S(N)(=O)=O)c(OC)c1C(=O)NNC(=O)Nc1ccc(C)cc1Cl	802048860	ZWUWIURRUWLOAW-UHFFFAOYSA-N	442.881	1.780	50	20	IDGD	
CC(C)(C)OC(=O)N(CC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)CC1CC1	802065982	GPAZIOLVEFDWOM-UHFFFAOYSA-N	440.522	1.890	50	20	IDGD	
COc1cc(C(=O)NCC(=O)NNC(=O)Nc2ccc3c(c2)OCO3)cc(OC)c1OC	802097536	NTJINOUTSRFAQO-UHFFFAOYSA-N	446.416	1.024	50	20	IDGD	
CCn1c(CCC(=O)NNc2cccc(F)n2)nc2cc(S(=O)(=O)N(C)C)ccc21	804768761	UCJQPFVOTHMQNH-UHFFFAOYSA-N	434.497	1.917	50	20	IDGD	
C[C@]1(c2ccc(Br)cc2)NC(=O)N(CC(=O)NNc2cccc(F)n2)C1=O	804773937	XAUYTRGBGKHKGR-QGZVFWFLSA-N	436.241	1.894	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCn3c(C4CCCC4)nnc3[C@H]2C)cc1OC	805789499	DBXIKDZEHIKBAW-CQSZACIVSA-N	442.520	1.791	50	20	IDGD	
CCc1nnc(NC(=O)[C@H](C)[C@@H](C)NC(=O)NNc2ccccc2S(C)(=O)=O)s1	805878491	NAORPHDOGMRXJV-GHMZBOCLSA-N	440.551	1.793	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)[C@H]3CCC(=O)N3C)c2)c(C)c1	806331585	NUURFUKOLXXZSU-GOSISDBHSA-N	444.513	1.486	50	20	IDGD	
N#Cc1ccc(NC(=O)C(=O)NNC(=O)COCc2ccccc2)cc1Br	806979540	ZIBUOYATENDOJD-UHFFFAOYSA-N	431.246	1.623	50	20	IDGD	
CC(C)(C)C(=O)NNC(=O)[C@@H]1CC[C@H](C(=O)NNC(=O)C(C)(C)C)N1Cc1ccccc1	810147293	HVEZTKJYMGFQRH-CALCHBBNSA-N	445.564	1.407	50	20	IDGD	
Cc1nc(-c2ccccn2)nc(NNC(=O)CNS(=O)(=O)c2ccc(C#N)cc2)c1C	810407414	FHCFXOJHTQUOJD-UHFFFAOYSA-N	437.485	1.449	50	20	IDGD	
CC[C@@H]1[C@@H](C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)CCN1C(=O)OC(C)(C)C	811298997	FMJLVCQBLLSXCQ-DLBZAZTESA-N	444.488	1.898	50	20	IDGD	
CCCN(CC)C[C@H](C)NC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	812701600	ACQSIAFPNMMYMU-INIZCTEOSA-N	439.582	1.536	50	20	IDGD	
CC(=NNC(=O)[C@H]1CCS(=O)(=O)C1)c1nnn(-c2cccc(Br)c2)c1C	814781626	MANVJNVYIKRFEQ-LBPRGKRZSA-N	440.323	1.613	50	20	IDGD	
Cc1nc(COc2ccccc2C(=O)NNc2ccccc2S(=O)(=O)N(C)C)no1	817053762	FQGYOBSGVCEKEY-UHFFFAOYSA-N	431.474	1.964	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)CN1C(=O)N[C@@](C)(c2ccc(F)cc2)C1=O	818486744	HDPXNPAEUWDILB-QFIPXVFZSA-N	442.447	1.382	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)c2cc(S(=O)(=O)N(C)C)ccc2Cl)c1	825771664	YZFSOABMULEAKR-UHFFFAOYSA-N	440.909	1.472	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)/C(C#N)=C\c2cc(C#N)n(C)c2C)c2ccccc2c1=O	834815974	ZSHSIRSRLJSLSD-YBEGLDIGSA-N	443.467	1.693	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)OCC(=O)NC2CCN(C(C)=O)CC2)c1C	897556944	BGWCUOTWSYEKLU-UNOMPAQXSA-N	430.505	1.329	50	20	IDGD	
COc1nn(C)c2nc(C)c(CCC(=O)NNC(=O)[C@@H]3COc4ccccc4O3)c(C)c12	914747935	WTRBZCCLMGSSJZ-KRWDZBQOSA-N	439.472	1.514	50	20	IDGD	
C[C@H]1CN(Cc2ccc(C(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)cc2)C[C@H](C)O1	914781875	UFAYBSZUGPXKOD-HOTGVXAUSA-N	449.511	1.618	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)NC[C@@H](c2ccc(OC)c(OC)c2)N(C)C)c1	915898145	SPXWBFXWXMMLBZ-SFHVURJKSA-N	446.504	1.968	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(CNC(=O)NNC(=O)Cn2nc(C)cc2C)cc1	915925467	SAGKDHFLWXFVPL-UHFFFAOYSA-N	436.538	1.061	50	20	IDGD	
Cn1ccnc1[C@@](O)(CCNC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)C(F)(F)F	916381755	RRKZOGIPLIRALV-HNNXBMFYSA-N	430.343	1.113	50	20	IDGD	
CCCCN(C(=O)COC(=O)/C(C#N)=C\c1cccc(OC)c1)[C@@H]1CCS(=O)(=O)C1	916599478	RQAZKGLHDGZPAF-UWKDKTGGSA-N	434.514	1.961	50	20	IDGD	
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1ccco1)NNC(=O)c1ccc([N+](=O)[O-])cc1	919639959	UZSFXHXESGVKAI-OAHLLOKOSA-N	444.400	1.187	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)[C@H](CC(C)C)N1C(=O)[C@H]2CC=CC[C@H]2C1=O	919822778	IYKSFNFOKQSZOY-KSZLIROESA-N	427.501	1.751	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)c2ccc(Br)cc2n1	919886478	RVPDBTAVWAMDSL-LLVKDONJSA-N	441.307	1.437	50	20	IDGD	
C[C@H]1C[C@@H](C)CN(C[C@H](C)NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)C1	919924635	QQWUXHDUWCXCCK-HBMCJLEFSA-N	444.624	1.896	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1cccc(N2CCNC2=O)c1	1248659580	IDRKWWMKOZMHOR-UHFFFAOYSA-N	446.847	1.496	50	20	IDGD	
O=C(NCc1ccc(NC(=O)C2CC2)cc1)NNC(=O)C1CCN(c2ncccn2)CC1	1318267614	JULOGJPCLNMFFM-UHFFFAOYSA-N	437.504	1.572	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)ccc2cncn12	1337335679	BPRJGKCCOLLOBU-UHFFFAOYSA-N	427.486	1.502	50	20	IDGD	
O=C(/C=C/C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Cl)C1)NCc1ccco1	1778029836	HCQZQIBTOZQBRZ-DGLVXXGDSA-N	441.887	1.500	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)/C=N/N3CCCCC3)C2)C1	1779020280	MBHDRFPRYVNSNS-UDBLOYCBSA-N	429.359	1.462	50	20	IDGD	
Cc1nnsc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CO[Si](C)(C)C)C1	1779544227	OPQKGBHSBCYRAB-RDTXWAMCSA-N	426.615	1.826	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(C(F)(F)F)nn3C)C2)C1	1779657179	KIGIEPXMCWINRT-BZNIZROVSA-N	438.834	1.136	50	20	IDGD	
COc1cc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)ccc1O	1780751415	YGVCSCUJHBZPBV-WMLDXEAASA-N	431.258	1.535	50	20	IDGD	
Cn1cccc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](F)Br)C2)c1=O	1780770396	LSYASYYQYJVQLC-HBUWYVDXSA-N	444.301	1.203	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccn(C(F)F)n3)CCO2)C1	1781230763	ZPAUXTCCWPRXGZ-HZPDHXFCSA-N	425.263	1.958	50	20	IDGD	
Cc1cc(C)n(CCC(=O)N2CCO[C@]3(CCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)n1	1781233876	OCTPISGOBBMUPF-RBUKOAKNSA-N	431.364	1.956	50	20	IDGD	
O=C(c1cnc(Cl)s1)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781332340	XPPSQPXFLLLDIU-RNCFNFMXSA-N	426.695	1.931	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Cl)C2)c1nc2ccc(F)cn2n1	1781433664	PPXHRYFGSMGVMG-UVBSCNOISA-N	427.839	1.530	50	20	IDGD	
CC(=O)N(C)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)Br)C1	1781997334	RFHPPDHSRNPWDT-DDUZABMNSA-N	432.359	1.152	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1c[nH]c3ncccc13)C2	1782172878	PLLIFDOAZCLMCL-CSODHUTKSA-N	434.924	1.944	50	20	IDGD	
C=CC[C@@H](C(=C)C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCC(=O)NN(C)C)C1	1782214129	FGXADVYBTNBWNT-YCRNBWNJSA-N	434.581	1.642	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cccc4nccn34)C2)C1	1782362932	DRMPQARTVPJLJI-AUUYWEPGSA-N	435.322	1.951	50	20	IDGD	
O=C(c1cc2cccnn2c1)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1782385683	GXAOPGCBPSGCAS-PBHICJAKSA-N	425.258	1.468	50	20	IDGD	
C[C@@H](CC(=O)N1CC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1)Oc1ccccc1	1782879611	FAUFQRCIRAQJEU-MBSDFSHPSA-N	446.548	1.047	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)Cc3c(C)nn(C)c3C)CCO2)C1	1783354517	SACWCQBZUCUNKH-QFBILLFUSA-N	441.370	1.583	50	20	IDGD	
O=C(COc1ccccc1F)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1783361873	WSLQAADUHVXOFN-DOTOQJQBSA-N	433.249	1.725	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)CCc3cccnc3OC)CCO2)C1	1783872614	DLYKFRISPLZPES-JXFKEZNVSA-N	425.913	1.107	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](C)Cn3ccnc3)C2)C1	1784495809	ZTHQKSATTJVNGV-RKVPGOIHSA-N	427.343	1.380	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CNC(=O)c3cccnc3)[C@H]2C1	1785169362	MMTDAPFMNYVLPK-XSLAGTTESA-N	436.940	1.199	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cccc(C(=O)N(C)C)c3)C2)C1	1785285192	NLTORKOKZCIQKC-LAUBAEHRSA-N	437.924	1.086	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3nc(C)sc3C)[C@H]2C1	1785413717	YEBIRXWXTWHORJ-MPTYRVRUSA-N	429.970	1.536	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3cncnc3)C[C@@H]21	1786405920	JXXJYSROWJEIDC-JYJNAYRXSA-N	425.327	1.174	50	20	IDGD	
Cc1cc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)CBr)C[C@@H]32)n[nH]1	1788688737	IHXSOHAYAPTDMA-XTBFLFJDSA-N	427.343	1.271	50	20	IDGD	
CC[C@H](C)[C@@H](O)C(=O)NC1(c2ccc(NC(=O)c3cnccc3C(=O)NN)cc2)CCC1	1789519925	RIQIQJZLOJJMEL-IFXJQAMLSA-N	439.516	1.840	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc4ccsc4[nH]3)[C@H]2C1	1790376754	SQWQRVVOCHZNIB-ZOBUZTSGSA-N	447.561	1.196	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3CC(c4ccccc4)=NN3)[C@H]2C1	1790545406	OPJKGDSOLARKFL-GCLMUHHRSA-N	432.952	1.750	50	20	IDGD	
CCOC(=O)O[C@@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21	1790611718	MCNPARGJWMPPFC-VLJOUNFMSA-N	439.278	1.218	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1ccc(C2(NC(=O)c3cc4n(n3)CCNC4=O)CCC2)cc1	1791563515	YFPUQXBEVFLJND-HNNXBMFYSA-N	445.907	1.628	50	20	IDGD	
Cc1cnn(CC(=O)NC2(c3ccc(NC(=O)CCC(=O)NN(C)C)cc3)CCC2)c1	1791600354	ZCZBBEHFPPESMJ-UHFFFAOYSA-N	426.521	1.699	50	20	IDGD	
O=C(/C=C/c1cnccn1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21	1791700130	NDSPYKJPTIUPRM-UEWRTFJKSA-N	427.274	1.160	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1CCCC1	1792621215	VHYAVISXTXJCKB-YVSFHVDLSA-N	442.988	1.853	50	20	IDGD	
COc1ccccc1OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)Br)C2	1792722516	JGHUFUHAKYTNRF-FLTUCWPJSA-N	441.322	1.447	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(C(=O)N(C)C)c1)C2	1793455650	PLUHJDQWIGNJMA-RDGPPVDQSA-N	435.952	1.999	50	20	IDGD	
Cc1oc2cc(O)ccc2c1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1	1796191441	MCMUPXPSMPMYQB-BCDXTJNWSA-N	448.284	1.692	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1c[nH]c3cnccc13)C2	1796892499	IJVRRZVQVCEJGV-CWNKPHDYSA-N	447.499	1.949	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H]1[C@@H]3C=CS[C@@H]13)C2	1796893508	CJJRYQHGPAIRJS-ZXFZUQOXSA-N	427.530	1.634	50	20	IDGD	
COc1cc(OC)cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CO[Si](C)(C)C)c1	1797957392	KZPMMUKSEGKBHA-CWPLJXCYSA-N	436.581	1.759	50	20	IDGD	
COc1c(Cl)ccnc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CO[Si](C)(C)C	1797957559	NRUZYHDHQOGEPK-YWVIFJGQSA-N	441.988	1.798	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2cccnn2n1	1798422326	RDFKFWRBAFWZDW-ABXQLRGKSA-N	426.304	1.169	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnc(O)c2ccn(C)c12	1798427924	CRNCTHUKHGNNTO-RMHZUWNSSA-N	434.924	1.890	50	20	IDGD	
Cc1c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](C)Br)C3)cn2[nH]cnc(=O)c12	1799153618	GJTHGTPAPVWUKC-FVCCEPFGSA-N	436.310	1.366	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3ncnn3c1)C2	1800642049	TXYHXYRHBVEKKI-HLPPOEQASA-N	436.310	1.106	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CCc3nc[nH]c3C1)C2	1800644446	UIUDTNHZBIJLMP-REVBEMBVSA-N	439.354	1.278	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1n[nH]c3c1CCCC3)C2	1800758330	WVRHREVQUHEJRT-MCYUEQNJSA-N	425.327	1.275	50	20	IDGD	
CC[C@H]1CC[C@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)CC1	1800805123	LSFOFHRVLLPFBV-SMOZFGAISA-N	443.548	1.105	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CCCN1Cc1ccccc1)C2	1800981540	OZDGZABSWZFZKI-SSTJLMRISA-N	449.979	1.494	50	20	IDGD	
CCO/C=C/C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1801186165	SQWUXSYUMUPWHV-UMIWNGEVSA-N	445.944	1.258	50	20	IDGD	
O=C(COCCO)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](Br)Cc1ccccc1	1801570720	UJFHJQXPYPPZLE-MHORFTMASA-N	439.350	1.640	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(S(C)(=O)=O)c(F)c1	1801870889	XWTVYYJQPBGULM-UMPJEAMMSA-N	446.928	1.450	50	20	IDGD	
C[C@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](O)NC(=O)OC(C)(C)C)C2	1801965336	HCJNJQSPVLEVNN-HNRZYHPDSA-N	434.331	1.251	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@](C)(O)C[C@H]1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](F)Cl)C2	1802054675	XYVWMKSWQDGJLH-KNJMQODFSA-N	447.935	1.919	50	20	IDGD	
COc1ccc([C@@H]2C[C@H]2C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CCC(=O)NN(C)C)cc1	1802334969	UTBBVPKAGYKEPO-WRJHFWDFSA-N	442.560	1.810	50	20	IDGD	
CNC(=O)CC(=O)N1CC[C@H](CNC(=O)[C@H](C)CBr)[C@@H]1c1cccnc1	1803011130	NYHZICUBXSZXGW-MRRJBJDNSA-N	425.327	1.255	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cccc3c2OCCO3)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803139651	RZVIINGSKCYLST-VDZJLULYSA-N	445.903	1.772	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)CS(=O)(=O)CC)[C@@H]1c1cccnc1	1803685831	CVKPPBBAOQFYKM-XYJFISCASA-N	429.970	1.930	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC2(CCCN(C(=O)/C=C/c3ccoc3)C2)CC1	1806822085	XQEBWGQMAGPKTK-NSCUHMNNSA-N	437.500	1.836	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CN2CCOC2=O)[C@@H]1c1cccnc1)[C@H](F)Br	1808649543	SYQHFQTVHNFDTB-CFVMTHIKSA-N	443.273	1.230	50	20	IDGD	
COC(=O)CCC(=O)N1CC[C@H](CNC(=O)[C@@H](F)Br)[C@@H]1c1cccnc1	1808661541	LTBGNLFRMZEBCX-UHOFOFEASA-N	430.274	1.731	50	20	IDGD	
O=C(c1ccnc(F)c1)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1	1809969293	ONBDVQGYFSSLRM-UHFFFAOYSA-N	425.269	1.059	50	20	IDGD	
O=C(CNc1ccc(F)cc1)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)CCl)CC2	1814832082	RJDCNBKGNIEQJT-OCCSQVGLSA-N	426.901	1.906	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)C2CCC(CO)CC2)n[nH]1	1815688404	JARVFQDVNLDENI-HTWSVDAQSA-N	448.568	1.574	50	20	IDGD	
Cc1cncc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)c1	1816496718	RHOPRERNHKLXDF-LJQANCHMSA-N	433.277	1.413	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](C)Br)CC2	1817310187	OBAYBSZINDPZCC-NGZCFLSTSA-N	431.356	1.705	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)CCl)CC2)c1ccc2c(c1)OCCO2	1817977863	MJDWCFDIVCYOEV-YPMHNXCESA-N	437.905	1.740	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnc4ncccn34)sc2C1	1818439751	ARGVNRKHBCSATK-GHMZBOCLSA-N	434.909	1.665	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3cc4ncccn4n3)sc2C1	1819016046	OZWZLTBTLCLLBM-QWRGUYRKSA-N	434.909	1.665	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](OC(C)=O)C(C)C)sc2C1	1819490281	WRMCAAWXNVSMEE-XUJVJEKNSA-N	431.942	1.897	50	20	IDGD	
C[Si](C)(C)OCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnc(O)nc1O)CC2	1820164915	MGVSWCCEJODRME-VIFPVBQESA-N	437.554	1.422	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](O)CCl)CC2)c1nc(O)n2c1CCCC2	1820232799	KARVATUHRDDALA-CABZTGNLSA-N	439.925	1.207	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)C23CC(C(=O)OC)(C2)C3)[nH]n1	1822377567	XVGKBQXYWSPZDA-KQQHOMHOSA-N	438.912	1.999	50	20	IDGD	
O=C(CCn1ccnn1)N[C@@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1	1823013964	LPXVXXIRMNERON-PRHODGIISA-N	431.291	1.427	50	20	IDGD	
O=C(NCC(=O)N1CCC([C@H]2CCCCN2C(=O)[C@H](O)CCl)CC1)c1cccs1	1824180665	LKGIKOJVDDPEEH-HZPDHXFCSA-N	441.981	1.697	50	20	IDGD	
O=C(c1nc2ccc(F)cn2n1)N1CCC([C@@H]2CCCCN2C(=O)[C@H](O)CCl)CC1	1824188001	MCOYQJISWBHNHA-JKSUJKDBSA-N	437.903	1.701	50	20	IDGD	
CCS(=O)(=O)N[C@H](C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H](F)Cl)CC1	1824459974	JTDHGSPIDVYHTK-YUELXQCFSA-N	425.954	1.468	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)CN2CC(=O)NC2=O)CC1	1824967101	LSXYLGIPTXKZDR-JKSUJKDBSA-N	426.945	1.565	50	20	IDGD	
Cc1ccc(C(=O)N[C@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)cn1	1826080464	MCRNEXZMHTXEBJ-AWEZNQCLSA-N	430.534	1.445	50	20	IDGD	
CCn1ccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)n1	1826094366	NRYAOIKNHPQNBN-IBGZPJMESA-N	432.569	1.509	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H]3CCNC(=O)C3)sc2C1	1826210176	NQEQJLBKSWXOMK-GMTAPVOTSA-N	443.367	1.612	50	20	IDGD	
O=C([C@H]1CCCOC1)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827054483	GISQOWKBVPXHHF-PZJWPPBQSA-N	428.338	1.026	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H]2CC[C@H](O)CC2)CC1	1831997272	QUOPBNHGTMHSOH-UFYCRDLUSA-N	436.597	1.530	50	20	IDGD	
O=C(Cc1cnc2ccccn12)NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1833293270	RAMWIXXTYYQQIL-LJQANCHMSA-N	447.967	1.048	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cc(OC)nn3C)CC2)CC1	1833953605	JXGGHWDDEZTQNB-INIZCTEOSA-N	425.961	1.631	50	20	IDGD	
CC(F)(F)C(C)(C)C(=O)N1CCOC[C@@]2(CN(C(=O)CCBr)CCO2)C1	1834819828	YHOVQJJVCNWPRH-QGZVFWFLSA-N	441.313	1.909	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)COC(=O)C(F)(F)F)CC2)CC1)[C@H](F)Cl	1835080580	PTLMGFXIQFMLKT-ZDUSSCGKSA-N	431.814	1.198	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cccn4cncc34)CC2)CC1	1835615872	OJJOGDOGEGJAET-LJQANCHMSA-N	447.967	1.773	50	20	IDGD	
Cc1nc(C(=O)N2CCC(OC3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)ccc1F	1836714972	GVNCNAXRORKZDC-SFHVURJKSA-N	427.904	1.741	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](COC)NC(C)=O)CC2)CC1	1836923484	ZJPPEGYRZXNONP-RBUKOAKNSA-N	445.988	1.544	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cnncc3C(=O)O)CC2)CC1	1838462297	MKCDEDDTWKAKKI-QGZVFWFLSA-N	438.912	1.804	50	20	IDGD	
COc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)ccc1C	1838988742	LIJAZLFVSVNLMA-LJQANCHMSA-N	431.316	1.877	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc4ccc(F)cn34)C2)C1	1839147889	FZDFZQVPIHFWBZ-MGPUTAFESA-N	438.887	1.561	50	20	IDGD	
O=C(c1ccc(O)c(F)c1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1839305350	IWGCDNQQXQBMNU-WMLDXEAASA-N	449.248	1.292	50	20	IDGD	
Cc1ccnc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)c1	1840033248	YPDQLJRLENAXBR-KDOFPFPSSA-N	426.311	1.243	50	20	IDGD	
O=C(c1scnc1C1CC1)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840186320	IWNLRSBCJHDPTA-QGZVFWFLSA-N	434.345	1.894	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccc(O)cn3)CCO2)C1	1840498005	JMAVBAUPOZYZPQ-OALUTQOASA-N	446.331	1.022	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@]1(F)CCCC=C1F)CCO2	1840950768	AVHAIOXKDGOQCT-JVPBZIDWSA-N	436.883	1.442	50	20	IDGD	
CC(C)(C)OC(=O)N1CC2(CC(C(=O)N3CC4(CCCN4C(=O)[C@H](O)CCl)C3)C2)C1	1841353937	YPHKTXODJCOFSE-OAHLLOKOSA-N	441.956	1.437	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2ccncc2C(F)(F)F)C1	1843532056	HLCWCXMVZPBGQR-UHFFFAOYSA-N	448.405	1.230	50	20	IDGD	
CN1CCC[C@@H](C(=O)N2CCCC23CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C3)C1	1845052556	PVAJKMPDEROAHN-CVEARBPZSA-N	442.988	1.664	50	20	IDGD	
Cn1ncnc1C(=O)N1CC2(CCCN2C(=O)[C@H](Br)Cc2ccccc2)C1	1845940663	CRXDPHKNWKPYRZ-OAHLLOKOSA-N	432.322	1.638	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)c1cccc(OC3CCOCC3)n1)C2	1846362866	AZMLKVTWTXXXLC-MRXNPFEDSA-N	437.924	1.710	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H](CC(=O)N2CCCC23CN(C(=O)[C@H](O)CCl)C3)C1	1846471802	MYVVURHDDYTPOA-LSDHHAIUSA-N	429.945	1.437	50	20	IDGD	
CSc1ccc(CC(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)cc1	1846496552	OIFZZRZNDRCCJN-UHFFFAOYSA-N	439.541	1.467	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)C(C)(C)C	1847528396	VWQWFIBVRWWMFT-XYJFISCASA-N	433.461	1.743	50	20	IDGD	
Cc1nc(N2CCOCC2)[nH]c(=O)c1CCC(=O)NNC(=O)C12CC3CC(CC(C3)C1)C2	14081228	FCAVBAXHLMCGQD-UHFFFAOYSA-N	443.548	1.211	50	20	IDGD	
COc1ccccc1N1C[C@H](C(=O)OCC(=O)NNC(=O)c2ccc(C)cc2)CC1=O	21607079	BVMSSAJWOIKIBD-MRXNPFEDSA-N	425.441	1.361	50	20	IDGD	
C[C@H](Oc1ccc(Br)cc1)C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	24061898	GCMPMPHNYYPXBK-NSHDSACASA-N	431.250	1.653	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2C(=O)N[C@@](C)(c3ccc(F)cc3)C2=O)cc1OC	25433715	LCBLADXSOBCEKI-NRFANRHFSA-N	444.419	1.071	50	20	IDGD	
C#CCNS(=O)(=O)c1ccc(C(=O)NNC(=O)CC23CC4CC(CC(C4)C2)C3)cc1	26069455	KBMZLJHSSRESMN-UHFFFAOYSA-N	429.542	1.966	50	20	IDGD	
CN1C(=C(C#N)C(=O)COC(=O)CNC(=O)c2cccc([N+](=O)[O-])c2)N(C)c2ccccc21	28210440	HFSWUVJPHKOVIN-UHFFFAOYSA-N	449.423	1.758	50	20	IDGD	
COCC[C@H](C)NC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	726261224	OPXJEUKNXCXABR-LBPRGKRZSA-N	426.520	1.918	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N=c2sccn2C)cc1	726533719	WIFODRNUSGXLHS-KNTPBDMRSA-N	436.497	1.869	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)[C@@H](c2ccccc2)N2CCN(C)CC2)cc1	727766274	OONODDYEHICFFG-XMSQKQJNSA-N	440.544	1.989	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1nn(-c2ccccc2)cc1O)c1ccc2c(c1)CC(=O)N2C	728311265	VASKKUYHRPHWOE-ZDUSSCGKSA-N	434.456	1.802	50	20	IDGD	
COc1ccc(COCCCNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1	728955287	OSQBRCJSUCFBLD-UHFFFAOYSA-N	442.520	1.639	50	20	IDGD	
CC[C@@H](N=c1nn[nH]n1-c1ccccc1)C(=O)NNc1nc2ccccc2c(=O)n1CC	729260720	WQFPRWFVLXDZBK-MRXNPFEDSA-N	433.476	1.148	50	20	IDGD	
C=CCOCC(=O)NNC(=O)c1ccc(CN(C)S(=O)(=O)c2ccc(C)cc2)cc1	729296702	AOLZKDVAIHKQGB-UHFFFAOYSA-N	431.514	1.779	50	20	IDGD	
CC(C)(C(=O)NNC(=O)[C@@H]1CCCN1C(=O)/C=C\c1ccc(C(N)=O)cc1)c1ccccc1	731176237	LRVGIJJKBHNVKX-LFDGNKEFSA-N	448.523	1.915	50	20	IDGD	
COC(=O)c1ccc(CCC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1	731597335	MKQWDRBBCBFMLJ-UHFFFAOYSA-N	433.486	1.117	50	20	IDGD	
CNC(=O)CCCNC(=O)/C(C#N)=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	733167094	SZUDLSCUZBSKKH-RVDMUPIBSA-N	442.907	1.628	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccccc1F)NNC(=O)c1cnn(-c2ccccc2)c1	733170164	QHYQHNHZFRMIFQ-UHFFFAOYSA-N	431.449	1.141	50	20	IDGD	
Cc1cc(=O)oc2cc(OCC(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)ccc12	734239246	JQXXHTXRXOBWCN-UHFFFAOYSA-N	434.449	1.335	50	20	IDGD	
COc1ccc([C@@H]2[C@H](C(=O)NNc3nc4ccccc4c(=O)n3C)CCC(=O)N2C)cc1	734438750	QKRBUYWWWYFSQM-YLJYHZDGSA-N	435.484	1.995	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)[C@]2(C)Cc3ccccc3C(=O)O2)CC1	734821849	NDJSZKXLOUGLCH-QFIPXVFZSA-N	446.504	1.888	50	20	IDGD	
Cc1ccc2ncc(C(=O)NNC(=O)NC3CCN(C(=O)OC(C)(C)C)CC3)c(=O)n2c1	734822230	SOQJNLHXHDJBLO-UHFFFAOYSA-N	444.492	1.346	50	20	IDGD	
COc1ccc(S(=O)(=O)C[C@@H](C)C(=O)NNC(=O)c2c(C)nc3ccccn23)cc1	735030759	JSANPANXTWHLLF-CYBMUJFWSA-N	430.486	1.522	50	20	IDGD	
C=CCOc1ccc(C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)cc1	735116839	IELKNPGOTUCMSZ-UHFFFAOYSA-N	431.518	1.339	50	20	IDGD	
Cc1ccc(O[C@H](C)C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)cc1	735117319	QPRPOCOACHJOOO-MRXNPFEDSA-N	433.534	1.237	50	20	IDGD	
COc1ccc(-c2nnc(S)n2CC(=O)NNC(=O)COCc2ccccc2)cc1	738545875	SQJBFVJHDAUCSW-UHFFFAOYSA-N	427.486	1.607	50	20	IDGD	
COc1ccc(-c2n[nH]c(CNC(=O)NNC(=O)Cc3nc4ccccc4n3C)n2)cc1	741419225	SIWKBKRPDKCLQB-UHFFFAOYSA-N	434.460	1.440	50	20	IDGD	
O=C(CCSc1ccc(F)cc1)NNC(=O)CCN1C(=O)[C@H]2[C@H](C1=O)[C@H]1CC[C@H]2O1	742479910	CIKPJSNKOYNMMY-DTTOXWODSA-N	435.477	1.008	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)c1cn([C@@H]2CCS(=O)(=O)C2)nc1C(C)C	742487985	CQRZXSNRAJNEJV-CQSZACIVSA-N	444.517	1.397	50	20	IDGD	
CC1CCC(NS(=O)(=O)CC(=O)NNC(=O)c2cccc(Br)c2)CC1	742770445	ZMKRKTWXHQTXRF-UHFFFAOYSA-N	432.340	1.708	50	20	IDGD	
O=C1C[C@@H](Cc2ccc(C(=O)NNC(=O)c3ccc(F)cc3Br)cc2)C(=O)N1	743313987	PVEQDSVPAXHXLT-GFCCVEGCSA-N	448.248	1.868	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)ccc1O)c1ccc(=O)n(-c2ccc(F)cc2)n1	743729674	CNEOGDXPERJYIC-UHFFFAOYSA-N	447.220	1.915	50	20	IDGD	
O=C(CNC(=O)c1cccc(Cl)c1)NNC(=O)c1cc(Br)ccc1O	743733961	WGJZBKLEYSYANT-UHFFFAOYSA-N	426.654	1.999	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)CCc2nc(-c3ccsc3)no2)c1	744523919	XLWLGTMJKQZNAO-UHFFFAOYSA-N	425.426	1.607	50	20	IDGD	
CCCn1c(=O)n(CCC(=O)OCC(=O)NNC(=O)c2cccc(C)c2)c2ccccc21	744601863	WBQKYWUDQQGGPJ-UHFFFAOYSA-N	438.484	1.916	50	20	IDGD	
COc1ccc(SCC(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)cc1	744620851	PEQRZGBRTDEWQB-UHFFFAOYSA-N	437.543	1.952	50	20	IDGD	
C=C1c2ccccc2C(=O)N1CC(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	744621099	OTNJZYKLOHZUTO-UHFFFAOYSA-N	442.497	1.277	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)[C@H]2CC(=O)N(c3ccc(F)cc3F)C2)c1	744707657	OWNVAPGMVCIKFU-AWEZNQCLSA-N	442.378	1.194	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)NCC(=O)NNC(=O)C(C)(C)c2ccccc2)cc1	746240101	VUQNADRUYRYJDQ-UHFFFAOYSA-N	447.513	1.267	50	20	IDGD	
O=C(COc1ccccc1O)NNS(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F	746663983	DBWLTTIAELWUCR-UHFFFAOYSA-N	435.336	1.708	50	20	IDGD	
O=C(O)c1cc(S(=O)(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc(Cl)c1Cl	746696201	NRFQDIAWOBSTED-CYBMUJFWSA-N	447.252	1.841	50	20	IDGD	
N#Cc1cccc(NNC(=O)c2cc(I)ccc2-n2cnnn2)c1	748044473	POPZSKGVIZSHHB-UHFFFAOYSA-N	431.197	1.895	50	20	IDGD	
CC(C)(C(=O)NNC(=O)c1ccc(S(N)(=O)=O)c(Br)c1)c1ccccc1	748080963	UDSOXCVTDCWYEU-UHFFFAOYSA-N	440.319	1.835	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)NC[C@@]2(N(C)C)CCSC2)c2ccccc2c1=O	748647042	KXZYKUGWGKFMBA-FQEVSTJZSA-N	432.550	1.359	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)NCC2CCN(S(C)(=O)=O)CC2)c(C)n1-c1ccccc1	749017839	WKZJPTMFIIXCIR-UHFFFAOYSA-N	447.561	1.710	50	20	IDGD	
COc1ccc(S(=O)(=O)NCCC(=O)NNC(=O)c2cc3ccccc3o2)cc1OC	749468340	VGSKKDYMEGZJFN-UHFFFAOYSA-N	447.469	1.580	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)c1cccc(F)c1I	749805599	DOAYFRIZHIYRGS-UHFFFAOYSA-N	447.229	1.683	50	20	IDGD	
C[C@@H](NC(=S)NNC(=O)c1ccc(S(=O)(=O)NC[C@H]2CCCO2)cc1)C1CC1	751620656	XOEXWZWFYNTERH-IUODEOHRSA-N	426.564	1.051	50	20	IDGD	
CN1C(=O)N[C@]2(CCC[C@H]2CNC(=O)NNC(=O)CCSc2ccc(F)cc2)C1=O	753023717	OIMGQIYCSKGDKX-BUXKBTBVSA-N	437.497	1.359	50	20	IDGD	
CCCN(CCNC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)C(=O)OC(C)(C)C	754084974	PYGARNXQSIWVAL-UHFFFAOYSA-N	432.485	1.253	50	20	IDGD	
NC(=O)CS(=O)(=O)c1ccc(C(=O)NNC(=O)Cc2ccc3ccccc3c2)cc1	754422927	GYHOKBDJXOOWGD-UHFFFAOYSA-N	425.466	1.103	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)Nc1nnc(C(F)(F)F)s1	755486373	NYEAOLYVDAWOGD-UHFFFAOYSA-N	443.455	1.922	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)Nc1cccc(S(=O)(=O)NC2=NCCCCC2)c1	755493315	ARZBUEHTRDIRME-UHFFFAOYSA-N	432.506	1.742	50	20	IDGD	
Cc1cc(C)nc(-n2nc(C)cc2NC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)n1	755517186	YTMDJBWGXJUSHH-UHFFFAOYSA-N	447.459	1.945	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2cccc(CN3CCCC3=O)c2)c1	755687841	VZUNAOMSPAWIKG-UHFFFAOYSA-N	430.486	1.679	50	20	IDGD	
COC(=O)c1cc(NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)ccc1Cl	755850707	YKNDVXWFSLPFOR-UHFFFAOYSA-N	432.868	1.986	50	20	IDGD	
O=C1CN(c2ccc(NC(=O)NNC(=O)COCc3ccccc3)cc2Cl)CCN1	755937251	DYOKSLFAIDLPMP-UHFFFAOYSA-N	431.880	1.646	50	20	IDGD	
COCC[S@](=O)Cc1cccc(NC(=O)NNC(=O)c2ccc3c(c2)OCCO3)c1	756615121	WHUIKENERRTSLM-PMERELPUSA-N	433.486	1.819	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)Nc1ccc2c(c1)C(=O)NCC2	756615586	DQZNUCNGMIPZHR-UHFFFAOYSA-N	436.516	1.338	50	20	IDGD	
CC[C@H]1CC[C@@H](C(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)O1	756901012	GCMHWGCIPWASIP-HKUYNNGSSA-N	431.514	1.884	50	20	IDGD	
O=C(c1cccnc1Br)N1CCN(S(=O)(=O)CBr)CC1	758528055	OKTOKRHLTKZRDF-UHFFFAOYSA-N	427.118	1.284	50	20	IDGD	
O=C(NNC(=O)c1cccc(NC(=O)[C@H]2Cc3ccccc3O2)c1)C(=O)Nc1ccccn1	758839874	FQUZGQDMHHNKCK-GOSISDBHSA-N	445.435	1.424	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)c1cn(CC2(C)COC2)nn1	758997332	ZFEJSSVSCZNEHS-LLVKDONJSA-N	438.282	1.306	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)c2cn(Cc3cccc(F)c3)nn2)c2ccccc2c1=O	759112486	UEZWTXPUOIXGJZ-UHFFFAOYSA-N	449.446	1.831	50	20	IDGD	
NC(=O)[C@@H]1CC[C@@H](CNC(=O)C(=O)Nc2ccccc2S[C@@H](Cl)C(F)(F)F)O1	760120692	JTLKQZXIYWRGOX-KPWYMIHSSA-N	439.843	1.994	50	20	IDGD	
CS(=O)(=O)c1ccc(OCCCCC(=O)NNc2nccc(N3CCOCC3)n2)cc1	762860111	DMDVBHKRIRGADA-UHFFFAOYSA-N	449.533	1.409	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)CCNS(=O)(=O)c2ccccc2Cl)n1	762907697	PDKHFHVVOBBWEX-UHFFFAOYSA-N	426.930	1.788	50	20	IDGD	
Cn1nccc1CCNC(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	763162517	TZZRGVBXXNGCPI-UHFFFAOYSA-N	445.483	1.365	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3n2)cc1S(C)(=O)=O	763450419	NVMBTFPYANMSAG-UHFFFAOYSA-N	426.454	1.346	50	20	IDGD	
COc1c(Br)cc(Cl)cc1NC(=O)C(=O)NNC(=O)c1ccncc1	763463927	HSVOEGWLNQAPKS-UHFFFAOYSA-N	427.642	1.906	50	20	IDGD	
CN(C(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccccn2)cc1)c1ccccc1	763467873	UMTBLZTWXVAVON-UHFFFAOYSA-N	431.452	1.687	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc([S@](=O)C(F)(F)F)cc1	763468930	YOOXRRCMWSGPEV-PMERELPUSA-N	444.347	1.622	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)C(=O)Nc1ccnn1Cc1ccccc1F	763548782	QWOSCVPGGHQJLW-UHFFFAOYSA-N	425.376	1.199	50	20	IDGD	
COC(=O)c1ccc(-n2cc(C)cn2)c(NC(=O)C(=O)NNC(=O)c2ccccc2F)c1	763561629	OUPGNQFEICUXKM-UHFFFAOYSA-N	439.403	1.506	50	20	IDGD	
COCCCn1ccc(NC(=O)C(=O)NNC(=O)c2cc(C)n(-c3ccccc3)c2C)n1	763600005	CUCGGZWTBMBWCM-UHFFFAOYSA-N	438.488	1.727	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)[nH]n1)C(=O)Nc1ccn(Cc2ccccn2)n1	763601034	NCBXEYHWBLMLDD-UHFFFAOYSA-N	430.428	1.116	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)[nH]n1)C(=O)Nc1cccc(CN2CCOC2=O)c1	763606193	WJJUFWMBJBYXMA-UHFFFAOYSA-N	448.439	1.429	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(N2CCO[C@H](C)C2)cc1	763661922	FEOLLHQZGRGGAA-OAHLLOKOSA-N	442.472	1.085	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(Br)cc2F)cc1	763662103	UPDFZRRPBQTOBS-UHFFFAOYSA-N	440.225	1.762	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(N2CCCC2=O)c(F)c1	763662900	LWXDAKRCTAKUTO-UHFFFAOYSA-N	444.419	1.126	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(NC(=O)OC)cc1	763679533	AIYOTJYMGGLIQH-UHFFFAOYSA-N	430.417	1.429	50	20	IDGD	
Cc1ccn(-c2ccccc2NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)n1	763687111	ZOQIVMOHZQUVPN-UHFFFAOYSA-N	427.848	1.999	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)c(C)c1	763695437	UUXDWGVTDVHKKS-UHFFFAOYSA-N	449.847	1.365	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccc(OC[C@@H]2CCCO2)c1	763712108	KYZHKIQYHWQGAS-IBGZPJMESA-N	441.484	1.972	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)C(=O)Nc2cccc(Cl)c2Cl)c2ccccc2c1=O	763789713	AYEPSVVKGOLFSG-UHFFFAOYSA-N	434.239	1.640	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)C(=O)Nc1cc(F)ccc1OC[C@@H]1CCCO1	763838033	LUAQTLBOLNPJIG-INIZCTEOSA-N	449.410	1.688	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(N3CCOC3=O)cc2)c1C	763839984	HIWFRRVTAVKTIR-OAHLLOKOSA-N	440.456	1.813	50	20	IDGD	
CCS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)cc1	763852436	WANXGMASCNFKDV-HNNXBMFYSA-N	447.513	1.650	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccnn1Cc1ccccc1F	763863558	AHSFEHMQNOJLTI-CYBMUJFWSA-N	443.410	1.763	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cn(-c3ccccc3)nc2C)cc1	763878628	SCEFYQBMGKBENU-MRXNPFEDSA-N	449.467	1.937	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc(CCN2CCSCC2)cc1	763960677	SOOFIVBMSWDDNH-UHFFFAOYSA-N	426.542	1.986	50	20	IDGD	
COCCOc1cccc(NC(=O)C(=O)NNC(=O)c2cc(Br)cn2C)c1	764004795	MSDRSXLXTPPMJR-UHFFFAOYSA-N	439.266	1.213	50	20	IDGD	
CC(C)C[C@@H](C)n1nccc1NC(=O)C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	764078388	SIOZLQVUUWTNPD-CYBMUJFWSA-N	435.506	1.293	50	20	IDGD	
O=C(NNC(=O)c1ccoc1)C(=O)Nc1ccnn1Cc1ccc(Br)cc1	764159820	HYBFSAKWFZVPEA-UHFFFAOYSA-N	432.234	1.687	50	20	IDGD	
C[C@H]1CN(Cc2cccc(NC(=O)C(=O)NNC(=O)CCc3ccco3)c2)C[C@@H](C)O1	764171460	LFPGIGBRKSULRH-IYBDPMFKSA-N	428.489	1.608	50	20	IDGD	
CN1CCC[C@H](N(C)C(=O)c2ccc(NC(=O)C(=O)NNC(=O)CC(C)(C)C)cc2)C1	764197536	DAGRXVCHAGNECX-KRWDZBQOSA-N	431.537	1.375	50	20	IDGD	
CN1CC(=O)N(c2cccc(NC(=O)C(=O)NNC(=O)CCCc3ccccc3)c2)C1=O	764224260	MOVHNZAIJVWUDL-UHFFFAOYSA-N	437.456	1.194	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cc(C(=O)NC)ccc3C)n[nH]2)cc1	764385364	ZDKIWZRUJNFMLQ-UHFFFAOYSA-N	448.483	1.707	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)C(=O)Nc2ccc(-n3cc(C)cn3)c(F)c2)c1	764433190	LINNTOJNOWXEEC-UHFFFAOYSA-N	439.407	1.073	50	20	IDGD	
CCS[C@H](C)c1noc(CN(C)C(=O)NNC(=O)CNC(=O)c2cccs2)n1	765732657	JNUZGWBUPGVDJV-SNVBAGLBSA-N	426.524	1.548	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1ccc(I)cc1Cl	766265147	WYSHGPGQAJVLRO-UHFFFAOYSA-N	447.620	1.825	50	20	IDGD	
CCc1cccnc1C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	766293224	CTBYGSOLQOVDJK-UHFFFAOYSA-N	446.529	1.059	50	20	IDGD	
O=C(NCCN1CCN(c2cccc(Cl)c2)CC1)NNc1ccc(-n2cccn2)nn1	767189750	MCGCIGHTNYONNY-UHFFFAOYSA-N	441.927	1.764	50	20	IDGD	
COc1ccc(-c2cc(C(=O)OCC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)n[nH]2)cc1	767573097	FHQQCLAAGITOFY-UHFFFAOYSA-N	439.384	1.612	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)NC1CCN([C@H]2CCCC[C@H]2O)CC1	767946906	HQISUCYLOFZSIV-VQTJNVASSA-N	426.521	1.584	50	20	IDGD	
CC(C)(O)C(=O)NNC(=O)c1ccc(I)c(Br)c1	768246847	ZXGRVKDPOCRFEB-UHFFFAOYSA-N	427.036	1.586	50	20	IDGD	
CCNC(=O)N(C)NC(=O)[C@H](CCS(C)(=O)=O)NC(=O)c1ccc(C(C)(C)C)cc1	768411101	WYROUVRBMLERRE-INIZCTEOSA-N	440.566	1.210	50	20	IDGD	
Cc1cnn(Cc2ccccc2F)c1NC(=O)C(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	769257268	YDZXNXXQQSJGQA-UHFFFAOYSA-N	440.391	1.687	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)NCCCNC(=O)c3ccc(F)cc3)nc21	770397182	VLHLMBBSQXBECF-UHFFFAOYSA-N	444.471	1.872	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)c3ccc(N4CCCS4(=O)=O)cc3)nc21	770969034	RCZPQZRMNOPVTC-UHFFFAOYSA-N	445.505	1.584	50	20	IDGD	
Cc1sc2ncc(C(=O)NNC(=O)C(=O)NCc3ccc(Cl)cc3)c(=O)n2c1C	775802229	TUSLOTMLDAWIDF-UHFFFAOYSA-N	433.877	1.104	50	20	IDGD	
CN(NC(=O)CCCc1nc(C2CC2)no1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776201565	JMXPGNDKHDIBIK-UHFFFAOYSA-N	436.513	1.905	50	20	IDGD	
O=C(Cc1n[nH]c2c1CCCC2)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	777180288	OXCZYUCTWOSQBY-UHFFFAOYSA-N	431.518	1.077	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1)c1ncn(C)n1	780689954	HFUIJDWGOVLMMD-LLVKDONJSA-N	449.518	1.383	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(N2C[C@@H](C(=O)NN=c3cc[nH]cc3)CC2=O)cc1	780761907	LIHIXUDLIOMVFS-HNNXBMFYSA-N	431.518	1.030	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@]2(C[C@H]2C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)C1	781280862	JDTBULCJOLKYLZ-KSFYIVLOSA-N	442.472	1.510	50	20	IDGD	
O=C(COC(=O)c1ccc(OC2CCCC2)nc1)NNC(=O)c1ccc([N+](=O)[O-])cc1	781759476	GXSDYRAXQXVVBG-UHFFFAOYSA-N	428.401	1.929	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)N2CCC(C(=O)NNc3ncncc3Cl)CC2)cc1	781818673	FQUZRVPAYFLUDM-UHFFFAOYSA-N	437.909	1.877	50	20	IDGD	
O=C(NNc1cccc([N+](=O)[O-])c1)[C@@H]1C[C@H](O)CN1S(=O)(=O)c1ccc(Cl)cc1	782016924	MGMBJGPESSDLGD-HOCLYGCPSA-N	440.865	1.515	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)C(=O)Nc1ccc2c(c1)CCC(=O)N2CC(F)(F)F	782117433	OBXGYIIWVYPTKG-UHFFFAOYSA-N	449.389	1.252	50	20	IDGD	
O=C1[C@H](N2CCN(S(=O)(=O)CBr)CC2)CCCN1Cc1ccccc1	782477406	UEPUPKTUOSRECI-MRXNPFEDSA-N	430.368	1.477	50	20	IDGD	
CN1CCN(CCOc2ccc(NC(=O)C(=O)NNc3ccc(F)cc3F)cc2)CC1	783342774	JMYHSDZKUUGXTC-UHFFFAOYSA-N	433.459	1.673	50	20	IDGD	
COCCOC(=O)c1c(NC(=O)C(=O)NNc2ccc(C)cc2)sc(C(N)=O)c1C	783346288	JDYPZGHHWPEMPL-UHFFFAOYSA-N	434.474	1.349	50	20	IDGD	
Cc1cc(C)cc(NNC(=O)C(=O)N2C[C@H](C(=O)N3CCOCC3)Oc3ccccc32)c1	783359256	KIOFZLPBYSLNDG-HXUWFJFHSA-N	438.484	1.400	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccc(C#N)c(C(F)(F)F)c2)cn1	784238498	PZOKSSLIJRZQPA-UHFFFAOYSA-N	427.364	1.457	50	20	IDGD	
CCCCn1nccc1NC(=O)C(=O)NNc1ccccc1S(=O)(=O)NC(C)(C)C	784833176	JPWWSEDOFBJAFP-UHFFFAOYSA-N	436.538	1.842	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)Nc1ccnn1Cc1ccccc1F	785024328	WUKQLISPAARJIK-UHFFFAOYSA-N	442.363	1.084	50	20	IDGD	
Cc1coc(-c2cc(NC(=O)C(=O)NNC(=O)Cc3cn4ccccc4n3)ccc2C)n1	785060075	GRITWMPVNMKBLH-UHFFFAOYSA-N	432.440	1.935	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)NCc1ccc(S(C)(=O)=O)s1	787310393	XSHYDXHUPLOARA-UHFFFAOYSA-N	434.540	1.287	50	20	IDGD	
Cc1ccc(N2CCNC2=O)cc1NC(=O)C(=O)NNc1ccc(Br)nc1	787560967	FTUXEUKJIIMSDA-UHFFFAOYSA-N	433.266	1.764	50	20	IDGD	
Cc1cc(N2C[C@H](C(=O)NNC(=O)N3CCN(C)CC3)CC2=O)ccc1Br	788167015	TYPJUSBHRQUHTL-CYBMUJFWSA-N	438.326	1.099	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)Nc1nc2c(s1)CCCCC2	789732143	QJBBMMROYMEZBU-UHFFFAOYSA-N	440.323	1.913	50	20	IDGD	
Cc1nnc(-c2cccc(NC(=O)C(=O)NNC(=O)[C@H]3OCC[C@H]3c3ccccc3)c2)n1C	789812320	KXSGZGJIZQZNJC-OALUTQOASA-N	448.483	1.449	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(CCC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)CC1	792168931	DBSJZAPQJCYLPF-UHFFFAOYSA-N	442.520	1.576	50	20	IDGD	
C[C@@](O)(Cn1cc(C(F)(F)F)ccc1=O)C(=O)NNC(=O)CSc1ccccc1O	792288784	YSGXNORPQHEGNU-QGZVFWFLSA-N	445.419	1.263	50	20	IDGD	
CC(=O)N1CCC[C@H](CNC(=O)NNC(=O)[C@H](C)Oc2cccc(Br)c2)C1	792781586	XKZSTMJUDMTUTO-GXTWGEPZSA-N	441.326	1.805	50	20	IDGD	
COc1cccc(C2(C(=O)NNC(=O)c3cccc(S(=O)(=O)N4CCCC4)c3)CC2)c1	794739975	BDVJNROUHSHZLQ-UHFFFAOYSA-N	443.525	1.973	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C[C@H]1COCCN1C(=O)OC(C)(C)C	794779930	IGFSQJDGTUFLKQ-KGLIPLIRSA-N	425.457	1.766	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)c1ccc(=O)n(-c2cccc(F)c2)c1	795169329	NDIAFJOETNSNSI-UHFFFAOYSA-N	430.461	1.984	50	20	IDGD	
C[C@@]1(C(=O)NNc2nccc(N3CCOCC3)n2)CCN(C(=O)OCc2ccccc2)C1	795173006	CWAHRTHILPGUME-JOCHJYFZSA-N	440.504	1.805	50	20	IDGD	
C=C(CBr)COC(=O)[C@H](NS(=O)(=O)c1ccc(Cl)cc1)[C@@H](C)O	795321831	YXHNIWBZATWMHM-ZWNOBZJWSA-N	426.716	1.862	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NC(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)nc1	797653787	MNSQPYQMHBGIDY-UHFFFAOYSA-N	429.462	1.189	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)CN2C(=O)Cn3c(cc4ccccc43)C2=O)c2ccccc2n1	799008737	AIPBNIOHMZSKRD-UHFFFAOYSA-N	441.447	1.942	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNS(=O)(=O)c2cnc3ccccc3c2)cc1	800831562	WCFUMTBZHWUWRX-UHFFFAOYSA-N	448.526	1.173	50	20	IDGD	
CC(C)(C)OC(=O)c1cnc(C(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)cn1	801891781	PTESOBSWSVPUAL-UHFFFAOYSA-N	428.453	1.789	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)CNC(=O)OCC(F)(F)F)cc1Cl	802075693	HJMCMEYRZWAUBH-UHFFFAOYSA-N	428.751	1.798	50	20	IDGD	
COC(=O)c1c(F)cc(NC(=O)C(=O)NNC(=O)c2c(C)nc3ccccn23)cc1F	802565670	FOZZHYZGWLZWMF-UHFFFAOYSA-N	431.355	1.107	50	20	IDGD	
CC[C@H](C)[C@H](NC(C)=O)C(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	802762420	FZXHYNXCYHIUIN-YWZLYKJASA-N	437.972	1.156	50	20	IDGD	
CCc1nnc(NC(=O)[C@H](C)[C@H](C)NC(=O)NNC(=O)COc2ccccc2F)s1	804867410	AOFIGNQKBSJDFJ-MNOVXSKESA-N	438.485	1.612	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2scc(C)c2C(=O)OC)o1	806977391	HGAOWUUCCMVEQU-UHFFFAOYSA-N	436.490	1.678	50	20	IDGD	
CN(C)c1nccc(NNC(=O)C(=O)Nc2cccc3cc(Br)cnc23)n1	807019010	RXTYWITZXGAUON-UHFFFAOYSA-N	430.266	1.935	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCCc2cccc(C)n2)c1	807427483	WKBOJFXPKKPUIR-UHFFFAOYSA-N	447.561	1.997	50	20	IDGD	
CCOCC(=O)NNC(=O)N[C@H]1CCCN(c2c(C)cc(Br)cc2C)C1=O	807542790	DNQGLIDAIUNEPM-AWEZNQCLSA-N	441.326	1.928	50	20	IDGD	
NC(=O)c1ccc(NC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c(OCC(F)F)c1	810304674	RJNBTYDPJJYWJQ-HNNXBMFYSA-N	436.371	1.422	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)nn1C1CCCCC1	810385594	VZUBJZDUTCVWJX-KRWDZBQOSA-N	427.461	1.623	50	20	IDGD	
CC(=O)Nc1cc(NC(C)=O)cc(C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)c1	812728981	HEZKXNCJLRWHDD-UHFFFAOYSA-N	433.490	1.611	50	20	IDGD	
CCn1c(NNC(=O)CN2C(=O)C(F)(F)Oc3ccccc32)nc2ccccc2c1=O	814270077	VJRNNTKTSCOQSM-UHFFFAOYSA-N	429.383	1.878	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCc2nncn2C1)C(=O)Nc1ccccc1-c1c(F)cccc1F	815691905	FEYSRFZSHZPJGN-LBPRGKRZSA-N	440.410	1.572	50	20	IDGD	
CCCNC(=O)[C@@H]1CN(C(=O)C(=O)NNc2ccc(OCC)cc2)c2ccccc2O1	815815778	REHZONCTKXWAFD-IBGZPJMESA-N	426.473	1.849	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)c2ccc3c(c2)NC(=O)CNC3=O)cc1Cl	816596897	VUQORWCOJXAWGK-UHFFFAOYSA-N	447.835	1.506	50	20	IDGD	
Cn1nncc1NNC(=O)C1CCN(S(=O)(=O)c2cccc(C(F)(F)F)c2)CC1	816770480	ZHDPCDPALHEVIV-UHFFFAOYSA-N	432.428	1.378	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@@H]1CCO[C@H](c2ccccc2)O1	816827748	CWGLEDCVGHWKAF-KXBFYZLASA-N	432.502	1.553	50	20	IDGD	
CC(C)n1ncc2cc(/C=C/C(=O)NNC(=O)c3nnc(O)c4ccccc34)c(=O)[nH]c21	891640950	VIXROXCKKKWHQR-BQYQJAHWSA-N	433.428	1.429	50	20	IDGD	
COCCNS(=O)(=O)c1cccc(C(=O)NNC(=O)Cc2cccc3ccccc23)c1	913055289	OFJZXVZSLXQUBK-UHFFFAOYSA-N	441.509	1.768	50	20	IDGD	
CN(CC(=O)NNC(=O)c1ccccc1OCc1ccc(F)cc1)[C@H]1CCS(=O)(=O)C1	914532218	DGBGNOPVPVMEDB-KRWDZBQOSA-N	449.504	1.285	50	20	IDGD	
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC(=NNC(=O)[C@@H](C)Oc2ccccc2F)CC1	914559164	BAOYRCABHGUNDP-CQSZACIVSA-N	437.497	1.890	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)Cc1ccc(-n2cnnn2)cc1	915064456	SDOWBKNNMCDTRY-GFCCVEGCSA-N	445.277	1.582	50	20	IDGD	
Cc1nnnn1[C@H](Cc1cccc(F)c1)C(=O)NNC(=O)[C@@H](C)Oc1ccccc1F	915697598	SNPDAXNQKZKSNL-SJKOYZFVSA-N	430.415	1.658	50	20	IDGD	
CCOc1ccc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)NCCOC)cc2)cc1	915879220	HCSVBQQLGHKGLU-UHFFFAOYSA-N	436.490	1.477	50	20	IDGD	
COc1cc(C=NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)ccc1O	915914023	MRLZUIXFKFEVBT-UHFFFAOYSA-N	447.513	1.505	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCN2CCC[C@@H](C)C2)c1	916452283	GXXUXLOIGDYBPL-MRXNPFEDSA-N	439.582	1.393	50	20	IDGD	
COCCOCCNC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	916628356	KTTVZDGAJGYUSF-UHFFFAOYSA-N	442.519	1.156	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)NCc1ccc(S(=O)(=O)N(C)C)cc1	916646610	CLJVKDOOHHGLIM-ZDUSSCGKSA-N	438.481	1.374	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)CNC(=O)c1ccc(Br)s1	916734382	DWBBBXDNLPSMSO-SECBINFHSA-N	444.282	1.994	50	20	IDGD	
CCc1noc2ncc(C(=O)NNC(=O)c3cccc(S(=O)(=O)N4CCCC4)c3)cc12	918398059	XUPNCFBAQCGGEO-UHFFFAOYSA-N	443.485	1.645	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)OCC(=O)NCC(=O)NC(C)(C)C)c(C)n1C[C@@H]1CCCO1	918952883	NSQOAPXJPWPZBU-VBIXMBBUSA-N	444.532	1.765	50	20	IDGD	
Cc1cc(C)cc(-n2ccnc2SCC(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)c1	919884962	LVRIEYNOASNMLJ-AWEZNQCLSA-N	437.547	1.099	50	20	IDGD	
Cc1ccc(O[C@H](C)C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)c(Br)c1	919885059	JPVULVWFYPZUOQ-MNOVXSKESA-N	434.312	1.042	50	20	IDGD	
CC(C)(C)CC(=O)NCC(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	920210716	JOUNKXOGHKPSNY-UHFFFAOYSA-N	449.511	1.758	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)CN2C(=O)Cn3c(cc4ccccc43)C2=O)c2ccccc21	920274726	FIMZEXAIPOITLW-UHFFFAOYSA-N	429.436	1.577	50	20	IDGD	
CC(=NNC(=O)N[C@H]1CCS(=O)(=O)C1)c1ccc(S(=O)(=O)C2CCCC2)cc1	920384208	JIITUMDSQJJLKH-HNNXBMFYSA-N	427.548	1.613	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@H](C(C)C)N1C[C@@H](C)O[C@H](C)C1	921202942	MEKJZGQOTKFVID-FMKPAKJESA-N	439.582	1.183	50	20	IDGD	
Cc1ncc(Br)c(C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)n1	1116754546	YNTZCQQXPBCZRU-UHFFFAOYSA-N	441.311	1.224	50	20	IDGD	
O=C(Cn1nc2n(c1=O)CCCCC2)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1	1253427646	HOOVGNBAZUKLOM-UHFFFAOYSA-N	433.412	1.208	50	20	IDGD	
Cc1cccc(N2N=C(C(=O)NNC(=O)Nc3ccc(S(C)(=O)=O)cc3)CCC2=O)c1	1256685645	MXIPSTGEFKYJAZ-UHFFFAOYSA-N	443.485	1.734	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)c2cncn2-c2ccccc2)c1	1318439030	IYRXXVCIBLXPNX-UHFFFAOYSA-N	445.476	1.773	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N2CCC[C@H](C(=O)NC3CC3)C2)cc1Br	1318440251	TXSZKLCBQNLQLL-LBPRGKRZSA-N	439.310	1.803	50	20	IDGD	
CC(=O)N1Cc2ccccc2C[C@@H]1C(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1	1339205486	ZXGFNOITDKYHDD-LJQANCHMSA-N	444.532	1.754	50	20	IDGD	
Cc1c(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)cnn1-c1ccncc1	1341295851	VJMDGSHAWSZRQI-UHFFFAOYSA-N	442.501	1.354	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H]2Cc3ccccc3CN2)C1	1777985853	CKKUJUBILPQNAT-XFGYDDDFSA-N	449.979	1.469	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnn4ccncc34)C2)C1	1777988346	LBKSGXBQNROZDJ-QZTJIDSGSA-N	426.304	1.409	50	20	IDGD	
CC(=O)Nc1ccc(CC(=O)N2CCO[C@@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)cc1	1779296894	KOZZGVSCOHNGGE-JOCHJYFZSA-N	447.608	1.869	50	20	IDGD	
Cc1nc2sccn2c1C(=O)N1CCO[C@]2(CCN(C(=O)CO[Si](C)(C)C)C2)C1	1779297201	VLSBYTSRDYTQJZ-IBGZPJMESA-N	436.610	1.999	50	20	IDGD	
CC(C)(C)c1cc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)[nH]n1	1779575748	UPOPOQWIJVLHLE-SUMWQHHRSA-N	431.306	1.841	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(CN(C(=O)C#CC3CC3)CCO2)C1	1780095216	KBMNSUMWHAYOJE-QFIPXVFZSA-N	441.440	1.377	50	20	IDGD	
COc1ccnc(C(=O)N2CC[C@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)c1OC	1780447917	MDVCDHGQKAFPSY-FQEVSTJZSA-N	437.569	1.394	50	20	IDGD	
CC(C)=CCCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2	1780654339	AFZHTJNYWJDMOT-NFBKMPQASA-N	428.338	1.240	50	20	IDGD	
CC(C)c1ccc(C(=O)N2CC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)cc1	1780760486	CLNKFVWTQDDTFN-DEOSSOPVSA-N	436.317	1.247	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H]3CC[C@H]4CCC(=O)N4C3)C2)C1	1781050309	HUZPPFRARWWHGI-QYWGDWMGSA-N	425.957	1.482	50	20	IDGD	
COc1cccc(CC(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)n1	1781326376	OCTWCFMQUXFTJF-WBVHZDCISA-N	430.274	1.153	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(Cl)c(O)cc3O)C2)C1	1781472358	FSBKNAUTIVOFLW-ACJLOTCBSA-N	433.288	1.449	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc3n[nH]cc3c1)C2	1782172732	MAKPVSIXCHRSMJ-YRISNDGFSA-N	434.924	1.944	50	20	IDGD	
CC(=O)Nc1ccccc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2	1782981130	JICBHUUDQBWMSM-WAOWUJCRSA-N	437.924	1.372	50	20	IDGD	
CCOC(=O)C(C)(C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)Br)C2	1783229357	ZRGQJOABWOFEMZ-PJIJBLCYSA-N	447.370	1.873	50	20	IDGD	
O=C([C@H](F)Br)N1CCO[C@]2(CCN(C(=O)[C@H](O)Cc3ccccc3)C2)C1	1783339786	NCLHJVVPARZIQN-VKJFTORMSA-N	429.286	1.110	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](CN)c1ccccc1)CCO2	1783341074	BDISGQQJTUTVAY-ZWOKBUDYSA-N	438.366	1.732	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cc(=O)ccn3C)CCO2)C1	1783352092	MYNXBBROCMFIGY-RDTXWAMCSA-N	426.311	1.002	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)C3CCN(CC)CC3)CCO2)C1	1783352391	GAQRDTWUXJIHJR-VQIMIIECSA-N	430.387	1.722	50	20	IDGD	
Cc1ccc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]3C2)cc1[N+](=O)[O-]	1784093237	SLXOVPZGCGBADP-LAQRGFTBSA-N	439.896	1.025	50	20	IDGD	
COc1ccc(/C=C/C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]3C2)c(F)c1	1784094818	TZVSCIMBXZOPFG-SMFIWNGZSA-N	440.899	1.427	50	20	IDGD	
COCc1c[nH]c(C(=O)NC2(c3ccc(NC(=O)c4ccc(B(O)O)cc4)cc3)CCC2)c1	1788142205	JWZXMTYIGISCJR-UHFFFAOYSA-N	447.300	1.902	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc4ncccn4n3)[C@H]2C1	1788303804	MDWXNSSSBXXMKQ-VODUFIJXSA-N	440.331	1.559	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3c(F)cccc3F)[C@H]2C1	1789631175	FILVJUBRMWFKLR-OWCBBSPXSA-N	430.879	1.741	50	20	IDGD	
Cc1ccc([C@H](C)C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]32)cc1	1790944959	NVGKAHGFENOYFF-VMXMFDLUSA-N	444.576	1.451	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4n(n3)CCCO4)C[C@@H]21	1791055754	HQOWGAATTNWYLD-ABHRYQDASA-N	441.326	1.042	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCn3nc(C)cc3C)[C@H]2C1	1791510958	CDUANDQTMZDISG-FJIDUMEYSA-N	426.945	1.124	50	20	IDGD	
COc1ccccc1CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)CBr	1792872116	MPDJVWXMCTVYSO-AMVTXUCVSA-N	439.350	1.858	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCCc1ccccc1F	1792952047	XMLNNANVYJEQCV-CLWJZODNSA-N	426.916	1.992	50	20	IDGD	
COc1cccc(Cl)c1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1	1796190533	IZDQAGFMGXTBPO-BJWYYQGGSA-N	442.708	1.594	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccnc(Cl)n1)C2	1796891888	MVYLVYVHFNAATQ-SIENDBQGSA-N	443.895	1.516	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2)c1cn2ccsc2n1	1797482050	YINDOKUCZPETNQ-GNXNZQSNSA-N	427.324	1.384	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2n(n1)CCC2	1797513640	OLULKOIDUDDCHV-FAXLKDOZSA-N	425.327	1.206	50	20	IDGD	
Cc1nc[nH]c1CSCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(C)(C)CCl)C2	1797662975	VPXNMGNRKXTTGZ-XOIINTDNSA-N	428.986	1.806	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc3c1OCC3)C2	1798440406	MXFGLEJDQYMXNE-MUJYYYPQSA-N	435.484	1.186	50	20	IDGD	
COc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Br)C3)c(O)c1	1798835841	CZAFGECSKTVXFX-ANGCBRKESA-N	431.258	1.295	50	20	IDGD	
CCn1nc(C(C)C)cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](Cl)COC	1800979255	YGOLBFHBKYTZRK-KRXQYRFLSA-N	426.945	1.483	50	20	IDGD	
Cc1cc(C)c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCC(=O)NN(C)C)c(C)c1	1801012185	MJABSOREGKNUGI-OPMZPASUSA-N	430.549	1.188	50	20	IDGD	
CO[C@@H](C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](Br)Cc1ccccc1)C2	1801043436	RIBNUOVUUHLBRF-JFMONLCZSA-N	439.350	1.617	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCc1cccc(O)c1	1801126292	OCFXWHGPTPMKMO-FRQROOTJSA-N	425.323	1.698	50	20	IDGD	
COC(=O)c1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CO[Si](C)(C)C)C3)c(C)c1	1801909686	RZPUDRHYHIEVLG-XEMDLRDOSA-N	448.592	1.836	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1CC(=O)C1	1802009061	HKKQQKKTXWMNLX-RBCWYBIJSA-N	429.423	1.440	50	20	IDGD	
Cc1cc(C)n2ccc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)CCC(=O)NN(C)C)c2n1	1802337949	FTEFVTPWAKVKGE-BCDXTJNWSA-N	440.548	1.576	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)[C@H]1C[C@@H]1C1CC1	1802990761	VFZFZUFCSHKDRV-WSWWRLHASA-N	433.317	1.127	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1CCN(C(=O)[C@@H]2CNC(=O)C2)[C@H]1c1cccnc1	1803016159	SWLDQRLYHJBSTH-DYWXZXKOSA-N	437.338	1.255	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2nc3ccc(F)cn3n2)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803147563	ISPOTOFAMRSUSM-JLJPHGGASA-N	446.870	1.183	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2nccnc2OC)[C@H]1c1cccnc1	1804979808	CPGSWJZQGXHBEL-YQQAZPJKSA-N	433.896	1.454	50	20	IDGD	
O=C(c1cc(-c2cccnc2)[nH]n1)N1CCC2(CCCN(C(=O)[C@@H](O)CCl)C2)CC1	1805523134	PUWDMDBSPYHYHS-SFHVURJKSA-N	431.924	1.916	50	20	IDGD	
Cc1cncc(C(=O)NC[C@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)c1	1805771509	HUBFROFOOYDTBE-GCJKJVERSA-N	438.532	1.478	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1807366947	WEIFCVKCJSMYDZ-HOJAQTOUSA-N	443.740	1.489	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@H](CNC(=O)c2nc[nH]c2[N+](=O)[O-])[C@H]1c1cccnc1	1808370856	FFUPKFLMIMMYRE-WMLDXEAASA-N	446.540	1.884	50	20	IDGD	
CN1CCN(CC(=O)NC[C@@H]2CCN(C(=O)C(Cl)Cl)[C@H]2c2cccnc2)CC1	1809607244	XDSUDZFEJHLYIQ-RDJZCZTQSA-N	428.364	1.139	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC2(CCCN(C(=O)CN3CCNC3=N)C2)CC1	1809739889	YIBDXQJLHKPXGN-CQSZACIVSA-N	428.375	1.089	50	20	IDGD	
Cc1ccoc1C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1	1810303381	RHNNUVZCGMUXSF-APWZRJJASA-N	448.483	1.615	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)Cn2nccn2)[C@@H]1c1cccnc1	1812777235	NXJHIYPXMULSEG-HLLBOEOZSA-N	435.326	1.553	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)[C@H]2CC[C@H](O)CC2)[C@H]1c1cccnc1	1813189927	BKAAIJPPXKEIDI-WGQQHEPDSA-N	445.564	1.012	50	20	IDGD	
O=C(C#Cc1ccccc1)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(B(O)O)cc1)CC2	1814012451	OKKHDMZUOLTCID-SFHVURJKSA-N	445.309	1.100	50	20	IDGD	
C=CC[C@H](C(=C)C)C(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1	1815344238	PBNXQCXJZSBSOX-DLBZAZTESA-N	439.346	1.817	50	20	IDGD	
COc1nccc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@H](O)CCl)CC3)c1F	1815813300	SWWALTMNEXNNPF-LDYMZIIASA-N	428.873	1.511	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccc(=O)n2O)n[nH]1	1816147505	FVDPZBKYKYCYNV-AWEZNQCLSA-N	433.541	1.966	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@H](O)c2ccccc2)[nH]n1)c1ccc(B(O)O)cc1	1817471029	COAKBBRUJJUGNE-PZJWPPBQSA-N	448.288	1.129	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@@H]2CCC(F)(F)C2)[nH]n1)c1cccc(B(O)O)c1	1817474864	GTKLHDMQZWLGHB-RHSMWYFYSA-N	446.263	1.831	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(F)cn3C)sc2C1	1817853672	VHGXAXKBGPLBHE-GFCCVEGCSA-N	436.513	1.220	50	20	IDGD	
Nc1n[nH]c(CCC(=O)Nc2nc3c(s2)C[C@@H](NC(=O)CCBr)CC3)n1	1819553796	PGDLQHWEGRWHAM-QMMMGPOBSA-N	442.343	1.173	50	20	IDGD	
C[Si](C)(C)OCC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)n2)[nH]n1	1819593986	UVOYTOFJJMZEPV-CYBMUJFWSA-N	434.529	1.768	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccnnc1O)CC2	1825643126	ZQQXHHNPHDTZMB-YUMQZZPRSA-N	426.296	1.648	50	20	IDGD	
C=CCSCC(=O)N[C@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1	1826082631	ADRWUMGZWKYIKU-LBPRGKRZSA-N	425.580	1.347	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@H]1CCc2nc(NC(=O)COc3cccnn3)sc2C1	1826761353	AQVWNWVUZKDRNC-LBPRGKRZSA-N	435.582	1.776	50	20	IDGD	
C[C@H]1CC[C@H](C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cccc(B(O)O)c2)CC3)CC1	1827153161	BJHVUZHBOSCZCI-ZQIUZPCESA-N	441.362	1.875	50	20	IDGD	
N#Cc1c[nH]c(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)CC2)c1	1828924355	QRZGLRJXYZKWGJ-HXUWFJFHSA-N	449.515	1.432	50	20	IDGD	
CCOc1ccsc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](Cl)COC)C2)C1	1829554109	GBEDKCWOVSVIAQ-KUHUBIRLSA-N	446.953	1.471	50	20	IDGD	
CCn1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)n1	1830538236	ZEHCWSVAZHVUKD-KDOFPFPSSA-N	443.342	1.004	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CSC3CCCC3)CCO2)C1	1831363063	ACBFAFBROKEAIV-KSSFIOAISA-N	449.411	1.902	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnncc2C(=O)O)CC1	1831831370	WNNSLQOCCWTLQC-SJORKVTESA-N	438.912	1.662	50	20	IDGD	
Cc1ncc(CC(=O)N2CCC([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)s1	1831876195	BCSFZPVSINJLSV-LJQANCHMSA-N	449.621	1.987	50	20	IDGD	
Cc1cn(CC(=O)N2CCC([C@H]3CCCCN3C(=O)C(Cl)Cl)CC2)c(=O)nc1O	1831882230	YBXRIXWQRKSKKQ-CQSZACIVSA-N	445.347	1.681	50	20	IDGD	
Cc1noc(C)c1CC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1	1832559239	KQOZDLREUIBZPY-RBUKOAKNSA-N	448.347	1.527	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3cccc(OC)n3)CCO2)C1	1832769206	LRDDNIWQOLOGON-OXQOHEQNSA-N	425.913	1.107	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)[C@H]3CCCCO3)CC2)CC1	1833113620	ONVYSQCZGRTETN-RHSMWYFYSA-N	430.387	1.911	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)[C@H](C)CC(N)=O)CC2)CC1	1833523256	DROUVGFVJTUOOR-CZUORRHYSA-N	445.402	1.243	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)nc1C	1833693143	CQPZVPOKOAXTIJ-QAPCUYQASA-N	444.301	1.459	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)Cc3ncccn3)CC2)CC1	1833878453	GWIMFIMWLJSEGU-CQSZACIVSA-N	438.370	1.374	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCBr)C3)C2)cn1	1833993637	HPLACPVKRUKMOW-GOSISDBHSA-N	426.311	1.245	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cccc(OC)n3)CC2)CC1	1834052242	XPXDNKOQGGRLFM-QGZVFWFLSA-N	438.956	1.529	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)c3ncccn3)CC2)CC1	1834229683	NJHBAHSZAJLBLL-AWEZNQCLSA-N	438.370	1.693	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)c1ccc2c[nH]nc2c1	1835003870	ZREGOYCNTFYHSR-LJQANCHMSA-N	433.940	1.348	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@H](CC)NC(N)=O)CC2)CC1	1835054660	XDYWPBSWCDVXJX-IRXDYDNUSA-N	429.993	1.412	50	20	IDGD	
N[C@@H](Cc1cccnc1)C(=O)NC1CCN(C2CCN(C(=O)C(Cl)Cl)CC2)CC1	1835097542	CSXDXYDXRKIZQG-KRWDZBQOSA-N	442.391	1.327	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3sc(N)nc3C)CCO2)C1	1835801582	WNMLJASJGRHWPX-ACJLOTCBSA-N	430.958	1.511	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC1CCN(C2CCN(C(=O)Cn3cccn3)CC2)CC1	1836398864	ZGZDKKMEKNKUAA-LJQANCHMSA-N	430.380	1.691	50	20	IDGD	
O=C(CSc1ccncc1)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836715190	MECLANLZSSWCFJ-GOSISDBHSA-N	441.981	1.772	50	20	IDGD	
Cc1cncc(CCC(=O)N2CCOC[C@]3(C2)CN(C(=O)CO[Si](C)(C)C)CCO3)c1	1837710118	JDYVLAWNCMJDIB-QFIPXVFZSA-N	449.624	1.631	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccccc3F)C2)C1	1837712245	LLWVFCSQSVFILB-OAQYLSRUSA-N	438.572	1.676	50	20	IDGD	
CCCC(=O)N[C@@H](C)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](Cl)COC)CC2)CC1	1838425948	JWVQKKLRNXGWCZ-YJBOKZPZSA-N	445.988	1.544	50	20	IDGD	
CSc1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)c1O	1838564235	DRQICCIQRBAKRX-YJBOKZPZSA-N	432.901	1.719	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)C3CCC4(CC3)OCCO4)CCO2)C1	1839773788	MXRMJHRJNWCVPT-XLIONFOSSA-N	444.956	1.394	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(C)n(C)c3)C2)C1	1839964177	JKONYAYALVFKQY-APWZRJJASA-N	442.354	1.577	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)c3ccccn3)C2)C1	1840036004	CFNMOLGHPWEXGU-DOXZYTNZSA-N	440.338	1.425	50	20	IDGD	
O=C(/C=C/C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2)c1cccs1	1840187666	PIFFAMGCVLZYRR-WHLIDYPQSA-N	447.340	1.747	50	20	IDGD	
Cc1ncc(/C=C/C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)s1	1840190636	FMIDXRKQLMSRTH-RCAFFNEUSA-N	434.345	1.725	50	20	IDGD	
C#CCCCCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)CBr)C2)C1	1840291543	USQVSQOFAKBYME-VQIMIIECSA-N	429.355	1.667	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)/C(C)=C/c3cccnc3)CCO2)C1	1840414489	NTUCJDUDOLCAQC-UMWZGDBLSA-N	437.924	1.195	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)C3CCSCC3)CCO2)C1	1840925044	JWRJGWOURNNTCB-QZTJIDSGSA-N	439.405	1.822	50	20	IDGD	
CCOC(=O)c1c(CCC(=O)N2CCCC23CN(C(=O)[C@H](O)CCl)C3)c[nH]c1C	1841454951	KWCHIHWOWVMBKN-OAHLLOKOSA-N	425.913	1.236	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@H]2COCCN2C(=O)OC(C)(C)C)C1	1841751378	OJLLWVZRVXCGAJ-HUUCEWRRSA-N	429.945	1.843	50	20	IDGD	
C[C@@H]1C[C@]1(C)C(=O)N1CCCC12CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2	1845087772	DZIPQTJQIIRHKR-VGSWGCGISA-N	427.549	1.582	50	20	IDGD	
O=C(COc1ccc(C2SCCCS2)cc1)NNC(=O)[C@@H]1CCS(=O)(=O)C1	9931066	IQOZSQHNPAVTLZ-CYBMUJFWSA-N	430.573	1.516	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)[C@@H]2CCCN(C(=O)c3ccc(F)cc3)C2)cc1	11060088	HDCFIGPJHDZPQD-GOSISDBHSA-N	441.459	1.991	50	20	IDGD	
CCOC(=O)c1ccc(-c2ccc(/C=C(\C#N)C(=O)c3c(N)n(C)c(=O)n(C)c3=O)o2)cc1	16881391	YLQKTGKMXOJHLM-RVDMUPIBSA-N	448.435	1.893	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)c2c(C)nn(C)c2n1	25169991	OOAKFTOVLSNKOA-UHFFFAOYSA-N	429.506	1.261	50	20	IDGD	
CC(=O)NC1CCC(NC(=O)NNC(=O)[C@@H](C)Oc2cccc(Br)c2)CC1	725876354	OFFKLFVKICMNLV-VCANKDNSSA-N	441.326	1.994	50	20	IDGD	
NS(=O)(=O)c1ccc(CNC(=S)NNC(=O)c2cc3ccccc3cc2O)cc1	726435513	CHKVWVSCAUHOCG-UHFFFAOYSA-N	430.511	1.502	50	20	IDGD	
C[C@]1(NNC(=O)NCCc2ccc(I)s2)CCS(=O)(=O)C1	727034635	QPBHQJBARHEHJK-LBPRGKRZSA-N	443.332	1.276	50	20	IDGD	
COc1ccc(CC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1[N+](=O)[O-]	727658965	HHEDLVRGHZADES-UHFFFAOYSA-N	441.488	1.506	50	20	IDGD	
CC(C)NC(=O)C(=O)NNS(=O)(=O)c1csc(-c2ccc(Br)cc2)n1	728171160	SAFHXBYKLXPXTL-UHFFFAOYSA-N	447.336	1.407	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)c1nc(-c2ccccc2)n(-c2ccccc2)n1	728372194	KTYFMCFSSFJRNY-HNNXBMFYSA-N	425.470	1.130	50	20	IDGD	
COc1ccc(-c2nn(-c3ccccc3)cc2C=NNC(=O)[C@H](C)NS(C)(=O)=O)cc1	728436704	IGNSCNPUQHJJNR-HNNXBMFYSA-N	441.513	1.936	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2ccc(C(=O)NNC(=O)c3cccc(C#N)c3)cc2)C[C@H](C)O1	728827852	AYNKQIZBPJDTCL-GJZGRUSLSA-N	442.497	1.431	50	20	IDGD	
C[C@@H]1CN(S(=O)(=O)c2ccc(C(=O)NNC(=O)c3cccc(C#N)c3)cc2)C[C@@H](C)O1	728827853	AYNKQIZBPJDTCL-HUUCEWRRSA-N	442.497	1.431	50	20	IDGD	
Cc1cc(N2C[C@@H](C(=O)NNC(=O)Cc3cccnc3)CC2=O)ccc1Br	728851009	HQOFQRLBKVTJAC-AWEZNQCLSA-N	431.290	1.896	50	20	IDGD	
N#Cc1cccc(C(=O)NNS(=O)(=O)c2cc(C(=O)O)sc2Br)c1	728853412	JZBWYHZHQIUGSA-UHFFFAOYSA-N	430.261	1.704	50	20	IDGD	
CSCC[C@@H](NC(=O)COc1ccccc1)C(=O)NNC(=O)c1cccc(C#N)c1	728872662	PPHLZSVKSGHRFC-GOSISDBHSA-N	426.498	1.636	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)c2ccccc2)cc1Br	729165255	BXQDTKLLEQIXKR-UHFFFAOYSA-N	426.292	1.774	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)N1CCN(C(=O)Cc2ccccc2F)CC1	729510742	KLZFFMZVILABSA-UHFFFAOYSA-N	437.475	1.908	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)[C@H](NC(=O)NCc2ccccc2)C(C)C)cn1	729691938	GADGUOSKDNMRRW-QGZVFWFLSA-N	430.534	1.932	50	20	IDGD	
CC(C)(C)OC(=O)N1CSC[C@@H]1C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	730077397	WKUDQYASLZSBRG-OAHLLOKOSA-N	442.563	1.880	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)NCCC(=O)NNC(=O)c2cccc3ncccc23)cc1	730286636	SXLTWQBPCRBWHA-UHFFFAOYSA-N	440.481	1.567	50	20	IDGD	
CCN(CC)CCN1C(=O)C(=NNC(=O)Cc2cc(O)nc(S)n2)c2ccccc21	730586805	PJDWYDLDTFLLRB-UHFFFAOYSA-N	428.518	1.222	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCc2ccccc2)cc1C(=O)NNC(=O)c1c[nH]nc1C	731853134	RNBSLRNPSVUSIK-UHFFFAOYSA-N	427.486	1.580	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)ccc1=O	732052378	LLEABTCGKBGHAE-UHFFFAOYSA-N	447.498	1.200	50	20	IDGD	
CC(=O)NCC(=O)NCC(=O)NNc1ccc(S(=O)(=O)c2ccc(C(C)C)cc2)cc1	732266617	HCJQLJILYNKDFT-UHFFFAOYSA-N	446.529	1.338	50	20	IDGD	
O=C(COC(=O)c1cnc(-c2ncccn2)s1)NNC(=O)c1cccc([N+](=O)[O-])c1	732334589	AALAVFZIWSSVPD-UHFFFAOYSA-N	428.386	1.126	50	20	IDGD	
O=C(NNC(=O)[C@H]1CC(c2cc(F)ccc2F)=NO1)c1csc(N2CCOCC2)n1	732653842	LLKTUMOMGQQSAL-OAHLLOKOSA-N	437.428	1.212	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)c2ccccc2NS(=O)(=O)C(F)(F)F)cc1	732750583	VSKUTKVJQOGKEN-UHFFFAOYSA-N	442.375	1.660	50	20	IDGD	
O=C(Cc1ccc([N+](=O)[O-])cc1Cl)NNC(=O)c1csc(N2CCOCC2)n1	735461201	ABLQHSDGLNOQKD-UHFFFAOYSA-N	425.854	1.545	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cc(C(=O)NNC(=O)c3cnn(C)c3)ccc2F)cc1	735472923	GWFUAZNMGZEVTJ-UHFFFAOYSA-N	447.448	1.443	50	20	IDGD	
O=C(C[C@H]1SC(N2CCCC2)=NC1=O)Nc1ccc(C(=O)NNc2cccnn2)cc1	736701795	HDIJBJMOMUVWNM-OAHLLOKOSA-N	439.501	1.656	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)N[C@H](Cc1ccccc1)CN1CCOCC1	739007010	RLYIZWVCZNCZPJ-OAQYLSRUSA-N	426.517	1.477	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)[C@H]2CCC[C@@H]2NC(=O)OC(C)(C)C)c2ccccc2c1=O	739678918	NHOJWBDRJXFKKZ-GJZGRUSLSA-N	429.477	1.388	50	20	IDGD	
Nc1c(C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cccc1C(F)(F)F	741000854	FCDCKZADGDMQFW-UHFFFAOYSA-N	426.307	1.814	50	20	IDGD	
Nc1c(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cccc1C(F)(F)F	741004546	WXNZSBDMAAMGHE-CQSZACIVSA-N	439.346	1.432	50	20	IDGD	
CC[C@@H]1CCC[C@@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)C1	741093025	JNBXPZMBXCGZBT-NVXWUHKLSA-N	438.550	1.620	50	20	IDGD	
CC(C)c1nn([C@H]2CCS(=O)(=O)C2)cc1C(=O)NNC(=O)Cn1cnc2ccccc21	742470841	BATAZAZXJMLXCW-AWEZNQCLSA-N	444.517	1.177	50	20	IDGD	
CC(=O)N[C@H](CC(=O)NNC(=O)CCN1C[C@@H](C)O[C@H](C)C1)c1ccc(F)cc1F	743291551	QVMHEEAFKQTYAR-SNUQEOBHSA-N	426.464	1.179	50	20	IDGD	
COC[C@H]1CN(C(=O)NNC(=O)[C@@H]2Cc3ccccc3CN2Cc2ccccc2)CCO1	743573807	IUCWWBUBPKIDQA-YADHBBJMSA-N	438.528	1.702	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)NCCN2CCOCC2(C)C)cc1Cl	743623510	YZVWMBUWMUZOTJ-UHFFFAOYSA-N	429.905	1.804	50	20	IDGD	
C[C@@H](CN1CCN(c2ccccc2)CC1)NC(=O)NNC(=O)c1ccc2c(c1)OCCO2	743633346	MHLYRLHGSIIUBG-KRWDZBQOSA-N	439.516	1.613	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)N2CCN(CC(=O)NNC(=O)c3cccc(C#N)c3)CC2)c1	744406305	BLJWQXAHWLVJEG-SFHVURJKSA-N	449.511	1.239	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)[C@@H](NC(=O)c2ccco2)c2ccccc2)c1	744545401	KYPVGHPBZZQFBI-FQEVSTJZSA-N	446.419	1.627	50	20	IDGD	
O=C(COC(=O)[C@@H]1CCSc2ccccc21)NNC(=O)[C@@H]1COc2ccccc2O1	745427541	MHGQLPUDIODANH-PBHICJAKSA-N	428.466	1.797	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)C[C@@H](C)C(=O)c2cccc(F)c2)cc1	746093770	MBQZAZKKTCGVEE-OAHLLOKOSA-N	449.504	1.811	50	20	IDGD	
CCOc1ccc(OCc2ccc(C(=O)NNC(=O)c3nccnc3C(N)=O)cc2)cc1	746093890	ZWDGTXKTPLCQKD-UHFFFAOYSA-N	435.440	1.628	50	20	IDGD	
CC(=O)N1CC[C@@](C)(C(=O)NNC(=O)c2nc(-c3ccccc3)n(-c3ccccc3)n2)C1	746823336	ZNXMMBRRWZFUJK-HSZRJFAPSA-N	432.484	1.954	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1F)c1ccc(S(=O)(=O)N2CCOCC2)o1	747326244	MEKUATIJMGASQA-UHFFFAOYSA-N	431.829	1.168	50	20	IDGD	
CN(c1ccc(OCC(=O)NNc2nccn(C)c2=O)cc1)S(=O)(=O)c1cccs1	747941559	HLVILAOBVMEHFA-UHFFFAOYSA-N	449.514	1.189	50	20	IDGD	
COc1cc(OC)cc(N2CC[C@H](NC(=O)NNC(=O)COc3ccc(C)cc3)C2=O)c1	747954308	LBGVOKHOIMSSKK-IBGZPJMESA-N	442.472	1.527	50	20	IDGD	
O=C(Cc1ccc(Cl)cc1)NNC(=O)NCC(=O)N1CCN(c2ccccc2)CC1	749219648	FBEKIBXSACDLIA-UHFFFAOYSA-N	429.908	1.562	50	20	IDGD	
O=C(NNC(=O)c1cc(S(=O)(=O)N2CCOCC2)ccc1F)c1cc2ccccc2o1	749473977	OAOZZTAFYWJAJA-UHFFFAOYSA-N	447.444	1.668	50	20	IDGD	
O=C(Cn1c(-c2cccc(Br)c2)noc1=O)NNC(=O)c1ccc(F)cc1	749750993	BDBKLAGAPICWQO-UHFFFAOYSA-N	435.209	1.866	50	20	IDGD	
CC(C)S(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)c2ccccc2O)cc1F	749751687	RTNRTTSWLIVITN-UHFFFAOYSA-N	431.467	1.305	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)c1cc(Br)c2c(c1)OCCO2	751212937	ZKDKSWVOHVGWFL-UHFFFAOYSA-N	440.275	1.473	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)NNC(=O)Cc2nc(-c3ccccc3)cs2)c(C)o1	751318149	QERMVLJQNCVORC-UHFFFAOYSA-N	434.499	1.623	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1cnn(-c2ccc(Cl)cc2)n1	751892735	BZYYFMXIOWKDJT-UHFFFAOYSA-N	426.868	1.388	50	20	IDGD	
Cc1nc(C(=O)NNC(=S)NCCc2cccs2)nn1-c1n[nH]c(C(F)(F)F)n1	753080208	XGGVLIAIXOCPOP-UHFFFAOYSA-N	445.456	1.126	50	20	IDGD	
NC(=O)c1ccc(NC(=O)NNC(=O)COc2ccc(Br)cc2)cc1F	756353461	ZNDNWMNGPRTNBQ-UHFFFAOYSA-N	425.214	1.919	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)Nc1ccn(Cc2ccccn2)n1	756648198	UXTKIXDRPDUJRJ-UHFFFAOYSA-N	448.531	1.691	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2cc(Br)ccc2O)cc1-n1cnnn1	756747357	OGIQIMGQRPDZHE-UHFFFAOYSA-N	448.237	1.606	50	20	IDGD	
COc1ccccc1N1CC[C@H](NC(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)C1=O	757291899	KSXMNHCVFZBOFS-BBRMVZONSA-N	430.436	1.738	50	20	IDGD	
O=C(NN=c1cc[nH]cc1Cl)[C@H]1CCCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1	757418092	YUBHNNZFVXHTEV-LBPRGKRZSA-N	439.881	1.609	50	20	IDGD	
CCS(=O)(=O)N1CCC(CNC(=O)NNC(=O)CC23CC4CC(CC(C4)C2)C3)CC1	758745616	USHHFHMPKDEDTL-UHFFFAOYSA-N	440.610	1.985	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)c1cn(C2CC2)c2cc(Cl)c(F)cc2c1=O	763011347	XNNFXPXORGELNL-VIFPVBQESA-N	441.868	1.325	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2ccccc2)ccc1NC(=O)c1cccnc1	763425327	GAPKEVNGJAUGHO-UHFFFAOYSA-N	433.424	1.742	50	20	IDGD	
C[C@@H](c1ccc(NC(=O)C(=O)NNC(=O)c2c[nH]c3ccccc23)cc1)N1CCOCC1	763540389	GOPKSDLSCKAMNB-HNNXBMFYSA-N	435.484	1.961	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(NC(=O)C3CC3)nc2)cc1C	763681258	VDXXGRPOEPMUHS-UHFFFAOYSA-N	425.445	1.212	50	20	IDGD	
COC(=O)c1ccc(OC)cc1NC(=O)C(=O)NNC(=O)COc1ccc(Cl)cc1	763695799	XQJAJGDBSLJGIW-UHFFFAOYSA-N	435.820	1.300	50	20	IDGD	
Cn1nccc1NC(=O)C(=O)NNC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1	763803207	DUQQPOZXCANUSS-UHFFFAOYSA-N	430.428	1.068	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)CCC(=O)N3C)c1C	763838896	CQRBVUBFIXUTJW-HNNXBMFYSA-N	438.484	1.766	50	20	IDGD	
CCNC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)Cc2c[nH]c3ccccc23)cc1	763864953	FTCBYCVBYUBFAK-UHFFFAOYSA-N	437.456	1.011	50	20	IDGD	
CCOC(=O)c1ccsc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccc(C(C)=O)cc1	763873016	RHDSUPKBDSQQKX-LBPRGKRZSA-N	447.469	1.681	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2cc(NC(=O)C(C)(C)C)ccc2C)n1	763892233	CEITZUKRQBRSRX-UHFFFAOYSA-N	428.493	1.579	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)C2=S=C3CCCCCCC3=C2)cc1	763911802	MVXFPXBZEMIKOB-UHFFFAOYSA-N	429.498	1.931	50	20	IDGD	
O=C(NNC(=O)c1ccc(COc2ccccc2)o1)C(=O)Nc1ccc(-n2cnnn2)cc1	763955643	NZKFQMCJYZSELY-UHFFFAOYSA-N	447.411	1.234	50	20	IDGD	
C[C@@H](c1ccc(NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)cc1)N1CCOCC1	763973899	GLSRBOAGIVJPJM-ZDUSSCGKSA-N	446.891	1.839	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2cccc(Cl)c2Cl)c1	764077968	PHUDRTYBCWBPIM-UHFFFAOYSA-N	430.269	1.797	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cccc4c3OCCC4=O)n[nH]2)cc1	764109654	AOFAXFOCLKEXNU-UHFFFAOYSA-N	433.424	1.750	50	20	IDGD	
CCC(=O)Nc1ccc(Cl)c(NC(=O)C(=O)NNC(=O)c2cccc(OC)c2O)c1	764131616	IUDTUZNLYJOGRR-UHFFFAOYSA-N	434.836	1.802	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNC(=O)CC2CC2)cc1S(=O)(=O)N(CC)CC	764142251	DICBTCXBJFWBAG-UHFFFAOYSA-N	440.522	1.002	50	20	IDGD	
CCCc1c(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)cnn1-c1cc(C)ccn1	764164895	UTVMRJUTMCQKKL-IBGZPJMESA-N	448.483	1.618	50	20	IDGD	
CCOc1cc(C(=O)N(C)C)ccc1NC(=O)C(=O)NNC(=O)CCc1ccccc1	764191695	BBDWIQYJRBLTLI-UHFFFAOYSA-N	426.473	1.506	50	20	IDGD	
O=C(CCc1ccccc1)NNC(=O)C(=O)Nc1ccc2nc(N3CCOCC3)oc2c1	764202475	UTKBGWIZBMWYMC-UHFFFAOYSA-N	437.456	1.383	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)C(=O)Nc1ccc(-n2cccn2)cc1	764204145	SXGLRPXOMXZLTC-UHFFFAOYSA-N	430.465	1.263	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(CN3C(=O)CSC3=O)cc2)c1	764235078	QBWNLTMGXMQGLJ-UHFFFAOYSA-N	437.437	1.153	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)C(=O)Nc1cc(Cl)ccc1C(=O)N1CCCCC1	764263408	HTKNNMWJXLJHRL-UHFFFAOYSA-N	443.891	1.690	50	20	IDGD	
Cc1nccn1-c1ccc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cn1	764350825	LYQJCKNKSGGLSU-UHFFFAOYSA-N	430.428	1.161	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc(-n4nccn4)cc3)n[nH]2)cc1	764384646	IDZQZXHNKFEHHV-UHFFFAOYSA-N	444.455	1.620	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1)C(=O)Nc1ccc2c(c1)OCCCO2	764387919	ODYIJFYAZNPJBA-UHFFFAOYSA-N	439.403	1.777	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1cnn(Cc2ccccn2)c1	764393881	SKLUXRAMLVGTHZ-UHFFFAOYSA-N	440.485	1.213	50	20	IDGD	
Cc1cn(-c2ccccc2)nc1NC(=O)C(=O)NNC(=O)CSc1ccccc1O	764403763	ANLOJYLDJNZHHY-UHFFFAOYSA-N	425.470	1.765	50	20	IDGD	
CCn1c(NNC(=O)C[C@@H]2CN(C(=O)OC(C)(C)C)CCO2)nc2ccccc2c1=O	764717580	SCQNAOVYQPVLIG-CQSZACIVSA-N	431.493	1.886	50	20	IDGD	
COC(=O)NNC(=O)C(=O)Nc1cc(I)ccc1Br	765366773	PSPPUQDUFFSHQE-UHFFFAOYSA-N	442.007	1.379	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)N[C@@H](c1ccc(Cl)cc1)[C@H]1CN(C)CCO1	766317853	GDRRGXQAEMVTRA-XYPHTWIQSA-N	428.917	1.094	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@@H](C(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)C1	766642414	HODHNXXDBRSTST-WOJBJXKFSA-N	430.549	1.239	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cc(C(C)(C)C)nn3C)CC2)cc1	766647421	FBABGOXMOZNEDQ-UHFFFAOYSA-N	426.565	1.605	50	20	IDGD	
CN(C)c1cc(C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)ccn1	766659600	CSEBWWSZAOARDP-UHFFFAOYSA-N	430.940	1.380	50	20	IDGD	
CC(C)Cn1c(N)c(C(=O)COC(=O)[C@@H](Br)C(C)(C)C)c(=O)n(C)c1=O	766750639	SUOUJZRAUQVELT-GFCCVEGCSA-N	432.315	1.321	50	20	IDGD	
COc1ccc(NNC(=O)[C@@H]2C[C@@H](O)CN2C(=O)OCc2ccccc2)c([N+](=O)[O-])c1	768328640	YWIXEDMTVBMPBW-KDOFPFPSSA-N	430.417	1.819	50	20	IDGD	
CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	769535671	PWALGWDQNZFWHL-HXUWFJFHSA-N	436.520	1.763	50	20	IDGD	
CCOc1cc(C#N)cc(Br)c1OCC(=O)NNC(=S)NCCSC	769769024	PIYUTBWVPBHNLY-UHFFFAOYSA-N	447.380	1.957	50	20	IDGD	
CCOC(=O)N1CC[C@H](NC(=O)NNC(=O)[C@H](C)Oc2cccc(Br)c2)C1	770325029	MYECFUWXDZXEKX-AAEUAGOBSA-N	443.298	1.778	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)NCc3ccnc(N4CCOCC4)c3)nc21	770341277	LGJJYONBWNSFGX-UHFFFAOYSA-N	441.496	1.345	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)N[C@H]2CC(=O)N(c3c(F)cccc3F)C2)cc1	771436932	WFSKNHNTBQWNOB-LBPRGKRZSA-N	434.399	1.488	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)[C@@H](O)Cc1ccccc1Cl	771854211	NZIQJHDOCXQVOX-FQEVSTJZSA-N	430.936	1.603	50	20	IDGD	
COc1ccc(-n2ccc(C(=O)NNC(=O)C(=O)NCc3ccc(Cl)cc3)n2)cc1	772182408	KGSPDZZXXRPGET-UHFFFAOYSA-N	427.848	1.612	50	20	IDGD	
Cc1oc(S(=O)(=O)N(C)C)cc1C(=O)NNC(=O)[C@@H](C)Oc1cccc(Cl)c1	772962939	GOYBXXJWAVBJPF-LLVKDONJSA-N	429.882	1.720	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)c1ccc(S(=O)(=O)N(C)C)nc1	772965840	ZNULEEZWDKBLSU-NSHDSACASA-N	426.882	1.214	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1cn(C)nc1C(F)(F)F	773544992	HMMOEAUYYPHMKB-UHFFFAOYSA-N	431.396	1.326	50	20	IDGD	
O=C(NNc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc2nc(N3CCOCC3)oc2c1	773655631	DMAAQLZTCLVHPE-UHFFFAOYSA-N	426.389	1.654	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ccc(C#N)cc2)c(C)c1S(=O)(=O)NC1CC1	773702083	NTUMELXXXJZDTA-UHFFFAOYSA-N	427.486	1.698	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)cc1[N+](=O)[O-]	774010747	ZAJZDYKDMLGQLX-JTQLQIEISA-N	436.808	1.810	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)NC[C@H]2CC[C@@H](C(=O)N(C)C)O2)cc1OC	774773775	YUFQHPLFJZXUBD-WBVHZDCISA-N	436.509	1.454	50	20	IDGD	
COc1cccc(CC(=O)N2CCc3ccc(NC(=O)NNC(=O)CN(C)C)cc32)c1	775591941	GXQCVUQIUDUZRB-UHFFFAOYSA-N	425.489	1.541	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)N[C@@H]2C[C@@H](OCC)[C@@H]2OC)c2ccccc2c1=O	776528255	XAQSOCFKWRRDPD-ZHALLVOQSA-N	445.520	1.723	50	20	IDGD	
CCCC[C@H](/N=C1/NS(=O)(=O)c2ccccc21)C(=O)NNc1cc(Cl)nc(N)n1	779376302	CSNXZVMUEBFEEC-NSHDSACASA-N	437.913	1.453	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)N[C@@H]2CCN(c3ccc(Cl)c(Cl)c3)C2=O)n1	779379610	FAWSHXDHWGEKNK-OAHLLOKOSA-N	439.303	1.943	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@@H](C(=O)NNc2cccc(Br)c2)[C@@H](C)O)cc1	779535803	FKYFRNMKGZKAIK-MLGOLLRUSA-N	442.335	1.929	50	20	IDGD	
O=C(NNS(=O)(=O)c1cnc(-c2ccccc2)nc1)C1CCN(c2ncccn2)CC1	780388043	USJUHQZCVHUCPR-UHFFFAOYSA-N	439.501	1.160	50	20	IDGD	
CCNC(=O)N(C)NC(=O)c1ccc(Cl)c(S(=O)(=O)N2C[C@H](C)O[C@@H](C)C2)c1	780710779	HZJOOVGFFNCWOQ-RYUDHWBXSA-N	432.930	1.444	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)N[C@@H]2CCCN(c3ccc(C#N)cc3)C2=O)c1	780893356	ABLAGEJNRFGAQP-GOSISDBHSA-N	427.486	1.783	50	20	IDGD	
O=C(NNc1ncncc1Cl)C(=O)Nc1ccccc1S(=O)(=O)N1CCCCC1	782158957	LCYMBKMAFOKHLU-UHFFFAOYSA-N	438.897	1.386	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)O[C@H](C(=O)N2CCC[C@@H](C(N)=O)C2)C(C)C)cc(C#N)n1C	782626763	GYFBWMGTRWHJSW-GIQLZWLLSA-N	425.489	1.404	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CCC[C@H](NC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)C1	782645838	AIMQPHQJFNZBAH-VBQJREDUSA-N	434.493	1.993	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc2c(c1)CCN2C(=O)C(=O)NNc1cccc(F)c1	783037733	SPXCXXDCPFPHGW-UHFFFAOYSA-N	434.493	1.889	50	20	IDGD	
CCOC(=O)C(C)(C)n1cc(NC(=O)C(=O)NNc2ncccc2C(F)(F)F)cn1	783121792	YOTICJSKWGQBHM-UHFFFAOYSA-N	428.371	1.677	50	20	IDGD	
COCCN1C(=O)CCc2cc(NC(=O)C(=O)NNC(=O)Nc3ccccc3C)ccc21	783410754	HRFKYAAHXPZSKH-UHFFFAOYSA-N	439.472	1.712	50	20	IDGD	
O=C(NNc1ccc(-n2cccn2)nn1)C(=O)Nc1cc(F)ccc1OCC(F)(F)F	783432938	IKSJPYCTPPMRBA-UHFFFAOYSA-N	439.329	1.824	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1cccc(N2CCCCCC2)c1	784004614	HVCFOHZCULLTHX-UHFFFAOYSA-N	443.529	1.644	50	20	IDGD	
O=C(NNc1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(CC(=O)N2CCSCC2)cc1	784831338	JMHCMRXVPMRKRB-UHFFFAOYSA-N	443.485	1.795	50	20	IDGD	
COc1cccc(CC(=O)N2CCc3ccc(NC(=O)C(=O)NNc4cccnn4)cc32)c1	784858378	KQMLHZXAIPUWIA-UHFFFAOYSA-N	446.467	1.699	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)C(=O)Nc1ccc(OC[C@@H]2CCCO2)cc1	785068169	VMHGJQYWSRLKKJ-SFHVURJKSA-N	437.456	1.221	50	20	IDGD	
C[C@@H](C#N)CSc1ccccc1NC(=O)C(=O)NNC(=O)Cc1cn2ccccc2n1	785068641	YOAIQRRWCNYWBZ-AWEZNQCLSA-N	436.497	1.915	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2nc3ccccc3cc2C)cc1-n1nnnc1C	785158796	SVSODKGJAUVSRV-UHFFFAOYSA-N	432.444	1.918	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2cnc(O)c3ccccc23)CC1	788002353	ZFCZUOLOTJMSDQ-UHFFFAOYSA-N	442.501	1.028	50	20	IDGD	
CC(=NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C)[C@@H]1C[C@H]1c1ccc(Cl)s1	788435568	VHICJKZWANFQES-WDEREUQCSA-N	434.909	1.444	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3C[C@H](C)O[C@@H](C)C3)cc2)n1	794090360	RRCGTBCPHJOZOF-GJZGRUSLSA-N	432.502	1.263	50	20	IDGD	
CCOC(=O)c1ccc(NNC(=O)c2nc(C)n(-c3n[nH]c(C(F)(F)F)n3)n2)cc1C	794656501	HJAPWRFTYQKHAB-UHFFFAOYSA-N	438.370	1.955	50	20	IDGD	
CCCc1c(NC(=O)C(=O)NNc2ncccn2)cnn1-c1cc(F)c(OC)cc1F	797021374	RVBRPQWONUZYGT-UHFFFAOYSA-N	431.403	1.983	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3ccc4c(c3)OCC(=O)N4C)cc2C1	799259246	WKGQZODHQNBCDJ-LLVKDONJSA-N	442.497	1.628	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)N[C@H]1CCCN(C(=O)Cc2ccccc2)C1	802471978	DOOPXLFGQJFRCF-IBGZPJMESA-N	435.484	1.501	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)N[C@H]2CCN(C(=O)Nc3ccccc3)C2)cc1C	802501283	XJRMFXWNLHXOJT-SFHVURJKSA-N	438.488	1.879	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1ccc(C(F)(F)F)s1	802763614	XXMRNBMCIAILSV-UHFFFAOYSA-N	440.447	1.986	50	20	IDGD	
COC(=O)N(C)NC(=O)C1CCN(S(=O)(=O)c2ccc(Br)s2)CC1	804125801	YCJLZGTTWCXJQN-UHFFFAOYSA-N	440.341	1.641	50	20	IDGD	
COc1ccc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c(C)c1OC	805591887	DAHWRJWQFDAZTC-QGZVFWFLSA-N	430.413	1.156	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2nc(C3CCOCC3)cs2)cc1	806973933	YGLDPLWUXMUHDK-UHFFFAOYSA-N	434.474	1.211	50	20	IDGD	
CCc1ccc([C@H](CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)N(C)C)cc1	807006019	KSPPBNKIJQVPKN-SFHVURJKSA-N	446.577	1.789	50	20	IDGD	
O=C1COC[C@@H](C[C@H]2CN(C(=O)C(=O)NNc3cc(F)c(F)c(F)c3)c3ccccc32)N1	807020809	RNTGKJOEVGZBAK-WCQYABFASA-N	448.401	1.583	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)COc2cc(C)cc(C)c2)cc2[nH]ccc12	808934383	CPVZTQIYHHQFTJ-UHFFFAOYSA-N	438.440	1.736	50	20	IDGD	
COCCOCc1cc(C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)ccc1F	812732060	QNGKYLCQUROATP-UHFFFAOYSA-N	425.482	1.996	50	20	IDGD	
Cc1cnc(Br)c(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)c1	812978988	HXPWWNVMLYWFNM-JTQLQIEISA-N	439.241	1.845	50	20	IDGD	
CC(C)Oc1ccc(C#N)cc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	813034122	YMHQQIAVYQXLOM-UHFFFAOYSA-N	445.501	1.678	50	20	IDGD	
COc1cccc(/C=C(/C(=O)NNC(=O)c2ccc3c(c2)OCCO3)n2nnnc2C)c1	818091776	LVXURFYNJBVNTD-BOPFTXTBSA-N	436.428	1.221	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)CN2C(=O)[C@H]3CC=CC[C@H]3C2=O)c1	818745466	IVNBYNZGJOQGLU-TXEJJXNPSA-N	436.262	1.630	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)c1cc([N+](=O)[O-])ccc1Sc1nc[nH]n1	821955611	YWMLWGXCVNXVRC-CQSZACIVSA-N	442.413	1.465	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2cccc(OC[C@H]3CCCO3)c2)n1	844484024	BRTSDSNQAKIZEX-MRXNPFEDSA-N	433.486	1.556	50	20	IDGD	
CN(CC(=O)NNC(=O)c1ccc(COc2ccc(Cl)cc2)cc1)S(C)(=O)=O	914710981	OCFPOJWVNXHDKN-UHFFFAOYSA-N	425.894	1.571	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)CCc2nc(-c3ccccn3)no2)c2ccccc2c1=O	915059699	MUBDMWQJOYGWNI-UHFFFAOYSA-N	447.455	1.816	50	20	IDGD	
CC(C)CC(=O)NNC(=O)c1ccc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1O	915063169	FRXSPBNVIUZEOT-UHFFFAOYSA-N	436.446	1.908	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1	916133439	OZYZFBCHBJSFNZ-UHFFFAOYSA-N	438.937	1.904	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)N[C@H](CN2CCOCC2)c2ccccc2)c1	916216719	SHCIFMJRNBXZBS-HXUWFJFHSA-N	428.489	1.721	50	20	IDGD	
CCCS(=O)(=O)N1CCC(NC(=O)NNC(=O)Cc2cccc3ccccc23)CC1	916379384	DFENKJVXKHPOJR-UHFFFAOYSA-N	432.546	1.917	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)NCc2cccnc2OCC(F)(F)F)nc2ccccc21	916397001	BJNGQHLYVDQUHJ-UHFFFAOYSA-N	436.394	1.983	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CSc2nnc(C)n2Cc2ccccc2)cc1	916830618	KXSONXJNCNNBBZ-UHFFFAOYSA-N	438.513	1.821	50	20	IDGD	
COc1ccc(/C=C(/C#N)C(=O)OCC(=O)N2CCN(CC(=O)NC(C)(C)C)CC2)cc1	917219187	FGSPVXRODTUCTA-AQTBWJFISA-N	442.516	1.204	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2ccc3oc(=O)ccc3c2)cc1	920258282	LSFZTYCGNIYQRK-UHFFFAOYSA-N	444.469	1.575	50	20	IDGD	
O=C(C[C@H]1SC(N2CCCC2)=NC1=O)Nc1ccc(C(=O)NNC(=O)NC2CC2)cc1	920766753	HXBUOTBCYRPZGC-OAHLLOKOSA-N	444.517	1.215	50	20	IDGD	
CN(C)C(=O)COc1ccccc1C(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1	1116087005	GCESUXZHMZPARQ-UHFFFAOYSA-N	448.520	1.562	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)CCc2nc(-c3ccccn3)no2)CC1	1116088445	UYMRWHAMPKECOK-UHFFFAOYSA-N	444.492	1.859	50	20	IDGD	
COC(=O)CS(=O)(=O)Cc1ccc(CNC(=O)NNc2ccc(C(C)(C)C)nn2)cc1	1116269123	ZRAFLPDBPDYTTC-UHFFFAOYSA-N	449.533	1.688	50	20	IDGD	
Cc1nn([C@@H]2CCS(=O)(=O)C2)c(C)c1C=NNC(=O)c1cncn1-c1ccccc1	1248424121	YVIBEBCGFATCJG-QGZVFWFLSA-N	426.502	1.809	50	20	IDGD	
COc1cccc(N2CCC(NC(=O)NNC(=O)[C@H]3COc4ccccc4O3)CC2)c1	1251875315	VMTKTBGQEFJBGU-HXUWFJFHSA-N	426.473	1.834	50	20	IDGD	
CNS(=O)(=O)c1ccc(CC(=O)NNC(=O)c2cc(-c3ccc(C)cc3)[nH]n2)cc1	1323862135	WGROQTKUJUJUPC-UHFFFAOYSA-N	427.486	1.297	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)c2cc(N3CCOCC3)ccn2)CC1	1324358650	WJHNZXKCNIDNPU-UHFFFAOYSA-N	433.509	1.326	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccnc(Cc3ccccc3)n2)c1	1337813793	AKVLEHRPPFTHGI-UHFFFAOYSA-N	425.470	1.937	50	20	IDGD	
Cc1nc[nH]c1CSCC(=O)N1CC[C@@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1778912819	ZOGCXXIAOMERCG-IBGZPJMESA-N	440.642	1.633	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3nc(O)n4c3CCCC4)C2)C1	1779349166	STSVCZYFHANKRW-KZULUSFZSA-N	441.326	1.152	50	20	IDGD	
CCOc1ncc(Cl)cc1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1779679996	GTZWEJNAAVAXEY-KSSFIOAISA-N	432.304	1.177	50	20	IDGD	
CN1CCN(C2(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)C(Cl)Cl)C4)CC2)CC1	1780651668	OPGHGROROVMUNS-DNVCBOLYSA-N	447.407	1.084	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](NC(C)=O)c3ccc(F)cc3)C2)C1	1780915155	LVVHZYLMBYRFCS-WAOWUJCRSA-N	439.915	1.850	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)COc3ccc(O)cc3)CCO2)C1	1781225310	IDQPIVXKLPMTGU-RBUKOAKNSA-N	431.316	1.837	50	20	IDGD	
COC(=O)C12CC(C(=O)N3CCO[C@]4(CCN(C(=O)[C@](C)(Cl)CCl)C4)C3)(C1)C2	1781232585	KTEBOCUZNGBCJP-UGXKVIGPSA-N	433.332	1.396	50	20	IDGD	
O=C(Cc1noc2ccccc12)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781331591	SNFKQOJUVALFKV-FUHWJXTLSA-N	440.269	1.891	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H]1CCCCN1C)C2	1781997447	WRFIAPZSIGBZHH-YYAJDYIMSA-N	430.387	1.768	50	20	IDGD	
CCc1cc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](C)Br)C2)n[nH]1	1781998309	RGLUFAPQGNEUSS-WBHUJUFNSA-N	427.343	1.883	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](NC(C)=O)C(C)(C)C)CCO2	1783344771	WOKSAGGCUYJVQT-DOXZYTNZSA-N	446.386	1.541	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3nn(C)c4c3CCC4)CCO2)C1	1783347798	OWGQWMDTRCFBAQ-IFXJQAMLSA-N	439.354	1.526	50	20	IDGD	
CC(=O)Nc1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](C)Br)C3)C2)ccn1	1783535036	WAOMRVICTLJHKY-KPZWWZAWSA-N	439.310	1.267	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](C)N(C)C(=O)OC(C)(C)C)CCO2	1783880014	DPHXZSAETHWKQK-STXHMFSFSA-N	447.960	1.326	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(Cl)c(O)cc3O)CCO2)C1	1783880313	HCMJBAJKWCQZBI-ACJLOTCBSA-N	433.288	1.449	50	20	IDGD	
COC(=O)CCCCCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](C)Br)CCO2	1784047698	DGLGPUCSQXZQRJ-KSSFIOAISA-N	433.343	1.723	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ncc(Cl)cc3Cl)C[C@@H]21)[C@@H](O)CCl	1784084466	SYHOBNBCWGXNJU-RETIQXCHSA-N	436.723	1.581	50	20	IDGD	
CC[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]21)c1ccccc1	1786364463	YIYGFGJVDSSVOL-WOZUAGRISA-N	444.576	1.533	50	20	IDGD	
CC(C)N[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)C(C)C	1786962149	HYPDIDWKGLEMLB-RFBLXINOSA-N	436.366	1.679	50	20	IDGD	
COC(=O)c1ccccc1CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]2C1	1787443581	MPWPWFOKUDMYAA-PCODUJHASA-N	440.899	1.920	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3Cc4ccccc4CN3)[C@H]2C1	1787451496	UHRLWQCFRXUNCY-HAGHYFMRSA-N	433.980	1.946	50	20	IDGD	
COCc1oncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)Br)C[C@@H]21	1787723114	ATEAINHLDJGMRD-IMIFBBOLSA-N	430.299	1.198	50	20	IDGD	
C=C[C@@H](O)C(C)(C)C(=O)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1	1788142108	AQHXLPWHIVLONP-HXUWFJFHSA-N	436.317	1.687	50	20	IDGD	
CC[C@@H](NC(C)=O)C(=O)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1	1788145133	GPEQNROCNUEYRB-HXUWFJFHSA-N	437.305	1.029	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)c1ccc2cncn2c1	1788429330	XZUBYNNVMWDFFE-TUUVXOQKSA-N	439.285	1.618	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CSc3ccncc3)C[C@@H]21)[C@@H](F)Br	1789922149	IBDXTRQUMBQMDH-ATVPRXPUSA-N	446.342	1.844	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCNC(=O)OC(C)(C)C)C[C@@H]21	1791256372	OJWPIUDKFDHMIA-JONQDZQNSA-N	447.960	1.135	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CC(c4ccccc4)=NN3)C[C@@H]21)C(Cl)Cl	1791295811	BIWAGPFQMQCBCB-DIECFANBSA-N	439.343	1.536	50	20	IDGD	
C[C@H](Cc1ccccc1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]21	1791449684	KDBHSNZGODSZMD-HZEGPAAWSA-N	444.576	1.218	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccnc1-c1ccccc1)C2)[C@@H](O)CCl	1792978511	XHDUGYDFDRLCFG-NBMJBFSESA-N	429.904	1.552	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(C(F)F)no1	1795915703	LOJYVPYQKDLDKR-BSTOTGJRSA-N	436.253	1.989	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cn2ccccc2n1	1796823944	MIKKVIHZYJEQQH-ZJOBFFGXSA-N	435.322	1.569	50	20	IDGD	
Cc1cc(NC(=O)CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](F)Br)C3)no1	1796869408	AOJZYAKFFIEVCF-JNIYBQFBSA-N	431.262	1.640	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2nonc2c1	1796886402	WPZCEFAFKWYDNC-ZWUHOBOKSA-N	437.294	1.600	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C=N/N1CCCCC1)C2	1796892096	ZIDODPWZOFEXBY-HPOMMXTISA-N	441.536	1.230	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(N(C)C)ccc1[N+](=O)[O-])C2	1799268939	OJMSBPHDAWGDDV-ZDFLXESQSA-N	438.912	1.881	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(O)c([N+](=O)[O-])c1)C2)[C@H](F)Br	1799348670	LWEWIAWQQHDRID-DJBIQUGXSA-N	446.229	1.194	50	20	IDGD	
COC(=O)Nc1cccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)C(Cl)Cl)C3)c1	1799429864	LYJPCDHDBHECQL-DABQJJPHSA-N	430.288	1.872	50	20	IDGD	
CC(=O)OC[C@H](OC(C)=O)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@](C)(Cl)CCl	1800080992	YXFIFKAAPZRJJA-DTFBLWLJSA-N	437.320	1.356	50	20	IDGD	
O=C(CNC(=O)c1cccs1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](F)Br	1800157739	VKXYRYDXBIUNGS-MIJXAVMKSA-N	432.315	1.807	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2	1800332445	LYVZEEFYEGNZQE-WAQIMAFDSA-N	439.846	1.061	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)Oc1cccnc1	1801405745	UGQJGXDOBSDKGN-QZLJAVCYSA-N	440.338	1.612	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCc1ccc(F)c(F)c1)C2	1802333550	AAAMHMFSOURIPP-BJWYYQGGSA-N	436.503	1.909	50	20	IDGD	
CN(C)c1ccc(CCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)cc1	1802679165	ABKDZCHCJDPCFV-UADZTWIMSA-N	449.360	1.317	50	20	IDGD	
CC(=O)NCCC(=O)N1CC[C@H](CNC(=O)[C@@H](C)CBr)[C@H]1c1cccnc1	1803013757	ACUMEWXASCJLRC-FDQGKXFDSA-N	439.354	1.645	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)[C@@H]2CC=CCC2)[C@H]1c1cccnc1	1803029713	ZBZSHTYDUZRINX-HGHGUNKESA-N	448.527	1.756	50	20	IDGD	
COc1ccc([C@H](O)C(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)cc1	1803137901	VMPQMLQKJFETSL-GTAWCEEGSA-N	447.919	1.429	50	20	IDGD	
Cn1cc2cc(C(=O)N3CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]3c3cccnc3)ccc2n1	1803148509	RIZDQYJJDODDBB-LSTHTHJFSA-N	441.919	1.888	50	20	IDGD	
C#CC(=O)N1CC[C@@H](CNC(=O)CN(C)NC(=O)NCc2ccccc2)[C@H]1c1cccnc1	1807451836	FRIOJGNKHSNQCB-NZQKXSOJSA-N	448.527	1.067	50	20	IDGD	
Cc1cc(NC(=O)CC(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)no1	1808391326	FXMNBPGSBOJNII-DOXZYTNZSA-N	449.895	1.012	50	20	IDGD	
Cc1ccn(CC(=O)N2CC[C@H](CNC(=O)[C@H](F)Br)[C@H]2c2cccnc2)n1	1808650808	FZDNZBYDOSSSSR-OIISXLGYSA-N	438.301	1.983	50	20	IDGD	
O=C(/C=C/c1ccccc1)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1	1809967675	CXWCYWNMSXLCOF-KPKJPENVSA-N	432.329	1.925	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)C3CCC(CO)CC3)CC2)C1	1809969610	XNEXXTHMOCPEDI-UHFFFAOYSA-N	442.365	1.010	50	20	IDGD	
CN1C(=O)CC[C@H]1C(=O)N1CC[C@H](CNC(=O)CO[Si](C)(C)C)[C@@H]1c1cccnc1	1810545253	WSTUZQJPANAIIR-UWVAXJGDSA-N	432.597	1.560	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)CSCC(=O)O)[C@H]1c1cccnc1	1813033858	VJEYCMDEUOIGSS-ZQIUZPCESA-N	429.926	1.159	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)C(F)(F)C(F)(F)C(=O)O)[nH]n1)[C@H](O)CCl	1814867555	NICBXWXUZLWKGF-DTWKUNHWSA-N	444.769	1.357	50	20	IDGD	
Cc1c(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@H](O)CCl)CC3)nc2ccccn12	1818103417	YGGVGNCAFQUKOK-DGCLKSJQSA-N	433.921	1.925	50	20	IDGD	
O=C(Cc1ccc2ncnn2c1)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1	1820699529	KEBLNUCCXUSYRO-LSDHHAIUSA-N	431.884	1.287	50	20	IDGD	
C[C@@H]1C[C@@]1(C)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnccc1C(=O)NN)CC2	1822650437	NINIETOQYVBRPF-QZXWKGOOSA-N	428.518	1.414	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1c[nH]c(=O)cn1)CC2	1822867980	PXAFCOPQUOBNOB-PWJLMRLQSA-N	430.317	1.689	50	20	IDGD	
CC(C)c1nc(CC(=O)N2CCCC[C@H]2C2CCN(C(=O)[C@@H](O)CCl)CC2)no1	1825119007	WQXRXCCOKDABCP-HOTGVXAUSA-N	426.945	1.955	50	20	IDGD	
CCS(=O)(=O)N[C@H](C)C(=O)N[C@@H]1CCc2nc(NC(=O)C(Cl)Cl)sc2C1	1826092873	NJKFJVJYKZTNNU-HTQZYQBOSA-N	443.378	1.187	50	20	IDGD	
CC(C)=NO[C@@H](C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827052659	VLEPEZWPAQGHLI-UWJYYQICSA-N	443.353	1.401	50	20	IDGD	
O=C([C@H](O)CCl)N1CCC([C@@H]2CCCCN2C(=O)c2ccc3c(n2)OCCO3)CC1	1827531919	STBALJNLQDBGJQ-DLBZAZTESA-N	437.924	1.686	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CC(C)(C)O)CC1	1827681191	OHJDPPBNKPTMQU-PTFSYIGCSA-N	445.564	1.901	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)C(F)(F)Cl)CC1	1828925537	KFGJMINQWHOGKQ-HNNXBMFYSA-N	443.882	1.750	50	20	IDGD	
O=C(CCc1ccccc1Cl)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1830724724	YOYOLNXBPBHFSQ-YLJYHZDGSA-N	445.343	1.329	50	20	IDGD	
CCCC(=O)N[C@H](C)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](Cl)CCC)CCO2)C1	1831651593	RPLCBFGREMDIHH-QINHECLXSA-N	431.961	1.155	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CC(=O)OC(C)(C)C)CCO2)C1	1831987356	YLEBALJAFDHEAR-YWZLYKJASA-N	432.945	1.582	50	20	IDGD	
C[C@@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)CN3CCCC3)CC2)CC1	1833261639	SSAXBFWVCUXZDI-INIZCTEOSA-N	443.430	1.685	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCC(N2CCC(NC(=O)Cc3cncnc3)CC2)CC1	1833862260	JQYNAJVQERSYGM-HXUWFJFHSA-N	442.391	1.827	50	20	IDGD	
CC(=O)c1cc(C(=O)NC2CCN(C3CCN(C(=O)C(Cl)Cl)CC3)CC2)n[nH]1	1834069071	WAVNSOMGSNDXNA-UHFFFAOYSA-N	430.336	1.601	50	20	IDGD	
Cc1oncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)CBr)C2)C1	1834310579	AQWBXDXYFWYGNU-SJKOYZFVSA-N	430.299	1.084	50	20	IDGD	
C/C(=C/C(=O)N1CCC(N2CCC(NC(=O)CCBr)CC2)CC1)C(=O)O	1834423729	WKLOHYOGRGQSFJ-SEYXRHQNSA-N	430.343	1.374	50	20	IDGD	
O=C(CNc1ccc(F)cc1)NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1834680253	VXTWKJTXSPZEHP-IBGZPJMESA-N	440.947	1.409	50	20	IDGD	
COc1ccc(CCC(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)cc1	1834846337	PEMYHPMKZPAEMD-AZUAARDMSA-N	428.888	1.619	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3cccnc3)CCO2)C1	1836181256	GOISBCSDRZWYQP-BEFAXECRSA-N	440.338	1.254	50	20	IDGD	
CC[C@H](C)[C@@H](N)C(=O)N1CCC(N2CCC(NC(=O)[C@H](F)Br)CC2)CC1	1836412588	NGETXEIQQRUXGR-MAZHCROVSA-N	435.382	1.622	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cncc(O)c3)CC2)CC1)[C@H](F)Br	1836414354	GPJALUHFKNNKQH-INIZCTEOSA-N	443.317	1.663	50	20	IDGD	
COc1cccc(CC(=O)N2CCC(OC3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)c1	1836716770	PUWIACXOOGKOAU-FQEVSTJZSA-N	438.952	1.836	50	20	IDGD	
C[C@@H](CC(N)=O)C(=O)N1CCC(OC2CCN(C(=O)[C@@](C)(Cl)CCl)CC2)CC1	1836911102	RKQRVTCPBLPWMF-DJJJIMSYSA-N	436.380	1.733	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@H](OC(C)=O)C(C)C)CC2)CC1	1838360966	IQPIPCWGXKPWRU-RBUKOAKNSA-N	446.972	1.827	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3c(OC)cccc3OC)CCO2)C1	1838882504	JAALYMNEFKYWEF-BTYIYWSLSA-N	440.924	1.791	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3c[nH]c4ncccc34)C2)C1	1839149939	WUCVLUKWHGDHDX-XMSQKQJNSA-N	448.951	1.969	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccncc3O)C2)C1	1839153598	LSKIYURIMIKCLA-MSOLQXFVSA-N	432.304	1.094	50	20	IDGD	
CC(C)n1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)n1	1839153759	RLTFRFCAZWKMNB-OALUTQOASA-N	447.363	1.770	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)s1	1840030977	BRJOSDMTZZRPGX-CXAGYDPISA-N	431.352	1.910	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(O)cc3)C2)C1	1840034692	UJCCUFKDTKGSKX-FZKQIMNGSA-N	427.295	1.246	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3csc(C)c3C)C2)C1	1840150708	PLCWAUAHWXDDKB-VQIMIIECSA-N	430.954	1.689	50	20	IDGD	
COC(=O)c1ccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)cc1	1840278391	GVMVYKYPUDXLTO-PXNSSMCTSA-N	442.871	1.007	50	20	IDGD	
C[C@]1(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)CC1(F)F	1840828115	NJJDJNWCYKMLNO-LERXQTSPSA-N	429.233	1.179	50	20	IDGD	
N=C1NCCN1CC(=O)N1CCCC12CN(C(=O)[C@@H](Br)Cc1ccccc1)C2	1842910197	JJNMIBGNIIZKRO-INIZCTEOSA-N	448.365	1.036	50	20	IDGD	
COc1cccc(Cl)c1C(=O)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843012639	KMNLOPUSQJQOOY-UHFFFAOYSA-N	428.681	1.159	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)c2cn(C)cc2C(F)(F)F)C1	1843562292	WVFQPXVTBISFBC-UHFFFAOYSA-N	429.443	1.234	50	20	IDGD	
O=C([C@@H](F)Br)N1CC2(CCCN2C(=O)[C@@H]2C[C@@]23C(=O)Nc2ccccc23)C1	1846183313	BSDHORNTLGQKGS-CFZJUORYSA-N	436.281	1.790	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@](C)(C(=O)N2CCCC23CN(C(=O)[C@H](O)CCl)C3)C1	1847015933	ABGTVLOJUFYTNC-QRWLVFNGSA-N	443.972	1.827	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CC[C@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](O)CCl)C1	1847559589	SVSBLCNFABMOLZ-XFIYOXNOSA-N	429.945	1.481	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)on1)c1cccc(S(=O)(=O)NC2CC2)c1	27261594	OGTHWVVHFJMFOT-UHFFFAOYSA-N	426.454	1.857	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cccn2Cc2ccncc2)c1	116569662	QMOMZPDBCYHAIF-UHFFFAOYSA-N	427.486	1.257	50	20	IDGD	
O=C(NNC(=O)c1sccc1S(=O)(=O)NC1CCCCCC1)C(=O)N1CCCC1	725713884	WTNUYWGXUMODLO-UHFFFAOYSA-N	442.563	1.133	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)c2ccc(CCNS(C)(=O)=O)s2)cc1F	727499960	QXUVYUGEVKSSJO-UHFFFAOYSA-N	446.551	1.619	50	20	IDGD	
CN(C)[C@@H](CNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)c1ccc(F)cc1	728959964	TVFKQPLHSAWKKO-SFHVURJKSA-N	429.500	1.465	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(CCNC(=O)NNC(=O)c2cccc(C#N)c2)s1	729229421	AASJCYASQCIYDP-UHFFFAOYSA-N	449.558	1.837	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)CCCCN(C)C)c2)cc1	729281872	GFHSSKUYCSWPFC-UHFFFAOYSA-N	448.545	1.989	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@H](C)C(=O)NNC(=O)Cc1c(C)[nH]c2ccnn2c1=O	729299662	GKHPIKWKXVFHFR-CYBMUJFWSA-N	431.880	1.759	50	20	IDGD	
CCOC(=O)[C@@H]1CCCN(C(=O)CN(C)C(=O)NNC(=O)Cn2ccc3ccccc32)C1	729506991	LRULOJTVDFTTGC-QGZVFWFLSA-N	443.504	1.116	50	20	IDGD	
CC[C@H](NC(=O)NNC(=O)COc1cc(C)ccc1C)c1cccc(S(N)(=O)=O)c1	729612590	FUQUMKLVIIOZQW-KRWDZBQOSA-N	434.518	1.811	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@H](C)N(C)C2CC2)c1	729617670	SESUWCVOVIEZDP-AWEZNQCLSA-N	425.555	1.144	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)C(F)(F)Oc2ccc(C=O)cc2)n1	730868784	FALYQECIGNNEGC-UHFFFAOYSA-N	427.385	1.169	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)CNC(=O)c1c(Cl)cccc1[N+](=O)[O-]	731051401	ZREBIWFKNULPTL-UHFFFAOYSA-N	434.836	1.767	50	20	IDGD	
Cn1cc(NS(=O)(=O)c2ccsc2C(=O)NNC(=O)Cc2ccccc2F)cn1	731344505	NRGXCXYAWYUCKA-UHFFFAOYSA-N	437.478	1.425	50	20	IDGD	
CCCCN(C)C(=O)c1ccccc1S(=O)(=O)NNC(=O)c1ccc2c(c1)OCO2	731467905	JIATXMGSMPZVLF-UHFFFAOYSA-N	433.486	1.911	50	20	IDGD	
C[C@]12CCC(=O)N1c1ccccc1C(=O)N2CC(=O)NNC(=O)Cn1cnc2ccccc21	732259790	KJFSFPWYSPGWGB-HSZRJFAPSA-N	446.467	1.183	50	20	IDGD	
CCc1cc(N2CCC[C@H](NC(=O)NNC(=O)c3cc(OC)cc(OC)c3)C2)ncn1	732915068	YRTPTAKDHPBXGA-INIZCTEOSA-N	428.493	1.669	50	20	IDGD	
Cc1c(C(=O)OCC(=O)NNC(=O)c2cccs2)nnn1-c1cccc([N+](=O)[O-])c1	733514254	SUPZRVKIILTIDM-UHFFFAOYSA-N	430.402	1.163	50	20	IDGD	
COc1ccccc1CN(CC(=O)NNC(=O)Cc1nc(C)cs1)C[C@@H]1CCCO1	734151501	JCQHHIBVWFTCOQ-KRWDZBQOSA-N	432.546	1.831	50	20	IDGD	
COc1ccc(S(=O)(=O)C[C@@H](C)C(=O)NNC(=O)COc2cc(C)cc(C)c2)cc1	735028715	NOVIERDRAPXBGU-MRXNPFEDSA-N	434.514	1.948	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)Cc2ccc3ccccc3c2)CC1	735116844	IGNBHFZXELKXHT-UHFFFAOYSA-N	439.541	1.857	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)N[C@H]2CCC[C@H](S(C)(=O)=O)C2)c2ccccc2c1=O	741092349	CLTYKFJESNWRNP-KBPBESRZSA-N	449.533	1.277	50	20	IDGD	
CC(C)CNC(=O)N1CCC[C@@H](CC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)C1	741284493	RFJTUSPDEYCTHB-INIZCTEOSA-N	442.520	1.807	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)[C@@H]2CCCN(Cc3ccccc3)C2)n1	741331156	YLSJCGBRCMUOAQ-QGZVFWFLSA-N	430.530	1.597	50	20	IDGD	
CC(C)(C)CNC(=O)c1ccc(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1	741661298	DBZJPKLPVNAVGU-UHFFFAOYSA-N	445.545	1.830	50	20	IDGD	
CC(=NNC(=O)c1sc(N2CCOCC2)nc1C)c1ccc(S(C)(=O)=O)c(F)c1	741756921	SUYJXXFTFFNFGV-UHFFFAOYSA-N	440.522	1.985	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)CN(C[C@@H]2CCCO2)C(=O)OC(C)(C)C)nc2ccccc21	742034648	SGVNGHBFPWQPJJ-HNNXBMFYSA-N	445.520	1.679	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NC[C@@H](C)Oc1ccccc1F	743510117	QDFNPMRPWWZDFJ-GFCCVEGCSA-N	437.497	1.839	50	20	IDGD	
COc1cn(-c2ccccc2)nc1C(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	743830906	MTPKFETUAPSUHN-UHFFFAOYSA-N	429.458	1.751	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)c2cccc(NC(=O)[C@H]3CCCO3)c2)c1	744548870	PTKBCEZSZUMUGN-GOSISDBHSA-N	436.424	1.294	50	20	IDGD	
CC(C)(C)C(=O)N1CCC[C@@H]1C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	744619467	PPVOOKWTAQOXHB-MRXNPFEDSA-N	438.550	1.188	50	20	IDGD	
CC(=O)N[C@@H](CC(=O)OCC(=O)NNC(=O)c1cccc(C)c1)c1ccc(F)cc1F	745141425	MSXXRHZYJUMADZ-SFHVURJKSA-N	433.411	1.845	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)NCc2cccc(OCC(N)=O)c2)c1	745898770	BEZIFHRPHZDJOV-UHFFFAOYSA-N	428.489	1.892	50	20	IDGD	
CC(C)(C(=O)NNC(=O)[C@H]1CN(Cc2nc(O)c3ccccc3n2)CCO1)c1ccccc1	746239165	FVPWPYKGOUWPLS-LJQANCHMSA-N	449.511	1.661	50	20	IDGD	
NC(=O)c1ncn2c(C(=O)NNC(=O)c3ccc(Cl)cc3F)cc(-c3ccco3)nc12	747431853	RHBUMXLQIJWHCI-UHFFFAOYSA-N	442.794	1.956	50	20	IDGD	
O=C(NNC(=O)C1CCN(S(=O)(=O)c2ccc(F)c(Cl)c2)CC1)c1ccc[nH]1	747663255	DZSBQRPBACQMIE-UHFFFAOYSA-N	428.873	1.669	50	20	IDGD	
Cn1ccnc(NNC(=O)CCCN2C(=O)c3ccc(Br)cc3C2=O)c1=O	747945442	HEWHVGAIAFILSD-UHFFFAOYSA-N	434.250	1.062	50	20	IDGD	
Cn1nccc1C(=O)NNC(=O)CCN1CCN(C(c2ccccc2)c2ccccc2)CC1	748604701	LVZYWOILDSMWRR-UHFFFAOYSA-N	446.555	1.978	50	20	IDGD	
O=C(O)COc1ccc(S(=O)(=O)NNC(=O)c2ccc(Cl)cc2O)cc1Cl	748690386	AARSUEJXDKETLB-UHFFFAOYSA-N	435.241	1.786	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)[C@H]1CCCN1C(=O)c1ccc2c(c1)OCO2	749561979	TURMJTSLLKRORZ-CXAGYDPISA-N	443.431	1.774	50	20	IDGD	
C[C@@H](NC(=S)NNC(=O)C1CCN(S(=O)(=O)c2ccc(C#N)cc2)CC1)C1CC1	751620497	WBDUIZLZLKYHSS-CYBMUJFWSA-N	435.575	1.253	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)Nc1ccc(S(=O)(=O)NC(C)C)cc1	755516776	KZYUAWLQBCLITR-UHFFFAOYSA-N	436.490	1.614	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2ccc3nc(C)oc3c2)cc1	755625080	LIYCAGZVVDFRNM-UHFFFAOYSA-N	431.474	1.918	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)Nc2cccc(N3CCCCC3=O)c2)c2ccccc2c1=O	755695429	WAVHZWDSPREUNE-UHFFFAOYSA-N	434.456	1.917	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2nnc(C(C)(C)C)s2)cc1	756155541	RLTRXBGLDGDQEF-UHFFFAOYSA-N	440.551	1.617	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)C1CCC1	756733791	LXDPXIXZIBOBKB-OAHLLOKOSA-N	438.550	1.159	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2ccc([S@@](C)=O)c(F)c2)c2ccccc2c1=O	756769963	HFEODTPMEGEMOX-SSEXGKCCSA-N	431.449	1.759	50	20	IDGD	
COC(=O)CCC(C)=NNC(=O)c1cc(S(=O)(=O)NCc2ccccc2)ccc1O	756876862	ROTQUAYGNJIFDY-UHFFFAOYSA-N	433.486	1.930	50	20	IDGD	
CCn1cc(S(=O)(=O)NNC(=O)c2cc(F)ccc2Br)c([N+](=O)[O-])n1	756939306	WLOMNXWQQFUBNJ-UHFFFAOYSA-N	436.219	1.336	50	20	IDGD	
O=C(NNC(=O)C1CCN(C(=O)OCc2ccccc2)CC1)C(=O)Nc1ccccn1	758833584	NSLMEGIXVSVLGQ-UHFFFAOYSA-N	425.445	1.216	50	20	IDGD	
CC[C@H]1CN(C(=O)NNC(=O)CNC(=O)c2cccs2)CCN1Cc1ccccc1	759256855	GQCHPTJTXZTPKT-KRWDZBQOSA-N	429.546	1.815	50	20	IDGD	
CCOC(=O)c1cc(S(=O)(=O)NNC(=O)c2ccc(OCC)c(OC)c2)cn1C	760508706	GIPGSOVNOOJNRW-UHFFFAOYSA-N	425.463	1.232	50	20	IDGD	
CCCCCS(=O)(=O)CC(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	763285042	ZXOUOENDRYLWTO-UHFFFAOYSA-N	434.559	1.227	50	20	IDGD	
CC(=O)Nc1cc(S(=O)(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)ccc1F	763439845	WDZUWVHWKVGEEH-UHFFFAOYSA-N	432.474	1.399	50	20	IDGD	
O=C(NNC(=O)c1ccncc1)C(=O)Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1	763463915	LXOPSFFOEVUTJW-UHFFFAOYSA-N	445.501	1.046	50	20	IDGD	
CC(=O)N(Cc1ccc(NC(=O)C(=O)NNC(=O)COc2cccc(C)c2)cc1)C(C)C	763624177	KQTLKDGZTICKNS-UHFFFAOYSA-N	440.500	1.917	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2ccc(OC3CCCC3)nc2)c1	763773116	VLIKXHGGCFRYFP-UHFFFAOYSA-N	428.445	1.820	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCC3)c(C)c1	763784377	WIIJNJBAVRMNKM-UHFFFAOYSA-N	431.470	1.497	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)C(=O)Nc1cccc(CC(F)(F)F)c1	763789758	CDMNRYLPMNZKBK-UHFFFAOYSA-N	433.346	1.840	50	20	IDGD	
Cc1cc(S(C)(=O)=O)ccc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccccc1F	763865851	RRGNDGNSDHDYSA-GFCCVEGCSA-N	437.449	1.091	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)OC(C)(C)O3)cc1	763877470	KJZYGDYAWRHPNN-ZDUSSCGKSA-N	441.440	1.950	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(Cl)cc2C(=O)OC)cc1OC	763902761	QCOLANGFYAVJNS-UHFFFAOYSA-N	449.847	1.934	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)C(=O)Nc1ccccc1Sc1ccccc1	764002743	RILLIYKZEGQVRT-ZDUSSCGKSA-N	433.511	1.358	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1ccc(O[C@@H]2CCOC2)cc1	764013022	UKLZKYLKWHECKI-OAHLLOKOSA-N	433.848	1.916	50	20	IDGD	
CNC(=O)[C@H]1CN(C(=O)C(=O)NNC(=O)Cc2cccc3ccccc23)c2ccccc2O1	764020048	UASMPGDAAWLBPC-HXUWFJFHSA-N	446.463	1.070	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccsc2)cc1I	764025965	SFIYXIWWJFXRCV-UHFFFAOYSA-N	443.266	1.990	50	20	IDGD	
C[C@@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)NNC(=O)CSc2ccccc2O)C1=O	764047288	PGKDZABGMSJQKW-FQEVSTJZSA-N	446.460	1.238	50	20	IDGD	
CC[C@H](C)C(=O)NNC(=O)C(=O)Nc1c(C)cnn1[C@H]1CCN(Cc2ccccc2)C1	764081925	KTGMCWHYZMJOJE-YJBOKZPZSA-N	426.521	1.771	50	20	IDGD	
O=C(CC(F)(F)F)NNC(=O)C(=O)Nc1ccnn1Cc1cccc(Br)c1	764111798	GAPFGCPDBITELI-UHFFFAOYSA-N	448.199	1.732	50	20	IDGD	
CCOc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NNC(=O)c1ccc(C)cc1O	764111879	SATZLYNJSSWZCX-UHFFFAOYSA-N	428.445	1.201	50	20	IDGD	
Cc1cc(C(=O)N2CCC[C@@H](C)C2)ccc1NC(=O)C(=O)NNC(=O)CC(F)(F)F	764112591	MFRWFBUFQGOKAR-LLVKDONJSA-N	428.411	1.905	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ccoc2)c(Br)cc1F	764158634	JVUOXNCZEKJYRN-UHFFFAOYSA-N	428.170	1.368	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cccc3ncccc23)c(OCCN(C)C)c1	764260280	ONNNMMIWRBCVPN-UHFFFAOYSA-N	435.484	1.883	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1cccc(CN2CCCCC2=O)c1	764278072	QMAYMYKEJCGBTC-UHFFFAOYSA-N	440.456	1.070	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(S(=O)(=O)N3CCCCC3)c2)o1	764367648	KGGPRNLRQSPJQC-UHFFFAOYSA-N	434.474	1.162	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCCNC(=O)NNC(=O)CSc2ccccc2O)s1	764457615	UNVZAMAKZQIFFB-UHFFFAOYSA-N	444.560	1.163	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)NCCCS(=O)(=O)Cc1ccccc1	764496961	YWOXDFAVKLVGMF-UHFFFAOYSA-N	425.532	1.721	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)CCn3c(=O)nc(O)c4ccccc43)n[nH]2)cc1	765575308	LKOGGLHJGRIULK-UHFFFAOYSA-N	446.467	1.906	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)CCn3c(=O)nc(O)c4ccccc43)n[nH]2)c1	765581958	RGUPTXAEAGRFOK-UHFFFAOYSA-N	446.467	1.960	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)Cc3c(C)nn(C(F)F)c3C)CC2)cc1	765748373	CHNDUDBHENOZPY-UHFFFAOYSA-N	448.518	1.711	50	20	IDGD	
CC(C)(C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1)c1cccc(F)c1	766644404	VILFDRBLNFPIEK-UHFFFAOYSA-N	426.492	1.709	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)CN1CCC(NC(=O)NC2CCCCC2)CC1	766860507	ALRMQERVFZPUQO-UHFFFAOYSA-N	429.565	1.781	50	20	IDGD	
O=C(NNC(=O)c1ccc2ccccc2n1)c1ccc(N2C(=O)CCC2=O)c([N+](=O)[O-])c1	767395584	FCLMDZMLOVNTQL-UHFFFAOYSA-N	433.380	1.871	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)Cc2cccnc2)n(-c2ccc(C(F)(F)F)cn2)n1	768241798	KMTZIGAUXLDHIJ-UHFFFAOYSA-N	447.377	1.318	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)CSCC(=O)Nc1cc(C)on1	768634439	KAQSHIVEUHRYHB-UHFFFAOYSA-N	428.492	1.210	50	20	IDGD	
CSCCNC(=S)NNC(=O)c1ccc(S(=O)(=O)N2C[C@@H](C)C[C@@H](C)C2)cc1	769768921	HQTVKVYFIJVMCK-OKILXGFUSA-N	444.648	1.825	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)[C@H]2CCN(C(=O)OCc3ccccc3)C2)C[C@@H](C)O1	770110952	QEMVSLUCUUHZAO-LMMKCTJWSA-N	432.521	1.292	50	20	IDGD	
COC(=O)c1c(C)cccc1S(=O)(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	771608548	VIHZAVUFUAYAMZ-UHFFFAOYSA-N	439.877	1.061	50	20	IDGD	
Cn1cnnc1COC(=O)/C(C#N)=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	771855145	UQYMXHMOWCYDTO-RIYZIHGNSA-N	439.863	1.858	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1	772195461	MXCCYEUKCLVJLC-UHFFFAOYSA-N	431.836	1.900	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C[C@](O)(c1nccn1C)C(F)(F)F	772994957	MKVTZPZRPVKPDI-HWPZZCPQSA-N	434.802	1.828	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)c1	773071474	BDXFYJAZVHRMAT-UHFFFAOYSA-N	426.433	1.626	50	20	IDGD	
O=C(NNc1ccc2ccccc2n1)C(=O)Nc1ccc(S(=O)(=O)NC2CC2)cc1	773661823	LXXCPDCNYVUAOL-UHFFFAOYSA-N	425.470	1.757	50	20	IDGD	
O=C(Cc1ccnc(O)c1Br)NNC(=O)c1nn(-c2ccccc2)cc1O	773926800	RWHCQFVBXMOUSS-UHFFFAOYSA-N	432.234	1.445	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1cccc(S(C)(=O)=O)c1	774008062	DYOHUJOLKOXRJP-LLVKDONJSA-N	439.877	1.297	50	20	IDGD	
Cc1ccsc1CCNC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	774301345	DKJHRXCPMYQUGM-UHFFFAOYSA-N	438.579	1.256	50	20	IDGD	
O=C(NNC(=O)c1ccc2cc[nH]c2n1)c1cccc(S(=O)(=O)N2CCCCC2)c1	779491420	OYSOSYDAGJPTOG-UHFFFAOYSA-N	427.486	1.812	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NCc2cc(C(N)=O)co2)c2ccccc2c1=O	779672779	CESPZQSXTSZDBO-UHFFFAOYSA-N	426.433	1.033	50	20	IDGD	
C[C@@H]1CN(S(=O)(=O)c2ccc(C(=O)NNc3ncncc3Cl)cc2)C[C@@H](C)O1	781829549	AVQXASHDDFMUTP-VXGBXAGGSA-N	425.898	1.685	50	20	IDGD	
CC(C)(C)OC(=O)N1CCc2[nH]nc(C(=O)OCC(=O)NNC(=O)c3cccs3)c2C1	782418907	YHQAZBZFWYBJJK-UHFFFAOYSA-N	449.489	1.382	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2Cl)ccc1-n1cnnn1	782924467	DFEJYMFZDCVZRS-UHFFFAOYSA-N	434.243	1.677	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2ccc(Cl)cc2OCC(F)(F)F)CCS(=O)(=O)C1	783427232	NLIUMTJAYZYTRD-CQSZACIVSA-N	443.831	1.418	50	20	IDGD	
CN(C)CCn1c(=O)oc2ccc(NC(=O)C(=O)NNc3nccc4sccc34)cc21	783436176	VEDBHFYKFCQSMH-UHFFFAOYSA-N	440.485	1.848	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)C(=O)Nc1ccc2nccnc2c1	784210096	CBUAUDRYWPOLQV-UHFFFAOYSA-N	426.458	1.152	50	20	IDGD	
Cc1ccn(C)c1C(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	784289856	KTXZPNXOPSWJIW-UHFFFAOYSA-N	426.498	1.887	50	20	IDGD	
Cc1ccc(C(=O)N2CCSCC2)cc1NC(=O)C(=O)NNc1nccnc1Cl	784778392	YBSZKXJUCLTIJE-UHFFFAOYSA-N	434.909	1.709	50	20	IDGD	
O=C(NNc1cccc([N+](=O)[O-])c1)C(=O)Nc1cc(N2CCCS2(=O)=O)ccc1F	784827730	HYCFHEJGSMKUON-UHFFFAOYSA-N	437.409	1.356	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc2c(c1)CCN2C(=O)C(=O)NNc1cccc(OC)n1	784843249	JFTNYKPZTADBRV-UHFFFAOYSA-N	447.517	1.153	50	20	IDGD	
CCNC(=O)N(C)NC(=O)C(=O)Nc1ccc(Cl)c(C(=O)NCc2cccs2)c1	784915872	QVSRCKATQVJWDA-UHFFFAOYSA-N	437.909	1.963	50	20	IDGD	
CN1CCN(C(=O)c2ccc(NC(=O)C(=O)NNc3ccc(C#N)c(Cl)c3)cc2)CC1	785092122	BKEGIGNEYSNZJT-UHFFFAOYSA-N	440.891	1.681	50	20	IDGD	
Cc1ccc(C)c(-n2cnc3cc(C(=O)NNC(=O)[C@@H]4CCS(=O)(=O)C4)ccc32)c1	788429183	VAPWJCIEZGTTST-MRXNPFEDSA-N	426.498	1.838	50	20	IDGD	
Nc1nc(Cl)cc(NNC(=O)Nc2ccc(S(=O)(=O)C[C@H]3CCCO3)cc2)n1	789097542	KKPBYAPEUKBSJD-LLVKDONJSA-N	426.886	1.814	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)Nc1nc2c(s1)CCCCCC2	789767238	GFYWKAFDUCUOEH-UHFFFAOYSA-N	433.446	1.816	50	20	IDGD	
O=C(NNC(=O)c1ccnn1CC(F)F)c1ccc(S(=O)(=O)N2CCCC2)cc1	789869022	QGNNJGDFWLZPDC-UHFFFAOYSA-N	427.433	1.008	50	20	IDGD	
CN1CCC/C1=N\S(=O)(=O)c1cccc(NC(=O)NNc2nc3ccccn3n2)c1	792248078	OQSLATMNEIMBNV-LFVJCYFKSA-N	428.478	1.691	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)cc(-n2cccn2)c1	792354953	NBLQLCUAYWUBJM-UHFFFAOYSA-N	443.847	1.699	50	20	IDGD	
COc1ccc(OC)c(C2=NO[C@H](C(=O)NNC(=O)c3cncc(NC(C)=O)c3)C2)c1	792651503	ATNRQGXUMFBOOP-SFHVURJKSA-N	427.417	1.011	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)N[C@H]3C[C@H](c4ccccc4)C3)nc2)CC1	798117180	UIBKXCUEZVLNOC-IYARVYRRSA-N	444.561	1.590	50	20	IDGD	
C=CCNC(=S)NNC(=O)[C@@H](CCS(C)(=O)=O)Cc1cccc(Br)c1	798305411	OGNBSJOBCCZOTJ-ZDUSSCGKSA-N	448.408	1.724	50	20	IDGD	
O=C(COC(=O)/C=C\c1ccc(Br)o1)NNC(=O)c1cccc([N+](=O)[O-])c1	798401746	DUUOKBBJYYJRHB-ALCCZGGFSA-N	438.190	1.968	50	20	IDGD	
CNC(=O)CNC(=O)c1cccc(NC(=O)NNC(=O)c2cc(-c3ccccc3)on2)c1	800594630	FGVRFQINKKPLEN-UHFFFAOYSA-N	436.428	1.284	50	20	IDGD	
CNC(=O)CNC(=O)c1cccc(NC(=O)NNC(=O)Cc2cccc3ccccc23)c1	800596184	LUSZHPDZCIRDKZ-UHFFFAOYSA-N	433.468	1.711	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)Nc2nccs2)cc1)c1cncc(-n2ccnn2)c1	802554284	VNQGUVOLHPLBJH-UHFFFAOYSA-N	442.486	1.677	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ccccc2)c(C)cc1Br	806966968	BQUVNSCVTUCATM-UHFFFAOYSA-N	434.246	1.944	50	20	IDGD	
O=C1COc2c(cc(Cl)cc2NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)N1	806977284	CHMVBQADQSCDDK-UHFFFAOYSA-N	439.211	1.430	50	20	IDGD	
C[C@]1(C2CC2)NC(=O)N(c2cccc(CNC(=O)NNC(=O)c3ccccc3O)c2)C1=O	807237733	IZUSVYIXBOATGN-JOCHJYFZSA-N	437.456	1.761	50	20	IDGD	
CC[C@@H](C)N[C@@H](CNC(=O)NNC(=O)c1csc(N2CCOCC2)n1)c1ccco1	807442298	YEMRSDPQAXTUPQ-KGLIPLIRSA-N	436.538	1.646	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)NC2C[C@@H]3CC[C@H](C2)N3CC(=O)N(C)C)cc1	807515116	XLFMLKOLACRCCB-AYHJJNSGSA-N	431.537	1.042	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@H]1C[C@H](c2ccccc2)OC1=O	809556819	OKKIMHGLHIIQTL-HUUCEWRRSA-N	430.486	1.354	50	20	IDGD	
COC(=O)c1c(F)ccc(NC(=O)C(=O)NNC(=O)COc2cc(C)cc(C)c2)c1F	810384610	GYXUMIYODSKZCI-UHFFFAOYSA-N	435.383	1.533	50	20	IDGD	
Cc1ccc(C)c(S(=O)(=O)NCC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c1	810398043	FNFLOZWGDUQKQJ-UHFFFAOYSA-N	427.486	1.229	50	20	IDGD	
CC[C@@]1(CNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)OCCc2ccccc21	811874800	PNFDSTKBDVTRAZ-QHCPKHFHSA-N	438.532	1.902	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3cc(CN4CCCC4)on3)n[nH]2)cc1OC	812533282	ACYKVSHNPCVLRA-UHFFFAOYSA-N	440.460	1.753	50	20	IDGD	
CN(CCc1cccc(Br)c1)C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	812867660	OBNXCORUEOSGCG-UHFFFAOYSA-N	444.293	1.954	50	20	IDGD	
CC(C)COc1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)cn1	813033257	LDAZFTPYTCZCMP-UHFFFAOYSA-N	435.506	1.449	50	20	IDGD	
Cn1c2c(ccc1=O)C(=NNC(=O)c1cccc(S(=O)(=O)N3CCCC3)c1)CCC2	814690917	FAWWXNLGRXRZNY-UHFFFAOYSA-N	428.514	1.640	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNc2ccc(-n3cccn3)nn2)cc1)[C@H]1C[C@H]1C	815589719	BLBFYEVHIQZFNQ-DYVFJYSZSA-N	434.460	1.505	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2ccc(C)c(C(=O)NNc3nnc(C)c(O)n3)c2)cc1	817282701	LUHGWDIONSDVHW-UHFFFAOYSA-N	444.473	1.760	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)c2c(C)oc(C)c2S(N)(=O)=O)c1	818750985	UKCLXTCSQYDKAA-UHFFFAOYSA-N	446.279	1.850	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)c(C)c2)cc1	880228565	IXMWTHQZYUKQGU-UHFFFAOYSA-N	434.518	1.192	50	20	IDGD	
CNS(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)cc1	906374738	LIBCBDOTJPSILC-UHFFFAOYSA-N	427.548	1.121	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1ccn(-c2ccc(F)cc2)n1	915064019	ZRPFYEVVOWMBLD-UHFFFAOYSA-N	430.465	1.688	50	20	IDGD	
COc1ccc2c(ccn2CC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1	915594103	DQHVVQNRGKTJNS-UHFFFAOYSA-N	430.486	1.361	50	20	IDGD	
Cc1occc1C(=O)Nc1nc(CC(=O)N([C@H]2CCS(=O)(=O)C2)N(C)C)cs1	915830093	UWEKXOIZVMTJJX-ZDUSSCGKSA-N	426.520	1.332	50	20	IDGD	
COCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2Cl)c1	915879257	KHXJLEYUHQUHOF-UHFFFAOYSA-N	426.882	1.731	50	20	IDGD	
COc1ccccc1[C@@H](NC(=O)NNC(=O)Cc1nc2ccccc2n1C)c1nccn1C	916228145	JLEUHNWDGWATBG-OAQYLSRUSA-N	447.499	1.978	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCc2ccc(N3CCCC3)nc2)nc1	916389268	SWFRTDKJQCTOMN-UHFFFAOYSA-N	447.565	1.934	50	20	IDGD	
CCCC(=O)N1CCC[C@H](C(=O)NNC(=O)c2ccc(CSc3nncn3C)cc2)C1	917524372	IFSIHVHQFFDVFJ-KRWDZBQOSA-N	444.561	1.907	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1Br)C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	918204412	CTSKMCZDXNRKMA-JTQLQIEISA-N	449.240	1.792	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)OCC(=O)NCC(=O)NC(C)(C)C)c(C)n1C[C@H]1CCCO1	918952884	NSQOAPXJPWPZBU-XLYVWGIVSA-N	444.532	1.765	50	20	IDGD	
Cc1nccn1-c1ncccc1CNC(=O)NNC(=O)COc1ccccc1[N+](=O)[O-]	919779176	KCDMKKWGLPJKIG-UHFFFAOYSA-N	425.405	1.393	50	20	IDGD	
Cn1c(C=NNC(=O)COc2ccccc2Cc2ccccc2)nc2c1c(O)nc(=O)n2C	920361849	YWOMTJJFXKVVDH-UHFFFAOYSA-N	446.467	1.493	50	20	IDGD	
CCOCCCN1CC[C@@H](NC(=O)NNC(=O)c2cncn2-c2ccccc2)[C@@H](C)C1	1116080433	ITUAMFDOCACGNP-PKOBYXMFSA-N	428.537	1.953	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnc4[nH]ncc4c3)C2)C1	1778417667	CHWKKXAMMTXLRF-KDOFPFPSSA-N	436.310	1.575	50	20	IDGD	
O=C(C(Cl)Cl)N1CCO[C@]2(CCN(C(=O)[C@H]3ON=C(c4ccccc4)O3)C2)C1	1778874395	JTCVQWQNBREASD-MSOLQXFVSA-N	428.272	1.355	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccnc4c3OCO4)C2)C1	1780029225	WHGQTPRIEHWDND-QZTJIDSGSA-N	430.288	1.490	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(=O)ccn2C)C1	1780059776	QMKCZBRLJCZOAW-VVFCZOMOSA-N	440.338	1.296	50	20	IDGD	
CCOCCC(=O)N1CCO[C@]2(CCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1	1780099147	UXMHXASKTDKHPE-OAQYLSRUSA-N	449.460	1.390	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccccc3Cl)C2)C1	1780503753	ZJWQHXJQYAJBHG-OAQYLSRUSA-N	443.891	1.096	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@@]3(CN(C(=O)CCBr)CCO3)C2)c(O)c1	1780553124	YXBDVXGEJKRQGI-GOSISDBHSA-N	427.295	1.629	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(N4CCOCC4)cn3)CCO2)C1	1781213632	LFKYCLVJAUBHTM-UTKZUKDTSA-N	436.940	1.379	50	20	IDGD	
CN(C)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)[C@](C)(Cl)CCl)C2)C1	1781228436	OOWJWDGODOBLNS-MOPGFXCFSA-N	429.348	1.827	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)c3cc4ncccn4n3)CCO2)C1	1781229759	JDWHZOVUSNYAIQ-MSOLQXFVSA-N	426.304	1.409	50	20	IDGD	
CC(=O)Nc1cc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](F)Br)C3)C2)ccn1	1781329738	JEYFHDXCMJPDFK-YOEHRIQHSA-N	443.273	1.174	50	20	IDGD	
O=C([C@H]1CCc2nc[nH]c2C1)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781333107	CJJVJDQZVYZFAK-PZSREKOKSA-N	429.290	1.035	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)Cn2ccnc2C)C1	1781558890	LPQLAFACZKJZGU-GPMSIDNRSA-N	441.370	1.879	50	20	IDGD	
O=C(c1cccc(N2CCOCC2)c1)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Cl)CCO2	1781736052	ZCJSWEQUVBHQCW-PXNSSMCTSA-N	425.888	1.501	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1	1782009003	NOAIKXZCZUJKAY-SCLBCKFNSA-N	433.288	1.449	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1[C@H]3COC[C@H]31)CCO2	1782868195	XCOIAOIHZOMAGQ-KAJAFPOMSA-N	443.450	1.594	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)C3CCC4(CC3)OCCO4)C2)C1	1782944278	RKNGMAYGKYFOFN-RDTXWAMCSA-N	445.354	1.533	50	20	IDGD	
COc1ncccc1CCC(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](C)Br)C2)C1	1783532581	PWCIFMNOHVDSLJ-AUUYWEPGSA-N	440.338	1.636	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(-n4cnnc4)cc3)CCO2)C1	1783533382	UASPLNSKGGWYLO-AUUYWEPGSA-N	448.321	1.494	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)CN3CCCCC3=O)C2)C1	1783759118	BDHJLYGIEZJGDC-KSSFIOAISA-N	430.343	1.002	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3scnc3C(F)(F)F)CCO2)C1	1783875088	CSSUTZAHJIRBMV-BONVTDFDSA-N	441.859	1.859	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3cc4ccccc4n3C)[C@H]2C1	1783901450	ACTMVAQLSDHGFD-ROPHOZQPSA-N	447.963	1.954	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]3C2)nn1	1783970557	WKMGJYNECRWJMS-OSFYFWSMSA-N	441.326	1.110	50	20	IDGD	
COc1ccc2c(CC(=O)N3CC[C@H]4CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]4C3)c[nH]c2c1	1784083586	CMHLWRBYXAISDT-SIXJUCDHSA-N	449.935	1.298	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccn(C)c3=O)[C@H]2C1	1784728285	AQCBRLOLTFSVEG-VRKREXBASA-N	440.338	1.010	50	20	IDGD	
COc1ccc(F)c(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)c1	1785017313	AWFRQQKIUIJDSG-PBHICJAKSA-N	433.249	1.968	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)COc3cccnc3)[C@H]2C1	1785144313	UURJWZIQDLQNIZ-OHFALNGGSA-N	440.338	1.471	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)c1cnc(OCF)cn1	1785689275	RWAUIXQJYPMQMI-JYYRZZBQSA-N	449.252	1.066	50	20	IDGD	
CN(CC(=O)NC1(c2ccc(NC(=O)CCBr)cc2)CCC1)C(=O)C(=O)O	1787674748	SZSFIORHSXYHAN-UHFFFAOYSA-N	440.294	1.449	50	20	IDGD	
COCc1oncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21	1787722358	AKCMCBZJHUMDGO-QVSJOPQTSA-N	434.262	1.105	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)c1ccc(-c2cccnc2)cc1	1789983877	UYJRGSZEDFRNOL-BURNTYAHSA-N	443.931	1.942	50	20	IDGD	
Cc1cc(O)c([N+](=O)[O-])cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21	1790292719	KJKCMXUQQMGBEB-LVLWZLKYSA-N	429.832	1.737	50	20	IDGD	
CC(C)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CC(=O)N(C3CCCC3)C1)C2	1792782184	HMFRKCFMKYLCOQ-OAFZBRQQSA-N	439.984	1.632	50	20	IDGD	
C[C@H](NC(=O)c1ccccn1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(C)(C)CCl	1792784853	WTDVLITYQFIIKE-MPTYRVRUSA-N	436.940	1.055	50	20	IDGD	
CCOc1ncccc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)CBr	1792867134	XZVODVBSHGTREH-HGTKMLMNSA-N	440.338	1.715	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](NC(=O)c1ccccc1)[C@@H](C)O	1792880735	WZTZYFWDZDRMAU-MATIZBOZSA-N	435.952	1.821	50	20	IDGD	
CC[C@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)CBr)C2)N(CC)CC	1793454572	NGMLGMOJSHEDBY-NQNKBUKLSA-N	432.403	1.727	50	20	IDGD	
Cc1nn2cc(CC(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)[C@@H](F)Br)C4)nc2s1	1793904715	IWIGTGKJXGHQKW-RFVSLCSESA-N	444.330	1.970	50	20	IDGD	
COc1cc(OC)c(F)c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Cl)c1F	1796363615	ZOQVRERRVKVUAB-HAHWHCPGSA-N	436.814	1.720	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cc1ccc(C)nc1)C2	1796890919	PTGIJBLUCFYGGO-INZAXJFKSA-N	436.516	1.705	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2	1799124857	PNNVAAIFNDMBGS-GGNLRSJOSA-N	438.297	1.991	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc3c1NC(=O)C3)C2	1799279305	HGZJTWBTIDCBTA-KNLUSZGBSA-N	440.327	1.621	50	20	IDGD	
N#Cc1cccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)c1Cl	1799301895	ZAYNAHSQHKVIOY-BCDXTJNWSA-N	437.692	1.457	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(OC)c(O)cc1[N+](=O)[O-]	1799308622	LUDWKMVAMZLKPF-GFQSEFKGSA-N	441.868	1.815	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1noc3ccccc13)C2)[C@H](F)Br	1799346630	UCVMEOMUSNRQDW-YNHQPCIGSA-N	440.269	1.650	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c(C)oc3cc(O)ccc13)C2	1800978038	JXMJRSGVIVITFH-AODNKKSCSA-N	436.892	1.904	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COCc1ccc(OC)cc1)C2	1800981856	VEGWDEMQCBGFRY-YNVMFWSZSA-N	440.924	1.055	50	20	IDGD	
C[C@@H](CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(B(O)O)cc1)C2)Oc1ccccc1	1801450508	ZENKRFFFRYVNNH-DVWBAYGPSA-N	436.317	1.476	50	20	IDGD	
Cc1ncc(/C=C/C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)s1	1803189598	HHSRNVLTQJFGLZ-HOYONBQMSA-N	440.529	1.415	50	20	IDGD	
Cc1onc(C(=O)NC[C@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)c1C	1803891616	LLHAADINRDQAHN-UTKZUKDTSA-N	442.520	1.379	50	20	IDGD	
CC(=O)N(C)CCC(=O)NC[C@@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1	1804068152	SLDVUMYEQFYKEJ-QFBILLFUSA-N	439.354	1.741	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@H](CNC(=O)CCBr)[C@H]2c2cccnc2)nn1	1806343354	PPJBUIQMAGXEPM-RDTXWAMCSA-N	448.321	1.985	50	20	IDGD	
O=C(CCBr)NC[C@H]1CCN(C(=O)c2cc(CO)on2)[C@H]1c1cccnc1	1806344038	VKTFOGUAIGQHEC-DYVFJYSZSA-N	437.294	1.667	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2cc(F)cn2C)[C@@H]1c1cccnc1	1808872571	QCVAZFAVJHIBMV-IERDGZPVSA-N	444.511	1.252	50	20	IDGD	
Cc1nc2ncccn2c1C(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1	1809294501	KIYXGKGSXAXYNQ-LZLYRXPVSA-N	442.907	1.352	50	20	IDGD	
Cc1nscc1C(=O)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1	1809968368	WJOXISWCQPGGOP-UHFFFAOYSA-N	427.335	1.290	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)c1ccc2cncn2c1	1810007417	UUIDWUVLEVGUGL-ZYSHUDEJSA-N	427.892	1.649	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)Cn2cncn2)[C@H]1c1cccnc1	1812867601	SPEUGBNBODVCNG-OTRWWLKZSA-N	449.353	1.799	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)[C@H](C)n2cnnn2)[C@H]1c1cccnc1	1812867937	PGEXJCWWNZREOY-JURCDPSOSA-N	436.314	1.119	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2ccccc2C(N)=O)[C@@H]1c1cccnc1	1813034132	BLFZGLFWTUIKMD-ZYSHUDEJSA-N	444.919	1.754	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)CCC(F)(F)F)[C@H]1c1cccnc1	1813071130	NMJDJZIOVOMEHP-KXBFYZLASA-N	443.470	1.803	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)C(F)(F)Cl)[C@@H]1c1cccnc1	1813072547	DASOPQZEMUXMML-CZUORRHYSA-N	431.871	1.292	50	20	IDGD	
CC(=O)C[C@H](C)C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1813075241	YPYXXWBLMZFDOD-KLHJMIIUSA-N	431.537	1.076	50	20	IDGD	
COC(=O)CCCCCC(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1	1813137744	GGDXGTNFAQFQME-ZWOKBUDYSA-N	439.940	1.811	50	20	IDGD	
COC(=O)NCC(=O)NC[C@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1	1813264293	CIQXURBOXFJVCM-CJNGLKHVSA-N	427.299	1.228	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)CCC(F)(F)F)sc2C1	1814441738	MAQDLASOFCHPQS-JTQLQIEISA-N	435.472	1.771	50	20	IDGD	
O=C(C#Cc1ccccc1)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1816954645	GIGFZMALCJJDAI-NRFANRHFSA-N	442.284	1.447	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H]2CCC(=O)N2)n[nH]1	1817088969	IMMDGECXUCUOAS-DMDPSCGWSA-N	426.315	1.711	50	20	IDGD	
COC[C@@H](C)C(=O)N[C@@H]1CCc2nc(NC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)sc2C1	1817275854	FTQCCJKRBIGUNB-WBXLDWLQSA-N	446.533	1.472	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](OC(C)=O)C(C)C)sc2C1	1819490278	WRMCAAWXNVSMEE-HUBLWGQQSA-N	431.942	1.897	50	20	IDGD	
CN1CCN(CC(=O)N[C@H]2CCc3nc(NC(=O)CO[Si](C)(C)C)sc3C2)CC1	1820166040	ZGEIMHCIMOCTIR-AWEZNQCLSA-N	439.658	1.154	50	20	IDGD	
COc1ccc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@@H](O)CCl)CC3)c(OC)c1	1821931460	LNEVGHZQFBCSHX-HZMBPMFUSA-N	439.921	1.986	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2c(F)cncc2F)[nH]n1	1822414406	FABNHVKINTUHPK-HNNXBMFYSA-N	449.462	1.762	50	20	IDGD	
C=CCC(F)(F)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1	1822416480	FETDGBGFKNZNRH-CQSZACIVSA-N	426.468	1.986	50	20	IDGD	
CC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CN1CCN(C(C)=O)CC1)CC2	1822848016	OLZJRIVEUMNCFB-ZIAGYGMSSA-N	441.985	1.237	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CN1C(=O)C=CC1=O)CC2	1822868972	DHTHJGKGJIHUHB-HUTHGQBESA-N	445.328	1.216	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CN2CCOCC2)CC1	1824092332	CKGOMFSTSBMIQC-AEFFLSMTSA-N	444.414	1.969	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CN2CCOC2=O)CC1	1824336289	KYCBPMKELTWBNW-HIFRSBDPSA-N	430.343	1.842	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC([C@H]2CCCCN2C(=O)CCN2C(=O)C=CC2=O)CC1	1824772124	JCWLUTYLMAFHTF-GOSISDBHSA-N	449.624	1.773	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CN1CCCC1=O)CC2	1825640637	BULGDDMZICDHLJ-UWVGGRQHSA-N	429.340	1.461	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CN1CCCCC1=O)CC2	1826003905	AKDXMRMEEYLMRB-NWDGAFQWSA-N	428.942	1.321	50	20	IDGD	
C[C@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H]3CCNC(=O)C3)sc2C1	1826228448	LVZXTMMIPIDIQS-AEJSXWLSSA-N	429.340	1.365	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827049110	LSTXPJUOKJEBJN-LJQANCHMSA-N	434.773	1.865	50	20	IDGD	
Cc1noc(C)c1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827051049	LZZIXHMXDKHGLS-HXUWFJFHSA-N	439.321	1.518	50	20	IDGD	
Cc1ncsc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827055888	IQYDPQCWZJGUHF-LJQANCHMSA-N	441.362	1.678	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)COc3ccccc3C#N)C2)C1	1830370699	PURUHAGITJHWAX-QFIPXVFZSA-N	449.935	1.658	50	20	IDGD	
O=C(CN1C(=O)C=CC1=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](F)Br)CC1	1830381438	JSIWULLTGXOGNC-SUMWQHHRSA-N	444.301	1.222	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)C3(O)CCC3)C2)C1	1830533454	NTMFMGLEMWAZKB-VKJFTORMSA-N	447.370	1.025	50	20	IDGD	
O=C(c1cc2sccc2s1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1830730774	DQIDVFIZXRUBDA-XIKOKIGWSA-N	444.962	1.633	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CN2CCOC2=O)CC1	1831649537	VTVBBMHMUWCYQS-HIFRSBDPSA-N	430.343	1.842	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3cccc(C)c3)CCO2)C1	1832244047	YWBXWVORQKVZRL-UGKGYDQZSA-N	438.952	1.638	50	20	IDGD	
COc1ncccc1CCC(=O)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1833005236	XTJRTTLRSBLBKT-LJQANCHMSA-N	446.331	1.283	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)s1	1833959267	CBAWSVWIMKSLSC-CJNGLKHVSA-N	435.315	1.817	50	20	IDGD	
Cc1ncsc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1834267672	FLAOTQPDCMXONP-SWLSCSKDSA-N	436.303	1.212	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cncc(F)c3)CCO2)C1	1834361167	MCOWBZPLDZPMKV-SJKOYZFVSA-N	430.274	1.074	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)CNC(C)(C)C)CC2)CC1	1834695410	FUKQIHIDRHYKCZ-OAHLLOKOSA-N	445.446	1.977	50	20	IDGD	
CC(C)N[C@H](C(=O)NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)C(C)C	1834785410	WTEXPJBBQISFNH-MOPGFXCFSA-N	431.021	1.180	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cnc(O)nc3O)CC2)CC1	1835069650	SHOZGMMVXADQJE-INIZCTEOSA-N	439.944	1.481	50	20	IDGD	
O=C(CCc1ccc[nH]1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1836015963	NPMBAUYNRLMKGA-NVXWUHKLSA-N	432.290	1.094	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CSc3ncccn3)CCO2)C1	1836115608	ZKXUWNPJYVHRHP-KSSFIOAISA-N	428.942	1.043	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccn4ccnc4c3)CCO2)C1	1836982771	RXRNQXXNNXOVGR-LAUBAEHRSA-N	434.924	1.812	50	20	IDGD	
O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)c1ncccc1F)CCO2	1838246376	SBDCDGOVEMHCDJ-KRWDZBQOSA-N	430.274	1.076	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(-n4ccnc4)ccn3)CCO2)C1	1838795749	NLVJDFHNZFFJQB-UWJYYQICSA-N	447.923	1.355	50	20	IDGD	
CN(C)c1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)cc1	1838963003	DGVOTSXLVWSHFL-JOCHJYFZSA-N	449.624	1.674	50	20	IDGD	
O=C(c1coc(Cl)n1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839198061	RNGLOGFAWHMFQC-IINYFYTJSA-N	440.653	1.089	50	20	IDGD	
Cc1ccc(F)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)c1	1839312930	AGKJENNWKDGSTR-YJBOKZPZSA-N	447.276	1.895	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)cc(C)c1C(=O)O	1839480402	GCHJRQCVCIZEDI-UZLBHIALSA-N	442.871	1.606	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3CCCCO3)C2)C1	1839962046	RTEAGBIFZPEIJX-HDMKZQKVSA-N	433.343	1.185	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccccc3O)C2)C1	1839962885	UMMROGMTIUXJIP-BEFAXECRSA-N	441.322	1.636	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1O)C2	1841668922	COGBJKRDBRKFEG-OWCLPIDISA-N	443.972	1.825	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)Cc1ccc(F)c(F)c1)C2	1843415861	VVOCHIGRIWTZBD-VULFUBBASA-N	443.454	1.845	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)COc1cccc(Cl)c1)C2	1844263209	FIYUQADMCOSSLH-UHFFFAOYSA-N	443.891	1.235	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)c2ccc(-c3cccnc3)cc2)C1	1845277455	NQWPKDSKJQZPOF-UHFFFAOYSA-N	441.296	1.559	50	20	IDGD	
CC(=O)N/C(C)=C/C(=O)N1CCCC12CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1845751158	CNQXSHHAYKMKOC-GLNPCMGASA-N	442.944	1.362	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC12CN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2	1846070091	OEYQUXDNZHWSSA-XMOVILSBSA-N	438.326	1.497	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)n1cccn1	1848098476	DQKPVWLTNVNNAZ-UGUYLWEFSA-N	439.944	1.778	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cc(Cl)ccc2O)cc(Cl)c1OCC(N)=O	11838082	SVZKCFDXSYOURJ-UHFFFAOYSA-N	428.228	1.647	50	20	IDGD	
CC(C)NC(=O)CSc1ccccc1C(=O)OCC(=O)NNC(=O)c1ccccc1	12423068	BZEWEASHCGEOMU-UHFFFAOYSA-N	429.498	1.921	50	20	IDGD	
O=C(NNC(=O)C1CC1)c1cccc(S(=O)(=O)N2CCN(c3ccc(F)cc3)CC2)c1	15794158	MWNFVBXLDIDCCH-UHFFFAOYSA-N	446.504	1.508	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=O)COc2cc(C)ccc2C)n(C)c1	16233073	FBEDAAXJLKMORF-UHFFFAOYSA-N	436.534	1.512	50	20	IDGD	
CCC1CCC2(CC1)NC(=O)N(CC(=O)NNC(=O)COc1cc(C)ccc1C)C2=O	17202872	JCZGLLXTOQNPBU-UHFFFAOYSA-N	430.505	1.720	50	20	IDGD	
CS(=O)(=O)N1CCCc2cc(C(=O)NNC(=O)c3cc(-c4ccccc4)n[nH]3)ccc21	17519306	ULTPVCZZSYFZLL-UHFFFAOYSA-N	439.497	1.864	50	20	IDGD	
NS(=O)(=O)c1ccc(C(=O)NNC(=S)Nc2cccc(Br)c2)cc1	27011360	RFPSOXYTLXNNDR-UHFFFAOYSA-N	429.321	1.728	50	20	IDGD	
CCC(=O)N1CCC[C@H](C(=O)NNC(=O)c2cccc(S(=O)(=O)N(CC)CC)c2)C1	108688848	HJGGRMKRBLESBD-INIZCTEOSA-N	438.550	1.127	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])c(C)c2)c1O	726622094	SLMSRTCRULELJZ-INIZCTEOSA-N	442.428	1.683	50	20	IDGD	
CCCCC(=O)N1CSC[C@@H]1C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	728212017	PDDNIEURYAKABW-MRXNPFEDSA-N	426.564	1.662	50	20	IDGD	
O=C(CSc1nnc(-c2ccc(Cl)cc2)o1)NNC(=O)[C@H]1CCS(=O)(=O)C1	728372378	MTYVIMXYBODRBB-JTQLQIEISA-N	430.895	1.064	50	20	IDGD	
CCOC(Cn1cc(C(=O)NNC(=O)c2cc(F)ccc2Br)nn1)OCC	728547586	UDPUWFYCMYFLKH-UHFFFAOYSA-N	444.261	1.654	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)N1CCC(C(=O)NNC(=O)Cc2cccnc2)CC1	728851042	KHKJWGRZGVHPFN-UHFFFAOYSA-N	430.892	1.986	50	20	IDGD	
C[C@H]1CCCN(C(=O)C2CCN(C(=O)NNC(=O)CNC(=O)c3cccs3)CC2)C1	728951167	DEMPVHSOYSBDAE-AWEZNQCLSA-N	435.550	1.189	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)COCC(=O)NCc2cccnc2)c(C)n1-c1ccccc1	729258412	UGLSUGWDIZHZCN-UHFFFAOYSA-N	435.484	1.583	50	20	IDGD	
C[C@@H]1COCCN1CCNC(=O)NNC(=O)COc1ccc(OCc2ccccc2)cc1	729615092	XBQOXGXXHWXRQO-GOSISDBHSA-N	442.516	1.696	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)[C@H]2CCN(c3ccc4c(c3)OCCO4)C2=O)c1	730513021	UGEKXBIMSDVQPY-QGZVFWFLSA-N	425.441	1.346	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@@H]2CC(=O)N(C3CCC(C)CC3)C2)cc(OC)c1OC	731327476	YATHJHQGTQCAGZ-OGVSOVDVSA-N	433.505	1.901	50	20	IDGD	
COc1ccccc1C(=O)NNS(=O)(=O)c1cc(C(=O)O)ccc1Br	731493511	CEVRCJHPZDUBSY-UHFFFAOYSA-N	429.248	1.779	50	20	IDGD	
COCCCn1c(S)nc2cc(C(=O)NNC(=O)c3ccccc3OC)ccc2c1=O	731494211	UEZBMWHMZCLNSS-UHFFFAOYSA-N	442.497	1.805	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)CC(=O)NNc2nc3ccccc3c(=O)n2C)cc1F	734815054	GYZXUQUQNAFSRU-UHFFFAOYSA-N	432.433	1.192	50	20	IDGD	
COc1ccc(S(=O)(=O)C[C@@H](C)C(=O)NNc2nc3ccccc3c(=O)n2C)cc1	735053281	DUYMBUDSSDWEEF-CYBMUJFWSA-N	430.486	1.495	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)C2CCN(S(=O)(=O)c3ccc4c(c3)CCCC4)CC2)cn1	735446246	HVJHOXLOYGIBGE-UHFFFAOYSA-N	445.545	1.161	50	20	IDGD	
CN(C(=O)c1ccncc1)c1ccc(CNC(=O)NNC(=O)COc2ccccc2O)cc1	736400093	KQOBUJLXHJEZSQ-UHFFFAOYSA-N	449.467	1.973	50	20	IDGD	
O=C(COC(=O)c1cn(-c2cccc(C(F)(F)F)c2)nn1)NNC(=O)c1cccs1	740376240	QORQJUNKUWDBCN-UHFFFAOYSA-N	439.375	1.966	50	20	IDGD	
CCCn1nc(C(=O)NNS(=O)(=O)c2ccc3ncccc3c2)c2ccccc2c1=O	740705108	HCKMARSAJOOUHG-UHFFFAOYSA-N	437.481	1.978	50	20	IDGD	
C#CCOc1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1	741509168	YGIXJVJSRAYQMB-UHFFFAOYSA-N	427.482	1.558	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)CN2C(=O)[C@H]3[C@H]4CC[C@@H](O4)[C@@H]3C2=O)c(C)n1-c1ccccc1	742469420	AGFARBGTKDVRFD-JYBIWHBTSA-N	436.468	1.018	50	20	IDGD	
CS(=O)(=O)c1cc(C(=O)NNC(=O)c2cccc(Br)c2)cc([N+](=O)[O-])c1	742768339	CBESWCBLTJJFNP-UHFFFAOYSA-N	442.247	1.836	50	20	IDGD	
O=C(NCc1ccc(N2CCOCC2)nc1)NNC(=O)c1cccc(Br)c1	743686373	AYGKARDHZSOHQN-UHFFFAOYSA-N	434.294	1.825	50	20	IDGD	
CS(=O)(=O)c1ccc(Br)c(S(=O)(=O)NNC(=O)NC2CCCC2)c1	743729331	GJNWGKKWMZIUNI-UHFFFAOYSA-N	440.341	1.288	50	20	IDGD	
O=C(CN1CCc2c(cccc2N2CCOC2=O)C1)NNC(=O)c1ccc([N+](=O)[O-])cc1	744415102	VJWWTBCLZJGIRE-UHFFFAOYSA-N	439.428	1.371	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCC2(N(C)C)Cc3ccccc3C2)nc1	745842895	SDXQUNDITXEWDU-UHFFFAOYSA-N	446.577	1.494	50	20	IDGD	
Cc1nc2c(c(O)nn2C)c(C)c1CCC(=O)NNC(=O)c1cnn(-c2ccccc2)c1	746259726	OSPPMGHPKRJOKK-UHFFFAOYSA-N	433.472	1.870	50	20	IDGD	
Cn1ncnc1COc1ccc(S(=O)(=O)NNC(=O)c2cc3ccccc3o2)cc1	746598990	RVVWZULPFKXWPG-UHFFFAOYSA-N	427.442	1.764	50	20	IDGD	
COc1cc(C)nc(NNC(=O)NCc2ccccc2S(=O)(=O)N2CCCCC2)n1	746746045	CSRLICXJLWJLCA-UHFFFAOYSA-N	434.522	1.795	50	20	IDGD	
C[C@H](CCNC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)N(C)Cc1ccccc1	746774724	RYLGNFZWXWBTAO-MRXNPFEDSA-N	432.546	1.945	50	20	IDGD	
COc1cc(C(C)=NNC(=O)[C@H](C)CN2C[C@H](C)O[C@H](C)C2)ccc1S(C)(=O)=O	747042498	QQTJZJMTESOGHK-KFWWJZLASA-N	425.551	1.684	50	20	IDGD	
C[C@@H]1CC(=O)Nc2ccccc2N1C(=O)CN(C)C(=O)NNC(=O)c1ccc(C#N)cc1	747102220	GWYIXQDHMYXREZ-CQSZACIVSA-N	434.456	1.608	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNS(=O)(=O)c1cc(C(=O)OC)c(Cl)cc1Cl	747616106	IKSBDXXYSYNVRR-UHFFFAOYSA-N	440.305	1.394	50	20	IDGD	
O=C(NNC(=O)C1(S(=O)(=O)c2ccc(Cl)cc2)CCCC1)C(=O)N1CCCC1	748240972	MRZJHQMSZFRLIZ-UHFFFAOYSA-N	427.910	1.196	50	20	IDGD	
CCc1cccc(NC(=O)CNC(=O)NNC(=O)c2nn(CC)c(=O)c3ccccc23)c1	748461500	LUTXOAPBEMBVBP-UHFFFAOYSA-N	436.472	1.562	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)C(=O)N1CCCC1)c1cc2c(cc1Br)OCCO2	748462509	UJMBFZDQCAXPPM-SNVBAGLBSA-N	441.282	1.234	50	20	IDGD	
CC(=O)NCc1ccc(S(=O)(=O)NCC(=O)NNc2cc(F)c(F)cc2F)s1	748795868	PUJVBAIHSNASJE-UHFFFAOYSA-N	436.437	1.223	50	20	IDGD	
CC[S@](=O)[C@H]1CCC[C@@H](NC(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)C1	750671791	VVRYPODTWITZMH-VXKZXEGRSA-N	431.584	1.474	50	20	IDGD	
CN(C)c1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c(F)c1	751538623	KUQIJUVMSLEVKU-UHFFFAOYSA-N	434.493	1.751	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N[C@H](C)c2nc[nH]n2)cc1	752640356	VHGIKQSNEILAGY-MLJKTZRHSA-N	434.460	1.337	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)NC[C@H]3CCC[C@]34NC(=O)N(C)C4=O)n[nH]2)cc1	753021987	KYERSBJZTOQPKF-SZNDQCEHSA-N	439.476	1.050	50	20	IDGD	
Cc1c(NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c(=O)n(-c2ccccc2)n1C	755320336	LOPKQCRTRQHNCV-UHFFFAOYSA-N	447.455	1.198	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)c3coc(S(=O)(=O)N(C)C)c3)n[nH]2)c1	756137759	IBEBIFVIADPWPL-UHFFFAOYSA-N	431.474	1.612	50	20	IDGD	
NC(=O)c1ccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c(F)c1	756819420	FEXXOEITFWPTEY-UHFFFAOYSA-N	449.464	1.176	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)Nc1cccc(S(=O)(=O)Nc2nccs2)c1	756875307	WEAWKNDTADMQEC-UHFFFAOYSA-N	432.487	1.734	50	20	IDGD	
CC[C@@H]1CN(CC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)CC[C@H]1NC(=O)OC(C)(C)C	757103931	FZSOUCSWEVAJEY-RHSMWYFYSA-N	449.508	1.981	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)c2ccc(Br)cc2n1	758058088	XNCVJQJFICXGNL-SECBINFHSA-N	429.296	1.004	50	20	IDGD	
O=C(Cc1nn2c(C3CCCCC3)nnc2s1)NNC(=S)NC[C@H]1CCCCO1	758177930	ZMZLZJYFJXGZFJ-CYBMUJFWSA-N	437.595	1.840	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)NCc2ccc3c(c2)C(=O)NCC3)cc1OC	758682282	FQERUSOYLKWIPK-UHFFFAOYSA-N	426.473	1.914	50	20	IDGD	
O=C(NC[C@H]1CSCCN1Cc1ccccc1)NNC(=O)[C@H]1COc2ccccc2O1	759199900	HBJJOCGYCOIGHD-FXAWDEMLSA-N	442.541	1.774	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCc1nn(C)c2ccccc12	759211228	ICVYYJNZSCENDX-UHFFFAOYSA-N	429.506	1.319	50	20	IDGD	
O=C(NNC(=O)[C@]12CCC(=O)N1c1ccccc1C(=O)N2Cc1ccccc1)NC1CC1	759589570	FRWBXSPXIORJGP-QHCPKHFHSA-N	433.468	1.659	50	20	IDGD	
C[C@@H](NC(=S)NNC(=O)CCNC(=O)[C@H]1CCCN1C(=O)OC(C)(C)C)C1CC1	760826787	XYISEFLZLPQDON-TZMCWYRMSA-N	427.571	1.186	50	20	IDGD	
Cc1cc(=O)c(C(=O)NNc2nccc(N3CCOCC3)n2)nn1-c1ccccc1F	762862014	SDCZAGZWVSNRQK-UHFFFAOYSA-N	425.424	1.064	50	20	IDGD	
O=C(NNC(=O)c1ccccc1)C(=O)Nc1ccnn1Cc1cnn(-c2ccccc2)c1	763419841	HXBCUJVCVMHVFV-UHFFFAOYSA-N	429.440	1.517	50	20	IDGD	
C[C@@H]1CN(c2ccccc2NC(=O)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)C[C@@H](C)O1	763471837	MTVFVGBGLIESOM-ZIAGYGMSSA-N	441.444	1.608	50	20	IDGD	
CCOC(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)c2ccccc2Br)c1	763482750	KVZPFLQITRKYFL-UHFFFAOYSA-N	448.273	1.954	50	20	IDGD	
Cc1ccc(C(=O)NCC(F)(F)F)cc1NC(=O)C(=O)NNC(=O)c1ccccc1O	763528534	OUZWCFIZGJNDCR-UHFFFAOYSA-N	438.362	1.392	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)Nc1ccc(OCc2ccccc2)nc1	763570708	HQDHDMIFPBLDKO-IBGZPJMESA-N	448.435	1.587	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)Nc1cccc(C#Cc2ccccn2)c1	763575465	WBPCDWYZJOTYRE-OAQYLSRUSA-N	442.431	1.407	50	20	IDGD	
CN(C)c1nnc(-c2ccc(NC(=O)C(=O)NNC(=O)COc3ccccc3F)cc2)o1	763679062	ANMBLUHHSINGSX-UHFFFAOYSA-N	442.407	1.107	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(Br)cc2)c(C)c1	763694097	HHXOQKMZVWBBRF-UHFFFAOYSA-N	436.262	1.931	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)cc1NC(C)=O	763727011	DCWLQDWTQVACAM-UHFFFAOYSA-N	428.489	1.956	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)C(=O)Nc2cnc3ccccc3c2)c2ccccc2c1=O	763790539	KNJZFCIRKWIXBN-UHFFFAOYSA-N	444.451	1.925	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2c(C)cccc2C(=O)N2CCCC2)cc1	763810053	YCCPTFTVTGMJLA-UHFFFAOYSA-N	438.484	1.704	50	20	IDGD	
COc1cccc(-c2nsc(NC(=O)C(=O)NNC(=O)COc3ccc(C)cc3)n2)c1	763820307	FIHWCEQALVIYGI-UHFFFAOYSA-N	441.469	1.687	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)N3CCN(C)CC3)cc2)cc1	763831755	MHPQLWIBQRVKEK-UHFFFAOYSA-N	437.500	1.036	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)ncn3C)cc1	763860484	HMXQEWCOYNSKPC-ZDUSSCGKSA-N	425.445	1.525	50	20	IDGD	
CCN1CCC(n2nccc2NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)CC1	763871710	HQZMJMFRFFJCKK-CQSZACIVSA-N	446.483	1.232	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c(C(F)(F)F)c1	763917185	RCPVGMCBUSXNOZ-UHFFFAOYSA-N	449.349	1.089	50	20	IDGD	
CC(C)n1nnnc1-c1ccc(NC(=O)C(=O)NNC(=O)Cc2ccc(F)cc2)cc1F	763920034	YHWRMLHBFOBFBM-UHFFFAOYSA-N	443.414	1.528	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)Nc1ccn(-c2ccccc2)n1	764005034	SEOQRUSAHSBSGQ-UHFFFAOYSA-N	431.250	1.373	50	20	IDGD	
CCn1nnnc1-c1cccc(NC(=O)C(=O)NNC(=O)Cc2ccc3ccccc3c2)c1	764083562	FPVOXPPTECDDBF-UHFFFAOYSA-N	443.467	1.842	50	20	IDGD	
O=C(CC(F)(F)F)NNC(=O)C(=O)Nc1cccc(N2CCN(CC3CC3)CC2)c1	764116617	LTFYZMSREPOXKH-UHFFFAOYSA-N	427.427	1.257	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2ccc(=O)n(Cc3ccccc3)c2)cc1	764124602	LTWGNLYABMFXHK-UHFFFAOYSA-N	448.479	1.624	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccc(N2CCCC2=O)c(F)c1	764136108	OFQHXISPTYEOCQ-UHFFFAOYSA-N	428.420	1.290	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(NC(=O)OC)c(F)c2)o1	764139301	QBXKJVNQMYCYJN-UHFFFAOYSA-N	449.439	1.839	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2O1)C(=O)Nc1cccnc1OCc1ccccc1	764164881	USPZILSYQJRMMJ-IBGZPJMESA-N	432.436	1.750	50	20	IDGD	
CN(C)C(=O)c1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)[C@@H]1Cc2ccccc2O1	764169062	STJTUNQITCHLJH-INIZCTEOSA-N	430.848	1.131	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)cnc1Br	764245276	OSYFDKPGQXKONT-UHFFFAOYSA-N	430.262	1.893	50	20	IDGD	
CC(C)(C)OC(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2O)c(F)c1	764279146	XYYLWQHBCZHTLB-UHFFFAOYSA-N	447.419	1.652	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)C(=O)Nc1ccc(S(=O)(=O)CCOC)cc1)c1ccccc1	764330822	YMVZBJOMLSFJJB-GOSISDBHSA-N	447.513	1.386	50	20	IDGD	
Cc1c(C(=O)NNC(=O)CNC(=O)c2cccnc2)cnn1-c1cccc(C(F)(F)F)c1	764345233	OZPDSNHWVCVGQZ-UHFFFAOYSA-N	446.389	1.786	50	20	IDGD	
COc1cc(C)c(NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)cc1OC	764381955	DDSZOCRCBWKNEP-UHFFFAOYSA-N	429.458	1.864	50	20	IDGD	
COC(=O)N(C)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)cc1	764382315	GRDYNGDRGOPVJR-UHFFFAOYSA-N	442.457	1.741	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1ccc(C#N)cc1)C(=O)NNC(=O)CC12CC3CC(CC(C3)C1)C2	764533817	MEGSCGOBBOCGKD-YMXMSLLWSA-N	444.557	1.979	50	20	IDGD	
COC(=O)NNC(=O)C(=O)Nc1ccc2c(c1)N(C(=O)Cc1cccc(OC)c1)CC2	765376479	QYEHRIKNACYUGS-UHFFFAOYSA-N	426.429	1.153	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)[C@@H]1CCN(C2CCCCC2)C1	766644978	XYCOXVJPJYSSEA-HXUWFJFHSA-N	441.576	1.246	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)c1cccc(-c2nc[nH]n2)c1	767187218	OIKDUMVCTODLPL-UHFFFAOYSA-N	440.485	1.331	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)CCc1nc(-c2cccs2)no1	767265177	PASPGXXDYFBXAA-UHFFFAOYSA-N	428.470	1.972	50	20	IDGD	
C[C@H](C(=O)NNc1nc(-c2ccccn2)nc2c1CCC2)S(=O)(=O)C1CCOCC1	768161884	IZDZFSTVZJNZJW-CYBMUJFWSA-N	431.518	1.453	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)[C@H](NC3CCOCC3)C(C)C)n[nH]2)cc1OC	768276873	NBRRUGLLRACLNT-HXUWFJFHSA-N	445.520	1.648	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3ccc4c(c3)NC(=O)CO4)n[nH]2)cc1OC	768278350	ZRQCAKJCDBJCSU-UHFFFAOYSA-N	437.412	1.500	50	20	IDGD	
Cc1cc(Br)cc2cc(C(=O)NNC(=O)N[C@H]3CCS(=O)(=O)C3)oc12	768482238	VQBCXALBZQLAML-NSHDSACASA-N	430.280	1.635	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NC[C@]2(C)CCO[C@H]2C2CC2)nc1	768535731	QUJHENAPVFBWOQ-HKUYNNGSSA-N	425.555	1.943	50	20	IDGD	
O=C(NNC(=O)c1ccc(Br)c(C(F)(F)F)c1)N[C@H]1CCS(=O)(=O)C1	768561788	GSUPOOGWSRISBX-QMMMGPOBSA-N	444.229	1.599	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@H](C)CNC(=O)OC(C)(C)C)c2ccccc2c1=O	769530251	BKAUBIFZCKKOOW-GFCCVEGCSA-N	432.481	1.274	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2cccc(S(=O)(=O)C(C)C)c2)n1	770445370	XLTPQBOZINSILH-UHFFFAOYSA-N	439.515	1.181	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)NCCNS(=O)(=O)c1cccs1	770659757	VDGQCDCQHVMFHA-LLVKDONJSA-N	446.938	1.478	50	20	IDGD	
CCc1c(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)cnn1-c1ccc(Cl)cc1	771267359	UDWKTWXSGIFQKQ-GFCCVEGCSA-N	425.898	1.219	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)c(C(F)(F)F)o1	771415671	LOVNKVDOCKMHRS-UHFFFAOYSA-N	438.406	1.826	50	20	IDGD	
CC(=O)c1cccc(S(=O)(=O)NCCC(=O)NNc2ccnc(Br)c2)c1	771539997	BNAUUHRCGRVUHQ-UHFFFAOYSA-N	441.307	1.858	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)CCNS(=O)(=O)c1ccc2ccccc2c1	771864065	XYJPSOYRVMOFQC-HNNXBMFYSA-N	449.529	1.633	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1cc(S(=O)(=O)N2CCCCC2)ccc1Cl	771968932	RFAKMYUFFAHLHV-GFCCVEGCSA-N	445.925	1.617	50	20	IDGD	
O=C(CCCNC(=O)c1cccnc1)NNC(=O)COc1ccc(Br)cc1	772009075	ZLJAVZMOTJCLPJ-UHFFFAOYSA-N	435.278	1.581	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCCO1)c1ccc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1	772221865	WOBAVSAABQUSAF-KRWDZBQOSA-N	448.457	1.726	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)c1ccc(CCNS(C)(=O)=O)s1	772955137	PWPJYVUQPZGSPI-NSHDSACASA-N	445.950	1.722	50	20	IDGD	
CC(=O)Nc1nc(C)c(S(=O)(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)s1	773265973	QUUCITSRLIYPRD-SECBINFHSA-N	432.911	1.840	50	20	IDGD	
Cc1c(C(=O)NNC(=O)[C@H]2CCCN(C(=O)OC(C)(C)C)C2)cnn1-c1ccc(O)nn1	773413150	GTESRQSAPHNBIO-ZDUSSCGKSA-N	445.480	1.084	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NNC(=O)C[C@@H](NC(N)=O)c2cccs2)C1	773418321	TWJPFBYKLAXEHY-CHWSQXEVSA-N	439.538	1.642	50	20	IDGD	
CCOc1ccc(NC(=O)NNC(=O)c2ccccc2)cc1S(=O)(=O)N1CCOCC1	775293307	QTFLFZAAXFXXMK-UHFFFAOYSA-N	448.501	1.573	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)[C@H]1CCCN1C(=O)C(F)(F)F	776312792	OZOXCJKTNRAHMX-LLVKDONJSA-N	438.200	1.529	50	20	IDGD	
CCOc1ccccc1[C@@](N)(C(=O)NNC(=O)[C@@H]1COc2ccccc2O1)C(F)(F)F	776318191	QNFKSJLOHNKFQL-QFBILLFUSA-N	439.390	1.789	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)NC[C@H]2COC3(CCOCC3)O2)cc1OC	776935769	AGVOMPJFGZWHSY-INIZCTEOSA-N	437.493	1.740	50	20	IDGD	
CC(C)(C)OC(=O)NCC(F)(F)CNC(=O)NNC(=O)c1cnn(-c2ccccc2)c1	777524103	IOMBIJLBSQLAKM-UHFFFAOYSA-N	438.435	1.976	50	20	IDGD	
CC(C)CS(=O)(=O)N1CCC(NC(=O)NNC(=O)c2cccc(N(C)C)c2)CC1	777765334	LAQYOCQITWVGAM-UHFFFAOYSA-N	425.555	1.147	50	20	IDGD	
COC(=O)c1ccccc1NNC(=O)c1ccc(C)c(S(=O)(=O)N2CCOCC2)c1	777828867	USIWVNJXURVVDG-UHFFFAOYSA-N	433.486	1.559	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)CCN2CCN(c3cccc(C)c3)CC2)nc1C	778422704	RKFSMFLZXPHKNQ-UHFFFAOYSA-N	426.521	1.926	50	20	IDGD	
C[C@@](O)(CC(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1)c1ccccc1	780983926	QUMOPUFRCAZFKN-HSZRJFAPSA-N	444.963	1.903	50	20	IDGD	
O=C(NNc1ncnc2ccsc12)C(=O)Nc1ccc(CC(=O)N2CCOCC2)cc1	783261706	IKSKTLPLZUCBOR-UHFFFAOYSA-N	440.485	1.174	50	20	IDGD	
CCCNS(=O)(=O)c1ccc(NC(=O)C(=O)NN=c2sc3ccccc3n2C)cc1	783351785	LXPXNEMCTWORFB-UHFFFAOYSA-N	447.542	1.499	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2cc(C)ccn2)cc1S(=O)(=O)N1CCCCC1	783931374	NXVZRPALZXTULT-UHFFFAOYSA-N	447.517	1.655	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCCCC2)cc1NC(=O)C(=O)NNc1cc(C)ncn1	783944617	BQTUUQFFKRVJCA-UHFFFAOYSA-N	448.505	1.050	50	20	IDGD	
O=C(NNC(=O)C(=O)N1CCCC1)C(=O)Nc1ccc(F)c(NC(=O)C2CCCCC2)c1	783996141	DUCDXXJXJRJQLD-UHFFFAOYSA-N	447.467	1.053	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)[C@H]1CC=CC[C@@H]1C(=O)N1CCOCC1	784456826	OVEYSGFDTCNBKG-HOTGVXAUSA-N	433.530	1.376	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)cc1OC	784836105	QEJMOOSIYXJVAF-UHFFFAOYSA-N	429.401	1.782	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCC[C@@H](Oc3ncccc3F)C2)cc1OC	785841622	UGIGTLLLVNSZCN-OAHLLOKOSA-N	432.452	1.542	50	20	IDGD	
CN(C)Cc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(C#N)c2)cc1Br	786417182	OCYJFLXTTUDLHY-UHFFFAOYSA-N	444.289	1.782	50	20	IDGD	
CCOC(=O)c1cnn(C)c1NC(=O)C(=O)NNc1ccc(Br)cc1F	786423185	UOFUIWDVARRSMH-UHFFFAOYSA-N	428.218	1.580	50	20	IDGD	
CCN1CCCN(C(=O)NNC(=O)[C@H]2Cc3ccccc3CN2Cc2ccccc2)CC1=O	787263903	YMKDNECQIVKMGU-JOCHJYFZSA-N	449.555	1.909	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1	787874324	UCJCRTOMNAIJEL-UHFFFAOYSA-N	435.359	1.969	50	20	IDGD	
COc1ccc(S(=O)(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)cc1	788914910	HMKPWNSOBOHIQS-UHFFFAOYSA-N	428.511	1.493	50	20	IDGD	
CCNC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)c1C	789730525	UMXILGCFETUVHO-UHFFFAOYSA-N	427.417	1.265	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)[C@@H]1CCCc2c(O)cccc21	789807692	WREBEGBUYWCPBJ-QGZVFWFLSA-N	431.514	1.976	50	20	IDGD	
C[C@H](NS(=O)(=O)c1cccc(C(F)(F)F)c1)C(=O)NNc1nc2ccccn2n1	791244036	HFWQBMKBKOTXCY-JTQLQIEISA-N	428.396	1.558	50	20	IDGD	
C[C@](O)(Cn1cc(C(F)(F)F)ccc1=O)C(=O)NNC(=O)NCCc1cccs1	792082841	AONBWRBKFCESJQ-INIZCTEOSA-N	432.424	1.253	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)CCc3cccc(N(C)C)c3)CC2)cc1	792238712	WCZKDDLLIAEZSY-UHFFFAOYSA-N	437.588	1.959	50	20	IDGD	
O=C(CC/N=C1/NS(=O)(=O)c2ccccc21)NNC(=O)c1cc2ccccc2cc1O	792521241	LHRQGPTVIRSGKG-UHFFFAOYSA-N	438.465	1.435	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2nnc(-c3ccccc3)o2)c(C)cc1F	793382635	UDMQJIOVXNHNNT-UHFFFAOYSA-N	434.405	1.594	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1	795177986	UVVOVFRDGXNYLK-UHFFFAOYSA-N	430.446	1.788	50	20	IDGD	
COc1cc2c(cc1S(=O)(=O)NNC(=O)c1cccc3ccccc13)OCC(=O)N2	797430811	VBLNTCFBODRJCR-UHFFFAOYSA-N	427.438	1.803	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(N2CCOCC2)ccc1C	797535911	REDPTJJMDDORPU-UHFFFAOYSA-N	440.500	1.559	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CCN2CCN(C(=O)OC(C)(C)C)CC2)cc1	801106669	XIMLERRCACOBRW-UHFFFAOYSA-N	433.509	1.024	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2CCCN(C(=O)COc3ccccc3)C2)cc1	801107212	QHYLRLXMELWLFJ-KRWDZBQOSA-N	438.484	1.399	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(-n3cc(Br)cn3)nn2)cc1	801107952	AOQOUHFXPOQZMS-UHFFFAOYSA-N	444.249	1.133	50	20	IDGD	
C[C@@H](CCNS(=O)(=O)c1ccccc1)NC(=O)NNC(=O)c1ccc2ccccc2n1	801798263	UANBNZTUTAVCDH-HNNXBMFYSA-N	441.513	1.936	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)NCCC(=O)NNC(=O)Nc2ccc3c(c2)OCO3)cc1	802106249	XYWVOLJHRIVOKF-UHFFFAOYSA-N	448.457	1.139	50	20	IDGD	
COC(=O)N(C)NC(=O)c1cc(S(=O)(=O)N2CCOCC2)ccc1N1CCCCC1	804125746	UEURGOBQSKKVKV-UHFFFAOYSA-N	440.522	1.041	50	20	IDGD	
CCC(C)(C)[C@H]1CCc2nc(NC(=O)C(=O)NNC(=O)[C@@H](C)OCCOC)sc2C1	806978980	KIRSJMKFPBBBTB-OLZOCXBDSA-N	440.566	1.822	50	20	IDGD	
CN(NC(=O)C1CCN(CC(F)F)CC1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	807242675	GUFNJXQLPKXKOI-UHFFFAOYSA-N	433.500	1.599	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)COc2ccc(OC)cc2)cc2[nH]ccc12	808934348	AYNLLQVFVNOTAO-UHFFFAOYSA-N	440.412	1.128	50	20	IDGD	
Cc1c(/C=C(\C#N)C(=O)OCCOc2ccc(S(=O)(=O)N(C)C)cc2)cc(C#N)n1C	809302106	AEMVNKVTCUONCT-GZTJUZNOSA-N	442.497	1.985	50	20	IDGD	
COCC1(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)CCOCC1	809957703	UURVEGQENVBCAV-UHFFFAOYSA-N	439.534	1.065	50	20	IDGD	
CC(=O)c1cccc(S(=O)(=O)NCC(=O)NNC(=O)c2ccc3ccccc3c2)c1	810165041	TWPRKOWZRHIPJL-UHFFFAOYSA-N	425.466	1.782	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCC(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)cc1	811462145	MAMDBMMNCZFMBI-CYBMUJFWSA-N	425.894	1.542	50	20	IDGD	
NC(=O)N1CCC(=NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)CC1	812382499	JHROOLKRKUXPFA-UHFFFAOYSA-N	429.502	1.425	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)[C@@H]2CC(=O)N(c3c(F)cccc3F)C2)cc1	812732292	ZPNYKJMNPLQPBL-GFCCVEGCSA-N	438.456	1.711	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)[C@@H](Cc1cnc[nH]1)NC(=O)CC(C)C	813366487	SSZSNWITBQUVAU-QGZVFWFLSA-N	439.520	1.243	50	20	IDGD	
O=C(NN=Cc1c[nH]c(C(=O)O)c1)c1cccc(S(=O)(=O)NCc2ccccc2)c1	814709525	BSPMCUBLPPVRTH-UHFFFAOYSA-N	426.454	1.955	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2cccnc2)nnn1Cc1ccc(C(F)(F)F)cc1	815564143	ZAGVMVOCBNIQFK-UHFFFAOYSA-N	447.377	1.448	50	20	IDGD	
Cc1cc(Br)cc(C)c1NC(=O)C(=O)NNC(=O)[C@@H]1CCc2nncn2C1	815692623	WFVHLRPXFRXTPE-LLVKDONJSA-N	435.282	1.006	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1ccc2c(c1)OC(F)(F)O2	815750417	ANRJTNSZFFDEFE-UHFFFAOYSA-N	442.400	1.340	50	20	IDGD	
O=C1CNC(=O)c2ccc(C(=O)NNc3c(F)cc(C(=O)NC4CC4)cc3F)cc2N1	815857064	NRKGYSKHELMHJX-UHFFFAOYSA-N	429.383	1.296	50	20	IDGD	
Cc1cc(Br)c(S(=O)(=O)N2CC[C@@H](B(O)O)C2)c(Br)c1	864231725	RAZBRAXZFRSFMQ-MRVPVSSYSA-N	426.923	1.757	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(/C#N)C(=O)OCC(=O)NCC(=O)N2CCCC2)c1C	913150147	NUHPTGYMQIKAQC-WSLMLHKMSA-N	430.505	1.501	50	20	IDGD	
Cn1cc(S(=O)(=O)N2CCCCC2)cc1C(=O)NNC(=O)c1cn(C)c2ccccc12	914847034	KIYPQTVSIABXQZ-UHFFFAOYSA-N	443.529	1.766	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCCN1S(=O)(=O)c1cccs1)c1cccc([N+](=O)[O-])c1	915800442	TYIXOEGPNQDUTM-AWEZNQCLSA-N	438.487	1.661	50	20	IDGD	
O=C(NCCOc1ccccc1)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	915894546	CVAJWQWJEMFPAC-UHFFFAOYSA-N	446.529	1.884	50	20	IDGD	
CCOCc1ccccc1CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	916426885	WUFIZCQITNSDPW-UHFFFAOYSA-N	434.518	1.618	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NC[C@@H](C)N2CCc3ccccc32)c2ccccc2c1=O	916623023	XVEBLHVYRYSPQM-OAHLLOKOSA-N	434.500	1.812	50	20	IDGD	
COC(=O)CNS(=O)(=O)c1ccc(NS(=O)(=O)c2ccc(CCCl)cc2)cc1	917731826	JMVGENBYLXMYQV-UHFFFAOYSA-N	446.934	1.720	50	20	IDGD	
Cc1nccn1-c1ccc(CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)cn1	918001521	AIPIEBOYABQLDZ-UHFFFAOYSA-N	442.505	1.013	50	20	IDGD	
C[S@](=O)c1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)cc1	919352533	SIFGYXPXGMZXKR-LJAQVGFWSA-N	449.554	1.673	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)c2nc(S(C)(=O)=O)n3ccccc23)cc1OC	920274598	CHYOPMDYGUOOLF-UHFFFAOYSA-N	446.485	1.610	50	20	IDGD	
O=C(CSCC(=O)N1CCOCC1)NNC(=O)c1ccc(-c2ccc(F)cc2)s1	920287945	QQVFNMXDDJFRLS-UHFFFAOYSA-N	437.518	1.907	50	20	IDGD	
C[C@H](OC[C@@H]1CCCCO1)C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	921166737	NRIQDDCWIYLEKL-RDJZCZTQSA-N	439.534	1.206	50	20	IDGD	
CCOCCOc1ccc(Br)cc1C=NNC(=O)N[C@@H]1CCS(=O)(=O)C1	921259502	APTYKOSHEOQTRP-CQSZACIVSA-N	448.339	1.685	50	20	IDGD	
CN1C(=O)c2cccc3c(S(=O)(=O)NNC(=O)c4n[nH]c5c4CCCC5)ccc1c23	1116373140	VCGFVWROVRQJTB-UHFFFAOYSA-N	425.470	1.655	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)[C@@]2(C)Cc3ccccc3C(=O)O2)CC1	1318556469	CJNPPEATAFNFPC-JOCHJYFZSA-N	431.489	1.953	50	20	IDGD	
C[C@@H]1CN(S(=O)(=O)c2cccc(C(=O)NNc3nncc(N)c3Cl)c2)C[C@@H](C)O1	1319208796	NJSLSEXYFKGNIJ-GHMZBOCLSA-N	440.913	1.267	50	20	IDGD	
CCN(CC)c1ccc(S(=O)(=O)N2CCCCC2)cc1NC(=O)NNC(=O)CCO	1320276990	XOFKMYUMGICZLK-UHFFFAOYSA-N	441.554	1.243	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2c[nH]c(Br)c2)c1	1328386093	JIROITVEHAHNKA-UHFFFAOYSA-N	443.323	1.883	50	20	IDGD	
Cc1ccc(F)c(NC(=S)NNC(=O)c2ccc(S(=O)(=O)N(C)CCO)cc2)c1	1329890451	FEFSIURQZVXGCA-UHFFFAOYSA-N	440.522	1.378	50	20	IDGD	
CN1CCc2cc(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)[C@H](O)CCl)C4)ccc21	1778642443	CHJJSOJVFXNFBS-WOIUINJBSA-N	435.952	1.406	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cncn1-c1ccncc1)CCO2	1779296373	ONIDBYOGCZOPLP-NRFANRHFSA-N	443.580	1.562	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccnc(OC)c2)C1	1779722788	WAAWPPXDNDTBSU-RZQQEMMASA-N	425.913	1.472	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)[C@@H](C)CNC(=O)OC(C)(C)C)CCO2)C1	1781211274	OOLBDQWYKWVWEF-AUSJPIAWSA-N	431.961	1.995	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)C3CN(C(=O)OC(C)(C)C)C3)CCO2)C1	1781218709	JOGGIYVMVPYZPD-MGPUTAFESA-N	429.945	1.701	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1[C@@H](O)CCN1Cc1ccccc1)CCO2	1781219389	MSGBYKDULMMIHV-MXBUBSDBSA-N	449.979	1.469	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)nn1C(F)F	1781334471	NZSWVCFZCOCONJ-IAQYHMDHSA-N	439.232	1.721	50	20	IDGD	
O=C(c1nc2ccccc2o1)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1782235170	ACKBDZVGABJFKA-DYVFJYSZSA-N	426.242	1.962	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3nc(O)n4c3CCCC4)CCO2)C1	1783537626	PMYFMLMHUMXMRP-XIKOKIGWSA-N	441.326	1.152	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(-n4cccn4)cc3)CCO2)C1	1783882499	ZWIWHQBZRCDZTC-NQIIRXRSSA-N	432.908	1.570	50	20	IDGD	
C[C@@H](CC(=O)N1CCO[C@@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1)c1ccccc1	1783937547	URUXETCABHESSU-FDDCHVKYSA-N	430.549	1.383	50	20	IDGD	
CC(C)OC(=O)c1ncccc1C(=O)N1CCO[C@@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783944380	YEAGRZZISDJIDY-LJQANCHMSA-N	444.315	1.894	50	20	IDGD	
COc1cccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Br)C[C@@H]32)n1	1785811725	NIOVUKFQBISWCA-UHXUCMFUSA-N	430.274	1.374	50	20	IDGD	
COc1ncc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCBr)[C@H]3C2)cc1F	1786400813	ABPFAZYSQGWPRZ-WHOFXGATSA-N	444.301	1.608	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccnc4c3OCO4)C[C@@H]21	1786406123	JQDWWVGGGDIKPL-UBHSHLNASA-N	440.294	1.189	50	20	IDGD	
C[C@H]1CCc2c(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)CCBr)[C@H]4C3)n[nH]c21	1786406825	IVERSRIYHDLAHI-JURCDPSOSA-N	439.354	1.838	50	20	IDGD	
O=C(CCc1cn[nH]c1)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1	1786850104	DDQJQFIRYVANPQ-UHFFFAOYSA-N	432.289	1.470	50	20	IDGD	
Cn1cc(CCC(=O)NC2(c3ccc(NC(=O)c4cccc(B(O)O)c4)cc3)CCC2)cn1	1788143941	YEWQCIMKALEMPI-UHFFFAOYSA-N	446.316	1.480	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)[C@@H]3[C@H]4C=CS[C@H]43)CCC2)cc1)c1cccc(B(O)O)c1	1788150332	CXRKKODKMXNPKR-VAMGGRTRSA-N	434.326	1.989	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccn4cncc4c3)[C@H]2C1	1788407769	MRCBCXXCKIYCLU-CSFVBSKPSA-N	435.322	1.711	50	20	IDGD	
CC1CCN(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]3C2)CC1	1788761751	CGJGCRXTJJEAQU-FHWLQOOXSA-N	425.646	1.550	50	20	IDGD	
C[C@@H](Nc1ccccn1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CO[Si](C)(C)C)C[C@@H]21	1788782827	VPFLOJUYOCETNE-OWSLCNJRSA-N	434.613	1.713	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(COC)c[nH]3)[C@H]2C1	1789212829	FCAVQTWDBMQOBD-MPTYRVRUSA-N	442.354	1.928	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(-n4cccn4)nc3)C[C@@H]21	1789863333	NCOADVBSWIDNIP-XSLAGTTESA-N	431.924	1.878	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(O)cc3F)[C@H]2C1	1790082253	LMYJIQMNASSODJ-AZLWOZFGSA-N	429.286	1.908	50	20	IDGD	
COC(OC)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C(C#N)=C/c3ccc(F)cc3F)[C@H]2C1	1790694026	VGCLXRMGGPQCOU-DKQAGWEXSA-N	449.454	1.470	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)Cn3cncn3)C[C@@H]21	1790960894	SVLCNWBIYPZTAZ-QXKUPLGCSA-N	442.358	1.067	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(OC)cn3)C[C@@H]21	1790961768	QDPNDHQJNZFQLU-QEWYBTABSA-N	440.338	1.857	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(OC)c3F)C[C@@H]21	1791255992	AVZZPMIOFZKGHF-FAYQHZLMSA-N	428.888	1.681	50	20	IDGD	
O=C(CN(CCO)CCO)Nc1ccc(C2(NC(=O)[C@@H](F)Br)CCC2)cc1	1791328589	SAHYNZQYMGVFDJ-MRXNPFEDSA-N	446.317	1.098	50	20	IDGD	
C[C@@H](NC(=O)c1ccccc1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21	1792247679	ORGBSYBMOLVUJW-VFTHGPRRSA-N	425.888	1.319	50	20	IDGD	
Cc1nn(C)c(C)c1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)CBr	1792868427	AEFAFRKOEXNTIZ-HPAJIGNASA-N	427.343	1.271	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCNC(=O)c1ccccc1)C2	1793455338	IBQVNAFUNDMPGY-DMUMMCEESA-N	435.952	1.804	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN(C)C(=O)OC(C)(C)C	1795339790	LVBJMYKSNORFCF-GUIRCDHDSA-N	448.358	1.226	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C=C/c1ccccc1N	1795650766	DWWBHVFHHYWJCL-QNSTWFABSA-N	436.350	1.903	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ncn(-c2ccccc2)n1	1796538972	KWLWFFFXLAIMQS-MVJTYMMSSA-N	431.924	1.878	50	20	IDGD	
C#CCCCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O	1798522916	DQDNRMCORUJTEN-VPTLXERWSA-N	443.456	1.527	50	20	IDGD	
Cc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CO[Si](C)(C)C)C3)nn1C(F)F	1798675339	BNCSPYSZZHOKJB-YWVIFJGQSA-N	430.528	1.641	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc3ccoc3c1)C2)[C@H](F)Br	1799346191	IEMXJAMQSYJPGY-JLUCKKNBSA-N	426.242	1.722	50	20	IDGD	
C[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Br)c1ccc(O)cc1	1799348214	DNMUBBNFRXRGRW-APDPGRRMSA-N	429.286	1.776	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3nc[nH]c3c1)C2)[C@H](F)Br	1799348995	FNJCMPANQDHUCR-JLUCKKNBSA-N	425.258	1.457	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](F)Br)c1nc(O)n2c1CCCC2	1800158722	WRQKYOSWAUVKHB-FBKDDSFISA-N	429.290	1.867	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(C)n(CC)n1)C2	1800642109	XHMHWVIIEXGYOY-HLPPOEQASA-N	427.343	1.588	50	20	IDGD	
Cc1cccc2c(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)CCC(=O)NN(C)C)C4)n[nH]c12	1801124919	YJIOJTSVSQYYBX-MUJYYYPQSA-N	426.521	1.496	50	20	IDGD	
C[C@@H](Cc1ccccn1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2	1801226957	XFUKTOVLBDFWKL-PLPKTUSISA-N	428.302	1.540	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)Oc1cccnc1	1801405742	UGQJGXDOBSDKGN-BIYBGRMPSA-N	440.338	1.612	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCC(N)=O	1801663449	CFGKFUGLGRIJBN-CRWXNKLISA-N	430.933	1.022	50	20	IDGD	
COC(=O)c1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CCC(=O)NN(C)C)c(C)c1	1802343824	LHMVULTVWVXJTC-BCDXTJNWSA-N	444.532	1.406	50	20	IDGD	
Cc1ncoc1C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1	1805857851	LEKXACIGEQSLFS-CRAIPNDOSA-N	449.471	1.010	50	20	IDGD	
CC(F)(F)C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1	1806962821	LUDYVRAVLRZXNW-XJKSGUPXSA-N	432.431	1.055	50	20	IDGD	
CC1(C)CC(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)C1	1807363780	BPIKKJJQZQBVKS-NQIIRXRSSA-N	435.333	1.517	50	20	IDGD	
C=CCC(F)(F)C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1807367164	QYMJJHFEASIANM-MJGOQNOKSA-N	443.259	1.292	50	20	IDGD	
C[C@@H](C(=O)N1CC[C@H](CNC(=O)[C@@H](F)Cl)[C@@H]1c1cccnc1)N1CCN(C)CC1	1808316251	WWGWHPPDBHXFIH-XOYOTBSWSA-N	425.936	1.258	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H](CNC(=O)[C@@H](C)NC=O)[C@H]1c1cccnc1	1808381719	DOCDCAZDPACURR-DMRZNYOFSA-N	425.327	1.395	50	20	IDGD	
CNC(=S)NCCC(=O)NC[C@@H]1CCN(C(=O)C(C)(C)CCl)[C@@H]1c1cccnc1	1810308097	IZKSLKWHWCRIMT-DOTOQJQBSA-N	440.013	1.836	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1CCN(C(=O)c2n[nH]cc2[N+](=O)[O-])[C@@H]1c1cccnc1	1810544946	VLQKHWOQURZUSZ-KBXCAEBGSA-N	446.540	1.884	50	20	IDGD	
C[C@H](Cn1cncn1)C(=O)N1CC[C@H](CNC(=O)CO[Si](C)(C)C)[C@@H]1c1cccnc1	1810545910	HMFSBKPXYOSDMT-POAQFYNOSA-N	444.612	1.867	50	20	IDGD	
CCc1cc(C(=O)NC[C@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)no1	1811002624	UVYNKKPFWIQUOK-IIBYNOLFSA-N	442.520	1.325	50	20	IDGD	
CCOC(=O)/C=C/C(=O)N1CC[C@H](CNC(=O)[C@@H](C)Br)[C@H]1c1cccnc1	1812864022	JLUIOMGBKOLGOM-XJRXJOCRSA-N	438.322	1.990	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)/C=C/c2ccoc2)[C@@H]1c1cccnc1	1813071723	WHTUAWSPEDRCMU-CXAJTEIHSA-N	439.516	1.767	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2ccc(O)cc2)[C@H]1c1cccnc1	1813072768	KFUPRXRLVQSAMU-GCJKJVERSA-N	439.516	1.480	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)CNC(=O)C(F)(F)F)[C@H]1c1cccnc1	1813099823	IWPBAKVLYYJNIL-KCQAQPDRSA-N	434.846	1.783	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)C2=COCCC2)[C@@H]1c1cccnc1	1813118388	HKXCHBATGWFNGQ-UWJYYQICSA-N	429.521	1.155	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)COc2cccnn2)[C@@H]1c1cccnc1	1813390449	BZEJYZILGWLIGT-GJYPPUQNSA-N	433.896	1.210	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@H]1CCc2nc(NC(=O)CN3CCCC3=O)sc2C1	1814598226	ZTJLCHBZCWGVIB-BTDLBPIBSA-N	433.361	1.914	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@H]1CCc2nc(NC(=O)CN3CCCC3=O)sc2C1	1814598227	ZTJLCHBZCWGVIB-DYZYQPBXSA-N	433.361	1.914	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@H]1CCc2nc(NC(=O)c3cc(O)n[nH]3)sc2C1	1815203400	BGUGNRSWFIEIFP-SFYZADRCSA-N	428.312	1.829	50	20	IDGD	
CCOC(=O)N[C@@H](O)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CO[Si](C)(C)C)[nH]n1	1819241704	OJUJYBSOVOIYAO-GUYCJALGSA-N	441.561	1.318	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](COC(C)=O)OC(C)=O)sc2C1	1819861387	FIJTZEBAIAFRKQ-DYEKYZERSA-N	445.925	1.567	50	20	IDGD	
Cc1ccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)cc1O	1821033362	GUCLLRZLPQKXAM-IBGZPJMESA-N	448.288	1.723	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN2CCOCC2)[nH]n1	1822184824	WRUAYNVPUYQNSV-OCCSQVGLSA-N	428.331	1.517	50	20	IDGD	
C[C@H](C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)C(C)(C)CCl)CC2)N1CCN(C)CC1	1822685292	YAALCBCVBVHCFS-KGLIPLIRSA-N	442.029	1.956	50	20	IDGD	
O=C(CC12CCCN1CCC2)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](O)CCl)CC2	1822749550	ZEVPEQUILBBOPF-TZMCWYRMSA-N	426.970	1.673	50	20	IDGD	
O=C(COc1cccnn1)Nc1cc([C@H]2CCCCN2C(=O)[C@H](F)Br)[nH]n1	1822754988	XYMJRZSKZJGTHB-ABAIWWIYSA-N	441.261	1.961	50	20	IDGD	
O=C(NCC(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H](O)CCl)CC1)c1cccnc1	1824179569	UISXVKPJAGQEDO-ZWKOTPCHSA-N	436.940	1.031	50	20	IDGD	
Cc1ccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)cn1	1825813900	SKDRLVHKVUJUIN-JOCHJYFZSA-N	435.333	1.617	50	20	IDGD	
Cc1ccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)cn1	1827051406	XKQNDDXPXRHVPH-JOCHJYFZSA-N	435.333	1.617	50	20	IDGD	
O=C(C1=COCCC1)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827060563	QHPZFVUEZWWGKS-NRFANRHFSA-N	426.322	1.294	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@H]2CCOC2)CC1	1827679827	WNJDJHHVGVWVSS-GLGQMAOFSA-N	443.548	1.777	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H](F)Cl)CC1	1828926966	VFKSEEMDFQSOIY-JKSUJKDBSA-N	425.892	1.453	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3ccc(C#N)cc3)CCO2)C1	1829635494	JOOYZSAJNDBMAF-KNQAVFIVSA-N	449.935	1.201	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(Cl)nn3)C2)C1	1830364269	DZJWDICOYAOWIW-GOSISDBHSA-N	431.320	1.465	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H]2CNC(=O)C2)CC1	1831553002	FAIFYARUGJHHRC-HRCADAONSA-N	428.371	1.916	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(O)nc(O)n2)CC1	1831833902	QIMBBWBIEJMQOG-DZGCQCFKSA-N	426.901	1.375	50	20	IDGD	
CCn1ccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)n1	1831872428	WFIZFEZDTCDXBP-LJQANCHMSA-N	432.569	1.509	50	20	IDGD	
COC1(CC(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CCC1	1832496111	IWIODHKODBHOLS-NRFANRHFSA-N	442.365	1.559	50	20	IDGD	
O=C(c1ccc(F)s1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1833217634	PJCSNHSWMYDSAQ-DOMZBBRYSA-N	439.278	1.648	50	20	IDGD	
O=C(Cn1ccnc1)NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1	1834266733	GVYWXPYDZXJHGZ-INIZCTEOSA-N	430.322	1.145	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CNc3ccccc3C)CCO2)C1	1835866913	MVDPKSCXCQTOKU-UTKZUKDTSA-N	439.940	1.117	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccc(F)cn3)CCO2)C1	1836035777	HOSJXKAPAKLUSL-ACJLOTCBSA-N	444.301	1.003	50	20	IDGD	
CC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)CCC(=O)N3CCCC3)CC2)CC1	1836394900	IZPKISKXUXUBGD-IBGZPJMESA-N	441.016	1.978	50	20	IDGD	
Cn1ncc2c(C(=O)N3CCC(OC4CCN(C(=O)[C@@H](O)CCl)CC4)CC3)cccc21	1836716962	AYFQCMYQRIOZKA-FQEVSTJZSA-N	448.951	1.785	50	20	IDGD	
O=C(c1cc(C(F)F)no1)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836718288	UQHRZXYYLHINPL-AWEZNQCLSA-N	435.855	1.824	50	20	IDGD	
Cc1cc(/C=C/C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)no1	1837557038	CCOBLQMPXXPPJD-YQHFQFMOSA-N	446.331	1.689	50	20	IDGD	
CSCC(C)(C)C(=O)N1CCOC[C@@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1837710340	WPJPTGYZIDPKLV-LJQANCHMSA-N	432.659	1.684	50	20	IDGD	
O=C(Cn1ccccc1=O)N1CCC(OC2CCN(C(=O)C(Cl)Cl)CC2)CC1	1837934497	SCXOGMMUNOBISH-UHFFFAOYSA-N	430.332	1.651	50	20	IDGD	
CCc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)no1	1838126803	DOMCKPYFFVVNPL-IBGZPJMESA-N	425.558	1.159	50	20	IDGD	
CC[S@@](=O)CCC(=O)N1CCC(OC2CCN(C(=O)CO[Si](C)(C)C)CC2)CC1	1838362068	MASMNMLOMKGSQL-MUUNZHRXSA-N	446.686	1.995	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(C)nc3C)CCO2)C1	1838363618	DGHGESAAQODHKZ-FXAWDEMLSA-N	425.913	1.022	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)[C@@]3(C)CCCN3)CC2)CC1	1838632598	FCNYHJBBAKMEFP-IFXJQAMLSA-N	430.387	1.911	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(F)c3[N+](=O)[O-])C2)C1	1839147596	WXDTUTKXGDYFQP-KUHUBIRLSA-N	443.859	1.821	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)nc2nccn12	1839546641	BATHBUOCSBCSES-NRFANRHFSA-N	449.939	1.373	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3C[C@H]4CC[C@@H]3O4)C2)C1	1839966709	NVMYMEQBFNCHPP-CLLBMXBRSA-N	445.354	1.184	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3CCC(F)(F)C3)C2)C1	1840029541	JALBQCLNLUKFGZ-HEHGZKQESA-N	439.297	1.662	50	20	IDGD	
Cc1nc(C)c(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)s1	1840031518	SHQZYQIRXXKYMN-DIFFPNOSSA-N	446.367	1.613	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3c(C)cc(C)cc3C)C2)C1	1840156822	VEYSSZBWGOIPON-AVRDEDQJSA-N	438.952	1.936	50	20	IDGD	
C[C@@H](Nc1cccnc1)C(=O)N1CCOC[C@@]2(CN(C(=O)C(Cl)Cl)CCO2)C1	1840188067	MBCWYYORQRLHHC-ACJLOTCBSA-N	431.320	1.142	50	20	IDGD	
COc1ccc([C@H](O)C(=O)N2CC3(CCCN3C(=O)[C@@H](C)CBr)C2)cc1	1841285414	UQWHYVUOIXRZCX-BBRMVZONSA-N	425.323	1.963	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@@H](C(=O)N2CCCC23CN(C(=O)[C@H](O)CCl)C3)C[C@H]2C[C@H]21	1841361178	VTWFTRZPIVGCKY-KBUPBQIOSA-N	427.929	1.187	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC2(CCCN2C(=O)c2cccnc2CS(C)(=O)=O)C1	1842241324	IMEOPJANUOMYHS-GFCCVEGCSA-N	444.351	1.227	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2cnnc3ccccc23)C1	1843678120	MHTSZJXWEXDUHA-CVKSISIWSA-N	445.483	1.581	50	20	IDGD	
O=C(C(Cl)Cl)N1CC2(CCCN2C(=O)[C@@H]2CN(Cc3ccccc3)CCO2)C1	1843926023	WQSCTSRUYBVWKM-INIZCTEOSA-N	426.344	1.895	50	20	IDGD	
CCO/C=C/C(=O)N1CC2(CCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)C1	1845039290	BIFHRGVYBMDRBB-JLHYYAGUSA-N	429.521	1.086	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)c1ccc(S(C)(=O)=O)c(F)c1)C2	1846365137	CADMVQSFQVOQPU-CYBMUJFWSA-N	432.901	1.300	50	20	IDGD	
CN(CC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H]1C[C@@H]1C1CC1)NC(=O)NCc1ccccc1	1847490623	UINLZLKETUQCKV-CGXNFDGLSA-N	439.560	1.581	50	20	IDGD	
CSC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl	1847568127	OAFGZPKGBXMPCH-XUXIUFHCSA-N	435.974	1.044	50	20	IDGD	
CCOC(=O)c1c(CCC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](Cl)COC)c[nH]c1C	1847663340	MCBCBEJCCABAKU-IKGGRYGDSA-N	439.940	1.888	50	20	IDGD	
C#CCO[C@@H](C)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O	1847806216	OFANWBIVFOKMJA-KKXDTOCCSA-N	429.429	1.374	50	20	IDGD	
O=C(NNC(=O)[C@H]1CC(=O)N(c2ccc3c(c2)OCCO3)C1)c1cc(Cl)ccc1O	10600780	MNOOZCHRBYBXJU-NSHDSACASA-N	431.832	1.631	50	20	IDGD	
CCCC[C@H](NC1=NS(=O)(=O)c2ccccc21)C(=O)NNC(=S)NC(C)(C)C	12747694	BPOSPFGGZNNRJO-ZDUSSCGKSA-N	425.580	1.578	50	20	IDGD	
Cc1ccc(C)c(S(=O)(=O)N2CCN(CC(=O)NNC(=O)c3cccs3)CC2)c1	15411414	ZFXSTZDEAASOGQ-UHFFFAOYSA-N	436.559	1.132	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNS(=O)(=O)c2ccsc2C(=O)OC)cc1	15519962	HIUZGNFQACYBFJ-NSHDSACASA-N	428.488	1.710	50	20	IDGD	
CSCC[C@H](NC(=O)c1cccc(C)c1)C(=O)NNC(=O)COc1ccc(C#N)cc1	15888591	VKAJZZBHAASRED-IBGZPJMESA-N	440.525	1.945	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)CNC(=O)c2ccc(C(F)(F)F)cc2)c1	46769027	MQEKTMWEKODQRU-UHFFFAOYSA-N	443.403	1.300	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)[C@@H]2CCCN(S(=O)(=O)c3ccccc3)C2)cc1	110888965	FBVOSOAOZBBUEK-QGZVFWFLSA-N	430.530	1.655	50	20	IDGD	
Cc1cc(C)n(Cc2cccc(C(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)c2)n1	116107924	HAXOHVBVUKZJET-UHFFFAOYSA-N	430.468	1.870	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)[C@H]1CCCN1C(=O)OCC(F)(F)F	727799189	HUQMUGPBGKHAIX-CQSZACIVSA-N	441.410	1.909	50	20	IDGD	
COC(=O)c1cccc(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)c1	728214671	DOKDJVITOUVCPF-UHFFFAOYSA-N	432.502	1.166	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNS(=O)(=O)c2ccc(C(N)=O)cc2)c1	728508403	PPUDBOAGQYBBAA-UHFFFAOYSA-N	428.264	1.180	50	20	IDGD	
Cc1nc2[nH]n(C)c(=O)c2c(C)c1CCC(=O)NNC(=O)[C@H](C)Oc1ccc(F)cc1	729281670	AVDXZAPJZRXNDP-ZDUSSCGKSA-N	429.452	1.565	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C1(OC)CCN(C(=O)OC(C)(C)C)CC1	729297321	GILALBCOBGDPAK-UHFFFAOYSA-N	437.493	1.638	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H](c2ccccc2)N2CCC(O)CC2)c1	729519071	HGPJBYSSPACLEG-IBGZPJMESA-N	431.514	1.049	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C1CCN(C(=O)c2ccc(F)cc2F)CC1	730782128	IAJHSOMUNADKHY-UHFFFAOYSA-N	433.411	1.749	50	20	IDGD	
N#CCCn1cc(/C=C(/C#N)C(=O)NCCCN2C(=O)CNC2=O)c(-c2ccccc2)n1	731008595	JZAIGSJBEBXVCT-ATVHPVEESA-N	431.456	1.429	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN(C(=O)c2ccccc2)C1)c1nn(-c2ccccc2)cc1O	731224424	YNDKZEMXFNPICN-KRWDZBQOSA-N	433.468	1.891	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@@H]1CC(=O)N(C2CCC(C)CC2)C1	731343078	DMSADTSYGWMQMV-OGVSOVDVSA-N	449.577	1.476	50	20	IDGD	
CN(C)S(=O)(=O)c1c[nH]c(C(=O)NNc2ccccc2S(=O)(=O)NC(C)(C)C)c1	734251859	QCTMTOOXAQHEQP-UHFFFAOYSA-N	443.551	1.099	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)CNC(=O)Cc2ccccc2)CC1	734826170	ZSWCQBFPRIVXDY-UHFFFAOYSA-N	433.509	1.075	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)[C@H](C)CS(=O)(=O)c2ccc(OC)cc2)cc1	735004402	AALZIHGGCPWBQG-OAHLLOKOSA-N	434.514	1.894	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@H]2CCCO[C@H]2C(C)(C)C)c1	735762454	MPQNDUOGNWMXFL-NVXWUHKLSA-N	440.566	1.722	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)NCc2ccc(O)nc2)cc1	736173419	GLLIBDQXIFDURQ-LICLKQGHSA-N	446.467	1.758	50	20	IDGD	
CC(=O)N1CCN(C(=O)CCNC(=O)NNC(=O)c2cc3c(s2)CCCCCC3)CC1	737064969	LYTFFSQQDNYAPY-UHFFFAOYSA-N	449.577	1.432	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2nnc(-c3ccccc3)o2)ccc1OC	739668906	YRAPHVJLILVDGJ-UHFFFAOYSA-N	432.414	1.155	50	20	IDGD	
COc1ccc(S(=O)(=O)CCC(=O)NNC(=O)C(C)(C)c2ccccc2)cc1OC	740784766	QFEDENPQSBXDPP-UHFFFAOYSA-N	434.514	1.993	50	20	IDGD	
CC1(C)[C@H]2OCC[C@H]2[C@H]1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	741425550	LWWMJRIDWMGFGD-BBWFWOEESA-N	436.534	1.229	50	20	IDGD	
CN(C)c1ccc(NC(=O)NN=Cc2c(N3CCOCC3)nc3ccccn3c2=O)cc1	741766171	RATAJFOJMKGAGW-UHFFFAOYSA-N	435.488	1.753	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)[C@@H]1CCCN(C(=O)c2ccncc2)C1	741884011	ZNUOYMYDQIRSLP-QGZVFWFLSA-N	426.473	1.559	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)c2cn([C@H]3CCS(=O)(=O)C3)nc2C(C)C)c1	742473022	ZKUAZFQUAYBVJF-INIZCTEOSA-N	448.545	1.823	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)[C@@H]1CCCN(c2ncnc3sccc23)C1	742653650	OKTMRHQHAWMALP-CYBMUJFWSA-N	427.486	1.840	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N[C@H]2CCSC2)cc1	742778530	PAVNZWDQEKSZQA-OBHPCNEJSA-N	425.514	1.963	50	20	IDGD	
COc1ccc(O[C@H](C)CNC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc1	743685742	DFENQYNFQJSBAM-CQSZACIVSA-N	425.445	1.998	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c(-c2cccnc2)n1	743841909	FOBXTPHDAUHFDG-UHFFFAOYSA-N	433.516	1.455	50	20	IDGD	
C[C@H](CCOc1ccccc1)C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	744456102	YRPAWIZBBKKPTJ-GFCCVEGCSA-N	425.894	1.854	50	20	IDGD	
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCC(=O)NNC(=O)c1ccc(C#N)cc1	744473661	JDQPKBXVQGQSJV-FQEVSTJZSA-N	447.451	1.091	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H](C)CC(C)(C)OC)c1	745865640	YOPDPWMSIQGOOV-CQSZACIVSA-N	428.555	1.865	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)N[C@H]2C[C@@H](C)N(c3cnn(C)c3)C2=O)c1C	745917072	HINSZLDEUPNDES-UNEWFSDZSA-N	428.493	1.329	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNc1ccc(S(=O)(=O)NC2CC2)cc1	746201473	XLXHNSNGQMGLNW-UHFFFAOYSA-N	443.573	1.783	50	20	IDGD	
COCCNS(=O)(=O)c1cccc(CNC(=O)c2c(C)nn(CCCl)c2C)c1	746282978	XQWUEGOUVXSBFR-UHFFFAOYSA-N	428.942	1.593	50	20	IDGD	
COc1cc([C@@H](C)NC(=O)NNC(=O)Cc2cn3ccccc3n2)cc(OC)c1OC	746749544	BZBCSSKUYBXXIT-CYBMUJFWSA-N	427.461	1.994	50	20	IDGD	
CCC(CC)[C@H](CCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)OC	747457839	ZCUHLVAWYVBCGI-KRWDZBQOSA-N	428.555	1.722	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2cc3c(s2)CC[C@@H](C)C3)cnc2c1c(=O)n(C)c(=O)n2C	747725810	RXQXZQVRIHTOKQ-SNVBAGLBSA-N	441.513	1.202	50	20	IDGD	
Cn1c2ccccc2n2c(SCC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)nnc12	751140239	YKXYPXSSBOGIDE-UHFFFAOYSA-N	425.430	1.683	50	20	IDGD	
COC[C@H](C)n1c(SCC(=O)NNC(=O)N2CCOCC2)nnc1-c1ccccc1	751387262	PQLCIHLGAFRWBE-AWEZNQCLSA-N	434.522	1.318	50	20	IDGD	
COc1ccc(C(=O)NNC(=S)N[C@@H](C)C2CC2)cc1S(=O)(=O)N1CCCC1	751621654	ZVVAUMJVXNQPMH-LBPRGKRZSA-N	426.564	1.387	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2cnc(OCC3CC3)c(Cl)c2)n1	751815958	UAQCLFFZBSNWPZ-UHFFFAOYSA-N	438.893	1.836	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)NCC2(CN3CCOCC3)CCCCC2)nc2ccccc21	751816661	BSMOQCXSAJHXNC-UHFFFAOYSA-N	442.564	1.729	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C2CCN(c3ccc4nnc(C(F)(F)F)n4n3)CC2)o1	752522879	HSHPBZZJRMJLGW-UHFFFAOYSA-N	437.382	1.722	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)NC[C@]3(C)CCCN(C(=O)OC(C)(C)C)C3)nc21	753371478	KMTUGIAGGCBUOS-IBGZPJMESA-N	434.501	1.732	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCC[C@H](C)N2CCCCC2)cc1	753417884	DREKRAUTFLLIOJ-KRWDZBQOSA-N	439.582	1.210	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc2c(c1)nc(CCC(=O)NNc1cccnc1Cl)n2C	754487188	BNNATJMZKRMXQB-UHFFFAOYSA-N	436.925	1.948	50	20	IDGD	
O=C(CNS(=O)(=O)c1cccc(C(F)(F)F)c1)NNc1ccc(C(F)(F)F)nn1	755183754	SPERQJLZDZUZQY-UHFFFAOYSA-N	443.329	1.936	50	20	IDGD	
COC(=O)Cc1csc(NC(=O)NNC(=O)c2cc(Br)ccc2O)n1	755419697	HSHHYVHIPHMCER-UHFFFAOYSA-N	429.252	1.793	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2ccc(NC(=O)NNC(=O)c3ccccc3O)cc2)C[C@@H](C)O1	755423049	NOSTVJLJXYDGSG-OKILXGFUSA-N	448.501	1.657	50	20	IDGD	
CON(C)S(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@H](C)Oc2ccccc2F)cc1	755534343	KAWYKQZAVJDCHA-LBPRGKRZSA-N	440.453	1.628	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1ccc(-c2nnc3n2CCCCCC3)cc1	755582278	CINQUUNXTITJEZ-CYBMUJFWSA-N	449.537	1.152	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1-n1cnnn1	755686908	MKOGQLLPPILJEQ-UHFFFAOYSA-N	449.519	1.336	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)Nc1cc(Cl)ccc1OC[C@@H]1CCCO1	756207350	QUKRYZOKRXNQGO-AAEUAGOBSA-N	431.898	1.485	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)cc1-n1nnnc1C	756318469	IPDMREBCMYIMSL-UHFFFAOYSA-N	448.484	1.437	50	20	IDGD	
CCc1ccc(NC(=O)NNC(=O)[C@H](C)Oc2ccc(C(C)=O)cc2)cc1S(N)(=O)=O	756526127	SKKODKRACVHHLG-ZDUSSCGKSA-N	448.501	1.719	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2c(C)nc3ccccn23)cc1NS(C)(=O)=O	756782153	OIPPJFTZQCZJMT-UHFFFAOYSA-N	432.462	1.489	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)Nc2ccccc2N(C)S(C)(=O)=O)o1	757660344	FEEATORUNFGDQE-UHFFFAOYSA-N	437.522	1.984	50	20	IDGD	
CCN(CC)CCNC(=O)c1cc(NC(=O)NNC(=O)c2c[nH]nc2C)ccc1Cl	757757971	OVFPQKOQDURYEQ-UHFFFAOYSA-N	435.916	1.910	50	20	IDGD	
Cn1ccc(CCNC(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)n1	761012546	OAWIHTIFIRIODS-UHFFFAOYSA-N	445.487	1.309	50	20	IDGD	
CCc1csc(-n2cc(C(=O)NNC(=O)Nc3ccc(S(C)(=O)=O)cc3)cn2)n1	762745572	RCDNIZIFPWPTMB-UHFFFAOYSA-N	434.503	1.761	50	20	IDGD	
CNC(=O)Cn1ccc2ccc(NC(=O)C(=O)NNC(=O)c3ccc4ccccc4n3)cc21	763450971	RVZYPKCRFZQYME-UHFFFAOYSA-N	444.451	1.335	50	20	IDGD	
O=C(NNC(=O)c1ccncc1)C(=O)Nc1ccccc1-n1cc(Br)cn1	763465009	UEHKCJDUTDYPBE-UHFFFAOYSA-N	429.234	1.430	50	20	IDGD	
CCc1noc(-c2ccc(C)c(NC(=O)C(=O)NNC(=O)c3c(C)nc4ccccn34)c2)n1	763630246	WOLPTAXUVMUCLS-UHFFFAOYSA-N	447.455	1.963	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2ccc(-c3csnn3)cc2)c1	763664601	CTYKJAUVRQIFML-UHFFFAOYSA-N	425.470	1.987	50	20	IDGD	
COc1ccc(Br)c(NC(=O)C(=O)NNC(=O)COc2ccccc2F)c1	763678360	DRJOSXVXSIOTCX-UHFFFAOYSA-N	440.225	1.762	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)n(C2CCOCC2)n1	763859223	ZHDTYTISSKUESK-CYBMUJFWSA-N	433.440	1.236	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(CNC(C)=O)cc2)cc1	763862726	ZVSITFPEKKTOMP-CQSZACIVSA-N	442.472	1.275	50	20	IDGD	
Cc1cc(Br)ccc1NC(=O)C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	763917604	ZEDQEELCPHGFJT-UHFFFAOYSA-N	444.249	1.133	50	20	IDGD	
Cc1ccc(C(=O)N2C[C@@H](C)C[C@H](C)C2)cc1NC(=O)C(=O)NNC(=O)c1cccn1C	763993409	PSYCSDXQVNDTLS-GJZGRUSLSA-N	439.516	1.851	50	20	IDGD	
CN(C)C(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cccc(C(F)(F)F)c2)ccc1F	764040463	JQVUSWOPHRBLML-UHFFFAOYSA-N	440.353	1.946	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccc(C)c(N2CCOC2=O)c1	764139304	RQQIIVOBBHCJRK-UHFFFAOYSA-N	426.429	1.289	50	20	IDGD	
O=C(CCc1ccco1)NNC(=O)C(=O)Nc1ccc(OCC(F)(F)C(F)F)nc1	764177698	SCPMKTQMUUHISK-UHFFFAOYSA-N	432.330	1.673	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)CC(=O)N3)c1	764230296	GZQNGIQVXMTHKJ-UHFFFAOYSA-N	447.245	1.352	50	20	IDGD	
COC(=O)c1cc2cc(NC(=O)C(=O)NNC(=O)Cn3ccc4ccccc43)ccc2o1	764243349	USQLFGQUFCDKFE-UHFFFAOYSA-N	434.408	1.960	50	20	IDGD	
COC(=O)NCc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(OC(F)F)c2)cc1	764251207	QUVLUYDTDBGEQF-UHFFFAOYSA-N	436.371	1.544	50	20	IDGD	
COCCn1nc(C)c(NC(=O)C(=O)NNC(=O)c2cccc(OC(F)F)c2)c1C	764253751	VSQJVLBEXMXPDZ-UHFFFAOYSA-N	425.392	1.147	50	20	IDGD	
CCOCC(=O)NNC(=O)C(=O)Nc1ccc(Cl)cc1I	764318431	UYMONLDSIXBULH-UHFFFAOYSA-N	425.610	1.067	50	20	IDGD	
Cc1ccc(I)cc1C(=O)NNC(=O)CCN1C[C@@H](C)O[C@H](C)C1	764321674	YMFDPBWGURSFBR-CHWSQXEVSA-N	445.301	1.860	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)C(=O)Nc1ccc(CS(C)(=O)=O)c(F)c1)c1ccccc1	764330965	ZRDMBBBAAFTTHP-MRXNPFEDSA-N	435.477	1.650	50	20	IDGD	
Cc1cc(-c2cc(C(=O)NNC(=O)CNC(=O)c3cccnc3)c3c(C)noc3n2)c(C)o1	764342919	KAJCGNJCWBKKLR-UHFFFAOYSA-N	448.439	1.994	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1cccc(NC(=O)c2cccs2)c1	764399903	NJWPIZPHNGIFCN-GFCCVEGCSA-N	434.474	1.138	50	20	IDGD	
O=C(NNc1ncnc2ccsc12)[C@@H]1CN(Cc2nc(O)c3ccccc3n2)CCO1	766679124	QMCVVSJDXWCEJN-HNNXBMFYSA-N	437.485	1.684	50	20	IDGD	
O=C(COC(=O)[C@H]1CC(=O)N(c2ccc(Cl)c(F)c2)C1)NNC(=O)c1ccccc1	766979780	ZBLZOBPMAJOPCU-ZDUSSCGKSA-N	433.823	1.836	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)CCC(=O)c2ccc3c(c2)CCC(=O)N3)c2ccccc2c1=O	767294264	AVBLBUMKMQJMOS-UHFFFAOYSA-N	447.451	1.242	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3cn(C)nc3C(F)(F)F)n[nH]2)cc1OC	768275670	FGYKYJJBBGPCNI-UHFFFAOYSA-N	438.366	1.921	50	20	IDGD	
COc1cc(N[C@@H]2CCCN(CC(=O)NNC(=O)Cc3nc(C)cs3)C2)cc(OC)c1	768552367	MSENFVNMVVEUCD-OAHLLOKOSA-N	447.561	1.735	50	20	IDGD	
CCC1(CC)[C@@H](OC)[C@@H](C)[C@H]1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	771433670	IOEQXFASSMNANS-XKQJLSEDSA-N	440.566	1.721	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Nc2cccc(-c3ncn(C)n3)c2)cc(OC)c1OC	771794817	XARGOVKGIWBZIY-UHFFFAOYSA-N	426.433	1.974	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)[C@@H]1CCCN(C(=O)c2ccccc2)C1	772182402	JYEKHJMWJYVLCK-QGZVFWFLSA-N	442.903	1.656	50	20	IDGD	
COc1ccc([C@@H](CC(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)NC(C)=O)cc1	772195621	BBLOYULMCUMNSX-GOSISDBHSA-N	446.891	1.380	50	20	IDGD	
CC(C)[C@@H](C(=O)NNC(=O)COc1ccccc1-c1ccccc1)N1CCCS1(=O)=O	772629666	DNFCEIHRBXIMCY-NRFANRHFSA-N	445.541	1.940	50	20	IDGD	
COc1ccc(OC)c(NC(=O)C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)c1	773467274	MYWBFKHGUFWOGY-UHFFFAOYSA-N	434.399	1.956	50	20	IDGD	
N#Cc1cccc(NNC(=O)C(=O)Nc2ccc3c(ccn3CCN3CCOCC3)c2)c1	773688538	FEHFBBJHFQFTRB-UHFFFAOYSA-N	432.484	1.927	50	20	IDGD	
O=C(NNc1cccc(Cl)c1)C(=O)Nc1ccc(C(=O)NCCN2CCOCC2)cc1	773744741	SRTLERXPMQSNIM-UHFFFAOYSA-N	445.907	1.484	50	20	IDGD	
COCCOC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(C)c(F)c2)c1	773886613	ZHRPBMKXSDCYTL-UHFFFAOYSA-N	432.408	1.729	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccc(C(=O)N(C)C)cc1	774010713	YUFUUYHHBUAROB-LBPRGKRZSA-N	432.864	1.595	50	20	IDGD	
O=C(NNC(=O)c1ccccc1O)N[C@@H]1CCN(c2cccc(Br)c2)C1=O	775219955	LAYVWKQSJZXEDK-CQSZACIVSA-N	433.262	1.904	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)COC1CCN(C(=O)OC(C)(C)C)CC1	777085077	ASGKPKMOUOJIDB-UHFFFAOYSA-N	437.493	1.638	50	20	IDGD	
COC(=O)c1ccccc1NNC(=O)C1CCN(S(=O)(=O)c2cn(C)c(C)n2)CC1	777773497	QFDHLLORSHQKGL-UHFFFAOYSA-N	435.506	1.059	50	20	IDGD	
COc1ccc(N2CCN(C(=O)/C=C\C(=O)NNC(=O)c3ccc(C#N)cc3)CC2)cc1	778251470	BFPKCUMFTBNDBR-KHPPLWFESA-N	433.468	1.233	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(F)(F)c2ccccc2OCC(=O)N(C)C)c1O	779185081	MRIUPKUPLWKXLR-UHFFFAOYSA-N	437.399	1.421	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)c1ccc(C(=O)c2cccc(O)c2)cc1	780173693	MVERRVNKNIRZMT-UHFFFAOYSA-N	428.408	1.674	50	20	IDGD	
COCCN1C(=O)c2ccc(C(=O)NNc3cccc(C(=O)OC)c3)cc2S1(=O)=O	780800131	ADCNLRYISLXBIK-UHFFFAOYSA-N	433.442	1.021	50	20	IDGD	
CC(C)(C)OC(=O)NCCCCC(=O)N1CCN(S(=O)(=O)CBr)CC1	782045645	OXDYMLFTFNYYGF-UHFFFAOYSA-N	442.376	1.508	50	20	IDGD	
CCCCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNc2ncncc2Cl)cc1	782159455	KZGARLNXTCNIKQ-UHFFFAOYSA-N	426.886	1.754	50	20	IDGD	
COc1ccc(NNC(=O)CCNc2ccc(S(N)(=O)=O)cc2[N+](=O)[O-])cc1Cl	782794408	FERUMEAOVGNJGS-UHFFFAOYSA-N	443.869	1.850	50	20	IDGD	
Cc1c(CS(C)(=O)=O)cccc1NC(=O)C(=O)NN=c1sc2ccccc2n1C	783349254	GYHJLBZXSDXTOG-UHFFFAOYSA-N	432.527	1.663	50	20	IDGD	
Cn1c(=NNC(=O)C(=O)Nc2ccc(F)cc2CS(C)(=O)=O)sc2ccccc21	783349399	IIHUGEDNVMNGDR-UHFFFAOYSA-N	436.490	1.494	50	20	IDGD	
CC(=NNC(=O)Cc1cc(O)nc(S)n1)[C@H]1CN(C(=O)OCc2ccccc2)CCO1	783822471	UWKDDBJGQZLTEF-MRXNPFEDSA-N	445.501	1.543	50	20	IDGD	
CCC(CC)NC(=O)[C@@H]1CN(C(=O)C(=O)NNc2ccc(C)nn2)c2ccccc2O1	783947521	CCMQCRGUMXBGBU-KRWDZBQOSA-N	426.477	1.327	50	20	IDGD	
Cc1c(NNC(=O)C(=O)Nc2ccccc2N2CCC(C(N)=O)CC2)cccc1[N+](=O)[O-]	784352982	OSHMOSDMLWRERC-UHFFFAOYSA-N	440.460	1.687	50	20	IDGD	
COC(=O)c1cccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)c1	784835217	IGUWWEGIPMHSGW-UHFFFAOYSA-N	427.385	1.551	50	20	IDGD	
CNC(=O)c1ccc(Cl)c(NC(=O)C(=O)NNc2ccnc(Br)c2)c1	784837510	VQLXHSFHFQSEGI-UHFFFAOYSA-N	426.658	1.939	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNc3cccc(S(C)(=O)=O)c3)cc2)CCO1	784841173	MOOHOEOKAGCHBV-AWEZNQCLSA-N	432.502	1.397	50	20	IDGD	
CCCN1CCN(c2ccc(NC(=O)C(=O)NNc3nccn(C)c3=O)cc2Cl)CC1	785090573	SXCFGLYSPBLPIO-UHFFFAOYSA-N	447.927	1.048	50	20	IDGD	
COc1ccc(OC)c([C@H]2C[C@H]2C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1	788091929	UZXBJOGRYBYWQL-SJLPKXTDSA-N	425.489	1.661	50	20	IDGD	
Cc1cc(-n2cccn2)ccc1NC(=O)C(=O)NNC(=O)CN1CCCc2ccccc21	789585728	CLHJNGNLHNQWMW-UHFFFAOYSA-N	432.484	1.719	50	20	IDGD	
COC(=O)c1cc(OC)ccc1NC(=O)C(=O)NNC(=O)[C@H]1OCC[C@H]1c1ccccc1	789809570	AFTIISKAJFRPCS-YJBOKZPZSA-N	441.440	1.140	50	20	IDGD	
COc1ccc(C(=O)N2CCN(S(=O)(=O)CBr)CC2)c(OC(C)C)c1	789847183	XKFXTNJHPXCVAF-UHFFFAOYSA-N	435.340	1.922	50	20	IDGD	
Cc1ccc(CN2CC[C@@H](NC(=O)NNC(=O)COc3ccccc3[N+](=O)[O-])C2=O)cc1	790696375	IDGBENJQGJAREF-MRXNPFEDSA-N	441.444	1.414	50	20	IDGD	
CC(=O)N1CCC[C@H](CNC(=O)NNC(=O)[C@@H](C)Oc2cccc(Br)c2)C1	792781590	XKZSTMJUDMTUTO-TZMCWYRMSA-N	441.326	1.805	50	20	IDGD	
CC(=NNC(=O)Cn1nnc(-c2ccccc2)n1)c1cc(S(N)(=O)=O)c(C)cc1C	794465997	SHUSJUQEBKKPEF-UHFFFAOYSA-N	427.490	1.145	50	20	IDGD	
CCCS(=O)(=O)c1ccccc1C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	794722656	ZHBBYNKRAXNAQW-UHFFFAOYSA-N	425.532	1.878	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)CNC(=O)c1ccc(Br)o1	795181398	KQUSVAASBBEZBP-UHFFFAOYSA-N	445.295	1.166	50	20	IDGD	
C=C(CBr)COC(=O)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(Cl)cc1	795315931	SQMSDZYUPSYXSY-OCCSQVGLSA-N	438.727	1.958	50	20	IDGD	
COC(=O)[C@H](C)S(=O)(=O)NC(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccccc1	797282549	HLBXRNSMYKNKNU-HNDQUVLASA-N	441.469	1.378	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)c2cnn(CCO)c2-c2ccccc2)c1	801318874	QIPWXVKQOZSUJP-UHFFFAOYSA-N	433.424	1.032	50	20	IDGD	
O=C(NNC(=O)C1=CC=CN2CCS(=O)(=O)N=C12)Nc1ccc(Cl)cc1Cl	802091812	XEYKSCPNZROYOU-UHFFFAOYSA-N	430.273	1.644	50	20	IDGD	
O=C(NCCNS(=O)(=O)c1ccc(F)cc1Cl)NNc1nc2ccccn2n1	802434599	OAQFBBJWFIKJFF-UHFFFAOYSA-N	427.849	1.126	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cc(=O)c3ccc(F)cc3o2)cc1OC	803928409	UXUWHFPRVPRZIE-UHFFFAOYSA-N	444.371	1.567	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)c1c(C)nn(Cc2ccccc2)c1N	803934048	ZHONIKXVOOVJAE-UHFFFAOYSA-N	435.484	1.677	50	20	IDGD	
O=C(Cn1cc(Cl)cn1)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	806306676	RFRYSQVNEZHIJW-UHFFFAOYSA-N	425.898	1.172	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2c(C)c(C(F)(F)F)nn2C)cc1	806977789	ZDYKLESUEKRVOW-UHFFFAOYSA-N	427.383	1.475	50	20	IDGD	
COCc1csc(NC(=O)C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)n1	807020156	HHIWYKVLSSPHSA-UHFFFAOYSA-N	425.417	1.542	50	20	IDGD	
COc1cc(C)nc(NNC(=O)NCCNS(=O)(=O)c2ccc(Cl)cc2C)n1	807547916	OIJXDPKCEGCFRE-UHFFFAOYSA-N	428.902	1.360	50	20	IDGD	
Cn1c(CCC(=O)NCC(Cl)Cl)nc2cc(S(=O)(=O)N3CCOCC3)ccc21	808131642	QBLARPMLWBIPLZ-UHFFFAOYSA-N	449.360	1.447	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)[C@H]2C[C@@H](c3ccccc3)OC2=O)cc1OC	808585640	IEXGACLLEMQFOL-WBVHZDCISA-N	442.424	1.312	50	20	IDGD	
O=C(CNS(=O)(=O)c1cc(C(F)(F)F)ccc1Cl)NNc1ncnc2[nH]cnc12	810424980	WDQSFFBAIFUEET-UHFFFAOYSA-N	449.802	1.447	50	20	IDGD	
CO[C@H]1CCOc2c(NC(=O)C(=O)NNc3ccc(S(=O)(=O)N(C)C)cc3)cccc21	813034053	WNMZZUXRHLHBGF-KRWDZBQOSA-N	448.501	1.489	50	20	IDGD	
CCCc1nnc(SCC(=O)NNC(=O)Nc2cc(OC)c(Cl)cc2OC)n1N	813574674	FAGHRCXFKILOPK-UHFFFAOYSA-N	443.917	1.560	50	20	IDGD	
Cc1cc2c(cc1C)C(=NNC(=O)c1cccc(S(=O)(=O)N3CCOCC3)c1)CO2	814689227	XHYDQNFXKGGXAY-UHFFFAOYSA-N	429.498	1.851	50	20	IDGD	
O=Cc1c[nH]c(C(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)c1	814718102	ISLGTLBXAJSZOO-UHFFFAOYSA-N	426.454	1.381	50	20	IDGD	
COCCN1[C@H]2CC[C@H]1CC(=NNC(=O)CN1CCN(C(=O)c3ccccc3)CC1)C2	814878687	HAQGBRCREONFNJ-SFTDATJTSA-N	427.549	1.190	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)c2cc(F)cc(Br)c2N)cc1	815248865	FPXHWNCFVSHEJP-UHFFFAOYSA-N	435.209	1.660	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)cc1)[C@H]1C[C@@H]1C	815565601	USCPBCBTOJXGGW-XOBRGWDASA-N	449.467	1.484	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccn(-c3ccc(Br)cc3)n2)o1	815569870	KNPJZYXHFHSPPT-UHFFFAOYSA-N	432.234	1.936	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2ccc([C@H]3CCOC3)cc2)n[nH]1	815570199	VPJYCXXFQDUGEB-HNNXBMFYSA-N	449.467	1.989	50	20	IDGD	
CCOc1ccc(NNC(=O)C(=O)Nc2ncn(CC(=O)N3CCCCCC3)n2)cc1	815816328	RHFOOBNWKIUDQY-UHFFFAOYSA-N	429.481	1.161	50	20	IDGD	
O=C(CC1CC1)NNC(=O)c1ccc(NS(=O)(=O)c2ccc3c(c2)OCCO3)cc1	819136019	JJHJHVVHUMBJRN-UHFFFAOYSA-N	431.470	1.820	50	20	IDGD	
CCC[C@H](C(=O)OCC)S(=O)(=O)NNC(=O)c1nn(CCC)c(=O)c2ccccc12	821126933	AHRSJFCXQSCLKS-OAHLLOKOSA-N	438.506	1.103	50	20	IDGD	
COCCCN(C(=O)/C(C#N)=C\c1cc(C)n(CCOC)c1C)[C@H]1CCS(=O)(=O)C1	841771894	ZRSRNPJNMPFHHU-DTBYZMGXSA-N	437.562	1.711	50	20	IDGD	
CCOc1ccc(N2C[C@H](C(=O)NNC(=O)CNc3ccc(OC)cc3)CC2=O)cc1	913430494	HGGLPOHVMMKGNO-OAHLLOKOSA-N	426.473	1.706	50	20	IDGD	
Cn1c(=O)nc(O)c2c(C(=O)NNC(=O)Cc3c[nH]c4ccccc34)cc(C3CC3)nc21	914333584	HRUNQYXIOHTPIT-UHFFFAOYSA-N	432.440	1.397	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)NC(C)(C)C)N(S(C)(=O)=O)CC2	915879270	LQHXWLVCNNXMQC-AWEZNQCLSA-N	442.538	1.082	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)NC[C@@H](c1cccs1)N1CCOCC1	915894009	UPAHEDIRWAUKFN-INIZCTEOSA-N	448.545	1.930	50	20	IDGD	
COc1ccc([C@@H](CNC(=O)NNC(=O)COc2ccc(F)cc2)N(C)C)cc1OC	915898181	UPTOJIDCNKBLHH-QGZVFWFLSA-N	434.468	1.855	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)NCCNC(=O)c2ccccc2Cl)nc2ccccc21	916263807	YEFMYTJVWKSOCL-UHFFFAOYSA-N	428.880	1.530	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)NCc2ccnc(N3CCN(C)CC3)c2)c1C	916389748	DHASCKWEIYYMOG-GOSISDBHSA-N	440.548	1.748	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NC[C@@H](C)N(C)c2ccccc2)cc1	916451638	MRPBFWRVSCHHHK-QGZVFWFLSA-N	447.561	1.471	50	20	IDGD	
CCOC(=O)N[C@H](CNC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)CC(C)C	916631672	NUQFFTRKBVREFQ-ZDUSSCGKSA-N	432.481	1.038	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H](CC(C)C)N2C(=O)[C@@H]3CC=CC[C@H]3C2=O)cc1	916830420	WRMOHPOWPTWAKV-KURKYZTESA-N	440.500	1.447	50	20	IDGD	
CCCC(=O)N1CCCC[C@@H]1C(=O)NNC(=O)c1nn(CCC)c(=O)c2ccccc12	918146089	NKXJYMYPJMBLFG-QGZVFWFLSA-N	427.505	1.749	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)NC2CCOCC2)c1	918233293	NPAPYDGRMIGETH-UHFFFAOYSA-N	448.501	1.619	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)Cc1cnn(-c2ccccc2)n1	919338434	GKLWRZCDEMGKRF-UHFFFAOYSA-N	443.847	1.476	50	20	IDGD	
COC(=O)c1ccc(Cl)c(S(=O)(=O)NNC(=O)c2nnc(-c3ccccc3)o2)c1	919961562	CJPRRDLVTOZKGZ-UHFFFAOYSA-N	436.833	1.800	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)[C@@H]2CCCN2C(=O)/C=C/c2ccc(C(N)=O)cc2)c1	920020006	FSEQHZRXKIVAAG-YPNIWSFNSA-N	449.511	1.317	50	20	IDGD	
CCCCNC(=O)NNC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1	920821885	QETLCZWTXMYRKP-OAHLLOKOSA-N	427.483	1.269	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)NC[C@@H](c1cccc(F)c1)N1CCOCC1	921247595	IAZDKRXINWISGB-IBGZPJMESA-N	434.443	1.748	50	20	IDGD	
COc1ccc(C(=O)NNc2nncc(N)c2Cl)cc1S(=O)(=O)N1CCCC1	1253124683	XXHDBVYUIZDPHG-UHFFFAOYSA-N	426.886	1.262	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)NCCC(=O)NC2CCCCC2)CC1	1318570011	HICAOGOYMPCAJI-UHFFFAOYSA-N	439.557	1.803	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)c1ccc([S@@](C)=O)cc1	1319501104	ISBKTXURARWGLA-NGFNCXNUSA-N	430.534	1.522	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)NCCN2CCOCC2(C)C)CC1	1328685127	GKKQTAUKGBXOCE-UHFFFAOYSA-N	427.546	1.075	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccccc1)NNC(=O)Cc1nc(-c2ccccc2)cs1	1337105792	ZJONLZVZOKVRLI-UHFFFAOYSA-N	430.511	1.479	50	20	IDGD	
O=C(c1cc2cccnc2[nH]1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1778590420	ABUCQPQKHFFWSO-CXAGYDPISA-N	425.258	1.697	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)C#CC3(O)CCCCC3)C2)C1	1779068355	YZWWCAPQBBYAEK-ICSRJNTNSA-N	431.360	1.751	50	20	IDGD	
Cn1ncc2c(C(=O)N3CCO[C@@]4(CCN(C(=O)CO[Si](C)(C)C)C4)C3)cccc21	1779297240	XOZFTCANCGOVHD-OAQYLSRUSA-N	430.581	1.868	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@]2(C1)CN(C(=O)Cc1ccc3c(c1)CCO3)CCO2	1779301584	SMJCAAOODPQGNP-QFIPXVFZSA-N	432.593	1.845	50	20	IDGD	
C[C@@H](Cn1cncn1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Br)C2	1779500509	OWICPJFKTYGXNW-ZOMKSWQUSA-N	446.321	1.119	50	20	IDGD	
CCn1nc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](Cl)COC)C3)cc1C	1779834984	LMIONUQKTIFDBU-XAUMDUMWSA-N	426.945	1.593	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Cl)C2)c1cnc2snnc2c1	1780042756	KSNMUAOWXOQZMM-PBFPGSCMSA-N	427.889	1.748	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Br)C2)[C@H](F)Br	1780773818	NHMFHXNPEKCDLM-BSTOTGJRSA-N	448.102	1.881	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2)c1c(F)ccc(O)c1F	1781091422	RJEXSDGWKVZHCY-PJIJBLCYSA-N	432.851	1.398	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)c3cn4ncccc4n3)CCO2)C1	1781229282	FWOKAMLILSBJGY-MSOLQXFVSA-N	426.304	1.409	50	20	IDGD	
Cc1cnc2c(C(=O)N3CCO[C@@]4(CCN(C(=O)[C@@](C)(Cl)CCl)C4)C3)cnn2c1	1781230623	WJRARXNYJAFNGS-OALUTQOASA-N	440.331	1.718	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(C(N)=O)cc3)CCO2)C1	1781233954	PAORADIRYISRKG-RTBURBONSA-N	428.316	1.465	50	20	IDGD	
C=CC[C@@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnccc1C(=O)NN)C2	1781742652	XCAVNKZKFIEVJG-YBOAYWMSSA-N	429.521	1.025	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](O)Cc2ccccc2)C1	1781895872	JUSJFVMQCDMPTN-JZJXAQOMSA-N	438.952	1.358	50	20	IDGD	
COCc1oncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)Br)C1	1781999099	PMJSIZZSGIYWFU-CDHAZOANSA-N	444.326	1.732	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(O)ccc3O)C2)C1	1782042578	LAQDFOJPOJWVAF-KZULUSFZSA-N	427.295	1.572	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](CN)c1ccccc1)C2	1782170775	XJPRIZHAGDMUDA-JPAWQOSXSA-N	437.968	1.497	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(CCN(C(=O)c3cnc4c(c3)CCNCC4)C2)C1	1782729753	KUCKCVLMZFRION-QFIPXVFZSA-N	446.624	1.065	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)[C@@H](N)Cc3cscn3)CCO2)C1	1783348118	VPVAIBQXSPCKCI-GRDNDAEWSA-N	445.383	1.016	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)Cc3cnc(C)s3)CCO2)C1	1783352950	KCBQKBJXQZRKCI-WMLDXEAASA-N	430.368	1.997	50	20	IDGD	
CNc1nsnc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CO[Si](C)(C)C)C[C@@H]21	1783522019	QWZHTYHGNAQQTR-AVGNSLFASA-N	427.603	1.025	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)COc3ccc(O)cc3)CCO2)C1	1783527519	CJMYVUDFXIYPFU-SCLBCKFNSA-N	427.295	1.384	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)Cc3cccc4ncccc34)CCO2)C1	1783871799	VWFDQRQRNPNAMN-AVRDEDQJSA-N	431.920	1.861	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(-c4ccccn4)[nH]n3)CCO2)C1	1783877801	PYFOMHPWGDTFPG-XOBRGWDASA-N	433.896	1.169	50	20	IDGD	
COc1ccc(F)c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]3C2)c1OC	1784092915	XOIGJCDRRJKIPP-GMZLATJGSA-N	444.887	1.036	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CC[C@]3(CN(C(=O)CCBr)CCO3)C2)cc1	1785103298	TUZXWJKTFAAVDP-IBGZPJMESA-N	438.322	1.874	50	20	IDGD	
CN(CCCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2)C(=O)OC(C)(C)C	1785582556	SGMJBPXCPUWKNO-FOIQADDNSA-N	447.960	1.063	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3scnc3C3CC3)[C@H]2C1	1785789121	OGBSMLWHAOYHAN-AJNGGQMLSA-N	427.954	1.868	50	20	IDGD	
CCN(CC)C[C@@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCBr)[C@H]2C1	1786407090	FUSUUBGPDSZXKV-QZWWFDLISA-N	432.403	1.729	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)c1cnc2ccccn12	1787931788	VQXQHZRYNHLTRS-DZKIICNBSA-N	435.322	1.713	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc(F)cn3)C[C@@H]21	1789866048	LICRSUJILYXNRL-DLLGKBFGSA-N	432.323	1.979	50	20	IDGD	
CCCc1onc(C)c1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](Cl)COC)[C@H]2C1	1791254938	XGRZCBAJQNTNFB-MPTYRVRUSA-N	427.929	1.783	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3ccc(C)nc3C)C[C@@H]21	1791256282	KZSJZOPTCLCXAW-MUGJNUQGSA-N	437.968	1.865	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3cc(F)ccc3OC)[C@H]2C1	1791378619	QQTJCXUFVKXIJW-KUZCPNRJSA-N	442.915	1.610	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCCn3ccnc3)[C@H]2C1	1791567186	PJLPBYXZPCSVIR-UGUYLWEFSA-N	427.343	1.426	50	20	IDGD	
CSCC[C@H](O)C(=O)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1	1791615667	AFDJHFYMRNCYAI-IBGZPJMESA-N	442.346	1.228	50	20	IDGD	
C[C@H](CBr)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](C)[C@@H]1SC(=N)NC1=O)C2	1792988321	VPUQIYGWZZFLAN-HKLHZYFVSA-N	445.383	1.458	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CC1CC1)C2	1793881107	PAGSDSJSKFXMEV-IVSAIRAKSA-N	429.945	1.508	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3cccnc3nc1O)C2	1795115235	RFCVTTVJCDPXNK-YWVIFJGQSA-N	449.305	1.324	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](COC)NC(=O)OC(C)(C)C	1796392698	FXOZJIXBADZSEF-YIDVYQOGSA-N	447.960	1.133	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc2cccnc12)c1ccc(B(O)O)cc1	1797329778	XTNBXEVLHCIHSM-ACDBMABISA-N	429.285	1.480	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C=C/c1cccs1)C2	1798439311	VUZQKXNLRCTOOD-ISFILERXSA-N	425.514	1.712	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c(-c3ccncn3)noc1C)C2	1799268659	BUXRSTZURQHDLO-UMPJEAMMSA-N	433.896	1.661	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(Cl)cc3nn[nH]c13)C2	1799268902	NGWDEIULQNFAMW-YJKIEOBBSA-N	426.304	1.832	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccn3c(C)cc(C)nc13)C2	1800979544	OVGOOWLKFDGICT-CYGHRXIMSA-N	434.924	1.408	50	20	IDGD	
COc1cccc(CC(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)c1	1803138191	HHVIIIFDZCQWBF-LMNJBCLMSA-N	431.920	1.938	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc3nonc3c2)[C@H]1c1cccnc1)[C@@H](O)CCl	1803139720	UGMMSCITPVXBRK-WBAXXEDZSA-N	429.864	1.537	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)CNCP(=O)(O)O)[C@@H]1c1cccnc1	1803688439	BOYXWJKIHRNKKW-YQQAZPJKSA-N	446.872	1.220	50	20	IDGD	
COc1cccc(CC(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)c1	1806551800	HTHLYRARAFROMV-CUWPLCDZSA-N	431.920	1.938	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)C2=CCCS2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807358998	BXEOSUKJEMVYKY-XLIONFOSSA-N	437.330	1.102	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2nc[nH]c2[N+](=O)[O-])[C@H]1c1cccnc1	1808371338	LZBUCZURYHYMOE-KCQAQPDRSA-N	436.856	1.286	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)N1CC[C@H](CNC(=O)[C@H](F)Br)[C@@H]1c1cccnc1	1808662266	JTBHOGLDVCVNSJ-RFGFWPKPSA-N	444.305	1.225	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2nc3ncccn3n2)[C@H]1c1cccnc1	1809230123	IPZRGFWPEYDTJW-HRCADAONSA-N	427.896	1.856	50	20	IDGD	
CCc1ccnc(C(=O)N2CCC3(CCCN(C(=O)c4ccc(B(O)O)cc4)C3)CC2)c1	1809966885	MEDBRGJHUWVOEX-UHFFFAOYSA-N	435.333	1.482	50	20	IDGD	
CC(C)N[C@H](C(=O)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1)C(C)C	1809976847	TUUCUPBNXHNLDW-NRFANRHFSA-N	443.397	1.234	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)C(Cl)Cl)[C@H]1c1cccnc1)C(=O)Nc1cccnc1	1810465603	ORWLSMZSFFQKAU-HIFRSBDPSA-N	436.299	1.925	50	20	IDGD	
O=C(c1n[nH]c2c1CS(=O)(=O)C2)N1CCC2(CCCN(C(=O)[C@H](F)Cl)C2)CC1	1810900823	GHYUDVFDIHDXDC-AWEZNQCLSA-N	432.905	1.217	50	20	IDGD	
Cc1cccc(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)c1	1811862393	MGJQLRFOOZBHNC-FYYLOGMGSA-N	443.312	1.703	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@H](CNC(=O)CN2CCCCC2=O)[C@H]1c1cccnc1	1812976341	YIBGRAPNZIBSKF-PGRDOPGGSA-N	446.624	1.951	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2cnn3c2OCCC3)[C@H]1c1cccnc1	1813034174	CWMYTHMVRTXQTB-NJAFHUGGSA-N	447.923	1.634	50	20	IDGD	
C[C@@H](CS(C)(=O)=O)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)C(Cl)Cl)[nH]n1	1815232698	PQMPDXGZDDZECI-ONGXEEELSA-N	425.338	1.886	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)N[C@H]1CCc2nc(NC(=O)[C@@H](F)Cl)sc2C1	1817118224	UXMWWEVHUSQYAH-IINYFYTJSA-N	425.873	1.415	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cocn2)[nH]n1	1818111334	DDVBHYVFJPSYES-UPVZUOOXSA-N	438.448	1.838	50	20	IDGD	
O=C1Cc2cc(C(=O)Nc3cc([C@@H]4CCCCN4C(=O)[C@@H](O)CCl)[nH]n3)ccc2N1	1818979324	BQRVAXPFIPYFOY-HOTGVXAUSA-N	431.880	1.810	50	20	IDGD	
C[Si](C)(C)OCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)Cn1ccncc1=O)CC2	1820169752	XNJFPRQICUSIPI-GFCCVEGCSA-N	435.582	1.164	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1cc([C@H]2CCCCN2C(=O)C2=NN(C)C(=O)CC2)[nH]n1	1822185582	YXLKLHDFUSRKRL-ZWNOBZJWSA-N	439.314	1.793	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@](C)(Cl)CCl)sc2C1	1822863939	UXRBOOGKZFOOHH-GLSBUQGYSA-N	436.365	1.738	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)Cc1ccn(C)n1)CC2	1825642486	QZYZCJVHVZMJAF-UWVGGRQHSA-N	426.340	1.815	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1sc(N)nc1C)CC2	1825998776	JULQGSPFKHORIZ-IUCAKERBSA-N	429.955	1.970	50	20	IDGD	
CCC[C@H](NC(C)=O)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](Cl)COC)CC2	1828131440	BZFJYAGRVUOBEJ-BZPMIXESSA-N	430.958	1.614	50	20	IDGD	
Cc1cc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)CC2)no1	1828925689	PFOFWWCQJMKDTB-IBGZPJMESA-N	440.504	1.529	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccn4ccnc4c3)C2)C1	1830361716	AZWXQXQMCZJVOA-OAQYLSRUSA-N	434.924	1.669	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC([C@H]2CCCCN2C(=O)Cn2nccn2)CC1	1830428008	XDRRZXNKAMAELA-GDBMZVCRSA-N	426.359	1.929	50	20	IDGD	
Cc1nc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)co1	1830537889	RUTRPEYTYLRBMK-SJKOYZFVSA-N	430.299	1.084	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(F)c3)C2)C1	1830543004	GZMIPNYHDVBOLQ-LIRRHRJNSA-N	443.313	1.927	50	20	IDGD	
CC(F)(F)C(C)(C)C(=O)N1CCO[C@]2(COCCN(C(=O)CCBr)C2)C1	1831678401	DPGJAXPLQOOQJB-KRWDZBQOSA-N	441.313	1.909	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)[C@H](C)C3(O)CCC3)CC2)CC1	1833069010	BKYYFMQZFUOPEF-LSDHHAIUSA-N	444.414	1.893	50	20	IDGD	
CC[C@@H](NC)C(=O)NC1CCN(C2CCN(C(=O)[C@H](C)CBr)CC2)CC1	1834790411	FQUQIJUVUHWIQH-RHSMWYFYSA-N	431.419	1.587	50	20	IDGD	
COCc1c[nH]c(C(=O)N2CCOC[C@]3(CN(C(=O)CCBr)CCO3)C2)c1	1834823963	ONTVNOJMTOVGMM-SFHVURJKSA-N	444.326	1.016	50	20	IDGD	
Cc1nnc(CC(=O)NC2CCN(C3CCN(C(=O)[C@@](C)(Cl)CCl)CC3)CC2)o1	1834834786	MTMLCCYMXYCWOW-IBGZPJMESA-N	446.379	1.728	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3ccc4nncn4c3)CC2)CC1	1835585392	MWZXGKQURYCLHY-SFHVURJKSA-N	448.955	1.168	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccccn3)CCO2)C1	1836184774	NKBDXUJCEFRECQ-BEFAXECRSA-N	440.338	1.112	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3ccc([N+](=O)[O-])[nH]3)CC2)CC1	1836197839	MZGIUFDGTLFREI-HNNXBMFYSA-N	441.916	1.362	50	20	IDGD	
O=C(C#CC1(O)CCCCC1)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836717186	MJEXGHKPQWODLX-IBGZPJMESA-N	440.968	1.283	50	20	IDGD	
C[C@@H](Cc1ccncc1)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836718751	CPNBXKBQADVUBI-JXFKEZNVSA-N	437.968	1.859	50	20	IDGD	
C[C@@H](Cn1ccnc1)C(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836720016	GURBXYZPDFPLRV-MAUKXSAKSA-N	426.945	1.118	50	20	IDGD	
O=C(c1cc2sccc2s1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1	1836857178	BYYAJBWQUJMADN-KPZWWZAWSA-N	444.962	1.633	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cc(O)ncn3)CC2)CC1	1836942070	YUGPMAJFGNBQSC-HNNXBMFYSA-N	426.901	1.048	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(F)ccc3F)C2)C1	1837714876	QTECLGYUDFQZQZ-FQEVSTJZSA-N	442.535	1.886	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc([N+](=O)[O-])[nH]3)CCO2)C1	1838827506	RFBBHICPZSTAQW-IAGOWNOFSA-N	449.291	1.229	50	20	IDGD	
COc1ccccc1C(=O)N1CCO[C@]2(COCCN(C(=O)CCBr)C2)C1	1838875364	LQDXPWONHPPBSZ-IBGZPJMESA-N	441.322	1.550	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)c3ccc(OC)cc3)C2)C1	1839141649	OMMGMBREZHNQBL-WFXMLNOXSA-N	440.924	1.202	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(O)ccc3F)C2)C1	1839154769	XKPMNTOSFJKORZ-RTBURBONSA-N	449.306	1.838	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3nccs3)C2)C1	1839963317	HRORBUZBKUJOKV-BLLLJJGKSA-N	432.340	1.387	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccccc3F)C2)C1	1840151676	KGUGOVCTMYRJCG-UZLBHIALSA-N	428.888	1.078	50	20	IDGD	
Cc1nccn1[C@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1	1840492257	JGUIVVKYUCUBBF-OXQOHEQNSA-N	438.601	1.060	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3cc(F)ccc3F)CCO2)C1	1840810875	IGRBJFRCPMGXOW-OXJNMPFZSA-N	430.879	1.981	50	20	IDGD	
O=C(c1cc(Br)c(O)cc1F)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1	1841352479	RQZHKJLVCSUUAP-ZDUSSCGKSA-N	435.677	1.711	50	20	IDGD	
O=C([C@H](O)CCl)N1CC2(CCCN2C(=O)Cc2cccc(Br)c2F)C1	1841426022	PGOULLKDZZSTRP-CYBMUJFWSA-N	433.705	1.934	50	20	IDGD	
CN1CCCC[C@H]1C(=O)N1CC2(CCCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C1	1841924043	PCFBPUFKVUWDRJ-HOTGVXAUSA-N	442.988	1.806	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)[C@H]1CC[C@@H](C)O1)C2	1844692644	TZDCYCWHIMCOGA-FZKQIMNGSA-N	431.445	1.905	50	20	IDGD	
Cc1c(C(=O)N2CC3(CCCN3C(=O)CCC(=O)NN(C)C)C2)nc2ccc(Cl)cn12	1846385629	AWPJDXYHJFDNTP-UHFFFAOYSA-N	446.939	1.486	50	20	IDGD	
CCCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl	1847556963	UQEKNIZKBIQLDO-VGWMRTNUSA-N	431.961	1.871	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](CCO)NC(=O)OC(C)(C)C	1847644496	XNVWNTOYPPGREB-RFGFWPKPSA-N	448.358	1.247	50	20	IDGD	
CN(CC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)COC(C)(C)C)NC(=O)NCc1ccccc1	1848028039	HNMKISZHHNPSIL-OALUTQOASA-N	445.564	1.350	50	20	IDGD	
CNc1ccc(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1[N+](=O)[O-]	15737581	QDGXDIJEDRUBFN-UHFFFAOYSA-N	426.477	1.610	50	20	IDGD	
COc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NNC(=O)c2cc(-c3ccccc3)n[nH]2)cc1	17519595	DOGVFCUSYJFDKR-ZDUSSCGKSA-N	443.485	1.213	50	20	IDGD	
COc1cc(C=NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc(OC)c1O	254576824	DHSDFCAPMAWHFI-UHFFFAOYSA-N	449.485	1.194	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)Cc2c[nH]c3cc(F)ccc23)cc1OC	725942990	ANVGYKPXUPNAPL-UHFFFAOYSA-N	429.404	1.871	50	20	IDGD	
Cc1noc(CCCNC(=O)NNC(=O)[C@H](C)Oc2cccc(Br)c2)n1	727473270	JIMMMSDRPMPMQW-JTQLQIEISA-N	426.271	1.871	50	20	IDGD	
COc1cccc(CN(CC(=O)NNC(=O)Cc2nc(C)cs2)C2CCC(O)CC2)c1	727831154	KRVRYGWRPIKPJB-UHFFFAOYSA-N	446.573	1.956	50	20	IDGD	
CN(CC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)C(=O)OC(C)(C)C	727861185	ANLYHXGGVATPRM-UHFFFAOYSA-N	440.522	1.099	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)[C@H](C)NC(=O)c3n[nH]c4ccccc34)n[nH]2)cc1	728208232	KYNCRHXTXXZBKK-ZDUSSCGKSA-N	431.456	1.841	50	20	IDGD	
CC[C@H](C)C(=O)NNS(=O)(=O)c1cc(S(=O)(=O)N(CC)CC)ccc1Cl	728260910	WFONQEJXNUXSLW-NSHDSACASA-N	425.960	1.726	50	20	IDGD	
CNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cc(F)ccc2Br)cc1	728549620	LUKGAIQOGHPSPD-UHFFFAOYSA-N	430.255	1.571	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)[C@@H]2CCCCN2C(=O)OC(C)(C)C)n1	728730645	DEBDVUZXOLNVSV-ZDUSSCGKSA-N	440.522	1.474	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCCCC2)cc1)NNC(=O)Cc1cccnc1	728851939	GNMATRLSMGEVJB-UHFFFAOYSA-N	430.530	1.579	50	20	IDGD	
CCOC(=O)C1=NN(c2ccccc2)[C@H](C(=O)NNC(=O)COc2ccccc2F)C1	729508807	BBDCMGMNZCSYRF-KRWDZBQOSA-N	428.420	1.550	50	20	IDGD	
CC(=O)Nc1cccc(OCCNC(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)c1	729613505	DAAMCTXHKONDCM-UHFFFAOYSA-N	427.461	1.610	50	20	IDGD	
Cc1cccc(COc2cccc(CC(=O)NNC(=O)N[C@@H]3CCS(=O)(=O)C3)c2)c1	729969201	WFYKXIPWLYIHPV-GOSISDBHSA-N	431.514	1.634	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCCCN1C(=O)CCC1=O	730021495	LUBCHKGUCJNNEH-LLVKDONJSA-N	441.282	1.086	50	20	IDGD	
CC(=NNC(=O)c1cccc2ncccc12)c1ccc(S(=O)(=O)NCC(=O)O)cc1	730145817	QVOVXKRVELVEGJ-UHFFFAOYSA-N	426.454	1.752	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)NCc1cccc(C(=O)NCc2ccco2)c1	730903092	UNINIOMDVIVKSY-UHFFFAOYSA-N	438.440	1.825	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)CSc1nnc(-c2cccnc2)n1-c1ccccc1	732086432	CTPFPPFJYIOCAA-UHFFFAOYSA-N	434.485	1.914	50	20	IDGD	
Cn1c(NNC(=O)[C@H]2CCCN(S(=O)(=O)c3ccccc3)C2)nc2ccccc2c1=O	733260406	DNTHIEWUNZBWIH-HNNXBMFYSA-N	441.513	1.478	50	20	IDGD	
C[C@](O)(CNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)c1ccc(F)cc1F	734010197	NWIGQCMIJJKLTN-FQEVSTJZSA-N	434.447	1.209	50	20	IDGD	
CCOC(=O)c1cc(S(=O)(=O)NNC(=O)CCc2ccco2)cc([N+](=O)[O-])c1C	734806910	AAMDUNRGANWSOJ-UHFFFAOYSA-N	425.419	1.615	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(Cl)c(C(=O)NNc2ccnc(N(C)C)n2)c1	740108360	XICXBHZFEDUARM-UHFFFAOYSA-N	426.930	1.983	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)CC[S@@](=O)c1ccc2c(c1)OCCO2	740749410	XXXJRPYBBQLFJC-GNDSEDMPSA-N	436.461	1.710	50	20	IDGD	
COc1ccc(S(=O)(=O)CCC(=O)NNC(=O)Cn2ccc3ccccc32)cc1OC	740784562	KJKLILQJEPQGEL-UHFFFAOYSA-N	445.497	1.670	50	20	IDGD	
CC(C)c1ccc(N2CC[C@@H](C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)C2=O)cc1	741660600	XMPSVJVRYVDKKK-IBGZPJMESA-N	433.472	1.600	50	20	IDGD	
O=C(NNC(=O)C12CC3CC(CC(C3)C1)C2)[C@H]1CCCCN1C(=O)c1ccc(O)nn1	741742390	GOZQEXGHQJUDDR-DCJJRUGTSA-N	427.505	1.541	50	20	IDGD	
O=C(Cc1cc(O)nc(O)n1)NN=C1C(=O)Nc2c(Cl)cc(Br)cc21	743447830	PEQHVXZDGKKBOV-UHFFFAOYSA-N	426.614	1.319	50	20	IDGD	
CSCC[C@@H](NC(=O)c1ccc2ccccc2n1)C(=O)NNc1ncnc2[nH]cnc12	743473045	JZHHLYMOTZYFCX-OAHLLOKOSA-N	436.501	1.896	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NCc2ccccc2Cn2cncn2)cc1	743534328	RQXPUTAUZAZNAP-UHFFFAOYSA-N	443.489	1.266	50	20	IDGD	
Cc1ccc([C@@]2(C)NC(=O)N(CC(=O)NNC(=O)Nc3ccc(N(C)C)cc3)C2=O)cc1	743827014	VYBLYFMKRFDYEN-JOCHJYFZSA-N	438.488	1.681	50	20	IDGD	
COc1ccc(OC)c(CN2CCN(CC(=O)NNC(=O)c3ccc(C#N)cc3)CC2)c1	744383434	OQCQPMHDFBIRLG-UHFFFAOYSA-N	437.500	1.154	50	20	IDGD	
CCOC(=O)N1CCC[C@H](C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)C1	744620588	LFBSIXDIUIJNFL-HNNXBMFYSA-N	440.522	1.019	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)[C@H]2CC(=O)N(c3ccc4c(c3)CCC4)C2)cc1	744683083	QYPLJEGAVXSKST-IBGZPJMESA-N	446.463	1.404	50	20	IDGD	
Cc1nc2c(c(C)nn2C)c(C)c1CC(=O)OCC(=O)NNC(=O)c1cccc(C#N)c1	744785933	DPSNMCBIUAETIY-UHFFFAOYSA-N	434.456	1.312	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)[C@@H]2CC(=O)N(c3ccc(Cl)cc3)C2)cc1	744820462	HWSJYMLTBXQUQW-OAHLLOKOSA-N	440.843	1.569	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3cc(F)c(F)cc3F)cc2)CC1	747592930	YNBGCPNXAIZCQF-UHFFFAOYSA-N	428.436	1.797	50	20	IDGD	
O=C(C[C@@H]1C=CS(=O)(=O)C1)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1	747786972	GMLVGCYJEHMZJL-RXVVDRJESA-N	439.537	1.709	50	20	IDGD	
NC(=O)CS(=O)(=O)c1ccc(C(=O)NNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1	748026753	LHLUMZWXRVSYHE-UHFFFAOYSA-N	446.363	1.630	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)[C@H](C(C)C)N2C(=O)c3ccccc3C2=O)cc1	748099632	OKQMIBZVXXZQBG-IBGZPJMESA-N	437.452	1.620	50	20	IDGD	
COc1cc(OC)cc(N2CC[C@@H](NC(=O)NNC(=O)Cc3cn4ccccc4n3)C2)c1	748663038	ZFMVJWBICLSXSG-OAHLLOKOSA-N	438.488	1.503	50	20	IDGD	
O=C(Cc1ccc(Cl)cc1)NNC(=O)[C@@H]1CCCN1S(=O)(=O)c1cccs1	749162084	WDZKYMDALRVOGA-AWEZNQCLSA-N	427.935	1.945	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)c2cn(C3CCN(C(=O)OC(C)(C)C)CC3)nn2)n1	751293051	RINUZUZADUEQRE-UHFFFAOYSA-N	446.512	1.125	50	20	IDGD	
CC(C)[C@H]1CC[C@H](C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)CC1	752998560	NVBDYVDHAZMNJG-QAQDUYKDSA-N	437.562	1.931	50	20	IDGD	
CC[C@H](NC(=O)NNC(=O)Nc1cc(Cl)c(OC)cc1OC)C(=O)N1CCOCC1	753061805	ZYIMEOHTJBRNHE-LBPRGKRZSA-N	443.888	1.330	50	20	IDGD	
COC(=O)c1cccc([C@H](NNC(=O)C2CCN(c3ncccn3)CC2)C(=O)OC)c1	754003867	RAJWHOZETZMVEC-KRWDZBQOSA-N	427.461	1.015	50	20	IDGD	
O=C(NNC(=O)c1cccc(I)c1O)c1ccc2c(c1)OCO2	754832944	DPRGIFCIPAIMHA-UHFFFAOYSA-N	426.166	1.800	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)c2cccc3ncccc23)n([C@@H]2CCS(=O)(=O)C2)n1	755528955	AHXICOCLBYLTAU-CYBMUJFWSA-N	428.474	1.566	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)Nc1cc(C(F)(F)F)ccc1-n1cccn1	755558253	PRPQPJDSEPMNBI-JTQLQIEISA-N	431.396	1.479	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@@H]2C)ccc1NC(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1	756246239	TWBJTCBGEXPSJK-HOCLYGCPSA-N	436.534	1.597	50	20	IDGD	
COc1cc(F)c(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1OC	756457198	PLAAVYUCQOEGBS-UHFFFAOYSA-N	440.453	1.560	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)Nc2cccc(S(=O)(=O)NC3CC3)c2C)c1O	756707807	ZAMPSLRMADSYEJ-UHFFFAOYSA-N	434.474	1.616	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)Nc1cccc(N2CCCNC2=O)c1	756789890	INBKNYPSNRMDQU-UHFFFAOYSA-N	428.405	1.746	50	20	IDGD	
Cn1cc(-c2nc3ccccn3c2NC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cn1	757663146	JJNOWWVVNRLFAT-INIZCTEOSA-N	433.428	1.728	50	20	IDGD	
COc1ncc(NC(=O)NNC(=O)c2ccc(F)cc2Br)cc1C(N)=O	757693264	VEHGRFRGRXLTPX-UHFFFAOYSA-N	426.202	1.557	50	20	IDGD	
CNC(=O)Cn1cc(NC(=O)NNC(=O)c2cc(-c3ccncc3)nc3ccccc23)cn1	757864976	DFDFFRBCFMNRQD-UHFFFAOYSA-N	444.455	1.706	50	20	IDGD	
COc1ccc(OC)c(CCCNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)c1	758648983	BUXDCGKQVONGMN-UHFFFAOYSA-N	449.533	1.574	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N(C)CC2(O)CCC2)cc1	760076645	KFLBMVIHZOIHQE-ATVHPVEESA-N	437.500	1.714	50	20	IDGD	
COc1c(C)c2c(c(O)c1C/C=C(\C)CCC(=O)NNC(=O)C(=O)NC1CC1)C(=O)OC2	760786836	FECJEXNVZPXTEM-NYYWCZLTSA-N	445.472	1.075	50	20	IDGD	
COc1cc(F)cc(NNC(=O)c2cc(S(=O)(=O)N3CCOCC3)ccc2F)c1	761581996	ZWYOVSYJUYJVCL-UHFFFAOYSA-N	427.429	1.751	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)c2cc(S(=O)(=O)N3CCC[C@@H](C)C3)cn2C)n1	762907030	BWORVWBCYFHNIL-OAHLLOKOSA-N	449.581	1.839	50	20	IDGD	
CCCCN(C)S(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2)cc1	763420560	RKLRURHBENCKBP-UHFFFAOYSA-N	432.502	1.507	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)C(=O)N1CCc2c(F)cccc21	763529448	BIQKJOVUELLZNU-UHFFFAOYSA-N	439.491	1.075	50	20	IDGD	
COc1c(NC(=O)C(=O)NNC(=O)COc2ccc(C(C)(C)C)cc2)cccc1C(N)=O	763593517	FETGNISETXTGPG-UHFFFAOYSA-N	442.472	1.257	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)C(=O)Nc2ccn(CCN(C)C)n2)c1	763594139	GYTYDRWLYVNTIV-UHFFFAOYSA-N	430.509	1.041	50	20	IDGD	
CCN1CCN(c2ccc(NC(=O)C(=O)NNC(=O)c3cc4c(s3)CCC4)cc2)CC1	763782215	QOTBBJTUTQGVKP-UHFFFAOYSA-N	441.557	1.778	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2ccc(N(C)C)c(C)c2)c2ccccc2c1=O	763785126	FYRPFRHRUZMYRN-UHFFFAOYSA-N	436.472	1.191	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)C(=O)Nc1ccn(Cc2ccccc2)n1	763802686	FQFPPBSQUUBKPE-UHFFFAOYSA-N	438.400	1.005	50	20	IDGD	
CCOC(=O)N(C)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C)cc2)cc1	763809822	QHMBWNHBUCPREO-UHFFFAOYSA-N	428.445	1.753	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)c1csc(COc2ccc(F)cc2)n1	763824243	MHIVSYKRCLNTPB-UHFFFAOYSA-N	429.433	1.447	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)N(C)C)cc2)c1C	763841190	OKZQNHAGUDKHGS-HNNXBMFYSA-N	426.473	1.559	50	20	IDGD	
CC(C)n1cnnc1-c1ccccc1NC(=O)C(=O)NNC(=O)COc1ccc(F)cc1	763843017	LHZSCSWFZVSPIL-UHFFFAOYSA-N	440.435	1.830	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cc(C#N)ccc2OCC)cc1	763859480	CDPTWHKCWFVJGY-AWEZNQCLSA-N	440.456	1.909	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccc(N2CCCC2=O)cc1	763865926	SXMIDMDZJNSNHE-ZDUSSCGKSA-N	428.420	1.506	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccccc1C(=O)NC(C)(C)C	763873438	SXAUBDIBKJGPDV-CYBMUJFWSA-N	444.463	1.907	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccc(OC(F)F)c3ncccc23)n1	763893242	RBQZBSKCTMOPTK-UHFFFAOYSA-N	432.387	1.436	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc3c2oc(=O)n3C)cc1OC	763912418	ZQEIVPMBXRQPSE-UHFFFAOYSA-N	442.428	1.329	50	20	IDGD	
Cc1ccc(-c2ncco2)cc1NC(=O)C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	763917284	SWDJUORWRCGXDK-UHFFFAOYSA-N	432.400	1.025	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1cc(N2CCCC2=O)ccc1F	764004165	LYRRQFBIMZELJP-UHFFFAOYSA-N	442.403	1.123	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)Nc1ccc(-c2ncon2)cc1	764004324	CVLXNFGARLPKLK-UHFFFAOYSA-N	433.222	1.237	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1ccc(-c2n[nH]c(C3CC3)n2)cc1	764004634	ZUHDAPCAHPOPOA-UHFFFAOYSA-N	448.439	1.520	50	20	IDGD	
COC(=O)c1csc(NC(=O)C(=O)NNC(=O)c2cc(Br)cn2C)c1C	764004858	PFKPKGBCSFKQQV-UHFFFAOYSA-N	443.279	1.344	50	20	IDGD	
CNC(=O)CCOc1ccc(NC(=O)C(=O)NNC(=O)Cc2cccc3ccccc23)cc1	764037522	YOAHCFKGECXEJV-UHFFFAOYSA-N	448.479	1.683	50	20	IDGD	
CCc1noc(-c2ccc(C)c(NC(=O)C(=O)NNC(=O)Cc3ccccc3OC)c2)n1	764138320	BSHSGWAVAFONTA-UHFFFAOYSA-N	437.456	1.945	50	20	IDGD	
O=C(CCc1ccccc1)NNC(=O)C(=O)Nc1cccc(Cl)c1N1CCOCC1	764184686	CVGLWXIUJJKFLE-UHFFFAOYSA-N	430.892	1.895	50	20	IDGD	
CNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2cc(OC)ccc2Br)c1	764233330	XGPBHMPSYBADRV-UHFFFAOYSA-N	449.261	1.217	50	20	IDGD	
O=C(NNC(=O)c1cccc(OC(F)F)c1)C(=O)Nc1cccc(C(=O)NC2CC2)c1	764250796	NKEPGIBXXLJYHV-UHFFFAOYSA-N	432.383	1.580	50	20	IDGD	
C[C@@H](c1cccc(NC(=O)C(=O)NNC(=O)CCc2ccccc2O)c1)N1CCOCC1	764277304	BIIVLXTTWRGBOH-INIZCTEOSA-N	440.500	1.504	50	20	IDGD	
O=C(CCCc1cccs1)NNC(=O)C(=O)Nc1cnn(CC(=O)NC2CCCC2)c1	764340605	FYHWPOLYJFAPNC-UHFFFAOYSA-N	446.533	1.112	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1)C(=O)Nc1cnn(-c2ccccn2)c1	764389123	ZONNRZLQOOVWEK-UHFFFAOYSA-N	434.391	1.196	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1ccccc1Nc1c(F)cccc1F	764398038	BZUBBVKZOLMFBQ-LBPRGKRZSA-N	436.415	1.846	50	20	IDGD	
CCN1CCC[C@@H]1CNC(=S)NNC(=O)CN1CCN(Cc2ccc(C)cc2)CC1	764518786	HZEABWZAZCIACH-HXUWFJFHSA-N	432.638	1.092	50	20	IDGD	
CCN(CC)c1ccc(S(=O)(=O)N2CCOCC2)cc1NC(=O)NNC(=O)C1CC1	764595178	BZKVZJXCGZCSMH-UHFFFAOYSA-N	439.538	1.116	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2cc(S(=O)(=O)NC3CC3)c(Cl)cc2Cl)n[nH]1	765588176	SPYCKMPPDJJYFW-UHFFFAOYSA-N	432.289	1.540	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)NNC(=O)c2cc(-c3ccccc3OC)[nH]n2)ccc1F	765595060	DOGRQDKSGYRWLD-UHFFFAOYSA-N	447.448	1.207	50	20	IDGD	
O=C(CCc1cccc([N+](=O)[O-])c1)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765738874	PQKUYSUGGIFBKR-UHFFFAOYSA-N	439.472	1.133	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)c1	765758597	OFGJWGBLWCTJAU-UHFFFAOYSA-N	446.935	1.936	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1ccc(N2CCC(N(C)C)CC2)c(F)c1	766261271	RHFJNTVHEKXJHD-UHFFFAOYSA-N	431.472	1.237	50	20	IDGD	
COC(=O)c1nccc2c(S(=O)(=O)NNC(=O)NCCc3cccs3)cccc12	766318121	HLEREPKUNKYOTO-UHFFFAOYSA-N	434.499	1.818	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)N2CCC(C(=O)N3CC=C(C#N)CC3)CC2)cc1	767157991	QVUJFWSIZLLJRC-UHFFFAOYSA-N	431.514	1.946	50	20	IDGD	
O=C(CCC(=O)N1CCN(c2ccccn2)CC1)NNC(=O)c1cc(-c2ccccc2)[nH]n1	767822601	DZTPLSNHXRPNHU-UHFFFAOYSA-N	447.499	1.362	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)[C@@H]1CN(C(=O)OC(C)(C)C)CCO1	768629296	QEUZFXAPSYRKOD-ZDUSSCGKSA-N	429.495	1.178	50	20	IDGD	
C[C@@]1(c2ccc(F)c(Cl)c2)NC(=O)N(CC(=O)NNC(=O)Cc2cccnc2)C1=O	769925063	XHXGSPQGPQOBBP-IBGZPJMESA-N	433.827	1.031	50	20	IDGD	
Cn1cc(CCNC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c2ccc(F)cc21	770522942	SWJYINUQGBCZFS-UHFFFAOYSA-N	432.477	1.908	50	20	IDGD	
O=C(NNc1ccc(Br)c(F)c1)C(=O)Nc1ccc2c(c1)S(=O)(=O)CC2	770810354	LKUULRAHGPNDIQ-UHFFFAOYSA-N	442.266	2.000	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)/C(=C/c3ccco3)n3nnnc3-c3ccccc3)nc21	770981722	BPHQLRMTEFKJKM-GDNBJRDFSA-N	444.415	1.457	50	20	IDGD	
O=C(NCC1CC1)NNC(=O)c1c[nH]c2ccc(I)cc2c1=O	772622826	HGRMYAWPVQOOMK-UHFFFAOYSA-N	426.214	1.487	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccc(Br)cn1	773529501	RPKYKQZPLMLBTL-VIFPVBQESA-N	425.214	1.537	50	20	IDGD	
Cc1nc(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)ccc1Br	773529538	RSXTUXVVBYGWCD-UHFFFAOYSA-N	425.214	1.457	50	20	IDGD	
CC(C)c1nccnc1NNC(=O)C(=O)Nc1ccc(C(=O)N2CCN(C)CC2)cc1	774000380	SXKLMUAAZZUDDZ-UHFFFAOYSA-N	425.493	1.069	50	20	IDGD	
CC(C)N1C(=O)C[C@@H](C(=O)NNC(=O)N2CCOCC2)[C@@H]1c1ccc(Cl)c(F)c1	776704630	DIKGLSGPGILRMD-DYVFJYSZSA-N	426.876	1.850	50	20	IDGD	
N#CCc1ccccc1CC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	776966827	WOZCNKYSQRNOID-UHFFFAOYSA-N	426.498	1.541	50	20	IDGD	
COCCO[C@H]1COCC[C@@H]1NC(=O)NNC(=O)c1ccc(-n2c(C)ccc2C)cc1	777278975	LSDYIZLJOFRLOL-PMACEKPBSA-N	430.505	1.859	50	20	IDGD	
COc1cc(OC)c(S(=O)(=O)NNC(=O)c2nnc(-c3ccccc3)o2)c(OC)c1	777614801	RFDJCLJJTDNVAD-UHFFFAOYSA-N	434.430	1.386	50	20	IDGD	
COC(=O)c1ccccc1NNC(=O)[C@@H]1CC(=O)N(c2cc(OC)c(OC)c(OC)c2)C1	777773014	RNCIVHULZPXEAF-CYBMUJFWSA-N	443.456	1.995	50	20	IDGD	
COc1cccc(-n2ccnc2SCC(=O)NNC(=O)CNC(=O)OC(C)(C)C)c1	778440220	CAEONXOGECDRMA-UHFFFAOYSA-N	435.506	1.645	50	20	IDGD	
COc1cccc([C@H]2[C@H](C(=O)NNC(=O)CNC(=O)OC(C)(C)C)CC(=O)N2C2CC2)c1	778442784	FAQRTDRLWRRMLD-APWZRJJASA-N	446.504	1.419	50	20	IDGD	
CC(C)Cn1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)cn1	781578837	OKZIOLIQERCOOS-UHFFFAOYSA-N	433.534	1.789	50	20	IDGD	
COc1ccccc1[C@](N)(C(=O)NNC(=O)[C@H]1COc2ccccc2O1)C(F)(F)F	782161552	BHRZPCGYGIFIGS-QAPCUYQASA-N	425.363	1.399	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1cccc(Oc2ccncc2)c1	784003561	IONSAEWZBSCLEU-UHFFFAOYSA-N	439.453	1.451	50	20	IDGD	
CN(C1CC1)S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccc(F)c(F)c2F)cc1	784811180	OXDZEBIYPXRFSQ-UHFFFAOYSA-N	442.419	1.969	50	20	IDGD	
O=C(NNc1ncccc1Cl)C(=O)Nc1ccccc1S(=O)(=O)N1CCCCC1	784820953	DWWQIUNTVJGSSZ-UHFFFAOYSA-N	437.909	1.991	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2cccnc2Cl)cc1	784843712	RAITXQHLIWNSLL-UHFFFAOYSA-N	425.898	1.847	50	20	IDGD	
Cn1ccnc(NNC(=O)C(=O)Nc2cc(C(C)(C)C)nn2-c2cccc(Cl)c2)c1=O	785089646	DVRYRJGORYMWOT-UHFFFAOYSA-N	443.895	1.999	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2cccc(OC[C@@H]3CCCO3)c2)n1	785226043	DIRHWATVFWZLGB-KRWDZBQOSA-N	428.493	1.962	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2cc(C(C)C)nn2-c2ncccn2)n1	785227393	PYWXZTDLVAMQLZ-UHFFFAOYSA-N	438.496	1.504	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNc2c(OC)cccc2S(C)(=O)=O)cc1C	785339024	QKALDEVXYNYRDP-UHFFFAOYSA-N	435.458	1.276	50	20	IDGD	
CCn1c(S)nc2cc(C(=O)NNC(=O)c3cc(Br)c[nH]3)ccc2c1=O	787992478	BWFIFHOIQRNVQH-UHFFFAOYSA-N	436.291	1.871	50	20	IDGD	
CCOc1ccccc1[C@@](N)(C(=O)NNc1nc(O)c2cnn(C)c2n1)C(F)(F)F	788000303	QSTVTJDJCYFNKF-MRXNPFEDSA-N	425.371	1.327	50	20	IDGD	
CN1CCN(C(=O)NNC(=O)c2ccc(S(=O)(=O)Nc3ccc(F)cc3)cc2)CC1	788165429	BUOMJZIEXKYURS-UHFFFAOYSA-N	435.481	1.228	50	20	IDGD	
COc1cccc([C@H]2[C@H](C(=O)NNc3ccc(-n4ccnc4)nn3)CC(=O)N2C2CC2)c1	788178351	NMDSXBIUUKPGPP-UTKZUKDTSA-N	433.472	1.866	50	20	IDGD	
CC1=C(C(=O)NNC(=O)[C@@H](C)Oc2cccc(Br)c2)[C@H](C)n2ncnc2N1C	788266587	XYPNCJXVHPKNEO-NWDGAFQWSA-N	449.309	1.940	50	20	IDGD	
CS(=O)(=O)[C@@H]1CCCC(=NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)C1	788407880	GWQZOCODXUDRLN-MRXNPFEDSA-N	427.548	1.544	50	20	IDGD	
C[C@@H](C=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O)c1ccc(C(F)(F)F)cc1	788974941	JAAJLNWIGOGDQB-JTQLQIEISA-N	429.424	1.496	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)C(=O)Nc1nc2c(s1)CCCCCC2	789741017	NFZIZVARMSGJKI-UHFFFAOYSA-N	440.489	1.178	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)cnn1-c1ccccc1	789811137	VIFFMRWYQAWVLJ-ICSRJNTNSA-N	433.468	1.839	50	20	IDGD	
CC(=O)N1CCc2ccc(S(=O)(=O)NNC(=O)NCCc3cccs3)cc2CC1	790053113	AVZKIUNUVKBAIM-UHFFFAOYSA-N	436.559	1.430	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)[C@H]1CCN(CC(F)(F)F)C1	791446824	CBMJSMSUTWLMDZ-INIZCTEOSA-N	427.471	1.230	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1ncccc1Br	792809175	LRBGRQGBBBNKIU-UHFFFAOYSA-N	426.296	1.520	50	20	IDGD	
CN(C)N(C(=O)c1cc([C@@H]2CCN(C(=O)OC(C)(C)C)C2)[nH]n1)[C@@H]1CCS(=O)(=O)C1	792848317	FOGSARDXCKSWPS-ZIAGYGMSSA-N	441.554	1.240	50	20	IDGD	
Cc1ccn(-c2ccc(NC(=O)C(=O)NNC(=O)COc3ccc(Cl)cc3)cc2)n1	793022804	CPRDNTMOABCHFL-UHFFFAOYSA-N	427.848	1.999	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)N2CCC[C@H](CN3CCN(c4ccccn4)CC3)C2)n1	793232520	XAZKWZFXMMEBRC-LJQANCHMSA-N	437.548	1.674	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)c(Br)c1	794588500	ASIBEWWIVPPKFD-UHFFFAOYSA-N	446.235	1.695	50	20	IDGD	
Cc1c(Cl)cc(S(=O)(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)cc1C(=O)O	794870619	WNMLIDVDFSMSLN-UHFFFAOYSA-N	449.913	1.961	50	20	IDGD	
COC(=O)N(C)N=Cc1c(Sc2nnnn2-c2ccccc2)nc2ccccn2c1=O	794959756	QQJHPWAOXCRVMG-UHFFFAOYSA-N	436.457	1.854	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2cc(C)nn2-c2ccc(C(F)(F)F)cn2)n1	797370649	JDVRFVUOOABNSF-UHFFFAOYSA-N	447.377	1.698	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)Nc2ccc(S(=O)(=O)N3C[C@@H](C)O[C@H](C)C3)cc2)n1	797607832	BWYORIPTIFLETE-HUUCEWRRSA-N	447.517	1.654	50	20	IDGD	
COC(=O)[C@H]1CC[C@H](C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)CC1	797949455	SWUXKOBBYXVHDW-WKILWMFISA-N	438.550	1.045	50	20	IDGD	
O=C(CN1C(=O)c2cccc(Cl)c2S1(=O)=O)NNC(=O)c1ccc(Cl)cc1	799318496	GZFSMBXFCYZEMH-UHFFFAOYSA-N	428.253	1.599	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2c(O)cnc3ccc(Cl)cc23)c1	801601690	RPESMKPICUXEIC-UHFFFAOYSA-N	448.888	1.919	50	20	IDGD	
C[C@H](CCNS(=O)(=O)c1ccccc1)NC(=O)NNC(=O)COc1ccccc1F	801737603	HCTUBHIQSLPQDI-CQSZACIVSA-N	438.481	1.292	50	20	IDGD	
Cn1cnc2c(C(=O)NNC(=O)c3cccc(S(=O)(=O)N4CCCCC4)c3)ccnc21	805154511	NGZUJBXSWVKPOA-UHFFFAOYSA-N	442.501	1.218	50	20	IDGD	
COc1ccc(-n2c(C)cc(/C=C(\C#N)C(=O)OCCn3cc(C(N)=O)nn3)c2C)cc1	805944156	GXDNNPHFRNOTNZ-GZTJUZNOSA-N	434.456	1.944	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)C3(c4ccccc4)CC(=O)C3)CC2)cc1	810594206	XMRGUGBDAADVGU-UHFFFAOYSA-N	434.540	1.561	50	20	IDGD	
Cc1cc(NC(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)n(C2CCN(C)CC2)n1	812949509	BKOMPAMKMDYCSF-UHFFFAOYSA-N	435.554	1.857	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)N[C@@H]1CCN(C(=O)OC(C)(C)C)C2(CCC2)C1	813793831	BCHWRWDSWSRIEY-LSDHHAIUSA-N	428.530	1.691	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)cc(OC)c1C	815569925	LSMVCPBXEBGMFS-UHFFFAOYSA-N	429.458	1.864	50	20	IDGD	
C[C@](O)(C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1)c1ccc(Cl)cc1	815826855	CYBQMVZUWISPTL-JOCHJYFZSA-N	444.919	1.153	50	20	IDGD	
CCS(=O)(=O)N1CCC[C@H](C(=O)NNc2cc(C(=O)OC)ccc2Br)C1	818756951	MTVDRUDFHJCDBG-LBPRGKRZSA-N	448.339	1.741	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)CCc2c(C)nc(O)nc2O)c1	818763987	URAXTHRECHJHIY-UHFFFAOYSA-N	425.239	1.821	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CC(=O)N(C2CC2)C1)c1nc(-c2ccccc2)n(-c2ccccc2)n1	828952785	PSGSZHLPXIGJQY-MRXNPFEDSA-N	430.468	1.706	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)c2cc(S(=O)(=O)N(C)C)ccc2F)c1C	911584334	TXYTWVQUVTXTHG-CQSZACIVSA-N	437.493	1.921	50	20	IDGD	
CNC(=O)CN1CCC(NC(=O)/C(C#N)=C\c2cc(C)n(C[C@@H]3CCCO3)c2C)CC1	914780046	BFGWYYKNGWDPDB-JCAJYURWSA-N	427.549	1.518	50	20	IDGD	
O=C(NNC(=O)c1ccccc1F)c1cccc(C(=O)NNC(=O)c2ccccc2F)n1	915060180	LQCNMCOCCWJHMS-UHFFFAOYSA-N	439.378	1.509	50	20	IDGD	
C[C@@H]1C[C@H]1C(=O)Nc1cccc(C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c1	915408137	KRJKBFRHZFBUCO-SJKOYZFVSA-N	440.412	1.807	50	20	IDGD	
CC(C)OCCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	915887906	CMGGAATZKNSDCC-UHFFFAOYSA-N	448.545	1.924	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCc2cccc(NC(C)=O)c2)nc1	916373800	VBBWBDQHGWUBFX-UHFFFAOYSA-N	434.522	1.897	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CC(=O)N(C2CC2)C1)c1nn(Cc2ccccc2)c(=O)c2ccccc12	916834059	SHOVDKSJNYSCHK-MRXNPFEDSA-N	445.479	1.217	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)c3ccc(CCNS(C)(=O)=O)s3)n[nH]2)cc1	917177980	BSJHUFZTDLNPBS-UHFFFAOYSA-N	447.542	1.613	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)c1ccc2c(c1)S(=O)(=O)N(CC)C2=O	917515760	JIYQVXVWIWIKKT-UHFFFAOYSA-N	447.469	1.090	50	20	IDGD	
C[C@@H]1CN(c2ccc(CNC(=O)NN[C@@]3(C)CCS(=O)(=O)C3)cc2F)C[C@@H](C)O1	918219033	CACYKQBPVJITGK-LPMFXHHGSA-N	428.530	1.320	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCCN1C(=O)c1ccco1)c1csc(N2CCOCC2)n1	918420176	FSMZVVARESCNQR-AWEZNQCLSA-N	433.490	1.029	50	20	IDGD	
NC(=O)c1ncn2c(C(=O)NNC(=O)c3cc(Cl)ccc3O)cc(-c3ccco3)nc12	919743322	DTBLQDZZRKPLBZ-UHFFFAOYSA-N	440.803	1.522	50	20	IDGD	
Cc1noc(C)c1CSc1ccccc1C(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1	919889794	UJNAUOWDKLDNAE-ZDUSSCGKSA-N	438.531	1.715	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)Nc3ccc(CN4C(=O)CNC4=O)cc3)n[nH]2)cc1	920936443	VNOBJFMAVRYVHJ-UHFFFAOYSA-N	447.455	1.903	50	20	IDGD	
CCCNC(=O)NNC(=O)c1cc(S(=O)(=O)NC(C)(C)C)ccc1Br	921042096	ZFGDTZYNCSKFAP-UHFFFAOYSA-N	435.344	1.880	50	20	IDGD	
COc1ccc(C=NNC(=O)COc2ccc(Br)cc2)cc1OCC(N)=O	1115813028	JMRLPPILNAZLKF-UHFFFAOYSA-N	436.262	1.851	50	20	IDGD	
CS(=O)(=O)Cc1nc2ccccc2n1CC(=O)NNc1cncc(Br)c1	1253717552	AVEZWOAUBUHPHJ-UHFFFAOYSA-N	438.307	1.882	50	20	IDGD	
COC(=O)c1ccccc1S(=O)(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1	1318612337	MAJGZHKVGHFLCK-UHFFFAOYSA-N	441.506	1.430	50	20	IDGD	
COC(=O)c1sc(S(=O)(=O)NNC(=O)c2n[nH]c3c2CCCC3)c(C)c1Cl	1320989107	IEKWNNXXAUUTBI-UHFFFAOYSA-N	432.911	1.722	50	20	IDGD	
CN(C)NC(=O)Nc1cccc(NC(=O)Cn2c(CS(C)(=O)=O)nc3ccccc32)c1	1321003699	NOPSDHXMDXMHLE-UHFFFAOYSA-N	444.517	1.818	50	20	IDGD	
COCCn1nc(C(=O)NNc2cc(C(F)(F)F)nc(-c3cccnc3)n2)ccc1=O	1322882453	HAWURJAJDKKGGU-UHFFFAOYSA-N	435.366	1.517	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@H](C)C(=O)NNC(=O)[C@H]1CCCCN1S(C)(=O)=O	1337223245	RRFBRPIUGFTECQ-UKRRQHHQSA-N	431.942	1.686	50	20	IDGD	
C[C@@H](NC(=O)c1ccccc1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Cl)C1	1778027237	GSLCYPAQFKYBBN-VGKBRBPRSA-N	439.915	1.853	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](OC(C)=O)C(C)C)C2)C1	1778801027	XZZYMFGJAMYWEL-HDMKZQKVSA-N	433.343	1.578	50	20	IDGD	
O=C(CS[C@@H]1CCCCO1)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1779083436	SYUXBZXWDHHORR-YCPHGPKFSA-N	439.347	1.767	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C=N/N2CCCCC2)C1	1779363882	MWPIUWMPYDMHRP-DLZNAHKKSA-N	443.386	1.755	50	20	IDGD	
CCn1nc(C(C)C)cc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2	1780219820	DBTHGKBSVQRWLO-WAOWUJCRSA-N	440.972	1.754	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)c(O)c1	1780555421	GERXZXTUIALKEC-SGTLLEGYSA-N	427.295	1.628	50	20	IDGD	
CN1CCCC[C@H]1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CO[Si](C)(C)C)C2	1780591560	MJNOSNZWFARBJO-WAOWUJCRSA-N	425.646	1.836	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Cl)C2)[C@@H]1CC[C@H]2CCC(=O)N2C1	1780612178	VMXLOZASOSKPRO-UTHDKSHUSA-N	429.920	1.436	50	20	IDGD	
CN(C)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)[C@@](C)(Cl)CCl)C2)C1	1781228438	OOWJWDGODOBLNS-RBUKOAKNSA-N	429.348	1.827	50	20	IDGD	
O=C(Cc1ccc2c(c1)OCO2)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781327911	DLCCKTVWYXRFNJ-AEFFLSMTSA-N	443.269	1.478	50	20	IDGD	
O=C(c1cnc2[nH]ncc2c1)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781329274	CILXNHGUJVYDJE-LRDDRELGSA-N	426.246	1.092	50	20	IDGD	
O=C(c1ccc2c(c1)COC2)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781329826	KVXUIOAOQVBUMU-CRAIPNDOSA-N	427.270	1.851	50	20	IDGD	
CN(C)c1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)cn1	1781331662	OMJOKPZRHBGGFX-PBHICJAKSA-N	429.290	1.282	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1csnn1)C2	1781901572	QWMSIDMILXWZPV-AXAPSJFSSA-N	431.356	1.839	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)n1cncn1)C2	1782002904	WXHFTPDSXPDACW-SZOQZIPDSA-N	428.331	1.136	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc([N+](=O)[O-])c(O)cc3C)C2)C1	1782103931	DIACGCOKUQSZCL-KUHUBIRLSA-N	441.868	1.306	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CN2CCCCC2=O)C1	1782105826	BCJQCQPXJJUPNU-UIAACRFSSA-N	448.391	1.749	50	20	IDGD	
Cn1nc2c(c1C(=O)N1CC[C@@]3(CN(C(=O)CCBr)CCO3)C1)CCC2	1782436394	GNPSTVZGVFVBRF-GOSISDBHSA-N	425.327	1.137	50	20	IDGD	
O=C([C@H](O)CCl)N1CCO[C@]2(CCN(C(=O)C3(c4ccc(Cl)cc4)CC3)C2)C1	1782964668	MQYDBCIVDLRLPS-VQIMIIECSA-N	427.328	1.801	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc4c(Cl)cccn34)C[C@@H]21)[C@H](O)CCl	1784089807	JLWDXVFFBVAWIZ-RKLWJJNISA-N	441.315	1.181	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](C)n3cccc3)C2)C1	1784327453	XJDIVQFCJRQEJZ-TUGUMKMLSA-N	440.504	1.013	50	20	IDGD	
CC(C)Oc1ccc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)cc1C#N	1785192646	JPZWLVFHIVSWHK-UTKZUKDTSA-N	435.908	1.389	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CC(C)(C)C)[C@H]2C1	1786379900	YXNPNAPWMVVBFZ-SMKMMKTPSA-N	431.537	1.536	50	20	IDGD	
C[C@@H](Nc1cccnc1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21	1786862127	QTIPPRGDYKSJOQ-OHFALNGGSA-N	439.354	1.647	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]3C2)C1	1787447351	ULKRVDKQDRLJFD-CYUUQNCZSA-N	433.908	1.367	50	20	IDGD	
CC(C)[C@@H](O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C(C#N)=C/c3ccc(F)cc3F)[C@H]2C1	1790693550	JCPNINMMDVRSHY-PEJPZTRWSA-N	447.482	1.868	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(F)cc3OC)C[C@@H]21	1791256193	HCAMWEWTHJXXFN-RPZXMPESSA-N	428.888	1.681	50	20	IDGD	
C[C@H](C(=O)NC1(c2ccc(NC(=O)CCC(=O)NN(C)C)cc2)CCC1)N1C[C@H]2C[C@H]2C1	1791601099	LXWYEAHNHWNXQJ-KURKYZTESA-N	441.576	1.834	50	20	IDGD	
C[C@@]1(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)CC=CCC1	1791776408	HERCCGCBSGHSNQ-HTIQSUCMSA-N	441.532	1.025	50	20	IDGD	
O=C(CCN1CCCC1)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1	1792366951	PDRNNYANRNTDMQ-UHFFFAOYSA-N	435.333	1.600	50	20	IDGD	
COc1ccc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Cl)C3)cc1OC	1793657267	JFNSIUGDGWBWFS-GTYSZEQSSA-N	428.888	1.760	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](O)c1ccccc1	1795382313	SSVGESPYIWSSQG-USACIQFYSA-N	425.323	1.341	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCS(=O)(=O)c1ccccc1	1795718038	GXBOGPQVJHBOOJ-KYHPRHEASA-N	442.965	1.742	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CC1CCOCC1	1795895776	CXPBVLOHCFFCLB-XMYAHUOOSA-N	429.521	1.575	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)c1cccc2ncccc12	1796190989	MCWLETSDUZMQNP-REPLKXPHSA-N	429.285	1.480	50	20	IDGD	
COC(=O)N(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Cl)Cc1ccccc1	1796369257	WDXDJFYJYNGHTK-CYGHRXIMSA-N	441.887	1.379	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1nc(OC)ccc1[N+](=O)[O-]	1796718424	DOICCOOBEBYAHK-OQMKEHIESA-N	440.884	1.609	50	20	IDGD	
C/C(=C\c1ccc(C)o1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnccc1C(=O)NN)C2	1798530766	ZMDUHZVAEDRCQQ-XYDLKOIESA-N	437.500	1.942	50	20	IDGD	
CCOC(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@](C)(Cl)CCl)OCC	1799278854	YZMABRRHYUVKEM-ZDFLXESQSA-N	425.353	1.602	50	20	IDGD	
COc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)Br)cc(Cl)n1	1800760504	PSVGHKYZGHDMRQ-ADGXKJENSA-N	446.729	1.730	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C(Cl)(Cl)Cl	1801738274	RCTKMSBERDSKBW-ILWJIGKKSA-N	434.711	1.307	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)Cn2cc(Cl)cn2)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803137723	DFLNRJSENRRTCC-JLJPHGGASA-N	426.304	1.237	50	20	IDGD	
Cc1ccc(C(=O)C(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)cc1	1803146315	NGJNFRYDOXXCBH-QRVBRYPASA-N	429.904	1.878	50	20	IDGD	
Cc1cc(F)c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)cc1F	1803658569	LNVUIRDJSQWVPW-BJWYYQGGSA-N	428.244	1.519	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@@H](O)C(=O)N1CCCC2(CCN(C(=O)[C@@H](F)Cl)CC2)C1	1805408811	UTOSVVXLIJBYRZ-ZIAGYGMSSA-N	435.924	1.638	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@H]1CCN(C(=O)Cn2nccn2)[C@@H]1c1cccnc1	1808305969	XXAOUFSXVKRMBE-KYJSFNMBSA-N	425.320	1.615	50	20	IDGD	
O=C(/C=N/O[C@@H]1CCCCO1)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1	1810358342	RUBZDWYXCKQLCX-TUPMQDAGSA-N	438.912	1.216	50	20	IDGD	
Cc1nnc(CC(=O)N2CC[C@H](CNC(=O)CO[Si](C)(C)C)[C@H]2c2cccnc2)o1	1810541640	LIWLTALTVFVCFI-OXQOHEQNSA-N	431.569	1.873	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@@H]1c1cccnc1)c1cc(O)no1	1810983494	FWWHGSDOOXXYNQ-GDLCADMTSA-N	427.230	1.785	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)c1ccc2ccnn2c1	1812201017	COIDHZDSYBLLIA-SNRMKQJTSA-N	427.892	1.649	50	20	IDGD	
C[C@H](Cc1ccncc1)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1	1812334165	NDMSPINHAMFBBW-TTYHFUOFSA-N	430.936	1.961	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2nccc3nc[nH]c23)[C@H]1c1cccnc1	1813032198	UXNJPPIAVYFBLX-DOXZYTNZSA-N	442.907	1.926	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)[C@@H]1C[C@]1(F)Cl	1813153168	OWJKHTQGQVTUMF-DZKDUJFISA-N	445.687	1.006	50	20	IDGD	
C[C@@H](CBr)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CN2CCNC2=N)[nH]n1	1814779989	CLRYJJXHAZTOQV-WCQYABFASA-N	440.346	1.273	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](O)c2ccccc2)n[nH]1	1817083791	CXRGUKAZWGDIHK-LAUBAEHRSA-N	442.520	1.508	50	20	IDGD	
CC(C)CNC(=O)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](F)Br)[nH]n1	1818134698	KNBGAEKTVQIPSU-AAEUAGOBSA-N	432.294	1.865	50	20	IDGD	
O=C(/C=N/O[C@@H]1CCCCO1)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1	1819450178	HFTLCSRBTOHKBN-FOLUXADTSA-N	427.889	1.531	50	20	IDGD	
C[C@](O)(CC(=O)O)CC(=O)Nc1cc([C@H]2CCCCN2C(=O)CCBr)[nH]n1	1822402937	APRWDCSGCBRZNT-SJKOYZFVSA-N	445.314	1.803	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)[C@H](C)N3CCN(C)CC3)sc2C1	1822693180	PFGPQKANRKAVEF-IHRRRGAJSA-N	428.002	1.708	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CS(C)(=O)=O)CC2	1822863081	FVVSEDBDMYTDAO-RMLUDKJBSA-N	428.363	1.336	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H]2C[C@H](O)CN2)CC1	1824094186	HSURXHXAJOQWLE-QSPRXWTASA-N	430.387	1.360	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CO[Si](C)(C)C)CC2	1826087740	JUPLFKCLUNEQID-LBPRGKRZSA-N	441.630	1.280	50	20	IDGD	
O=C(Cc1ccsc1)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827052737	CCCDSNLIXMPKHU-OAQYLSRUSA-N	440.374	1.904	50	20	IDGD	
O=C(/C=C/c1ccoc1)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827056063	OQNRNPVFSZYJJU-DORXLWPQSA-N	436.317	1.906	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)CCl)CC2)c1ccc(CO)c(F)c1	1827903025	RWANKYMWIBSEPB-RISCZKNCSA-N	427.885	1.600	50	20	IDGD	
N#Cc1ccccc1OCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](O)CCl)CC2	1828025770	STQRKWROECHSLI-GXTWGEPZSA-N	434.905	1.605	50	20	IDGD	
CC(C)[C@H](S)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1	1828923551	LRQFUZLLMUCASO-OALUTQOASA-N	447.605	1.873	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(Cl)ncn3)C2)C1	1830364478	MGKRHDVWSCIXPQ-GOSISDBHSA-N	431.320	1.465	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)C(=O)c2ccco2)CC1	1831870933	JGHKAVOXWSBKIY-KRWDZBQOSA-N	432.521	1.455	50	20	IDGD	
Cc1noc(C)c1CCC(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)CCl)CC2)CC1	1833308604	WREVQWPGNXSNFT-IBGZPJMESA-N	440.972	1.395	50	20	IDGD	
Cc1nscc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)CBr)C2)C1	1833740505	NVBUBIHUIUUQHA-SJCJKPOMSA-N	446.367	1.553	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)C(Cl)Cl)CC2)CC1)c1cnc2ncccn12	1835388122	LWKRKIQSAIPHNW-UHFFFAOYSA-N	439.347	1.718	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC1CCN(C2CCN(C(=O)CCc3cnccn3)CC2)CC1	1835838043	ZLFQCJTVWJBEDW-UHFFFAOYSA-N	447.656	1.832	50	20	IDGD	
Cc1n[nH]c(C)c1C(=O)NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1	1835871987	GOTNLJSRCWMHGH-INIZCTEOSA-N	444.349	1.902	50	20	IDGD	
Cc1nc(CC(=O)N2CCC(N3CCC(NC(=O)[C@@H](F)Br)CC3)CC2)no1	1836413363	DDOITJXVJWJIKM-MRXNPFEDSA-N	446.321	1.183	50	20	IDGD	
O=C(c1ccc2cccnc2n1)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836717130	JUOSCZBWAWURQX-IBGZPJMESA-N	446.935	1.842	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc4nncn4c3)CCO2)C1	1837011646	SJARDWXVNNFOAR-OXJNMPFZSA-N	435.912	1.207	50	20	IDGD	
COC(=O)C12CC(C(=O)N3CCC(OC4CCN(C(=O)[C@H](F)Cl)CC4)CC3)(C1)C2	1838085961	LICLVYIGEOIJGO-VMEOHVCESA-N	430.904	1.863	50	20	IDGD	
COCc1c[nH]c(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)c1	1838519411	MKOLBILCTQSDKK-FZKQIMNGSA-N	444.326	1.015	50	20	IDGD	
Cc1n[nH]c(C)c1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2	1839153280	DUUPGPVQPLLPDK-ROUUACIJSA-N	433.336	1.333	50	20	IDGD	
CC(C)n1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)n1	1839153760	RLTFRFCAZWKMNB-RBUKOAKNSA-N	447.363	1.770	50	20	IDGD	
O=C(c1cnoc1C1CC1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839197737	GYUHFRMYELUUAZ-RHSMWYFYSA-N	446.273	1.313	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3C[C@@H]3F)C2)C1	1839743853	AFMHVGHURQAUDR-YFOLIPHBSA-N	449.429	1.686	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H](O)Cc3ccccc3)CCO2)C1	1839956314	MGQDIOOMESJPKO-PGRDOPGGSA-N	438.952	1.311	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)COC(C)(C)C)C2)C1	1839962461	FYNFWGPQPBCWMX-KBXCAEBGSA-N	435.359	1.431	50	20	IDGD	
Cc1cccc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)n1	1840030457	MZYBFNVVWVGCHW-BEFAXECRSA-N	440.338	1.172	50	20	IDGD	
CN(C)c1ccc(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)cc1	1840314959	WUSVORKBUNRZNJ-CTNGQTDRSA-N	441.931	1.676	50	20	IDGD	
O=C(CCCn1cccc1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1840461636	NJZABUPZPSCFEE-FUHWJXTLSA-N	446.317	1.415	50	20	IDGD	
COC1(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)CCC1	1840618416	GOKWFGVDILJWLM-KSSFIOAISA-N	433.343	1.185	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(CO)c(F)c3)CCO2)C1	1840783723	YKNDMOQNIFUFSX-JXFKEZNVSA-N	428.888	1.405	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@]2(C[C@H]2C(=O)N2CC3(CCCN3C(=O)[C@@H](O)CCl)C2)C1	1841353544	DDGWEVRLFKZENE-AVYPCKFXSA-N	441.956	1.437	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)c2cc(=O)cco2)C1	1842579658	ACNPBRYQWLIGQC-UHFFFAOYSA-N	441.396	1.604	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)C(=O)c1ccc(C)cc1)C2	1843417128	ZPBVNZAZUILXOQ-PCLIKHOPSA-N	435.484	1.515	50	20	IDGD	
CCC(=O)N[C@@H](C)C(=O)N1CC2(CCCN2C(=O)c2cc([N+](=O)[O-])ccc2OC(C)=O)C1	1844692001	WXEUEKNLYBAMRP-ZDUSSCGKSA-N	446.460	1.252	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)C[C@H](O)CNC(=O)OC(C)(C)C)C1	1845229036	YZDWDBOLKGFUNY-GJZGRUSLSA-N	431.961	1.873	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](C)[C@H]1SC(=N)NC1=O	1847498900	UCKFEALJXPEQTD-LDMBFOFVSA-N	431.356	1.022	50	20	IDGD	
CCOC(=O)NNC(=O)C1CCN(S(=O)(=O)c2ccc(C(=O)OCC)cc2)CC1	14795068	MIHKLLZEELTHQM-UHFFFAOYSA-N	427.479	1.041	50	20	IDGD	
CC(C)(C)NC(=S)NNC(=O)C1CCN(S(=O)(=O)c2ccc(F)c(F)c2)CC1	14895364	PLTXVFHXRRPOLL-UHFFFAOYSA-N	434.534	1.659	50	20	IDGD	
O=C(NNC(=S)Nc1cccc(Br)c1)c1cnc2n(c1=O)CCS2	16108534	HFYFBKMOOAJSNO-UHFFFAOYSA-N	426.321	1.743	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCCC3)cc2)c1	17252439	AZVZEBWQTXCEFR-UHFFFAOYSA-N	444.557	1.931	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)c1ccc(S(=O)(=O)N2CCCCC2)cc1	17822265	XIWLYQJRTJIATR-UHFFFAOYSA-N	445.497	1.707	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)CCCC(=O)NNC(=O)c1ccccc1OC	100099272	XUHFDFSIQARVBN-UHFFFAOYSA-N	428.445	1.096	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)Cc1ccc(S(N)(=O)=O)cc1	110921420	WBACEBXDAFJCNO-UHFFFAOYSA-N	430.511	1.770	50	20	IDGD	
Cn1cc(S(=O)(=O)N2CCCCC2)cc1C(=O)NNc1nc(-c2ccncc2)no1	726376131	FKUHGXYTCDRFMK-UHFFFAOYSA-N	431.478	1.402	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=S)NCc2ccc(S(N)(=O)=O)cc2)o1	726484652	BPVPMFOVHFZHGP-UHFFFAOYSA-N	439.563	1.078	50	20	IDGD	
O=C(COc1ccccc1OCC(F)(F)F)NNC(=O)[C@@H]1COc2ccccc2O1	727658764	CRLLLNZUCQZNPY-INIZCTEOSA-N	426.347	1.994	50	20	IDGD	
CC/C=C(\C)C(=O)N1CSC[C@H]1C(=O)NNC(=O)c1cc(OC)c(OC)c(OC)c1	727982487	HZCCKXFDJIDTOR-GMMCIKNFSA-N	437.518	1.731	50	20	IDGD	
O=C(NNc1nc(-c2cccnc2)no1)c1ccc(S(=O)(=O)NC[C@@H]2CCCO2)cc1	728078844	YEPJZCZCBPQPMJ-HNNXBMFYSA-N	444.473	1.346	50	20	IDGD	
COc1cccc(COCC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)c1	728214581	AWCOQHDXYMHYPV-UHFFFAOYSA-N	448.545	1.291	50	20	IDGD	
CCCCS(=O)(=O)N1CCC(C(=O)NNC(=O)c2cccc(OC(F)F)c2)CC1	728485255	UCZKIMNVMQDFCH-UHFFFAOYSA-N	433.477	1.891	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)CN2C(=O)[C@H]3CCCC[C@H]3C2=O)c1	728528477	JCCXRWRINCNDOW-TXEJJXNPSA-N	438.278	1.394	50	20	IDGD	
COC(=O)N1CCC(NC(=O)NNC(=O)c2cc(OC)ccc2Br)CC1	728746784	NPMROLXXLVWFRF-UHFFFAOYSA-N	429.271	1.633	50	20	IDGD	
CCN(CCCNC(=O)NNC(=O)c1cc(F)ccc1Br)S(C)(=O)=O	728747010	HYGSMHCHENKMQT-UHFFFAOYSA-N	439.307	1.204	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)NCCN2CCOCC2(C)C)c1	728755413	MHYDXWUPFINFMD-UHFFFAOYSA-N	429.315	1.513	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCN(c2ccc(F)cc2)C1=O)C1CCN(c2ncccn2)CC1	728890437	QONDAUWJYMNYFI-QGZVFWFLSA-N	426.452	1.033	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCC(Oc3cccc(C#N)c3)CC2)cc1OC	729479979	LQEHKNNRFNNZGL-UHFFFAOYSA-N	438.484	1.880	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)Cc2cccc3ccccc23)cc1S(=O)(=O)NCC#N	731184126	NHQAFYVVBUXZKM-UHFFFAOYSA-N	436.493	1.954	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)NCCNC(=O)c1cccc(Br)c1	731405854	PQHHLBFGGJNBSK-UHFFFAOYSA-N	437.269	1.891	50	20	IDGD	
CC[C@H](C#N)Oc1cccc(CNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1	733801141	LKLGDJHVRPRDSA-GOSISDBHSA-N	437.504	1.905	50	20	IDGD	
CC(=O)NCC(=O)N1CCc2cc(C(=O)NNC(=O)c3cc4ccccc4cc3O)ccc21	735687288	NCMVBQCCWJWXCN-UHFFFAOYSA-N	446.463	1.645	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)NCc1cccc(NC(=O)[C@H]2CCCO2)c1	738461316	PQPREONKHHYLLV-LJQANCHMSA-N	426.473	1.851	50	20	IDGD	
COc1ccccc1CC(=O)NN=C(C)c1cccc(S(=O)(=O)N2CCOCC2)c1	739411916	RTVVFVAZGPWLMJ-UHFFFAOYSA-N	431.514	1.799	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(\C#N)C(=O)N2CCC[C@@H](CNS(N)(=O)=O)C2)c1C	739696506	IVYDUHRSUCTTJD-JMZZEXELSA-N	437.566	1.251	50	20	IDGD	
CN(C)c1nccc(NNC(=O)C2CCN(S(=O)(=O)/C=C/c3ccccc3)CC2)n1	740107705	KXICXFKCNDIVCM-RVDMUPIBSA-N	430.534	1.698	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@@H]2C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	740843855	YUTIQVQHQMBQBU-MRXNPFEDSA-N	441.492	1.461	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)[C@H]2CN(Cc3ccccc3)CCO2)c2ccccc2c1=O	741207114	IWYLTWRATRBBDM-HXUWFJFHSA-N	449.511	1.639	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)c1c[nH]cc1-c1ccc2c(c1)OCCO2	742063167	XHGLOTMWZFNTMG-UHFFFAOYSA-N	426.454	1.705	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)NC[C@@](C)(O)C2CC2)cc1	743776072	WNXZJTABPSJSDV-OBIZFTICSA-N	437.500	1.618	50	20	IDGD	
O=C(CCN1C(=O)NC2(CCCC2)C1=O)NNC(=O)Nc1ccc(OC(F)F)cc1	743832668	QSBVMOYQHJLRDM-UHFFFAOYSA-N	425.392	1.695	50	20	IDGD	
CSc1nc2nc(C)c(CC(=O)OCC(=O)NNC(=O)c3cccc(C)c3)c(C)n2n1	744522156	XEWSJLKGPOQRRZ-UHFFFAOYSA-N	442.501	1.318	50	20	IDGD	
O=C(COC(=O)c1c[nH]cc1-c1ccc(F)cc1)NNC(=O)[C@H]1COc2ccccc2O1	745268314	BFWPAYIVQJYCBZ-LJQANCHMSA-N	439.399	1.965	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)c1cc(F)ccc1Br)CN1CCN(C)CC1	745862175	HVCIPKJCVYIIKK-GFCCVEGCSA-N	430.322	1.416	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2ccc(OC(C)C)c(OC)c2)cn1C	745977295	SVXMVQXBYPCGDR-UHFFFAOYSA-N	425.463	1.231	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)CCN1CCN(c2cccc(C)c2)CC1	746094682	OYTJSPYFWNPDNK-UHFFFAOYSA-N	426.517	1.742	50	20	IDGD	
COC[C@@H](C)n1c(C)cc(/C=C(\C#N)C(=O)NCCNS(=O)(=O)c2cccnc2)c1C	746272682	VUGWXAZQRLSCHR-YDDPGSGASA-N	445.545	1.709	50	20	IDGD	
CS(=O)(=O)Nc1cc(C(=O)NNC(=O)c2cc(Br)c[nH]2)ccc1Cl	747150458	BYTPPBFOTVORDU-UHFFFAOYSA-N	435.687	1.877	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(C)c(NC(=S)NNC(=O)[C@H](C)OCCOC)c1	748608156	ROGVTNVTRAIXEW-AWEZNQCLSA-N	446.595	1.395	50	20	IDGD	
Cc1nc(C(C)C)nc(O)c1C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	748620875	UPSFBLROSCLJAY-UHFFFAOYSA-N	448.549	1.307	50	20	IDGD	
COc1cc(OC)cc(N2CC[C@H](NC(=O)NNC(=O)[C@H]3COc4ccccc4O3)C2)c1	748662996	YGSXUINYAYFNAI-VBKZILBWSA-N	442.472	1.453	50	20	IDGD	
CC1(O)CCC(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)CC1	749597361	XQWRMQIGRZMYBD-UHFFFAOYSA-N	438.550	1.499	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)CNC(=O)OC(C)(C)C	749867640	BYZJAFHIAOAOCX-LBPRGKRZSA-N	428.511	1.195	50	20	IDGD	
COc1ccc([C@H]2CCN(C(=O)NNC(=O)c3csc(N4CCOCC4)n3)C2)cc1	749919049	YQONABYNLGXNSI-HNNXBMFYSA-N	431.518	1.832	50	20	IDGD	
CNS(=O)(=O)c1cccc(NC(=O)[C@H](C)NC(=O)/C(C#N)=C/c2ccc(F)cc2)c1	752056091	CUOXTKVBRLAFIB-LERPTODRSA-N	430.461	1.784	50	20	IDGD	
CS(=O)(=O)NCc1ccc(C(=O)NNC(=S)Nc2cccc(Br)c2)o1	754183507	QJHKQQCREHCSEP-UHFFFAOYSA-N	447.336	1.723	50	20	IDGD	
C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	755021191	OSWJSRSMAMOEAR-GFBZKKKVSA-N	441.396	1.529	50	20	IDGD	
CON(C)S(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)cc1	755537266	YNRWQGLFHCGWMC-LBPRGKRZSA-N	440.453	1.628	50	20	IDGD	
COC(=O)CNC(=O)c1ccc(NC(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)cc1	755544147	DLVPJYQKLCLBKA-OAHLLOKOSA-N	442.472	1.826	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)Nc1ccccc1C(=O)N1CCOCC1	755622945	KYGTUURZOZMYMM-CQSZACIVSA-N	430.436	1.918	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)Nc1cccc(C(=O)N2CCCCC2)c1	756082393	CHNUIGXATNBGQO-UHFFFAOYSA-N	434.460	1.755	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)Nc2ccn(CCCOC)n2)c2ccccc2c1=O	756660287	VFMXHUVIOSNIFH-UHFFFAOYSA-N	441.492	1.896	50	20	IDGD	
CCN1CCN(C(=O)Cc2ccc(NC(=O)NNC(=O)c3ccccc3F)cc2)CC1	757577541	CNNUTMBVFDDAFH-UHFFFAOYSA-N	427.480	1.999	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(F)(F)[C@H](C(=O)NNC(=O)C(=O)Nc2ccccn2)C1	757986982	QAYCVYKPCCYNBN-NSHDSACASA-N	427.408	1.060	50	20	IDGD	
Cc1ccc(S(N)(=O)=O)c(C(=O)NNC(=O)c2ccc(COc3ccccc3)o2)c1	757988255	KXMVKSJCTHNECE-UHFFFAOYSA-N	429.454	1.889	50	20	IDGD	
Cc1nc(-c2ncccn2)sc1C(=O)N1CCN(S(=O)(=O)CBr)CC1	758535664	PXULUYOBZDETJQ-UHFFFAOYSA-N	446.352	1.349	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)N[C@@H]2CN(C(=O)OC(C)(C)C)C[C@@H]2C#N)cc1OC	758777775	PQUMFIMZQCXUCL-LSDHHAIUSA-N	447.492	1.797	50	20	IDGD	
COc1ccc(C[C@H](C)C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)cc1	759660786	MNONDVKEVUMIFD-KRWDZBQOSA-N	446.573	1.953	50	20	IDGD	
CC(C)CNS(=O)(=O)c1ccc(C(=O)NNC(=O)CCNC(=O)OC(C)(C)C)cc1	760431329	APQHWHMCCNAMOZ-UHFFFAOYSA-N	442.538	1.297	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNS(=O)(=O)c1ccc(Cl)c(Br)c1	761950613	HSJYEQSRLQVCBD-UHFFFAOYSA-N	426.720	1.717	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H](C)C2CCOCC2)c1	762362836	YTMCCQXVGFJELK-CQSZACIVSA-N	426.539	1.476	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)C(=O)Nc1ncn(Cc2ccc(Cl)cc2)n1	763454934	KHKZPJRWXIOUIH-UHFFFAOYSA-N	443.807	1.288	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)NC1CCN(C(=O)C(C)(C)C)CC1	763462223	ILDZTDMUHXNKHN-UHFFFAOYSA-N	427.546	1.659	50	20	IDGD	
O=C(NNC(=O)c1cc2ccccc2cc1O)C(=O)Nc1ccccc1N1CCOC1=O	763521736	IYONVANVWLNAPU-UHFFFAOYSA-N	434.408	1.902	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)ccc1Cl	763574344	ZATPUVVDBPVRDF-MRXNPFEDSA-N	447.831	1.443	50	20	IDGD	
O=C(COc1cccc(C(F)(F)F)c1)NNC(=O)C(=O)Nc1ccn(CC(F)F)n1	763641832	XHASLZCYLWUOGL-UHFFFAOYSA-N	435.309	1.332	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(N(C)C(=O)OC)cc1	763680897	IBBKRKSPZZIQJV-UHFFFAOYSA-N	444.444	1.453	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2nc(-c3cccs3)cs2)cc1	763682011	ZYYFYVMLIYRVEF-UHFFFAOYSA-N	427.467	1.908	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc2c(c1)N(CC)CC2	763684333	JQKWUWCYFGAZHR-UHFFFAOYSA-N	426.473	1.633	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)C(=O)Nc2ccccc2SC(F)F)c2ccccc2c1=O	763787281	WHDMFAZOZUSTHZ-UHFFFAOYSA-N	447.423	1.648	50	20	IDGD	
COC(=O)c1cc(OC)ccc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccccc1F	763856810	IEMXAQOKBUGFKX-NSHDSACASA-N	433.392	1.174	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)ccc1Cl	763872267	MZQSOTYFJZYDCU-SNVBAGLBSA-N	437.811	1.819	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2cc(C(C)(C)C)nn2-c2ccccn2)n1	763893746	YKBRYVKTGJNGKD-UHFFFAOYSA-N	438.492	1.164	50	20	IDGD	
O=C1COc2ccc(NC(=O)C(=O)NNC(=O)c3cc4c(s3)CCCCC4)cc2N1	763967592	FBYISZWZTZTUIF-UHFFFAOYSA-N	428.470	1.748	50	20	IDGD	
CCOCCOc1ccc(Br)cc1NC(=O)C(=O)NNC(=O)c1ccc[nH]1	763980095	BZACWKXKBKBVLE-UHFFFAOYSA-N	439.266	1.592	50	20	IDGD	
O=C(NNC(=O)c1cnccn1)C(=O)Nc1ccc(OC(F)(F)F)cc1Br	764031798	MTMSBBQWFFOSBR-UHFFFAOYSA-N	448.155	1.537	50	20	IDGD	
O=C(Cc1cccc2ccccc12)NNC(=O)C(=O)Nc1cccn(CC(F)(F)F)c1=O	764036922	SOBIFFFUSBIXJQ-UHFFFAOYSA-N	446.385	1.892	50	20	IDGD	
Cc1ccc(S(C)(=O)=O)cc1NC(=O)C(=O)NNC(=O)c1ccc2ccccc2c1	764067857	ZQDVBSKCEBUNOG-UHFFFAOYSA-N	425.466	1.951	50	20	IDGD	
CCNC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(CN(CC)CC)o2)c1	764139265	PJVBGTRVDTYDAB-UHFFFAOYSA-N	444.492	1.663	50	20	IDGD	
O=C(NNC(=O)c1ccoc1)C(=O)Nc1ccc(CCn2cc(Br)cn2)cc1	764163058	GZMBQRIGKNDKSA-UHFFFAOYSA-N	446.261	1.881	50	20	IDGD	
O=C1CN(c2ccc(NC(=O)C(=O)NNC(=O)CCC3CCCCC3)cc2Cl)CCN1	764209849	DVIYYRSALCPJGX-UHFFFAOYSA-N	449.939	1.723	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(S(=O)(=O)C3CCCC3)cc2)c1	764234985	OELYZLCZWNSMEX-UHFFFAOYSA-N	440.481	1.674	50	20	IDGD	
Cc1ccc(S(C)(=O)=O)cc1NC(=O)C(=O)NNC(=O)c1cccc2ncccc12	764257276	BGEOYHSQGVZWPK-UHFFFAOYSA-N	426.454	1.346	50	20	IDGD	
O=C(Cc1ccccn1)NNC(=O)C(=O)Nc1cnn(-c2ccccc2Br)c1	764270206	HWGJEJDNNUMDJY-UHFFFAOYSA-N	443.261	1.358	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)C(=O)Nc1ccccc1S(=O)(=O)C(F)F	764288747	LVQFAKKKDUUIJG-UHFFFAOYSA-N	441.412	1.107	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3ccc(Cl)cc3F)cn2)C[C@@H](C)O1	764411359	VXLKXGLEMNCYGW-TXEJJXNPSA-N	449.870	1.887	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NN=C3C(=O)Nc4ccc([N+](=O)[O-])cc43)CC2)cc1	764830592	MGETTZNIFANNDA-UHFFFAOYSA-N	436.472	1.493	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)[C@@H](C)NS(=O)(=O)c2cccc(C#N)c2)o1	765097401	FOWQHTKKQAVWHX-CQSZACIVSA-N	447.517	1.121	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)[C@H](CC(F)F)NC(=O)OC(C)(C)C)nc2ccccc21	765530045	OTGSBEWGKMUBJE-LBPRGKRZSA-N	425.436	1.812	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cc(C)nc4[nH]nc(C)c34)CC2)cc1	766639948	AZVYDMRKQNZPDG-UHFFFAOYSA-N	435.532	1.462	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)[C@@H]2CC(=O)N(Cc3ccccn3)C2)cc1C	766935648	VLKFVKGQINSYBF-CQSZACIVSA-N	444.513	1.367	50	20	IDGD	
O=C(CCC(=O)N1CCN(c2ncccn2)CC1)NNc1ccc(Br)cc1	767862918	TZKLWUFOXYOOJU-UHFFFAOYSA-N	433.310	1.811	50	20	IDGD	
COc1cc(F)cc(CNC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c1	770308093	YWBKJLUPMYBJKJ-UHFFFAOYSA-N	429.496	1.877	50	20	IDGD	
Cc1cccc(F)c1NNC(=O)C(=O)Nc1ccc(CC(=O)N2CCN(C)CC2)cc1	770815209	LGBIFZGEJMVCKL-UHFFFAOYSA-N	427.480	1.532	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)CCNS(=O)(=O)c3cccs3)nc21	770958922	SZWOUUVKUQVRAQ-UHFFFAOYSA-N	439.523	1.160	50	20	IDGD	
CCNC(=O)COc1ccc(C=NNC(=O)C(=O)NCc2ccc(Cl)cc2)cc1OC	771567718	JENVLNJLGILIQZ-UHFFFAOYSA-N	446.891	1.630	50	20	IDGD	
O=C(C[C@@H](O)c1cccc(F)c1)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	772810608	KOQMKLJVPCTJEX-HXUWFJFHSA-N	448.926	1.868	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)C(=O)Nc2ccc(NC(=O)NC[C@@H]3CCCO3)cc2)n1	773483426	WTBTVXVVJRWVLE-INIZCTEOSA-N	427.465	1.476	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)nc1)C(=O)Nc1ccc2c(c1)CCC(=O)N2CC1CC1	773495464	BMBCCQDPLDEWNG-UHFFFAOYSA-N	441.875	1.824	50	20	IDGD	
O=C(c1ccn(Cc2ccccc2)n1)N1CCN(S(=O)(=O)CBr)CC1	773615922	ZPRLAKDSXYGSHL-UHFFFAOYSA-N	427.324	1.371	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1cc(NC(=O)C(=O)NNc2cccc(C#N)c2)ccc1F	773685237	HQJWBDUWFPDRQP-UHFFFAOYSA-N	433.465	1.856	50	20	IDGD	
CS(=O)(=O)c1cc(Br)ccc1NC(=O)C(=O)NNc1ccc(C#N)cc1	773693141	WHLYEEKLUJEYQV-UHFFFAOYSA-N	437.275	1.806	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(S(C)(=O)=O)c(C(F)F)c2)cc1F	773884888	FAHJOAHDXUGMPQ-UHFFFAOYSA-N	443.403	1.875	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN[C@@H](C)c2ccc(N3CCOCC3)cc2)cc1OC	775255779	QALHZVVRARLFMU-INIZCTEOSA-N	442.516	1.652	50	20	IDGD	
COc1cccc([C@@H]2[C@@H](C(=O)NNC(=O)Cn3cnc4ccccc43)CC(=O)N2C2CC2)c1	776448725	RZALCOAAFCWORJ-FDDCHVKYSA-N	447.495	1.945	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)NC1CCN(S(=O)(=O)CC(C)C)CC1	776885651	OELKOJLBSVUCSZ-UHFFFAOYSA-N	436.538	1.037	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)c2ccc3c(c2)S(=O)(=O)N(C(C)C)C3=O)nc1C	778425596	BYKWEBDXNRYPND-UHFFFAOYSA-N	447.473	1.272	50	20	IDGD	
O=C(CCC1CCCCC1)NNC(=O)C(=O)Nc1ccc(C(=O)N2CCOCC2)c(F)c1	778711044	UKNXKVYJTNFSJV-UHFFFAOYSA-N	448.495	1.745	50	20	IDGD	
O=C(NCc1ccccc1CN1CC[C@@H](O)C1)NNC(=O)c1cc(Br)c[nH]1	781779394	AJOVJQQUMKFAOS-OAHLLOKOSA-N	436.310	1.488	50	20	IDGD	
O=C(NNc1ncncc1Cl)C(=O)Nc1ccc(-n2nccn2)cc1C(F)(F)F	782158551	FSYWRXXYSVYJIO-UHFFFAOYSA-N	426.746	1.811	50	20	IDGD	
C[C@H]1CN(C(=O)c2ccc(NC(=O)C(=O)NNc3ncncc3Cl)cc2)C[C@@H](C)O1	782165186	FBJIGDQJISAOPE-TXEJJXNPSA-N	432.868	1.461	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C(=O)Nc2cc3c(cc2Cl)OCCO3)nc2ccccc21	782884635	GZYQBZQMZHVXPE-UHFFFAOYSA-N	443.847	1.327	50	20	IDGD	
CCOC(=O)c1c(C)csc1NC(=O)C(=O)NNc1ccc(S(C)(=O)=O)cc1	783071117	JTKZBDGJAAYQTM-UHFFFAOYSA-N	425.488	1.719	50	20	IDGD	
CC(C)(C)c1ccc(Cn2nccc2NC(=O)C(=O)NN[C@@]2(C)CCS(=O)(=O)C2)cc1	783423922	BOGSPRLFRIZIDB-NRFANRHFSA-N	447.561	1.365	50	20	IDGD	
CCc1ccc(NC(=O)C(=O)NNc2ccnc(Br)c2)cc1S(N)(=O)=O	784828881	PBVBTRRUQFUNHD-UHFFFAOYSA-N	442.295	1.136	50	20	IDGD	
CN1CCN(Cc2cccc(NC(=O)C(=O)NNc3ccc(C(F)(F)F)nn3)c2)CC1	784886824	ZIFIAUULLQZDPU-UHFFFAOYSA-N	437.426	1.325	50	20	IDGD	
COc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)C(=O)NNc1cc(F)c(F)cc1F	784893544	WEJHVEJPTPDFHY-UHFFFAOYSA-N	446.407	1.445	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)Nc1cccc(OCC(F)(F)F)c1	785024707	YHVUGZNHEFOSEL-UHFFFAOYSA-N	442.306	1.641	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)c2c[nH]nc2-c2ccc3c(c2)OCO3)c1	785227753	LXVYPOSBADLAEB-UHFFFAOYSA-N	428.426	1.284	50	20	IDGD	
COc1ccc(NC(=O)NNc2nc3ccccn3n2)cc1S(=O)(=O)N1CCCC1	786131931	XPALHBUZNLCYQY-UHFFFAOYSA-N	431.478	1.671	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)NCc2nc(-c3cccc(F)c3)no2)cc1C	787408911	RQORTGQPTNVFJW-UHFFFAOYSA-N	426.408	1.962	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1ccc(C#N)cc1)C(=O)NNC(=O)NCc1ccc(Cl)cc1	787422552	FYXKPVBRPIOFTB-GFCCVEGCSA-N	435.893	1.409	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)ccc1Cl	789756799	JWXOHOSBGHFCGA-UHFFFAOYSA-N	438.893	1.871	50	20	IDGD	
COC(=O)N(C)c1ccc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)cc1	789810868	RTJVXVSRDJFAHA-ROUUACIJSA-N	440.456	1.548	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)CN1C(=O)N[C@@](C)(c2ccccc2)C1=O	789909829	JQSOCIHIBDAWCB-FQEVSTJZSA-N	430.848	1.577	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1cc([C@H]2CCCOC2)nn1C	790952824	WAVGRRSVDUJSJA-STQMWFEESA-N	433.440	1.007	50	20	IDGD	
COCC[S@@](=O)Cc1cccc(NC(=O)C(=O)NNc2cccc(F)c2[N+](=O)[O-])c1	790999224	PMDGPVNINRJRPR-SSEXGKCCSA-N	438.437	1.711	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cnc(CC3CC3)nc2)cc1Br	793024178	CIVNETSDTAFKKU-UHFFFAOYSA-N	448.277	1.600	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNS(=O)(=O)c2cccc([N+](=O)[O-])c2OC)cc1	794863688	CSWWFCQVMVZDNV-LBPRGKRZSA-N	439.446	1.779	50	20	IDGD	
C[C@@H](C=NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)NC(=O)OC(C)(C)C	799105087	KAZJLJSZYLDQKT-AWEZNQCLSA-N	440.522	1.336	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)C2(c3cncc(Br)c3)CC2)c1	799522995	YQCHUOZGRLJNMB-UHFFFAOYSA-N	443.257	1.752	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2cc(F)cc(F)c2)cc1S(=O)(=O)N(C)C	802001767	TWFBSVACFKMUMX-UHFFFAOYSA-N	428.417	1.690	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)C2=NN(c3ccc(F)cc3)[C@@H](C(N)=O)C2)cc1	802122809	BKAIODCVBNLUMJ-QGZVFWFLSA-N	427.440	1.165	50	20	IDGD	
COc1ccc(C2=NO[C@H](CNC(=O)NNC(=O)COc3ccccc3OC)C2)cc1C	802349648	URXHAFMNIQEEPC-INIZCTEOSA-N	442.472	1.915	50	20	IDGD	
Cc1ccc(C(=O)NNS(=O)(=O)c2ccc(S(C)(=O)=O)cc2Br)o1	802721726	BOTYMDUPGGMBRL-UHFFFAOYSA-N	437.293	1.377	50	20	IDGD	
CC(C)Cn1ncc(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1C1CC1	806972494	BGGXCCKLRIYROH-QGZVFWFLSA-N	427.461	1.342	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2cccc(C3OCCO3)c2)c1	808849331	UVSWEJZSTUTFJG-UHFFFAOYSA-N	434.474	1.449	50	20	IDGD	
N#Cc1cccc(S(=O)(=O)NCC(=O)NNc2ccc(F)cc2Br)c1	810681551	KKYKWZLPFKRKMO-UHFFFAOYSA-N	427.255	1.881	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)CNS(=O)(=O)c2ccc(Br)cc2)nc1	810754705	FTDRHYZKSNVSLA-UHFFFAOYSA-N	443.279	1.052	50	20	IDGD	
COC(=O)Cc1sccc1C(=O)OCC(=O)NNC(=O)c1cc(Cl)ccc1OC	815457354	XZQLNSDEUCBSKG-UHFFFAOYSA-N	440.861	1.744	50	20	IDGD	
CNC(=O)Oc1cccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)c1	815569663	BYPJSZLCTDHIQV-UHFFFAOYSA-N	440.391	1.334	50	20	IDGD	
O=C(c1ccc(OC(F)F)c(F)c1)N1CCN(S(=O)(=O)CBr)CC1	815964475	JMWXTIZHULVBES-UHFFFAOYSA-N	431.230	1.867	50	20	IDGD	
Cn1nncc1NNC(=O)c1ccc(N2CCCCC2)c(S(=O)(=O)N2CCCCC2)c1	816770656	GREVLMVPGICEPX-UHFFFAOYSA-N	447.565	1.737	50	20	IDGD	
COc1ccccc1NC(=S)NNC(=O)CN1C(=O)N[C@](C)(c2ccc(F)cc2)C1=O	825123453	VJCNSDCOIIBNMP-HXUWFJFHSA-N	445.476	1.619	50	20	IDGD	
Cc1nn(CCC#N)c(C)c1CCC(=O)NNC(=O)c1csc(N2CCOCC2)n1	883990517	LRJAWRNZQDRMEH-UHFFFAOYSA-N	431.522	1.101	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)NCc2ccc(C(=O)N3CCOCC3)cc2)c2ccccc21	913628003	NJSBHYLERCZXPA-UHFFFAOYSA-N	435.484	1.795	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN(C(=O)c2ccc(Cl)c(Cl)c2)C1)C(=O)NC1CC1	914838962	UFNLYGFPHQHKDH-LLVKDONJSA-N	427.288	1.272	50	20	IDGD	
COCCNC(=O)NNC(=O)c1ccc(CN(C)S(=O)(=O)c2ccc(C)cc2)cc1	915879307	QBIRZGVSVNVPQN-UHFFFAOYSA-N	434.518	1.406	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)Nc1ccc([N+](=O)[O-])cc1	915879569	YAKBWIANBNLZHK-UHFFFAOYSA-N	449.445	1.082	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)NC[C@@H](c2ccc(F)cc2)N2CCOCC2)cc1	915897758	JTYWERQQEXGKCZ-FQEVSTJZSA-N	441.463	1.480	50	20	IDGD	
CSCC[C@@H](NC(=O)NNC(=O)COc1ccccc1C#N)c1nnc2ccccn12	916223750	PYJLGZTZTQIFIX-OAHLLOKOSA-N	439.501	1.805	50	20	IDGD	
Cc1nc2scc(C)n2c1C=NNC(=O)C(=O)NN=Cc1c(C)nc2scc(C)n12	916266181	IUDLMFQTIRSJTL-UHFFFAOYSA-N	442.530	1.939	50	20	IDGD	
COc1ccc(OCC(=O)NN=Cc2c(C)nn([C@@H]3CCS(=O)(=O)C3)c2Cl)cc1	916296917	SYBLUAVNFPZBLA-CYBMUJFWSA-N	440.909	1.742	50	20	IDGD	
CC(=NNC(=O)C1=S=C2CCCCCC2=C1)c1ccc(S(=O)(=O)NCC(=O)O)cc1	916369385	DGSKWDUKQDSIAI-UHFFFAOYSA-N	449.554	1.872	50	20	IDGD	
C[C@H](Cn1cccn1)NC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	916464477	WPCAPSMBEQEHSX-CYBMUJFWSA-N	448.530	1.778	50	20	IDGD	
CCOC(=O)N1CCC(NC(=O)CCCNC(=O)NNc2cncc(Cl)n2)CC1	916638779	AZALNMPKLXTSBX-UHFFFAOYSA-N	427.893	1.273	50	20	IDGD	
CCC(CC)C(=O)N1CCC(NC(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)CC1	918231856	HXUASXGDZHGLNP-UHFFFAOYSA-N	431.537	2.000	50	20	IDGD	
CN(C(=O)c1cccs1)c1ccccc1C(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1	919888930	IASJESBZPVISLD-GFCCVEGCSA-N	436.515	1.156	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)[C@@H]1CC(=O)N(c2ccc(F)c([N+](=O)[O-])c2)C1	920008317	RQLKAJUHCJKPQN-CYBMUJFWSA-N	430.392	1.486	50	20	IDGD	
Cc1ccc(OCc2nc(C=NNC(=O)CSc3nnc(O)nc3O)cs2)cc1	920371558	WSBSRBCACOVFDB-UHFFFAOYSA-N	432.487	1.869	50	20	IDGD	
CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)NNC(=O)c1csc(N2CCOCC2)n1	921295559	SQLSBFDZQSGQEC-UHFFFAOYSA-N	441.491	1.074	50	20	IDGD	
CS(=O)(=O)Nc1ccccc1CC(=O)NNC(=O)c1cc(F)ccc1Br	1251778548	CVQPHOJMPIIPCZ-UHFFFAOYSA-N	444.282	1.963	50	20	IDGD	
Cc1ccc(NC(=O)N(C)C)c(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)c1	1321818344	HJPUOMBTVMSLJB-UHFFFAOYSA-N	432.506	1.456	50	20	IDGD	
CNS(=O)(=O)c1ccc([C@@H](C)NC(=O)NNC(=O)c2cncn2-c2ccccc2)cc1	1337754183	FSEYYNFZXQOLHR-CQSZACIVSA-N	442.501	1.486	50	20	IDGD	
Cc1nc2ccc(S(=O)(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)cc2o1	1338837458	IFDISXOQTZXNIU-UHFFFAOYSA-N	438.487	1.010	50	20	IDGD	
COc1ccc(C=NNC(=O)[C@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1OCC(N)=O	1347634759	VYALTWLTDOCLSI-HNNXBMFYSA-N	434.493	1.657	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2)c1csc2c1CCCO2	1777809777	WQQMHHUJLGNTAC-JXXFODFXSA-N	442.965	1.800	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3c(-c4ccncn4)noc3C)C2)C1	1780052130	PJISFRFRICKSPP-XOBRGWDASA-N	449.895	1.137	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)N2CCN(C)CC2)C1	1780641130	QJJCMHPGTZCQLX-XKGFGPFHSA-N	429.005	1.154	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CN1CCOCC1)C2	1780713465	TZBRISZMYMFOIH-ATZDWAIDSA-N	436.380	1.069	50	20	IDGD	
C[C@@H](NC(=O)c1ccc(F)cc1)C(=O)N1CC[C@]2(CN(C(=O)C(Cl)Cl)CCO2)C1	1780907412	YJIIKPAGYLRVQE-CWTRNNRKSA-N	446.306	1.578	50	20	IDGD	
CCOc1c(F)cc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)cc1Cl	1781848427	JUTRYPMLACXISB-HNAYVOBHSA-N	449.306	1.921	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(=O)NCC(C)C)C2	1781900952	SXSYJWKUCBDHNY-QMTMVMCOSA-N	446.386	1.446	50	20	IDGD	
O=C(Cc1ccc(F)cc1F)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2	1781917493	BUJLCVWMMGVKBC-SQGPQFPESA-N	430.879	1.621	50	20	IDGD	
CCOC(=O)O[C@@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](Cl)COC)C1	1782178581	AVTWWQZLTXGXDW-XTDOFWJNSA-N	434.917	1.316	50	20	IDGD	
CN1CCCn2nc(C(=O)N3CC[C@]4(CN(C(=O)CO[Si](C)(C)C)CCO4)C3)cc2C1	1782560675	KTTKTBNEMNMSDE-NRFANRHFSA-N	449.628	1.014	50	20	IDGD	
COc1cccc(CCC(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](C)Br)C3)C2)n1	1783529208	GOOPEZBGCWGQIM-LIRRHRJNSA-N	440.338	1.636	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3ccc[nH]3)C[C@@H]21	1783965828	UWWHUEPVEPWEDL-OHFALNGGSA-N	426.355	1.958	50	20	IDGD	
C[C@@H](Sc1ccccc1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]2C1	1784083952	IHFRKFSNSSXETH-KSIDHJATSA-N	426.966	1.747	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3(c4ccc(O)cc4)CC3)[C@H]2C1	1784142270	OZNZZKFGWVUZGO-QZHFEQFPSA-N	436.936	1.657	50	20	IDGD	
Cc1ccc2[nH]cc(CC(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)[C@H](O)CCl)C[C@@H]43)c2c1	1785179670	XQVGAQBLCALHIB-OBZTVWKBSA-N	433.936	1.598	50	20	IDGD	
Cc1nc(O)c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)Br)C[C@@H]32)nc1C	1785575097	ZEUWPEBMFLAWRV-HBEIAFGSSA-N	441.326	1.176	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCBr)[C@H]2C1)n1cccc1C=O	1786405776	BFFVIDPVYRZQSQ-OHFALNGGSA-N	440.338	1.626	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3Cc4ccccc4O3)C[C@@H]21	1786407226	RFTQGOJVIGTJRD-ONIAQPFYSA-N	437.334	1.755	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cn3ccc4sccc4c3=O)C[C@@H]21)[C@H](F)Cl	1787444076	LWNUFRFAPKFGCS-MJFSBKNWSA-N	441.912	1.577	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cc([N+](=O)[O-])ccc3F)C[C@@H]21)[C@H](F)Cl	1787444145	POBOQUSSWDFOLQ-MSMFTSAESA-N	431.823	1.791	50	20	IDGD	
Cc1c(C(=O)NC2(c3ccc(NC(=O)c4ccc(B(O)O)cc4)cc3)CCC2)cnn1C	1788140197	NLDIHZDABBGNQD-UHFFFAOYSA-N	432.289	1.470	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)c1cc2ncsc2[nH]1	1788786806	MRGHEHOSPFWDAR-VDUILEQBSA-N	445.314	1.908	50	20	IDGD	
Cc1nc(F)ccc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)Br)C[C@@H]21	1789064272	ZYQHMFFGJILSAG-WCUVEOEZSA-N	428.302	1.906	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN3CCCCC3=O)[C@H]2C1	1791181982	DCRSCENKUIUNNA-XMDUPGNXSA-N	434.364	1.215	50	20	IDGD	
CCOc1c(F)cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](O)CCl)cc1Cl	1792980691	UJECWKBYFCAKDR-VZAMPYOESA-N	449.306	1.681	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(OCC3CC3)c(F)c1)C2)[C@@H](O)CCl	1792983334	HNGUKJTUJXFLOP-HIRMHNASSA-N	440.899	1.417	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccnc1OCC1CC1	1794777162	CDIXUMHISZELMA-BCDXTJNWSA-N	443.548	1.495	50	20	IDGD	
CCOC(=O)N(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Cl)Cc1ccco1	1796369346	WOEROHRTUYKMGP-RMHZUWNSSA-N	445.875	1.362	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1c(C)oc2cc(O)ccc12	1796997855	WTDYFSYXNWIXIP-UESRRSCYSA-N	436.892	1.904	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C=C/C(=O)NCc1ccco1	1797890086	QWCOESMAGKDAMR-ZAELMVBLSA-N	437.924	1.449	50	20	IDGD	
C[C@@H](NC(=O)c1ccc(F)cc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2	1799050915	GUOPJCYJVCHRFU-MIGXYKPQSA-N	429.851	1.068	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](F)Br)c1cnc2c(c1)CCNCC2	1800161761	NBMIQZNBVXQKCZ-IVSAIRAKSA-N	439.329	1.712	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCOCCOCCOCCOC	1800206624	WREXUCZVNHFVIK-FCGDIQPGSA-N	448.988	1.728	50	20	IDGD	
CC[C@@H](C)[C@H](O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C#N)=C/c1ccc(F)cc1F	1800332506	RUROZUMXNSFVRK-JIOGVWDZSA-N	447.482	1.868	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccn3ccnc3c1)C2	1800641694	HMPOKFJDRNXEHN-JYYAWHABSA-N	435.322	1.711	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=N/O[C@H]1CCCCO1)C2	1800641998	PZFIBHHBTIPVND-XPLDTJOOSA-N	446.342	1.279	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1noc3c1CCCC3)C2	1800757402	YGMBEWSUUIUDPI-MCYUEQNJSA-N	426.311	1.540	50	20	IDGD	
COc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)Br)c(OC)c1	1800760235	KENUZZVZJLFZTN-JRATXPSKSA-N	441.322	1.690	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1csc3c1CCCO3)C2	1800974874	GCIFQZCUOHUZPQ-NOXHYTERSA-N	428.938	1.530	50	20	IDGD	
C[C@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](O)CNC(=O)OC(C)(C)C)C2	1801959424	TVTFBPVYHQVLJD-PDWCTOEPSA-N	448.358	1.294	50	20	IDGD	
C=C[C@@H]1C[C@]1(NC(=O)OC(C)(C)C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](O)CCl)C2	1804408578	NMASBASJGRJOJU-ATCDCCBLSA-N	441.956	1.694	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)c1n[nH]c(C2CC2)c1F	1805124580	WZFNCMRKHHYFIS-IYOUNJFTSA-N	435.887	1.741	50	20	IDGD	
CN1CCN(CCC(=O)NC[C@@H]2CCN(C(=O)C(Cl)Cl)[C@@H]2c2cccnc2)CC1	1806915739	COPPDYBVOZIUST-FUHWJXTLSA-N	442.391	1.529	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H]2CC=CCC2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1	1807367103	XGUFMDRFYGLXLO-AGHHOFFYSA-N	433.317	1.437	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H](CNC(=O)[C@@H](C)NC=O)[C@@H]1c1cccnc1	1808381721	DOCDCAZDPACURR-OJLVUWQFSA-N	425.327	1.395	50	20	IDGD	
COc1ncc(C(=O)N2CCCC3(CCN(C(=O)CCC(=O)NN(C)C)CC3)C2)cc1C	1808840533	CIAORSFHVOVFGI-UHFFFAOYSA-N	445.564	1.616	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2cnn3cccnc23)[C@@H]1c1cccnc1	1809745334	OYWWKCRUPQJLQV-SZMVWBNQSA-N	442.907	1.698	50	20	IDGD	
Cc1cc(C(=O)NC[C@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)ccn1	1810789612	BFBUDXJVZTWBNY-KNQAVFIVSA-N	438.532	1.478	50	20	IDGD	
Cc1nnc(CC(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@@H](C)Br)CC3)o1	1815494887	GTBGSPHCALCVTG-VXNVDRBHSA-N	428.312	1.773	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1)[C@H]1COc2ccccc2O1	1815672129	JTTRUVONIVNYAK-JJRVBVJISA-N	434.880	1.842	50	20	IDGD	
Cc1ncccc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1816390708	IKILAOIMQAADRN-GOSISDBHSA-N	448.487	1.731	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)C(C)(C)F)CC2	1817280546	ZARILJGLJCRSDA-IVWJEFBKSA-N	434.497	1.937	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(Cl)o2)[nH]n1)c1ccc(B(O)O)cc1	1817471828	QBDZRUKBCJIZAS-HNNXBMFYSA-N	442.668	1.956	50	20	IDGD	
CC1=C(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)[nH]n2)CCO1	1817696601	QAOONNUTROQRFT-QGZVFWFLSA-N	439.476	1.408	50	20	IDGD	
CN1CCN(C2(C(=O)N3CCCC[C@@H]3c3cc(NC(=O)[C@H](F)Cl)n[nH]3)CC2)CC1	1818041150	BVWXTBBPIHTSJO-ZBFHGGJFSA-N	426.924	1.716	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3n[nH]cc3[N+](=O)[O-])sc2C1	1820303698	YVPDTPFGOUFJNF-JGVFFNPUSA-N	428.858	1.254	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1)c1nn[nH]c1C(F)(F)F	1820323572	PVTSTWYJIUNVEY-IUCAKERBSA-N	435.794	1.452	50	20	IDGD	
CC[C@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CN2CCN(C(C)=O)CC2)[nH]n1	1820855580	ZDVKXVFIANBHDK-DOTOQJQBSA-N	438.960	1.583	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN2CC(=O)NC2=O)[nH]n1	1820862895	WKUFSWGSDYIXCM-GTNSWQLSSA-N	445.307	1.190	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](N)CCC(N)=O)[nH]n1	1820864176	RXCXGRUFKUBMSI-QAGHZCBJSA-N	433.340	1.231	50	20	IDGD	
C[C@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](F)Br)n[nH]1)n1cnnn1	1820936925	HYSFIJGTPBDHQD-UISBYWKRSA-N	429.254	1.340	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)Cn1cc([N+](=O)[O-])cn1)CC2	1825993018	DACLOTWSAQVOND-ONGXEEELSA-N	442.885	1.114	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@H]1CCCS1(=O)=O)CC2)C(Cl)Cl	1826103746	ZVFGYEITLSPDTQ-GMSGAONNSA-N	426.347	1.436	50	20	IDGD	
O=C(CC1CCOCC1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827050676	CMJAPPYDDGNXEO-QFIPXVFZSA-N	442.365	1.416	50	20	IDGD	
CC(C)=NO[C@H](C)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827052656	VLEPEZWPAQGHLI-DYESRHJHSA-N	443.353	1.401	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H]2CCCS2)CC1	1828926106	ZBLFCTGYVLBKGO-OALUTQOASA-N	445.589	1.814	50	20	IDGD	
C[C@@H](Nc1cccnc1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830359700	SWZNJSSFAVFYJK-IIBYNOLFSA-N	438.956	1.603	50	20	IDGD	
O=C(c1cnc(O)nc1O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](F)Br)CC1	1830378404	MDXJRNIVWMIOLD-QWHCGFSZSA-N	445.289	1.812	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnnc(Cl)c3)C2)C1	1831644553	ZPAWWPYGPHBQED-KBXCAEBGSA-N	431.320	1.608	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3n[nH]c4c3CCCC4)C2)C1	1831646247	JYAILRWPBLSJJA-IIBYNOLFSA-N	438.956	1.766	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@H](C)N2CCN(C)CC2)CC1	1831833395	NMMXEEFPKZKOLK-SXLOBPIMSA-N	443.032	1.496	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3sccc3F)CCO2)C1	1831922821	OZYYFKZPIKYUGT-BDJLRTHQSA-N	435.315	1.741	50	20	IDGD	
O=C(Cc1ccc(Cl)s1)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1	1832599503	CLCNZMKTMKXAMF-DYVFJYSZSA-N	437.345	1.000	50	20	IDGD	
O=C(/C=C\c1c[nH]c2ccccc12)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1	1832732703	VTBLRBWIDCDDCG-VDXKNXLBSA-N	447.919	1.237	50	20	IDGD	
CC(=O)NC(C)(C)C(=O)N1CCC(N2CCC(NC(=O)C(C)(C)CCl)CC2)CC1	1833213113	CPCPSTMYNGXCIY-UHFFFAOYSA-N	429.005	1.738	50	20	IDGD	
CC(C)N(C)CC(=O)N1CCC(N2CCC(NC(=O)[C@@H](C)CBr)CC2)CC1	1833266323	ZIQGNXPCPPWGBB-INIZCTEOSA-N	445.446	1.929	50	20	IDGD	
N#Cc1cccc(CCC(=O)N2CCC(N3CCC(NC(=O)[C@H](O)CCl)CC3)CC2)c1	1833305859	AGXVZVIXBRVGLQ-OAQYLSRUSA-N	446.979	1.662	50	20	IDGD	
CC[C@H](C)[C@H](O)C(=O)NC1CCN(C2CCN(C(=O)[C@H](C)Br)CC2)CC1	1833503757	ZGRFDBQIZNFRBH-ZQIUZPCESA-N	432.403	1.748	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3c(F)c(C)nn3C)CCO2)C1	1833702864	OPIMPAICIISVSL-IFXJQAMLSA-N	430.908	1.345	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccccc3O)CCO2)C1	1833751880	HTFUXLSNJNJSNR-IFXJQAMLSA-N	441.322	1.493	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)Cn3ccnc3)CC2)CC1	1834264079	QWZAVNNRYYPOAS-HNNXBMFYSA-N	440.386	1.486	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)Cc3ccccc3F)C2)C1	1834822418	MTTYYELAEHDTOW-LJQANCHMSA-N	443.313	1.610	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)CCC(F)(F)F)CCO2)C1	1835319131	ODMCEAMZUDYBFR-DOMZBBRYSA-N	445.276	1.816	50	20	IDGD	
CNC(=O)CC(=O)N1CCC(OC2CCN(C(=O)[C@H](C)CBr)CC2)CC1	1836670480	PJODAQZZDSTFKD-CYBMUJFWSA-N	432.359	1.152	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)C(F)(F)C(F)F)C2)C1	1837709916	AXFSBDCCFZRWJB-OAHLLOKOSA-N	430.471	1.195	50	20	IDGD	
C[C@@H]1CCC[C@H]1C(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1	1837920174	GCYNFIHHIBCFKT-VGOFRKELSA-N	442.365	1.415	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3oncc3C)CCO2)C1	1838400199	QIQCAKFGALDIEI-GUYCJALGSA-N	430.299	1.227	50	20	IDGD	
CCN1CCC(C(=O)N2CCC(OC3CCN(C(=O)[C@H](Cl)COC)CC3)CC2)CC1	1838785831	IUCMDVCYOSZPLZ-HXUWFJFHSA-N	444.016	1.971	50	20	IDGD	
Cc1cccnc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839198607	KGDSTTGPMQAOEJ-YOEHRIQHSA-N	430.274	1.151	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)c(F)c1	1839201551	ASEOLSQZMDZHTQ-MAUKXSAKSA-N	447.276	1.895	50	20	IDGD	
Cc1cc(F)cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)c1	1839202176	WNSJLSIRTUEKKB-QAPCUYQASA-N	447.276	1.895	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cn3cnc4ccccc43)CCO2)C1	1840102808	WMLNUMRAHHEVMV-KKSFZXQISA-N	434.924	1.510	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCBr)C3)C2)c(O)c1	1840667907	IODCRVYKESLZKU-LJQANCHMSA-N	441.322	1.556	50	20	IDGD	
Cc1ccc(C(=O)NCC(=O)N2CC3(CCCN3C(=O)[C@H](C)CBr)C2)cc1	1841290001	GGFLVFGZVOZEPV-OAHLLOKOSA-N	436.350	1.959	50	20	IDGD	
Cc1ccc(S(=O)(=O)CC(=O)N2CCCC23CN(C(=O)[C@@H](F)Br)C3)cc1	1842759276	WMFNSXOMGYRVTB-OAHLLOKOSA-N	447.326	1.663	50	20	IDGD	
O=C([C@H](Br)Cc1ccccc1)N1CC2(CCCN2C(=O)c2cc(O)n[nH]2)C1	1842984700	KLBHYXGOLVFBFM-CQSZACIVSA-N	433.306	1.939	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)Cc2nc(C)no2)C1	1843059441	IBDLNAJCTBYREQ-UHFFFAOYSA-N	443.416	1.271	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1ccn3cncc3c1)C2	1843416190	JMFNRLOIYXXINJ-MFKUBSTISA-N	433.472	1.285	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)C13CCC(C(=O)OC)(CC1)CC3)C2	1846362449	FUKYNNFDNBCEJN-APMMTJHUSA-N	426.941	1.957	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)C1=C3c4ccccc4C(=O)N3CC1)C2	1846363005	JRAKCXRSRBJJBC-KRWDZBQOSA-N	429.904	1.714	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1ccc[n+]([O-])c1	1848095757	MUNRNVMPNFYLIH-JYJNAYRXSA-N	438.912	1.268	50	20	IDGD	
Cc1n[nH]c(C)c1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1848099122	BXNMLASTDLGESV-KKUMJFAQSA-N	439.944	1.974	50	20	IDGD	
Cn1nncc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](Br)Cc1ccccc1	1848282051	YVEQVZVLMVAEFY-PMPSAXMXSA-N	432.322	1.637	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cncc(S(C)(=O)=O)c1	1848325963	IUEKBTLFZJRCSK-HOTGVXAUSA-N	425.583	1.152	50	20	IDGD	
CC(C)(C)NC(=S)NNC(=O)C1CCN(S(=O)(=O)c2cc(F)ccc2F)CC1	14895448	XACMHFGRNIAPLW-UHFFFAOYSA-N	434.534	1.659	50	20	IDGD	
CN(CC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)Cc1ccccc1N1CCOCC1	15039193	QCUQOKPXVWSDEL-UHFFFAOYSA-N	427.461	1.324	50	20	IDGD	
C#CCNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2ccc(Br)s2)cc1	26071162	NGFDSQFHKQSLFY-UHFFFAOYSA-N	442.316	1.497	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1)c1csc(N2CCOCC2)n1	109339988	XQPLWHWJKWLHOW-MRXNPFEDSA-N	447.536	1.792	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)NCc2cccc(S(=O)(=O)N3CCCCC3)c2)n1	726272812	SIXGBWKCAMZKOI-UHFFFAOYSA-N	448.549	1.205	50	20	IDGD	
C=CCn1c(=O)c2ccccc2n2c(SCC(=O)NNC(=O)c3cccn3C)nnc12	726538137	CMANUTIDKLGHEL-UHFFFAOYSA-N	437.485	1.122	50	20	IDGD	
CCOc1ccc(/C=C(\C#N)C(=O)NCCC(=O)N2CCN(c3ncccn3)CC2)cc1	726544848	YRCMQHMHPXUQIJ-KNTRCKAVSA-N	434.500	1.637	50	20	IDGD	
CCS(=O)(=O)N[C@H](CCSC)C(=O)NNC(=O)c1c(Cl)cccc1Cl	727793590	UDCOCHRTIHDPQN-LLVKDONJSA-N	428.363	1.815	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)[C@H]2CCCN(S(=O)(=O)c3ccccc3)C2)c1	728206003	PPCPKIODBBGNQI-INIZCTEOSA-N	446.529	1.355	50	20	IDGD	
C#CCNC(=O)C1CCN(C(=O)NNC(=O)c2ccc(Br)cc2Cl)CC1	728954298	BGXDVHMXWKKFMQ-UHFFFAOYSA-N	441.713	1.918	50	20	IDGD	
Cc1cc(C)c(NC(=O)CNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c(C)c1	728959294	JNANHNSOQYIPLU-UHFFFAOYSA-N	439.520	1.587	50	20	IDGD	
COc1ccccc1OCCCNC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	729611224	KXHVFFZWRDQEOF-UHFFFAOYSA-N	425.445	1.355	50	20	IDGD	
COC1CCN(C2(CNC(=O)NNC(=O)COc3ccccc3C#N)CCCC2)CC1	730913410	HNVNOIJURZMDDB-UHFFFAOYSA-N	429.521	1.691	50	20	IDGD	
CS(=O)(=O)CCCC(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	731186963	XTDXQOZFSDBHDF-UHFFFAOYSA-N	442.497	1.031	50	20	IDGD	
O=C(COc1cccnc1)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	732050727	HXRAVAGMWFQOPV-UHFFFAOYSA-N	429.436	1.680	50	20	IDGD	
CSc1cccc(N2C[C@H](C(=O)NNC(=O)CCN3C[C@H](C)O[C@H](C)C3)CC2=O)c1	732262394	SCMGVLZJWVCQIR-OWCLPIDISA-N	434.562	1.408	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)NCCC(=O)N1CCN(c2ncccn2)CC1)c1ccccc1	732458831	LVHQQTFNBUZUJK-SFHVURJKSA-N	439.520	1.040	50	20	IDGD	
O=C(NCCCCN1C(=O)c2ccccc2C1=O)NNC(=O)c1ccc2c(c1)OCCO2	732471294	ICPRUCPERPKKSP-UHFFFAOYSA-N	438.440	1.478	50	20	IDGD	
O=C(CN1CCN(c2nn3cc(-c4ccc(F)cc4)nc3s2)CC1)NNC(=O)C1CC1	733194381	NOQOCNLHYPMQOP-UHFFFAOYSA-N	443.508	1.276	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)NCc2cc3c(nc2O)CCC3)c2ccccc2c1=O	733650972	BCRUARDVBXTSQJ-UHFFFAOYSA-N	436.472	1.711	50	20	IDGD	
Cc1nn(-c2ccccc2)c2sc(C(=O)NNC(=O)N[C@H](C)CS(C)(=O)=O)cc12	733660876	YIQVQEQLOFOKEP-LLVKDONJSA-N	435.531	1.773	50	20	IDGD	
CN1CCC(N2CC[C@H](NC(=O)NNc3ccc(S(=O)(=O)C(F)(F)F)cc3)C2)CC1	734284089	QSRPHYZDEAOIPO-AWEZNQCLSA-N	449.499	1.775	50	20	IDGD	
CN1C(=O)C[C@H](C(=O)NNC(=O)c2nnc(O)c3ccccc23)[C@H]1c1cccc(Cl)c1	734417773	UJEPLWPBBYBDNW-MAUKXSAKSA-N	439.859	1.969	50	20	IDGD	
CCOCCCN1CC[C@@H](NC(=O)NNC(=O)c2cc(Br)c[nH]2)[C@@H](C)C1	734683304	GVFVAZMEAUMATP-GXTWGEPZSA-N	430.347	1.858	50	20	IDGD	
Cc1cc(N(C)C)ccc1CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	734687000	AZJCTHGAEJDRSS-UHFFFAOYSA-N	433.534	1.456	50	20	IDGD	
CCOC(=O)c1cc(S(=O)(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)cc([N+](=O)[O-])c1C	734807334	LKTXHBKQXXVAGB-KRWDZBQOSA-N	449.441	1.393	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCC[S@@](=O)Cc2ccccc2)cc(OC)c1OC	735087793	OCHOMHVLFOZUOY-SSEXGKCCSA-N	435.502	1.605	50	20	IDGD	
CC(C)(C(=O)NNC(=O)NCCNS(=O)(=O)c1ccccc1[N+](=O)[O-])c1ccccc1	735100524	UARUWTWJIVNOOS-UHFFFAOYSA-N	449.489	1.181	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNc3ncccc3S(=O)(=O)N3CCN(C)CC3)cc2C1	735117555	WYWKSGGFUUDSEZ-CQSZACIVSA-N	449.602	1.961	50	20	IDGD	
C[C@H](C(=O)NNC(=O)COc1ccc(C#N)cc1)N1CCN(c2ccc(F)cc2)CC1	735460468	XOOWMJKKJRBNRS-MRXNPFEDSA-N	425.464	1.434	50	20	IDGD	
COC[C@@H](C)CNC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	737064450	GRSRRBONMRCLJB-HNNXBMFYSA-N	434.518	1.392	50	20	IDGD	
O=C(NNS(=O)(=O)c1cccc(I)c1)c1ccc2c(c1)OCO2	739667024	IMKHRDLPAQZJFV-UHFFFAOYSA-N	446.222	1.643	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N[C@@H]2CCC[C@@H](S(C)(=O)=O)C2)cc1Br	740915710	QLHXOFNNKLEWGT-VXGBXAGGSA-N	448.339	1.758	50	20	IDGD	
CCn1c(=O)c(=O)[nH]c2cc(C(=O)NNC(=O)NCc3cccc(C(F)(F)F)c3)ccc21	742457806	PHKGTGPTITWXPM-UHFFFAOYSA-N	449.389	1.873	50	20	IDGD	
O=C(NNC(=O)[C@@H](c1ccccc1F)N1CCOCC1)C1CCN(c2ncccn2)CC1	742635391	NCELTTACCCQHHA-LJQANCHMSA-N	442.495	1.053	50	20	IDGD	
CCOc1cc(N2CCN(C)CC2)ccc1NC(=O)NNC(=O)COc1ccccc1O	743242531	KHVWWKVLJBQIHD-UHFFFAOYSA-N	443.504	1.774	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)NCCOCCS(C)(=O)=O	743518809	UTMJKDGWZGDRAV-UHFFFAOYSA-N	426.520	1.124	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)CNC(=O)c1ccco1)Oc1ccc(Br)cc1	743576823	KCAGUFMTBJLTKZ-LLVKDONJSA-N	439.266	1.570	50	20	IDGD	
COc1ccccc1O[C@H](C)CNC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	743691483	LILCSVGWOSSKNQ-CYBMUJFWSA-N	436.490	1.902	50	20	IDGD	
O=C(CN1CCC(n2c(O)nc3ccccc32)CC1)NNC(=O)c1ccc([N+](=O)[O-])cc1	744427464	WWYHGWJREWDGHV-UHFFFAOYSA-N	438.444	1.748	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)[C@H](c2cccc(F)c2)N2CCOCC2)cc1	745423972	LZTOQVRARXAKEZ-FQEVSTJZSA-N	440.431	1.075	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)N[C@H]3C[C@@H]3C3CCCCC3)nc2)CC1	745858458	RFMPMNOIEKMQJH-MSOLQXFVSA-N	436.582	1.613	50	20	IDGD	
C[C@@H]1C[C@H](NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)C(=O)N1c1ccccc1	745881749	LWUJVSFAEJCYEE-DYVFJYSZSA-N	434.456	1.072	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1cc(-c2ccccn2)no1	746330514	BUGLVQNAIDUBRJ-UHFFFAOYSA-N	429.458	1.514	50	20	IDGD	
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC[C@@H](C(=O)NNc2cc(F)c(F)c(F)c2)C1	746707177	ZVFTYEILEFEISL-LLVKDONJSA-N	431.440	1.988	50	20	IDGD	
Cn1ccnc(NNC(=O)C2CCN(S(=O)(=O)c3ccc(C(C)(C)C)cc3)CC2)c1=O	747938367	UCBPMYFRIYCKDT-UHFFFAOYSA-N	447.561	1.622	50	20	IDGD	
N#Cc1cccc(NNC(=O)C2CCN(S(=O)(=O)c3ccc4c(c3)OCCO4)CC2)c1	748033023	SBOCAXJXRFXTNM-UHFFFAOYSA-N	442.497	1.873	50	20	IDGD	
CCS(=O)(=O)N1CCC[C@H](C(=O)NNc2nc(-c3ccccn3)nc3c2CCC3)C1	748337169	ACZDNGFOJDJYJH-AWEZNQCLSA-N	430.534	1.532	50	20	IDGD	
CC[C@H](Oc1cccc(C)c1)C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	750405444	GBAUKCVURLLYJN-QFBILLFUSA-N	428.441	1.683	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)N[C@H]1CCN(c2cccc(Cl)c2)C1=O	750671418	SBYAHIXNVIWQPT-HNNXBMFYSA-N	440.847	1.738	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)NCC2CCN(CC(=O)NC(C)(C)C)CC2)c1	751111057	LHNPPPGNCMETQU-UHFFFAOYSA-N	449.552	1.275	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)[C@H]2CCCN(C(=O)c3ccc4n[nH]cc4c3)C2)c1	751290517	MVGAROSBFUYBRM-KRWDZBQOSA-N	435.484	1.950	50	20	IDGD	
C[C@H]1C[C@H](CNC(=O)OC(C)(C)C)CN1CC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	752085233	NGTSHYBXTYENNS-UONOGXRCSA-N	435.481	1.591	50	20	IDGD	
Nc1nc(Cl)cc(NNC(=O)CS(=O)(=O)Cc2cccc(Br)c2)n1	753463400	DVXPAXMUNZNQSL-UHFFFAOYSA-N	434.703	1.533	50	20	IDGD	
O=C(NNc1cc(C(F)(F)F)ccc1F)C1=NN([C@@H]2CCS(=O)(=O)C2)C(=O)CC1	754154042	RSPMDMXZGKOXGS-SNVBAGLBSA-N	436.387	1.453	50	20	IDGD	
CC(C)Oc1cccc(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)n1	755181464	SREAENGADIURPF-UHFFFAOYSA-N	433.534	1.562	50	20	IDGD	
O=C(NCCN1C(=O)[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)NNC(=O)Nc1ccc(OC(F)F)cc1	755261586	YLMMBFKQCKPCCL-LWWSYDQCSA-N	449.414	1.431	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2ccc(NC(=O)NNC(=O)Cc3ccncc3)cc2)C[C@H](C)O1	755422322	JUXDSJBEYBWZLZ-GJZGRUSLSA-N	447.517	1.275	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)Nc1ccc(CNS(C)(=O)=O)cc1	756628520	NNUYAHUTNVSSFF-UHFFFAOYSA-N	438.531	1.689	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)Nc1ccccc1OCC(=O)N1CCOCC1	756873130	HTQWFNPMOWFXBZ-UHFFFAOYSA-N	442.472	1.294	50	20	IDGD	
COc1cccc(OC)c1CC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	756901159	HTFGXTMCGVCCTE-UHFFFAOYSA-N	447.513	1.492	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)c1cncc(I)c1	756996574	QEMMOBSSNLJVIS-UHFFFAOYSA-N	433.209	1.947	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)COc2ccccc2C#N)cc1-n1nnnc1C1CC1	757620349	DMPLJMDUUCJJIA-UHFFFAOYSA-N	448.443	1.652	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2ccc(F)cc2OCC#N)cc1	757682393	KOACKBUESXSFOB-UHFFFAOYSA-N	449.464	1.510	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1)c1cn[nH]c1	757722051	NGDMTEGXVFGWPH-CQSZACIVSA-N	431.460	1.817	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)Nc2cc(OC)ncn2)c2ccccc2c1=O	757758221	FGGNHDWDDVMZQS-UHFFFAOYSA-N	425.449	1.852	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)Nc2cnn(-c3cnc4ccccc4n3)c2)c1	757782934	NJHAFXIWRSWTIS-UHFFFAOYSA-N	431.416	1.635	50	20	IDGD	
CCOCCS(=O)(=O)NCC(=O)NNC(=O)c1cc(-c2ccco2)nc2ccccc12	758152275	QQYVZOFVRTZSFE-UHFFFAOYSA-N	446.485	1.212	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1cccnc1Br	758159373	WGNJODWOMBMFPT-UHFFFAOYSA-N	426.296	1.520	50	20	IDGD	
CC(=O)N[C@H](CC(=O)N1CCN(S(=O)(=O)CBr)CC1)c1ccc(C)cc1	758527075	GAMXSBZDHAJFIR-MRXNPFEDSA-N	446.367	1.389	50	20	IDGD	
COc1ccc(Cl)cc1N1CC[C@@H](NC(=O)NNC(=O)C(=O)Nc2ccccn2)C1	758742029	SPZZLARCZLAOPN-CYBMUJFWSA-N	432.868	1.291	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NN=C2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)ccc1Cl	760232974	PMVSMCFXSGYDFG-ZDUSSCGKSA-N	440.869	1.993	50	20	IDGD	
C[C@@H](CC(=O)NNC(=O)Cc1ccccc1F)NS(=O)(=O)c1cccnc1Cl	760555767	LBWVRMOLTUFEBL-NSHDSACASA-N	428.873	1.321	50	20	IDGD	
O=C(CSCC(F)(F)F)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	761192087	UDIRVPLDKNQAOR-UHFFFAOYSA-N	425.454	1.528	50	20	IDGD	
CCc1ccccc1N1C[C@@H](C(=O)OCC(=O)NNC(=O)Cc2nc(C)cs2)CC1=O	761415309	CBSSPCZYLQKUBH-HNNXBMFYSA-N	444.513	1.300	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)CNC(=O)c1cccnc1)c1cccc(C(=O)c2ccccc2)c1	762262986	JDELHLMKDLMENQ-MRXNPFEDSA-N	430.464	1.994	50	20	IDGD	
C[S@@](=O)Cc1ccccc1NC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	762929816	RNRQZISIJGVJGA-WJOKGBTCSA-N	443.573	1.930	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)cc1	762937859	MZOWERXDVBGZOV-UHFFFAOYSA-N	445.457	1.466	50	20	IDGD	
O=C(NNC(=O)c1ccccc1)C(=O)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1	763429667	JFMXPGGYUCDANY-LJQANCHMSA-N	432.484	1.730	50	20	IDGD	
COC(=O)CCc1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2Br)cc1	763483887	WAWKEGVHKRXFSW-UHFFFAOYSA-N	448.273	1.954	50	20	IDGD	
CCN(CC)C(=O)Cn1ccc2cc(NC(=O)C(=O)NNC(=O)c3cccnc3)ccc21	763491932	QWNZMPQXWOXBAY-UHFFFAOYSA-N	436.472	1.304	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)C(=O)Nc1ccccc1OCc1cscn1	763548629	OOYSFTIZWNHTKL-UHFFFAOYSA-N	440.437	1.851	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cnc(Br)c(C)c1	763716573	JEKKGTMXBNNRAW-UHFFFAOYSA-N	435.278	1.880	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(C(N)=O)ccc2F)cc1	763767402	IIPUZELSKHNFSM-UHFFFAOYSA-N	430.436	1.749	50	20	IDGD	
CC(C)Sc1ccccc1NC(=O)C(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	763790333	HXXPWBVLCTWTGN-UHFFFAOYSA-N	439.497	1.834	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)ccc1NC(C)=O	763867978	ZKAOXGICRVUNFP-NSHDSACASA-N	432.408	1.346	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(C)c([N+](=O)[O-])c2)cc1	763872574	ONCIZRRZMIIJSU-ZDUSSCGKSA-N	428.401	1.659	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(C(N)=O)c(Cl)c2)cc1	763878264	OJCPUPLFIZXFNE-NSHDSACASA-N	446.847	1.195	50	20	IDGD	
COCCOc1ccc(C#N)cc1NC(=O)C(=O)NNC(=O)CSc1ccc(C)cc1	763896699	RZGGEKWDCCNVPQ-UHFFFAOYSA-N	442.497	1.770	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)CCC(=O)N3C)cc1OC	763902256	TYMSNWUQXXLYHM-UHFFFAOYSA-N	440.456	1.403	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1cccn(Cc2ccc(F)cc2)c1=O	764041359	SHEJYCKXDUBZFR-UHFFFAOYSA-N	438.415	1.444	50	20	IDGD	
O=C(NNC(=O)c1cccc2ccccc12)C(=O)Nc1ccc(CN2C(=O)CNC2=O)cc1	764048387	KNFXCAZOOFUBGT-UHFFFAOYSA-N	445.435	1.291	50	20	IDGD	
COc1ccc(Br)c(NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)c1	764154827	VHXDRWGMWNHJKT-OAHLLOKOSA-N	434.246	1.547	50	20	IDGD	
CN1CCC[C@@H](N(C)C(=O)c2ccc(NC(=O)C(=O)NNC(=O)CC3CCCC3)cc2)C1	764187110	BXSKZEVCMNTFBM-LJQANCHMSA-N	443.548	1.519	50	20	IDGD	
COC(=O)N(C)Cc1ccc(NC(=O)C(=O)NNC(=O)CCCc2ccccc2)cc1	764224439	QUBNKEGDWBKWOT-UHFFFAOYSA-N	426.473	1.994	50	20	IDGD	
CN(C)C(=O)COc1ccc(NC(=O)C(=O)NNC(=O)CCCc2ccccc2)cc1	764225911	CTAOFTFNYCOJAM-UHFFFAOYSA-N	426.473	1.262	50	20	IDGD	
Cc1ccn(-c2ccccc2NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)n1	764350416	FPRJDCUVRJKUQU-UHFFFAOYSA-N	429.440	1.766	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2ccccc2-n2cccn2)n[nH]1	764376583	FSWWCULDDJQISV-UHFFFAOYSA-N	445.439	1.671	50	20	IDGD	
Cc1cccc(Oc2ccc(Cl)cc2NC(=O)C(=O)NNC(=O)[C@@H]2COCCO2)c1	764434005	PJPXRBOJUWQDGS-KRWDZBQOSA-N	433.848	1.942	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)NCCOCC(F)(F)C(F)F)c2ccccc2c1=O	765644353	BQAWBVBRJLXOPA-UHFFFAOYSA-N	447.389	1.838	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1	767304875	KJDWMEHHWQCMKJ-UHFFFAOYSA-N	437.412	1.636	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)CCC(=O)N2CCN(c3ccccc3)CC2)c1	767853510	UJWYPQCZNUOZGC-UHFFFAOYSA-N	439.516	1.384	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)Cn1nnc(-c2ccc(Br)cc2)n1	768264186	LLCREXQKSLZRNS-UHFFFAOYSA-N	429.278	1.801	50	20	IDGD	
CC(C)[C@H](CNC(=O)NNC(=O)[C@@H](C)Oc1cccc(Cl)c1)N1CCN(C)CC1	770127239	CRXJJDOWSWVMEY-QAPCUYQASA-N	425.961	1.710	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2nn(-c3ccccc3)cc2C)cc1	770211130	AAMOQGLDKGJJTQ-UHFFFAOYSA-N	441.513	1.571	50	20	IDGD	
C[C@H](CBr)COC(=O)c1cc(S(=O)(=O)N(C)C)ccc1N1CCOCC1	770333894	YIAYAFLLEKUQKQ-CYBMUJFWSA-N	449.367	1.961	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1ccc2c(c1)C(=O)N(CCc1ccccc1)C2=O	771968880	POGWAHWUWBMKMX-CQSZACIVSA-N	437.452	1.628	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)N[C@H](c1ccc(F)c(Cl)c1)C(F)(F)F	772628229	LACZFEOTJIMOAY-LDYMZIIASA-N	431.795	1.848	50	20	IDGD	
CC(C)[C@@H](C(=O)NNC(=O)[C@H](C)Oc1ccc2ccccc2c1)N1CCCS1(=O)=O	772630786	MJGTZLOXCDPZFM-KXBFYZLASA-N	433.530	1.815	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)Nc1cnn(Cc2nnc3n2CCCC3)c1	772639324	DYJDOGDFZIPXNG-ZDUSSCGKSA-N	442.455	1.619	50	20	IDGD	
COC(=O)c1ccc(C(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)c(F)c1	773387990	BHHTVBHREBHSMZ-UHFFFAOYSA-N	442.491	1.500	50	20	IDGD	
O=C1Nc2ccccc2C[C@H]1CCC(=O)N1CCN(S(=O)(=O)CBr)CC1	777777117	FISPDNAADIRVRN-CQSZACIVSA-N	444.351	1.404	50	20	IDGD	
CC(C)C[C@H](C(=O)NNC(=O)CNC(=O)OC(C)(C)C)N1C(=O)[C@H]2CC=CC[C@H]2C1=O	778445871	VIQADZOWKGLKAM-QLFBSQMISA-N	436.509	1.024	50	20	IDGD	
NC(=O)c1ccc(F)c(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2Br)c1	778753471	SOWOEMWZTUPKTM-UHFFFAOYSA-N	440.185	1.677	50	20	IDGD	
O=C(NNC(=O)[C@H](O)[C@H](O)c1nc2ccccc2s1)c1cccc(Br)c1	779526064	ULFGSGYRCXDYIO-KGLIPLIRSA-N	436.287	1.914	50	20	IDGD	
COc1cc(S(=O)(=O)NNC(=O)c2cccc(C#N)c2)c(OC)cc1Br	780386550	GWACDIUNOOCCQH-UHFFFAOYSA-N	440.275	1.961	50	20	IDGD	
N#CC1=CCN(C(=O)C2CCN(S(=O)(=O)c3ccc4c(c3)OCCCO4)CC2)CC1	780688273	BGCIWVJSHVUPNS-UHFFFAOYSA-N	431.514	1.931	50	20	IDGD	
COC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)cc1F	782886924	MBNZFJCSYOYRAF-UHFFFAOYSA-N	442.407	1.219	50	20	IDGD	
CC1CCN(C(=O)c2ccccc2NC(=O)C(=O)NNc2ccc(-n3cccn3)nn2)CC1	783432895	HIMBWZOHNMSYER-UHFFFAOYSA-N	448.487	1.616	50	20	IDGD	
CNC(=O)c1cc(Oc2ccccc2NC(=O)C(=O)NNc2nccnc2Cl)ccn1	784776576	MHRFKKQQCJOCDS-UHFFFAOYSA-N	441.835	1.759	50	20	IDGD	
CCNC(=O)COc1ccc(NC(=O)C(=O)NNc2nc(C(F)(F)F)cs2)cc1	785145557	GVXCWHINYAIUTF-UHFFFAOYSA-N	431.396	1.759	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3ccn(C4CCN(C)CC4)n3)cc2C1	787542631	CCSWFHHEYFHBKG-CYBMUJFWSA-N	444.561	1.736	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)[C@H](CCS(C)(=O)=O)c2ccccc2)cc1	789116121	KUKBQOCPUQGIMG-GOSISDBHSA-N	432.498	1.518	50	20	IDGD	
COc1nc(Br)ccc1NC(=O)C(=O)NNC(=O)c1ccc(Cl)cc1O	789585137	YKOJQMQJMWEZAF-UHFFFAOYSA-N	443.641	1.611	50	20	IDGD	
Cn1nc(-c2ccc(F)cc2F)cc1NC(=O)C(=O)NNC(=O)COCc1ccccc1	789740329	UVMYSGZPMSCTPR-UHFFFAOYSA-N	443.410	1.668	50	20	IDGD	
CC[C@@H]1CCc2nc(NC(=O)C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)sc2C1	789741010	MSXSSBZMKJNEGP-LLVKDONJSA-N	440.489	1.033	50	20	IDGD	
COc1c(C)cnc(Cn2cnc(NC(=O)C(=O)NNc3cc(F)c(F)c(F)c3)n2)c1C	789774039	KNOITBIWJDXNNQ-UHFFFAOYSA-N	449.393	1.846	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)[C@](C)(O)Cn2ccc(C)cc2=O)c1	790647763	UOOZTTKHODJNLT-GOSISDBHSA-N	438.278	1.140	50	20	IDGD	
O=C(NNc1nc2ccccn2n1)C1CCN(S(=O)(=O)/C=C/c2ccccc2)CC1	791248016	GTRDHXOWQUTJAP-RVDMUPIBSA-N	426.502	1.885	50	20	IDGD	
CCCS(=O)(=O)Nc1cccc(NC(=O)C(=O)NNc2nc3ccccn3n2)c1C	792391826	IJPMCICYNMPPMU-UHFFFAOYSA-N	431.478	1.271	50	20	IDGD	
CCc1c(NC(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)cnn1-c1cccc(Cl)c1	792487003	VLTKVWAHPXISJN-JTQLQIEISA-N	428.902	1.179	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)[C@@H]1CC(c2cc(OC)ccc2OC)=NO1	792629113	KDSJPUDFXQGWLH-FQEVSTJZSA-N	427.457	1.986	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H](C)N(C)CC(F)(F)F)c1	792774765	WALFWWGROICUAM-GFCCVEGCSA-N	438.472	1.361	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)N1CCN(C(=O)OC(C)(C)C)C[C@H]1c1nccn1C	792903968	FSACZXDWFUFPSK-HOTGVXAUSA-N	436.557	1.596	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)NNC(=O)c2cccc(C)n2)cc1Br	794598239	DJQLRRMEYDYTOK-UHFFFAOYSA-N	427.280	1.734	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)n1	797371161	PQZKEIRMFNIXGP-ZIAGYGMSSA-N	429.452	1.542	50	20	IDGD	
CCCCNS(=O)(=O)c1ccc(C)c(NC(=O)NNC(=O)Cn2nc(C)cc2C)c1	799471210	AYTXCKJOZIARKI-UHFFFAOYSA-N	436.538	1.740	50	20	IDGD	
C[C@H](C(=O)NNC(=O)N=c1cc[nH]cc1)N1C(=O)c2ccc(Br)cc2C1=O	802027529	KPAYGJBBTAKMSY-SECBINFHSA-N	432.234	1.103	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)[C@H](CSC)N2C(=O)[C@H]3CCCC[C@H]3C2=O)cc1	802063261	XHLRRLAVMNSFSF-XHSDSOJGSA-N	434.518	1.755	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)[C@@](C)(O)Cn2c(C)cccc2=O)c(OC)cc1Cl	802078302	LFSINABKQUXHBE-IBGZPJMESA-N	438.868	1.431	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)NC[C@@H]2CCCC[C@@H]2NS(C)(=O)=O)c1C	804495781	SIPYTQGUZUHPEP-FMYIBSAGSA-N	436.578	1.883	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)[C@@H]1CC(=O)N(CCOc2ccccc2Cl)C1	804952372	KUZFJVZSUPIHOZ-CQSZACIVSA-N	441.879	1.686	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)NCCCN1C(=O)c2ccccc2C1=O	805818359	HCOJBPQETMSDPA-UHFFFAOYSA-N	428.470	1.501	50	20	IDGD	
COCCOc1ccc(S(C)(=O)=O)cc1NC(=O)NNc1ccc(-n2ccnc2)nn1	806737182	QCIGHFUGFIRFJX-UHFFFAOYSA-N	447.477	1.240	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(F)c(N3CCCNC3=O)c2)c1	806973165	BULQVEWCMWXRAU-UHFFFAOYSA-N	443.435	1.219	50	20	IDGD	
CN(C)C(=O)CN1[C@H]2CC[C@H]1CC(NC(=O)NNC(=O)Cc1c[nH]c3ccccc13)C2	807515078	WBKJTDDDZUOGFK-IRXDYDNUSA-N	426.521	1.124	50	20	IDGD	
O=C(CCc1ccco1)NNC(=O)C(=O)Nc1ccc(Br)c([N+](=O)[O-])c1	810386963	ZDCJJMPPAOJULS-UHFFFAOYSA-N	425.195	1.669	50	20	IDGD	
NC(=O)c1ccc(OCC(F)F)c(NC(=O)C(=O)NNc2cnc3ccccc3n2)c1	810387892	KBVPEYBNALSSFK-UHFFFAOYSA-N	430.371	1.454	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)CNS(=O)(=O)c2ccc3ccccc3c2)n1	810560456	AUAXACPXZSKBAA-UHFFFAOYSA-N	428.518	1.898	50	20	IDGD	
CCOC(=O)c1ccc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cc1	810593231	VQVYINSZJACEEZ-UHFFFAOYSA-N	438.484	1.082	50	20	IDGD	
COCc1cc(Cl)cc(S(=O)(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)c1	811691237	MSZKEPHRMHQRFF-UHFFFAOYSA-N	446.312	1.766	50	20	IDGD	
COC(=O)c1cn(-c2cccc(NC(=O)C(=O)NNc3ccc(OC)c(Cl)c3)c2)nn1	812987290	IYKPKVCEPICZLF-UHFFFAOYSA-N	444.835	1.798	50	20	IDGD	
COc1ccc(CN(C)C)cc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	813033071	CZUKTIQMZAJTKV-UHFFFAOYSA-N	449.533	1.089	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)[C@@H](O)c1ccc(Cl)cc1F	813363145	CWXAAGDXTQDVMK-FQEVSTJZSA-N	434.899	1.872	50	20	IDGD	
N#Cc1cc(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)ccc1Br	815568585	NOGSKCBOASQEGF-HNNXBMFYSA-N	429.230	1.410	50	20	IDGD	
COC(=O)Nc1cccc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)N(C)C)c1	815751992	XKHDOTNSZZLFIW-UHFFFAOYSA-N	435.462	1.197	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)[C@H](CC(F)F)NC(=O)OC(C)(C)C	817053419	QLCQILJPDZNGOW-LBPRGKRZSA-N	436.481	1.929	50	20	IDGD	
O=C(NNC(=S)NCCc1cccs1)C1CCN(c2ccc3nncn3n2)CC1	819432564	WIZNCRZKUPTJHQ-UHFFFAOYSA-N	430.563	1.140	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@H](CSC)N2C(=O)[C@H]3CCCC[C@@H]3C2=O)cc1OC	859323314	ZOHAWGKDMGGMAI-KKUMJFAQSA-N	449.529	1.372	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccccc1F)NNC(=O)c1ccc(COc2ccccc2)o1	913229304	WUAQHVUXYSOEQI-UHFFFAOYSA-N	447.444	1.737	50	20	IDGD	
NC(=O)CC[C@@H](NC(=O)OCc1ccccc1)C(=O)NNC(=O)c1cccc(Cl)c1	914431535	GXOHLISUFPNCSO-MRXNPFEDSA-N	432.864	1.662	50	20	IDGD	
COc1ccc(C=NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)c(O)c1	914692669	UWNTULIGDSBZPA-UHFFFAOYSA-N	447.513	1.505	50	20	IDGD	
COc1cc(C=NNC(=O)CN2CCCC2=O)ccc1OS(=O)(=O)c1ccc(C)cc1	916357909	RHKZXNHMNSJXDZ-UHFFFAOYSA-N	445.497	1.844	50	20	IDGD	
COc1cccc(/C=C(\C#N)C(=O)OCC(=O)NCCc2ccc(S(N)(=O)=O)cc2)c1	916598983	DPTDVPIEAOUINQ-GZTJUZNOSA-N	443.481	1.152	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)NCCNc2ncccc2C#N)c2ccccc2c1=O	916641331	WCOJIUFTZOYOLF-UHFFFAOYSA-N	434.460	1.300	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCc2cc3ccccc3o2)cc1	916646246	FEZWITDJLJWNFN-UHFFFAOYSA-N	430.486	1.892	50	20	IDGD	
CCCCS(=O)(=O)N1CCC(C(=O)NNC(=O)CNc2ccc(OC)cc2)CC1	916987238	UMVPRYARNUIXND-UHFFFAOYSA-N	426.539	1.096	50	20	IDGD	
C[C@@H]1CN(S(=O)(=O)c2cc(C(=O)NNC(=O)C(C)(C)C)ccc2Cl)C[C@@H](C)O1	917182655	QNFDFYAVVHKZNY-VXGBXAGGSA-N	431.942	1.945	50	20	IDGD	
COc1cccc([C@@H](C)NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)c1	918109565	QDHGQYZMZSCKEB-OAHLLOKOSA-N	434.518	1.716	50	20	IDGD	
O=C(NNC(=O)[C@H](Cc1ccccc1)NC(=O)c1cccnc1)c1cccc([N+](=O)[O-])c1	921296906	VNZNINNLTMQJOH-IBGZPJMESA-N	433.424	1.792	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)[C@@H](C(C)C)N2C(=O)c3ccccc3C2=O)c1	929086524	IGMBPGXLBIKFES-GOSISDBHSA-N	425.441	1.786	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)Nc2ccnn2C[C@H]2CCOC2)n[nH]1	1255199469	LXRZFDPDXTXGTL-CYBMUJFWSA-N	425.449	1.785	50	20	IDGD	
Cn1c(C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)cc(Br)c1C=O	1318949869	VHGBKFBYGXGILK-UHFFFAOYSA-N	433.218	1.090	50	20	IDGD	
COc1cccc(OC)c1S(=O)(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1	1320700946	QXKXQTFWXKRAGF-UHFFFAOYSA-N	443.522	1.660	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccncn2)C1	1778152573	JLEJXAFZKYTTKY-JCKWVBRZSA-N	425.327	1.635	50	20	IDGD	
Cc1cnc2c(C(=O)N3CC[C@]4(C3)CN(C(=O)[C@](C)(Cl)CCl)CCO4)cnn2c1	1778525412	FUMIQYXIDGWGGL-MOPGFXCFSA-N	440.331	1.718	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](C)Nc3cnccn3)C2)C1	1779062837	WRYISLBHZFZHLC-SUNYJGFJSA-N	440.342	1.280	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cn(C)c3ncccc23)C1	1779193426	LZMSEBYVZQXPPW-JBYIUTFZSA-N	448.951	1.955	50	20	IDGD	
Cc1cccc(C)c1NC(=O)C(=O)N1CCO[C@]2(CCN(C(=O)CO[Si](C)(C)C)C2)C1	1779299857	GVCQBELYGOPEBA-QFIPXVFZSA-N	447.608	1.923	50	20	IDGD	
Cn1c(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)cc2c[nH]c3nccc-3c21	1780035166	IXBBXMKGQXPNEB-KKSFZXQISA-N	445.907	1.049	50	20	IDGD	
CN(C)c1ccc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)cc1	1780728135	ODQBUDVHRSRVQM-QAPCUYQASA-N	428.302	1.887	50	20	IDGD	
CSCC[C@@H](O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Br)C1	1780777466	SQEMDZYGBZXYCF-NFFDBFGFSA-N	441.363	1.305	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)c3nccc4nc[nH]c34)CCO2)C1	1781227390	KUYRQFDWTLBVSZ-ZWKOTPCHSA-N	426.304	1.638	50	20	IDGD	
O=C(c1ccc2n[nH]cc2c1)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781331064	KIMLFWCIPUVZBZ-WMLDXEAASA-N	425.258	1.697	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)N1C[C@H]3C[C@H]3C1)C2	1782175070	BOMUHBFZPSTSHL-XWUBNECOSA-N	427.973	1.094	50	20	IDGD	
CSCC[C@H](O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Br)C2	1782232272	DXAWIKVRGKNDKT-RSUWNVLCSA-N	441.363	1.305	50	20	IDGD	
O=C([C@H](O)CCl)N1CCO[C@@]2(CCN(C(=O)[C@@H]3CCc4cccc(Cl)c43)C2)C1	1782852632	FBKOYUICQICUQM-AKCHCHLHSA-N	427.328	1.799	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)COc3ccc(F)cc3)CCO2)C1	1783532616	LIDMKVFOLPXSIK-FZKQIMNGSA-N	429.286	1.818	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccc4nn(C)cc4c3)CCO2)C1	1783536279	ILUOHLSNQAIUEE-ORAYPTAESA-N	435.322	1.800	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)/C=C3\C(=O)Nc4ccccc43)CCO2)C1	1783877611	LXHFQQGBUFNJLL-VWELDODOSA-N	433.892	1.106	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cc(O)c(O)c(Cl)c3)CCO2)C1	1783882224	WTXMLJCVGWNNGN-FZKQIMNGSA-N	433.288	1.449	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1ccc(C(C)(C)C)nc1)CCO2	1783933424	YOTZWXWJQCXFCW-QHCPKHFHSA-N	445.564	1.196	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(=O)cco3)C[C@@H]21	1783968547	WUGFHJRGEIJGQV-DSPQJCBJSA-N	427.295	1.264	50	20	IDGD	
COC1(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]3C2)CCC1	1783975613	OOFKAHSXZWQGHM-VGWMRTNUSA-N	431.371	1.956	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@]3(C)CC=CCC3)C2)C1	1784752348	IBZRURPPSFNAEF-JPRVSBAYSA-N	441.532	1.697	50	20	IDGD	
O=C(CN1CCc2sccc2C1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Cl)C[C@@H]21	1785100123	RNXGHRWXIQUXRY-YRBFXIGRSA-N	429.945	1.620	50	20	IDGD	
COc1cccc(CCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CO[Si](C)(C)C)C[C@@H]32)n1	1785228328	OORWDAOFVWYJOR-WDSOQIARSA-N	449.624	1.854	50	20	IDGD	
Cc1ccc(CCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Br)C[C@@H]32)cn1	1785262145	BNDWKYAAFUEPFS-NBOOPKSLSA-N	442.329	1.993	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc(OCF)cn3)[C@H]2C1	1785687084	YGNRHNBJFYWXQA-AYDFFVQHSA-N	428.892	1.783	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)c1csc2c1CCCO2	1787255860	VRZALCDANKCORD-YUDUHTQSSA-N	428.938	1.266	50	20	IDGD	
C[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21)N1CSCSC1	1788685285	ABUWEMCMOZHJBN-CYDGBPFRSA-N	442.434	1.813	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)c1ccc(-n2cccn2)cc1	1790108632	KBSFUEXMORGPOQ-WNHJNPCNSA-N	432.908	1.065	50	20	IDGD	
C[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Cl)C[C@@H]21)[S@](=O)c1ccccc1	1790595331	HSUBNWKHXVGRNW-HNQNNMDFSA-N	430.929	1.697	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C/N=C/c3ccco3)C[C@@H]21	1790961068	WEIIOJCQADONDJ-RYWIAXKTSA-N	440.338	1.852	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc(O)cn3)C[C@@H]21	1790963976	QNJDTVOCZSLOMQ-SJWGOKEGSA-N	440.338	1.483	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cn4ccccc4n3)C[C@@H]21	1791058086	YENWBFYDXPROPQ-HOSILWTGSA-N	435.322	1.711	50	20	IDGD	
Cc1cnn([C@@H](C)C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]3C2)c1	1791064963	NRCLQSDCPLJJPK-YXMSTPNBSA-N	427.343	1.516	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C[C@@H](N)c1cccnc1)C2	1792868012	QCZZMRORPBLCPX-VJHAZISPSA-N	439.354	1.092	50	20	IDGD	
Cc1ccc(O)c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)CBr)c1	1792872511	LNNWFZTZNSXGHV-VWPFQQQWSA-N	425.323	1.935	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCCOc1ccc(Cl)cc1)C2)[C@@H](O)CCl	1792975827	ZLYODYRYAWNWGC-CSHUHZATSA-N	445.343	1.688	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1COc2ccccc2O1	1793846990	YBEOKGSOYQHNTC-PMUIAIRXSA-N	439.306	1.199	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)COCc1ccccc1	1795422796	HJUKRBRYQFIRNF-RMRDIRSESA-N	439.350	1.824	50	20	IDGD	
C[C@@H](Nc1cccnc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2	1795604159	PBWGQHHJQPXCLC-VWPFQQQWSA-N	425.327	1.257	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(C(F)F)no1	1795915704	LOJYVPYQKDLDKR-WJZNIJOASA-N	436.253	1.989	50	20	IDGD	
COc1ccc(-c2cc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@@H](F)Cl)n[nH]2)cc1	1796362975	LRDJPBUOXZOSRY-JGTCGTHISA-N	436.871	1.823	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](COC)NC(=O)OC(C)(C)C	1796394084	FXOZJIXBADZSEF-QRJUGERDSA-N	447.960	1.133	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccs1)C2	1796441253	ORUYAEYKZNVSKZ-MGRLTOJPSA-N	429.502	1.085	50	20	IDGD	
Cc1nc2sccn2c1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCC(=O)NN(C)C)C2	1798218048	QEZXTKWXPXHKNM-QDMKHBRRSA-N	432.550	1.329	50	20	IDGD	
CSc1ncccc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2	1798331051	PGFIZJKLGDTONC-LFSVMHDDSA-N	432.315	1.697	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2)c1cccc(OC2CCOCC2)n1	1798374198	UHQOPISFHXCGFC-JGTCGTHISA-N	441.887	1.377	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ncn(C)n1)C2	1799220029	GRILQXUTUMGDGD-BTTYYORXSA-N	442.432	1.214	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc(F)c(F)c1)C2)[C@H](F)Br	1799346172	GZOKOPCIEXQRQT-OJXGSEEGSA-N	435.240	1.787	50	20	IDGD	
Cc1c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](F)Br)cn2[nH]cnc(=O)c12	1800161401	VROSYIGQTUOCQK-FBKDDSFISA-N	440.273	1.273	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)Br)C1	1800762852	HHDOQUULAYPDJF-GTDBDLECSA-N	445.354	1.339	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(Cl)Cl	1801015903	WYOGBQMUWOUIGF-RNJOBUHISA-N	436.336	1.389	50	20	IDGD	
CC(=O)N[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(Cl)Cl)c1ccc(F)cc1	1801016386	HGUSFWZUTVHNNR-OCVGTWLNSA-N	446.306	1.396	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2ccnc(F)c2)[C@H]1c1cccnc1	1803848411	YDFNBMOCPBFENW-LAUBAEHRSA-N	442.495	1.308	50	20	IDGD	
CCOc1cnc(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)cn1	1804912503	NZNUUMOQGQNDFB-QILLFSRXSA-N	433.896	1.190	50	20	IDGD	
O=C(CCBr)NC[C@@H]1CCN(C(=O)c2cc(CO)on2)[C@H]1c1cccnc1	1806344041	VKTFOGUAIGQHEC-GUYCJALGSA-N	437.294	1.667	50	20	IDGD	
CC(C)N1CCC(C(=O)N2CCCC3(CCN(C(=O)CCC(=O)NN(C)C)CC3)C2)CC1	1806645435	JTMGMOBNVZSRTN-UHFFFAOYSA-N	449.640	1.711	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2cc(=O)n3[nH]cnc3n2)[C@@H]1c1cccnc1	1807356539	CFCPDWHDVFCVDK-ZQIUZPCESA-N	443.895	1.150	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2ccc(F)cc2)[C@H]1c1cccnc1	1811906212	WNPNDPLYRMBXNT-XMSQKQJNSA-N	441.507	1.913	50	20	IDGD	
COc1ccc(CC(=O)Nc2cc([C@@H]3CCCCN3C(=O)[C@@H](O)CCl)[nH]n2)cc1O	1814647622	SJFUXFITRKBAIV-HOCLYGCPSA-N	436.896	1.958	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)C(=O)C1CC1)CC2	1817276196	OUATXOPFPIVHEP-LPUHGPTISA-N	442.501	1.168	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc(Cl)o2)[nH]n1)c1ccc(B(O)O)cc1	1817471829	QBDZRUKBCJIZAS-OAHLLOKOSA-N	442.668	1.956	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc(=O)nc3cccnn23)[nH]n1)[C@@H](F)Cl	1818041876	XKAMOSBWDVRETL-BDJLRTHQSA-N	433.831	1.653	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCc2nc(N)n[nH]2)n[nH]1	1819286025	WTQRWTUDPGDFIK-KOLCDFICSA-N	439.318	1.518	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccccc2O)[nH]n1	1819402199	UHTXWPCAFZZOKK-KRWDZBQOSA-N	449.471	1.734	50	20	IDGD	
Cc1ccc(CC(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)o1	1822903290	GWIDANTVSPJXPM-LJQANCHMSA-N	436.277	1.540	50	20	IDGD	
CC(=O)N/C(C)=C/C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](C)Br)CC2	1824477309	BFXNRKIEVZQVDF-RDGXFMKGSA-N	429.340	1.878	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](C)NC(C)=O)sc2C1	1825226679	LHZKHDWRWYAHEL-MIMYLULJSA-N	431.356	1.753	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)C#Cc1ccccc1)CC2	1826085534	ZOMWIMCPOJYJIE-MRXNPFEDSA-N	439.541	1.480	50	20	IDGD	
Cc1n[nH]c(C)c1C(=O)N[C@@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1	1826088619	YWRRGHYNMUETSJ-GFCCVEGCSA-N	433.538	1.082	50	20	IDGD	
CCc1oncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827050964	IBBOZGSTDYTWHD-FQEVSTJZSA-N	439.321	1.464	50	20	IDGD	
CC(C)(C)[C@@H](O)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1	1828923271	BCXJRCXWDSVJBU-MOPGFXCFSA-N	445.564	1.325	50	20	IDGD	
Cc1ocnc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1	1829431422	XCBGVOBOFRHOKD-LJQANCHMSA-N	425.294	1.210	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(F)nc3F)CCO2)C1	1829524365	GKIJDCZWALFLHO-LIRRHRJNSA-N	431.867	1.837	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CN2C(=O)C=CC2=O)CC1	1830321779	ROXILNPLCFAYQB-QRWLVFNGSA-N	444.359	1.767	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)C3CC(F)(F)C3)C2)C1	1830534149	XJADJJXVKKRJIM-BLLLJJGKSA-N	439.297	1.519	50	20	IDGD	
CCC1(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)COC1	1831274853	GYJXOHPQERTXEN-HXUWFJFHSA-N	428.338	1.026	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cc(C)n(C)n3)C2)C1	1831639845	FCAMRXPORFDIIB-PXNSSMCTSA-N	426.945	1.135	50	20	IDGD	
CN[C@H](CC(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H](C)Br)CC1)C(=O)O	1831649552	BOQJVJMAHPMCHU-BPLDGKMQSA-N	432.359	1.452	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CN2CCN(C)CC2)CC1	1831655320	NRIPBBOGCCONFO-FUHWJXTLSA-N	443.430	1.637	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)[C@H]2CCCS2)CC1	1832435200	YROXQWCAHDWTNB-WOJBJXKFSA-N	430.379	1.495	50	20	IDGD	
CC[C@H](NC(C)=O)C(=O)NC1CCN(C2CCN(C(=O)[C@H](C)Br)CC2)CC1	1833097314	LXOIAIDQOHDWDM-GUYCJALGSA-N	445.402	1.256	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1)[C@@H]1CCCCO1	1833112979	RJUQKEWKAQKHSD-JKSUJKDBSA-N	434.350	1.818	50	20	IDGD	
CC[C@@H](NC(C)=O)C(=O)N1CCC(N2CCC(NC(=O)C(C)(C)CCl)CC2)CC1	1833213418	OZIKFTQXHDPBEF-GOSISDBHSA-N	429.005	1.738	50	20	IDGD	
Nc1ccccc1/C=C/C(=O)NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1834741928	ZEIJMPFIIGZQPV-RRFGBZISSA-N	434.968	1.453	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)CNC(=O)c3ccco3)CC2)CC1	1834869968	HCQITFCMKIQOFJ-KRWDZBQOSA-N	438.956	1.598	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)c1nccc2[nH]ccc12	1835015687	GMDGSYLJELEZTL-GOSISDBHSA-N	433.940	1.348	50	20	IDGD	
COc1cc(C(=O)NC2CCN(C3CCN(C(=O)C(Cl)Cl)CC3)CC2)nn1C	1836204269	AXXSZIDVLUZDLI-UHFFFAOYSA-N	432.352	1.418	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)C3=CCCS3)CC2)CC1	1836899330	GLEDOPABNRQKCG-UHFFFAOYSA-N	438.594	1.379	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)Cn3ccnc3)CC2)CC1	1837534822	GPDXCZYXPLIPBQ-CQSZACIVSA-N	427.343	1.665	50	20	IDGD	
CCOC(CC(=O)N1CCOC[C@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1)OCC	1837717666	LQTVBOSILWMJSX-HXUWFJFHSA-N	446.617	1.084	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(F)c3[N+](=O)[O-])C2)C1	1839147594	WXDTUTKXGDYFQP-AUUYWEPGSA-N	443.859	1.821	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(C)cn3)C2)C1	1839963505	MNTOKSNISSXZLH-HNAYVOBHSA-N	440.338	1.634	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3CC4(CCC4)C3)C2)C1	1840035968	BNHGVBNEORKPSO-KUHUBIRLSA-N	429.355	1.807	50	20	IDGD	
C[C@@H](Oc1ccccn1)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1840422813	LDMGOKRNUZLQEZ-IERDGZPVSA-N	439.940	1.570	50	20	IDGD	
C[C@]1(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)CC=CCC1	1840557188	SBBKMJODTNLZBU-JCGIZDLHSA-N	433.318	1.880	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3c(C)cc(C)cc3C)CCO2)C1	1840673568	IVKCNTPZXCWDRX-GCJKJVERSA-N	438.952	1.936	50	20	IDGD	
COc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)ccc1[N+](=O)[O-]	1840757998	LHBYYIRSSHAAJN-MAUKXSAKSA-N	445.831	1.208	50	20	IDGD	
COc1cc(C(=O)N2CCCC23CN(C(=O)[C@H](O)CCl)C3)nn1-c1ccccc1F	1843184782	AUSHMNKPKGGHEP-MRXNPFEDSA-N	436.871	1.437	50	20	IDGD	
O=C(c1ccc2nnc(Br)n2c1)N1CC2(CCCN2C(=O)[C@H](F)Cl)C1	1843363549	LLPWDRFMCJHPBJ-NSHDSACASA-N	430.665	1.843	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2n[nH]c3c2CC[C@@H]3C)C1	1843727636	GMSUOOQTULWYGP-NYATXJBFSA-N	437.504	1.410	50	20	IDGD	
CC(=O)N1CCC(N2CCC(C(=O)N3CCCC34CN(C(=O)[C@@H](F)Cl)C4)CC2)CC1	1843951927	FVABDGUXLGCVDC-GOSISDBHSA-N	442.963	1.447	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)[C@H](O)C(C)(C)C)C2	1844691959	SKUJDSFQZMRQBI-KRWDZBQOSA-N	433.461	1.744	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@H]1CC(=O)CN1C(=O)OC(C)(C)C)C2	1845163096	FMJWHPZCLXUCLK-CABCVRRESA-N	427.929	1.786	50	20	IDGD	
O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)[C@@H](F)Br)C1	1845220625	DCEOPFRILJQEEH-SJDLMVEWSA-N	429.242	1.711	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC2(CCCN2C(=O)[C@H](O)NC(=O)OC(C)(C)C)C1	1845436455	JQCOQVOGGVMTQH-NEPJUHHUSA-N	434.331	1.064	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC[C@H]2[C@@H]1CCN2C(=O)C1(c2ccccc2)CCCC1	1847425747	JISNLXDMVHOWPE-VXKWHMMOSA-N	432.329	1.694	50	20	IDGD	
COc1cc(OC)c(C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1OC	3446017	ROYMSSFLYXWJCQ-UHFFFAOYSA-N	433.373	1.239	50	20	IDGD	
CS(=O)(=O)N1CCCc2cc(C(=O)NNC(=S)NCCc3cccs3)ccc21	11519484	SEASIKQPAICDBO-UHFFFAOYSA-N	438.600	1.812	50	20	IDGD	
O=C(COC(=O)CCN1C(=O)COc2ccccc21)NNC(=O)c1ccc(Cl)cc1	17989131	QFALAOFDZYFSSG-UHFFFAOYSA-N	431.832	1.460	50	20	IDGD	
O=C(NNC(=O)N1CCOCC1)c1cccc(S(=O)(=O)Nc2ccccc2Cl)c1	27338084	WDPOOEPUVKKUMY-UHFFFAOYSA-N	438.893	1.827	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNS(=O)(=O)c1ccc2c(c1)C[C@@H](C)N2C(C)=O	28679109	XETUXXSKNSIMNC-CQSZACIVSA-N	447.513	1.771	50	20	IDGD	
Cc1cc(C)c(S(=O)(=O)NCCC(=O)NNC(=O)c2ccc3c(c2)OCCO3)c(C)c1	105281441	SXRFJPYYVRFEOQ-UHFFFAOYSA-N	447.513	1.513	50	20	IDGD	
CC(C)C[C@H](C(=O)NNC(=O)c1ccc2c(c1)OCO2)N1C(=O)[C@H]2CC=CC[C@H]2C1=O	197984216	NTWTXTRQOFWHFO-OWCLPIDISA-N	427.457	1.542	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NC[C@H](O)c1ccccc1C(F)(F)F	725873753	QRDXBFPSLVFMCL-LBPRGKRZSA-N	430.408	1.561	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)cc1C(=O)O	727720631	STWBTEUWNANHMY-UHFFFAOYSA-N	435.458	1.349	50	20	IDGD	
CN(C)N(C(=O)c1cccc(CS(=O)(=O)NC(C)(C)C)c1)[C@H]1CCS(=O)(=O)C1	728161969	QTTAORQZFZFYGW-INIZCTEOSA-N	431.580	1.010	50	20	IDGD	
Cc1nn(-c2ccc(S(N)(=O)=O)cc2)c(C)c1CCC(=O)NNC(=O)CC(C)(C)C	728612565	UBWFSPNAZJTDGF-UHFFFAOYSA-N	435.550	1.653	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2ccc(N3C[C@@H](C)O[C@H](C)C3)nc2)n1	728722274	OCFQNVOBRJYYIP-ZIAGYGMSSA-N	447.517	1.007	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)C2CCN(C3=NS(=O)(=O)c4ccccc43)CC2)c1	728828294	QPTNJRKNUZVCJP-UHFFFAOYSA-N	437.481	1.180	50	20	IDGD	
CCOc1ccc(CN2C(=O)c3ccccc3C2=O)cc1C(=O)NNC(=O)Cc1cc[nH]n1	730103166	YYTBVIYSWXOSCV-UHFFFAOYSA-N	447.451	1.608	50	20	IDGD	
O=C(NNC(=O)c1cc(F)ccc1N1CCOCC1)c1csc(N2CCOCC2)n1	730769716	XBRWOQSJSQIWKW-UHFFFAOYSA-N	435.481	1.030	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NC[C@H](C)N(C)Cc1ccccc1	732236085	NZZXRAQDKIVAMG-HNNXBMFYSA-N	446.577	1.753	50	20	IDGD	
O=C(COC(=O)C1CCN(CC(F)(F)F)CC1)NNC(=O)c1cccc([N+](=O)[O-])c1	732325205	KXISRNDIAGOCDF-UHFFFAOYSA-N	432.355	1.173	50	20	IDGD	
CCN1CCC[C@H]1CN1C[C@H](C(=O)NNC(=O)c2cc(-c3ccc(C)cc3)[nH]n2)CC1=O	733358590	BHXGOXFTZJPLPX-MSOLQXFVSA-N	438.532	1.479	50	20	IDGD	
CC(=O)[C@H]1CC(C(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)=NN1c1ccccc1	733537288	AWXUGIYHNRRGRG-GOSISDBHSA-N	442.859	1.868	50	20	IDGD	
C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C	734241867	WVVDZDJGZBSCIP-NSHDSACASA-N	427.483	1.931	50	20	IDGD	
CC(C)[C@@H](CNC(=O)NNC(=O)CNC(=O)c1cccs1)NC(=O)OC(C)(C)C	734526558	XFIRBIZKXRWWGN-GFCCVEGCSA-N	427.527	1.358	50	20	IDGD	
Cc1cc(C)c(OCC(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)c(C)c1	735116893	KACDYHQTIHZUCJ-UHFFFAOYSA-N	447.561	1.465	50	20	IDGD	
Cc1cc(N2CCCS2(=O)=O)ccc1C(=O)NNC(=O)c1cc(Br)c[nH]1	741662691	SILXMKDTCLLRGZ-UHFFFAOYSA-N	441.307	1.700	50	20	IDGD	
O=C(CCn1c(=O)nc(O)c2ccccc21)NNC(=O)c1cccc(Br)c1	742771784	AQEJHNRJUUIKDP-UHFFFAOYSA-N	431.246	1.716	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@H]2CC(=O)N(Cc3ccccc3)C2)cc1	743830211	QGJKVZOYENKAIJ-HNNXBMFYSA-N	430.486	1.292	50	20	IDGD	
CCc1ccccc1N1C[C@H](C(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)CC1=O	743830453	FMQUANPSJQGKRO-OAHLLOKOSA-N	444.513	1.858	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1ccccc1Cn1cncn1	744620978	JZGMZRUBGQJUQR-UHFFFAOYSA-N	442.501	1.104	50	20	IDGD	
O=C(COC(=O)[C@@H](c1ccccc1F)N1CCOCC1)NNC(=O)c1ccc(Cl)cc1	745499072	QSTAQCUOPYHZQO-LJQANCHMSA-N	449.866	1.857	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)N[C@@H]2CC(=O)N(CCOc3ccccc3)C2)cc1C	745848717	WDAARXRHVRPLOF-GOSISDBHSA-N	440.500	1.693	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@@H]2CCc3c(O)cccc32)cc1	745865135	BQPYKFQSSUTQJN-QGZVFWFLSA-N	432.502	1.339	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccccc2Cn2cccn2)c1	746093798	MIFZXNZRIFINTE-UHFFFAOYSA-N	427.486	1.257	50	20	IDGD	
NC(=O)CC[C@H](C(=O)NNc1nc(-c2ccccc2)no1)N1C(=O)c2ccccc2C1=O	746241729	OOMGYOPTNGHYJN-OAHLLOKOSA-N	434.412	1.110	50	20	IDGD	
O=C(Cn1cc(C(=O)NNC(=O)c2nnc(O)c3ccccc23)cn1)NC1CCCCC1	746576091	FFLDAGHQEUSOPA-UHFFFAOYSA-N	437.460	1.056	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)Cc3ccncc3)CC2)cc1	747325146	UDPKTHZPPRAYRJ-UHFFFAOYSA-N	444.513	1.075	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)N2CCN(c3cnn(C)c3)C(=O)C2)c(C)n1C[C@@H]1CCCO1	750072698	RPGPCWACFJWQIN-KEBMYNNESA-N	436.516	1.800	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2cc(Br)c[nH]2)sc2nc3n(c(=O)c12)CCC3	750841427	AQSXNHRBCDJKPA-UHFFFAOYSA-N	436.291	1.878	50	20	IDGD	
CC1CCN(c2ccc(C(=O)NNC(=O)CNC(=O)c3ccco3)cc2[N+](=O)[O-])CC1	751211890	MHUKEYQYIAHGCX-UHFFFAOYSA-N	429.433	1.615	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3ccc(N(C)C)cc3F)cc2)CC1	752143778	NFUALKGAVBISCJ-UHFFFAOYSA-N	435.525	1.585	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)CN(C(=O)OC(C)(C)C)C2CC2)c2ccccc2c1=O	753008477	QRNVBIOPBPYBNN-UHFFFAOYSA-N	443.504	1.967	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)NCCn2c(O)nc3ccccc32)cc1	753035782	AJJCNONSOBOSQJ-CQSZACIVSA-N	427.461	1.939	50	20	IDGD	
C[C@H](C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1)c1ccc([N+](=O)[O-])cc1F	755068739	SNGPHSZOHVYLKA-APPDUMDISA-N	447.375	1.368	50	20	IDGD	
COC(=O)CNC(=O)c1ccc(NC(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)cc1	755547346	NYTVPGCTOAIPEP-LBPRGKRZSA-N	432.408	1.349	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)Nc1ccc(N2CCCS2(=O)=O)cc1	755591613	CVXPGXFNNPMNSR-UHFFFAOYSA-N	434.474	1.467	50	20	IDGD	
COCC(=O)NNC(=O)Nc1cc(Br)ccc1I	756220495	HIMMQQTVAKHSRX-UHFFFAOYSA-N	428.024	1.853	50	20	IDGD	
CN(NC(=O)c1cc2c(nc1O)CCCC2)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758785899	GVNINRKTIHXROD-UHFFFAOYSA-N	433.509	1.915	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)C2=Cc3cc(F)ccc3OC2)ccc1Cl	761206209	RUSCNZKMGKTUDA-UHFFFAOYSA-N	425.825	1.364	50	20	IDGD	
Cn1ccc([C@H](NC(=O)NNC(=O)CNC(=O)c2ccco2)c2ccc(Cl)cc2)n1	762571884	PYDCPWPWAJHLGY-QGZVFWFLSA-N	430.852	1.516	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc([S@@](=O)C(F)(F)F)cc1	763443023	WJXOIWQZEJQPDU-SSEXGKCCSA-N	444.347	1.622	50	20	IDGD	
O=C(NNC(=O)c1ccncc1)C(=O)Nc1cc(I)ccc1Cl	763463754	IBSHQMCEZBFVHK-UHFFFAOYSA-N	444.616	1.739	50	20	IDGD	
Cc1cc(Cl)ccc1OCCCC(=O)NNC(=O)C(=O)Nc1cc(C)c(=O)n(C)c1	763499180	FVAKYXMZZGAXMP-UHFFFAOYSA-N	434.880	1.601	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccnn2CCC(C)C)cc(OC)c1OC	763539522	MUFFEKXGOILNRI-UHFFFAOYSA-N	433.465	1.355	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)CCN3C(C)=O)cc1OC	763551135	TVKBUXPLSPZLLR-UHFFFAOYSA-N	426.429	1.013	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2cc(C)nn2C2CCOCC2)c1	763664885	LVJWSIATGNGBHL-UHFFFAOYSA-N	429.477	1.325	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cnn(C[C@@H]3CCCO3)c2)cc1	763768856	UTBLKOMWRWXUTK-IBGZPJMESA-N	443.504	1.887	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2cccc3cccnc23)c2ccccc2c1=O	763785556	HTJCLNMMXKARSB-UHFFFAOYSA-N	430.424	1.364	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNC(=O)c2nn(CC)c(=O)c3ccccc23)c(C)c1	763786950	SIMMVJBXDPMZDO-UHFFFAOYSA-N	437.456	1.523	50	20	IDGD	
Cc1ccc(-n2nc(NC(=O)C(=O)NNC(=O)COc3ccc(F)cc3)cc2C)cc1	763841478	RNLQKIQWVLBTAI-UHFFFAOYSA-N	425.420	1.793	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cnc3c(c2)c(C)nn3C)cc1	763872144	KRMIDBKTUGEQQA-ZDUSSCGKSA-N	438.444	1.033	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(Cl)c(C(N)=O)c2)cc1	763878382	PTZXYJFOSBUEIH-NSHDSACASA-N	446.847	1.195	50	20	IDGD	
CC[C@H](C)n1ncc(NC(=O)C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c1C1CC1	763916957	LLQPERAIEJNIJG-LBPRGKRZSA-N	437.464	1.107	50	20	IDGD	
C[C@]1(c2ccccc2)NC(=O)N(CC(=O)NNC(=O)CSc2ccccc2O)C1=O	764046513	MPPHPEXLRDWAAA-HXUWFJFHSA-N	428.470	1.099	50	20	IDGD	
Cc1nn(C)c2sc(C(=O)N[C@H](C)C(=O)NNC(=O)CSc3ccccc3O)cc12	764046581	OLSLRKYHDBZIRA-LLVKDONJSA-N	447.542	1.707	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H]1CCc2ncc(NC(=O)C(=O)NNC(=O)C3CCCC3)cc2C1	764069473	CUMICVKARKRAQC-HNNXBMFYSA-N	445.520	1.740	50	20	IDGD	
O=C(Cc1ccc2ccccc2c1)NNC(=O)C(=O)Nc1cc(-n2cnnn2)ccc1F	764083564	FPXCLESFNYWEAD-UHFFFAOYSA-N	433.403	1.283	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2O1)C(=O)Nc1ccc(OC[C@H]2CCCO2)cc1	764154333	PKZZLIWIPUODOR-IEBWSBKVSA-N	425.441	1.334	50	20	IDGD	
O=C(CCc1ccco1)NNC(=O)C(=O)Nc1ccccc1S(=O)(=O)N1CCCCC1	764170887	CDZPKDVPDSXDHW-UHFFFAOYSA-N	448.501	1.173	50	20	IDGD	
Cc1nc(COc2ccc(NC(=O)C(=O)NNC(=O)c3cccc4ncccc34)cc2)no1	764257742	MLWINTBVJPPFRF-UHFFFAOYSA-N	446.423	1.905	50	20	IDGD	
COc1c(C)ccc(NC(=O)C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1C	764258827	AELHIGIDMFNYIB-UHFFFAOYSA-N	426.477	1.105	50	20	IDGD	
CNS(=O)(=O)c1ccc(C)c(C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)c1	764333839	GJLLVZATRMZFAM-UHFFFAOYSA-N	438.456	1.830	50	20	IDGD	
Cn1ccnc1[C@](O)(CC(=O)NNc1c(F)cc(C(=O)NC2CC2)cc1F)C(F)(F)F	764335291	PQIVHPHRPLHSTK-QGZVFWFLSA-N	447.364	1.874	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)c(Cl)c1)C(=O)Nc1ccnn1Cc1ccccc1F	764350083	WRRALWUNVCINGR-UHFFFAOYSA-N	431.811	1.829	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)C(=O)Nc1ccc(NC(=O)NCc2ccco2)cc1	764386178	BBUHZCBHANROLZ-UHFFFAOYSA-N	436.428	1.704	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)cnn1-c1ccccc1F	764401949	UDTNJPZWAZBISM-UHFFFAOYSA-N	443.460	1.904	50	20	IDGD	
Cc1nc(-c2ccccc2)ncc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	764528160	OBBNMEXFJWYKRI-UHFFFAOYSA-N	439.497	1.777	50	20	IDGD	
O=C(NCc1cccc(Br)c1O)NNC(=O)C1CCN(c2ncccn2)CC1	764777716	FPCYGAIJXRIMRY-UHFFFAOYSA-N	449.309	1.692	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc2c3c(c1)CC(=O)N3CCC2)c1cnn(-c2ccccc2)c1	764933922	BUYKLYJOSJHFDG-UHFFFAOYSA-N	437.481	1.331	50	20	IDGD	
CC(C)C[C@H](C(=O)NNC(=O)CSc1ccccc1O)N1C(=O)[C@@H]2CC=CC[C@H]2C1=O	765248303	PWNLIDVLVGHIFX-BZUAXINKSA-N	445.541	1.998	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)c3cc(S(=O)(=O)N(C)C)c[nH]3)n[nH]2)cc1C	765567681	RGROMPTXWPOUQU-UHFFFAOYSA-N	430.490	1.347	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)CSc2nnc(-c3ccncc3)n2-c2ccccc2)n[nH]1	765587061	NOAAOPLOZWBTAR-UHFFFAOYSA-N	434.485	1.914	50	20	IDGD	
Cn1ccnc1[C@@](O)(CCNC(=O)NNc1ccccc1S(C)(=O)=O)C(F)(F)F	765690622	QHGDGBXBZYJURZ-HNNXBMFYSA-N	435.428	1.290	50	20	IDGD	
COc1ccc(CC(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)cc1OC	765749952	WKMYDXJVZNDOSZ-UHFFFAOYSA-N	440.544	1.520	50	20	IDGD	
CCc1nc(CC(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)cs1	765755266	RIVTZBCXMZIALP-UHFFFAOYSA-N	435.981	1.867	50	20	IDGD	
N#CCc1cccc(C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)c1	766664147	OFUGCTSAUNCRCN-UHFFFAOYSA-N	425.920	1.985	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)CCC(=O)c2ccc3c(c2)CCC(=O)N3)cc1	767607205	IGCKFWHKAXGDSX-UHFFFAOYSA-N	437.452	1.847	50	20	IDGD	
CC(C)c1cc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2F)n(-c2ncccn2)n1	768240917	CWDUBGHVRJMUKU-UHFFFAOYSA-N	445.842	1.978	50	20	IDGD	
CC(C)[C@H](NC(=O)OC(C)(C)C)C(=O)NCC(=O)NNC(=O)c1ccc2ccccc2n1	768280867	YPYCTBZBDWUFCZ-SFHVURJKSA-N	443.504	1.661	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCCn2cc([N+](=O)[O-])cn2)cc1Br	768527235	VJJSGFGERMRFQB-UHFFFAOYSA-N	427.215	1.207	50	20	IDGD	
COc1ccc2c(c1)[C@@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)CCO2	768529016	IXSAYPFZOBPNHS-KRWDZBQOSA-N	448.501	1.413	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)c1cnc(NC(=O)OC(C)(C)C)cn1	768639618	RVJNKBMLGJXIHE-UHFFFAOYSA-N	437.478	1.993	50	20	IDGD	
C[C@H]1CCC2=S=C(C(=O)NNC(=O)C(=O)Nc3ccnn3-c3cccc(F)c3)C=C2C1	770771943	QEXDRLAXARKXBG-LBPRGKRZSA-N	441.488	1.935	50	20	IDGD	
CCCCN1C(=O)c2ccccc2N2C(=O)CC[C@@]12C(=O)O[C@@H](C)C(=O)NNC(=O)CC	771966001	MEPJLRFNCBMRDB-RCDICMHDSA-N	444.488	1.255	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1cccnc1SCc1ccc(C(N)=O)cc1	771990896	CHMZFTRNGHNYSY-GFCCVEGCSA-N	430.486	1.576	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)Nc1cnn(Cc2nnc3n2CCCC3)c1	772642941	ZKMNPPARDOGWFB-UHFFFAOYSA-N	433.476	1.667	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2ccc3nc(Cl)sc3c2)c1	772857848	MXJIWPRPWCZBAT-UHFFFAOYSA-N	445.931	1.977	50	20	IDGD	
CN1CCC(=O)Nc2cc(C(=O)NNC(=O)C(=O)NCc3ccc(Cl)cc3)ccc21	772897795	MLNFDGCNPVCXCQ-UHFFFAOYSA-N	429.864	1.196	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1)C(=O)Nc1ccc(Br)cn1	773547678	XGEAFBNKXJUXSM-UHFFFAOYSA-N	447.224	1.773	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ncc(Cl)cc2Cl)cc1OCC(N)=O	773672689	HSPVCTSNXKFISS-UHFFFAOYSA-N	428.232	1.343	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)Nc1ccc(C[C@H]2NC(=O)NC2=O)cc1	775705154	YMHGNQGTKCZDJV-MEDUHNTESA-N	429.408	1.196	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCN(C(=O)C(C)(C)C)CC2(C)C)cc1OC	776036743	TVPDNJVNHZXANN-UHFFFAOYSA-N	434.537	1.434	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2c[nH]c3c(C)cc(C)cc3c2=O)c2ccccc2c1=O	776095954	BRBVAZJSUBCUPS-UHFFFAOYSA-N	431.452	1.950	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)COc2ccccc2-c2ccccc2)ccn1	776314238	HVJVPZPHGBXATQ-UHFFFAOYSA-N	426.454	1.236	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)[C@@H](c2cnn(C)c2)N(C)C(=O)OC(C)(C)C)c1	776315264	SIJMFVTZBOHJKK-QGZVFWFLSA-N	430.509	1.855	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)[C@@H](c2cnn(C)c2)N(C)C(=O)OC(C)(C)C)cc1	776327813	UCBIVSHGIOQHLU-GOSISDBHSA-N	430.509	1.896	50	20	IDGD	
Cc1cc2ccccc2nc1NNC(=O)[C@@H]1CC(=O)N(c2cccc(S(N)(=O)=O)c2)C1	777481941	ZTQXSHBSQUTUDE-OAHLLOKOSA-N	439.497	1.687	50	20	IDGD	
COC(=O)c1ccccc1NNC(=O)CN1C(=O)N[C@@](C)(c2ccc(OC)cc2)C1=O	777772687	IUSIFOLHGZDQHH-NRFANRHFSA-N	426.429	1.392	50	20	IDGD	
Cc1c(C(=O)NNC(=O)CNC(=O)OC(C)(C)C)nnn1-c1ccc2ncccc2c1	778433760	RCIUQCJWHOEUSM-UHFFFAOYSA-N	425.449	1.410	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)Nc1ccnn1Cc1cccc(Cl)c1Cl	779463183	YNSXXKFSSHAGIB-LLVKDONJSA-N	446.316	1.826	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)c1c(Cl)cccc1S(C)(=O)=O	779469542	HBINNJMVHHKQPA-UHFFFAOYSA-N	426.878	1.982	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NN=C1CCc2cc(O)ccc21	780188087	GMCFMYRWKOKDNX-UHFFFAOYSA-N	443.525	1.812	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1S(=O)(=O)NNC(=O)c1ccc(Cl)cc1F	780397455	ZBPRVTXOCODTEQ-UHFFFAOYSA-N	435.886	1.353	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)CN2CCN(C(=O)OCc3ccccc3)CC2)c1	780793151	YNNBBSYOQXGFOO-UHFFFAOYSA-N	426.473	1.871	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)NCCC(=O)N2CCN(c3ccccn3)CC2)c1	780827213	JIKPSFPQLMADNE-UHFFFAOYSA-N	426.477	1.233	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)N[C@@H]2CCN(c3cc(OC)cc(OC)c3)C2=O)c1	780842253	SUZQLTJADWEKSF-GOSISDBHSA-N	428.445	1.922	50	20	IDGD	
Cc1nc2c(C#N)cnn2c(C)c1CCC(=O)NNC(=O)CCNC(=O)OC(C)(C)C	780971706	RFFPMJOXUDDXIT-UHFFFAOYSA-N	429.481	1.213	50	20	IDGD	
CCC1(C(=O)NNC(=O)CNC(=O)c2ccco2)CCN(C(=O)c2ccccc2)CC1	781155000	WQUQQTPLSONZMN-UHFFFAOYSA-N	426.473	1.489	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2cccc(C(=O)NNc3ncncc3Cl)c2)C[C@H](C)O1	781813768	LSWANCYXLPGCJZ-RYUDHWBXSA-N	425.898	1.685	50	20	IDGD	
CCOc1cc(NC(=O)C(=O)NNC(=O)c2ccc(O)cc2)c([N+](=O)[O-])cc1OCC	782831972	JIRHGUFQFGTCDM-UHFFFAOYSA-N	432.389	1.498	50	20	IDGD	
O=C(NNC(=O)C(=O)NC1CC1)C(=O)Nc1cc(Cl)ccc1SCC(F)(F)F	782965062	DTBVKNQCWMSJRS-UHFFFAOYSA-N	438.815	1.359	50	20	IDGD	
O=C(CSc1nnnn1-c1ccc(Br)cc1)NNC(=O)c1ccccc1	783913459	SQGYSQZRLFELOH-UHFFFAOYSA-N	433.291	1.978	50	20	IDGD	
CC(C)c1cc(Br)ccc1NC(=O)C(=O)NNC(=O)C(=O)N1CCCC1	783998566	BRPCFNBDRARGGZ-UHFFFAOYSA-N	425.283	1.281	50	20	IDGD	
CC(C)(C)OC(=O)N1CCc2ncc(NC(=O)C(=O)NNc3ccc(Cl)nn3)cc2C1	784789592	KJMVLSLHLAURGL-UHFFFAOYSA-N	447.883	1.900	50	20	IDGD	
CN(C)C(=O)COc1ccc(NC(=O)C(=O)NNc2ccnc(Br)c2)cc1	784831237	XLZVTYNBDFGPAE-UHFFFAOYSA-N	436.266	1.393	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(NC(=O)C(=O)NNc2ccnc(Br)c2)c1	784837101	HEZVLZNIDIMIDC-UHFFFAOYSA-N	442.295	1.176	50	20	IDGD	
O=C(NNc1ccc(C(F)(F)F)nn1)C(=O)Nc1ccc(-n2cncn2)c(Cl)c1	784891662	XEHDDWRHLGIXLV-UHFFFAOYSA-N	426.746	1.811	50	20	IDGD	
Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)C(=O)NNc1ccnc(N(C)C)n1	784969520	NPUFIZHLGQHWAO-UHFFFAOYSA-N	432.444	1.992	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)Nc1ccc(N2CCCCC2)cc1	785023540	KQDKLOINMVCKIY-UHFFFAOYSA-N	427.417	1.690	50	20	IDGD	
O=C(COC(=O)[C@@H]1CCCN1c1ccccc1)NNC(=O)[C@H]1COc2ccccc2O1	785123658	ASNBDPZTADZYNR-QFBILLFUSA-N	425.441	1.186	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1cc(F)c(OC)c(F)c1	785331086	ODTRIRURQDUFCU-UHFFFAOYSA-N	429.401	1.467	50	20	IDGD	
COC(=O)c1scc(C)c1S(=O)(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	785489518	ZTJUSNFKVDWJCS-UHFFFAOYSA-N	445.906	1.122	50	20	IDGD	
CCOC(=O)c1cnn(C)c1NC(=O)C(=O)NNc1nc(-c2ccc(Cl)cc2)no1	786429103	UJKNGGQISXUBPA-UHFFFAOYSA-N	433.812	1.382	50	20	IDGD	
CCCCN1C(=O)CC[C@H](C(=O)NNC(=O)N2CCN(C)CC2)[C@@H]1c1ccc(OC)cc1	788168834	FNGNWVJOUFKEQD-FPOVZHCZSA-N	445.564	1.763	50	20	IDGD	
CSC1(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)CC1	789296051	UDMZHXBLJZPEQP-UHFFFAOYSA-N	426.564	1.701	50	20	IDGD	
CC1(C)Cc2cccc(NC(=O)C(=O)NNC(=O)c3nn(-c4ccccc4)cc3O)c2O1	789584766	PYXBHKRRRUKJQQ-UHFFFAOYSA-N	435.440	1.691	50	20	IDGD	
CCNC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)COc2ccccc2CC)c1C	789733019	URDMUFRORASDNG-UHFFFAOYSA-N	441.488	1.864	50	20	IDGD	
CC(C)Oc1cc(NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)ccc1C(N)=O	789735065	KAVOBRDFIMRBOT-UHFFFAOYSA-N	437.456	1.314	50	20	IDGD	
Cc1nn(-c2cncc3nnnn23)c(C)c1CC(=O)NNc1cccc(F)c1[N+](=O)[O-]	790590474	ARDRUKNMJSJOCG-UHFFFAOYSA-N	426.372	1.055	50	20	IDGD	
Cc1c(NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cccc1NC(=O)N(C)C	791911016	OUMUGIFMIFVJOG-UHFFFAOYSA-N	440.508	1.948	50	20	IDGD	
O=C(NNC(=O)[C@@H](O)Cc1ccccc1)c1nn(Cc2ccccc2)c(=O)c2ccccc12	792804522	QVYDBWLAXDZBOV-NRFANRHFSA-N	442.475	1.809	50	20	IDGD	
COc1ccc(Cn2cc(NC(=O)C(=O)NNC(=O)c3cccc(N(C)C)c3)cn2)cc1	793021563	DYXVBOMCGZMATA-UHFFFAOYSA-N	436.472	1.406	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)cnc1C	793429291	OXQFKYVZHHSWME-NSHDSACASA-N	427.866	1.607	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CSCCOCCN2C(=O)c3ccccc3C2=O)cc1	795246665	YWLZSKQNJXBHFS-UHFFFAOYSA-N	441.509	1.802	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2C[C@H]3CN(C(=O)OC(C)(C)C)C[C@H]3C2)cc1OC	796595565	VNTGLXBTGJMPNJ-IYBDPMFKSA-N	448.520	1.264	50	20	IDGD	
CNc1nc(C)cc(C(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)n1	798155053	ZSSFUFWNBZQVGL-UHFFFAOYSA-N	443.471	1.603	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)C(=O)Nc1cc(Cl)c(Cl)cc1F	799259335	YTMLTZJFEDIBDH-UHFFFAOYSA-N	438.206	1.508	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(C(=O)NNc2cc([N+](=O)[O-])ccc2Br)o1	800619352	NRWDKRNYMVGDAM-UHFFFAOYSA-N	433.240	1.958	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Nc2ccc(Br)cc2)ccc1OCC(N)=O	801995095	YCZHZLBHNUKLPZ-UHFFFAOYSA-N	437.250	1.788	50	20	IDGD	
C[C@H]1CCCN(S(=O)(=O)c2ccc(C(=O)NNc3ccc(-n4ccnc4)nn3)cc2)C1	804952606	QZKCHOVYWZIZKJ-HNNXBMFYSA-N	441.517	1.840	50	20	IDGD	
CSCC[C@@H](NC(=O)Cc1ccccc1)C(=O)NNc1ccc(-n2ccnc2)nn1	804958012	GIVIQSLBBIGBJN-MRXNPFEDSA-N	425.518	1.586	50	20	IDGD	
Cc1cc(=O)c(C(=O)NNC(=O)c2ccc(CSc3nncn3C)cc2)cn1C1CC1	806376137	YBMHEQJADVLRIL-UHFFFAOYSA-N	438.513	1.987	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COCCO1)C(=O)Nc1cccc(-c2ccc(Br)cc2)c1	806980152	KIDRTFRMNUSSCA-INIZCTEOSA-N	448.273	1.617	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)N2CCN([C@@H]3CCN(C(=O)OC(C)(C)C)C3)CC2)n1	808298916	CFSFOBILBYNGNN-MRXNPFEDSA-N	432.525	1.371	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](N2CCN(CC(=O)NNC(=O)c3ccc(F)cc3)CC2)C1	808770965	QUUAJYHSGJIMFY-SFHVURJKSA-N	449.527	1.214	50	20	IDGD	
COc1c(Cl)cccc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	813033503	WSCDBELHBQKGKS-UHFFFAOYSA-N	426.882	1.681	50	20	IDGD	
O=C(Cc1cc[nH]n1)NN=C1C(=O)N(Cc2ncon2)c2ccc(Br)cc21	814957383	PKIZTPJUELGDJC-UHFFFAOYSA-N	430.222	1.165	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)COc2cc(C)cc(C)c2)cc1)C1CC1	815565524	RNRUVFGXNJRCOY-UHFFFAOYSA-N	438.484	1.984	50	20	IDGD	
CCOC(=O)c1cc(COC)cc(NC(=O)C(=O)NNc2ccc(-n3cccn3)nn2)c1	815589738	BWGLNDDLHPFQRR-UHFFFAOYSA-N	439.432	1.067	50	20	IDGD	
N#Cc1cc(NC(=O)C(=O)NNC(=O)[C@H]2CCc3nncn3C2)ccc1Oc1ccccc1	815693369	VDCOIIJLZACQJR-AWEZNQCLSA-N	445.439	1.291	50	20	IDGD	
CNS(=O)(=O)NC1CCN(C(=O)/C(C#N)=C\c2cc(C)n(C[C@H]3CCCO3)c2C)CC1	819579689	GYWHHEYNUCKNKD-JKALPCAWSA-N	449.577	1.236	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)CNS(=O)(=O)c2cc(C)ccc2C)cc1OC	913070427	IRXLQBIYDNYSAS-UHFFFAOYSA-N	449.529	1.840	50	20	IDGD	
Cc1nc(C(F)(F)F)ccc1C(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	914656463	MCTLFAMLERJWGB-UHFFFAOYSA-N	426.307	1.935	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)CNS(=O)(=O)c1cccc(F)c1	915788136	VUXTUZVBUUNDLZ-AWEZNQCLSA-N	445.472	1.872	50	20	IDGD	
COc1cccc(C[C@H](C(=O)NNC(=O)c2ccc3ccccc3n2)n2nnnc2C)c1	916092027	RXHHZKIZFTZAKT-HXUWFJFHSA-N	431.456	1.783	50	20	IDGD	
Cc1nn([C@H]2CCS(=O)(=O)C2)c(Cl)c1C=NNC(=O)c1cccc([N+](=O)[O-])c1	916245591	KQYZHSQZPOPPMC-ZDUSSCGKSA-N	425.854	1.877	50	20	IDGD	
Cc1cccc(N2CCN(CCCNC(=O)NNC(=O)Cn3nc(C)cc3C)CC2)c1	916513631	IBHKMZXGCLNOFM-UHFFFAOYSA-N	427.553	1.351	50	20	IDGD	
CSCC[C@@H](NC(=O)c1ccco1)C(=O)NNC(=O)C(=O)Nc1ccc(C)c(C)c1	916561682	DDYJITPEYLZJIZ-OAHLLOKOSA-N	432.502	1.534	50	20	IDGD	
O=C(NNC(=O)C1CCN(S(=O)(=O)c2ccccc2F)CC1)c1ccc(Cl)nc1	917248765	CZTRPDPRYYTYBD-UHFFFAOYSA-N	440.884	1.736	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)N2CCN(CC(=O)N(C)C)CC2)c(C)n1C[C@@H]1CCCO1	917367046	JDQVYZYEHFIQAG-MSTPFNHUSA-N	427.549	1.423	50	20	IDGD	
CC(=NNC(=O)c1ccc(C)cc1O)c1ccc(S(=O)(=O)NCCCC(=O)O)cc1	917556115	MSCFWOAOFVJBBX-UHFFFAOYSA-N	433.486	1.998	50	20	IDGD	
COc1ccc(CNC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c(OC)c1	918236127	XKBQQMPPLAXINY-UHFFFAOYSA-N	441.532	1.747	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)[C@H]2CCCN(S(=O)(=O)CC)C2)cc1	918548621	HLJXDDXWUQSAAA-GJZGRUSLSA-N	427.523	1.062	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)NCCC(=O)N[C@H]2CCS(=O)(=O)C2)c(C)n1CCC(C)C	918570824	XYLJYKRQMWYMKR-RQRMZWKBSA-N	448.589	1.868	50	20	IDGD	
Cc1oc(C)c(S(N)(=O)=O)c1C(=O)NNC(=O)c1ccc(F)cc1Br	918645450	INAGLQDICICISI-UHFFFAOYSA-N	434.243	1.520	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cccc(N3CCOC3=O)c2)cc1OC	919197527	CBKBLLDFQIHCHJ-UHFFFAOYSA-N	443.412	1.278	50	20	IDGD	
CC(=O)Nc1ccc(F)c(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1	919691879	CNHXLBCBYRSPLV-UHFFFAOYSA-N	448.476	1.643	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccccc2OCC#N)c1	919807281	BZGCQXLSGNXYFN-UHFFFAOYSA-N	430.486	1.694	50	20	IDGD	
O=C(CS(=O)(=O)Cc1cccc(Br)c1)NNC(=O)c1ccccc1O	920208393	MTWXQTZCRXGODH-UHFFFAOYSA-N	427.276	1.531	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccn(-c3cccc(F)c3)n2)c1	920284719	HWLCHKPZMSHJKK-UHFFFAOYSA-N	431.449	1.337	50	20	IDGD	
COc1ccc(OCc2nc(C=NNC(=O)CSc3nnc(O)nc3O)cs2)cc1	920371011	QTZPFDMZGLNTKW-UHFFFAOYSA-N	448.486	1.569	50	20	IDGD	
COc1ccc(Br)cc1NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	1254714551	MYJVQVOHFXZKPF-UHFFFAOYSA-N	432.238	1.900	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)N1CCC([C@H]2C(=O)Nc3ccccc32)CC1	1318338940	RQAKLBBGLMHYHW-GOSISDBHSA-N	425.445	1.198	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCCN1Cc1cccnc1)c1csc(N2CCOCC2)n1	1318654979	WFDGXOWLUJMCMY-KRWDZBQOSA-N	430.534	1.190	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)c2cn(-c3ccc(Br)cc3)nn2)c1O	1324038367	ZNMHCJDKSQZCIV-UHFFFAOYSA-N	432.234	1.819	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)CCc3ccc(OC)cc3F)C2)C1	1778286554	BYLXHKDKBTXMJR-DYESRHJHSA-N	442.915	1.851	50	20	IDGD	
Cc1nccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](C)Br)C3)n1	1778311941	ATFPESACPPHHME-CDHAZOANSA-N	425.327	1.696	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(CCN(C(=O)c3ccc4ncncc4c3)C2)C1	1778599721	NRRRFQAJDKHLSF-IBGZPJMESA-N	433.306	1.858	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccn(C(F)F)n3)C2)C1	1779618611	WVZSKZOIYWVJEW-BDJLRTHQSA-N	435.269	1.895	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)Cc3cn4nc(C)sc4n3)CCO2)C1	1781214655	BALIQTVOQABNDJ-KSSFIOAISA-N	425.942	1.489	50	20	IDGD	
COC(=O)[C@@H]1CC[C@H](C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)C1	1781325590	ODBVPRGQAGTYKJ-SFDCBXKLSA-N	435.290	1.096	50	20	IDGD	
O=C(c1cc(O)cc([N+](=O)[O-])c1)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781333443	OJGLHFLICHLIMC-CZUORRHYSA-N	446.229	1.434	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2)c1cnn2cccc(F)c12	1781424021	OWDVOXDEEAOLBI-RZQQEMMASA-N	438.887	1.201	50	20	IDGD	
CCOC(=O)O[C@@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)Br)C2	1781516993	YSYRIVVSNZBBOB-UYAYXHRUSA-N	449.342	1.845	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1cnc[nH]1)C2	1781899858	AUWKXHQWWSMCIF-HDMKZQKVSA-N	427.343	1.640	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3c(F)ccc(O)c3F)C2)C1	1781932520	FKZPRMFLQQLNRE-QGHHPUGFSA-N	433.249	1.897	50	20	IDGD	
O=C(Cc1ccc([N+](=O)[O-])cc1F)N1CC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1782974786	VCONPIJVXONGPJ-QGZVFWFLSA-N	434.251	1.910	50	20	IDGD	
CCC(=O)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](Br)Cc3ccccc3)C2)C1	1783021586	CRLRNXCXAZKBQS-OXQOHEQNSA-N	437.334	1.802	50	20	IDGD	
Cc1ccc(C(=O)NCC(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](F)Cl)C3)cc1	1783259306	STLUPWIKDZSSSB-HGHGUNKESA-N	439.915	1.773	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cnn4ncccc34)CCO2)C1	1783347602	MUZBYBGQJQUDCR-KBXCAEBGSA-N	436.310	1.346	50	20	IDGD	
COc1nc(C)ccc1C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](C)Br)C2)C1	1783535563	AAZHRBHJKDGAMP-SCLBCKFNSA-N	426.311	1.626	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](C)CNC(=O)OC(C)(C)C)CCO2	1783870466	CGXFPGIMTPMYLG-QEEYODRMSA-N	447.960	1.231	50	20	IDGD	
CC(C)(C)OC(=O)NC(C)(C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Cl)C[C@@H]21	1784813639	YAAFIJZXZSLDAJ-XDQVBPFNSA-N	435.924	1.804	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(C(N)=O)cc3)C2)C1	1784931184	CHEZWDRXAUUSBI-DNVCBOLYSA-N	438.322	1.403	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3cn[nH]c3)[C@H]2C1	1785275846	CLQGRNBRHOCXJR-OEAJRASXSA-N	427.343	1.353	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnn(C(C)(C)C)c3)[C@H]2C1	1785621360	VYMWCASYSBBNRE-LLLHUVSDSA-N	426.945	1.485	50	20	IDGD	
COc1ncccc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]21	1786010973	IGHQSCLUTTUPEB-XPVILTJLSA-N	430.332	1.920	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)c1cnoc1C1CC1	1786291117	HYUGHTJLEGLTSC-GZCFXPHUSA-N	430.274	1.836	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc([N+](=O)[O-])[nH]3)C[C@@H]21	1786408799	BMSLUZHRNHLFGM-GVXVVHGQSA-N	429.271	1.301	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)c1cnn2ccncc12	1788033240	REYZDXTYYMQMEN-HQRZJTNHSA-N	440.273	1.013	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3CCC[C@@H]3C)[C@H]2C1	1788235094	CTDYKDXVBWULSN-QAVYHNJPSA-N	443.548	1.536	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(C(=O)O)ncn3)C[C@@H]21	1789868938	TZUFLDIJAZUHFE-DDWFUNMISA-N	445.303	1.004	50	20	IDGD	
CCc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]3C2)n(C)n1	1789924495	HRUREZLZHSBLGD-LVGORTOPSA-N	431.306	1.266	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)c1c(O)cc(O)cc1O	1790155987	QGEGEZISBUZFQR-WBIUFABUSA-N	443.294	1.182	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@H](C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)C(Cl)Cl)C[C@@H]32)C1	1791247571	LASRWUIJWYWQIK-AICCOOGYSA-N	435.348	1.749	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/c3ccc([N+](=O)[O-])o3)C[C@@H]21	1791249188	FROZKAOUJJENPL-QFYSZYJQSA-N	441.868	1.435	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](N)c3cccc(Cl)c3)C[C@@H]21	1791251773	VMMYJJOEKBDUOT-XEIOYGOASA-N	444.359	1.573	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1	1791434540	STQPLHIMJHLNRF-CYBMUJFWSA-N	445.122	1.898	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC1(c2ccc(NC(=O)CCn3cncn3)cc2)CCC1	1791795163	HHWUGOZARXLHBK-UHFFFAOYSA-N	427.509	1.175	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@H](O)CCl)c[nH]2)cc1	1792975656	SYEWXTSHMSKUCE-PIKOESSRSA-N	431.920	1.793	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(OCC3CC3)cc1F)C2)[C@@H](O)CCl	1792981050	YVQYNAOVGINNQH-FTUNRGFVSA-N	440.899	1.417	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3cc(F)c(F)cc3[nH]1)C2)[C@@H](O)CCl	1792981290	JDOFOKGOORIKBM-YNHQPCIGSA-N	427.835	1.249	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](F)Br)C3)n1	1794577797	YGRGYDAEHZEMLA-NWJSVONSSA-N	427.274	1.982	50	20	IDGD	
CS(=O)(=O)c1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](F)Br)C3)nc1	1794749476	MJCMXSDLENHCFO-FBKDDSFISA-N	448.314	1.427	50	20	IDGD	
O=C(Cc1ccc2c(c1)CCCO2)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1	1796189043	PXAHBSSXEIDETK-KOUNCHBCSA-N	448.328	1.186	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2cc(O)ccc2n1	1796864730	CHADQISPUWDMQX-MVWRLGRASA-N	433.892	1.397	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)n1ccccc1=O	1797937347	KOFAQPOHVGTNJS-OWVAZHOYSA-N	440.338	1.172	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CCc3ccccc3O1)C2	1797956504	HCZHACRYDIJXQD-NZGUISNBSA-N	432.593	1.821	50	20	IDGD	
C[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CO[Si](C)(C)C)N1CSCSC1	1797956821	FHLCRVGNFZTMFW-PNBKFKSVSA-N	447.699	1.471	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(C(F)(F)F)ccn1)c1cccc(B(O)O)c1	1798877249	MLYZSHRNXCAQSD-BJWYYQGGSA-N	447.222	1.346	50	20	IDGD	
COc1ccc(OCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@](C)(Cl)CCl)cc1	1799274079	ZFDSHMROLHFVFK-VLBMKZOESA-N	445.343	1.900	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(C)c(C(=O)O)c(C)c1	1799874230	ULARHDVQXYZWNG-DFGXFYAUSA-N	438.908	1.459	50	20	IDGD	
CCCCC[C@H](C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2	1800562186	MSADWUXVMMBWOJ-PWIWSCCXSA-N	445.564	1.926	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc3nc[nH]c13)C2	1800639020	GASGZFUXNLXNMC-LMWOUKEDSA-N	435.322	1.940	50	20	IDGD	
Cn1ncnc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C(C#N)=C/c1ccc(F)cc1F	1801435970	ZWBKDEYDXNURHO-RMWXTBGQSA-N	426.427	1.952	50	20	IDGD	
COc1ccc(F)c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCBr)C3)c1	1801719408	QVVFMSRSSRYTHZ-DPIQGUFMSA-N	429.286	1.823	50	20	IDGD	
O=C(Cc1cccc([N+](=O)[O-])c1)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1	1802378167	NRPUKUQWJJLPTF-XKGZKEIXSA-N	446.891	1.838	50	20	IDGD	
C[C@H](Cc1ccccc1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnccc1C(=O)NN)C2	1802644321	HBUFMTQKYBOJTD-OQIJWPOYSA-N	435.528	1.816	50	20	IDGD	
Cc1cnc2c(C(=O)N3CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]3c3cccnc3)cnn2c1	1803142984	QDDQRPPKSRNUGL-BPQIPLTHSA-N	442.907	1.352	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2nc3ccc(F)cn3n2)[C@H]1c1cccnc1)[C@@H](O)CCl	1803147579	ISPOTOFAMRSUSM-QRTARXTBSA-N	446.870	1.183	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2cccs2)[C@@H]1c1cccnc1	1805391599	DKBSFFREFNUAET-UZLBHIALSA-N	429.546	1.836	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H](CNC(=O)CSC(=N)N)[C@@H]1c1cccnc1	1807008291	JGKNSBZCODFXFZ-IPYPFGDCSA-N	442.383	1.888	50	20	IDGD	
O=C(CCCc1ccncc1)N1CCCC2(CCN(C(=O)c3cccc(B(O)O)c3)CC2)C1	1807118074	PACMBCPOQPHOOL-UHFFFAOYSA-N	449.360	1.629	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)Cc2ccc3ncnn3c2)[C@H]1c1cccnc1)[C@H](F)Cl	1808314972	LOOVFASBQLLAKP-SNRMKQJTSA-N	430.871	1.907	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)CCc2ccoc2)[C@H]1c1cccnc1	1813074042	NYEMYLZUTYVCSW-CVDCTZTESA-N	441.532	1.686	50	20	IDGD	
CCC[C@@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(=O)n3[nH]cnc3n2)[nH]n1	1815317844	KDIXYWQOWWXQAQ-RISCZKNCSA-N	446.899	1.854	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)C1CC(F)(F)C1)CC2)c1cccc(B(O)O)c1	1815347684	KKBMHBXOKSDNFH-CYBMUJFWSA-N	435.261	1.094	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccccc2O)[nH]n1)c1cccc(B(O)O)c1	1817473548	ZRPIMTMKZKMICY-SFHVURJKSA-N	434.261	1.415	50	20	IDGD	
Cc1cccnc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819401840	VDDVVPDCKSCTBZ-KRWDZBQOSA-N	448.487	1.731	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cscn2)[nH]n1	1819401909	FUEMSCPDLCFFNX-OAHLLOKOSA-N	440.489	1.484	50	20	IDGD	
CC(C)N(C)CC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819404802	ZUDCUZRCQAWRNJ-QGZVFWFLSA-N	442.524	1.054	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnncc2C(=O)O)n[nH]1	1819763177	GRQDRJFSKAINDE-JSGCOSHPSA-N	436.856	1.458	50	20	IDGD	
COc1ccnc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)c1	1819768321	SOGNWRWFULSHPY-KRWDZBQOSA-N	443.508	1.492	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CN2C(=O)CNC2=O)[nH]n1	1820862825	UVFDXDCYUZWGOO-DIFFPNOSSA-N	445.307	1.190	50	20	IDGD	
COC(=O)NCC(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](C)CBr)[nH]n1	1822620455	WHRBUERJJBXFGG-CMPLNLGQSA-N	430.303	1.789	50	20	IDGD	
O=C(CC12CCCN1CCC2)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)CCl)CC2	1822749549	ZEVPEQUILBBOPF-OCCSQVGLSA-N	426.970	1.673	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H](O)N2CCOCC2)CC1	1824013861	VILFIIUARBGRET-IEBWSBKVSA-N	429.989	1.522	50	20	IDGD	
CN[C@H](CC(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H](C)CBr)CC1)C(=O)O	1824092714	GYXVNMGURQFIJN-BMFZPTHFSA-N	446.386	1.700	50	20	IDGD	
C[C@H](C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCC(=O)NN(C)C)CC2)c1ccccn1	1827074188	LHQDQUYIIMUNBZ-UONOGXRCSA-N	444.561	1.627	50	20	IDGD	
O=C(CCc1ccoc1)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2	1827106630	RBHJHKWKQFMPRQ-MRXNPFEDSA-N	439.302	1.275	50	20	IDGD	
O=C(c1cc(=O)nc2cccnn12)N1CCC([C@H]2CCCCN2C(=O)[C@H](F)Cl)CC1	1827610918	SDFGDKCANVYTIF-KDOFPFPSSA-N	435.887	1.857	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2nc3ncccn3n2)CC1	1828179564	BZZBFFBCIRSWNT-CVEARBPZSA-N	434.928	1.611	50	20	IDGD	
O=C([C@H](O)CCl)N1CCC([C@@H]2CCCCN2C(=O)[C@H]2CC[C@H]3CCC(=O)N3C2)CC1	1830208812	FTUUBURWZRMXSA-CADBVGFASA-N	439.984	1.607	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCC(F)(F)F)C2)C1	1830537074	BARCVGFBQZJQBR-SWLSCSKDSA-N	445.276	1.816	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(F)cc3)C2)C1	1830543430	RYRAWJTURKTMHY-AUUYWEPGSA-N	443.313	1.927	50	20	IDGD	
O=C(CCc1ccccc1Cl)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1830724715	YOYOLNXBPBHFSQ-FXAWDEMLSA-N	445.343	1.329	50	20	IDGD	
Cc1ccc(CCC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)s1	1830726051	NXERWZUNBWEJMT-LPHOPBHVSA-N	430.954	1.045	50	20	IDGD	
Cc1ccc2nc(C(=O)N3CCOC[C@]4(C3)CN(C(=O)[C@H](O)CCl)CCO4)ccc2c1	1830727831	HQMDHOZZCJRCEC-KNQAVFIVSA-N	447.919	1.213	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCCCCC(=O)OC)C2)C1	1831656348	DGVKWCLTAYDGGS-DYESRHJHSA-N	446.972	1.974	50	20	IDGD	
Cc1ccn(CC(=O)NC2CCN(C3CCN(C(=O)[C@@](C)(Cl)CCl)CC3)CC2)n1	1833853886	PQTPUBMWEBMVHY-FQEVSTJZSA-N	444.407	1.999	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3c(C)noc3C)CCO2)C1	1834067984	FIDAPGFJNBLQHH-KDOFPFPSSA-N	444.326	1.535	50	20	IDGD	
Cc1noc(N)c1C(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)Br)CC2)CC1	1834702357	BISVYIIYBMYQOP-LLVKDONJSA-N	442.358	1.534	50	20	IDGD	
O=C(Cc1cccc(F)c1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1835025515	ZNHOVZQRHMAPQV-WMZOPIPTSA-N	447.276	1.515	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC1CCN(C2CCN(C(=O)c3cc4n(n3)CCC4)CC2)CC1	1835837011	KTAQULFKZKSDNA-UHFFFAOYSA-N	447.656	1.866	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)Cc3cccnc3)CC2)CC1)[C@H](F)Br	1836412731	RZKJHFCSUYMUAS-SFHVURJKSA-N	441.345	1.886	50	20	IDGD	
COc1ncc(C(=O)N2CCC(OC3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)cc1C	1836716769	PONLUSUNZRFWRI-SFHVURJKSA-N	439.940	1.611	50	20	IDGD	
CCc1ncsc1C(=O)N1CCOC[C@@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1837714486	IIEXITVZCLSPMH-LJQANCHMSA-N	441.626	1.627	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@H](O)c3ccccc3)CC2)CC1	1837779737	KBDBDUWLKDHFCT-VQTJNVASSA-N	438.952	1.972	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)Cc3cnc[nH]3)CC2)CC1	1838072010	HIFNBHVXYDWGPB-ZDUSSCGKSA-N	427.343	1.734	50	20	IDGD	
Cc1ccn(C)c1C(=O)N1CCC(OC2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1	1838559461	TXRJAZCPAKUHGI-UHFFFAOYSA-N	447.580	1.319	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)[C@H]3CCNC(=O)C3)CC2)CC1	1838773492	JRZQJEWTFVUTOT-KGLIPLIRSA-N	444.370	1.295	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ncc(OC)cc3F)C2)C1	1839143062	KLPQCKVBQWKXPX-AUUYWEPGSA-N	429.876	1.317	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4ncsc4[nH]3)C2)C1	1839145631	NRRUFXGHWIYHRS-KPZWWZAWSA-N	426.926	1.712	50	20	IDGD	
CCOc1cccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](Cl)CC)CCO3)c1O	1839146965	BYGRQKSLGVZUHW-IERDGZPVSA-N	440.924	1.878	50	20	IDGD	
O=C(c1ccc(-n2cccn2)cc1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1839336980	CCTHRKHQIUUYKY-PXNSSMCTSA-N	436.871	1.477	50	20	IDGD	
Cc1c(F)cccc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)Br)CCO2	1840030402	KPWWKQCLTPCCNP-IFXJQAMLSA-N	443.313	1.988	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)o1	1840188678	WZLKLEXJAGUQCC-QGZVFWFLSA-N	434.276	1.112	50	20	IDGD	
O=C(C(Cl)Cl)N1CCO[C@@]2(COCCN(C(=O)C3(Br)CC3)C2)C1	1840189470	SSDJEBCTFYBFTB-ZDUSSCGKSA-N	430.126	1.174	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccc(C)o3)CCO2)C1	1840508722	LRWHILGFGPZZLG-LPHOPBHVSA-N	443.338	1.760	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C1(C#N)CCC1)CCO2	1840812484	UJHQRPSBSDYATN-KDOFPFPSSA-N	428.327	1.168	50	20	IDGD	
Cc1nnsc1C(=O)N1CC2(CCCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C1	1841924797	AQTYPYAUNYFYCT-LBPRGKRZSA-N	443.957	1.796	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)c2cc(C)no2)C1	1842461331	VQTKDYSWWHPLHD-UHFFFAOYSA-N	428.401	1.947	50	20	IDGD	
Cn1ccc(C(=O)N2CCCC23CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C3)n1	1842466194	HMQDQWSUIVYOME-AWEZNQCLSA-N	425.917	1.369	50	20	IDGD	
O=C(Cc1cc(F)ccc1Cl)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843010739	XCYQMLHTEFXLMT-UHFFFAOYSA-N	430.672	1.219	50	20	IDGD	
O=C1COc2ccc(C(=O)N3CCCC34CN(C(=O)[C@@H](F)Br)C4)cc2N1	1844080585	PCTRKIHCPGFRTG-CQSZACIVSA-N	426.242	1.525	50	20	IDGD	
O=C([C@@H](F)Br)N1CC2(CCCN2C(=O)[C@@H]2ON=C(c3ccccc3)O2)C1	1844198664	WVPJPYUGYGMFRR-WBMJQRKESA-N	426.242	1.615	50	20	IDGD	
N#C/C(=C\c1ccc(Br)cc1)C(=O)N1CCCC12CN(C(=O)COCCO)C2	1845872956	SRZYVEDGYQZCJD-MHWRWJLKSA-N	448.317	1.568	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC12CN(C(=O)c1ccc(N3CCOCC3)cn1)C2	1846176119	NOZSVWXKWFKPRV-AWEZNQCLSA-N	437.338	1.519	50	20	IDGD	
C[C@@H]1[C@@H](C(=O)N2CCCC23CN(C(=O)[C@H](O)CCl)C3)CCN1C(=O)OC(C)(C)C	1847162114	ZQUBUSVONHKKHB-QLFBSQMISA-N	429.945	1.435	50	20	IDGD	
CN(CC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H]1CCCCO1)NC(=O)NCc1ccccc1	1847313653	QZGOOELASRXSJF-SLFFLAALSA-N	443.548	1.104	50	20	IDGD	
O=C(CN1CCC(NC(=O)c2ccccc2)CC1)NNC(=O)c1ccc([N+](=O)[O-])cc1	11097469	IHPYAXYMFJZRRS-UHFFFAOYSA-N	425.445	1.250	50	20	IDGD	
CCOc1ccc(NC(=S)NNC(=O)c2ccc(S(=O)(=O)N(C)OC)cc2)cc1	14841192	BYSKDKMTKTWWFE-UHFFFAOYSA-N	438.531	1.899	50	20	IDGD	
CCC1CCC2(CC1)NC(=O)N(CC(=O)NNC(=O)Cn1cnc3ccccc31)C2=O	17403509	YQIYYZMFYKCQRN-UHFFFAOYSA-N	426.477	1.075	50	20	IDGD	
O=C(Cc1ccc2c(c1)OCCO2)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	17456723	BZBDGHRMSYYLFU-UHFFFAOYSA-N	445.497	1.246	50	20	IDGD	
CNS(=O)(=O)c1ccc(C(=O)OCC(=O)C(C#N)=C2N(C)c3ccccc3N2C)cc1	22865013	OBKLLSWRPGAYAG-UHFFFAOYSA-N	440.481	1.642	50	20	IDGD	
Cc1ccc(S(=O)(=O)NC2CC2)cc1C(=O)NNC(=O)c1cc(-c2ccccc2)n[nH]1	28636188	OAYCOGITDPVJRT-UHFFFAOYSA-N	439.497	1.901	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)CS[C@@H]1CCS(=O)(=O)C1	105008358	WMBRTMRLWVMVMD-CYBMUJFWSA-N	425.557	1.800	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)Cn2cc(Br)ccc2=O)o1	109421074	CUAPLDJGWBKDHR-UHFFFAOYSA-N	425.283	1.507	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@@H](CC(C)C)N2C(=O)[C@H]3CC=CC[C@H]3C2=O)cc1OC	197983887	NFQFVVXGLMHCER-IXDOHACOSA-N	443.500	1.831	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2ccc3c(c2)OCCCO3)c1	727605639	SLQZJMCGXSSITE-UHFFFAOYSA-N	448.501	1.242	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)C[C@@H](c2ccccc2)N2CCOC2=O)c2ccccc2c1=O	728264748	LKGDJKGCTSAPSB-KRWDZBQOSA-N	435.440	1.278	50	20	IDGD	
O=C(CCNC(=O)c1n[nH]c2ccccc12)NNc1ccc(S(=O)(=O)C(F)F)cc1	728972061	QAXVLRDAQUJEFG-UHFFFAOYSA-N	437.428	1.822	50	20	IDGD	
O=C(CN(Cc1ccccc1)S(=O)(=O)c1ccc(Cl)cc1)NNC(=O)c1cocn1	729298826	UYPZAKYKOZKVQK-UHFFFAOYSA-N	448.888	1.980	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)CNS(=O)(=O)c2cccc(C(F)(F)F)c2)cc1	729350109	WYEDIGPUGOVZHO-UHFFFAOYSA-N	426.376	1.317	50	20	IDGD	
CO[C@@](C)(C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)c1ccccc1	730205678	PALHFXYDSDZNBO-OAQYLSRUSA-N	431.514	1.794	50	20	IDGD	
CCOc1ccc(N2C(=O)/C(=C\NNC(=O)C(=O)NC(C)C)c3ccccc3C2=O)cc1	730982241	NDAVUQBDBPSUIR-UYRXBGFRSA-N	436.468	1.759	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCC(n3cc(Br)cn3)CC2)n1	731669178	ONJFMNYLYVCUPD-UHFFFAOYSA-N	441.355	1.438	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCC(=O)NCC(F)(F)F)cc1Br	732241336	GOBRZPVAUGKFML-UHFFFAOYSA-N	427.177	1.080	50	20	IDGD	
O=C(NCCCCN1C(=O)c2ccccc2C1=O)NNC(=O)c1cccc([N+](=O)[O-])c1	732470629	AHMFBGGVOYMWSV-UHFFFAOYSA-N	425.401	1.615	50	20	IDGD	
CC(C)(C)[C@@H]1CCc2sc(C(=O)NNC(=O)Cn3ncn4nccc4c3=O)cc2C1	732750971	FHIAMLLFXPOEPR-CYBMUJFWSA-N	428.518	1.565	50	20	IDGD	
CCc1cc(N2CCC[C@H](NC(=O)NNC(=O)c3ccc(OC)c(OC)c3)C2)ncn1	732914246	JYYWOQSIMBPUQD-INIZCTEOSA-N	428.493	1.669	50	20	IDGD	
CCOCCCN1CC[C@@H](NC(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)[C@H](C)C1	734685804	IBYIVEIBZBCCFD-IEBWSBKVSA-N	433.553	1.709	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)CSc2cccc[n+]2[O-])CC1	734820967	BTWDKWWTTRHIFV-UHFFFAOYSA-N	425.511	1.142	50	20	IDGD	
Cc1cc(S(=O)(=O)NNC(=O)CNC(=O)c2cccs2)c(C)cc1Br	735029639	YHWFGVFTXCLQNX-UHFFFAOYSA-N	446.348	1.867	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)c2cc(N3CCNC3=O)ccc2F)cc1	737765265	CWICDNZOZGABCW-CYBMUJFWSA-N	430.436	1.983	50	20	IDGD	
CC(C)(C)OC(=O)NC1CCC(NC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)CC1	740071170	XGJQCVYGOGKWCR-KVULBXGLSA-N	434.493	1.993	50	20	IDGD	
CN(CCCC(=O)NNC(=O)c1c[nH]c2ccccc12)C1=NS(=O)(=O)c2ccccc21	742036520	KZGKUBMCFBOLGU-UHFFFAOYSA-N	439.497	1.790	50	20	IDGD	
CC(C)(NC(=O)Nc1ccccc1)C(=O)NNC(=O)c1csc(N2CCOCC2)n1	742239806	FNVXEAQOXPNXQV-UHFFFAOYSA-N	432.506	1.341	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)c2cn(Cc3cccs3)nn2)c2ccccc2c1=O	742474130	CPODNPDNDNLJRS-UHFFFAOYSA-N	437.485	1.754	50	20	IDGD	
Cc1cc(C)nc(-n2cc(C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)c(C(C)C)n2)n1	742481086	QXODZGCBMRYDRJ-UHFFFAOYSA-N	446.475	1.453	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2ccc(C(=O)O)cc2F)cc(OC)c1OC	743252291	VDNYELJSDBKWGP-UHFFFAOYSA-N	428.394	1.173	50	20	IDGD	
Cc1ccc(CCN(C[C@@H]2CCCO2)C(=O)NNC(=O)CNC(=O)c2ccco2)cc1	743577892	TZLLEABGWWDEKA-SFHVURJKSA-N	428.489	1.782	50	20	IDGD	
N#Cc1ccc(N2CCN(C(=O)NNC(=O)c3cccc(Br)c3)CC2)nc1	743686282	IZVSTALCZJZODG-UHFFFAOYSA-N	429.278	1.892	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2ccc3c(c2)NC(=O)CCS3)cc1	743829611	XVUYEAXECJPZPV-UHFFFAOYSA-N	434.499	1.991	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)c2cn(C)nc2-c2cccnc2)c2ccccc2c1=O	743845545	REYQZOVQJJNBAA-UHFFFAOYSA-N	431.456	1.848	50	20	IDGD	
O=C(CN1CCC(C(=O)NC2CCCCC2)CC1)NNC(=O)c1cccc([N+](=O)[O-])c1	744221168	REXGIECHKQBVTK-UHFFFAOYSA-N	431.493	1.517	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)CN2CCN(C(=O)CCC3CCCCC3)CC2)cc1	744389107	JWTQVXLJIATZMP-UHFFFAOYSA-N	425.533	1.824	50	20	IDGD	
CC(C)NC(=O)C(=O)NNC(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl	744446726	LVNKSAYWKPILLT-UHFFFAOYSA-N	447.835	1.786	50	20	IDGD	
COc1ccc([N+](=O)[O-])c(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)c1	744619278	MAJYCDYIMFNOGB-UHFFFAOYSA-N	436.446	1.381	50	20	IDGD	
O=C(CCc1nc2ccccc2[nH]1)NNc1ccccc1S(=O)(=O)N1CCOCC1	744620528	GXZRFLMCEZYPRQ-UHFFFAOYSA-N	429.502	1.660	50	20	IDGD	
COc1cc(C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)c(N)cc1OC(F)F	744751874	JNEWWRBBVNHCOH-UHFFFAOYSA-N	434.355	1.368	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12)c1cnn(C)c1	745835927	JPFAWPASGPLZDN-HNNXBMFYSA-N	445.483	1.884	50	20	IDGD	
O=C(NNC(=O)c1cc(S(=O)(=O)N2CCCC2)ccc1O)c1cc(Cl)ccc1O	745989642	WYZLSOJLQAOKNK-UHFFFAOYSA-N	439.877	1.611	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)NCCNS(=O)(=O)c2cccs2)c1	747438369	SNALKOLNOBRUKQ-UHFFFAOYSA-N	426.520	1.053	50	20	IDGD	
Cc1ccc(C(=O)NNS(=O)(=O)c2ccc(C(=O)O)cc2Br)c(O)c1	747608444	WTDOOPOVDRHLKE-UHFFFAOYSA-N	429.248	1.785	50	20	IDGD	
Cc1oc2ncn(C)c(=O)c2c1C(=O)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1	748523036	LWQUJFXBUALYRP-UHFFFAOYSA-N	430.364	1.885	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)N2CCC[C@@H](N3CCNC3=O)C2)N(C)c2ccccc21	748722159	OXPVZUCWKDLORM-MRXNPFEDSA-N	436.516	1.673	50	20	IDGD	
CNS(=O)(=O)c1csc(C(=O)NNC(=O)Nc2cc(Cl)c(OC)cc2OC)c1	748867101	UWNPUODPBVCXSE-UHFFFAOYSA-N	448.910	1.793	50	20	IDGD	
O=C(Cn1nc(-c2ccccc2)ccc1=O)NNc1nc(Br)cn2ccnc12	750247174	LHKOPTFQVPVMJK-UHFFFAOYSA-N	440.261	1.859	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)N[C@@H]1CCN(CCCc2ccccc2)C1=O	750292992	VRARDZZSPZCJOG-YLJYHZDGSA-N	438.484	1.391	50	20	IDGD	
CCN1CCN(C(=O)CNC(=O)/C(C#N)=C\c2cc(C)n(C[C@H]3CCCO3)c2C)CC1	750734115	ONHXDKAGGICFAM-DMMSUNFISA-N	427.549	1.471	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)[C@@H]3CCc4nnc(C)n4C3)n[nH]2)cc1OC	750794663	LTKNUGOFIZEBEW-CYBMUJFWSA-N	425.449	1.017	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNS(=O)(=O)c2cc(F)cc(Cl)c2)ccc1Cl	755408203	XSCXVYVFFKEQNG-UHFFFAOYSA-N	442.277	1.403	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)Nc1ccc(S(=O)(=O)C(F)F)cc1	755444666	QZCIKNCEEDHONW-UHFFFAOYSA-N	427.385	1.921	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)N2CCC(C(=O)NNc3cc(C)ccn3)CC2)o1	755838619	RTAWVRASKMBCCJ-UHFFFAOYSA-N	436.490	1.704	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)c(OC)n1	756248935	QKAFIZREIHYJAP-UHFFFAOYSA-N	426.433	1.856	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2ccc(S(=O)(=O)NCC3CC3)cc2)cc1OC	756786098	XJNMEBOJPPATSE-UHFFFAOYSA-N	448.501	1.859	50	20	IDGD	
CN(NC(=O)c1ccnc(OCC(F)F)c1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758785163	BFUWAFNEFZUHRS-UHFFFAOYSA-N	443.451	1.975	50	20	IDGD	
COc1ccc2c(c1)OC[C@H](C(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1)C2	758785191	CCBCJOKFHXAECE-MRXNPFEDSA-N	448.520	1.882	50	20	IDGD	
O=C(NNC(=O)C1CCN(C(=O)c2cccc3ccccc23)CC1)C(=O)Nc1ccccn1	758835025	TWGBFONOAGMLSN-UHFFFAOYSA-N	445.479	1.873	50	20	IDGD	
Cc1cc(S(C)(=O)=O)cc(C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)c1C	758968532	HFWBAGXKQXXLJQ-UHFFFAOYSA-N	437.543	1.905	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)NC[C@H]2CC(=O)N(Cc3ccccc3)C2)nc2ccccc21	759682421	GXAFWDLMTMSYOG-QGZVFWFLSA-N	434.500	1.495	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCc2nc(CS(=O)(=O)N(C)C)no2)N(C)c2ccccc21	761879436	XAJSPJCEYRTHBY-UHFFFAOYSA-N	430.490	1.284	50	20	IDGD	
CC(C)C[C@H](C(=O)NNc1nccc(N2CCOCC2)n1)N1C(=O)[C@H]2CC=CC[C@@H]2C1=O	762869313	VMBPPUKDVZWBQL-YESZJQIVSA-N	442.520	1.122	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccccc2C[S@](C)=O)c1	762913297	ASPSAXTZXJNPFE-NDEPHWFRSA-N	438.531	1.282	50	20	IDGD	
C[C@H](CC(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	763305727	YJEZGDQTWFTGBH-KFWWJZLASA-N	446.570	1.177	50	20	IDGD	
CCC(=O)NNC(=O)C(=O)Nc1cc(OC)c(OC)cc1C(=O)N1[C@@H](C)CCC[C@H]1C	763441790	ZYDQDTNJOYFJQU-BETUJISGSA-N	434.493	1.603	50	20	IDGD	
Cc1cnc(O)n1-c1ccccc1NC(=O)C(=O)NNC(=O)c1ccc2ccccc2n1	763451387	XJZPOSFOVJQHKG-UHFFFAOYSA-N	430.424	1.834	50	20	IDGD	
O=C(NNC(=O)c1ccccn1)C(=O)Nc1cc(C(F)(F)F)ccc1N1CCOCC1	763466118	DOJKOWNCEVUFJM-UHFFFAOYSA-N	437.378	1.337	50	20	IDGD	
COC(=O)CSCc1cccc(NC(=O)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c1	763472263	UPSJQAJSFREKHC-UHFFFAOYSA-N	446.441	1.401	50	20	IDGD	
C[C@H]1COCCN1c1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)cc1	763547569	FAKLPMLXLQKWJQ-ZDUSSCGKSA-N	426.429	1.040	50	20	IDGD	
CCOC(=O)c1c(C2CC2)csc1NC(=O)C(=O)NNC(=O)c1ccc2c(c1)OCO2	763550488	APABUQBAVUBQGO-UHFFFAOYSA-N	445.453	1.931	50	20	IDGD	
C[C@H]1CN(C(=O)c2ccc(NC(=O)C(=O)NNC(=O)c3ccccc3F)cc2)C[C@H](C)O1	763560969	GWWJGXJSDRRGBB-KBPBESRZSA-N	442.447	1.475	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)Nc1cc(Cl)cc2cccnc12	763572563	RVXJZLZDRLDIHL-MRXNPFEDSA-N	426.816	1.814	50	20	IDGD	
Cc1cc(C)c(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)c(Br)c1	763574809	IRUDZWWGXFAZLL-OAHLLOKOSA-N	448.273	1.992	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)cnn1-c1ccccc1	763600478	JJLKHOOLGBHJCE-UHFFFAOYSA-N	429.440	1.971	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(C#Cc3ccccn3)c2)cc1	763660101	XGXLONIATKJQRX-UHFFFAOYSA-N	444.447	1.655	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)COc2ccc(C)c(C)c2)c(F)cc1F	763667073	PEQSIELMBPIPHX-UHFFFAOYSA-N	435.383	1.533	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(F)c(C(=O)N(C)C)c1	763681794	IURDJZLFGLEWOV-UHFFFAOYSA-N	446.435	1.091	50	20	IDGD	
COCCOc1ccc(C#N)cc1NC(=O)C(=O)NNC(=O)c1cccc(N(C)C)c1	763760809	SWXSJYYUHLUYJD-UHFFFAOYSA-N	425.445	1.049	50	20	IDGD	
O=C(CCc1ncc(-c2ccccc2Cl)o1)NNC(=O)CNC(=O)c1cccnc1	763819004	UUACJQCLSNEKFV-UHFFFAOYSA-N	427.848	1.900	50	20	IDGD	
Cc1nn(-c2ccccc2)c2nc(C(=O)NNC(=O)CNC(=O)c3cccnc3)ccc12	763826427	ZJDKRDOPUUUHOP-UHFFFAOYSA-N	429.440	1.315	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)C(=O)Nc2ccccc2CN2CCOCC2)cc1	763891684	RMAZBEIGLSXHSJ-UHFFFAOYSA-N	442.541	1.705	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(F)cc2C(=O)OC)cc1OC	763900264	CEUJEWMAVMWGQC-UHFFFAOYSA-N	433.392	1.419	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)Nc1cnc(-c2ccccc2)nc1	764004695	LLCHPHILVDGIBJ-UHFFFAOYSA-N	443.261	1.644	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)Cc2cccc3ccccc23)cc1-n1cnnn1	764029885	YRVLHRNPBMKGMU-UHFFFAOYSA-N	429.440	1.453	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccccc1N1C[C@H](C)O[C@H](C)C1	764041607	YFELIGKZRUZPFJ-GASCZTMLSA-N	426.473	1.709	50	20	IDGD	
CCCOc1cc(F)ccc1NC(=O)C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	764077241	JWWKRVGZIUIWLH-UHFFFAOYSA-N	437.449	1.418	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)c2cc(C)[nH]n2)sc2c1CC[C@@H](C)C2	764098029	IZNHRWOWZHFKHW-SECBINFHSA-N	433.490	1.481	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(OCC(=O)N3CCCC3)c2)c(O)c1	764105856	ZMRWTYJUKKCGFR-UHFFFAOYSA-N	440.456	1.102	50	20	IDGD	
CN1CCN(Cc2cccc(NC(=O)C(=O)NNC(=O)c3ccc(Cl)cc3O)c2)CC1	764126346	ICFWREHBSZOHMK-UHFFFAOYSA-N	445.907	1.193	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccnc(Sc2ccccn2)c1	764136067	NALHLPCOTZIAJW-UHFFFAOYSA-N	437.481	1.965	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1cc(Cl)ccc1C(=O)N(C)C	764136538	RWSWNLGNNSJPIH-UHFFFAOYSA-N	432.864	1.379	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2O1)C(=O)Nc1cc(CC2CC2)nn1-c1ccccc1	764165425	YTFMWLCNLOQYRU-HXUWFJFHSA-N	445.479	1.914	50	20	IDGD	
CC1CCN(C(=O)c2ccccc2NC(=O)C(=O)NNC(=O)CCc2ccco2)CC1	764167197	VUVWQDQGHWFJAZ-UHFFFAOYSA-N	426.473	1.870	50	20	IDGD	
CC(C)CCC(=O)NNC(=O)C(=O)Nc1ccc(F)c(S(=O)(=O)NC(C)(C)C)c1	764203501	TYVOACBOMKAWGK-UHFFFAOYSA-N	430.502	1.425	50	20	IDGD	
Cc1nc(-c2ccccc2NC(=O)C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)no1	764204925	VSOIJGOHUIPHBD-UHFFFAOYSA-N	446.464	1.436	50	20	IDGD	
COCCOc1c(Cl)cccc1NC(=O)C(=O)NNC(=O)COc1ccccc1O	764275550	NGCODMKXMOXDEO-UHFFFAOYSA-N	437.836	1.236	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)ccc1O)C(=O)Nc1ccc(-c2ncon2)cc1	764279683	BWIWHMFBPGHPIR-UHFFFAOYSA-N	446.217	1.604	50	20	IDGD	
CC(C)(C(=O)NNC(=O)C(=O)Nc1cccc(C(=O)N2CCOCC2)c1)c1ccccc1	764309527	PNFPWMHIJCOGCG-UHFFFAOYSA-N	438.484	1.223	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)N(C)[C@@H]3CCCN(C)C3)cc2)o1	764370021	KRMBIVDCBJZELJ-QGZVFWFLSA-N	441.488	1.154	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1)C(=O)Nc1ccc(-n2nccn2)cc1	764387194	GPXWVNURDQEPPK-UHFFFAOYSA-N	434.391	1.196	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1ccn(-c2ccc(Cl)cc2Cl)n1	764399023	JEQMFVUZOQQNRI-SNVBAGLBSA-N	444.275	1.317	50	20	IDGD	
O=C(/C=C/c1ccc2ccccc2n1)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765739510	WKVKIQUJCWERTM-OUKQBFOZSA-N	443.507	1.853	50	20	IDGD	
Cc1cccc(C)c1CNC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	767201983	PSOSRBIGXOJYLQ-UHFFFAOYSA-N	432.550	1.461	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)C[C@@H]2CN(C(=O)OC(C)(C)C)CCO2)c1	767490809	IPPGPDMNMPIEGI-MRXNPFEDSA-N	435.477	1.325	50	20	IDGD	
COCCC(=O)N1CCC(NC(=O)NNC(=O)c2ccc(Br)s2)CC1	767936787	FDDZUUQEYMJFAK-UHFFFAOYSA-N	433.328	1.482	50	20	IDGD	
COCCCNC(=S)N(C)NC(=O)CCc1ccc(S(=O)(=O)N2CCCC2)cc1	768736170	CPGCLUOWJYFUPI-UHFFFAOYSA-N	442.607	1.278	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)c1ccc(-n2cnc3ccccc32)nc1	768979511	CUBUTSIBANSBDC-UHFFFAOYSA-N	439.476	1.889	50	20	IDGD	
Cn1c(O)nc2ncc(-c3cccc(C(=O)NNC(=O)CNC(=O)c4ccco4)c3)cc21	771822414	CDPCOMGWBUKTTB-UHFFFAOYSA-N	434.412	1.125	50	20	IDGD	
O=C(CCC(=O)c1ccc2c(c1)OCCO2)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772197105	VUTOZGZIJQXJCU-UHFFFAOYSA-N	445.859	1.538	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)C[C@H]1CSCCN1C(=O)OC(C)(C)C	772207095	LZNBHTHVJOWCDM-KGLIPLIRSA-N	431.555	1.854	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@@H](NC(=O)NNC(=O)C(=O)Nc1ccccn1)C1CCCC1	775120485	MMWHPCWFRSKDEY-CQSZACIVSA-N	434.497	1.434	50	20	IDGD	
Cc1cc(C)nc(-n2nc(C)c(CC(=O)NNc3cccc(S(C)(=O)=O)c3)c2C)n1	776529157	FLHYTZMZECDDHZ-UHFFFAOYSA-N	428.518	1.985	50	20	IDGD	
CC(=NNC(=O)CN1c2cccc3cccc(c23)S1(=O)=O)C1CCS(=O)(=O)CC1	777429725	MBMLZVUDAVLDHJ-UHFFFAOYSA-N	435.527	1.665	50	20	IDGD	
COC(=O)Nc1ccc(S(=O)(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)cc1	777595558	HIFVFJHGBDOYAR-UHFFFAOYSA-N	439.446	1.514	50	20	IDGD	
COc1ccc(CCNC(=O)CSc2ccccc2C(=O)NN(C)C(N)=O)cc1OC	778415292	DABAYMCPJZTPLK-UHFFFAOYSA-N	446.529	1.810	50	20	IDGD	
COC(=O)c1cn(C2CN(C(=O)/C(C#N)=C/c3cc(C)n(C[C@H]4CCCO4)c3C)C2)nn1	779550261	UQNXBWVKCHIFII-QGCWPSNUSA-N	438.488	1.653	50	20	IDGD	
COc1ccc(C(=O)N2CCN(C)CC2)cc1NC(=O)C(=O)NNc1cccc(F)c1	783037294	MXYMLXBRKWTEHP-UHFFFAOYSA-N	429.452	1.304	50	20	IDGD	
Cc1cc(C)cc(NNC(=O)C(=O)Nc2ccc(NC(=O)CN3CCOCC3)cc2)c1	783355157	DGZWWHYNECQIQF-UHFFFAOYSA-N	425.489	1.656	50	20	IDGD	
COc1cc(C)ccc1Oc1ccc(NC(=O)C(=O)NN[C@@]2(C)CCS(=O)(=O)C2)cn1	783426038	LJTAGBABRXNMKL-FQEVSTJZSA-N	448.501	1.327	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNc2ccnc(F)c2)ccc1S(=O)(=O)N1CCCC1	784847141	OBIBBXODWNRCFP-UHFFFAOYSA-N	437.453	1.096	50	20	IDGD	
C[C@@H](C(=O)Nc1ccc(NC(=O)C(=O)NNc2cc(F)c(F)c(F)c2)cc1)n1cncn1	785083869	YNAUGGVMACZLRR-JTQLQIEISA-N	447.377	1.977	50	20	IDGD	
Cn1ncc(NC(=O)C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)c1C(F)F	785099563	IRYQCKSSXVQSDU-UHFFFAOYSA-N	428.346	1.610	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc(-n4cccn4)nc3)n[nH]2)c1	785128882	NAGCLDWEGDGYED-UHFFFAOYSA-N	444.455	1.674	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)Nc1ccc(Oc2cccc(F)c2F)nc1	786097376	RECGLWACPGGIEX-JTQLQIEISA-N	426.401	1.740	50	20	IDGD	
NC(=O)[C@@H]1CCC[C@H](C(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)C1	786723420	OXJURGROJMDDHI-MOPGFXCFSA-N	447.499	1.441	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)N[C@H]2CCCN(Cc3ccc(F)cc3F)C2=O)c1	786972243	JJUPRYTVKBUKIA-SFHVURJKSA-N	427.411	1.972	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)CC3CCC4(CC3)OCCO4)CC2)cc1	788098144	XHARQNNHGSFREB-UHFFFAOYSA-N	444.576	1.583	50	20	IDGD	
CC1=C(C(=O)NNC(=O)[C@H](C)Oc2cccc(Br)c2)[C@H](C)n2ncnc2N1C	788266588	XYPNCJXVHPKNEO-RYUDHWBXSA-N	449.309	1.940	50	20	IDGD	
Cc1nc(C(=O)NNc2nnc(-c3ccccn3)s2)nn1-c1n[nH]c(C(F)(F)F)n1	788558052	IDFHENSSRJWQMR-UHFFFAOYSA-N	437.371	1.383	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(-n3cccn3)cc2C)cc1OC	789584859	SABGEBDLSHNPQN-UHFFFAOYSA-N	437.456	1.988	50	20	IDGD	
COC(=O)c1ccc(C)c(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)c1	789809701	DWXNWTBJYJYBOS-WMZOPIPTSA-N	425.441	1.440	50	20	IDGD	
CCOc1nc(C)ccc1C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	790804599	UMMCWVWKQFWGMK-UHFFFAOYSA-N	433.534	1.482	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccc3c2OCC[C@@H]3OC)cc1	790952290	QKHWULPELXJSFP-KRWDZBQOSA-N	429.429	1.330	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)NCCCn2c(=O)ccn(C)c2=O)c(C)n1C[C@@H]1CCCO1	791263285	VJRWKORIDLFRAF-ACSPXDACSA-N	439.516	1.258	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N1CCO[C@]2(CCO[C@@H]2C)C1	792779240	DSOJNJLLAHSKKE-VEVIJQCQSA-N	442.310	1.837	50	20	IDGD	
COc1ccc(Cn2cc(NC(=O)C(=O)NNC(=O)COc3ccccc3F)cn2)cc1	793023329	NERHFRIOACWCMI-UHFFFAOYSA-N	441.419	1.244	50	20	IDGD	
O=C(NNc1ccc2c(=O)[nH]ccc2c1)C(=O)Nc1ccc(CN2C(=O)CCCC2=O)cc1	793070158	OIEQZTBYEBRMJB-UHFFFAOYSA-N	447.451	1.649	50	20	IDGD	
Cc1ccc(OCc2ccccc2)c(NC(=O)C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)c1	799835282	OORGBWNMFTUBIK-INIZCTEOSA-N	445.497	1.095	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)N[C@H]3COc4cc(F)c(Br)cc43)nc21	800745928	JIMMHLMIZATOLF-JTQLQIEISA-N	438.217	1.730	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)N[C@@H](Cn1ccccc1=O)c1ccccc1	800762047	COMOOLBQOHUZMA-IBGZPJMESA-N	430.468	1.810	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(N2C[C@@H](C(=O)NNc3cccc(F)n3)CC2=O)cc1	804772708	OEXZVAVJRYNNOM-AWEZNQCLSA-N	449.508	1.747	50	20	IDGD	
COC(OC)c1ccc(C(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)o1	807094154	USNVAWUTLLALJJ-UHFFFAOYSA-N	430.505	1.458	50	20	IDGD	
C[C@H]1[C@@H](NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)CCN1Cc1ccccc1	807622261	QRNRGMPYAGBRON-KXBFYZLASA-N	430.530	1.697	50	20	IDGD	
CCS(=O)(=O)N1CCC([C@H](C)N(C)CC(=O)NNC(=O)c2ccccc2Cl)CC1	808776118	QAUDIKVPBPSONF-AWEZNQCLSA-N	444.985	1.483	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccccc1C(F)(F)F)NNc1nc(O)c2ccccc2n1	810518096	YZLSLGNYOOFFLE-UHFFFAOYSA-N	441.391	1.776	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)[C@]1(c2ccccc2)CNC(=O)C1	811239173	VMPRQAURQHAIAK-NRFANRHFSA-N	445.859	1.111	50	20	IDGD	
CC(C)(C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)S(=O)(=O)c1ccc(Cl)cc1	813368154	XRIMSVYYPKVVOK-UHFFFAOYSA-N	448.892	1.329	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCc2nncn2C1)C(=O)Nc1ccc(F)cc1-c1ccc(F)cc1	815691373	OFQXMIWWRIXGKY-CYBMUJFWSA-N	440.410	1.572	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)Cn1c(S)nc2ccccc2c1=O	817054952	GAPRKYGFBGHFSG-UHFFFAOYSA-N	433.515	1.079	50	20	IDGD	
O=C(NNc1ncncc1F)C1CCN(c2ccc3nnc(C(F)(F)F)n3n2)CC1	817080790	DWIRLQNQWVXTLF-UHFFFAOYSA-N	425.350	1.432	50	20	IDGD	
O=C(CNc1ccccc1)NNC(=O)COc1ccc(I)cc1	823327565	RLWONQXTRNNMNA-UHFFFAOYSA-N	425.226	1.930	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)CNS(=O)(=O)c2ccc(C(C)=O)cc2)cc1OC	913068076	KQGRDOFAPOSTJM-UHFFFAOYSA-N	449.485	1.036	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C1=NN(c2ccc(F)cc2)[C@@H](C(N)=O)C1	913082952	CHQQGUXZAJCMLW-OAHLLOKOSA-N	433.827	1.369	50	20	IDGD	
O=C(NNC(=O)C1CC1)c1cc(S(=O)(=O)NC[C@@H]2CCCO2)ccc1Br	913415823	QKLVIKOJGXXVIJ-NSHDSACASA-N	446.323	1.077	50	20	IDGD	
COc1ccc(S(=O)(=O)N[C@H](C)C(=O)NNC(=O)COc2cc(C)ccc2C)cc1	913450247	IGHLJVVMKGAMFO-OAHLLOKOSA-N	435.502	1.205	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1ccc(N2CCOC2=O)cc1	915509699	DFDATWMZUCVGOD-UHFFFAOYSA-N	447.831	1.923	50	20	IDGD	
COc1cc(-n2cnnn2)c(Cl)cc1C(=O)NNC(=O)[C@H](C)Oc1ccc(F)cc1	916138353	HFWXQMLAOGERQO-JTQLQIEISA-N	434.815	1.692	50	20	IDGD	
CC(=NNC(=O)[C@H](C)Oc1cccc(C)c1C)c1ccc(S(=O)(=O)NCC(=O)O)cc1	916336747	NZVSPKCGXHWDBM-INIZCTEOSA-N	447.513	1.974	50	20	IDGD	
Cc1cc(C)c(NNC(=O)NCCS(=O)(=O)N2CCN(c3ccccn3)CC2)c(C)c1	916516267	IKQLKIRVHUIULJ-UHFFFAOYSA-N	446.577	1.785	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)NCc2nncn2-c2ccccc2)c2ccccc2c1=O	916580755	TVVZCJLDOCRDFJ-UHFFFAOYSA-N	446.471	1.702	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCc2cccc(C(=O)NC3CC3)c2)nc1	916649098	TZLNNTFZCYLZEI-UHFFFAOYSA-N	446.533	1.487	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)CN2CCc3ccccc32)c1	916734638	SLVPOSOYCVKLHU-UHFFFAOYSA-N	430.530	1.541	50	20	IDGD	
O=C(NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1)c1cn2cccnc2n1	916736760	RMCWDJXVSBTOGO-UHFFFAOYSA-N	442.482	1.666	50	20	IDGD	
NC(=O)c1ccc(/C=C\C(=O)N2CCC[C@@H]2C(=O)NNC(=O)NC2CCCCC2)cc1	920029494	DUZRVRCRHVNONN-ADYSOMBNSA-N	427.505	1.453	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)[nH]n1)Nc1cccc(CN2C(=O)CNC2=O)c1	920932373	GCUQIVVFHKYMAJ-UHFFFAOYSA-N	433.428	1.595	50	20	IDGD	
CCCNC(=O)NNC(=O)c1ccc(OC)c(S(=O)(=O)N[C@@H]2CCCC[C@H]2C)c1	921041617	FQOYZBPZMVBERG-UKRRQHHQSA-N	426.539	1.906	50	20	IDGD	
O=C(CNC(=O)c1cc(-c2ccccc2)on1)NNC(=O)c1cncn1-c1ccccc1	1318161752	WAZGJHBFRVZSKA-UHFFFAOYSA-N	430.424	1.718	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)c2ccc(N3CCOCC3)nc2)CC1	1318668369	UMYWFCKZOXGAHD-UHFFFAOYSA-N	433.509	1.326	50	20	IDGD	
COc1cccc2c1OC[C@@H](NC(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1)C2	1328685113	GBMGUGMZYLIFCU-INIZCTEOSA-N	448.520	1.976	50	20	IDGD	
O=C(NNC(=O)[C@H]1CS[C@]2(c3ccc(F)cc3)CCC(=O)N12)c1n[nH]c2c1CCCC2	1337156149	QZRFZTFTJIOJLX-IERDGZPVSA-N	443.504	1.779	50	20	IDGD	
CNS(=O)(=O)c1ccc(CC(=O)NNC(=O)c2cccc(Br)c2)cc1	1337857540	VTMGXGVEJVGENT-UHFFFAOYSA-N	426.292	1.361	50	20	IDGD	
O=C(c1c[nH]c2cc(Cl)ccc12)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1777787646	SPOYRKNPYRBGBJ-VQIMIIECSA-N	426.300	1.865	50	20	IDGD	
CC(=O)Nc1ccc(CC(=O)N2CC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)cc1	1778259203	YQHIWLPUBZOUKF-IBGZPJMESA-N	428.316	1.821	50	20	IDGD	
COC(=O)C12CCC(C(=O)N3CC[C@@]4(CN(C(=O)[C@@H](F)Cl)CCO4)C3)(CC1)CC2	1778303223	QMPUNFILACBMRG-HJXCVWKLSA-N	430.904	1.864	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)CS[C@H]3CCCCO3)C2)C1	1779084971	LBEPKOXRDQZFTM-QRTARXTBSA-N	435.384	1.860	50	20	IDGD	
O=C(c1nnc(-c2ccccc2)o1)N1CC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1779117344	ZFLUSVJNOXKDEQ-GOSISDBHSA-N	425.272	1.984	50	20	IDGD	
CN1Cc2ccccc2C[C@@H]1C(=O)N1CCO[C@]2(CCN(C(=O)CO[Si](C)(C)C)C2)C1	1779294327	NYWVTBQVLAQZLV-OFNKIYASSA-N	445.636	1.725	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(-c4ccccn4)[nH]n3)C2)C1	1779628650	IWEXEHMJXCNHHL-NRFANRHFSA-N	443.580	1.767	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(=O)cco1)C2)[C@@H](F)Br	1780771780	QBOGFGLFUKXTBM-CKEIUWERSA-N	431.258	1.458	50	20	IDGD	
C[C@H](Nc1cccnc1)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781330686	CYQJBNOQLIHDFW-JDFRZJQESA-N	429.290	1.402	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](NC(C)=O)C(C)(C)C)C2	1782172487	VUODDAWNKQZCAS-BZLDKRAPSA-N	445.988	1.305	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnn3c1OCCC3)C2	1782178013	CZPIPOUDYPMDSJ-RZQQEMMASA-N	440.928	1.047	50	20	IDGD	
CC(C)c1cc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CCC(=O)NN(C)C)C2)n[nH]1	1782212347	VPQARNWNSCGGNB-XMSQKQJNSA-N	448.568	1.034	50	20	IDGD	
Cn1nncc1C(=O)N1CCO[C@@]2(CCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1	1782864393	VEPZCDFSFVTEIW-JTVVXKTLSA-N	442.426	1.144	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)CNc3ccc(F)cc3)CCO2)C1	1783532859	OIRJQCHHRDMAJH-UGSOOPFHSA-N	428.302	1.851	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)CCO2)C1	1783537974	VDEAYCOSYHKGEI-APPDUMDISA-N	442.266	1.527	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H]3CCc4nc[nH]c4C3)C2)C1	1784346007	UVZOZQJMIPKPJF-PJIJBLCYSA-N	439.354	1.376	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(CCN(C(=O)[C@@H]3CCc4nc[nH]c4C3)C2)C1	1784346407	WYKRFMIGBPDZEX-FZKQIMNGSA-N	425.327	1.130	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H]3CCCSC3)C2)C1	1785473139	NWRGVLOKHIQJJA-OCCKZLSWSA-N	447.561	1.094	50	20	IDGD	
COc1ncc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CO[Si](C)(C)C)C[C@@H]32)cc1C	1786269726	PNMDCPQGSUGFLL-SZMVWBNQSA-N	435.597	1.843	50	20	IDGD	
Cc1nnc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)CBr)C[C@@H]32)s1	1787056596	LYGGMNYKOYIQFT-PYJNHQTQSA-N	445.383	1.400	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)c1c[nH]c2ncccc12	1787875798	UVHZKAUQMKXRPO-FBUXBERBSA-N	439.285	1.847	50	20	IDGD	
Cc1nnsc1C(=O)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1	1788143667	LEAFWIOYHGXMKU-UHFFFAOYSA-N	436.302	1.588	50	20	IDGD	
COc1cc(Cl)ccc1CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21	1790709273	RDBJZBNYIITWLE-MBGYTDRXSA-N	445.343	1.471	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3ccccc3O)[C@H]2C1	1790895895	DRTLSVXJMABGLL-VKZRIFJHSA-N	439.350	1.945	50	20	IDGD	
COCc1oncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]2C1	1791057121	CVNDYFKPPNSVGU-XWUBHJNHSA-N	430.299	1.198	50	20	IDGD	
CCn1nc(C)cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)Br)[C@H]2C1	1791057290	KDKRVGJLCMJDJT-YXWQFLTLSA-N	427.343	1.588	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnoc1C1CC1)C2	1792870169	JYNYKPZYECTFPA-IKVITTDRSA-N	426.311	1.786	50	20	IDGD	
CC1=NN(c2ccc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)[C@H](O)CCl)cc2)C(=O)C1	1793115508	PWEWZXRXDXYEDW-BZZMCLGOSA-N	432.908	1.651	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(C)(C)NC(=O)OC(C)(C)C	1793629537	ZXFXPPAFOORISN-LXTVHRRPSA-N	447.960	1.133	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ncsc1Br)C2)[C@H](F)Cl	1796363605	TZXQWOHFHOOYEO-PJFCORBGSA-N	426.695	1.643	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc2c(c1)n(C)c(=O)n2C	1797505535	XWJNUCDGEPHYCB-REBRKWNGSA-N	449.349	1.912	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1(c3ccc(O)cc3)CC1)C2	1797953635	AZZGEFHWYOEZQI-CWPLJXCYSA-N	432.593	1.865	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnsn1)C2	1799220033	HCIJDKNGYLKKRC-CLLJXQQHSA-N	445.457	1.937	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Br	1799346862	CVMGPAFIBYUOSQ-FAXLKDOZSA-N	439.285	1.536	50	20	IDGD	
CC(C)[C@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)c1ccc(F)cc1	1800878313	DFXJZZUSAGTXOG-PTIUUAQKSA-N	426.916	1.755	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1ccc(N(C)C)cc1)C2	1800981429	MWONIEGJTNIMKP-SHJAMOMRSA-N	437.968	1.529	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ncccc1C(F)(F)F)C2	1802337073	FNZRMEXGWCVZMB-BTTYYORXSA-N	441.454	1.725	50	20	IDGD	
CC(=O)Nc1cc(C(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)ccn1	1803139366	ONEJGDFHGWJILE-ZIFCJYIRSA-N	445.907	1.354	50	20	IDGD	
N#Cc1ccc(CC(=O)N2CCCC3(CCN(C(=O)c4ccc(B(O)O)cc4)CC3)C2)cc1	1804942909	JLVZDJXIUZPWIB-UHFFFAOYSA-N	445.328	1.326	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2cncc(F)c2)[C@@H]1c1cccnc1	1805849611	LFIDMYIPGHQLCN-IERDGZPVSA-N	442.495	1.308	50	20	IDGD	
Cc1noc(C)c1CC(=O)N1CCCC2(CCN(C(=O)c3ccc(B(O)O)cc3)CC2)C1	1806762035	LOSMTBJXHZZQPJ-UHFFFAOYSA-N	439.321	1.059	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)/C=C/C2CCCC2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807363293	BRWXMRRGUCXIET-AHIKMHNJSA-N	447.344	1.827	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2nc3ccccn3n2)[C@@H]1c1cccnc1	1807934001	JOFDTCCJMCQQFK-BQFCYCMXSA-N	442.907	1.698	50	20	IDGD	
Cc1cc(C(=O)NC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)cn1C	1808731144	SAEOOZJINIVZPV-PGRDOPGGSA-N	440.548	1.421	50	20	IDGD	
Cc1[nH]ccc1C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1	1810302129	GQXXIRFYFRXVIC-OXQOHEQNSA-N	447.499	1.350	50	20	IDGD	
CC(=O)NC(C)(C)C(=O)N1CC[C@@H](CNC(=O)CO[Si](C)(C)C)[C@@H]1c1cccnc1	1810537508	JAAJBGHXULHLOH-HKUYNNGSSA-N	434.613	1.854	50	20	IDGD	
COc1cc(C#N)cc(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)c1	1811407544	WOJQXVFPBYJMPL-FFZOFVMBSA-N	442.903	1.881	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)c2cc(=O)ccn2C)[C@@H]1c1cccnc1	1812867242	NXIATUCGYBBLMU-JCKWVBRZSA-N	447.333	1.883	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)Cc2ccccc2)[C@@H]1c1cccnc1	1813034763	WVVHLBKCYJDJSP-XSDIEEQYSA-N	445.947	1.945	50	20	IDGD	
C[C@@H]1CC[C@H](C(=O)N2CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)O1	1813070403	IXUWBNQQRRRGBU-QTQZEZTPSA-N	431.537	1.028	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H](CNC(=O)CCn2ccnn2)[C@@H]1c1cccnc1	1813432324	GFLZCIBTMKOPFM-XLIONFOSSA-N	430.585	1.621	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)[C@H](O)CCl)n[nH]2)n1	1814868080	VALMOQFUUPBRLY-LSDHHAIUSA-N	434.884	1.669	50	20	IDGD	
O=C(CCc1ccco1)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1	1815336873	HDBXJSYTAUZAMI-HNNXBMFYSA-N	439.302	1.275	50	20	IDGD	
Cc1ncc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)s1	1815341326	WOXBUMFKKBNPBS-CYBMUJFWSA-N	442.331	1.127	50	20	IDGD	
Cc1ccoc1C(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1	1815341330	WPZXOFCXEDRMDT-AWEZNQCLSA-N	425.275	1.264	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1ccsc1)CC2)c1cccc(B(O)O)c1	1815355160	PQRUFKXYQBMZIZ-AWEZNQCLSA-N	427.316	1.424	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CS(C)(=O)=O)n[nH]1	1817054044	WPXVDUSMTQQRAP-PWSUYJOCSA-N	435.344	1.477	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](N)Cc3cccnc3)sc2C1	1817192596	QDDJBCSPEFHCOC-IHRRRGAJSA-N	437.953	1.274	50	20	IDGD	
N#Cc1cccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)c1	1817472814	ZBQGQYGPPMONQG-FQEVSTJZSA-N	443.272	1.581	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)CCl)CC2)c1cc(N2CCCC2)ccn1	1817576726	FGQDNUKNFSKSPX-WBMJQRKESA-N	449.964	1.964	50	20	IDGD	
CN1CCN(CC(=O)N2CCCC[C@H]2c2cc(NC(=O)CO[Si](C)(C)C)n[nH]2)CC1	1819594024	XOYMZFJFJFENBM-KRWDZBQOSA-N	436.633	1.501	50	20	IDGD	
Cc1cc[nH]c1C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1	1819793739	SFAUOKWAKCQBSJ-LLVKDONJSA-N	439.501	1.318	50	20	IDGD	
COC[C@@H](NC(C)=O)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CO[Si](C)(C)C)CC2	1820193535	XMYXWGOQYPHLDK-TZMCWYRMSA-N	442.614	1.058	50	20	IDGD	
CN(C)C(=O)NCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](F)Br)n[nH]1	1820934863	RCNGJMRDERPPEU-ZWNOBZJWSA-N	433.282	1.364	50	20	IDGD	
O=C(O)CSCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](F)Br)n[nH]1	1820936418	BZVKQWFGQLUEOP-NOZJJQNGSA-N	437.291	1.910	50	20	IDGD	
O=C(CN1C(=O)C=CC1=O)Nc1cc([C@@H]2CCCCN2C(=O)CCBr)[nH]n1	1822530122	MOGSUXOAXMQGFJ-LBPRGKRZSA-N	438.282	1.112	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CN2CC(=O)NC2=O)CC1	1824608951	DWTOQJMTVPKCCI-HOTGVXAUSA-N	426.945	1.565	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)CCc2ccco2)CC1	1825247066	XOXIANLDMWBMDH-JOCHJYFZSA-N	438.333	1.826	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](C)n1cnnn1)CC2	1825453155	PXMLFUSSJKFYFI-GUBZILKMSA-N	442.343	1.476	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1c(O)cc(O)cc1O)CC2	1826007150	RZTJULLFMYKSAP-PSASIEDQSA-N	441.893	1.740	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](N)CCC(N)=O)CC1	1826821089	SQDRPECCUSSYMJ-DOXZYTNZSA-N	435.396	1.435	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@H](O)CCl)CC3)c1	1827741925	WPJJGUCMOZZPNS-UKRRQHHQSA-N	436.921	1.927	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CNc3ccc(F)cc3)C2)C1	1830359843	WGXQGYLSDIQLHM-OAQYLSRUSA-N	441.931	1.959	50	20	IDGD	
C=C(C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2)C(F)(F)F	1830544504	ZTLPUMOVZWECMN-XHDPSFHLSA-N	443.260	1.592	50	20	IDGD	
CN(CC(=O)N1CCCC[C@@H]1C1CCN(C(=O)CO[Si](C)(C)C)CC1)C(=O)C(=O)O	1831165401	MYPZEPKGEIAFGY-MRXNPFEDSA-N	441.601	1.001	50	20	IDGD	
CN[C@H](CC(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](C)Br)CC1)C(=O)O	1831649558	BOQJVJMAHPMCHU-YUELXQCFSA-N	432.359	1.452	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)Oc3ccccn3)C2)C1	1831657422	OGJSQVOEDZQKAQ-LLGFUMIMSA-N	439.940	1.713	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)/C=C\C(=O)NC2CC2)CC1	1831831324	UUDAFSRVTPRKIG-JKCVZHOFSA-N	425.957	1.695	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CN2CCCCC2=O)CC1	1831832332	CFYVQXKWXLZFFR-ZWKOTPCHSA-N	427.973	1.872	50	20	IDGD	
O=C(C(Cl)Cl)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1COc3ccccc3O1)CCO2	1832499724	WSMCAXAAXIVQKU-KXBFYZLASA-N	445.299	1.087	50	20	IDGD	
Cc1nc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)cs1	1832971656	LNWHHUXLFMDPQS-IBGZPJMESA-N	441.626	1.302	50	20	IDGD	
O=C(COc1ccc(O)cc1)NC1CCN(C2CCN(C(=O)[C@@H](F)Cl)CC2)CC1	1833210777	DFJUHTUDGMZVIK-LJQANCHMSA-N	427.904	1.877	50	20	IDGD	
CC(C)(C)c1cc(C(=O)N2CCC(N3CCC(NC(=O)[C@@H](O)CCl)CC3)CC2)[nH]n1	1833312642	UQMDNNPYPQKIPP-KRWDZBQOSA-N	439.988	1.492	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3coc(C(C)C)n3)CCO2)C1	1833350590	CZTQTXFFKLYBJE-AUUYWEPGSA-N	429.901	1.122	50	20	IDGD	
CC[C@H](C(=O)NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)N(CC)CC	1833535922	SOZNHNGYVOILOG-RTBURBONSA-N	431.021	1.278	50	20	IDGD	
CO[C@H](C(=O)NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)c1ccccc1	1834577072	MCWWMLARWIJFID-PMACEKPBSA-N	437.968	1.545	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)c1ccc2nccn2c1	1835413165	IFUPZOWYPVUMLI-SFHVURJKSA-N	433.940	1.119	50	20	IDGD	
Cn1ccc(CC(=O)N2CCC(N3CCC(NC(=O)CO[Si](C)(C)C)CC3)CC2)n1	1835837625	QFMMYMHUDXGLQA-UHFFFAOYSA-N	435.645	1.386	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC1CCN(C2CCN(C(=O)Cn3ccnc3)CC2)CC1	1836398250	DRQVHOWABPMSFY-LJQANCHMSA-N	430.380	1.691	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC(OC2CCN(C(=O)[C@@H]3C[C@@H]3C3CC3)CC2)CC1	1836657462	RGLOZPZIURVOLZ-FGZHOGPDSA-N	440.349	1.025	50	20	IDGD	
Cc1nc(CC(=O)N2CCC(OC3CCN(C(=O)[C@H](O)CCl)CC3)CC2)cs1	1836715133	JXPRHPRTYNCSBC-QGZVFWFLSA-N	429.970	1.592	50	20	IDGD	
Cc1cc(C)nc(C(=O)N2CCOC[C@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)c1	1837711871	UUNCHGBEGHCWGO-NRFANRHFSA-N	435.597	1.620	50	20	IDGD	
Cn1ccc(CC(=O)N2CCC(OC3CCN(C(=O)[C@H](F)Br)CC3)CC2)n1	1837948520	GLWYTGXUNFZDNH-KRWDZBQOSA-N	445.333	1.652	50	20	IDGD	
CC[C@@H](NC(N)=O)C(=O)N1CCC(OC2CCN(C(=O)CO[Si](C)(C)C)CC2)CC1	1838068088	YAGGDTXBQQNOQM-QGZVFWFLSA-N	442.633	1.283	50	20	IDGD	
COc1ccsc1C(=O)N1CCO[C@]2(COCCN(C(=O)CCBr)C2)C1	1838292191	ZEHBXKFNEATUGY-KRWDZBQOSA-N	447.351	1.612	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cscn3)C2)C1	1839151820	FAMDMXATXCMMPP-DLBZAZTESA-N	436.361	1.378	50	20	IDGD	
CCc1ccnc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)c1	1839199689	RWXGWQGPDXQVTG-QAPCUYQASA-N	444.301	1.405	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)c(C)n1C	1839200364	JFZOWGZIMAMEEP-MAUKXSAKSA-N	446.317	1.402	50	20	IDGD	
O=C(c1ccccc1F)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839202255	YQZWSIDXJUGFRZ-RHSMWYFYSA-N	433.249	1.586	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1C[C@@H]1F)CCO2	1839771354	BPIFVCGKEKTVAO-SZYHELCZSA-N	449.429	1.686	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cscn3)C2)C1	1839964667	YQRHZQBLDFOXPL-WMLDXEAASA-N	446.367	1.316	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3nccc4occc34)C2)C1	1840151991	TVADFSJBLYMWEF-FOIQADDNSA-N	437.880	1.152	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)Cc1ccco1)CCO2	1840472330	BXFWXOMTXFIUAK-DOXZYTNZSA-N	443.338	1.698	50	20	IDGD	
Cc1cc(F)ccc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1840778763	NNCPHBFCBPCKGX-CRAIPNDOSA-N	447.276	1.895	50	20	IDGD	
CC(=O)NC(C)(C)C(=O)N1CCCC12CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1841620496	CZVJJMJWBQNTBJ-AWEZNQCLSA-N	444.960	1.237	50	20	IDGD	
Cn1nncc1C(=O)N1CCCC12CN(C(=O)[C@@H](Br)Cc1ccccc1)C2	1842134824	XGWMRFAXOHSKPI-HNNXBMFYSA-N	432.322	1.638	50	20	IDGD	
O=C([C@H](F)Cl)N1CC2(CCCN2C(=O)c2ccc3nnc(Br)n3c2)C1	1843126466	NVAKOFBBCGNLPV-NSHDSACASA-N	430.665	1.843	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC12CN(C(=O)[C@@H](O)CCNC(=O)OC(C)(C)C)C2	1846178212	KSRGKGYAJJULEC-STQMWFEESA-N	448.358	1.249	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)c1ccc(N3N=C(C)CC3=O)cc1)C2	1846363473	LLOKUFANJQYPQG-KRWDZBQOSA-N	432.908	1.870	50	20	IDGD	
C#CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)[C@H](F)Br)C2	1847071986	SBNJACREHGIGEF-STQMWFEESA-N	446.317	1.797	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](O)CCl)C1	1847562862	CPGBZFRFPANBAM-NRKLIOEPSA-N	443.972	1.871	50	20	IDGD	
CSC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl	1847568125	OAFGZPKGBXMPCH-XDQVBPFNSA-N	435.974	1.044	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2c[nH]nc2-c2ccc(F)cc2)ccc1Cl	10099275	CFYXJXXAKBMYML-UHFFFAOYSA-N	437.840	1.591	50	20	IDGD	
O=C(CNC(=O)c1cccc([N+](=O)[O-])c1)NNC(=O)Cc1nc(-c2ccccc2)cs1	10600520	VBLXLDQSLNTHPA-UHFFFAOYSA-N	439.453	1.838	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)C(=O)c2c(C)nn(C)c2C)cc(OCC)c1OCC	16230041	GJMQRHWSWRPHCD-UHFFFAOYSA-N	432.477	1.877	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)c1ccc(CS(=O)(=O)c2ccccc2)o1	26974312	NAESKOUXRXRCSA-IBGZPJMESA-N	442.449	1.855	50	20	IDGD	
O=C(NNC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)c1ccc(F)cc1F)C(=O)N1CCCC1	726160900	NGIDUCMFSFZHJU-KKXDTOCCSA-N	448.470	1.508	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCC(=O)N2CCc3ccccc32)nc1	726281244	HYPAYFYHLWHLMP-UHFFFAOYSA-N	446.533	1.328	50	20	IDGD	
C[C@H]1CC(C)(C)C[C@@]2(C1)NC(=O)N(CC(=O)NNc1nc(-c3ccncc3)no1)C2=O	726377424	YZDCHMIQYDPNAZ-FKIZINRSSA-N	427.465	1.712	50	20	IDGD	
CC1CCN(c2ccc(C(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)cn2)CC1	727098802	GATWTFPOEOAKQL-UHFFFAOYSA-N	445.545	1.643	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)c3cccc(C)c3)CC2)cc1	727348567	WDJBXQFVYZXPSL-UHFFFAOYSA-N	430.530	1.071	50	20	IDGD	
CS(=O)(=O)CCNC(=O)NNC(=O)c1cn(-c2ccccc2)nc1-c1ccccc1	727943141	XFRPNKSFCKESJK-UHFFFAOYSA-N	427.486	1.528	50	20	IDGD	
CSC[C@H](C(=O)NNc1nc(-c2cccnc2)no1)N1C(=O)[C@H]2CCCC[C@@H]2C1=O	728079578	YHRWNTLJWXRJEO-MELADBBJSA-N	430.490	1.482	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)cc1	728213063	CXJIJCKFWAIJEJ-UHFFFAOYSA-N	431.518	1.338	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)c1ccc([N+](=O)[O-])cc1I	728850190	KABPXESHLBQONX-UHFFFAOYSA-N	426.170	1.598	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)c1ccccc1)C(=O)NNC(=O)c1cccc(C#N)c1	728871667	ABAVNNBCQNMOCZ-KRWDZBQOSA-N	432.527	1.419	50	20	IDGD	
CS(=O)(=O)N1CCCc2cc(C(=O)NNC(=O)Cn3ccc4ccccc43)ccc21	729450496	YAIPGWQHLPHKLU-UHFFFAOYSA-N	426.498	1.815	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)Cc1c(C)nc(-c2ncccn2)nc1O	729512348	FZAPAQVWHWTLHT-UHFFFAOYSA-N	428.836	1.613	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)NCCC(=O)N1CCN(c2ccccn2)CC1	729605637	IXJQSZQWUVUMBD-UHFFFAOYSA-N	449.515	1.106	50	20	IDGD	
COc1ccc(-c2nc(C(=O)N([C@@H]3CCS(=O)(=O)C3)N(C)C)cs2)cc1OC	730732771	QCRLBCVMEAZUNN-CYBMUJFWSA-N	425.532	1.933	50	20	IDGD	
COc1cccc(C(=O)NNS(=O)(=O)c2cc(Br)cc(F)c2OC)c1O	730766520	RIEQZLFDVFQPME-UHFFFAOYSA-N	449.254	1.934	50	20	IDGD	
CC(=O)Nc1cc(F)c(S(=O)(=O)NNC(=O)COc2ccccc2O)cc1Cl	730812274	NEQKEGKEPDZYFQ-UHFFFAOYSA-N	431.829	1.532	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)c2ccc(S(=O)(=O)C3CCCC3)cc2)C[C@@H](C)O1	732259889	KTCNENSJUJSMFX-HZPDHXFCSA-N	437.562	1.663	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)NCCCc2ccccc2)cc1Br	732306294	XPAQGYGSVCPGIL-UHFFFAOYSA-N	434.290	1.968	50	20	IDGD	
C[C@@H](NC(=O)CC1CCCCC1)C(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	732334742	FUTMDAFRLFIOIV-CYBMUJFWSA-N	434.449	1.374	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)N(C)Cc1ccccc1	732470315	YMGKGJVXILWLFO-INIZCTEOSA-N	447.561	1.401	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)N[C@H]2CCN(CC(F)(F)F)C2=O)cc1	732589820	FUZFIXXUVJTPQJ-FZMZJTMJSA-N	432.399	1.346	50	20	IDGD	
COc1cc(-n2cnnn2)c(Cl)cc1C(=O)NNC(=O)c1cnn(-c2ccccc2)c1	733108888	QDMCCCQYIUFYQA-UHFFFAOYSA-N	438.835	1.585	50	20	IDGD	
CC(C)Cn1nc(C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)c2ccccc2c1=O	734241338	BTFFYIBITVSBAA-UHFFFAOYSA-N	446.508	1.521	50	20	IDGD	
COc1ccc2c(c1)OC[C@@H](C(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1)C2	734826025	UDOKTVIHJINYNS-HNNXBMFYSA-N	448.520	1.976	50	20	IDGD	
O=C(COC(=O)[C@@H]1C[C@@H]1c1c(F)cccc1F)NNC(=O)[C@@H]1COc2ccccc2O1	734924239	SKBUNXKAFYJWFZ-JKDFXYPNSA-N	432.379	1.599	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)CCCOc2ccc(Cl)cc2Cl)c(=O)n(C)c1=O	734989435	CINCIHCSPUKEGV-UHFFFAOYSA-N	429.260	1.011	50	20	IDGD	
O=C(O)COc1ccc(S(=O)(=O)NNC(=O)COCc2ccccc2)cc1Cl	737756521	QDASFFLORJYAMY-UHFFFAOYSA-N	428.850	1.330	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)c1ccc(C)c(S(=O)(=O)N2CCCCC2)c1	740852470	BKJJOPIPBXIQDJ-UHFFFAOYSA-N	438.550	1.235	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)CN2C(=O)[C@H]3[C@H](C2=O)[C@H]2CC[C@H]3O2)c(C)n1-c1ccccc1	742469419	AGFARBGTKDVRFD-HNBVOPMISA-N	436.468	1.018	50	20	IDGD	
O=C(CCNC(=O)c1ccc([N+](=O)[O-])cc1)NNC(=O)c1cccc(Br)c1	742769284	MEFNIOFDHOLCTH-UHFFFAOYSA-N	435.234	1.938	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)N[C@@H](C)CN1CCN(c2ccccc2)CC1	743507763	IBNYGNKFMKKRRM-KRWDZBQOSA-N	435.532	1.797	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)O[C@H](C)C(=O)Nc2cccc(S(N)(=O)=O)c2)cc(C#N)n1C	744633651	YMQLLHFEIBVBJQ-QVYJARAXSA-N	441.469	1.330	50	20	IDGD	
CN(C)C(=O)[C@H]1CCCN1CCCNC(=O)NNC(=O)c1cccc(Br)c1	745796425	RVRSLGSRGBZYRG-OAHLLOKOSA-N	440.342	1.336	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@@H]2CCOc3cc(OC)ccc32)c2ccccc2c1=O	745860868	FIHSSBWOZXJRNM-QGZVFWFLSA-N	437.456	1.893	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)CC2CN(C(=O)OC(C)(C)C)C2)c2ccccc2c1=O	746013755	OIAOCFYOYFREHM-UHFFFAOYSA-N	443.504	1.825	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)[C@@H]1CCCN1Cc1ccccn1	746331774	IXMRSIPQYBCMST-IBGZPJMESA-N	445.545	1.210	50	20	IDGD	
O=C(COc1ccc(C(=O)c2ccc(Cl)cc2)cc1)NNC(=O)C(=O)N1CCCC1	748240839	ZBZHKNKBFNEZRK-UHFFFAOYSA-N	429.860	1.720	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)[C@H]2CCCN2C(=O)CC(C)(C)C)cc1OC	748384383	GEHYYRJFEFYZMQ-OAHLLOKOSA-N	449.504	1.435	50	20	IDGD	
Cc1[nH]c2ccnn2c(=O)c1CC(=O)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1	748519720	BYUFJDDWUMWMMH-UHFFFAOYSA-N	429.380	1.310	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)[C@H](NS(C)(=O)=O)C(C)(C)C	748594452	SZVJAKSAFBXSAI-AWEZNQCLSA-N	434.584	1.170	50	20	IDGD	
CCN1CCN(C(=O)CNC(=O)/C(C#N)=C/c2cc(C)n(C[C@@H]3CCCO3)c2C)CC1	750734118	ONHXDKAGGICFAM-OABJIQBASA-N	427.549	1.471	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)c2cccc(CN3CCS(=O)(=O)CC3)c2)c1	751290176	JEQFNZJSCRHASJ-UHFFFAOYSA-N	447.513	1.009	50	20	IDGD	
O=C(NC[C@@H](O)CS(=O)(=O)c1cccs1)NNC(=O)c1ccc2ccccc2c1	752143228	NPDJYTGSUQEGHK-MRXNPFEDSA-N	433.511	1.680	50	20	IDGD	
CC(C)Oc1cc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)ccn1	752697438	PKGLTJHXAIJBMO-UHFFFAOYSA-N	435.506	1.263	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@@H]2CCCCS2)c1	753259768	DACOSMRYUDKUGH-HNNXBMFYSA-N	428.580	1.947	50	20	IDGD	
CCc1cc(NNC(=O)c2cnn3c2C[C@@H](CNC(C)=O)CC3)nc(-c2ccccn2)n1	754223158	HZCFSJAGDCFNIC-HNNXBMFYSA-N	434.504	1.753	50	20	IDGD	
COc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NNC(=O)c2cc(C)nc3ccccc23)cc1	754777998	VFJOQWHDFTXXPM-AWEZNQCLSA-N	442.497	1.680	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)Nc1cc(C)nn1[C@@H]1CCS(=O)(=O)C1	755528953	AGASICPOMNOASH-GFCCVEGCSA-N	441.897	1.680	50	20	IDGD	
COC(=O)CCNC(=O)c1ccc(NC(=O)NNC(=O)COc2ccc(Cl)cc2)cc1	755603581	LAGKCQNFRDNCNV-UHFFFAOYSA-N	448.863	1.865	50	20	IDGD	
CCc1c(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cnn1CC(C)C	756364640	DRTRROGLMHXERB-GOSISDBHSA-N	430.461	1.246	50	20	IDGD	
C[C@@H]1CN(C(=O)Cn2cc(NC(=O)NNC(=O)c3cc4ccccc4o3)cn2)C[C@@H](C)O1	756839015	PABMUGPSDXIPES-ZIAGYGMSSA-N	440.460	1.732	50	20	IDGD	
C[C@H]1CN(C(=O)Cn2cc(NC(=O)NNC(=O)c3c[nH]c4ccccc34)cn2)C[C@H](C)O1	756839721	SLGICUTYWJQNMZ-KBPBESRZSA-N	439.476	1.467	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Cc2ccn(-c3ccccc3)n2)c1	756902006	ZSKZNQFZSXDIKV-UHFFFAOYSA-N	427.486	1.126	50	20	IDGD	
CN(c1ccccc1NC(=O)NNC(=O)COc1ccc(Cl)cc1)S(C)(=O)=O	757660299	BHVBVUJBYWBZLG-UHFFFAOYSA-N	426.882	1.968	50	20	IDGD	
COCCOc1ccc(CC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1	757766208	NMQSCPJEMJDYQY-UHFFFAOYSA-N	449.529	1.031	50	20	IDGD	
Cc1nn([C@H]2CCS(=O)(=O)C2)c(C)c1NC(=O)NNC(=O)COCc1ccccc1	757872173	UOKQZGHTDCBAFX-INIZCTEOSA-N	435.506	1.229	50	20	IDGD	
CCCCOc1c(Cl)cc(C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)cc1OCC	758043110	FNCONDDDPNRXRR-LLVKDONJSA-N	435.930	1.616	50	20	IDGD	
CC(=O)N1CCN(S(=O)(=O)c2ccc(C(=O)NNc3cc(C)ccc3F)cc2)CC1	760137059	OHUAEKLBFWVBID-UHFFFAOYSA-N	434.493	1.744	50	20	IDGD	
O=C(C[C@H]1Sc2ccc(Cl)cc2NC1=O)NNc1nccc(N2CCOCC2)n1	762856302	JUAIEKZQURJIPI-CQSZACIVSA-N	434.909	1.913	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cc3ccccc3cc2O)ccc1F	763527775	PKKAQFVLPRZCML-UHFFFAOYSA-N	425.372	1.871	50	20	IDGD	
Cc1c(Cl)cccc1NC(=O)C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	763531607	PQEMUIYWEOPHHC-UHFFFAOYSA-N	443.935	1.947	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)C(=O)Nc1ccc(N2CCCC2=O)c(Cl)c1	763550495	AUYURKBBELXJDI-UHFFFAOYSA-N	444.831	1.595	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)C(=O)Nc1ccc(-c2nccs2)cc1	763802688	FTKYCCWZDVJVPD-UHFFFAOYSA-N	441.425	1.883	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)c1cc(N2CCCC2=O)cc(C(F)(F)F)c1	763825005	OOTPDVKDNLCWFW-UHFFFAOYSA-N	449.389	1.418	50	20	IDGD	
COC(=O)c1c(F)cccc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1cccc(C)c1C	763852480	WLTZMHRDTLJSSJ-CYBMUJFWSA-N	431.420	1.783	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1cccc(Cl)c1-n1cncn1	763856915	IVDUHQZTCMCKSL-NSHDSACASA-N	446.826	1.613	50	20	IDGD	
COC(=O)N(C)Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)cc1	763858486	SYAMGPZUTWSROM-ZDUSSCGKSA-N	446.435	1.577	50	20	IDGD	
CN1CCN(Cc2cccc(NC(=O)C(=O)NNC(=O)Cc3c[nH]c4ccccc34)c2)CC1	763865237	MSNCZLFXBOONPW-UHFFFAOYSA-N	448.527	1.244	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)N1C[C@H]2CCCN2c2ccccc21	763865439	PWYKTKKOOZCGKU-HUUCEWRRSA-N	426.448	1.756	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNC(=O)CC(C)C)cc1S(=O)(=O)N(CC)CC	763882321	NFVNHIYCUUKRBC-UHFFFAOYSA-N	442.538	1.248	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(C(N)=O)ccc2C)cc1OC	763910353	FRVGUNLMMLMNKM-UHFFFAOYSA-N	428.445	1.291	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(C(F)(F)F)cc2Br)n[nH]1	764106622	NQTQGKKCSJYUIQ-UHFFFAOYSA-N	434.172	1.899	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3ccnc(Cl)c3F)cc2)CC1	764140371	NRVGIPZXYOUABR-UHFFFAOYSA-N	427.889	1.567	50	20	IDGD	
COC(=O)CCSc1cccc(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)c1	764168198	OGAKTBSILJSJJI-KRWDZBQOSA-N	443.481	1.431	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(N3CCOCC3)c3ccncc23)cc1	764177780	QVGSTHMANUVAAV-UHFFFAOYSA-N	444.451	1.343	50	20	IDGD	
CC(C)CCC(=O)NNC(=O)C(=O)Nc1ccc2c(ccn2CC(=O)N2CCOCC2)c1	764199493	TTYMYZAADCWPFP-UHFFFAOYSA-N	443.504	1.022	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)CC(C)(C)C)c(Br)cc1F	764202156	MSAVCQSODZCYGG-UHFFFAOYSA-N	432.246	1.897	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)CCc3ccccc3O)cn2)C[C@@H](C)O1	764281501	YJGROXFMONGPFR-GASCZTMLSA-N	441.488	1.120	50	20	IDGD	
N#Cc1cccc(COc2ccc(NC(=O)C(=O)NNC(=O)Cc3cc[nH]n3)cc2F)c1	764285890	OICFHQPAKWTIQY-UHFFFAOYSA-N	436.403	1.328	50	20	IDGD	
CCOCC(=O)NNC(=O)C(=O)Nc1ccc(Cl)cc1C(=O)N1[C@@H](C)CCC[C@@H]1C	764317081	IMQHZXAXPSJTCU-STQMWFEESA-N	438.912	1.866	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)c1cnn(-c2ccccc2)c1C(F)(F)F	764343849	SSRQLMJSEAKUGD-UHFFFAOYSA-N	432.362	1.477	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)C(=O)Nc1ccc(OC[C@H]2CCCO2)cc1	764394857	VOXRSDYSOLETPS-MRXNPFEDSA-N	445.497	1.828	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1cccc(N2CCNC2=O)c1	764397361	HJSVSEQWMWWOLZ-UHFFFAOYSA-N	443.485	1.103	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)Cn2nc(C)cc2C)c(I)c1	765414968	RTMPCFHQUSVZLZ-UHFFFAOYSA-N	443.245	1.966	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](CC(F)F)C(=O)NNC(=O)c1nnc(O)c2ccccc12	765530119	IXADDUGQNNEVPW-LLVKDONJSA-N	425.392	1.645	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCCC(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)cc1C	765569019	CDXRUAYUZHVZNR-UHFFFAOYSA-N	447.542	1.885	50	20	IDGD	
CCSc1ccc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cn1	765737108	WFOZHMBWKWUSFM-UHFFFAOYSA-N	427.530	1.413	50	20	IDGD	
CN1CCO[C@@H]([C@@H](NC(=O)NNC(=O)COc2ccccc2O)c2ccc(Cl)cc2)C1	766320403	NUHGCXFEZWZJEV-QUCCMNQESA-N	448.907	1.827	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)[C@H]1Cc2cc(F)ccc2O1	766659449	BKCFWHVBMITMQQ-HXUWFJFHSA-N	446.910	1.748	50	20	IDGD	
CC(C)c1ccnc(N2CCN(C(=O)NNC(=O)c3cnn(-c4ccccc4)c3)CC2)n1	767330039	ZRGDTUADTJKFAM-UHFFFAOYSA-N	434.504	1.962	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cc(C)nn3-c3ncccn3)n[nH]2)cc1	768239774	OFSZULNXRTWRKW-UHFFFAOYSA-N	445.443	1.069	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)[C@H]3CCCN(C(=O)N4CCCC4)C3)nc21	770969091	ROOORERAYJDSMM-ZDUSSCGKSA-N	430.513	1.658	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NN=Cc3ccc(C#N)cc3F)CC2)cc1	772844587	NCTKMLLCKCQLTN-UHFFFAOYSA-N	443.504	1.462	50	20	IDGD	
Cc1nc(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)ccc1Br	773525874	UVLUYSWQFWKPBR-UHFFFAOYSA-N	432.234	1.189	50	20	IDGD	
CN1CCC/C1=N\S(=O)(=O)c1cccc(NC(=O)C(=O)NNc2ccc(C#N)cc2)c1	773697425	QUHFSTXXVLTSQE-XIEYBQDHSA-N	440.485	1.453	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2ccc(CC(=O)Nc3ccccc3F)cc2)n1	773726768	QZBFUDBPTROKRC-UHFFFAOYSA-N	438.419	1.887	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccccc1OCCC(N)=O	774006118	ADHRHQHNBVNNJE-LBPRGKRZSA-N	448.863	1.148	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)N2CCC(C(=O)NCCCSC#N)CC2)o1	774293091	PPFUHJYNJDMHSB-UHFFFAOYSA-N	429.520	1.578	50	20	IDGD	
N#Cc1ccc(Cl)c(S(=O)(=O)NNC(=O)c2csc(N3CCOCC3)n2)c1	775252342	VVBXJUJZRYGPES-UHFFFAOYSA-N	427.895	1.128	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2cccc(C(F)(F)F)n2)cc1	775733047	OXDPZNWDRVTWNS-UHFFFAOYSA-N	445.423	1.882	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCN(C(=O)OC(C)(C)C)[C@@H](C)[C@@H]2C)n1	776607333	STQNDQZIQRFQJV-KBPBESRZSA-N	425.555	1.471	50	20	IDGD	
CC1CCC2(CC1)OC[C@H](CNC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)O2	776949426	MRZLBMXIGHIJGL-BTUGKURYSA-N	440.522	1.748	50	20	IDGD	
CC(C)Cc1cc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cc(O)n1	777419953	OXNLRHMHARQBRT-UHFFFAOYSA-N	439.516	1.205	50	20	IDGD	
O=C(c1cccnc1OCC(F)(F)F)N1CCN(S(=O)(=O)CBr)CC1	777776975	AYXQBHDYRUCQMD-UHFFFAOYSA-N	446.245	1.463	50	20	IDGD	
C[C@@H](Oc1ccccc1Cl)C(=O)N1CCN(S(=O)(=O)CBr)CC1	777777128	FXUFTLZWQZHHTD-LLVKDONJSA-N	425.732	1.934	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNS(=O)(=O)c1ccc(Br)c(Cl)c1	777940284	YRCRZCSJAVESHX-UHFFFAOYSA-N	442.719	1.937	50	20	IDGD	
CCOC(=O)c1cc(F)cc(S(=O)(=O)NNC(=O)c2ccc(OC)c(OC)c2)c1	778557511	XOZPCTNKGVGKJY-UHFFFAOYSA-N	426.422	1.643	50	20	IDGD	
CN(C)C(=O)Cn1cnc(NC(=O)NNc2ccc([N+](=O)[O-])cc2Br)n1	779436045	YNNIINBNHRRIRV-UHFFFAOYSA-N	427.219	1.186	50	20	IDGD	
Cc1cc(N2C[C@@H](C(=O)OCC(=O)NNC(=O)c3cccc(C#N)c3)CC2=O)ccc1F	780184986	PXPYDRRMUXYWKE-INIZCTEOSA-N	438.415	1.363	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)[C@H]1C[C@@]12CCN(C(=O)OC(C)(C)C)C2	780715528	JUSXCCHOQJUHSM-ZUOKHONESA-N	441.529	1.489	50	20	IDGD	
CC(=O)N1CCCc2cc(NC(=O)C(=O)NNC(=O)Cc3nc4ccccc4n3C)ccc21	782893451	IRGJJJZQKLKUQD-UHFFFAOYSA-N	448.483	1.201	50	20	IDGD	
Cc1cc(C)cc(NNC(=O)C(=O)Nc2cc(C3CC3)nn2[C@@H]2CCS(=O)(=O)C2)c1	783362046	JSXXSRNTPONWAC-MRXNPFEDSA-N	431.518	1.819	50	20	IDGD	
C[C@@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(NC(=O)C(=O)NN=c3cc[nH]cc3)cc2)C1	783379168	XICRXKORJWXZKR-HUUCEWRRSA-N	431.518	1.252	50	20	IDGD	
Cc1cnn([C@@H]2CCCc3ccccc32)c1NC(=O)C(=O)NN[C@@]1(C)CCS(=O)(=O)C1	783424399	DJRRALIXJPBTDU-UTKZUKDTSA-N	445.545	1.254	50	20	IDGD	
CN(C)c1nccc(NNC(=O)C(=O)Nc2cccc(-c3nnc4n3CCCCC4)c2)n1	784971167	UOXDIXHGFYXZKF-UHFFFAOYSA-N	435.492	1.609	50	20	IDGD	
CNC(=O)[C@H]1CN(C(=O)C(=O)NNc2nc(C(F)(F)F)cs2)c2ccccc2O1	785145321	NWCAQLFWPWAZOW-SNVBAGLBSA-N	429.380	1.145	50	20	IDGD	
COC1(C(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)CCOCC1	785687391	SBQXOZXRTABZJY-UHFFFAOYSA-N	436.468	1.401	50	20	IDGD	
Cc1ccc(C(=O)NCC2CC2)cc1NC(=O)C(=O)NNC(=O)Cc1c[nH]c2ccccc12	785990550	IIMXOUIQZRPIJJ-UHFFFAOYSA-N	447.495	1.945	50	20	IDGD	
CCCc1c(NC(=O)C(=O)NNC(=O)c2cccc(C#N)c2)cnn1-c1cccc(C#N)c1	785991109	PGTWEUIWQYSDMS-UHFFFAOYSA-N	441.451	1.968	50	20	IDGD	
CCOC(=O)c1cnn(C)c1NC(=O)C(=O)NNC(=O)CC12CC3CC(CC(C3)C1)C2	786415172	ZTOOIJLWWNGOEO-UHFFFAOYSA-N	431.493	1.289	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)N[C@H]1CSc2ccc(Br)cc21	787399971	NXMIXDYWOIQUTA-NSHDSACASA-N	439.291	1.949	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)Nc1cccc(Cn2nc3ccccn3c2=O)c1	787993648	BDPFFMOPMYMZBZ-UHFFFAOYSA-N	442.476	1.486	50	20	IDGD	
O=C(NNC(=O)[C@H](F)C(F)(F)F)c1cccc(S(=O)(=O)NCc2ccccc2)c1	788264271	BVOSDYNATDIYKX-AWEZNQCLSA-N	433.383	1.827	50	20	IDGD	
CCOC(=O)C1(CC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)CCC1	789132686	FVPPXHMOPTYDCK-UHFFFAOYSA-N	437.518	1.356	50	20	IDGD	
Cc1nc(Cl)ccc1NC(=O)C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	789730617	UQRWYYWKYASEFL-UHFFFAOYSA-N	444.923	1.342	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)C(=O)Nc1nc2c(s1)CCCCC2	789735672	SWMUIKCITQMAPF-UHFFFAOYSA-N	443.533	1.205	50	20	IDGD	
COc1c(C)cnc(Cn2cnc(NC(=O)C(=O)NNc3c(F)cccc3F)n2)c1C	789746433	YYJJOYHROJUUNA-UHFFFAOYSA-N	431.403	1.707	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)N1CCC(COc2ccc(Cl)nc2)CC1	789840238	WPGIAYKFXMHZCH-UHFFFAOYSA-N	435.868	1.590	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cc([C@@H]3CCCOC3)nn2C)c1C	790951866	MIXOURWUEBELLH-JKSUJKDBSA-N	443.504	1.484	50	20	IDGD	
C[C@@](O)(Cn1cc(C(F)(F)F)ccc1=O)C(=O)NNC(=O)c1ccc(Cl)cc1O	792633493	XCKCPFZQDBATKQ-MRXNPFEDSA-N	433.770	1.438	50	20	IDGD	
COc1ccc(Br)cc1C(=O)CCC(=O)N([C@H]1CCS(=O)(=O)C1)N(C)C	792851471	WWQFJNXYGHLGRZ-ZDUSSCGKSA-N	447.351	1.913	50	20	IDGD	
COC(=O)c1nn(C)c(C)c1/C=C(\C#N)C(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1	792865020	ASFPTBUMIAEWFD-NTCAYCPXSA-N	438.444	1.679	50	20	IDGD	
CC(=O)N1CCC[C@H](CNC(=O)NNC(=O)COc2ccc(Br)cc2)C1	793202650	NRWLHUXTQVCQRD-CYBMUJFWSA-N	427.299	1.417	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)c1cnn(CCO)c1-c1ccccc1	793520128	XOUXXUSOJVXXNG-UHFFFAOYSA-N	432.481	1.011	50	20	IDGD	
Cc1ccc(S(=O)(=O)NNC(=O)c2nn(CCC(C)C)c(=O)c3ccccc23)cn1	795285778	YRMFIKWOOLKPMA-UHFFFAOYSA-N	429.502	1.769	50	20	IDGD	
CCNC(=O)N(C)c1cccc(NC(=O)NNC(=O)CNC(=O)OCc2ccccc2)c1	797664869	WRDHQFBHURWASP-UHFFFAOYSA-N	442.476	1.931	50	20	IDGD	
CCn1c(S)nc2cc(C(=O)NNC(=O)C(=O)Nc3ccc(C)c(C)c3)ccc2c1=O	798308053	NXCJUVNZBWWVBY-UHFFFAOYSA-N	439.497	1.722	50	20	IDGD	
O=C(CCCC1CCOCC1)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	798346290	BVVCFCCGTPCUKL-UHFFFAOYSA-N	439.534	1.065	50	20	IDGD	
COc1nn(C)c2nc(C)c(CCC(=O)NNC(=O)C(=O)Nc3ccc(C)cc3)c(C)c12	801106427	USKAMDJBHVNRFH-UHFFFAOYSA-N	438.488	1.621	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)Nc2cccc(NC(=O)C(N)=O)c2)N(C)c2ccccc21	801512644	XJXWGKZWMKEMSL-UHFFFAOYSA-N	446.467	1.720	50	20	IDGD	
Cc1ccc(CN2C(=O)CC[C@H]2C(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)cc1	802068005	VXZAQQYQQZLUTK-SFHVURJKSA-N	444.513	1.742	50	20	IDGD	
COc1ccnc(NNC(=O)NCCOc2ccc(I)cc2)n1	802324910	CBIXRDAEVCOOPJ-UHFFFAOYSA-N	429.218	1.795	50	20	IDGD	
COc1cccc(C2(C(=O)NNC(=O)CN3CCN(C(=O)c4ccccc4)CC3)CC2)c1	802762469	HZWYHSKDEHQXHN-UHFFFAOYSA-N	436.512	1.332	50	20	IDGD	
CN(C)CCn1ncc(C(=O)NNC(=O)Cn2cnc3ccccc32)c1-c1ccccc1	806343267	AZBOYUSGRQMNNV-UHFFFAOYSA-N	431.500	1.923	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2C)c(OC)c(OC)c1	807455775	UDPOGSSMYUZCNH-UHFFFAOYSA-N	432.389	1.789	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2cnn(-c3ccc(Cl)cc3)c2C)n1	808934936	YEWKKKAZLOSLTR-UHFFFAOYSA-N	429.868	1.434	50	20	IDGD	
COC(=O)c1ccccc1NNC(=O)CNS(=O)(=O)c1ccccc1C(F)(F)F	810891143	FPDIGKCFXPMMRP-UHFFFAOYSA-N	431.392	1.914	50	20	IDGD	
CN(NS(=O)(=O)c1ccc(C#N)c(F)c1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	813696210	XASNLPWVNWPBCK-UHFFFAOYSA-N	441.485	1.495	50	20	IDGD	
Cc1c(S(=O)(=O)NC(=O)/C(C#N)=C/c2cc(C)n(C[C@H]3CCCO3)c2C)cnn1C	813956539	OZMMJSZPWPLURH-JIARHERNSA-N	431.518	1.738	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)CNC(=O)c1ccco1)c1ccc(N2CCCOC2=O)cc1	814294871	OSQAEKYHSSIYMH-CYBMUJFWSA-N	429.433	1.448	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCOCC2)cc1NC(=O)NNc1cccc(Cl)n1	814489057	IWLBDTATSWVFMU-UHFFFAOYSA-N	441.897	1.913	50	20	IDGD	
O=C(NN=Cc1cc2cccnc2n1S(=O)(=O)c1ccccc1)[C@H]1CCS(=O)(=O)C1	814781317	FFLWLEVEWBCTFJ-HNNXBMFYSA-N	446.510	1.158	50	20	IDGD	
CC(=NNC(=O)Nc1ccc(S(N)(=O)=O)cc1)c1cccc(NS(C)(=O)=O)c1	814970382	ZZSNTDIQGNZRAR-UHFFFAOYSA-N	425.492	1.251	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCc2nncn2C1)C(=O)Nc1cccc(C#Cc2ccccc2)c1	815691650	WYSAVHVLTGRELQ-GOSISDBHSA-N	428.452	1.026	50	20	IDGD	
CCN1CCc2ccc(NC(=O)C(=O)NNc3ccccc3S(=O)(=O)N(C)C)cc21	815751051	QEQSGLRNSUDLES-UHFFFAOYSA-N	431.518	1.401	50	20	IDGD	
Cc1cc(Cn2nnc(C(=O)NNc3ccccc3S(=O)(=O)NC(C)(C)C)c2C)on1	815854544	GZWSUIBSAOHUCX-UHFFFAOYSA-N	447.521	1.765	50	20	IDGD	
Cn1ncc(I)c1C(=O)NNC(=O)NCc1ccc(Cl)cc1	816396076	DVOYPKFAIHGQTH-UHFFFAOYSA-N	433.637	1.822	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N2CC3(CCOC3)C2)cc1	819384757	LLFMKWGSKOMAHS-LICLKQGHSA-N	435.484	1.590	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNC(=O)CN2C(=O)[C@@H]3[C@@H](C2=O)[C@H]2C=C[C@H]3C2)cc1	909364716	AWOVSVGMMSDETF-FVCZOJIISA-N	425.485	1.680	50	20	IDGD	
CCOc1ccc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)C3(O)CCCC3)cc2)cc1	914684502	VCYDGGUBWMDEGF-UHFFFAOYSA-N	447.513	1.952	50	20	IDGD	
Cc1cc(O)cc2c1C(=O)C(=NNC(=O)c1cccc(S(=O)(=O)N3CCCC3)c1)O2	915934980	IPHNDSLLWNMEEZ-UHFFFAOYSA-N	429.454	1.804	50	20	IDGD	
C[C@@H](CN1CCOCC1)C(=O)NN=Cc1cc(Br)ccc1OCC(=O)O	915953428	WGVFXTGJOPGQIM-LBPRGKRZSA-N	428.283	1.331	50	20	IDGD	
CCN1CCN(Cc2ccc(CNC(=O)NNC(=O)COc3ccc(F)cc3)cc2)CC1	916418656	PMNCCNHADMEKQE-UHFFFAOYSA-N	443.523	1.873	50	20	IDGD	
CCOCc1ccccc1CNC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1	916426211	GWDDNSURLJKRCI-UHFFFAOYSA-N	448.545	1.683	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)Cn2cc(C(N)=O)c3ccccc32)c2ccccc2c1=O	917387606	DZWQQDCSJJVZNU-UHFFFAOYSA-N	446.467	1.492	50	20	IDGD	
N#Cc1cc(S(=O)(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)ccc1Cl	917725364	NEEMQSLOYYBRJL-UHFFFAOYSA-N	449.297	1.136	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCc2ccc(CN3CCCC3=O)cc2)cc1OC	918124973	KXXMTPBSWANMOD-UHFFFAOYSA-N	426.473	1.970	50	20	IDGD	
CC(=O)N[C@H](C)c1ccc(S(=O)(=O)NNC(=O)c2ccc3c(c2)OCCO3)s1	918399097	KFENSXCOVFCDRJ-SNVBAGLBSA-N	425.488	1.340	50	20	IDGD	
CCCCS(=O)(=O)N1CCC[C@@H]1C(=O)NNC(=O)[C@H](C)Oc1cccc(C)c1C	918690694	ONLPLWTVRDCGHK-DLBZAZTESA-N	425.551	1.812	50	20	IDGD	
CC(=O)Nc1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)ccc1F	919677794	FCORHNBIFFUFEC-UHFFFAOYSA-N	448.476	1.643	50	20	IDGD	
CC[C@H](C)c1ccccc1N1C[C@@H](C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)CC1=O	919883930	FGFCORDLTZEBRN-KKUMJFAQSA-N	436.534	1.071	50	20	IDGD	
CN(C)C(=O)C[C@H](NC(=O)NNC(=O)c1nn(-c2ccccc2)cc1O)c1ccccc1	920048595	ZEUCAQTYZQPLTL-KRWDZBQOSA-N	436.472	1.742	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NCc2ccc(S(=O)(=O)N(C)C(C)C)cc2)cc1	920234991	AEFKRGYQWUZYCQ-UHFFFAOYSA-N	448.545	1.933	50	20	IDGD	
Cc1cccc(NC(=S)NNC(=O)CCNS(=O)(=O)c2ccc([N+](=O)[O-])cc2)c1	920430947	MCFNJOMWLZMOLH-UHFFFAOYSA-N	437.503	1.589	50	20	IDGD	
C[C@H]1CC(C)(C)C[C@]2(C1)NC(=O)N(CC(=O)NNC(=O)NCCc1cccs1)C2=O	920861365	YALSHDTULJZSQN-RBZFPXEDSA-N	435.550	1.758	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)Nc2cccc(N3C(=O)CNC3=O)c2)cc1	920933612	ZNFLQTYQQHAJET-CYBMUJFWSA-N	441.444	1.762	50	20	IDGD	
O=C(CCN1CCN(C(=O)[C@@H]2CCCO2)CC1)NNc1cncc(Br)c1	1116394935	AEAHLGAKMVCVOA-HNNXBMFYSA-N	426.315	1.001	50	20	IDGD	
O=C(CNC(=O)c1cc(Cl)ccn1)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1	1253442393	LTMQWYDNOLZETA-UHFFFAOYSA-N	436.799	1.902	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)c(C)c1	1318667433	DZTOFYQUOWURSP-UHFFFAOYSA-N	427.523	1.960	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccc(F)cc2C1)c1ccc(S(=O)(=O)N2CCCC2)cc1	1319668350	LRRKYFIDMZHQNJ-MRXNPFEDSA-N	447.488	1.623	50	20	IDGD	
COC(=O)c1ccc(C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)o1	1319880392	SZKIZCXAYGWGCS-UHFFFAOYSA-N	434.880	1.298	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2cc(Cl)cc(C(=O)N(C)C)c2OC)cc1	1321870303	YBPWCCHYECQCRS-UHFFFAOYSA-N	441.893	1.682	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cn(C)c4ncccc34)C2)C1	1778770942	ZFQOMCKQRLHWEC-YJYMSZOUSA-N	435.322	1.800	50	20	IDGD	
CCc1nn(C)c(C(=O)N2CCO[C@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)c1Cl	1779295767	BIRSTTKVYQIJTH-IBGZPJMESA-N	443.020	1.931	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)Cc3ccc([N+](=O)[O-])c(OC)c3)CCO2)C1	1781218462	PDQBWFJXQYHYKY-YWZLYKJASA-N	439.896	1.993	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cnc4cc(C)ccn4c3=O)CCO2)C1	1781218836	KGDKKSXENPBXFI-IIBYNOLFSA-N	432.908	1.464	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc4c(n3)OCCO4)CCO2)C1	1781226888	CFQDLLUUSINGEA-OALUTQOASA-N	444.315	1.533	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc4ncnn4c3)CCO2)C1	1781229315	BTMXVUYARLNQBB-ROUUACIJSA-N	426.304	1.409	50	20	IDGD	
CC(=O)N/C(=C\c1ccco1)C(=O)N1CC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1781866170	ARZOBCLWLDKZOX-WAFIBAPDSA-N	430.288	1.390	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1ccn(C)n1)C2	1781900769	SEGZXGIDRFGPLE-GPMSIDNRSA-N	441.370	1.650	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc4cccnc4nc3O)C2)C1	1782267046	CFPPUSLITZWUKY-QRWLVFNGSA-N	434.880	1.033	50	20	IDGD	
Cc1ccc(CCC(=O)N2CC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)cc1	1783298366	AAFJLYAMMCFZLM-QHCPKHFHSA-N	430.549	1.131	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3nc(C)c(C)[nH]c3=O)CCO2)C1	1783344935	UPRPRVLENXKWSZ-FZKQIMNGSA-N	441.326	1.004	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H]3CC=CC[C@H]3C(=O)OC)C2)C1	1783847540	BVPLIMIZMYNEHO-VWXURSGXSA-N	426.941	1.979	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)C#Cc3ccc(Cl)cc3)CCO2)C1	1783871793	VVONZZVAKNVSMW-FXAWDEMLSA-N	425.312	1.775	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3c(F)cc(OC)cc3F)CCO2)C1	1783881530	RWVTWJRPKNLCDN-ORAYPTAESA-N	432.851	1.671	50	20	IDGD	
CCOC(CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]2C1)OCC	1783974855	VWUNZPLGMXAYHX-UGUYLWEFSA-N	449.386	1.786	50	20	IDGD	
Cc1cccc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Br)C[C@@H]32)n1	1784222611	VSEYWTSYYSPSJX-NZUILWFCSA-N	428.302	1.603	50	20	IDGD	
CCCNC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)CBr)C[C@@H]21	1784374269	VLMZWDIPSJULOC-VGWMRTNUSA-N	446.386	1.304	50	20	IDGD	
O=C([C@@H](F)Cl)N1CC[C@H]2CO[C@@H](CNC(=O)C3(C(=O)Nc4ccccc4)CC3)[C@H]2C1	1784560440	FTNXWBRNZSEAKF-QSPRXWTASA-N	437.899	1.919	50	20	IDGD	
CCc1[nH]nc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)Br)C[C@@H]32)c1F	1785793943	AVRDUBGWLVPOHA-BLFANLJRSA-N	431.306	1.488	50	20	IDGD	
C[C@H](Nc1nccs1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21	1787485534	JAEGSQUKDFXNRQ-XUXIUFHCSA-N	445.383	1.708	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)c1cccn2ccnc12	1788366445	SWAAMRKZUKPVNH-CYUUQNCZSA-N	439.285	1.618	50	20	IDGD	
CC(C)C1(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)CCC1	1788611198	NVJNEVIDFYCEDK-SNRMKQJTSA-N	443.548	1.105	50	20	IDGD	
Cc1nn(C)c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]3C2)c1F	1788760902	GBEJGUYGUUJCSL-KKUMJFAQSA-N	426.565	1.312	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21)c1ccc(-c2ccc(O)nn2)cc1	1790300216	LPVXDQXRHXXDNO-MRHSLFKSSA-N	448.882	1.977	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4ccnn4c3)[C@H]2C1	1790444409	UIPWNJGJFTXHBX-CSFVBSKPSA-N	435.322	1.711	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnn(C)c3C)C[C@@H]21	1790960764	DFRUQZXCGDKYKM-HNKHHVNMSA-N	427.343	1.495	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)c3ccccc3)C[C@@H]21	1791057508	FAAYQLXIRQYPCA-YYESSZKYSA-N	425.323	1.483	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3ccc(OC)nc3)C[C@@H]21	1791252058	AKAPAAQCJMSFGQ-XSLAGTTESA-N	439.940	1.256	50	20	IDGD	
CC[C@H]1CC[C@H](C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]3C2)CC1	1791293337	WTPGYRTWIQFDQR-HVTWWXFQSA-N	436.597	1.556	50	20	IDGD	
Cc1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)cc1Cl	1792731837	VCYCGTMRIAWOLK-REPLKXPHSA-N	426.709	1.894	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(C)(C)CCl	1792782543	WIYBHPXSNGTLCQ-FZKCQIBNSA-N	443.972	1.850	50	20	IDGD	
Cc1nc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](C)CBr)c(=O)[nH]c1C	1792988977	MWQCHWPUVUFBRS-WBMYTEFPSA-N	425.327	1.670	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(C=O)s1	1796195047	WMBJLRBVGPOIEQ-NGYDUSEUSA-N	441.513	1.946	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2)c1cnc2ccccc2n1	1796777698	LAIHZONYYZORMM-IVWMJMPLSA-N	433.306	1.618	50	20	IDGD	
Cn1ncc2cc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)CCBr)C4)ccc21	1797084325	OFUZMBUAELVWPU-JLVBRIDZSA-N	435.322	1.562	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1ON=C(c2ccccc2)O1	1797639503	CRRVVKQAMAOEDD-AHZRMZFZSA-N	435.908	1.718	50	20	IDGD	
COC(=O)[C@@H]1CC[C@@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CO[Si](C)(C)C)C1	1797953674	CCVGMNNKYBIUNY-MAPUTHEBSA-N	426.586	1.017	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(-n2ccnc2)ccn1	1798725720	VEPXQPGHTSPFDX-HIRMHNASSA-N	431.924	1.878	50	20	IDGD	
C[C@@H](Nc1nccs1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@](C)(Cl)CCl	1799275362	QKRYYPUPUCTRIV-GUFWIUQMSA-N	435.377	1.769	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(F)c1Cl	1799576514	CYMSYDRUZQKEBP-DBWKPXFBSA-N	440.903	1.055	50	20	IDGD	
C[C@H](NC(=O)c1ccc(F)cc1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](O)CCl)C2	1799811768	QLVTXTDCPZYWAM-DBRALVMTSA-N	425.888	1.182	50	20	IDGD	
CC(=O)OC[C@H](OC(C)=O)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@](C)(Cl)CCl	1800080994	YXFIFKAAPZRJJA-SFUJAXRZSA-N	437.320	1.356	50	20	IDGD	
C[C@H](NC=O)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](Br)Cc1ccccc1)C2	1800098896	VCNXLFZWCSDDSR-XEIOYGOASA-N	436.350	1.765	50	20	IDGD	
C=CC[C@H](C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1800491032	JUJNBCBKRGIRTG-KSWRQPAISA-N	443.972	1.920	50	20	IDGD	
Cc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)Br)cc2c[nH]nc12	1800762576	VKDUPQNOZYAXLB-RMIITELYSA-N	435.322	1.858	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1=COCC1	1801546910	QMOYQOQNHRLRSX-CCWDJLKJSA-N	445.428	1.028	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(OC)c(C)c(OC)c1	1801836697	ZMAGSLVQLMTTLL-RCJHGTSTSA-N	440.924	1.469	50	20	IDGD	
COC[C@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H]1[C@@H](O)CCN1Cc1ccccc1)C2	1802283934	JHDSJXKKSURLOL-STHVQZNPSA-N	449.979	1.514	50	20	IDGD	
CCOc1ncccc1C(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1	1802314113	PZUMVGNVOIYIRO-CGTJXYLNSA-N	432.908	1.795	50	20	IDGD	
CNC(=S)NCCC(=O)N1CC[C@@H](CNC(=O)C(C)(C)CCl)[C@@H]1c1cccnc1	1802900711	DVQYLRSAOSTXQT-RDJZCZTQSA-N	440.013	1.836	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CNc2ccc(F)cc2)[C@H]1c1cccnc1)[C@H](O)CCl	1803138617	LOXVHTWMBGFXOC-CVAIRZPRSA-N	434.899	1.938	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)Cn2cc([N+](=O)[O-])cn2)[C@@H]1c1cccnc1	1804421687	NVXPPJJAKYKJBE-HFTRVMKXSA-N	434.884	1.910	50	20	IDGD	
CC(C)(C)n1cc(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)cn1	1804925213	BKGHTEKMWBMSIP-RYQLBKOJSA-N	433.940	1.952	50	20	IDGD	
O=C(CCc1cccs1)N1CCCC2(CCN(C(=O)c3ccc(B(O)O)cc3)CC2)C1	1807229405	PBXXXPCFTZSSHI-UHFFFAOYSA-N	440.374	1.906	50	20	IDGD	
Cc1ccoc1C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1807364310	UBXJDGDQXLVSRR-QUCCMNQESA-N	433.273	1.296	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)Cn2cc(Cl)cn2)[C@@H]1c1cccnc1	1807414081	PWGDXXLTDCWLAA-HFTRVMKXSA-N	440.331	1.891	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@H](CNC(=O)Cn2ccnn2)[C@H]1c1cccnc1	1807681892	NIBYWSOGNVYXQM-LESCRADOSA-N	425.320	1.615	50	20	IDGD	
CC(F)(F)C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1	1810303989	YTBCWOICDHGPEE-XJKSGUPXSA-N	432.431	1.055	50	20	IDGD	
C=CCC(F)(F)C(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1813074015	NSOIOBCIUALFPE-LPHOPBHVSA-N	437.491	1.672	50	20	IDGD	
COc1cc(C(=O)N2CC[C@H](CNC(=O)C(Cl)Cl)[C@@H]2c2cccnc2)nn1C	1813079821	NNONNFMOIRRPSF-DOMZBBRYSA-N	426.304	1.947	50	20	IDGD	
Cn1ccc2c(O)ncc(C(=O)N3CCCC[C@@H]3c3cc(NC(=O)[C@H](O)CCl)n[nH]3)c21	1814873910	SQCANWBXPNSZBZ-HUUCEWRRSA-N	446.895	1.908	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3cc(=O)n4[nH]cnc4n3)sc2C1	1815323164	AUGXMKQSJPDZLO-VHSXEESVSA-N	449.924	1.507	50	20	IDGD	
CC(C)[C@H](S)C(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1	1815337732	WJWXIYPUVKKJST-BBRMVZONSA-N	433.364	1.003	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)Cc3cscn3)sc2C1	1815522598	CRCYCDLNVIHEQX-LLVKDONJSA-N	436.563	1.127	50	20	IDGD	
CN(CC(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1)C(=O)OC(C)(C)C	1817026990	KBUSMSLSWYNCTA-ZIAGYGMSSA-N	443.932	1.868	50	20	IDGD	
CN[C@H](CC(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](C)CBr)[nH]n1)C(=O)O	1817361368	HBNBJSJRIYBRAQ-CYZMBNFOSA-N	444.330	1.496	50	20	IDGD	
Cc1n[nH]c(C)c1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1	1817472317	QDZQDLZNUZYMOI-KRWDZBQOSA-N	436.281	1.049	50	20	IDGD	
N#Cc1cccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)c1	1817476570	KAAAPZGFAXGORJ-HXUWFJFHSA-N	443.272	1.581	50	20	IDGD	
CCC1(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2ccc(B(O)O)cc2)CC3)CCC1	1818861495	ZJJVKGNPGONMNQ-OAHLLOKOSA-N	427.335	1.629	50	20	IDGD	
Cc1ncccc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819401844	CECCCHYDSAYNMZ-GOSISDBHSA-N	448.487	1.731	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1)c1nc2ccc(F)cn2n1	1821595185	AJADXGSEGIBLPW-QWHCGFSZSA-N	435.847	1.497	50	20	IDGD	
CC(=O)C(C)(C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1	1824373936	WPBXAQUBELFNQE-FQEVSTJZSA-N	428.338	1.215	50	20	IDGD	
CC[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ncnn1C)CC2	1825444789	BVPTWBNHLKWRJK-DTWKUNHWSA-N	427.328	1.671	50	20	IDGD	
CC[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnc(O)[nH]1)CC2	1825450753	VUANVYBLDGBMQO-HTQZYQBOSA-N	428.312	1.971	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CC(F)(F)C(=O)O)CC2	1825642492	WITIJAKAASQYFF-BQBZGAKWSA-N	440.266	1.949	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccccn2)CC1	1825809229	JIXDPWKMTJLKGC-FQEVSTJZSA-N	436.516	1.627	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnc(OCF)cn1)CC2	1825994162	QXHFGFWZHJTHCS-ZJUUUORDSA-N	443.888	1.719	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cocn2)CC1	1826162041	DUOGCMSMPHZKNQ-GOSISDBHSA-N	426.477	1.220	50	20	IDGD	
O=C([C@H]1[C@H]2SC=C[C@H]21)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827060288	FSZSHMBBAYSHSP-BURNTYAHSA-N	440.374	1.475	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)COCc3ccccc3)C2)C1	1830359727	TYOQFUSBCKRTCG-QFIPXVFZSA-N	438.952	1.925	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(Cl)nn3)C2)C1	1830364271	DZJWDICOYAOWIW-SFHVURJKSA-N	431.320	1.465	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)cn1C	1830538270	AFJBBPKWPXNJJF-LIRRHRJNSA-N	442.354	1.435	50	20	IDGD	
CSCC(C)(C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1831538316	PFCQMBHYGRLXOB-LRDDRELGSA-N	441.363	1.523	50	20	IDGD	
O=C(CSc1ccncc1)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1832712615	HRLVNXLRVNITKS-KRWDZBQOSA-N	434.345	1.434	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3noc(C(C)C)n3)CCO2)C1	1832783556	LUICNJITNBNBRH-QRWLVFNGSA-N	442.944	1.599	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3cccnc3OC)CCO2)C1	1833003749	SCMANDWBVOSCDS-DYESRHJHSA-N	439.940	1.497	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnnc(Cl)c3)CCO2)C1	1833204897	STIXVGBEGBEGBH-SFHVURJKSA-N	431.320	1.465	50	20	IDGD	
Cn1cc(C(=O)N2CCC(N3CCC(NC(=O)[C@@H](O)CCl)CC3)CC2)c(C(F)F)n1	1833309895	DJTSREHOJUGYSU-HNNXBMFYSA-N	447.914	1.143	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnn(-c4cccnc4)c3)CCO2)C1	1833621449	IUTZXDGYRTUUMY-GHTZIAJQSA-N	447.923	1.355	50	20	IDGD	
Cc1nc(C(=O)NC2CCN(C3CCN(C(=O)[C@H](F)Br)CC3)CC2)co1	1834204528	FQVSBMDNNWVYJL-HNNXBMFYSA-N	431.306	1.859	50	20	IDGD	
Cc1ncsc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1	1834267866	KKVKRXJZZNUYOB-IAGOWNOFSA-N	436.361	1.758	50	20	IDGD	
Cc1cncc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCBr)C3)C2)c1	1834280521	VLCAEQAWXGROND-GOSISDBHSA-N	426.311	1.245	50	20	IDGD	
Cn1ccc(C(=O)N2CCC(N3CCC(NC(=O)CCBr)CC3)CC2)c1	1834421243	WDYRHQQFVYKIOG-UHFFFAOYSA-N	425.371	1.995	50	20	IDGD	
O=C(CCBr)NC1CCN(C2CCN(C(=O)c3csnn3)CC2)CC1	1834422584	VTZYOSZYVAVXJD-UHFFFAOYSA-N	430.372	1.508	50	20	IDGD	
O=C(CCc1ccccc1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1834840626	RSCGRNIKBXLQQZ-IEBWSBKVSA-N	443.313	1.766	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cn4cccnc4n3)CC2)CC1	1835547389	DZKBZVFUYSQSBI-KRWDZBQOSA-N	448.955	1.168	50	20	IDGD	
Cc1nc(CC(=O)N2CCC(N3CCC(NC(=O)CO[Si](C)(C)C)CC3)CC2)no1	1835834900	GVVQBDCDTNUZGF-UHFFFAOYSA-N	437.617	1.344	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](F)Cl)CC2)CC1)c1cnc2snnc2c1	1836100769	HGHWAIYYTLDGGL-OAHLLOKOSA-N	440.932	1.806	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)N1CCC(N2CCC(NC(=O)[C@H](F)Br)CC2)CC1	1836412307	DCWKEDQEAJHQDI-WBMJQRKESA-N	449.365	1.115	50	20	IDGD	
O=C(c1ccnc(Cl)c1)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836714884	AGHGGCUTUCEINU-MRXNPFEDSA-N	430.332	1.947	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)c3ccccc3O)CC2)CC1	1837348957	GEANAXNDNIMNSX-UHFFFAOYSA-N	446.548	1.377	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3nc4ccccn4n3)CC2)CC1	1838020985	CQORHRHWXZFFSU-KRWDZBQOSA-N	449.939	1.595	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(F)cc3)CCO2)C1	1838953695	KVGNVLWCHBDFKH-IFXJQAMLSA-N	443.313	1.927	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccc(OC)c(O)c3)C2)C1	1839141585	MZQWPOVREAGBPC-IERDGZPVSA-N	440.924	1.417	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc(OC)c(C)c3)C2)C1	1839143139	MLJNKZITCKYJGT-OXJNMPFZSA-N	425.913	1.486	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(OC)cc3O)C2)C1	1839145686	CKQSCMUORPRJMB-JXFKEZNVSA-N	426.897	1.488	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccccc3)C2)C1	1839150912	CCGDOOOQKNTSHR-PMACEKPBSA-N	429.344	1.922	50	20	IDGD	
CC(C)c1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)on1	1839202070	UGXNGJJYDGZDJS-PBHICJAKSA-N	448.289	1.559	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1839961718	GHQCQBMIOVHGFB-SUMWQHHRSA-N	439.778	1.881	50	20	IDGD	
C[C@@H](C(=O)N1CCOC[C@]2(CN(C(=O)C(Cl)Cl)CCO2)C1)n1cccc1C=O	1840188017	JZWYQPVQDSITFB-SCLBCKFNSA-N	432.304	1.122	50	20	IDGD	
Cc1cccc2c(C(=O)N3CCOC[C@]4(C3)CN(C(=O)C(Cl)Cl)CCO4)n[nH]c12	1840189753	KLANCAFDWYFIFV-IBGZPJMESA-N	441.315	1.745	50	20	IDGD	
CN(CC(=O)N1CCCC12CN(C(=O)[C@@H](F)Br)C2)C(=O)c1ccccc1	1841522838	AEVUVBLMRNMPAC-OAHLLOKOSA-N	426.286	1.653	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@]2(F)CCN(C(=O)OC(C)(C)C)C2)C1	1843955024	NMJJUYAVBBDWGQ-JLTOFOAXSA-N	447.935	1.793	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2ccc3cncn3c2)C1	1844118147	NSGWCZCSUDSKJM-MFKUBSTISA-N	433.472	1.285	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC12CN(C(=O)c1cc(S(C)(=O)=O)ccc1F)C2	1846178651	KVWPVULZVNPLDM-LLVKDONJSA-N	447.326	1.830	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)C1CCN(Cc3ccccn3)CC1)C2	1846360731	CXFBJXUZXIPMFM-LJQANCHMSA-N	434.968	1.751	50	20	IDGD	
C#CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)[C@H](Cl)COC)C1	1846365806	WUIIZCLWZDYEOT-CABCVRRESA-N	427.929	1.360	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1848098795	ZNQKKYQYADLABQ-RFGFWPKPSA-N	438.352	1.574	50	20	IDGD	
O=C(NNC(=O)C1CCN(S(=O)(=O)c2cc(F)ccc2F)CC1)c1ccccc1O	17575291	WZBXIQFSCZTPSZ-UHFFFAOYSA-N	439.440	1.532	50	20	IDGD	
O=C(CN1C(=O)COc2ccc([N+](=O)[O-])cc21)NNC(=O)c1cc(-c2ccccc2)n[nH]1	21784577	WYOWAXSRKQUHQR-UHFFFAOYSA-N	436.384	1.172	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)[nH]c2c1C(=O)CC(C)(C)C2	24291349	KZUILMTZEIUVEQ-UHFFFAOYSA-N	431.518	1.846	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)c2cccc(S(=O)(=O)NC[C@@H]3CCCO3)c2)cc1	104747676	RGLVPSQHQSXXPJ-SFHVURJKSA-N	446.529	1.325	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)NCCC(=O)NNC(=O)CCCc2ccccc2)cc1	727869334	OJWRLBWMJVRFLI-UHFFFAOYSA-N	446.529	1.484	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)c1nn(-c2ccccc2F)c(C)cc1=O	727969839	PYMKVOICGFVLMJ-UHFFFAOYSA-N	440.431	1.919	50	20	IDGD	
N#Cc1ccc(N2CCC[C@H]2C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1	728159980	CTRUHUYCZNEEBJ-QHCPKHFHSA-N	446.555	1.887	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@@H]2CCCN2C(=O)CNC(C)=O)ccc1OCCC(C)C	728513079	QJXQGJNMIDKKGZ-KRWDZBQOSA-N	448.520	1.008	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCCNC(=O)NNC(=O)c2cccc(OC(F)F)c2)cc1	728595528	KGXFMNQLGRQAJO-UHFFFAOYSA-N	442.444	1.519	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c(Br)c1	728845045	CWGCXNUIFIRUDK-UHFFFAOYSA-N	434.294	1.925	50	20	IDGD	
CC(C)CC(=O)N[C@@H](C(=O)NNC(=O)C1CCN(c2ncccn2)CC1)c1ccccc1	728890360	NKJIBDFRCKBPST-HXUWFJFHSA-N	438.532	1.744	50	20	IDGD	
O=C(NNC(=O)N1CCO[C@@H](c2ccc(F)cc2)C1)C1CCN(c2ncccn2)CC1	728958910	GUZDXQIHRABNLR-GOSISDBHSA-N	428.468	1.646	50	20	IDGD	
Cc1ccc(S(=O)(=O)n2ccc(C(=O)NNC(=O)CNC(=O)c3cccs3)c2)cc1	732282762	UDOMGISSTBKITA-UHFFFAOYSA-N	446.510	1.286	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)N[C@H]1CCN(c2ccccc2C(N)=O)C1	732589530	CNOSRKPMDUTDSD-KBPBESRZSA-N	429.452	1.301	50	20	IDGD	
Cc1cc(NNC(=O)c2cc(S(=O)(=O)NC3CC3)ccc2Br)ncn1	734254159	LEQVSOIDTQMZCU-UHFFFAOYSA-N	426.296	1.745	50	20	IDGD	
Cc1ncc2c(n1)CCC[C@H]2NC(=O)NNC(=O)c1sc(N2CCOCC2)nc1C	734855947	TVPDGUQBNHHHEX-OAHLLOKOSA-N	431.522	1.408	50	20	IDGD	
O=C(CSc1nnnn1-c1ccc2c(c1)OCO2)NNC(=O)c1ccccc1Cl	734982299	RDYUTVJJMFLHOA-UHFFFAOYSA-N	432.849	1.598	50	20	IDGD	
C[C@H](CC(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1)c1ccccc1F	735118338	SJAOTDSHNSZMEY-OAHLLOKOSA-N	435.525	1.794	50	20	IDGD	
O=C(NN=C1C(=O)Nc2c(Br)cc(Cl)cc21)N[C@H]1CCS(=O)(=O)C1	735613592	CLHKKSWSYKWCQR-ZETCQYMHSA-N	435.687	1.245	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NC[C@H](O)C1CCOCC1	736650549	WLBXEANXTWNTNX-NHYWBVRUSA-N	430.299	1.334	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)c1ccccc1CS(=O)(=O)c1ccccc1	740851855	ZBLGHAUJCUJKSL-UHFFFAOYSA-N	431.514	1.726	50	20	IDGD	
Cc1nn(C)c2sc(C(=O)N[C@@H](C)C(=O)NNC(=O)[C@H](C)Oc3ccccc3F)cc12	742037260	VMYMEJBWKHMCFQ-RYUDHWBXSA-N	447.492	1.816	50	20	IDGD	
O=C(COC(=O)C1(C(=O)Nc2ccc(F)cc2)CC1)NNC(=O)c1ccc([N+](=O)[O-])cc1	743173894	YSHFCVMDENBFQM-UHFFFAOYSA-N	444.375	1.457	50	20	IDGD	
O=C(NNc1ncnc2[nH]cnc12)c1ccc(NS(=O)(=O)c2cccs2)cc1O	743471158	SRPPPLMJWWOKHX-UHFFFAOYSA-N	431.459	1.678	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)N[C@H]2CCN(c3ccccc3C(N)=O)C2)cc1	743606361	UKCZQYMYMGJWME-HNNXBMFYSA-N	425.493	1.466	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)[C@H](O)c2ccc(Br)cc2)c1	745043614	FFDCUAMHKGPWOJ-MRXNPFEDSA-N	432.230	1.359	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2ccc(C(C)(C)C)cc2)cc(S(N)(=O)=O)cc1[N+](=O)[O-]	746097269	YAASSMFRZYFKDT-UHFFFAOYSA-N	434.474	1.923	50	20	IDGD	
Cc1cccn2cc(CCNC(=O)NNC(=O)Nc3ccc(S(C)(=O)=O)cc3)nc12	746775917	NIDDOSPZWYTFIS-UHFFFAOYSA-N	430.490	1.625	50	20	IDGD	
O=C(CCOc1ccccc1)NNC(=O)c1cccc(S(=O)(=O)NC[C@H]2CCCO2)c1	747236485	KGUPFGCGIKMAPW-GOSISDBHSA-N	447.513	1.374	50	20	IDGD	
O=C(NCC1CCN(S(=O)(=O)C(F)F)CC1)NNC(=O)c1ccc(Cl)cc1F	747505108	VKXHYAZDEGKYBO-UHFFFAOYSA-N	442.847	1.688	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cccn2C)cc1S(=O)(=O)N1C[C@@H](C)C[C@@H](C)C1	747599131	NSJZZCPPQRBOEZ-GASCZTMLSA-N	448.545	1.775	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cc(C(=O)NNc2nccn(C)c2=O)ccc1C	747941643	MGGDVKDNKRUZIT-UHFFFAOYSA-N	443.485	1.655	50	20	IDGD	
O=C(NNC(=O)c1cc(S(=O)(=O)N2CCC2)ccc1Cl)c1ccc(Cl)nc1	748699116	WLQXNIBBTAJHQM-UHFFFAOYSA-N	429.285	1.858	50	20	IDGD	
CCCN1CCC[C@@H]1C(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	749560655	DEKGTCDGGSNSGT-HXUWFJFHSA-N	444.557	1.801	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)NC2CCN(c3cc(C)nc(C)n3)CC2)c1	749616673	QUQOVDANTGQVLP-UHFFFAOYSA-N	428.493	1.724	50	20	IDGD	
COc1ccc(-n2c(C)cc(/C=C(\C#N)C(=O)NS(=O)(=O)N3CCOCC3)c2C)cc1	750732333	SJJDPRCMJHSJAV-QGOAFFKASA-N	444.513	1.703	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)C2CCC(NC(=O)C3CCCC3)CC2)c1	751084134	XPSKEDZFERCJCF-UHFFFAOYSA-N	435.546	1.716	50	20	IDGD	
COc1ccc(-c2nnc(S)n2CC(=O)NNC(=O)COc2ccccc2F)cc1	751200787	VIIXTTSIMOWURH-UHFFFAOYSA-N	431.449	1.608	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NC2CCC(OC(C)C)CC2)cc1	752697797	VPBQHFFIEHILKQ-UHFFFAOYSA-N	440.566	1.682	50	20	IDGD	
CN1C(=O)N[C@]2(CCC[C@@H]2CNC(=O)NNC(=O)CCSc2ccc(F)cc2)C1=O	753023712	OIMGQIYCSKGDKX-BLVKFPJESA-N	437.497	1.359	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)N[C@@H]1CCN(Cc2ccc(C#N)cc2)C1=O	753033588	RDCCKENWNOKTND-QGZVFWFLSA-N	431.456	1.260	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(n2cc(C(=O)NNc3cc(Cl)nc(N)n3)nn2)CC1	753454807	WXVCHILWSPFSPU-UHFFFAOYSA-N	437.892	1.633	50	20	IDGD	
Cc1oc(S(N)(=O)=O)cc1C(=O)NNC(=O)[C@@H](C)Oc1cccc(Br)c1	754179009	DFSWBBJPHJLXPJ-SECBINFHSA-N	446.279	1.226	50	20	IDGD	
O=C(NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)N[C@@H]1[C@@H]2CCO[C@@H]2C12CCC2	754675440	OBJHVMVXPFAJCA-KSZLIROESA-N	448.545	1.373	50	20	IDGD	
C[C@@](O)(C(=O)NNC(=O)c1csc(N2CCOCC2)n1)c1cccc(C(F)(F)F)c1	754843435	WXXZPJDQELMQCR-KRWDZBQOSA-N	444.435	1.667	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(N2CCCCC2)c(NC(=O)NNC(=O)COC)c1	755392314	ODNPRTBQIBCCSO-UHFFFAOYSA-N	441.554	1.507	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)Nc1ccccc1C(=O)N1CCCCC1	755447897	VBZSJJNAOZLQLZ-UHFFFAOYSA-N	434.460	1.755	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NN=CCCSC)N(S(C)(=O)=O)CC2	755573126	RMXBYGFLNCQXNQ-OAHLLOKOSA-N	429.564	1.808	50	20	IDGD	
CCS(=O)(=O)c1ccc(CCC(=O)NNC(=O)CCN2C[C@H](C)O[C@@H](C)C2)cc1	757720118	FXJZTCGCFRQSRO-HOTGVXAUSA-N	425.551	1.060	50	20	IDGD	
CN1Cc2ccccc2[C@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)C1	757734424	NILPSSOWCDFGIR-GOSISDBHSA-N	431.518	1.068	50	20	IDGD	
Cc1cnn(-c2ccc(C(N)=O)cc2NC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c1	757873875	CZEKSQXBRARLDA-UHFFFAOYSA-N	444.455	1.932	50	20	IDGD	
COC(=O)c1ccccc1CCC(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	758075494	KCHREVVQOMQPQP-UHFFFAOYSA-N	439.877	1.168	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccnc(Br)c2)c1	758152419	TUAQEFNGGPIAHE-UHFFFAOYSA-N	427.280	1.169	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)NC3CCN(c4cccnn4)CC3)nc21	759585021	WHGKLJQEGAOPHA-UHFFFAOYSA-N	426.485	1.372	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2cc3ccccc3nc2Br)CCS(=O)(=O)C1	760299685	AGUIFKMSXSLZOW-INIZCTEOSA-N	441.307	1.134	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H](C)C2CCOCC2)c1	762362832	YTMCCQXVGFJELK-AWEZNQCLSA-N	426.539	1.476	50	20	IDGD	
COc1nn(C)c2nc(C)c(CCC(=O)NNc3nccc(N4CCOCC4)n3)c(C)c12	762847400	JEUYDLUBIWZQBM-UHFFFAOYSA-N	440.508	1.296	50	20	IDGD	
Cc1cc(S(=O)(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)cc(C(=O)O)c1C	763438537	APGQDGGGRQERDV-UHFFFAOYSA-N	429.495	1.616	50	20	IDGD	
CNC(=O)c1cc(Oc2ccccc2NC(=O)C(=O)NNC(=O)c2cccnc2)ccn1	763495440	VEIKZUDEICYBGC-UHFFFAOYSA-N	434.412	1.028	50	20	IDGD	
O=C(NNC(=O)c1ccccc1O)C(=O)Nc1ccc(C(=O)NCc2ccccc2)cc1	763526530	ANHVTOQINMSPLZ-UHFFFAOYSA-N	432.436	1.722	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccccc2CN2CCOCC2)c2ccccc2n1	763610475	HGKLCLYYQLKFHM-UHFFFAOYSA-N	447.495	1.775	50	20	IDGD	
O=C(COc1cccc(C(F)(F)F)c1)NNC(=O)C(=O)Nc1cccc(-n2ccnn2)c1	763638542	AAPZUUPATZJROU-UHFFFAOYSA-N	448.361	1.451	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(N3CCCC3)cc2C)cc1	763658786	BXNDOBJZVJSYSL-UHFFFAOYSA-N	426.473	1.769	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)n(-c2ccccc2F)n1	763674058	KKMSJMOYGWHZQU-UHFFFAOYSA-N	436.403	1.356	50	20	IDGD	
Cc1cc(C)cc(-n2nc(NC(=O)C(=O)NNC(=O)COc3ccc(C#N)cc3)cc2C)c1	763681066	IVYYJJCEPJFJIW-UHFFFAOYSA-N	446.467	1.834	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)C(=O)Nc1ccnc(Sc2ccccn2)c1	763682100	XCXQHMCQTOFHJH-UHFFFAOYSA-N	441.444	1.932	50	20	IDGD	
O=C(CSc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1ccc(-n2cnnn2)cc1	763737463	ZHNBXPCJZQQNPA-UHFFFAOYSA-N	431.865	1.194	50	20	IDGD	
CC(=O)N1CCc2cc(NC(=O)C(=O)NNC(=O)CN3CCCc4ccccc43)ccc21	763745965	LTGNVGAFDVBYDW-UHFFFAOYSA-N	435.484	1.134	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)C(=O)Nc1cccnc1-c1ccccc1	763802771	AIRNRZQVXYVRTH-UHFFFAOYSA-N	435.396	1.822	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(C(=O)NC(C)C)c(C)c2)cc1	763810871	CYLCHWMJHYMPAZ-UHFFFAOYSA-N	426.473	1.607	50	20	IDGD	
CC(=O)N(C)c1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)cc1	763841365	QRELUCZAPCCYFW-HNNXBMFYSA-N	426.473	1.840	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)n(C)c(=O)n3C)c1C	763850629	OTOUGMCPZKOSDH-CQSZACIVSA-N	439.472	1.047	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cc(C)n(CCC#N)n2)cc1	763860459	HGQNJNJTTGYSQI-AWEZNQCLSA-N	428.449	1.057	50	20	IDGD	
CCOCCOc1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)Cn1nc(C)cc1C	763880649	JBBGITCHPOVYAI-UHFFFAOYSA-N	437.884	1.355	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(Cl)cc(C(=O)OC)c2)cc1OC	763901265	MIKNYBCXOVPAAR-UHFFFAOYSA-N	449.847	1.934	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)C(=O)Nc1ccccc1OC(F)F	763949457	OUUFKEPBZFVJHR-UHFFFAOYSA-N	431.355	1.579	50	20	IDGD	
CNS(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=O)CSc2ccccc2O)c1	764046522	MYVJKMUSTZNXKM-UHFFFAOYSA-N	429.907	1.507	50	20	IDGD	
CS(=O)(=O)c1cc(Br)ccc1NC(=O)C(=O)NNC(=O)C1CCCC1	764065848	DIIUWJQAUVSBAR-UHFFFAOYSA-N	432.296	1.129	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccccc2C(=O)N2C[C@@H](C)C[C@@H](C)C2)n[nH]1	764097518	FJYOSTZCILGKNB-BETUJISGSA-N	426.477	1.236	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)nc1)C(=O)Nc1ccc([S@@](=O)C(F)(F)F)cc1	764100203	ISXVEGUFACENBI-MUUNZHRXSA-N	434.783	1.762	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(N3CCC(N(C)C)CC3)cc2)c(O)c1	764109254	JAOQJAGWCRPVTI-UHFFFAOYSA-N	439.516	1.631	50	20	IDGD	
Cc1ncsc1C(=O)NNC(=O)C(=O)Nc1ccccc1C(=O)N1CCC(C)CC1	764244247	DYBOKVIDQHKMIN-UHFFFAOYSA-N	429.502	1.723	50	20	IDGD	
O=C(NNC(=O)c1cc(F)ccc1Br)C(=O)Nc1ccnn1-c1ccncc1	764270035	CGGFUFWOOHJPIG-UHFFFAOYSA-N	447.224	1.569	50	20	IDGD	
CCOC(=O)c1cc(CC)sc1NC(=O)C(=O)NNC(=O)CCc1ccccc1O	764278227	NQQIGZMXLATATL-UHFFFAOYSA-N	433.486	1.912	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)C(=O)Nc1cc(Cl)ccc1OC[C@@H]1CCCO1	764355896	LFYXJQQMKCYAPO-HNNXBMFYSA-N	432.864	1.621	50	20	IDGD	
CCC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)CSc2ccccc2OC)cc1	764393634	SCJOHOOQIQORDU-UHFFFAOYSA-N	430.486	1.922	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNS(=O)(=O)c1cccc(F)c1	765118457	FUEMXWJYXDULOO-UHFFFAOYSA-N	440.928	1.606	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CN2CCO[C@@H](c3ccc(OC(F)F)cc3)C2)c1	766266926	PJVPCWZNTFZLST-GOSISDBHSA-N	430.411	1.994	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)Cc3ccn(-c4ccccc4)n3)CC2)cc1	766650534	VMGAHCWVGYRCQP-UHFFFAOYSA-N	446.555	1.688	50	20	IDGD	
Cc1cc(Cl)c2c(c1)C(=NNC(=O)Cn1cnc3c1c(=O)n(C)c(=O)n3C)CCCO2	767791353	QLJVPQPODJYWID-UHFFFAOYSA-N	444.879	1.089	50	20	IDGD	
CCc1nn(C)c(Cl)c1C(=O)OCC(=O)NNC(=O)c1cc(Cl)ccc1OC	767839903	BKRRHBPNRZJJJW-UHFFFAOYSA-N	429.260	1.916	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2O)cc1	768929719	ONQSRRNLJVVOSN-UHFFFAOYSA-N	428.430	1.796	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H]2CCOC3(CCCCC3)C2)c1	769174122	DCIGKBZHIANZFO-MRXNPFEDSA-N	438.550	1.763	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)N[C@H]3CCN(c4ccccc4F)C3=O)nc21	770393250	CEHFAKMXWDGMPG-ZDUSSCGKSA-N	442.455	1.858	50	20	IDGD	
COc1ccc(Cl)cc1N1C[C@H](C(=O)NNC(=O)c2ccc3c(c2)OCCO3)CC1=O	770406074	GPQGPWLXVDJTBY-CYBMUJFWSA-N	445.859	1.934	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@H](C)C(=O)NNC(=O)[C@@H](NS(C)(=O)=O)C(C)(C)C	770750797	ZEYXEWBMQCJSRF-IUODEOHRSA-N	433.958	1.835	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)N2CCC(C(=O)NCCO)CC2)c(C)n1C[C@@H]1CCCO1	771768303	HCWDVWICYLCLHQ-OABJIQBASA-N	428.533	1.538	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(C(=O)O[C@@H](C)C(=O)NNC(=O)CC(C)C)cc1	771894058	MCLXWXKHWZDKJE-AWEZNQCLSA-N	427.523	1.456	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)CCNC(=O)c1ccc(Br)cc1	771906510	ZKXDFJMUIMTTLI-GFCCVEGCSA-N	442.310	1.694	50	20	IDGD	
O=C(Cn1cc(C(=O)NNC(=O)c2ccc(Br)s2)cn1)NC1CCCC1	772045886	HUFDMTHWLKICMI-UHFFFAOYSA-N	440.323	1.841	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)[C@@H]1CC(=O)N(c2ccc(F)cc2)C1	772183146	QNJWWLOUDVVOLS-CYBMUJFWSA-N	432.839	1.296	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)c1ccc(N2NC(=O)CCC2=O)cc1	772956623	YBSGRVVEEJQIQA-GFCCVEGCSA-N	430.848	1.727	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)[C@H]2CCN(C(=O)OCc3ccccc3)C2)c1	773582400	QTMDTLJVIBSKJT-IBGZPJMESA-N	439.468	1.958	50	20	IDGD	
COc1cc(NS(=O)(=O)c2cc(C(=O)NN(C)C(N)=O)ccc2OC)cc(OC)c1	778417771	XRLXJSWRNKHEJW-UHFFFAOYSA-N	438.462	1.169	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)c2cc(C)c(C)c(S(=O)(=O)N(C)C)c2)nc1C	778425481	AJMPGARGXVSIFN-UHFFFAOYSA-N	435.506	1.586	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)[C@H]1CCCN(C(=O)c2ccc3n[nH]cc3c2)C1	778441283	QZZRAPFALITHLU-AWEZNQCLSA-N	444.492	1.087	50	20	IDGD	
CN(C)C(=O)Cn1cc(NC(=O)NNc2ccc([N+](=O)[O-])cc2Br)cn1	779435751	UVCBDVXREHGYJP-UHFFFAOYSA-N	426.231	1.791	50	20	IDGD	
COc1cc(-c2ccccc2)ccc1C=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O	781123996	RPKRAQSNDSCTOV-UHFFFAOYSA-N	439.497	1.397	50	20	IDGD	
O=C(NNc1nccc(N2CCOCC2)n1)c1cnc2ncc(Br)cc2c1	781950412	WHVFHIYBKVKNBZ-UHFFFAOYSA-N	430.266	1.776	50	20	IDGD	
Cc1cnc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(Br)c2)s1	782120197	GTYNILCSOGIRSA-SECBINFHSA-N	427.280	1.767	50	20	IDGD	
C[C@@H]1CN(Cc2cccc(NC(=O)C(=O)NNC(=O)c3ccc(O)cc3)c2)C[C@@H](C)O1	782838003	WDESIVAZONIUCQ-HUUCEWRRSA-N	426.473	1.401	50	20	IDGD	
COc1ncnc(N(C)C)c1NC(=O)C(=O)NNc1ncc(C(F)(F)F)cc1Cl	782853229	ACOHARPFKMDXEY-UHFFFAOYSA-N	433.778	1.700	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)C(=O)Nc1cc(Cl)ccc1F	782897508	PYNCOSKCFSZJLD-UHFFFAOYSA-N	441.872	1.480	50	20	IDGD	
COCCOc1ncccc1NC(=O)C(=O)NNC(=O)c1ccc(Cl)cc1Cl	782927045	PNUIVCWWJPJIBA-UHFFFAOYSA-N	427.244	1.813	50	20	IDGD	
Cc1cc(Cl)c(NC(=O)C(=O)NNC(=O)CNC(=O)c2cccs2)cc1Cl	784003231	CCSJNFKZJWIVSI-UHFFFAOYSA-N	429.285	1.879	50	20	IDGD	
CS(=O)(=O)NCc1ccc(NC(=O)C(=O)NNc2ccc(OC(F)F)cc2)cc1	784313412	MJRXXLZLNROFOV-UHFFFAOYSA-N	428.417	1.419	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2nc(-c3ccc(Cl)cc3)no2)cc1-n1cnnn1	784799832	PBRWIEVFJNYDIV-UHFFFAOYSA-N	439.823	1.756	50	20	IDGD	
CNC(=O)c1ccc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)NC(C)(C)C)cc1	784832929	HKJRYVIOAODTBG-UHFFFAOYSA-N	447.517	1.205	50	20	IDGD	
C[C@H]1COCCN1c1ccc(NC(=O)C(=O)NNc2cccc(S(C)(=O)=O)c2)cc1	784842043	UGJHZJHLWOAGAY-AWEZNQCLSA-N	432.502	1.397	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C)c(C)c(NC(=O)C(=O)NNc2ccnc(F)c2)c1	784848673	KZGMJQGHAKHOMX-UHFFFAOYSA-N	437.497	1.950	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)C(=O)Nc2ccc(OCc3noc(C)n3)cc2)c1	784850879	DHGCRXBBSFSBFS-UHFFFAOYSA-N	425.401	1.825	50	20	IDGD	
CCNC(=O)N(C)NC(=O)C(=O)Nc1cccc(CS(=O)(=O)Cc2ccccc2)c1	784914873	BEAHKEOUXAWKHN-UHFFFAOYSA-N	432.502	1.433	50	20	IDGD	
Cc1cc2ccccc2nc1NNC(=O)C(=O)Nc1cccc(CN2C(=O)CNC2=O)c1	785164766	JLOQGXNCRVVHSS-UHFFFAOYSA-N	432.440	1.677	50	20	IDGD	
CN(NC(=O)Nc1cccnc1-n1cncn1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	785844427	CSXOIEHFGIRMJV-UHFFFAOYSA-N	445.484	1.303	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)C(=O)Nc1cccc(C(F)(F)F)n1	786417903	ZMPQLWFNLKMUOW-UHFFFAOYSA-N	433.387	1.491	50	20	IDGD	
C[C@@H]1[C@@H](C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)CCN1C(=O)OC(C)(C)C	786686837	CBLZEQBYDDKHCL-OLZOCXBDSA-N	429.477	1.340	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)N[C@H](COC)[C@H]2CCCO2)c2ccccc2c1=O	789332459	PELAXRYOOOABFC-IAGOWNOFSA-N	431.493	1.335	50	20	IDGD	
CC(C)(C)Cc1csc(NC(=O)C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)n1	789732491	AGISDWNGLMGZLS-UHFFFAOYSA-N	438.531	1.535	50	20	IDGD	
CC(C)n1nc(-c2ccco2)cc1NC(=O)C(=O)NNC(=O)COc1ccccc1O	789734149	DLBAINXPQSHQPD-UHFFFAOYSA-N	427.417	1.595	50	20	IDGD	
CCn1c(NNC(=O)CCN2CCN(C(=O)OC(C)(C)C)CC2)nc2ccccc2c1=O	792043959	IJKSNGRYXNQMNN-UHFFFAOYSA-N	444.536	1.802	50	20	IDGD	
COc1cc(Cl)c(Cl)cc1NC(=O)C(=O)NNC(=O)COc1ccccc1O	792269796	YYCYTKKASGBZDM-UHFFFAOYSA-N	428.228	1.873	50	20	IDGD	
O=C(NNc1cc(Cl)cc(Cl)c1)C(=O)Nc1ccn(CCN2CCOCC2)n1	792436984	AHZXJDQRENMNCK-UHFFFAOYSA-N	427.292	1.604	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNC(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1	794069640	JLDKBZFRGIXFBY-UHFFFAOYSA-N	441.444	1.882	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)[C@@H]1CCN(c2ccc(C#N)cc2F)C1	795182417	VFCCGWJLRLRRES-OAHLLOKOSA-N	431.493	1.917	50	20	IDGD	
O=C(NNc1nccc(N2CCOCC2)n1)[C@H]1CCCN1C(=O)OCc1ccccc1	798111499	HYEJYNKXRMIKCL-QGZVFWFLSA-N	426.477	1.558	50	20	IDGD	
O=C(NCC(F)(F)F)NNC(=O)[C@@H]1CCC(=O)N1Cc1ccc(Br)cc1	798315532	JUOPSRQWPNEVHN-NSHDSACASA-N	437.216	1.833	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@@H]2C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1	798830719	SSDJXYJRSKARTJ-GOSISDBHSA-N	449.467	1.008	50	20	IDGD	
CNS(=O)(=O)c1ccccc1S(=O)(=O)NNC(=O)CC12CC3CC(CC(C3)C1)C2	799518363	DTIITSYGCSGMRO-UHFFFAOYSA-N	441.575	1.511	50	20	IDGD	
CNS(=O)(=O)c1ccc(C(=O)NNC(=O)Nc2ccc(Br)cc2)cc1	801997130	SNZDERVJYIIDJO-UHFFFAOYSA-N	427.280	1.824	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)cc1	802066292	SSMRYEYJNJFGTF-UHFFFAOYSA-N	444.429	1.651	50	20	IDGD	
Cc1c(C(F)(F)F)nn(C)c1NC(=O)C(=O)NNC(=O)CSc1ccccc1O	806980242	MMRYXAOJZWINNR-UHFFFAOYSA-N	431.396	1.331	50	20	IDGD	
COc1ccc([C@H](C)NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c(C)c1OC	807600122	YOVQZEUZUCEHNA-ZDUSSCGKSA-N	425.449	1.693	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)NCC(=O)NNc2ccccc2C(=O)OC)cc1	810891545	RIPIRIJCCATIDR-UHFFFAOYSA-N	435.458	1.072	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H](C)CN(C)C(C)C)c1	812514448	YFIBEJCQBFEAHC-HNNXBMFYSA-N	427.571	1.390	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1)NOC/C=C\Cl	812704895	NJOFIJCTPWJZAI-YHYXMXQVSA-N	438.893	1.793	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)c2ccc(-n3ncc(C#N)c3N)cc2)cc1	812732938	VSEGUINAAFGBNW-UHFFFAOYSA-N	425.474	1.333	50	20	IDGD	
CC(=O)N(C)c1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)cc1	813033151	HEUOYOXMNIBHGH-UHFFFAOYSA-N	433.490	1.001	50	20	IDGD	
Cc1cccc(C(C)C)c1NNC(=O)C(=O)Nc1ccn(CC(=O)N2CCOCC2)n1	813049852	OJRBYRBTRMIKND-UHFFFAOYSA-N	428.493	1.256	50	20	IDGD	
COC[C@]1(C(=O)NNC(=O)Nc2ccc3c(c2)OCO3)CCN(C(=O)OC(C)(C)C)C1	813575055	MPIKVKRDEZGMSD-FQEVSTJZSA-N	436.465	1.842	50	20	IDGD	
O=C(NN=C1CCS(=O)(=O)CC1)c1ccccc1NS(=O)(=O)c1cccs1	814706909	OYRQPJHQYIIDMU-UHFFFAOYSA-N	427.529	1.843	50	20	IDGD	
NS(=O)(=O)c1ccc(NC(=O)NN=Cc2cn(-c3ccc(F)c(Cl)c3)nn2)cc1	814967583	QQJIEJYPYLEGSG-UHFFFAOYSA-N	437.844	1.863	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1ccc2c(c1)NC(=O)CS2	815752042	ZMDAPPQKJJJJDU-UHFFFAOYSA-N	449.514	1.063	50	20	IDGD	
CCS(=O)(=O)N[C@H](C)C(=O)NNC(=O)c1cn(-c2ccccc2)nc1-c1ccccc1	816815623	ZJCBSDLZIHNKCC-OAHLLOKOSA-N	441.513	1.628	50	20	IDGD	
CC(C)[C@H](NS(=O)(=O)c1ccc2c(c1)OCCCO2)C(=O)NNc1ncncc1F	817078993	CWNAXASAUPHXIJ-INIZCTEOSA-N	439.469	1.223	50	20	IDGD	
Cc1nc2c(cc1C(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)c(C)nn2C	914680398	WLGSQGJQEVNGNS-UHFFFAOYSA-N	426.389	1.111	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)c1ccccc1S(=O)(=O)C(F)(F)F	915131252	MLSJWFWWRAERGU-ZDUSSCGKSA-N	430.360	1.581	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)NCc2ccc(S(=O)(=O)N3CCCCC3)cc2)n1	915926946	KAUIGETUTCZSDV-UHFFFAOYSA-N	448.549	1.205	50	20	IDGD	
CCNS(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)c2ccc(OCC)c(OC)c2)c1	917924604	BZBLVIFEQUIDMV-UHFFFAOYSA-N	439.465	1.606	50	20	IDGD	
C[C@H](COc1ccccc1)NC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	918087536	GFDGBSZYYYYDPG-MRXNPFEDSA-N	448.549	1.111	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)N[C@H](C)c2cccc(NS(C)(=O)=O)c2)cc1C	918088161	XYYBEGCYVCDSJC-CQSZACIVSA-N	447.517	1.705	50	20	IDGD	
O=C(CCCNC(=O)c1ccc(F)cc1)NNC(=O)c1csc(N2CCOCC2)n1	919810107	XZAUDKKYVZTMTE-UHFFFAOYSA-N	435.481	1.090	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)CCNS(=O)(=O)c2ccccc2Cl)cc1	919835904	UVBNPFHGRGFCRX-UHFFFAOYSA-N	439.921	1.797	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)NCCCS(=O)(=O)c2ccccc2)cc1OC	921201844	QTGUPHLFRQBZOC-UHFFFAOYSA-N	435.502	1.902	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(S(=O)(=O)NNC(=O)c2ccccc2Cl)c1	1256627409	SCYIDDBYFQASAJ-UHFFFAOYSA-N	445.950	1.994	50	20	IDGD	
CS(=O)(=O)Nc1ccccc1CNC(=O)NNC(=O)c1cccc(OC(F)F)c1	1318246590	VPFVCAMNUGXZBX-UHFFFAOYSA-N	428.417	1.804	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1F	1318557951	MHAIDFHJQNZJHI-UHFFFAOYSA-N	431.486	1.791	50	20	IDGD	
Cc1c(C(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)nnn1-c1ccccc1	1318613090	PNLJOFNELJERRA-UHFFFAOYSA-N	428.493	1.984	50	20	IDGD	
O=C(Cn1cc(Br)ccc1=O)NNC(=O)c1ccc(Br)cc1	1322697661	FKSYTSDFEWVFTB-UHFFFAOYSA-N	429.068	1.835	50	20	IDGD	
CC/C=C(/C)C(=O)N1CSC[C@H]1C(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	1322746273	JWMAZYSCDFUYDY-LGVHXXEASA-N	440.547	1.501	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CC1CCC1)C2	1778094319	FXRUZBRCCBJNOH-LVGVVDSRSA-N	443.548	1.825	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccn4cncc4c3)C2)C1	1778658017	GNVKKQVVHDERND-QFBILLFUSA-N	435.322	1.951	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc[n+]([O-])cc1)C2	1780715360	QWLYEQJRLADWTD-ATZDWAIDSA-N	430.332	1.684	50	20	IDGD	
O=C(Cc1n[nH]c2cc(Cl)ccc12)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1780942431	SYVPBGXEUBSTDC-LPHOPBHVSA-N	441.315	1.188	50	20	IDGD	
CC(C)Cc1cc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)n(C)n1	1781331262	NCRGSKKUOJKQJL-QAPCUYQASA-N	445.333	1.753	50	20	IDGD	
C[C@@H](Oc1ccccc1)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781332658	ISKPXSFQJWMJAW-DDUZABMNSA-N	429.286	1.974	50	20	IDGD	
COC(=O)CCCCCC(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781335243	WQHNQINAHBGCMD-NVXWUHKLSA-N	437.306	1.630	50	20	IDGD	
CCOC(=O)/C=C/C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](Br)CC)C1	1781899623	ASMFCTXXWQWECO-SZIZTXFTSA-N	445.354	1.793	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)Oc2ccccn2)C1	1782540714	QRIDNZWCYURQSU-KYFSNAEOSA-N	439.940	1.617	50	20	IDGD	
Cn1ccnc1C(=O)N1CCO[C@@]2(CCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1	1782864416	WCKPXFZIDBORPM-JLOHOZFJSA-N	441.438	1.749	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(COC)c[nH]3)CCO2)C1	1783352772	SRFBBKYGWUCKBN-KSSFIOAISA-N	428.327	1.778	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)CNc3ccc(F)cc3)CCO2)C1	1783532857	OIRJQCHHRDMAJH-SCLBCKFNSA-N	428.302	1.851	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H]1Cc3ccccc3CN1)CCO2	1783533999	CPZPZSOZVLSWHJ-JNAXZKDPSA-N	436.350	1.314	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc4cc(OC)ccc4n3)CCO2)C1	1783875366	QCNIJYDONJGHBY-VGSWGCGISA-N	447.919	1.941	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc([N+](=O)[O-])c(OC)c3)CCO2)C1	1783883475	IYGPQKXTFZYXLZ-AUUYWEPGSA-N	441.868	1.301	50	20	IDGD	
COc1nccnc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]2C1	1783970328	WMEGPQAEAIJJBB-RFGFWPKPSA-N	441.326	1.110	50	20	IDGD	
O=C(/C=C/C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Cl)C[C@@H]21)NCc1ccccc1	1784054804	FUMZUDWFJYNWIH-XHNMEYTFSA-N	437.899	1.373	50	20	IDGD	
Cc1ncc(/C=C/C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)s1	1784687668	BKCRBJHDIUZFCT-JCSQBOLZSA-N	432.315	1.985	50	20	IDGD	
COc1ccc(CC(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)cc1F	1784704244	MAVYKLJCPVSQQT-BFUOFWGJSA-N	443.313	1.990	50	20	IDGD	
CS(=O)(=O)c1ccc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](F)Cl)CCO3)cc1F	1785226340	PVZYVPCRETUQRS-PBHICJAKSA-N	436.864	1.207	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CNC(=O)c3cccs3)[C@H]2C1	1785330333	GVCLZRHIGOXQKW-JONQDZQNSA-N	441.981	1.865	50	20	IDGD	
CCc1[nH]nc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](Br)CC)C[C@@H]32)c1F	1785794886	QSDJISIUMUIYLS-FMSGJZPZSA-N	445.333	1.878	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCn3c(=O)oc4ccccc43)C[C@@H]21)[C@@H](F)Cl	1787443766	CJVLDXGWBLRHTE-RASHJEQFSA-N	439.871	1.499	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21)C1=NN(c2ccccc2)C(=O)C1	1787539406	AVVHTJFZEXDCRL-GKEYINFOSA-N	436.871	1.293	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3snnc3C3CC3)[C@H]2C1	1787741452	YUAUQFHTZHEJFA-XUXIUFHCSA-N	428.942	1.263	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(F)cn3C)[C@H]2C1	1787744428	VCJBMIRRHFCOIH-DSPQJCBJSA-N	430.318	1.789	50	20	IDGD	
COCc1c[nH]c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]32)c1	1789210933	PXFHMCOSEVBXBX-IWKLRQMXSA-N	432.348	1.991	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4n(n3)CCCO4)C[C@@H]21	1789868236	REDQMHRGHLWRRN-VODUFIJXSA-N	445.347	1.495	50	20	IDGD	
Cc1n[nH]c(C)c1CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)CBr)C[C@@H]21	1789973075	ULZGUQZIUPKMFP-UMPQAUOISA-N	441.370	1.580	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)[C@@H](O)Cc1ccccc1	1790955831	WSTYPLQFKOZMQQ-XSLAGTTESA-N	439.350	1.355	50	20	IDGD	
CCC(=O)N[C@@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](Br)CC)[C@H]2C1	1790958217	MMHLBOUPZRWANZ-YTFOTSKYSA-N	432.359	1.054	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3cnc[nH]3)C[C@@H]21	1790958518	SGAWIITUXHFSCD-TUUVXOQKSA-N	427.343	1.496	50	20	IDGD	
C[C@H](C(=O)Nc1ccc(C2(NC(=O)c3cnccc3C(=O)NN)CCC2)cc1)n1cncn1	1791857500	CIUAISMOCFDUES-CQSZACIVSA-N	448.487	1.286	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnc(Cl)nc1	1792369669	PCWCROLWBLTMAS-SYEHKZFSSA-N	431.718	1.364	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@H](O)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C(C)(C)CCl)C2	1793005236	NLIOPOADMORTGV-XGUBFFRZSA-N	431.961	1.775	50	20	IDGD	
CC(=O)N[C@@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@](C)(Cl)CCl)C2)C(C)(C)C	1793194175	LWDUARSEKNCERS-WYGUVQOISA-N	436.380	1.363	50	20	IDGD	
Cc1cccnc1CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2	1793994292	QNIQCHCJDVYLHY-DLTLXFJOSA-N	428.302	1.603	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)nc(Cl)c1	1794411956	YKUHZEFDUMLOOL-BTABJRDXSA-N	446.729	1.675	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCN1CCCCC1	1795289782	MACACPPGBWLGII-CUSZFKRNSA-N	430.387	1.483	50	20	IDGD	
CCOc1ccsc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1	1796189685	OXDVDWCMZIIDIZ-BJWYYQGGSA-N	428.319	1.392	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1ccc2cncn2c1	1797529751	DARRGFGSDOEODM-NEBZKDRISA-N	425.258	1.228	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccn(C(F)F)c1=O	1797992418	DEDMUFVYRCZYRQ-YWVIFJGQSA-N	443.523	1.298	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc3nc[nH]c3c1)C2	1798440353	JGQOBQNGAIMUQL-QDMKHBRRSA-N	433.472	1.127	50	20	IDGD	
Cc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)C(Cl)Cl)C3)c(-n2nccn2)c1	1798631217	IXULQRMCVOYAIH-YWVIFJGQSA-N	438.315	1.583	50	20	IDGD	
COc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)Br)C3)c(C)c1	1799025216	DNBBUVNKJUXEPL-ZJOBFFGXSA-N	425.323	1.990	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)N(C)C(=O)OC(C)(C)C)C2	1799268788	KCRPFKMHPPCCAW-IBEHDNSVSA-N	431.961	1.849	50	20	IDGD	
CCOc1c(F)cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](O)CCl)C3)cc1Cl	1799677027	KFMCHEQGNTYERZ-VZAMPYOESA-N	449.306	1.681	50	20	IDGD	
C#CCCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](Br)Cc1ccccc1	1800437457	YZLOIVMAQGSRFV-AJYBTWMASA-N	433.346	1.996	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)NC(=O)OC(C)(C)C	1800596951	JZTZQURYVKWIAD-YGEZULPYSA-N	434.331	1.251	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccccc1OC(F)F)C2	1800982730	JVMPFTPLELCNLH-LMWOUKEDSA-N	432.851	1.745	50	20	IDGD	
Cc1cccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCC(=O)NN(C)C)C3)c1Cl	1801729705	ANICFSJQHIFXNJ-YVWYUNDQSA-N	436.940	1.225	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1(c2ccccc2)CCC1)c1ccc(B(O)O)cc1	1802191931	IBTHSRDIDFPFFL-KOUNCHBCSA-N	432.329	1.740	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(F)cnc1Cl)C2	1802337710	QFIKMQYEMXPSRA-BTTYYORXSA-N	425.892	1.499	50	20	IDGD	
Cc1ccn2c(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)CCC(=O)NN(C)C)cnc2c1	1802337792	ASFIWXOUHUVCMA-BJWYYQGGSA-N	426.521	1.268	50	20	IDGD	
CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@](C)(Cl)CCl)C2	1802843835	LEFMNFDYCZPTFH-NHMNCCLUSA-N	444.363	1.331	50	20	IDGD	
CC(C)N1CCC(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)CC1	1804143071	ZNWKBFVYPAZNGI-SLFFLAALSA-N	436.984	1.808	50	20	IDGD	
Cc1ccc(C(=O)NCC(=O)N2CCC3(CCCN(C(=O)[C@@H](O)CCl)C3)CC2)cc1	1805529140	MVGGRJSXWFRLOZ-SFHVURJKSA-N	435.952	1.556	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)[C@@H]1Cc2ccccc2CN1	1808235928	WNNNOFOEODNIGE-TUFLPTIASA-N	442.947	1.402	50	20	IDGD	
Cc1cscc1C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1808619878	ILZAJOKKAQFCKE-NQIIRXRSSA-N	449.341	1.765	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cnsn2)[C@@H]1c1cccnc1)[C@H](F)Br	1808652205	WEYLAMVAKZQHKI-UHTWSYAYSA-N	428.287	1.943	50	20	IDGD	
CCc1oncc1C(=O)N1CCCC2(CCN(C(=O)c3cnccc3C(=O)NN)CC2)C1	1808764885	WQQZTQUSKXKHLX-UHFFFAOYSA-N	440.504	1.394	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2cnn3ccncc23)[C@@H]1c1cccnc1	1809390160	WVHRTSHJNSMKFJ-IEZWGBDMSA-N	442.907	1.698	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)c3cccc4nccn34)CC2)C1	1809980142	IZVRECIVBSSMJR-UHFFFAOYSA-N	446.316	1.173	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2cc3cccnn3n2)[C@H]1c1cccnc1	1811269547	GLRIPCDGBHBIBO-VDZJLULYSA-N	442.907	1.698	50	20	IDGD	
Cn1ccc(=O)cc1C(=O)NC[C@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1	1811361090	UBGAVWUOKKBASF-BEFAXECRSA-N	447.333	1.885	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2ccc3nn[nH]c3c2)[C@@H]1c1cccnc1	1812302071	QJZHQRHFSZCMKS-GJYPPUQNSA-N	442.907	1.926	50	20	IDGD	
CC(=O)N/C(C)=C/C(=O)N1CC[C@H](CNC(=O)[C@@H](C)Br)[C@H]1c1cccnc1	1812869054	QDYNLNLIRHYCAG-FVLCHZBUSA-N	437.338	1.911	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2cn3cccnc3n2)[C@@H]1c1cccnc1	1813029901	ALGZYWVUTLEAOB-XYJFISCASA-N	442.907	1.698	50	20	IDGD	
Cc1cnc(C(=O)N2CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)s1	1813070590	JYRXBRVQQRASIF-VQIMIIECSA-N	444.561	1.539	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)Cn3cc(Cl)cn3)sc2C1	1815413880	LRHPKQXOXWAXBF-MNOVXSKESA-N	432.333	1.859	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccccc2O)n[nH]1	1816265453	FZGHRPBIUIUNPJ-QGZVFWFLSA-N	449.471	1.734	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CN2CCOCC2)n[nH]1	1817151854	QWZIACLLNISHPG-DZGCQCFKSA-N	442.358	1.908	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)C2(C)COC2)[nH]n1	1818110574	KHVMQKRHTJONDZ-CBFMJHRQSA-N	441.492	1.572	50	20	IDGD	
Cc1ccccc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2	1822005180	RYTBOVRZCBBXAE-MRXNPFEDSA-N	435.314	1.671	50	20	IDGD	
CC(=O)C[C@H](C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1822335411	JEOSXPSHJXBVHY-UGSOOPFHSA-N	426.282	1.011	50	20	IDGD	
O=C(N[C@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1)c1cc[n+]([O-])cc1	1823007711	RZLCWTVKVQOFIE-JOYOIKCWSA-N	429.271	1.693	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CN1CCCCC1=O)CC2	1825647042	ICYCRCTYALEERX-MNOVXSKESA-N	443.367	1.851	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)Cc1c(C)nn(C)c1C)CC2	1826009159	MKGUDLUZUKPFKE-TZMCWYRMSA-N	439.969	1.902	50	20	IDGD	
Cc1cc(C(=O)N[C@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)ccn1	1826087442	CGRSUDMVSADCTM-AWEZNQCLSA-N	430.534	1.445	50	20	IDGD	
C[C@H](Oc1cccnc1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830369852	CGJHCPOYNIKYSV-KKSFZXQISA-N	439.940	1.570	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ncc(F)cc3F)C2)C1	1831641011	UMJBXGTYZAMMHL-AUUYWEPGSA-N	431.867	1.837	50	20	IDGD	
CCS(=O)(=O)CC(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H](C)Br)CC1	1831648426	FFOHEDAMMDGKSA-ZFWWWQNUSA-N	437.400	1.824	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)CCc2cnccn2)CC1	1831877178	SZASOBOXEVMWET-FQEVSTJZSA-N	444.580	1.402	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC([C@@H]2CCCCN2C(=O)C2CN(C)C2)CC1	1832426554	RLBAZHAFJCYHGZ-KXWHUPIZSA-N	442.564	1.302	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3csnc3C)CCO2)C1	1833749783	VWOFTSIHXNCCNN-PBHICJAKSA-N	446.367	1.695	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3cc(O)n(C)n3)CC2)CC1	1833946710	APFNNSUVECLLEW-GFCCVEGCSA-N	442.358	1.094	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)c(C)o1	1834096720	RDBUDJCZOCUFNI-SCLBCKFNSA-N	429.311	1.750	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)NC1CCN(C2CCN(C(=O)[C@H](C)Br)CC2)CC1	1835830970	HZTRBWIFKUPIQA-UONOGXRCSA-N	443.386	1.032	50	20	IDGD	
O=C(c1nccc2[nH]ccc12)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836718059	QZBHSPWSJVKKDH-GOSISDBHSA-N	434.924	1.775	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3n[nH]c4ccc(F)cc34)CCO2)C1	1837043041	OXVVOWRXMOYLDX-YWZLYKJASA-N	438.887	1.789	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](N)c3cccc(Cl)c3)C2)C1	1839144328	VJHLANADEZBTMO-ABSDTBQOSA-N	444.359	1.814	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3n[nH]c4ccc(C#N)cc34)C2)C1	1839147959	ICFYTHPHSQKHNE-KKSFZXQISA-N	445.907	1.522	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)COc3cccnc3)C2)C1	1839150514	OFWFEWWPQIGLBV-RBUKOAKNSA-N	446.331	1.153	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)c(O)c1OC	1839376695	NFDFDTPPRCIDAY-LPHOPBHVSA-N	446.859	1.014	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3=CCCS3)C2)C1	1839963042	YEJGEXYXGGBJTH-DYVFJYSZSA-N	433.368	1.637	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(C=O)s3)C2)C1	1840032472	ZFJIRHNWWZMILD-SJCJKPOMSA-N	445.335	1.414	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(Cl)cc3C)C2)C1	1840149522	RPNAQPCZHFOQSY-YLJYHZDGSA-N	445.343	1.972	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCCCn3cccc3)C2)C1	1840153390	MTEKOGHHRZUZJD-NQIIRXRSSA-N	441.956	1.369	50	20	IDGD	
O=C(Cc1ccc(F)cc1F)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840189950	URSWTSQRVUVJCT-SFHVURJKSA-N	437.270	1.767	50	20	IDGD	
Cc1ccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)o1	1840508489	COWWLZGSXXSQNY-KSSFIOAISA-N	429.311	1.370	50	20	IDGD	
O=C1COc2ccc(C(=O)N3CCCC34CN(C(=O)[C@H](F)Br)C4)cc2N1	1844080584	PCTRKIHCPGFRTG-AWEZNQCLSA-N	426.242	1.525	50	20	IDGD	
COc1cc(C)c(C(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)c(C)c1	1845467180	ZSRDAWZFZQXOCG-UHFFFAOYSA-N	437.500	1.441	50	20	IDGD	
COCCOCCOCCC(=O)N1CCCC12CN(C(=O)[C@@H](C)CBr)C2	1846247851	JYXJIFQOJPKFLL-HNNXBMFYSA-N	435.359	1.291	50	20	IDGD	
CCOc1c(C(=O)N2CC3(CCCN3C(=O)[C@@H](Cl)COC)C2)cnc2c1cnn2C	1846361804	PZLJCDQKVHUBLH-HNNXBMFYSA-N	435.912	1.438	50	20	IDGD	
O=C1C[C@H](C(=O)N2CCCC23CN(C(=O)[C@@H](Br)Cc2ccccc2)C3)CCN1	1846424582	ROZXXNHBJIMMND-SJORKVTESA-N	448.361	1.722	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)C(F)(F)C(F)(F)C(=O)O	1847493813	JJLLRZRAYOMWDA-VGMNWLOBSA-N	433.196	1.574	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@](F)(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](O)CCl)C1	1847563899	RHEVNCNRPDSSJG-UJKGCTCZSA-N	447.935	1.527	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2Oc3ccccc3O[C@@H]2C)c1	14287660	WDRROOQGBDWCPJ-AUUYWEPGSA-N	447.513	1.707	50	20	IDGD	
CCOC(=O)N1CCC(C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)CC1	17196589	VSKLRVPHBLNVAC-UHFFFAOYSA-N	429.477	1.607	50	20	IDGD	
C#CCNS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H](C)Oc2ccc(OCC)cc2)c1	18072058	PAEBHSYBRWWABW-HNNXBMFYSA-N	445.497	1.225	50	20	IDGD	
CC(C)(C)C(=O)NNC(=O)CSc1nnc(-c2cccc(Br)c2)n1N	20830431	RWKUFDYPZFPXHF-UHFFFAOYSA-N	427.328	1.707	50	20	IDGD	
COc1cc(/C=C(\C#N)C(=O)Nc2nccs2)ccc1OCC(=O)N1CCOCC1	23215605	GMIMFNZLXXUMRI-XNTDXEJSSA-N	428.470	1.935	50	20	IDGD	
CCCn1c(CCC(=O)NNC(=O)c2cc(C)oc2C)nc2cc(S(N)(=O)=O)ccc21	27617675	YTNIFTOLOWNEMI-UHFFFAOYSA-N	447.517	1.697	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)N[C@@H]2CCCN(S(C)(=O)=O)C2)N(C)c2ccccc21	109047988	QHNJGNRXVDSKCM-OAHLLOKOSA-N	445.545	1.197	50	20	IDGD	
O=C(Cc1ccc(Cl)cc1)NNC(=O)c1sccc1S(=O)(=O)N1CCOCC1	115501824	MSNWJQIBIAVDTO-UHFFFAOYSA-N	443.934	1.426	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)CCCN1C(=O)CN(C)C1=O	726196367	ONIPWTCTHGUKEJ-LLVKDONJSA-N	441.282	1.038	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)NCc2ccc([C@@]3(C)NC(=O)NC3=O)cc2)cc1	726282372	MWGGHIZVEXFYMR-OAQYLSRUSA-N	441.513	1.672	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)[C@H](C)NC(=O)c2n[nH]c3ccccc23)cc1	726379034	DTKCTJSZOZZDSK-KBPBESRZSA-N	439.472	1.695	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)c2ccc(F)c(S(=O)(=O)N(C)C)c2)cc1F	727498829	HCWOBVJRWVTJCP-UHFFFAOYSA-N	444.485	1.855	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CC(=O)N(c2ccccc2F)C1)C1CCN(c2ncccn2)CC1	728844691	AXTKRXQGTIPURA-OAHLLOKOSA-N	426.452	1.033	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(C(F)(F)F)cc1)C1CCN(c2ncccn2)CC1	728856383	OQSMVUZLEPKGRM-UHFFFAOYSA-N	429.424	1.722	50	20	IDGD	
CN(C[C@H]1CCN(CC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)C1)C(=O)OC(C)(C)C	729476746	IVPVEZBNRYUPCW-CQSZACIVSA-N	435.481	1.545	50	20	IDGD	
O=C(COc1ccccc1O)NNS(=O)(=O)c1cc(Br)ccc1[N+](=O)[O-]	730814046	PYOHFMNMULBJQO-UHFFFAOYSA-N	446.235	1.451	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)CCN3CCN(C(=O)[C@@H]4CCCO4)CC3)cc2C1	732053149	XYHLDBQGXNGRTM-RDJZCZTQSA-N	448.589	1.347	50	20	IDGD	
Cc1oc(C(=O)NNc2nc3ccccc3c(=O)n2C)cc1S(=O)(=O)N1CCCC1	733263652	PEGCWWFLGQDINA-UHFFFAOYSA-N	431.474	1.376	50	20	IDGD	
O=C(NNc1ccc(Cl)nn1)c1cc(S(=O)(=O)N2CCOCC2)ccc1Cl	735687578	QNLJKRBNLQYBGS-UHFFFAOYSA-N	432.289	1.561	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)COCc1ccccc1)c1ccc(S(=O)(=O)N(C)C)cc1	738985367	NINIALOUIFGUKQ-OAHLLOKOSA-N	434.518	1.545	50	20	IDGD	
CN(C)C(=O)CS(=O)(=O)c1ccc(C(=O)NNC(=O)Cc2ccc(Cl)cc2)cc1	742035791	ZRBANGOXPPLLGL-UHFFFAOYSA-N	437.905	1.206	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)CN(C[C@H]1CCCO1)C(=O)OC(C)(C)C	742036051	BMGVDLXIXODYEI-OAHLLOKOSA-N	431.493	1.820	50	20	IDGD	
CC(=O)N(CCC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)Cc1ccccc1	743831124	PYWZNOHFGZVUTE-UHFFFAOYSA-N	432.502	1.682	50	20	IDGD	
COc1cc(C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)c([N+](=O)[O-])cc1OC	744455481	YTTSEKWKDVSICT-UHFFFAOYSA-N	428.357	1.102	50	20	IDGD	
O=C(NCCN1CCN(c2ccccc2)CC1)NNC(=O)c1cc([N+](=O)[O-])ccc1O	745518817	NNJOXNLOYIQVGF-UHFFFAOYSA-N	428.449	1.067	50	20	IDGD	
COc1cc(C)nc(NNC(=O)c2ccc(C(=O)NNc3nc(C)cc(OC)n3)s2)n1	746694773	ZWNUZJVRPTZXRU-UHFFFAOYSA-N	444.477	1.476	50	20	IDGD	
C[C@@H]1C[C@@H](C)CN(S(=O)(=O)c2cccc(C(=O)NNC(=O)Cc3ccncc3)c2)C1	747318611	AESUEOFIXVWAAR-HZPDHXFCSA-N	430.530	1.752	50	20	IDGD	
Cc1nc(C(=O)NNC(=O)c2ccc3ccccc3n2)nn1-c1n[nH]c(C(F)(F)F)n1	747348728	POLKSVRABDDFSF-UHFFFAOYSA-N	431.338	1.336	50	20	IDGD	
COCCCNC(=O)CN(C)C(=O)CCC(=O)C(C#N)=C1N(C)c2ccccc2N1C	749585716	XUFUFUFCSPQCKH-UHFFFAOYSA-N	427.505	1.268	50	20	IDGD	
C[C@@H](NC(=S)NNC(=O)CCCNS(=O)(=O)c1ccc2c(c1)CCCC2)C1CC1	751619097	SLDILQMICWMYID-CQSZACIVSA-N	438.619	1.918	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)NCCCCCC(=O)N2CCN(C(=O)CC(C)C)CC2)o1	752369290	ZTSUJWFGKWBNKL-UHFFFAOYSA-N	449.552	1.809	50	20	IDGD	
CC[C@H](NC(=O)/C(C#N)=C\c1cc(C)n(C[C@H]2CCCO2)c1C)C(=O)N1CCOCC1	752480866	BZHDDHUBVQVCMM-NXMPMIKESA-N	428.533	1.945	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](n2cc(C(=O)NNc3ncnc4[nH]cnc34)cn2)C1	753415262	BQRCUHXGAKFVCV-CYBMUJFWSA-N	427.469	1.878	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(C(=O)NNC(=O)c2ccc(F)cc2Br)co1	755588037	NNBYVEVVWJTXDO-UHFFFAOYSA-N	434.243	1.506	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)Nc2ccccc2CN2C(=O)CNC2=O)o1	755988858	OEWINUKNFXRODL-UHFFFAOYSA-N	442.476	1.640	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)Nc1ccc(N2CCOCC2)c(F)c1	756336142	RGWUZFQRMRDGSU-UHFFFAOYSA-N	433.396	1.802	50	20	IDGD	
O=C1C[C@@H](Cc2ccc(NC(=O)NNC(=O)c3cccc(OC(F)F)c3)cc2)C(=O)N1	756816633	SIUDSAJSUFKPMJ-CYBMUJFWSA-N	432.383	1.960	50	20	IDGD	
Cc1cccc(NS(=O)(=O)c2ccc(C)c(C(=O)NNc3ccc(C(N)=O)nn3)c2)c1	757393333	XUBYDIHSGTXZRS-UHFFFAOYSA-N	440.485	1.750	50	20	IDGD	
Cc1cnn(-c2ccc(C(N)=O)cc2NC(=O)NNC(=O)CSc2ccccc2O)c1	757873404	LAPREQDBGHISHK-UHFFFAOYSA-N	440.485	1.930	50	20	IDGD	
CN1C(=O)C[C@H](C(=O)NNc2nccc(N3CCOCC3)n2)[C@@H]1c1ccc(Cl)c(F)c1	760172212	DVEISODIBUIIIL-UGSOOPFHSA-N	448.886	1.768	50	20	IDGD	
O=C(NNc1ncc(F)cn1)C1CCN(S(=O)(=O)c2ccc(F)c(Cl)c2)CC1	762095436	CEDBFJCHHPUUMW-UHFFFAOYSA-N	431.852	1.952	50	20	IDGD	
O=C(O)c1cc(Br)cc(S(=O)(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c1	762462534	JFLQENWFNMNOBQ-UHFFFAOYSA-N	444.219	1.679	50	20	IDGD	
CSc1nc2ccc(NC(=O)C(=O)NNC(=O)[C@@H]3COc4ccccc4O3)cc2s1	763570260	DLWCKPCVWSJCEH-AWEZNQCLSA-N	444.494	1.944	50	20	IDGD	
CC1CCN(c2ccc(NC(=O)C(=O)NNC(=O)[C@@H]3COc4ccccc4O3)cc2)CC1	763571375	MSWQCZVYGUIVLF-FQEVSTJZSA-N	438.484	1.849	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1	763581432	RFASBIJJEIIBLI-UHFFFAOYSA-N	433.425	1.249	50	20	IDGD	
C[S@@](=O)Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)ccc1Cl	763837230	AZVIDYSUFKSSCW-GDLZYMKVSA-N	441.868	1.523	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(OC(C)C)nc2)cc1	763862113	UDONCRCVCPQTQM-CQSZACIVSA-N	430.461	1.821	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccc(Cl)c(Br)c2)n1	763884170	BWEHMHJJWZEYMM-UHFFFAOYSA-N	428.674	1.702	50	20	IDGD	
CCOC(=O)c1cn(C)nc1NC(=O)C(=O)NNC(=O)c1cc2c(s1)CCCCCC2	763910627	BMWBWPOHBLYAEB-UHFFFAOYSA-N	447.517	1.717	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cnn(-c3ccccc3)n2)cc1OC	763912683	ZSGZFKALDJGKFF-UHFFFAOYSA-N	438.444	1.464	50	20	IDGD	
CN(C)c1nc2cc(NC(=O)C(=O)NNC(=O)c3cc(Br)c[nH]3)ccc2o1	763995146	NDRRGASSLIMGCV-UHFFFAOYSA-N	435.238	1.384	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1c(F)cccc1-n1cccn1	764003363	CFIZAJVADDADJJ-UHFFFAOYSA-N	425.376	1.182	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1ccccc1O[C@H]1CCOC1	764013160	VKGONJQNCSOBJB-ZDUSSCGKSA-N	433.848	1.916	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)on2)cn1C	764016778	NAFWDPQRYCIKPW-UHFFFAOYSA-N	425.401	1.257	50	20	IDGD	
O=C(NNC(=O)c1cccc(Br)c1)C(=O)Nc1ccn(-c2ncccc2F)n1	764062953	HKQFPTRWTVAJGN-UHFFFAOYSA-N	447.224	1.569	50	20	IDGD	
CCOC(=O)C1CCN(C(=O)c2ccc(NC(=O)C(=O)NNC(=O)[C@H](C)CC)cc2)CC1	764082040	AHPLTVIXOMHOMN-CQSZACIVSA-N	446.504	1.234	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)C(=O)Nc1ccccc1CN1CCOCC1	764242665	XPWKBXKLJBDOLT-UHFFFAOYSA-N	435.484	1.260	50	20	IDGD	
COCCOc1ccc(C(F)(F)F)cc1NC(=O)C(=O)NNC(=O)c1scnc1C	764245438	GITRMOZGCPSTLF-UHFFFAOYSA-N	446.407	1.895	50	20	IDGD	
COCCOc1ccc(C(F)(F)F)cc1NC(=O)C(=O)NNC(=O)Cc1ccccn1	764270098	FTQYNDVFLUBWBT-UHFFFAOYSA-N	440.378	1.454	50	20	IDGD	
CC(C)(C)OC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2O)cn1	764277797	OATLWDRKPJNELZ-UHFFFAOYSA-N	445.432	1.299	50	20	IDGD	
O=C(Cc1cc[nH]n1)NNC(=O)C(=O)Nc1cc(Br)ccc1N1CCCC1	764285574	GQEXHECRGKVTOX-UHFFFAOYSA-N	435.282	1.101	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)C(=O)Nc1cccc(Cn2cccnc2=O)c1)c1ccccc1	764328325	OVSNXSDNGNVEIM-LJQANCHMSA-N	433.468	1.571	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)C(=O)N1C[C@@H](C(=O)OC)Oc2ccccc21)c1ccccc1	764330975	ZUYCQUJQFDGEDO-QAPCUYQASA-N	425.441	1.295	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)C(=O)Nc2ccnn2Cc2cccc(Cl)c2Cl)cn1	764358657	HEAWHFCOCYWNFX-UHFFFAOYSA-N	436.259	1.371	50	20	IDGD	
CCC(=O)Nc1ccc(Cl)c(NC(=O)C(=O)NNC(=O)COCc2ccccc2)c1	764366441	LUXQMFAEFKERPA-UHFFFAOYSA-N	432.864	1.991	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)COCc2ccccc2)c(OC[C@@H]2CCCO2)c1	764367793	MFCIGNUBECDKQQ-SFHVURJKSA-N	441.484	1.856	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1)C(=O)Nc1ccc2c(c1)OC(F)(F)O2	764387380	KWBSAZPPGBDEIS-UHFFFAOYSA-N	447.329	1.937	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1ccc2c(c1)NC(=O)[C@@H](C)O2	764392970	MZHSHCNMEOQLEH-LLVKDONJSA-N	444.469	1.293	50	20	IDGD	
C#CCOc1ccc(F)cc1NC(=O)C(=O)NNC(=O)CSc1ccccc1OC	764393617	JKPSEWZGYMTSGH-UHFFFAOYSA-N	431.445	1.725	50	20	IDGD	
CC(C)(C)OC(=O)NNC(=O)C(=O)Nc1ccc2c(ccn2CCN2CCOCC2)c1	765397416	ZPPSSYIAZKHMPL-UHFFFAOYSA-N	431.493	1.468	50	20	IDGD	
O=C(NNC(=O)c1cc(S(=O)(=O)NCc2ccccc2)ccc1O)c1ccccn1	765460909	TTYDCQAUFYCODL-UHFFFAOYSA-N	426.454	1.341	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NN=CC[C@@H]1CCOC1)N(S(C)(=O)=O)CC2	765569397	KKTRCHKPOJBKFP-PBHICJAKSA-N	439.534	1.481	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)C[C@H]3CC[C@@H](C)C3)CC2)cc1	765729362	PJAJFTSQOBCALE-MSOLQXFVSA-N	436.578	1.275	50	20	IDGD	
O=Cc1ccc(OCC(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)cc1	766659876	HNLXYHYAUPBYGY-UHFFFAOYSA-N	444.919	1.497	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)CNC(=O)c1ccc(Br)cc1	771414935	BZCNKVZNJJPICU-UHFFFAOYSA-N	426.292	1.726	50	20	IDGD	
O=C(NCC1CCN(c2ccncc2)CC1)NNC(=O)c1csc(N2CCOCC2)n1	771906551	WBUSXXZHCHWKKZ-UHFFFAOYSA-N	445.549	1.235	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)CCCNC(=O)c1cccnc1	772047462	QMWQALVAEJRDSB-CYBMUJFWSA-N	449.305	1.969	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)N[C@@H]2CC(=O)N(C3CCCCC3)C2)cc1	772563785	LCHBVZGQYIILDU-CQSZACIVSA-N	437.522	1.359	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCCCCC2)cc1NC(=O)C(=O)NNc1ncccn1	773721477	QOPMTQUMRIUFKE-UHFFFAOYSA-N	448.505	1.132	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNc2nccc(OC)n2)c(Br)cc1F	773729882	BYCAMMGCISAVRF-UHFFFAOYSA-N	442.201	1.255	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)N[C@H]1CCN(c2ccc(Cl)c(Cl)c2)C1	778639341	CKSIXPRFSBXEFU-NSHDSACASA-N	440.287	1.926	50	20	IDGD	
CCNC(=O)N(C)NC(=O)CCC(=O)N[C@@H](C)C(=O)c1ccc(Br)cc1	780711057	IODQOCXJZOVIIX-NSHDSACASA-N	427.299	1.609	50	20	IDGD	
CCNC(=O)N(C)NC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(Br)cc2)C1	780712369	RFCUBKRSYPDXHU-LBPRGKRZSA-N	447.355	1.542	50	20	IDGD	
COc1ccc(NNC(=O)c2ccc(Br)c(S(=O)(=O)N(C)C)c2)nc1	781527915	OMNXQPCQRRLVOE-UHFFFAOYSA-N	429.296	1.860	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)c1ccc(C)cc1)C(=O)NNc1ncncc1Cl	781820218	OXCGNSBKZQXDEM-AWEZNQCLSA-N	429.955	1.982	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NN=c2sc3ccccc3n2C)c(OC)c(OC)c1	783349165	AIXIIWLXERVFKD-UHFFFAOYSA-N	444.469	1.614	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)C(=O)Nc1cccc(-c2ccc3c(c2)CCO3)c1	784001666	AMETYWLJYWWVHT-UHFFFAOYSA-N	448.435	1.397	50	20	IDGD	
O=C(NNc1ccc(F)cc1)C(=O)Nc1ccc(N2CCN(C(=O)C3CC3)CC2)nc1	784786392	QOQOVIHVOMBSJB-UHFFFAOYSA-N	426.452	1.361	50	20	IDGD	
COC(=O)c1cc(OC)c(OC)c(OC)c1NC(=O)C(=O)NNc1ncccc1Cl	784817175	VBTVNQJABCMZHN-UHFFFAOYSA-N	438.824	1.629	50	20	IDGD	
COC(=O)c1cc(OC)c(OC)c(OC)c1NC(=O)C(=O)NNc1cccc([N+](=O)[O-])c1	784827912	APIJJCYRPJGHJP-UHFFFAOYSA-N	448.388	1.489	50	20	IDGD	
Cc1cc(S(C)(=O)=O)ccc1NC(=O)C(=O)NNc1ccnc(Br)c1	784837568	YJJDWELIWVYRTC-UHFFFAOYSA-N	427.280	1.638	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)C(=O)Nc2ccc(S(=O)(=O)NC(C)C)cc2)c1	784852450	LGYDDJIAMGNQFV-UHFFFAOYSA-N	434.474	1.242	50	20	IDGD	
O=C(NNc1cc(F)c(F)c(F)c1)C(=O)Nc1ccc(S(=O)(=O)NC2CC2)cc1	785087470	UYWIXILBGGCOJW-UHFFFAOYSA-N	428.392	1.626	50	20	IDGD	
CCOC(=O)Cn1cccc(NC(=O)C(=O)NNc2cc(C(F)(F)F)ccc2F)c1=O	785167328	SQRXNTLIKNRIKY-UHFFFAOYSA-N	444.341	1.651	50	20	IDGD	
N#C/C(=C\c1ccccc1)C(=O)OCC(=O)N1CCN(S(=O)(=O)c2ccccc2)CC1	785347832	HTAMVQDJOAJTGO-XDJHFCHBSA-N	439.493	1.670	50	20	IDGD	
CN(NC(=O)Nc1ccc2c(c1)oc(=O)n2C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	785849220	PUSLIBKBGDGYCO-UHFFFAOYSA-N	448.480	1.773	50	20	IDGD	
O=C(NN=Cc1ccc(Br)cc1N1CCOCC1)N[C@@H]1CCS(=O)(=O)C1	788715010	UGVAROQKIMBPCB-CQSZACIVSA-N	445.339	1.106	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(O[C@@H]3CCOC3)cc2)c1	788720705	OGCSJAKLEZULCS-QGZVFWFLSA-N	433.486	1.179	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)CC(=O)N2C	789740959	LGAZQYSAHAJVCR-CQSZACIVSA-N	446.463	1.912	50	20	IDGD	
COC(=O)Cc1ccccc1NC(=O)C(=O)NNC(=O)[C@H]1OCC[C@H]1c1ccccc1	789815623	CVIMDMJXUOKSEC-LPHOPBHVSA-N	425.441	1.061	50	20	IDGD	
CO[C@H]1CCOc2c(NC(=O)C(=O)NNC(=O)c3cc(-c4ccccc4)[nH]n3)cccc21	790951764	LGEKCGJKBZSZOD-SFHVURJKSA-N	435.440	1.946	50	20	IDGD	
CC[C@H](C)C(=O)NNC(=O)C(=O)Nc1cc(Br)cc(C(=O)N2CCCC2)c1	790952756	UTHUZFDDZPGCAK-NSHDSACASA-N	439.310	1.817	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@@H]2C(=O)NNc2nc3ccccn3n2)cc1	791257239	BHHNEBBSPGMZRK-QGZVFWFLSA-N	442.501	1.618	50	20	IDGD	
CCOc1c(Cl)cccc1CC(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	791502433	PWEFBVLFKFDUOX-KRWDZBQOSA-N	448.859	1.812	50	20	IDGD	
CCCCn1ncc(NC(=O)C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c1C(C)C	792269879	XXKZSAHWRYXSKC-UHFFFAOYSA-N	439.480	1.182	50	20	IDGD	
COc1c(C(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)cccc1[N+](=O)[O-]	793680924	HNMZRGJKSPJTME-UHFFFAOYSA-N	441.488	1.491	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@@H](C)N(C)CC(F)(F)F)CC2)cc1	793683962	XKGIVSOQZOYXHS-MRXNPFEDSA-N	429.487	1.143	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)Nc1ccc(NS(=O)(=O)Cc2ccccc2)cn1	797653695	IHBXBSHYKOGNFC-UHFFFAOYSA-N	440.485	1.814	50	20	IDGD	
O=C(NCCCNS(=O)(=O)c1ccccc1Cl)NNC(=O)c1ccccc1O	798494253	ALBFNQXUTPZPKT-UHFFFAOYSA-N	426.882	1.358	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2cc(S(N)(=O)=O)c(Br)s2)cc1	802059381	HQOQKJBZNITCDZ-UHFFFAOYSA-N	449.308	1.633	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)CCN/C(O)=C2/N=CC=CC2=O)cc1Cl	802074030	CKRTVRUSFMFFSP-MSUUIHNZSA-N	437.840	1.426	50	20	IDGD	
CCCN(NC(=O)[C@@H]1CC(=O)N(c2cccc(S(N)(=O)=O)c2)C1)C(=O)OC(C)(C)C	804594782	RAONWNYMKVKNKT-CYBMUJFWSA-N	440.522	1.365	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cccc(C(C)(C)O)c2)cc(OC)c1OC	806972874	PMLCACDBJZYCSI-UHFFFAOYSA-N	431.445	1.340	50	20	IDGD	
CCN(C)C(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)c1	806973569	RRPHYRVOGABLLK-UHFFFAOYSA-N	434.456	1.568	50	20	IDGD	
COC(=O)[C@H]1CCCCN1C(=O)c1cccc(NC(=O)C(=O)NNc2ncccc2F)c1	807302227	PCYQRFZCJBKNRS-MRXNPFEDSA-N	443.435	1.470	50	20	IDGD	
CCOC(=O)c1cnn(-c2cccc(NC(=O)C(=O)NNc3cccc(F)n3)c2)c1C	807390577	GPONOEJAHPWECT-UHFFFAOYSA-N	426.408	1.973	50	20	IDGD	
O=C(NNc1cccc(F)n1)C(=O)Nc1ccc2c(ccn2CC(=O)N2CCOCC2)c1	807391528	XGLCZARSENMQFJ-UHFFFAOYSA-N	440.435	1.116	50	20	IDGD	
Cc1ccccc1[C@H]([C@@H](C)NC(=O)NNC(=O)c1csc(N2CCOCC2)n1)N(C)C	807406714	AZRFYVFUPAKOIS-QAPCUYQASA-N	446.577	1.924	50	20	IDGD	
COC(=O)c1c(NC(=O)C(=O)NNc2ccc(-n3ccnc3)nn2)sc2c1CCCC2	807429335	UCOOJYGSWXXENE-UHFFFAOYSA-N	441.473	1.471	50	20	IDGD	
COCCOc1c(Cl)cc(S(=O)(=O)NNC(=O)N2CCOCC2)cc1Cl	808086275	WHATWARFDIBKSV-UHFFFAOYSA-N	428.294	1.254	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)C(=O)OC3)ccc1OC(C)C	808934587	MJYCZWAXZKENMZ-UHFFFAOYSA-N	427.413	1.553	50	20	IDGD	
NS(=O)(=O)c1ccc2c(c1)C(=NNC(=O)C1CCN(c3ncccn3)CC1)CCC2	811642065	XSWAGAPCBZLBHR-UHFFFAOYSA-N	428.518	1.197	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)[C@H]1COc2ccccc2O1)c1ccc(N2CCCNC2=O)cc1	812944286	LFIIWOADCUIKTF-AUUYWEPGSA-N	439.472	1.838	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2cnn(-c3ccccn3)c2N)c2ccccc2c1=O	814731688	FZFBNYICPJAIDY-UHFFFAOYSA-N	432.444	1.044	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2cnc(C(F)(F)F)c(C#N)c2)n1	815478325	PBLBIGXPEMIULO-UHFFFAOYSA-N	427.364	1.284	50	20	IDGD	
O=C(NNc1ncncc1F)C(=O)Nc1ccc(CCn2nnc(-c3ccccc3)n2)cc1	815766178	PXJVYOVHEABGAM-UHFFFAOYSA-N	447.434	1.594	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@@H]1CSC(c2ccccc2O)=N1	816827839	HHMOOWVTZHTMSQ-ZDUSSCGKSA-N	447.542	1.317	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@@H]2CS[C@@H](Cc3ccccc3F)C(=O)N2)cc1OC	886540037	VOBHWLFNRBKOOF-YJBOKZPZSA-N	447.488	1.447	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)NC2CC2)cc1)NNC(=O)c1ccc([N+](=O)[O-])cc1	913471070	KXKISOPXLATBKV-UHFFFAOYSA-N	432.458	1.429	50	20	IDGD	
COc1ccc(-c2nn(CCC#N)cc2/C=C(/C#N)C(=O)N2CCNC(=O)C2)cc1OC	914749283	LRBMHRGQYOOHAR-YBEGLDIGSA-N	434.456	1.346	50	20	IDGD	
N#Cc1nc(C2CC2)oc1N1CCN(CC(=O)NNC(=O)c2cccc(Cl)c2)CC1	914851186	BXRAZGAFCJQJOA-UHFFFAOYSA-N	428.880	1.660	50	20	IDGD	
O=C(O)COc1ccc(S(=O)(=O)NNC(=O)c2ccc(Br)s2)cc1	915184934	NMWKDINIFXLCJJ-UHFFFAOYSA-N	435.277	1.597	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)c1nnc2ccccn12	916221982	NEJWSVQJYIRNSJ-QGZVFWFLSA-N	436.520	1.333	50	20	IDGD	
CNS(=O)(=O)c1ccc(CNC(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)s1	916233162	QYEMSUPXENRORR-UHFFFAOYSA-N	426.564	1.703	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)NCc2ccc(N3CCO[C@H](C)C3)nc2)c1	916393013	QFBFIZBBVAIIDS-QGZVFWFLSA-N	427.505	1.833	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)CNC(=O)c2ccc(Br)s2)c1	916724555	BKDBEPHHCKYIBG-UHFFFAOYSA-N	425.308	1.768	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2cc(C)ccc2F)c1	917718323	SMMQONCFTIDZLD-UHFFFAOYSA-N	443.522	1.788	50	20	IDGD	
O=C(NCC(F)(F)F)NNC(=O)c1cccc(S(=O)(=O)NCc2cccs2)c1	918707063	MVZGZJZTCCOCCR-UHFFFAOYSA-N	436.437	1.733	50	20	IDGD	
CSCC[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)NNC(=O)NCC(F)(F)F	918707208	GQOYVGYTKOHQLO-NSHDSACASA-N	437.400	1.339	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)CCNS(=O)(=O)c1ccccc1Cl	919820310	SDYWSLZOCJNKIT-UHFFFAOYSA-N	425.894	1.407	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@H]2CCCN2Cc2ccccc2)cc1	919963404	LDWYAIUZBVMZTG-HXUWFJFHSA-N	444.557	1.428	50	20	IDGD	
COC(=O)c1cc(NC(=O)NNC(=O)COc2ccc(OC)cc2)cc(C(=O)OC)c1	920930955	XMFIIGDNDQJFHQ-UHFFFAOYSA-N	431.401	1.500	50	20	IDGD	
COc1ccc(NC(C)=O)cc1S(=O)(=O)NNC(=O)c1cncn1-c1ccccc1	1317710801	MDMWZUPZMJCFAY-UHFFFAOYSA-N	429.458	1.463	50	20	IDGD	
O=C(CNC(=O)c1cc2ccccc2[nH]1)NNC(=O)c1cc(Br)ccc1O	1318907281	BWESYGPIOHEONA-UHFFFAOYSA-N	431.246	1.827	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCc2ccc(Br)o2)c2ccccc2c1=O	1324330298	KHYSUPCCGJJJFQ-UHFFFAOYSA-N	434.250	1.916	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4nccn4c3)C2)C1	1778011830	PVUJEFRKYQQFID-AUUYWEPGSA-N	435.322	1.809	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(Cl)c4nncn4c3)C2)C1	1778948331	UKHXJYXOPPTCJN-RDTXWAMCSA-N	442.303	1.080	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccncc2O)C1	1779614716	BERCLCNNKYXDSY-URKNILKWSA-N	440.338	1.946	50	20	IDGD	
COC(=O)C1(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@](C)(Cl)CCl)C2)CC1	1780717193	YOMISLKYGDPPQE-JEBQAFNWSA-N	435.348	1.690	50	20	IDGD	
C[C@H](C(=O)N1CCO[C@]2(CCN(C(=O)[C@@](C)(Cl)CCl)C2)C1)n1cccc1C=O	1781226833	AUOUNAMQYWYSGU-MDASCCDHSA-N	430.332	1.928	50	20	IDGD	
C[C@H](Nc1cccnc1)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@](C)(Cl)CCl)C2)C1	1781227192	IBBHIULKMGCCMD-ZOCIIQOWSA-N	429.348	1.948	50	20	IDGD	
COc1cc(F)ccc1CC(=O)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781337732	VEYATKZILSJLKX-FUHWJXTLSA-N	447.276	1.897	50	20	IDGD	
COC(=O)C12CC(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)C(Cl)Cl)C4)(C1)C2	1781962607	ZVZKNPLJMXFANM-MLHVSEJTSA-N	433.332	1.647	50	20	IDGD	
O=C(c1cc2ncccc2[nH]1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1782211641	XHYQFMHUADJOAH-RHSMWYFYSA-N	425.258	1.697	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H]3[C@@H](O)CCN3Cc3ccccc3)C2)C1	1782813032	WMQJMDJVZSLVEK-NVJIOZQYSA-N	449.979	1.469	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cc(OC)n(C)n3)CCO2)C1	1783351261	HFROLWZFHLHOKL-SJKOYZFVSA-N	429.315	1.046	50	20	IDGD	
Cc1noc(C)c1CCC(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](C)Br)C2)C1	1783532571	PRNFZJDMCSJCFF-XIKOKIGWSA-N	428.327	1.837	50	20	IDGD	
Cc1nc[nH]c1CSCC(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](C)Br)C2)C1	1783533579	AMHCDJYUHCNSLN-SJCJKPOMSA-N	445.383	1.565	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H]1CCc3ccccc3O1)CCO2	1783539240	GYVZSZIPBAMJQA-JNAXZKDPSA-N	437.334	1.994	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)Cc3ccc(OC)cc3Cl)CCO2)C1	1783873762	UISISQQFLJMPHC-XLIONFOSSA-N	445.343	1.975	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCO[C@]2(CCN(C(=O)C3CC(=O)C3)C2)C1	1785408899	ACWYBIQHSKKCIX-RWHUQTJRSA-N	429.423	1.681	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnn(C)c3C)[C@H]2C1	1786186190	GMISSQVIHDDXOV-TUUVXOQKSA-N	427.343	1.495	50	20	IDGD	
CC[C@H](C)[C@@H](O)C(=O)Nc1ccc(C2(NC(=O)c3cnccc3C(=O)NN)CCC2)cc1	1786401905	ZWJVADLMMUAFRA-IFXJQAMLSA-N	439.516	1.840	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C[C@H](N)c3cccnc3)[C@H]2C1	1786932081	RAMINNYXKUHQGV-VFTHGPRRSA-N	439.354	1.235	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3F)[C@H]2C1	1787196613	ZHPREGRWLDTRPR-ZIEJDFEHSA-N	428.302	1.988	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3csc4c3CCCO4)[C@H]2C1	1787260423	RTJYQZUCYSBMNB-CSFVBSKPSA-N	442.965	1.920	50	20	IDGD	
Cc1c(C(=O)Nc2ccc(C3(NC(=O)c4cccc(B(O)O)c4)CCC3)cc2)cnn1C	1787509340	CAZNUDHAQGWQIG-UHFFFAOYSA-N	432.289	1.470	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3c(Br)cnn3C)[C@H]2C1	1787777867	QPISAVMSLVBKJW-VTPLQMEGSA-N	447.761	1.793	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc([N+](=O)[O-])[nH]3)C[C@@H]21	1789872733	VMKHRJAMTRANCS-BTIUKSQHSA-N	433.292	1.753	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3CCC(CO)CC3)C[C@@H]21	1790957915	CTHKHACSQPYLNK-GNEWDUKKSA-N	445.398	1.938	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CC(F)(F)C(=O)O)C[C@@H]21	1790962166	VXIGMQNAVSRRKP-YFKTTZPYSA-N	441.269	1.250	50	20	IDGD	
CN1CCN(c2ccc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)[C@@H](O)CCl)cc2)CC1	1793105489	AMNJOEYDKNTXCJ-RNQOJCNYSA-N	434.968	1.290	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(C)(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](O)CCl)C1	1793111594	QZZPJGYHPDVVRC-LXTVHRRPSA-N	429.945	1.481	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2cnccc2n1	1796895873	QQVGKSYUUFREJN-MBMVNNNZSA-N	433.306	1.616	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc2ncccc2c1)c1cccc(B(O)O)c1	1797324228	QLWWHHCQSNCSPQ-WKCHPHFGSA-N	429.285	1.480	50	20	IDGD	
Cn1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CO[Si](C)(C)C)C3)c(C(F)(F)F)n1	1798111176	WDFGZRMGJNVPAR-JJLQDPRZSA-N	448.518	1.494	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnccc1C(=O)NN	1798440216	HOXUQJQSCWLOBA-MUJYYYPQSA-N	447.499	1.207	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc3ncccc3c1)C2	1798440448	RIWRPGWZXOCTEH-BCDXTJNWSA-N	444.495	1.799	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@](C)(Cl)CCl	1799279372	LIVSUSKTEQUZFF-ONQKKCPMSA-N	430.170	1.986	50	20	IDGD	
COC(=O)CCCCCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)Br	1800762950	LIGNFZMNZSPJSD-VWPFQQQWSA-N	433.343	1.483	50	20	IDGD	
O=C(CCc1c[nH]c2ccc(F)cc12)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2	1800840526	PLNFHESJPFIDND-VLBMKZOESA-N	437.899	1.429	50	20	IDGD	
CC[C@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cn1cc([N+](=O)[O-])cn1)C2	1801797928	FNVAJVYWISLVBN-OPDFLTKYSA-N	428.287	1.603	50	20	IDGD	
O=C(Cc1cccnc1Cl)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1	1804357969	ACJPVRMKNUEFCG-LZLYRXPVSA-N	437.327	1.978	50	20	IDGD	
Cc1cc(NC(=O)CC(=O)N2CCC3(CCCN(C(=O)[C@@H](O)CCl)C3)CC2)no1	1805523839	WSWGTRFLRWBPKQ-AWEZNQCLSA-N	426.901	1.143	50	20	IDGD	
O=C(CCBr)NC[C@@H]1CCN(C(=O)Cc2cnccn2)[C@@H]1c1cccnc1	1806343042	RNPRHAPMBUAKMJ-HNAYVOBHSA-N	432.322	1.905	50	20	IDGD	
CC(C)c1nc(CC(=O)N2CCCC3(CCN(C(=O)CCC(=O)NN(C)C)CC3)C2)no1	1806926200	HSCUMWAXPNJBRW-UHFFFAOYSA-N	448.568	1.340	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)CCc2ccco2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1	1807369851	XGKJAHVNTUIVCB-AUSIDOKSSA-N	447.300	1.307	50	20	IDGD	
Cn1nc(C(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)c2c1CCC2	1809359669	HPBOGRDUJPMBNK-POZUXBRTSA-N	431.924	1.223	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)c3cc(F)ccc3F)CC2)C1	1809969439	IDNLNBCQHCTOMN-UHFFFAOYSA-N	442.271	1.803	50	20	IDGD	
CCS(=O)(=O)CC(=O)N1CC[C@H](CNC(=O)CO[Si](C)(C)C)[C@H]1c1cccnc1	1810537932	QLJVDGZBMBFIIM-VQIMIIECSA-N	441.626	1.374	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2c3c(nn2C)CCC3)[C@H]1c1cccnc1	1812227367	XGPZGHUUKIKXNM-HHXXYDBFSA-N	445.951	1.877	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)COc2cccnn2)[C@@H]1c1cccnc1	1813033372	MGLDSJVCJRPDHJ-TXPKVOOTSA-N	433.896	1.210	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H]3CCC(=O)N3)sc2C1	1814061511	HDLYIOJVMMYKTQ-QXEWZRGKSA-N	429.340	1.507	50	20	IDGD	
COc1ncccc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1816430964	JYRWEZXAJKUUHS-GOSISDBHSA-N	449.276	1.113	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1CCc2nc(NC(=O)c3nc4ncccn4n3)sc2C1	1818306715	PDUFGALKAZRGMZ-LLVKDONJSA-N	445.581	1.658	50	20	IDGD	
Cc1ccncc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1	1818340134	WTQZJMFOCYJGTP-QGZVFWFLSA-N	427.509	1.792	50	20	IDGD	
CC(=O)N1CCN(CC(=O)Nc2cc([C@H]3CCCCN3C(=O)[C@H](F)Cl)[nH]n2)CC1	1818965801	YGKDHVFIHYDKQD-PBHICJAKSA-N	428.896	1.100	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(O)cc2)[nH]n1	1819403970	QDMBJOFFYJMDIT-GOSISDBHSA-N	449.471	1.734	50	20	IDGD	
O=C(C/N=C/c1ccco1)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1819477834	YIEQLZOMFXTYMJ-NZYROCMPSA-N	449.276	1.108	50	20	IDGD	
COC[C@@H](NC(C)=O)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CO[Si](C)(C)C)n[nH]1	1819595708	YLHXGYICAXFXCP-HZPDHXFCSA-N	439.589	1.404	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1)c1cnc2snnc2c1	1820150781	PSGFQAPCCCNZMA-STQMWFEESA-N	435.897	1.715	50	20	IDGD	
O=C([C@@H](O)CCl)N1CCC([C@H]2CCCCN2C(=O)Cn2nnc3ccccc32)CC1	1824849359	BXEDUKQZYFEZNG-MJGOQNOKSA-N	433.940	1.651	50	20	IDGD	
CN1N=C(C(=O)N2CCC([C@@H]3CCCCN3C(=O)CCBr)CC2)CCC1=O	1826353327	WKJCGOWNPHSDPK-INIZCTEOSA-N	441.370	1.999	50	20	IDGD	
CCOC(=O)C(C)(C)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](Cl)COC)CC2	1828215409	VHFOGNPXGQAQFV-MNOVXSKESA-N	431.942	1.898	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2nccnc2C(N)=O)CC1	1829511369	PILVYZJYTUVLME-LSDHHAIUSA-N	437.928	1.063	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccn3C)C2)C1	1830537341	DHZBCFRXKKUCFA-KBXCAEBGSA-N	428.327	1.126	50	20	IDGD	
Cc1cnoc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)CBr)CCO2	1830543142	KMQXMZILFARFIZ-PXAZEXFGSA-N	430.299	1.084	50	20	IDGD	
O=C(c1cc2c(s1)CCCC2)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1830730786	DTRUVUGWWRBCFY-YWZLYKJASA-N	442.965	1.297	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)Cc2ccccc2O)CC1	1831472934	ANGAJUWITAXZAU-HXUWFJFHSA-N	444.576	1.927	50	20	IDGD	
CC(C)(C)OC(=O)CC(=O)N1CCO[C@@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1	1831989953	BSDFUNZUXMAWPH-FQEVSTJZSA-N	444.601	1.026	50	20	IDGD	
O=C(COC1CCCCC1)NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1833217023	OXEOSLLGCUSJNI-LJQANCHMSA-N	429.989	1.507	50	20	IDGD	
CCOc1ccsc1C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)CCl)CC2)CC1	1833306323	BGLSYVRTTKPIMV-MRXNPFEDSA-N	443.997	1.932	50	20	IDGD	
Cc1cncc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)c1	1834287446	HDRXGFMSIGVGED-KDOFPFPSSA-N	426.311	1.243	50	20	IDGD	
CCCC(=O)NC1CCN(C2CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CC2)CC1	1834444073	YJVIZAGHQVIEJW-PCLIKHOPSA-N	430.553	1.492	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CCCSC3)C2)C1	1834826268	IGZPRTBCACDVEF-YOEHRIQHSA-N	435.384	1.371	50	20	IDGD	
O=C(Cc1ccccc1F)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1835005767	QEOVFPCZLKHXDF-AEFFLSMTSA-N	447.276	1.515	50	20	IDGD	
O=C(c1ccc2[nH]ccc2n1)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836717111	IPVNDFYPPIJGEW-LJQANCHMSA-N	434.924	1.775	50	20	IDGD	
CCC(=O)N[C@H](C)C(=O)N1CCC(OC2CCN(C(=O)CO[Si](C)(C)C)CC2)CC1	1836819079	YARRAUSRGDDIHX-MRXNPFEDSA-N	441.645	1.751	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)/C=N/N3CCCCC3)CCO2)C1	1837440707	UXTVZYHCKIAZPJ-NXOUIPOBSA-N	428.961	1.322	50	20	IDGD	
Cc1nc(C)c(C(=O)N2CCOC[C@@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)s1	1837712393	OTVYFGOKQSRMFY-LJQANCHMSA-N	441.626	1.681	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccoc3Cl)C2)C1	1837714880	QVXYGHZWOIAKFZ-SFHVURJKSA-N	430.961	1.855	50	20	IDGD	
CCc1cnc(C(=O)N2CCOC[C@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)s1	1837715427	PGTSQDCTXNBTPZ-IBGZPJMESA-N	441.626	1.627	50	20	IDGD	
COc1nc(C)ccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1838170608	RDAAIPPICXRVOT-NRFANRHFSA-N	439.940	1.734	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@H](OC(C)=O)C(C)C)CC2)CC1	1838360967	IQPIPCWGXKPWRU-RTBURBONSA-N	446.972	1.827	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccnc(F)c3)C2)C1	1839150192	FIKRSLODVWPIPE-MSOLQXFVSA-N	434.295	1.527	50	20	IDGD	
COc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)cc1	1839201824	KNFFOUBCESKWPW-QAPCUYQASA-N	445.285	1.456	50	20	IDGD	
CC(C)=NO[C@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1	1839227096	JLOGTAAWYONTHA-APWZRJJASA-N	429.590	1.095	50	20	IDGD	
O=C(Cc1ccc2c(c1)CCO2)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1839999844	XJCRTQZPTCRAOK-HXUWFJFHSA-N	443.327	1.424	50	20	IDGD	
O=C(c1cc2n(n1)CCCC2)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840188671	WPNZQFRONKOZKS-GOSISDBHSA-N	431.320	1.093	50	20	IDGD	
Cc1ccc(CCC(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)c(C)n1	1840337575	CFEKJJHTUCNCKL-AZUAARDMSA-N	427.904	1.622	50	20	IDGD	
COc1ccc(F)cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1840690903	JPUWILWOXXRVQD-SFHVURJKSA-N	435.279	1.708	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC12CN(C(=O)c1cc3n(n1)CCCN(C)C3)C2	1841289053	IBUDIZVYGAXZDE-AWEZNQCLSA-N	438.370	1.567	50	20	IDGD	
C[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1C(=O)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1	1841350360	XTSVFDTZYODNMF-OAGGEKHMSA-N	443.972	1.683	50	20	IDGD	
O=C(c1c[nH]c2ncc(C(F)(F)F)cc12)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1	1841351372	NKLSMERXQVCHHS-CYBMUJFWSA-N	430.814	1.998	50	20	IDGD	
CN(CC(=O)N1CCCC12CN(C(=O)[C@H](F)Br)C2)C(=O)c1ccccc1	1841522837	AEVUVBLMRNMPAC-HNNXBMFYSA-N	426.286	1.653	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C1	1841925431	UREWPXSQKABALN-OLZOCXBDSA-N	438.352	1.576	50	20	IDGD	
CN(CC(=O)N1CC2(CCCN2C(=O)C2CCCC2)C1)NC(=O)NCc1ccccc1	1842593406	ZKSPZMBLQJIOLE-UHFFFAOYSA-N	427.549	1.726	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)CNc2ccc(F)cc2)C1	1842886016	HHBLTHKUVLUJQL-CVKSISIWSA-N	440.479	1.575	50	20	IDGD	
CC#CC[C@@H](C(=O)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1)c1ccccc1	1843014322	XKWMLXAGEWWZBB-JOCHJYFZSA-N	430.313	1.381	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@H]2CN(C(=O)OC(C)(C)C)C[C@@H]2O)C1	1845104035	RQURVMHVDVGOTO-JYJNAYRXSA-N	443.972	1.825	50	20	IDGD	
COc1c(Br)cccc1C(=O)N1CCCC12CN(C(=O)[C@H](O)CCl)C2	1845324403	LWRXQWXWDQXNGB-CYBMUJFWSA-N	431.714	1.874	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)CN(C(=O)OC(C)(C)C)C1CC1)C2	1846359935	PASMCEDIZRDRBS-OAHLLOKOSA-N	429.945	1.843	50	20	IDGD	
COc1ccc(CCC(=O)N2CC3(CCCN3C(=O)CCC(=O)NN(C)C)C2)cc1OC	1846384207	QBJVAOPGPAFWCF-UHFFFAOYSA-N	446.548	1.213	50	20	IDGD	
CCn1c(NNC(=O)CS[C@@H](C)C(=O)Nc2cc(C)on2)nc2ccccc2c1=O	11155294	BEHIDVMIAVHIOO-LBPRGKRZSA-N	430.490	1.916	50	20	IDGD	
O=C(CN1C(=O)N[C@]2(CCc3ccccc32)C1=O)NNC(=O)c1cc(-c2ccccc2)on1	27260320	IRWDNDKGALEXID-QHCPKHFHSA-N	445.435	1.496	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc2c(c1)C(=O)NC2=O)c1cc2c(s1)CCCCCC2	111134656	WOSQCXBGEMPVIX-UHFFFAOYSA-N	433.511	1.914	50	20	IDGD	
Cc1ccc(CC(=O)N2CCN(C(=O)NNC(=O)c3cc(Br)c[nH]3)CC2)cc1	725859925	ICWOYWHEKSFSHI-UHFFFAOYSA-N	448.321	1.827	50	20	IDGD	
O=C(C[C@H](c1ccccc1)N1CCOC1=O)NNC(=O)C1CCN(c2ncccn2)CC1	728846118	LVQIGPIGDBSXJH-GOSISDBHSA-N	438.488	1.424	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)N2CCN(C(=O)COc3ccc(F)cc3)CC2)c1	728952812	FRISEFPRNNRMOU-UHFFFAOYSA-N	425.420	1.275	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)[C@H]1CS[C@@H](Cc2ccccc2F)C(=O)N1	729450931	AZQHHWDVNJYXIM-MJGOQNOKSA-N	440.500	1.771	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)c2ccccc2O)cc1Br	729511797	UPMSFBRFCGZLCY-UHFFFAOYSA-N	442.291	1.480	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc2c(c1)C(=O)NC2=O)c1ccc(Br)s1	731595377	UOLFUMLYJYRZJY-UHFFFAOYSA-N	430.261	1.018	50	20	IDGD	
Cc1c(C(=O)NNC(=O)CCN2C[C@H](C)O[C@@H](C)C2)nnn1-c1ccc2ncccc2c1	732258930	IQYJFTZLTOCVCZ-GJZGRUSLSA-N	437.504	1.384	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)c2cccc(CSc3nccn3C)c2)C[C@@H](C)O1	732263109	JVXNHWBZYXHJER-HZPDHXFCSA-N	431.562	1.973	50	20	IDGD	
O=C(NNc1cnccn1)C1CCN(S(=O)(=O)c2ccc(Br)s2)CC1	734242448	HYINQONNLYIQSL-UHFFFAOYSA-N	446.352	1.845	50	20	IDGD	
CN1CCC(N2CC[C@@H](NC(=O)NNc3ccc(S(=O)(=O)C(F)(F)F)cc3)C2)CC1	734284090	QSRPHYZDEAOIPO-CQSZACIVSA-N	449.499	1.775	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)c2ccc(Cn3cccn3)o2)CC1	734826013	SXBBNGFDUWSZBO-UHFFFAOYSA-N	432.481	1.868	50	20	IDGD	
COc1ccc(S(=O)(=O)C[C@H](C)C(=O)NNC(=O)Cc2c[nH]c3ccccc23)cc1	735028733	NXSNRDYLLRFEDM-AWEZNQCLSA-N	429.498	1.976	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1ccc(N2CCC(O)CC2)cc1	735836147	DZDXJGQURCPNLN-UHFFFAOYSA-N	445.545	1.324	50	20	IDGD	
C[C@H]1CN(Cc2cccc(CNC(=O)NNC(=O)COCc3ccccc3)c2)CCO1	738460042	KPPKZSUSEREKHT-SFHVURJKSA-N	426.517	1.955	50	20	IDGD	
O=C(CCCc1nc(C2CC2)no1)NNC(=O)CCN1CCN(c2ccccc2)CC1	739675489	AJUWOUJMTVUFBP-UHFFFAOYSA-N	426.521	1.629	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)C(=O)NCc1ccc(F)cc1	742037219	UGOONTQFEKAKMW-NSHDSACASA-N	438.253	1.819	50	20	IDGD	
Cc1ccccc1-n1c(=O)c2ccccc2n2c(SCC(=O)NNC(=O)C3CC3)nnc12	742447841	LNLVNLXIWKOWBX-UHFFFAOYSA-N	448.508	1.991	50	20	IDGD	
C/C(=C\C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)C(C)(C)C	742487180	LPZRZDZIGRBFJG-FOCLMDBBSA-N	437.562	1.780	50	20	IDGD	
CCCCCCOc1ccc(C(=O)NNC(=O)CN2C(=O)[C@H]3[C@H]4CC[C@@H](O4)[C@@H]3C2=O)cc1	742516728	HZUKGFSJBFLTKX-JYBIWHBTSA-N	443.500	1.569	50	20	IDGD	
C[C@@H](CC(=O)NNC(=O)NCCc1cccs1)/N=C1/NS(=O)(=O)c2ccccc21	742582997	GZCCALZHVBHHDW-LBPRGKRZSA-N	435.531	1.138	50	20	IDGD	
COc1ccc(N2CCN(CCNC(=O)NNc3ccc(-n4cccn4)nn3)CC2)cc1	743362986	MRBKYYGWJFIFHQ-UHFFFAOYSA-N	437.508	1.119	50	20	IDGD	
O=C(NCCOc1ccc(Br)cc1)NNC(=O)[C@H]1COc2ccccc2O1	744296026	NTBGTTFOEIKXAM-MRXNPFEDSA-N	436.262	1.998	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)CC12CC3CC(CC(C3)C1)C2)N1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O	744352858	QEQCGUBSQYXIKG-RTFMJOIVSA-N	429.517	1.291	50	20	IDGD	
O=C(NNC(=O)c1sccc1S(=O)(=O)N1CCCC[C@@H]1CCO)c1ccccc1	745475233	BFZLGCZSHZIWIL-OAHLLOKOSA-N	437.543	1.749	50	20	IDGD	
COC[C@@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)C(C)C	745848530	HXPNUXIASOKOJR-QGZVFWFLSA-N	426.539	1.476	50	20	IDGD	
C[C@H]1C[C@@H](NC(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)CCN1C	745856230	BWMONCFWSXRLDA-JXFKEZNVSA-N	448.531	1.815	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2cc(C#N)ccc2F)c1	745890803	BFMFZWUXEGTOAE-UHFFFAOYSA-N	447.492	1.872	50	20	IDGD	
Cc1nn(C)c2sc(C(=O)N[C@@H](C)C(=O)NNC(=O)Cc3cn4ccccc4n3)cc12	746637015	KCOUNESOGCEUTN-LBPRGKRZSA-N	439.501	1.099	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)c1cc(S(N)(=O)=O)ccc1O	747337832	UHWDQHOJTJGHAB-UHFFFAOYSA-N	432.483	1.546	50	20	IDGD	
CC(C)[C@H](NS(=O)(=O)c1ccc2ccccc2c1)C(=O)NNc1nccn(C)c1=O	747938098	POJRBQOTVASIPJ-KRWDZBQOSA-N	429.502	1.380	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)N[C@@H]1CCN(CCCc2ccccc2)C1=O	750266037	GZURGDBBLWQULM-GOSISDBHSA-N	440.500	1.638	50	20	IDGD	
Cc1ccc(S(=O)(=O)NNC(=O)CNC(=O)c2cccs2)c(Br)c1	751281093	ZIJMGRLPLRKQHT-UHFFFAOYSA-N	432.321	1.559	50	20	IDGD	
CCc1ccc(C(=O)NNC(=S)N[C@@H](C)C2CC2)cc1S(=O)(=O)N1CCOCC1	751618700	JKGHVLPKSNNOLQ-ZDUSSCGKSA-N	440.591	1.177	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)N[C@H]1CCN(Cc2ccc(C#N)cc2)C1=O	753033583	RDCCKENWNOKTND-KRWDZBQOSA-N	431.456	1.260	50	20	IDGD	
CC(C)(C)OC(=O)NC1(CNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)CCC1	753334920	PKDAEWBTNNNHDX-UHFFFAOYSA-N	447.540	1.471	50	20	IDGD	
O=C(NCCc1csc(-c2ccccc2)n1)NNC(=O)c1ccc(-n2cnnn2)cc1	753955896	RITQDJFSHMZYFN-UHFFFAOYSA-N	434.485	1.973	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@@H]2[C@H]3CCO[C@@H]3C23CCCC3)c2ccccc2c1=O	755076949	DIJKBTXJUMVAQX-NXHRZFHOSA-N	425.489	1.708	50	20	IDGD	
CS(=O)(=O)Cc1nc2ccccc2n1CC(=O)NNc1ccc(C(F)(F)F)nn1	755183619	QGMHZVFDGSQUNK-UHFFFAOYSA-N	428.396	1.533	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@H](C(=O)NNC(=O)Cc3cc[nH]n3)C2)c2ccccc12	755284047	JFMYSFLSWYCTSP-HNNXBMFYSA-N	435.484	1.814	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)Nc1cccc(S(=O)(=O)NC2=NCCCCC2)c1	755496572	WGQHOFSLYIFREA-UHFFFAOYSA-N	444.517	1.728	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)Nc2cccc(S(=O)(=O)N3CCN(C)CC3)c2)c(O)c1	756213687	ZTLPHGRTVPDKSE-UHFFFAOYSA-N	447.517	1.103	50	20	IDGD	
CCc1ccc(NC(=O)NNC(=O)[C@@H](C)Oc2ccc(C(C)=O)cc2)cc1S(N)(=O)=O	756526125	SKKODKRACVHHLG-CYBMUJFWSA-N	448.501	1.719	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)N[C@H]2CCN(c3ccccc3OC)C2=O)c1	757288509	ZYOUOIQBBNSVQJ-INIZCTEOSA-N	428.445	1.462	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2ccc(OC)c(OC)c2)ccc1Cl	757472462	HZQNKXXUMQDGJC-UHFFFAOYSA-N	428.850	1.767	50	20	IDGD	
COc1ccc(CNC(=O)NNC(=O)C(=O)Nc2ccccn2)cc1OC1CCCC1	758743491	KJKBEIRNCUSXLF-UHFFFAOYSA-N	427.461	1.881	50	20	IDGD	
CCO[C@@H]1C[C@H](NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)[C@]12CCCO2	760141245	HKCMONULQSRVBQ-MIZPHKNDSA-N	445.564	1.256	50	20	IDGD	
Cc1ccnc(-n2nccc2NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)c1	760276240	AUXLEECWDAOEGI-CYBMUJFWSA-N	426.408	1.268	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)[C@](C)(O)CN2C(=O)C(C)(C)c3ccccc32)nc1C	760490330	NWJSYBRTRVUOLP-JOCHJYFZSA-N	441.488	1.480	50	20	IDGD	
COc1cc(Br)cc(S(=O)(=O)NNC(=O)COCc2ccccc2)c1	760516541	ZFONEHCELIBPCI-UHFFFAOYSA-N	429.292	1.984	50	20	IDGD	
CCC(CC)[C@H](C)C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	761215341	OWMIIKIRFYURQB-INIZCTEOSA-N	439.578	1.860	50	20	IDGD	
O=C(COC(=O)c1cnc(-c2cccnc2)s1)NNC(=O)[C@H]1COc2ccccc2O1	761611246	PPOUHVBTPJKRIR-OAHLLOKOSA-N	440.437	1.349	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3c(C)nc4ccnn4c3C)CC2)cc1	761953321	QTMHLCBVMSCDIV-UHFFFAOYSA-N	435.532	1.233	50	20	IDGD	
COc1cc(Br)cc(NC(=O)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c1	763471325	HUSHVNVIXSHDKA-UHFFFAOYSA-N	437.206	1.766	50	20	IDGD	
CCOC(=O)c1cnn(-c2ccc(NC(=O)C(=O)NNC(C)=O)cc2)c1C(F)(F)F	763515473	NDCCPPDXXXLHCK-UHFFFAOYSA-N	427.339	1.174	50	20	IDGD	
Cc1cc(S(C)(=O)=O)ccc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccccc2)[nH]n1	763605720	SBUOAKSDSSUFPC-UHFFFAOYSA-N	441.469	1.188	50	20	IDGD	
COC(=O)c1cc(Cl)ccc1NC(=O)C(=O)NNC(=O)c1c(C)nc2ccccn12	763628673	DRUCENYUMLUXPH-UHFFFAOYSA-N	429.820	1.482	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cnc(-c2ccccc2)s1	763663881	ZJPMEHGLKOBNQG-UHFFFAOYSA-N	426.454	1.984	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)C(=O)Nc1ccccc1OC(F)(F)F	763791892	ZSTQCKMINRQMBX-UHFFFAOYSA-N	435.318	1.634	50	20	IDGD	
CO[C@@H]1Cc2ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc3cccc(C)c3C)cc2C1	763840253	JWNGNAQWEOBVKD-DNVCBOLYSA-N	425.485	1.970	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)ccc1C(=O)NC(C)C	763866183	URYMKFYCNNUKNF-CQSZACIVSA-N	444.463	1.826	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(C(C)=O)cc2)cc(OC)c1	763872585	OTDRFUBHOPOETR-CYBMUJFWSA-N	429.429	1.460	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(NC(=O)OC)c2)cc1OC	763902634	VUJKKDURKNLXTO-UHFFFAOYSA-N	430.417	1.672	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)C[C@@H](OC)C3)cc1OC	763911901	QMFJCOHCNCQOKW-SFHVURJKSA-N	441.484	1.997	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(OC(C)C)c(OC)c2)c(OC)c1	763916930	ZGVGFLMGCALWSS-UHFFFAOYSA-N	431.445	1.899	50	20	IDGD	
O=C(Cc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1ccccc1CN1CCNC1=O	763936702	PNHFBRJKFKMJKC-UHFFFAOYSA-N	429.864	1.194	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)on1)C(=O)Nc1ccc(-n2cncn2)c(F)c1	764015865	ABSUPAQSKVELNQ-UHFFFAOYSA-N	435.375	1.461	50	20	IDGD	
COC(=O)[C@H]1CN(C(=O)C(=O)NNC(=O)c2ccc3ccccc3c2)c2ccccc2O1	764061874	OFWBYFSIEVXJMT-LJQANCHMSA-N	433.420	1.568	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2sc3c(c2C(=O)OC(C)C)CC[C@@H](C)C3)n[nH]1	764105882	ANZJNPZWPHAGRP-SNVBAGLBSA-N	447.517	1.869	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2O1)C(=O)Nc1ccc(OCCc2ccccc2)nc1	764153173	JQHAOYFGWYJMTL-HXUWFJFHSA-N	446.463	1.793	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)C(=O)N2CCc3cc(Br)cc(F)c32)cc1	764177745	PVFMEFLDVUHPET-UHFFFAOYSA-N	431.221	1.810	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)C(=O)Nc1ccc(OC[C@@H]2CCCO2)cc1	764242024	AEDLYQLMBQHXRC-IBGZPJMESA-N	436.468	1.985	50	20	IDGD	
Cc1cc(C(=O)N2CCC[C@H](C)C2)ccc1NC(=O)C(=O)NNC(=O)Cc1ccccn1	764267252	FXCOATZBCVAFPV-HNNXBMFYSA-N	437.500	1.591	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)c(Cl)c1)C(=O)Nc1ccc(N2CCSCC2)cc1	764345892	LJUPDSNZUWKEQO-UHFFFAOYSA-N	434.905	1.999	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2cccs2)[nH]n1)C(=O)N1C[C@H]2CCCN2c2ccccc21	764383203	YDXVGJAICVNSNI-CYBMUJFWSA-N	436.497	1.915	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)c(F)cc1F	764404509	KPKHAEMREOLVCJ-UHFFFAOYSA-N	439.396	1.335	50	20	IDGD	
CCc1cccc(S(=O)(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)c1	765117142	BEVBDVGDBJXFFU-UHFFFAOYSA-N	430.530	1.017	50	20	IDGD	
Cc1ccc([C@H](C)[C@@H](O)C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)cc1	765129085	YJNZXQHBBXUBTI-OXJNMPFZSA-N	433.530	1.624	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)Nc3ccccc3)CC2)cc1	765313527	SLVFNYHOLMFUIG-UHFFFAOYSA-N	431.518	1.154	50	20	IDGD	
CNC(=O)[C@@H]1CCC[C@H]1NC(=O)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1	765667019	VITPHOSDKNBQIZ-VSKRKVRLSA-N	449.555	1.859	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)[C@@H]1CCC[C@@H](C(F)(F)F)C1	765731813	BYEMPLJTOGFGGR-IAGOWNOFSA-N	440.466	1.961	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)COc3ccccc3[N+](=O)[O-])CC2)cc1	765747793	GYYIAESZUYHTOX-UHFFFAOYSA-N	441.488	1.247	50	20	IDGD	
NC(=O)Nc1cccc(C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)c1	765753170	XCJMBTBHRZFOEQ-UHFFFAOYSA-N	444.923	1.409	50	20	IDGD	
Cc1c(C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cnn1C1CCOCC1	766990598	MBQOJYUVSCPAFS-UHFFFAOYSA-N	431.405	1.069	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)[C@@H](C)NS(=O)(=O)c2cccc(C#N)c2)cc1	767888945	IECXJCIXKBLIJP-CQSZACIVSA-N	430.486	1.014	50	20	IDGD	
CCNC(=O)N(C)NC(=O)[C@H]1Cc2ccccc2CN1S(=O)(=O)c1ccc(C)cc1	768408702	AJNZTWUSXWKBLM-LJQANCHMSA-N	430.530	1.803	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCc2cscn2)c1	769193544	NTDUWIPDRFNFIP-UHFFFAOYSA-N	425.536	1.360	50	20	IDGD	
CC(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c1	770210055	YLOFUKVRVWCMCE-UHFFFAOYSA-N	428.470	1.190	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)[C@@H]3CCCN(C(=O)c4ccc(Cl)cc4)C3)nc21	770990260	MXYDVBVATCXDER-GFCCVEGCSA-N	429.868	1.718	50	20	IDGD	
CCNS(=O)(=O)[C@@H]1CCN(C(=O)/C(C#N)=C\c2cc(C)n(C[C@@H]3CCCO3)c2C)C1	771402389	FEGSYTBUHBBMAZ-OHBNSYPMSA-N	434.562	1.731	50	20	IDGD	
COc1ccc(C(=O)NNc2nccnc2C(C)C)cc1S(=O)(=O)N1CCOCC1	772889497	CRVSAWUDTPEYJE-UHFFFAOYSA-N	435.506	1.386	50	20	IDGD	
CCNC(=O)C(C)(C)CNC(=O)NNC(=O)[C@H](C)Oc1cccc(Br)c1	772973649	BSVHECTYWYOODZ-NSHDSACASA-N	429.315	1.709	50	20	IDGD	
CCCCn1cc(CNC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)c(C)n1	773451197	YFCUIMACDFZVRL-UHFFFAOYSA-N	435.554	1.737	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccc([S@@](C)=O)c(F)c1	774010419	VJMPZNBCXLBBLN-XUQHIXODSA-N	441.868	1.770	50	20	IDGD	
O=C(CN1CCNC(=O)[C@H]1c1cccc(Br)c1)NNC(=O)c1ccccc1	777716804	MWCQJOMFCPMBIN-QGZVFWFLSA-N	431.290	1.383	50	20	IDGD	
COC(=O)c1ccccc1NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	777773105	HVMCWONOTWOHPF-UHFFFAOYSA-N	447.513	1.570	50	20	IDGD	
C[C@H](C(=O)N1CCN(S(=O)(=O)CBr)CC1)N1CCc2ccccc2C1	777777915	SOMQTDRDHVPYRY-CQSZACIVSA-N	430.368	1.260	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)c2cnn(CC(=O)NC3CCCCC3)c2)nc1C	778429282	JSLHRHGHCDJNHC-UHFFFAOYSA-N	429.481	1.364	50	20	IDGD	
CCOC(=O)c1sc([C@@H](C)NC(=O)NNC(=O)CNC(=O)OC(C)(C)C)nc1C	778701102	KYLFRFPHLHDRCO-SNVBAGLBSA-N	429.499	1.544	50	20	IDGD	
C[C@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1NC(=O)NNC(=O)c1nnc(O)c2ccccc12	779715457	ZJVBIAHVHVWPJI-SWLSCSKDSA-N	444.492	1.925	50	20	IDGD	
CCOC(=O)c1cnn(-c2cccc(NC(=O)C(=O)NNc3ncncc3Cl)c2)c1C	782159908	YPFOZRCGQHQLFE-UHFFFAOYSA-N	443.851	1.883	50	20	IDGD	
CC(=O)Nc1ccc(NC(=O)C(=O)NNc2ccc(-n3cccn3)nn2)c(C(F)(F)F)c1	783437379	ZTVUVDYQZLWMPI-UHFFFAOYSA-N	448.365	1.721	50	20	IDGD	
Cn1cc(Br)cc(NC(=O)C(=O)NNc2ccc(Br)cn2)c1=O	784339465	KSFRIPYOEVGGMT-UHFFFAOYSA-N	445.071	1.387	50	20	IDGD	
COc1cc(C(=O)N(C)C)ccc1NC(=O)C(=O)NNc1cccc(C(F)(F)F)n1	784951258	GUYVCNSFUQWFTP-UHFFFAOYSA-N	425.367	1.893	50	20	IDGD	
CC(C)(C)[C@@H]1CCc2nc(NC(=O)C(=O)NN[C@]3(C)CCS(=O)(=O)C3)sc2C1	789751291	VLASUXMOZMCUJH-ADLMAVQZSA-N	428.580	1.431	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)[C@H]2CCS(=O)(=O)c3ccccc32)n[nH]1	791054756	QLOZAUIBBIUOLX-AWEZNQCLSA-N	440.481	1.808	50	20	IDGD	
CC(C)(C)OC(=O)CCc1cccc(NC(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)c1	791910813	UAIMGGUCPHFEQQ-CQSZACIVSA-N	425.507	1.548	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)[C@H](C#N)Cc2ccc(C#N)cc2)c2ccccc2c1=O	792017080	XIMKPBKVDHOERL-KRWDZBQOSA-N	428.452	1.993	50	20	IDGD	
C[C@@](O)(Cn1cc(C(F)(F)F)ccc1=O)C(=O)NNC(=O)c1cnn(-c2ccccc2)c1	792171722	SWBZZWYGFHWNQB-LJQANCHMSA-N	449.389	1.265	50	20	IDGD	
COc1ccc(Cn2cc(NC(=O)C(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)cn2)cc1	793022866	DIPNVBVRPNLWMI-UHFFFAOYSA-N	438.400	1.248	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C[C@H]1COCCN1C(=O)OC(C)(C)C	794760118	NVUKPXXWYOSXOO-HNNXBMFYSA-N	437.493	1.638	50	20	IDGD	
CNS(=O)(=O)N1CCC(C(=O)NNC(=O)[C@H](C)Oc2c(C)cc(Cl)cc2C)CC1	794791250	RMDMZXHQOAMNBY-ZDUSSCGKSA-N	446.957	1.048	50	20	IDGD	
C[C@@H](C(=O)NNc1ccccc1S(=O)(=O)N(C)C)c1ccc(S(C)(=O)=O)cc1	795182423	VGBHNHKQRAWEBF-CYBMUJFWSA-N	425.532	1.587	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2ccc(C)c(S(=O)(=O)NCC#N)c2)c2ccccc2n1	799010937	WHMVRSNTRTZDNG-UHFFFAOYSA-N	437.481	1.728	50	20	IDGD	
NC(=O)CC[C@H](NC(=O)CCC1CCCC1)C(=O)NNc1ccc2c(=O)[nH]ccc2c1	803431875	HYJDGGJWJJILBV-SFHVURJKSA-N	427.505	1.692	50	20	IDGD	
NS(=O)(=O)c1ccc(NC(=O)NNC(=O)COc2cccc(C(F)(F)F)c2)cc1	804030364	GLNVZXYEIAATPW-UHFFFAOYSA-N	432.380	1.585	50	20	IDGD	
COC(=O)N(C)NC(=O)[C@@H](CCS(C)(=O)=O)NC(=O)c1ccc(C(C)(C)C)cc1	804125018	XFXUOBXBOXUHBK-OAHLLOKOSA-N	427.523	1.247	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N2CCOC[C@H]2[C@@H]2CCCO2)cc1Br	805104485	SRDJBXRFJNEOID-ZFWWWQNUSA-N	428.283	1.692	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccc(F)cc1OC1CCOCC1	806974315	DYBKTCQRCSJCIE-UHFFFAOYSA-N	449.410	1.688	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(C(=O)N(C)CC)c2)cc1OC	806975143	OYZYDSQCKNTQMI-UHFFFAOYSA-N	442.472	1.586	50	20	IDGD	
Cc1ccc(Sc2nsc(NC(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)n2)cc1	810244981	MBZPVIVMSMPKSM-VIFPVBQESA-N	430.537	1.088	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1)NNC(=O)Cc1ccccc1F	810373404	SRJNLVLOVWXFND-UHFFFAOYSA-N	449.382	1.393	50	20	IDGD	
NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2)c(OCC(F)F)c1	810385542	TUAGUKMKSCOQCC-UHFFFAOYSA-N	440.790	1.483	50	20	IDGD	
CC[C@H]1[C@H](C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)CCN1C(=O)OC(C)(C)C	810619047	LAAYZUVZHZSCMH-KGLIPLIRSA-N	443.545	1.877	50	20	IDGD	
COCCOCc1ccc(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)cc1	812525202	YUYUQZKRIIPUDG-UHFFFAOYSA-N	449.529	1.627	50	20	IDGD	
COCC1(CNC(=O)NNC(=O)c2ccc(OC)c(Br)c2)CCOCC1	813772100	SDTGZDYJFQGFFZ-UHFFFAOYSA-N	430.299	1.845	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2ccc[nH]2)nnn1Cc1ccc(C(F)(F)F)cc1	815566780	FNMKFBKORSSQIR-UHFFFAOYSA-N	435.366	1.381	50	20	IDGD	
Cc1c(C(=O)NNc2ccccc2S(=O)(=O)NC(C)(C)C)nnn1-c1ccn(C)n1	815854677	LVAIYNXIUKCDIP-UHFFFAOYSA-N	432.510	1.143	50	20	IDGD	
Cc1ccc(CN2C(=O)CC[C@H]2C(=O)NNc2ccccc2S(=O)(=O)N(C)C)cc1	817052596	ICSHECXXGIHJTB-SFHVURJKSA-N	430.530	1.880	50	20	IDGD	
COc1cccc(/C=C(\C(=O)NNC(=O)COc2ccccc2OC)n2nnnc2C)c1	818023554	MLEWCNSZIKGVRP-SFQUDFHCSA-N	438.444	1.223	50	20	IDGD	
CCn1c(S)nc2cc(C(=O)NNC(=O)CNc3ccccc3OC)ccc2c1=O	825643669	IIRKBLCLOMQEPQ-UHFFFAOYSA-N	427.486	1.587	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)CCNS(=O)(=O)c2ccc(C)c(C)c2)c1	825769648	ATZSUFNPWQPDJS-UHFFFAOYSA-N	434.518	1.240	50	20	IDGD	
CCOc1ccc(S(=O)(=O)Nc2cc(OC)c(OC)cc2C(=O)NNC(C)=O)cc1	893658838	TURGRGXCNWRAGP-UHFFFAOYSA-N	437.474	1.684	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)OCC(=O)NC2CCN(C(C)=O)CC2)c1C	897556945	BGWCUOTWSYEKLU-XDHOZWIPSA-N	430.505	1.329	50	20	IDGD	
CS(=O)(=O)c1cccc(S(=O)(=O)NNC(=O)c2ccc(Br)s2)c1	903959045	WJFFOFOQTLJCED-UHFFFAOYSA-N	439.334	1.537	50	20	IDGD	
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC(=NNC(=O)[C@@H](C)CN2CCCCCC2)CC1	914555252	MDSWCSHFNDNCIC-HNNXBMFYSA-N	438.598	1.795	50	20	IDGD	
COc1ccnc(NNC(=O)C2CCN(S(=O)(=O)c3ccc(F)c(F)c3)CC2)n1	914763202	YPIFFIDHBRXKEV-UHFFFAOYSA-N	427.433	1.307	50	20	IDGD	
CC(C)CN1CCO[C@H](CNC(=O)NNC(=O)COc2ccc(Br)cc2)C1	915923196	YVTGHIYOTKEAAX-MRXNPFEDSA-N	443.342	1.515	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2ccccc2CN2CCOCC2)c1	915927348	JJDAJAKJMVYSDX-UHFFFAOYSA-N	446.529	1.067	50	20	IDGD	
C[C@@H]1CN(CCCNC(=O)NNC(=O)COc2ccc(Br)cc2)C[C@@H](C)O1	916249830	MVTXRPSHSHZEFH-ZIAGYGMSSA-N	443.342	1.658	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NC[C@H](c2cccc(C)c2)N2CCOCC2)cc1	916435610	IIOAMZOZVRUXBO-OAQYLSRUSA-N	442.516	1.786	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NCCN2CCN(c3ccccc3)CC2)cc1	916514888	SEFHOWWIVXSGAF-UHFFFAOYSA-N	427.505	1.227	50	20	IDGD	
CCCCN(C(=O)COC(=O)/C(C#N)=C/c1cccc(OC)c1)[C@@H]1CCS(=O)(=O)C1	916599481	RQAZKGLHDGZPAF-ZKTNYTPDSA-N	434.514	1.961	50	20	IDGD	
O=C(CSCc1ccccn1)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	916734718	NHHZNFZFCYDWAW-UHFFFAOYSA-N	434.543	1.561	50	20	IDGD	
Cc1[nH]c(-c2ccncc2)nc(=O)c1CC(=O)NNC(=O)c1cc(Br)c[nH]1	917939565	YPMOIFOBQBHCIX-UHFFFAOYSA-N	431.250	1.235	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)[C@@H]2CCCN(S(=O)(=O)CC)C2)cc1OC	918549752	FEJFWYBFOQDUOR-OAHLLOKOSA-N	427.523	1.307	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)N[C@H](C)CN2CCC[C@H](C)C2)nc1	919914346	GRGDKYBZDZCVMF-JKSUJKDBSA-N	426.587	1.859	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)CC(C)(C)C)N(S(C)(=O)=O)CC2	920596729	ZCRRCTGYXGDYOE-HNNXBMFYSA-N	441.550	1.536	50	20	IDGD	
N#C/C(=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)N1CCC(O)CC1	920853303	MZQNUPMSFGJUKK-RVDMUPIBSA-N	427.892	1.969	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)Nc2cccc(CN3CCC[C@H]3C(N)=O)c2)cc1	920940696	VJZSBADPWQOOOU-FQEVSTJZSA-N	439.516	1.930	50	20	IDGD	
O=C(NNC(=O)c1cncn1-c1ccccc1)N[C@@H](Cc1ccccc1)CN1CCOCC1	1318719003	QFTCOGJHDKCIHO-FQEVSTJZSA-N	448.527	1.760	50	20	IDGD	
C[C@@H](O)C(=O)NNC(=O)CN(Cc1ccccc1)S(=O)(=O)c1ccc(Cl)cc1	1324410092	TZUCSXDCTPVPRH-CYBMUJFWSA-N	425.894	1.059	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Cl)C1	1778030485	UGTHDMYZFRYUHF-BBNZOYGDSA-N	430.904	1.790	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)CCN3Cc4ccccc4C3=O)C2)C1	1778187110	UIPYRKUVDDNFID-XMSQKQJNSA-N	449.935	1.116	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)NC(=O)NCC)C1	1779315912	XBYCAQWZTXRLHV-QCBUCWTNSA-N	430.977	1.615	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cccc(C#N)c3Cl)C2)C1	1780192120	GGPUJSGUJCDAOQ-DNVCBOLYSA-N	426.300	1.909	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)CN1CCCCC1)C2)[C@@H](F)Br	1780771987	YFNBEZICUVOPOV-QGPMSJSTSA-N	434.350	1.677	50	20	IDGD	
Cc1cccc(/C=C/C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](F)Br)C3)C2)n1	1781325055	IIJRYTXVSPTXFS-OZZQIWQLSA-N	426.286	1.924	50	20	IDGD	
O=C(c1n[nH]c2c(F)cccc12)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781332182	VHZUWPYAYIVQSN-WMLDXEAASA-N	443.248	1.836	50	20	IDGD	
O=C(c1n[nH]c2ccc(F)cc12)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781332430	YKGKJSFDRFJPAF-WMLDXEAASA-N	443.248	1.836	50	20	IDGD	
Cc1cc(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](C)Br)C2)nn1C	1781997078	BPBHRNHDMMKPFJ-IDHHARJASA-N	441.370	1.568	50	20	IDGD	
Cc1nc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)C(Cl)Cl)C2)c(=O)[nH]c1C	1782216536	YJXNKYPZYDNZOE-KZULUSFZSA-N	431.320	1.318	50	20	IDGD	
O=C([C@@H](O)CCl)N1CCO[C@@]2(CCN(C(=O)C3(c4ccc(Cl)cc4)CC3)C2)C1	1782964666	MQYDBCIVDLRLPS-LPHOPBHVSA-N	427.328	1.801	50	20	IDGD	
CCOCC(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](Br)Cc3ccccc3)C2)C1	1783024173	VBQUDXLVBJYWBK-XLIONFOSSA-N	439.350	1.859	50	20	IDGD	
CCOc1cnc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](Br)CC)C3)C2)cn1	1783342582	CAIKOIIOVIAJIY-ACJLOTCBSA-N	441.326	1.492	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ncc(Cl)cn3)CCO2)C1	1783343372	HLKWKXNTTKFJOW-LRDDRELGSA-N	431.718	1.747	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](C)Br)C3)C2)nc2nccn12	1783537456	SJLBHQIHZOIPAK-ACJLOTCBSA-N	436.310	1.265	50	20	IDGD	
CCOc1ncc(Cl)cc1C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](Cl)COC)C2)C1	1783877646	MNMSQYMUTIDIME-DNVCBOLYSA-N	446.331	1.831	50	20	IDGD	
CC1CCN(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]32)CC1	1784320189	JYEJRKFFBNVZIN-OGNFBWPZSA-N	434.408	1.934	50	20	IDGD	
Cc1nn(C)c(C)c1CC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](C)CBr)CCO2	1784509872	VOPINUYLAHKKOQ-BFUOFWGJSA-N	441.370	1.440	50	20	IDGD	
CC(=O)Nc1ccc(Cl)c(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)c1	1785270631	PFQBIXRTHXJQTK-VQIMIIECSA-N	444.315	1.342	50	20	IDGD	
C=CCCc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](O)CCl)C[C@@H]32)c(O)n1	1785772913	UVLLDYKAUQXLQP-RUGDWHBFSA-N	437.924	1.099	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCC3CCCC3)[C@H]2C1	1786322450	RBFSLZGMGPFJKG-VDGAXYAQSA-N	443.548	1.249	50	20	IDGD	
CCn1nc(C(=O)NC2(c3ccc(NC(=O)c4cccc(B(O)O)c4)cc3)CCC2)cc1C	1788147961	RMHTXPVZRYLXPQ-UHFFFAOYSA-N	446.316	1.953	50	20	IDGD	
COc1cccc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]3C2)n1	1789868773	LPDOJOOAPDAMOJ-XCGRYBKZSA-N	444.359	1.849	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1cccc2ccoc12	1790465457	OAOCZMABRLEXRK-YYWHXJBOSA-N	448.284	1.020	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(SC)c3O)C[C@@H]21	1791254149	OJECXVSVPLCICS-HNKHHVNMSA-N	442.965	1.961	50	20	IDGD	
CC(C)N1CCC[C@H]1C(=O)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1	1792016333	LQUTYTZKJMBLTE-QFIPXVFZSA-N	449.360	1.987	50	20	IDGD	
CC(C)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3cccnc3nc1O)C2	1792784427	CVZBCDBQJZBOMM-MIFYACCESA-N	432.908	1.804	50	20	IDGD	
CCOc1ccc(Cl)cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](O)CCl	1792981084	ZNGOFHDGDJZLAM-RBNVPPIJSA-N	431.316	1.542	50	20	IDGD	
C#CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCl	1793117132	AVYOCFWBPXTAPV-YIDVYQOGSA-N	427.929	1.141	50	20	IDGD	
O=C(CCCc1ccncc1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2	1794132963	QQXHUCLXORVYMH-YALNPMBYSA-N	428.302	1.684	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1CC(=O)C1)C2	1794143410	FHNJLDWHAVUOOC-FQLMCAECSA-N	427.929	1.736	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnoc1C1CC1	1795004819	CIDDWNLGENVQQK-DNVSUFBTSA-N	426.311	1.786	50	20	IDGD	
CC[C@@H](C)[C@@H](N)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)C2	1795558112	XGUBCHGKGNUKKG-UAPBNUCKSA-N	446.498	1.835	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2c(c1)OCO2	1796787286	BUPXOOFXRWFSGG-LOUJCGABSA-N	439.306	1.792	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc2c1OCC2	1796797294	POKOTBNRFJRJHY-YALNPMBYSA-N	437.334	1.998	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2)[C@H](O)c1cccc(Br)c1	1799096935	CQIPTYIDBOVGEQ-BJBXXJATSA-N	449.704	1.607	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C#Cc1ccc(Cl)cc1)C2)[C@H](F)Br	1799343496	YHBGWEJAVDZNEP-RMHZUWNSSA-N	443.700	1.972	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCOc1ccccc1)C2)[C@@H](F)Br	1799347737	RIYFRXFEJSIEMM-DLTLXFJOSA-N	429.286	1.736	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(B(O)O)cc1)C2	1799776040	MZHYLMUOVOHEMD-BCDXTJNWSA-N	442.708	1.594	50	20	IDGD	
Cc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CO[Si](C)(C)C)C3)cc2c[nH]nc12	1799918012	AXHUMFALFXKWJM-XEMDLRDOSA-N	430.581	1.926	50	20	IDGD	
CCOc1ncccc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)Br	1800754476	OQFVHGCGUIPGHI-GUIRCDHDSA-N	426.311	1.467	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C=C/c1ccc(OC)cc1F	1800835024	LIZJUNMSTIDPLS-DTRAHEBBSA-N	440.899	1.691	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)Oc1cccnc1	1801405303	MQFJEILWEYQJHH-IPVBOJNNSA-N	426.311	1.222	50	20	IDGD	
Cc1cc(C)c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCC(=O)NN(C)C)C3)c(C)c1	1801700898	WTOLRUMSYSQJMJ-OPMZPASUSA-N	430.549	1.188	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCCC2(CCN(C(=O)c3cc(=O)n4[nH]nnc4n3)CC2)C1	1806157069	QPOXGOREGSAFDT-ZDUSSCGKSA-N	435.916	1.065	50	20	IDGD	
CN1CCN(CCC(=O)NC[C@@H]2CCN(C(=O)[C@@H](F)Cl)[C@@H]2c2cccnc2)CC1	1806914429	PULYLEXCFYSOJJ-QXAKKESOSA-N	425.936	1.259	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2cc3ncccn3n2)[C@@H]1c1cccnc1	1809766980	DDPSCQWHKAWLCM-BXWFABGCSA-N	442.907	1.698	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)c1nc(O)n2c1CCCC2	1810584444	BBAFUHCIBHMCFJ-YXJHDRRASA-N	447.923	1.239	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1)c1cc[n+]([O-])cc1	1811190463	KUKWLWXAUFJGOS-AEFFLSMTSA-N	433.306	1.820	50	20	IDGD	
NC(=O)c1ccc(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)cc1	1813733948	MEVAYKIUGJGBJF-OKZBNKHCSA-N	430.892	1.100	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)c3nc[nH]c3[N+](=O)[O-])sc2C1	1817205392	LTXVTMDDMDAETL-RNFRBKRXSA-N	443.283	1.784	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)COC(C)C)CC2	1817276210	PKLHKJHSUAXRBR-XIXVAHAYSA-N	446.533	1.614	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](O)C(C)C)[nH]n1	1818111022	YMFKJVWHCNMJTD-ROXVCHECSA-N	443.508	1.553	50	20	IDGD	
O=C(/C=N/O[C@@H]1CCCCO1)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1	1819450180	HFTLCSRBTOHKBN-VAJPYINFSA-N	427.889	1.531	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](C)N3C[C@H]4C[C@H]4C3)sc2C1	1819579504	FJIKDRJMOGYADN-QNSTZXKLSA-N	426.970	1.649	50	20	IDGD	
Cc1n[nH]c(C)c1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1819663135	SKTXFNFRGCVDRN-KRWDZBQOSA-N	436.281	1.049	50	20	IDGD	
Cc1cc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)ccn1	1819757615	SMRHHRHCICWHIM-QGZVFWFLSA-N	427.509	1.792	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cccnc1)CC2	1819794671	AXCJHFUNSBPYMW-GFCCVEGCSA-N	437.485	1.076	50	20	IDGD	
CCn1nc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)CCC(=O)NN(C)C)CC3)cc1C	1820777455	JPHHTGVMMWEHIT-ZDUSSCGKSA-N	447.565	1.267	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)n2)[nH]n1	1822187652	YLKVMANNRUUECI-LDYMZIIASA-N	439.270	1.700	50	20	IDGD	
CC(C)=CCCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2	1822731065	UDFHVQSTNVPKJZ-MRXNPFEDSA-N	427.335	1.795	50	20	IDGD	
Cc1cnn(CC(=O)N[C@@H]2CCc3nc(NC(=O)[C@@H](F)Br)sc3C2)c1	1823005181	XRDCANLIDKKMCO-NOZJJQNGSA-N	430.303	1.951	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CN1CCCC1=O)CC2	1825446224	AAILLEMNGUCRHX-MNOVXSKESA-N	443.367	1.851	50	20	IDGD	
O=C(CN1CCCCC1=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](F)Br)CC2	1825865730	MXFZJMGTZYNKSU-LKFCYVNXSA-N	447.330	1.758	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc3n(n1)CCCO3)CC2	1826000398	SMKBXQUODFWKFV-WDEREUQCSA-N	439.925	1.602	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnn3c1OCCC3)CC2	1826004944	VSIPMSDZQMMBNY-CMPLNLGQSA-N	439.925	1.602	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)Cc1ccccc1O)CC2	1826089764	NYWGOKMKNLLXNH-AWEZNQCLSA-N	445.545	1.376	50	20	IDGD	
CC(=O)N1CCN(CC(=O)N[C@@H]2CCc3nc(NC(=O)C(Cl)Cl)sc3C2)CC1	1826097147	IBCHRLPVFGZQHT-LLVKDONJSA-N	448.376	1.023	50	20	IDGD	
O=C(O)CSCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCBr)CC2	1826110597	OGYRXSGSYUCATI-QMMMGPOBSA-N	436.353	1.658	50	20	IDGD	
Cc1ocnc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827052515	MIFBGNDXMGOYTP-LJQANCHMSA-N	425.294	1.210	50	20	IDGD	
O=C(CCN1CCCC1)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827060306	WJWWQJODEYUVSA-QFIPXVFZSA-N	441.381	1.086	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)CCc2ccc[nH]2)CC1	1827108530	IBOFCGHXROQWQZ-JOCHJYFZSA-N	437.349	1.561	50	20	IDGD	
O=C([C@@H](O)CCl)N1CCC([C@@H]2CCCCN2C(=O)c2ccc3c(n2)OCCO3)CC1	1827531921	STBALJNLQDBGJQ-IRXDYDNUSA-N	437.924	1.686	50	20	IDGD	
O=C(N[C@@H]1CCc2nc(NC(=O)[C@H]3CCCSC3)sc2C1)c1ccc(B(O)O)cc1	1828153885	ZZZYRDYEHDXSME-DZGCQCFKSA-N	445.375	1.192	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cnco2)CC1	1828923625	PRWVPPOUQRVZMF-QGZVFWFLSA-N	426.477	1.220	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@H]2CCNC(=O)C2)CC1	1831942380	VRPPPPSGQKGWJH-CWRNSKLLSA-N	428.371	1.916	50	20	IDGD	
Cn1c(C(=O)N2CCC(N3CCC(NC(=O)[C@@H](O)CCl)CC3)CC2)cc2ccccc21	1833310131	KDGWOHCMCTYKBF-NRFANRHFSA-N	446.979	1.963	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(C)n3)CCO2)C1	1834049868	FSWVTJPLPOASNG-HNAYVOBHSA-N	440.338	1.634	50	20	IDGD	
COc1cnc(C(=O)NC2CCN(C3CCN(C(=O)C(C)(C)CCl)CC3)CC2)cn1	1834314632	BPCSULNFJPIJSY-UHFFFAOYSA-N	437.972	1.935	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC(N2CCC(NC(=O)CCc3cncnc3)CC2)CC1	1834844210	BXAJHBYKJIFKPW-UHFFFAOYSA-N	447.656	1.832	50	20	IDGD	
O=C(CSc1ccncc1)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836715191	MECLANLZSSWCFJ-SFHVURJKSA-N	441.981	1.772	50	20	IDGD	
O=C(c1ccc2cncn2c1)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836717575	YKCZOCGSSGSSCF-IBGZPJMESA-N	434.924	1.546	50	20	IDGD	
C[C@H](CC(N)=O)C(=O)N1CCC(OC2CCN(C(=O)[C@H](F)Br)CC2)CC1	1836911149	UHKJBXFJZGREKD-ABAIWWIYSA-N	436.322	1.187	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cn4ccsc4n3)CCO2)C1	1837045508	YUVAYYZYYNOELR-LIRRHRJNSA-N	440.953	1.873	50	20	IDGD	
Cc1nc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)sc1C	1838412119	VGGVYLFZWXRQFY-GTNSWQLSSA-N	446.367	1.613	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(OC)c3)CCO2)C1	1838929576	VVHYLRSLFWREKJ-YLJYHZDGSA-N	426.897	1.019	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C)c([N+](=O)[O-])cn3)C2)C1	1839144566	FFIWOGHMHAIBQY-KUHUBIRLSA-N	440.884	1.386	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3c[nH]c4ncccc34)C2)C1	1839149937	WUCVLUKWHGDHDX-GCJKJVERSA-N	448.951	1.969	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3cn[nH]c3)C2)C1	1839150484	NUKXSTXUNAGSRP-MSOLQXFVSA-N	433.336	1.035	50	20	IDGD	
C=CCC(F)(F)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1	1839889862	UDJRFIVNIFLKTH-CVEARBPZSA-N	429.291	1.891	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@]3(C)CC=CCC3)C2)C1	1840036964	UKPWTTWNZZFBCD-ZYSHUDEJSA-N	429.355	1.973	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4[nH]ccc4s3)C2)C1	1840152548	LYRNIGLAXZKUIV-DJJJIMSYSA-N	441.937	1.553	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCCc3cccnc3)CCO2)C1	1840513502	CLLBBGWVWVSDNA-WIYYLYMNSA-N	439.940	1.115	50	20	IDGD	
COc1ccc([C@H](O)C(=O)N2CC3(CCCN3C(=O)[C@H](C)CBr)C2)cc1	1841285415	UQWHYVUOIXRZCX-CJNGLKHVSA-N	425.323	1.963	50	20	IDGD	
CC(C)(NC(=O)c1ccc(Cl)s1)C(=O)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1	1841352254	DLSDGXAQZOQEIM-NSHDSACASA-N	448.372	1.713	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)Cc1ccc3ncccc3c1)C2	1844263633	ZJRMAGQUBQPDRR-UHFFFAOYSA-N	444.495	1.293	50	20	IDGD	
Cc1ccc(=O)n(C(C)(C)C(=O)N2CCCC23CN(C(=O)[C@@H](F)Br)C3)n1	1844354382	BIYNNDGUHCKGAD-CYBMUJFWSA-N	429.290	1.181	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCCC12CN(C(=O)c1cccc(N3CCOCC3)n1)C2	1845170567	APDDCLWZOSIHGW-IBGZPJMESA-N	441.359	1.972	50	20	IDGD	
COC(=O)c1ccc(CC(=O)N2CC3(CCCN3C(=O)[C@H](F)Br)C2)cc1	1845220191	GLIRWYKGJSEDNP-HNNXBMFYSA-N	427.270	1.910	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)c2ccc(CCNS(C)(=O)=O)s2)c1C	18103702	YVNGWAGQPRPICQ-AWEZNQCLSA-N	439.559	1.685	50	20	IDGD	
O=C(CCS(=O)(=O)c1ccc2c(c1)CCC2)NNC(=O)c1ccc2c(c1)OCCO2	106285543	DXIYQVBOWNXHRT-UHFFFAOYSA-N	430.482	1.572	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1cccc(CN2CCOCC2)c1	110746687	PXZIHJXFCNEJPH-UHFFFAOYSA-N	445.545	1.195	50	20	IDGD	
CCCc1c(C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)[nH]c(C)c1C(=O)OC	117473715	QZHWJUPONRIPKR-UHFFFAOYSA-N	425.445	1.384	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)N[C@@H](c2nnc3ccccn23)C(C)C)nc1	726282320	LWEDUMMSXRUBHZ-QGZVFWFLSA-N	446.537	1.834	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)NCc1cccc(C(=O)NCCN(C)C)c1	727479440	JFZDCOMQQBGMAY-UHFFFAOYSA-N	447.923	1.784	50	20	IDGD	
CN(C)N(C(=O)CNC(=O)c1sc2ccccc2c1Cl)[C@@H]1CCS(=O)(=O)C1	728175159	KPWXJIYOQPSWOY-LLVKDONJSA-N	429.951	1.777	50	20	IDGD	
C[C@H]1NC(C(=O)NNC(=O)c2cc(F)ccc2Br)=NN(c2ccccc2)C1=O	728549047	ASJNVDJOJJGUTJ-SNVBAGLBSA-N	448.252	1.688	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)NCCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-]	728942107	LTOMYQICGCQUHV-UHFFFAOYSA-N	426.355	1.994	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CC[C@H](CN(C)C(=O)OC(C)(C)C)C2)n1	729477790	NSMFMCNAPSVVTN-CQSZACIVSA-N	425.555	1.330	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)NNC(=O)Cn2ccc3ccccc32)cc1OC	729507018	MFVNCZFMRCWKFM-UHFFFAOYSA-N	425.445	1.724	50	20	IDGD	
C[C@@]1(NNC(=O)NCC2CCN(Cc3ccccc3Cl)CC2)CCS(=O)(=O)C1	730134335	YKPPGAJFRCIEKU-LJQANCHMSA-N	428.986	1.933	50	20	IDGD	
O=C(COC(=O)c1cc(F)ccc1N1CCOCC1)NNC(=O)c1cccc(Cl)c1	730862883	STQQSJGZSCRDIK-UHFFFAOYSA-N	435.839	1.934	50	20	IDGD	
COC1CCN(C2(CNC(=O)NNC(=O)c3nnc(O)c4ccccc34)CCCC2)CC1	730907779	KYNBAUHBOLSXPY-UHFFFAOYSA-N	442.520	1.703	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)NCCS(=O)(=O)NCC2CCC2)c1C	731761172	VSXPBHVEHUPWQZ-HNNXBMFYSA-N	426.539	1.121	50	20	IDGD	
CCC1(CC)NC(=O)N(CC(=O)NNC(=O)c2ccc(OC)c(Br)c2)C1=O	732034587	WQXAMNIDIUDVFR-UHFFFAOYSA-N	441.282	1.329	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Cc2csc(-c3nc[nH]n3)n2)cc1Br	732174995	FVSKAZYFBNOXDW-UHFFFAOYSA-N	437.279	1.703	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)c1ccn(S(=O)(=O)c2ccc(C)cc2)c1	732257464	PLVVOWDBDMLDRF-UHFFFAOYSA-N	443.481	1.882	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)CCc2c(C)nc3[nH]n(C)c(=O)c3c2C)c1	733124214	XUAKADRJJZOYAW-UHFFFAOYSA-N	425.489	1.654	50	20	IDGD	
Cc1cccc(-n2c(NNC(=O)[C@H](C)NS(C)(=O)=O)nc3ccccc3c2=O)c1C	733366043	YOLRHVNRPHRKAW-AWEZNQCLSA-N	429.502	1.383	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)[C@@H]1CC(=O)N(c2ccc3c(c2)CCC3)C1	734240808	ZPJJBNFABWZILN-MRXNPFEDSA-N	445.520	1.383	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1	734242121	UNROMZLVSNFLJX-UHFFFAOYSA-N	433.425	1.249	50	20	IDGD	
CCCC(=O)N1CSC[C@@H]1C(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	734825030	RAFQVDOWRDJCNE-CQSZACIVSA-N	443.570	1.418	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N1CC[S@](=O)[C@H](C)[C@H]1C	736649434	FFRWSGCSLSAETG-PKLLPDNZSA-N	432.340	1.799	50	20	IDGD	
Cc1nc(-c2cccnc2)nc(NNC(=O)C2=NN(c3ccccc3)[C@@H](C(N)=O)C2)c1C	736696633	KJVXNAQRFPHAPL-GOSISDBHSA-N	430.472	1.719	50	20	IDGD	
O=C(NC[C@]1(N2CCOCC2)CCSC1)NNC(=O)Nc1ccc(OC(F)F)cc1	743557664	RZZPVOGQBCAJAX-GOSISDBHSA-N	445.492	1.832	50	20	IDGD	
CCc1cc(N2CCC[C@@H](NC(=O)NNC(=O)c3cc([N+](=O)[O-])ccc3O)C2)ncn1	745817308	XRVAZCRBLXZKEI-CYBMUJFWSA-N	429.437	1.266	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)N[C@@H]3CCN(c4cc(C)nn4C)C3=O)n[nH]2)cc1	745905928	OMICHEPXFVPLSH-OAHLLOKOSA-N	436.476	1.177	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)N[C@@H](c2ccccc2)c2cccc(S(C)(=O)=O)c2)cn1	745908502	HPNAVZRSZICKLF-SFHVURJKSA-N	427.486	1.557	50	20	IDGD	
C[C@@H](C(=O)NNc1nc(-c2ccc(Cl)cc2)no1)N1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O	746256383	PFBBBTWTGCYIJI-YPCYXAEESA-N	431.836	1.384	50	20	IDGD	
COc1ccc([C@H]2[C@H](C(=O)NNC(=O)Cc3cn4ccccc4n3)CCC(=O)N2C)cc1	746549601	BMQBNCXOYDBZHU-GCJKJVERSA-N	435.484	1.643	50	20	IDGD	
CCCC[C@@H](/N=C1/NS(=O)(=O)c2ccccc21)C(=O)NNc1nc(C)cc(OC)n1	746630376	IXEUIRICBQKIDK-CQSZACIVSA-N	432.506	1.534	50	20	IDGD	
COc1cc(C)nc(NNC(=O)CS(=O)(=O)Cc2cccc(Br)c2)n1	746630466	JOEKYYIUVYQKTE-UHFFFAOYSA-N	429.296	1.614	50	20	IDGD	
COc1ccc2c(c1)OC[C@@H](C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1)C2	747412248	NLZBIQKFLWEBGT-LBPRGKRZSA-N	439.877	1.008	50	20	IDGD	
O=C(NNc1ccc(F)cc1Br)[C@@H]1CC(=O)N([C@H]2CCS(=O)(=O)C2)C1	748073769	YHLQOGGMIOSIAI-KOLCDFICSA-N	434.287	1.067	50	20	IDGD	
NS(=O)(=O)c1cccc(N2C[C@@H](C(=O)NNc3ccc(F)c(F)c3F)CC2=O)c1	748220371	NVNRARZMOIXVIA-VIFPVBQESA-N	428.392	1.248	50	20	IDGD	
O=C(CCN1CCN(C(=O)[C@H]2CCCO2)CC1)NNc1ccc(OC(F)(F)F)cc1	748501151	DWDBKICLDDKRBR-MRXNPFEDSA-N	430.427	1.742	50	20	IDGD	
CC[C@@H](C(=O)N1CCC(NC(=O)NN[C@@]2(C)CCS(=O)(=O)C2)CC1)c1ccccc1	749191541	SULPIUXUVIGUQJ-NQIIRXRSSA-N	436.578	1.552	50	20	IDGD	
CN(CCO)S(=O)(=O)c1ccccc1CNC(=O)NNC(=O)c1cc2ccccc2o1	749573913	XRVGQFRMOQJFFD-UHFFFAOYSA-N	446.485	1.190	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2CCCN2C(=O)OC(C)(C)C)c1	750568401	IIGDSDVVNNJZNE-HNNXBMFYSA-N	440.522	1.097	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O	751060700	KKKTYIXKCNRNFD-UHFFFAOYSA-N	432.483	1.653	50	20	IDGD	
CC(C)(C)NC(=O)CN1CCC(CNC(=O)NNC(=O)Cc2ccc(Cl)cc2)CC1	751111580	QANHJHBLFVONKN-UHFFFAOYSA-N	437.972	1.840	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNS(=O)(=O)c1ccc(Br)c(Cl)c1	751548406	QODXZJLXVQQUBD-UHFFFAOYSA-N	426.720	1.717	50	20	IDGD	
CCOC(=O)C1(C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)CCC1	752127394	LJISZZOJDHATSN-UHFFFAOYSA-N	436.940	1.338	50	20	IDGD	
COCC[C@H](Cc1ccco1)NC(=O)NNc1ccc(S(=O)(=O)NC(C)C)cn1	753283853	YIUGBFFYLOTDAN-CQSZACIVSA-N	425.511	1.635	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)NC[C@H]1CCCN1S(C)(=O)=O	753691069	JDRVRYQREDQRHI-WMLDXEAASA-N	434.518	1.362	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)N[C@@H]2[C@H]3CCO[C@H]3C23CCC3)c2ccccc2c1=O	754677589	WHSKLUUKWYIWEI-KBAYOESNSA-N	425.489	1.879	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)Nc1nc2ccccc2s1	755057477	QWFUIKCHKZPFSS-UHFFFAOYSA-N	438.513	1.907	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)Nc2c(C)n(C)n(-c3ccccc3)c2=O)c1	755320460	MNJAYVOIHQDUAV-UHFFFAOYSA-N	425.445	1.968	50	20	IDGD	
CCN(CC)CCOc1ccccc1NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	755611353	SNRJMDNZXBVZBT-UHFFFAOYSA-N	438.492	1.849	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)Nc2cccc(CN3CCCC3=O)c2)c2ccccc2c1=O	755687983	XXKVPHGEKRHLPQ-UHFFFAOYSA-N	434.456	1.522	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c(OCC(=O)N(C)C)c1	756203178	PKSGBAAWHBCPGS-UHFFFAOYSA-N	448.501	1.332	50	20	IDGD	
COCC[S@](=O)Cc1cccc(NC(=O)NNC(=O)COc2ccc(C#N)cc2)c1	756613732	QLLDJHODNHISPS-PMERELPUSA-N	430.486	1.685	50	20	IDGD	
COc1ncncc1NC(=O)NNC(=O)c1nn(CCC(C)C)c(=O)c2ccccc12	757689714	IAJHGEVXQPALRC-UHFFFAOYSA-N	425.449	1.708	50	20	IDGD	
COCCc1nnc(-c2cccc(C(=O)NNC(=O)c3nn(-c4ccccc4)cc3O)c2)o1	757719939	RGIZKVFQHFWCTK-UHFFFAOYSA-N	448.439	1.892	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)NNC(=O)COc2ccccc2C#N)cc1Cl	757738063	HNZYDZRLDIJIPR-UHFFFAOYSA-N	432.820	1.995	50	20	IDGD	
O=C(NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)Nc1cnc2c(c1)COCC2	757939602	QCQZKTAQWNVRON-UHFFFAOYSA-N	445.501	1.405	50	20	IDGD	
N#Cc1ccc(N2CCC[C@H]2C(=O)N2CCN(S(=O)(=O)CBr)CC2)cc1	758514097	ZHTCHSXKZBVQAH-INIZCTEOSA-N	441.351	1.353	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)c2ccc(S(=O)(=O)N=c3cc[nH]cc3)cc2)nc1	759734392	CEZJNGCCSODKRB-UHFFFAOYSA-N	427.442	1.243	50	20	IDGD	
Cc1cc(C)nc(-n2nccc2NC(=O)C(=O)NNc2ccnc(Br)c2)n1	760305747	ZQNZSKDIVZLSFK-UHFFFAOYSA-N	431.254	1.518	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCCC(=O)NNC(=O)Cc1ccccc1F	760813588	KMTGRWOKGSURRT-MRXNPFEDSA-N	436.484	1.421	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)C(=O)Nc1c(F)cccc1F	763532332	VLKZLAJTPJLRSJ-UHFFFAOYSA-N	431.443	1.263	50	20	IDGD	
Cc1ccc(Br)c(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1	763574016	WVOJUVFOQKAQSR-OAHLLOKOSA-N	434.246	1.683	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1ccc(CCN2CCCC2)cc1	763623792	HOMUXLHLIJGDEV-UHFFFAOYSA-N	434.500	1.681	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)COc2cc(C)cc(C)c2)cc1	763644002	CTIBGHBKBMDNQY-UHFFFAOYSA-N	429.429	1.020	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)COc2cc(C)ccc2C)cc1F	763667865	DICRTJNXOHXLRN-UHFFFAOYSA-N	433.436	1.633	50	20	IDGD	
Cc1nn(-c2ccccc2)c(C)c1NC(=O)C(=O)NNC(=O)COc1ccc(C#N)cc1	763678166	FGZYOLPOCGTLRA-UHFFFAOYSA-N	432.440	1.526	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)C(=O)Nc1ccc(NC(=O)[C@H]2CCCO2)cc1	763678559	GBPBOQQOQUFCDD-QGZVFWFLSA-N	444.419	1.108	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)C(=O)Nc1cccc(CN2CCCC2=O)c1	763679485	BVUAIYKRMINMBB-UHFFFAOYSA-N	428.420	1.113	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)COc2ccccc2F)cccc1C(=O)N1CCCC1	763681828	QWSRGIZOBIRQSR-UHFFFAOYSA-N	442.447	1.535	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2cccc(-n3cccn3)c2)c2ccccc2c1=O	763786947	SDRRSBYERSVPAZ-UHFFFAOYSA-N	445.439	1.002	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccc(OC[C@H]2CCCO2)cc1	763839229	GTHTWZKYNQODGG-GOSISDBHSA-N	431.420	1.548	50	20	IDGD	
COC(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)cc1	763839273	CWBBRCKKSKVHFZ-OAHLLOKOSA-N	427.457	1.572	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3cccc([C@H]4CNC(=O)C4)c3)cc2C1	763944223	XXPSEQICTMSBHZ-SWLSCSKDSA-N	440.525	1.876	50	20	IDGD	
COc1ncnc(N(C)C)c1NC(=O)C(=O)NNC(=O)c1cc2c(s1)CCCCC2	763962400	OPVKSOAWQSFKPS-UHFFFAOYSA-N	432.506	1.281	50	20	IDGD	
O=C(NNC(=O)c1cc(Cl)ccc1O)C(=O)Nc1ccnn1CCc1ccccc1	763974187	NAUARLJQENQTHL-UHFFFAOYSA-N	427.848	1.885	50	20	IDGD	
Cc1cccc(Oc2ccc(NC(=O)C(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)cc2)c1	763999395	WMQYNCJQYKIASM-CQSZACIVSA-N	431.470	1.308	50	20	IDGD	
O=C(NNC(=O)c1cccc(Br)c1)C(=O)Nc1cccnc1N1CCOCC1	764062922	FSCXFPNZGMCEJF-UHFFFAOYSA-N	448.277	1.080	50	20	IDGD	
C[C@H]1CCCN(S(=O)(=O)c2ccc(NC(=O)C(=O)NNC(=O)C3CCCC3)cc2)C1	764070987	PATXSASOABAOHX-AWEZNQCLSA-N	436.534	1.383	50	20	IDGD	
COc1ccc(C(=O)N2CCCCCC2)cc1NC(=O)C(=O)NNC(=O)c1cc(C)[nH]n1	764106703	PVMILXICQYCCLP-UHFFFAOYSA-N	442.476	1.143	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1O)C(=O)Nc1cccc(N2CCCNC2=O)c1	764127320	UTNVTRCWWITUHL-UHFFFAOYSA-N	431.836	1.365	50	20	IDGD	
Cc1ncsc1C(=O)NNC(=O)C(=O)Nc1ccc(C(=O)NCC(C)C)c(Cl)c1	764247643	VSFVPZWTAAEWKX-UHFFFAOYSA-N	437.909	1.890	50	20	IDGD	
Cc1cnn([C@H]2CCCc3ccccc32)c1NC(=O)C(=O)NNC(=O)Cc1ccccn1	764266319	ATFVHBCYHLDPNP-IBGZPJMESA-N	432.484	1.841	50	20	IDGD	
Cc1ccc(-n2ncc(C(=O)NNC(=O)CNC(=O)c3cccnc3)c2C(F)(F)F)cc1	764344708	HSTCNUDXSOYEMI-UHFFFAOYSA-N	446.389	1.786	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1)C(=O)Nc1ccc(Br)nc1	764386965	FTFOMHQGWFODOG-UHFFFAOYSA-N	447.224	1.773	50	20	IDGD	
COC(=O)c1ccccc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	764387272	ICPHTJCPVGQOGR-UHFFFAOYSA-N	425.376	1.402	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNc2nccc(OC)n2)cc(Br)c1F	764664334	VIRJRWZIJYCDAY-UHFFFAOYSA-N	442.201	1.255	50	20	IDGD	
COc1cc2c(cc1OC)CN(C(=O)CCC(=O)NNC(=O)Cc1ccncc1)CC2	765770421	XJQWZEITGSVWQD-UHFFFAOYSA-N	426.473	1.154	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)c1noc2c1CCCC2	766660600	OIOAWBCSEFPIBD-UHFFFAOYSA-N	431.924	1.786	50	20	IDGD	
C[C@H](CC(=O)NNc1ccccc1S(C)(=O)=O)NS(=O)(=O)c1cccnc1Cl	766667741	CUOPYSSHMSTXFU-LLVKDONJSA-N	446.938	1.339	50	20	IDGD	
CCc1nn(C)c(Cl)c1C(=O)NNC(=O)c1cccc(S(=O)(=O)N(CC)CC)c1	767187824	YJBJKCLQCQVSFF-UHFFFAOYSA-N	441.941	1.741	50	20	IDGD	
CCOc1ccnc(N2CCCN(C(=O)NNC(=O)COCc3ccccc3)CC2)n1	767950243	HDZJLYOZYTYJKW-UHFFFAOYSA-N	428.493	1.345	50	20	IDGD	
COc1cc2c(cc1NC(=O)C(=O)NNC(=O)Cc1ccc(Cl)cc1)NC(=O)CC2	768237420	KLPNITPNKMJIIM-UHFFFAOYSA-N	430.848	1.562	50	20	IDGD	
CCN1CCC[C@@H]1CN1C[C@@H](C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)CC1=O	768261851	XIHAGUQLKYWAOH-UONOGXRCSA-N	430.534	1.232	50	20	IDGD	
O=C(NNC(=O)C1CCN(C(=O)N2CCCC2)CC1)c1cc(-c2ccc(F)cc2)[nH]n1	768277049	RKWPGUUALBCVJB-UHFFFAOYSA-N	428.468	1.905	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)CN1C(=O)N[C@]2(CCCC(C)(C)C2)C1=O	768565810	KZMDPNFABQTNNO-QFIPXVFZSA-N	430.505	1.666	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)NCCS(=O)(=O)Cc3ccccc3)nc21	770356171	QJQKVECEYWLMPN-UHFFFAOYSA-N	447.521	1.528	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)N[C@H]1CC(=O)N(c2c(F)cccc2F)C1	770844208	ZWQQUPFYTLOWLZ-NSHDSACASA-N	436.440	1.898	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)Cc3cccc(NS(C)(=O)=O)c3)nc21	770958972	UXJQVVNAYNPYQV-UHFFFAOYSA-N	433.494	1.344	50	20	IDGD	
CCOc1ccccc1C(=O)NCC(=O)NNc1nc(O)c2cnn(C(C)(C)C)c2n1	771010238	UPMZXAWNYIFOCT-UHFFFAOYSA-N	427.465	1.559	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCCc1cc2ccccc2[nH]1	771199174	ALBNUQSEUXEZBM-UHFFFAOYSA-N	428.518	1.956	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)c1ccc2c(c1)C(=O)N(C[C@@H]1CCCO1)C2=O	771933366	GKJVFPWXEHRDKA-ZFWWWQNUSA-N	445.472	1.200	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)C1CCN(C(=O)COc2ccccc2)CC1	771988871	NKAOZLAXHFATFG-MRXNPFEDSA-N	433.505	1.429	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)[C@H](C(C)C)N1CCCS1(=O)=O	772630816	NBIHMVZQDKAZHF-HNNXBMFYSA-N	436.559	1.940	50	20	IDGD	
COC(=O)Cn1cc(C(C)=NNC(=O)c2nn(CCC(C)C)c(=O)c3ccccc23)nn1	772837562	VBRIRZOULNADTR-UHFFFAOYSA-N	439.476	1.361	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)c1cccc(Br)c1O	772884339	JFGPQVDCPHFDIF-UHFFFAOYSA-N	426.654	1.886	50	20	IDGD	
COc1ccc(-n2nc(C(=O)NNC(=O)C(=O)NCc3ccc(Cl)cc3)cc2C)cc1	772889208	OGIWHXJPLHVOMJ-UHFFFAOYSA-N	441.875	1.920	50	20	IDGD	
Cc1ccc(-n2nc(C)cc2NC(=O)C(=O)NNC(=O)Cc2c[nH]c3ccccc23)nn1	773500145	QZIBEFQYGLFJEZ-UHFFFAOYSA-N	432.444	1.089	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(C(F)(F)F)ccn2)o1	773540098	ILMVUZIYHIEBFU-UHFFFAOYSA-N	427.383	1.935	50	20	IDGD	
CS(=O)(=O)Nc1ccc(OCCNC(=O)NNC(=O)c2ccc3ccccc3n2)cc1	773779223	KPLZHSGPXJPPGB-UHFFFAOYSA-N	443.485	1.629	50	20	IDGD	
CNC(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)cc1	774011340	YAEZQJGYUFGEKD-LBPRGKRZSA-N	432.864	1.182	50	20	IDGD	
C#C[C@H](NC(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1)[C@H]1CCCO1	776226853	ILXFOZFJNHBBOD-VQTJNVASSA-N	445.483	1.513	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2c(C)nn(C)c2-n2cc(C)cn2)cc(OC)c1OC	777412842	VTHGTYZEPHXXLN-UHFFFAOYSA-N	428.449	1.323	50	20	IDGD	
O=C(c1cccnc1OCC(F)F)N1CCN(S(=O)(=O)CBr)CC1	777777882	RHFJGVXGCAKNTQ-UHFFFAOYSA-N	428.255	1.166	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN(C)C[C@@]2(O)CCN(Cc3ccccc3)C2)cc1C	778497676	KJMOYPJXXWLBOO-QHCPKHFHSA-N	444.601	1.949	50	20	IDGD	
CCOC(=O)N1CCC([C@@H](C)NC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])CC1	779669356	NPPBRSURKTZPBL-CYBMUJFWSA-N	437.453	1.561	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)Cc2ccc(C(=O)NNC(=O)C3(C)COC3)cc2)cc1	782548651	JEIZQRXRILUDJP-UHFFFAOYSA-N	431.514	1.613	50	20	IDGD	
Cc1ccc(-n2cc(C)cn2)c(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)c1	782892390	CBGBKRFHPOOUMP-UHFFFAOYSA-N	445.483	1.704	50	20	IDGD	
COC(=O)c1c(NC(=O)C(=O)NNc2ccc(-n3cccn3)nn2)sc2c1CCCC2	783437340	YAXLJRAIQFJJCA-UHFFFAOYSA-N	441.473	1.471	50	20	IDGD	
Cc1nn(-c2ccccc2)c(C)c1NC(=O)C(=O)NNC(=O)c1cc([N+](=O)[O-])ccc1O	785024255	VIRVWCXYFQGPOG-UHFFFAOYSA-N	438.400	1.503	50	20	IDGD	
Cc1cc(NC(=O)[C@@H](C)SCC(=O)OCC(=O)NNC(=O)c2cccs2)no1	785300128	RIPNSZVAHBSWOL-SNVBAGLBSA-N	426.476	1.109	50	20	IDGD	
Cc1ccc(C(=O)NNc2nnc(-c3ccccn3)s2)cc1S(=O)(=O)NCC#N	788567249	XSAVSNUGCNNPIH-UHFFFAOYSA-N	429.487	1.467	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)[C@@H]1CCCN(C(=O)c2ccccc2)C1	795162142	XHCBLWLJPVUDPV-QGZVFWFLSA-N	430.530	1.932	50	20	IDGD	
CC(C)Cn1c(=O)nc(O)c2c(C(=O)NNC(=O)NCC(F)(F)F)cc(C(C)C)nc21	798316146	UYYYJTIMSPGOND-UHFFFAOYSA-N	444.414	1.783	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)C2(c3cncc(Br)c3)CC2)C[C@H](C)O1	799102302	XUUPPSKAXBRVCJ-STQMWFEESA-N	425.327	1.522	50	20	IDGD	
O=C(NNC(=O)c1cn2c(n1)CCCC2)c1cccc(S(=O)(=O)N2CCCCC2)c1	799518276	HUBIAZHOLSHVOM-UHFFFAOYSA-N	431.518	1.469	50	20	IDGD	
CN1CCN(CCNC(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)CC1(C)C	799686812	ZGTXEZUPPUMEPG-UHFFFAOYSA-N	437.488	1.632	50	20	IDGD	
COCCOc1cncc(C(=O)NNC(=O)c2cc(-c3ccc(OC)c(OC)c3)[nH]n2)c1	801180666	MCRCWTIXUHTAAI-UHFFFAOYSA-N	441.444	1.589	50	20	IDGD	
O=C(N=c1cc[nH]cc1)NNC(=O)c1ccc(Cl)c(S(=O)(=O)N2CCCCC2)c1	802026581	HPGORIRWFRILIZ-UHFFFAOYSA-N	437.909	1.798	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2ccc(-c3nnc(S)o3)cc2)cc1	802065021	JTMVDMXFQIHQTR-UHFFFAOYSA-N	433.471	1.895	50	20	IDGD	
CC(C)(C)c1ccc(S(=O)(=O)NCCC(=O)NNc2ccc(-n3ccnc3)nn2)cc1	804955703	WGLSHQXUFZWUFU-UHFFFAOYSA-N	443.533	1.772	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)N1CCC[C@@H]1COC(=O)NC1CCCCC1	805043374	IXSYALVWMMBLDW-OAHLLOKOSA-N	435.481	1.274	50	20	IDGD	
COCCn1cc(C(=O)NNc2ccccc2S(=O)(=O)NC(C)(C)C)c(=O)cc1C	806863887	VSKQBUVFHMXZCI-UHFFFAOYSA-N	436.534	1.637	50	20	IDGD	
CN(C)C(=O)CN1[C@H]2CC[C@H]1CC(NC(=O)NNC(=O)NCc1ccc(Cl)cc1)C2	807513683	DNZBPESIGUZJMM-IRXDYDNUSA-N	436.944	1.437	50	20	IDGD	
CCCNS(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)c2ccc3ccccc3n2)cc1	808065685	GETUMGDKLQEHAW-UHFFFAOYSA-N	448.526	1.546	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)Nc1ccc2c(c1)C(=O)OC2	808892978	OGWIOBHMCQWLQQ-UHFFFAOYSA-N	444.469	1.608	50	20	IDGD	
O=C(COC(=O)c1ccc2c(c1)SCC(=O)N2)NNC(=O)c1cccc([N+](=O)[O-])c1	811297250	VPWNTROGAQPQHM-UHFFFAOYSA-N	430.398	1.257	50	20	IDGD	
O=C(CCc1ccco1)NNC(=O)c1ccc(C(=O)NNC(=O)CCc2ccco2)nc1	813430053	WNUFMRVKIQJUDV-UHFFFAOYSA-N	439.428	1.055	50	20	IDGD	
COC(=O)C12CCC(C(=O)NNC(=O)CCN3CCN(c4ccccc4)CC3)(CC1)CC2	814361761	CVTGIFSKPTWUPD-UHFFFAOYSA-N	442.560	1.860	50	20	IDGD	
O=C(NNc1cccc(Cl)n1)C(=O)Nc1ccc(F)c(N2CCCS2(=O)=O)c1	815726299	XMHADZDTTVALRQ-UHFFFAOYSA-N	427.845	1.496	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)N(C)[C@H]2CCN(S(C)(=O)=O)C2)N(C)c2ccccc21	816817491	CVRGMWDDPGVDQT-HNNXBMFYSA-N	445.545	1.149	50	20	IDGD	
CC(C)CNS(=O)(=O)c1ccc(Br)c(C(=O)N2CC[C@@H](B(O)O)C2)c1	864234394	UROIKSQBJWIDQA-LLVKDONJSA-N	433.133	1.072	50	20	IDGD	
O=C(CNS(=O)(=O)c1cccc(F)c1)NNC(=O)c1ccc(COc2ccccc2)o1	913228547	LPPRTDMYPDNYNG-UHFFFAOYSA-N	447.444	1.737	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)c2ccc(CN3CCCCC3=O)cc2)c2ccccc2c1=O	915190898	RPHUNASAXLPJHP-UHFFFAOYSA-N	433.468	1.521	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)[C@@H]2CCCCN2S(=O)(=O)c2cccs2)c1	915808657	KIAPUWBFLMLPGV-INIZCTEOSA-N	436.559	1.819	50	20	IDGD	
Cn1cc(-c2nc(C(=O)NNC(=O)CCN3CCN(c4ccccc4)CC3)cs2)cn1	916091819	XZMZQTRGCYEMKZ-UHFFFAOYSA-N	439.545	1.517	50	20	IDGD	
Cn1c(=NNC(=O)NCCCN2CCN(c3ncccn3)CC2)sc2ccccc21	916263827	DIAMSXOCYLMWJM-UHFFFAOYSA-N	426.550	1.357	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)NCc2cccc(S(=O)(=O)NC)c2)cc1OC	916485950	OKNLSBSCPUEEMS-UHFFFAOYSA-N	436.490	1.146	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)NCCNS(=O)(=O)Cc1ccccc1	916517196	XYOIWIILHMYXPR-UHFFFAOYSA-N	434.518	1.078	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NCc2ccc(C(N)=O)cc2)c2ccccc2c1=O	916531146	ZZTZBZQLTNMABI-UHFFFAOYSA-N	436.472	1.440	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)NCc2ccc(S(C)(=O)=O)cc2)cc1	916568186	NYLKUWRQSGOXGH-AWEZNQCLSA-N	435.502	1.787	50	20	IDGD	
O=C(CCN1CCOCC1)Nc1cccc(CNC(=O)NNC(=O)c2ccccc2F)c1	918092240	QCHSPMLQBJCCQK-UHFFFAOYSA-N	443.479	1.631	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)N[C@@H](C)CN1C[C@@H](C)C[C@@H](C)C1	919924743	VJHZJXQAAZEYBE-ZNMIVQPWSA-N	438.598	1.599	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)Cc1nnn(-c2ccccc2)c1C	919963760	BVEFKRVPCGCFED-UHFFFAOYSA-N	441.517	1.181	50	20	IDGD	
CC(C)N(C)S(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1	920235279	MLWCOYOPBDIJKZ-UHFFFAOYSA-N	449.489	1.768	50	20	IDGD	
C[C@@]1(NNC(=O)NCCCN2CCN(c3ccccc3Cl)CC2)CCS(=O)(=O)C1	920813359	GUVMKJQKVBNQOF-LJQANCHMSA-N	444.001	1.233	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)N[C@@H]2CC(=O)N(c3ccccc3)C2)nc1	921124964	ARUDMXZDJZDAFG-CQSZACIVSA-N	432.506	1.200	50	20	IDGD	
CC(C)Cn1nc(C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c2ccccc2c1=O	933544347	OVDYQHVYJYTKFP-UHFFFAOYSA-N	446.467	1.374	50	20	IDGD	
COc1cc(OC)cc(N2C[C@@H](C(=O)NNC(=O)c3n[nH]c4c3CCCC4)CC2=O)c1	1116228591	NULQYLKSZXWZRR-LBPRGKRZSA-N	427.461	1.120	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NNC(=O)c2cncn2-c2ccccc2)cc1C(=O)O	1251551979	XLZUDCHVVYXQMC-UHFFFAOYSA-N	430.442	1.593	50	20	IDGD	
COc1ccccc1[C@]1(C)NC(=O)N(CC(=O)NNc2ccc(C(C)(C)C)nn2)C1=O	1319305427	GGKLYWOHPQJQDO-NRFANRHFSA-N	426.477	1.693	50	20	IDGD	
C[C@@H]1CCCN(C(=O)CCNC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)C1	1519987564	KCMICLMZDNZIGO-LJQANCHMSA-N	444.580	1.178	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2)c1ccnc2ccccc12	1778423222	JVECFOSMPLHGLX-WOIUINJBSA-N	431.920	1.962	50	20	IDGD	
Cc1nc[nH]c1CSCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](C)Br)CCO2	1778913876	UOWVPCMATOSRHH-SJCJKPOMSA-N	445.383	1.565	50	20	IDGD	
COc1cc(C#N)cc(C(=O)N2CCO[C@@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)c1	1779299115	TTYPQGLMUOWPQD-OAQYLSRUSA-N	431.565	1.862	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(CCN(C(=O)c3nc(O)n4c3CCCC4)C2)C1	1779348324	UWXVSYZVIAVYFH-HXUWFJFHSA-N	436.585	1.220	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnn(C)c1)C2	1781899720	DOFWODOQCMPOEZ-HDMKZQKVSA-N	427.343	1.721	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cn(C)c3ncccc13)C2	1782175389	KZBQLOTZFILADT-NJNPRVFISA-N	448.951	1.955	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cccc4nccn34)C2)C1	1782356875	ZKISJFPUZWYDMO-AUUYWEPGSA-N	435.322	1.809	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)CC(F)(F)C(=O)O)CCO2)C1	1783348001	RLRQSQYDWABXGQ-QMTHXVAHSA-N	427.242	1.100	50	20	IDGD	
CC(C)(C)CCCCCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2	1783390829	LNFOCNJSHJYJAQ-XMMPIXPASA-N	444.381	1.807	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)c1cc(-c2ccccc2)on1	1783420942	MMBDAJBHFBEWLP-MRHSLFKSSA-N	433.892	1.535	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)c3ccco3)[C@H]2C1	1783554632	NXEBXVNDFRERQH-VRUQUDLLSA-N	429.311	1.324	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccncc3C(F)(F)F)CCO2)C1	1783874543	IOICBYIRCDUNAM-YOEHRIQHSA-N	435.830	1.798	50	20	IDGD	
CCn1nccc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]2C1	1783967102	BJOJOVGFIJAQPQ-YXWQFLTLSA-N	427.343	1.527	50	20	IDGD	
COc1ccc(C(=O)Nc2ccc(C3(NC(=O)c4ccc(B(O)O)cc4)CCC3)cc2)cn1	1786529150	FNIQCCHQFCZQMQ-UHFFFAOYSA-N	445.284	1.832	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](CN)c3ccccc3)[C@H]2C1	1786924616	MDYQCWUGZGTFSF-WJNMYVKJSA-N	438.366	1.492	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)c1[nH]nc2ccncc12	1787339122	QKAGGOYKQVHMSV-WHOFXGATSA-N	436.310	1.336	50	20	IDGD	
COc1ccc(C(=O)NC2(c3ccc(NC(=O)c4ccc(B(O)O)cc4)cc3)CCC2)cn1	1788140500	ULEQQYNIPRQROB-UHFFFAOYSA-N	445.284	1.832	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc4nccn34)C[C@@H]21	1788763377	CPOULBUSPXPPNR-BQFCYCMXSA-N	430.581	1.779	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(F)cnc3Cl)[C@H]2C1	1788849369	ORIXIZKOOSJSDV-HJPIBITLSA-N	434.295	1.721	50	20	IDGD	
C/C=C/C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)[C@H]2C1	1789221969	XCADNILZJVZNCY-TZTOCFSCSA-N	431.445	1.690	50	20	IDGD	
O=C(NC1(c2ccc(NC(=O)[C@H](F)Br)cc2)CCC1)c1cccc(B(O)O)c1	1790534894	WJUOOSRZGSVACG-INIZCTEOSA-N	449.085	1.805	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)NC(=O)c3ccccn3)[C@H]2C1	1790586575	SARQQGOLXUNJNR-DNCCFGNJSA-N	436.940	1.197	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3CCN(CC)CC3)C[C@@H]21	1790962493	CAHJBKZMGOHLPJ-FJIDUMEYSA-N	444.414	1.872	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CCc4ccccc43)C[C@@H]21	1791293332	VZRRKGMMHNRMEZ-VMXMFDLUSA-N	442.560	1.069	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnc(Cl)nc1	1792371253	BOTYTDYKZASPMQ-YVECIDJPSA-N	431.718	1.507	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Nc1cccnc1)C2	1792867925	NVPGVNDHSKQCPA-SVZOTFJBSA-N	439.354	1.503	50	20	IDGD	
O=C(C[C@H]1COc2ccccc2O1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2	1793269019	DRTVDTATOKTKTD-LKQDWFRTSA-N	429.300	1.610	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nc3ccccc3n(C)c1=O)C2	1793450028	YJOUIDYGDUATQF-KRXQYRFLSA-N	446.935	1.544	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cn1cc([N+](=O)[O-])cn1	1794273983	AUYVIUPNHODQEH-RVMXOQNASA-N	428.287	1.461	50	20	IDGD	
COc1cccc(CCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CCC(=O)NN(C)C)C3)n1	1794289047	OABGLDRPPXYHSW-BCDXTJNWSA-N	431.537	1.034	50	20	IDGD	
Cc1ccc(OCCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)cc1	1796189613	HXYVVCAHFSASBX-WKCHPHFGSA-N	436.317	1.396	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1[nH]nc2ncccc12	1796216988	SCFXOHKKBZESJW-IMEWIIRVSA-N	426.304	1.397	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2	1796837194	ONZNCGVNCVPOGN-LMWOUKEDSA-N	439.285	1.536	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1C[C@H]1F)C2	1798524900	PEBBOMJVJIHWPS-HOWPAZRSSA-N	435.408	1.081	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3cncn3c1)C2	1799277575	YPDUMCKEEIQESW-MVWRLGRASA-N	425.316	1.774	50	20	IDGD	
CN(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C=C/C1CC1)C2)NC(=O)NCc1ccccc1	1799865799	NCERJFNGAADXSU-SKHSGBRBSA-N	439.560	1.937	50	20	IDGD	
CCOC(=O)O[C@@H](C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)CBr)C2	1800226440	YPRZNIMHHWQLLP-XHJNMGKDSA-N	435.315	1.169	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2)[C@@H]1Cc2[nH]nc(C(F)(F)F)c2C1	1800321658	XVBZPJJJOLWNGS-JAQPXOGNSA-N	438.809	1.267	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccno1)C2	1800332774	ZEXGWVBQZOJCEL-ODLYAQKHSA-N	428.395	1.763	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2)[C@@H]1CCc2ccccc2O1	1800946675	NWHUZACNYXOCKT-HIRMHNASSA-N	437.334	1.755	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(OC)c(C)c(OC)c1)C2	1800983214	SICAQOSLJGRYCF-RCJHGTSTSA-N	440.924	1.469	50	20	IDGD	
C#CCCCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2	1800993632	WUDSAOMKCTUXRV-VPTLXERWSA-N	443.456	1.527	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@H]1CCN(C(=O)c2cnnn2C)[C@H]1c1cccnc1	1803009021	OFSPNDCSTGRNPE-XPKDYRNWSA-N	435.326	1.561	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H]2COc3ccccc3O2)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803135588	FIJFKANWAVULJM-CPLUKWAASA-N	445.903	1.527	50	20	IDGD	
CC(C)[C@H](S)C(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1803607381	CNSSSTBNFYXRPL-UXPWSPDFSA-N	435.594	1.415	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2ccnc(F)c2)[C@H]1c1cccnc1	1803848409	YDFNBMOCPBFENW-DYESRHJHSA-N	442.495	1.308	50	20	IDGD	
O=C(/C=C/C(=O)N1CCCC2(CCN(C(=O)[C@@H](O)CCl)CC2)C1)NCc1ccccc1	1805478907	YLVMCQOTZVUMLM-UCFODXPJSA-N	447.963	1.690	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)[C@H]2CCCS2(=O)=O)[C@@H]1c1cccnc1	1808277312	BTLAFVMUTRCLDN-MWDXBVQZSA-N	427.954	1.682	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)C3(C(F)(F)F)CC3)CC2)C1	1809971942	DRMIOLPIMPLDOY-UHFFFAOYSA-N	438.255	1.554	50	20	IDGD	
C=CCNC(=O)/C=C\C(=O)N1CC[C@@H](CNC(=O)CO[Si](C)(C)C)[C@@H]1c1cccnc1	1810537556	KZLMDTBXPVAAJG-GGUUDJDBSA-N	444.608	1.797	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)N1CC[C@@H](CNC(=O)CO[Si](C)(C)C)[C@@H]1c1cccnc1	1810546004	KPSCDOVTSHTXIU-AYBZRNKSSA-N	449.628	1.647	50	20	IDGD	
CC/C=C(\C)C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1	1813703915	YWHZCJBZDYJNIG-UNCLRNMLSA-N	436.516	1.756	50	20	IDGD	
Cc1cncc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)c1	1816500431	JXCHVOLGJGULID-KRWDZBQOSA-N	427.509	1.792	50	20	IDGD	
Cn1nc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)CCBr)n[nH]2)cc1O	1816780798	ASONNCBBHQORQM-GFCCVEGCSA-N	425.287	1.940	50	20	IDGD	
C[C@H](C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCBr)n[nH]1)n1cnnn1	1816784584	JBMFSOFHQGDDBS-PWSUYJOCSA-N	425.291	1.435	50	20	IDGD	
CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](F)Cl)sc2C1	1817133947	PLFJRJAVHUENEN-GAJTVXKRSA-N	442.904	1.060	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CNCP(=O)(O)O)n[nH]1	1817232154	NIOSFMNEEUKEBB-DGCLKSJQSA-N	435.849	1.534	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cnccc2F)[nH]n1)c1cccc(B(O)O)c1	1817475303	NTBHEWXDRXMRJK-SFHVURJKSA-N	437.240	1.243	50	20	IDGD	
COC(C)(C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)n[nH]1	1818110868	REMKFUPXZWYRJJ-CBFMJHRQSA-N	443.508	1.961	50	20	IDGD	
Cc1cc(C)n2ncc(C(=O)Nc3nc4c(s3)C[C@@H](NC(=O)[C@@H](O)CCl)CC4)c2n1	1818237278	WKRICVKYDHRVQF-FZMZJTMJSA-N	448.936	1.628	50	20	IDGD	
COC[C@H](NC(C)=O)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@](C)(Cl)CCl)[nH]n1	1819611687	KTVGTWYSZUWZMA-PMUMKWKESA-N	448.351	1.789	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](C)n3ccccc3=O)sc2C1	1820130868	LWZNUCHLAZUYSG-AGIUHOORSA-N	438.937	1.732	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](C)CS(C)(=O)=O)[nH]n1	1822369480	GUQDSJZQCKSVFI-MBNYWOFBSA-N	434.946	1.336	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@H]1CCc2nc(NC(=O)Cn3ccncc3=O)sc2C1	1824536947	YJEVHBAGKKZRHH-DYZYQPBXSA-N	444.344	1.548	50	20	IDGD	
CN1N=C(C(=O)N2CCCC[C@H]2C2CCN(C(=O)[C@@H](F)Br)CC2)CCC1=O	1824925736	FMFMZSSFBTUXCA-GOEBONIOSA-N	445.333	1.905	50	20	IDGD	
Cc1cccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)n1	1825849743	YSLQXXMJVPYCBG-QFIPXVFZSA-N	435.333	1.617	50	20	IDGD	
Cc1nc(C(=O)N[C@@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)ccc1F	1826080404	IUVAYDQYOJMLDP-GFCCVEGCSA-N	448.524	1.584	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(Cl)o1)CC2	1826085761	BPJUTFSZLNUDKT-JTQLQIEISA-N	439.925	1.988	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCCn1cccc1)CC2	1826092302	YLBKUGWGKOWDIN-HNNXBMFYSA-N	446.577	1.710	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@H]1CCc2nc(NC(=O)CCn3cncn3)sc2C1	1826608523	NJHXICLQHFVLIV-MGPLVRAMSA-N	431.349	1.973	50	20	IDGD	
O=C(CC(F)(F)F)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827051066	MIHQVCLAXUKFFC-QGZVFWFLSA-N	426.244	1.552	50	20	IDGD	
C=CCC(F)(F)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827053645	WTQBQTZUVKMBCG-LJQANCHMSA-N	434.292	1.811	50	20	IDGD	
CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H](F)Cl)CC1	1827615725	GWEMBIYHFRSWEN-KZNAEPCWSA-N	441.935	1.611	50	20	IDGD	
O=C([C@H](F)Cl)N1CCC([C@@H]2CCCCN2C(=O)CS(=O)(=O)N2CCCC2)CC1	1827675186	CMUDZDMQWOLFFQ-RDJZCZTQSA-N	437.965	1.566	50	20	IDGD	
C/C=C/C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCN2C(=O)OCc1ccccc1	1828551313	MOAASXBKTIZFLO-CKCUPWHLSA-N	449.935	1.614	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3nccc4nc[nH]c34)C2)C1	1830358762	ZJHJQZJLZVGPEW-FQEVSTJZSA-N	435.912	1.293	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)/C=N/N3CCCCC3)C2)C1	1831652244	XGGDBTRHJAINIV-FXDLTUPKSA-N	428.961	1.322	50	20	IDGD	
O=C([C@@H](F)c1ccccc1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1832224589	AKDRNMHIWZDZJJ-RLFYNMQTSA-N	447.276	1.844	50	20	IDGD	
CO[C@@H](C(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)CCl)CC2)CC1)c1ccccc1	1833309010	IVMHEALCWNWYAA-VQTJNVASSA-N	437.968	1.545	50	20	IDGD	
Cc1cc(CC(=O)NC2CCN(C3CCN(C(=O)CO[Si](C)(C)C)CC3)CC2)nn1C	1833368373	DWFGJKQJJPBSIR-UHFFFAOYSA-N	449.672	1.694	50	20	IDGD	
Cc1cncc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](C)CBr)C3)C2)c1	1834277870	GVGQOKIDYUJRMY-HNAYVOBHSA-N	440.338	1.491	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(CN(C(=O)CCN3CCCCC3)CCO2)C1	1835134893	PMBHQBUECHTUST-NRFANRHFSA-N	441.645	1.170	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@H](C)N3C[C@H]4C[C@H]4C3)CC2)CC1	1835676416	DAZIZPMTKZUMNT-LJCCNALRSA-N	441.016	1.152	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)Cc3cscn3)CC2)CC1)[C@@H](F)Br	1836412483	IFHPZQWUJDBTPU-MRXNPFEDSA-N	447.374	1.948	50	20	IDGD	
CNC(=O)CC(=O)N1CCC(OC2CCN(C(=O)[C@@H](C)CBr)CC2)CC1	1836670483	PJODAQZZDSTFKD-ZDUSSCGKSA-N	432.359	1.152	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccn4ccnc4c3)CCO2)C1	1836979866	DWDOVOFCQAPRPL-OAQYLSRUSA-N	434.924	1.669	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)c3ccccc3)CC2)CC1	1837778721	KBDBDUWLKDHFCT-UXHICEINSA-N	438.952	1.972	50	20	IDGD	
CCc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@](C)(Cl)CCl)C3)C2)no1	1838128298	KNYPVIOKPDQWKD-QZTJIDSGSA-N	434.320	1.543	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnc(Cl)s3)CCO2)C1	1838160911	CVDGFHNQBABXOZ-BZNIZROVSA-N	438.333	1.120	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3ccncc3O)CC2)CC1	1838447013	KUNKSQWTFNWXAA-KRWDZBQOSA-N	425.913	1.653	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C)n(C(F)F)n3)C2)C1	1839146005	IGPNSWAUVWAYHA-ACJLOTCBSA-N	434.871	1.674	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(F)ccc3OC)C2)C1	1839148592	CZEXVCJGCAGJJE-OXQOHEQNSA-N	428.888	1.922	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cscn3)C2)C1	1839151821	FAMDMXATXCMMPP-IAGOWNOFSA-N	436.361	1.378	50	20	IDGD	
O=C(c1cc(O)cc([N+](=O)[O-])c1)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1839414775	AUWQUYRPWFLPBE-QGZVFWFLSA-N	448.259	1.174	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(C)c4n[nH]cc4c3)CCO2)C1	1839511306	QYQCRVBSGOTPQV-UTKZUKDTSA-N	434.924	1.959	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc4ccoc4c3)CCO2)C1	1839536814	ADODQIFIJGOELC-UTKZUKDTSA-N	436.892	1.757	50	20	IDGD	
C#CCCCCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](Br)CC)CCO2	1839967758	XXNYVCWSKRDVBL-APWZRJJASA-N	429.355	1.810	50	20	IDGD	
Cc1csc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)c1	1840030832	XZTHXMOKXDKHIE-SUMWQHHRSA-N	431.352	1.910	50	20	IDGD	
COc1ccsc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2	1840034319	HWBKJDFMMZLGOY-PXAZEXFGSA-N	447.351	1.610	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](OC)c3ccccc3)C2)C1	1840151710	MCTFFALBTVNDFJ-DBXWQHBBSA-N	440.924	1.084	50	20	IDGD	
C[C@H](Cc1ccco1)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCBr)C2)C1	1840468817	QLBPVSJZUIUHIL-DNVCBOLYSA-N	443.338	1.700	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CC2(CCCN2C(=O)[C@H](C)CBr)C1	1841289642	LRPPQWGTCXPZNC-QLFBSQMISA-N	427.339	1.976	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCCC12CN(C(=O)Cc1cccnc1)C2	1841924501	TUADKMLRBPFTRS-INIZCTEOSA-N	436.940	1.960	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)Cc2c(C)noc2C)C1	1841926746	SGUUTRDIPUJUOD-OEAKJJBVSA-N	426.477	1.171	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC2(CCCN2C(=O)Cc2ccc(S(C)(=O)=O)cc2)C1	1842811335	VZLAOLDHODIZRN-UHFFFAOYSA-N	438.622	1.688	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)c2ccc(-c3cccnc3)cc2)C1	1845277380	GYDONUTUFNKVBY-UHFFFAOYSA-N	441.296	1.559	50	20	IDGD	
O=C([C@@H](O)CCl)N1CC2(CCCN2C(=O)c2cccc(Br)c2[N+](=O)[O-])C1	1845468333	YXLJOTWWLOEDKU-LBPRGKRZSA-N	446.685	1.774	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)CCCn1c(O)nc3ccccc31)C2	1846363501	MVQNFNQSYDOALO-HNNXBMFYSA-N	434.924	1.979	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(CNC(=O)NNC(=O)Cc2ccc(F)cc2)s1	9943476	IBYCNZFEEVPTTG-UHFFFAOYSA-N	442.538	1.991	50	20	IDGD	
Nn1c(SCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)nnc1-c1cccc(Cl)c1	11310389	ZPHUDEFONVNLGI-UHFFFAOYSA-N	447.864	1.774	50	20	IDGD	
CCCn1nc(C(=O)NNS(=O)(=O)c2cc(C(=O)O)ccc2C)c2ccccc2c1=O	13028840	UDRRQRTXEIRQGN-UHFFFAOYSA-N	444.469	1.436	50	20	IDGD	
O=C(NNC(=O)c1cc(S(=O)(=O)N2CCOCC2)ccc1F)c1ccccc1F	15991500	CEZTVSAIVGXTDW-UHFFFAOYSA-N	425.413	1.061	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)CN(C)C3=NS(=O)(=O)c4ccccc43)cc2C1	20938465	XKQZVVJVTONXPB-GFCCVEGCSA-N	446.554	1.715	50	20	IDGD	
Cc1ccccc1CC(=O)N1CCN(CC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)CC1	109955427	VMYUMTVNUJDLTA-UHFFFAOYSA-N	439.472	1.051	50	20	IDGD	
CCc1[nH]nc(C(=O)NNC(=O)[C@@H](C)Oc2cccc(Br)c2)c1[N+](=O)[O-]	726382319	PXQZWSIXLNTAGN-MRVPVSSYSA-N	426.227	1.871	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)C[C@@H](C)NC(=O)C2CCCC2)c2ccccc2c1=O	727098625	DQFDIBHCAFCLAH-CQSZACIVSA-N	427.505	1.653	50	20	IDGD	
Cc1cccc(-n2c(C)cc(/C=C(/C#N)C(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)c2C)c1	728382356	IMAMQFKGQNZTGI-BEWREHSGSA-N	440.525	1.892	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NN=Cc1cc(Br)cc(Br)c1O	728436583	QYMODAZRWKMSOC-ZCFIWIBFSA-N	443.117	1.305	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)CCCN2C(=O)NC(C)(C)C2=O)c1	728529337	ZALZMDSYFAATIR-UHFFFAOYSA-N	441.282	1.329	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-])C1CCN(c2ncccn2)CC1	728853902	GVEMCJTVLVDHTK-UHFFFAOYSA-N	440.869	1.264	50	20	IDGD	
O=C(NCc1ccc(OC2CCCC2)nc1)NNC(=O)C1CCN(c2ncccn2)CC1	728945645	CZGZSUXJIMBARI-UHFFFAOYSA-N	439.520	1.940	50	20	IDGD	
Cc1c(C(=O)N([C@@H]2CCS(=O)(=O)C2)N(C)C)nnn1-c1ccc(OC(F)F)cc1	731163677	RGXVMFISOMQTMZ-CYBMUJFWSA-N	429.449	1.283	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)N1CCN(S(=O)(=O)c2ccc(C(C)C)cc2)CC1	731849294	ZLLRQRWVUVJQFT-QGZVFWFLSA-N	438.594	1.698	50	20	IDGD	
C[C@H](CC(=O)NNC(=O)c1cccc(N(C)C)c1)NS(=O)(=O)c1cccnc1Cl	731891929	SYAAQXIDNRIVGV-GFCCVEGCSA-N	439.925	1.319	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)N1CCN(S(=O)(=O)c2ccc(Cl)cc2)CC1	732195738	SAMRHXMLYFRFDW-CQSZACIVSA-N	430.958	1.228	50	20	IDGD	
C[C@@H]1C[C@@H]1C(=O)Nc1ccc(C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1	732328494	ZTHGMJBJIWCGID-PXAZEXFGSA-N	440.412	1.807	50	20	IDGD	
Cc1cc(NC(=O)[C@@H](C)SCC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)no1	733110806	VFYYJAPNMOASHQ-CYBMUJFWSA-N	428.474	1.690	50	20	IDGD	
C[C@@H]1CC[C@@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)[C@H](C)C1	733651371	MTNQKSCPWQNAIA-IIDMSEBBSA-N	438.550	1.476	50	20	IDGD	
O=C(NNc1cnnc2ccccc12)[C@@H]1CCCN1S(=O)(=O)c1cccc([N+](=O)[O-])c1	733808930	OBTXSJVFFOXZEY-SFHVURJKSA-N	442.457	1.834	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](NC(=O)NNC(=O)CNC(=O)c2cccs2)C1	734167803	COQUPBYWNPWXFW-LBPRGKRZSA-N	425.511	1.208	50	20	IDGD	
Cc1cc(S(=O)(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)ccc1[N+](=O)[O-]	734420167	YLBUXLBVXBHLSI-UHFFFAOYSA-N	441.491	1.128	50	20	IDGD	
Cc1cc(C(=O)NNc2nc(-c3ccc(Cl)cc3)no2)nc2c1c(=O)n(C)c(=O)n2C	737850531	CVSXRLYAIREPEJ-UHFFFAOYSA-N	441.835	1.401	50	20	IDGD	
Cn1nc(Br)c2c(=O)n(CC(=O)NNc3ncccc3C(F)(F)F)cnc21	740092260	YYCQFGRIQSLWTG-UHFFFAOYSA-N	446.187	1.450	50	20	IDGD	
CCCn1nc(C(=O)NNS(=O)(=O)c2ccc(C#N)cc2C)c2ccccc2c1=O	740809592	DAYPTPXDUQJLBG-UHFFFAOYSA-N	425.470	1.610	50	20	IDGD	
CN(CCCC(=O)NNC(=O)c1cccc(Cl)c1)C1=NS(=O)(=O)c2ccccc21	741884348	AAIKPHFYIOVSSL-UHFFFAOYSA-N	434.905	1.962	50	20	IDGD	
CCO[C@@H](C)c1noc(CN2CCN(C(=O)/C(C#N)=C\c3cc(C#N)n(C)c3C)CC2)n1	742793258	LRUZRWSOMLFAMH-PMFHANACSA-N	437.504	1.937	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)NNC(=O)CCc2ccco2)cc1Cl	743574542	UHMWUFDKWAUMHN-UHFFFAOYSA-N	425.829	1.950	50	20	IDGD	
O=C(NCCC(=O)N1CCN(c2ccccn2)CC1)NNC(=O)c1cccc2ccccc12	745789577	NATOVSCREFKOBL-UHFFFAOYSA-N	446.511	1.918	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)N[C@H]1CCN(c2ccc(Cl)cc2)C1=O	745835111	TZXGPNUQRDCUOB-AWEZNQCLSA-N	433.808	1.703	50	20	IDGD	
Cc1nc(C)c(CNC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)s1	745861580	MRHDRWQMRFEZOS-UHFFFAOYSA-N	437.547	1.689	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)c2c(C)cc(=O)n(CC(=O)NC(C)C)c2C)cc1	746097191	WKLYORDZSAYXLW-UHFFFAOYSA-N	428.489	1.138	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)N[C@@H]2CCN(CC(F)(F)F)C2)nc1	747308201	NZXHTJBOWNGDLT-GFCCVEGCSA-N	438.476	1.375	50	20	IDGD	
C[C@H](NC(=O)c1ccc(Cl)cc1)C(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	748127197	ZRMNVOIUTZTAJX-NSHDSACASA-N	448.819	1.371	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)c2ccc(S(=O)(=O)CCCC#N)cc2)cc1	748343699	LTQJXFQSTPQSPC-UHFFFAOYSA-N	430.486	1.646	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)NC[C@@H](c1ccc(Cl)cc1)N1CCOCC1	748624824	OXBKVXHFEYSCOK-PBHICJAKSA-N	428.917	1.095	50	20	IDGD	
O=C(NCC(=O)N1CCN(c2ccccc2)CC1)NNC(=O)c1cc2c(s1)CCC2	749220938	OOTHIXHNPHMBMG-UHFFFAOYSA-N	427.530	1.530	50	20	IDGD	
N#C/C(=C\c1ccc(O)cc1)C(=O)OCC(=O)N(C1CCCC1)[C@H]1CCS(=O)(=O)C1	750664858	YUMICCDLCQPXPH-FYXHJSOBSA-N	432.498	1.801	50	20	IDGD	
CC(C)[C@H](NS(=O)(=O)c1ccc(Br)cc1)C(=O)NNC(=O)c1ccc[nH]1	750894628	ZESZALYNNPBSSO-AWEZNQCLSA-N	443.323	1.541	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)[C@H]1CC1(C)C)N(S(C)(=O)=O)CC2	752261636	MSWKJQNTTVXMLB-HUUCEWRRSA-N	439.534	1.146	50	20	IDGD	
CC[C@@H](NC(=O)NNC(=O)Nc1cc(Cl)c(OC)cc1OC)C(=O)N1CCOCC1	753061801	ZYIMEOHTJBRNHE-GFCCVEGCSA-N	443.888	1.330	50	20	IDGD	
CC(=O)NC[C@H]1CCn2ncc(C(=O)NNC(=O)c3cc(-c4cccs4)[nH]n3)c2C1	753259216	QLBWDGZNHIPNMX-LBPRGKRZSA-N	427.490	1.108	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)N[C@H]2CCCN(Cc3ccccn3)C2=O)cc1C	753289340	LHFMTYKUNWDAFK-SFHVURJKSA-N	438.488	1.159	50	20	IDGD	
CCn1c(=O)nc(O)c2c(C(=O)NNC(=O)CCc3ccccc3O)cc(C3CC3)nc21	754419090	DZXPTNDSCKTTNA-UHFFFAOYSA-N	437.456	1.494	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)Cc2cc(Cl)cc3c2OCC3)cc1OC	755090221	JEDAOYZIBSMNCV-UHFFFAOYSA-N	448.859	1.839	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)c1cccc(-n2ccnn2)c1	755380590	AGVPVRLMWWOBJF-UHFFFAOYSA-N	440.485	1.127	50	20	IDGD	
CSc1nsc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)n1	757591601	YMQQAUUIBNLAKW-UHFFFAOYSA-N	442.548	1.511	50	20	IDGD	
C[C@H]1C[C@@H](C)C[C@]2(C1)NC(=O)N(CC(=O)NNC(=O)Nc1ccc(N(C)C)cc1)C2=O	757644903	BBZYKOFQEUHRJW-GFENJXEQSA-N	430.509	1.652	50	20	IDGD	
COCc1nc2n(n1)C[C@H](NC(=O)CCC(=O)C(C#N)=C1N(C)c3ccccc3N1C)CC2	758328892	VCHIESOWWUKLFZ-OAHLLOKOSA-N	449.515	1.526	50	20	IDGD	
O=C(NN=Cc1ccc(N2CCCC2)nc1)c1cccc(S(=O)(=O)N2CCOCC2)c1	758360449	VYWGMKWAHLVLLW-UHFFFAOYSA-N	443.529	1.467	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)Nc1ccc([N+](=O)[O-])cc1F	758363665	VJQZMHZWYRMVGQ-UHFFFAOYSA-N	444.423	1.345	50	20	IDGD	
COCCOc1cc(C(=O)OCC(=O)NNC(=O)c2cccs2)nc2ccccc12	758842212	BIEADKVEXAESCW-UHFFFAOYSA-N	429.454	1.940	50	20	IDGD	
COc1cccc(C(=O)OCC(=O)NNC(=O)Cc2nc(C)cs2)c1OC(F)F	760187859	XHVHUQGSNVTXFZ-UHFFFAOYSA-N	429.401	1.608	50	20	IDGD	
O=C(NNC(=O)c1ccc(I)c(O)c1)c1cccc([N+](=O)[O-])c1	760799430	MCEMZLDEGVHZOE-UHFFFAOYSA-N	427.154	1.980	50	20	IDGD	
CC(C)(C)C(=O)NNC(=O)C(=O)Nc1cc(F)c(I)c(F)c1	761063231	FGGWRJSMTULIRJ-UHFFFAOYSA-N	425.173	1.701	50	20	IDGD	
COCCC1(CNC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)CCC1	761780351	IAYIMVYSAFQLAF-UHFFFAOYSA-N	426.539	1.153	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)c2ccc(OC)c(S(=O)(=O)NC3CC3)c2)n1	762908534	VIOXCWUIUWNLOE-UHFFFAOYSA-N	434.522	1.529	50	20	IDGD	
CS(=O)(=O)Cc1ccc(S(=O)(=O)NNC(=O)CSc2ccccc2O)cc1	763412555	WXFPKPIOTWZJHR-UHFFFAOYSA-N	430.529	1.039	50	20	IDGD	
O=C(NNC(=O)c1ccccn1)C(=O)Nc1cccc(C(=O)N2CCc3ccccc32)c1	763467624	RTHUJHLCWZJHDL-UHFFFAOYSA-N	429.436	1.684	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ccc(OC)c(OC)c2)ccc1Cl	763543124	LOMLQIWFVMODLL-UHFFFAOYSA-N	449.847	1.934	50	20	IDGD	
CCN(CC)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)cc1	763606402	ZJIPOPNYCVQSPB-UHFFFAOYSA-N	448.483	1.958	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)n(-c2ccccc2)n1	763694122	FMHOATCZCXVROV-UHFFFAOYSA-N	427.848	1.999	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(Cl)c(F)c2)c1	763718734	LYZUVURCOZMNGZ-UHFFFAOYSA-N	442.856	1.129	50	20	IDGD	
O=C(CN1CCCc2ccccc21)NNC(=O)C(=O)Nc1cccc(Br)c1	763746074	QCQPJDNFQVVYOT-UHFFFAOYSA-N	431.290	1.988	50	20	IDGD	
CCN(CC)C(=O)c1ccccc1NC(=O)C(=O)NNC(=O)c1cccc(N(C)C)c1	763754531	UQPGCDKQXWKHNL-UHFFFAOYSA-N	425.489	1.634	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)C(=O)Nc2ccc(F)cc2C#N)c2ccccc2c1=O	763791552	VIXVXPQITZXCMP-UHFFFAOYSA-N	436.403	1.388	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(-c3nnc4n3CCCC4)cc2)cc1	763819888	AOUUFAKHSRCBLL-UHFFFAOYSA-N	448.483	1.755	50	20	IDGD	
CC(C)(C)NC(=O)c1ccccc1NC(=O)C(=O)NNC(=O)COc1ccc(F)cc1	763840750	XDKUVRXTZVYCCX-UHFFFAOYSA-N	430.436	1.519	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(OC)c([N+](=O)[O-])c2)cc1	763865162	JCKIROGWPHNICG-GFCCVEGCSA-N	446.416	1.556	50	20	IDGD	
COc1ccc(Cn2nccc2NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)cc1	763977317	NPILQNYEPQGXHX-UHFFFAOYSA-N	443.847	1.699	50	20	IDGD	
CCOCCOCc1cccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)c1	764004766	UMTHSZWOFWRILL-UHFFFAOYSA-N	443.456	1.411	50	20	IDGD	
CNS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cccc(C(F)(F)F)c2)cc1	764037982	XRYIXKFEPRNHHT-UHFFFAOYSA-N	444.391	1.013	50	20	IDGD	
COc1cccc(-c2nsc(NC(=O)C(=O)NNC(=O)c3ccccc3OC)n2)c1	764047518	GETWSVPUESEEAK-UHFFFAOYSA-N	427.442	1.622	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccccc2C(=O)N2C[C@H](C)C[C@@H](C)C2)n[nH]1	764097524	FJYOSTZCILGKNB-CHWSQXEVSA-N	426.477	1.236	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2O1)C(=O)Nc1cc(F)ccc1OC[C@H]1CCCO1	764166622	FDAAWFQJJCAALS-DNVCBOLYSA-N	443.431	1.473	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CCc2ccccc2O)nc1I	764175924	NVTIDAHJQDZGHI-UHFFFAOYSA-N	441.225	1.794	50	20	IDGD	
C[C@H]1CN(Cc2cccc(NC(=O)C(=O)NNC(=O)c3cccc(C#N)c3)c2)C[C@@H](C)O1	764238117	PHJLRNYKRQAUKL-IYBDPMFKSA-N	435.484	1.567	50	20	IDGD	
COC(=O)c1c(NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)sc(C)c1C	764239775	TWFIRYZFEKWIPK-UHFFFAOYSA-N	428.470	1.892	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)C(=O)Nc1ccc(OC[C@@H]2CCCO2)cc1	764277291	AZCIHUVMYGCHDD-SFHVURJKSA-N	427.457	1.669	50	20	IDGD	
COCC(=O)NNC(=O)C(=O)Nc1ccnn1Cc1ccc(SC(F)(F)F)cc1	764302021	ICGCULKRTDKANV-UHFFFAOYSA-N	431.396	1.276	50	20	IDGD	
C[C@@H](C(=O)NNc1c(F)cc(C(=O)NC2CC2)cc1F)N1C(=O)NC2(CCCC2)C1=O	764334608	NETNJUNXGWJOJH-JTQLQIEISA-N	435.431	1.553	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2OC)c1)N(C)C	764457712	MTIRNSRJMAGXBU-KRWDZBQOSA-N	434.518	1.597	50	20	IDGD	
CCn1c(SCC(=O)NN=C(C)CS(C)(=O)=O)nnc1-c1ccc(OC)cc1	764751142	XFKJJUVHBQZDOB-UHFFFAOYSA-N	425.536	1.602	50	20	IDGD	
CCCCCCOc1ccc(C=NNC(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)cc1	764812714	PMBPSBDDJBTEMC-UHFFFAOYSA-N	440.504	1.543	50	20	IDGD	
CC(C)n1cc2c(n1)[C@H](NC(=O)NNC(=O)c1csc(N3CCOCC3)n1)CCC2	765195458	RBGPFRWZFSADRP-CQSZACIVSA-N	433.538	1.779	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)CCn3c(C)csc3=O)n[nH]2)cc1OC	765595679	BTROJFPMLAIIPE-UHFFFAOYSA-N	431.474	1.477	50	20	IDGD	
Cc1ccc(OCCC(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cc1C	765737085	VQASPBBDJZWLJJ-UHFFFAOYSA-N	438.528	1.678	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765738888	PUGJAYWNQTWLHG-INIZCTEOSA-N	444.919	1.713	50	20	IDGD	
CCCC1(C(=O)NNC(=O)CN2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)CCC1	766636352	NYBSVJRNDYYELW-UHFFFAOYSA-N	436.578	1.419	50	20	IDGD	
Nc1c(C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)cccc1[N+](=O)[O-]	766660577	NGLODXVZGVTRBH-UHFFFAOYSA-N	446.895	1.409	50	20	IDGD	
COCCOCC(=O)NC1CCC(C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)CC1	768268408	PRTLHOYIASKNMC-UHFFFAOYSA-N	449.533	1.237	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1	768639451	QZSJOVYSTHECGI-UHFFFAOYSA-N	432.418	1.345	50	20	IDGD	
C[C@@]1(c2ccc(F)c(Cl)c2)NC(=O)N(CC(=O)NNC(=O)NCC(F)(F)F)C1=O	770223236	QPAOPNGUIUJBAY-AWEZNQCLSA-N	439.753	1.139	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)N1CCO[C@H](CN2C(=O)c3ccccc3C2=O)C1	771215707	IMMPYDGQUGKIHN-AWEZNQCLSA-N	438.440	1.047	50	20	IDGD	
Cc1c(C=NNC(=O)C(=O)NCc2ccc(Cl)cc2)c(=O)n(-c2ccccc2)n1C	771566806	AHYTYYGLWCKQAT-UHFFFAOYSA-N	425.876	1.904	50	20	IDGD	
Cc1nn(C)c2sc(C(=O)N[C@@H](C)C(=O)O[C@H](C)C(=O)NNC(=O)CC(C)C)cc12	772152191	AGKQDWBCLYLDEL-NWDGAFQWSA-N	437.522	1.187	50	20	IDGD	
COc1cc(OC)cc(N2C[C@@H](C(=O)O[C@H](C)C(=O)NNC(=O)CC(C)C)CC2=O)c1	772180186	AKEINRBFSLIBMT-KGLIPLIRSA-N	435.477	1.182	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)c1nn(-c2ccc(F)cc2)ccc1=O	772188896	ZYYRBSSOXOVNDJ-UHFFFAOYSA-N	443.822	1.102	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H]2[C@H]3CCc4ccccc4[C@@H]32)c1	772631113	QZCKUFJJBYINIQ-GBESFXJTSA-N	428.514	1.609	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)[C@@]2(C)Cc3ccccc3C(=O)O2)C1	773421103	QWNLCJRUTPBLLB-OYHNWAKOSA-N	431.489	1.953	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(F)(F)F)cn2)cc1OC	773533319	SWJSUEZZELMQKO-UHFFFAOYSA-N	426.351	1.907	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2cccc(C#N)c2)c(C)c1S(=O)(=O)NC1CC1	773689335	UFICAYMTRQXROT-UHFFFAOYSA-N	427.486	1.698	50	20	IDGD	
CC(C)c1nccnc1NNC(=O)C(=O)Nc1ccc(C(=O)N2C[C@@H](C)O[C@H](C)C2)cc1	774000290	SFRWOJGTGYYNMY-HUUCEWRRSA-N	440.504	1.931	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)Nc1ccnn1[C@H]1CCS(=O)(=O)C1	776054576	GWSFOAIUAHMOLS-NEPJUHHUSA-N	425.442	1.002	50	20	IDGD	
COC(=O)C1(c2ccc(S(=O)(=O)NNC(=O)[C@H]3COc4ccccc4O3)cc2)CC1	776271910	LLPFLKRFILMCBN-QGZVFWFLSA-N	432.454	1.041	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2cc(OCC(F)F)ccn2)ccc1Cl	777956914	BZFONBRSKXBWLV-UHFFFAOYSA-N	434.808	1.101	50	20	IDGD	
CN(C)C(=O)COc1ccccc1C(F)(F)C(=O)NNc1nc(-c2cccnc2)no1	778727586	AHPCRWUWKJHCRI-UHFFFAOYSA-N	432.387	1.834	50	20	IDGD	
COc1ccc(C)cc1N1C[C@H](C(=O)NNC(=O)CCNC(=O)OC(C)(C)C)CC1=O	780974360	VKWHTKULTYFJEE-CQSZACIVSA-N	434.493	1.419	50	20	IDGD	
CCO[C@H]1C[C@](NC(=O)OC(C)(C)C)(C(=O)NNC(=S)NCCSC)C1(C)C	780988191	WBWPBNHPJWLKAF-SGTLLEGYSA-N	434.628	1.943	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)[C@@H]1CCCN(C2CCC2)C1	781402611	HFEFQHWQLOFXGV-HUUCEWRRSA-N	426.521	1.531	50	20	IDGD	
O=C(Cn1cc(NC(=O)C(=O)NNc2ccccc2Br)cn1)NC1CCCC1	782988461	IDPAAPCTBUINIR-UHFFFAOYSA-N	449.309	1.786	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)Nc2ccccc2C)cc1Cl	783411798	ZMOJFHKMIGYTNY-UHFFFAOYSA-N	434.836	1.992	50	20	IDGD	
Cc1cnn([C@H]2CCCc3ccccc32)c1NC(=O)C(=O)NN[C@@]1(C)CCS(=O)(=O)C1	783424400	DJRRALIXJPBTDU-UWJYYQICSA-N	445.545	1.254	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNc2ccc(-n3cccn3)nn2)sc2c1CCC2	783435974	FRFVSLINKLKZAN-UHFFFAOYSA-N	441.473	1.471	50	20	IDGD	
COc1c(Cl)cc(NC(=O)C(=O)NNC(=O)CNC(=O)c2ccco2)cc1Cl	784003538	ZFKLFPXLGCMARO-UHFFFAOYSA-N	429.216	1.111	50	20	IDGD	
CCCNS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2cccc([N+](=O)[O-])c2C)cc1	784358398	VQUYHEJCOPWQBG-UHFFFAOYSA-N	435.462	1.673	50	20	IDGD	
Cc1nn(C(C)(C)C)cc1C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	784580959	UXTIGDKBJPDBCJ-UHFFFAOYSA-N	433.534	1.806	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ccccc2Cl)cc1S(=O)(=O)NC1CC1	784772880	ATJYDXMPCJJUIB-UHFFFAOYSA-N	438.893	1.871	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2cccc(S(C)(=O)=O)c2)ccc1N1CCOCC1	784844510	KSFIZZUEZKEFBW-UHFFFAOYSA-N	432.502	1.317	50	20	IDGD	
CCNC(=O)N(C)NC(=O)C(=O)Nc1cccc(S(=O)(=O)N(C)C2CCCCC2)c1	784915419	NJORHOOSHNZSHT-UHFFFAOYSA-N	439.538	1.271	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2ncc(F)cn2)nn1CCCOc1ccc(F)cc1	784949486	LXYVNVCTWGZZKP-UHFFFAOYSA-N	431.403	1.811	50	20	IDGD	
O=C(NNc1cc(C(F)(F)F)ccc1F)C(=O)Nc1ccn(CCN2CCOCC2)n1	785166916	PSOSZIYNFKCFAD-UHFFFAOYSA-N	444.389	1.455	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2cc3c(cc2OC)CCC(=O)N3)n1	785238676	ZENVFVKKUIPCGW-UHFFFAOYSA-N	427.465	1.298	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)ccc1O	785615057	ZIBWBZDXNLZHPN-UHFFFAOYSA-N	432.908	1.633	50	20	IDGD	
O=C(NNC(=O)c1ccc2cncn2c1)c1cccc(S(=O)(=O)NCc2ccccc2)c1	785684066	IUUWORFDFPWVIY-UHFFFAOYSA-N	449.492	1.888	50	20	IDGD	
COCCOc1ccc(F)cc1S(=O)(=O)NNC(=O)[C@H]1COc2ccccc2O1	786713793	LBIWXOHTLFOWSI-MRXNPFEDSA-N	426.422	1.000	50	20	IDGD	
CCNC(=O)Nc1ccc(C)c(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)c1	787568765	CQWVBSQIOSPQCF-UHFFFAOYSA-N	437.460	1.113	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)c1cccc(S(=O)(=O)N2CCCCC2)c1	788177697	ILGHSLCIEGOICR-UHFFFAOYSA-N	427.490	1.594	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1cccc2c1OC(C)(C)C2	789597975	UJXFSIZXSPLOPP-UHFFFAOYSA-N	433.486	1.894	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1nc2c(s1)CCCCC2	789732397	OVNBBUDBFXBBKU-UHFFFAOYSA-N	432.502	1.976	50	20	IDGD	
O=C(NNC(=O)[C@H]1OCC[C@H]1c1ccccc1)C(=O)Nc1ccc(NC(=O)C2CC2)cc1	789810864	RNMXTNRVTCAWCR-OALUTQOASA-N	436.468	1.694	50	20	IDGD	
CC(=O)c1cccc(S(=O)(=O)N2CCC(C(=O)NNc3nc4ccccn4n3)CC2)c1	791248316	LHIHQKZXOUIEIZ-UHFFFAOYSA-N	442.501	1.476	50	20	IDGD	
C[C@@](O)(Cn1cc(C(F)(F)F)ccc1=O)C(=O)NNC(=O)CCc1ccccc1O	792640518	BXIQALBUQJGIKD-GOSISDBHSA-N	427.379	1.104	50	20	IDGD	
O=C(CCc1ccco1)NNC(=O)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1	793026476	RZSZKFUPJDXFHH-UHFFFAOYSA-N	425.195	1.669	50	20	IDGD	
CN(C(=O)OC(C)(C)C)[C@H](C(=O)NNC(=O)c1ccc2c(c1)OCO2)c1cnn(C)c1	794756748	CJXOIZCZXRWARD-INIZCTEOSA-N	431.449	1.518	50	20	IDGD	
Cc1cc(=O)c(C(=O)NNc2ccccc2S(=O)(=O)N(C)C)nn1-c1ccccc1F	795182244	SBNNCVGUESRGOB-UHFFFAOYSA-N	445.476	1.687	50	20	IDGD	
CSc1ccc(C)c(NC(=O)C(=O)NNC(=O)CNC(=O)OCc2ccccc2)c1	797368994	LHUBWJRWBBIQEU-UHFFFAOYSA-N	430.486	1.729	50	20	IDGD	
CN(CCNC(=O)NNC(=O)c1ccc2ccccc2n1)S(=O)(=O)c1ccc(F)cc1	798098014	KWSFXPLTEBLXAO-UHFFFAOYSA-N	445.476	1.639	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cnn(CC)c2C(F)(F)F)o1	799259325	TZWACIWUGAUTEM-UHFFFAOYSA-N	444.414	1.756	50	20	IDGD	
CC(C)[C@H](NC(=O)C(F)(F)F)C(=O)NNC(=O)c1cc(Br)ccc1O	801625825	LXJGQDKHBUYQDE-JTQLQIEISA-N	426.189	1.619	50	20	IDGD	
COc1ccccc1[C@@]1(C)NC(=O)N(CC(=O)NNC(=O)Nc2cc(F)cc(F)c2)C1=O	802003261	KWSDUSMWKHQXKV-HXUWFJFHSA-N	447.398	1.593	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@@H](C(=O)NNC(=O)Nc2cc(F)cc(F)c2)[C@@H](C)O)cc1	802004314	MQUZXJRXQLZGPF-BDJLRTHQSA-N	442.444	1.154	50	20	IDGD	
Cc1nnnn1/C(=C/c1ccccc1)C(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	802063702	AUOGQXJCCINYRJ-SFQUDFHCSA-N	441.473	1.236	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@@H]2CC(c3cc(F)ccc3F)=NO2)cc1	802066658	UVVOXNFKUMFYDZ-INIZCTEOSA-N	438.412	1.714	50	20	IDGD	
COc1ccc(Cl)c(NC(=O)NNC(=O)C2=NN(c3ccccc3)[C@H](C(N)=O)C2)c1	802111702	POMIKRVXELVZGN-INIZCTEOSA-N	430.852	1.622	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCC(=O)OC2CCCCC2)c1	802452237	TWWMTVDKCJETQT-UHFFFAOYSA-N	440.522	1.147	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)C(=O)Nc1ccc(Br)c2cccnc12	802566950	JMRGEZDEKHPNLC-UHFFFAOYSA-N	428.246	1.721	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)N2CCN(C)CC2)c1	804025304	NGSNSPHXNSKARX-UHFFFAOYSA-N	447.517	1.098	50	20	IDGD	
COC(OC)c1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)o1	806306870	USAQNHUNVDZGFB-UHFFFAOYSA-N	437.474	1.430	50	20	IDGD	
COC(=O)c1cc(C)c(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)c(Cl)c1	806977232	ZYIHULNTIGMGBJ-UHFFFAOYSA-N	447.831	1.606	50	20	IDGD	
COc1cc(C)c(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)c(C)c1C	806997316	DTORDXDKTXPYNZ-UHFFFAOYSA-N	449.533	1.784	50	20	IDGD	
CCCCOc1ccc(OC)cc1NC(=O)C(=O)NNc1ccc(-n2ccnc2)nn1	807429122	LYISYXOOHLJSTF-UHFFFAOYSA-N	425.449	1.932	50	20	IDGD	
CCc1ccccc1OCC(=O)NNS(=O)(=O)c1ccc2c(c1)C[C@@H](C)N2C(C)=O	812541016	MUSKMEIRIMEHJJ-CQSZACIVSA-N	431.514	1.935	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](NC(=O)NNC(=O)CNC(=O)c2ccco2)CC12CCC2	813801769	UBWMQGHUWAZCFT-AWEZNQCLSA-N	449.508	1.662	50	20	IDGD	
O=C(NCCCN(C1CC1)S(=O)(=O)c1cccc(F)c1)NNc1ncncc1F	814314788	JKODLGAHTXNUET-UHFFFAOYSA-N	426.449	1.624	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cnc3c(F)ccc(F)c3c2)c1	814721933	BVEWEECYMOCDSS-UHFFFAOYSA-N	434.424	1.838	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)C(=O)Nc1cccc(C2CC2)n1	815565157	DZJFZZJLEXZKSO-UHFFFAOYSA-N	433.262	1.886	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)Cn2nc(C)cc2C)cc1)[C@H]1C[C@@H]1C	815566654	ALGMMVMEKGGAFM-SGTLLEGYSA-N	426.477	1.047	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2ccc([N+](=O)[O-])c(I)c2)ncn1	815593210	FMNYKGLQYOGVCR-UHFFFAOYSA-N	442.173	1.380	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)[C@H](c1ccccc1)N1CCC(O)CC1	817053935	MFDOXZKXZZXPRB-FQEVSTJZSA-N	432.546	1.578	50	20	IDGD	
C[C@]1(c2ccc(Br)cc2)NC(=O)N(CC(=O)NNc2ncncc2F)C1=O	817079009	DILSTMKKPIPINI-MRXNPFEDSA-N	437.229	1.289	50	20	IDGD	
COCCCNC(=S)N(C)NC(=O)CN1C(=O)NC2(CCC(C(C)(C)C)CC2)C1=O	899890095	HZXLKFMQPXEEAD-UHFFFAOYSA-N	441.598	1.387	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2ccc3oc(=O)ccc3c2)cc(OC)c1OC	903887755	CVQJUXCXGLSNGW-UHFFFAOYSA-N	434.426	1.442	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)CC(C)C)N(S(C)(=O)=O)CC2	913161854	ZLFSGKJXUQYJDN-HNNXBMFYSA-N	427.523	1.146	50	20	IDGD	
COc1ccccc1NC(=S)NNC(=O)c1cc(S(=O)(=O)N(C)C)ccc1F	913441286	VZSBGXFIEXKHPF-UHFFFAOYSA-N	426.495	1.716	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)CCNS(=O)(=O)c2cccnc2)c1	914830140	ZKYVFWFEIFAPSQ-UHFFFAOYSA-N	434.518	1.408	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)C2=S=C3CCCCCCC3=C2)o1	914846413	IQZKBXRSMCBENG-UHFFFAOYSA-N	425.532	1.663	50	20	IDGD	
CCCS(=O)(=O)N1CCC(NC(=O)NNC(=O)c2ccc(Cl)cc2OC)CC1	916379918	XZVBGDRUAVRIOE-UHFFFAOYSA-N	432.930	1.497	50	20	IDGD	
Cc1ccc(NCCCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)nc1	916521621	KBBMQNWXMYFQMD-UHFFFAOYSA-N	434.522	1.087	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)CCC(=O)N2CCc3sccc3C2)c2ccccc2c1=O	917529511	IMSJUJNFUKEBAN-UHFFFAOYSA-N	439.497	1.121	50	20	IDGD	
Cc1ccc([C@@]2(C)NC(=O)N(CC(=O)NNC(=O)c3ccc(Cl)cc3O)C2=O)cc1	918358015	SURPVRUQCSXWFT-HXUWFJFHSA-N	430.848	1.582	50	20	IDGD	
CNC(=O)COc1ccc(C(=O)NNC(=O)c2cc(-c3ccc(C)cc3)[nH]n2)cc1OC	919747946	KJBKWIUUKIMIQG-UHFFFAOYSA-N	437.456	1.593	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)CCCNC(=O)c1ccc(F)cc1	919809719	BKZQGKYPDOHTDW-UHFFFAOYSA-N	449.508	1.398	50	20	IDGD	
Cc1cc(C)c2c(-n3cccc3)c(C(=O)NNC(=O)N[C@@H]3CCS(=O)(=O)C3)sc2n1	919883033	ADHTTXHINSBZET-CYBMUJFWSA-N	447.542	1.835	50	20	IDGD	
Cc1ccc(Sc2ncccc2C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)cc1C	919888873	HOLTZZCPFDZJCF-CQSZACIVSA-N	434.543	1.981	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)Cn2cc(C)cn2)c1	920400180	CJQGFZQNCGDREB-UHFFFAOYSA-N	443.485	1.462	50	20	IDGD	
Cc1nn(-c2ccccn2)c2nc(C3CC3)cc(C(=O)NNC(=O)CN3CCCC3=O)c12	920805870	UAMIWBXSTPKDQS-UHFFFAOYSA-N	433.472	1.385	50	20	IDGD	
O=C(Cc1ccc(Cl)cc1)NNC(=O)c1cc(S(=O)(=O)N2CCSCC2)c[nH]1	921023152	VQUMFXDKKJSNTJ-UHFFFAOYSA-N	442.950	1.409	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)N[C@H]2CCO[C@]3(CCSC3)C2)cc1	1116307628	XZXPCDRWNKIFIA-SUMWQHHRSA-N	428.536	1.481	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccccc1)NNC(=O)c1ccc(COc2ccccc2)o1	1248407241	KCVCUHYOFZEUNQ-UHFFFAOYSA-N	429.454	1.598	50	20	IDGD	
Cc1nc2c(C#N)cnn2c(C)c1CCC(=O)NNC(=O)c1cncn1-c1ccccc1	1317851559	BEHDCWNWVDZKAB-UHFFFAOYSA-N	428.456	1.797	50	20	IDGD	
COc1cccc([C@@H]2[C@@H](C(=O)NNC(=O)c3n[nH]c4c3CCCC4)CC(=O)N2C2CC2)c1	1323487166	KNZNZFJHMOGKAC-LAUBAEHRSA-N	437.500	1.810	50	20	IDGD	
COc1ccc(CC(=O)N2CCO[C@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)cc1O	1779294440	GDBZPLLUTRCXKK-NRFANRHFSA-N	436.581	1.625	50	20	IDGD	
C[C@H](Cn1cncn1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(C)(C)CCl)C2	1779495969	RVTVCWOHKSNFRH-JXXFODFXSA-N	425.961	1.693	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3nccc(OC)c3OC)C2)C1	1780444857	GQGWEPWUXOZEMF-JLTOFOAXSA-N	425.913	1.950	50	20	IDGD	
Cn1cc(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](F)Br)C2)cn1	1780776887	HQMMXBKCHYQKSZ-UKPHBRMFSA-N	431.306	1.167	50	20	IDGD	
C[C@H](Cc1ccncc1)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781335091	VSCIPYBPAQTREG-DDUZABMNSA-N	428.302	1.781	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cccc(F)c3[N+](=O)[O-])C2)C1	1781773021	YAJZZAMRUSYGRB-DIFFPNOSSA-N	444.257	1.961	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)NC(C)=O)C1	1781789911	VMKDPXKMCFCQQV-MJXUCMMTSA-N	432.359	1.198	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1nccn1C)C2	1781900885	XKQASJPDQAJPAT-PMUMKWKESA-N	427.343	1.721	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)COc1ccc(O)cc1)C2	1782166376	DRSPYEIAINAJGP-DBXWQHBBSA-N	440.924	1.539	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc3cccnc3[nH]1)C2	1782175718	QBSREIXIQWZYOP-LUQKVYGDSA-N	434.924	1.944	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(CCN(C(=O)c3ccnc4ncccc34)C2)C1	1782337497	QCSRGRZRTCOTIH-IBGZPJMESA-N	433.306	1.858	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)nc2nccn12	1782357602	UVYVAKOIYOKLLK-FZKQIMNGSA-N	436.310	1.265	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)C3CCC4(CC3)OCCO4)C2)C1	1782943667	KKQFSWNZEFNROK-APWZRJJASA-N	430.929	1.003	50	20	IDGD	
CCC(=O)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](Br)Cc3ccccc3)C2)C1	1783021585	CRLRNXCXAZKBQS-OXJNMPFZSA-N	437.334	1.802	50	20	IDGD	
CCOc1ncccc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)Br)C[C@@H]21	1783390680	KYQPJMQZFHLDGP-VRKREXBASA-N	440.338	1.857	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3n[nH]c4c3CC[C@@H]4C)CCO2)C1	1783534549	WDUGTSMKTJEQSH-PZROIBLQSA-N	425.327	1.686	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)COc3ccc(O)cc3)[C@H]2C1	1783842527	JFZOBSKMIBVYHP-MGHWNKPDSA-N	426.897	1.005	50	20	IDGD	
CC(=O)N[C@@H](C(=O)N1CCO[C@]2(CCN(C(=O)C(Cl)Cl)C2)C1)c1ccc(F)cc1	1783948160	CVMBCOVWGJCGOL-BEFAXECRSA-N	446.306	1.637	50	20	IDGD	
Cc1ccn(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]3C2)n1	1783969271	KBBOTUPMIOYWDV-TUUVXOQKSA-N	427.343	1.202	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnn4c3CCC4)C[C@@H]21	1783973237	VMSODMLVGGOETL-RMRKRWHISA-N	439.354	1.454	50	20	IDGD	
CO[C@H](C)C(=O)N1CC[C@@]2(CN(C(=O)[C@H](Br)Cc3ccccc3)CCO2)C1	1783993724	FZHNSOHGIWBGJJ-MDYRTPRTSA-N	439.350	1.857	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](N)c3ccccn3)[C@H]2C1	1786872575	RUEIGBHOUNFRAF-JBJRXJHCSA-N	439.354	1.235	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc4c3OCC4)[C@H]2C1	1787818545	YWELWPKDDCZCHX-QCPWZWHMSA-N	437.334	1.998	50	20	IDGD	
Cc1ccn2c(=O)c(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)[C@@H](F)Cl)C[C@@H]43)cnc2c1	1788040224	SXXWPSQFEMCVEV-NZUILWFCSA-N	436.871	1.131	50	20	IDGD	
Cc1c(C(=O)NC2(c3ccc(NC(=O)c4cnccc4C(=O)NN)cc3)CCC2)cnn1C	1789521045	ASOQJGALSXOHBH-UHFFFAOYSA-N	447.499	1.789	50	20	IDGD	
CN(C)c1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]3C2)cn1	1789924502	IDZAESSEUPWJJE-RZLSGREXSA-N	443.317	1.431	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)COc3cccnc3)C[C@@H]21	1790958342	PTTLACYBGFCUDY-HJWJTTGWSA-N	440.338	1.614	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1ccc(C2(NC(=O)C[C@@](C)(O)CC(=O)O)CCC2)cc1	1791573025	XAHXIHOJOOMGQL-HNAYVOBHSA-N	426.897	1.990	50	20	IDGD	
CCN(CC)C[C@H](C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)CBr	1792872130	NLOIYGPLNYJRSI-BPKGMFCQSA-N	432.403	1.585	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CO)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C(C)(C)CCl	1792881928	CXIISSJXROCGEC-XGUBFFRZSA-N	431.961	1.775	50	20	IDGD	
O=C(CCCN1C(=O)c2ccccc2C1=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCl	1793110904	RCWYWYTWFOWHJY-BASYENTBSA-N	447.919	1.301	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)[C@@H]1CCc2ccccc2C1	1796192085	HDXRLKCUABADQU-TWHAJKEOSA-N	432.329	1.423	50	20	IDGD	
Cc1nn(-c2ccccc2)c(O)c1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Cl	1796362028	WKQZKRHADKVTQK-RMHZUWNSSA-N	436.871	1.624	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1c(Br)cnn1C	1797253458	WHIXTKQLSSRVBT-NOHGZBONSA-N	433.734	1.688	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1ccc2c(c1)CCCO2	1797849691	SWAYNUOMSILLLA-ACDBMABISA-N	442.560	1.565	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](Br)Cc1ccccc1)C2)c1ncon1	1798352326	ZGKFYVNYNGKJKT-FZKCQIBNSA-N	449.305	1.279	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN1CCCC1)C2	1799219629	YZPGKHHSOMGDRX-BJWYYQGGSA-N	444.488	1.868	50	20	IDGD	
C=C(CC(=O)OCC)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)CBr)C2	1799302058	VYMOPYCKMMQLKR-AYDFFVQHSA-N	431.327	1.116	50	20	IDGD	
COc1cc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Br)ccn1	1799344800	VXHQZJHTEYYWAN-DLTLXFJOSA-N	444.301	1.303	50	20	IDGD	
CS(=O)(=O)c1cncc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](F)Br)c1	1800157488	RERDRIGRYLAEFS-GFQSEFKGSA-N	448.314	1.427	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)c1ccccc1)C2	1800640186	YEKWMFVYMUHINK-BQJWPVKWSA-N	425.323	1.483	50	20	IDGD	
O=C(Cc1cccc(F)c1F)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2	1800665244	UULOLYHRASUEMG-OJXGSEEGSA-N	435.240	1.787	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(Cl)nc1Cl)C2	1800977118	RTHUSWOQDLYNQN-QPPBUOOMSA-N	436.723	1.845	50	20	IDGD	
COc1ccc(F)cc1CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2	1801099083	DQQDFVNPJIBLRB-HBCWATKFSA-N	443.313	1.751	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc(O)c([N+](=O)[O-])c2)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803141185	MKYVAYHQBCAUSB-JCGIZDLHSA-N	448.863	1.615	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)c2cocn2)[C@@H]1c1cccnc1	1806019390	XZBLNCQURKXGAN-YRJCQSRDSA-N	449.471	1.523	50	20	IDGD	
C[C@@H]1CCC[C@@H]1C(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1809662020	AWOJWBNGKDVTCY-NSAZKJPHSA-N	429.565	1.897	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2cnn3c2OCCC3)[C@H]1c1cccnc1	1813034176	CWMYTHMVRTXQTB-SZMVWBNQSA-N	447.923	1.634	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)C(Cl)Cl)[C@H]1c1cccnc1	1813081781	APVXUAGWZGGKRV-XJKSGUPXSA-N	430.336	1.264	50	20	IDGD	
COC(=O)[C@@H]1CC[C@H](C(=O)Nc2cc([C@@H]3CCCCN3C(=O)[C@H](O)CCl)[nH]n2)C1	1814859509	WMPUTYSSXQNASX-MYZSUADSSA-N	426.901	1.591	50	20	IDGD	
O=C(C[C@H]1CCCCO1)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1815602012	FABGMDSYULDXND-MJGOQNOKSA-N	440.309	1.355	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)Cc3cccnc3)sc2C1	1815705277	QGVCTAMUPZJWQK-CQSZACIVSA-N	430.534	1.066	50	20	IDGD	
Cc1cc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)n(C)n1	1816448148	USROSFGKUFBEMU-HNNXBMFYSA-N	430.513	1.131	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2C[C@@]2(F)Cl)[nH]n1)c1ccc(B(O)O)cc1	1817475746	RIDGBQUIYAHHFC-RFUYNDQBSA-N	434.664	1.320	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)Cc2ccccc2O)[nH]n1)c1cccc(B(O)O)c1	1817476909	GTEWDIPMIKEBTC-LJQANCHMSA-N	448.288	1.344	50	20	IDGD	
C[C@H](NC(=O)c1cnccn1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](F)Cl)[nH]n1	1819514619	QRZUXDMYPAQSIO-ZBINZKHDSA-N	437.863	1.545	50	20	IDGD	
CN1CCN(CC(=O)N2CCCC[C@H]2c2cc(NC(=O)[C@@H](F)Br)n[nH]2)CC1	1820933821	NYGCKGNEVSOCEL-XJKSGUPXSA-N	445.337	1.340	50	20	IDGD	
O=C(Cn1ccncc1=O)Nc1cc([C@H]2CCCCN2C(=O)CCBr)[nH]n1	1821654848	VCYKMXGDXYIGDX-CYBMUJFWSA-N	437.298	1.444	50	20	IDGD	
C[C@H](NC(=O)c1ccccn1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1	1821662987	XGVIHYUJAWHQGM-VBNZEHGJSA-N	448.911	1.215	50	20	IDGD	
CS(=O)(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1	1823014421	WFWFWFVBZIMPNJ-RDDDGLTNSA-N	442.332	1.180	50	20	IDGD	
CN[C@H](CC(=O)N1CCC([C@H]2CCCCN2C(=O)[C@H](C)CBr)CC1)C(=O)O	1824092716	GYXVNMGURQFIJN-FVQBIDKESA-N	446.386	1.700	50	20	IDGD	
Cc1ncc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)cn1	1825699955	NECVXWDCJQUUQF-NRFANRHFSA-N	436.321	1.012	50	20	IDGD	
O=C([C@@H]1CCCCO1)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827056023	QLGQXTNURLFVTR-RTWAWAEBSA-N	428.338	1.169	50	20	IDGD	
CC(C)(C)OCC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827056097	SEDMDIKANUJDSE-FQEVSTJZSA-N	430.354	1.415	50	20	IDGD	
Nc1n[nH]c(CCC(=O)N2CCCC[C@@H]2C2CCN(C(=O)CCBr)CC2)n1	1828801577	GUTVUPRLJHNFGU-CQSZACIVSA-N	441.374	1.724	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(F)nc3F)CCO2)C1	1829524248	GKIJDCZWALFLHO-AUUYWEPGSA-N	431.867	1.837	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3c[nH]c4cnccc34)C2)C1	1830361839	FWBPSZPXPZWWDV-OAQYLSRUSA-N	434.924	1.898	50	20	IDGD	
CC(C)(C)OC(=O)CCCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1830800405	FBSWRXHXOUHFSP-APWZRJJASA-N	436.908	1.489	50	20	IDGD	
O=C([C@H](F)Cl)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CCc3ccccc3[C@H]1O)CCO2	1830824715	NHVVKGJRTUDLOJ-DCXXXQMHSA-N	440.899	1.273	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](S)C(C)C)CCO2	1831499271	TUBNVVKBHZKFAC-ZQIUZPCESA-N	437.400	1.571	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3nnc(C)s3)CCO2)C1	1833014983	APTBLHJHLIFHSR-KXBFYZLASA-N	444.985	1.643	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cc4ncccc4[nH]3)CC2)CC1)[C@H](O)CCl	1833312492	WFLRVPHOOWTGFR-LJQANCHMSA-N	433.940	1.348	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3cc[nH]n3)CC2)CC1	1833564374	FIMYLWWQHJYFSZ-OAHLLOKOSA-N	426.359	1.768	50	20	IDGD	
C=CCCc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)c(O)n1	1833699178	UILLOHYQGRNMAI-OXQOHEQNSA-N	441.887	1.510	50	20	IDGD	
Cc1n[nH]c(C)c1C(=O)N1CCC(N2CCC(NC(=O)CCBr)CC2)CC1	1834423258	MVZSGPONRLYPMQ-UHFFFAOYSA-N	440.386	1.997	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@]3(CN(C(=O)CCBr)CCO3)C2)c(C)n1C	1834823079	HXQLOJOAHDRNHO-IBGZPJMESA-N	442.354	1.497	50	20	IDGD	
Cc1nc(C(=O)N2CCC(N3CCC(NC(=O)[C@@H](F)Cl)CC3)CC2)c(=O)[nH]c1C	1835078595	NSFGAKUPRPGKKF-MRXNPFEDSA-N	427.908	1.106	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)c3cn[nH]c3)CC2)CC1	1835169476	VNFJDOKHYMUCET-ZDUSSCGKSA-N	426.359	1.626	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](N)c1cccc(Cl)c1)CCO2	1835733288	LQOLPIRQAIOTRF-QKLQHJQFSA-N	444.359	1.814	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccsc3)CCO2)C1	1836102046	ZVNUOOAFCVYJHJ-QAPCUYQASA-N	445.379	1.921	50	20	IDGD	
CCNC(=S)NCC(=O)N1CCC(N2CCC(NC(=O)[C@@H](Cl)CC)CC2)CC1	1836397867	QSDWLIGOVMHXHV-INIZCTEOSA-N	432.034	1.059	50	20	IDGD	
C[C@@H](C(=O)N1CCC(N2CCC(NC(=O)[C@@H](F)Br)CC2)CC1)n1cncn1	1836414256	BGHPCYKVMDHYHH-SWLSCSKDSA-N	445.337	1.101	50	20	IDGD	
O=C(c1csnn1)N1CCC(OC2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1836943765	OMJOJHHLMCNTSU-CYBMUJFWSA-N	435.319	1.841	50	20	IDGD	
CC(=O)O[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1)C(C)C	1837213612	NBNYMUGGGJEIHJ-OXJNMPFZSA-N	432.945	1.296	50	20	IDGD	
O=C(c1ccc(O)cc1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1838971066	AIDSTTORIPBWCR-RHSMWYFYSA-N	431.258	1.153	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3cc(F)ccn3)C2)C1	1839142752	ZLQXIYDHAOKSDE-XLIONFOSSA-N	427.904	1.627	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(O)nc(Cl)c3)C2)C1	1839143424	WBCLFTCJGMTICI-SCLBCKFNSA-N	432.304	1.528	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4c(cnn4C)c3)C2)C1	1839145204	YRBLXBFROBJDCZ-UTKZUKDTSA-N	434.924	1.661	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(O)cn3)C2)C1	1839151127	IVNDYTNGKRNXFE-ZWKOTPCHSA-N	432.304	1.094	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(C)n4ccnc4n3)CCO2)C1	1839546705	DQQZENSWUMUOCA-IIBYNOLFSA-N	449.939	1.515	50	20	IDGD	
CO[C@@H](C)C(=O)N1CCOC[C@]2(CN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)CCO2)C1	1839744227	VWCUWBJUEBVLQI-QLBMNLSNSA-N	449.454	1.363	50	20	IDGD	
CCC(C)(C)C(=O)N1CCO[C@]2(COCCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)C1	1839853713	PPUBUJLZMDBPBT-OLCUMFGGSA-N	447.536	1.013	50	20	IDGD	
Cc1cccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)c1	1840034128	AXXCPBACWHYEOC-DNVCBOLYSA-N	425.323	1.848	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(OC)cc3C)C2)C1	1840154308	RUINJVUDMDONPJ-WIYYLYMNSA-N	440.924	1.327	50	20	IDGD	
COc1ncc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)cc1F	1840186710	SRPJQTFKDNIJLZ-QGZVFWFLSA-N	436.267	1.103	50	20	IDGD	
COc1ccc(F)c(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)c1	1840190789	MXBOSQDPPNOFNW-GOSISDBHSA-N	435.279	1.708	50	20	IDGD	
COc1ccc([C@@H](C)C(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)cc1	1841255949	JODGXEFENAKGTR-OAHLLOKOSA-N	437.500	1.314	50	20	IDGD	
Cc1nccc(C(=O)N2CC3(CCCN3C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)n1	1841924810	CJYSZCVFHBDPKD-HNNXBMFYSA-N	437.928	1.734	50	20	IDGD	
COc1cccc(CC(=O)N2CC3(CCCN3C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)c1	1843415687	AXBNXNVGDIOJIB-PCLIKHOPSA-N	437.500	1.575	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)[C@@H]2[C@H]3Sc4ccccc4[C@@H]32)C1	1844271297	XPYATFXAONBBKJ-AABGKKOBSA-N	434.326	1.071	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC2(CCCN2C(=O)c2ccc(-n3c(O)nnc3O)cc2)C1	1844739782	VHSJQAZLKZXUMS-UHFFFAOYSA-N	445.552	1.347	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1O	1847868436	BKVZEWPHMJRBBE-JSRQGNBESA-N	443.972	1.824	50	20	IDGD	
O=C(COC(=O)CCc1cnn(-c2ccccc2)c1)NNC(=O)c1ccc([N+](=O)[O-])cc1	16257726	FKAMAAYLWNSUQN-UHFFFAOYSA-N	437.412	1.718	50	20	IDGD	
CS(=O)(=O)NCCc1ccc(C(=O)NNC(=S)NCCc2cccs2)cc1	21126061	IGQNKQVBYWYCRU-UHFFFAOYSA-N	426.589	1.191	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc2c(c1)nc(CCC(=O)NNC(=O)c1ccccc1F)n2C	26691368	QGUXUABPCFJBFI-UHFFFAOYSA-N	447.492	1.357	50	20	IDGD	
Cc1ccc(NC(=S)NNC(=O)Cn2c(=O)ccn(Cc3ccccc3)c2=O)cc1C	725906298	AOBASAVJFNACAW-UHFFFAOYSA-N	437.525	1.693	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1cn(-c2cccc(C)c2)nn1	725965695	PRGFUDXACDQWKJ-UHFFFAOYSA-N	443.847	1.856	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)c2ccc(S(=O)(=O)N(C)CCO)cc2)c1C	728312288	LBGVFDVZEKUPJF-INIZCTEOSA-N	449.529	1.145	50	20	IDGD	
Cc1cccc(Oc2ccc(S(=O)(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)cc2)c1	728509750	MACGSNZBALVUMD-CYBMUJFWSA-N	427.504	1.035	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1CNC(=O)NNC(=O)c1cccc(OC(F)F)c1	728594533	SWOMEZIWHQMICF-UHFFFAOYSA-N	442.444	1.683	50	20	IDGD	
CNS(=O)(=O)c1ccc([C@@H](C)NC(=O)NNC(=O)c2cccc(OC(F)F)c2)cc1	728597935	UXHMHHCEHYNYQI-LLVKDONJSA-N	442.444	1.901	50	20	IDGD	
COc1ccc([C@H](CNC(=O)NNC(=O)COc2ccccc2O)N2CCOCC2)cc1	730901755	FDCNIFIWVIMLEQ-SFHVURJKSA-N	444.488	1.184	50	20	IDGD	
CCCc1[nH]nc(C(=O)NNC(=O)c2nn(CCC)c(=O)c3ccccc23)c1[N+](=O)[O-]	731631389	YRIUZVVZCRAQIE-UHFFFAOYSA-N	427.421	1.465	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cc(C)nc3c2c(O)nn3C)cc1Br	732176622	VYOAMLUUEGBJSI-UHFFFAOYSA-N	434.250	1.828	50	20	IDGD	
Cc1cc(-c2noc(CCC(=O)NNC(=O)CCN3C[C@H](C)O[C@@H](C)C3)n2)ccc1F	732262480	UHDLGPRXWYYKRW-GJZGRUSLSA-N	433.484	1.763	50	20	IDGD	
Cc1ccc(C2(C(=O)OCC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)CCOCC2)cc1	732384238	PJIPQTAWIVCJON-UHFFFAOYSA-N	441.440	1.956	50	20	IDGD	
COc1c(C(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)c(C)nn1C	732750191	KWOKMUPQACUQNL-UHFFFAOYSA-N	446.467	1.570	50	20	IDGD	
CN(c1ccc(CNC(=O)NNC(=O)NCc2ccc(Cl)cc2)cc1)S(C)(=O)=O	732997773	AYMRNFZRMZZVRB-UHFFFAOYSA-N	439.925	1.949	50	20	IDGD	
CC(C)[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)c1cc(-c2ccco2)nc2ccccc12	733251044	OBRVTBYDBBPOPX-GOSISDBHSA-N	430.486	1.830	50	20	IDGD	
CCN1CCC[C@@H]1CN1C[C@@H](C(=O)NNC(=O)c2cc(-c3ccc(C)cc3)[nH]n2)CC1=O	733358593	BHXGOXFTZJPLPX-ZWKOTPCHSA-N	438.532	1.479	50	20	IDGD	
CCc1ccccc1N1C[C@@H](C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)CC1=O	734241984	NOEVVYVUUBWPAO-HNNXBMFYSA-N	433.509	1.457	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)c1cccc(CS(N)(=O)=O)c1	734251565	IALQDIINIMONSG-UHFFFAOYSA-N	440.547	1.309	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NC2CCN(C[C@@H]3CCCO3)CC2)cc(OC)c1OC	734283710	SDHNBQARCLVJCB-INIZCTEOSA-N	436.509	1.300	50	20	IDGD	
CCN(CC)C(=O)CCCC(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	734821974	QQFYSBNMLDLYEW-UHFFFAOYSA-N	427.546	1.755	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)c2cccnc2-n2cccn2)CC1	734824557	CPKANPTYZZSZHJ-UHFFFAOYSA-N	429.481	1.611	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)c2ccc3c(c2)CCC(=O)N3)CC1	734824972	PEKBEXPGQYAIEA-UHFFFAOYSA-N	431.493	1.915	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2ccc(F)c(F)c2)cn1	735473029	KDWRWBCIMVINAS-UHFFFAOYSA-N	435.412	1.574	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN[C@@](C)(CO)c2cccc(C(F)(F)F)c2)n1	735493338	OJMAEIVGCYGYJJ-KRWDZBQOSA-N	430.452	1.658	50	20	IDGD	
CC(=O)NCC(=O)N1CCc2cc(C(=O)NNC(=O)Cc3c[nH]c4ccccc34)ccc21	735647000	FDXQGYFOMGMMTN-UHFFFAOYSA-N	433.468	1.197	50	20	IDGD	
Cc1ccccc1O[C@@H](C)C(=O)N1CCN(CC(=O)NNC(=O)c2ccc(F)cc2)CC1	736620264	BNQOUBMAHYZCKL-KRWDZBQOSA-N	442.491	1.507	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@@H](C)C(=O)N2CCCC[C@H]2C)c2ccccc2c1=O	737054709	SUCXTQWQWCNPSA-KGLIPLIRSA-N	428.493	1.150	50	20	IDGD	
CN(C)c1nccc(NNC(=O)C2CCN(S(=O)(=O)/C=C\c3ccccc3)CC2)n1	740107704	KXICXFKCNDIVCM-PTNGSMBKSA-N	430.534	1.698	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)N[C@H]2CCC[C@H](S(C)(=O)=O)C2)cc1OC	741093631	AZTJGYCCOGCIGY-GJZGRUSLSA-N	427.523	1.784	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc2nnc(SCC(=O)NNC(=O)C(C)(C)C)n2c1	742452452	SAUUZRMXTAJEMO-UHFFFAOYSA-N	442.567	1.045	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)CNC(=O)c2cc3ccccc3[nH]2)c2ccccc2c1=O	742474435	HYONRTMXAXFSIH-UHFFFAOYSA-N	446.467	1.650	50	20	IDGD	
NS(=O)(=O)c1ccc(CNC(=O)NNC(=O)Nc2ccc(OC(F)F)cc2)s1	743516720	RDYGKGHFIAEUQP-UHFFFAOYSA-N	435.434	1.533	50	20	IDGD	
CCc1nsc(N2CCCN(C(=O)NNC(=O)c3cnn(-c4ccccc4)c3)CC2)n1	743609221	QZUURYTWWLWWMC-UHFFFAOYSA-N	440.533	1.853	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@H]2C(=O)NNC(=O)NC2CCCC2)cc1	744053983	KZWMSDYJEODQKP-SFHVURJKSA-N	436.534	1.705	50	20	IDGD	
O=C(COC(=O)[C@H]1CCSc2ccccc21)NNC(=O)[C@@H]1COc2ccccc2O1	745427549	MHGQLPUDIODANH-YOEHRIQHSA-N	428.466	1.797	50	20	IDGD	
Cc1ccc(N2CCC[C@H](NC(=O)NNC(=O)Cc3nc4ccccc4n3C)C2=O)cc1	745881941	RQNCTEFJHLLRAX-SFHVURJKSA-N	434.500	1.950	50	20	IDGD	
COc1cc(C=NNC(=O)c2nn(C)c(=O)c3ccccc23)cc(Cl)c1OCC(N)=O	745985811	XTEDGMGRXAZZHH-UHFFFAOYSA-N	443.847	1.224	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)[C@]2(O)CCN(Cc3ccccc3)C2)c1	746214445	CLBFQTUICLJZSQ-FQEVSTJZSA-N	448.317	1.856	50	20	IDGD	
CC(C)c1nc(C#N)c(NNC(=O)c2ccc(S(=O)(=O)NC[C@H]3CCCO3)cc2)o1	746340010	WLXRDIMHAGOOPR-CQSZACIVSA-N	433.490	1.884	50	20	IDGD	
CC(=O)N1CC[C@@](C)(C(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)C1	746815878	GWBOTVSTROJRRA-XMMPIXPASA-N	447.495	1.464	50	20	IDGD	
C[C@H]1C[C@@H](CNC(=O)OC(C)(C)C)CN1CC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	752071980	GHJCLGHIUFVAOA-KBPBESRZSA-N	435.481	1.591	50	20	IDGD	
CC[C@@H](NC(=O)CCC(=O)C(C#N)=C1N(C)c2ccccc2N1C)C(=O)N1CCOCC1	752767399	HFSUFLHZHVPNSI-QGZVFWFLSA-N	439.516	1.411	50	20	IDGD	
CC(C)Nc1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cn1	752788815	JXBPCWWDCVWSJC-UHFFFAOYSA-N	431.518	1.761	50	20	IDGD	
N#Cc1ccc(N2C(=O)N[C@@H](CCC(=O)NNc3ccc(C(F)(F)F)nn3)C2=O)cc1	755187883	SYGLTAZGBDXQLR-LBPRGKRZSA-N	433.350	1.715	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)Nc1ccc(S(=O)(=O)N2CCC[C@H](C)C2)cc1	755447756	RFHKACXRGPVTHQ-GJZGRUSLSA-N	442.538	1.311	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)Nc1cc(C)nn1[C@@H]1CCS(=O)(=O)C1	755535521	QDPHCAVPNGMICX-OAHLLOKOSA-N	435.506	1.345	50	20	IDGD	
Cc1ccc(S(C)(=O)=O)cc1NC(=O)NNC(=O)CCCNC(=O)OC(C)(C)C	755537637	WTUDCVBODAPRKI-UHFFFAOYSA-N	428.511	1.856	50	20	IDGD	
COc1ccc(S(=O)(=O)NC2CC2)cc1NC(=O)NNC(=O)COc1ccc(C)cc1	755615849	VKARKWXFPPOYTE-UHFFFAOYSA-N	448.501	1.676	50	20	IDGD	
C=CCNC(=O)c1ccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1	756111376	PVHXDUADZJXZPM-UHFFFAOYSA-N	445.501	1.319	50	20	IDGD	
Cc1cc(C(=O)N2CCOCC2)ccc1NC(=O)NNC(=O)[C@H]1COc2ccccc2O1	757829754	FGPUUMASXNNVBK-LJQANCHMSA-N	440.456	1.460	50	20	IDGD	
Cc1nn([C@H]2CCS(=O)(=O)C2)c(C)c1NC(=O)NNC(=O)c1ccc2ccccc2n1	757872205	WJFFSTJEEXBEEO-HNNXBMFYSA-N	442.501	1.874	50	20	IDGD	
Cc1cnn(-c2ccc(C(N)=O)cc2NC(=O)NNC(=O)COc2ccc(F)cc2)c1	757877112	VAFYLGNGRFBCNC-UHFFFAOYSA-N	426.408	1.650	50	20	IDGD	
Cc1ccc(-n2cc(C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)c(-c3ccccc3)n2)cc1	758046534	TZISLODFAQHNJE-HNNXBMFYSA-N	441.513	1.546	50	20	IDGD	
CN1C(=O)C[C@H](C(=O)NNC(=O)[C@H]2COc3ccccc3O2)[C@H]1c1ccc(Cl)c(F)c1	758055887	UCHMMEIPARHPRB-OEPMTFCVSA-N	447.850	1.986	50	20	IDGD	
COC(=O)c1cn(C2CCN(C(=O)NNC(=O)c3cc4c(s3)CC[C@@H](C)C4)CC2)nn1	759211131	GMYJQIYQXXOUTE-GFCCVEGCSA-N	446.533	1.943	50	20	IDGD	
CCOC(=O)c1cc(S(=O)(=O)NNC(=O)c2ccc(OC(C)C)c(OC)c2)cn1C	760509599	LILQVRPIQOZGFB-UHFFFAOYSA-N	439.490	1.621	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	760801685	VJSAQERYMIYBAE-HNNXBMFYSA-N	449.464	1.262	50	20	IDGD	
CCCS(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)c2ccccc2O)c(OC)c1	761267215	PWDRXFMXDAYHNK-UHFFFAOYSA-N	443.503	1.176	50	20	IDGD	
O=C(CCn1ccnc1)Nc1cccc(C(=O)NNc2nccc(N3CCOCC3)n2)c1	762869277	UJINURCVYDBPPH-UHFFFAOYSA-N	436.476	1.295	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)c2ccc(S(=O)(=O)NC[C@@H]3CCCO3)cc2)n1	762906945	MXMZCYKEWHKAHQ-INIZCTEOSA-N	448.549	1.537	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2ccccc2C[S@](C)=O)c2ccccc2c1=O	762915591	CYOPTKAIGRRADZ-PMERELPUSA-N	427.486	1.761	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)COCC(=O)NCc3cccnc3)n[nH]2)cc1	763164430	NOUVCSOEWLUDMW-UHFFFAOYSA-N	436.472	1.128	50	20	IDGD	
Cc1cc([N+](=O)[O-])cc(S(=O)(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)c1C	763438549	BIRYBLLFVPYSSS-UHFFFAOYSA-N	430.483	1.826	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccccc2OCC2CC2)cc(OC)c1OC	763538453	BZTWLZUNLGXSHG-UHFFFAOYSA-N	443.456	1.901	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)[nH]n1)C(=O)Nc1ccccc1C(=O)N1CCCC1	763605581	VMTMSHONRJYZSW-UHFFFAOYSA-N	446.467	1.712	50	20	IDGD	
CCCN1C(=O)CCc2cc(NC(=O)C(=O)NNC(=O)COc3cccc(C)c3)ccc21	763623930	RGEIFHABFSKQGN-UHFFFAOYSA-N	438.484	1.849	50	20	IDGD	
CCN(CC)C(=O)c1ccccc1NC(=O)C(=O)NNC(=O)COc1cc(C)ccc1C	763665982	RSADWLYXIXGUHA-UHFFFAOYSA-N	440.500	1.950	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(Cl)ccc1C(=O)OC	763711338	HMQVGGVFLBMLLZ-UHFFFAOYSA-N	433.848	1.854	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccc(Cn2cccnc2=O)c1	763712448	RICIJBPCPWQFQF-UHFFFAOYSA-N	449.467	1.019	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)C(=O)Nc2c(C)cc(C)cc2C)cc1	763738390	UEHRGXBKTIRBKT-UHFFFAOYSA-N	446.529	1.327	50	20	IDGD	
CNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2sc(-c3ccccc3)nc2C)cc1	763901330	OBYRWFRZNMJZRL-UHFFFAOYSA-N	437.481	1.878	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(Cl)c(C(N)=O)c2)cc1OC	763911454	OMYPOYXKEBDRQX-UHFFFAOYSA-N	448.863	1.636	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccccc2-n2ccnn2)ccc1OC(C)C	763916857	WNQNNQXGOZTHDO-UHFFFAOYSA-N	438.444	1.463	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)Cc3ccc(Cl)cc3)cn2)C[C@@H](C)O1	763936086	CMINCGAHCGOHQK-OKILXGFUSA-N	445.907	1.677	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2ccc[nH]2)cc1NC(=O)c1cccc(F)c1	763980319	ZRIRAMTWJYUUTO-UHFFFAOYSA-N	439.403	1.814	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)C(=O)Nc1ccc(SC2CCCC2)cc1	764001889	GMGUCDNGDJROBU-GFCCVEGCSA-N	425.532	1.242	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1cccc(OCc2cccnc2)c1	764005398	WYUSHXOIBCLBAD-UHFFFAOYSA-N	448.435	1.832	50	20	IDGD	
COC(=O)c1c(NC(=O)C(=O)NNC(=O)c2ccccc2OC)sc2c1CCCC2	764047519	GFMBZTYKHLDCKW-UHFFFAOYSA-N	431.470	1.822	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2ccc(Br)cc2Cl)ncn1	764058409	HBRXDBFOSMLUKR-UHFFFAOYSA-N	428.630	1.301	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2cccc([C@H](C)N3CCOCC3)c2)c1O	764133807	XTYHMPVMVDZYIV-AWEZNQCLSA-N	442.472	1.194	50	20	IDGD	
N#Cc1cccnc1-n1cc(NC(=O)C(=O)NNC(=O)c2c(Cl)cccc2Cl)cn1	764221499	SHBRWVYBJJOYQV-UHFFFAOYSA-N	444.238	1.845	50	20	IDGD	
CCNC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2cccc(OC(F)F)c2)c1	764250093	IWMMVBQFTQNPEV-UHFFFAOYSA-N	435.387	1.829	50	20	IDGD	
COC(=O)CCOc1ccc(NC(=O)C(=O)NNC(=O)c2cccc3ncccc23)cc1	764252044	AHFOEUWHKIVHHV-UHFFFAOYSA-N	436.424	1.576	50	20	IDGD	
O=C(Cc1ccccn1)NNC(=O)C(=O)Nc1cc(Br)ccc1-n1cccn1	764266385	DAPNARFPSSAKIB-UHFFFAOYSA-N	443.261	1.358	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2O)c(C(F)(F)F)c1	764275053	IBZJCMJOUOXXMB-UHFFFAOYSA-N	427.335	1.585	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)cc(OC)c1OC	764379277	APFONKCTYVYISN-UHFFFAOYSA-N	439.371	1.470	50	20	IDGD	
O=C(Cc1ccc(Cl)cc1)NNC(=O)NCc1cccc(N2CCCS2(=O)=O)c1	765304343	PQYAXNDEIYPLPD-UHFFFAOYSA-N	436.921	1.953	50	20	IDGD	
CC(C)(C)OC(=O)NNC(=O)C(=O)Nc1ccc(C(=O)N2CCOCC2)c(Cl)c1	765391121	OUXKNSFDUCLXDF-UHFFFAOYSA-N	426.857	1.307	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)c1ccc([N+](=O)[O-])cc1F	765754964	AVLLXFAQUIAIAY-UHFFFAOYSA-N	449.870	1.966	50	20	IDGD	
O=C(NCC1CCN(S(=O)(=O)C(F)(F)F)CC1)NNc1ncnc2ccsc12	765775598	MFDDMVVHWULUJI-UHFFFAOYSA-N	438.457	1.879	50	20	IDGD	
O=C(/C=C\c1ccc2[nH]ccc2c1)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765804943	PTILWUXGQRXAKL-CLFYSBASSA-N	431.496	1.787	50	20	IDGD	
CS(=O)(=O)c1cccc(Oc2ccc(NC(=O)C(=O)NNc3cnccn3)cc2)c1	766260715	SPKISWHJBIZHCF-UHFFFAOYSA-N	427.442	1.754	50	20	IDGD	
CCC(=O)N1CCC[C@@H](C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)C1	766664921	XSUJPSDYLFTZSK-GOSISDBHSA-N	449.983	1.254	50	20	IDGD	
COc1ccccc1N1C[C@H](C(=O)OCC(=O)NNC(=O)Cc2ccccc2C)CC1=O	767263950	YAFQRDHDYBPFSA-QGZVFWFLSA-N	439.468	1.290	50	20	IDGD	
CCOc1ccnc(N2CCCN(CC(=O)NNC(=O)Cc3ccccc3C)CC2)n1	767911610	IUWAEQVLPPMKNP-UHFFFAOYSA-N	426.521	1.086	50	20	IDGD	
N#Cc1cccc(NNC(=O)Nc2ccc(S(=O)(=O)N[C@H]3CCS(=O)(=O)C3)cc2)c1	769936386	FESCKXZUWXFYCB-INIZCTEOSA-N	449.514	1.172	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)CCCC[C@@H]3SC[C@H]4NC(=O)N[C@H]43)nc21	770967602	XYXUNBYFKGMDTN-MBNYWOFBSA-N	448.553	1.456	50	20	IDGD	
C[C@H](NS(=O)(=O)c1ccc(C(N)=O)cc1)C(=O)NNc1cccc(C(F)(F)F)c1	770968651	NYMDOCKSBNJBFI-JTQLQIEISA-N	430.408	1.614	50	20	IDGD	
O=C(CNC(=O)c1c(F)cccc1Cl)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772182358	HSNYRODRHVDPDI-UHFFFAOYSA-N	441.246	1.326	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)Nc2ccc(N3CCOCC3)cn2)cc1	772402117	FURMZGUXHFQNLH-HNNXBMFYSA-N	429.477	1.937	50	20	IDGD	
Cc1cc(S(=O)(=O)NCCNC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c(C)s1	772623394	FKSCJTZYCRQLBD-UHFFFAOYSA-N	441.491	1.196	50	20	IDGD	
CC[C@@H](C)NS(=O)(=O)Cc1cccc(NC(=O)C(=O)NNc2nc(C)cc(C)n2)c1	773482357	XKSGIJAFUSOLED-GFCCVEGCSA-N	434.522	1.393	50	20	IDGD	
Cn1nc(-c2cc(F)cc(F)c2)cc1NC(=O)C(=O)NNc1cccc(S(C)(=O)=O)c1	773487830	GJKIASYYZMLCHY-UHFFFAOYSA-N	449.439	1.851	50	20	IDGD	
COCCCS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2)cc1	773644773	QKNUODBNWDCFCJ-UHFFFAOYSA-N	436.446	1.487	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@@H](NC(=O)NNC(=O)CNC(=O)c1ccco1)C1CCCC1	775122580	XGOONXUWBZQLGR-CQSZACIVSA-N	437.497	1.423	50	20	IDGD	
CC(C)[C@H]1CC(=NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)CCO1	776758112	GOKQBOHLGLHGBJ-HXUWFJFHSA-N	437.562	1.947	50	20	IDGD	
CC1CCC2(CC1)OC[C@@H](CNC(=O)NNC(=O)c1nn(C)c(=O)c3ccccc13)O2	777761380	MOOLSUVHMXIGGS-YZGUTLMUSA-N	429.477	1.199	50	20	IDGD	
COC(=O)Cc1cccc(C(=O)NNC(=O)c2ccc(CSc3nncn3C)cc2)c1	777763197	YNDOGSZNNGBMKE-UHFFFAOYSA-N	439.497	1.898	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)CCc2c(C)nc3c(c(OC)nn3C)c2C)nc1C	778427489	ZGILOOCEZZZYAR-UHFFFAOYSA-N	441.492	1.945	50	20	IDGD	
COc1cc(OC)c(NC(=O)C(=O)NNC(=O)c2ncccc2C)cc1Br	778713777	MJLZDJKJDAEOME-UHFFFAOYSA-N	437.250	1.569	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)nn1-c1cccc(C#N)c1	780315323	RRFFQEPCKJXLDJ-UHFFFAOYSA-N	427.424	1.374	50	20	IDGD	
COc1cccc(NNC(=O)CN2C(=O)N[C@@](C)(c3ccc(Br)cc3)C2=O)n1	780770823	WFTNCTFRIVDNND-SFHVURJKSA-N	448.277	1.763	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2ccc(OC3CCCC3)nc2)cc1	781666166	LKBZWUHVRTZKOP-UHFFFAOYSA-N	446.529	1.793	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cnn(C)c2C(F)(F)F)c1C	782121052	QKQPPJKFCSCNQR-NSHDSACASA-N	427.383	1.609	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C(=O)Nc2ccc(OCC(F)(F)F)cc2)nc2ccccc21	782885225	GOMAEVDMIRXBQK-UHFFFAOYSA-N	449.389	1.843	50	20	IDGD	
CS(=O)(=O)NCc1ccc(NC(=O)C(=O)NNc2ccccc2Br)cc1	782983684	HAELCIJETMSTAI-UHFFFAOYSA-N	441.307	1.580	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(OC)c(NC(=O)C(=O)NNc2cccc(F)c2)c1	783035912	IUOHSZRJOFFJLD-UHFFFAOYSA-N	438.481	1.947	50	20	IDGD	
Cc1ccc(C(=O)N2CCOCC2)cc1NC(=O)C(=O)NNc1ncnc2ccsc12	783262210	NZDRCDWZGOOMIO-UHFFFAOYSA-N	440.485	1.554	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)C(=O)Nc1ccccc1OC(F)F	784214616	ALASTMXXIIHQDR-UHFFFAOYSA-N	440.428	1.811	50	20	IDGD	
Cn1ccnc1C(=O)c1ccc(NC(=O)C(=O)NNc2cccc(S(C)(=O)=O)c2)cc1	784841562	KVGVNOZVJXNFOR-UHFFFAOYSA-N	441.469	1.136	50	20	IDGD	
CCOC(=O)Nc1ccc(NC(=O)C(=O)NNc2cccc(C(=O)OC)c2)cc1C#N	784855336	YLZYFWJYFYYPLZ-UHFFFAOYSA-N	425.401	1.995	50	20	IDGD	
N#Cc1ccc(NNC(=O)C(=O)Nc2ccc(N3CCC(C(N)=O)CC3)cc2)cc1Cl	785093227	NUHDKVDDULJVIB-UHFFFAOYSA-N	440.891	1.995	50	20	IDGD	
COC(=O)CCNC(=O)c1ccc(NC(=O)C(=O)NNc2ccc(OC)c(Cl)c2)cc1	785117153	NURYBRBZPDCABJ-UHFFFAOYSA-N	448.863	1.723	50	20	IDGD	
N#C/C(=C/C1CC1)C(=O)OCC(=O)NCCN1C(=O)S/C(=C\c2cccnc2)C1=O	786674973	YTOKZLQBQQFXRO-SRKDFGFSSA-N	426.454	1.637	50	20	IDGD	
Cc1ccc(Br)nc1C(=O)NNC(=O)c1sc(N2CCOCC2)nc1C	786689544	WNJDFQMPNIUMIN-UHFFFAOYSA-N	440.323	1.829	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(C(F)(F)F)c2)cc1N1CCNC1=O	787545064	ZTDGZZHIYPCSBL-UHFFFAOYSA-N	449.389	1.943	50	20	IDGD	
CCNC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)CCc2ccc(OC)cc2)c1C	789733573	OFHPPITZHNBJAH-UHFFFAOYSA-N	441.488	1.864	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)N1CCC[C@@H](N2CCCS2(=O)=O)C1	789842014	SQWZBFWMCXKCAM-UKRRQHHQSA-N	444.941	1.348	50	20	IDGD	
CNC(=O)c1cc2cc(NC(=O)C(=O)NNC(=O)COc3cc(C)cc(C)c3)ccc2[nH]1	792355572	TXWNPQARWLDMTN-UHFFFAOYSA-N	437.456	1.309	50	20	IDGD	
CC(C)Oc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C(C)(C)C)cc2)nn1	793023279	KRNRUESEKZULES-UHFFFAOYSA-N	429.477	1.726	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccc2ccn(C)c(=O)c2c1	793067389	WDMZQRZKYVJAIJ-GFCCVEGCSA-N	442.859	1.745	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNC(=O)NC1CCC(O)(c2cccnc2)CC1	793168809	JYEOYWAFZZGKQS-UHFFFAOYSA-N	441.488	1.469	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)[C@@H]3[C@H]4[C@H]5C[C@@H]6[C@H]7[C@@H](C[C@H]64)[C@@H]3[C@@H]75)cc2)CC1	793711524	IESVQFLLJSKHCT-VJQJMSHESA-N	442.585	1.460	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)C[C@H]1COCCN1C(=O)OC(C)(C)C	794772649	CPUOUOUGAIUKBN-HNNXBMFYSA-N	445.520	1.772	50	20	IDGD	
CCS(=O)(=O)NCc1ccc(C(=O)NNc2ccccc2S(=O)(=O)N(C)C)cc1	795169038	IAGNWMRXHAAIBG-UHFFFAOYSA-N	440.547	1.133	50	20	IDGD	
C[C@H](CNC(=O)OC(C)(C)C)C(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	796514642	DYVSGFCIXXENTP-CYBMUJFWSA-N	443.545	1.877	50	20	IDGD	
COC(=O)c1cc(F)cc(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)c1F	796992977	YUKWLPLUKHOHCC-UHFFFAOYSA-N	441.774	1.570	50	20	IDGD	
COC(=O)Cn1ncc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2Cl)c1C	797034492	KJEBZEYAXNARDH-UHFFFAOYSA-N	428.232	1.071	50	20	IDGD	
O=C(NNC(=O)c1cc(S(=O)(=O)N2CCSCC2)c[nH]1)Nc1cc(F)cc(F)c1	802008283	XUJGPAQEYULPJE-UHFFFAOYSA-N	445.473	1.497	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccccc1)Nc1ccc2c(c1)OCO2	802099164	DUBUUODWBRAUQH-INIZCTEOSA-N	446.485	1.811	50	20	IDGD	
COc1ccc(C2=NO[C@@H](CNC(=O)NNC(=O)c3cc(Br)c[nH]3)C2)cc1	802369796	NKHXRNQGNQPXTB-CYBMUJFWSA-N	436.266	1.923	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)c2nnn(Cc3ccncc3)c2C)cc1C	803970008	IRTODLYIZNWBGN-UHFFFAOYSA-N	442.501	1.580	50	20	IDGD	
CS(=O)(=O)c1ccc(C(=O)NNc2ccc(-n3ccnc3)nn2)cc1Br	804955612	SDAJXYBFWFBIJG-UHFFFAOYSA-N	437.279	1.585	50	20	IDGD	
COc1cc(CNC(=O)NNc2ccc3c(=O)[nH]ccc3c2)ccc1OCC(=O)N(C)C	806445956	FYWNPTIWYLIHKM-UHFFFAOYSA-N	439.472	1.830	50	20	IDGD	
Cc1nc2ccc(NC(=O)C(=O)NNC(=O)CCCOc3ccc(Cl)cc3C)cn2n1	810385033	KJAANXFCBDLFIA-UHFFFAOYSA-N	444.879	1.945	50	20	IDGD	
COC(=O)c1c(F)ccc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)c1C	810389361	DCORGNCYDCASKL-UHFFFAOYSA-N	435.433	1.505	50	20	IDGD	
COc1ccccc1N1C[C@H](C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)CC1=O	812730483	KQNSRRUJAOZVRV-CQSZACIVSA-N	432.502	1.442	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2cc(Cl)ccc2OC(F)(F)F)CCS(=O)(=O)C1	815590256	PQPJKDWKUZCLIW-ZDUSSCGKSA-N	429.804	1.375	50	20	IDGD	
CCn1c(NNC(=O)CNS(=O)(=O)c2cccc(C(C)=O)c2)nc2ccccc2c1=O	823892838	KHUUJNKVNGEKPN-UHFFFAOYSA-N	443.485	1.041	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)[C@@H]2CCCCN2S(=O)(=O)c2ccccc2)cc1	825588241	CNXGRZWIYUOVHR-IBGZPJMESA-N	430.530	1.798	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C(C)C)c2)c1	825781587	FTAAHTUJOMUBFT-UHFFFAOYSA-N	434.518	1.597	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)[C@H](CCS(C)(=O)=O)NC(=O)c2ccccc2Cl)n1	837302466	SHCSABUFFBVFBS-HNNXBMFYSA-N	439.925	1.423	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@@H](C)C(=O)NNC(=O)CN1C(=O)NC2(CCCC2)C1=O	912864316	CYEYWYOOBNINSB-ZDUSSCGKSA-N	436.896	1.736	50	20	IDGD	
O=C(NNC(=O)c1ccc(S(=O)(=O)NCCc2cccs2)cc1)c1ccncc1	914457148	MDECRUPWIVRZRJ-UHFFFAOYSA-N	430.511	1.739	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)CCc1c(C)nc2c(C#N)cnn2c1C	914781438	FGVOZIROXRWJTE-UHFFFAOYSA-N	444.499	1.910	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)C3=NN(c4ccccc4)C(=O)[C@@H](C)N3)cc2C1	915188928	ISOCSSXSEADEAU-CHWSQXEVSA-N	425.514	1.972	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@@H]2CC2(Cl)Cl)c1	915908505	RSPUZTUUFGADCL-LBPRGKRZSA-N	437.349	1.855	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cccnc2N2CCCCC2)c1	916108635	DQKDIHPYNMKKBO-UHFFFAOYSA-N	431.518	1.397	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)NCc1ccnc(N2CCOCC2)c1	916388956	KJBOSFIJYQQXDI-UHFFFAOYSA-N	429.477	1.226	50	20	IDGD	
O=C(NC[C@H](c1ccccc1)N1CCOCC1)NNC(=O)[C@H]1COc2ccccc2O1	916510046	ZUPMJPTUXZIIEJ-YLJYHZDGSA-N	426.473	1.230	50	20	IDGD	
CCOCCO[C@H](C)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	918689592	YWVNUGVUEOZWBG-OAHLLOKOSA-N	427.523	1.064	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)c2cc(S(=O)(=O)Nc3ccccc3F)c[nH]2)c1O	919757644	RDQXFEICMNWXRZ-UHFFFAOYSA-N	448.432	1.744	50	20	IDGD	
CC(C)[C@H](NC(=O)Cc1ccc2ccccc2c1)C(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1	919884809	QKXFUTKNDFCIOV-ICSRJNTNSA-N	445.541	1.105	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NCc2ccn(-c3ccc(OC)cc3)n2)cc1	919916902	PCVQUEXVFHGHDT-UHFFFAOYSA-N	425.445	1.799	50	20	IDGD	
CC(C)NC(=O)C(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1ccc(F)c(F)c1	920431452	CLSARIMEPFWFGZ-UHFFFAOYSA-N	440.428	1.051	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCOCC2)cc1C(=O)NNc1ccc(F)cc1F	921183836	FTAQSEJTPDNGTH-UHFFFAOYSA-N	427.429	1.751	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)c2ccc(S(=O)(=O)NC[C@H](C)O)cc2)c(Cl)c1	1120728659	IZPCRNCDPPMLDG-LBPRGKRZSA-N	440.909	1.774	50	20	IDGD	
CN(C)[C@H]1CCCC[C@H]1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	1318405520	BSKQDLKTKZXDRC-MSOLQXFVSA-N	437.566	1.288	50	20	IDGD	
CN1CCC(=NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c2ccccc21	1345367155	JAPDPBVRTALOEB-UHFFFAOYSA-N	428.514	1.682	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3nc4ccccc4n(C)c3=O)C2)C1	1777889666	BTEWWSREQGDWHK-SZNDQCEHSA-N	432.908	1.394	50	20	IDGD	
Cc1nnsc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CO[Si](C)(C)C)C2	1778238165	CNRRUTDQXFHEND-RDTXWAMCSA-N	426.615	1.826	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4c(c3)NC(=O)CO4)C2)C1	1778575127	OZDUBWCEZXZOEK-OAQYLSRUSA-N	447.564	1.313	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)COc3cc(Cl)ccn3)C2)C1	1779231721	FFLRNZRNZBOLIG-KSSFIOAISA-N	432.304	1.198	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H]1Cc3ccccc3CN1)CCO2	1779295260	CLKCPEWSZMKHMB-SIKLNZKXSA-N	431.609	1.382	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc[nH]3)C2)C1	1779369990	XAFAJETVDXIDPM-YWZLYKJASA-N	440.928	1.590	50	20	IDGD	
Cc1onc(-c2ccncn2)c1C(=O)N1CC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1780051416	FARDWMSKNWQJKP-SFHVURJKSA-N	440.287	1.687	50	20	IDGD	
CN1N=C(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@](C)(Cl)CCl)C2)CCC1=O	1780706286	HZYYDMDGNNEKQS-NIKGAXFTSA-N	447.363	1.345	50	20	IDGD	
CC(=O)Nc1cc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@](C)(Cl)CCl)C3)C2)ccn1	1781229762	LODFRTGAEOLOLV-RTBURBONSA-N	443.331	1.720	50	20	IDGD	
O=C(c1ccc2nccnc2c1)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781329454	GCXDBGCUAREYJS-QAPCUYQASA-N	437.269	1.764	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Cl)C2)[C@H]1CC(c2ccccc2)=NN1	1781449858	VANHMPFYKOLMHO-DCXXXQMHSA-N	436.915	1.801	50	20	IDGD	
CCN(CC)C[C@@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](Cl)COC)C2	1781507820	JDUSTVGYXGLEKS-BMQTXXJKSA-N	432.005	1.732	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(O)c([N+](=O)[O-])c3)C2)C1	1781543946	VYAMKKJRGCTXOT-GTNSWQLSSA-N	442.266	1.527	50	20	IDGD	
O=C(COc1cccnn1)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Br)C2	1782520849	AYAYUHVYPRSFNY-SRCQZFHVSA-N	445.289	1.060	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccn4c(C)cc(C)nc34)C2)C1	1782578211	KDJVRPGZCUFHLU-LAUBAEHRSA-N	434.924	1.648	50	20	IDGD	
CCC[C@@H](NC(C)=O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCBr)C2	1783185147	MOOFTIURFANNBZ-GPMSIDNRSA-N	446.386	1.590	50	20	IDGD	
COC(=O)C12CC(C(=O)N3CC[C@@]4(CN(C(=O)[C@@H](C)CBr)CCO4)C3)(C1)C2	1783440206	AFXMAKAQXFYAOP-CYBNEDPLSA-N	443.338	1.191	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN3CCSCC3)[C@H]2C1	1783496265	BRDGHFPMVJQQSK-VGWMRTNUSA-N	448.427	1.046	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cc(O)nc(Cl)c3)CCO2)C1	1783532355	MMGHISDYLLTVPR-MGPLVRAMSA-N	432.702	1.668	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cccc(F)c3[N+](=O)[O-])CCO2)C1	1783538091	SZDUODLXWZLDHE-GTNSWQLSSA-N	444.257	1.961	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)Cn3cnc4ccccc43)C2)C1	1783752936	UQCPNHRSDYYPJG-LIRRHRJNSA-N	435.322	1.650	50	20	IDGD	
CCc1nn(C)c(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](Cl)COC)C3)C2)c1Cl	1783873663	RYNYTVUGDHWHCH-KZULUSFZSA-N	433.336	1.333	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3c(Cl)ccc4c3OCO4)CCO2)C1	1783876250	XSLUCOPZUICARX-DJJJIMSYSA-N	445.299	1.766	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(F)cn3)C[C@@H]21	1783967935	NUMYQLSKGISZOW-DSPQJCBJSA-N	428.302	1.845	50	20	IDGD	
CNc1nsnc1C(=O)Nc1ccc(C2(NC(=O)CCC(=O)NN(C)C)CCC2)cc1	1785836237	DEXKTKWKJCPEKL-UHFFFAOYSA-N	445.549	1.701	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21	1786409054	UDTLIGJFGJYRGG-QFOLPQNPSA-N	430.112	1.442	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)C[C@@H]21)[C@H](F)Cl	1787447129	NHHATWYJUYNFFB-GKEYINFOSA-N	436.871	1.293	50	20	IDGD	
CN(C)c1c(F)cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](O)CCl)C[C@@H]32)cc1F	1790296315	YEPCBEKJABAXII-SCTFDZSOSA-N	445.894	1.224	50	20	IDGD	
N#Cc1ccc2[nH]nc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)C(Cl)Cl)C[C@@H]43)c2c1	1790330613	LMMBKYPREIFACQ-WHOFXGATSA-N	436.299	1.832	50	20	IDGD	
CCC[C@H](NC(C)=O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](Br)CC)[C@H]2C1	1790963259	ARRUPZVZMLKXLP-WOYTXXSLSA-N	446.386	1.444	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CN3CCc4sccc4C3)C[C@@H]21)C(Cl)Cl	1791294361	ZOHSXTPNSXGZCT-KKUMJFAQSA-N	446.400	1.890	50	20	IDGD	
Cc1nccn1[C@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]21	1791705265	UPYAPDGUKIICKN-SOOYWPCWSA-N	431.364	1.969	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc(OCF)cn1)C2	1792870900	YFDUVNVWZQIFNN-MCYUEQNJSA-N	445.289	1.017	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2	1793631651	HSGWVZHNJVHTCK-YVECIDJPSA-N	436.336	1.389	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ncn(-c2cccc(F)c2)n1	1794587446	GQLOGEHWUAAVJM-ORQFMDKSSA-N	435.887	1.912	50	20	IDGD	
Cc1cc(Br)cnc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2	1794964915	JDJHJHRDQZWRQY-DJBIQUGXSA-N	434.693	1.890	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cn1ccc3ccc([N+](=O)[O-])cc31)C2)[C@H](F)Cl	1796365082	RXRRCNKKCUEKCX-GGNLRSJOSA-N	438.843	1.674	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN1CCC(C)CC1)C2	1796891036	ZFSQARUAFZUBHX-PNFLAOTCSA-N	442.564	1.491	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc3c[nH]nc3c1)C2	1796892218	OJKVVVRPBOMZSL-DIWZVOJHSA-N	447.499	1.949	50	20	IDGD	
Cn1c(=O)n(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)C(C)(C)CCl)C3)c2ccccc21	1797171686	NXDWWBCVYWJDIZ-CCWDJLKJSA-N	448.951	1.195	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1ccn2cncc2c1	1797506374	QJCIGYMGMDOIII-NEBZKDRISA-N	425.258	1.228	50	20	IDGD	
COc1cccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CO[Si](C)(C)C)c1C	1797956627	UAVTUNADVLDFHI-OPMZPASUSA-N	434.609	1.987	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(Cl)cnc1O)C2)[C@@H](F)Br	1799342017	CXVNOVCVTAYKDS-IWXIMVSXSA-N	436.665	1.334	50	20	IDGD	
Cc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CO[Si](C)(C)C)C3)nc2nccn12	1799989159	BPZDHBJTHBFAGG-JLVBRIDZSA-N	431.569	1.092	50	20	IDGD	
COc1ccccc1CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2	1800628875	SWWPNZMTEWVMGJ-DLTLXFJOSA-N	429.286	1.518	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(N3CCCC3)ccn1)C2)C(Cl)Cl	1801014805	HZPKGIHTRZSOCK-YWVIFJGQSA-N	427.332	1.689	50	20	IDGD	
Cc1nccn1CCCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2	1801311770	WTVYUELRCCTUQH-OCVGTWLNSA-N	431.306	1.252	50	20	IDGD	
COC[C@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(CS(C)(=O)=O)nc1)C2	1802277683	WQSXEPMMFFDYFK-YVSFHVDLSA-N	443.953	1.132	50	20	IDGD	
Cc1cccn2ncc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)CCC(=O)NN(C)C)c12	1802338018	HQECJRGAJQGGOO-BJWYYQGGSA-N	426.521	1.268	50	20	IDGD	
CCNC(=S)NCC(=O)N1CC[C@H](CNC(=O)C(C)(C)CCl)[C@H]1c1cccnc1	1802904905	PANOGQPYJHOJGG-NVXWUHKLSA-N	440.013	1.836	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CCc2cc(F)ccn2)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803140281	CAJFAPGDGQAXRC-ZAAXVRCTSA-N	434.899	1.854	50	20	IDGD	
Cn1nncc1C(=O)NC[C@@H]1CCN(C(=O)[C@](C)(Cl)CCl)[C@H]1c1cccnc1	1804750636	XSJUWDSYQRHJLT-DHSIGJKJSA-N	425.320	1.766	50	20	IDGD	
Cn1ncc2cc(C(=O)NC[C@@H]3CCN(C(=O)[C@@H](O)CCl)[C@@H]3c3cccnc3)ccc21	1809419064	DYDUOBLVCLBQAE-FFZOFVMBSA-N	441.919	1.888	50	20	IDGD	
CC(=O)N[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)[C@H](C)Br)[C@H]1c1cccnc1	1812652133	LABJQBNWPAYPLQ-VZAMPYOESA-N	425.327	1.395	50	20	IDGD	
COc1nccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)[C@@H](O)CCl)n[nH]2)c1F	1814870531	VSMDZBNEPIDVMN-STQMWFEESA-N	425.848	1.858	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCN2CCN(C)CC2)n[nH]1	1817156159	MEOULNOYRZQMFP-NVXWUHKLSA-N	440.976	1.293	50	20	IDGD	
CN[C@@H](CC(=O)Nc1cc([C@H]2CCCCN2C(=O)CO[Si](C)(C)C)[nH]n1)C(=O)O	1817366946	DDZLZQVKNKLINR-UONOGXRCSA-N	425.562	1.316	50	20	IDGD	
Cc1ccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)c(C)n1	1817471988	AMDNROUXSVKRAR-FQEVSTJZSA-N	447.304	1.721	50	20	IDGD	
CCOC(=O)N[C@@H](O)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCBr)[nH]n1	1819239128	CQCRPTDGBLCJJN-ABAIWWIYSA-N	446.302	1.251	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](F)Br)[nH]n1	1819354800	ZPERVZHGXRQJOW-XWIASGKRSA-N	447.309	1.800	50	20	IDGD	
C[C@@](O)(CC(=O)O)CC(=O)Nc1cc([C@H]2CCCCN2C(=O)CCBr)[nH]n1	1822402932	APRWDCSGCBRZNT-PXAZEXFGSA-N	445.314	1.803	50	20	IDGD	
O=C(N[C@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1)c1ccc(O)nn1	1823001684	JBJWWQDLQUKSSO-UPONEAKYSA-N	430.259	1.555	50	20	IDGD	
CCS(=O)(=O)CC(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@H](F)Br)CC1	1824468263	YICVDJRJWKVEHA-ZFWWWQNUSA-N	441.363	1.731	50	20	IDGD	
C=C(C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2)C(F)(F)F	1825263913	BWQYMRXEKQATGA-GFCCVEGCSA-N	439.224	1.167	50	20	IDGD	
O=C(C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1)c1ccccc1	1826288864	ZKQCKRHSYOXOSO-QFIPXVFZSA-N	448.328	1.483	50	20	IDGD	
O=C(c1ccncc1O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827057893	MHEZOLKEKCFFCJ-HXUWFJFHSA-N	437.305	1.014	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cnc(O)nc2O)CC1	1827592352	SWRFMMIFAPVQLX-RISCZKNCSA-N	441.326	1.905	50	20	IDGD	
O=C1Nc2c(cccc2C(=O)N2CCCC[C@H]2C2CCN(C(=O)[C@H](O)CCl)CC2)C1=O	1828716220	CNGFRQIUCCIAFL-DLBZAZTESA-N	447.919	1.654	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)CCc2nc(N)n[nH]2)CC1	1828806522	KZCJIJKCRUFWKC-LSDHHAIUSA-N	426.949	1.193	50	20	IDGD	
CN1CCN(C2(C(=O)N3CCCC[C@H]3C3CCN(C(=O)[C@@H](F)Cl)CC3)CC2)CC1	1830247860	ZSALMPCEUUBGBG-ZWKOTPCHSA-N	428.980	1.921	50	20	IDGD	
C[C@H](Sc1ccccc1)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1	1830725242	IFGBNUCLNYCIBK-VPWXQRGCSA-N	442.965	1.223	50	20	IDGD	
Cc1ccc(/C=C/C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)s1	1830738594	QJXIOENLHAOHBT-HLIGJIKWSA-N	428.938	1.126	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](OC(C)=O)C(C)C)C2)C1	1831651208	NTYKEMHLIIZXQB-ZWOKBUDYSA-N	432.945	1.438	50	20	IDGD	
C[C@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1)n1cccn1	1832235873	JOOIYUUVWIDBKM-UTKZUKDTSA-N	438.337	1.057	50	20	IDGD	
Cc1ccc(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)nc1	1832995671	SAGNWMVJWWPHCR-IBGZPJMESA-N	430.332	1.583	50	20	IDGD	
C[C@@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)CSC(=N)N)CC2)CC1	1833262293	MRLJEMNLRHTVME-LBPRGKRZSA-N	448.431	1.216	50	20	IDGD	
C[C@@H](C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)CCl)CC2)CC1)c1ccc(O)cc1	1833313810	ROPVINDOTMJHRK-FOIQADDNSA-N	437.968	1.667	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccs3)CCO2)C1	1833930212	IVINNWDFCPRNEO-CXAGYDPISA-N	431.352	1.849	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@](C)(Cl)CCl)C3)C2)n(C)n1	1834165794	XYGPBNQQDMDWQZ-MSOLQXFVSA-N	433.336	1.035	50	20	IDGD	
Nc1nc(C(=O)N2CCC(N3CCC(NC(=O)CCBr)CC3)CC2)cs1	1834421875	QNMJOEFGBPRJJR-UHFFFAOYSA-N	444.399	1.696	50	20	IDGD	
C[C@@H](Nc1cccnc1)C(=O)NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1834718488	IQYJJZWTZLWYMO-DNVCBOLYSA-N	437.972	1.053	50	20	IDGD	
CCC1(C(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)CCC1	1834798701	ZBNPROQCRRMKAI-UHFFFAOYSA-N	441.381	1.132	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H]3CC[C@H]4CCC(=O)N4C3)CC2)CC1)[C@@H](F)Cl	1835082204	VQZHAHSIWULVFH-DKSSEZFCSA-N	442.963	1.493	50	20	IDGD	
Cc1cnc2c(C(=O)N3CCC(OC4CCN(C(=O)[C@@H](O)CCl)CC4)CC3)cnn2c1	1836716995	CSBRGHIWHQOKFO-SFHVURJKSA-N	449.939	1.250	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(Cl)nn3)CCO2)C1	1837833120	RUUUXWCTSZPDNP-ACJLOTCBSA-N	431.320	1.608	50	20	IDGD	
O=C([C@H]1CC[C@@H]2CCC(=O)N2C1)N1CCC(OC2CCN(C(=O)[C@H](F)Cl)CC2)CC1	1838083871	CQFPGAFCVQCCFA-KHYOSLBOSA-N	443.947	1.920	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)CC3CCOCC3)C2)C1	1839151928	IJZPDEVERHQBMQ-MOPGFXCFSA-N	437.364	1.496	50	20	IDGD	
O=C(c1c(F)ccc(O)c1F)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1839412118	DLQIKVABMCSUOV-QGZVFWFLSA-N	439.242	1.544	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)Cc1ccccc1O)CCO2	1839908491	HYZVDPLFBMKCMM-OAQYLSRUSA-N	436.581	1.243	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3ccc(F)cc3)CCO2)C1	1840056239	UDMXPTAQCYTLRM-WIYYLYMNSA-N	442.915	1.469	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(Cl)ccc3F)C2)C1	1840149012	APFFPQNEYPWEBB-KXBFYZLASA-N	449.306	1.803	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc4ccncc34)C2)C1	1840154713	DDVNICQIVVKWNA-SIKLNZKXSA-N	447.919	1.559	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(C)cc(F)c3)C2)C1	1840154845	HOVIDDHRBZZPSK-XLIONFOSSA-N	428.888	1.458	50	20	IDGD	
Cc1cnn([C@H](C)C(=O)N2CCO[C@@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)c1	1840400726	DOMDLYARZCHFPG-UZLBHIALSA-N	426.945	1.474	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@H]2CN(Cc3ccccc3)CCO2)C1	1843925292	BBXPCWVSFLZPQA-RBUKOAKNSA-N	435.952	1.345	50	20	IDGD	
COc1ccc2[nH]cc(C(=O)N3CC4(CCCN4C(=O)c4cnccc4C(=O)NN)C3)c2c1	1844264454	UTGZZBKLGAWLTE-UHFFFAOYSA-N	448.483	1.306	50	20	IDGD	
C[C@H]1CCC[C@H]1C(=O)N1CC2(CCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)C1	1845038857	BDMLENAHWGKQMY-AZUAARDMSA-N	441.576	1.972	50	20	IDGD	
C[C@](O)(CC(=O)O)CC(=O)N1CCCC12CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)C2	1846382607	GZVMRYXJTZSUQL-JMDQKNPTSA-N	447.438	1.691	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)c2ccc(S(C)(=O)=O)c(F)c2)C1	1846894636	RWLRJPMXACHXCI-CYBMUJFWSA-N	432.901	1.300	50	20	IDGD	
C=CCSCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CN(C)NC(=O)NCc1ccccc1	1848061648	LUGZUAGERWLHNL-OALUTQOASA-N	445.589	1.454	50	20	IDGD	
O=C(Cc1ccc2c(c1)CCO2)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	10124859	CJHCKLMVDGFGJK-UHFFFAOYSA-N	429.498	1.410	50	20	IDGD	
CN1C(=C(C#N)C(=O)COC(=O)c2nn(C)c(=O)c3ccccc23)N(C)c2ccccc21	25393685	QERTWEZACKWVKY-UHFFFAOYSA-N	429.436	1.981	50	20	IDGD	
O=C(CN1C(=O)c2ccccc2S1(=O)=O)NNC(=O)c1ccc(Cl)cc1Cl	29509557	SUXSFVVWTSIEIR-UHFFFAOYSA-N	428.253	1.599	50	20	IDGD	
O=C(NNC(=O)c1ccc(F)c(S(=O)(=O)N2CCCC2)c1)c1cccc([N+](=O)[O-])c1	105928790	IIZLFDJYUKFWQZ-UHFFFAOYSA-N	436.421	1.593	50	20	IDGD	
COc1ccccc1NC(=S)NNC(=O)CN(C)C1=NS(=O)(=O)c2ccccc21	725908625	KJQRVBFDWSYANR-UHFFFAOYSA-N	433.515	1.094	50	20	IDGD	
Cc1noc(C)c1S(=O)(=O)N1CCC(C(=O)NNc2nc(-c3ccncc3)no2)CC1	726377146	LKBNALJUKHDEQE-UHFFFAOYSA-N	447.477	1.280	50	20	IDGD	
N#Cc1ccc(N2CCC(NC(=O)NNC(=O)c3cc(Br)c[nH]3)CC2)nc1	727473751	RLNRPNBSVPDGSG-UHFFFAOYSA-N	432.282	1.657	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)CN(C)C(=O)c2ccc(Br)o2)c(C)c1	728205219	SINGQLFYLOXQLL-UHFFFAOYSA-N	437.294	1.990	50	20	IDGD	
COc1cc(C=NNC(=O)[C@H](C)NS(C)(=O)=O)ccc1OC(=O)c1ccccc1F	728435585	FJDKGXHZIRUBNR-LBPRGKRZSA-N	437.449	1.441	50	20	IDGD	
Cc1cc(C(=O)O)cc(S(=O)(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1C	728854392	VANKOWVQVUYEFY-UHFFFAOYSA-N	433.490	1.018	50	20	IDGD	
C[C@H]1C[C@H](C)CN(CCCCNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)C1	728946688	RJZWELNTOWKCSQ-ROUUACIJSA-N	431.585	1.782	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)c1ccc(OCC(F)(F)C(F)F)nc1	729167626	NEUDSCVBZDRYNO-ZDUSSCGKSA-N	429.326	1.962	50	20	IDGD	
Cc1[nH]c2ccnn2c(=O)c1CC(=O)NNC(=O)COc1ccccc1Cc1ccccc1	729298076	QPEIRJCZMKKVLG-UHFFFAOYSA-N	445.479	1.691	50	20	IDGD	
CCOc1cc2c(cc1[C@@H]1C[C@@H]1C(=O)NNC(=O)c1ccc(-n3cnnn3)cc1)O[C@@H](C)C2	730515566	PUJOCTHEDMZQIO-IXDGSTSKSA-N	448.483	1.949	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2cc3c(cc2Cl)OCCO3)c1	730706787	HTKWMELZOASJFM-UHFFFAOYSA-N	425.850	1.981	50	20	IDGD	
Cc1cccc(N2C(=O)N[C@H](CCC(=O)NNC(=O)c3ccc4c(c3)OCCO4)C2=O)c1	730742724	VEUAKQAVCYCWTD-MRXNPFEDSA-N	438.440	1.432	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])c1	731050916	RFOPQSKRYMHQIN-UHFFFAOYSA-N	434.836	1.821	50	20	IDGD	
Cc1c(C(=O)NNC(=O)CNC(=O)c2cccs2)nnn1-c1cccc2cnccc12	731168076	UVPSNZAAIMSJON-UHFFFAOYSA-N	435.469	1.376	50	20	IDGD	
COc1ccc(Br)c(C(=O)NCCCNC(=O)NNC(=O)CC(C)C)c1	731760497	MSCCLHVHFJYYMP-UHFFFAOYSA-N	429.315	1.954	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)N1CCC(C(=O)Nc2ccc(Br)cn2)CC1	731848220	GQQJKDPGSRDGSH-NSHDSACASA-N	426.315	1.441	50	20	IDGD	
COC(=O)c1ccc2[nH]cc(C=NNC(=O)Cc3csc(N4CCOCC4)n3)c2c1	731924771	JKYQAJVJCZYROH-UHFFFAOYSA-N	427.486	1.940	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)c(OC)c1	731991214	UZOYUUKLISDAAE-CYBMUJFWSA-N	448.457	1.739	50	20	IDGD	
COCCOc1ccc(C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1	732051116	WDFUGANXGAEZCS-UHFFFAOYSA-N	435.502	1.102	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)[C@@H](C)N1CCN(c2ccc(F)cc2)CC1	732264449	RPCYAABQMZXURV-MRXNPFEDSA-N	429.496	1.604	50	20	IDGD	
O=C(NNc1ccc(Br)nc1)c1cccc(S(=O)(=O)N2CCOCC2)c1	732836636	QKXGTUUAQSLFKJ-UHFFFAOYSA-N	441.307	1.622	50	20	IDGD	
O=C(COC(=O)Cn1ncn2nccc2c1=O)NN=C(c1ccccc1)c1ccccc1	732864653	RIBJBDYSWPFTGY-UHFFFAOYSA-N	430.424	1.003	50	20	IDGD	
COCCOCC(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2cccc(Cl)c2)c1	733123741	CWEPBCWXZFWJDN-UHFFFAOYSA-N	441.893	1.565	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)[C@@H]1CSCN1C(=O)OC(C)(C)C	734239689	WCEHTZZPXJMXBS-NSHDSACASA-N	433.531	1.152	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN(C)[C@@H]2CCCN(c3ccccc3)C2=O)cc1OC	734488750	LNAPWBRTEGYTGB-GOSISDBHSA-N	440.500	1.592	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNS(=O)(=O)c1ccc(CS(C)(=O)=O)cc1	734807063	SEDQOMHQBXRPFU-UHFFFAOYSA-N	442.515	1.018	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H]2C[C@H]2c2c(F)cccc2F)c1	734947728	YWJXLXXSTPVHSA-CZUORRHYSA-N	438.456	1.715	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)c1ccc(S(=O)(=O)Cc2ccccc2)cc1	741216145	AYMJBYYTEHJMHD-UHFFFAOYSA-N	431.514	1.726	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=S)N[C@@H]1CCOc2ccccc21	741475953	JXTOZJPJPIYESO-CQSZACIVSA-N	433.559	1.921	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)[C@@H]2CCCN(C(=O)c3ccncc3)C2)o1	742055164	KXAPLWSZNAGYET-QGZVFWFLSA-N	427.505	1.830	50	20	IDGD	
C=CCN1C(=O)c2ccc(C(=O)NNC(=O)Nc3ccc(S(C)(=O)=O)cc3)cc2C1=O	743831305	VDOOOSOQJGAJAG-UHFFFAOYSA-N	442.453	1.339	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)c2cc(S(N)(=O)=O)ccc2F)cc1Cl	743834146	SHNCKRJDNNLBFX-UHFFFAOYSA-N	446.844	1.610	50	20	IDGD	
COc1ccc([C@H](CC(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)NC(C)=O)cc1	744511761	JOOCLCPUWMTROQ-IBGZPJMESA-N	438.440	1.139	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)cc1	745299966	JECSJSZMGHEHAW-QGZVFWFLSA-N	431.518	1.700	50	20	IDGD	
CC(C)[C@H](NS(=O)(=O)c1ccc2ccccc2c1)C(=O)NNC(=O)N1CCOCC1	745992039	SVFLVRCNPGDUKH-SFHVURJKSA-N	434.518	1.216	50	20	IDGD	
C[C@@H]1OC(C)(C)N(C(=O)OC(C)(C)C)[C@H]1C(=O)NNC(=O)c1nnc(O)c2ccccc12	746096466	GLUCYVMTRXCPSU-XHDPSFHLSA-N	445.476	1.857	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)N[C@@H]2CCCN(CC(F)(F)F)C2=O)cc1OC	746338667	FBMKHANVNDVDLQ-GFCCVEGCSA-N	432.399	1.591	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)c2cnn(CC(=O)NC3CCCCC3)c2)c1	746578966	BOAXRNKBMDNSAK-UHFFFAOYSA-N	427.505	1.789	50	20	IDGD	
O=C(NNC(=O)C1CCN(S(=O)(=O)c2cccnc2)CC1)c1ccc(Cl)cc1F	747332463	PUHJBHZQCNVAPJ-UHFFFAOYSA-N	440.884	1.736	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CS[C@H](Cc2ccccc2F)C(=O)N1)c1cccc2cccnc12	747425306	FOXZKMVKRHHJSQ-ZWKOTPCHSA-N	438.484	1.978	50	20	IDGD	
O=C(NNC(=O)C1CCN(S(=O)(=O)c2ccccc2C(F)(F)F)CC1)c1ccc[nH]1	747662964	RXKWDPDYFUCQPW-UHFFFAOYSA-N	444.435	1.895	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(S(=O)(=O)CCCC#N)cc2)cc1	748409098	GPQZVLPROGYDRQ-UHFFFAOYSA-N	443.481	1.691	50	20	IDGD	
CC(C)(C)[C@H](NS(C)(=O)=O)C(=O)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1	748521619	XCZWDBFDHHGURM-LLVKDONJSA-N	431.458	1.387	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)NC[C@H]1CCN(c2cccc(Br)c2)C1	748625016	KGFXVVBDIUQODB-ZIAGYGMSSA-N	443.342	1.657	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)NCC2CCOCC2)cc1	749230902	UWVWZJNNOJQXJK-LDADJPATSA-N	437.500	1.884	50	20	IDGD	
CN(C)CCOc1ccccc1N1CCN(CC(=O)NNC(=O)c2ccc(F)cc2)CC1	750047018	GCXGWTFMWUGHAQ-UHFFFAOYSA-N	443.523	1.349	50	20	IDGD	
CC(C)[C@H](CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)c1cccnc1	751814059	RERUWDXJRMYIOF-SFHVURJKSA-N	433.534	1.716	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)c2cc(S(N)(=O)=O)cc(Cl)c2F)c1C	752258227	YIMIDSHPNFBWTL-LLVKDONJSA-N	443.884	1.972	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CCNS(=O)(=O)c2ccc(OC(F)(F)F)cc2)o1	752526824	XOIVXNBVVXPYMT-UHFFFAOYSA-N	435.380	1.616	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)N[C@H]1COc2cc(F)cc(F)c21	753419161	KDXUEMQQAJHJCB-SFHVURJKSA-N	445.470	1.941	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(C(=O)OC)cc([N+](=O)[O-])c2C)cc1	753841779	UTKOOGBTKGIPDE-UHFFFAOYSA-N	428.401	1.652	50	20	IDGD	
COc1ccc(-c2nn(CCC#N)cc2/C=C(\C#N)C(=O)NCc2nc(O)n[nH]2)cc1OC	754356146	VIZLDQGLIRYGPC-RIYZIHGNSA-N	448.443	1.528	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)COc2ccc(Cl)cc2)n([C@@H]2CCS(=O)(=O)C2)n1	755529087	BYNHUCAIVKCTDC-CYBMUJFWSA-N	441.897	1.436	50	20	IDGD	
CCn1cnc2c1c(=O)n(CC(=O)NN=C(C)c1ccoc1)c(=O)n2Cc1ccccc1	755887540	LWESSJYVTWZBNP-UHFFFAOYSA-N	434.456	1.561	50	20	IDGD	
COC(=O)c1nscc1S(=O)(=O)NNC(=O)c1cc(C)n(-c2ccccc2)c1C	755957244	MGIDVTXGCMXXFX-UHFFFAOYSA-N	434.499	1.961	50	20	IDGD	
COCCOc1ccc(NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c(C)c1	756016976	DKWYVRWMBKMRTB-UHFFFAOYSA-N	425.445	1.734	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)Nc2cccc(C(=O)NCCC(N)=O)c2)c1	756391982	IZIIJIDSDAGGLT-UHFFFAOYSA-N	427.461	1.140	50	20	IDGD	
O=C1C[C@@H](Cc2ccc(NC(=O)NNC(=O)c3cc(-c4ccccc4)[nH]n3)cc2)C(=O)N1	756815182	JBXMNVPYVIRQJI-OAHLLOKOSA-N	432.440	1.748	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)Cc2ccn(-c3ccccc3)n2)c2ccccc2c1=O	756900368	ZHIIKUGBAOGWCI-UHFFFAOYSA-N	430.468	1.996	50	20	IDGD	
CCn1cc(S(=O)(=O)NNC(=O)[C@@H](C)Oc2ccc3ccccc3c2)c([N+](=O)[O-])n1	756929946	NOLJFPVQRBYVRE-GFCCVEGCSA-N	433.446	1.741	50	20	IDGD	
Cc1cc(C(=O)O)ccc1S(=O)(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12	757645653	OGSUPPJNYCIXEM-UHFFFAOYSA-N	444.469	1.607	50	20	IDGD	
O=C(NN=C1C(=O)Nc2c(I)cccc21)C(=O)Nc1ccccn1	758390226	OBABDZLRJYSJMA-UHFFFAOYSA-N	435.181	1.097	50	20	IDGD	
Cc1nc(C(=O)N2CCN(S(=O)(=O)CBr)CC2)nn1-c1ccccc1	758524012	RTBKCUHJBGDZAF-UHFFFAOYSA-N	428.312	1.016	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H](C(=O)NNC(=O)C(=O)Nc2ccccn2)C[C@H]2CCCC[C@H]21	758830392	KHRCBKRLGKWJBQ-KFWWJZLASA-N	431.493	1.736	50	20	IDGD	
O=C(CCc1nnc(C2CCCC2)o1)NNc1ccccc1S(=O)(=O)N1CCOCC1	760690508	VGWIIYZDZVFNGN-UHFFFAOYSA-N	449.533	1.824	50	20	IDGD	
CC[C@@H](NC(=O)NNC(=O)COc1ccccc1O)[C@@H]1CN(Cc2ccccc2)CCO1	760900086	URFMHOQDFXSJFV-NQIIRXRSSA-N	442.516	1.781	50	20	IDGD	
COC(=O)c1cn([C@H]2CCCN(C(=O)NNC(=O)c3cc4c(s3)CC[C@H](C)C4)C2)nn1	762556757	QPOICIWKTXEQSM-JSGCOSHPSA-N	446.533	1.943	50	20	IDGD	
COc1ccc(C[C@@H](C)CNC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1OC	762656109	RKVAZFZHVHNRBL-CQSZACIVSA-N	449.529	1.930	50	20	IDGD	
COc1cc(OC)c(OC)cc1NC(=O)C(=O)NNC(=O)COc1cc(C)cc(C)c1	763646297	FNFRTXBULFGPEV-UHFFFAOYSA-N	431.445	1.494	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)C(=O)Nc1cccc(CN2CCCCC2)c1	763679338	LEWMVVAKSAIWJR-UHFFFAOYSA-N	428.464	1.977	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)C(=O)Nc1cccc(C(=O)N2CCCCC2)c1	763681551	VOJVHJFQJMTKJG-UHFFFAOYSA-N	442.447	1.617	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(NC(=O)C(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)c1	763724082	VRFLUFPZCFKGDY-UHFFFAOYSA-N	448.545	1.239	50	20	IDGD	
O=C(NNC(=O)C12CC3CC(CC(C3)C1)C2)C(=O)Nc1ccn(-c2ncccc2F)n1	763729419	ZBGFQOKAEPSFEJ-UHFFFAOYSA-N	426.452	1.709	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2cccc(Cl)c2)ccc1N1CCCC1=O	763750203	LBANWVOTGILZOW-UHFFFAOYSA-N	430.848	1.875	50	20	IDGD	
COC(=O)c1cc(F)c(F)cc1NC(=O)C(=O)NNC(=O)c1cc(OC)cc(OC)c1	763773047	UAQQZLIRMGBAHB-UHFFFAOYSA-N	437.355	1.168	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc([C@@H](C)N3CCOCC3)cc2)cc1	763820836	JUQRQNOXCFYJBM-QGZVFWFLSA-N	440.500	1.553	50	20	IDGD	
CC(C)CCn1nc(C(=O)NNC(=O)C(=O)Nc2ccc(F)nc2)c2ccccc2c1=O	763842722	JWBVHRFGECJACG-UHFFFAOYSA-N	440.435	1.376	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)oc(=O)n3C)cc1	763861441	POEXACMVOWLHNR-LBPRGKRZSA-N	442.428	1.084	50	20	IDGD	
C[C@H](c1ccc(NC(=O)C(=O)NNC(=O)Cc2c[nH]c3ccccc23)cc1)N1CCOCC1	763865994	YZZOEEXDRDQOEA-MRXNPFEDSA-N	449.511	1.890	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cc(C3CCCC3)nn2C)cc1	763872074	JUTKGWVPTXKLAO-CQSZACIVSA-N	441.488	1.834	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)C(=O)Nc1ccc2[nH]ncc2c1	763882645	KKIPOAVCJYCDRW-SNVBAGLBSA-N	446.261	1.879	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)C(=O)Nc2cccc(N3CCCNC3=O)c2)cc1	763897814	GNNMVMIKXCKHDF-UHFFFAOYSA-N	441.513	1.793	50	20	IDGD	
C[C@@H]1CN(Cc2ccccc2NC(=O)C(=O)NNC(=O)Cc2ccc(F)cc2)C[C@@H](C)O1	763918968	NNCVRBRQQMQWEN-HZPDHXFCSA-N	442.491	1.764	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)C(=O)Nc1cncc(Br)c1	763943311	FCAIKMCVFHKWRD-UHFFFAOYSA-N	445.233	1.135	50	20	IDGD	
CC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2cc(Br)cn2C)c1C	764002878	VCEUNIUQABBYHO-UHFFFAOYSA-N	436.266	1.454	50	20	IDGD	
CC(C)c1cc(Br)ccc1NC(=O)C(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1	764003150	ZXOIDJURYOPIKM-JTQLQIEISA-N	446.323	1.093	50	20	IDGD	
O=C1C[C@@H](c2cccc(NC(=O)C(=O)NNC(=O)c3cccc(C(F)(F)F)c3)c2)CN1	764040903	QVLJRWSZSOFOIF-CYBMUJFWSA-N	434.374	1.709	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1cc(NC(=O)C(=O)NNC(=O)C2CCCC2)ccc1F	764078126	YSJUZSCWXPWQSL-UHFFFAOYSA-N	428.486	1.179	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1O)C(=O)Nc1ccccc1C(=O)N1CCCC1	764125964	CFCPLOWUELIMRR-UHFFFAOYSA-N	430.848	1.681	50	20	IDGD	
Cc1ccc(C)c(-n2ncc(NC(=O)C(=O)NNC(=O)[C@@H]3Cc4ccccc4O3)c2C)c1	764167358	JBMXWXJMZQQPIR-FQEVSTJZSA-N	433.468	1.887	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(C#N)cc2)cc1N1CCCCC1=O	764182453	NBDGIPBVSLWFPP-UHFFFAOYSA-N	435.440	1.483	50	20	IDGD	
CNC(=O)c1cc(Oc2ccccc2NC(=O)C(=O)NNC(=O)CC(C)(C)C)ccn1	764198632	MFLZURILWXXSBM-UHFFFAOYSA-N	427.461	1.756	50	20	IDGD	
CC(C)CCC(=O)NNC(=O)C(=O)Nc1ccc(S(=O)(=O)C[C@H]2CCCO2)cc1	764200181	VYJAFWAMLHYUDI-OAHLLOKOSA-N	425.507	1.161	50	20	IDGD	
Cc1cc(C(=O)N2CCC(C)CC2)ccc1NC(=O)C(=O)NNC(=O)Cc1cccnc1	764268266	OVTIHJYHILNDQL-UHFFFAOYSA-N	437.500	1.591	50	20	IDGD	
CCNC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](CC)c2ccccc2)cc1	764332143	MRLZWUSMPQHALX-SFHVURJKSA-N	426.473	1.481	50	20	IDGD	
COCCOc1cc(C)ccc1NC(=O)C(=O)NNC(=O)C(F)(F)Oc1ccccc1	764379282	UXVJKEJFEJNEMP-UHFFFAOYSA-N	437.399	1.778	50	20	IDGD	
O=C(NNC(=O)C(F)(F)Oc1ccccc1)C(=O)Nc1ccnc(OCC(F)(F)F)c1	764380318	VOQWVSQQPBLVKH-UHFFFAOYSA-N	448.304	1.780	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1cc(F)c(N2CCCCC2)c(F)c1	764397398	IMRFJBYVQMKJHX-LBPRGKRZSA-N	428.436	1.093	50	20	IDGD	
COc1nccnc1NNC(=O)CCCNS(=O)(=O)c1cccc(C(F)(F)F)c1	764464575	BIVKFJYSDXSNMP-UHFFFAOYSA-N	433.412	1.706	50	20	IDGD	
C[C@H](CC(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1)C1CCN(C(=O)OC(C)(C)C)CC1	764617405	UJJIVTPWCBZQOW-HIFRSBDPSA-N	431.555	1.242	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)[C@H](C)NS(=O)(=O)c1cccc(C#N)c1	764636428	STPPQVBGIASVIA-NSHDSACASA-N	436.877	1.348	50	20	IDGD	
COc1ccccc1N1C[C@H](C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)CC1=O	765316745	FDLIVOMPGSFLFG-CQSZACIVSA-N	434.493	1.500	50	20	IDGD	
CC(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)cc1	765318820	RPSAKPWQAKASEI-UHFFFAOYSA-N	427.523	1.935	50	20	IDGD	
CN1CCN([C@@H](C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)c2ccccc2)CC1	765321536	CIERKVNDDYWADO-LJQANCHMSA-N	433.553	1.427	50	20	IDGD	
CC(C)OC(=O)C[C@H]1CCCN(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)C1	766083851	CCHFEXHRCLHUGT-CQSZACIVSA-N	439.538	1.388	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)[C@H](O)c1ccc(Br)cc1	767356378	VYQUNBVMIAIOJC-GOSISDBHSA-N	435.274	1.724	50	20	IDGD	
CN(C)CCS(=O)(=O)c1ccccc1C(=O)NNC(=O)Cn1ccc2ccccc21	767434189	KUJNYFVZMJLUMH-UHFFFAOYSA-N	428.514	1.438	50	20	IDGD	
C[C@H](NC(=O)c1n[nH]c2ccccc12)C(=O)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	768278194	ZJBOZCFOTDWJMN-NSHDSACASA-N	435.419	1.672	50	20	IDGD	
O=C(NNC(=O)c1ccc(F)cc1Br)NC1CCN([C@H]2CCC[C@H]2O)CC1	769155938	PSXWNFNKZCDJOF-JKSUJKDBSA-N	443.317	1.910	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1	770404272	JWHVBKYAJFCRHF-KRWDZBQOSA-N	445.497	1.381	50	20	IDGD	
COC(=O)c1ccc2c(c1)CN(C(=O)NNC(=O)c1csc(N3CCOCC3)n1)CC2	770753111	CLXXTEHMEJXOLL-UHFFFAOYSA-N	445.501	1.179	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2O)c1	771844476	FBBAAXAJONRGJA-UHFFFAOYSA-N	436.446	1.406	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1c(Br)ccc(Br)c1N	772136714	RWAFQGYOBOKQEJ-ZCFIWIBFSA-N	437.088	1.897	50	20	IDGD	
Cc1ccc(N2C[C@H](C(=O)NNC(=O)C(=O)NCc3ccc(Cl)cc3)CC2=O)cc1	772194777	DKXQVMSDAMALCU-OAHLLOKOSA-N	428.876	1.465	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)c1cccc(OCC(F)(F)F)n1	772899189	ZHGWLZMNELVOKH-UHFFFAOYSA-N	430.770	1.754	50	20	IDGD	
COC(=O)COc1ccc(S(=O)(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)cc1	773263094	DQOKBKMUKWLOPC-GFCCVEGCSA-N	442.877	1.669	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)CCn2cnc3ccccc3c2=O)C1	773411054	IHQKFBBEJMJODP-HNNXBMFYSA-N	443.504	1.581	50	20	IDGD	
COC(=O)c1c(F)cccc1NNC(=O)Cn1c(CS(C)(=O)=O)nc2ccccc21	773640721	FUBDMQXGRQEQOO-UHFFFAOYSA-N	434.449	1.650	50	20	IDGD	
COCCNC(=O)c1ccc(NC(=O)C(=O)NNc2ccccc2[N+](=O)[O-])cc1Cl	773651206	QNZQKIZUXUTRHQ-UHFFFAOYSA-N	435.824	1.706	50	20	IDGD	
CNS(=O)(=O)c1cc(NC(=O)C(=O)NNc2ncc(Cl)cc2Cl)ccc1C	773682712	NBPMVDVWCWJVEL-UHFFFAOYSA-N	432.289	1.687	50	20	IDGD	
COCCn1nc(C)c(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)c1C	774006181	BVVBESKLGWTYEQ-CYBMUJFWSA-N	437.884	1.353	50	20	IDGD	
CC[C@@H](NCC(=O)NNC(=O)c1cccc(C)c1)c1ccccc1OCC(=O)N(C)C	775067950	TUXFDFXSUUJJRN-LJQANCHMSA-N	426.517	1.964	50	20	IDGD	
COCCOc1ccc(C(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)cc1	776201865	MNOORSAWAIJRAA-UHFFFAOYSA-N	436.509	1.961	50	20	IDGD	
CC(=O)Nc1ccc(NS(C)(=O)=O)c(C(=O)NNc2cccc(S(C)(=O)=O)c2)c1	776721137	MUMDQGHHWPXLSX-UHFFFAOYSA-N	440.503	1.177	50	20	IDGD	
CSc1ccccc1CC(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	776985306	YQVUZJNUWFRWAU-UHFFFAOYSA-N	426.542	1.556	50	20	IDGD	
Cc1sc(Br)cc1S(=O)(=O)NNC(=O)CNC(=O)OC(C)(C)C	777939381	LZHNYPYVLKXXIS-UHFFFAOYSA-N	428.330	1.653	50	20	IDGD	
C[C@H](NC(=O)OC(C)(C)C)[C@@H]1CCN(CC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)C1	778973904	BMASWZGYBKGGAT-DZGCQCFKSA-N	435.481	1.591	50	20	IDGD	
CN(NC(=O)c1cnc(C(F)(F)F)nc1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	779414571	RQBXVDMFRSDVBS-UHFFFAOYSA-N	432.403	1.745	50	20	IDGD	
CCn1cnc2c1c(=O)n(CC(=O)NN=Cc1ncccc1C)c(=O)n2Cc1ccccc1	781584016	LVYZSGSQQKMJTR-UHFFFAOYSA-N	445.483	1.282	50	20	IDGD	
CN(Cc1cccc(NC(=O)C(=O)NNc2ncncc2Cl)c1)C(=O)C(F)(F)F	782158371	BCCURWZRVYKZMZ-UHFFFAOYSA-N	430.774	1.733	50	20	IDGD	
CC(C)C(=O)Nc1nc(CC(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)cs1	782354613	MTBLPNWNIWITHS-UHFFFAOYSA-N	438.893	1.938	50	20	IDGD	
Cc1ccc2cccc(NC(=O)C(=O)NNC(=O)c3csc(N4CCOCC4)n3)c2n1	782897297	MWPCQMAJRIPFQR-UHFFFAOYSA-N	440.485	1.236	50	20	IDGD	
CC[C@@H](C)n1nc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)cc1C	783259273	XPCGWJKTZCPRJW-GFCCVEGCSA-N	437.526	1.326	50	20	IDGD	
CC(=NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)c1nccnc1C	783507921	OGKKQTGDBDFGTC-UHFFFAOYSA-N	431.518	1.279	50	20	IDGD	
Cc1ccc(-n2nc(C(C)(C)C)cc2NC(=O)C(=O)NNC(=O)C(=O)N2CCCC2)cc1	784003400	WDOOHDDXVBEZDR-UHFFFAOYSA-N	440.504	1.187	50	20	IDGD	
Cc1csc(-c2ccc(NC(=O)C(=O)NNC(=O)CNC(=O)c3cccs3)cc2)n1	784003701	MCCAAIOQXMUUDH-UHFFFAOYSA-N	443.510	1.696	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNC(=O)CNC(=O)c2cccs2)cc1OCC	784003812	BKYLSXBYLIUQIW-UHFFFAOYSA-N	434.474	1.061	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@H]2CC=CC[C@H]2C(=O)N2CCOCC2)ccc1OC(C)C	784295302	FKLPUEXORCQFCX-ZWKOTPCHSA-N	445.516	1.685	50	20	IDGD	
O=C(NNC(=O)[C@H]1CC=CC[C@H]1C(=O)N1CCOCC1)c1ccc(Br)s1	784295314	FNQNFRXSXWLOLQ-NWDGAFQWSA-N	442.335	1.713	50	20	IDGD	
C=CCN(C)S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2cccc([N+](=O)[O-])c2)cc1	784827431	CUFSIYIXYPWVEP-UHFFFAOYSA-N	433.446	1.483	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc(-n4cnnn4)cc3)n[nH]2)c1	785126274	NKQLLEDBIVSRJX-UHFFFAOYSA-N	445.443	1.069	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)N[C@H]2CCCN(C3CCCCC3)C2=O)c2ccccc2c1=O	785920208	ATCJQNWYRUUCIP-KRWDZBQOSA-N	440.504	1.201	50	20	IDGD	
CCCOc1c(Br)cc(C(=O)NNC(=O)N2CCN(C)CC2)cc1OC	788169264	LRZUUTQCVGUIAN-UHFFFAOYSA-N	429.315	1.848	50	20	IDGD	
O=C(CC1OCCCO1)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	788625781	SSWMWWMFUAXMLY-UHFFFAOYSA-N	433.486	1.079	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)n(-c2ccccc2)n1	789809919	GRNMSXIBMAZCIK-ICSRJNTNSA-N	433.468	1.839	50	20	IDGD	
C[C@]12CCN(C(=O)NNC(=O)c3csc(N4CCOCC4)n3)C[C@H]1C2(Cl)Cl	790655273	HGAFEQCXMFOXOB-ABAIWWIYSA-N	434.349	1.850	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)[C@H]2CC(c3cc(OC)ccc3OC)=NO2)cc1	791543102	RPBCTPUVDMUXKT-HXUWFJFHSA-N	427.457	1.986	50	20	IDGD	
C[C@](O)(Cn1cc(C(F)(F)F)ccc1=O)C(=O)NNC(=O)Cc1ccc(Cl)cc1	792028833	FZBKJSZYYZOHFX-KRWDZBQOSA-N	431.798	1.662	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccc(Br)n1	793023109	HLMNLFRFVVNZLP-UHFFFAOYSA-N	437.250	1.408	50	20	IDGD	
COc1c(NC(=O)C(=O)NNC(=O)c2ccc(C#N)cc2)cc(Cl)cc1C(=O)N(C)C	793027102	XTBVVHCFJXYUTP-UHFFFAOYSA-N	443.847	1.322	50	20	IDGD	
CN(C)C(=O)Nc1cccc(CNC(=O)NNC(=O)CNC(=O)OCc2ccccc2)c1	793048287	JBXCJPUEJRTGSZ-UHFFFAOYSA-N	442.476	1.537	50	20	IDGD	
CCCc1ccc(S(=O)(=O)N2CCN(C(=O)NNC(=O)c3cccc(C)n3)CC2)cc1	793219944	IJUCVSZGQUYLSY-UHFFFAOYSA-N	445.545	1.703	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)[C@H](C)NS(=O)(=O)c2cccc(C(F)(F)F)c2)n1	794089915	LMHJEGRZCIKLLU-NSHDSACASA-N	430.408	1.537	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCN(c2cnccc2C#N)CC1	795051862	UKJDMRCGXNDHHA-UHFFFAOYSA-N	428.880	1.198	50	20	IDGD	
COc1ccccc1-n1nccc1C=NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1	797400129	ODVMTRMCUPZHSR-UHFFFAOYSA-N	441.513	1.960	50	20	IDGD	
CC(=O)N[C@@](C)(C(=O)NNC(=O)c1cc2ccccc2o1)c1ccc(S(C)(=O)=O)cc1	797461655	AYWOTTUBFUHMIS-OAQYLSRUSA-N	443.481	1.649	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)Nc1cc2c(cc1N1CCCCC1)n(C)c(=O)n2C	800591712	ARTIMCWWNZTFBK-UHFFFAOYSA-N	425.493	1.672	50	20	IDGD	
Cn1cc(-n2cc(C(=O)NNc3cc([N+](=O)[O-])ccc3Br)ccc2=O)cn1	800619700	UENQAFWOGPCNQM-UHFFFAOYSA-N	433.222	1.999	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)C2(S(=O)(=O)c3ccc(Cl)cc3)CC2)cc1	801108480	BPSZIBBCGWMGPE-UHFFFAOYSA-N	435.889	1.741	50	20	IDGD	
O=C(Cn1ncn2nccc2c1=O)NNC(=O)Nc1c(Cl)cc(Cl)cc1Cl	802069327	GVZRLFIMAFLIGO-UHFFFAOYSA-N	430.639	1.704	50	20	IDGD	
Cc1ccc(C2=NO[C@H](CNC(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)C2)cc1C	802376309	UHEUFPKAUKTYPZ-SFHVURJKSA-N	434.460	1.416	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(Br)c2cccnc12	802567782	XQAJADVDTDAGNU-SNVBAGLBSA-N	439.266	1.135	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cccc(C(C)(C)O)c2)cc1	806975267	SEPLYQHFZUXMSM-CQSZACIVSA-N	429.473	1.866	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cccc(C(C)(C)O)c2)cc1	806975426	YQCQWXRZHWVYCA-AWEZNQCLSA-N	427.457	1.670	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)N[C@@H]2CCCN(C(=O)N3CCCC3)C2)nc2ccccc21	807461105	OVAFYYGZTVOEJM-OAHLLOKOSA-N	427.509	1.126	50	20	IDGD	
NC(=O)c1ccc(NC(=O)C(=O)NNc2cc(F)c(F)cc2F)c(OCC(F)F)c1	810395659	PBWLJKBZFJPKNX-UHFFFAOYSA-N	432.305	1.929	50	20	IDGD	
O=C1COc2c(cccc2NC(=O)C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)N1	810397752	AFEOYPYONHQGSV-UHFFFAOYSA-N	445.382	1.270	50	20	IDGD	
CO[C@@H]1C[C@H](c2ccccc2)CCC1=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O	814785229	OCFKFPKSZJOTAO-GDBMZVCRSA-N	431.518	1.026	50	20	IDGD	
Cc1ccc2snc(C(=O)OCC(=O)NNC(=O)[C@@H]3COc4ccccc4O3)c2c1	815506282	RYNJASBEHZPYFP-HNNXBMFYSA-N	427.438	1.749	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@]1(C)Cc2ccccc2C(=O)O1	892831540	HTXJURLCLSCIOT-FQEVSTJZSA-N	430.486	1.221	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCc2cc(OC)ccc2OC)nc1	916261303	AOTDYPCRHMZYEP-UHFFFAOYSA-N	437.522	1.956	50	20	IDGD	
Cc1nnc(O)c(C(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)c1C	916760547	QCPLPAXOETXNCT-UHFFFAOYSA-N	444.455	1.576	50	20	IDGD	
Cc1nc2ccnn2c(C)c1CCC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	917532157	PXLSMXVZOAMBIL-UHFFFAOYSA-N	449.559	1.638	50	20	IDGD	
COC(=O)CCOc1ccc(S(=O)(=O)NNC(=O)c2cc(OC)cc(OC)c2)cc1	917725093	XTARQKATNRJGKQ-UHFFFAOYSA-N	438.458	1.269	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)c1ccc(S(=O)(=O)N=c2cc[nH]cc2)cc1	919822738	DVVSODIOQHWUTD-UHFFFAOYSA-N	440.481	1.317	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccco2)nn1-c1ccccc1)N[C@@H]1CCS(=O)(=O)C1	919889269	KIPWBNZQTKTVSR-CYBMUJFWSA-N	429.458	1.263	50	20	IDGD	
O=C(O)c1cc(S(=O)(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)cc2c1OCCO2	919954026	ASEUEVDNZJTVTR-UHFFFAOYSA-N	436.486	1.682	50	20	IDGD	
C[C@@]1(NNC(=O)NCc2ccc(-n3ccc(C(F)(F)F)n3)cc2)CCS(=O)(=O)C1	920920582	NWMQMTVRRYMLTH-MRXNPFEDSA-N	431.440	1.772	50	20	IDGD	
CC(C)(CC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1ccccc1	921277492	QINSZWJHAIMFSY-UHFFFAOYSA-N	445.541	1.836	50	20	IDGD	
CCNC(=O)C1(CNC(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)CCC1	1255754521	FBXOIAFOJRHHSU-UHFFFAOYSA-N	425.530	1.270	50	20	IDGD	
CN(C(=O)OC(C)(C)C)[C@H](C(=O)NNC(=O)COc1ccc(F)cc1)c1cnn(C)c1	1321299734	ZOPUNPHSQOFLNT-KRWDZBQOSA-N	435.456	1.694	50	20	IDGD	
O=C(NC[C@@H]1CN(Cc2ccccc2)CCO1)NNC(=O)c1cncn1-c1ccccc1	1323086085	WZFAWJQXLBZECQ-HXUWFJFHSA-N	434.500	1.717	50	20	IDGD	
Cn1cc([C@@H](NC(=O)NNC(=O)c2csc(N3CCOCC3)n2)c2ccccc2)cn1	1325221328	YKXJQOBZNJQDGQ-KRWDZBQOSA-N	441.517	1.447	50	20	IDGD	
CCn1c(=O)c(C(=O)/C(C#N)=C/c2cccnc2N(C)C)c(N)n(Cc2ccccc2)c1=O	1342253046	DQTVDHQRCJGTFO-QGOAFFKASA-N	444.495	1.911	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)COC(=O)C(F)(F)F)C2)C1	1778899085	ZKNMLYSRLRXLSZ-KGLIPLIRSA-N	435.226	1.158	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3nc4cc(C)c(C)cc4[nH]3)C2)C1	1778925869	CJRCQRJYOCHTJK-BTYIYWSLSA-N	434.924	1.877	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc[n+]([O-])cc2)C1	1779945722	KJYDUEPFGVFWFE-DDUZABMNSA-N	426.311	1.231	50	20	IDGD	
Cc1ccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C3)cc1C	1780403973	RYLQXTMTTBTJCC-HYBUGGRVSA-N	444.576	1.804	50	20	IDGD	
CC(=O)c1cc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@](C)(Cl)CCl)C2)n[nH]1	1780710525	ZVSNUBDZBKQLBJ-AYOQOUSVSA-N	445.347	1.976	50	20	IDGD	
COc1cnc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@](C)(Cl)CCl)C3)C2)c(F)c1	1781227556	BGRYJPDQWPIWRY-QZTJIDSGSA-N	434.295	1.909	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781335494	ZXNAUAWCQHEMTL-MLGOLLRUSA-N	438.294	1.032	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(O)c([N+](=O)[O-])c3)C2)C1	1781542917	YYCZMIKEPONSRR-LJQANCHMSA-N	437.525	1.595	50	20	IDGD	
COc1nn(C)cc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)Br)C1	1781996761	SYJQSIFFEGZIOR-WPKBUWHJSA-N	443.342	1.340	50	20	IDGD	
CCc1ncccc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCC(=O)NN(C)C)C1	1782209463	RHFBNJNCPPQTNR-AUSIDOKSSA-N	445.564	1.145	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4nn(C)cc4c3)C2)C1	1782244722	QKXLLASKEVMJAL-BFUOFWGJSA-N	435.322	1.800	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)C3CCC4(CC3)OCCO4)CCO2)C1	1783881395	LCDJLMQSXBJBIA-QFBILLFUSA-N	430.929	1.003	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3c(F)ccc(OC)c3OC)CCO2)C1	1783881786	UEWLCYKTJTWVIL-XCLFUZPHSA-N	444.887	1.540	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)C1(c3cccc(F)c3)CC1)CCO2	1783933818	ZLIUTEWFYVNTGD-JOCHJYFZSA-N	446.523	1.060	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccnc(Cl)n3)C[C@@H]21	1783970588	XBRIGEVLTJCJIL-MNXVOIDGSA-N	445.745	1.754	50	20	IDGD	
Cc1cc2nc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]4C3)[nH]c2cc1C	1784091809	CQGLXBRSYLMJOK-USJZOSNVSA-N	434.924	1.373	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(=O)nc4cccnn34)C[C@@H]21	1784620718	HSECNKWPCNTGRH-MPTYRVRUSA-N	447.923	1.090	50	20	IDGD	
O=C(CCCc1cccnc1)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1784674550	RMMBMGSPWBGEDX-WMZOPIPTSA-N	428.302	1.925	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCC(=O)N3CCCC3)[C@H]2C1	1785001049	ZVOVFPQLCQVCCA-ZKNHNOBHSA-N	448.391	1.605	50	20	IDGD	
O=C(c1ccc(F)cc1C(F)(F)F)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1785203238	LMOXMUBWEYYSET-WMLDXEAASA-N	438.805	1.888	50	20	IDGD	
O=C(C/N=C/c1ccco1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21	1788679883	ZEUIGTOOJVMGHM-NNPXLFLASA-N	430.274	1.369	50	20	IDGD	
Cc1cncc(CCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]3C2)c1	1789922623	QCQFQCSQRIGMNS-OVWQWFNUSA-N	442.329	1.993	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]3C2)c(O)c1	1789924817	XIRXBXAIQBVNOF-NHJBHEPMSA-N	445.285	1.685	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)c3ccco3)C[C@@H]21	1790960538	BVTLOZDZWVTRJD-IGNRKKQASA-N	429.311	1.466	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c[nH]c3nccc-3c1)C2	1792867673	FWZIOSQGEGBSGU-BQDHKBFISA-N	435.322	1.749	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H](C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](O)CCl)C3)C[C@@H]2C[C@@H]21	1793126773	KCPJBXKFWXFARO-BYWHFUISSA-N	441.956	1.622	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cn1nc(C)cc1C	1794123301	QCBPTPDGLWFTNM-JYYAWHABSA-N	427.343	1.263	50	20	IDGD	
Cc1ccc2oc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)c3cccc(B(O)O)c3)C4)cc2n1	1796398433	ITNVJALWRGMTFO-BCDXTJNWSA-N	433.273	1.382	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1nn(-c2ccccc2)c2c1COC2)[C@@H](O)CCl	1796559398	MTIKCHOMLXMPKM-YBKUAAOGSA-N	444.919	1.754	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1oc(C)nc1C)C2	1796891778	KRKUBGAGMZYKLW-XMOXNHLCSA-N	426.477	1.677	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2)c1ccc2cccnc2n1	1797357643	NWYHNWHWEXTMPG-XOIINTDNSA-N	433.306	1.618	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc2ccccc12)c1ccc(B(O)O)cc1	1797426332	HGSWSMKQWVKKOX-BCDXTJNWSA-N	445.284	1.186	50	20	IDGD	
Cc1nc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)sc1C	1799087352	UPVNCNAUCNFESS-BTTYYORXSA-N	428.518	1.324	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1=NN(c3ccccc3)C(=O)C1)C2	1799269555	IDOMHWBOHINBGJ-QHHYFVSCSA-N	432.908	1.386	50	20	IDGD	
COC(=O)c1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@](C)(Cl)CCl)cn1	1799275317	PMVUASUBFCVCBG-FCIKYMEBSA-N	444.315	1.308	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)c1cccc(Br)c1F	1799500212	GVLDLJJSJVVLDO-YJKIEOBBSA-N	449.704	1.391	50	20	IDGD	
COc1ccc([C@@H](O)C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)Br)cc1	1800754001	CJIMNDRQGCNDIK-MCKBVIGDSA-N	441.322	1.102	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Cl)C3)CC1	1802225587	FVRFGKMKVVDZKT-QKPAOTATSA-N	447.935	1.758	50	20	IDGD	
COc1ccc(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CCC(=O)NN(C)C)c(C#N)c1	1802337999	KEYFDWUENANAME-REPLKXPHSA-N	441.532	1.121	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC2(CCCN(C(=O)[C@H]3CCC(=O)NC3)C2)CC1	1804970605	CNZGJKKRGPBXED-GJZGRUSLSA-N	428.371	1.775	50	20	IDGD	
COCC1(C(=O)N2CCCC3(CCN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)CC3)C2)CC1	1805991735	KSXAFSVBOVSEST-KOEQRZSOSA-N	443.548	1.778	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2cnc(OC)cn2)[C@@H]1c1cccnc1	1806044893	COBBBZWJIOQDRG-MPGHIAIKSA-N	433.896	1.454	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cccc(F)c2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807362857	WTNRDCJQBQVNBM-UGKGYDQZSA-N	447.275	1.534	50	20	IDGD	
N#Cc1cc(CC(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@H]2c2cccnc2)ccc1F	1808550364	VGNYPTOREPHFOB-SCWSEQNSSA-N	444.894	1.941	50	20	IDGD	
O=C(COc1cccnn1)N1CCC2(CCCN(C(=O)CCBr)C2)CC1	1809069698	FKCWCBUDIAOZDY-UHFFFAOYSA-N	425.327	1.872	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC2(CCCN(C(=O)CCC(F)(F)F)C2)CC1	1809480940	MHCQRWTXIRLUII-UHFFFAOYSA-N	441.454	1.872	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@H](CNC(=O)c2cc(CO)on2)[C@@H]1c1cccnc1	1811592076	FUFPDUTWVZEHJO-KXBFYZLASA-N	432.553	1.733	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)C#Cc2ccccc2)[C@H]1c1cccnc1	1813071392	PGZRZQDRHYEZMK-OFVILXPXSA-N	447.539	1.512	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)Cn2cc(C)c(O)nc2=O)[C@@H]1c1cccnc1	1814040484	MTTIETCADCLLOK-BQFCYCMXSA-N	447.923	1.376	50	20	IDGD	
C[C@@H](CS(C)(=O)=O)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCBr)[nH]n1	1815226460	DHTILOJLIMMNIV-AAEUAGOBSA-N	449.371	1.868	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)Cc3ccc(F)cn3)sc2C1	1815506826	LXIXBTWFTSNPMF-CQSZACIVSA-N	448.524	1.205	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)C(Cl)Cl)[nH]n1)c1cccc(B(O)O)c1	1817479367	LSUYBXFXTPYETG-ZDUSSCGKSA-N	425.081	1.199	50	20	IDGD	
C[C@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](F)Cl)n[nH]1)[C@H]1SC(=N)NC1=O	1818038662	ZLWGWTVBACECAG-ZPKWADRFSA-N	430.893	1.739	50	20	IDGD	
CC[C@@H](O)C(=O)N1CCCC[C@H]1c1cc(NC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)n[nH]1	1818110365	CHVLKEUZXKXDTR-JXBLVPALSA-N	429.481	1.307	50	20	IDGD	
Cc1ccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cnccc3C(=O)NN)n[nH]2)o1	1819401667	NDUQTIPXHOIMAB-INIZCTEOSA-N	437.460	1.929	50	20	IDGD	
C[C@H](NC(=O)c1cnccn1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](F)Cl)CC2	1820023196	SCVXONFPEQKIIF-IGJMFERPSA-N	440.888	1.198	50	20	IDGD	
O=C1Cc2cccc(C(=O)Nc3cc([C@H]4CCCCN4C(=O)[C@@H](O)CCl)[nH]n3)c2N1	1821512762	IJQSVAOIFJQBDJ-CABCVRRESA-N	431.880	1.810	50	20	IDGD	
O=C(Cc1ccccc1O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1822010781	BHKQQVPVNISCMS-IBGZPJMESA-N	448.288	1.344	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](C)S)n[nH]1	1822382165	ZMURHFZKWWHSSZ-QSINWOOJSA-N	431.522	1.854	50	20	IDGD	
CC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc3n(n1)CCNC3=O)CC2	1822844291	YBFGIGSUVIKXOG-NXEZZACHSA-N	436.925	1.326	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)CCNC(C)=O)sc2C1	1825246954	VRWZQXISJLAHIE-GHMZBOCLSA-N	431.356	1.755	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1nc3ncccn3n1)CC2	1826000311	RPRQFBFMWIUISU-UWVGGRQHSA-N	435.897	1.060	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)Cc2ccccn2)CC1	1827225148	JMNVNFZKBYGYJO-HXUWFJFHSA-N	429.565	1.617	50	20	IDGD	
Cc1c[nH]cc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1	1827784133	WAPTUJDMXFGPCO-FQEVSTJZSA-N	438.532	1.869	50	20	IDGD	
CCNC(=S)NCC(=O)N1CCC([C@H]2CCCCN2C(=O)CO[Si](C)(C)C)CC1	1829104457	YJIJDTHOVHIHAR-QGZVFWFLSA-N	442.702	1.942	50	20	IDGD	
Cc1nccnc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1	1829437759	ZOKRBZNDSVFILG-FQEVSTJZSA-N	436.321	1.012	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CS[C@@H]3CCCCO3)C2)C1	1830364664	OAISPLRPALQFNX-YLJYHZDGSA-N	449.013	1.968	50	20	IDGD	
CC(C)=NO[C@@H](C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1	1830414483	GEHWXZJOPAZRDA-UWJYYQICSA-N	443.353	1.401	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3ccco3)C2)C1	1830535110	JFKIPBUSPYNGEG-HNAYVOBHSA-N	443.338	1.700	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3cc(C)n(C)n3)CCO2)C1	1830945624	OGJLPYUNYVLGPI-XLIONFOSSA-N	426.945	1.135	50	20	IDGD	
O=C1C[C@H](C(=O)N2CCCC[C@@H]2C2CCN(C(=O)[C@@H](F)Br)CC2)CCN1	1831942424	VUOJJRMLKLRXIO-IIAWOOMASA-N	432.334	1.823	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)/C=C/c3ccco3)CCO2)C1	1833078129	JADDCTLUOLRTGC-KOBPNJQFSA-N	441.322	1.923	50	20	IDGD	
COc1ncc(C(=O)N2CCC(N3CCC(NC(=O)[C@H](O)CCl)CC3)CC2)cc1C	1833308946	FFEYUIJACLTCCO-GOSISDBHSA-N	438.956	1.184	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3ccc4cncn4c3)CC2)CC1)[C@H](O)CCl	1833310154	LFXAVPWIHOMFOC-LJQANCHMSA-N	433.940	1.119	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnc(OCF)cn3)CCO2)C1	1833567090	GNTJNKURKOQRRS-KUHUBIRLSA-N	444.891	1.260	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCBr)C3)C2)s1	1833954247	IQFPKGXNMNBNFW-QGZVFWFLSA-N	431.352	1.912	50	20	IDGD	
O=C(CCBr)NC1CCN(C2CCN(C(=O)[C@H]3CC[C@H](O)CC3)CC2)CC1	1834423522	PFXLXLIRGUKRGG-RZDIXWSQSA-N	444.414	1.894	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)NC1CCN(C2CCN(C(=O)[C@](C)(Cl)CCl)CC2)CC1	1835833098	VJGYVYXSTXHACF-JLTOFOAXSA-N	447.407	1.485	50	20	IDGD	
CCOc1ccccc1C(=O)NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836242262	LLDRIEAUFYUYRP-LJQANCHMSA-N	437.968	1.870	50	20	IDGD	
CC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)CCNC(=S)NC)CC2)CC1	1836397182	UBZXYWHNMZPRNI-INIZCTEOSA-N	432.034	1.059	50	20	IDGD	
C[C@@H](CC(N)=O)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](C)CBr)CC2)CC1	1836670853	VLWLIGLPYQXXEU-KBPBESRZSA-N	446.386	1.528	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc3cncn3c1)CCO2	1837122298	FVWQGMMHYLNSIM-OAQYLSRUSA-N	446.580	1.256	50	20	IDGD	
O=C(CC1CCC1)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1	1837921101	ZMISSCIPOULPDW-UHFFFAOYSA-N	428.338	1.169	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cc(F)ccc3F)C2)C1	1839149676	ODYISOBKWSNTNF-UZLBHIALSA-N	430.879	1.981	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccccc3O)C2)C1	1839151535	VQHYLBRJXFURQZ-RTBURBONSA-N	431.316	1.699	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)s1	1839198180	WNHKXXWGNQJJKJ-BBRMVZONSA-N	435.315	1.817	50	20	IDGD	
O=C(c1cccc2nscc12)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1839576258	USVFFAPPUVJYFB-CRAIPNDOSA-N	427.885	1.901	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnn4cccc(C)c34)CCO2)C1	1839612127	BBFFPOCYKFBHNM-LAUBAEHRSA-N	434.924	1.730	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3CC(F)(F)C3)C2)C1	1839961634	CXLHYZFXRZSVGJ-XJKSGUPXSA-N	439.297	1.662	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3C[C@@H]3C3CC3)C2)C1	1839962117	VBVJMWSVMVXAMT-DRMAHVMPSA-N	429.355	1.662	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)C#Cc3ccccc3)C2)C1	1839963410	JJWLIFWBNJVCJA-WIYYLYMNSA-N	449.345	1.668	50	20	IDGD	
O=C([C@@H]1CCc2ccccc2O1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1840136646	HBAUEOOZXOFILF-ABSDTBQOSA-N	426.872	1.371	50	20	IDGD	
O=C(C(Cl)Cl)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CCc3ccccc3O1)CCO2	1840139290	NVMLGXVNRUHTJL-OXQOHEQNSA-N	443.327	1.640	50	20	IDGD	
NCC(=O)N1CCOC[C@]2(C1)CN(C(=O)CCCCCCCCBr)CCO2	1840937113	UPHDIGMZAGOHCA-LJQANCHMSA-N	448.402	1.527	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)CCNC(C)C)C1	1842994501	QNKWHPBAAMIVAY-UHFFFAOYSA-N	432.477	1.725	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(CC(=O)N2CC3(CCCN3C(=O)[C@@H](F)Cl)C2)CC1	1843367684	VXDODPCBZKPOIA-OAHLLOKOSA-N	432.924	1.277	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC2(CCCN2C(=O)c2ccc3c(c2)NC(=O)CO3)C1	1844079005	JRMWCLOQVPFOOJ-GFCCVEGCSA-N	436.306	1.866	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1c(F)ccnc1Cl)C2	1844263722	NEQYNGLLICQQSA-UHFFFAOYSA-N	432.843	1.003	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)CNC(C)(C)C)C2	1844692335	LSTQQECVGXWSQZ-UHFFFAOYSA-N	432.477	1.725	50	20	IDGD	
Cc1ccc(OC(C)(C)C(=O)N2CCCC23CN(C(=O)CCC(=O)NN(C)C)C3)nc1	1845037913	XTUNUNJLDWLKSH-UHFFFAOYSA-N	431.537	1.124	50	20	IDGD	
CN(CC(=O)N1CCCC12CN(C(=O)C1CC(F)(F)C1)C2)NC(=O)NCc1ccccc1	1845038220	FYJVTZWSMDHELW-UHFFFAOYSA-N	449.502	1.581	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)C1(O)CCN(C(=O)OC(C)(C)C)CC1)C2	1845163438	XKGPGOPJWBCMGJ-HNNXBMFYSA-N	443.972	1.969	50	20	IDGD	
CCCn1c(=O)n(CCC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)c2ccccc21	10159870	YCSNSNPIHLYWRD-UHFFFAOYSA-N	448.483	1.956	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(C)c(C(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1	15795076	FNAFHXSXDBEKIY-LJQANCHMSA-N	447.513	1.627	50	20	IDGD	
Cc1c(-c2ccccc2)oc2c(C(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)cccc2c1=O	16785925	FSPVQBLSPMVDKV-HNNXBMFYSA-N	440.477	1.964	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)NCc1cccc(NS(C)(=O)=O)c1	28423749	QIAYWWZDWKHFSX-UHFFFAOYSA-N	426.882	1.864	50	20	IDGD	
CC(C)CC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1ccc2[nH]c(=O)[nH]c2c1	28689606	BRNGNTLTJPZERY-UHFFFAOYSA-N	431.474	1.464	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)CNC(=O)CC12CC3CC(CC(C3)C1)C2	105481027	DBONMVJRTXNEEW-UHFFFAOYSA-N	428.533	1.977	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)CCc2ccc(S(=O)(=O)NC3CC3)cc2)cc1	110891645	YORKAVGCWVGXSZ-UHFFFAOYSA-N	430.530	1.628	50	20	IDGD	
CCc1noc(-c2ccc(CCNC(=O)NNC(=O)CNC(=O)c3ccco3)cc2)n1	727844504	VSFRLADLUCDZBC-UHFFFAOYSA-N	426.433	1.195	50	20	IDGD	
NS(=O)(=O)c1ccc(N2CCN(C(=O)NNC(=O)CCCc3ccccc3)CC2)cc1	727845795	YVWDBYBNJMEPRP-UHFFFAOYSA-N	445.545	1.220	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)NC2CC2)cc1)NNc1nc(-c2cccnc2)no1	728075978	DDEMHCFXELYRGQ-UHFFFAOYSA-N	428.474	1.648	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)N3CCN(C(=O)CN4CCCC4)CC3)cc2C1	728715358	YHKLXICLSSRKOF-OAHLLOKOSA-N	433.578	1.467	50	20	IDGD	
O=C(O)CCCOc1ccc(S(=O)(=O)NNC(=O)Cc2cccnc2)cc1Cl	728856474	SCTPABCZNDLWGX-UHFFFAOYSA-N	427.866	1.531	50	20	IDGD	
O=C(COC(=O)c1cnc(-c2ccco2)s1)NNC(=O)[C@H]1COc2ccccc2O1	729025289	VEWWRQSKKNYLJJ-CQSZACIVSA-N	429.410	1.547	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1cn(-c2ccccc2)nc1-c1cccs1	729275079	KLORTDVSRVORLH-LBPRGKRZSA-N	433.515	1.300	50	20	IDGD	
CCN1CCC[C@@H]1CN1C[C@@H](C(=O)NNC(=O)CSc2ccc(Cl)cc2)CC1=O	729626328	CBPOSYSLUFOULP-GOEBONIOSA-N	438.981	1.912	50	20	IDGD	
O=C(Cc1cc[nH]n1)NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2Cl)c1	730102678	LLZGYPZEPWHPAO-UHFFFAOYSA-N	433.877	1.868	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)c2cc(S(=O)(=O)N3CCC[C@H](C)C3)cn2C)cc1	730205934	SGBUFHILWKZPOC-INIZCTEOSA-N	448.545	1.594	50	20	IDGD	
CC(C)(C(=O)NNC(=O)CN1C(=O)N[C@](C)(c2ccc(F)cc2)C1=O)c1ccccc1	731173356	NQOWEIRRNWZEOJ-JOCHJYFZSA-N	426.448	1.718	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])o1)c1cc(-c2ccccc2)[nH]n1	731875341	YORGFJILYGPEFR-OAHLLOKOSA-N	438.400	1.644	50	20	IDGD	
CC[C@H](C)NS(=O)(=O)c1ccc(C(=O)NNc2ccccc2S(C)(=O)=O)cc1	732303466	FXWPCNSVHPWUKV-ZDUSSCGKSA-N	425.532	1.924	50	20	IDGD	
Cc1c(Cl)cccc1-n1ccnc1SCC(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1	732307812	NJBVFYXZACRKSL-GFCCVEGCSA-N	442.950	1.508	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)NCCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1ccccc1	732453386	DBRCUPISMRHSBT-QGZVFWFLSA-N	449.489	1.397	50	20	IDGD	
N#Cc1ccc(N2C(=O)N[C@H](CCC(=O)NNC(=O)CCCc3ccccc3)C2=O)cc1	733758304	RDVRRBXYPRWBFB-LJQANCHMSA-N	433.468	1.934	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2c1=O	735462151	RALCSXPOTZXUSD-UHFFFAOYSA-N	429.820	1.982	50	20	IDGD	
Cc1ccc(Nc2cccc(C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)c2)nn1	736093193	WYEOMQHJMMRILS-UHFFFAOYSA-N	429.481	1.997	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN2CCN(CC(=O)N3CCCCC3)CC2)cc1C	736307773	BFNOIYZPLJUKRH-UHFFFAOYSA-N	435.594	1.010	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2cccc(Oc3cnccn3)c2)n1	736924490	AURZAAUQRPUSCP-UHFFFAOYSA-N	427.442	1.581	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2cn(-c3cccc(C(F)(F)F)c3)nn2)C[C@@H](C)O1	740076014	QKDGNPOEHDNIDK-BETUJISGSA-N	440.426	1.546	50	20	IDGD	
COCCOCC(=O)NC1CCC(C(=O)NNC(=O)c2cccc3ccccc23)CC1	741576119	LNMALTKBPXPFCK-UHFFFAOYSA-N	427.501	1.939	50	20	IDGD	
CC(=O)N[C@@H](Cc1c[nH]c2ccc(Br)cc12)C(=O)NNC(=O)c1ccccn1	742031171	BRGCYNFJJOVUAZ-KRWDZBQOSA-N	444.289	1.834	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)CNC(=O)c1ccco1)Oc1ccc(Br)cc1	743576824	KCAGUFMTBJLTKZ-NSHDSACASA-N	439.266	1.570	50	20	IDGD	
CCCCN1C(=O)c2ccc(C(=O)OCC(=O)NNC(=O)c3ccc(C#N)cc3)cc2C1=O	744453065	VZIIKBKVDJGJHN-UHFFFAOYSA-N	448.435	1.572	50	20	IDGD	
Cc1ccc(-c2ocnc2C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1	745357684	LYSKIZQKJDQQOZ-QGZVFWFLSA-N	437.408	1.794	50	20	IDGD	
CCc1cnc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(CC)CC)c2)s1	745904825	RIRSJMFXNFQNJI-UHFFFAOYSA-N	439.563	1.880	50	20	IDGD	
Cc1cc(C)c(S(=O)(=O)N2CCC(C(=O)NNC(=O)Cc3ccncc3)CC2)c(C)c1	747322989	WAGDQHAEHGRBHU-UHFFFAOYSA-N	444.557	1.798	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)[C@H]1CCCN1c1ncccn1	747347796	GQYMLQMCJQOKIZ-SWLSCSKDSA-N	434.294	1.823	50	20	IDGD	
NC(=O)CC1CCN(C(=O)NNC(=O)[C@H]2Cc3ccccc3CN2Cc2ccccc2)CC1	747980448	VKMIJEZLSHKMOJ-JOCHJYFZSA-N	449.555	1.942	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cc3ccccc3o2)cc1S(=O)(=O)NC1CC1	749479057	YBTUHBPBYAURSV-UHFFFAOYSA-N	429.454	1.957	50	20	IDGD	
O=C(CN1C(=O)CCOc2ccccc21)NNc1nc(Br)cn2ccnc12	750247598	FOWQVHQPLGHJGJ-UHFFFAOYSA-N	431.250	1.751	50	20	IDGD	
O=C(NN[C@H](C(=O)NCc1ccccc1)c1ccccc1)c1ccc(-n2cnnn2)cc1	750268964	NKMIXAVTVCJYNX-NRFANRHFSA-N	427.468	1.954	50	20	IDGD	
Cc1cc(S(=O)(=O)NNC(=O)CNC(=O)c2cccs2)sc1Br	751213705	VKEFRKDHPPMKNK-UHFFFAOYSA-N	438.350	1.620	50	20	IDGD	
C[C@H]1C[C@@H](CNC(=O)OC(C)(C)C)CN1CC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	752085231	NGTSHYBXTYENNS-KBPBESRZSA-N	435.481	1.591	50	20	IDGD	
COc1cc(OC)cc(N2C[C@H](C(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)CC2=O)c1	752266327	OZBKKBBMLIZYPR-CYBMUJFWSA-N	428.401	1.426	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(-n3cccc3)nc2)c1	753275239	XJSFZVKIYRJKMA-UHFFFAOYSA-N	441.513	1.978	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)c2cc(OC)c(S(N)(=O)=O)s2)cc1	754185744	YLBUYZPMEYABOX-SNVBAGLBSA-N	443.503	1.031	50	20	IDGD	
CNS(=O)(=O)c1cc(NC(=O)COC(=O)/C(C#N)=C/c2ccc(O)cc2)ccc1C	754539059	FYHXYHJDYCYTHN-OQLLNIDSSA-N	429.454	1.698	50	20	IDGD	
CC(C)(C(=O)NNC(=O)Cc1cc[nH]n1)S(=O)(=O)c1ccc(Br)cc1	755289915	YLMNDDXOWRILNI-UHFFFAOYSA-N	429.296	1.115	50	20	IDGD	
COc1c(F)ccc(F)c1C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	755808194	BPFUUXITDQKRGT-UHFFFAOYSA-N	441.460	1.061	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)CCC(=O)NC2CCCC2)CC1	755901773	CTCWBQAFXPBQDX-UHFFFAOYSA-N	425.530	1.555	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)Nc1cccc(Cn2nc3ccccn3c2=O)c1	755937308	FVYSYFSKTITSRL-UHFFFAOYSA-N	446.467	1.948	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)Nc1cccc(OCC(=O)N(C)C)c1	755961074	WIDMBZDZVSPVOY-UHFFFAOYSA-N	430.461	1.784	50	20	IDGD	
O=C(COC(=O)Cc1ccc([N+](=O)[O-])cc1Br)NNC(=O)c1ccccc1	756524136	BFRHSWYTHPSPJF-UHFFFAOYSA-N	436.218	1.904	50	20	IDGD	
CCOC(=O)[C@@H](C)NC(=O)c1ccc(NC(=O)NNC(=O)CCc2ccccc2O)cc1	756791064	UATQZQVCSKCICJ-CQSZACIVSA-N	442.472	1.859	50	20	IDGD	
CCOc1cc(N2CCN(C)CC2)ccc1NC(=O)NNC(=O)Cn1nc(C)cc1C	756819761	BSHVEUFWRBEHMH-UHFFFAOYSA-N	429.525	1.503	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)Nc2ccc(S(=O)(=O)NCCC(C)C)cc2)n1	757798338	MYIRLGNBKZVUKI-UHFFFAOYSA-N	436.538	1.677	50	20	IDGD	
O=C(N=c1cc[nH]cc1[N+](=O)[O-])NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	757805331	HLKBLZFKSISZAL-UHFFFAOYSA-N	448.461	1.053	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)Nc1cccc2c1CCN2S(C)(=O)=O	758299627	DADYNBZBTNDNKN-UHFFFAOYSA-N	432.502	1.803	50	20	IDGD	
CCc1c(C(=O)NNC(=O)C(=O)Nc2ccccn2)nnn1-c1ccc(OC(C)C)cc1	758840852	RSUFCBYKDOHKKQ-UHFFFAOYSA-N	437.460	1.412	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)C(=O)Nc1ccccn1)c1noc(-c2ccc(Cl)cc2)n1	758841937	ZABKOWWMBFQPJX-JTQLQIEISA-N	429.824	1.815	50	20	IDGD	
CN1C(=O)C[C@H](C(=O)NNc2nc(O)c3cnn(C)c3n2)[C@@H]1c1ccc(Cl)c(F)c1	759108213	QJWHKPAYILWJHN-XPTSAGLGSA-N	433.831	1.524	50	20	IDGD	
CCNS(=O)(=O)c1ccc(CC(=O)NNC(=O)COc2ccccc2OCC)cc1	759357556	NCHCPHCFJAXQEQ-UHFFFAOYSA-N	435.502	1.152	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)NC[C@@H]1CN(Cc2ccccc2)CCCO1	759361017	IPRLQMVJFKNHOX-HXUWFJFHSA-N	430.480	1.826	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1cnc(-c2cccnc2)s1	761813181	MECGTJQOBSEHHM-UHFFFAOYSA-N	445.526	1.983	50	20	IDGD	
C[C@@H](C(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2ccccc2O)c1)n1cccn1	763527159	GTAOPOVWBCYIKA-ZDUSSCGKSA-N	436.428	1.188	50	20	IDGD	
N#Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1C(F)(F)F	763574564	DTIMZVCXBUQPBJ-OAHLLOKOSA-N	434.330	1.503	50	20	IDGD	
COC(=O)c1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccccc2)[nH]n1	763604811	LUMNDWMIZHMACL-UHFFFAOYSA-N	441.831	1.916	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cccnc2OCC(F)F)c2ccccc2n1	763615785	QFKYAQQMCNFODB-UHFFFAOYSA-N	429.383	1.982	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)c1	763629084	DMDVKAIMLZWTEL-UHFFFAOYSA-N	438.343	1.670	50	20	IDGD	
CCOC(=O)c1cc(F)c(F)cc1NC(=O)C(=O)NNC(=O)c1c(C)nc2ccccn12	763629589	NSBVDKRDBBCUIU-UHFFFAOYSA-N	445.382	1.497	50	20	IDGD	
CCn1cc(NC(=O)C(=O)NNC(=O)COc2cccc(C(F)(F)F)c2)ccc1=O	763639205	CEQNULYAHTWRTC-UHFFFAOYSA-N	426.351	1.052	50	20	IDGD	
CSc1ccccc1NC(=O)C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	763718144	HXNAQLSNPNTITE-UHFFFAOYSA-N	436.515	1.059	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(C(=O)NCC(C)C)cc2C)cc1	763819976	CGYZCHHHYQNQSR-UHFFFAOYSA-N	440.500	1.854	50	20	IDGD	
CCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)c(C)c1	763841548	SNYDZCACGQCHDG-MRXNPFEDSA-N	440.500	1.915	50	20	IDGD	
CCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)c(C)c1	763864696	GBOQMWOMCFLKGO-CYBMUJFWSA-N	430.436	1.437	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccccc1O[C@@H]1CCOC1	763867338	UUQSRHULVMVLOR-CZUORRHYSA-N	431.420	1.547	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)CCSc2ccc(F)cc2)ccc1-n1cnnn1	763894382	BJZXEWLALDUECO-UHFFFAOYSA-N	443.464	1.378	50	20	IDGD	
CCN1CCN(Cc2ccc(NC(=O)C(=O)NNC(=O)Cc3ccc(F)cc3)cc2)CC1	763919355	OKSVBZMUVMHQSK-UHFFFAOYSA-N	441.507	1.292	50	20	IDGD	
CC(C)Sc1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1	764002511	NTPVJSMZERPPTE-JTQLQIEISA-N	433.939	1.361	50	20	IDGD	
Cc1cc(-c2nc3cc(F)ccc3n2C)ccc1NC(=O)C(=O)NNC(=O)c1cnccn1	764025653	XWHRPWJFEFVGKS-UHFFFAOYSA-N	447.430	1.878	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(F)c(OC)cc2OC)o1	764139107	OCNHYXQONRIBQI-UHFFFAOYSA-N	436.440	1.677	50	20	IDGD	
C[C@@H](c1cccc(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)c1)N1CCOCC1	764152379	DKSRJVHRUOFRMC-YWZLYKJASA-N	438.484	1.169	50	20	IDGD	
CN(C)C(=O)c1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)Cn1ccc2ccccc21	764239314	LONDDZPUQJEUCJ-UHFFFAOYSA-N	441.875	1.783	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2cccc(OC(F)F)c2)ccc1NC(C)=O	764259796	NZGIYCCPIXSWLP-UHFFFAOYSA-N	436.371	1.655	50	20	IDGD	
CC(C)N(C)c1cccc(NC(=O)C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1	764265896	HACACJTZXBFQLY-UHFFFAOYSA-N	439.520	1.324	50	20	IDGD	
O=C(CCCc1cccs1)NNC(=O)C(=O)Nc1ccc(CCN2CCOCC2)cc1	764342502	ZIKQYTNMWGMCET-UHFFFAOYSA-N	444.557	1.732	50	20	IDGD	
CS(=O)(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)CCCc2cccs2)c1	764342820	KBRIQETVWLOFHC-UHFFFAOYSA-N	443.934	1.914	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1F)C(=O)Nc1ccc(N2C(=O)CCCC2=O)cc1	764413959	XNMHTTGWOVAWEC-UHFFFAOYSA-N	446.822	1.922	50	20	IDGD	
CN1CCC(NC(=S)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)CC1	764519660	UWRKYJWIXZFDEG-UHFFFAOYSA-N	439.029	1.047	50	20	IDGD	
CC(C)(C)OC(=O)NNC(=O)C(=O)Nc1cc(N2CCCS2(=O)=O)ccc1Cl	765391235	PVSJJMLFOCMMGM-UHFFFAOYSA-N	432.886	1.374	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc1S(C)(=O)=O	766073413	BRNMJPIIWCKVBS-UHFFFAOYSA-N	428.470	1.619	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)c1cnn2ccccc12	766663100	JEPOUHLPRRCHKS-UHFFFAOYSA-N	426.908	1.567	50	20	IDGD	
O=S(=O)(CBr)N1CCN(S(=O)(=O)c2c(F)cc(F)cc2F)CC1	767849654	IQWLMQOTNKZCCH-UHFFFAOYSA-N	437.259	1.092	50	20	IDGD	
O=C(c1ccn(-c2ccc(F)cc2F)n1)N1CCN(S(=O)(=O)CBr)CC1	768387448	LXGMUJITIVXGDB-UHFFFAOYSA-N	449.277	1.591	50	20	IDGD	
CC(C)(C)OC(=O)N(CC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)c1ccccc1	769059115	DZWDGVMXHTUCRX-UHFFFAOYSA-N	437.460	1.865	50	20	IDGD	
CSCCNC(=S)NNC(=O)[C@H](C)NC(=O)c1ccc(Br)s1	769769517	VDAHYYHRHDRWNA-ZETCQYMHSA-N	425.399	1.487	50	20	IDGD	
Cn1c(=O)c2cc(NC(=O)NNc3ccc(F)cc3Br)cnc2n(C)c1=O	769960022	YFAXAWPSAICGMJ-UHFFFAOYSA-N	437.229	1.682	50	20	IDGD	
Cc1nn(CC(=O)OC(C)C)c(C)c1C=NNC(=O)C(=O)NCc1ccc(Cl)cc1	771562756	RQXQLKVVTUZHMP-UHFFFAOYSA-N	433.896	1.871	50	20	IDGD	
Cc1ccc(N2C[C@@H](C(=O)NNC(=O)C(=O)NCc3ccc(Cl)cc3)CC2=O)cc1F	772200151	OANHCDHYJPSILW-AWEZNQCLSA-N	446.866	1.604	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NC2CCC(O)(CC)CC2)c1	772588254	IRSAQAQNCRTQBJ-UHFFFAOYSA-N	440.566	1.745	50	20	IDGD	
CC(C)[C@@H](C(=O)NNC(=O)c1ccc(F)cc1Br)N1CCCS1(=O)=O	772671757	SSRJNGSQWCWSJS-ZDUSSCGKSA-N	436.303	1.409	50	20	IDGD	
Cn1cc([C@@H](NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c2ccc(F)cc2)cn1	773133268	XRWUBGKWJHTBMX-SFHVURJKSA-N	435.423	1.269	50	20	IDGD	
COc1cccc(C)c1NC(=O)C(=O)NNC(=O)COc1ccc(Br)cc1	773526105	USJDFTKIHIVALW-UHFFFAOYSA-N	436.262	1.931	50	20	IDGD	
CNC(=O)CCOc1ccc(NC(=O)C(=O)NNc2ccc(C(F)(F)F)cn2)cc1	773666370	OHUGGDRAZORJTK-UHFFFAOYSA-N	425.367	1.697	50	20	IDGD	
Cc1nc(-c2cccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc3cccc(Cl)c3)c2)n[nH]1	774009984	SVWMCMKYEDGDRT-NSHDSACASA-N	442.863	1.987	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1cccc([C@H]2CNC(=O)C2)c1	774010029	UOAWTOCZDRQWMN-GXTWGEPZSA-N	444.875	1.497	50	20	IDGD	
Nc1ccc(Br)cc1C(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	775091720	TWAVPZPURAYHMW-UHFFFAOYSA-N	437.206	1.558	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN[C@@H](c2ccc(F)cc2)c2cnn(C)c2)cc1OC	775751851	OVJOGYKBYBTYBU-NRFANRHFSA-N	441.463	1.717	50	20	IDGD	
CCOc1ccc2c(c1)[C@H](NC(=O)NNC(=O)c1nn(C)c(=O)c3ccccc13)CCO2	776247119	IQQUNCGICNVRJV-QGZVFWFLSA-N	437.456	1.800	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CN(C)[C@@H](C)c2cccc(N3CCCS3(=O)=O)c2)c1	778227739	WDBMJOJKJXQYKH-KRWDZBQOSA-N	444.557	1.989	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)c2cccc(CS(=O)(=O)NC(C)(C)C)c2)nc1C	778430741	ZNHLCUFKKNCDOK-UHFFFAOYSA-N	449.533	1.937	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1cc(Cl)ccc1OC1CCCC1	778714142	PTTQQJDUVZHRFS-LBPRGKRZSA-N	427.885	1.799	50	20	IDGD	
Cn1nc(SCC(=O)NN=Cc2cc(Cl)cc(C(F)(F)F)c2)c(=O)n(C)c1=O	780207559	GKGFOYIBPOKBSN-UHFFFAOYSA-N	435.815	1.394	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)NCCC(=O)N2CCN(c3ccccc3)CC2)c1	780827686	LVTKLYKABDHKSK-UHFFFAOYSA-N	425.489	1.838	50	20	IDGD	
Cc1ccc(CNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c(N2CCCC2)n1	781385028	JZRBYMUUABCGKI-UHFFFAOYSA-N	438.536	1.527	50	20	IDGD	
CC(=O)N1CCN(c2cccc(NC(=O)NNC(=O)c3cc(Br)c[nH]3)c2)CC1	782084255	YOSJIQRXUHJRPK-UHFFFAOYSA-N	449.309	1.912	50	20	IDGD	
CC(C)N(C)S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ncncc2Cl)cc1	782166327	RLQMMFRJNYUZCU-UHFFFAOYSA-N	426.886	1.241	50	20	IDGD	
CCCOc1cccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)c1	784216788	PSXHHZVXVZZZIL-UHFFFAOYSA-N	432.502	1.998	50	20	IDGD	
Cc1c(NNC(=O)C(=O)Nc2ccc(N3CCNC(=O)C3)c(Cl)c2)cccc1[N+](=O)[O-]	784353795	VLKXATMGRQWUQC-UHFFFAOYSA-N	446.851	1.575	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)C(=O)Nc2ccc(C(=O)NC3CCCC3)cc2)c1	784840021	WNBVAPXGMVLYBT-UHFFFAOYSA-N	444.513	1.844	50	20	IDGD	
COc1cccc(NNC(=O)C(=O)Nc2ccc(NC(=O)NC[C@H]3CCCO3)cc2)n1	784842991	DYGPPCKGDYZARH-OAHLLOKOSA-N	428.449	1.473	50	20	IDGD	
Cc1ccnc(-c2ccc(NC(=O)C(=O)NNc3cccc(S(C)(=O)=O)c3)cc2)n1	784844993	VXNYYYLBPWSWOY-UHFFFAOYSA-N	425.470	1.937	50	20	IDGD	
C[C@H]1CCCN(Cc2ccc(NC(=O)C(=O)NNC(=O)Cc3cn4ccccc4n3)cc2)C1	785067862	QKCSZYGVFRYWLK-KRWDZBQOSA-N	448.527	1.895	50	20	IDGD	
CNS(=O)(=O)c1ccc(C)c(NC(=O)C(=O)NNc2ccc(OC)c(Cl)c2)c1	785118308	QUWLWEQBHWDEHZ-UHFFFAOYSA-N	426.882	1.647	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2ncn(Cc3ccc(Cl)cc3)n2)n1	785226537	IRRYXXLXPGKGDW-UHFFFAOYSA-N	443.899	1.698	50	20	IDGD	
CCOC(=O)[C@@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNc2cc(F)cc(OC)c2)cc1	785246125	LHIVAYUXSKENOY-GFCCVEGCSA-N	446.435	1.598	50	20	IDGD	
Cc1nc(C(=O)NNC(=O)NCc2ccc(Cl)cc2)nn1-c1n[nH]c(C(F)(F)F)n1	787430120	ZTZNPWQISSNTFG-UHFFFAOYSA-N	443.777	1.510	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2ccc(C)c(N3CCNC3=O)c2)c1	787541451	SBTDLINJMBIWOP-UHFFFAOYSA-N	439.472	1.306	50	20	IDGD	
CSC[C@H](C(=O)NNc1nnc(-c2ccccn2)s1)N1C(=O)[C@@H]2CCCC[C@H]2C1=O	788563964	YLIMIEARNMOSNL-YRGRVCCFSA-N	446.558	1.950	50	20	IDGD	
CC(C)n1nc(C(=O)NNS(=O)(=O)C2=Cc3ccccc3OC2)c2ccccc2c1=O	788744642	WQIIJMAZBNKDMB-UHFFFAOYSA-N	440.481	1.975	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)C(=O)Nc1nc(C(C)(C)C)cs1	789735987	XKFWGNMHDKFYHO-UHFFFAOYSA-N	427.527	1.831	50	20	IDGD	
O=C(NNC(=O)[C@H]1OCC[C@H]1c1ccccc1)C(=O)Nc1cncc(Br)c1	789812288	KFAMQIQADSSXIB-GJZGRUSLSA-N	433.262	1.503	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)[C@H]1CC(=O)N(c2ccccc2Br)C1	790062938	DEWIYLPEBVYEAN-LBPRGKRZSA-N	442.310	1.739	50	20	IDGD	
COC(=O)c1cc(OC)c(OC)cc1NC(=O)C(=O)NNc1cccc(F)c1[N+](=O)[O-]	790993604	HSFMVYQGZWJAPN-UHFFFAOYSA-N	436.352	1.620	50	20	IDGD	
COc1ccc(F)c2[nH]c(C(=O)NNC(=O)c3ccc(Cl)c(S(N)(=O)=O)c3)cc12	792808625	JGAVPRXYYSOQSZ-UHFFFAOYSA-N	440.840	1.691	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1ccc2c(c1)N(CC(F)F)C(=O)CS2	793030150	DAMAYVNAERBVPV-UHFFFAOYSA-N	438.416	1.271	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C2CCN(c3oc(C)nc3C#N)CC2)n[nH]1	793749945	OMFVTBLMNDILDO-UHFFFAOYSA-N	449.471	1.931	50	20	IDGD	
Cc1cc(Cn2nnc(C(=O)NNC(=O)c3cc(F)ccc3Br)c2C)on1	794287930	AIJRZNCFLMBKGV-UHFFFAOYSA-N	437.229	1.908	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccc(F)c(N2CCOC2=O)c1	796989561	HJQHLLKYUGLLBZ-LLVKDONJSA-N	448.382	1.475	50	20	IDGD	
NC(=O)c1cc(Br)cc(S(=O)(=O)NNC(=O)CCCc2ccccc2)c1	799529021	ANYJLGCGWBIFGJ-UHFFFAOYSA-N	440.319	1.880	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)N[C@H](Cn1ccccc1=O)c1ccccc1	800762108	BIOZNBLJFZGICK-GOSISDBHSA-N	444.451	1.883	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2cc3c(cc2Cl)CCC3=O)c1	800833064	IRSGJLHQOREFIV-UHFFFAOYSA-N	442.902	1.496	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CN2CCN([C@@H]3CCN(C(=O)OC(C)(C)C)C3)CC2)c1	808772314	FVPNIYXZMYPMDH-LJQANCHMSA-N	445.564	1.383	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)C(=O)Nc1ccc(-c2ccccn2)cc1	810385993	IHLMGSMUFAHCED-UHFFFAOYSA-N	435.396	1.822	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)CNS(=O)(=O)c1c(F)cccc1F	811462704	WJFVMRUOFGGZLJ-JTQLQIEISA-N	447.847	1.511	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N2C[C@H](C)S(=O)(=O)[C@@H](C)C2)cc1Br	811878768	NVVAPHICCOTREX-UWVGGRQHSA-N	434.312	1.320	50	20	IDGD	
CCOCc1nc([C@H](C)NC(=O)NNc2ccc(S(=O)(=O)N(CC)CC)cn2)no1	812564114	NCLOSXQAPCTMHV-LBPRGKRZSA-N	441.514	1.419	50	20	IDGD	
CSCCc1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)cc1	813033954	SOPVSRZIUNHTKA-UHFFFAOYSA-N	436.559	1.924	50	20	IDGD	
O=C(NNC(=O)c1ccccc1Br)C(=O)Nc1cn(Cc2ccccc2)nn1	815563489	DRAXQJCRRNXRGX-UHFFFAOYSA-N	443.261	1.489	50	20	IDGD	
N#Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccncc3)nc3ccccc23)nc1	815563992	UOLWMYAQLBHEPK-UHFFFAOYSA-N	437.419	1.963	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(C(=O)CCC(=O)NCC(Cl)Cl)CC2)cc1	816605750	KGBPLKROKWKIRZ-UHFFFAOYSA-N	436.361	1.528	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)CCNS(=O)(=O)c2ccccc2Cl)cc1	825549753	STZBKUJSRGLNOW-UHFFFAOYSA-N	440.909	1.277	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)c2cnc3c(c2)c(O)nc(=O)n3C)c1	879375131	PCKSHHALHVOGIQ-UHFFFAOYSA-N	425.445	1.306	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)c1cnc2c(c1)c(O)nc(=O)n2C1CC1	892277154	OLQUUEVFDZDOIL-UHFFFAOYSA-N	447.455	1.205	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2ccc(CS(=O)(=O)c3ccccc3)o2)C[C@H](C)O1	912918857	FNCLLVBFFDXYHN-HOTGVXAUSA-N	449.529	1.514	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(Cl)cc2)c(C)c1	913164911	ZNRNCUBTEUKUEL-UHFFFAOYSA-N	438.937	1.837	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)CNC(=O)c2cccc([N+](=O)[O-])c2)c1	913419312	AMSSIJCKZXJQDJ-UHFFFAOYSA-N	428.445	1.983	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Cn2cc(Br)ccc2=O)ccc1OC(C)C	914865153	VWUJSBMRAAAIHU-UHFFFAOYSA-N	438.278	1.868	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)NC[C@H](c1cccs1)N1CCOCC1	915893358	IPLQPIYSGTUBEU-OAHLLOKOSA-N	449.489	1.439	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)NCCN2CCN(Cc3ccccc3)CC2)c2ccccc21	915901025	CHMJDHIULYRUDC-UHFFFAOYSA-N	434.544	1.940	50	20	IDGD	
CC(=NNC(=O)CNc1ccc(C)cc1)c1ccc(S(=O)(=O)NCCC(=O)O)cc1	915922151	ZHALHCLTEFISGG-UHFFFAOYSA-N	432.502	1.700	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)NCCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])n1	915931745	GHNZCJAKDDNEMX-UHFFFAOYSA-N	443.386	1.869	50	20	IDGD	
Cc1nc2ccccn2c1C=NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	916259189	YSMPWRCYBYFKEQ-UHFFFAOYSA-N	427.486	1.428	50	20	IDGD	
C[C@H]1CCCCN1[C@@H](C)CNC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	916446913	DGQBXASUKSZGQP-PMACEKPBSA-N	430.597	1.792	50	20	IDGD	
CC(=NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)c1ccc(N)cc1	916542096	SQSMPMQMJBMRIA-UHFFFAOYSA-N	430.530	1.763	50	20	IDGD	
N#Cc1ccc(S(=O)(=O)NNC(=O)c2ccc3c(c2)OCCO3)c(C(F)(F)F)c1	917731871	OCUXKJZZFQZFLE-UHFFFAOYSA-N	427.360	1.972	50	20	IDGD	
C[C@H](Nc1ccc(C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)cc1[N+](=O)[O-])c1ccccn1	919693762	BXCKMXRMMYZKRN-GXTWGEPZSA-N	447.473	1.359	50	20	IDGD	
Cc1ccc(Oc2ccc(OCC(=O)NNC(=O)N[C@@H]3CCS(=O)(=O)C3)cc2)cc1	919889850	VNFHKJNVTZFTCX-OAHLLOKOSA-N	433.486	1.684	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCC(=O)N2CCCc3ccccc32)c2ccccc2c1=O	920045745	WQCHNNDWWAIHFJ-UHFFFAOYSA-N	448.483	1.340	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@@H](C)COc2ccccc2F)c2ccccc2c1=O	1319914231	CGAFKFCGPQMPKX-ZDUSSCGKSA-N	427.436	1.967	50	20	IDGD	
Cn1c(C(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)cc(Br)c1C=O	1328575826	LONHKJIKQGVOML-UHFFFAOYSA-N	442.653	1.872	50	20	IDGD	
Cc1ccn2c(=O)c(C(=O)N3CC[C@@]4(C3)CN(C(=O)C(C)(C)CCl)CCO4)cnc2c1	1777993852	DDLJBDBKOCOBGH-JOCHJYFZSA-N	446.935	1.711	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)Cc3ccc(NC(C)=O)cc3)C2)C1	1778257244	TWAWTOXUFVXEAG-NQIIRXRSSA-N	437.924	1.271	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C2(F)CCCCC2)C1	1778820242	OJXRUSUSNGTMRO-DYESRHJHSA-N	440.560	1.546	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc3cncn3c2)C1	1779140075	PAKNHVNILLGPBC-WAOWUJCRSA-N	434.924	1.716	50	20	IDGD	
CCOC(=O)O[C@@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)Br)C1	1782002598	RTXSCXGQHIACBU-UYAYXHRUSA-N	449.342	1.845	50	20	IDGD	
CCCNC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](Cl)COC)C1	1782172323	SXJWBUUVHGTQCP-RZQQEMMASA-N	431.961	1.061	50	20	IDGD	
O=C(c1cc2ccoc2cn1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1782191168	RSIAXXSOSHSFIG-RHSMWYFYSA-N	426.242	1.962	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H]3CC=CC[C@H]3C(=O)OC)C2)C1	1783847526	BVPLIMIZMYNEHO-DLRJPAPCSA-N	426.941	1.979	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cccc(SC)c3O)CCO2)C1	1783883180	VTZKYJHAQBXUQO-KUHUBIRLSA-N	428.938	1.811	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](C)S)C2)C1	1783899865	WUCYCXJNTZEQPD-HXPMCKFVSA-N	437.474	1.282	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C3=NO[C@@H](c4ccccc4)C3)C[C@@H]21)[C@H](O)CCl	1784092204	JLYSDFNZEVOMSM-OBQKDBCYSA-N	435.908	1.083	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CC[C@@H](C(=O)OC)C3)C[C@@H]21	1784615592	SMDZQPYZXCNJAQ-COZGXFGHSA-N	428.957	1.963	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc4c[nH]nc34)[C@H]2C1	1787325041	GKYPEGOCKBLUNO-XTBFLFJDSA-N	435.322	1.940	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(OC)nn3C)C[C@@H]21	1790961886	VVRMOPOGCIKGKO-XPCVCDNBSA-N	443.342	1.196	50	20	IDGD	
Cc1ncc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)Br)C[C@@H]32)s1	1791590505	ADQJQLZHAZZUMS-LVGORTOPSA-N	430.368	1.757	50	20	IDGD	
CC(=O)O[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)CBr)C(C)C	1792870286	BFECNWZPQUDHAG-HVQZGBDUSA-N	433.343	1.195	50	20	IDGD	
CC1=NN(c2ccc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)[C@@H](O)CCl)cc2)C(=O)C1	1793115510	PWEWZXRXDXYEDW-RANZSIQMSA-N	432.908	1.651	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccc(OC)cc1Cl	1793868237	PESVFOBWCDCBFA-QOIYZWAUSA-N	445.343	1.735	50	20	IDGD	
Cc1cccc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Br)C3)n1	1793911898	OCGZKEWDEBGYQZ-RMHZUWNSSA-N	428.302	1.603	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CNc1ccc(F)cc1	1795540672	CUVMMAUIGUAYCN-ZUMXRPEOSA-N	442.329	1.858	50	20	IDGD	
Cc1nnc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)CBr)C3)s1	1795819240	DZXJASJKTZTBKM-BTABJRDXSA-N	431.356	1.010	50	20	IDGD	
CN1CCN(c2ccc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@H](F)Cl)cc2)CC1	1796361172	KLNDVWPOIBQLPA-NBMJBFSESA-N	438.931	1.176	50	20	IDGD	
CC(C)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2c(c1)NC(=O)CO2	1797449160	IGSGRRJQTMXVBH-ZSBFGKGUSA-N	435.908	1.486	50	20	IDGD	
Cc1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)nc2ccccc12	1797512750	YCZGOGFSJYTZHN-ACDBMABISA-N	443.312	1.789	50	20	IDGD	
Cn1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Br)C3)c2cccnc21	1797577889	JTLVNHCRYNOVJL-JLUCKKNBSA-N	439.285	1.467	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](O)[C@H](C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](F)Cl)C3)C1	1797684043	MLWREEXVTNFBEH-UKRFAEJPSA-N	447.935	1.777	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc2c1NC(=O)C2=O	1798209564	UICBTDHZTSAQDX-WISYIIOYSA-N	434.290	1.857	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc3occc3c1)C2	1798440615	TUGJYCWRTRCUSA-BJWYYQGGSA-N	433.468	1.997	50	20	IDGD	
CN(C)c1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@](C)(Cl)CCl)cn1	1799276222	BEUWTIXIFPBIBM-MVWRLGRASA-N	429.348	1.587	50	20	IDGD	
C[C@@H](Oc1ccccn1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Br	1799351911	GBDCAFPMHGMYIC-GGUBGCTKSA-N	430.274	1.129	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1c(C)n[nH]c1C	1799417180	LMCGJPFXMYJPCJ-YXPYIKCWSA-N	427.343	1.332	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2c(c1)C(=O)CC2	1799960572	QLVRRFRLGFTQOF-MKXCTONWSA-N	435.318	1.802	50	20	IDGD	
Cc1ccc(=O)n(C(C)(C)C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](F)Br)n1	1800158288	IENRUDJCPRATSA-QVHKTLOISA-N	443.317	1.616	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/c1cc(F)c(F)c(F)c1)C2	1800982162	XWCXQEIOOKABJZ-CNIQGABISA-N	446.853	1.961	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CC1Cc3ccccc3C1)C2	1802343497	FDLJGJCFMVFCOQ-WKCHPHFGSA-N	426.561	1.803	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2n[nH]c3c2CCCC3)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803138816	FNROWEOPQRDKJI-UCLAIMLFSA-N	431.924	1.603	50	20	IDGD	
C[C@H](Cc1ccccn1)C(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]1c1cccnc1	1803146256	MMFQHLVMDMJUNK-WSTLGDPDSA-N	430.936	1.961	50	20	IDGD	
O=C(CCC(=O)N1CCCC1)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1	1804144680	BGZAOWHRUZNPKW-ABSDTBQOSA-N	436.940	1.090	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC2(CCCN(C(=O)c3cccnc3Cl)C2)CC1	1804656883	LXUXILGYSYDQEJ-UHFFFAOYSA-N	441.724	1.573	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H]1C(=O)N1CCC2(CCCN(C(=O)[C@H](O)CCl)C2)CC1	1805518011	NJAJUYDZYIXSRI-JKSUJKDBSA-N	443.972	1.827	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC2(CCCN(C(=O)c3coc(Cl)n3)C2)CC1	1807625554	MDTIYRXVEANPEC-UHFFFAOYSA-N	431.685	1.166	50	20	IDGD	
Cc1ccncc1C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1808784673	NHLVKSBKEAQKEJ-SIKLNZKXSA-N	444.300	1.098	50	20	IDGD	
O=C(c1ccc(F)nc1)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1	1809971313	RCBUXPTYZLULIO-UHFFFAOYSA-N	425.269	1.059	50	20	IDGD	
Cc1cccc(/C=C/C(=O)N2CCC3(CCCN(C(=O)c4cccc(B(O)O)c4)C3)CC2)n1	1809978226	XTPFHQGLHBKRTM-MDZDMXLPSA-N	447.344	1.628	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)Br)[C@H]1c1cccnc1	1810533380	OOOGBMVMIPJRKR-LGWLGOQQSA-N	437.338	1.562	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2c(O)cc(O)cc2O)[C@@H]1c1cccnc1	1811433536	MKTMZAJRKLAPOA-WTANOLMUSA-N	449.891	1.772	50	20	IDGD	
Cn1nc2c(c1C(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)CCC2	1812223306	SZXFYNSBTLBSOZ-QGTPRVQTSA-N	431.924	1.223	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)COC(C)C)n[nH]1	1814549853	PHVXFKHRCWEDHR-PTZPRWATSA-N	443.508	1.961	50	20	IDGD	
CC(C)(CCl)C(=O)N[C@H]1CCc2nc(NC(=O)c3cc(=O)n4[nH]cnc4n3)sc2C1	1815324480	WZGSVFGIPMOILA-VIFPVBQESA-N	449.924	1.365	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)C1CC3(CCC3)C1)CC2)c1ccc(B(O)O)cc1	1815347905	WWAUTDIGGXKGTH-MRXNPFEDSA-N	439.346	1.629	50	20	IDGD	
Cc1cccc(CC(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)c1	1817473470	VOMNDPIQWYDNDC-NRFANRHFSA-N	446.316	1.947	50	20	IDGD	
CCc1ccnc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)c1	1817768979	YJCVOEKRBRRVJZ-FQEVSTJZSA-N	447.304	1.667	50	20	IDGD	
Cn1cc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@H](O)CCl)CC3)c(C(F)F)n1	1817823841	RNZQNLJFDAWYAD-OIBJUYFYSA-N	433.868	1.640	50	20	IDGD	
CNC(=S)NCCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCBr)CC2	1819804867	OXSMPPVEWBHSRE-SECBINFHSA-N	448.412	1.324	50	20	IDGD	
COC(=O)CSCC(=O)N[C@H]1CCc2nc(NC(=O)CO[Si](C)(C)C)sc2C1	1820159970	CQIXXCBZIGBENZ-NSHDSACASA-N	445.639	1.813	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H]3C[C@H]3F)sc2C1	1822667768	XTPDNAMCJGTFIE-RZLFWIPMSA-N	432.481	1.547	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)Cn1ccncc1=O)CC2	1822869278	HXAWXOBHHBTCIF-BTDLBPIBSA-N	444.344	1.548	50	20	IDGD	
O=C(c1cccn2c(O)nnc12)N1CCC([C@@H]2CCCCN2C(=O)[C@H](O)CCl)CC1	1824183326	UMRHICSNBVWPHU-JKSUJKDBSA-N	435.912	1.268	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)cnc1C	1825391221	PZXGTGDVRRTDOV-QHCPKHFHSA-N	449.360	1.925	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccncc2)CC1	1825830724	VJBHZGOHEBJFLV-HXUWFJFHSA-N	436.516	1.627	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](NC(C)=O)C(C)(C)C)CC2	1825993809	FPOFPCSHZNINAC-SLEUVZQESA-N	444.985	1.860	50	20	IDGD	
COCc1oncc1C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](Cl)COC)sc2C1	1825999159	RQXFJVQCRVCTKX-KOLCDFICSA-N	428.898	1.757	50	20	IDGD	
CO[C@H](C)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1)CC2	1826155410	ZLXUOQVYKWMILT-HXPORVOZSA-N	432.506	1.224	50	20	IDGD	
O=C(CCc1ccoc1)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(B(O)O)cc1)CC2	1827106549	MJBUTVJJNPACNQ-INIZCTEOSA-N	439.302	1.275	50	20	IDGD	
CC[C@@H](NC(N)=O)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CO[Si](C)(C)C)CC1	1827561935	JZEZQKZJHISSNO-IAGOWNOFSA-N	426.634	1.905	50	20	IDGD	
CC(=O)OC[C@H](OC(C)=O)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@H](F)Cl)CC1	1827609613	VTLPSJHCYHYONZ-IKGGRYGDSA-N	434.892	1.635	50	20	IDGD	
CCOC(=O)N[C@@H](O)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CCBr)CC1	1828758109	DXKHIMKMXRKUNG-HOCLYGCPSA-N	448.358	1.456	50	20	IDGD	
CC(=O)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Cl)CCN2C(=O)OCc1ccccc1	1829053033	WKCYJTOZEHBCRK-JXFKEZNVSA-N	439.871	1.562	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CN2C(=O)C=CC2=O)CC1	1830321778	ROXILNPLCFAYQB-MGPUTAFESA-N	444.359	1.767	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc([N+](=O)[O-])[nH]3)C2)C1	1830364648	NHUXHAXUOVGAIT-SFHVURJKSA-N	428.873	1.258	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4nncn4c3)C2)C1	1831652309	YJYACENKIMVCGP-OXQOHEQNSA-N	435.912	1.207	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@](C)(O)C(F)(F)F)CCO2	1832148602	AGOIPYYYVPDRLB-HOTGVXAUSA-N	430.851	1.021	50	20	IDGD	
C[C@@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1)n1cccn1	1832237309	XYHSDYXZYGXTPO-UWJYYQICSA-N	438.337	1.057	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)C(=O)c3ccco3)CCO2)C1	1832667441	FFKDZRKUDLWTRF-SCLBCKFNSA-N	443.294	1.092	50	20	IDGD	
Cc1nc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)ccc1F	1833467352	WGFMFKZNFKGTEO-KPZWWZAWSA-N	444.301	1.383	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)CCBr)C3)C2)s1	1833954246	IQFPKGXNMNBNFW-KRWDZBQOSA-N	431.352	1.912	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCC(N2CCC(NC(=O)c3ncccn3)CC2)CC1	1834233186	BMIXEJLGDAJOOI-LJQANCHMSA-N	428.364	1.898	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)nc1	1834379424	XSIWHYIQHWLTQB-WMLDXEAASA-N	430.274	1.151	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)c3ccc(F)cc3F)C2)C1	1834824243	ZROXWOHJKKWZMM-SFHVURJKSA-N	447.276	1.820	50	20	IDGD	
O=C(Cc1ccc2ccccc2c1)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1	1834891264	XGLQABNVKSPHQR-OFNKIYASSA-N	446.931	1.438	50	20	IDGD	
O=C(C#Cc1ccccc1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1835101998	MNBCIZYBEXVEDS-MJGOQNOKSA-N	439.281	1.185	50	20	IDGD	
Cn1cc(C(=O)NC2CCN(C3CCN(C(=O)[C@H](O)CCl)CC3)CC2)c2cccnc21	1835637481	FWLBKMNPWVRYBA-LJQANCHMSA-N	447.967	1.358	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(CN(C(=O)CCc3cccnc3)CCO2)C1	1836180816	UTCDBAQYSZMNNY-OAQYLSRUSA-N	435.597	1.322	50	20	IDGD	
CC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)N3C[C@H]4C[C@H]4C3)CC2)CC1	1836397355	YCCOHKZSVMEMFZ-WWNBULGVSA-N	425.017	1.916	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccn3ccnc3c1)CCO2	1836986462	GOMQCIORXUYELG-NRFANRHFSA-N	446.580	1.256	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cccc(F)c3)C2)C1	1837712428	QDJVGKOVSLOIIQ-NRFANRHFSA-N	438.572	1.676	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)CCSC(=N)N)CC2)CC1	1837865028	KGBZNGMLDYFYNW-OAHLLOKOSA-N	434.990	1.256	50	20	IDGD	
C[C@H]1C[C@@]1(C)C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1	1837920237	SHFPMHDPVNGETI-QMHKHESXSA-N	428.338	1.025	50	20	IDGD	
CC(=O)NCCC(=O)N1CCC(OC2CCN(C(=O)[C@@H](C)Br)CC2)CC1	1838754796	FDEFDFCHBORRME-CYBMUJFWSA-N	432.359	1.295	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)C3CCSCC3)C2)C1	1839156259	JWNBBJJWYQUBMV-ROUUACIJSA-N	439.405	1.822	50	20	IDGD	
CC(C)C1(C(=O)N2CCOC[C@@]3(CN(C(=O)[C@@H](F)Br)CCO3)C2)CCC1	1839203660	RKKFWVZBKYJSEH-RHSMWYFYSA-N	435.334	1.960	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(C)n4ccnc4n3)CCO2)C1	1839546703	DQQZENSWUMUOCA-HRAATJIYSA-N	449.939	1.515	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1839966326	AUPWNVGPOHVNCG-IINYFYTJSA-N	432.142	1.420	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccccc3F)C2)C1	1840032389	XNWCYJFNGUOXRK-AUUYWEPGSA-N	443.313	1.608	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C13CCC(CC1)CC3)CCO2	1840543907	GAVJFSTUCNLIJN-HPAHXVRCSA-N	428.957	1.667	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)[C@H]2C[C@@H]2c2ccc(F)c(F)c2)C1	1841397393	LVEHXNAZZOKIPS-MSOLQXFVSA-N	440.255	1.265	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC2(CCCN2C(=O)c2cncc(S(C)(=O)=O)c2)C1	1842188214	RXNJOVBWBPUYHL-LBPRGKRZSA-N	444.351	1.333	50	20	IDGD	
CC#C[C@@H](CC(=O)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1)c1ccc(O)cc1	1843015222	UQECZZIGMOJUDL-IBGZPJMESA-N	446.312	1.086	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](O)[C@@H](C(=O)N2CC3(CCCN3C(=O)[C@H](F)Cl)C2)C1	1843363857	CTHUZSNORSEDGI-IHRRRGAJSA-N	433.908	1.342	50	20	IDGD	
COC(=O)CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)[C@@H](F)Cl)C2	1845146315	NEAQXCAWNWPWCN-GXTWGEPZSA-N	449.907	1.571	50	20	IDGD	
C[C@H](CC(N)=O)C(=O)N1CC2(CCCN2C(=O)[C@@H](Br)Cc2ccccc2)C1	1845940585	YJIPSOUVIGYFGU-ZBFHGGJFSA-N	436.350	1.708	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)C2CN(C(=O)OCc3ccccc3)C2)C1	1845948895	XZBFSQVUNWCMOO-SFHVURJKSA-N	449.935	1.712	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC12CN(C(=O)C(C)(C)n1nc(C)ccc1=O)C2	1846070912	LVUUWDRICAQLBC-AWEZNQCLSA-N	439.354	1.664	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC2(CCCN2C(=O)c2cncc(O)c2)C1	1846218569	VCIJUNUKQBBCNC-HNNXBMFYSA-N	438.912	1.736	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)c1cc(OC)c(O)cc1[N+](=O)[O-])C2	1846362950	GPVCTIGHLGRNEW-LBPRGKRZSA-N	427.841	1.380	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@H]1CCC(=O)N1C(=O)OC(C)(C)C)C2	1846365261	JKODSQJRJZDBOZ-UONOGXRCSA-N	443.928	1.370	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)COc1cccc(Cl)c1	1847414310	CESJNMHELJYFOQ-ROUUACIJSA-N	443.891	1.233	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)CN1C(=O)c2ccc(Br)cc2C1=O	24302936	GVJFCQNUJJOPRC-UHFFFAOYSA-N	434.221	1.574	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)Cn2cccc(C(F)(F)F)c2=O)c2ccccc2c1=O	105687509	KWDRNGGELFBNNC-UHFFFAOYSA-N	449.389	1.619	50	20	IDGD	
COc1cc(NC(=O)[C@@H]2C[C@H]2C)c(C(=O)NNC(=O)CNC(=O)c2ccco2)cc1OC	725740240	CWMWZVJEXIVBDJ-VXGBXAGGSA-N	444.444	1.082	50	20	IDGD	
CC(=O)N/C(=C/c1ccccc1)C(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12	726086712	NFDCHWYKJVQXRQ-CPNJWEJPSA-N	433.468	1.916	50	20	IDGD	
C[C@]1(c2ccc(CNC(=O)NNC(=O)c3cc4c(s3)CCC4)cc2)NC(=O)NC1=O	726282183	KHQITHDFTOTHCE-HXUWFJFHSA-N	427.486	1.436	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)c1ccccc1	727115990	NFEGWQADWBCRRL-QGZVFWFLSA-N	437.460	1.689	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)NCCC(=O)NNc2nc(-c3ccncc3)no2)cc1	728072329	BYPXPURDNDCRLF-UHFFFAOYSA-N	430.446	1.146	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	728214513	QJPHDGJCTRCGRK-HNNXBMFYSA-N	436.509	1.672	50	20	IDGD	
COc1ccc2c(ccn2CC(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1	728328089	GDVZSTFZYNKSAN-LJQANCHMSA-N	439.424	1.181	50	20	IDGD	
CCNC(=O)COc1cccc(CNC(=O)NNC(=O)c2cccc(OC(F)F)c2)c1	728595596	NMPNIKKDLWFRQD-UHFFFAOYSA-N	436.415	1.947	50	20	IDGD	
O=C(CNC(=O)c1ccc(Br)o1)NNC(=O)c1cccc(OC(F)F)c1	728609712	QBZTZIOMTPGVCX-UHFFFAOYSA-N	432.177	1.835	50	20	IDGD	
Cc1nc2cc(O)nn2c(C)c1CC(=O)NNC(=O)c1cc(F)ccc1Br	729533688	QCQKZZOUNPPXJL-UHFFFAOYSA-N	436.241	1.957	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)c2ccc(S(=O)(=O)NC(C)(C)C)o2)cn1	729692150	LYGALUIGDSXVMW-UHFFFAOYSA-N	427.508	1.391	50	20	IDGD	
N#Cc1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)cc1Cl	730077155	LSLYGPKTJNQKPH-UHFFFAOYSA-N	433.877	1.734	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)NCCCN2CCN(c3cccc(Cl)c3)CC2)n1	730673380	RVZLMQBOSRTGCT-UHFFFAOYSA-N	447.971	1.696	50	20	IDGD	
CCCCn1c(C)cc(/C=C(\C#N)C(=O)N[C@@H](C)C(=O)N2CCS(=O)(=O)CC2)c1C	731476642	GXMVOZRUBBAGKM-HUCUOGIVSA-N	434.562	1.574	50	20	IDGD	
C[C@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)N1CCc2ccccc2C1	731864099	OEWXTKDBZVSOTP-OAHLLOKOSA-N	430.530	1.145	50	20	IDGD	
O=C(NN=C1CCCS(=O)(=O)C1)c1ccccc1NS(=O)(=O)c1cccs1	731923227	AEYUPIFRAKAQOL-UHFFFAOYSA-N	427.529	1.843	50	20	IDGD	
N#C/C(=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)NNC(=O)C1CCC1	732142689	IIXNORXTZAGCFE-GDNBJRDFSA-N	440.891	1.933	50	20	IDGD	
N#C/C(=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)NNC(=O)C1CCC1	732142690	IIXNORXTZAGCFE-XNTDXEJSSA-N	440.891	1.933	50	20	IDGD	
C=CCn1c(S)nc2cc(C(=O)NNC(=O)CCN3C[C@@H](C)O[C@H](C)C3)ccc2c1=O	732261128	KLXXQCIBHYXKPP-ZIAGYGMSSA-N	445.545	1.132	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N[C@H](Cc2ccccc2)CN2CCOCC2)cc1OC	732476797	WWLVICFVRXGTHR-LJQANCHMSA-N	442.516	1.591	50	20	IDGD	
C[C@]1(NNC(=O)N[C@@H]2CCN(Cc3ccc(C(F)(F)F)cc3)C2)CCS(=O)(=O)C1	734071417	JTXFVEUNKJGEDS-WBVHZDCISA-N	434.484	1.661	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)N[C@H]2CCN(C(C)C)C2=O)c2ccccc2c1=O	734218030	HFKKPOBTUTYJOQ-KRWDZBQOSA-N	442.520	1.540	50	20	IDGD	
CC(=O)NCC(=O)N1CCc2cc(C(=O)NNC(=S)Nc3cccc(C)c3C)ccc21	735688059	PNUAFCTVAGLHIJ-UHFFFAOYSA-N	439.541	1.960	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)c2ccc(N3CCCS3(=O)=O)cc2Cl)cc1	736066470	JRHPTIVPHWHJHV-UHFFFAOYSA-N	448.888	1.592	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)CCSc2ccc3c(c2)OCCO3)c2ccccc2c1=O	737765281	DMAYKEAGAVDOPA-UHFFFAOYSA-N	440.481	1.648	50	20	IDGD	
O=C(NNc1ncnc2[nH]cnc12)C1CCN(c2ccc3nnc(C(F)(F)F)n3n2)CC1	740746616	VNAVMZXIFGGKTA-UHFFFAOYSA-N	447.385	1.169	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)c1ccc(S(=O)(=O)CC(=O)N(C)C)cc1)c1ccccc1	741930226	OKXFYSLAXIILCD-GOSISDBHSA-N	431.514	1.503	50	20	IDGD	
CCCOc1ccc(C(=O)NNS(=O)(=O)c2csc(C(=O)OC)c2)cc1OC	743250759	IWKRANGFNNEEPP-UHFFFAOYSA-N	428.488	1.955	50	20	IDGD	
Cc1ccc(OC[C@@H](C)NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1	743350908	HFLWASPBGQUHGW-QGZVFWFLSA-N	448.545	1.722	50	20	IDGD	
CSC[C@H](C(=O)NNC(=O)Nc1ccc(N(C)C)cc1)N1C(=O)[C@H]2CCCC[C@H]2C1=O	743826391	BVMDGZSFAWNKHV-IXDOHACOSA-N	447.561	1.812	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)c2cc(S(N)(=O)=O)c(Br)s2)cc1	744463400	BJARDRFLSZAELM-UHFFFAOYSA-N	432.321	1.795	50	20	IDGD	
C[C@@H](CC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)C(=O)c1cccc(F)c1	746093167	DAFVJPFHBHCVCV-ZDUSSCGKSA-N	435.477	1.746	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)N[C@@H]2CCCN(CC(F)(F)F)C2=O)c1C	746339236	LVCRCSJVTLSVKF-UONOGXRCSA-N	430.427	1.954	50	20	IDGD	
COc1cc(S(=O)(=O)N2CCOCC2)cc(C(=O)NNc2ccccc2F)c1OC	748056313	RSFOWPUTMXRQSS-UHFFFAOYSA-N	439.465	1.621	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)[C@H]2CCCN2C(=O)c2ccc3c(c2)OCO3)c1	749562136	MRDBLQXRZBMPLZ-QGZVFWFLSA-N	439.468	1.863	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)[C@@H]2CCCN2C(=O)c2ccc3c(c2)OCO3)cc1	749719905	HCTNLRIDTTXNNI-KRWDZBQOSA-N	440.456	1.288	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)N[C@@H]1CCN(c2cccc(Cl)c2)C1=O	750669864	GBSHOMXEQDFNEA-MRXNPFEDSA-N	426.864	1.666	50	20	IDGD	
Cc1cc2nc(C)c(CCC(=O)NNC(=O)c3csc(N4CCOCC4)n3)c(C)n2n1	751230187	JEVSUVBPNHYTMH-UHFFFAOYSA-N	443.533	1.341	50	20	IDGD	
C[C@H](NC(=S)NNC(=O)c1ccc(Br)c(S(=O)(=O)N(C)C)c1)C1CC1	751617541	AYGMQQWYLLOAJU-VIFPVBQESA-N	449.396	1.607	50	20	IDGD	
O=C(NNC(=O)c1ccccc1F)Nc1ccc(N2CCOCC2)cc1N1CCOCC1	755456477	WVFLVLHEAQJCFM-UHFFFAOYSA-N	443.479	1.965	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)Nc1cc(N2CCCC2=O)ccc1Cl	755677377	AZYKCTJFJVMAIX-UHFFFAOYSA-N	440.851	1.909	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccc(=O)n(Cc3ccccc3)c2)c1	755960635	PJRCINUCUURBNQ-UHFFFAOYSA-N	440.481	1.767	50	20	IDGD	
COc1ccccc1Oc1ccc(NC(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)cc1F	756211421	JHKIZQWWIMMHCU-LLVKDONJSA-N	440.453	1.717	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1ccc(N2CCc3sccc3C2)cc1	756277158	PUOWXNHDFSIWPV-LBPRGKRZSA-N	437.547	1.401	50	20	IDGD	
CS(=O)(=O)CCOc1cccc(NC(=O)NNC(=O)c2ccc(O)c(Cl)c2)c1	756297018	FOZAGSHICIIDOV-UHFFFAOYSA-N	427.866	1.936	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)Nc2ccc(CN3C(=O)CSC3=O)cc2)c1	756301457	WBTAHHGHIPVSPY-UHFFFAOYSA-N	442.457	1.702	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)Nc2ccc(C)c(S(=O)(=O)NC(C)(C)C)c2)n1	756681062	FJIHCHLIFJQOMJ-UHFFFAOYSA-N	436.538	1.738	50	20	IDGD	
C[C@H](CS(=O)(=O)c1ccc(F)cc1)C(=O)OCC(=O)NNC(=O)c1cccs1	756710995	JUMBKCPANLMGBY-LLVKDONJSA-N	428.463	1.301	50	20	IDGD	
O=C(NC[C@H](O)c1cc2ccccc2s1)NNC(=O)C1CCN(c2ncccn2)CC1	757739114	XJFFIHYHFDPDIM-INIZCTEOSA-N	440.529	1.972	50	20	IDGD	
CCOC(=O)Cn1cccc(NC(=O)NNC(=O)c2ccc(OCC)c(OC)c2)c1=O	757762617	GDJAVFULQSVCQB-UHFFFAOYSA-N	432.433	1.285	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)Nc1ccn(-c2ccc(Cl)cc2Cl)n1	757893252	YRWWBFAWZKQXTQ-VIFPVBQESA-N	432.289	1.767	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)c2cc(Br)cc(S(C)(=O)=O)c2F)nc1	759737951	IPNBECYYBDQGCQ-UHFFFAOYSA-N	446.254	1.930	50	20	IDGD	
CN(C)c1ccc2c(c1)NC(=O)C2=NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	761745685	ZNJUGWOBVXEMMA-UHFFFAOYSA-N	441.513	1.623	50	20	IDGD	
O=C(NCCOc1ccc(C(F)(F)F)cn1)NNC(=O)c1cc([N+](=O)[O-])ccc1O	761778007	DNSFNMXCPGOURM-UHFFFAOYSA-N	429.311	1.737	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H]2CCC[C@H]3OCC[C@@H]23)c1	761789340	GJBLNFVETMHOEC-RCCFBDPRSA-N	438.550	1.619	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)c1cc([N+](=O)[O-])c2nsnc2c1	762817215	ZJSNCFDRZCKFLR-UHFFFAOYSA-N	425.386	1.566	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)[C@@H]2CCCN(S(=O)(=O)c3ccccc3)C2)n1	762908550	VTYIHQNTNRYNFS-MRXNPFEDSA-N	432.550	1.867	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2ccccc2C[S@@](C)=O)c2ccccc2c1=O	762915597	CYOPTKAIGRRADZ-SSEXGKCCSA-N	427.486	1.761	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(C(C)=NNC(=O)CNC(=O)c2cccnc2)cc1	763195953	POWIETQIZRLJRF-UHFFFAOYSA-N	431.518	1.382	50	20	IDGD	
COc1cccc(C(=O)NNS(=O)(=O)c2ccc(C(=O)N3CCCC3)c(F)c2)c1O	763423458	XEYJZMDIWIQWGM-UHFFFAOYSA-N	437.449	1.399	50	20	IDGD	
O=C(NNC(=O)c1ccccc1)C(=O)Nc1ccc(CC(=O)N2CCSCC2)cc1	763431855	UATOKMMBKGFKNT-UHFFFAOYSA-N	426.498	1.204	50	20	IDGD	
Cc1ccc(S(C)(=O)=O)cc1S(=O)(=O)NNC(=O)CCCNC(=O)OC(C)(C)C	763438704	DCRDZVIVBVBZCK-UHFFFAOYSA-N	449.551	1.013	50	20	IDGD	
C[C@@H]1CN(Cc2cccc(NC(=O)C(=O)NNC(=O)c3ccccc3F)c2)C[C@@H](C)O1	763556139	KZIQVFVQDAQFHQ-HUUCEWRRSA-N	428.464	1.835	50	20	IDGD	
CC(C)n1nnnc1-c1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2F)cc1F	763561952	PRUCRVOVRZTIRA-UHFFFAOYSA-N	429.387	1.599	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cc(Br)cnc2-n2cccn2)c(C)o1	763576146	GUPSXOTTYRMBNO-UHFFFAOYSA-N	447.249	1.639	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccnc(OCC(F)(F)C(F)F)c2)c(C)o1	763576310	KHGIIZCAUMGLSA-UHFFFAOYSA-N	432.330	1.970	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccc(C(C)(C)C)cc2)nn1CCC#N	763601247	WKJTYLWUYGZZMU-UHFFFAOYSA-N	426.477	1.568	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(OC[C@H]3CCCO3)cc2)c1	763619016	MGGSEFOCRKXIFK-LJQANCHMSA-N	427.457	1.718	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2c(C)nc3ccccn23)cc1C(=O)NC(C)C	763630257	WXMXTNQAPNSLRD-UHFFFAOYSA-N	436.472	1.489	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)N2CCc3c2cccc3C(F)(F)F)cc1	763662528	WXOAQZKTJBDFMC-UHFFFAOYSA-N	437.374	1.830	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2F)ccc1OC1CCOCC1	763680398	HBKNOQATLZPGKQ-UHFFFAOYSA-N	445.447	1.857	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccc(-c2nnco2)c1	763681803	NGVBGPNZUGZROD-UHFFFAOYSA-N	425.401	1.300	50	20	IDGD	
Cc1cc(C(=O)NC(C)C)ccc1NC(=O)C(=O)NNC(=O)COc1ccc(Cl)cc1	763684370	KGTPJMLWSCHJOW-UHFFFAOYSA-N	446.891	1.952	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)C(=O)Nc2cc(F)c(F)cc2F)c2ccccc2c1=O	763790486	KCEZNGIAKDGXIB-UHFFFAOYSA-N	447.373	1.794	50	20	IDGD	
COc1ncc(C)cc1NC(=O)C(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12	763790651	MFFHNXJQZNFGAN-UHFFFAOYSA-N	438.444	1.089	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)C[C@@H](OC)C3)cc1	763859796	FWQUFAMEQQSDGF-VLIAUNLRSA-N	441.484	1.752	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1cccnc1N1CCCCC1	763867362	VFVGRRWVGJKGLU-CQSZACIVSA-N	429.452	1.764	50	20	IDGD	
C#CCOc1cc(F)ccc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccc(C(C)=O)cc1	763870721	BUAARHVYDACFEE-CQSZACIVSA-N	441.415	1.594	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@H](C)C(=O)NNC(=O)C(=O)Nc1c(C)ccn(C)c1=O	763877498	KYNYCMBTTOUGSX-CYBMUJFWSA-N	434.880	1.517	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2nn(C(C)(C)C)cc2C#N)cc1	763879607	ZQASFHYUUMWVRG-ZDUSSCGKSA-N	440.460	1.266	50	20	IDGD	
O=C(CCSc1ccc(F)cc1)NNC(=O)C(=O)Nc1cccc(C(=O)NC2CC2)c1	763904342	YUCPBVDZQYQYRA-UHFFFAOYSA-N	444.488	1.986	50	20	IDGD	
O=C(Cc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1ccccc1CN1C(=O)CCC1=O	763941425	NILAFTMMZNQFON-UHFFFAOYSA-N	442.859	1.318	50	20	IDGD	
O=C(NNC(=O)c1ccc(COc2ccccc2)o1)C(=O)Nc1cnc2c(c1)COCC2	763955041	HBHUMZMDZSASAY-UHFFFAOYSA-N	436.424	1.726	50	20	IDGD	
Cc1ccc(C(=O)N2C[C@@H](C)C[C@@H](C)C2)cc1NC(=O)C(=O)NNC(=O)c1cnccn1	764023692	CWTKCAYTYFFPKN-OKILXGFUSA-N	438.488	1.303	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)c2ccccc2OC)sc2c1CCC2	764049503	ZRFCKKGLDDSDAG-UHFFFAOYSA-N	431.470	1.822	50	20	IDGD	
CCn1nnnc1-c1cccc(NC(=O)C(=O)NNC(=O)c2cccc3ccccc23)c1	764052005	RDJHYHBIGHVNJK-UHFFFAOYSA-N	429.440	1.913	50	20	IDGD	
NC(=O)c1n[nH]c2ccc(NC(=O)C(=O)NNC(=O)Cc3ccc4ccccc4c3)cc12	764092508	WLWNXWHTACHYNJ-UHFFFAOYSA-N	430.424	1.144	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)C(=O)N2CCc3cc(Br)cc(F)c32)c1	764237566	JCXDYVMRMXNKST-UHFFFAOYSA-N	431.221	1.810	50	20	IDGD	
COC(=O)c1c(F)cccc1NC(=O)C(=O)NNC(=O)c1cccc(OC(F)F)c1	764251683	XGPKLKKFPFPHOB-UHFFFAOYSA-N	425.319	1.613	50	20	IDGD	
Cc1nc(C)n(-c2ccccc2NC(=O)C(=O)NNC(=O)c2cccc3ncccc23)n1	764253760	WBOHWQOSZIUNMC-UHFFFAOYSA-N	429.440	1.832	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)C(=O)Nc1ccc(C(F)(F)F)cc1	764261043	WNDIPGZLHAOGNH-UHFFFAOYSA-N	436.394	1.498	50	20	IDGD	
O=C(Cc1ccccn1)NNC(=O)C(=O)Nc1cccc(COCC(F)(F)C(F)F)c1	764267308	SFTNMICPHDRFSH-UHFFFAOYSA-N	442.369	1.827	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)N[C@@H]2CCCC[C@H]2N2CCOCC2)nc1	764377848	ZQJFYWDFRFXSJG-IAGOWNOFSA-N	440.570	1.038	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc4c(c3)N(C)CCO4)n[nH]2)cc1	764385375	ZRTDZOLXWVTPNA-UHFFFAOYSA-N	448.483	1.867	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)C(=O)Nc1ccc(C(=O)N2CCCC2)cc1	764402341	ZGWFELXOWDMBQF-UHFFFAOYSA-N	442.497	1.506	50	20	IDGD	
COc1cccc(O)c1C=NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1	764816553	KFJRKLLUUHKFFA-UHFFFAOYSA-N	446.529	1.166	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2ccc(C)c(S(=O)(=O)NCc3ccccc3)c2)n[nH]1	765586072	LBHOQWJJSAKIHW-UHFFFAOYSA-N	427.486	1.580	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)Cn2nc(-c3ccccc3)ccc2=O)n[nH]1	765601660	QZVUGKCHPLRTKP-UHFFFAOYSA-N	444.451	1.770	50	20	IDGD	
C[C@H](CCc1ccccc1F)C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765736803	AZHDIMVQPWMUGH-GOSISDBHSA-N	440.519	2.000	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3oc4c(c3C)C(=O)CCC4)CC2)cc1	766648171	IOENHZOFMFRWRF-UHFFFAOYSA-N	438.528	1.994	50	20	IDGD	
O=C(NN=Cc1ccn(-c2ccccc2)n1)C(=O)NN=Cc1ccn(-c2ccccc2)n1	766677963	IECPDAOTXWXQHP-UHFFFAOYSA-N	426.440	1.658	50	20	IDGD	
C[C@@H]1CN(S(=O)(=O)N2CCN(C(=O)[C@@H](Br)C(C)(C)C)CC2)C[C@@H](C)O1	767028360	CNPXUDPOIZGLFX-MGPQQGTHSA-N	440.404	1.294	50	20	IDGD	
C[C@H](CBr)COC(=O)[C@@H](C)NC(=O)c1ccc(S(=O)(=O)N(C)C)cc1	770337606	SPAZZUKNKLOOQB-VXGBXAGGSA-N	435.340	1.629	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)c1ccc(S[C@@H]2CCOC2=O)cc1	770644023	LJTLEMOOMCAZDX-OAHLLOKOSA-N	448.526	1.462	50	20	IDGD	
COC(=O)CCNC(=O)c1ccc(NC(=O)C(=O)NNc2c(F)cccc2Cl)cc1	770812337	OOSCQMQZQYOKJT-UHFFFAOYSA-N	436.827	1.854	50	20	IDGD	
COc1ccccc1[C@]1(C)NC(=O)N(CC(=O)NNC(=O)CCCc2ccccc2)C1=O	771255224	FSDGXOSPFGPOFI-QHCPKHFHSA-N	438.484	1.633	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1ccc(S(=O)(=O)Nc2nccs2)cc1	772183665	PTFNNXDKXHJHTK-SNVBAGLBSA-N	426.476	1.047	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)[C@@H](C(C)C)N2CCCS2(=O)=O)cc1OC	772630836	NSTWFWHTMAIFKL-GOSISDBHSA-N	441.550	1.695	50	20	IDGD	
O=C(NNC(=O)c1cccc(Br)c1)N[C@H]1CCCN(CC(F)(F)F)C1=O	773032586	TZFUVLRASDGTRS-NSHDSACASA-N	437.216	1.946	50	20	IDGD	
COC(=O)c1cc(N2CCOCC2)ccc1NC(=O)C(=O)NNc1ccccc1[N+](=O)[O-]	773656588	RJIUNSXZYWVTSC-UHFFFAOYSA-N	443.416	1.300	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cc(Cl)sc2S(N)(=O)=O)cc(OC)c1OC	773706283	ASRGJTXWGQHQPS-UHFFFAOYSA-N	449.894	1.150	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)N3CCOCC3)cc2)cc1F	773887395	AGQUFIXQDNLNLH-UHFFFAOYSA-N	428.420	1.006	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccccc1Cn1cncn1	774010655	YSEZZXAQVLZREL-ZDUSSCGKSA-N	442.863	1.533	50	20	IDGD	
O=C(NNC(=O)c1ccccc1)Nc1ccc(N2CCOCC2)cc1N1CCOCC1	775284144	ZTYDEYGPHMNSIU-UHFFFAOYSA-N	425.489	1.826	50	20	IDGD	
Cc1nc(Cl)cc(NNC(=O)CSCC(=O)NNc2cc(Cl)nc(C)n2)n1	775606796	DHZFQJUSWZQIHS-UHFFFAOYSA-N	431.309	1.510	50	20	IDGD	
Cc1c(C(=O)NNc2cccc(S(C)(=O)=O)c2)nnn1-c1ccc2c(c1)OCCO2	776526632	HIUACZYBWGCKDO-UHFFFAOYSA-N	429.458	1.507	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)c1cccc(CS(=O)(=O)c2ccccc2)c1	778437964	IHNNMIYOAJSLJJ-UHFFFAOYSA-N	447.513	1.946	50	20	IDGD	
CN1C(=O)C[C@H](C(=O)NNC(=O)CNC(=O)OC(C)(C)C)[C@H]1c1ccc(Cl)c(F)c1	778443481	UAMBHLYKTJCGMX-MEDUHNTESA-N	442.875	1.671	50	20	IDGD	
COc1ccc(Cn2nccc2NC(=O)NNC(=O)c2cnn(C)c2)c(OC)c1OC	779458608	FGWOOCGDJQSPGO-UHFFFAOYSA-N	429.437	1.157	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)nn1-c1cccc(C#N)c1	779915520	MMYVLOFUGIGYEN-UHFFFAOYSA-N	427.465	1.521	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2cn(-c3cccc(Cl)c3)nn2)c2ccccc2c1=O	780172439	ZUKMIPUUDCFEAZ-UHFFFAOYSA-N	437.847	1.725	50	20	IDGD	
COc1ccc(NNC(=O)c2ccc3c(c2)S(=O)(=O)N(C[C@@H]2CCCO2)C3=O)nc1	781525385	LJYMFQMWRSVZKC-AWEZNQCLSA-N	432.458	1.171	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)c2ccc(OC)c(-n3cnnn3)c2)n[nH]1	781711643	ZXAWZQXYJDHRQV-UHFFFAOYSA-N	434.416	1.144	50	20	IDGD	
O=C(NNC(=O)C(=O)NC1CC1)C(=O)Nc1cc(Cl)ccc1Sc1ccccc1	782968062	WSMWIQYJRAQSPU-UHFFFAOYSA-N	432.889	1.856	50	20	IDGD	
O=C(NNc1nccc2sccc12)C(=O)Nc1cccc(N2CCS(=O)(=O)CC2)c1	783435547	GQLFEODJHRWNMZ-UHFFFAOYSA-N	445.526	1.613	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)cc1Cl	784217006	SHOPMVGIDJBJDM-UHFFFAOYSA-N	438.893	1.871	50	20	IDGD	
Cc1c(NNC(=O)C(=O)Nc2ccc(N3CCCS3(=O)=O)cc2)cccc1[N+](=O)[O-]	784351224	MDQROAYIRSDYHW-UHFFFAOYSA-N	433.446	1.525	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)C(=O)Nc1ccc2c(c1)OC1(CCCC1)O2	785068164	VEIOKUXEZDDEKB-UHFFFAOYSA-N	435.440	1.704	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCC(=O)c2cccn21)c1ccc(S(=O)(=O)N2CCCC2)cc1	788721569	WEQKGHROKIGZEP-QGZVFWFLSA-N	430.486	1.251	50	20	IDGD	
COC(=O)COc1ccc(C=NNC(=O)C(=O)NCc2ccc(Cl)cc2)cc1[N+](=O)[O-]	788725386	JOQOPPRAAWFNQB-UHFFFAOYSA-N	448.819	1.567	50	20	IDGD	
CN(C)[C@@H]1CCOc2c(NC(=O)C(=O)NNC(=O)c3ccc(O)c(Cl)c3)cccc21	789735224	VDMXCTQDZCZKDU-OAHLLOKOSA-N	432.864	1.831	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cc([C@H]3CCCO3)nn2C)cc1	789741004	MHZOCXAISJAVNM-SUMWQHHRSA-N	443.460	1.028	50	20	IDGD	
Cc1cccc(-c2nnc(S)n2CCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1	790091965	UVHARXPKXZLEFZ-QGZVFWFLSA-N	439.497	1.920	50	20	IDGD	
O=C(NNc1nc2ccccn2n1)C(=O)Nc1cc(Cl)ccc1OC[C@H]1CCOC1	792395239	QOKKYMHPRMKBAY-LBPRGKRZSA-N	430.852	1.880	50	20	IDGD	
COc1ccc(Cn2cc(NC(=O)C(=O)NNC(=O)Cc3c[nH]c4ccccc34)cn2)cc1	793021896	NNXOQLLHKIDSHJ-UHFFFAOYSA-N	446.467	1.750	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)NCc2ccc(I)c(C)c2)n1	798477951	WIAGTIYIPKHSQG-UHFFFAOYSA-N	441.273	1.944	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N1CC[C@H](S(C)(=O)=O)C1	799859399	HBBTUNHQEDAFOK-MFKMUULPSA-N	434.312	1.076	50	20	IDGD	
CCOC(=O)COc1ccc(NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1	800561469	JUUWQLYCZMBMJR-UHFFFAOYSA-N	442.476	1.488	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cn(-c3ccccc3C(F)(F)F)nn2)cc1	801106559	YRBWUAOJHOJTBI-UHFFFAOYSA-N	432.362	1.994	50	20	IDGD	
COCCNS(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2cc(F)cc(F)c2)c1	802005562	NHIGEVGNPBKWDS-UHFFFAOYSA-N	428.417	1.356	50	20	IDGD	
CSCCNC(=S)NNC(=O)CN(C)c1cc(Br)ccc1[N+](=O)[O-]	802985924	QKQZDVFRLZWDTM-UHFFFAOYSA-N	436.357	1.652	50	20	IDGD	
N#Cc1ccc(N2CCC(C(=O)NNc3nccc(N4CCOCC4)n3)CC2)c(F)c1	807075527	BXHAXDBLFCDUCD-UHFFFAOYSA-N	425.468	1.684	50	20	IDGD	
CCCn1nc(C(=O)NNS(=O)(=O)c2ccc(Cl)nc2C)c2ccccc2c1=O	808068777	HHOHBRMDJYXTIH-UHFFFAOYSA-N	435.893	1.787	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)Nc2ccnnc2OC)c2ccccc2c1=O	808901866	DLBRYTYMJDOVBF-UHFFFAOYSA-N	425.449	1.852	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)OCC(=O)c2ccc(N(C)S(C)(=O)=O)cc2)cc(C#N)n1C	809302012	KBSGJLXEDPNMFZ-MFOYZWKCSA-N	440.481	1.934	50	20	IDGD	
O=C(NNC(=O)c1snnc1C1CC1)c1cccc(S(=O)(=O)N2CCCCC2)c1	809957594	PQKRHJWTJMAVDG-UHFFFAOYSA-N	435.531	1.665	50	20	IDGD	
O=C(COC(=O)[C@@H](O)c1ccc(Cl)cc1F)NNC(=O)c1cccc([N+](=O)[O-])c1	811370847	RVIBKXYLUJJADD-HNNXBMFYSA-N	425.756	1.425	50	20	IDGD	
COCCOCc1ccc(C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)cc1	812450383	GSNGDBCZDGYANV-UHFFFAOYSA-N	434.518	1.526	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)CCCC[C@@H]2SC[C@H]3NC(=O)N[C@@H]32)cc1	812730437	JFLOPJDSSUNYMA-VYDXJSESSA-N	441.579	1.106	50	20	IDGD	
COc1cc(C(=O)NNC(=O)N[C@H]2CC(=O)N(c3ccccc3F)C2)cc(OC)c1OC	812868129	SBFXBCVHLOAFNT-ZDUSSCGKSA-N	446.435	1.601	50	20	IDGD	
O=C1CN(Cc2cccc(NC(=O)C(=O)NNc3ccc(Cl)cc3[N+](=O)[O-])c2)CCN1	812983255	JMVWSKNKLLEFIG-UHFFFAOYSA-N	446.851	1.262	50	20	IDGD	
COCC(C)(C)CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	813840346	MEKLNJWEXNBXBV-UHFFFAOYSA-N	426.539	1.478	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(N(C)C)c(NC(=O)NNc2ncncc2F)c1	814499618	QPULEURNYGAHAZ-UHFFFAOYSA-N	425.490	1.861	50	20	IDGD	
CC(=NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1)c1cc2c(cc1[N+](=O)[O-])OCO2	814729964	HEUIETVMSDJYRT-UHFFFAOYSA-N	448.457	1.793	50	20	IDGD	
CCn1c(NNC(=O)c2cnn(C)c2I)nc2ccccc2c1=O	814889618	PJDFSYOCVNMXNZ-UHFFFAOYSA-N	438.229	1.511	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNc2cccc(S(C)(=O)=O)c2)cc1)[C@H]1C[C@@H]1C	815558623	JAUROJUWQVCORJ-DJJJIMSYSA-N	444.513	1.933	50	20	IDGD	
CN(C)c1cc(C#N)cc(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)c1	815734499	JNWFFGYVOGEQBN-UHFFFAOYSA-N	429.502	1.402	50	20	IDGD	
Cc1nnnn1[C@@H](Cc1ccccc1)C(=O)NNc1ccccc1S(=O)(=O)N(C)C	817051310	JTOZZVREINAQPA-KRWDZBQOSA-N	429.506	1.159	50	20	IDGD	
NS(=O)(=O)c1ccc(N2CCOCC2)c(C(=O)NNc2ccccc2C(F)(F)F)c1	849613020	QJIDEKNUNHKITG-UHFFFAOYSA-N	444.435	1.946	50	20	IDGD	
CCN1CCC[C@@H]1CNC(=S)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	884004211	MFOOECQCXNMVOM-MRXNPFEDSA-N	439.607	1.064	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)c3ccc[n+]([O-])c3)c2)cc1	913125761	WFAPTUZQFUJFND-UHFFFAOYSA-N	442.453	1.204	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)CNS(=O)(=O)c3c(F)cccc3F)cc2C1	913162529	VZYYJZRPQFLRRV-JTQLQIEISA-N	443.497	1.891	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1cc(C(=O)NNC(=O)COc2ccc(F)cc2)ccc1F	914602246	NASQYAQBKBKDBT-UHFFFAOYSA-N	441.456	1.882	50	20	IDGD	
Cn1ccnc1SCc1ccc(C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)o1	915076960	VTPMGVSLOJCZTF-UHFFFAOYSA-N	434.499	1.784	50	20	IDGD	
C[C@@H]1CCC[C@@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)[C@@H]1C	915890576	WUPAHFFWSCGKDK-IIDMSEBBSA-N	438.550	1.476	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCC(C)(C)N2CCCCC2)c1	915899784	SARGLYZKXNOGHT-UHFFFAOYSA-N	425.555	1.145	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)NC[C@H](c1ccc(C)o1)N1CCOCC1	916229670	UIYYUNMIRPGVCS-GOSISDBHSA-N	430.505	1.933	50	20	IDGD	
CNS(=O)(=O)c1ccc(CNC(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)s1	916232112	FUDDDDFUXPTFFL-SNVBAGLBSA-N	430.483	1.093	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NN=C(C)c1ccccn1)N(S(C)(=O)=O)CC2	916356337	SEDJSGZVRRNGON-SFHVURJKSA-N	446.529	1.888	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)NC[C@H](c2ccccc2)N2CCOCC2)cc1C	916511235	OSOKSEIFKXJHHB-HXUWFJFHSA-N	439.516	1.646	50	20	IDGD	
CCN(CCP(=O)(c1ccccc1)c1ccccc1)CC(=O)N[C@H]1CCS(=O)(=O)C1	917011131	OEZROMXYZKLBJT-IBGZPJMESA-N	448.525	1.626	50	20	IDGD	
COC(=O)c1ccc(C(=O)OC)c(S(=O)(=O)NNC(=O)c2ccc(Cl)cc2O)c1	917757879	FFOOSVNJWDXDEV-UHFFFAOYSA-N	442.833	1.242	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)NCc1ccc(N2CCC(CO)CC2)cc1	918230257	FKXXQERRZFJLIE-UHFFFAOYSA-N	436.516	1.996	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)Cn1cc(Br)cn1	919480856	NIZNZLHTLXVVOW-UHFFFAOYSA-N	445.657	1.312	50	20	IDGD	
O=C(CNC(=O)[C@H]1c2ccccc2C(=O)N1Cc1ccccc1)NNC(=O)c1ccccn1	920251491	QOMUIIAJNUPMQI-OAQYLSRUSA-N	443.463	1.356	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@@H](C)Cc3c(C)n[nH]c3C)CC2)cc1	1116292430	HYIOWYAPLKXRRN-KRWDZBQOSA-N	426.565	1.479	50	20	IDGD	
Cc1nn2cc(S(=O)(=O)NNC(=O)c3cncn3-c3ccccc3)cnc2c1Cl	1336597996	BKRAQQHMXWOZMV-UHFFFAOYSA-N	431.865	1.500	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)/C=N/O[C@@H]3CCCCO3)C2)C1	1779104616	FIUKYYSPFXZXPY-FFAFJEAKSA-N	436.336	1.582	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)ncn1)C2	1780707949	XOQUJSYIFISIIZ-JEBQAFNWSA-N	431.320	1.546	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](C)NC(=O)c1ccc(F)cc1)CCO2	1781218277	OMHUQYJPMYOSMT-LFRPXUGBSA-N	439.915	1.791	50	20	IDGD	
COc1ccc(CC(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)cc1F	1781335627	XXNHWNATFXISLP-AEFFLSMTSA-N	447.276	1.897	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)NC(C)=O)C1	1781789910	VMKDPXKMCFCQQV-KDQZPGIASA-N	432.359	1.198	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1snnc1C1CC1)C2	1782172538	GFRYVGQZVHVOSK-PJIJBLCYSA-N	442.969	1.797	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(C)nc1O)C2	1782173919	SZMOFAFLIGBHGP-RZQQEMMASA-N	425.913	1.477	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccn3nccc13)C2	1782178092	FKIMFHJFSCCEQB-YRISNDGFSA-N	434.924	1.716	50	20	IDGD	
C=CCCC(C)(C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCC(=O)NN(C)C)C1	1782210067	COCSSFHNJBDJAQ-WZONZLPQSA-N	436.597	1.866	50	20	IDGD	
C[C@H](N[C@H](C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2)C1CC1)c1ccccc1	1782887482	JMKXIDLTCSSZKD-VHTOSUDKSA-N	449.979	1.545	50	20	IDGD	
CCC[C@H](NC(C)=O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](Cl)COC)C2	1783191003	PPEFVPQKKHAPDT-AXVVYFOYSA-N	431.961	1.059	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](N)c1ccccn1)CCO2	1783343334	TVJQQURPGIUHHP-JCKWVBRZSA-N	425.327	1.085	50	20	IDGD	
COc1ccccc1OCC(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](C)Br)C2)C1	1783527536	CPOUPMMENMCLDP-LIRRHRJNSA-N	441.322	1.687	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)/C=C/c3ccc(OC)cc3F)C2)C1	1783660234	IIAQDOPJVAHGGV-NWWLCNQNSA-N	440.899	1.931	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ncccc3Br)CCO2)C1	1783877025	DKBQGNHMWLIREP-SUMWQHHRSA-N	446.729	1.541	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)c3ccco3)C[C@@H]21	1783964769	ZWSBBRRWOPBYER-YOPIWALVSA-N	429.311	1.324	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN3CCCCC3=O)C[C@@H]21	1783974271	JZFXFUKQVKWYBR-VGWMRTNUSA-N	444.370	1.010	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(CCN(C(=O)[C@H](O)c3ccccc3Cl)C2)C1	1784252554	IEHTZKHJCZGBIB-AEFFLSMTSA-N	445.741	1.988	50	20	IDGD	
COc1cccnc1CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CO[Si](C)(C)C)C[C@@H]21	1785243326	NJGBJPDPQBLVEQ-ZWOKBUDYSA-N	449.624	1.854	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cn4cc(F)ccc4n3)C[C@@H]21	1788764333	LODBXMPCWMKAPM-ZVZYQTTQSA-N	448.571	1.918	50	20	IDGD	
COc1ccc(C(=O)Nc2ccc(C3(NC(=O)c4cccc(B(O)O)c4)CCC3)cc2)nc1	1788860574	HNGYLMXHUCVDKO-UHFFFAOYSA-N	445.284	1.832	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21)[C@@H]1CC[C@H]2CCC(=O)N2C1	1789770624	ABIJFUUNPNDFFX-QTVXIADOSA-N	432.348	1.171	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4n(n3)CCCC4)C[C@@H]21)[C@@H](F)Br	1789926473	ZKTSGJZUHCHGBA-DLKVLKDVSA-N	443.317	1.503	50	20	IDGD	
CCOC(=O)C1(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](Br)CC)C[C@@H]32)CC1	1790720582	CLPKXVWULCPUCI-XQLPTFJDSA-N	445.354	1.483	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(=O)c3cccn3C)C[C@@H]21	1790964203	UHSYFNANMCPJTH-AYDFFVQHSA-N	440.338	1.361	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)COc3cccc(Cl)c3)C[C@@H]21	1791249660	OFIXLJUMWWPEPF-RUGDWHBFSA-N	445.343	1.952	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(NC(C)=O)o3)C[C@@H]21	1791255313	LEGXZJOMYBKCMD-YXWQFLTLSA-N	427.885	1.085	50	20	IDGD	
C[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]2C1	1791298383	MPXRIHKKESLBCC-VOAKCMCISA-N	438.352	1.683	50	20	IDGD	
N#Cc1cccc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Br)C3)c1	1792833599	GYMHANCCVJZHBO-CYGHRXIMSA-N	438.297	1.771	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1n[nH]c3c1CCCC3)C2	1792868270	SSTFLOMMQKHJSF-NFFDBFGFSA-N	439.354	1.523	50	20	IDGD	
CC(C)Oc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](O)CCl)c(F)c1	1792980051	KJVFBAPLDXWDCH-GGNLRSJOSA-N	428.888	1.416	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2)[C@@H]1CCc2ccccc2[C@H]1O	1793036559	KHBAFIYRGKOCFI-IMPMIVQMSA-N	427.328	1.676	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CCc2ccoc2C1	1793290747	UHJBWZUCCGTGLS-WCXIOVBPSA-N	437.500	1.335	50	20	IDGD	
Cc1ccc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)CBr)C3)nc1	1794087019	CFKUHYNDITWWPK-GGXPGOJBSA-N	438.366	1.943	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCc1ccc2c(c1)OCO2	1795321758	WGMFHCDDEAEAAP-UIVXKWKOSA-N	438.908	1.191	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H](O)C[C@H]1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](F)Cl	1796810727	ZCQAHFWUYKHBPA-QLKXBERHSA-N	433.908	1.529	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1n[nH]c2c1CC[C@@H]2C	1796973961	QTWQAWWRSBNGIT-VOZNZKSSSA-N	439.354	1.836	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2c(cnn2C)c1	1797085710	KRSSWPLKMIDRKJ-FIUQPQMISA-N	435.322	1.560	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Cl)C3)C1	1797220238	ZJMWLVFNNVWZHH-UXXRCYHCSA-N	433.908	1.367	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(C)nc2ccc(O)cc12	1797356672	WRFIZXQURAIWFH-VLBMKZOESA-N	447.919	1.706	50	20	IDGD	
COc1ccsc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)CBr)C2	1798333904	FBQXBUASRIWHDD-NRWUCQMLSA-N	431.352	1.991	50	20	IDGD	
Cc1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)c(F)c1	1798441758	IIKRAKBCKOURCU-QDMKHBRRSA-N	425.464	1.698	50	20	IDGD	
CC(C)c1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cccc(B(O)O)c2)C3)cc1	1798959545	MZNCTQJVYOOLJN-VTYHHJSWSA-N	436.317	1.007	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nccc3[nH]ccc13)C2)[C@@H](F)Br	1799346203	JABAAADOUIRZOF-YJKIEOBBSA-N	425.258	1.457	50	20	IDGD	
COc1ccc(F)c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)C(Cl)Cl)C3)c1OC	1799662371	BPVBWYUEMLZQHY-WDAIWFPHSA-N	435.279	1.850	50	20	IDGD	
COC(=O)c1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Cl)C3)c([N+](=O)[O-])c1	1799821183	JTHFPWRDYDEPKK-BAESOJJISA-N	443.815	1.119	50	20	IDGD	
C#CCCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN(C)NC(=O)NCc1ccccc1	1799869449	OXHNSNDJJHBQCQ-ACDBMABISA-N	425.533	1.384	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(Cl)c1OC	1801808456	YCHBQBTVEYGCMC-NOXHYTERSA-N	431.316	1.806	50	20	IDGD	
O=C(CCBr)NC[C@@H]1CCN(C(=O)CN2CCCC2=O)[C@H]1c1cccnc1	1806341204	ZVHVHBVCSMMUQR-KXBFYZLASA-N	437.338	1.495	50	20	IDGD	
CCOCC(=O)NC[C@H]1CCN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@H]1c1cccnc1	1806502787	SAULLFQZRDQXKA-QOZRKGCKSA-N	440.504	1.258	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)CCc2ccoc2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807363853	BVFCWGYICCPUDV-OFNKIYASSA-N	447.300	1.307	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@@H]1c1cccnc1)[C@@H](F)Cl	1808319008	KLQHOWXAOZWWOE-NILFDRSVSA-N	444.941	1.482	50	20	IDGD	
Cn1cccc1C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1	1810297345	BRLTWMSGSUKRNF-UZLBHIALSA-N	447.499	1.052	50	20	IDGD	
Cc1ccc(C(=O)NCC(=O)N2CCCC[C@H]2c2cc(NC(=O)[C@@H](O)CCl)n[nH]2)cc1	1814876177	QIPIYXNTJUVKQJ-IRXDYDNUSA-N	447.923	1.740	50	20	IDGD	
O=C(CC1CCCC1)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1	1815354745	CCRMWSYNHHKOIH-MRXNPFEDSA-N	427.335	1.629	50	20	IDGD	
CN[C@H](CC(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](F)Br)[nH]n1)C(=O)O	1817372305	PMNFNIMQTHLMOY-GIPNMCIBSA-N	434.266	1.155	50	20	IDGD	
Cc1cc(C(=O)NCC(=O)N2CCCC[C@@H]2c2cc(NC(=O)[C@H](F)Cl)n[nH]2)no1	1818039408	BDWYVMWYLQHFJW-DOMZBBRYSA-N	426.836	1.663	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](O)CCl)CC2)c1ccc2nccnc2c1	1818488430	RUHAJQUBUMZYFP-NHYWBVRUSA-N	431.905	1.912	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](F)Br)[nH]n1	1819354797	ZPERVZHGXRQJOW-CDMKHQONSA-N	447.309	1.800	50	20	IDGD	
Cc1ccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)c(O)n1	1820264102	FXTWQHUHFPJGPO-SFHVURJKSA-N	449.276	1.118	50	20	IDGD	
CC[C@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](COC(C)=O)OC(C)=O)[nH]n1	1820856534	PKUYPRAPQVMFMT-BPUTZDHNSA-N	442.900	1.914	50	20	IDGD	
CC[C@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](Cc2cnc[nH]2)NC(C)=O)[nH]n1	1820859955	IBAIVCAMFNHUKO-UAGQMJEPSA-N	449.943	1.890	50	20	IDGD	
O=C(N[C@@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1)c1ccc(O)nn1	1823001681	JBJWWQDLQUKSSO-KBUNVGBDSA-N	430.259	1.555	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@H]1CCc2nc(NC(=O)Cn3ccncc3=O)sc2C1	1824536945	YJEVHBAGKKZRHH-BTDLBPIBSA-N	444.344	1.548	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)COc3ccc(O)nn3)sc2C1	1824561470	SDODDDAGVCPVTG-UWVGGRQHSA-N	425.898	1.647	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)CCc2cn[nH]c2)CC1	1825187717	OSBTUPQMUZGFPG-IBGZPJMESA-N	432.569	1.335	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H]1CCNC(=O)C1)CC2	1825647235	LEXNBORUSRUDFI-GUBZILKMSA-N	429.340	1.365	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](N)CCC(N)=O)CC1	1826821095	SQDRPECCUSSYMJ-YZVOILCLSA-N	435.396	1.435	50	20	IDGD	
O=C(CN1CCCCC1)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827055233	VMXULEQSSCZOQS-JOCHJYFZSA-N	441.381	1.086	50	20	IDGD	
O=C(c1ccnc(F)c1)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827056465	ZWQNEPROJLYIOU-HXUWFJFHSA-N	439.296	1.448	50	20	IDGD	
O=C(N[C@H]1CCc2nc(NC(=O)C3CC4(CCC4)C3)sc2C1)c1ccc(B(O)O)cc1	1827369207	HFYNZHKTXVKADS-INIZCTEOSA-N	439.346	1.629	50	20	IDGD	
CCCC(=O)N[C@@H](C)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830364499	MLQXQSAHVQNLMM-MGPUTAFESA-N	431.961	1.013	50	20	IDGD	
O=C1CC[C@H](C(=O)N2CCC([C@@H]3CCCCN3C(=O)[C@H](F)Br)CC2)CN1	1830379217	QFBPVFGAWNMDED-DZKIICNBSA-N	432.334	1.823	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3sc(N)nc3C)C2)C1	1831647198	SFYYJWNZWGJFKQ-SCLBCKFNSA-N	430.958	1.511	50	20	IDGD	
C[C@@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1)n1cccn1	1832239419	FTPJVOWZJDQIEO-PKOBYXMFSA-N	432.569	1.437	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3c(C)noc3C)CCO2)C1	1833065430	CCXFMFJQTHWNJN-YLJYHZDGSA-N	427.929	1.698	50	20	IDGD	
CCOc1ncccc1C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)CCl)CC2)CC1	1833306389	CTALWVVSZKOHMX-GOSISDBHSA-N	438.956	1.265	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3n[nH]c(C)c3F)CCO2)C1	1833674143	QIMTWFRDGIPWMK-SJKOYZFVSA-N	447.305	1.101	50	20	IDGD	
O=C(c1cnccc1C(F)(F)F)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1834111923	RMAWPCNJXXDPIR-CJNGLKHVSA-N	439.793	1.705	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3csc(C)n3)CCO2)C1	1834459862	QZSROONGISDXMK-GUYCJALGSA-N	446.367	1.695	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](CN)c1ccccc1)CCO2	1835813916	WKUFDVGOPRVULG-IPJJNNNSSA-N	437.968	1.593	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccn4nccc4c3)CCO2)C1	1837155595	KPVZMCQQOGDCNY-NQIIRXRSSA-N	434.924	1.812	50	20	IDGD	
CN(C)c1cccc(C(=O)N2CCOC[C@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)c1	1837715112	WIXWUQCSFYDMTG-QFIPXVFZSA-N	449.624	1.674	50	20	IDGD	
CCc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)nn1C	1838276386	VIEAADVNGAPTBG-RBUKOAKNSA-N	447.363	1.289	50	20	IDGD	
C[C@@H](C(=O)N1CCC(OC2CCN(C(=O)CO[Si](C)(C)C)CC2)CC1)n1cncn1	1838432472	ZKFOCNLWSGIGPB-INIZCTEOSA-N	437.617	1.689	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)cc1	1838984943	CHJAJYZRTPTOHF-KXBFYZLASA-N	425.323	1.848	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3nnc(C)s3)C2)C1	1839142422	OIHZKADPFKPBPT-KBXCAEBGSA-N	430.958	1.253	50	20	IDGD	
Cc1cccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)n1	1839197745	HLWZYNBKCYBQHM-RHSMWYFYSA-N	430.274	1.151	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(O)ccc1O)CCO2	1839448117	QZJIXSKMPURFQD-HXUWFJFHSA-N	438.553	1.019	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cncc(F)c3)C2)C1	1840031298	LOKJBFNQVOASGH-SJCJKPOMSA-N	430.274	1.074	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@](F)(C(=O)N2CC3(CCCN3C(=O)[C@@H](O)CCl)C2)C1	1841351097	FZYWSNGTXMYTQT-ORAYPTAESA-N	433.908	1.139	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)C2=CCN(C(=O)OC(C)(C)C)C2)C1	1841521416	QVHXHNIMNHGITC-OAHLLOKOSA-N	427.929	1.621	50	20	IDGD	
Cn1cc(NC(=O)OC(C)(C)C)cc1C(=O)N1CCCC12CN(C(=O)[C@@H](O)CCl)C2	1842233821	NZKOGXWEJFZNIA-HNNXBMFYSA-N	440.928	1.789	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC2(CCCN2C(=O)CCSC(=N)N)C1	1842912778	AIMFYLDQLHXBQB-LBPRGKRZSA-N	447.989	1.339	50	20	IDGD	
O=C([C@H]1C[C@@H]1c1ccc(F)c(F)c1)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843012744	LDDWCDYJFDNNAN-MSOLQXFVSA-N	440.255	1.265	50	20	IDGD	
C=CC[C@H](CC(=O)N1CCCC12CN(C(=O)[C@H](O)CCl)C2)NC(=O)OC(C)(C)C	1846932592	CCQDAZGUNKVXIE-HUUCEWRRSA-N	429.945	1.649	50	20	IDGD	
O=C(c1cc(=O)c(OCc2ccccc2)c[nH]1)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl	1847556148	FLOMLSHQFOOYEV-JENIJYKNSA-N	445.903	1.369	50	20	IDGD	
O=C([C@H](O)CCl)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](Br)Cc1ccccc1	1847564328	YKQROJIZUWPFNI-FXUDXRNXSA-N	429.742	1.794	50	20	IDGD	
CC(C)[C@H](S)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CN(C)NC(=O)NCc1ccccc1	1847826942	NMIDNSUJTCDMJF-BJLQDIEVSA-N	447.605	1.489	50	20	IDGD	
CC(C)C(=O)NNC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(Br)cc2)C1	14350909	GPMORYAFKHLTAI-GFCCVEGCSA-N	432.340	1.653	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C2CCN(S(=O)(=O)c3c(C)noc3C)CC2)cc1	18095734	YRPSWCICHWQIRT-UHFFFAOYSA-N	434.518	1.716	50	20	IDGD	
COc1ccc(CN2C(=O)c3ccccc3C2=O)cc1C(=O)NNc1nnc(C)c(O)n1	23309680	BOYPDZIQSWCVOO-UHFFFAOYSA-N	434.412	1.447	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)CCc2nc3ccccc3[nH]2)c1	27205547	MMEQLMXYLIXCBZ-UHFFFAOYSA-N	443.529	1.987	50	20	IDGD	
COc1ccc(C)cc1-n1ccc(C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)n1	60106520	MMXVGXFFANEBEI-UHFFFAOYSA-N	432.440	1.511	50	20	IDGD	
COc1ccc(CC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)cc1[N+](=O)[O-]	727671637	GKJJKYCEOHJCPO-UHFFFAOYSA-N	435.462	1.209	50	20	IDGD	
CS(=O)(=O)Cc1nc2ccccc2n1CC(=O)NNC(=O)CCCc1ccccc1	727717247	FJCFNBWHNXUEIW-UHFFFAOYSA-N	428.514	1.751	50	20	IDGD	
CC(=O)N1CCN(c2ccc(C(=O)NNC(=S)NCC3CCC3)cc2[N+](=O)[O-])CC1	727869245	JUEQERRTJNQPFK-UHFFFAOYSA-N	434.522	1.172	50	20	IDGD	
Cn1c(=O)n(CCC(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)c2ccccc21	728209587	HTDXETOBOLDQHD-UHFFFAOYSA-N	429.502	1.314	50	20	IDGD	
O=C(NNC(=O)c1ccc(F)c(S(=O)(=O)NC2CC2)c1)c1cccc(OC(F)F)c1	728486427	BYTPLHAUWTXDFZ-UHFFFAOYSA-N	443.403	1.943	50	20	IDGD	
CS(=O)(=O)c1nc(C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)c2ccccn12	728972635	WXRSURBEATWAMF-UHFFFAOYSA-N	444.441	1.491	50	20	IDGD	
CCn1c(=O)c(=O)[nH]c2cc(C(=O)NNc3ccc(S(=O)(=O)C(F)F)cc3)ccc21	728976542	UWLLLVMKHCXIPX-UHFFFAOYSA-N	438.412	1.463	50	20	IDGD	
NC(=O)[C@H]1CCCN(CCCNC(=O)NNC(=O)c2ccc(COc3ccccc3)o2)C1	729495192	REQRRZVGHBMTLN-INIZCTEOSA-N	443.504	1.390	50	20	IDGD	
Cc1cc(S(C)(=O)=O)c(C)c(S(=O)(=O)NNC(=O)c2cccc3ncccc23)c1	730204246	MUWGLCAIIRMDNI-UHFFFAOYSA-N	433.511	1.878	50	20	IDGD	
Cc1cccc(N2C(=O)N[C@H](CCC(=O)NNC(=O)[C@H](C)Oc3ccc(F)cc3)C2=O)c1	730769353	SVFIRIGRZDVRFE-KBXCAEBGSA-N	442.447	1.954	50	20	IDGD	
CC(C)N(C)S(=O)(=O)c1ccc(NC(=O)NNC(=O)COc2ccccc2O)cc1	730895490	JHOMOGOHCKTKEE-UHFFFAOYSA-N	436.490	1.653	50	20	IDGD	
CC[C@@H]1CCCN(C(C)(C)CNC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)C1	732469768	PJDFWBMXXKHCPT-OAHLLOKOSA-N	428.537	1.778	50	20	IDGD	
C[C@H](CS(C)(=O)=O)NC(=O)NNC(=O)CCCOc1ccc(Cl)cc1Cl	733662917	QYANUXPDIAIDFL-SNVBAGLBSA-N	426.322	1.916	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)CC[C@H]1NC(=O)N(c2ccc(C#N)cc2)C1=O	733758809	WQHRXMWPSHQIMW-QGZVFWFLSA-N	435.440	1.162	50	20	IDGD	
C[C@H]1CCc2c(C(=O)NNc3ncccc3S(=O)(=O)N3CCN(C)CC3)csc2C1	735117380	UFBPPZUQZUBGLS-AWEZNQCLSA-N	449.602	1.961	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)NCc2noc(C)n2)cc1	736092292	MZALYXYMXYMNIM-OQLLNIDSSA-N	435.444	1.349	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)N2CCC[C@@H]2C(=O)NNc2cc(C)nc(C)n2)o1	736716184	GXRWFUPOKHDXOE-CYBMUJFWSA-N	437.478	1.160	50	20	IDGD	
CCc1cc(CNC(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)n[nH]1	739024950	OCFWMHWRIRQIJK-UHFFFAOYSA-N	445.487	1.818	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC[C@@H]2C)cc1	740853388	QEGCCKPTYYDJFF-AWEZNQCLSA-N	438.550	1.316	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)N[C@H](C)[C@@H]1CN(Cc2ccccc2)CCO1	741266397	JWURUGIQZWIPNP-UTKZUKDTSA-N	442.516	1.694	50	20	IDGD	
COc1ccc(Cc2nnc(SCC(=O)NNC(=O)c3cccc(C)c3)n2N)cc1	742444654	CDRDHSCPOPEOCB-UHFFFAOYSA-N	426.502	1.453	50	20	IDGD	
C[C@H](CN1CCN(c2ccccc2)CC1)NC(=O)NNC(=O)COCc1ccccc1	743624614	MMGIPKPYMWQJMX-LJQANCHMSA-N	425.533	1.744	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)COc2ccc(N3CCCC3=O)cc2)cc1	743829708	BKYXQCSWFIOOBT-UHFFFAOYSA-N	446.485	1.449	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)[C@@H](c2cccc(F)c2)N2CCOCC2)c1	745424256	PKIAYSMTSJUAOX-HXUWFJFHSA-N	429.448	1.512	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)[C@@H]3CCCN3C3CCCC3)cc2)CC1	749235207	DNNOCYXKRLMDQL-FQEVSTJZSA-N	435.594	1.473	50	20	IDGD	
CCOC(=O)[C@H]1CCCN(C(=O)CN(C)C(=O)NNC(=O)c2cc3ccccc3o2)C1	750285084	VBHJMYIJCGASQK-HNNXBMFYSA-N	430.461	1.521	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@@H]2CCCOc3ccccc32)cc1	750338554	QJGFQFKPTPZYMN-GOSISDBHSA-N	446.529	1.860	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCC2(CS(C)(=O)=O)CC2)cc1Br	752015676	YSBVZBDKMBDHCX-UHFFFAOYSA-N	434.312	1.227	50	20	IDGD	
Cc1ccc([C@]2(C)NC(=O)N(CC(=O)NNc3nc4ccccc4c(=O)n3C)C2=O)cc1	752907974	QICQFWSQDUIHLQ-QFIPXVFZSA-N	434.456	1.152	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)N[C@H]1CCCN(Cc2ccccn2)C1=O	753297168	HFBQPLWHEKVYGO-KRWDZBQOSA-N	441.488	1.381	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)CSc2nc(-c3ccccc3)no2)c2ccccc2c1=O	754841915	IYYHHORFZLPVGB-UHFFFAOYSA-N	436.453	1.537	50	20	IDGD	
O=C(Cc1cc[nH]n1)NNC(=O)c1cccc(S(=O)(=O)N2CCc3ccccc32)c1	755282231	ODBXPYQAZFPKBO-UHFFFAOYSA-N	425.470	1.165	50	20	IDGD	
CC1CCN(S(=O)(=O)c2ccc(NC(=O)NNC(=O)Cc3cccnc3)cc2)CC1	755420742	CAXBRPYXINJFBO-UHFFFAOYSA-N	431.518	1.898	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)Nc2ccc(-n3cnnn3)cc2)c2ccccc2c1=O	755435140	LTMPIJMISASZAL-UHFFFAOYSA-N	433.432	1.420	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)Nc2ccc(C)c(-n3cnnn3)c2)cc1	755687920	ZMEPVFFISSSORE-AWEZNQCLSA-N	425.449	1.990	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)Nc2cccc(S(=O)(=O)/N=C3/CCCN3C)c2)n1	756033339	XWNSNPIAVYCFLI-ULJHMMPZSA-N	447.521	1.166	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)NCC2CCS(=O)(=O)CC2)cc1OC	756132195	BZDWLXVHGVDCNQ-UHFFFAOYSA-N	427.523	1.643	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2ccc(OC)c(-n3nnnc3C)c2)c(OC)c1	756322967	XNHAYTBBCNZNED-UHFFFAOYSA-N	427.421	1.463	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(NC(=O)NNC(=O)COc2cccc(C)c2)cc1	756783097	DWRBVBLNENXKRX-UHFFFAOYSA-N	436.490	1.151	50	20	IDGD	
COc1ccc(C(=O)NN=c2cc[nH]cc2Cl)cc1S(=O)(=O)NCc1ccccn1	757413524	JQOFBGVKZSJBQY-UHFFFAOYSA-N	447.904	1.796	50	20	IDGD	
Cn1cc(NC(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)cc(Br)c1=O	757690311	SLHHQIWNFVDVHX-UHFFFAOYSA-N	446.302	1.605	50	20	IDGD	
COC(=O)CCc1csc(NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)n1	757734951	NSKXQTANZOSGHR-UHFFFAOYSA-N	433.494	1.108	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)N[C@H]2CN(C(=O)OC(C)(C)C)C[C@@H]2C#N)c1	758770519	LIGLZYWUXUHYBO-RDJZCZTQSA-N	431.493	1.772	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)NC[C@H]1CC(=O)N(Cc2ccccc2)C1	759682419	GUJHAXJPQNGBDV-MRXNPFEDSA-N	441.444	1.353	50	20	IDGD	
N#CC1=CCN(C(=O)c2cc(S(=O)(=O)N3CCCCC3)ccc2N2CCOCC2)CC1	760003704	ONDIOZYIDZFKQX-UHFFFAOYSA-N	444.557	1.994	50	20	IDGD	
Cc1c(S(=O)(=O)NNC(=O)c2csc(N3CCOCC3)n2)oc2ccc(F)cc12	760335567	SPXRAMGMLRSNIQ-UHFFFAOYSA-N	440.478	1.797	50	20	IDGD	
COC(=O)c1cn([C@H]2CCN(C(=O)NNC(=O)c3ccc(Br)s3)C2)nn1	760654177	ASMAZFONHDOWPJ-QMMMGPOBSA-N	443.283	1.190	50	20	IDGD	
Cc1nn(CC(F)F)c(C)c1C(=O)N1CCN(S(=O)(=O)CBr)CC1	760931247	PTOHXZIRRPZSCS-UHFFFAOYSA-N	429.287	1.205	50	20	IDGD	
Cc1nnnn1[C@@H](Cc1cccc(F)c1)C(=O)NNC(=O)c1cc(-c2ccccc2)[nH]n1	762937651	KQXYZSWPZOHIHG-IBGZPJMESA-N	434.435	1.756	50	20	IDGD	
CCS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3n2)cc1	763450400	NSEIDBGBIUDLKU-UHFFFAOYSA-N	426.454	1.428	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)[nH]n1)C(=O)Nc1ccc(CN2CCCC2=O)cc1	763605752	UONPBCSKGDYIBD-UHFFFAOYSA-N	446.467	1.599	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(N3C[C@H](C)O[C@@H](C)C3)cc2)c1	763618923	JFBDNMZZESFPIB-IRXDYDNUSA-N	440.500	1.774	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2nc(-c3nccn3C)cs2)c1	763667618	BLVBRCBOYQZQNO-UHFFFAOYSA-N	428.474	1.325	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2F)cc1Br	763679449	LSIJJBXQTFEILM-UHFFFAOYSA-N	440.225	1.762	50	20	IDGD	
O=C(COc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1ccc2c(c1)NC(=O)CS2	763686668	OXVPBQOETFUWKZ-UHFFFAOYSA-N	434.861	1.549	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(C3CC3)cc2)c1	763718339	JZZAIPNOAGEVKL-UHFFFAOYSA-N	430.486	1.214	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2ccccc2N2CCOC2=O)c1	763773498	XYLONXSLEPJBHZ-UHFFFAOYSA-N	428.401	1.060	50	20	IDGD	
N#Cc1cccc(-c2csc(NC(=O)C(=O)NNC(=O)COc3ccccc3C#N)n2)c1	763807438	BWTGXZQTXHOVFA-UHFFFAOYSA-N	446.448	1.718	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(S(C)(=O)=O)c(C(F)F)c2)cc1	763829246	FDGHZIRVVZGDSX-UHFFFAOYSA-N	439.440	1.990	50	20	IDGD	
CCN1CCN(c2ccc(NC(=O)C(=O)NNC(=O)COc3ccc(F)cc3)cc2)CC1	763837530	IIZKAACLHWRIGT-UHFFFAOYSA-N	443.479	1.133	50	20	IDGD	
CC(C)Cn1ncc(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)c1C(F)F	763838962	CDGPDLIPSLGFSI-UHFFFAOYSA-N	427.383	1.781	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)OC(F)(F)O3)cc1	763873691	XNZHWFVSHVDDFN-NSHDSACASA-N	449.366	1.764	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C)c(C(=O)N(C)C)c2)cc1OC	763903015	ZOEMAMRAUFLZMA-UHFFFAOYSA-N	442.472	1.504	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)Cc2ccc3ccccc3c2)ccc1-n1cnnn1	764081794	LEKVKFQSXHHEML-UHFFFAOYSA-N	429.440	1.453	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2ccc(OCC(F)(F)F)nc2)cc1	764124451	HJZHEWJDRQRHLN-UHFFFAOYSA-N	440.378	1.750	50	20	IDGD	
CCn1cnnc1-c1ccccc1NC(=O)C(=O)NNC(=O)CCc1ccc(OC)cc1	764126520	IMGWKNFCHOJDFE-UHFFFAOYSA-N	436.472	1.692	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1cccc(NC(=O)c2ccoc2)c1	764133161	UNJXJOWEUWARJV-UHFFFAOYSA-N	436.424	1.869	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2O1)C(=O)Nc1ccc(OCc2ccccc2)nc1	764165375	XXQFJYPWNNNQPJ-LJQANCHMSA-N	432.436	1.750	50	20	IDGD	
COC(=O)c1cc(Br)ccc1NC(=O)C(=O)NNC(=O)c1ccc(C#N)cc1	764183457	YLRYCRQIMLOZCT-UHFFFAOYSA-N	445.229	1.507	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)CCc2ccccc2)cc1C(F)F	764191750	DVHNIYIBLPRNNE-UHFFFAOYSA-N	439.440	1.746	50	20	IDGD	
CCCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cccc(OC(F)F)c2)cc1	764260407	XPZAOASBEHUJCT-UHFFFAOYSA-N	434.399	1.828	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)C(=O)Nc1ccn(-c2ccc(Cl)cc2Cl)n1	764266503	KHRDUWNWHNTGRJ-UHFFFAOYSA-N	433.255	1.903	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F	764275039	HWBSAOMFQLCGKL-UHFFFAOYSA-N	440.315	1.067	50	20	IDGD	
CC(C)(C)NC(=O)c1cccc(NC(=O)C(=O)NNC(=O)COc2ccccc2O)c1	764276972	FOIFBXGHFWXSEU-UHFFFAOYSA-N	428.445	1.085	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)C(=O)Nc1ncn(Cc2ccc(Cl)cc2)n1	764367871	PGZWFOBAMUDVPE-UHFFFAOYSA-N	442.863	1.283	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)CNC(=O)c1c(F)cccc1Cl	765418307	OLXQFGLYHSLEIP-UHFFFAOYSA-N	430.864	1.661	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@]1(C)CCCC[C@@H]1C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	765542871	SPEUUIGSOIFFCQ-IERDGZPVSA-N	443.508	1.897	50	20	IDGD	
Cc1onc(-c2ccncc2)c1C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	766644784	WLQANQZQDIJZMF-UHFFFAOYSA-N	448.483	1.264	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)c1ccc2nccnc2c1	766663711	MCXCJSNFSCSMJM-UHFFFAOYSA-N	438.919	1.862	50	20	IDGD	
Nc1cc(C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)cc(Cl)n1	766664903	XEQDLVFATNDSKA-UHFFFAOYSA-N	437.331	1.549	50	20	IDGD	
CSCC[C@@H](NC(=O)c1ccccc1Br)C(=O)NNC(=O)C(C)(C)O	768260927	INPCNBKILWSNCX-GFCCVEGCSA-N	432.340	1.219	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@@H](NC3CCOCC3)C(C)C)CC2)cc1	768290588	KPPPWLGAFJPFHX-QHCPKHFHSA-N	445.608	1.053	50	20	IDGD	
O=C(COC(=O)c1ccc(OCC(F)(F)F)cn1)NNC(=O)c1ccc([N+](=O)[O-])cc1	768927489	KREHYAIALCYULK-UHFFFAOYSA-N	442.306	1.549	50	20	IDGD	
Cc1cnn(Cc2ccccc2F)c1NC(=O)C(=O)NNC(=O)CCc1ccccc1O	769268338	YYXFUAVTLXBRSW-UHFFFAOYSA-N	439.447	1.803	50	20	IDGD	
CNS(=O)(=O)c1ccc(C(=O)NNC(=O)[C@@H](C)Oc2ccc3ccccc3c2)cn1	770208817	OKEDHYSULKFPAQ-CYBMUJFWSA-N	428.470	1.371	50	20	IDGD	
CNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2ccc(COc3ccccc3)o2)cn1	770220703	SDTSNDKTXGJROF-UHFFFAOYSA-N	430.442	1.237	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)[C@]34CCC(=O)N3c3cc(Cl)ccc3S4)nc21	770980746	UJMQDKQWQLEJNH-QGZVFWFLSA-N	431.865	1.794	50	20	IDGD	
C[C@]1(c2ccc(Br)cc2)NC(=O)N(CC(=O)NNC(=O)c2ccccn2)C1=O	771216782	RXGVKTOGXMIINI-GOSISDBHSA-N	446.261	1.072	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)[C@@H]1CSCN1C(=O)c1ccc(Cl)cc1	772095588	KPUJOKGTKDXELN-WFASDCNBSA-N	441.937	1.980	50	20	IDGD	
C[C@H]1CN(c2ccnc(C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)c2)C[C@H](C)O1	772486187	GIBVEIMJOSGZKS-GJZGRUSLSA-N	435.525	1.761	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)[C@@H]2CCCN(C(=O)Cc3ccccc3)C2)nc1C	778422118	VBGMQZJOKBEDJN-QGZVFWFLSA-N	425.489	1.886	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(/C#N)C(=O)N2CC(n3cc(C(=O)OC)nn3)C2)c1C	779550930	YSPCYYARSFVCRC-CGWJPAAUSA-N	426.477	1.681	50	20	IDGD	
CCNC(=O)N(C)NC(=O)c1ccc(NS(=O)(=O)c2ccc3nc(O)[nH]c3c2)cc1	780708308	FEFGWAXZQWHQAD-UHFFFAOYSA-N	432.462	1.375	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)/C=C\C(=O)N2CCN(c3ccc(OC)cc3)CC2)c1	781034603	LBYGFNKCXMXWEW-KHPPLWFESA-N	438.484	1.830	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)NCc1ccccc1CN1CC[C@H](O)C1	781956602	WBMZVFMGVPXUNF-IBGZPJMESA-N	442.516	1.561	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2ccc(F)c(S(=O)(=O)NC(C)(C)C)c2)nc1	782145826	ZBMYHUHTTIXFFX-UHFFFAOYSA-N	439.469	1.388	50	20	IDGD	
CC(C)(C)c1cc(NC(=O)C(=O)NNC(=O)C(=O)NC2CC2)n(-c2cccc(Cl)c2)n1	782966717	OUNGZWHQPVITSK-UHFFFAOYSA-N	446.895	1.188	50	20	IDGD	
Cc1ccccc1NC(=O)NNC(=O)C(=O)Nc1cnn(CC(=O)NC2CCCC2)c1	783417579	VNQHYAGWGLUZQD-UHFFFAOYSA-N	427.465	1.042	50	20	IDGD	
Cc1ccc(-n2nc(C(C)C)cc2NC(=O)C(=O)NN[C@@]2(C)CCS(=O)(=O)C2)cc1	783424836	FYNJMVRPPZZAEF-FQEVSTJZSA-N	433.534	1.441	50	20	IDGD	
O=C(NNc1cc(Cl)ccn1)C(=O)Nc1cccc(S(=O)(=O)N2CCCCC2)c1	784856139	CUNPPZNSSWWVHD-UHFFFAOYSA-N	437.909	1.991	50	20	IDGD	
N#Cc1ccc(NNC(=O)C(=O)Nc2cccc(C(=O)N3CCOCC3)c2)cc1Cl	785085803	GDAJKOVDNNSYHS-UHFFFAOYSA-N	427.848	1.766	50	20	IDGD	
O=C1Cc2cc(NC(=O)C(=O)NNc3c(F)cc(C(=O)NC4CC4)cc3F)ccc2N1	785100742	YRVJZDJQKNSGHK-UHFFFAOYSA-N	429.383	1.433	50	20	IDGD	
CN(NC(=O)Nc1ccc(-n2ccnn2)cc1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	785844955	JCYXXNXZPFDIHR-UHFFFAOYSA-N	444.496	1.908	50	20	IDGD	
CN(C)NC(=O)Nc1cccc(NC(=O)CN2C(=O)N[C@](C)(c3ccc(F)cc3)C2=O)c1	788258405	ALCNYSRJDCYIQA-OAQYLSRUSA-N	442.451	1.830	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1ccc(CN2CCCC2)cc1	788865697	AHKDAAZWMXTHIR-UHFFFAOYSA-N	429.546	1.959	50	20	IDGD	
CCOC[C@@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(CC)CC)c1)C(C)C	788877927	QAPLXYUEHLZKTM-QGZVFWFLSA-N	428.555	1.722	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)[C@H]1CC(=O)N(C)[C@@H]1c1ccc(Cl)c(Cl)c1	790664107	PLVVBJOIODNTQF-BLLLJJGKSA-N	443.331	1.965	50	20	IDGD	
CO[C@H]1CCOc2c(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc3ccccc3F)cccc21	790951883	MJDWUULCZKBBJC-WBMJQRKESA-N	431.420	1.849	50	20	IDGD	
Cc1ccc(S(=O)(=O)NNC(=O)NCc2ccco2)cc1I	793382633	UASPUSATWFCFLG-UHFFFAOYSA-N	435.243	1.885	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNC(=O)c1c[nH]nc1-c1ccc2c(c1)OCO2	794062064	SNBCSDXXIYVMCS-UHFFFAOYSA-N	437.412	1.493	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C2CCN(S(=O)(=O)c3cc(F)ccc3F)CC2)n1	794077337	VDOFHQSJBZPDMV-UHFFFAOYSA-N	438.456	1.530	50	20	IDGD	
CC(C)(C)OC(=O)N1CCOC[C@@H]1CC(=O)NNC(=O)c1cnn(-c2ccccc2)c1	796435293	SWSGSDDEOICNJA-KRWDZBQOSA-N	429.477	1.659	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNC(=O)C(=O)Nc1ccc(OC(F)F)cc1	797368990	LFVAIHPLIDDCLU-UHFFFAOYSA-N	436.371	1.300	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc(I)c[nH]2)cc1C	798309243	YEWOBPKLSDVXDW-UHFFFAOYSA-N	426.214	1.636	50	20	IDGD	
CCO[C@H]1C[C@](NC(=O)OC(C)(C)C)(C(=O)NNC(=O)NCC(F)(F)F)C1(C)C	798315596	LHVZZSIFQHVWED-QFYYESIMSA-N	426.436	1.978	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc(F)c(F)c1)NNC(=O)Nc1ccc2c(c1)OCO2	802101283	JJUMTMBHSBOESR-UHFFFAOYSA-N	442.400	1.215	50	20	IDGD	
CC(C)C[C@H](C(=O)NNC(=O)Nc1ccc2c(c1)OCO2)N1C(=O)[C@@H]2CC=CC[C@H]2C1=O	802106339	BWDBNWMTMWCRDD-BZUAXINKSA-N	442.472	1.934	50	20	IDGD	
Cc1cnc(COCC(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)o1	802762644	JSUWSISBGFLRNY-UHFFFAOYSA-N	435.912	1.118	50	20	IDGD	
CN(CC(=O)NNC(=O)NCC(F)(F)F)c1cc(Br)ccc1[N+](=O)[O-]	803168783	FAEYELCFGHBVRS-UHFFFAOYSA-N	428.165	1.686	50	20	IDGD	
CC(C)[C@H](NS(=O)(=O)c1ccc2c(c1)OCCCO2)C(=O)NNc1cccc(F)n1	804770447	BTABXBSFYNNKKT-SFHVURJKSA-N	438.481	1.828	50	20	IDGD	
COC(=O)c1c(C)csc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)C(F)F)cc1	806968177	AKBCLCUEPWDTCZ-UHFFFAOYSA-N	447.441	1.921	50	20	IDGD	
Cc1cc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)n(C)n1	807224012	IJEOAMOHLJNNHN-UHFFFAOYSA-N	434.522	1.047	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1cccc(NC(=O)C(=O)NNc2nccnc2C2CCC2)c1	807461669	OGISIUMEISGNSD-UHFFFAOYSA-N	446.533	1.903	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccccc1F)NNC(=O)c1cc(F)ccc1Br	810345546	XVMJUXDQVQINDT-UHFFFAOYSA-N	448.245	1.467	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)CNS(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1	810363994	KKKAGWJOTZMSDS-UHFFFAOYSA-N	439.803	1.130	50	20	IDGD	
COc1cc(C(=O)NNC(=O)N[C@H](C)c2noc(COC(C)C)n2)cc(OC)c1OC	811851460	ZMOPOKYKRHARRR-LLVKDONJSA-N	437.453	1.726	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)Nc1ccc2c(c1)OCO2	813464364	DDUWMIXLXCTCCQ-UHFFFAOYSA-N	432.458	1.666	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cccc(OC(=O)NC)c2)cc1	815566123	JQOTYUKSMYCBPL-CYBMUJFWSA-N	444.444	1.357	50	20	IDGD	
CNC(=O)c1cc(Oc2cccc(NC(=O)C(=O)NNC(=O)c3ccccc3C)c2)ccn1	815567183	QSTWIQWEPABKPE-UHFFFAOYSA-N	447.451	1.942	50	20	IDGD	
O=C(CN1CCOCC1)Nc1ccc(NC(=O)C(=O)NNc2cccc(Cl)n2)cc1	815726746	SAVQLYVWMLQCAX-UHFFFAOYSA-N	432.868	1.088	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1cnn(-c2ccccc2F)c1	815751842	QSQBEGJOLIYZPM-UHFFFAOYSA-N	446.464	1.344	50	20	IDGD	
CCOc1ccc(C(=O)N2CCCCC2)cc1NC(=O)C(=O)NNc1ncncc1F	815765569	VXWHGHVNMHXJIJ-UHFFFAOYSA-N	430.440	1.722	50	20	IDGD	
O=C(CC1CC1)NNC(=O)c1cccc(NS(=O)(=O)c2ccc3c(c2)OCCO3)c1	819103986	FNAAVGKFXNXIMX-UHFFFAOYSA-N	431.470	1.820	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)[C@@H]2CS[C@H](Cc3ccccc3F)C(=O)N2)cc1C	888438410	YWLYTQNELVYPHF-RBUKOAKNSA-N	445.516	1.812	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@H](C)C(=O)NNC(=O)CN1C(=O)[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O	912868669	JKNGSQRBDMHHCN-AYMSOESYSA-N	445.903	1.679	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)CNS(=O)(=O)c2ccccc2C(F)(F)F)cc1	913431319	FBANAQMWAMJITQ-UHFFFAOYSA-N	444.435	1.552	50	20	IDGD	
COc1cc(N2C[C@@H](C(=O)NNC(=O)NC3CCCCC3)CC2=O)cc(OC)c1OC	913901020	KKUNUYCTVHMTAL-ZDUSSCGKSA-N	434.493	1.728	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cc(-c3ccc(C)o3)[nH]n2)cc1	915685694	CYNOBWACDHTUGK-UHFFFAOYSA-N	431.474	1.368	50	20	IDGD	
CC(C)CN1CCO[C@@H](CNC(=O)NNC(=O)COc2ccc(Br)cc2)C1	915923195	YVTGHIYOTKEAAX-INIZCTEOSA-N	443.342	1.515	50	20	IDGD	
O=C(Cc1ccc(NC(=O)c2ccc(Br)o2)cc1)NNC(=O)C(=O)NC1CC1	916127577	LGMIBSJYJOUQTD-UHFFFAOYSA-N	449.261	1.263	50	20	IDGD	
Cc1oc(C(=O)NNC(=O)COc2ccc(F)cc2)cc1S(=O)(=O)N1CCCC1	916131468	FMVNXGIHGTZMQI-UHFFFAOYSA-N	425.438	1.352	50	20	IDGD	
N#Cc1ccc(CS(=O)(=O)CC(=O)NNC(=O)c2cc(Br)c[nH]2)cc1	916133474	QXEPZQGVROJKLJ-UHFFFAOYSA-N	425.264	1.025	50	20	IDGD	
CCC(CC)[C@@H](CNC(=O)NNC(=O)c1csc(N2CCOCC2)n1)N1CCCC1	916256753	PSAGUVVIZVXUJC-QGZVFWFLSA-N	438.598	1.824	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)N[C@@H]2CCc3nc(C)ncc3C2)c2ccccc2c1=O	916319430	RNWATEZFAIZOKF-MRXNPFEDSA-N	449.515	1.797	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cc(F)cc3nccnc23)cc1OC	919594535	XCQBQOMAWNSLSJ-UHFFFAOYSA-N	428.376	1.404	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)N[C@@H]2CCO[C@]3(CCSC3)C2)cc1	1116307625	XZXPCDRWNKIFIA-CXAGYDPISA-N	428.536	1.481	50	20	IDGD	
O=C(Cc1ccc(S(=O)(=O)N2CCCCC2)cc1)NNC(=O)c1n[nH]c2c1CCCC2	1321526856	CGQPSUUCEKBWRF-UHFFFAOYSA-N	445.545	1.467	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@]2(F)CCOC2)c1	1323467121	XDHOJKMIJDIAMV-LJQANCHMSA-N	437.449	1.386	50	20	IDGD	
CC(=O)N(C)[C@@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Br)C2	1778105691	GITZWWUFOUDZRI-XZBIERFOSA-N	436.322	1.058	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C/N=C/c2ccco2)C1	1779446388	JYQOSYLCVNIUQG-PSHCQLPQSA-N	440.338	1.996	50	20	IDGD	
COc1ncccc1CCC(=O)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781326266	MOQRJSNQVRSGRJ-MAUKXSAKSA-N	444.301	1.543	50	20	IDGD	
O=C(c1cn2ccsc2n1)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781331711	PZHJIWMWGLGYBE-ABAIWWIYSA-N	431.287	1.530	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(NC(=O)C4CC4)cc3)C2)C1	1781470575	RTXYIOWWKGHXIB-GCJKJVERSA-N	449.935	1.732	50	20	IDGD	
CCn1nccc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)Br)C1	1781996602	OAVFFLTYXHIYQG-JCKWVBRZSA-N	427.343	1.814	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C/N=C/c1ccco1)C2	1781997603	DMVGVMGAVSVVIR-PSHCQLPQSA-N	440.338	1.996	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CCC(=O)NN(C)C)C2)c(F)c1	1782213358	MJFYDYAQQUVNHP-AUSIDOKSSA-N	448.539	1.635	50	20	IDGD	
C[C@@H](C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Br)C2)n1cncn1	1782532333	XLAWEKCGZIHHCZ-VPWBDBDCSA-N	432.294	1.044	50	20	IDGD	
C[C@]1(C(=O)N2CCO[C@]3(CCN(C(=O)/C(C#N)=C/c4ccc(F)cc4F)C3)C2)CCCN1	1782867934	VTRYTPXIXYUQKD-ZXGKALCVSA-N	444.482	1.844	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)CCN3CCCCC3)CCO2)C1	1783343644	WESLGHGQZXKRNU-QFBILLFUSA-N	430.387	1.866	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ncn(C(C)C)n3)CCO2)C1	1783348026	SBXSCUYBEAKRQK-SUMWQHHRSA-N	428.331	1.476	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)CCC(=O)N3CCCC3)CCO2)C1	1783530230	VPXMINAAQSDLLT-KDOFPFPSSA-N	430.343	1.002	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)CCC(=O)N3CCCC3)CCO2)C1	1783530231	VPXMINAAQSDLLT-KSSFIOAISA-N	430.343	1.002	50	20	IDGD	
O=C(c1ccc2nc(CO)[nH]c2c1)N1CCO[C@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783947890	LAHFZUADJAXFOX-SFHVURJKSA-N	427.288	1.302	50	20	IDGD	
Cc1n[nH]c(C)c1CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]2C1	1783972826	QHKOZOOLONIQTK-UMPQAUOISA-N	441.370	1.580	50	20	IDGD	
N#Cc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]3C2)c(Cl)c1	1784092205	KJAKJLMOBVQXDE-CSFVBSKPSA-N	426.300	1.405	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3nc(Cl)ccc3F)[C@H]2C1	1785477102	QZMCJDUJEUBEPJ-FMSGJZPZSA-N	434.295	1.721	50	20	IDGD	
O=C(C/N=C/c1ccco1)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1	1788142376	VFKFBHFKOIOVGN-CVKSISIWSA-N	445.284	1.826	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)c3cnn4c3CCC4)CCC2)cc1)c1ccc(B(O)O)cc1	1788143440	DTHMCOXOFHJAOH-UHFFFAOYSA-N	444.300	1.571	50	20	IDGD	
CCn1ccc(C(=O)NC2(c3ccc(NC(=O)c4cccc(B(O)O)c4)cc3)CCC2)n1	1788145993	OTTBZGUMKMTXGL-UHFFFAOYSA-N	432.289	1.644	50	20	IDGD	
CCc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]3C2)nn1C	1789870261	BLNZCYYCDYDLGZ-BCRCDCHUSA-N	431.364	1.812	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(C(F)F)no3)C[C@@H]21)[C@@H](F)Br	1789922909	NQEWNNAUIGUPFN-RJVLYZLMSA-N	440.216	1.896	50	20	IDGD	
COc1nccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]3C2)c1F	1789922938	OMMGLQYRTVNAMS-HVTMNAMFSA-N	448.264	1.513	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(F)c(F)cc3F)[C@H]2C1	1790044776	SIDCPCWOTOHGNW-AKENFEQQSA-N	434.842	1.951	50	20	IDGD	
Cc1cccc(C)c1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]21	1790152633	SEQJLGWMXPVLSB-FHWLQOOXSA-N	430.549	1.270	50	20	IDGD	
CCOc1ccsc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](Cl)COC)[C@H]2C1	1791250695	JIDXPKNMWUEGRB-AYDFFVQHSA-N	430.954	1.994	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccccc3NC(C)=O)C[C@@H]21	1791256671	UEFOUNXUXYALNM-XPYUAMARSA-N	437.924	1.492	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1ccc(C2(NC(=O)/C=N/N3CCCCC3)CCC2)cc1	1791601027	FYNWWNDPCGZEHC-JJIBRWJFSA-N	442.564	1.965	50	20	IDGD	
O=C(CN1C(=O)CSC1=S)Nc1ccc(C2(NC(=O)[C@H](O)CCl)CCC2)cc1	1792314710	QAWAVXHCWHHYJV-CYBMUJFWSA-N	441.962	1.581	50	20	IDGD	
Cc1nnc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)CBr)s1	1792869983	FOXUYOWJHBXWJQ-YGSHXTJESA-N	445.383	1.400	50	20	IDGD	
C#CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCl	1793117129	AVYOCFWBPXTAPV-JKJDWNRSSA-N	427.929	1.141	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C[C@H]1OCCc2ccccc21)c1cccc(B(O)O)c1	1793488318	UGSIHCOWWKVYGI-ADYITMSISA-N	448.328	1.322	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](C)CC(N)=O	1793663788	MCEOPIRBPUBOTR-REBRKWNGSA-N	446.460	1.283	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CSc1ccncc1	1793948100	PMRYBARLQVKNAI-VWPFQQQWSA-N	442.379	1.794	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CSc1ccncc1	1793950514	NBNMCKMPASFIIR-VLWCASSMSA-N	432.373	2.000	50	20	IDGD	
CC[C@@H](NC)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1794142440	AILFKLRRZCWGCE-JKJDWNRSSA-N	430.977	1.755	50	20	IDGD	
CCOc1c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Cl)C3)cnc2c1cnn2C	1796073497	WDWJBWRJKLLNKS-VAECKANCSA-N	439.875	1.105	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnoc1	1796527518	PNWKWTNNQGETGK-IANMSCASSA-N	428.395	1.763	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2nc(CO)[nH]c2c1	1796870340	DRQADAGTDIAEAP-YVWYUNDQSA-N	446.580	1.110	50	20	IDGD	
Cc1nc2sccn2c1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2	1797546686	KIDZMFLUSWSBBX-LSCVPOLPSA-N	445.314	1.598	50	20	IDGD	
O=C1CC(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](Br)Cc2ccccc2)C3)=NN1	1798374874	NAVJBYOLKNNKKM-FZKCQIBNSA-N	447.333	1.507	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnncc1C(=O)O	1798780878	SUDIPZJCEZNTRT-MIJXAVMKSA-N	425.283	1.600	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nc(O)n3c1CCCC3)C2	1799277194	SXLQRABKSYZNOY-MAAUKKLOSA-N	445.347	1.365	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@](C)(Cl)CCl	1799278604	PQZOFWAMSXLCRH-MXSVDAKMSA-N	447.359	1.568	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c(F)ccnc1Cl)C2)[C@@H](F)Br	1799344282	GZUIFKMRKBSZMG-IWXIMVSXSA-N	438.656	1.768	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Br	1799347835	XFSXWVDGZUDXAZ-RCZSTQMZSA-N	430.112	1.440	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnn3ccccc13)C2	1800641243	TXAXHNAKKYUPFC-YXPYIKCWSA-N	435.322	1.711	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CCc3nc[nH]c3C1)C2	1800644445	UIUDTNHZBIJLMP-NLIDSEJHSA-N	439.354	1.278	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CC=CC[C@@H]1C(=O)OC	1800951385	CWKWLKAYGBNMOJ-BQULAQKPSA-N	426.941	1.739	50	20	IDGD	
COc1ccc([C@H](O)C(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)cc1	1802800270	WMBSCPXCOPFICQ-LEAZDLGRSA-N	447.919	1.429	50	20	IDGD	
COc1ncc(C(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)cc1F	1803140184	BCYHWAMIKPFBHQ-XYPHTWIQSA-N	436.871	1.544	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)c2ccno2)[C@@H]1c1cccnc1	1805626486	YSSVZBBPWPGHJI-VQMZYRHSSA-N	449.471	1.523	50	20	IDGD	
COC(=O)CSCC(=O)N1CCCC2(CCN(C(=O)CCBr)CC2)C1	1806036508	JGLVJPBNGDGWDR-UHFFFAOYSA-N	435.384	1.909	50	20	IDGD	
O=C(CC(F)(F)F)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1806835348	CSKNTEIHSDXKTN-CRAIPNDOSA-N	435.211	1.033	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H](CNC(=O)Cn2cnnn2)[C@@H]1c1cccnc1	1807614627	RVZFVMTZBPYPRR-KMFMINBZSA-N	426.308	1.010	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)c1cnc2ccccn12	1809213980	GKECPWOLQVKJFN-WDYCEAGBSA-N	427.892	1.649	50	20	IDGD	
Cc1cc(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)ccn1	1810788231	VKIBWBVFHLFSFQ-IRLDBZIGSA-N	444.300	1.098	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2ccc3nncn3c2)[C@@H]1c1cccnc1	1813030690	LJVWXPCHPNCQKN-VDZJLULYSA-N	442.907	1.698	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H](CNC(=O)COc2cccnn2)[C@H]1c1cccnc1	1813387055	JDMUSNRWBKQCKJ-DYESRHJHSA-N	443.580	1.808	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H]2CCCCN2C)n[nH]1	1814889482	UHRJXIAWGSOHNO-IAGOWNOFSA-N	433.557	1.259	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1ccc(F)cn1	1816587562	ODSQFHOENYTTHB-GOSISDBHSA-N	437.240	1.243	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1	1816727893	BGNMZTZBHYIFAE-UWVGGRQHSA-N	426.882	1.429	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1	1816728261	CWHNQJKXDNKUHV-IONNQARKSA-N	441.307	1.959	50	20	IDGD	
CN(CC(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1)C(=O)OC(C)(C)C	1817026985	KBUSMSLSWYNCTA-UONOGXRCSA-N	443.932	1.868	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1)[C@H]1Cc2ccccc2CN1	1818045281	VCJXRMOOJWPYLG-KURKYZTESA-N	431.924	1.716	50	20	IDGD	
Cc1ccncc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1818337043	LAWHQHZBLNBYTB-GOSISDBHSA-N	448.487	1.731	50	20	IDGD	
Cc1cc[nH]c1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819401818	BAOBCKFCJDFJAQ-INIZCTEOSA-N	436.476	1.664	50	20	IDGD	
COC[C@@H](NC(C)=O)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCBr)[nH]n1	1819607710	KBZPQVNUZICWBI-KGLIPLIRSA-N	444.330	1.338	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CC(F)(F)F)CC2	1819795399	MBXLRWWLFNCNFD-QMMMGPOBSA-N	442.423	1.320	50	20	IDGD	
Cc1cc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)CCC(=O)NN(C)C)CC3)ccn1	1820490915	KQJOTXTVOARXHI-AWEZNQCLSA-N	430.534	1.445	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)CN2C(=O)C=CC2=O)[nH]n1)[C@H](F)Br	1820938483	WHJIVAVUVPVYAX-BMIGLBTASA-N	442.245	1.017	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3cc(=O)nc4cccnn34)sc2C1	1821268427	PRKPRXJXRIVLHV-QWRGUYRKSA-N	446.920	1.789	50	20	IDGD	
C[C@@]1(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)[nH]n2)CC1(F)F	1823397591	DCJXCAVOVYPWHX-LIRRHRJNSA-N	447.446	1.759	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](O)CCl)CC2)c1cc(O)cc([N+](=O)[O-])c1	1823640454	OQXQKTJLFJXLIJ-TVQRCGJNSA-N	440.865	1.582	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H]1CCC(F)(F)C1)CC2	1826080904	GZXJRYJOYAUTGS-RYUDHWBXSA-N	443.520	1.864	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cnc(O)nc2O)CC1	1829101814	COLHXPQQOWVKJA-MRXNPFEDSA-N	436.585	1.973	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)C3CC(F)(F)C3)CCO2)C1	1829992320	FDPRNZKBMXJAEP-NHYWBVRUSA-N	425.270	1.272	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(Cl)cc3C)CCO2)C1	1830124571	MFAJKLNFMHZXHL-PXNSSMCTSA-N	445.343	1.972	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CCc2ccc(O)nn2)CC1	1831087378	BGPOQVJPAPJVDU-ROUUACIJSA-N	438.956	1.988	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3N(C)C)C2)C1	1831643862	JICMWNKQJGEMDN-LAUBAEHRSA-N	438.956	1.625	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc(OCF)cn3)C2)C1	1831643995	MPAPEUHTIVJRCT-IFXJQAMLSA-N	444.891	1.260	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C)nn3CC)C2)C1	1831647268	SXGIVNYJGKCETP-UZLBHIALSA-N	426.945	1.689	50	20	IDGD	
COC[C@H](NC(C)=O)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@H](C)Br)CC1	1831655346	OCZPCBXKSCARGX-RRQGHBQHSA-N	446.386	1.541	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CC[C@H](C(=O)OC)CC1)CCO2	1832013111	HIKUVSYUDVWDJG-NWZZKEMCSA-N	444.956	1.440	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)CCN3CCOCC3)CC2)CC1	1833532118	CTXQOSSRFSBLLB-HXUWFJFHSA-N	443.032	1.688	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccnc3C)CCO2)C1	1834043386	WAROZWAOPLMSQQ-LPHOPBHVSA-N	440.338	1.634	50	20	IDGD	
Cn1c(C(=O)NC2CCN(C3CCN(C(=O)C(C)(C)CCl)CC3)CC2)cccc1=O	1834083172	JQNJKOAPJMUTMY-UHFFFAOYSA-N	436.984	1.836	50	20	IDGD	
CN1CCCC[C@@H]1C(=O)N1CCC(N2CCC(NC(=O)CCBr)CC2)CC1	1834421455	HGBHGDJWYYULPJ-GOSISDBHSA-N	443.430	1.827	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)COc3ccccc3)CCO2)C1	1834954870	BQNKWMNTISTRCC-BEFAXECRSA-N	441.322	1.305	50	20	IDGD	
O=C1Cc2cccc(C(=O)N3CCC(N4CCC(NC(=O)[C@H](F)Cl)CC4)CC3)c2N1	1835081027	DAHYIOTUHAYRDL-IBGZPJMESA-N	436.915	1.901	50	20	IDGD	
O=C(c1cc2cnccc2[nH]1)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836717085	HEQUXRFQQZJYOP-LJQANCHMSA-N	434.924	1.775	50	20	IDGD	
Cc1nccn1[C@H](C)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836720567	XFVOPHOPDDPQKX-KDOFPFPSSA-N	426.945	1.351	50	20	IDGD	
Cc1ccc(C(=O)N2CCC(OC3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)o1	1836952952	ARBAFNILLKTCHA-UHFFFAOYSA-N	440.305	1.194	50	20	IDGD	
C[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1)N1C[C@H]2C[C@@H]2C1	1837287270	PPXWQTSHBLFIRH-SQOWSMRPSA-N	448.391	1.019	50	20	IDGD	
C#CCCCCC(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1	1837922175	SVDCFTMOFRWXOF-UHFFFAOYSA-N	440.349	1.172	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)ccn1	1837940675	LTJVUUYFVYVQIG-WMLDXEAASA-N	430.274	1.151	50	20	IDGD	
CC(C)CNC(=O)C(=O)N1CCC(OC2CCN(C(=O)[C@H](C)Br)CC2)CC1	1838108402	PXYRQFGFGXOXTJ-AWEZNQCLSA-N	446.386	1.541	50	20	IDGD	
COc1cccc(OC)c1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1838881960	DOEABAGSIFBAQU-APWZRJJASA-N	430.860	1.308	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ncn(-c4ccccc4)n3)C2)C1	1839144634	HBNPUCZKJWLNBS-UTKZUKDTSA-N	447.923	1.355	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(OC)ccc3F)C2)C1	1839148490	AKSIGCFUMGZMQW-OXJNMPFZSA-N	428.888	1.922	50	20	IDGD	
C[C@@H](Oc1ccccc1)C(=O)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1839219469	IEPLCTNFSHKPJX-AUUYWEPGSA-N	431.316	1.714	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3cc(C)ccc3C)CCO2)C1	1839936276	QYTUTHDAYNSNHN-SIKLNZKXSA-N	438.952	1.556	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3snnc3C)C2)C1	1839963992	BRXAVKVCXNMMBT-WBMJQRKESA-N	447.355	1.090	50	20	IDGD	
COc1cccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)c1C	1840070503	VVLQHSJHEGATHN-ICSRJNTNSA-N	428.888	1.537	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4ncccc4c3)C2)C1	1840152701	PXUZLWIFMRHUFI-AVRDEDQJSA-N	447.919	1.559	50	20	IDGD	
CS(=O)(=O)c1ccc(CC(=O)N2CCCC23CN(C(=O)[C@@H](F)Br)C3)cc1	1842811015	JVWXPADTPVNLFU-OAHLLOKOSA-N	447.326	1.527	50	20	IDGD	
Cc1onc(-c2ccccc2)c1C(=O)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843010840	JWIJXYJNOGSKCW-UHFFFAOYSA-N	445.284	1.461	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)c2cn3c(Cl)cccc3n2)C1	1843662482	HSJVWQRFCJVPDH-UHFFFAOYSA-N	432.912	1.178	50	20	IDGD	
Cc1c(C(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)oc2ccccc12	1843686267	MQXGUAPWVSHEFK-UHFFFAOYSA-N	433.468	1.871	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1ccc3ncccc3c1)C2	1844264199	SALHDDVKBLKIBO-UHFFFAOYSA-N	430.468	1.364	50	20	IDGD	
COC(=O)c1ccc(CC(=O)N2CCCC23CN(C(=O)[C@H](F)Br)C3)cc1	1846476469	WWMNPZABQXTBIA-HNNXBMFYSA-N	427.270	1.910	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H](C(=O)N2CCCC23CN(C(=O)[C@@H](O)CCl)C3)C[C@H]2C[C@H]21	1847079985	VTWFTRZPIVGCKY-KBXIAJHMSA-N	427.929	1.187	50	20	IDGD	
O=C(c1ccc(F)cc1)N1CCC[C@H]1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl	1847518637	JICJIJPITZMQMA-XLAORIBOSA-N	437.899	1.232	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H]1CC(=O)N(C2CCCC2)C1	1848045874	ZISSQANEECTVCQ-SDADXPQNSA-N	426.355	1.763	50	20	IDGD	
Cc1nn(-c2ccccc2)c(C)c1C(=O)C(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	17193448	CVNZJOZZNRJHTB-UHFFFAOYSA-N	444.451	1.380	50	20	IDGD	
O=C(CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)NNC(=O)Cn1cnc2ccccc21	17405241	DUUIFINHFSXIIW-UHFFFAOYSA-N	438.400	1.480	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)c2ccc3c(c2)SC2=NS(=O)(=O)CCN23)c1	17849444	PPCRCEPRTMNRKS-UHFFFAOYSA-N	446.510	1.447	50	20	IDGD	
O=C(NNC(=S)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1)Nc1ccccc1	18171954	LGXPIERZXYSMAN-UHFFFAOYSA-N	435.531	1.731	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)CNC(=O)Cc2cccc3ccccc23)C[C@H](C)O1	38688497	FZHCFRNGXQWXLP-IRXDYDNUSA-N	426.517	1.145	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C2CCN(c3ccc4nncn4n3)CC2)o1	109420301	FYPSDSGYTSJSHQ-UHFFFAOYSA-N	440.508	1.237	50	20	IDGD	
COc1cccc2c1OCC(C(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)=C2	725978234	HWOUXBTYYYEUDW-UHFFFAOYSA-N	427.369	1.384	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)COc1ccccc1F)c1cccc(S(=O)(=O)N(C)C)c1	727609107	GROLJPSKELJKTE-CYBMUJFWSA-N	438.481	1.546	50	20	IDGD	
CN(C)CC(=O)NNC(=O)c1cc(S(=O)(=O)N(C)c2ccc(F)cc2)ccc1Cl	727761467	GZPAWBSXHLALPJ-UHFFFAOYSA-N	442.900	1.627	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)[C@H]1CCCN(Cc2cccnc2)C1	728211024	DNTUFDRSZSITIS-KRWDZBQOSA-N	429.546	1.878	50	20	IDGD	
Cc1cc(C)n([C@H](C)CC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)n1	728216089	PXUPNCOVQWFWHZ-QGZVFWFLSA-N	434.566	1.530	50	20	IDGD	
COc1cccc(C[C@H](C(=O)NNC(=O)COc2ccccc2OC)n2nnnc2C)c1	729297456	LKGLSHPODDJDCJ-QGZVFWFLSA-N	440.460	1.009	50	20	IDGD	
COCCOc1cn(-c2ccccc2)nc1C(=O)NNC(=O)c1nnc(O)c2ccccc12	729300330	OSVDJCRGSQTMEP-UHFFFAOYSA-N	448.439	1.621	50	20	IDGD	
Cc1cccc(N2C(=O)N[C@@H](CCC(=O)NNC(=O)[C@@H](C)Oc3ccccc3F)C2=O)c1	730739271	BSXZCFYIVIXZAV-PBHICJAKSA-N	442.447	1.954	50	20	IDGD	
Cc1c(C(=O)NNC(=O)COc2ccccc2O)nnn1-c1ccc(OC(F)F)cc1	731193852	GHSFPIOKICHELQ-UHFFFAOYSA-N	433.371	1.723	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)N1CCN([C@@H](C)c2nc(-c3ccccc3)no2)CC1	731848302	HTQXZNHDPUUAOD-IRXDYDNUSA-N	428.537	1.997	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)c2sccc2S(=O)(=O)N(C)C)o1	732062704	WAGXNCDGLFBAOE-UHFFFAOYSA-N	428.536	1.508	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NCC2CCN(S(=O)(=O)C(F)F)CC2)cc1C	733042267	MZHHWBXIAHZZRN-UHFFFAOYSA-N	448.492	1.277	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)Cc3ccncc3)c2)cc1	741144664	YTBCWQDGQGDRJG-UHFFFAOYSA-N	440.481	1.895	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N[C@@H](C)[C@@H]2CN(Cc3ccccc3)CCO2)cc1OC	741270071	OPXGCOXQGSFTJT-KKSFZXQISA-N	442.516	1.937	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2nccnc2NC(=O)C(C)(C)C)c2ccccc2c1=O	742474880	ZSEDROZTKBPFBS-UHFFFAOYSA-N	437.460	1.266	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)CN2C(=O)[C@@H]3CCCC[C@H]3C2=O)cc1Cl	743834666	OWHJFIBRTHESDJ-GHMZBOCLSA-N	438.868	1.685	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)c2ccc(S(=O)(=O)NC3CC3)cc2)c1	744517639	ROMIHXGVCGASKG-UHFFFAOYSA-N	431.470	1.054	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)[C@H]2CCN(c3cccc(Cl)c3)C2=O)c1	745433389	RJPXUDVDHVAKBB-KRWDZBQOSA-N	440.843	1.569	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)N[C@H]2CCCN(c3ccn(C)n3)C2=O)c1	745884627	ZJXVFNALYQQFFO-KRWDZBQOSA-N	442.520	1.757	50	20	IDGD	
CCOC(=O)[C@@H](NCC(=O)NNC(=O)c1cc(Cl)ccc1OC)c1cccc(O)c1	746494086	HVBFEUOAKHFOTB-SFHVURJKSA-N	435.864	1.709	50	20	IDGD	
CS(=O)(=O)Cc1c(C(=O)NNC(=O)Cc2cn3ccccc3n2)oc2ccccc12	746545802	WOVOHDXXWCUZSK-UHFFFAOYSA-N	426.454	1.629	50	20	IDGD	
COc1ccc(Br)c(S(=O)(=O)NNC(=O)COc2ccccc2O)c1	747267488	FEADADGHNLYHKI-UHFFFAOYSA-N	431.264	1.552	50	20	IDGD	
COC(=O)c1ccc(S(=O)(=O)NNC(=O)c2ccc(Cl)nc2)c(Br)c1	747605915	FIKYIKRJGKEQLB-UHFFFAOYSA-N	448.682	1.907	50	20	IDGD	
COC[C@H](NC(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12)C1CC1	750447516	VBULAOPMZFWHPI-IBGZPJMESA-N	435.484	1.814	50	20	IDGD	
O=C(NNC(=O)c1cnc2n1CCCC2)c1cccc(S(=O)(=O)N2CCCCC2)c1	750715127	PRPJZQVAJUJZQN-UHFFFAOYSA-N	431.518	1.469	50	20	IDGD	
CC[C@H](CS(=O)(=O)c1ccccc1)NC(=O)NNC(=O)c1cc(Br)c[nH]1	752127734	RBILYHIDJFVOLA-GFCCVEGCSA-N	443.323	1.974	50	20	IDGD	
C[S@@](=O)c1ccc(CNC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1	753052083	SMTIVQZCHHJDDQ-WJOKGBTCSA-N	443.573	1.467	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)n([C@H]2CCS(=O)(=O)C2)n1	755538042	ZGCXJOPKDWFUEF-OCABNYQQSA-N	435.550	1.920	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)Nc1ccc(C(=O)N2CCOCC2)cc1	755932623	CBJJXPOSLRCTQE-CQSZACIVSA-N	430.436	1.918	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)Nc1ccc(S(=O)(=O)/N=C2\CCCCCN2C)cc1	756113209	IDCAZQIOCZJTSX-KOEQRZSOSA-N	447.521	1.778	50	20	IDGD	
COc1cc(C#N)ccc1Oc1ccc(NC(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)cc1	756297637	NHRZVBPOJSAPRB-CQSZACIVSA-N	444.469	1.947	50	20	IDGD	
COCc1nc2n(n1)C[C@H](NC(=O)NNC(=O)c1ccc(COc3ccccc3)o1)CC2	757795530	MQQGOEJSVMYQBC-CQSZACIVSA-N	440.460	1.556	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2cc(C)c3c[nH]nc3c2)cc1	757820459	ZGJXNPQEWNBUEN-UHFFFAOYSA-N	430.490	1.653	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1ccc(N2CCCCCCC2)c(F)c1	757994895	IUQSPKDGGHEUHM-ZDUSSCGKSA-N	429.518	1.687	50	20	IDGD	
Cc1oc(-c2cccc(C(F)(F)F)c2)nc1C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O	758030435	QGRXRFKXLLJEBC-QMMMGPOBSA-N	434.396	1.368	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=S)NC[C@H]1CCCCO1	758251329	JJGTUZNFWXXEET-QGZVFWFLSA-N	440.013	1.522	50	20	IDGD	
CCn1c(NNC(=O)[C@@](C)(O)CN2C(=O)C(C)(C)c3ccccc32)nc2ccccc2c1=O	760104997	SLPVEQPLNQOIEQ-DEOSSOPVSA-N	449.511	1.935	50	20	IDGD	
CCCCS(=O)(=O)N1CCC(C(=O)NNC(=O)CSc2ccccc2OC)CC1	762374751	XKRMALMBGRABKJ-UHFFFAOYSA-N	443.591	1.777	50	20	IDGD	
CCc1ncc(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N(CC)CC)c2)s1	763373881	MVVDJTUKFQAMRQ-UHFFFAOYSA-N	446.576	1.359	50	20	IDGD	
CCCCOC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1	763468296	WBSDJLIWQAMJFM-UHFFFAOYSA-N	428.401	1.951	50	20	IDGD	
C[S@](=O)Cc1ccccc1NC(=O)C(=O)NNC(=O)c1cc2ccccc2cc1O	763528860	UKEBJNJNFOXZGS-PMERELPUSA-N	425.466	1.824	50	20	IDGD	
COC(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)c2ccc(OC)c(OC)c2)c1	763542388	FATXHTSWWWRQQS-UHFFFAOYSA-N	435.820	1.544	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)Nc1ccc(OC(F)F)c(F)c1	763570565	FYAAEBDNIMYYQN-CQSZACIVSA-N	425.319	1.353	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cccc(C(=O)N3CCOCC3)c2C)c(C)o1	763576535	NNGPFUOSINMJGM-UHFFFAOYSA-N	428.445	1.077	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)n(-c2ccc(F)cc2)n1	763579023	SPFABEHYDYUVPL-KRWDZBQOSA-N	439.403	1.246	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cc(S(C)(=O)=O)ccc2F)c2ccccc2n1	763611409	NJKNIFXYDHVQEF-UHFFFAOYSA-N	444.444	1.486	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)c2c(C)nc3ccccn23)cc1Cl	763628226	HHGZCWGJPCRIJC-UHFFFAOYSA-N	445.863	1.721	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cc(NC(=O)C3CC3)ccc2C)cc1	763660587	CEMCVONOSLSVNR-UHFFFAOYSA-N	440.456	1.517	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)c1	763772220	OYXBNRYKIKDGLB-UHFFFAOYSA-N	436.346	1.994	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2cnn(-c3ccccc3Cl)c2)c1	763774869	IAJNTFYMCMFXCS-UHFFFAOYSA-N	443.847	1.943	50	20	IDGD	
Cc1nc(N2CCOCC2)ccc1NC(=O)C(=O)NNC(=O)c1cc2c(s1)CCC2	763784325	VNBGFFNNNOYAKP-UHFFFAOYSA-N	429.502	1.177	50	20	IDGD	
CCOCc1cccc(NC(=O)C(=O)NNC(=O)c2nn(CC)c(=O)c3ccccc23)c1	763786342	MFABPFOLAFQDIT-UHFFFAOYSA-N	437.456	1.353	50	20	IDGD	
Cc1nc2ccc(NC(=O)C(=O)NNC(=O)COc3ccccc3[N+](=O)[O-])cc2s1	763806143	ZWXMZEATUFKFBE-UHFFFAOYSA-N	429.414	1.678	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(OC[C@@H]3CCCO3)c2)cc1	763809768	PARMTEHXJZKHSN-IBGZPJMESA-N	427.457	1.718	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc([C@H](C)N3CCOCC3)cc2)cc1	763820835	JUQRQNOXCFYJBM-KRWDZBQOSA-N	440.500	1.553	50	20	IDGD	
Cc1cnc(O)n1-c1ccccc1NC(=O)C(=O)NNC(=O)Cc1c[nH]c2ccccc12	763865291	NPFWELAJAHYYKQ-UHFFFAOYSA-N	432.440	1.696	50	20	IDGD	
COC(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(C(C)=O)cc2)cc1	763873736	YIZODHWMBXJMFJ-CQSZACIVSA-N	441.440	1.158	50	20	IDGD	
CCSCc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c1	763916583	GWTILGZSTMNVMN-UHFFFAOYSA-N	425.474	1.315	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)OCCO3)ccc1OC(C)C	763916918	YJWUJOYAQBQHIW-UHFFFAOYSA-N	429.429	1.653	50	20	IDGD	
CCOC(=O)C(C)(C)n1cc(NC(=O)C(=O)NNC(=O)Cc2ccc(Cl)cc2)cn1	763937252	ZTLUJAPHJRNHSH-UHFFFAOYSA-N	435.868	1.163	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3ccc(OCCC(N)=O)cc3)cc2C1	763938128	ANADMMUNOKZBDQ-LBPRGKRZSA-N	444.513	1.527	50	20	IDGD	
COC(=O)Cc1ccccc1NC(=O)C(=O)NNC(=O)c1cc2c(s1)CC[C@@H](C)C2	763942419	MWLLBLDHIQOWOB-GFCCVEGCSA-N	429.498	1.988	50	20	IDGD	
Cc1ccc(Oc2ccccc2)c(NC(=O)C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)c1	763998251	NVCPYNKDRXZJAO-CQSZACIVSA-N	431.470	1.308	50	20	IDGD	
C[C@@H](C(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)Cc2ccsc2)c1)n1cccn1	764024434	GUCNOGRFTUEHSK-ZDUSSCGKSA-N	440.485	1.473	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1cccc(S(=O)(=O)NC(C)(C)C)c1	764042397	IIXDLTUWAPKAFG-UHFFFAOYSA-N	448.501	1.172	50	20	IDGD	
O=C(NNC(=O)c1cccc(Br)c1)C(=O)Nc1ccnn1-c1ccncc1	764058932	KTAFMHXWIGIRGJ-UHFFFAOYSA-N	429.234	1.430	50	20	IDGD	
COCCOc1ccc(C(F)(F)F)cc1NC(=O)C(=O)NNC(=O)c1cc(C)[nH]n1	764108253	FUPXNAIWVKEZAQ-UHFFFAOYSA-N	429.355	1.162	50	20	IDGD	
CCCCNS(=O)(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2ccc(C#N)cc2)c1	764176852	HVHQCBZJSIEJFX-UHFFFAOYSA-N	443.485	1.036	50	20	IDGD	
COCC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(OC(F)F)c2)cc1	764260155	QURICSNDXBMPSA-UHFFFAOYSA-N	436.371	1.273	50	20	IDGD	
COCCOc1cc(NC(=O)C(=O)NNC(=O)c2cc3ccccc3o2)ccc1OC	764330410	BPNWXFHSJOJOIG-UHFFFAOYSA-N	427.413	1.866	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)c1	764333476	VGVUMKSRSMJOPW-UHFFFAOYSA-N	438.456	1.864	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N(CC)CC)cc1NC(=O)C(=O)NNC(=O)C1CCC1	764334690	JEXOZKYWEOGYJL-UHFFFAOYSA-N	440.522	1.002	50	20	IDGD	
C[C@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(NC(=O)C(=O)NNC(=O)C3CCC3)cc2)C1	764340997	BYEIEKBTVBZHPY-OKILXGFUSA-N	436.534	1.239	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@@H](C(=O)NNC(=O)CNC(=O)c1cccnc1)c1ccccc1	764343445	UQQWGODEWYERPO-QGZVFWFLSA-N	441.488	1.267	50	20	IDGD	
CCN1CCN(c2ccc(Cl)cc2NC(=O)C(=O)NNC(=O)Cc2ccncc2)CC1	764353957	NRANQZWJJQREOJ-UHFFFAOYSA-N	444.923	1.206	50	20	IDGD	
CC(C)OC(=O)c1c(NC(=O)C(=O)NNC(=O)c2cnn(C)c2)sc2c1CC[C@@H](C)C2	764358452	DWMOYHRJLQDURH-LLVKDONJSA-N	447.517	1.571	50	20	IDGD	
CN1CCc2ccc(NC(=O)C(=O)NNC(=O)c3cc(-c4cccs4)[nH]n3)cc2C1=O	764381838	AJYXBPPJFXKDMG-UHFFFAOYSA-N	438.469	1.166	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)ccc1C(=O)N(C)C	764394567	RJAXTOUQVZXMPU-UHFFFAOYSA-N	430.486	1.281	50	20	IDGD	
CSCCCNC(=S)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	764519863	ZSRZKSONRFTTQS-UHFFFAOYSA-N	430.043	1.706	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1ccc([N+](=O)[O-])c2cccnc12	765531067	MWKQZPVTIJNBRL-UHFFFAOYSA-N	442.457	1.819	50	20	IDGD	
COc1ccc(S(=O)(=O)C[C@@H](C)C(=O)NNc2ccccc2S(C)(=O)=O)cc1	766670965	XSHWRPVLXGVKNG-CYBMUJFWSA-N	426.516	1.652	50	20	IDGD	
C#Cc1cccc(NC(=S)NNC(=O)c2nccc3c(S(N)(=O)=O)cccc23)c1	768479329	QSUIBAAMGCIVAR-UHFFFAOYSA-N	425.495	1.495	50	20	IDGD	
O=C(NNC(=S)Nc1ccccn1)[C@@H]1CCCN(S(=O)(=O)c2ccc(F)cc2)C1	768585890	VMVQLRFYHAVUIC-CYBMUJFWSA-N	437.522	1.639	50	20	IDGD	
CCc1ccc(C(=O)NNc2c(OC)cccc2S(C)(=O)=O)cc1S(C)(=O)=O	768635076	VAVTUTLNKYLHPZ-UHFFFAOYSA-N	426.516	1.822	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)[C@@H]1CSCN1C(=O)CC(C)(C)C	768639747	VIQNWJLZYSFNQU-LBPRGKRZSA-N	429.564	1.880	50	20	IDGD	
CCOc1ccc(NC(=S)NNC(=O)[C@@H](C)NS(=O)(=O)c2cccs2)cc1	770956641	ZQILMACUMJISQL-LLVKDONJSA-N	428.561	1.831	50	20	IDGD	
CCOC(=O)N1[C@@H](C(=O)NNc2nc(O)c3cnn(C)c3n2)CC[C@@H]1c1ccc(C)o1	770982974	KGGZNYQYLGWOQC-CHWSQXEVSA-N	429.437	1.776	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1	772131822	IYDOTJBJSDUXLM-VXGBXAGGSA-N	440.478	1.386	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)c1ccc(CN2CCCCC2=O)cc1	772187784	FDIIUPITOHABLZ-UHFFFAOYSA-N	442.903	1.930	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1	772194913	FGUONCRXOWMIKE-UHFFFAOYSA-N	442.819	1.511	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NNC(=O)c2ccc(C(=O)NC3CC3)cc2)C1	773415890	ASIIUTHCTFQXBI-MRXNPFEDSA-N	430.505	1.987	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)c(OC)c1	774010224	WOWWYPKGLIXPFB-LLVKDONJSA-N	449.847	1.689	50	20	IDGD	
O=C(NNc1cnc2ccccc2n1)c1ccc2c(c1)SC1=NS(=O)(=O)CCN12	774769411	KVPHQNUYUOGGSR-UHFFFAOYSA-N	426.483	1.998	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2ccc(O)c(Cl)c2)nc1	776062751	JMXLWHSDSBLZKY-UHFFFAOYSA-N	441.897	1.984	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(F)c(C(=O)NNc2cccc(S(C)(=O)=O)c2)c1	776720837	ITKPSTREUJMDIL-UHFFFAOYSA-N	429.495	1.673	50	20	IDGD	
CCOC(=O)N1CCC[C@@H]([C@@H](C)NC(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)C1	777263867	BPHHTVKDXZQBTH-HZPDHXFCSA-N	433.509	1.829	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)[C@]1(F)CCN(C(=O)OCc2ccccc2)C1	777390946	DLTMTNYYBZYSFQ-NRFANRHFSA-N	431.420	1.669	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)CCC(=O)N2CCN(c3ccccc3)CC2)nc1C	778425128	LPNUSYOBBDXEHS-UHFFFAOYSA-N	440.504	1.534	50	20	IDGD	
CC(C)n1cc2cc(NC(=O)C(=O)NNC(=O)Cc3nc4ccccc4n3C)ccc2n1	782895291	ZRXXVTRSLKMMIG-UHFFFAOYSA-N	433.472	1.833	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)C(=O)Nc1cccc2c1ccn2C	782895852	AEEOYGGUYHQYBN-UHFFFAOYSA-N	442.501	1.180	50	20	IDGD	
CCCOc1cc(C)ccc1NC(=O)C(=O)NNC(=O)c1csc(N2CCOCC2)n1	782896345	GFAPKTHZAOHZEM-UHFFFAOYSA-N	447.517	1.477	50	20	IDGD	
O=C(NNc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1ccc(CN2C(=O)CNC2=O)cc1	783291757	UVZUZFTXZFPOBY-UHFFFAOYSA-N	446.807	1.382	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)(F)F)cc1)C(=O)Nc1ccc2[nH]ncc2c1	783409864	YIIXXNXXWFMBJK-UHFFFAOYSA-N	427.364	1.938	50	20	IDGD	
O=C(NNc1ccc(OC(F)F)cc1)C(=O)Nc1ccc(C(=O)N2CCOCC2)cc1	784308243	MPACJYPVBCDOMT-UHFFFAOYSA-N	434.399	1.842	50	20	IDGD	
O=C(NNc1ccc(F)cc1)C(=O)Nc1ccc(N2CCOCC2)cc1N1CCOCC1	784783298	XZKFFMHGSUVTTE-UHFFFAOYSA-N	443.479	1.581	50	20	IDGD	
CS(=O)(=O)c1cccc(NC(=O)C(=O)NNc2nc(-c3ccc(Cl)cc3)no2)c1	784795785	VCVOZDBIRBKSHD-UHFFFAOYSA-N	435.849	1.875	50	20	IDGD	
C[C@H]1[C@@H](C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)CCN1C(=O)OC(C)(C)C	786368509	LYIZIPRSMAOVFR-BBRMVZONSA-N	430.461	1.508	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1OC(C)C	787541470	SLYRVCICBWGQPQ-UHFFFAOYSA-N	437.456	1.429	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)C(=O)NCC3CC3)c2)c(C)c1	788492913	QBUUZFCTVILOSI-UHFFFAOYSA-N	444.513	1.391	50	20	IDGD	
CSCC[C@H](O)C(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	788626166	VUHSZZRHWSWKGB-KRWDZBQOSA-N	437.543	1.040	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)c(OC(C)C)c1	788672031	QNGAFBPEVXTHSA-UHFFFAOYSA-N	449.529	1.873	50	20	IDGD	
COc1cc(NNC(=O)C(=O)Nc2ccc(C[C@H]3CC(=O)NC3=O)cc2)ccc1Cl	789795911	ITKKCIGMRFZTNJ-LBPRGKRZSA-N	430.848	1.636	50	20	IDGD	
CS(=O)(=O)C1(C(=O)NNC(=O)[C@H]2Cc3ccccc3CN2Cc2ccccc2)CC1	792113830	HYVFWTUJLAHKRX-LJQANCHMSA-N	427.526	1.338	50	20	IDGD	
Cc1cccnc1NNC(=O)C(=O)Nc1ncn(Cc2cccc(Br)c2)n1	792375372	IWHJFQVWQLEVSL-UHFFFAOYSA-N	430.266	1.874	50	20	IDGD	
C[C@@H]1C(=O)CC[C@H]1CC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	792789621	LWNOWWJOZWNVKB-RDJZCZTQSA-N	443.525	1.931	50	20	IDGD	
C[C@@]1(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)CCN(C(=O)OCc2ccccc2)C1	792821333	DQZZKZYEFRJIQO-JOCHJYFZSA-N	449.471	1.472	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(F)cc2-c2cnn(C)c2)cc1	796991041	YZOJTLUEHAQYOD-UHFFFAOYSA-N	425.420	1.700	50	20	IDGD	
CCN1CCC[C@H]1CN1C[C@@H](C(=O)NNC(=O)Nc2ccc(OC(F)F)cc2)CC1=O	802043594	IDZQZYWOLNDUGF-ZFWWWQNUSA-N	439.463	1.774	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)CN2C(=O)N[C@](C)(C3CC3)C2=O)c(OC)cc1Cl	802081721	ZPBJUBKGXSFNCF-GOSISDBHSA-N	439.856	1.230	50	20	IDGD	
CNC(=O)c1cccc(NC(=O)NNC(=O)COc2ccccc2C#N)c1Br	806731894	IHBYDQRNESJZLB-UHFFFAOYSA-N	446.261	1.912	50	20	IDGD	
COCc1cnc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)NC(C)(C)C)s1	806968229	COQMHOCJTMKJQF-UHFFFAOYSA-N	441.535	1.448	50	20	IDGD	
CN1CCN(C(=O)NNC(=O)c2nnn(-c3cccc(C(F)(F)F)c3)c2C2CC2)CC1	807380134	PSACOVWIVIKJSO-UHFFFAOYSA-N	437.426	1.765	50	20	IDGD	
CC(C)(C)OC(=O)N1CCc2ccccc2[C@@H]1CNC(=O)NNC(=O)C(=O)N1CCCC1	807436415	GAMWNIQYGPBRGX-KRWDZBQOSA-N	445.520	1.474	50	20	IDGD	
CCS(=O)(=O)N1CCC([C@@H](C)N(C)C(=O)NNC(=O)COCc2ccccc2)CC1	808275372	UOWSOYYJYJHUAL-MRXNPFEDSA-N	440.566	1.326	50	20	IDGD	
N#Cc1cccc(S(=O)(=O)NCC(=O)NNc2ccc(OCC(F)(F)F)cc2)c1	810685847	ALMNMYABJNOAJB-UHFFFAOYSA-N	428.392	1.921	50	20	IDGD	
COC(=O)Cc1cc(Br)ccc1S(=O)(=O)NNC(=O)c1cccn1C	811680876	YGWYATQGRGHXDY-UHFFFAOYSA-N	430.280	1.126	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)COc1ccccc1O)c1ccc(N2CCCNC2=O)cc1	812945106	RUAOZDDJWYVPTJ-CQSZACIVSA-N	427.461	1.782	50	20	IDGD	
Cn1ncc2ccc(CNC(=O)NNC(=O)CCN3CCN(c4ccccc4)CC3)cc21	813176464	WBZOOMXVAZMETI-UHFFFAOYSA-N	435.532	1.616	50	20	IDGD	
C[C@](O)(C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1)c1ccc(Cl)cc1	815498644	KHOCTSSEPQGIOP-OXJNMPFZSA-N	434.832	1.078	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc2cccnc12	815569712	FCBFWPAQGVPIQV-UHFFFAOYSA-N	430.424	1.829	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)/C(=C/c1ccc(F)cc1)n1nnnc1C	818023801	QMXDGHMENMZNLA-WJDWOHSUSA-N	426.408	1.354	50	20	IDGD	
O=C(CNc1ccccc1)NNC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(F)cc2)C1	823328214	ROBFFKCOLMUBLD-HNNXBMFYSA-N	434.493	1.486	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2CCCCN2S(=O)(=O)c2ccccc2)cc1	837302173	VJFMZTTVXOLWPZ-SFHVURJKSA-N	444.513	1.324	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)[C@@H]1CCCCN1S(=O)(=O)c1ccccc1	859440153	GJKHMQJRQOPZCI-QFBILLFUSA-N	445.497	1.217	50	20	IDGD	
CCCn1nc(C(=O)NNS(=O)(=O)N2CCc3ccccc3C2)c2ccccc2c1=O	912947390	RDVPFQFBEZUQAM-UHFFFAOYSA-N	441.513	1.344	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2cccc(Cl)c2)cc1	913509835	WBXUKVUGSAEIRD-UHFFFAOYSA-N	439.877	1.256	50	20	IDGD	
C[C@H](Oc1ccccc1Cl)C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	913628106	WFSDCJRXGVLKFG-LBPRGKRZSA-N	425.894	1.819	50	20	IDGD	
O=C(COC(=O)c1cccc(S(=O)(=O)NCC2CC2)c1)NNC(=O)c1cccs1	914676507	QCTHPYHJCJKJTM-UHFFFAOYSA-N	437.499	1.054	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)NC[C@H](c1cccs1)N1CCOCC1	915893709	PFITXGHAESKYOE-MRXNPFEDSA-N	429.502	1.402	50	20	IDGD	
CN1CCN([C@@H](CNC(=O)NNC(=O)COc2ccccc2F)c2cccs2)CC1	915901525	JHTYWBBFJPRPBA-INIZCTEOSA-N	435.525	1.585	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)c1nc2ccccc2[nH]1	915926579	GABGZGQBDMSCCO-GFCCVEGCSA-N	430.490	1.518	50	20	IDGD	
CNS(=O)(=O)Cc1ccc(CNC(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)cc1	916228654	MLPBQROOCCDEJV-UHFFFAOYSA-N	434.562	1.783	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NCCCN2CCN(Cc3ccccc3)CC2)cc1	916485574	BRKJPOXIYGRIJW-UHFFFAOYSA-N	439.560	1.912	50	20	IDGD	
CCn1c(NNC(=O)[C@H](Cc2cccc(OC)c2)n2nnnc2C)nc2ccccc2c1=O	918017331	STVKPHGDGRSYTO-IBGZPJMESA-N	448.487	1.647	50	20	IDGD	
COCCOc1ccccc1C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	919691840	BHONDFXFDIIIIA-UHFFFAOYSA-N	447.513	1.571	50	20	IDGD	
O=C(CNC(=O)NNC(=O)c1nn(-c2ccccc2)cc1O)Nc1ccc(Cl)cc1	919782997	HDNBVLIQQKVIFU-UHFFFAOYSA-N	428.836	1.814	50	20	IDGD	
CCCS(=O)(=O)N1CCCC[C@@H]1C(=O)NNC(=O)c1cc(-c2ccc(C)cc2)[nH]n1	919815592	PBYFPZJNCRUYJZ-GOSISDBHSA-N	433.534	1.740	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)[C@H]2CCCN2C(=O)/C=C/c2ccc(C(N)=O)cc2)cc1	920023252	YMBYYNOFTCXRCO-CBHXRGPZSA-N	434.496	1.813	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)c1cc(OC)c(OC)cc1[N+](=O)[O-]	920497486	MNPMXBBIASUOQE-UHFFFAOYSA-N	427.417	1.985	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)c1ccccc1F)C(=O)NNC(=O)NCc1ccco1	920856394	FQCQYAGBGIMCHT-CQSZACIVSA-N	444.510	1.349	50	20	IDGD	
CCNC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cc(C)cc([N+](=O)[O-])c1C	920858220	RCHYDWZLXDPAGX-UHFFFAOYSA-N	435.462	1.976	50	20	IDGD	
Cc1cc(N2CCN(C)CC2)ccc1NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	920931850	FYZOTZOKIBKWSB-UHFFFAOYSA-N	435.492	1.189	50	20	IDGD	
CCCNC(=O)NNC(=O)c1cc(C2CC2)nc2c1c(C)nn2[C@@H]1CCS(=O)(=O)C1	921042175	DCGHPTYIULDLGF-CYBMUJFWSA-N	434.522	1.331	50	20	IDGD	
CC(C)c1nn([C@@H]2CCS(=O)(=O)C2)cc1C(=O)NNc1ccc(C(F)(F)F)nn1	1118096153	KOCWYHWUANDSBQ-SNVBAGLBSA-N	432.428	1.932	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(/C#N)C(=O)N2CCS(=O)(=O)C[C@@H]2C(=O)OC)c1C	1121236917	GECAJNZTNAPZRX-SJJURFEFSA-N	437.518	1.018	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)c3cc(=O)c4cc(Br)ccc4[nH]3)nc21	1319292254	QCCRSPRBAXGQGB-UHFFFAOYSA-N	430.222	1.430	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)CNS(=O)(=O)c3ccccc3)n[nH]2)cc1C	1323919269	OSFJADMBVYDTJK-UHFFFAOYSA-N	427.486	1.433	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CN2CCC(CN3C(=O)c4ccccc4C3=O)CC2)c1	1334842948	ADDVNTWUEXZXTD-UHFFFAOYSA-N	445.479	1.327	50	20	IDGD	
CC[S@@](=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Br)C2	1779219948	FQLOYANWPHIEPG-BBDQLSLDSA-N	441.363	1.350	50	20	IDGD	
COc1cncc(CCC(=O)N2CCO[C@@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)c1	1779294583	UGJPDBIHYLNCKY-OAQYLSRUSA-N	435.597	1.704	50	20	IDGD	
O=C(OCCO)c1ccccc1C(=O)N1CC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1780158550	YYAMTOYINHUOHN-LJQANCHMSA-N	445.299	1.083	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cn(C(C)(C)C)nn3)C2)C1	1780357543	NBPHYCCKRODGBN-ACJLOTCBSA-N	442.358	1.650	50	20	IDGD	
COc1cc(CCC(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)ccn1	1781326756	SVAOJJYGLOGJNF-AEFFLSMTSA-N	444.301	1.543	50	20	IDGD	
Cc1cccc(Cl)c1C(=O)N1CC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1	1781727279	SOLHHBJAYSWKKP-OAQYLSRUSA-N	436.940	1.465	50	20	IDGD	
CCC[C@@H](NC(C)=O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)Br)C1	1782001237	CBCTVFCIVFJMMH-GKDNMFGBSA-N	446.386	1.589	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CC(=O)OC(C)(C)C)C2	1782172049	MFOINLJRBPLMHN-BXTJHSDWSA-N	432.945	1.486	50	20	IDGD	
O=C(O)CSCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Br)C2	1782224040	YKAVMDOZRBKSJV-RIEGTJTDSA-N	441.319	1.009	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(Cl)Cl)C2)[C@H]1CCc2nc[nH]c2C1	1782459300	FSPGURXKOUGLCW-IOHHAYIISA-N	429.348	1.832	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1782861050	GGNLMTQFFUJPSP-AZDFAVSGSA-N	439.846	1.301	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)C1(c3ccccc3F)CC1)CCO2	1783939980	PQFFSRDNRRXKAS-QFIPXVFZSA-N	446.523	1.060	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C3(c4ccc(Cl)cc4)CC3)C[C@@H]21)[C@@H](O)CCl	1784094914	VAZBSLFSONYRJE-MGHWNKPDSA-N	441.355	1.951	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3cn[nH]c3)[C@H]2C1	1785281159	ZYNDKMDIFINRCT-JONQDZQNSA-N	427.343	1.496	50	20	IDGD	
CCOC(=O)C(C)(C)C(=O)N1CC[C@]2(CN(C(=O)[C@@H](C)CBr)CCO2)C1	1785517317	HTQFNBBHWZOTKC-UGSOOPFHSA-N	433.343	1.437	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)C3(NC(=O)OC(C)(C)C)CC3)C2)C1	1785711542	FWXMHALZGZQCJR-LIRRHRJNSA-N	429.945	1.891	50	20	IDGD	
COc1ccc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]3C2)c([N+](=O)[O-])c1	1787448989	JRAVHXZBCYGWRD-GKEYINFOSA-N	443.859	1.660	50	20	IDGD	
CC(=O)O[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CO[Si](C)(C)C)C[C@@H]21)C(C)C	1788477769	BTDTYBKVGBLMJE-LSTDLKDCSA-N	428.602	1.405	50	20	IDGD	
Cc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Br)C[C@@H]32)c(O)c1	1791926975	YEJIBNSYECMVKH-DLKVLKDVSA-N	429.286	1.984	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/c1cccc(C(F)(F)F)c1)C2)[C@@H](O)CCl	1792975788	XMBVTSHKRNSLFX-VIAGFTJPSA-N	446.853	1.908	50	20	IDGD	
Cc1snc2sc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@H](O)CCl)cc12	1792976718	KYVIIOMSFXTKKW-IQOUGMIPSA-N	429.951	1.469	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCl)c1ccc([N+](=O)[O-])c2c1OCO2	1793113431	JIRMKGYPRJRXLX-FBKDDSFISA-N	425.825	1.175	50	20	IDGD	
Cc1cncc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)CBr)C3)c1	1794073120	MCKWJSOSGRXPPR-RMRDIRSESA-N	438.366	1.943	50	20	IDGD	
Cc1csc(CCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)c1	1796188220	CGLKLQWJYWHDKU-REPLKXPHSA-N	426.347	1.621	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1scnc1C)C2	1796889842	LHOFTBNETOYRBE-NGYDUSEUSA-N	428.518	1.837	50	20	IDGD	
C[C@H](Nc1ccccn1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)CBr)C2	1797972085	XEZVWDIFJVUVDQ-JGFGOLAASA-N	439.354	1.503	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1nc3ccccc3[nH]1)C2	1798440119	BKKUVZJMFHNASY-BTTYYORXSA-N	433.472	1.127	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1onc3ccccc13)C2	1798443225	ZORINNDDVGYSJP-BTTYYORXSA-N	434.456	1.392	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CC1CCC1)C2	1798525870	NMJHDXYDANEFKO-VPTLXERWSA-N	445.472	1.914	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1noc3c1CCCC3)C2	1799274792	IBHYWSOQVWVWJZ-RHQBZFHZSA-N	430.332	1.993	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@](C)(Cl)CCl	1799278603	PQZOFWAMSXLCRH-LZMFIQLBSA-N	447.359	1.568	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1Cc3ccccc3CN1)C2	1800758390	YGHZLLOGVKRVGA-UWLPGLTFSA-N	436.350	1.074	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccn(-c3ccccc3)n1)C2	1800760381	MQNFROZCQQKEMV-ZXFNITATSA-N	447.333	1.859	50	20	IDGD	
CC[C@@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](COC(C)=O)OC(C)=O)C2	1801801293	CZERGPPLGHBPBX-JKJDWNRSSA-N	447.326	1.293	50	20	IDGD	
C[C@@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](O)CNC(=O)OC(C)(C)C)C2	1801959428	TVTFBPVYHQVLJD-RGDJUOJXSA-N	448.358	1.294	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)COCCOCCOCCOC	1802097182	WWEBFLGNHGIVSN-RDGPPVDQSA-N	448.988	1.728	50	20	IDGD	
C[C@@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCC(=O)NN(C)C)[S@@](=O)c1ccccc1	1802338010	HATPZBXKVFVVEH-UXJCKXGJSA-N	448.589	1.194	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cn3ccccc3n2)[C@@H]1c1cccnc1)[C@H](O)CCl	1803138930	HXKHVQJVNHZWPB-KVSKMBFKSA-N	427.892	1.649	50	20	IDGD	
CC1(C)CC(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)C1	1807363785	BPIKKJJQZQBVKS-RXVVDRJESA-N	435.333	1.517	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)c1ccc2c(c1)OCO2	1808981089	DXULSJVLOCAIMO-TXPKVOOTSA-N	431.876	1.730	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2cc(OC)nn2C)[C@H]1c1cccnc1	1813029566	PSIUDOJOGNXYRB-VKJFTORMSA-N	435.912	1.397	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)C(F)(F)C(F)F)[C@H]1c1cccnc1	1813068426	MLGMWZPAXFDFDJ-CJNGLKHVSA-N	447.433	1.361	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2cscn2)[C@@H]1c1cccnc1	1813071229	QRFMLENYKIMJJH-HNAYVOBHSA-N	430.534	1.231	50	20	IDGD	
O=C(CNC(=O)C(F)(F)F)NC[C@@H]1CCN(C(=O)C(Cl)Cl)[C@@H]1c1cccnc1	1813100920	KAFSQYWXMPTXAQ-CMPLNLGQSA-N	441.237	1.570	50	20	IDGD	
COC(=O)NCC(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)Br)[C@@H]1c1cccnc1	1813268932	MALJLCBRRIVUFN-OSAQELSMSA-N	427.299	1.227	50	20	IDGD	
N#CC1(C(=O)NC[C@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)CCC1	1814052105	NQNVYODRJQKZRG-APWZRJJASA-N	447.499	1.094	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)CN3CCOCC3)sc2C1	1814572311	KMDYSRZRYRUIRI-NEPJUHHUSA-N	445.383	1.561	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H]1CCC(F)(F)C1)CC2)c1cccc(B(O)O)c1	1815347899	VXOUNGUSEMGQEK-TZMCWYRMSA-N	449.288	1.484	50	20	IDGD	
Cc1occc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1816436538	VODJOPDXVMEBFH-QGZVFWFLSA-N	437.460	1.929	50	20	IDGD	
COC[C@H](C)C(=O)N[C@H]1CCc2nc(NC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)sc2C1	1817275844	FTQCCJKRBIGUNB-VDGBYBFQSA-N	446.533	1.472	50	20	IDGD	
CC1=C(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cnccc4C(=O)NN)sc3C2)CCO1	1819797655	WQKGTJSBFPXIAE-LLVKDONJSA-N	442.501	1.062	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccnnc3O)sc2C1	1821093312	YYESRNYCRNFKPE-RKDXNWHRSA-N	440.323	1.896	50	20	IDGD	
C#CC(=O)N[C@H]1CCc2nc(NC(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)sc2C1	1821304762	RPUOMRCZFRHYIC-NSHDSACASA-N	428.426	1.836	50	20	IDGD	
C=CCC(F)(F)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1	1822416478	FETDGBGFKNZNRH-AWEZNQCLSA-N	426.468	1.986	50	20	IDGD	
O=C1C[C@H](C(=O)Nc2cc([C@@H]3CCCCN3C(=O)[C@H](F)Br)[nH]n2)CCN1	1822486273	VGGWEBYTHXJELP-PUYPPJJSSA-N	430.278	1.619	50	20	IDGD	
C[C@H](Cn1ccnc1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1	1822789292	OZVVFBOQDFSRQY-WBVHZDCISA-N	444.540	1.308	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)/C=C\C(=O)NC1CC1)CC2	1825642499	QOYOWIUBLOHVFO-BCVXMLFPSA-N	441.351	1.673	50	20	IDGD	
O=C(Cc1cccnc1)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827052840	JCBXJVVKHOQECY-JOCHJYFZSA-N	435.333	1.237	50	20	IDGD	
O=C(/C=C/c1cnc[nH]1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827055210	SFOSNSVUDLNHDW-SHBDEGQCSA-N	436.321	1.036	50	20	IDGD	
N#Cc1ccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)cc1	1827056061	AGFNFEPYHQNUGC-HSZRJFAPSA-N	445.328	1.785	50	20	IDGD	
N#CC1(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2cnccc2C(=O)NN)CC3)CCC1	1828012587	BKPFCYMMKVJPSN-LLVKDONJSA-N	439.501	1.061	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4cnccc4n3)C2)C1	1830362579	ZJZKMOLUIAJXON-QFIPXVFZSA-N	446.935	1.965	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc(OCC)cn3)C2)C1	1831644140	PQLJBHUGSAHPNG-YWZLYKJASA-N	440.928	1.353	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cn3cc(Cl)cn3)C2)C1	1831647106	QABZGYXAVIRKSU-MAUKXSAKSA-N	433.336	1.400	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4ccnn4c3)C2)C1	1831654033	PNKKQIQJTMTVML-RXVVDRJESA-N	434.924	1.812	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)C(=O)Nc2cccnc2)CC1	1831831178	PWYUGTHBMRDXKW-QZTJIDSGSA-N	436.940	1.894	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccn3c(O)nnc23)CC1	1831832711	HHTNUKYWHCAULD-DLBZAZTESA-N	449.939	1.922	50	20	IDGD	
COc1cc(C(=O)N2CCC([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)n(C)n1	1831871371	BOPDCKLYOFKBPQ-QGZVFWFLSA-N	448.568	1.035	50	20	IDGD	
C[C@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)C3CC(O)C3)CC2)CC1	1833264509	DDSYYWZCJVTREZ-TUBUQKNSSA-N	430.387	1.360	50	20	IDGD	
C[C@@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)C3=COCC3)CC2)CC1	1833266241	WZHPGXYLXDZDOI-AWEZNQCLSA-N	428.371	1.893	50	20	IDGD	
COc1nc(C)ccc1C(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)CCl)CC2)CC1	1833311799	FEJZDMGIDUQION-SFHVURJKSA-N	438.956	1.184	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)c3cocn3)CC2)CC1	1834306884	WMLVCLNZCOVCNB-ZDUSSCGKSA-N	427.343	1.891	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)c1n[nH]c2c1CCCC2	1835001282	YQHDXVCHSBQUAW-SFHVURJKSA-N	437.972	1.073	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C1(C(F)(F)F)CCC1)CCO2	1835473862	BDUPRBODUHGAIK-BBRMVZONSA-N	442.862	1.429	50	20	IDGD	
O=C(Cc1cccs1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1836091617	RHTOPSPHWRQJDA-HOCLYGCPSA-N	435.315	1.438	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnccc3F)CCO2)C1	1836319798	ZPKVWYKIGVXURC-KSSFIOAISA-N	444.301	1.464	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC(OC2CCN(C(=O)[C@H](C)NC=O)CC2)CC1	1836672918	GEROJIMRIGGQJZ-KGLIPLIRSA-N	432.359	1.151	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(OC2CCN(C(=O)[C@H](C)S)CC2)CC1	1838103192	NOXMNIORFWQWJQ-FVQJWRHTSA-N	449.577	1.437	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC(OC2CCN(C(=O)c3cc(CO)on3)CC2)CC1	1838430697	SMNMLVFDSWSTFR-UHFFFAOYSA-N	439.585	1.631	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C=C/c3ccccc3)C2)C1	1840032084	NJUNZLUEQXMUHC-KJOHCHSBSA-N	437.334	1.940	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(C)c3F)C2)C1	1840149769	ZPIHIEFYNHTOMT-OXQOHEQNSA-N	428.888	1.458	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3ccsc3)C2)C1	1840151419	AVSKNOSYXLBVQR-QFBILLFUSA-N	430.954	1.391	50	20	IDGD	
O=C([C@@H](O)CCl)N1CCOC[C@@]2(C1)CN(C(=O)C13CC(c4ccccc4)(C1)C3)CCO2	1840952461	HZSAVUQGGBFZGC-DVVHHAQGSA-N	448.947	1.164	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC12CN(C(=O)Cn1c(=O)n(C)c3ccccc31)C2	1841287498	RBZLYXGJQQSENM-AWEZNQCLSA-N	449.349	1.574	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC12CN(C(=O)[C@H]1CC(c3ccccc3)=NN1)C2	1841289384	XWIKDNAWKPEMQZ-WMLDXEAASA-N	433.350	1.987	50	20	IDGD	
COc1ccc(C(=O)N2CCCC23CN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C3)s1	1842195935	HULFJCLJHKKEDS-LPYMAVHISA-N	429.502	1.708	50	20	IDGD	
O=C(COc1cccc2ccccc12)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843010621	LVRRTDWPWAWRNB-UHFFFAOYSA-N	444.296	1.416	50	20	IDGD	
COC(=O)CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)[C@@H](F)Cl)C1	1843365450	RBHMIEUHXDBAOB-GXTWGEPZSA-N	449.907	1.571	50	20	IDGD	
COc1cc(C(=O)N2CCCC23CN(C(=O)[C@@H](O)CCl)C3)cc([N+](=O)[O-])c1OC	1845550986	DIRAWHXHKNQQOF-ZDUSSCGKSA-N	427.841	1.029	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@H]2CC23CN(C(=O)OC(C)(C)C)C3)C1	1846118499	MXWZMZSPFDWGNT-LSDHHAIUSA-N	441.956	1.701	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@H]2C[C@@H](O)CN2C(=O)OC(C)(C)C)C1	1846216751	XYLJBJKWUSDLEX-OAGGEKHMSA-N	443.972	1.968	50	20	IDGD	
COc1cccc(Cl)c1C(=O)N1CCCC12CN(C(=O)c1cnccc1C(=O)NN)C2	1846849826	JYGUVKBDVDQPMO-UHFFFAOYSA-N	443.891	1.478	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CNC(=O)OC(C)(C)C	1847494362	HFAZFXBFTHKXPO-RFGFWPKPSA-N	448.358	1.105	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](CCO)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CO[Si](C)(C)C	1847641986	XAWFNNIVZYQCES-PMPSAXMXSA-N	443.617	1.315	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(=O)C[C@H]1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)C(Cl)Cl	1847644751	RNYRGXOYGSYYSE-AVGNSLFASA-N	434.320	1.570	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCCc1nc2ccccc2[nH]1	10656831	KTPMWBJQEKXOOT-UHFFFAOYSA-N	429.506	1.351	50	20	IDGD	
CSc1nc(C2CC2)cc(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)c1C#N	27083998	UGTDJYDMFHOLQX-UHFFFAOYSA-N	444.542	1.920	50	20	IDGD	
Cn1cc(S(N)(=O)=O)cc1C(=O)NNC(=O)c1cc2c(s1)CC[C@H](C(C)(C)C)C2	27314123	DYJSNJRNHYILAA-LBPRGKRZSA-N	438.575	1.960	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1	46660130	MWSGKTCTWMZBMJ-UHFFFAOYSA-N	432.546	1.854	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)CNS(=O)(=O)c3ccc4c(c3)COC4)cc2C1	726381953	KKIXSGXHHDRNIH-LBPRGKRZSA-N	449.554	1.643	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=S)NCc1ccc(S(N)(=O)=O)cc1	726449104	AZZCTNOULVDBAH-UHFFFAOYSA-N	428.923	1.305	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(C)c(C(=O)N([C@@H]2CCS(=O)(=O)C2)N(C)C)c1	728179178	PJDVLUQNCLTFOW-OAHLLOKOSA-N	431.580	1.131	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)CN3CCc4ccccc43)cc2)CC1	728216152	SVYYJPQLNIKYSV-UHFFFAOYSA-N	429.546	1.129	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2cc(F)ccc2Br)ccc1F	728549758	SMPNOUUNQWJEPP-UHFFFAOYSA-N	434.218	1.450	50	20	IDGD	
CN(C(=O)CSCC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)C1CCCCC1	728845707	OXFINRUQJSYPGF-UHFFFAOYSA-N	448.593	1.365	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc([C@@H](C)NC(=O)NNC(=O)Cc2cccnc2)cc1	728956907	AILUDHWVOILVIG-OAHLLOKOSA-N	433.534	1.746	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)CCCNS(=O)(=O)c2ccc(F)cc2)cn1	729693285	RBZMBNLUDQFIKE-UHFFFAOYSA-N	441.510	1.306	50	20	IDGD	
COc1ccc(-c2nc(C(=O)N([C@H]3CCS(=O)(=O)C3)N(C)C)cs2)cc1OC	730732772	QCRLBCVMEAZUNN-ZDUSSCGKSA-N	425.532	1.933	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC(=O)NNC(=O)c1nnc(O)c2ccccc12	730908399	BHYRFZJTGRJKTJ-GFCCVEGCSA-N	430.465	1.679	50	20	IDGD	
COc1ccccc1C(=O)NNS(=O)(=O)c1cc(Br)cc(C(=O)O)c1F	731494176	SFAYKBUGQBSZKK-UHFFFAOYSA-N	447.238	1.918	50	20	IDGD	
O=C(COC(=O)c1cccc(S(=O)(=O)CC(F)F)c1)NNC(=O)c1ccccc1	731531147	NEGXZSPTFWRIQS-UHFFFAOYSA-N	426.397	1.343	50	20	IDGD	
CN(CCNC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1)C1CC1	732892013	YLCSTIXGOFSOIC-UHFFFAOYSA-N	445.545	1.203	50	20	IDGD	
CCNC(=O)COc1cccc(CNC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c1	733340710	OCMPJEPTKMNCGI-UHFFFAOYSA-N	436.472	1.531	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)[C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])o2)cc1	733560224	XWJOSCSSMILNLS-CQSZACIVSA-N	444.400	1.105	50	20	IDGD	
NS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccc(Br)cc2Cl)cc1	733806001	TYXFLDFLZKZBBJ-UHFFFAOYSA-N	447.698	1.832	50	20	IDGD	
COc1ccnc(C(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)c1	734810414	XPUCLUSJGJZWNY-UHFFFAOYSA-N	440.481	1.644	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)NC3CCN(C[C@H]4CCOC4)CC3)n[nH]2)cc1	737056346	JVOOJUCWZIJOLA-MRXNPFEDSA-N	426.521	1.830	50	20	IDGD	
CC1(C)[C@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)[C@H]2CCO[C@H]21	741425551	LWWMJRIDWMGFGD-BRWVUGGUSA-N	436.534	1.229	50	20	IDGD	
CC(C)Cn1c(SCC(=O)NNC(=O)c2cccc(C#N)c2)nnc1N1CCOCC1	741851758	RALACSPIWUFJDI-UHFFFAOYSA-N	443.533	1.196	50	20	IDGD	
C[C@@]1(C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)CCCN(C(=O)c2ccccc2)C1	741898208	LMEYSEDEZXKTEG-JOCHJYFZSA-N	443.525	1.794	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(OCC(F)F)c2ccccc12)[C@H]1CCS(=O)(=O)C1	742026307	APDURNLKWZZSLN-NSHDSACASA-N	448.469	1.228	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)N[C@@H]3CCCN(c4ccn(C)n4)C3=O)cc2C1	743512891	ZTRGFLYIDFHWHE-GXTWGEPZSA-N	430.534	1.746	50	20	IDGD	
Cc1cc(N2CC[C@H](NC(=O)NNC(=O)c3ccc(Br)s3)C2=O)n(C)n1	743518527	MYPCLLCKUIBCLI-VIFPVBQESA-N	441.311	1.302	50	20	IDGD	
CC(C)NC(=O)C(=O)NNC(=O)c1ccccc1NC(=O)c1ccccc1Br	744446536	CSRBVYGGOLXWRR-UHFFFAOYSA-N	447.289	1.987	50	20	IDGD	
C[C@@H](CN1CCN(c2ccccc2)CC1)NC(=O)NNC(=O)Cc1cn2ccccc2n1	746768412	WGYPULLHZPYYJL-SFHVURJKSA-N	435.532	1.418	50	20	IDGD	
CC(=O)N1CC[C@@](C)(C(=O)NNc2nc3ccccc3c(=O)n2CCCOC(C)C)C1	746853234	SKULJBYNVJNSPG-JOCHJYFZSA-N	429.521	1.913	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc(F)c(F)c1)NNC(=O)c1ccc(Cl)cc1F	747431744	NJXQKHVHXCHICF-UHFFFAOYSA-N	435.811	1.887	50	20	IDGD	
Cc1ccsc1[C@@H]1C[C@@H]1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	747693931	RVXCLUPLFSXMPO-SJORKVTESA-N	449.554	1.642	50	20	IDGD	
Cn1ccnc(NNC(=O)c2ccc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)cc2)c1=O	747937384	DVEHZNRZIIYYQW-UHFFFAOYSA-N	444.429	1.246	50	20	IDGD	
CN(CC(=O)NNc1nc(-c2ccccn2)nc2c1CCC2)S(=O)(=O)c1cccnc1	747982905	NCDOVZVOBFICGP-UHFFFAOYSA-N	439.501	1.186	50	20	IDGD	
C[C@H](C(=O)NNc1ccc(Br)cc1F)N1C(=O)[C@H]2[C@H](C1=O)[C@H]1CC[C@H]2O1	748200942	IAIMFCPTZADGOA-ODTJPNJJSA-N	426.242	1.582	50	20	IDGD	
NS(=O)(=O)c1ccc(NCCC(=O)NNc2ccc(F)c(F)c2F)c([N+](=O)[O-])c1	748221106	UPSVYVMJCKXEMA-UHFFFAOYSA-N	433.368	1.605	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@H]2CCCN2C(=O)c2ccc3c(c2)OCO3)cc1OC	749467943	AZGCDXBJVKKZEF-OAHLLOKOSA-N	441.440	1.498	50	20	IDGD	
CC[C@@H](Oc1ccccc1C)C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	750460647	BPEFNAXWWYAACY-BEFAXECRSA-N	428.441	1.683	50	20	IDGD	
CC(C)(C)OC(=O)N1CSC[C@H]1C(=O)NNC(=O)c1csc(N2CCOCC2)n1	751294850	UGISCRKKKSZCHJ-LBPRGKRZSA-N	443.551	1.051	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN(C(=O)c2ccc3n[nH]cc3c2)C1)c1ccc2c(c1)OCCO2	751304429	PDNJHLBCXRDUSZ-INIZCTEOSA-N	449.467	1.648	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccc(Cl)cc2)n1)c1csc(N2CCOCC2)n1	751546539	OUBGACFUKOOZIA-UHFFFAOYSA-N	433.881	1.289	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N1CCC2(CC1)CNC(=O)C2	752001474	BZOKJPJXRPRJKU-LBPRGKRZSA-N	439.310	1.559	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)NNC(=O)Nc2ccc(OC(F)F)cc2)ccc1F	752520947	FXZHXZCIEZSMHP-UHFFFAOYSA-N	432.380	1.802	50	20	IDGD	
CCc1cc(Br)ccc1NNC(=O)CCNS(=O)(=O)c1cn(C)c(C)n1	753175861	NRRNBWKELDEKOF-UHFFFAOYSA-N	444.355	1.865	50	20	IDGD	
COC[C@@](C)(O)C(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2Cl)c1	754973432	HEMBCWJPSGKJRD-GOSISDBHSA-N	441.893	1.299	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)Nc1cc(F)cc(F)c1	755564090	ZOWOPKYXBXNBGF-UHFFFAOYSA-N	440.428	1.452	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1Cl	757738237	NAZXGPUBUNVQRE-INIZCTEOSA-N	435.820	1.885	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1cc2ccccc2n1Cc1ccccc1F	758057534	VRUCIPOBSFHNNW-ZDUSSCGKSA-N	432.477	1.527	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN1C(=O)c1ccccc1OC(F)F)C(=O)Nc1ccccn1	758831082	OCKOZCUNKRFMER-ZDUSSCGKSA-N	447.398	1.074	50	20	IDGD	
Cc1cc(C)nc(-n2nccc2NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)n1	760278565	ZLEQFULJSHLBMH-UHFFFAOYSA-N	429.824	1.038	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)c1cccc(I)c1O	760439558	ILYIBWFVYKLFIR-UHFFFAOYSA-N	449.245	1.673	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)CNC(=O)c1ccc(Br)o1	761618254	DHSHWTLTMHAIMM-UHFFFAOYSA-N	442.291	1.720	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CSc2nc3cc([N+](=O)[O-])ccc3c(=O)n2C)cc1	762484558	PCFSWAUGZLLPDB-UHFFFAOYSA-N	427.442	1.703	50	20	IDGD	
Cc1ccccc1C(=O)N[C@@H](CC(C)C)C(=O)NNc1nccc(N2CCOCC2)n1	762866278	DZRRXDVRWNTDSM-SFHVURJKSA-N	426.521	1.909	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccnc(OCC(F)(F)F)c1	763443266	ZEMITLXVHQIYQB-UHFFFAOYSA-N	427.295	1.331	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1ncn(Cc2ccc(Cl)cc2)n1	763471778	YJLYYBXRZSYGHY-UHFFFAOYSA-N	443.807	1.288	50	20	IDGD	
O=C(NNC(=O)c1c[nH]c2ccccc12)C(=O)Nc1ccc(CCN2CCOCC2)cc1	763541251	QIPDLAIFJOLMIC-UHFFFAOYSA-N	435.484	1.442	50	20	IDGD	
Cc1ccc(-c2ccncc2)cc1NC(=O)C(=O)NNC(=O)[C@H]1COc2ccccc2O1	763574644	HTKOZQXRUVZFCU-HXUWFJFHSA-N	432.436	1.983	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)COc2cc(C)ccc2C(C)C)c(OC)n1	763598082	UIHCPKXGRMXVMS-UHFFFAOYSA-N	430.461	1.696	50	20	IDGD	
NS(=O)(=O)c1ccc2c(c1)oc(=O)n2CC(=O)NNc1c(Cl)cccc1Cl	763615459	DMJGRWFFOOCWHL-UHFFFAOYSA-N	431.257	1.692	50	20	IDGD	
CNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(C)nc3ccccc23)cc1Cl	763617369	ZGWACDKRRDHMOD-UHFFFAOYSA-N	439.859	1.956	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccccc2CN2CCSCC2)c1	763760833	USIIKPMSNJDNTD-UHFFFAOYSA-N	441.557	1.701	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(S(C)(=O)=O)cc2)cc1	763768520	SKQDHJYDHJGCQR-UHFFFAOYSA-N	447.513	1.915	50	20	IDGD	
COc1cc(C(=O)N(C)C)ccc1NC(=O)C(=O)NNC(=O)c1cc2c(s1)CCC2	763783957	RWEBJCIHVAFPPW-UHFFFAOYSA-N	430.486	1.347	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)C(=O)Nc2cc(C)n(C)n2)c2ccccc2c1=O	763820679	MONCRVOWBBNXQP-UHFFFAOYSA-N	439.476	1.028	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)NC(=O)CS3)c1C	763849821	NIYUPXKMOVZCFY-CYBMUJFWSA-N	442.497	1.901	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)cc(OC)c1OC	763856834	ILRAIXSQBODNAA-LLVKDONJSA-N	435.408	1.405	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)NNC(=O)C(=O)Nc1cccc(Cn2cccnc2=O)c1	763860204	BWHCASDZPCIXPE-UHFFFAOYSA-N	444.451	1.102	50	20	IDGD	
CSc1cc2c(cc1NC(=O)C(=O)NNC(=O)Cc1c[nH]c3ccccc13)OCCO2	763861985	YJIPPBLCDSFHAX-UHFFFAOYSA-N	440.481	1.990	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cccc(CN(C)C)c2)cc1	763872202	LTNLOJGRESCHMZ-HNNXBMFYSA-N	426.473	1.504	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)CCC(=O)N3)cc1	763872648	PEDBUYDCUJALFM-ZDUSSCGKSA-N	438.440	1.327	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cccc(-c3nccn3C)c2)cc1	763879629	ZZYKLQYKARWPQO-HNNXBMFYSA-N	449.467	1.843	50	20	IDGD	
CC(C)N(C)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1F	763917559	XMKLFKJNQXGGIQ-UHFFFAOYSA-N	440.439	1.046	50	20	IDGD	
CC1(C)Oc2ccc(NC(=O)C(=O)NNC(=O)c3nn(-c4ccccc4)cc3O)cc2O1	763943957	HKZDZEKNMLYYPX-UHFFFAOYSA-N	437.412	1.485	50	20	IDGD	
C[C@H]1C[C@H](C)CN(S(=O)(=O)c2ccc(NC(=O)C(=O)NNC(=O)c3ccc[nH]3)cc2)C1	763980811	NGMLRLHNYARPPA-KBPBESRZSA-N	447.517	1.081	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1cnn(-c2ccccc2F)c1	764003504	FKRXKPGDSOSPMN-UHFFFAOYSA-N	425.376	1.182	50	20	IDGD	
CC(C)N(C)S(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)CCc2ccco2)cc1	764176619	FNCRAHQWVZMPSI-UHFFFAOYSA-N	436.490	1.027	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)C(=O)Nc1ccc(CN2CCc3ccccc32)cc1	764268796	QFUMKOSTSOEIFV-UHFFFAOYSA-N	429.480	1.973	50	20	IDGD	
Cc1nnc(-c2ccccc2C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)o1	764396416	PKVLAOBTXILRPN-UHFFFAOYSA-N	428.474	1.721	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(C(=O)N2CCCC[C@@H]2C)cc1C	764399936	NYIDUTQUISMGSX-HOTGVXAUSA-N	448.520	1.147	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)N[C@H](CCO)C2CCOCC2)N(C)c2ccccc21	764405524	TUISBQXCWWIGPR-GOSISDBHSA-N	426.517	1.951	50	20	IDGD	
CCOC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2F)cc1	764410569	SMLYVCPWNOZZID-UHFFFAOYSA-N	437.811	1.821	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)C(=O)Nc2cc(C)nn2-c2ccccc2F)c1	764433580	NRIRKAJCOKOLIF-UHFFFAOYSA-N	439.407	1.073	50	20	IDGD	
CCn1c(SCC(=O)NN=C2CCCS(=O)(=O)C2)nnc1-c1ccc(OC)cc1	764744324	SUPMVZFUBPVAMZ-UHFFFAOYSA-N	437.547	1.747	50	20	IDGD	
Cc1c(C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)sc2nc3n(c(=O)c12)CCC3	765321650	DVQOVVMRMYJOGC-UHFFFAOYSA-N	449.533	1.779	50	20	IDGD	
CN(C)c1ncccc1C(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	766659859	GUSMDGJTVMLARK-UHFFFAOYSA-N	430.940	1.380	50	20	IDGD	
Cc1cc(F)ccc1-n1cc(C(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)nn1	767820156	QDHDLOPGSNIAHK-UHFFFAOYSA-N	431.811	1.986	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)c3ccc(CS(N)(=O)=O)cc3)n[nH]2)cc1	768268374	NSAPMBOBCMIPAR-UHFFFAOYSA-N	427.486	1.502	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)[C@H]1CCN(C(=O)OCc2ccccc2)C1	770080794	RCTJQUHGGVDSHW-QFBILLFUSA-N	425.441	1.633	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NNc2ccnc(Br)c2)n(C)c1	771549580	RJTBNKUMQOBHKL-UHFFFAOYSA-N	430.328	1.970	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1cccc(S(=O)(=O)N(C)c2ccc(C)cc2)c1	771875462	UKMHRZYOVVZTPB-HNNXBMFYSA-N	447.513	1.923	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)C[C@@H]2CSCCN2C(=O)OC(C)(C)C)C[C@@H](C)O1	772374220	NVKUYGCMPASZCX-BZUAXINKSA-N	444.598	1.376	50	20	IDGD	
CNC(=O)COc1cccc(CC(=O)NNc2nc(Br)cn3ccnc23)c1	772474199	TYTRYBNCJHUHFP-UHFFFAOYSA-N	433.266	1.302	50	20	IDGD	
Cc1nn(C)c2nc(C3CC3)cc(C(=O)NNC(=O)C(=O)NCc3ccc(Cl)cc3)c12	772883403	ACCYBIRKQHCZDP-UHFFFAOYSA-N	440.891	1.885	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1ccn(Cc2ccccc2)n1	773228674	DHBYIALDNNYQFM-UHFFFAOYSA-N	441.513	1.709	50	20	IDGD	
CCOC(=O)c1cc(S(=O)(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)cn1C	773266927	UJOKHJBWAMGUNI-LLVKDONJSA-N	429.882	1.632	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2cc(C)nn2-c2cccc(Br)c2)n1	773726189	KVKGGJCKGXYWKQ-UHFFFAOYSA-N	446.265	1.824	50	20	IDGD	
CCOC(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)c1	774007340	GDALJJAWQGTQJX-CYBMUJFWSA-N	447.875	1.999	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)c2ccc(Br)s2)cc1CC(=O)O	774602955	DGSJEKFIXYWJBN-UHFFFAOYSA-N	449.304	1.770	50	20	IDGD	
O=C(NCCc1cnccn1)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	775453561	BSBGZAMLYTZPQJ-UHFFFAOYSA-N	443.467	1.422	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)N1CCN(S(=O)(=O)CBr)CC1	777777853	QGPLVBRNMQMZOR-LLVKDONJSA-N	425.732	1.934	50	20	IDGD	
CC(=O)N1CCC(=NNC(=O)Cc2csc(N3CCOCC3)n2)c2ccccc2C1	778540687	SCPYLMZFGONRCN-UHFFFAOYSA-N	427.530	1.795	50	20	IDGD	
COC(=O)c1cnc(C(=O)NNC(=O)COc2ccc(OCc3ccccc3)cc2)cn1	779640474	DBOVYJJAEGGQHJ-UHFFFAOYSA-N	436.424	1.682	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2Cl)cc1-n1cnnn1	782927657	TXLTUGGMMCTVFR-UHFFFAOYSA-N	434.243	1.677	50	20	IDGD	
CN(C)C1(CNC(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)CCC1	783001090	MBSLZZGBAPRKTO-UHFFFAOYSA-N	448.531	1.817	50	20	IDGD	
Cc1cc(C(=O)N2CCOCC2)ccc1NC(=O)C(=O)NNc1ncnc2ccsc12	783255377	UABPHCKQBMMEDX-UHFFFAOYSA-N	440.485	1.554	50	20	IDGD	
Cc1cc(C)c(NNC(=O)C(=O)Nc2ncn(CC(=O)N3CCCCCC3)n2)c(C)c1	783367869	FTVNWGXGCDBJCO-UHFFFAOYSA-N	427.509	1.688	50	20	IDGD	
CN(NC(=O)C(=O)Nc1ccc(F)c(NC(=O)CCN2CCOCC2)c1)c1ccccc1	783432345	UYDWFGXTYUZFQD-UHFFFAOYSA-N	443.479	1.593	50	20	IDGD	
CCN1CCC(n2nccc2NC(=O)C(=O)NNc2ccnc(Br)c2)CC1	784828614	MGLMTORZCBSIOE-UHFFFAOYSA-N	436.314	1.779	50	20	IDGD	
CNS(=O)(=O)c1cc(NC(=O)C(=O)NNc2ccnc(Br)c2)ccc1C	784830034	JHBIEDUSRSVCLI-UHFFFAOYSA-N	442.295	1.142	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(NC(=O)C(=O)NNc2cccc(C(F)(F)F)n2)c1	784952964	WJDJRYXZLHFGPD-UHFFFAOYSA-N	431.396	1.433	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)C(=O)Nc3cccc(C(=O)N(C)C)c3)n[nH]2)c1	785126883	SWLAFIQZERGGBS-UHFFFAOYSA-N	448.483	1.795	50	20	IDGD	
CN(NC(=O)Nc1cnc2c(c1)COCC2)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	785862336	RYJRKDXODMTOAE-UHFFFAOYSA-N	434.497	1.795	50	20	IDGD	
COCCc1ccccc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccccc2OC)[nH]n1	786417730	XRVHYXLJAQUXHD-UHFFFAOYSA-N	437.456	1.674	50	20	IDGD	
CSCC[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)NNC(=O)NCc1ccccc1	787372412	JCVFQPGXRFFLTP-QGZVFWFLSA-N	445.501	1.977	50	20	IDGD	
Cc1cc(C(=O)N2CCC[C@H]2C(=O)NNc2ccc(-n3ccnc3)nn2)ccc1[N+](=O)[O-]	788178513	RVTWNLAYTZSGHN-INIZCTEOSA-N	436.432	1.627	50	20	IDGD	
CCc1csc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)NC(C)(C)C)n1	789725774	FSZMSPDZFKWAQA-UHFFFAOYSA-N	425.536	1.864	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2cccc3c2OCC[C@H]3N(C)C)cc1	789733800	VGVOJEUYHJNCEJ-LJQANCHMSA-N	440.500	1.799	50	20	IDGD	
O=C(NNC(=O)[C@H]1CC(=O)c2ccccc21)c1ccc(S(=O)(=O)N2CCCC2)cc1	789734805	HUIXTCASBJCWGE-SFHVURJKSA-N	427.482	1.602	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)C3CCC(O)CC3)c2)cc1	792010975	CNPUIXZVINUKBQ-UHFFFAOYSA-N	447.513	1.808	50	20	IDGD	
CCS(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2cc(OC)cc(OC)c2)s1	792217943	MSEZSJJRXHCKPZ-UHFFFAOYSA-N	427.504	1.703	50	20	IDGD	
O=C(NNC(=O)[C@H]1[C@@H]2[C@@H]3[C@H]4[C@H]5C[C@@H]3[C@H]1[C@@H]5C[C@H]42)c1cccc(S(=O)(=O)N2CCCC2)c1	792773391	HHULZLRMLZSAFO-PIOCQINBSA-N	441.553	1.626	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1cccc(Br)n1	793021399	DKWCHXVJCGCPRE-VIFPVBQESA-N	425.214	1.537	50	20	IDGD	
Cn1ccc2ccc(NC(=O)C(=O)NNC(=O)CN3CCCc4ccccc43)cc2c1=O	793023934	YJRYVGPKOMWIRK-UHFFFAOYSA-N	433.468	1.077	50	20	IDGD	
O=C(NNc1ccc2c(=O)[nH]ccc2c1)C(=O)Nc1ccccc1S(=O)(=O)C(F)F	793066065	RGQZFBXXPHPLPX-UHFFFAOYSA-N	436.396	1.606	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)[C@@]3(C)CCN(C(=O)OCc4ccccc4)C3)nc21	793500969	LFSZGQVFQOTGFA-FQEVSTJZSA-N	425.449	1.561	50	20	IDGD	
CCCn1nc(C(=O)NNS(=O)(=O)c2cccc(CC#N)c2)c2ccccc2c1=O	794575922	BUSFJZCJNMJJJW-UHFFFAOYSA-N	425.470	1.496	50	20	IDGD	
C[C@H](Oc1ccc(C=O)cc1)C(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	796515646	ZIMRKTWJGCIZQF-AWEZNQCLSA-N	434.493	1.996	50	20	IDGD	
Cc1nc2ccc(NC(=O)C(=O)NNC(=O)CNC(=O)OCc3ccccc3)cc2o1	797369824	LWEOAPAVNWEUHC-UHFFFAOYSA-N	425.401	1.149	50	20	IDGD	
C[C@H](c1ccc(S(N)(=O)=O)cc1)N(C)C(=O)NNC(=O)Cn1ccc2ccccc21	799920164	CNQPWCVGBBLLBK-CQSZACIVSA-N	429.502	1.723	50	20	IDGD	
CNC(=O)CNC(=O)c1cccc(NC(=O)NNC(=O)CC23CC4CC(CC(C4)C2)C3)c1	800595106	PXHHEIRUAABGKK-UHFFFAOYSA-N	441.532	1.922	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)NCCOc2ccc(I)cc2)cn1	801062158	WJYQASBXIJBFNT-UHFFFAOYSA-N	429.218	1.048	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NNc2ncccc2F)o1	804215478	SCBMBFUQGJGRDB-LBPRGKRZSA-N	426.426	1.287	50	20	IDGD	
COc1ccc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c(C)c1OC	805591886	DAHWRJWQFDAZTC-KRWDZBQOSA-N	430.413	1.156	50	20	IDGD	
COc1ccc(CS(C)(=O)=O)cc1NC(=O)C(=O)NNC(=O)c1cccc(Cl)c1	806974001	OVQYOQNQSFBEAW-UHFFFAOYSA-N	439.877	1.293	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)cc2C1	807134546	BMIUXRXOJYHESP-LLVKDONJSA-N	440.489	1.138	50	20	IDGD	
COC(OC)c1ccc(C(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)o1	807242538	CZHJBPNVGCGKLB-UHFFFAOYSA-N	426.470	1.820	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](N2CCN(C(=O)NNC(=O)c3cccc(C#N)c3)CC2)C1	808264882	SBCTWPVYUCFTDW-SFHVURJKSA-N	442.520	1.540	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N(C)CCn2cc(Br)cn2)c(OC)c1	808267269	UUXTYHPCWAXPFY-UHFFFAOYSA-N	426.271	1.649	50	20	IDGD	
CNC(=O)c1cc(Oc2ccc(NC(=O)NNC(=O)c3cnn(C)c3)cc2F)ccn1	810312072	LIULPLWVFALXDI-UHFFFAOYSA-N	427.396	1.573	50	20	IDGD	
Cc1cc(C(C)(C)C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)ccc1Br	813420251	HPSNXAXXDLENIP-LBPRGKRZSA-N	432.340	1.553	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2cc3ccccc3o2)nnn1Cc1ccccc1F	815570131	SCSGPBHVPGACTH-UHFFFAOYSA-N	436.403	1.920	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)C(=O)Nc2ccc(CC(N)=O)cc2)c1	815865926	JOFDCJIALATKER-UHFFFAOYSA-N	449.261	1.345	50	20	IDGD	
O=C(NNc1nc[nH]n1)c1ccc(N2CCCCC2)c(S(=O)(=O)N2CCCCC2)c1	816633024	JXGQWJISKYLNHO-UHFFFAOYSA-N	433.538	1.727	50	20	IDGD	
CCOc1ccc(NNC(=O)Cc2ccc(S(=O)(=O)N3CCOCC3)s2)cc1	817925787	QDDIKCXQKKDGKY-UHFFFAOYSA-N	425.532	1.854	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)CNS(=O)(=O)c3c(F)cccc3F)cc2C1	913162530	VZYYJZRPQFLRRV-SNVBAGLBSA-N	443.497	1.891	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)[C@@H]2CC(=O)N(Cc3ccccc3Cl)C2)cc1	913429557	IATZSXCYMGKCBR-OAHLLOKOSA-N	430.892	1.957	50	20	IDGD	
CCOc1ccc(NC(=S)NNC(=O)CNS(=O)(=O)c2cccc(F)c2)cc1	913444027	WAVZPZHZKLWAHH-UHFFFAOYSA-N	426.495	1.521	50	20	IDGD	
CC(C)C[C@H](/N=C1/NS(=O)(=O)c2ccccc21)C(=O)NNC(=O)NC1CCCCC1	913451097	MSYMCQABBPJZBA-INIZCTEOSA-N	435.550	1.803	50	20	IDGD	
CNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2ccc(OCCC(C)C)c(OC)c2)o1	915064430	PAOHGXKQJOREFY-UHFFFAOYSA-N	439.490	1.696	50	20	IDGD	
COc1cccc(C[C@H](C(=O)NNC(=O)Cc2c[nH]c3ccccc23)n2nnnc2C)c1	915697464	QRPUENKQZMSDIE-HXUWFJFHSA-N	433.472	1.645	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NC[C@@H]2CN(Cc3ccccc3)CCO2)cc1C	915894712	NZQQXLKZYFCNCS-OAQYLSRUSA-N	426.517	1.914	50	20	IDGD	
CC(=NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)c1cc(O)ccc1O	915915315	YSELREWZODIBRX-UHFFFAOYSA-N	447.513	1.592	50	20	IDGD	
COc1cccc(C[C@@H](C(=O)NNC(=O)c2ccc3ccccc3n2)n2nnnc2C)c1	916092026	RXHHZKIZFTZAKT-FQEVSTJZSA-N	431.456	1.783	50	20	IDGD	
O=C(NNC(=O)c1c(Cl)nc2ccccn12)c1cccc(S(=O)(=O)N2CCCC2)c1	916096596	YFJTVMJEQMCWQE-UHFFFAOYSA-N	447.904	1.847	50	20	IDGD	
O=C(NCc1ccc(C(=O)N2CCOCC2)cc1)NNC(=O)c1ccc([N+](=O)[O-])cc1	916247893	QXAUOENSPBPUIP-UHFFFAOYSA-N	427.417	1.211	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)NCCCN2CCN(c3ncccn3)CC2)c1	916267409	QYEODVVALUEPIA-UHFFFAOYSA-N	441.536	1.015	50	20	IDGD	
CCN(CCP(=O)(c1ccccc1)c1ccccc1)CC(=O)N[C@@H]1CCS(=O)(=O)C1	917011133	OEZROMXYZKLBJT-LJQANCHMSA-N	448.525	1.626	50	20	IDGD	
CSC[C@H](C(=O)NNC(=O)c1c[nH]c2ccccc12)N1C(=O)[C@H]2CCCC[C@H]2C1=O	917359052	UIVDIWMAKGPYCW-JKIFEVAISA-N	428.514	1.836	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNS(=O)(=O)c2ccc([N+](=O)[O-])cc2OC)cc1	917724069	SJWGWFMNBSAMEZ-GFCCVEGCSA-N	439.446	1.779	50	20	IDGD	
COc1cccc([C@@H](C)NC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)c1	918110398	YRUSNNCHPYEHTR-OAHLLOKOSA-N	448.549	1.414	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNS(=O)(=O)c2cccc(F)c2[N+](=O)[O-])cc1	918399993	WVZHMDXAINYIKR-LLVKDONJSA-N	427.410	1.910	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1ccccc1OCc1ccccc1Cl	920298656	QUDNBBJVINGKPW-LBPRGKRZSA-N	425.894	1.618	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NNC(=O)OC(C)(C)C)o1	920402225	OTIJEDLULDPONS-NSHDSACASA-N	431.467	1.165	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)CCCOc2ccc(F)cc2F)ccc1Cl	921301642	BHYVYALKHHFXEN-UHFFFAOYSA-N	447.847	1.886	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)CCS(=O)(=O)c2ccc(Cl)cc2)c1	929086502	BZUQDJWPQASPIJ-UHFFFAOYSA-N	426.878	1.982	50	20	IDGD	
COC(=O)COc1cccc(C(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)c1	1318903484	NPCPCHNATHQJHU-UHFFFAOYSA-N	435.477	1.647	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)NNC(=O)N[C@@H]1CCO[C@]2(CCS(=O)(=O)C2)C1	1319835999	ISVRWBJYGBKOCS-RHSMWYFYSA-N	430.914	1.090	50	20	IDGD	
O=C(NNC(=O)c1sccc1S(=O)(=O)N1CCOCC1)c1ccccc1Cl	1321501944	ODAYYCHXWQCONT-UHFFFAOYSA-N	429.907	1.497	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2)c1ccncc1C(F)(F)F	1778270434	RTVOIRJMKIXZFK-HDMKZQKVSA-N	449.857	1.828	50	20	IDGD	
O=C(c1n[nH]c2ccccc12)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1778520744	XPPNBZGKICTISJ-RHSMWYFYSA-N	425.258	1.697	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccn4cncc4c3)C2)C1	1778653140	JHZUKZRRIPCATM-IFXJQAMLSA-N	435.322	1.809	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(Cl)Cl)C2)c1ccc2nncn2c1	1779073027	XAZVCZQJSVAWLL-FZKQIMNGSA-N	426.304	1.661	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(CCN(C(=O)c3cc(-c4cccnc4)[nH]n3)C2)C1	1779613690	RYQVWIBYINSSNJ-OAQYLSRUSA-N	443.580	1.767	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cccc(F)c2)C1	1780356823	YGTLMXNVCVBSME-XMSQKQJNSA-N	434.512	1.326	50	20	IDGD	
O=C(c1nnsc1C1CC1)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781329918	NSSTZRIYDCLQRS-DOMZBBRYSA-N	433.303	1.550	50	20	IDGD	
O=C(c1cc(O)cc([N+](=O)[O-])c1)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1781938596	HWYXOJUREIPESV-CJNGLKHVSA-N	446.229	1.434	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CN1CCSCC1)C2	1781995192	CWPUVACOQBNDPR-HDMKZQKVSA-N	448.427	1.333	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H]2CCNC(=O)C2)C1	1782273639	IWYVBRINUZGFFA-XTDOFWJNSA-N	444.370	1.200	50	20	IDGD	
O=C(c1onc2ccccc12)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1782348760	BNCJQRYZHPEFRJ-YOEHRIQHSA-N	426.242	1.962	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@@]2(CN(C(=O)CSC(=N)N)CCO2)C1	1782864518	NJOAKPFBWVFFFF-CDXDBMBRSA-N	449.483	1.328	50	20	IDGD	
O=C1CC(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](Br)Cc4ccccc4)C3)C2)C1	1783021725	GJQFDIYWAPZMHE-RXVVDRJESA-N	449.345	1.802	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cnccc3C(F)(F)F)CCO2)C1	1783877452	YTTVDJJSQJGOHD-PBHICJAKSA-N	435.830	1.798	50	20	IDGD	
CC#C[C@H](CC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2)c1ccc(O)cc1	1784016795	ZAQSCPGNKILMNE-SFGWALBWSA-N	434.920	1.319	50	20	IDGD	
COc1ccc(F)cc1CC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](C)Br)CCO2	1784087853	ROVPZCOKDUMHLI-DJJJIMSYSA-N	443.313	1.990	50	20	IDGD	
Cc1ccc(CCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Br)C[C@@H]32)nc1	1785304711	AHQXKCYXZFNBML-OWIUFQIYSA-N	442.329	1.993	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3cnccn3)C[C@@H]21	1786407754	RPSMVLCDYQMKFH-BPUTZDHNSA-N	425.327	1.174	50	20	IDGD	
O=C(/C=C/c1cnccn1)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1	1788145522	XPEUCGJEVBXZGK-ZHACJKMWSA-N	442.284	1.618	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(OC)nn3)[C@H]2C1	1789105050	DKBIKJANVFYVNY-ABHRYQDASA-N	441.326	1.252	50	20	IDGD	
CCCCC[C@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21	1790892947	QFOOUVNPTZCDJA-GIUOSPMZSA-N	430.354	1.176	50	20	IDGD	
O=C(Cc1ccccc1O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21	1790896512	CAYCJTANWIEYRI-ZOBUZTSGSA-N	425.323	1.699	50	20	IDGD	
Cc1cc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](C)Br)[C@H]3C2)nn1C	1791055127	KEYUDQXPXAOSME-SDADXPQNSA-N	427.343	1.034	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)COc3ccccc3)C[C@@H]21	1791058166	SIZKEESOIPUYTG-OHFALNGGSA-N	425.323	1.829	50	20	IDGD	
Cc1cc(NC(=O)CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]3C2)no1	1791295748	YCCXVJPVLGHIIX-SRVKXCTJSA-N	433.292	1.095	50	20	IDGD	
Cc1nccn1[C@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)Br)C[C@@H]21	1791707144	AFQQIJVIBJGICE-WOOFSFRISA-N	427.343	1.516	50	20	IDGD	
CCC[C@H](NC(C)=O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]21	1792184686	HQSYPQUORSPBMN-GMHRPJKWSA-N	436.380	1.507	50	20	IDGD	
Cn1c(=O)n(C)c2cc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)C(C)(C)CCl)ccc21	1792781889	FRAZQUZZFGSTBH-JLVBRIDZSA-N	448.951	1.345	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Cl	1796365941	HKUCABVIQBDGMN-OJXGSEEGSA-N	443.815	1.258	50	20	IDGD	
C[C@H]1C[C@]1(C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1799158687	PRWOJHNXYOGHLQ-BCKAASPTSA-N	443.972	1.754	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CCc3ccccc31)C2)[C@@H](F)Br	1799352318	PQRQZAMUAGRJQZ-QMPXSYISSA-N	425.298	1.997	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)Br	1800757307	KNHVOLLMJMBVJO-ZIEJDFEHSA-N	435.322	1.629	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nc3cc(C)c(C)cc3[nH]1)C2	1800976742	GCFVKXUFIRCTPH-KRXQYRFLSA-N	434.924	1.637	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c(OC)cccc1OC)C2	1800979024	OFFGVSQXENOXJR-AHXJXLJNSA-N	426.897	1.161	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(Br)cn1)C2)C(Cl)Cl	1801016901	BYNBEPMTSHDDHS-BZBKMWRSSA-N	437.121	1.851	50	20	IDGD	
Cn1c(C(=O)NC[C@H]2CCN(C(=O)CO[Si](C)(C)C)[C@@H]2c2cccnc2)cccc1=O	1805313995	ADRAEQBNGBDLKE-DYESRHJHSA-N	442.592	1.951	50	20	IDGD	
COCCC(=O)NC[C@H]1CCN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@H]1c1cccnc1	1806743058	WQTWICFVPBLKHY-QOZRKGCKSA-N	440.504	1.258	50	20	IDGD	
O=C(c1cnc(-c2ccccn2)nc1)N1CCCC2(CCN(C(=O)[C@H](O)CCl)CC2)C1	1807357678	JCVWLLLQPVFIEC-GOSISDBHSA-N	443.935	1.983	50	20	IDGD	
Cc1c[nH]cc1C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1807361113	HKGRULNWPSMUJE-GHTZIAJQSA-N	432.289	1.031	50	20	IDGD	
Cc1ccsc1C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1807365544	YLZWZKNHSBRUMD-ICSRJNTNSA-N	449.341	1.765	50	20	IDGD	
Cc1ncccc1C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1807365682	ZJTGDAAPAXPTIZ-UGKGYDQZSA-N	444.300	1.098	50	20	IDGD	
C[C@H](C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)n1cccc1	1807373803	GSEFVCPSNVXXSM-PIPMEXSNSA-N	446.316	1.144	50	20	IDGD	
Cc1nnc(CC(=O)NC[C@@H]2CCN(C(=O)[C@H](C)Br)[C@@H]2c2cccnc2)o1	1807474614	INLKHVAOLWVKET-PZSREKOKSA-N	436.310	1.805	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)c1c[nH]c2nccc-2c1	1808077836	ROXLFVALYLSTCD-CGTJXYLNSA-N	427.892	1.829	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)NC[C@H]1CCN(C(=O)CN)[C@H]1c1cccnc1	1812442463	XEOAVEHFLIBISS-MTNVJAPISA-N	425.439	1.931	50	20	IDGD	
Cc1ccc(C(=O)C(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@H]2c2cccnc2)cc1	1812962002	YLAOWJXMHNYLPF-OTWHNJEPSA-N	429.904	1.878	50	20	IDGD	
CCOC(=O)N[C@@H](O)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)C(C)(C)CCl)n[nH]1	1814697094	LYEBVKVNKPWIAY-OCCSQVGLSA-N	429.905	1.731	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)C#CC1CC1)CC2	1817275862	GADOKNGVAZPFOW-IETDBYTCSA-N	438.513	1.603	50	20	IDGD	
Cc1ccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)c(C)n1	1817477086	YLOGKFNTEUVZDF-HXUWFJFHSA-N	447.304	1.721	50	20	IDGD	
CC(=O)N1CCN(CC(=O)Nc2nc3c(s2)C[C@@H](NC(=O)C(Cl)Cl)CC3)CC1	1818898396	KMWSIRDUNAVJNG-NSHDSACASA-N	448.376	1.023	50	20	IDGD	
C[C@H](Br)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1822182932	GJRXNGTUULOLLC-XHDPSFHLSA-N	449.114	1.179	50	20	IDGD	
C=CCNC(=O)/C=C\C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](C)Br)sc2C1	1825631706	KPYBPBHCUJUMIW-UQRGBAIESA-N	441.351	1.697	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](C)Br)sc2C1	1825641361	NVLBLHWDZAWTGW-KKZNHRDASA-N	431.356	1.705	50	20	IDGD	
CCNC(=S)NCC(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](C)Br)sc2C1	1825647649	UKWSIKMCDLZKRX-BDAKNGLRSA-N	448.412	1.323	50	20	IDGD	
C[C@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)C[C@@](C)(O)CC(=O)O)sc2C1	1826078534	UULAGXJLRYGYRW-OMQMVUIESA-N	448.339	1.454	50	20	IDGD	
O=C(/C=C/c1ccoc1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827050366	PGDIVYNOEFTZKI-DGOUCMFKSA-N	436.317	1.906	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CCC(N)=O)CC1	1827679675	OTPOUNVTDKJTJP-BIKZULFDSA-N	444.536	1.006	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)C3CC(F)(F)C3)CCO2)C1	1829992319	FDPRNZKBMXJAEP-IAQYHMDHSA-N	425.270	1.272	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)C(=O)c3ccc(Cl)cc3)CCO2)C1	1830688199	QUMQJPKDENIBGL-JXFKEZNVSA-N	443.327	1.997	50	20	IDGD	
Cc1csc(CCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)c1	1830726833	UEVDOCQKHKVBCQ-QFBILLFUSA-N	430.954	1.045	50	20	IDGD	
Cc1cn(CC(=O)N2CCC([C@@H]3CCCCN3C(=O)C(Cl)Cl)CC2)c(=O)nc1O	1831882223	YBXRIXWQRKSKKQ-AWEZNQCLSA-N	445.347	1.681	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)c1ccc(Cl)nc1F	1833904593	LUEINZUMNLWYOO-HNNXBMFYSA-N	447.338	1.659	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3ccc(=O)oc3)CC2)CC1	1834340930	MJWJMDLJHNSBLS-KRWDZBQOSA-N	425.913	1.079	50	20	IDGD	
CCOc1cnc(C(=O)N2CCC(N3CCC(NC(=O)[C@@H](F)Cl)CC3)CC2)cn1	1835078731	UIATWISGQJWPDE-QGZVFWFLSA-N	427.908	1.595	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)c1cccn2ccnc12	1835576297	BFOKJPBNZWYWGZ-SFHVURJKSA-N	433.940	1.119	50	20	IDGD	
O=C(c1ccc2cnccc2n1)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836717239	OXRUUJXIMQCXCS-HXUWFJFHSA-N	446.935	1.842	50	20	IDGD	
O=C(c1ccc2nc[nH]c2c1)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836717280	RWFXGXUVOVFIOF-IBGZPJMESA-N	434.924	1.775	50	20	IDGD	
O=C(/C=N/N1CCCCC1)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836717310	TUULZAQBXMKPQB-GNFOSXPUSA-N	428.961	1.056	50	20	IDGD	
O=C(c1ccc2cccnc2n1)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1836834349	LGCKIUSISAPTNP-IBGZPJMESA-N	439.299	1.504	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)COc3cccnc3)CC2)CC1	1837114480	UZDCUPPDZXMFKA-IBGZPJMESA-N	439.940	1.713	50	20	IDGD	
N[C@@H](Cc1cscn1)C(=O)N1CCC(OC2CCN(C(=O)C(Cl)Cl)CC2)CC1	1838064450	WELBFRKJKWMXDZ-HNNXBMFYSA-N	449.404	1.815	50	20	IDGD	
O=C(Nc1cccnc1)C(=O)N1CCC(OC2CCN(C(=O)C(Cl)Cl)CC2)CC1	1838419827	KXHJHTYTXLEUQY-UHFFFAOYSA-N	443.331	1.822	50	20	IDGD	
CC(C)c1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)n[nH]1	1838700243	WIJAMFDAINVDOG-UGSOOPFHSA-N	443.342	1.387	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(NC(C)=O)o3)C2)C1	1839146429	ZAGPFLNWMVUDGZ-LIRRHRJNSA-N	427.885	1.325	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccccc3)C2)C1	1839150915	CCGDOOOQKNTSHR-WOJBJXKFSA-N	429.344	1.922	50	20	IDGD	
Cc1cccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)n1	1839151110	IGIHWOXTVJWAJR-RBUKOAKNSA-N	430.332	1.696	50	20	IDGD	
C=CCOCCCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](Br)CC)CCO2	1839962479	GYOYUSASDRWCQL-QFBILLFUSA-N	447.370	1.599	50	20	IDGD	
CCc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)no1	1840033835	SDIQXFPDYJKZLG-PXAZEXFGSA-N	430.299	1.090	50	20	IDGD	
CSc1cccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)c1O	1840189056	SYKOTSKFZVIMPP-SFHVURJKSA-N	449.356	1.988	50	20	IDGD	
CSc1ncccc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840189127	YRMHXEYWCCNIBP-KRWDZBQOSA-N	434.345	1.677	50	20	IDGD	
Cc1ccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)o1	1840508830	IQWDVTJVZSASIH-OALUTQOASA-N	433.332	1.823	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CCCS1)CCO2	1840578477	APDBPAOOJRHBGV-VBQJREDUSA-N	435.384	1.512	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H]3CCCS3)CCO2)C1	1840580004	ZONIPLZGBDMHKA-JQFCIGGWSA-N	425.378	1.575	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(C)c3Cl)CCO2)C1	1840693226	NYGGXRMSIJHTLT-JXFKEZNVSA-N	445.343	1.972	50	20	IDGD	
Cc1cc(NC(=O)CC(=O)N2CC3(CCCN3C(=O)[C@H](C)CBr)C2)no1	1841286580	NUANHPXBLXYPMA-LLVKDONJSA-N	427.299	1.546	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@H]2COCCN2C(=O)OC(C)(C)C)C1	1841751714	JUSGAJRDDHSAOA-HUUCEWRRSA-N	445.944	1.080	50	20	IDGD	
Cc1c(C(=O)N2CCCC23CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C3)cnn1C	1842520038	RHVMQVZLXGSBLQ-HNNXBMFYSA-N	439.944	1.678	50	20	IDGD	
O=C1CCCN1CC(=O)N1CCCC12CN(C(=O)[C@H](Br)Cc1ccccc1)C2	1842831700	HWSVOHXISXYDJG-QGZVFWFLSA-N	448.361	1.818	50	20	IDGD	
O=C([C@@H](O)CCl)N1CC2(CCCN2C(=O)c2c(C(F)(F)F)nc3ccc(F)cn23)C1	1845723127	DDILUBWWDHCSCQ-NSHDSACASA-N	448.804	1.909	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)N2CCCC23CN(C(=O)[C@@H](O)CCl)C3)CC1	1847145566	BHXVYMMXXPZZRT-HNNXBMFYSA-N	429.945	1.437	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)NCCNc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-]	9797783	BCHJCESAUKQKFC-UHFFFAOYSA-N	435.462	1.363	50	20	IDGD	
Cc1cc(NC(=O)[C@@H](C)SCC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)no1	10158682	NMAFDHIGOXZCPH-GFCCVEGCSA-N	444.473	1.396	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)c1ccc2c(c1)NC(=O)CS2	17355919	LJUDKSDRVLCQMG-UHFFFAOYSA-N	439.541	1.704	50	20	IDGD	
Cc1cc(C)n2nc(C(=O)NNC(=O)c3ccc(CSc4nncn4C)cc3)nc2n1	21291103	NRLBHDSDOXSFLM-UHFFFAOYSA-N	437.489	1.237	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)C2=COCCO2)c1	24584121	YZJXAPOGUIDUBR-UHFFFAOYSA-N	433.442	1.145	50	20	IDGD	
Cn1cc(S(N)(=O)=O)cc1C(=O)NNC(=O)COc1ccccc1-c1ccccc1	29122501	SHWXOKWIKMODKF-UHFFFAOYSA-N	428.470	1.180	50	20	IDGD	
CCn1c(=O)[nH]c2cc(C(=O)NNC(=O)CSc3ccc(Cl)cc3)ccc2c1=O	108056383	BTSAGRJYCAUIOT-UHFFFAOYSA-N	432.889	1.916	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCCNC(=O)CC2CCCCC2)nc1	726259392	DAWMYBFAYVJBTB-UHFFFAOYSA-N	440.570	1.481	50	20	IDGD	
COc1cccc2c1OCC[C@H]2NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	726274401	PXROHWZYKCQJDW-MRXNPFEDSA-N	448.501	1.413	50	20	IDGD	
O=C(CSc1nnnn1C1CCCC1)NNc1ccc(S(=O)(=O)NC2CC2)cc1	726863392	SJOCSQXPLDCPAL-UHFFFAOYSA-N	437.551	1.464	50	20	IDGD	
CC(C)c1ccccc1NC(=S)NNC(=O)C1CCN(c2ccc3nnnn3n2)CC1	727171332	BIBARXAGPINALR-UHFFFAOYSA-N	439.549	1.877	50	20	IDGD	
CCS(=O)(=O)c1ccc(N2CCC(NC(=O)NNC(=O)Cc3cccnc3)CC2)cc1	728957339	BSJZVSXWWIHNQW-UHFFFAOYSA-N	445.545	1.417	50	20	IDGD	
CSCC[C@@H](NC(=O)c1ccc([N+](=O)[O-])o1)C(=O)NNC(=O)c1scnc1C	729455145	RMWXOHARUJTINB-SECBINFHSA-N	427.464	1.265	50	20	IDGD	
CCN1CCC[C@@H]1CN1C[C@@H](C(=O)NNC(=O)COc2cc(C)ccc2C(C)C)CC1=O	729627434	LFDJWRWBUBOUQT-RBUKOAKNSA-N	444.576	1.977	50	20	IDGD	
O=C(NNC(=O)[C@H]1CS[C@@H](Cc2ccccc2F)C(=O)N1)c1cccc2ncccc12	730226519	OIDHZPMJDZPJMU-MOPGFXCFSA-N	438.484	1.978	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCCc2c[nH]c3ccccc23)c1	730913664	ZAVULSWOQMRWIQ-UHFFFAOYSA-N	443.529	1.995	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)N[C@@H]1CCOc2ccc(F)cc21	731679385	KLIKGSOMRCAKOX-CQSZACIVSA-N	435.481	1.895	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2ccc(Br)s2)ccc1OCC(N)=O	731833571	FRTPHRJBERDSRT-UHFFFAOYSA-N	428.264	1.458	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@@H]2CCCCN2S(C)(=O)=O)cc1Br	732036154	YQLSTYLLOMUFQN-LBPRGKRZSA-N	434.312	1.033	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)c2sccc2S(=O)(=O)N(C)C)cc1OC	732052058	KAYJUKOWFDMLPU-UHFFFAOYSA-N	427.504	1.481	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)N1CCC(C(=O)c2ccc3c(c2)NC(=O)[C@H](C)O3)CC1	732199018	DIPAMEQVMGVDBX-GJZGRUSLSA-N	444.532	1.883	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2nn(-c3ccccc3F)c3c2CCC3)C[C@H](C)O1	732261635	OCEKQTGGHXLUCR-GJZGRUSLSA-N	429.496	1.760	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)c2cc(Br)c3c(c2)OCO3)C[C@@H](C)O1	732263159	LDBTZXVKCKBRMT-GHMZBOCLSA-N	428.283	1.438	50	20	IDGD	
C[C@@H]1Cc2ccccc2N1C(=O)[C@H]1CCCC[C@@H]1C(=O)NNC(=O)C(=O)N1CCCC1	732755092	ODYCIGIUWIRKAP-NJAFHUGGSA-N	426.517	1.540	50	20	IDGD	
CS(=O)(=O)c1cc(S(=O)(=O)NNC(=O)c2cnn(-c3ccccc3)c2)ccc1F	733123127	SZBOLMFPTMSKAW-UHFFFAOYSA-N	438.462	1.038	50	20	IDGD	
Cc1c(C)c(C)c(S(=O)(=O)N2CCN(CC(=O)NNC(=O)C3CC3)CC2)c(C)c1C	733193156	FWTOULXZNZGWRC-UHFFFAOYSA-N	436.578	1.092	50	20	IDGD	
CCOCCCn1c(NNC(=O)c2ccc(N3CCCC3)nn2)nc2ccccc2c1=O	733267636	ABGXJBFHPCSQOD-UHFFFAOYSA-N	437.504	1.970	50	20	IDGD	
C[C@@](O)(CNC(=O)NNC(=O)c1csc(N2CCOCC2)n1)c1ccc(F)cc1F	734007691	YPIIBYLCBNOVKX-GOSISDBHSA-N	441.460	1.110	50	20	IDGD	
Cc1nc(-c2ccccn2)nc(NNC(=O)C2=CN3CCS(=O)(=O)N=C3C=C2)c1C	734255763	JQPMXVDMKUFNEB-UHFFFAOYSA-N	425.474	1.096	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2ccc(OC)c(C(=O)N(C)C)c2)cc1OC	734414533	KAAGAPZSNCFVOW-UHFFFAOYSA-N	437.474	1.038	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)Cc2ccc(C(=O)NNC(=O)c3nonc3C)cc2)cc1	736666814	JWWIHUOQXUUDIK-UHFFFAOYSA-N	443.485	1.582	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)c2cn(Cc3ccccc3)nn2)cc1C	736770404	BFGBLXZPISRWJM-UHFFFAOYSA-N	427.486	1.877	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)N2CCN(c3cc(N4CCOCC4)ncn3)CC2)cc(C#N)n1C	737998619	CAYPWPOVBLOYJB-ODLFYWEKSA-N	446.515	1.088	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)N[C@@H]2CCC[C@@H](S(C)(=O)=O)C2)cc1OC	741093632	AZTJGYCCOGCIGY-HUUCEWRRSA-N	427.523	1.784	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1cccc(N(C)C)c1)[C@H]1CN(Cc2ccccc2)CCO1	741282480	PSPUHWCHBOIVKL-LAUBAEHRSA-N	425.533	1.986	50	20	IDGD	
CN(CCCOc1cccc(S(C)(=O)=O)c1)CC(=O)NNC(=O)c1cccc(C#N)c1	744395030	OSCSKHSYAWHXGO-UHFFFAOYSA-N	444.513	1.124	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)NCCn2cnnc2CC)c2ccccc2c1=O	745912342	RSSRTNPEGIYWKX-UHFFFAOYSA-N	440.508	1.385	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)c1ccc(F)c(S(=O)(=O)Cc2ncon2)c1	746283759	AAURKHFELDWKED-UHFFFAOYSA-N	448.432	1.160	50	20	IDGD	
CN(C)[C@@H](CNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)c1ccc(Cl)cc1	746776072	BMIDIXYCYPZUBD-SFHVURJKSA-N	445.955	1.980	50	20	IDGD	
C[C@@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(C(=O)NNC(=O)Cc3ccncc3)cc2)C1	747323062	ZAGLJQFIODZYEL-HZPDHXFCSA-N	430.530	1.752	50	20	IDGD	
Cc1ccc(C(=O)NNS(=O)(=O)c2ccc(NS(=O)(=O)C(C)C)c(F)c2)c(O)c1	749754543	CZGWHMRGJLDCLM-UHFFFAOYSA-N	445.494	1.613	50	20	IDGD	
CN(C)c1nccc(NNC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)n1	751067509	MLNSZAUYPQICET-UHFFFAOYSA-N	434.503	1.867	50	20	IDGD	
O=C(NNS(=O)(=O)c1cnn([C@@H]2CCOC2)c1)c1ccc(Br)cc1Cl	751547568	LIMNSDIPLDYTFF-SNVBAGLBSA-N	449.714	1.884	50	20	IDGD	
CSC[C@H](C(=O)NNc1nc2ccccc2c(=O)n1C)N1C(=O)[C@H]2CCCC[C@H]2C1=O	752906415	ITWPADVZGSVRIQ-DVOMOZLQSA-N	443.529	1.283	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)c2cc(S(=O)(=O)N(C)C)c(C)o2)cc1OC	753566514	QTPZGVWHCXTGEI-UHFFFAOYSA-N	439.490	1.711	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)N[C@@H]2CCN(c3ccccn3)C2)c2ccccc2c1=O	753728943	DWMGNKFFOMZDLV-MRXNPFEDSA-N	449.515	1.815	50	20	IDGD	
COC(=O)c1c(Br)ccc(NC(=O)C(=O)NNC(=O)Cc2cccnc2)c1C	753841481	SQYVIPQBEJRZAI-UHFFFAOYSA-N	449.261	1.268	50	20	IDGD	
C[C@@H](NCC(=O)NNC(=O)c1cccc(C#N)c1)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	754322114	XHIPDPVDTKBVOF-CRAIPNDOSA-N	429.521	1.944	50	20	IDGD	
O=C(CN(CC(=O)NNC(=O)C1CCCC1)Cc1ccccc1)NNC(=O)C1CCCC1	755008561	CWXZKHKYICRLHI-UHFFFAOYSA-N	443.548	1.164	50	20	IDGD	
Cc1cc(N2CCOCC2)ccc1NC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	755742531	VAAUWFYMJMUXCR-UHFFFAOYSA-N	432.502	1.702	50	20	IDGD	
O=C(Cc1cccc2ccccc12)NNC(=O)NCCN1C(=O)[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O	756096410	PSFKQFQSYMZIIC-ZCLUNYJNSA-N	432.480	1.520	50	20	IDGD	
CCn1ncc2ccc(NC(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)cc21	756269213	MLOUPWLIZVDKHN-UHFFFAOYSA-N	430.490	1.773	50	20	IDGD	
O=C(COC(=O)c1csc([C@@H]2CCCO2)n1)NNC(=O)[C@@H]1COc2ccccc2O1	756459937	NPAIAGJSKYYOEA-GJZGRUSLSA-N	433.442	1.139	50	20	IDGD	
CN(CC(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1)C(=O)OCc1ccccc1	756821367	YFLVNQNHIFDIFV-UHFFFAOYSA-N	432.502	1.839	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)Nc1ccc(-n2ncn(C)c2=O)cc1	757863213	PEVGQVGRQFKDQA-UHFFFAOYSA-N	426.433	1.201	50	20	IDGD	
COc1ccc(C(=O)CCC(=O)N2CCN(S(=O)(=O)CBr)CC2)cc1	758514072	YMOPPSMKUURVRY-UHFFFAOYSA-N	433.324	1.485	50	20	IDGD	
O=C(NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)NNC(=O)c1cccc(Cl)c1	758692000	FSHOAMNCMVETCD-UHFFFAOYSA-N	426.838	1.666	50	20	IDGD	
CS(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2cc(Br)c[nH]2)cc1Cl	758856174	RWULTPCSANVUAD-UHFFFAOYSA-N	449.714	1.978	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)C(C)(C)NC(=O)C(F)(F)F)c1	760257032	QVOLZDNPWDAIHZ-UHFFFAOYSA-N	426.189	1.676	50	20	IDGD	
C[C@H]1CCCCN1CC(=O)Nc1ccc(F)c(NC(=O)C(=O)NNC(=O)C(C)(C)C)c1	761073790	YIUWOZSEYKRXCY-ZDUSSCGKSA-N	435.500	1.771	50	20	IDGD	
Cc1cc(N2CCOCC2)ccc1NC(=O)C(=O)NNC(=O)c1ccc2ccccc2n1	763450651	QPXIMNWWZFFSLX-UHFFFAOYSA-N	433.468	1.780	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)C(=O)Nc1cccc(Cl)c1-n1cncn1	763558927	NLHLGIUKYAEKDJ-UHFFFAOYSA-N	428.792	1.049	50	20	IDGD	
COC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2c(C)nc3ccccn23)cc1F	763628595	BILRKZSELDXSEM-UHFFFAOYSA-N	428.380	1.360	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cc(S(C)(=O)=O)ccc2C)cc1C	763666503	HCGKTLCHGWIWTR-UHFFFAOYSA-N	433.486	1.180	50	20	IDGD	
COc1cccc(-c2nsc(NC(=O)C(=O)NNC(=O)COc3ccccc3F)n2)c1	763679794	CXVQBMFHQFEGTC-UHFFFAOYSA-N	445.432	1.518	50	20	IDGD	
COCc1ccccc1NC(=O)C(=O)NNC(=O)COc1ccc(Br)cc1	763696190	TZWCKQCXELVBPH-UHFFFAOYSA-N	436.262	1.760	50	20	IDGD	
COC(=O)COc1cccc(NC(=O)C(=O)NNC(=O)CC23CC4CC(CC(C4)C2)C3)c1	763736916	UKSQASZBHZILFP-UHFFFAOYSA-N	443.500	1.931	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(N3CCCC3=O)c(F)c2)cc1	763812096	OZHXGGGZNUFYNP-UHFFFAOYSA-N	428.420	1.426	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccc(N2CCSCC2)cc1	763849528	JZXJNIXNLNWLKE-AWEZNQCLSA-N	446.504	1.932	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ncn(Cc2ccccc2)n1	763873105	QXOPCWMYIRNGCD-ZDUSSCGKSA-N	426.408	1.019	50	20	IDGD	
CCc1nn(C)cc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1cccc(Br)c1	763884431	WKZHLELULRZPAS-SNVBAGLBSA-N	438.282	1.298	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)n1	763893752	YPHAYOWEVFEIEK-UHFFFAOYSA-N	449.471	1.930	50	20	IDGD	
O=C(NNC(=O)c1ccc(COc2ccccc2)o1)C(=O)Nc1cnn(-c2ncccn2)c1	763956348	ZXSJBTFJJBVFHO-UHFFFAOYSA-N	447.411	1.234	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)Nc1nc(C(C)(C)C)ns1	764004323	CTBXCJDRNDODDA-UHFFFAOYSA-N	429.300	1.336	50	20	IDGD	
COc1cc(OC)c(NC(=O)C(=O)NNC(=O)c2cc(Br)cn2C)cc1F	764005110	UPLIXJLRHHLOCB-UHFFFAOYSA-N	443.229	1.344	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1ccc(C(=O)N(C)C)c(C)c1	764011701	KQOMSJFFUVAINX-UHFFFAOYSA-N	432.864	1.759	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(-c3ccc[nH]3)cc2)c1	764078579	XDUGJCDUOBHYLL-UHFFFAOYSA-N	426.454	1.485	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)nc1)C(=O)Nc1cccc(OCC(=O)N2CCCC2)c1	764100250	KIRPBHACMBBEKD-UHFFFAOYSA-N	445.863	1.136	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccc(C)cc1OC[C@H]1CCCO1	764136047	MPYHFBIJLRSDGW-QGZVFWFLSA-N	441.484	1.890	50	20	IDGD	
Cc1ccc(Cn2cccc(NC(=O)C(=O)NNC(=O)[C@H]3Cc4ccccc4O3)c2=O)cc1	764169005	RNHHIABDLBUUMJ-HXUWFJFHSA-N	446.463	1.295	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)C(=O)Nc1ccc(-c2cc[nH]n2)cc1	764204110	SEPHUOPEHJLJJR-UHFFFAOYSA-N	430.465	1.468	50	20	IDGD	
COC(=O)c1cc(Br)ccc1NC(=O)C(=O)NNC(=O)c1cccc(C#N)c1	764234826	KWBWAOGVZLHUHK-UHFFFAOYSA-N	445.229	1.507	50	20	IDGD	
CN(C)CC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(OC(F)F)c2)cc1	764249718	CXOPDCFLUIADJY-UHFFFAOYSA-N	449.414	1.188	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)C(=O)Nc1cccc(-c2nnc3n2CCCCC3)c1	764264653	WPMRCVCTRPBZEA-UHFFFAOYSA-N	433.472	1.395	50	20	IDGD	
O=C(NNC(=O)c1cc(F)ccc1Br)C(=O)Nc1cnn(CC(F)F)c1	764271307	ZQKFNSVLONXLLM-UHFFFAOYSA-N	434.172	1.450	50	20	IDGD	
O=C1C[C@@H](Cc2ccc(NC(=O)C(=O)NNC(=O)c3cc4ccccc4o3)cc2)C(=O)N1	764331141	RAYFBDGGOHJCIK-CQSZACIVSA-N	434.408	1.038	50	20	IDGD	
CCc1noc(-c2cc(Cl)ccc2NC(=O)C(=O)NNC(=O)Cc2ccncc2)n1	764355736	HLGWSZIMNATEGK-UHFFFAOYSA-N	428.836	1.676	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)N2C[C@@H](CC(=O)N(C)C)c3cc(Cl)ccc32)o1	764370526	DOOQUBJWWKKPIY-GFCCVEGCSA-N	432.864	1.611	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)cccc1N1CCOC1=O	764371079	WRFBIERGKANNPU-UHFFFAOYSA-N	448.382	1.709	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2ccc3nc(C)oc3c2)n[nH]1	764377840	RBWPJYNVDSVMIV-UHFFFAOYSA-N	434.412	1.935	50	20	IDGD	
CC(C)Oc1cncc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1	764545304	UZWPOBZQCIDZRS-UHFFFAOYSA-N	432.502	1.728	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)NC[C@@H](NC(=O)OC(C)(C)C)C2CC2)nc2ccccc21	764545800	YPNGXDUREHLDDV-OAHLLOKOSA-N	430.509	1.750	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)c2cc(S(C)(=O)=O)ccc2C)n[nH]1	765587902	HPEMDUJFVAUVIL-UHFFFAOYSA-N	428.470	1.872	50	20	IDGD	
C[C@H](NC(=O)OC(C)(C)C)[C@@H]1COCCC1=NNC(=O)Cn1nnc(-c2ccccc2)n1	766009157	LMIGEYTZJOMHMC-HOCLYGCPSA-N	443.508	1.762	50	20	IDGD	
CC(C)(C)C(=O)NNC(=O)CN1CCN(Cc2ccc(Br)c(F)c2)CC1	767026072	SSYZFGMBEKBICO-UHFFFAOYSA-N	429.334	1.899	50	20	IDGD	
CCn1c(=O)oc2cc(S(=O)(=O)NNC(=O)C(=O)Nc3ccc(C)c(C)c3)ccc21	767444822	LPJCVRLGFJLUEV-UHFFFAOYSA-N	432.458	1.179	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNS(=O)(=O)c1cc(Cl)c(F)c(C(=O)O)c1	767737800	STJGJACZLRDFSI-UHFFFAOYSA-N	426.813	1.757	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)CCN1CCN(c2ccccn2)CC1	768638416	KCBYRUBHVNWTOU-UHFFFAOYSA-N	433.534	1.149	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)CN2C(=O)N[C@]3(CCCC(C)(C)C3)C2=O)cc1	768706493	RCNGVDASONKRCE-QFIPXVFZSA-N	444.488	1.190	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)CN2C(=O)N[C@]3(CCCC(C)(C)C3)C2=O)o1	768975379	FWNMKWFBWOBBSO-QFIPXVFZSA-N	447.536	1.773	50	20	IDGD	
COc1ccccc1-c1noc([C@@H](C)NC(=O)NNc2nc(O)c3cnn(C)c3n2)n1	770397417	CUXAWKZWDMXFAS-SECBINFHSA-N	425.409	1.515	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)NC3CCN(C[C@H]4CCOC4)CC3)nc21	770402521	XZNMJVFQMHKCGG-CYBMUJFWSA-N	432.529	1.414	50	20	IDGD	
O=C(NCc1ccc2c(c1)COC2)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	770415039	NBHSBCOFPYJMLJ-UHFFFAOYSA-N	444.513	1.646	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)CC[C@@]2(C)CCC(=O)N2)c2ccccc2c1=O	770548861	IAYTVVRDRHDCKQ-JOCHJYFZSA-N	427.505	1.797	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CC=C(c3ccc4c(c3)OCCO4)CC2)n1	771462854	KUUQTEFGMKNSHE-UHFFFAOYSA-N	428.514	1.702	50	20	IDGD	
CCOc1ccccc1C(=O)N1CCC[C@H]1C(=O)O[C@H](C)C(=O)NNC(=O)CC(C)C	771993582	PUXHEKINDHWONK-WBVHZDCISA-N	433.505	1.815	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)[C@H](C)NC(=O)c1ccc(Br)s1	772036992	MSRPBQNHGAQXBT-UWVGGRQHSA-N	448.339	1.754	50	20	IDGD	
COC(=O)c1cc(C(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)cc([N+](=O)[O-])c1	772195970	UUOOREZLLVOYKH-UHFFFAOYSA-N	434.792	1.112	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2cnn(Cc3nnc4n3CCCC4)c2)cc1OC	772636987	ZYVVPFKIFHPWGM-UHFFFAOYSA-N	440.464	1.343	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@H]1CN(C(=O)NNC(=O)c2cc(Br)c[nH]2)CCO1	773135448	MRMCJHFMJQQGOF-NSHDSACASA-N	446.302	1.357	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)C(=O)Nc2cc(N3CCCS3(=O)=O)ccc2Cl)n1	773483392	WDSSWYXRYWCJCR-UHFFFAOYSA-N	438.897	1.369	50	20	IDGD	
O=C(NC[C@@H]1CCCO1)Nc1ccc(NC(=O)C(=O)NNc2ccccc2[N+](=O)[O-])cc1	773654554	XWJDPYPBTKUWLE-HNNXBMFYSA-N	442.432	1.977	50	20	IDGD	
CCN1CCN(C(=O)Cc2ccc(NC(=O)C(=O)NNc3c(F)cccc3F)cc2)CC1	773714791	YIJFJRKQXLZHEI-UHFFFAOYSA-N	445.470	1.753	50	20	IDGD	
COC(=O)c1cccc(C#Cc2cccc(NC(=O)C(=O)NNc3nccc(OC)n3)c2)c1	773731660	TWRGBGPOPTWEJV-UHFFFAOYSA-N	445.435	1.753	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2cccc(C(F)(F)F)c2)cc1OCC(N)=O	773743668	GGXFAOPOYFJORS-UHFFFAOYSA-N	426.351	1.660	50	20	IDGD	
Cc1c(Cl)cccc1NNC(=O)C(=O)Nc1cnn(CC(=O)N2C[C@H](C)O[C@H](C)C2)c1	773768133	KUXIVDRMAIVBLC-BETUJISGSA-N	448.911	1.563	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccccc1-n1ccnn1	774001823	KDVZPGPODCRMOH-LBPRGKRZSA-N	428.836	1.474	50	20	IDGD	
CN(C)c1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)nc2ccccc12	774314505	AFJBTOPJOLCRTL-UHFFFAOYSA-N	441.513	1.626	50	20	IDGD	
O=C(NNc1ccccc1[N+](=O)[O-])Nc1ccc(F)c(S(=O)(=O)N2CCOCC2)c1	775531961	PZNIQWWKIHAQRI-UHFFFAOYSA-N	439.425	1.903	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)nc1C	778422510	PTZUHEIBAABUMV-LBPRGKRZSA-N	448.461	1.679	50	20	IDGD	
CCOC(=O)C1=NN(c2ccccc2)[C@@H](C(=O)NNc2ncc(C(=O)OCC)c(C)n2)C1	778424480	USQCFUIWXDNCHD-QGZVFWFLSA-N	440.460	1.603	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N2CC(C(C)(C)O)C2)cc1	781867604	RQJQQZOKBDYCLA-MHWRWJLKSA-N	437.500	1.570	50	20	IDGD	
COc1ccc(NNC(=O)Nc2ccc(N3CCOCC3)cc2N2CCOCC2)nc1	782012869	UKBZDITWMDFPOG-UHFFFAOYSA-N	428.493	1.912	50	20	IDGD	
O=C(NNc1ncncc1Cl)C(=O)Nc1cccc(S(=O)(=O)N2CCCCC2)c1	782166848	YBJMMOFACDSEKD-UHFFFAOYSA-N	438.897	1.386	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2Cl)n(-c2ncccn2)n1	782925437	IVTBVWGHEMUMDA-UHFFFAOYSA-N	434.243	1.677	50	20	IDGD	
COc1c(F)cc(F)cc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)NC(C)C)cn1	783265838	YLRYYCOASGTEAV-UHFFFAOYSA-N	443.432	1.137	50	20	IDGD	
Cc1ccc(C)c(NNC(=O)C(=O)Nc2cnn(CC(=O)N3C[C@H](C)O[C@H](C)C3)c2)c1	783361310	DWZVIZATEFMAQQ-IYBDPMFKSA-N	428.493	1.218	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2cc(C(F)(F)F)ccc2-n2cccn2)CCS(=O)(=O)C1	783427226	NGXPPHDSKBZUSN-MRXNPFEDSA-N	445.423	1.028	50	20	IDGD	
COc1cc(C=NNC(=O)C(=O)NCc2ccc(Cl)cc2)ccc1OCCC(=O)O	783863394	KXODTKUPWALMAI-UHFFFAOYSA-N	433.848	1.969	50	20	IDGD	
O=C(NNC(=O)C(=O)N1CCCC1)C(=O)Nc1ccc(N2CCCCCCC2)c(F)c1	783998593	DGKALCOVPRLGJI-UHFFFAOYSA-N	433.484	1.305	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NC[C@@H]1CCCCS1(=O)=O	784176312	NMTVYHMAHQACJA-FZMZJTMJSA-N	448.339	1.514	50	20	IDGD	
CCOC(=O)Cn1cccc(NC(=O)C(=O)NNc2c(Cl)cc(F)cc2Cl)c1=O	784878781	UBMDDBCTLVGROT-UHFFFAOYSA-N	445.234	1.939	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)c(Br)n1	785023530	KEYWXPQJKJNQMW-UHFFFAOYSA-N	438.194	1.166	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)CCOc1ccccc1I	785133461	OLEXPHZSNUJXRT-UHFFFAOYSA-N	447.273	1.512	50	20	IDGD	
O=C(Cc1ccccc1CO)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	786612762	DIRZVUGDKGWANU-UHFFFAOYSA-N	431.514	1.357	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N(C)Cc2ncnn2CC(F)F)cc1Br	787864791	JLYKKJPOKZKNOA-UHFFFAOYSA-N	447.240	1.801	50	20	IDGD	
NS(=O)(=O)c1ccccc1NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	788223834	ONOMCLXHKKOINJ-UHFFFAOYSA-N	438.531	1.266	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)Nc1nc([C@@H]2C[C@H]3CC[C@H]2C3)cs1	789731680	IHCHXPDWVORTTL-APNQJHFZSA-N	442.497	1.973	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)CC(=O)N2C	789783696	YCLPQGODWABGRM-NSHDSACASA-N	430.848	1.412	50	20	IDGD	
Cc1ccc(NNC(=O)NCC(=O)Nc2ccc(I)cc2)nn1	790890790	ODXJOOJYYUYACT-UHFFFAOYSA-N	426.218	1.654	50	20	IDGD	
CC[C@@H](C)n1ncc(NC(=O)C(=O)NNC(=O)c2cc(Br)cn2C)c1C	792269848	WERFIFCQDKAMHT-SECBINFHSA-N	425.287	1.663	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cccc(OC(F)F)c2)cc1OC	797004670	KQUDZSXXYUIZOA-UHFFFAOYSA-N	437.355	1.483	50	20	IDGD	
O=C(CCCc1cccs1)NNC(=O)C(=O)Nc1ccc(F)c(N2CCOC2=O)c1	797006295	JZCROBBXSMKPDD-UHFFFAOYSA-N	434.449	1.953	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)CSc2ccccc2OC)c(C)c(OC)c1	800625684	RYNZXHPWSGCKOK-UHFFFAOYSA-N	433.486	1.899	50	20	IDGD	
COCCCS(=O)(=O)NCC(=O)NNC(=O)Nc1c(Cl)cc(Cl)cc1Cl	802070926	JHDDORQDJBAWCA-UHFFFAOYSA-N	447.728	1.755	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NCC(=O)NNC(=O)Nc1ccc(Cl)cc1Cl	802089120	AIEZKGJGODNVSG-UHFFFAOYSA-N	434.280	1.787	50	20	IDGD	
O=C(NNC(=O)C(=O)N1CCCC1)N[C@@H]1CN(Cc2ccccc2)C[C@H]1c1ccccc1	802429569	XZVMKUAQAFEUGM-LEWJYISDSA-N	435.528	1.607	50	20	IDGD	
CC1(C(=O)NNC(=O)C(=O)Nc2ccccn2)CCN(c2ccc(Cl)cc2C#N)CC1	804444162	WHWZWYKCILTANA-UHFFFAOYSA-N	440.891	1.999	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)C(=O)Nc2cc(F)c(N3CCOCC3)cc2F)c1	806978229	RRDPBGYRJYXRCU-UHFFFAOYSA-N	429.383	1.073	50	20	IDGD	
O=C1COc2c(cc(Cl)cc2NC(=O)C(=O)NNC(=O)c2cccc3ncccc23)N1	806978425	ATCHFAABVVJJQW-UHFFFAOYSA-N	439.815	1.619	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)NC[C@@H](c1ccc(F)cc1)N1CCOCC1	806999821	AHUHZFFXOLUSCP-SFHVURJKSA-N	446.479	1.617	50	20	IDGD	
COc1cc(OC)cc(Oc2cccc(CNC(=O)NNC(=O)C(=O)N3CCCC3)c2)c1	807423514	QPXZMFFTWVCPFJ-UHFFFAOYSA-N	442.472	1.949	50	20	IDGD	
COC(=O)c1ccc(C(F)(F)F)cc1NC(=O)C(=O)NNc1ccc(-n2ccnc2)nn1	807430064	ZSMIYWUNRWRDCS-UHFFFAOYSA-N	449.349	1.550	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)NCc1ccncc1OC[C@H]1CCOC1	807616735	WMXHYRRRSXAWJH-AWEZNQCLSA-N	432.502	1.825	50	20	IDGD	
C[C@H]1CN(c2cccc(F)c2)CCN1C(=O)NNC(=O)c1csc(N2CCOCC2)n1	814271214	XRXIZPKYUIYKPJ-AWEZNQCLSA-N	448.524	1.684	50	20	IDGD	
CN(C)c1ccc(C2(C(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)CC2)cc1	814722028	GYGNGEBKCQKOGL-UHFFFAOYSA-N	430.530	1.496	50	20	IDGD	
COc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)C(=O)NNc1cccc(Cl)n1	815725813	BURKUDVWTZSGHE-UHFFFAOYSA-N	427.870	1.076	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NNC(=O)[C@@H]2COCCN2CC(F)(F)F)C1	816510407	VLGZTNGTEMYHOE-OLZOCXBDSA-N	438.447	1.044	50	20	IDGD	
COc1ccc(CC(=O)NNc2cccc(Cl)n2)cc1S(=O)(=O)N1CCOCC1	817011835	LIZQNZAKXUNJGM-UHFFFAOYSA-N	440.909	1.450	50	20	IDGD	
C[C@@H](NC(=O)c1n[nH]c2ccccc12)C(=O)NNc1ccccc1S(=O)(=O)N(C)C	817053238	JSLQOUJLSSGUAX-GFCCVEGCSA-N	430.490	1.075	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C[C@](O)(c2nccn2C)C(F)(F)F)cc(OC)c1OC	818648142	OSOLQRVNCOTAEX-KRWDZBQOSA-N	446.382	1.047	50	20	IDGD	
Cc1ccccc1[C@@H](CC(=O)NNC(=O)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1)NC(N)=O	819658102	ISOWOYFGJSUZEF-NVXWUHKLSA-N	447.536	1.889	50	20	IDGD	
COc1cc(CC(=O)NNC(=O)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)cc(OC)c1O	819658276	KUDJNEXPWQPWIY-CQSZACIVSA-N	437.493	1.746	50	20	IDGD	
CSC[C@@H](C(=O)NNC(=O)COc1ccc(C)cc1)N1C(=O)[C@H]2CCCC[C@H]2C1=O	901472737	HMFZWVFZYCSHQM-BBWFWOEESA-N	433.530	1.428	50	20	IDGD	
Cc1c(C=NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)c(=O)n(-c2ccccc2)n1C	912797833	JQYKYNALOQAZLB-UHFFFAOYSA-N	447.904	1.549	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)C1CCCC1)N(S(C)(=O)=O)CC2	913161254	GACSTXNFRDYNCH-MRXNPFEDSA-N	439.534	1.290	50	20	IDGD	
CCCCn1c(=O)nc(O)c2c1nc(COC(=O)/C(C#N)=C/c1cc(C#N)n(C)c1C)n2C	913286879	MHHRFJPDZWNICW-OVCLIPMQSA-N	449.471	1.805	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)[C@H]2CC(=O)N(c3ccc(F)cc3F)C2)cc1	914995710	YEGQYXFOBAJBMT-AWEZNQCLSA-N	431.395	1.631	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)C3=NN(c4ccccc4)C(=O)[C@H](C)N3)cc2C1	915188931	ISOCSSXSEADEAU-STQMWFEESA-N	425.514	1.972	50	20	IDGD	
Cc1sc(=O)n(CC(=O)N([C@H]2CCS(=O)(=O)C2)N(C)C)c1-c1ccc(F)cc1	915830434	ZJLWORMVYFECOY-HNNXBMFYSA-N	427.523	1.517	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NN=Cc1cccc(O)c1O	915915328	ZKSJAMRUAAKDJY-UHFFFAOYSA-N	433.486	1.202	50	20	IDGD	
COCCN(CCOC)S(=O)(=O)c1ccc(C(=O)NNc2nc(C)cc(C)n2)cc1	916160197	PMHROMLVZVREKW-UHFFFAOYSA-N	437.522	1.134	50	20	IDGD	
Cn1ccnc1[C@](O)(CCNC(=O)NNC(=O)COc1ccccc1F)C(F)(F)F	916377182	ABIHDULBQXEODV-MRXNPFEDSA-N	433.362	1.109	50	20	IDGD	
CNS(=O)(=O)c1cccc(CNC(=O)NNC(=O)c2cc(C)nc3ccccc23)c1	916485646	DYYVYYFROXAGPX-UHFFFAOYSA-N	427.486	1.596	50	20	IDGD	
Cc1cc(C(N)=O)ccc1NC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	916633859	POKLLDMOEIKFGQ-UHFFFAOYSA-N	445.501	1.345	50	20	IDGD	
CCCn1nc(C(=O)NNS(=O)(=O)c2ccc(C#N)c(Cl)c2)c2ccccc2c1=O	917722494	XARAJNUBNZXVNK-UHFFFAOYSA-N	445.888	1.955	50	20	IDGD	
C[C@H](NC(=O)NNc1ccc(-n2cccn2)nn1)c1ccc(S(=O)(=O)N(C)C)cc1	918106027	VUGYAXOEIHQHEH-ZDUSSCGKSA-N	430.494	1.300	50	20	IDGD	
O=C(NC[C@H]1CCCOC1)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	918124227	LHLFESHIHGZDKS-CYBMUJFWSA-N	438.531	1.920	50	20	IDGD	
O=C(NNc1ccc(Br)cc1)c1ccc(S(=O)(=O)N2CCOCC2)o1	918320454	KJJZWOZOPUUXTG-UHFFFAOYSA-N	430.280	1.820	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)[C@H](CCSC)N1C(=O)c2ccccc2C1=O	919820252	RBAAWSGZIKAQCV-KRWDZBQOSA-N	441.509	1.803	50	20	IDGD	
CC(C)C[C@@H](C(=O)NNC(=O)NCCc1cccs1)N1C(=O)[C@H]2CC=CC[C@H]2C1=O	920860590	PSBJLCXOQCRUGF-BBWFWOEESA-N	432.546	1.987	50	20	IDGD	
O=C(O)COc1ccc(S(=O)(=O)NNC(=O)NCc2cccc(C(F)(F)F)c2)cc1	921298111	PSUWQFSVUZCUJK-UHFFFAOYSA-N	447.391	1.862	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NCc2cccc(CN3CCN(C)CC3)c2)cc1C	1318284414	XALXJACKRJHCOC-UHFFFAOYSA-N	439.560	1.960	50	20	IDGD	
CS(=O)(=O)CC[C@@H](NS(=O)(=O)/C=C\c1ccccc1)C(=O)N1CC=C(C#N)CC1	1321049146	RKBBHAJMJUGYEE-GIIHOQTISA-N	437.543	1.062	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2cc(Br)cc([N+](=O)[O-])c2)cc1	1322591838	VSMSTGPYIHTVSB-UHFFFAOYSA-N	430.236	1.989	50	20	IDGD	
COc1cc2c(cc1OC)CN(C(=O)CCC(=O)NNc1nncc(N)c1Cl)CC2	1340553272	CBSALGPBNMAOBK-UHFFFAOYSA-N	434.884	1.538	50	20	IDGD	
O=C(Cn1c(=O)ccn(Cc2ccccc2)c1=O)NNc1cncc(Br)c1	1341215375	TYKGQWQNCQFJBE-UHFFFAOYSA-N	430.262	1.359	50	20	IDGD	
Cc1nc2sccn2c1C(=O)N1CC[C@]2(CN(C(=O)CCBr)CCO2)C1	1778716616	ZACOPRGYPUFWCZ-KRWDZBQOSA-N	441.351	1.933	50	20	IDGD	
O=C(C#CC1(O)CCCCC1)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1779066985	KEIGKWLRNMSDII-QAPCUYQASA-N	431.302	1.205	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@](C)(Cl)CCl)C3)C2)nc2nccn12	1781234122	IQYIRQLWWLMDNM-MOPGFXCFSA-N	440.331	1.718	50	20	IDGD	
Cc1nccn1CC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Br)C2	1781557987	JRNGUXCGXNUYLK-FRFSOERESA-N	431.306	1.396	50	20	IDGD	
C=C[C@@H](O)C(C)(C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)Br)C1	1781997946	OVMNFJOIBXQNGC-DEXNDLTESA-N	431.371	1.857	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(F)nc1C)C2	1782173471	DMJRMOCLIGAGAL-JXXFODFXSA-N	427.904	1.910	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)n1ccccc1=O)C2	1782175686	PCRMBHKFRNETGW-BIZBXSGISA-N	439.940	1.177	50	20	IDGD	
COc1cc2c(O)cccc2cc1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1782388029	XYRWSLCBYZSQQI-PGRDOPGGSA-N	448.903	1.597	50	20	IDGD	
C[C@@H](Sc1ccccn1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2	1782495773	RMXLELDFKVAXLQ-UIVXKWKOSA-N	441.981	1.676	50	20	IDGD	
Cn1cnc(C(=O)N2CCO[C@]3(CCN(C(=O)/C(C#N)=C/c4ccc(F)cc4F)C3)C2)n1	1782863527	FLXXZOSDCGDWNU-OMKLEDIQSA-N	442.426	1.144	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3nc4ccc(F)cn4n3)CCO2)C1	1783535619	FVJHHNTWZBYRGO-GTNSWQLSSA-N	440.273	1.095	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](C)Br)C3)C2)c1	1783538573	TZIBHVOAYUCXFD-YJYMSZOUSA-N	438.322	1.872	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(C(=O)OC)cc3C)CCO2)C1	1783885371	ZOZUCEZUFAVQQD-DYESRHJHSA-N	438.908	1.479	50	20	IDGD	
O=C(c1cc([N+](=O)[O-])cc2c1OCC2)N1CCO[C@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783948595	WUQPQUQJFMBWRS-SFHVURJKSA-N	444.271	1.777	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCC(=O)N3CCCC3)[C@H]2C1	1785002021	LHQFQPCTMCKVMB-BZSNNMDCSA-N	439.629	1.220	50	20	IDGD	
O=C(CN1CCS(=O)(=O)CC1)Nc1ccc(C2(NC(=O)[C@H](F)Cl)CCC2)cc1	1786688743	DJTOBQJPRIIYPY-INIZCTEOSA-N	431.917	1.385	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@]3(C)C[C@H]3C)C[C@@H]21	1787507559	DOLIQLDBLGRNGN-HDBZRWKTSA-N	429.521	1.146	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4nonc4c3)[C@H]2C1	1787881719	QGGAQRWOHUQTLK-MPGHIAIKSA-N	432.553	1.668	50	20	IDGD	
Cc1noc(N)c1C(=O)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1	1788009283	SVUGYJAVJGXFHC-UHFFFAOYSA-N	434.261	1.307	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cccc([N+](=O)[O-])c3)C[C@@H]21	1788762006	KICVDNHHCDFFFB-WDSOQIARSA-N	449.580	1.969	50	20	IDGD	
CC1(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)/C(C#N)=C/c4ccc(F)cc4F)[C@H]3C2)COC1	1790694101	XVDRVJLZQVSMOE-IPHSZAQTSA-N	445.466	1.888	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](C)Br)[C@H]3C2)o1	1791056319	STFHBGRBVXNZKS-NHULGOKLSA-N	442.310	1.615	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN3CCCCC3=O)[C@H]2C1	1791179451	XYCBPFZVMWPDLI-VGWMRTNUSA-N	444.370	1.010	50	20	IDGD	
COc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](O)CCl)C[C@@H]32)cc(OC)c1C	1792045206	FHLCIJHCQNIGMT-FJXLLPKBSA-N	440.924	1.205	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nccc3[nH]ccc13)C2	1792868426	ZEPIOVGXHXGNGD-JFILPPLUSA-N	435.322	1.797	50	20	IDGD	
O=C(Cc1n[nH]c2cc(Cl)ccc12)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCl	1793115711	TZKIVXJTKCTUGX-IPJQOSJUSA-N	425.316	1.997	50	20	IDGD	
CN1CCC[C@H]1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1793873968	AEWQCNFWPMMXRR-QEOTZNIISA-N	442.988	1.851	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CC1CCC1)C2	1793882629	OXBTYSWJLZWHJJ-DFGXFYAUSA-N	443.972	1.898	50	20	IDGD	
Cc1cccnc1CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)CBr)C2	1793990425	GFUGMBMSQHKCCV-OAFZBRQQSA-N	438.366	1.943	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1ccc(Cl)nc1F	1794247309	OHENBRPUYLFFOI-IWXIMVSXSA-N	438.656	1.768	50	20	IDGD	
O=C(CNc1ccc(F)cc1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2	1795542072	OQVNECSKZVHFQW-OXUXUCFPSA-N	432.265	1.518	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cc1cc[nH]n1)C2	1799221992	XAKVSAXVSSWLDN-MUJYYYPQSA-N	441.444	1.738	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1(c3ccc(O)cc3)CC1)C2)[C@@H](F)Br	1799343095	MVEGSAGNCTYVJK-NOXHYTERSA-N	441.297	1.704	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(F)c1Cl)c1ccc(B(O)O)cc1	1800455364	GHKYQNSAQQOUFO-MUJYYYPQSA-N	430.672	1.725	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nc3ccccc3[nH]1)C2	1800641200	QZHAUZYNFHDOQN-OQMKEHIESA-N	435.322	1.940	50	20	IDGD	
COc1cccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)Br)c1C	1800762491	CDOWSWSXTSWTHX-VWPFQQQWSA-N	425.323	1.990	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(OC)ccc1Cl)C2	1800982629	HQHKYBXOCDUMNY-LZDSYCOUSA-N	431.316	1.806	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CC(=O)N(C3CCCC3)C1)C2)C(Cl)Cl	1801015298	CUOCEPSWFZFQET-NFFDBFGFSA-N	432.348	1.171	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H](CNC(=O)Cc2cnccn2)[C@@H]1c1cccnc1	1803300234	IUNISJKBVNZPRR-UTKZUKDTSA-N	427.581	1.972	50	20	IDGD	
C=CCO[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1803571097	MOYZEDXQAJSAIM-PLMTUMEDSA-N	431.537	1.052	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)C(C)(C)NCCC#N)[C@@H]1c1cccnc1	1807149127	CZNZBZKMQGRBFD-BZSNNMDCSA-N	435.956	1.623	50	20	IDGD	
N=C(N)SCC(=O)N1CC[C@H](CNC(=O)[C@H](F)Br)[C@@H]1c1cccnc1	1808661671	OJABGHVKELSLBZ-WXHSDQCUSA-N	432.319	1.405	50	20	IDGD	
CC1(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)[nH]n2)CCC1	1814401973	FKNYUNOBHOUMJS-INIZCTEOSA-N	425.493	1.904	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H]1C[C@@H]1F)CC2	1817276530	ULTRZHXYZMOCGU-IUUVCZKVSA-N	432.481	1.547	50	20	IDGD	
Cc1nc2sccn2c1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)CCl)CC2	1819352174	XBLUYBJCOWEROZ-KOLCDFICSA-N	439.950	1.986	50	20	IDGD	
O=C1C[C@H](C(=O)N2CCCC[C@@H]2c2cc(NC(=O)[C@H](F)Br)n[nH]2)CCN1	1820936929	IFWZZGZUGQNFGG-UDZFHETQSA-N	430.278	1.619	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCc2ccc(O)nn2)n[nH]1	1821640890	ZFCOGALIIWUCIR-DZGCQCFKSA-N	436.900	1.784	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(O)ccc3F)sc2C1	1823289271	FGWYJNGPYVATSW-LLVKDONJSA-N	449.508	1.587	50	20	IDGD	
CCC[C@H](NC(C)=O)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1	1823442220	JUKOAJNOLREONN-DOTOQJQBSA-N	449.556	1.080	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CNC(=O)OC)CC2	1825453125	PEFPVMWZUAXYEM-BDAKNGLRSA-N	433.328	1.585	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccco2)CC1	1825772887	DFNNURQIPCLLFY-GOSISDBHSA-N	425.489	1.825	50	20	IDGD	
CCCNC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](Cl)COC)sc2C1	1825994678	NETZZNDOAXDRBE-NEPJUHHUSA-N	430.958	1.615	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)/C=C\C(=O)NC1CC1)CC2	1826000511	UWMBZSGLXPYYQL-PBWNMSGQSA-N	426.926	1.144	50	20	IDGD	
CC(C)=NO[C@@H](C)C(=O)N[C@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1	1826088361	DYUBLASGUMAZKB-STQMWFEESA-N	438.554	1.229	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](C)n3cnnn3)sc2C1	1826985025	PNFJZAMUEHCIBQ-DJLDLDEBSA-N	428.316	1.086	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccnc2)CC1	1828926000	WXROAMNZYUMTPG-FQEVSTJZSA-N	436.516	1.627	50	20	IDGD	
Cc1cnc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)s1	1830535978	WANHKYKVQZXWEC-YVEFUNNKSA-N	446.367	1.553	50	20	IDGD	
CC[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)Br)C2)C1)N(CC)CC	1831674127	CTHXDJJMMGMQLN-FRQCXROJSA-N	448.402	1.347	50	20	IDGD	
CNc1ccc(C(=O)N2CCOC[C@]3(CN(C(=O)CCBr)CCO3)C2)cc1	1834822457	OIRMYKDOYLPJAG-IBGZPJMESA-N	440.338	1.583	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)Cc3nnc(C)s3)CC2)CC1	1834855592	YTYAIQUPPMNTEH-MRXNPFEDSA-N	428.002	1.978	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](N)c1cccc(Cl)c1)CCO2	1835733287	LQOLPIRQAIOTRF-ABSDTBQOSA-N	444.359	1.814	50	20	IDGD	
Cc1n[nH]c(C)c1C(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)Br)CC2)CC1	1835870938	RCTLSFMAKCDDGA-GFCCVEGCSA-N	440.386	1.995	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3c(F)cncc3F)CC2)CC1	1835998510	QFIHRYTVRSXECF-HNNXBMFYSA-N	444.910	1.799	50	20	IDGD	
O=C([C@H](F)Br)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836717891	LMIBJLJTYNJKDL-STQMWFEESA-N	429.714	1.275	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cc(O)nc(O)n3)CC2)CC1	1836920139	YLCHJMWGKZNROG-OAHLLOKOSA-N	440.928	1.908	50	20	IDGD	
O=C(c1ccc2scnc2c1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1837063316	OFDXYGXQSWKUPP-MAUKXSAKSA-N	427.885	1.901	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)C3CCC3)CC2)CC1	1837602307	HWMMINQOJKIECQ-UHFFFAOYSA-N	429.521	1.097	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccncc3O)CCO2)C1	1837819531	ORUGXKBOPNPKJF-ZWKOTPCHSA-N	432.304	1.094	50	20	IDGD	
O=C(c1ccn(-c2ccccc2)n1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1838745082	HALAAOPXAOAUFS-XLIONFOSSA-N	436.871	1.477	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)CCc3ncc[nH]3)CC2)CC1	1838785593	IUBQGLURFBOEAE-QGZVFWFLSA-N	426.945	1.595	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3c(F)cccc3Cl)CCO2)C1	1838871049	DSKIPLYHEVAZQF-AUUYWEPGSA-N	449.306	1.803	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(O)cc3)CCO2)C1	1838971137	DHSZPLQLUCEREX-MOPGFXCFSA-N	431.316	1.699	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3c(C)nc4ncccn34)C2)C1	1839144513	CQRZLFUUJDWEPT-MGPUTAFESA-N	435.912	1.125	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)n3cccc3)C2)C1	1840036351	IVVQQQBEBZDOTO-HDMKZQKVSA-N	428.327	1.289	50	20	IDGD	
CC(C)(C)n1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)n1	1840187030	ZWSNJCHFQPIUHL-GOSISDBHSA-N	433.336	1.512	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC12CN(C(=O)[C@H](O)CNC(=O)OC(C)(C)C)C2	1841285078	BBZNUBWFEWZUAI-QWHCGFSZSA-N	448.358	1.106	50	20	IDGD	
COc1ccc([C@H]2C[C@@H]2C(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)cc1	1841573396	AFAIMWQREMAYKB-MOPGFXCFSA-N	449.511	1.314	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCCC12CN(C(=O)CCc1cnc[nH]1)C2	1841924145	BEQGNJQVUVJEIS-HNNXBMFYSA-N	439.944	1.678	50	20	IDGD	
Cc1noc(CC(=O)N2CC3(CCCN3C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)n1	1841924464	OOVMRBXDGWSGFR-ZDUSSCGKSA-N	441.916	1.256	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1cc3cc[nH]c3cc1F)C2	1844264605	OMBUXIZNOLEPGF-UHFFFAOYSA-N	436.447	1.436	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC2(CCCN2C(=O)c2cnc3c(c2)CCNCC3)C1	1845796179	NMJNTRQNHRDNTL-CQSZACIVSA-N	435.366	1.618	50	20	IDGD	
O=C(Cn1nccn1)N1CC2(CCCN2C(=O)[C@@H](Br)Cc2ccccc2)C1	1845942130	MQCBEMZWDXTMPR-INIZCTEOSA-N	432.322	1.488	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H]2C[C@@]21C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl	1847563611	LENMHVRVNKMPIV-SUFCVFMQSA-N	427.929	1.187	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)Cn1c(=O)oc2cc([N+](=O)[O-])ccc21	104797473	BHPKGOLNOTXUEN-UHFFFAOYSA-N	430.373	1.128	50	20	IDGD	
C[C@@H](c1ccc(-n2cncn2)cc1)N(C)C(=O)NNC(=O)CNC(=O)c1cccs1	725871973	MIULTNBXGUEMBO-ZDUSSCGKSA-N	427.490	1.492	50	20	IDGD	
CC(C)NC(=O)C(=O)NNC(=O)[C@@H]1C[C@H]2CCCC[C@H]2N1C(=O)c1ccc(F)cc1F	726157666	YCWXSJKJRBPDCE-JLZZUVOBSA-N	436.459	1.410	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)CCCN1C(=O)CN(C)C1=O	726196372	ONIPWTCTHGUKEJ-NSHDSACASA-N	441.282	1.038	50	20	IDGD	
CC(C)CC(=O)Nc1cccc(CNC(=O)NNC(=O)CNC(=O)c2cccs2)c1	726243109	GPGQSYUJIAIYPR-UHFFFAOYSA-N	431.518	1.993	50	20	IDGD	
COc1cc(C(=O)NNC(=O)N[C@H]2CCc3nc(C)nn3C2)ccc1OCCC(C)C	727228986	KRPZEVGSFUKMHG-INIZCTEOSA-N	430.509	1.979	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)CN2C(=O)[C@H]3CCCC[C@@H]3C2=O)c1	728528475	JCCXRWRINCNDOW-RYUDHWBXSA-N	438.278	1.394	50	20	IDGD	
O=C(NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12)c1ccc2nncn2c1	729298293	ABZMJGDRYJZRDC-UHFFFAOYSA-N	439.435	1.562	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)c2cccc3c2O[C@@H](C)C(=O)N3)c2ccccc2c1=O	729300778	UMYLFXNQPZRXRT-LBPRGKRZSA-N	435.440	1.772	50	20	IDGD	
C[C@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)NNC(=O)c2cccc3ncccc23)C1=O	730227011	YGIDEFMOQCZXFJ-JOCHJYFZSA-N	435.415	1.602	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H]2CCOc3ccc(F)cc32)c1	731760713	WYDYGCOOZSOFFC-MRXNPFEDSA-N	436.465	1.544	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)[C@H]2CC(=O)N(c3ccc4c(c3)CCC4)C2)C[C@@H](C)O1	732262036	HYXVAYHEVHXZNL-FCEWJHQRSA-N	428.533	1.175	50	20	IDGD	
CC(=O)N[C@H](CC(=O)NNC(=O)CCN1C[C@@H](C)O[C@H](C)C1)c1c(F)cccc1F	732263729	OATRVAWGKHZXGI-PBFPGSCMSA-N	426.464	1.179	50	20	IDGD	
CCc1nc(CN2CCC(CNC(=O)NN[C@]3(C)CCS(=O)(=O)C3)CC2)cs1	732470537	JOCQCUIAAMAJDZ-GOSISDBHSA-N	429.612	1.299	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)NCCCCN2C(=O)c3ccccc3C2=O)c1	732472341	QECFBLRKPHESCO-UHFFFAOYSA-N	440.456	1.724	50	20	IDGD	
CCc1cc(N2CCC[C@@H](NC(=O)NNC(=O)[C@H](C)Oc3ccc(F)cc3)C2)ncn1	732914495	QTHCFRPOICSWSH-WMLDXEAASA-N	430.484	1.945	50	20	IDGD	
CCOCCCn1c(NNC(=O)[C@@H](C(C)C)N2CCCC2=O)nc2ccccc2c1=O	733265405	CSMOPSUCPZSLBH-LJQANCHMSA-N	429.521	1.913	50	20	IDGD	
CCN(CC)C(=O)CN1CCCN(C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)CC1	733350521	YACIYUDETQVCNA-UHFFFAOYSA-N	441.536	1.103	50	20	IDGD	
O=C(NCc1ccnc(OC2CCOCC2)c1)NNC(=O)[C@@H]1COc2ccccc2O1	733352258	AQLYCGZLDXRTRC-SFHVURJKSA-N	428.445	1.310	50	20	IDGD	
COc1ccc([C@@H]2[C@@H](C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)CCC(=O)N2C)cc1	734419465	SAWFKSLYPUWXMX-AZUAARDMSA-N	449.471	1.042	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(/C#N)C(=O)N[C@H]2CCN(CCN3CCOCC3)C2)c1C	734468287	QHJJXRDNZXGDSN-RMFOQJOXSA-N	443.592	1.742	50	20	IDGD	
C[C@H]1Cc2ccccc2N1S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cnn(C)c2)c1	735445221	PDCTVTIQOFOVCO-AWEZNQCLSA-N	439.497	1.635	50	20	IDGD	
CC(=O)NCC(=O)N1CCc2cc(C(=O)NNC(=O)c3cc4c(s3)CCC4)ccc21	735647544	RRFZWWLYZVMTFN-UHFFFAOYSA-N	426.498	1.337	50	20	IDGD	
CSC[C@H](C(=O)NNC(=O)COCc1ccccc1)N1C(=O)[C@H]2CCCC[C@H]2C1=O	737636619	SYBMWHNPTFSMKS-IXDOHACOSA-N	433.530	1.257	50	20	IDGD	
CN1CC[C@@H](NC(=O)/C(C#N)=C\c2cn(CCC(N)=O)nc2-c2ccc(Cl)cc2)C1=O	737993279	GRKGIJBGSOQVMT-OOXMNIKJSA-N	440.891	1.333	50	20	IDGD	
CC(=O)N1CCN(c2ccccc2CNC(=O)NNC(=O)COCc2ccccc2)CC1	739010693	SKXKKDYRIJGPNH-UHFFFAOYSA-N	439.516	1.402	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCC2(c3cccc(F)c3)CC2)cc1	740484661	QZQHEFAODIWWOA-UHFFFAOYSA-N	448.520	1.817	50	20	IDGD	
C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)NNC(=O)CNC(=O)c1cccs1	740913042	MAAXRVSRYUAEDN-INIZCTEOSA-N	429.546	1.815	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNS(=O)(=O)c2ccccc2S(N)(=O)=O)cc1	741646679	KKEFLSDGZPGKDN-UHFFFAOYSA-N	441.531	1.382	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)[C@H]2CCCCN2C(=O)c2ccc(O)nn2)c1C	741740637	CTEWGEJNEWTIJV-DOTOQJQBSA-N	441.488	1.409	50	20	IDGD	
COc1ccnc(NNC(=O)[C@H](Cc2c[nH]c3ccc(Br)cc23)NC(C)=O)n1	742043842	BBAFHLQGOSUNOD-HNNXBMFYSA-N	447.293	1.920	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)[C@@H]2SCCc3sccc32)ccc1Cl	742477718	IWFIUIQMFOZGGF-CYBMUJFWSA-N	431.948	1.841	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)N[C@H](C)[C@H](C)N2CCOCC2)cc1Cl	743627059	RTKAFLJXMHPIAR-NEPJUHHUSA-N	429.905	1.802	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)c2ccccc2c1=O	743805024	AYPQUVUSRBERML-UHFFFAOYSA-N	429.458	1.286	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1ccnc(N2CCCCC2)n1	744620062	BESANEAIVOKYJZ-UHFFFAOYSA-N	446.533	1.245	50	20	IDGD	
COc1cc(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)cc2c1O[C@@H](C)C2	744620208	HCXXVFZESXQYMV-AWEZNQCLSA-N	447.513	1.796	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)c2ncoc2-c2ccc3c(c2)OCCO3)c1	745296850	XLDNPLORIWRFKH-UHFFFAOYSA-N	448.391	1.602	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)N[C@H](c2ccccc2)c2cccc(S(C)(=O)=O)c2)cn1	745908501	HPNAVZRSZICKLF-GOSISDBHSA-N	427.486	1.557	50	20	IDGD	
CSCC[C@H](NC(=O)Cc1ccccc1)C(=O)NNC(=O)Cc1cn2ccccc2n1	746636844	HMEAUCCEZPEZNJ-SFHVURJKSA-N	439.541	1.505	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)N2CCN(C(=O)Cc3ccc(Cl)cc3)CC2)cc1	747103411	IIPBWPPTWQNOTP-UHFFFAOYSA-N	425.876	1.953	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)[C@H]2CCCCN2Cc2ccc(F)cc2)c2ccccc2c1=O	747345623	RTBRJBMBGBUBNW-LJQANCHMSA-N	437.475	1.888	50	20	IDGD	
COc1cc(C)nc(NNC(=O)NNC(=O)c2ccc(OC)c(Br)c2)n1	747501143	HFPFIWIEQRHVPW-UHFFFAOYSA-N	425.243	1.536	50	20	IDGD	
CCCCN1C(=O)CC[C@H](C(=O)NNC(=O)C(=O)N2CCCC2)[C@H]1c1ccccc1OC	748247844	VWLAYLVLDQHWTE-FXAWDEMLSA-N	444.532	1.545	50	20	IDGD	
Cc1nc(Cl)cc(NNC(=O)[C@@H]2CCCN2C(=O)/C=C/c2ccc(C(N)=O)cc2)n1	748333193	BXUKTKJIMVYYFJ-PPYMECGQSA-N	428.880	1.685	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)CS[C@H]1CCS(=O)(=O)C1	748594696	WPRBJRPGTJXNBT-LBPRGKRZSA-N	435.593	1.127	50	20	IDGD	
C[C@@]1(c2ccc(C(=O)NNc3ccc(S(=O)(=O)C(F)F)cc3)cc2)NC(=O)NC1=O	751060307	BTKUSHCLGASYLG-SFHVURJKSA-N	438.412	1.494	50	20	IDGD	
Cc1noc(C)c1COc1ccc(CC(=O)NNC(=O)CNC(=O)c2ccco2)cc1	751206292	CKFGKLMUTHUNGX-UHFFFAOYSA-N	426.429	1.583	50	20	IDGD	
C[C@@H](NC(=S)NNC(=O)CS(=O)(=O)Cc1cccc(Br)c1)C1CC1	751620439	ULHHXFQXAYBFAT-SNVBAGLBSA-N	434.381	1.658	50	20	IDGD	
CCOCCCn1c(NNC(=O)CCn2c(C)csc2=O)nc2ccccc2c1=O	752046973	FANDANPUIPOLHF-UHFFFAOYSA-N	431.518	1.888	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)N[C@H]3CCOC3)c2)cc1	752703341	HYEFDGZWWYDWHG-HNNXBMFYSA-N	434.474	1.229	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2cnc3ccsc3c2)c1	753070001	ZDFKXJNAAHHEPW-UHFFFAOYSA-N	440.528	1.170	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2nnc3ccccn23)c1	756432137	HRMOZFAISSPJEV-UHFFFAOYSA-N	431.478	1.226	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)Nc2ccc3c(c2)C(=O)NCC3)c2ccccc2c1=O	756618378	SRZBIOORDVFDGF-UHFFFAOYSA-N	448.483	1.949	50	20	IDGD	
C[C@H]1CN(C2CC2)C[C@H]1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	757792227	WJKXOHAGRXOUDC-HNAYVOBHSA-N	449.577	1.288	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3cc(Br)nn3C)n[nH]2)cc1OC	757980519	QMQQTDXBYHOMOM-UHFFFAOYSA-N	449.265	1.665	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)CCCCOc1ccc(Br)cc1	758027208	VICUDFXWVNKBOL-LLVKDONJSA-N	436.328	1.083	50	20	IDGD	
COc1ccc(COCCCC(=O)N2CCN(S(=O)(=O)CBr)CC2)cc1	758513834	UQYSTUJLRZCTOA-UHFFFAOYSA-N	449.367	1.818	50	20	IDGD	
CCOc1cccc2c1OCC(C(=O)N1CCN(S(=O)(=O)CBr)CC1)=C2	758523372	OZXFFXSTSJXBBS-UHFFFAOYSA-N	445.335	1.688	50	20	IDGD	
C=C1c2ccccc2C(=O)N1[C@@H](C)C(=O)N1CCN(S(=O)(=O)CBr)CC1	758523531	QEVVCOVAVPPUBY-ZDUSSCGKSA-N	442.335	1.328	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)N2CCN(c3nc(N)ns3)CC2)c(C)n1C[C@H]1CCCO1	758588855	LRTAIVWYNHKTOG-UWKDKTGGSA-N	441.561	1.973	50	20	IDGD	
C[C@H]1C[C@H](C)CN(c2ccc(C(=O)NNC(=O)C(=O)Nc3ccccn3)cc2[N+](=O)[O-])C1	758820417	HTYNJQIJLBDJHN-KBPBESRZSA-N	440.460	1.872	50	20	IDGD	
COc1ccc(Cl)cc1NC(=O)CCNC(=O)NNC(=O)C(=O)Nc1ccccn1	758825904	VLYQEFRNUNLZSR-UHFFFAOYSA-N	434.840	1.041	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCc2ccc(S(C)(=O)=O)c(Cl)c2)cc1OC	758865509	XVPKSEQMLDONSH-UHFFFAOYSA-N	441.893	1.905	50	20	IDGD	
Cc1cc(S(C)(=O)=O)cc(C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)c1C	758942176	GHOSPAPKUUVCCJ-UHFFFAOYSA-N	429.454	1.197	50	20	IDGD	
O=C(/C=C/c1ccc(Cl)nc1)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	759611740	ZUBKVDOFARXGRU-VQHVLOKHSA-N	427.892	1.354	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)N[C@H]2CCOC[C@H]2OCC)c2ccccc2c1=O	760132137	OWNKPWHFFMZISQ-ZWKOTPCHSA-N	445.520	1.725	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Cn2nc(C)cc2C)c(I)c1	760295270	FUQUVYMYPDKLGD-UHFFFAOYSA-N	428.230	1.574	50	20	IDGD	
C[C@H](CC(=O)NNC(=O)c1cccc2ncccc12)NS(=O)(=O)c1cccnc1Cl	760546462	WYEWGDJGCMZXJZ-GFCCVEGCSA-N	447.904	1.801	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCCC(=O)NNC(=O)CCc1ccccc1	760809032	OEKBVMOMIAGRBM-KRWDZBQOSA-N	432.521	1.672	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1cnn(C)c1)c1nc(-c2ccc(Br)cc2)no1	760881448	KSQRUHHZSRMJFB-SECBINFHSA-N	434.254	1.938	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)CC/N=C1/NS(=O)(=O)c2ccccc21	761633529	KHOBKJXRBAHKSA-UHFFFAOYSA-N	448.526	1.064	50	20	IDGD	
CCOc1ccc(S(=O)(=O)Nc2ccc(C(=O)NN=C3CCN(C)C3=O)cc2)cc1	761744055	XNTJOAWGOUQBFH-UHFFFAOYSA-N	430.486	1.834	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)N[C@@H]1CCCN(c2ccccc2F)C1=O	761820241	YQWQAXHKTDNVJQ-OAHLLOKOSA-N	428.420	1.737	50	20	IDGD	
CCOc1ccccc1[C@@H](CC(=O)NNc1nccc(N2CCOCC2)n1)NC(C)=O	762851493	QQFHHZGTIUXEKE-QGZVFWFLSA-N	428.493	1.423	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)[C@H](C)Sc2nnnn2C2CC2)n[nH]1	763151724	DPXQSVHVERXSQD-JTQLQIEISA-N	428.478	1.349	50	20	IDGD	
CN(C)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1Cl	763442449	RGMRKTBMLFODAX-UHFFFAOYSA-N	433.808	1.350	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CNC(=O)NNC(=O)CNC(=O)c1cccs1)C1CC1	763485042	KPLHIMGZRBELJI-LBPRGKRZSA-N	425.511	1.112	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2cccnc2)ccc1NC(=O)OC(C)(C)C	763495483	WYKQUAMPOZPSAH-UHFFFAOYSA-N	429.433	1.837	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2ccc(Br)nc2C)c1	763651123	VBFOVEPJTFFCTK-UHFFFAOYSA-N	435.278	1.934	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)c(C)c1	763681916	PLPRNWRPENMRGT-UHFFFAOYSA-N	426.429	1.057	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc2c(c1)OC(F)(F)O2	763682320	QUCSIDBUSQHSFW-UHFFFAOYSA-N	437.355	1.572	50	20	IDGD	
O=C(CSc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1ccc(-n2ccnc2)nc1	763738062	SPKMGAKSOUCFHB-UHFFFAOYSA-N	430.877	1.799	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2ccc(C)c(C(=O)N(C)C)c2)c1	763770961	CMMYRBGNWKELQW-UHFFFAOYSA-N	428.445	1.114	50	20	IDGD	
C=CCOc1cccc(NC(=O)C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)c1	763789822	CRVPQYVVPMLPFS-UHFFFAOYSA-N	449.467	1.942	50	20	IDGD	
CNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)cc1Cl	763864405	IKXWBVLKCJVYBV-SNVBAGLBSA-N	436.827	1.392	50	20	IDGD	
CCNC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)c1	763871501	HCBPVIQBKBUCRC-GFCCVEGCSA-N	431.424	1.521	50	20	IDGD	
COC(=O)c1csc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(C(C)=O)cc2)c1C	763879006	VKKHCUYBWPQSAG-LBPRGKRZSA-N	447.469	1.599	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccc(N3CCSCC3)cc2C)n1	763880954	KKTWGLSHLKZEMM-UHFFFAOYSA-N	430.534	1.148	50	20	IDGD	
COC(=O)c1ccsc1NC(=O)C(=O)NNC(=O)CCSc1ccc(F)cc1	763902445	KZKNBVPCXYGIAW-UHFFFAOYSA-N	425.463	1.942	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)C(=O)Nc1ccccc1SC(F)F	763921661	NHTOMZHTWKOJRX-UHFFFAOYSA-N	433.400	1.377	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccc(Cl)cc2)cc1	763941674	OVCIGWRBXMMJLL-UHFFFAOYSA-N	438.893	1.430	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccn(-c2ccccc2Cl)n1	764138961	LYZOHNZPXNVADJ-UHFFFAOYSA-N	427.848	1.863	50	20	IDGD	
O=C(NNC(=O)c1ccoc1)C(=O)Nc1ccc(S(=O)(=O)c2ccc(F)cc2)cc1	764158562	GLSGBBBWWOKCIB-UHFFFAOYSA-N	431.401	1.651	50	20	IDGD	
CN1C(=O)COc2ccc(NC(=O)C(=O)NNC(=O)c3cccc(OC(F)F)c3)cc21	764260178	RWZIIZVAMFBTPC-UHFFFAOYSA-N	434.355	1.043	50	20	IDGD	
COc1ccc(Br)c(NC(=O)C(=O)NNC(=O)CCc2ccccc2O)c1	764281366	UVLOGTHFLQISJU-UHFFFAOYSA-N	436.262	1.882	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)C(=O)Nc1ccc(S(=O)(=O)C(F)F)cc1	764319572	NVSOQRSLRLMKFR-UHFFFAOYSA-N	429.376	1.151	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)C(=O)Nc1ccc(CCS(C)(=O)=O)cc1)c1ccccc1	764332426	SZGFTDSADSFESU-GOSISDBHSA-N	431.514	1.553	50	20	IDGD	
Cc1cnc(O)n1-c1ccccc1NC(=O)C(=O)NNC(=O)C(F)(F)Oc1ccccc1	764379757	JHPVKZQLTRFKLG-UHFFFAOYSA-N	445.382	1.644	50	20	IDGD	
COC(=O)c1ccc(OC)cc1NC(=O)C(=O)NNC(=O)C(F)(F)Oc1ccccc1	764380140	PPOPNHZVZQAFIB-UHFFFAOYSA-N	437.355	1.240	50	20	IDGD	
CCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(C)c(C)c3)[nH]n2)cc1	764388057	XHZXEGRFWXHKDJ-UHFFFAOYSA-N	448.483	1.843	50	20	IDGD	
CNC(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)c1	764394647	VHQOQVQUZAZYBI-UHFFFAOYSA-N	436.877	1.283	50	20	IDGD	
Cc1ccc(Cn2nccc2NC(=O)C(=O)NNC(=O)CSc2ccccc2O)s1	764405593	TUPATAJKNAGHOT-UHFFFAOYSA-N	445.526	1.885	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNc2nccnc2OC)cc(Br)c1F	764661443	BUFGJHCGFZOFOP-UHFFFAOYSA-N	442.201	1.255	50	20	IDGD	
COc1cc(C=NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cc(Cl)c1O	764816797	CRLOEANFFXPJCW-UHFFFAOYSA-N	430.892	1.962	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)cc1NS(C)(=O)=O	765318632	KFUOLIIDTKNBBW-UHFFFAOYSA-N	428.511	1.432	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)C[C@H]3CC[C@H](C)C3)CC2)cc1	765729365	PJAJFTSQOBCALE-ROUUACIJSA-N	436.578	1.275	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)[C@H](C)N3C(=O)[C@H]4CCCC[C@@H]4C3=O)n[nH]2)cc1	768268196	LLLUECOPJFLNDA-JQFCIGGWSA-N	437.500	1.964	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)Cc2c(C)nc3[nH]n(C)c(=O)c3c2C)n[nH]1	768274162	OZHUMVVQJWYRFG-UHFFFAOYSA-N	449.471	1.281	50	20	IDGD	
CSCCNC(=S)NNC(=O)c1cccc(S(=O)(=O)N2CCCC[C@@H]2C)c1	769764189	ABTDJWMKSFDENQ-ZDUSSCGKSA-N	430.621	1.722	50	20	IDGD	
CSCCNC(=S)NNC(=O)[C@@H]1CS[C@]2(c3ccc(F)cc3)CCC(=O)N12	770241168	VUQTWVBLARLEBY-GUYCJALGSA-N	428.580	1.575	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)c2ncccc12	770774697	RNFSPWJYRMOEOM-LBPRGKRZSA-N	426.404	1.936	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)NNc2nc(O)c3cnn(C)c3n2)N(C)c2ccccc21	770989504	IDVUTWSQASLARQ-UHFFFAOYSA-N	447.459	1.183	50	20	IDGD	
Cn1cc(S(=O)(=O)N2CCC(NC(=O)NNc3c(F)cccc3Cl)CC2)cn1	771326649	JXAUHVXHYVTZFT-UHFFFAOYSA-N	430.893	1.692	50	20	IDGD	
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)c1C	771607302	LRIKGWZHTNGNMB-UHFFFAOYSA-N	440.865	1.491	50	20	IDGD	
O=C(NNc1ccc(Br)c(F)c1)c1ccc(S(=O)(=O)N2CCOCC2)o1	771681231	QLLKBEMOPHWCQE-UHFFFAOYSA-N	448.270	1.959	50	20	IDGD	
O=C(NNC(=O)c1ccc(OC(F)F)cn1)c1cccc(S(=O)(=O)N2CCCC2)c1	771847272	VCYWFSMJXXSHOC-UHFFFAOYSA-N	440.428	1.542	50	20	IDGD	
C[C@H]1C[C@H](NC(=O)OC(C)(C)C)CCN1C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	771945385	ALWPJUDSPDAWCS-DZGCQCFKSA-N	444.496	1.394	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)c1occc1CS(=O)(=O)c1ccccc1	771970620	ZBSFJKWXHAQVER-CQSZACIVSA-N	436.486	1.992	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)c(-c2ccccc2)n1	772811160	LRNLLXSHTUNTLH-UHFFFAOYSA-N	446.511	1.306	50	20	IDGD	
COCc1ccc(NC(=O)C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1	773513724	XKMMBHCAONUMLV-UHFFFAOYSA-N	439.516	1.131	50	20	IDGD	
CCN(CC)C(=O)COc1cccc(NC(=O)C(=O)NNc2cnc3ccccc3n2)c1	773718068	IYASIAMWGQTAFY-UHFFFAOYSA-N	436.472	1.959	50	20	IDGD	
CN(C1CCCCC1)S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ncccn2)cc1	773719660	NUFQIIXPMRWZDR-UHFFFAOYSA-N	432.506	1.512	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)C(=O)NCC2	774008041	DTUZSJYYLTUANM-LLVKDONJSA-N	430.848	1.179	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)CCC(=O)N2	774008773	KYOIIMVKSSQYTQ-NSHDSACASA-N	430.848	1.778	50	20	IDGD	
Cc1cc(C(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)n2nc(C)cc2n1	776210952	CPKGLDOXSKOIAR-UHFFFAOYSA-N	431.497	1.595	50	20	IDGD	
COc1cccc([C@H]2[C@H](C(=O)NNC(=O)COc3ccccc3O)CC(=O)N2C2CC2)c1	776475917	OEZLDXABQNEEAM-VGSWGCGISA-N	439.468	1.679	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)NC[C@@H]1COC2(CCOCC2)O1	776943451	IKQFZXVRJUSSSM-CQSZACIVSA-N	444.282	1.080	50	20	IDGD	
Cc1ncc(C(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)c(C)n1	777289119	BDQKIPGFIVJITH-UHFFFAOYSA-N	428.456	1.870	50	20	IDGD	
COc1nc(C(=O)N2CCN(S(=O)(=O)CBr)CC2)cc2ccccc12	777779940	UCYIPARUMDPKJS-UHFFFAOYSA-N	428.308	1.683	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(OCC(F)(F)F)nc1)c1cnn(-c2ccccc2)c1	777933855	XHZCYRCRUYEMPT-UHFFFAOYSA-N	441.391	1.832	50	20	IDGD	
C[C@H](O)[C@H](NC(=O)C1CC1)C(=O)NNC(=O)c1ccc(COc2ccc(Cl)cc2)cc1	779490593	CBZPTPPJJXEBDF-DJJJIMSYSA-N	445.903	1.956	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@H](C(=O)NNC(=O)c2cccc3ncccc23)[C@H](C)O)cc1	779513705	IJNCXRVVRSXBBW-LIRRHRJNSA-N	442.497	1.032	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(OC3COC3)cc2)cc1	782121446	YYLIIHVVTZSPFZ-CQSZACIVSA-N	441.440	1.220	50	20	IDGD	
CN(C)CCc1ccccc1NC(=O)C(=O)NNC(=O)c1ccccc1Br	782703423	ZJHMDILTWOMENG-UHFFFAOYSA-N	433.306	1.953	50	20	IDGD	
COc1c(Cl)cccc1NC(=O)C(=O)NNC(=O)c1csc(N2CCOCC2)n1	782897466	PLQJIYHGUVGHOA-UHFFFAOYSA-N	439.881	1.041	50	20	IDGD	
CCCOc1cccc(NC(=O)C(=O)NNC(=O)c2csc(N3CCOCC3)n2)c1	782898003	VSVRYFQSJFRXHQ-UHFFFAOYSA-N	433.490	1.168	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2cccc(OCCc3ccccc3)c2)CCS(=O)(=O)C1	783427374	RWOAEMSESIMBSN-OAQYLSRUSA-N	431.514	1.445	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2cccc(OCc3ccc(F)cc3)c2)CCS(=O)(=O)C1	783429041	ZHNWDHCTYWTYMX-FQEVSTJZSA-N	435.477	1.541	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)C(=O)Nc1c[nH]nc1-c1ccccc1	784216671	OWYSZVCQTXVDQF-UHFFFAOYSA-N	440.485	1.599	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNc2ccc(F)c(F)c2F)cccc1C(=O)N1CCOCC1	784806935	NLRMHMKKHNTKCM-UHFFFAOYSA-N	436.390	1.967	50	20	IDGD	
Cn1c(=O)oc2cc(NC(=O)C(=O)NNc3ccc(S(=O)(=O)C(F)F)cc3)ccc21	784833919	SOXYFZGLZOPBIU-UHFFFAOYSA-N	440.384	1.210	50	20	IDGD	
CC(=O)N(Cc1ccc(NC(=O)C(=O)NNc2cccc(S(C)(=O)=O)c2)cc1)C(C)C	784842402	ZLKYXGOXODYLIE-UHFFFAOYSA-N	446.529	1.929	50	20	IDGD	
COC[C@@H](C)NS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2cc(C)ccc2F)cc1	784885030	SYMRPAKIQIFLBM-CYBMUJFWSA-N	438.481	1.529	50	20	IDGD	
O=C(NNc1c(F)cc(F)cc1Br)C(=O)Nc1cnn(-c2ncccn2)c1	785010502	DUCYEAJGLYQLMN-UHFFFAOYSA-N	438.192	1.785	50	20	IDGD	
CCc1cc(Br)ccc1NNC(=O)C(=O)Nc1c(OC)ncnc1N(C)C	785098788	GDDXTNXJOWJPIZ-UHFFFAOYSA-N	437.298	1.958	50	20	IDGD	
O=C(NNc1nc(C(F)(F)F)cs1)C(=O)Nc1cccc(C(=O)N2CCOCC2)c1	785143371	BSEGKEAWJJOERI-UHFFFAOYSA-N	443.407	1.716	50	20	IDGD	
COC(=O)CCc1cccc(NC(=O)C(=O)NNC(=O)c2ccccc2Br)c1	786415135	XUXSXXSRYPEJPV-UHFFFAOYSA-N	448.273	1.954	50	20	IDGD	
CN1CCC(n2ccc(NC(=O)C(=O)NNC(=O)c3cccc(C(F)(F)F)c3)n2)CC1	787542604	BOKMIACOIDVDOD-UHFFFAOYSA-N	438.410	1.568	50	20	IDGD	
CC(C)[C@@H](CNC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)c1ccnn1C	788322197	VCYOGDNEMXHJBK-HXUWFJFHSA-N	441.580	1.702	50	20	IDGD	
CCS(=O)(=O)c1ccc([C@@H](C)NC(=O)NNC(=O)Cc2cn3ccccc3n2)cc1	790986969	VLKBYWMINZIUIP-CQSZACIVSA-N	429.502	1.762	50	20	IDGD	
CCc1ccc([C@H]2CN(C(=O)NNC(=O)c3csc(N4CCOCC4)n3)CCO2)cc1	791010367	QAZNCFRQRGRKFK-GOSISDBHSA-N	445.545	1.970	50	20	IDGD	
C[C@@H]1CC(=O)C[C@H](C(=O)NNC(=O)c2ccccc2)[C@@H]1C(=O)NNC(=O)c1ccccc1	791122372	YJEWVUFTULXBIS-MDASCCDHSA-N	436.468	1.140	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCN(CC(F)(F)F)C1)c1ccc(S(=O)(=O)N2CCCC2)cc1	792016422	OSBJYHCFHKVACI-CQSZACIVSA-N	448.467	1.116	50	20	IDGD	
Cc1ccc(-n2ncc(NC(=O)C(=O)NNC(=O)C(=O)N3CCCC3)c2C(C)C)cc1	792279686	LHGCIRJNSKSXHV-UHFFFAOYSA-N	426.477	1.012	50	20	IDGD	
COc1c(NC(=O)C(=O)NNC(=O)CCc2ccccc2)cc(Cl)cc1C(=O)N(C)C	793024804	FMPVKONEOKOTDN-UHFFFAOYSA-N	446.891	1.769	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2ccc(F)cc2Br)cnc1C	793368433	ZBYGEZVWWGKEGJ-UHFFFAOYSA-N	446.254	1.702	50	20	IDGD	
CS(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)CC23CC4CC(CC(C4)C2)C3)cn1	794578803	OLOBLXDFGCATNX-UHFFFAOYSA-N	427.548	1.401	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1cc(OC)c(OC)c(C)c1OC	797001708	JXNNDYYDVZKLJY-UHFFFAOYSA-N	431.445	1.358	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)N3CCC[C@@H](C)C3)cc2C)n1	797370388	BBMRITCVEWDAEX-CQSZACIVSA-N	437.500	1.970	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)ccc1Cl	798335671	RCJCWEYCULTMBO-UHFFFAOYSA-N	444.847	1.915	50	20	IDGD	
COc1ccccc1-n1ncc(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1C	798428611	ITSVNIWARIYYQS-UHFFFAOYSA-N	435.488	1.657	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCCC1C[C@H](C)O[C@@H](C)C1	801737974	LWUNVDIHUTTWQR-STQMWFEESA-N	425.555	1.826	50	20	IDGD	
O=C(NC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1)NNC(=O)c1cccc([N+](=O)[O-])c1	802332409	LXDGXQJGCITPLV-MRXNPFEDSA-N	425.401	1.667	50	20	IDGD	
CC(C)CSc1ccc(S(=O)(=O)NCC(=O)NNC(=O)C2CCC2)cc1[N+](=O)[O-]	802532673	PBHRTMGCLDOKNU-UHFFFAOYSA-N	444.535	1.569	50	20	IDGD	
COc1ccc(CN2CC[C@@H](NC(=O)NNC(=O)c3ccc(C#N)cc3)C2=O)c(OC)c1	805027311	JUXJKDSUBJYXER-GOSISDBHSA-N	437.456	1.321	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N2CCOC[C@@H]2[C@H]2CCCO2)cc1Br	805104484	SRDJBXRFJNEOID-UKRRQHHQSA-N	428.283	1.692	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)C(=O)CC(C)(C)O3)cc1OC	806973041	XCLNWYXOXHEGLX-UHFFFAOYSA-N	441.440	1.847	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2ccc(C#N)c(Br)c2)c1	806974350	GLFCFOHMLKQBIW-UHFFFAOYSA-N	447.245	1.738	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1cccc2cc(Br)cnc12	806979024	LBCCSGXYTOSQNN-JTQLQIEISA-N	439.266	1.135	50	20	IDGD	
O=C(NNc1nccnc1C1CCC1)C(=O)Nc1cccc(S(=O)(=O)N2CCCC2)c1	807462828	UDMCYCOQMMLSRV-UHFFFAOYSA-N	444.517	1.610	50	20	IDGD	
O=C(NNc1ccc2c(=O)[nH]ccc2c1)c1ccc2c(c1)SC1=NS(=O)(=O)CCN12	807504143	KWGUHXGMYVXIPK-UHFFFAOYSA-N	441.494	1.897	50	20	IDGD	
Cc1nn(C)cc1S(=O)(=O)NC(=O)/C(C#N)=C\c1cc(C)n(C[C@@H]2CCCO2)c1C	809034157	RPTNUUXTPKKJEE-XUKORKDYSA-N	431.518	1.738	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CN2CCC(NS(=O)(=O)c3cccs3)CC2)cc1	809931173	FWITZIGBQLVCTH-UHFFFAOYSA-N	436.559	1.260	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)CNS(=O)(=O)c1ccc(Br)cc1	810375056	PDPMACWEPSCGOX-UHFFFAOYSA-N	442.291	1.197	50	20	IDGD	
CC1(C)CCCc2sc(NC(=O)C(=O)NNC(=O)CNC(=O)c3cccs3)nc21	810396279	VBKAXZXSVYTMFV-UHFFFAOYSA-N	435.531	1.334	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccc(O[C@@H]3CCOC3)cc2)cc1	813033526	XQGMJJDNGAGHRE-QGZVFWFLSA-N	448.501	1.186	50	20	IDGD	
CCCN1C(=O)c2ccccc2N2C(=O)CC[C@@]12C(=O)NNC(=O)c1cccc(C#N)c1	815399459	YDAQQFNIVRXEJI-HSZRJFAPSA-N	431.452	1.708	50	20	IDGD	
O=C(NNc1ncncc1F)C(=O)Nc1ccnn1Cc1ccc(Br)cc1	815764057	PACQGASVFVSPQB-UHFFFAOYSA-N	434.229	1.705	50	20	IDGD	
CC(=O)N1CCN(S(=O)(=O)c2cccc(C(=O)NNc3ccc(F)cc3F)c2)CC1	876973914	SDVGBEQRIRQEEB-UHFFFAOYSA-N	438.456	1.575	50	20	IDGD	
O=C(COC(=O)[C@H]1CC(=O)N(c2ccc(F)c([N+](=O)[O-])c2)C1)NNC(=O)c1ccccc1	904221676	YDPUPMJJJYVTSP-ZDUSSCGKSA-N	444.375	1.091	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)COc2ccc(F)cc2Br)C[C@@H](C)O1	912919396	MTMAYTVLKDRNHK-VXGBXAGGSA-N	432.290	1.614	50	20	IDGD	
Cc1nc(C(F)(F)F)ccc1C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	914587380	IDVHWXNYHPEXOQ-CQSZACIVSA-N	439.346	1.553	50	20	IDGD	
O=C(NNC(=O)C1CCCC1)c1ccc(Cl)c(S(=O)(=O)NC[C@@H]2CCCO2)c1	914849167	QMDHSEIYVZZDRF-AWEZNQCLSA-N	429.926	1.749	50	20	IDGD	
COC(=O)Cc1cc(=O)n(-c2ccc(C(=O)NNC(=O)c3cccc(N(C)C)c3)cc2)[nH]1	915189075	BRQYHKVHXZINHH-UHFFFAOYSA-N	437.456	1.022	50	20	IDGD	
O=C(NNC(=O)c1cc2c(nc1O)CCC2)c1cccc(S(=O)(=O)N2CCCC2)c1	915802729	SIDUDPFWVDYVIA-UHFFFAOYSA-N	430.486	1.135	50	20	IDGD	
CCO[C@@H]1C[C@H]1C(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2OC)c1	916095369	GPGPYIYYUKPXGH-CRAIPNDOSA-N	433.486	1.682	50	20	IDGD	
Cc1ccc([C@H](CNC(=O)NNC(=O)COc2ccc(C)c(C)c2)N2CCOCC2)o1	916229712	WFMZGUUMWAOTOP-IBGZPJMESA-N	430.505	1.988	50	20	IDGD	
O=C(NN=Cc1c(Cl)nc2ccccn12)c1cccc(S(=O)(=O)N2CCOCC2)c1	916259199	ZGQZAZSXARNSGS-UHFFFAOYSA-N	447.904	1.773	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)Nc2ccc(OCC(N)=O)cc2)c2ccccc2c1=O	916375477	FKGJAGXAEMMGDE-UHFFFAOYSA-N	438.444	1.308	50	20	IDGD	
CN1CCN(CCCNC(=O)NNc2ccc(-n3cccn3)nn2)[C@H](c2ccccc2)C1	916485246	LOJUULVNIZSACN-IBGZPJMESA-N	435.536	1.667	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)COc1ccccc1F)c1ccc(OCC(=O)NC2CC2)cc1	916489414	LFOGZJMNEDNVRA-AWEZNQCLSA-N	444.463	1.954	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NC[C@@H]2CCN(CC(F)(F)F)C2)c2ccccc2c1=O	916577797	GHSZKHVNDSJWSI-LBPRGKRZSA-N	440.426	1.245	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)c3ccc(CCNS(C)(=O)=O)cc3)n[nH]2)cc1	917178049	GYCHRPDTFMWVNK-UHFFFAOYSA-N	441.513	1.552	50	20	IDGD	
Cc1nn2c(=O)c3ccccc3[nH]c2c1C=NNC(=O)Cn1nnc(-c2ccccc2)n1	918708281	KUGILSUFJQAVCD-UHFFFAOYSA-N	427.428	1.288	50	20	IDGD	
CC(C)n1ncc2c(C(=O)NNC(=O)N[C@@H]3CCS(=O)(=O)C3)cc(-c3ccco3)nc21	919888540	FSZHYJXZMYSQQG-GFCCVEGCSA-N	446.489	1.403	50	20	IDGD	
COC(=O)c1cc(NC(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc(C(=O)OC)c1	920933024	KJNXUSAIOQSCBM-UHFFFAOYSA-N	429.385	1.498	50	20	IDGD	
O=C(COC(=O)C(F)(F)c1ccc(Cl)cc1)NNC(=O)[C@@H]1COc2ccccc2O1	1115978667	XOQJBYKIMPERSA-HNNXBMFYSA-N	440.786	1.962	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N[C@H]2CCCN(C(=O)c3ccccc3)C2)cc1OC	1322308611	OSLYITXAFQRJPZ-KRWDZBQOSA-N	426.473	1.953	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](F)Cl)C2)c1	1778021965	AGBCNIVISGHBJX-GPMSIDNRSA-N	446.928	1.752	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)NC(=O)NCC)C1	1779315916	XBYCAQWZTXRLHV-UIVXKWKOSA-N	430.977	1.615	50	20	IDGD	
COc1c(Cl)ccnc1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](C)Br)CCO2	1780327747	AXIJIVDQDMGBNM-GTNSWQLSSA-N	446.729	1.971	50	20	IDGD	
Cc1cccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cccc(B(O)O)c2)C3)c1	1780394355	JBAOPNSKFWZEFU-ZJSXRUAMSA-N	436.317	1.116	50	20	IDGD	
CCOc1ccc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)nn1	1780426733	HPXJCAJUXQYUFE-BBRMVZONSA-N	431.262	1.009	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)NC(=O)OC(C)(C)C)C2	1780707088	HCVLKCISUNITCJ-NOAAKOMESA-N	447.960	1.361	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Br)C1	1780777255	PMYXBUVGESXZKP-ZHSDAYTOSA-N	444.139	1.974	50	20	IDGD	
O=C(c1ccn2cncc2c1)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781332186	VMVMCPROELDVAJ-PBHICJAKSA-N	425.258	1.468	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCN1CCOC1=O)C2	1781999351	WOZNYRBRBFBCGF-HBUWYVDXSA-N	446.342	1.126	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCn2nc(C)cc2C)C1	1782438735	SCRHUGYCUMXHTQ-WAOWUJCRSA-N	440.972	1.658	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3c(F)cncc3F)CCO2)C1	1783351314	JLPIQLMSUTZYFC-DIFFPNOSSA-N	432.265	1.977	50	20	IDGD	
C[C@@H](CNC(=O)OC(C)(C)C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Cl)C[C@@H]21	1784098071	VMUJSPYJYVXRSS-YYFQZIEXSA-N	435.924	1.661	50	20	IDGD	
O=C(c1ccc(N2C(=O)C=CC2=O)cc1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Cl)CCO2	1785221717	MRYSBLPFGKZZDY-YLJYHZDGSA-N	435.839	1.094	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(F)cn3)[C@H]2C1	1786215723	ZGYDXBNRTWYDRS-PCBIJLKTSA-N	428.302	1.988	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]3C2)cc1N(C)C	1787449869	YQQDYKBROVLXMB-USJZOSNVSA-N	427.904	1.889	50	20	IDGD	
Cc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Br)C[C@@H]32)c(O)n1	1789311023	NSCKWGPQHWTGDB-DOERSZECSA-N	430.274	1.379	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1ccc(C2(NC(=O)c3cc[n+]([O-])cc3)CCC2)cc1	1789520982	FTMVHKRSQYVWEG-UHFFFAOYSA-N	446.467	1.380	50	20	IDGD	
C[Si](C)(C)OCC(=O)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1	1789648925	RULUJUAEIXPYEU-UHFFFAOYSA-N	440.381	1.966	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)ccc3F)C[C@@H]21)[C@H](F)Br	1789923484	PNBHRTKHQDUTRK-HLHNXRDNSA-N	433.249	1.815	50	20	IDGD	
C[C@@H](Nc1ccccn1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]2C1	1789926065	MCHKXUIRPBFKQG-XSEXMBABSA-N	443.317	1.552	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21)c1cn2c(F)cccc2n1	1790423914	WQFBOHDNXLRADK-GVXVVHGQSA-N	429.279	1.870	50	20	IDGD	
CCNC(=S)NCC(=O)Nc1ccc(C2(NC(=O)[C@H](Cl)COC)CCC2)cc1	1791035152	OPGCIEYCSMBDCK-OAHLLOKOSA-N	426.970	1.858	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1ccc(C2(NC(=O)c3cnn4cccnc34)CCC2)cc1	1791601555	KIHBSRQKGSNYSL-UHFFFAOYSA-N	449.515	1.850	50	20	IDGD	
C[C@H](NC(=O)c1ccccc1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Cl)C[C@@H]21	1792247677	ORGBSYBMOLVUJW-JVNPIMRCSA-N	425.888	1.319	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCl)c1cccc(OC2CCOCC2)n1	1793113734	SFRGWZKKFHVGFC-KRXQYRFLSA-N	437.924	1.491	50	20	IDGD	
O=C(Cc1ccc(F)c(F)c1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2	1795297485	ZSPQKAJQSBXXEZ-OXUXUCFPSA-N	435.240	1.787	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](F)Cl)[C@@H](O)C1	1796803672	AEAAHCBGHHOQKG-PLZKBRGSSA-N	447.935	1.777	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc3ncccn3n1)C2	1796892617	XLNUTNQGLXVDLI-MVRRYPJTSA-N	448.487	1.115	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2ncncc2c1	1797469114	XLMUUYCQLGNMHL-FIUQPQMISA-N	433.306	1.616	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2)c1cc(Cl)c2nncn2c1	1797691998	OYRAQRPIOOQNHO-PEGIJTEDSA-N	432.695	1.390	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c(n1)NC(=O)CC3)C2	1797954767	HKNLBYWHIVQMDT-CCWDJLKJSA-N	446.580	1.021	50	20	IDGD	
CC(=O)OC[C@H](OC(C)=O)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@](C)(Cl)CCl)C2	1798475355	ZNAPAVJOGDQJNM-SFUJAXRZSA-N	437.320	1.356	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1nc(O)n2c1CCCC2	1798661122	LQUQFERUFXNHRE-RVMXOQNASA-N	425.327	1.960	50	20	IDGD	
N#Cc1cccc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Br)c1	1799343424	WWALPRSDHFTNHE-CYGHRXIMSA-N	438.297	1.771	50	20	IDGD	
Cc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Br)ncc1[N+](=O)[O-]	1799346932	FGZCTWBTPPWROF-RDBQEKCUSA-N	445.245	1.192	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](O)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](F)Br	1800162204	LUGVBHAEVTVHIT-UYNYGYNWSA-N	438.294	1.158	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3cccnc3[nH]1)C2	1800641754	IYVFSJQQFBUGGB-FQLMCAECSA-N	435.322	1.940	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc3c(Cl)cccn13)C2	1800975140	KASISKBOVMANBP-FAXLKDOZSA-N	441.315	1.445	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(Br)cn1)C2	1800977360	YLSPHFAHRIKBJX-NDPMZMCLSA-N	446.729	1.301	50	20	IDGD	
COc1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CCC(=O)NN(C)C)c(OC)c1	1802336276	IGJIBKYJAZXEOU-MUJYYYPQSA-N	432.521	1.329	50	20	IDGD	
C[C@H](Nc1ccccn1)C(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]1c1cccnc1	1803142627	FWFLCVHXIIOHEJ-LKCYJCQHSA-N	431.924	1.583	50	20	IDGD	
Cc1csc(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)c1	1803770589	JCFJKXWVQFAECI-WIYYLYMNSA-N	449.341	1.765	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@@H](CNC(=O)c2ncn(C)n2)[C@H]1c1cccnc1	1805317962	JSEIGDVEWCYYIT-VHDGCEQUSA-N	435.326	1.561	50	20	IDGD	
O=C(CCBr)NC[C@H]1CCN(C(=O)Cc2cncnc2)[C@H]1c1cccnc1	1806341912	IGZQCBJMJRZRDF-APWZRJJASA-N	432.322	1.905	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)CCN2CCN(C)CC2)[C@H]1c1cccnc1	1806918088	YPUKQJZAEJJYNP-SVFBPWRDSA-N	436.000	1.742	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)c3cnc(Cl)s3)CC2)C1	1809971016	JLLLMUPQEVLUTF-UHFFFAOYSA-N	447.753	1.635	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)o1	1810295706	VTMYUCLZYXVFLQ-JXFKEZNVSA-N	448.483	1.615	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)C(C)(C)CCl)[C@@H]1c1cccnc1	1813068929	QUZGOSLGONORNB-VQIMIIECSA-N	437.972	1.725	50	20	IDGD	
CSCC(C)(C)C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1813068987	RDUMRFOBFKOQTM-YLJYHZDGSA-N	449.621	1.850	50	20	IDGD	
Cc1cccc(C(=O)N2CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)n1	1813070297	GXDKGGMRDOCUIO-GCJKJVERSA-N	438.532	1.478	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H](CNC(=O)CCn2cncn2)[C@@H]1c1cccnc1	1813318749	MWPHGFBEXSWGPJ-XLIONFOSSA-N	430.585	1.621	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CN2CCNC2=N)n[nH]1	1817296248	CHDRIZKTVSMZMH-SJCJKPOMSA-N	430.340	1.478	50	20	IDGD	
CC(C)CNC(=O)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](F)Br)CC2	1817332456	MEIQKPLESLONQM-LDYMZIIASA-N	435.319	1.518	50	20	IDGD	
CSCC(C)(C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1	1817470421	QUYAUFIJPZZNLL-KRWDZBQOSA-N	444.366	1.785	50	20	IDGD	
O=C(N[C@@H]1CCc2nc(NC(=O)c3ccc(Cl)o3)sc2C1)c1ccc(B(O)O)cc1	1817918989	ZSFXTRTZGCECGM-GFCCVEGCSA-N	445.693	1.609	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(CO)on2)n[nH]1	1820348874	KMLZBUYGNRRCIN-NOZJJQNGSA-N	426.271	1.979	50	20	IDGD	
CC(=O)N1CCN(CC(=O)N2CCCC[C@H]2c2cc(NC(=O)C(Cl)Cl)n[nH]2)CC1	1822422428	VVSVMYDNSUBNIX-AWEZNQCLSA-N	445.351	1.370	50	20	IDGD	
CC[C@@H](NC(C)=O)C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1	1822999605	VENMBKOMVXDLAY-YGOYTEALSA-N	435.319	1.660	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)[C@@H](O)CCl)CC2)n1	1825409093	QQGSDYYNUTYHBF-MSOLQXFVSA-N	436.940	1.873	50	20	IDGD	
CC(C)c1nc(C(=O)N[C@@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)co1	1826080346	DHVAJWDPBOYLEP-GFCCVEGCSA-N	448.549	1.853	50	20	IDGD	
O=C1CC[C@H](C(=O)N2CCC([C@H]3CCCCN3C(=O)CCBr)CC2)CN1	1826354479	IAOHHWIZYWICBK-JKSUJKDBSA-N	428.371	1.917	50	20	IDGD	
Cn1cc(CC(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@@H](F)Br)CC3)cn1	1826943319	FWHHSYIPSLJMOL-TVQRCGJNSA-N	430.303	1.722	50	20	IDGD	
C[C@@]1(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cccc(B(O)O)c2)CC3)CC1(F)F	1828048088	VDCRWJSHKKCWDI-SGTLLEGYSA-N	435.261	1.094	50	20	IDGD	
CSCC(C)(C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1831538313	PFCQMBHYGRLXOB-BLLLJJGKSA-N	441.363	1.523	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)Cc2cnccn2)CC1	1831871880	WKBLUOYAUGDVTA-LJQANCHMSA-N	430.553	1.012	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)[C@@H]3CCC(=O)NC3)CC2)CC1	1833529649	CUGSSBLUOJAYCZ-CRAIPNDOSA-N	426.989	1.492	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cc(C(C)=O)[nH]n3)CC2)CC1	1834068830	HAWCQDGUUPWLBS-INIZCTEOSA-N	439.944	1.051	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccnn3CC)CCO2)C1	1834417693	OJNOQWDZBCKPLV-KDOFPFPSSA-N	443.342	1.147	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)CCSC(=N)N)CC2)CC1	1834709919	WLDVJKYLQVSKTA-LBPRGKRZSA-N	448.431	1.358	50	20	IDGD	
Cc1n[nH]c(C)c1C(=O)NC1CCN(C2CCN(C(=O)[C@H](C)Br)CC2)CC1	1835870939	RCTLSFMAKCDDGA-LBPRGKRZSA-N	440.386	1.995	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3ccc(O)nc3)CC2)CC1	1836144707	KIROSDXSUPCOIB-CYBMUJFWSA-N	439.354	1.756	50	20	IDGD	
CC[C@H](C)[C@H](N)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](F)Br)CC2)CC1	1836412591	NGETXEIQQRUXGR-VBNZEHGJSA-N	435.382	1.622	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)Cc3cnccn3)CC2)CC1)[C@@H](F)Br	1836414203	YRYQKOYPZSAGEX-QGZVFWFLSA-N	442.333	1.281	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC(OC2CCN(C(=O)CCN(C)C)CC2)CC1	1836671287	VLSBWKBRMXWKPN-HNNXBMFYSA-N	432.403	1.968	50	20	IDGD	
CCOc1cnc(C(=O)N2CCC(OC3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)cn1	1836714957	GBOCZDVDHPJXBF-KRWDZBQOSA-N	440.928	1.087	50	20	IDGD	
O=C(c1cnoc1C1CC1)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836716570	CJWQHTHJKFOMAS-KRWDZBQOSA-N	425.913	1.764	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3n[nH]c4c(F)cccc34)CCO2)C1	1837058909	PIQUXIHNHFAPDQ-VLIAUNLRSA-N	438.887	1.789	50	20	IDGD	
CCOC(=O)/C=C/C(=O)N1CCC(OC2CCN(C(=O)[C@@H](C)Br)CC2)CC1	1837639202	RTUYBAFUPLNNHL-ISZGNANSSA-N	445.354	1.888	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(F)c(F)c3)C2)C1	1837714575	KVAGZYRWBNMFJT-FQEVSTJZSA-N	442.535	1.886	50	20	IDGD	
O=C(c1ccc(F)cc1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1838956734	UPKRDFWOQWXDHD-YOEHRIQHSA-N	433.249	1.586	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cn4cc(F)ccc4n3)C2)C1	1839146252	WWTPSVCVNPEXAO-YWZLYKJASA-N	438.887	1.561	50	20	IDGD	
O=C(c1ccccc1O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839197637	CQYPRRCHVLCUAB-RHSMWYFYSA-N	431.258	1.153	50	20	IDGD	
O=C(c1cc2sccn2c1)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840187505	FTSAOOXYVCSRFP-KRWDZBQOSA-N	432.329	1.875	50	20	IDGD	
Cc1cc(F)cc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)c1	1840190561	APTKDULXVOFATQ-LJQANCHMSA-N	433.307	1.937	50	20	IDGD	
C[C@@H](C(=O)N1CCCC12CN(C(=O)c1cccc(B(O)O)c1)C2)c1ccc(Cl)cc1	1841197984	RWPXNEYUAAZUFT-OAHLLOKOSA-N	426.709	1.641	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@@H](C)C(=O)N2CC3(CCCN3C(=O)[C@@H](F)Cl)C2)cc1	1843361447	HRXIKYGLGQOBPD-DZGCQCFKSA-N	431.917	1.400	50	20	IDGD	
O=C([C@H](O)CCl)N1CC2(CCCN2C(=O)c2cc(Br)cc3cn[nH]c23)C1	1844127854	BMXJLSKYIXXDLU-CYBMUJFWSA-N	441.713	1.742	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1O)C2	1845162932	VXTVYYVCKKJXFF-JYJNAYRXSA-N	443.972	1.825	50	20	IDGD	
CCNC(=S)NCC(=O)N1CC2(CCCN2C(=O)/C(C#N)=C/c2ccc(F)cc2F)C1	1845871669	CBHBZOGVWKNVTH-OVCLIPMQSA-N	447.511	1.559	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)c2cc(F)c(F)c(Cl)c2)C1	1846871560	OYHJOYSOVCCRQN-UHFFFAOYSA-N	434.635	1.429	50	20	IDGD	
C[C@H]1[C@@H](C(=O)N2CCCC23CN(C(=O)[C@H](O)CCl)C3)CCN1C(=O)OC(C)(C)C	1847158640	ZQUBUSVONHKKHB-SOUVJXGZSA-N	429.945	1.435	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@]2(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](O)CCl)C1	1847563049	LVXFRUANDKJSBM-UFJVTBDRSA-N	441.956	1.435	50	20	IDGD	
Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCC(C(=O)NNC(=O)c2ccccn2)CC1	17328348	BITQHHWBCUSPCO-UHFFFAOYSA-N	447.473	1.160	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)N1CCN(Cc2c(F)cccc2Cl)CC1	725871853	HQPICGXCZBIRLV-UHFFFAOYSA-N	437.859	1.361	50	20	IDGD	
CC(=O)N1c2ccccc2C[C@H]1C(=O)NNC(=O)c1sc(N2CCOCC2)nc1C	726522890	ZWXLWLAHVXAKKB-INIZCTEOSA-N	429.502	1.027	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNS(=O)(=O)c2cc3c(cc2Cl)OCCO3)cc1C	726764291	DDPSNLRMXKDEJT-UHFFFAOYSA-N	439.877	1.676	50	20	IDGD	
O=C(CN1c2cccc3cccc(c23)S1(=O)=O)NNC(=S)NCCc1cccnc1	727694145	QPXLHNZIQQERQG-UHFFFAOYSA-N	441.538	1.482	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(OC)c(C(=O)NNc2nc(-c3cccnc3)no2)c1	728076304	HTCQGTNDHKKAED-UHFFFAOYSA-N	446.489	1.928	50	20	IDGD	
O=C(NNC(=O)c1cc(F)c(F)c(F)c1)c1cccc(S(=O)(=O)N2CCCC2)c1	728456018	WWGLWJXNJWFHQU-UHFFFAOYSA-N	427.404	1.963	50	20	IDGD	
CC(=O)NCC(=O)N1CCC[C@H]1C(=O)NNC(=O)c1cc(-c2ccco2)nc2ccccc12	728511588	VGQKHYFCKMMLNH-IBGZPJMESA-N	449.467	1.383	50	20	IDGD	
Cc1ccc(-n2ncc(C(=O)OCC(=O)NNC(=O)Cc3nc(C)cs3)c2C)cc1	728721015	RTIWPEZRYFBJMS-UHFFFAOYSA-N	427.486	1.801	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2cnn(-c3ccc(F)cc3)c2C)n1	728722637	GUQQJDUATOANPI-UHFFFAOYSA-N	431.449	1.632	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NC[C@@H]2CN3CCC[C@@H]3CO2)c2ccccc2c1=O	729619017	NWXSJKXTQAOZSM-HZPDHXFCSA-N	442.520	1.004	50	20	IDGD	
C[C@H]1CCCN(S(=O)(=O)c2cc(C(=O)NNC(=O)c3ccc(Cl)nc3)n(C)c2)C1	730209495	CQZHRRBCVVYTBM-LBPRGKRZSA-N	439.925	1.569	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3c[nH]nc3-c3cccnc3)cc2)CC1	730422772	BYRQZDXGFMYBEK-UHFFFAOYSA-N	441.517	1.165	50	20	IDGD	
O=C(Cc1ccc2ccccc2c1)NNC(=O)NCCS(=O)(=O)N1CCSCC1	730583665	PEHBSOWXUDKHPE-UHFFFAOYSA-N	436.559	1.091	50	20	IDGD	
CC(CCN1C(=O)c2ccccc2C1=O)=NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	730947446	RHINKHUJTPASPZ-UHFFFAOYSA-N	448.888	1.779	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)c1ccc(S(=O)(=O)NCc2ccco2)cc1	731494097	LBIFKSBBZAUMFZ-UHFFFAOYSA-N	429.454	1.842	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NC2CCC(NC(C)=O)CC2)cc1Br	732244894	LYXBBLPAGVIWFO-UHFFFAOYSA-N	427.299	1.849	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2csc(-c3ccc4c(c3)OCCO4)n2)C[C@@H](C)O1	732260386	RZQMBWPJJHCUCL-OKILXGFUSA-N	446.529	1.842	50	20	IDGD	
CCN(CC)[C@H](C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1)c1ccccc1	732351223	YACNYXPNDPZMGC-CTNGQTDRSA-N	441.484	1.600	50	20	IDGD	
CN(C)CCNC(=O)c1cccc(CNC(=O)NNC(=O)NCc2ccc(Cl)cc2)c1	732993967	HUCFWYYBMGGMTK-UHFFFAOYSA-N	446.939	1.845	50	20	IDGD	
NC(=O)c1ccccc1N1CC[C@@H](NC(=O)NNC(=O)NCc2ccc(Cl)cc2)C1	732997977	FLVNXWDGSDLIIB-OAHLLOKOSA-N	430.896	1.731	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CSc2nccn2Cc2ccccn2)cc1OC	733082400	QRSUIAQTGQYCNH-UHFFFAOYSA-N	427.486	1.897	50	20	IDGD	
Cc1ccc(-n2c(NNC(=O)CN3CCCS3(=O)=O)nc3ccccc3c2=O)c(C)c1	733263152	LBTYCCPLSLFZKX-UHFFFAOYSA-N	441.513	1.481	50	20	IDGD	
Cc1ccc(-n2c(NNC(=O)CCCN3C(=O)CNC3=O)nc3ccccc3c2=O)c(C)c1	733263339	XDRFULRWSKLRPE-UHFFFAOYSA-N	448.483	1.778	50	20	IDGD	
CN(C)CC(=O)NNC(=O)c1ccc(Cl)c(S(=O)(=O)Nc2ccc(F)cc2)c1	733359613	UCKRXDNQIFODOP-UHFFFAOYSA-N	428.873	1.603	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)[C@H](c1ccccc1)N1CCSCC1	734241616	SBMIQLRHFHALKT-INIZCTEOSA-N	437.566	1.632	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)C[C@H]1Oc2ccccc2NC1=O	734250917	PDMDLNYXOJEQNO-MRXNPFEDSA-N	432.502	1.996	50	20	IDGD	
O=C(COC(=O)C[C@@H]1OCCc2ccccc21)NNC(=O)[C@@H]1COc2ccccc2O1	734604892	CZDMIBPVNLUVRQ-OALUTQOASA-N	426.425	1.221	50	20	IDGD	
COc1ccc(CN2CC[C@@H](NC(=O)NNC(=O)COc3ccc(OC)cc3)C2=O)cc1	734682840	CTAKTFRFQMPIPB-LJQANCHMSA-N	442.472	1.214	50	20	IDGD	
O=C(NNc1ccc(F)cc1Br)N[C@H]1CCN(CCN2CCOCC2)C1	734685511	GANPZXREMQCSML-AWEZNQCLSA-N	430.322	1.621	50	20	IDGD	
COC(=O)c1ccc(C(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)s1	734825231	WLHFUUXBTFKPKH-UHFFFAOYSA-N	426.495	1.878	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)CSc2ccc(F)cc2)CC1	735117144	BWPWFODOUARKJM-UHFFFAOYSA-N	439.538	1.392	50	20	IDGD	
O=C(COC(=O)Cc1csc(-c2ccoc2)n1)NNC(=O)[C@@H]1COc2ccccc2O1	738855597	NAQJOSUNPCGJOA-INIZCTEOSA-N	443.437	1.476	50	20	IDGD	
C#Cc1cccc(NC(=S)NNC(=O)CN2CCN(C(=O)OC(C)(C)C)CC2=O)c1	741306372	VONLGCSUTBFUNT-UHFFFAOYSA-N	431.518	1.065	50	20	IDGD	
Cc1c(/C=C(\C#N)C(=O)Nc2cnn(CC(=O)N3C[C@H](C)O[C@@H](C)C3)c2)cc(C#N)n1C	741726084	JUMNFPNFWMZWEJ-UEBYQVMESA-N	435.488	1.583	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)CN(C[C@@H]2CCCO2)C(=O)OC(C)(C)C)c1	741885782	RMMPQNXFSUMASY-HNNXBMFYSA-N	437.493	1.881	50	20	IDGD	
CC(C)(C)CC(=O)Nc1ccc(Cl)c(C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)c1	742055220	MBICVNMVPZBNQC-LBPRGKRZSA-N	444.941	1.846	50	20	IDGD	
Cc1cccc(-n2c(NNC(=O)C(C)(C)NS(C)(=O)=O)nc3ccccc3c2=O)c1C	742077264	XBJHZEJWPRTDNO-UHFFFAOYSA-N	443.529	1.773	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc2oc(=O)[nH]c2cc1Cl)c1ccc2c(c1)OCCO2	743250163	ADZJOMHSHRGAGB-UHFFFAOYSA-N	425.806	1.169	50	20	IDGD	
COCCOC[C@@H]1CCN(C(=O)NNC(=O)[C@@H](C)Oc2cccc(Br)c2)C1	743522136	VVLMCDUKLGOLOY-ZIAGYGMSSA-N	444.326	1.942	50	20	IDGD	
O=C(NCc1cccnc1N1CCOCC1)NNC(=O)c1cccc(Br)c1	743530667	ZNYCEKZLCZGVEO-UHFFFAOYSA-N	434.294	1.825	50	20	IDGD	
CC(C)Oc1ccc(NC(=S)NNC(=O)CCN2C(=O)[C@H]3[C@H](C2=O)[C@H]2CC[C@H]3O2)cc1	743820058	FXOUATXNTZGGRP-JOCBIADPSA-N	446.529	1.344	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)CCc2c(C)noc2Cl)cc1	744314849	IOQXPHTUSXYXAF-UHFFFAOYSA-N	428.898	1.346	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CN2CCC(n3cc(Br)cn3)CC2)c1	744400377	HVWKPHBNSJJBDV-UHFFFAOYSA-N	431.294	1.615	50	20	IDGD	
C[C@@H](CCN(C)C)NC(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	744865050	ARRDMQMRQHNJCX-INIZCTEOSA-N	436.516	1.729	50	20	IDGD	
O=C(NCc1ccc(CN2CCOCC2)cc1)NNC(=O)c1cc([N+](=O)[O-])ccc1O	745336927	WHYSZHZAVYAGHM-UHFFFAOYSA-N	429.433	1.277	50	20	IDGD	
NC(=O)[C@@H]1CCCN(CCCNC(=O)NNC(=O)c2ccc(F)cc2Br)C1	745829875	HUPOGDIXUMMJGK-LLVKDONJSA-N	444.305	1.120	50	20	IDGD	
COC[C@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1)C(C)C	745851195	YUKUZBQDGIPWEH-IBGZPJMESA-N	448.545	1.780	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@@H]2[C@H]3CCCO[C@@H]3C2(C)C)cc1	745860370	QNURABMWXQQNAK-NXHRZFHOSA-N	438.550	1.150	50	20	IDGD	
CN(C)C(=O)NNC(=O)c1cccc(NS(=O)(=O)c2ccc3c(c2)OCCCO3)c1	746012737	IOAFERJFYOVMFP-UHFFFAOYSA-N	434.474	1.565	50	20	IDGD	
C[C@@H](C(=O)Nc1cccc(F)c1)N1CCN(C(=O)NNC(=O)c2ccc(C#N)cc2)CC1	747103513	NZPIUBHFKMRIOH-HNNXBMFYSA-N	438.463	1.697	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)NCCOc2ncccc2F)c2ccccc2c1=O	747450976	WAEVLNXJNSPOCL-UHFFFAOYSA-N	428.424	1.535	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNS(=O)(=O)c2cc(C(=O)OC)cs2)cc1	749150568	ARXJDMXPXKLIEF-LLVKDONJSA-N	428.488	1.710	50	20	IDGD	
COc1cc(CNC(=O)NN[C@@]2(C)CCS(=O)(=O)C2)cc(Br)c1OC	749188318	GMAWDMAVHLCFQT-HNNXBMFYSA-N	436.328	1.347	50	20	IDGD	
CS(=O)(=O)Cc1nc2ccccc2n1CC(=O)NNC(=O)c1cc2ccccc2o1	749477565	MJHMREUKSAHQAW-UHFFFAOYSA-N	426.454	1.788	50	20	IDGD	
O=C(CCc1ccccc1)NNC(=O)NCc1ccc(S(=O)(=O)N2CCOCC2)cc1	749918558	VTCITRDZOASLOX-UHFFFAOYSA-N	446.529	1.171	50	20	IDGD	
O=C(CC12CC3CC(CC(C3)C1)C2)NNC(=O)NCCNS(=O)(=O)Cc1ccon1	750289847	XQTKTMMEZMLKRN-UHFFFAOYSA-N	439.538	1.031	50	20	IDGD	
COc1nn(C)c2nc(C)c(CCC(=O)NNC(=O)CNC(=O)c3cccs3)c(C)c12	751209920	YMKSNXOFYXMWNN-UHFFFAOYSA-N	444.517	1.165	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@@H](C)C(=O)NNC(=O)CCCN1C(=O)NC(C)(C)C1=O	751458060	KUFYEUAUFXQOLX-ZDUSSCGKSA-N	438.912	1.982	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=S)N[C@H](C)C3CC3)CC2)c(C)c1	751619539	OJKPSEZEDPEELU-OAHLLOKOSA-N	438.619	1.998	50	20	IDGD	
CS[C@@H](CNC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1)C(C)(C)C	753290976	MFMKSMHKUOCBML-HNNXBMFYSA-N	430.596	1.724	50	20	IDGD	
CC(C)CCn1ncc(NC(=O)C(=O)NNC(=O)COc2ccccc2O)c1C(C)C	753840620	KPTZVVFYIQCXQB-UHFFFAOYSA-N	431.493	1.923	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)Cc2ccccc2C)c(C)c([N+](=O)[O-])c1	753841386	RJPCYICBISFBBV-UHFFFAOYSA-N	428.401	1.327	50	20	IDGD	
O=C(NNC(=O)c1cc2c(s1)CCC2)NC1CCN(S(=O)(=O)C(F)(F)F)CC1	755306131	NWJYHWSKSRSQNI-UHFFFAOYSA-N	440.469	1.495	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)Nc2cc(C)nn2[C@@H]2CCS(=O)(=O)C2)cc1	755535774	RIELYNQZYNCXAB-OAHLLOKOSA-N	435.506	1.345	50	20	IDGD	
CCn1c(NNC(=O)CN2C(=O)NC3(C[C@@H](C)C[C@H](C)C3)C2=O)nc2ccccc2c1=O	756909532	YKFUNJAGGTWUGV-KBPBESRZSA-N	440.504	1.606	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cncc(I)c2)cc1C	757632697	CPXYUIAKSZSOJG-UHFFFAOYSA-N	438.225	1.703	50	20	IDGD	
CN(C)N(C(=O)CCn1cnc2sc3c(c2c1=O)CCCC3)[C@H]1CCS(=O)(=O)C1	757867827	WZZQAXKBCTVNIF-ZDUSSCGKSA-N	438.575	1.219	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)COc1ccc(C(C)(C)C)cc1C(C)(C)C	758048770	VVSPRAUFNHYVSE-CYBMUJFWSA-N	427.567	1.746	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1scnc1Br	758301540	ULUZPTLBHWQIRO-UHFFFAOYSA-N	447.336	1.683	50	20	IDGD	
Cc1cnc([C@@H](C)CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)s1	758742952	AIGSHJJEFVAADX-NSHDSACASA-N	425.536	1.450	50	20	IDGD	
O=C(/C=C/c1ccc(I)o1)NNC(=O)C(=O)Nc1ccccn1	758835276	VXHXMLXTJFDLMG-FNORWQNLSA-N	426.170	1.079	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccnn1Cc1ccc(F)cc1	760279603	OFHSPCMAKLUBIN-CYBMUJFWSA-N	443.410	1.763	50	20	IDGD	
COc1c(C)c2c(c(O)c1C/C=C(/C)CCC(=O)NNc1nnc(C)c(O)n1)C(=O)OC2	760792557	BBLFTGMGTYSLFR-YHYXMXQVSA-N	443.460	1.991	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)Nc1ccc(CN2C(=O)CCCC2=O)cc1	760953609	FJIHKHHIRUNDHY-UHFFFAOYSA-N	426.429	1.663	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)N[C@H]2CCCN(c3ccccc3F)C2=O)nc2ccccc21	761815672	FQCOTHTTWWBVOJ-INIZCTEOSA-N	438.463	1.781	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3cc(F)c(O)c(F)c3)cc2)CC1	762619560	IYPAGJXFYBOHGV-UHFFFAOYSA-N	426.445	1.363	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)CCc2c(C)nc3c(C(N)=O)cnn3c2C)n1	762902245	QKFKHBSSSIHISL-UHFFFAOYSA-N	425.497	1.157	50	20	IDGD	
O=C(NNC(=O)c1ccc2ccccc2n1)C(=O)Nc1cc(F)cc(N2CCOCC2)c1	763450554	MQHFUDVDKAYGKJ-UHFFFAOYSA-N	437.431	1.610	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)CCCN3C(C)=O)cc1OC	763543129	LPLSVOHSLHDGOI-UHFFFAOYSA-N	440.456	1.403	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cnc(Br)cc2C)cc1OC	763550656	JAHOZNZGZNOEBF-UHFFFAOYSA-N	437.250	1.569	50	20	IDGD	
CCC(=O)Nc1ccc(Cl)c(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1	763572734	OIRBGNXJFMNURN-INIZCTEOSA-N	446.847	1.614	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)n([C@H]2C[C@H]3CC[C@H]2C3)n1	763573863	VKOJRRKTDVXART-XSWJXKHESA-N	439.472	1.479	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(C(=O)c3nccn3C)cc2)c1	763618941	JXBCCEQDPOTXKP-UHFFFAOYSA-N	435.440	1.124	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(OC[C@@H]3CCCO3)cc2)c1	763619014	MGGSEFOCRKXIFK-IBGZPJMESA-N	427.457	1.718	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(Br)cc1C	763656310	ANRNORHJHUTMHY-UHFFFAOYSA-N	436.262	1.931	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccc(Br)cc2)nn1CCC#N	763695581	PMLWBAGEIRADBQ-UHFFFAOYSA-N	449.265	1.033	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCC3)c(=O)n(-c2ccccc2)n1C	763780780	FTNVUSZJMVJYNB-UHFFFAOYSA-N	439.497	1.434	50	20	IDGD	
C[C@H]1COCCN1c1ccc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCC3)cc1	763784662	GAPJSBPLTXHXLA-ZDUSSCGKSA-N	428.514	1.862	50	20	IDGD	
Cc1nccn1-c1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)cn1	763867622	XRBYFNBVAOQCCO-LBPRGKRZSA-N	426.408	1.268	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)nn1-c1ccccc1	763870714	BTRSLHNWHUVMLS-AWEZNQCLSA-N	425.420	1.873	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1cc(C#N)ccc1OC(F)F	763872048	JRWXGMQRMVJGIT-SNVBAGLBSA-N	436.346	1.852	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cc3c(cc2C)OCO3)cc1	763875923	BQUUDVDBDMFBGY-ZDUSSCGKSA-N	427.413	1.480	50	20	IDGD	
CS(=O)(=O)c1ccccc1NC(=O)C(=O)NNC(=O)c1ccc(Br)s1	763940587	KCNBURWKWROLNZ-UHFFFAOYSA-N	446.304	1.314	50	20	IDGD	
CC(C)Oc1cc(F)ccc1NC(=O)C(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	763951048	YSOQKFNIMNRIJX-UHFFFAOYSA-N	441.419	1.904	50	20	IDGD	
CCOc1ccc(OC)cc1NC(=O)C(=O)NNC(=O)c1cc(Br)c[nH]1	763994909	JLAKFONMWIINGT-UHFFFAOYSA-N	425.239	1.584	50	20	IDGD	
CC[C@@H](C)C(=O)NNC(=O)C(=O)Nc1cnc2c(c1)C[C@H](NC(=O)OC(C)(C)C)CC2	764082484	NQIQOCAUAZKXAN-TZMCWYRMSA-N	433.509	1.596	50	20	IDGD	
CS(=O)(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)Cc2ccc3ccccc3c2)c1	764085168	PYESXTKDDIBLQB-UHFFFAOYSA-N	439.493	1.713	50	20	IDGD	
CC[C@@H](C)C(=O)NNC(=O)C(=O)Nc1cc(C)nn1[C@@H]1CCN(Cc2ccccc2)C1	764087217	YJUZRVWVTXMIGS-CRAIPNDOSA-N	426.521	1.771	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cccc(-c4nnco4)c3)n[nH]2)cc1	764110822	LLJCQFIJBUQJAU-UHFFFAOYSA-N	431.412	1.835	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)C[C@@H](OC)C3)o1	764139553	VADUITQLGVBXBP-SFHVURJKSA-N	428.489	1.635	50	20	IDGD	
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC(=O)C(=O)NNC(=O)CC1CC1	764142763	KEMXMXKBQUICON-UHFFFAOYSA-N	440.456	1.842	50	20	IDGD	
CC(C)S(=O)(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)CCc2ccccc2O)c1	764288001	CCRIDRPECRRHJK-UHFFFAOYSA-N	447.513	1.434	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)C(=O)Nc1ccc(Cl)c(C(=O)NC2CCCCC2)c1	764297566	BLHUIYIRSCFDQK-UHFFFAOYSA-N	446.895	1.834	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc(CC(N)=O)cc3)n[nH]2)cc1	764385297	VYVMTJRUUGYVTO-UHFFFAOYSA-N	434.456	1.067	50	20	IDGD	
Cn1nc(O)c2c(C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)cc(C3CC3)nc21	765311124	QMZKXUHDKOHSNT-UHFFFAOYSA-N	432.481	1.617	50	20	IDGD	
COc1ncccc1NC(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	765314040	ZRWPAVGNTAACLX-UHFFFAOYSA-N	432.912	1.714	50	20	IDGD	
C#CCNS(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)c1	765620057	OHEZCZNVZCWEQD-UHFFFAOYSA-N	441.444	1.202	50	20	IDGD	
O=C(COc1ccccc1Cc1ccccc1)NNC(=O)NCC1(N2CCOCC2)CC1	765642805	VQAZNOQKJGUPFJ-UHFFFAOYSA-N	438.528	1.851	50	20	IDGD	
Cn1cc(CCC(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)c2ccccc21	765733113	NNPGRGWABCFFTJ-UHFFFAOYSA-N	447.539	1.716	50	20	IDGD	
CCc1noc2ncc(C(=O)NNC(=O)CN3CCN(Cc4ccc(C)cc4)CC3)cc12	765748926	JPBAFDCLMZJUMR-UHFFFAOYSA-N	436.516	1.672	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)NCc1cccnc1N1CCC(C(N)=O)CC1	765752974	SPZVSDPFXYRLDD-UHFFFAOYSA-N	446.533	1.013	50	20	IDGD	
CNc1snc(C)c1C(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	766661283	VMZVSTMIWLKZKL-UHFFFAOYSA-N	436.969	1.725	50	20	IDGD	
N#CCOc1ccccc1C(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	766661627	XTSGOOLLOBPTSH-UHFFFAOYSA-N	441.919	1.821	50	20	IDGD	
C[C@@H](OC(=O)[C@@H](Br)C(C)(C)C)C(=O)NCCc1ccc(S(N)(=O)=O)cc1	766749726	OLYDYFRMNQQDLY-BXUZGUMPSA-N	449.367	1.734	50	20	IDGD	
C=CCOc1cc(OC)ccc1C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	766801923	SGXWPVCYKANSJI-LJQANCHMSA-N	442.424	1.404	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2ccccc2S(=O)(=O)CCN(C)C)cc1OC	767189374	KYYBOQGXQVZPDU-UHFFFAOYSA-N	435.502	1.114	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)Cn3c(O)nc4ccccc4c3=O)n[nH]2)c1	768264244	FQWJCDZWFLENRD-UHFFFAOYSA-N	432.440	1.570	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)[C@@H](C)NS(=O)(=O)c3cccs3)n[nH]2)cc1	768848046	MUZCFXNCHQKYKL-GFCCVEGCSA-N	433.515	1.575	50	20	IDGD	
N#Cc1cc(Cl)nc(NNC(=O)[C@@H]2CCCC[C@H]2C(=O)N[C@@H]2CCS(=O)(=O)C2)c1	769055357	GJTPJNDQOHHIOY-MGPQQGTHSA-N	439.925	1.159	50	20	IDGD	
COc1cc(F)c(S(=O)(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)cc1OC	771604125	HALXCJCXTWJPDP-UHFFFAOYSA-N	445.856	1.122	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)C1CCN(S(=O)(=O)c2ccc(C)cc2C)CC1	771927800	DUCQADQLPYJXRW-HNNXBMFYSA-N	439.534	1.193	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1nn(-c2cccc(C(F)(F)F)c2)c(C)cc1=O	771964530	WPDZZADGAITWNT-LLVKDONJSA-N	440.378	1.662	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNS(=O)(=O)c1cccc(-c2nnnn2C)c1	773250492	FOYOLEQDYRVOBX-NSHDSACASA-N	436.881	1.308	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)C(=O)Nc1ccc(Cl)cn1	773511462	MAYARECORCRFHN-UHFFFAOYSA-N	430.896	1.033	50	20	IDGD	
COc1nc(C)c(Br)cc1C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	776775127	IVORYVOXPPHHKI-UHFFFAOYSA-N	442.291	1.639	50	20	IDGD	
Cn1cc(C(=O)NNS(=O)(=O)c2cc(Cl)ccc2OC[C@@H]2CCCCO2)cn1	777629258	JCXLWGCRGUSEOJ-AWEZNQCLSA-N	428.898	1.645	50	20	IDGD	
Cc1nc(-c2cnn(C)c2)sc1C(=O)N1CCN(S(=O)(=O)CBr)CC1	777831577	CSIOILSRBXCOGI-UHFFFAOYSA-N	448.368	1.292	50	20	IDGD	
Cc1nn(-c2ccccc2)c(C)c1C(=O)N1CCN(S(=O)(=O)CBr)CC1	777832608	OLFHXNYMWOLTMY-UHFFFAOYSA-N	441.351	1.929	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)NNc2ccc([N+](=O)[O-])cc2Br)c(C)o1	779140360	IAOJVIKVZWEJFX-UHFFFAOYSA-N	433.240	1.924	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)c2cc(I)ccc2Br)cn1	779914164	OIYRSWYHAILWCY-UHFFFAOYSA-N	449.046	1.862	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)NCc2ccc(C(=O)NN=c3cc[nH]cc3)cc2)cc1	781021638	YIVXCGIFYCQLPI-UHFFFAOYSA-N	439.497	1.697	50	20	IDGD	
COc1ccc(C(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)cc1-n1cnnn1	782016638	HYQDEFFBSPHARE-UHFFFAOYSA-N	442.379	1.721	50	20	IDGD	
CC(=NNC(=O)C(F)F)c1ccc(S(=O)(=O)NCc2ccc(C(=O)O)cc2)cc1	782236092	QZCRQAYNYDDUAU-UHFFFAOYSA-N	425.413	1.969	50	20	IDGD	
O=C(CN1CCC[C@H](n2ccc(C(F)(F)F)n2)C1)NNC(=O)c1cccc([N+](=O)[O-])c1	782535037	CJVQNJKQDVHOAZ-AWEZNQCLSA-N	440.382	1.908	50	20	IDGD	
CN(C)C(=O)C[C@@H]1CN(C(=O)C(=O)NNC(=O)c2ccc(O)cc2)c2ccc(Cl)cc21	782833181	YCSRIAUOEJRWLH-CYBMUJFWSA-N	444.875	1.415	50	20	IDGD	
CC(C)(C)OC(=O)N[C@]1(C(=O)NNc2ccc(C(N)=O)nn2)[C@H]2CCCO[C@H]2C1(C)C	783902261	XNWBJOTZNVJLFO-CJAGKMTESA-N	434.497	1.117	50	20	IDGD	
O=C1COc2ccc(NC(=O)C(=O)NNc3nc(-c4ccc(Cl)cc4)no3)cc2N1	784800281	YTASKBDVEQDVCK-UHFFFAOYSA-N	428.792	1.803	50	20	IDGD	
COCCOc1ncccc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)C(F)F)cc1	784836090	PLUZXKQWMVUVCL-UHFFFAOYSA-N	444.416	1.185	50	20	IDGD	
O=C(NNc1cccnn1)C(=O)Nc1ccc(CCn2cc(Br)cn2)cc1	784858477	NWGJWEMQMNDONL-UHFFFAOYSA-N	430.266	1.760	50	20	IDGD	
CN1CCC[C@@H](N(C)C(=O)c2ccc(NC(=O)C(=O)NNc3ccc(Cl)nc3)cc2)C1	784874754	LNBOWXAACYUAHZ-QGZVFWFLSA-N	444.923	1.983	50	20	IDGD	
Cn1ccnc(NNC(=O)C(=O)Nc2ccnn2Cc2cccc(Cl)c2Cl)c1=O	785087179	XCHZMGFNPNNQQE-UHFFFAOYSA-N	436.259	1.414	50	20	IDGD	
O=C(NNc1c(F)cc(C(=O)NC2CC2)cc1F)C(=O)Nc1cccnc1-n1cccn1	785100299	VVVXNVOPAKBJLX-UHFFFAOYSA-N	441.398	1.520	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)[C@@H]2COc3cc(C)c(C)cc32)cc1OC	786966032	KEBJYQHHQKKTID-MRXNPFEDSA-N	428.441	1.801	50	20	IDGD	
CCNC(=O)Nc1ccc(C)c(NC(=O)C(=O)NNC(=O)COc2ccccc2F)c1	787541034	JFYNXQFDSUJENP-UHFFFAOYSA-N	431.424	1.440	50	20	IDGD	
O=C(CCC(=O)Nc1ccc2nc(O)[nH]c2n1)NNC(=O)c1cccc(Br)c1	787898351	DWXUHRUBAOZNEQ-UHFFFAOYSA-N	447.249	1.606	50	20	IDGD	
COC(=O)COc1ccc(C=NNC(=O)CSc2nc(C)cc(C)n2)cc1[N+](=O)[O-]	788698924	NYWCAVFZZCQSPK-UHFFFAOYSA-N	433.446	1.796	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)C(=O)Nc2nc3c(s2)CCCCCC3)c1	789739219	IPHVYJCEKZXXST-UHFFFAOYSA-N	430.490	1.555	50	20	IDGD	
COc1cc(CC(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)cc(OC)c1O	789869731	XAWJRHOCWBSJBX-UHFFFAOYSA-N	440.456	1.704	50	20	IDGD	
Cn1cncc1CCC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	790070383	OUOMVVUKPBDDRG-UHFFFAOYSA-N	441.513	1.292	50	20	IDGD	
CCN(C)c1ccc(C=NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cn1	790141552	NBDPYJQYSFVGPN-UHFFFAOYSA-N	431.518	1.323	50	20	IDGD	
CN1C(=O)C[C@H](C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)[C@H]1c1ccc(Cl)c(Cl)c1	790218961	YJENGPQCCNCTKL-JRPNMDOOSA-N	448.328	1.095	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)[C@@](C)(O)Cn2ccc(C)cc2=O)cc1OC	790484639	GIUQSCYKIJMYFI-QFIPXVFZSA-N	431.489	1.556	50	20	IDGD	
O=C(Cn1c(=O)oc2cc([N+](=O)[O-])ccc21)NNC(=O)[C@H]1OCC[C@H]1c1ccccc1	791042638	SVGZNFJXYXNKDF-KSSFIOAISA-N	426.385	1.223	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)[C@H]1CCN(CC(F)(F)F)C1	792210201	RSGQPKIHPDSKAQ-ZDUSSCGKSA-N	436.456	1.035	50	20	IDGD	
CCCCn1ncc(NC(=O)C(=O)NNC(=O)c2nnc(O)c3ccccc23)c1C(C)C	792268675	OVMZJEPZFAAWNK-UHFFFAOYSA-N	439.476	1.855	50	20	IDGD	
CN(C)C(=O)C[C@H]1CN(C(=O)C(=O)NNc2nc3ccccn3n2)c2ccc(Cl)cc21	792393969	JIBFZOHBKDRBCW-LBPRGKRZSA-N	441.879	1.435	50	20	IDGD	
COc1cccc(NNC(=O)C(=O)Nc2ccc3c(c2)N(CC(F)F)C(=O)CS3)n1	793017411	DPRCZYCFUDRSKE-UHFFFAOYSA-N	437.428	1.876	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)C(=O)Nc1cccc(Br)n1	793022370	WHJYFLWKZMMLOO-UHFFFAOYSA-N	431.044	1.334	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)N(CC(F)F)C(=O)CS2	793026620	SLQIYSZZEQRJPB-UHFFFAOYSA-N	449.439	1.494	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NCCSSC)cc1S(=O)(=O)N1CCCC1	793077825	HBQRAYBCEPISOC-UHFFFAOYSA-N	433.577	1.546	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1cc(NS(C)(=O)=O)cc(C(F)(F)F)c1	795782612	NTPQOHNQZQHOMB-QMMMGPOBSA-N	425.385	1.180	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@H]2C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)cc1	798986986	DRLISEOXJILTPT-KRWDZBQOSA-N	448.520	1.752	50	20	IDGD	
CCn1c(=O)c(=O)[nH]c2cc(C(=O)NNC(=O)Nc3ccc(Br)cc3)ccc21	801998822	HSBGMOZGPOQYOB-UHFFFAOYSA-N	446.261	1.939	50	20	IDGD	
CC(C)(C(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)c1ccc2c(c1)OCCO2	802067345	CCSYRSYYUXSFBP-UHFFFAOYSA-N	433.486	1.992	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)Nc1cccc2cc(Br)cnc12	806562207	FABXSWNAYVALRT-SNVBAGLBSA-N	427.280	1.585	50	20	IDGD	
COCCOCc1ccc(C=NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1	807949481	HIYZFXSYCQIFPS-UHFFFAOYSA-N	433.530	1.929	50	20	IDGD	
CN1CC(=O)N(Cc2ccc(C(N)=O)cc2NC(=O)NNc2cccc(Cl)n2)C1=O	814664225	SRLDZNOJZYWCRY-UHFFFAOYSA-N	431.840	1.377	50	20	IDGD	
Cc1cc(C)c(C(=O)O)cc1C=NNC(=O)C(=O)NN=Cc1cc(C(=O)O)c(C)cc1C	814692279	OXRCIRMEHFAXJO-UHFFFAOYSA-N	438.440	1.917	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)N(C)C)c(C)cc1C	815750530	CYRMQNINKGFRHX-UHFFFAOYSA-N	448.501	1.422	50	20	IDGD	
CC(C)(C)OC(=O)N1CCOc2ccc(NC(=O)C(=O)NNC(=O)[C@H]3CCCO3)cc2C1	815779831	XTTPJMRPIHELHR-MRXNPFEDSA-N	448.476	1.081	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)Cc1ccc(S(=O)(=O)N2CCCC2)s1	910843782	PSLIFCGIIXHIRV-UHFFFAOYSA-N	441.506	1.441	50	20	IDGD	
O=C(COc1cccc(NC(=O)C2CC2)c1)NNC(=O)c1nn(-c2ccccc2)cc1O	914857729	VFOOELNUILGLJT-UHFFFAOYSA-N	435.440	1.766	50	20	IDGD	
C[C@H]1CN(c2ccc(C(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)cn2)C[C@H](C)O1	914877312	SAMBWZAPBJGBEF-KBPBESRZSA-N	436.472	1.017	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)c1ccccn1	915898580	DUUPVNFQDZGARA-OAHLLOKOSA-N	431.518	1.961	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)Cc2ccc(C(=O)NNC(=O)c3cc[nH]n3)cc2)cc1	916144944	AAKVMCMCMZDNSR-UHFFFAOYSA-N	427.486	1.614	50	20	IDGD	
CNS(=O)(=O)c1ccc(CNC(=O)NNC(=O)CSc2ccc(C)cc2)s1	916233478	XKPFJDRERHYEKZ-UHFFFAOYSA-N	428.561	1.587	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)NCc3ccc(N4CCN(C)CC4)nc3)n[nH]2)cc1	916247053	XDQJTICMGMQYPP-UHFFFAOYSA-N	448.531	1.676	50	20	IDGD	
COc1ccc(C=NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1OC	916258572	FYIQXQSMQZOKSF-UHFFFAOYSA-N	433.486	1.489	50	20	IDGD	
Cc1ccc(C)c(S(=O)(=O)NCCC(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)c1	916561815	GICWRBLPXTVZKT-UHFFFAOYSA-N	446.529	1.375	50	20	IDGD	
COc1ccc(F)cc1[C@@H](C)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	916590829	HUEYCKDYKBHQEI-GFCCVEGCSA-N	438.481	1.790	50	20	IDGD	
CC(C)(C)OC(=O)N(CCCNC(=O)NNC(=O)[C@@H]1COc2ccccc2O1)C1CC1	916631456	QXSZYEXPCYRWLC-KRWDZBQOSA-N	434.493	1.946	50	20	IDGD	
CC[S@@](=O)c1ccccc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	917510414	QRIIPKMRBKIYRP-GDLZYMKVSA-N	449.554	1.673	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)Nc2cnn(CCOC)c2)c2ccccc2c1=O	918542785	ILVIVMRMZLSWOZ-UHFFFAOYSA-N	441.492	1.896	50	20	IDGD	
C[C@H](Nc1ccc(C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)cc1[N+](=O)[O-])c1ccccn1	919693763	BXCKMXRMMYZKRN-JSGCOSHPSA-N	447.473	1.359	50	20	IDGD	
O=C(NCCN1CCc2sccc2C1)NNC(=O)c1nn(-c2ccccc2)cc1O	919784549	MHSHXJKIMQQHOT-UHFFFAOYSA-N	426.502	1.642	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)c2nc(S(C)(=O)=O)n3ccccc23)cc1	920274893	ZOKPJMGMWCNYIY-CYBMUJFWSA-N	446.485	1.365	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NN=Cc1cc(C)ncn1)N(S(C)(=O)=O)CC2	1117698164	YGHKEXVRMVDUMX-KRWDZBQOSA-N	447.517	1.201	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2cncn2-c2ccccc2)cc1	1323296591	HMWXBPJXGAAABL-UHFFFAOYSA-N	442.501	1.267	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)Nc1ccnc(Cc2ccccc2)n1	1323844824	LWMYQBIEMIRKSF-UHFFFAOYSA-N	432.488	1.927	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2ccc(N3CCN(C(=O)C4CC4)CC3)nc2)cc1	1337785593	ORNGFGLIJXPTQX-UHFFFAOYSA-N	438.488	1.615	50	20	IDGD	
O=C(c1ccc2nc(CO)[nH]c2c1)N1CC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1777706444	ZQRNFQNHTQRITI-SFHVURJKSA-N	427.288	1.302	50	20	IDGD	
O=C(c1cnc2ccccn12)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1777825205	QWCXCUYTRVTDLU-RHSMWYFYSA-N	425.258	1.468	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H]3Cc4ccccc4O3)C2)C1	1778249579	UXRFAWFVDVSYNU-VPWXQRGCSA-N	437.334	1.994	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc(Cl)o2)C1	1778415623	RTHFCRCNICXLRT-FOIQADDNSA-N	440.928	1.434	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnn4cccnc34)C2)C1	1778442752	YAEMEUCUUTZYAS-ACJLOTCBSA-N	436.310	1.204	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H]1CCc3ccccc3[C@H]1O)CCO2	1779294437	GCEFCMWYHLBLGT-WPYKKVEZSA-N	446.620	1.964	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc3nncn3c1)C2	1779544108	MFKDPEBSTAXBAX-DYESRHJHSA-N	445.596	1.708	50	20	IDGD	
Cn1c(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@](C)(Cl)CCl)C2)cccc1=O	1780710367	QRQVGIXRLBUSLJ-CDHQVMDDSA-N	444.359	1.749	50	20	IDGD	
Cn1cc(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](F)Br)C2)cn1	1780776884	HQMMXBKCHYQKSZ-FRFSOERESA-N	431.306	1.167	50	20	IDGD	
COC(=O)[C@H]1CC[C@H](C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](F)Br)C3)C2)CC1	1781326987	VWBFCCAGBSBAGT-WZTLGTBRSA-N	449.317	1.486	50	20	IDGD	
CC(=O)Nc1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)ccn1	1781329734	JEYFHDXCMJPDFK-RHSMWYFYSA-N	443.273	1.174	50	20	IDGD	
O=C(c1ccc(OCC2CC2)cc1F)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1781435515	VIBUJMWNAIAUGV-GHTZIAJQSA-N	440.899	1.658	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3c(F)ccc(O)c3F)C2)C1	1781932519	FKZPRMFLQQLNRE-DYZYQPBXSA-N	433.249	1.897	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CNC(=O)OC(C)(C)C)C1	1781937736	PERTUOPOZQIVJV-BXTJHSDWSA-N	447.960	1.279	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H]1CNc3ccccc31)C2	1782170720	VDAFXICKHFKJQJ-VALFRTSSSA-N	435.952	1.963	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCC(F)(F)F)C2	1782210807	NMPHZOBTQPJNEW-RDTXWAMCSA-N	436.475	1.216	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(Cl)ncn3)CCO2)C1	1783353554	XMPZAPMEHNDZOX-ZBEGNZNMSA-N	431.718	1.747	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)N2CC[C@@]3(CN(C(=O)[C@H](F)Cl)CCO3)C2)C1	1783550073	RPYXYAXVYRSOBL-SIFCLUCFSA-N	447.935	1.998	50	20	IDGD	
COc1ccc([C@H](O)C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)C(Cl)Cl)C[C@@H]32)cc1	1783768809	KBRWWWYHHMUJKR-TUUVXOQKSA-N	431.316	1.512	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cc(F)cc(Cl)c1)CCO2	1783938509	ZVSANOWTYYZUNM-FQEVSTJZSA-N	440.903	1.296	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H]3CCc4nc[nH]c4C3)C2)C1	1784353076	WTAIHMGWPCWPDN-FASAQXTFSA-N	429.348	1.581	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(CCN(C(=O)COc3ccccc3C#N)C2)C1	1785380846	ZFVWFTAWDUPMPA-OAQYLSRUSA-N	431.565	1.618	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3noc4c3CCCC4)[C@H]2C1	1787305731	DPKOMDAOBXBNAE-QEWYBTABSA-N	425.913	1.401	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C[C@@H]3COc4ccccc4O3)C[C@@H]21)[C@H](F)Cl	1787443396	IFWNKLFAUDATKT-XYKJDMJCSA-N	426.872	1.731	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3C[C@@]34C(=O)Nc3ccccc34)C[C@@H]21)[C@@H](F)Cl	1787448725	ACWHGFOOFVMHQL-LDBZLIDKSA-N	435.883	1.411	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(N4C(=O)C=CC4=O)cc3)C[C@@H]21)[C@H](F)Cl	1787450061	TWZLHQJACPVQNM-FJXLLPKBSA-N	449.866	1.244	50	20	IDGD	
COc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]3C2)ccc1[N+](=O)[O-]	1787450493	ZPHGTIUTWDNMOQ-GVAFMPQTSA-N	429.832	1.731	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4cc(O)ccc4n3)[C@H]2C1	1787868733	UATZHHWRRXOELQ-VERUCKTNSA-N	447.919	1.788	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc4c3NC(=O)C4=O)C[C@@H]21	1789863342	NTYMPPFFASJFRQ-DDWPSWQVSA-N	433.892	1.432	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnn4c3OCCC4)C[C@@H]21	1789872656	YABJPRNPJSIMFH-VFSPDHHESA-N	445.347	1.495	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cncc(N(C)C)c3)C[C@@H]21	1791057939	ZVXHRVAOHGWKES-PYTWLRIVSA-N	439.354	1.524	50	20	IDGD	
Cc1ccc(=O)n(C(C)(C)C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]3C2)n1	1791298376	SVZNDJBIKRNZKZ-IHRRRGAJSA-N	445.347	1.070	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)Cn3ccnc3)[C@H]2C1	1791631268	ZTOVGPOZQHBMMF-HMDCTGQHSA-N	441.370	1.672	50	20	IDGD	
CCOc1cnc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)CBr)cn1	1792870115	GGVJPAYBRXCCFV-NFFDBFGFSA-N	441.326	1.110	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H](CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](O)CCl)C1	1793116855	XHYUSRMFCGHMMD-ZOFXXKQRSA-N	443.972	1.871	50	20	IDGD	
Cc1ncccc1CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)CBr)C2	1793916795	NFDTZDYCMFCOJH-KUZCPNRJSA-N	438.366	1.943	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1csnc1C	1794854188	GSTFYDRTTRWXFX-BFEVCPCASA-N	428.518	1.837	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1nc2ccccn2n1	1796102979	DJVLHJCSBRUTQE-QVHKTLOISA-N	436.310	1.106	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)c1ccnc(C(F)(F)F)c1	1796188298	NBQJVFRJEGDDDI-BJWYYQGGSA-N	447.222	1.346	50	20	IDGD	
COc1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)c(Cl)c1	1796192419	JGPAXJBNBJVDGX-BJWYYQGGSA-N	442.708	1.594	50	20	IDGD	
COc1ccc(/C=C(\C)C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)cc1	1796193257	YPAANYBXAFLGNZ-RFYQUTDWSA-N	448.328	1.730	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1Cc2ccccc2CN1	1796374313	XXPPOOMQSMQIPN-SOGIYBJLSA-N	436.350	1.074	50	20	IDGD	
COC(=O)[C@@H](CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](F)Cl)NC(=O)OC(C)(C)C	1796810296	VHHIJXURLKNPHF-WPLOAARJSA-N	449.907	1.615	50	20	IDGD	
C[C@@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCBr)C2)[C@@H]1SC(=N)NC1=O	1796873451	IDRISUISCIAANX-HMUNZLOLSA-N	431.356	1.212	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2)c1ccc2nccnc2c1	1797054982	RNQRIZIMCBIKDG-ZSBFGKGUSA-N	433.306	1.618	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2)c1cn2cc(F)ccc2n1	1797427956	QEKWGOIYVQTONW-DPIQGUFMSA-N	439.285	1.462	50	20	IDGD	
O=C(CCNC(=O)c1ccc[nH]1)NC[C@@H]1CCN(C(=O)[C@@H](F)Cl)[C@@H]1c1cccnc1	1804460347	FZYMAOQJWGLJMR-BMGDILEWSA-N	435.887	1.770	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2cccnc2C(N)=O)[C@H]1c1cccnc1	1804812280	SBXFGTOZDSOZLC-UWWQBHOKSA-N	429.908	1.913	50	20	IDGD	
Cc1ccc(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)nc1	1805867757	HTYIAPDTKVMOBE-KNQAVFIVSA-N	444.300	1.098	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)C2(C#N)CC2)[C@@H]1c1cccnc1	1806849669	DQDXFQXJGCOXFH-UKVGILNFSA-N	447.499	1.525	50	20	IDGD	
N[C@@H](Cc1cscn1)C(=O)NC[C@H]1CCN(C(=O)C(Cl)Cl)[C@@H]1c1cccnc1	1808209899	DXSWMDNNDPMQFV-VHDGCEQUSA-N	442.372	1.918	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)c2cn[nH]c2)[C@@H]1c1cccnc1	1808416474	AFPFUTZLWCXAES-PAAWNMQJSA-N	448.487	1.258	50	20	IDGD	
Cc1cscc1C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1808619865	ILZAJOKKAQFCKE-GHTZIAJQSA-N	449.341	1.765	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2csnn2)[C@H]1c1cccnc1)[C@H](F)Br	1808649186	LDDXJTHNIVQZCG-DRZSPHRISA-N	428.287	1.943	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)c2ccc[nH]2)[C@@H]1c1cccnc1	1810303550	VDAHZDCXPJJSML-DNVCBOLYSA-N	433.472	1.042	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)Cc2c(C)n[nH]c2C)[C@@H]1c1cccnc1	1810414771	UQYLMTWRCGPEMY-KPFFTGBYSA-N	433.940	1.924	50	20	IDGD	
C[C@H](Cn1cncn1)C(=O)N1CC[C@H](CNC(=O)CO[Si](C)(C)C)[C@H]1c1cccnc1	1810545911	HMFSBKPXYOSDMT-YVWKXTFCSA-N	444.612	1.867	50	20	IDGD	
COc1cc(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)ccc1O	1811940958	VSVNYCAIHKBKOV-VDZJLULYSA-N	433.892	1.715	50	20	IDGD	
Cc1ccoc1C(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1813070909	OBWPUROUPJOOME-PXNSSMCTSA-N	427.505	1.676	50	20	IDGD	
C#CCCCCC(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1	1813227818	XXOHFRDPLOGNDZ-XMSQKQJNSA-N	448.527	1.593	50	20	IDGD	
C[C@H](C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)n1cccc1	1813309523	NLMDEKLYPHASGL-PIPMEXSNSA-N	446.316	1.144	50	20	IDGD	
Cc1ccc(=O)n(C(C)(C)C(=O)N[C@@H]2CCc3nc(NC(=O)[C@@H](F)Cl)sc3C2)n1	1817125363	MIXCTZNAZBFQOA-QMTHXVAHSA-N	441.916	1.890	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CN2CCOCC2)n[nH]1	1817148762	CMOLTXSBKOFPMG-RDTXWAMCSA-N	432.352	1.970	50	20	IDGD	
CC[C@@H](NC(N)=O)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCBr)[nH]n1	1817991102	XFKHJVGUGAQCDZ-PWSUYJOCSA-N	429.319	1.634	50	20	IDGD	
C=C[C@H](O)C(C)(C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1	1819368587	WFYOGWRWVOKFKV-HOTGVXAUSA-N	434.541	1.348	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cnccc3C(=O)NN)n[nH]2)on1	1819402121	NXXNNHFIZSBKDX-HNNXBMFYSA-N	438.448	1.324	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)CN)[nH]n1	1820167052	VVQAFCFRLKRCIX-OAHLLOKOSA-N	430.421	1.508	50	20	IDGD	
Cc1ncccc1C(=O)N[C@@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1	1826080388	HRFBRGWSQFJWHT-CYBMUJFWSA-N	430.534	1.445	50	20	IDGD	
O=C(C(Cl)Cl)N1CCOC[C@]2(C1)CN(C(=O)C1(c3ccccc3)CC1)CCO2	1829843657	NWUBRFMFBILRCO-IBGZPJMESA-N	427.328	1.978	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)COc3cccnc3)C2)C1	1830359210	WKFXOXPDVXYBCH-HXUWFJFHSA-N	425.913	1.182	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(=O)n2O)CC1	1831829083	XYFMVTZJFHFFAI-CVEARBPZSA-N	425.913	1.573	50	20	IDGD	
Cc1onc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](C)CBr)C3)C2)c1C	1831972137	XQCROEGGBKWOCY-KPZWWZAWSA-N	444.326	1.392	50	20	IDGD	
O=C(CCc1ccco1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1833051280	REZSRZONASUNSE-DOTOQJQBSA-N	433.274	1.359	50	20	IDGD	
C[C@@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)[C@H](C)CC(N)=O)CC2)CC1	1833265430	VRZLJQFQDLWVJP-KGLIPLIRSA-N	445.402	1.101	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)CCc3ccccc3F)CC2)CC1)[C@@H](O)CCl	1833312784	DODVDMBGYJZXSY-FQEVSTJZSA-N	439.959	1.930	50	20	IDGD	
O=C(c1coc(Cl)n1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1833557108	DKRHJHAAWBVHJX-HZMBPMFUSA-N	440.653	1.089	50	20	IDGD	
O=C(CCc1ccc(F)nc1)NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1833793662	CEMHLQLUSPUKLU-GOSISDBHSA-N	440.947	1.325	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(O)n3)CCO2)C1	1834193742	YGROLTGXTYZMDZ-ROUUACIJSA-N	432.304	1.094	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)C3CCCCC3)CC2)CC1	1834379208	WRRLCJRTSNWFPK-UHFFFAOYSA-N	435.613	1.511	50	20	IDGD	
O=C(CCBr)NC1CCN(C2CCN(C(=O)c3cncc(O)c3)CC2)CC1	1834423271	ATTNUBYSMBQEJJ-UHFFFAOYSA-N	439.354	1.757	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)c3cccnc3S)C2)C1	1834820329	YXEWOGBGSBVURU-QGZVFWFLSA-N	444.351	1.225	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCC(OC2CCN(C(=O)CCc3nc(N)n[nH]3)CC2)CC1	1836623705	HXXCAUHBJJWNPF-UHFFFAOYSA-N	440.976	1.583	50	20	IDGD	
C[C@@H](Oc1cccnc1)C(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836719625	ATCUCDWCMLHQCG-DNVCBOLYSA-N	439.940	1.447	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)NC(=O)OCC)CC2)CC1	1836923436	XKHNZHFUTJYZCA-DLBZAZTESA-N	447.960	1.457	50	20	IDGD	
O=C(c1cn2cc(F)ccc2n1)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1836961816	BNQRLXFHCMMACZ-GOSISDBHSA-N	445.278	1.347	50	20	IDGD	
CC[C@@H](NC(N)=O)C(=O)N1CCC(OC2CCN(C(=O)[C@H](C)Br)CC2)CC1	1838069570	WMOARLAUSOZRKJ-SWLSCSKDSA-N	447.374	1.215	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(C)nc3O)CCO2)C1	1838667380	DEVJEXJGLXFCPX-JXFKEZNVSA-N	425.913	1.573	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccn(C(C)C)n3)CCO2)C1	1838780380	CSVXXEJPJYQVIX-OXQOHEQNSA-N	426.945	1.942	50	20	IDGD	
O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)c1ccoc1Cl)CCO2	1838843067	KZTCNCCLYDSRCY-INIZCTEOSA-N	435.702	1.788	50	20	IDGD	
Cc1cc(C)n2ccc(C(=O)N3CCO[C@]4(COCCN(C(=O)[C@@H](F)Cl)C4)C3)c2n1	1839626785	UTLGXTBOAHEJHQ-OXQOHEQNSA-N	438.887	1.556	50	20	IDGD	
O=C(CCc1cnc2[nH]ccc2c1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1840080727	AJJCNSUSLMIOFO-PXNSSMCTSA-N	438.887	1.486	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(F)cc3C)C2)C1	1840156911	XXQJGGONHXQUNG-PXNSSMCTSA-N	428.888	1.458	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)c2cccc(N3CCCNC(=O)C3)n2)C1	1842304521	HZJXTWHVUMPUNS-INIZCTEOSA-N	447.967	1.632	50	20	IDGD	
CN(CC(=O)N1CC2(CCCN2C(=O)[C@H](F)Cl)C1)NC(=O)NCc1ccccc1	1843365444	QWICYLOXBWZGCU-INIZCTEOSA-N	425.892	1.070	50	20	IDGD	
O=C(CCn1cncn1)N1CC2(CCCN2C(=O)[C@H](Br)Cc2ccccc2)C1	1845942685	UHNVUCQRECBDPI-QGZVFWFLSA-N	446.349	1.878	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)Cc2ccc3c(c2)CCO3)C1	1846098285	YBFKMVXTRMIDFF-WGOQTCKBSA-N	449.511	1.501	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@](F)(C(=O)N2CCCC23CN(C(=O)[C@@H](O)CCl)C3)C1	1846124180	WBEYGWMDUBNONI-VBKZILBWSA-N	447.935	1.529	50	20	IDGD	
COc1ccc([N+](=O)[O-])c(C(=O)N2CC3(CCCN3C(=O)[C@@H](C)Br)C2)n1	1846176964	PQJQFHSGXIAAAD-SNVBAGLBSA-N	427.255	1.599	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H]2C[C@]21C(=O)N1CCCC12CN(C(=O)[C@@H](O)CCl)C2	1846187592	FZWUGINLYIGDSK-LAPQFRIASA-N	427.929	1.189	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)c1ccncc1-c1ccccc1)C2	1846385227	GKZIPFGWWMANDL-UHFFFAOYSA-N	435.528	1.939	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)NCc2ccccc2CS(=O)(=O)NC(C)C)c1	9863652	XQIWPTHRDIIEMB-UHFFFAOYSA-N	448.545	1.732	50	20	IDGD	
Cc1nc2nc(N)nn2c(C)c1CC(=O)NNC(=O)Cc1nc(-c2ccccc2)cs1	10600513	UIWAYQGIZUBWPQ-UHFFFAOYSA-N	436.501	1.379	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN(C(=O)c2ccc(F)cc2)C1)c1n[nH]c(=O)c2ccccc12	21038589	QCSVHHPEWGGXME-CQSZACIVSA-N	437.431	1.376	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN(C(=O)c2ccc(F)cc2)C1)c1n[nH]c(=O)c2ccccc12	21038596	QCSVHHPEWGGXME-AWEZNQCLSA-N	437.431	1.376	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)cc2c1O[C@H](C)C2	24291014	WUQPUUUMEGBGIC-LLVKDONJSA-N	432.502	1.695	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)/C=C/c1ccccc1)C(=O)NNC(=O)c1cccn1C	115208472	BIYOUSNWRIOYBC-WSYSLRRZSA-N	436.559	1.498	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)c1ccc(-n2cncn2)c([N+](=O)[O-])c1	726862392	MIBPWDXLEOBOFP-UHFFFAOYSA-N	443.445	1.373	50	20	IDGD	
Cc1cc(C(=O)NC2CCN(C(=O)NNC(=O)CNC(=O)c3cccs3)CC2)c(C)o1	727479348	JBFUUZVWHQHTAS-UHFFFAOYSA-N	447.517	1.323	50	20	IDGD	
CN(C)N(C(=O)COc1ccc(Br)cc1Cl)[C@@H]1CCS(=O)(=O)C1	728178204	DYQUUTYZFYRUIP-LLVKDONJSA-N	425.732	1.974	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNC(=O)[C@@H]2CC(=O)N(CCN3CCOCC3)C2)cc1	729300592	SVFOZNWQDRFNJO-LJQANCHMSA-N	446.548	1.053	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)Cc2cc[nH]n2)cc(S(=O)(=O)N2CCC(C)CC2)c1C	730102404	AWGWLEGNFZXYMZ-UHFFFAOYSA-N	433.534	1.451	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)c1ccc(N2CCOCC2)c(F)c1	730274042	AFOIBWXPTIMMGU-UHFFFAOYSA-N	425.420	1.628	50	20	IDGD	
CN1CCN([C@@H](CNC(=O)NNC(=O)COc2ccccc2O)c2cccs2)CC1	730905254	QKTJDWNDFQFOOJ-HNNXBMFYSA-N	433.534	1.152	50	20	IDGD	
Cc1c(C(=O)OCC(=O)NNC(=O)c2ccccc2)nnn1-c1ccc(OC(F)F)cc1	731266840	XKFVTGMIMYKBAF-UHFFFAOYSA-N	445.382	1.795	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)NC2CCN(CC(=O)N(C)C)CC2)c1	731761861	KOAMKLKOYKVFAE-UHFFFAOYSA-N	433.553	1.380	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2c[nH]nc2C)cc1S(=O)(=O)N1C[C@H](C)C[C@@H](C)C1	731852165	HHSUTXKCKDFVNA-CHWSQXEVSA-N	449.533	1.468	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2C(=O)[C@H]3CCCC[C@@H]3C2=O)cc1Br	732037119	HKVSXLFBHKGTEO-RYUDHWBXSA-N	438.278	1.394	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)N1CCC[C@H](NS(=O)(=O)c2cccc(F)c2)C1	732201400	ZELYVLZTVQMABG-ZBFHGGJFSA-N	428.530	1.150	50	20	IDGD	
CCc1cccc(C)c1NC(=S)NNC(=O)CN(C)C1=NS(=O)(=O)c2ccccc21	732282911	ONTZWLSENUJGKI-UHFFFAOYSA-N	445.570	1.956	50	20	IDGD	
O=C(NNS(=O)(=O)c1cccc(C(=O)NC2CC2)c1)c1cnn(-c2ccccc2)c1	733122834	CCLCQEWBHCXCTG-UHFFFAOYSA-N	425.470	1.388	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)/C(=C/c2cccnc2)NC(=O)c2ccccc2)cc1	733124073	QNYQFSCMALUNHM-BKUYFWCQSA-N	441.447	1.951	50	20	IDGD	
CCc1ccc(N2C[C@H](C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)CC2=O)cc1	734241381	CSQONRSUOPKLIF-OAHLLOKOSA-N	433.509	1.457	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2ccc3c(c2)CCCC3)CC1	735116871	JDHJMARNSMHZDC-UHFFFAOYSA-N	429.546	1.653	50	20	IDGD	
CC(C)c1nc(C(=O)NNC(=O)CNC(=O)c2cccs2)nn1-c1cccc(F)c1	735437221	JJZHKAOIVPDOBH-UHFFFAOYSA-N	430.465	1.782	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)N[C@H]1CCN(c2cnn(C)c2)C1=O	735584525	WGFOFTBCHOEXFJ-KUHUBIRLSA-N	436.472	1.477	50	20	IDGD	
CC1(C)[C@H]2OCC[C@@H]2[C@H]1NC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	741427098	WIOYIPUBIPHRMN-ZACQAIPSSA-N	436.534	1.229	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNS(=O)(=O)c1c(F)cc(NC(C)=O)c(Cl)c1F	741655803	FXUGZNWKFYSULY-UHFFFAOYSA-N	440.856	1.191	50	20	IDGD	
Cc1cc(N2CCCS2(=O)=O)ccc1C(=O)NNC(=O)[C@@H](C)Oc1ccc(F)cc1	741661181	BVYXVMQQLZURAY-CQSZACIVSA-N	435.477	1.903	50	20	IDGD	
CN(CCCC(=O)NNC(=O)CNc1ccccc1)C1=NS(=O)(=O)c2ccccc21	743293083	KOYFVYZOTQCFFF-UHFFFAOYSA-N	429.502	1.107	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)[C@H]2C[C@@]23CCc2ccccc23)CC1	743420071	UNRQPGWYTFTCDK-XMSQKQJNSA-N	441.557	1.365	50	20	IDGD	
O=C(CN1CCCS1(=O)=O)NNC(=O)Nc1ccc(Br)cc1Cl	743831508	QMIYUUYFCHAEAC-UHFFFAOYSA-N	425.692	1.291	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)Nc2ccnn2[C@H]2CCS(=O)(=O)C2)c1C	744378182	JWQIGIUMNXODQR-RLGUWMIQSA-N	431.518	1.853	50	20	IDGD	
CC(=O)c1cccc(O[C@H](C)C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)c1	744619224	KOKIOODMOKDCDD-MRXNPFEDSA-N	447.513	1.821	50	20	IDGD	
CCCc1ccc(N2C[C@@H](C(=O)OCC(=O)NNC(=O)c3cccc(C#N)c3)CC2=O)cc1	744682606	MMWHLJSTXHNZGK-IBGZPJMESA-N	448.479	1.868	50	20	IDGD	
O=C(COC(=O)[C@@H](c1cccc(F)c1)N1CCOCC1)NNC(=O)c1ccc(Cl)cc1	745419583	CIHWLHQUOJMLHD-LJQANCHMSA-N	449.866	1.857	50	20	IDGD	
O=C(NCCN/C(O)=C1/N=CC=CC1=O)NNc1c(F)cc(F)cc1Br	745813561	OWKGEFBXBFQTAP-YPKPFQOOSA-N	430.209	1.880	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)c1ccc(F)cc1Br)CN1CCN(C)CC1	745863244	URRGEJTULQNZEX-GFCCVEGCSA-N	430.322	1.416	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NNC(=O)Cc2cn3ccccc3n2)s1	746549513	QSHCXAGVCBNPHG-HNNXBMFYSA-N	447.542	1.247	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)C[C@H]1C(=O)Nc2ccccc21	746618706	YLFDBTDGMQAKOH-CYBMUJFWSA-N	431.832	1.779	50	20	IDGD	
COc1ccc(C(=O)OCC(=O)NNC(=O)c2cccc(C)c2)cc1N1CCNC1=O	747715913	IRECPYDJGPVMFY-UHFFFAOYSA-N	426.429	1.151	50	20	IDGD	
O=C1CN(S(=O)(=O)c2cccc(C(=O)NNc3ccc(Cl)cc3Cl)c2)CCN1	748009686	RIXDQJNNMRIVOH-UHFFFAOYSA-N	443.312	1.871	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc(Br)ccc1F)[C@@H]1COc2ccccc2O1	748689021	FTLSBRIRZPPAPR-ZDUSSCGKSA-N	431.239	1.738	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)NNC(=O)c1cc2ccccc2o1	750265288	BLYFBRJURHVAOQ-UHFFFAOYSA-N	430.446	1.015	50	20	IDGD	
Cc1ccc(-c2nnc(S)n2CC(=O)NNC(=O)CCN2C[C@H](C)O[C@@H](C)C2)cc1	751426889	WRYYSRGWRGLNFX-GJZGRUSLSA-N	432.550	1.189	50	20	IDGD	
O=C(NNC(=O)c1ncoc1-c1cccc(C(F)(F)F)c1)N[C@H]1CCS(=O)(=O)C1	751461074	PMORWQCZMOYQSF-NSHDSACASA-N	432.380	1.492	50	20	IDGD	
COc1cc(OC)cc(N2C[C@@H](C(=O)NNC(=O)[C@@H]3COc4ccccc4O3)CC2=O)c1	752269325	VIMSDZNECZATOI-DJJJIMSYSA-N	441.440	1.044	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)NC[C@H]2CCC[C@]23NC(=O)N(C)C3=O)c1C	753024828	QYZBNVFICDCISC-PZPWOCDFSA-N	431.493	1.122	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NC[C@@H]2CCCCS2(=O)=O)c2ccccc2c1=O	753265732	WQNKUWFXXXQKHJ-AWEZNQCLSA-N	449.533	1.108	50	20	IDGD	
CON(C)S(=O)(=O)c1ccc(NC(=O)NNC(=O)c2cccc3ncccc23)cc1	755532848	GDKSHAMHQLWTPW-UHFFFAOYSA-N	429.458	1.883	50	20	IDGD	
CCn1nc(C)c(C=NNC(=O)CN2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)c1C	755790603	PKPYLEIUORQZEX-UHFFFAOYSA-N	446.577	1.285	50	20	IDGD	
COC(=O)c1cc(NC(=O)NNC(=O)c2cncc(NC(C)=O)c2)cc(C(=O)OC)c1	756035094	ZHTQVGYNUIQQNB-UHFFFAOYSA-N	429.389	1.080	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)Nc2ccc(C)cc2OCC(=O)N(C)C)cc1	756204168	ULPALKJJAKBMJC-UHFFFAOYSA-N	430.461	1.702	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)Nc1ccc(S(=O)(=O)N(C)C2CC2)cc1	756404275	UAPFKOXOXRWAAZ-UHFFFAOYSA-N	442.501	1.892	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)Nc1ccn(CCc2ccncc2)n1	756729523	COCLMEHUZMVYIE-UHFFFAOYSA-N	435.492	1.380	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)Nc2ccc(S(=O)(=O)NCC3CC3)cc2)cc1	756785968	VXJQTFTUDCGJSZ-UHFFFAOYSA-N	448.501	1.615	50	20	IDGD	
CCC(CC)(CC)CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	759603442	XENQLUFTZIIVHR-UHFFFAOYSA-N	440.566	1.868	50	20	IDGD	
COc1ccc(S(N)(=O)=O)cc1NC(=O)COC(=O)/C(C#N)=C/c1ccc(O)cc1	759900066	USZYGTIYFBMADQ-MDWZMJQESA-N	431.426	1.137	50	20	IDGD	
CC(C)(C)C(=O)NNC(=O)C(=O)Nc1cc(Br)ccc1N1CCOCC1	761063361	HGOHSUQYQNEAHV-UHFFFAOYSA-N	427.299	1.418	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H]1[C@@H]1COCCC1=NNC(=O)Cc1cc(O)nc(O)n1	762422866	MUVWNWJMTUCSCP-UKRRQHHQSA-N	435.481	1.339	50	20	IDGD	
CN1CC[C@H](CNC(=O)NNC(=O)C(=O)N2CCCC2)[C@H]1c1ccc(Cl)c(F)c1	763090262	BCSQQZRRESIGGW-CZUORRHYSA-N	425.892	1.425	50	20	IDGD	
CN(C)C(=O)C[C@@H]1CN(C(=O)C(=O)NNC(=O)c2ccccc2)c2ccc(Cl)cc21	763424674	CXKSNONXAJTFRB-CQSZACIVSA-N	428.876	1.710	50	20	IDGD	
CN(C)C(=O)Cn1cc(NC(=O)C(=O)NNC(=O)c2sc3ccccc3c2Cl)cn1	763578181	MPXFWAFGJUPYIP-UHFFFAOYSA-N	448.892	1.239	50	20	IDGD	
CON(C)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2cc(C)cc(C)c2)cc1	763648318	CDYWVGLXMCVDFQ-UHFFFAOYSA-N	428.445	1.102	50	20	IDGD	
COC(=O)Nc1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)ccc1F	763806873	GOJRFCHXVIWYIT-UHFFFAOYSA-N	429.364	1.041	50	20	IDGD	
Cc1nc(Br)ccc1NC(=O)C(=O)NNC(=O)COc1ccc(F)cc1	763838105	NMKMXFCCJKZETA-UHFFFAOYSA-N	425.214	1.457	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccnn2Cc2ccccn2)c1C	763840227	JMUHZVOALRTILL-MRXNPFEDSA-N	436.472	1.497	50	20	IDGD	
COCC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)cc1	763848412	HGUHAPTUFLRHJH-HNNXBMFYSA-N	442.472	1.442	50	20	IDGD	
COC(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(C(C)=O)cc2)c1	763870700	BRYKLVZWLCDCFM-AWEZNQCLSA-N	441.440	1.158	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cccc(-n3ccnn3)c2)cc1	763879061	WEWFBLFMYOJXOU-AWEZNQCLSA-N	436.428	1.023	50	20	IDGD	
C#CCOc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(OC(C)C)c(OC)c2)c1	763916704	SPLGCTNDNHTTSF-UHFFFAOYSA-N	425.441	1.894	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3ccc(CS(C)(=O)=O)cc3)cc2C1	763940364	GWQQBRBXSVYUGP-LBPRGKRZSA-N	449.554	1.817	50	20	IDGD	
CC(=O)N(C)c1cccc(NC(=O)C(=O)NNC(=O)c2ccc(Br)s2)c1	763942115	ULSQOULEFCKBKF-UHFFFAOYSA-N	439.291	1.893	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ccc(COc3ccccc3)o2)cn1C	763950081	JHDDEPSBLSFSMK-UHFFFAOYSA-N	440.412	1.383	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)c2cccnc12	763995171	NQHYSPKYBNWRKR-UHFFFAOYSA-N	432.234	1.734	50	20	IDGD	
O=C(Cc1ccsc1)NNC(=O)C(=O)Nc1ccc2nc(N3CCOCC3)oc2c1	764035404	XXLJBDLKESOVRK-UHFFFAOYSA-N	429.458	1.055	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)NCCc3ccccc3)cc2)n[nH]1	764109307	RTBSASMPBJLVFM-UHFFFAOYSA-N	434.456	1.090	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cccnc3-n3cccn3)n[nH]2)cc1	764109831	CHOHEQBNAFIGFA-UHFFFAOYSA-N	430.428	1.366	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1cnn(Cc2ccc(Cl)cc2)c1	764130862	AUAMZWRVNKOJAC-UHFFFAOYSA-N	441.875	1.922	50	20	IDGD	
COC(=O)c1c(C2CC2)csc1NC(=O)C(=O)NNC(=O)[C@H]1Cc2ccccc2O1	764155293	XMZFXDQWHMVUOQ-CQSZACIVSA-N	429.454	1.502	50	20	IDGD	
Cc1cc(S(N)(=O)=O)cc(NC(=O)C(=O)NNC(=O)CCCc2ccccc2)c1C	764223729	KDKJIYIXGHTEHH-UHFFFAOYSA-N	432.502	1.060	50	20	IDGD	
COC(=O)C(C)(C)c1ccc(NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)cc1	764242315	DGGXGQVNXNUOOZ-UHFFFAOYSA-N	436.468	1.878	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cccc3ncccc23)cc1N1CCOC1=O	764260937	TZKUSJFLVHASEM-UHFFFAOYSA-N	433.424	1.900	50	20	IDGD	
CC(C)(C)c1cc(NC(=O)C(=O)NNC(=O)Cc2cc[nH]n2)n(-c2ccc(F)cc2)n1	764294382	XYDPNIAFNAGUEG-UHFFFAOYSA-N	427.440	1.361	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1cc(CN(C)C)ccc1C	764392900	MROFJOGTYDBQSN-UHFFFAOYSA-N	430.530	1.943	50	20	IDGD	
CC(=NNC(=O)c1cc(C)[nH]n1)c1ccc(S(=O)(=O)N2CCC(C(=O)O)CC2)cc1	764789367	HNDYDHDSBBKLCZ-UHFFFAOYSA-N	433.490	1.357	50	20	IDGD	
O=C(CNC(=O)NCc1ccc([N+](=O)[O-])cc1)NNC(=O)CSc1ccccc1O	765248480	SLVRYBIDDVGWPT-UHFFFAOYSA-N	433.446	1.039	50	20	IDGD	
Cc1cc(=O)n(CC(=O)NC(C)C)c(C)c1C(=O)NNC(=O)CSc1ccccc1O	765248863	WGKSQLIFGHUYGE-UHFFFAOYSA-N	446.529	1.249	50	20	IDGD	
COC(=O)NNC(=O)C(=O)Nc1ccccc1CN1CCc2cc(OC)c(OC)cc2C1	765364936	IHNPAWHUOFYIGM-UHFFFAOYSA-N	442.472	1.588	50	20	IDGD	
O=C(COC/C=C/c1ccccc1)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765733633	ODOJWLKGUPGFHO-JXMROGBWSA-N	436.512	1.322	50	20	IDGD	
NC(=S)c1ccc(C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)cc1	765757555	WJQWGCGQBVZXQT-UHFFFAOYSA-N	445.976	1.553	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNc2cnccn2)cc1S(=O)(=O)N1CCCCC1	766259880	FRIPRMAANAOZLN-UHFFFAOYSA-N	448.505	1.132	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(=O)n(CC(=O)NNc2ncnc3ccsc23)c1	766678462	FAAFCKKRRRYHEE-UHFFFAOYSA-N	436.519	1.027	50	20	IDGD	
COc1ccc(-c2ncc(C(=O)NNc3nc(O)c4cnn(C)c4n3)s2)cc1OC	767928232	YSCQNSTULHSDSV-UHFFFAOYSA-N	427.446	1.967	50	20	IDGD	
COc1cc2c(cc1OC)CN(C(=O)CCC(=O)NNc1ncnc3[nH]cnc13)CC2	768137247	NNFCGPTVYGNDCG-UHFFFAOYSA-N	425.449	1.178	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)c1nnn(Cc2ccc(F)cc2)c1C	768208815	XXQCAPWXXSFEGL-UHFFFAOYSA-N	433.465	1.943	50	20	IDGD	
CN(C)C(=O)c1cc(F)ccc1NC(=O)C(=O)NNC(=O)C12CC3CC(CC(C3)C1)C2	768237429	KOVIVAMVAJDYII-UHFFFAOYSA-N	430.480	1.830	50	20	IDGD	
O=C(CCC(=O)N1CCN(c2ncccn2)CC1)NNc1ccc(OC(F)(F)F)cc1	768239916	ZLMUMJAMQKCWFP-UHFFFAOYSA-N	438.410	1.947	50	20	IDGD	
CCOc1ccc(NS(=O)(=O)c2cc(C(=O)NNC(=O)C(C)(C)O)ccc2C)cc1	768243971	ISTHWVZXAYBIHA-UHFFFAOYSA-N	435.502	1.726	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)[C@@H]3Cc4cc(F)ccc4O3)n[nH]2)cc1OC	768275440	BVWDMGZVGSQHEZ-IBGZPJMESA-N	426.404	1.998	50	20	IDGD	
CCOc1cccc(-c2nnc(SCC(=O)NNC(=O)c3cccc(C#N)c3)n2N)c1	768433035	HNERBSDLARWQCH-UHFFFAOYSA-N	437.485	1.483	50	20	IDGD	
CCNc1nc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)cs1	768918858	PPYYGDAIEQFPSY-UHFFFAOYSA-N	437.547	1.824	50	20	IDGD	
CC(C)(C)OC(=O)N1Cc2ccc(C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)cc2C1	769536533	FOIVOFKKTCEAJE-UHFFFAOYSA-N	449.471	1.988	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)c2cccc([S@@](C)=O)c2)cc1	770210163	UQDSCXAQYCFDDU-GDLZYMKVSA-N	429.527	1.920	50	20	IDGD	
C[S@@](=O)c1cccc(C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)c1	770245914	NGXWFNRTSOZGES-SSEXGKCCSA-N	448.976	1.656	50	20	IDGD	
Cc1nn(C)c(C)c1S(=O)(=O)N[C@H](C)C(=O)NNc1ccnc(Br)c1	771554004	UYVRKDGNAGOGHM-SECBINFHSA-N	431.316	1.005	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)CCn1cnc2ccc(Br)cc2c1=O	771967281	FWWYNUMIKLKROU-JTQLQIEISA-N	439.266	1.038	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)[C@@H]1CCCN(C(=O)N2CCc3sccc3C2)C1	772159330	PJVHBLZULSUEFB-DZGCQCFKSA-N	436.534	1.427	50	20	IDGD	
CCC(=O)N1CC[C@H](C(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)C1	773049922	LAFMWGNVAVKTCG-KRWDZBQOSA-N	447.495	1.464	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)[C@@H]2CC[C@@H](C(F)(F)F)NC2=O)C1	773410879	FSZMAKNYRXPTNS-TUAOUCFPSA-N	436.431	1.238	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)N[C@H](CS(C)(=O)=O)c2ccccc2)nc2ccccc21	774285544	WONABGZCUCJWQY-MRXNPFEDSA-N	429.502	1.232	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)Nc2ccnn2[C@@H]2CCS(=O)(=O)C2)c1C	776059711	QYDAYALYGKAOSR-LSDHHAIUSA-N	435.506	1.480	50	20	IDGD	
COc1cccc(CO[C@@H](C)C(=O)N2CCN(S(=O)(=O)CBr)CC2)c1	777779485	MTVDQPYUIGEAGZ-ZDUSSCGKSA-N	435.340	1.427	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCc2ccc(Cl)cc2F)cc1	779662061	YQSQWXFXNHFGAQ-UHFFFAOYSA-N	442.900	1.939	50	20	IDGD	
CCNC(=O)N(C)NC(=O)c1ccccc1NS(=O)(=O)c1ccc2c(c1)OCCO2	780711648	QTNLLCVMMCKWJG-UHFFFAOYSA-N	434.474	1.565	50	20	IDGD	
Cc1nnc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)s1	780903912	VLXPDSMRLNDLBX-UHFFFAOYSA-N	438.535	1.165	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)OCn2nnc3c(cnn3-c3ccccc3)c2=O)cc(C#N)n1C	781228924	DWZCBKIWSQZOQK-PXNMLYILSA-N	440.423	1.604	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N[C@H](C)c2ncn(C)n2)cc1	781392469	MMTONQSANGBJSP-KWZJRMENSA-N	448.487	1.347	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N[C@@H](CO)C1CCOCC1	782494576	WBJDOWLSQAMFSB-ABAIWWIYSA-N	430.299	1.334	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)Nc2ccccc2C)cc1	783417221	NZIDACXKTDSJAN-UHFFFAOYSA-N	447.517	1.817	50	20	IDGD	
Cc1ccc(NC(=O)OC(C)(C)C)cc1NC(=O)C(=O)NNC(=O)C(=O)N1CCCC1	784000029	RSQZSORDFDNETP-UHFFFAOYSA-N	433.465	1.050	50	20	IDGD	
CC(C)c1ccc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1[N+](=O)[O-]	784258486	ZRUBWXLONDVLEL-SFHVURJKSA-N	443.412	1.862	50	20	IDGD	
O=C(NNc1nc(Br)cn2ccnc12)[C@H]1CC=CC[C@H]1C(=O)N1CCOCC1	784782777	DHYYCOFALLYGCP-QWHCGFSZSA-N	449.309	1.376	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)cnn1-c1ccccc1F	785061611	YPIICAKAFUEVRX-UHFFFAOYSA-N	435.419	1.296	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)n(-c2ccccc2F)n1	785061617	YWMPDVCXEYKQDB-UHFFFAOYSA-N	435.419	1.296	50	20	IDGD	
Cc1cn2cc(NC(=O)C(=O)NNc3c(F)cc(C(=O)NC4CC4)cc3F)ccc2n1	785100741	YOKFWVDTTBAGPH-UHFFFAOYSA-N	428.399	1.895	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2ccc(C)c(C(=O)NC(C)C)c2)n1	785227895	ZKQORUMIMVJPQT-UHFFFAOYSA-N	427.509	1.851	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)N1CCC[C@H](N2CCCS2(=O)=O)C1	789842016	SQWZBFWMCXKCAM-ZFWWWQNUSA-N	444.941	1.348	50	20	IDGD	
COc1ccc(C)cc1[C@@]1(C)NC(=O)N(CC(=O)NNc2cccc(F)c2[N+](=O)[O-])C1=O	790585958	LPLQAEJXEFYTLL-HXUWFJFHSA-N	445.407	1.961	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCC(NC(=O)NNc3ncccc3C)CC2)cc1OC	791023675	CVIOOQJUPHMVNS-UHFFFAOYSA-N	449.533	1.887	50	20	IDGD	
NC(=O)[C@@H](NC(=O)NNC(=O)COCc1ccccc1)c1cccc(Br)c1	792954081	CYEQNFBNBJXFOL-INIZCTEOSA-N	435.278	1.523	50	20	IDGD	
C[C@H](CS(=O)(=O)c1ccc(F)cc1)C(=O)NNc1ccccc1S(=O)(=O)N(C)C	795176877	GRGVOHFVNGIZRR-CYBMUJFWSA-N	443.522	1.629	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)Nc2cc(S(=O)(=O)N3CCCC3)ccn2)c1	797675492	YKXHGTWXLNBTBB-UHFFFAOYSA-N	433.490	1.406	50	20	IDGD	
Cc1nn(C)c(Br)c1C(=O)OCC(=O)NNC(=O)c1ccc(Cl)cc1	801503539	UQSRWQUQMAOPKD-UHFFFAOYSA-N	429.658	1.762	50	20	IDGD	
CC(C)Cn1c(=O)nc(O)c2c(C(=O)NNC(=O)N=c3cc[nH]cc3)cc(C(C)C)nc21	802035414	GWKHBEMWAJXSKU-UHFFFAOYSA-N	439.476	1.560	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCCC(=O)NNc1ccc2c(=O)[nH]ccc2c1	803439368	CGZOFKBVPPAZRT-QGZVFWFLSA-N	443.504	1.877	50	20	IDGD	
CS(=O)(=O)NC1CC(NC(=O)NNc2ccc(-c3cccc(C(F)(F)F)c3)nn2)C1	805459379	DBAWASQDMKDBRB-UHFFFAOYSA-N	444.439	1.869	50	20	IDGD	
CN(C)S(=O)(=O)C[C@H](NC(=O)NNC(=O)Cc1ccc2ccccc2c1)C(F)(F)F	805769096	JTXWIOUPZJXKIF-HNNXBMFYSA-N	446.451	1.535	50	20	IDGD	
CN1CCC/C1=N/S(=O)(=O)c1cccc(NC(=O)C(=O)NNc2cccc(F)n2)c1	807390456	CQNDZBRVBJQXST-JLPGSUDCSA-N	434.453	1.115	50	20	IDGD	
COC(=O)c1ccc(OC(C)C)c(NC(=O)C(=O)NNc2ccc(-n3ccnc3)nn2)c1	807429891	YRNJOYSPFDWLMV-UHFFFAOYSA-N	439.432	1.318	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)ccc1O)C(=O)Nc1cccc2c1COC2=O	808935264	PAHAFAQLVDCXEQ-UHFFFAOYSA-N	434.202	1.225	50	20	IDGD	
COc1ccc(S(=O)(=O)NCC(=O)NNc2ccc(-c3ccccc3)nn2)cc1OC	810493790	HXSMUQQVBDFCLB-UHFFFAOYSA-N	443.485	1.582	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)CNS(=O)(=O)c2ccc3ccccc3c2)nc1C	810932386	NETYECIEFLXZJZ-UHFFFAOYSA-N	443.485	1.537	50	20	IDGD	
COC[C@]1(CNC(=O)NNC(=O)c2ccc(OC)c(OC)c2)OCCc2ccccc21	811853559	DTHKPNZIHAXJNO-QFIPXVFZSA-N	429.473	1.762	50	20	IDGD	
Cc1nc(O)c(C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)cc1Br	812729191	GCHFVSUWXPLTJR-UHFFFAOYSA-N	429.296	1.865	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cc(F)ccc2Br)cn2ccnc12	815569096	HNYXBDKJPDIADH-UHFFFAOYSA-N	434.225	1.944	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)c1ccc(=O)n(-c2ccc(F)cc2)n1	914857614	KJVMWWWDDXRMGL-UHFFFAOYSA-N	434.387	1.338	50	20	IDGD	
CC(C)CNS(=O)(=O)c1ccc(C(=O)OCC(=O)NNC(=O)c2cccs2)cc1	914976673	SXXNWJSHJXZMIC-UHFFFAOYSA-N	439.515	1.300	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)NC[C@@H](c1cccs1)N1CCOCC1	915894240	XKCPXYMGZHYBCV-HNNXBMFYSA-N	434.518	1.539	50	20	IDGD	
CCn1c(CNC(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)nc2ccccc21	915928109	FLKKREAMSFSGII-UHFFFAOYSA-N	431.522	1.964	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NCc2ccc(C(=O)N3CCOCC3)cc2)cc1	916247835	IJQXWLQEDJXGLD-UHFFFAOYSA-N	426.473	1.377	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(C(C)=NNC(=O)c2ccc(-n3cnnn3)cc2)cc1	916350287	WKBKDNRVNYKYQA-UHFFFAOYSA-N	441.517	1.847	50	20	IDGD	
CNS(=O)(=O)c1cccc(CNC(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)c1	916485610	CPWOGOQFQIAIEM-HNNXBMFYSA-N	434.518	1.509	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)NCC1CCCC1	916622476	UCARHLMMDGAVST-UHFFFAOYSA-N	438.550	1.161	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)c1c[nH]c(C(=O)N2CCCC2)c1	916724456	XFYPSEPXXAYSRZ-UHFFFAOYSA-N	435.278	1.853	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)c3cccc(S(=O)(=O)NC4CC4)c3)n[nH]2)cc1	917178036	FWIOJGPEICENIT-UHFFFAOYSA-N	439.497	1.901	50	20	IDGD	
CCCC(=O)N1CCC[C@@H]1C(=O)NNC(=O)c1cccc(S(=O)(=O)N(CC)CC)c1	917901063	OCWXEQNWFVPTJP-QGZVFWFLSA-N	438.550	1.269	50	20	IDGD	
CNC(=O)COc1cccc(CNC(=O)NNC(=O)c2cc(-c3ccc(C)cc3)[nH]n2)c1	918098008	QDCPOEWKXFPSSR-UHFFFAOYSA-N	436.472	1.654	50	20	IDGD	
Cc1ccc([C@@H](CNC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)N2CCOCC2)cc1	918099131	LDUSYPHNISBYPQ-LJQANCHMSA-N	427.461	1.921	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)N[C@H](c1ccc(F)cc1)[C@H]1CCCO1	918126037	FBCXQVYXDJCCNY-QZTJIDSGSA-N	425.424	1.666	50	20	IDGD	
O=C(CCNS(=O)(=O)c1cccc(Cl)c1)NNC(=O)c1ccc(Cl)cc1O	918358278	NVHWOGJICYQAOU-UHFFFAOYSA-N	432.285	1.829	50	20	IDGD	
O=C(NNc1ccccc1[N+](=O)[O-])c1ccc2c(c1)S(=O)(=O)N(C[C@@H]1CCCO1)C2=O	918549196	GRONFXUUEWSMME-ZDUSSCGKSA-N	446.441	1.675	50	20	IDGD	
CCOc1ccc(/C=C(\C#N)C(=O)NCc2ccc(C(=O)N3CCNC(=O)C3)cc2)cc1	918608694	JXXLORUSAGUSGR-DEDYPNTBSA-N	432.480	1.881	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)c3c[nH]nc3C)c2)cc1	920400799	SCYPKULWILDJHV-UHFFFAOYSA-N	429.458	1.602	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)c1cc(F)ccc1NS(C)(=O)=O	920407487	CDRLCIFMHSFWGU-UHFFFAOYSA-N	425.438	1.436	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3n[nH]cc3Br)CC2)cc1	1123639787	AVOALVNKBTUNHH-UHFFFAOYSA-N	435.326	1.059	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)N[C@H]2CCO[C@@]3(CCOC3)C2)c2ccccc2c1=O	1254071324	YZQQLNPOKFRBGL-QKKBWIMNSA-N	429.477	1.260	50	20	IDGD	
Nc1cnnc(NNC(=O)NCCNC(=O)c2ccc(Br)cc2)c1Cl	1319309827	LFJRXBQWPYNYKM-UHFFFAOYSA-N	428.678	1.531	50	20	IDGD	
Cn1cc([C@H](NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c2ccccc2)cn1	1320204882	HLCFLNUREBTCCT-GOSISDBHSA-N	427.486	1.557	50	20	IDGD	
O=C(NNC(=O)c1ncoc1[C@H]1CCCO1)c1cccc(S(=O)(=O)N2CCCCC2)c1	1328422270	XDOGPESOZWMMBZ-MRXNPFEDSA-N	448.501	1.776	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cn(C)c4ncccc34)C2)C1	1778770931	ZFQOMCKQRLHWEC-BFUOFWGJSA-N	435.322	1.800	50	20	IDGD	
C[C@@H](C(=O)N1CC[C@]2(CN(C(=O)C(Cl)Cl)CCO2)C1)N1CSCSC1	1779150139	UNQWRZDYNNNSCU-XHDPSFHLSA-N	428.407	1.663	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cn3cccnc3n1)C2	1779543769	AGGJUBFXCABTPR-DYESRHJHSA-N	445.596	1.708	50	20	IDGD	
CCc1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)CCBr)C3)n(C)n1	1779762863	PTEHSAVJDFGSDQ-VQIMIIECSA-N	441.370	1.895	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3c(-c4ccncn4)noc3C)C2)C1	1780049616	RRISOBHVRDIGLP-JLTOFOAXSA-N	433.896	1.901	50	20	IDGD	
O=C([C@@H](O)c1cccc(Br)c1)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Cl)CCO2	1780972815	XJVIWPUQLVHZOZ-GRDNDAEWSA-N	449.704	1.847	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(CCN(C(=O)[C@@H]3CC[C@@H]4CCC(=O)N4C3)C2)C1	1781055614	AIMILPTVJHPMHQ-CBGDNZLLSA-N	437.613	1.069	50	20	IDGD	
C[C@]1(C(=O)N2CC[C@]3(CN(C(=O)/C(C#N)=C/c4ccc(F)cc4F)CCO3)C2)CCCN1	1781143800	WYAOUVOKZXCXLU-ZXGKALCVSA-N	444.482	1.844	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)Cn3c(=O)n(C)c4ccccc43)CCO2)C1	1781219363	OQCOLUXTYSOJIA-QVKFZJNVSA-N	434.924	1.187	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)[C@H]3Cc4ccccc4CN3)CCO2)C1	1781229822	MJFFZSARQWGEQY-JRGCBEDISA-N	440.371	1.767	50	20	IDGD	
O=C([C@H](F)Br)N1CC[C@@]2(C1)CN(C(=O)[C@H]1COc3ccccc3O1)CCO2	1781326573	QHAOSCNGIBCBLA-RVKKMQEKSA-N	443.269	1.347	50	20	IDGD	
C=C(Oc1ccccc1O)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781331538	RHQSLWNMNNLVEV-YJBOKZPZSA-N	443.269	1.805	50	20	IDGD	
O=C(C1CCC2(CC1)OCCO2)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781332651	CRNDPEHRMSKFMM-PBHICJAKSA-N	449.317	1.440	50	20	IDGD	
O=C([C@H](F)Br)N1CCO[C@]2(CCN(C(=O)C3(Br)CC3)C2)C1	1781347410	UEDLGCNSLYIOPZ-JOYOIKCWSA-N	428.096	1.434	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1n[nH]c3c1CC[C@H]3C)C2	1782172862	OXCLEPTWLLOBEJ-GJDPQZJCSA-N	438.956	1.841	50	20	IDGD	
C[C@]1(C(=O)N2CCO[C@@]3(CCN(C(=O)/C(C#N)=C/c4ccc(F)cc4F)C3)C2)CCCN1	1782867932	VTRYTPXIXYUQKD-RRBHZOCGSA-N	444.482	1.844	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](C)n1cccc1C=O)CCO2	1783341080	BELHVBRHBWBGND-QOKNQOGYSA-N	440.338	1.865	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cncc(N(C)C)c3)CCO2)C1	1783343998	LZNXUTHYNMEIAW-LPHOPBHVSA-N	439.354	1.765	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cc3cccnc3s1)CCO2	1783934198	BXCQNIUEWZTSAR-OAQYLSRUSA-N	445.545	1.113	50	20	IDGD	
Cc1nccn1[C@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]2C1	1783975036	YKTSSMQYOXNANW-WLGNDBIMSA-N	441.370	1.763	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(=O)cco3)[C@H]2C1	1786284313	BMKSWKXLLZTKTN-PCBIJLKTSA-N	427.295	1.407	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21	1789871770	FJNXJDJTBZTJPA-MMROJZCPSA-N	434.133	1.893	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(F)nc3F)C[C@@H]21)[C@@H](F)Br	1789921109	SQTFMJSTVQDZQY-KYVBTAMFSA-N	436.228	1.644	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]3C2)cc(O)n1	1789922728	LSQNYKCNGPPWEG-NHULGOKLSA-N	430.274	1.379	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]2C1	1789923395	KZXBQQQXSDNEET-MOUCOTEISA-N	434.133	1.893	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnn(C)c3Cl)C[C@@H]21	1790960619	OKJFZQKXIVYSMF-DEQVHRJGSA-N	447.761	1.840	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc[n+]([O-])c3)C[C@@H]21	1790961091	JEWZVFGICGXTAV-JONQDZQNSA-N	426.311	1.087	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cc2ccccc2n1C	1792818583	ICLMCJLIPNTULP-VWFIUDSGSA-N	433.936	1.564	50	20	IDGD	
CS(=O)(=O)c1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](O)CCl)cc1F	1793117831	GVAFYQNIVZMTDQ-QVHKTLOISA-N	432.901	1.081	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCc1cncnc1	1796246178	CSTKQGGBHYKXKQ-MVUGMWCJSA-N	437.504	1.181	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cn2ccc(Cl)cc2n1	1797108255	PUUVEUHFRUBYSS-IFOZYUSPSA-N	441.315	1.445	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc2ncccc12)c1cccc(B(O)O)c1	1797317839	BAMKILYLGKWUKV-REPLKXPHSA-N	429.285	1.480	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@]1(F)CCCC=C1F)C2	1798442683	MYGMIQKTHQNTDU-RZNKXZLBSA-N	433.459	1.683	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnncc1C(=O)O	1798777506	WDZYHPPKCQKJFL-WISYIIOYSA-N	425.283	1.458	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc2ccnn12	1799904263	JARYTRMPUPPGPT-AODNKKSCSA-N	425.316	1.774	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2nn[nH]c2c1	1800139678	UCGRFWZSDWTDDT-VFFTVRQLSA-N	436.310	1.192	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](Br)CC)C2	1800233272	LXWAEQQRKQHEOQ-RKQHYHRCSA-N	435.315	1.311	50	20	IDGD	
C[C@@H]1CCc2c(C(=O)N3CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]3c3cccnc3)n[nH]c21	1803138426	ARHLHPGZNDSCPL-FYHWNKSOSA-N	431.924	1.774	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cc3cccnc3[nH]2)[C@H]1c1cccnc1)[C@@H](O)CCl	1803143099	TZZROOWEVFPYLS-SZMVWBNQSA-N	427.892	1.877	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)NC[C@@H]1CCN(C(=O)CN)[C@H]1c1cccnc1	1804239582	NVVUZWPHYVHUSS-ZOBUZTSGSA-N	439.944	1.178	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1CCN(C(=O)[C@@H]2CCC(=O)NC2)[C@@H]1c1cccnc1	1808290818	YLRCWXAVIADTCF-VZHLBOQGSA-N	441.359	1.850	50	20	IDGD	
Cc1ccoc1C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1808494415	OZEPQQWGRBIIFM-QUCCMNQESA-N	433.273	1.296	50	20	IDGD	
COCc1oncc1C(=O)NC[C@@H]1CCN(C(=O)[C@@H](Cl)COC)[C@@H]1c1cccnc1	1808824243	XHIWECGIZOOLNK-QILLFSRXSA-N	436.896	1.789	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)c1ccc2c(c1)OCCO2	1808989434	NXKKIVSKNAETEN-ABSDTBQOSA-N	445.903	1.772	50	20	IDGD	
CC[C@H](NC(C)=O)C(=O)N1CC[C@H](CNC(=O)[C@H](C)Br)[C@H]1c1cccnc1	1812864549	WBLWXELPJCVNQA-NKKGCODLSA-N	439.354	1.786	50	20	IDGD	
CC(=O)N/C(C)=C/C(=O)N1CC[C@H](CNC(=O)[C@@H](C)Br)[C@@H]1c1cccnc1	1812869058	QDYNLNLIRHYCAG-XMCVBQRBSA-N	437.338	1.911	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)Cc2c(C)nn(C)c2C)[C@H]1c1cccnc1	1813033118	IQFXJKBNVFDRKF-CUWPLCDZSA-N	447.967	1.934	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CCN2CCOC2=O)[C@@H]1c1cccnc1)C(Cl)Cl	1813079274	WXFMGWRCQCKCOT-DZGCQCFKSA-N	429.304	1.733	50	20	IDGD	
O=C(/C=C/c1ccccc1)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(B(O)O)cc1)CC2	1814027438	VQWBYFARWUWJRD-LGWVBRRBSA-N	447.325	1.762	50	20	IDGD	
Cc1cncc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)[nH]n2)c1	1816498595	REGPIDIGYDAOFM-SFHVURJKSA-N	448.487	1.731	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3nccc4nc[nH]c34)sc2C1	1816902205	RWWHOWDUJNTDGY-UWVGGRQHSA-N	434.909	1.894	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3nccc4nc[nH]c34)sc2C1	1816902209	RWWHOWDUJNTDGY-VHSXEESVSA-N	434.909	1.894	50	20	IDGD	
O=C(Cc1cscn1)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1817546245	QBVXGGSNYLVQCJ-KRWDZBQOSA-N	439.306	1.095	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)CS(=O)(=O)N2CCCC2)[nH]n1)[C@H](F)Cl	1818037157	GDSVIKHLMDFUDO-WFASDCNBSA-N	435.909	1.362	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)COC(=O)C(F)(F)F)n[nH]1	1819315885	BZJNIMJNIJVZPF-ONGXEEELSA-N	440.806	1.761	50	20	IDGD	
C[C@@H](CS(C)(=O)=O)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CO[Si](C)(C)C)n[nH]1	1819592002	SRDQRWAANSHQPF-ZFWWWQNUSA-N	444.630	1.934	50	20	IDGD	
C[C@H](C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](F)Br)n[nH]1)n1cncn1	1820936934	INZSMWQXIZZPPX-CDMKHQONSA-N	428.266	1.945	50	20	IDGD	
C[C@@]1(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)CC1(F)F	1823393696	KTFNNVFYBNRLIL-KXBFYZLASA-N	432.236	1.441	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC([C@@H]2CCCCN2C(=O)CN2C(=O)CNC2=O)CC1	1824899613	AGCUNMBCTFCXNT-INIZCTEOSA-N	438.601	1.009	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ncnn1C)CC2	1825444790	BVPTWBNHLKWRJK-IUCAKERBSA-N	427.328	1.671	50	20	IDGD	
Cn1cccc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1	1825761908	QJOUOEGDMSRDTP-IBGZPJMESA-N	438.532	1.571	50	20	IDGD	
Cc1nc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)co1	1825953752	LKJSSYFLHAACIW-HXUWFJFHSA-N	425.294	1.210	50	20	IDGD	
O=C([C@@H]1C[C@H]2CC[C@@H]1O2)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827053146	FMUVGAKPGRDIRX-CZYKHXBRSA-N	440.349	1.167	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830366253	MJGHEEWDCUCYDM-MLGOLLRUSA-N	425.751	1.491	50	20	IDGD	
Cc1cc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)no1	1830545782	MQXDLIDIWQRJHI-FZKQIMNGSA-N	444.326	1.013	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3nsnc3NC)C2)C1	1831638197	BWQCHEXQUGSUBU-SJCJKPOMSA-N	431.946	1.057	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@H](O)c2ccccc2)CC1	1831871121	LWRMKPIEGFOVPZ-NZQKXSOJSA-N	444.576	1.713	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)CO[Si](C)(C)C)CC1	1831873694	SVKZLETUOCHFOA-SFHVURJKSA-N	440.661	1.831	50	20	IDGD	
COc1ccc(CCC(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)cn1	1832580960	RPUZYJYBBRHCDR-IEBWSBKVSA-N	429.876	1.014	50	20	IDGD	
Cc1cccnc1CCC(=O)N1CCO[C@@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1	1832778418	JXRMNPKENHKUSD-QFIPXVFZSA-N	449.624	1.631	50	20	IDGD	
C[C@H](C(=O)N1CCOC[C@]2(CN(C(=O)CCBr)CCO2)C1)n1cccc1	1834826835	YDGIGTZXASTIFK-QAPCUYQASA-N	428.327	1.291	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCOc3ccccc3)CCO2)C1	1834833346	MURCYBAZSYEMQA-GHTZIAJQSA-N	440.924	1.166	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCC(N2CCC(NC(=O)Cn3ccnn3)CC2)CC1	1834897789	RLAHOLVIAVTESF-GOSISDBHSA-N	431.368	1.086	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)C(Cl)Cl)CC2)CC1)c1nc2ccccn2n1	1834969775	GYDUNUKKMCHDHD-UHFFFAOYSA-N	439.347	1.718	50	20	IDGD	
C[C@H](Nc1cccnc1)C(=O)N1CCC(N2CCC(NC(=O)[C@H](F)Cl)CC2)CC1	1835080300	OUMRGVXXAFZWEJ-KSSFIOAISA-N	425.936	1.988	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccn(C(F)F)n3)CCO2)C1	1838031136	ZJUIXRAXZPNRJZ-SFHVURJKSA-N	434.871	1.613	50	20	IDGD	
O=C(c1cc(C(F)(F)F)ccn1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1838084568	HMZMZCLFBBFGKT-BBRMVZONSA-N	439.793	1.705	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)Cc3cnn(C)c3)CC2)CC1	1838787571	YZDYGJSJMQZDPG-SFHVURJKSA-N	426.945	1.215	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(F)c3F)CCO2)C1	1839000097	STNWISUVUODVFM-AUUYWEPGSA-N	432.851	1.289	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(OC)c(F)c3)C2)C1	1839141454	JCGKXTOXWNFXTO-FOIQADDNSA-N	428.888	1.922	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ncccc3F)C2)C1	1839153948	WHPIYFPIKFDHJW-ROUUACIJSA-N	434.295	1.527	50	20	IDGD	
O=C(c1cc(O)ccc1F)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839202239	YDWUKRWUJLGVLT-RHSMWYFYSA-N	449.248	1.292	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1[C@H]3C=CS[C@H]31)CCO2	1839700280	KSCOLGAXRAQONM-VTWRMFPLSA-N	445.379	1.491	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3(COC)CC3)C2)C1	1839962663	NBPUDRHROJOLIX-KSSFIOAISA-N	433.343	1.043	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(C)c(Cl)c3)C2)C1	1840149652	WNIQEJWGCNMCFY-PXNSSMCTSA-N	445.343	1.972	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(F)c(F)c3)C2)C1	1840154309	RWMDDWXCKVGGGZ-AUUYWEPGSA-N	432.851	1.289	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(O)c(C)c3)C2)C1	1840154986	MAAVFHUFSWYYJG-UZLBHIALSA-N	426.897	1.024	50	20	IDGD	
CCCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1	1841349985	ASRLEARUYLZHNN-GJZGRUSLSA-N	431.961	1.873	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H](C(=O)N2CC3(CCCN3C(=O)[C@H](O)CCl)C2)C[C@H]2C[C@H]21	1841354839	ZNABXKCAYSTELK-APIJFGDWSA-N	427.929	1.187	50	20	IDGD	
O=C(c1ccc2sccc2c1O)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843014904	OFJZGTQWELPYBK-UHFFFAOYSA-N	436.298	1.418	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1	1843441896	UMIAEHPRLRYMEK-UHFFFAOYSA-N	428.565	1.834	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC2(CCCN2C(=O)[C@H]2ON=C(c3ccccc3)O2)C1	1844195458	PFUBQLQNIKLTTJ-SCLBCKFNSA-N	436.306	1.956	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)C2(c3ccc(F)c(F)c3)CC2)C1	1845017479	PRTOEELIMZQQDN-UHFFFAOYSA-N	434.487	1.573	50	20	IDGD	
CO/C=C(\C)C(=O)N1CC2(CCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)C1	1845039061	YUANBRAYFZUKMG-SAPNQHFASA-N	429.521	1.086	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)N1CC2(CCCN2C(=O)/C(C#N)=C/c2ccc(F)cc2F)C1	1845871159	VNQWYEZHPNNGOJ-AAKUMTKESA-N	431.443	1.522	50	20	IDGD	
COc1cccc2[nH]cc(C(=O)N3CC4(CCCN4C(=O)CCC(=O)NN(C)C)C3)c12	1846385648	DLQWNAGUZCECSS-UHFFFAOYSA-N	427.505	1.367	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC2(CCCN2C(=O)[C@H]2CCNC(=O)C2)C1	1846424560	PUKNRLKDLKHRMM-MDNIKOHYSA-N	428.439	1.601	50	20	IDGD	
O=C(c1cnc2ccc(Br)cn12)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl	1847563691	OUUAWGFBFCKUHF-OBJOEFQTSA-N	441.713	1.512	50	20	IDGD	
C[C@H](CC(N)=O)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](Br)Cc1ccccc1	1847859262	YAZQSMMDXIPBGF-IWCQGFGOSA-N	436.350	1.706	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2Cl)c1	16593896	PSXJOLKFLIATSY-UHFFFAOYSA-N	426.838	1.573	50	20	IDGD	
CCc1ccc(C(=O)NNc2ccccc2[N+](=O)[O-])cc1S(=O)(=O)N1CCOCC1	105840822	YDIVXHXYPCFDEB-UHFFFAOYSA-N	434.474	1.935	50	20	IDGD	
O=C(Cc1ccc(O)cc1)NCC(=O)NNC(=O)COc1ccccc1-c1ccccc1	726869704	IYZMSYAKLLPKGR-UHFFFAOYSA-N	433.464	1.944	50	20	IDGD	
CNS(=O)(=O)c1cccc([C@@H](C)NC(=O)NNC(=O)CCc2ccc(OC)cc2)c1	727609314	JJAAMOQYGDQIJS-CQSZACIVSA-N	434.518	1.628	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)[C@H]2CCCN2C(=O)c2ccc3c(c2)OCO3)c(C)c1	728206017	QBUZTZUCKDRBAT-GOSISDBHSA-N	438.484	1.896	50	20	IDGD	
CCOC(=O)c1ccc(NC(=S)NNC(=O)C2CCN(c3ncccn3)CC2)cc1	728798743	ZJXGROBYXIYIQM-UHFFFAOYSA-N	428.518	1.888	50	20	IDGD	
COc1ccc(CN2C[C@H](C(=O)NNC(=S)Nc3ccc(OC)nc3)CC2=O)cc1	729691650	KIGKCIPGFINWFM-CQSZACIVSA-N	429.502	1.465	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NCCOc1ccc(S(C)(=O)=O)cc1	730067313	WVJQIJAAOINFHJ-CYBMUJFWSA-N	439.465	1.406	50	20	IDGD	
O=C(NC[C@@H](O)c1cccc(C(F)(F)F)c1)NNC(=O)c1ccc(-n2cnnn2)cc1	730820435	DPKVBSIAVBEKJH-OAHLLOKOSA-N	435.366	1.359	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)c2ccc(C)c(S(=O)(=O)NCC#N)c2)c1	731185984	FSDCASCQPWPZRN-UHFFFAOYSA-N	430.486	1.254	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)CCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1ccccc1	732133406	YMZSRDXXVYSHQE-KRWDZBQOSA-N	434.474	1.604	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)NCc1ccc(S(=O)(=O)NCCOC)cc1)c1ccccc1	732239735	VXWFPGCITMZZKP-IBGZPJMESA-N	448.545	1.636	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N2CCC(N3CCNC3=O)CC2)cc1Br	732256183	YFJIZBDZHVSAHJ-UHFFFAOYSA-N	440.298	1.302	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@@H](C(=O)NNC(=O)C(=O)NC(C)C)C2)c2ccccc12	732644589	XQYNQFPEWQIGPK-OAHLLOKOSA-N	440.500	1.373	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCCS(=O)(=O)C(C)(C)C)cc1Br	733347652	GGECQTKHQVDWJK-UHFFFAOYSA-N	436.328	1.615	50	20	IDGD	
CCCCn1c(N)c(N(CC(=O)NNC(=O)c2ccc(C)cc2)CC(C)C)c(O)nc1=O	733793544	IVCBFSXLEKBIOQ-UHFFFAOYSA-N	444.536	1.563	50	20	IDGD	
COc1ncc(C(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)cn1	733947858	HPAVJUHDVJIXDP-UHFFFAOYSA-N	441.469	1.039	50	20	IDGD	
CCc1ccc([C@@H]2COCCN2C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)o1	736387634	UCCZFWGXWYAPCD-KRWDZBQOSA-N	428.493	1.663	50	20	IDGD	
COc1cc(C(=O)NNC(=O)N[C@@H]2CCN(c3ccc(C)cc3)C2=O)cc(OC)c1OC	743505357	AEEYWLSSUFTMGT-MRXNPFEDSA-N	442.472	1.770	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)NCCCN2CCN(c3ncccn3)CC2)cc1	743523524	RBLXRLBPWOOQLA-UHFFFAOYSA-N	441.540	1.091	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)NCCN1CCN(C(=O)OC(C)(C)C)CC1	744896195	QEZLBQJEOYCJFP-UHFFFAOYSA-N	445.524	1.139	50	20	IDGD	
CSC1(CNC(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)CCOCC1	745868629	JUOYPXRPEQFWKF-UHFFFAOYSA-N	433.534	1.834	50	20	IDGD	
NC(=O)COc1ccc(C=NNC(=O)CN2c3cccc4cccc(c34)S2(=O)=O)cc1	745986347	HKZLRSHFGXZEOI-UHFFFAOYSA-N	438.465	1.363	50	20	IDGD	
CC[C@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(CC)CC)c1)C1CCOCC1	746425849	KIBNGQWGTZAGNU-SFHVURJKSA-N	440.566	1.866	50	20	IDGD	
CC[C@@H](NC(=O)NNC(=O)Cc1cn2ccccc2n1)c1ccccc1OCC(=O)NC	746759135	PPBDQERBHMPAOI-QGZVFWFLSA-N	438.488	1.483	50	20	IDGD	
Cc1ccc(CNC(=O)C2CCN(CC(=O)NNC(=O)c3ccc(C#N)cc3)CC2)cc1	747848149	PKSXANMRWNZSAM-UHFFFAOYSA-N	433.512	1.656	50	20	IDGD	
O=C(NNC(=O)c1ccc(S(=O)(=O)Nc2ccc(F)cc2)cc1)C(=O)N1CCCC1	748246581	MEBCOAYTHKAXBD-UHFFFAOYSA-N	434.449	1.010	50	20	IDGD	
Cc1cc(S(=O)(=O)NNC(=O)c2ccc(Br)s2)ccc1OCC(=O)O	748689552	LLGWTIYYHWWXHN-UHFFFAOYSA-N	449.304	1.906	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)N1CCCN(C(=O)Cc2cccc(F)c2)CC1	749111637	NPHURNRITXKDTB-UHFFFAOYSA-N	428.464	1.966	50	20	IDGD	
Cc1ccc(CCC(=O)NCC(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)cc1	749311987	IGUWQDFUVAGCLF-UHFFFAOYSA-N	431.876	1.702	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(Br)s1)NNC(=O)NC1CCCC1	749851339	KTISAMZNCYNRBD-UHFFFAOYSA-N	425.330	1.062	50	20	IDGD	
CC(=O)N1C[C@H](C(=O)NNc2nc(Br)cn3ccnc23)Oc2ccccc21	750246883	INXZURKCVZVNOU-CYBMUJFWSA-N	431.250	1.749	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)N[C@H]1CCN(c2cccc(Cl)c2)C1=O	750266996	KJLTYWZZAMMSQW-INIZCTEOSA-N	440.851	1.065	50	20	IDGD	
COc1ccccc1N1CC[C@@H](CNC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)C1	750331781	YYIWJHZLASXUAC-HNNXBMFYSA-N	436.476	1.141	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)[nH]n1)c1ccc(N2CCCS2(=O)=O)cc1	751126252	KCRMHPRQAMECFJ-UHFFFAOYSA-N	425.470	1.691	50	20	IDGD	
Cc1nn(-c2ccccc2)c2ncc(C(=O)NNC(=O)CNC(=O)c3cccs3)cc12	751209856	WJGNQNOXLCJKME-UHFFFAOYSA-N	434.481	1.981	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)c1ccc(CS(=O)(=O)C(F)F)cc1	751564449	CKTWOALAKTUZDJ-UHFFFAOYSA-N	436.396	1.548	50	20	IDGD	
O=C1CN(S(=O)(=O)c2ccc(C(=O)NNc3cc(Cl)ccc3Cl)cc2)CCN1	752813382	UWNXPWTZNVWIFT-UHFFFAOYSA-N	443.312	1.871	50	20	IDGD	
Cc1oncc1C(=O)Nc1ccc(O)c(C(=O)NNC(=O)CNC(=O)c2cccs2)c1	755222894	LYHDAEXBYOLHSP-UHFFFAOYSA-N	443.441	1.193	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2ccc3c(c2)NC(=O)CS3)c2ccccc2c1=O	755549146	HCDPKEIPTPOUFR-UHFFFAOYSA-N	438.469	1.927	50	20	IDGD	
Cc1cccc(C(=O)N2CCCC2)c1NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	755645113	FZGGBEPDKAEMII-UHFFFAOYSA-N	448.483	1.944	50	20	IDGD	
CN1CC(=O)N(c2cccc(NC(=O)NNC(=O)c3cc(Br)c[nH]3)c2)C1=O	755991684	JVYOKMYGDJFTDM-UHFFFAOYSA-N	435.238	1.642	50	20	IDGD	
Cc1cccn2c(NC(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)c(-c3ccccc3)nc12	756287317	SLDHJIIZSKGESY-HNNXBMFYSA-N	427.486	1.897	50	20	IDGD	
COC(=O)Nc1cc(NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)ccc1F	756327443	UAVLEFGTCCQLKF-UHFFFAOYSA-N	428.380	1.717	50	20	IDGD	
C#CCOc1ccc(NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc1	756480293	UTSVMYRQKSBVSI-UHFFFAOYSA-N	442.497	1.950	50	20	IDGD	
Cn1c(=NNC(=O)[C@H](CC(N)=O)NC(=O)OCc2ccccc2)sc2ccccc21	756788244	TVESOCUWWHJYFB-AWEZNQCLSA-N	427.486	1.342	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N[C@@H]2CCN(c3ccccc3OC)C2=O)cc1OC	756916040	UNFXGMBYJFHYPF-CQSZACIVSA-N	428.445	1.462	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccnn2Cc2ccccn2)c1	757785241	CBJWRJWOPSRTPB-UHFFFAOYSA-N	443.489	1.043	50	20	IDGD	
CCS(=O)(=O)N1CCC(CNC(=O)NNC(=O)Nc2ccc(OC(F)F)cc2)CC1	758745240	RPWXCQJKAZRQQX-UHFFFAOYSA-N	449.480	1.685	50	20	IDGD	
C[C@H](CC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)NS(=O)(=O)c1cccnc1Cl	760210975	LGTKBKBIVCUJDK-SNVBAGLBSA-N	441.853	1.161	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)N1CCO[C@@H]([C@@H](C)NC(=O)OC(C)(C)C)C1	760713886	DZAWOZJJRPPHJN-UKRRQHHQSA-N	446.508	1.611	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)C#Cc2ccc3c(c2)OCO3)c1	761787615	ZHJUISUXCIKJLJ-UHFFFAOYSA-N	443.481	1.259	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)/C(=C\c2ccccc2)n2nnnc2C)n[nH]1	763150751	BCVSHHGSBSPRJM-XDHOZWIPSA-N	444.455	1.840	50	20	IDGD	
O=C(NNC(=O)c1ccccc1Br)C(=O)Nc1ccn(Cc2ccncc2)n1	763482471	GKLBDHFWYHDMBY-UHFFFAOYSA-N	443.261	1.489	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cnn(-c3ccccc3Cl)c2)cc1OC	763552106	VWPOURMIOIIFHW-UHFFFAOYSA-N	443.847	1.943	50	20	IDGD	
COC(=O)c1ccc(OC)cc1NC(=O)C(=O)NNC(=O)c1cc(C)nc2ccccc12	763617341	YDMIFUVBABSLPO-UHFFFAOYSA-N	436.424	1.738	50	20	IDGD	
COc1ccc(C)cc1NC(=O)C(=O)NNC(=O)COc1ccc(Br)cc1	763695747	VGTRORVERQGFTL-UHFFFAOYSA-N	436.262	1.931	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cnn(C[C@H]3CCCO3)c2)cc1	763768858	UTBLKOMWRWXUTK-LJQANCHMSA-N	443.504	1.887	50	20	IDGD	
C[S@](=O)Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)ccc1Cl	763813277	JIZKESLSPJSCBT-PMERELPUSA-N	448.888	1.255	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)Cc2c(C)nn(CC(F)(F)F)c2C)c1	763828042	KQJADUORWFITDZ-UHFFFAOYSA-N	426.395	1.918	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cccc([N+](=O)[O-])c2C)cc1	763872282	NGUCTSRJBPQNRQ-ZDUSSCGKSA-N	428.401	1.659	50	20	IDGD	
CCn1cnnc1-c1cccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)c1	763873873	XORIDHKZYUAILA-CYBMUJFWSA-N	440.435	1.658	50	20	IDGD	
CC1CCN(c2cccc(NC(=O)C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)c2)CC1	763916241	FBIYPSZUAJRWIC-UHFFFAOYSA-N	448.487	1.298	50	20	IDGD	
C[S@](=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Br)s2)cc1F	763940647	MFUJQTQHJOJKBI-VWLOTQADSA-N	448.295	1.787	50	20	IDGD	
COC(=O)c1cc(Cl)cc(NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)c1	763978095	DRKFMXZVJDGIEP-UHFFFAOYSA-N	426.212	1.885	50	20	IDGD	
CCCN1CCN(c2ccc(NC(=O)C(=O)NNC(=O)c3cccn3C)cc2Cl)CC1	763993281	NEQQDWXPDFJQSM-UHFFFAOYSA-N	446.939	1.610	50	20	IDGD	
Cc1ccc(-n2nc(-c3ccco3)cc2NC(=O)C(=O)NNC(=O)c2cnccn2)cc1	764031756	MGJJUQUUZUWPLJ-UHFFFAOYSA-N	431.412	1.630	50	20	IDGD	
O=C(NNC(=O)c1cccc(C(F)(F)F)c1)C(=O)Nc1ccn(-c2ncccc2F)n1	764037706	UUILGIIFAGWDBB-UHFFFAOYSA-N	436.325	1.825	50	20	IDGD	
Cn1cnn(-c2ccc(NC(=O)C(=O)NNC(=O)c3ccc4ccccc4c3)cc2)c1=O	764062161	RSVHRVINLOBBGY-UHFFFAOYSA-N	430.424	1.124	50	20	IDGD	
Cc1cc(OC(C)C)ccc1NC(=O)C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	764077262	KXRTUECRAKMTKX-UHFFFAOYSA-N	433.486	1.585	50	20	IDGD	
COCCOc1c(Cl)cccc1NC(=O)C(=O)NNC(=O)c1cccc(OC)c1O	764130529	JRWKDEJIRSJXJH-UHFFFAOYSA-N	437.836	1.479	50	20	IDGD	
CC(C)CCC(=O)NNC(=O)C(=O)Nc1ccc(S(=O)(=O)/N=C2/CCCN2C)cc1	764203817	XZSIKALDRGBKDZ-KQWNVCNZSA-N	437.522	1.022	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)C(=O)Nc1ccc(N=Nc2ccccc2)cc1	764227861	SCVXRIYZNSJUHR-GFCCVEGCSA-N	432.462	1.126	50	20	IDGD	
Cc1cc(C(=O)N2CCSCC2)ccc1NC(=O)C(=O)NNC(=O)c1scnc1C	764248030	YEFLHIUJBDVGDO-UHFFFAOYSA-N	447.542	1.349	50	20	IDGD	
Cc1nnnn1-c1cc(NC(=O)C(=O)NNC(=O)CCCc2cccs2)ccc1F	764342717	ITRZYCZRFOZXCB-UHFFFAOYSA-N	431.453	1.280	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)COCc2ccccc2)ccc1N1CCCC1=O	764367125	JNDTVLMKHKPWQH-UHFFFAOYSA-N	440.456	1.125	50	20	IDGD	
CO[C@H](CNC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)c1ccccc1Cl	764374993	PEGFIZZENDOYJK-MRXNPFEDSA-N	429.864	1.919	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)C(=O)Nc2cccc(-n3nc(C)cc3C)c2)c1	764432118	CHXVZJHXZKWKGS-UHFFFAOYSA-N	435.444	1.242	50	20	IDGD	
C[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@H]1NC(=O)NNC(=O)c1nnc(O)c2ccccc12	764562950	FBPVEEAAXVDTGQ-IUODEOHRSA-N	444.492	1.925	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)NCc2cccc(N3CCCS3(=O)=O)c2)c1	765893149	PDIXFUXIYPANTK-UHFFFAOYSA-N	446.529	1.753	50	20	IDGD	
Cc1c(C(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)nnn1Cc1ccc(F)cc1	768178587	BRVGDKWTPQPCAI-UHFFFAOYSA-N	444.854	1.505	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)c1ccc(S(N)(=O)=O)cc1F	769738050	GIMPHJYFQIKPBZ-UHFFFAOYSA-N	434.474	1.980	50	20	IDGD	
CC(=O)NCc1ccc(S(=O)(=O)NCC(=O)OC[C@H](C)CBr)s1	770382642	HPCVRSLOHVFSNY-SECBINFHSA-N	427.342	1.237	50	20	IDGD	
CCOC(=O)N1CC[C@H](NC(=O)NNC(=O)COc2ccc(Br)cc2)C1	770535802	QKMATSBVGJWCFW-LBPRGKRZSA-N	429.271	1.389	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)N1CCN([C@H](C)C(=O)NC2CC2)CC1	770646227	DTMPYHMAFREKBV-KGLIPLIRSA-N	437.928	1.133	50	20	IDGD	
CS(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)c2cccc3ccccc23)cc1F	771145655	XINGKIXEQGLLFA-UHFFFAOYSA-N	437.474	1.974	50	20	IDGD	
COCCc1ccc(S(=O)(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)cc1	771608110	RSDNPGLPTGGYRU-UHFFFAOYSA-N	425.894	1.155	50	20	IDGD	
COC(=O)c1ccc(C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)c(F)c1	771868216	QBRYDJJMOYWBET-UHFFFAOYSA-N	437.449	1.002	50	20	IDGD	
Cc1cc(=O)c(C(=O)O[C@@H](C)C(=O)NNC(=O)CC(C)C)nn1-c1ccccc1[N+](=O)[O-]	771900489	BOICXJBTDMJEKY-ZDUSSCGKSA-N	445.432	1.188	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)CN1C(=O)N[C@@](C)(c2ccccc2)C1=O	772971180	JZQNTTWBGPCBES-ASSNKEHSSA-N	444.875	1.722	50	20	IDGD	
Cc1ocnc1CNC(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	775454021	JEMUJYZYUCCCPQ-UHFFFAOYSA-N	432.440	1.885	50	20	IDGD	
O=C(c1cc(Cl)ccc1[N+](=O)[O-])N1CCN(S(=O)(=O)CBr)CC1	777833129	SOUBMKUZMDUAGM-UHFFFAOYSA-N	426.676	1.688	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)c1cn(-c2ccccc2C(F)(F)F)nn1	778433060	GDDZJFDKUPOPKO-UHFFFAOYSA-N	428.371	1.572	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)CNC(=O)c2ccc(Br)o2)nc1C	778510205	CYRSBLORFRYWOV-UHFFFAOYSA-N	426.227	1.190	50	20	IDGD	
COc1cccc2[nH]cc(CC(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)c12	778531187	WLIPTHUHENYTSW-UHFFFAOYSA-N	430.486	1.431	50	20	IDGD	
COC(=O)Cc1cccc(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)c1	778942140	XZICLVIJOHGHKM-UHFFFAOYSA-N	433.486	1.180	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)c2cccc(S(=O)(=O)NC[C@H]3CCCO3)c2)c1	780789625	IVOYAHFTHRXCHZ-QGZVFWFLSA-N	433.486	1.687	50	20	IDGD	
CCCn1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)cn1	781928930	BSQSWLBMTXRLNX-UHFFFAOYSA-N	441.513	1.846	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2c[nH]nc2-c2ccsc2)CC1	781932274	KWPWOXZYOCQSCO-UHFFFAOYSA-N	447.546	1.226	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)c1cccc(NS(=O)(=O)C(F)(F)F)c1	782542489	XKWWCYOGZLHHMC-UHFFFAOYSA-N	447.391	1.797	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)O[C@H](C(=O)N2CCC[C@H](C(N)=O)C2)C(C)C)cc(C#N)n1C	782626762	GYFBWMGTRWHJSW-AUKVGYTBSA-N	425.489	1.404	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ncccc2C(F)(F)F)c(OCC(=O)N(C)C)c1	783118281	NNWKCIVHKHDHRE-UHFFFAOYSA-N	439.394	1.958	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)cc1Cl	783263159	HYSCKZJZYXDAAN-UHFFFAOYSA-N	425.898	1.812	50	20	IDGD	
CCC(CC)NC(=O)[C@H]1CN(C(=O)C(=O)NNc2ncc(F)cn2)c2ccccc2O1	784950660	WVAHOFWAXRLCPX-MRXNPFEDSA-N	430.440	1.158	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2cccc3c2CCN3S(C)(=O)=O)cc1Cl	785116001	ADQJVMLRYFEWLE-UHFFFAOYSA-N	438.893	1.753	50	20	IDGD	
C[C@H]1Cc2cc(S(N)(=O)=O)ccc2N1C(=O)COC(=O)/C(C#N)=C/c1ccccc1	785352740	ZSEIBSJRDGYIKI-FBJMNJBLSA-N	425.466	1.762	50	20	IDGD	
COC(=O)c1sc(S(=O)(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c(C)c1Cl	788478952	WGMICFKRBWZWCP-NSHDSACASA-N	446.890	1.646	50	20	IDGD	
O=C(NNC(=O)C1CCC1)C(=O)Nc1cc(Br)cc(C(=O)N2CCCC2)c1	790953184	XTFMRZNYBQJHGO-UHFFFAOYSA-N	437.294	1.571	50	20	IDGD	
CC(C)(C)NS(=O)(=O)Cc1cccc(NC(=O)C(=O)NNc2nc3ccccn3n2)c1	792394220	OIMHQDOOOWQOIC-UHFFFAOYSA-N	445.505	1.029	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)COc1ccc(N2CCCC2=O)cc1	795168712	CCSCJLRMNXWBQH-UHFFFAOYSA-N	432.502	1.586	50	20	IDGD	
Cc1ccc(NC(=O)OC(C)(C)C)cc1C(=O)NNC(=O)CNC(=O)c1cccnc1	795180663	CUAGTKLWHYUSQY-UHFFFAOYSA-N	427.461	1.928	50	20	IDGD	
C[C@H](c1cccc(S(N)(=O)=O)c1)N(C)C(=O)NNC(=O)c1cc(Br)c[nH]1	799856613	CKISQXLRJHVRJQ-SECBINFHSA-N	444.311	1.472	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)cc1	801109344	KEMLXLOIWWEXAH-CYBMUJFWSA-N	445.457	1.355	50	20	IDGD	
COc1ccc(S(N)(=O)=O)cc1C(=O)NNC(=O)Nc1ccc(Br)cc1	801996921	HXJKITBJHDFKID-UHFFFAOYSA-N	443.279	1.572	50	20	IDGD	
CC1(C)CCC[C@]2(C1)NC(=O)N(CC(=O)NNC(=O)Nc1ccc3c(c1)OCO3)C2=O	802096766	DUHINDGXLCNIDT-HXUWFJFHSA-N	431.449	1.459	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2N2CCOCC2)cc1	802121469	DVDOUGHFMVQFGG-UHFFFAOYSA-N	428.449	1.964	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(F)cc2OC2CCOCC2)c1	806973210	DXAWYPSZVOYBIN-UHFFFAOYSA-N	445.447	1.857	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(CS(C)(=O)=O)ccc2OC)cc1	806974945	ZLCVQNPTNTWIKT-UHFFFAOYSA-N	433.486	1.202	50	20	IDGD	
CCc1nnc(NC(=O)[C@@H](C)[C@@H](C)NC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)s1	807565530	MYRPJLBSKYHCHR-VHSXEESVSA-N	435.466	1.616	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCc2ccncc2OC[C@@H]2CCOC2)c(OC)c1	807615243	GEKLKXVRGFHKTO-CQSZACIVSA-N	430.461	1.658	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H](N2CCN(CC(=O)NNC(=O)c3ccc(F)cc3)CC2)C1	808770964	QUUAJYHSGJIMFY-GOSISDBHSA-N	449.527	1.214	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)COc2cc(F)cc(F)c2)c1	809957090	IVJQNKNFRHBLLN-UHFFFAOYSA-N	441.456	1.835	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1ccc(C#N)c(F)c1	810382857	OJSORKXMJMOUAG-UHFFFAOYSA-N	433.465	1.856	50	20	IDGD	
O=C(CNS(=O)(=O)c1cccc(F)c1)NNc1nc(-c2ccccn2)nc2c1CCC2	810442627	ZNZOAHJAYLTGFB-UHFFFAOYSA-N	442.476	1.588	50	20	IDGD	
CCCCN(C)C[C@@H](C)NC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1	812508029	LPKRRNMNBBOWNA-MRXNPFEDSA-N	427.571	1.066	50	20	IDGD	
CCCN(CC)C[C@@H](C)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	812659087	FVRFWYJURJZKSY-MRXNPFEDSA-N	439.582	1.536	50	20	IDGD	
COC(=O)c1cn(-c2cccc(NC(=O)NNC(=O)c3c(C)nc4ccccn34)c2)nn1	812978645	ACQDXWRFHVTNNN-UHFFFAOYSA-N	434.416	1.477	50	20	IDGD	
COCC1(CNC(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)CCOCC1	813771978	OGGWGXPWRIMCRH-UHFFFAOYSA-N	431.493	1.365	50	20	IDGD	
Cc1c(CC(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)cnn1C	814266548	OTMNJIJQSXMZKL-UHFFFAOYSA-N	430.472	1.434	50	20	IDGD	
O=C(NNC(=O)c1ccccn1)C(=O)Nc1ccn(-c2ccc(Br)cc2)n1	815563898	RAEYFOJJYYRCEN-UHFFFAOYSA-N	429.234	1.430	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)cc(OC)c1C	815595345	ONWCEWAJUMUZIX-UHFFFAOYSA-N	448.501	1.535	50	20	IDGD	
COc1ccc(-c2nn(CCC#N)cc2C(=O)NNC(=O)[C@H]2CCCO2)cc1[N+](=O)[O-]	817215587	HNDHQIJMYZMNCQ-MRXNPFEDSA-N	428.405	1.321	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)CNC(=O)c2ccc(Br)cc2)c1	825796820	LWKVBJCNMWJTBY-UHFFFAOYSA-N	435.278	1.447	50	20	IDGD	
C[C@H](NC(=O)C(C)(C)C)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	871045111	GAGCSUKBPYQJNY-AWEZNQCLSA-N	438.550	1.173	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)C1CCN(c2ncccn2)CC1	915804552	HUKFIWYPRFEMOW-UHFFFAOYSA-N	437.548	1.053	50	20	IDGD	
CCN(CC)[C@@H](CNC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)c1ccccc1	915901182	AAUSJSJINOHVML-IBGZPJMESA-N	436.516	1.961	50	20	IDGD	
COc1ccc(NCC(=O)NN=Cc2c(C)nn([C@@H]3CCS(=O)(=O)C3)c2Cl)cc1	915916275	CLZAUWMYWFUZCB-CQSZACIVSA-N	439.925	1.775	50	20	IDGD	
CC(=NNC(=O)c1nn(-c2ccccc2)cc1O)c1cccc(S(=O)(=O)N(C)C)c1	915952238	PFRCMIBBNIZVEM-UHFFFAOYSA-N	427.486	1.982	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2ccc(OC)nc2)c1	916233671	HKWDVJUOBVSORH-UHFFFAOYSA-N	435.506	1.265	50	20	IDGD	
O=C(NN=Cc1cccc2c1OCCCO2)C(=O)NN=Cc1cccc2c1OCCCO2	917531409	OULNWZLCDUIRTR-UHFFFAOYSA-N	438.440	1.610	50	20	IDGD	
CN(C)[C@@H](CNC(=O)NNC(=O)c1csc(N2CCOCC2)n1)c1ccc(F)cc1	918091395	VGDRYRPSVJZVFY-INIZCTEOSA-N	436.513	1.366	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc2c(c(C(=O)O)c1)OCCO2)c1ccc(Cl)cc1O	919957980	KZCSKVMJPWNMHZ-UHFFFAOYSA-N	428.806	1.138	50	20	IDGD	
O=C(NC[C@@H]1CCCCO1)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	920344197	QARXHYQAYHANPB-KRWDZBQOSA-N	435.484	1.958	50	20	IDGD	
O=C(CCNS(=O)(=O)c1cccc([N+](=O)[O-])c1)NNC(=O)c1ccc(Cl)cc1O	920345237	AYQKSRKADUMXEY-UHFFFAOYSA-N	442.837	1.083	50	20	IDGD	
N#Cc1ccc(N2C[C@H](C(=O)NNc3nc(Br)cn4ccnc34)CC2=O)cc1	1116216098	NDLASFLJSDBCIR-GFCCVEGCSA-N	440.261	1.860	50	20	IDGD	
O=C(NNC(=O)c1cncn1-c1ccccc1)N[C@H]1CC(=O)N(c2c(F)cccc2F)C1	1116457329	NAQPCRAADKPANR-ZDUSSCGKSA-N	440.410	1.900	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)C3CCN(C(=O)c4cccnc4)CC3)nc21	1253272704	JFXYRNRQUXSELU-UHFFFAOYSA-N	438.492	1.677	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnn4c(C)cc(C)nc34)C2)C1	1777779836	MRRPEYPFYDPWGQ-UZLBHIALSA-N	435.912	1.043	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(CCN(C(=O)c3cn4ccsc4n3)C2)C1	1778626570	IAYBKDSEMICKEA-MRXNPFEDSA-N	427.324	1.624	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccn4cncc4c3)C2)C1	1778658016	GNVKKQVVHDERND-LPHOPBHVSA-N	435.322	1.951	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCSC(=N)N)C2	1779543968	VIULLSOVLGALDV-RDTXWAMCSA-N	430.647	1.369	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2n[nH]cc2[N+](=O)[O-])C1	1779600154	SWGGZALLLIMYLG-RVZJWNSFSA-N	427.889	1.853	50	20	IDGD	
O=C(c1ccc(N2CCCC2)c(F)c1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1780143709	UAZBOWYCUXYJKL-GHTZIAJQSA-N	439.915	1.469	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cnc4cc(C)ccn4c3=O)CCO2)C1	1781218832	KGDKKSXENPBXFI-HRAATJIYSA-N	432.908	1.464	50	20	IDGD	
COc1ccccc1CC(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781335379	XVFZNQDEOTWTSX-SJLPKXTDSA-N	429.286	1.758	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(CCN(C(=O)c3ccc(O)c([N+](=O)[O-])c3)C2)C1	1781539580	ZKTFRJZEEDGVTM-QGZVFWFLSA-N	442.266	1.529	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)n1ccnn1)C2	1782002866	YMPPZYYAJRJBPQ-VMUDFCTBSA-N	428.331	1.136	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)Cn1cccn1)C2	1782170865	CPMWYPQZSOVLDG-TVKQPGBESA-N	426.945	1.287	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(CO)c(F)c1)C2	1782179483	YEYJDULYNMFILT-YRISNDGFSA-N	442.915	1.699	50	20	IDGD	
Cc1ccn2c(C(=O)N3CC[C@]4(C3)CN(C(=O)[C@H](F)Br)CCO4)cnc2c1	1782487470	FONJJHQNBOJLSB-YJBOKZPZSA-N	439.285	1.777	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCc2ccoc2)C1	1782664009	KKVDEDHOWQCFJA-XMSQKQJNSA-N	434.537	1.099	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cccc(NC(=O)OC)c3)CCO2)C1	1783880781	LNUZDRCUYMPEGE-UZLBHIALSA-N	439.896	1.562	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CC[C@@H]4CCC(=O)N4C3)C[C@@H]21	1784620669	GIONWGYYPLZDRL-SGYMCOKNSA-N	439.984	1.775	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cn3cnc4ccccc43)C[C@@H]21	1786407697	KYTWBYWDDPBFEX-MPGHIAIKSA-N	449.349	1.801	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cn3cc(Cl)cn3)[C@H]2C1	1787003144	CXUKFHPYSIAKNG-MJFSBKNWSA-N	437.755	1.753	50	20	IDGD	
O=C(/C=C/C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]2C1)NCc1ccccc1	1787443921	XMFHZYPPPUAJCG-XHNMEYTFSA-N	437.899	1.373	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3nn[nH]c3C(F)(F)F)[C@H]2C1	1789358861	QPZCLKZUECVZAP-BJDJZHNGSA-N	437.850	1.824	50	20	IDGD	
CCOc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]3C2)nn1	1789872758	WFLWGCHTOFYCJQ-VODUFIJXSA-N	445.347	1.705	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](NC(=O)OC)c1ccccc1	1792906116	RTRZOOMKRTXJDR-FLXSYLCISA-N	437.924	1.976	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cnc2ccccn12	1792930450	AJMDQSCNHSFLNG-BKEDOTJMSA-N	449.349	1.497	50	20	IDGD	
CN(C)[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](O)CCl)c1ccccc1Cl	1792983461	IOQYRWLYYLIRNA-IYYQDKMGSA-N	444.359	1.132	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(F)s1	1794219614	LZOQUQMZEWCLRS-CNKKGNCFSA-N	447.492	1.224	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(C=O)s1	1795745061	RCZJSJPOFYNBIL-WJNVRWDZSA-N	429.336	1.937	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(N2CCOCC2)n1	1796618565	ZASQTGZWMYEBBC-RCJHGTSTSA-N	436.940	1.139	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(O)(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](F)Cl)CC1	1796802932	IUGAPEKQCKFBMR-LXTVHRRPSA-N	447.935	1.921	50	20	IDGD	
CCN1CCC(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)CC1	1796893060	LKGXDYNGUHKCPL-JAEJZPAFSA-N	442.564	1.491	50	20	IDGD	
CC(C)NC(=O)OC(C)(C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CO[Si](C)(C)C	1797956250	MMQOSUJFSNWQNI-SCAQPMJSSA-N	443.617	1.341	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccn(-c2ccccc2)n1	1798698652	RBQKSUSBWSCURG-ZXFNITATSA-N	447.333	1.859	50	20	IDGD	
CSc1cccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)c1O	1799261505	BFFHEWKKYACTSF-BJWYYQGGSA-N	440.330	1.360	50	20	IDGD	
COC(=O)[C@@H]1CC[C@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@](C)(Cl)CCl)C1	1799273267	ATSXTEWATNFJFG-ZNRJKYBQSA-N	435.348	1.402	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3[nH]ccc3n1)C2)[C@H](F)Br	1799348977	FFXYIIATHRQCNQ-OWLDWWDNSA-N	425.258	1.457	50	20	IDGD	
CN(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccco1)C2)NC(=O)NCc1ccccc1	1799864690	IDNQTAWFVRTPAR-REPLKXPHSA-N	439.516	1.878	50	20	IDGD	
N#CC1(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](Br)Cc2ccccc2)CC1	1800436579	YLIWHKPRCJJLEC-MHORFTMASA-N	446.345	1.886	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(-c2cnco2)c1)c1cccc(B(O)O)c1	1800547495	VCZATEJYMBZAMV-WKCHPHFGSA-N	445.284	1.587	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccnn1C(C)C)C2	1800642128	YFCILCXABUEFEP-FQLMCAECSA-N	427.343	1.841	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccc(F)cc1F	1800660209	JTJJGRVYPWSJRL-YVWYUNDQSA-N	426.536	1.948	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nc(Cl)ccc1F)C2	1800757394	FBZNLUPIDIAMJO-ORXSELOVSA-N	434.693	1.861	50	20	IDGD	
Cc1ccc(C(=O)C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)CBr)C3)cc1	1800882556	GXHKLERUAXGGRI-MXASKKJJSA-N	437.334	1.798	50	20	IDGD	
CC[C@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc3n(n1)CCNC3=O)C2	1801798221	AVGUMZPSZIXEBR-RNJOBUHISA-N	438.326	1.052	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCc1ccc(C#N)cc1)C2	1802328866	HAACSRRGCATMQI-ACDBMABISA-N	425.533	1.502	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](N)c1cccc(Cl)c1)C2	1802332468	CLVHTFJNLBVCQA-AXVVYFOYSA-N	435.956	1.351	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCCC(=O)OC(C)(C)C)C2	1802334736	OIIDZDOBQPYWNZ-BJWYYQGGSA-N	438.569	1.510	50	20	IDGD	
CC(C)(C)OC(=O)NCC[C@H](O)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C(Cl)Cl	1802346130	BVCASSXKIWHZQE-RNJOBUHISA-N	438.352	1.704	50	20	IDGD	
Cn1ncc(C(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)c1Cl	1803140381	FBQLKIXVRPHPOC-YUELXQCFSA-N	426.304	1.388	50	20	IDGD	
COc1cc(C#N)cc(C(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)c1	1803141582	QDBJHXXAYGAYPP-LSTHTHJFSA-N	442.903	1.881	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)Cn2ccncc2=O)[C@@H]1c1cccnc1	1803693651	AOVMWPHHADEFRP-ABSDTBQOSA-N	431.924	1.752	50	20	IDGD	
Cc1noc(CC(=O)N2CC[C@@H](CNC(=O)CCBr)[C@H]2c2cccnc2)n1	1806340772	MZFKBDLNKWLCGG-KBXCAEBGSA-N	436.310	1.807	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)CCN2CCN(C)CC2)[C@@H]1c1cccnc1	1806918085	YPUKQJZAEJJYNP-DYXWJJEUSA-N	436.000	1.742	50	20	IDGD	
C#CCCCCC(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1807374134	IRPNOLNNYUYBNP-NFBKMPQASA-N	433.317	1.275	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)NC[C@@H]1CCN(C(=O)[C@@](C)(Cl)CCl)[C@@H]1c1cccnc1	1808231664	IEBMLYZMHRIIHE-ZTENYAIWSA-N	444.363	1.771	50	20	IDGD	
Cc1c[nH]cc1C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1	1808583301	FWWSTGWJPVNHJX-OXQOHEQNSA-N	447.499	1.350	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)[C@@H]3CCc4ccccc43)CC2)C1	1809980201	LTQTXROCIILGGC-HSZRJFAPSA-N	446.356	1.941	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)CCNC(=S)NC)[C@@H]1c1cccnc1	1810314724	JNRZBTVTIKCNBV-VYDXJSESSA-N	425.986	1.589	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)on1	1813070396	ILXBWKMBSDPZBS-OXJNMPFZSA-N	428.493	1.071	50	20	IDGD	
O=C(CCc1ccoc1)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1813523791	WXUKATVOGBCCBT-REWPJTCUSA-N	447.300	1.307	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)[C@H]2CCCSC2)[C@@H]1c1cccnc1	1814142980	YRRSPVSTFSXIRM-LQWHRVPQSA-N	447.605	1.604	50	20	IDGD	
CN(CC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](O)CCl)CC2)C(=O)OC(C)(C)C	1814231313	DLUPFGGKJSWKAR-JQWIXIFHSA-N	446.957	1.522	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](CC)NC(N)=O)sc2C1	1817023837	KCVASMOJFGMGIV-UTLUCORTSA-N	446.371	1.676	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](O)CCl)CC2)c1ccc2c(c1)CNC2=O	1819362761	FWWZHVAWRPKKQQ-SMDDNHRTSA-N	434.905	1.212	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)C2CCOCC2)[nH]n1	1819402259	XGHHVCHUUGROBT-KRWDZBQOSA-N	441.492	1.141	50	20	IDGD	
Cc1ccc(O)c(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)c1	1820462153	AOYGEVYDNYDMRI-IBGZPJMESA-N	448.288	1.723	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)C[C@@H]2NC(=O)NC2=O)[nH]n1	1820862310	NBCGVNXBNPECOX-DINDLPBHSA-N	445.307	1.236	50	20	IDGD	
CC[C@@H](Br)C(=O)Nc1cc([C@H]2CCCCN2C(=O)Cn2cnnn2)[nH]n1	1822086971	DOQVAEUHJZKLEH-ZYHUDNBSSA-N	425.291	1.262	50	20	IDGD	
O=C(CC(F)(F)C(=O)O)N[C@@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1	1823002416	DBHPCUCLJWCPCZ-ANLVUFKYSA-N	444.229	1.856	50	20	IDGD	
O=C(N[C@@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1)c1n[nH]cc1[N+](=O)[O-]	1823006485	BCOMJDMOPVWHLB-FWOIEVBISA-N	447.246	1.691	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2CCCCO2)CC1	1823819559	YACZMPGNOXVTFQ-SFTDATJTSA-N	428.338	1.169	50	20	IDGD	
C[C@](O)(CC(=O)O)CC(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCBr)CC2	1826069676	VGUCHJTWHIEAKG-JDNHERCYSA-N	448.339	1.456	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)C/N=C/c2ccco2)CC1	1828998425	CZFUUPDXTAAEBM-WEKPXBEKSA-N	445.564	1.691	50	20	IDGD	
O=C(c1c(Cl)cncc1Cl)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1829599136	OECKVCJGGDPRLH-XJKSGUPXSA-N	440.686	1.993	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H](C)N2CCN(C)CC2)CC1	1830244381	UHZDNFWJALHNQB-SXLOBPIMSA-N	443.032	1.496	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc4nccn34)C2)C1	1831654077	PYKPEEHDLZSFPA-IIBYNOLFSA-N	434.924	1.812	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)Cc3cccc(F)c3F)CC2)CC1)[C@@H](O)CCl	1833312373	RSEYVHTZQMCTNK-SFHVURJKSA-N	443.922	1.679	50	20	IDGD	
Cc1cc(C(=O)N2CCC(N3CCC(NC(=O)[C@H](O)CCl)CC3)CC2)cc(C)c1O	1833313091	VAZCANQUWRUGJS-LJQANCHMSA-N	437.968	1.794	50	20	IDGD	
Cc1nc(CC(=O)NC2CCN(C3CCN(C(=O)[C@](C)(Cl)CCl)CC3)CC2)no1	1833810316	AQHPLWDJWKSDME-LJQANCHMSA-N	446.379	1.728	50	20	IDGD	
C[C@H](Nc1cccnc1)C(=O)NC1CCN(C2CCN(C(=O)[C@H](F)Cl)CC2)CC1	1834719280	HTTXSIFRJWRZSM-KSSFIOAISA-N	425.936	1.988	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)Cn3nnc4ccccc43)CC2)CC1)[C@@H](F)Cl	1835079444	XPXCGDNTKRGKQN-LJQANCHMSA-N	436.919	1.537	50	20	IDGD	
CNC(=S)NCCC(=O)NC1CCN(C2CCN(C(=O)C(C)(C)CCl)CC2)CC1	1835737303	GKTIAXXMMPDIEC-UHFFFAOYSA-N	446.061	1.307	50	20	IDGD	
Cc1nc(N)sc1C(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1835801208	OGDJWAPUAQANDQ-GOSISDBHSA-N	430.958	1.369	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)c3cnn4cccnc34)CC2)CC1	1836396558	BGDWGLUHOQDFHT-GOSISDBHSA-N	432.956	1.932	50	20	IDGD	
CC(C)(C)n1ccc(C(=O)N2CCC(OC3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)n1	1836715403	SJXFZZYDHYEOLT-SFHVURJKSA-N	440.972	1.850	50	20	IDGD	
COc1nc(C)ccc1C(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836718672	YXCXTPBJDOIKHR-SFHVURJKSA-N	439.940	1.611	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C1(C(F)(F)F)CC1)CCO2	1836720874	WLBCUMJPVUTYIU-RISCZKNCSA-N	443.260	1.569	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)Nc1cnccn1)CCO2	1837477959	TZEHTRGTRSZGMI-GQIGUUNPSA-N	439.944	1.141	50	20	IDGD	
CC(C)(C)CC(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1	1837642362	HKTRRBKAJICSCG-UHFFFAOYSA-N	430.354	1.415	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3sc(N)nc3C)CC2)CC1	1837895786	VCKUMVUVPCZDFW-OAHLLOKOSA-N	444.985	1.900	50	20	IDGD	
CCc1nc(C(=O)N2CCC(OC3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)co1	1838485987	HJJIELMJYNLGAO-UHFFFAOYSA-N	449.552	1.222	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CC34CCCN3CCC4)C2)C1	1839147557	VBMIHNMIYYBEPW-UWJYYQICSA-N	427.973	1.479	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)COc3ccccc3F)C2)C1	1839148116	NDRGRCXPWYKAMQ-FOIQADDNSA-N	428.888	1.678	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C4CC4)on3)C2)C1	1839149692	OIVGLBXFMHLAOG-RTBURBONSA-N	446.331	1.858	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)c3ccccc3)C2)C1	1839152346	WUPWJQYPBJMBKE-LSTHTHJFSA-N	445.343	1.413	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)CCBr)C3)C2)ccc1O	1839307357	IDKQGKSTVDUEPB-IBGZPJMESA-N	441.322	1.556	50	20	IDGD	
COc1cc(C)cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)c1	1840189517	WEZGWSGVXMWJON-IBGZPJMESA-N	431.316	1.877	50	20	IDGD	
Cc1nccn1CCCC(=O)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840190704	JAGCAINGDXNEEA-SFHVURJKSA-N	433.336	1.232	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2scnc2C2CC2)C1	1842306714	QLGZQSWNNYFYND-ZMOGYAJESA-N	440.529	1.972	50	20	IDGD	
COC(=O)CCC(=O)N1CCCC12CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2	1842649541	WRSAAPXSWITGAP-UHFFFAOYSA-N	433.417	1.290	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC2(CCCN2C(=O)c2cc3n(n2)CCCN(C)C3)C1	1845727618	VZYITWZPVXJEIN-HNNXBMFYSA-N	438.370	1.709	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC12CN(C(=O)c1ccc(CS(C)(=O)=O)nc1)C2	1846176353	DRGFVJYBCBXROG-GFCCVEGCSA-N	444.351	1.227	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)c2ccc(OCC3CC3)c(F)c2)C1	1846911393	UTEXZYGWVZIRLS-UHFFFAOYSA-N	446.523	1.805	50	20	IDGD	
O=C(NNC(=O)c1cc2ccccc2[nH]c1=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	12616255	WLEJUMMNJQUCPZ-UHFFFAOYSA-N	440.481	1.387	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c(OC)c1OC	15315070	XTTSVYPAGQGIHG-UHFFFAOYSA-N	442.516	1.686	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)s1)c1cccc(S(=O)(=O)N2CCOCC2)c1	15525027	WDEPWFNSAYWISH-UHFFFAOYSA-N	429.907	1.497	50	20	IDGD	
CS(=O)(=O)CC[C@H](NC(=O)c1ccc(Cl)cc1)C(=O)NNC(=O)c1ccccc1	24332441	KVIJPVNQWBBFJH-INIZCTEOSA-N	437.905	1.334	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN1S(=O)(=O)c1cccs1)c1ccc2ccccc2n1	109910299	WOMFQLVKRHUUAE-MRXNPFEDSA-N	430.511	1.911	50	20	IDGD	
CCN1CCN(CCC(=O)NNC(=O)[C@@H]2Cc3ccccc3CN2Cc2ccccc2)CC1	725894968	PUHWTWNGDAULFF-DEOSSOPVSA-N	449.599	1.789	50	20	IDGD	
COc1ccnc(NNC(=O)C(C)(C)S(=O)(=O)c2ccc(Br)cc2)n1	726159205	XKNMXWAHJLEHPA-UHFFFAOYSA-N	429.296	1.943	50	20	IDGD	
C[C@@]1(c2ccc(CNC(=O)NNC(=O)C34CC5CC(CC(C5)C3)C4)cc2)NC(=O)NC1=O	726281596	AEPFDRLILADGAL-WPLPQICOSA-N	439.516	1.788	50	20	IDGD	
CCOC(=O)C1=NN(c2ccccc2)[C@@H](C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)C1	727752138	IDXZXZJUNFZGGS-QGZVFWFLSA-N	425.401	1.554	50	20	IDGD	
CN1CCN(C[C@H](NC(=O)NNC(=O)c2cc(Br)c[nH]2)c2ccccc2)CC1	727841088	PAQOPNRRMYZCNK-KRWDZBQOSA-N	449.353	1.710	50	20	IDGD	
CC/C=C(/C)C(=O)N1CSC[C@@H]1C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	727986744	DHWGKIRIGZBGMU-NYXMJBRJSA-N	425.532	1.109	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCCCC2)cc1C(=O)N([C@H]1CCS(=O)(=O)C1)N(C)C	728176395	OEGXJQIRKUNJIJ-INIZCTEOSA-N	443.591	1.276	50	20	IDGD	
CC(=O)c1cccc(OCC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)c1	728212746	BYOWNYVFEBMCJY-UHFFFAOYSA-N	446.529	1.347	50	20	IDGD	
CCSc1ccc(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)cn1	728214844	VTRHXMISTMGSCG-UHFFFAOYSA-N	435.575	1.887	50	20	IDGD	
CCc1noc2ncc(C(=O)NNc3ccc(S(=O)(=O)N4CCN(C)CC4)cc3)cc12	728215610	HVCCQRMEIGUUCW-UHFFFAOYSA-N	444.517	1.478	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)Cc3cccnc3)CC2)cc1C	728851294	XAWLFINNPNQAQN-UHFFFAOYSA-N	430.530	1.489	50	20	IDGD	
O=C(NCc1ccccc1Cn1cccn1)NNC(=O)C1CCN(c2ncccn2)CC1	728944543	FOMFUSPWKUUFBO-UHFFFAOYSA-N	434.504	1.468	50	20	IDGD	
O=C(NCc1ccnc(N2CCCCC2)c1)NNC(=O)C1CCN(c2ncccn2)CC1	728945884	OBJLXEZUQRWTMQ-UHFFFAOYSA-N	438.536	1.609	50	20	IDGD	
CNC(=O)CCN(C)C(=O)/C(C#N)=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	729368914	PZJUNXWSYNKEOO-PTNGSMBKSA-N	442.907	1.580	50	20	IDGD	
Cc1ccc(Cn2nc(C)c(CCC(=O)NNC(=O)N[C@H]3CCS(=O)(=O)C3)c2C)cc1	730212663	HVCGTDGGSNAROF-SFHVURJKSA-N	447.561	1.307	50	20	IDGD	
CCN(CC)c1ccc(CNC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1F	731404350	KJINAKHAIKSGRL-UHFFFAOYSA-N	426.456	1.792	50	20	IDGD	
COC(=O)c1sc2ccccc2c1S(=O)(=O)NNC(=O)[C@H]1COc2ccccc2O1	731595637	XITWFNJUUUARSO-CQSZACIVSA-N	448.478	1.837	50	20	IDGD	
O=C(Cn1cnc2ccccc21)NNC(=O)c1ccc(N2CCCS2(=O)=O)cc1Cl	736066945	ZXYYBMOIINTXON-UHFFFAOYSA-N	447.904	1.691	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)CN2CCN(c3ccccn3)CC2)cc1	740748890	CDPBMKILWFCTJN-KRWDZBQOSA-N	427.505	1.217	50	20	IDGD	
CC(C)c1nn([C@@H]2CCS(=O)(=O)C2)cc1C(=O)NNC(=O)NCCc1cccs1	742584273	XUKRQHVNJZJKMK-CYBMUJFWSA-N	439.563	1.614	50	20	IDGD	
N=C1NC(=O)[C@@H](CC(=O)NNC(=O)[C@H]2Cc3ccccc3CN2Cc2ccccc2)S1	742600153	SSPZRFKPKSLWDO-QZTJIDSGSA-N	437.525	1.317	50	20	IDGD	
O=C(CN1C(=O)COc2ccc([N+](=O)[O-])cc21)NNC(=O)c1cccc(Br)c1	742769698	QLVQOOSIXMZMNT-UHFFFAOYSA-N	449.217	1.544	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)CN2C(=O)Cn3c(cc4ccccc43)C2=O)c1	743845366	LAOJMRYMRHVYKF-UHFFFAOYSA-N	436.424	1.102	50	20	IDGD	
O=C(NNC(=O)[C@@H](O)c1ccccc1)c1cccc(S(=O)(=O)NCc2ccccc2)c1	746093088	KJDZIMUVZPVFCQ-FQEVSTJZSA-N	439.493	1.660	50	20	IDGD	
O=C(CCc1ccco1)NNC(=O)c1ccnc(C(=O)NNC(=O)CCc2ccco2)c1	746185565	KLRHBDCMMMXAKM-UHFFFAOYSA-N	439.428	1.055	50	20	IDGD	
CN1CCN(CCCNC(=O)NNC(=O)Cc2cn3ccccc3n2)[C@@H](c2ccccc2)C1	746750098	KQHWOVWRGKRHFA-OAQYLSRUSA-N	449.559	1.586	50	20	IDGD	
CS(=O)(=O)CC[C@H](NS(=O)(=O)c1ccccc1)C(=O)NNc1ccccc1F	748055849	SCGPPLNNEGSNOW-INIZCTEOSA-N	429.495	1.051	50	20	IDGD	
Cc1cc(NNC(=O)CCN2CCN(C(=O)[C@@H]3CCCO3)CC2)ccc1Br	748607942	XJBUNZUTJCRRNO-KRWDZBQOSA-N	439.354	1.914	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)N[C@@H](c1ccccc1)c1cccc(S(C)(=O)=O)c1	748636066	IRJGDBOEFPCBNP-BEFAXECRSA-N	449.529	1.561	50	20	IDGD	
NS(=O)(=O)c1cccc(N2C[C@@H](C(=O)NNc3ccc(Cl)c(F)c3)CC2=O)c1	748899082	TYGVYBYZYOYXJI-JTQLQIEISA-N	426.857	1.623	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc(Br)cc1)NNC(=O)CC1CCCC1	749952179	ZFYIBEQOFFTJKD-UHFFFAOYSA-N	432.340	1.845	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)N[C@@H]1CCN(CCCc2ccccc2)C1=O	750662605	XSXOUQCYGZYGPW-GOSISDBHSA-N	448.483	1.513	50	20	IDGD	
CCOC(=O)c1ccc(N2CC(NC(=O)NNC(=O)c3ccc(OC)c(OC)c3)C2)nc1	753278825	IAODXHIKYUDEAG-UHFFFAOYSA-N	443.460	1.108	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NCC2(NC(=O)OC(C)(C)C)CCC2)c2ccccc2c1=O	753332291	NSHPAUCDBSPEPQ-UHFFFAOYSA-N	444.492	1.325	50	20	IDGD	
COc1cc(Br)ccc1CCCNC(=O)NN[C@]1(C)CCS(=O)(=O)C1	753386360	UBOQMDDVDZAZHK-MRXNPFEDSA-N	434.356	1.771	50	20	IDGD	
O=C(CN1CCOC[C@H]1C[C@@H](O)c1cccs1)NNC(=O)c1ccc([N+](=O)[O-])cc1	753860779	ANMHQEWCJRBGAD-HZPDHXFCSA-N	434.474	1.242	50	20	IDGD	
Cc1oc(S(N)(=O)=O)cc1C(=O)OCC(=O)NN=C(c1ccccc1)c1ccccc1	754155550	UBVFYQBEEKHXDC-UHFFFAOYSA-N	441.465	1.961	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1NC(C)=O	755624867	YWVCISFEHIQVIL-UHFFFAOYSA-N	427.465	1.513	50	20	IDGD	
COC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2ccccc2F)c1Br	756165554	ZDSHBHUGUHGXRS-UHFFFAOYSA-N	438.209	1.775	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)N[C@@H]2CCN(c3ccccc3OC)C2=O)cc1OC	757296520	SSGIMOBJYNWPAK-OAHLLOKOSA-N	442.472	1.852	50	20	IDGD	
COc1ncncc1NC(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	757689746	IUDNCOICKDBKKW-UHFFFAOYSA-N	445.439	1.710	50	20	IDGD	
Cc1ccc(CNC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c(O[C@@H]2CCOC2)c1	758834807	RXEXXXQPIFHRAG-GOSISDBHSA-N	437.460	1.283	50	20	IDGD	
CCOC(=O)c1cc(S(=O)(=O)NNC(=O)c2ccc(F)cc2Br)cn1C	760511495	XUVHCCPGYYJDIY-UHFFFAOYSA-N	448.270	1.727	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)NC[C@@]1(N2CCOCC2)CCSC1	761661434	LHJXRFHEQJCMEL-IBGZPJMESA-N	440.591	1.326	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NN/C=C1\C(=O)N(c2ccccn2)C(=O)c2ccccc21	763107663	LEPAKIHGDBYLNC-AQTBWJFISA-N	442.435	1.055	50	20	IDGD	
Cc1cscc1NC(=O)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	763507778	DPBDRNIGHYDPQO-UHFFFAOYSA-N	436.515	1.241	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)Nc1cccc(N2CCCCCC2)c1	763570782	FZBOFGBSSRXOGJ-HXUWFJFHSA-N	438.484	1.993	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(-c3nnnn3C(C)C)c(F)c2)c(C)o1	763582445	HQOWRAQUHSOXRA-UHFFFAOYSA-N	429.412	1.670	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cc3sc(C)nc3cc2OC)cc1	763661892	QMLYNTIBXSZZGZ-UHFFFAOYSA-N	444.469	1.787	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2nnc(O)c3ccccc23)ccc1Br	763789761	AYHYWHJSSOUCDJ-UHFFFAOYSA-N	444.245	1.806	50	20	IDGD	
C[C@H](NC(=O)c1cccc(Cl)c1Cl)C(=O)NNC(=O)CNC(=O)c1cccnc1	763818739	OFLSVUISQXKDAI-JTQLQIEISA-N	438.271	1.084	50	20	IDGD	
Cc1cc(N2CCOCC2)ccc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccccc1F	763850640	PFJCEWUPXVRKCE-HNNXBMFYSA-N	444.463	1.524	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)Nc1cccc(N2CCCS2(=O)=O)c1	763926447	QFEOSIHQYRNTRL-UHFFFAOYSA-N	436.515	1.877	50	20	IDGD	
CN(C)C(=O)COc1cccc(NC(=O)C(=O)NNC(=O)Cc2cccc3ccccc23)c1	764020090	UKJMMPAFOGMVET-UHFFFAOYSA-N	448.479	1.635	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc(S(=O)(=O)N(C)C(C)C)cc1	764049233	WTGOLTMFCKSXOZ-UHFFFAOYSA-N	448.501	1.124	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc([S@@](C)=O)c(F)c2)o1	764139126	OQARHNVWEATKKQ-SSEXGKCCSA-N	438.481	1.398	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cnn(-c3ccncc3)c2)o1	764139163	PEDNACQNSQZCDI-UHFFFAOYSA-N	425.449	1.102	50	20	IDGD	
CC(C)[C@@H]1CC[C@@H](C)C[C@H]1OC(=O)c1ccccc1NC(=O)C(=O)NNC(=O)CN(C)C	764204222	PDNVZOYZJCXNOJ-JTDSTZFVSA-N	446.548	1.952	50	20	IDGD	
CCOC(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c1	764343192	OZSFGHCWXNJSAC-UHFFFAOYSA-N	435.440	1.378	50	20	IDGD	
O=C(NNC(=O)C(F)(F)Oc1ccccc1)C(=O)Nc1ccc(Cn2cncn2)cc1	764380352	XFTZGIZWQVRDMW-UHFFFAOYSA-N	430.371	1.084	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1ccc(F)c(NC(C)=O)c1	764398579	UMKSSSBMPWWTIG-UHFFFAOYSA-N	434.449	1.671	50	20	IDGD	
COc1nccnc1NNC(=O)CCCN1C(=O)c2ccc(Br)cc2C1=O	764469787	NFVQCXMTXYBLFR-UHFFFAOYSA-N	434.250	1.767	50	20	IDGD	
Cn1nnc2cc(C=NNC(=O)CN3CCN(Cc4ccc(Cl)cc4)CC3)ccc21	764832351	YEPOYYKNVZKPRO-UHFFFAOYSA-N	425.924	1.890	50	20	IDGD	
C[C@@H](CC(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1)C1CCN(C(=O)OC(C)(C)C)CC1	765071247	SBQLDRJAYAUFRK-DZGCQCFKSA-N	446.570	1.177	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)c3cccc(CN4C(=O)CNC4=O)c3)n[nH]2)cc1	765571651	MUWQITYHKINMBG-UHFFFAOYSA-N	446.467	1.766	50	20	IDGD	
CON(C)C(=O)[C@H](CCSC)NC(=O)NNC(=O)c1cccc(Br)c1	765808938	YPXWDTWNSHFDKW-LBPRGKRZSA-N	433.328	1.535	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NCCc2nc3c(s2)CCCC3)c2ccccc2c1=O	766265805	BOOXLGKZRNUFPX-UHFFFAOYSA-N	426.502	1.456	50	20	IDGD	
CN1CCO[C@H]([C@H](NC(=O)NN[C@]2(C)CCS(=O)(=O)C2)c2ccc(Cl)cc2)C1	766319478	LVDVNCZDFSOVHJ-LZLYRXPVSA-N	430.958	1.093	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@@H](C)NC(=O)OC(C)(C)C)CC2)cc1	766643476	WYUNSCHYMBCZGW-QGZVFWFLSA-N	433.553	1.173	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1ccc(-c2cnco2)cc1	766647842	WITJKKGCCZEIBF-UHFFFAOYSA-N	433.468	1.561	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)Cn2nnc(-c3ccccc3)n2)C1	767950716	ZKCNEFWZTXEABR-HNNXBMFYSA-N	429.481	1.135	50	20	IDGD	
O=C(NNC(=S)Nc1ccccn1)c1ccc(N2CCCS2(=O)=O)cc1Cl	768577282	CJPDIKVNQNPJIS-UHFFFAOYSA-N	425.923	1.906	50	20	IDGD	
CSCCNC(=S)NNC(=O)c1cccc(S(=O)(=O)NCc2cccs2)c1	769766182	QTAIMFDZYJUAFI-UHFFFAOYSA-N	444.629	1.699	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1ccc2nc(C(F)(F)F)cn2c1	769924204	QMVFUGLXMMKCPS-UHFFFAOYSA-N	433.394	1.821	50	20	IDGD	
COCCNS(=O)(=O)c1c[nH]c(C(=O)NNc2ccc(Br)c(F)c2)c1	771681594	CNYKJAOIXHIIPR-UHFFFAOYSA-N	435.275	1.598	50	20	IDGD	
C[C@@H]1CN(C(=O)OC(C)(C)C)[C@H](C)CN1C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	771905182	MWYZDEZNBHFBOM-ZIAGYGMSSA-N	444.496	1.346	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)CCNC(=O)NC12CC3CC(CC(C3)C1)C2	771941541	TVIQPNCVVWTPKF-XSXQVXRUSA-N	436.553	1.770	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)C[C@H](NC(=O)c1ccc(O)cc1)c1ccccc1	772001127	AVKYCLVYCVOVBZ-KSSFIOAISA-N	427.457	1.743	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)c1cc(N2CCCC2=O)ccc1F	772194968	FTYLNKZFJSXMFR-UHFFFAOYSA-N	432.839	1.683	50	20	IDGD	
C[C@H](C(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1)c1ccc(S(C)(=O)=O)cc1	772196224	HTBFDGXRMIRTMA-LBPRGKRZSA-N	437.905	1.311	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2F)ncc1Br	773525173	LKZPJXGOAFPJHU-UHFFFAOYSA-N	425.214	1.457	50	20	IDGD	
O=C(NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)Nc1ccnn1CC1CC1	776034902	CYZQJHYSPLHOPA-UHFFFAOYSA-N	432.506	1.544	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2c(C)nn(C)c2-n2cccn2)c2ccccc2c1=O	777413818	NJUAWLWNRYVGCV-UHFFFAOYSA-N	434.460	1.109	50	20	IDGD	
O=C(Cc1cc2ccccc2nc1O)N1CCN(S(=O)(=O)CBr)CC1	777777618	NLDADKWOZFBILY-UHFFFAOYSA-N	428.308	1.309	50	20	IDGD	
COc1ccc(N2CCN(C(=O)/C=C\C(=O)NNC(=O)NCc3ccco3)CC2)cc1	778248070	ZUIPIRLLTFMTGO-HJWRWDBZSA-N	427.461	1.024	50	20	IDGD	
CCOc1ccccc1C(=O)N1CCC[C@@H]1C(=O)NNC(=O)CNC(=O)OC(C)(C)C	778437062	UBAMLTQLVOBZCJ-OAHLLOKOSA-N	434.493	1.362	50	20	IDGD	
CCCNC(=O)NNC(=O)c1cc(I)ccc1N1CCOCC1	778599079	QVBNMSHIQMRZFH-UHFFFAOYSA-N	432.262	1.482	50	20	IDGD	
COc1ccc(-n2cc(O)c(C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)n2)cc1	779522102	RFRAGAVHJJUPRM-UHFFFAOYSA-N	434.453	1.055	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)F)cc1)[C@@H](O)[C@H](O)c1nc2ccccc2s1	779535993	GOENUZZAZWXKDM-KBPBESRZSA-N	443.453	1.830	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)[C@H]2CC(=O)N(c3cc(OC)c(OC)c(OC)c3)C2)c1	780792355	VBGQBSFWMLEJTQ-AWEZNQCLSA-N	443.456	1.995	50	20	IDGD	
CC(C)S(=O)(=O)c1ccc(CC(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)cc1	781305708	DHEHYTZMDVIKLI-UHFFFAOYSA-N	443.481	1.287	50	20	IDGD	
CS(=O)(=O)CC[C@H](NC(=O)c1ccc(Cl)cc1)C(=O)NNc1ccnc(F)c1	781363860	OJPHUWRXJNJEFA-AWEZNQCLSA-N	428.873	1.551	50	20	IDGD	
CC1(C)CC[C@@H](C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)C1	781558917	BIAZTEOXVRAIQF-QGZVFWFLSA-N	437.562	1.614	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2ccc(C)c(NC(=O)CN3CCCCC3)c2)nc1	782143507	ZIEURROZZBLGOT-UHFFFAOYSA-N	440.504	1.905	50	20	IDGD	
O=C(NNc1ccc(-n2cccn2)nn1)C(=O)Nc1ccc(C(=O)NC2CCCC2)cc1	783435964	DTGMASBJMZFGLY-UHFFFAOYSA-N	434.460	1.417	50	20	IDGD	
O=C(NNc1ccnc(Br)c1)C(=O)Nc1cccc(C(=O)N2CCOCC2)c1	784828987	UHRYZJYPEGYXBW-UHFFFAOYSA-N	448.277	1.398	50	20	IDGD	
O=C(NNc1cc(F)c(F)cc1F)C(=O)Nc1ccc(N2CCCS2(=O)=O)cc1	784886886	VETATHQCYCCDRI-UHFFFAOYSA-N	428.392	1.726	50	20	IDGD	
CCS(=O)(=O)CCn1cc(C)c(NC(=O)NNc2ccnc(Br)c2)n1	786713907	SMSIDIWPNKJJCM-UHFFFAOYSA-N	431.316	1.932	50	20	IDGD	
O=C(NCc1ccccc1)NNC(=O)c1ccc(F)c(S(=O)(=O)Cc2ncon2)c1	787597890	ZKESJCCPMCNCIC-UHFFFAOYSA-N	433.421	1.327	50	20	IDGD	
CC(=O)N1CCc2cc(NC(=O)C(=O)NNC(=O)[C@H]3OCC[C@H]3c3ccccc3)ccc21	789810251	LTUNOXIREUQEAI-ICSRJNTNSA-N	436.468	1.254	50	20	IDGD	
COC(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)cc1	789812277	JVOMGFIIDLCTMC-HKUYNNGSSA-N	425.441	1.061	50	20	IDGD	
CC(C)CC(=O)NNC(=O)C(=O)Nc1cc(Br)cc(C(=O)N2CCCC2)c1	790951154	DKCCJOSGQUCLHS-UHFFFAOYSA-N	439.310	1.817	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCc1ccc2ncccc2c1	792328782	UEUQEGOXAKHESX-UHFFFAOYSA-N	426.502	1.981	50	20	IDGD	
CCOC(=O)c1cnn(-c2cccc(NC(=O)C(=O)NNc3nc4ccccn4n3)c2)c1C	792393101	CJSZUUVDTDMBCV-UHFFFAOYSA-N	448.443	1.482	50	20	IDGD	
CCCNS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccc3c(=O)[nH]ccc3c2)cc1	793071050	XAKQYSKXRDLVTK-UHFFFAOYSA-N	443.485	1.298	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)N2CCN(S(=O)(=O)c3ccc(C(C)C)cc3)CC2)n1	793227353	RTSSFSJNRRXBPS-UHFFFAOYSA-N	445.545	1.874	50	20	IDGD	
CCn1nc(C)c(CC(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)c1C	794392950	LCYBWLXRDKQUMQ-UHFFFAOYSA-N	446.983	1.681	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CC[C@@H](Oc2ccc(C#N)cn2)C1	794833749	RDFXGBWSYSQPEZ-OAHLLOKOSA-N	429.864	1.530	50	20	IDGD	
Cc1ccc2c(c1)CC[C@@H](C(=O)OCC(=O)NNC(=O)[C@@H]1COc3ccccc3O1)O2	796298654	JSMFYXFSESVWQD-OALUTQOASA-N	426.425	1.219	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(Cl)cc2C(=O)N2CCCC2)n1	797370453	DFVLCGRXBIBKKP-UHFFFAOYSA-N	429.864	1.679	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)N[C@@H]1CCN(C(=O)Nc2ccccc2)C1	801077889	OQZFQKMMGXEMIP-CRAIPNDOSA-N	425.445	1.463	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)Cn2c(S)nnc2-c2ccc(Cl)cc2)cc1	801111192	MPGOIPMQOOXNPH-UHFFFAOYSA-N	444.904	1.982	50	20	IDGD	
COCN1C(=O)CCc2cc(NC(=O)NNC(=O)c3nnc(O)c4ccccc34)ccc21	801786921	ACKGOSXJEBDITI-UHFFFAOYSA-N	436.428	1.685	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)CCNC(=O)[C@@H]2CCCN2C(=O)OC(C)(C)C)cc1	802059380	ZIQAYESUWPAKOG-INIZCTEOSA-N	449.508	1.754	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)[C@@H](NS(C)(=O)=O)C(C)(C)C)cc1Cl	802075187	LXNUNZKMJBFXGB-CYBMUJFWSA-N	436.918	1.474	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)[C@@H]2CCCN2C(=O)c2ccc3c(c2)OCO3)cc1	802118575	GHXJIDCFJFJOLJ-KRWDZBQOSA-N	439.472	1.939	50	20	IDGD	
CCCN(NC(=O)c1ccc(S(=O)(=O)N2CCNC(=O)C2)cc1)C(=O)OC(C)(C)C	804592619	DQMOJZALEVDUOD-UHFFFAOYSA-N	440.522	1.099	50	20	IDGD	
CN1CCN(C(=O)NNC(=O)c2cnn(-c3ncccc3Cl)c2C(F)(F)F)CC1	807383527	YXRQSPNULSLOSG-UHFFFAOYSA-N	431.806	1.541	50	20	IDGD	
CC(C)CCC(=O)NNC(=O)CNS(=O)(=O)c1ccc(NC(C)C)c([N+](=O)[O-])c1	810332964	JSVRYMULVGVCTK-UHFFFAOYSA-N	429.499	1.277	50	20	IDGD	
CCc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NNC(=O)CN1CCCc2ccccc21	810385226	OUQHQYNGNOSPNM-UHFFFAOYSA-N	425.445	1.696	50	20	IDGD	
NC(=O)c1ccc(OCC(F)F)c(NC(=O)C(=O)NNC(=O)CCc2ccccc2)c1	810386827	SZHLVZSXTNYGPI-UHFFFAOYSA-N	434.399	1.148	50	20	IDGD	
Cn1nncc1COC(=O)/C(C#N)=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	811031532	SDDHHFORYKKXEN-ZSOIEALJSA-N	439.863	1.858	50	20	IDGD	
CN(C)c1ncc(C=NNC(=O)c2ccc(NN=Cc3cnc(N(C)C)n3C)cc2)n1C	811631088	KNBYUFYKZBGVAO-UHFFFAOYSA-N	436.524	1.496	50	20	IDGD	
CCc1ccccc1OCC(=O)NNS(=O)(=O)CCCN1C(=O)c2ccccc2C1=O	811676914	MBRJGRVZRAPADJ-UHFFFAOYSA-N	445.497	1.265	50	20	IDGD	
O=C(CN1C(=O)[C@H]2CC=CC[C@H]2C1=O)NNC(=O)c1ccc(Br)cc1Cl	815399241	ONCKXRNYXDEHBZ-PHIMTYICSA-N	440.681	1.815	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)cc2cccnc12	815656652	BVTBMFCTHGPEJW-UHFFFAOYSA-N	443.485	1.576	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)Cc2ccc(S(=O)(=O)N3CCCCC3)cc2)c1	904222354	UUXACJURSAAQPO-UHFFFAOYSA-N	444.557	1.931	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc2ccccc2c1)NNC(=O)c1ccc2c(c1)OCO2	913415701	PVGGQKBDNQGSJY-UHFFFAOYSA-N	427.438	1.308	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)NCc1ccc2c(c1)OCCO2	915894051	AXRXQOHAUMZPIF-UHFFFAOYSA-N	439.516	1.501	50	20	IDGD	
CC(C)NC(=O)C(=O)NNC(=O)c1ccc(NC(=O)c2ccc(Br)o2)cc1	916161954	XQFKITADOMIUKL-UHFFFAOYSA-N	437.250	1.580	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N[C@@H](C(N)=O)c1ccccc1	916233427	XHTNFNJFSLCEHQ-XHDPSFHLSA-N	435.278	1.773	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)NC1CCN(C2CC2)CC1	916240184	VXIQZVBUQYCRAN-UHFFFAOYSA-N	449.577	1.432	50	20	IDGD	
CC(=NNC(=O)c1cccnc1)c1ccc(S(=O)(=O)N2CCC(C(=O)O)CC2)cc1	916252640	COPJXONEZBKAQJ-UHFFFAOYSA-N	430.486	1.721	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)NCCCN2C(=O)NC3(CCCCC3)C2=O)c1	916268765	OENBDTQZSAMURJ-UHFFFAOYSA-N	445.520	1.657	50	20	IDGD	
Cc1nn([C@H]2CCS(=O)(=O)C2)c(Cl)c1C=NNC(=O)[C@H]1COc2ccccc2O1	916292273	VBXWHWGGKBKARC-BLLLJJGKSA-N	438.893	1.495	50	20	IDGD	
CC(=NNC(=O)COc1cc(C)ccc1C)c1ccc(S(=O)(=O)NCC(=O)O)cc1	916298140	XBHAADXORBQWGY-UHFFFAOYSA-N	433.486	1.586	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NCCNS(=O)(=O)Cc2ccccc2)cc1C	916517219	ZGUHKIMIHHKIHM-UHFFFAOYSA-N	434.518	1.132	50	20	IDGD	
CCCNC(=O)CN1CCC(NC(=O)NNC(=O)c2cc3c(s2)CCCCC3)CC1	916518672	DGKQDYPIBAEFOM-UHFFFAOYSA-N	435.594	1.952	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCCc2ccc(Cl)s2)cc1	916647468	FPWPUFYXWFUSAO-UHFFFAOYSA-N	444.966	1.904	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(C(=O)NNc2ccc(Cl)cc2[N+](=O)[O-])cc1	917214261	NBTBJDZLQSLMIK-UHFFFAOYSA-N	428.854	1.930	50	20	IDGD	
COc1ccc(CNC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)c(OC)c1OC	918015174	VUCULWLGYKRKQG-UHFFFAOYSA-N	441.444	1.748	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCOC2CCCC2)c1	918084752	IIKAZSFDNCIYFJ-UHFFFAOYSA-N	426.539	1.620	50	20	IDGD	
CNC(=O)COc1cccc(CNC(=O)NNC(=O)c2ccc(Br)s2)c1	918095616	DYIWVAKOHRIZFN-UHFFFAOYSA-N	441.307	1.780	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1O)c1ccc2c(c1)C(=O)N(C[C@H]1CCCO1)C2=O	918357432	FJXIXJNBMWWZFK-CYBMUJFWSA-N	443.843	1.895	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)Cc2csc(NC(=O)c3ccco3)n2)cc1	919656980	LYMMIDXCLDYBFX-UHFFFAOYSA-N	425.426	1.629	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccccc1Cl)NNC(=O)NCCc1cccs1	920888941	FBBDGFMKBPVJFM-UHFFFAOYSA-N	430.939	1.643	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)[C@H](c2ccccc2)n2cccn2)cc1OC	920910313	VYQGYRMAPDYLFU-FQEVSTJZSA-N	438.440	1.494	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)NC1CCN(c2cccc(F)c2)CC1	1252024522	FHGDVOIUZVNYEQ-UHFFFAOYSA-N	441.511	1.832	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2nn(C)c3c2CCC3)C1	1778674628	DNUBHIHWJWSLJB-QLVMHMETSA-N	438.956	1.290	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C=C\C(=O)NC2CC2)C1	1779229544	AEXDDHLXYKTXEC-UXTXJKSZSA-N	437.613	1.187	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)Cc1ccccc1)C2	1779546398	USGGCGDTHSYTJW-TXTKFYIRSA-N	448.636	1.955	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(-n4cccn4)nc3)C2)C1	1779690612	BPBLAIKJHJXCKV-KUHUBIRLSA-N	448.321	1.494	50	20	IDGD	
CC(C)n1ccc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)n1	1780376886	IJRLMOZZXUUBCI-KDOFPFPSSA-N	427.343	1.939	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H]2CCCCN2C)C1	1780595213	XMGHSIRXWDQDBB-YKTARERQSA-N	430.387	1.768	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCSC(=N)N)C2	1780713566	YMTGJVREMZILPR-CSMYWGQOSA-N	439.409	1.753	50	20	IDGD	
Cc1nccn1[C@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Br)C1	1780777299	QNSYWHIBQGXUKZ-LJGDNWOOSA-N	445.333	1.957	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H]3CC[C@H]4CCC(=O)N4C3)C2)C1	1781050313	HUZPPFRARWWHGI-XFQAVAEZSA-N	425.957	1.482	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cc(OC)c(O)cc3[N+](=O)[O-])CCO2)C1	1781216920	CFWGXTSCXKJQMW-ORAYPTAESA-N	441.868	1.770	50	20	IDGD	
Cc1ccc(CCC(=O)N2CCO[C@]3(CCN(C(=O)[C@H](F)Br)C3)C2)nc1	1781325733	IDZQNKYMIFYQEO-FUHWJXTLSA-N	428.302	1.843	50	20	IDGD	
O=C(c1cccc2nccn12)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781332179	DRRHKHXCCGVSAI-PBHICJAKSA-N	425.258	1.468	50	20	IDGD	
Cc1cnc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](C)Br)C2)cn1	1781996612	ONGDSLXZUWKFLQ-JCKWVBRZSA-N	425.327	1.696	50	20	IDGD	
CC(=O)c1cc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](C)Br)C2)n[nH]1	1781996656	PMVUWNZHQYTUOT-BKGUAONASA-N	441.326	1.523	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)ncn1)C2	1781997278	OJRPWSRBYSLTOQ-CJBNDPTMSA-N	427.299	1.093	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C/N=C/c1ccco1)C2	1782175050	BDCYRAPYASYACX-XDGMJCQUSA-N	425.913	1.466	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)Cc1ccccc1)C2	1782178589	BHUFFJOITROGKJ-JPAWQOSXSA-N	438.952	1.358	50	20	IDGD	
CCCCC[C@H](C)C(=O)N1CC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1	1783223264	CKWYORJDNDHKMZ-AOMKIAJQSA-N	431.537	1.345	50	20	IDGD	
C[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CC[C@]2(CN(C(=O)[C@@H](F)Cl)CCO2)C1	1783508690	CKGKNFPXTDAYCS-AKCHCHLHSA-N	441.887	1.666	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccc4cnccc4n3)CCO2)C1	1783534801	OYXNZHBKBAEIPK-ORAYPTAESA-N	433.306	1.857	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)n3ccnc3)[C@H]2C1	1784258114	SZJZRDBPOPOTJZ-QXKUPLGCSA-N	427.343	1.597	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H]2C[C@H]2C[C@@H]1C(=O)N1CC[C@@]2(CN(C(=O)[C@@H](F)Cl)CCO2)C1	1785591416	GFSKOOVBZPFDGC-OFCPVLAQSA-N	445.919	1.749	50	20	IDGD	
CC[C@@H](NC(C)=O)C(=O)Nc1ccc(C2(NC(=O)CCC(=O)NN(C)C)CCC2)cc1	1785869364	ZMOUYRNGLFZCGP-GOSISDBHSA-N	431.537	1.408	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nc4ccccn4n3)C[C@@H]21	1786406112	RMRVMIBAYKYKPH-IHRRRGAJSA-N	436.310	1.108	50	20	IDGD	
Nc1ccccc1/C=C/C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21	1786907153	SEEKJGYSNJBMOU-JRWYWPFWSA-N	440.313	1.952	50	20	IDGD	
CCOC(=O)N[C@@H](O)C(=O)Nc1ccc(C2(NC(=O)[C@H](Cl)COC)CCC2)cc1	1789408500	HYEXHLINERQWFC-PBHICJAKSA-N	427.885	1.439	50	20	IDGD	
C[C@@H](NC(=O)c1ccc(F)cc1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21	1789695218	WARJPPOOXBVEJT-DIMBHLCBSA-N	443.878	1.458	50	20	IDGD	
C[C@@H](Cn1cncn1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]2C1	1789870535	MHGDDXHGJSUHNV-PQKJENKHSA-N	432.352	1.130	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(OC)nc3)C[C@@H]21	1790958088	HFPVIMGHRLXQNC-VGWMRTNUSA-N	440.338	1.857	50	20	IDGD	
O=C(NC1(c2ccc(NC(=O)[C@H]3[C@H]4SC=C[C@H]43)cc2)CCC1)c1cccc(B(O)O)c1	1791086581	BXOYUXQOQCBVIL-ZCNNSNEGSA-N	434.326	1.989	50	20	IDGD	
CN(CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]2C1)C(=O)c1ccccc1	1791292717	MDDSCRUQYONMMP-JYJNAYRXSA-N	442.343	1.542	50	20	IDGD	
C[C@H](Br)C(=O)Nc1ccc(C2(NC(=O)CNCP(=O)(O)O)CCC2)cc1	1791434305	QKGWPBBEKTYCOF-NSHDSACASA-N	448.254	1.629	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C[C@H](N)c1cccnc1)C2	1792868008	QCZZMRORPBLCPX-BHOIQGAFSA-N	439.354	1.092	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1n[nH]c3ccccc13)C2	1792870708	IYIFHWYMHXXLNJ-JFILPPLUSA-N	435.322	1.797	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(-c3cccnc3)cc1)C2)[C@@H](O)CCl	1792979674	AXEQHGFQMCHLFT-YRPNKDGESA-N	429.904	1.552	50	20	IDGD	
CCOc1cnc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@](C)(Cl)CCl)C3)cn1	1794340270	INGMQQGDGBWVQB-TYYYEBLRSA-N	431.320	1.315	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(Cl)nc1F)C2	1795111298	BGKODNRTEWVHJE-WDAIWFPHSA-N	434.693	1.862	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnc2c(Cl)cccn12	1796529879	PTXXJLNDBVOJRN-QDMKHBRRSA-N	446.939	1.613	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1CN(C(=O)OC(C)(C)C)C1	1797146741	YHUKQWQHDJBCIU-FZKCQIBNSA-N	429.945	1.460	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cn2ccsc2n1	1797486147	XHKGIABTGJJGMX-GFQSEFKGSA-N	441.351	1.773	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C=N/N1CCCCC1	1797739773	DJYPLQKSUDCPMJ-IIQSSOLDSA-N	429.359	1.079	50	20	IDGD	
CCc1cnc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)s1	1798439762	CWUBMVVBPVCSNO-CLLJXQQHSA-N	428.518	1.270	50	20	IDGD	
COc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Cl)C3)cc1NC(C)=O	1798609230	BZVDGTURZFLVFA-DLTLXFJOSA-N	427.860	1.391	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc3snnc3c1)C2	1799276805	LTABECQDHXRBGM-QTFJUKGGSA-N	444.344	1.526	50	20	IDGD	
Cc1cccc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Br)n1	1799344738	UNNQBLVHZBZWQP-RMHZUWNSSA-N	428.302	1.603	50	20	IDGD	
COc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Br)ccc1C	1799349029	UOZCJBDQMRIONG-OCVGTWLNSA-N	429.286	1.897	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnn(C)c1Cl)C2	1800641895	MCRHHLFLTHDLIO-LFSVMHDDSA-N	433.734	1.450	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1c(C)nn(C)c1C)C2	1800644543	ZRVVYVQLEKCKOO-CXHZTBPHSA-N	441.370	1.343	50	20	IDGD	
COc1ccc(Cl)c(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](O)CCl)C3)c1F	1801078402	UBGXWRRCWKSEBO-MSNRECKUSA-N	449.306	1.220	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cncc3cnccc23)[C@H]1c1cccnc1)[C@@H](O)CCl	1803140015	AYTMBVAXKKFUTH-YSSFQJQWSA-N	439.903	1.944	50	20	IDGD	
O=C(CCC1CCC1)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1803370461	QNDSHZXJDDKZSE-NZQKXSOJSA-N	435.333	1.661	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC2(CCN(C(=O)C3=NN(C)C(=O)CC3)CC2)C1	1805383525	NXUJPAFYMASVKC-AWEZNQCLSA-N	441.370	1.857	50	20	IDGD	
Cc1cc(C(=O)NC[C@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)c(C)o1	1805566770	MXKQHCZNXUMHRA-GCJKJVERSA-N	441.532	1.984	50	20	IDGD	
C[C@H](CC(N)=O)C(=O)N1CC[C@H](CNC(=O)CCBr)[C@@H]1c1cccnc1	1806341711	FKRLJPOEWLYBIH-MRRJBJDNSA-N	425.327	1.384	50	20	IDGD	
Cn1cccc(C(=O)N2CC[C@@H](CNC(=O)CCBr)[C@H]2c2cccnc2)c1=O	1806343129	SZXFYTQRUNMVOY-MAUKXSAKSA-N	447.333	1.885	50	20	IDGD	
O=C(CN1CCOCC1)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@@H]1c1cccnc1	1806908440	HDQCCDGYAPKSBI-UAGQMJEPSA-N	443.317	1.110	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)Cn2cc(Cl)cn2)[C@@H]1c1cccnc1	1807414084	PWGDXXLTDCWLAA-ZVZYQTTQSA-N	440.331	1.891	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H](CNC(=O)Cn2ccnn2)[C@@H]1c1cccnc1	1807681885	NIBYWSOGNVYXQM-HFTRVMKXSA-N	425.320	1.615	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)C2(F)CC2)[C@@H]1c1cccnc1	1808416200	GVLCRSNEXUEXOV-PMRLGZHMSA-N	440.479	1.724	50	20	IDGD	
CC(=O)N/C(C)=C/C(=O)N1CC[C@H](CNC(=O)[C@H](F)Br)[C@H]1c1cccnc1	1808678014	FBRCYWXLKJIRLY-BTMPVPSKSA-N	441.301	1.818	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)[C@H](C)Cn2cncn2)[C@@H]1c1cccnc1	1810480049	MRWVSHKFHHHDRY-WTTBNOFXSA-N	449.353	1.799	50	20	IDGD	
Cc1ncoc1C(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1813070418	IVFBSJNMTIKVCL-QFBILLFUSA-N	428.493	1.071	50	20	IDGD	
Cc1nscc1C(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1813071060	OKOOPQBIXHLERM-JXFKEZNVSA-N	444.561	1.539	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)C23CC(C2)C3)[C@H]1c1cccnc1	1813644442	KFYSQYVFGJGFIL-VJCUWHJYSA-N	434.500	1.200	50	20	IDGD	
COCCn1nccc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](Cl)COC)[nH]n1	1818251516	OMFZRAKYFYXGEZ-ZFWWWQNUSA-N	438.916	1.812	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H]2C[C@@H](O)C2)n[nH]1	1818824438	UHANOZBSSCHUKA-SRXFQKJYSA-N	441.492	1.307	50	20	IDGD	
C=CCC(F)(F)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819403878	KVFNFKIQWZVSSA-HNNXBMFYSA-N	447.446	1.926	50	20	IDGD	
C=CC[C@@H](C(=C)C)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2	1819597805	MHZULFROAKOFRS-IRXDYDNUSA-N	439.346	1.817	50	20	IDGD	
CCCC(=O)N[C@H](C)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](Cl)COC)CC2	1820120352	WUUPCAKQCWWUPO-GRYCIOLGSA-N	430.958	1.614	50	20	IDGD	
CC[C@@H](Br)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)Cn2cnnn2)[nH]n1	1822086970	DOQVAEUHJZKLEH-PWSUYJOCSA-N	425.291	1.262	50	20	IDGD	
CCNC(=S)NCC(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](Cl)COC)n[nH]1	1822377515	XFWFJEJDRHICMU-YPMHNXCESA-N	430.962	1.140	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)CC2(O)CCC2)n[nH]1	1823039689	XGJUVVRWAITXFG-INIZCTEOSA-N	441.492	1.019	50	20	IDGD	
C#CC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)CC2	1825020170	XTFXFVBPMZOEPM-NSHDSACASA-N	428.426	1.836	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2cccnc2)CC1	1825280474	YQKBBPRZGBLVME-ZWPAVUJESA-N	447.344	1.708	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)on1	1825964978	UOSIBYKSDMDNTF-LJQANCHMSA-N	425.294	1.210	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](C)Nc1cnccn1)CC2	1826000345	SHMLTLXCXDBHSV-UTUOFQBUSA-N	438.941	1.600	50	20	IDGD	
CCc1cc(C(=O)N[C@@H]2CCc3nc(NC(=O)[C@H](Cl)COC)sc3C2)n(C)n1	1826003944	VFIHYKUQGSYVRW-VXGBXAGGSA-N	425.942	1.919	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCc1ccoc1)CC2	1826091776	BYDAFVDCSWDSNT-AWEZNQCLSA-N	433.534	1.654	50	20	IDGD	
C[C@@H](Cc1ccco1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCC(=O)NN(C)C)CC2	1826966588	USCIGFIRLVZWAU-KBPBESRZSA-N	447.561	1.900	50	20	IDGD	
CC(C)(C)[C@@H](O)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827048945	DMIHCIZTDDTWNA-PMACEKPBSA-N	430.354	1.007	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(F)nc3F)CCO2)C1	1829524250	GKIJDCZWALFLHO-IFXJQAMLSA-N	431.867	1.837	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CN2CCNC2=N)CC1	1830316005	FTTAANHGLQJWSG-BEFAXECRSA-N	432.396	1.682	50	20	IDGD	
CC(=O)C[C@H](C)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2	1830543911	HGRYUNIDXHYTNG-SUNYJGFJSA-N	433.343	1.089	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C)nc(O)c3)C2)C1	1831647499	WMSUSBCYADLEPC-OXQOHEQNSA-N	425.913	1.573	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnc(O)nc2O)CC1	1831652716	INPFDQSLTPYYCQ-FZMZJTMJSA-N	441.326	1.905	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc4c3NC(=O)C4)C2)C1	1831653273	DFNZENHVQXRFGT-HTAPYJJXSA-N	449.935	1.659	50	20	IDGD	
CCn1nccc1C(=O)NC1CCN(C2CCN(C(=O)[C@H](Cl)COC)CC2)CC1	1834278420	WWPHDIGZYKKHSG-QGZVFWFLSA-N	425.961	1.342	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)CN3CCCCC3)CCO2)C1	1835378020	LHCMGRPMSALCEP-MOPGFXCFSA-N	436.380	1.165	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cc4n(n3)CCCO4)CC2)CC1	1835568906	OTZCHGKIQLWCEN-KRWDZBQOSA-N	437.972	1.868	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)C(=O)Nc3cccnc3)CC2)CC1	1835803460	RLXDAMYPAYTBLS-GOSISDBHSA-N	435.956	1.609	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CS[C@H]3CCCCO3)CCO2)C1	1837507351	BNHAGDPHBBBPAR-VDZJLULYSA-N	434.986	1.720	50	20	IDGD	
CCc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@](C)(Cl)CCl)C3)C2)no1	1838128295	KNYPVIOKPDQWKD-MSOLQXFVSA-N	434.320	1.543	50	20	IDGD	
CCn1nc(C(=O)N2CCO[C@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)cc1C	1838150654	NSBCJEOIRZJHKU-FQEVSTJZSA-N	438.601	1.133	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3[nH]cc4c3CCC4)CCO2)C1	1838456570	JBQLNTIBVBEVPB-ORAYPTAESA-N	440.338	1.357	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C)nn3C(F)F)C2)C1	1839146065	JIDPSWWHHWFYHZ-UGSOOPFHSA-N	434.871	1.674	50	20	IDGD	
Cc1nn(C)cc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2	1839150174	DEUPYWHZRIVOTP-ROUUACIJSA-N	433.336	1.035	50	20	IDGD	
C=CCOCCCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2	1839150483	NTXKYFLIDMCQHB-RTBURBONSA-N	437.364	1.662	50	20	IDGD	
O=C(c1ccc(O)c(F)c1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839201813	KBXJNSQEZPVDOB-YOEHRIQHSA-N	449.248	1.292	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(C)c(O)c3)CCO2)C1	1839269172	GMKCRNTYWNHWOA-JXFKEZNVSA-N	426.897	1.024	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccccc3-n3nccn3)CCO2)C1	1839381405	RMDBNHLKEHZAQP-UTKZUKDTSA-N	447.923	1.355	50	20	IDGD	
C=CCC(F)(F)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](Br)CC)C2)C1	1839890504	DFOQIIFCKAOVOU-CZUORRHYSA-N	439.297	1.828	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3CCSCC3)C2)C1	1839967299	IDRKEZBNLMMWJE-CRAIPNDOSA-N	449.411	1.760	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CCCSC3)C2)C1	1839967697	VACDJHICUOUTIU-RLFYNMQTSA-N	449.411	1.760	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3[C@@H]4C=CS[C@@H]34)C2)C1	1840035016	DFKDVFPWJAOYQX-CNUKPYSBSA-N	431.352	1.101	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)Oc1cccnc1)CCO2	1840449790	KMHPGUGXHFUJRA-MDKPJZGXSA-N	439.940	1.713	50	20	IDGD	
Cc1ccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)CBr)C3)C2)o1	1840506851	SBSZHGPVORAXDY-KUHUBIRLSA-N	443.338	1.618	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@]1(C)CC1(F)F)CCO2	1840829578	KAYQTAYLZVHVSX-NILFDRSVSA-N	425.270	1.272	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H]1CC(=O)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1	1841350107	IPLNDSRCVFKQBE-CABCVRRESA-N	429.945	1.579	50	20	IDGD	
Cc1ccc2[nH]cc(CC(=O)N3CCCC34CN(C(=O)c3ccc(B(O)O)cc3)C4)c2c1	1841974148	NONWCWLMLVTWSJ-UHFFFAOYSA-N	431.301	1.216	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2ccc(Cl)nc2F)C1	1842143305	NBALOPLXKGBDQH-BRJLIKDPSA-N	446.870	1.825	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC2(CCCN2C(=O)c2cncc(S(C)(=O)=O)c2)C1	1842189755	MUUCSZMTYCTAQL-AWEZNQCLSA-N	444.351	1.476	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)/C=C/c1ccc(F)cc1F)C2	1844263508	LPMCZKKONUARJD-HWKANZROSA-N	441.438	1.494	50	20	IDGD	
Cn1cc(C(=O)N2CC3(CCCN3C(=O)[C@@H](F)Br)C2)c(C(F)(F)F)n1	1845218586	OATSVGAWZTZCCW-SNVBAGLBSA-N	427.196	1.946	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1C)C2	1846362758	UPUVGYUZXPMTGG-JYJNAYRXSA-N	443.972	1.947	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)c1cc(-c3ccccc3)on1)C2	1846383643	OVUJHSDWFITFHM-UHFFFAOYSA-N	425.489	1.532	50	20	IDGD	
COc1ccc([C@@H]2C[C@H]2C(=O)N2CC3(CCCN3C(=O)CCC(=O)NN(C)C)C2)cc1	1846383871	DDHWCVNZWMXJAJ-RBUKOAKNSA-N	428.533	1.375	50	20	IDGD	
Cc1ccc(C(=O)NCC(=O)N2CCCC23CN(C(=O)[C@@H](F)Br)C3)cc1	1847065897	JCDCJRGAMXSRGD-OAHLLOKOSA-N	426.286	1.619	50	20	IDGD	
O=C(CCc1cnc2ccccc2c1)N1CC[C@H]2[C@@H]1CCN2C(=O)c1ccc(B(O)O)cc1	1847464515	CCDFUHGEDPFVFM-GOTSBHOMSA-N	443.312	1.363	50	20	IDGD	
CCOC(=O)/C=C/C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1848099836	XXGPDQMUEVAYKH-YTCPFPDASA-N	443.928	1.440	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ccc3nnc(C(F)(F)F)n3n2)CC1)c1cccnc1	10127470	LCGXLUWLOIZMIB-UHFFFAOYSA-N	434.382	1.216	50	20	IDGD	
CCCOc1ccc(C(=O)NNS(=O)(=O)c2ccc3c(c2)CC(=O)N3C)cc1OC	12969586	QUMZZSOOLOBIFW-UHFFFAOYSA-N	433.486	1.626	50	20	IDGD	
COc1ccccc1OCCC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	15737596	CVGVOIIIGOXKIS-UHFFFAOYSA-N	426.517	1.824	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(Cl)cc1	15879872	ADYPJDHDJXBHHF-UHFFFAOYSA-N	441.893	1.196	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)[C@@H]2CC(=O)N(Cc3ccccc3)C2)c2ccccc2c1=O	15945829	AONJUQCZOMNFBW-QGZVFWFLSA-N	447.495	1.787	50	20	IDGD	
Cc1cc(C)n2ncc(C(=O)NNC(=O)c3cccc(S(=O)(=O)N4CCCC4)c3)c2n1	23109097	SGKAYMTWUDXBKS-UHFFFAOYSA-N	442.501	1.205	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)c3ccccc3F)CC2)cc1	24005686	GREPVYRHCFBLNJ-UHFFFAOYSA-N	447.488	1.890	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)cc2c1O[C@@H](C)C2	24291019	WUQPUUUMEGBGIC-NSHDSACASA-N	432.502	1.695	50	20	IDGD	
O=C(CC1CCCCC1)NCC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	109764768	MVMMIBTYQFUJFZ-UHFFFAOYSA-N	429.565	1.433	50	20	IDGD	
CC1CCN(S(=O)(=O)c2ccc(C(=O)N([C@H]3CCS(=O)(=O)C3)N(C)C)cc2)CC1	728180807	YMSYANVOZLMCBH-KRWDZBQOSA-N	443.591	1.213	50	20	IDGD	
COc1cccc(N2CC[C@@H](NC(=O)NNc3ccc(S(=O)(=O)NC(C)C)cn3)C2)c1	728220773	JULORJWRGOSTFP-OAHLLOKOSA-N	448.549	1.682	50	20	IDGD	
Cc1cccc(-n2c(C)cc(/C=C(/C#N)C(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)c2C)c1	728382358	IMAMQFKGQNZTGI-HPKGMJOESA-N	440.525	1.892	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(O)c([N+](=O)[O-])c1)c1cc(F)ccc1Br	728510254	VITUFZPLVJQGQI-UHFFFAOYSA-N	434.199	1.825	50	20	IDGD	
Cc1oc(C(=O)NNC(=O)Cn2ccc3ccccc32)cc1S(=O)(=O)N1CCCC1	729450859	XGIYNTLYSJXOII-UHFFFAOYSA-N	430.486	1.788	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)CNC(=O)c2ccccc2OC(F)F)cn1	729693036	FMVDWHDEZKZAGT-UHFFFAOYSA-N	425.417	1.439	50	20	IDGD	
CC(C)(C)C(=O)N1CSC[C@H]1C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	730077259	QKEZBPWYLOYBQK-HNNXBMFYSA-N	426.564	1.518	50	20	IDGD	
COc1cc(C=NNC(=O)Cc2ccccc2F)ccc1OCC(=O)N1CCOCC1	731320059	GUNJYUSUIKGMJB-UHFFFAOYSA-N	429.448	1.765	50	20	IDGD	
O=C(NNC(=O)C1(NS(=O)(=O)c2ccc(Cl)cc2)CCCCC1)N1CCOCC1	732063921	OFHVVSSZUAZRBI-UHFFFAOYSA-N	444.941	1.394	50	20	IDGD	
O=C(COC(=O)[C@H]1CC(=O)N(C2CCCCC2)C1)NNC(=O)c1cccc([N+](=O)[O-])c1	732323164	IRTVTDHHGBSRIB-AWEZNQCLSA-N	432.433	1.080	50	20	IDGD	
CCOCCCn1c(NNC(=O)[C@@H]2CC(=O)N(C(C)(C)C)C2)nc2ccccc2c1=O	733268448	LRUQGQSRPDNCLO-OAHLLOKOSA-N	429.521	1.913	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2cccc(C(=O)NNc3nccnc3Cl)c2)C[C@@H](C)O1	734261073	OTHUQJXVTVFQEC-TXEJJXNPSA-N	425.898	1.685	50	20	IDGD	
CC(CS(=O)(=O)c1ccc(C)cc1)=NNC(=O)Cc1csc(N2CCOCC2)n1	734297077	RSWLRTVETVZQQO-UHFFFAOYSA-N	436.559	1.797	50	20	IDGD	
O=C(NNC(=O)c1cccc(Cl)c1)NC1CCN(S(=O)(=O)C2CCOCC2)CC1	736405414	GGMGLUBGEFBXFM-UHFFFAOYSA-N	444.941	1.257	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)Cn2c(C)nc3ccccc3c2=O)cc1C	736777172	YWHGYHOTZGPGOQ-UHFFFAOYSA-N	442.497	1.642	50	20	IDGD	
COc1ccc(-c2nn(CCC#N)cc2/C=C(\C#N)C(=O)N[C@@H]2CCN(C)C2=O)cc1OC	737993275	GOKXJYZFNLLDLP-QIPHDZALSA-N	448.483	1.735	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)c2ccnc(-n3cccn3)c2)CC1	739732592	HFRDGPRDMNAYEY-UHFFFAOYSA-N	429.481	1.611	50	20	IDGD	
NS(=O)(=O)c1ccccc1S(=O)(=O)NNC(=O)c1cc2c(s1)CCCCC2	740704647	KFXMWZXBRFTHNN-UHFFFAOYSA-N	429.545	1.288	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)[C@@H]1CCCN1C(=O)c1cc(Cl)ccc1OC	740851240	VZUILABCUMIJBK-HNNXBMFYSA-N	438.912	1.405	50	20	IDGD	
CC(C)CNC(=O)N1CCC[C@H](C(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)C1	741360141	UTJXYONIWCMTLP-HNNXBMFYSA-N	438.912	1.722	50	20	IDGD	
O=C(NCc1cccc(C(F)(F)F)c1)NNC(=O)c1ccc(CN2C(=O)CNC2=O)cc1	742459655	QOMVCBGIGAGHQP-UHFFFAOYSA-N	449.389	1.901	50	20	IDGD	
C[C@@H]1C[C@H](NC(=O)NNC(=O)c2cccc(Br)c2)C(=O)N1c1cnn(C)c1	743686528	JIBXYIAZLAYUQU-YGRLFVJLSA-N	435.282	1.321	50	20	IDGD	
CCC[C@@H](C)N1C[C@@H](C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)CC1=O	744619040	FWRNIFQGAWZVNE-CVEARBPZSA-N	438.550	1.188	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)C2CCC(NC(=O)C3CCCC3)CC2)cc1	744922116	MITILTLUONIXQW-UHFFFAOYSA-N	440.500	1.728	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)c1cc(F)ccc1Br)CN1CCN(C)CC1	745862176	HVCIPKJCVYIIKK-LBPRGKRZSA-N	430.322	1.416	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NC[C@@H](C)Oc2ccccc2OC)c2ccccc2c1=O	745901354	HKOUBAXOPUVAKN-CQSZACIVSA-N	439.472	1.837	50	20	IDGD	
CCO[C@H]1C[C@@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)C12CCCC2	745918017	MQYQAHMUMUSGBJ-SJORKVTESA-N	438.550	1.619	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)[C@]1(O)CCN(Cc2ccccc2)C1	746200891	QJOLUFUSPLUFGH-NRFANRHFSA-N	430.530	1.207	50	20	IDGD	
CC(C)c1nc(C#N)c(NNC(=O)CCNS(=O)(=O)c2ccc3c(c2)OCCCO3)o1	746524423	YJAZFUITKZWLMY-UHFFFAOYSA-N	449.489	1.643	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)COc2ccccc2O)c(Cl)cc1Cl	747271546	ZWNJPFAUNDBDLC-UHFFFAOYSA-N	449.268	1.874	50	20	IDGD	
C[C@H](NC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)[C@H](C)c1ccccc1	747589842	UIWGQROBHOAQMQ-IRXDYDNUSA-N	446.577	1.836	50	20	IDGD	
COc1cc(OC)cc(N2CC[C@H](NC(=O)NNC(=O)Cc3ccc(F)cc3)C2=O)c1	747957306	YUUWQBOKSTWJGH-SFHVURJKSA-N	430.436	1.521	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc(Br)ccc1F)[C@H]1COc2ccccc2O1	748689020	FTLSBRIRZPPAPR-CYBMUJFWSA-N	431.239	1.738	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Nc2ccccc2S(=O)(=O)N1)c1ccc(F)cc1Br	749915612	JGRCQEKFIYURQR-CYBMUJFWSA-N	443.254	1.079	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2cc(F)ccc2Br)oc1C	751143433	QSLULUJGDZTEQD-UHFFFAOYSA-N	435.227	1.900	50	20	IDGD	
CCNS(=O)(=O)c1cccc(C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)c1	751388881	PIGFKSOEGXDNHV-UHFFFAOYSA-N	433.458	1.738	50	20	IDGD	
Cc1cc(S(N)(=O)=O)cc(C(=O)NNC(=O)c2ccc(F)cc2Br)c1C	751647515	JWFCJJVPIUFBBO-UHFFFAOYSA-N	444.282	1.927	50	20	IDGD	
O=C(C[C@@H]1CSCCS1)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	752128159	XKCMKFKYPQLRJL-MRXNPFEDSA-N	443.038	1.844	50	20	IDGD	
Cc1oc(-c2cnn(C)c2)nc1C(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12	752504224	YQKDFPLANWWKDQ-UHFFFAOYSA-N	435.444	1.749	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NNC(=O)c2cc(C)nc3ccccc23)cc1	753118776	YJJBKJQDBUXZBV-HNNXBMFYSA-N	426.498	1.980	50	20	IDGD	
CCn1cc([C@@H]2C[S@@](=O)CCN2C(=O)NNC(=O)Cn2ccc3ccccc32)cn1	753125835	OLQLOCMPAWWBNB-PBYQXAPXSA-N	428.518	1.404	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCc2cn(-c3ccccc3)nn2)cc(OC)c1OC	755075212	OYLJPQSDFIULSA-UHFFFAOYSA-N	426.433	1.437	50	20	IDGD	
O=C(NNc1ccc(C(F)(F)F)nn1)c1cccc(CN2CCS(=O)(=O)CC2)c1	755192114	WNJADSUJAWUJGU-UHFFFAOYSA-N	429.424	1.483	50	20	IDGD	
O=C(Cc1cc[nH]n1)NNC(=O)c1cc(Cl)ccc1NS(=O)(=O)c1ccccc1	755268525	KPAPEDNRYFYMAG-UHFFFAOYSA-N	433.877	1.868	50	20	IDGD	
CN(c1ccccc1)S(=O)(=O)c1cccc(NC(=O)NNC(=O)c2cnn(C)c2)c1	755408490	DUQQVQYYWLIRKJ-UHFFFAOYSA-N	428.474	1.712	50	20	IDGD	
COCCOc1cc(NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)ccc1OC	755694771	DMLSDKGSUAGLOP-UHFFFAOYSA-N	437.474	1.590	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)Nc1ccc(C(=O)N2CCOCC2)cc1	755933191	HHOHBIMGCMHSIS-GOSISDBHSA-N	426.429	1.152	50	20	IDGD	
C[C@@H]1CN(c2ccc(NC(=O)NNC(=O)C3CCN(c4ncccn4)CC3)cc2)CCO1	756673221	XMEIDHNZDGHVJP-MRXNPFEDSA-N	439.520	1.771	50	20	IDGD	
Cc1nn(C)c(OCC(F)(F)F)c1C=NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	756822784	AQJNVXWHDUHKRH-UHFFFAOYSA-N	447.439	1.684	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)Nc2cc(C(N)=O)ccc2-n2cc(C)cn2)cc1	757873290	KEVZKWFJYCDFBK-UHFFFAOYSA-N	438.444	1.520	50	20	IDGD	
O=C(Cc1ccsc1)NNC(=O)Nc1ccc(NC(=O)CCN2C(=O)CNC2=O)cc1	758016720	MZFXXPGDJYRGDO-UHFFFAOYSA-N	444.473	1.024	50	20	IDGD	
Cc1nn(CC(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)c(C)c1Cl	758787923	WWHBUJBGYRZVCH-UHFFFAOYSA-N	428.921	1.789	50	20	IDGD	
O=C(NNC(=O)c1cccnc1)C(=O)Nc1ccc(C(=O)N2CCc3ccccc32)cc1	763492141	UUYCDSZPZBNVBS-UHFFFAOYSA-N	429.436	1.684	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)C(=O)Nc1ccc(F)cc1F	763531374	NCWKMRHOKIGFGI-UHFFFAOYSA-N	431.443	1.263	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2ccc([C@@H](C)N3CCOCC3)cc2)c1	763629831	IPHFNWUWYHUSJF-QGZVFWFLSA-N	440.500	1.553	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(Oc3ccccn3)cc2)cc1	763681802	OCBQVOKBZKNOSQ-UHFFFAOYSA-N	431.408	1.910	50	20	IDGD	
Cc1ccccc1-c1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2F)n(C)n1	763682950	SEZTWQILPBLMCB-UHFFFAOYSA-N	425.420	1.700	50	20	IDGD	
O=C(CN1CCCc2ccccc21)NNC(=O)C(=O)Nc1ccc2c(c1)OC(F)(F)O2	763728441	QJPOQJYGFYXGNY-UHFFFAOYSA-N	432.383	1.547	50	20	IDGD	
O=C(CN1CCCc2ccccc21)NNC(=O)C(=O)Nc1cccc(N2CCCCC2=O)c1	763745293	BWSPAQVPRNBHKE-UHFFFAOYSA-N	449.511	1.742	50	20	IDGD	
O=C(NNC(=O)c1cc2c(s1)CCC2)C(=O)Nc1ccc(N2C(=O)CCCC2=O)cc1	763775490	TWINNOXSKGXAFA-UHFFFAOYSA-N	440.481	1.680	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1c(F)cccc1Br	763806888	HFCCEWDNFSHTMH-UHFFFAOYSA-N	435.209	1.625	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)c1ccc(=O)n(Cc2ccccc2Cl)c1	763825408	WJAQOUDAPZPIIN-UHFFFAOYSA-N	439.859	1.136	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(NC(=O)OCCOC)c2)cc1	763831515	YYCCTYQIZFDXFY-UHFFFAOYSA-N	428.445	1.844	50	20	IDGD	
COCCOc1cc(C)ccc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccc(F)cc1	763873697	XPAWUKOCXXSZGO-CQSZACIVSA-N	433.436	1.713	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2c(C)cc(Cl)cc2C)c(=O)n(C)c1	763883753	QLURQICANLCHEW-CYBMUJFWSA-N	434.880	1.517	50	20	IDGD	
O=C(CCSc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccc2c(c1)OCC(=O)N2	763896206	YTHYEMHUFCFWLE-UHFFFAOYSA-N	432.433	1.425	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)C(=O)Nc1ccnc(Oc2ccccc2)c1	763916973	MKOBTENZESBAEF-UHFFFAOYSA-N	444.411	1.249	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3ccc(Cn4cncn4)cc3)cc2C1	763940304	FCQAYWUJXKKYNV-CYBMUJFWSA-N	438.513	1.912	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3cc(Cl)ccc3O)cn2)C[C@@H](C)O1	763973560	BBBQNBODJSYNLM-TXEJJXNPSA-N	447.879	1.454	50	20	IDGD	
O=C(Cc1ccsc1)NNC(=O)C(=O)Nc1ccc(CN2C(=O)CSC2=O)cc1	764033322	JVYJRYQVZARVAL-UHFFFAOYSA-N	432.483	1.272	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc2nc(N3CCOCC3)oc2c1	764049326	XYABDDLWHQSJHN-UHFFFAOYSA-N	439.428	1.073	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3c2)cc1-n1nnnc1C	764061433	DOOHPGJURHPSTF-UHFFFAOYSA-N	445.439	1.532	50	20	IDGD	
C=CCNC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccccc2OC)cc1	764133639	XSCUUPJAXCDKEG-UHFFFAOYSA-N	425.445	1.331	50	20	IDGD	
COC(=O)c1cc(Br)c(F)cc1NC(=O)C(=O)NNC(=O)c1ccoc1	764164737	ZTAUKXBIDYRNEF-UHFFFAOYSA-N	428.170	1.368	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(C#N)cc2)c2ccccc12	764176238	DGPVUMGDPMSSKK-UHFFFAOYSA-N	446.419	1.663	50	20	IDGD	
Cn1ccc(NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3CN2Cc2ccccc2)n1	764178743	IUBVDDLGERJVAF-LJQANCHMSA-N	432.484	1.133	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1ccc(-n2cnc3ccccc32)nc1	764280797	UOBMGOHVJGDGJU-UHFFFAOYSA-N	446.423	1.291	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2c[nH]nc2C)cc1NC(=O)C1CCCCC1	764297801	ZRXOZPTZTNOOMV-UHFFFAOYSA-N	442.476	1.645	50	20	IDGD	
CCCN1CCN(c2ccc(NC(=O)C(=O)NNC(=O)c3c[nH]nc3C)cc2Cl)CC1	764298101	MYTNIOCNEZNBMB-UHFFFAOYSA-N	447.927	1.303	50	20	IDGD	
COC(=O)N(C)Cc1ccc(NC(=O)C(=O)NNC(=O)C(C)(C)c2ccccc2)cc1	764309106	LMYOANRYKLEVAZ-UHFFFAOYSA-N	426.473	1.949	50	20	IDGD	
CC(C)n1nnnc1-c1ccccc1NC(=O)C(=O)NNC(=O)c1ccc(O)c(Cl)c1	764349085	HAEPBQAECMCUOA-UHFFFAOYSA-N	443.851	1.680	50	20	IDGD	
CCCN1CCN(c2ccc(NC(=O)C(=O)NNC(=O)c3cnn(C)c3)cc2Cl)CC1	764358958	LDYGCWWUBOHGAZ-UHFFFAOYSA-N	447.927	1.005	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccn(CC(F)(F)F)n3)n[nH]2)cc1	764385119	RSOIHBYLSDOMIU-UHFFFAOYSA-N	449.393	1.798	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C[C@H]1CN(C(=O)OC(C)(C)C)CCO1	764554768	WYLLRAQPEQBSGK-KBPBESRZSA-N	425.457	1.766	50	20	IDGD	
CC(=NNC(=O)[C@H](C)CN1C[C@@H](C)O[C@H](C)C1)c1ccc(Cl)c(S(N)(=O)=O)c1	764667419	RUUCKSDNRFMTEK-JHJVBQTASA-N	430.958	1.573	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N2CCOCC2)cc1NC(=O)NNC(=O)OC(C)(C)C	765111578	IQGDOZKJYZHKFY-UHFFFAOYSA-N	444.510	1.667	50	20	IDGD	
COc1ccc(S(=O)(=O)NC(C)(C)C)cc1NC(=O)C(=O)NNC(=O)OC(C)(C)C	765392218	WJLONBPNDBQXJL-UHFFFAOYSA-N	444.510	1.266	50	20	IDGD	
CCn1c(NNC(=O)CCC(=O)Nc2ccc3nc(O)[nH]c3n2)nc2ccccc2c1=O	765471781	BNLXFHKZXQRZQH-UHFFFAOYSA-N	436.432	1.255	50	20	IDGD	
CC(C)NC(=O)C(=O)NNS(=O)(=O)c1ccc(-c2ccc(Br)cc2)cc1	766313040	UTUIZVPFUDHPTK-UHFFFAOYSA-N	440.319	1.950	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)C[C@H](C)NC(=O)C3CCCC3)CC2)cc1	766647256	CFWBCUFSELQVLU-IBGZPJMESA-N	443.592	1.345	50	20	IDGD	
O=C(NNc1ccc(-n2cccn2)nn1)N[C@H]1CC(=O)N(c2ccc(Cl)c(F)c2)C1	766870743	PPFIUBSJZYLHKV-NSHDSACASA-N	430.831	1.886	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)[C@H]1CCN(c2ccc(Cl)cc2)C1=O	767305586	HSLVEIGEHPKFJB-SFHVURJKSA-N	443.887	1.935	50	20	IDGD	
CC(CC(=O)NNC(=O)Cc1ccc(F)cc1)CC(=O)NNC(=O)Cc1ccc(F)cc1	767440426	SAQBVHUJANXMNA-UHFFFAOYSA-N	446.454	1.461	50	20	IDGD	
O=C(O)c1cc(S(=O)(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc(Cl)c1F	767735931	NKFDJKXWSLKZPD-CYBMUJFWSA-N	430.797	1.327	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N2CCCC[C@@H](S(C)(=O)=O)C2)cc1Br	767809183	CNPFKPGEFTWZSF-GFCCVEGCSA-N	448.339	1.711	50	20	IDGD	
O=C(Cc1ccccn1)NNC(=O)C(=O)Nc1ccc(Cc2nnc3n2CCCCC3)cc1	768244172	YXAVRGLMQNFARH-UHFFFAOYSA-N	447.499	1.319	50	20	IDGD	
COc1cc(OC)cc(C(=O)Nc2ccc(O)c(C(=O)NNC(=O)c3cc(C)[nH]n3)c2)c1	768275956	GBNJBAXJLOVIEQ-UHFFFAOYSA-N	439.428	1.768	50	20	IDGD	
CCNc1nc(C)c(C(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)s1	768290190	DMMADHRSBARHCS-UHFFFAOYSA-N	430.578	1.771	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)NC2CCN([C@H]3CCCC[C@@H]3O)CC2)nc2ccccc21	769158980	CHZAMNNJMDNSBM-OALUTQOASA-N	428.537	1.214	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc3c2CCN3C(C)=O)cc1OC	769250785	ACJVIGSULGBPFB-UHFFFAOYSA-N	426.429	1.013	50	20	IDGD	
Cn1cc(S(=O)(=O)NNC(=O)c2nc(Cl)c(Cl)c(N)c2Cl)nc1Cl	769823650	VGXBJFHCOSXKNJ-UHFFFAOYSA-N	434.092	1.634	50	20	IDGD	
C[C@H]1CN(C(C)(C)CNC(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)C[C@@H](C)O1	770341223	MBLSIUCOVHQJGT-BETUJISGSA-N	434.545	1.801	50	20	IDGD	
CNS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccc(Br)c(F)c2)cc1	770815465	HKTUWHFZABKHAV-UHFFFAOYSA-N	445.270	1.578	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)[C@H]3CCCN(C(=O)c4ccncc4)C3)nc21	770968219	JLDCOKLBQFOWEJ-AWEZNQCLSA-N	438.492	1.677	50	20	IDGD	
COC(=O)C[C@H]1CCCN1C(=O)NNC(=O)[C@H](C)Oc1cccc(Br)c1	771954764	RBWQIYBWDRSJSK-WCQYABFASA-N	428.283	1.985	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)[C@@]12CCC(=O)N1c1ccccc1C(=O)N2CC(C)C	771970004	QQHISKWBYNKYTM-JLCFBVMHSA-N	444.488	1.111	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)[C@H]2CC[C@@H](C(F)(F)F)NC2=O)C1	773410878	FSZMAKNYRXPTNS-SRVKXCTJSA-N	436.431	1.238	50	20	IDGD	
CN1CCN(C(=O)c2ccccc2NC(=O)C(=O)NNc2cnc3ccccc3n2)CC1	773716197	INZQOPFGKNWIJN-UHFFFAOYSA-N	433.472	1.099	50	20	IDGD	
C[C@@H](C(=O)Nc1ccc(NC(=O)C(=O)NNc2c(F)cccc2F)cc1)n1cncn1	773719081	VEJZONNCTFBPCZ-NSHDSACASA-N	429.387	1.838	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)Nc3ccnn3[C@H]3CCS(=O)(=O)C3)n[nH]2)cc1	776060372	WQVNKVIPCBKPTH-AWEZNQCLSA-N	443.489	1.408	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)[C@@H]2CCc3c(Cl)cccc32)CC1	776232687	UZJPFELXSCGDJT-MRXNPFEDSA-N	449.964	1.844	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)NCCN2CCN(Cc3ccccc3)CC2)c1	776608204	CCZXOHRTWARXQF-UHFFFAOYSA-N	431.562	1.534	50	20	IDGD	
C[C@H](NC(=O)NNc1cccc(S(C)(=O)=O)c1)c1cccc(S(=O)(=O)N(C)C)c1	776619790	STTIXSHWALOKEN-ZDUSSCGKSA-N	440.547	1.728	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(OCC(=O)NNc2nccc(N3CCOCC3)n2)CC1	777167157	OFNXACCVHUKCHH-UHFFFAOYSA-N	436.513	1.172	50	20	IDGD	
COC[C@@H](C)n1c(C)cc(/C=C(/C#N)C(=O)N2CC(n3cc(C(=O)OC)nn3)C2)c1C	779550931	YSPCYYARSFVCRC-IGYCIJMVSA-N	426.477	1.681	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1S(=O)(=O)NNC(=O)c1ccc2ccccc2c1	780372701	BNODMKZDSLKOJP-UHFFFAOYSA-N	433.511	1.713	50	20	IDGD	
Cc1ccc(C)c(N2N=C(C(=O)NNC(=O)CCNC(=O)OC(C)(C)C)CCC2=O)c1	780974088	OCBAKMZDWVTGAW-UHFFFAOYSA-N	431.493	1.848	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)[C@H]1CCCN(C2CCC2)C1	781402609	HFEFQHWQLOFXGV-CABCVRRESA-N	426.521	1.531	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2c(C)cnn2Cc2ccc(OC)c(OC)c2)nc1	782141155	MWRGDSUZDUFJEU-UHFFFAOYSA-N	440.460	1.742	50	20	IDGD	
CN(NC(=O)C(=O)Nc1ccc(Cl)cc1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	783705357	WUAPKKBBHLVJKU-UHFFFAOYSA-N	439.900	1.914	50	20	IDGD	
C#CCOc1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)cc1	784210508	RNNHOAHTBHJXKO-UHFFFAOYSA-N	428.470	1.221	50	20	IDGD	
CN(C)C(=O)c1cc(NC(=O)C(=O)NNc2c(F)cc(F)cc2Br)ccn1	785009452	ULDONYZUFGSPOM-UHFFFAOYSA-N	442.220	1.906	50	20	IDGD	
Cc1ccc(-n2cc(C)cn2)c(NC(=O)C(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)c1	785024453	ZNVQUNKESYIQNR-UHFFFAOYSA-N	438.400	1.503	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2nc(-c3cccc(OC)c3)ns2)n1	785226157	QZJCWRPBKNNZFE-UHFFFAOYSA-N	442.505	1.932	50	20	IDGD	
CSCCNC(=S)NNC(=O)c1cc([C@@H]2CCN(C(=O)OC(C)(C)C)C2)[nH]n1	787489772	LXFKKHDZSLIHJQ-LLVKDONJSA-N	428.584	1.606	50	20	IDGD	
Cn1nc([C@@H]2CCCO2)cc1NC(=O)C(=O)NNC(=O)c1ccccc1Br	789730731	ZMHLSVNHTLAMBH-ZDUSSCGKSA-N	436.266	1.434	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)N3CCC[C@@H](N4CCCS4(=O)=O)C3)cc2C1	789829458	OYOGLOIEADNWLV-DZGCQCFKSA-N	440.591	1.727	50	20	IDGD	
Cc1cc(F)c(Br)cc1S(=O)(=O)NNC(=O)CNC(=O)OC(C)(C)C	790405683	UAAQKQYKUBBKIS-UHFFFAOYSA-N	440.291	1.731	50	20	IDGD	
CS(=O)(=O)C1(C(=O)NNC(=O)c2nc(-c3ccccc3)n(-c3ccccc3)n2)CC1	792016043	KBWIMMYXHQERAZ-UHFFFAOYSA-N	425.470	1.273	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)CCN1CCN(C(=O)OC(C)(C)C)CC1	792017074	XFEIVQDXZJLEKI-OAHLLOKOSA-N	438.500	1.683	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)[C@@](C)(O)Cn2cc(C(F)(F)F)ccc2=O)c(C)c1	792632528	FSSDAZNTQPPXQG-IBGZPJMESA-N	440.422	1.494	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)c2cnn3c2C[C@H](CNC(C)=O)CC3)cc1OC	792736332	KMMVPHAMCHSLQL-OAHLLOKOSA-N	443.504	1.454	50	20	IDGD	
COc1ccc(Cn2cc(NC(=O)C(=O)NNC(=O)Cc3ccc(F)cc3)cn2)cc1	793022234	RJXMVYSAYBCLKO-UHFFFAOYSA-N	425.420	1.408	50	20	IDGD	
Cc1noc(C2CCC(NC(=O)NNC(=O)CNC(=O)OCc3ccccc3)CC2)n1	793086453	SSHDOELXFJISFT-UHFFFAOYSA-N	430.465	1.661	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@@H](C)c3ccc4c(c3)OCO4)CC2)cc1	794392905	KEPWAOUXOSDJGK-SFHVURJKSA-N	438.528	1.792	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc(N3C[C@H](C)O[C@@H](C)C3)ccn2)cc1C	798308940	FAWZENXJXDFLNK-HOTGVXAUSA-N	425.489	1.712	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)c2ccc(S(N)(=O)=O)c(Br)c2)c1	798338274	JVUPRSZTWSNCAJ-UHFFFAOYSA-N	428.264	1.640	50	20	IDGD	
COc1ccccc1CONC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	798535080	KZSSGTGBWLEACJ-UHFFFAOYSA-N	427.505	1.670	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccc([N+](=O)[O-])cc2Br)cc1	801111517	PCPWBSJRDNBXCC-UHFFFAOYSA-N	435.234	1.994	50	20	IDGD	
O=C(COC(=O)c1ccc(CN2CCCC2)cc1)NNC(=O)c1ccc([N+](=O)[O-])cc1	801870823	HTMODUYIUJBVSL-UHFFFAOYSA-N	426.429	1.809	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)CN(C)c2ncnc3[nH]cnc23)cc1Cl	802076115	VCMIQZJHBLPADI-UHFFFAOYSA-N	434.844	1.313	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)C2CCC3(CC2)NC(=O)NC3=O)c(OC)cc1Cl	802081554	URSMPOZMUJVXMN-UHFFFAOYSA-N	439.856	1.278	50	20	IDGD	
O=C(Cc1nc(-c2ccccc2)cs1)NNC(=O)CN1C(=O)[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O	802577948	XWJSMPLZMJVQEO-AFHBHXEDSA-N	436.493	1.307	50	20	IDGD	
COC(=O)N(C)NC(=O)/C(C#N)=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	804124086	AEXTVJNTBRKYAH-LCYFTJDESA-N	430.852	1.715	50	20	IDGD	
O=C(NC[C@@H](N1CCOCC1)C(F)(F)F)NNC(=O)c1ccc(Br)s1	804872423	KEHPBOUACLZHCJ-SECBINFHSA-N	445.261	1.718	50	20	IDGD	
CC(C)(CNC(=O)NNC(=O)CNC(=O)c1cccs1)Oc1cc(F)cc(F)c1	805044401	QRQGFNAVUVIBHO-UHFFFAOYSA-N	426.445	1.944	50	20	IDGD	
CCS(=O)(=O)N1CCN(C(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)[C@H](C)C1	805369226	PVEGVQXAPMFHMB-OLZOCXBDSA-N	432.930	1.204	50	20	IDGD	
O=C(NNC(=O)c1cc2c(s1)CCC2)C(=O)Nc1ccc(F)c(N2C(=O)CCC2=O)c1	806974708	RVTAZLCVIUVLQK-UHFFFAOYSA-N	444.444	1.429	50	20	IDGD	
Cc1ccccc1NS(=O)(=O)c1ccc(C)c(C(=O)NNC(=O)N2CCN(C)CC2)c1	807381098	CRQOROIHJYSTMG-UHFFFAOYSA-N	445.545	1.706	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C2(S(=O)(=O)c3ccccc3)CCOCC2)c1	809144344	LDLNZDOEGDLNDP-UHFFFAOYSA-N	446.525	1.853	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)CNS(=O)(=O)c2ccc(C)cc2)n[nH]1	810584342	PJIKWPJASVOBBL-UHFFFAOYSA-N	443.485	1.133	50	20	IDGD	
COCC1(C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)CCOCC1	810593869	LOGSGEMJBMCEDG-UHFFFAOYSA-N	438.956	1.048	50	20	IDGD	
Cn1cncc1CNC(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	812489233	OJWHYWTXEWNBEM-UHFFFAOYSA-N	431.456	1.323	50	20	IDGD	
CC(=O)N1c2ccc(S(=O)(=O)NNC(=O)C(=O)Nc3ccc(C)c(C)c3)cc2C[C@H]1C	812551951	PEBPBYGMOYWKQA-CQSZACIVSA-N	444.513	1.549	50	20	IDGD	
Cc1cc(CC(C)(C)C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)ccc1Br	814256078	KBZXDRSPPPRMFX-CYBMUJFWSA-N	431.352	1.908	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1ccc(-c2ncon2)cc1	815751984	XCUROAUHJBRJLS-UHFFFAOYSA-N	430.446	1.069	50	20	IDGD	
CNS(=O)(=O)NC1CCN(C(=O)/C(C#N)=C\c2cc(C)n([C@H](C)COC)c2C)CC1	816468623	KJQOLPMOKZLJRK-JQFNYASXSA-N	437.566	1.264	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)C2CCN(S(C)(=O)=O)CC2)c1	816718286	LOCWMTQUQWJLTR-UHFFFAOYSA-N	434.312	1.350	50	20	IDGD	
CS(=O)(=O)c1cc(S(=O)(=O)NNC(=O)c2c[nH]c3ccccc23)ccc1Cl	821123517	CDWRPRTUJYFVRF-UHFFFAOYSA-N	427.891	1.848	50	20	IDGD	
CCCC[C@H](/N=C1/NS(=O)(=O)c2ccccc21)C(=O)NNC(=O)CNc1ccccc1	823328873	XOQHMTARUOPRQX-KRWDZBQOSA-N	443.529	1.543	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)CN2C(=O)N[C@](C)(c3ccc(C)cc3)C2=O)c1	825781371	BMEUGQHIFXUERT-JOCHJYFZSA-N	439.472	1.030	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)[C@H](O)[C@H](O)c2nc3ccccc3s2)c1C	831083219	RZUPDGHKDDQFLO-XWIAVFTESA-N	429.498	1.922	50	20	IDGD	
C=C1c2ccccc2C(=O)N1CC(=O)NNC(=O)c1ccc(CSc2nncn2C)cc1	836351117	RJPVZJRJIYZQPG-UHFFFAOYSA-N	448.508	1.995	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)CNC(=O)Cc2cccc3ccccc23)cc1	849198244	RIMFJFMOFGHHPU-UHFFFAOYSA-N	433.464	1.811	50	20	IDGD	
NC(=O)CCn1c(SCC(=O)NNC(=O)c2cccc(Cl)c2)nnc1-c1ccco1	863890481	WOLJCFRWCWRNLE-UHFFFAOYSA-N	448.892	1.620	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(Br)cc1)NNC(=O)c1cccc(Cl)c1	913509033	RBWRVHVRQNWGAW-UHFFFAOYSA-N	446.710	1.842	50	20	IDGD	
Cc1nn(C)c(C)c1C=NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	915914346	QWRHRHZLZSKYSP-UHFFFAOYSA-N	433.534	1.141	50	20	IDGD	
CCC(=O)Nc1cccc(CNC(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)c1	916381821	VFZPFLMZVSIQQB-UHFFFAOYSA-N	434.522	1.943	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)CN1CCCC1	918223986	VQSYGVANLDPYMP-MRXNPFEDSA-N	437.566	1.147	50	20	IDGD	
CCS(=O)(=O)NC1CCN(C(=O)NNC(=O)c2ccc(Br)s2)CC1	918778968	WAYOCGBULNBPBE-UHFFFAOYSA-N	439.357	1.269	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)CCc2ccc(S(=O)(=O)NC3CC3)cc2)cc1	919834385	YOEFKKDHJQCCEG-UHFFFAOYSA-N	445.541	1.849	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)C2(c3ccc(F)cc3)CCOCC2)c1	919971936	RMKOMNDIPDNUHE-UHFFFAOYSA-N	449.504	1.585	50	20	IDGD	
NC(=O)c1ccc(/C=C/C(=O)N2CCC[C@@H]2C(=O)NNC(=O)c2ccc(Cl)cc2)cc1	920020399	UZQNFVLXXNNQRU-OPGJMIRHSA-N	440.887	1.904	50	20	IDGD	
CC(C)(C)C(=O)N1CCC[C@H](C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)C1	920421924	MEJIVUPIAKPCDL-LBPRGKRZSA-N	444.941	1.033	50	20	IDGD	
C[C@@H](Nc1ccc(C(=O)NNC(=O)CN2CCCC2=O)cc1[N+](=O)[O-])c1ccccn1	920432501	BCRGVDWIFOGZCP-CYBMUJFWSA-N	426.433	1.546	50	20	IDGD	
CC(C)(C)c1ccc(C(=O)N[C@@H](CCS(C)(=O)=O)C(=O)NNc2cccnn2)cc1	1116567536	MOMFMMZXUHNVRW-INIZCTEOSA-N	433.534	1.451	50	20	IDGD	
CCc1cc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CO[Si](C)(C)C)C2)n(C)n1	1779545481	QUCLUXWDYVFSLP-WIYYLYMNSA-N	436.629	1.962	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2)c1[nH]cnc1-c1cccnc1	1780033581	DQIYKZNWSDUYSW-GCKMJXCFSA-N	447.923	1.199	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(CO)on2)C1	1780219666	VAZGWDZKBROCFG-FABXCBLPSA-N	430.299	1.078	50	20	IDGD	
Cc1[nH]nc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](F)Br)C2)c1F	1780770803	CFYOOAVIOMWGBZ-AKWBHNSASA-N	435.269	1.675	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Br)C1	1780776848	GRHAKMFTJRYJNJ-FUTJPDQTSA-N	429.714	1.445	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H]3CC[C@H]4CCC(=O)N4C3)C2)C1	1781057376	OIESUHIQHDSWLU-SLUIBLPYSA-N	446.375	1.454	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)C(=O)Nc3cccnc3)CCO2)C1	1781229786	JLFLZCMGYXCVDM-ZWKOTPCHSA-N	429.304	1.086	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)c3ccn(C(F)F)n3)CCO2)C1	1781230761	ZPAUXTCCWPRXGZ-CVEARBPZSA-N	425.263	1.958	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)C3(Br)CC3)CCO2)C1	1781234515	NUPCLNPHFSNSPK-ZIAGYGMSSA-N	428.154	1.980	50	20	IDGD	
C#CC(=O)N1CC[C@@]2(C1)CN(C(=O)/C(C#N)=C/c1ccc(Br)cc1)CCO2	1783055044	LUMQDWGURVNBNC-MBNYPGIVSA-N	428.286	1.819	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN3CCSCC3)[C@H]2C1	1783498684	ZEMLCCVBWBWJPC-YRBFXIGRSA-N	438.421	1.251	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)Cc3cccc(C(F)(F)F)n3)CCO2)C1	1783873202	MBWLOUGPYOWVRV-KDOFPFPSSA-N	449.857	1.727	50	20	IDGD	
CCOC(=O)c1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](Cl)COC)C3)C2)cc1	1783879720	AEEHEDQINMKLCY-LAUBAEHRSA-N	438.908	1.561	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3CC(=O)N(C4CCCC4)C3)[C@H]2C1	1784967649	DAXRDROMQGOILL-PTIUUAQKSA-N	439.984	1.775	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)c1ccc(C(F)(F)F)nc1	1786096540	LNODUKFOORYBLP-XUXIUFHCSA-N	435.830	1.293	50	20	IDGD	
CCS(=O)(=O)N[C@@H](C)C(=O)Nc1ccc(C2(NC(=O)[C@@H](Cl)COC)CCC2)cc1	1786338600	CXEGKRLEFVOBTA-BBRMVZONSA-N	445.969	1.702	50	20	IDGD	
Cc1nc(N)sc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CO[Si](C)(C)C)C[C@@H]21	1786917553	OPRPAOUOHPHUAZ-IHRRRGAJSA-N	426.615	1.479	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC1(c2ccc(NC(=O)c3ncccn3)cc2)CCC1	1787434965	LQKXGULUJHMVEU-UHFFFAOYSA-N	431.456	1.537	50	20	IDGD	
Cc1ccc(COCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](O)CCl)C[C@@H]32)cc1C	1787530069	KGDBOHSKRHHSGR-MUGJNUQGSA-N	438.952	1.399	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cn4ccsc4n3)[C@H]2C1	1788392819	OHBMDCKBHIMBIX-MNXVOIDGSA-N	441.351	1.773	50	20	IDGD	
CCCCC[C@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1	1788609834	MJCOGTLZUKAMRE-FVCZOJIISA-N	445.564	1.495	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccnc(OC)c3)[C@H]2C1	1788909059	ONDSBBJHXINMEM-JONQDZQNSA-N	440.338	1.857	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc([N+](=O)[O-])[nH]3)[C@H]2C1	1789392982	YQJAGXDVUSRERU-ZPFDUUQYSA-N	429.271	1.300	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(Cl)ncn3)C[C@@H]21	1789870472	IMBCOTKBAAQMHH-NDBFUVGKSA-N	435.739	1.960	50	20	IDGD	
O=C(CN1C(=O)C=CC1=O)Nc1ccc(C2(NC(=O)CCBr)CCC2)cc1	1791692019	OCQZTYUFCUXLTN-UHFFFAOYSA-N	434.290	1.831	50	20	IDGD	
Cn1c(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)cc2ccccc21	1792923572	SCTILWDDEFWOSY-WKCHPHFGSA-N	445.328	1.353	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/C(=O)NCc1ccco1)C2	1793448817	JVXCPGDNSMAGPH-ZAELMVBLSA-N	437.924	1.449	50	20	IDGD	
CN(CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CC(C)(C)O)NC(=O)NCc1ccccc1	1795795428	QIHSPBLKZYJLTC-REPLKXPHSA-N	445.564	1.132	50	20	IDGD	
Cn1ncc(Br)c1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(C)(C)CCl)C2	1796747420	QMWWFNDOWNCBQQ-PTEHBNRSSA-N	447.761	1.651	50	20	IDGD	
COc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CO[Si](C)(C)C)cc1OC	1797957359	JXNABKKLPXQCOR-CWPLJXCYSA-N	436.581	1.759	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](COC)NC(=O)OC(C)(C)C)C2	1799269564	IFEHRAUQJCYXKP-DGADGQDISA-N	447.960	1.133	50	20	IDGD	
COc1nc(C)ccc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Br	1799348217	AKTSGBZKYHQKTA-XCCSTKFXSA-N	430.274	1.292	50	20	IDGD	
COc1nc(C)ccc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Br	1799348219	AKTSGBZKYHQKTA-ZMJPVWNMSA-N	430.274	1.292	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(F)cc([N+](=O)[O-])c1	1799629796	RIUZKVGXFPIEMV-ZSBFGKGUSA-N	439.516	1.789	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCc1noc(-c2ccccc2)n1)[C@@H](O)CCl	1799802980	ZBEDQWWXVFQWGE-YVSFHVDLSA-N	432.908	1.907	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(C(F)F)no1)C2	1800639685	MCHGCFBUDAYESJ-WJZNIJOASA-N	436.253	1.989	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C13CC(c4ccccc4)(C1)C3)C2	1800982434	FQTDZBBRLGUNDB-KYFMYTABSA-N	432.948	1.952	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCNC(=O)OC(C)(C)C	1801954750	VJSZFDPMHPTNLH-IVSAIRAKSA-N	431.961	1.898	50	20	IDGD	
C[C@@H]1[C@@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Cl)C3)CCN1C(=O)OC(C)(C)C	1802259199	YHVAVXCJFVDUNU-XMEMRUQMSA-N	447.935	1.756	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc3[nH]ccc3n2)[C@H]1c1cccnc1)[C@H](O)CCl	1803142954	PARQYOVBMUVSCG-KYNGSXCRSA-N	427.892	1.877	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc3ncncc3c2)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803143285	YWRSXUHXMKXBHI-FFZOFVMBSA-N	439.903	1.944	50	20	IDGD	
Cc1cccn2ncc(C(=O)N3CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]3c3cccnc3)c12	1803147337	HCUWTZCJGQCFBO-KPFFTGBYSA-N	441.919	1.957	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC2(CCCN(C(=O)[C@@H]3CCC(F)(F)C3)C2)CC1	1804769865	VIVBIUKRXUKPKI-QGZVFWFLSA-N	434.292	1.647	50	20	IDGD	
CCOc1cnc(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](Cl)COC)[C@H]2c2cccnc2)cn1	1804919633	MQQWEXFUULBKRL-BXWFABGCSA-N	447.923	1.844	50	20	IDGD	
O=C(COc1cc(Cl)ccn1)N1CCC2(CCCN(C(=O)[C@H](O)CCl)C2)CC1	1805522233	GOKKMIAZSLBJRY-OAHLLOKOSA-N	430.332	1.945	50	20	IDGD	
CC(=O)NCCC(=O)N1CC[C@@H](CNC(=O)CCBr)[C@@H]1c1cccnc1	1806346307	FYYOAWHGOUNQGA-YJBOKZPZSA-N	425.327	1.399	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)o1	1807360244	POEOIWGABAAXSQ-RXVVDRJESA-N	433.273	1.296	50	20	IDGD	
CCC1(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)CCC1	1807360760	CANXWCLGVCCKTG-CTNGQTDRSA-N	435.333	1.661	50	20	IDGD	
CCC1(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)CCC1	1807374707	HVOLBDCHSFFUKH-CTNGQTDRSA-N	435.333	1.661	50	20	IDGD	
CC(C)Cc1cc(C(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)n(C)n1	1807841439	DRDSCBVNDVSJJC-PWIZWCRZSA-N	447.967	1.933	50	20	IDGD	
CN1CCN(C2(C(=O)NC[C@@H]3CCN(C(=O)[C@@H](F)Cl)[C@@H]3c3cccnc3)CC2)CC1	1807943418	ZMJNZEFJLIVBKX-RCCFBDPRSA-N	437.947	1.402	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2nccc3nc[nH]c23)[C@H]1c1cccnc1	1808138625	LBWNFORODWZYPU-YZVOILCLSA-N	442.907	1.926	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@H]1CCN(C(=O)C2=NNC(=O)C2)[C@@H]1c1cccnc1	1808305756	AFHAUSWOLFYLPZ-DWQUBVKVSA-N	426.304	1.200	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)[C@H]2C[C@H]2F)[C@H]1c1cccnc1	1808416186	GPBFKUXVZXGEPR-GCFKLVLTSA-N	440.479	1.579	50	20	IDGD	
CC(C)CNC(=O)C(=O)NC[C@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1	1808444385	RYICCTXIXGZEKB-WBVHZDCISA-N	439.354	1.645	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1)c1cc[n+]([O-])cc1	1811190465	KUKWLWXAUFJGOS-SJLPKXTDSA-N	433.306	1.820	50	20	IDGD	
COc1ccc(C(=O)NC[C@@H]2CCN(C(=O)[C@H](C)Br)[C@H]2c2cccnc2)nn1	1811209427	MAIKWOGRFKEICZ-JDFRZJQESA-N	448.321	1.983	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)CN2CCCC2=O)[C@@H]1c1cccnc1	1812864906	QSLFVIWIPUVLKE-JCKWVBRZSA-N	437.338	1.493	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2cc(OC)nn2C)[C@@H]1c1cccnc1	1813029565	PSIUDOJOGNXYRB-RVKKMQEKSA-N	435.912	1.397	50	20	IDGD	
COCCn1ccc(C(=O)N2CC[C@H](CNC(=O)[C@@H](Cl)COC)[C@H]2c2cccnc2)n1	1813030343	HXHCOCUHPLMCDH-ZIFCJYIRSA-N	449.939	1.498	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)[C@H](C)N2C[C@@H]3C[C@H]3C2)[C@@H]1c1cccnc1	1813030985	IITYWEZOYIGCNG-KKMIJOEASA-N	434.968	1.681	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)CCN2C(=O)C=CC2=O)[C@H]1c1cccnc1)C(Cl)Cl	1813075282	AESXGVPHMUPHJO-DYVFJYSZSA-N	439.299	1.206	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2CC(c3ccccc3)=NN2)[nH]n1)[C@H](O)CCl	1814875149	QAZRRGXZDVCGQA-OKZBNKHCSA-N	444.923	1.768	50	20	IDGD	
CCC[C@@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1815317721	HATYFQUWJIJTQX-WBVHZDCISA-N	432.717	1.803	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@H]1CC=CCC1)CC2)c1ccc(B(O)O)cc1	1815343707	KFEUQAFXKYTXJO-XJKSGUPXSA-N	425.319	1.405	50	20	IDGD	
CCC1(C(=O)N[C@@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)CCC1	1815344365	VRNUJFFQHUKCSG-OAHLLOKOSA-N	427.335	1.629	50	20	IDGD	
CS(=O)(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)CCBr)n[nH]1	1816784808	NXXMNDYRPNUEQP-LBPRGKRZSA-N	435.344	1.622	50	20	IDGD	
O=C(N[C@@H]1CCc2nc(NC(=O)[C@@H](F)Cl)sc2C1)c1cc2n(n1)CCCNC2=O	1817121787	BMFYEAFFEDQMSY-AMIZOPFISA-N	440.888	1.233	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)/C=C/c2ccoc2)[nH]n1)c1cccc(B(O)O)c1	1817474769	YUVVLXYUDMAKEH-UCFODXPJSA-N	434.261	1.702	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)Cc2cccnc2)n[nH]1	1817623881	ZXHFIXXMQWZCMB-QGZVFWFLSA-N	427.509	1.413	50	20	IDGD	
Cn1cc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@H](O)CCl)CC3)c(C(F)F)n1	1817823839	RNZQNLJFDAWYAD-GMSGAONNSA-N	433.868	1.640	50	20	IDGD	
CCOC(=O)N[C@@H](O)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CO[Si](C)(C)C)[nH]n1	1819241703	OJUJYBSOVOIYAO-DYVFJYSZSA-N	441.561	1.318	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)C(F)(F)Cl)[nH]n1	1819404344	HSXLLBKRYNRBMK-LBPRGKRZSA-N	441.826	1.546	50	20	IDGD	
CCc1cc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@@H](Cl)COC)CC3)nn1C	1820971961	OROMHABTWJKXDY-JQWIXIFHSA-N	425.942	1.919	50	20	IDGD	
Cc1ccccc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(B(O)O)cc1)CC2	1822005173	RYTBOVRZCBBXAE-INIZCTEOSA-N	435.314	1.671	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCN2CCN(C)CC2)[nH]n1	1822368318	HHVSJLZFASYTNY-DOTOQJQBSA-N	440.976	1.293	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@H]2CCC(=O)N2)CC1	1824094678	XUWGCYFLWBBGRZ-IMJJTQAJSA-N	428.371	1.916	50	20	IDGD	
O=C(NCCC(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H](O)CCl)CC1)c1ccc[nH]1	1824180694	LUVFEXVYRXUMJK-ZWKOTPCHSA-N	438.956	1.354	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2CNC(=O)O2)CC1	1824574749	FPDKFAONOUBAOU-ILXRZTDVSA-N	430.343	1.888	50	20	IDGD	
CC[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(O)n[nH]1)CC2	1825447434	XBHFNNGAFBVWBN-HTQZYQBOSA-N	428.312	1.971	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(O)nc(O)n1)CC2	1825641498	OSHZNBJZULSIFK-NKWVEPMBSA-N	442.295	1.354	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](C)n1ccnn1)CC2	1825647693	VEUVCEMTHHATAX-GUBZILKMSA-N	427.328	1.691	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnc(OC)cn1)CC2	1825999932	YCHAQPGSRAUTGV-UWVGGRQHSA-N	425.898	1.421	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC([C@H]2CCCCN2C(=O)CN2CCNC2=N)CC1	1826873601	NCXHQFWLKOHRPA-JKSUJKDBSA-N	442.402	1.620	50	20	IDGD	
COC[C@@H](NC(C)=O)C(=O)N1CCC([C@H]2CCCCN2C(=O)CO[Si](C)(C)C)CC1	1829102856	OZNQNNKMVXYFOT-RTBURBONSA-N	441.645	1.609	50	20	IDGD	
Cc1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCBr)C3)C2)c1F	1830094304	NHKHQQIWMCTNSD-LJQANCHMSA-N	443.313	1.989	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4ncnn4c3)C2)C1	1830362078	KOIZKWMCASMALW-FQEVSTJZSA-N	435.912	1.064	50	20	IDGD	
Cc1cccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)c1Cl	1830737304	GZZUIAXZHCXRDV-DNVCBOLYSA-N	431.316	1.318	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4cncn4c3)C2)C1	1831651494	PXYCLMJJFARTCD-GHTZIAJQSA-N	434.924	1.812	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ncccc3C)CCO2)C1	1831842212	RGXCVEWHHAQXMC-KXBFYZLASA-N	440.338	1.634	50	20	IDGD	
Cc1onc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)c1C	1831981660	GPDAYODHTDHJIY-CZUORRHYSA-N	434.262	1.052	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cnc(Cl)nc3)CC2)CC1	1833015227	SUUVJQVLVDVATM-INIZCTEOSA-N	444.363	1.569	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)Cc3cccc(Cl)n3)CC2)CC1)[C@H](O)CCl	1833307978	FSZPCVLYNWKQLR-QGZVFWFLSA-N	443.375	1.449	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cccn4cncc34)CC2)CC1)[C@@H](O)CCl	1833310321	QBUGVANQPBCBPP-IBGZPJMESA-N	433.940	1.119	50	20	IDGD	
CCOc1cccc(C(=O)N2CCC(N3CCC(NC(=O)[C@H](O)CCl)CC3)CC2)c1	1833313265	CRNRPHNLVZZCAI-HXUWFJFHSA-N	437.968	1.870	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccncc3)CCO2)C1	1834012276	WKBXSTWLAIPUDA-RDTXWAMCSA-N	426.311	1.183	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3ncn(C)n3)CC2)CC1	1834090389	OVWJWTBTYHEZLH-HNNXBMFYSA-N	441.374	1.174	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3scnc3C)CCO2)C1	1834269412	YKCVVYGCFPYFGE-CXAGYDPISA-N	446.367	1.695	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cnc4ccccn34)CC2)CC1	1835348938	JOUCTRFBEUJZKK-GOSISDBHSA-N	447.967	1.773	50	20	IDGD	
COc1ccc(C(=O)NC2CCN(C3CCN(C(=O)C(Cl)Cl)CC3)CC2)nn1	1836057300	CBOWOJXCDSGOOL-UHFFFAOYSA-N	430.336	1.474	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)CSc3ncccn3)CCO2)C1	1836109955	STGLCPCBCGQWEN-IBGZPJMESA-N	442.969	1.290	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3cc(C#N)c[nH]3)CC2)CC1	1836170824	OKOLNBBWMCNLQA-CYBMUJFWSA-N	436.354	1.855	50	20	IDGD	
Cc1cc(C(=O)N2CCC(OC3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)cc(O)n1	1836718019	PPMDIRNSQJTHHP-KRWDZBQOSA-N	425.913	1.308	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC(OC2CCN(C(=O)Cc3cnccn3)CC2)CC1	1836774712	XZFXDULXYACHBF-UHFFFAOYSA-N	434.613	1.869	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)/C=N/N3CCCCC3)CCO2)C1	1837445320	PNELIUCGLKYBDU-IYVWXJGLSA-N	449.379	1.151	50	20	IDGD	
CC(C)CC(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1	1837645308	KDBWFOUWSCYQOY-UHFFFAOYSA-N	431.537	1.343	50	20	IDGD	
C[C@@H](Nc1ccccn1)C(=O)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1837747207	JOXLJQWRZWHEIY-FZKQIMNGSA-N	431.320	1.142	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)c3nc[nH]n3)CC2)CC1	1838012985	APTZIUBWYWCQAQ-AWEZNQCLSA-N	428.331	1.590	50	20	IDGD	
O=C(Cc1cnc[nH]1)N1CCC(OC2CCN(C(=O)[C@H](F)Br)CC2)CC1	1838072553	HNQHVQLCOWPJDZ-INIZCTEOSA-N	431.306	1.641	50	20	IDGD	
O=C(Nc1cccnc1)C(=O)N1CCC(OC2CCN(C(=O)[C@H](F)Cl)CC2)CC1	1838082047	DAGIMEHYRZIBSF-INIZCTEOSA-N	426.876	1.553	50	20	IDGD	
Cc1nccnc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1	1838217012	QMEMPISCTGZQIX-ZWKOTPCHSA-N	431.320	1.091	50	20	IDGD	
CC(F)(F)C(C)(C)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H](F)Br)CCO2)C1	1839199375	VEYHDPQROMWVJO-BDJLRTHQSA-N	445.276	1.815	50	20	IDGD	
O=C(c1ccc(O)c(F)c1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839201810	KBXJNSQEZPVDOB-PBHICJAKSA-N	449.248	1.292	50	20	IDGD	
C=C(C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](Br)CC)C2)C1)C(F)(F)F	1839894915	YRVSDQCKGPKGRZ-IUODEOHRSA-N	443.260	1.735	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)C3(COC)CC3)C2)C1	1839962664	NBPUDRHROJOLIX-RDTXWAMCSA-N	433.343	1.043	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3=COCCC3)C2)C1	1839966493	HFHPOLKINCUPCP-CRAIPNDOSA-N	431.327	1.311	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccncc3Cl)C2)C1	1840033644	MFSKRNHGEUYZKL-SJCJKPOMSA-N	446.729	1.588	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccccc3OC)C2)C1	1840153712	ACUWHRCZQUKOOT-OXQOHEQNSA-N	426.897	1.019	50	20	IDGD	
C=CC(=O)N[C@@H](C)C(=O)N1CC2(CCCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C1	1841924723	VERXIBOEBIRDFQ-KBPBESRZSA-N	442.944	1.013	50	20	IDGD	
CCN(C)[C@@H](C)C(=O)N1CC2(CCCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C1	1841925292	IHYGLGXSDBMPRY-GJZGRUSLSA-N	430.977	1.662	50	20	IDGD	
O=C(c1c(Cl)cccc1Cl)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843011686	GKDDHZXRRRBSOM-UHFFFAOYSA-N	433.100	1.804	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)c2ccc(OC(F)(F)F)cc2)C1	1845316580	BXOSISOSZOFNIA-UHFFFAOYSA-N	448.206	1.396	50	20	IDGD	
O=C(NNC(=O)c1csc(S(=O)(=O)N2CCc3ccccc3C2)c1)c1ccncc1	11763062	MWCWKKKOYJJQHL-UHFFFAOYSA-N	442.522	1.965	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)c2nn(-c3ccc(F)cc3)c3c2CCC3)c2ccccc2c1=O	14044449	SCDPMFIVKQABHX-UHFFFAOYSA-N	446.442	1.822	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)N2CCC(C(=O)NCCN(C)C)CC2)c1C	217176209	XYSQCSFAHPHQRA-QNGOZBTKSA-N	429.565	1.575	50	20	IDGD	
O=C(CNC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)Nc1cccc2ccccc12	725859494	FILKPUFBNLBMQI-UHFFFAOYSA-N	430.428	1.398	50	20	IDGD	
O=C(CNC(=O)c1ccc(Oc2ccccc2)cc1)NNC(=O)CNC(=O)c1ccco1	725902313	KBCVNUYIXFDDTI-UHFFFAOYSA-N	436.424	1.379	50	20	IDGD	
CC(=O)N1CCc2ccccc2[C@H]1CC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	728000016	JOPCADDXPIJWEH-LJQANCHMSA-N	433.468	1.231	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCCCC(=O)NNc2nc(-c3cccnc3)no2)cc1C	728078506	ICURJDRIXJQROW-UHFFFAOYSA-N	430.490	1.950	50	20	IDGD	
CN(C)N(C(=O)CNC(=O)c1ccc(Oc2ccccc2)cc1)[C@H]1CCS(=O)(=O)C1	728176199	LNTJFXUKFJSMHS-KRWDZBQOSA-N	431.514	1.701	50	20	IDGD	
COc1nc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc2ccccc12	728334187	XDQAHQHNRNYOHK-GOSISDBHSA-N	437.408	1.388	50	20	IDGD	
Cc1ccc(CN2C[C@H](C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)CC2=O)cc1	728847892	CVNFOMQWXNHTLM-LJQANCHMSA-N	436.516	1.198	50	20	IDGD	
CN(CC1CCN(CC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)CC1)C(=O)OC(C)(C)C	728933922	NYHBHZREAAQVCR-UHFFFAOYSA-N	449.508	1.935	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)c1ccc2c(c1)CC(=O)N2C	728953606	IJDGBWHEPWOVNR-CQSZACIVSA-N	437.504	1.304	50	20	IDGD	
Cc1nc2c(C(N)=O)cnn2c(C)c1CCC(=O)NNC(=O)Cn1ccc2ccccc21	729450845	WJMVPDLYHFBING-UHFFFAOYSA-N	433.472	1.180	50	20	IDGD	
C[C@H](Sc1ncccc1C(=O)NNC(=O)COc1ccccc1O)C(=O)N1CCCC1	730778868	XVKMSQQGBYPQIR-AWEZNQCLSA-N	444.513	1.730	50	20	IDGD	
C[C@@H]1CCC[C@@H](NC(=O)CN2CCN(C(=O)NNC(=O)c3ccc(C#N)cc3)CC2)C1	731223409	ZIVZQAZXXZRHSO-VQIMIIECSA-N	426.521	1.225	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CSc2nncn2CCc2ccccn2)cc1OC	731937134	IFDMUYFSZNCZPF-UHFFFAOYSA-N	442.501	1.486	50	20	IDGD	
CC(=O)NCCNC(=O)CCC(=O)NNC(=O)c1cc2c(s1)CC[C@@H](C(C)(C)C)C2	732258796	HOMWOKXAGSXUAX-OAHLLOKOSA-N	436.578	1.693	50	20	IDGD	
CCCc1ccc(N2C[C@H](C(=O)NNC(=O)CCN3C[C@H](C)O[C@H](C)C3)CC2=O)cc1	732264682	WGQMYZARKDEADY-ZIFCJYIRSA-N	430.549	1.639	50	20	IDGD	
Cc1ccc(C(=O)N[C@H](C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)C(C)C)cc1	734239873	YHOCPRKWHGWJRQ-INIZCTEOSA-N	435.525	1.605	50	20	IDGD	
CCOCCCN1CC[C@@H](NC(=O)NNC(=O)c2cc(Br)c[nH]2)[C@H](C)C1	734683315	GVFVAZMEAUMATP-TZMCWYRMSA-N	430.347	1.858	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)COc2ccccc2Cl)CC1	735117925	JGLIQQVKAGODJB-UHFFFAOYSA-N	439.925	1.193	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)CNC(=O)c2cc(F)cc(F)c2)cc1C	736797071	SDHUSTSGKLSYSO-UHFFFAOYSA-N	439.440	1.631	50	20	IDGD	
CN(CC(=O)NNC(=O)c1cccc2cccnc12)S(=O)(=O)c1cccc([N+](=O)[O-])c1	737820577	LZFCVTIRMCFZHR-UHFFFAOYSA-N	443.441	1.225	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1Br)c1ccc(-n2cnnn2)cc1	739681147	UTZWXNWQEWCPLB-UHFFFAOYSA-N	432.194	1.408	50	20	IDGD	
COc1ccc(C(=O)NNc2ccnc(N(C)C)n2)cc1S(=O)(=O)N1CCCCCC1	740107913	QCDGTCQPRXKLNX-UHFFFAOYSA-N	448.549	1.873	50	20	IDGD	
CC(C)[C@@H](C(=O)OCC(=O)NNC(=O)c1ccc(Cl)cc1)N1C[C@H](C)O[C@H](C)C1	741027194	QTKANIYBBZWORE-IYOUNJFTSA-N	425.913	1.778	50	20	IDGD	
CS(=O)(=O)[C@H]1CCC[C@@H](NC(=O)NNC(=O)COc2ccc(Br)cc2)C1	741092221	AIQPNDUBBWWQLD-OCCSQVGLSA-N	448.339	1.514	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3cnc4ccsc4c3)cc2)CC1	743334515	KJTFGOXESGMUCX-UHFFFAOYSA-N	431.543	1.989	50	20	IDGD	
Cc1ccc(NC(=S)NNC(=O)c2ccc(S(=O)(=O)CC(=O)N(C)C)cc2)c(C)c1	743819998	KXFMEJNLFSHBJX-UHFFFAOYSA-N	448.570	1.797	50	20	IDGD	
C[C@@H]1Oc2ccccc2N(CCC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)C1=O	743830573	HGQXKCPEKGXTQI-ZDUSSCGKSA-N	446.485	1.447	50	20	IDGD	
CCS(=O)(=O)c1ccc(C(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)cc1	743831495	YECDQHGEGTVNPD-UHFFFAOYSA-N	425.488	1.350	50	20	IDGD	
CS(=O)(=O)CC[C@H](NC(=O)c1ccc(Cl)cc1)C(=O)NNC(=O)NC1CCCC1	744059561	TXOUKEDKZGXCTO-HNNXBMFYSA-N	444.941	1.146	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CN2CCN(CC(=O)N[C@@H]3CCC[C@H](C)C3)CC2)c1	744402040	HSPDXLUCAJRZAQ-AZUAARDMSA-N	429.565	1.069	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)C[C@@](O)(c2nc(C)cs2)C(F)(F)F)c1	744888126	CGOKZQGAHGGWDX-QGZVFWFLSA-N	445.419	1.904	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(CSc3nc[nH]n3)cc2)cc1	744996079	IUVFLEKCRLDEPQ-UHFFFAOYSA-N	436.453	1.587	50	20	IDGD	
Cc1nn(C)c2sc(C(=O)N[C@@H](C)C(=O)OCC(=O)NNC(=O)c3ccccc3)cc12	745269737	CZIALURJQCBYDW-LBPRGKRZSA-N	443.485	1.066	50	20	IDGD	
NC(=O)CSc1ccccc1C(=O)NNC(=O)COc1ccc(Br)cc1	746095156	JGILOJAKHFNOQJ-UHFFFAOYSA-N	438.303	1.867	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN(C(=O)NC2CCCC2)C1)c1cc(Br)c[nH]1	746103597	QEEUAKUHASRLFM-NSHDSACASA-N	426.315	1.902	50	20	IDGD	
NS(=O)(=O)c1cccc(N2C[C@H](C(=O)NNc3ccccc3C(F)(F)F)CC2=O)c1	746113675	VOVMTDHJEYMLKJ-LLVKDONJSA-N	442.419	1.849	50	20	IDGD	
Cc1cc(-n2c(C)cc(C(=O)OCC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)c2C)no1	746171640	RPFOXCIKYYHIHR-UHFFFAOYSA-N	441.400	1.917	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1ccc(Br)nc1	746614095	BYDZICCRDMOMPH-UHFFFAOYSA-N	441.307	1.622	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)N2CCN(S(=O)(=O)c3ccc(F)cc3)CC2)cc1	747102388	YXXHRTLCTMRAAP-UHFFFAOYSA-N	431.449	1.058	50	20	IDGD	
COCCOCC(=O)NC1CCC(C(=O)NNC(=O)c2ccc(Cl)cc2F)CC1	747329821	MWDPMYVDOAIVDJ-UHFFFAOYSA-N	429.876	1.578	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)CSc1nnc(S)s1	747348321	IHNSAHNZQNYDFX-UHFFFAOYSA-N	438.604	1.279	50	20	IDGD	
CCS(=O)(=O)CCOc1ccc(S(=O)(=O)NNC(=O)c2ccc(Cl)nc2)cc1	747606867	YFKNEICRBIQDRK-UHFFFAOYSA-N	447.922	1.172	50	20	IDGD	
COc1cc(OC)cc(N2CC[C@H](NC(=O)NNC(=O)CNC(=O)c3cccs3)C2)c1	748659489	AAYUUHIDWMLTTN-ZDUSSCGKSA-N	447.517	1.104	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN(Cc2cccnc2)C1)c1csc(N2CCOCC2)n1	749161668	OFELHTIICSKLPK-INIZCTEOSA-N	430.534	1.048	50	20	IDGD	
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	749583568	MSMYRTSLDIJAJE-JXFKEZNVSA-N	434.504	1.517	50	20	IDGD	
COCCCOc1ccc(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1	749866950	UDJZKYOHJUNKSO-UHFFFAOYSA-N	441.893	1.478	50	20	IDGD	
CCOc1cc(C=NNC(=O)CSc2nnc(O)nc2O)ccc1OCC(F)(F)F	750933070	WQRZSIATUPLDRD-UHFFFAOYSA-N	447.395	1.865	50	20	IDGD	
COC(=O)c1ccc(S(=O)(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)c(Cl)c1	751268269	ZYCNUTUSWHYHNL-UHFFFAOYSA-N	439.877	1.692	50	20	IDGD	
Cn1nnc2cc(C(=O)NNC(=O)[C@H]3Cc4ccccc4CN3Cc3ccccc3)cnc21	755203771	TXPCSUOZTFLLJQ-OAQYLSRUSA-N	441.495	1.751	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)c2cc(Br)ccc2O)cc1S(N)(=O)=O	756635994	CZKDKDROBZGKOD-UHFFFAOYSA-N	443.279	1.577	50	20	IDGD	
C[C@H]1C[C@H](C)CC2(C1)NC(=O)N(CC(=O)NNC(=O)Cc1nc3ccccc3n1C)C2=O	756863247	IWVHZHQFTKLUQL-KBPBESRZSA-N	440.504	1.010	50	20	IDGD	
C[C@H]1C[C@H](NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)CN1Cc1ccccc1	757762104	JMSYPDHJVNIXKU-RDJZCZTQSA-N	434.500	1.541	50	20	IDGD	
CO[C@@](C)(C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)c1ccccc1F	757768655	ZJVHQUZPRCXRMY-OAQYLSRUSA-N	449.504	1.933	50	20	IDGD	
COc1ccc2c(-c3ccccc3)c(C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)oc2c1	758036378	RGRQTJDOVNSIBT-LBPRGKRZSA-N	431.470	1.807	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)c1ccc(C(=O)Nc2ccccc2)cc1	758094402	CTTSEPBRFJKRER-UHFFFAOYSA-N	427.424	1.989	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2cccc3c2CCN3S(C)(=O)=O)cc1OC	758298421	IOUCEMDGIBHWIT-UHFFFAOYSA-N	434.474	1.492	50	20	IDGD	
CCS(=O)(=O)N1CCC(CNC(=O)NNC(=O)Cc2cccc3ccccc23)CC1	758742056	IZNCPVDADFPAPT-UHFFFAOYSA-N	432.546	1.774	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)[C@@](C)(O)CN2C(=O)C(C)(C)c3ccccc32)cc1C	760054893	ZLTVVGDTHMEEIM-DEOSSOPVSA-N	439.512	1.905	50	20	IDGD	
CCc1ccc(C=NNC(=O)C[C@@H](C(=O)NN=Cc2ccc(CC)o2)N2CCOCC2)o1	760260511	PKIACOKUSVTLTL-FQEVSTJZSA-N	443.504	1.689	50	20	IDGD	
Cc1nnc(NNC(=O)c2c[nH]c3c(Cl)cc(Br)cc3c2=O)nc1O	760792611	BWNSDCBRNMENFI-UHFFFAOYSA-N	425.630	1.900	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)c1ccc(I)c(O)c1	760797415	HDCJMTQHVDLUBI-UHFFFAOYSA-N	430.173	1.976	50	20	IDGD	
COc1ccc(C(=O)NCCNC(=O)NNC(=O)CSc2ccccc2OC)cc1	761667851	BIYDISZBZSERTQ-UHFFFAOYSA-N	432.502	1.556	50	20	IDGD	
O=C(NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12)c1ccc([N+](=O)[O-])cn1	761783874	FOVQIZHHXAPEDH-UHFFFAOYSA-N	444.407	1.823	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)[C@H](C)NS(=O)(=O)c1ccc(C)cc1	762362025	TVECNZLXTJBDQF-AWEZNQCLSA-N	437.543	1.610	50	20	IDGD	
CC(=NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1)c1ccc(C#N)s1	762450835	YJLIVUUUIQFHDR-UHFFFAOYSA-N	445.570	1.775	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H]2CC[C@@H]3SCCS[C@@H]32)c1	763061444	GCZIKLKWQQFHNC-QLFBSQMISA-N	444.604	1.261	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)c2cc(F)ccc2NS(C)(=O)=O)n[nH]1	763154569	OGUFZDFPHCZKHV-UHFFFAOYSA-N	447.448	1.671	50	20	IDGD	
O=C(NNC(=O)c1cc2ccccc2cc1O)C(=O)Nc1ccn(Cc2ccccn2)n1	763516544	ARVCEROBZDDVCY-UHFFFAOYSA-N	430.424	1.585	50	20	IDGD	
CCCNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2ccc(OC)c(OC)c2)c1	763543864	SIHDLVJIFLXDPN-UHFFFAOYSA-N	428.445	1.243	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)nn1-c1ccccc1Cl	763547903	GITPISRSGCIWGG-UHFFFAOYSA-N	441.831	1.963	50	20	IDGD	
CCN(c1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1)C(C)C	763572183	PWPRQVUCUOGZFX-IBGZPJMESA-N	426.473	1.847	50	20	IDGD	
O=C(NNC(=O)c1sc2ccccc2c1Cl)C(=O)Nc1cccnc1-n1cncn1	763576440	AKSUQOYHLPJBBC-UHFFFAOYSA-N	441.860	1.930	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)[nH]n1)C(=O)Nc1ccc(NC(=O)C2CC2)cc1	763601059	NPFAONKQRNPMSO-UHFFFAOYSA-N	432.440	1.825	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(F)cc2OCC(F)F)c1	763623364	KJDBUFLPRFLJKL-UHFFFAOYSA-N	425.363	1.943	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(N3CCSCC3)cc2)cc1	763659351	MQQHFNSQLKWBPD-UHFFFAOYSA-N	444.513	1.413	50	20	IDGD	
COC(=O)c1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)COc1cc(C)ccc1C	763668059	HCNPTKBYHFJPKY-UHFFFAOYSA-N	433.848	1.908	50	20	IDGD	
COC(=O)CCc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C)c(C)c2)cc1	763679763	LEOPNZOLVATADM-UHFFFAOYSA-N	427.457	1.574	50	20	IDGD	
CN1CCN(c2ccccc2NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)CC1	763683982	DZEBGPQJQDBKAE-UHFFFAOYSA-N	445.907	1.257	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)C(=O)Nc2cccc(OC[C@H]3CCCO3)c2)c1	763753749	JKMIKBROYXIHJH-LJQANCHMSA-N	426.473	1.710	50	20	IDGD	
CC(C)C(=O)NNC(=O)C(=O)Nc1cccc(S(=O)(=O)/N=C2/CCCCCN2C)c1	763821559	SVDLPCNFQKQMRW-KQWNVCNZSA-N	437.522	1.022	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cnc(C(C)(C)C)nc2)cc1	763878365	PHDLZDPTVSRIMR-ZDUSSCGKSA-N	427.461	1.530	50	20	IDGD	
CNC(=O)c1ccc(C)c(NC(=O)C(=O)NNC(=O)CCSc2ccc(F)cc2)c1	763895850	IZKIFLXGSMSTIR-UHFFFAOYSA-N	432.477	1.762	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3ccc(-n4cnnn4)cc3)cc2C1	763940846	JGOAJFUCZLXJPW-LLVKDONJSA-N	425.474	1.248	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3ncn(Cc4ccccc4)n3)cc2C1	763942499	NELVYKNTSQXOQG-ZDUSSCGKSA-N	438.513	1.912	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)C2=S=C3CC[C@@H](C)CC3=C2)n(C2CCOCC2)n1	763947893	DPFXRMLSBZXQPV-GFCCVEGCSA-N	445.545	1.467	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc(NC(=O)c2ccccc2)nc1	764040697	JRROYYNXEKSUAW-UHFFFAOYSA-N	433.424	1.742	50	20	IDGD	
O=C(NNC(=O)c1cccc(Br)c1)C(=O)Nc1cccnc1OCC(F)F	764058509	JKOUYSTUVLZWCX-UHFFFAOYSA-N	443.204	1.888	50	20	IDGD	
CNC(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(Br)c2)cc1	764059083	OZDVXUYBOZMXOK-UHFFFAOYSA-N	433.262	1.137	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2ccc(C)c(C(=O)NC(C)C)c2)cc1	764131187	HGXNPQNKRKPGEG-UHFFFAOYSA-N	440.500	1.861	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1cccc(Cl)c1-n1cccn1	764137064	YLWDBFFTKZFOHV-UHFFFAOYSA-N	427.848	1.863	50	20	IDGD	
CCCS(=O)(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)CCOc2ccccc2)c1	764160440	CPHMBJMXVZNMDO-UHFFFAOYSA-N	448.501	1.393	50	20	IDGD	
O=C(NNC(=O)c1ccoc1)C(=O)Nc1ncn(Cc2cccc(Br)c2)n1	764162556	DRVLOOXEOFUJFN-UHFFFAOYSA-N	433.222	1.082	50	20	IDGD	
C[C@@H](C(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)CCc2ccco2)c1)n1cccn1	764166911	RYUMWTSBDVILLC-AWEZNQCLSA-N	438.444	1.395	50	20	IDGD	
C[C@H](C(=O)NNc1c(F)cc(C(=O)NC2CC2)cc1F)N1C(=O)[C@H]2CCCC[C@@H]2C1=O	764335382	UTIUEVRRWHDWQC-SWHYSGLUSA-N	434.443	1.864	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2cnccc2SC)n[nH]1	764378199	VPMNDYDWJITLIE-UHFFFAOYSA-N	426.458	1.602	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)cc1F	764380185	QUZUTKYWXSSZLH-UHFFFAOYSA-N	441.362	1.609	50	20	IDGD	
Cc1nc(-c2ccccc2NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)no1	764382372	INCPJWNWESTZAM-UHFFFAOYSA-N	437.441	1.896	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)C(=O)Nc1ccc2nc(N3CCOCC3)sc2c1	764388217	DVCHVILTXZFILV-UHFFFAOYSA-N	440.485	1.236	50	20	IDGD	
Cc1ccc(C)c(Sc2ccc(NC(=O)C(=O)NNC(=O)[C@@H]3COCCO3)cc2)c1	764430051	RHTQEWSYTXLJHK-KRWDZBQOSA-N	429.498	1.956	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C[C@H]2CN(C(=O)OC(C)(C)C)CCO2)nc2ccccc21	764547641	OKUQOWKGOXIGEN-AWEZNQCLSA-N	431.493	1.289	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNS(=O)(=O)c3sc(C)nc3C)CC2)cc1	765124505	BBIWCIWQIYJSJE-UHFFFAOYSA-N	437.591	1.196	50	20	IDGD	
CCCN(CCC)S(=O)(=O)NNC(=O)CN1CCN(Cc2ccc(C)cc2)CC1	765126156	JDSUSHCNHGPKIA-UHFFFAOYSA-N	425.599	1.100	50	20	IDGD	
Cc1ccc(N2C[C@H](C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)CC2=O)cc1F	765310398	FVSLSLSDQMVSOF-CQSZACIVSA-N	436.484	1.939	50	20	IDGD	
CCCNc1ccc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1	765620537	SHDKTDCDHPFGBV-UHFFFAOYSA-N	433.534	1.903	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)N[C@H]2CN(Cc3ccccc3)C[C@@H]2C)nc1	765892743	MNZXEFXJRDKJLW-LPHOPBHVSA-N	446.577	1.915	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)[C@H]1CCCN1Cc1ccccc1	766635689	CRLJCNLPILCSCC-JOCHJYFZSA-N	449.555	1.256	50	20	IDGD	
Cc1nccn1CCCC(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	766660621	PPEJCASFNXZILV-UHFFFAOYSA-N	432.956	1.590	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(Br)c(C(=O)NNC(=O)C(C)(C)O)c1	768256427	POYOPRGQGIFSLR-UHFFFAOYSA-N	436.328	1.012	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)COc1cccc(NC(=O)C2CC2)c1	768639701	SVIFIFGYSQQSTP-UHFFFAOYSA-N	433.486	1.969	50	20	IDGD	
O=C(NNc1ccc(F)c([N+](=O)[O-])c1)c1ccc(S(=O)(=O)NC[C@H]2CCCO2)cc1	771590720	OUKNBVGNEUZPJZ-CQSZACIVSA-N	438.437	1.948	50	20	IDGD	
Cc1cc(C(=O)O)cc(S(=O)(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)c1F	771606629	IISKMSQTCXDOON-UHFFFAOYSA-N	443.840	1.112	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)c1cc(S(=O)(=O)N(C)C(C)C)ccc1F	771996428	UYCDEYMYVADMOX-CYBMUJFWSA-N	445.513	1.593	50	20	IDGD	
Cc1nn(CC(F)(F)F)c(C)c1CC(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772195642	BZRYBNZAIOQQGG-UHFFFAOYSA-N	445.829	1.722	50	20	IDGD	
C[C@@H]1C[C@H](NC(=O)NNC(=O)CNC(=O)OC(C)(C)C)CCN1C(=O)OC(C)(C)C	772483556	VEUJLTHLCZUGHD-CHWSQXEVSA-N	429.518	1.630	50	20	IDGD	
Cn1cc(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)c(-c2ccccc2)n1	772736708	OBHBXDSHTSKBAU-UHFFFAOYSA-N	441.513	1.865	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2ccc(N3CCC(CN(C)C)CC3)cc2)n1	773731762	UZPWAHIRSCARKH-UHFFFAOYSA-N	427.509	1.345	50	20	IDGD	
COc1ccc(C(=O)N2CCN(C)CC2)cc1NC(=O)C(=O)NNc1cccc(Cl)c1	773744404	BCEZBWJVPYYETK-UHFFFAOYSA-N	445.907	1.818	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2cnn(CC(F)(F)F)c2)cc(OC)c1OC	775251267	PKQUXMFBEWMNDI-UHFFFAOYSA-N	438.384	1.095	50	20	IDGD	
C[C@@H](NCC(=O)NNC(=O)c1ccccc1Cl)c1cccc(S(=O)(=O)N(C)C)c1	775338441	MQNYOCVFVTZTKQ-CYBMUJFWSA-N	438.937	1.702	50	20	IDGD	
Cc1ccc(S(=O)(=O)NC[C@H](NCC(=O)NNC(=O)C2CC2)c2ccccc2)c(C)c1	775461912	FNTCQQHYWDFQPU-IBGZPJMESA-N	444.557	1.470	50	20	IDGD	
COc1nc(C)c(Br)cc1C(=O)OCC(=O)NNC(=O)c1cccc(C#N)c1	777115561	BIWCTHXHUSSGFM-UHFFFAOYSA-N	447.245	1.651	50	20	IDGD	
O=C(COc1ccccc1-c1ccccc1)NNC(=O)NC[C@H]1COC2(CCOCC2)O1	777756037	GUUDDJTYQLHRBN-SFHVURJKSA-N	441.484	1.985	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(C(=O)NNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])n(C)c1	778524625	OFBXGSCOCVZLSV-UHFFFAOYSA-N	435.384	1.959	50	20	IDGD	
Cc1ncsc1C(=O)NNC(=O)C(=O)Nc1cc(Cl)ccc1OC[C@H]1CCOC1	778711161	VNQMXBWUOKVRSZ-NSHDSACASA-N	438.893	1.920	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)F)cc1)[C@H](O)[C@H](O)c1nc2ccccc2s1	779535994	GOENUZZAZWXKDM-KGLIPLIRSA-N	443.453	1.830	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NOCCC(F)(F)F)c1	779696120	XBWXIPHGLXMEPE-UHFFFAOYSA-N	426.417	1.545	50	20	IDGD	
Cc1ccc(C(F)(F)C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1	780324401	ONQVSAMFIJAFLU-UHFFFAOYSA-N	425.457	1.863	50	20	IDGD	
CC(=O)N1CCN(c2cccc(NC(=O)C(=O)NNC(=O)CCC3CCCCC3)c2)CC1	782118677	YTFRKPSZHJLCDP-UHFFFAOYSA-N	443.548	1.802	50	20	IDGD	
CN(C(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(O)cc2)cc1)c1ccccc1	782832992	WHFHPAPLNOCPME-UHFFFAOYSA-N	446.463	1.997	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)c(C)c1F	782916091	YTDQMAWXGYIQOP-UHFFFAOYSA-N	429.857	1.422	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(F)c(NC(=O)C(=O)NNc2ncccc2C(F)(F)F)c1	783120404	LALCIPNABJCJQX-UHFFFAOYSA-N	449.386	1.572	50	20	IDGD	
COc1ccc(C(=O)N2CCN(C)CC2)cc1NC(=O)C(=O)NNc1ccc(F)cc1F	783346944	CKPMXSKRXBITSG-UHFFFAOYSA-N	447.442	1.443	50	20	IDGD	
Cn1c(=NNC(=O)C(=O)Nc2cc(C3CC3)nn2-c2ncccn2)sc2ccccc21	783351922	OBTXNZBQYGTBMC-UHFFFAOYSA-N	434.485	1.664	50	20	IDGD	
Cn1cnc2cc(NC(=O)C(=O)NNc3ccc(S(=O)(=O)C(F)(F)F)cc3)ccc21	783408490	KISJBHPCIJFLKJ-UHFFFAOYSA-N	441.391	1.949	50	20	IDGD	
Cc1ccc(Oc2ccc(NC(=O)C(=O)NNC(=O)CNC(=O)c3ccco3)cc2)cc1	784002392	DMCCFXOBPOTGIQ-UHFFFAOYSA-N	436.424	1.896	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNc2cccc(C(=O)OC)c2)cc1C	784854479	HXOUCAVAQZRZHQ-UHFFFAOYSA-N	434.474	1.625	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)c(Br)c1	785067776	MYOMYPRMCBTRIG-UHFFFAOYSA-N	446.261	1.434	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2ccc3oc(C(=O)OC)cc3c2)n1	785227389	PURMJAIGHILQRN-UHFFFAOYSA-N	426.433	1.937	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cccnc2-c2cnn(C)c2)c2ccccc2n1	786413638	DKEGYBXMMIVCMO-UHFFFAOYSA-N	429.440	1.738	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1C(=O)N(C)C(C)C	787544246	KJYZKSJGUFSUNC-UHFFFAOYSA-N	441.444	1.783	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)[C@@H]1CC12CN(C(=O)OC(C)(C)C)C2	789182317	LPRFHNYFCSQITF-LBPRGKRZSA-N	427.502	1.099	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)Cc2cc(OC)c(O)c(OC)c2)cc1C	789259209	HXENKZFQIZZQEW-UHFFFAOYSA-N	436.486	1.889	50	20	IDGD	
CC(C)(C)OC(=O)N1CC2(C[C@@H]2C(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)C1	789757542	ALHMIIMEUXJLGF-GFCCVEGCSA-N	431.497	1.987	50	20	IDGD	
COc1cncc(C(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)n1	790252533	AVLXALLFYMUTIZ-UHFFFAOYSA-N	430.428	1.262	50	20	IDGD	
CCn1c(S)nc2cc(C(=O)NNC(=O)COc3ccccc3OC)ccc2c1=O	791730631	CSVZQBNWDSUGIZ-UHFFFAOYSA-N	428.470	1.554	50	20	IDGD	
CCc1c(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cnn1C(CC)CC	792266893	BCVASGPSUXLBTD-SFHVURJKSA-N	429.477	1.733	50	20	IDGD	
CN(C)N(C(=O)c1cccc(NS(=O)(=O)c2ccccc2)c1)[C@H]1CCS(=O)(=O)C1	792852998	BKOKZXWXLJAIEI-KRWDZBQOSA-N	437.543	1.593	50	20	IDGD	
CC(C)Oc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc3ccccc3c2)nn1	793021643	HVHURBQQJNLQFD-CQSZACIVSA-N	437.456	1.970	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNS(=O)(=O)c1ccc(C(=O)OC)cc1F	794579327	VPEZKAQRFCTUFI-UHFFFAOYSA-N	426.422	1.400	50	20	IDGD	
Cc1nnnn1/C(=C\c1ccccc1)C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	794730226	LEGLFJDOIHRDOG-AQTBWJFISA-N	427.490	1.373	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C)c(C)c2)cc1OC	796991756	IRRYQHYGHHKHHK-UHFFFAOYSA-N	429.429	1.264	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNC(=O)C(=O)Nc1c(F)cc(Cl)cc1F	797368981	KUTXNDZNGWIJRH-UHFFFAOYSA-N	440.790	1.631	50	20	IDGD	
Cc1cc(O[C@H]2CCN(C)C2=O)ccc1NC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	799241552	UQSVOCBEUJZKIU-OALUTQOASA-N	440.456	1.597	50	20	IDGD	
N#Cc1ccc(NNC(=O)C(=O)Nc2cc(F)cc(S(N)(=O)=O)c2)c(C(F)(F)F)c1	799841360	YMOWQYRAYDFDCJ-UHFFFAOYSA-N	445.354	1.445	50	20	IDGD	
CCC(C)(C)C1CCC(CC(=O)NNC(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)CC1	801165121	ONRMYFAZHNDDEN-UHFFFAOYSA-N	446.552	1.214	50	20	IDGD	
CC(=O)NC[C@H]1CCn2ncc(C(=O)NNC(=O)Nc3ccc(Br)cc3)c2C1	802000528	URSRFLOXMZITAU-LBPRGKRZSA-N	449.309	1.811	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2cc(F)ccc2N2CCOCC2)cc1	802064707	YCCOWURNBBOMHT-UHFFFAOYSA-N	436.465	1.532	50	20	IDGD	
CC(C)N(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccc3c(c2)OCO3)c1	802093073	OHPJTMHQQMBWEV-UHFFFAOYSA-N	434.474	1.911	50	20	IDGD	
COc1ccc(C2=NO[C@@H](CNC(=O)NNC(=O)c3cc([N+](=O)[O-])ccc3O)C2)cc1	802369674	LNHIGQPFIBEEMC-CQSZACIVSA-N	429.389	1.446	50	20	IDGD	
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)NNc1ccc2c(=O)[nH]ccc2c1	803428840	PQYGSWKIELUDMH-SFHVURJKSA-N	437.456	1.532	50	20	IDGD	
O=C(CNS(=O)(=O)c1cccc(C(F)(F)F)c1)NNc1ccc2c(=O)[nH]ccc2c1	803431330	ZTXAJOPIFRXLQT-UHFFFAOYSA-N	440.403	1.969	50	20	IDGD	
NS(=O)(=O)c1ccc(NC(=O)NNC(=O)COc2ccc(Br)cc2)cc1	804030797	NIIDMZGKFYAXJF-UHFFFAOYSA-N	443.279	1.328	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N(C)[C@H]2CCCOC2)cc1	804287794	OYASXOUCJXOVPK-WPNIOXTASA-N	437.500	1.978	50	20	IDGD	
COc1ccc(-c2nn(CCC#N)cc2/C=C(\C#N)C(=O)N(C)CCC(N)=O)cc1OC	804743929	WSZAGBXXPPCSAL-LFIBNONCSA-N	436.472	1.722	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)c(F)cc1Br	806973448	BQLWLTFCEIKXLG-UHFFFAOYSA-N	449.236	1.933	50	20	IDGD	
CCCCCCOc1ccc(C(=O)NNC(=O)C(=O)N=c2ccnc3n(C)[nH]cc2-3)cc1	806974284	CSEMKVWHHQSONP-UHFFFAOYSA-N	438.488	1.701	50	20	IDGD	
CN(C)[C@H](CNC(=O)NNC(=O)c1csc(N2CCOCC2)n1)Cc1ccccc1	807006816	TYZFIGSNFPXVTP-INIZCTEOSA-N	432.550	1.097	50	20	IDGD	
C[C@H]1COCC[C@@H]1CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	807508583	GWWSRQVSZJBPFO-DOTOQJQBSA-N	438.550	1.478	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)NC[C@@H](N2CCOCC2)C(F)(F)F)c1C	807540555	YCBBRBZKRGTUIX-GDBMZVCRSA-N	432.443	1.664	50	20	IDGD	
C[C@@H]1[C@H](NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)CCN1Cc1ccccc1	807619984	CXXRVLIGWBYGQV-YLJYHZDGSA-N	437.548	1.686	50	20	IDGD	
NS(=O)(=O)c1ccc(C=NNC(=O)c2cccc([N+](=O)[O-])c2)cc1Br	807942720	WHLBAJCAACPTLE-UHFFFAOYSA-N	427.236	1.769	50	20	IDGD	
CN(C)CCN1C(=O)C(=NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)c2ccccc21	807952153	FJNSBJOVDHQMMD-UHFFFAOYSA-N	449.920	1.030	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)C1(S(=O)(=O)c2ccccc2)CCOCC1	808614907	AYWNWFUUDKAXPA-OAHLLOKOSA-N	440.518	1.135	50	20	IDGD	
CC[C@H]1[C@@H](C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)CCN1C(=O)OC(C)(C)C	810619046	LAAYZUVZHZSCMH-KBPBESRZSA-N	443.545	1.877	50	20	IDGD	
CC(C)Nc1ccc(S(=O)(=O)NCC(=O)NNc2ccccc2F)cc1[N+](=O)[O-]	810680741	ZSMUKNRLUZSIGK-UHFFFAOYSA-N	425.442	1.976	50	20	IDGD	
O=C(CN(CC(=O)NNC(=O)C1CCCC1)c1ccccc1)NNC(=O)C1CCCC1	812461759	HMVIEQUUQPLQLI-UHFFFAOYSA-N	429.521	1.168	50	20	IDGD	
CN(CCOc1ccc(S(N)(=O)=O)cc1)C(=O)NNC(=O)c1cccc2ccccc12	814305137	FBBMTJFIUHNDEQ-UHFFFAOYSA-N	442.497	1.852	50	20	IDGD	
CC(=NNC(=O)c1cc(-c2cccs2)[nH]n1)c1ccc(S(=O)(=O)CC(N)=O)cc1	814876284	QSQKKEVLAUGRKL-UHFFFAOYSA-N	431.499	1.551	50	20	IDGD	
CCS(=O)(=O)N[C@H](CCSC)C(=O)NNC(=O)[C@@H](C)Oc1cccc(C)c1C	818857718	HEKBCPIAPGRXFE-HUUCEWRRSA-N	431.580	1.279	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)CN2C(=O)N[C@]3(C[C@@H](C)CC(C)(C)C3)C2=O)cc1C	864001799	KGLSJDYGXXVFDH-PSLXWICFSA-N	444.532	1.966	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H](NC(=O)NCc2ccc(F)cc2)C(C)C)cc1	893072314	ILZWQEMBESNHDG-GOSISDBHSA-N	443.479	1.744	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@H](C)C(=O)NNC(=O)CSCC(=O)N1CCOCC1	912865042	YGJOIMNIYRMPES-CQSZACIVSA-N	443.953	1.464	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NC[C@@H](c2cccs2)N2CCN(C)CC2)cc1	915901648	KGHZQONVEQRPNJ-SFHVURJKSA-N	447.561	1.455	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NC[C@@H]2CN(CC(C)C)CCO2)nc1	915922751	BLGVWZRRYWZDJU-MRXNPFEDSA-N	442.586	1.095	50	20	IDGD	
O=C(CSc1nnc(O)nc1O)NN=Cc1ccc(-n2ccc(C(F)(F)F)n2)cc1	915957455	KGNHFEFXRHCGCF-UHFFFAOYSA-N	439.379	1.730	50	20	IDGD	
N#Cc1ccc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)cc1	916409843	KMEXWGHDYINPSJ-UHFFFAOYSA-N	441.513	1.877	50	20	IDGD	
Cc1cccc([C@@H](CNC(=O)NNC(=O)c2ccc3c(c2)OCCO3)N2CCOCC2)c1	916437429	JRUFFMOZBCTKGQ-LJQANCHMSA-N	440.500	1.784	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)NCCN1CCN(c2ccccc2)CC1	916514639	JNDZICJAFOJZTM-UHFFFAOYSA-N	427.505	1.227	50	20	IDGD	
C[C@H](COc1ccccc1)NC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	918089598	WLEWHEBNATUMFF-MRXNPFEDSA-N	446.529	1.883	50	20	IDGD	
CNS(=O)(=O)c1ccc([C@H](C)NC(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)cc1	919779068	NGMFSVMMWIPJOG-AWEZNQCLSA-N	447.517	1.242	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)c1cc2c(c(S(N)(=O)=O)c1)CCC2	1116102990	RIGDOENBUBSTKD-UHFFFAOYSA-N	441.513	1.196	50	20	IDGD	
Cn1c(CCC(=O)N2CC=C(C#N)CC2)nc2cc(S(=O)(=O)N3CCOCC3)ccc21	1116428973	IOKAUVCFDXTIOK-UHFFFAOYSA-N	443.529	1.209	50	20	IDGD	
C[S@](=O)c1ccc(CNC(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1	1319077393	HOYBETVNPLUXJJ-PMERELPUSA-N	438.550	1.902	50	20	IDGD	
COc1ccccc1C1(C(=O)N2CCN(S(=O)(=O)CBr)CC2)CCC1	1337815032	QXZYJHWDPYSWML-UHFFFAOYSA-N	431.352	1.943	50	20	IDGD	
CC(=O)N(C)[C@@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CO[Si](C)(C)C)C1	1779543496	DSEJCONKOBRRIH-XAUMDUMWSA-N	427.618	1.219	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Br)C2)c1cc(Cl)ncn1	1779900107	GRNZEYPKKOJBQT-AXAPSJFSSA-N	449.708	1.948	50	20	IDGD	
CCc1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](Cl)COC)C3)nn1C	1779910909	JQDVBNQQKOJDJK-WRWLIDTKSA-N	426.945	1.364	50	20	IDGD	
C[C@H](NC(=O)c1ccc(F)cc1)C(=O)N1CC[C@]2(CN(C(=O)[C@@H](F)Cl)CCO2)C1	1780901614	LYRMYRBPCFMWTA-IOHHAYIISA-N	429.851	1.308	50	20	IDGD	
CC(=O)N[C@H](C(=O)N1CCO[C@]2(CCN(C(=O)[C@](C)(Cl)CCl)C2)C1)C(C)(C)C	1781225102	DKPVJJNIZFWSJV-NIKGAXFTSA-N	436.380	1.603	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc4c(c3)CC(=O)N4)CCO2)C1	1781230542	VBRQEVMOVSYDRQ-UXHICEINSA-N	440.327	1.861	50	20	IDGD	
CN(C)c1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)cn1	1781331663	OMJOKPZRHBGGFX-RHSMWYFYSA-N	429.290	1.282	50	20	IDGD	
C[C@@H](Oc1ccccc1)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781332664	ISKPXSFQJWMJAW-XUWXXGDYSA-N	429.286	1.974	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc3ccnn3c1)C2	1782179717	SDILDWFSKALCJX-WAOWUJCRSA-N	434.924	1.716	50	20	IDGD	
O=C(c1cnc2ccc(Cl)cc2c1)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1782271692	NVIDSBHZROXWDH-XLIONFOSSA-N	438.311	1.931	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Br)C2)C1CCC(O)CC1	1782330585	BSTFKHUQNDPADR-UPYBYFBQSA-N	435.334	1.742	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cccn4nccc34)C2)C1	1782335309	CWRICBUZFKXQIU-BEFAXECRSA-N	435.322	1.951	50	20	IDGD	
O=C(c1cnc2cccc(Cl)c2c1)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1782497925	XZHONVDCFMOVHX-XLIONFOSSA-N	438.311	1.931	50	20	IDGD	
Cn1cncc1C(=O)N1CCO[C@@]2(CCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1	1782863479	CMWRCHZHEBJCJI-XXFFJTNUSA-N	441.438	1.749	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3C[C@@]3(F)Cl)C[C@@H]21	1783974129	JHISRZYQLFIDQD-RQXQIDNZSA-N	425.726	1.922	50	20	IDGD	
C[C@@H]1[C@H](C(=O)N2CC[C@@]3(CN(C(=O)[C@@H](F)Cl)CCO3)C2)CCN1C(=O)OC(C)(C)C	1785745286	WOLIQFUCQKOMKV-RTEYEHBSSA-N	447.935	1.996	50	20	IDGD	
Cc1ncc(C(=O)Nc2ccc(C3(NC(=O)c4cnccc4C(=O)NN)CCC3)cc2)[nH]1	1786503389	FKQIYQKQNOIYNT-UHFFFAOYSA-N	433.472	1.778	50	20	IDGD	
CCOC(=O)/C=C/C(=O)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1	1787653172	NRPRIQNKLSNSEI-VAWYXSNFSA-N	436.273	1.233	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)c1cn2cc(Cl)ccc2n1	1787859561	HMTCKTPZQLLMAP-MZGVZZPPSA-N	441.315	1.181	50	20	IDGD	
O=C(Cc1cccnc1)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1	1788140605	AOSNFRXHIUEAQA-UHFFFAOYSA-N	429.285	1.752	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](CN)c3ccccc3)C[C@@H]21	1789865676	BDCZMBJIIGWSQI-VPMQLGLMSA-N	442.387	1.945	50	20	IDGD	
CC(C)(C)n1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]3C2)nn1	1789870508	KKWFOPWSOQRQHH-VODUFIJXSA-N	446.379	1.863	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc(Cl)nc3)C[C@@H]21)[C@H](F)Br	1789921005	PFKMWGIOLBFSFH-VGDYDELISA-N	435.681	1.414	50	20	IDGD	
Cc1noc(C)c1CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]2C1	1789922117	HQPDHUYBWSDPLR-QEWYBTABSA-N	446.317	1.894	50	20	IDGD	
COc1cccc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]3C2)c1	1789922162	DRVSDZCMDSHHDG-MBGYTDRXSA-N	443.313	1.908	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4nn[nH]c4c3)[C@H]2C1	1790536164	ZTURXKAMOKMQGJ-LKTHJCGVSA-N	440.331	1.788	50	20	IDGD	
C=CC[C@@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C[C@@H]21	1790829680	QYWKYMSXYJTMLJ-JGLFJCHSSA-N	429.521	1.312	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(C)(C)CCl)C[C@@H]21	1790987712	YDTHHWAFWWZGAY-KKUMJFAQSA-N	431.961	1.756	50	20	IDGD	
CC(C)N1CCC(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](C)Br)[C@H]3C2)CC1	1791055225	OUGKXOYKQOYUKK-DKIMLUQUSA-N	444.414	1.870	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cnc4ccccn34)C[C@@H]21)C(Cl)Cl	1791292689	KWKOLVQGMMWGCU-QEJZJMRPSA-N	425.316	1.660	50	20	IDGD	
CC(C)NC(=O)OC(C)(C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]2C1	1791296442	KTTLBKRALHHZIC-AVGNSLFASA-N	438.352	1.683	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cnc2ccccn12	1792933479	YXGDREOQDHUJBF-QHHYFVSCSA-N	449.349	1.640	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(Cl)nc3ccccc13)C2)[C@@H](O)CCl	1792978133	FQEGUJVGJAWAFO-GWLLULGVSA-N	438.311	1.691	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)[C@H]1C[C@H]1c1ccc(F)c(F)c1	1793044304	FHYLUAZGDAXXMZ-ZRISUJQESA-N	428.863	1.258	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H]2C[C@@]21C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCl	1793115937	BOSKTJMOJZJKCJ-DKQNDJRWSA-N	441.956	1.624	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2)c1cccnc1OCC1CC1	1794450762	YYZIAMJOZFNTPH-AGGWBTHJSA-N	428.316	1.877	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(C(F)(F)F)nc1	1794809575	CVGIZVGFSLXPGN-XFMPKHEZSA-N	435.830	1.557	50	20	IDGD	
Cc1nc(C)c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)s1	1795051113	BNCHRZPWKQNHSG-BTTYYORXSA-N	428.518	1.324	50	20	IDGD	
C[Si](C)(C)c1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCBr)co1	1795115915	UMKSFQHFUGCUFM-XOIINTDNSA-N	443.414	1.813	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CN(Cc3ccccc3)CCO1)C2)[C@@H](F)Cl	1796365061	PPOUQXKWMMADCH-XCDZQEORSA-N	439.915	1.011	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2)c1cc([N+](=O)[O-])cc2c1OCC2	1798518332	WXCQTWLJKVTIES-VAECKANCSA-N	427.816	1.267	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(CO)c(F)c1)C2)[C@H](F)Br	1799351874	DHFDLIQOSFHSCM-NEBZKDRISA-N	433.249	1.212	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](F)Br)c1ccc2nc(CO)[nH]c2c1	1800159479	HMSPJUSBXBBQBS-BUWBCJGYSA-N	439.285	1.998	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)[S@@](=O)c1ccccc1	1800217142	RDRSQWDATBQBAF-YQSNDBDWSA-N	426.966	1.790	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1ccc(F)nc1)C2	1800639886	BAQZGBHTSIHYGU-KRXQYRFLSA-N	442.329	1.916	50	20	IDGD	
CCn1nc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](Cl)COC)c2ccccc21	1800975882	XCAVHRUCCIPBTE-KPEUIFRASA-N	434.924	1.513	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)Sc1ccccn1	1801323108	RKJOMNDWZWQTHO-OWVAZHOYSA-N	427.954	1.406	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)Oc1cccnc1	1801396575	WKLTTWUTNWATMU-LBKYZSNHSA-N	440.338	1.470	50	20	IDGD	
NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](Br)Cc1ccccc1	1801570757	VPWAUNFKFMNQDO-YYIAUSFCSA-N	436.350	1.896	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C(Cl)Cl)c1ccc(-n2c(O)nnc2O)cc1	1802344143	OECMQUCKSLLCBK-LMKPVCQUSA-N	440.287	1.734	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)[C@@H]2CC=CCC2)[C@@H]1c1cccnc1	1803029712	ZBZSHTYDUZRINX-BLIXFSHQSA-N	448.527	1.756	50	20	IDGD	
CC(C)c1nc(CC(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)no1	1803135790	HNAHTBDQOYHZIM-VKJFTORMSA-N	435.912	1.436	50	20	IDGD	
O=C(CCc1ccco1)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1804584251	ILJXBZBXTYWJJF-CVDCTZTESA-N	447.300	1.307	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@@H](CNC(=O)c2ccc(O)nn2)[C@H]1c1cccnc1	1805263875	ALWDTHPPCUCNBP-HACGYAERSA-N	448.321	1.928	50	20	IDGD	
O=C(c1cc2cccnc2nc1O)N1CCC2(CCCN(C(=O)[C@@H](O)CCl)C2)CC1	1805527273	ZNLYKAQWFUOSME-INIZCTEOSA-N	432.908	1.780	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)C2=CCCS2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1	1807365476	OZZRVWHZICLADU-PXNSSMCTSA-N	437.330	1.102	50	20	IDGD	
CC1=C(C(=O)NC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)CCO1	1807766591	ZCXDDRPKNQNARQ-LAUBAEHRSA-N	429.521	1.155	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)NC[C@@H]1CCN(C(=O)[C@](C)(Cl)CCl)[C@@H]1c1cccnc1	1808231661	IEBMLYZMHRIIHE-XTDOFWJNSA-N	444.363	1.771	50	20	IDGD	
COCCOCC(=O)N1CC[C@H](CNC(=O)[C@@H](F)Br)[C@@H]1c1cccnc1	1808661318	IERVULYEIYEVEO-VNQPRFMTSA-N	432.290	1.441	50	20	IDGD	
C[C@@H]1CCC[C@@H]1C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1809656372	KAYCDVDRQJOYSK-XEHJXZTKSA-N	435.333	1.517	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)c3onc4ccccc34)CC2)C1	1809974129	RIYCDUZDVCYAGO-UHFFFAOYSA-N	447.300	1.666	50	20	IDGD	
Nc1ccccc1/C=C/C(=O)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1	1809976882	VDBSCNCHHZDQAI-MDZDMXLPSA-N	447.344	1.507	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC2(CCCN(C(=O)Cc3ccc(F)cn3)C2)CC1	1810068459	UAOGNTKSGWYRQW-UHFFFAOYSA-N	433.528	1.367	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1cccc(F)c1	1811800836	PZWVTZRSIPJGPC-SIKLNZKXSA-N	447.275	1.534	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)COCCOC)[C@@H]1c1cccnc1	1812775033	PCOOBYUMSARMKW-SOLBZPMBSA-N	442.354	1.924	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)o1	1813067710	BMKQZCKDKNRPQV-UWJYYQICSA-N	427.505	1.676	50	20	IDGD	
Cc1oncc1C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1813071544	UOJHLRLHJPSJRW-OXQOHEQNSA-N	428.493	1.071	50	20	IDGD	
Cn1cc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)[C@H](O)CCl)n[nH]2)c(C(F)F)n1	1814871023	HZBMMDQUPHPJIY-VXGBXAGGSA-N	430.843	1.986	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cccn(C(F)F)c2=O)[nH]n1)[C@@H](O)CCl	1814873364	QCIMCSJCJFSOKJ-OLZOCXBDSA-N	443.838	1.872	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2nc(C)c(C)[nH]c2=O)n[nH]1	1816116077	ZJWRARBNFCFCKO-OCCSQVGLSA-N	436.900	1.670	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](F)Br)[nH]n1	1817994532	VWBZXLJWEDTVLV-PTOFAABTSA-N	433.282	1.539	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@@H](F)Cl)[nH]n1)c1cc2n(n1)CCCNC2=O	1818975310	JMEKOEYLRCQKSN-IUODEOHRSA-N	437.863	1.580	50	20	IDGD	
Cc1nc[nH]c1CSCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)CCl)CC2	1819627186	KOMMLQORQADHAQ-MFKMUULPSA-N	443.982	1.620	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1c(C)nc3ncccn13)CC2	1826000626	YRSGEHHVOFTSLE-RYUDHWBXSA-N	448.936	1.974	50	20	IDGD	
Cc1noc(C)c1C(=O)N[C@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1	1826080345	CRIBIGLODYDTLY-LBPRGKRZSA-N	434.522	1.347	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(F)c1)CC2	1826089002	TVMMQONMQUCMTQ-AWEZNQCLSA-N	433.509	1.881	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)cn1C	1827865345	LVJIHOWHUVOJKT-JOCHJYFZSA-N	437.349	1.560	50	20	IDGD	
Cc1cc(CC(=O)N2CCCC[C@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)n[nH]1	1829015360	AAPDSUUDABJRBZ-IBGZPJMESA-N	432.569	1.253	50	20	IDGD	
C[C@@H](Oc1cccnc1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830369849	CGJHCPOYNIKYSV-IIBYNOLFSA-N	439.940	1.570	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CC34CCCN3CCC4)C2)C1	1831653606	BIPZCXHUPJKHDW-AVRDEDQJSA-N	442.000	1.869	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccnc(F)c3)CCO2)C1	1831894954	HNBILDFVVVQREY-ACJLOTCBSA-N	444.301	1.322	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)COCc3ccccc3)CC2)CC1)[C@@H](O)CCl	1833309036	JVYSAOYCXYMFGC-FQEVSTJZSA-N	437.968	1.375	50	20	IDGD	
C[C@@H](Nc1nccs1)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)CCl)CC2)CC1	1833310314	GODRSICODANVSU-CJNGLKHVSA-N	444.001	1.115	50	20	IDGD	
N[C@@H](Cc1cccnc1)C(=O)NC1CCN(C2CCN(C(=O)[C@H](F)Cl)CC2)CC1	1835097950	JODRKBLJMZIBNW-ROUUACIJSA-N	425.936	1.057	50	20	IDGD	
O=C(CCc1cc(F)ccn1)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836715139	KEDSEMXODVQLDH-IBGZPJMESA-N	441.931	1.752	50	20	IDGD	
CC(=O)N(C)CCC(=O)N1CCC(OC2CCN(C(=O)CO[Si](C)(C)C)CC2)CC1	1837040039	GWHCVMPFQWYRCN-UHFFFAOYSA-N	441.645	1.705	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(F)s3)C2)C1	1837709908	AHECQGJRFJSSOJ-SFHVURJKSA-N	430.574	1.809	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)c3[nH]nnc3C)CC2)CC1	1838002339	WPNCRZXOGCKIOH-HNNXBMFYSA-N	442.358	1.899	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](C)Cn3ccnc3)CC2)CC1	1838786084	KAZCAUAWDYQYEV-QFBILLFUSA-N	440.972	1.772	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3c(F)cccc3F)CCO2)C1	1838864098	LSYJQPCRXFQUAQ-BFUOFWGJSA-N	432.851	1.289	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)c(OC)c1	1838879425	MKOMABGXSORFQF-LJQANCHMSA-N	447.315	1.578	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3nc(C)sc3C)C2)C1	1839142254	LAVVLGZLOPIZFD-BEFAXECRSA-N	429.970	1.776	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3csc(N)n3)C2)C1	1839152202	RAYUNWVRLHPPST-HZPDHXFCSA-N	437.349	1.032	50	20	IDGD	
O=C(c1sccc1F)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839198882	OMQHVRYBADZPAZ-IUODEOHRSA-N	439.278	1.648	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(OC)cc3F)CCO2)C1	1839292129	SWIWYDHNDQMKKE-OXJNMPFZSA-N	428.888	1.922	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3n[nH]c4cccc(F)c34)CCO2)C1	1839599642	VXDBZLPBAHDSHJ-XCLFUZPHSA-N	438.887	1.789	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1[C@H]3C=CS[C@H]31)CCO2	1839696539	ABHGEMINUHDDLK-MYZZLAAOSA-N	426.611	1.169	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc(C)nc3)C2)C1	1839963527	NJULPEQPWRHGBO-CRAIPNDOSA-N	441.326	1.029	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CNC(=O)OC(C)(C)C)CCO2)C1	1839986009	FLXUCYKDIQMPLT-MGPUTAFESA-N	447.960	1.375	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(Cl)nc3)C2)C1	1840029336	AVUSVDPFSWPHHM-YVEFUNNKSA-N	446.729	1.588	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CSC3CCCC3)C2)C1	1840030681	SUJKPZBRBGEMCE-KBXCAEBGSA-N	449.411	1.902	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc4ccncc34)C2)C1	1840154714	DDVNICQIVVKWNA-UGKGYDQZSA-N	447.919	1.559	50	20	IDGD	
C[C@H]1CC[C@H](C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)CC1	1840530727	IIZBDMBNOMACRY-ADAWSYLGSA-N	435.334	1.960	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)COCc1ccccc1)C2	1843415793	NKMVUCRMPZJUGU-KOEQRZSOSA-N	437.500	1.541	50	20	IDGD	
Cc1cn2c(=O)c(C(=O)N3CCCC34CN(C(=O)CCBr)C4)cnc2s1	1843785155	VZJZJVKFWFXSIZ-UHFFFAOYSA-N	439.335	1.666	50	20	IDGD	
O=C(COC(=O)c1ccc2c(c1)NC(=O)CS2)NNC(=O)c1ccc([N+](=O)[O-])cc1	9074628	VFDRFRFUDBNBMR-UHFFFAOYSA-N	430.398	1.257	50	20	IDGD	
C[C@@H]1Oc2ccccc2O[C@H]1C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	14330733	GEDHXECJKZFIDM-IFXJQAMLSA-N	445.497	1.461	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2ccc3c(c2)CCN3C(C)=O)cc(OC)c1OC	15243847	GWIFALINBKSINZ-UHFFFAOYSA-N	449.485	1.245	50	20	IDGD	
O=C(NNC(=O)[C@H]1CC(=O)N(C2CCCC2)C1)c1ccc(S(=O)(=O)N2CCCC2)cc1	17514306	UFJDJAOFXRNOOB-INIZCTEOSA-N	448.545	1.023	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccc(C(=O)OCC(=O)NNC(=O)c2cccs2)cc1	24653550	FQWYWFOJVUGLQN-UHFFFAOYSA-N	439.515	1.443	50	20	IDGD	
CSc1nc2nc(C)c(CC(=O)NNC(=O)[C@H](C)Oc3ccccc3F)c(C)n2n1	25257590	DOIJJXXUUXVNDJ-LBPRGKRZSA-N	432.481	1.760	50	20	IDGD	
CC(C)C(=O)Nc1nc(CC(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)cs1	726867608	PREDQEMYFXTKDR-UHFFFAOYSA-N	437.547	1.864	50	20	IDGD	
CC(C)CCC(=O)NNC(=O)c1cccc(NS(=O)(=O)c2ccc3nnn(O)c3c2)c1	727490492	NMYJHXKEEJWFNV-UHFFFAOYSA-N	446.489	1.667	50	20	IDGD	
O=C(NNC(=O)C1CCCC1)c1ccc(C(=O)NNC(=O)C2CCCC2)c([N+](=O)[O-])c1	727849796	MWXSUFFULRFHLH-UHFFFAOYSA-N	431.449	1.497	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1nn(-c2ccccc2F)c2c1CCC2	728845519	KLRFYPWBQWEXMG-UHFFFAOYSA-N	449.490	1.968	50	20	IDGD	
COc1cccc([C@H](C)N2CCN(CC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)CC2)c1	728930425	OFOWAYQJPFTPGD-INIZCTEOSA-N	441.488	1.743	50	20	IDGD	
CCC[C@@H](NC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)c1ccccn1	729613822	VUBJPEBYCQFDQJ-GOSISDBHSA-N	447.565	1.580	50	20	IDGD	
O=C(NCC1CCN(S(=O)(=O)C(F)F)CC1)NNC(=O)c1cc2c(s1)CCC2	733045339	IOMBZBIEHJHZLJ-UHFFFAOYSA-N	436.506	1.445	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)N[C@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1C	734218517	VNWUFIBQJDEVIG-INIZCTEOSA-N	433.509	1.972	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)CC(=O)NNC(=O)c2cc(Br)c[nH]2)cc1F	734808595	QKFFDFIAMHOXDG-UHFFFAOYSA-N	446.254	1.354	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)c2ccccc2SCc2nnnn2-c2ccccc2)cn1	735473459	WBJCUAHHCODGAY-UHFFFAOYSA-N	434.485	1.763	50	20	IDGD	
CC(=O)NC[C@H]1CN(C(=O)CCC(=O)C(C#N)=C2N(C)c3ccccc3N2C)CCO1	735477618	DTTVKOPRHJWROY-INIZCTEOSA-N	425.489	1.021	50	20	IDGD	
CC(C)CCOCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	743350955	IPIZJIJBJLUOGT-UHFFFAOYSA-N	426.539	1.478	50	20	IDGD	
CCc1cc(NNC(=O)CCN2C(=O)[C@@H]3[C@H]4CC[C@@H](O4)[C@@H]3C2=O)nc(-c2ccccn2)n1	743377035	WYHHZRPYOYHYMU-RGCFKVTRSA-N	436.472	1.097	50	20	IDGD	
CN(C)c1nccc(NNC(=O)[C@@H]2CCCN(C(=O)N3CCc4sccc4C3)C2)n1	743484988	VJQUSBMPCQBVDI-OAHLLOKOSA-N	429.550	1.938	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1cccc(Br)c1)c1cccc(S(N)(=O)=O)c1	743506346	PBAYTSYYNIOIST-JTQLQIEISA-N	441.307	1.802	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)[C@H]2CCCCN2C(=O)c2ccccc2)cc1	744453867	OGKVZBXJRBLGPX-LJQANCHMSA-N	434.452	1.557	50	20	IDGD	
Cc1c(C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)nnn1-c1cccc(Cl)c1	744835137	NVPONIJOUKSABP-UHFFFAOYSA-N	438.831	1.719	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NC[C@@H](C)CN2CCN(C)CC2)cc1Br	745862956	QRDHTRXBBIAFRL-CYBMUJFWSA-N	442.358	1.285	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NCCc2ccn(-c3ccc(F)cc3)n2)c2ccccc2c1=O	745892423	YCYBDWKNOMDSTF-UHFFFAOYSA-N	449.446	1.445	50	20	IDGD	
CC(C)c1nc(C#N)c(NNC(=O)Cc2ccc(S(=O)(=O)N3CCOCC3)s2)o1	746524875	IHIRVWXCWQPPCZ-UHFFFAOYSA-N	439.519	1.438	50	20	IDGD	
Cc1nn(C)c(C)c1[C@@H](C)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	746753842	MAPIFNYXTUWOJG-CYBMUJFWSA-N	433.534	1.386	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)N[C@@H](COC)Cc2ccccc2)nc1	746782480	MQBXGGXZCFYGGC-QGZVFWFLSA-N	435.550	1.996	50	20	IDGD	
COc1ccc(NNC(=O)Cc2ccc(OC)c(S(=O)(=O)N3CCOCC3)c2)cc1	746885565	ADAZJFFZDGRBKF-UHFFFAOYSA-N	435.502	1.411	50	20	IDGD	
CC(=O)c1cccc(S(=O)(=O)NCCC(=O)NNC(=O)CCOc2ccccc2)c1	747236766	NIOFPCBSZONNLQ-UHFFFAOYSA-N	433.486	1.174	50	20	IDGD	
O=C(NNC(=O)c1nc(C2CC2)n(-c2ccccc2Cl)n1)c1ccc(-n2cnnn2)cc1	748699964	BQXYCXGYISUSAU-UHFFFAOYSA-N	449.862	1.849	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc2c(c1)CCN2CC(=O)NNC(=O)c1ccc(C)cc1	749868671	VVFXHBZZRTWOBN-UHFFFAOYSA-N	444.557	1.849	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(N2CCOCC2)c(C(=O)NNC(=O)CC2CCCC2)c1	749945351	QMINNIYGBYXIAN-UHFFFAOYSA-N	438.550	1.115	50	20	IDGD	
CC(C)N1C[C@@H](NC(=O)NNC(=O)[C@@H](C)Oc2cccc(Br)c2)CC1=O	750644317	QCLXWSVPGLWCLT-YPMHNXCESA-N	427.299	1.556	50	20	IDGD	
CC[C@@H](C)c1ccccc1N1C[C@@H](C(=O)NNC(=O)CNC(=O)c2ccco2)CC1=O	751206797	NONXJXNKMZSDNQ-CABCVRRESA-N	426.473	1.723	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNS(=O)(=O)c2ccc(C(=O)CCC(=O)O)cc2)cc1C	751207607	AZXDLFNDYBKUEJ-UHFFFAOYSA-N	447.469	1.299	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2ccc(C#N)c(C(F)(F)F)c2)c1	751516363	AGWSFPAIKONHHY-UHFFFAOYSA-N	447.416	1.604	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)CCn2c(S)nnc2-c2cccs2)nc2ccccc21	752976650	HWEGPVDJMDONGJ-UHFFFAOYSA-N	441.542	1.962	50	20	IDGD	
CCc1nnc(O)c(CNC(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)c1CC	754655426	QVUAMWQBLGBOEL-UHFFFAOYSA-N	429.485	1.734	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)[C@](C)(O)c2cccc(C(F)(F)F)c2)c2ccccc2c1=O	754843208	VBJWQFCJGQHZFI-LJQANCHMSA-N	434.374	1.621	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)Nc1cccc(S(=O)(=O)NC2CC2)c1	755586394	WAKGQEVXNPTMAD-UHFFFAOYSA-N	448.501	1.758	50	20	IDGD	
CCN(CCNC(=O)NNC(=O)c1nn(CC)c(=O)c2ccccc12)CCC(F)(F)F	755851394	FXUJQEFOJKOJRO-UHFFFAOYSA-N	442.442	1.635	50	20	IDGD	
COC(=O)CCc1nnc(NC(=O)NNC(=O)c2ccc(OC(C)C)c(OC)c2)s1	756675912	HZLSLAHAFRQOOX-UHFFFAOYSA-N	437.478	1.906	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2nnc(O)c3ccccc23)cc1N1CCOC1=O	756820398	WGIXQFQPGDZRNY-UHFFFAOYSA-N	438.400	1.767	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)COc2ccccc2C#N)cc1S(=O)(=O)NC1CC1	757866163	MATQDJQIPHMWIH-UHFFFAOYSA-N	443.485	1.539	50	20	IDGD	
Cc1nn([C@H]2CCS(=O)(=O)C2)c(C)c1NC(=O)NNC(=O)c1cc2c(s1)CCC2	757870989	CCUTWSDJPSBJQU-ZDUSSCGKSA-N	437.547	1.876	50	20	IDGD	
O=C(COC(=O)c1ccccc1CN1CCOCC1)NNC(=O)c1cccc([N+](=O)[O-])c1	758492490	FORRMERKVRXZCX-UHFFFAOYSA-N	442.428	1.045	50	20	IDGD	
O=C(COC(=O)c1cnc2ccc(F)cc2c1)NNC(=O)[C@H]1COc2ccccc2O1	758624766	PLZBUMTYSIKHDN-GOSISDBHSA-N	425.372	1.518	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NC[C@H]1CN(Cc2ccccc2)CCCO1	758958238	SYUOJJMSPXVSEQ-KRWDZBQOSA-N	445.545	1.099	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)c1ccc(OC)c(I)n1	761159468	QUGJJJQANSAFGH-UHFFFAOYSA-N	427.198	1.778	50	20	IDGD	
CCCCc1ccc(NC(=S)NNC(=O)C2=CC=CN3CCS(=O)(=O)N=C23)cc1	761577236	MIVUBQUPPVEBIZ-UHFFFAOYSA-N	433.559	1.844	50	20	IDGD	
Cc1nnnn1[C@H](Cc1ccccc1)C(=O)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	763172902	DSFMJRXEUMZJPT-LJQANCHMSA-N	434.435	1.756	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)C(=O)Nc1cccc(OCc2cccnc2)c1	763446959	YNCUQFGOBNQDFV-UHFFFAOYSA-N	435.396	1.969	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cnn1-c1ccccc1F	763468872	WIKXYRZJHPQMSP-UHFFFAOYSA-N	426.364	1.628	50	20	IDGD	
CCCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2Br)cc1	763483637	UWDZYLXPRLVXPQ-UHFFFAOYSA-N	447.289	1.989	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1ccc(-n2cccn2)c(Cl)c1	763629534	MKABICCNDBJABF-UHFFFAOYSA-N	437.847	1.882	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C)c(C)c2)cc1	763664843	JPQHFWTVNGUXSI-UHFFFAOYSA-N	429.429	1.020	50	20	IDGD	
CC(=O)Nc1cc(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)c(F)cc1F	763728856	RXJJHCYVVOLODH-UHFFFAOYSA-N	445.426	1.462	50	20	IDGD	
O=C(CSc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1cnn(C[C@H]2CCCO2)c1	763733860	IASBRLXZOPDNRE-CQSZACIVSA-N	437.909	1.594	50	20	IDGD	
CCOc1cc2c(cc1NC(=O)C(=O)NNC(=O)c1cc(OC)cc(OC)c1)O[C@H](C)C2	763773088	UKGAWKZWGPYYDQ-GFCCVEGCSA-N	443.456	1.826	50	20	IDGD	
COc1cc(Cl)c(C)cc1NC(=O)C(=O)NNC(=O)COc1ccccc1[N+](=O)[O-]	763804225	QSPRGVJWASAHHP-UHFFFAOYSA-N	436.808	1.730	50	20	IDGD	
Cc1cc(Br)ncc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccccc1F	763855904	CDWVEUROSSMLOW-JTQLQIEISA-N	439.241	1.845	50	20	IDGD	
COC(=O)Nc1cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)ccc1F	763864258	HOPONCRZCQATRM-JTQLQIEISA-N	436.371	1.697	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(-n3cccn3)cc2)cc1	763873216	SOAVBIYIRXODBE-OAHLLOKOSA-N	435.440	1.628	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3ccc(-n4cncn4)nc3)cc2C1	763941900	YUWPMVWBVPAHSK-NSHDSACASA-N	425.474	1.248	50	20	IDGD	
CCN1CCN(c2ccc(Cl)cc2NC(=O)C(=O)NNC(=O)Cc2ccsc2)CC1	764035867	UFYQWLLLFJNBCS-UHFFFAOYSA-N	449.964	1.872	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1O)C(=O)Nc1ccc(N2CCCC2=O)c(F)c1	764126016	DRNUGXVPLAPJEU-UHFFFAOYSA-N	434.811	1.711	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2cccc(-c3nnnn3C3CC3)c2)cc1	764132985	ZKZUMNWUBXNZNJ-UHFFFAOYSA-N	449.471	1.402	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccnn2Cc2ccc(C)o2)o1	764138933	LQBDDEKQUGXURP-UHFFFAOYSA-N	442.476	1.667	50	20	IDGD	
O=C(CCc1ccco1)NNC(=O)C(=O)Nc1ccc(S(=O)(=O)C2CCCC2)cc1	764168311	BQBPHAWNBGTWTN-UHFFFAOYSA-N	433.486	1.715	50	20	IDGD	
O=C(CCc1ccccc1)NNC(=O)C(=O)Nc1ccc(Cl)c(C(=O)NC2CC2)c1	764192933	RJBSWBHFXZGMBP-UHFFFAOYSA-N	428.876	1.951	50	20	IDGD	
Cc1ncsc1C(=O)NNC(=O)C(=O)Nc1ccc(-c2nnc3n2CCCC3)cc1	764245363	FNTIAENERKNRKJ-UHFFFAOYSA-N	425.474	1.446	50	20	IDGD	
CCOc1cc(NC(=O)C(=O)NNC(=O)c2scnc2C)c([N+](=O)[O-])cc1OCC	764246002	CAARZALCDPPFBK-UHFFFAOYSA-N	437.434	1.557	50	20	IDGD	
C[S@@](=O)c1cccc(NC(=O)C(=O)NNC(=O)c2cc(F)ccc2Br)c1	764270419	MRROGHUPWBJUFG-AREMUKBSSA-N	442.266	1.725	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)COc2ccccc2O)cccc1C(=O)N1CCCC1	764275753	TVIGZHONTDUDRT-UHFFFAOYSA-N	440.456	1.102	50	20	IDGD	
Cn1ccnc1C(=O)c1ccc(NC(=O)C(=O)NNC(=O)CCCc2cccs2)cc1	764340137	ULXVLWGYHWRKGW-UHFFFAOYSA-N	439.497	1.821	50	20	IDGD	
C[C@@H]1CCCCN1CC(=O)Nc1ccc(F)c(NC(=O)C(=O)NNC(=O)C2CCC2)c1	764341078	DKOOFCOZKBOWJU-CYBMUJFWSA-N	433.484	1.525	50	20	IDGD	
Cc1nc(-c2ccc(NC(=O)C(=O)NNC(=O)c3cnn(-c4ccccc4)c3)cc2)n[nH]1	764350336	CJVBRUIAWCVKIE-UHFFFAOYSA-N	430.428	1.366	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2cccs2)[nH]n1)C(=O)Nc1cccc(Cn2cccn2)c1	764384756	LBWSNSBFNPDCGJ-UHFFFAOYSA-N	435.469	1.783	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1cc(C(F)(F)F)ccc1N1CCCC1	764401834	XYMNAEHGMMFRLO-LBPRGKRZSA-N	446.426	1.443	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)c(C)c1	764404587	MBFLTGCHCIBCNR-UHFFFAOYSA-N	447.469	1.131	50	20	IDGD	
O=C(CCC(=O)N1CCN(c2ccccc2)CC1)NNC(=O)[C@@H]1COc2ccccc2O1	764516731	UBCRTIGONPIPAR-FQEVSTJZSA-N	438.484	1.103	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)CCc3ccc(S(N)(=O)=O)cc3)n[nH]2)c1	765582278	VTSZIMKUBCFVTO-UHFFFAOYSA-N	441.513	1.735	50	20	IDGD	
CCc1cnccc1C(C)=NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1	765584583	ROULPFHVPKMAJK-UHFFFAOYSA-N	443.573	1.799	50	20	IDGD	
CC(C)(C)OC(=O)N1CCO[C@@H](C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)C1	765606471	AANJKIPLUPDQPO-MRXNPFEDSA-N	433.440	1.613	50	20	IDGD	
CNS(=O)(=O)c1ccc(C)c(C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)c1	765615223	BZUSTYLRSYDVGP-UHFFFAOYSA-N	431.449	1.507	50	20	IDGD	
CC(C)Oc1ccc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cn1	765738665	MGKKWQGMMGLYNR-UHFFFAOYSA-N	425.489	1.088	50	20	IDGD	
C#CCOc1ccc(C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)cc1	765758353	KINYDVLCAGSRJM-UHFFFAOYSA-N	440.931	1.931	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)[C@H]1COc2ccccc2C1	765759458	UPJHNAULLRPYKE-LJQANCHMSA-N	442.947	1.856	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)N[C@@H]1CCN(C2CCCCC2)C1=O	765887030	WWDFGDSWSQAQIS-MRXNPFEDSA-N	426.477	1.456	50	20	IDGD	
COc1cc(C#N)ccc1NC(=O)C(=O)NNC(=O)c1cc(Br)ccc1O	766259733	HYJNICAZGIBONQ-UHFFFAOYSA-N	433.218	1.435	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)c1ccc(N2C(=O)CCC2=O)c([N+](=O)[O-])c1	766606523	TXNNCBWDKXAALS-UHFFFAOYSA-N	435.396	1.664	50	20	IDGD	
CC(C)(C)C(=O)NCCC(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	766659846	GABLMRPZIMNTGK-UHFFFAOYSA-N	437.972	1.157	50	20	IDGD	
Cc1nc(C#N)c(N2CCN(C(=O)COC(=O)[C@H](Br)C(C)(C)C)CC2)o1	766748398	GBBXZXRJZYTJIB-AWEZNQCLSA-N	427.299	1.856	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)Nc1cccc(N2C(=O)CNC2=O)c1	767221718	LFMACBINZRVAHG-UHFFFAOYSA-N	433.446	1.304	50	20	IDGD	
O=C(CCC(=O)N1CCN(c2ccccn2)CC1)NNC(=O)c1cc(Cl)ccc1O	767840963	UPEDPMVDQKHUAO-UHFFFAOYSA-N	431.880	1.331	50	20	IDGD	
CCOc1ccc(NC(=S)NNC(=O)[C@H](C)NS(=O)(=O)c2ccc(C#N)cc2)cc1	767855559	YRIIOWACANPCDJ-ZDUSSCGKSA-N	447.542	1.642	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)CO[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)c1	768065069	UMNOSAYJXKBQTJ-QGZVFWFLSA-N	449.504	1.715	50	20	IDGD	
COc1cccc(NNC(=O)C(=O)Nc2ccccc2OCC(=O)Nc2cccnc2)n1	768233286	VJYLPMBTVAMOTL-UHFFFAOYSA-N	436.428	1.585	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2F)c2ncccc12	768234697	YQIPRHQHWMTXAI-UHFFFAOYSA-N	426.404	1.938	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)CCc3c(C)nc4nc(N)nn4c3C)n[nH]2)cc1	768268393	PCGZKPDWDXRNJR-UHFFFAOYSA-N	447.503	1.670	50	20	IDGD	
CCNS(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)c1	768288898	HDBRLIIQKOZDGH-UHFFFAOYSA-N	431.449	1.589	50	20	IDGD	
CCn1c(SCC(=O)NNC(=O)c2ccc(OC)c(OC)c2)nnc1-c1ccccn1	768410811	CKHHMUSZQFPTCR-UHFFFAOYSA-N	442.501	1.931	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)N2CCC[C@@H]2C(=O)NNc2nc3ccccc3[nH]2)o1	768514789	KXKJGWIGAVJTNV-CQSZACIVSA-N	447.473	1.629	50	20	IDGD	
O=C(CCCCc1cnn[nH]1)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	768721252	LADHJGZIBJTONC-UHFFFAOYSA-N	433.944	1.136	50	20	IDGD	
CCC1(CC)[C@@H](OC)[C@H](C)[C@H]1NC(=O)NNC(=O)c1csc(N2CCOCC2)n1	770753848	OACKSPCOUMNZEW-YUELXQCFSA-N	425.555	1.763	50	20	IDGD	
COc1ccccc1[C@]1(C)NC(=O)N(CC(=O)NNc2nc(-c3cccnc3)no2)C1=O	771481651	AMNMZIIBFBIUPY-FQEVSTJZSA-N	437.416	1.051	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NN=Cc1cnc2cnc(Br)cn12	771573406	WBDWORNNLPFQRP-UHFFFAOYSA-N	435.669	1.912	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)[C@@H](C(C)C)N2CCCS2(=O)=O)c(C)n1-c1ccccc1	772631064	PNAOORMUHDXDPA-LJQANCHMSA-N	432.546	1.915	50	20	IDGD	
CC1CCC(N2C[C@@H](C(=O)NNC(=O)C(=O)NCc3ccc(Cl)cc3)CC2=O)CC1	772906292	SILMJUJBTKEDCQ-GULBITTBSA-N	434.924	1.531	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2c(C)cnn2Cc2ccc(OC)c(OC)c2)n1	773726587	NMZFCMRIJFHCLG-UHFFFAOYSA-N	441.448	1.137	50	20	IDGD	
CC(=O)N(C)c1cccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)c1	774001914	LIZVHJASZNQYFM-LBPRGKRZSA-N	432.864	1.876	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)cc1	774003495	WKVLLOWTJUYSMV-LBPRGKRZSA-N	449.847	1.445	50	20	IDGD	
C[C@@H]1[C@@H](C)N(C(=O)OC(C)(C)C)CCN1C(=O)NNC(=O)CNC(=O)c1cccs1	776322393	ZLAQPYPDYNKMST-CHWSQXEVSA-N	439.538	1.548	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)CNC(=O)OC(C)(C)C)cc1Br	777940484	MIWPAZGRWBWJES-UHFFFAOYSA-N	438.300	1.292	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H](O)Cc2cccc(C(F)(F)F)c2)c1	778460365	WWMYLQUGMKWGPN-OAHLLOKOSA-N	430.404	1.474	50	20	IDGD	
COc1cc([C@@H](C)NC(=O)NNC(=O)CNC(=O)OC(C)(C)C)cc(OC)c1OC	778606403	OCNHYAILZFTTMO-LLVKDONJSA-N	426.470	1.629	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)Nc1ccnn1Cc1ccccc1Br	779465297	DFXDMBBIOORHGC-LBPRGKRZSA-N	440.298	1.898	50	20	IDGD	
Cc1ccc(-c2nnc(S)n2CC(=O)NNC(=O)CCNC(=O)OC(C)(C)C)cc1	780973505	ABCXFYDNWMJOPF-UHFFFAOYSA-N	434.522	1.604	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)c1ccc2c(c1)CCCN2S(C)(=O)=O	780973860	IGXPJDZVZIQHCZ-UHFFFAOYSA-N	440.522	1.075	50	20	IDGD	
CCNC(=O)N(C)NC(=O)c1cc(S(=O)(=O)N(CC)CC)ccc1N1CCCC1	781063279	CNNLKHKPGROJIE-UHFFFAOYSA-N	425.555	1.623	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2cncc(Cl)n2)cc1	783266699	YXUPWBQYJJXHNR-UHFFFAOYSA-N	426.886	1.242	50	20	IDGD	
Cn1c(=NNC(=O)C(=O)Nc2cccc(Cl)c2S(C)(=O)=O)sc2ccccc21	783352123	YIQCPWBAPSWPEK-UHFFFAOYSA-N	438.918	1.867	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNc2nccc3sccc23)cc(S(C)(=O)=O)c1	783444460	FOGZNZVRIUXTPR-UHFFFAOYSA-N	448.482	1.568	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cn(Cc3noc(C)n3)nn2)ccc1OCCC(C)C	784731093	ZQFDHAQYSWQNCW-UHFFFAOYSA-N	443.464	1.526	50	20	IDGD	
COCCOc1ccc(Br)cc1NC(=O)C(=O)NNc1ccc(Cl)nn1	784789803	QGMKLYHLFPGATA-UHFFFAOYSA-N	444.673	2.000	50	20	IDGD	
CCNC(=O)N(C)NC(=O)C(=O)Nc1ccc(CCn2nnc(-c3ccccc3)n2)cc1	784915838	PUUTVJCWAAMDPY-UHFFFAOYSA-N	436.476	1.214	50	20	IDGD	
NC(=O)COc1cccc(NC(=O)C(=O)NNc2c(F)cc(F)cc2Br)c1	785011181	UMCLXSZSGHRVDJ-UHFFFAOYSA-N	443.204	1.673	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)Nc1ccc(SC(F)F)nc1	785022303	FYYFNOPWDQXBFL-UHFFFAOYSA-N	427.345	1.410	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)n([C@@H]2C[C@H]3CC[C@H]2C3)n1	785023450	IVFAPWALTYYCST-SLEUVZQESA-N	442.432	1.566	50	20	IDGD	
Cc1cc2ccccc2nc1NNC(=O)C(=O)Nc1cccc(S(=O)(=O)N(C)C)c1	785158186	LUNPAYWJKCNMEG-UHFFFAOYSA-N	427.486	1.875	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)n1	785226961	YFIDVSVFSJNRHM-UHFFFAOYSA-N	425.493	1.641	50	20	IDGD	
O=C([C@@H]1[C@H]2CC[C@@H](O2)[C@@H]1C(F)(F)F)N1CCN(S(=O)(=O)CBr)CC1	785626683	XJBIHTIDNCSVDH-DBIOUOCHSA-N	435.262	1.169	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)N2CCN(C(=O)/C(C#N)=C\c3ccc(O)cc3)CC2)c1	787371011	HMOULSHXAXQTKB-AQTBWJFISA-N	439.493	1.687	50	20	IDGD	
CCOc1ccccc1[C@](N)(C(=O)NNC(=O)CNC(=O)c1cccs1)C(F)(F)F	787996306	VMMUZAKAGHOQKX-KRWDZBQOSA-N	444.435	1.441	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNS(=O)(=O)CCCCCl	788062466	KYVDVHPXDZOBGN-UHFFFAOYSA-N	437.393	1.427	50	20	IDGD	
Cc1c(C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)nnn1CC1CCCC1	789190856	LBCDJMRBIZTYRH-UHFFFAOYSA-N	430.421	1.303	50	20	IDGD	
CC[C@H](C)CC(=O)NNC(=O)Cn1c(=O)c2c(ncn2CC)n(Cc2ccccc2)c1=O	790255692	SJSATSQWQZWJDY-HNNXBMFYSA-N	440.504	1.012	50	20	IDGD	
O=C(NNc1cccc(F)c1[N+](=O)[O-])C(=O)Nc1ccc2nc(N3CCOCC3)oc2c1	790998122	HOFTXEJWIJLHDW-UHFFFAOYSA-N	444.379	1.794	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)cccc1NC(=O)N(C)C	792352746	IQVQRADFDCZGFT-KRWDZBQOSA-N	425.445	1.178	50	20	IDGD	
CN(C)N(C(=O)c1cccn2c(I)cnc12)[C@@H]1CCS(=O)(=O)C1	792856508	ZSLKWGLFTHRSHX-SNVBAGLBSA-N	448.286	1.045	50	20	IDGD	
CON(C)C(=O)C1CCN(C(=O)CCC(=O)C(C#N)=C2N(C)c3ccccc3N2C)CC1	794624052	IOROJOWUYMOBPR-UHFFFAOYSA-N	439.516	1.915	50	20	IDGD	
CC(=O)N1CCCC[C@@H]1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	794741763	PGJUEAOKDYWLGF-GOSISDBHSA-N	436.534	1.023	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)Nc2ccc(S(=O)(=O)N(C)C)cn2)cc1	797652808	QARWRIKVRJOIET-ZDUSSCGKSA-N	449.489	1.155	50	20	IDGD	
Cc1cc(O[C@@H]2CCN(C)C2=O)ccc1NC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	799241551	UQSVOCBEUJZKIU-MOPGFXCFSA-N	440.456	1.597	50	20	IDGD	
Cc1cc(O[C@H]2CCN(C)C2=O)ccc1NC(=O)NNC(=O)[C@H]1COc2ccccc2O1	799241553	UQSVOCBEUJZKIU-RBUKOAKNSA-N	440.456	1.597	50	20	IDGD	
C[C@H]1CC(C)(C)C[C@]2(C1)NC(=O)N(CC(=O)NNC(=O)Nc1ccc3c(c1)OCO3)C2=O	802100872	AVWFDIZBGPJHMZ-QKVFXAPYSA-N	445.476	1.705	50	20	IDGD	
COc1ccc(CN2CC[C@H](NC(=O)NNC(=O)c3cccc(C)n3)C2=O)c(OC)c1	805407551	WEIBEADFYCVAHV-KRWDZBQOSA-N	427.461	1.152	50	20	IDGD	
CC(C)[C@@H](NC(=O)NNC(=O)COc1ccc(Br)cc1)c1nncn1C	805767619	YQKIUVCPNCUYKY-CQSZACIVSA-N	425.287	1.684	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)Cc2coc3ccccc23)CC1	806872178	FUVDHDUOJQHSBA-UHFFFAOYSA-N	429.502	1.450	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)[nH]n1)C(=O)Nc1nc(C2CCOCC2)cs1	806973506	PQWPFQPQZFEUPW-UHFFFAOYSA-N	440.485	1.827	50	20	IDGD	
COc1ccccc1C(=O)NNS(=O)(=O)c1cc(Cl)c(NC(C)=O)cc1OC	808090537	ITOJHDBCMWMHBW-UHFFFAOYSA-N	427.866	1.939	50	20	IDGD	
COc1nnccc1NC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	808902844	QZMLROMDNGEPPA-UHFFFAOYSA-N	448.486	1.814	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)cc2[nH]ccc12	808934596	MWXDPAKBJVNUNV-UHFFFAOYSA-N	446.423	1.744	50	20	IDGD	
O=C1COc2c(cccc2NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCCCC3)N1	810384608	NRNLWDRVJJOOKG-UHFFFAOYSA-N	428.470	1.748	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NC[C@H]2COc3ccccc32)cc1	812443960	TXDYTBVCZKLAPB-HNNXBMFYSA-N	432.502	1.122	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)Nc2cccc(N3C(=O)NC(C)(C)C3=O)c2)c1O	812974915	RVODUEPWEWODPN-UHFFFAOYSA-N	427.417	1.702	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)/C=C/CN(C)CC(F)(F)F)c2ccccc2c1=O	814364675	KVTANDMOXHAXOX-RMKNXTFCSA-N	425.411	1.789	50	20	IDGD	
O=C(COC(=O)c1cnc2c(F)ccc(F)c2c1)NNC(=O)[C@H]1COc2ccccc2O1	815355454	DTZXXZZHZXAWFA-QGZVFWFLSA-N	443.362	1.657	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)Cc1nc(-c2ccc(S(C)(=O)=O)cc2)cs1	815457613	JEHPSQPQBUTVIA-LLVKDONJSA-N	439.515	1.245	50	20	IDGD	
COC(=O)N1CCN(c2ccc(NC(=O)C(=O)NNc3ncccc3Cl)cn2)CC1	815557734	CHHAUZPHFXBDAP-UHFFFAOYSA-N	433.856	1.100	50	20	IDGD	
CNC(=O)Oc1cccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)c1	815558749	MVUVHKOHSPZVSN-UHFFFAOYSA-N	442.400	1.483	50	20	IDGD	
CCOC(=O)[C@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNc2cccc(Cl)n2)cc1	815726160	RHTHBXVXHUBAJP-NSHDSACASA-N	433.852	1.498	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2ncncc2F)nn1CCCOc1ccc(F)cc1	815764186	WAPQXFMBJVDSJK-UHFFFAOYSA-N	431.403	1.811	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)CNC(=O)c1ccc(Br)o1	825644169	WVXSHRKTQNUQHB-UHFFFAOYSA-N	425.239	1.040	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)[C@H](CC(C)C)N2C(=O)[C@@H]3CC=CC[C@H]3C2=O)c1	825791650	ROKRNGPEHSPRQF-QRVBRYPASA-N	442.516	1.620	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)[C@]12CCC(=O)N1CCS2	849201894	CMAHKADKJCLIAG-MGPLVRAMSA-N	428.308	1.429	50	20	IDGD	
Cc1ccc(/C=C(\C#N)C(=O)OCC(=O)N(C[C@@H]2CCCO2)[C@@H]2CCS(=O)(=O)C2)cc1	913229214	VEUWIYHDTOZEBT-INQFTJRBSA-N	446.525	1.640	50	20	IDGD	
Cc1cc(C)c(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c(O)n1	916216434	JGYCSWWJYXLDOS-UHFFFAOYSA-N	447.517	1.333	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)NC[C@H](C(C)C)N3CCN(C)CC3)n[nH]2)cc1	916257444	QVRQDUKBZABYNU-HXUWFJFHSA-N	427.553	1.601	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NC[C@H]2CCN(CC(F)(F)F)C2)c2ccccc2c1=O	916577796	GHSZKHVNDSJWSI-GFCCVEGCSA-N	440.426	1.245	50	20	IDGD	
CCOc1ccccc1OCC(=O)NN=Cc1c(C)nn([C@H]2CCS(=O)(=O)C2)c1C	917026830	PIOFFUCDWDCLQK-INIZCTEOSA-N	434.518	1.787	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CN2CCN(C(=O)COc3ccc(F)cc3)CC2)cc1	917109279	QTYGXWFDOCZFBS-UHFFFAOYSA-N	428.464	1.118	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)c2c[nH]nc2C)c1	920400190	DJOHJXVUFDJIHI-UHFFFAOYSA-N	429.458	1.602	50	20	IDGD	
C[C@H](CO)NC(=O)/C(C#N)=C\c1cn(CCC(N)=O)nc1-c1ccc(Br)cc1	920853205	LOMUULVLRCGNJU-UGMNDJHYSA-N	446.305	1.592	50	20	IDGD	
CNS(=O)(=O)c1ccc(Br)c(C(=O)NNC(=O)NC2CCCCC2)c1	1317704784	JWEGNHYLFRPFPC-UHFFFAOYSA-N	433.328	1.634	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cc(C)c3ccccc3n2)cc1	1317863213	HEVKIGBWMAELOH-UHFFFAOYSA-N	426.498	1.933	50	20	IDGD	
CCOC(=O)c1ncc(C(=O)OCC(=O)NNC(=O)c2cc(C)c(CC)s2)s1	1321237826	NLEJALVVOWFWEY-UHFFFAOYSA-N	425.488	1.870	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)C34C[C@H]5C[C@@H](CC(O)(C5)C3)C4)cc2)CC1	1322436303	LEMOAPKYNYHQMJ-WZGNDQMWSA-N	448.589	1.397	50	20	IDGD	
O=C(c1cnnc2ccccc12)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1777728522	YDMZBXLEWCZJNQ-MAUKXSAKSA-N	437.269	1.764	50	20	IDGD	
Cc1ccn2ncc(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)[C@H](O)CCl)C4)c2c1	1777940532	CUTRTEJHDAKHFF-DBXWQHBBSA-N	434.924	1.370	50	20	IDGD	
CCC1(C(=O)N2CC[C@@]3(CN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)CCO3)C2)CCC1	1778329792	WDGAACQQTGBRTE-ZHNJOBQTSA-N	429.521	1.531	50	20	IDGD	
CC(=O)Nc1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](F)Cl)C3)ccn1	1778402763	SZSRKZLZCWWAKC-SIXWZSSISA-N	426.876	1.702	50	20	IDGD	
COCc1oncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CO[Si](C)(C)C)C1	1779544253	QKCJLESZLKIWPH-YLJYHZDGSA-N	439.585	1.800	50	20	IDGD	
Cn1nc(C(F)(F)F)cc1C(=O)N1CC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1779656575	DLGFKPWWTJZPSS-AWEZNQCLSA-N	429.226	1.686	50	20	IDGD	
COc1ccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C3)cc1	1780434280	QDDPJVMQUXLPGT-AUSIDOKSSA-N	446.548	1.196	50	20	IDGD	
O=C(c1cccc2[nH]ncc12)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781331412	QCXLNPBZZYNTRP-RHSMWYFYSA-N	425.258	1.697	50	20	IDGD	
CCOC(=O)O[C@@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)Br)C2	1781516991	YSYRIVVSNZBBOB-KYZVSKTDSA-N	449.342	1.845	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)Nc1cccnc1)C2	1782170391	KJHJDKINUHGFIP-LNNXQNCSSA-N	438.956	1.650	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cnc(Cl)nc3)CCO2)C1	1783338301	GFCOCDGPHLMOOS-LRDDRELGSA-N	431.718	1.747	50	20	IDGD	
CCC[C@H]1CC[C@H](C(=O)N2CC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)CC1	1783362305	LQLRMAQTENXAJU-JXQFQVJHSA-N	442.365	1.416	50	20	IDGD	
C[C@H](C#N)c1cccc(C(=O)N2CCO[C@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)c1	1783937840	PBLZAMUGIXEAHL-HXOBKFHXSA-N	441.532	1.130	50	20	IDGD	
CC(C)(C)n1ncc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]3C2)c1Cl	1784086461	MEULAMZZSLMYQB-MXAVVETBSA-N	447.363	1.485	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(-c4ccccc4)[nH]n3)C[C@@H]21)[C@@H](O)CCl	1784091399	SJYKFYIVVFRLBX-LNMJFAINSA-N	432.908	1.270	50	20	IDGD	
COc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Br)C[C@@H]32)cn1	1784763351	CLSCIIVBDDTNBX-PWNZVWSESA-N	430.274	1.374	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21)[C@@H]1CC(=O)N(C2CCCC2)C1	1784969748	KFGZCAYESIXAIM-XRGAULLZSA-N	446.375	1.561	50	20	IDGD	
O=C(c1ccc(CO)c(F)c1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1785268717	VVMRMBDGARNZLR-RHSMWYFYSA-N	433.249	1.452	50	20	IDGD	
CC(C)c1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]3C2)n[nH]1	1789924730	TVTOJJANTUKIEG-LWWSYDQCSA-N	431.306	1.817	50	20	IDGD	
CC(C)(C)OC(=O)NCC(C)(C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCl	1793117649	VRTHTOFKVAVXTC-LXTVHRRPSA-N	431.961	1.775	50	20	IDGD	
COc1ccc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@](C)(Cl)CCl)C3)cn1	1793894134	ZKEPLFAPNRBJTG-BAAGSCJXSA-N	444.359	1.849	50	20	IDGD	
Cc1ccc2nc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3cccc(B(O)O)c3)ccc2c1	1796191002	NENHFLCJEVJNBU-WKCHPHFGSA-N	443.312	1.789	50	20	IDGD	
CC1(C)CCc2cccc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@@H](O)CCl)C4)c2O1	1796253489	TYBYFANDMZEKEV-MVJTYMMSSA-N	436.936	1.593	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccn(-c2ccccc2)n1	1798698716	XQHGHANDARMDAE-HIRMHNASSA-N	432.908	1.329	50	20	IDGD	
COCCOCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O	1799217840	JYIHQSDCCOWKCB-MUJYYYPQSA-N	449.460	1.435	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Br	1799343528	ZRXGCFJDKAZQKL-HHKYUTTNSA-N	430.112	1.298	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc3ccccn13)C2)[C@@H](F)Br	1799347273	KMWWCHCPPFOKAK-BAESOJJISA-N	425.258	1.228	50	20	IDGD	
CC(C)(O)CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C#N)=C/c1ccc(F)cc1F	1800332435	LBJUIFRHRDJWBD-AHHPBITISA-N	433.455	1.622	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnoc1)C2	1800333206	TUBKZRDGDJXKLE-IANMSCASSA-N	428.395	1.763	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc3[nH]ncc3c1)C2	1800640922	MGEUWFDCTRNCSO-LXTVHRRPSA-N	436.310	1.335	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](Br)CC	1800644157	KUUQRXJMTRCXRD-RXGFPQBGSA-N	440.176	1.923	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ncn(-c3cccc(F)c3)n1)C2)C(Cl)Cl	1801015882	OBCWUANCCNBQJA-GNXNZQSNSA-N	442.278	1.413	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(Cl)cc(OC)c1	1801813737	QHFOEJSBOPOYAV-DLTLXFJOSA-N	431.316	1.806	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(OCC2CC2)cc1	1801825912	YYYDTDJUBWXGBJ-HNJRGHQBSA-N	436.936	1.932	50	20	IDGD	
COc1cc(F)ccc1CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2	1802181874	DWHCDBSTQYMKKX-CZAMWMTLSA-N	447.276	1.657	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(C#N)cc1Cl)C2	1802338008	LEMINGNWOWNZMW-MUJYYYPQSA-N	431.924	1.836	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@H](O)C(=O)N1CCCC2(CCN(C(=O)[C@@H](F)Cl)CC2)C1	1805408807	UTOSVVXLIJBYRZ-UONOGXRCSA-N	435.924	1.638	50	20	IDGD	
C[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCC2(CCCN(C(=O)[C@H](O)CCl)C2)CC1	1805515523	ROGFKQRVJNWDJR-LSDHHAIUSA-N	431.961	1.731	50	20	IDGD	
O=C(CCBr)NC[C@H]1CCN(C(=O)CC(F)(F)C(=O)O)[C@@H]1c1cccnc1	1806340809	NTZVVPHDAAYZJZ-IUODEOHRSA-N	448.264	1.982	50	20	IDGD	
Cc1[nH]ccc1C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1807364040	RVEJVLZJPVWTKR-WIYYLYMNSA-N	432.289	1.031	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@H](CNC(=O)Cn2cnnn2)[C@@H]1c1cccnc1	1807614629	RVZFVMTZBPYPRR-QRTARXTBSA-N	426.308	1.010	50	20	IDGD	
N[C@@H](Cc1cscn1)C(=O)N1CC[C@H](CNC(=O)[C@H](F)Cl)[C@H]1c1cccnc1	1808313124	SHOXGJSCFWMYDU-BVUBDWEXSA-N	425.917	1.648	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1CCN(C(=O)CN2CCOC2=O)[C@H]1c1cccnc1	1810538173	TVFAXFJFPZSIFI-LPHOPBHVSA-N	434.569	1.391	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)Cn2nccn2)[C@@H]1c1cccnc1	1812777238	NXJHIYPXMULSEG-YQQAZPJKSA-N	435.326	1.553	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@H]1CCc2nc(NC(=O)CN3CCCC3=O)sc2C1	1814585607	JULGYEKFTVSUIN-QWRGUYRKSA-N	443.367	1.709	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)C1(C)COC1)CC2	1817275829	DVEARHDKBAXLRA-JBBSTVMTSA-N	444.517	1.226	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](O)C(C)C)[nH]n1	1818111023	YMFKJVWHCNMJTD-XAIYEHPZSA-N	443.508	1.553	50	20	IDGD	
Cn1ccc2c(O)ncc(C(=O)Nc3cc([C@@H]4CCCCN4C(=O)[C@@H](O)CCl)[nH]n3)c21	1820090846	IHMQHSVKHOPHCC-GJZGRUSLSA-N	446.895	1.908	50	20	IDGD	
C[C@](O)(CC(=O)O)CC(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](F)Br)n[nH]1	1820937979	XLUZDBSNCMMRNV-DRZCJDIDSA-N	449.277	1.708	50	20	IDGD	
COc1cc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@@H](C)Br)CC3)nn1C	1821777166	ACMFACAZBKJZPG-BDAKNGLRSA-N	442.339	1.894	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)CCN2C(=O)C=CC2=O)[nH]n1)C(Cl)Cl	1822418962	JPMGSSJXLSPHGK-LLVKDONJSA-N	428.276	1.521	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CN2CCSCC2)CC1	1823725034	XVWONAYJCZMGFK-ROUUACIJSA-N	432.030	1.909	50	20	IDGD	
O=C(NCC(=O)N1CCC([C@H]2CCCCN2C(=O)[C@H](O)CCl)CC1)c1ccco1	1824182180	VPSFVDBPRBMQOB-HZPDHXFCSA-N	425.913	1.229	50	20	IDGD	
Cc1nc(CC(=O)N[C@H]2CCc3nc(NC(=O)[C@H](C)Br)sc3C2)no1	1825637009	PLSHKLIIKQVCSZ-CBAPKCEASA-N	428.312	1.773	50	20	IDGD	
Cc1ccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)cn1	1825813890	SFWOVVSYLARRKE-JOCHJYFZSA-N	435.333	1.617	50	20	IDGD	
CC(=O)N1CCN(CC(=O)N2CCCC[C@H]2C2CCN(C(=O)C(Cl)Cl)CC2)CC1	1828495973	XIJNBSYIRSTBDL-KRWDZBQOSA-N	447.407	1.574	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnc(Cl)nc3)CCO2)C1	1829513792	CKKWROBESGCVMM-KSSFIOAISA-N	431.320	1.608	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(Cl)c3C)CCO2)C1	1830140204	UMQUKBBANYESFB-YLJYHZDGSA-N	445.343	1.972	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccnc4c3OCO4)C2)C1	1830364679	PALZOMMIDMUGJO-FQEVSTJZSA-N	439.896	1.145	50	20	IDGD	
Cc1nocc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)CBr)CCO2	1830537184	CKWSKVWQKQCRPE-SJKOYZFVSA-N	430.299	1.084	50	20	IDGD	
C/C(=C\c1cccs1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1830719828	LVZVTEFSSSSFSP-JERBSLHSSA-N	428.938	1.208	50	20	IDGD	
Cc1ccc(CCC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)cc1F	1830726901	VVDLNUZGCSWONI-RXVVDRJESA-N	442.915	1.123	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@](C)(O)C(F)(F)F)C2)C1	1831640533	NDYZLWNRFAXOHN-VBNZEHGJSA-N	430.851	1.164	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(C)nc3OC)C2)C1	1831652283	XODDBDKHXLIPCE-UTKZUKDTSA-N	439.940	1.876	50	20	IDGD	
COC1(CC(=O)N2CCC([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)CCC1	1831876246	BLXVNUVVIOVHJI-LJQANCHMSA-N	436.597	1.938	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccnc(F)c3)CCO2)C1	1831907187	IWFDWWFXWUEHJG-KDOFPFPSSA-N	444.301	1.464	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CCCC(F)(F)F)CCO2)C1	1832265682	XRHHJOLPBFGUSW-WFASDCNBSA-N	445.276	1.959	50	20	IDGD	
CCC(=O)N[C@@H](C)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)Br)CC2)CC1	1833423129	ZGLQTUYVKQEISG-KGLIPLIRSA-N	445.402	1.256	50	20	IDGD	
Cc1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)n1	1834051584	VDSWUHZJPLJGFE-PBHICJAKSA-N	430.274	1.151	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3c(C)noc3C)CCO2)C1	1834067983	FIDAPGFJNBLQHH-KBXCAEBGSA-N	444.326	1.535	50	20	IDGD	
Cc1nc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@](C)(Cl)CCl)C3)C2)cs1	1834456942	FKEAYUAKQASGPF-IAGOWNOFSA-N	436.361	1.758	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)c3cc(F)ccc3F)C2)C1	1834824030	RLEMNNGHCSNRTR-SFHVURJKSA-N	447.276	1.820	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cnc4ncccn34)CC2)CC1	1835387595	XFAFLCTUHVWAIR-KRWDZBQOSA-N	432.956	1.932	50	20	IDGD	
O=C([C@@H](O)CCl)N1CCC(N2CCC(NC(=O)C3(C(F)(F)F)CC3)CC2)CC1	1835492352	LYGBKGAJJYQBQB-AWEZNQCLSA-N	425.879	1.500	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](CN)c1ccccc1)CCO2	1835818770	QLGHGLNOTXRFKN-UGKGYDQZSA-N	449.624	1.037	50	20	IDGD	
CC(=O)Nc1ccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)cc1	1836661074	CANBFCWEAJWAMY-AZUAARDMSA-N	441.887	1.178	50	20	IDGD	
Cn1cc(C(=O)N2CCC(OC3CCN(C(=O)[C@H](O)CCl)CC3)CC2)c2cccnc21	1836717633	ZNQMQBKABGUPME-LJQANCHMSA-N	448.951	1.785	50	20	IDGD	
C[C@H](Cc1ccncc1)C(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836718753	CPNBXKBQADVUBI-OXQOHEQNSA-N	437.968	1.859	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)Cn3ccnc3C)CC2)CC1	1838731083	WACXXWLOMLQNBC-SFHVURJKSA-N	426.945	1.444	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)[C@@H]3C[C@]3(F)Cl)CC2)CC1	1838789695	UATVDJSIOHNAFX-OXJNMPFZSA-N	446.951	1.283	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnoc3C3CC3)C2)C1	1839151192	KMIZRWKDDVSDIY-MOPGFXCFSA-N	446.331	1.858	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3[nH]cc4c3CCC4)C2)C1	1839153694	OOKKOLMGFYZDIQ-PMACEKPBSA-N	444.359	1.810	50	20	IDGD	
CC(F)(F)C(C)(C)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H](F)Br)CCO2)C1	1839199381	VEYHDPQROMWVJO-BZNIZROVSA-N	445.276	1.815	50	20	IDGD	
Cc1cscc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839200525	JMMORNCBSQPVIV-BBRMVZONSA-N	435.315	1.817	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(O)c(F)c3)CCO2)C1	1839305646	UTMRVZCPZYBCKT-RBUKOAKNSA-N	449.306	1.838	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc([N+](=O)[O-])o3)C2)C1	1840029373	BYRLXFSIDNUOFT-BDJLRTHQSA-N	446.254	1.041	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)Nc3ccccc3)C2)C1	1840153683	XRAXPORQZBUKAQ-MMOPVJDHSA-N	439.940	1.197	50	20	IDGD	
O=C(C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2)c1ccc(Cl)cc1	1840186403	HAGPDZJXIMYMPY-SFHVURJKSA-N	449.718	1.783	50	20	IDGD	
COc1c(Cl)cccc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1	1840738318	CNXKGBIPCMRLQO-DNVCBOLYSA-N	447.315	1.018	50	20	IDGD	
COc1ccc(Cn2cc(CC(=O)N3CC4(CCCN4C(=O)[C@H](O)CCl)C3)cn2)cc1	1841350016	CHCYHEWXNKCOIM-LJQANCHMSA-N	446.935	1.286	50	20	IDGD	
CC(C)(C)n1ncc(C(=O)N2CC3(CCCN3C(=O)c3ccc(B(O)O)cc3)C2)c1Cl	1843010696	SKVPQIDUKIUYBM-UHFFFAOYSA-N	444.728	1.102	50	20	IDGD	
O=C([C@@H](Br)Cc1ccccc1)N1CC2(CCCN2C(=O)Cn2ccnn2)C1	1843103208	YJXOXGLLNBQTOP-INIZCTEOSA-N	432.322	1.488	50	20	IDGD	
O=C(CN1C(=O)C2(CCOCC2)c2ccccc21)N1CC2(CCCN2C(=O)[C@@H](F)Cl)C1	1843365374	MNDXSIPOESLNCK-GOSISDBHSA-N	449.910	1.819	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(C(=O)N2CCCC23CN(C(=O)[C@H](F)Br)C3)C1	1843842224	DTIYBMJAQBJBIF-LBPRGKRZSA-N	434.306	1.747	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1cnccc1C(F)(F)F)C2	1844263708	LLRRZVKDPYVCFS-UHFFFAOYSA-N	448.405	1.230	50	20	IDGD	
CCN(C)[C@@H](C)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1848098789	ZCLDBPOOTLPWBQ-VGWMRTNUSA-N	430.977	1.661	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2cccnc2N2CCOCC2)c2ccccc2c1=O	14347658	OALDFEPDKDMNIJ-UHFFFAOYSA-N	436.472	1.113	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)c1occc1CS(=O)(=O)c1ccccc1	26692788	CQQYPYJOSBJOIH-SFHVURJKSA-N	442.449	1.855	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)CCn2c(=O)[nH]c(=O)c3ccccc32)c1	27620202	LHCMTQKRFOHDMS-UHFFFAOYSA-N	438.484	1.738	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)CSCc2ccc(C#N)cc2)c1	46900087	JVAJEDAPDGATOZ-UHFFFAOYSA-N	432.527	1.503	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Cc2c[nH]c3ccccc23)cc1S(=O)(=O)NC1CC1	104871250	BYKKALOPAHOXOC-UHFFFAOYSA-N	442.497	1.621	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2ccc(S(N)(=O)=O)c(Cl)c2)cc(OC)c1OC	725907277	GYDZZMVFHZWSHA-UHFFFAOYSA-N	443.865	1.088	50	20	IDGD	
COCCCNC(=O)NNC(=O)C(C)(C)S(=O)(=O)c1ccc(Br)cc1	726162672	RNGXKVISNZEPAF-UHFFFAOYSA-N	436.328	1.368	50	20	IDGD	
Cc1ccc(C(=O)NCCC(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)c(O)c1	726204137	FCFGQYSRPCNPIY-UHFFFAOYSA-N	433.848	1.478	50	20	IDGD	
CC(C)(C)OC(=O)NC1(CNC(=O)NNC(=O)CNC(=O)c2ccco2)CCCCC1	726263055	QBEPBOSQMHJTSQ-UHFFFAOYSA-N	437.497	1.567	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)CS(=O)(=O)NC2CCC(C)CC2)cc1OC	726868970	LMNMDKWVWTTZGS-UHFFFAOYSA-N	441.550	1.743	50	20	IDGD	
O=C(CCCNC(=O)c1ccc(F)cc1)NNC(=O)C1CCN(c2ncccn2)CC1	728845139	CSQFXOPXHLUXEF-UHFFFAOYSA-N	428.468	1.190	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)CCc2c(C)nc3[nH]n(C)c(=O)c3c2C)cc1C	729283480	SBKCPGRJECKMTG-UHFFFAOYSA-N	425.489	1.654	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN(S(=O)(=O)Cc2ccccc2)C1)c1cccc([N+](=O)[O-])c1	730444691	RGKXLWBYGAJCDS-KRWDZBQOSA-N	446.485	1.598	50	20	IDGD	
C[C@@H]1CC(C)(C)C[C@]2(C1)NC(=O)N(CC(=O)NNC(=O)COc1ccccc1O)C2=O	730782170	JDHVHCSOECSFMG-ASSNKEHSSA-N	432.477	1.055	50	20	IDGD	
N#CCCN(C(=O)CCC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)c1ccccc1	731228824	WDMSRELQCFFUBI-UHFFFAOYSA-N	449.515	1.567	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)N1CCN(S(=O)(=O)c2ccc(F)cc2)CC1	731499970	UEMBDWMHYHKLOA-UHFFFAOYSA-N	436.465	1.195	50	20	IDGD	
C[C@H]1CN(C(=O)OC(C)(C)C)CCN1C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	731683829	JZRKHDQBDWMZHC-HNNXBMFYSA-N	447.540	1.375	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Cc2ccc(-n3cnnn3)cc2)cc1Br	732036024	RDEFCILMMOMDJP-UHFFFAOYSA-N	431.250	1.437	50	20	IDGD	
CNC(=O)c1cccc(CNC(=O)NNC(=O)c2ccc(OC)c(Br)c2)c1	732255284	AZTXOQHKUKHLGB-UHFFFAOYSA-N	435.278	1.962	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)NCc2nnc(C)n2C)cc1	733151613	IWAVQCLPYRSUAL-MHWRWJLKSA-N	448.487	1.094	50	20	IDGD	
CCOc1cc(CNC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)ccc1OC	734068319	DDNKYKLJBVWLOZ-UHFFFAOYSA-N	425.445	1.485	50	20	IDGD	
CC(C)N1CC[C@H](NC(=O)NNC(=O)[C@@H]2Cc3ccccc3CN2Cc2ccccc2)C1=O	734168670	ZXDWJFNVRHQPDF-VXKWHMMOSA-N	449.555	1.953	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCC(C(N)=O)(c2ccccc2)CC1	734486901	KYYPVPYCRUHJRM-UHFFFAOYSA-N	444.919	1.629	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cnn(C)c2)cc1S(=O)(=O)N[C@H]1CCCC[C@@H]1C	735446110	WYNZSFQAVHDDKC-BBRMVZONSA-N	449.533	1.361	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)N[C@@H]1CCN(c2ccc(Cl)cc2)C1=O	740025650	MEMYRYFULPRZPI-OAHLLOKOSA-N	432.864	1.863	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@H](NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)C1CC1	741272581	CLFJZRMERYTZQS-INIZCTEOSA-N	447.540	1.327	50	20	IDGD	
COc1cc(C(=O)NNc2nc3ccccc3c(=O)n2C)cc(NS(C)(=O)=O)c1OC	742671478	BAGYUFJBHAABCG-UHFFFAOYSA-N	447.473	1.079	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CCN2C[C@H](C)O[C@H](C)C2)cc(OC)c1OC(F)F	743289511	XJDPMKKJVQLSLZ-TXEJJXNPSA-N	431.436	1.566	50	20	IDGD	
COc1ccc(Cn2ncc3cc(C(=O)NNc4ncnc5[nH]cnc45)cnc32)c(OC)c1	743470671	KCFBXLWSEODTTC-UHFFFAOYSA-N	445.443	1.920	50	20	IDGD	
Cc1ccc(N2CC[C@@H](NC(=O)NNC(=O)c3csc(N4CCOCC4)n3)C2=O)cc1	743509858	MATUEDQSSGFMBV-OAHLLOKOSA-N	444.517	1.038	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)CN2CCCN(C(=O)c3ccc(Cl)cc3)CC2)cc1	744390964	MFVQWRFBQYIEMT-UHFFFAOYSA-N	439.903	1.821	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)[C@H]1CCCN(C(=O)COc2ccccc2)C1	746549715	VSXOAUYTYTZJMU-KRWDZBQOSA-N	435.484	1.342	50	20	IDGD	
C[C@@H](c1ccncc1)N1CCC(NC(=O)NNC(=O)CNC(=O)c2cccs2)CC1	747949485	AJVJMXGCLSPXOX-AWEZNQCLSA-N	430.534	1.429	50	20	IDGD	
COc1cc(C=NNC(=O)C(=O)N2CCCC2)cc(I)c1OC	748136433	ILXODSBMTFMBQR-UHFFFAOYSA-N	431.230	1.381	50	20	IDGD	
CN(C)N(C(=O)c1cccc(F)c1I)[C@H]1CCS(=O)(=O)C1	749648295	SFUSMLXEKQNARD-VIFPVBQESA-N	426.251	1.536	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)N[C@H]1CCN(CCCc2ccccc2)C1=O	750292986	VRARDZZSPZCJOG-FXAWDEMLSA-N	438.484	1.391	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)CC2CCCC2)cc1S(=O)(=O)N1CCOCC1	755412856	IKSKTWCRRSBADW-UHFFFAOYSA-N	440.522	1.449	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2cc(Br)c[nH]2)cc(F)c1F	755952608	AYWVTPPFOVXFET-UHFFFAOYSA-N	438.206	1.465	50	20	IDGD	
CN(C)C(=O)Cn1ccc(NC(=O)NNC(=O)c2ccc(F)cc2Br)n1	756310408	BZESZBYWVWNYSB-UHFFFAOYSA-N	427.234	1.339	50	20	IDGD	
COC(=O)c1ccc(NC(=O)NNC(=O)c2cncc(NC(C)=O)c2)c(OC(F)F)c1	756536289	UKSIHWMNDXPELT-UHFFFAOYSA-N	437.359	1.895	50	20	IDGD	
CCn1nnnc1-c1cccc(NC(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)c1	756687488	VAROMCHAXQSIQW-UHFFFAOYSA-N	441.448	1.852	50	20	IDGD	
C[C@H]1CN(C(=O)Cn2cc(NC(=O)NNC(=O)c3cc4c(s3)CCC4)cn2)C[C@@H](C)O1	756836632	CHKAVYAEMJGFIT-BETUJISGSA-N	446.533	1.536	50	20	IDGD	
COc1cc(C(=O)N(C)C)ccc1NC(=O)NNC(=O)c1cc(OC)c(OC)c(OC)c1	756868691	NOSJSBHOOBSVHW-UHFFFAOYSA-N	446.460	1.889	50	20	IDGD	
Cc1ccnn1-c1ccc(C(=O)N2CCN(S(=O)(=O)CBr)CC2)cc1	758522102	DXUAVQQUGCTTTO-UHFFFAOYSA-N	427.324	1.621	50	20	IDGD	
O=C1CCc2cc(C(=O)N3CCN(S(=O)(=O)CBr)CC3)c(F)cc2N1	758523973	QVLVUXZQLBVKLI-UHFFFAOYSA-N	434.287	1.150	50	20	IDGD	
Cc1nnc(-c2ccc(C(=O)OCC(=O)NNC(=O)[C@@H]3COc4ccccc4O3)cc2)o1	758968946	BSMOXQJCGSQRBM-KRWDZBQOSA-N	438.396	1.189	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)[C@@H]2CCCN2C(=O)/C=C/c2ccc(C(N)=O)cc2)nc1	759729464	VJVWNQKVYCWEDN-CEUCYRDJSA-N	437.456	1.115	50	20	IDGD	
CC1(C)C(=O)N(C[C@@](C)(O)C(=O)NNC(=O)COc2ccc(C#N)cc2)c2ccccc21	760054895	ZLXYQXGRCGTNMZ-HSZRJFAPSA-N	436.468	1.160	50	20	IDGD	
Cc1cc(C)nc(-n2nccc2NC(=O)C(=O)NNC(=O)Cc2ccc(Cl)cc2)n1	760276937	GPNWTIOHWXURAN-UHFFFAOYSA-N	427.852	1.261	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)c2cc(C)oc2C)c(OC)c1	761267540	SGNIGIWHLUCDPE-UHFFFAOYSA-N	431.492	1.290	50	20	IDGD	
COc1ccc2c(c1)[C@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)N3CCCC3)c1)CC2	761393176	UJDUPVCIBZTUMY-LJQANCHMSA-N	443.525	1.971	50	20	IDGD	
Cc1ccc(-c2nnc(S)n2CCC(=O)NNc2nccc(N3CCOCC3)n2)cc1	762857238	XEIPBKIQHGXEJH-UHFFFAOYSA-N	440.533	1.702	50	20	IDGD	
O=C(NNC(=O)c1ccncc1)C(=O)Nc1cccc(N2C(=O)c3ccccc3C2=O)c1	763467497	SAFLCPXIOVCJEZ-UHFFFAOYSA-N	429.392	1.282	50	20	IDGD	
CN1CCN(c2ccc(CNC(=O)NNC(=O)CSc3ccccc3O)cn2)CC1	763467752	YJWFUWUIXWAVHM-UHFFFAOYSA-N	430.534	1.162	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C)nc2Br)cc1OC	763542117	DWAJBFLTTDSDGB-UHFFFAOYSA-N	437.250	1.569	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2ccccc2N2C[C@H](C)O[C@H](C)C2)c1	763623789	NIIFABKYSCVYIC-CALCHBBNSA-N	440.500	1.774	50	20	IDGD	
Cc1nc(COc2ccc(NC(=O)C(=O)NNC(=O)COc3ccccc3F)cc2)no1	763681137	KPUJOHUALBSFDH-UHFFFAOYSA-N	443.391	1.261	50	20	IDGD	
O=C(COc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1cnc(-c2ccccc2)nc1	763695317	QAWBZPIKYCRKBB-UHFFFAOYSA-N	425.832	1.962	50	20	IDGD	
CN(C)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(Br)cc2)cc1	763696189	TYXBEVBIKJSYKK-UHFFFAOYSA-N	435.278	1.680	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(=O)n(Cc3ccccc3)c2)c1	763755025	ZSZXXSXKYVCSOV-UHFFFAOYSA-N	433.468	1.362	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)C(=O)Nc2cc(F)cc(F)c2)c2ccccc2c1=O	763790637	MDFNPIILIGXBJC-UHFFFAOYSA-N	429.383	1.655	50	20	IDGD	
CC(=O)Nc1cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(C(C)=O)cc2)ccc1C	763877306	JDQKPPCUGOGOSX-CQSZACIVSA-N	440.456	1.709	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccccc2-n2cccn2)cc1	763879031	VRJIQNULVKWEMN-OAHLLOKOSA-N	435.440	1.628	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3ccc4[nH]nc(C(N)=O)c4c3)cc2C1	763951028	YPZRJQVGKOTSBT-VIFPVBQESA-N	440.485	1.248	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)C(=O)Nc1ccc(O[C@H]2CCOC2)cc1	763994997	LARNBVMZMXYBDY-ZDUSSCGKSA-N	437.250	1.345	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)C(=O)Nc1ccc(-n2cccn2)c(F)c1	763995932	SGCHOMAIXKVYCN-UHFFFAOYSA-N	435.213	1.502	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2O1)C(=O)Nc1cccc(NC(=O)c2ccoc2)c1	764153230	KFGDGBGXIIKFSC-GOSISDBHSA-N	434.408	1.622	50	20	IDGD	
C[C@@H]1CN(C(=O)c2ccc(NC(=O)C(=O)NNC(=O)CC3CCCC3)cc2)C[C@@H](C)O1	764184139	NIBSDWKCDGQLRP-HUUCEWRRSA-N	430.505	1.602	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)CCc2ccccc2)cc1	764192870	LWXKTLVGYCNHFN-UHFFFAOYSA-N	432.502	1.092	50	20	IDGD	
COc1cc2nc(C)sc2cc1NC(=O)C(=O)NNC(=O)COc1ccccc1O	764277587	KEIMMRZTXQBDOB-UHFFFAOYSA-N	430.442	1.484	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)C(=O)Nc1ccc(NC(=O)CCN(C)C)cc1)c1ccccc1	764328408	FHNDLWGTCOZBCX-LJQANCHMSA-N	439.516	1.857	50	20	IDGD	
CCOC(=O)c1c(F)cccc1NC(=O)C(=O)NNC(=O)c1cnn(-c2ccccc2)c1	764346376	YNXBGTIVRZNFMQ-UHFFFAOYSA-N	439.403	1.588	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)C(=O)Nc1ccnn1Cc1cccc2ccccc12	764353237	GHXOWFBAGWKGGG-UHFFFAOYSA-N	428.452	1.808	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)C(=O)Nc1cccc(Cl)c1-n1cncn1	764368062	UHUMJKCMBKYOKE-UHFFFAOYSA-N	428.836	1.223	50	20	IDGD	
Cc1ccc(-n2nc(C(C)(C)C)cc2NC(=O)C(=O)NNC(=O)[C@@H]2COCCO2)c(C)c1	764426426	USNMEZYZNXUIFR-INIZCTEOSA-N	443.504	1.288	50	20	IDGD	
COc1cccc(-c2cc(C(=O)NNC(=O)c3sc(N4CCOCC4)nc3C)n[nH]2)c1	764559578	VDKSHTRVNKMFGT-UHFFFAOYSA-N	442.501	1.762	50	20	IDGD	
CC(=NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1)c1cc(C)ccc1O	764816341	IZPKVSVVDDLRIN-UHFFFAOYSA-N	444.557	1.856	50	20	IDGD	
CC(=O)Nc1cc(S(=O)(=O)NNC(=O)c2cc(F)ccc2Br)ccc1O	765078404	JPJRILSMCXNNOM-UHFFFAOYSA-N	446.254	1.876	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)c1cnc2c(c1)c(O)nc(=O)n2C1CC1	765248418	RPHILXBTDQJZPA-UHFFFAOYSA-N	427.442	1.091	50	20	IDGD	
CC(=O)[C@@H]1CC(C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)=NN1c1ccccc1	765312871	FNLFNVHMHRISQQ-KRWDZBQOSA-N	431.493	1.663	50	20	IDGD	
CC(C)(C)OC(=O)N1CCO[C@@H](CC(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)C1	765390099	ADIXRAGYCLTFTP-HNNXBMFYSA-N	429.477	1.864	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)c1ccc(Cl)c(N2CCNC2=O)c1	767374710	NLWPIYAYTBSXHW-UHFFFAOYSA-N	444.875	1.725	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)CCC(=O)N2CCN(c3ccccn3)CC2)c(C)c1	767853421	SCTJQKCGTQVJBQ-UHFFFAOYSA-N	438.532	1.387	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2ccccc2COC2CCOCC2)n1	768117082	QFDWOTKRRLNARA-UHFFFAOYSA-N	447.513	1.694	50	20	IDGD	
CCNC(=O)N(C)NC(=O)[C@@H]1Cc2ccccc2CN1S(=O)(=O)c1ccc(C)cc1	768408701	AJNZTWUSXWKBLM-IBGZPJMESA-N	430.530	1.803	50	20	IDGD	
Cc1nc(S(=O)(=O)N2CCC(C(=O)NNc3cc(C#N)cc(Cl)n3)CC2)cn1C	768701393	QZNDAQQDDYEWPL-UHFFFAOYSA-N	437.913	1.193	50	20	IDGD	
CSCCNC(=S)NNC(=O)/C(=C\c1ccco1)n1nnnc1-c1ccccc1	770246065	JEZPTDLNMHHFLV-NTCAYCPXSA-N	429.531	1.790	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)N[C@H]3CCC[C@H](S(C)(=O)=O)C3)nc21	770396407	HXVIGAISFCVBBT-QWRGUYRKSA-N	425.515	1.269	50	20	IDGD	
O=C(NCCNS(=O)(=O)c1cccc([N+](=O)[O-])c1)NNc1c(F)cccc1Cl	771307308	FIGZVBUVCXVSMC-UHFFFAOYSA-N	431.833	1.992	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)CCC(=O)c1cc(Br)ccc1OC	771844463	DTQHGHPAKHQBNL-JTQLQIEISA-N	429.267	1.910	50	20	IDGD	
COc1ccc([C@H](OC)[C@H](C)NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1	772582977	QKVGKKUKAZMJMU-ORAYPTAESA-N	439.472	1.662	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@H](C)C(=O)NNC(=O)[C@H](C(C)C)N1CCCS1(=O)=O	772629278	DCROVMCYBKHQMK-ZBFHGGJFSA-N	445.969	1.932	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNS(=O)(=O)c1ccc2c(c1)C(=O)N(C)C2=O	773267844	XQMRQAFDYREYCC-JTQLQIEISA-N	437.861	1.343	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1ccc(Br)cn1	773530337	VIKMTCYKQKYVDX-UHFFFAOYSA-N	427.642	1.906	50	20	IDGD	
Cc1ccc([C@@](O)(CC(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)C(F)(F)F)o1	773594875	QAFMMIVPUAMGTH-KRWDZBQOSA-N	447.797	1.845	50	20	IDGD	
COC[C@@H](NC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)c1ccc(F)c(F)c1	773787316	SAMJBGOYNDGBRN-MRXNPFEDSA-N	427.429	1.700	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NNC(=O)c2cnn(-c3ccc(F)cc3)n2)C1	774247915	XMCPCRQJUFIJRK-CYBMUJFWSA-N	432.456	1.815	50	20	IDGD	
O=C(NCC1CCN(C2CC2)CC1)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	775203884	JRTQJFDRQALBLH-UHFFFAOYSA-N	449.577	1.290	50	20	IDGD	
COc1ccnc(NNC(=O)Nc2ccc(S(=O)(=O)N3C[C@@H](C)O[C@H](C)C3)cc2)n1	775447531	YSNULBHSTNGXGB-CHWSQXEVSA-N	436.494	1.432	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)Nc2ccc(C[C@@H]3NC(=O)NC3=O)cc2)cc1	775708428	OPECKFZIZQGXDJ-INIZCTEOSA-N	427.486	1.691	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)on1)Nc1ccnn1[C@H]1CCS(=O)(=O)C1	776055154	HGBHAHFCXUSNMQ-ZDUSSCGKSA-N	430.446	1.364	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)[C@H]2CS[C@@H](Cc3ccccc3F)C(=O)N2)c1	776714487	GWQGMWKSYSCEKH-SJORKVTESA-N	437.518	1.515	50	20	IDGD	
CCOC(=O)N1CCC[C@H]([C@H](C)NC(=O)NNC(=O)c2cc(Br)c[nH]2)C1	776844082	DLLYUFFCDVOHLP-QWRGUYRKSA-N	430.303	1.978	50	20	IDGD	
Cc1oc(-c2ccco2)nc1CC(=O)N1CCN(S(=O)(=O)CBr)CC1	777777893	RPACUPYQPGIPGN-UHFFFAOYSA-N	432.296	1.612	50	20	IDGD	
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	779389692	VXLIKGLLNIXPNW-GFCCVEGCSA-N	428.511	1.337	50	20	IDGD	
CNS(=O)(=O)c1cccc(NC(=O)C(=O)NNc2ccc(Br)cc2)c1C	783005717	FNRQXTUPEWAGJY-UHFFFAOYSA-N	441.307	1.747	50	20	IDGD	
Cn1c(=NNC(=O)C(=O)Nc2ccc(CN3CCOC3=O)cc2)sc2ccccc21	783349195	BZZLEHYMEPIZGC-UHFFFAOYSA-N	425.470	1.763	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2cccc(Cl)c2SCC(F)F)CCS(=O)(=O)C1	783428762	XHGJFESJOJILGW-HNNXBMFYSA-N	441.909	1.834	50	20	IDGD	
COc1ccc(S(=O)(=O)NC2CC2)cc1NC(=O)C(=O)NNc1ccc(F)cc1C	783444030	BKVULHXPQVEGNI-UHFFFAOYSA-N	436.465	1.665	50	20	IDGD	
CC[C@@H](C)n1ncc(NC(=O)C(=O)NNC(=O)CNC(=O)c2cccs2)c1C1CC1	784003551	IGPZHJVERVDYBH-LLVKDONJSA-N	432.506	1.309	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1ccc(Br)cc1	784003583	JUBNYSVKVVQEFN-UHFFFAOYSA-N	425.264	1.027	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1NC(=O)C(=O)NNC(=O)CNC(=O)c1ccco1	784003865	CUTKNFSFPOSEBN-UHFFFAOYSA-N	427.442	1.227	50	20	IDGD	
O=C(NNc1c(F)cc(C(=O)NC2CC2)cc1F)C(=O)Nc1cnn(-c2ccccc2)n1	785100150	RVECIWFKFGZZEY-UHFFFAOYSA-N	441.398	1.520	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2cc(Br)cn(C)c2=O)cc1Cl	785120007	BHDMKAMZUFCHCM-UHFFFAOYSA-N	429.658	1.892	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)C(=O)Nc3cccnc3-n3cccn3)n[nH]2)c1	785127344	GOOBFOGPORSHME-UHFFFAOYSA-N	444.455	1.674	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cc([N+](=O)[O-])cc(C)c2F)cc1OC	787944988	RAAQEXLFEDJVRE-UHFFFAOYSA-N	435.364	1.678	50	20	IDGD	
CCc1[nH]nc(C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)c1Br	789872239	ZSBYDMJXGZAQNZ-UHFFFAOYSA-N	443.327	1.411	50	20	IDGD	
Cc1cnn(Cc2cc(F)ccc2F)c1NC(=O)C(=O)NNc1nc2ccccn2n1	792395233	QOBFPJAVQKKWNX-UHFFFAOYSA-N	426.387	1.643	50	20	IDGD	
Cn1cc(S(N)(=O)=O)cc1C(=O)NNC(=O)c1cc(-c2ccco2)nc2ccccc12	792992119	LGWDRSCXQPEFSH-UHFFFAOYSA-N	439.453	1.556	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2CCCN(C(=O)c3ccc(F)cc3)C2)cc1	793212629	KMQJMCMHPGIZEX-MRXNPFEDSA-N	426.448	1.772	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1	795169325	MXIFRRIPTUGKKS-UHFFFAOYSA-N	430.446	1.788	50	20	IDGD	
CC(C)Oc1cc(NC(=O)NNC(=O)CNC(=O)OCc2ccccc2)ccc1C(N)=O	797651484	GIBMZINVKMJSKE-UHFFFAOYSA-N	443.460	1.652	50	20	IDGD	
CCOc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NNC(=O)c1ccc(OC)cc1OC	799259039	MUYPJMZHQFGFMH-UHFFFAOYSA-N	432.389	1.410	50	20	IDGD	
CNS(=O)(=O)c1ccccc1S(=O)(=O)NNC(=O)[C@H](C)Oc1cccc(Cl)c1	799543955	XOPDBWRQYONLDD-NSHDSACASA-N	447.922	1.025	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)nnn1CCOc1ccc(F)cc1	799854741	BWLMFCZTTATBKO-UHFFFAOYSA-N	428.380	1.788	50	20	IDGD	
CC(CCc1ccc(C(F)(F)F)cc1)=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O	800809684	FWLHHTFSBFPUSL-UHFFFAOYSA-N	443.451	1.715	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CC(=O)N(c2ccc3c(c2)OCCO3)C1)Nc1cc(F)cc(F)c1	802004445	FKRXYJBBVXOCDD-LLVKDONJSA-N	432.383	1.942	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCCCCC2)cc1C(=O)NNC(=O)N=c1cc[nH]cc1	802029728	QNVIYIOCQFVNLG-UHFFFAOYSA-N	447.517	1.543	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)COc2cccc(NC(=O)C3CC3)c2)cc1	802064843	DDFVDWMFEHKQSN-UHFFFAOYSA-N	446.485	1.670	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@H](c2ccccc2)N2CCC(O)CC2)cc1	802068191	DOCYJBHKRWKBID-IBGZPJMESA-N	446.529	1.441	50	20	IDGD	
COc1ccccc1[C@]1(C)NC(=O)N(CC(=O)NNc2ccc([N+](=O)[O-])cc2C)C1=O	805387055	SHEMDCONYXQAJV-FQEVSTJZSA-N	427.417	1.822	50	20	IDGD	
CCc1nnc(NC(=O)[C@@H](C)[C@@H](C)NC(=O)NNc2ccccc2S(C)(=O)=O)s1	805878494	NAORPHDOGMRXJV-WDEREUQCSA-N	440.551	1.793	50	20	IDGD	
CC(=O)c1cc(NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)ccc1F	806574915	JHJAVIKCGAHLEU-UHFFFAOYSA-N	436.465	1.810	50	20	IDGD	
CCN(CC)CC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2scnc2C)c1	806978951	NXFRWBMUTHFSPV-UHFFFAOYSA-N	432.506	1.132	50	20	IDGD	
COc1cc(F)cc(NNC(=O)C(=O)N2C[C@H](C[C@@H]3COCC(=O)N3)c3ccccc32)c1	807025814	WKETWBRJIFXZDN-XJKSGUPXSA-N	442.447	1.313	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc3nccnc3c2Br)n1	807070519	NIWJXGALEIUKJA-UHFFFAOYSA-N	429.234	1.495	50	20	IDGD	
COC(=O)c1cc(NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc2[nH]ccc12	808874344	XMZWCAFUPGVBIV-UHFFFAOYSA-N	434.412	1.668	50	20	IDGD	
CC[C@H]1[C@H](C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)CCN1C(=O)OC(C)(C)C	810348683	QXXHIYFZKUISRR-SJORKVTESA-N	446.552	1.876	50	20	IDGD	
COC[C@]1(CNC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)OCCc2ccccc21	811923741	XJVRXTFWBOJKQR-NRFANRHFSA-N	447.513	1.149	50	20	IDGD	
CC(C)NS(=O)(=O)NCCNC(=O)NNc1ccc(Br)cc1Cl	812204241	AVHFOBVLDNFIQK-UHFFFAOYSA-N	428.740	1.561	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2ccc3c(c2)NC(=O)CNC3=O)c(C)n1-c1ccccc1	814204251	FIBCOKKDTNPQKL-UHFFFAOYSA-N	431.452	1.851	50	20	IDGD	
CC(=NNC(=O)c1nnc(-c2ccccc2)o1)c1ccc(S(=O)(=O)CC(N)=O)cc1	814816611	XNMUZMAWGFQRCB-UHFFFAOYSA-N	427.442	1.150	50	20	IDGD	
O=C(CCc1ccco1)NNC(=O)C(=O)Nc1ccn(-c2ccc(Br)cc2)n1	815568295	CDGPCWLLEQQNIX-UHFFFAOYSA-N	446.261	1.947	50	20	IDGD	
O=C(NNC(=O)c1cccc(OC(F)F)c1)C(=O)Nc1cn(Cc2ccccc2)nn1	815569440	UAPUWJZRBDMCIB-UHFFFAOYSA-N	430.371	1.328	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)CCCc2cccs2)nnn1Cc1ccccc1F	815569738	FZLZCFSOKXAJJD-UHFFFAOYSA-N	444.492	1.944	50	20	IDGD	
CCOC(=O)Nc1ccc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)N(C)C)cc1	815752483	UOARCBZFCMXZMI-UHFFFAOYSA-N	449.489	1.587	50	20	IDGD	
CCOc1ccc(NNC(=O)C(=O)N2C[C@H](C[C@@H]3COCC(=O)N3)c3ccccc32)cc1	815817118	DJKSISWLTMFYLB-DOTOQJQBSA-N	438.484	1.564	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)CN1c2cccc3cccc(c23)S1(=O)=O	863999210	PEVXIUTYTDZCRM-UHFFFAOYSA-N	441.465	1.584	50	20	IDGD	
CC(C)C[C@H](C(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)N1C(=O)[C@@H]2CC=CC[C@H]2C1=O	866751093	UEMREQWLDXESBV-BRWVUGGUSA-N	428.445	1.722	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)[C@@H]1CS[C@@H](Cc2ccccc2F)C(=O)N1	892665578	QHDSEPUIISBIEZ-IWEFOYFVSA-N	449.479	1.722	50	20	IDGD	
O=C(Cc1ccccc1[N+](=O)[O-])NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	912643258	MWVFWSPCBJMGDJ-UHFFFAOYSA-N	446.485	1.773	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)Cn2c(C)nc3ccccc3c2=O)c2ccccc2c1=O	914265482	OALMTGDEKUASIU-UHFFFAOYSA-N	446.467	1.286	50	20	IDGD	
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC(=NNC(=O)COc2ccccc2C#N)CC1	914559360	LAAHIESJUHLTSV-UHFFFAOYSA-N	430.490	1.234	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)[C@@H](Cc1cccc(F)c1)n1nnnc1C	915685009	JEJOUKICICBDQR-QGZVFWFLSA-N	442.451	1.530	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)NCCCN2C(=O)NC3(CCCC3)C2=O)c2ccccc2n1	915906300	YYPSCHQRNSXBDO-UHFFFAOYSA-N	438.488	1.742	50	20	IDGD	
Cc1nc2c(c(C)nn2C)c(C)c1CC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	916124747	FIBOFIMNOJCVGO-UHFFFAOYSA-N	433.472	1.144	50	20	IDGD	
Cc1ncc(CO)c(C=NNC(=O)Cc2nn3c(C4CCCCC4)nnc3s2)c1O	916327555	FDTISNANIQOIGO-UHFFFAOYSA-N	429.506	1.828	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NCc2ccc(N3CCO[C@H](C)C3)nc2)cc1	916392861	NSAGSUWFRRCCAT-OAHLLOKOSA-N	429.477	1.225	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2ccc(Cl)nc2)cc1S(=O)(=O)NC(C)(C)C	917248946	HZLDMVLZIPMHEU-UHFFFAOYSA-N	440.909	1.895	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)NC[C@H]2CCCO2)c1)c1ccc(Cl)nc1	917253489	ODTPRSZCMZZHNV-CQSZACIVSA-N	438.893	1.267	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)N[C@H](C)c1cccc([N+](=O)[O-])c1	918002026	LVTZFMOMLONGOW-LLVKDONJSA-N	434.478	1.902	50	20	IDGD	
O=C(NNC(=O)[C@H]1CC(=O)N(c2ccc3c(c2)OCCO3)C1)c1ccc(Cl)cc1O	918358007	SUEGGLJEHXSHTP-NSHDSACASA-N	431.832	1.631	50	20	IDGD	
CCS(=O)(=O)N1CCC[C@H](C(=O)NNC(=O)c2cc(C)n(-c3ccccc3)c2C)C1	918551710	FNBHPYAJFHBWSR-KRWDZBQOSA-N	432.546	1.917	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN(c2nc3ccccc3s2)C1)N[C@H]1CCS(=O)(=O)C1	919886656	SZMBTWKNYFRZBI-STQMWFEESA-N	437.547	1.030	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)[C@H](CCSC)N1C(=O)[C@@H]2CCCC[C@H]2C1=O	920006370	JCFOZIUWGLOEQL-ZACQAIPSSA-N	447.557	1.682	50	20	IDGD	
C/C=C/COc1ccc(CCC(C)=NNC(=O)CSc2nn(C)c(=O)n(C)c2=O)cc1	920370921	ONUGIUOWSLNWHU-SVSRNIHGSA-N	445.545	1.651	50	20	IDGD	
CC[C@@]1(C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)CCN(C(=O)OC(C)(C)C)C1	1116339877	LCRCOCSFPHJHKL-JOCHJYFZSA-N	444.488	1.900	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)NCCCN2CCCCC2=O)CC1	1251918980	JFXYCQJZWPJMNQ-UHFFFAOYSA-N	425.530	1.367	50	20	IDGD	
CC1(C)NC(=O)N(CCCNC(=O)NNC(=O)c2ccc(Br)s2)C1=O	1263024857	LYUYTAGCKOXCSQ-UHFFFAOYSA-N	432.300	1.175	50	20	IDGD	
O=C1CCCc2cc(S(=O)(=O)NNC(=O)c3cncn3-c3ccccc3)ccc2N1	1317953942	ZZGJGCZMNOXBBQ-UHFFFAOYSA-N	425.470	1.770	50	20	IDGD	
Cc1c(NC(=O)[C@H](C)SCC(=O)NNc2cccnn2)c(=O)n(-c2ccccc2)n1C	1320054225	RCDAGAFSKBTMEV-AWEZNQCLSA-N	441.517	1.478	50	20	IDGD	
CS(=O)(=O)Nc1cccc(F)c1CNC(=O)NNC(=O)Cc1ccc(Cl)cc1	1322460742	UPPMIUJHHNYKJO-UHFFFAOYSA-N	428.873	1.924	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)Nc2ccc(N3CCOCC3)cn2)CC1	1324722087	PWMAYRBQONKSOZ-UHFFFAOYSA-N	448.524	1.718	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4cc(OC)ccc4n3)C2)C1	1777900354	RRAPQCQSIDJDPK-JTSKRJEESA-N	447.919	1.941	50	20	IDGD	
Cc1nc2ncccn2c1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1777901735	QJYNGIHYBSTDOK-DYVFJYSZSA-N	440.273	1.172	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnc(O)nc2O)C1	1778009365	UKNZBJKDPDKMSZ-OCBCSQNSSA-N	447.319	1.252	50	20	IDGD	
O=C(c1ncon1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](Br)Cc1ccccc1)CCO2	1779871727	GGGOTPVPQQHUFF-HNAYVOBHSA-N	449.305	1.519	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc(O)c(F)c2)C1	1780925068	UXFWPIZHIFWJJI-JNAXZKDPSA-N	428.888	1.913	50	20	IDGD	
Cc1ccccc1NCC(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781331266	NJYHVXPBBOPNDG-AEFFLSMTSA-N	428.302	1.927	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(CCN(C(=O)c3cccc(F)c3[N+](=O)[O-])C2)C1	1781768899	MULSJWXNUCMNOF-KRWDZBQOSA-N	444.257	1.962	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](CC)NC(N)=O)C2	1781899868	BISYNYZIJDHHFR-UHQDVWGKSA-N	447.374	1.121	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](C)Nc1ccccn1)CCO2	1783349224	KEJWSLFNAZEUKK-DOXZYTNZSA-N	439.354	1.885	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)Cc3ccc(C(=O)OC)s3)CCO2)C1	1783881117	JAFHUVMQJQFPPW-LIRRHRJNSA-N	444.937	1.161	50	20	IDGD	
C[C@H](Sc1ccccc1)C(=O)N1CCO[C@@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1	1783933292	GLIPKMVBCDRYPX-HTAPYJJXSA-N	448.589	1.370	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCBr)[C@H]2C1	1786407283	NCRGIWVYLATAPT-RFGFWPKPSA-N	435.315	1.313	50	20	IDGD	
O=C1CSc2cc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)[C@H](F)Cl)C[C@@H]43)ccc2N1	1787388806	XUMSTXHHLLTVEB-GWIFVGGISA-N	441.912	1.859	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4c(c3)OCO4)[C@H]2C1	1787808526	JFZUCHGXMRDKGH-BXWFABGCSA-N	434.565	1.860	50	20	IDGD	
CC(C)N1CCC[C@H]1C(=O)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1	1788149258	GDTCWXLVBAKFPI-QFIPXVFZSA-N	449.360	1.987	50	20	IDGD	
CC#CC[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)c1ccccc1	1788704972	KVIHSPXQDWYBDK-FCMAGTKHSA-N	432.948	1.763	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(C(C)(C)C)n[nH]3)[C@H]2C1	1788915755	XKLXBOCLACELFH-YXWQFLTLSA-N	426.945	1.554	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C3(C(F)(F)F)CC3)C[C@@H]21)[C@@H](F)Br	1789926365	VDAZUVQODHSTEU-XWLWVQCSSA-N	431.224	1.999	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3c(F)ccc(O)c3F)[C@H]2C1	1790212648	HEWLGYUPNCVWCN-OHTBPHCPSA-N	432.851	1.518	50	20	IDGD	
CCOC(=O)N[C@H](O)C(=O)NC1(c2ccc(NC(=O)[C@H](Cl)COC)cc2)CCC1	1791568845	KAPYRVLMVWJXCX-GDBMZVCRSA-N	427.885	1.439	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)Oc3cccnc3)[C@H]2C1	1791654364	PYUQSOUEIKOTPD-BJMQQELFSA-N	440.338	1.612	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C=C/c3cnccn3)[C@H]2C1	1791699530	JXVSUOMXPXHHCB-OQSFXPJBSA-N	437.338	1.643	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)n3ccnc3C)[C@H]2C1	1791707324	DQUXSMURHZYHNC-DWBZUHSKSA-N	441.370	1.906	50	20	IDGD	
CC(C)N(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](O)CCl)C2)C(=O)OC(C)(C)C	1792673521	QTIMBTWBJYWONV-QKPAOTATSA-N	431.961	1.870	50	20	IDGD	
COC[C@@H](C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2	1793440803	CRDYPWHIBPZHSG-NFWAQSGPSA-N	449.460	1.006	50	20	IDGD	
Cc1ccc(NCCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)c(C)c1	1796188875	WKLVKDKNKZKTAA-KOUNCHBCSA-N	449.360	1.737	50	20	IDGD	
COc1cc(OC)c(F)c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Cl)c1F	1796363618	ZOQVRERRVKVUAB-PSNKQFAISA-N	436.814	1.720	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccnn1-c1ccccc1	1796739079	WMJYPTJXNGNQSU-AFIMGQEJSA-N	447.333	1.859	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc3n[nH]cc3c1)C2	1796892129	JYEARMFVXOWCSJ-DIWZVOJHSA-N	447.499	1.949	50	20	IDGD	
Cn1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CO[Si](C)(C)C)C3)c2cccnc21	1797575387	VTNUDVREZDRYJN-CCWDJLKJSA-N	430.581	1.628	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1[C@H]2Sc3ccccc3[C@@H]21	1797771862	SUKFITKUHUDSDG-PHYLFGOOSA-N	436.961	1.718	50	20	IDGD	
C[C@H](Nc1cccnc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Br	1799346654	UZISWZNQZHYWCZ-ZZVJUGKHSA-N	429.290	1.162	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc([N+](=O)[O-])cc1F	1800352339	IJHZHSAHYUSTCH-BTTYYORXSA-N	435.456	1.359	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)Nc1nccs1)C2	1800639025	GCZMXFHVVRQLMB-HPCHECBXSA-N	445.383	1.707	50	20	IDGD	
CC(C)(C)OC(=O)N1C(=O)CC[C@@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2	1801158503	MWWQMDXJMDQSSX-BUONHZGMSA-N	447.891	1.037	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cc1ccc(S(C)(=O)=O)cc1)C2	1802273676	OBSAOCLTDFIYEZ-KYHPRHEASA-N	442.965	1.525	50	20	IDGD	
O=C(Cc1cnc2ccccn12)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1	1803097374	JEVMVERFYSLOOO-MDKPJZGXSA-N	441.919	1.578	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)Cc2cccc(Cl)n2)[C@@H]1c1cccnc1)[C@H](O)CCl	1803141841	SIQLTNZLYIAKRN-ZSZQSSIHSA-N	437.327	1.978	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cccc3nccn23)[C@H]1c1cccnc1)[C@@H](O)CCl	1803146542	BPPBXSMRHAWCBI-IEZWGBDMSA-N	427.892	1.649	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)Cc2ccc3c(c2)CCO3)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803148055	NWODBNUAJDIGLK-CNNODRBYSA-N	443.931	1.865	50	20	IDGD	
Cc1ccc(C(=O)NC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)o1	1803788776	KXIOESNZFGGRGP-LAUBAEHRSA-N	427.505	1.676	50	20	IDGD	
Cn1cc(C(=O)N2CCC3(CCCN(C(=O)[C@@H](O)CCl)C3)CC2)c(C(F)(F)F)n1	1805522405	IMBINIXLTZYELQ-ZDUSSCGKSA-N	436.862	1.883	50	20	IDGD	
O=C(CCBr)NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1	1806340979	SNQMGIBXKFKZSW-UGSOOPFHSA-N	449.305	1.992	50	20	IDGD	
Cc1cccnc1C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1807364666	TUFMTMSFFWTHGD-KNQAVFIVSA-N	444.300	1.098	50	20	IDGD	
Cc1ccc(C(=O)N2CCCC3(CCN(C(=O)c4cccc(B(O)O)c4)CC3)C2)nc1C	1807791816	YJCBCYZCDMPRTH-UHFFFAOYSA-N	435.333	1.537	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)c3cnc4ccccn34)CC2)C1	1809978698	KTSYKXOSMQWWMM-UHFFFAOYSA-N	446.316	1.173	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)[C@@H]2CNC(=O)O2)[C@H]1c1cccnc1	1812774530	XNZFJKIXKXSOTM-AJNGGQMLSA-N	439.310	1.369	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)c2ccc[n+]([O-])c2)[C@@H]1c1cccnc1	1812864583	ISFKUPLNUWUVRK-YSVLISHTSA-N	433.306	1.818	50	20	IDGD	
CC(C)(CCl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2nccnc2C(N)=O)[nH]n1	1814697411	DYLVUXLGSPJLRY-LBPRGKRZSA-N	433.900	1.870	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2CC(c3ccccc3)=NN2)[nH]n1)[C@@H](O)CCl	1814875147	QAZRRGXZDVCGQA-BZSNNMDCSA-N	444.923	1.768	50	20	IDGD	
Cc1nc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)cs1	1816577651	CCZRBYVRBPNHFR-KRWDZBQOSA-N	439.306	1.474	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)CCN2CCCCC2)n[nH]1	1816977684	BJYWTXKBFDVPRG-SFHVURJKSA-N	447.584	1.651	50	20	IDGD	
Cc1ncc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)s1	1818405766	DCMSCOMWXDIVFS-INIZCTEOSA-N	439.306	1.474	50	20	IDGD	
CO/C=C(\C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819403432	LWSFSTPCLSSZGO-LPQFERQCSA-N	427.465	1.264	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819403803	GMMGWQCUGZXYFG-HIFRSBDPSA-N	433.900	1.732	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(CO)on2)n[nH]1	1820348875	KMLZBUYGNRRCIN-RNCFNFMXSA-N	426.271	1.979	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccnc2C(N)=O)CC1	1825400754	DXUOOKBYLABEIK-DLBZAZTESA-N	436.940	1.668	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCN1CCOCC1)CC2	1825640994	GHOPKHWCEWVXHL-NEPJUHHUSA-N	445.383	1.561	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2CCC(=O)N2)CC1	1826536904	JVHWTKPPYGRNNX-BPUTZDHNSA-N	428.371	1.916	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])[nH]2)CC1	1829836136	RXWJYKAZBCGWSS-QGZVFWFLSA-N	448.524	1.529	50	20	IDGD	
Cc1cccc2[nH]c(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)[C@H](O)CCl)CCO4)cc12	1830731707	OMKKPSQCLUVXAY-WIYYLYMNSA-N	435.908	1.146	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C13CC(F)(C1)C3)CCO2	1831592803	JSVAACAHTREFBA-BQPQTXTPSA-N	433.318	1.509	50	20	IDGD	
C[C@@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1)n1ccnc1	1831870491	DJMDKYLULGKMKS-HKUYNNGSSA-N	432.569	1.437	50	20	IDGD	
Cc1cnn([C@H](C)C(=O)N2CCC([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)c1	1831876503	GSXOOTYBVPYVKN-UYAOXDASSA-N	446.596	1.745	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccnc(F)c3)CCO2)C1	1831905037	OTHCXRVSAKASKV-MSOLQXFVSA-N	434.295	1.527	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3sccc3F)CCO2)C1	1831910962	YYCQUEUFORXHIQ-YVEFUNNKSA-N	449.342	1.988	50	20	IDGD	
C[C@@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1)n1cccc1	1832108247	MRVIDAFUMUQWIX-PGRDOPGGSA-N	437.349	1.662	50	20	IDGD	
Cc1nc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)ccc1F	1833465509	DHJYMSHNDMPOJW-RHSMWYFYSA-N	448.264	1.290	50	20	IDGD	
Cc1cnc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@](C)(Cl)CCl)C3)C2)s1	1833804503	ZNCVMQYZDWQTCX-IAGOWNOFSA-N	436.361	1.758	50	20	IDGD	
Cc1ncncc1C(=O)NC1CCN(C2CCN(C(=O)CO[Si](C)(C)C)CC2)CC1	1835971942	FTELGEHKRDSYPA-UHFFFAOYSA-N	433.629	1.822	50	20	IDGD	
O=C(c1cc2cccnc2[nH]1)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1837011766	MSSVRSLZJXNQAD-GOSISDBHSA-N	427.288	1.437	50	20	IDGD	
O=C(c1ccn2cncc2c1)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1837082462	TUSYCVRCYVXYPE-SFHVURJKSA-N	427.288	1.208	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(CO)o3)CCO2)C1	1837971766	HRNVXYJICFUSTK-KBXCAEBGSA-N	445.310	1.015	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3ccnc(OC)c3)CC2)CC1	1838466065	OBXHTRYUQDMGKJ-SFHVURJKSA-N	439.940	1.956	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCSC)CC2)CC1	1838786657	PTLWJMRRPWANGA-DLBZAZTESA-N	437.002	1.353	50	20	IDGD	
Cc1ccc(CC(=O)N2CCC(OC3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)o1	1838789437	PSDBSISSIFBHCN-UHFFFAOYSA-N	448.564	1.502	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(-n4ccnc4)ccn3)CCO2)C1	1838795747	NLVJDFHNZFFJQB-LAUBAEHRSA-N	447.923	1.355	50	20	IDGD	
COc1ccccc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)Br)CCO2	1840034212	DTVDJGVYHBGPEB-IFXJQAMLSA-N	441.322	1.549	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)c(O)c1	1840036888	RVEJBKYUQWBWMC-LIRRHRJNSA-N	441.322	1.554	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CCc4ccccc43)C2)C1	1840155595	FMFCVWKTRLINJE-CNNODRBYSA-N	436.936	1.427	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C=C/c3cnc(C)s3)C2)C1	1840155621	BTZWBUVCYWBHKA-HLPXUMPJSA-N	443.953	1.175	50	20	IDGD	
Cc1cccc(F)c1C(=O)N1CCO[C@@]2(COCCN(C(=O)CCBr)C2)C1	1840650285	HHWMTQAMQSGMBA-LJQANCHMSA-N	443.313	1.989	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC2(CCCN2C(=O)[C@@H](O)CNC(=O)OC(C)(C)C)C1	1841300150	ROUKWCIEFVSWFN-STQMWFEESA-N	448.358	1.249	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)C13CC(c4ccccc4)(C1)C3)C2	1844265553	ODZGOXIQXRIIIA-UHFFFAOYSA-N	445.523	1.624	50	20	IDGD	
CCn1nccc1C(=O)N1CC2(CCCN2C(=O)c2cc([N+](=O)[O-])ccc2OC(C)=O)C1	1844692218	VTOZXDAHHBESEM-UHFFFAOYSA-N	441.444	1.867	50	20	IDGD	
C[C@H]1C[C@@]1(C)C(=O)N1CCCC12CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2	1845087769	DZIPQTJQIIRHKR-HTAPYJJXSA-N	427.549	1.582	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)[C@@H](C)c2ccc(O)cc2)C1	1845184060	DQMHXFOUUXPLCC-BDKXHVGHSA-N	437.500	1.833	50	20	IDGD	
C#CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)[C@H](F)Br)C1	1845220806	OVXHOVSKKOFCPS-OLZOCXBDSA-N	446.317	1.797	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)CN(Cc2ccccc2)C(=O)OC)C1	1846260685	UIRITTBXGQUIJV-QGZVFWFLSA-N	437.924	1.712	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@H]1CCN(C(=O)OC(C)(C)C)C1)C2	1846362747	UFROZGXTLKSNDY-CABCVRRESA-N	429.945	1.701	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC2(CCCN2C(=O)CCN2CCCC2)C1	1847123628	DPKCWMLTULLJNV-INIZCTEOSA-N	442.988	1.808	50	20	IDGD	
O=C(COC(=O)C(O)(c1ccccc1)c1ccccc1)NNC(=O)c1cccc([N+](=O)[O-])c1	9180460	XBULBYOGEDSUKO-UHFFFAOYSA-N	449.419	1.835	50	20	IDGD	
CCn1c(NNC(=O)CCNS(=O)(=O)c2ccc(C)c(C)c2)nc2ccccc2c1=O	9856880	DKZFZIJDMFOTMG-UHFFFAOYSA-N	443.529	1.845	50	20	IDGD	
O=C(COc1ccccc1-c1ccccc1)NNC(=O)Cn1c(=O)[nH]c(=O)c2ccccc21	14045129	BAHXZOYZZRUWOK-UHFFFAOYSA-N	444.447	1.583	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)c1ccc(Cl)c(Cl)c1)C(=O)NNC(=O)C1CC1	15793797	KJFVYMHULSDUET-CYBMUJFWSA-N	440.374	1.951	50	20	IDGD	
Cc1cc(=O)c(C(=O)NNC(=O)Cc2c[nH]c3ccccc23)nn1-c1ccccc1[N+](=O)[O-]	16057652	VLZVCOPONINPTD-UHFFFAOYSA-N	446.423	1.934	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)COc1cccc(N2CCCC2=O)c1	26791993	IFSGLQOXXCSYGQ-UHFFFAOYSA-N	435.484	1.952	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)CCC1CCCC1	28663124	AXSHAYGLWMVBPM-UHFFFAOYSA-N	437.562	1.758	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCN(c3cccc(Cl)c3)CC2)cc1OC	105169753	NRQYQJBPLOBLBV-UHFFFAOYSA-N	432.908	1.940	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)CN2C(=O)[C@@H](C)Oc3ccccc32)c2ccccc2c1=O	115401821	LENLZOSDQVRPJY-CQSZACIVSA-N	449.467	1.553	50	20	IDGD	
CC1CCN([C@@H](CNC(=O)NNC(=O)CNC(=O)c2ccco2)c2cccs2)CC1	726085131	XZMCGRKGGCZYGC-HNNXBMFYSA-N	433.534	1.875	50	20	IDGD	
C#Cc1cccc(NC(=S)NNC(=O)c2ccc(S(=O)(=O)N3CCOCC3)cc2)c1	727501590	ZNAWWHNZLYJKCO-UHFFFAOYSA-N	444.538	1.320	50	20	IDGD	
Cc1c(NNC(=O)NCc2ccc(S(=O)(=O)N3CCOCC3)cc2)cccc1[N+](=O)[O-]	728128105	SJGHVQHOEYMXCE-UHFFFAOYSA-N	449.489	1.750	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1cnn(-c2ccc(Cl)cc2)c1	728845865	OHJIYCORHHYYJD-UHFFFAOYSA-N	425.880	1.993	50	20	IDGD	
O=C(C[C@@H](c1ccccc1)N1CCOC1=O)NNC(=O)C1CCN(c2ncccn2)CC1	728846122	LVQIGPIGDBSXJH-SFHVURJKSA-N	438.488	1.424	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(F)c2ncccc12)C1CCN(c2ncccn2)CC1	728854547	XNJWPGMPWCODAY-UHFFFAOYSA-N	430.465	1.390	50	20	IDGD	
CC1(C)NC(=O)N(CCCC(=O)NNC(=O)c2ccc(Br)cc2Cl)C1=O	728870145	TXEQKIBTZOMBPW-UHFFFAOYSA-N	445.701	1.974	50	20	IDGD	
C[C@@H](C(=O)NNc1ccc(S(=O)(=O)C(F)F)cc1)N1C(=O)NC2(CCCC2)C1=O	728972320	RSLSYCUVBYLKLB-JTQLQIEISA-N	430.433	1.379	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CC[C@@H](NC(=O)OC(C)(C)C)C1	730262470	VANWHHDIXFMGLG-CYBMUJFWSA-N	426.901	1.709	50	20	IDGD	
CC(C)(C)NS(=O)(=O)Cc1cccc(C(=O)NNC(=O)COc2ccccc2O)c1	730779503	BQRIDWOEMINSCT-UHFFFAOYSA-N	435.502	1.450	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)N2CCC[C@H](CS(N)(=O)=O)C2)N(C)c2ccccc21	731881058	BFBOSEZUXAYQRZ-HNNXBMFYSA-N	445.545	1.184	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)N[C@H]2CCN(CC(F)(F)F)C2=O)cc1OC	732590672	VIFXNIOKNXKENC-LBPRGKRZSA-N	432.399	1.591	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)c1cccc(O)c1	732888730	DCZXWJZBHMBBPE-AWEZNQCLSA-N	432.502	1.882	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)[C@@H]2CCCN2S(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1	732959217	TXTATJSDGAKYHZ-KRWDZBQOSA-N	443.441	1.081	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)c1cccc(Oc2cnccn2)c1	736543377	ILUQFUNKYFBEBG-UHFFFAOYSA-N	426.458	1.637	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)c1ccc(Cl)c(S(=O)(=O)N(CC)CC)c1	740852421	ZWCISZGHQHSWGV-UHFFFAOYSA-N	446.957	1.436	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCCCOC[C@H]2CCOC2)cc1Br	740914676	DDIHMTAFDBOOFT-GFCCVEGCSA-N	430.299	1.845	50	20	IDGD	
CS(=O)(=O)[C@H]1CCC[C@H](NC(=O)NNC(=O)COc2ccc(Br)cc2)C1	741092220	AIQPNDUBBWWQLD-JSGCOSHPSA-N	448.339	1.514	50	20	IDGD	
Cc1nc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c2ccccn12	741171476	GNWWQCUFFFTOBX-UHFFFAOYSA-N	427.486	1.502	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)[C@@]1(C)CCCN(C(=O)c2ccccc2)C1	742077533	WOPLSNFWBHLPHZ-QFIPXVFZSA-N	447.536	1.784	50	20	IDGD	
C[C@H]1NC(C(=O)NNC(=O)NCc2cccc(C(F)(F)F)c2)=NN(c2ccccc2)C1=O	742452726	DHXYPLMZLMYXIX-GFCCVEGCSA-N	448.405	1.874	50	20	IDGD	
CC(=O)N1CCc2cc(S(=O)(=O)NNC(=O)c3cccc(Br)c3)ccc21	743264191	QOBUEBKQZHQVMK-UHFFFAOYSA-N	438.303	1.981	50	20	IDGD	
COC[C@@](C)(O)CNC(=O)/C(C#N)=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	743771293	FOYNXRPNMWQASC-VYARXKNBSA-N	445.907	1.499	50	20	IDGD	
C[C@H]1CCCC[C@]12NC(=O)N(CC(=O)NNC(=O)Nc1ccc(OC(F)F)cc1)C2=O	743832643	XQYDXBVBCFPFLG-WLRWDXFRSA-N	439.419	1.941	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)[C@H](C)N2C(=O)[C@@H]3[C@H]4CC[C@@H](O4)[C@@H]3C2=O)c1	744352059	ULEMCRIHBIDMSO-FQCQXKDLSA-N	443.500	1.196	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN(C[C@@H]2CCCO2)[C@H]2CCS(=O)(=O)C2)cc1C	744401270	CIPKPMJKPIOBMG-GJZGRUSLSA-N	443.591	1.048	50	20	IDGD	
CCC(=O)Nc1cccc(CNC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)c1	745447657	QXRIJWFSCHLCIB-UHFFFAOYSA-N	433.490	1.975	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)N[C@@H]2CCN(c3cc(C)nn3C)C2=O)cc1	745907095	YGOWEDPYQHJXFT-RHSMWYFYSA-N	444.492	1.030	50	20	IDGD	
Cc1cc([N+](=O)[O-])c(C)c(S(=O)(=O)Nc2ccccc2C(=O)NNC(=O)N(C)C)c1	746003983	XVWUYWQPEAFNAM-UHFFFAOYSA-N	435.462	1.928	50	20	IDGD	
COC(=O)c1ccsc1N1CC[C@H](NC(=O)NNC(=O)c2cc3c(s2)CCC3)C1=O	746783067	ZYQGVVUZCFXTAZ-LBPRGKRZSA-N	448.526	1.834	50	20	IDGD	
CS(=O)(=O)CC1(CC(=O)NNC(=O)COc2ccc(-c3ccc(C#N)cc3)cc2)CC1	746816989	ZVCBUSSRRWWMJR-UHFFFAOYSA-N	441.509	1.966	50	20	IDGD	
O=C(CN1C(=O)Cn2c(cc3ccccc32)C1=O)NNC(=O)c1ccc(Cl)cc1F	747429631	VWFFUHAUOGFCIF-UHFFFAOYSA-N	428.807	1.877	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2ccc(Cl)cc2F)cc(NS(C)(=O)=O)c1OC	747431456	MCZPCZQPQOSFPM-UHFFFAOYSA-N	445.856	1.943	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCCOCc2ccccc2)cc1	747588045	BPTZJSRQQFLBMV-UHFFFAOYSA-N	434.518	1.163	50	20	IDGD	
CC(C)CCn1nc(C(=O)NNS(=O)(=O)c2c[nH]c(C(=O)O)c2)c2ccccc2c1=O	748791535	WCJJBUVAYOZEQT-UHFFFAOYSA-N	447.473	1.092	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)[C@@H](Cc2c[nH]c3cc(F)ccc23)NC(C)=O)cn1	750305323	GCIPOCBSGVTKPY-QGZVFWFLSA-N	444.492	1.776	50	20	IDGD	
CN(C)C(=O)CN1C(=O)C(=NNC(=O)NC2CCCC2)c2cc(Br)ccc21	750935848	ICPYZFJOSCTSAP-UHFFFAOYSA-N	436.310	1.830	50	20	IDGD	
COc1ccc(C(=O)CNC(=O)CCC(=O)NNC(=O)Cc2c[nH]c3ccccc23)cc1	751293377	GXJNYKPHCVDERV-UHFFFAOYSA-N	436.468	1.646	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNS(=O)(=O)c1ccc(C(F)(F)F)cc1Cl	751548991	QXMBBKNEBYWIKG-UHFFFAOYSA-N	425.772	1.691	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1ncccc1OCC(F)(F)F	752504100	XNHVVCMKBAIWET-UHFFFAOYSA-N	445.423	1.699	50	20	IDGD	
Cc1cc(C(=O)O)cc(S(=O)(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1Cl	753772253	ZHYPFLAYACHHEK-ZDUSSCGKSA-N	426.834	1.496	50	20	IDGD	
Cc1cc(NC(=O)COC(=O)/C(C#N)=C\c2ccc(O)cc2)n([C@H]2CCS(=O)(=O)C2)n1	754552012	ZOBBVOQVVVHBJZ-TYWAAFNRSA-N	444.469	1.346	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)Nc1ccc(C(=O)N2CCOCC2)cc1	755932450	AALQORMQIOMXTF-UHFFFAOYSA-N	443.416	1.299	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNS(=O)(=O)c1ccc2c(c1)C(C)(C)C(=O)N2	755955560	IGZGPGCPRDANBD-UHFFFAOYSA-N	433.486	1.704	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)Nc1ccc(N2C[C@H]3CC[C@H]2C3)cc1	756163331	HAJYRTWODFZGSE-VHFSOBRXSA-N	436.468	1.601	50	20	IDGD	
CCc1c(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)cnn1CCC(C)C	756165513	XLFOLAAQKKSNCM-GOSISDBHSA-N	429.477	1.418	50	20	IDGD	
COc1ccc(C(=O)N2CCOCC2)cc1NC(=O)NNC(=O)CCc1ccccc1	756257052	LABURFNDKBWHBM-UHFFFAOYSA-N	426.473	1.953	50	20	IDGD	
CNS(=O)(=O)c1ccc(C)c(NC(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)c1	756527983	SJIGLNZNMHITTE-UHFFFAOYSA-N	434.503	1.821	50	20	IDGD	
CN(Cc1cccc(NC(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)c1)C(=O)OC(C)(C)C	756664871	QSNYSDITTUFMCK-AWEZNQCLSA-N	440.522	1.641	50	20	IDGD	
C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)NNC(=O)C(=O)Nc3ccccn3)cc2[N+](=O)[O-])C1	758820422	HTYNJQIJLBDJHN-ZIAGYGMSSA-N	440.460	1.872	50	20	IDGD	
CCCN(CC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)C[C@@H]1COc2ccccc2O1	762260724	ZMWNMXUJVYHVMI-QGZVFWFLSA-N	428.445	1.908	50	20	IDGD	
CCc1csc(-n2cc(C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)cn2)n1	762523939	QCXHVQFPRXVXLR-UHFFFAOYSA-N	426.506	1.359	50	20	IDGD	
O=C(NCCc1cccs1)NNS(=O)(=O)c1ccc(C(=O)N2CCCC2)c(F)c1	763419699	GEYFIVYYLPTVMW-UHFFFAOYSA-N	440.522	1.858	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)C(=O)Nc1cccnc1Cl	763531807	RKIHSDDIIHOMAI-UHFFFAOYSA-N	430.896	1.033	50	20	IDGD	
O=C1CSc2ccc(NC(=O)C(=O)NNC(=O)c3cc(-c4ccccc4)[nH]n3)cc2N1	763605777	XKWROCWSJMMHAA-UHFFFAOYSA-N	436.453	1.521	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)n(Cc2ccccc2)n1	763865869	SGBMGMKBQZHSHK-HNNXBMFYSA-N	439.447	1.932	50	20	IDGD	
C[C@@H](c1cccc(NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)c1)N1CCOCC1	763978884	OEHDKJMPWIAWQT-ZDUSSCGKSA-N	446.891	1.839	50	20	IDGD	
COc1ccc(CN(C)C)cc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccccc2)on1	764003823	OXIMSYIANUPWPM-UHFFFAOYSA-N	437.456	1.812	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1cnn(Cc2ccccn2)c1	764011531	HZLFVPJSDCLBRR-UHFFFAOYSA-N	428.836	1.388	50	20	IDGD	
COCCOc1ncccc1NC(=O)C(=O)NNC(=O)c1cccc(C(F)(F)F)c1	764040224	IJARDLCYBNADTC-UHFFFAOYSA-N	426.351	1.525	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccc(F)cc1OCC(F)F	764133635	XOYYJBOLGQKFGC-UHFFFAOYSA-N	425.363	1.807	50	20	IDGD	
C[C@@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)[C@@H]3Cc4ccccc4O3)cc2)C[C@@H](C)O1	764155230	WZXDRMMYRXJSBF-SXGZJXTBSA-N	438.484	1.390	50	20	IDGD	
O=C(CCC1CCCCC1)NNC(=O)C(=O)Nc1ccc(CN2C(=O)CCC2=O)cc1	764214968	IFONOSGKBJOKHZ-UHFFFAOYSA-N	428.489	1.782	50	20	IDGD	
CC(C)COc1ccccc1NC(=O)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	764265621	BXUHKMBCPLBSEN-UHFFFAOYSA-N	440.504	1.514	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)C(=O)Nc1ccnn1Cc1cccc(Cl)c1Cl	764296065	TYXSZPQMJCMBHJ-UHFFFAOYSA-N	436.259	1.669	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3OC)[nH]n2)cc1F	764378006	UXTBFYXNZALJDT-UHFFFAOYSA-N	427.392	1.633	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H](O)[C@@H](C)c2ccc(C)cc2)c1	764584903	LPBWBNNPAQERPP-OXJNMPFZSA-N	447.557	1.951	50	20	IDGD	
CC(=NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1)c1ccc(N2CCOCC2)cc1	764831958	XMPKPPPLZRMLTQ-UHFFFAOYSA-N	449.555	1.821	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)Cn3cnc4ccccc4c3=O)n[nH]2)cc1OC	765602768	YRERSDAYVBQESL-UHFFFAOYSA-N	448.439	1.265	50	20	IDGD	
CC(=NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)c1cncc(C)c1	767357326	HFBOKLLKQJSJRI-UHFFFAOYSA-N	430.530	1.884	50	20	IDGD	
O=C(O)c1cc(S(=O)(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc(Cl)c1F	767735933	NKFDJKXWSLKZPD-ZDUSSCGKSA-N	430.797	1.327	50	20	IDGD	
COC(=O)[C@H](NCC(=O)NNC(=O)c1ccc(OC)c(OC)c1)c1ccc(F)c(C)c1	767885765	UWLAPJNCDYYBQF-LJQANCHMSA-N	433.436	1.416	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)CN3C(=O)[C@@H]4[C@H]5C=C[C@@H](C5)[C@H]4C3=O)n[nH]2)c1	768264331	HPTLLTSIJYBOSB-AFHBHXEDSA-N	433.468	1.262	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)[C@@H](NC(=O)NC(C)(C)C)C(C)C)n[nH]1	768281348	JWPUWSJDLAUMKJ-KRWDZBQOSA-N	430.509	1.969	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NC2CCC(C(=O)OC(C)(C)C)CC2)c2ccccc2c1=O	770353830	VDWUXWAIUJJZLM-UHFFFAOYSA-N	443.504	1.778	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)c1cccnc1I	770466093	HYEKSZIIIUNYOX-GFCCVEGCSA-N	425.182	1.287	50	20	IDGD	
Cn1ccnc1[C@@](O)(CC(=O)NNc1nc(O)c2cnn(C(C)(C)C)c2n1)C(F)(F)F	770958048	GWLGGCWXGJGKKI-INIZCTEOSA-N	442.402	1.304	50	20	IDGD	
CCCCCCn1cc(S(=O)(=O)NNC(=O)c2c[nH]c3ccccc23)c(O)nc1=O	772568746	NTEOXAPTSHIHCJ-UHFFFAOYSA-N	433.490	1.634	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)N[C@H]1CCCO[C@@H]1CC(C)C	773133240	XAPIEFVXPBRAIB-LSDHHAIUSA-N	425.555	1.826	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNS(=O)(=O)c1ccc(OCC(=O)O)c(F)c1	773253259	YZCNGRSXPSPIJF-JTQLQIEISA-N	446.840	1.720	50	20	IDGD	
O=C(NNc1ccc(F)c(F)c1F)C(=O)Nc1cnn(Cc2nnc3n2CCCC3)c1	773489099	KPTRFMYPNSVFHM-UHFFFAOYSA-N	434.382	1.358	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COCCN1CC(F)(F)F)c1ccc(F)cc1Br	773840885	GRBRGJRYBNPGSK-NSHDSACASA-N	428.180	1.612	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)ccc1-n1cnnn1	774007519	AZEMVCPUXGYMLZ-GFCCVEGCSA-N	443.851	1.178	50	20	IDGD	
O=C(Cc1ccc2ccccc2c1)NNC(=O)Nc1ccc(C[C@@H]2NC(=O)NC2=O)cc1	775700359	DKVVYTHOSQTOIP-IBGZPJMESA-N	431.452	1.986	50	20	IDGD	
CN(NC(=O)[C@@H]1CC(=O)N(C(C)(C)C)C1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776201648	KRCBKWWWOLRMRT-CQSZACIVSA-N	425.530	1.269	50	20	IDGD	
CN(NC(=O)c1ccnc(N2CCCC2)n1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776205456	LTHTUTYLEPGILV-UHFFFAOYSA-N	433.513	1.326	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1)N[C@@H]1CCCOCC1	776632913	HIEAGCXBLMKVCK-GOSISDBHSA-N	446.529	1.678	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)c2c(C)cc(=O)n(CC(=O)NC(C)C)c2C)cc1	776849924	YGBFVTLROGXQSJ-UHFFFAOYSA-N	442.516	1.392	50	20	IDGD	
Cn1cnn(CC(=O)NNC(=O)c2cc(-c3ccc(Cl)cc3)nc3ccccc23)c1=O	778565914	ZGAYGYWDBJWUHT-UHFFFAOYSA-N	436.859	1.912	50	20	IDGD	
COC[C@H](C)n1ccc(NC(=O)C(=O)NNC(=O)c2ccc(F)cc2Br)n1	778712410	HCOJESUFMFLPKK-VIFPVBQESA-N	442.245	1.392	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCOC[C@H]2c2noc(C(C)C)n2)cc1OC	779633191	UYHGPELWUYFRKG-AWEZNQCLSA-N	433.465	1.045	50	20	IDGD	
O=C(NNc1ccccc1F)C(=O)Nc1ccc2c(ccn2CC(=O)N2CCOCC2)c1	782706911	DTCMHHRCEPNCDO-UHFFFAOYSA-N	439.447	1.721	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNc2ncnc3ccsc23)c(OC)c(OC)c1	783261771	JSVQKOMVHSQXQC-UHFFFAOYSA-N	431.430	1.577	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)Nc2ccccc2C)cc1NC(=O)CCN(C)C	783410813	KNEBSKPNBGCPGA-UHFFFAOYSA-N	440.504	1.985	50	20	IDGD	
Cc1cc(OCc2cccc(F)c2)ccc1NC(=O)C(=O)NN[C@@]1(C)CCS(=O)(=O)C1	783428775	XHZGHPXGDGDGEO-NRFANRHFSA-N	449.504	1.850	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)C(=O)Nc1ccccc1SC(F)(F)F	784004717	QGKJMJSSSGBILL-UHFFFAOYSA-N	430.364	1.407	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)C(=O)Nc1ccnn1C1CCCC1	784212640	DDKKNXJRDLAIFS-UHFFFAOYSA-N	432.506	1.521	50	20	IDGD	
O=C(NNc1cccc([N+](=O)[O-])c1)C(=O)Nc1cccc(C(=O)N2CCSCC2)c1	784828366	POLULUCLQIELKW-UHFFFAOYSA-N	429.458	1.866	50	20	IDGD	
CCN(c1ccccc1)S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2cccnn2)cc1	784858490	NYGOBCXAUFGGHF-UHFFFAOYSA-N	440.485	1.774	50	20	IDGD	
CCOc1cc(NC(=O)C(=O)NNc2c(OC)cccc2S(C)(=O)=O)ccc1OC	785330375	GKBMXWNJLDUFEN-UHFFFAOYSA-N	437.474	1.588	50	20	IDGD	
CNS(=O)(=O)c1cccc(NC(=O)[C@@H](C)NC(=O)/C(C#N)=C\c2ccc(O)cc2)c1	787330465	YYFJTLFBKOLLRI-NWFCWYBLSA-N	428.470	1.351	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)c(C)cc1C	788332313	BTUVKIPXHDLQDZ-UHFFFAOYSA-N	431.470	1.674	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cnc1Br	788431042	FRXDRBJLGARAGQ-UHFFFAOYSA-N	428.264	1.331	50	20	IDGD	
Cc1ccc(-c2nnc(S)n2CCC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1	789048746	UCOAGCSHOSACOL-UHFFFAOYSA-N	449.500	1.369	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCN(C)[C@@H](Cc2ccccc2)C1	792939689	HSBQLAKZKDWQCD-SFHVURJKSA-N	430.936	1.968	50	20	IDGD	
CN1CCCN(c2ccc(NC(=O)C(=O)NNc3ccc4c(=O)[nH]ccc4c3)cc2)CC1	793069678	HJLCSSGGBOVRTL-UHFFFAOYSA-N	434.500	1.752	50	20	IDGD	
C[C@@](O)(CN1C(=O)NC2(CCCC2)C1=O)C(=O)NNc1ccc(Cl)cc1[N+](=O)[O-]	793086748	XHFCWKPPSUZMLR-MRXNPFEDSA-N	425.829	1.307	50	20	IDGD	
COc1cccc(CCC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)c1F	794766238	FDEYPDLZTLKXDZ-UHFFFAOYSA-N	437.493	1.543	50	20	IDGD	
CCOc1cc(N2CCN(CC(=O)NNC(=O)c3ccc(C)cc3)CC2)ccc1[N+](=O)[O-]	796463941	GOFZFOUJWFGCNC-UHFFFAOYSA-N	441.488	1.885	50	20	IDGD	
COC(=O)c1cc(F)cc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2OC)c1F	796998169	GHAWAMLAGOHVEP-UHFFFAOYSA-N	441.774	1.813	50	20	IDGD	
Cc1nnc(NNC(=O)c2cc([N+](=O)[O-])cc(I)c2C)nc1O	801600032	ANIYYZWTRUAQCM-UHFFFAOYSA-N	430.162	1.464	50	20	IDGD	
O=C(Cc1nc(-c2ccccc2)cs1)NNC(=O)CN1C(=O)[C@@H]2CCCC[C@H]2C1=O	802580945	BLOJCSZRIRBCSN-HUUCEWRRSA-N	426.498	1.675	50	20	IDGD	
O=C(NNc1ccc2c(=O)[nH]ccc2c1)[C@H]1CS[C@H](Cc2ccccc2F)C(=O)N1	803428136	SGCCXYJHCUVTRR-QZTJIDSGSA-N	426.473	1.953	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NC[C@H]1CCCS(=O)(=O)C1	804880756	NDJBTSZACYNMFD-NWDGAFQWSA-N	448.339	1.372	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC2(CC1)CC(C(=O)NNc1ccc(-n3ccnc3)nn1)=NO2	804954924	KSHPPHVMAATJLO-UHFFFAOYSA-N	442.480	1.651	50	20	IDGD	
CN1CCN(C(=O)NNC(=O)[C@H]2CCCN2C(=O)c2ccc3ccccc3c2O)CC1	807379965	KSPGGDIIVCJCDP-GOSISDBHSA-N	425.489	1.138	50	20	IDGD	
COC(=O)c1c(F)ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)on2)c1C	810384407	KHBGYOHSOVXBRQ-UHFFFAOYSA-N	440.387	1.975	50	20	IDGD	
COc1cc(F)c(F)cc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)NC(C)C)cn1	810392166	PBPMZSQNUIZTMB-UHFFFAOYSA-N	443.432	1.137	50	20	IDGD	
COC[C@@]1(C(=O)NNc2cccc(S(C)(=O)=O)c2)CCN(C(=O)OC(C)(C)C)C1	810915656	RYUINCGXKJLRFZ-LJQANCHMSA-N	427.523	1.807	50	20	IDGD	
CCCCCn1nc(C(=O)NN=Cc2ccc(S(N)(=O)=O)cc2)c2ccccc2c1=O	811632755	BTVLZHOUFBHKBF-UHFFFAOYSA-N	441.513	1.998	50	20	IDGD	
CCn1nc(C(=O)NN=C2CCCc3ccc(S(N)(=O)=O)cc32)c2ccccc2c1=O	811633584	UJBRLRDGWPMZFW-UHFFFAOYSA-N	439.497	1.534	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)NN[C@@]2(C)CCS(=O)(=O)C2)CC12CCC2	813800593	VEFYXZPVHJEFPU-KDOFPFPSSA-N	430.571	1.690	50	20	IDGD	
NS(=O)(=O)c1ccc(NC(=O)NN=Cc2cc([N+](=O)[O-])ccc2OC(F)F)cc1	814964200	OPJUKPRTZSFYAQ-UHFFFAOYSA-N	429.361	1.999	50	20	IDGD	
COC(=O)C(C)(C)c1csc(NC(=O)C(=O)NNC(=O)COc2ccc(C)cc2)n1	815566469	VEMYEBQDUAPSDM-UHFFFAOYSA-N	434.474	1.067	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)C(=O)Nc2cc3n(n2)CCCC3)c1	815865648	AXWKBZIKWIVKOS-UHFFFAOYSA-N	436.266	1.850	50	20	IDGD	
CS(=O)(=O)c1ccc(-c2csc(CC(=O)NNc3nc4ccccn4n3)n2)cc1	816467980	WJFFFIHLOYDYMC-UHFFFAOYSA-N	428.499	1.942	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)N[C@@H]2CCc3c(nc(C)n3CCO)C2)c1C	819745098	QJJXVHIASCAPAX-NURJGKTBSA-N	425.533	1.829	50	20	IDGD	
CCn1c(=O)nc(O)c2c(C(=O)NNC(=O)COc3ccc(F)cc3)cc(C3CC3)nc21	914333809	UWKUKLIIJBNVSD-UHFFFAOYSA-N	441.419	1.374	50	20	IDGD	
CC(=O)Nc1ccc(CNC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)cc1	914543255	OCRNQXVXOBMJON-UHFFFAOYSA-N	432.506	1.391	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)CCCc2nc3ccccc3[nH]2)ccc1Cl	914846590	OAPIWKCYDWTCDH-UHFFFAOYSA-N	435.893	1.648	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2ccnc(OCC(F)(F)F)c2)c1	916396497	VXLMJYZAMNHFQD-UHFFFAOYSA-N	446.407	1.570	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CNC(=O)c2ccc(Br)cc2)cc1C	916562123	LHWZZACMMSIAOH-UHFFFAOYSA-N	447.289	1.582	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NCc2ccc(S(=O)(=O)N(C)C)cc2)cc1C	916646902	UWDVHFPRMSBBMS-UHFFFAOYSA-N	434.518	1.463	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2CC(=O)N(Cc3ccccc3Cl)C2)cc1	916830500	CKAQQEAHKCPILR-OAHLLOKOSA-N	428.876	1.783	50	20	IDGD	
CCCCN(C)C(=O)C1CCN(CC(=O)NNC(=O)c2ccc(OC)c(OC)c2)CC1	917159622	BGSXJMBEPPBXGJ-UHFFFAOYSA-N	434.537	1.435	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)CNC(=O)OCC(F)(F)F	917496403	GFDVCWMTZISUPP-MRVPVSSYSA-N	442.188	1.652	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)NCCS(=O)(=O)c2ccc(Cl)cc2)nc2ccccc21	919786019	ONCAGQKSPOCLCA-UHFFFAOYSA-N	449.920	1.574	50	20	IDGD	
O=C(NCC1(c2cccc(C(F)(F)F)c2)CCOCC1)NNC(=O)C(=O)NC1CC1	919917557	HVABUZGVMIQUQF-UHFFFAOYSA-N	428.411	1.363	50	20	IDGD	
COCCOc1ccc(S(=O)(=O)NNC(=O)c2nnc(-c3ccccc3)o2)cc1C	919961597	FWAUAYGBJPPIPM-UHFFFAOYSA-N	432.458	1.694	50	20	IDGD	
O=C(CC1CCN(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)CC1)NC1CCCC1	920048972	HFHWDBSLWXSKIU-UHFFFAOYSA-N	440.508	1.178	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)NCc1ccc(-n2ccnc2)c(F)c1	920239194	WFSCTOYCWHFIPA-UHFFFAOYSA-N	428.380	1.829	50	20	IDGD	
CCOc1ccc(NC(=O)CNC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])cc1	920343389	WOZHPOHQLSAUPZ-UHFFFAOYSA-N	431.405	1.341	50	20	IDGD	
COc1nc(Cl)c(C=NNC(=O)CN2c3cccc4cccc(c34)S2(=O)=O)n1C	1324254469	UDBAKZLGIBRNHS-UHFFFAOYSA-N	433.877	1.894	50	20	IDGD	
COc1ccc(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](F)Cl)C2)cc1O	1778022436	KHCRFPPWPGEYQG-IMFGXOCKSA-N	428.888	1.992	50	20	IDGD	
C=CC[C@@H](C(=C)C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)C2	1779275994	OKEJVRHIEWVDTG-YCRNBWNJSA-N	434.581	1.642	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(C(F)(F)F)nn3C)C2)C1	1779657181	KIGIEPXMCWINRT-ZBEGNZNMSA-N	438.834	1.136	50	20	IDGD	
CCc1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](F)Br)C3)n(C)n1	1779765406	KQQKGRVLNKFMIC-RVKKMQEKSA-N	445.333	1.801	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)c3cn4cccnc4n3)CCO2)C1	1781230708	YBHTZMVTWVSMPT-ZWKOTPCHSA-N	426.304	1.409	50	20	IDGD	
COc1ccc(CC(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)cc1O	1781325680	PPYPSJQIQVKKBO-SJLPKXTDSA-N	445.285	1.464	50	20	IDGD	
O=C(c1cc2cnccc2[nH]1)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781331084	CYUBMGQHQXISQT-WMLDXEAASA-N	425.258	1.697	50	20	IDGD	
C[Si](C)(C)c1cc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](F)Br)C3)C2)co1	1781331677	PCSXVKMPVQDLCA-YOEHRIQHSA-N	447.377	1.959	50	20	IDGD	
O=C(c1ccc2c[nH]nc2c1)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781332129	ZXJAPVZSMDQMIZ-RHSMWYFYSA-N	425.258	1.697	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)CC(N)=O)C2	1781897136	CVINIAUMVPRGQZ-KYZVSKTDSA-N	432.359	1.185	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H]2CC[C@H](O)CC2)C1	1782326452	NCQCTGHIUUERLY-DINLJIAVSA-N	431.371	1.835	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cnc4ccccc4n3)CCO2)C1	1783534414	JGKJJFNUWYVOER-ORAYPTAESA-N	433.306	1.857	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](C)Br)C3)C2)c1	1783538566	TZIBHVOAYUCXFD-DJJJIMSYSA-N	438.322	1.872	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(Cl)c(O)cc3O)CCO2)C1	1783880327	HCMJBAJKWCQZBI-UGSOOPFHSA-N	433.288	1.449	50	20	IDGD	
O=C(c1cc(Cl)cc2nn[nH]c12)N1CCO[C@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783948454	NBPRNIZWSGSPDP-INIZCTEOSA-N	432.695	1.859	50	20	IDGD	
Cc1nccn1CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]2C1	1783974621	SNLXMYPAMRFEOQ-TUUVXOQKSA-N	427.343	1.202	50	20	IDGD	
C[C@@H](Cc1ccccc1)C(=O)N1CC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1	1784209721	LCOJLRNFZFQNTR-FDDCHVKYSA-N	430.549	1.068	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(CO)c(F)c3)C2)C1	1785266127	KPKOVUIPQMMPPC-HNAYVOBHSA-N	443.313	1.935	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4nncn4c3)C[C@@H]21	1786406791	FDKXULLCMKATJC-KKUMJFAQSA-N	436.310	1.108	50	20	IDGD	
O=C1CSc2cc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)[C@@H](F)Cl)C[C@@H]43)ccc2N1	1787388807	XUMSTXHHLLTVEB-MYLCLEHYSA-N	441.912	1.859	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC1(c2ccc(NC(=O)c3cc(=O)cco3)cc2)CCC1	1787591531	ZIJSIIUNCCJTCU-UHFFFAOYSA-N	447.451	1.700	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCN3CCOC3=O)[C@H]2C1	1788137545	YWRVGPYNLCBRSN-NUXNZHGMSA-N	436.336	1.045	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3CCC[C@@H]3C)[C@H]2C1	1788235082	CTDYKDXVBWULSN-KJYUKMNNSA-N	443.548	1.536	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4nncn4c3)[C@H]2C1	1788375301	LCCWRLNGQIIBLQ-XMDUPGNXSA-N	440.331	1.559	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(SC)c3O)[C@H]2C1	1789247392	OVXVLKGKAVOYKD-HNKHHVNMSA-N	442.965	1.961	50	20	IDGD	
NC[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]2C1)c1ccccc1	1789923083	XVYAWOCSYSQMGQ-BQJWPVKWSA-N	442.329	1.399	50	20	IDGD	
NC(=O)[C@@H](N)CCC(=O)NC1(c2ccc(NC(=O)[C@@H](F)Br)cc2)CCC1	1790534840	UFEIHJAQJJGWCX-GXTWGEPZSA-N	429.290	1.404	50	20	IDGD	
Cc1nnc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](C)Br)[C@H]3C2)s1	1791057913	KTGVFQPRVHHHAM-BQUFFADESA-N	431.356	1.152	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)c1ccc(OCC2CC2)cc1	1792036443	QVLRVXPQXJMJDY-FFGOWVMKSA-N	436.936	1.668	50	20	IDGD	
CCOC(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)CBr)OCC	1792872177	PNHLYJMJIMFHHO-ZJOBFFGXSA-N	435.359	1.396	50	20	IDGD	
C[C@@H](CBr)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)COC(=O)C(F)(F)F)C2	1792987555	UMSUEEQDVBOTSS-MMWGEVLESA-N	429.233	1.761	50	20	IDGD	
CN1CCN(c2ccc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)[C@H](O)CCl)cc2)CC1	1793105488	AMNJOEYDKNTXCJ-GSEOLPGOSA-N	434.968	1.290	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccn(C(C)(C)C)n1	1794416737	QPZGOHFWFUWEDT-AYDFFVQHSA-N	441.370	1.872	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1nc(OC)ccc1[N+](=O)[O-]	1797214123	DXYAJRPCTHGFJB-RNJOBUHISA-N	426.857	1.504	50	20	IDGD	
CO[C@@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnccc1C(=O)NN)c1ccccc1	1798439194	NPEXFEQPHHUFHV-AXVVYFOYSA-N	437.500	1.325	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cn3ccccc3n1)C2	1799275014	GSNOYNMOWAZFLC-AODNKKSCSA-N	425.316	1.774	50	20	IDGD	
COc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Br)ccc1O	1799348634	NPAYMWWQEZHERT-JLUCKKNBSA-N	431.258	1.295	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c[nH]c3cnccc13)C2)[C@H](F)Br	1799349994	PCESDMXIQWCWMT-OWLDWWDNSA-N	425.258	1.457	50	20	IDGD	
CC[C@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H]1CN(C(=O)OC(C)(C)C)C[C@H]1O)C2	1800073581	SYZKQXMNYUXXLK-FHULIHMCSA-N	443.972	1.870	50	20	IDGD	
Cc1ccc(=O)n(C(C)(C)C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](F)Br)n1	1800158289	IENRUDJCPRATSA-XFMPKHEZSA-N	443.317	1.616	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cn1nccn1)[C@@H](Br)Cc1ccccc1	1800248459	IBAWORKLIIYIRF-MHORFTMASA-N	446.349	1.923	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)Cc1ccc(F)cc1	1800373031	YWRVCDCIUDVCGX-XYYYAOKXSA-N	426.916	1.848	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)NC(=O)OC(C)(C)C	1800590907	SRFFCQUBPVSKPN-AIUMHDJVSA-N	448.358	1.499	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CNc3ccccc31)C2	1800639871	PNEQQFWWCPSVMI-XIZOUUALSA-N	436.350	1.959	50	20	IDGD	
Cc1nc2ccc(F)cn2c1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCC(=O)NN(C)C)C2	1800967961	XQUWJZWNKFQAKS-BJWYYQGGSA-N	444.511	1.407	50	20	IDGD	
COC[C@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(OC)c(O)cc1[N+](=O)[O-])C2	1802279051	KNMRHHYEUTWVER-OPDFLTKYSA-N	441.868	1.815	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc3c[nH]nc3c2)[C@H]1c1cccnc1)[C@@H](O)CCl	1803139711	UFJCQQQMZAIWJV-WDSOQIARSA-N	427.892	1.877	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)COC(C)(C)C)[C@@H]1c1cccnc1	1804085326	SRQKPHHSCLTFMV-UWJYYQICSA-N	433.553	1.276	50	20	IDGD	
O=C(CCBr)NC[C@H]1CCN(C(=O)CN2CCOCC2)[C@H]1c1cccnc1	1806340848	OMIGTWUYOSHHDS-APWZRJJASA-N	439.354	1.205	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H](CNC(=O)Cn2ccccc2=O)[C@H]1c1cccnc1	1807440839	RPJCWLVQBLDIKJ-XMSQKQJNSA-N	442.592	1.801	50	20	IDGD	
CCC1(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)CCC1	1809644607	GSAVHRMPRKOBAB-FPOVZHCZSA-N	435.333	1.661	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)c1cc2n(n1)CCCC2	1809861463	RWCQIZYACFKCHR-IPELMVKDSA-N	431.924	1.534	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)c3ccc([N+](=O)[O-])o3)CC2)C1	1809968442	YHXAODLRRHKQJT-UHFFFAOYSA-N	441.249	1.026	50	20	IDGD	
CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CCC2(CCCN(C(=O)[C@H](F)Cl)C2)CC1	1810910557	YCRALBGVCKWKGK-CVEARBPZSA-N	427.908	1.223	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)COCCOC)sc2C1	1814312584	SAVWSDIVYBSGNL-MNOVXSKESA-N	434.356	1.892	50	20	IDGD	
COC(=O)[C@H]1CC[C@H](C(=O)N2CCCC[C@@H]2c2cc(NC(=O)[C@@H](O)CCl)n[nH]2)CC1	1814866986	BQKPKRBYLBLMFQ-XOUADPBQSA-N	440.928	1.981	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1)c1ccc(-n2cnnc2)cc1	1817204029	PHKJKKHIXANGMS-DLBZAZTESA-N	443.895	1.896	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)Cc2cscn2)n[nH]1	1817549873	QUYBZEZRLHSRJF-HNNXBMFYSA-N	433.538	1.474	50	20	IDGD	
CC[S@](=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](C)Br)CC2	1819519667	KRLYTSCLIQWFEZ-IGSRQBSMSA-N	436.397	1.997	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)[C@H](O)N3CCOCC3)sc2C1	1819878003	YMJAOOQVLDEGFA-PRXAMGSTSA-N	430.958	1.113	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)cn1C	1822413757	AJCYZKFHRZGNQR-QGZVFWFLSA-N	429.525	1.736	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(O)nc(O)n1)CC2	1825641501	OSHZNBJZULSIFK-RNFRBKRXSA-N	442.295	1.354	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCS(C)(=O)=O)CC2	1825646658	BGMPIPCDSMCSLC-BDAKNGLRSA-N	438.369	1.273	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)CN3CCCCC3=O)sc2C1	1825867741	JEUVLGFJVCCRSP-VXGBXAGGSA-N	428.942	1.321	50	20	IDGD	
N#Cc1ccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)cc1	1827052576	PLHNUJLIPDSWHU-HSZRJFAPSA-N	445.328	1.785	50	20	IDGD	
CN(C)C(=O)NCC(=O)N1CCC([C@@H]2CCCCN2C(=O)CO[Si](C)(C)C)CC1	1829099109	BXNJPQHRXHORLZ-KRWDZBQOSA-N	426.634	1.729	50	20	IDGD	
COc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)nc1	1830362431	WXYHEDULJJDFPM-HXUWFJFHSA-N	425.913	1.425	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)c(C)n1C	1830364320	FUQBPBHPGHRRGK-OAQYLSRUSA-N	425.957	1.977	50	20	IDGD	
C[C@H](Sc1ccccc1)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1	1831149790	IIVUTGBCHWKCFB-VPWXQRGCSA-N	442.965	1.223	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)C3=CCCS3)CCO2)C1	1831559404	YGRDLVLVEJRZTN-GUYCJALGSA-N	433.368	1.637	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cn3nc(C)cc3C)C2)C1	1831640598	NZGCTGVTCBUVTP-FXAWDEMLSA-N	426.945	1.364	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCn3nc(C)cc3C)C2)C1	1831656675	HEPRIYPNBIURRH-WIYYLYMNSA-N	440.972	1.754	50	20	IDGD	
Cc1onc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)c1C	1831984296	HGRFJSIZJIMPTF-YVEFUNNKSA-N	430.299	1.145	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1)[C@@H](O)c1ccco1	1833086618	MAQKQJOHLAFLEP-SFHVURJKSA-N	442.354	1.670	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)[C@H]3CCCCN3C)CC2)CC1	1833319157	RLLVBDIIIQFMOZ-MAUKXSAKSA-N	443.430	1.826	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@@](C)(O)C(F)(F)F)CC2)CC1	1833644170	MDVRDWYLLACKNC-WMLDXEAASA-N	427.895	1.889	50	20	IDGD	
COc1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)n1	1833762664	VQMRPKWGXBZXRE-FQEVSTJZSA-N	425.913	1.425	50	20	IDGD	
Cc1cncc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)c1	1834287445	HDRXGFMSIGVGED-KBXCAEBGSA-N	426.311	1.243	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCN3CCCCC3)CCO2)C1	1835128840	ONUFFDTZJGSDEY-WIYYLYMNSA-N	429.989	1.726	50	20	IDGD	
NC[C@@H](C(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1)c1ccccc1	1836716821	SDEORZQUISNMJN-WOJBJXKFSA-N	437.968	1.327	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3n[nH]c4c(F)cccc34)CCO2)C1	1837058912	PIQUXIHNHFAPDQ-XOBRGWDASA-N	438.887	1.789	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)CCCc3ccncc3)C2)C1	1837709963	BPMWWZXFNMPVPU-JOCHJYFZSA-N	449.624	1.712	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC(OC2CCN(C(=O)c3cc[n+]([O-])cc3)CC2)CC1	1838429784	OOTGNJPWVBIIGP-UHFFFAOYSA-N	435.597	1.784	50	20	IDGD	
CCc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)n[nH]1	1839152426	YYDPQYXQHBNKEY-MSOLQXFVSA-N	433.336	1.278	50	20	IDGD	
C[C@H](C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2)n1cccn1	1839155532	WKADZXCXJNWPOC-JLSDUUJJSA-N	433.336	1.137	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)cn1	1839197975	OEPYNZWVZFKRHV-YOEHRIQHSA-N	430.274	1.151	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)C34CC(F)(C3)C4)C2)C1	1839962484	HFZDZEWFSXCAQV-RXOFBLNVSA-N	433.318	1.509	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CC3CCOCC3)C2)C1	1839963562	OHFCKWRIPJBNGC-VQIMIIECSA-N	447.370	1.433	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)c(F)c1	1840034652	SBFBHUIOHNCCDF-IFXJQAMLSA-N	443.313	1.988	50	20	IDGD	
Cc1ccc(C(=O)C(=O)N2CCO[C@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)cc1	1840099197	VCPDUQBIOZTPIN-QFIPXVFZSA-N	448.592	1.486	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(Cl)s3)C2)C1	1840149795	AFNOVRCZHBCMMQ-PXAZEXFGSA-N	437.345	1.725	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc4cnccc34)C2)C1	1840153185	GXTDSENFVCXVEO-DENIHFKCSA-N	447.919	1.559	50	20	IDGD	
C=CCC(=O)N1CCO[C@]2(COCCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1	1840175380	NDEOCCVYNUGFSL-IHSQGBLNSA-N	431.439	1.904	50	20	IDGD	
Cc1nc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)c(C)s1	1840186840	WKSMFBZHMVQPEJ-QGZVFWFLSA-N	436.361	1.563	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)C(Cl)Cl)CCO2)C1	1840189864	QANOULNYBWITPI-IINYFYTJSA-N	432.142	1.420	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)C2CCN(C)CC2)C1	1841097001	GYKWQCOBAZSVDF-UHFFFAOYSA-N	444.488	1.679	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@](C)(C(=O)N2CC3(CCCN3C(=O)[C@@H](O)CCl)C2)C1	1841354509	FELDAEKBOJAJFP-YWZLYKJASA-N	443.972	1.827	50	20	IDGD	
CC(=O)C[C@H](C)C(=O)N1CC2(CCCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C1	1841925339	MQUINDWXYREPRT-ZFWWWQNUSA-N	429.945	1.937	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1cccc(C(F)(F)F)n1)C2	1844264651	UMOSWJOKXRLURC-UHFFFAOYSA-N	448.405	1.230	50	20	IDGD	
Cc1ccc(S(=O)(=O)CC(=O)N2CC3(CCCN3C(=O)[C@@H](F)Br)C2)cc1	1845216796	LERAJKCIOGQGKF-OAHLLOKOSA-N	447.326	1.663	50	20	IDGD	
CC(C)[C@@H](C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl)N1Cc2ccccc2C1=O	1847557428	YLZIZJCCTMQFDV-VJANTYMQSA-N	433.936	1.469	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H]1CCC[C@@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](O)CCl)C1	1847567744	CPGBZFRFPANBAM-XAJHFOFHSA-N	443.972	1.871	50	20	IDGD	
CC(=O)C(C)(C)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CN(C)NC(=O)NCc1ccccc1	1847718583	KJFJZSKCKWIYQX-OALUTQOASA-N	443.548	1.150	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1ccc(-n2c(O)nnc2O)cc1	1847870875	YRSYGBNWJPCADJ-JYJNAYRXSA-N	433.896	1.901	50	20	IDGD	
CC[C@H](C)[C@H](N)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1848099161	HIZAMBVBRRYDBL-QXKUPLGCSA-N	430.977	1.694	50	20	IDGD	
O=C(COc1cccc(N2CCCC2=O)c1)NNC(=O)c1nn(-c2ccccc2)cc1O	10159795	LTVPIRDBZAENGI-UHFFFAOYSA-N	435.440	1.545	50	20	IDGD	
CSc1ncc(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)n1-c1ccc(F)cc1	27093967	XOAQQYLKVUNMED-UHFFFAOYSA-N	438.448	1.784	50	20	IDGD	
C=CCNS(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(-c3ccccc3)on2)c1	28792837	BOGHUEGKUNFPGT-UHFFFAOYSA-N	426.454	1.881	50	20	IDGD	
COC(=O)c1c(CC(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)[nH]c(C(C)=O)c1C	726281194	FJSHPZMAQATIMQ-UHFFFAOYSA-N	428.445	1.258	50	20	IDGD	
C[C@@H](NC(=O)NNc1ccc(-n2cccn2)nn1)c1cccc(S(=O)(=O)N(C)C)c1	727609135	HKWSZXJGIQUNAA-CYBMUJFWSA-N	430.494	1.300	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN1C(=O)OCC(F)(F)F)c1cc(Br)c[nH]1	727799878	JCEMWHUXFYXLKE-SECBINFHSA-N	427.177	1.702	50	20	IDGD	
CCOc1ccc(NC(=S)NNC(=O)CS(=O)(=O)NC2CCC(C)CC2)cc1	728064352	DJBYYEGKAKWPBO-UHFFFAOYSA-N	428.580	1.901	50	20	IDGD	
Cn1cc(NS(=O)(=O)c2ccsc2C(=O)NNc2nc(-c3cccnc3)no2)cn1	728075328	WPXXYXJIVAITIV-UHFFFAOYSA-N	446.474	1.484	50	20	IDGD	
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC[C@H](C(=O)NN=c2sc3ccccc3n2C)C1	728202856	BQBZECRGAMLFOF-AWEZNQCLSA-N	448.574	1.613	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)N[C@@H]2COc3c(cccc3OC)C2)nc1	728398423	DOHAGYFZJZSZHS-HNNXBMFYSA-N	449.533	1.751	50	20	IDGD	
C#CCNC(=O)CN1CCN(C(=O)/C(C#N)=C\c2cc(C)n(C[C@H]3CCCO3)c2C)CC1	728533499	KVXKYEVAGIVWRK-ZPWPBLDLSA-N	437.544	1.085	50	20	IDGD	
COc1cccc(/C=C(/C#N)C(=O)O[C@@H](C)C(=O)Nc2cccc(S(N)(=O)=O)c2)c1	729272096	RHYNJQGQAROXTM-GRRFOWRYSA-N	429.454	1.820	50	20	IDGD	
Cc1nc2[nH]n(C)c(=O)c2c(C)c1CCC(=O)NNC(=O)c1cc(Br)c[nH]1	729282355	SPUUZOZGCUSIKM-UHFFFAOYSA-N	435.282	1.363	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2cc(OC)c(OC)c(C(=O)O)c2)c(OC)c1	729963741	QSDZBNRBNHBMCO-UHFFFAOYSA-N	440.430	1.043	50	20	IDGD	
COc1cc(C=NNC(=O)c2nn(-c3ccccc3)cc2O)cc(OC)c1OCC(N)=O	730551714	UIUJIXIGDUNACT-UHFFFAOYSA-N	439.428	1.223	50	20	IDGD	
COc1ccc(N2CCN(CCCNC(=O)NNC(=O)c3ccccc3OC)CC2)cc1	731499927	RAXYHLIQNADETB-UHFFFAOYSA-N	441.532	1.860	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)c2ccc(CNC(=O)c3cccs3)cc2)C[C@@H](C)O1	732264534	VBFDOSORWVANQW-HZPDHXFCSA-N	444.557	1.938	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)N[C@H]1CCN(c2ccccc2Cl)C1=O	732469163	AVXUURQZPXCEPV-AWEZNQCLSA-N	440.847	1.738	50	20	IDGD	
CN(c1ccc(CNC(=O)NNC(=O)Cc2nc3ccccc3n2C)cc1)S(C)(=O)=O	732475800	NUKDEXNTXKIRPD-UHFFFAOYSA-N	444.517	1.042	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)Nc1cccc(CN2C(=O)CNC2=O)c1	733333243	WZZAGTDDSVOYIK-UHFFFAOYSA-N	433.428	1.391	50	20	IDGD	
CC[C@H](C#N)Oc1cccc(CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)c1	733800117	QNMNYTYLDFAHNT-OAHLLOKOSA-N	444.517	1.805	50	20	IDGD	
CCOc1ccc(N2C[C@H](C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)CC2=O)cc1	734241042	AHZKXTBGJZJHBX-CQSZACIVSA-N	449.508	1.293	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)C1CCN(c2cnccn2)CC1	734252015	YRPQBULEHPOTFL-UHFFFAOYSA-N	432.550	1.913	50	20	IDGD	
Cn1nc(Br)c2c(=O)n(CC(=O)NNc3cc(F)c(F)cc3F)cnc21	734551879	DXTHZMCIOCYUBN-UHFFFAOYSA-N	431.172	1.453	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)NCCNc1nccc(C(F)(F)F)n1	738449957	HQUBLEJVCKCFLF-UHFFFAOYSA-N	428.371	1.325	50	20	IDGD	
CC(=NNC(=O)COc1ccc(C)cc1)c1cccc(S(=O)(=O)N2CCOCC2)c1	739399239	BLCKALHNSDOLIV-UHFFFAOYSA-N	431.514	1.935	50	20	IDGD	
COCCOC[C@H]1CCN(C(=O)NNC(=O)[C@@H](C)Oc2cccc(Br)c2)C1	743522133	VVLMCDUKLGOLOY-KGLIPLIRSA-N	444.326	1.942	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)CN2CCN(C(=O)Cc3c[nH]c4ccccc34)CC2)cc1	744386295	AIFLUNMWIURODD-UHFFFAOYSA-N	444.495	1.187	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)N[C@H]1CC(=O)N(CCOc2ccccc2)C1	745847548	OWJGRYHXUMVZFF-CVEARBPZSA-N	444.463	1.603	50	20	IDGD	
COc1ccc(S(=O)(=O)Nc2ccccc2C(=O)NNC(=O)N2CCOCC2)cc1	745992259	XSBHDAAAOFOAQF-UHFFFAOYSA-N	434.474	1.183	50	20	IDGD	
CCOC(=O)C1=NN(c2ccccc2)[C@@H](C(=O)NNC(=O)Cc2cn3ccccc3n2)C1	746556321	SXKXFYIILBFMPP-GOSISDBHSA-N	434.456	1.222	50	20	IDGD	
O=C(NCCOc1ncccc1C(F)(F)F)NNC(=O)c1ccc2c(c1)OCCO2	746794696	GHRAVXPUOADKPQ-UHFFFAOYSA-N	426.351	1.895	50	20	IDGD	
CC[C@](C)(CNC(=O)OC(C)(C)C)C(=O)NNC(=O)c1csc(N2CCOCC2)n1	747727719	OLTWYBASQVDEIX-LJQANCHMSA-N	441.554	1.682	50	20	IDGD	
O=C(CCN1C(=O)CCC1=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1	747786575	AQLJWWWCZOXGRX-HXUWFJFHSA-N	434.496	1.300	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)N2CCN(CCS(N)(=O)=O)CC2)c(C)n1CCC(C)C	748372747	SNGSSFLPRYOZMY-XSFVSMFZSA-N	435.594	1.491	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3ccccc3-n3ccnn3)n[nH]2)cc1OC	752693399	NIOXXLDNXAAIOJ-UHFFFAOYSA-N	433.428	1.749	50	20	IDGD	
O=C(NNC(=O)N1CC(=O)N(CC(F)(F)F)C1)c1ccc(COc2ccccc2)o1	753033500	QTIFLVKTKNPZFR-UHFFFAOYSA-N	426.351	1.877	50	20	IDGD	
C[C@@]1(NNC(=O)N[C@@H]2CC(=O)N(c3cccc(C(F)(F)F)c3)C2)CCS(=O)(=O)C1	753035442	WORMUMUQLPKBKH-MLGOLLRUSA-N	434.440	1.192	50	20	IDGD	
CC[C@H](NC(=O)NNC(=O)COc1ccccc1-c1ccccc1)C(=O)N1CCOCC1	753057061	KVAGHINZLQRXTP-IBGZPJMESA-N	440.500	1.700	50	20	IDGD	
CCOC(=O)c1ccc(N2CC(NC(=O)NNC(=O)COc3ccc(C)cc3)C2)nc1	753278116	AVVIHTCWBGHXPW-UHFFFAOYSA-N	427.461	1.165	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN[C@H](C)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)n1	754319500	QRAOIRGOIIRWRE-HUUCEWRRSA-N	439.582	1.767	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@@H]2[C@@H]3CCO[C@@H]3C23CCCC3)c2ccccc2c1=O	755076943	DIJKBTXJUMVAQX-JQHSSLGASA-N	425.489	1.708	50	20	IDGD	
CN1C(=O)C[C@H](NC(=O)NNC(=O)C(=O)Nc2ccccn2)[C@@H]1c1ccc(Cl)c(F)c1	755087290	KTSZIZBIBHNIFR-BBRMVZONSA-N	448.842	1.115	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)Nc2ccc(S(=O)(=O)N3C[C@@H](C)C[C@@H](C)C3)cc2)n[nH]1	755419437	DMOKAJZJQTWRNC-BETUJISGSA-N	434.522	1.851	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)c2ccc(Cl)cc2F)n([C@H]2CCS(=O)(=O)C2)n1	755532959	MXMBAHLSZKVDOX-NSHDSACASA-N	429.861	1.810	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)Nc2ccc(CC(=O)N3CCOCC3)cc2)c1	755862839	VSTXVSHDWUNGGQ-UHFFFAOYSA-N	425.489	1.620	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)Nc1cccc(N2CCCS2(=O)=O)c1	755886395	VRGQDOIRTSVMRQ-UHFFFAOYSA-N	429.458	1.330	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)Nc1ccc(OC(F)F)cc1OC(F)F	755916769	RZDYGSQYKYWGPV-SSDOTTSWSA-N	429.348	1.477	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)Nc2cc(N3CCCS3(=O)=O)ccc2F)c1	756154266	FGTDGKISKZPCJU-UHFFFAOYSA-N	436.465	1.906	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)Nc1cccc(OCCS(C)(=O)=O)c1	756298522	XXWGUAYIMVTVGP-ZDUSSCGKSA-N	439.465	1.869	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)Nc2ccc(C[C@H]3CC(=O)NC3=O)cc2)cc1	756815540	MLFVPCCNCFYMCS-AWEZNQCLSA-N	426.429	1.132	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)c2cccc(OC)c2O)ccc1S(=O)(=O)N(C)C	757775075	DDYKCANKJJVUTP-UHFFFAOYSA-N	438.462	1.126	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)COc2ccc(F)cc2)ccc1S(=O)(=O)N(C)C	757776548	RDLOSBDAXMTAEQ-UHFFFAOYSA-N	440.453	1.316	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)c1ccc(Oc2cccc(Cl)c2Cl)nn1	758047948	ZSOQHJFWYUQQOR-MRVPVSSYSA-N	448.288	1.274	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H](C#N)[C@@H](NC(=O)NNC(=O)COc2ccccc2C#N)C1	758775075	VRVIURCPHLDQJA-GJZGRUSLSA-N	428.449	1.027	50	20	IDGD	
CCNS(=O)(=O)c1ccc(CC(=O)NNC(=S)NCCc2cccs2)cc1	759357607	UXQAMIFNKHPQKY-UHFFFAOYSA-N	426.589	1.327	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCNC(=O)[C@@H]1c1ccccc1C	759920391	DJQADYOCPURSBP-IBGZPJMESA-N	430.892	1.591	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	760439385	DZKYEHJYUQNGGE-INIZCTEOSA-N	434.493	1.850	50	20	IDGD	
Cc1nn(CC(F)F)c(C)c1C(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	760827626	ZZTQHIOGAWUCSO-UHFFFAOYSA-N	425.348	1.291	50	20	IDGD	
COCCSc1ccc([N+](=O)[O-])cc1C(=O)NNC(=O)[C@H]1COc2ccccc2O1	763334546	IURHNXLHTWGFAQ-MRXNPFEDSA-N	433.442	1.934	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)cc1Br	763549240	VJHFBOPUMLTEKT-UHFFFAOYSA-N	436.218	1.586	50	20	IDGD	
COC(=O)NCc1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)cc1	763605355	RKYRHUVRQZIGQI-UHFFFAOYSA-N	436.428	1.332	50	20	IDGD	
Cc1ccn(C)c(=O)c1NC(=O)C(=O)NNC(=O)COc1ccccc1-c1ccccc1	763642307	WGUXCORPSAVDHQ-UHFFFAOYSA-N	434.452	1.526	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2cccc(Cn3cccnc3=O)c2)c1	763648014	SDMYDVXGXSDAHJ-UHFFFAOYSA-N	449.467	1.073	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(CN3CCCCC3)c2)cc1	763675273	UMFZAFJVUUVQCA-UHFFFAOYSA-N	435.484	1.709	50	20	IDGD	
C[C@@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)COc3ccccc3F)cc2)C[C@@H](C)O1	763679873	PTAPOEZHTBHLOI-HUUCEWRRSA-N	444.463	1.604	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccc([S@](=O)C(F)(F)F)cc2)c1	763760254	JEYWEFYVXBUEIL-PMERELPUSA-N	442.419	1.780	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccnn1Cc1ccccc1	763864571	KTSYOUJFGBPQLW-CQSZACIVSA-N	425.420	1.624	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(CC(N)=O)cc1	763875768	ANJAUITXAZJXKJ-ZDUSSCGKSA-N	446.891	1.538	50	20	IDGD	
CCOC(=O)c1cnn2c(C(=O)NNC(=O)c3cc(-c4ccc(C)cc4)[nH]n3)ccnc12	763885188	QESYKBQSNHZNHM-UHFFFAOYSA-N	433.428	1.679	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cc(CC(C)C)nn2C)ccc1OC(C)C	763916760	VWTJYCFIXZYFQB-UHFFFAOYSA-N	431.493	1.814	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)C(=O)Nc1cc(C(F)(F)F)ccc1F	763917504	VKOUAYXHADBKID-UHFFFAOYSA-N	437.313	1.220	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)C(=O)Nc1cc(F)ccc1OC[C@H]1CCCO1	763919800	VTZMTHPGHSIOIN-MRXNPFEDSA-N	433.411	1.851	50	20	IDGD	
COC(=O)[C@@H](C)Cc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccccc2OC)cc1	764136513	RLTYLVVPBJSQRT-AWEZNQCLSA-N	427.457	1.375	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1cccc(NC(=O)C(=O)NNC(=O)CCc2ccccc2)c1	764187798	IOCFOSHYOLRGNN-UHFFFAOYSA-N	446.529	1.482	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cccc(OC(F)F)c2)ccc1F	764251253	SVQCWQRFWRWSPH-UHFFFAOYSA-N	425.319	1.613	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)C(=O)Nc1cc(Cl)ccc1OC[C@H]1CCCO1	764268339	ICHPNWLTHITFFM-OAHLLOKOSA-N	432.864	1.621	50	20	IDGD	
CC(C)OC(=O)c1c(NC(=O)C(=O)NNC(=O)Cc2cc[nH]n2)sc2c1CC[C@H](C)C2	764293515	QCFZMQJTXHEOJR-NSHDSACASA-N	447.517	1.490	50	20	IDGD	
CCCNS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@@H](CC)c2ccccc2)cc1	764329833	OUISOGOMKNLBES-SFHVURJKSA-N	446.529	1.655	50	20	IDGD	
CCOC(=O)C(C)(C)n1cc(NC(=O)C(=O)NNC(=O)[C@@H](CC)c2ccccc2)cn1	764332431	TZDBKENAVKWJJD-INIZCTEOSA-N	429.477	1.461	50	20	IDGD	
CCN(Cc1ccccc1NC(=O)C(=O)NNC(=O)c1cnn(C)c1)C(=O)OC(C)(C)C	764360044	RZLAJLVZGQZGIZ-UHFFFAOYSA-N	444.492	1.577	50	20	IDGD	
CC(C)n1ncc2cc(NC(=O)C(=O)NNC(=O)c3cc(-c4cccs4)[nH]n3)cnc21	764378254	WZVOCNASQQEJFO-UHFFFAOYSA-N	438.473	1.864	50	20	IDGD	
CCOC(=O)c1c(C)csc1NC(=O)C(=O)NNC(=O)CSc1ccccc1O	764403796	BLJHMDDMOKKILP-UHFFFAOYSA-N	437.499	1.817	50	20	IDGD	
Cn1ccnc1C(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2F)cc1	764412610	KGQBRZWBNBLUEG-UHFFFAOYSA-N	443.822	1.843	50	20	IDGD	
Cn1nnc2cc(C=NNC(=O)CN3CCN(Cc4ccccc4Cl)CC3)ccc21	764838191	BTJZIABKWMENRB-UHFFFAOYSA-N	425.924	1.890	50	20	IDGD	
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)NNC(=O)c1csc(N2CCOCC2)n1	765197791	XWGHSAFNOIBCSF-WBVHZDCISA-N	444.561	1.444	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)CN1C(=O)Cn2c(cc3ccccc32)C1=O	765252600	OQZSFGOOLUCDLN-UHFFFAOYSA-N	438.465	1.269	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN(C(=O)c2ccncc2)C1)c1cc(-c2ccc(F)cc2)[nH]n1	765621553	VAHGGWUZKIPHRB-MRXNPFEDSA-N	436.447	1.924	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2ccoc2)c(I)c1	765698338	OWOXHRFTMONSSL-UHFFFAOYSA-N	429.170	1.293	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)Cn1cnc2ccccc21	766663619	KPFNHNFVRSFJBK-UHFFFAOYSA-N	440.935	1.655	50	20	IDGD	
C[C@H](NC(=O)NNc1ccccc1S(C)(=O)=O)c1ccc(S(=O)(=O)N(C)C)cc1	766880264	KZURJHAWZJKSMB-ZDUSSCGKSA-N	440.547	1.728	50	20	IDGD	
C=CCOc1cc(OC)ccc1C(=O)NNC(=O)c1sc(N2CCOCC2)nc1C	766967411	LVUPGRMWVQHJQP-UHFFFAOYSA-N	432.502	1.936	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)COC2CN(C(=O)OC(C)(C)C)C2)n[nH]1	768281319	INROPGUFKAKQPO-UHFFFAOYSA-N	445.476	1.482	50	20	IDGD	
COCCN1C(=O)c2ccc(C(=O)NNc3cc(C#N)cc(Cl)n3)cc2S1(=O)=O	768694884	KLOIYAJAXNTRQB-UHFFFAOYSA-N	435.849	1.154	50	20	IDGD	
CN(CCN(C)C(=O)OC(C)(C)C)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	768724423	ADDGWVGOKZSQRP-UHFFFAOYSA-N	435.529	1.233	50	20	IDGD	
CC[C@H](NC(=O)NNc1nc(O)c2cnn(C)c2n1)c1ccccc1OCC(=O)N(C)C	770351676	SWYGZVCKRWXWRF-AWEZNQCLSA-N	442.480	1.313	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)C1(c2cccc(F)c2)CCOCC1	772897003	FCBDPUMPFZYPOI-UHFFFAOYSA-N	433.867	1.991	50	20	IDGD	
Cc1nc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)ccc1Br	773542327	WWIGLLWPBCVHSW-UHFFFAOYSA-N	427.642	1.911	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)[C@@H](C)Nc1nc(C)cs1	775909331	OKRYRSYVBWBFCP-SNVBAGLBSA-N	426.882	1.918	50	20	IDGD	
O=C(NNc1ccc(F)cc1Br)N[C@@H]1CCO[C@@]2(CCS(=O)(=O)C2)C1	776077446	SOURRTOUYOILPJ-ABAIWWIYSA-N	436.303	1.951	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1c[nH]c2c(F)cc(F)cc2c1=O	776320202	LVKDUBISJQWMAA-UHFFFAOYSA-N	449.439	1.483	50	20	IDGD	
CC1CCC2(CC1)OC[C@H](CNC(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)O2	776948680	GJQCLOSEOVVCOB-CHWWFWEZSA-N	428.530	1.944	50	20	IDGD	
CSc1cccc(C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)c1[N+](=O)[O-]	777088979	GHBGAQVSIXBHKB-UHFFFAOYSA-N	437.503	1.993	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])c1	778743353	QIAJXCXZFCKGAN-UHFFFAOYSA-N	440.865	1.838	50	20	IDGD	
COc1ccc2ccccc2c1-c1cc(CNC(=O)NNC(=O)C(=O)N2CCCC2)on1	779406188	VDVHODHOWZLOQI-UHFFFAOYSA-N	437.456	1.956	50	20	IDGD	
CCC[C@H]1C[C@@H](C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)CCO1	779713074	KCKUHDUUKFPCAF-IRXDYDNUSA-N	439.534	1.064	50	20	IDGD	
CCn1c(=O)c(C(=O)/C(C#N)=C/c2ccc(OC)nc2)c(N)n(Cc2ccccc2)c1=O	780148368	QBLHYBFXCVRASY-GZTJUZNOSA-N	431.452	1.854	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)NCc1ccc2c(c1)CN(C(=O)OC(C)(C)C)C2	780773896	HEPJFBYDJFWMHR-AWEZNQCLSA-N	436.509	1.819	50	20	IDGD	
CCOc1cc(F)ccc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)NC(C)C)cn1	783263936	MUBMXXQVAQZKPG-UHFFFAOYSA-N	439.469	1.388	50	20	IDGD	
Cc1cc(C)c(NNC(=O)C(=O)Nc2cnn(CC(=O)N3C[C@@H](C)O[C@H](C)C3)c2)c(C)c1	783367242	WIFDVABLVMWUCC-IAGOWNOFSA-N	442.520	1.526	50	20	IDGD	
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)NNC(=O)c1cc2c(s1)CCC2	783806001	LLZIBMWNVNWVFT-UHFFFAOYSA-N	425.444	1.555	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)C(=O)Nc1ccc2c(c1)OCCCO2	784210354	PJCKIKAGGROBJH-UHFFFAOYSA-N	446.485	1.370	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCCCCC2)cc1NC(=O)C(=O)NNc1ccccn1	784798077	LVJLZHMPBUAGSA-UHFFFAOYSA-N	447.517	1.737	50	20	IDGD	
CCN1CCN(C(=O)Cc2ccc(NC(=O)C(=O)NNc3cccnc3Cl)cc2)CC1	784841931	BHFJOBXIAUKEBV-UHFFFAOYSA-N	444.923	1.523	50	20	IDGD	
COc1cccc(NNC(=O)C(=O)Nc2ccc(S(=O)(=O)N3CCC(C)CC3)cc2)n1	784847344	BZLHFHIIGHIOPO-UHFFFAOYSA-N	447.517	1.593	50	20	IDGD	
COc1ccc(C(=O)N2CCOCC2)cc1NC(=O)C(=O)NNc1cc(Cl)ccn1	784862213	YWEHRGKDTQJVKL-UHFFFAOYSA-N	433.852	1.298	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNc2ncc(F)cn2)sc2c1CCCS2	784958431	ZGWCPWMKHMANQP-UHFFFAOYSA-N	425.467	1.974	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)[C@H]2[C@H]3CC[C@@H](O3)[C@@H]2C(F)(F)F)cc1OC	785803804	NCTCHXPOPSTSPW-MPTQWLOMSA-N	446.378	1.364	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2nc(Br)ccc2C)c2ccccc2c1=O	786686890	COUXSIRHHCGMMJ-UHFFFAOYSA-N	430.262	1.957	50	20	IDGD	
COc1ccc(OC)c([C@@H]2C[C@H]2C(=O)NNC(=O)c2csc(N3CCOCC3)n2)c1	788092798	RYDDFEWFASYKPC-DZGCQCFKSA-N	432.502	1.562	50	20	IDGD	
Cc1cc(S(=O)(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)cnc1Cl	788914924	HQRNTDIOOQQHRE-UHFFFAOYSA-N	447.945	1.841	50	20	IDGD	
CCCc1csc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3OC)[nH]n2)n1	789740270	UADXTSYQPVWAHJ-UHFFFAOYSA-N	428.474	1.894	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(-c3cccc(C#N)c3)no2)c1	789869180	LZBVIOJGXUZCTF-UHFFFAOYSA-N	439.453	1.538	50	20	IDGD	
COc1cc(C)nc(NNC(=O)NCc2ccc(N3C(=O)N[C@](C)(C4CC4)C3=O)cc2)n1	790899301	PLSOEXXBZTYWOQ-OAQYLSRUSA-N	439.476	1.845	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(CCC(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)CC1	792014185	HBORRPDPYVYFHO-UHFFFAOYSA-N	442.520	1.781	50	20	IDGD	
CCc1c(C(=O)NNC(=O)CNC(=O)c2cccnc2)cnn1-c1ccccc1Cl	792393038	IOGWGNYXSBJMOC-UHFFFAOYSA-N	426.864	1.674	50	20	IDGD	
COc1ccc(OC)c(C2=NO[C@H](C(=O)NNC(=O)CCNC(=O)OC(C)(C)C)C2)c1	792659183	ZOZKLEZIKKFRAT-INIZCTEOSA-N	436.465	1.259	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C2=NN(c3ccc(F)cc3)C(=O)CC2=O)cc1	792797322	ANGBWUROWRAUNJ-UHFFFAOYSA-N	426.404	1.276	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)[C@@H]1[C@H]2[C@H]3C[C@@H]4[C@@H]5[C@H]3[C@H]1[C@@H]5C[C@H]42	793591961	NYGXRDJTPGVMEZ-YNSBBLKHSA-N	429.542	1.545	50	20	IDGD	
COCC1(C(=O)NNC(=O)Cc2cn3ccccc3n2)CCN(C(=O)OC(C)(C)C)CC1	793599783	OVIMLXXRCSDDGO-UHFFFAOYSA-N	445.520	1.688	50	20	IDGD	
Cc1cc(O[C@H]2CCN(C)C2=O)ccc1NC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	799239514	ZAWWNLPYNSHDKB-KRWDZBQOSA-N	427.417	1.979	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1cc(Cl)c(Cl)cc1F	799261709	AVAFPXUYNBNYHN-UHFFFAOYSA-N	433.248	1.710	50	20	IDGD	
CCN1CCN(c2ccc(C(=O)NNC(=O)C(=O)Nc3ccc(C)cc3)cc2F)CC1	801106185	SAIMVUJEHWQUOD-UHFFFAOYSA-N	427.480	1.676	50	20	IDGD	
COCC1(C(=O)NNC(=O)C(=O)Nc2ccc(C)cc2)CCN(C(=O)OC(C)(C)C)CC1	801110785	GYPCIIWFLWUAIR-UHFFFAOYSA-N	448.520	1.745	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@](C)(O)CCc3ccccc3)CC2)cc1	801172622	VNXWVCIKHUXFKX-RUZDIDTESA-N	438.572	1.644	50	20	IDGD	
Cc1nnnn1[C@H](Cc1cccc(F)c1)C(=O)NNC(=O)Nc1ccc2c(c1)OCO2	802096902	AOCOUSCHIWHVLY-OAHLLOKOSA-N	427.396	1.486	50	20	IDGD	
Cc1ccc(C2=NO[C@H](CNC(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)C2)cc1C	802382206	VTUDLWYNUDKLHY-INIZCTEOSA-N	448.483	1.688	50	20	IDGD	
COC(=O)c1c(F)cc(NC(=O)C(=O)NNC(=O)c2cc(OC)cc(OC)c2)cc1F	802566240	FOTAENNBMFTUGS-UHFFFAOYSA-N	437.355	1.168	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccc(Br)c3cccnc23)n1	802566522	TZRLPWYGDPCADP-UHFFFAOYSA-N	445.277	1.597	50	20	IDGD	
CC(C)(C)C[C@H](CC(=O)NNC(=O)c1ccccn1)C(=O)NNC(=O)c1ccccn1	809538900	VRIRBRMTQAUTIS-AWEZNQCLSA-N	426.477	1.141	50	20	IDGD	
NC(=O)c1ccc(NC(=O)NNC(=O)c2nnc(O)c3ccccc23)c(OCC(F)F)c1	810307323	XTDLQAQBTCQPEX-UHFFFAOYSA-N	446.370	1.545	50	20	IDGD	
CCOc1cc(Br)c(F)cc1NC(=O)C(=O)NNc1nccn(C)c1=O	810399810	ZDBKLIOBBCDTDT-UHFFFAOYSA-N	428.218	1.162	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)NC[C@H]1CCCCN(Cc2ccccc2)C1	811872897	YLPHIUQJSVRIJD-GOSISDBHSA-N	427.505	1.642	50	20	IDGD	
Cc1cc(NC(=O)NNc2ccccc2S(=O)(=O)N(C)C)n(C2CCN(C)CC2)n1	814658334	BHZVSOGKIRMQRC-UHFFFAOYSA-N	435.554	1.857	50	20	IDGD	
COC(=O)N1CCN(c2ccc(NC(=O)C(=O)NNc3ccccc3Cl)cn2)CC1	815557975	MBUBJSJSTPOYDS-UHFFFAOYSA-N	432.868	1.705	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)CNc2cccc(OC)c2)c1	825786233	MBBMKQVIYKSCSP-UHFFFAOYSA-N	434.518	1.599	50	20	IDGD	
Cc1ccc([C@@]2(C)NC(=O)N(CC(=O)NNC(=O)COc3cc(C)cc(C)c3)C2=O)cc1	863997218	VTBKHICLAVTHII-HSZRJFAPSA-N	438.484	1.605	50	20	IDGD	
Cc1cc(C(=O)N([C@@H]2CCS(=O)(=O)C2)N(C)C)c2cnn(Cc3cccs3)c2n1	886575831	MGVWDVWQVHWKNH-CQSZACIVSA-N	433.559	1.955	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)N[C@H](CN1CCOCC1)c1ccccc1	916213613	FINAOSFJURSTKR-OXJNMPFZSA-N	430.480	1.997	50	20	IDGD	
CCC(CC)[C@H](CNC(=O)NNC(=O)c1nnc(O)c2ccccc12)N1CCOCC1	916256121	NGZVIUYGEOQBQB-KRWDZBQOSA-N	430.509	1.416	50	20	IDGD	
CCOc1ccc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)c3cc(C)[nH]n3)cc2)cc1	917393266	ILGPGVPWVUYDPW-UHFFFAOYSA-N	443.485	1.992	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2ccc(Br)s2)ccc1O	917727507	IYZWWQCKVJILBW-UHFFFAOYSA-N	435.277	1.626	50	20	IDGD	
O=C(NCc1ccn(-c2ccccc2)n1)NNC(=O)c1csc(N2CCOCC2)n1	918779146	CEYFFBRBIKMOTN-UHFFFAOYSA-N	427.490	1.310	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@H]2CCCN2C(=O)Cc2ccccc2)cc(OC)c1OC	920216655	MXUWNNIEKSUNTL-QGZVFWFLSA-N	441.484	1.707	50	20	IDGD	
C[C@@H]1CN(Cc2cccc(CNC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)c2)CCO1	920238401	WQTIZDCKZFJHJH-OAHLLOKOSA-N	427.461	1.960	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)Nc3cccc(CN4C(=O)CNC4=O)c3)n[nH]2)cc1	920936118	IDKYRJASUXWGGD-UHFFFAOYSA-N	447.455	1.903	50	20	IDGD	
CCCNC(=O)NNC(=O)C1CCN(S(=O)(=O)c2ccc(C(=O)OCC)cc2)CC1	921042232	HQKUZQUJEOZCSV-UHFFFAOYSA-N	440.522	1.004	50	20	IDGD	
CC(C)NC(=S)NNC(=O)CSc1nnc(-c2cccnc2)n1Cc1ccco1	1116834451	MAFVIKDJUNUTCR-UHFFFAOYSA-N	431.547	1.977	50	20	IDGD	
CN1CCN(Cc2cccc(CNC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)c2)CC1	1322425117	IVGZUBUHAUAXJC-UHFFFAOYSA-N	426.477	1.486	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCC[C@@H]2CNc2cccc(C)n2)cc1OC	1324450440	JXXOZSYJGUFATB-QGZVFWFLSA-N	427.505	1.745	50	20	IDGD	
CNS(=O)(=O)c1ccc(CC(=O)NNC(=O)Nc2cc(OC)ccc2Cl)cc1	1327172944	SZZLCBAULXRRAD-UHFFFAOYSA-N	426.882	1.652	50	20	IDGD	
CC(C)n1cnc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](F)Br)C3)n1	1778280186	YPPAHNUZSWKREO-IIYDPXPESA-N	446.321	1.677	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4c(c3)NC(=O)CO4)C2)C1	1778570585	CVDCGDFBYJCLJT-BTYIYWSLSA-N	435.908	1.869	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4nncn4c3)C2)C1	1778593202	FVNGDJFIAQSQJJ-UGSOOPFHSA-N	436.310	1.204	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3cccn4cncc34)C2)C1	1778680648	JENAACOLDXXAIN-LIRRHRJNSA-N	435.322	1.809	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](C)N3C[C@H]4C[C@H]4C3)C2)C1	1778853226	HQHHRCHTNNLQBC-LCEIHVTHSA-N	428.371	1.188	50	20	IDGD	
CC(=O)N[C@H](C(=O)N1CCO[C@]2(CCN(C(=O)CO[Si](C)(C)C)C2)C1)C(C)(C)C	1779293952	HWWUOSCIOGUYSS-XLIONFOSSA-N	427.618	1.219	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccnnc1O)C2)[C@H](F)Br	1780774047	UXIRESJXQOBCRI-BFQNTYOBSA-N	431.262	1.000	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3c(-c4ccncn4)noc3C)CCO2)C1	1781221090	JKWLGHHDDVWPIE-VBKZILBWSA-N	433.896	1.901	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)CCNC(=O)c3ccc[nH]3)CCO2)C1	1781223650	AKZMFHFXDCOBPI-OALUTQOASA-N	445.347	1.201	50	20	IDGD	
CC(=O)Nc1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@](C)(Cl)CCl)C3)C2)ccn1	1781229756	LODFRTGAEOLOLV-MOPGFXCFSA-N	443.331	1.720	50	20	IDGD	
O=C(c1ccc2cncn2c1)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781331648	OISFOBIECVNCEN-WMLDXEAASA-N	425.258	1.468	50	20	IDGD	
O=C(c1cccc2ccnn12)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1782228478	AESPQZWNNOCHRJ-RHSMWYFYSA-N	425.258	1.468	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)COc2cccnn2)C1	1782518809	RJHZXQORGSIZBI-OXQOHEQNSA-N	436.585	1.221	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccn4c(C)cc(C)nc34)C2)C1	1782578215	KDJVRPGZCUFHLU-UWJYYQICSA-N	434.924	1.648	50	20	IDGD	
C[C@H](O)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](Br)Cc3ccccc3)C2)C1	1783023268	VXIRPFZGRXHSJN-GMBSWORKSA-N	425.323	1.203	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cc(O)nc(O)c3)CCO2)C1	1783343521	VBOPSTWKFDAGDL-YVEFUNNKSA-N	428.283	1.110	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H]1CCc3nc[nH]c3C1)CCO2	1783355005	GVZQWZIHUIPECZ-NJSLBKSFSA-N	439.354	1.518	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H]3C[C@@]34C(=O)Nc3ccccc34)C2)C1	1783496618	XNYYESGUNWTTNM-AERDPVEMSA-N	431.920	1.744	50	20	IDGD	
Cc1nc[nH]c1CSCC(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](C)Br)C2)C1	1783533578	AMHCDJYUHCNSLN-PXAZEXFGSA-N	445.383	1.565	50	20	IDGD	
O=C1COc2ccc(C(=O)N3CCO[C@@]4(CCN(C(=O)C(Cl)Cl)C4)C3)cc2N1	1783946804	TUELTSANEQFXLI-GOSISDBHSA-N	428.272	1.265	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccccc3N3CCCCC3)C[C@@H]21)[C@H](O)CCl	1784093033	ZVBHTBRQWFJIHZ-YRLHULLVSA-N	449.979	1.870	50	20	IDGD	
COC(=O)c1ccc(CC(=O)N2CC[C@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)cc1	1784157263	YFBCMTBYPMWRTD-JOCHJYFZSA-N	448.592	1.697	50	20	IDGD	
C#CCCCCC(=O)N1CC[C@@]2(C1)CN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)CCO2	1784199667	OWYIVOMGTDAOPO-PCCDRTMGSA-N	427.505	1.144	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CC[C@H](C(=O)OC)C3)C[C@@H]21	1784615594	SMDZQPYZXCNJAQ-QQCJEOGWSA-N	428.957	1.963	50	20	IDGD	
Cc1nnc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCBr)[C@H]3C2)s1	1786406073	PWCHSSZRHQFZGW-AVGNSLFASA-N	431.356	1.154	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3F)[C@H]2C1	1787192618	CPCJIHPSVGXOQL-DSPQJCBJSA-N	428.302	1.845	50	20	IDGD	
CS(=O)(=O)c1ccc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]3C2)cc1	1787445994	YSJUFQQUYVFCNI-MBGYTDRXSA-N	446.928	1.147	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(Br)cn3)C[C@@H]21)[C@H](F)Cl	1787446453	KNFLSGLQOZOYJS-RETIQXCHSA-N	434.693	1.972	50	20	IDGD	
NC(=O)[C@H](N)CCC(=O)Nc1ccc(C2(NC(=O)CCBr)CCC2)cc1	1788052196	DUEQWKJIDVNGTB-CQSZACIVSA-N	425.327	1.498	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H](C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Cl)C[C@@H]32)C1	1788179948	JUQRQOQRTJQTQQ-OLMNGRFOSA-N	447.935	1.758	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1(c2ccc(NC(=O)c3nc[nH]n3)cc2)CCC1	1788370625	LWVBLRIVOOHPRN-UVHMKAGCSA-N	434.460	1.686	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(F)c3[N+](=O)[O-])[C@H]2C1	1790136909	SBZRNRZYRAAIFI-PCBIJLKTSA-N	443.859	1.581	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(Cl)c(O)cc3O)C[C@@H]21	1791257182	SEGMQGAOMMSOSC-DBDKUZAISA-N	447.315	1.598	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1ccc(C2(NC(=O)c3cc(=O)cco3)CCC2)cc1	1791599704	RCKHZYVFVVLHSR-UHFFFAOYSA-N	426.473	1.761	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1ccc(C2(NC(=O)CCc3ncc[nH]3)CCC2)cc1	1791603067	GZHHKEAVHWDEOY-UHFFFAOYSA-N	426.521	1.849	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(=O)C[C@H]1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](F)Cl)C2	1793251416	XDVBQSZAVPFBKP-XXUMUBMXSA-N	431.892	1.738	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1sc3nccnc3c1N)C2	1793446882	QFXHLVQGHVEBBY-OPDFLTKYSA-N	437.953	1.884	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2)[C@H]1COc2ccccc2O1	1793840564	OARHIPSKGLYMIE-ZDFLXESQSA-N	439.306	1.201	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cn1nc(C)cc1C	1794398713	XVOYEXDNSZLREI-DPEPCVEMSA-N	439.520	1.272	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1Cc3ccccc3CN1)C2	1795112351	ARCFEINZPZVYFK-ZMMAXQRCSA-N	436.350	1.076	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccnc2ccccc12	1797283027	ZNWYBJWDRMXKNG-MUJYYYPQSA-N	444.495	1.799	50	20	IDGD	
COc1ncccc1CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@](C)(Cl)CCl	1799273806	JDWXDZHFAQHGAF-DOHHPOSVSA-N	444.359	1.849	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1snnc1C1CC1)C2)[C@H](F)Br	1799347809	TUYBLPATENCLRK-WJZNIJOASA-N	433.303	1.309	50	20	IDGD	
COc1ccc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Br)cc1	1799347941	VDLHXPOZWBEAOJ-DACLVMHWSA-N	443.313	1.908	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1cn2c(nc1=O)SCC2	1799838979	JHCAEQDKARFXMU-FZKCQIBNSA-N	438.981	1.937	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)c1cccc(Br)c1)[C@@H](O)CCl	1799870230	GLBYJAVTKLCEJI-QRJUGERDSA-N	445.741	1.720	50	20	IDGD	
Cc1cccn2ncc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@H](C)Br)C4)c12	1800107816	DFHGALFQNQGQGF-AYDFFVQHSA-N	435.322	1.629	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CCc3nc[nH]c3C1)C2	1800644444	UIUDTNHZBIJLMP-LHLGERLTSA-N	439.354	1.278	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1CN(C(=O)OCc2ccccc2)C1)[C@H](O)CCl	1801579798	LELTWLSENDWUGB-FCGDIQPGSA-N	449.935	1.493	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(OC(C)C)c(C#N)c1	1801850672	SVGKVONJEDKGIM-DMUMMCEESA-N	449.935	1.802	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2cc3n(n2)CCNC3=O)[C@@H]1c1cccnc1	1806084768	QTAALIHTOPDQPY-VKJFTORMSA-N	444.923	1.359	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCCC2(CCN(C(=O)c3cc4n(n3)CCNC4=O)CC2)C1	1806156314	QBIILQXZUYHNOS-HNNXBMFYSA-N	435.956	1.879	50	20	IDGD	
Cc1nc(CC(=O)N2CC[C@H](CNC(=O)CCBr)[C@@H]2c2cccnc2)no1	1806342187	KKOVTGZQHLMMRN-KDOFPFPSSA-N	436.310	1.807	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC2(CCCN(C(=O)c3cccc(=O)n3O)C2)CC1	1807550927	IGEUAZWBXKKNJM-AWEZNQCLSA-N	440.338	1.961	50	20	IDGD	
CN(C)C(=O)NCC(=O)N1CC[C@H](CNC(=O)[C@H](F)Br)[C@@H]1c1cccnc1	1808649262	LYLTWHMPHZLFSH-SNPRPXQTSA-N	444.305	1.049	50	20	IDGD	
Cn1cc(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)c(C(F)F)n1	1808841004	CJYCIQTYOYAANO-DUVNUKRYSA-N	441.866	1.672	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2ccncc2F)[C@@H]1c1cccnc1	1808887107	UMMOXWPIUCJTNW-KKSFZXQISA-N	442.495	1.308	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)c1cc2n(n1)CCCC2	1809861470	RWCQIZYACFKCHR-SNRMKQJTSA-N	431.924	1.534	50	20	IDGD	
Cc1ccc(F)c(C(=O)N2CCC3(CCCN(C(=O)c4cccc(B(O)O)c4)C3)CC2)c1	1809980152	KRLOKZSTNQDAKW-UHFFFAOYSA-N	438.308	1.973	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)[C@H]2CCCCO2)[C@@H]1c1cccnc1	1813068365	LKJZZHRVWHEURJ-WAOWUJCRSA-N	431.537	1.030	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)[C@@H]2C[C@]2(F)Cl)[C@@H]1c1cccnc1	1813159611	NPKNGEAEPJEQPE-HCCHORAYSA-N	439.919	1.385	50	20	IDGD	
COC(OC)C(=O)N1CCCC[C@H]1c1cc(NC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)n[nH]1	1818110378	CZLMFSMVMLEVIE-GIEPYWIESA-N	445.480	1.155	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3c(C)nc4ncccn34)sc2C1	1818395838	MGBDMGKMYYZTDL-NWDGAFQWSA-N	448.936	1.974	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)CCl)CC2)c1ccc2c(c1)CNC2=O	1819362760	FWWZHVAWRPKKQQ-RISCZKNCSA-N	434.905	1.212	50	20	IDGD	
Cc1ccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)cc1O	1821032704	CDFLYTZZCHPCOO-IBGZPJMESA-N	448.288	1.723	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](C)O)CC2	1821305034	YZMBRFRORRIXKW-KOLCDFICSA-N	448.457	1.583	50	20	IDGD	
C[C@H](Br)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CN2CCCC2=O)[nH]n1	1822184213	QEQDQPHQVYYXOQ-WCQYABFASA-N	426.315	1.808	50	20	IDGD	
Cc1[nH]nc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)c1F	1822412893	JGPPIDBPCYXTTH-ZDUSSCGKSA-N	434.476	1.259	50	20	IDGD	
CCc1[nH]nc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)c1F	1822413409	USJGBOKBYWYJAC-CQSZACIVSA-N	448.503	1.513	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCC([C@H]2CCCCN2C(=O)C[C@H]2NC(=O)NC2=O)CC1	1825076520	ORWPULTXRBRPMU-LPMFXHHGSA-N	447.363	1.441	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(OC)n(C)n1)CC2	1826002692	AZVYPESTERTNEE-NXEZZACHSA-N	427.914	1.365	50	20	IDGD	
CC(C)O[C@@H](C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827057596	KQADPMAUJJAVFH-UWJYYQICSA-N	430.354	1.413	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccnc3Cl)CCO2)C1	1829500722	GAROCVRXUZWMNP-KDOFPFPSSA-N	432.304	1.059	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccnc3Cl)CCO2)C1	1829501735	QWDRRRVEGJZACQ-SJKOYZFVSA-N	446.729	1.588	50	20	IDGD	
COc1ccccc1OCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1830230397	CAYUNUGAECPOJW-HKUYNNGSSA-N	430.860	1.065	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)COC3CCCCC3)CCO2)C1	1830383745	HRPZQZILYFYCNQ-BEFAXECRSA-N	447.370	1.576	50	20	IDGD	
CN1CCCC[C@@H]1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1	1830760772	OTYCXUOYVHFNDX-MNEFBYGVSA-N	436.380	1.163	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3[nH]nc4ncccc34)C2)C1	1831646970	PFWFKOAANCVVOY-MGPUTAFESA-N	435.912	1.435	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CN2C(=O)C=CC2=O)CC1	1831987485	HYDXAEDZFDDFJG-ZFWWWQNUSA-N	440.338	1.315	50	20	IDGD	
N#CC1(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CCC1	1832785917	LYOOMGLCGZGEMO-IBGZPJMESA-N	438.532	1.612	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3ccc(C)s3)CCO2)C1	1832888014	FMUSIXWBUHDNTQ-YLJYHZDGSA-N	444.981	1.699	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3ccco3)CCO2)C1	1833044672	RGQQMEGNLNINPI-BEFAXECRSA-N	443.338	1.700	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)c3ccco3)CC2)CC1	1833089623	JPEKCHBVKCHSTL-GUYCJALGSA-N	442.354	1.668	50	20	IDGD	
CC(C)(CCl)C(=O)NC1CCN(C2CCN(C(=O)C(=O)Nc3cccnc3)CC2)CC1	1833214601	HHWQKCPVFGWHQD-UHFFFAOYSA-N	449.983	1.857	50	20	IDGD	
Cc1cncc(CCC(=O)N2CCC(N3CCC(NC(=O)[C@H](O)CCl)CC3)CC2)c1	1833308303	QOCHXPOJZNRXAY-HXUWFJFHSA-N	436.984	1.494	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cncc(N(C)C)c3)CCO2)C1	1833358783	UXTFNJAVEWKXAW-RXVVDRJESA-N	438.956	1.625	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(C)c(C)n3)CCO2)C1	1833694943	FDPMNXAHABQHPX-UZLBHIALSA-N	425.913	1.022	50	20	IDGD	
Cc1cncc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)c1	1834285124	IRIHOYRKTYMOBP-OALUTQOASA-N	430.332	1.696	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3cc(O)n[nH]3)CC2)CC1	1834772433	CKTCJAVFBHWYQM-LLVKDONJSA-N	428.331	1.084	50	20	IDGD	
Cc1ccccc1C(=O)N1CCC(N2CCC(NC(=O)c3cccc(B(O)O)c3)CC2)CC1	1834801348	ZTZOKFDNLHEKNB-UHFFFAOYSA-N	449.360	1.174	50	20	IDGD	
O=C(CCN1CCCCC1)N1CCOC[C@]2(C1)CN(C(=O)CCBr)CCO2	1834822164	BNJZBJGNYZNXDG-IBGZPJMESA-N	446.386	1.104	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3ccc4nn[nH]c4c3)CC2)CC1	1836500568	BQDBPNSNSHVZDK-QGZVFWFLSA-N	448.955	1.397	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc4nncn4c3)CCO2)C1	1837011650	SJARDWXVNNFOAR-OXQOHEQNSA-N	435.912	1.207	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)/C=N/N3CCCCC3)CCO2)C1	1837440705	UXTVZYHCKIAZPJ-FXDLTUPKSA-N	428.961	1.322	50	20	IDGD	
CCOC(=O)/C=C/C(=O)N1CCC(OC2CCN(C(=O)[C@H](F)Br)CC2)CC1	1837638562	GFTIXZKIKGRBIP-IDOMTICXSA-N	449.317	1.795	50	20	IDGD	
Cc1ccncc1CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)CO[Si](C)(C)C)CCO2	1837710023	CPKMKDMGIRFMNM-JOCHJYFZSA-N	449.624	1.631	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3cccnc3)C2)C1	1837711401	GNHJLELNRAADJI-OAQYLSRUSA-N	435.597	1.322	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)Cc3cnn(C)c3)CC2)CC1	1838787570	YZDYGJSJMQZDPG-GOSISDBHSA-N	426.945	1.215	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(F)ccc3F)CCO2)C1	1838860404	FVYXNRYDIUNBBH-KPZWWZAWSA-N	447.276	1.818	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCCC(=O)OC(C)(C)C)C2)C1	1839141493	JXCZQAKVUMRPNB-KKSFZXQISA-N	446.972	1.972	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CC34CCCN3CCC4)C2)C1	1839147554	VBMIHNMIYYBEPW-DYESRHJHSA-N	427.973	1.479	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)C[C@H]3CCCCO3)C2)C1	1839150189	FGZOJCTUIMEQHK-MNEFBYGVSA-N	437.364	1.638	50	20	IDGD	
CC(C)=NO[C@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)CBr)C2)C1	1839222543	QVTOSTHPWZCBLU-HDMKZQKVSA-N	448.358	1.275	50	20	IDGD	
O=C(c1cnc2ccc(F)cn12)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1839591585	JIUFCHIMRBBMOS-YJBOKZPZSA-N	428.823	1.078	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnc4ccc(F)cn34)CCO2)C1	1839592544	MHIBAJHAYPGYFB-FOIQADDNSA-N	438.887	1.561	50	20	IDGD	
Cc1ccc(F)cc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)Br)CCO2	1840030658	RSZGTWPMYHSBMF-IFXJQAMLSA-N	443.313	1.988	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)/C=C/c3ccco3)C2)C1	1840031083	FKDROXHNDKJTTL-CRPWZZHVSA-N	427.295	1.533	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(F)c(C)cc3F)C2)C1	1840155937	GLXAECBYNPHVPS-YWZLYKJASA-N	446.878	1.597	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C[C@H](C)c3ccccc3)C2)C1	1840156553	VBTLIPYQGAQNJN-LQBOVUBWSA-N	438.952	1.890	50	20	IDGD	
CN(C)c1cccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)c1	1840188961	OCZPWACGJAIPPD-IBGZPJMESA-N	430.332	1.626	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(C)c(F)c3F)CCO2)C1	1840702169	IXMWNPCAOVRHOB-FOIQADDNSA-N	446.878	1.597	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(F)cc(Cl)c3)CCO2)C1	1840711004	BYLFLKBLRZJQHW-VQIMIIECSA-N	449.306	1.803	50	20	IDGD	
C[C@@H](C(=O)N1CCCC12CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)C1(O)CCC1	1841045503	OFAOODUQQRCZSE-GJZGRUSLSA-N	443.972	1.873	50	20	IDGD	
CN(CC(=O)N1CC2(CCCN2C(=O)C(C)(C)CCl)C1)NC(=O)NCc1ccccc1	1841226980	PVTAYAGRENXAGO-UHFFFAOYSA-N	449.983	1.801	50	20	IDGD	
O=C([C@@H](O)CCl)N1CC2(CCCN2C(=O)c2cc(Br)ncc2Cl)C1	1842129748	PHBULYDYTBMNAJ-NSHDSACASA-N	437.121	1.914	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC2(CCCN2C(=O)c2ccc(S(C)(=O)=O)cn2)C1	1842255521	JKOPCAUVSOQVHC-MRXNPFEDSA-N	434.345	1.538	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)c2cccc(-c3ccccc3)n2)C1	1843479272	WJZKMYXIOVRZEI-UHFFFAOYSA-N	441.296	1.559	50	20	IDGD	
Cc1cc2nnc(C(=O)N3CCCC34CN(C(=O)[C@@H](F)Br)C4)c(C)n2n1	1843698239	TXMFZWGSFNGVTR-CYBMUJFWSA-N	425.262	1.249	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@]2(C(=O)N3CCCC34CN(C(=O)[C@H](F)Cl)C4)C[C@H]1CO2	1845078167	FKURXEDAGOHKEF-JMERFSKESA-N	431.892	1.503	50	20	IDGD	
COc1cc(F)cc(/C=C/C(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)c1	1846261563	QREBOPLWQKYZPK-VOTSOKGWSA-N	438.264	1.045	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c2cnn(C(C)C)c2n1	11544087	AVPNZFUVTSQGSF-UHFFFAOYSA-N	444.517	1.646	50	20	IDGD	
O=C(CN1CCC(C(=O)Nc2ccccc2)CC1)NNC(=O)c1cccc([N+](=O)[O-])c1	15550757	VQSLQLAQBBFORT-UHFFFAOYSA-N	425.445	1.707	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2ccc3c(c2)OCO3)cc1S(=O)(=O)NC(C)(C)C	15793547	SFNWMIVPOWQISG-UHFFFAOYSA-N	449.485	1.576	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)c1cccc(S(=O)(=O)N2CCCCC2)c1	15795325	SNGUKRAHWWQEAN-IBGZPJMESA-N	445.497	1.462	50	20	IDGD	
CCc1cccc(C)c1NC(=S)NNC(=O)CCn1c(=O)[nH]c(=O)c2ccccc21	26959724	QFAYCIUKYGLKOK-UHFFFAOYSA-N	425.514	1.969	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2csc(-c3cnn(C)c3)n2)c2ccccc2c1=O	107909431	FPBSSRPVSVFDCK-UHFFFAOYSA-N	437.485	1.738	50	20	IDGD	
O=C(COC(=O)[C@@H]1CCCN(C(=O)c2ccc3n[nH]cc3c2)C1)NNC(=O)c1ccccc1	726202316	MLHJGQFQGSIKLE-QGZVFWFLSA-N	449.467	1.420	50	20	IDGD	
Cc1noc(CCCNC(=O)NNC(=O)[C@@H](C)Oc2cccc(Br)c2)n1	727473271	JIMMMSDRPMPMQW-SNVBAGLBSA-N	426.271	1.871	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)CCNS(=O)(=O)c2cccc([N+](=O)[O-])c2)c(C)c1	728205064	JCIXFYJXTAAIFA-UHFFFAOYSA-N	449.489	1.140	50	20	IDGD	
COc1cccc(N2CC[C@@H](NC(=O)NNC(=O)C(=O)Nc3ccc(C)c(C)c3)C2)c1	728221338	RLPGGCPATYAQST-QGZVFWFLSA-N	425.489	1.860	50	20	IDGD	
O=C(COC(=O)c1cc(F)c(F)cc1[N+](=O)[O-])NNC(=O)[C@H]1COc2ccccc2O1	728344893	SFIPQCCZEPYWOI-OAHLLOKOSA-N	437.311	1.017	50	20	IDGD	
O=C(NCc1cc(F)ccc1F)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	729622038	LVSDPUJMXOUVOE-UHFFFAOYSA-N	438.456	1.894	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)[C@@H](NC(=O)NCc2ccccc2)C(C)C)cn1	729691937	GADGUOSKDNMRRW-KRWDZBQOSA-N	430.534	1.932	50	20	IDGD	
CNS(=O)(=O)c1cccc([C@H](C)NC(=O)NNC(=O)c2cccc3ncccc23)c1	730128743	ZYWCCLCQJHKTFA-ZDUSSCGKSA-N	427.486	1.848	50	20	IDGD	
C[C@H]1CCCN(S(=O)(=O)c2cc(C(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)n(C)c2)C1	730205030	ALOWUXPOOXUSSY-ZDUSSCGKSA-N	449.489	1.429	50	20	IDGD	
Cc1cccc(N2C(=O)N[C@@H](CCC(=O)NNC(=O)c3cc(Br)c[nH]3)C2=O)c1	730770190	YMFGAVCSXZPXRR-ZDUSSCGKSA-N	448.277	1.752	50	20	IDGD	
O=C(NNC(=O)C1CCC1)c1ccc(Br)c(S(=O)(=O)N2CCOCC2)c1	732140994	DCZKIYBXINWOFI-UHFFFAOYSA-N	446.323	1.031	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)c1cccc(CN2CCS(=O)(=O)CC2)c1	732304546	OFHZEMHBXOWMQM-UHFFFAOYSA-N	437.543	1.077	50	20	IDGD	
O=C(NCCNC(=O)c1c(F)cccc1F)NNC(=O)c1cccc(OC(F)F)c1	732995412	LTKNTQOJGFABOU-UHFFFAOYSA-N	428.342	1.940	50	20	IDGD	
COc1ccc(CN2CC[C@H](NC(=O)NNC(=O)c3cccc(N(C)C)c3)C2=O)cc1	734545079	VXAIWSZOCMZMSH-IBGZPJMESA-N	425.489	1.506	50	20	IDGD	
COc1ccccc1[C@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)CNC(=O)c1ccco1	734813728	GCWMOBWXWJKNOX-KRWDZBQOSA-N	446.460	1.431	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2cc(Cl)ccc2O)CC1	735117881	IIHXLOGCIAEXOS-UHFFFAOYSA-N	425.898	1.134	50	20	IDGD	
O=C(Cc1cc(O)nc(S)n1)NN=C1C(=O)Nc2c(Br)cc(Cl)cc21	735612446	KYHJQEFQYRLEND-UHFFFAOYSA-N	442.682	1.902	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NCCCCc2ccc([N+](=O)[O-])cc2)c2ccccc2c1=O	740483032	KZYYWIHMGXXAEV-UHFFFAOYSA-N	438.444	1.809	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)[C@H]1CCCN(c2ncnc3sccc23)C1	742611670	CVHZTNRPGWDFHW-LBPRGKRZSA-N	428.474	1.078	50	20	IDGD	
O=C(COC(=O)[C@@H]1SCCc2ccccc21)NNC(=O)[C@H]1COc2ccccc2O1	745472208	GYWRVHSZAMXCDU-IEBWSBKVSA-N	428.466	1.548	50	20	IDGD	
CN(C)CCN1C[C@H](C(=O)NNC(=O)CCCOc2ccc(Cl)cc2Cl)CC1=O	746094009	XDXNWZGFMDVPNK-CYBMUJFWSA-N	445.347	1.710	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)c1cnn(-c2ccccn2)c1C(F)(F)F	746545490	PHMIOOJDULAKEI-UHFFFAOYSA-N	429.362	1.938	50	20	IDGD	
COc1cccc(-c2nn(-c3ccccc3)cc2C(=O)NNC(=O)C(=O)N2CCCC2)c1	748246933	HUCOMJOEBDPVFV-UHFFFAOYSA-N	433.468	1.931	50	20	IDGD	
O=C(CCCNS(=O)(=O)c1ccc2c(c1)OCCO2)NNc1ccc(F)cc1F	748276001	PPFOIUIMHSVECN-UHFFFAOYSA-N	427.429	1.938	50	20	IDGD	
C=CCn1c(SCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)nnc1-c1cccnc1	748345327	ABVMZBIHCYWAFU-UHFFFAOYSA-N	439.457	1.988	50	20	IDGD	
Cc1c(NNC(=O)[C@H]2CC(=O)N(c3cccc(S(N)(=O)=O)c3)C2)cccc1[N+](=O)[O-]	748683254	RRDCENHQACEJQV-LBPRGKRZSA-N	433.446	1.047	50	20	IDGD	
C[C@H](C(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12)c1cnn(C)c1	749865862	VPLWIUBWWHQHBB-HNNXBMFYSA-N	430.468	1.743	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)c1ccccc1F)C(=O)NNC(=O)CC1CCCC1	749952191	JLWPEOIWAUIHJI-HNNXBMFYSA-N	431.555	1.953	50	20	IDGD	
Cc1c(C(=O)NNC(=O)CNC(=O)c2ccco2)nnn1-c1cccc(Br)c1	751203260	KZTWPIUNBUBJIP-UHFFFAOYSA-N	447.249	1.122	50	20	IDGD	
C[C@@]1(O)CCN(C(=O)/C(C#N)=C/c2cn(CCC(N)=O)nc2-c2ccc(Cl)cc2)C1	754368392	RZOCCOZFDHSCMN-XISXUPMFSA-N	427.892	1.969	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cccnc2Br)cc1OC	756239604	BTQQJXDDONJHPM-UHFFFAOYSA-N	438.234	1.479	50	20	IDGD	
C[C@H]1CN(C(=O)Cn2cc(NC(=O)NNC(=O)c3cccc(Cl)c3)cn2)C[C@H](C)O1	756838489	MZVWFUPQMBLSDL-STQMWFEESA-N	434.884	1.639	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)c1ccc(-c2ccc(Br)cc2)s1	758039128	HQNQGFXUKZFWKP-SECBINFHSA-N	446.348	1.876	50	20	IDGD	
COc1ccc(C[C@H](C)C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cc1	759607052	DPZGNDWVWSMKRG-SFHVURJKSA-N	438.528	1.479	50	20	IDGD	
COc1cc(N2CCN(CC(=O)NNC(=O)c3cccc(C)c3)CC2)cc(OC)c1OC	759872433	JMEMMHIKBTWOOF-UHFFFAOYSA-N	442.516	1.604	50	20	IDGD	
CCS(=O)(=O)c1cc(F)ccc1NC(=O)NNC(=O)COc1ccccc1OC	760009965	LYXLPKPNXIVLAB-UHFFFAOYSA-N	425.438	1.860	50	20	IDGD	
CCn1c(NNC(=O)[C@](C)(O)CN2C(=O)C(C)(C)c3ccccc32)nc2ccccc2c1=O	760104999	SLPVEQPLNQOIEQ-XMMPIXPASA-N	449.511	1.935	50	20	IDGD	
COc1ccc2c(c1)OC[C@H]2CC(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	760620640	WLSQKCDUOAJGOU-YJYMSZOUSA-N	442.424	1.092	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(NC(=O)C(=O)NNC(=O)C(C)(C)C)ccc1Cl	761064351	XGPBKHURENSWJO-UHFFFAOYSA-N	432.930	1.503	50	20	IDGD	
CC(=O)N(CCc1ccccc1)CC(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	761643831	TYXAIUKJBVNPOA-UHFFFAOYSA-N	430.530	1.662	50	20	IDGD	
N#Cc1ccc(N2CCC(NC(=O)NNC(=O)CSc3ccccc3O)CC2)nc1	763497392	QAIDCVYIKXHMOL-UHFFFAOYSA-N	426.502	1.750	50	20	IDGD	
COc1cc(OC)c(OC)cc1NC(=O)C(=O)NNC(=O)c1cc2ccccc2cc1O	763525614	AFGWUCGGVLXDDC-UHFFFAOYSA-N	439.424	1.971	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(NC(=O)C2CC2)cc1	763649100	ZAVLCXXPSOQNOF-UHFFFAOYSA-N	426.429	1.209	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(-n2nc(C)cc2C)nc1	763712412	QDEMLADIPDVFEI-UHFFFAOYSA-N	436.472	1.611	50	20	IDGD	
O=C(CN1CCCc2ccccc21)NNC(=O)C(=O)Nc1cc(C(F)(F)F)cnc1O	763745783	KNYWUEVGDDUPJA-UHFFFAOYSA-N	437.378	1.345	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)c(OCCN(C)C)c1	763837236	BJBAFGUFPYYJQK-UHFFFAOYSA-N	432.452	1.239	50	20	IDGD	
CNC(=O)c1ccc(C)c(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)c1	763841919	VBNGHCWSGFZUNY-HNNXBMFYSA-N	426.473	1.525	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cnn(C[C@@H]3CCCO3)c2)c1C	763842312	YNORVPZVEOXZJL-RDJZCZTQSA-N	429.477	1.232	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccn(Cc3ccccc3)n2)cc1	763877914	MIZVFBYIRLPGEC-INIZCTEOSA-N	449.467	1.687	50	20	IDGD	
CCc1onc(C)c1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1cccc(Br)c1	763883474	OMFPVHYMKRUDKA-JTQLQIEISA-N	439.266	1.861	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccc(OCC(F)(F)F)c(C)c2)n1	763890975	IZGBWLWHUBHNGE-UHFFFAOYSA-N	427.383	1.536	50	20	IDGD	
CCC(=O)Nc1ccc(Cl)c(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)c1	764003277	AXKCIVLYTSKNAE-UHFFFAOYSA-N	446.847	1.859	50	20	IDGD	
O=C(NNC(=O)c1cccc2ccccc12)C(=O)Nc1ccc(CN2C(=O)CCC2=O)cc1	764057467	CWKUGFBDAHSHMX-UHFFFAOYSA-N	444.447	1.889	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2O1)C(=O)Nc1ccc(OC[C@@H]2CCCO2)cc1	764154340	PKZZLIWIPUODOR-PKOBYXMFSA-N	425.441	1.334	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2O1)C(=O)Nc1ccc(-c2ncc3n2CCCC3)cc1	764169014	RVYQVOIMBLLORN-FQEVSTJZSA-N	445.479	1.976	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(N3CCCC3=O)c(Cl)c2)c1	764234757	IVIKYRINBIXJHU-UHFFFAOYSA-N	425.832	1.738	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1ccc2c(c1)oc(=O)n2C	764397713	MFYDLPBGKDDWCC-UHFFFAOYSA-N	430.442	1.018	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(Br)c2ccccc12	764398889	YCHMHSZIWHEKKO-NSHDSACASA-N	438.278	1.740	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)c2cccnc12	764402053	XBCOQSVTVUSIBP-UHFFFAOYSA-N	426.454	1.827	50	20	IDGD	
O=C(CCC(=O)N1CCN(c2ccccn2)CC1)NNC(=O)c1ccc2ccccc2n1	764430322	PGMOJUPBPVJKKG-UHFFFAOYSA-N	432.484	1.520	50	20	IDGD	
CC(=O)N1CCc2ccccc2[C@H]1CC(=O)NNC(=O)CCCNC(=O)OC(C)(C)C	765322740	LVZJHMVBRYAZRF-GOSISDBHSA-N	432.521	1.975	50	20	IDGD	
COC(=O)c1nccc2c(S(=O)(=O)NNC(=O)COc3ccccc3O)cccc12	766798875	CJEJYKAPVCMKAY-UHFFFAOYSA-N	431.426	1.116	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cnn(C3CCOCC3)c2C)cc1OC	766988986	CPLCXFJBGZEJRD-UHFFFAOYSA-N	446.460	1.178	50	20	IDGD	
COc1cccc(C(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)c1[N+](=O)[O-]	768207088	OHEYHTWOYLWBHB-UHFFFAOYSA-N	437.453	1.853	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccccn2)n(-c2ccc(C(F)(F)F)cn2)n1	768234061	QQPOSGGBRDKRCH-UHFFFAOYSA-N	433.350	1.389	50	20	IDGD	
CN1CCC(N2CCC(NC(=O)NNc3nc(O)c4cnn(C(C)(C)C)c4n3)CC2)CC1	770368359	LTDJSVOPWFIVRG-UHFFFAOYSA-N	445.572	1.472	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)N1CCC(N(C)S(C)(=O)=O)CC1	770647539	MVGRKWOMORNPOD-GFCCVEGCSA-N	432.930	1.204	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)N1CCC[C@@H](CNS(C)(=O)=O)C1	770658848	PWWPQQSIAGKQGV-STQMWFEESA-N	432.930	1.109	50	20	IDGD	
C[C@@H]1CN(c2ccnc(C(=O)NNC(=O)c3csc(N4CCOCC4)n3)c2)C[C@@H](C)O1	770813545	KJZGUHDNRJHSKH-ZIAGYGMSSA-N	446.533	1.063	50	20	IDGD	
CCS(=O)(=O)c1ccc(F)c(C(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)c1	770966742	ADZLZYJAPFZBLM-UHFFFAOYSA-N	436.469	1.977	50	20	IDGD	
O=C(NCCNS(=O)(=O)c1cccnc1)NNc1ccc(Br)c(F)c1	771344582	QBXBWLXXSXEMHJ-UHFFFAOYSA-N	432.275	1.588	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)[C@H]3CCCCO3)CC2)cc1	772222399	NOYNQEWNJGYFLD-GOSISDBHSA-N	439.534	1.203	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)Nc1cnn(Cc2nnc3n2CCCC3)c1	772642295	YHCXWEZIPLKFLL-UHFFFAOYSA-N	428.428	1.230	50	20	IDGD	
CC(=O)N1Cc2ccccc2C[C@@H]1C(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772897738	LNQFFHMCMLUPGI-GOSISDBHSA-N	428.876	1.077	50	20	IDGD	
CCOc1ccc(C(=O)NCC(=O)NNC(=O)[C@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1	773422654	XFSGFNXNKIDGEG-INIZCTEOSA-N	448.520	1.610	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)C(=O)Nc2ccc3c(c2)CCN3C(=O)c2cccnc2)n1	773479907	MEAQRFXLJAUJJU-UHFFFAOYSA-N	431.456	1.773	50	20	IDGD	
O=C(NNc1ccccc1[N+](=O)[O-])C(=O)Nc1ccc(F)c(N2CCCS2(=O)=O)c1	773651494	ZPLTWLMABBBOHR-UHFFFAOYSA-N	437.409	1.356	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)C3=CCCCCC3)CC2)cc1	775878293	ZUGQJVUOAQAZIJ-UHFFFAOYSA-N	434.562	1.339	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C[C@@H]2CCN(C(=O)OC(C)(C)C)C2)c2ccccc2c1=O	777758882	UWKAOTJKZMBAQG-AWEZNQCLSA-N	443.504	1.825	50	20	IDGD	
O=C1NC[C@H]2CN(S(=O)(=O)c3cccc(S(F)(F)(F)(F)F)c3)CCN2C1=O	777996987	LMTLUGNMQMGLDL-VIFPVBQESA-N	435.396	1.675	50	20	IDGD	
CCOC(=O)N1[C@H](C(=O)NNC(=O)CNC(=O)OC(C)(C)C)CC[C@@H]1c1ccc(C)o1	778441531	LWLWSPJNURUWFH-KGLIPLIRSA-N	438.481	1.922	50	20	IDGD	
CN(C)C(=O)COc1ccccc1C(F)(F)C(=O)NNc1cccc(S(C)(=O)=O)c1	778966981	GKTKNTFMEUJCND-UHFFFAOYSA-N	441.456	1.792	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(C(=O)NNc2ccc([N+](=O)[O-])cc2Br)n(C)c1	779145463	VBVVEPCPDDYWTD-UHFFFAOYSA-N	446.283	1.703	50	20	IDGD	
COC(=O)c1ccccc1NNC(=O)[C@@H]1CCCN1C(=O)/C=C\c1ccc(C(N)=O)cc1	780730835	DKAHQVXSHOEIIA-XGCMIMOYSA-N	436.468	1.720	50	20	IDGD	
CCOc1cc(N2CCN(C)CC2)ccc1NC(=O)C(=O)NNc1ccc(OC)cc1	783036071	MBJWKTVKEPNLHJ-UHFFFAOYSA-N	427.505	1.928	50	20	IDGD	
Cc1ccccc1COc1cccc(NC(=O)C(=O)NN[C@]2(C)CCS(=O)(=O)C2)c1	783426085	FQZXGDAZHYBIHZ-OAQYLSRUSA-N	431.514	1.711	50	20	IDGD	
CN(NC(=O)C(=O)Nc1ccc(Br)cc1S(C)(=O)=O)c1ccccc1	783433468	SEWKFVFTRDDRAD-UHFFFAOYSA-N	426.292	1.959	50	20	IDGD	
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)NNC(=O)NCCc1cccs1	783817115	VYZWXSQMZWREDA-UHFFFAOYSA-N	428.448	1.178	50	20	IDGD	
O=C(NNC(=O)C(=O)N1CCCC1)C(=O)Nc1cccc(OCc2cccc(F)c2)c1	783996177	FVZVNBGXLLMRAE-UHFFFAOYSA-N	428.420	1.113	50	20	IDGD	
C[C@H](C[S@@](C)=O)NC(=O)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1	784254390	LICXEKYWHNEYKL-ROTZMGCXSA-N	428.558	1.711	50	20	IDGD	
COc1cccc(NNC(=O)C(=O)Nc2ccc3c(ccn3CCN3CCOCC3)c2)n1	784844100	UJKVIWRBWUHITF-UHFFFAOYSA-N	438.488	1.459	50	20	IDGD	
O=C(NNc1ccc(Cl)c(F)c1)C(=O)Nc1cccc(N2CCS(=O)(=O)CC2)c1	785184040	MZIOKQWSCFNPKM-UHFFFAOYSA-N	440.884	1.796	50	20	IDGD	
CCCNC(=O)[C@@H]1CN(C(=O)C(=O)NNc2cc(F)cc(OC)c2)c2ccccc2O1	785236916	KHCILOOVYYELIG-SFHVURJKSA-N	430.436	1.598	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1cc(C)n([C@H](C)C2CC2)n1	785331101	ORHJVOMQOBIQOI-GFCCVEGCSA-N	435.506	1.656	50	20	IDGD	
CN(CC(=O)NNC(=O)C1CC1)Cc1cccc(Br)c1OC[C@H]1CCCO1	785518118	ONJAHPHPKYQXOF-OAHLLOKOSA-N	440.338	1.996	50	20	IDGD	
C[C@H]1[C@H](C(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)CCN1C(=O)OC(C)(C)C	786249897	LQZDKZDLKBAOBG-SWLSCSKDSA-N	438.912	1.749	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)[C@H]1CCC(=O)c2ccccc21	786391189	KOODAVIRCSGXBL-FQEVSTJZSA-N	434.496	1.352	50	20	IDGD	
CCOC(=O)c1cnn(C)c1NC(=O)C(=O)NNC(=O)c1sc2ccccc2c1Cl	786415115	XFQIQHDCODWWLE-UHFFFAOYSA-N	449.876	1.865	50	20	IDGD	
C[C@H]1C[C@H](C)CC2(C1)NC(=O)N(CC(=O)NNc1nnc(-c3ccccn3)s1)C2=O	788557991	DQPPIULRNRBZQI-RYUDHWBXSA-N	429.506	1.790	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1cccc2c1OCC[C@H]2N(C)C	789732948	VNLQXJLKYBXVBA-MRXNPFEDSA-N	436.472	1.428	50	20	IDGD	
Cn1cncc1CCC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	790070601	VICNMZFDJBEVJR-UHFFFAOYSA-N	433.515	1.676	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2cccc(NC(=O)N(C)C)c2C)c1	792352769	JRPCJNIAPBOFCR-UHFFFAOYSA-N	443.460	1.505	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)[C@@H]2Cc3cc(Br)ccc3O2)C[C@@H](C)O1	792629484	POSSMLFIULHAQF-OZVIIMIRSA-N	426.311	1.399	50	20	IDGD	
CC(=O)N[C@H](CC(=O)N([C@@H]1CCS(=O)(=O)C1)N(C)C)c1ccc(Br)cc1	792855833	URDXSHICDUMNFP-HZPDHXFCSA-N	446.367	1.509	50	20	IDGD	
CSSCCNC(=O)C(=O)Nc1ccc(N2CCOCC2)cc1N1CCOCC1	793079521	QYARYWVIVKYPFI-UHFFFAOYSA-N	440.591	1.426	50	20	IDGD	
CNS(=O)(=O)N1CCC(C(=O)NNC(=O)CCCOc2ccc(Cl)cc2C)CC1	794742051	QSCFKBVHQRRJOU-UHFFFAOYSA-N	446.957	1.131	50	20	IDGD	
COC(=O)C[C@@](C)(NCC(=O)NNC(=O)c1cc(Cl)ccc1OC)c1ccccn1	796011262	PQDKHBFTMBHSKF-HXUWFJFHSA-N	434.880	1.573	50	20	IDGD	
N#Cc1ccc(Cl)c(NC(=O)C(=O)NNC(=O)CNC(=O)OCc2ccccc2)c1	797369197	QBMRSPFVTSZODH-UHFFFAOYSA-N	429.820	1.224	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CCCN2CCN(c3ccccc3)CC2)cc1C	798310187	UUUOQBYBHYXURM-UHFFFAOYSA-N	437.544	1.992	50	20	IDGD	
C/C(C=NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C)=C\c1ccccc1C(F)(F)F	799883008	MELGAOKGSWRTBD-CKUCPQHNSA-N	448.405	1.658	50	20	IDGD	
C[C@@H](c1cccc(S(N)(=O)=O)c1)N(C)C(=O)NNC(=O)c1cnn(-c2ccccc2)c1	799927013	LNLCXJDBZXMTOJ-AWEZNQCLSA-N	442.501	1.567	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)NCCC(=O)NS(C)(=O)=O)c(C)n1-c1ccccc1F	800552167	LQFWFWYWKLPNMJ-WJDWOHSUSA-N	432.477	1.722	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)[C@@H]2CC[C@@H](C(F)(F)F)NC2=O)c(OC)cc1Cl	802081470	PUDLRJUVZUCDEJ-KRTXAFLBSA-N	438.790	1.967	50	20	IDGD	
COc1ccc(C2=NO[C@@H](CNC(=O)NNC(=O)CNC(=O)c3cccs3)C2)cc1	802366281	HCZDTBLRDDUGNB-CQSZACIVSA-N	431.474	1.010	50	20	IDGD	
CN(CC(=O)NNc1ccc(-c2cccc(C(F)(F)F)c2)nn1)[C@H]1CCS(=O)(=O)C1	804211120	FWDMMAFAQWTPMA-AWEZNQCLSA-N	443.451	1.724	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)N1CC[C@@H](N2CCN(C(=O)OC(C)(C)C)CC2)C1	804868316	CPIZNOISBJAKRG-QGZVFWFLSA-N	431.537	1.976	50	20	IDGD	
Cn1ncc(CNC(=O)/C(C#N)=C\c2cn(CCC(N)=O)nc2-c2ccc(Cl)cc2)n1	805204468	VSBZTPCHNITAHN-ZSOIEALJSA-N	438.879	1.431	50	20	IDGD	
COc1ccnc(NNC(=O)NCc2ccc(N3C(=O)N[C@@](C)(C4CC4)C3=O)cc2)n1	807240034	MHQZCNGXRYBEHM-FQEVSTJZSA-N	425.449	1.536	50	20	IDGD	
O=C(NC[C@H]1CCCSC1)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	807597485	JQMDGPBKLCPOJZ-OAHLLOKOSA-N	440.591	1.948	50	20	IDGD	
C#CC[C@@]1(C(=O)NNC(=O)c2cncc(NC(C)=O)c2)CCCN1C(=O)OC(C)(C)C	809729854	PVENJJDDUAAXPE-NRFANRHFSA-N	429.477	1.594	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)c1cc(S(=O)(=O)NC2CC2)ccc1C	811879969	ZHFOEJSOTLWIGM-UHFFFAOYSA-N	431.514	1.838	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)c2ccc(=O)n(-c3cccc(F)c3)c2)cc1	812731327	FUCYKILLJKIGGP-UHFFFAOYSA-N	430.461	1.984	50	20	IDGD	
CCOc1ccccc1N1C[C@H](C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)CC1=O	812732529	KKHARGADTXGGDK-OAHLLOKOSA-N	446.529	1.832	50	20	IDGD	
C[C@@](O)(C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1)c1ccc(Cl)cc1	815826856	CYBQMVZUWISPTL-QFIPXVFZSA-N	444.919	1.153	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)c2c(I)cnn2C)nc1C	815980169	BMRFTMAFYNCYFE-UHFFFAOYSA-N	430.206	1.057	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)Nc2nc(C)n(C)n2)cc1	817019078	QXTCDEYKQJUPQB-XNTDXEJSSA-N	434.460	1.417	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCO1)c1ccccc1NS(=O)(=O)c1cccc([N+](=O)[O-])c1	817215789	SOHGHEMHRQJHTP-MRXNPFEDSA-N	434.430	1.336	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCCC(=O)NNc2cccc(F)c2C(=O)OC)cc1	819717031	ZSURBRYHGRHMKZ-UHFFFAOYSA-N	439.465	1.823	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)c1cccc(OCC(N)=O)c1	912988912	TZXRCXYFYDIJNF-LLVKDONJSA-N	436.262	1.542	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cccnc2)cc1S(=O)(=O)NCc1ccccn1	913108744	KBQMADZUIOQIOR-UHFFFAOYSA-N	441.469	1.039	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(Cl)c(Cl)c1)NNC(=O)c1ccc2c(c1)OCO2	913415710	SMALEMGGURMAIQ-UHFFFAOYSA-N	446.268	1.462	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)NCC(=O)NNC(=S)Nc2cccc(Cl)c2)cc1	913522192	UHMXZZQARXZICF-UHFFFAOYSA-N	440.934	1.839	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)Cc2ccc(F)cc2)cc1S(=O)(=O)N1CCOCC1	913654379	AYVMKCLVMBSHHH-UHFFFAOYSA-N	449.504	1.413	50	20	IDGD	
CC(C)NS(=O)(=O)c1cc(C(=O)NNC(=O)[C@H]2COc3ccccc3O2)ccc1F	914709740	WMNSHMLBCZPECY-MRXNPFEDSA-N	437.449	1.113	50	20	IDGD	
C[C@H]1CN(c2ccc(C(=O)OCC(=O)NNC(=O)c3cccc(Cl)c3)cn2)C[C@H](C)O1	915039344	ZBBSSCZYHYDGQN-KBPBESRZSA-N	446.891	1.967	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCc2ccc(N3CCCCC3)nc2)nc1	916392167	JYRXIKWZEFPAOQ-UHFFFAOYSA-N	447.565	1.980	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCCCN2C[C@@H](C)C[C@@H](C)C2)c2ccccc2c1=O	916461162	WLKDRFCNEPHXLG-IYBDPMFKSA-N	428.537	1.728	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CNC(=O)c2ccc(C(F)(F)F)cc2)cc1C	916562149	MMFDZRWUGLPKLH-UHFFFAOYSA-N	436.390	1.838	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)NC[C@]2(N3CCOCC3)CCSC2)c2ccccc2n1	916637256	XAZHUAHKYSFKFS-OAQYLSRUSA-N	429.546	1.695	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)c1ccc2c(=O)n(CC)c(O)nc2c1	916741024	SCIKCFHHDKHQPA-UHFFFAOYSA-N	426.429	1.361	50	20	IDGD	
C[C@@H](COc1ccccc1)NC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	918089597	WLEWHEBNATUMFF-INIZCTEOSA-N	446.529	1.883	50	20	IDGD	
C[C@@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(C(=O)NNC(=O)NCC(F)(F)F)cc2)C1	918707099	RDROAORQDZNDGT-VXGBXAGGSA-N	436.456	1.860	50	20	IDGD	
Cc1nn(-c2ccc(C(=O)NNC(=O)N[C@@H]3CCS(=O)(=O)C3)cc2)c(C)c1Cl	919883915	GKVZTIBBKPRPNX-CYBMUJFWSA-N	425.898	1.274	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1C(F)(F)F)N[C@@H]1CCS(=O)(=O)C1	919889958	XMYAMDFNRWOZHJ-SNVBAGLBSA-N	431.396	1.022	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)NCCNS(=O)(=O)c2ccc(C)cc2)cc1	919902093	XNMOZNRCCYSDFT-UHFFFAOYSA-N	434.518	1.245	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)c1ccc(Cl)c(S(=O)(=O)N(C)OC)c1	920006351	IKKBPBHCBADWGI-UHFFFAOYSA-N	441.893	1.534	50	20	IDGD	
COCCn1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c2ccccc21	920030224	VGWPJRGCSOKQIW-UHFFFAOYSA-N	444.513	1.613	50	20	IDGD	
CCn1c(S)nc2cc(C(=O)NNC(=O)c3cncn3-c3ccccc3)ccc2c1=O	1317777853	RLBBNXBRIUJERN-UHFFFAOYSA-N	434.481	1.966	50	20	IDGD	
CN(C)c1nc(CNC(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)cs1	1319037542	YTDRNLAMYFDMLM-UHFFFAOYSA-N	426.543	1.687	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N[C@H]2CCN(c3cnn(C)c3)C2)cc1Br	1322968392	CXRUEOMLPYYULO-LBPRGKRZSA-N	437.298	1.414	50	20	IDGD	
COc1cc(CNC(=O)NNC(=O)CNC(=O)c2cccs2)cc(Cl)c1OC	1340495234	XIWJUKFSGJPTEU-UHFFFAOYSA-N	426.882	1.679	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCCC(=O)N2CCC[C@H](C)C2)c2ccccc2c1=O	1351924510	NQZJESQGQLZYDY-AWEZNQCLSA-N	428.493	1.009	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CC(F)(F)C(=O)O)C1	1778013336	REBOIJBTIIGXAS-XFBWCDHKSA-N	445.290	1.847	50	20	IDGD	
O=C(/C=C/C(=O)c1cccs1)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2	1778095860	LNHPXFPICAAFIG-WIDONADASA-N	440.949	1.601	50	20	IDGD	
O=C(c1cc2n(n1)CCCC2)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1778561800	OQQCJPRRNICYTK-YOEHRIQHSA-N	429.290	1.353	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4c(c3)NC(=O)[C@@H](C)O4)C2)C1	1780179594	SGKZVMISCCJRBH-CGSMKXTHSA-N	435.908	1.867	50	20	IDGD	
CCOc1ccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](Cl)COC)C3)nn1	1780239853	RVOJJVJOFPUWAS-YYFZDKIDSA-N	440.928	1.257	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](C)NC(=O)c3ccc(F)cc3)C2)C1	1780907214	VHEACKVIZSONST-LFRPXUGBSA-N	439.915	1.791	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H]1CC(=O)N(Cc3ccccc3)C1)CCO2	1781210961	FEUVPLLJHFLGAM-SELNLUPBSA-N	447.963	1.882	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccccc3C(N)=O)CCO2)C1	1781234703	PXAVZOMLIODYKN-RTBURBONSA-N	428.316	1.465	50	20	IDGD	
O=C([C@@H]1COc2ccccc2O1)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781326571	QHAOSCNGIBCBLA-RLFYNMQTSA-N	443.269	1.347	50	20	IDGD	
O=C(c1nc2ccccc2[nH]1)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781329267	CIHHHZRTWYWPII-GUYCJALGSA-N	425.258	1.697	50	20	IDGD	
C[C@H](Nc1cccnc1)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781330684	CYQJBNOQLIHDFW-DXCKQFNASA-N	429.290	1.402	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2)[C@@H]1CCc2ccccc2O1	1782146547	HBGQBKNPEMWTJI-FAGZOMQFSA-N	436.936	1.494	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnc3ccccn13)C2	1782172385	ATPVJOPEHNSEKR-LUQKVYGDSA-N	434.924	1.716	50	20	IDGD	
COc1ccc(CC(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](O)CCl)C3)cc1F	1782675918	SQFQGGDSFVLSBV-HGHGUNKESA-N	442.915	1.490	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2	1783102714	CWLTVGPWKXSYJB-STXHMFSFSA-N	447.960	1.015	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)Cc3cc(C)n(C)n3)CCO2)C1	1783344117	QOXKTAAVEZGYNP-MAUKXSAKSA-N	427.343	1.274	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(N(C)C)nc3)CCO2)C1	1783352064	MSNGHILHAMXJBO-BEFAXECRSA-N	439.354	1.765	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H]2C[C@@]21C(=O)N1CC[C@]2(CN(C(=O)[C@@H](F)Cl)CCO2)C1	1783553835	FPQQELRLWBKRHZ-NSMLZSOPSA-N	445.919	1.750	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)NC(=O)OC(C)(C)C)[C@H]2C1	1783820785	IYJDKGASXNYHHM-GVRJEKJASA-N	431.961	1.897	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4cccnn4c3)C[C@@H]21	1783972717	OMAFXDIRCZJTBY-BODMPHMZSA-N	449.349	1.959	50	20	IDGD	
O=C(CCC(=O)N1CCCC1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21	1785000753	DGMMBYNQEDJMIG-WSMBLCCSSA-N	448.333	1.059	50	20	IDGD	
Cn1cnc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)C(Cl)Cl)C[C@@H]32)c1C(F)(F)F	1787645275	ZMVQEZGYNGGRLS-GUBZILKMSA-N	443.253	1.836	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3Cc4ccccc4O3)[C@H]2C1	1788186038	BIKMBZBYQHZFRK-FUXXODJASA-N	437.334	1.753	50	20	IDGD	
Cn1ncc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]3C2)c1Cl	1788764226	FEJOQUQZRWVTOY-QEJZJMRPSA-N	428.993	1.518	50	20	IDGD	
CCSc1cccnc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21	1789420668	HFAODDFOXPVBOS-AJNGGQMLSA-N	427.954	1.387	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nc4ccccc4[nH]3)C[C@@H]21)[C@@H](F)Br	1789922781	NCBZHTZSMODOCI-LWWSYDQCSA-N	439.285	1.847	50	20	IDGD	
C[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]2C1)n1cccc1C=O	1789922972	VLQBZWXNLHPPLU-YERCRUGSSA-N	444.301	1.532	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc4nccn34)C[C@@H]21)[C@H](F)Br	1789924815	DVOSDIFKMGPUSQ-DUPGQFARSA-N	439.285	1.618	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3CC(c4ccccc4)=NN3)[C@H]2C1	1790543968	VLYCMWHSOFEMGS-ZULIPRJHSA-N	446.979	1.997	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)C3(O)CCC3)C[C@@H]21	1790962220	QUOJRSATYMLJCM-YXMSTPNBSA-N	431.371	1.691	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3c(F)cccc3F)C[C@@H]21	1791254532	WERUFDOVWPDINK-FRQROOTJSA-N	430.879	1.741	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4c(s3)CCC4)C[C@@H]21	1791288534	BASLVPSYKJPJBT-ULQDDVLXSA-N	448.589	1.203	50	20	IDGD	
COc1cnc(C(=O)NC2(c3ccc(NC(=O)CCC(=O)NN(C)C)cc3)CCC2)cn1	1791599731	TWGLSAGSNYJZPL-UHFFFAOYSA-N	440.504	1.606	50	20	IDGD	
O=C(CN1C(=O)C=CC1=O)Nc1ccc(C2(NC(=O)[C@H](F)Br)CCC2)cc1	1791695404	LWIBADIJOOEORC-INIZCTEOSA-N	438.253	1.736	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C#Cc1ccc(Cl)cc1	1792837342	HLDYUUAUXMTBBM-LORHWOILSA-N	425.312	1.535	50	20	IDGD	
COC(=O)[C@@H]1CC[C@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)CBr)C3)C1	1792967101	XSDGJJUMUMKDMK-KLOLGFOXSA-N	445.354	1.196	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCl)C1CC1	1793110690	UATCEDRRIAYYNE-JKJDWNRSSA-N	429.945	1.528	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CCc2nc(O)nc(O)c2C1)C(Cl)Cl	1794385334	HBMINSZLRHUCOA-CHWFTXMASA-N	429.304	1.435	50	20	IDGD	
CN(C)c1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Br)C3)nc1	1794461764	TYIOPMGIWBMNDW-JLUCKKNBSA-N	429.290	1.041	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](NC(C)C)C(C)C	1796174115	FHIICAGUAYPJDR-HFYDSOEISA-N	444.580	1.781	50	20	IDGD	
Cc1ccc2nc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3ccc(B(O)O)cc3)sc2c1	1796187335	YPLRVRPVLWDDQK-BCDXTJNWSA-N	449.341	1.850	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H]2C[C@]21C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Cl	1796369557	YVFCOYSHJHMNGM-RNCJLBHCSA-N	445.919	1.510	50	20	IDGD	
Cn1c(=O)c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CCBr)C3)nc2ccccc21	1797521433	WGDSINWLJACTPR-BTTYYORXSA-N	447.333	1.970	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1C[C@@H](O)C1	1797721139	XVITWXSGYOYHKI-WIBPJOOCSA-N	431.445	1.543	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1[C@@H]2Sc3ccccc3[C@H]21)c1ccc(B(O)O)cc1	1798451739	BNATVMCNEOAWIU-WXBORZKFSA-N	448.353	1.506	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CCN1C(=O)OC(C)(C)C)C2	1799263311	JTNIDJZVCZJZMW-YIDVYQOGSA-N	429.945	1.603	50	20	IDGD	
C[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@](C)(Cl)CCl)n1cccc1C=O	1799274664	DIHCOBXSXOBLEZ-MABMQTIPSA-N	430.332	1.688	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccn3ccnc3c1)C2	1799277102	RVPMUACLOAZICN-MVWRLGRASA-N	425.316	1.774	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(NC(=O)OC)c1)C2	1800977775	YHPWEYPEXCXSLG-YALNPMBYSA-N	439.896	1.322	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCCn1ccnc1	1801307325	MRLAAKLQEQZMGO-IVSAIRAKSA-N	427.343	1.426	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2n[nH]c(C3CC3)c2F)[C@@H]1c1cccnc1)[C@H](O)CCl	1803141272	MLLFOKHGQKJYCI-PMUMKWKESA-N	435.887	1.741	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@@H]1c1cccnc1)c1cc(O)ncn1	1803739977	BEVGPSSBCGXSFB-NILFDRSVSA-N	438.257	1.587	50	20	IDGD	
COc1ncc(C(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)cc1F	1804958663	WUTXNTFRCQOGQT-IAOVAPTHSA-N	436.871	1.544	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H](CNC(=O)c2ncnn2C)[C@H]1c1cccnc1	1805281130	GKMMFVFILTUBHV-QLFBSQMISA-N	435.326	1.703	50	20	IDGD	
Cn1cnc(C(=O)NC[C@@H]2CCN(C(=O)[C@H](F)Br)[C@H]2c2cccnc2)n1	1805327273	WIUVHRXXHNLGCG-AVGNSLFASA-N	425.262	1.220	50	20	IDGD	
O=C(c1[nH]cnc1-c1cccnc1)N1CCC2(CCCN(C(=O)[C@H](O)CCl)C2)CC1	1805523282	RWIKQPBIRDWLEL-MRXNPFEDSA-N	431.924	1.916	50	20	IDGD	
C=CCNC(=O)/C=C\C(=O)N1CC[C@@H](CNC(=O)CCBr)[C@@H]1c1cccnc1	1806337191	GTWDTXPMKPMHAH-MARJLNQVSA-N	449.349	1.731	50	20	IDGD	
C[C@H](Cn1cncn1)C(=O)N1CC[C@@H](CNC(=O)CCBr)[C@H]1c1cccnc1	1806342792	LIITYMLUVIVSDD-UWWQBHOKSA-N	449.353	1.800	50	20	IDGD	
O=C([C@H](O)CCl)N1CC[C@H](CNC(=O)C2(Br)CC2)[C@@H]1c1cccnc1	1808695667	TXLLNYBUEZQGGF-MCIONIFRSA-N	430.730	1.615	50	20	IDGD	
CC(C)n1ccc(C(=O)N2CCC3(CCCN(C(=O)c4cccc(B(O)O)c4)C3)CC2)n1	1809977574	GQXSDUNSRNROQX-UHFFFAOYSA-N	438.337	1.302	50	20	IDGD	
Cc1ccn(C)c1C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1811609934	BSPPXAWDMOKECD-AVRDEDQJSA-N	440.548	1.421	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)CNC(=O)c2ccco2)[C@H]1c1cccnc1	1813031342	QOENBOKVIAQOLW-GJYPPUQNSA-N	448.907	1.364	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)COc2cccnn2)[C@H]1c1cccnc1	1813390454	BZEJYZILGWLIGT-TXPKVOOTSA-N	433.896	1.210	50	20	IDGD	
CC(C)/C=C/C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1	1813694996	XTKUUKCBNXLXPZ-DFUKUNQBSA-N	436.516	1.612	50	20	IDGD	
O=C1COc2ccc(C(=O)N3CCCC[C@H]3c3cc(NC(=O)[C@H](O)CCl)n[nH]3)cc2N1	1814873328	PIYWGRNUAKCSEN-LSDHHAIUSA-N	447.879	1.646	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)C(=O)c1ccccc1	1816716267	USVFOURPLSXPMB-IBGZPJMESA-N	446.272	1.278	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](F)Br)n[nH]1	1820935444	MMMULBXENBROPF-PUYPPJJSSA-N	430.278	1.783	50	20	IDGD	
Cc1nn(C)cc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1	1822411069	ZENHCQQKYQVQTN-MRXNPFEDSA-N	430.513	1.131	50	20	IDGD	
CCc1cc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)n(C)n1	1822414933	OGNHNYIRKGBALY-INIZCTEOSA-N	444.540	1.385	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCn1ccnn1)CC2	1822868912	CDSGWUZGHZRARU-HWPZZCPQSA-N	431.349	1.973	50	20	IDGD	
O=C(CNC(=O)C(F)(F)F)Nc1nc2c(s1)C[C@@H](NC(=O)C(Cl)Cl)CC2	1826146355	QMSODERTCYIJSM-YFKPBYRVSA-N	433.239	1.537	50	20	IDGD	
C#CCCCCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2	1826420497	GAVPLPDHWBOHET-INIZCTEOSA-N	425.319	1.242	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H](O)c2ccccc2)CC1	1826659095	DSXOXXXEOXDQAG-NZQKXSOJSA-N	444.576	1.713	50	20	IDGD	
C[C@]1(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)CC1(F)F	1827055313	UOAIIYGVOFBSIY-GHTZIAJQSA-N	434.292	1.645	50	20	IDGD	
Cc1ccn(C)c1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827056042	AFPYOOQTEBPUTO-OAQYLSRUSA-N	437.349	1.560	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccsc3)C2)C1	1830537425	HQEBASMUFJPWLM-SUMWQHHRSA-N	431.352	1.849	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1CC=CCC1)CCO2	1830554561	IUILNONXIJMKET-GPMSIDNRSA-N	429.355	1.830	50	20	IDGD	
CC(C)(C)[C@@H](O)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1	1830631565	YVLAQXPZNBSWQB-KKXDTOCCSA-N	425.353	1.086	50	20	IDGD	
COC(=O)C12CC(C(=O)N3CCCC[C@@H]3C3CCN(C(=O)[C@H](O)CCl)CC3)(C1)C2	1831601730	VWTVQXJSHFEVHS-AJHHTPGJSA-N	426.941	1.549	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cn3cc(Cl)cn3)C2)C1	1831647107	QABZGYXAVIRKSU-QAPCUYQASA-N	433.336	1.400	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4c(c3)CC(=O)N4)C2)C1	1831652121	WLOLOSQDFMZLIM-HTAPYJJXSA-N	449.935	1.659	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCCn2ccnc2)CC1	1831877430	XHCTWFJYGPYNLA-HXUWFJFHSA-N	446.596	1.656	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)Cc2ccc(O)cn2)CC1	1831877449	YDLRBQVGJSCAOF-HXUWFJFHSA-N	445.564	1.322	50	20	IDGD	
C[C@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)Cc3cnc[nH]3)CC2)CC1	1833263253	GZDBURWXUTTYHB-CQSZACIVSA-N	440.386	1.555	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)COc3ccc(F)cc3)CC2)CC1)[C@@H](O)CCl	1833308984	HHANOBJTQHGPFP-IBGZPJMESA-N	441.931	1.376	50	20	IDGD	
Cc1cc(C#N)cc(C(=O)N2CCC(N3CCC(NC(=O)[C@H](O)CCl)CC3)CC2)c1	1833312068	JLJMHIBNQMWOFA-HXUWFJFHSA-N	432.952	1.652	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)[C@@H]3CCCN3C)CC2)CC1	1833623595	MOJFPXDQUAQUBC-YOEHRIQHSA-N	429.403	1.436	50	20	IDGD	
Cc1cc(CC(=O)NC2CCN(C3CCN(C(=O)[C@@H](F)Br)CC3)CC2)on1	1833733142	HCRWWIDPAKTEGG-QGZVFWFLSA-N	445.333	1.788	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccn(C)c3)CCO2)C1	1833858922	ORPYCBKSHJFBED-YJBOKZPZSA-N	428.327	1.269	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccncc3)CCO2)C1	1834020158	NVLOWLPUPQUHAI-YJBOKZPZSA-N	426.311	1.325	50	20	IDGD	
Cc1noc(C)c1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1	1834069047	REKILENUKOCBDE-QZTJIDSGSA-N	434.320	1.598	50	20	IDGD	
CCc1ccc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCBr)CCO3)C2)cn1	1834819444	RMEHDCQYSMIETC-LJQANCHMSA-N	440.338	1.499	50	20	IDGD	
CC(C)N[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)Br)C2)C1)C(C)C	1835900934	LTQDSHSOFGMODT-JTDSTZFVSA-N	448.402	1.249	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCC(N2CCC(NC(=O)c3c[nH]c(=O)cn3)CC2)CC1	1836140276	LKCZZMDDZDEWGQ-IBGZPJMESA-N	444.363	1.191	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC(OC2CCN(C(=O)Cn3nccn3)CC2)CC1	1836673161	JSYLCCNQBREHQF-CQSZACIVSA-N	442.358	1.308	50	20	IDGD	
Cc1cccnc1CCC(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836715323	PNPSEKAOTCJMRL-HXUWFJFHSA-N	437.968	1.921	50	20	IDGD	
O=C(c1ccc2cnccc2n1)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836717238	OXRUUJXIMQCXCS-FQEVSTJZSA-N	446.935	1.842	50	20	IDGD	
CCS(=O)(=O)CC(=O)N1CCC(OC2CCN(C(=O)CO[Si](C)(C)C)CC2)CC1	1836846122	IHOQVPFMBZDQMR-UHFFFAOYSA-N	448.658	1.271	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)c(C)n1C	1838389701	MLFABAXUXHXKCE-AUUYWEPGSA-N	442.354	1.495	50	20	IDGD	
N#Cc1cccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)c1Cl	1838596390	XBXJBTLSBQMMRB-MAUKXSAKSA-N	430.263	1.816	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccncc3)CCO2)C1	1839060213	VBQNIQRDBQBSHG-MOPGFXCFSA-N	430.332	1.317	50	20	IDGD	
O=C(Cc1ccsc1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839199864	XHKPRZORNXRWKS-HOCLYGCPSA-N	435.315	1.438	50	20	IDGD	
COc1cc(Cl)ccc1CC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1839752967	FFIPDIXGENECHF-IEBWSBKVSA-N	449.306	1.882	50	20	IDGD	
CCc1[nH]nc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)c1Cl	1840188008	JSYJONSCDCOJQH-MRXNPFEDSA-N	439.727	1.499	50	20	IDGD	
O=C(C(Cl)Cl)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3Cc4ccccc4N3)C2)C1	1840189635	CZXUQRBRVWAMJW-HNAYVOBHSA-N	428.316	1.283	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@]1(C)CC=CCC1)CCO2	1840557872	GEUITGROEGDJKI-KFKAGJAMSA-N	429.355	1.973	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(F)c(F)c3C)CCO2)C1	1840705566	UBKDIVOQPRJAEX-QRWLVFNGSA-N	446.878	1.597	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@H](CC(N)=O)NC(=O)OC(C)(C)C)C2	1841671734	FIWFORSKMXHULN-KBPBESRZSA-N	444.960	1.366	50	20	IDGD	
C=C[C@@H](O)C(C)(C)C(=O)N1CCCC12CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1844235403	ACUNBSWTYJHDMG-LSDHHAIUSA-N	443.972	1.895	50	20	IDGD	
COc1cc(N2CCC(C(=O)N3CC4(CCCN4C(=O)C(Cl)Cl)C3)CC2)ncn1	1846386786	XRKZBBPWULVAKQ-UHFFFAOYSA-N	442.347	1.709	50	20	IDGD	
COc1cc(C(=O)OCC(=O)NNC(=O)c2ccc(C)cc2)cc(Cl)c1OCC(N)=O	11366909	HSNFXUMDUURWOF-UHFFFAOYSA-N	449.847	1.139	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2ccc(CN3C(=O)CCC3=O)cc2)c2ccccc2c1=O	21896601	CDYLTPFLBDGUDA-UHFFFAOYSA-N	447.451	1.140	50	20	IDGD	
CN1C(=C(C#N)C(=O)COC(=O)c2ccc(S(N)(=O)=O)cc2)N(C)c2ccccc21	22391796	WVVCDAARVUCMAQ-UHFFFAOYSA-N	426.454	1.381	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)c1ccc(CNC(N)=O)cc1	23785716	IRELSBCPTGUNCD-NSHDSACASA-N	435.278	1.846	50	20	IDGD	
COc1ccccc1-c1nnc(SCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)n1N	36185688	IAJUCFWSHZCOIL-UHFFFAOYSA-N	443.445	1.129	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)N2CCC[C@H](NS(C)(=O)=O)C2)N(C)c2ccccc21	108783759	AWKGDPRDCFQEMO-HNNXBMFYSA-N	445.545	1.197	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)c2nn(-c3ccccc3C(F)(F)F)c(C)cc2=O)n1	302795509	YPSUVLBNHBVFLZ-UHFFFAOYSA-N	448.405	1.834	50	20	IDGD	
C#Cc1cccc(NC(=S)NNC(=O)CNC(=O)NCc2ccc([N+](=O)[O-])cc2)c1	727498942	BGWZWDKQGUZQRD-UHFFFAOYSA-N	426.458	1.393	50	20	IDGD	
Cc1cc(C)c(S(=O)(=O)NCCC(=O)NNc2nc(-c3ccncc3)no2)c(C)c1	728074001	WHFQYZAPZXBHRN-UHFFFAOYSA-N	430.490	1.869	50	20	IDGD	
COc1ccccc1[C@H](C)CC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1	728511596	VLVBFKHFAWMZAO-MRXNPFEDSA-N	433.530	1.965	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2csc(-c3ccc(O)cc3)n2)n1	728729709	AFUMKOJSJLHIQV-UHFFFAOYSA-N	432.483	1.828	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)N2CCN(S(=O)(=O)c3ccccc3Cl)CC2)c1	728954883	RCALKSDICOTKPE-UHFFFAOYSA-N	447.904	1.573	50	20	IDGD	
CC[C@H](N=c1nn[nH]n1-c1ccccc1)C(=O)NNc1nc2ccccc2c(=O)n1CC	729260719	WQFPRWFVLXDZBK-INIZCTEOSA-N	433.476	1.148	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)[C@H]3CCN(C)C3)c2)cc1	729282408	WCXRKHYMXSXKGF-HNNXBMFYSA-N	432.502	1.209	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)[C@@H]2C[C@@H](O)CN2C(=O)OCc2ccccc2)cc1C	729282711	GDGVLIMRPDYHTD-QUCCMNQESA-N	441.484	1.602	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Cc2ccccn2)cc1S(=O)(=O)Cc1cc(C)no1	729397460	ZLKYVXIZQYTZEY-UHFFFAOYSA-N	444.469	1.364	50	20	IDGD	
CCN1C(=O)c2ccc(C(=O)NNC(=O)Cn3ccc4ccccc43)cc2S1(=O)=O	729454559	VFZAMBZBOUNIKL-UHFFFAOYSA-N	426.454	1.267	50	20	IDGD	
COc1ccc(Cl)cc1N1C[C@H](C(=O)NNC(=O)COc2ccccc2O)CC1=O	730782230	JQNIHMCNDCSSSN-GFCCVEGCSA-N	433.848	1.634	50	20	IDGD	
COc1ccc([C@@H](CNC(=O)NNC(=O)COc2ccccc2O)N(C)C)cc1OC	730903505	LWOFBXDCUDIHJN-OAHLLOKOSA-N	432.477	1.422	50	20	IDGD	
CCn1c(NNC(=O)CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])nc2ccccc2c1=O	731050256	GICMCIALDFKZTH-UHFFFAOYSA-N	444.835	1.851	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(\C#N)C(=O)OCCN(C)S(=O)(=O)N(C)C)c1C	731144448	GRSHUCOSWLDXQG-LZNAANCOSA-N	426.539	1.501	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)N1CCN(C(=O)N(C)Cc2ccccc2)CC1	731499724	CJWUKUWYQMJAHJ-UHFFFAOYSA-N	425.489	1.919	50	20	IDGD	
C[C@]1(NNC(=O)N[C@@H]2CCN(c3ccccc3Br)C2)CCS(=O)(=O)C1	732476176	AFLHVGLNIMNBDX-WBMJQRKESA-N	431.356	1.409	50	20	IDGD	
O=C(NNS(=O)(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)c1cccc(Cl)c1	733121024	HVWPSZVWMIPWQA-UHFFFAOYSA-N	443.934	1.748	50	20	IDGD	
Cc1csc([C@@](O)(CC(=O)NNc2nc3ccccc3c(=O)n2C)C(F)(F)F)n1	733260990	VURFEASGBBFWDW-INIZCTEOSA-N	427.408	1.982	50	20	IDGD	
CCOC(Cn1cc(C(=O)NNc2nc(-c3ccccn3)nc(C)c2C)nn1)OCC	734256599	ICLMPWJSCUQADZ-UHFFFAOYSA-N	426.481	1.903	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)N[C@@H]1CCCN(c2ccccc2)C1	734516322	GKYQRPYKOLLUJG-MRXNPFEDSA-N	444.561	1.901	50	20	IDGD	
COCCOc1ccc(-n2nc(C)c(C(=O)NNC(=O)Cn3cnc4ccccc43)n2)cc1	735028994	PKXZRCQYZZZOOW-UHFFFAOYSA-N	449.471	1.412	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)N[C@@H]1CCN(c2ccccc2OC(F)F)C1	735097168	SCMGMWYXAHCMDO-GFCCVEGCSA-N	437.403	1.220	50	20	IDGD	
Cc1ccc(Nc2cccc(C(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)c2)nn1	736066375	FFSLDQWBRGVURA-UHFFFAOYSA-N	429.440	1.850	50	20	IDGD	
O=C(NNc1cccnn1)[C@H]1CCCCN1S(=O)(=O)c1ccc(Br)s1	736698903	YZVQFQPNKMEIPL-SNVBAGLBSA-N	446.352	1.987	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)NCCNc2nccc(C(F)(F)F)n2)c1	739045400	LTXLQVVUGAHZGD-UHFFFAOYSA-N	428.371	1.569	50	20	IDGD	
O=C(C[C@@H]1CN(Cc2ccccc2)CCO1)NNC(=O)c1csc(N2CCOCC2)n1	740740050	MMWQULZODGWXMG-QGZVFWFLSA-N	445.545	1.032	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CCN2CCN(c3ccccn3)CC2)cc(OC)c1OC	741143922	AMZQTETWWQTUOO-UHFFFAOYSA-N	443.504	1.081	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)CCS(=O)(=O)c2ccc3c(c2)OCCCO3)cc1	741206907	GPGUJSMLZARKPW-UHFFFAOYSA-N	448.497	1.547	50	20	IDGD	
Cn1c(SCC(=O)NNC(=O)c2cccc(C#N)c2)nc2sc3c(c2c1=O)CCC3	741843552	RJCGGMSZFLWQNL-UHFFFAOYSA-N	439.522	1.909	50	20	IDGD	
O=C(CN1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O)NNC(=O)Nc1ccc(-c2ccccc2)cc1	743826283	XCNQJJAHCUJZHW-LFGUQSLTSA-N	434.452	1.669	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1cccc(-n2cccn2)c1	744621175	UDSCJEIIDFGEBN-UHFFFAOYSA-N	427.486	1.650	50	20	IDGD	
C[C@H](CC(=O)OCC(=O)NNC(=O)c1ccc(C#N)cc1)S(=O)(=O)c1ccc(F)cc1	744959661	YVTHRZALMDWCPY-CYBMUJFWSA-N	447.444	1.254	50	20	IDGD	
O=C(NNC(=O)[C@]1(O)CCN(Cc2ccccc2)C1)c1ccc(F)cc1Br	746136554	YJSMIURGHCNSLZ-IBGZPJMESA-N	436.281	1.986	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)c1cnn(CC(=O)NC2CCCCC2)c1	746575952	CAIJWTOHHNGODN-CQSZACIVSA-N	431.468	1.700	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)[C@@]1(F)CCN(C(=O)OC(C)(C)C)C1	748285079	HEUBWZQGCSLROT-HXUWFJFHSA-N	425.457	1.961	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)NCCCN1CCN(c2ccncc2)CC1	748464580	GEDKSWFBJNNKOP-UHFFFAOYSA-N	442.520	1.012	50	20	IDGD	
C[C@]1(C2CC2)NC(=O)N(CC(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)C1=O	748521641	XRFXBOMRJUUKOB-OAHLLOKOSA-N	434.396	1.144	50	20	IDGD	
CNS(=O)(=O)c1csc(C(=O)NNC(=O)c2cc(Br)ccc2O)c1	748853046	DZIDPJYJDCMNIQ-UHFFFAOYSA-N	434.293	1.199	50	20	IDGD	
CC[C@H](Nc1c([N+](=O)[O-])c(C)nn1C)C(=O)NNc1ccc(S(=O)(=O)C(F)F)cc1	749531913	WZSPIGIXDPYPSX-LBPRGKRZSA-N	446.436	1.967	50	20	IDGD	
Cc1cccc(NC(=O)N2CCC[C@@H](C(=O)NNC(=O)CNC(=O)c3ccco3)C2)c1	751204264	YPRUQPCXWHBKAV-OAHLLOKOSA-N	427.461	1.409	50	20	IDGD	
Cc1ccc(Cn2nc(C)c(C(=O)NNC(=O)CNC(=O)c3ccco3)c2Cl)cc1	751206549	JFUMZERVONAIHU-UHFFFAOYSA-N	429.864	1.986	50	20	IDGD	
O=C(COC(=O)c1cnn(CCC(F)(F)F)c1)NNC(=O)c1cccc([N+](=O)[O-])c1	752271578	ULZRODCVWWQBOL-UHFFFAOYSA-N	429.311	1.362	50	20	IDGD	
C[C@@]1(NNC(=O)N[C@H]2CC(=O)N(c3cccc(C(F)(F)F)c3)C2)CCS(=O)(=O)C1	753035437	WORMUMUQLPKBKH-BLLLJJGKSA-N	434.440	1.192	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)N[C@@H]1CCCN(Cc2ccccn2)C1=O	753298146	JJLSZTUVBABHRC-OAHLLOKOSA-N	429.502	1.401	50	20	IDGD	
Cc1ccc(S(=O)(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c(C)c1C(=O)O	753774274	DKAFLPDQXKUXHT-UHFFFAOYSA-N	426.472	1.028	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCc1ccc(C(N)=O)nc1	753952775	BNDJXOLZXGOGHF-SNVBAGLBSA-N	436.266	1.241	50	20	IDGD	
CC(C)(C(=O)NNC(=O)NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1ccccc1	754192988	FWVXBRXSRBARTR-UHFFFAOYSA-N	434.474	1.677	50	20	IDGD	
C[C@H](NCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)[C@H]1CCCN(C(=O)OC(C)(C)C)C1	754319182	PMTLPFPEAXRYOU-HOCLYGCPSA-N	449.508	1.981	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)/C(C#N)=C/c1ccc(O)cc1	754535689	IDBHPCLBENRZFD-MDWZMJQESA-N	429.816	1.966	50	20	IDGD	
Cc1cc(S(N)(=O)=O)cc(NC(=O)COC(=O)/C(C#N)=C/c2ccc(O)cc2)c1C	754549758	NKSDBNHRSGOCJY-OVCLIPMQSA-N	429.454	1.745	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Cc2cc[nH]n2)c([N+](=O)[O-])cc1OCc1cscn1	755270881	WPGPXIPDPPQCLU-UHFFFAOYSA-N	432.418	1.366	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)Nc2ccc(S(=O)(=O)N3CCC[C@H](C)C3)cc2)n1	755447491	OSADHHAHZJKWGC-AWEZNQCLSA-N	448.549	1.773	50	20	IDGD	
COC(=O)CNC(=O)c1ccc(NC(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)cc1	755547344	NYTVPGCTOAIPEP-GFCCVEGCSA-N	432.408	1.349	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)COc2ccc(Br)cc2)cc1-n1cnnn1	755685760	CNWBBSCQJARCER-UHFFFAOYSA-N	446.265	1.965	50	20	IDGD	
COC(=O)CNC(=O)Cc1ccc(NC(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)cc1	755861493	FKYBYUJXCLKSFL-UHFFFAOYSA-N	442.516	1.887	50	20	IDGD	
CCOc1ccc([C@@H](C)NC(=O)CCCNC(=O)NN[C@@]2(C)CCS(=O)(=O)C2)cc1	756127591	ZXRYRWLLZYBLJF-QRWLVFNGSA-N	440.566	1.424	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2ccc(-c3cc[nH]n3)cc2)cc1	756513787	QPYBASOBTOUZNY-UHFFFAOYSA-N	442.501	1.859	50	20	IDGD	
COCCOc1ccc(C#N)cc1NC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	758013906	KFRWHNFHSBZHIH-UHFFFAOYSA-N	432.458	1.453	50	20	IDGD	
O=C(NCC1(c2ccccc2Cl)CCOCC1)NNC(=O)C(=O)Nc1ccccn1	758745921	KWSPZLSUMJYPDL-UHFFFAOYSA-N	431.880	1.752	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NC2CCN(c3cccnn3)CC2)ccc1OC(C)C	759615221	XPUYNYPQWPJNDZ-UHFFFAOYSA-N	428.493	1.885	50	20	IDGD	
CC(=O)Nc1cc(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc(C(F)(F)F)c1	760300109	ARIHDHLBDOIDFB-UHFFFAOYSA-N	433.350	1.714	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)Cc1c(C)nc2nc(SC)nn2c1C	761619311	LYWFVZKGKNETRC-UHFFFAOYSA-N	446.558	1.954	50	20	IDGD	
O=C(N[C@H](Cc1ccccc1)C(=O)NNc1nccc(N2CCOCC2)n1)c1ccccc1	762869597	YTTHQJOFYKHXSW-HXUWFJFHSA-N	446.511	1.798	50	20	IDGD	
O=C(NNC(=O)c1ccccc1Br)C(=O)Nc1cccc2c1OCCC2=O	763482127	CZNAOLYRNDJUGL-UHFFFAOYSA-N	432.230	1.814	50	20	IDGD	
COC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2ccccc2Br)c1C	763483626	UGDRLPLDWGEGKQ-UHFFFAOYSA-N	434.246	1.944	50	20	IDGD	
CN1CCCN(c2ccc(NC(=O)C(=O)NNC(=O)c3c[nH]c4ccccc34)cc2)CC1	763539889	BSKSNEGVKHPZQD-UHFFFAOYSA-N	434.500	1.710	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3cccc(N(C)C)c3)cn2)C[C@H](C)O1	763760830	UKUNTJAGEYKULV-GJZGRUSLSA-N	440.504	1.161	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)C(=O)Nc2ccc3n[nH]cc3c2)c2ccccc2c1=O	763801133	HPJCIVLPRMZQJQ-UHFFFAOYSA-N	447.455	1.473	50	20	IDGD	
CC1CCN(c2cccc(NC(=O)C(=O)NNC(=O)COc3ccccc3C#N)c2)CC1	763812083	BZSAONXFVGYFDM-UHFFFAOYSA-N	435.484	1.959	50	20	IDGD	
CC(C)CNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)Cc2c[nH]c3ccccc23)cc1	763860302	DBSCVBLWKXQVMT-UHFFFAOYSA-N	435.484	1.882	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(CNC(C)=O)cc2)cc1	763862725	ZVSITFPEKKTOMP-AWEZNQCLSA-N	442.472	1.275	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1cnn(Cc2ccccn2)c1	763865062	NJGZEKAEVVHXPA-ZDUSSCGKSA-N	426.408	1.019	50	20	IDGD	
O=C(NNC(=O)c1ccc(COc2ccccc2)o1)C(=O)Nc1cccnc1-n1cccn1	763950259	MVKUGEQQZIMKCC-UHFFFAOYSA-N	446.423	1.839	50	20	IDGD	
COC(=O)NCc1ccc(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)cc1	763994153	AGWLMXRXIPGXHK-UHFFFAOYSA-N	438.238	1.033	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)C(=O)Nc1cc(F)c(F)cc1I	763995016	CTGGTGGKHFRBFG-UHFFFAOYSA-N	448.167	1.308	50	20	IDGD	
O=C(NNC(=O)c1cnccn1)C(=O)Nc1cc(I)ccc1Cl	764025181	SZCAEBYZKQDUFT-UHFFFAOYSA-N	445.604	1.134	50	20	IDGD	
CN1CCN(c2ccccc2NC(=O)C(=O)NNC(=O)c2cccc3ccccc23)CC1	764047275	DLOZKYBJUMUPLW-UHFFFAOYSA-N	431.496	1.991	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2ccn(CCc3ccncc3)n2)cc1	764132183	QEDQCDRUFSATCD-UHFFFAOYSA-N	436.472	1.248	50	20	IDGD	
O=C(CCCc1ccccc1)NNC(=O)C(=O)Nc1ccccc1CN1C(=O)CCC1=O	764223339	GDTMVUBHBRCPEK-UHFFFAOYSA-N	436.468	1.444	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)Cc2cccnc2)n(-c2cccc(C(F)(F)F)c2)n1	764265582	BIEGEVKLGIKUDI-UHFFFAOYSA-N	446.389	1.923	50	20	IDGD	
Cc1cnn([C@@H]2CCCc3ccccc32)c1NC(=O)C(=O)NNC(=O)Cc1ccccn1	764266320	ATFVHBCYHLDPNP-LJQANCHMSA-N	432.484	1.841	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cccc(F)c3F)n[nH]2)cc1OC	764379123	RJHPQJYGZPWNSL-UHFFFAOYSA-N	445.382	1.772	50	20	IDGD	
CCOC(=O)c1cc(Br)ccc1NC(=O)C(=O)NNC(=O)c1ncccc1C	764388801	JJBVUHAULMLGMA-UHFFFAOYSA-N	449.261	1.729	50	20	IDGD	
CNc1ccc(C(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)cc1[N+](=O)[O-]	765753086	AVONYJXPKLTLOE-UHFFFAOYSA-N	440.504	1.524	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)CCSc3ccccn3)CC2)cc1	765753942	GAWRNMALNFWTBM-UHFFFAOYSA-N	427.574	1.837	50	20	IDGD	
COc1cc(C)nc(NNC(=O)NCCOc2ccc(S(=O)(=O)C(F)(F)F)cc2)n1	766548411	BYNQDYMAWMLHSM-UHFFFAOYSA-N	449.411	1.792	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)nn1C(C)(C)C	766647408	GUKFLCQUDDFPLF-UHFFFAOYSA-N	426.521	1.166	50	20	IDGD	
CON(C)C(=O)[C@H](CCSC)NC(=O)NNC(=O)[C@@H](C)Oc1cccc(C)c1C	767163558	INGLQAFVUBUPKL-CABCVRRESA-N	426.539	1.543	50	20	IDGD	
NC(=O)CNS(=O)(=O)c1ccc(C(=O)NNc2c(Cl)cc(F)cc2Cl)o1	768009102	LLIARCMGYSMCED-UHFFFAOYSA-N	425.225	1.246	50	20	IDGD	
C=CCn1c(SCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)nnc1-c1cnccn1	768411193	JVIPBBNPAGUHCV-UHFFFAOYSA-N	440.445	1.383	50	20	IDGD	
CC(C)c1cccc2c1OCCCC2=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O	768483461	RFJVJXNSAIXCGB-UHFFFAOYSA-N	431.518	1.388	50	20	IDGD	
COC(=O)c1ccc(S(=O)(=O)NNC(=O)c2cc(OC)ccc2Br)cn1	769631961	DOXRDQLKTKCOLF-UHFFFAOYSA-N	444.263	1.263	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NCCCc3cccs3)nc2)CC1	770286431	PDIBKCQRJQMWCA-UHFFFAOYSA-N	438.579	1.338	50	20	IDGD	
CNS(=O)(=O)c1ccc(CCC(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)cc1	770966257	OZPOIHFWDWJDLA-UHFFFAOYSA-N	447.521	1.271	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2ncccc2C(F)(F)F)cc1OC	771114132	JAFOBJVGHJDVLD-UHFFFAOYSA-N	427.335	1.736	50	20	IDGD	
Cc1cn(-c2ccccc2)nc1C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	771393271	WHHSDVUHHTZIJI-UHFFFAOYSA-N	441.513	1.959	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)N2CCN(c3nccn4cnnc34)[C@H](C)C2)c1C	771495139	SDFOUKVRFRHGLS-XNHPLOEXSA-N	448.531	1.833	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)c1ccc(CS(=O)(=O)c2ccccc2)o1	771927316	HOTXRWDMSZMXTK-CQSZACIVSA-N	436.486	1.992	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)c1cccc([C@]2(C)NC(=O)NC2=O)c1	772965345	XFVQIAAHAVEBDP-GIPWTMENSA-N	430.848	1.623	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)[C@@H](O)Cc2ccccc2Cl)CC1	773036121	RWXWNYCXFSYTCX-INIZCTEOSA-N	440.928	1.973	50	20	IDGD	
Cc1ccc(C(=O)N2CCOCC2)cc1NC(=O)C(=O)NNc1nccnc1C(C)C	773992160	LTMPOTUQIQLQDP-UHFFFAOYSA-N	426.477	1.463	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)nn1-c1ccc(Cl)c(Cl)c1	777368242	RNOHTISTIVOVLT-SNVBAGLBSA-N	446.316	1.619	50	20	IDGD	
Cc1ccc(C)n1-c1c(C(=O)N2CCN(S(=O)(=O)CBr)CC2)cnn1C	777831613	FCOSHDHHXHIMOD-UHFFFAOYSA-N	444.355	1.268	50	20	IDGD	
CN(NC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc(Br)s1)C(N)=O	778415483	IMOUURHJUABUKL-MRVPVSSYSA-N	425.330	1.096	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)C(=O)Nc2cc(Cl)ccc2OC[C@H]2CCCCO2)cn1	778715622	YXJWGBORCDHLCF-CQSZACIVSA-N	435.868	1.421	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)Nc1ccnn1Cc1ccc(Cl)c(F)c1	779479282	HLPLNRXOXMTGRB-NSHDSACASA-N	429.861	1.311	50	20	IDGD	
Cc1c(/C=C(\C#N)C(=O)OCn2nnc3c(cnn3-c3ccccc3)c2=O)cc(C#N)n1C	781228923	DWZCBKIWSQZOQK-LZYBPNLTSA-N	440.423	1.604	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc(Br)cc1)NNc1ncncc1Cl	781819010	VGKLJZGMFBKPRX-UHFFFAOYSA-N	434.703	1.704	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ncc(C)s3)n[nH]2)cc1OC	782124761	SXOYWPTVBDWFTK-UHFFFAOYSA-N	430.446	1.259	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)c1cccc(NS(=O)(=O)C(F)(F)F)c1	782540876	ZSOPCKVRFSXNBF-UHFFFAOYSA-N	432.336	1.931	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2ccc(NC(=O)CN3CCOCC3)cc2)cc1	783021331	CMQLSJYNBWGGHF-UHFFFAOYSA-N	427.461	1.048	50	20	IDGD	
CCC(CC)NC(=O)[C@@H]1CN(C(=O)C(=O)NNc2cc(C)nc(C)n2)c2ccccc2O1	783325254	GYKVVMGGGGBWCG-SFHVURJKSA-N	440.504	1.636	50	20	IDGD	
O=C(NNc1ccc(Cl)cc1)C(=O)Nc1ccccc1OCC(=O)N1CCOCC1	783340395	SJGAFZCUMGQKIB-UHFFFAOYSA-N	432.864	1.659	50	20	IDGD	
Cc1nn(C(C)(C)C)cc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	784588370	LRUAMJPUUDIBQA-UHFFFAOYSA-N	433.534	1.806	50	20	IDGD	
COc1ccc(C(=O)N2CCOCC2)cc1NC(=O)C(=O)NNc1cccc([N+](=O)[O-])c1	784831403	LWKCEQZONLTZSU-UHFFFAOYSA-N	443.416	1.158	50	20	IDGD	
CC(C)(C)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)cc1	785024691	XNABKOMULSCJOC-UHFFFAOYSA-N	428.401	1.929	50	20	IDGD	
CC(C)(C)N1C(=O)C[C@@H](C(=O)NNC(=O)C(=O)NC2CC2)[C@H]1c1ccc(Cl)c(F)c1	785066392	OIIZQTHYRVJCRE-MLGOLLRUSA-N	438.887	1.593	50	20	IDGD	
COc1nc(Br)ccc1NC(=O)C(=O)NNC(=O)c1c[nH]c2ccccc12	789586899	STOGGHAWCNGQON-UHFFFAOYSA-N	432.234	1.734	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)C(=O)Nc2ccc3c(c2)CC(=O)N3C)c1	789731634	HCUKDTSLLJBYAL-UHFFFAOYSA-N	438.484	1.802	50	20	IDGD	
CC(C)(C)c1cnc(NC(=O)C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)s1	789732594	WRAZMILCFHWKOJ-UHFFFAOYSA-N	428.474	1.732	50	20	IDGD	
COc1cc(NNC(=O)[C@H](NS(=O)(=O)c2ccc(C)cc2)[C@H](C)O)ccc1Cl	790179477	RHNSFDKFGYJAKX-YVEFUNNKSA-N	427.910	1.828	50	20	IDGD	
CC(C)(C)OC(=O)NNS(=O)(=O)c1cccc(S(=O)(=O)N2CCCCCC2)c1	790382231	PLECQPCEQPTVOD-UHFFFAOYSA-N	433.552	1.969	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)C(=O)Nc1ccccc1N1C[C@H]2CC[C@H]1C2	790951510	HIRSBWUVLNEEPQ-GJZGRUSLSA-N	426.448	1.979	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2cc(Cl)cc(C(N)=O)c2OC)n1	793060605	WKFCAJONCMDUAD-UHFFFAOYSA-N	435.872	1.166	50	20	IDGD	
COc1cc(N2C[C@@H](C(=O)NNC(=O)c3cccc(C)n3)CC2=O)cc(OC)c1OC	794089771	JSNWESSWBMGOJX-ZDUSSCGKSA-N	428.445	1.230	50	20	IDGD	
O=C(CNS(=O)(=O)c1c[nH]c2ncccc12)NNC(=O)Cc1cccc2ccccc12	794923006	VLFLWLLZXHSPNK-UHFFFAOYSA-N	437.481	1.385	50	20	IDGD	
CNC(=O)c1cc(Cl)cc(S(=O)(=O)NNC(=O)c2cc3c(s2)CCC3)c1OC	795280605	PDAVTIMYJUHGHS-UHFFFAOYSA-N	443.934	1.882	50	20	IDGD	
COc1ccc(Cl)c(NC(=O)NNC(=O)CNC(=O)c2c[nH]c3ccccc3c2=O)c1	802108490	WWBXKXOMLDWCLX-UHFFFAOYSA-N	443.847	1.773	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)C[C@@H]1COCCN1C(=O)OC(C)(C)C	803950416	ZCLOTQAZTLWETH-QGZVFWFLSA-N	449.504	1.254	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)/C(=C\c1cccnc1)NC(=O)c1ccccc1	804958954	TYFJCFSFPPMBKD-QGOAFFKASA-N	426.440	1.972	50	20	IDGD	
CCc1nnc(NC(=O)[C@H](C)[C@H](C)NC(=O)NNC(=O)Cc2ccccc2OC)s1	805881115	VKPVOEAFTVRNSM-NEPJUHHUSA-N	434.522	1.645	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N2CCOCC2)cc1NC(=O)NNc1cccc(F)n1	806142299	BUAADXYUIQRYID-UHFFFAOYSA-N	439.469	1.789	50	20	IDGD	
COc1ccc(CS(C)(=O)=O)cc1NC(=O)NNC(=O)c1cncc(NC(C)=O)c1	806636671	SRDOCMCMJIEOOC-UHFFFAOYSA-N	435.462	1.060	50	20	IDGD	
COCCNC(=O)[C@H](C)OC(=O)c1ccc(NC(=O)NNC(=O)c2ncccc2C)cc1	806750912	NRDJPGOEVISTSE-AWEZNQCLSA-N	443.460	1.164	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2nc(C3CCOCC3)cs2)c1	806973124	AHOHNRSDLDAYCS-UHFFFAOYSA-N	432.502	1.819	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cnn(C)c2-c2ccccc2)cc1	806974680	FJTDLUALYCWCLE-OAHLLOKOSA-N	449.467	1.843	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)[C@@H]1CCCN1C(=O)c1cc(Cl)ccc1OC	807371784	UFITVOUMVZXMHT-HNNXBMFYSA-N	441.912	1.890	50	20	IDGD	
CC1CCN(Cc2ccc(NC(=O)C(=O)NNc3ccc(-n4ccnc4)nn3)cc2)CC1	807429572	VLKHDSXTTLEJSU-UHFFFAOYSA-N	434.504	1.976	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCC(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)cc1C	810346710	WEZGTKMLOKSXPI-UHFFFAOYSA-N	447.485	1.721	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)C(=O)Nc1ccc(-c2ccccn2)cc1	810387076	DVELOAFNEWHNKT-UHFFFAOYSA-N	445.483	1.541	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NN=Cc1cc(I)cc([N+](=O)[O-])c1	811642812	HKSPKDOHGWYOFH-UHFFFAOYSA-N	432.218	1.954	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN(c2ccccc2)C1=O)c1csc(N2CCOCC2)n1	814365322	FZVBHPCWUXWXHQ-HNNXBMFYSA-N	429.502	1.184	50	20	IDGD	
CCC(=NNC(=O)Cn1nnc(-c2ccccc2)n1)c1ccccc1OCC(=O)N(C)C	814704830	ZSNMWLNWJFMLLH-UHFFFAOYSA-N	435.488	1.738	50	20	IDGD	
COc1cc(C(=O)NN=C(C)c2ccc(S(=O)(=O)CC(N)=O)cc2)ccc1OC(C)C	814755977	NEHWSVFRINWIHG-UHFFFAOYSA-N	447.513	1.895	50	20	IDGD	
Cc1c(COC(C)(C)C)cccc1NC(=O)C(=O)NNC(=O)[C@H]1CCc2nncn2C1	815691959	GPBUOUXUAWSTPC-AWEZNQCLSA-N	428.493	1.250	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)N2CCS(=O)(=NS(C)(=O)=O)CC2)c(C)n1CC(C)C	816716082	WGEGFGIDRAPARB-WOJGMQOQSA-N	440.591	1.938	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)c1cc(N2CCNC2=O)ccc1Cl	817053102	CLQAYPRXRMAHSS-UHFFFAOYSA-N	437.909	1.877	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)CSCC(=O)N1CCOCC1	913036912	JDXSUNYETLEUOL-UHFFFAOYSA-N	434.543	1.472	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C2=NN(c3ccc(F)cc3)[C@H](C(N)=O)C2)cc1C	913081186	DCLLQXVXBPXFSD-SFHVURJKSA-N	427.436	1.089	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)[C@@H]2CCCN(C(=O)Cc3ccccc3)C2)c1	914712722	SPHJLPOYWIBLID-QGZVFWFLSA-N	425.485	1.946	50	20	IDGD	
O=C(NN(Cc1ccccc1)c1ccccc1)[C@H]1CC(=O)N([C@H]2CCS(=O)(=O)C2)C1	914830002	OONAIQHBKHYKPR-ICSRJNTNSA-N	427.526	1.760	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)[C@H]1CC(=O)N(Cc2ccccn2)C1	914881283	HVNVKEJABVWUFD-ZDUSSCGKSA-N	447.289	1.419	50	20	IDGD	
COc1ccc(CCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1	915883591	OEUNKWIYZFWUPT-UHFFFAOYSA-N	446.529	1.666	50	20	IDGD	
O=C(NCCc1ccccn1)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	915885281	ZUGSSJPGJQFDJM-UHFFFAOYSA-N	442.483	1.970	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)NC[C@@H]1CN(Cc2ccccc2)CCO1	915894061	GKWFMGCAPZBPON-GOSISDBHSA-N	428.489	1.305	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)N3CCN(c4ccc(C(N)=O)cn4)CC3)cc2C1	916519880	ZOCLYNVUERIPJO-CYBMUJFWSA-N	442.545	1.543	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)NC1CCN(CC2CC2)CC1	918083551	AQZRWOMNAWTQGJ-UHFFFAOYSA-N	449.577	1.290	50	20	IDGD	
O=C(CC(F)(F)F)NNC(=O)NCc1cccc(NC(=O)CCN2CCOCC2)c1	918093847	NUEOTKZOCYTERU-UHFFFAOYSA-N	431.415	1.130	50	20	IDGD	
CCOc1ccc(CNC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1	920343352	URBZDXNIIUVKAZ-UHFFFAOYSA-N	434.518	1.545	50	20	IDGD	
CCCCN1C(=O)CC[C@H](C(=O)NNC(=O)CN2CCCC2=O)[C@H]1c1ccc(OC)cc1	920436228	ZDZZGTBQBGXAGR-PGRDOPGGSA-N	444.532	1.545	50	20	IDGD	
Cc1ccc([C@@]2(C)NC(=O)N(CC(=O)NNC(=O)Cc3nc4ccccc4n3C)C2=O)cc1	920455555	IDRRHDYXPWZFMJ-HSZRJFAPSA-N	448.483	1.039	50	20	IDGD	
CCN(CC)C[C@@H](C)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(CC)CC)c1	921121323	LXCFDQXXEFODKM-OAHLLOKOSA-N	427.571	1.391	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)c1ccc(S(=O)(=O)N(C)CCO)cc1	1116896364	MONZDYHTJBGHCI-UHFFFAOYSA-N	441.893	1.036	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2cc(C3CC3)nn2[C@H]2CCS(=O)(=O)C2)cc1	1320425093	UTFGVOQZRGRHRF-AWEZNQCLSA-N	433.490	1.595	50	20	IDGD	
Cc1cc(N2CCC(NC(=O)NNC(=O)C3CCN(C(=O)OC(C)(C)C)CC3)CC2)n[nH]1	1343322395	MHWDPHRNOXMBAT-UHFFFAOYSA-N	449.556	1.664	50	20	IDGD	
CC(C)n1cnc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](C)Br)C3)n1	1778280429	YRFWWUFCFYFQME-HBUWYVDXSA-N	442.358	1.770	50	20	IDGD	
CC[S@@](=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)Br)C2	1779223834	HLJPIELZOXROJP-KFBOSPLFSA-N	437.400	1.442	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@]2(C1)CN(C(=O)C[C@@H]1COc3ccccc3O1)CCO2	1779293813	CYPIJEFPGCJKLS-VGSWGCGISA-N	448.592	1.898	50	20	IDGD	
CCOc1ccc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)nn1	1780429205	GTQOZDYSIGSAIN-SJCJKPOMSA-N	427.299	1.102	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CNC(=O)c1ccco1)C2	1780702412	QWKOQQCGUMMRDU-AKCHCHLHSA-N	425.913	1.541	50	20	IDGD	
CN(C)c1ccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)cc1	1780728132	ODQBUDVHRSRVQM-CRAIPNDOSA-N	428.302	1.887	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)c3c(O)cc(O)cc3O)CCO2)C1	1781235455	ZNSSIVXUPRKDRL-QZTJIDSGSA-N	433.288	1.483	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(NC(=O)C4CC4)cc3)C2)C1	1781470576	RTXYIOWWKGHXIB-PGRDOPGGSA-N	449.935	1.732	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cccc(N4CCOCC4)c3)C2)C1	1781738426	ZTQCSCKNTJUOEL-SIKLNZKXSA-N	435.952	1.984	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4ccnn4c3)C2)C1	1782404997	OVUMQLZBDKGWBV-VQIMIIECSA-N	435.322	1.951	50	20	IDGD	
Cc1cnn([C@H](C)C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](F)Br)C3)c1	1782514140	JSTVGTBBERNUQG-ZXFNITATSA-N	445.333	1.957	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C2CC3(CCC3)C2)C1	1782795279	RHYIEUNWSKZWKX-WZONZLPQSA-N	434.581	1.454	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@]2(C1)CN(C(=O)c1cc(O)n[nH]1)CCO2	1782864987	ZTDMOOPBWMGISB-MYHKYFONSA-N	443.410	1.444	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccn4ccnc4c3)CCO2)C1	1783349206	JPULTJFIQAHXGE-HNAYVOBHSA-N	435.322	1.951	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cnn4cccnc34)CCO2)C1	1783350002	XZOMMNSYYDFEGU-KDOFPFPSSA-N	436.310	1.346	50	20	IDGD	
C[C@@H](NNc1ccccc1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21	1783554547	NURRYTZPPXFWBB-VRKREXBASA-N	429.348	1.775	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)Cc3cccc4ncccc34)CCO2)C1	1783871801	VWFDQRQRNPNAMN-GCJKJVERSA-N	431.920	1.861	50	20	IDGD	
CC(C)[C@@H](C(=O)N1CCO[C@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1)c1ccccc1	1783933211	RUTFULQCEVAROR-VWNXMTODSA-N	444.576	1.629	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4c(s3)CCCC4)C[C@@H]21)[C@@H](O)CCl	1784092380	KVDAPIHAHSVZOX-VGWMRTNUSA-N	426.966	1.820	50	20	IDGD	
Cc1cn2c(=O)c(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]4C3)cnc2s1	1787447006	IAILARHVWXAISA-PYJNHQTQSA-N	442.900	1.192	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)c1cn2ncccc2n1	1788017672	JTKNVYJFBNNQPP-TZQJONAQSA-N	440.273	1.013	50	20	IDGD	
Cn1ncc2cc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)C(Cl)Cl)C[C@@H]43)ccc21	1788062863	UEKYLBVFHWRJAX-NOLJZWGESA-N	425.316	1.970	50	20	IDGD	
Cc1cc(C(=O)NC2(c3ccc(NC(=O)c4ccc(B(O)O)cc4)cc3)CCC2)nn1C	1788140114	HJXCGQVBRLTULC-UHFFFAOYSA-N	432.289	1.470	50	20	IDGD	
CCc1ncsc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21	1789408966	RZTYDRKFHUBXLQ-WRZDFSGXSA-N	434.331	1.989	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC1(c2ccc(NC(=O)c3ccncc3O)cc2)CCC1	1789701601	NINSHTGDHBUHIB-UHFFFAOYSA-N	446.467	1.847	50	20	IDGD	
CNCCCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C(C#N)=C/c3ccc(F)cc3F)[C@H]2C1	1790693951	ACCMKYZQNSNUDE-VWZYDEGLSA-N	446.498	1.851	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3nnc(C)o3)C[C@@H]21	1790961418	KAMXRWATYVDRAK-FQUUOJAGSA-N	429.315	1.074	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=N/N3CCCCC3)C[C@@H]21	1791056454	ZXKRALIZVNIYGR-FBSHZBFYSA-N	429.359	1.221	50	20	IDGD	
O=C(NC1(c2ccc(NC(=O)[C@@H]3[C@H]4C=CS[C@@H]43)cc2)CCC1)c1cccc(B(O)O)c1	1791086578	BXOYUXQOQCBVIL-AQNXPRMDSA-N	434.326	1.989	50	20	IDGD	
COc1ccnc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]3C2)c1OC	1791296304	BUVJICGKLFJUIU-GVXVVHGQSA-N	432.304	1.496	50	20	IDGD	
CC1CCN(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)CBr)CC1	1792868720	NDDMZMLHALGIPG-CUSZFKRNSA-N	430.387	1.339	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)CBr	1792872124	NDMPUIGXWIPRLG-VJTDZRGJSA-N	435.315	1.169	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(N(C)C)nc1)C2	1792872370	BKERQCWFGPOGIH-JJAZEVLHSA-N	439.354	1.382	50	20	IDGD	
CC(C)N1CCC(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)CBr)C3)CC1	1793797127	ZMGCTKQAWWLTTK-OWLYRPNTSA-N	444.414	1.727	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cccnc1Cl	1793952841	SCORKVJGVCNEOE-ZIEJDFEHSA-N	444.757	1.898	50	20	IDGD	
C[C@@H](CC(N)=O)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1794141604	RNHACJXHDIXLSQ-RMEBNNNOSA-N	444.960	1.268	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(C(F)(F)F)nc1	1794809574	CVGIZVGFSLXPGN-QVHKTLOISA-N	435.830	1.557	50	20	IDGD	
COc1cnc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCBr)c(F)c1	1795112827	VXOPWCUKBCCGDZ-QHBPRCKVSA-N	430.274	1.218	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cn2ncccc2n1	1797569306	JIBJEWPMOCOTBQ-LCFLCXBCSA-N	448.487	1.115	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc3c(c1)C(=O)CC3)C2	1798442798	FWUGHKZIHXBABG-BJWYYQGGSA-N	447.495	1.380	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(Cl)cc2nn[nH]c12	1798620211	XDWJCZHZAKOAFX-YJKIEOBBSA-N	442.303	1.068	50	20	IDGD	
CCOc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)CBr)C3)nn1	1798753383	QVYMCFGOASHIAO-JFILPPLUSA-N	441.326	1.110	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(=O)nc2sccn12	1799096632	SBRCJTDWUABUGG-WISYIIOYSA-N	439.335	1.791	50	20	IDGD	
CC(C)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1nc2cc([N+](=O)[O-])ccc2[nH]1	1799875674	XLDZHOCASDJALS-DRXBFXEBSA-N	449.895	1.939	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccccc1O	1800565721	UEXPQMZKYLWMIZ-LJGDNWOOSA-N	425.323	1.555	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](CN)c1ccccc1)C2	1800639629	KTHXMYUSIKXONZ-MDMSPXHWSA-N	438.366	1.492	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cncc(N(C)C)c1)C2	1800640412	WRBVMXLTSXYHTR-FSDCSDTHSA-N	439.354	1.524	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cccc(F)c1F	1800666007	LQHWCMMRIYBHCA-YVWYUNDQSA-N	426.536	1.948	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1ccc(N(C)C)cc1)C2	1800981427	MWONIEGJTNIMKP-NZGUISNBSA-N	437.968	1.529	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(C)(C)c1ccccn1	1801210915	LKSFEAQQAOYOSM-MPTYRVRUSA-N	438.366	1.980	50	20	IDGD	
C[C@H](NNc1ccccc1)C(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]1c1cccnc1	1803138098	WJBFIPGPQVLNNY-MFHCWRBVSA-N	445.951	1.692	50	20	IDGD	
O=C(CN1CCOC1=O)NC[C@@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1	1803340879	ZZKUFMJLVMCCFT-WMLDXEAASA-N	439.310	1.325	50	20	IDGD	
O=C(c1cccn(C(F)F)c1=O)N1CCC2(CCCN(C(=O)[C@@H](O)CCl)C2)CC1	1805523711	ZPDWAWDUQFCIGX-AWEZNQCLSA-N	431.867	1.688	50	20	IDGD	
CC[C@@H](C(=O)N1CCCC2(CCN(C(=O)CCC(=O)NN(C)C)CC2)C1)N(CC)CC	1806176322	LWHNBTNXBCBQHE-IBGZPJMESA-N	437.629	1.711	50	20	IDGD	
O=C1CC[C@H](C(=O)NC[C@@H]2CCN(C(=O)[C@H](F)Br)[C@@H]2c2cccnc2)N1	1806815181	OYMTZNFPSNQDBB-MXYBEHONSA-N	427.274	1.057	50	20	IDGD	
Cc1csc(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)c1	1807366667	VHAPMXKZBHXENY-RXVVDRJESA-N	449.341	1.765	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2nccnc2C(N)=O)[C@H]1c1cccnc1	1811191960	UHKBLGSRAUZEEI-GRDNDAEWSA-N	430.896	1.308	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)COCCOC)[C@H]1c1cccnc1	1812775031	PCOOBYUMSARMKW-RYRKJORJSA-N	442.354	1.924	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)c2c[nH]c(=O)cn2)[C@@H]1c1cccnc1	1812868069	YLDHQAPLHDQYOU-DETPVDSQSA-N	434.294	1.268	50	20	IDGD	
Cc1ccncc1C(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1813071702	VLGALLKXDNQNOE-PGRDOPGGSA-N	438.532	1.478	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)Cn2cc([N+](=O)[O-])cn2)[C@H]1c1cccnc1)C(Cl)Cl	1813078132	PRVVBZPSJWFARA-DOMZBBRYSA-N	441.275	1.696	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)CN3CCCC3=O)sc2C1	1814600582	GHFDTWSKKARUAU-WDEREUQCSA-N	443.367	1.851	50	20	IDGD	
O=C(CCN1CCOCC1)Nc1nc2c(s1)C[C@H](NC(=O)CCBr)CC2	1814639694	LEUKWNGMFIOIGV-GFCCVEGCSA-N	445.383	1.562	50	20	IDGD	
CC[C@@H](O)C(=O)Nc1cc([C@H]2CCCCN2C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[nH]n1	1814770861	XSQSTMLZOAYSMA-ILLSNQCBSA-N	429.481	1.307	50	20	IDGD	
Cc1ccn(C)c1C(=O)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1	1815360840	OQYIBZWDEJKHJP-OAHLLOKOSA-N	438.318	1.009	50	20	IDGD	
COc1ncccc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1816430604	BFULWDZNZFTSNX-GOSISDBHSA-N	449.276	1.113	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ncccc2F)[nH]n1)c1ccc(B(O)O)cc1	1817472166	MHGLQSUNJYRLPZ-KRWDZBQOSA-N	437.240	1.243	50	20	IDGD	
Cc1ccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)nc1C	1817473183	KJVBVTHNDXGDSX-HXUWFJFHSA-N	447.304	1.721	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2nc3ncccn3n2)n[nH]1	1818621206	UKDLCXLFDSXSMH-AAEUAGOBSA-N	432.872	1.407	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc4nncn4c3)sc2C1	1819180986	PQKQMWZFXAWUNB-VXGBXAGGSA-N	434.909	1.665	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1)c1cccc(-n2cncn2)c1	1821295724	CQKASAJOXPHWFL-IRXDYDNUSA-N	443.895	1.896	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1)c1cc2cccnc2nc1O	1821423443	IVHNWWGMFKVPLU-LSDHHAIUSA-N	444.879	1.964	50	20	IDGD	
O=C(Cn1cccc([N+](=O)[O-])c1=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](F)Cl)[nH]n1	1821736963	HMUUNDXEBIYZOJ-ABAIWWIYSA-N	440.819	1.706	50	20	IDGD	
O=C(N[C@@H]1CCc2nc(NC(=O)c3ccoc3Cl)sc2C1)c1ccc(B(O)O)cc1	1821809128	DFCQTFPEXBHNMZ-GFCCVEGCSA-N	445.693	1.609	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H](O)c2ccco2)CC1	1823772865	AUQPBHSALYWJDI-UTKZUKDTSA-N	434.537	1.306	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CN2CCNC2=N)CC1	1824092893	IFGBVGYKJHXXFJ-GDBMZVCRSA-N	442.402	1.477	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)C[C@](C)(O)CC(=O)O)sc2C1	1826078532	UULAGXJLRYGYRW-DRTKUVKGSA-N	448.339	1.454	50	20	IDGD	
C[C@@H](C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2)n1cccc1	1826589196	ZLSNBSIKXVCVJH-BBRMVZONSA-N	438.318	1.111	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H](N)CCC(N)=O)CC1	1826823601	XKIWNTXZUJUYLW-DLBZAZTESA-N	426.634	1.050	50	20	IDGD	
CN1CCCC[C@H]1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827049632	YQGTYYCCBLDEST-YADHBBJMSA-N	441.381	1.084	50	20	IDGD	
O=C([C@@H]1C[C@]1(F)Cl)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827055267	SYIMMCVHKPXLHT-BBTUJRGHSA-N	436.720	1.524	50	20	IDGD	
Cc1cc(Cl)ccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1	1830117101	XCMOQTHGLRFQIB-APWZRJJASA-N	431.316	1.318	50	20	IDGD	
Cc1ccc2[nH]c(C(=O)N3CCOC[C@]4(C3)CN(C(=O)[C@@H](O)CCl)CCO4)cc2c1	1830728580	VKTVGARPJJTJTE-RXVVDRJESA-N	435.908	1.146	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@H](C)N2CCN(C)CC2)CC1	1831833386	NMMXEEFPKZKOLK-IHPCNDPISA-N	443.032	1.496	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cncc(O)c2)CC1	1831874264	GAKMIYJLRMUTJB-LJQANCHMSA-N	431.537	1.394	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)C(Cl)Cl)CC1	1831879077	SPACTOIQKOUNGS-INIZCTEOSA-N	427.137	1.403	50	20	IDGD	
COCC1(C(=O)NC2CCN(C3CCN(C(=O)CCBr)CC3)CC2)CC1	1833461145	QNFPCAKHYXAIEI-UHFFFAOYSA-N	430.387	1.770	50	20	IDGD	
Cc1cc[nH]c1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)CBr)C2)C1	1833538534	VBKKMIVPJQNYLC-KDOFPFPSSA-N	428.327	1.424	50	20	IDGD	
CN1CCC[C@H]1C(=O)NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1833622344	SWVYKXYPXYBOIE-JKSUJKDBSA-N	433.366	1.343	50	20	IDGD	
Cc1ccsc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1833945936	PMRFDMNJRHJCQC-CZUORRHYSA-N	435.315	1.817	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3cncn3C)CC2)CC1	1834246465	WUNQLSVQKWJNTN-INIZCTEOSA-N	440.386	1.779	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@]3(CN(C(=O)CCBr)CCO3)C2)cn1C	1834821823	ZSBVJCNHJUBRGG-SFHVURJKSA-N	428.327	1.189	50	20	IDGD	
CC(C)=NO[C@@H](C)C(=O)N1CCOC[C@]2(CN(C(=O)CCBr)CCO2)C1	1834823630	ACWMXMJIHCVUHZ-YOEHRIQHSA-N	434.331	1.029	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3ccnc(Cl)n3)CC2)CC1	1835912155	WLQWNMXTNHKBFE-OAHLLOKOSA-N	444.363	1.569	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3ccn(C(C)C)n3)CC2)CC1	1836185506	DAEJYPNQSFBYOW-GOSISDBHSA-N	439.988	1.903	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)/C=N/N3CCCCC3)CCO2)C1	1837440706	UXTVZYHCKIAZPJ-HPNSBFNSSA-N	428.961	1.322	50	20	IDGD	
CC(C)n1nccc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1838025013	ANOVRIPIVMLXSW-RHSMWYFYSA-N	447.305	1.225	50	20	IDGD	
CCc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)n(C)n1	1838039064	PJLMNLZTTRGUNF-FQEVSTJZSA-N	426.945	1.318	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(C#N)cc3)CCO2)C1	1838952601	CTVUFOYZSLARGU-UXHICEINSA-N	440.327	1.865	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(=O)c3ccco3)C2)C1	1839150781	XJXUSSUUHIPFRC-QZTJIDSGSA-N	433.288	1.155	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)C[C@@H](C)c3ccccc3)CCO2)C1	1839932323	RCELJSUSORHGDV-LZNRXBQRSA-N	438.952	1.890	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)cn1C	1840032804	KNQQDFFPTFEATF-KDOFPFPSSA-N	428.327	1.187	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(OC)c(F)c3)C2)C1	1840149166	GOMLGHQPBHBWOV-YWZLYKJASA-N	444.887	1.158	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(F)ccc3Cl)C2)C1	1840154770	FSRPJIPKVGSJCE-VQIMIIECSA-N	449.306	1.803	50	20	IDGD	
C[C@@H](Cc1ccccn1)C(=O)N1CCOC[C@@]2(CN(C(=O)C(Cl)Cl)CCO2)C1	1840190764	LNJMKKHWSGZFPQ-LIRRHRJNSA-N	430.332	1.520	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)C3CC4(CCC4)C3)CCO2)C1	1840604863	BPGMESTVNKMTPC-LIRRHRJNSA-N	429.355	1.807	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(NC(C)=O)c3)CCO2)C1	1840730117	CKQDCCDAHFWPBK-RXVVDRJESA-N	437.924	1.732	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)C3CCN(CC)CC3)CCO2)C1	1840927043	GALXCAAGYKYFLH-NQIIRXRSSA-N	429.989	1.582	50	20	IDGD	
C=CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)[C@H](Cl)COC)C2	1841748447	XEOHEAKRLHTRGQ-HUUCEWRRSA-N	429.945	1.913	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2c(F)ccnc2Cl)C1	1842138927	FSDZIXFSBRCENZ-BRJLIKDPSA-N	446.870	1.825	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)c2n[nH]c(C)c2F)C1	1842288373	DUDMOMOEUXPZPD-UHFFFAOYSA-N	445.407	1.822	50	20	IDGD	
O=C([C@H]1C[C@@]12C(=O)Nc1ccccc12)N1CC2(CCCN2C(=O)CCBr)C1	1842639125	HEUKPASJEGJOEX-VLIAUNLRSA-N	432.318	1.885	50	20	IDGD	
C[C@H](Br)C(=O)N1CC2(CCCN2C(=O)c2ccc(CS(C)(=O)=O)nc2)C1	1843216654	JJSWAZOCYHPPMX-LBPRGKRZSA-N	444.351	1.227	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC2(CCCN2C(=O)[C@@H](O)NC(=O)OC(C)(C)C)C1	1845440052	NCBDFMTVUMJWDM-VXGBXAGGSA-N	434.331	1.206	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2cc(C#N)ccc2F)C1	1845485485	KOUZVUBTDNNLMP-VULFUBBASA-N	436.447	1.648	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCCC12CN(C(=O)c1nc3ncccn3n1)C2	1845871146	TZSMZXWVOYKLKD-OQLLNIDSSA-N	449.421	1.827	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC12CN(C(=O)CN1C(=O)CSC1=S)C2	1846073072	KITPTUHBCGCUTC-JTQLQIEISA-N	434.381	1.224	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@H](NC(C)=O)c1cccc(Cl)c1)C2	1846363551	PNLVSGAIAIBYFC-DLBZAZTESA-N	442.343	1.974	50	20	IDGD	
CC(C)(C)OC(=O)N1CCO[C@H](C(=O)N2CC3(CCCN3C(=O)C(Cl)Cl)C2)C1	1846386719	QURQVAKVZORFIH-LBPRGKRZSA-N	436.336	1.629	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H]1CC[C@H]2CCC(=O)N2C1	1847500327	FAACWHKVKUGVQW-YXMSTPNBSA-N	426.355	1.620	50	20	IDGD	
CC(C)C[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl	1847569042	XIXZVRNYPIYTJW-VGWMRTNUSA-N	431.961	1.727	50	20	IDGD	
O=C(CNC(=O)c1ccc2c(c1)OCO2)NNC(=O)Cc1nc(-c2ccccc2)cs1	10600532	ZDTWIXYLUOIFRH-UHFFFAOYSA-N	438.465	1.659	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NNc2nc3ccccc3c(=O)n2CC)n(C)c1	11163282	RSQSNJAEHCIQDW-UHFFFAOYSA-N	446.533	1.542	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)c1ccc(S(=O)(=O)N2CCCCC2)cc1	26964136	ZTKNGNAEYJNIIY-UHFFFAOYSA-N	431.470	1.665	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@@H](NC(=O)COc2ccccc2)C(C)C)cc1OC	28777286	GHCFYLOGQVUYAV-FQEVSTJZSA-N	429.473	1.685	50	20	IDGD	
NC(=O)c1ccc(/C=C/C(=O)N2CCC[C@H]2C(=O)NNc2nc(-c3ccncc3)no2)cc1	728072197	ZPBAGGSFMDVAMI-JZLODUJNSA-N	447.455	1.378	50	20	IDGD	
O=C(NNc1nc(-c2ccccc2)no1)c1cc(S(=O)(=O)N2CCSCC2)c[nH]1	728079773	BHEPZBGXZSLOIK-UHFFFAOYSA-N	434.503	1.559	50	20	IDGD	
C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	728845610	NHVKXAZRDDHFFB-CYBMUJFWSA-N	430.490	1.929	50	20	IDGD	
CC[C@@H](C)NC(=O)CN1CCN(C(=O)NNC(=O)c2cccc(OC(F)F)c2)CC1	728953587	IAHQFQUBHIXDPX-CYBMUJFWSA-N	427.452	1.175	50	20	IDGD	
CCCN(CCC)S(=O)(=O)c1ccc(C(=O)NNC(=O)Cn2nc(C)cc2C)cc1	729298966	IYTRTHFCTHMIRP-UHFFFAOYSA-N	435.550	1.772	50	20	IDGD	
C[C@@H]1CCCCN1CCOc1ccccc1C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	729629546	LVGGBAVHQLFGIB-QGZVFWFLSA-N	449.515	1.990	50	20	IDGD	
CCc1ccccc1O[C@@H](C(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1)c1ccccc1	730535536	QHRQKHRACMSECI-IEBWSBKVSA-N	431.514	1.887	50	20	IDGD	
CC(C)[C@H](C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)N1C(=O)c2ccccc2C1=O	734239244	JQCLNBNCIZLGIY-OAHLLOKOSA-N	447.492	1.162	50	20	IDGD	
O=C(Cc1cccc2ccccc12)NNC(=O)N[C@H]1CCN(CCN2CCOCC2)C1	734685782	HJKWZOYBSGQTGW-FQEVSTJZSA-N	425.533	1.119	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)[C@H]2CC(=O)N(C3CCCC3)C2)CC1	734824672	HJMOBMFVIAWGAK-AWEZNQCLSA-N	437.541	1.507	50	20	IDGD	
CN1CCN([C@H](CNC(=O)NNC(=O)COCc2ccccc2)c2cccs2)CC1	738963177	KJIFITVHUIFKAR-GOSISDBHSA-N	431.562	1.584	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)CC(C)(C)NC(=O)OC(C)(C)C)c1	739678795	JGVQFIWEDPCLFA-UHFFFAOYSA-N	442.538	1.391	50	20	IDGD	
CN(C)Cc1cccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1	741275327	DQVNRJMOJFKAEG-UHFFFAOYSA-N	430.530	1.608	50	20	IDGD	
O=C(COC(=O)[C@H]1CN(Cc2ccccc2)CCO1)NNC(=O)c1ccc(Cl)cc1	741381156	FOUZVNXCHNZVBV-GOSISDBHSA-N	431.876	1.545	50	20	IDGD	
Cc1nn(C)c(C)c1C[C@H](C)C(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	742075973	FNZQRJVERFILNF-ZDUSSCGKSA-N	436.557	1.945	50	20	IDGD	
COc1ccc(O[C@H](C)CNC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)cc1	743685922	FPJYQBLQVPXXCI-CYBMUJFWSA-N	436.490	1.902	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)c2cccc(NC(=O)[C@@H]3CCCO3)c2)cc1	744550064	XBOUYFYAJCKVNJ-SFHVURJKSA-N	436.424	1.294	50	20	IDGD	
O=C(COc1cccc(Cl)c1)NNc1ccccc1S(=O)(=O)N1CCOCC1	744619513	RCESLRWXBGLKDC-UHFFFAOYSA-N	425.894	1.883	50	20	IDGD	
CCCc1c(C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)[nH]c(C)c1C(=O)OC	744826203	RCPLCKZKVUTGPL-UHFFFAOYSA-N	426.429	1.552	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)N[C@@H](CN1CCCC1=O)c1ccccc1	745499099	AVAPVJSREFJXCO-INIZCTEOSA-N	427.417	1.608	50	20	IDGD	
Cc1cc(=O)n(CC(=O)NC(C)C)c(C)c1C(=O)NNC(=O)[C@@H](C)Oc1ccccc1F	746098604	VYLVENOFEFFADS-OAHLLOKOSA-N	446.479	1.357	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)c1ccc2c(c1)C(=O)N(Cc1ccco1)C2=O	746550906	YBBQBDNQVOYFON-UHFFFAOYSA-N	443.419	1.727	50	20	IDGD	
O=C(CSc1nnc(NCC(F)(F)F)s1)NNC(=O)c1ccc([N+](=O)[O-])cc1	747062791	QICVELRRXMTCFM-UHFFFAOYSA-N	436.397	1.974	50	20	IDGD	
Cc1nn(C)c2ncc(C=NNC(=O)c3cccc(S(=O)(=O)N4CCCC4)c3)cc12	747602873	SBATVAVOWVGAGX-UHFFFAOYSA-N	426.502	1.825	50	20	IDGD	
Cc1nn(C)c(C)c1S(=O)(=O)N[C@@H](C)C(=O)NNc1cccc(Br)c1	748020035	FPEOTHPFHIVKBR-JTQLQIEISA-N	430.328	1.610	50	20	IDGD	
NS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cc3ccccc3o2)cc1Br	748085472	ROBAXYMGJGVKMZ-UHFFFAOYSA-N	438.259	1.918	50	20	IDGD	
COc1cc(S(=O)(=O)N2CCOCC2)cc(C(=O)NNc2cccc(F)c2)c1OC	748098955	NJQHBAXDSWTXSR-UHFFFAOYSA-N	439.465	1.621	50	20	IDGD	
O=C(CCN1C(=O)[C@H]2[C@H](C1=O)[C@H]1CC[C@H]2O1)NNc1ccc(Br)cc1F	748204008	YTGAGDPGMYBAKK-QHSBEEBCSA-N	426.242	1.584	50	20	IDGD	
CCN1CCN(c2ccc(F)cc2[C@@H](C)NC(=O)NNC(=O)[C@@H](C)OCCOC)CC1	748628025	PCJPZICSFJSFQU-HZPDHXFCSA-N	439.532	1.411	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)N[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	748637261	ZCFGSJWKHDLSED-BBRMVZONSA-N	432.443	1.662	50	20	IDGD	
COCCCOc1ccc(C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)cn1	751292888	CGLOLFKMXKUTHN-UHFFFAOYSA-N	435.506	1.173	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3ccc(S(C)(=O)=O)cc3)n[nH]2)cc1OC	751352052	OILZRESLAGAYLP-UHFFFAOYSA-N	444.469	1.572	50	20	IDGD	
CC(C)C[C@@H](CNC(=O)OC(C)(C)C)NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	751812608	GCTYDSCZLXHPIM-HNNXBMFYSA-N	446.512	1.546	50	20	IDGD	
CCOC(=O)c1ccc(N2CC(NC(=O)NNC(=O)c3cc(C)nc4ccccc34)C2)nc1	753280585	URONWKZKPCTZCG-UHFFFAOYSA-N	448.483	1.948	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc(Br)c(Cl)c(C(=O)O)c1)c1ccccn1	753522764	TZSQNRJNKLHJPV-UHFFFAOYSA-N	434.655	1.819	50	20	IDGD	
COCCOc1cc(C)ccc1CNC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	755088348	XLTVEVIXNZKKQG-UHFFFAOYSA-N	425.449	1.140	50	20	IDGD	
CN(CC(=O)O)c1ccc(C(F)(F)F)cc1C=NNC(=O)N[C@H]1CCS(=O)(=O)C1	755665291	UVKAUSRPPYRPQE-LBPRGKRZSA-N	436.412	1.046	50	20	IDGD	
COc1cc(CN2CC[C@H](NC(=O)NNC(=O)Cn3nc(C)cc3C)C2)cc(OC)c1	756093930	HDTMEVZVAKPKTI-KRWDZBQOSA-N	430.509	1.122	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)Nc2ccn(CCOC)n2)c2ccccc2c1=O	756310257	AHQVXCWAGOMKNS-UHFFFAOYSA-N	441.492	1.896	50	20	IDGD	
CN(C)C(=O)Cn1cc(NC(=O)NNC(=O)COc2ccccc2-c2ccccc2)cn1	756797231	PPCZTPYAFDLKKW-UHFFFAOYSA-N	436.472	1.870	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)CC[C@H](NC(=O)OC(C)(C)C)c1ccccc1	758046505	SWYCEDDKQZKPGL-HIFRSBDPSA-N	442.538	1.118	50	20	IDGD	
CCc1nnc(O)c(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c1CC	758151881	ZVBGISSJOGVSLQ-UHFFFAOYSA-N	426.521	1.280	50	20	IDGD	
CCc1nnc(O)c(C(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)c1CC	758782651	VICGMHHISQSWLM-UHFFFAOYSA-N	436.513	1.556	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)NC[C@]3(Cc4ccc(F)cc4)CCC[C@@H]3O)nc21	759650052	OBCZMQBVUAJTRF-MGPUTAFESA-N	429.456	1.608	50	20	IDGD	
O=C(COC(=O)c1scnc1C1CCCC1)NNC(=O)[C@@H]1COc2ccccc2O1	759754492	QEVMEHQIXPMDMX-HNNXBMFYSA-N	431.470	1.945	50	20	IDGD	
CCS(=O)(=O)c1cc(F)ccc1NC(=O)NNC(=O)c1nnc(O)c2ccccc12	760013859	IHLUQXGDRVDSQC-UHFFFAOYSA-N	433.421	1.735	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCCc2cccs2)nc1I	761146462	FUIWVLRPPFHASM-UHFFFAOYSA-N	446.270	1.943	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)o1	761621142	JGQMRAWQSAOOIU-UHFFFAOYSA-N	439.515	1.626	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)NCc1ccc(N2CCN(C)CC2)nc1	761653174	DVVHCQMVSBULCF-UHFFFAOYSA-N	444.561	1.465	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1Br	763573308	YMLUSOFFLZYKFF-OAHLLOKOSA-N	434.246	1.683	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2ccnc(OCC(F)(F)F)c2)c1	763631279	XSQWFWJAGKDAKM-UHFFFAOYSA-N	426.351	1.496	50	20	IDGD	
CC[C@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(OC)cc2)cc1	763660848	HUVIOKGIOZRCEM-AWEZNQCLSA-N	442.472	1.388	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cc(C3CCCCC3)nn2C)cc1	763661223	LDTTVUPSYWNMOZ-UHFFFAOYSA-N	429.477	1.641	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2cccc(-n3ccnc3)c2)c2ccccc2c1=O	763786959	SRSGOKIZSMHRRO-UHFFFAOYSA-N	445.439	1.002	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)C(=O)Nc1cc2c(cc1Cl)OCO2	763806071	YRTOACLJAYJRKV-UHFFFAOYSA-N	436.764	1.142	50	20	IDGD	
C[C@@H]1CCCN(c2ccc(C(=O)NNC(=O)CNC(=O)c3cccnc3)cc2[N+](=O)[O-])C1	763818922	QBASNUKTTJEYMU-CQSZACIVSA-N	440.460	1.417	50	20	IDGD	
CO[C@@H]1Cc2ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc3cccc(C)c3C)cc2C1	763840254	JWNGNAQWEOBVKD-HNAYVOBHSA-N	425.485	1.970	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(-n3cncn3)c(F)c2)c1C	763853421	YYKHZLGBRMVYGT-AWEZNQCLSA-N	440.435	1.577	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cnn(C[C@H]3CCCO3)c2)cc1	763861394	PAMONMSAZOEXJI-RDTXWAMCSA-N	445.476	1.014	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1cccc(N2CCOC2=O)c1	763864425	JBGYCLSZNGSFJU-GFCCVEGCSA-N	430.392	1.336	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2cccc(NC(=O)c3cccs3)c2)n1	763880095	BCJDLNDKKNUELX-UHFFFAOYSA-N	440.485	1.600	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2cccc(NC(=O)OCC(C)C)c2)n1	763886311	SLMJDHGVVNVVPB-UHFFFAOYSA-N	430.465	1.491	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(F)c(NC(=O)OC)c2)cc1OC	763901034	DZCIVGCKTBUBNW-UHFFFAOYSA-N	448.407	1.811	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(S(C)(=O)=O)cc2)ccc1OC(C)C	763916140	IYKDFKUTBUBQKC-UHFFFAOYSA-N	449.485	1.286	50	20	IDGD	
Cc1cn(C2CCCCC2)nc1NC(=O)C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	763921202	JCIHKKWDZJFFAD-UHFFFAOYSA-N	437.464	1.072	50	20	IDGD	
Cc1ccc(C(N)=O)cc1NC(=O)C(=O)NNC(=O)c1ccc(Br)s1	763942162	WIWVDJMZNDORGH-UHFFFAOYSA-N	425.264	1.318	50	20	IDGD	
CN(C)CCCOc1ccc(NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)cc1	763974850	ZSOHTDTUGAESNX-UHFFFAOYSA-N	434.880	1.776	50	20	IDGD	
COc1ccc(OC(C)C)c(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)c1	763994431	DDEPLDUIRAWETL-UHFFFAOYSA-N	439.266	1.973	50	20	IDGD	
N#Cc1ccc(OC(F)F)c(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)c1	763995079	LVXOFCNZJJIIHF-UHFFFAOYSA-N	442.176	1.650	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1cnn(-c2ccccc2Cl)c1	764003352	GJFRNSOLIFAXQQ-UHFFFAOYSA-N	441.831	1.697	50	20	IDGD	
CC[C@@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(NC(=O)[C@@H]2CCCO2)cc1C(F)(F)F	764082396	NKAACIMJWOWWSX-YGRLFVJLSA-N	444.410	1.955	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc4c(c3)NC(=O)CO4)n[nH]2)cc1	764110842	LVIHTEQBWCXTOJ-UHFFFAOYSA-N	434.412	1.116	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2cc(N3CCCC3=O)ccc2Cl)c1O	764132692	VZQVBTLXCQZTSA-UHFFFAOYSA-N	446.847	1.581	50	20	IDGD	
COCCOc1cc(NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)ccc1OC	764239229	HRSPOZBIFCZRJD-UHFFFAOYSA-N	440.456	1.461	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2c[nH]nc2-c2ccccc2)n[nH]1	764378207	VTQGMAKGHMGKOS-UHFFFAOYSA-N	445.439	1.875	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ncccc2C)cc1OCC1CCOCC1	764386561	ZKAMLJFRKNRXOJ-UHFFFAOYSA-N	426.473	1.904	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1cccc(C(=O)Nc2ccccc2)c1C	764398332	FNQMLLULQPJDFA-HNNXBMFYSA-N	442.472	1.385	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1ccccc1C(=O)N(C)C1CCCCC1	764401888	YXEAJZATWOTQKV-OAHLLOKOSA-N	448.520	1.229	50	20	IDGD	
CCOc1ccc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)[C@H](CC)N(C)C)cc2)cc1	764499548	CJTUHFNJIMQVLM-IBGZPJMESA-N	448.545	1.987	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)[C@@H](C)S(=O)(=O)C2CCOCC2)cc1OC	764574329	SNDHDCQOXIFGMC-CQSZACIVSA-N	442.534	1.617	50	20	IDGD	
CC(C)(C)OC(=O)N1CCO[C@H](CC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)C1	765464798	YJPXCFDADJFVBQ-QGZVFWFLSA-N	429.477	1.659	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)c3cc(S(N)(=O)=O)ccc3F)n[nH]2)cc1C	765567029	MTRGLKVKZGGLBD-UHFFFAOYSA-N	431.449	1.555	50	20	IDGD	
C=CCNS(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)c1	765616133	KYOGEXOZRSJJNT-UHFFFAOYSA-N	443.460	1.755	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)[C@H]1CC(=O)N(c2ccccc2Cl)C1	767270173	QOBDVXDQCDXSHN-INIZCTEOSA-N	443.887	1.935	50	20	IDGD	
O=C(COC(=O)C12C[C@H]3C[C@@H](CC(F)(C3)C1)C2)NNC(=O)[C@H]1COc2ccccc2O1	767468589	JMTKSUXINYITAC-YMBSLFMGSA-N	432.448	1.826	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](OCC(=O)NNC(=O)COc2ccccc2F)C1	767736932	ONZZVVWRCNYREB-CQSZACIVSA-N	425.457	1.768	50	20	IDGD	
Cc1c(C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)nnn1Cc1ccc(F)cc1	769558040	LBGULWPROQZYBC-UHFFFAOYSA-N	436.403	1.264	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)C(=O)Nc1ccnn1-c1cccc(F)c1	770774707	RUQAKROMZDTSBT-UHFFFAOYSA-N	442.363	1.085	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	771888282	LOGFBJNYCCJVRJ-AWEZNQCLSA-N	425.507	1.210	50	20	IDGD	
Cc1ccc(S(=O)(=O)NC2CC2)cc1C(=O)O[C@@H](C)C(=O)NNC(=O)CC(C)C	771969368	FIFWAHNSYUESGX-ZDUSSCGKSA-N	425.507	1.175	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C[C@@](O)(c1nccn1C)C(F)(F)F	772994959	MKVTZPZRPVKPDI-MGPLVRAMSA-N	434.802	1.828	50	20	IDGD	
CCOc1ccc2c(c1)[C@@H](NC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)CCO2	773557588	GLHAGTFEJHAVBN-KRWDZBQOSA-N	433.486	1.957	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ccccc2[N+](=O)[O-])cc1S(=O)(=O)NC1CC1	773657009	UIDJPYFPAIUBIZ-UHFFFAOYSA-N	449.445	1.126	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN[C@@H](C)c2ccc(N3CCOC3=O)cc2)cc1OC	775264996	ZMZPIWVDKZNNJJ-AWEZNQCLSA-N	442.472	1.772	50	20	IDGD	
CSc1cccc(C(=O)N2CCN(S(=O)(=O)CBr)CC2)c1[N+](=O)[O-]	777175705	YNKKMICNMOBSLR-UHFFFAOYSA-N	438.325	1.757	50	20	IDGD	
O=C(NNC(=O)N1CCO[C@H](c2ccc(F)cc2F)C1)c1ccc(-n2cnnn2)cc1	777411691	BGXOGXUXCYNWAC-KRWDZBQOSA-N	429.387	1.368	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CNC(=O)OC(C)(C)C)c([N+](=O)[O-])cc1OC(F)F	778436486	LERWUKPVLSGGDU-UHFFFAOYSA-N	434.352	1.491	50	20	IDGD	
O=C1CCc2cc(NC(=O)C(=O)NNC(=O)c3cccc(Br)c3)c(F)cc2N1	778713609	NRHKMHANEDKCAI-UHFFFAOYSA-N	449.236	1.873	50	20	IDGD	
O=C(CSCC(=O)N1CCOCC1)NNc1ccc([N+](=O)[O-])cc1Br	779140018	CHBUHFOLXRUPJN-UHFFFAOYSA-N	433.284	1.392	50	20	IDGD	
CN1C(=O)CN(NC(=O)/C(C#N)=C\c2cn(CCC#N)nc2-c2ccc(Cl)cc2)C1=O	779541446	MBFJKKBPMPTZML-ZROIWOOFSA-N	437.847	1.949	50	20	IDGD	
CN(C)[C@H](C(=O)OCC(=O)NNC(=O)c1ccc(C#N)cc1)c1c(F)cccc1Cl	780108965	FYKJEDFPIOJDNI-SFHVURJKSA-N	432.839	1.958	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2ccnn2Cc2cccc(OC)c2OC)nc1	782145770	PBLJJWYVPRVXSP-UHFFFAOYSA-N	426.433	1.434	50	20	IDGD	
Cc1cc(C)c(C)c(S(=O)(=O)N2CCN(S(=O)(=O)CBr)CC2)c1C	782398699	LLRGCVQZWODIDX-UHFFFAOYSA-N	439.397	1.909	50	20	IDGD	
COc1ccc(Cl)cc1S(=O)(=O)NNC(=O)c1cc(OC)c(OC)c(OC)c1	782463249	SMWZUOZKIOYFLE-UHFFFAOYSA-N	430.866	1.998	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)C(=O)Nc1cc(F)cc(Cl)c1	782896222	CMKSLPQVBIWDSF-UHFFFAOYSA-N	427.845	1.172	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2cccc(C(C)(F)F)c2)nc1	783264928	SXGBXUHAVHEEOG-UHFFFAOYSA-N	441.460	1.962	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)CCS(=O)(=O)C1	783429109	ZXXZHUPXIXKCGJ-FQEVSTJZSA-N	428.470	1.487	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2cc(Br)ccc2N2CCOCC2)ncn1	783945094	GGQITKLWUJUJJX-UHFFFAOYSA-N	435.282	1.466	50	20	IDGD	
COc1cc(Cl)ccc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	784210688	ZHOOTYWOJKFTOW-UHFFFAOYSA-N	438.893	1.871	50	20	IDGD	
COc1cccc(NNC(=O)C(=O)Nc2ccc(CC(=O)N3CCSCC3)cc2)n1	784845890	GPNFEFPPJAWOCR-UHFFFAOYSA-N	429.502	1.290	50	20	IDGD	
COc1cccc(NNC(=O)C(=O)Nc2cc(OC)c(OC)cc2Br)n1	784846386	RLKLGWUBUDDBOO-UHFFFAOYSA-N	425.239	1.952	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNc2ccnc(N(C)C)n2)sc2c1CC[C@H](C)C2	784969870	AUUXZBXHMOVKKU-NSHDSACASA-N	446.533	1.987	50	20	IDGD	
COC(=O)CCc1cccc(NC(=O)C(=O)NNC(=O)COc2cc(C)ccc2C)c1	786414837	SKNUCJFJRSTDKD-UHFFFAOYSA-N	427.457	1.574	50	20	IDGD	
COc1ccc(NC(=O)COC(=O)/C(C#N)=C\C2CC2)cc1S(=O)(=O)N1CCOCC1	786679084	JUABKEOJVZEABN-GDNBJRDFSA-N	449.485	1.058	50	20	IDGD	
N#C/C(=C/c1ccc(O)cc1)C(=O)N1CCC(C(=O)NCCCN2CCOCC2)CC1	787387501	MDHOLWLAJPVELY-SILNSSARSA-N	426.517	1.376	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)COc2cccc(I)c2)nc1	787475519	SSNLNHSVKACAPH-UHFFFAOYSA-N	427.198	1.995	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c(C)cc1C	788333387	MGKKNTBOJRRQLD-UHFFFAOYSA-N	435.440	1.675	50	20	IDGD	
O=C(NCc1ccc(S(=O)(=O)NC[C@@H]2CCCO2)cc1)NNc1nc2ccccn2n1	790216363	YFZAWCIVMKGZPR-HNNXBMFYSA-N	445.505	1.013	50	20	IDGD	
NC(=O)c1ccc(SCC(=O)NNC(=O)c2ccc3c(c2)OCCO3)c([N+](=O)[O-])c1	791012323	IMHNGMBXFRQUBJ-UHFFFAOYSA-N	432.414	1.018	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)N1CCOc2c(Br)cccc2C1	792886164	YWCQEAPNMHAPJR-UHFFFAOYSA-N	437.250	1.407	50	20	IDGD	
CCN(CC(=O)Nc1ccc(N2CCOCC2)cc1)C(=O)NNC(=O)c1cccc(C)n1	793227211	PNRZNLQDJVRXOD-UHFFFAOYSA-N	440.504	1.542	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2cc(C(=O)O)c(F)cc2C)cc(OC)c1OC	793350860	RFVWIOVDEHFTJL-UHFFFAOYSA-N	442.421	1.481	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)N1CCC[C@H](C=NNC(=O)Cn2cnc3ccccc32)C1	794472443	WWHTVLOICLNDEG-MRXNPFEDSA-N	442.520	1.902	50	20	IDGD	
CCCCS(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)c2cccc(C)n2)cc1	794600688	HOYXGSSQOOVCRP-UHFFFAOYSA-N	426.520	1.555	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CN2C(=O)N[C@](C)(c3ccc4ccccc4c3)C2=O)n1	795667339	WFNPFLFQWJXXAZ-HSZRJFAPSA-N	431.452	1.771	50	20	IDGD	
C=CCNC(=S)NNC(=O)[C@@]12CCC(=O)N1c1ccccc1C(=O)N2Cc1ccccc1	798304989	PRMFARXLNFZSBP-HSZRJFAPSA-N	449.536	1.847	50	20	IDGD	
CC(C)(C)OC(=O)NCC[C@@H]1CCCN(CC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)C1	799358716	ONJKCANATZGUGH-HNNXBMFYSA-N	449.508	1.983	50	20	IDGD	
O=C(CSc1nnc2c(=O)[nH]c3ccccc3n12)NNC(=O)c1ccc(Cl)cc1	799826345	IOFAPMUEDDXWPS-UHFFFAOYSA-N	428.861	1.778	50	20	IDGD	
CSCC(C)(C)C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	799856902	NTYXCTRLQFQJII-UHFFFAOYSA-N	443.591	1.177	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)N(CCO)CCN2CCOCC2)c(C)n1C[C@@H]1CCCO1	801174650	YMUDMEIGJWYXHL-GYZZIOIESA-N	430.549	1.344	50	20	IDGD	
CS(=O)(=O)N1CCC[C@H]1C(=O)NNC(=O)Nc1ccc(Br)cc1Cl	802042184	NJNSLQAMKRMPQA-NSHDSACASA-N	439.719	1.679	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)[C@@H]2CCCN2S(=O)(=O)c2cccs2)cc1	802118906	PTNKMYMPZYRVKY-HNNXBMFYSA-N	437.547	1.820	50	20	IDGD	
O=C(NCCCOC(F)F)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	802438209	AKHFVUMPRLITAX-UHFFFAOYSA-N	445.430	1.962	50	20	IDGD	
C[C@H]1C[C@H](CCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)C[C@@H](C)O1	802510934	WWTRYSHQQRJJDL-QDMKHBRRSA-N	426.539	1.475	50	20	IDGD	
CCn1c(=O)nc(O)c2c(C(=O)NNc3ccc4c(=O)[nH]ccc4c3)cc(C3CC3)nc21	803431150	QXXXZVAOWSRPKD-UHFFFAOYSA-N	432.440	1.993	50	20	IDGD	
COC(=O)c1ccccc1S(=O)(=O)N1CCC(C(=O)NNc2ncccc2F)CC1	804215888	KAHZCPYPIPWIPM-UHFFFAOYSA-N	436.465	1.551	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NC(=O)NNc1ccc(-n2ccnc2)nn1	806266651	DMSPVIJZIMWBQT-UHFFFAOYSA-N	430.494	1.888	50	20	IDGD	
CN(C)c1nccc(NNC(=O)C(=O)Nc2cc(C(F)(F)F)cc(Br)n2)n1	807017666	GUASPOXUZIOMGO-UHFFFAOYSA-N	448.203	1.801	50	20	IDGD	
COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)NNC(=O)N2CCN(C)CC2)cc1	807383021	YVKUEAUTZJOEED-UHFFFAOYSA-N	429.433	1.998	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2nccnc2C2CCC2)cc1-n1nnnc1C1CC1	807461728	QZSJSOYOQDBMNP-UHFFFAOYSA-N	449.475	1.688	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)c1c(F)cncc1F	807557201	VSMLMIDMMRUEDO-JTQLQIEISA-N	427.433	1.315	50	20	IDGD	
N#Cc1ncn(-c2ccccc2NC(=O)C(=O)NNc2nc(-c3ccc(Cl)cc3)no2)n1	810397705	YJSPZOVLKHQISQ-UHFFFAOYSA-N	449.818	1.924	50	20	IDGD	
O=C(CNS(=O)(=O)c1cccc(Br)c1)NNc1cccc(F)c1[N+](=O)[O-]	811475931	MWCXFHWUUQIFBS-UHFFFAOYSA-N	447.242	1.918	50	20	IDGD	
CCOC(=O)c1ccc(NNC(=O)[C@H](C)NS(=O)(=O)c2ccc(C#N)cc2)cc1C	812722504	SPFBYUVYKAFTHF-AWEZNQCLSA-N	430.486	1.854	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@@H](C)C(=O)NNC(=O)CN1C(=O)[C@H]2CC=CC[C@H]2C1=O	814738704	JZYMIAJXKHQLDN-CWRNSKLLSA-N	433.892	1.823	50	20	IDGD	
CC(C)OC(=O)c1c(NC(=O)C(=O)NNC(=O)[C@H]2CCCO2)sc2c1CC[C@H](C)C2	815779170	USIZWYHGRNNGNP-WCQYABFASA-N	437.518	1.703	50	20	IDGD	
CN(C)NC(=O)Nc1cccc(NC(=O)CN2C(=O)COc3ccc([N+](=O)[O-])cc32)c1	816406177	IAXZIACUNBRPAG-UHFFFAOYSA-N	428.405	1.557	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)[C@H](C)NC(=O)C(C)(C)C)c2ccccc2c1=O	871398725	IOBNFZLXCSROCU-AWEZNQCLSA-N	429.521	1.899	50	20	IDGD	
CC(=O)Nc1cccc(NC(=S)NNC(=O)c2sc(N3CCOCC3)nc2C)c1	913143982	IXZUDZWDITTXRZ-UHFFFAOYSA-N	434.547	1.878	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)[C@@H](C)NS(=O)(=O)c2ccc(Cl)cc2)c1	913450331	YMGNVSBJBZWZIO-CQSZACIVSA-N	439.921	1.850	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)[C@@H]2CCCCN2S(=O)(=O)c2cccs2)cc1	915685017	JYMMBRAWWVCWTG-INIZCTEOSA-N	448.526	1.389	50	20	IDGD	
CCN(CC)CCNC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	915879088	LWWKJIWVTBQXID-UHFFFAOYSA-N	439.563	1.835	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)N[C@@H](CN1CCOCC1)c1ccccc1	916213616	FINAOSFJURSTKR-UZLBHIALSA-N	430.480	1.997	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NCCS(=O)(=O)NCc1ccccc1	916645307	PRHDRBOUJARPPK-AWEZNQCLSA-N	438.481	1.043	50	20	IDGD	
CCOc1ccc(C(=O)NCC(=O)NNC(=O)C(=O)Nc2ccc(C)cc2)cc1OCC	916830357	PHDICCJFKVKDBO-UHFFFAOYSA-N	442.472	1.308	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)COc1ccccc1C#N)c1ccc(S(=O)(=O)N(C)C)cc1	918105728	UYKDFIAXMUSMSC-AWEZNQCLSA-N	445.501	1.279	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCCc2c(F)cccc2F)cc1	918229071	WSQGPIVEGCZFJL-UHFFFAOYSA-N	440.472	1.467	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)c2nc3ncc(Br)cn3n2)cc1	919806539	CZZJKEURYCKNBU-SNVBAGLBSA-N	449.265	1.514	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)c2ccc(N3NC(=O)CCC3=O)cc2)cc1	920288033	LXTFWNONIUVALD-AWEZNQCLSA-N	440.456	1.472	50	20	IDGD	
CCCCN1C(=O)C[C@H](C(=O)NNC(=O)CN2CCCC2=O)[C@@H]1c1ccc(OC)cc1	920436267	ZRQXDEGRUQYBGG-UWJYYQICSA-N	430.505	1.155	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(N2CCOCC2)c(C(=O)NNc2ncccn2)c1	920447135	APLNREVQRTYPIV-UHFFFAOYSA-N	434.522	1.101	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2csc(-c3ccccn3)n2)c1	921055476	LEYHCHJPZMFMSK-UHFFFAOYSA-N	431.499	1.530	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1cc2c(nc1O)CCCC2=O	1116158860	NTPOTENJMNMZIZ-UHFFFAOYSA-N	446.485	1.084	50	20	IDGD	
CN1CCN(c2ncccc2CNC(=O)NNC(=O)c2ccc(Br)cc2)CC1	1251316128	LQKOFJATQHQXLC-UHFFFAOYSA-N	447.337	1.740	50	20	IDGD	
NC(=O)[C@H]1CCCN(c2ccc(C(=O)NNC(=O)Nc3ccc4c(c3)OCO4)cc2)C1	1321789198	OZGGZJZEEULUGK-AWEZNQCLSA-N	425.445	1.584	50	20	IDGD	
C[C@@H](O)CNS(=O)(=O)c1ccc(C(=O)NNC(=O)NCc2ccc(Cl)cc2)cc1	1337094967	YGXUCNGHELMSJR-GFCCVEGCSA-N	440.909	1.143	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)c3ccc4ccoc4c3)CCO2)C1	1779037099	NSSCRQPYLCPWDP-QHCPKHFHSA-N	449.467	1.189	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccc3c(n1)NC(=O)CC3)CCO2	1779295753	WTBPBXARVIKCLA-OAQYLSRUSA-N	446.580	1.261	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(-c4ccccn4)[nH]n3)C2)C1	1779632267	YOMSJYWTQWTFIO-VBKZILBWSA-N	433.896	1.169	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(-n4cccn4)nc3)C2)C1	1779690611	BPBLAIKJHJXCKV-IFXJQAMLSA-N	448.321	1.494	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cncc(C(F)(F)F)c3)C2)C1	1779751139	SESVXULAOCVNDN-RHSMWYFYSA-N	435.830	1.798	50	20	IDGD	
CCc1noc(C)c1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)C2	1779777733	IFEBSDBLNDEINI-VGOFRKELSA-N	449.552	1.046	50	20	IDGD	
COc1ccnc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](F)Cl)C3)c1OC	1780252711	PKJIOXYDHBJPGN-VVFCZOMOSA-N	429.876	1.761	50	20	IDGD	
C[C@@H]1C[C@]1(C)C(=O)N1CC[C@]2(CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2)C1	1781065099	JSPIAJOXZFTRQV-UFNANVBGSA-N	443.972	1.995	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)[C@@H](C)CNC(=O)OC(C)(C)C)CCO2)C1	1781211277	OOLBDQWYKWVWEF-MDOVXXIYSA-N	431.961	1.995	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cccc(S(C)(=O)=O)c3)CCO2)C1	1781211450	UWDQHIPVTDDCET-APWZRJJASA-N	428.938	1.551	50	20	IDGD	
O=C(Cc1cccc(Cl)n1)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781325823	JAYKASWSROIBMO-GDBMZVCRSA-N	434.693	1.798	50	20	IDGD	
Cc1ccc(OCC(=O)N2CCO[C@]3(CCN(C(=O)[C@H](F)Br)C3)C2)cc1	1781328784	ZJXNVHNMEKCRTD-FUHWJXTLSA-N	429.286	1.894	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)n2ccnc2C)C1	1782632157	VVKBHPAQZSDPOY-CNVJLJKISA-N	426.945	1.520	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccn(C(F)F)n3)CCO2)C1	1783349515	MPORLPPJRRSTPQ-BDJLRTHQSA-N	435.269	1.895	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)C(=O)Nc3cccnc3)CCO2)C1	1783350043	ZKFDJSNKMZCDHZ-KDOFPFPSSA-N	439.310	1.024	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc4c(c3C)OCCO4)CCO2)C1	1783874984	JJYFVHYUUYNOOI-IERDGZPVSA-N	438.908	1.464	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1[C@@H]3Sc4ccccc4[C@H]31)CCO2	1783877960	SQUOKXPJKWYJCH-GQXXFKRGSA-N	436.961	1.958	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3c(-c4ccncn4)noc3C)CCO2)C1	1783883855	ZUKPZJVNQDLTLE-XOBRGWDASA-N	449.895	1.137	50	20	IDGD	
CN(C)c1cccc(OCC(=O)N2CCO[C@@]3(CCN(C(=O)C(Cl)Cl)C3)C2)c1	1783942392	NTDBIOICPKZENL-IBGZPJMESA-N	430.332	1.765	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccn4ccnc4c3)C[C@@H]21	1783967926	ZKAMHBYSDDLOET-HJWJTTGWSA-N	449.349	1.959	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)n3cccn3)C[C@@H]21	1783974435	NUZJXDFTKDBROY-QRJUGERDSA-N	427.343	1.455	50	20	IDGD	
Cc1nccn1[C@@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]2C1	1783975039	YKTSSMQYOXNANW-ZAZJUGBXSA-N	441.370	1.763	50	20	IDGD	
COc1cc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)cc(OC)c1C	1785173796	WCZATKCYMCPHND-QRWLVFNGSA-N	426.897	1.055	50	20	IDGD	
C[C@H](Cn1cccn1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)CBr)C[C@@H]21	1785435863	CJLZKNYBYFUFFN-QEOTZNIISA-N	441.370	1.530	50	20	IDGD	
CC(=O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](Br)Cc3ccccc3)C[C@@H]21	1786347999	IEEAEYRTOPTDFZ-XSLAGTTESA-N	437.334	1.561	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3nc[nH]c3[N+](=O)[O-])[C@H]2C1	1787478129	UDCFRLMBCPUUBU-ZGNZKYAMSA-N	434.280	1.148	50	20	IDGD	
Cc1cc(C)n2ncc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)C(Cl)Cl)C[C@@H]43)c2n1	1787909998	AIWUQAFDKHMVBM-QEJZJMRPSA-N	440.331	1.743	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(=O)Nc3cccnc3)[C@H]2C1	1788715658	DXMCFAHELFFEJI-XPVILTJLSA-N	443.331	1.236	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc4ncnn4c3)C[C@@H]21	1788763575	RGDQUIRJKPAXCJ-BZSNNMDCSA-N	445.596	1.103	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnoc3C3CC3)C[C@@H]21)[C@H](F)Br	1789922352	IGVLNLCYEZGCSI-NHULGOKLSA-N	430.274	1.836	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3(Br)CC3)[C@H]2C1	1789931832	VCOVWTOWJKWJKB-IHRRRGAJSA-N	433.419	1.745	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC1(c2ccc(NC(=O)c3nccnc3C(N)=O)cc2)CCC1	1789948706	LDVNROIZHMJJCD-CQSZACIVSA-N	431.880	1.577	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(C)(C)CNC(C)=O)C[C@@H]21	1790958515	SFHYKOFSYWCFMF-JONQDZQNSA-N	446.386	1.302	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nn[nH]c3C(F)(F)F)C[C@@H]21)C(Cl)Cl	1791296359	FLZYLXUQTIXTBI-FXQIFTODSA-N	430.214	1.221	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Cn1cccn1)C2	1792869834	BUDPHIYWJFBANX-DGADGQDISA-N	427.343	1.140	50	20	IDGD	
CN(C)[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](O)CCl)c1ccc(Cl)cc1	1792983173	BRFVHFITCUDEBU-YFUQURRKSA-N	444.359	1.132	50	20	IDGD	
Cc1nn(-c2ccccc2)c(O)c1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Cl	1796362027	WKQZKRHADKVTQK-DLTLXFJOSA-N	436.871	1.624	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C(=O)c1ccccc1)C2	1796889920	OFKQWOWVDYCDIP-DHMPJCMBSA-N	435.484	1.642	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(F)cc1F)C2	1798441966	QLSNRNMXOVMDLQ-BTTYYORXSA-N	429.427	1.529	50	20	IDGD	
COc1cccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)c1C	1798443642	RFICKDUHLFZJHV-MUJYYYPQSA-N	437.500	1.568	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1C[C@@H]1F)C2	1798522708	PEBBOMJVJIHWPS-FETDOPKISA-N	435.408	1.081	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/C(=O)NCc1ccco1	1798571438	CDLNHEHEIHWVBQ-DJWHXZHKSA-N	438.322	1.874	50	20	IDGD	
Cc1ccc(O)c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)CBr)C3)c1	1798839746	XRVRJWWESFOYNM-VWPFQQQWSA-N	425.323	1.935	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(C)c1	1798905468	BFIRRVUHPOTXCM-WCARGJHZSA-N	437.500	1.332	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1CCN(Cc3ccccn3)CC1)C2	1799264285	GZPOFLJVPKNGBX-YHELAOLJSA-N	448.995	1.901	50	20	IDGD	
COc1cc(F)c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCBr)C3)c(F)c1	1799590391	JBRJQSRZWRRKRT-YQYWCBKUSA-N	447.276	1.962	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1cccc(F)c1[N+](=O)[O-]	1799633617	FGMBMIGNGPQHDY-NVVZYBJKSA-N	448.220	1.628	50	20	IDGD	
COc1ccc(C)c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Br)C3)c1	1799638101	HAHQIDRYSYTGNH-NOXHYTERSA-N	429.286	1.897	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](F)Br)c1nc(O)n2c1CCCC2	1800158723	WRQKYOSWAUVKHB-MIJXAVMKSA-N	429.290	1.867	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1ccc(F)nc1)C2	1800639885	BAQZGBHTSIHYGU-BASYENTBSA-N	442.329	1.916	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)Br	1800757300	KNHVOLLMJMBVJO-OEYIWLLWSA-N	435.322	1.629	50	20	IDGD	
CCOc1ncc(Cl)cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](Cl)COC	1800976907	LDIVWBBGLZEASI-VZAMPYOESA-N	446.331	1.591	50	20	IDGD	
COc1ccc(/C=C/C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CCC(=O)NN(C)C)c(F)c1	1802339652	DUJRXBUDVHPYEC-VYMNDLDVSA-N	446.523	1.859	50	20	IDGD	
CC1(C(=O)NC[C@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)CCC1	1802422904	MEVZKMPTJLXGIC-APWZRJJASA-N	436.516	1.590	50	20	IDGD	
COc1ncccc1CCC(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1	1803141593	PXOKHTADWBJNKR-HBFSDRIKSA-N	446.935	1.724	50	20	IDGD	
O=C(c1ncn(-c2cccc(F)c2)n1)N1CCCC2(CCN(C(=O)[C@H](O)CCl)CC2)C1	1807416835	RUVGQGXPZHHVLS-QGZVFWFLSA-N	449.914	1.851	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H](CNC(=O)CCn2ccnn2)[C@H]1c1cccnc1	1813432325	GFLZCIBTMKOPFM-YLJYHZDGSA-N	430.585	1.621	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1CCc2nc(NC(=O)CS(C)(=O)=O)sc2C1	1814325492	QQEUBICSJKTMRY-CLAHSXSESA-N	428.363	1.336	50	20	IDGD	
C[C@@H](CBr)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2CCC(=O)N2)[nH]n1	1814780329	MBAAHPSAFUUWCZ-GVXVVHGQSA-N	426.315	1.711	50	20	IDGD	
CCOC(=O)c1cc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)[C@@H](O)CCl)n[nH]2)ccn1	1814873528	PCVGFAOYJFJSBT-CVEARBPZSA-N	449.895	1.887	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1)c1ccc2nc(CO)[nH]c2c1	1818538443	JIZIDWFZVVSZPV-HOTGVXAUSA-N	446.895	1.684	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)CC[C@H]2CCOC2)[nH]n1	1822417670	LJNKJXOOZLDKMD-DOTOQJQBSA-N	434.541	1.592	50	20	IDGD	
O=C(CC[C@H]1CCOC1)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1823028497	NAXJPBYMEBRWMV-HNAYVOBHSA-N	440.309	1.212	50	20	IDGD	
CC(C)(C)OCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1	1824896094	GCSJDLQLDONJLG-LJQANCHMSA-N	445.564	1.734	50	20	IDGD	
O=C(N[C@H]1CCc2nc(NC(=O)C(Cl)Cl)sc2C1)c1cccn2c(O)nnc12	1826099362	XZBNDRGBABPWCW-ZETCQYMHSA-N	441.300	1.921	50	20	IDGD	
O=C(Cc1ccccn1)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827055348	XWUKCBGFVABDFJ-QFIPXVFZSA-N	435.333	1.237	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC([C@H]2CCCCN2C(=O)[C@H](O)N2CCOCC2)CC1	1828969646	WYEZGRADQILAIY-QUCCMNQESA-N	441.645	1.108	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccnc3S)C2)C1	1830353649	IWNAZGXPKVAOHP-LJQANCHMSA-N	427.954	1.705	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CN2CCN(C)CC2)CC1	1831655325	NRIPBBOGCCONFO-WMZOPIPTSA-N	443.430	1.637	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCn3nc(C)cc3C)C2)C1	1831656674	HEPRIYPNBIURRH-RXVVDRJESA-N	440.972	1.754	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CN2CCN(C)CC2)CC1	1831830539	DUQPQBYIDUZMND-RTBURBONSA-N	429.005	1.107	50	20	IDGD	
CC[S@](=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1	1831873632	QTUUJOQBNOSQQF-PBYQXAPXSA-N	442.626	1.138	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3cccs3)CCO2)C1	1833160674	WEHDBOLBZYISHI-APWZRJJASA-N	430.954	1.391	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3cccs3)CCO2)C1	1833160759	ZHDHHXBSRKMSST-KDOFPFPSSA-N	445.379	1.921	50	20	IDGD	
CC(C)(C)[C@@H](O)C(=O)NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1	1833287884	QCSJDOJTAKKTNE-GJZGRUSLSA-N	436.366	1.656	50	20	IDGD	
Cc1ccc(F)cc1C(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)CCl)CC2)CC1	1833306485	UCAKXRMFNQLIED-IBGZPJMESA-N	425.932	1.919	50	20	IDGD	
CCCNC(=O)CCC(=O)NC1CCN(C2CCN(C(=O)[C@H](Cl)CC)CC2)CC1	1833424378	PXGHHALONXJUJC-GOSISDBHSA-N	429.005	1.882	50	20	IDGD	
CCOc1cnc(C(=O)N2CCO[C@@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)cn1	1833428433	PNCMKGHXEMRATL-FQEVSTJZSA-N	440.928	1.210	50	20	IDGD	
Cc1cc[nH]c1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)CBr)C2)C1	1833538536	VBKKMIVPJQNYLC-RDTXWAMCSA-N	428.327	1.424	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)c3cnsn3)CC2)CC1	1833975295	BKHHWKKIGPANEZ-LBPRGKRZSA-N	444.399	1.754	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1)c1ccc(=O)oc1	1834339359	JUXSOZKQGXTOKP-UHFFFAOYSA-N	440.338	1.610	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)C[C@H]3CCCCO3)C2)C1	1834818926	FIYYIEAIHSBELQ-QAPCUYQASA-N	433.343	1.187	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CCC(N3CCC(NC(=O)[C@H](F)Cl)CC3)CC2)o1	1835080325	JGZASHMGRCKWTB-KRWDZBQOSA-N	428.892	1.958	50	20	IDGD	
CC[C@@H](NC(C)=O)C(=O)N1CCC(N2CCC(NC(=O)CO[Si](C)(C)C)CC2)CC1	1835835153	QXCSDIKACBEVDF-LJQANCHMSA-N	440.661	1.324	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc3nc[nH]c3c1)CCO2	1836932179	JCAOUNCHUNNNID-NRFANRHFSA-N	446.580	1.484	50	20	IDGD	
CC(=O)O[C@@H](C(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1)C(C)C	1837213613	NBNYMUGGGJEIHJ-OXQOHEQNSA-N	432.945	1.296	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(NC(C)=O)o3)CCO2)C1	1837453036	AVXWSDOEMRHLGW-AUUYWEPGSA-N	427.885	1.325	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)c(C)c1	1839026268	PTMGNKYJZGLBCA-IBGZPJMESA-N	431.316	1.877	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)OC(=O)NC(C)C)C2)C1	1839146997	DGPNGCGHQRNPQD-MGPUTAFESA-N	447.960	1.373	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3cccnc3)C2)C1	1839152206	RBACPJCLLPQTKU-VQTJNVASSA-N	444.359	1.707	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)/C=N/N3CCCCC3)C2)C1	1839153110	BEQLOXPRHSANKY-YMQCEMJTSA-N	449.379	1.151	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(F)c3[N+](=O)[O-])CCO2)C1	1839356707	SPCVXYVSPZUIDV-LIRRHRJNSA-N	443.859	1.821	50	20	IDGD	
C=CCOCCCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](Br)CC)CCO2	1839962477	GYOYUSASDRWCQL-APWZRJJASA-N	447.370	1.599	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccoc3Cl)C2)C1	1840034468	MLJLBPGVPCBYAJ-BZNIZROVSA-N	435.702	1.786	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1C[C@H]3CC[C@@H]1O3)CCO2	1840048169	SKDUTZRTVQFZHT-GMKVZWAMSA-N	445.354	1.041	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C34CCC(CC3)CC4)C2)C1	1840156372	NIRPQKYRCOHMJH-BLVDZXQRSA-N	428.957	1.667	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3ccoc3)CCO2)C1	1840516345	KHPIEZQEHYPIPP-RBUKOAKNSA-N	433.332	1.905	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H]1C(=O)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1	1841348423	QVTAATZJKUPEOU-RRFJBIMHSA-N	429.945	1.483	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2ccc(Cl)nn2)C1	1844426698	NPUSCSSDLZOZRV-WSDLNYQXSA-N	429.868	1.081	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC2(CCCN2C(=O)[C@H]2CC[C@@H]3CCC(=O)N3C2)C1	1845074781	FIYIKMBBUAVRKV-ZNMIVQPWSA-N	426.355	1.764	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC12CN(C(=O)[C@H]1C[C@@]13C(=O)Nc1ccccc13)C2	1846178971	DCRYWFQGEGQMHV-HKMRUAMVSA-N	432.318	1.883	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)CCc2cnc3[nH]ccc3c2)C1	1846255664	WFUYKSRBYJVMST-UHFFFAOYSA-N	426.521	1.072	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)Cc1ccc(OC)cc1[N+](=O)[O-])C2	1846363794	DYKQNWDFIBOCDB-OAHLLOKOSA-N	425.869	1.603	50	20	IDGD	
C#CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)[C@H](C)Br)C2	1847071682	WSDRACQBVMIWIJ-UONOGXRCSA-N	442.354	1.890	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H]1ON=C(c2ccccc2)O1	1847499313	WLSHWQNJEHJJDH-CTYUOQFJSA-N	436.306	1.954	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1ccc(OCC(F)(F)F)nc1	14324748	XPDLFYBZNNHOIB-UHFFFAOYSA-N	445.423	1.699	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NN[C@@H](C(=O)N(C)C)c2ccccc2)c1	15467766	NZLQYIYFIIBOHN-LJQANCHMSA-N	432.546	1.781	50	20	IDGD	
CCCn1nc(C(=O)NNS(=O)(=O)c2ccc(C(C)=O)cc2)c2ccccc2c1=O	16095549	SSIBLGWFFPOQAX-UHFFFAOYSA-N	428.470	1.632	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(N2CCCC2=O)cc1)c1cc(Br)c[nH]1	28808916	NDUFCEOCMLSTAA-UHFFFAOYSA-N	427.280	1.527	50	20	IDGD	
O=C(NNc1nc(-c2ccncc2)no1)c1ccc2c(c1)S(=O)(=O)N(C1CC1)C2=O	726370859	NIJPPFAGZRAPOY-UHFFFAOYSA-N	426.414	1.195	50	20	IDGD	
COc1ccc(CN2C[C@@H](C(=O)NNC(=O)[C@@H](C)Oc3ccccc3F)CC2=O)cc1	726497530	BWHHBQGCLXTSIP-ZBFHGGJFSA-N	429.448	1.798	50	20	IDGD	
COCc1cccc(S(=O)(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)c1	727350150	HUKSRSNIORCYGP-UHFFFAOYSA-N	430.486	1.747	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(=O)n(CC(=O)NNC(=O)CCCc2ccccc2)c1	727717080	UEAALOGIEBJWAD-UHFFFAOYSA-N	448.545	1.049	50	20	IDGD	
Cc1c(C(=O)NNC(=O)Cc2cccnc2)nnn1C1CCN(C(=O)OC(C)(C)C)CC1	728850314	LZFOGZZKJMMYKS-UHFFFAOYSA-N	443.508	1.557	50	20	IDGD	
COCCN(Cc1cccs1)C(=O)NNC(=O)c1csc(N2CCOCC2)n1	728944659	IQDWIZOKRWPETB-UHFFFAOYSA-N	425.536	1.544	50	20	IDGD	
C[C@H]1Oc2c(ccc(Cl)c2Cl)C1=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O	729932971	SSADZKBGNKXCSG-SSDOTTSWSA-N	444.300	1.179	50	20	IDGD	
CC(C)Cn1c(=O)nc(O)c2c(C(=O)NNC(=O)Cc3cc[nH]n3)cc(C(C)C)nc21	730091013	XLJGNAXEJHUIQZ-UHFFFAOYSA-N	427.465	1.003	50	20	IDGD	
C[C@@H](CN1CCN(C)CC1)NC(=O)NNC(=O)[C@H](C)Oc1cccc(Br)c1	730130844	NMWRXLVXTKTPNR-KBPBESRZSA-N	442.358	1.183	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)NCc1cccc(NC(=O)c2ccccn2)c1	730821957	AQZZSNFIOMLMGF-UHFFFAOYSA-N	435.440	1.949	50	20	IDGD	
CC[C@H](NC(=O)NNC(=O)COc1ccccc1O)c1ccccc1OCC(=O)NC	730902294	HBYFKYKUVNHCNE-HNNXBMFYSA-N	430.461	1.378	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)c2ccoc2COc2ccc(C=O)cc2)c2ccccc2c1=O	731597655	IYUQOCUHSSIYNI-UHFFFAOYSA-N	446.419	1.993	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1cc(O)nc2ccc([N+](=O)[O-])cc12	732287263	SWXYUNMVVYBZCF-UHFFFAOYSA-N	437.416	1.316	50	20	IDGD	
C[C@@H]1Cc2ccccc2N1Cc1occc1C(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1	732755163	PIJQPQOXGCGZPU-UKRRQHHQSA-N	432.502	1.362	50	20	IDGD	
C[C@H](c1nc(-c2cccs2)no1)N1CCN(C(=O)NNC(=O)Cc2cccnc2)CC1	732995671	QIARKBHBGLAJCC-CQSZACIVSA-N	441.517	1.855	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)NNC(=O)c1nn(-c2ccccc2)cc1O	733349514	AFQXBHCXRLVDSG-UHFFFAOYSA-N	446.427	1.053	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2cc(C(=O)NNc3cnccn3)ccc2Cl)C[C@@H](C)O1	734245493	IIYHAFOBHCCWPO-TXEJJXNPSA-N	425.898	1.685	50	20	IDGD	
Cc1cc(NNC(=O)[C@H]2CC(=O)N([C@@H]3CCS(=O)(=O)C3)C2)ccc1Br	734254951	RJMTWYXQNWLJDP-WCQYABFASA-N	430.324	1.236	50	20	IDGD	
CCOCCCN1CC[C@@H](NC(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)[C@@H](C)C1	734685806	IBYIVEIBZBCCFD-PKOBYXMFSA-N	433.553	1.709	50	20	IDGD	
Cc1ncc2c(n1)CCC[C@@H]2NC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	734952686	TWQQRWAQPAYLGN-NRFANRHFSA-N	437.548	1.705	50	20	IDGD	
CS(=O)(=O)CC[C@H](NS(=O)(=O)c1ccccc1)C(=O)NNc1c(F)cccc1F	735697781	HDUSEIMTCAABAN-HNNXBMFYSA-N	447.485	1.190	50	20	IDGD	
C[C@@H]1OC(C)(C)N(C(=O)OC(C)(C)C)[C@@H]1C(=O)NNC(=O)[C@@H]1COc2ccccc2O1	735837508	OYLXUCAJUYHXCE-RCBQFDQVSA-N	435.477	1.734	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)CCN2C(=O)[C@@H]3CCCC[C@H]3C2=O)cc1C	736735621	VLPNRXXQGINWGL-ZIAGYGMSSA-N	449.529	1.488	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@@H](CCCO)c2ccccc2)cc1	741093647	BMWDGUOPQNPEHX-IBGZPJMESA-N	448.545	1.460	50	20	IDGD	
CC(C)CN1C(=O)/C(=C/NNC(=O)c2cccc(Br)c2)C(=O)NC1=S	742216150	SSTMTEXEFLCEFR-KPKJPENVSA-N	425.308	1.467	50	20	IDGD	
CCOc1ccc(/C=C(\C#N)C(=O)N2CCN(S(=O)(=O)Cc3ccon3)CC2)cc1	742804571	FHZVGRRCRGALIP-GHRIWEEISA-N	430.486	1.654	50	20	IDGD	
COc1cccc(O[C@@H](C)CNC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)c1	743509618	IEYGFPXUIATNRV-ZDUSSCGKSA-N	449.533	1.708	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)NCCCN2C(=O)COc3ccccc32)cc1	743640532	OQZMYFCBVGSQBW-UHFFFAOYSA-N	426.473	1.774	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)c2ccc([N+](=O)[O-])cc2Br)cc1	745071557	FZVHFULXVOZAPA-UHFFFAOYSA-N	447.201	1.847	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)NC[C@@H](C)CN2CCOCC2)cc1Cl	745833917	GNDZTYHIBBXRBC-GFCCVEGCSA-N	429.905	1.661	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)c2cnn(CC(=O)NC3CCCCC3)c2)nc2ccccc21	746579543	HWUAQYAZDOIGKM-UHFFFAOYSA-N	437.504	1.222	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)NCCOc1ncccc1C(F)(F)F	746702215	MWXIKVDZCMGXME-UHFFFAOYSA-N	428.367	1.897	50	20	IDGD	
COc1ncnc(N)c1C=NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	747625128	DWTFXCFKBJHFLG-UHFFFAOYSA-N	432.487	1.694	50	20	IDGD	
CN(C)C(=O)CCCNC(=O)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1	747984038	MOWIMXBTAZEKGU-NRFANRHFSA-N	437.544	1.812	50	20	IDGD	
CC(C)(C)CC(=O)N1CCC[C@@H]1C(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	748391903	ZUPXIAXMTVJFLO-OAHLLOKOSA-N	434.449	1.326	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1)NNC(=O)c1cc2ccccc2o1	749475064	WCVRDXZVQBXNPN-UHFFFAOYSA-N	432.414	1.471	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1)N1CCSCC1	750914827	RCQSDTHTSXVINC-INIZCTEOSA-N	440.013	1.042	50	20	IDGD	
Cc1nc(-c2ccccc2)oc1C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	750942898	BXSXLCMRGNURKV-KRWDZBQOSA-N	437.408	1.794	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc2[nH]c(=O)ccc2c1)c1ccc(Br)s1	751143306	YSZFXBPPQFDQFO-UHFFFAOYSA-N	428.289	1.975	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1)N[C@H]1CC[C@H](O)CC1	753712915	AXMUULQIVBDVIP-IYARVYRRSA-N	446.529	1.413	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)[C@H]2CCCCS2(=O)=O)cc(OCC)c1OCC	753982100	VFVUOAJNTCNANY-MRXNPFEDSA-N	428.507	1.611	50	20	IDGD	
C[C@H](NS(=O)(=O)c1cnn(C)c1)C(=O)NNC(=O)c1cc2c(s1)CCCCCC2	755052846	XVSDDYBZLZOELJ-LBPRGKRZSA-N	439.563	1.269	50	20	IDGD	
COCCN(C)S(=O)(=O)[C@H]1CCCN(C(=O)NNC(=O)c2cc3ccccc3o2)C1	755264694	HXXYAJPINJLBPT-HNNXBMFYSA-N	438.506	1.160	50	20	IDGD	
O=C(CCc1ccccc1)NNC(=O)Nc1cccc(S(=O)(=O)N2CCOCC2)c1	755352914	BAIVIROUBJRCFY-UHFFFAOYSA-N	432.502	1.493	50	20	IDGD	
COc1c(F)cc(NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1F	756148744	NJSDXIZOHOGOEO-UHFFFAOYSA-N	442.444	1.755	50	20	IDGD	
CCN1CCN(C(=O)c2ccc(NC(=O)NNC(=O)c3ccc(Cl)nc3)cc2)CC1	756252584	HXVVFQKYVNMUFO-UHFFFAOYSA-N	430.896	1.979	50	20	IDGD	
CC(C)CN1C(=O)C(=NNC(=O)Cc2cc(O)nc(O)n2)c2cc(Br)ccc21	756895769	WFGRMVIOIMRSSD-UHFFFAOYSA-N	448.277	1.716	50	20	IDGD	
C[C@H](NC(=O)OC(C)(C)C)[C@H]1CCCN(CC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)C1	758781153	VWVYSLMUKPQRRK-HOCLYGCPSA-N	449.508	1.981	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CN2CCNC(=O)[C@H]2c2ccc(C(F)(F)F)cc2)cc1	759329948	SGOHXEIOTJPPMX-GOSISDBHSA-N	434.418	1.948	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)c1cc([N+](=O)[O-])ccc1SC1CCCC1	763437004	DEMYRJWXJKKZHI-NSHDSACASA-N	427.504	1.825	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(Br)c(F)c1	763441747	IWIIWJFBURXDCQ-UHFFFAOYSA-N	425.170	1.896	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1ccc(Br)cc1F	763628277	IHTUNOHAENQVIH-UHFFFAOYSA-N	434.225	1.944	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2cc(C)n(-c3cccc(F)c3)n2)c1	763629814	IMGQWHOFJQONQK-UHFFFAOYSA-N	425.420	1.793	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2ccc(CCS(C)(=O)=O)cc2)c1	763650901	SMXVYEVMEYLNJO-UHFFFAOYSA-N	447.513	1.055	50	20	IDGD	
CCc1onc(C)c1NC(=O)C(=O)NNC(=O)COc1ccc(Br)cc1	763696676	YGEYALVQIIAQNE-UHFFFAOYSA-N	425.239	1.473	50	20	IDGD	
O=C1C[C@H](c2cccc(NC(=O)C(=O)NNC(=O)CSc3ccc(Cl)cc3)c2)CN1	763737396	XUJLJVXGQUPOGI-ZDUSSCGKSA-N	446.916	1.822	50	20	IDGD	
CNC(=O)Cn1ccc2ccc(NC(=O)C(=O)NNC(=O)c3cccc(Cl)c3)cc21	763748684	XXHJQNXFXAEZBT-UHFFFAOYSA-N	427.848	1.440	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2ccc(-c3ncco3)cc2)c2ccccc2c1=O	763787023	USRIFNYGEDUTCX-UHFFFAOYSA-N	446.423	1.471	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)C(=O)Nc2cccc(C(F)(F)F)c2)c2ccccc2c1=O	763787115	WBETUEXWROYOJF-UHFFFAOYSA-N	433.346	1.352	50	20	IDGD	
CC(C)n1cnnc1-c1ccccc1NC(=O)C(=O)NNC(=O)COc1ccccc1C#N	763808356	LYDBGYSRYYPZTP-UHFFFAOYSA-N	447.455	1.563	50	20	IDGD	
COCC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)cc1	763848413	HGUHAPTUFLRHJH-OAHLLOKOSA-N	442.472	1.442	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cccc(NC(=O)OC)c2)cc1	763859749	FSUXKLCGNSLTKO-CYBMUJFWSA-N	444.444	1.817	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)C(=O)Nc2ccc(NC(=O)CN(C)C)cc2)cc1	763896352	LSLQMANGMJLZHW-UHFFFAOYSA-N	443.529	1.373	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cnn(C)c2C(F)F)ccc1OC(C)C	763915650	BXFFWPNDSXQQOS-UHFFFAOYSA-N	425.392	1.553	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)C(=O)Nc1ccccc1Br	763998122	LQBUCNHMORYPTL-UHFFFAOYSA-N	430.056	1.939	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)NC(C)C)cc2C)c1O	764132227	MDSCTNXQKRNXOU-UHFFFAOYSA-N	428.445	1.247	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1cc(NC(=O)C(C)C)ccc1C	764137126	ZGWQWDDVONEVTE-UHFFFAOYSA-N	426.473	1.927	50	20	IDGD	
CNC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)c2c(Cl)cccc2Cl)cc1	764221653	WOOMTBVZGHPEEE-UHFFFAOYSA-N	439.255	1.518	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2O)n([C@H]2C[C@H]3CC[C@H]2C3)n1	764276917	FEJVYSUGCUEYIA-KKUMJFAQSA-N	427.461	1.423	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1NC(=O)C(=O)NNC(=O)COc1ccccc1O	764277740	NITIZTGWTXIYPG-UHFFFAOYSA-N	426.454	1.989	50	20	IDGD	
CCOCC(=O)NNC(=O)C(=O)Nc1ccc(OC(F)(F)F)cc1Br	764318564	BNYLGDBBGMCJQR-UHFFFAOYSA-N	428.161	1.470	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)C(=O)Nc1ccc(CCC(=O)N2CCCC2)cc1	764319534	MBVWIMSJMOQPDB-UHFFFAOYSA-N	440.475	1.709	50	20	IDGD	
CCN(CC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)CC(=O)Nc1c(C)cccc1C	764334522	ZPURTUONUQLIMR-UHFFFAOYSA-N	427.461	1.933	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)C(=O)Nc1ccc(=O)n(Cc2ccccc2Cl)c1	764353417	GLWPLLBGCMXJOY-UHFFFAOYSA-N	439.859	1.274	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc(-n4ccnc4)nc3)n[nH]2)cc1C	764386502	ISUQJRBRXQWDRH-UHFFFAOYSA-N	444.455	1.674	50	20	IDGD	
Cc1onc(-c2ccncc2)c1C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	764527654	KBQSRCNVZSHFAF-UHFFFAOYSA-N	429.458	1.370	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCC2C3CC4CC(C3)CC2C4)c1	764532206	LVJBPTQWGKSNDQ-UHFFFAOYSA-N	434.562	1.953	50	20	IDGD	
COc1ccc(C=NNC(=O)CN2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)s1	764820082	VHJJYQODUILVSX-UHFFFAOYSA-N	436.559	1.522	50	20	IDGD	
COc1ccccc1C(C)=NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1	764820371	XCMSHAKGMGRVSM-UHFFFAOYSA-N	444.557	1.850	50	20	IDGD	
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c1C	765047864	DGHGOHPNAIFPCN-UHFFFAOYSA-N	427.460	1.238	50	20	IDGD	
C[C@@H]1CN(C(=O)NNC(=O)CNC(=O)c2cccs2)[C@H](C)CN1Cc1ccccc1	766528472	JDUUGBJYAWGWNN-HZPDHXFCSA-N	429.546	1.814	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cc(Br)cn3C)CC2)cc1	766648906	YHYPNNMMENEMOW-UHFFFAOYSA-N	448.365	1.675	50	20	IDGD	
COc1ccc(CN2CCN(CC(=O)NNC(=O)Cc3ccccc3C)CC2)cc1F	766836469	PBAHHNGBAFLHAX-UHFFFAOYSA-N	428.508	1.650	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)c1csc(S(C)(=O)=O)c1	767084303	PHAWYRUJMIFFPC-UHFFFAOYSA-N	431.561	1.985	50	20	IDGD	
Cc1nn(-c2ccccc2)c2sc(C(=O)NNC(=O)CN(C)CC(=O)NC(C)C)cc12	767654629	UMJPRUYIZGKHER-UHFFFAOYSA-N	442.545	1.613	50	20	IDGD	
CC(C)NC(=O)c1ccc(C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1	767794051	AUKRVCRVBIJUTH-UHFFFAOYSA-N	428.401	1.351	50	20	IDGD	
COc1cc(C)cc(C(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)c1O	768291535	RSXOBEBXJYGQJT-UHFFFAOYSA-N	426.517	1.596	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCCSCC(F)(F)F	769708508	ISFIUAXUAAJBGO-UHFFFAOYSA-N	427.474	1.528	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1)Nc1ccncn1	770764535	ZMCLHRDUORFFTK-UHFFFAOYSA-N	426.458	1.422	50	20	IDGD	
COc1cccnc1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	771794845	YWWLOZUUDGCPHG-UHFFFAOYSA-N	433.490	1.731	50	20	IDGD	
COc1c([N+](=O)[O-])ccc(C=NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1O	773020280	ZDTHETAKPPXYAM-UHFFFAOYSA-N	448.457	1.857	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNS(=O)(=O)c2ccc(C(=O)OC)c(F)c2)cc1	773249039	DBQQGSLESZOVPN-LBPRGKRZSA-N	440.449	1.788	50	20	IDGD	
Cc1cc(-n2cncn2)ccc1C(=O)NNC(=O)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	773412390	DUNYTIKRDXUBKJ-OAHLLOKOSA-N	428.493	1.984	50	20	IDGD	
O=C(NC[C@@H]1CCCO1)Nc1ccc(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2)cc1	773645166	WWNAPTHFLWAELD-KRWDZBQOSA-N	442.432	1.977	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2)c(C)c1S(=O)(=O)NC1CC1	773656085	IHJJGFLMTKBJFP-UHFFFAOYSA-N	447.473	1.734	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2c(F)cccc2F)cc1S(=O)(=O)NC1CC1	773708461	CXZHKJFEDUHCSB-UHFFFAOYSA-N	440.428	1.496	50	20	IDGD	
COC(=O)c1cc(OC)c(OC)cc1NC(=O)C(=O)NNC(=O)c1ccc(C)c(F)c1	773888246	HYOJWSXCGXXIIC-UHFFFAOYSA-N	433.392	1.338	50	20	IDGD	
COC(=O)CCN1CCN(C(=O)NNC(=O)c2ccc(Br)s2)[C@H](C)C1	774664532	ZEISLAWMQBAFOI-SNVBAGLBSA-N	433.328	1.434	50	20	IDGD	
COc1ccc(SC)c(OC)c1C(=O)OCC(=O)NNC(=O)Cc1nc(C)cs1	775959125	NWFZJUNPQGYAJY-UHFFFAOYSA-N	439.515	1.738	50	20	IDGD	
CC(C)N1C(=O)C[C@@H](C(=O)NNC(=O)C(=O)N2CCCC2)[C@@H]1c1ccc(Cl)c(F)c1	776472942	FRKHGCLGWZWDGQ-DYVFJYSZSA-N	438.887	1.547	50	20	IDGD	
CCO[C@@H]1C[C@H](NC(=O)NNC(=O)c2nnc(O)c3ccccc23)[C@H]1Oc1ccccc1	776535721	WZCAMDXAJIQIOV-YQVWRLOYSA-N	437.456	1.904	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)NC[C@H](c2ccc(F)cc2)N2CCOCC2)c1	776608513	IWUZPFRHUZWYCS-LJQANCHMSA-N	436.509	1.929	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)NCc1nn(-c2ccccc2)c2c1CCC2	778613665	PKALEILAGMQOTA-UHFFFAOYSA-N	428.493	1.716	50	20	IDGD	
Cn1cc(-n2cc(C(=O)NNc3ccc([N+](=O)[O-])cc3Br)ccc2=O)cn1	779145975	NDBRIUJUGKGQMX-UHFFFAOYSA-N	433.222	1.999	50	20	IDGD	
O=C(Cn1cc(NC(=O)NNc2ccc([N+](=O)[O-])cc2Br)cn1)NC1CC1	779435051	IZWPHIMPQFPHTP-UHFFFAOYSA-N	438.242	1.981	50	20	IDGD	
COc1cc(S(=O)(=O)NNC(=O)c2ccccc2O)c(OC)cc1Br	780365714	OWFUPDJMHXEWFC-UHFFFAOYSA-N	431.264	1.795	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)[C@H]3CCC(C)(C)C3)CC2)cc1	781711059	VDFRTUMHUNWHOJ-KRWDZBQOSA-N	436.578	1.275	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNc2ncncc2Cl)cccc1S(=O)(=O)NC(C)(C)C	782158646	GOELQOXJJRGCQB-UHFFFAOYSA-N	440.913	1.597	50	20	IDGD	
CC(C)N1C(=O)C[C@H](NC(=O)NNC(=O)C(=O)NC2CC2)[C@H]1c1ccc(Cl)c(F)c1	783320020	JCVKDIMSYQSDKE-GOEBONIOSA-N	439.875	1.139	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2ccc(Oc3ccc(Cl)cn3)cc2)CCS(=O)(=O)C1	783423977	CFHTXZWYEFWHOG-SFHVURJKSA-N	438.893	1.664	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2ccccc2-c2cc(F)c(F)c(F)c2)CCS(=O)(=O)C1	783426668	JBWFFHMODQZTMW-LJQANCHMSA-N	441.431	1.907	50	20	IDGD	
NC(=O)C1CCN(Cc2cccc(NC(=O)C(=O)NNc3cc(F)c(F)c(F)c3)c2)CC1	785086704	HBSQMJFSPVJVAB-UHFFFAOYSA-N	449.433	1.883	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)N1C[C@@H]2CCCN2c2ccccc21	785330777	LZNKFWJJRHDKHW-AWEZNQCLSA-N	444.513	1.557	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)N(C)Cc1cccc(Br)c1OCC(C)(C)O	786450306	DJWGYTWMYNGIKN-LBPRGKRZSA-N	430.343	1.977	50	20	IDGD	
CCS(=O)(=O)CCn1cc(C)c(NC(=O)NNC(=O)c2cc(C)nc3ccccc23)n1	786730695	NMSSHOZIVUCBRN-UHFFFAOYSA-N	444.517	1.949	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2cccc3c2OCC[C@@H]3N(C)C)n1	789772094	ZIPBEFZTHNFUHZ-INIZCTEOSA-N	427.509	1.790	50	20	IDGD	
O=C(NNC(=O)[C@H]1OCC[C@H]1c1ccccc1)C(=O)Nc1ccc(NC(=O)C2CC2)nc1	789811549	DMMLHEAXGLZOHD-WMZOPIPTSA-N	437.456	1.089	50	20	IDGD	
COc1ccc(OC)c(C2=NO[C@@H](C(=O)NNC(=O)CCNC(=O)OC(C)(C)C)C2)c1	792659186	ZOZKLEZIKKFRAT-MRXNPFEDSA-N	436.465	1.259	50	20	IDGD	
CC(=NNC(=O)c1ccc(O)c(O)c1)c1ccc(S(=O)(=O)NCCCC(=O)O)cc1	794556060	PEXLLYLCXNHSAY-UHFFFAOYSA-N	435.458	1.395	50	20	IDGD	
COC(=O)c1cc(Br)cc(S(=O)(=O)NNC(=O)c2cccc(C)n2)c1	794600360	BCHPQOJOMJHXRB-UHFFFAOYSA-N	428.264	1.562	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)c2ccc(CSc3nncn3C)cc2)cn1	795280131	CPSDBSAKALMPQM-UHFFFAOYSA-N	434.503	1.134	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(Cl)c(CN3CCOCC3)c2)c(O)c1	797535921	RTMFWQCPWZXVIY-UHFFFAOYSA-N	446.891	1.586	50	20	IDGD	
CCNC(=O)N(C)c1cccc(NC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])c1	797664835	VVCYHKPADOENBQ-UHFFFAOYSA-N	430.421	1.992	50	20	IDGD	
Cc1cc(O[C@@H]2CCN(C)C2=O)ccc1NC(=O)C(=O)NNC(=O)c1c[nH]c2ccccc12	799257925	WJRFFSCUBWIPEG-LJQANCHMSA-N	449.467	1.486	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)C(=O)Nc1ccnc(OCc2ccccc2)c1	800622444	LORKGFSWAYEDJA-UHFFFAOYSA-N	438.415	1.965	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)[C@@H]2CC[C@H](C(F)(F)F)NC2=O)c(OC)cc1Cl	802081468	PUDLRJUVZUCDEJ-JMCQJSRRSA-N	438.790	1.967	50	20	IDGD	
COc1ccc(Cl)c(NC(=O)NNC(=O)CN2C(=O)c3ccccc3S2(=O)=O)c1	802115737	CZRSODULNLQEPZ-UHFFFAOYSA-N	438.849	1.346	50	20	IDGD	
O=C(CNS(=O)(=O)c1c[nH]c2ncccc12)NNc1ccc(Br)c(F)c1	803116368	JTMAFSKXSYBTRX-UHFFFAOYSA-N	442.270	1.886	50	20	IDGD	
O=C(NNc1ccc2c(=O)[nH]ccc2c1)c1cccc(CN2CCS(=O)(=O)CC2)c1	803430354	ZWVYYNLQCGEEHZ-UHFFFAOYSA-N	426.498	1.515	50	20	IDGD	
O=C1CC[C@]2(C(=O)NNc3ccc(-n4ccnc4)nn3)N1c1ccccc1C(=O)N2C1CC1	804958772	MSFSWKSQGGBGIA-JOCHJYFZSA-N	444.455	1.247	50	20	IDGD	
COC(=O)c1cc(Br)c(OC)cc1NC(=O)C(=O)NNC(=O)C1CCCC1	806976310	MSGOARMZRSLVJE-UHFFFAOYSA-N	442.266	1.520	50	20	IDGD	
O=C(NNc1nccnc1C1CCC1)C(=O)Nc1cc(F)c(N2CCOCC2)cc1F	807461480	GIYYKIDJRUUKGG-UHFFFAOYSA-N	432.431	1.941	50	20	IDGD	
CCOC(=O)C1CCN(S(=O)(=O)NNC(=O)CC23CC4CC(CC(C4)C2)C3)CC1	808069308	SWSBIGQFRLIJRP-UHFFFAOYSA-N	427.567	1.734	50	20	IDGD	
CN(NC(=O)[C@H]1C[C@@H](c2ccccc2)OC1=O)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	809763124	KALXNPFHIRLNJF-SJORKVTESA-N	446.504	1.927	50	20	IDGD	
Cc1nc2ccc(NC(=O)C(=O)NNC(=O)COc3ccccc3-c3ccccc3)cn2n1	810385288	QKRRVXVCDOJNSE-UHFFFAOYSA-N	444.451	1.870	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3nc(C)nn3c2)cc1OC	810386378	WWTGJRYMDZBODG-UHFFFAOYSA-N	426.433	1.235	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)CNS(=O)(=O)c2ccc(Cl)cc2)nc1C	810931104	AVHIIWAVTQVZLZ-UHFFFAOYSA-N	427.870	1.037	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNS(=O)(=O)c1ccc(Oc2ccc(Cl)cc2)cc1	811683456	UJVNHVLYEINEPC-LLVKDONJSA-N	447.922	1.380	50	20	IDGD	
CCCCN(C)C[C@@H](C)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	812507592	UNINZIOVGKOACW-MRXNPFEDSA-N	439.582	1.536	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2cccc(-c3ncco3)c2)cc1	813033690	GWKVOXZGIRMPDK-UHFFFAOYSA-N	429.458	1.674	50	20	IDGD	
O=C(NCC1CC(F)(F)C1)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	813770193	NPQDYHDSBUBXQA-UHFFFAOYSA-N	430.477	1.851	50	20	IDGD	
CC(=NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1)c1cccc(O[C@@H](C)C(=O)O)c1	814746384	FNOKSRIJPVCMGM-NSHDSACASA-N	439.877	1.993	50	20	IDGD	
COc1cc(C=NNC(=O)Nc2ccc(S(N)(=O)=O)cc2)cc(Br)c1O	814964539	XSXBWVVUEYMULF-UHFFFAOYSA-N	443.279	1.966	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2nc(CC(F)(F)F)cs2)cc1	815565313	JXKTVMSWHISYOP-UHFFFAOYSA-N	427.364	1.284	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)cc1)C1CC1	815565764	ZHVOUNXDRRGWFP-UHFFFAOYSA-N	449.511	1.741	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)C(=O)Nc1ccc([C@@H]2CCOC2)cc1	815567141	PUHNFQAFQUDRMR-OAHLLOKOSA-N	435.440	1.482	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCc2nncn2C1)C(=O)Nc1cc(Cl)ccc1OC(F)(F)F	815692000	HICOGIIZPVBFFJ-MRVPVSSYSA-N	446.773	1.179	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)[C@H]2CCCN(C(=O)c3ccc(F)cc3)C2)c1	825801068	JJOTUBDGNGYHCA-INIZCTEOSA-N	428.464	1.946	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)[C@H]1CC(=O)N(Cc2ccccc2Cl)C1	863998958	GKAWJOMSNKGLPA-HNNXBMFYSA-N	431.876	1.924	50	20	IDGD	
CN1C(=C(C#N)C(=O)COC(=O)[C@H]2CC(=O)N(CC(F)(F)F)C2)N(C)c2ccccc21	914969258	KUXSVPZGWZIXHN-LBPRGKRZSA-N	436.390	1.831	50	20	IDGD	
O=C(NCCn1ccnc1)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	915905260	CVGPUJFYGNVKMK-UHFFFAOYSA-N	434.503	1.390	50	20	IDGD	
CC(=NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1ccc(CC(=O)O)cc1	915939470	QOAAJSJOBIMRNX-UHFFFAOYSA-N	445.497	1.489	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCc2cccc3cccnc23)c1	916240605	QAEFOCJPPDZCCR-UHFFFAOYSA-N	441.513	1.672	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)NCC(=O)N2CCCCC2)cc(OCC)c1OCC	916473567	QRXLQMLATUKGJP-UHFFFAOYSA-N	436.509	1.839	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)nnn1-c1cccc(Cl)c1	917665237	LZCBEOPKOFLJPY-UHFFFAOYSA-N	433.877	1.707	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@@H](C)S(=O)(=O)c2ccc(F)cc2)c2ccccc2c1=O	917915010	FWUYEDAMDGAZOI-GFCCVEGCSA-N	446.460	1.179	50	20	IDGD	
COC1(C(=O)NNC(=O)c2nnc(O)c3ccccc23)CCN(C(=O)OC(C)(C)C)CC1	917915509	KTTAUHQRTGDLMB-UHFFFAOYSA-N	445.476	1.513	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)N(C)CC(=O)N[C@H]2CCS(=O)(=O)C2)c(C)n1CC(C)C	919747022	XJIORFAEZVYEGU-MAYQHFBPSA-N	434.562	1.430	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)cc1NC(=O)c1ccccc1F	919884887	IAPQODGKPYRORB-AWEZNQCLSA-N	448.476	1.518	50	20	IDGD	
Cc1ccc(-c2nn(-c3ccccc3)cc2C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)o1	919885710	QTETXBDKLHGDBS-CQSZACIVSA-N	443.485	1.572	50	20	IDGD	
Cc1ccc(C)n1-c1ccc(C(=O)NNC(=O)N[C@@H]2CCCN(S(C)(=O)=O)C2)cc1	920238723	JODFFIDDBBAARX-QGZVFWFLSA-N	433.534	1.462	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)c2ccc(-n3cncn3)c([N+](=O)[O-])c2)o1	920248476	HJOPDSFXHDBCAT-UHFFFAOYSA-N	427.421	1.685	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)NCc2cccc(C(=O)NC[C@H]3CCCO3)c2)c1	920346816	DZXYJHWAOQMHGV-HXUWFJFHSA-N	439.516	1.806	50	20	IDGD	
COc1ccc(C(=O)Nc2cccc(C=NNC(=O)N[C@@H]3CCS(=O)(=O)C3)c2)cc1	920381780	UGMSQPPOGRZLHW-QGZVFWFLSA-N	430.486	1.768	50	20	IDGD	
COCCN1CCC(NC(=O)NNC(=O)COc2ccc(Br)cc2)CC1	920814191	COXJBBXLBMDKNA-UHFFFAOYSA-N	429.315	1.269	50	20	IDGD	
CC(C)(C)c1cc(NC(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)n(Cc2ccccc2)n1	1116582476	OKKITQXNHJBBSG-HNNXBMFYSA-N	433.534	1.816	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)c1ccc(-n2cccn2)c(F)c1	1251640315	GRUGMJKLCMQIKN-UHFFFAOYSA-N	436.491	1.985	50	20	IDGD	
O=C(NNC(=O)c1ccn(-c2ccccc2C(F)(F)F)n1)N[C@H]1CCS(=O)(=O)C1	1320392577	UKJRLFFIDFHCKJ-JTQLQIEISA-N	431.396	1.022	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@]2(F)CCOC2)c1	1323467119	XDHOJKMIJDIAMV-IBGZPJMESA-N	437.449	1.386	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4c(c3)CCCC4=O)C2)C1	1777927324	GHAKLYASFXXVCG-PGRDOPGGSA-N	434.920	1.903	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@](C)(C(=O)N2CC[C@]3(CN(C(=O)[C@H](F)Cl)CCO3)C2)C1	1778179552	QWOSUHHYLRLCHL-GKCIPKSASA-N	447.935	1.998	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc([N+](=O)[O-])cc4c3OCC4)C2)C1	1780093100	BETGKWBTCAXFNK-UZLBHIALSA-N	437.880	1.991	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc[n+]([O-])c1)C2	1780710206	LRMUYLGVMROTPM-ATZDWAIDSA-N	430.332	1.684	50	20	IDGD	
Cc1nnc(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](F)Br)C2)s1	1780772071	ZUYSXRZLGZRYKP-DIOULYMOSA-N	449.346	1.593	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)c1	1781334940	QIJOTEMRWTYSMS-CRAIPNDOSA-N	442.285	1.779	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)n(C)n1)C2	1781996456	KGCXXFUWNJABAL-CJBNDPTMSA-N	429.315	1.037	50	20	IDGD	
CCOC(=O)c1ccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](Cl)COC)CCO3)cc1	1782041293	SLDGAQYUNVMXKB-LAUBAEHRSA-N	438.908	1.561	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)nc2nccn12	1782357598	UVYVAKOIYOKLLK-ACJLOTCBSA-N	436.310	1.265	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](O)Cc3ccccc3)C2)C1	1783340984	FXGYBZWRKBIXDR-QOKNQOGYSA-N	425.323	1.203	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](C)Nc1cnccn1)CCO2	1783349662	QOYYEZVSKUHDHC-QWQRMKEZSA-N	440.342	1.280	50	20	IDGD	
CC(C)Cc1cc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](C)Br)C3)C2)n(C)n1	1783532397	HOCMNWBSWQCAMX-LIRRHRJNSA-N	441.370	1.846	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cc(Cl)c(O)cc3O)CCO2)C1	1783537990	SESGCUXPDTZXHP-DYZYQPBXSA-N	447.713	1.978	50	20	IDGD	
CC(C)=NO[C@@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]2C1	1783971672	DNVCIPPNNYPCHZ-YXMSTPNBSA-N	432.359	1.798	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3CC(c4ccccc4)=NO3)[C@H]2C1	1784406908	DRSIQBATJIUTTM-OIGVQNGMSA-N	449.935	1.413	50	20	IDGD	
Cc1cnn([C@H](C)C(=O)N2CC[C@@]3(CN(C(=O)[C@H](C)CBr)CCO3)C2)c1	1784442201	LWPVFNHNMCYATQ-RKVPGOIHSA-N	427.343	1.613	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3COc4ccccc4O3)[C@H]2C1	1785043584	MOGDNMHDKXXITD-FLKCQLHMSA-N	438.908	1.060	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)c1cnccc1C(F)(F)F	1786000921	NJQKPQVKYKGIIF-LVGORTOPSA-N	435.830	1.293	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)c1ccc(C(F)(F)F)nc1	1786096538	LNODUKFOORYBLP-FQUUOJAGSA-N	435.830	1.293	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC1(c2ccc(NC(=O)CN3CC(=O)NC3=O)cc2)CCC1	1786684977	ZVVXTBNLTWKZLG-UHFFFAOYSA-N	432.553	1.524	50	20	IDGD	
CCc1cc(C(=O)NC2(c3ccc(NC(=O)c4ccc(B(O)O)cc4)cc3)CCC2)no1	1788142339	QJQLDOFSVSVQRB-UHFFFAOYSA-N	433.273	1.978	50	20	IDGD	
Cc1ncncc1C(=O)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1	1788147812	ISABLGIDLMSZOU-UHFFFAOYSA-N	430.273	1.526	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1ccc(C2(NC(=O)COCCO)CCC2)cc1	1788645250	AOWLSLZBUVDEDY-CVKSISIWSA-N	441.488	1.263	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(=O)Nc3cccnc3)C[C@@H]21	1789870784	VWFGQYYXDYEUON-XPVILTJLSA-N	443.331	1.236	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]3C2)cc1O	1789923343	GQKMQECYKCLYNY-SDADXPQNSA-N	429.286	1.984	50	20	IDGD	
O=C(Cc1ccc([N+](=O)[O-])cc1F)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21	1790754664	BXHKZNZLZCBDEF-ONQXIZJVSA-N	431.823	1.791	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4nccn4c3)C[C@@H]21	1791055638	AXSLESIVLDEZAW-OEAJRASXSA-N	435.322	1.711	50	20	IDGD	
CCCC(=O)N[C@@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)Br)[C@H]2C1	1791055738	HGCVVIQYWCASMB-YTFOTSKYSA-N	432.359	1.054	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1ccc(C2(NC(=O)c3ccc(O)cn3)CCC2)cc1	1791599620	NUEILKJDUISKQZ-UHFFFAOYSA-N	425.489	1.908	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)NNc1ccccc1	1792511986	YSXOBTLAJABAKJ-JGFGOLAASA-N	439.354	1.365	50	20	IDGD	
CC(C)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1C[C@@]13C(=O)Nc1ccccc13)C2	1792785642	MPNIPFQIHIPZON-XMWNQWDJSA-N	445.947	1.751	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1(c3cccc(Cl)c3)CC1)C2)[C@H](O)CCl	1792981711	PRLXTSFVSGWDPG-DLTLXFJOSA-N	427.328	1.561	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](O)CCl)CC1	1793117490	OYMCOUFXMIYEBO-YYIAUSFCSA-N	443.972	1.871	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C#CC1(O)CCCCC1)C2	1795115824	LZUGAFUCPLYZSF-JLVBRIDZSA-N	427.339	1.060	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc(Br)cn1)C2)[C@@H](F)Cl	1796361602	LAIBNZIMUBFJPU-ANGCBRKESA-N	434.693	1.511	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H]1CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Cl	1796365483	XRSHWXZDEKUKSO-AUOOEQCUSA-N	447.935	1.900	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1nc2ccccc2[nH]1	1797340740	FNZHWPMHHNTRFY-BTTYYORXSA-N	433.472	1.127	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1nc2ccccc2n(C)c1=O	1797524036	PNERXYZZMWRECJ-FQUUOJAGSA-N	447.333	1.969	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(F)c1[N+](=O)[O-])C2	1797956111	AFWWYTFMXQYENN-FVCICTRLSA-N	439.516	1.789	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1ON=C(c3ccccc3)O1)C2	1797956842	GIDRASDBNSVWCZ-HPNQWNLUSA-N	447.564	1.162	50	20	IDGD	
Cc1ccc(NCCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)c(C)c1	1798503403	HCLDQBPJTYRONQ-KOUNCHBCSA-N	449.360	1.737	50	20	IDGD	
CCCc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCC(=O)NN(C)C)C3)cc1	1799014357	LAOMFFCAYYAYQN-HATOLVCRSA-N	430.549	1.215	50	20	IDGD	
O=C(CC12CCCN1CCC2)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2	1799209621	HYHMJOMQGIWWTO-JLVBRIDZSA-N	428.371	1.380	50	20	IDGD	
Cc1ccc(-n2ccnn2)c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)C(Cl)Cl)C3)c1	1799865691	USVWBBNMFLOHFP-YWVIFJGQSA-N	438.315	1.583	50	20	IDGD	
Cc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Br)C3)cc2c[nH]nc12	1799919807	TVKXFZKPJBYJJD-XRGAULLZSA-N	439.285	1.765	50	20	IDGD	
O=C(COc1ccccc1F)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2	1800648533	SWCYXTVPFBSOEW-OJXGSEEGSA-N	433.249	1.485	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1n[nH]c3c1CC[C@H]3C)C2	1800757057	HJMIEXGYQOBUNY-VNUHZKFNSA-N	425.327	1.446	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cn3c(Cl)cccc3n1)C2	1800978309	RSBAGRALEQDGRM-IPJQOSJUSA-N	441.315	1.445	50	20	IDGD	
CC[C@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](N)Cc1cscn1)C2	1801801559	LHUOPJPZSHYPBN-KLLKFSIISA-N	429.384	1.825	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1CCN(C(=O)c2cc(O)ncn2)[C@H]1c1cccnc1	1803010686	JHAAEPVZMOVZAU-IFIJOSMWSA-N	448.321	1.928	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)C23CC(F)(C2)C3)[C@@H]1c1cccnc1	1803661479	RMRSASKBGVQABP-CEHZJVLFSA-N	431.512	1.353	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1803690847	UKKXPUWTQXNUKC-YZGWKJHDSA-N	443.740	1.489	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)CNC(=S)NCC)[C@@H]1c1cccnc1	1803693642	AJHCVDPFDVREPN-XYJFISCASA-N	440.013	1.979	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)Cc2nnc(C)s2)[C@H]1c1cccnc1	1807538479	GLVDPBROMTYCHK-RLFYNMQTSA-N	437.953	1.744	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)c2ccccn2)[C@@H]1c1cccnc1	1810297692	CTDXNWQLWLAUSW-OXJNMPFZSA-N	445.483	1.109	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@H]1CCN(C(=O)CCc2nc(N)n[nH]2)[C@H]1c1cccnc1	1810545896	HDHQNXGWNWOJPC-BEFAXECRSA-N	445.600	1.272	50	20	IDGD	
COC(=O)NCC(=O)N1CC[C@H](CNC(=O)[C@H](C)Br)[C@H]1c1cccnc1	1812868307	YAASURNGTGIXTG-NJZAAPMLSA-N	427.299	1.227	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](OC(C)=O)C(C)C)[C@@H]1c1cccnc1	1813030869	GUVRACFYCSVNHS-OKYOBFRVSA-N	439.940	1.929	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)Cc2c(C)n[nH]c2C)[C@@H]1c1cccnc1	1813033500	UDFROWYULQXKHB-IMFGXOCKSA-N	433.940	1.924	50	20	IDGD	
COC(=O)CSCC(=O)N1CC[C@H](CNC(=O)C(Cl)Cl)[C@@H]1c1cccnc1	1813075769	JEYQOUBYFDRVHB-DOMZBBRYSA-N	434.345	1.797	50	20	IDGD	
C[C@H](C(=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@H]1c1cccnc1)n1cnnn1	1813473677	NOVYBGWVVSBFSP-VZZFWQQMSA-N	440.277	1.026	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)c1ccc(CO)c(F)c1	1813990305	GNNILVWIIBZZIM-ZYSHUDEJSA-N	435.883	1.632	50	20	IDGD	
CCOC(=O)N[C@H](O)C(=O)N1CCCC[C@H]1c1cc(NC(=O)C(C)(C)CCl)n[nH]1	1814697092	LYEBVKVNKPWIAY-GXTWGEPZSA-N	429.905	1.731	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(-n3ccnc3)ccn2)[nH]n1)[C@@H](O)CCl	1814872977	IILCIHDCHKIYKS-IRXDYDNUSA-N	443.895	1.896	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)[C@H](O)CCl)n[nH]2)nc2nccn12	1814874888	IOOXRTBPLWFCLV-LSDHHAIUSA-N	431.884	1.666	50	20	IDGD	
CCC[C@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CNCP(=O)(O)O)[nH]n1	1815317558	AHTGCMBUSHSERP-WCQYABFASA-N	435.849	1.534	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)C(F)(F)C(F)F)n[nH]1	1815544464	MJLRWTDAXWRWSW-LLVKDONJSA-N	436.410	1.675	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN)[nH]n1	1815704413	SSHKFVCGZBIMAI-STQMWFEESA-N	428.921	1.493	50	20	IDGD	
CC[C@@H](NC(N)=O)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCBr)n[nH]1	1816780751	IZRMFEKAMKUMBY-PWSUYJOCSA-N	429.319	1.634	50	20	IDGD	
CN[C@H](CC(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](C)CBr)[nH]n1)C(=O)O	1817361369	HBNBJSJRIYBRAQ-RAIGVLPGSA-N	444.330	1.496	50	20	IDGD	
Cc1ccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)nc1	1817471080	QSBXMMMBIJARJI-LJQANCHMSA-N	433.277	1.413	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1)c1ccc2c(n1)OCCO2	1817960376	OSTDOYPNGYBPDR-KGLIPLIRSA-N	435.868	1.482	50	20	IDGD	
CCNC(=O)N[C@@H](C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CO[Si](C)(C)C)[nH]n1	1819353161	MDMZARDOQVLJED-DZGCQCFKSA-N	438.605	1.961	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccccn2)[nH]n1	1819402114	NWGCAYAOSJKOIL-QGZVFWFLSA-N	434.460	1.423	50	20	IDGD	
CN1CCN(C2(C(=O)Nc3cc([C@H]4CCCCN4C(=O)C(Cl)Cl)[nH]n3)CC2)CC1	1820800844	BVPQMLOEABTMCY-CQSZACIVSA-N	443.379	1.986	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1)C1CCC2(CC1)OCCO2	1821819612	RQNGPTSYZZWBIU-JKSUJKDBSA-N	440.928	1.935	50	20	IDGD	
COc1ccc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@H](O)CCl)CC3)c(O)c1	1821962600	CAZQZLFAPDLKBV-YMTOWFKASA-N	425.894	1.683	50	20	IDGD	
Cc1ccc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2cccc(B(O)O)c2)CC3)cc1	1822265752	TXLXWMHQTXHDBY-QGZVFWFLSA-N	435.314	1.671	50	20	IDGD	
CCc1ccc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cccc(B(O)O)c2)CC3)cc1	1822287446	LOCKPAYLIRDAGO-SFHVURJKSA-N	449.341	1.925	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)Cc2ccccc2O)[nH]n1	1822416992	UTEPJVIHUMXODH-QGZVFWFLSA-N	442.520	1.723	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc3ncccn3n1)CC2	1826000100	KWEUTJVUBRKYDN-QWRGUYRKSA-N	434.909	1.665	50	20	IDGD	
CC[C@@H](NC(N)=O)C(=O)N1CCC([C@H]2CCCCN2C(=O)CCBr)CC1	1826357343	WWPOFVLJJAMDNM-HUUCEWRRSA-N	431.375	1.838	50	20	IDGD	
C=CCC(F)(F)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827053642	WTQBQTZUVKMBCG-IBGZPJMESA-N	434.292	1.811	50	20	IDGD	
COc1ncc(Cl)cc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1829584010	AWFIGNMTBDFLSA-CXAGYDPISA-N	436.267	1.348	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3cnc4ccccn34)CCO2)C1	1830654668	BBOWCOINTJFFSO-PGRDOPGGSA-N	448.951	1.741	50	20	IDGD	
O=C([C@H](O)CCl)N1CCO[C@]2(COCCN(C(=O)C34CC(c5ccccc5)(C3)C4)C2)C1	1830737280	CVVVGOICBGVPBF-BKAOJLMESA-N	448.947	1.164	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)Cn2cc([N+](=O)[O-])cn2)CC1	1831829012	XBDSUKBFVCPASO-IRXDYDNUSA-N	441.916	1.665	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@H]2CC[C@H](O)CC2)CC1	1831875475	WCOYIKUHEJNINY-UFYCRDLUSA-N	436.597	1.530	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccnc(F)c3)CCO2)C1	1831907185	IWFDWWFXWUEHJG-KBXCAEBGSA-N	444.301	1.464	50	20	IDGD	
C=CCO[C@@H](C)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1833477743	RFEZZMABMRIBGS-XJKSGUPXSA-N	434.350	1.840	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)[C@H](COC)NC(C)=O)CC2)CC1	1833533344	BFARQIAQUGYSRF-MOPGFXCFSA-N	445.004	1.117	50	20	IDGD	
Cc1nscc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1833747024	IEJWJDCTKSLNKL-IUODEOHRSA-N	436.303	1.212	50	20	IDGD	
Cc1ccsc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1833945935	PMRFDMNJRHJCQC-CJNGLKHVSA-N	435.315	1.817	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)CCSC(=N)N)CC2)CC1	1834709918	WLDVJKYLQVSKTA-GFCCVEGCSA-N	448.431	1.358	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@]3(CN(C(=O)CCBr)CCO3)C2)s1	1834819712	YTHNFWUNUPXXJV-KRWDZBQOSA-N	431.352	1.912	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)Cc3cccs3)CC2)CC1	1834858577	SPKUUNPKVJYXEU-UHFFFAOYSA-N	449.621	1.235	50	20	IDGD	
N[C@@H](Cc1cscn1)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](F)Cl)CC2)CC1	1835079876	YYMCCNUVFKSXHZ-JKSUJKDBSA-N	431.965	1.119	50	20	IDGD	
Cc1nccc(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](F)Br)CC3)CC2)n1	1835219044	KJBWNHBLRBNBHI-MRXNPFEDSA-N	442.333	1.661	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](F)Cl)CC2)CC1)c1ccc2c(c1)CNC2=O	1835627163	AXMGUNVICWAAQP-SFHVURJKSA-N	436.915	1.650	50	20	IDGD	
O=C(C(Cl)Cl)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CNc3ccccc31)CCO2	1835723071	QASNWHIUNJPACU-LIRRHRJNSA-N	428.316	1.456	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(CN(C(=O)/C=C/c3ccccc3N)CCO2)C1	1835777730	ZWRCEFODUKVHRN-HYGBKTPJSA-N	447.608	1.590	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](C)Cn3cncn3)CC2)CC1	1835805373	CQTSNTIYFFKWHK-LPHOPBHVSA-N	439.004	1.893	50	20	IDGD	
CCc1nc(C(=O)NC2CCN(C3CCN(C(=O)[C@H](Cl)COC)CC3)CC2)co1	1835987273	PHCMCDDYVKXHKZ-MRXNPFEDSA-N	426.945	1.676	50	20	IDGD	
CC(=O)C[C@H](C)C(=O)N1CCC(N2CCC(NC(=O)[C@H](F)Br)CC2)CC1	1836414323	DUTLYYJWCMGPOA-LRDDRELGSA-N	434.350	1.864	50	20	IDGD	
O=C(CCc1ccc(O)nn1)NC1CCN(C2CCN(C(=O)[C@H](F)Cl)CC2)CC1	1836502326	DXDDNEMBRPMLDW-SFHVURJKSA-N	427.908	1.221	50	20	IDGD	
O=C(/C=C/C(=O)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1)c1cccs1	1836520969	ZXBJMNNXPVEENB-WHLIDYPQSA-N	447.340	1.747	50	20	IDGD	
O=C(c1snnc1C1CC1)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836718075	RPXPTQRGOIQMKS-HNNXBMFYSA-N	442.969	1.627	50	20	IDGD	
CN1CCN(CCC(=O)N2CCC(OC3CCN(C(=O)C(Cl)Cl)CC3)CC2)CC1	1837807504	PECMHWYPMPEGFR-UHFFFAOYSA-N	449.423	1.426	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3n[nH]c4cccc(F)c34)C2)C1	1839147879	FVUYVTHZXZKVRZ-ZUOKHONESA-N	438.887	1.789	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3ccco3)C2)C1	1839150822	YIIFHKQNWRBIPI-RBUKOAKNSA-N	433.332	1.905	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3ncc[nH]3)C2)C1	1839154904	BEKCDAXUMAGJOM-ROUUACIJSA-N	433.336	1.035	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3C[C@@]3(F)Cl)C2)C1	1839155060	HKRUNHFILPYITQ-MEYUZBJRSA-N	431.719	1.604	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3F)C2)C1	1839964682	YZUOXBPTKSBDEB-KDOFPFPSSA-N	444.301	1.464	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccnc(Cl)c3)C2)C1	1840030965	BKTCYWVEOQXYJS-PXAZEXFGSA-N	446.729	1.588	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(C)cc(C#N)c3)C2)C1	1840154693	CWRJJFKLDTYGAS-RXVVDRJESA-N	435.908	1.191	50	20	IDGD	
C[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1)n1cccn1	1840442961	SZIXCZJNKFGFSH-ZTFGCOKTSA-N	433.336	1.137	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@H](O)CCNC(=O)OC(C)(C)C)C2	1841669279	KYWAAEUQIXNCBQ-GJZGRUSLSA-N	431.961	1.873	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2cnccc2Cl)C1	1844404387	YYAXEPRLALYQFT-ZMOGYAJESA-N	428.880	1.686	50	20	IDGD	
CN1CCCn2nc(C(=O)N3CC4(CCCN4C(=O)[C@@](C)(Cl)CCl)C3)cc2C1	1845172362	DHVJOEDIBSPQQB-SFHVURJKSA-N	428.364	1.772	50	20	IDGD	
O=C(c1nc2cc([N+](=O)[O-])ccc2[nH]1)N1CC2(CCCN2C(=O)[C@@H](F)Br)C1	1845219513	UCHSAJGORFOEFC-GFCCVEGCSA-N	440.229	1.979	50	20	IDGD	
C#CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)[C@H](C)Br)C1	1846180186	RZHLVMWXDGPNFE-KBPBESRZSA-N	442.354	1.890	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)c1ccc(C(F)(F)F)nc1)C2	1846384303	BAAKTEGLFUPSFJ-UHFFFAOYSA-N	427.427	1.290	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H]1CC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl	1847556095	CQOKGFKWEZFHAA-VGWMRTNUSA-N	429.945	1.578	50	20	IDGD	
CC(C)(C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl)c1ncc(Br)cn1	1847560191	WPHRDIKVXMJJJC-RWMBFGLXSA-N	445.745	1.318	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)c1nc(-c2cccs2)n(-c2ccc(F)cc2)n1	11002969	UODMKRDDWXPAGU-NSHDSACASA-N	449.489	1.331	50	20	IDGD	
O=C(CCCNC(=O)c1ccc(F)cc1F)NNC(=O)c1nn(-c2ccccc2)cc1O	11677468	LCDDLKSKDKTLEM-UHFFFAOYSA-N	443.410	1.827	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)CCc2nc(-c3ccncc3)no2)c2ccccc2c1=O	14282609	NELOYPNJHASCCL-UHFFFAOYSA-N	447.455	1.645	50	20	IDGD	
O=C(NNC(=O)C1CCN(S(=O)(=O)c2cc(F)ccc2F)CC1)c1ccccc1F	14800895	GMXQIBJJOWNMSE-UHFFFAOYSA-N	441.431	1.966	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)ccc1C	15794941	JDBBRTRNMNVBLU-SFHVURJKSA-N	447.513	1.627	50	20	IDGD	
Cc1c(-c2ccccc2)oc2c(C(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)cccc2c1=O	16785924	FSPVQBLSPMVDKV-OAHLLOKOSA-N	440.477	1.964	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)[C@@H]2COc3ccc(Cl)cc3C2)cc1OC	16796790	YFXDDAATXMESJU-AWEZNQCLSA-N	448.859	1.913	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)C[C@](O)(c1nc(C)cs1)C(F)(F)F	109466179	UNVRRQTZRUBTQH-INIZCTEOSA-N	432.424	1.860	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)CNC(=O)c1cccs1)N1CCN(c2ccccc2)CC1	725874440	ZOOSQSBJMXNBIT-INIZCTEOSA-N	444.561	1.019	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)c1ccc(S(N)(=O)=O)c(Cl)c1	725907303	HNTHEYQONDZPQR-UHFFFAOYSA-N	435.893	1.361	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)c2ccc3c(c2)S(=O)(=O)N(C(C)C)C3=O)c1	728206600	WMEVALWZLSXCPP-UHFFFAOYSA-N	446.485	1.121	50	20	IDGD	
Cc1cc2ncc(C(=O)NNc3ccc(S(=O)(=O)N4CCN(C)CC4)cc3)c(C)n2n1	728214862	UBBVAQBWJGNFDO-UHFFFAOYSA-N	443.533	1.039	50	20	IDGD	
COc1cccc(/C=C(\C#N)C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1	728320733	YMXQWFZXSNBQDN-POUQMFDLSA-N	437.408	1.133	50	20	IDGD	
CCOC(=O)c1cc(S(=O)(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)ccc1F	728503712	XWKURGYRUXICDI-UHFFFAOYSA-N	437.449	1.567	50	20	IDGD	
Cc1cc(O)c(C(=O)O)cc1S(=O)(=O)NNC(=O)c1cc(F)ccc1Br	728509372	CYQCXHUZBQBBGT-UHFFFAOYSA-N	447.238	1.924	50	20	IDGD	
CCN(CC)C(=O)CN1CCCN(C(=O)NNC(=O)c2cccc(OC(F)F)c2)CC1	728598631	JMMBMJFYVGUIOU-UHFFFAOYSA-N	441.479	1.519	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)c2ccc(CS(N)(=O)=O)cc2)c1	728608990	IQLQGELXWSEBEN-UHFFFAOYSA-N	442.291	1.321	50	20	IDGD	
O=C(CCc1nc(-c2nc[nH]n2)no1)NNC(=O)c1ccc(Br)cc1Cl	728977426	MPWUZHADUGYFIM-UHFFFAOYSA-N	440.645	1.664	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)O[C@H](C)C(=O)N[C@H]2CCS(=O)(=O)C2)c(C)n1CC(C)C	729254447	BXJHRNJNDYLNOZ-UDDJLZNGSA-N	435.546	1.903	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)c2ccc(C)c(S(=O)(=O)NCC#N)c2)cc1	729257914	TWCRNZJMCPDFRI-UHFFFAOYSA-N	432.527	1.659	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)NCCOc2ccc(S(C)(=O)=O)cc2)cc1	730067383	XQKGDDXCISJUMI-UHFFFAOYSA-N	437.543	1.900	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)N1CCc2ccccc2C1	732265223	PXFRIKCIEPIWQO-FQEVSTJZSA-N	435.572	1.793	50	20	IDGD	
COc1ccc2[nH]cc(CC(=O)OCC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)c2c1	732324916	KLPSEIZCMPLOSD-UHFFFAOYSA-N	426.385	1.632	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1OC	733347898	DHZRQUVSEVNNGJ-UHFFFAOYSA-N	438.444	1.569	50	20	IDGD	
CN1CCN(C(=O)CCNC(=O)/C(C#N)=C/c2cn(CCC#N)nc2-c2ccccc2)CC1	733975269	MVIUNINIKZDHGD-CAPFRKAQSA-N	445.527	1.651	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NCc3coc4ccccc34)nc2)CC1	734071320	CYJXCLRNTTZWST-UHFFFAOYSA-N	444.517	1.590	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)C1CCN(C(=O)Nc2ccccc2)CC1	734241632	SKWXGLALYAYEGV-UHFFFAOYSA-N	448.524	1.786	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)NC1CCN(C[C@H]2CCCO2)CC1	734283983	UYGRSQYYNIOFSM-QGZVFWFLSA-N	428.493	1.165	50	20	IDGD	
CCn1c(NNC(=O)CS(=O)(=O)c2ccc(C(C)=O)c(F)c2)nc2ccccc2c1=O	734809451	FZLLUHQMDCDOFH-UHFFFAOYSA-N	446.460	1.675	50	20	IDGD	
CC(=O)NCC(=O)N1CCc2cc(C(=O)NNC(=O)c3ccc4ccccc4n3)ccc21	735647228	VLUQALOCPHNDEY-UHFFFAOYSA-N	431.452	1.335	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc2c(c1)CCCC2)NNC(=O)COCc1ccccc1	737923763	YXGHTDVZSFXRCE-UHFFFAOYSA-N	445.541	1.598	50	20	IDGD	
Cc1cc(N2CCCS2(=O)=O)ccc1C(=O)NNC(=O)[C@H](C)Oc1ccccc1F	741525504	LZZUNRHMCILHRB-AWEZNQCLSA-N	435.477	1.903	50	20	IDGD	
C[C@H](C(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1)[C@H](NC(=O)OC(C)(C)C)c1ccccc1	742489415	BKYFFNNGAJPNRT-IMJJTQAJSA-N	439.534	1.471	50	20	IDGD	
CSc1nc(C)c(CCC(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)c(C)n1	744521927	ZYFMMCQPMYDKIR-UHFFFAOYSA-N	427.486	1.624	50	20	IDGD	
COc1ccc2[nH]cc(CC(=O)NNc3ccccc3S(=O)(=O)N3CCOCC3)c2c1	744619741	WXLALZKEQLPWIE-UHFFFAOYSA-N	444.513	1.883	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1cnn(-c2ccccc2)n1	744622005	LXEOHIDIIUXIPL-UHFFFAOYSA-N	428.474	1.045	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1)N[C@H]1CCSC1	745898976	CRQBCRSRLMAEST-INIZCTEOSA-N	434.543	1.615	50	20	IDGD	
C[C@H](C(=O)NNC(=O)c1ccc(Cl)cc1Cl)N1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O	746100305	JIWKZWCYHDYYLK-FVJKAEFOSA-N	426.256	1.305	50	20	IDGD	
CC(C)CN1CCC[C@H](CNC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)C1	746328594	NJBHNXWEMZOYSD-OAHLLOKOSA-N	425.555	1.794	50	20	IDGD	
Cn1ncc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)c1C1CC1	747145149	ZCQHZKBEZHNABK-UHFFFAOYSA-N	431.518	1.547	50	20	IDGD	
O=C(CCc1ccccc1O)NNS(=O)(=O)c1ccc(C(=O)O)c(Br)c1	747613818	VSORXEVRMSFDKA-UHFFFAOYSA-N	443.275	1.795	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCCCNC(=O)C1CCC1	749118041	WBIOIJBBUYLTPK-LBPRGKRZSA-N	441.326	1.853	50	20	IDGD	
O=C(Cn1cnc2ccccc21)NNC(=O)[C@@H]1CCCN1C(=O)c1ccc2c(c1)OCO2	749562127	VVHSPCHBIFCDSI-KRWDZBQOSA-N	435.440	1.217	50	20	IDGD	
CC[C@H](C)n1c(SCC(=O)NNC(=O)C(=O)N2CCCC2)nnc1-c1ccccc1	749850749	XMVPBEDBEISHFZ-AWEZNQCLSA-N	430.534	1.778	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCCCNC(=O)c2ccccc2)nc1	750325904	FSZCWQCLGVZNNZ-UHFFFAOYSA-N	434.522	1.215	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1)N[C@H]1CC(=O)N(C2CC2)C1	750656276	WWGCHZIKNOGTMY-RBBKRZOGSA-N	447.539	1.707	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)N[C@@H]1CCN(c2cccc(Cl)c2)C1=O	750671420	SBYAHIXNVIWQPT-OAHLLOKOSA-N	440.847	1.738	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)c1ccccc1SCC(=O)N1CCCC1	751206248	ANNVPEHMBNQSHB-UHFFFAOYSA-N	430.486	1.185	50	20	IDGD	
C[C@@H](NC(=S)NNC(=O)c1cccc(S(=O)(=O)NC[C@@H]2CCCO2)c1)C1CC1	751620967	NDOPJNRAPKKHPU-DOMZBBRYSA-N	426.564	1.051	50	20	IDGD	
CN1C(=O)N[C@]2(CCC[C@H]2CNC(=O)NNC(=O)Nc2ccc(OC(F)F)cc2)C1=O	752022633	HJTCACACMZDNCS-YPMLDQLKSA-N	440.407	1.344	50	20	IDGD	
N#Cc1ccc(CN2CC[C@H](NC(=O)NNC(=O)COc3ccccc3F)C2=O)cc1	753026429	AONQDCLCBFVGPL-KRWDZBQOSA-N	425.420	1.208	50	20	IDGD	
CCc1cc(Br)ccc1NNC(=O)[C@H]1CC(=O)N([C@H]2CCS(=O)(=O)C2)C1	753175458	KFSDOOIZCVPQEB-JSGCOSHPSA-N	444.351	1.490	50	20	IDGD	
Nc1nc(Cl)cc(NNC(=O)c2ccc(Cl)c(S(=O)(=O)N3CCCC3)c2)n1	753450337	SZNPAJSKQUIKAQ-UHFFFAOYSA-N	431.305	1.907	50	20	IDGD	
C[C@@H](CCC(C)(C)C)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	753999115	PEGSDKWTXRFCFR-HNNXBMFYSA-N	425.551	1.931	50	20	IDGD	
CC(C)CNc1nc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cs1	754822946	HWYMOKBNQLBFAH-HNNXBMFYSA-N	434.474	1.355	50	20	IDGD	
Cc1ccc(S(=O)(=O)Nc2ccccc2F)cc1C(=O)NNC(=O)Cc1cc[nH]n1	755264272	WIXTVNGTFSXCMY-UHFFFAOYSA-N	431.449	1.662	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)n([C@@H]2CCS(=O)(=O)C2)n1	755537503	VTFWNTBHABHHGN-MRXNPFEDSA-N	443.489	1.203	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)Nc1ccc(CN2C(=O)CCC2=O)cc1	755661570	IMZAMESXCBLGKA-UHFFFAOYSA-N	434.412	1.451	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)CCc2cccc([N+](=O)[O-])c2)CC1	755809547	LKZHNXHXZTUWGP-UHFFFAOYSA-N	448.505	1.002	50	20	IDGD	
COC(=O)c1cc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)ccc1F	756054963	IZQLDRIONWKABH-UHFFFAOYSA-N	438.437	1.329	50	20	IDGD	
COc1ccc(COCc2cccc(NC(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)c2)cc1	756247228	ZQZQHVXTLPDTKJ-QGZVFWFLSA-N	447.513	1.999	50	20	IDGD	
CCN1CCN(C(=O)c2ccc(NC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)cc2)CC1	756252765	JQPJWAVRWOOOBN-UHFFFAOYSA-N	440.460	1.839	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccc3c(c2)NC(=O)CC3)c1	756747917	STUUQPVYNXHFGR-UHFFFAOYSA-N	431.474	1.288	50	20	IDGD	
CN(C)C(=O)Cn1cc(NC(=O)NNC(=O)c2ccc(F)cc2Br)cn1	756800774	FSWCCKNOTQYSIV-UHFFFAOYSA-N	427.234	1.339	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)Nc1cc(C(N)=O)ccc1CN(C)C	756826176	BFIGOLINTORGKZ-UHFFFAOYSA-N	429.477	1.478	50	20	IDGD	
C[C@H]1CN(C(=O)Cn2cc(NC(=O)NNC(=O)Cc3ccc(Cl)cc3)cn2)C[C@H](C)O1	756836389	AAUNXCSUCBEWPU-KBPBESRZSA-N	448.911	1.568	50	20	IDGD	
COCCNC(=O)Cn1cc(NC(=O)NNC(=O)CSc2ccc(Cl)cc2)cn1	756840536	WHNAYPKOMXUEKR-UHFFFAOYSA-N	440.913	1.244	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)Nc2cccc3c2CCN3S(C)(=O)=O)cc1	758299500	BPYSASDQPNHADL-UHFFFAOYSA-N	434.474	1.249	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)N1CCC[C@H]1C(=O)NNC(=O)C(=O)Nc1ccccn1	758831918	FGCKBHLZGFRVJP-AWEZNQCLSA-N	445.863	1.134	50	20	IDGD	
C[C@@]1(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)CCCS1	758861221	KWNZCUVTMTWFMY-SFHVURJKSA-N	426.564	1.701	50	20	IDGD	
C[C@@H]1CCS(=O)(=O)CCN1C(=O)CCC(=O)C(C#N)=C1N(C)c2ccccc2N1C	762512698	LATDFMKZTQDPKF-OAHLLOKOSA-N	430.530	1.693	50	20	IDGD	
Cc1nn(-c2ccc(Br)cc2)cc1C(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1	763436944	CDWVTIABEVOUTN-LLVKDONJSA-N	441.307	1.139	50	20	IDGD	
O=C(NNC(=O)c1cc2ccccc2cc1O)C(=O)Nc1cccc(N2CCNC2=O)c1	763523621	XDTAOYDCJGEBEY-UHFFFAOYSA-N	433.424	1.475	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(Cl)c(C(=O)N(C)C)c2)cc1OC	763544377	WXVAXENTHHNCLE-UHFFFAOYSA-N	448.863	1.459	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cc(C)n([C@H](C)C3CC3)n2)cc(OC)c1OC	763544582	ZNOQVCLMERWBGQ-GFCCVEGCSA-N	445.476	1.588	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)c2c(C)nc3ccccn23)sc(C)c1C	763628400	JMLUBXBSTMRKPZ-UHFFFAOYSA-N	443.485	1.897	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2c(C)nc3ccccn23)cc1Br	763629040	NVURKGBTMSLPLD-UHFFFAOYSA-N	446.261	1.814	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cc(N3CCCC3=O)ccc2F)cc1C	763667140	QLBBVWLIKWWSLW-UHFFFAOYSA-N	442.447	1.734	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(NC(=O)CC)cc1	763682688	ULHATSBOXHJWNC-UHFFFAOYSA-N	428.445	1.599	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(O[C@H]2CCOC2)cc1	763711416	JKWDBIBRRYUUNZ-SFHVURJKSA-N	427.457	1.582	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2ccc(CN3CCCC3=O)cc2)c1	763771494	BCDUVBCZHGQJSG-UHFFFAOYSA-N	440.456	1.226	50	20	IDGD	
COc1ccc(C#N)cc1NC(=O)C(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12	763789916	GKMJYCHSMZRHJH-UHFFFAOYSA-N	448.439	1.257	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)c(F)cc1F	763850733	PBQDIFKVKVDKFB-GFCCVEGCSA-N	449.410	1.922	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)NNC(=O)C(=O)Nc1cc2c(cc1Cl)OCCO2	763857707	ONGRXJPGJYNXLG-UHFFFAOYSA-N	428.832	1.921	50	20	IDGD	
COCCOc1ccc(F)cc1NC(=O)C(=O)NNC(=O)Cc1c[nH]c2ccccc12	763861072	ODNFPCAVDWZRNW-UHFFFAOYSA-N	428.420	1.661	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)n1	763892953	OONVQKUXOLMQOW-UHFFFAOYSA-N	432.440	1.950	50	20	IDGD	
CC(C)n1nnnc1-c1ccccc1NC(=O)C(=O)NNC(=O)Cc1ccc(Cl)cc1	763936980	SXMYRICEZKUJBP-UHFFFAOYSA-N	441.879	1.903	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc1OC	763944079	LPLLKHLSNSBWRC-UHFFFAOYSA-N	439.428	1.385	50	20	IDGD	
COCCOc1ccccc1NC(=O)C(=O)NNC(=O)c1cc(Br)cn1C	764004215	AAPXHZQEVWLEDR-UHFFFAOYSA-N	439.266	1.213	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1ccn(CCc2ccncc2)n1	764010790	CYZKVEDIULAWQB-UHFFFAOYSA-N	442.863	1.583	50	20	IDGD	
COCCn1nc(C)c(NC(=O)C(=O)NNC(=O)c2cccc(C(F)(F)F)c2)c1C	764037896	WTHNPGUHGAPZJQ-UHFFFAOYSA-N	427.383	1.565	50	20	IDGD	
O=C(NNC(=O)c1ccc2ccccc2c1)C(=O)Nc1ccc(CN2C(=O)CNC2=O)cc1	764062146	RAOMCQYGQYPYIY-UHFFFAOYSA-N	445.435	1.291	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(OCc3nc(C)no3)cc2)c(O)c1	764109122	HJNOXUJTKMYVCU-UHFFFAOYSA-N	425.401	1.371	50	20	IDGD	
O=C(CC(F)(F)F)NNC(=O)C(=O)Nc1ccnn1Cc1ccc(C(F)(F)F)cc1	764115628	BMPKMWOMSUTWJK-UHFFFAOYSA-N	437.300	1.989	50	20	IDGD	
CCN(Cc1ccccc1NC(=O)C(=O)NNC(=O)c1ccc(Cl)cc1O)C(C)=O	764126411	KEKCJKJFEOQSQH-UHFFFAOYSA-N	432.864	1.814	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1cccc(-c2nnnn2C2CC2)c1	764135989	LAHRODQABOEDLU-UHFFFAOYSA-N	435.444	1.012	50	20	IDGD	
O=C(NNC(=O)c1ccoc1)C(=O)Nc1cc(F)c(F)cc1I	764163567	JCWXOEUAXVIQPT-UHFFFAOYSA-N	435.124	1.562	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2O1)C(=O)Nc1cccc(NC(=O)c2ccncc2)c1	764168501	PWUFEGFIPBXVKP-IBGZPJMESA-N	445.435	1.424	50	20	IDGD	
CCCNS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)CCC2CCCCC2)cc1	764217330	DUSRQGLYTZNDNM-UHFFFAOYSA-N	438.550	1.821	50	20	IDGD	
COc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NNC(=O)Cn1ccc2ccccc21	764243355	VAEUECVIHGBYTC-UHFFFAOYSA-N	437.456	1.138	50	20	IDGD	
COC(=O)[C@H]1CN(C(=O)C(=O)NNC(=O)c2cccc(OC(F)F)c2)c2ccccc2O1	764260341	VNUOPOCCNVGSHP-OAHLLOKOSA-N	449.366	1.016	50	20	IDGD	
CCOC(=O)c1cc(C(C)(C)C)sc1NC(=O)C(=O)NNC(=O)Cc1cccnc1	764268931	YKJBJKKESLAAJN-UHFFFAOYSA-N	432.502	1.946	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)Cc2cccnc2)sc2c1CCCS2	764269128	XMNFHCFDPQDRCH-UHFFFAOYSA-N	448.526	1.687	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)C(=O)Nc1ccc(N2CCSCC2)cc1	764277273	AEYLATVEAWGFPQ-UHFFFAOYSA-N	428.514	1.664	50	20	IDGD	
C[C@H]1CN(C(=O)C(=O)NNC(=O)c2cc(Br)ccc2O)c2ccccc2O1	764279755	DYQPYZPZBLBING-JTQLQIEISA-N	434.246	1.730	50	20	IDGD	
CCOc1ccc(C(=O)N2CCCCC2)cc1NC(=O)C(=O)NNC(=O)c1c[nH]nc1C	764297938	JBVCCZBNQQVSRK-UHFFFAOYSA-N	442.476	1.143	50	20	IDGD	
COC(=O)[C@@H]1CN(C(=O)C(=O)NNC(=O)C(C)(C)c2ccccc2)c2ccccc2O1	764301900	GORFXINCFSTGAL-KRWDZBQOSA-N	425.441	1.079	50	20	IDGD	
CN(C)CC1CCN(c2ccc(NC(=O)C(=O)NNC(=O)Cc3ccncc3)cc2)CC1	764356033	PNBWYJJIMXTIEH-UHFFFAOYSA-N	438.532	1.188	50	20	IDGD	
COC(=O)Cc1ccccc1NC(=O)C(=O)NNC(=O)c1cc(-c2cccs2)[nH]n1	764383121	WMKNDYSYQKUGGY-UHFFFAOYSA-N	427.442	1.253	50	20	IDGD	
O=C(CN1CCC(C(=O)NCCCN2CCCCC2)CC1)NNC(=O)c1cccs1	764384815	DCYGMTRWPHUYOE-UHFFFAOYSA-N	435.594	1.213	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCCCC2)cc1S(=O)(=O)NNC(=O)OC(C)(C)C	764931187	CGZHVHHFKWEOIY-UHFFFAOYSA-N	433.552	1.888	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)c2ccc(C)c(S(C)(=O)=O)c2)n[nH]1	765592085	IJLYGQPYLHFZRH-UHFFFAOYSA-N	428.470	1.872	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)cc1	765757944	IDVJCBQAPQJBMJ-UHFFFAOYSA-N	443.935	1.877	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1ccc(-c2ccco2)nc1O	766636728	SSLIDXNJTOFYRV-UHFFFAOYSA-N	449.467	1.266	50	20	IDGD	
Cc1nn2cc(S(=O)(=O)NNC(=O)CSc3ccccc3O)cnc2c1Cl	766849527	FCZXYTNFWLPKNG-UHFFFAOYSA-N	427.895	1.499	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)cc1	768260780	NZPBPHPPJFFATL-UHFFFAOYSA-N	447.498	1.080	50	20	IDGD	
CC1(C)CCC[C@@]2(C1)NC(=O)N(CC(=O)NNC(=S)NCCc1cccs1)C2=O	768571116	MXIJOGHGXDGHHC-IBGZPJMESA-N	437.591	1.677	50	20	IDGD	
CN1CCC(N2CC[C@H](NC(=O)NNc3nc(O)c4cnn(C(C)(C)C)c4n3)C2)CC1	770396372	OYHZMVSCSWPFEL-ZDUSSCGKSA-N	431.545	1.082	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NN=C1CCCOCC1)N(S(C)(=O)=O)CC2	770592539	UIBDHVBKKVFDJP-QGZVFWFLSA-N	439.534	1.625	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)N[C@H]1CC(=O)N(c2c(F)cccc2F)C1	770845608	ZJTIQMDINKLQGX-ZBEGNZNMSA-N	432.383	1.241	50	20	IDGD	
CCCOc1ccc(S(=O)(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)cc1	771604856	MZSJVLVGXJMMHZ-UHFFFAOYSA-N	425.894	1.755	50	20	IDGD	
COc1cccc([C@@H]2[C@H](C(=O)O[C@@H](C)C(=O)NNC(=O)CC(C)C)CC(=O)N2C2CC2)c1	772234812	FKMXGFOPESCRRO-FIKMYACPSA-N	445.516	1.872	50	20	IDGD	
CC(C)[C@@H](C(=O)NNC(=O)c1ccc(COc2ccccc2)o1)N1CCCS1(=O)=O	772632173	XBRLLZKOFMQYJO-SFHVURJKSA-N	435.502	1.680	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2cc(I)ccc2C)n1	773726055	GNDDBXDGFWFWEF-UHFFFAOYSA-N	427.202	1.480	50	20	IDGD	
CC[C@@H](NCC(=O)NNC(=O)c1ccc(C)cc1)c1ccccc1OCC(=O)N(C)C	775052978	HFLFGWXBYVMEBN-LJQANCHMSA-N	426.517	1.964	50	20	IDGD	
COCCCOc1ccc(Cl)cc1S(=O)(=O)NNC(=O)CNC(=O)c1ccco1	775277622	NQRCTIURVMTLMD-UHFFFAOYSA-N	445.881	1.088	50	20	IDGD	
CN(Cc1ccccc1)[C@H](CNC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)C1CC1	776266615	VXODWWZWOWRQJV-HXUWFJFHSA-N	448.527	1.788	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(C(=O)CCC(=O)NNc3ccccn3)CC2)cc1	777472467	JCDOLRDREHIYNO-UHFFFAOYSA-N	431.518	1.146	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)[C@H]1CCCN(C(=O)Nc2ccccc2F)C1	778437504	FCZNEBQHRVJGEW-ZDUSSCGKSA-N	437.472	1.742	50	20	IDGD	
COc1ccc(C2(CNC(=O)NNC(=O)CNC(=O)OC(C)(C)C)CCOCC2)cc1	778627116	QXHQWZQXHBPHBP-UHFFFAOYSA-N	436.509	1.599	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCOC[C@H]2CC(=O)c2cccs2)cc1OC	781916119	ALNLWMHGCZNHPI-OAHLLOKOSA-N	447.513	1.500	50	20	IDGD	
CNC(=O)c1cc(Oc2ccccc2NC(=O)C(=O)NNc2ccc(OC)cn2)ccn1	782144587	AOWHTZOISKZNLG-UHFFFAOYSA-N	436.428	1.719	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)cc1)C(=O)Nc1cnn(-c2ccccc2Br)c1	782832514	ZCGPXOKMNSRPDC-UHFFFAOYSA-N	444.245	1.740	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)C(=O)Nc1cc(F)c(F)cc1Cl	782896247	CXKWALLIBAGXQC-UHFFFAOYSA-N	445.835	1.311	50	20	IDGD	
CC[C@@H](C)Sc1ccc(NC(=O)C(=O)NNC(=O)C(=O)NC2CC2)c(C(F)(F)F)c1	782966052	KOIWOOFRPRTQTN-SECBINFHSA-N	446.451	1.961	50	20	IDGD	
O=C(CCOc1ccccc1I)NNC(=O)Cc1cccnc1	783287333	XKTSOKWNRKYWQJ-UHFFFAOYSA-N	425.226	1.845	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2cccc(S(=O)(=O)N3CCCCC3)c2)nc(C)n1	783326038	SAXNEJXWSKFWGY-UHFFFAOYSA-N	432.506	1.350	50	20	IDGD	
CCOC(=O)c1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)cc1	784212691	FAODRJMVNNUBRE-UHFFFAOYSA-N	446.485	1.386	50	20	IDGD	
CCOc1cc(N2CCN(C)CC2)ccc1NC(=O)C(=O)NNc1cccc([N+](=O)[O-])c1	784830677	AYEBSQFESVRIGV-UHFFFAOYSA-N	442.476	1.827	50	20	IDGD	
O=C(NNc1cc(F)c(F)c(F)c1)C(=O)Nc1cc(N2CCCS2(=O)=O)ccc1F	785087440	SDRPMYUMLZULAH-UHFFFAOYSA-N	446.382	1.865	50	20	IDGD	
Cc1c(NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cccc1N1CCNC1=O	786317261	UDUXPSANTXIVQI-UHFFFAOYSA-N	435.444	1.238	50	20	IDGD	
O=C(CCCc1nnc(-c2ccc(Cl)cc2Cl)o1)NNC(=O)C(=O)NC1CC1	786707084	YICSFNKAYQVJJY-UHFFFAOYSA-N	426.260	1.792	50	20	IDGD	
O=C(NN=CC1CCC2(CC1)OCCO2)c1cccc(S(=O)(=O)N2CCOCC2)c1	788699630	ZUEZKOZDBAIOLE-UHFFFAOYSA-N	437.518	1.356	50	20	IDGD	
Cc1ccc(-n2cccn2)cc1NC(=O)C(=O)NNC(=O)CN1CCCc2ccccc21	789585712	CHGWRFDWDFUNFW-UHFFFAOYSA-N	432.484	1.719	50	20	IDGD	
CN1C(=O)Cc2cc(NC(=O)C(=O)NNC(=O)c3cccc(Br)c3)ccc21	789732736	FMLMZIFEVHQKFU-UHFFFAOYSA-N	431.246	1.368	50	20	IDGD	
COc1cc(NNC(=O)C(=O)Nc2cc(S(=O)(=O)N(C)C)ccc2F)ccc1Cl	789797401	AJBBVXFYYMIETC-UHFFFAOYSA-N	444.872	1.820	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)nc1Br	793023759	VXEPQKQJINJMEA-UHFFFAOYSA-N	443.261	1.942	50	20	IDGD	
O=C(COC(=O)c1nc(Br)ccc1F)NNC(=O)c1ccc([N+](=O)[O-])cc1	795855806	IFPGTJAHDBNKGR-UHFFFAOYSA-N	441.169	1.509	50	20	IDGD	
O=C(COC(=O)c1cc(C2CC2)cnc1Cl)NNC(=O)[C@H]1COc2ccccc2O1	796174578	XKVZPQIOKWEPOI-MRXNPFEDSA-N	431.832	1.757	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)Nc1cc(F)c(Br)cc1Cl	799233192	DOTCMMULXAEPRO-LURJTMIESA-N	428.667	1.829	50	20	IDGD	
CCc1csc(CC(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)n1	801171271	ALVZNBJZHUARSW-UHFFFAOYSA-N	435.981	1.867	50	20	IDGD	
COc1ccc(CC(=O)NNC(=O)Nc2ccccc2)cc1S(=O)(=O)N1CCOCC1	801986518	OMLSABOQEAAFLP-UHFFFAOYSA-N	448.501	1.112	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)NC[C@H](c1ccc(C)o1)N1CCOCC1	807023096	ASRWOIPLYXPKLB-MRXNPFEDSA-N	432.477	1.379	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)c1cc(Br)cnc1OCC1CC1	807082111	MQJHZUIQTHUQNN-UHFFFAOYSA-N	448.277	1.219	50	20	IDGD	
CCCNC(=O)[C@@H]1CN(C(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2C)c2ccccc2O1	807455207	HIAAHLNNWZHZFU-SFHVURJKSA-N	441.444	1.667	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)CNS(=O)(=O)c3cccc(F)c3)n[nH]2)cc1	810584433	QXQNIFYZSQBEER-UHFFFAOYSA-N	445.476	1.518	50	20	IDGD	
COc1nccnc1NNC(=O)CNS(=O)(=O)c1cc(C(F)(F)F)ccc1Cl	811073944	HTSGUTBTFXUMMU-UHFFFAOYSA-N	439.803	1.579	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cn(Cc3ccccc3)nn2)c2ccccc2n1	815564647	OWBWCIFVLOPUBH-UHFFFAOYSA-N	429.440	1.583	50	20	IDGD	
CC(C)(C)[C@@H]1CCc2nc(NC(=O)C(=O)NNC(=O)[C@@H]3CCc4nncn4C3)sc2C1	815692495	SBGQSGHKSBIQAF-VXGBXAGGSA-N	445.549	1.234	50	20	IDGD	
CC(C)OCc1cccc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)N(C)C)c1	815751781	OAXMYCLMVIKCGX-UHFFFAOYSA-N	434.518	1.944	50	20	IDGD	
CN(C)c1ccc(C2(C(=O)NNC(=O)CN3CCN(C(=O)c4ccccc4)CC3)CC2)cc1	815827047	JWBZLXSOBGYRSR-UHFFFAOYSA-N	449.555	1.390	50	20	IDGD	
Cc1cc(Cn2nnc(C(=O)NNc3ccc(S(=O)(=O)C(F)F)cc3)c2C)on1	815854466	DAFYSQXEEKWDNK-UHFFFAOYSA-N	426.405	1.684	50	20	IDGD	
CN1CCN(Cc2cccc(C(=O)NNc3ccccc3S(=O)(=O)N(C)C)c2)CC1	817054613	QIMMVEQPSIDAPC-UHFFFAOYSA-N	431.562	1.441	50	20	IDGD	
CS(=O)(=O)Nc1ccc(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1	846291442	MQUMJODALMQDPJ-UHFFFAOYSA-N	445.545	1.031	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NN=Cc2ccc(-n3cncn3)c(F)c2)cc1	863966177	YYLMDECZJHZBGX-UHFFFAOYSA-N	430.465	1.486	50	20	IDGD	
C=CCn1c(=O)c2ccccc2n2c(SCC(=O)NNC(=O)c3cccnc3)nnc12	913109489	HJRNPVAOQHVASE-UHFFFAOYSA-N	435.469	1.179	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NN=C2CCN(S(=O)(=O)c3c(C)n[nH]c3C)CC2)cc1	914555258	MEMYNNWANLSRQE-UHFFFAOYSA-N	432.506	1.230	50	20	IDGD	
CC(=NNC(=O)[C@@H](C)Oc1cccc(C)c1C)c1ccc(S(=O)(=O)NCC(=O)O)cc1	916336748	NZVSPKCGXHWDBM-MRXNPFEDSA-N	447.513	1.974	50	20	IDGD	
O=C(NCCCn1cncn1)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	916376327	JBSICHAFBBKPSR-UHFFFAOYSA-N	446.475	1.014	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)N[C@H](CN1CCCC1=O)c1ccccc1	916460026	WWBXDBCONOXBNA-QGZVFWFLSA-N	434.456	1.643	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)NCc2ccc(S(=O)(=O)NC[C@H]3CCCO3)cc2)n1	916649739	RHWIDALVGVCAAL-MRXNPFEDSA-N	434.522	1.377	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)Nc1cccc(CN2CCC[C@H]2C(N)=O)c1	920930343	HGXAYZDZLCJNEZ-KRWDZBQOSA-N	441.488	1.377	50	20	IDGD	
CS(=O)(=O)Nc1ccccc1CNC(=O)NNC(=O)c1cccc(Br)c1	1116147566	YDIFRDYGCUDRPB-UHFFFAOYSA-N	441.307	1.965	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)Nc2cc(N3CCOC3=O)ccc2F)c2ccccc2c1=O	1320123926	XPXPAMYVAPDJJF-UHFFFAOYSA-N	440.391	1.496	50	20	IDGD	
COCCn1cc(NC(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)ccc1=O	1320407563	GRIPKRVANODBFL-UHFFFAOYSA-N	437.497	1.295	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2)c1csc2c1CCCO2	1777809791	WQQMHHUJLGNTAC-RZQQEMMASA-N	442.965	1.800	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2)c1cc(-c2ccco2)no1	1777838200	QFBJVVVRTJLHIN-JNAXZKDPSA-N	437.880	1.662	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2)c1ccncc1C(F)(F)F	1778270435	RTVOIRJMKIXZFK-IIDMSEBBSA-N	449.857	1.828	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cccc(N4CCOCC4)n3)CCO2)C1	1781219236	SSGVFHOETPXCKM-KKSFZXQISA-N	436.940	1.379	50	20	IDGD	
O=C(c1cnc2[nH]ncc2c1)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781329278	CILXNHGUJVYDJE-WBMJQRKESA-N	426.246	1.092	50	20	IDGD	
O=C(c1n[nH]c2c(Cl)cccc12)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1782215598	OPVJEDBFENMYRV-SCLBCKFNSA-N	427.288	1.260	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H]3CCCN3C(C)C)C2)C1	1784806798	KXAUJTRDRHTGNU-JTDSTZFVSA-N	430.387	1.863	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc4c3OCC4)C[C@@H]21	1786406771	CPGZTBUXLVDPFO-XIRDDKMYSA-N	437.334	2.000	50	20	IDGD	
COc1cccc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Br)C[C@@H]32)c1	1786527176	BMRWSEQEQRTSOW-MBGYTDRXSA-N	443.313	1.908	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3csc(N)n3)[C@H]2C1	1786912836	MCPJQLLFTPZGSQ-ZPFDUUQYSA-N	431.356	1.492	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc4[nH]ncc34)[C@H]2C1	1787312975	UCOBYLBAYKVNQD-LMMLAZSQSA-N	435.322	1.940	50	20	IDGD	
CC[C@H](C)CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)[C@H]2C1	1787507145	ZUHINKGECBYNNP-BQRDVNJZSA-N	431.537	1.536	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccncc3F)[C@H]2C1	1787752200	BTMTWQBUFNDSHY-DUPGQFARSA-N	428.302	1.845	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3n[nH]c4c3CC[C@H]4C)[C@H]2C1	1787953307	PDPFCHZKWQQROF-MUGBGTHKSA-N	439.354	1.836	50	20	IDGD	
COc1cnc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]3C2)c(F)c1	1788761377	WPQWJYLFOGNSNS-QRTARXTBSA-N	439.560	1.674	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)c1cc(Cl)ncn1	1789056554	RGLVSTXOWMLHJS-GVXVVHGQSA-N	431.718	1.508	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)COc3ccc(O)cc3)C[C@@H]21	1789867938	NKOSCFLCIKGCLZ-VZYKRBATSA-N	445.343	1.987	50	20	IDGD	
NC[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]2C1)c1ccccc1	1789923085	XVYAWOCSYSQMGQ-QEOTZNIISA-N	442.329	1.399	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4n[nH]cc4c3)C[C@@H]21)[C@@H](F)Br	1789923184	WVLWKOONRLBWRH-DLKVLKDVSA-N	439.285	1.847	50	20	IDGD	
C[C@@H](Oc1cccnc1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]2C1	1789926915	LEXPWLPOJMZJIX-MLEONAHRSA-N	444.301	1.519	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cn(C)nc3C(F)F)C[C@@H]21	1791057154	FKCJIALWPGPAJX-BLFANLJRSA-N	449.296	1.734	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@@H](C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)C(Cl)Cl)C[C@@H]32)C1	1791247572	LASRWUIJWYWQIK-MRLBHPIUSA-N	435.348	1.749	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1(C)COC1	1792697038	DGSGEDIUNGZBML-QDMKHBRRSA-N	431.445	1.808	50	20	IDGD	
Cc1c(Cl)cccc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(B(O)O)cc1)C2	1792744344	PTWPHAKMQQPXHT-BCDXTJNWSA-N	426.709	1.894	50	20	IDGD	
O=C(CCCn1c(O)nc2ccccc21)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCl	1793115507	PTZYPPRURUCFAC-KRXQYRFLSA-N	434.924	1.760	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cc1cnc[nH]1)C2	1794142183	RLORSOIRLLTKLU-UKMLZYKCSA-N	439.944	1.723	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnn(-c2cccnc2)c1	1794442654	INBALZBPAKZYRR-UKBAYJJMSA-N	431.924	1.878	50	20	IDGD	
Cc1nn(-c2ccccc2)c(O)c1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](O)CCl)C2	1794632296	YZMUKOLNKJLEOR-ORQFMDKSSA-N	432.908	1.738	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccon1	1794925301	KPLFMGZVCOFVGY-IVWMJMPLSA-N	444.400	1.025	50	20	IDGD	
COc1ccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)CBr)C3)cc1	1795257849	GLUWATRARMFDCX-AMVTXUCVSA-N	439.350	1.858	50	20	IDGD	
CCc1[nH]nc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)Br)C3)c1Cl	1795904752	ZZWDJRPBZFOFLP-XHSYRHOGSA-N	433.734	1.612	50	20	IDGD	
N=C(N)NCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](Br)Cc1ccccc1)C2	1795985133	BSDYITGGRSIXKE-QKPAOTATSA-N	436.354	1.114	50	20	IDGD	
CCCOc1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)cc1	1796188536	RMQPAXMTCJYSEK-WKCHPHFGSA-N	436.317	1.721	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cn(C)c2ncccc12	1797577626	RECKHBJXZNQPOC-NFFDBFGFSA-N	435.322	1.560	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C[C@@H]1CNc2ccccc2O1	1798368865	NMNBIPVPGGRNMM-XMTFNYHQSA-N	443.548	1.261	50	20	IDGD	
COc1cccc(OC)c1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CO[Si](C)(C)C)C2	1798825940	UYIFQUWSBWCKJM-YVWYUNDQSA-N	436.581	1.759	50	20	IDGD	
C=CCC(CC=C)C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1803082069	NICHMTPVDRQSMV-GGAORHGYSA-N	447.344	1.849	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2nc3ccccc3[nH]2)[C@H]1c1cccnc1)[C@@H](O)CCl	1803139497	PZKYYMRTWDEDRP-WBAXXEDZSA-N	427.892	1.877	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc3cnccc3n2)[C@H]1c1cccnc1)[C@H](O)CCl	1803139794	WACOAVHTACJSRV-DBVUQKKJSA-N	439.903	1.944	50	20	IDGD	
CC(C)(C)n1ccc(C(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)n1	1803141515	OLXBNADQTILDTA-NJAFHUGGSA-N	433.940	1.952	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@H](C(=O)N2CCC3(CCCN(C(=O)[C@H](O)CCl)C3)CC2)C1	1805527873	FTGBCTBKVYIOCG-GVDBMIGSSA-N	428.957	1.797	50	20	IDGD	
COc1cnc(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](C)Br)[C@@H]2c2cccnc2)cn1	1806046568	JXQNOWDIKZJACX-HACGYAERSA-N	448.321	1.983	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H]1C(=O)N1CCCC2(CCN(C(=O)[C@@H](O)CCl)CC2)C1	1806405455	NPHRLXWGYRBMNV-CVEARBPZSA-N	443.972	1.827	50	20	IDGD	
CN1Cc2ccccc2C[C@@H]1C(=O)N1CCCC2(CCN(C(=O)[C@@H](O)CCl)CC2)C1	1806680045	LRXCENNTORHDIY-UXHICEINSA-N	433.980	1.874	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H](CNC(=O)Cn2cncn2)[C@H]1c1cccnc1	1807604833	WYSAOXFWMAQIJU-HLLBOEOZSA-N	435.326	1.553	50	20	IDGD	
O=C(CCN1CCOC1=O)NC[C@H]1CCN(C(=O)C(Cl)Cl)[C@H]1c1cccnc1	1809532085	JTLQCEXXDOLSAY-HIFRSBDPSA-N	429.304	1.733	50	20	IDGD	
CNc1ccc(C(=O)N2CCC3(CCCN(C(=O)c4ccc(B(O)O)cc4)C3)CC2)cc1	1809967079	RHAVHVQYTNXHFD-UHFFFAOYSA-N	435.333	1.567	50	20	IDGD	
Cc1nc(C(=O)N2CC[C@H](CNC(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)co1	1810298426	IMAUQPOHUPQFQQ-BEFAXECRSA-N	449.471	1.010	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)[C@H]2CCC(=O)N2)[C@H]1c1cccnc1	1812774697	CWWLAUBMLLZFIH-MPTYRVRUSA-N	437.338	1.540	50	20	IDGD	
CCC(=O)N[C@H](C)C(=O)N1CC[C@H](CNC(=O)[C@@H](C)Br)[C@@H]1c1cccnc1	1812863807	CYCOOOIWEHZZGW-SMKXDYDZSA-N	439.354	1.786	50	20	IDGD	
CSCC[C@H](O)C(=O)N1CC[C@H](CNC(=O)[C@H](C)Br)[C@H]1c1cccnc1	1812868012	RAUKRSFWMZVQQN-DRPJVOAASA-N	444.395	1.985	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)/C=C/c2ccoc2)[C@H]1c1cccnc1	1813071725	WHTUAWSPEDRCMU-FDJIPLHRSA-N	439.516	1.767	50	20	IDGD	
C[C@H](CBr)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H]2CCC(=O)N2)[nH]n1	1814780332	MBAAHPSAFUUWCZ-NQBHXWOUSA-N	426.315	1.711	50	20	IDGD	
O=C(NCCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](O)CCl)n[nH]1)c1ccc[nH]1	1814866997	BTBZXYOLPGOZJS-HUUCEWRRSA-N	436.900	1.150	50	20	IDGD	
N[C@H](C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCBr)CC2)c1ccccn1	1815011780	HXWMHVVKQIHLIH-BMIGLBTASA-N	438.351	1.935	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](O)CCl)CC2)[C@@H]1Cc2ccccc2CN1	1817030330	IJGAYUNCBOMFBI-BPUTZDHNSA-N	434.949	1.369	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1)c1ccccc1-n1nccn1	1821203622	CZWYLLKLQOQJFE-IAGOWNOFSA-N	443.895	1.896	50	20	IDGD	
Cc1c(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)cnn1C	1822413421	VKTZCUDAIXSWFP-MRXNPFEDSA-N	430.513	1.131	50	20	IDGD	
C[C@@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1)n1cccn1	1822802408	GNHFCDDCKSGXTH-HOCLYGCPSA-N	430.513	1.233	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)C[C@H]2NC(=O)NC2=O)CC1	1824610134	WVLVZGNITDYPRV-XHSDSOJGSA-N	426.945	1.612	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCc1nc(N)n[nH]1)CC2	1825642621	SARSNIQRQYGMGI-JGVFFNPUSA-N	442.343	1.172	50	20	IDGD	
C=CCNC(=O)/C=C\C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](Cl)COC)sc2C1	1825990894	GHJQYGKHZQHWNG-PBWNMSGQSA-N	426.926	1.167	50	20	IDGD	
COC[C@@H](NC(C)=O)C(=O)N1CCC([C@H]2CCCCN2C(=O)CCBr)CC1	1826358614	JDZVVANGAWCWCE-IAGOWNOFSA-N	446.386	1.542	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H]3CCc4nc[nH]c4C3)sc2C1	1826626155	RQOMJGVYVZBZPT-UTUOFQBUSA-N	437.953	1.837	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3c(C)noc3C)CCO2)C1	1832553057	IOOBRPFJSBVDCP-YLJYHZDGSA-N	427.929	1.698	50	20	IDGD	
CC(=O)N[C@@H](C)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](C)CBr)CC2)CC1	1833265000	UWNXXUJEGXPEOG-KBPBESRZSA-N	445.402	1.114	50	20	IDGD	
C[C@@H](C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)CCl)CC2)CC1)n1cccc1C=O	1833310475	KSGBUHCTXKTEIM-HNAYVOBHSA-N	438.956	1.033	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)CC3Cc4ccccc4C3)CC2)CC1)[C@H](O)CCl	1833313751	PQRVQVSTDWIVCF-JOCHJYFZSA-N	448.007	1.963	50	20	IDGD	
CC(=O)C(C)(C)C(=O)NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1	1833408522	KZLZEQLFTRACLW-UHFFFAOYSA-N	430.387	1.958	50	20	IDGD	
N[C@@H](C(=O)NC1CCN(C2CCN(C(=O)C(Cl)Cl)CC2)CC1)c1ccccn1	1834725697	GSTGIOUJJJQYDN-MRXNPFEDSA-N	428.364	1.457	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cc4cccnn4n3)CC2)CC1	1836079581	NQCWVBKEHMDYHK-GOSISDBHSA-N	448.955	1.168	50	20	IDGD	
O=C(c1cccc2ccnn12)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836719505	UTOJJOIJJUIQFS-LJQANCHMSA-N	434.924	1.546	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4nccn4c3)C2)C1	1837713052	FBWBBAUFWMWDAK-NRFANRHFSA-N	446.580	1.256	50	20	IDGD	
CC[C@@H](NC(N)=O)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](C)Br)CC2)CC1	1838069569	WMOARLAUSOZRKJ-IUODEOHRSA-N	447.374	1.215	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)c3cccnn3)CC2)CC1	1838453504	LZPQFWHNPFHCSB-CYBMUJFWSA-N	425.327	1.872	50	20	IDGD	
O=C(c1cc[n+]([O-])cc1)N1CCC(OC2CCN(C(=O)[C@H](F)Br)CC2)CC1	1838508908	UNKPHBAYBBJRSX-INIZCTEOSA-N	444.301	1.623	50	20	IDGD	
O=C(c1cc2ncccc2[nH]1)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1839493661	PQKPFOPNQUROEX-GOSISDBHSA-N	427.288	1.437	50	20	IDGD	
C=CCC(F)(F)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1	1839889865	UDJRFIVNIFLKTH-JKSUJKDBSA-N	429.291	1.891	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(F)cn3)C2)C1	1839963870	ZEAPLYCRRWDKQZ-KDOFPFPSSA-N	444.301	1.464	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CC3(F)F)C2)C1	1839965475	ZKWKWNZMJQAOMP-TYNCELHUSA-N	425.270	1.272	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3nc4ccccc4o3)C2)C1	1840154600	ADGXRVXLSAKDLM-VBKZILBWSA-N	437.880	1.152	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(OC)c3F)C2)C1	1840156231	LCIZZMNMABMLPX-YWZLYKJASA-N	444.887	1.158	50	20	IDGD	
O=C(COc1ccc(O)cc1)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840186649	BZVUKCXZMPRUFQ-SFHVURJKSA-N	433.288	1.031	50	20	IDGD	
C[C@@H](Oc1ccccc1)C(=O)N1CCOC[C@]2(CN(C(=O)C(Cl)Cl)CCO2)C1	1840189385	OLHMEGZTXOJVPM-AUUYWEPGSA-N	431.316	1.714	50	20	IDGD	
C[C@@H](Oc1cccnc1)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1840450212	VRHNMZBEZNRBCJ-IERDGZPVSA-N	439.940	1.570	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H]1C(=O)N1CCCC12CN(C(=O)[C@@H](F)Br)C2	1841766986	XZYZWFGZQXDYQT-NWDGAFQWSA-N	434.306	1.890	50	20	IDGD	
O=C(c1cccc(-c2ccccc2)n1)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843011403	ZJKVAFABBKEHMH-UHFFFAOYSA-N	441.296	1.559	50	20	IDGD	
Cn1c(=O)c(C(=O)N2CCCC23CN(C(=O)CCBr)C3)nc2ccccc21	1843743379	TYSPIUDBOFZFGK-UHFFFAOYSA-N	433.306	1.536	50	20	IDGD	
COc1ccccc1CCC(=O)N1CC2(CCCN2C(=O)c2cnccc2C(=O)NN)C1	1844263405	AOIPTNMLNYPFHD-UHFFFAOYSA-N	437.500	1.144	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)[C@@H]2[C@H]3Sc4ccccc4[C@@H]32)C1	1844272208	BQOQUOFRJTZTQD-QYZOEREBSA-N	449.536	1.390	50	20	IDGD	
CC(C)n1nc(C(=O)N2CC3(CCCN3C(=O)[C@@H](F)Br)C2)cc1C(=O)O	1845216815	MSUHEWOQQXISIJ-GFCCVEGCSA-N	431.262	1.670	50	20	IDGD	
CNC(=S)NCCC(=O)N1CC2(CCCN2C(=O)/C(C#N)=C/c2ccc(F)cc2F)C1	1845871367	RPLFBRBWHUKFOJ-OQLLNIDSSA-N	447.511	1.559	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2cc(Cl)ccc2O)cc(S(=O)(=O)N(C)C)c1C	10624728	MQKBGFJVAQCYAD-UHFFFAOYSA-N	425.894	1.988	50	20	IDGD	
Cn1c(=O)n(CCC(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)c2ccccc21	11962588	MGDXYGMNMLTHDS-UHFFFAOYSA-N	430.848	1.388	50	20	IDGD	
Cc1cc([N+](=O)[O-])cc(S(=O)(=O)NNC(=O)c2csc(N3CCOCC3)n2)c1C	15244861	PUUGHBQQCYXEKJ-UHFFFAOYSA-N	441.491	1.128	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1nc(C)n(-c2ccc(F)cc2)n1	16177521	RBBYFGICPAJEPG-UHFFFAOYSA-N	445.480	1.391	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)[C@@H]2CN(C(C)=O)c3ccccc3O2)cc1	18071421	USAFVYCJXRDNIL-XOBRGWDASA-N	427.457	1.814	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)OCC(=O)N[C@@H]2CCS(=O)(=O)C2)c(C)n1CCC(C)C	33447867	ZRGLWZWYXSQRBH-XLYVWGIVSA-N	435.546	1.905	50	20	IDGD	
CN1CCN(CCCCNC(=O)NNC(=O)c2ccc(COc3ccccc3)o2)CC1	60381609	UTKJPMYBZWLVFF-UHFFFAOYSA-N	429.521	1.830	50	20	IDGD	
CC(C)c1ccccc1NC(=S)NNC(=O)[C@@H]1CC(=O)N([C@H]2CCS(=O)(=O)C2)C1	727171858	OHWDSXSBGQOLII-KGLIPLIRSA-N	438.575	1.163	50	20	IDGD	
CCOc1cc(C(=O)NNS(=O)(=O)c2cnn(CC)c2)cc(OCC)c1OCC	727349742	HODNZVAPJIAEMX-UHFFFAOYSA-N	426.495	1.722	50	20	IDGD	
O=C(Cc1nn2c(C3CCCCC3)nnc2s1)NNC(=S)NCCc1cccnc1	727691394	UPUAPXKXNNYKFU-UHFFFAOYSA-N	444.590	1.909	50	20	IDGD	
COc1ccc(CCNC(=O)NNC(=O)c2ccc3c(c2)OCCO3)c(OC)c1OC	727847102	UWQQARHHTITHSA-UHFFFAOYSA-N	431.445	1.670	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=S)NCC3CCC3)CC2)cc1C	727866404	GLYXFSNRGKGOPU-UHFFFAOYSA-N	438.619	2.000	50	20	IDGD	
COc1cccc(CO[C@@H](C)C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1	728326015	AWUDBYAIAAYXRX-IFXJQAMLSA-N	444.440	1.131	50	20	IDGD	
CCOC(=O)C1=NN(c2ccccc2)[C@H](C(=O)NNC(=O)CCc2ccc(OC)cc2)C1	728471001	VIYMXKQIKJHYSE-FQEVSTJZSA-N	438.484	1.973	50	20	IDGD	
O=C(NCCNS(=O)(=O)c1ccccc1)NNC(=O)c1cccc(OC(F)F)c1	728598553	GHNFLGLGMQQMPI-UHFFFAOYSA-N	428.417	1.211	50	20	IDGD	
CCn1cnc2c1c(=O)n(CC(=O)NN=Cc1cccnc1C)c(=O)n2Cc1ccccc1	728778743	GGADJZVHSSFVRE-UHFFFAOYSA-N	445.483	1.282	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)/C=C\c1ccccc1)C(=O)NNC(=O)Cc1cccnc1	728893379	JQVLRADBMXYFHP-GFBZKKKVSA-N	448.570	1.484	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCCCN2CCC[C@H](C(N)=O)C2)ccc1OC(C)C	729505515	LCLKPLLATGWBAH-INIZCTEOSA-N	435.525	1.014	50	20	IDGD	
CC[C@@H]1Nc2ccc(C(=O)OCC(=O)NNC(=O)Cc3nc(C)cs3)cc2NC1=O	729720813	PACQMKZFLLJTFE-LBPRGKRZSA-N	431.474	1.141	50	20	IDGD	
CSCC[C@@H](C(=O)NNC(=O)CCc1ccccc1O)N1C(=O)c2ccccc2C1=O	730034138	VLNRDKVMDYMTMB-KRWDZBQOSA-N	441.509	1.890	50	20	IDGD	
CCOc1cccc2cc(C(C)=NNC(=O)CSc3nn(C)c(=O)n(C)c3=O)oc12	730570866	MPKVOTYPUPLNDB-UHFFFAOYSA-N	431.474	1.256	50	20	IDGD	
O=C(/C=C\c1ccc(I)o1)NNC(=O)COc1ccccc1O	730782122	HYDNSNNTJBCDKP-VURMDHGXSA-N	428.182	1.829	50	20	IDGD	
N#CCNC(=O)COC(=O)/C(C#N)=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	731233115	DWLQTPBIJLSDAB-ZROIWOOFSA-N	440.847	1.169	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)[C@H](C)N1CCN(c2ccc(F)cc2)CC1	732257686	YJEYGARWJKYXDJ-INIZCTEOSA-N	430.480	1.571	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)C2CCN(C(=O)OCc3ccccc3)CC2)C[C@@H](C)O1	732262059	IIAWSXANGVALNM-QZTJIDSGSA-N	446.548	1.682	50	20	IDGD	
C[C@@H]1C[C@@H]1C(=O)Nc1cccc(C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c1	732327830	MEVCAFHREOQYAS-PXAZEXFGSA-N	440.412	1.807	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2ccc3c(c2)N(C(C)=O)CC3)cc(OC)c1OC	734414368	HSIPHVXJTJUPSK-UHFFFAOYSA-N	449.485	1.245	50	20	IDGD	
C=CC[C@@H](NC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)c1ccncc1	734678356	GJLNQXUMQKYOEY-GOSISDBHSA-N	445.549	1.356	50	20	IDGD	
O=C(CC12CC3CC(CC(C3)C1)C2)NNC(=O)N[C@@H]1CCN(CCN2CCOCC2)C1	734686458	ODZBHBBHFFYFKF-LIPMQLJGSA-N	433.597	1.330	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)N[C@@H]3CCN(CCN4CCOCC4)C3)cc2C1	734686737	TUHIQNSMLZEOQY-DOTOQJQBSA-N	435.594	1.223	50	20	IDGD	
CC(C)COc1ccc(C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)cc1	735117329	REHGXPYMVGGJNQ-UHFFFAOYSA-N	447.561	1.809	50	20	IDGD	
COc1ccc([C@H](CNC(=O)NNC(=O)COCc2ccccc2)N2CCOCC2)cc1	738963210	MDWFNKMLXKXWFL-NRFANRHFSA-N	442.516	1.616	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNS(=O)(=O)c2ccc(C#N)cc2F)cc1	739667415	NWQANJASSLJMLS-UHFFFAOYSA-N	446.489	1.741	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)CC[S@](=O)c2ccc3c(c2)OCCO3)cc1OC	740749174	OODRDCBPJWWOCE-HKBQPEDESA-N	448.497	1.824	50	20	IDGD	
O=C(NC[C@H](O)c1c(Cl)cccc1Cl)NNC(=O)c1ccc(-n2cnnn2)cc1	740903234	LAFCPHXHOAMTKY-AWEZNQCLSA-N	436.259	1.647	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@H]2CN(Cc3ccccc3)CCO2)cc(OC)c1OC	741172264	PTDUOFFHWDHOMN-LJQANCHMSA-N	429.473	1.374	50	20	IDGD	
O=C(NNC(=O)c1cccc2ccccc12)c1sccc1S(=O)(=O)N1CCOCC1	741576890	SHCWGIZJGXTPFH-UHFFFAOYSA-N	445.522	1.997	50	20	IDGD	
Cc1ccc([C@H](CN2CCOCC2)NCC(=O)NNC(=O)Cc2nc(C)cs2)cc1	741907819	WFXZZIOLVCBXTC-SFHVURJKSA-N	431.562	1.113	50	20	IDGD	
Cc1nn(C)c2sc(C(=O)N[C@@H](C)C(=O)NNC(=O)COCc3ccccc3)cc12	742078324	FADIJRBXOHEPBJ-ZDUSSCGKSA-N	429.502	1.426	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C[C@H](C)/N=C2/NS(=O)(=O)c3ccccc32)c1	742471246	BFZVIPSFWLSQFK-AWEZNQCLSA-N	430.486	1.039	50	20	IDGD	
COCCOc1ccc(CNC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)cn1	743536187	FVUDWAQLGKLVSW-UHFFFAOYSA-N	437.478	1.046	50	20	IDGD	
CS(=O)(=O)Nc1ccc(O)c(C(=O)NNC(=O)c2cccc(Br)c2)c1	743731301	OKAUXSOMMNRHCY-UHFFFAOYSA-N	428.264	1.601	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1cccnc1N1CCCC1	744619663	UYYPIAWYIQPTBI-UHFFFAOYSA-N	431.518	1.460	50	20	IDGD	
COc1cc(C(=O)NNC(=O)N[C@@H]2CCN(c3cc(C)nn3C)C2=O)ccc1OC(C)C	745905918	OJXMPEBXFACSRP-OAHLLOKOSA-N	444.492	1.274	50	20	IDGD	
O=C(Nc1sc2c(c1C(=O)NNC(=O)N1CCOCC1)CCCC2)c1cccnc1	745986505	XINVNIIKMLGCOL-UHFFFAOYSA-N	429.502	1.961	50	20	IDGD	
CCOc1ccccc1OS(=O)(=O)c1cccc(C(=O)NNC(=O)N2CCOCC2)c1	745996152	OXOXUYYUVNOPBO-UHFFFAOYSA-N	449.485	1.540	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)C[C@H]1CN(Cc2ccccc2)CCO1	746270431	XPTLLFLYHYHRPN-KRWDZBQOSA-N	435.525	1.133	50	20	IDGD	
CSCc1noc(CCC(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)n1	747375056	KKWZLGKGQXBLPQ-UHFFFAOYSA-N	430.490	1.617	50	20	IDGD	
C[C@@H](C(=O)NNc1ccc(F)cc1Br)N1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O	748074316	XZFWPYQTAFFQIP-AJVHJNHVSA-N	426.242	1.582	50	20	IDGD	
O=C(CCN1CCN(C(=O)[C@@H]2CCCO2)CC1)NNc1ccc(OC(F)(F)F)cc1	748501149	DWDBKICLDDKRBR-INIZCTEOSA-N	430.427	1.742	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)[C@H]2CCCN2S(=O)(=O)c2cccs2)cc1	749126649	QDAMWXVSQKGYGK-MRXNPFEDSA-N	437.543	1.690	50	20	IDGD	
COC(=O)Cc1cc(=O)n(-c2ccc(C(=O)NNC(=O)c3cc4ccccc4o3)cc2)[nH]1	749474306	JLYGDFXQYOTMPZ-UHFFFAOYSA-N	434.408	1.702	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)[C@@H]1CCCN1C(=O)c1ccc2c(c1)OCO2	749562388	WGENIWVCRJLZML-HNNXBMFYSA-N	429.404	1.385	50	20	IDGD	
O=C(CCn1nnc2ccccc2c1=O)NNc1nc(Br)cn2ccnc12	750248162	KTVJVLRXFADHSM-UHFFFAOYSA-N	429.238	1.130	50	20	IDGD	
N#Cc1ccc(S(=O)(=O)NNC(=O)[C@H]2Cc3ccccc3CN2Cc2ccccc2)cn1	751276582	UFUONEQWENSFFF-JOCHJYFZSA-N	447.520	1.890	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNS(=O)(=O)c1cnn([C@@H]2CCOC2)c1	751537817	ANFCHQFSGKFFJY-CQSZACIVSA-N	433.515	1.900	50	20	IDGD	
O=C(NNC(=O)c1cc(Cn2cc(Br)cn2)on1)c1ccc(Cl)nc1	751629100	KDTHYAFZMROFOT-UHFFFAOYSA-N	425.630	1.805	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)N[C@@H](CC)C(=O)N2CCOCC2)cc1OC	753057649	MZKRLEVNAQKLOT-INIZCTEOSA-N	436.509	1.456	50	20	IDGD	
O=C(NNC(=O)N1CCS(=O)(=O)[C@H]2CCCC[C@@H]21)c1ccc(Br)s1	753811331	SSJUKALNEVDBKX-ONGXEEELSA-N	436.353	1.907	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)N[C@@H]1[C@@H]2CCO[C@@H]2C12CCC2	754677869	ZBWYTPDRYZXTMT-KSZLIROESA-N	448.545	1.373	50	20	IDGD	
O=C(Cc1cc[nH]n1)NNC(=O)c1cnn(-c2ncccc2Cl)c1C(F)(F)Cl	755277920	XMDFRRBLMWYATF-UHFFFAOYSA-N	430.202	1.936	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)Nc1cc(S(=O)(=O)N2CCCCC2)ccc1N(C)C	755434581	ITMLAGFDZBUUBP-UHFFFAOYSA-N	449.537	1.425	50	20	IDGD	
O=C(CSc1nc(-c2ccccc2)no1)NNC(=O)C(=O)NCc1ccc(Cl)cc1	755845441	WGYILTFINDJYCA-UHFFFAOYSA-N	445.888	1.946	50	20	IDGD	
CN1C(=C(C#N)C(=O)COC(=O)c2coc(S(=O)(=O)N(C)C)c2)N(C)c2ccccc21	756296159	XRPWGSGGNFBISZ-UHFFFAOYSA-N	444.469	1.577	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2C[C@@H](C)C(=O)N(C)c3ccccc32)cc1OC	756602762	XMYQKJZBBKUTHT-CQSZACIVSA-N	426.473	1.584	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)[C@](C)(O)CN2Cc3ccccc3C2=O)cc1	756797860	SXGDHXDCYQWAKS-NPMXOYFQSA-N	441.484	1.407	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2ccc3c(c2)OCCO3)ccc1Cl	757473527	QCGJMFWNBWXPBZ-UHFFFAOYSA-N	426.834	1.521	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)Nc2c(-c3cnn(C)c3)nc3ccccn23)c1	757664073	MGWHSQWGURNIKA-UHFFFAOYSA-N	433.432	1.555	50	20	IDGD	
CC1(C)CCCC[C@@H]1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	757751338	SNHHYLHDPJRYKI-KRWDZBQOSA-N	438.550	1.620	50	20	IDGD	
CCOC(=O)Cn1cccc(NC(=O)NNC(=O)CCSc2ccc(F)cc2)c1=O	757765749	XJDKWUZCNUXXHF-UHFFFAOYSA-N	436.465	1.886	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)nn1-c1ccc(Cl)c(Cl)c1	758038401	DVCYLVIWQZVJID-VIFPVBQESA-N	434.305	1.186	50	20	IDGD	
O=C([C@H]1CC(=O)N(c2ccccc2F)C1)N1CCN(S(=O)(=O)CBr)CC1	758523299	ODJPXSOGJBRXNG-LBPRGKRZSA-N	448.314	1.005	50	20	IDGD	
Cn1nc(SCC(=O)NN=C2CCCc3c(Cl)sc(Cl)c32)c(=O)n(C)c1=O	760240401	VMUIPHZUBPJRBX-UHFFFAOYSA-N	448.357	1.796	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1c(C)nc2ccnn2c1C	760592952	YPHAXVWVHCKCGM-UHFFFAOYSA-N	431.836	1.626	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1cccc([C@@H]2CCOC2)c1	761486572	BWYUMXIRMFLRIY-OAQYLSRUSA-N	436.512	1.410	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)NNC(=O)CSc2ccccc2OC)ccc1F	761622304	RRUJYEQANUEUIH-UHFFFAOYSA-N	427.479	1.296	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)N[C@@H]1CCCN(c2ccccc2F)C1=O	761815363	HXPYZPPARNMJJE-MRXNPFEDSA-N	425.420	1.602	50	20	IDGD	
C[C@@H]1OC(C)(C)N(C(=O)OC(C)(C)C)[C@H]1CNC(=O)NN[C@@]1(C)CCS(=O)(=O)C1	762323900	ARXRIWGVKGYHOO-LXIYXOSZSA-N	434.559	1.128	50	20	IDGD	
O=C(NNc1nccc(N2CCOCC2)n1)C1CCN(C(=O)OCc2ccccc2)CC1	762854959	AXOSJQGRHFOURW-UHFFFAOYSA-N	440.504	1.805	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)NNc1nccc(N2CCOCC2)n1	762869282	UMDOUYVKGLTZIK-KRWDZBQOSA-N	442.520	1.892	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1cc(F)ccc1Br	763471870	ZPTBWGGCWKXOAL-UHFFFAOYSA-N	425.170	1.896	50	20	IDGD	
NC(=O)CCOc1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2Br)cc1	763483176	OIRQTMHPVSSIIW-UHFFFAOYSA-N	449.261	1.103	50	20	IDGD	
Cc1ccc(C(=O)NCC(F)(F)F)cc1NC(=O)C(=O)NNC(=O)c1ccccc1F	763555637	IUQXZOPIIOXCAX-UHFFFAOYSA-N	440.353	1.826	50	20	IDGD	
CC(C)n1nnnc1-c1ccccc1NC(=O)C(=O)NNC(=O)c1ccc2c(c1)OCO2	763558945	ODOHNAHOQCOOAE-UHFFFAOYSA-N	437.416	1.049	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(F)c(C(=O)OC)c1	763685254	SLJNYPOAMQEMJT-UHFFFAOYSA-N	433.392	1.176	50	20	IDGD	
NC(=O)COc1cccc(NC(=O)C(=O)NNC(=O)CC23CC4CC(CC(C4)C2)C3)c1	763752546	HMPDNDMNFWSHAG-UHFFFAOYSA-N	428.489	1.243	50	20	IDGD	
CSc1c(F)cc(NC(=O)C(=O)NNC(=O)c2nnc(O)c3ccccc23)cc1F	763790793	OLHKPVPXGYWBOT-UHFFFAOYSA-N	433.396	1.735	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cc(C#N)ccc2OCC)cc1	763859481	CDPTWHKCWFVJGY-CQSZACIVSA-N	440.456	1.909	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2c[nH]nc2-c2ccccn2)cc1	763861838	QZJMJYJQOWVSQT-CYBMUJFWSA-N	438.444	1.424	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccn(-c3ccncc3)n2)cc1	763876480	DYYKNRGRTLSXQS-CQSZACIVSA-N	436.428	1.023	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)OC[C@@H]2COC(=O)O2)cc1	763892685	REXOMVNUOKBXBI-LEHPZIBWSA-N	440.412	1.420	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2sc(-c3ccccc3)nc2C)ccc1C(N)=O	763899959	FHBUDOGPWAPECC-UHFFFAOYSA-N	437.481	1.926	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cnc3c(cnn3C(C)C)c2)cc1OC	763902838	YKJYEGAPXHDZPV-UHFFFAOYSA-N	440.460	1.819	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)C(=O)Nc1ccc2c(c1)OC1(CCCC1)O2	763921220	JJMGPLIPXIEODL-UHFFFAOYSA-N	449.427	1.104	50	20	IDGD	
Cc1nnnn1-c1cc(NC(=O)C(=O)NNC(=O)Cc2ccc(Cl)cc2)ccc1F	763936982	SXWOYXKMZGIJQA-UHFFFAOYSA-N	431.815	1.092	50	20	IDGD	
Cc1ccc(Cn2nccc2NC(=O)C(=O)NNC(=O)C2=S=C3CC[C@@H](C)CC3=C2)o1	763938146	ASNMLKJPOPGJSP-GFCCVEGCSA-N	441.513	1.757	50	20	IDGD	
O=C(Cc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1ncn(Cc2ccc(Cl)cc2)n1	763942344	UZYBKAXQAYQVEJ-UHFFFAOYSA-N	447.282	1.962	50	20	IDGD	
C[C@H]1CN(C(=O)c2ccc(NC(=O)C(=O)NNC(=O)Cc3ccsc3)cc2)C[C@@H](C)O1	764034165	GQUXQIBZFNOKME-OKILXGFUSA-N	444.513	1.326	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2cccc3ccccc23)cc1OCC(N)=O	764058237	NGTVDOILHJQRIL-UHFFFAOYSA-N	436.424	1.112	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)CCC(=O)N3C)o1	764138858	KRUYRFMUDAVHQY-UHFFFAOYSA-N	441.488	1.430	50	20	IDGD	
COC(=O)c1cc(Cl)cc(NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)c1	764242357	FATVIGMZVDCVOS-UHFFFAOYSA-N	428.832	1.867	50	20	IDGD	
O=C(NNC(=O)c1cccc2ncccc12)C(=O)Nc1ncn(Cc2ccc(Cl)cc2)n1	764258876	BXLHTKUCCFPBCZ-UHFFFAOYSA-N	449.858	1.928	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)C(=O)Nc1ccccc1S(=O)(=O)C(F)F)c1ccccc1	764331856	IUUFYEZPEIANCH-CYBMUJFWSA-N	439.440	1.963	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(NC(=O)CN3CCCCCC3)c2)o1	764368797	ZSXBQHRJPLRWAE-UHFFFAOYSA-N	441.488	1.802	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3ccc(Br)cn3)CC2)cc1	765747166	DEZQXYXQCMLBJR-UHFFFAOYSA-N	446.349	1.731	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)N[C@@H]1CCO[C@H](C2CC2)C1	765905950	RATFQEWVXIRGDP-AEFFLSMTSA-N	436.534	1.373	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNS(=O)(=O)c2cc([N+](=O)[O-])c(O)cc2C)cc1	766312497	TXYZPDHQLISVCW-LBPRGKRZSA-N	439.446	1.785	50	20	IDGD	
CC(=NNC(=O)Cc1cc(C)[nH]n1)c1ccc(S(=O)(=O)N2CCC(C(=O)O)CC2)cc1	767403263	KBUVDJYRAFNUSZ-UHFFFAOYSA-N	447.517	1.286	50	20	IDGD	
COc1cc2c(cc1NC(=O)NNC(=O)c1nn(-c3ccccc3)cc1O)NC(=O)CC2	767952099	FNYYGXDJGJZHRO-UHFFFAOYSA-N	436.428	1.938	50	20	IDGD	
COc1ccccc1NC(=S)NNC(=O)c1ccc(N2C(=O)CCC2=O)c([N+](=O)[O-])c1	768197439	PXFGTIDCUMFNDN-UHFFFAOYSA-N	443.441	1.888	50	20	IDGD	
NS(=O)(=O)c1cccc2c(C(=O)NNC(=O)c3cc(-c4cccs4)[nH]n3)nccc12	768487880	MOABPOMQDIMXOO-UHFFFAOYSA-N	442.482	1.409	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)CN2C(=O)N[C@@]3(CCCC(C)(C)C3)C2=O)nc2ccccc21	768566694	UZLZQFBYJNMZFE-JOCHJYFZSA-N	440.504	1.154	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cn(C)nc2-c2cccs2)cc1OC	768673025	HRPDPNUXQFRJJQ-UHFFFAOYSA-N	444.469	1.784	50	20	IDGD	
CSCCNC(=S)NNC(=O)c1cc(S(=O)(=O)N2CCCCC2)ccc1C	769769181	QQBBYZOSEDYNOU-UHFFFAOYSA-N	430.621	1.642	50	20	IDGD	
CSCCNC(=S)NNC(=O)c1ccc(S(=O)(=O)N2CCC[C@@H](C)C2)cc1	769770781	ZFWRKZZLRMQTOO-CYBMUJFWSA-N	430.621	1.579	50	20	IDGD	
CSCCNC(=S)NNC(=O)c1ccc2c(=O)n(-c3ccccc3)c(O)nc2c1	770245370	CJJVEYVCFSRSOZ-UHFFFAOYSA-N	429.527	1.563	50	20	IDGD	
COc1ccc([C@@H]2[C@@H](C(=O)NNc3nc(O)c4cnn(C)c4n3)CCC(=O)N2C)cc1	770972012	OHIOQBPWVJJEOD-XJKSGUPXSA-N	425.449	1.130	50	20	IDGD	
CCOCCC1(C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)CCC1	771014521	AQDUBNYKBHXVJW-UHFFFAOYSA-N	425.555	1.058	50	20	IDGD	
CC1(C)Cc2cc(S(=O)(=O)NNC(=O)C(=O)NCc3ccc(Cl)cc3)ccc2O1	771606942	KMHUZBHZYVGXDY-UHFFFAOYSA-N	437.905	1.679	50	20	IDGD	
CCOC(=O)CNC(=O)C1CCN(C(=O)NNC(=O)c2ccc3ccccc3c2)CC1	771946752	NUDOLFWOXSQANJ-UHFFFAOYSA-N	426.473	1.586	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)[C@H]1CCN(c2cccc(Br)c2)C1=O	772033699	VORXQEAIBHRRIH-MFKMUULPSA-N	426.267	1.291	50	20	IDGD	
COC[C@H](NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)c1ccc(F)c(F)c1	773541874	SFYCYFHQWRLDJA-KRWDZBQOSA-N	434.447	1.689	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H]2[C@@H](C)[C@@H](OC)C2(C)C)c1	776065826	CYSQVJUDXLWPMW-KBRIMQKVSA-N	440.566	1.721	50	20	IDGD	
CCC(CC)n1nc(C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1C	776449022	VGRYNQCBAHOSLV-UHFFFAOYSA-N	435.550	1.943	50	20	IDGD	
Cn1cc(S(=O)(=O)N2CCCCC2)cc1C(=O)NNc1cccc(S(C)(=O)=O)c1	776538738	KJBBDOJAGDGHOT-UHFFFAOYSA-N	440.547	1.360	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)NCc2ccc(C(=O)N3CCOCC3)cc2)c1	776610613	FRHNUYUFLVDWKD-UHFFFAOYSA-N	432.502	1.389	50	20	IDGD	
Cc1ccc(-n2nc(C(=O)NNC(=O)c3csc(N4CCOCC4)n3)cc2C)cc1	777274019	HDWQMVFPJJGOAK-UHFFFAOYSA-N	426.502	1.857	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)c2ccc3c(=O)n(CC)c(S)nc3c2)nc1C	778421805	GVLRNSZTODQYJT-UHFFFAOYSA-N	428.474	1.737	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)CNC(=O)c2ccc(Br)s2)nc1C	778510280	GSPACMWAFGVNCV-UHFFFAOYSA-N	442.295	1.659	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cnn([C@H](C)C3CC3)c2)cc1	778708344	YXRXDRHVKFJUJA-KGLIPLIRSA-N	429.477	1.806	50	20	IDGD	
C[C@]1(NNC(=O)N[C@@H]2CCN(c3ccc(Cl)c(Cl)c3)C2=O)CCS(=O)(=O)C1	779380413	RPBFHKZBIAJSEP-CJNGLKHVSA-N	435.333	1.480	50	20	IDGD	
CCNC(=O)N(C)NC(=O)Cc1csc(NC(=O)c2ccc(Br)o2)n1	780706784	TULWGTAYGFIMKJ-UHFFFAOYSA-N	430.284	1.986	50	20	IDGD	
CSCc1ccccc1NC(=O)C(=O)NNC(=O)c1csc(N2CCOCC2)n1	782897627	RHLVIIYTYLOJIA-UHFFFAOYSA-N	435.531	1.242	50	20	IDGD	
CC(C)(C)OC(=O)Nc1ccc(NC(=O)C(=O)NN[C@]2(C)CCS(=O)(=O)C2)cc1	783426786	ODSHDMCIHZCSJK-GOSISDBHSA-N	426.495	1.170	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNc2ccc(-n3cccn3)nn2)cc1Br	783432707	CFIIIGDDOVUKKX-UHFFFAOYSA-N	446.265	1.905	50	20	IDGD	
O=C(NNc1nccc2sccc12)C(=O)Nc1cccc(S(=O)(=O)NC2CC2)c1	783445160	PNQOYNSBTHGWNH-UHFFFAOYSA-N	431.499	1.819	50	20	IDGD	
Cc1ccc(Oc2ccc(NC(=O)C(=O)NNC(=O)CNC(=O)c3ccco3)cc2)nc1	784002281	MWCMBSHWUBLOCP-UHFFFAOYSA-N	437.412	1.291	50	20	IDGD	
CNC(=O)Cn1ccc2ccc(NC(=O)C(=O)NNc3ccnc(Br)c3)cc21	784836988	FSMWHTXGKKRURU-UHFFFAOYSA-N	445.277	1.627	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)Nc1c(F)cccc1Br	785022558	HGBHRAJRXOSASD-UHFFFAOYSA-N	441.169	1.602	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNc2cc(F)c(F)c(F)c2)cc1OC	785083533	QVBRXJUHCKPCLA-UHFFFAOYSA-N	446.407	1.956	50	20	IDGD	
COc1ccc2nc(NNC(=O)C(=O)Nc3ccc(OCCC(N)=O)cc3)c(C)cc2c1	785164148	PADSACLRZUDCTH-UHFFFAOYSA-N	437.456	1.888	50	20	IDGD	
CC(C)Oc1cc(NC(=O)C(=O)NNC(=O)CCCc2cccs2)ccc1C(N)=O	789735095	SHHPZSRZVYHHTB-UHFFFAOYSA-N	432.502	1.743	50	20	IDGD	
O=C(NNc1cccc(F)c1[N+](=O)[O-])C(=O)Nc1ccc(CN2C(=O)CCCC2=O)cc1	790993238	APEUJIYICNLEER-UHFFFAOYSA-N	443.391	1.855	50	20	IDGD	
O=C(NNc1cccc(F)c1[N+](=O)[O-])C(=O)Nc1ccc(I)cn1	790998653	QQXGDYRAFXQORQ-UHFFFAOYSA-N	445.148	1.815	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(CCC(=O)NNC(=O)c2ccc3ccccc3n2)CC1	792003944	CQMXCTNFXHOBSH-UHFFFAOYSA-N	427.505	1.939	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)NCC2CCN(S(=O)(=O)c3ccccc3)CC2)n1	792873523	SGCPMWUGFPEDEE-UHFFFAOYSA-N	431.518	1.435	50	20	IDGD	
CN(CC(N)=O)C(=O)c1cccc(NC(=O)C(=O)NNc2ccc(C(F)(F)F)cc2)c1	793030012	WCEHPHGBTXPOGU-UHFFFAOYSA-N	437.378	1.345	50	20	IDGD	
COC(=O)[C@H](CS(=O)(=O)NNC(=O)c1cccc(OC(F)F)c1)c1ccccc1	795313687	GSQKTHQPOYTQTQ-OAHLLOKOSA-N	428.413	1.809	50	20	IDGD	
COC(=O)c1cc(F)c(Br)cc1NC(=O)C(=O)NNc1ccc(C)nn1	797059261	ARXDMZMDPJLABV-UHFFFAOYSA-N	426.202	1.555	50	20	IDGD	
CCn1ncc(NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)c1C(F)(F)F	799258510	CBUXJBXHPQSTOT-UHFFFAOYSA-N	441.395	1.773	50	20	IDGD	
O=C(CN1C(=O)[C@@H]2[C@@H](C1=O)[C@H]1C=C[C@H]2C1)NNC(=O)Nc1ccc(Br)cc1	802000672	XIOZQVDJUDWUPE-CHPZLBCBSA-N	433.262	1.409	50	20	IDGD	
O=C(CCS(=O)(=O)c1ccc2c(c1)CCC2)NNC(=O)Nc1ccc2c(c1)OCO2	802105886	JVODYVKVMXUODO-UHFFFAOYSA-N	431.470	1.921	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)C2CCN(c3ccc(C#N)cc3F)CC2)cc1	803866937	WUOHHTHPEFZWNI-UHFFFAOYSA-N	449.442	1.790	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)[C@@H]1CS[C@@]2(c3ccc(F)cc3)CCC(=O)N12	804954071	GOFJYYWAARCSJF-MGPUTAFESA-N	439.476	1.835	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)c2ccccc21)c1nn(-c2ccccc2)cc1O	806346968	UVXKCLVKPWGVNQ-HNNXBMFYSA-N	426.454	1.300	50	20	IDGD	
Cc1ccc(NC(=O)NNc2ccc(-n3ccnc3)nn2)cc1S(=O)(=O)NC1CC1	806385144	XUONLWGDNZQPQB-UHFFFAOYSA-N	428.478	1.560	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2cc(Cl)cc3c2OCC(=O)N3)c1	806973279	IKJAVYGCUWJYEQ-UHFFFAOYSA-N	446.847	1.453	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2cc(C)c(Br)cc2F)n1	806974942	IXOXBJFEPFOQIR-UHFFFAOYSA-N	426.246	1.496	50	20	IDGD	
O=C1COc2c(cc(Cl)cc2NC(=O)C(=O)NNc2ccnc(Br)c2)N1	807011468	FYSCUHOAMOFZTQ-UHFFFAOYSA-N	440.641	1.910	50	20	IDGD	
O=C(NNC(=O)[C@H]1OCC[C@H]1c1ccccc1)C(=O)Nc1nc(C2CCOCC2)cs1	807068271	HLXZZZKRCFMFSQ-RDJZCZTQSA-N	444.513	1.696	50	20	IDGD	
COC[C@]1(C(=O)NNc2cccc(S(C)(=O)=O)c2)CCN(C(=O)OC(C)(C)C)C1	810915655	RYUINCGXKJLRFZ-IBGZPJMESA-N	427.523	1.807	50	20	IDGD	
O=C(NNC(=O)N1CC[C@@H](n2cc(Cl)cn2)C1)c1csc(N2CCOCC2)n1	811850753	DKVBVSBVKBUMFT-GFCCVEGCSA-N	425.902	1.131	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)c1cc(S(=O)(=O)NC2CC2)ccc1C	811866856	NXBPUBWZYBYDEC-UHFFFAOYSA-N	433.486	1.284	50	20	IDGD	
COc1cc(SC)ccc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	813033040	BDMCGRIRYXTSNC-UHFFFAOYSA-N	438.531	1.749	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1ccnc(NC(=O)C(C)C)c1	814736795	SHWNZGNWWMLUDU-UHFFFAOYSA-N	432.506	1.352	50	20	IDGD	
Cc1cc(N2CCCCCC2)ccc1NC(=O)C(=O)NNC(=O)[C@H]1CCc2nncn2C1	815692561	UXBCMODTSHRVLI-INIZCTEOSA-N	439.520	1.315	50	20	IDGD	
Cc1c(C(=O)NNC(=S)NCCc2cccs2)nnn1-c1cccc([N+](=O)[O-])c1	819427989	YQPMIFYMHCRIPA-UHFFFAOYSA-N	431.503	1.897	50	20	IDGD	
N#Cc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)CNc3ccccc3)CC2)cc1	823328131	IKKONZZTQNKKDA-UHFFFAOYSA-N	441.513	1.218	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)C[C@@H]1C[C@H]2CC[C@H]1C2	863950167	ZWLSKKMSKPXCBO-FHWLQOOXSA-N	449.573	1.614	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(N2C[C@@H](C(=O)NNc3ncccn3)CC2=O)cc1	913044410	WVOQZXRKIRBMMO-AWEZNQCLSA-N	432.506	1.003	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C2=NN(Cc3ccccc3)C(=O)CC2)c2ccccc2c1=O	916123321	ZHNHFQAVAMZGNA-UHFFFAOYSA-N	446.467	1.356	50	20	IDGD	
CN1CCN(Cc2ccc(CNC(=O)NNC(=O)[C@@H]3COc4ccccc4O3)cc2)CC1	916387789	GYDMFXWSDXHEPN-NRFANRHFSA-N	439.516	1.104	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)COc1ccccc1C#N)N1CCN(c2ccccc2)CC1	916514440	DZCVUFMDIKDUHH-GOSISDBHSA-N	436.516	1.478	50	20	IDGD	
Cc1ccc(Cl)c(S(=O)(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c1Cl	917728371	ZOUFHWJNSRLVCT-UHFFFAOYSA-N	427.273	1.901	50	20	IDGD	
COC1(C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)CCN(C(=O)OC(C)(C)C)CC1	917905796	JAKZULXYJURFTG-INIZCTEOSA-N	435.477	1.390	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)Cc2ccc3c(c2)OCO3)cc1	918552293	PSZOMTUIEMJCSP-UHFFFAOYSA-N	425.470	1.840	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)NCc2ccc(C(=O)N3CCNC(=O)C3)cc2)cc(C#N)n1C	918609888	VKWYHYGRYAUJJZ-OCKHKDLRSA-N	430.468	1.001	50	20	IDGD	
Cn1cc(CNC(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)cn1	919792800	GZILTBUYNIUZHL-UHFFFAOYSA-N	434.503	1.427	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)C1CC1	920054635	SSOBBEDJWGDBNM-HNNXBMFYSA-N	438.550	1.017	50	20	IDGD	
O=C(CN1CCCC1=O)NNC(=O)[C@@H]1CCCN1C(=O)c1cc(Cl)cc(Cl)c1	920435949	QPDBPPWIAWNRBU-AWEZNQCLSA-N	427.288	1.368	50	20	IDGD	
CC(=NNC(=O)c1csc(N2CCOCC2)n1)c1cccc(OCC(=O)N(C)C)c1	920482603	NPUKRZACXMDICL-UHFFFAOYSA-N	431.518	1.601	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2ccc(C(=O)O)c(Br)c2)cc1	1116195334	BNCMOCIGOUZFAN-UHFFFAOYSA-N	429.248	1.779	50	20	IDGD	
O=C(CCCC[C@@H]1SC[C@H]2NC(=O)N[C@H]21)NNC(=O)c1ccc(Br)cc1	1318053826	CUNFBZYMOUPTGF-VNHYZAJKSA-N	441.351	1.936	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cccn(C(F)F)c3=O)C2)C1	1779363730	YBQIIXIAXJPSAX-APPDUMDISA-N	448.264	1.470	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)n2ccccc2=O)C1	1779530889	JPHNDTGNCIIMRS-KYFSNAEOSA-N	439.940	1.177	50	20	IDGD	
Cn1cc(C(=O)N2CC[C@@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)c(C(F)(F)F)n1	1779540241	FSQVEJFZAHVGEV-QGZVFWFLSA-N	448.518	1.734	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc([N+](=O)[O-])cc4c3OCC4)C2)C1	1780093095	BETGKWBTCAXFNK-OXJNMPFZSA-N	437.880	1.991	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(C1)CN(C(=O)C(C)(C)C#N)CCO2	1780095300	PEEUOTUGLIFGKP-OAQYLSRUSA-N	444.444	1.513	50	20	IDGD	
O=C(c1ccc(OCCCO)cc1)N1CC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1780126576	NHOQQGOJGRWIRO-IBGZPJMESA-N	431.316	1.695	50	20	IDGD	
COc1cccc(CC(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)c1	1781328422	PTUHKXSULBZVGE-AEFFLSMTSA-N	429.286	1.758	50	20	IDGD	
O=C(c1cccc(F)c1[N+](=O)[O-])N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1781772495	XYYMUAKEEUQVIF-CJNGLKHVSA-N	448.220	1.868	50	20	IDGD	
COc1cc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](F)Cl)CCO3)cc([N+](=O)[O-])c1OC	1782116933	WDODGFKKDBGYQR-YJBOKZPZSA-N	445.831	1.590	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1ccc(O)cn1)C2	1782178055	GPNZLPNAKKDDSK-SQGPQFPESA-N	425.913	1.097	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1c3c(nn1C)CCC3)C2	1782179731	SOTBUOWPPCBBHM-QLVMHMETSA-N	438.956	1.290	50	20	IDGD	
Cc1ccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C3)c(O)c1	1782900400	BXKJGXWCIBHJRY-AUSIDOKSSA-N	446.548	1.201	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)C/N=C/c3ccco3)CCO2)C1	1783349234	KJWMFVKAJJPRAK-HOTAGGJMSA-N	426.311	1.702	50	20	IDGD	
C=C(CC(=O)OCC)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](Br)CC)C2)C1	1783353276	NZCADPALZQGFPJ-RDTXWAMCSA-N	431.327	1.499	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN3CCSCC3)[C@H]2C1	1783498683	ZEMLCCVBWBWJPC-XSWJXKHESA-N	438.421	1.251	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ncccc3C(F)(F)F)CCO2)C1	1783876847	AYKJLBYQOWMOKE-DYVFJYSZSA-N	435.830	1.798	50	20	IDGD	
Cc1ccc(NCCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]3C2)c(C)c1	1784091281	MSZCKKIJXWVCLK-ZULIPRJHSA-N	437.968	1.685	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3n[nH]c4c(Cl)cccc34)C[C@@H]21)[C@H](O)CCl	1784092807	WFLHONJYARHRMF-FATJJJSSSA-N	441.315	1.409	50	20	IDGD	
CCOC(CC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2)OCC	1784165768	GAOGDFXHYJCAES-HOCLYGCPSA-N	425.295	1.296	50	20	IDGD	
O=C(c1ccc(OCC2CC2)c(F)c1)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1785254069	SAKGEBSNJAPJRS-DYESRHJHSA-N	440.899	1.658	50	20	IDGD	
CC/C=C(\C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)[C@H]2C1	1787508227	QUBPVYIKILFSCA-JSGDAKEHSA-N	429.521	1.456	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cn4cccnc4n3)[C@H]2C1	1788313597	WRCAROZJQOTYBL-ABHRYQDASA-N	436.310	1.106	50	20	IDGD	
O=C(C#CC1(O)CCCCC1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21	1788637451	LBMDTCJOIMREGO-JKQORVJESA-N	445.329	1.355	50	20	IDGD	
COc1ccnc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)CBr)C[C@@H]32)c1	1788889239	WCMUUGKZAOMVNB-RMRKRWHISA-N	440.338	1.715	50	20	IDGD	
CCc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](C)Br)[C@H]3C2)nn1C	1791058837	IGKPLTMXGVNYRC-DUPGQFARSA-N	427.343	1.359	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/c3ccccc3)C[C@@H]21	1791289019	BKAWLNMLLQFIIG-KOQZAGCLSA-N	428.533	1.053	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(O)c([N+](=O)[O-])c3)C[C@@H]21)C(Cl)Cl	1791296764	JJEGJXGEBWTSHZ-MJVIPROJSA-N	432.260	1.697	50	20	IDGD	
O=C(CCc1cnccn1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21	1791660564	URQQQISKXYAYFQ-ATVPRXPUSA-N	429.290	1.079	50	20	IDGD	
Cc1cc(C(N)=O)cc(C)c1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(C)(C)CCl	1792783230	OSGWDOPDYATFKV-ALXJQNPVSA-N	435.952	1.871	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)c1ccccc1)C2	1792867729	KERLBMAFPDCIIT-RKOFLFEYSA-N	425.323	1.341	50	20	IDGD	
CC[C@@H](C)[C@@H](O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)C2	1793398812	CMGDSCSLMYAOOO-UAPBNUCKSA-N	447.482	1.868	50	20	IDGD	
CC[C@@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2)N(CC)CC	1793689481	MRMAZEKETUWUDC-NVQWDPAISA-N	444.580	1.879	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(-c2ccco2)no1	1796126159	CWYIBSJZFFBEKD-HBCWATKFSA-N	433.537	1.989	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)c1cc2c(F)cc(F)cc2[nH]1	1796932849	UGWCSYPIXVJBRT-OBSGGCNASA-N	427.835	1.249	50	20	IDGD	
CCOc1ncc(Cl)cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](Cl)COC)C2	1798209387	YBPWTUBHWNDNIG-VZAMPYOESA-N	446.331	1.591	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c(c1)CNC3=O)C2	1799277247	UNRRTVMRYDVWAQ-FKEXNYPISA-N	440.327	1.370	50	20	IDGD	
C[C@H]1CCc2c(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@@H](F)Br)n[nH]c21	1799347978	ZXVNIDLIXCBLAS-RMEBFJKESA-N	429.290	1.353	50	20	IDGD	
C[C@@H](NC(=O)c1ccc(F)cc1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](O)CCl)C2	1799811770	QLVTXTDCPZYWAM-UFRBAHOGSA-N	425.888	1.182	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cncnc1)C2	1800332304	BTBSPEJIGDOCQK-JNIOACBCSA-N	439.422	1.565	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)NC(=O)OC(C)(C)C	1800590923	SRFFCQUBPVSKPN-VVSAWPALSA-N	448.358	1.499	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCCC(=O)OC(C)(C)C)C2	1800754072	DKOAVCMRYVWUBM-ZJOBFFGXSA-N	447.370	1.871	50	20	IDGD	
CCCOc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCC(=O)NN(C)C)cc1	1801012496	KQPHVGJIOSOOME-OPMZPASUSA-N	446.548	1.052	50	20	IDGD	
Cc1cc(O)c([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(Cl)Cl	1801016811	STNVTHQFZCQVHE-WDAIWFPHSA-N	432.260	1.616	50	20	IDGD	
C=CCNC(=O)/C=C\C(=O)NC[C@@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1	1802483365	UDVCYFCGTRAJKI-MARJLNQVSA-N	449.349	1.731	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H]2CC[C@@H]3CCC(=O)N3C2)[C@@H]1c1cccnc1)[C@H](O)CCl	1803140197	BKZINIPXHDIJHK-VAVNGKDRSA-N	448.951	1.088	50	20	IDGD	
CN1N=C(C(=O)NC[C@H]2CCN(C(=O)C(Cl)Cl)[C@H]2c2cccnc2)CCC1=O	1804124741	VWRPPPTXEXMHLP-DOMZBBRYSA-N	426.304	1.499	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC2(CCCN(C(=O)C3CCC(CO)CC3)C2)CC1	1806727761	XVYBDDUHFZZSHP-UHFFFAOYSA-N	442.365	1.010	50	20	IDGD	
Cc1cccc(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)c1	1807366602	NGDUIYOFJYDXFN-JTHBVZDNSA-N	443.312	1.703	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccccc2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1	1807376056	SPVJLTAQAWWVRK-RBBKRZOGSA-N	429.285	1.395	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1CCN(C(=O)[C@@H]2C[C@H](O)CN2)[C@@H]1c1cccnc1	1808306148	ZJMGQFQDVJMRMB-ZAHIEGGZSA-N	429.348	1.047	50	20	IDGD	
C=C(Oc1ccccc1O)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1	1808400870	PGNCENZCENQOTJ-XKGZKEIXSA-N	445.903	1.985	50	20	IDGD	
Cc1ccoc1C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1808494416	OZEPQQWGRBIIFM-UYAOXDASSA-N	433.273	1.296	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCC2(CCCN(C(=O)c3cc(=O)n4[nH]cnc4n3)C2)CC1	1809959564	SVGXIIYCPNZLQX-UHFFFAOYSA-N	434.928	1.527	50	20	IDGD	
Cn1cc(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)c2cccnc21	1810081694	QCSRBAONLONNAN-SNRMKQJTSA-N	441.919	1.888	50	20	IDGD	
C=C(C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)C(F)(F)F	1812676687	CKIZKTAKNLUQPC-SJLPKXTDSA-N	447.222	1.200	50	20	IDGD	
COc1ccnc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)[C@H](O)CCl)n[nH]2)c1OC	1814872830	GQJPDXWYDYYUGM-CHWSQXEVSA-N	437.884	1.728	50	20	IDGD	
O=C(Cc1ccsc1)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1	1815354590	KFVATQLKNFFBBJ-OAHLLOKOSA-N	441.343	1.353	50	20	IDGD	
CN1CCN(CCC(=O)Nc2cc([C@@H]3CCCCN3C(=O)C(Cl)Cl)[nH]n2)CC1	1817156444	WGTHDTIFSAGQGO-AWEZNQCLSA-N	431.368	1.843	50	20	IDGD	
Cc1cccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cnccc3C(=O)NN)n[nH]2)n1	1819401877	DBULGYLFBLZYQS-GOSISDBHSA-N	448.487	1.731	50	20	IDGD	
C[Si](C)(C)OCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)n2)[nH]n1	1819593987	UVOYTOFJJMZEPV-ZDUSSCGKSA-N	434.529	1.768	50	20	IDGD	
CN1N=C(C(=O)N[C@@H]2CCc3nc(NC(=O)CO[Si](C)(C)C)sc3C2)CCC1=O	1820160309	JPZJBPKZONTYAM-LLVKDONJSA-N	437.598	1.515	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1cccc(F)c1	1820489639	VYWGLIBENHUVSN-IBGZPJMESA-N	436.252	1.848	50	20	IDGD	
CC[C@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)Cn2cc(C)c(O)nc2=O)[nH]n1	1820861302	WWSCAQFBXUQVCZ-JSGCOSHPSA-N	436.900	1.690	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCCC[C@H]1c1cc(NC(=O)COc2ccc(O)nn2)n[nH]1	1821665577	BTSFUALZTBUQTB-AWEZNQCLSA-N	448.556	1.828	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)[C@@H]1[C@H]2C=CS[C@H]21	1821706746	GQEBPYQSTZFQLC-IWKCEXAMSA-N	438.318	1.271	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](C)S)n[nH]1	1822382168	ZMURHFZKWWHSSZ-RWKNQCGYSA-N	431.522	1.854	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)[C@@H]1CCCS1	1823008610	IAMPKKWBZVQOAN-IRXDYDNUSA-N	428.323	1.291	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)Cc2cncnc2)CC1	1825290659	LUZRQHXAJTWVIR-IBGZPJMESA-N	430.553	1.012	50	20	IDGD	
C[C@@](O)(CC(=O)O)CC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CO[Si](C)(C)C)CC2	1826073784	IXLLTVMBJMPTNZ-VOJFVSQTSA-N	443.598	1.522	50	20	IDGD	
O=C1CC[C@@H](C(=O)N2CCC([C@H]3CCCCN3C(=O)CCBr)CC2)CN1	1826354477	IAOHHWIZYWICBK-HZPDHXFCSA-N	428.371	1.917	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cccnc1Cl)CCO2	1829498644	YHOJMMHWZLTNTI-IBGZPJMESA-N	441.988	1.657	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnn4cccnc34)C2)C1	1830362048	JOTXAJZOMKLDON-HXUWFJFHSA-N	435.912	1.064	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3(C#N)CCC3)C2)C1	1830546993	YXWWBFPVWXBZRT-KDOFPFPSSA-N	428.327	1.168	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3CCCSC3)C2)C1	1830547032	ZNQQIFQVDVJJCP-RVKKMQEKSA-N	449.411	1.617	50	20	IDGD	
CC(C)(C)[C@@H](O)C(=O)NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1	1833286050	OCFFSNRGNBIFQA-KRWDZBQOSA-N	432.403	1.750	50	20	IDGD	
C[C@H](Cc1ccncc1)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)CCl)CC2)CC1	1833312553	WYHRBCVICFJZJX-UZLBHIALSA-N	436.984	1.432	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H]3CCc4ccccc4C3)CC2)CC1)[C@H](O)CCl	1833312594	ZCXDFQLIZZWVHR-DENIHFKCSA-N	448.007	1.963	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3c(F)cncc3F)CC2)CC1)[C@H](O)CCl	1833312741	ZOONQELOYLNPTG-MRXNPFEDSA-N	430.883	1.145	50	20	IDGD	
O=C(c1ccnc(C(F)F)c1)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1833324564	UURVNYYASILLRL-KRWDZBQOSA-N	438.258	1.893	50	20	IDGD	
O=C(CSC1CCCC1)NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1833456602	GKVVFYDBTYIFCX-SFHVURJKSA-N	432.030	1.834	50	20	IDGD	
C=CC(=O)N[C@@H](C)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](Cl)CCC)CC2)CC1	1833533886	UCTDBHGUJRXUEX-YJBOKZPZSA-N	426.989	1.656	50	20	IDGD	
Cc1ncc(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](C)Br)CC3)CC2)[nH]1	1833580586	OCVLDMKRNANOMP-GFCCVEGCSA-N	426.359	1.687	50	20	IDGD	
O=C(c1ccc(OC(F)F)cn1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1833638890	HUUJFTYULGBTQX-DYVFJYSZSA-N	437.802	1.287	50	20	IDGD	
Cc1occc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)CBr)C2)C1	1834134098	VXDDOFDEOGQAES-SCLBCKFNSA-N	429.311	1.689	50	20	IDGD	
CN1CCC[C@H](C(=O)N2CCC(N3CCC(NC(=O)CCBr)CC3)CC2)C1	1834423371	RCTXBKVNOMBPSL-INIZCTEOSA-N	443.430	1.685	50	20	IDGD	
CC1=CC[C@@H](C(=O)N2CCOC[C@@]3(CN(C(=O)CCBr)CCO3)C2)CC1	1834821271	DSTWLCXIYQXAHL-VQIMIIECSA-N	429.355	1.974	50	20	IDGD	
CCc1cc(C(=O)NC2CCN(C3CCN(C(=O)[C@H](F)Br)CC3)CC2)n[nH]1	1834924650	WLXXLJBLRJAOLT-INIZCTEOSA-N	444.349	1.848	50	20	IDGD	
O=C(c1[nH]nc2ncccc12)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836718106	SAGUGQPLQJNZII-MRXNPFEDSA-N	435.912	1.170	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)C#CC3(O)CCCCC3)CCO2)C1	1837486347	BYOSRVMIDNEKNJ-GCJKJVERSA-N	440.968	1.549	50	20	IDGD	
CCc1nc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)co1	1838138775	IRCJUTBHJUMTFR-SJKOYZFVSA-N	430.299	1.090	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)[C@H]3CCC=CO3)CC2)CC1	1838389452	PCAAJKHQCPJUKX-LJQANCHMSA-N	436.553	1.051	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)CCNC(=S)NC)CC2)CC1	1838396311	RIYSTRSPKCTBLH-INIZCTEOSA-N	433.018	1.486	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccccc3NC(C)=O)C2)C1	1839148993	PPFSVTXBRYHRPJ-LAUBAEHRSA-N	437.924	1.732	50	20	IDGD	
Cc1ccncc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2	1839152736	JLOPZQBKQBHUDO-RBUKOAKNSA-N	430.332	1.696	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)cc1	1840034632	RPEBETVQLPXSAN-DNVCBOLYSA-N	425.323	1.848	50	20	IDGD	
CC(C)N1CCC[C@H]1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2	1840036111	FONCARCNMKXDSV-JTDSTZFVSA-N	446.386	1.099	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1C[C@H]3CC[C@@H]1O3)CCO2	1840051426	ZSZLGMGOAWXCDF-RMWBKXBUSA-N	445.354	1.184	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4ncccc4c3)C2)C1	1840152703	PXUZLWIFMRHUFI-PGRDOPGGSA-N	447.919	1.559	50	20	IDGD	
Cc1nccn1CCCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840190703	JAGCAINGDXNEEA-GOSISDBHSA-N	433.336	1.232	50	20	IDGD	
C[C@@H](Cc1ccco1)C(=O)N1CCO[C@]2(COCCN(C(=O)CCBr)C2)C1	1840468819	QLBPVSJZUIUHIL-KXBFYZLASA-N	443.338	1.700	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(C)cc(Cl)c3)CCO2)C1	1840699599	OYGPAXCZDQYZCT-XLIONFOSSA-N	445.343	1.972	50	20	IDGD	
COc1ccc([N+](=O)[O-])c(C(=O)N2CC3(CCCN3C(=O)[C@@H](C)CBr)C2)n1	1841286403	CIROGFWUGGWSNL-NSHDSACASA-N	441.282	1.846	50	20	IDGD	
O=C(c1cc2c[nH]nc2cc1Br)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1	1841352059	UGNDQRFOMLUOBU-AWEZNQCLSA-N	441.713	1.742	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)N2CC3(CCCN3C(=O)[C@@H](O)CCl)C2)C1	1841353014	ZBKSAVRYLUDWAE-GJZGRUSLSA-N	429.945	1.437	50	20	IDGD	
CC(C)n1nc(C(=O)N2CC3(CCCN3C(=O)CCBr)C2)cc1C(=O)O	1842637701	VXMXPADAXCGJSC-UHFFFAOYSA-N	427.299	1.764	50	20	IDGD	
CC1(C)CCc2cccc(C(=O)N3CC4(CCCN4C(=O)c4cccc(B(O)O)c4)C3)c2O1	1843013766	KKSKKFLEKVJINC-UHFFFAOYSA-N	448.328	1.601	50	20	IDGD	
CC(C)(C)OC(=O)N1CC2(CC[C@H](C(=O)N3CC4(CCCN4C(=O)[C@@H](F)Cl)C3)O2)C1	1843361486	KFIFKXHHKTXPCY-ZIAGYGMSSA-N	445.919	1.893	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CC3(CCCN3C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)o1	1843416298	UOLCFFGJMPABBG-ZMOGYAJESA-N	440.460	1.189	50	20	IDGD	
Cc1cc(F)c(F)c(C(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)c1	1844265105	UUHGFPQGJBIABT-UHFFFAOYSA-N	429.427	1.403	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCCC12CN(C(=O)c1ccc(S(C)(=O)=O)cn1)C2	1845169323	COMSGMWXKGILPB-INIZCTEOSA-N	434.345	1.538	50	20	IDGD	
CC(C)Oc1ccc(C(=O)N2CCCC23CN(C(=O)c2ccc(B(O)O)cc2)C3)c(F)c1	1845525545	QAEGUVVHANOGRF-UHFFFAOYSA-N	440.280	1.424	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)[C@H]2CC[C@H](C(F)(F)F)CC2)C1	1846982626	YXHKPKZXGCNMTN-WKILWMFISA-N	438.255	1.552	50	20	IDGD	
O=C(NNC(=O)N1CCC(C(=O)c2ccccc2)CC1)c1csc(N2CCOCC2)n1	11608261	YNPAEIGGYUSITM-UHFFFAOYSA-N	443.529	1.929	50	20	IDGD	
O=C(NNC(=O)[C@H]1CC(=O)N(c2ccccc2Cl)C1)c1csc(N2CCOCC2)n1	12802312	BFTDHHOPBNCCHR-LBPRGKRZSA-N	449.920	1.447	50	20	IDGD	
COc1ccc(CC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc1OC	17513553	SIQAOSJNUQVYCW-UHFFFAOYSA-N	447.513	1.492	50	20	IDGD	
CCn1c(=O)c2ccccc2n(CC(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)c1=O	18103656	BDDJAIQNKOSJSW-INIZCTEOSA-N	438.484	1.415	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2ccc3c(c2)C[C@H](C)N3S(C)(=O)=O)cc1OC	45573770	ODNLRTZBURKDTA-LBPRGKRZSA-N	433.486	1.489	50	20	IDGD	
O=C(NNc1nc(-c2ccncc2)no1)c1ccc(S(=O)(=O)NC[C@@H]2CCCO2)cc1	726376827	FXFQATJXQJCZFO-HNNXBMFYSA-N	444.473	1.346	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)[C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])c(C)c2)n1	726522113	ARXGZYWIDSWGAJ-QGZVFWFLSA-N	428.449	1.169	50	20	IDGD	
CCS(=O)(=O)NCCCNC(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccccc1	726771223	HTOJAVVJWBPWKT-JXAWBTAJSA-N	440.529	1.816	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)CN2C(=O)COc3ccc([N+](=O)[O-])cc32)cc1C	727958054	OZQBBMWPSUJHSJ-UHFFFAOYSA-N	428.401	1.163	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(F)cc1C(F)(F)F)c1ccc(-n2cnnn2)cc1	728502891	FNCIVEGVTCBRFL-UHFFFAOYSA-N	430.343	1.444	50	20	IDGD	
O=C(CCCc1nnc(-c2ccccc2)o1)NNC(=O)C1CCN(c2ncccn2)CC1	728845869	OINNQXAUGXGNPO-UHFFFAOYSA-N	435.488	1.913	50	20	IDGD	
Cn1ccnc1[C@](O)(CC(=O)NNc1ccc(S(=O)(=O)C(F)F)cc1)C(F)(F)F	728975782	SNYARZJHNHKWCQ-CQSZACIVSA-N	442.366	1.700	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)N2CCC[C@H](NS(=O)(=O)c3cccc(F)c3)C2)c1	729500702	XNQDUVPFPVEZCT-KRWDZBQOSA-N	445.476	1.495	50	20	IDGD	
Cc1ccc([C@H](CN2CCOCC2)NC(=O)NNC(=O)COc2ccccc2O)cc1	730903307	JEDKCOSQWTZWMN-SFHVURJKSA-N	428.489	1.483	50	20	IDGD	
Cc1sc2nc(CC(=O)NN=C3CCN(CCN4CCOCC4)CC3)nc(O)c2c1C	731557608	SYKZJMPBFKNNDE-UHFFFAOYSA-N	446.577	1.456	50	20	IDGD	
COC(=O)c1ccc(CCC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1	731569601	JJASZCXSRVUKKT-UHFFFAOYSA-N	438.528	1.766	50	20	IDGD	
COc1ccc(-c2nc3c(s2)[C@H](NC(=O)NNC(=O)C(=O)NC2CC2)CCC3)cc1	731762436	CGYLADMRXWJOHH-OAHLLOKOSA-N	429.502	1.805	50	20	IDGD	
O=C(COC(=O)c1ccc(N2CCOCC2)cc1)NNC(=O)c1cccc([N+](=O)[O-])c1	732334185	ZTEXPLZIRGMVEU-UHFFFAOYSA-N	428.401	1.049	50	20	IDGD	
CCS(=O)(=O)C[C@@H](C)NC(=O)NNC(=O)c1ccc(Br)cc1Cl	733660855	XSEXWEWPIJQJHG-MRVPVSSYSA-N	426.720	1.870	50	20	IDGD	
C[C@@H](c1cccnc1)N1CCN(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)CC1	734169137	NBSFXZLHOKGKSV-KRWDZBQOSA-N	438.536	1.208	50	20	IDGD	
C#CCNS(=O)(=O)c1cccc(C(=O)NNc2nc(-c3ccccn3)nc(C)c2C)c1	734259929	NZFZBXYCKZJLIL-UHFFFAOYSA-N	436.497	1.824	50	20	IDGD	
COCCOc1ccc(-n2nc(C)c(C(=O)NNC(=O)COc3ccccc3O)n2)cc1	735048297	MHSHLOQHGPDZPA-UHFFFAOYSA-N	441.444	1.147	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)Cc2cn(C)c3ccccc23)CC1	735117891	IIRIMMJTWAJDIA-UHFFFAOYSA-N	442.545	1.195	50	20	IDGD	
CN1CCC[C@@H](CNC(=O)NNC(=O)C(=O)NC2CC2)[C@@H]1c1ccc(C(F)(F)F)cc1	735587032	QQTXWSAJIKKKCL-BBRMVZONSA-N	441.454	1.697	50	20	IDGD	
CCCCn1c(C)cc(/C=C(/C#N)C(=O)N[C@@H]2CC(=O)N(CCN3CCOCC3)C2)c1C	736150839	BEISJWSPXGWODY-ZPWPBLDLSA-N	441.576	1.861	50	20	IDGD	
Cc1c(NNC(=O)NC2CCN(S(=O)(=O)C3CCOCC3)CC2)cccc1[N+](=O)[O-]	737057442	HQIBTUDWOYZWBP-UHFFFAOYSA-N	441.510	1.503	50	20	IDGD	
Cc1cc(C(=O)NNS(=O)(=O)c2ccccc2S(N)(=O)=O)c(C)n1-c1ccccc1	740705021	DZVPYAPKOVKZAE-UHFFFAOYSA-N	448.526	1.365	50	20	IDGD	
O=C(/C=C\c1ccc([N+](=O)[O-])cc1)NNc1ccccc1S(=O)(=O)N1CCOCC1	744620180	GPESILSKJYMDAN-YFHOEESVSA-N	432.458	1.772	50	20	IDGD	
O=C(COC(=O)c1ccc(OC2CCOCC2)cc1)NNC(=O)c1cccc([N+](=O)[O-])c1	745251933	ZWPYPOWRKWADHQ-UHFFFAOYSA-N	443.412	1.771	50	20	IDGD	
COc1cc(C)nc(NNC(=O)CN(C)S(=O)(=O)c2ccc(Br)cc2)n1	746630645	KROGJMBOBYRKIY-UHFFFAOYSA-N	444.311	1.320	50	20	IDGD	
O=C(CN(Cc1ccccc1)S(=O)(=O)c1ccc(Cl)cc1)NNC(=O)c1ccon1	747145101	OUXCJSIVVFOGPD-UHFFFAOYSA-N	448.888	1.980	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)c2ccc(Cl)c(NS(C)(=O)=O)c2)c1	747145104	OWYOPACDWZNCAD-UHFFFAOYSA-N	427.866	1.804	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)c1cc(S(=O)(=O)N2CCCCC2)ccc1Cl	747323169	LQVOHOHCWMXLAZ-UHFFFAOYSA-N	436.921	1.913	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NCCOc2ncccc2C(F)(F)F)cc1	747446645	DGKHNJMFFRCHKY-UHFFFAOYSA-N	428.367	1.897	50	20	IDGD	
CS(=O)(=O)CC[C@H](NC(=O)c1ccc(Cl)cc1)C(=O)NNc1cccc(C#N)c1	748035025	LHNVBECNVVHBRX-KRWDZBQOSA-N	434.905	1.888	50	20	IDGD	
CCCOc1ccc(C(=O)NNS(=O)(=O)c2cc(F)cc(C(=O)O)c2)cc1OC	749144720	WPEMPXKGJJDWFD-UHFFFAOYSA-N	426.422	1.945	50	20	IDGD	
COc1cc(C)nc(NNC(=O)CCC(C)(C)C(=O)NNc2nc(C)cc(OC)n2)n1	749416662	MGMOVTUCNKYCEE-UHFFFAOYSA-N	432.485	1.293	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@H]2SCCc3ccccc32)c1	749612051	KNFUYGGCFFWTLX-GOSISDBHSA-N	448.570	1.912	50	20	IDGD	
CO[C@H](C)c1noc(CN2CCCN(C(=O)/C(C#N)=C\c3cc(C#N)n(C)c3C)CC2)n1	750114911	UJRPZNXLYFHBFU-LTKMBJGESA-N	437.504	1.937	50	20	IDGD	
NC(=O)c1cn(CC(=O)NNc2nc(Br)cn3ccnc23)c2ccccc12	750243997	UCRVGXOLYCNUSS-UHFFFAOYSA-N	428.250	1.689	50	20	IDGD	
CC(C)(CO)CCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	754916921	SQTRJVDQAGFPOS-UHFFFAOYSA-N	426.539	1.214	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1F	755386262	JLAKVOZHFWOUFF-UHFFFAOYSA-N	436.465	1.622	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)Nc1cc(Cl)ccc1N1CCOCC1	755422453	ZCTNFSKHOCRBCJ-UHFFFAOYSA-N	442.867	1.619	50	20	IDGD	
COc1ccc(C(=O)N(C)C)cc1NC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	756122342	MHQSKZRYZAGEJQ-UHFFFAOYSA-N	434.474	1.267	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)c2ccc3c(c2)OCO3)c(C)c1S(=O)(=O)NC1CC1	756711536	KSYWGCDHVORNPR-UHFFFAOYSA-N	446.485	1.939	50	20	IDGD	
CCS(=O)(=O)NCC(=O)NNC(=O)c1cn(-c2ccccc2)nc1-c1ccccc1	758156833	RYGOYIDJJOPWNX-UHFFFAOYSA-N	427.486	1.240	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)N[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1C#N	758772109	PLKBUTVGCPMQBC-ZIAGYGMSSA-N	433.465	1.163	50	20	IDGD	
O=C(NNC(=O)c1ccc(I)c(F)c1)C(=O)Nc1ccccn1	758840506	IXQBCWCKAKESCV-UHFFFAOYSA-N	428.161	1.225	50	20	IDGD	
C[C@H](O)C[C@@H](CNC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)c1ccccc1	759610939	MWEAVGGZSLHMAI-HOCLYGCPSA-N	434.518	1.981	50	20	IDGD	
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)NNC(=O)c1cc(Cl)ccc1O	760122033	VIBRABZTRHHKLZ-HNNXBMFYSA-N	448.863	1.367	50	20	IDGD	
CC1(C)C(=O)N(C[C@@](C)(O)C(=O)NNC(=O)NCCc2cccs2)c2ccccc21	760170302	TUWULTRFXPZUJX-OAQYLSRUSA-N	430.530	1.696	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1ccnn1Cc1ccc(F)cc1	760277772	QZYPVRYSMHJEKN-UHFFFAOYSA-N	439.403	1.241	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccnn1-c1cc(C)ccn1	760278402	CKAGTQNKLYVZKD-UHFFFAOYSA-N	438.444	1.139	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCCC(=O)NNc1nc(-c2cccnc2)no1	760877356	KJOWFXLYONXYSC-AWEZNQCLSA-N	445.480	1.481	50	20	IDGD	
CCC(=O)N1CC[C@@H](NC(=O)NNC(=O)[C@@H](C)Oc2cccc(Br)c2)C1	762081714	HZRLIWPIZXTDEU-DGCLKSJQSA-N	427.299	1.558	50	20	IDGD	
C[C@@H](c1ccc(NC(=O)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1)N1CCOCC1	763467867	HXMQTGRDSPIWOS-AWEZNQCLSA-N	441.444	1.388	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)C(=O)Nc1scnc1C1CC1	763532366	XKEACSXZGFMTDI-UHFFFAOYSA-N	442.545	1.319	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)Nc1cccc(COCC2CC2)c1	763573380	ZZHJXDTZVRLSDN-LJQANCHMSA-N	425.441	1.539	50	20	IDGD	
COc1ccc(OC(F)F)c(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1	763574110	WWBZDXRQPSWWAV-HNNXBMFYSA-N	437.355	1.223	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)C(=O)Nc1cccc(NC(=O)c2ccoc2)c1	763679498	MFVIWCJCWSDBHQ-UHFFFAOYSA-N	440.387	1.836	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)cc1OC	763745654	HLQDNXJVAACBLR-UHFFFAOYSA-N	426.473	1.633	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)NC3CCCC3)cc2)c1	763760363	KYFNFOQRVSMPHB-UHFFFAOYSA-N	437.500	1.825	50	20	IDGD	
CC[C@@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(OC)cc(OC)c2)cc1	763772951	RCFHSNLGIFSNPQ-CYBMUJFWSA-N	442.472	1.632	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2ccccc2-n2c(C)cnc2O)c1	763774915	JXFXZVHEODNGLS-UHFFFAOYSA-N	439.428	1.303	50	20	IDGD	
CN1CCCN(c2ccc(NC(=O)C(=O)NNC(=O)COc3ccc(F)cc3)cc2)CC1	763841494	RPTLXXMVBSPTRU-UHFFFAOYSA-N	443.479	1.133	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc3ccccc3c2)ccc1C(N)=O	763856034	XMSWVXTXWSPZEW-AWEZNQCLSA-N	434.452	1.801	50	20	IDGD	
CSc1cc2c(cc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccc(F)cc1)OCCO2	763864329	ATLDMEQTJGXONM-LLVKDONJSA-N	449.460	1.872	50	20	IDGD	
CCN(CC)C(=O)c1ccccc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccc(F)cc1	763865037	HMMZKZNKHDAOIG-AWEZNQCLSA-N	444.463	1.861	50	20	IDGD	
COC(=O)c1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccc(F)cc1	763872777	ORPFASMPRBPTKL-SNVBAGLBSA-N	437.811	1.819	50	20	IDGD	
O=C(CCSc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccc2c(c1)CCC(=O)N2	763895696	PLUOGEFLEFOUNN-UHFFFAOYSA-N	430.461	1.979	50	20	IDGD	
CCNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2ccc(OCC)c(OC)c2)c1	763901191	LXVULEOBKUGNGU-UHFFFAOYSA-N	428.445	1.243	50	20	IDGD	
C[C@H](C#N)Oc1ccccc1NC(=O)C(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	763944793	QCLDXGLLVLYGNR-CYBMUJFWSA-N	434.412	1.268	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1ccnn1Cc1ccc(C)o1	764012438	QRZFWOVIWLPOIY-UHFFFAOYSA-N	431.836	1.895	50	20	IDGD	
CCOC(=O)c1ccn(-c2ccccc2NC(=O)C(=O)NNC(=O)Cc2ccsc2)n1	764035002	QFGDOISPKKBZLG-UHFFFAOYSA-N	441.469	1.439	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2nc(-c3ccccc3OC(F)F)cs2)n[nH]1	764097218	BYZUICWPWMMCGM-UHFFFAOYSA-N	436.400	1.843	50	20	IDGD	
CN(C)c1nnc(-c2ccc(NC(=O)C(=O)NNC(=O)c3ccc(Cl)nc3)cc2)o1	764101094	OGSVEQHPPKNUBW-UHFFFAOYSA-N	429.824	1.251	50	20	IDGD	
Cc1cc(C(=O)NCC(C)C)ccc1NC(=O)C(=O)NNC(=O)c1ccc(Cl)nc1	764102289	YBNLKEVQLJVBCO-UHFFFAOYSA-N	431.880	1.829	50	20	IDGD	
CCCc1c(NC(=O)C(=O)NNC(=O)c2ccc(C)cc2O)cnn1-c1cc(C)ccn1	764110438	JPXRACRXTSVWST-UHFFFAOYSA-N	436.472	1.942	50	20	IDGD	
O=C(CCc1ccccc1)NNC(=O)C(=O)Nc1cc(N2CCNC2=O)ccc1Cl	764185146	HZTQRFAWXQUNJC-UHFFFAOYSA-N	429.864	1.588	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)C(=O)Nc1ccnc(OCC(F)(F)F)c1	764289367	RNRZGSPYWUVITP-UHFFFAOYSA-N	426.351	1.447	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)CCCc2cccs2)c(=O)n(-c2ccccc2)n1C	764342118	VFSBRBBXOFMVRD-UHFFFAOYSA-N	441.513	1.655	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c(F)c1	764343591	SUYBJLFRAPCSHB-UHFFFAOYSA-N	425.376	1.198	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1C(=O)N(C)C	764344135	ZYXTVQDLJFVBNA-UHFFFAOYSA-N	434.456	1.282	50	20	IDGD	
Cc1noc(COc2ccc(NC(=O)C(=O)NNC(=O)COCc3ccccc3)cc2)n1	764365793	BPAJFFJRDDKSDB-UHFFFAOYSA-N	439.428	1.260	50	20	IDGD	
N#Cc1ccc(S(=O)(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)cc1	765119981	WZCJRQXWHWSFCG-UHFFFAOYSA-N	447.948	1.339	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2nc(C)ccc2OC)c1	765300228	HYJJJGVTCXIFPP-UHFFFAOYSA-N	435.506	1.896	50	20	IDGD	
CN(C)C(=O)NNC(=O)CCC(=O)N1CCN(C2c3ccccc3-c3ccccc32)CC1	765330192	MFRLEJHKPVQVHN-UHFFFAOYSA-N	435.528	1.983	50	20	IDGD	
CNc1c(C(=O)OCC(=O)NNC(=O)c2cc(Cl)ccc2OC)cccc1[N+](=O)[O-]	765522565	QPEVEHRQXCRQIM-UHFFFAOYSA-N	436.808	1.917	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)NOCC(F)(F)F)cc1	766763327	QGNVOQYTGJPBIF-MDWZMJQESA-N	437.378	1.951	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cc(F)cc3cccnc23)cc1	767192042	QYCUEMJNZWKSOM-UHFFFAOYSA-N	430.461	1.764	50	20	IDGD	
Cc1ccc([C@@](O)(CC(=O)OCC(=O)NNC(=O)Cc2ccccc2C)C(F)(F)F)o1	767279655	WQQDAVPZSMDVKU-IBGZPJMESA-N	442.390	1.970	50	20	IDGD	
CN(NC(=O)CCC(=O)N1CCN(S(=O)(=O)c2ccc(F)cc2)CC1)c1ccccc1	767824448	NLFZZCOGYXKEKW-UHFFFAOYSA-N	448.520	1.606	50	20	IDGD	
COc1cc2c(cc1NC(=O)C(=O)NNC(=O)C(F)(F)Oc1ccccc1)NC(=O)CC2	768240888	BWVAFIWQISJBLE-UHFFFAOYSA-N	448.382	1.338	50	20	IDGD	
CC(C)(O)C(=O)NNC(=O)c1ccc(CNS(=O)(=O)c2ccc(C(C)(C)C)cc2)cc1	768261008	JUGGNXKPGNOSHA-UHFFFAOYSA-N	447.557	1.995	50	20	IDGD	
CN(C)c1ccnc(C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)c1	768290584	KOHIRLLKQUEXFR-UHFFFAOYSA-N	430.940	1.380	50	20	IDGD	
NS(=O)(=O)c1cccc2c(C(=O)NNC(=O)c3cccc(OC(F)F)c3)nccc12	768479584	SSWCDDLUUJDCNF-UHFFFAOYSA-N	436.396	1.558	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)c1cc(Cl)ccc1-n1cnnn1	772897390	GYYXEGJDTHECPC-UHFFFAOYSA-N	434.243	1.047	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1cccc(-c2ncc3n2CCCC3)c1	773544783	DGDTXUWNQNCUCH-UHFFFAOYSA-N	449.467	1.757	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2ccc(C)c(F)c2)c(C(=O)N(C)C)cc1OC	773891020	YLBLKRFGBSBNGZ-UHFFFAOYSA-N	446.435	1.253	50	20	IDGD	
CS(=O)(=O)N(c1ccc(OCCNC(=O)NNc2ccccc2)cc1)S(C)(=O)=O	774302369	HQXHBQWNGVCUBV-UHFFFAOYSA-N	442.519	1.117	50	20	IDGD	
CC(C)C[C@H](C(=O)NNc1cccc(S(C)(=O)=O)c1)N1C(=O)[C@H]2CC=CC[C@@H]2C1=O	776540886	DCNSOYSCAGQEBQ-OKZBNKHCSA-N	433.530	1.899	50	20	IDGD	
N#C/C(=C\c1ccc(O)cc1)C(=O)N1CCN(S(=O)(=O)c2c[nH]c3ncccc23)CC1	776633078	VCKPUQHXYKQEGR-FOWTUZBSSA-N	437.481	1.709	50	20	IDGD	
COCCO[C@@H]1COCC[C@H]1NC(=O)NNC(=O)COc1ccccc1-c1ccccc1	777277775	DCFCDBQMPVFGSV-TZIWHRDSSA-N	443.500	1.883	50	20	IDGD	
CCOc1ncc(C(=O)N2CCN(S(=O)(=O)CBr)CC2)cc1Cl	777779572	PFRKNMXNLAQXLU-UHFFFAOYSA-N	426.720	1.574	50	20	IDGD	
CC(C)(C(=O)N1CCN(S(=O)(=O)CBr)CC1)c1ccc2c(c1)OCCO2	777838183	SSQNSHPTVZXRCB-UHFFFAOYSA-N	447.351	1.562	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)c2cn(-c3ccc(C(F)(F)F)cn3)nn2)nc1C	778425661	VKINKEPZNZYJEI-UHFFFAOYSA-N	436.354	1.713	50	20	IDGD	
NC(=O)c1cc(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2Br)ccc1F	778756849	WWOZVRMUJJOEIQ-UHFFFAOYSA-N	440.185	1.677	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)[C@H](O)[C@H](O)c1nc2ccccc2s1	779511856	SVSLOLQKWBRELA-SJORKVTESA-N	448.526	1.275	50	20	IDGD	
CCC[C@H]1C[C@H](C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)CCO1	780522442	VBBQSASTJTYBBF-CVEARBPZSA-N	425.555	1.056	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2ccnc(OCCN(C)C)c2)cc1Br	781424748	CICIUOWSWOSABJ-UHFFFAOYSA-N	437.294	1.868	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)cn1	781658236	PYIHSPJVCAKGBN-UHFFFAOYSA-N	431.474	1.394	50	20	IDGD	
O=C(Cc1cncs1)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	782660789	DFBOINCRFZUEGM-UHFFFAOYSA-N	430.511	1.625	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)cc1)C(=O)Nc1ccc(-n2nccc2C(F)(F)F)cc1	782831310	DNUYJLVLFSUCOG-UHFFFAOYSA-N	433.346	1.996	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ccc(F)cc2C)cc1S(=O)(=O)NC1CC1	783449632	USAYJRQWZDBMEZ-UHFFFAOYSA-N	436.465	1.665	50	20	IDGD	
Cc1coc(-c2cc(NC(=O)C(=O)NNC(=O)CNC(=O)c3cccs3)ccc2C)n1	784003695	LWZGMUNXPGCSDX-UHFFFAOYSA-N	441.469	1.536	50	20	IDGD	
CCOC(=O)c1ccccc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	784212730	FQLCFAPVOOSJGA-UHFFFAOYSA-N	446.485	1.386	50	20	IDGD	
COCCOc1ccccc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	784214773	DLPHJUDGEFIMIV-UHFFFAOYSA-N	448.501	1.234	50	20	IDGD	
C[C@H](c1ccc(NC(=O)C(=O)NNc2ccc(C(F)(F)F)nn2)cc1)N1CCOCC1	784891033	BAOCCZIHTHAFFG-GFCCVEGCSA-N	438.410	1.970	50	20	IDGD	
Cc1n[nH]c(C)c1[C@H](C)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	784976108	JJYKHBCGMAIPRX-ZDUSSCGKSA-N	433.534	1.766	50	20	IDGD	
Cc1cc(S(N)(=O)=O)cc(NC(=O)C(=O)NNc2nc(C(F)(F)F)cs2)c1C	785145254	NJRFXTNHYYIKKQ-UHFFFAOYSA-N	437.425	1.508	50	20	IDGD	
CN(C)C(=O)COc1ccc(NC(=O)C(=O)NNc2nc(C(F)(F)F)cs2)cc1	785145360	OIRKHGBYGFVOHQ-UHFFFAOYSA-N	431.396	1.711	50	20	IDGD	
CS(=O)(=O)c1c(F)cc(NC(=O)C(=O)NNc2nc(C(F)(F)F)cs2)cc1F	785148241	ZWKXTHQHYUGLCL-UHFFFAOYSA-N	444.363	1.925	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1ccccc1-n1cccn1	785337934	IVEDLDCQWWQOPU-UHFFFAOYSA-N	429.458	1.366	50	20	IDGD	
Cc1csc(C(=O)NNC(=O)CNC(=O)c2cccs2)c1I	786855652	AURNKDMKHJTJGE-UHFFFAOYSA-N	449.295	1.914	50	20	IDGD	
CC(=O)c1cccc(S(=O)(=O)NCCC(=O)Nc2cccc(NC(=O)NN(C)C)c2)c1	788256210	UZFQVHNAUCSWQW-UHFFFAOYSA-N	447.517	1.794	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])c(C)cc1C	788331950	VQRQMPUFDCOCLH-UHFFFAOYSA-N	444.400	1.163	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cccc3c2OCC3(C)C)cc1	788721678	WHKIXIVUAGXXRJ-UHFFFAOYSA-N	431.514	1.747	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(CN3CCCC3)cc2)c1	788881635	LBBHIGPCHWWLBT-UHFFFAOYSA-N	430.530	1.608	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@@H]2CCCN(c3ccccc3)C2)c1	789313362	BAMAUYNQNRGAHY-INIZCTEOSA-N	430.530	1.951	50	20	IDGD	
COC(=O)CN(CC(=O)NNC(=O)c1ccccc1)Cc1cccc(Br)c1	789490013	QQFHZAQUKLXOOB-UHFFFAOYSA-N	434.290	1.885	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccc3c2OCC[C@H]3N(C)C)cc1C	789732699	UBZHQOANLFCNSA-LJQANCHMSA-N	440.500	1.854	50	20	IDGD	
O=C(NNC(=O)c1cc(F)ccc1Br)C(=O)Nc1nc2c(s1)CCC2	789734513	JSQIONQUDZMSHD-UHFFFAOYSA-N	427.255	1.933	50	20	IDGD	
O=C(NCc1ccc(S(=O)(=O)CCO)cc1)NNC(=O)c1cccc(OC(F)F)c1	790764737	WKDQZALAFLMWKA-UHFFFAOYSA-N	443.428	1.198	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)[C@](C)(O)Cn1cc(C(F)(F)F)ccc1=O)c1ccccc1	792155544	AKIZHVGJOPBVOU-HNAYVOBHSA-N	425.407	1.959	50	20	IDGD	
CS(=O)(=O)C1(C(=O)NNC(=O)COc2ccc(-c3ccc(C#N)cc3)cc2)CCC1	792800458	GENSGFSBMCBFHF-UHFFFAOYSA-N	427.482	1.719	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@@H]2N(C(=O)OC(C)(C)C)CC2(C)C)c2ccccc2c1=O	792810440	HMWAKUKEEYHVMM-INIZCTEOSA-N	443.504	1.823	50	20	IDGD	
C[C@@H](CCc1ccc(I)cc1)NC(=O)NNC(=O)c1cnn(C)c1	793233934	WMVUNBXIDHEJBF-NSHDSACASA-N	441.273	1.990	50	20	IDGD	
COc1cc2ncn(CCCC(=O)NNC(=O)c3cccc(C)n3)c(=O)c2cc1OC	794077269	UERXOMWQLGAENL-UHFFFAOYSA-N	425.445	1.359	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NN=C[C@@H]2CCCN(C(=O)CNC(=O)OC(C)(C)C)C2)cc1	794484739	ROIBQEDRTRNJOU-INIZCTEOSA-N	445.520	1.799	50	20	IDGD	
O=C(NN=Cc1c(F)ccc(I)c1F)N[C@@H]1CCS(=O)(=O)C1	794497678	NQZOAESFHGICRF-SSDOTTSWSA-N	443.213	1.390	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H]2CN(CC(=O)NNC(=O)c3cccc(C#N)c3)CC[C@H]21	795127510	FKJGYSKTDJKLLV-QZTJIDSGSA-N	427.505	1.651	50	20	IDGD	
O=C(NNC(=O)C1(c2cc(F)cc(Br)c2)CC1)N[C@H]1CCS(=O)(=O)C1	795527561	ONKHAKFCIVFLKD-LBPRGKRZSA-N	434.287	1.137	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)CNC(=O)OCc2ccccc2)c(C)cc1C	797368537	CZDFQJYMKKHODT-UHFFFAOYSA-N	428.445	1.324	50	20	IDGD	
Cc1ccc(N2CCOCC2)cc1NC(=O)C(=O)NNC(=O)c1cnn(-c2ccccc2)c1	797535545	NOPAPABLDZGSPF-UHFFFAOYSA-N	448.483	1.417	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)c1cc(S(=O)(=O)C2CCCC2)ccc1F	797749916	DFJDDFZCQBVCQL-UHFFFAOYSA-N	443.497	1.828	50	20	IDGD	
C[C@@H](C(=O)NNc1cc([N+](=O)[O-])ccc1Br)S(=O)(=O)C1CCOCC1	800618238	LTJFILPOXMTQBO-VIFPVBQESA-N	436.284	1.783	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2CCCN2C(=O)c2ccc3c(c2)OCO3)cc1	801109627	WHECCLVBAISROX-MRXNPFEDSA-N	438.440	1.114	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)c2cnn(-c3ccc(O)nn3)c2C)c(OC)cc1Cl	802083521	CCCYGYJPVNZOFA-UHFFFAOYSA-N	447.839	1.813	50	20	IDGD	
C[C@H](C(=O)NNC(=O)Nc1ccc(Cl)cc1Cl)N1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O	802090931	KFVDCNIVOQNEEZ-FVJKAEFOSA-N	441.271	1.697	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)C2CCN(c3ccc(C#N)cc3F)CC2)c1	803866799	QTDAPJJCGCZPMF-UHFFFAOYSA-N	449.442	1.790	50	20	IDGD	
COCCN(CCOC)C1CCN(C(=O)NNC(=O)c2c(C)nc3ccccn23)CC1	804867078	GBYWSIZRULHWRV-UHFFFAOYSA-N	432.525	1.056	50	20	IDGD	
CN(C(=O)OC(C)(C)C)[C@@H](C(=O)NNC(=O)CCc1ccccc1O)c1cnn(C)c1	806806192	KKMGLJCSDZOPAH-GOSISDBHSA-N	431.493	1.814	50	20	IDGD	
CC(C)Oc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)C(=O)NNc1ncccc1F	807301204	AHVHYANBGVOSGZ-UHFFFAOYSA-N	439.469	1.340	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)CC[C@@H]1NC(=O)N(c2ccc(Cl)cc2)C1=O	807371051	BXRILUSWAHLJNR-AWEZNQCLSA-N	440.884	1.482	50	20	IDGD	
O=C(NNc1nccnc1C1CCC1)C(=O)Nc1ccc(Cc2nnc3n2CCC3)cc1	807461448	FHQLDACNPLXCCU-UHFFFAOYSA-N	432.488	1.954	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)C1(S(=O)(=O)c2ccccc2)CCCCC1	808343364	GOWYHPUSMVDJKU-UHFFFAOYSA-N	433.486	1.334	50	20	IDGD	
COc1ccc(F)cc1C=NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1	812227966	XADRCSNUQARVOJ-UHFFFAOYSA-N	448.520	1.599	50	20	IDGD	
CSc1nc2nc(C)c(CC(=O)NNc3ccc(S(=O)(=O)N(C)C)cc3)c(C)n2n1	812731991	PZBUITGXDBRSSY-UHFFFAOYSA-N	449.562	1.399	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@H](O)c1ccc(Cl)cc1F	813367223	XDWHLLVGSGLLLZ-CYBMUJFWSA-N	428.873	1.575	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCc2nncn2C1)C(=O)Nc1cc(F)ccc1Oc1ccccc1	815691103	FISQKXPSIPYANW-CYBMUJFWSA-N	438.419	1.558	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCO1)C(=O)Nc1cccc(C[S@](=O)Cc2ccccc2)c1	815779857	ZCPBFGFEOIASCG-VPTFNQTCSA-N	429.498	1.400	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3cc(C#N)cc(N(C)C)c3)cc2)CC1	815854778	QCPRBFCAMDCQCW-UHFFFAOYSA-N	442.545	1.317	50	20	IDGD	
Cc1cccn2cc(COc3ccccc3C(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)nc12	841751068	WCLRDCJMVBNSQG-OAHLLOKOSA-N	442.497	1.417	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)Cc1c(C)nc2nc(SC)nn2c1C	849366645	SFTMJSSMWABRCZ-UHFFFAOYSA-N	429.506	1.274	50	20	IDGD	
CCOc1ccccc1OCC(=O)NN=Cc1c(Cl)nc(N)nc1N1CCOCC1	873985373	JDCKFQCYUIMQGC-UHFFFAOYSA-N	434.884	1.477	50	20	IDGD	
Cc1ccc(/C=C(\C#N)C(=O)OCC(=O)N2CCN(CC(=O)NC(C)(C)C)CC2)cc1	912613461	PJMYPCOUYVOCDT-CPNJWEJPSA-N	426.517	1.504	50	20	IDGD	
COc1ccc(CC(=O)NNC(=O)c2ccccc2C)cc1S(=O)(=O)N1CCOCC1	913265213	LMFUWWNUHYIWNC-UHFFFAOYSA-N	447.513	1.028	50	20	IDGD	
Cc1ccc(NC(=O)COC(=O)/C(C#N)=C\c2cc(C#N)n(C)c2C)cc1S(N)(=O)=O	913287093	SPUZBPIWIJSZRT-UUASQNMZSA-N	441.469	1.250	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)CNS(=O)(=O)c1cc(C)ccc1C	913457948	XYXQAEJALSSXLP-UHFFFAOYSA-N	435.502	1.207	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H](C)n2cccn2)c1	913471022	CIZKNSVOKVMUQV-CQSZACIVSA-N	443.485	1.715	50	20	IDGD	
COc1cccc(C[C@H](C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)n2nnnc2C)c1	915696720	HYRMQBBWSRXKEF-FZKQIMNGSA-N	442.451	1.528	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)NC1CCN(CC(=O)Nc2ccccc2)CC1	916237025	QOIBIPHVSFZFDN-UHFFFAOYSA-N	443.479	1.638	50	20	IDGD	
COc1ccccc1OCC(=O)NN=C(C)c1ccc(S(=O)(=O)NCCC(=O)O)cc1	916296449	NQULJPDWOUWNQS-UHFFFAOYSA-N	449.485	1.367	50	20	IDGD	
CCCS(=O)(=O)N1CCC(NC(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)CC1	916383516	KIDUOXXESONYBY-CYBMUJFWSA-N	430.502	1.128	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NC[C@H](C)N2CCc3ccccc3C2)c2ccccc2c1=O	916604575	IMQJRHOCHYCTNT-INIZCTEOSA-N	448.527	1.807	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)c2cc(F)cc([N+](=O)[O-])c2N)c2ccccc2c1=O	918409885	QKACYMNMLKECPL-UHFFFAOYSA-N	428.380	1.682	50	20	IDGD	
COC(=O)CNS(=O)(=O)c1cccc(NC(=O)/C(C#N)=C/c2cc(C#N)n(C)c2C)c1	918581115	GNPVTDHNGHDWEM-VIZOYTHASA-N	441.469	1.202	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@@H](C)Cc2cccc(O)c2)cc1	919782878	BCQFROPTXZBBSE-HNNXBMFYSA-N	434.518	1.283	50	20	IDGD	
COc1ccc(Br)c2[nH]c(C(=O)NNC(=O)N[C@@H]3CCS(=O)(=O)C3)cc12	919888461	DELNRGJKSOURQV-MRVPVSSYSA-N	445.295	1.070	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)NNC(=O)COc2ccccc2C#N)cc1OC	920930058	FXJAJAHBCGSSQI-UHFFFAOYSA-N	447.473	1.560	50	20	IDGD	
COc1ccc(CCC(=O)N2CCN(CC(=O)NNC(=O)c3cccs3)CC2)cc1	921061925	WLXQNMIUYLQRKI-UHFFFAOYSA-N	430.530	1.295	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Cc2ccc(C(C)=O)cc2)c1	1317885034	ROKLCLVMWOKSNE-UHFFFAOYSA-N	431.514	1.923	50	20	IDGD	
COC[C@@H](C)n1c(C)cc(/C=C(\C#N)C(=O)N2CCN(C(=O)N3CCOCC3)CC2)c1C	1317982397	UAMLIFWSZCAMIN-ALDSOSFCSA-N	443.548	1.816	50	20	IDGD	
O=C(CCc1nc(-c2ccccc2)no1)N1CCN(S(=O)(=O)CBr)CC1	1320266043	PTWNMNZSJXELRJ-UHFFFAOYSA-N	443.323	1.496	50	20	IDGD	
O=C(c1cccc2c1OCCO2)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1777835199	DOHBVKSWMMPZFK-YJBOKZPZSA-N	443.269	1.592	50	20	IDGD	
Cc1nc2ncccn2c1C(=O)N1CC[C@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1777900817	LWPPLHWHXAKYGJ-FQEVSTJZSA-N	431.569	1.333	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc3c(cnn3C)c2)C1	1778707305	NTXJTUBAFQGJOK-LRXVAGHRSA-N	448.951	1.955	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(CN(C(=O)c3cn[nH]c3)CCO2)C1	1780098034	YZKPUIDEBJLIBM-FQEVSTJZSA-N	443.416	1.001	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)C[C@H](N)c3cccnc3)CCO2)C1	1781227336	JGOOYJZAQNAKGG-ZYSHUDEJSA-N	429.348	1.538	50	20	IDGD	
N#Cc1ccccc1OCC(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781334331	LDACIXFQEABXNY-SJLPKXTDSA-N	440.269	1.457	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc3c(c1)CNC3=O)C2	1782175529	MQESZKLKZMTZKW-JBYIUTFZSA-N	449.935	1.311	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc3cccnn3c1)C2	1782178596	LWZMVBNJVSECQF-WAOWUJCRSA-N	434.924	1.716	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Br)C2)C1CCC(O)CC1	1782330582	BSTFKHUQNDPADR-PTALEHFISA-N	435.334	1.742	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)CCc3ccc(O)nn3)C2)C1	1782641794	XLPLVCUGKBCQKO-KBXCAEBGSA-N	441.326	1.118	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1C=CCN1)CCO2	1782864825	VFEJNKZCAZPDGD-ZMMSGNDHSA-N	428.439	1.230	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)CNC(=O)OC(C)(C)C)C2)C1	1783401669	TUMQTUKUMPPNQZ-ACJLOTCBSA-N	448.358	1.515	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)Cn3cnc4ccccc43)CCO2)C1	1783539998	PSEXZBVUBFQOQV-KUHUBIRLSA-N	435.322	1.650	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3nnc(-c4ccccc4)o3)CCO2)C1	1783877210	HIKFGRWFXZYUSN-QRWLVFNGSA-N	434.880	1.434	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]2C1	1784092825	MPUOLFPKPDOTCR-SIUGBPQLSA-N	431.316	1.542	50	20	IDGD	
CC[S@@](=O)CCC(=O)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1	1788142121	BYQFVPPKWDEFKA-WJOKGBTCSA-N	442.346	1.273	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc4c3NC(=O)C4=O)[C@H]2C1	1788436197	UHBBBNBSNDVUCE-DDWPSWQVSA-N	433.892	1.432	50	20	IDGD	
COCc1c[nH]c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Br)C[C@@H]32)c1	1789211036	WQIVABXALKYPLA-JURCDPSOSA-N	432.290	1.445	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3CC3)C[C@@H]21	1789222016	BOFLGGVHRUNEKX-FNHZYXHNSA-N	431.445	1.523	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1ccc(C2(NC(=O)c3ccc[n+]([O-])c3)CCC2)cc1	1789521067	CPKDLMHZTHPAFP-UHFFFAOYSA-N	446.467	1.380	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3c[nH]c4ncccc34)C[C@@H]21)[C@@H](F)Br	1789922410	FGDZQZSIBPTTDK-FBUXBERBSA-N	439.285	1.847	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3noc4c3CCCC4)C[C@@H]21	1791058004	VDDPHMQXJHHAAH-DSPQJCBJSA-N	440.338	1.930	50	20	IDGD	
CN1Cc2ccccc2C[C@@H]1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]2C1	1791294326	XFJRCPFGDWTQTQ-FJIDUMEYSA-N	440.371	1.827	50	20	IDGD	
O=C1Nc2c(cccc2C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]3C2)C1=O	1791298325	PYTLGIAROYNZRS-XDTLVQLUSA-N	440.283	1.218	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1ccc(C2(NC(=O)CCc3cnccn3)CCC2)cc1	1791603352	TXBOEJNBPPCKKC-UHFFFAOYSA-N	438.532	1.916	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3CC3)[C@H]2C1	1791874897	IAVFYXQRLBRIMK-VGWMRTNUSA-N	429.945	1.508	50	20	IDGD	
COc1ccc([C@@H](O)C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCBr)C3)cc1	1792713907	YDZODTZIUVDXIK-LTCOOKNTSA-N	441.322	1.103	50	20	IDGD	
CCCCCc1ncc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](O)CCl)s1	1792983470	IXVUMPVPTLXIOA-LOUJCGABSA-N	429.970	1.679	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cn1ccc2ccc([N+](=O)[O-])cc21)[C@H](O)CCl	1793407274	OTFOPVKNDCFCRJ-BASYENTBSA-N	434.880	1.787	50	20	IDGD	
CC(C)[C@@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](O)CCl)C2)N1Cc2ccccc2C1=O	1793542515	OSROPRDBTKJCFN-DSJDWBEOSA-N	447.963	1.905	50	20	IDGD	
COc1ccc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CO[Si](C)(C)C)C3)cn1	1793893694	NHUHCFOQPVGMPW-UPHUGPLXSA-N	435.597	1.464	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)nc(Cl)c1	1794415600	CCELGDZYWBVTDX-GCDPNZCJSA-N	432.702	1.427	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)c1csc2c1CCCC2	1796188922	AZKFULRMVQRERR-BCDXTJNWSA-N	438.358	1.872	50	20	IDGD	
CC1(C)Cc2cccc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)c3ccc(B(O)O)cc3)C4)c2O1	1796695983	ICTJDZKONGIRJC-ACDBMABISA-N	448.328	1.646	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc3[nH]ncc13)C2	1796892227	PIMHQZOHJGYKGO-LCFLCXBCSA-N	447.499	1.949	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2c(c1)CCN2C	1797019828	NCZJKBPPBIQYDK-PTOXDTDZSA-N	436.350	1.666	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CCC[C@H]2CCCC[C@@H]21	1797266121	REOPKSMCSHLAJO-TYUQVFQOSA-N	448.608	1.556	50	20	IDGD	
COc1ccc2cc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)c3cccc(B(O)O)c3)C4)[nH]c2c1	1797430285	IQDDOQBSXNCHEH-REPLKXPHSA-N	447.300	1.422	50	20	IDGD	
CCc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)CBr)C3)nn1C	1798318273	UOFSSBDHJUIVCZ-NFFDBFGFSA-N	427.343	1.217	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1n[nH]c3ccccc13)C2	1798440591	RUHWVWDLVSXEDV-BTTYYORXSA-N	433.472	1.127	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(C#N)c1Cl	1798592799	ZZSXTJSLPYLKFM-YXPYIKCWSA-N	426.300	1.669	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(N3CCOCC3)c1)C2	1799268128	LJAOTZUEUFPKDO-HNJRGHQBSA-N	435.952	1.744	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=N/O[C@H]1CCCCO1)C2	1799276494	KRIFEUILLBELED-AAFDZJLISA-N	436.336	1.341	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccn3ccnc3c1)C2	1799277105	RVPMUACLOAZICN-QHHYFVSCSA-N	425.316	1.774	50	20	IDGD	
O=C(/C=C/C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Br)c1cccs1	1799347346	NKUPPMJZNIREOG-JMAOVPHRSA-N	445.310	1.767	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(Cl)(Cl)Cl	1800582715	RHXVWNPIKQWQJH-QEYWKRMJSA-N	436.561	1.977	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)ccc1F)C2	1800643099	LMJAQWWCFRFCFG-VAECKANCSA-N	429.286	1.908	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1ccc(F)nc1)C2	1800756375	CBOFFILFLHYUSJ-DPYKFYPSSA-N	428.302	1.526	50	20	IDGD	
C=CCCc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](Cl)COC)c(O)n1	1800974329	SSZASQGNUGQCQC-DACLVMHWSA-N	437.924	1.363	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)c1ccccc1Cl)C2	1800982181	YUHNMWBSNUWAIJ-QMWOBKFGSA-N	431.316	1.217	50	20	IDGD	
COC(=O)N(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](O)CCl)C2)Cc1ccccc1	1802105587	KRNTUSHRDVMJMQ-MHORFTMASA-N	437.924	1.493	50	20	IDGD	
O=C(Cc1cccc([N+](=O)[O-])c1)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1	1802378166	NRPUKUQWJJLPTF-QRFRQXIXSA-N	446.891	1.838	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)Cc2cccc([N+](=O)[O-])c2)[C@H]1c1cccnc1)[C@H](O)CCl	1803137853	UGZQICCCTUTDPP-HQRMLTQVSA-N	446.891	1.838	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H](CNC(=O)CN2CCOC2=O)[C@H]1c1cccnc1	1803337997	FPWDAWVDVDRRDT-VQIMIIECSA-N	434.569	1.391	50	20	IDGD	
COC[C@@H](C)C(=O)N1CCCC2(CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CC2)C1	1806142459	DNLKOZFXRNVZAE-LXUZAUPUSA-N	431.537	1.634	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)/C=C/c2ccoc2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807360511	BZRRWQMOXGNXQM-HXKKIVOGSA-N	445.284	1.387	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)[C@H](F)Cl)[C@H]1c1cccnc1	1808312363	CWASSIKAKNUWRB-VFZXZXODSA-N	448.886	1.756	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1CCN(C(=O)[C@H]2CCC(=O)NC2)[C@H]1c1cccnc1	1810538086	SALNVXXPNKHTEF-ZWOKBUDYSA-N	432.597	1.465	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)[C@H]2[C@H]3SC=C[C@H]32)[C@@H]1c1cccnc1	1813073796	MJHBTUFHGXFYLF-KHDMTIDOSA-N	443.573	1.336	50	20	IDGD	
O=C(CCn1ccnn1)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@@H]1c1cccnc1	1813432530	NCDWDVFTDQZLJJ-IMJJTQAJSA-N	439.289	1.460	50	20	IDGD	
C[C@]1(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)CC=CCC1	1813579537	OFNCUJHVPSMOIV-KJWPAHLWSA-N	447.344	1.827	50	20	IDGD	
Cc1nc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)cs1	1815339367	BFZYYGSCRSUNDR-CYBMUJFWSA-N	442.331	1.127	50	20	IDGD	
C=CCC(F)(F)C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1	1815348651	UWLOVEAANWGEFD-CYBMUJFWSA-N	435.261	1.260	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H]1CC[C@H]3CCC(=O)N3C1)CC2)[C@H](F)Cl	1817128798	QTBSXOUDTHTRFR-OZWUEAAUSA-N	428.917	1.991	50	20	IDGD	
O=C(N[C@@H]1CCc2nc(NC(=O)[C@@H](F)Cl)sc2C1)c1cc(=O)nc2cccnn12	1817128829	QVUDKKKRZKWMHG-XLKFXECMSA-N	436.856	1.306	50	20	IDGD	
COC(=O)c1ccc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@H](O)CCl)CC3)cn1	1817535558	KENYRASBFDJRTL-ZWNOBZJWSA-N	438.893	1.150	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)C(Cl)Cl)CC2)c1nc2ncccn2n1	1818310135	FCKKSXIGUAHUEG-SSDOTTSWSA-N	426.289	1.610	50	20	IDGD	
CC(=O)OC[C@H](OC(C)=O)C(=O)Nc1cc([C@H]2CCCCN2C(=O)C(Cl)Cl)[nH]n1	1819432302	GCEJZPVCLBDKIO-OLZOCXBDSA-N	449.291	1.700	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)C1CCCCC1)CC2	1819795217	KHHYCPKSYUWXRD-CYBMUJFWSA-N	442.545	1.948	50	20	IDGD	
C[Si](C)(C)OCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)/C=C\C(=O)NC1CC1)CC2	1820165440	GFKMXEYPNDDKKS-LJTDUEICSA-N	436.610	1.741	50	20	IDGD	
CN1CCN(CC(=O)N2CCCC[C@H]2c2cc(NC(=O)[C@](C)(Cl)CCl)n[nH]2)CC1	1820865789	BRWHXRPPFNJUCH-HNAYVOBHSA-N	445.395	1.886	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)C23CC(C(=O)OC)(C2)C3)[nH]n1	1822377564	XVGKBQXYWSPZDA-DVJGTGJLSA-N	438.912	1.999	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCn1cncn1)CC2	1822869335	JTFKSDVCARCRIY-MGPLVRAMSA-N	431.349	1.973	50	20	IDGD	
O=C1CC[C@H](C(=O)N2CCCC[C@H]2C2CCN(C(=O)[C@@H](F)Br)CC2)CN1	1823842102	XUSOVXLVJLJRFJ-OFQRWUPVSA-N	432.334	1.823	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(C(=O)O)ncn2)CC1	1825508349	RAAXWMGRYFVPGL-WMLDXEAASA-N	438.912	1.662	50	20	IDGD	
Cc1ccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)nc1	1826070435	CQKKPNVELTYNHE-QFIPXVFZSA-N	435.333	1.617	50	20	IDGD	
C[C@@H](CS(C)(=O)=O)C(=O)N[C@H]1CCc2nc(NC(=O)C(Cl)Cl)sc2C1	1826093418	ZQGUHVFYDHGVRB-YUMQZZPRSA-N	428.363	1.540	50	20	IDGD	
O=C(CCn1cncn1)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](F)Br)CC2	1826608620	OVGQUPYVYBXUPR-PELKAZGASA-N	431.291	1.427	50	20	IDGD	
Cc1cc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)cn1C	1827052816	HSPVQYDWANJSJO-JOCHJYFZSA-N	437.349	1.560	50	20	IDGD	
Cc1nccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)n1	1827884400	CGBMTCFBNGFOPC-OAQYLSRUSA-N	436.321	1.012	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnc(Cl)nc3)CCO2)C1	1829513786	CKKWROBESGCVMM-KBXCAEBGSA-N	431.320	1.608	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(Cl)cnc3OC)CCO2)C1	1829586219	DLDDUYLVTGQNHX-KXBFYZLASA-N	446.331	1.831	50	20	IDGD	
CCNC(=S)NCC(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@H](Cl)COC)CC1	1831093340	LLTJEFGJHMUAIT-CVEARBPZSA-N	433.018	1.344	50	20	IDGD	
O=C([C@H](F)Br)N1CCC([C@@H]2CCCCN2C(=O)Cn2ccncc2=O)CC1	1831109756	BIMQANDBWUIVLD-YOEHRIQHSA-N	443.317	1.554	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccc(O)cn3)C2)C1	1831658957	KFGXSZUGZXXDII-YLJYHZDGSA-N	425.913	1.194	50	20	IDGD	
Cc1csc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)c1	1831777810	NGUCBKKKJWTAIK-LJQANCHMSA-N	426.611	1.978	50	20	IDGD	
Cc1cccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)n1	1831871403	DGGVITQESVCQIJ-HXUWFJFHSA-N	429.565	1.996	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)C(C)(C)CCl)CC2)CC1	1833216077	SYGZYOJGCAOEJQ-UHFFFAOYSA-N	444.020	1.196	50	20	IDGD	
O=C(c1cc2n(n1)CCCC2)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1836980615	IENGLTPEKINJIH-SFHVURJKSA-N	431.320	1.093	50	20	IDGD	
O=C(Cn1cc([N+](=O)[O-])cn1)N1CCC(OC2CCN(C(=O)C(Cl)Cl)CC2)CC1	1837135796	LFJIEJJESFVPCP-UHFFFAOYSA-N	448.307	1.594	50	20	IDGD	
Cn1nc(C(=O)N2CCC(OC3CCN(C(=O)CO[Si](C)(C)C)CC3)CC2)cc1O	1837269848	DJAWZTNEAJADAN-UHFFFAOYSA-N	438.601	1.589	50	20	IDGD	
Cn1ccnc1C(=O)N1CCC(OC2CCN(C(=O)[C@H](F)Br)CC2)CC1	1837536313	MFZOCABHHWDKKN-AWEZNQCLSA-N	431.306	1.723	50	20	IDGD	
CCN1CCC(C(=O)N2CCOC[C@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)CC1	1837718163	YQLYIZWVEIZFLW-NRFANRHFSA-N	441.645	1.026	50	20	IDGD	
CC(C)c1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)on1	1838778615	AEVYQYHXJZFOHU-ACJLOTCBSA-N	444.326	1.651	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccccc3F)CCO2)C1	1838853557	VNIIYSGBKFQQCZ-LIRRHRJNSA-N	443.313	1.927	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)/C=C/C3CCCC3)CCO2)C1	1839179486	GRWOEWBNFRNEFJ-RYUWCBOHSA-N	429.355	1.973	50	20	IDGD	
O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(O)ccc1F)CCO2	1839294563	WFSUWKYQJZFHOF-GOSISDBHSA-N	445.285	1.386	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4cccc(C)c4[nH]3)C2)C1	1840153394	NENPVSBSXIJRPH-JTSKRJEESA-N	449.935	1.800	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(OC)cc3)C2)C1	1840153806	AXKWCRXHQZTNQZ-PXNSSMCTSA-N	426.897	1.019	50	20	IDGD	
O=C(c1n[nH]c2cccc(F)c12)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840189591	AGJOBBFEEOZBMZ-GOSISDBHSA-N	445.278	1.576	50	20	IDGD	
C[C@@H](Cc1ccccn1)C(=O)N1CCO[C@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1	1840334370	SRQCMTYBLPMOGD-AVRDEDQJSA-N	449.624	1.568	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)CSC2CCCC2)C1	1841591751	LFFIKAKFIZQVJX-HZHRSRAPSA-N	431.562	2.000	50	20	IDGD	
CC[C@H](C(=O)N1CCCC12CN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2)N(CC)CC	1841673523	FLIMOZIRWYMVSX-WCIBBKAISA-N	430.553	1.444	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1nc3ccccn3c1C)C2	1843416032	RLIXFVYOMJEAES-CVKSISIWSA-N	447.499	1.594	50	20	IDGD	
Cc1ccc(C(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)cc1Cl	1844263200	DOTSIQHDNFOHHL-UHFFFAOYSA-N	427.892	1.778	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@]1(O)CCN(C(=O)OC(C)(C)C)C1)C2	1845167806	VSVGIOWUCQDSNK-VBKZILBWSA-N	429.945	1.579	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2cc(F)c(F)c(Cl)c2)C1	1846867724	NIIUNUBRZTYMAA-UHFFFAOYSA-N	449.845	1.748	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)/C=C/C(=O)NCc1ccco1	1847499391	YIVZMEAMGNMYQP-ZQRKMXHTSA-N	438.322	1.685	50	20	IDGD	
O=C(CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)NNC(=O)COc1ccccc1F	14843792	IHBIDTAPVYYODR-UHFFFAOYSA-N	432.364	1.648	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)Cn2nc(-c3ccccc3)oc2=O)cc1	16496413	NYWZQCJQVQHLHD-CQSZACIVSA-N	426.429	1.517	50	20	IDGD	
COC(=O)CCCNC(=S)NNC(=O)c1nn(CCC(C)C)c(=O)c2ccccc12	18141523	HWONUKZSADKRNK-UHFFFAOYSA-N	433.534	1.505	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)NNC(=O)c1sccc1S(=O)(=O)N1CCOCC1	25487897	IOPLSYBTHRBVFE-UHFFFAOYSA-N	448.526	1.254	50	20	IDGD	
O=C(CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@H]12)NNC(=O)c1cc(-c2ccccc2)on1	27264611	WQPOKXUKMUNLQH-ZVZYQTTQSA-N	429.502	1.828	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)CNC(=O)NCc2ccc(F)cc2)cc1	28318309	IMVQHYSSDXIXCS-AWEZNQCLSA-N	432.452	1.639	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CSc2nc3ccccc3c(=O)n2C)cc1OC	28628687	HVFROROKIHASHE-UHFFFAOYSA-N	428.470	1.504	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)CN1C(=O)COc2ccc([N+](=O)[O-])cc21	105038563	NZZBILGQAHHFTA-NSHDSACASA-N	432.364	1.074	50	20	IDGD	
CN(C(=O)OC(C)(C)C)[C@@H]1CCCN(CC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)C1	725812161	BYHHVZIPNPUJSE-MRXNPFEDSA-N	435.481	1.687	50	20	IDGD	
COc1cccc(OC)c1OC1CCN(C(=O)NNC(=O)CNC(=O)c2ccco2)CC1	725872632	PRHINBYANKDDER-UHFFFAOYSA-N	446.460	1.311	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc2c(c1)COC2)NNC(=O)c1cc2c(s1)CCCCC2	726381867	IQEPNPBCLIDKLU-UHFFFAOYSA-N	449.554	1.787	50	20	IDGD	
CN(C)N(C(=O)C1CCN(c2ccc(C(F)(F)F)cn2)CC1)[C@@H]1CCS(=O)(=O)C1	728180389	ZTRYNGVBVPBDFR-OAHLLOKOSA-N	434.484	1.809	50	20	IDGD	
O=C(COC(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12)NNC(=O)[C@H]1COc2ccccc2O1	728340682	MEABJTQJQHAICN-QGZVFWFLSA-N	440.368	1.220	50	20	IDGD	
CC(C)COc1ncccc1C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	728512923	ZEDIVXKNCZXJJF-UHFFFAOYSA-N	426.882	1.492	50	20	IDGD	
CC(C)Cn1c(=O)nc(O)c2c(C(=O)NNC(=O)c3cccc(C#N)c3)cc(C3CC3)nc21	728871163	PRSLHFXLAQRQMV-UHFFFAOYSA-N	446.467	1.977	50	20	IDGD	
O=C(NNC(=O)N1CCO[C@H](c2ccc(F)cc2)C1)C1CCN(c2ncccn2)CC1	728958913	GUZDXQIHRABNLR-SFHVURJKSA-N	428.468	1.646	50	20	IDGD	
CCn1nc(C(=O)NN=C(C)c2cccc(NS(C)(=O)=O)c2)c2ccccc2c1=O	729816054	ACZGPEDOLQHICB-UHFFFAOYSA-N	427.486	1.942	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)N2CCN(CC(C)(C)O)CC2)N(C)c2ccccc21	730087489	UTYOLQQPXBIDQM-UHFFFAOYSA-N	425.533	1.572	50	20	IDGD	
COc1ccc(C(=O)CNC(=O)CCC(=O)NNC(=O)C(C)(C)c2ccccc2)cc1	731200532	QNABZSVKHSILKF-UHFFFAOYSA-N	425.485	1.900	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCc1cn2c(C)cccc2n1	731679846	XUANFVZSBHGIQS-UHFFFAOYSA-N	429.506	1.388	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)[C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)c1	731960016	WDHBQHDZWKFXAA-CQSZACIVSA-N	431.474	1.788	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)CCCOc1ccc(I)cc1	732084557	OSDRNZIUMYKQSV-UHFFFAOYSA-N	428.230	1.943	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NC[C@H](C)N(C)Cc2ccccc2)c2ccccc2c1=O	732469653	JQMDUFQTSOXWEZ-INIZCTEOSA-N	436.516	1.881	50	20	IDGD	
CCN(C(=O)NNC(=O)c1ccc(OC)c(Br)c1)[C@@H](C)CS(C)(=O)=O	732998411	LFOHSJXGOWKJOU-JTQLQIEISA-N	436.328	1.567	50	20	IDGD	
CCOCCCn1c(NNC(=O)c2ccnc(-n3cncn3)c2)nc2ccccc2c1=O	733268863	SOLGQANZTFFWHR-UHFFFAOYSA-N	434.460	1.556	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCOCC2)cc1C(=O)NNc1ncccc1Cl	734245887	CIDPGHHTHREYFG-UHFFFAOYSA-N	426.882	1.521	50	20	IDGD	
CC(CS(=O)(=O)c1ccccc1)=NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1	735408116	CHUJWAKTYDUZBN-UHFFFAOYSA-N	437.543	1.582	50	20	IDGD	
O=C(CC[C@H]1NC(=O)N(c2ccc(Cl)cc2)C1=O)NNC(=O)COCc1ccccc1	737629419	QJEGGIFLUCQHSR-QGZVFWFLSA-N	444.875	1.909	50	20	IDGD	
CCOCCCn1c(NNC(=O)c2ccnc(N3CCCC3)n2)nc2ccccc2c1=O	739730299	CQGPRSQJCKTIBQ-UHFFFAOYSA-N	437.504	1.970	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)[C@H]2CN(Cc3ccccc3)CCO2)cc1	741174037	YZTUULBWPJCPLK-DYESRHJHSA-N	427.501	1.901	50	20	IDGD	
O=C(O)c1cc(S(=O)(=O)NNC(=O)c2cccc3ccccc23)cc2c1OCCO2	741655140	GGKGXPSAPCSCBO-UHFFFAOYSA-N	428.422	1.933	50	20	IDGD	
O=C(NNc1ncnc2[nH]cnc12)c1ccc(NC2=NS(=O)(=O)c3ccccc32)cc1	743470935	LCYIDBWLJKBNKW-UHFFFAOYSA-N	434.441	1.671	50	20	IDGD	
CCOc1cc([N+](=O)[O-])c(C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)cc1OC	744521682	RQHGFHVIMGMLTN-UHFFFAOYSA-N	442.384	1.492	50	20	IDGD	
CCN(C)C(=O)c1cccc(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)c1	744622250	YCXXHACZSXZVOD-UHFFFAOYSA-N	446.529	1.556	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(-n3cncn3)c(C)c2)cc1OC	745411400	OJVNKFNCMZSPKM-UHFFFAOYSA-N	439.428	1.211	50	20	IDGD	
CC(C)[C@H](CNC(=O)NNC(=O)c1cccc(Br)c1)N1CCN(C)CC1	745431605	DYZVCWPKXBBMPN-INIZCTEOSA-N	426.359	1.665	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(C)c(NC(=S)NNC(=O)Cc2ccncc2)c1	747672039	LLHKBPDQVDPSIF-UHFFFAOYSA-N	435.575	1.981	50	20	IDGD	
O=C(C[C@H]1C=CS(=O)(=O)C1)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1	747786973	GMLVGCYJEHMZJL-WIYYLYMNSA-N	439.537	1.709	50	20	IDGD	
Cc1ccc(C)c(S(=O)(=O)Oc2ccc(C(=O)NNc3nccn(C)c3=O)cc2)c1	747942170	YJBAZMCKAAFQMV-UHFFFAOYSA-N	428.470	1.922	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc(CCCl)cc1)N1CCN(c2ccccn2)CC1	748315304	KDZMFWRHAAVQDS-UHFFFAOYSA-N	436.965	1.880	50	20	IDGD	
O=C(NC1CC1)c1cc(F)c(NNC(=O)[C@H]2Nc3ccccc3S(=O)(=O)N2)c(F)c1	748828298	WTDSONYGLOFRHL-INIZCTEOSA-N	437.428	1.030	50	20	IDGD	
C[C@H](Sc1ccnc2cc(Cl)ccc12)C(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1	749927692	UTCGHBANAJDWHA-CMPLNLGQSA-N	442.950	1.886	50	20	IDGD	
COc1ccc(C(=O)CNC(=O)CCC(=O)NNC(=O)c2ccc(Cl)cc2OC)cc1	751310175	NAWCBAQSQABMGC-UHFFFAOYSA-N	447.875	1.898	50	20	IDGD	
CCOC(=O)[C@H]1Cc2cc(S(=O)(=O)NNC(=O)c3ccc(Cl)nc3)ccc2O1	751540313	GJSQHOFQLKLNFG-CQSZACIVSA-N	425.850	1.225	50	20	IDGD	
C[C@@H](NC(=S)NNC(=O)c1ccc(Br)c(S(=O)(=O)N(C)C)c1)C1CC1	751617538	AYGMQQWYLLOAJU-SECBINFHSA-N	449.396	1.607	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NN=C1CCCC[C@@H](N2C(=O)c3ccccc3C2=O)C1	752733311	HYDLZXABIOMHGS-QGZVFWFLSA-N	433.468	1.913	50	20	IDGD	
O=C(CCc1cccc([N+](=O)[O-])c1)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	755047342	MDRUDHAPPCHWOY-UHFFFAOYSA-N	446.485	1.773	50	20	IDGD	
CN1CC[C@H](NC(=O)NNC(=O)C(=O)Nc2ccccn2)[C@H]1c1ccc(Cl)c(F)c1	755100888	VOQLPVIFSOCCCL-GOEBONIOSA-N	434.859	1.588	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)C(=O)Nc2cc(C(N)=O)ccc2-n2cc(C)cn2)c1	755343746	GYPIINPGHNDNQM-UHFFFAOYSA-N	436.428	1.148	50	20	IDGD	
COC(=O)CNC(=O)c1ccc(NC(=O)NNC(=O)c2ccc(OC)cc2OC)cc1	755552353	ZXQQRFVZBDPFKL-UHFFFAOYSA-N	430.417	1.073	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NN=Cc1cnc(N2CCN(C)CC2)nc1	755563619	IVKIWUQBHLAXOU-CQSZACIVSA-N	447.337	1.909	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2cc(Cl)c(F)c(Cl)c2)c1	756155334	OXSAAQKDKCJOGS-UHFFFAOYSA-N	448.259	1.936	50	20	IDGD	
COc1cc(Br)c(NC(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)cc1OC	756183929	PVLCTZJITFAQJP-MRVPVSSYSA-N	436.284	1.054	50	20	IDGD	
COc1ccc(C(=O)N2CCN(C)CC2)cc1NC(=O)NNC(=O)Cc1ccccc1F	756247718	IJNFZNLKRCXUEF-UHFFFAOYSA-N	443.479	1.617	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)Nc2ccc(Cl)c(-n3nnnc3C3CC3)c2)n1	756838933	CDAFKIYCGXYQSR-UHFFFAOYSA-N	429.872	1.859	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(C(=O)NN=c2cc[nH]cc2Cl)cc1Br	757420160	QRNXKKLMXBNSGJ-UHFFFAOYSA-N	433.715	1.927	50	20	IDGD	
C#CCCCC(=O)NNC(=O)c1ccc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1	757800238	LBPKPRLTCWQHHV-UHFFFAOYSA-N	430.442	1.960	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1S(=O)(=O)NC1CC1	757864479	HHKKJPVXBZIDFB-UHFFFAOYSA-N	433.446	1.810	50	20	IDGD	
Cc1nn([C@H]2CCS(=O)(=O)C2)c(C)c1NC(=O)NNC(=O)c1ccc2c(c1)OCCO2	757871267	HYGSSSALYIJWTM-AWEZNQCLSA-N	449.489	1.097	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)c1cn(C(C)(C)C)nc1-c1ccccc1Cl	758039606	MLMTWQXKNNUDTG-LLVKDONJSA-N	441.941	1.657	50	20	IDGD	
CC(C)(C(=O)N1CCN(S(=O)(=O)CBr)CC1)c1ccc([N+](=O)[O-])cc1	758524948	ZKDITROGABUZSE-UHFFFAOYSA-N	434.312	1.699	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)NCC2CCN(S(=O)(=O)CC)CC2)cc1OC	758745305	SDZBGVNERIOWBZ-UHFFFAOYSA-N	442.538	1.100	50	20	IDGD	
C[C@@H](O)C[C@H](CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)c1ccccc1	759608859	FHZDEZGZPYIVSQ-CRAIPNDOSA-N	448.545	1.436	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)[C@](C)(O)CN1C(=O)C(C)(C)c2ccccc21	760053392	LSAKKGDMASHQJZ-HSZRJFAPSA-N	441.484	1.297	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2cnc3ccc(F)cc3c2)CC1	760153728	BZRQPLAVGYOIMK-UHFFFAOYSA-N	444.492	1.462	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)c2cccc(S(=O)(=O)NC[C@H]3CCCO3)c2)nc1	760784389	DBXLOFNDWCEHAA-OAHLLOKOSA-N	434.474	1.082	50	20	IDGD	
Cc1nnnn1-c1ccc(F)c(NC(=O)COC(=O)/C(C#N)=C\c2cc(C#N)n(C)c2C)c1	761060882	QYIPTCIVDLNFRK-UUASQNMZSA-N	448.418	1.717	50	20	IDGD	
CCOC(=O)c1cnn2c(C(=O)NNC(=O)C3=S=C4CC[C@H](C)CC4=C3)ccnc12	763270521	OSZFAHRMYDYWCO-NSHDSACASA-N	427.486	1.505	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(C(=O)NC2CCCC2)cc1	763455264	OKEKQGZFLCZLTH-UHFFFAOYSA-N	439.428	1.667	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1cccc(Cl)c1-n1cccn1	763467895	IMZNAXSRHNCAIS-UHFFFAOYSA-N	428.792	1.834	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)[C@H]2CC23CCN(C(=O)OC(C)(C)C)CC3)C[C@@H](C)O1	763467996	ZUFVPUVGICBNDV-IXDOHACOSA-N	438.569	1.670	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)C(=O)Nc1ccc(F)cc1	763508401	IRFMZGVHXRLBDA-UHFFFAOYSA-N	434.449	1.010	50	20	IDGD	
C=CCNC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)cc1	763549305	XAVVPUJEFUXCOL-UHFFFAOYSA-N	425.401	1.123	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c(Br)n1	763574379	ADKPYYUVYBSJIX-ZDUSSCGKSA-N	435.234	1.078	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(O[C@@H]2CCOC2)cc1	763679542	AKFPXDHLTVYQOX-QGZVFWFLSA-N	443.456	1.418	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3cccc(Cl)c3)cn2)C[C@@H](C)O1	763748607	VTAZVMWHDCZNQO-BETUJISGSA-N	431.880	1.748	50	20	IDGD	
CCCOc1cccc(NC(=O)C(=O)NNC(=O)c2nn(CC)c(=O)c3ccccc23)c1	763785116	FPXOQRLWCFODLF-UHFFFAOYSA-N	437.456	1.605	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)COc1ccc(C2SCCCS2)cc1	763821163	SZRXPBJQTRDNIE-UHFFFAOYSA-N	446.554	1.907	50	20	IDGD	
CCn1nccc1NC(=O)C(=O)NNC(=O)c1nn(CCC(C)C)c(=O)c2ccccc12	763844179	WMSDYFWWWYUDPH-UHFFFAOYSA-N	439.476	1.059	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@H](C)C(=O)NNC(=O)C(=O)Nc1cccc(C(N)=O)n1	763877254	IXWOXEFXMYZTSE-LLVKDONJSA-N	433.852	1.004	50	20	IDGD	
Cc1cc(C)n(-c2ccc(NC(=O)C(=O)NNC(=O)Cc3ccc(Cl)cc3)cn2)n1	763932725	RWQOEECVTPUUQD-UHFFFAOYSA-N	426.864	1.866	50	20	IDGD	
Cn1cccc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CC[C@H](C(C)(C)C)C3)c1=O	763939003	APTQKZHXKZUBEZ-ZDUSSCGKSA-N	430.530	1.998	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2c(F)cccc2-n2cccn2)o1	764139483	UUHCELUOFSUWDX-UHFFFAOYSA-N	442.451	1.846	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)n(Cc2ccccc2)n1	764242256	CHQQOOJDOIZXQC-UHFFFAOYSA-N	430.468	1.981	50	20	IDGD	
CO[C@@H](C)C(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2cccc3ncccc23)c1	764257482	HYQATWYWIAVDES-ZDUSSCGKSA-N	435.440	1.608	50	20	IDGD	
O=C(Cc1ccccn1)NNC(=O)C(=O)Nc1ccc(Oc2ccc(Cl)nn2)cc1	764267113	NXAMBIYGYBFQSV-UHFFFAOYSA-N	426.820	1.646	50	20	IDGD	
COC(=O)c1cc2cc(NC(=O)C(=O)NNC(=O)c3ccc(OC)cc3OC)ccc2o1	764284509	MVBKNUOVFFYCMX-UHFFFAOYSA-N	441.396	1.636	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)C(=O)Nc1ccc(OC)c(-n2nnnc2C)c1)c1ccccc1	764329907	QQGMDHFSJSHHRG-MRXNPFEDSA-N	437.460	1.259	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c(OC)c1OC	764343085	NXYSBWZBXRSQCW-UHFFFAOYSA-N	439.428	1.298	50	20	IDGD	
CC(=O)N(C)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)cc1	764389128	ZTZBEXDHJKESGR-UHFFFAOYSA-N	438.419	1.598	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1ccc(N(C)C(C)=O)cc1	764399133	ZVZPMTZVTHBLSZ-UHFFFAOYSA-N	430.486	1.556	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1F)C(=O)Nc1cccc(Cn2cccnc2=O)c1	764410410	OSQQIUISZKQITN-UHFFFAOYSA-N	443.822	1.484	50	20	IDGD	
CCOC(=O)c1cc(-c2ccccc2)ccc1NC(=O)C(=O)NNC(=O)[C@H]1COCCO1	764434656	RAEKNIYTELGELI-GOSISDBHSA-N	441.440	1.032	50	20	IDGD	
CC(=O)c1cccc(S(=O)(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)c1	765129054	ZVASPVZOEOFKCG-UHFFFAOYSA-N	444.557	1.325	50	20	IDGD	
C[C@@H]1CCCC[C@@]12NC(=O)N(CC(=O)NNC(=O)c1cc(-c3cccs3)[nH]n1)C2=O	765569421	IOLNRIGYIUVHGO-NSPYISDASA-N	430.490	1.400	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)[C@H]1CCSc2ccccc21	766642127	JRIUGRUXMBZNIE-IBGZPJMESA-N	438.553	1.871	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)[C@@H](C)S(=O)(=O)c2ccc(F)cc2)n[nH]1	768281848	QYIFTZZCRGUSRY-GFCCVEGCSA-N	446.460	1.848	50	20	IDGD	
N#Cc1cc(Cl)nc(NNC(=O)C2CCN(C3=NS(=O)(=O)c4ccccc43)CC2)c1	768696663	ZBBDDNHFZTXJMX-UHFFFAOYSA-N	444.904	1.911	50	20	IDGD	
Cc1ccc(CNC(=O)NNc2nc(O)c3cnn(C)c3n2)c(OC[C@@H]2CCCO2)c1	770413497	SCCAGAQHNZLCSN-AWEZNQCLSA-N	427.465	1.761	50	20	IDGD	
COc1ccc([C@H]2[C@@H](C(=O)NNc3nc(O)c4cnn(C)c4n3)CCC(=O)N2C)cc1	770972009	OHIOQBPWVJJEOD-BBRMVZONSA-N	425.449	1.130	50	20	IDGD	
Cc1[nH]ccc(=NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1Cl	771769564	UEYIUTPLZUYERP-UHFFFAOYSA-N	437.909	1.716	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)CCc1ccc(S(=O)(=O)N2CCCCC2)cc1	771876753	XVZBAFGUHLACNW-HNNXBMFYSA-N	439.534	1.283	50	20	IDGD	
CCOc1cc(C#N)cc(Br)c1OCC(=O)O[C@H](C)C(=O)NNC(=O)CC	772003981	MYXILTUNLWKISJ-SNVBAGLBSA-N	442.266	1.587	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)CCNC(=O)c1ccc([N+](=O)[O-])cc1	772968280	QKHIRZCOCRBKFK-LBPRGKRZSA-N	434.836	1.983	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](CC(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1)c1ccccc1	773263743	ZTLGHNMCYSFGEM-LSDHHAIUSA-N	425.507	1.225	50	20	IDGD	
CC(C)c1nccnc1NNC(=O)C(=O)Nc1ccc(F)c(S(=O)(=O)NC2CC2)c1	773993460	WFISOUFHNLFALS-UHFFFAOYSA-N	436.469	1.262	50	20	IDGD	
COC(=O)c1sccc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1cccc(Cl)c1	774010191	VSUIBKRIOBKLNS-SECBINFHSA-N	425.850	1.742	50	20	IDGD	
CCOc1ccccc1[C@@](N)(C(=O)NNC(=O)[C@H]1COc2ccccc2O1)C(F)(F)F	776318192	QNFKSJLOHNKFQL-VQIMIIECSA-N	439.390	1.789	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)C[C@H]1C=CCCC1	777412925	XFAUWTUMFMYUEF-SFHVURJKSA-N	435.546	1.534	50	20	IDGD	
Cc1ccc2cccnc2c1S(=O)(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	777937112	LSMQDMFNUNUVEH-UHFFFAOYSA-N	432.889	1.823	50	20	IDGD	
Cc1nn(CC(F)(F)F)c(C)c1[C@@H](C)C(=O)NNc1nccc(N2CCOCC2)n1	778508685	KXUWUAYGORNYOK-LLVKDONJSA-N	427.431	1.936	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)N1CCC[C@@H](S(=O)(=O)N2CCc3ccccc32)C1	779624673	QLOZTHZRZNYOGJ-SJLPKXTDSA-N	436.578	1.425	50	20	IDGD	
N#Cc1cc(Cl)nc(NNC(=O)[C@@H]2C[C@@H](O)CN2S(=O)(=O)c2ccc(F)cc2)c1	780977379	LYFCOVPIWAPIEZ-OCCSQVGLSA-N	439.856	1.013	50	20	IDGD	
COc1cccc(NNC(=O)[C@@H](CCS(C)(=O)=O)NC(=O)c2ccccc2Cl)n1	781024070	PROUZSJIJXEDQN-CQSZACIVSA-N	440.909	1.420	50	20	IDGD	
CC(=O)N1CCN(Cc2cccc(NC(=O)C(=O)NNc3ccc(F)c(F)c3F)c2)CC1	782117288	MKAFCNUWJLSHJF-UHFFFAOYSA-N	449.433	1.850	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc3ccccc3cc2O)c(OC)c1	782121767	WGRQFRKJTHOHFS-UHFFFAOYSA-N	437.408	1.740	50	20	IDGD	
Cc1ccc(-c2ncco2)cc1NC(=O)C(=O)NNC(=O)Cc1nc2ccccc2n1C	782893755	LCEBUPQXXUPBHK-UHFFFAOYSA-N	432.440	1.865	50	20	IDGD	
Cc1nc(C)n(-c2ccccc2NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)n1	782894979	UHNRHIFEKRUSBX-UHFFFAOYSA-N	446.471	1.099	50	20	IDGD	
O=C(NNC(=O)C(=O)NC1CC1)C(=O)Nc1ccc(Cc2nc3ccccc3s2)cc1	782965817	JCEGCYZPROMWII-UHFFFAOYSA-N	437.481	1.252	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc2c(c1)CCN2C(=O)C(=O)NNc1cc(C)nc(C)n1	783326585	JXUBMOLKOOFUER-UHFFFAOYSA-N	446.533	1.156	50	20	IDGD	
Cc1ccnc(NNC(=O)C(=O)Nc2cccc(S(=O)(=O)NC3=NCCCCC3)c2)c1	783928744	FQCALTWJCNNFLA-UHFFFAOYSA-N	444.517	1.723	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1cccc(NC(=O)C(=O)NNc2ccc(Cl)nn2)c1	784792015	RGJXAAMXBVAFFX-UHFFFAOYSA-N	426.886	1.289	50	20	IDGD	
COCC(=O)N1CCc2cc(NC(=O)C(=O)NNc3ccnc(Br)c3)ccc21	784828884	PDINEYMNNKEDSW-UHFFFAOYSA-N	448.277	1.461	50	20	IDGD	
COc1cc(Br)cc(NC(=O)C(=O)NNc2cccc(S(C)(=O)=O)c2)c1	784844144	HPEVELVEHBFVJV-UHFFFAOYSA-N	442.291	1.943	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1ccnn1-c1ccccc1C	785330881	NOQANSHGNSKFMK-UHFFFAOYSA-N	443.485	1.675	50	20	IDGD	
CCCNC(=O)c1cccc(NC(=O)C(=O)NNc2c(OC)cccc2S(C)(=O)=O)c1	785338364	LCELFYALFSLSAF-UHFFFAOYSA-N	448.501	1.320	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccc(Oc3cccc(F)c3F)nc2)n1	787543198	GXMAQVLHKFZWLU-UHFFFAOYSA-N	444.398	1.752	50	20	IDGD	
O=C(NC[C@H](Cc1cccc(F)c1)C(=O)N1CCOCC1)NNC(=O)c1ccccc1	789309517	DTBYEDRLGYVOCN-SFHVURJKSA-N	428.464	1.487	50	20	IDGD	
Cc1ccc(-n2cccn2)cc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccc(F)cc1	789583972	AFJRJRNRTHBPLL-CQSZACIVSA-N	425.420	1.873	50	20	IDGD	
O=C(NNc1nc2ccccn2n1)[C@@H]1CCCC[C@H]1C(=O)NNc1nc2ccccn2n1	791253269	SETOMPAUDRDDTC-ZIAGYGMSSA-N	434.464	1.165	50	20	IDGD	
Cn1c(=NNC(=O)C(=O)Nc2ccc(Cc3nnc4n3CCC4)cc2)sc2ccccc21	792283705	ZHUFGRIXCNQNJT-UHFFFAOYSA-N	447.524	1.939	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)C(=O)Nc1cc(-c2ccccc2)ccc1Cl	792355324	FWZFDMJYZIWSLE-NSHDSACASA-N	438.893	1.031	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2cc3cnn(C(C)C)c3nc2C)n1	792703170	CRUQJZZNDIBMOP-UHFFFAOYSA-N	430.490	1.632	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CNC(=O)c2ccccc2I)n1	794089540	IBQQZOBJXCZCTH-UHFFFAOYSA-N	438.225	1.186	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1	794722321	WGYCCHJICCXMRP-UHFFFAOYSA-N	431.562	1.592	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2cc(=O)c3ccc(F)cc3o2)ccc1Cl	794779172	DYLTWEDXSYYMHQ-UHFFFAOYSA-N	439.808	1.308	50	20	IDGD	
CCOc1ccc(C(=O)NNS(=O)(=O)c2cccc([N+](=O)[O-])c2OC)cc1OC	794867514	XQCYWNVOAQFAAZ-UHFFFAOYSA-N	425.419	1.634	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)[C@]2(C)CCN(C(=O)OCc3ccccc3)C2)C[C@@H](C)O1	794898428	FQNXYFNOCMJEBS-IEGUWTFLSA-N	446.548	1.682	50	20	IDGD	
COCc1ccc(OC)c(S(=O)(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)c1	795280168	DGZJHODOAAZEKM-UHFFFAOYSA-N	440.474	1.491	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)CCSc2ccc(F)cc2)cc1OC	797000145	RGXFYYYDCMLFHW-UHFFFAOYSA-N	449.460	1.889	50	20	IDGD	
C=C(C)[C@@H]1OCC[C@@H]1CNC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	798116042	BHHIMXRBRQWSEA-AEFFLSMTSA-N	436.534	1.396	50	20	IDGD	
Nc1nc(Cl)cc(NNC(=O)Nc2cnc(N3CCOCC3)c(Br)c2)n1	799249188	QNBSXRRMTGAAPX-UHFFFAOYSA-N	443.693	1.855	50	20	IDGD	
O=C(CSc1ccccc1O)NNS(=O)(=O)c1ccc(Cl)c(-c2nn[nH]n2)c1	799795982	PJFRVHUJHKOVJW-UHFFFAOYSA-N	440.894	1.328	50	20	IDGD	
O=C(NCCS(=O)(=O)CCc1ccccc1)NNC(=O)c1cccc2ncccc12	800064142	OQJMYXCMOUBZBR-UHFFFAOYSA-N	426.498	1.836	50	20	IDGD	
O=C(COC(=O)c1nn(-c2ccccc2F)cc1O)NNC(=O)c1ccc([N+](=O)[O-])cc1	801376474	JPBDQQMLNLILMS-UHFFFAOYSA-N	443.347	1.243	50	20	IDGD	
Cc1nnnn1/C(=C/c1ccc(F)cc1)C(=O)NNC(=O)Nc1ccc2c(c1)OCO2	802095355	AFPOBTBVXLGHQR-OVCLIPMQSA-N	425.380	1.700	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)Nc1cc(Cl)cc2c1OCC(=O)N2	806755613	UAVRDEONZRFUPC-UHFFFAOYSA-N	435.780	1.811	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN1C(=O)C(F)(F)F)c1cc(F)ccc1Br	806786957	ATYPZQGFAHDVIG-SNVBAGLBSA-N	426.164	1.903	50	20	IDGD	
CCN(CC)CC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2ccccc2O)c1	806972973	URHASIIVORITPM-UHFFFAOYSA-N	427.461	1.072	50	20	IDGD	
CN(C)C(=O)COc1c(Cl)cc(S(=O)(=O)NNC(=O)c2cccn2C)cc1Cl	808070942	GMAUQHHXBJLUNJ-UHFFFAOYSA-N	449.316	1.422	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(Br)c([N+](=O)[O-])c2)c(O)c1	810386464	BANXKTMBEGYDSY-UHFFFAOYSA-N	437.206	1.771	50	20	IDGD	
N#Cc1ncn(-c2ccccc2NC(=O)C(=O)NNc2ccc(Br)nc2)n1	810396530	ADPMNYLAMOZODX-UHFFFAOYSA-N	427.222	1.378	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cnnc(-c3ccccc3)c2)cc1OC	811285920	MBZWDPMRPFHJBI-UHFFFAOYSA-N	436.424	1.779	50	20	IDGD	
COC(=O)N(C)NC(=O)[C@@H](CCSC)NS(=O)(=O)c1ccc2ccccc2c1	811521137	DLYOOEXAYVOTTM-MRXNPFEDSA-N	425.532	1.969	50	20	IDGD	
COC(=O)c1cc(Br)cc(C(=O)OCC(=O)NNC(=O)c2cccs2)c1	812700074	RYUDMUKNGIMIGP-UHFFFAOYSA-N	441.259	1.915	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)cc1)C1CC1	815564784	RYTMVZJTYLZULN-UHFFFAOYSA-N	446.467	1.992	50	20	IDGD	
CC(C)Oc1ccc(F)cc1NC(=O)C(=O)NNc1ccccc1S(=O)(=O)N(C)C	815752523	VVCVZYYEAUTUBQ-UHFFFAOYSA-N	438.481	1.945	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ncncc2F)cc1S(=O)(=O)N1CCCCC1	815764837	WXHOOSOAKMUDFA-UHFFFAOYSA-N	436.469	1.181	50	20	IDGD	
CC(C)(C)OC(=O)N1CC2(COC2)[C@](F)(C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)C1	816809148	MIDYOLIAXVAAJQ-LJQANCHMSA-N	438.412	1.331	50	20	IDGD	
Cc1c(C(=O)NNC(=O)Cc2nc3ccccc3n2C)nnn1-c1cccc([N+](=O)[O-])c1	818863153	COGMRWQQRKTTOZ-UHFFFAOYSA-N	434.416	1.374	50	20	IDGD	
Cc1ccccc1[C@@H](CC(=O)NNC(=O)[C@H]1CCCN(C(=O)OC(C)(C)C)C1)NC(N)=O	819658101	ISOWOYFGJSUZEF-DOTOQJQBSA-N	447.536	1.889	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1ccc(-n2ccnc2S)cc1	915674798	CGDFPBUXLAOAER-UHFFFAOYSA-N	444.542	1.837	50	20	IDGD	
C[C@@H](CNC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)c1ccccc1	915904212	ROPRFHBAFNIUBZ-INIZCTEOSA-N	432.550	1.448	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1CNC(=O)NNC(=O)C12CC3CC(CC(C3)C1)C2	916237634	LAHXONFZUCXOMC-UHFFFAOYSA-N	434.562	1.984	50	20	IDGD	
CC(C)CN1C(=O)/C(=C/NNC(=O)c2ccc(F)cc2Br)C(=O)NC1=S	917603750	OZCOLFQVPHTELL-IZZDOVSWSA-N	443.298	1.606	50	20	IDGD	
C[C@@H]1C[C@@H]1c1ccc(CNC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)o1	918078020	LTUADDRMDPARSL-PBHICJAKSA-N	448.549	1.560	50	20	IDGD	
Cc1ccc(C(=O)c2ccccc2C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)cc1C	919890000	YELBOFLSYGTPMO-MRXNPFEDSA-N	429.498	1.666	50	20	IDGD	
CC(=O)N(c1ccc(C)cc1)c1nc(C=NNC(=O)N[C@@H]2CCS(=O)(=O)C2)cs1	920378811	CFQAKPWJUOOSCA-CQSZACIVSA-N	435.531	1.956	50	20	IDGD	
Cc1cc2nc(C)c(CCC(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)c(C)n2n1	921235777	CGXBLTMXIYBBER-UHFFFAOYSA-N	433.472	1.295	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NCCOC)c(C(=O)NNC(=S)NC(C)C)c1	1115838022	UPRRGYZDAOESCZ-UHFFFAOYSA-N	445.611	1.293	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)NCc2c(C)nn(CC(=O)OC)c2C)c1C	1319931707	BVUUGUPMJHNXEG-GRSHGNNSSA-N	427.505	1.961	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2cccc(Br)c2)cc2c1CCC2	1323221088	GJZDMZPPVWWGCR-UHFFFAOYSA-N	438.303	1.660	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)CSc2nc3ccccc3[nH]2)c1	1335898867	YWMLHXKOJAESOJ-UHFFFAOYSA-N	433.515	1.367	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H]3ON=C(c4ccccc4)O3)C2)C1	1778870866	KDFCGZPPJMAQDX-DQLDELGASA-N	435.908	1.959	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2)c1cn2cc(F)ccc2n1	1779026413	OBRLLVXCLNNIAL-JXXFODFXSA-N	438.887	1.201	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cn4[nH]cnc(=O)c4c3C)C2)C1	1780016175	FMOCINYRNVTXEX-YWZLYKJASA-N	435.912	1.182	50	20	IDGD	
CC(C)NC(=O)OC(C)(C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2	1780583036	IINPGWMDTGEUAI-BXTJHSDWSA-N	447.960	1.013	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@]2(C)CCCN2)C1	1780668448	SJRFLGZIZNQYRB-OHDICMOHSA-N	430.387	1.673	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)nc(O)n1)C2	1780712081	VFZSVGLOLUOCNN-OCBCSQNSSA-N	447.319	1.252	50	20	IDGD	
Cc1nccnc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)Br)C1	1781997819	KTGFLACDHPRNDR-WPKBUWHJSA-N	425.327	1.696	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1sc(N)nc1C)C2	1782170245	DKNQSDDDWYHZDQ-SNUQEOBHSA-N	430.958	1.415	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@@]2(C1)CN(C(=O)c1cnc[nH]1)CCO2	1782864407	VQHFJXRAUPQZDR-JMDQKNPTSA-N	427.411	1.739	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)CCCn3ccnc3)CCO2)C1	1783351858	BYNTUVNPPGIKBV-CRAIPNDOSA-N	427.343	1.667	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2	1783857012	GVDNGVKYPBCYGN-NXEZDXNNSA-N	443.338	1.355	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3scnc3C(F)(F)F)CCO2)C1	1783875090	CSSUTZAHJIRBMV-MEBBXXQBSA-N	441.859	1.859	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)/C=C/c3cc(F)cc(OC)c3)CCO2)C1	1783879558	XDKYAHOMNZVCHA-MXHCUOCRSA-N	440.899	1.931	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@](C)(O)C(F)(F)F)[C@H]2C1	1784877514	PXBJDNQXIYRQBB-QKZHPOIUSA-N	445.276	1.453	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)CN3C(=O)CSC3=S)C2)C1	1785540532	YFJQRFVFIVADBY-PXAZEXFGSA-N	433.983	1.084	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](F)Cl)CCO3)CC1	1785716635	RWUCREPKBAVGER-QRWLVFNGSA-N	447.935	1.998	50	20	IDGD	
C[C@H](C(=O)NC1(c2ccc(NC(=O)[C@@H](O)CCl)cc2)CCC1)[C@H]1SC(=N)NC1=O	1786132371	MFYILGLSBJGANO-LEWSCRJBSA-N	438.937	1.523	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4cccnn4n3)C[C@@H]21	1786406061	GFXHQSMWGLWRMG-NOLJZWGESA-N	436.310	1.108	50	20	IDGD	
Cn1nc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]32)c2c1CCC2	1788021274	KYFNLGBFJSOBRW-DXJCSPRDSA-N	443.375	1.738	50	20	IDGD	
CC(C)NCCC(=O)Nc1ccc(C2(NC(=O)c3cnccc3C(=O)NN)CCC2)cc1	1788118687	GPSFPDDTESZZDV-UHFFFAOYSA-N	438.532	1.821	50	20	IDGD	
O=C(/C=N/N1CCCCC1)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1	1788142457	YGCKEPCLGOHWII-YZSQISJMSA-N	448.332	1.586	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C=N/O[C@H]3CCCCO3)[C@H]2C1	1788652365	CIKZGBZKHRPAFO-BRLCOEBDSA-N	429.945	1.903	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3CC[C@@H]4CCC(=O)N4C3)[C@H]2C1	1789770224	LRCZXBSRPMBFHL-PCCRXHMLSA-N	425.957	1.385	50	20	IDGD	
COCc1oncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]2C1	1789868538	XMMQIUFUDNFFRV-DGBRYZOVSA-N	434.320	1.651	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cn3ccc(C)n3)C[C@@H]21	1790961892	WDQSAUICDAYSCW-JONQDZQNSA-N	427.343	1.345	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4cnccc4nc3C)C[C@@H]21	1791253422	AAONNTPLGPPMPD-RNVRALISSA-N	446.935	1.785	50	20	IDGD	
CC[C@@H](Br)C(=O)Nc1ccc(C2(NC(=O)CC[C@H](N)C(N)=O)CCC2)cc1	1791361090	QGGOVMJUBYYUOP-CABCVRRESA-N	439.354	1.887	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1(c2ccc(NC(=O)C#CC(=O)O)cc2)CCC1	1791449103	SZBOKAWNPJXTDN-VULFUBBASA-N	435.440	1.343	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCCn3ccnc3)[C@H]2C1	1791567898	ZHODNLLIFJNVDK-IUVQAAGXSA-N	431.364	1.879	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C34CCC(CC3)CC4)[C@H]2C1	1791762171	NJAUJFNTBNQAPV-VJSAIMCRSA-N	434.581	1.310	50	20	IDGD	
COc1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)cc1F	1792750330	ALXQTHIXTVYNPB-QDMKHBRRSA-N	441.463	1.398	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cccc(Cl)n1)C2	1792870778	UJCGTORERXVWHS-JRATXPSKSA-N	444.757	1.898	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1CCN1C(=O)OC(C)(C)C	1793865617	AVSUZZHUZFEPTP-YIDVYQOGSA-N	429.945	1.888	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c(c1)CCCO3)C2	1795116855	ALFUZBXAZBYUHF-HGKCTWBKSA-N	437.334	2.000	50	20	IDGD	
COc1ccc(OC)c(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Cl)C3)c1	1795368521	JOKDAAJLNOYCCD-GTYSZEQSSA-N	428.888	1.760	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1CCC(=O)N1	1795824562	JMZFVPTUDZWZNU-UMPJEAMMSA-N	444.444	1.051	50	20	IDGD	
COc1ccc([C@@H](C)C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)cc1	1796187889	JKUCADAVWHBQRL-HUJKARHJSA-N	436.317	1.431	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)c1cc(F)ccc1Cl	1796189520	XTDFBYMDXLKADZ-BJWYYQGGSA-N	430.672	1.725	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)c1cccc2nscc12	1796193030	ISUVFGIUSFBEMA-BJWYYQGGSA-N	435.314	1.542	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](CO)NC(=O)OC(C)(C)C	1796738106	XSUDWKXSMZALKM-QRJUGERDSA-N	431.961	1.918	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccc2c(c1)CCCO2	1797242688	NINTVHQTZSDZOW-NYUBLWNDSA-N	436.936	1.398	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2cnccc2[nH]1	1798183133	FGXDBMVEUUPJJX-QDMKHBRRSA-N	433.472	1.127	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1[C@H]2Sc3ccccc3[C@H]21)c1cccc(B(O)O)c1	1798452666	JHJXVMOLFUBSJG-HFABISMESA-N	448.353	1.506	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc3ccccn13)C2)[C@H](F)Br	1799347278	KMWWCHCPPFOKAK-JLUCKKNBSA-N	425.258	1.228	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(C#N)cc1	1799665292	KARJDWNAVYSUDX-OLGCSEPZSA-N	432.484	1.944	50	20	IDGD	
CCOc1cccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)c1	1799771933	KJMLFKCJDJZZOU-BJWYYQGGSA-N	437.500	1.649	50	20	IDGD	
CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2	1799797314	MLYYPXOFTAMRFE-OJXGSEEGSA-N	428.848	1.398	50	20	IDGD	
C#CCCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](Br)Cc1ccccc1	1800437460	YZLOIVMAQGSRFV-DMUMMCEESA-N	433.346	1.996	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(OC)c(OC)c1O	1800573029	PZPITUGOQCXQCZ-QVHKTLOISA-N	426.897	1.915	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(Cl)cnc1O)C2	1800638318	YJCMHIWDNKOLAU-RDBQEKCUSA-N	446.729	1.817	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3sc(N)nc3c1)C2	1800975749	SRWCMIAEIBVNLF-ZWUHOBOKSA-N	438.937	1.336	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)Cc2cnc3ccccn23)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803137768	RNBNUKWQRXKGIP-DJPFJPOOSA-N	441.919	1.578	50	20	IDGD	
Cc1ccn(C)c1C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1807360041	GPUXMJRDURBHOR-SIKLNZKXSA-N	446.316	1.042	50	20	IDGD	
CCNC(=S)NCC(=O)N1CC[C@H](CNC(=O)[C@@H](Cl)CC)[C@@H]1c1cccnc1	1808277364	DFVBIOYGKKCJLG-VYDXJSESSA-N	425.986	1.589	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)CCC#N)[C@H]1c1cccnc1	1808414855	MWFRFUTZPYPCGN-ZXRGJLGVSA-N	435.488	1.525	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC2(CCCN(C(=O)Cc3cscn3)C2)CC1	1810068659	HYDINYKGECBVHM-UHFFFAOYSA-N	442.545	1.229	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@H]1CCN(C(=O)c2cc(O)ncn2)[C@@H]1c1cccnc1	1810540742	PWIMXPZPIKEPSJ-DNVCBOLYSA-N	429.553	1.748	50	20	IDGD	
Cc1cc(C(=O)NC[C@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)ccn1	1810789610	BFBUDXJVZTWBNY-DENIHFKCSA-N	438.532	1.478	50	20	IDGD	
COC(=O)C1(C(=O)NC[C@H]2CCN(C(=O)CO[Si](C)(C)C)[C@@H]2c2cccnc2)CC1	1812689465	FLBYRVSAPUHYGB-SJLPKXTDSA-N	433.581	1.892	50	20	IDGD	
CC(=O)Nc1ccccc1C(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1	1813884003	UFLSJUPZSHQYGC-VDGAXYAQSA-N	444.919	1.959	50	20	IDGD	
CCC[C@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](O)NC(=O)OCC)[nH]n1	1815320154	VYJFYTJVCXHDJD-DETPVDSQSA-N	429.905	1.874	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnco2)n[nH]1	1815433158	BJXUMHQCBNNQJK-ZIFAQYRBSA-N	438.448	1.838	50	20	IDGD	
CCn1nc(C)cc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1	1817841406	HRTIDCZOMFMIOR-INIZCTEOSA-N	444.540	1.613	50	20	IDGD	
CN1CCN(CC(=O)Nc2nc3c(s2)C[C@@H](NC(=O)CO[Si](C)(C)C)CC3)CC1	1818801107	ZDRBKVXMSGJQFH-AWEZNQCLSA-N	439.658	1.154	50	20	IDGD	
Cc1cccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cnccc3C(=O)NN)n[nH]2)n1	1819401878	DBULGYLFBLZYQS-SFHVURJKSA-N	448.487	1.731	50	20	IDGD	
CC(=O)N1CCCC[C@@H]1c1cc(NC(=O)CN(C)NC(=O)NCc2ccccc2)n[nH]1	1820710659	YAYCCZKLVGFBLY-GOSISDBHSA-N	427.509	1.768	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(O)nn2)[nH]n1)[C@@H](F)Br	1820930829	DKCIYDKGYCUXON-GXFFZTMASA-N	427.234	1.902	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1	1822192113	OYWAPURLHGKTQO-YPMHNXCESA-N	443.346	1.558	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(F)n2)[nH]n1	1822414868	MJAWHZDVWHKYNO-HNNXBMFYSA-N	431.472	1.623	50	20	IDGD	
CC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CNC(=O)c1cc(C)on1)CC2	1822849169	HPTDPHJABXHEPC-GHMZBOCLSA-N	439.925	1.799	50	20	IDGD	
Cc1ccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)c(O)c1	1823148264	NKHSWKNUAILHJY-IBGZPJMESA-N	448.288	1.723	50	20	IDGD	
O=C([C@@H]1ON=C(c2ccccc2)O1)N1CCC([C@H]2CCCCN2C(=O)[C@@H](O)CCl)CC1	1824185490	FFGSTLNYQLKFBZ-FGSXEWAUSA-N	449.935	1.941	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H]3C[C@]3(F)Cl)sc2C1	1826274270	QARBMPSSMUQQLW-GPHJXTMHSA-N	431.921	1.353	50	20	IDGD	
CCc1ccnc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)c1	1827054416	AKQUKZPVWQYVSJ-QHCPKHFHSA-N	449.360	1.871	50	20	IDGD	
C[C@]1(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cccc(B(O)O)c2)CC3)CC=CCC1	1827221478	OSSQJWHJFVBJTR-AOMKIAJQSA-N	439.346	1.795	50	20	IDGD	
CC(C)(O)CC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1	1828925438	LTAQHWXFOBJIFY-SFHVURJKSA-N	431.537	1.079	50	20	IDGD	
O=C(CCc1ccc(F)c(F)c1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1830271930	MENGNWAQFGWKPZ-MJGOQNOKSA-N	434.842	1.888	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)C2=NN(C)C(=O)CC2)CC1	1831828653	STIUTKAPRGUJDB-DOTOQJQBSA-N	426.945	1.468	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CCN2CCOCC2)CC1	1831830271	OGGIAWZZVCDOFU-MOPGFXCFSA-N	429.989	1.582	50	20	IDGD	
Cc1cnn(CC(=O)N2CCC([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)c1	1831870743	DLGXBPNBBAFVNN-IBGZPJMESA-N	432.569	1.184	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cccnc3C(N)=O)CC2)CC1	1833918521	WUGCURRFVSQSGW-SFHVURJKSA-N	449.983	1.773	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)c3cnc(O)[nH]3)CC2)CC1	1835961588	LDXHBSXYHBBUQV-GFCCVEGCSA-N	442.358	1.332	50	20	IDGD	
CCOc1ccc(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](F)Cl)CC3)CC2)nn1	1836198752	LHEDJQYHTZSWIM-QGZVFWFLSA-N	427.908	1.595	50	20	IDGD	
C[C@H](CS(C)(=O)=O)C(=O)N1CCC(OC2CCN(C(=O)[C@H](F)Cl)CC2)CC1	1836873885	JOBNMKBLYGEHGH-DOMZBBRYSA-N	426.938	1.200	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)Cn3cccn3)CC2)CC1	1837973180	FYOWHQKJMOXVAQ-CQSZACIVSA-N	427.343	1.665	50	20	IDGD	
CC(=O)N(C)[C@@H](C)C(=O)N1CCC(OC2CCN(C(=O)CO[Si](C)(C)C)CC2)CC1	1838106827	NLNHBKTXZQYCMV-INIZCTEOSA-N	441.645	1.703	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(C)nc3OC)CCO2)C1	1838172302	NVQJFHUSKAMPKM-UTKZUKDTSA-N	439.940	1.876	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc([N+](=O)[O-])[nH]3)CCO2)C1	1838824888	YHTFMEJIDIMLBT-GOSISDBHSA-N	428.873	1.258	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)OC(=O)NC(C)C)CCO2	1839073720	CXJHMJSHLIUPKG-FOIQADDNSA-N	447.960	1.373	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4nn(C)cc4c3)C2)C1	1839148236	RYNZLEVYVWLTKD-DYESRHJHSA-N	434.924	1.661	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3F)C2)C1	1839152151	PEHJQOZNSVHTSQ-ZWKOTPCHSA-N	434.295	1.527	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839199422	WHKYSXRGGSRCNG-SLEUVZQESA-N	429.714	1.541	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc(C)s3)C2)C1	1839964531	URVLXTQQRYZWNQ-GUYCJALGSA-N	446.367	1.695	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc([C@@H](C)C#N)c3)C2)C1	1840156961	YWKHGLDKRORKJR-XWFZLUIHSA-N	449.935	1.637	50	20	IDGD	
CCCCC[C@H](C)C(=O)N1CCOC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1	1840185439	QEVADOUYIHVDGS-PGRDOPGGSA-N	440.585	1.032	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)C(=O)OCC)CCO2	1840882486	ONWKGRNURZGHPV-QRWLVFNGSA-N	432.945	1.440	50	20	IDGD	
C=C1C[C@@H](C(=O)N2CC3(CCCN3C(=O)[C@@H](O)CCl)C2)N(C(=O)OC(C)(C)C)C1	1841353976	AWFLDXUZESTJPY-GJZGRUSLSA-N	427.929	1.355	50	20	IDGD	
C[C@H](Br)C(=O)N1CC2(CCCN2C(=O)[C@H](CCO)NC(=O)OC(C)(C)C)C1	1841431953	UNZBBKKHXYKIGB-STQMWFEESA-N	448.358	1.249	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1cc3c(s1)CCC3)C2	1844263836	ZTLJQFWBDFBICF-UHFFFAOYSA-N	425.514	1.366	50	20	IDGD	
CNC(=S)NCCC(=O)N1CCCC12CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)C2	1844267848	VDUNDNNTIUFZPK-OQLLNIDSSA-N	447.511	1.559	50	20	IDGD	
CN(CC(=O)N1CCCC12CN(C(=O)[C@@H]1C[C@@H]1C1CC1)C2)NC(=O)NCc1ccccc1	1845038213	FFWYCIROJRBULO-WOJBJXKFSA-N	439.560	1.582	50	20	IDGD	
Cn1nc(C(F)(F)F)cc1C(=O)N1CC2(CCCN2C(=O)[C@@H](F)Br)C1	1845218748	ZOUUDFMEQJOSRA-SNVBAGLBSA-N	427.196	1.946	50	20	IDGD	
COC(=O)NCC(=O)N1CCCC12CN(C(=O)[C@H](Br)Cc1ccccc1)C2	1846512634	GEKMWTIAMPUCTN-OAHLLOKOSA-N	438.322	1.552	50	20	IDGD	
CSC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)[C@@H](O)CCl)C2	1846951143	ZXTMYAJBHKUBHB-STQMWFEESA-N	435.974	1.046	50	20	IDGD	
CCOC(=O)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)[C@H](Cl)CC)C2	1847044953	YYFXLSSAUXGALW-ZIAGYGMSSA-N	445.944	1.664	50	20	IDGD	
C=C1c2ccccc2C(=O)N1[C@@H](C)C(=O)NNC(=O)c1csc(N2CCOCC2)n1	10292230	IJFNGZALJYKKTC-ZDUSSCGKSA-N	427.486	1.256	50	20	IDGD	
O=C(COC(=O)Cc1ccc(Br)cc1)NNC(=O)c1ccc([N+](=O)[O-])cc1	11445218	SKGCNMXXEJAQJB-UHFFFAOYSA-N	436.218	1.904	50	20	IDGD	
Cc1cc(C(=O)NNC(=S)NCCc2cccs2)cc(S(=O)(=O)N(C)C)c1C	11518329	GJTVLDJFSFTSSG-UHFFFAOYSA-N	440.616	1.967	50	20	IDGD	
O=C(CN1CCN(S(=O)(=O)c2ccc3c(c2)CCC3)CC1)NNC(=O)c1cccs1	15482120	KSQRNZRTWYPTGD-UHFFFAOYSA-N	448.570	1.004	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=S)Nc2ccc3c(c2)OCCO3)ccc1Cl	17451112	HACMFQYKRAGARV-UHFFFAOYSA-N	442.906	1.390	50	20	IDGD	
O=C1NC(=O)c2ccccc2/C1=C/NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	104934151	ALZRCHUXNBNEGD-AQTBWJFISA-N	440.481	1.017	50	20	IDGD	
COc1ccccc1OCCNC(=O)NNC(=O)c1sc(N2CCOCC2)nc1C	115385371	MAABRQUNRYEWSQ-UHFFFAOYSA-N	435.506	1.320	50	20	IDGD	
COc1ccc(C=NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)cc1O	254734639	KBANJMGWVNIJIN-UHFFFAOYSA-N	447.513	1.505	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)c2nccnc2C(=O)NCc2ccc(F)cc2)c1	726522989	FNJUSLIXYCOTHP-UHFFFAOYSA-N	436.447	1.687	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)c2nccnc2C(=O)NCc2ccc(F)cc2)cc1	726523788	YFVYLUYVLRMUJQ-UHFFFAOYSA-N	448.414	1.257	50	20	IDGD	
Cc1ccc([C@]2(C)NC(=O)N(CC(=O)NNC(=O)c3ccc4ccccc4n3)C2=O)cc1	726712624	MRZLIAOMDOEIKK-QHCPKHFHSA-N	431.452	1.771	50	20	IDGD	
O=C(CCc1nc(-c2ccccn2)no1)NNc1ccc(S(=O)(=O)NC2CC2)cc1	728210062	PWVZAFCTSCDPCN-UHFFFAOYSA-N	428.474	1.648	50	20	IDGD	
CN(C)C(=O)c1cccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1	728456047	XURIVDSHUVECDV-UHFFFAOYSA-N	444.513	1.248	50	20	IDGD	
O=C(NC[C@H]1CCN(CCc2ccccc2)C1)NNC(=O)c1ccc(-n2cnnn2)cc1	728715362	YNMAECFRSFLVFP-GOSISDBHSA-N	434.504	1.171	50	20	IDGD	
CC(=O)CCc1ccc(OCCC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1	728845460	ICGVUHOHLPLMSF-UHFFFAOYSA-N	439.516	1.831	50	20	IDGD	
Cc1nc(COc2ccc(C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)cc2)no1	728847826	QXPXUSBBQCMQGG-UHFFFAOYSA-N	437.460	1.425	50	20	IDGD	
COc1cc(CNC(=O)NNC(=O)Cn2ccc3ccccc32)ccc1OCC(N)=O	729596314	PLRVCIQXVUXDSH-UHFFFAOYSA-N	425.445	1.045	50	20	IDGD	
O=C(NNC(=O)c1cccc2ncccc12)c1sccc1S(=O)(=O)N1CCOCC1	730228438	MHNWCNWJHJHXSM-UHFFFAOYSA-N	446.510	1.392	50	20	IDGD	
CC(C)COc1cn(-c2ccccc2)nc1C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	730768250	AWYKRGHZGOIPGS-UHFFFAOYSA-N	446.471	1.958	50	20	IDGD	
C[C@H]1CCCCN1CCOc1ccccc1C(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1	731186532	OTZCBQHHXVYYCE-HOTGVXAUSA-N	438.550	1.071	50	20	IDGD	
CCc1ccccc1OCC(=O)NNS(=O)(=O)c1cc(C(=O)OC)c(F)cc1F	732045341	IAVOHOOFINZJSN-UHFFFAOYSA-N	428.413	1.702	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)CCCN1CCN(c2ccccc2)CC1	732257244	HOQGEHLPBWPOLZ-UHFFFAOYSA-N	426.517	1.824	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)[C@H](C)NC(=O)c2cccc(Cl)c2Cl)C[C@@H](C)O1	732265079	YTLPTEYJEWDFLH-XQQFMLRXSA-N	445.347	1.758	50	20	IDGD	
CCN1CCCC[C@@H]1CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(CC)CC)c1	732470672	FAMTUXFYOLNVLN-QGZVFWFLSA-N	439.582	1.536	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCCn1cnc2ccccc21	732594632	FGNKNLUFSGIDSY-UHFFFAOYSA-N	429.506	1.282	50	20	IDGD	
CN(CCO)S(=O)(=O)c1ccccc1CNC(=O)NNC(=O)c1cccc(Cl)c1	733040819	LZKVEOSHKBKGHF-UHFFFAOYSA-N	440.909	1.097	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccc(OCc3ccccc3)cc2)CC1)NNC(=O)C1CC1	733194372	NAJTVHWFCLAPDS-UHFFFAOYSA-N	436.512	1.581	50	20	IDGD	
CCOC(=O)c1cc(S(=O)(=O)NNC(=O)c2scnc2C)cc([N+](=O)[O-])c1C	734807432	PLXPBDHMXQIVFH-UHFFFAOYSA-N	428.448	1.468	50	20	IDGD	
C[C@@H](Cc1ccccc1F)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	737466581	RUPSPEYYQCSTOZ-HNNXBMFYSA-N	449.504	1.486	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)/C(=C/c1ccco1)n1nnnc1-c1ccccc1	740852381	YARIBHCKOPSKRS-LGMDPLHJSA-N	437.460	1.383	50	20	IDGD	
O=C(Cc1csc(N2CCOCC2)n1)NNC(=S)N[C@H]1CCOc2ccccc21	741475886	ILZLODOFPYIQDO-HNNXBMFYSA-N	433.559	1.541	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)CNC(=O)c2cccs2)c(Cl)c1Cl	742030328	WAVGJPKYIKPDFV-UHFFFAOYSA-N	438.314	1.803	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)[C@@H](C(CC)CC)N2CCOCC2)c2ccccc2c1=O	742034234	GKRKYWWRCVSESH-HXUWFJFHSA-N	443.548	1.705	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(CC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)CC1	742300826	RJBHTAFWBMKYKM-UHFFFAOYSA-N	439.534	1.888	50	20	IDGD	
COc1cc(C(=O)NNC(=O)COc2ccccc2F)cc(NS(C)(=O)=O)c1OC	742471052	MIXNNKZCFCRYNL-UHFFFAOYSA-N	441.437	1.054	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)CCN3C(=O)[C@@H]4[C@H]5CC[C@@H](O5)[C@@H]4C3=O)cc2C1	742480452	PLQHYAMOCCEVRY-IAAQCEKXSA-N	431.514	1.186	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@@H](C(=O)NNC(=O)CNC(=O)c1cccs1)c1ccccc1	742613200	PPCYPGDDEMPFCN-OAHLLOKOSA-N	446.529	1.934	50	20	IDGD	
COc1ccc(O[C@@H](C)CNC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)cc1	743685923	FPJYQBLQVPXXCI-ZDUSSCGKSA-N	436.490	1.902	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)CN1C(=O)Cn2c(cc3ccccc32)C1=O	743845015	ILAHEXKBBCPYSM-UHFFFAOYSA-N	430.424	1.041	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)Cc2cc3c(cc2Br)OCCO3)cc1	743854114	ZLPPGUNYANCZOD-UHFFFAOYSA-N	446.257	1.861	50	20	IDGD	
COc1ccc(C(=O)CCC(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)cc1	744619447	OXMNRPKXYSGKPC-UHFFFAOYSA-N	447.513	1.822	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1ccc(Cn2cncn2)cc1	744621773	PVSJGTBRDHNZGD-UHFFFAOYSA-N	442.501	1.104	50	20	IDGD	
CC(C)(C)CNC(=O)c1ccc(C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)cc1	745182677	KHIAMJSXGJXEMY-UHFFFAOYSA-N	436.468	1.952	50	20	IDGD	
CN(CC(=O)NNC(=O)CNC(=O)c1ccco1)c1ccc(C(F)(F)F)cc1C=O	746594077	XSQOTSABEQIBDJ-UHFFFAOYSA-N	426.351	1.125	50	20	IDGD	
O=C(CNC(=O)c1ccncc1)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1	747900681	YLHISSMSBMXRLG-JOCHJYFZSA-N	443.507	1.586	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)NCc1ccc(N2CCc3ccccc3C2)nc1	748622929	XPAWTPMGCZIQEI-INIZCTEOSA-N	427.505	1.526	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)NCc1ccc(NC(=O)c2ccc(F)cc2)cc1	748626964	ZOJGRYCYZBUTHW-CQSZACIVSA-N	432.452	1.960	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NN=Cc1ccn(C)c1)N(S(C)(=O)=O)CC2	749854256	JTWFCIXAIRVVLX-QGZVFWFLSA-N	434.518	1.442	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)N[C@@H]2CC(=O)N(C3CC3)C2)cc(OCC)c1OCC	750654484	AWDGDXSWRWSLJO-CQSZACIVSA-N	434.493	1.590	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CCNS(=O)(=O)c2cccc(Br)c2)o1	752522738	CGGLVDINQNAVFV-UHFFFAOYSA-N	430.280	1.480	50	20	IDGD	
O=C(NC[C@@H]1CCCCS1(=O)=O)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1	753259847	DYDMLECZQXUPMT-LBPRGKRZSA-N	429.442	1.574	50	20	IDGD	
C[C@H]1C[C@H](NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)CN1C1CC1	753942640	ATALFGZLIPCSGG-HOCLYGCPSA-N	435.550	1.040	50	20	IDGD	
C[C@@H]1C[C@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)CN1C1CC1	753942870	IDFNUQCJHGMNNF-WBVHZDCISA-N	449.577	1.430	50	20	IDGD	
N#Cc1cc(Br)cc(S(=O)(=O)NNC(=O)CNC(=O)c2cccs2)c1	754257939	MKANYXMHURKTEI-UHFFFAOYSA-N	443.304	1.122	50	20	IDGD	
COCCOc1cc(NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)ccc1OC	755702254	YZYURZQVEDWSJZ-UHFFFAOYSA-N	427.421	1.163	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)NC2CCN(S(=O)(=O)C(C)(C)C)CC2)cc1	755900637	OKAIDEQKRCVFNZ-UHFFFAOYSA-N	440.570	1.681	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Nc2cccc(OCC(=O)N(C)C)c2)cc(OC)c1OC	755960331	LEQDEDZPOHXICB-UHFFFAOYSA-N	446.460	1.646	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1ccc(OCc2ccccn2)c(Cl)c1	756252967	LMHJJJSPEQGWDF-LLVKDONJSA-N	441.897	1.404	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)Nc1cccc(C(=O)NCCC(N)=O)c1	756391166	KRNDNGVGLWDODJ-UHFFFAOYSA-N	427.461	1.086	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2cnn(C[C@@H]3CCCO3)c2)c2ccccc2c1=O	756739067	LJQHDUSACGWGNE-AWEZNQCLSA-N	425.449	1.258	50	20	IDGD	
CCS(=O)(=O)NCC(=O)NNc1nc2ccccc2c(=O)n1-c1cccc(C)c1C	759104421	XCVYCBWYZFHPSE-UHFFFAOYSA-N	429.502	1.385	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)N=c1cc[nH]cc1I	760024844	PKOFHOHRMAFTFP-UHFFFAOYSA-N	442.213	1.348	50	20	IDGD	
Cn1c(=NNC(=O)[C@H](CCC(N)=O)NC(=O)OCc2ccccc2)sc2ccccc21	760098080	WHAIHKSTQWOINE-HNNXBMFYSA-N	441.513	1.732	50	20	IDGD	
O=C(NNC(=O)c1ccc(COc2ccccc2)o1)C1=CC=CN2CCS(=O)(=O)N=C12	761510552	JKLBXWSENNTIKW-UHFFFAOYSA-N	442.453	1.117	50	20	IDGD	
O=C(NNC(=O)c1ccc2ccccc2n1)C(=O)Nc1cc(N2CCCC2=O)ccc1F	763449472	CHFICYBMULHQNT-UHFFFAOYSA-N	435.415	1.900	50	20	IDGD	
O=C(NNC(=O)c1ccncc1)C(=O)Nc1cc(C(F)(F)F)ccc1N1CCOCC1	763462054	IQLAEPSLQRQNNE-UHFFFAOYSA-N	437.378	1.337	50	20	IDGD	
CNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2cccc(C(F)(F)F)c2)cc1	763641374	VEZBEUCIOQTZKN-UHFFFAOYSA-N	438.362	1.230	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)COc2cc(C)ccc2C)c(OC)c1OC	763665836	PEDVUJSABKXHGC-UHFFFAOYSA-N	431.445	1.494	50	20	IDGD	
CO[C@@H](C)C(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)COc2cc(C)ccc2C)c1	763667490	ALBUARZSZJWIBB-HNNXBMFYSA-N	442.472	1.442	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2ccccc2C(=O)NC(C)(C)C)c1	763668921	STLFBDHASIBFKW-UHFFFAOYSA-N	440.500	1.997	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)n(C2CCOCC2)n1	763728414	PKIIGEHILFZWGP-UHFFFAOYSA-N	429.521	1.845	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)C(=O)Nc2ccc(N(C)C)cc2)c2ccccc2c1=O	763790796	OLLNZHQPXXYRNA-UHFFFAOYSA-N	436.472	1.443	50	20	IDGD	
COCCOc1c(Cl)cccc1NC(=O)C(=O)NNC(=O)COc1ccc(C)cc1	763819979	CHGKTIYHHUJCFH-UHFFFAOYSA-N	435.864	1.839	50	20	IDGD	
CNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)Cc2c[nH]c3ccccc23)cc1Cl	763864511	CDWPZBIZOOOGQK-UHFFFAOYSA-N	427.848	1.510	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(F)c(C(=O)OC)c2)cc1	763867603	XOYSHNJMXQRVEE-LBPRGKRZSA-N	447.419	1.564	50	20	IDGD	
CCc1noc(-c2ccc(C)c(NC(=O)C(=O)NNC(=O)Cn3nc(C)cc3C)c2)n1	763891179	KSPPNPJUKRCCLB-UHFFFAOYSA-N	425.449	1.207	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(C(=O)NCC)c2)cc1OC	763912807	VCUABTYBWNWVQF-UHFFFAOYSA-N	442.472	1.633	50	20	IDGD	
CC(C)n1ncc2cc(NC(=O)C(=O)NNC(=O)c3cc(Br)c[nH]3)cnc21	763995220	OQVRQVFXYJWHRM-UHFFFAOYSA-N	434.254	1.503	50	20	IDGD	
Cc1c(C(=O)NNC(=O)CSc2ccccc2O)cnn1CCO[C@H]1CCCCO1	764045258	HIZQZKTYEFZMBV-IBGZPJMESA-N	434.518	1.994	50	20	IDGD	
CNS(=O)(=O)c1ccc(C)c(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3c2)c1	764061218	ADWMYBGJOIKEFI-UHFFFAOYSA-N	440.481	1.456	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(NC(=O)c3ccncc3)c2)c(O)c1	764104938	JONLOZLLUGJWPV-UHFFFAOYSA-N	433.424	1.748	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc4c(c3)NC(=O)[C@H](C)O4)n[nH]2)cc1	764112206	XZRVLELWHSWSIY-LBPRGKRZSA-N	448.439	1.504	50	20	IDGD	
CCNC(=O)c1ccc(C)c(NC(=O)C(=O)NNC(=O)CCc2ccc(OC)cc2)c1	764125116	RSWNWPRMVYGQMD-UHFFFAOYSA-N	426.473	1.472	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(-c3nnc(C)o3)cc2)o1	764138931	MFMIGGDMBYSPCZ-UHFFFAOYSA-N	440.460	1.880	50	20	IDGD	
CCOc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NNC(=O)CCc1ccccc1	764184652	BGNZPQXQWHEESV-UHFFFAOYSA-N	426.473	1.506	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)C(=O)Nc1cccnc1Br	764203968	QLOMTFWYEDZQJB-UHFFFAOYSA-N	444.286	1.235	50	20	IDGD	
CCOC(=O)COc1cccc(NC(=O)C(=O)NNC(=O)c2cccc3ncccc23)c1	764252604	JASRLLJBINHIIH-UHFFFAOYSA-N	436.424	1.576	50	20	IDGD	
COC(=O)NCc1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)cc1	764382917	SGXWEUILQKQNIE-UHFFFAOYSA-N	442.457	1.394	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)C(=O)Nc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1	764385546	AWKNZTXDNHLPLW-KBPBESRZSA-N	429.452	1.542	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1)C(=O)Nc1ccn(Cc2ccncc2)n1	764387939	OKBBFGVPSRFCFV-UHFFFAOYSA-N	448.418	1.255	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)c(C)c1	764404575	LQJZPINVKIYFBE-UHFFFAOYSA-N	433.486	1.604	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)C(=O)Nc2ccc(Oc3cccnc3)c(C)c2)c1	764430726	MOVYZGFBCOUBBQ-UHFFFAOYSA-N	448.439	1.935	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNS(=O)(=O)c3ccc4c(c3)CCC4)CC2)cc1	765127990	SPSIXLHSCYSHKO-UHFFFAOYSA-N	442.585	1.611	50	20	IDGD	
O=C(COc1ccccc1Cl)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765738775	ODUIXBPNLCDVKL-UHFFFAOYSA-N	430.892	1.324	50	20	IDGD	
C[C@H](NC(=O)OC(C)(C)C)[C@H]1COCCC1=NNC(=O)Cn1nnc(-c2ccccc2)n1	766009152	LMIGEYTZJOMHMC-GOEBONIOSA-N	443.508	1.762	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)c1ccc(N2C[C@H](C)O[C@@H](C)C2)nc1	767281745	FNIOJUZTSBWUTC-IRXDYDNUSA-N	440.500	1.551	50	20	IDGD	
O=S(=O)(CBr)N1CCN(S(=O)(=O)c2cnc3ccsc3c2)CC1	767849585	HCJWQDAWCQAIPE-UHFFFAOYSA-N	440.366	1.285	50	20	IDGD	
CCOC1CC(CNC(=O)NNC(=O)c2ccc3ccccc3n2)(N2CCOCC2)C1	767888237	QCGZGSQWNNVMFF-UHFFFAOYSA-N	427.505	1.449	50	20	IDGD	
CN(C)c1ccc(NC(=S)NNC(=O)CN2C(=O)N[C@]3(CCCC(C)(C)C3)C2=O)cc1	768570828	NBIFQQBTKBZGOH-NRFANRHFSA-N	446.577	1.961	50	20	IDGD	
CSCCNC(=S)NNC(=O)CCc1ccc(S(=O)(=O)N2CCCCC2)cc1	769766213	RWSDSMUFRCQNHJ-UHFFFAOYSA-N	444.648	1.652	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)[C@@H](NS(=O)(=O)c1ccc2ccccc2c1)C(C)C	771881680	BRKBNCOCFMPUPJ-LIRRHRJNSA-N	449.529	1.632	50	20	IDGD	
CCN1C(=O)c2ccccc2N2C(=O)CC[C@@]12C(=O)O[C@@H](C)C(=O)NNC(=O)CC(C)C	771965007	BQTQJHVTVDWOJT-RCDICMHDSA-N	444.488	1.111	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)c2ccccc2SCC(N)=O)C1	773413136	GOCDWQACEWEDAV-ZDUSSCGKSA-N	436.534	1.672	50	20	IDGD	
C#CCOc1ccccc1NC(=O)C(=O)NNc1ccccc1S(=O)(=O)NC(C)(C)C	773479477	XDMGLPRAFNGYNY-UHFFFAOYSA-N	444.513	1.857	50	20	IDGD	
CCNS(=O)(=O)c1ccc2c(c1)N(C(=O)C(=O)NNc1cccc(Cl)c1C)CC2	773766912	YQEWSFQFCMAALQ-UHFFFAOYSA-N	436.921	1.979	50	20	IDGD	
COc1cccc(Cn2nccc2NC(=O)C(=O)NNc2nccnc2C(C)C)c1OC	773993407	UNPWVFMVBWFZHF-UHFFFAOYSA-N	439.476	1.944	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)N[C@@H]1CCN(c2ccc(Cl)cc2)C1	776320486	PLUNJPHZSJCGBI-QGZVFWFLSA-N	443.939	1.956	50	20	IDGD	
C[C@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)NNc2cccc(S(C)(=O)=O)c2)C1=O	776528493	OTLZNXHDYIQTFU-LJQANCHMSA-N	434.449	1.140	50	20	IDGD	
O=C(NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12)N[C@@H]1CCCOCC1	776636059	RGBFCJPVRWOVKF-QGZVFWFLSA-N	435.484	1.958	50	20	IDGD	
CC(=O)N(CCC(=O)N1CCN(S(=O)(=O)CBr)CC1)Cc1ccccc1	777777895	RQTRXDURGVYOJB-UHFFFAOYSA-N	446.367	1.252	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNS(=O)(=O)c2ccc(OCC(F)(F)F)nc2)cc1C	777913695	YORFSLSUZFRDAC-UHFFFAOYSA-N	446.407	1.588	50	20	IDGD	
C[C@H]1CN(Cc2cccc(CNC(=O)NNC(=O)CNC(=O)OC(C)(C)C)c2)CCO1	778627931	QEONLJJETVOOLK-HNNXBMFYSA-N	435.525	1.262	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(C(=O)NNC(=O)Nc2ccc(OC(F)F)cc2)n(C)c1	778683818	SMAKDHNNLKCZKV-UHFFFAOYSA-N	431.421	1.343	50	20	IDGD	
COc1cc(OC)c(NC(=O)C(=O)NNc2nccnc2OC)cc1Br	778724051	ISSNXWPHGLUWJT-UHFFFAOYSA-N	426.227	1.347	50	20	IDGD	
COc1ccc(Cc2nnc(SCC(=O)NNC(=O)c3ccccc3Cl)n2N)cc1	779378548	OKGSCAXKVSCQHS-UHFFFAOYSA-N	446.920	1.798	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)N[C@H]1CCCN(c2ccc(C#N)cc2)C1=O	780901863	JOPMGFSSCDWEEL-KUHUBIRLSA-N	439.447	1.991	50	20	IDGD	
Cc1ccc(NNC(=O)C(=O)Nc2ccc(N3CCOCC3)cc2N2CCOCC2)cc1	783346586	SKHNXRNYWAUXRF-UHFFFAOYSA-N	439.516	1.750	50	20	IDGD	
CSc1nnnn1-c1cccc(NC(=O)C(=O)NN=c2sc3ccccc3n2C)c1	783349410	IQDNVZGBVNNIEJ-UHFFFAOYSA-N	440.514	1.508	50	20	IDGD	
C[C@H]1CCCCN1CC(=O)Nc1ccc(F)c(NC(=O)C(=O)NN=c2cc[nH]cc2)c1	783376201	JELNMDDTNVJLQZ-AWEZNQCLSA-N	428.468	1.537	50	20	IDGD	
CCCc1c(NC(=O)C(=O)NN[C@]2(C)CCS(=O)(=O)C2)cnn1-c1cccc(F)c1	783427281	QZSMAGFBPWJWLV-LJQANCHMSA-N	437.497	1.100	50	20	IDGD	
COCCOc1ccc(C#N)cc1NC(=O)C(=O)NNc1ccnc(Br)c1	784837489	UZJKZWDKAKQXQI-UHFFFAOYSA-N	434.250	1.823	50	20	IDGD	
COc1cc(F)cc(NNC(=O)C(=O)Nc2ccc(NC(=O)[C@H](C)n3cncn3)cc2)c1	785237602	UZTQKRHWESTUNR-LBPRGKRZSA-N	441.423	1.707	50	20	IDGD	
Cc1nn(C)c2ncc(NC(=O)NN(C)C(=O)N3CCN(C(=O)OC(C)(C)C)CC3)cc12	785836717	CPBHGHNUSZHLJC-UHFFFAOYSA-N	446.512	1.918	50	20	IDGD	
COC(=O)CCc1cccc(NC(=O)C(=O)NNc2c(OC)cccc2S(C)(=O)=O)c1	786430800	LVJBKPRASFBGAY-UHFFFAOYSA-N	449.485	1.286	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)Cc2ccc(C(=O)NNC(=O)CCCC(N)=O)cc2)cc1	786627081	IXVWXAPSVDJVGB-UHFFFAOYSA-N	446.529	1.232	50	20	IDGD	
O=C(NNc1ccc(-n2cccn2)nn1)C(=O)Nc1cc(F)cc(Br)c1F	787560624	PJLXXWGYMJGWJW-UHFFFAOYSA-N	438.192	1.785	50	20	IDGD	
CN(C)NC(=O)Nc1cccc(NS(=O)(=O)c2cc3c4c(c2)CC(=O)N4CCC3)c1	788093228	NYLOFLQBOMLTAB-UHFFFAOYSA-N	429.502	1.921	50	20	IDGD	
NS(=O)(=O)c1ccccc1NNC(=O)CNC(=O)c1ccc(Br)s1	788223222	HARKBBGYNQKLET-UHFFFAOYSA-N	433.309	1.031	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)c1cccc(NN2C(=O)[C@H]3CC=CC[C@H]3C2=O)c1	788619492	RFLGMGINOYKUSV-HDICACEKSA-N	449.423	1.948	50	20	IDGD	
Cn1nc(-c2ccc(F)cc2F)cc1NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	788717950	LMQMYIZHDNYRNF-UHFFFAOYSA-N	439.386	1.808	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2nc3c(s2)CCCCCC3)cc1	789732640	RJVIHCCTYRZDHA-UHFFFAOYSA-N	427.486	1.839	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)CN(C)C(=O)c1ccc(Br)s1	790063454	KAQOBLLSLWIMFK-UHFFFAOYSA-N	436.328	1.519	50	20	IDGD	
O=C(NNC(=O)C1(S(=O)(=O)c2ccc(Cl)cc2)CCCC1)[C@H]1CCS(=O)(=O)C1	790390760	MGSGJNCMFPGSAL-LBPRGKRZSA-N	448.950	1.009	50	20	IDGD	
CO[C@@H]1CCOc2c(NC(=O)C(=O)NNC(=O)COc3ccccc3[N+](=O)[O-])cccc21	790953093	ZKQXSMIEABWXCR-OAHLLOKOSA-N	444.400	1.230	50	20	IDGD	
CN(CCC(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1)C(=O)OCc1ccccc1	793773511	PNRLMWDHOAXMDR-UHFFFAOYSA-N	446.891	1.762	50	20	IDGD	
CCC(=NNC(=O)NCCNC(=O)OC(C)(C)C)c1ccc(Cl)c(S(N)(=O)=O)c1	794512119	NRZNXKSTWVFKJM-UHFFFAOYSA-N	447.945	1.925	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNS(=O)(=O)c2ccccc2CC#N)cc1	794579613	ZUAKWUGUNFETDI-UHFFFAOYSA-N	442.526	1.797	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN(Cc2ccc(C(N)=O)cc2F)C2CC2)cc1OC	794765707	DEBFNIHRTLKDFJ-UHFFFAOYSA-N	444.463	1.367	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(F)cc2-c2cnn(C)c2)c1O	797001191	GNSLOICDAHQVKO-UHFFFAOYSA-N	427.392	1.340	50	20	IDGD	
Cc1ccc(N2CCOCC2)cc1NC(=O)C(=O)NNC(=O)Cc1c[nH]c2ccccc12	797535553	NVBBUGYVWNNBRB-UHFFFAOYSA-N	435.484	1.642	50	20	IDGD	
C[S@](=O)c1ccc(CC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1	797788624	QDSUUOQSXAUYNN-PMERELPUSA-N	428.558	1.326	50	20	IDGD	
CN(C)Cc1cc(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)ccc1Cl	799257887	UUVHVLGYWGDASW-UHFFFAOYSA-N	443.935	1.940	50	20	IDGD	
Cc1nc(C(=O)NNC(=O)Nc2cc(F)cc(F)c2)nn1-c1n[nH]c(C(F)(F)F)n1	802002977	HMWFLDOXLQTGFZ-UHFFFAOYSA-N	431.285	1.457	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)CCCc2ccc3c(c2)CC(=O)N3)cc1	802068106	ZXTBUNMEUSOJRI-UHFFFAOYSA-N	430.486	1.760	50	20	IDGD	
C[C@@H](CCNS(=O)(=O)c1ccccc1)NC(=O)NNC(=O)Cc1c[nH]c2ccccc12	802527139	VMNGCSVXDCUKPO-HNNXBMFYSA-N	443.529	1.798	50	20	IDGD	
COc1ccc(S(C)(=O)=O)cc1S(=O)(=O)NNC(=O)c1ccc(Cl)cc1O	802721765	FAOLKWODVGHSDA-UHFFFAOYSA-N	434.879	1.081	50	20	IDGD	
COc1ccc(CS(C)(=O)=O)cc1NC(=O)NNc1cccc(S(C)(=O)=O)c1	806634554	JZIXNDXLWXUCMK-UHFFFAOYSA-N	427.504	1.792	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NC[C@H](c1ccco1)N1CCCC1	807003677	XLUVTVMBTPWVRI-OAHLLOKOSA-N	448.549	1.662	50	20	IDGD	
CCOC(=O)[C@@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNc2cccc(F)n2)cc1F	807391205	JZUXSAQUWHQMCQ-SNVBAGLBSA-N	435.387	1.123	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NCCCN2C(=O)c3ccccc3C2=O)cc1	807494161	VLVFCOXATVEFAM-UHFFFAOYSA-N	426.429	1.091	50	20	IDGD	
Cc1ccc(Br)c(S(=O)(=O)NCCNC(=O)NNC(=O)C2CCC2)c1	807563749	LDWKPKXAPIWVQL-UHFFFAOYSA-N	433.328	1.166	50	20	IDGD	
CC[C@@H](C)C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)CN(C(=O)OC(C)(C)C)CCO2	812979237	LOCOQQYSKQZNOO-CYBMUJFWSA-N	434.493	1.948	50	20	IDGD	
Cc1cnc(Br)c(NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c1	812999022	YKDFEHKOXVVCCG-UHFFFAOYSA-N	431.250	1.866	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)N2C[C@H]3CCCN3c3ccccc32)cc1	813033454	TZGPCEHQWDVGPM-MRXNPFEDSA-N	443.529	1.396	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NN=Cc2ccc(Cl)cc2-n2cncn2)c1	814725899	RDRAQMSUUWUSJV-UHFFFAOYSA-N	432.893	1.935	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)C(=O)Nc2cnc(N(C)C)nc2)c1	815866819	PZRVOWIKXUGXMF-UHFFFAOYSA-N	437.254	1.174	50	20	IDGD	
O=C(CNC(=O)[C@@H]1c2ccccc2C(=O)N1Cc1ccccc1)NNc1ncncc1F	817077972	VBGRUUTWSRUVIB-IBGZPJMESA-N	434.431	1.572	50	20	IDGD	
O=C(CCC/N=C1/NS(=O)(=O)c2ccccc21)NNC(=O)c1ccc2ccccc2n1	912766659	HBBQBPLEBXBQFZ-UHFFFAOYSA-N	437.481	1.515	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)CNS(=O)(=O)c2ccc3ccccc3c2)c1	913445758	XQGPPGWSVCOVLQ-UHFFFAOYSA-N	427.482	1.653	50	20	IDGD	
O=C(CNS(=O)(=O)c1c(F)cccc1F)NNC(=O)CSc1ccc(Cl)cc1	913496472	GOXUYXUWKAWYOI-UHFFFAOYSA-N	449.888	1.836	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N(C)C)o2)cc1OC	914846191	BKBPMNPERQITGY-UHFFFAOYSA-N	425.463	1.402	50	20	IDGD	
COc1ccnc(NNC(=O)[C@@H](CCSC)NS(=O)(=O)c2ccccc2F)n1	914861594	ZQKSJZBJSVVETF-GFCCVEGCSA-N	429.499	1.168	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)NCc2ccc(S(=O)(=O)N3CCOCC3)cc2)cc1	915921720	HLSWWTSEALKYHT-UHFFFAOYSA-N	446.529	1.414	50	20	IDGD	
O=C(NNC(=O)c1n[nH]c2c1CCC2)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	916147706	ACGBRWKABBRIFC-UHFFFAOYSA-N	428.456	1.675	50	20	IDGD	
CC(=NNC(=O)CN1c2cccc3cccc(c23)S1(=O)=O)c1cccc(-n2cnnn2)c1	916367730	MRYYNJFIKOXLCD-UHFFFAOYSA-N	447.480	1.865	50	20	IDGD	
COC[C@@H](C)n1c(C)cc(/C=C(/C#N)C(=O)N2CCN(C(=O)C(=O)NC3CC3)CC2)c1C	916409705	GCVUKYIBMNWPRO-BKAYVGFPSA-N	441.532	1.169	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NC[C@H](C1CCCCC1)N(C)C	916447903	HWUXOXARMUYQCW-MRXNPFEDSA-N	438.598	1.743	50	20	IDGD	
Cc1cc(C(N)=O)ccc1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	916633682	LDIUPIDYEZTNFS-UHFFFAOYSA-N	445.501	1.345	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)N[C@@H](C)CN2CCCC2=O)c2ccccc2c1=O	918100017	HLAPFCORJXUNFF-HNNXBMFYSA-N	442.520	1.542	50	20	IDGD	
CC(=O)N[C@@H](C)c1ccc(S(=O)(=O)NNC(=O)c2ccc3c(c2)OCCO3)s1	918399096	KFENSXCOVFCDRJ-JTQLQIEISA-N	425.488	1.340	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)CS(C)(=O)=O)c3ccccc3n2)cc1OC	919689667	AYWYXSIGLLUJAH-UHFFFAOYSA-N	443.481	1.725	50	20	IDGD	
O=C(Cn1cnc2ccccc21)NNC(=O)C1(S(=O)(=O)c2ccc(Cl)cc2)CC1	919689941	HAHNLMQBZAYURV-UHFFFAOYSA-N	432.889	1.844	50	20	IDGD	
CCn1c(NNC(=O)/C(=C/c2cccc(OC)c2)n2nnnc2C)nc2ccccc2c1=O	920444208	BODRJJKPMSOOCO-UYRXBGFRSA-N	446.471	1.861	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)Nc1cccc(CN2CCC[C@@H]2C(N)=O)c1	920933371	NOXIWTRYKLLSFE-KBXCAEBGSA-N	443.479	1.896	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)[C@H](Cc2ccccc2)NC(=O)c2cccnc2)cc1	921299457	UYBKKYZNRPDZLC-NRFANRHFSA-N	443.463	1.521	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)CCc3ccc4c(c3)CCO4)cc2)CC1	1253418593	FOSUPNJAKVSGGK-UHFFFAOYSA-N	444.557	1.634	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)N[C@@H]2CCOC3(CCOCC3)C2)CC1	1261443598	WFGGPOKSBFIDLI-MRXNPFEDSA-N	440.541	1.692	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NC2CCN(Cc3ccncc3)CC2)c1	1317909420	CYEYDUAROYNEIH-UHFFFAOYSA-N	431.518	1.094	50	20	IDGD	
CS(=O)(=O)c1ccc(OCCCC(=O)NNC(=O)c2cncn2-c2ccccc2)cc1	1318026510	MJADDWAHTCXFBD-UHFFFAOYSA-N	442.497	1.896	50	20	IDGD	
C[C@H](C(=O)NNC(=O)c1cncn1-c1ccccc1)N1CCN(c2ccc(F)cc2)CC1	1321910083	LTHRSOYBLSEYMM-QGZVFWFLSA-N	436.491	1.983	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)COc1ccc(Br)cc1)C(=O)NCC(F)(F)F	1325422856	LGRCPALVNLYSNX-MRVPVSSYSA-N	441.204	1.225	50	20	IDGD	
COC(=O)c1cc(C(=O)NNC(=O)c2cc(Br)c[nH]2)n(-c2ccccc2)n1	1326287333	RWULASUBHJYYGM-UHFFFAOYSA-N	432.234	1.824	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2CCCc3nn(C)cc32)c1	1326996085	WAOFSRQEWFGHSQ-MRXNPFEDSA-N	433.534	1.332	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N(C)CCO)cc2)c2ccccc2n1	1339812419	WJZOORJNRQJXBE-UHFFFAOYSA-N	442.497	1.231	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(Cl)Cl)C2)c1cnn2ccncc12	1778685002	IQOGTJYPKBADEF-RDTXWAMCSA-N	426.304	1.661	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C=C\C(=O)NC2CC2)C1	1779231448	TUKRUSZJNMQYKQ-ZUNJUMKGSA-N	442.354	1.119	50	20	IDGD	
COC(=O)[C@@H]1CC[C@@H](C(=O)N2CCO[C@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)C1	1779295155	ZBPGXSYUAGMZIN-QINHECLXSA-N	426.586	1.257	50	20	IDGD	
Cn1ccc2c(O)ncc(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)[C@H](F)Cl)C4)c21	1779996569	GPEQZFFSSORCSG-PTSWNOGYSA-N	438.887	1.941	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(C1)CN(C(=O)C1(F)CCC1)CCO2	1780099110	SUNYAIPVVYVHMK-FQEVSTJZSA-N	449.435	1.856	50	20	IDGD	
Cc1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](C)CBr)C3)n[nH]1	1780131433	HGEXZABIAUKWGP-WBHUJUFNSA-N	427.343	1.877	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cn(C(C)(C)C)nn3)C2)C1	1780357550	NBPHYCCKRODGBN-SCLBCKFNSA-N	442.358	1.650	50	20	IDGD	
Nc1ncc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](F)Br)C2)s1	1780771461	IRAXLEOWBDHCCA-JRPNMDOOSA-N	435.319	1.543	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)Cn1cccn1)C2	1782170864	CPMWYPQZSOVLDG-MIALQEHNSA-N	426.945	1.287	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(CCN(C(=O)c3n[nH]c4ccc(C#N)cc34)C2)C1	1782197017	WYUYXSNJTWWEBD-NRFANRHFSA-N	441.564	1.730	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)c1ccccc1)C2	1782209010	GRDIOQWWCKMJQV-JMUQELJHSA-N	448.539	1.584	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)COc2cccnn2)C1	1782521586	VICGAJYMZMEBQF-MDASCCDHSA-N	445.347	1.606	50	20	IDGD	
C[C@@H](Cn1ccnc1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Br)C2	1782548371	HPOIOFZZMYCVRF-JTOWHCCKSA-N	445.333	1.724	50	20	IDGD	
Cc1nccn1[C@@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Br)C2	1782626174	IVCVIOZXMZSPDH-KDQZPGIASA-N	445.333	1.957	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3cnc[nH]3)C[C@@H]21	1783969052	IKIDDRHJMGIVNQ-SDADXPQNSA-N	427.343	1.353	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cc(F)ccc3Cl)C[C@@H]21)[C@H](O)CCl	1784085272	DYISGUYLWUOZFH-WPUCRFQZSA-N	433.307	1.601	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3cncnc3)[C@H]2C1	1785392820	XAPUVAAKPUAPFJ-JONQDZQNSA-N	425.327	1.172	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21)c1cccnc1OCC1CC1	1785732268	AGYINCSZINNNRT-HJWJTTGWSA-N	425.888	1.998	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)CSc3ccncc3)C[C@@H]21	1786400914	FNLAIERSGDNFNZ-BPUTZDHNSA-N	442.379	1.938	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CNc4ccccc43)C[C@@H]21	1786406088	QIYSQKUWPVPBDE-MBGYTDRXSA-N	436.350	1.960	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Cl)C[C@@H]21)C1=C2c3ccccc3C(=O)N2CC1	1789168213	MFVYEEDFODRUNO-SJIKZXFPSA-N	447.894	1.771	50	20	IDGD	
CC(C)c1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]32)cc1	1789611001	HVDPYGYROKLRTG-ACRUOGEOSA-N	444.576	1.776	50	20	IDGD	
COc1ccccc1CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]2C1	1789925092	NDVQKPGNNSHHJV-DNUAJFIVSA-N	443.313	1.908	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)Oc3cccnc3)C[C@@H]21	1791065487	YJZOWYSVPDXCQD-BJMQQELFSA-N	440.338	1.612	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3ncc[nH]3)[C@H]2C1	1791484051	VDNUZQJVDWSRMJ-AJNGGQMLSA-N	427.343	1.496	50	20	IDGD	
O=C(CC[C@@H]1CCOC1)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1	1792021432	LHKGHZGFEXNLDD-QGZVFWFLSA-N	436.317	1.931	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@](C)(Cl)CCl)C2	1792874544	QZLFVFWEKBNMBY-HJHSNUOESA-N	430.170	1.843	50	20	IDGD	
COc1ccc(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](O)CCl)c([N+](=O)[O-])c1	1793115673	SCCSCSQWMIZQIV-UMPJEAMMSA-N	425.869	1.384	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(C)(C)CCl)C2	1793630705	QOFJAJMCBVTBKU-FZKCQIBNSA-N	443.972	1.850	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccnc(C(F)F)c1	1794567458	XDKGYAKBCKRJHU-BTTYYORXSA-N	444.442	1.583	50	20	IDGD	
CCc1nn(C)c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CO[Si](C)(C)C)c1Cl	1797954358	AQCSUYFNMCXVCY-FVCICTRLSA-N	443.020	1.691	50	20	IDGD	
Cn1nc(C(F)(F)F)cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CO[Si](C)(C)C	1797957339	JKQRMOVMQNLJLB-DRXBFXEBSA-N	448.518	1.494	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(Cl)cc1)C2	1798441783	KIYDJAOTXYCEFL-MUJYYYPQSA-N	427.892	1.904	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1n[nH]c3ccccc13)C2)[C@H](F)Br	1799349491	HKOCFALSLSIJSB-FJHTZYQYSA-N	425.258	1.457	50	20	IDGD	
O=C(CCNC(=O)c1ccc[nH]1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](F)Br	1800157810	ZGTKWJKUOMAIHP-NWJSVONSSA-N	429.290	1.463	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c(F)cc(OC)cc1F)C2	1800977072	HUPYCGPIIFNDBB-QTFJUKGGSA-N	432.851	1.430	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)Sc1ccccn1	1801321989	IMMFFEAHSUPFSB-AQDIXCGQSA-N	442.379	1.935	50	20	IDGD	
CN1CC(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)/C(C#N)=C/c2ccc(F)cc2F)C3)C1	1801560173	YWKSASISVBOXSW-HTVRTGGUSA-N	430.455	1.023	50	20	IDGD	
COc1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CCC(=O)NN(C)C)cc1N(C)C	1802338707	OSIINUXALYBBGE-BCDXTJNWSA-N	445.564	1.386	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C(Cl)Cl)c1ccccc1C(=O)OCCO	1802344126	OCFOWVCSRIAVRO-CLLJXQQHSA-N	429.300	1.891	50	20	IDGD	
COc1cccc(CCC(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)n1	1803135889	KAKDOJWRQOYBMR-BLIXFSHQSA-N	446.935	1.724	50	20	IDGD	
CC(=O)N(C)CCC(=O)NC[C@@H]1CCN(C(=O)CO[Si](C)(C)C)[C@@H]1c1cccnc1	1804069732	KVCYKQNDJJSMCY-GHTZIAJQSA-N	434.613	1.807	50	20	IDGD	
O=C(CCBr)NC[C@H]1CCN(C(=O)Cn2ccccc2=O)[C@H]1c1cccnc1	1806340250	ASABJFKFGKLEQN-UZLBHIALSA-N	447.333	1.734	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC2(CCCN(C(=O)c3ncc(F)cc3F)C2)CC1	1806345157	SEPRUMBCJDBDAS-UHFFFAOYSA-N	437.491	1.578	50	20	IDGD	
CN1CCN(CCC(=O)NC[C@@H]2CCN(C(=O)[C@H](F)Cl)[C@@H]2c2cccnc2)CC1	1806914430	PULYLEXCFYSOJJ-UHOSZYNNSA-N	425.936	1.259	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@H]1CCN(C(=O)[C@@H]2C[C@H](O)CN2)[C@H]1c1cccnc1	1808306141	ZJMGQFQDVJMRMB-CUGJGTHOSA-N	429.348	1.047	50	20	IDGD	
C[C@H](Nc1nccs1)C(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1	1808381825	VHDCIUHKQHVICB-ARLBYUKCSA-N	437.953	1.644	50	20	IDGD	
Cn1ncnc1C(=O)N1CC[C@H](CNC(=O)[C@@H](F)Br)[C@@H]1c1cccnc1	1808650893	GZHOZAFMCSGDEQ-FRRDWIJNSA-N	425.262	1.220	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)c1cc2ccccn2n1	1809053002	FUMQITXLZQJFAI-KFKAGJAMSA-N	427.892	1.649	50	20	IDGD	
CCn1nc(C)cc1C(=O)N1CCCC2(CCN(C(=O)c3ccc(B(O)O)cc3)CC2)C1	1810535905	WAGIWGXSNQMWAM-UHFFFAOYSA-N	438.337	1.050	50	20	IDGD	
CCOc1ccc(C(=O)N2CC[C@H](CNC(=O)[C@H](Cl)COC)[C@@H]2c2cccnc2)nn1	1813033307	PYHCLGCMBRRQNT-MDZRGWNJSA-N	447.923	1.844	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)/C=C/c2cnccn2)[C@H]1c1cccnc1	1813033810	SJDVGIVHNOSVMM-MZUXGMSXSA-N	429.908	1.845	50	20	IDGD	
COC(=O)[C@H]1CC[C@H](C(=O)Nc2cc([C@H]3CCCCN3C(=O)[C@@H](O)CCl)[nH]n2)CC1	1815465319	FNDABNNDDBHLFM-XOUADPBQSA-N	440.928	1.981	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CC[C@@H](N)C(N)=O)n[nH]1	1817351256	ALWPTLADLFBGJS-WZRBSPASSA-N	443.346	1.026	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccncc1)CC2	1819795639	PVDWGPHTZMDIJU-LBPRGKRZSA-N	437.485	1.076	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CNC(=O)OC)[nH]n1	1822092753	VKLUCXMODNYSSF-CMPLNLGQSA-N	430.303	1.931	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)Cn2nccn2)CC1	1824093792	DEYHBMQSPVDKHH-GDBMZVCRSA-N	426.359	1.929	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@H](O)C(C)C)CC1	1824254233	QGXNSALRKCZHQG-LZVXGSKFSA-N	445.564	1.757	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccco2)CC1	1825263528	ILMDWEOGLSBXFP-NEQMZLFVSA-N	436.317	1.906	50	20	IDGD	
Cc1ccc(CC(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)cn1	1825293980	GTMDHMISCGYKMY-QHCPKHFHSA-N	449.360	1.546	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H]1CNC(=O)O1)CC2	1825441528	ZMEGRIYNQGWPCG-WEDXCCLWSA-N	431.312	1.337	50	20	IDGD	
CN1CCN(CCC(=O)N[C@H]2CCc3nc(NC(=O)C(Cl)Cl)sc3C2)CC1	1826096208	LNTOCUWFABCLLO-NSHDSACASA-N	434.393	1.496	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCCC[C@H]1C1CCN(C(=O)CN2CCOC2=O)CC1	1829099223	GCAGUHVIHZWTMP-KRWDZBQOSA-N	425.602	1.910	50	20	IDGD	
O=C(C1CC(F)(F)C1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1829991794	VYFASQUIMOHMTF-SMDDNHRTSA-N	429.233	1.179	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@H]2CNC(=O)C2)CC1	1831408590	BYXRXNDELWCYTE-FVQBIDKESA-N	428.371	1.773	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccnc2C(N)=O)CC1	1831827874	LRWAGKUISJSQMZ-IRXDYDNUSA-N	436.940	1.668	50	20	IDGD	
C[C@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1)n1cccn1	1832239415	FTPJVOWZJDQIEO-MJGOQNOKSA-N	432.569	1.437	50	20	IDGD	
CC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)[C@@H](C)CBr)CC2)CC1	1833262198	JNROIMMLOAYOAQ-AWEZNQCLSA-N	430.387	1.958	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3c(F)ccnc3Cl)CC2)CC1)[C@H](O)CCl	1833307851	AQENISDRETZPRY-OAHLLOKOSA-N	447.338	1.659	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)CCl)CC2)CC1	1833312251	MSDXCGCRYWAIKV-LSDHHAIUSA-N	438.794	1.331	50	20	IDGD	
Cc1cc(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](C)Br)CC3)CC2)nn1C	1834175951	SZNKSFHXCFTDKT-CQSZACIVSA-N	440.386	1.697	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC1CCN(C2CCN(C(=O)c3ccc(CO)o3)CC2)CC1	1835836931	CSVLIZTUURJWLQ-UHFFFAOYSA-N	437.613	1.809	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(F)c(C)c3N)CCO2)C1	1835873165	NQKFCESQGBCRJZ-MGPUTAFESA-N	427.904	1.804	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)c3cnn4ccncc34)CC2)CC1	1836393993	FZFKVMAUOFEBGE-GOSISDBHSA-N	432.956	1.932	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC(OC2CCN(C(=O)c3ncn(C)n3)CC2)CC1	1836670274	NAYSLGJHHYCEEH-ZDUSSCGKSA-N	442.358	1.458	50	20	IDGD	
O=C(c1ccc2nc[nH]c2c1)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836717282	RWFXGXUVOVFIOF-LJQANCHMSA-N	434.924	1.775	50	20	IDGD	
O=C(c1cc2sccc2s1)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1	1836857197	BYYAJBWQUJMADN-XIKOKIGWSA-N	444.962	1.633	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)CSC(=N)N)CC2)CC1	1837831537	UKNSJSFDQHDBTF-AWEZNQCLSA-N	449.415	1.785	50	20	IDGD	
O=C(c1cc(C(F)(F)F)ccn1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1838084575	HMZMZCLFBBFGKT-XJKSGUPXSA-N	439.793	1.705	50	20	IDGD	
O=C(c1[nH]cnc1-c1cccnc1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1838495893	KHUKMFOVPUYRSB-QFBILLFUSA-N	437.859	1.076	50	20	IDGD	
C=C(CC(=O)OCC)C(=O)N1CCC(OC2CCN(C(=O)[C@H](Cl)COC)CC2)CC1	1838642462	PQWLKKRQSXIPPQ-GOSISDBHSA-N	444.956	1.748	50	20	IDGD	
O=C(c1cc(-c2ccccc2)[nH]n1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1838688884	KRMCVMAFZPEJMC-YLJYHZDGSA-N	436.871	1.681	50	20	IDGD	
COc1cccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)c1	1838929398	LOFCQVRXZZVBML-KUHUBIRLSA-N	441.322	1.549	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccnc(NC(C)=O)c3)C2)C1	1839145008	QLKOOLNJEAWKCP-JXFKEZNVSA-N	438.912	1.127	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3coc(Cl)n3)C2)C1	1840031027	DGLJGGWPHMBGGO-MEBBXXQBSA-N	436.690	1.181	50	20	IDGD	
O=C(CCCc1ccncc1)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840186149	DBADNRIZHRGZPK-IBGZPJMESA-N	430.332	1.664	50	20	IDGD	
O=C(Cc1ccc2c(c1)OCO2)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840188165	RQMWUMGMGLLZMU-IBGZPJMESA-N	445.299	1.218	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC12CN(C(=O)[C@H]1CC[C@H]3CCC(=O)N3C1)C2	1841288266	KGPIQHAGLXSBTR-ILXRZTDVSA-N	426.355	1.622	50	20	IDGD	
O=C(c1cc2cc(Br)ccn2n1)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1	1841351665	WSGQVVMOAVPKGJ-AWEZNQCLSA-N	441.713	1.514	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)c1cccc(N3CCCNC(=O)C3)n1)C2	1841666990	KFZVTVFRYILNJK-INIZCTEOSA-N	447.967	1.632	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H]1C(=O)N1CCCC12CN(C(=O)[C@H](F)Br)C2	1841766985	XZYZWFGZQXDYQT-NEPJUHHUSA-N	434.306	1.890	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)Cc2nc(C)sc2C)C1	1842105046	CJOREXXIIXTEKP-ZMOGYAJESA-N	442.545	1.640	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC2(CCCN2C(=O)c2ccc3c(c2)n(C)c(=O)n3C)C1	1843734861	JPKAOPOMDMZIFN-CQSZACIVSA-N	449.349	1.868	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2csc3c2CCCC3)C1	1844043015	VAYINEYXGFCQAR-UHFFFAOYSA-N	439.541	1.756	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)c1cccnn1)C2	1844692759	HIVVCGCPHMCTDQ-UHFFFAOYSA-N	425.401	1.441	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)CC1CN(C(=O)OC(C)(C)C)C1)C2	1846365797	WREYDYXUIZZLSM-HNNXBMFYSA-N	429.945	1.701	50	20	IDGD	
O=C(COc1cccc2ccccc12)N1CC[C@H]2[C@@H]1CCN2C(=O)c1ccc(B(O)O)cc1	1848059363	QAHOWSHBWNJZIR-VXKWHMMOSA-N	444.296	1.414	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CNC(=O)c1cccs1	1848219954	MCYWAIASYGWMJO-AVGNSLFASA-N	428.352	1.853	50	20	IDGD	
Cc1ccc(S(=O)(=O)NC(C)(C)C)cc1C(=O)OCC(=O)NNC(=O)c1ccccc1	24196738	WTIRSOWHHMHSBT-UHFFFAOYSA-N	447.513	1.690	50	20	IDGD	
CCCCOc1ccc(C(=O)NNS(=O)(=O)c2ccc3c(c2)NC(=O)CO3)cc1OC	24260349	SEOUJFWLYADDGC-UHFFFAOYSA-N	449.485	1.828	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1	26974924	JHQADXULCVJLSS-QFBILLFUSA-N	445.497	1.136	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)CCCNS(=O)(=O)c1cccc(C(F)(F)F)c1	726541244	UCIAWNYBOJQVIP-UHFFFAOYSA-N	432.424	1.564	50	20	IDGD	
CC(=O)N[C@@H](CC(=O)OCC(=O)NNC(=O)c1cccs1)c1c(F)cccc1F	727569927	KTWLXJWXOFBVAN-ZDUSSCGKSA-N	425.413	1.598	50	20	IDGD	
COC(=O)Nc1ccc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1	728322967	IOIWSMBAYLEIID-INIZCTEOSA-N	429.385	1.009	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c2ccccc12	728854350	SKRQUIRSVVXWKH-UHFFFAOYSA-N	441.513	1.865	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)c1ccc(NS(=O)(=O)c2cccs2)cc1O	728981576	BVTJCXSRMFGTQQ-UHFFFAOYSA-N	432.483	1.653	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)N[C@@H](CC)c1cccc(S(N)(=O)=O)c1	729612155	ABAHKFVMBKTNFA-KRWDZBQOSA-N	434.518	1.757	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)NCCOc2ccc(S(C)(=O)=O)cc2)c1	730066838	QLKTWLYQDWHWBX-UHFFFAOYSA-N	437.474	1.130	50	20	IDGD	
Cc1cccc(N2C(=O)N[C@H](CCC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)C2=O)c1	730768426	OPPUPTPSIBVDKG-MRXNPFEDSA-N	425.401	1.569	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNS(=O)(=O)C[C@@H]2CCCCO2)cc1	731901985	IUTIDTQQXZSHBT-HNNXBMFYSA-N	425.536	1.241	50	20	IDGD	
CC(C)N(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1	733108279	FIIJATAVDKIUOX-UHFFFAOYSA-N	441.513	1.976	50	20	IDGD	
CCS(=O)(=O)C[C@H](C)N(C)C(=O)CCC(=O)C(C#N)=C1N(C)c2ccccc2N1C	733184776	RMGPZQKUSADLRG-HNNXBMFYSA-N	432.546	1.939	50	20	IDGD	
CC(=O)[C@@H]1CC(C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)=NN1c1ccccc1	734239179	IZFGCAQXYUWPFS-INIZCTEOSA-N	432.481	1.065	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1)N[C@H]1CCN(C2CC2)C1	734284935	BYANKHHQVZPICZ-IBGZPJMESA-N	446.515	1.569	50	20	IDGD	
NC(=O)C1(c2ccccc2)CCN(C(=O)NNC(=O)c2cc(Br)c[nH]2)CC1	734519555	WVKRSSGEUBCXCY-UHFFFAOYSA-N	434.294	1.651	50	20	IDGD	
CNC(=O)c1cncc(/C=C\C(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)c1	734825141	VVUZUHVVOTYRKE-WAYWQWQTSA-N	446.508	1.184	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)NC[C@H](O)c1cc(Cl)c2c(c1)OCCO2	740025207	FLWXQERDSUGATR-AWEZNQCLSA-N	445.863	1.745	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNS(=O)(=O)c2ccc(N3CCOC3=O)cc2)cc1C	740809589	CXSOZNBWHNEJAQ-UHFFFAOYSA-N	432.458	1.208	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)CCN2CCN(c3ccccn3)CC2)c1C	741144149	GYIKMCOHMFKLQL-IBGZPJMESA-N	425.533	1.825	50	20	IDGD	
O=C(Cn1cnc2ccccc21)NNC(=O)[C@H]1CCCN(C(=O)COc2ccccc2)C1	741207879	UPYAYVFQQAYSFU-KRWDZBQOSA-N	435.484	1.501	50	20	IDGD	
NC(=O)CS(=O)(=O)c1ccc(C(=O)NNC(=O)c2ccc(Cl)cc2Cl)cc1	742483934	ZFYDNJRYEZZTQD-UHFFFAOYSA-N	430.269	1.327	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)NCC[C@@](O)(c2nccn2C)C(F)(F)F)cc1	743559820	OBMDRKGXXPMLQM-QGZVFWFLSA-N	443.430	1.662	50	20	IDGD	
CCOC(=O)N1CCC[C@@H](C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)C1	744620590	LFBSIXDIUIJNFL-OAHLLOKOSA-N	440.522	1.019	50	20	IDGD	
CCCN(C(=O)[C@H](C)OC(=O)/C(C#N)=C/c1cc(C#N)n(C)c1C)[C@H]1CCS(=O)(=O)C1	744630947	CETAGCFGYOXCKA-LYENLMGESA-N	446.529	1.470	50	20	IDGD	
Cc1ccc(F)c(NC(=S)NNC(=O)CN2C(=O)N[C@@](C)(c3ccccc3)C2=O)c1	745195959	ZBHHWXWURXDFIT-FQEVSTJZSA-N	429.477	1.919	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NCc2cccc(C(=O)NC3CC3)c2)cc1	745632404	AYFQLRVGELXYQO-UHFFFAOYSA-N	445.501	1.518	50	20	IDGD	
O=C(NCCCC(=O)N1Cc2ccccc2C1)NNC(=O)c1cc([N+](=O)[O-])ccc1O	745816048	ROMRNFNSYNCOHG-UHFFFAOYSA-N	427.417	1.567	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)CNC(=O)[C@@H]1c2ccccc2C(=O)N1Cc1ccccc1	745838361	LTADPYJDOSRXEB-NRFANRHFSA-N	445.479	1.300	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@H]2C[C@@H](C)N(c3ccccc3)C2=O)c2ccccc2c1=O	745880805	BLQOHXOCUGHDAE-KDOFPFPSSA-N	448.483	1.554	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN(C(=O)NC2CCCC2)C1)C1CCN(c2ncccn2)CC1	746219685	UOTLBCXGDFXPMZ-QGZVFWFLSA-N	443.552	1.205	50	20	IDGD	
CCOc1ccc(-n2ncc(C(=O)NNC(=O)c3nn(-c4ccccc4)cc3O)c2C)nn1	746678691	SVMYZRHOGPNECW-UHFFFAOYSA-N	448.443	1.336	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2CCCN2Cc2ccc(F)cc2)c1	747344368	DFPRIAWHVQDYGU-IBGZPJMESA-N	448.520	1.502	50	20	IDGD	
CN(CC(C)(C)CNC(=O)OC(C)(C)C)C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	747491986	ZSDZJGSBHZQBAC-UHFFFAOYSA-N	446.512	1.499	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N2CCN(c3cnn(C)c3)CC2)cc1Br	747502584	UOGPFXCGKXSMEN-UHFFFAOYSA-N	437.298	1.368	50	20	IDGD	
C[C@H](c1ccncc1)N1CCC(NC(=O)NNC(=O)CNC(=O)c2cccs2)CC1	747949487	AJVJMXGCLSPXOX-CQSZACIVSA-N	430.534	1.429	50	20	IDGD	
O=C(C/N=C1/NS(=O)(=O)c2ccccc21)NNc1nc(-c2ccccn2)nc2c1CCC2	748337650	KNNDFYUNKFHSSO-UHFFFAOYSA-N	449.496	1.209	50	20	IDGD	
O=C(CNS(=O)(=O)c1cccs1)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1	748522554	URWPHKPVNNHQED-UHFFFAOYSA-N	443.450	1.463	50	20	IDGD	
CCCc1nc(C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)nn1-c1ccccc1Cl	748614556	VDGNEHAPGQZHAY-NSHDSACASA-N	425.898	1.069	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)CCSCc3ccccn3)cc2)CC1	748620503	QITAHPPCIPYLOI-UHFFFAOYSA-N	449.602	1.784	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NC[C@H](C)Cn2ccnc2C)c2ccccc2c1=O	749196816	QZEIZUYUARCQNY-HNNXBMFYSA-N	439.520	1.982	50	20	IDGD	
Nc1c(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)cccc1[N+](=O)[O-]	749323925	JTALLMQAVHFKAT-UHFFFAOYSA-N	447.473	1.426	50	20	IDGD	
CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)NNC(=O)COc1ccc(C)cc1	749332857	FNXVWGHNZPAZJR-HXUWFJFHSA-N	426.448	1.889	50	20	IDGD	
CCO[C@H]1C[C@@H](NC(=O)NNC(=O)c2csc(N3CCOCC3)n2)C1(CC)CC	749619577	WTPPAMOVTJQPFW-CABCVRRESA-N	425.555	1.908	50	20	IDGD	
O=C(NNC(=O)N1CCN(S(=O)(=O)c2ccc(F)cc2)CC1)c1cc2ccccc2o1	750288884	MFAMYEQDYUWQGY-UHFFFAOYSA-N	446.460	1.933	50	20	IDGD	
CCCN(CC)c1ccc(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cn1	751294866	UQFODFWQIIAYJP-UHFFFAOYSA-N	439.925	1.694	50	20	IDGD	
COc1cccc(C(=O)NNS(=O)(=O)c2cc(Br)cc(C#N)c2)c1O	754255925	FEXASERCRZWAHD-UHFFFAOYSA-N	426.248	1.658	50	20	IDGD	
C[C@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)NNc2ccc(C(F)(F)F)nn2)C1=O	755197175	ACGPLWKCGUXIRA-MRXNPFEDSA-N	426.330	1.545	50	20	IDGD	
COc1cc(C(=O)NCC(=O)NNc2ccc(C(F)(F)F)nn2)cc(OC)c1OC	755288118	ANEQGEQKUJGFGE-UHFFFAOYSA-N	429.355	1.394	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)Nc2ccc(C)c(S(=O)(=O)N3CCCCC3)c2)n1	755391788	DJRHTZWLTZWBKF-UHFFFAOYSA-N	448.549	1.836	50	20	IDGD	
COC(=O)c1cc(NC(=O)NNC(=O)COc2ccccc2C#N)c(OC)c(OC)c1	756741566	GQJWQAPACJWOED-UHFFFAOYSA-N	428.401	1.594	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)Nc2ccc(-n3ncn(C)c3=O)cc2)cc1	757864455	YTOSMNNMIMCWFJ-CQSZACIVSA-N	438.444	1.394	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2cc(C)cc([N+](=O)[O-])c2C)cc(OC)c1OC	758148742	RISZKLKMNXTNSN-UHFFFAOYSA-N	439.446	1.861	50	20	IDGD	
O=C(COC(=O)c1cnc([C@@H]2CCCO2)s1)NNC(=O)[C@@H]1COc2ccccc2O1	760673180	QDBLUASWLYFKIG-KBPBESRZSA-N	433.442	1.139	50	20	IDGD	
Cc1cc(C)n(-c2ccc(NC(=O)C(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)cc2F)n1	763455570	UNRQJQPJYVZVFP-UHFFFAOYSA-N	440.391	1.936	50	20	IDGD	
O=C(NNC(=O)c1ccccc1O)C(=O)Nc1ccc(C(=O)N2CCc3ccccc32)cc1	763530653	YRPVDKHDTNUGEY-UHFFFAOYSA-N	444.447	1.995	50	20	IDGD	
O=C(COc1ccccc1Br)NNC(=O)Cn1nnc(-c2ccccc2)n1	763547101	HDAHXDQBEGIREA-UHFFFAOYSA-N	431.250	1.329	50	20	IDGD	
CC(C)C(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1	763569802	CCQXVAXIFFAFDS-QGZVFWFLSA-N	426.429	1.207	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)N1CCc2ccc(Br)cc21	763571374	IKTHNVMMYWOTKQ-INIZCTEOSA-N	446.257	1.326	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1cnn(-c2ccccc2F)c1C	763629120	OUSLJFZZZNSTBD-UHFFFAOYSA-N	435.419	1.676	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1cccc(-c2nnnn2C2CC2)c1	763630154	VSQYDIJKBUTSKS-UHFFFAOYSA-N	445.443	1.031	50	20	IDGD	
O=C(CN1CCCc2ccccc21)NNC(=O)C(=O)Nc1ccc(-n2cccn2)c(F)c1	763728349	LATBSRISPZJADO-UHFFFAOYSA-N	436.447	1.550	50	20	IDGD	
Cc1nnc(-c2cccc(NC(=O)C(=O)NNC(=O)CN3CCCc4ccccc43)c2)n1C	763746334	SLOWKVLMKOGGMQ-UHFFFAOYSA-N	447.499	1.329	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2cc(C)ccc2Cl)c2ccccc2c1=O	763787292	WOFUNGVWEDWPHZ-UHFFFAOYSA-N	427.848	1.778	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)C(=O)Nc1ccc(Br)cc1	763790814	PFJKPEQTTBLINU-UHFFFAOYSA-N	430.218	1.498	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)C(=O)Nc1cccc(C(F)(F)F)c1	763804479	NGWPOAHHVLBIIT-UHFFFAOYSA-N	426.307	1.779	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(C(C)=O)cc2)cc(OC)c1	763872587	OTDRFUBHOPOETR-ZDUSSCGKSA-N	429.429	1.460	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)C(=O)Nc1ccc(OC2CCC2)c(F)c1	763921828	PFGJSVSPUSFVJQ-UHFFFAOYSA-N	439.407	1.132	50	20	IDGD	
Cc1ccnc(-c2ccc(NC(=O)C(=O)NNC(=O)c3cc(Br)c[nH]3)cc2)n1	763996122	VJOFLVRZZHFXHR-UHFFFAOYSA-N	443.261	1.942	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc4c(c3)CCC(=O)N4)n[nH]2)cc1	764110462	KBPDVSUKMIJOHU-UHFFFAOYSA-N	432.440	1.670	50	20	IDGD	
Cc1ncsc1C(=O)NNC(=O)C(=O)Nc1ccc(C(=O)NCc2ccccc2)cc1	764245844	VAUNDTHNAGRDDT-UHFFFAOYSA-N	437.481	1.781	50	20	IDGD	
CS(=O)(=O)c1c(F)cc(NC(=O)C(=O)NNC(=O)c2cccc3ncccc23)cc1F	764257712	MBIKYQCXSDQCNS-UHFFFAOYSA-N	448.407	1.316	50	20	IDGD	
COC(=O)c1csc(NC(=O)C(=O)NNC(=O)c2cc(F)ccc2Br)c1	764271143	WPNBADWMASMABR-UHFFFAOYSA-N	444.238	1.836	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1	764342838	SATVINURONTJJF-UHFFFAOYSA-N	434.412	1.924	50	20	IDGD	
CC(=O)N1CCCc2cc(NC(=O)C(=O)NNC(=O)c3ccc(O)c(Cl)c3)ccc21	764345306	FSMZGUVDZQMELD-UHFFFAOYSA-N	430.848	1.744	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)N2CCc3cc(F)c(F)cc32)n[nH]1	764378010	UYWJVZLYXIFTFD-UHFFFAOYSA-N	441.394	1.714	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NN/C=C3\C(=O)NC(=O)c4ccccc43)n[nH]2)cc1OC	764415006	XRIQLUVQOFVUGM-PTNGSMBKSA-N	433.424	1.639	50	20	IDGD	
O=C(CSc1nnc(-c2ccncc2)n1Cc1ccco1)NNC(=O)c1ccccn1	764430421	QESCSUJXJRVJHR-UHFFFAOYSA-N	435.469	1.930	50	20	IDGD	
COc1ccc(C(=O)NNc2nccnc2OC)cc1S(=O)(=O)NCc1ccccn1	764469872	MIOCNAMQIQAGIJ-UHFFFAOYSA-N	444.473	1.124	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)[C@@H](C)Oc1ccc2ccccc2c1)S(=O)(=O)C1CCOCC1	764553093	QHHDRFYUHDRQSY-CABCVRRESA-N	434.514	1.737	50	20	IDGD	
COCc1cccc(C=NNC(=O)CN2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)c1	764820184	WAEPFNGFJMGLLN-UHFFFAOYSA-N	444.557	1.598	50	20	IDGD	
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)NNC(=O)c1csc(N2CCOCC2)n1	765197782	XWGHSAFNOIBCSF-RDJZCZTQSA-N	444.561	1.444	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3ccc([S@@](C)=O)cc3)n[nH]2)cc1OC	765597814	XMSGRDYEBIZDDL-SSEXGKCCSA-N	428.470	1.906	50	20	IDGD	
C[C@H](OC[C@@H]1CCCO1)C(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	766670330	XMQHKSIEJDBSAI-WMZOPIPTSA-N	438.956	1.189	50	20	IDGD	
CC[C@@H](C)NC(=O)CN1CCN(C(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)CC1	770650417	VIWIYWONHZABBN-CABCVRRESA-N	439.944	1.380	50	20	IDGD	
C[C@H](NS(=O)(=O)c1cccs1)C(=O)NNc1nc(O)c2cnn(C(C)(C)C)c2n1	770966075	JYTCCLQHQRAYTP-VIFPVBQESA-N	439.523	1.159	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)c3nc(C4CC4)n(-c4ccccc4Cl)n3)nc21	770972560	RVWQEQLZCRFGBM-UHFFFAOYSA-N	425.840	1.937	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1cccc(S(=O)(=O)Nc2ccccc2OC)c1	771881413	ISCTUALIZAUGOB-CYBMUJFWSA-N	449.485	1.599	50	20	IDGD	
C[C@@H](NC(=O)c1n[nH]c2ccccc12)C(=O)NNC(=O)[C@@H](C)Oc1cccc(Cl)c1	772991627	WPDGOWDKJUJICZ-VXGBXAGGSA-N	429.864	1.950	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NNC(=O)[C@H]2CC(=O)N(CC(F)(F)F)C2)C1	773412872	XSHJZGVTUUVQJA-NEPJUHHUSA-N	436.431	1.192	50	20	IDGD	
Cn1c(CNC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)nc2cccc(Cl)c21	773491828	KMRUMSLTCGVQMI-UHFFFAOYSA-N	435.893	1.774	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C)c(S(=O)(=O)N(C)C)c2)cc1F	773888134	AWAWLBPHIQGAKK-UHFFFAOYSA-N	436.465	1.093	50	20	IDGD	
COCc1ccc(S(=O)(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)cc1	774611321	OBAPXJZCDJRVFH-UHFFFAOYSA-N	426.520	1.058	50	20	IDGD	
CCO[C@@H](CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)c1ccccc1	775199336	BHWWLSRGBJFCRM-SFHVURJKSA-N	434.518	1.659	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)N[C@@H](c1ccccc1OC(F)F)C(F)(F)F	776003045	WIKKAEKYVIZIPJ-XCBNKYQSSA-N	448.370	1.160	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)CN2C(=O)N[C@@]3(C[C@@H](C)CC(C)(C)C3)C2=O)nc1C	778423484	DEGPPCQLABBSMG-LAJNKCICSA-N	446.508	1.542	50	20	IDGD	
CCn1c(=O)c(C(=O)/C(C#N)=C\c2ccc(OC)nc2)c(N)n(Cc2ccccc2)c1=O	780148359	QBLHYBFXCVRASY-BOPFTXTBSA-N	431.452	1.854	50	20	IDGD	
COc1ccc(NNC(=O)CN2C(=O)N[C@@](C)(c3ccc(Br)cc3)C2=O)nc1	781537470	POFFKYWWSHWHHT-SFHVURJKSA-N	448.277	1.763	50	20	IDGD	
CC(C)(C)c1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(OC3COC3)cc2)cc1	782121284	NXRPJOZKOICYNF-UHFFFAOYSA-N	441.484	1.927	50	20	IDGD	
CSCc1cccc(NC(=O)C(=O)NNC(=O)c2csc(N3CCOCC3)n2)c1	782896243	CVJRYIMBXBNPHO-UHFFFAOYSA-N	435.531	1.242	50	20	IDGD	
Cc1ccc(C(=O)N2CCSCC2)cc1NC(=O)C(=O)NNc1cncc(Cl)n1	783258914	QGTLMPUYMKCBRD-UHFFFAOYSA-N	434.909	1.709	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2cc(Cl)ccc2Cl)n([C@H]2CCS(=O)(=O)C2)n1	783369201	GQINKNGJDOQCKX-NSHDSACASA-N	446.316	1.940	50	20	IDGD	
CCN1CCN(S(=O)(=O)c2cccc(NC(=O)C(=O)NN(C)c3ccccc3)c2)CC1	783428935	FCKONFLUBPKLPB-UHFFFAOYSA-N	445.545	1.119	50	20	IDGD	
CCCNS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccc(C#N)c(Cl)c2)cc1	785093078	LJYKQAAOXYAYAI-UHFFFAOYSA-N	435.893	1.982	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)[C@H]2CCCN2c2ccccc2)CC1	787887319	BHCRNNXNAFJRJA-GOSISDBHSA-N	444.561	1.130	50	20	IDGD	
COc1ccc(OC)c([C@H]2C[C@@H]2C(=O)NNC(=O)c2csc(N3CCOCC3)n2)c1	788092799	RYDDFEWFASYKPC-HIFRSBDPSA-N	432.502	1.562	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)c1ccc2c(c1)C(=O)N(C[C@@H]1CCCO1)C2=O	788180665	DGJXGTTVWQNEDW-AWEZNQCLSA-N	433.428	1.194	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)CNc1ccccc1C(N)=O	788265973	RAJHHDGQNSGZAR-LLVKDONJSA-N	435.278	1.575	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)CN1CCc2ccccc2C1=O	789276963	FHLCHGZBKHYPFG-UHFFFAOYSA-N	445.859	1.351	50	20	IDGD	
CCS(=O)(=O)c1ccc(CNC(=O)NNC(=O)Cc2nc3ccccc3n2C)s1	792218228	ROYFVVRNXNFLFI-UHFFFAOYSA-N	435.531	1.502	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)Cc1csc2ccc(Br)cc12	792643996	WXSJBYBDHXOHNV-MRVPVSSYSA-N	434.337	1.291	50	20	IDGD	
Cc1ccn(-c2ccc(NC(=O)C(=O)NNC(=O)c3cc(-c4ccccc4)[nH]n3)cc2)n1	793023308	LZYWDOKEZJVEPH-UHFFFAOYSA-N	429.440	1.971	50	20	IDGD	
CN(CC(N)=O)C(=O)c1cccc(NC(=O)C(=O)NNc2ccccc2Br)c1	793034487	GLPDTYMUIPBHIA-UHFFFAOYSA-N	448.277	1.088	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)N2CCCN(S(=O)(=O)c3ccc(F)cc3)CC2)n1	793220270	MNTRJXPUAOWYFU-UHFFFAOYSA-N	435.481	1.280	50	20	IDGD	
Cc1ccc(S(=O)(=O)NNC(=O)c2ccccc2O)cc1I	793349214	LHEIDGXHMXFZEQ-UHFFFAOYSA-N	432.239	1.929	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@@H](c2cnn(C)c2)N(C)C(=O)OC(C)(C)C)cc1OC	794756747	CFEKROKCSPEREA-QGZVFWFLSA-N	447.492	1.807	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)CNC(=O)c1ccccc1C(F)(F)F	795161329	MOKLLRXWNLCUPC-UHFFFAOYSA-N	444.435	1.829	50	20	IDGD	
CCC[C@H](NC(=O)Cc1ccccc1)C(=O)NNc1ccccc1S(=O)(=O)N(C)C	795176522	BSTGVZQTFORTCR-SFHVURJKSA-N	432.546	1.908	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)CCCNC(=O)NC1CCCCC1	795182741	WVECOAXAAQHKIM-UHFFFAOYSA-N	425.555	1.792	50	20	IDGD	
O=C(CSCCOCCN1C(=O)c2ccccc2C1=O)NNC(=O)c1ccccc1	795244912	HJJSYIOLBNWKNQ-UHFFFAOYSA-N	427.482	1.494	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNS(=O)(=O)c2cc([N+](=O)[O-])cc(Cl)c2F)cc1C	795286447	LXWFWWLVZQWFET-UHFFFAOYSA-N	444.828	1.952	50	20	IDGD	
COC(=O)[C@@H]1CN(C(=O)OC(C)(C)C)CCCN1[C@@H](C)C(=O)NNC(=O)CC(C)C	796682705	KVKLZEZVAAWVDW-GJZGRUSLSA-N	428.530	1.053	50	20	IDGD	
Cc1cc(C)c(NNC(=O)C(=O)Nc2cc(S(=O)(=O)N3CCCC3)ccn2)c(C)c1	797051960	TVAYFISCJBJDRH-UHFFFAOYSA-N	431.518	1.873	50	20	IDGD	
CNC(=O)CNC(=O)c1cccc(NC(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)c1	800597616	YEVFJDKZAIEDLX-UHFFFAOYSA-N	427.505	1.532	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)[C@](C)(O)CSc1cccc(F)c1	803799201	YIBGSTKWNKLUBE-OAQYLSRUSA-N	434.489	1.911	50	20	IDGD	
COCc1nc(Cl)cc(NNC(=O)Nc2c(C)nn([C@H]3CCS(=O)(=O)C3)c2C)n1	806385088	WIHBNROEKQAICE-NSHDSACASA-N	443.917	1.598	50	20	IDGD	
Cc1c(C(F)(F)F)nn(C)c1NC(=O)C(=O)NNC(=O)c1cnn(-c2ccccc2)c1	806980149	PSTULCMIIMHOOO-UHFFFAOYSA-N	435.366	1.333	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)NC[C@H](c1ccc(F)cc1)N1CCOCC1	807000092	IYTDIMZIYKMJEO-LJQANCHMSA-N	441.463	1.480	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)C(=O)Nc1ccccc1CN1CCSCC1	807429060	LCHXDMHTGNAVNQ-UHFFFAOYSA-N	438.517	1.293	50	20	IDGD	
Cc1nn(C)cc1S(=O)(=O)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1	808084569	AOIMRQHZTDCJKY-FQEVSTJZSA-N	439.541	1.665	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CC[C@@](CO)(Cc3ccc(F)cc3)C2)cc1OC	808793938	AMGFUGPKRCOEBZ-HSZRJFAPSA-N	445.491	1.531	50	20	IDGD	
CNC(=O)c1cc(Oc2ccc(NC(=O)C(=O)NNC(=O)CC(C)(C)C)cc2F)ccn1	810386566	HCJCKXKNOFQGEX-UHFFFAOYSA-N	445.451	1.895	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCC(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)cc1C	811462018	JUHIWSRGFCPTBN-AWEZNQCLSA-N	439.921	1.850	50	20	IDGD	
O=C(COC(=O)C1(S(=O)(=O)c2ccc(Cl)cc2)CC1)NNC(=O)c1cccs1	812747466	AYQBCZOIFMOXOK-UHFFFAOYSA-N	442.902	1.712	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CCN2C[C@H](C)O[C@@H](C)C2)c([N+](=O)[O-])cc1OC(F)F	813281482	CRZHEJOTRMUOEP-QWRGUYRKSA-N	446.407	1.465	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)c2ccc3c(c2)NC(=O)CNC3=O)cc1OC	814248263	RDUNIUDVHXTCRP-UHFFFAOYSA-N	426.429	1.241	50	20	IDGD	
CCNC(=O)NNC(=O)c1cn(C)nc1[C@H]1CCCN(C(=O)OCc2ccccc2)C1	814627227	WXMPDQIRRRWYSH-INIZCTEOSA-N	428.493	1.900	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2nc3ccccn3n2)cc1S(=O)(=O)C1CCCC1	815619065	AZMZRKZZGZRVAS-UHFFFAOYSA-N	442.501	1.836	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNc2ncncc2F)c(OCC(F)(F)F)c1	815766256	STGNLRMSMCLDGM-UHFFFAOYSA-N	431.302	1.425	50	20	IDGD	
CCCn1nc(C(=O)NNS(=O)(=O)Cc2ccc(C(=O)O)cc2)c2ccccc2c1=O	821127820	OASAKNSUANKDAB-UHFFFAOYSA-N	444.469	1.269	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)[C@H]2CCCN2c2ncccn2)c2ccccc2c1=O	912864327	DDSJYQPHLPKOHI-GOSISDBHSA-N	449.515	1.807	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNS(=O)(=O)c2ncn(C)c2Cl)cc1	914564631	XHWSWAMSUXEIGK-UHFFFAOYSA-N	441.926	1.118	50	20	IDGD	
Cc1nn([C@H]2CCS(=O)(=O)C2)c2nc(C3CC3)cc(C(=O)NNC(=O)C3CCCC3)c12	914843738	WYWYSKVZBXDEAF-HNNXBMFYSA-N	445.545	1.928	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NCCc3ccccc3F)nc2)CC1	915908818	OPZHGRDZHUUGHW-UHFFFAOYSA-N	436.513	1.026	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)c1cncc(C(=O)NNC(=O)c2ccccc2C)c1	916146703	UUSAYKXWWFYVRI-UHFFFAOYSA-N	431.452	1.848	50	20	IDGD	
CC[C@H](C)NC(=O)c1cccc(CNC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1	916477281	WZCFBVCYJNNTLS-IFXJQAMLSA-N	426.473	1.885	50	20	IDGD	
COCCCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	916501997	HQABZILHVVHAPL-UHFFFAOYSA-N	434.518	1.536	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)N(C)CC(=O)N2CCN(C)CC2)c(C)n1C[C@H]1CCCO1	916558344	LHYCMMCJUYYSEC-DMMSUNFISA-N	427.549	1.423	50	20	IDGD	
Cc1cc(O[C@@H](C)C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)ccc1Cl	917314106	YYTNTOCWCGNTIK-UGSOOPFHSA-N	448.859	1.946	50	20	IDGD	
COC(=O)COc1cccc(C(=O)NNC(=O)COc2ccc(Br)cc2)c1	917547064	KSAWVWXNLHEBKH-UHFFFAOYSA-N	437.246	1.841	50	20	IDGD	
COc1cccc(CCNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)c1OC	918014422	ZWQFMDGKISZBGZ-UHFFFAOYSA-N	435.506	1.184	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)[C@H](C)NC(=O)C2CCCCC2)cc1OC	919635711	QGAGMNCFVAMBPG-ZDUSSCGKSA-N	435.477	1.093	50	20	IDGD	
COc1cccc(C(=O)NNS(=O)(=O)c2cc(C(=O)O)ccc2Br)c1O	919958447	MHZXXCTVLKZZIT-UHFFFAOYSA-N	445.247	1.485	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)NCc1cccc(NC(=O)[C@H]2CCCO2)c1	920238081	PTNZUYCPSMZCGM-GOSISDBHSA-N	430.436	1.853	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)CS(=O)(=O)Cc2ccc(C#N)cc2)o1	920272459	YBPDYMCTXBZBBK-UHFFFAOYSA-N	432.502	1.369	50	20	IDGD	
CCCCNC(=O)NNC(=O)c1cc(C2CC2)nc2c1c(C)nn2[C@@H]1CCS(=O)(=O)C1	920823169	STBZUASJWVMGIJ-CQSZACIVSA-N	448.549	1.721	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CN2CCC(CN3C(=O)c4ccccc4C3=O)CC2)c1	1319583844	LIPUTJWLPGSBCW-UHFFFAOYSA-N	434.496	1.764	50	20	IDGD	
O=C(NNC(=O)[C@H]1Nc2ccccc2S(=O)(=O)N1)c1ccc(Br)s1	1322337319	BJRGRYXXIBVEPV-NSHDSACASA-N	431.293	1.002	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnn3ncccc23)C1	1777948399	CHIGJUAMNDBDIU-WRWLIDTKSA-N	435.912	1.111	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2)c1cn2cc(F)ccc2n1	1779026416	OBRLLVXCLNNIAL-RZQQEMMASA-N	438.887	1.201	50	20	IDGD	
CC(C)(C)OC(=O)C(C)(C)CC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1780886695	RNUUROMQRAGFQM-XOBRGWDASA-N	432.945	1.174	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(-n4c(O)nnc4O)cc3)CCO2)C1	1781217381	IOIYNTAOLSBBIQ-QRWLVFNGSA-N	449.895	1.139	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cnc4c(c3)NC(=O)CS4)CCO2)C1	1781219993	UHCBXOAHMWQCBJ-YJYMSZOUSA-N	438.937	1.587	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(OC)n1)C2	1782170946	IKPQCAFGCLUBNA-YYFZDKIDSA-N	425.913	1.472	50	20	IDGD	
C[C@@H](C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@](C)(Cl)CCl)C2)n1cncn1	1782532372	YDQNNRZVCFORLG-MJSCVDMRSA-N	432.352	1.589	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)C3(O)CCC3)[C@H]2C1	1783509648	VRQQJSCICAEHDR-OWYFMNJBSA-N	431.371	1.548	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cn(C(C)(C)C)nn3)CCO2)C1	1783537236	MYXDUDCXPXAQNS-YVEFUNNKSA-N	428.331	1.260	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cn(C)cc3C(F)(F)F)CCO2)C1	1783874995	NHACKHQVWUVNOJ-WMLDXEAASA-N	437.846	1.741	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ncccc3Br)CCO2)C1	1783877017	DKBQGNHMWLIREP-CXAGYDPISA-N	446.729	1.541	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)C[C@H]3CNc4ccccc4O3)CCO2)C1	1783877834	RCURDGKUVVDOKC-CKJXQJPGSA-N	437.924	1.333	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(CCN(C(=O)C3(F)CCC3)C2)C1	1784880896	VMFOSIILSXRHNP-FQEVSTJZSA-N	449.435	1.856	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCNC(=O)c3ccc[nH]3)[C@H]2C1	1785247000	FBINQIDJOXLNQH-ZOBUZTSGSA-N	438.956	1.379	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)Cn3cccn3)[C@H]2C1	1785445245	YOHMSHLRTRBYPX-XAJHFOFHSA-N	441.370	1.672	50	20	IDGD	
CN(C)c1cncc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]32)c1	1785554714	FHAQPOUBMRBTNC-VZYKRBATSA-N	443.375	1.977	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3c[nH]c4ncccc34)[C@H]2C1	1787878070	XMEJYUSVCMSMLR-APYUEPQZSA-N	435.322	1.940	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)c3nc[nH]c3[N+](=O)[O-])CCC2)cc1)c1cccc(B(O)O)c1	1788143681	LXUBWFFVNYOKBB-UHFFFAOYSA-N	449.232	1.059	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)c1cc2n(n1)CCCC2	1788353787	PQXIIRPZHVGRHM-QRTARXTBSA-N	439.354	1.598	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1ccc(C2(NC(=O)[C@H](O)CCl)CCC2)cc1	1789519986	XHCHZBWCPUXZFV-MRXNPFEDSA-N	431.880	1.033	50	20	IDGD	
Cc1nccc(C(=O)NC2(c3ccc(NC(=O)c4cnccc4C(=O)NN)cc3)CCC2)n1	1789521636	SVGOGJZFUWSPNT-UHFFFAOYSA-N	445.483	1.845	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21	1789668438	FRRWGYRYUXCBOS-SIUGBPQLSA-N	431.316	1.542	50	20	IDGD	
Cc1ccc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](O)CCl)C[C@@H]32)cc1[N+](=O)[O-]	1789910302	UWTNRKZKZVGINH-LAQRGFTBSA-N	439.896	1.025	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]2C1	1789921239	DDRTWWFMHZVIRM-UHFZAUJKSA-N	444.139	1.688	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]3C2)nc1C	1789922023	BWKRVTNIATVTLG-DARAHFNDSA-N	428.302	1.982	50	20	IDGD	
CCc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]3C2)cn1	1789922861	WMQHEUSTWYDAIE-QCEMKRCNSA-N	428.302	1.928	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4[nH]ccc4n3)C[C@@H]21)[C@@H](F)Br	1789925739	IKXMLOOQEPPYPK-KUDNYVPYSA-N	439.285	1.847	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3c(F)ccc(O)c3F)C[C@@H]21	1791257269	VRFBMIDKMINZSJ-OHTBPHCPSA-N	432.851	1.518	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CC[C@@H]4CCC(=O)N4C3)C[C@@H]21)C(Cl)Cl	1791296770	ZVEGVOLQDINUSE-RMEBNNNOSA-N	432.348	1.171	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC1(c2ccc(NC(=O)/C=C/c3cnc[nH]3)cc2)CCC1	1791780516	RXWCSCLOUGXERH-VOTSOKGWSA-N	445.483	1.869	50	20	IDGD	
Cc1c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](O)CCl)[nH]c2c(Cl)cccc12	1792978332	QVWFDUHGSFMIRT-RBNVPPIJSA-N	440.327	1.933	50	20	IDGD	
C[C@H](CBr)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](O)NC(=O)OC(C)(C)C)C2	1792990638	BSQIYQCEBFTNDS-VVSAWPALSA-N	448.358	1.499	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ncc(F)cc1F	1793578938	RUMGBTPKDRLLMT-IQOUGMIPSA-N	432.265	1.737	50	20	IDGD	
Cn1c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Cl)cc2c1-c1ncccc1OC2	1796363384	QWZSDHJPIHHVRU-AODNKKSCSA-N	448.882	1.717	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1snnc1C1CC1	1796707537	PCKAYHYZVVUKSC-YVECIDJPSA-N	443.367	1.792	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnn3ccncc13)C2	1796892516	JZNNWMIAZPNWRT-LCFLCXBCSA-N	448.487	1.115	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc3ncccc3[nH]1)C2	1796893519	DBLSCZQFYHLCSM-CWNKPHDYSA-N	447.499	1.949	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1CN(Cc2ccccc2)CCO1	1797853292	CDLLCIOCPUUZNF-HGJUEJDCSA-N	449.979	1.779	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cc1c(F)cccc1F)C2	1798441701	DSNOVOUENPYAHC-BTTYYORXSA-N	443.454	1.458	50	20	IDGD	
COc1cc(OC)cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)Br)C3)c1	1798899334	VJRZIMRLZYYHIJ-MBMVNNNZSA-N	441.322	1.690	50	20	IDGD	
Cc1c(F)ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Br)c1N	1799346582	RWNLZODVWRAJKA-OWLDWWDNSA-N	432.265	1.610	50	20	IDGD	
C[C@H]1CCc2c(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@H](F)Br)n[nH]c21	1799347979	ZXVNIDLIXCBLAS-SGESHLDCSA-N	429.290	1.353	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1cc(O)cc([N+](=O)[O-])c1	1799732897	SIHPRBNRQLAPNL-RDBQEKCUSA-N	446.229	1.194	50	20	IDGD	
CC(C)(C)NCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C#N)=C/c1ccc(F)cc1F	1800332421	KARMRAYZOPMWAD-RNCDSHHQSA-N	446.498	1.849	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cn(C)nc1C(F)F)C2	1800640611	BJXNSHYSIHPAOI-LYIQGSDWSA-N	449.296	1.734	50	20	IDGD	
CC(C)Cc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)Br)n(C)n1	1800756193	HBOIFPSLNNVIJR-VWPFQQQWSA-N	441.370	1.605	50	20	IDGD	
CC(=O)Nc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)Br)ccn1	1800757720	OYUCYDYCIBCFIY-HPAJIGNASA-N	439.310	1.027	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1ON=C(c3ccccc3)O1)C2)C(Cl)Cl	1801017164	URUCGEAZGVRRJY-SJBDTSRBSA-N	428.272	1.114	50	20	IDGD	
CCOC(=O)c1ncn2c1CC[C@H](C(=O)N1[C@H]3CC[C@@H]1C[C@H](NC(=O)[C@H](F)Cl)C3)C2	1801422431	URZKFJQPOLIWRA-LHLGERLTSA-N	440.903	1.795	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1=NO[C@H](c3ccccc3)C1)C2	1802336177	JHTMXLMJURGIMY-DMUMMCEESA-N	441.532	1.515	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2[nH]nc3ncccc23)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803140235	YQKLNFOECUKHRX-JLJPHGGASA-N	428.880	1.272	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC2(CCN(C(=O)CCn3cncn3)CC2)C1	1805388876	DFJBTBDVIASECU-OAHLLOKOSA-N	426.359	1.930	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)C2CCCCC2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807362431	GZJSRWHCRVDWOY-RBBKRZOGSA-N	435.333	1.661	50	20	IDGD	
COc1cc(C(=O)N2CCCC3(CCN(C(=O)[C@@H](F)Br)CC3)C2)n(C)n1	1807526130	BIJDWTIOTDYHIY-CQSZACIVSA-N	431.306	1.964	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)c1c[nH]c2nccc-2c1	1808077838	ROXLFVALYLSTCD-RYQLBKOJSA-N	427.892	1.829	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)c1ccc2nccnc2c1	1809384824	ONACXZXIDSZHNW-FFZOFVMBSA-N	439.903	1.944	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)[C@H]1Cc2ccccc2O1	1809579352	FDWOWAGSRNNBPL-ONCXSQPRSA-N	429.904	1.691	50	20	IDGD	
Cc1cccc(C(=O)N2CCC3(CCCN(C(=O)c4cccc(B(O)O)c4)C3)CC2)c1F	1809977554	IWEBEIVLEMIJND-UHFFFAOYSA-N	438.308	1.973	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)N1CC[C@@H](CNC(=O)CO[Si](C)(C)C)[C@@H]1c1cccnc1	1810541621	LIHSPVOKJXNDIX-BQFCYCMXSA-N	435.601	1.386	50	20	IDGD	
O=C([C@H]1CCc2nc(O)nc(O)c2C1)N1CCC2(CCCN(C(=O)[C@H](F)Cl)C2)CC1	1810899847	VWJHNVLMJUWTJY-WFASDCNBSA-N	440.903	1.758	50	20	IDGD	
Cc1ccn(C)c1C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1811607593	UJPGOOVNIKOLNW-SIKLNZKXSA-N	446.316	1.042	50	20	IDGD	
CC(=O)NCCC(=O)NC[C@@H]1CCN(C(=O)[C@H](C)CBr)[C@@H]1c1cccnc1	1812654542	KTONAXNZOBFDFG-RPVQJOFSSA-N	439.354	1.645	50	20	IDGD	
C=C(C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)C(F)(F)F	1812676688	CKIZKTAKNLUQPC-WMZOPIPTSA-N	447.222	1.200	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)CC(F)(F)C(=O)O)[C@@H]1c1cccnc1	1812865438	YKDWEPLNFXSZPZ-ZKYQVNSYSA-N	448.264	1.981	50	20	IDGD	
CC(=O)N[C@H](C)C(=O)N1CC[C@H](CNC(=O)[C@H](C)Br)[C@H]1c1cccnc1	1812867202	GBNCRUBMZKVSPE-UAXWRAGISA-N	425.327	1.395	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc(-n3ccnc3)ccn2)[nH]n1)[C@@H](O)CCl	1814872980	IILCIHDCHKIYKS-SJORKVTESA-N	443.895	1.896	50	20	IDGD	
Cc1ncsc1C(=O)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1	1815355524	VDEYOVHIXJLOKJ-CYBMUJFWSA-N	442.331	1.127	50	20	IDGD	
COc1ncccc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1816430605	BFULWDZNZFTSNX-SFHVURJKSA-N	449.276	1.113	50	20	IDGD	
CCc1oncc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1	1816607512	WAMZISVTNASKTB-HNNXBMFYSA-N	431.497	1.639	50	20	IDGD	
Cc1cnc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)s1	1817473426	STONJNMPBPOQBZ-INIZCTEOSA-N	439.306	1.474	50	20	IDGD	
CC(C)[C@@H](S)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819401706	PGLHCJQUJBBZEU-NVXWUHKLSA-N	445.549	1.669	50	20	IDGD	
C[Si](C)(C)OCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCN2CCOCC2)[nH]n1	1819593688	QFPPBYHOASWAHV-KRWDZBQOSA-N	437.617	1.976	50	20	IDGD	
COC[C@H](NC(C)=O)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCBr)[nH]n1	1819607711	KBZPQVNUZICWBI-UONOGXRCSA-N	444.330	1.338	50	20	IDGD	
COC[C@@H](NC(C)=O)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)C(C)(C)CCl)CC2	1820183803	GQORNAXQRTURAT-WCQYABFASA-N	430.958	1.471	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](F)Cl)CC2)c1cc(=O)nc2sccn12	1821153470	SPQZCAJQEOKYDQ-MADCSZMMSA-N	441.897	1.973	50	20	IDGD	
COc1cc(OC)cc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@@H](O)CCl)CC3)c1	1822110426	IKOUJVRBRCACCA-ABAIWWIYSA-N	439.921	1.986	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)C(F)(F)Cl)n[nH]1	1822568396	RPARVZFNJUCPNZ-GFCCVEGCSA-N	441.826	1.546	50	20	IDGD	
COCCn1ccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)[C@@H](O)CCl)CC2)n1	1824182755	JECFBWCZTCIPAP-MSOLQXFVSA-N	426.945	1.363	50	20	IDGD	
CCC(=O)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1)CC2	1825087069	BGOMMNALRTYOFZ-QPDIMOPTSA-N	430.490	1.168	50	20	IDGD	
O=C(CN1CCCCC1=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](F)Br)CC2	1825865735	MXFZJMGTZYNKSU-OTYXRUKQSA-N	447.330	1.758	50	20	IDGD	
Cc1nc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)co1	1825953379	BUORETKUMFZNLU-HXUWFJFHSA-N	425.294	1.210	50	20	IDGD	
Cc1ccc(C)c(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2ccc(B(O)O)cc2)CC3)c1	1827551558	QHIYTERMBFEZEI-KRWDZBQOSA-N	449.341	1.979	50	20	IDGD	
C[C@@H]1CC[C@H](C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)O1	1828405154	IIXCUXYZKDLCFA-UIAACRFSSA-N	443.548	1.486	50	20	IDGD	
C[C@H](C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2)N1C[C@H]2C[C@H]2C1	1830362000	IFIGXRPKEICFIP-PZTGFMGMSA-N	427.973	1.048	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3nccs3)C2)C1	1830537082	BFNGRCBQGBSRCQ-BLLLJJGKSA-N	432.340	1.244	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3n[nH]c4c3CC[C@@H]4C)C2)C1	1831646860	NKRFXFSNCGOTFC-WDUKFBBWSA-N	438.956	1.937	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cn4ccsc4n3)C2)C1	1831650916	MHADXTCYUNRMQJ-AUUYWEPGSA-N	440.953	1.873	50	20	IDGD	
COc1cc(C(=O)N2CCC([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)nn1C	1831874381	OAXMTYIAGGEFFN-GOSISDBHSA-N	448.568	1.035	50	20	IDGD	
N[C@@H](CC(=O)NC1CCN(C2CCN(C(=O)C(Cl)Cl)CC2)CC1)c1cccnc1	1834765299	XZTAXVVDHGVZPK-KRWDZBQOSA-N	442.391	1.847	50	20	IDGD	
Cc1ccc(CC(=O)N2CCOC[C@]3(CN(C(=O)CCBr)CCO3)C2)cn1	1834819231	KWEVGGKCJSTDJQ-IBGZPJMESA-N	440.338	1.174	50	20	IDGD	
C[C@H](Nc1cnccn1)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](F)Cl)CC2)CC1	1835084082	KDUSFERPRIAAHK-SUMWQHHRSA-N	426.924	1.383	50	20	IDGD	
Cn1cc(CC(=O)N2CCC(N3CCC(NC(=O)CO[Si](C)(C)C)CC3)CC2)cn1	1835837936	TVWCEWQDWYMTDU-UHFFFAOYSA-N	435.645	1.386	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@H](F)Br)CC2)CC1	1836414416	JUBCAFLINTZCOP-KBPBESRZSA-N	442.757	1.502	50	20	IDGD	
O=C([C@H](F)Cl)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1[C@H]3Sc4ccccc4[C@@H]31)CCO2	1837473903	XSASHSQUPQWACP-ZPFYTHJMSA-N	440.924	1.865	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)c3ccc(F)cn3)CC2)CC1	1837558081	HYKXVMYGHOARLT-UHFFFAOYSA-N	449.527	1.206	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)CCn3ccnn3)CC2)CC1	1838773573	OJOQAWAJHLBDKY-AWEZNQCLSA-N	442.358	1.450	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc4c3NC(=O)C4)CCO2)C1	1839572222	MHKGJVFFASDHCY-JTSKRJEESA-N	449.935	1.659	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccoc3C)C2)C1	1839963588	PIEUQIFWGKTDLF-MAUKXSAKSA-N	429.311	1.832	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(O)ccc3F)C2)C1	1840034808	XSTCCSRBMZQQTD-XIKOKIGWSA-N	445.285	1.385	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)ccc1F	1840035006	CXDZVQHWAYRAAD-LIRRHRJNSA-N	443.313	1.988	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3nc(C)sc3C)C2)C1	1840150866	SIHWPYUJULJDBK-HNAYVOBHSA-N	445.969	1.013	50	20	IDGD	
O=C(c1ccc(CO)c(F)c1)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840190090	CVMCWGLHGZEIOS-SFHVURJKSA-N	435.279	1.192	50	20	IDGD	
C[C@H](Cc1ccccn1)C(=O)N1CCOC[C@@]2(CN(C(=O)C(Cl)Cl)CCO2)C1	1840190763	LNJMKKHWSGZFPQ-KUHUBIRLSA-N	430.332	1.520	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@H]2CCN(C(=O)OC(C)(C)C)C[C@H]2O)C1	1841028063	SDJVOMDNUNRSOC-HRCADAONSA-N	443.972	1.825	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(F)(C(=O)N2CCCC23CN(C(=O)[C@@H](O)CCl)C3)CC1	1841077584	LJVHZMHPEUKMEK-AWEZNQCLSA-N	447.935	1.529	50	20	IDGD	
C[C@H]1[C@@H](C(=O)N2CC3(CCCN3C(=O)[C@H](O)CCl)C2)CCN1C(=O)OC(C)(C)C	1841354503	FBJHAIQTBUGLIJ-SOUVJXGZSA-N	429.945	1.435	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)Cn2cc(C)cn2)C1	1843099490	URGZYYOTHLROJD-UHFFFAOYSA-N	441.444	1.542	50	20	IDGD	
O=C(c1nccn(Cc2ccc(F)cc2)c1=O)N1CC2(CCCN2C(=O)[C@@H](F)Cl)C1	1843363240	VXQQHYMNYBSAHD-MRXNPFEDSA-N	436.846	1.782	50	20	IDGD	
N#Cc1ccc(C(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)c(Cl)c1	1844265144	YJTGFLXPLCUIBZ-UHFFFAOYSA-N	438.875	1.341	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)C[C@@H](NC(=O)OC(C)(C)C)C(=O)OC)C2	1845167687	PBIQAEIPZDFQGG-UONOGXRCSA-N	445.944	1.664	50	20	IDGD	
CS(=O)(=O)c1ccc(CC(=O)N2CC3(CCCN3C(=O)[C@@H](F)Br)C2)cc1	1845217286	QCEGVLSOUVXMHD-OAHLLOKOSA-N	447.326	1.527	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)COc2ccc3c(c2)CCC3)cc1OC	9449575	RKEKYMFIIZCSHX-UHFFFAOYSA-N	428.441	1.576	50	20	IDGD	
O=C(CCn1c(=O)[nH]c(=O)c2ccccc21)NNC(=O)CSc1ccc(Cl)cc1	17185638	YRTGRQZAHQLPPG-UHFFFAOYSA-N	432.889	1.673	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)OCC(=O)NNC(=O)c2cccs2)c1C	213562404	GIIOKNFKLBCCPA-YBEGLDIGSA-N	430.486	1.724	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)CC23C[C@H]4C[C@@H](CC(O)(C4)C2)C3)cc1	226658891	RDJCOJKFGIMBMZ-WZGNDQMWSA-N	449.573	1.484	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)CCCN3S(C)(=O)=O)cc1C	726281149	CGCLYJLQPMYJSI-UHFFFAOYSA-N	444.513	1.415	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)NCc1cccc(C(=O)NCCN(C)C)c1	727604217	SDVUKOKMONYLRI-HNNXBMFYSA-N	445.495	1.415	50	20	IDGD	
CCCS(=O)(=O)Nc1ccc(C(=O)NNC(=O)Cc2nc3ccccc3n2C)cc1	728018275	ILDCNMGVJOLPLY-UHFFFAOYSA-N	429.502	1.729	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)[C@@H]2CCCN(S(=O)(=O)c3ccccc3)C2)c(C)c1	728205351	BZSKJQAEIUNQHO-GOSISDBHSA-N	444.557	1.964	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2cccc(OC(F)F)c2)cc1	728595736	TXBBGSBBSHWHNG-UHFFFAOYSA-N	442.444	1.683	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)Cc2c(C)nc3nc(N)nn3c2C)c1	728609176	QSXQTLUHMUTDIL-UHFFFAOYSA-N	448.281	1.098	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)nnn1-c1ccccc1Cl	728812276	SSGCLUTWUYYGAO-UHFFFAOYSA-N	433.877	1.707	50	20	IDGD	
CCCc1ccc(S(=O)(=O)N2CCN(C(=O)NNC(=O)Cc3cccnc3)CC2)cc1	728957489	WMFLVPMRUICKSP-UHFFFAOYSA-N	445.545	1.324	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)NC[C@@H]3CCCO3)c2)c1	728977706	XXJZQBWDZGLIME-KRWDZBQOSA-N	428.470	1.090	50	20	IDGD	
CSC[C@H](C(=O)NNC(=O)Cn1ccc2ccccc21)N1C(=O)[C@H]2CCCC[C@H]2C1=O	729448430	QUEIDHVHFMOYOK-SOLBZPMBSA-N	442.541	1.696	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(N2CCCC2)c(C(=O)NNC(=O)Cc2cc[nH]n2)c1	730091659	RYOZJQVVHQXAKM-UHFFFAOYSA-N	448.549	1.044	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)[C@H]2CCN(c3ccc4c(c3)OCCO4)C2=O)cc1	730590801	YQBOOWGCKOWIGV-GOSISDBHSA-N	439.468	1.600	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)N1CCC(NS(=O)(=O)c2ccc(F)cc2)CC1	731849057	RCGOSFFZBJPFEX-CQSZACIVSA-N	428.530	1.150	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCCCNC(=O)c2cccc(F)c2)cc(OC)c1OC	732236567	RZCVXHKIORVKRP-UHFFFAOYSA-N	448.451	1.616	50	20	IDGD	
COCCS(=O)(=O)CC(=O)NNc1nc2ccccc2c(=O)n1-c1ccc(C)cc1C	733265365	OKTUPFGYDLYKSY-UHFFFAOYSA-N	444.513	1.507	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1)N[C@@H]1CCN(C2CC2)C1	734284936	BYANKHHQVZPICZ-LJQANCHMSA-N	446.515	1.569	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)N[C@H]2CCN(CCN3CCOCC3)C2)c1C	734467988	NTGRJDIJTVEZFF-GYZZIOIESA-N	429.565	1.181	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)NCc2cc(S(N)(=O)=O)ccc2F)c1C	734674526	XLMMWNUFQKISGS-ZDUSSCGKSA-N	438.481	1.388	50	20	IDGD	
CCC(CC)N1C[C@H](C(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)CC1=O	734825343	ZAAIYLLEQKHVGN-CQSZACIVSA-N	439.557	1.753	50	20	IDGD	
CC(C)Oc1cccc([C@@H](O)CNC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c1	735088691	JFRCLZMGAQSITL-SFHVURJKSA-N	425.449	1.127	50	20	IDGD	
CN(C)N(C(=O)Cc1ccc(S(=O)(=O)CC(F)(F)F)cc1)[C@H]1CCS(=O)(=O)C1	736458041	CUWHLPFONMBUSO-ZDUSSCGKSA-N	442.481	1.057	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)c2c(C)oc3ncn(C)c(=O)c23)cc1C	736767100	VNWQKYMANIYIRT-UHFFFAOYSA-N	432.458	1.385	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)c1ccc(N2CCCS2(=O)=O)cc1C	743282589	PCXOPAWCQOKMBY-UHFFFAOYSA-N	431.514	1.937	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)N[C@H]1CC(=O)N(CCOc2ccccc2)C1	745847552	OWJGRYHXUMVZFF-HOTGVXAUSA-N	444.463	1.603	50	20	IDGD	
O=C(CSCC(=O)Nc1cccc(Br)c1)NNC(=O)N1CCOCC1	746519618	LWQCMOHWSGLNJH-UHFFFAOYSA-N	431.312	1.194	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)NNC(=O)Cc3cn4ccccc4n3)cc2C1	747490258	HHPYXYFJBHUYGM-GFCCVEGCSA-N	426.502	1.739	50	20	IDGD	
Cc1nn(Cc2cccc(Br)c2)c(C)c1C(=O)NNC(=O)C(=O)NC1CC1	747905488	CPYAPVSCWPHVIG-UHFFFAOYSA-N	434.294	1.350	50	20	IDGD	
CS(=O)(=O)CC[C@H](NS(=O)(=O)c1ccccc1)C(=O)NNc1ccc(Cl)cc1	749274165	IVHOWFCYTXUAPX-INIZCTEOSA-N	445.950	1.565	50	20	IDGD	
O=C(NCCc1ccc(O)cc1)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	749346734	HFRSZWUBFDAZKE-UHFFFAOYSA-N	432.502	1.363	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCN(c3cc(F)ccc3F)CC2)cc1OC	750072198	PPSXHLWZQHEIOL-UHFFFAOYSA-N	434.443	1.565	50	20	IDGD	
O=C(COC(=O)CC12C[C@H]3C[C@@H](CC(O)(C3)C1)C2)NNC(=O)c1cccc([N+](=O)[O-])c1	750512206	FAJORBZODAYLAJ-RKOMNEFPSA-N	431.445	1.620	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)c1ccc(F)c(NS(C)(=O)=O)c1	750716953	USWSHWRMOHUNAB-UHFFFAOYSA-N	425.438	1.436	50	20	IDGD	
NS(=O)(=O)c1cc(Cl)c(F)c(C(=O)NNC(=O)c2cccc(OC(F)F)c2)c1	752294565	YMPUQNKGKZOKIW-UHFFFAOYSA-N	437.783	1.803	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)N[C@H]1CCN(Cc2ccc(C#N)cc2)C1=O	753291993	MBPHXZNNONBKKD-KRWDZBQOSA-N	427.486	1.389	50	20	IDGD	
C[C@H]1CC/C(=C\C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)C1	753573662	QOZXZFXAQMZYTR-XIGQLOAZSA-N	435.546	1.534	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)N1CCC[C@@H](S(=O)(=O)N2CCc3ccccc32)C1	754189112	YPFXDPXHGPUEJP-GOSISDBHSA-N	443.529	1.222	50	20	IDGD	
O=C(NNC(=O)c1ccc2nc[nH]c2n1)c1cccc(S(=O)(=O)N2CCCCC2)c1	754828500	IFBBXHYRVQSQKW-UHFFFAOYSA-N	428.474	1.207	50	20	IDGD	
Cc1cc(C)cc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c1	755382942	KGUDWLSRBGLSKZ-UHFFFAOYSA-N	432.502	1.791	50	20	IDGD	
COC(=O)CCNC(=O)c1ccc(NC(=O)NNC(=O)c2cc3c(s2)CCC3)cc1	755604361	PYBGZKMUTGSELP-UHFFFAOYSA-N	430.486	1.996	50	20	IDGD	
CCOCCCNC(=O)c1cccc(NC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1	755956248	KFBPSQGWCBLWAM-IBGZPJMESA-N	442.472	1.836	50	20	IDGD	
CNC(=O)c1ccc(NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1Cl	756140751	WNGZINXRSGWRQI-UHFFFAOYSA-N	428.836	1.413	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2ccc(N3CCOC3=O)cc2)c2ccccc2c1=O	756157148	AGHRMNQTARSYCJ-UHFFFAOYSA-N	436.428	1.840	50	20	IDGD	
CS(=O)(=O)Cc1cccc(NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1	756270095	UPIWYVAPYYEBAO-UHFFFAOYSA-N	432.506	1.091	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)Nc2ccn(CCN3CCOCC3)n2)c1C	756647838	VWPXJVNSSHAFKT-KRWDZBQOSA-N	430.509	1.452	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)CN2C(=O)NC3(C[C@@H](C)C[C@H](C)C3)C2=O)c(C)c1	757732140	GYVKICDMKQJRDD-GJZGRUSLSA-N	429.521	1.609	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1Cl	757738239	NAZXGPUBUNVQRE-MRXNPFEDSA-N	435.820	1.885	50	20	IDGD	
Cc1nn([C@H]2CCS(=O)(=O)C2)c(C)c1NC(=O)NNC(=O)c1cc(Cl)ccc1O	757871901	QUFPRYXYUHXHGQ-LBPRGKRZSA-N	441.897	1.685	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)CCc1ncc(-c2ccc(Cl)cc2Cl)o1	758035214	KFJOPMGYNABEAY-VIFPVBQESA-N	449.316	1.666	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2ccc(Cl)c(C#N)c2)CC1	758171774	ZTOZCLXBYJIDBD-UHFFFAOYSA-N	434.909	1.300	50	20	IDGD	
O=C(c1cnn(-c2ccc(Cl)cc2)n1)N1CCN(S(=O)(=O)CBr)CC1	758528921	ZYAYBWDMTSCCCA-UHFFFAOYSA-N	448.730	1.361	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCN(c2cc(Cl)ccc2Cl)C1=O)C(=O)Nc1ccccn1	758831612	RNJGVBDEDKHNDA-NSHDSACASA-N	436.255	1.527	50	20	IDGD	
Cc1ccc(CNC(=O)NNC(=O)C(=O)Nc2ccccn2)c(OC[C@H]2CCCO2)c1	758846123	URYWPOIWJKADJL-MRXNPFEDSA-N	427.461	1.417	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCCC(=O)NNC(=S)Nc1ccccn1	760826116	WCZXSXHMZDNPRV-ZDUSSCGKSA-N	436.538	1.305	50	20	IDGD	
CC(=O)Nc1cc(C(=O)NNC(=O)CCN2C[C@H](C)O[C@H](C)C2)cc(C(F)(F)F)c1	760988558	RQOJEYNJHGIZMO-TXEJJXNPSA-N	430.427	1.924	50	20	IDGD	
COc1cc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc2c1O[C@@H](C)C2	761073358	ZCTNUSAXGJYDRM-SGTLLEGYSA-N	442.424	1.163	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C2=CC=CN3CCS(=O)(=O)N=C23)c(C)n1-c1ccccc1	761632719	JNNSHSWVDKBSLD-UHFFFAOYSA-N	439.497	1.353	50	20	IDGD	
COc1ccc2c(c1)[C@@H](C(=O)NNC(=O)CN1CCN(Cc3ccc(C)cc3)CC1)CC2	762089028	XMADMFDOGAEDDT-QFIPXVFZSA-N	436.556	1.999	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)[C@@H](C)NS(=O)(=O)c1cccs1	762370073	GPNHDELNZITRLS-LLVKDONJSA-N	429.545	1.363	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NN=C(C)c1c(C)nn(CCS(C)(=O)=O)c1C	763138645	ITZAAGGRCFUQOI-UHFFFAOYSA-N	444.561	1.997	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccccn2)nn1CCCOc1ccc(F)cc1	763462715	AXLZWVJYUDSIOH-UHFFFAOYSA-N	440.435	1.594	50	20	IDGD	
CCC(=O)Nc1ccc(Cl)c(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)c1	763547407	AWAVUPGMWBRQDM-UHFFFAOYSA-N	432.820	1.817	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)C(=O)Nc1ccc(CCN2CCCCC2)cc1	763551184	KUNPFOHMLVBKFJ-UHFFFAOYSA-N	438.484	1.843	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2ccc(O[C@H]3CCOC3)cc2)c1	763647851	QCXZTVOXXBAWOO-SFHVURJKSA-N	427.457	1.636	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccccc1S(=O)(=O)C(C)C	763648924	YNRZFSRTXKJTSI-UHFFFAOYSA-N	449.485	1.042	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(N2CCCC2)cc1C	763656817	DXQUHXLHCIJDOK-UHFFFAOYSA-N	426.473	1.769	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2cc(Cl)ccc2F)c1	763718870	PVUGZXOEOGHTFH-UHFFFAOYSA-N	442.856	1.129	50	20	IDGD	
O=C(NNC(=O)c1cccc(Cl)c1)C(=O)Nc1ccc(NC(=O)[C@@H]2CCCO2)cc1	763753419	VUYNJZKKDJJGQN-INIZCTEOSA-N	430.848	1.857	50	20	IDGD	
CSc1ccc(NC(=O)C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1Cl	763789740	BPVMWYMQWGVOHK-UHFFFAOYSA-N	445.888	1.709	50	20	IDGD	
COC(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)c1	763866000	MYZDDSVSPMPGFO-JTQLQIEISA-N	437.811	1.819	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cccc(-n3cccn3)c2)cc1	763873616	WQDDFJRECTWXTE-HNNXBMFYSA-N	435.440	1.628	50	20	IDGD	
COC(=O)c1ccc(F)c(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(C(C)=O)cc2)c1	763878624	SCDBNROEUKBKJB-LBPRGKRZSA-N	445.403	1.368	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccc(C)c(OCC3CCOCC3)c2)n1	763891743	SDAMAICTGOZWPC-UHFFFAOYSA-N	443.504	1.400	50	20	IDGD	
Cc1cnc(-c2cccc(NC(=O)C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)c2)o1	763921590	MFARGJLINRFEGU-UHFFFAOYSA-N	432.400	1.025	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)C(=O)Nc1ccnn1Cc1ccccc1	763944607	NNWRJORVHFVYBA-UHFFFAOYSA-N	445.439	1.222	50	20	IDGD	
Cc1cc(S(N)(=O)=O)cc(NC(=O)C(=O)NNC(=O)c2cccc3ccccc23)c1C	764050674	HHAJUWXLCVTQDO-UHFFFAOYSA-N	440.481	1.504	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2O1)C(=O)N1CCc2ccc(Br)cc21	764155307	YADFWYJMWRXXLY-MRXNPFEDSA-N	430.258	1.489	50	20	IDGD	
O=C(CCOc1ccccc1)NNC(=O)C(=O)Nc1cnn(-c2cnc3ccccc3n2)c1	764161740	UQFYGNBTBXIYFP-UHFFFAOYSA-N	445.439	1.371	50	20	IDGD	
CCOc1cc(N2CCN(C)CC2)ccc1NC(=O)C(=O)NNC(=O)CCc1ccco1	764177298	MQWAUDXLRLYVDE-UHFFFAOYSA-N	443.504	1.149	50	20	IDGD	
CN(C)CC(=O)NNC(=O)C(=O)Nc1cc2c(cc1Sc1ccccc1)OCCO2	764204776	UNDJQEGQSLHMAG-UHFFFAOYSA-N	430.486	1.257	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)C(=O)Nc1cccc(C[S@](=O)c2ccccc2)c1	764267866	KNSYZHSMQMXZCV-HKBQPEDESA-N	436.493	1.718	50	20	IDGD	
COC(=O)c1ccc(OC(C)C)c(NC(=O)C(=O)NNC(=O)COc2ccccc2O)c1	764276853	COOQVOBAYURMHH-UHFFFAOYSA-N	445.428	1.131	50	20	IDGD	
COC(=O)[C@@H](C)Cc1ccc(NC(=O)C(=O)NNC(=O)CCc2ccccc2O)cc1	764287856	BHCCXMPZLMOYAS-AWEZNQCLSA-N	427.457	1.463	50	20	IDGD	
CC(C)n1nnnc1-c1ccccc1NC(=O)C(=O)NNC(=O)Cc1ccccc1F	764320441	XYYRWCMIGHUVOF-UHFFFAOYSA-N	425.424	1.389	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)ccc1F	764328927	CBJLUISWTSXOAM-UHFFFAOYSA-N	442.419	1.661	50	20	IDGD	
COC[C@@H](C)n1c(C)cc(/C=C(\C#N)C(=O)NNC(=O)CNC(=O)c2cccnc2)c1C	764344215	UZQUTZFFUJHTJM-VTNJTDAWSA-N	438.488	1.192	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)C(=O)Nc2cc(I)ccc2Cl)cn1	764359209	MNCQITXZTBSLIG-UHFFFAOYSA-N	447.620	1.078	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc4n[nH]cc4c3)n[nH]2)cc1OC	764378009	GCKHHSSEISIHRM-UHFFFAOYSA-N	449.427	1.370	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1cnn(CC(F)(F)F)c1	764392179	BYDDJJWGWBCOHK-UHFFFAOYSA-N	431.396	1.332	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1cccc(Cl)c1Oc1cccnc1	764400627	QTKUUUUKCKSDMD-LBPRGKRZSA-N	436.852	1.665	50	20	IDGD	
COc1nccnc1NNC(=O)[C@@H](CCSC)NS(=O)(=O)c1ccccc1F	764481898	NSTCANLJJLCURE-GFCCVEGCSA-N	429.499	1.168	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1)c1cccc(N2CCCS2(=O)=O)c1	765617002	CHYBKJSFDNVZID-UHFFFAOYSA-N	443.460	1.831	50	20	IDGD	
CCCCS(=O)(=O)c1ccc(C(=O)NNC(=O)CCN2C[C@H](C)O[C@H](C)C2)cc1	765817869	TUCBYZVCPMIINJ-IYBDPMFKSA-N	425.551	1.521	50	20	IDGD	
CC[C@@H](Oc1cccc(C)c1)C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	766648525	HJRLZOUGHHWPMU-OAQYLSRUSA-N	438.528	1.758	50	20	IDGD	
CC(=O)N1C[C@@H](C(=O)OCC(=O)NNC(=O)Cc2ccccc2C)Oc2ccccc21	767258516	CSGFBEKJLRGHML-IBGZPJMESA-N	425.441	1.042	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)[C@@H](C(C)C)N1C(=O)c2ccccc2C1=O	768640760	NIYDOPNMLFQMJG-GOSISDBHSA-N	445.497	1.863	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)c1ccccc1COC1CCOCC1	769209878	JBVDDQRXKROSRH-UHFFFAOYSA-N	436.509	1.851	50	20	IDGD	
C[S@](=O)c1cccc(C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)c1	770247608	UHWPFZLBGMILGL-PMERELPUSA-N	448.976	1.656	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)c3nn(-c4ccc(F)c(F)c4)c4c3CCC4)nc21	770983107	LHEDEUOEGWOEAF-UHFFFAOYSA-N	426.387	1.778	50	20	IDGD	
CO[C@H](c1ccc(F)cc1)[C@@H](C)NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	771434577	PLBKRLONPMQWLV-XIKOKIGWSA-N	427.436	1.793	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)CNC(=O)c2ccc(Br)cc2)nc1C	771448626	LKWHSNWCSMRWBD-UHFFFAOYSA-N	436.266	1.597	50	20	IDGD	
Cc1nc2nc(N)nn2c(C)c1CCC(=O)NNC(=O)[C@@H](C)Oc1cccc(Cl)c1	772967651	PDKZNPOSXFMSJM-GFCCVEGCSA-N	431.884	1.524	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)Cc2csc(NC(=O)c3cccs3)n2)c1	773086186	BWCOPKHACDRHKD-UHFFFAOYSA-N	444.498	1.814	50	20	IDGD	
Cc1ccc(-n2nc(C)cc2NC(=O)C(=O)NNC(=O)c2cccc(C(F)(F)F)c2)nn1	773500650	VBLAHWILBUQVKS-UHFFFAOYSA-N	447.377	1.698	50	20	IDGD	
O=C(COc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1ccc(Br)cn1	773525113	KFYZULFBVOPGOE-UHFFFAOYSA-N	427.642	1.662	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1)NNc1ccc(C(F)(F)F)cn1	775249200	HHGHGHCVZLJVNP-UHFFFAOYSA-N	433.368	1.820	50	20	IDGD	
CC[C@H]1Oc2cc([C@H](C)NCC(=O)NNC(=O)Cc3nc(C)cs3)ccc2NC1=O	775462938	GPGSJRBUXPORGW-SWLSCSKDSA-N	431.518	1.602	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NCc2nc3cccc(Cl)c3n2C)c2ccccc2c1=O	776184712	LROHJESPDMLSHZ-UHFFFAOYSA-N	439.863	1.618	50	20	IDGD	
O=C(NNC(=O)N1CC[C@@](O)(c2ccc(F)cc2)C1)c1csc(N2CCOCC2)n1	776885731	RQAXZIXFDUEVGD-IBGZPJMESA-N	435.481	1.067	50	20	IDGD	
COc1ccc(C2(C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)CCCC2)cc1OC	777275278	LTTAQFZBPLKTQI-UHFFFAOYSA-N	436.472	1.953	50	20	IDGD	
COC(=O)c1ccccc1NNC(=O)c1ccc(S(=O)(=O)NC[C@@H]2CCCO2)cc1	777773137	UFLXVMBFVQHTTK-HNNXBMFYSA-N	433.486	1.687	50	20	IDGD	
CCc1c(C(=O)N2CCN(S(=O)(=O)CBr)CC2)cnn1-c1ccccc1	777831621	FRRAQSZNAJJLQS-UHFFFAOYSA-N	441.351	1.875	50	20	IDGD	
O=C(NNc1ncc(C(F)(F)F)cc1Cl)C(=O)Nc1cnn(-c2ncccn2)c1	782854123	NGKLUTWCVMYBOT-UHFFFAOYSA-N	426.746	1.811	50	20	IDGD	
Cc1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)c1sc(N2CCOCC2)nc1C	782895956	BBXIYTYJUFUCMG-UHFFFAOYSA-N	437.909	1.650	50	20	IDGD	
C=CCOc1cccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)c1	783263083	HEEQOTZSKDIJLP-UHFFFAOYSA-N	433.490	1.415	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NC[C@H]1CCCCS1(=O)=O	784176314	NMTVYHMAHQACJA-SMDDNHRTSA-N	448.339	1.514	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)F)cc1)C(=O)Nc1ccc(-c2ncon2)cc1	784834829	ATOWDMVOELNSNU-UHFFFAOYSA-N	437.384	1.815	50	20	IDGD	
COc1ccc(S(=O)(=O)C(F)(F)F)cc1NC(=O)C(=O)NNc1ccnc(F)c1	784847151	OPJBILFWXUWUHX-UHFFFAOYSA-N	436.343	1.605	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)C(=O)Nc1ccc(OCc2ccncc2)cc1	785061631	ZJMCJWWPVKAROF-UHFFFAOYSA-N	444.451	1.637	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1ccc(-c2ncon2)cc1	785330385	GSHDPCNSTZTSOE-UHFFFAOYSA-N	431.430	1.231	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNc2c(OC)cccc2S(C)(=O)=O)cc1	785331655	XVZFXNIZUNHXAP-UHFFFAOYSA-N	437.474	1.206	50	20	IDGD	
O=C1CC[C@@H](C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)c2ccccc21	786260838	PGWMUSPQWKYXSA-QGZVFWFLSA-N	429.498	1.911	50	20	IDGD	
COC(=O)CC1(CC(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)CCCC1	786689522	VPWULFJVKGBPGX-UHFFFAOYSA-N	431.898	1.262	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCC[C@@H](NC(=O)OC(C)(C)C)C2)cc1OC	787353142	UDIKTTMJYYZYAX-OAHLLOKOSA-N	436.509	1.454	50	20	IDGD	
CN1CCN(C(=O)NNC(=O)c2ccc3c(c2)C(=O)N(CCc2ccccc2)C3=O)CC1	788164405	ANSRMLVZVUOXFE-UHFFFAOYSA-N	435.484	1.127	50	20	IDGD	
Cc1nn(-c2ccc(C(=O)NNC(=O)N3CCN(C)CC3)cc2)c(C)c1Br	788168811	DPLVXJXJXLLRGI-UHFFFAOYSA-N	435.326	1.853	50	20	IDGD	
Cc1nnnn1[C@@H](Cc1cccc(F)c1)C(=O)NNc1nnc(-c2ccccn2)s1	788560437	OJKNUFCVGNFODQ-HNNXBMFYSA-N	425.453	1.961	50	20	IDGD	
O=C(NN=Cc1ccc(Cl)c(I)c1O)[C@@H]1CCS(=O)(=O)C1	788708634	KPCFNYGGGWORAY-MRVPVSSYSA-N	442.662	1.535	50	20	IDGD	
O=C(NNc1nc2ccccn2n1)c1cccc(C(=O)NNc2nc3ccccn3n2)c1	791263756	MADFAUDFEDYIMR-UHFFFAOYSA-N	428.416	1.286	50	20	IDGD	
COc1ccc(OC)c(C2=NO[C@H](C(=O)NNC(=O)c3cc(Br)c[nH]3)C2)c1	792026605	YUMVVOFHQNWEQD-HNNXBMFYSA-N	437.250	1.749	50	20	IDGD	
O=C(NCCCCn1cc(Br)cn1)NNC(=O)[C@H]1COc2ccccc2O1	792220686	LDRIMOPRLKFXHZ-OAHLLOKOSA-N	438.282	1.596	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)NC2CCN(S(=O)(=O)Cc3ccccc3)CC2)n1	793031798	NUMUXBRJMTVEBN-UHFFFAOYSA-N	431.518	1.328	50	20	IDGD	
CNS(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)c2cccc3ncccc23)cc1C	794587231	IOGLVKYMGHURTQ-UHFFFAOYSA-N	434.499	1.075	50	20	IDGD	
Cc1cccc2c(=O)n(CCC(=O)NNc3ccccc3S(=O)(=O)N(C)C)cnc12	795169681	SQRBUEXHRPKAOL-UHFFFAOYSA-N	429.502	1.489	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCC[C@H]2COC(=O)NC2CCCCC2)n1	796678139	HPVOKVHLUOBWNZ-INIZCTEOSA-N	437.566	1.665	50	20	IDGD	
COC(=O)c1cc(F)c(Br)cc1NC(=O)C(=O)NNC(=O)c1cccnc1	796992562	WUKRRQFUVAGNTL-UHFFFAOYSA-N	439.197	1.170	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)c1cn2c(n1)CCCC2	799696551	ZCGZYSUFCRMDSH-UHFFFAOYSA-N	430.940	1.452	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CCc2c(C)[nH]c(-c3ccncc3)nc2=O)cc1	801108491	NYVRMXRTOGDUDI-UHFFFAOYSA-N	434.456	1.167	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cn(-c3ccc(C(F)(F)F)cn3)nn2)cc1	801108496	CCIIUEHUTBRODH-UHFFFAOYSA-N	433.350	1.389	50	20	IDGD	
CC(C)(C)c1cnc(CCC(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)o1	801634690	QSBOFKXRNVBKCH-UHFFFAOYSA-N	441.532	1.510	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)CCC(=O)N2CCN(c3ncccn3)CC2)c(Cl)c1	802051018	KZIQFRAGIOMYSR-UHFFFAOYSA-N	445.911	1.720	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)N2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)cc1	805026853	DJLXPCTVLQPFIG-JOCHJYFZSA-N	432.528	1.805	50	20	IDGD	
COc1ccc(CS(C)(=O)=O)cc1NC(=O)NNC(=O)[C@@H](C)Oc1ccc(F)cc1	806638575	KTCGKJTWRFWVPW-GFCCVEGCSA-N	439.465	1.999	50	20	IDGD	
O=C1COC[C@@H](C[C@H]2CN(C(=O)C(=O)NNc3cc(F)c(F)cc3F)c3ccccc32)N1	807014042	PCPKXHWVNADGMG-NWDGAFQWSA-N	448.401	1.583	50	20	IDGD	
COc1ccc(Cn2ncc(C)c2NC(=O)C(=O)NNc2ncccc2F)cc1OC	807302157	YCGJUKUFBFOGJR-UHFFFAOYSA-N	428.424	1.873	50	20	IDGD	
CCOc1cc(Br)c(F)cc1NC(=O)C(=O)NNc1ccnc(N(C)C)n1	810398978	QKAZRUGUYSCCJI-UHFFFAOYSA-N	441.261	1.925	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)N3CCN(c4ccccc4)CC3)n[nH]2)cc1C	812534208	KKSIIVVPWLVNMA-UHFFFAOYSA-N	446.511	1.803	50	20	IDGD	
CCOc1ccc(N2C[C@H](C(=O)NNc3ccc(S(=O)(=O)N(C)C)cc3)CC2=O)cc1	812728686	VKEKKVHZLMXOIA-OAHLLOKOSA-N	446.529	1.832	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)cc1)C1CC1	815567671	HFXCOAFWMOPQSL-UHFFFAOYSA-N	448.277	1.692	50	20	IDGD	
COC(=O)c1cc(NNC(=O)c2ccc(S(=O)(=O)NC[C@@H]3CCCO3)cc2)ccc1C	816687765	NSSMGPJJFXDJAG-KRWDZBQOSA-N	447.513	1.996	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)c2ccc(Br)c(S(=O)(=O)N(C)C)c2)n1	877458427	SWDKXOBJODBOHQ-UHFFFAOYSA-N	428.312	1.863	50	20	IDGD	
CC(C)NS(=O)(=O)c1cc(C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)ccc1F	914882165	XBVZOHQGUPKEGR-UHFFFAOYSA-N	445.476	1.977	50	20	IDGD	
CCc1ccc([C@H](CNC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)N(C)C)cc1	915901032	CQKZWIGVYNBBSI-IBGZPJMESA-N	436.516	1.743	50	20	IDGD	
COc1ccccc1OCC(=O)NN=Cc1c(C)nn([C@H]2CCS(=O)(=O)C2)c1Cl	916295774	CZMALXPDCCDCLV-ZDUSSCGKSA-N	440.909	1.742	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@@H]2C(=O)NNC(=O)c2ccc(Cl)nc2)s1	917252086	AZXDPXWJKQVLJM-GFCCVEGCSA-N	428.923	1.719	50	20	IDGD	
O=C(NNC(=O)c1cccnc1SCc1ccc(F)cc1)N[C@@H]1CCS(=O)(=O)C1	919886205	QIHLKCAGMWIPOX-CQSZACIVSA-N	438.506	1.644	50	20	IDGD	
NC(=O)c1ccc(/C=C\C(=O)N2CCC[C@H]2C(=O)NNC(=O)c2cccc(Cl)c2)cc1	920021939	RGLULYJYBJLHME-YFWYWMRJSA-N	440.887	1.904	50	20	IDGD	
O=C(CCCN1C(=O)CNC1=O)NNC(=O)c1ccccc1OCc1ccc(F)cc1	920213452	QQDUQWZUJFZJBJ-UHFFFAOYSA-N	428.420	1.498	50	20	IDGD	
COc1ccc(CCC(=O)NN=C(C)c2ccc(S(=O)(=O)NCCC(=O)O)cc2)cc1	920380136	PYJRQFJLQIMODI-UHFFFAOYSA-N	447.513	1.921	50	20	IDGD	
O=C(COC(=O)C1(c2cccc(F)c2)CCOCC1)NNC(=O)c1ccc([N+](=O)[O-])cc1	920664283	DQOBVWKCAQIUNL-UHFFFAOYSA-N	445.403	1.787	50	20	IDGD	
COc1cc(C(=O)NCC(=O)NNC(=O)NCCc2cccs2)cc(OC)c1OC	920889232	PMGUHJODOWIEFM-UHFFFAOYSA-N	436.490	1.077	50	20	IDGD	
CC(C)[C@H](C(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12)N1C[C@H](C)O[C@H](C)C1	921201313	MNDPLKPHCAZFGB-GQIGUUNPSA-N	443.548	1.872	50	20	IDGD	
O=C(CSc1nnnn1CC(F)(F)F)NNC(=O)c1ccc(Br)cc1	1116003982	VUFLBZJLXPITDC-UHFFFAOYSA-N	439.217	1.551	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)NCc2nnc3n2CCOC3)cc(OCC)c1OCC	1116745757	AQDVQHLSANBQNW-UHFFFAOYSA-N	448.480	1.149	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)C2CCC(NC(=O)C3CC3)CC2)CC1	1321506674	IHMMYSLMDDCZQW-UHFFFAOYSA-N	436.553	1.866	50	20	IDGD	
C[C@@](O)(Cn1cc(C(F)(F)F)ccc1=O)C(=O)NNc1cncc(Br)c1	1324952826	GPUFKYHMOZQZKQ-CQSZACIVSA-N	435.200	1.919	50	20	IDGD	
COc1ccnc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](F)Cl)C2)c1OC	1778025590	UCOFTTAAFHAQNO-ACWOFJMJSA-N	429.876	1.761	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)[C@@H]3CCC[C@@H]4CCCC[C@H]43)C2)C1	1778299013	NJHFVHOZYJEKIJ-UECWXEIQSA-N	448.608	1.796	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccn4nccc4c3)C2)C1	1778727135	CAPLHWIHXVUPJI-LIRRHRJNSA-N	435.322	1.809	50	20	IDGD	
C[C@H](Cn1cncn1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@](C)(Cl)CCl)C2	1779500550	QDTDPLXXGHZLHT-VVWQDTPRSA-N	446.379	1.664	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)n(C(F)F)n1	1780313086	RMKFAACVADQXBD-BDJLRTHQSA-N	435.269	1.814	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc4cccnc4nc3O)C2)C1	1782267336	HNAUMHVSQBAOMK-BLVKFPJESA-N	449.305	1.562	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@]2(C1)CN(C(=O)c1cnccn1)CCO2	1782864334	TURHGDBGULESJK-NAVGAYGYSA-N	439.422	1.805	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](N)c1cccc(Cl)c1)CCO2	1783875657	JTRRNFYXQKZXAU-TXPKVOOTSA-N	430.332	1.424	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CCCN(C)C3)C[C@@H]21	1783971679	DYKISZGMIUOVQE-QEOTZNIISA-N	430.387	1.339	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(=O)nc4sccn34)[C@H]2C1	1789139786	UOSBOQGNUJYFHE-ABHRYQDASA-N	438.937	1.367	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CC34CCCN3CCC4)[C@H]2C1	1789822917	IYWUPZDMTJBVGM-QZWWFDLISA-N	442.398	1.768	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3[nH]nc4ccncc34)C[C@@H]21	1789866539	RBEOHGYIAVOTBG-DCFBYQPESA-N	440.331	1.788	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]2C1)n1ccccc1=O	1789870737	SVYDGFGSYMPGBX-TYNWYWJLSA-N	444.359	1.625	50	20	IDGD	
Cn1ccc(=O)cc1C(=O)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1	1790049458	VXCIDYILKRDIPB-UHFFFAOYSA-N	445.284	1.127	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC1(c2ccc(NC(=O)c3cc(CO)on3)cc2)CCC1	1790173417	NXCUTHXHWMTZIR-UHFFFAOYSA-N	429.477	1.288	50	20	IDGD	
Cc1cc(C)n2ccc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)[C@H](O)CCl)C[C@@H]43)c2n1	1790530326	SAVSUFHSKNMMFU-OWLYRPNTSA-N	434.924	1.144	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cccc(Cl)n3)C[C@@H]21	1791252072	BFGQGPRFIDWBOM-TUUVXOQKSA-N	430.332	1.511	50	20	IDGD	
O=C(NC1(c2ccc(NC(=O)C(Cl)Cl)cc2)CCC1)c1cc(=O)n2[nH]cnc2n1	1791604668	BNEHGDFCUMQTCZ-UHFFFAOYSA-N	435.271	1.969	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)Cn1cccn1)C2	1792869841	BUDPHIYWJFBANX-NPJQDHAYSA-N	427.343	1.140	50	20	IDGD	
O=C([C@H](F)Br)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C12CC(C(F)(F)F)(C1)C2	1793480596	XLBLEWRZKZPNHC-NQSCELDKSA-N	443.235	1.999	50	20	IDGD	
CC(C)(C)c1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)c[nH]1	1794607613	DHGGCUTXEDGRAF-MUJYYYPQSA-N	438.532	1.876	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc3c(c1)CCO3)C2	1795116492	MNESGZVZRJQOEO-CWPLJXCYSA-N	437.334	1.539	50	20	IDGD	
Nc1nc2cc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)C(Cl)Cl)C4)ccc2s1	1795660210	LNHGVQGPYLNLOG-DDFAGTSDSA-N	429.329	1.885	50	20	IDGD	
CC(=O)Nc1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](F)Br)C3)ccn1	1797246545	TYVZYYGYYAOJOM-QVHKTLOISA-N	427.274	1.982	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2ccccc2n1C	1797277080	POGSEPHJEJOWCP-BCDXTJNWSA-N	425.533	1.803	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1cccc([N+](=O)[O-])c1)C2	1797952722	INYHPHFGJMIQKJ-UPHUGPLXSA-N	449.580	1.969	50	20	IDGD	
COc1ccc2[nH]cc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)CO[Si](C)(C)C)c2n1	1797957312	GSJIGBPPEDRURT-HBCWATKFSA-N	446.580	1.626	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(Cl)cc(Cl)n1	1798298456	KXROQTRQPGBFSS-HOZXKAFVSA-N	436.723	1.845	50	20	IDGD	
Cc1cccc(CCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)n1	1798440648	GJFABKJUSTZQMS-BCDXTJNWSA-N	436.516	1.273	50	20	IDGD	
Cc1cc(C(=O)NCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@](C)(Cl)CCl)C3)no1	1798509634	SRFGKPQZSKQQCW-SJBDTSRBSA-N	431.320	1.587	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1COc3ccccc3O1)C2	1799273970	NNMATVLUHCKSGE-GUSVHXROSA-N	443.327	1.652	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1ccc([N+](=O)[O-])cc1F	1799491846	WTCPJUZOBIZENN-HZZFPTLFSA-N	448.220	1.628	50	20	IDGD	
COc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Cl)C3)cc([N+](=O)[O-])c1OC	1799841855	YSAWHBUZSATKDF-VAECKANCSA-N	445.831	1.350	50	20	IDGD	
Cc1cccc2c(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@H](F)Br)C4)n[nH]c12	1800072004	IUNOUEYEMKYCKT-VAECKANCSA-N	439.285	1.765	50	20	IDGD	
C[C@H](NC(=O)c1ccccn1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](F)Br)C2	1801262424	TZMFIPDJRSGWCC-AIUMHDJVSA-N	441.301	1.529	50	20	IDGD	
COC[C@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CS(=O)(=O)c1ccc(C)cc1)C2	1802274237	VXFRBHSHNVHCOS-DFGXFYAUSA-N	442.965	1.661	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](O)CCl)C3)C1	1802578504	QOEUWVCXRHRMHS-UUAJXVIYSA-N	443.972	1.871	50	20	IDGD	
COc1cncc(CCC(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]2c2cccnc2)c1	1803141391	NLHDBLUOGOPXLL-YFVAEKQCSA-N	446.935	1.724	50	20	IDGD	
O=C(CCc1cc(F)ccn1)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1	1804441753	FCSFMRBRBIVNHG-CVAIRZPRSA-N	434.899	1.854	50	20	IDGD	
O=C(c1ccc(-n2cccn2)nc1)N1CCC2(CCCN(C(=O)[C@H](O)CCl)C2)CC1	1805522740	KRCQIBYEMAJSQO-QGZVFWFLSA-N	431.924	1.712	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc(F)cc2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807368115	YZNOODCCNHLLNV-SIKLNZKXSA-N	447.275	1.534	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC2(CCCN(C(=O)c3cnc[nH]3)C2)CC1	1808270098	SXSMSRAYVXQNDH-MFKUBSTISA-N	425.493	1.389	50	20	IDGD	
Cc1nc(C)c(C(=O)N2CCC3(CCCN(C(=O)c4cccc(B(O)O)c4)C3)CC2)s1	1809974871	DQHABUKJGBAJQJ-UHFFFAOYSA-N	441.362	1.598	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC2(CCCN(C(=O)c3cccn4c(O)nnc34)C2)CC1	1810772361	ROIMPXRBSUAZED-HNNXBMFYSA-N	435.912	1.534	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)N1CC[C@H](CNC(=O)[C@H](C)Br)[C@@H]1c1cccnc1	1812865198	VGPAUANYTLSSAU-ATGSNQNLSA-N	440.342	1.318	50	20	IDGD	
CC(=O)C[C@H](C)C(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1813011097	FUYWWLUSVVQZLU-RRMPHLOHSA-N	431.537	1.076	50	20	IDGD	
C[C@@H](CBr)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H]2CCC(=O)N2)[nH]n1	1814780330	MBAAHPSAFUUWCZ-LOWVWBTDSA-N	426.315	1.711	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc(O)cn2)n[nH]1	1816640430	HHFRBOLKCFKNNP-INIZCTEOSA-N	429.481	1.189	50	20	IDGD	
Cc1cc(NC(=O)CC(=O)N[C@H]2CCc3nc(NC(=O)[C@@H](F)Cl)sc3C2)no1	1817121462	KARGSKJIJZZCEQ-RMLUDKJBSA-N	429.861	1.915	50	20	IDGD	
Cc1cc2nnc(C(=O)N[C@H]3CCc4nc(NC(=O)[C@H](F)Cl)sc4C3)c(C)n2n1	1817122527	JRAHJRFSJYOKMZ-XPTSAGLGSA-N	437.888	1.958	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](COC)NC(C)=O)n[nH]1	1819606177	SEWABLFTTPWJMW-IMJJTQAJSA-N	427.933	1.960	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cccc(=O)n2O)[nH]n1)[C@@H](F)Br	1820931082	FTGHZKHOEIARHK-QMTHXVAHSA-N	442.245	1.805	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CN(C)C(=O)C(=O)O)n[nH]1	1821712973	IESJZTMYUGHPNG-AAEUAGOBSA-N	427.889	1.352	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cnc[nH]2)CC1	1825884087	KAOJWROABRAWJU-CRXVIZHGSA-N	439.520	1.777	50	20	IDGD	
O=C(c1ccc(F)cn1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827051183	OZYZBZBXZJMVGS-NRFANRHFSA-N	439.296	1.448	50	20	IDGD	
O=C(c1cc2ccoc2s1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1830723902	TWSSYPNEABJUSP-SCLBCKFNSA-N	428.894	1.164	50	20	IDGD	
O=C([C@@H](O)CCl)N1CCO[C@@]2(COCCN(C(=O)C34CC(c5ccccc5)(C3)C4)C2)C1	1830737287	CVVVGOICBGVPBF-QVYZHRQISA-N	448.947	1.164	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1CC(c3ccccc3)=NO1)CCO2	1831263734	VZSFJPRBGDUWPP-LQBOVUBWSA-N	449.935	1.653	50	20	IDGD	
CN[C@H](CC(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H](C)Br)CC1)C(=O)O	1831649554	BOQJVJMAHPMCHU-CFVMTHIKSA-N	432.359	1.452	50	20	IDGD	
O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)CCCC(F)(F)F)CCO2	1832257365	RDKUTTNUCODYQY-HNNXBMFYSA-N	445.276	1.960	50	20	IDGD	
O=C(Cc1ccc(Cl)s1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1832602803	HIOITCACRLIVDG-GOEBONIOSA-N	425.309	1.935	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3ncccc3OC)CCO2)C1	1832865386	IECOLSDRILPUFL-HRAATJIYSA-N	439.940	1.497	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)C[C@@H]3C[C@@H]4CC[C@H]3C4)CC2)CC1)[C@@H](O)CCl	1833311894	GRYALZLAOIPLRH-YLAKUSLOSA-N	426.001	1.984	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3c(F)c(C)nn3C)CCO2)C1	1833702862	OPIMPAICIISVSL-AUUYWEPGSA-N	430.908	1.345	50	20	IDGD	
COc1cnc(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](F)Cl)CC3)CC2)c(F)c1	1834007133	CJJJZWKLTIYBSY-QGZVFWFLSA-N	430.883	1.949	50	20	IDGD	
Cc1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)n1	1834052115	SVQJKLMGYNUJPG-RDTXWAMCSA-N	426.311	1.243	50	20	IDGD	
CC(C)(C)NCC(=O)NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1	1834698826	RNJNLDVUULZARO-INIZCTEOSA-N	435.382	1.637	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC(N2CCC(NC(=O)c3csc(N)n3)CC2)CC1	1834751284	VIPKAIUQZAWPPA-UHFFFAOYSA-N	439.658	1.762	50	20	IDGD	
O=C(Cc1cccc(F)c1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1835025512	ZNHOVZQRHMAPQV-FUHWJXTLSA-N	447.276	1.515	50	20	IDGD	
O=C(C/N=C/c1ccco1)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836717018	DXAULGMVMBJPRY-MNOULKQQSA-N	425.913	1.297	50	20	IDGD	
O=C(c1cnnc2ccccc12)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836718392	WWYCLNIDBKEUMB-HXUWFJFHSA-N	446.935	1.842	50	20	IDGD	
C[C@@H](CS(C)(=O)=O)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](F)Cl)CC2)CC1	1836873894	JOBNMKBLYGEHGH-SWLSCSKDSA-N	426.938	1.200	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](C)CC(N)=O)CC2)CC1	1836911897	DGNPGIAQVOOUHD-STQMWFEESA-N	432.359	1.280	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)Cc3ncccn3)CC2)CC1	1837212640	YHZKUFFUWVBLKJ-CQSZACIVSA-N	439.354	1.801	50	20	IDGD	
O=C(CC(F)(F)C(=O)O)N1CCC(OC2CCN(C(=O)C(Cl)Cl)CC2)CC1	1838079229	HCUWCSSJISTIEH-UHFFFAOYSA-N	431.263	1.899	50	20	IDGD	
O=C(c1cncc(C(F)(F)F)c1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1838181090	IBVCNDXOIIWGJN-BBRMVZONSA-N	439.793	1.705	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)c3cccc(F)c3)CC2)CC1	1838580858	NGLKEEAWBKNPRM-UHFFFAOYSA-N	448.539	1.811	50	20	IDGD	
CCOc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)nn1	1838829670	KIAGCZMRSYBCTE-FQEVSTJZSA-N	440.928	1.210	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(-n4cncn4)c3)C2)C1	1839147576	VYKUGVBMQDYOJT-RXVVDRJESA-N	447.923	1.355	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccc(F)cc3F)C2)C1	1839147844	DTTRKPUKEBSMQC-JXFKEZNVSA-N	430.879	1.981	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)NC(=O)OC(C)(C)C)C2)C1	1839148715	HACTWIDWFJQNAH-STXHMFSFSA-N	447.960	1.373	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)NC(=O)OC(C)(C)C)C2)C1	1839148716	HACTWIDWFJQNAH-SXGZJXTBSA-N	447.960	1.373	50	20	IDGD	
COC1(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)CCC1	1839156500	RIHRQLMUPWEPIJ-PKOBYXMFSA-N	437.364	1.638	50	20	IDGD	
O=C(Cc1ccccc1O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839202872	RVHUUYZCVLEVKB-FUHWJXTLSA-N	445.285	1.082	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3n[nH]c4ccc(C#N)cc34)CCO2)C1	1839489230	TZJGILFKXMBJSY-IIBYNOLFSA-N	445.907	1.522	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccc4c(c3)CCO4)CCO2)C1	1839998854	PTGGLUONYINFGI-AVRDEDQJSA-N	436.936	1.638	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(F)n3)C2)C1	1840033406	CIOWZFRTYODOIT-YVEFUNNKSA-N	430.274	1.074	50	20	IDGD	
COc1cc(F)ccc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840190816	OUNUYIXSNDVGNT-SFHVURJKSA-N	435.279	1.708	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3c(C)cc(C)cc3C)CCO2)C1	1840673570	IVKCNTPZXCWDRX-XMSQKQJNSA-N	438.952	1.936	50	20	IDGD	
CC(C)(C)OC(=O)N1CC2(CC(C(=O)N3CC4(CCCN4C(=O)[C@@H](O)CCl)C3)C2)C1	1841353936	YPHKTXODJCOFSE-HNNXBMFYSA-N	441.956	1.437	50	20	IDGD	
Cn1ccnc1C(=O)N1CC2(CCCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C1	1841924333	ZEGBEZFWBBLEEW-ZDUSSCGKSA-N	425.917	1.369	50	20	IDGD	
O=C(OCCO)c1ccccc1C(=O)N1CC2(CCCN2C(=O)CCBr)C1	1842638965	ZYUNFNQPJRQQBF-UHFFFAOYSA-N	439.306	1.438	50	20	IDGD	
Cc1cn2c(=O)c(C(=O)N3CCCC34CN(C(=O)[C@@H](C)Br)C4)cnc2s1	1843785909	GXNOVETZGRARMF-LLVKDONJSA-N	439.335	1.665	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)c2cc3cc(F)ccc3s2)C1	1844063958	RHVWQJGDHAPVTA-UHFFFAOYSA-N	438.289	1.851	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1cc(F)ccc1Cl)C2	1844264824	LPBQWKPKFZLKGV-UHFFFAOYSA-N	431.855	1.608	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)c1cccnc1N1CCOCC1	14372584	UKLXWIPCYCSSDH-CYBMUJFWSA-N	449.305	1.909	50	20	IDGD	
O=C(CSc1nnc(NC[C@@H]2CCCO2)s1)NNC(=O)c1ccc([N+](=O)[O-])cc1	16330858	LGPBZTJENGBRPR-LBPRGKRZSA-N	438.491	1.591	50	20	IDGD	
Cc1ccc(N2C[C@@H](C(=O)NNC(=O)c3csc(N4CCOCC4)n3)CC2=O)cc1F	26352596	FXFMCROSLXKFSW-ZDUSSCGKSA-N	447.492	1.241	50	20	IDGD	
CC(C)NC(=O)C(=O)NNC(=O)c1ccc(NS(=O)(=O)c2ccc(Cl)s2)cc1	726613147	NQTJJIPIPIJTQO-UHFFFAOYSA-N	444.922	1.488	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)c2cn(-c3ccccc3Br)nn2)c1	728206122	VVXVVTVAADUFGG-UHFFFAOYSA-N	445.277	1.912	50	20	IDGD	
CCOc1ccccc1[C@H](CC(=O)NNC(=O)CNC(=O)c1cccs1)NC(C)=O	728241091	PYDNEIZDWXFEBP-HNNXBMFYSA-N	432.502	1.292	50	20	IDGD	
CN(CCO)S(=O)(=O)c1ccc(C(=O)NNC(=O)c2cc(-c3ccccc3)on2)cc1	728312509	UJGBXUXCMKMYPJ-UHFFFAOYSA-N	444.469	1.029	50	20	IDGD	
CN(C)N(C(=O)CSc1nnc(-c2cccs2)n1C1CC1)[C@@H]1CCS(=O)(=O)C1	728460442	OOIPAOHQKQVNIP-CYBMUJFWSA-N	441.604	1.926	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N(C)CC(=O)N1CCCC1	729222810	STYKPWKZYBUCSX-LBPRGKRZSA-N	427.299	1.511	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)C2(C(=O)NC3CC3)CCC2)cc1	729296686	ABWGWLLJOJLXHV-UHFFFAOYSA-N	428.518	1.317	50	20	IDGD	
CN(C)c1ccc(NC(=S)NNC(=O)CN2C(=O)N[C@](C)(c3ccccc3)C2=O)cc1	729688955	KWPCMMPRYZNHKN-OAQYLSRUSA-N	440.529	1.537	50	20	IDGD	
CCn1c(=O)c(=O)[nH]c2cc(C(=O)NNC(=S)Nc3ccc(N(C)C)cc3)ccc21	729688991	MRXXBSCAAHIIMH-UHFFFAOYSA-N	426.502	1.407	50	20	IDGD	
C[C@@H]1CCCN(S(=O)(=O)c2cc(C(=O)NNC(=S)NCC3CCC3)n(C)c2)C1	730290224	JFPAERCNOSNGAR-CYBMUJFWSA-N	427.596	1.355	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)[C@H]1CCCN(S(=O)(=O)c2ccccc2)C1	730779665	BRANPRURBXXPGS-HNNXBMFYSA-N	433.486	1.019	50	20	IDGD	
C[C@@H]1CCC[C@H](NC(=O)CN2CCN(CC(=O)NNC(=O)c3ccccc3Cl)CC2)C1	731214874	URIDLAYRVKLRBM-SJORKVTESA-N	449.983	1.414	50	20	IDGD	
CCOc1cccc2c1OCC(C(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)=C2	732324815	IUTMXRZFJKAUME-UHFFFAOYSA-N	441.396	1.774	50	20	IDGD	
CCN(CC)C(=O)c1ccc(C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1	732339653	QTQOLYNUKMDPLJ-UHFFFAOYSA-N	442.428	1.695	50	20	IDGD	
O=C(NCCCNC(=O)c1ccc(F)cc1)NNC(=O)c1nnc(O)c2ccccc12	732468651	ZKILDDHEMRXVBK-UHFFFAOYSA-N	426.408	1.239	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)CC(C)(C)c2ccccc2)CC1	735117112	OCWQFYRCRRVBQP-UHFFFAOYSA-N	431.562	1.829	50	20	IDGD	
CC[C@@H](Nc1c([N+](=O)[O-])c(C)nn1C)C(=O)NNC(=O)c1cc(Br)c[nH]1	735841624	SRXFJTATMRQKCQ-SECBINFHSA-N	428.247	1.379	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)NC1CCN(C[C@@H]2CCOC2)CC1	736391919	HOKYBKMJUHORNN-HNNXBMFYSA-N	428.493	1.023	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCC[C@@H](c3nnc4ccccn34)C2)cc1OC	738319533	WDEZIDCZQBKGFS-MRXNPFEDSA-N	438.488	1.387	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)CCCc2nc(C3CC3)no2)cc1	739679343	VQDIQJDYYSQGLD-UHFFFAOYSA-N	435.506	1.046	50	20	IDGD	
Cc1nn(C)c2sc(C(=O)N[C@@H](C)C(=O)NNC(=O)COc3ccc(F)cc3)cc12	742034985	UHRUNXVHRLVGLW-NSHDSACASA-N	433.465	1.427	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)CN(C)c2ccccc2[N+](=O)[O-])c2ccccc2c1=O	742475150	WXCKKGNEHKJIEY-UHFFFAOYSA-N	438.444	1.783	50	20	IDGD	
C[C@@H](Oc1ccc(F)c(F)c1)C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	743741804	KKAYEQAXIJDLSQ-MRVPVSSYSA-N	433.820	1.494	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)c1	744644117	KHTYFTVYKOSPAW-MRXNPFEDSA-N	440.481	1.619	50	20	IDGD	
COC[C@@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1)C(C)C	745851196	YUKUZBQDGIPWEH-LJQANCHMSA-N	448.545	1.780	50	20	IDGD	
COc1cc(C)nc(NNC(=O)c2cccc(S(=O)(=O)N3C[C@H](C)O[C@H](C)C3)c2)n1	746622994	IBCOXWJMKGQQMH-OKILXGFUSA-N	435.506	1.348	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)Nc3cccc([N+](=O)[O-])c3)cc2)CC1	747824805	SEILNJVTKFASBV-UHFFFAOYSA-N	434.478	1.680	50	20	IDGD	
CS(=O)(=O)CC[C@@H](NS(=O)(=O)c1ccccc1)C(=O)NNc1cccc(F)c1	748089854	WSSMUMMSVYHENM-MRXNPFEDSA-N	429.495	1.051	50	20	IDGD	
CCCCS(=O)(=O)N1CCC[C@H]1C(=O)NNc1c(F)cc(C(=O)NC2CC2)cc1F	748834025	HGXZDZGVZOMNHB-INIZCTEOSA-N	444.504	1.894	50	20	IDGD	
COCCS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cc(Br)c[nH]2)cc1	749562481	JRJIMGUHRWFDBK-UHFFFAOYSA-N	430.280	1.272	50	20	IDGD	
Cc1ccc(/C=C(/C#N)C(=O)OCC(=O)N2CCc3cc(S(N)(=O)=O)ccc32)cc1	752821445	DSKKKJUQOYVOFD-YVLHZVERSA-N	425.466	1.682	50	20	IDGD	
COC(=O)c1cc(NC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c(C)c([N+](=O)[O-])c1	753127417	WJKOFHMTBHAWRR-MRXNPFEDSA-N	430.373	1.683	50	20	IDGD	
CCc1cc(Br)ccc1NNC(=O)NCCS(=O)(=O)N1CCOCC1	753152216	QXOTYJPYTPSTPZ-UHFFFAOYSA-N	435.344	1.300	50	20	IDGD	
CCOc1ccc(NC(=O)NNC(=O)Cc2cccnc2)cc1S(=O)(=O)N1CCCC1	755468762	CCHKNTHPFKCPFT-UHFFFAOYSA-N	447.517	1.660	50	20	IDGD	
O=C(NN=Cc1cnc(N2CCOCC2)s1)c1ccc(S(=O)(=O)N2CCCC2)cc1	755540838	AFELCJSIEWIECX-UHFFFAOYSA-N	449.558	1.528	50	20	IDGD	
Cc1nn(C)c(N2CCOCC2)c1C=NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12	755545279	IOPSZLZWHDLQMI-UHFFFAOYSA-N	437.504	1.620	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)Nc1ccc(N2CCOCC2)cc1C(F)(F)F	755915699	CLQYSNLIFDGRHO-GFCCVEGCSA-N	434.415	1.746	50	20	IDGD	
N#CCOc1cccc(NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1	755933158	OTXHWHIZDGMXJF-UHFFFAOYSA-N	443.485	1.840	50	20	IDGD	
CCOC(=O)Cc1nnc(NC(=O)NNC(=O)c2ccc(OC(C)C)c(OC)c2)s1	757755042	GOHFRMFVQVWYQZ-UHFFFAOYSA-N	437.478	1.906	50	20	IDGD	
CCOc1nc(C(F)(F)F)ccc1C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	758032923	ZNIRZUPUHQZHJW-UHFFFAOYSA-N	431.392	1.977	50	20	IDGD	
COc1ccc([C@]2(C)NC(=O)N(CC(=O)NNc3nc(O)c4ccccc4n3)C2=O)cc1	758298258	CWZQNAHPJYYTCX-NRFANRHFSA-N	436.428	1.254	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2cccnc2)c1)c1cccc(S(=O)(=O)N2CCCC2)c1	759275183	JRXKTZPPKZEGIQ-UHFFFAOYSA-N	440.485	1.127	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NCCOc2cccc(C(F)(F)F)n2)cc1	759623451	QRUCJZFHZKPNNJ-UHFFFAOYSA-N	428.367	1.897	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)c1cccc([C@]2(C)NC(=O)NC2=O)c1	762374270	UUQZMMBAIYHSMJ-FQEVSTJZSA-N	428.470	1.303	50	20	IDGD	
CC(C)(C)S(=O)(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)c2ccccc2O)c1	763530171	FBEJNEXGYJIRRR-UHFFFAOYSA-N	433.486	1.505	50	20	IDGD	
CCOc1ccc(OCc2ccc(C(=O)NNC(=O)C(=O)Nc3ccnn3C)cc2)cc1	763601462	RGCPQQCUFOUASR-UHFFFAOYSA-N	437.456	1.798	50	20	IDGD	
Cc1ccc(Oc2ccc(NC(=O)C(=O)NNC(=O)COc3ccccc3F)cc2)nn1	763681469	UKKBPMAQZPZTIY-UHFFFAOYSA-N	439.403	1.881	50	20	IDGD	
CS(=O)(=O)CCc1ccc(NC(=O)C(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)cc1	763728355	LMQPXLKXXUHELW-UHFFFAOYSA-N	447.557	1.576	50	20	IDGD	
CNC(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)c1	763729061	TYUAFJFRGMHGID-UHFFFAOYSA-N	443.891	1.238	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCC3)c(OC)c(OC)c1	763783941	RIZXNMOLAHTEJG-UHFFFAOYSA-N	447.469	1.440	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)n(-c2ccccc2F)n1	763808859	ROASEKKBQSJWMT-UHFFFAOYSA-N	436.403	1.356	50	20	IDGD	
Cc1ccc(C(=O)NC2CC2)cc1NC(=O)C(=O)NNC(=O)COc1ccc(F)cc1	763839199	ZCYSTFMSXLHFSL-UHFFFAOYSA-N	428.420	1.191	50	20	IDGD	
Cc1cc(C)n(-c2ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc3ccc(F)cc3)cn2)n1	763867615	XQMYQEFELIYMOR-AWEZNQCLSA-N	440.435	1.577	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccc(F)cc2-c2nc(C3CC3)no2)n1	763881233	MGUDYDNOLGBNCC-UHFFFAOYSA-N	441.423	1.353	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)C(=O)Nc2cc(S(C)(=O)=O)ccc2F)cc1	763891257	NYEUTAXBTPINKJ-UHFFFAOYSA-N	439.490	1.416	50	20	IDGD	
O=C(CCSc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccc2c(c1)NC(=O)CO2	763895142	LFRONOIHKZMMLB-UHFFFAOYSA-N	432.433	1.425	50	20	IDGD	
CCOC(=O)c1ccc(NC(=O)C(=O)NNC(=O)C2=S=C3CC[C@@H](C)CC3=C2)cc1	763938375	DQYCTRDIDKZYBS-GFCCVEGCSA-N	429.498	1.787	50	20	IDGD	
CN(C)c1ncc(NC(=O)C(=O)NNC(=O)c2ccc(-c3ccc(F)cc3)s2)cn1	763976098	QMCUVAWSEPVQJR-UHFFFAOYSA-N	428.449	1.810	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)NC(=O)CC2	764002667	PNWYGJTUYGZCDD-UHFFFAOYSA-N	434.250	1.072	50	20	IDGD	
CON(C)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)on2)cc1	764016104	GKAIREOVKXDKPL-UHFFFAOYSA-N	437.412	1.375	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(I)cc2)c(O)c1	764105247	OWZKSKDUOFARDO-UHFFFAOYSA-N	439.209	1.705	50	20	IDGD	
Cn1ccnc1C(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)cc1	764117846	UIARZDCYCUIFIB-UHFFFAOYSA-N	441.831	1.410	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1cccn(Cc2ccc(C)cc2)c1=O	764136478	RAXIKVLCMWKQEA-UHFFFAOYSA-N	448.479	1.542	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)C(=O)Nc2cc(C(N)=O)ccc2C)c1	764233653	XVJVDQXOEBADHT-UHFFFAOYSA-N	449.261	1.265	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)C(=O)Nc1ccn(Cc2ccccc2)n1	764350398	FDKVHPDHPFARBH-UHFFFAOYSA-N	429.440	1.517	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)C(=O)Nc2cc(C)n(-c3cc(C)cc(C)c3)n2)c1	764434471	XBDQYQSQJDHWPY-UHFFFAOYSA-N	449.471	1.551	50	20	IDGD	
COC(=O)c1nccc2c(S(=O)(=O)NNC(=O)COCc3ccccc3)cccc12	766316198	CMUHPBPPABJKRP-UHFFFAOYSA-N	429.454	1.548	50	20	IDGD	
COc1ccc2cc(C(=O)NNC(=O)CN3CCN(C(=O)c4ccccc4)CC3)[nH]c2c1	766649120	ZSGKLFUVYGCMJQ-UHFFFAOYSA-N	435.484	1.396	50	20	IDGD	
CN(CC(=O)NNC(=O)c1cccc(C#N)c1)[C@@H](CO)c1cccc(Br)c1	767045495	OZYPAVMHKZTXBG-KRWDZBQOSA-N	431.290	1.747	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)CCC(=O)c1ccc2c(c1)CCC(=O)N2	767245400	LVMXHMYCLBOHDZ-UHFFFAOYSA-N	425.441	1.769	50	20	IDGD	
COc1ccc(C(=O)NCCCC(=O)NNc2c(OC)cccc2S(C)(=O)=O)cc1	768634966	SNRFRZYEZOWUNC-UHFFFAOYSA-N	435.502	1.761	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)c1ccc(C)c(NS(C)(=O)=O)c1	768635990	NEATUXVROLGOBJ-UHFFFAOYSA-N	427.504	1.536	50	20	IDGD	
CCOC(=O)c1nn(C)cc1C=NNC(=O)c1ccc(CSc2nncn2C)cc1	769764253	MFBODAJSJWZVDI-UHFFFAOYSA-N	427.490	1.782	50	20	IDGD	
O=C(CN1CCOCC1)Nc1ccc(NC(=O)C(=O)NNc2c(F)cccc2Cl)cc1	770810915	WEJATKVLAJNCPT-UHFFFAOYSA-N	449.870	1.832	50	20	IDGD	
Cc1nc(NC2CC2)sc1C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	771046320	SEKNVVMNKGZTLJ-UHFFFAOYSA-N	442.545	1.245	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)C(=O)Nc2ccc(C(=O)N3C[C@H](C)O[C@H](C)C3)cc2)n1	773483287	UGWUGBBLUBKOSK-GASCZTMLSA-N	426.477	1.425	50	20	IDGD	
CC(=O)N1CCc2c(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc3cccc(Cl)c3)cccc21	774003227	VONDEGPCDJXRMJ-GFCCVEGCSA-N	444.875	1.802	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)Nc2ccc(S(=O)(=O)N3CCOCC3)cn2)c1	776062507	XBVAXNCAANHTEX-UHFFFAOYSA-N	435.462	1.038	50	20	IDGD	
Cn1cc([C@@H](NC(=O)NNC(=O)c2nnc(O)c3ccccc23)c2ccc(F)cc2)cn1	776197542	VRPIHDGJLKORGG-KRWDZBQOSA-N	435.419	1.942	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)C[C@H]3C=CCCC3)CC2)cc1	777812957	KENQVVTVKMJVCO-SFHVURJKSA-N	434.562	1.195	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)[C@H](Cc2c[nH]c3cc(F)ccc23)NC(C)=O)nc1C	778421556	NUFLNJKZLPAHIE-SFHVURJKSA-N	442.451	1.773	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)[C@@]1(F)CCN(C(=O)OCc2ccccc2)C1	778435995	BAXHWHBJBQGRGZ-HXUWFJFHSA-N	438.456	1.409	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@H]3CCN3C(=O)OC(C)(C)C)CC2)cc1	780928201	XHJVZXYTNCZSGJ-LJQANCHMSA-N	445.564	1.269	50	20	IDGD	
CC(=O)N[C@@H](CC(=O)NNC(=O)CCNC(=O)OC(C)(C)C)c1ccc(Cl)cc1	780973622	DGFSLVBEAKUTMV-HNNXBMFYSA-N	426.901	1.970	50	20	IDGD	
COC(=O)c1ccc(-n2cc(C)cn2)c(NC(=O)C(=O)NNc2ncncc2Cl)c1	782166096	NLOAPVYSYHSGJX-UHFFFAOYSA-N	429.824	1.493	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2ccc(CN3CCc4ccccc43)cc2)CCS(=O)(=O)C1	783427096	PRTBSGZNTOGVOI-JOCHJYFZSA-N	442.541	1.386	50	20	IDGD	
Cc1ccnc(Oc2ccc(NC(=O)C(=O)NNc3ccc(-n4cccn4)nn3)cc2)n1	783437051	RFCPESLKUTUXNB-UHFFFAOYSA-N	431.416	1.635	50	20	IDGD	
COc1ncc(NC(=O)C(=O)NNc2ccc(F)cc2Br)cc1C(N)=O	784803530	MNGULTGAKDPDJX-UHFFFAOYSA-N	426.202	1.173	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)cn1C	785099308	DQIOQNMVPXEAAZ-UHFFFAOYSA-N	435.387	1.064	50	20	IDGD	
O=C(NNc1c(F)cc(C(=O)NC2CC2)cc1F)C(=O)Nc1cnn(-c2ccccn2)c1	785108277	SPLLOROFSSQGEH-UHFFFAOYSA-N	441.398	1.520	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2ncccc2OCCCC#N)c2ccccc2c1=O	786148908	FJHWGSHJCXHGLB-UHFFFAOYSA-N	435.444	1.960	50	20	IDGD	
CCN1CCCN(C(=O)NNC(=O)[C@H](C)Oc2cccc(Br)c2)CC1=O	787256068	XGKKHJKKLIPLOX-LBPRGKRZSA-N	427.299	1.511	50	20	IDGD	
O=C(CCNC(=O)c1cc(F)ccc1Br)NNc1ccc(-n2ccnc2)nn1	788181468	SDTZWGRANLOUJX-UHFFFAOYSA-N	448.256	1.827	50	20	IDGD	
O=C(NNC(=O)[C@H]1OCC[C@H]1c1ccccc1)C(=O)Nc1cccc(N2CCOC2=O)c1	789809937	HQGLNNPBVHCVQY-ROUUACIJSA-N	438.440	1.302	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)CCOCC(F)(F)C(F)F)c1	790112521	GHLFEASEYIRCSU-UHFFFAOYSA-N	429.392	1.005	50	20	IDGD	
COc1cc(C)nc(NNC(=O)NCc2ccc(N3C(=O)N[C@@](C)(C4CC4)C3=O)cc2)n1	790899299	PLSOEXXBZTYWOQ-NRFANRHFSA-N	439.476	1.845	50	20	IDGD	
Cc1ccn(C[C@](C)(O)C(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)c(=O)c1	790901778	PIBZFVGVFVFLPL-INIZCTEOSA-N	433.408	1.345	50	20	IDGD	
CC(C)c1cc(NC(=O)C(=O)NNc2cccc(F)c2[N+](=O)[O-])n(-c2ncccn2)n1	790999936	HQCRNEFFUGDSOW-UHFFFAOYSA-N	428.384	1.915	50	20	IDGD	
O=C(NNc1nc2ccccn2n1)[C@H]1CCC[C@@H](C(=O)NNc2nc3ccccn3n2)C1	791242849	LHAXAOKFWFZRBU-OKILXGFUSA-N	434.464	1.165	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2ccc3ncccc3c2)c1	792329404	QKDMHVCWUXIKKC-UHFFFAOYSA-N	427.486	1.629	50	20	IDGD	
O=C(Cc1ccc(I)cc1)NNC(=O)c1nnc(O)c2ccccc12	792574933	BEOAMDBVZLWLMA-UHFFFAOYSA-N	448.220	1.944	50	20	IDGD	
CN(C)N(C(=O)C[C@H](NC(=O)c1ccc(O)cc1)c1ccccc1)[C@H]1CCS(=O)(=O)C1	792853628	FZQKYRBQWLLASS-ICSRJNTNSA-N	445.541	1.746	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(CC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1	793492747	FJWAPGHYRZGNGY-UHFFFAOYSA-N	427.486	1.126	50	20	IDGD	
COc1cc(S(=O)(=O)NNC(=O)c2cccc(C)n2)c(OC)cc1Br	794599064	AKQRWJGNECPQPI-UHFFFAOYSA-N	430.280	1.793	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2ccnc(NC(=O)C3CC3)c2)c2ccccc2c1=O	794776195	UOCUDRPKGUSIBF-UHFFFAOYSA-N	434.456	1.625	50	20	IDGD	
O=C(NNc1nccc(N2CCOCC2)n1)c1cnnn1-c1c(Cl)cccc1Cl	795173727	GJHYBWNNADHXKG-UHFFFAOYSA-N	435.275	1.958	50	20	IDGD	
CNC(=O)c1cc(Cl)cc(S(=O)(=O)NNC(=O)c2c[nH]c3ccccc23)c1OC	795280738	LPSIATHSPRFXJD-UHFFFAOYSA-N	436.877	1.813	50	20	IDGD	
CC(C)(C)C(=O)NNC(=O)CN(CCn1ccnc1)Cc1ccc(Br)o1	796192276	WOAMBSZUJWSUPC-UHFFFAOYSA-N	426.315	1.934	50	20	IDGD	
O=C(CN1CCCC[C@@H]1COC(=O)N[C@@H]1CCOC1)NNC(=O)c1ccccc1Cl	796549603	OORJRSSJRVZHHI-HUUCEWRRSA-N	438.912	1.471	50	20	IDGD	
Cc1ccc(-c2ccnn2C)cc1NC(=O)C(=O)NNC(=O)CN1CCCc2ccccc21	799257956	XJUWVZUYJYIDQF-UHFFFAOYSA-N	446.511	1.934	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)N=c2cc[nH]cc2)cc(C)c1OCC(=O)N1CCCCC1	802033259	QAQBLMVWCQXPSC-UHFFFAOYSA-N	425.489	1.978	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)N[C@H]2CCCN(C(=O)Cc3ccccc3)C2)cc1	802474623	NQZVDEUOBZBGON-SFHVURJKSA-N	440.500	1.638	50	20	IDGD	
O=C(NNC(=O)c1ccc2ncn(-c3ccc(Cl)cc3)c2c1)N[C@H]1CCS(=O)(=O)C1	805168196	NLLXMTZSQLFSSY-AWEZNQCLSA-N	447.904	1.810	50	20	IDGD	
CCOc1ccc(NC(=O)NNc2cccc(F)n2)cc1S(=O)(=O)N1CCOCC1	806175582	CZXLZKXTEWTAAS-UHFFFAOYSA-N	439.469	1.789	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)Nc1nc(-c2ccco2)cs1	806976959	PICNPPPNSLYZCT-UHFFFAOYSA-N	438.263	1.904	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2O)c(F)cc1Br	806978912	MYVDQWHMGHDHRR-UHFFFAOYSA-N	440.225	1.767	50	20	IDGD	
CC[C@H]1[C@@H](C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)CCN1C(=O)OC(C)(C)C	809932948	KRMDGPOQVNMROV-HOTGVXAUSA-N	443.504	1.730	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)c2ccc3c(c2)CCN3S(C)(=O)=O)cc1	812728551	PGNIVMAGWXNVJI-UHFFFAOYSA-N	438.531	1.016	50	20	IDGD	
CC(C)(C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1)c1ccccc1[N+](=O)[O-]	814222933	XHXDDTDLAQKRRD-UHFFFAOYSA-N	440.865	1.634	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)[C@H]2CCCCN2S(=O)(=O)c2ccccc2)c1	825786169	KAZZWCKFLRFMDF-LJQANCHMSA-N	446.529	1.498	50	20	IDGD	
N#Cc1ccc(S(=O)(=O)NCC(=O)NNC(=O)CSc2ccc(Cl)cc2)cc1	913496465	FRBJDKMPQBCIRN-UHFFFAOYSA-N	438.918	1.430	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCCCN2C[C@H](C)C[C@@H](C)C2)c2ccccc2c1=O	916461161	WLKDRFCNEPHXLG-HZPDHXFCSA-N	428.537	1.728	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)NCCN1CCN(c2ccccc2)CC1	916514852	QEOVXZKABKCWCA-UHFFFAOYSA-N	425.533	1.780	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)CCc3ccc(S(N)(=O)=O)cc3)n[nH]2)cc1	917177997	CNYYVCQSINNJPD-UHFFFAOYSA-N	427.486	1.426	50	20	IDGD	
O=C(CCC(=O)N1CCc2sccc2C1)NNC(=O)c1nnc(O)c2ccccc12	917529383	OIPSJKSLISQMNX-UHFFFAOYSA-N	425.470	1.523	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2ccc(COc3ccccc3)o2)ccc1O	917726725	NNRBIILOUQGEJJ-UHFFFAOYSA-N	446.437	1.974	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)NCc1cccc(C(=O)NC[C@H]2CCCO2)c1	920347812	SOHBIISEPYXTNJ-LJQANCHMSA-N	440.500	1.677	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NC2CCN(CCOC)CC2)c2ccccc2c1=O	920814337	XTRHJMGAWIUKCL-UHFFFAOYSA-N	444.536	1.251	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)c2ccccc2c1=O	933527900	DROABYRKWIYPSY-UHFFFAOYSA-N	436.428	1.517	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)NC2CCN(CC(F)F)CC2)CC1	1116083521	KASAPMDPLRCMRV-UHFFFAOYSA-N	433.500	1.693	50	20	IDGD	
O=C(NNC(=O)c1n[nH]c2c1CCCC2)Nc1cccc(S(=O)(=O)N2CCCCC2)c1	1116582400	KPFAEXGZCSDRLV-UHFFFAOYSA-N	446.533	1.930	50	20	IDGD	
C[C@@H](CC(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1)NC(=O)c1ccccc1	1322961351	HWLPAOSXHTWDFM-HNNXBMFYSA-N	432.521	1.990	50	20	IDGD	
NC(=O)[C@H]1CCCN(c2ccc(C(=O)NNC(=O)c3cncn3-c3ccccc3)cc2)C1	1324034095	LYMOMILPNGTWGA-KRWDZBQOSA-N	432.484	1.649	50	20	IDGD	
N#Cc1ccc(CN2CC[C@@H](NC(=O)NNC(=O)c3cncn3-c3ccccc3)C2=O)cc1	1338989492	YUZXZTXOSGADJC-LJQANCHMSA-N	443.467	1.489	50	20	IDGD	
Cc1c(C(=O)N2CC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)oc2ccccc12	1777746910	DITXGKWEYLNKFM-XMMPIXPASA-N	448.284	1.178	50	20	IDGD	
O=C(CC(F)(F)C(=O)O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Br)C2	1778013278	OINTVMAMUNBSNC-OLUVUFQESA-N	445.232	1.301	50	20	IDGD	
Cc1nc2sccn2c1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1778718774	DBCPIMKHGVDCBL-MLGOLLRUSA-N	445.314	1.838	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(CN(C(=O)c3cc[nH]n3)CCO2)C1	1780095006	BQNAEHAUYVDTNP-FQEVSTJZSA-N	443.416	1.001	50	20	IDGD	
CCOC(=O)c1cccc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](F)Cl)CCO3)c1F	1780110511	KVVDOWRNPIECBA-BEFAXECRSA-N	430.835	1.980	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CSCC(=O)O)C2	1780715578	RXXNVXXZQIIFKA-CSMYWGQOSA-N	441.377	1.554	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](C)N(C)C(=O)OC(C)(C)C)C2)C1	1781041991	ZDMAMDLBEOYOHB-STXHMFSFSA-N	447.960	1.326	50	20	IDGD	
COc1ccc(CC(=O)N2CCO[C@]3(CCN(C(=O)[C@H](F)Br)C3)C2)cc1	1781328688	WJJZYVWUGNLHLN-FUHWJXTLSA-N	429.286	1.758	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(F)s1)C2	1782209395	MFVAQJGYJWIYEM-FOIQADDNSA-N	440.541	1.388	50	20	IDGD	
O=C(c1cn2c(F)cccc2n1)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1782373325	HQDVIMYBRHNIED-PBHICJAKSA-N	443.248	1.607	50	20	IDGD	
C[C@@H](CC(N)=O)C(=O)N1CCO[C@]2(CCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1	1782860866	DSATXIAKHBNHGW-VHZLJSGKSA-N	446.454	1.213	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3nc(C)c(C)[nH]c3=O)CCO2)C1	1783344940	UPRPRVLENXKWSZ-UGSOOPFHSA-N	441.326	1.004	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@H]2[C@H](C(=O)N3CC[C@@]4(CN(C(=O)[C@@H](F)Cl)CCO4)C3)[C@@H]2C1	1783467321	MXPDOFWFPXGDLF-UPYQZRRNSA-N	445.919	1.464	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc4c(c3)CNC4=O)CCO2)C1	1783533851	KVDROMYGEQNANN-BUXKBTBVSA-N	436.306	1.157	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)Cc3cc(F)ccc3[N+](=O)[O-])CCO2)C1	1783884118	QMJSJFQKRUXDBR-BEFAXECRSA-N	443.859	1.360	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)C(Cl)Cl)C3)C2)c(O)c1OC	1783946568	COYCQRIHXQKAFZ-SFHVURJKSA-N	433.288	1.657	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCN3CCCCC3)C[C@@H]21	1783968604	YFLVURYXGLLLAV-OWSLCNJRSA-N	444.414	1.873	50	20	IDGD	
CCOC(=O)C(C)(C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]2C1	1783975200	IBGPWIRRXMBPPR-AJNGGQMLSA-N	447.370	1.586	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](O)c3ccccc3Cl)C2)C1	1784251678	OQBZVURQUGTNPF-DWQUBVKVSA-N	445.741	1.987	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cn3cc([N+](=O)[O-])cn3)[C@H]2C1	1785213982	FEHWEIZFLTWDLZ-TUUVXOQKSA-N	427.889	1.179	50	20	IDGD	
C[C@H](Oc1cccnc1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCBr)[C@H]2C1	1786407765	UGRTWLMQQMAGDK-OTRWWLKZSA-N	440.338	1.614	50	20	IDGD	
O=C(/C=C/c1cc(F)c(F)c(F)c1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21	1791161724	YSGFWEZDOSVDID-GJPACEKJSA-N	446.853	1.697	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3noc4c3CCCC4)C[C@@H]21	1791253648	DNYLWIMAKJNCIB-FAYQHZLMSA-N	425.913	1.401	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccnn3-c3ccccc3)C[C@@H]21	1791254271	MTVUXJJSENACNS-BOLBYERCSA-N	446.935	1.719	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4cccnc4n3)C[C@@H]21	1791254292	NDSDLCGVNOJCGN-CUSZFKRNSA-N	432.908	1.477	50	20	IDGD	
Cc1cccc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)CBr)n1	1792868505	BVKDTYFTYVMJKV-JNNRSPCRSA-N	438.366	1.943	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c(F)cncc1F)C2	1792872578	PGXUGSHFLWTANT-ZVXAKGHKSA-N	432.265	1.594	50	20	IDGD	
O=C(CCCc1ccccc1F)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1	1796188008	SZQSWJABTDELMQ-WKCHPHFGSA-N	438.308	1.780	50	20	IDGD	
O=C(Cc1ccc(F)cc1F)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1	1796190301	LVMLIZAYCCIWDD-REPLKXPHSA-N	428.244	1.139	50	20	IDGD	
Cc1cc2nc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3cccc(B(O)O)c3)[nH]c2cc1C	1796191574	ZPIZZJZGHNGFRL-REPLKXPHSA-N	446.316	1.425	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2)c1nnsc1C1CC1	1796641280	DTXCZBYAQGNJDV-PTEHBNRSSA-N	429.340	1.404	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2nonc2c1	1796885096	YVXGJEODFBVFBP-ABXQLRGKSA-N	427.288	1.662	50	20	IDGD	
C[C@H](Nc1ccccn1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Br)C2	1797976113	JATBGUBHMNZAFZ-YMSVYLFOSA-N	425.327	1.255	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccnc(OC)c1	1798124890	OLTFWHCCKDNOBQ-HLPPOEQASA-N	426.311	1.467	50	20	IDGD	
C[C@@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CO[Si](C)(C)C)[C@H]1SC(=N)NC1=O	1798625934	RSRRKROTGXHWGN-ZHZXCYKASA-N	426.615	1.279	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)N(C)C(=O)OC(C)(C)C	1799140217	QOZCYYFLDIIAOQ-RBGFHDKUSA-N	447.960	1.085	50	20	IDGD	
C[C@@H](Nc1ccccn1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@](C)(Cl)CCl	1799275686	AFTAEBMWXKNDTR-TWAUDHPGSA-N	429.348	1.708	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COc1ccccc1C#N)C2	1799282687	VPLVUIDWWZEPOU-BAAGSCJXSA-N	440.327	1.763	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(C(F)F)no1)C2)[C@@H](F)Br	1799346383	PYULSKVBDZKNAC-LRMGWDNHSA-N	426.189	1.506	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3ncoc3c1)C2)[C@@H](F)Br	1799347804	TUVVQKAKRBJNAW-BAESOJJISA-N	426.242	1.722	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1c(F)ccc(O)c1F	1799727672	ABBCYBPLPMVYOI-QYOFDKIESA-N	437.212	1.564	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cn1cccc([N+](=O)[O-])c1=O)C2	1800082984	HGGJUBGLXFNVKY-SJBDTSRBSA-N	445.303	1.631	50	20	IDGD	
Cc1ccc(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CCC(=O)NN(C)C)C3)cc1[N+](=O)[O-]	1800139749	GAJPVWVNDZZYRJ-BCDXTJNWSA-N	445.520	1.457	50	20	IDGD	
COc1ccccc1CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)CBr)C2	1800628260	XCIQOEWFBHIIBK-AMVTXUCVSA-N	439.350	1.858	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)Cc1ccccn1	1801223452	ZLWFBMUZSHORQM-MAPUTHEBSA-N	438.366	1.881	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)COc1ccccc1C#N	1801994651	ZBPYBOGWOWDLJS-FRQROOTJSA-N	436.306	1.310	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)C1CC(F)(F)C1	1802633188	SFAVXNQQULYVGY-QFBILLFUSA-N	443.259	1.126	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2cccn(C)c2=O)[C@H]1c1cccnc1	1803835117	HYTRYAZLMZANEZ-BPQIPLTHSA-N	432.908	1.354	50	20	IDGD	
Cc1cccc(C(=O)NC[C@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)n1	1805521214	UKQIFTBBEGTPKP-XMSQKQJNSA-N	438.532	1.478	50	20	IDGD	
Cc1occc1C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1807369719	SPMDKWVFNAPJNU-NQIIRXRSSA-N	433.273	1.296	50	20	IDGD	
C[C@H](CC(N)=O)C(=O)N1CC[C@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]1c1cccnc1	1808289587	FQCNMTXEKBGLBV-QNDNMDDASA-N	429.348	1.835	50	20	IDGD	
CN1C(=O)CC[C@H]1C(=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@@H]1c1cccnc1	1808774551	SCYHHZFNPNSGFN-WMHQRMGPSA-N	441.301	1.399	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)[C@H](F)c3ccccc3)CC2)C1	1809968896	HEJFIFCDAWSTCZ-OAQYLSRUSA-N	438.308	1.922	50	20	IDGD	
O=C(Cc1ccsc1)N1CCCC2(CCN(C(=O)c3ccc(B(O)O)cc3)CC2)C1	1810110732	KOXMJSOLTCGPQZ-UHFFFAOYSA-N	426.347	1.515	50	20	IDGD	
CC(C)O[C@H](C)C(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1810434959	HSKYXXLEAMMZJW-HGHGUNKESA-N	433.553	1.274	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)CCSC(=N)N)[C@H]1c1cccnc1	1813030781	LCJGFFJLTJFOFX-DZKIICNBSA-N	427.958	1.358	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2cnn3ccncc23)[C@H]1c1cccnc1	1813031272	RZFNFCFFBIVVJK-AYBZRNKSSA-N	442.907	1.698	50	20	IDGD	
CC[S@](=O)CCC(=O)N1CC[C@H](CNC(=O)[C@@H](Cl)COC)[C@@H]1c1cccnc1	1813032909	XXFNPZJGEZZXCO-FMMHAMBFSA-N	429.970	1.500	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(O)c([N+](=O)[O-])c2)[nH]n1)[C@H](O)CCl	1814872768	NSDBGDUFEOAMSO-SWLSCSKDSA-N	437.840	1.929	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)C[C@H](NC)C(=O)O)sc2C1	1815087493	YXTRWHXUCRCSQK-QXEWZRGKSA-N	447.355	1.291	50	20	IDGD	
CCc1oncc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1816605358	MOJSDYFQVVBZTB-KRWDZBQOSA-N	437.265	1.260	50	20	IDGD	
Cc1ccoc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(B(O)O)cc1)CC2	1817415775	NCBLQLMKXRYDJZ-AWEZNQCLSA-N	425.275	1.264	50	20	IDGD	
CC(=O)C[C@H](C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1	1817474839	HJPRWACBHXKDBN-UGSOOPFHSA-N	426.282	1.011	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc(Cl)nn2)n[nH]1	1819689449	LAKLYCLFYOIOAP-AWEZNQCLSA-N	448.915	1.532	50	20	IDGD	
Cc1cc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cnccc4C(=O)NN)sc3C2)c[nH]1	1819796995	LAMMABLEVYVBCZ-LBPRGKRZSA-N	439.501	1.318	50	20	IDGD	
C[C@H](C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](F)Br)[nH]n1)n1cnnn1	1822858837	AFDQWJAJXJEPRA-UISBYWKRSA-N	429.254	1.340	50	20	IDGD	
CC(C)OCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1	1823868522	VWRZGRPQVDEEIS-LJQANCHMSA-N	431.537	1.343	50	20	IDGD	
O=C(CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)CC1)N1CCCC1	1824178789	KUYBHTXGZIPXFX-ROUUACIJSA-N	427.973	1.608	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)C[C@H]2CCCCO2)CC1	1824904591	CQRYGLIISVZGDJ-FGZHOGPDSA-N	442.365	1.559	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1nc[nH]c1[N+](=O)[O-])CC2	1825641090	MTBUHGINSLZEKH-RNFRBKRXSA-N	443.283	1.784	50	20	IDGD	
Cc1nc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)co1	1825954685	ZWQVIVFXJMSGFP-IBGZPJMESA-N	440.504	1.529	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@H]1CCc2nc(NC(=O)CCn3ccnn3)sc2C1	1826877420	FHMSRUNMHMOTOV-MGPLVRAMSA-N	431.349	1.973	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3ccc(C#N)cc3)CCO2)C1	1829634336	LFKGTUJDFLXEQM-KNQAVFIVSA-N	433.936	1.965	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cn4ccsc4n3)C2)C1	1830361711	AXUVZTGNXKPTMD-LJQANCHMSA-N	440.953	1.731	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4nccn4c3)C2)C1	1830362240	OVOWEIPJFCLHNH-OAQYLSRUSA-N	434.924	1.669	50	20	IDGD	
CC(C)Cc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)cc1	1830733706	RIMNHDKAFTVEJK-SIKLNZKXSA-N	438.952	1.555	50	20	IDGD	
Cc1ccn(CC(=O)N2CCC([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)n1	1831872095	OBCHTBWWZSOSAS-LJQANCHMSA-N	432.569	1.184	50	20	IDGD	
COc1ccnc(C(=O)N2CCC([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)c1	1831873444	LGSOCVRBBCWCOA-HXUWFJFHSA-N	445.564	1.697	50	20	IDGD	
COc1ccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)cc1C	1832090512	VVEDVIXJRPDIAK-AZUAARDMSA-N	428.888	1.537	50	20	IDGD	
O=C(Cc1ccc(Cl)s1)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1	1832599500	CLCNZMKTMKXAMF-CXAGYDPISA-N	437.345	1.000	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3ncccc3C)CCO2)C1	1832781167	GILYKVBKFXOYAR-UTKZUKDTSA-N	439.940	1.033	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2CCCSC2)CC1	1832856998	UHHVKJQAYJDUIH-CTNGQTDRSA-N	444.406	1.743	50	20	IDGD	
Cc1nc(CC(=O)N2CCO[C@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)cs1	1832971657	LNWHHUXLFMDPQS-LJQANCHMSA-N	441.626	1.302	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)c1ccc(F)nc1F	1833016084	UCSNRDFQBOBDEI-HNNXBMFYSA-N	430.883	1.145	50	20	IDGD	
O=C(CCc1cccs1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1833158892	KTJBABZCLXMROW-DOTOQJQBSA-N	449.342	1.828	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@H](C)NC(=O)CC)CC2)CC1	1833418146	RPKSVAZARIORLZ-YJBOKZPZSA-N	429.005	1.880	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](C)CBr)C3)C2)nc1	1834371733	QCANXNPEHMPNQP-KXBFYZLASA-N	440.338	1.491	50	20	IDGD	
CCOC(=O)/C=C/C(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)Br)CC2)CC1	1834405839	LRWDGVRIHYSFLC-ISZGNANSSA-N	444.370	1.461	50	20	IDGD	
CCc1oncc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](Br)CC)C2)C1	1834522352	RIEUFTQZLUAVKG-KBXCAEBGSA-N	444.326	1.481	50	20	IDGD	
Cc1nn[nH]c1C(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)Br)CC2)CC1	1834935430	GUBWZEBCELVAJL-LLVKDONJSA-N	427.347	1.082	50	20	IDGD	
CC(=O)C[C@@H](C)C(=O)N1CCC(N2CCC(NC(=O)[C@H](F)Br)CC2)CC1	1836414325	DUTLYYJWCMGPOA-WBMJQRKESA-N	434.350	1.864	50	20	IDGD	
COC(OC)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1836789761	HIMIPSIRJWBHIY-CYBMUJFWSA-N	425.295	1.294	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)n1ccccc1=O)CCO2	1837681995	LJMGEQRNBUKDJD-LLGFUMIMSA-N	439.940	1.273	50	20	IDGD	
COCc1c[nH]c(C(=O)N2CCOC[C@@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)c1	1837715224	CVJNVSBODDSIHF-HXUWFJFHSA-N	439.585	1.083	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCC(OC2CCN(C(=O)CN3CCNC3=N)CC2)CC1	1837862102	WXXJOEZASZOVBT-IBGZPJMESA-N	448.395	1.061	50	20	IDGD	
CC(C)c1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)n[nH]1	1838693673	FUXKQWAPGGFENW-HXUWFJFHSA-N	426.945	1.868	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)CCn3cncn3)CC2)CC1	1838773728	YKRBEDJRURZXEO-AWEZNQCLSA-N	442.358	1.450	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(O)c(OC)c3)CCO2)C1	1838974763	YWGFGCZEXBKMBI-YWZLYKJASA-N	426.897	1.488	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)C3(c4ccc(O)cc4)CC3)C2)C1	1839141501	KBPGNQWONDRNQL-WIYYLYMNSA-N	436.936	1.898	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CC=CC[C@@H]3C(=O)OC)C2)C1	1839148564	BTWGYNHBYAQWAX-JJDSTIRJSA-N	442.940	1.216	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccc(F)cc3OC)C2)C1	1839149321	BQAWIHJVEFIKMP-UTKZUKDTSA-N	442.915	1.851	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CCCS3)C2)C1	1839156228	IEDTVNDNBZQHIP-XOKHGSTOSA-N	425.378	1.575	50	20	IDGD	
Cc1cc(C)nc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)c1	1839199912	ZLJWZFCYACQCNO-QAPCUYQASA-N	444.301	1.459	50	20	IDGD	
C[C@H]1CC[C@H](C(=O)N2CCOC[C@@]3(CN(C(=O)[C@H](F)Br)CCO3)C2)CC1	1839203469	LWPVUAPKWDLLGO-XSWJXKHESA-N	435.334	1.960	50	20	IDGD	
CCc1oncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](Br)CC)CCO2	1839963613	QFUBUSYVBCVIHL-KSSFIOAISA-N	444.326	1.481	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(O)cc3)C2)C1	1840034694	UJCCUFKDTKGSKX-UGSOOPFHSA-N	427.295	1.246	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3ccoc3)C2)C1	1840036892	RWEGHSVMJPTIEF-RDTXWAMCSA-N	429.311	1.452	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3c[nH]c4ccccc34)C2)C1	1840154125	LZQZYLOHZAOHKP-AVRDEDQJSA-N	449.935	1.421	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@]1(C)CC1(F)F)CCO2	1840823350	QFLIBCOCBHTJIJ-UHOFOFEASA-N	439.297	1.519	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC12CN(C(=O)c1cc(=O)nc3sccn13)C2	1841287751	DLEUFZGHQKFQER-NSHDSACASA-N	439.335	1.604	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H]1C(=O)N1CCCC12CN(C(=O)CCBr)C2	1841763709	RVVBZRMLKOGYDR-CYBMUJFWSA-N	430.343	1.984	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)c2cc(O)n[nH]2)C1	1842984127	UOBAIKRVCLHXMF-UHFFFAOYSA-N	429.389	1.080	50	20	IDGD	
CCc1nn(C)c(C(=O)N2CCCC23CN(C(=O)[C@H](Cl)COC)C3)c1Br	1843148943	ZMCLVGKJTHDSKC-LLVKDONJSA-N	447.761	1.816	50	20	IDGD	
Cn1ccc2c(O)ncc(C(=O)N3CC4(CCCN4C(=O)[C@H](F)Br)C3)c21	1845218588	OIBIZJRGVNNMQH-ZDUSSCGKSA-N	425.258	1.786	50	20	IDGD	
O=C([C@H]1C[C@@]12C(=O)Nc1ccccc12)N1CC2(CCCN2C(=O)[C@@H](F)Br)C1	1845219613	AIJIEIAWCBQOKM-TVZGQMOCSA-N	436.281	1.790	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC2(CCCN2C(=O)[C@@H]2CCCS2(=O)=O)C1	1845915014	UUKVJOVDDCTBPD-DWCFMXGVSA-N	449.479	1.652	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@H]1CC(=O)N(Cc3cccs3)C1)C2	1846360987	RBTWFZZYFJOWKD-ZBFHGGJFSA-N	439.965	1.554	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)CN(Cc1ccccc1)C(=O)OC)C2	1846364739	HLEADTXMRXLGKU-KRWDZBQOSA-N	437.924	1.712	50	20	IDGD	
COc1cc(CC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](O)CCl)cc(OC)c1OC	1847556075	CGEYSNJHZHNEKV-KKUMJFAQSA-N	426.897	1.056	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNS(=O)(=O)c2ccc(S(N)(=O)=O)cc2)cc1	18995247	DCVRFRXNQIWVQI-UHFFFAOYSA-N	441.531	1.382	50	20	IDGD	
NS(=O)(=O)c1cccc(S(=O)(=O)NNC(=O)c2cc3c(s2)CCCCCC3)c1	23394009	KOFXYDKVNYNVHG-UHFFFAOYSA-N	443.572	1.678	50	20	IDGD	
COc1ccc(S(=O)(=O)NCCC(=O)NNc2oc(C(C)C)nc2C#N)cc1OC	116128163	RQEHPZRVFKXICR-UHFFFAOYSA-N	437.478	1.499	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)[C@@H](NS(=O)(=O)c2ccc(C)cc2)C(C)C)cc1	117659624	RGOARUJMFCLFKJ-FQEVSTJZSA-N	448.545	1.566	50	20	IDGD	
C[C@]1(NNC(=O)NC[C@H](c2cccc(Cl)c2)N2CCOCC2)CCS(=O)(=O)C1	727034919	YAPWKZSYCGCBBE-AEFFLSMTSA-N	430.958	1.094	50	20	IDGD	
C#Cc1cccc(NC(=S)NNC(=O)[C@H]2CC(=O)N(c3ccc4c(c3)OCCO4)C2)c1	727501273	QNEZLORBEMHBKI-HNNXBMFYSA-N	436.493	1.810	50	20	IDGD	
CN1CCN(C[C@H](NC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c2ccccc2)CC1	727945130	IYYUZCQUCBBKMB-GHTZIAJQSA-N	439.516	1.146	50	20	IDGD	
CC(C)[C@@H](C(=O)OCC(=O)NNC(=O)c1cccs1)S(=O)(=O)C1CCCCC1	728647555	FXMGQFFHHQUECY-INIZCTEOSA-N	430.548	1.824	50	20	IDGD	
O=C(NCc1coc(-c2cccs2)n1)NNC(=O)C1CCN(c2ncccn2)CC1	728942221	MMUCEBYSCBSGPB-UHFFFAOYSA-N	427.490	1.940	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)NCCCN1CCN(c2ccccc2Cl)CC1	728950720	ZRVOEOKDEDELAR-UHFFFAOYSA-N	430.940	1.820	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)NCCNS(=O)(=O)c1cccc(Cl)c1	729496557	VLUHLCNETAJGSM-UHFFFAOYSA-N	449.920	1.604	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)CCc1c(C)nc2[nH]n(C)c(=O)c2c1C	729512728	NCVJYYUAUXLZKF-UHFFFAOYSA-N	431.880	1.934	50	20	IDGD	
COc1cccc(C(=O)NNS(=O)(=O)c2cc(Cl)c(NC(C)=O)cc2F)c1O	729665212	FBFJAAGUTCLHAR-UHFFFAOYSA-N	431.829	1.775	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)c1c(F)ccc(S(=O)(=O)NC2CC2)c1F	729845561	MJXIVZDZQBZPKC-UHFFFAOYSA-N	448.451	1.821	50	20	IDGD	
COC(=O)CSCCNC(=O)NNC(=O)[C@H](C)Oc1cccc(Br)c1	729856417	OMYPCJQFUWNVTK-JTQLQIEISA-N	434.312	1.453	50	20	IDGD	
CC(C)(C)[C@H]1CCc2sc(C(=O)NNC(=O)NCCCN3C(=O)CNC3=O)cc2C1	731116861	DBGTVCSWSISRHT-ZDUSSCGKSA-N	435.550	1.785	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNS(=O)(=O)c1ccc2c(c1)C(=O)NC2=O	731594897	NMTVAOIDOKUQKW-LBPRGKRZSA-N	439.449	1.500	50	20	IDGD	
CCN(CC)C(=O)N1CCC(C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)CC1	732325536	NYEPSJCZGTUWCR-UHFFFAOYSA-N	449.464	1.073	50	20	IDGD	
CC(C)(C)C(=O)NNC(=O)N1CCN(C(=O)COc2ccc(Br)cc2)CC1	732677157	KCIVJYKHZBLSRL-UHFFFAOYSA-N	441.326	1.759	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)c1cccc(N2CCCS2(=O)=O)c1	733106545	GYLWSZOEQQKEIA-UHFFFAOYSA-N	425.470	1.487	50	20	IDGD	
CCNS(=O)(=O)c1ccc(C)c(C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c1	733169874	DEUZCDOXBZTGSK-UHFFFAOYSA-N	427.486	1.554	50	20	IDGD	
O=C(Cn1c(Cc2ccccc2)nc2ccccc21)NNC(=O)[C@@H]1CCS(=O)(=O)C1	733731154	LAJQASNONVPPQV-MRXNPFEDSA-N	426.498	1.209	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)CC[C@H]2NC(=O)N(c3ccc(C#N)cc3)C2=O)cc1	733805376	SIWBHPIUMMTLRC-GOSISDBHSA-N	434.456	1.331	50	20	IDGD	
COc1ccc(C=NNC(=O)c2sc(N3CCOCC3)nc2C)c(OCC(=O)O)c1	734363385	IXCPOBAIEIWDNW-UHFFFAOYSA-N	434.474	1.524	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)O[C@@H]2CCN(C)C2=O)cc1	734889019	VHTPYEFSPYCPGI-VHUCWBOISA-N	437.456	1.115	50	20	IDGD	
COc1cccc(C[C@]2(C(=O)NNC(=O)N[C@@H]3CCS(=O)(=O)C3)C[C@H]3CC[C@H]2C3)c1	735468086	CYVHZJXINIGKQY-OPOADAIRSA-N	435.546	1.562	50	20	IDGD	
CS(=O)(=O)[C@@H]1CCC[C@H](NC(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)C1	741093545	SZFYPNSMUACULD-WCQYABFASA-N	443.469	1.962	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)[C@H]1CCCN(C(=O)NCC(C)C)C1	741206696	CRKBUEPSLRZYPR-INIZCTEOSA-N	428.537	1.824	50	20	IDGD	
Cc1ccccc1C=NNC(=O)C[C@@H](C(=O)NN=Cc1ccccc1C)N1CCOCC1	741767583	ZPGWQAUOMFZFOT-QFIPXVFZSA-N	435.528	1.995	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@@H]2CCCN(C(=O)c3ccncc3)C2)c2ccccc2c1=O	742033959	HOSPVPMXCQMIQB-MRXNPFEDSA-N	448.483	1.125	50	20	IDGD	
CN(C)[C@H](CNC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)c1cccs1	742710926	QGWSPVULHRNWKH-CQSZACIVSA-N	425.536	1.790	50	20	IDGD	
CN(CC(=O)NNC(=O)c1cccc(C#N)c1)CC(=O)Nc1ccccc1Br	744383269	LNFUPOVWBRCEDP-UHFFFAOYSA-N	444.289	1.652	50	20	IDGD	
Cc1cccc(N2C[C@H](C(=O)OCC(=O)NNC(=O)c3cccc(C#N)c3)CC2=O)c1C	744566363	FHBMECAZYFODCE-GOSISDBHSA-N	434.452	1.532	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)C2=NN(Cc3ccc(F)cc3)C(=O)CC2)c1	744794924	ABWTVZRFRJDTGY-UHFFFAOYSA-N	440.431	1.617	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NC(C)C)cc1S(=O)(=O)N[C@H]1CCCC[C@@H]1C	745147440	YZPHMIKMVVJGAS-ZFWWWQNUSA-N	426.539	1.905	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)N2CCOCC2)ccc1OCC(=O)N1CCCCC1	745995800	BXKAWILOSJDZJO-UHFFFAOYSA-N	434.493	1.163	50	20	IDGD	
COc1ccc([C@]2(C)NC(=O)N(CC(=O)NNC(=O)CCOc3ccccc3)C2=O)cc1	747180584	IRLSSHAALDRPIL-QFIPXVFZSA-N	440.456	1.079	50	20	IDGD	
CSC[C@H](C(=O)NNC(=O)CCOc1ccccc1)N1C(=O)[C@H]2CCCC[C@H]2C1=O	747182576	OIVKILGBNZHZRQ-IXDOHACOSA-N	433.530	1.510	50	20	IDGD	
CC(=NNC(=O)c1cccc2cccnc12)c1ccc(S(=O)(=O)N2CCNCC2)cc1	747362134	OCSPUSRBZBREGH-UHFFFAOYSA-N	437.525	1.983	50	20	IDGD	
CC(C)S(=O)(=O)CC(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1	747778720	AGIDKTFNOFAFRA-HXUWFJFHSA-N	429.542	1.584	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)NC[C@H](c1ccc(Cl)cc1)N1CCOCC1	748624825	OXBKVXHFEYSCOK-RHSMWYFYSA-N	428.917	1.095	50	20	IDGD	
COCCCNC(=O)NNC(=O)[C@@H]1CCCN1C(=O)c1ccc(Br)cc1	749585606	NRDLVXLNZNNBHH-AWEZNQCLSA-N	427.299	1.421	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)CNC(=O)c1ccco1)n1nnc(-c2ccc(Cl)cc2)n1	751204223	GHGNJHCDLZBOJT-ZDUSSCGKSA-N	431.840	1.115	50	20	IDGD	
CCc1ccc(C(=O)NNC(=S)N[C@H](C)C2CC2)cc1S(=O)(=O)N1CCOCC1	751618697	JKGHVLPKSNNOLQ-CYBMUJFWSA-N	440.591	1.177	50	20	IDGD	
CN(C)c1cc(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)c2ccccc2n1	754847657	ALEFADUMBKYFKY-UHFFFAOYSA-N	426.502	1.669	50	20	IDGD	
COC[C@@H](C)CC(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2OC)c1	755036721	HUETYUKGRFSLAS-AWEZNQCLSA-N	435.502	1.930	50	20	IDGD	
O=C(CCc1ccncn1)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	755316800	DPVHEXJXLXGBFE-UHFFFAOYSA-N	431.499	1.733	50	20	IDGD	
CN(C)c1ccc(S(=O)(=O)N(C)C)cc1NC(=O)NNC(=O)Cc1ccccc1F	755534317	SQBBIIBVAGIKPN-UHFFFAOYSA-N	437.497	1.537	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2ccc([N+](=O)[O-])cc2OC)cc1OC	755678048	KADWTRCIQDNKAL-UHFFFAOYSA-N	433.373	1.239	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)Nc2ccc(N3CCNC(=O)C3)c(Cl)c2)c1	755937371	HAGWHHABYQDHFK-UHFFFAOYSA-N	431.880	1.816	50	20	IDGD	
CC(C)NC(=O)c1ccc(NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1	756089317	DFFMMDKENJQUOP-UHFFFAOYSA-N	425.493	1.684	50	20	IDGD	
O=C(COC(=O)CCc1cccc([N+](=O)[O-])c1)NNC(=O)[C@H]1COc2ccccc2O1	756525153	HXNVBGPWHZMDDO-QGZVFWFLSA-N	429.385	1.058	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)Nc1ccc(F)c(-n2nnnc2C2CC2)c1	756780480	YQWQFYZRDRPYPT-UHFFFAOYSA-N	449.406	1.794	50	20	IDGD	
CCOC(=O)[C@@H](C)NC(=O)c1ccc(NC(=O)NNC(=O)c2cccc(OC)c2O)cc1	756790100	LSEZKXNGQIYSOK-GFCCVEGCSA-N	444.444	1.549	50	20	IDGD	
Cc1ccc(C)c(S(=O)(=O)Nc2cccc(C(=O)NNc3ccc(C(N)=O)nn3)c2)c1	757402226	KTVYXVOKJRTNCU-UHFFFAOYSA-N	440.485	1.750	50	20	IDGD	
CNS(=O)(=O)c1cccc(NC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])c1C	757720146	BPXWDCYYFDHUGJ-UHFFFAOYSA-N	437.434	1.043	50	20	IDGD	
CN(C)C(=O)CNC(=O)c1ccc(NC(=O)NNC(=O)c2ccccc2O)cc1Cl	757725585	RSJVMGDJOMHDQX-UHFFFAOYSA-N	433.852	1.330	50	20	IDGD	
CCNS(=O)(=O)c1ccc(CC(=O)NNC(=O)c2ccc(CN(CC)CC)o2)cc1	759579407	MYYYQSTZOFWJJO-UHFFFAOYSA-N	436.534	1.423	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)N[C@@H]2CCN(C(=O)C3CCCC3)C2)cc1	762086095	IEVDIJNSOWGZGO-OAHLLOKOSA-N	437.522	1.217	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1cc(N2CCNC2=O)ccc1Cl	763468763	UJXHMJQTAYNGQW-UHFFFAOYSA-N	446.807	1.178	50	20	IDGD	
Cc1cc(C(=O)N2CCC(C)CC2)ccc1NC(=O)C(=O)NNC(=O)c1ccccc1O	763529048	IGUZHZRKHTZMBN-UHFFFAOYSA-N	438.484	1.972	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2c3c(nn2-c2ccccc2)CCC3)cc1OC	763552342	YZOWVMGYQAVKCD-UHFFFAOYSA-N	449.467	1.778	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)Nc1cc(F)ccc1OC(F)F	763572916	VVRKFGYBXPORTP-AWEZNQCLSA-N	425.319	1.353	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccccc2CN2C[C@H](C)O[C@@H](C)C2)c(C)o1	763587612	ZWUGMKNAUZXKBV-GJZGRUSLSA-N	428.489	1.905	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccccc2C(=O)N2CCCC2)cc1C	763667126	QGPPTNGFCJLYRH-UHFFFAOYSA-N	438.484	1.704	50	20	IDGD	
Cn1c(C(C)(C)C)nc2cc(NC(=O)C(=O)NNC(=O)COc3ccc(C#N)cc3)ccc21	763674735	PPMKUEUXOFROGQ-UHFFFAOYSA-N	448.483	1.907	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)C(=O)N2CCc3c2cccc3C(F)(F)F)cc1	763680241	DTNROCPMQKCGLQ-UHFFFAOYSA-N	432.358	1.693	50	20	IDGD	
COC(=O)c1cc(F)ccc1NC(=O)C(=O)NNC(=O)CN1CCCc2ccccc21	763746373	TVTVYZRAZOUJEZ-UHFFFAOYSA-N	428.420	1.151	50	20	IDGD	
N#Cc1ccc(Cn2cnc(NC(=O)C(=O)NNC(=O)c3cc4c(s3)CCC4)n2)cc1	763784658	FZEOHBXNIAYTMA-UHFFFAOYSA-N	435.469	1.148	50	20	IDGD	
CC(=O)Nc1c(C)ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])c1C	763804431	NDQHIAADZDRIGY-UHFFFAOYSA-N	443.416	1.335	50	20	IDGD	
COc1ccc(OC(F)F)c(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)c1	763809526	WEIZJXVBAUMJMY-UHFFFAOYSA-N	434.355	1.333	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccccc2OCCC(N)=O)c1C	763850845	BAXDEYSSDNLQQP-OAHLLOKOSA-N	442.472	1.111	50	20	IDGD	
Cc1ccc(S(C)(=O)=O)cc1NC(=O)C(=O)NNC(=O)Cc1c[nH]c2ccccc12	763860546	GRPNAXJHQPGIEJ-UHFFFAOYSA-N	428.470	1.208	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccccc2N(C)C(C)=O)cc1	763872997	QSRGVEFTKZLSSH-AWEZNQCLSA-N	440.456	1.425	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)C(=O)Nc2ccc(CCS(C)(=O)=O)cc2)cc1	763895863	JKKGOINEFRHLHT-UHFFFAOYSA-N	449.554	1.460	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccnn2-c2ccncc2)ccc1OC(C)C	763916336	MRVGPAVDAUMQTP-UHFFFAOYSA-N	438.444	1.463	50	20	IDGD	
COCCn1nc(C)c(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CC[C@@H](C)C3)c1C	763950223	VDNHDYNGVMWJHL-LLVKDONJSA-N	433.534	1.732	50	20	IDGD	
COc1cc(-n2cnnn2)c(Cl)cc1C(=O)NNC(=O)CSc1ccccc1O	764047352	QNZNUJDGEDPTRE-UHFFFAOYSA-N	434.865	1.583	50	20	IDGD	
Cc1nccn1-c1ccc(NC(=O)C(=O)NNC(=O)c2cccc(Br)c2)cn1	764059055	OBHQFXIYAOSQLA-UHFFFAOYSA-N	443.261	1.738	50	20	IDGD	
COC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(C)cc3)[nH]n2)cc1	764109711	APBBZIVMWDSZPY-UHFFFAOYSA-N	436.428	1.963	50	20	IDGD	
CCOc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NNC(=O)Cc1ccccc1OC	764138423	DYZIQCUMJGVZOO-UHFFFAOYSA-N	442.472	1.124	50	20	IDGD	
C[C@@H](c1ccc(NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)cc1)N1CCOCC1	764170139	ZKVMHRNXRKMWJN-MGPUTAFESA-N	438.484	1.169	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)C(=O)Nc2cc(C)nn2[C@H]2C[C@H]3CC[C@H]2C3)c1	764433236	NBTAORJFTAQNPU-ZQIUZPCESA-N	439.476	1.306	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)c1ccc(CN2CCC(CO)CC2)cc1	764656238	HGTGCSKKJGJBLA-UHFFFAOYSA-N	425.485	1.737	50	20	IDGD	
Cn1c(S)nc2cc(C(=O)NNC(=O)c3cc(-c4cccs4)[nH]n3)ccc2c1=O	768261368	RNSUPCXKZPPAAP-UHFFFAOYSA-N	426.483	1.749	50	20	IDGD	
COCc1c(C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cnn1-c1ccccc1	768688285	QDZNFUILMUFHTI-UHFFFAOYSA-N	432.440	1.985	50	20	IDGD	
COCCC(=O)N1CCC(NC(=O)NNC(=O)c2cc(-c3ccc(C)cc3)[nH]n2)CC1	769166206	UPRLKVPXLAEERE-UHFFFAOYSA-N	428.493	1.357	50	20	IDGD	
CSCCNC(=S)NNC(=O)CCn1cnc2sc3c(c2c1=O)CCCC3	769770174	RQYXJTCRWACFRG-UHFFFAOYSA-N	425.605	1.585	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)[C@@H](OC)C(C)C)c2)cc1	770209133	MUJOVJJIGZZSOT-SFHVURJKSA-N	435.502	1.928	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)cc1-n1cnnn1	770507496	BGHKGDVXWPODSR-LLVKDONJSA-N	431.840	1.945	50	20	IDGD	
O=C(NNC(=O)c1cccc2ncccc12)Nc1cnn(Cc2nnc3n2CCCC3)c1	772636805	WBHNHPXPFUIVGT-UHFFFAOYSA-N	431.460	1.874	50	20	IDGD	
CCn1c(=O)c2ccccc2n(CC(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)c1=O	772990732	PSCGWWXSHIYMAU-ZDUSSCGKSA-N	444.875	1.451	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1)n1nnc(-c2ccccc2)n1	773412242	USAHRBMNLOFAQB-GOEBONIOSA-N	443.508	1.696	50	20	IDGD	
CCOc1cc(N2CCN(C)CC2)ccc1NC(=O)C(=O)NNc1nc(C)cc(C)n1	773478129	HJPNUYUVLVLHHG-UHFFFAOYSA-N	427.509	1.326	50	20	IDGD	
O=C(NNc1c(F)cccc1F)C(=O)N1C[C@@H](C(=O)N2CCOCC2)Oc2ccccc21	773714817	ZECMFTIHEHZPOP-KRWDZBQOSA-N	446.410	1.061	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(N2C[C@H](C(=O)NCCCSC#N)CC2=O)cc1	774298595	SEGGBPOXLVTKIO-OAHLLOKOSA-N	438.575	1.791	50	20	IDGD	
CCC(=O)N[C@@H](CCSC)C(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776202001	OQJBZEDEKAPYMC-AWEZNQCLSA-N	445.586	1.270	50	20	IDGD	
CN(NC(=O)c1ccc(N2CCOCC2)nc1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776213106	NFJCYEVMDIWTLG-UHFFFAOYSA-N	448.524	1.168	50	20	IDGD	
COCCO[C@@H]1COCC[C@H]1NC(=O)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1	777279994	WQGHEBIANLVRAT-ZIAGYGMSSA-N	441.428	1.427	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2c(C)nn(C)c2-n2cccn2)cc1Br	777660072	HILITGLTLADIQI-UHFFFAOYSA-N	433.266	1.760	50	20	IDGD	
CCS(=O)(=O)c1ccc(CNC(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)cc1	777749256	QMBRHTJTSBGYLD-UHFFFAOYSA-N	432.502	1.566	50	20	IDGD	
O=C(NNc1ccc(-n2cccn2)nn1)N[C@H]1CCN(c2ccc(F)c(Cl)c2)C1=O	777753041	TVBIUCGACXQGQV-AWEZNQCLSA-N	430.831	1.886	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(CCC(=O)NNc2cc(Cl)nc(N)n2)cc1	779374914	IDZHIFHGQWYSJZ-UHFFFAOYSA-N	426.930	1.819	50	20	IDGD	
CCc1cnccc1CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	779410827	WXTWTLHNRSBLIC-UHFFFAOYSA-N	431.518	1.573	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@H](C(=O)NNC(=O)c2ccc(Cl)cc2F)[C@H](C)O)cc1	779532892	XCFBDCWCNMWEPI-ZBEGNZNMSA-N	443.884	1.276	50	20	IDGD	
Cn1cc(-c2n[nH]cc2C(=O)NNC(=O)c2ccc(CSc3nncn3C)cc2)cn1	780158802	IWERVZJVXFCFIK-UHFFFAOYSA-N	437.489	1.306	50	20	IDGD	
O=[N+]([O-])c1cc(S(=O)(=O)N2CCOCC2)ccc1OS(=O)(=O)CCCCCl	780664972	HNVNYYFLHHWTEO-UHFFFAOYSA-N	442.899	1.343	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)Cc1csc(NC(=O)C(C)C)n1	782351735	OLADMFMJTMZDFE-UHFFFAOYSA-N	432.502	1.522	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)c2ccc(S(=O)(=O)CC(N)=O)cc2)cc1Cl	782798570	KNSZVRYEUYPUMZ-UHFFFAOYSA-N	425.850	1.143	50	20	IDGD	
Cc1cc(C)c(NNC(=O)C(=O)Nc2cnn(CC(=O)N3C[C@H](C)O[C@@H](C)C3)c2)c(C)c1	783367244	WIFDVABLVMWUCC-IRXDYDNUSA-N	442.520	1.526	50	20	IDGD	
Cc1ccc(F)c(NNC(=O)C(=O)N2C[C@H](C(=O)N3CCOCC3)Oc3ccccc32)c1	784885026	STSPWGILDZGCIC-LJQANCHMSA-N	442.447	1.230	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)Nc1ccccc1OCC(F)(F)F	785024333	XGOSTXLHSIYBLI-UHFFFAOYSA-N	442.306	1.641	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cc(-c3cc(C)ccc3C)[nH]n2)cn1C	785131179	XFPDCWDINXGSRE-UHFFFAOYSA-N	438.444	1.218	50	20	IDGD	
Cc1nn([C@H]2CCS(=O)(=O)C2)c(C)c1NC(=O)C(=O)NNc1ccc(Cl)c(F)c1	785179851	UONDBSYBKFVEOP-LBPRGKRZSA-N	443.888	1.734	50	20	IDGD	
COc1cc(C(=O)NNC(=O)N2CCN(C)CC2)cc(OC)c1OCc1ccccc1	788167042	UDCKGIPRRKLMPT-UHFFFAOYSA-N	428.489	1.885	50	20	IDGD	
COc1nc(Br)ccc1NC(=O)C(=O)NNC(=O)c1ccc(C)c(F)c1	789588724	LOXONEXUJUBTPK-UHFFFAOYSA-N	425.214	1.700	50	20	IDGD	
CC(C)Oc1cc(NC(=O)C(=O)NN=c2sc3ccccc3n2C)ccc1C(N)=O	789747446	IJHSXKISVPZESX-UHFFFAOYSA-N	427.486	1.697	50	20	IDGD	
N#Cc1ccc(OC(F)F)c(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)c1	789810888	SLUSWAAGSUHXJX-YOEHRIQHSA-N	444.394	1.818	50	20	IDGD	
CCS(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2ccc(OC)c(OC)c2)s1	792217928	MNVZTNPLCFVHJZ-UHFFFAOYSA-N	427.504	1.703	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2c(C)c(C)nn2-c2ccc(Cl)cc2)n1	792267774	AROCJXNSVZEFAZ-UHFFFAOYSA-N	443.895	1.742	50	20	IDGD	
COc1c(NC(=O)C(=O)NNc2ncccc2C(F)(F)F)cc(Cl)cc1C(N)=O	793034798	SBZHBZWQGLUXAR-UHFFFAOYSA-N	431.758	1.943	50	20	IDGD	
CCCS(=O)(=O)Nc1cccc(NC(=O)C(=O)NNc2ccc3c(=O)[nH]ccc3c2)c1	793068742	CPBNUAYIHAIFIM-UHFFFAOYSA-N	443.485	1.762	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNS(=O)(=O)c1cc(C(=O)O)c(F)cc1C	793351802	ZTRWDLOYGRERGJ-UHFFFAOYSA-N	426.422	1.620	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3C[C@H](C)O[C@H](C)C3)cc2)n1	794090359	RRCGTBCPHJOZOF-GASCZTMLSA-N	432.502	1.263	50	20	IDGD	
Cc1cccc(-c2cc(Cl)ccc2NC(=O)C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)c1	796998230	CGBDGVZPDBWNCL-AWEZNQCLSA-N	449.916	1.836	50	20	IDGD	
Cc1ccc([C@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)cc1	797703443	WPCIEKUMBMEEHR-CABCVRRESA-N	425.507	1.143	50	20	IDGD	
CC(C)(C)n1ncnc1CNC(=O)NNC(=O)COc1ccc(Br)cc1	800028299	MRGKPEREMHPRAK-UHFFFAOYSA-N	425.287	1.705	50	20	IDGD	
CC(=O)N1CCN(S(=O)(=O)c2ccc(C(=O)NNC(=O)Nc3ccccc3)cc2)CC1	801991966	SECBCHSIDKQWQT-UHFFFAOYSA-N	445.501	1.006	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@@H]2CCCN(Cc3cccnc3)C2)cc1	802063832	DBNRGMVSNICVOH-MRXNPFEDSA-N	431.518	1.550	50	20	IDGD	
O=C(Cc1nc(-c2ccccc2)cs1)NNC(=O)CN1C(=O)NC2(CCCC2)C1=O	802578968	XPBGNWQYGOCYMK-UHFFFAOYSA-N	427.486	1.365	50	20	IDGD	
COCCOc1ccc(S(C)(=O)=O)cc1NC(=O)NNC(=O)c1ccccc1OC	806736194	KPBTZYJGFWAZQF-UHFFFAOYSA-N	437.474	1.590	50	20	IDGD	
Cc1cc(C)cc(-n2nc(NC(=O)C(=O)NNc3ccc(-n4ccnc4)nn3)cc2C)c1	807428556	BUKILODIYZMUPG-UHFFFAOYSA-N	431.460	1.855	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2nccnc2C2CCC2)cc1S(=O)(=O)NC1CC1	807461674	OLBFZGKCNXTALR-UHFFFAOYSA-N	444.517	1.575	50	20	IDGD	
COc1cc(C=NNC(=O)Cc2cc(O)nc(S)n2)cc(OC)c1OCC(F)F	807958736	FWTUOPAFIVCUSW-UHFFFAOYSA-N	428.417	1.825	50	20	IDGD	
CCOC(=O)c1cccc(NC(=O)c2cccc(NC(=O)C(=O)NNC(=O)OC)c2)c1	810382834	OELQWYULICQWNR-UHFFFAOYSA-N	428.401	1.441	50	20	IDGD	
COc1ccc(NC(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)cc1-n1nnnc1C	812931265	IZZIOMYFGGVAKF-UHFFFAOYSA-N	446.493	1.378	50	20	IDGD	
CC(=NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1)c1cc2c(cc1[N+](=O)[O-])OCO2	814746820	NOGLXWOYGUBNBU-UHFFFAOYSA-N	440.821	1.778	50	20	IDGD	
CN(C)c1ccc(C2(C(=O)OCC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)CC2)cc1	815306279	RMFKSOOSBOEHCR-UHFFFAOYSA-N	426.429	1.697	50	20	IDGD	
N#Cc1cc(NC(=O)C(=O)NNC(=O)COCc2ccccc2)ccc1Br	815569867	KMMJSXRJTGMYQF-UHFFFAOYSA-N	431.246	1.623	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCO1)C(=O)Nc1cc(Br)ccc1N1CCCC1	815778838	HSNZHBONLPBYAF-CQSZACIVSA-N	425.283	1.314	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)[C@H](NS(=O)(=O)C2CC2)C(C)C)cc1	816818243	VKDHQHAUNALOTJ-CXAGYDPISA-N	427.523	1.106	50	20	IDGD	
O=C(COC(=O)C1CCN(C(=O)/C=C\c2ccccc2)CC1)NNC(=O)c1ccccc1	818926822	VKBVODGXCXFQKG-QXMHVHEDSA-N	435.480	1.943	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)CNC(=O)c1cccc(Br)c1	825643617	GGFKONUSHVNMED-UHFFFAOYSA-N	435.278	1.447	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)c(C)c1	880228724	NNRZZTCZTYYTNQ-UHFFFAOYSA-N	434.518	1.192	50	20	IDGD	
O=C(COC(=O)c1ccc(N2CCOC2=O)cc1)NNC(=O)c1ccc([N+](=O)[O-])cc1	915509494	NNDHJQUDPYBJML-UHFFFAOYSA-N	428.357	1.169	50	20	IDGD	
COc1cccc(C[C@H](C(=O)NNC(=O)COc2ccc(F)cc2)n2nnnc2C)c1	915694910	JVRAFYOBPSXVCI-GOSISDBHSA-N	428.424	1.139	50	20	IDGD	
COc1ccccc1NCC(=O)NN=C(C)c1ccc(OCC(=O)N2CCOCC2)cc1	915919844	AHFLJHUIGLWYHM-UHFFFAOYSA-N	440.500	1.885	50	20	IDGD	
CCCn1nc(C(=O)NN=C(C)c2cccc(S(N)(=O)=O)c2)c2ccccc2c1=O	915946770	SNXZPMHMGUWWEM-UHFFFAOYSA-N	427.486	1.608	50	20	IDGD	
COc1ccc(C(=O)NN=C(C)c2ccc(S(=O)(=O)NCC(=O)O)cc2)cc1OC	916288739	BXOUAPBZENPBNY-UHFFFAOYSA-N	435.458	1.221	50	20	IDGD	
Cc1nn([C@@H]2CCS(=O)(=O)C2)c(Cl)c1C=NNC(=O)COc1ccc(C#N)cc1	916300048	JXOSKUOGFSIDFW-CQSZACIVSA-N	435.893	1.605	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@H]2CCN(c3cc(C)cc(C)c3)C2=O)c2ccccc2c1=O	919692300	MOFQFMAGAHTIDP-LJQANCHMSA-N	447.495	1.847	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)/C(=C/c1ccc(F)cc1)n1nnnc1C	920423456	WNUWTYCDAPXHIE-UNOMPAQXSA-N	448.462	1.878	50	20	IDGD	
O=C(CN1CCCC1=O)NNC(=O)c1ccc(S(=O)(=O)Nc2ccc(F)cc2)cc1	920827717	WVTRAEGZAVSQGO-UHFFFAOYSA-N	434.449	1.010	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)Nc2ccc(N3CCN(C)CC3)cc2C)cc1	920930973	YSBJHJGJEFUGAV-UHFFFAOYSA-N	427.505	1.987	50	20	IDGD	
CN1CCN(c2ncccc2CNC(=O)NNC(=O)CCSc2ccc(F)cc2)CC1	921248078	RANGDIUUHPIAHJ-UHFFFAOYSA-N	446.552	1.985	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1ccc(-n2cccn2)c(F)c1	1318807608	LWZFJUHBEXDWOU-UHFFFAOYSA-N	445.476	1.789	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)[C@H]2CC(=O)N(C)c3ccccc32)c2ccccc2c1=O	1321527228	RZWKPHCWHYAJHR-KRWDZBQOSA-N	433.468	1.889	50	20	IDGD	
COc1ccc(Cn2nccc2NC(=O)NNC(=O)COc2ccccc2O)c(OC)c1	1338482886	GSNXHDCMJRMBMW-UHFFFAOYSA-N	441.444	1.886	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2cc(-c3ccco3)nn2C)cc1	1339241370	IDFVQWIBLFICGU-UHFFFAOYSA-N	446.489	1.462	50	20	IDGD	
O=C1CCc2ccc(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)[C@@H](F)Cl)C4)nc2N1	1777818947	NWKMDSZVLYDINS-AKCHCHLHSA-N	438.887	1.628	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2)c1occc1Br	1778186697	MPBYPSYWJGBSRY-OGHNNQOOSA-N	449.729	1.769	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc4ncccn4n3)C2)C1	1778467554	PTGPMKWBZFSDGI-FZKQIMNGSA-N	436.310	1.346	50	20	IDGD	
Cc1nc2sccn2c1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2	1779152569	MFENMFGLNBEQPE-PJIJBLCYSA-N	440.953	1.431	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](Br)CC)C2	1779536176	KTKDNOHLWMQNEE-NXEZDXNNSA-N	444.370	1.365	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccn(C(F)F)n3)C2)C1	1779615449	CMBOIDLGOKBTIK-JKSUJKDBSA-N	425.263	1.958	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(CCN(C(=O)c3cncc4cnccc34)C2)C1	1780010869	OIUKKZJNSOURKB-LJQANCHMSA-N	433.306	1.858	50	20	IDGD	
COc1cccc(OC)c1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2	1780310864	UEULMOSFCANGFQ-AVBTWRTFSA-N	440.924	1.431	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(OC)cc(OC)c3)C2)C1	1780663271	BLBARBBNVBVDDI-XLIONFOSSA-N	426.897	1.401	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnc(O)nc1O)C2	1780712216	XKDHUPKPYHTJNY-NXOUGTEYSA-N	447.319	1.252	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc4nncn4c3)CCO2)C1	1781229898	KPRQHCQNISULLV-QZTJIDSGSA-N	426.304	1.409	50	20	IDGD	
COc1ccc(CC(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)cc1O	1781325676	PPYPSJQIQVKKBO-AEFFLSMTSA-N	445.285	1.464	50	20	IDGD	
O=C(Cc1ccc2c(c1)CCO2)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781332587	BTCPRLIEMPVTGI-MJGOQNOKSA-N	441.297	1.684	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](F)Br)C3)C2)cc1OC	1781332900	CHUUXCSTLXPUPH-MAUKXSAKSA-N	445.285	1.838	50	20	IDGD	
CC(=O)N(C)[C@@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)Br)C1	1781998772	HDFAYZFBTGCQGV-ZFHGCVPZSA-N	432.359	1.151	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(Cl)cnc1O)C2	1782168761	UKZSQXDZQRLEEO-QMTMVMCOSA-N	446.331	1.822	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3c(C)nc4ccc(F)cn34)C2)C1	1782305197	XGBPVFWMJKDJIO-YWZLYKJASA-N	438.887	1.479	50	20	IDGD	
CCOc1ccsc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](Cl)COC)C[C@@H]21	1783396650	UXEZGPIEZAHCEX-YXWQFLTLSA-N	430.954	1.994	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](C)Br)C2)C1	1783534721	NQNBGYPKVXALRG-DJJJIMSYSA-N	435.322	1.870	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)c3ccco3)[C@H]2C1	1783554631	NXEBXVNDFRERQH-IICXDKKESA-N	429.311	1.324	50	20	IDGD	
O=C(Cn1cnc2ccccc21)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1783750789	LZBJBYYHGHOHTF-FUHWJXTLSA-N	439.285	1.557	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)Cc3ccc(OC)cc3C#N)CCO2)C1	1783882239	WVDIHNVXOHFBKA-WIYYLYMNSA-N	435.908	1.193	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(CCN(C(=O)c3cccc4c3CCCC4)C2)C1	1785092104	WFOJVZSSLHSFQK-VWLOTQADSA-N	448.328	1.003	50	20	IDGD	
CC(C)(C)OC(=O)NCC(C)(C)C(=O)N1CC[C@]2(CN(C(=O)[C@H](F)Cl)CCO2)C1	1785737315	ZEFOEMFNMSKPDU-DJJJIMSYSA-N	435.924	1.902	50	20	IDGD	
CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]2C1	1787450541	ZEMZIYVANIFTER-YJOCZYATSA-N	442.875	1.789	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc([N+](=O)[O-])o3)C[C@@H]21	1788762171	NJADWSMRPZMQSH-YDHLFZDLSA-N	425.514	1.633	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21)c1ncccc1Br	1788961174	NNVNGFCFLPSFQQ-WRZDFSGXSA-N	434.693	1.972	50	20	IDGD	
CCc1nc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)CBr)C[C@@H]32)co1	1788989545	DKLBXGWXJQSRPU-ABHRYQDASA-N	428.327	1.861	50	20	IDGD	
CCOc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]32)nn1	1789397148	OVOJIDDAWXOVGZ-NGOJXBLDSA-N	445.347	1.705	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nc4ccccc4n(C)c3=O)C[C@@H]21	1789860254	XXJBGMVUCKHTLA-XSWJXKHESA-N	446.935	1.544	50	20	IDGD	
CN(C)c1ncc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]3C2)o1	1789922402	MCPVYPYRCCDTGK-ZPFDUUQYSA-N	433.278	1.024	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc4ccnn34)[C@H]2C1	1790341027	CCEAEQYGUBNRJF-DNUAJFIVSA-N	449.349	1.959	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)n3cccn3)C[C@@H]21	1790963739	LAPKLXVYIKGKNJ-QXKUPLGCSA-N	427.343	1.597	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1ccc(C2(NC(=O)c3cccc(O)n3)CCC2)cc1	1791599898	ZUBGZGBUPUSSIQ-UHFFFAOYSA-N	425.489	1.908	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)COc1cccc(Cl)c1	1792749429	RWGUTBVQHLSXHH-ZDFLXESQSA-N	431.316	1.562	50	20	IDGD	
CC(C)(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](O)CCl)C2)NC(=O)OC(C)(C)C	1793149429	LVDJTHXRTWCEPD-LXTVHRRPSA-N	431.961	1.918	50	20	IDGD	
N#CCCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](Br)Cc1ccccc1)C2	1795420537	GCKYBRJNJQLBCW-SFNKJDCFSA-N	434.334	1.886	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)c1cc(-c2ccccc2)on1	1796185561	AGZORFZOYYIZGR-ACDBMABISA-N	445.284	1.587	50	20	IDGD	
CC(C)(C)OC(=O)N1CC=C(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Cl)C1	1796365474	XROGCOHGYUKNLW-LXTVHRRPSA-N	431.892	1.288	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](C)[C@H]1SC(=N)NC1=O	1796876778	FIBNOYCRTNHFKI-HTXLXMOSSA-N	445.383	1.601	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2ncsc2[nH]1	1797983048	QVTDDHFYQLKJFX-XHSYRHOGSA-N	427.324	1.611	50	20	IDGD	
Cc1c(F)cccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnccc1C(=O)NN	1798439686	WXWOHCSHJHIVFM-QDMKHBRRSA-N	425.464	1.698	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1c(C)n[nH]c1C	1798692015	XFOQWTREIBLFQM-MVRRYPJTSA-N	425.493	1.412	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1nn(C)c(C)c1Br	1798715590	JGJVTCMOWSBKPK-OPDFLTKYSA-N	447.761	1.712	50	20	IDGD	
O=C(Cc1[nH]nc2c(Cl)cccc12)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2	1799075728	MNUFVDNCQJFFPG-BPKTZYHTSA-N	429.279	1.883	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(O)cc1F	1799562418	BYHSSCUYJLANSF-OVZMXSCWSA-N	429.286	1.766	50	20	IDGD	
CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2	1799797315	MLYYPXOFTAMRFE-OXUXUCFPSA-N	428.848	1.398	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)Oc1ccccn1	1801369154	MGOQLSQMXZIDNZ-AQDIXCGQSA-N	426.311	1.222	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)CN2CCSCC2)[C@@H]1c1cccnc1	1802448181	HXMDKWXZSBUJRM-AOIWGVFYSA-N	440.997	1.390	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]1c1cccnc1	1803145806	IGYJVHARHXLIGO-MTHXSQLBSA-N	449.935	1.443	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CCOC1	1803235806	VHUDFIPOZVFGSW-LVQVYYBASA-N	431.445	1.808	50	20	IDGD	
CC(=O)NC(C)(C)C(=O)NC[C@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1	1803589832	VPXMETHZUYHLQA-WBVHZDCISA-N	439.354	1.787	50	20	IDGD	
Cc1cncc(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)c1	1805768200	ZQGVCIIDTXHFQB-SIKLNZKXSA-N	444.300	1.098	50	20	IDGD	
C[C@H](Nc1cccnc1)C(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1	1807149635	AJNRVVFONPWHJJ-WQCNXYOZSA-N	431.924	1.583	50	20	IDGD	
O=C(C[C@@H]1CCCCO1)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1	1809975154	VKIOYYYHVDOXTF-FQEVSTJZSA-N	428.338	1.170	50	20	IDGD	
CC(C)CNC(=O)C(=O)N1CC[C@H](CNC(=O)[C@@H](C)Br)[C@@H]1c1cccnc1	1812864862	SMYQMHWWOHBOFQ-BMFZPTHFSA-N	439.354	1.643	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2cc(F)cn2C)[C@H]1c1cccnc1	1813069818	DACIPULMSXSYKP-IERDGZPVSA-N	444.511	1.252	50	20	IDGD	
Cc1nc(C(=O)N2CC[C@@H](CNC(=O)C(Cl)Cl)[C@@H]2c2cccnc2)c(=O)[nH]c1C	1813077869	OOSDEQVRVLHTIG-ZFWWWQNUSA-N	438.315	1.905	50	20	IDGD	
CCS(=O)(=O)N[C@H](C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)C(C)(C)CCl)n[nH]1	1814695623	ZDTZSMVCWMJODJ-TZMCWYRMSA-N	447.989	1.995	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2ON=C(c3ccccc3)O2)[nH]n1)[C@@H](O)CCl	1814872207	FNBFTFZQGSMRRH-AVYPCKFXSA-N	447.879	1.736	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2nc(O)n3c2CCCC3)[nH]n1)[C@@H](O)CCl	1814872351	HDEWEEGDICDORT-JSGCOSHPSA-N	436.900	1.554	50	20	IDGD	
C[C@H](C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1)n1cccc1	1815347682	KJTKQZFIGYOCBP-CZUORRHYSA-N	438.318	1.111	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](F)Br)CC2)c1cc(O)nc(O)c1	1816727035	CFSPNBXYPMLHHU-MADCSZMMSA-N	445.270	1.866	50	20	IDGD	
C[C@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)c3cc(O)nc(O)n3)sc2C1	1817109055	UYGKYFLPYNFNAZ-BQBZGAKWSA-N	442.295	1.354	50	20	IDGD	
O=C(Cn1cccc([N+](=O)[O-])c1=O)N[C@H]1CCc2nc(NC(=O)[C@@H](F)Cl)sc2C1	1817133852	IYFFRCBIGVIROA-ISVAXAHUSA-N	443.844	1.360	50	20	IDGD	
Cc1cc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)CCC(=O)NN(C)C)CC3)cn1C	1817700979	GXQXWKMUWOWNQT-AWEZNQCLSA-N	432.550	1.389	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)COC(=O)C(F)(F)F)n[nH]1	1819315883	BZJNIMJNIJVZPF-KOLCDFICSA-N	440.806	1.761	50	20	IDGD	
CC[C@@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)Cn2cc(C)c(O)nc2=O)[nH]n1	1820861303	WWSCAQFBXUQVCZ-OCCSQVGLSA-N	436.900	1.690	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1)C1CCC2(CC1)OCCO2	1821819610	RQNGPTSYZZWBIU-HOTGVXAUSA-N	440.928	1.935	50	20	IDGD	
Cc1ccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)c(O)n1	1822415104	TXJRLKHPMQSDSZ-MRXNPFEDSA-N	443.508	1.498	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)/C=C/c2cnccn2)[nH]n1	1822416822	QHQVNZXXBKGKJU-NADMHLTPSA-N	440.508	1.278	50	20	IDGD	
CC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)Cn1cc([N+](=O)[O-])cn1)CC2	1822840705	BUSMBXUVFZDFLB-KOLCDFICSA-N	426.886	1.877	50	20	IDGD	
CCNC(=S)NCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CO[Si](C)(C)C)CC2	1824502868	PFIHJDVXGRIDCS-NSHDSACASA-N	443.671	1.391	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)Cn1ccncc1=O)CC2	1825646505	DAXLSKRSOFOKPL-VHSXEESVSA-N	440.323	1.095	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](N)Cc2cccnc2)CC1	1827642962	DSEXCOSGRURYCY-UFYCRDLUSA-N	436.984	1.825	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)C23CC(F)(C2)C3)CC1	1828923781	XSBVPMNZGYKIQR-WDGBRCNXSA-N	443.523	1.811	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(F)(F)C(F)F)C2)C1	1830535138	JUYZETITTOUJTC-YGRLFVJLSA-N	449.239	1.374	50	20	IDGD	
Cc1ccc2cc(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)[C@H](O)CCl)CCO4)ccc2n1	1830727814	GMVJNIKUAYMFMG-DENIHFKCSA-N	447.919	1.213	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnn(C(C)(C)C)c3)CCO2)C1	1833455630	WYJDNJPKZKXQKH-UZLBHIALSA-N	426.945	1.726	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)c3cccc(=O)n3O)CC2)CC1	1833531528	RZMOBFRBIVCPGV-KRWDZBQOSA-N	438.956	1.678	50	20	IDGD	
C[C@@H](C(=O)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1)n1cccc1C=O	1835957659	CSRCRLNBWOHPAG-SCLBCKFNSA-N	432.304	1.122	50	20	IDGD	
CCc1[nH]nc(C(=O)N2CCO[C@@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)c1Cl	1836227218	BYTNYORQZMLCDZ-IBGZPJMESA-N	447.363	1.961	50	20	IDGD	
CC(C)=CCCC(=O)NC1CCN(C2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1	1836379525	JZTRQBHSJNEDPL-UHFFFAOYSA-N	435.613	1.677	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc4c(C)cccc4[nH]3)CCO2)C1	1836918533	BFZOBVQMVCNZMQ-HTAPYJJXSA-N	449.935	1.800	50	20	IDGD	
Cc1nc(C(=O)N2CCO[C@]3(COCCN(C(=O)CCBr)C3)C2)sc1C	1838406248	UJBJRIMKGIOHPY-KRWDZBQOSA-N	446.367	1.615	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C=C/c3ccc([N+](=O)[O-])o3)C2)C1	1839141286	DDBUZNVIWDLOHM-GJWPRGSGSA-N	441.868	1.675	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(Cl)cnc3OC)C2)C1	1839141530	KRWQZRUOGUDINB-BEFAXECRSA-N	446.331	1.831	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3COc4ccccc4O3)C2)C1	1839142463	PWPRNDSWAKPYSO-RRMPHLOHSA-N	438.908	1.300	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(F)cnc3Cl)C2)C1	1839145440	HROLRQMCZZGCMK-KSSFIOAISA-N	434.295	1.962	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)C3CC(F)(F)C3)C2)C1	1839150022	YDBOSFQUZAXCQC-HOTGVXAUSA-N	429.291	1.724	50	20	IDGD	
Cc1ccc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)o1	1839156362	NKPJQTGGTOEOOP-RTBURBONSA-N	433.332	1.823	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(OC)ccc3C)CCO2)C1	1839360358	CGJHXILXYOSTJV-NQIIRXRSSA-N	440.924	1.327	50	20	IDGD	
CC(C)c1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)no1	1840031424	PNEAQYWWDBXOEI-UGSOOPFHSA-N	444.326	1.651	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3nc(C(C)C)cs3)C2)C1	1840150246	IICYRHHIZPGDFX-KUHUBIRLSA-N	445.969	1.590	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC2(CCCN2C(=O)[C@H](O)CNC(=O)OC(C)(C)C)C1	1841298037	QHNPEKCQGIRKEM-QWHCGFSZSA-N	448.358	1.106	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCO)C(=O)N1CCCC12CN(C(=O)CCBr)C2	1841430101	RFPZOOCUVRAQAY-ZDUSSCGKSA-N	448.358	1.251	50	20	IDGD	
C=CCSCC(=O)N1CCCC12CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2	1841884500	LBKFFWPBCGQEAQ-UHFFFAOYSA-N	445.589	1.455	50	20	IDGD	
Cc1cc(C(=O)N2CC3(CCCN3C(=O)c3ccc(B(O)O)cc3)C2)c2cc(O)ccc2n1	1843011559	QFRKSGJZBRQBRW-UHFFFAOYSA-N	445.284	1.059	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)[C@H]1Cc3ccccc3O1)C2	1843416260	PTMWUJVVAIQNMG-KWXFCVSUSA-N	435.484	1.328	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)/C=C/C(=O)c2cccs2)C1	1843418498	BTRATADWHHNOMA-SNAWJCMRSA-N	439.497	1.003	50	20	IDGD	
Cc1nc2cccc(C(=O)N3CCCC34CN(C(=O)c3ccc(B(O)O)cc3)C4)c2s1	1843668089	XRJWFEFQACBHSN-UHFFFAOYSA-N	435.314	1.415	50	20	IDGD	
Cc1ccc(=O)n(C(C)(C)C(=O)N2CCCC23CN(C(=O)[C@@](C)(Cl)CCl)C3)n1	1844354513	RGMAUMZRFOEKFE-SFHVURJKSA-N	429.348	1.727	50	20	IDGD	
CC(=O)N/C(=C\c1ccco1)C(=O)N1CC2(CCCN2C(=O)[C@@H](F)Br)C1	1845219344	JPNQTHIAEHWHBJ-YLHGKKIISA-N	428.258	1.651	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC12CN(C(=O)CCNC(=O)c1ccc[nH]1)C2	1846069133	JXICCSXJJGUVHX-ZDUSSCGKSA-N	425.327	1.512	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCCC12CN(C(=O)c1ccc3c(c1)n(C)c(=O)n3C)C2	1846070497	MIZWRODPVQFOSM-CQSZACIVSA-N	449.349	1.868	50	20	IDGD	
CSCC[C@H](NC(=O)c1ccco1)C(=O)NNC(=S)NCCc1cccs1	11515340	DWLKXKINCVJXKY-ZDUSSCGKSA-N	426.589	1.931	50	20	IDGD	
CCC(C)(C)C1CCC2(CC1)NC(=O)N(CC(=O)NNC(=O)Cn1nc(C)cc1C)C2=O	20917946	BRDPRPFQLBKCPV-UHFFFAOYSA-N	446.552	1.564	50	20	IDGD	
O=C(CNc1cccc(C(F)(F)F)c1)NNC(=O)c1csc(N2CCOCC2)n1	111034082	WHGJVACSRXSTIA-UHFFFAOYSA-N	429.424	1.872	50	20	IDGD	
C[C@@H](NC(=O)c1cccc(Cl)c1Cl)C(=O)NNC(=O)CNC(=O)c1cccs1	725740626	XJTFNQLXYLRNSU-SECBINFHSA-N	443.312	1.751	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cccn2C)cc1S(=O)(=O)N[C@H]1CCCC[C@@H]1C	726540524	GXDCLDGQUPFRHR-HOCLYGCPSA-N	448.545	1.966	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)CS(=O)(=O)NC2CCC(C)CC2)cc1OC	726869942	YGSJNZKDYLJXQE-UHFFFAOYSA-N	427.523	1.353	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H]2CCCN2C(=O)OCC(F)(F)F)c1	727788509	OMEYZLWZDJDUTP-GFCCVEGCSA-N	437.396	1.014	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)c2ccc3c(c2)OCCO3)ccc1OCC(=O)OC	728462359	MUBLYDYNOAPUMO-UHFFFAOYSA-N	430.413	1.483	50	20	IDGD	
Cn1cc(S(=O)(=O)NNC(=O)c2ccc(Br)cc2Cl)cc1C(=O)O	728853675	YYWQVDNPOQTPOK-UHFFFAOYSA-N	436.671	1.763	50	20	IDGD	
COc1ccc(NNC(=O)c2ccc(S(=O)(=O)N3CCN(C(C)=O)CC3)cc2)cc1	729273535	WJLWDWRYATWXBH-UHFFFAOYSA-N	432.502	1.305	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)c1ccc2c(c1)C(=O)N(Cc1ccco1)C2=O	730778388	HJONMYFUZCCXQN-UHFFFAOYSA-N	435.392	1.621	50	20	IDGD	
Cc1cccc(N2C(=O)N[C@@H](CCC(=O)OCC(=O)NNC(=O)c3ccccc3)C2=O)c1	730869221	OGBNHMPKCSACBX-KRWDZBQOSA-N	438.440	1.204	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CN2CCN(CC(=O)N[C@H]3CCC[C@H](C)C3)CC2)cc1	731214091	ARPGEHYOOWTAFA-ICSRJNTNSA-N	429.565	1.069	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)NC1CCN(CC(=O)N(C)C)CC1	731761757	BZJBEEVXGYCZHJ-MRXNPFEDSA-N	441.532	1.490	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)CCNS(=O)(=O)c1ccc(C(C)=O)cc1)c1ccccc1	732292140	SEJBKLLRKRALQJ-IBGZPJMESA-N	431.514	1.899	50	20	IDGD	
C[C@H](NC(=O)CC1CCCCC1)C(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	732334743	FUTMDAFRLFIOIV-ZDUSSCGKSA-N	434.449	1.374	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)NCCCNC(=O)c1cccc(F)c1	732469501	GWLUNSHFTOLBBH-UHFFFAOYSA-N	433.396	1.263	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2ccccc2NC(=O)C(C)(C)C)n1	733501534	GQROTINCUYYTLI-UHFFFAOYSA-N	432.502	1.983	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cnn(C)c2)cc1	735470686	HAFLTPLMSWNNBM-UHFFFAOYSA-N	429.458	1.304	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)Cc1ccc(S(=O)(=O)CC(F)(F)F)cc1	736542878	CLBPGHWAZOIMOO-UHFFFAOYSA-N	448.394	1.931	50	20	IDGD	
CCOc1ccc(/C=C(\C#N)C(=O)N2CCN(c3cc(N4CCOCC4)ncn3)CC2)cc1	737999027	GMIKBUSEGZBLCV-HMMYKYKNSA-N	448.527	1.968	50	20	IDGD	
O=C(CN1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O)NNC(=O)c1cc2c(s1)CCCCCC2	742480711	NGTGUITWJBWNCY-HLNSBACISA-N	431.514	1.331	50	20	IDGD	
CC(=O)N[C@H](CC(=O)NNC(=O)c1nn(-c2ccccc2)cc1O)c1ccc(F)cc1F	743293369	XGJHCVZETDOTBT-QGZVFWFLSA-N	443.410	1.885	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)c1ccccc1NS(=O)(=O)CC	743737866	GIHGGSQWFVIRJP-UHFFFAOYSA-N	429.502	1.822	50	20	IDGD	
CC(C)(C)CC(=O)N1CSC[C@@H]1C(=O)OCC(=O)NNC(=O)c1cccc(C#N)c1	744974543	RXVVZQTVUWLBBP-OAHLLOKOSA-N	432.502	1.200	50	20	IDGD	
C[C@@H](C(=O)OCC(=O)NNC(=O)c1ccc(Cl)cc1)n1nnc(-c2ccccc2)n1	745680837	GZLMWYDDGUIYSZ-LBPRGKRZSA-N	428.836	1.559	50	20	IDGD	
CN(C)c1cc(CNC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c2ccccc2n1	745925238	IRUWZQKYFVQKIW-UHFFFAOYSA-N	445.483	1.692	50	20	IDGD	
COCCS(=O)(=O)c1ccc(C(=O)NNC(=O)C2=S=C3CC[C@H](C)CC3=C2)cc1	749564819	XTYYPYWAAOVFLU-ZDUSSCGKSA-N	436.555	1.706	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(Br)s1)NNC(=O)c1ccccc1F	749837225	BNFZFUMILPDYRG-UHFFFAOYSA-N	436.284	1.389	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)N[C@H]1CCN(c2cccc(Cl)c2)C1=O	750277402	VRXVLWGAQXGXIT-ZDUSSCGKSA-N	435.893	1.267	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)[C@H]1CCCN(C(=O)c2ccc3n[nH]cc3c2)C1	751291514	VQPHJGXNDJRGFT-YWZLYKJASA-N	449.467	1.403	50	20	IDGD	
CC(=O)N1CCc2cc(Br)c(S(=O)(=O)NNC(=O)c3ccc(C)o3)cc21	753086299	SRKQFWBGKPOREE-UHFFFAOYSA-N	442.291	1.883	50	20	IDGD	
CC[C@H](CNC(=O)NNC(=O)c1csc(N2CCOCC2)n1)Oc1cccc(F)c1	753345904	GDSHCSJAVOMFMT-CQSZACIVSA-N	437.497	1.920	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCCS1(=O)=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1	753767714	DCSHXGITKNRKCP-KRWDZBQOSA-N	439.497	1.663	50	20	IDGD	
O=C(CCSc1ccc(F)cc1)NNC(=O)NC1CCN(S(=O)(=O)C2CC2)CC1	753965035	FKFXHQFJKBWBAK-UHFFFAOYSA-N	444.554	1.595	50	20	IDGD	
COCC(=NNC(=O)C[C@@H]1c2cc(OC)c(OC)cc2CCN1S(C)(=O)=O)C1CC1	754256470	CIYPPAIXRSFBBL-QGZVFWFLSA-N	439.534	1.481	50	20	IDGD	
C=CCn1c(SCC(=O)NNC(=O)Cc2cc[nH]n2)nnc1-c1ccc(Cl)cc1	755284210	QBSVTBKCVIZBKS-UHFFFAOYSA-N	431.909	1.990	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)Nc1cc(S(=O)(=O)N(C)C(C)C)ccc1C	755961144	YNROXAVCTHXDLU-AWEZNQCLSA-N	430.527	1.228	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)Nc1cccc(CS(=O)(=O)NC(C)(C)C)c1	756207379	RQIYYLAXLPFOCE-ZDUSSCGKSA-N	430.527	1.109	50	20	IDGD	
O=C1C[C@@H](Cc2ccc(NC(=O)NNC(=O)c3nnc(O)c4ccccc34)cc2)C(=O)N1	756815857	ORMXEKHDSNRHTN-GFCCVEGCSA-N	434.412	1.007	50	20	IDGD	
Cc1cnn(-c2ccc(S(=O)(=O)NNC(=O)c3nnc(-c4ccccc4)o3)cc2F)c1	757657025	TWTWAAXKMMBXNC-UHFFFAOYSA-N	442.432	1.993	50	20	IDGD	
CS(=O)(=O)Cc1ccc(NC(=O)NNC(=O)c2cc(Br)c[nH]2)cc1F	757674282	DOAKZXVLIDNNHW-UHFFFAOYSA-N	433.259	1.927	50	20	IDGD	
CC[C@H](C)NS(=O)(=O)c1cccc(NC(=O)NNC(=O)COc2ccccc2C#N)c1	757709183	LREIDPFXXVEDLH-AWEZNQCLSA-N	445.501	1.867	50	20	IDGD	
Cn1cnn(-c2ccc(NC(=O)NNC(=O)c3ccc(Br)s3)cc2)c1=O	757861828	AOGLQYBNUYOAEB-UHFFFAOYSA-N	437.279	1.862	50	20	IDGD	
COC[C@H](NC(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccc(Cl)cc1)C(N)=O	760043174	NBXBQHCNSZIGIG-ZGUWOUCSSA-N	426.864	1.641	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)[C@@H]2COc3ccc(Br)cc32)C[C@@H](C)O1	760120516	XVWTYHXAAWCQBU-LALPHHSUSA-N	426.311	1.572	50	20	IDGD	
Cc1cc(Br)cn2cc(CNC(=O)NNC(=O)C(=O)Nc3ccccn3)nc12	760145284	TXETXDQHQHCSBT-UHFFFAOYSA-N	446.265	1.269	50	20	IDGD	
NC(=O)[C@@H]1CC[C@H](CNC(=O)NNC(=O)COc2ccc(OCc3ccccc3)cc2)O1	760204247	PEULQLWBXWJVRV-MOPGFXCFSA-N	442.472	1.008	50	20	IDGD	
CN(C)N(C(=O)c1cc(F)c(F)cc1I)[C@@H]1CCS(=O)(=O)C1	760319429	ZCILBIGTNPPCLE-MRVPVSSYSA-N	444.241	1.675	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)[C@]23CCC(=O)N2c2ccccc2S3)n1	761611474	QYLCSFZYLKMRPG-LJQANCHMSA-N	446.510	1.314	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)[C@@H](c1ccccc1)N1CCN(C)CC1	762371371	WXXSRPRBQHVBRU-OAQYLSRUSA-N	428.558	1.923	50	20	IDGD	
O=C(NNc1nccc(N2CCOCC2)n1)c1ccc(CS(=O)(=O)c2ccccc2)o1	762868755	RKSWBIHLQMKRAB-UHFFFAOYSA-N	443.485	1.637	50	20	IDGD	
O=C(NNC(=O)c1ccccc1O)C(=O)Nc1ccnc(OCC(F)(F)C(F)F)c1	763526808	KRQCVWFMJQDMET-UHFFFAOYSA-N	430.314	1.466	50	20	IDGD	
C[C@H](c1cccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)c1)N1CCOCC1	763547575	FFKHUZNSVBIPDW-CQSZACIVSA-N	440.456	1.208	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(C)c(S(C)(=O)=O)c2)c2ccccc2n1	763614610	GVWBRNBHBOMWJO-UHFFFAOYSA-N	440.481	1.655	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(Cl)c2-n2cncn2)c1	763624887	OXMWCUBDJCWAJX-UHFFFAOYSA-N	428.836	1.394	50	20	IDGD	
COc1cc(OC)c(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)cc1Cl	763682655	YSAGVVZIHWVIIW-UHFFFAOYSA-N	432.820	1.394	50	20	IDGD	
CN(C)CCOc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)cc1	763695755	WASHLULWFSAODM-UHFFFAOYSA-N	434.880	1.445	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)C(=O)Nc2cnc(-c3ccccc3)s2)c2ccccc2c1=O	763791789	YOFKNOSFPGRNSX-UHFFFAOYSA-N	448.464	1.457	50	20	IDGD	
CCNC(=O)N1CCc2ccc(NC(=O)C(=O)NNC(=O)COc3ccc(C)cc3)cc21	763820893	LYRDPWNDGNHIJD-UHFFFAOYSA-N	439.472	1.252	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)N(C)CC3)cc1	763860431	GXGDJCJVGDURSI-CQSZACIVSA-N	426.473	1.631	50	20	IDGD	
O=C(NNC(=O)C1=S=C2CCCCCCC2=C1)C(=O)Nc1ccnn1-c1ccncc1	763910701	DAIPENXBTPFHGP-UHFFFAOYSA-N	438.513	1.725	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc(COc3ccccc3)o2)n(CCC#N)n1	763949258	IJGNGDNHVIYJMK-UHFFFAOYSA-N	436.428	1.677	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)C(=O)Nc1ccccc1Oc1cccc(F)c1	764002240	KQNKAOGRAWLKKO-LBPRGKRZSA-N	435.433	1.139	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccc(C(=O)NC(C)C)cc1C	764131094	DQALDSXFZLJXQS-UHFFFAOYSA-N	426.473	1.470	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(NC(=O)OC(C)(C)C)nc2)c1O	764133819	XVWAHXSYLPXSIU-UHFFFAOYSA-N	445.432	1.543	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)ccc1Cl	764151983	BJVNWLBFUKMSTE-MRXNPFEDSA-N	431.832	1.606	50	20	IDGD	
CCOC(=O)/C=C/c1ccc(NC(=O)C(=O)NNC(=O)CCc2ccccc2O)cc1	764289840	YYZZIARUSZRNEM-NTEUORMPSA-N	425.441	1.687	50	20	IDGD	
COC(=O)CCSc1cccc(NC(=O)C(=O)NNC(=O)Cc2ccccc2F)c1	764320281	WJOKISXWWYIQRP-UHFFFAOYSA-N	433.461	1.810	50	20	IDGD	
O=C(NNC(=O)c1cc2ccccc2o1)C(=O)Nc1cc(F)cc(N2CCOCC2)c1	764331377	VGNPLXSPZARUNC-UHFFFAOYSA-N	426.404	1.808	50	20	IDGD	
CC(C)Oc1ccc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1C#N	764350736	JWNACDNGSVPQCL-UHFFFAOYSA-N	432.440	1.931	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)C(=O)Nc1cccc(COc2ccc3c(c2)OCO3)c1	764352955	FUEDYJIDEMAPOJ-UHFFFAOYSA-N	448.435	1.718	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)C(=O)Nc2cccc3c2CCN(C(=O)OC(C)(C)C)C3)cn1	764358450	DSXXBQNAOPVGKS-UHFFFAOYSA-N	442.476	1.113	50	20	IDGD	
CC(=O)N1CCc2cc(NC(=O)C(=O)NNC(=O)CSc3ccccc3O)ccc21	764402067	XHGDFKQZFBPASQ-UHFFFAOYSA-N	428.470	1.179	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)Nc2nc(CS(C)(=O)=O)no2)c(C)n1-c1ccccc1	765246154	YTEGZJDQGZIZGP-UHFFFAOYSA-N	432.462	1.488	50	20	IDGD	
CC(C)(C)OC(=O)N1CCO[C@H](C(=O)NNC(=O)c2cc(F)ccc2Br)C1	765406686	SYBWFIDYXVDUFZ-ZDUSSCGKSA-N	446.273	1.985	50	20	IDGD	
CCOc1nccc(C)c1C(=O)NNC(=O)CN1CCN(Cc2ccc(C)cc2)CC1	765423015	GTIYIUNLUXPXRW-UHFFFAOYSA-N	425.533	1.676	50	20	IDGD	
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	765895656	XNNBZGXCUXKMMC-KXBFYZLASA-N	434.500	1.398	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)CSc3nc(C)cc(C)n3)CC2)cc1	766647436	FBZJKYZNLIPAKH-UHFFFAOYSA-N	442.589	1.459	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(O)c(C(=O)NNC(=O)c2cc(-c3ccccc3)on2)c1	767011068	BFMRLXNSUQOZSW-UHFFFAOYSA-N	430.442	1.372	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)CO[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1	768067408	LGFATYLNTHPCNY-QGZVFWFLSA-N	449.504	1.715	50	20	IDGD	
Cc1noc(C)c1S(=O)(=O)N1CCC[C@@H](C(=O)NNc2cc(C#N)cc(Cl)n2)C1	768694858	GQBQXLSZXYHIGL-CYBMUJFWSA-N	438.897	1.756	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCOCC2)cc1NC(=O)NNc1cccc(C#N)c1	769926045	LKPMGFVWDMCNCX-UHFFFAOYSA-N	431.474	1.736	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)c3cccc(S(=O)(=O)NC4CC4)c3)nc21	770965552	CPLQLTFGWHUQMO-UHFFFAOYSA-N	445.505	1.485	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1ccccc1NS(=O)(=O)c1ccc(F)cc1	771890459	RWIYWXNAGCEAAW-GFCCVEGCSA-N	437.449	1.729	50	20	IDGD	
O=C(C[C@@H](O)c1ccc(Cl)cc1)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	772809148	DPFHRYKYLRWRLO-LJQANCHMSA-N	444.919	1.369	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)c1sccc1S(=O)(=O)N(C)C	772955475	UQVZHQCVJPDKOD-SNVBAGLBSA-N	431.923	1.880	50	20	IDGD	
C[C@H](NC(=O)c1n[nH]c2ccccc12)C(=O)NNC(=O)[C@@H](C)Oc1cccc(Cl)c1	772991623	WPDGOWDKJUJICZ-NWDGAFQWSA-N	429.864	1.950	50	20	IDGD	
CC(=O)NC[C@H]1CCn2ncc(C(=O)NNC(=O)[C@@H](C)Oc3cccc(Cl)c3)c2C1	772994311	KCMBWYAPLGUVPU-OCCSQVGLSA-N	433.896	1.464	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)c2nnn(-c3ccc(OC(C)C)cc3)c2C)c1	773086936	HIWVVXCCQYEVJO-UHFFFAOYSA-N	437.460	1.791	50	20	IDGD	
C#CCOc1ccccc1NC(=O)C(=O)NNC(=O)c1ccc(OCCC)c(OC)c1	773500161	RHUAIMUHLIHYIR-UHFFFAOYSA-N	425.441	1.896	50	20	IDGD	
N#Cc1cccc(NNC(=O)C(=O)Nc2cc(Br)cnc2-n2cccn2)c1	773681403	SSJSJMAOJYTCPB-UHFFFAOYSA-N	426.234	1.983	50	20	IDGD	
CN1CCN(CC(=O)N(C)c2ccc(NC(=O)NNc3ccccc3[N+](=O)[O-])cc2)CC1	775600907	NEAIVBFGVGFWBX-UHFFFAOYSA-N	441.492	1.954	50	20	IDGD	
CCOC(=O)c1c(NC(=O)NNC(=O)c2ccc(C)cc2O)c(C#N)cn1CCOC	775765218	KCQVYLRNISRCKA-UHFFFAOYSA-N	429.433	1.663	50	20	IDGD	
COc1cccc([C@H]2[C@H](C(=O)NNC(=O)Cn3cnc4ccccc43)CC(=O)N2C2CC2)c1	776448728	RZALCOAAFCWORJ-JPYJTQIMSA-N	447.495	1.945	50	20	IDGD	
O=C(CCCc1ccc2nc(O)[nH]c2c1)N1CCN(S(=O)(=O)CBr)CC1	777777506	KHPCFDBVUBLHMY-UHFFFAOYSA-N	445.339	1.418	50	20	IDGD	
Cc1cc(C(=O)N2CCC[C@H]2C(=O)NNC(=O)CNC(=O)OC(C)(C)C)ccc1[N+](=O)[O-]	778435987	CMJGJNGURXRTLF-HNNXBMFYSA-N	449.464	1.180	50	20	IDGD	
Cc1nc2nc(N)nn2c(C)c1CC(=O)NNc1ccc([N+](=O)[O-])cc1Br	779433098	KRGNSTKSGYMBDE-UHFFFAOYSA-N	435.242	1.680	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)CCNS(=O)(=O)c1ccccc1Cl	780971304	NMRLOOSLMNXIGT-UHFFFAOYSA-N	448.929	1.071	50	20	IDGD	
Cc1cc(C)nc(SCc2ccc(C(=O)NNC(=O)c3cccc(C(N)=O)n3)cc2)n1	781942137	ZVKPNWPNRGMJQZ-UHFFFAOYSA-N	436.497	1.954	50	20	IDGD	
CC(C)c1ccc(S(=O)(=O)N2CCN(S(=O)(=O)CBr)CC2)cc1	782399104	SUCXOLRJWWHEGQ-UHFFFAOYSA-N	425.370	1.799	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)c2cccc(NS(=O)(=O)C(F)(F)F)c2)cc1	782851344	LJJFQNVSGIOXLF-UHFFFAOYSA-N	446.407	1.830	50	20	IDGD	
CS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)cc1	783076534	YBRDJQSLJBCUHV-UHFFFAOYSA-N	444.372	1.682	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNc2c(C)cc(C)cc2C)cc(S(C)(=O)=O)c1	783366652	DIACKDLUBPMSIX-UHFFFAOYSA-N	433.486	1.884	50	20	IDGD	
Cc1cc(C)cc(-n2nc(NC(=O)C(=O)NNc3ccc(-n4cccn4)nn3)cc2C)c1	783437152	UDIZKVCTXVHTBZ-UHFFFAOYSA-N	431.460	1.855	50	20	IDGD	
N#Cc1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)c(Cl)c1	784217805	YFPKMKAVWQNEGZ-UHFFFAOYSA-N	433.877	1.734	50	20	IDGD	
O=C(NNc1ccc(Cl)nn1)C(=O)Nc1cccc(N2CCN(CC3CC3)CC2)c1	784792843	KFIBNVAEBWHXGG-UHFFFAOYSA-N	429.912	1.744	50	20	IDGD	
COc1cccc(NNC(=O)C(=O)Nc2ccc(S(=O)(=O)N3CCCCCC3)cc2)n1	784843138	HMZQBQUAYPHKCU-UHFFFAOYSA-N	447.517	1.737	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cccc3ccn(C)c23)cc(OC)c1OC	788332304	ZNPBKXRTVDXKDZ-UHFFFAOYSA-N	426.429	1.604	50	20	IDGD	
Cc1cccc(-c2nnc(S)n2CCC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c1	789053550	VIHZCIYOMLIKIC-UHFFFAOYSA-N	449.500	1.369	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2cccc3c2OCC[C@H]3N(C)C)c1	789733135	XPEKVWQDIJAERJ-GOSISDBHSA-N	440.500	1.854	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)cc(-n2cccn2)c1	792355482	IAODTCSFFGNOEE-UHFFFAOYSA-N	429.820	1.640	50	20	IDGD	
Cc1cccnc1NNC(=O)C(=O)Nc1cc(Cl)ccc1OCCS(C)(=O)=O	792379348	FBZIBACJEGQWMG-UHFFFAOYSA-N	426.882	1.549	50	20	IDGD	
CN(C)N(C(=O)c1cccc(NN2C(=O)[C@@H]3CC=CC[C@H]3C2=O)c1)[C@H]1CCS(=O)(=O)C1	792851218	UJIIEMBOSAAJKK-RCCFBDPRSA-N	446.529	1.071	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)[C@]3(C)CCN(C(=O)OCc4ccccc4)C3)nc21	793500971	LFSZGQVFQOTGFA-HXUWFJFHSA-N	425.449	1.561	50	20	IDGD	
CN(C(=O)OC(C)(C)C)[C@@H](C(=O)NNC(=O)COc1ccccc1F)c1cnn(C)c1	794761826	XZIRMBRINVHRTD-QGZVFWFLSA-N	435.456	1.694	50	20	IDGD	
CC(=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O)c1cc(C)c(Br)s1	794888017	YVIDAPIWZUEXHJ-UHFFFAOYSA-N	446.352	1.244	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2cccc(CN3C[C@H](C)O[C@@H](C)C3)c2)n1	797371132	PJWVRDFVFZWLRP-HOTGVXAUSA-N	425.489	1.399	50	20	IDGD	
O=C(NC[C@@H]1CCC(F)(F)C1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	797556687	SZNPCCDUPCKDLP-CYBMUJFWSA-N	430.477	1.851	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)OCC(=O)N3C)c1C	799258375	ALOFJQJLOIIWQU-CQSZACIVSA-N	440.456	1.212	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNS(=O)(=O)c1cc2c(cc1Cl)CCC2=O	800835629	PQPJKLCSAMBGIF-UHFFFAOYSA-N	427.891	1.270	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2nc(-c3ccco3)cs2)cc(OC)c1OC	806972896	QGOSVJANUVHMGL-UHFFFAOYSA-N	446.441	1.829	50	20	IDGD	
COCCn1cc(C(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)c(=O)cc1C	807120444	IEXDEWOREKPXIH-UHFFFAOYSA-N	433.408	1.854	50	20	IDGD	
Cc1ccc(Br)c(S(=O)(=O)NCCNC(=O)NNC(=O)CC(C)(C)C)c1	807561923	BACFIAHLUBOOCD-UHFFFAOYSA-N	449.371	1.802	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cccc4c3COC4=O)n[nH]2)cc1C	808934849	BMIGGIFCHYLYEY-UHFFFAOYSA-N	433.424	1.764	50	20	IDGD	
CCOC(=O)c1ccc(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1	809982741	NXGSORRKFPKFFU-UHFFFAOYSA-N	425.850	1.239	50	20	IDGD	
NC(=O)c1ccc(OCC(F)F)c(NC(=O)C(=O)NNc2cccc(C(F)(F)F)n2)c1	810395320	LNBYXBNDANTFTP-UHFFFAOYSA-N	447.320	1.925	50	20	IDGD	
O=C(CSc1ccc(Cl)cc1)NNC(=O)C(=O)N1CCN(c2ccccc2)CC1	812445105	RAMPQHGOLDKEQR-UHFFFAOYSA-N	432.933	1.928	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCc2nncn2C1)c1nn(Cc2ccccc2)c(=O)c2ccccc12	814211638	KYMZXSBWCGYAAP-MRXNPFEDSA-N	443.467	1.060	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)C2(c3ccc(N(C)C)cc3)CC2)cc1	814723305	BWCSVWJQUBIMRK-UHFFFAOYSA-N	444.557	1.561	50	20	IDGD	
Cc1ncc(S(N)(=O)=O)cc1C(=O)OCC(=O)C(C#N)=C1N(C)c2ccccc2N1C	815273181	ADNGNRWKWHCBEO-UHFFFAOYSA-N	441.469	1.085	50	20	IDGD	
COC(=O)C(C)(C)c1csc(NC(=O)C(=O)NNC(=O)c2c[nH]c3ccccc23)n1	815563524	GCOZSEDUBUZSRC-UHFFFAOYSA-N	429.458	1.475	50	20	IDGD	
COCc1cc(NC(=O)C(=O)NNC(=O)c2cccc(N(C)C)c2)cc(C(=O)OC)c1	815565518	RELCGIDXJMNYMO-UHFFFAOYSA-N	428.445	1.085	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)[C@H]1CSCN1C(=O)OC(C)(C)C	817054183	XLKCWPNILBMIMF-CYBMUJFWSA-N	430.552	1.690	50	20	IDGD	
CSCC[C@@H](NC(=O)c1ccccc1Br)C(=O)N1CC[C@@H](B(O)O)C1	864233170	HPXPFUGESSLOQI-BXUZGUMPSA-N	429.145	1.376	50	20	IDGD	
O=C(COc1ccc(Cl)cc1)NN=Cc1c(N2CCOCC2)nc2ccccn2c1=O	864237080	ITNXYKYZZHEJFQ-UHFFFAOYSA-N	441.875	1.714	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNC(=O)C2=NN(c3ccccc3)[C@H](C(N)=O)C2)cc1	913081431	PCKIQZJGWVHXJS-FQEVSTJZSA-N	437.500	1.993	50	20	IDGD	
CC(=O)c1cccc(S(=O)(=O)NCCC(=O)NNC(=O)CNc2ccc(C)cc2)c1	913432012	AHPQHQWCEPOKDF-UHFFFAOYSA-N	432.502	1.126	50	20	IDGD	
O=C(NNC(=O)N1CCN(S(=O)(=O)c2ccc(Cl)s2)CC1)c1ccccc1	913632594	GQHURRQKGPSHDB-UHFFFAOYSA-N	428.923	1.762	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)Cc2c[nH]c3ccccc23)c1	914749271	KUSPHOOIGAGURA-UHFFFAOYSA-N	432.477	1.997	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)CCS(=O)(=O)c2ccc3c(c2)CCC3)c1	915274482	CYIDWJKXIIFGRG-UHFFFAOYSA-N	432.498	1.818	50	20	IDGD	
COc1cccc([C@@H](CNC(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)N(C)C)c1	915901171	FFPONGTUGDJFIA-LJQANCHMSA-N	427.505	1.884	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)NCCN2CCN(Cc3ccccc3)CC2)c1	915901528	JIPHGZZPWWMXLO-UHFFFAOYSA-N	425.533	1.522	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2ccc(Cn3ccnc3)cc2)ccc1Cl	916133289	CSHVOQITLPZSKE-UHFFFAOYSA-N	433.877	1.307	50	20	IDGD	
Cc1n[nH]cc1CNC(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	916578473	JHADRIJOMRQHCA-UHFFFAOYSA-N	431.456	1.621	50	20	IDGD	
Cc1cc(Br)oc1C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	917289603	KLDQXADOKHJQGA-LBPRGKRZSA-N	439.218	1.495	50	20	IDGD	
O=C(CCCc1cccs1)Nc1cccc(C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)c1	918551257	RYCNIMLXYPSIEC-OAHLLOKOSA-N	449.554	1.905	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)[C@H]1CCCN(S(=O)(=O)c2ccccc2)C1	919820515	KJIMZGRQMHZWJK-KRWDZBQOSA-N	431.514	1.486	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1	919912081	XXDKPYBZGBYNDC-SFHVURJKSA-N	439.516	1.470	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@@H](C)CN2CCC[C@H](C)C2)cc1	919914488	HKYBTNYKMXOEFA-IRXDYDNUSA-N	439.582	1.066	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)NCc2ccc3c(c2)OCO3)c1)NC1CC1	920822665	VCZURPNJZBMSIF-UHFFFAOYSA-N	432.458	1.000	50	20	IDGD	
CC[C@]1(C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)CCN(C(=O)OC(C)(C)C)C1	1319565431	LOAUMFSUYDVBLN-QFIPXVFZSA-N	444.488	1.900	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCC[C@H](c2n[nH]cc2NC(C)=O)C1	1319927046	GPODICVLVSGMEN-ZDUSSCGKSA-N	448.911	1.671	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccccc2N2CCCC2=O)c1	1321404188	TUBNRRBUGVWWPG-UHFFFAOYSA-N	430.486	1.139	50	20	IDGD	
Nc1cnnc(NNC(=O)[C@H]2CC(=O)N(CCOc3ccccc3Cl)C2)c1Cl	1335412730	MPSHVZAHOLMKHH-JTQLQIEISA-N	425.276	1.736	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)/C=N/O[C@@H]3CCCCO3)C2)C1	1779104623	FIUKYYSPFXZXPY-MRZPIDLUSA-N	436.336	1.582	50	20	IDGD	
COc1cncc(CCC(=O)N2CCO[C@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)c1	1779294581	UGJPDBIHYLNCKY-NRFANRHFSA-N	435.597	1.704	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cccn(C(F)F)c1=O)CCO2	1779298964	RLLOJVDANRVQRB-IBGZPJMESA-N	443.523	1.538	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@]3(CN(C(=O)CCBr)CCO3)C2)c(O)c1	1780553129	YXBDVXGEJKRQGI-SFHVURJKSA-N	427.295	1.629	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(OC)c(OC)c3O)C2)C1	1781828848	AEHAMMWCRBHSPU-JLTOFOAXSA-N	442.896	1.107	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cnccc3N(C)C)CCO2)C1	1783343454	JGICSASMBLHOJT-BEFAXECRSA-N	439.354	1.765	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(C)c(NC(C)=O)c3)CCO2)C1	1783879751	ANXOSUCIIKROEO-DYESRHJHSA-N	437.924	1.651	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(OC)cc3OC)CCO2)C1	1783883212	WQGFEKZDBSALMO-OXQOHEQNSA-N	426.897	1.401	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc([N+](=O)[O-])c(OC)c3)CCO2)C1	1783883479	IYGPQKXTFZYXLZ-IFXJQAMLSA-N	441.868	1.301	50	20	IDGD	
O=C(c1ccc([N+](=O)[O-])c2c1OCO2)N1CCO[C@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783948166	DEGLDCIWWZFOHZ-KRWDZBQOSA-N	446.243	1.571	50	20	IDGD	
CO[C@H](C)C(=O)N1CC[C@]2(CN(C(=O)[C@H](Br)Cc3ccccc3)CCO2)C1	1783993733	FZHNSOHGIWBGJJ-WRWLIDTKSA-N	439.350	1.857	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](C)Oc3cccnc3)C2)C1	1784549529	WVAZZYLVRNZGNC-ALKREAHSSA-N	440.338	1.852	50	20	IDGD	
CN1CC(C(=O)N2CC[C@]3(CN(C(=O)/C(C#N)=C/c4ccc(F)cc4F)CCO3)C2)C1	1784786831	FFLQQYDAAUGNIA-XXFFJTNUSA-N	430.455	1.263	50	20	IDGD	
CCS(=O)(=O)N[C@@H](C)C(=O)Nc1ccc(C2(NC(=O)[C@H](O)CCl)CCC2)cc1	1786335359	BFDDJGQLUGVIBG-SWLSCSKDSA-N	431.942	1.048	50	20	IDGD	
COc1nn(C)cc1C(=O)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1	1788145966	LKIRBNBCEDPVEE-UHFFFAOYSA-N	448.288	1.170	50	20	IDGD	
C=C(CC(=O)OCC)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]2C1	1789923378	JWASAGPIGAXCLF-ABHRYQDASA-N	435.290	1.166	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]2C1	1789924806	DUEFALKESPZIQB-QHZLYTNSSA-N	430.112	1.440	50	20	IDGD	
CN1CCC[C@H](C(=O)Nc2ccc(C3(NC(=O)CCC(=O)NN(C)C)CCC3)cc2)C1	1790395236	AGKLWYCSLPMSNO-KRWDZBQOSA-N	429.565	1.835	50	20	IDGD	
O=C(NC1(c2ccc(NC(=O)[C@@H](F)Br)cc2)CCC1)c1cccc(B(O)O)c1	1790534896	WJUOOSRZGSVACG-MRXNPFEDSA-N	449.085	1.805	50	20	IDGD	
Cc1cc(C)n(CCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCBr)C[C@@H]32)n1	1791509714	WUALOAAIXLBGDA-ULQDDVLXSA-N	441.370	1.655	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)[C@@H]1C[C@H]1c1ccc(F)c(F)c1	1793044302	FHYLUAZGDAXXMZ-MHVDTCSESA-N	428.863	1.258	50	20	IDGD	
CCOC(=O)c1c(CCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](O)CCl)c[nH]c1C	1793107708	VPRNHLCYXVJKAG-YVSFHVDLSA-N	439.940	1.670	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)C1=NO[C@@H](c2ccccc2)C1	1796191571	YOZQQAGMJFRQDX-XAPVIXHLSA-N	447.300	1.136	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(OCC(F)(F)F)n1)C2)[C@H](F)Cl	1796361862	PGAITUUZWASOSB-DJBIQUGXSA-N	439.793	1.760	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](O)[C@@H](C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](F)Cl)C3)C1	1797684041	MLWREEXVTNFBEH-PLZKBRGSSA-N	447.935	1.777	50	20	IDGD	
CCc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](Br)CC)C3)n(C)n1	1798167906	IAWSXLREZAAEOC-LMWOUKEDSA-N	427.343	1.359	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cc(F)ccc1[N+](=O)[O-])C2	1799272079	ZFEGAHIAKCDDCK-HRJSJKBJSA-N	427.860	1.883	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nnsc1C1CC1)C2	1799275516	UOKWSZQWXVYYDZ-JJHQXXDFSA-N	433.361	1.855	50	20	IDGD	
Nc1ccccc1/C=C/C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Br	1799346450	RBYJTWDUCBQFGH-OWOJSOJESA-N	426.286	1.562	50	20	IDGD	
CN(C)c1cccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Br)c1	1799349061	UVTXUGADMFKZKH-XRGAULLZSA-N	428.302	1.646	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccn3ccnc3c1)C2)[C@H](F)Br	1799349788	LANZNMIYCQBARC-NEBZKDRISA-N	425.258	1.228	50	20	IDGD	
O=C([C@H](F)Br)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1(Br)CC1	1799360069	GJCNPRMZMFVMNY-JXUBOQSCSA-N	428.096	1.194	50	20	IDGD	
O=C([C@H](O)CCl)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1(c2ccc(Cl)cc2)CCC1	1800418246	PXSCEVNYENHVHW-LTCOOKNTSA-N	441.355	1.951	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nn(C)c3c1CCC3)C2	1800640590	AMKQQYSHJXNUIH-FAXLKDOZSA-N	439.354	1.286	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CSc1ccc(C)cc1)C2	1800978168	NDLXUSIDCAXNJG-LORHWOILSA-N	426.966	1.931	50	20	IDGD	
CC(C)(C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1ccccn1	1801218721	PXTFEODWEINFLN-AYRXBEOTSA-N	428.302	1.639	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@](C)(O)C[C@H]1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](F)Cl)C2	1802054676	XYVWMKSWQDGJLH-NMQXAITKSA-N	447.935	1.919	50	20	IDGD	
Cc1nn[nH]c1C(=O)N1CC[C@H](CNC(=O)[C@H](C)CBr)[C@H]1c1cccnc1	1803009798	XZRKKAULULOHRW-DJSGYFEHSA-N	435.326	1.859	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H](CNC(=O)c2cccc(=O)n2O)[C@@H]1c1cccnc1	1804949045	DRVXCNXHURBEBX-UZLBHIALSA-N	444.564	1.652	50	20	IDGD	
Cc1nnc(CC(=O)NC[C@H]2CCN(C(=O)CO[Si](C)(C)C)[C@@H]2c2cccnc2)o1	1807470834	MERJVKNYOSGMNB-OXQOHEQNSA-N	431.569	1.873	50	20	IDGD	
Cc1c[nH]cc1C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1	1808583304	FWWSTGWJPVNHJX-UZLBHIALSA-N	447.499	1.350	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)c1cc2cn[nH]c2cn1	1810082603	KJFADWXBQFKIIV-KKXDTOCCSA-N	428.880	1.272	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@H](CNC(=O)CCn2cncn2)[C@@H]1c1cccnc1	1813318748	MWPHGFBEXSWGPJ-PXNSSMCTSA-N	430.585	1.621	50	20	IDGD	
O=C(CCc1ccoc1)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1813523788	WXUKATVOGBCCBT-NFBKMPQASA-N	447.300	1.307	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1cc(C2CC2)on1	1814624979	GKOIROMSZLYQBS-GOSISDBHSA-N	449.276	1.575	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H]2CCC(=O)N2)n[nH]1	1817091655	FWWAXAHEBSLCQJ-NQBHXWOUSA-N	426.315	1.854	50	20	IDGD	
Cc1ccc(=O)n(C(C)(C)C(=O)N[C@H]2CCc3nc(NC(=O)[C@@H](F)Cl)sc3C2)n1	1817125362	MIXCTZNAZBFQOA-IINYFYTJSA-N	441.916	1.890	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3nc[nH]c3[N+](=O)[O-])sc2C1	1817205861	WFPWKXMLAKCGDQ-HTQZYQBOSA-N	428.858	1.254	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)ccn1	1817472169	MIYRGXGNNWQCRJ-LJQANCHMSA-N	433.277	1.413	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnccc2F)n[nH]1	1817736199	SXKOAVHWCUBVLB-MRXNPFEDSA-N	431.472	1.623	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](C)S)[nH]n1	1818113059	AMZBMYBSUYQBOB-HLPBRAGLSA-N	431.522	1.854	50	20	IDGD	
Cc1cc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)ccn1	1819752110	HXRAZIFYRZIHRY-LJQANCHMSA-N	433.277	1.413	50	20	IDGD	
CC(=O)NCCC(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](C)CBr)[nH]n1	1821978407	QGWDQRBEBUGQQE-BXUZGUMPSA-N	428.331	1.959	50	20	IDGD	
C[C@H](Br)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN2CCNC2=N)[nH]n1	1822182873	DWMNLHSXMOUHLE-JQWIXIFHSA-N	426.319	1.025	50	20	IDGD	
CC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(=O)n3[nH]cnc3n1)CC2	1822843038	JTDNNPVZOGCOHL-BDAKNGLRSA-N	435.897	1.117	50	20	IDGD	
Cc1ccn(CC(=O)N2CCCC[C@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)n1	1825274351	MYNVJLFERFXFFB-IBGZPJMESA-N	432.569	1.184	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)C1(C(F)(F)F)CC1)CC2	1826085812	DAMYVYNBIQBOMP-JTQLQIEISA-N	447.483	1.771	50	20	IDGD	
Cc1nc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)cs1	1827056523	WGROFPQZEWNMQF-HXUWFJFHSA-N	441.362	1.678	50	20	IDGD	
O=C(CS(=O)(=O)N1CCCC1)N1CCC([C@@H]2CCCCN2C(=O)[C@H](F)Cl)CC1	1827613957	WLJOBICATMKXKG-RDJZCZTQSA-N	437.965	1.566	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2nc[nH]c2[N+](=O)[O-])CC1	1827651428	XBYQNMNUXZITCH-UONOGXRCSA-N	427.889	1.805	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H]2CCCCO2)CC1	1828922104	MEXHDNBHGUEFEH-UXHICEINSA-N	443.548	1.488	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(F)c3C)CCO2)C1	1830164164	XTABBCZNPUOSNU-OXJNMPFZSA-N	428.888	1.458	50	20	IDGD	
Cc1nscc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)CBr)CCO2	1830534960	FYXGMKVOXZQEII-PXAZEXFGSA-N	446.367	1.553	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3C[C@H]4CC[C@@H]3O4)C2)C1	1830543899	HCGXHIMYQJWEBR-RMWBKXBUSA-N	445.354	1.041	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3nnsc3C3CC3)C2)C1	1831645672	CZFKNCXWFPTMNN-KUHUBIRLSA-N	442.969	1.893	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](CN)c3ccccc3)C2)C1	1831646145	IAAUFBVPAZFPBF-IPJJNNNSSA-N	437.968	1.593	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccn4nccc34)C2)C1	1831653530	HJKXPFDSIBUOHK-LAUBAEHRSA-N	434.924	1.812	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(F)(F)C(F)F)CCO2	1832194015	WCPUPLQOPHSVTE-QMTHXVAHSA-N	449.239	1.517	50	20	IDGD	
O=C([C@H](F)Br)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)c1ccccc1)CCO2	1832224595	AKDRNMHIWZDZJJ-VKJFTORMSA-N	447.276	1.844	50	20	IDGD	
Cc1cncc(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)c1	1832962513	LBZWHCBLAUGLKH-IBGZPJMESA-N	430.332	1.583	50	20	IDGD	
Cc1ccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)cn1	1833132874	OCFGVJFYCXPTMY-SJLPKXTDSA-N	444.301	1.079	50	20	IDGD	
Cc1ncccc1C(=O)N1CCO[C@]2(COCCN(C(=O)CCBr)C2)C1	1834037109	JEXVSDZKVMPTLL-SFHVURJKSA-N	426.311	1.245	50	20	IDGD	
Cc1nc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](C)CBr)C3)C2)cs1	1834450315	ANQVKTOOIJAAPK-SJCJKPOMSA-N	446.367	1.553	50	20	IDGD	
Cc1cccnc1C(=O)N1CCOC[C@@]2(CN(C(=O)CCBr)CCO2)C1	1834819639	SHWBUBFMRKAZBT-GOSISDBHSA-N	426.311	1.245	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3cc(F)cc(F)c3)CCO2)C1	1836121647	HDVLGUPPBGGCNY-FXAWDEMLSA-N	430.879	1.981	50	20	IDGD	
Cn1ccnc1C(=O)N1CCC(N2CCC(NC(=O)[C@@](C)(Cl)CCl)CC2)CC1	1836398645	PPXKAYOQTFIPNE-IBGZPJMESA-N	430.380	1.842	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)CC(=O)NC)CC2)CC1	1836835568	WQZCBYIWEZRWBD-OAHLLOKOSA-N	432.359	1.295	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)CCN3C(=O)C=CC3=O)CC2)CC1	1836995485	BUMXOZSCXFMPIO-KRWDZBQOSA-N	439.940	1.318	50	20	IDGD	
Cn1cc(CC(=O)N2CCC(OC3CCN(C(=O)CCBr)CC3)CC2)cn1	1837654574	DAFUSMVNYZHQPP-UHFFFAOYSA-N	441.370	1.746	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)c3ccccc3)C2)C1	1837712613	ZUCSUNWKONQHSK-PZJWPPBQSA-N	436.581	1.028	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(C#N)cc(OC)c3)CCO2)C1	1838584798	HCHJGOODLQZXQC-RXVVDRJESA-N	435.908	1.654	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(-n4ccnc4)ccn3)CCO2)C1	1838795748	NLVJDFHNZFFJQB-UTKZUKDTSA-N	447.923	1.355	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)/C=C/C(=O)c3cccs3)C2)C1	1839144473	AWPCVCSSPRWMBH-ONYHAXFOSA-N	440.949	1.961	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(C)n(C(F)F)n3)C2)C1	1839146011	IGPNSWAUVWAYHA-SCLBCKFNSA-N	434.871	1.674	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccc(F)cc3F)C2)C1	1839147847	DTTRKPUKEBSMQC-UZLBHIALSA-N	430.879	1.981	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(C#N)c[nH]3)C2)C1	1839153870	UJWLDPWZBQKMKF-MSOLQXFVSA-N	429.304	1.193	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3cnccn3)C2)C1	1839155152	KTLNDKZCUFRTIN-RTBURBONSA-N	445.347	1.102	50	20	IDGD	
Cc1cccc2c(C(=O)N3CCO[C@@]4(COCCN(C(=O)C(Cl)Cl)C4)C3)n[nH]c12	1839597172	MQKBZOCKRUIKNM-IBGZPJMESA-N	441.315	1.745	50	20	IDGD	
Cc1cccc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)c1	1840032060	MQOCWUQTQWRNOU-UZLBHIALSA-N	439.350	1.777	50	20	IDGD	
CCn1nc(C)cc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)Br)CCO2	1840032513	ASYYSUBHCPRYHT-KSSFIOAISA-N	443.342	1.065	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3c(C)c[nH]c3C)C2)C1	1840150755	RDPVJVZCDAOKLA-GHTZIAJQSA-N	441.956	1.274	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1C[C@]1(F)Cl)CCO2	1840248233	YNWYSHBSVDFPBS-LWWSYDQCSA-N	427.698	1.151	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3cnc(C)s3)CCO2)C1	1840398146	PSPZPVMEXNESGE-QFBILLFUSA-N	429.970	1.858	50	20	IDGD	
COC1(CC(=O)N2CCO[C@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)CCC1	1840616671	IPLJBTYUSPLXRR-HXUWFJFHSA-N	428.602	1.254	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2cc(Cl)ccc2F)C1	1841174329	HIWKIDDGKBHGMI-UHFFFAOYSA-N	431.855	1.608	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)c1cccc(N3CCCNC(=O)C3)n1)C2	1841666991	KFZVTVFRYILNJK-MRXNPFEDSA-N	447.967	1.632	50	20	IDGD	
CN(CC(=O)N1CC2(CCCN2C(=O)c2cccs2)C1)NC(=O)NCc1ccccc1	1842371800	BOKZHILNMRBAHP-UHFFFAOYSA-N	441.557	1.911	50	20	IDGD	
CC(C)(C)OC(=O)N1CCCO[C@@H](C(=O)N2CCCC23CN(C(=O)[C@@H](F)Cl)C3)C1	1843817921	IRHHVYUZIAGZGK-ZIAGYGMSSA-N	433.908	1.750	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)/C=C/c2cc3ccccc3o2)C1	1843835159	OGFKKSBQYKKYOG-ZHACJKMWSA-N	430.269	1.643	50	20	IDGD	
COc1cccc(/C=C/C(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)c1	1844265256	LIIGUVRKCVFWLK-VOTSOKGWSA-N	435.484	1.224	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)[C@H]1CCc3ccccc3C1)C2	1844265344	STGQTORPCVGLQJ-SFHVURJKSA-N	433.512	1.307	50	20	IDGD	
CC(=O)N[C@@H](C(=O)N1CCCC12CN(C(=O)[C@@H](O)CCl)C2)c1cccc(Cl)c1	1845017740	PUOTWQMTOBHKSB-JKSUJKDBSA-N	428.316	1.320	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)CN1CCN(C(=O)OC(C)(C)C)CC1)C2	1845168739	WUGXZDICUHOBSO-INIZCTEOSA-N	442.988	1.760	50	20	IDGD	
O=C(c1cc(CO)on1)N1CC2(CCCN2C(=O)[C@H](Br)Cc2ccccc2)C1	1845942025	GRKQCFYDJPBRCF-MRXNPFEDSA-N	448.317	1.990	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)OC)C2	1846360538	RVYNJKDAHPRZHW-ILXRZTDVSA-N	447.960	1.372	50	20	IDGD	
O=C(CC12CC3CC(CC(C3)C1)C2)NCC(=O)OCC(=O)NNC(=O)c1ccccc1	5627469	CVCSMISISHMUCY-UHFFFAOYSA-N	427.501	1.714	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)OCC(=O)NC(=O)NCc2ccco2)c1C	9604654	RFGOJTDBKZEOJE-LICLKQGHSA-N	428.445	1.821	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2ccc(F)c(C(=O)O)c2)cc(OC)c1OC	13367589	GSZZVDGSBIGOFJ-UHFFFAOYSA-N	428.394	1.173	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCCC(=O)NNC(=O)COc2cc(C)cc(C)c2)cc1	28637397	DAPVVXPPUHGKIP-UHFFFAOYSA-N	449.529	1.597	50	20	IDGD	
Cc1nc2ccc(C(=O)NNC(=O)c3sc(N4CCOCC4)nc3C)cc2nc1C	105193323	MUZYDYSWMSAQKE-UHFFFAOYSA-N	426.502	1.923	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN(C(=O)CCOc2ccccc2)C1)c1ccc2c(c1)OCO2	108617367	BHEVUBGMXKASGI-KRWDZBQOSA-N	439.468	1.884	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)NCc1ccc(CN2CCCCCC2)cc1	725870848	CAZCSKKWSBXLFC-UHFFFAOYSA-N	427.505	1.916	50	20	IDGD	
CC(=O)N1CCC[C@@H](C(=O)NNC(=O)c2nc(-c3ccccc3)n(-c3ccccc3)n2)C1	726094482	FTOBMHMOTVUCLG-GOSISDBHSA-N	432.484	1.954	50	20	IDGD	
Cc1ccc([C@H](CNC(=O)NNC(=O)CNC(=O)c2cccs2)N2CCCC2)cc1	726249776	LQLDPIINWHVLGQ-KRWDZBQOSA-N	429.546	1.954	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=S)NCC3CCC3)CC2)c(C)c1	727866944	HTRUBKAIMAMSJO-UHFFFAOYSA-N	438.619	2.000	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN1c1ncnc2sccc12)[C@H]1COc2ccccc2O1	728455434	PSWONTVRZIZBFR-CZUORRHYSA-N	425.470	1.648	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)[C@H]2CCCN2c2ncnc3sccc23)cc1	728668265	RACBMYNHGICESO-MRXNPFEDSA-N	439.497	1.973	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)Cc2cccnc2)cc1NC(=O)c1ccccn1	728856131	HVLKCKODMLJXFD-UHFFFAOYSA-N	441.469	1.290	50	20	IDGD	
CCOc1ccc(NS(=O)(=O)c2ccc(C(=O)NNC(=O)c3cnn[nH]3)cc2)cc1	729455519	IXOUOCTTYFCZGZ-UHFFFAOYSA-N	430.446	1.079	50	20	IDGD	
CN(C)c1ccc(NC(=S)NNC(=O)CS(=O)(=O)Cc2ccc(C#N)cc2)cc1	729688802	BROHLFVUYHAQAO-UHFFFAOYSA-N	431.543	1.557	50	20	IDGD	
O=C(CSc1nnc(O)nc1O)NN=Cc1cc2c(cc1Br)OCO2	730558876	UWVQASRARHUWTQ-UHFFFAOYSA-N	428.224	1.016	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)c1cn(-c2ccccc2Br)nn1	730778603	RENUBALGXGCBDT-UHFFFAOYSA-N	432.234	1.575	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)N1CCC[C@@H]1C(=O)NNC(=O)COc1ccccc1O	730781950	CUBFUXCFVZPVQI-OAHLLOKOSA-N	447.875	1.885	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)c1ccc(N2CCN(C(C)=O)CC2)c([N+](=O)[O-])c1	731492510	LEOMLFSZJNOAGL-UHFFFAOYSA-N	441.444	1.347	50	20	IDGD	
O=C(NN=C1CCOc2ccc(F)cc21)c1cccc(S(=O)(=O)N2CCOCC2)c1	731560440	UQOGQMOPFDIRAW-UHFFFAOYSA-N	433.461	1.763	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)Cc1ccc(NS(=O)(=O)c2ccc(F)cc2)cc1	732084664	VWWPPEVUAVOGMJ-UHFFFAOYSA-N	431.449	1.662	50	20	IDGD	
CCc1cc(CNC(=O)/C(C#N)=C/c2cn(CCC(N)=O)nc2-c2ccc(OC)cc2)n[nH]1	732794109	UEKWBRXXYXLJPH-MHWRWJLKSA-N	447.499	1.943	50	20	IDGD	
O=C(NNc1cnnc2ccccc12)c1ccc(S(=O)(=O)NC[C@H]2CCCO2)cc1	733810341	FFAUVIGOWYWQON-OAHLLOKOSA-N	427.486	1.844	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2cc3cc(F)ccc3[nH]2)CC1	735118394	UEXZNEKXBVDWHW-UHFFFAOYSA-N	432.481	1.395	50	20	IDGD	
CCCCN1C(=O)CC[C@H](C(=O)NNC(=O)c2cnn(C)c2)[C@@H]1c1ccc(OC)cc1	735446261	IRVKDCJLPBADMK-ICSRJNTNSA-N	427.505	1.970	50	20	IDGD	
O=C(CN1CCN(C(=O)CCCC[C@@H]2CCSS2)CC1)N[C@H]1CCS(=O)(=O)C1	736165221	AEXYGJJQTJGYJV-JKSUJKDBSA-N	449.664	1.148	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N[C@H](C)[C@@H]2CN(Cc3ccccc3)CCO2)cc1OC	741270067	OPXGCOXQGSFTJT-IERDGZPVSA-N	442.516	1.937	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)[C@H]2CCCN(Cc3ccccc3)C2)n1	741331155	YLSJCGBRCMUOAQ-KRWDZBQOSA-N	430.530	1.597	50	20	IDGD	
COCc1cccc(C=NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1	743422766	FZSSRBDEGCGOQE-UHFFFAOYSA-N	445.541	1.937	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CN2CCC[C@H](C(=O)Nc3ccc(Cl)cn3)C2)c1	744389013	FRTNROMMJIWPBW-INIZCTEOSA-N	440.891	1.718	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)[C@H]2CCCN(C(=O)c3ccccc3)C2)cc1	744993618	FPDJIRROSAMODA-IBGZPJMESA-N	434.452	1.415	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)[C@H]2CCCN(C(=O)c3ccccc3)C2)c1	744994544	MYKOMHDECLHZRJ-IBGZPJMESA-N	434.452	1.415	50	20	IDGD	
CCS(=O)(=O)c1ccc(Cl)c(C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)c1	744996927	BGCWENUWFRBEST-UHFFFAOYSA-N	449.872	1.623	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCCN1C(=O)c1ccc(O)nn1)c1c(Cl)cccc1Cl	746210874	XSYCIDJVRHOVDV-ZDUSSCGKSA-N	438.271	1.945	50	20	IDGD	
O=C(COC(=O)c1csc(-c2ccccc2)n1)NNC(=O)[C@H]1COc2ccccc2O1	746244045	NCRUYTSHOLRIPG-QGZVFWFLSA-N	439.449	1.954	50	20	IDGD	
O=C(COC[C@@H]1CCCO1)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	746386821	VNBNJRDMCIWSOI-ZDUSSCGKSA-N	439.515	1.506	50	20	IDGD	
CC(=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O)c1cc(Cl)ccc1OC(F)F	748076910	YCAKMDKOHQTOLW-UHFFFAOYSA-N	447.851	1.366	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@](F)(C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)C1	748301602	GAQQRLOIQAANJD-LJQANCHMSA-N	442.513	1.920	50	20	IDGD	
CCC1(CC)NC(=O)N(CC(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)C1=O	748520804	UPMMLDKYOINOHY-UHFFFAOYSA-N	436.412	1.534	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)c1cc(S(=O)(=O)N2CCC2)ccc1Cl	748795063	SIJITKFILAETKP-UHFFFAOYSA-N	437.905	1.747	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCc2cc(F)cc(F)c2)c1	749020588	YYQUTOBYWCJZRG-UHFFFAOYSA-N	426.445	1.402	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)c(F)c1	749308160	IWKKPEXDDAKZQO-UHFFFAOYSA-N	449.504	1.549	50	20	IDGD	
O=C(NNC(=O)c1cc2ccccc2o1)c1ccc(F)c(S(=O)(=O)N2CCOCC2)c1	750305504	JRUXXKSAJNQFPR-UHFFFAOYSA-N	447.444	1.668	50	20	IDGD	
CS(=O)(=O)NCCc1ccc(C(=O)COC(=O)/C(C#N)=C\c2ccc(O)cc2)s1	750667283	XCOKVSIINUJOSF-UVTDQMKNSA-N	434.495	1.878	50	20	IDGD	
O=C(COC(=O)c1cnn(CCC(F)(F)F)c1)NNC(=O)c1ccc([N+](=O)[O-])cc1	752289342	APBHQMLKECDXPI-UHFFFAOYSA-N	429.311	1.362	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccccc2CNC(=O)/C(C#N)=C\c2ccc(F)cc2)CC1	752406998	NBWYUMVOJHGPCQ-RGEXLXHISA-N	442.516	1.985	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)c1ccc(F)cc1F	753056550	MCECWZRRXNKZBQ-LLVKDONJSA-N	426.445	1.920	50	20	IDGD	
CCOC(=O)c1ccc(N2CC(NC(=O)NNC(=O)C34CC5CC(CC(C5)C3)C4)C2)nc1	753285544	ZMTSQGRBAYALSL-UHFFFAOYSA-N	441.532	1.994	50	20	IDGD	
Cc1nnc(NNC(=O)c2cc(C(C)C)nc3c2c(O)nc(=O)n3CC(C)C)nc1O	754416843	MLAXAWDDKNPKLV-UHFFFAOYSA-N	428.453	1.232	50	20	IDGD	
O=C(NN=c1cc[nH]c2ccccc12)[C@@H]1CN(Cc2nc(O)c3ccccc3n2)CCO1	754420166	NGDMVGQYTONQRR-FQEVSTJZSA-N	430.468	1.650	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1F)NC1CCN(S(=O)(=O)C(F)(F)F)CC1	755308009	WGNOQUCBERFAKP-UHFFFAOYSA-N	446.810	1.737	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)Nc1cccc(S(=O)(=O)NC2CC2)c1	755586454	WYKKMJWAJWSKDR-UHFFFAOYSA-N	440.485	1.780	50	20	IDGD	
O=C(CN1CCOCC1)Nc1ccc(NC(=O)NNC(=O)c2cccc3ncccc23)cc1	755600194	QWJNOKLGAAQHLT-UHFFFAOYSA-N	448.483	1.972	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)Nc1ccc(CC(=O)N2CCOCC2)cc1	755862833	VOOOMGYZBDKDCB-UHFFFAOYSA-N	426.473	1.457	50	20	IDGD	
COCCn1ncc2ccc(NC(=O)NNC(=O)C3CCN(c4ncccn4)CC3)cc21	756269955	KJNFMTWODLFSPW-UHFFFAOYSA-N	438.492	1.542	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)Nc1cc(F)ccc1OC[C@@H]1CCCO1	756477829	ZMTNRHZDTPKLQB-INIZCTEOSA-N	441.423	1.826	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2c(F)cc(F)cc2F)cc1	756800694	DLMRWQFXUAONDN-UHFFFAOYSA-N	430.408	1.886	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)Nc2ccc(C[C@@H]3CC(=O)NC3=O)cc2)cc1	756815541	MLFVPCCNCFYMCS-CQSZACIVSA-N	426.429	1.132	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNS(=O)(=O)c2cccc(F)c2C(=O)OC)cc1	757645400	LLILALUTMGFWQG-GFCCVEGCSA-N	440.449	1.788	50	20	IDGD	
COCc1nc2n(n1)C[C@H](NC(=O)NNC(=O)c1ccc(F)cc1Br)CC2	757791646	ZOPNGLDWZHFRTD-SNVBAGLBSA-N	441.261	1.285	50	20	IDGD	
CC1CCN(CCc2cccc(NC(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)c2)CC1	757847500	CINTWBTXALDBEJ-OAHLLOKOSA-N	425.555	1.051	50	20	IDGD	
Cc1nn([C@@H]2CCS(=O)(=O)C2)c(C)c1NC(=O)NNC(=O)COc1ccccc1F	757872283	XFYBSAOITNUPER-CYBMUJFWSA-N	439.469	1.230	50	20	IDGD	
CC(C)n1c(C(F)(F)F)nc2cc(C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)ccc21	758045131	BMQVWORKFZABLA-SECBINFHSA-N	435.428	1.335	50	20	IDGD	
Cc1nn(C)c(C)c1OCC(=O)NNC(=O)[C@@H](C)Oc1cccc(Br)c1	758372825	VAQDTHATDIMUDJ-GFCCVEGCSA-N	425.283	1.793	50	20	IDGD	
CSCCNC(=S)NNC(=O)Cc1csc(NC(=O)c2cc(C)ccc2O)n1	760930437	NMGOAXVTFSPECA-UHFFFAOYSA-N	439.588	1.810	50	20	IDGD	
CN1CC[C@H](CNC(=O)NN[C@]2(C)CCS(=O)(=O)C2)[C@H]1c1ccc(Cl)c(F)c1	763091482	KSAOEBGMWZKCFC-MZMPZRCHSA-N	432.949	1.853	50	20	IDGD	
COc1cc(C)nc(NNC(=O)c2cn(CCOc3ccc(C=O)cc3Cl)nn2)n1	763434301	VPQBGBUBXQRYRL-UHFFFAOYSA-N	431.840	1.687	50	20	IDGD	
CNC(=O)c1cc(Oc2ccccc2NC(=O)C(=O)NNC(=O)c2ccncc2)ccn1	763463419	DHJBQZBVDFWHFY-UHFFFAOYSA-N	434.412	1.028	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1cccc(N2CCCCC2=O)c1	763471900	PEDHIJTZTQVMLZ-UHFFFAOYSA-N	425.401	1.511	50	20	IDGD	
CSc1cccc(NC(=O)C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c1	763529541	CPJALTKPTQNBCE-UHFFFAOYSA-N	441.557	1.707	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(Cl)c2-n2cncn2)cc1OC	763552226	XRAGPIITDARESW-UHFFFAOYSA-N	444.835	1.338	50	20	IDGD	
CCc1cc(Br)ccc1NC(=O)C(=O)NNC(=O)[C@@H]1COc2ccccc2O1	763575248	RZUMCESHKLBDMN-INIZCTEOSA-N	448.273	1.937	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(-n3cccn3)c(Cl)c2)cc1	763661323	NJJUGSMOKCNHKN-UHFFFAOYSA-N	443.847	1.699	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccnn2CCc2ccccc2)cc1	763681604	LVWDNOOMEHEJIG-UHFFFAOYSA-N	432.440	1.162	50	20	IDGD	
Cc1cc(C(=O)N2CCCC2)ccc1NC(=O)C(=O)NNC(=O)c1cccc(N(C)C)c1	763760191	GQDDGXUNKVYUFG-UHFFFAOYSA-N	437.500	1.697	50	20	IDGD	
CCN(CC)C(=O)c1ccccc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccccc1F	763849884	LVGJQJPSXHWVIK-AWEZNQCLSA-N	444.463	1.861	50	20	IDGD	
Cc1ccc(N2CCOC2=O)cc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccccc1F	763859225	ZHJBZQWQSMPGCH-CYBMUJFWSA-N	444.419	1.644	50	20	IDGD	
COCc1cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2c(C)cc(Cl)cc2C)ncn1	763882328	IUGKPLBZOHCDMY-GFCCVEGCSA-N	435.868	1.447	50	20	IDGD	
CC(C)CC(=O)NNC(=O)C(=O)Nc1cc(F)c(F)cc1I	763887867	DTPCNUKFDNNQNC-UHFFFAOYSA-N	425.173	1.701	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(-n3ccnn3)cc2)ccc1OC(C)C	763916600	PCLYWGOROODJSR-UHFFFAOYSA-N	438.444	1.463	50	20	IDGD	
CNC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CC[C@@H](C)C3)cc1	763941125	KCZUQTSAYOVDCG-GFCCVEGCSA-N	444.513	1.397	50	20	IDGD	
O=C(Cc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1cccc(C(=O)N2CCOCC2)c1	763943009	YIIIYEOWVRDHHF-UHFFFAOYSA-N	444.875	1.141	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)on1)C(=O)Nc1ccc(C(=O)N2CCCC2)cc1	764003583	IHAVOELULSKHAB-UHFFFAOYSA-N	447.451	1.977	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cccc3ccccc23)cc1C(=O)OC	764048400	LDRPITVNZQUHRK-UHFFFAOYSA-N	449.419	1.813	50	20	IDGD	
COC(=O)[C@H]1CCCCN1C(=O)c1cccc(NC(=O)C(=O)NNC(=O)C2CCCC2)c1	764070595	MLEHIBHSFPTEBA-QGZVFWFLSA-N	444.488	1.130	50	20	IDGD	
CCCN1CCN(c2ccc(NC(=O)C(=O)NNC(=O)c3cc(C)[nH]n3)cc2Cl)CC1	764105912	CISVFJNFXGQOAF-UHFFFAOYSA-N	447.927	1.303	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccccc2-c2nnnn2C(C)C)c1O	764130365	FUMZCRIMJROZLL-UHFFFAOYSA-N	439.432	1.035	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2O1)C(=O)Nc1ccnc(Sc2ccccn2)c1	764168072	NONIJYLMVAMVIQ-MRXNPFEDSA-N	435.465	1.717	50	20	IDGD	
COc1ccc2cc(NC(=O)C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)ccc2n1	764259981	LZCAMBWMIKDBEN-UHFFFAOYSA-N	449.471	1.036	50	20	IDGD	
C[C@H]1C[C@@H](C)CN(C(=O)c2ccccc2NC(=O)C(=O)NNC(=O)Cc2ccccn2)C1	764264799	UNAQHSWENWGOGO-IYBDPMFKSA-N	437.500	1.528	50	20	IDGD	
CCOCC(=O)NNC(=O)C(=O)Nc1ccc(C(=O)Nc2ccc(OCC)cc2)cc1	764320510	ZMSSZIXZVDKXAB-UHFFFAOYSA-N	428.445	1.460	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C(=O)Nc1ccccc1N(C)S(C)(=O)=O)c1ccccc1	764330833	YPZRIHFEBHTESI-HNNXBMFYSA-N	432.502	1.362	50	20	IDGD	
CN(C)CCOc1ccc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1	764345308	FVTOWDDGOCSQGO-UHFFFAOYSA-N	436.472	1.212	50	20	IDGD	
Cc1ccc(C(=O)NCC(F)(F)F)cc1NC(=O)C(=O)NNC(=O)Cc1ccncc1	764355502	CYRFSEBGCYWUPW-UHFFFAOYSA-N	437.378	1.011	50	20	IDGD	
C[C@H]1Oc2ccc(NC(=O)C(=O)NNC(=O)c3cc(-c4cccs4)[nH]n3)cc2NC1=O	764383220	YPVFVSJLQZRBJP-SECBINFHSA-N	440.441	1.257	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=S)NCCc3ccccc3)CC2)cc1	764519875	ZVYBOZVOUSRGKT-UHFFFAOYSA-N	425.602	1.851	50	20	IDGD	
Cc1cccc(F)c1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	764685721	TXHWVMAFIALRDF-UHFFFAOYSA-N	436.465	1.622	50	20	IDGD	
COc1cc(C=NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)cc(OC)c1OCC(N)=O	764810610	OIGFGWSDJANGHC-UHFFFAOYSA-N	441.419	1.861	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)CCCN3C(=O)NC(C)(C)C3=O)n[nH]2)c1	765577032	RUGQXFDWMPTLAR-UHFFFAOYSA-N	426.477	1.565	50	20	IDGD	
O=C(CCc1cc(Cl)cs1)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765736500	TZKOPKIQSQFZPV-UHFFFAOYSA-N	434.949	1.940	50	20	IDGD	
COc1ccc(N2C[C@@H](C(=O)NNc3ccccc3S(C)(=O)=O)CC2=O)c(OC)c1	766662215	KHNBWAZQWRRPHX-ZDUSSCGKSA-N	433.486	1.604	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)N[C@H]2CC(=O)N(c3ccc(Cl)c(F)c3)C2)cc1	766869685	KDSOJDNJRYOELX-ZDUSSCGKSA-N	445.838	1.865	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2nnn(Cc3ccc(F)cc3)c2C)c2ccccc2c1=O	767432372	SINCYNVEWFOYOO-UHFFFAOYSA-N	449.446	1.579	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNC(=O)c2nnc(O)c3ccccc23)c2ncccc12	768236482	CUPKEAOEWGZSJT-UHFFFAOYSA-N	446.423	1.682	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)CCn3cc([N+](=O)[O-])cn3)n[nH]2)cc1OC	768275414	BQLGIBBUIKHEAX-UHFFFAOYSA-N	429.393	1.050	50	20	IDGD	
CN(C)C(=O)COc1ccc(C(F)(F)C(=O)NNC(=O)c2cccc(N(C)C)c2)cc1	769435524	JIUCVDJZOZFVPD-UHFFFAOYSA-N	434.443	1.773	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNS(=O)(=O)c1c[nH]c2cccc(F)c12	769858278	BXNYOZGILZXRFI-UHFFFAOYSA-N	439.494	1.532	50	20	IDGD	
Cc1c(C(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)cnn1Cc1ccccc1	772898860	UAACSADMBMKINY-UHFFFAOYSA-N	425.876	1.971	50	20	IDGD	
O=C(CCCC(=O)c1ccc(Br)cc1)NNC(=O)CNC(=O)c1cccnc1	772969360	XTFNVSPZDYGSDM-UHFFFAOYSA-N	447.289	1.775	50	20	IDGD	
COCCCS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2nccnc2C(C)C)cc1	773993411	URRTUBLNRLDZAR-UHFFFAOYSA-N	435.506	1.492	50	20	IDGD	
CC[C@@H](NC(=O)OC(C)(C)C)C(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776201576	JVKOLBIHDQGSKM-CQSZACIVSA-N	443.545	1.925	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)c3coc(C)n3)c2)cc1	776320182	LLNUVZASOVNWJA-UHFFFAOYSA-N	430.442	1.867	50	20	IDGD	
COC(=O)c1cc(NC(=O)NNc2cccc(S(C)(=O)=O)c2)cc(S(C)(=O)=O)c1	776476765	NUQXYCJJPKGADW-UHFFFAOYSA-N	441.487	1.429	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2cccc(-c3nnc(COC)o3)c2)c2ccccc2c1=O	776703394	VKDCKYPSRDLXEQ-UHFFFAOYSA-N	448.439	1.688	50	20	IDGD	
O=C(c1ccc2c(O)nc(S)nc2c1)N1CCN(S(=O)(=O)CBr)CC1	777779099	DONMOEFNOBYBTG-UHFFFAOYSA-N	447.336	1.064	50	20	IDGD	
O=C(NNc1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(C(=O)N2CCOCC2)c(F)c1	778697497	NPUWKXMFFKVJAS-UHFFFAOYSA-N	431.380	1.288	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1ccnn1Cc1ccc(C(C)(C)C)cc1	779462644	WCUPEGOYVHLQPK-CYBMUJFWSA-N	436.538	1.319	50	20	IDGD	
CCOc1ccc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)NC[C@H](C)C#N)cc2)cc1	781944147	JRCSJWFVLKZOJB-CQSZACIVSA-N	445.501	1.990	50	20	IDGD	
CNC(=O)[C@@H]1CN(C(=O)C(=O)NNc2ccccc2Br)c2ccccc2O1	782982942	PONVOLVSRDNLER-HNNXBMFYSA-N	433.262	1.432	50	20	IDGD	
CCOc1cc(N2CCN(C)CC2)ccc1NC(=O)C(=O)NNc1cncc(Cl)n1	783267232	DYIQUVOVLBDTFJ-UHFFFAOYSA-N	433.900	1.362	50	20	IDGD	
CC(=NNC(=O)CNC(=O)c1ccco1)[C@@H]1CN(C(=O)OCc2ccccc2)CCO1	783841869	YBXCEUVFSZJNDX-SFHVURJKSA-N	428.445	1.539	50	20	IDGD	
Cc1cc(Br)ccc1NC(=O)C(=O)NNC(=O)CNC(=O)c1cccs1	784005085	ZGZHADINYDBJFD-UHFFFAOYSA-N	439.291	1.335	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)c1cc2c(=O)n3ccccc3nc2n1C	784524411	OTFWXBLNHVSNFJ-UHFFFAOYSA-N	441.469	1.355	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)C(=O)Nc2cccc(C(=O)N3CCOCC3)c2)c1	784850708	AMTKKBNIQQHZRX-UHFFFAOYSA-N	426.429	1.027	50	20	IDGD	
CN(C)c1nccc(NNC(=O)C(=O)Nc2ccn(-c3ccc(Cl)cc3C#N)n2)n1	784971072	SIQGGZQRQYVWND-UHFFFAOYSA-N	425.840	1.335	50	20	IDGD	
CC[C@@H](Oc1ccccc1F)C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	786535416	QUICPIQXENCJHD-RDTXWAMCSA-N	432.404	1.514	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2O1)C(=O)Nc1cc(F)cc(Br)c1F	787542152	GLZCZOJJEQDZLL-ZDUSSCGKSA-N	440.200	1.817	50	20	IDGD	
O=C(CCC(=O)Nc1ccc2nc(O)[nH]c2n1)NNC(=O)c1cccc(OC(F)F)c1	787885474	CGAWOXAWDSOVLW-UHFFFAOYSA-N	434.359	1.445	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2cc(C)cnc2Cl)n[nH]1	787890435	ZOOCODCVEQUFPC-UHFFFAOYSA-N	428.836	1.842	50	20	IDGD	
COc1ccc(OC)c([C@H]2C[C@@H]2C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)c1	788084967	DGINVGMKKZOFHF-ZBFHGGJFSA-N	446.529	1.870	50	20	IDGD	
COc1ccc(C(=O)NNc2nnc(-c3ccccn3)s2)cc1S(=O)(=O)NC1CC1	788556382	KOTXHGFNLRFIGL-UHFFFAOYSA-N	446.514	1.806	50	20	IDGD	
CCc1csc(NC(=O)C(=O)NNC(=O)c2ccc(OC)c(Br)c2)n1	789735524	ZFSHPBYOOOXALI-UHFFFAOYSA-N	427.280	1.876	50	20	IDGD	
CC(=O)Nc1cc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)c(F)cc1F	789810717	QCLCYRPXIIJTSV-UGSOOPFHSA-N	446.410	1.582	50	20	IDGD	
CC[C@H](Nc1c([N+](=O)[O-])c(C)nn1C)C(=O)NNC(=O)[C@H]1OCC[C@H]1c1ccccc1	790315603	RHLQSNOMBNZMPO-ZOBUZTSGSA-N	430.465	1.547	50	20	IDGD	
CCOC(=O)c1csc([C@H]2CCCN2CC(=O)NNC(=O)Cc2nc(C)cs2)n1	792470373	IRVFGUJCASQWAM-CYBMUJFWSA-N	437.547	1.612	50	20	IDGD	
Cc1c(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cnn1-c1ccccc1	792736945	YYDHWKBXLQHLCZ-LJQANCHMSA-N	436.424	1.325	50	20	IDGD	
CN(C)N(C(=O)C1CCN(c2ccc3cccc(O)c3n2)CC1)[C@H]1CCS(=O)(=O)C1	792853211	CLOOVPFENMTDTF-KRWDZBQOSA-N	432.546	1.649	50	20	IDGD	
COc1ccc(S(=O)(=O)NC(C)(C)C)cc1NC(=O)C(=O)NCCSSC	793078105	BEJCWWRUEJMUBO-UHFFFAOYSA-N	435.593	1.838	50	20	IDGD	
COc1cc(F)cc(NNC(=O)C(=O)Nc2cc(S(=O)(=O)N3CCCC3)ccn2)c1	797104113	PFMBUDCKVDRGLT-UHFFFAOYSA-N	437.453	1.096	50	20	IDGD	
COc1cc2c(cc1S(=O)(=O)NNC(=O)c1c(Cl)cccc1Cl)OCC(=O)N2	797430086	NKBYBZJNQCLONZ-UHFFFAOYSA-N	446.268	1.956	50	20	IDGD	
CC(C)(C)OC(=O)NCC[C@H]1CCCN(CC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)C1	799360279	IDXSUTLPWJDVLZ-OAHLLOKOSA-N	449.508	1.983	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)NCc3cccc(CS(N)(=O)=O)c3)n[nH]2)cc1	800719266	SYJKAHMGTJBDEJ-UHFFFAOYSA-N	442.501	1.318	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)[C@@H]2CS[C@@H](Cc3ccccc3F)C(=O)N2)cc1	802061514	XRNSOZPPIAJVPO-IRXDYDNUSA-N	432.477	1.830	50	20	IDGD	
Cc1ccc(C(=O)NCCC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)c(O)c1	802065771	BNQLKNLSCJXTQG-UHFFFAOYSA-N	434.474	1.077	50	20	IDGD	
C=C1c2ccccc2C(=O)N1[C@H](C)C(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	802066272	SFFWVICNISKJTD-CYBMUJFWSA-N	428.470	1.758	50	20	IDGD	
O=C(CN1C(=O)c2ccccc2S1(=O)=O)NNC(=O)Nc1ccc(Cl)cc1Cl	802094369	SHUZCHJFJHXVNW-UHFFFAOYSA-N	443.268	1.991	50	20	IDGD	
O=C(Cc1ccc(S(=O)(=O)C(F)F)cc1)NNC(=O)Nc1ccc2c(c1)OCO2	802097093	FMTYCFOVGKIYIJ-UHFFFAOYSA-N	427.385	1.807	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(\C#N)C(=O)NS(=O)(=O)[C@H](C)[C@H](C)C(=O)OC)c1C	802163937	TZMMEKKSKRCBLO-ISOZNEMKSA-N	439.534	1.863	50	20	IDGD	
CN(C)S(=O)(=O)C[C@H](NC(=O)NNC(=O)C12CC3CC(CC(C3)C1)C2)C(F)(F)F	805768554	CQPLVNNYHUOJTE-PCPABOIYSA-N	440.488	1.356	50	20	IDGD	
COCCNS(=O)(=O)c1cccc(CNC(=O)NNc2ccc3c(=O)[nH]ccc3c2)c1	806829419	PUMBLEACFAJINU-UHFFFAOYSA-N	445.501	1.279	50	20	IDGD	
CC(C)(O)c1cccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)c1	806968243	DHHGBLIVIXUJMG-UHFFFAOYSA-N	427.429	1.992	50	20	IDGD	
CNc1nc(C)cc(C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)n1	807093999	RVCSUQJPRZTHFW-UHFFFAOYSA-N	431.928	1.059	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)NCc1ccnc(OC(F)F)c1	807255647	LDDVJTNPZKXICK-UHFFFAOYSA-N	448.474	1.726	50	20	IDGD	
CCCS(=O)(=O)c1ccccc1S[C@@H](C)C(=O)NNC(=O)N1CCN(C)CC1	807380128	PRQNMQXZVFXXPM-AWEZNQCLSA-N	428.580	1.339	50	20	IDGD	
O=C(NC[C@@H]1CCCSC1)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	807595031	LXMMRWZDBYHPLB-AWEZNQCLSA-N	426.564	1.558	50	20	IDGD	
CCn1c(NNC(=O)[C@@H](Cc2cnc[nH]2)NC(=O)CC(C)C)nc2ccccc2c1=O	809998811	WCAYXLCWFDFGKI-QGZVFWFLSA-N	425.493	1.356	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccc(-c3ncco3)cc2)cc1	813033943	SDTYPKWZSKJFNZ-UHFFFAOYSA-N	429.458	1.674	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccc3c(c2)OCO3)c1	813464078	BFPWDSQGFMMTLX-UHFFFAOYSA-N	434.474	1.912	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3cn(Cc4ccccc4)nn3)cc2C1	815567000	LQCPPYXATJVWJF-CYBMUJFWSA-N	438.513	1.912	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCc2nncn2C1)C(=O)Nc1cccc(COC2CCCCC2)c1	815691896	DZGYMQYHJZKHQR-INIZCTEOSA-N	440.504	1.476	50	20	IDGD	
Cc1ccc2ncc(C(=O)NNC(=O)[C@@H]3CCCN(C(=O)OC(C)(C)C)C3)c(=O)n2c1	816510337	SGWBURUEYPADDI-CQSZACIVSA-N	429.477	1.411	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)c2ccc(C(N)=O)c(Cl)n2)C1	816510884	IXHGZBKVKLNUJL-JTQLQIEISA-N	425.873	1.242	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)c1ccc(S(=O)(=O)N(C)C(C)C)cc1	825649167	DGLMBLJXTOEWBS-UHFFFAOYSA-N	434.518	1.597	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2CCN(C(C)C)C[C@H]2c2cnn(C)c2)cc1C	849485544	GXBFOLAKGOFJFB-PMACEKPBSA-N	440.548	1.637	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)c1ccc(NC(=O)c2ccccc2)cc1	875865674	QIMKXQFAFRGJPW-UHFFFAOYSA-N	427.424	1.989	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)NCC(=O)NNC(=O)CSc2ccc(C)cc2)cc1	913033454	BKHOZLXZGCUBJO-UHFFFAOYSA-N	435.527	1.416	50	20	IDGD	
Cc1ccc(-n2nc(C(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)c3c2CCC3)cc1	914602825	YMLULVDWPVDESD-UHFFFAOYSA-N	442.479	1.991	50	20	IDGD	
COCCOC(=O)c1c(C)[nH]c(C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)c1C	915638511	YTWRXJCHSNKSHC-UHFFFAOYSA-N	425.445	1.900	50	20	IDGD	
CN1CCN(Cc2ccc(CNC(=O)NNC(=O)c3ccc4c(c3)OCCO4)cc2)CC1	916387857	IUUADQOBRXEOJR-UHFFFAOYSA-N	439.516	1.349	50	20	IDGD	
CCCNC(=O)CN1CCC(NC(=O)NNC(=O)c2ccc(Cl)cc2Cl)CC1	916518686	FPCNFWPGDHLBPR-UHFFFAOYSA-N	430.336	1.928	50	20	IDGD	
O=C(COC(=O)CS(=O)(=O)Cc1ccc(Cl)s1)NNC(=O)c1cccs1	916535029	WXPHISFGALVATC-UHFFFAOYSA-N	436.920	1.382	50	20	IDGD	
CCN(CCCNC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)C(=O)OC(C)(C)C	916630324	KHVZUZYRAVGWON-UHFFFAOYSA-N	446.508	1.525	50	20	IDGD	
COc1cc(CNC(=O)NNC(=O)CSc2ccc(C)cc2)ccc1OCC(N)=O	916641064	UZICQQLLLWTDPJ-UHFFFAOYSA-N	432.502	1.490	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C3=NN(c4ccccc4)[C@H](C(N)=O)C3)n[nH]2)cc1	917178895	XSTNDPWMJRLLJX-IBGZPJMESA-N	431.456	1.266	50	20	IDGD	
O=C(NCC(F)(F)F)c1cccc(S(=O)(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c1	917714191	YNJIYJGVSFOGLL-UHFFFAOYSA-N	446.363	1.510	50	20	IDGD	
O=C(NNC(=O)N1CCC[C@H](OCC(F)(F)F)C1)c1csc(N2CCOCC2)n1	918002043	MPBLRSKSPUAUPM-NSHDSACASA-N	437.444	1.377	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)NCCC(=O)NC1CCCCC1	918125702	OJXQUYJSEYAQGS-UHFFFAOYSA-N	441.326	1.997	50	20	IDGD	
Cc1cnc(O)n1-c1ccc(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1	919970283	YEKDXTKUSAFNGN-UHFFFAOYSA-N	448.527	1.860	50	20	IDGD	
NC(=O)c1ccc(/C=C\C(=O)N2CCC[C@@H]2C(=O)NNC(=O)Cc2ccc(F)cc2)cc1	920033385	YLFBXTDKHKTZJB-XCJXAGMVSA-N	438.459	1.319	50	20	IDGD	
CC(=O)N[C@](C)(C(=O)NNC(=O)c1ccccc1Cl)c1ccc(S(C)(=O)=O)cc1	1321107680	VXOCMIXYDFNIHB-IBGZPJMESA-N	437.905	1.556	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)CN2C(=O)CCc3ccccc32)CC1	1321910287	OGHQBKNWVXUZNI-UHFFFAOYSA-N	430.505	1.760	50	20	IDGD	
COc1ccc(C(=O)CCC(=O)NNC(=O)c2n[nH]c3c2CCCC3)c(OC)c1OC	1337653727	RETRVGFKKCTTCU-UHFFFAOYSA-N	430.461	1.738	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)c2cc(O)ccc2n1	1778423059	IXCFJVBFMPZGOM-GHTZIAJQSA-N	433.892	1.292	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H]1COc3ccccc3O1)CCO2	1779293750	BOWKFVKZGJHSDC-NQIIRXRSSA-N	434.565	1.508	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@]2(C1)CN(C(=O)C1CCC3(CC1)OCCO3)CCO2	1779299513	WCRGRSDLGNBIPH-FQEVSTJZSA-N	440.613	1.601	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)C1(F)CN(C(=O)OC(C)(C)C)C1)CCO2	1781224360	VLBKCUHUNYJPIR-KUHUBIRLSA-N	447.935	1.793	50	20	IDGD	
CN(C)c1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)nc1	1781328372	PFASUPCMTVEDHL-PBHICJAKSA-N	429.290	1.282	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)c(F)c1	1781600317	VAVNBBXCUZTZGS-WMLDXEAASA-N	433.249	1.968	50	20	IDGD	
CCCC(=O)N[C@@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)Br)C1	1781998186	UXAKDEUKGRLFFN-NXEZDXNNSA-N	446.386	1.589	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)Oc1cccnc1)C2	1782178228	JHFTYQJAVBBBQS-QTQZEZTPSA-N	439.940	1.617	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3n[nH]c4c(Cl)cccc34)C2)C1	1782219629	CEMRBPWBDFAGOQ-LIRRHRJNSA-N	441.315	1.914	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3nsnc3NC)CCO2)C1	1783339270	QRKXVSKTRUSQAT-MEBBXXQBSA-N	432.344	1.197	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](C)Br)C3)C2)c(OC)c1	1783539171	YLEYQKMTYVSRMZ-DJJJIMSYSA-N	441.322	1.931	50	20	IDGD	
COc1ccc(CC(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](C)Br)C3)C2)cc1F	1783540107	RSWXVWITQPMSDO-DJJJIMSYSA-N	443.313	1.990	50	20	IDGD	
Cc1ccc(C(=O)C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)cc1	1783743385	LXZGZUYFUUNALF-MAUKXSAKSA-N	427.270	1.698	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CCCN(C)C3)C[C@@H]21	1783971677	DYKISZGMIUOVQE-NRKLIOEPSA-N	430.387	1.339	50	20	IDGD	
O=C(/C=C\c1c[nH]c2ccccc12)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21	1785174229	URZFTPDWQDOTEK-PFJARCFTSA-N	431.920	1.761	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CC(F)(F)C(=O)O)[C@H]2C1	1787436489	CBMZVCXEEVBFLX-USXUVBGUSA-N	431.263	1.312	50	20	IDGD	
COC(=O)CCC(=O)Nc1ccc(C2(NC(=O)c3cnccc3C(=O)NN)CCC2)cc1	1787684872	QIWBAVPSKSKYHO-UHFFFAOYSA-N	439.472	1.386	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)c3cccc(O)n3)CCC2)cc1)c1ccc(B(O)O)cc1	1788140107	HAJCPBQYSXORJS-UHFFFAOYSA-N	431.257	1.529	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4c(c3)OCO4)C[C@@H]21	1788762648	KDIFICRPRHJCGF-BXWFABGCSA-N	434.565	1.860	50	20	IDGD	
Cc1nn(C)c(C)c1CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]2C1	1789873372	VMIZQALVOWPYMT-VERUCKTNSA-N	445.391	1.795	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3cncnc3)C[C@@H]21	1790961753	PWGXEESYDMBKCP-QAETUUGQSA-N	439.354	1.562	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(=O)oc3)C[C@@H]21	1790961912	XGVMUQAWZWFNGO-MHEUCROKSA-N	427.295	1.407	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(C)nc3O)C[C@@H]21	1790963241	PHIWKZYHMPYWPP-TUUVXOQKSA-N	440.338	1.862	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnnc4ccccc34)C[C@@H]21	1791255009	YXSKXTBIPMEXQA-UHEFJODHSA-N	432.908	1.477	50	20	IDGD	
CC#C[C@H](CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)c1ccc(O)cc1	1791335061	QHYQZYLVZGGAFI-DIZVHYTASA-N	448.947	1.469	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c[nH]c3cnccc13)C2	1792870677	IICYQEZSZSNFKU-KOFHJDLBSA-N	435.322	1.797	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cn(C)nc1C	1793779558	IARGNEDVYMQIPU-YDOXXCSQSA-N	425.493	1.114	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1n[nH]c(C2CC2)c1F	1794483701	VXVCGLXODQCXBP-OPDFLTKYSA-N	443.317	1.803	50	20	IDGD	
Cc1cccc(-c2ncccc2C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](O)CCl)C3)c1	1796009750	DSHVUFUWRIKNQD-HNJRGHQBSA-N	443.931	1.860	50	20	IDGD	
CCc1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)nn1C	1796891893	NFZYSNCUQJEBCH-YVLAOCGESA-N	439.520	1.368	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cn2cc(Cl)ccc2n1	1797369868	YMNATHSTUHYXAX-MUJYYYPQSA-N	446.939	1.613	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CS[C@@H]1CCCCO1	1798481182	FPASNYRKRGXOAN-UIVXKWKOSA-N	426.583	1.257	50	20	IDGD	
COc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)CBr)C3)cc1	1798940572	OGMOWJVPSHLJEV-JJAZEVLHSA-N	425.323	1.929	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cc2cccnc2cc1F	1799243125	YWXTVQRWZYCNBH-KYFSNAEOSA-N	449.910	1.760	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1Cc3[nH]nc(C(F)(F)F)c3C1)C2	1799272454	ROJGHGKFTFLBPN-RXHHHXIQSA-N	448.873	1.750	50	20	IDGD	
Cc1cccc(/C=C/C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Br)n1	1799343084	MSNOSWGGUFOXQO-OWOJSOJESA-N	426.286	1.683	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(S(C)(=O)=O)ccc1F	1799860820	UNKMSGAPHIHWDF-DJZPMSPPSA-N	446.928	1.450	50	20	IDGD	
COc1ncc(C(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)cc1C	1803140327	CJVOCTNMZKJNDV-BPQIPLTHSA-N	432.908	1.713	50	20	IDGD	
C=CCSCC(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1804173579	XNSDKKUOUCTQMS-NQIIRXRSSA-N	439.346	1.000	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC2(CCN(C(=O)[C@@H]3CCC(=O)N3C)CC2)C1	1805387497	ORQOOHBVGANHFM-CABCVRRESA-N	428.371	1.869	50	20	IDGD	
Cc1nc(CC(=O)N2CC[C@@H](CNC(=O)CCBr)[C@H]2c2cccnc2)no1	1806342184	KKOVTGZQHLMMRN-KBXCAEBGSA-N	436.310	1.807	50	20	IDGD	
Cc1cccc(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)c1	1807366572	NGDUIYOFJYDXFN-FYYLOGMGSA-N	443.312	1.703	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)CC2CCCC2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1	1807371654	WZEHDWOOKWAIJA-OFNKIYASSA-N	435.333	1.661	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)c1ccc2nc[nH]c2c1	1809815731	FVDOHDGNRHNTIY-KFKAGJAMSA-N	427.892	1.877	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1CCN(C(=O)/C=C\C(=O)NC2CC2)[C@@H]1c1cccnc1	1810546339	TYSWENNFJWVOPF-XCWBYQPUSA-N	444.608	1.774	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@H](O)C(=O)N1CCC2(CCCN(C(=O)[C@H](F)Cl)C2)CC1	1810902576	KUFVBWHPLLUBJF-KBPBESRZSA-N	435.924	1.638	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)[C@@H]2[C@@H]3C=CS[C@@H]23)[C@@H]1c1cccnc1	1812385961	ASNJHUIIZCZBSE-DPDIENECSA-N	443.573	1.336	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)[C@@H](C)n2ccnn2)[C@@H]1c1cccnc1	1812400183	YLZVXZHNDLRJBV-XNISGKROSA-N	435.326	1.724	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)COCCO)[C@@H]1c1cccnc1	1812776270	CQKFYVLNJZTOCE-YQQAZPJKSA-N	428.327	1.270	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)C23CC(C(=O)OC)(C2)C3)[C@@H]1c1cccnc1	1812837917	NHNJVEXMYULUOL-CTHIEXCLSA-N	449.935	1.685	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)Cc2nnc(C)s2)[C@H]1c1cccnc1	1813030804	LMMPSGVCRBSGEY-VKJFTORMSA-N	437.953	1.744	50	20	IDGD	
C#CCCCCC(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1813223817	UVHFNMHIVXQMRN-OFNKIYASSA-N	433.317	1.275	50	20	IDGD	
Cc1cncc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)c1	1816496490	MFLUXAXKAATIIL-LJQANCHMSA-N	433.277	1.413	50	20	IDGD	
Cc1noc(C)c1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1	1817471400	YNAXHZGEAAEXNW-KRWDZBQOSA-N	437.265	1.314	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ncc[nH]2)[nH]n1	1818111388	IKZPPOHEHCDNLF-HURLIOHXSA-N	437.464	1.573	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc4ncccn4n3)sc2C1	1819016044	OZWZLTBTLCLLBM-GHMZBOCLSA-N	434.909	1.665	50	20	IDGD	
Cc1nc[nH]c1CSCC(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1	1819320930	VIWGBMCDYLCJPC-HUUCEWRRSA-N	440.957	1.966	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)/C=C/c2cnc[nH]2)[nH]n1	1819404157	BMZUIQVJCLVWLK-BDUNBXCCSA-N	449.475	1.151	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@H]1CCc2nc(NC(=O)c3cnc(O)[nH]3)sc2C1	1820658767	OMCKUPQRQPIZFN-SFYZADRCSA-N	428.312	1.829	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(C#N)c2)[nH]n1	1822414311	AKEYNTFKDHHYHF-SFHVURJKSA-N	437.504	1.960	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)CNC(=S)NCC)sc2C1	1824492538	OZVSIUCFJMGJKS-QWRGUYRKSA-N	432.015	1.947	50	20	IDGD	
C=CCO[C@@H](C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1	1824504510	PZNYLQLKXZNMFZ-LAUBAEHRSA-N	428.338	1.191	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(=O)n1C)CC2	1825636420	FUHMCBWSPKEJHT-UWVGGRQHSA-N	439.335	1.851	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CC[C@H](N)C(N)=O)CC1	1826935459	QGGIZAIJRZDDQW-DOXZYTNZSA-N	435.396	1.435	50	20	IDGD	
O=C(Cc1cccc([N+](=O)[O-])c1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1829622357	UGRSPKASNJMKKM-SJLPKXTDSA-N	429.832	1.128	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(C4CC4)on3)CCO2)C1	1830198520	AWQTZDPBSYSYCA-MOPGFXCFSA-N	446.331	1.858	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccccc3C(N)=O)C2)C1	1830363534	AQDGZVWULBMVSM-OAQYLSRUSA-N	437.924	1.121	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3CCCCO3)C2)C1	1830534242	YPUFTNNIMBAVHB-VKJFTORMSA-N	433.343	1.043	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3cnc4ccccn34)CCO2)C1	1830654664	BBOWCOINTJFFSO-AVRDEDQJSA-N	448.951	1.741	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ncc(OC)cc3F)C2)C1	1831644205	RKFDVQHJLNKPSW-FOIQADDNSA-N	443.903	1.707	50	20	IDGD	
CCc1nc(C(=O)N2CCC([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)co1	1831873763	WPIBCYJXRNODFQ-GOSISDBHSA-N	433.553	1.843	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)C3CCC(CO)CC3)CCO2)C1	1832513777	AVCILKIBCFMFJA-JWYNLTDQSA-N	430.973	1.649	50	20	IDGD	
O=C(CN1CCc2sccc2C1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1832584435	BPXSETOTQKVFNB-MJGOQNOKSA-N	445.944	1.097	50	20	IDGD	
Cc1ccc(C(=O)NCC(=O)N2CCCC[C@H]2C2CCN(C(=O)[C@@H](O)CCl)CC2)cc1	1832911291	ZHUHQXCCPHYLOS-PMACEKPBSA-N	449.979	1.944	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3nc(C(C)C)cs3)CCO2)C1	1833287719	BDHNAEDXEVGVDX-LIRRHRJNSA-N	445.969	1.590	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)[C@@H]3CCCN3C)CC2)CC1	1833623593	MOJFPXDQUAQUBC-PBHICJAKSA-N	429.403	1.436	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)nc1C	1833693142	CQPZVPOKOAXTIJ-MAUKXSAKSA-N	444.301	1.459	50	20	IDGD	
Cc1ccsc1C(=O)N1CCO[C@@]2(COCCN(C(=O)CCBr)C2)C1	1833944116	UUDZVOMMTAIFKE-QGZVFWFLSA-N	431.352	1.912	50	20	IDGD	
N#CCC(=O)N1CCO[C@]2(COCCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1	1834767531	SXAMDKWRHAZVMH-ZZKIFARHSA-N	430.411	1.242	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)CCC(=O)N3CCCC3)CC2)CC1)[C@@H](F)Cl	1835078947	GJCVAAVHKAJXJZ-LJQANCHMSA-N	430.952	1.495	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)[C@@H]3C[C@@H]3F)CC2)CC1	1835116431	NBZLWHZHNJWFNM-UTMDGHJCSA-N	446.527	1.050	50	20	IDGD	
C[C@@H](Cn1cncn1)C(=O)NC1CCN(C2CCN(C(=O)C(Cl)Cl)CC2)CC1	1835810704	YKUYAJCHKNDAKH-ZDUSSCGKSA-N	431.368	1.290	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CSc3ncccn3)CCO2)C1	1836109728	HCQBWAIWGYJODP-KXBFYZLASA-N	442.969	1.433	50	20	IDGD	
Cc1nn(C)cc1C(=O)N1CCC(N2CCC(NC(=O)[C@H](F)Br)CC2)CC1	1836413724	NFMNFFKNQNGSBA-INIZCTEOSA-N	444.349	1.604	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC(OC2CCN(C(=O)CSC(=N)N)CC2)CC1	1836671376	XAXAJRMNRLUJKX-GFCCVEGCSA-N	449.415	1.643	50	20	IDGD	
Cc1ccc(CCC(=O)N2CCC(OC3CCN(C(=O)[C@H](O)CCl)CC3)CC2)cn1	1836714878	ADGBURDFUCENGG-HXUWFJFHSA-N	437.968	1.921	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CCC(F)(F)C3)C2)C1	1837708510	ITLLPDZVFYPNGR-CRAIPNDOSA-N	434.556	1.730	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3c[nH]c4nccc-4c3)C2)C1	1837711665	NDPKENPPDLFHEG-NRFANRHFSA-N	446.580	1.436	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3n[nH]c(C4CC4)c3F)C2)C1	1839143437	WEXKMLWUGCXCPX-YJYMSZOUSA-N	428.892	1.514	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4cccnc4nc3O)C2)C1	1839148450	YNSXOFBBAKHRRS-IIBYNOLFSA-N	448.907	1.423	50	20	IDGD	
COc1cccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)n1	1839151659	ZNSNBZUVRDQELS-RTBURBONSA-N	446.331	1.397	50	20	IDGD	
COCc1c[nH]c(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)c1	1839153646	MXAKPPXOVGGMCA-MOPGFXCFSA-N	448.347	1.467	50	20	IDGD	
C[C@H](C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](F)Br)CCO2)C1)n1cccc1	1839202802	QBLQVBRTJVFEFO-KEYYUXOJSA-N	432.290	1.196	50	20	IDGD	
O=C(C(Cl)Cl)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1Cc3ccccc3N1)CCO2	1839736950	RNWSMNFTPJLSRL-KXBFYZLASA-N	428.316	1.283	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3nccnc3C)C2)C1	1839966137	VSGMPRQONVXAIY-KBXCAEBGSA-N	441.326	1.029	50	20	IDGD	
COc1cccc(/C=C/C(=O)N2CCO[C@@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)c1	1839996268	AFTHGUTXVISSDT-XJDXJNMNSA-N	443.327	1.969	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnoc3C3CC3)C2)C1	1840032018	LJHFCFYRRWZRFD-KZULUSFZSA-N	442.310	1.405	50	20	IDGD	
CCc1noc(C)c1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)Br)CCO2	1840033323	ALJHLSDJFSVDBH-KPZWWZAWSA-N	444.326	1.399	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(C)cc(OC)c3)C2)C1	1840155137	QTYDFFJZLPDKTM-RXVVDRJESA-N	440.924	1.327	50	20	IDGD	
O=C(Cc1cccnc1Cl)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840186853	QJJMJUYZJSMAMK-KRWDZBQOSA-N	436.723	1.538	50	20	IDGD	
O=C(c1cc2cccnn2c1)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840189647	DRYFVCSTYYTGSW-GOSISDBHSA-N	427.288	1.208	50	20	IDGD	
Cc1cc(F)ccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1840778766	NNCPHBFCBPCKGX-QAPCUYQASA-N	447.276	1.895	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H]3CCCSC3)CCO2)C1	1840865641	UESCPIMZUMOTIB-JLSDUUJJSA-N	439.405	1.822	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)[C@H](C)C2(O)CCC2)C1	1841048004	FHQJMEQJJNXDRE-AWEZNQCLSA-N	445.472	1.888	50	20	IDGD	
Cc1cnc(C(=O)N2CCCC23CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C3)cn1	1842416389	BVKPGYQBPLAWIH-AWEZNQCLSA-N	437.928	1.734	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)c2cncn2C)C1	1842491473	RKVFDBIQTZOXCL-UHFFFAOYSA-N	427.417	1.384	50	20	IDGD	
COC(=O)[C@@H](CC(=O)N1CC2(CCCN2C(=O)[C@H](F)Cl)C1)NC(=O)OC(C)(C)C	1843366917	XWRZXWHZKLZGND-YPMHNXCESA-N	435.880	1.181	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2c[nH]c3ncccc23)C1	1843672932	BCVZRHKOMYUZPQ-VULFUBBASA-N	433.472	1.514	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@H](O)[C@H](C(=O)N2CCCC23CN(C(=O)C(Cl)Cl)C3)C1	1845108867	VOLYMNSQYRBTFM-VXGBXAGGSA-N	436.336	1.221	50	20	IDGD	
COc1ccc(C(=O)N2CC3(CCCN3C(=O)[C@H](F)Br)C2)c(O)c1OC	1845219537	VJNUAYPIGKROTN-AWEZNQCLSA-N	431.258	1.917	50	20	IDGD	
N#C/C(=C\c1ccc(Br)cc1)C(=O)N1CCCC12CN(C(=O)c1nc[nH]n1)C2	1845872574	BKIAIIIAUAQBRR-RIYZIHGNSA-N	441.289	1.991	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)CCn2ccnn2)C1	1846623211	HNOHWMKMVQQEMB-UHFFFAOYSA-N	442.432	1.019	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)c2cnccn2)c1	11362047	OGPGYZDMMQOXKZ-UHFFFAOYSA-N	427.442	1.361	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)nc2c1cnn2Cc1ccco1)C(=O)NC1CC1	14311795	DMGJWNZHMJJISL-UHFFFAOYSA-N	444.451	1.779	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)c2cc(S(=O)(=O)N3CCOCC3)ccc2Cl)n1	14511901	JCMGPXPUKXKYSH-UHFFFAOYSA-N	425.898	1.525	50	20	IDGD	
C=CCc1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc(OC)c1OC	16226051	HLKCKDQGZGVQAF-UHFFFAOYSA-N	447.513	1.757	50	20	IDGD	
O=C(Cc1cccc2ccccc12)NNC(=O)CN1C(=O)COc2ccc([N+](=O)[O-])cc21	27136474	FYXYYWUWFVWIPB-UHFFFAOYSA-N	434.408	1.864	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc([N+](=O)[O-])c(O)c2)c1	28196167	NCPFXDIIKNLFNT-UHFFFAOYSA-N	436.446	1.406	50	20	IDGD	
Cn1cc(S(=O)(=O)NNC(=O)c2cc3c(s2)CC[C@H](C(C)(C)C)C3)cc1C(N)=O	115631604	GKOLGXDCMHFIHV-LBPRGKRZSA-N	438.575	1.960	50	20	IDGD	
C[C@H](c1ccc(S(C)(=O)=O)cc1)N(C)C(=O)NNC(=O)CNC(=O)c1cccs1	725872290	CGNVRTRFLPXLIB-GFCCVEGCSA-N	438.531	1.315	50	20	IDGD	
CN(C)C(=O)[C@H]1CCCN1CCCNC(=O)NNC(=O)Cc1ccc2ccccc2c1	726278566	WRXIPLRLCCMONF-HXUWFJFHSA-N	425.533	1.655	50	20	IDGD	
COc1ccc(CN2C[C@H](C(=O)NNC(=O)[C@@H](C)Oc3ccc(F)cc3)CC2=O)cc1	726522860	YXHVGLXQLVUUAX-GDBMZVCRSA-N	429.448	1.798	50	20	IDGD	
COC(=O)CCn1nc(C)c(C=NNC(=O)CCN2CCN(c3ccccc3)CC2)c1C	727057761	HMEJBIIVPHVOIQ-UHFFFAOYSA-N	440.548	1.725	50	20	IDGD	
O=C(CCCc1ccccc1)NNC(=O)c1cccc(S(=O)(=O)NC[C@@H]2CCCO2)c1	727860290	BJLRYAOKHCAYFH-IBGZPJMESA-N	445.541	1.928	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(Cl)c(S(=O)(=O)NNC(=O)NC(C)C)c1	728263382	XZQWBRJSSFHTLR-UHFFFAOYSA-N	426.948	1.271	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)NCc1ccccc1S(=O)(=O)N1CCCCC1	728943380	NHHAQCVFRAEPBC-UHFFFAOYSA-N	431.518	1.329	50	20	IDGD	
COCCOc1cn(-c2ccccc2)nc1C(=O)NNC(=O)c1ccc(OC)c(OC)c1	729297197	YKWLWEAQBUVMOY-UHFFFAOYSA-N	440.456	1.990	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)NCC2(N3CCCC3)CCOCC2)cc1	729623915	QEEOCJXMVKXKAC-KRWDZBQOSA-N	434.537	1.828	50	20	IDGD	
COc1ccnc(NNC(=O)CC2(CC(=O)NNc3nccc(OC)n3)CCCCC2)n1	729838995	WSNWZKITQFSZIO-UHFFFAOYSA-N	444.496	1.601	50	20	IDGD	
CSCC[C@@H](NC(=O)c1ccc(Cl)cc1Cl)C(=O)NNC(=O)Cc1cc[nH]n1	730103122	XYBGQUDVDMRGKK-CQSZACIVSA-N	444.344	1.958	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)[C@H]2CCN(c3ccc4c(c3)OCCO4)C2=O)c1	730512204	JMSFXQGDXNHZRB-GOSISDBHSA-N	439.468	1.654	50	20	IDGD	
O=C(COC(=O)Cn1[nH]cc2c(=O)ncnc1-2)NN=C(c1ccccc1)c1ccccc1	730660102	YSWPEAWWQPWFSG-UHFFFAOYSA-N	430.424	1.183	50	20	IDGD	
COc1ccnc(NNC(=O)CCCS(=O)(=O)c2ccc(Br)cc2)n1	731000300	OBJTVWXXJVLCOT-UHFFFAOYSA-N	429.296	1.945	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)C1CCN(C2=NS(=O)(=O)c3ccccc32)CC1	731328482	NLUFZQXFQRVSNF-UHFFFAOYSA-N	444.488	1.377	50	20	IDGD	
Cc1c(C(=O)NNC(=O)COc2ccccc2F)nnn1-c1ccc2c(c1)OCCO2	731453406	KIYZBPCEJQHKNI-UHFFFAOYSA-N	427.392	1.326	50	20	IDGD	
O=Cc1ccc(OC(F)(F)C(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1	731596866	HZVURKYNUCWWIQ-UHFFFAOYSA-N	426.401	1.225	50	20	IDGD	
CC[C@@H]1CCCN(C(C)(C)CNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)C1	732245596	BAFNCFFAONNOGZ-QGZVFWFLSA-N	431.585	1.924	50	20	IDGD	
COC(=O)c1ccc(S(=O)(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c([N+](=O)[O-])c1	733122871	FNIBYNNBGZDDKW-UHFFFAOYSA-N	445.413	1.190	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)N[C@H]2CCN(C3CCN(C)CC3)C2)cc1	734284067	PVFSAWHJZUKAOT-SJORKVTESA-N	433.553	1.352	50	20	IDGD	
CC(C)C(=O)N1CCCC[C@H]1C(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	734826058	VJDLNTIRLIPNPQ-INIZCTEOSA-N	439.557	1.753	50	20	IDGD	
COc1ccc(CCCC(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)cc1	735117245	DMODXBALFCCENJ-UHFFFAOYSA-N	447.561	1.492	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)Cc1ccccc1OC(F)F	735647164	JORLAUZBOHTWDE-UHFFFAOYSA-N	426.445	1.893	50	20	IDGD	
O=C(COC(=O)c1cc2c(nc1O)CCCCC2)NNC(=O)[C@@H]1COc2ccccc2O1	738760097	WQLGMSDDACDHKN-SFHVURJKSA-N	441.440	1.200	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc(OC(F)(F)F)cc1)NNc1ncnc2[nH]cnc12	740746866	UNKAAEOLTKWZRP-UHFFFAOYSA-N	445.383	1.063	50	20	IDGD	
CC(C)c1ccc(N2CC[C@H](C(=O)NNC(=O)CNC(=O)c3cccs3)C2=O)cc1	741684610	IXSFWZIAYCAMIL-MRXNPFEDSA-N	428.514	1.802	50	20	IDGD	
CC(=O)N/C(=C/c1ccccc1)C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	744621739	PAQHBQXESAIQAJ-XDJHFCHBSA-N	444.513	1.328	50	20	IDGD	
CN(C)c1ncc(Br)cc1C(=O)OCC(=O)NNC(=O)c1ccc(C#N)cc1	745025698	INPAWBMYTUJSDE-UHFFFAOYSA-N	446.261	1.400	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)N[C@@H]3C[C@H](C)N(c4cnn(C)c4)C3=O)n[nH]2)cc1	745919465	UEDQYANLXPWURY-SCLBCKFNSA-N	436.476	1.257	50	20	IDGD	
CC(C)(C)OC(=O)NCc1nc(C(=O)NNC(=O)Cc2cn3ccccc3n2)cs1	746556353	UFQQHPABTRIYEQ-UHFFFAOYSA-N	430.490	1.819	50	20	IDGD	
COc1cc(C)nc(NNC(=O)[C@@H](CCSC)NS(=O)(=O)c2ccc(C)cc2)n1	746630119	FOZNWDKRRRPCLK-OAHLLOKOSA-N	439.563	1.645	50	20	IDGD	
COc1cc(C(C)=NNC(=O)Cc2cc(O)nc(S)n2)ccc1S(=O)(=O)C(F)F	747047246	TVFPIOMQFSIFDV-UHFFFAOYSA-N	446.457	1.559	50	20	IDGD	
NS(=O)(=O)c1cccc(N2C[C@@H](C(=O)NNc3cccc(C(F)(F)F)c3)CC2=O)c1	747994845	AIFWOUONZAFOIW-NSHDSACASA-N	442.419	1.849	50	20	IDGD	
NS(=O)(=O)c1cccc(N2C[C@@H](C(=O)NNc3ccc(C(F)(F)F)cc3)CC2=O)c1	748508418	XBNLVAYYZIHGDS-NSHDSACASA-N	442.419	1.849	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NC[C@@H](C)CNC(=O)OC(C)(C)C)c2ccccc2c1=O	750440176	KCYSKORULUXSJP-CYBMUJFWSA-N	446.508	1.521	50	20	IDGD	
Cc1cc(S(N)(=O)=O)cc(C(=O)NNC(=O)[C@H](C)Nc2nc3ccccc3s2)c1C	751591487	VYHCCERWKKZTFZ-LBPRGKRZSA-N	447.542	1.822	50	20	IDGD	
CO[C@@H](C)c1nc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cs1	753057903	RKFNONGNDKRRHP-NSHDSACASA-N	441.535	1.245	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N2CCOCC2)cc1NC(=O)NNC(=O)CC(C)(C)C	755442075	OVHSLGOCEUGVRT-UHFFFAOYSA-N	442.538	1.695	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)Nc2ccc(-n3nccn3)nc2)c2ccccc2c1=O	755948346	YEQBJMHNZVGKMK-UHFFFAOYSA-N	433.432	1.420	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)Nc1cccc(CS(=O)(=O)NC(C)(C)C)c1	756207378	RQIYYLAXLPFOCE-CYBMUJFWSA-N	430.527	1.109	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2ncn(Cc3ccccc3)n2)c2ccccc2c1=O	756237844	NLFUUWYNMXBADD-UHFFFAOYSA-N	432.444	1.523	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1N1CCCS1(=O)=O	756704222	HZLOELUCOULIJT-UHFFFAOYSA-N	433.446	1.910	50	20	IDGD	
CCCNS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2cc(Br)c[nH]2)cc1	756775908	MTYBNHABQCLXBU-UHFFFAOYSA-N	444.311	1.932	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)Nc2ccc3c(c2)N(C)C(=O)CO3)cc1	756829251	FENMEPIEAFAHCE-ZDUSSCGKSA-N	426.429	1.865	50	20	IDGD	
COc1cc(-c2noc(CCC(=O)NNc3ccc(C(N)=O)nn3)n2)cc(Cl)c1OC	757392494	MVOOLSXDZCNFRP-UHFFFAOYSA-N	447.839	1.372	50	20	IDGD	
O=C(NNS(=O)(=O)CCC1CC1)c1ccccc1NS(=O)(=O)c1cccs1	757926915	XVASNUGOFWTXMK-UHFFFAOYSA-N	429.545	1.913	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)Nc1cccc2c1OCO2	757997490	ZGDZHDCZSGPONF-UHFFFAOYSA-N	432.458	1.666	50	20	IDGD	
O=C(NCCCNc1ccc(C(F)(F)F)cn1)NNC(=O)C(=O)Nc1ccccn1	758689931	UIWRABCZAYMELA-UHFFFAOYSA-N	425.371	1.267	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)NC[C@H]1CSCCN1Cc1ccccc1	759199780	DOANUUIDRGOXFN-IBGZPJMESA-N	438.557	1.825	50	20	IDGD	
CS(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)cc1Cl	759387925	KDUAOCWDJLBWDA-UHFFFAOYSA-N	442.837	1.502	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC2(CC1)CC(C(=O)NNC(=O)COc1ccccc1O)=NO2	760297234	PVQIXWUREJJEBI-UHFFFAOYSA-N	448.476	1.464	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)c1ccc[nH]1	760864166	VBBVTLJZPMLHOF-OAHLLOKOSA-N	449.533	1.060	50	20	IDGD	
COc1ccc2c(c1)[C@@H](C(=O)NNC(=O)c1ccc(S(=O)(=O)N3CCCC3)cc1)CC2	761398219	BCPALKNAGQDCKM-IBGZPJMESA-N	443.525	1.971	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)c1cc(S(N)(=O)=O)ccc1Cl	761624228	HVVGKSHAJLOGMC-UHFFFAOYSA-N	429.907	1.549	50	20	IDGD	
CN1CCN(c2cc(CNC(=O)NNC(=O)CSc3ccccc3O)ccn2)CC1	763464827	ZAKNECSQBUPBCV-UHFFFAOYSA-N	430.534	1.162	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cccc(-c3cnco3)c2)cc(OC)c1OC	763539666	ORYMIKHAMGVXAI-UHFFFAOYSA-N	440.412	1.767	50	20	IDGD	
C[C@H](c1ccccc1)n1ccc(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)n1	763575604	YTNZKOZSSPMECF-RDTXWAMCSA-N	435.440	1.418	50	20	IDGD	
COC(=O)c1cc(OC)ccc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccccc2)[nH]n1	763613200	JYWHMADFEPPJMI-UHFFFAOYSA-N	437.412	1.272	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(N3CCOCC3)cc2C)c1	763623934	RITNMYMTJNIUHE-UHFFFAOYSA-N	426.473	1.305	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(N3CCCC3=O)c(F)c2)c1	763628967	CUBCVMQOSGZNAS-UHFFFAOYSA-N	428.420	1.426	50	20	IDGD	
CCN(CC)C(=O)c1ccccc1NC(=O)C(=O)NNC(=O)COc1ccccc1OC	763646539	HVIMHFBUXSBWPP-UHFFFAOYSA-N	442.472	1.342	50	20	IDGD	
Cc1ccc(Cn2nccc2NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)s1	763840365	JXIRYSGSUGCVIC-UHFFFAOYSA-N	431.449	1.605	50	20	IDGD	
COc1ccc(S(=O)(=O)C(F)(F)F)cc1NC(=O)C(=O)NNC(=O)CC(C)C	763882604	QXALYXOFZNUTPV-UHFFFAOYSA-N	425.385	1.121	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2c(C)cc(Cl)cc2C)c(=O)n(C)c1	763883756	QLURQICANLCHEW-ZDUSSCGKSA-N	434.880	1.517	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)C(=O)Nc2cccc(CS(C)(=O)=O)c2C)cc1	763890631	DJDOVPPIBDUOCI-UHFFFAOYSA-N	449.554	1.726	50	20	IDGD	
CON(C)S(=O)(=O)c1ccc(NC(=O)NNC(=O)CSc2ccccc2O)cc1	763914950	JWJAYDNQNJPWRN-UHFFFAOYSA-N	440.503	1.519	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)oc(=O)n3C)ccc1OC(C)C	763916616	PTYNWHJYCWRNQL-UHFFFAOYSA-N	442.428	1.327	50	20	IDGD	
Cc1nc(N2CCOCC2)ccc1NC(=O)C(=O)NNC(=O)Cc1ccc(Cl)cc1	763935958	BOROEOJCCGPIEU-UHFFFAOYSA-N	431.880	1.209	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CC[C@@H](C)C3)cn1	763939216	BCZHTVYQBCCMQW-GFCCVEGCSA-N	432.502	1.693	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cccn2C)n(-c2cccc(Br)c2)n1	763992375	DARHNVUMTNUQRN-UHFFFAOYSA-N	445.277	1.681	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1cccc(Cl)c1-n1cncn1	764138344	CILKJMLIYWBUKA-UHFFFAOYSA-N	428.836	1.258	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)CC2CCCC2)c(C(=O)N2CCCC2)cc1OC	764178509	BXGJXPGDFHMSFN-UHFFFAOYSA-N	446.504	1.606	50	20	IDGD	
CCCS(=O)(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)CCCc2ccccc2)c1	764224968	UOBCUFXFIWOIJI-UHFFFAOYSA-N	446.529	1.947	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)OCO3)c1	764229874	CRRLTOCUHQHVDT-UHFFFAOYSA-N	436.218	1.586	50	20	IDGD	
COc1c(F)cc(NC(=O)C(=O)NNC(=O)c2cc(Br)ccc2O)cc1F	764276384	CVRUNCYIDLDNIW-UHFFFAOYSA-N	444.188	1.841	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C(=O)Nc1cccc(-c2nnnn2C2CC2)c1)c1ccccc1	764327750	DPIQAMYHEWZDLC-SFHVURJKSA-N	433.472	1.955	50	20	IDGD	
CNS(=O)(=O)c1csc(C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)c1	764329373	JXCZIRBAUWKTSQ-UHFFFAOYSA-N	430.458	1.584	50	20	IDGD	
O=C(NNC(=O)c1cc2ccccc2o1)C(=O)Nc1ccc2nc3n(c(=O)c2c1)CCC3	764332763	YMABCPJKBKEJMM-UHFFFAOYSA-N	431.408	1.489	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cnc1Br	764345490	GIMKMZYFBUTILT-UHFFFAOYSA-N	443.261	1.738	50	20	IDGD	
CN(C)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)COCc2ccccc2)cc1Cl	764366954	FZSPJPZIGZFHSQ-UHFFFAOYSA-N	432.864	1.345	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)C(=O)Nc1cccnc1OCc1ccccc1	764367989	QTVYMDPCJFZDOI-UHFFFAOYSA-N	434.452	1.963	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)N(C)CC3)n[nH]1	764376892	LBLPXBVFBAHEJH-UHFFFAOYSA-N	434.456	1.477	50	20	IDGD	
CO[C@H]1Cc2ccc(NC(=O)C(=O)NNC(=O)c3cc(-c4cccs4)[nH]n3)cc2C1	764376910	LIMLURPESYMDKF-AWEZNQCLSA-N	425.470	1.652	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1ccn(-c2ccncc2)n1	764393561	HVTUAVCHAUAZOL-UHFFFAOYSA-N	426.458	1.154	50	20	IDGD	
CCN(Cc1ccccc1NC(=O)C(=O)NNC(=O)CSc1ccccc1O)C(C)=O	764405613	USQKAVRAPHRGIL-UHFFFAOYSA-N	444.513	1.639	50	20	IDGD	
COc1cc2nc(C)sc2cc1NC(=O)C(=O)NNC(=O)c1cncc(NC(C)=O)c1	764432099	BZHVANPZSFJOEQ-UHFFFAOYSA-N	442.457	1.366	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@@H]2CCO[C@@H](C(C)(C)C)C2)cc1	764509545	AEIYHELDNWZMCI-NVXWUHKLSA-N	440.566	1.540	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)[C@@H](C)NS(=O)(=O)c2cccc(C#N)c2)c1C	764553115	RFFJNOYYIMDNFF-CVEARBPZSA-N	444.513	1.457	50	20	IDGD	
CC(=NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1)c1cccc(F)c1	764816361	JGJZPMPESJSYBR-UHFFFAOYSA-N	432.521	1.981	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)c3ccc(CNS(C)(=O)=O)o3)n[nH]2)cc1C	765557939	DJBGTFDTNIRQMO-UHFFFAOYSA-N	431.474	1.411	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	765751056	IEEAXNHLOPFTTR-UHFFFAOYSA-N	434.899	1.823	50	20	IDGD	
CC(=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O)c1cc(Cl)c(Cl)cc1O	766003246	UTBGNFUNIIUADT-UHFFFAOYSA-N	432.289	1.124	50	20	IDGD	
CCn1nc(C)c(C(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)c1Cl	766641833	NHNZOXJXACLCAA-UHFFFAOYSA-N	432.956	1.752	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)C1(c2cccc(F)c2)CCC1	766653961	SBGIZBQGBFQUIK-UHFFFAOYSA-N	438.503	1.853	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)[C@H](Br)C(C)(C)C)cc1OC	766749867	FTYLTYFTWWWXIN-AWEZNQCLSA-N	431.283	1.818	50	20	IDGD	
Cc1nc(-c2ccccc2)ncc1C(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	767621278	BGYCAHSMQNIKRC-UHFFFAOYSA-N	435.396	1.978	50	20	IDGD	
O=C(COC(=O)c1ccc(F)cc1C(F)(F)F)NNC(=O)[C@@H]1COc2ccccc2O1	768094696	UPUQKSOYGZBCBW-HNNXBMFYSA-N	442.321	1.989	50	20	IDGD	
CC(=O)N1CCc2c(NC(=O)C(=O)NNC(=O)c3ccccc3Br)cccc21	769256181	OTGQWRRDFPSCAS-UHFFFAOYSA-N	445.273	1.758	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)c3cccc(NS(=O)(=O)c4ccccc4)c3)nc21	770973520	DHWZWQYGMXLYMM-UHFFFAOYSA-N	439.457	1.627	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccc3c(c2)CCO3)no1)c1csc(N2CCOCC2)n1	771227767	NXQXZNVSMLMILD-UHFFFAOYSA-N	441.469	1.644	50	20	IDGD	
C[C@H]1CN(C(=O)OC(C)(C)C)[C@@H](C)CN1C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	771904782	MWYZDEZNBHFBOM-KBPBESRZSA-N	444.496	1.346	50	20	IDGD	
Cc1ccc(C)c(S(=O)(=O)NCCC(=O)O[C@@H](C)C(=O)NNC(=O)CC(C)C)c1	771944392	WEBZRUAWKPXIKU-HNNXBMFYSA-N	427.523	1.097	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)[C@H]1CC(=O)N(c2ccc(F)cc2)C1	772183809	QNJWWLOUDVVOLS-ZDUSSCGKSA-N	432.839	1.296	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N[C@@H](C)CS(=O)(=O)c2ccc(C)cc2)cc1OC	773136645	WBIXEKUUPNUEKL-AWEZNQCLSA-N	435.502	1.819	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)CCN2C(=O)c3ccccc3C2=O)C1	773411831	AOSOSXXLZXTIPW-AWEZNQCLSA-N	444.488	1.467	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)C(=O)Nc2cc(Cl)ccc2OCCS(C)(=O)=O)n1	773477854	COCLYYNYYMVWLW-UHFFFAOYSA-N	441.897	1.252	50	20	IDGD	
CS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNc2cnc3ccccc3n2)cc1Cl	773717781	FBLHLSOIRSINRQ-UHFFFAOYSA-N	434.865	1.737	50	20	IDGD	
Nc1nc(Cl)cc(NNC(=O)CCS(=O)(=O)c2ccc3c(c2)OCCCO3)n1	773862455	VXGZGOPSNULOLX-UHFFFAOYSA-N	427.870	1.181	50	20	IDGD	
CO[C@H]1CCC[C@H]1CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	775459772	PDDVJIJQBJVTJA-WMZOPIPTSA-N	438.550	1.620	50	20	IDGD	
Cc1ccc(S(=O)(=O)C[C@@H](C)NC(=O)NNc2cccc(S(C)(=O)=O)c2)cc1	776196856	VOWBWAWPNCBCKJ-CQSZACIVSA-N	425.532	1.887	50	20	IDGD	
C[C@@H](OC[C@H]1CCCCO1)C(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776201844	MHNLSPCHHDNXHU-HZPDHXFCSA-N	428.530	1.596	50	20	IDGD	
COc1cccc([C@H]2[C@@H](C(=O)NNC(=O)COc3ccc(C#N)cc3)CC(=O)N2C2CC2)c1	776558192	NHWJYUMPBMFBRQ-REWPJTCUSA-N	448.479	1.845	50	20	IDGD	
CCS(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc1	776932206	NPCREVJQWDLZBQ-UHFFFAOYSA-N	443.485	1.516	50	20	IDGD	
NS(=O)(=O)c1ccc(NS(=O)(=O)c2ccc(OCCBr)cc2)cc1	777743309	FKCQOLVIHPOJCL-UHFFFAOYSA-N	435.321	1.909	50	20	IDGD	
C[C@@H](NC(=O)CC1CCCCC1)C(=O)N1CCN(S(=O)(=O)CBr)CC1	777833126	SHIBPUOOZWAAIM-CYBMUJFWSA-N	438.388	1.288	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)[C@H](c2cccc(Cl)c2)N(C)C)cc1OC	780102493	HKCATFBJUHBVMB-IBGZPJMESA-N	449.891	1.964	50	20	IDGD	
CS(=O)(=O)c1ccc(N2CCN(S(=O)(=O)CCCCCl)CC2)c([N+](=O)[O-])c1	780679531	CYCMFZHDCDGFHZ-UHFFFAOYSA-N	439.943	1.469	50	20	IDGD	
CO[C@]1(C(F)(F)F)CCCN(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)C1	780947096	RBZRALVZIMXWQJ-OAHLLOKOSA-N	437.444	1.377	50	20	IDGD	
COC(=O)c1scc(C)c1NC(=O)C(=O)NNC(=O)c1cc(Br)c[nH]1	782121332	UUWYILQKFCNSSB-UHFFFAOYSA-N	429.252	1.333	50	20	IDGD	
CCCCCn1nc(C)cc1NC(=O)C(=O)NNC(=O)c1csc(N2CCOCC2)n1	782896568	KHEVUPQDSMNOSX-UHFFFAOYSA-N	449.537	1.075	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)nn1[C@H](C)C1CC1	783263078	HDWYKEFNQWKSLV-CYBMUJFWSA-N	449.537	1.326	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2cc(C3CCCC3)nn2-c2ccccc2)CCS(=O)(=O)C1	783423971	CDIVFFJYNQYANH-OAQYLSRUSA-N	445.545	1.666	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2ccc(S(C)(=O)=O)nc2)ccc1Br	783921234	OJFVTMUFYMEGDP-UHFFFAOYSA-N	427.280	1.638	50	20	IDGD	
COC(=O)CN1CCN(c2ccc(NC(=O)C(=O)NNc3ccccc3Cl)cc2)CC1	784777206	NRFJPEMNOCLLTK-UHFFFAOYSA-N	445.907	1.717	50	20	IDGD	
CCNC(=O)N(C)NC(=O)C(=O)Nc1cc(OCC)c(OCC)cc1Br	784917296	JWKVIYLTFNOYQM-UHFFFAOYSA-N	431.287	1.878	50	20	IDGD	
CN(C)c1nccc(NNC(=O)C(=O)Nc2ccc(OC(F)F)cc2OC(F)F)n1	784970703	YRQXHNLXYJFCDT-UHFFFAOYSA-N	432.334	1.827	50	20	IDGD	
CCc1nnc(-c2cccc(NC(=O)C(=O)NNC(=O)Cc3cn4ccccc4n3)c2)o1	785067811	PCJDTALQOLRYEB-UHFFFAOYSA-N	433.428	1.275	50	20	IDGD	
CCS(=O)(=O)CCn1cc(C)c(NC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)n1	786734333	YRTXZZTYBPASMM-UHFFFAOYSA-N	445.505	1.278	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)ccc1C(F)(F)F	790952753	URRBWYKHEBEERB-UHFFFAOYSA-N	439.346	1.885	50	20	IDGD	
C[C@@H]1CN(S(=O)(=O)c2ccc(C(=O)NNc3nc4ccccn4n3)cc2)C[C@@H](C)O1	791259885	YTKAAIXHJKJAGW-ZIAGYGMSSA-N	430.490	1.284	50	20	IDGD	
CC(C)Cc1ncc(NC(=O)C(=O)NNC(=O)c2ccc(Br)s2)cn1	792352168	CZEMUWLLPIIQEU-UHFFFAOYSA-N	426.296	1.899	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)c1cc(NC(C)=O)ccc1NS(C)(=O)=O	792814519	WZVLAGFNPMDQOO-UHFFFAOYSA-N	434.474	1.029	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)Cc2ccncc2)n(-c2nc3ccccc3s2)n1	793027123	VJOSGHBYZPIDHA-UHFFFAOYSA-N	435.469	1.514	50	20	IDGD	
Cc1cncc(CCC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)c1	794195389	HBWQKHVBDYMRNY-UHFFFAOYSA-N	430.530	1.958	50	20	IDGD	
COC(=O)c1cccc(NC(=O)C(=O)NNC(=O)Cc2ccc(F)cc2)c1OC(C)C	799259188	UYFSOADCJPNKNC-UHFFFAOYSA-N	431.420	1.728	50	20	IDGD	
CNS(=O)(=O)c1ccccc1S(=O)(=O)NNC(=O)[C@@H](C)Oc1cccc(Cl)c1	799543954	XOPDBWRQYONLDD-LLVKDONJSA-N	447.922	1.025	50	20	IDGD	
C[C@@](O)(CCc1ccccc1)C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	801162905	DQBCTLNOUFVYID-OAQYLSRUSA-N	433.530	1.534	50	20	IDGD	
COc1ccc(C2=NO[C@H](CNC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)C2)cc1F	802343505	VQCDKMACERJVII-AWEZNQCLSA-N	431.380	1.880	50	20	IDGD	
COc1ccc(C2=NO[C@H](CNC(=O)NNC(=O)Cc3nc4ccccc4n3C)C2)cc1	802366124	BYRJCHLHWBKCKX-INIZCTEOSA-N	436.472	1.648	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)NC[C@H]1CC(c2ccc(OC)cc2)=NO1	802369780	MUKMJVQRENMIDL-QGZVFWFLSA-N	442.472	1.996	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)N[C@@H]1CCCN(C(=O)Cc2ccccc2)C1	802473218	PIZYVWUMEZCPGC-MRXNPFEDSA-N	448.483	1.513	50	20	IDGD	
COc1cc(C(=O)NCC(=O)NNc2ccc(-n3ccnc3)nn2)ccc1OC(F)F	804953862	BLHIKRVLSAEORX-UHFFFAOYSA-N	433.375	1.145	50	20	IDGD	
O=C(CC[C@@H]1NC(=O)N(c2ccc(Cl)cc2)C1=O)NNc1ccc(-n2ccnc2)nn1	804955796	XXPKQPVQAXELLN-AWEZNQCLSA-N	440.851	1.664	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)C(=O)Nc1cc(F)c(N2CCCC2)c(F)c1	807429189	OEBLCDJTOSQCPR-UHFFFAOYSA-N	428.403	1.623	50	20	IDGD	
C[C@@H]1CSC[C@@H]1NC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	807475607	IBEJPHFXSXAXCA-KDOFPFPSSA-N	448.570	1.861	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)Nc3ccc4nc(C)nn4c3)n[nH]2)cc1OC	809897423	DZKDSEXJWXZQJE-UHFFFAOYSA-N	436.432	1.912	50	20	IDGD	
Cc1ncc2n1CC[C@H](C(=O)NNC(=O)CN1CCN(Cc3ccccc3Cl)CC1)C2	810594234	YAAJTXSWKKNZSS-KRWDZBQOSA-N	444.967	1.373	50	20	IDGD	
CC1(C)COc2ccc(C(=O)OCC(=O)NNC(=O)[C@@H]3COc4ccccc4O3)cc21	811336149	GZPNBRGODOJORJ-SFHVURJKSA-N	426.425	1.501	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)Nc2ccc(CN3C(=O)CCC3=O)cc2)cc1	812918305	GMAVGIXLQZFLIZ-UHFFFAOYSA-N	445.501	1.735	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@@H]2NC(=O)NNC(=O)Cc1cn2ccccc2n1	813809654	VIBIWJHYHHUBDI-INIZCTEOSA-N	442.520	1.997	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)c1cn2c(Br)cnc2s1	814731062	XLYXSSQRIRFCFQ-UHFFFAOYSA-N	433.247	1.882	50	20	IDGD	
CCOC(=O)c1ccc(C(=O)NNC(=O)c2cc(-c3ccc(OC)c(OC)c3)[nH]n2)nc1	815886853	KWUGQLPGKGMGOY-UHFFFAOYSA-N	439.428	1.740	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)N[C@H](c1ccccc1OC)c1nccn1C	914598898	ZIRCLJOCIMYAJW-HXUWFJFHSA-N	439.472	1.936	50	20	IDGD	
Cc1ccccc1[C@@H](CC(=O)OCC(=O)NNC(=O)c1cccc(Cl)c1)NC(N)=O	914645316	WEUXNSCTDRYVDK-MRXNPFEDSA-N	432.864	1.752	50	20	IDGD	
COc1ccnc(NNC(=O)[C@@H](CCSC)NS(=O)(=O)/C=C\c2ccccc2)n1	914763183	WYWMDMJAJKRLOA-VSKPTYQZSA-N	437.547	1.640	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)c2ccc(COc3ccc(Cl)cc3)cc2)c(O)nc1=O	915056383	CCSSMCQUGAWOMV-UHFFFAOYSA-N	428.832	1.793	50	20	IDGD	
CCOc1cc(C=NNC(=O)[C@@H](C)CN2CCOCC2)ccc1O[C@@H](C)C(=O)N(C)C	916362070	ILNMAVKQCXWYKF-IRXDYDNUSA-N	434.537	1.359	50	20	IDGD	
CN(C)CCN1CCC(NC(=O)NNC(=O)c2ccc(COc3ccccc3)o2)CC1	916382609	LFHNDYQMZMDJOS-UHFFFAOYSA-N	429.521	1.829	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCC(C)(C)c2ccccc2)cc1	916516367	TZHJLEPPXKHELY-UHFFFAOYSA-N	432.546	1.924	50	20	IDGD	
CCn1c(=O)c2ccccc2n(CC(=O)NNC(=O)c2cc(-c3ccc(C)cc3)[nH]n2)c1=O	917178355	UIYJUNGQROZEPU-UHFFFAOYSA-N	446.467	1.343	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCC[C@@H](C(=O)Nc2ccccn2)C1	917400617	XHEFKFUFTRFMOZ-CQSZACIVSA-N	445.907	1.855	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)[C@H](C)NS(=O)(=O)c2cccs2)cc1	917918001	ISXYZZASWQJYMO-STQMWFEESA-N	441.531	1.429	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)NCCC(=O)N2CCN(C)CC2)c(C)n1C[C@@H]1CCCO1	918695927	GRMUWBPGNAYKLF-URBQWANRSA-N	427.549	1.471	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)c1cccc(S(=O)(=O)NC[C@H]2CCCO2)c1	919820319	SMEYOMRSSCHPCD-QGZVFWFLSA-N	447.513	1.156	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C2CCN(S(=O)(=O)c3cccnc3)CC2)cc1	919836222	FNMSSEUXGNNGAY-UHFFFAOYSA-N	446.529	1.271	50	20	IDGD	
O=C(NNC(=O)C1(c2ccc(Br)cc2)CCCC1)N[C@@H]1CCS(=O)(=O)C1	919889434	LZNIHUWYTWRPDQ-CQSZACIVSA-N	444.351	1.778	50	20	IDGD	
CNS(=O)(=O)c1ccc(CNC(=O)NNC(=O)CCc2ccc(OC)cc2)s1	919898539	BBSKNGHGOSUVLH-UHFFFAOYSA-N	426.520	1.128	50	20	IDGD	
Cc1cnc(O)n1-c1ccc(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1	919972438	NSTIVYQBAYGBRE-UHFFFAOYSA-N	449.876	1.262	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)C2(NC(=O)NCC)CCCC2)c2ccccc2c1=O	919972878	WANPNFDVZCGJQX-UHFFFAOYSA-N	428.493	1.199	50	20	IDGD	
Cc1cc(C)c(S(=O)(=O)NNC(=O)NCc2ccco2)c(C)c1NS(C)(=O)=O	920832454	QYRAUZAGMSSAQG-UHFFFAOYSA-N	430.508	1.269	50	20	IDGD	
CC(C)[C@@H](C(=O)NNC(=O)c1nnc(O)c2ccccc12)N1C(=O)c2ccccc2C1=O	934946866	COACEJSWGGRYLA-KRWDZBQOSA-N	433.424	1.417	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2ccccc2CN2CCCC2=O)c1	1115854876	QMMZAGVYIUAGNJ-UHFFFAOYSA-N	444.513	1.357	50	20	IDGD	
CC[C@@H](N=c1nn[nH]n1-c1ccccc1)C(=O)NNC(=O)CSc1ccc(C)cc1	1251649288	IXYSGVIIGHTNQZ-QGZVFWFLSA-N	425.518	1.523	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)c2n[nH]c3c2CCCC3)c(Br)c1	1321540778	XOKIISBRYZDDCW-UHFFFAOYSA-N	429.296	1.683	50	20	IDGD	
Cn1cc(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)c(C(F)(F)F)c1	1337931260	BQKXKDNBQDFYLD-UHFFFAOYSA-N	432.424	1.822	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)Cc2cnc[nH]2)C1	1777996000	NIUVHRZGMCWNBH-IIDMSEBBSA-N	427.343	1.640	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4ncnn4c3)C2)C1	1778735510	ARMHMTCZBLOSOD-SCLBCKFNSA-N	436.310	1.204	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)/C=C/C3CCCCC3)CCO2)C1	1779037141	PSDMWDWMWAHEFI-YQTDCCHMSA-N	441.532	1.265	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2)c1n[nH]c2ccc(F)cc12	1779085437	PWQVGPJYXHMECD-JXXFODFXSA-N	438.887	1.429	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)COc3ccc(O)cc3)CCO2)C1	1781225309	IDQPIVXKLPMTGU-OALUTQOASA-N	431.316	1.837	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccccc3C(N)=O)C2)C1	1781754862	ATQDHFOUTRRZPP-ORAYPTAESA-N	438.322	1.260	50	20	IDGD	
Cc1cc(C)n(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](C)Br)C2)n1	1781996447	JUPSOGQKNXMIKB-GPMSIDNRSA-N	441.370	1.797	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)Nc1nccs1)C2	1782172840	NKNFHRHAXZPKFZ-XTDOFWJNSA-N	444.985	1.711	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnc3[nH]ncc3c1)C2	1782175174	FQGRXMWNGKMWQW-RZQQEMMASA-N	435.912	1.339	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cn4c(F)cccc4n3)C2)C1	1782373935	ZYYPZEKDEISVBV-KZULUSFZSA-N	439.285	1.700	50	20	IDGD	
O=C(CCc1c[nH]c2ncccc12)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2	1783208363	UMIBJZPMYSANFJ-JBYIUTFZSA-N	448.951	1.609	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ncc(F)cc3F)CCO2)C1	1783342503	JGYILXGBEQNBHV-SJCJKPOMSA-N	432.265	1.977	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCOc3ccc(C)cc3)[C@H]2C1	1783764944	KEUPNCRPUDVGTH-LEAZDLGRSA-N	438.952	1.997	50	20	IDGD	
C[C@H](Cc1ccc(F)cc1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]2C1	1784094804	SHYAMDMJHLKGJK-VXKGYBDPSA-N	426.916	1.584	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(OC)nc3)[C@H]2C1	1784764744	LLQHYWPNIJOFQR-JONQDZQNSA-N	440.338	1.857	50	20	IDGD	
Cc1cnc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)CBr)C[C@@H]32)cn1	1785985026	BEFAHJVDNHEIKM-DSRCVFDASA-N	425.327	1.409	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4n[nH]cc4c3)[C@H]2C1	1787301766	DDZOJHGYGYENOZ-ONQXIZJVSA-N	435.322	1.940	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)c1cccc2c1OCC2	1787814588	XAPOHTXPQITGAX-XIRDDKMYSA-N	437.334	2.000	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3c(Br)cnn3C)C[C@@H]21	1789859504	GDPBCSNFDDNELO-VTPLQMEGSA-N	447.761	1.793	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4c(n3)NC(=O)CC4)C[C@@H]21	1789859893	DYBIFFXVGPPSGK-JKQORVJESA-N	434.924	1.577	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](N)Cc3cscn3)C[C@@H]21	1789865894	INKLIXCFCMPZQT-GKHXFJEZSA-N	449.404	1.229	50	20	IDGD	
CCc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]3C2)n(C)n1	1791058773	FIIVDAWAGVJUNG-DSPQJCBJSA-N	427.343	1.359	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC1(c2ccc(NC(=O)[C@@H]3CCNC(=O)C3)cc2)CCC1	1791660707	MPYKHGJNYYHNJW-OAHLLOKOSA-N	429.521	1.020	50	20	IDGD	
Cn1cccc1C(=O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]21	1791694598	LOTAXTSAPKCEFB-VODUFIJXSA-N	430.332	1.424	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3ccc(O)cn3)[C@H]2C1	1791711544	LSGVWRJFXCUDCI-APYUEPQZSA-N	426.311	1.093	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1cc2ccccc2n1C	1792925535	PSPDABOBDHYOAW-REPLKXPHSA-N	439.560	1.732	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CC[C@H](C(=O)OC)C1	1792970393	BRMUKQHTBMAXHS-YUDUXTHKSA-N	445.354	1.339	50	20	IDGD	
CCCc1onc(C)c1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1	1796189310	WOAYGPGONHYGBF-BCDXTJNWSA-N	425.294	1.181	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1ccc2c(c1)OCO2	1796786906	MQOUNUKTTDOCNC-BAESOJJISA-N	429.242	1.309	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccncc1Cl)C2	1798439791	FXRVGAPXVMHMFW-CLLJXQQHSA-N	428.880	1.299	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(SC)c1O	1798564345	KWLSKLFQGJTXML-FAXLKDOZSA-N	428.938	1.571	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2ncsc2[nH]1	1798655440	VUFHTSFENBODHJ-ZSBIGDGJSA-N	439.501	1.189	50	20	IDGD	
O=C1Cc2cc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@H](F)Br)ccc2N1	1799348739	AAWZJOWQKNJZHB-VZAMPYOESA-N	440.269	1.075	50	20	IDGD	
C[C@H](NC(=O)c1ccccn1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(C)(C)CCl)C2	1800199722	FPGWCYJYTAOYHV-MPTYRVRUSA-N	436.940	1.055	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(C(=O)OC)cc1C)C2	1800983277	VKYIVIZWRAQSIE-MVJTYMMSSA-N	438.908	1.239	50	20	IDGD	
CCOC(=O)N1CCC(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C(Cl)Cl)CC1	1801021127	JKLDWIXPETTZEU-BTTYYORXSA-N	436.336	1.248	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1nc2ccc(F)cn2n1)[C@@H](F)Br	1801190234	IKXNZYPMASOYPV-LSCVPOLPSA-N	428.237	1.811	50	20	IDGD	
CC[C@@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](C)N1CCN(C)CC1)C2	1801804165	UFNVGJAGZRXTPO-NQNKBUKLSA-N	429.403	1.434	50	20	IDGD	
COc1cccnc1CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCC(=O)NN(C)C	1802333656	ZJYYITHGIOJRPW-BJWYYQGGSA-N	431.537	1.034	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)[C@@H]1CC=CCC1	1803026620	QQGKMBCSCAFFKT-ZNLUXHQJSA-N	433.317	1.437	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)C[C@@H]2NC(=O)NC2=O)[C@H]1c1cccnc1	1803686585	QKIZQMKYTHXWPW-JKQORVJESA-N	435.912	1.093	50	20	IDGD	
CC(=O)N(C)CCC(=O)NC[C@@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1	1804068150	SLDVUMYEQFYKEJ-LPHOPBHVSA-N	439.354	1.741	50	20	IDGD	
CC(=O)N(C)CCC(=O)NC[C@@H]1CCN(C(=O)[C@H](C)Br)[C@H]1c1cccnc1	1804071609	GIWCVPHVCPFTCV-OWQGQXMQSA-N	439.354	1.739	50	20	IDGD	
CC(C)(C)OC(=O)N1CCO[C@@H](C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](F)Cl)C3)C1	1804608606	JWHKUDCLUVSIHF-KHMAMNHCSA-N	433.908	1.795	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC2(CCCN(C(=O)[C@@H]3CCC(=O)NC3)C2)CC1	1804981864	KHLDRVZDLKMSNE-HUUCEWRRSA-N	428.371	1.917	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)c2cccnc2)[C@@H]1c1cccnc1	1805465956	YTGBTEALMMHPPJ-UZLBHIALSA-N	445.483	1.109	50	20	IDGD	
Cc1cccc(C(=O)NC[C@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)n1	1805521212	UKQIFTBBEGTPKP-GCJKJVERSA-N	438.532	1.478	50	20	IDGD	
Cn1c(=O)n(C)c2cc(C(=O)N3CCC4(CCCN(C(=O)[C@H](O)CCl)C4)CC3)ccc21	1805524565	TWGVFJZAUBHPOS-GOSISDBHSA-N	448.951	1.322	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H](CNC(=O)CCSC(=N)N)[C@@H]1c1cccnc1	1807127626	PGNUOMPQJJKZEW-QAPCUYQASA-N	437.642	1.956	50	20	IDGD	
Cc1ccc(CC(=O)N2CCCC3(CCN(C(=O)c4cccc(B(O)O)c4)CC3)C2)cn1	1807195251	ANYGTNUITCXNOU-UHFFFAOYSA-N	435.333	1.157	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H](CNC(=O)Cn2ccnn2)[C@H]1c1cccnc1	1807694254	YWXGQOYGRTWHEB-HLLBOEOZSA-N	435.326	1.553	50	20	IDGD	
CO[C@H](C)C(=O)N1CC[C@H](CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@@H]1c1cccnc1	1808416138	FHLNZNOLLGQKFV-YNZGHISLSA-N	440.504	1.256	50	20	IDGD	
CCn1ccc(C(=O)N2CCCC3(CCN(C(=O)c4cnccc4C(=O)NN)CC3)C2)n1	1808633960	FFOLATKNDMJOFF-UHFFFAOYSA-N	439.520	1.060	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)c1cc2cccn2cn1	1809446929	RBYRMEGHAARDII-KFKAGJAMSA-N	427.892	1.649	50	20	IDGD	
O=C(CC1CCOCC1)N1CCCC2(CCN(C(=O)c3ccc(B(O)O)cc3)CC2)C1	1809566447	LGSNZDAWIZEJEI-UHFFFAOYSA-N	428.338	1.028	50	20	IDGD	
N#CC1(C(=O)N2CC[C@H](CNC(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)CCC1	1810309409	QWPFHTGNFBVQTN-APWZRJJASA-N	447.499	1.094	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2cccc(F)c2)[C@@H]1c1cccnc1	1811807680	SGQNOTPWIOOPDR-GCJKJVERSA-N	441.507	1.913	50	20	IDGD	
CC(=O)NCCC(=O)NC[C@@H]1CCN(C(=O)[C@H](C)CBr)[C@H]1c1cccnc1	1812654543	KTONAXNZOBFDFG-SKDZVZGDSA-N	439.354	1.645	50	20	IDGD	
CC(=O)NCCC(=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@@H]1c1cccnc1	1812662615	ZXTFOMCWEMQFQF-NUEKZKHPSA-N	429.290	1.304	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)/C=N/O[C@H]2CCCCO2)[nH]n1)[C@@H](O)CCl	1814872726	KAVKKAWMROTBOP-YLMMLPIESA-N	427.889	1.531	50	20	IDGD	
Cc1ncsc1C(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1	1815339614	JZZZLDCTZGXRAK-ZDUSSCGKSA-N	442.331	1.127	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CNC(=O)c2ccco2)n[nH]1	1817606665	LFHJLYSIABCOBK-TZMCWYRMSA-N	437.884	1.679	50	20	IDGD	
C[C@@H]1CCC[C@@H]1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2	1818876488	MAMABNWNXHBPEY-WQVCFCJDSA-N	427.335	1.485	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)CN3CCN(C(C)=O)CC3)sc2C1	1818896877	KYAWXRKVLRCKAC-KGLIPLIRSA-N	441.985	1.237	50	20	IDGD	
CCOC(=O)N[C@H](O)C(=O)Nc1cc([C@H]2CCCCN2C(=O)C(C)(C)CCl)[nH]n1	1819238011	OXUIRWWFBAFVAE-IUODEOHRSA-N	429.905	1.731	50	20	IDGD	
C[Si](C)(C)OCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCc2nc(N)n[nH]2)[nH]n1	1819595283	FXLUOUMUCOJYCA-ZDUSSCGKSA-N	434.577	1.586	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2)c1cccc(F)c1	1822042308	JCEQWYIPQZXXEV-INIZCTEOSA-N	439.277	1.502	50	20	IDGD	
CC(=O)C[C@H](C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1822335449	JKFSMCPCXRTOOM-SCLBCKFNSA-N	426.282	1.011	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)CC[C@@H]2CCOC2)n[nH]1	1823035386	PXSYLWBPJYQTNH-NVXWUHKLSA-N	434.541	1.592	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)C1CCSCC1	1823544888	NDJIIKVZSBKTAR-SFHVURJKSA-N	442.350	1.539	50	20	IDGD	
CC1(C)CC(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2cccc(B(O)O)c2)CC3)C1	1826201256	PRNSBFDBNLTZPB-OAHLLOKOSA-N	427.335	1.485	50	20	IDGD	
CCn1ccc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)n1	1827056000	NHOILABKBFYEHJ-NRFANRHFSA-N	438.337	1.130	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)[C@@]3(C)CC3(F)F)sc2C1	1828054695	JGFAMHLILRGKOQ-BMLIUANNSA-N	429.493	1.473	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC([C@H]2CCCCN2C(=O)C2=NNC(=O)C2)CC1	1828858428	GLESMMOXQBWFTR-IUODEOHRSA-N	427.343	1.513	50	20	IDGD	
C=C[C@H](O)C(C)(C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1	1828882958	TTYWFHHAUXATKS-SFTDATJTSA-N	442.365	1.173	50	20	IDGD	
Cc1cc(Cl)ccc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1	1830117107	XCMOQTHGLRFQIB-QFBILLFUSA-N	431.316	1.318	50	20	IDGD	
O=C(C#Cc1ccc(Cl)cc1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1830468746	SPSBKVAROSNIBR-HKUYNNGSSA-N	429.275	1.682	50	20	IDGD	
O=C([C@H](O)CCl)N1CCO[C@@]2(COCCN(C(=O)C3(c4ccccc4)CCC3)C2)C1	1830738500	PGDTWTOVNWGXJC-NQIIRXRSSA-N	436.936	1.164	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)C2=NNC(=O)C2)CC1	1831552609	DTJMIYOQPAITLZ-UKRRQHHQSA-N	427.343	1.656	50	20	IDGD	
CC(C)=NO[C@@H](C)C(=O)N1CCC([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1	1831874903	XRCFBGXQOYFXGH-PKOBYXMFSA-N	437.585	1.780	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3cccnc3C)CCO2)C1	1832640218	NWPFBWZIPADBGZ-RXVVDRJESA-N	439.940	1.033	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3c(C)noc3C)CCO2)C1	1833065427	CCXFMFJQTHWNJN-XLIONFOSSA-N	427.929	1.698	50	20	IDGD	
CC(C)(CCl)C(=O)NC1CCN(C2CCN(C(=O)c3cc(O)nc(O)n3)CC2)CC1	1833215486	VCYGFRARYXOTOX-UHFFFAOYSA-N	439.944	1.338	50	20	IDGD	
C[C@@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)CCN(C)C)CC2)CC1	1833262309	NGLPULUUEMABAO-HNNXBMFYSA-N	431.419	1.541	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)s1	1833425750	NLIOJYHREYGFQA-PXAZEXFGSA-N	447.351	1.610	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3scnc3C3CC3)CCO2)C1	1833732259	RHKOVHXZAUGQBV-KUHUBIRLSA-N	443.953	1.344	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)C(Cl)Cl)CC2)CC1)c1cnc(OCF)cn1	1833990303	JVAUDIDLYFQWBW-UHFFFAOYSA-N	448.326	1.771	50	20	IDGD	
N#Cc1c[nH]c(C(=O)N2CCC(N3CCC(NC(=O)CCBr)CC3)CC2)c1	1834423254	MMMMOCJLJQQRPO-UHFFFAOYSA-N	436.354	1.857	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc4c(s3)CCC4)CCO2)C1	1834547568	BXDVQJGFRFGEEZ-YWZLYKJASA-N	442.965	1.561	50	20	IDGD	
Cc1onc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCBr)CCO3)C2)c1C	1834819471	ONGCDTGLCKCXKH-QGZVFWFLSA-N	430.299	1.146	50	20	IDGD	
O=C(/C=C/c1cccnc1)N1CCOC[C@]2(C1)CN(C(=O)CCBr)CCO2	1834819626	WVIASYYJMKNAAV-RTLBZRNLSA-N	438.322	1.336	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)COc3ccccc3)CCO2)C1	1834953956	HMLYZXAYLJUVEM-PMACEKPBSA-N	445.343	1.758	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)[C@@H]3CCCS3(=O)=O)CC2)CC1	1836397166	AUBMDZDXXHMKKO-SJORKVTESA-N	434.002	1.153	50	20	IDGD	
O=C(c1ccc[n+]([O-])c1)N1CCC(OC2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1837241980	KOPGJDUQIHKKOE-MRXNPFEDSA-N	444.301	1.623	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccnc3Cl)C2)C1	1837708862	QOLNBDIVWJTUPJ-IBGZPJMESA-N	441.988	1.657	50	20	IDGD	
Cn1nc(C(F)(F)F)cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1838078434	NSXHEBJBCWWLCV-WFASDCNBSA-N	442.797	1.043	50	20	IDGD	
CCOc1ccccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](Cl)COC)C2)C1	1838886501	ZXDBQRNJOJPDJP-UWJYYQICSA-N	440.924	1.409	50	20	IDGD	
Cc1nc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)cs1	1839151055	HCHOJUMBGHIKKG-SJORKVTESA-N	436.361	1.758	50	20	IDGD	
O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)c1cc(O)ccc1F)CCO2	1839294564	WFSUWKYQJZFHOF-SFHVURJKSA-N	445.285	1.386	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)C#Cc3ccccc3)C2)C1	1839963408	JJWLIFWBNJVCJA-NQIIRXRSSA-N	449.345	1.668	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3CC3(F)F)C2)C1	1839965474	ZKWKWNZMJQAOMP-SLEUVZQESA-N	425.270	1.272	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3C[C@H]4CC[C@@H]3O4)C2)C1	1839966712	NVMYMEQBFNCHPP-RMWBKXBUSA-N	445.354	1.184	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@H](CCN)NC(=O)OC(C)(C)C)C1	1842910958	FRLPNZXYMRKJQD-HUUCEWRRSA-N	430.977	1.839	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC2(CCCN2C(=O)c2nc3ccccc3n(C)c2=O)C1	1843744270	JEOVOQDENKCWTK-ZDUSSCGKSA-N	447.333	1.924	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@]1(O)CCN(C(=O)OC(C)(C)C)C1)C2	1845167807	VSVGIOWUCQDSNK-VLIAUNLRSA-N	429.945	1.579	50	20	IDGD	
COC[C@@H](NC(C)=O)C(=O)N1CC2(CCCN2C(=O)/C(C#N)=C/c2ccc(F)cc2F)C1	1845871216	BPRMWDCATDIBBD-DDBXPCSUSA-N	446.454	1.226	50	20	IDGD	
O=C(c1cc2cc(Br)ccn2n1)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl	1847563603	MQWWKXUOWHAMBQ-SOUVJXGZSA-N	441.713	1.512	50	20	IDGD	
Cc1ccc(C)c(S(=O)(=O)NCCC(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)c1	21967874	GWLWINWQMCDKBK-OAHLLOKOSA-N	437.493	1.726	50	20	IDGD	
C[C@@H]1CCCC[C@]12NC(=O)N(CC(=O)NNC(=O)c1cc(Br)c[nH]1)C2=O	28717699	GUTDNAXJHOUTKA-ABKXIKBNSA-N	426.271	1.039	50	20	IDGD	
O=C(NNC(=O)c1cnn2c(-c3ccccc3)ccnc12)c1n[nH]c(=O)c2ccccc12	107908823	CVDGKMRGFHYOER-UHFFFAOYSA-N	425.408	1.708	50	20	IDGD	
CCOC(=O)C[C@H](NC(=O)NNC(=O)CNC(=O)c1cccs1)c1ccc(F)cc1	725873094	KEQWDWJOPAFGDJ-AWEZNQCLSA-N	436.465	1.642	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NCC(=O)Nc1cccc2ccccc12	725873169	LFTGZHMTVWUWNQ-UHFFFAOYSA-N	425.470	1.600	50	20	IDGD	
Cc1cc(=O)c(C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)nn1-c1ccccc1	726867403	JQEUPPNSADNRQC-UHFFFAOYSA-N	439.497	1.739	50	20	IDGD	
O=C(CCNS(=O)(=O)c1cccc([N+](=O)[O-])c1)NNC(=O)CCC1CCCCC1	727414365	LLAFMJOXWNLUHM-UHFFFAOYSA-N	426.495	1.771	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCCC(=O)NNc2nc(-c3cccnc3)no2)cc1	728079007	GHCONRVQOHSIEI-UHFFFAOYSA-N	432.462	1.342	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)c1cc(N2CCCC2=O)cc(C(F)(F)F)c1	728234739	SKAHJMSZUHDUJC-JTQLQIEISA-N	433.408	1.028	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)c1occc1CN1C(=O)Cc2ccccc21	728511391	LZLWBXOIHUUMAN-LJQANCHMSA-N	433.420	1.970	50	20	IDGD	
CN(C)CCCOc1ccc(CNC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1	728594779	ZDCUJTDEPAXZKD-UHFFFAOYSA-N	438.492	1.137	50	20	IDGD	
O=C(NNC(=O)N1CCN(Cc2cccs2)CC1)C1CCN(c2ncccn2)CC1	728958210	WYRHSDGEMBUTQB-UHFFFAOYSA-N	429.550	1.313	50	20	IDGD	
O=C(NNC(=O)N1CCN(Cc2ccsc2)CC1)C1CCN(c2ncccn2)CC1	728959320	LDMLQJBKVJFNAO-UHFFFAOYSA-N	429.550	1.313	50	20	IDGD	
NC(=O)C1CCN(c2ncccc2CNC(=O)NNC(=O)Cc2ccc(Cl)cc2)CC1	729229653	BMWGJVXUTCBOIE-UHFFFAOYSA-N	444.923	1.510	50	20	IDGD	
O=C(NNC(=O)c1cccc(Br)c1O)c1csc(N2CCOCC2)n1	730104825	ZZAABWZHTYEUSI-UHFFFAOYSA-N	427.280	1.523	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H](CCNC(=O)NNC(=O)COc2ccccc2C#N)C1	730139069	KMPWHRKTXRRURE-OAHLLOKOSA-N	431.493	1.915	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)NNC(=O)[C@@H]1CCN(c2ccc3c(c2)OCCO3)C1=O	730515143	PUBCKROQPYRTQJ-KRWDZBQOSA-N	434.452	1.682	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)[C@@H]1CCCN(S(=O)(=O)Cc2ccccc2)C1	730782493	PLDXMVHLXNRZHN-QGZVFWFLSA-N	447.513	1.160	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3cc(F)cc([N+](=O)[O-])c3)cc2)CC1	731809856	SSNCQPPKPLOZHF-UHFFFAOYSA-N	437.453	1.427	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)CCNC(=O)c2ccc3ccccc3c2)C[C@H](C)O1	732261205	LKPINKBYCHTMMJ-IRXDYDNUSA-N	426.517	1.606	50	20	IDGD	
CC(C)Oc1ccc(NS(=O)(=O)CC(=O)NNc2nc3ccccc3c(=O)n2C)cc1	733261406	PTWPGQKNTLBHIY-UHFFFAOYSA-N	445.501	1.606	50	20	IDGD	
Cn1cc(C(=O)NNS(=O)(=O)c2csc(-c3ccc(Br)cc3)n2)cn1	735461998	KMPKXBNORVEEKK-UHFFFAOYSA-N	442.320	1.929	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)c1ccc(S(=O)(=O)N(C)c2ccccc2)cc1	740851044	MWNJBJCRNIBNTB-UHFFFAOYSA-N	446.529	1.578	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN(C(=O)COc2ccccc2)C1)c1cccc([N+](=O)[O-])c1	741169464	RIWOBKDYTFNCRJ-MRXNPFEDSA-N	426.429	1.673	50	20	IDGD	
O=C(CN1C(=O)[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)NNC(=O)NCc1cccc(C(F)(F)F)c1	742458114	UGRJAZVCMGYXGC-GVAFMPQTSA-N	436.390	1.343	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)Cc2csc(NC(=O)C(C)(C)C)n2)c2ccccc2c1=O	742474858	YTQJZITZAXWEBP-UHFFFAOYSA-N	442.501	1.378	50	20	IDGD	
Cc1ccc(S(=O)(=O)NNC(=O)CNC(=O)c2cccs2)cc1Br	743255605	KGKIGQKLVWGJMY-UHFFFAOYSA-N	432.321	1.559	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2cn(-c3ccc(Cl)cc3)nn2)cc1	743830196	PWLYRXLOTISKNL-UHFFFAOYSA-N	434.865	1.791	50	20	IDGD	
CCc1ccccc1N1C[C@@H](C(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)CC1=O	743830452	FMQUANPSJQGKRO-HNNXBMFYSA-N	444.513	1.858	50	20	IDGD	
O=C(CCNS(=O)(=O)c1cccs1)NNC(=O)Nc1ccc(OC(F)F)cc1	743832493	MQJAJHDPQCOFNJ-UHFFFAOYSA-N	434.446	1.871	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccc(F)cc3Cl)CC2)cc1	744395401	SNPGUSDYENFLQP-UHFFFAOYSA-N	443.866	1.570	50	20	IDGD	
Cc1c(/C=C(\C#N)C(=O)O[C@@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)cc(C#N)n1C	744632667	MTJLSZSAOWBBCJ-LIOBOASVSA-N	441.469	1.330	50	20	IDGD	
Cc1cc(N2CC[C@@H](NC(=O)NNC(=O)[C@@H](C)Oc3cccc(C)c3C)C2=O)n(C)n1	745906871	VYBWNPGHTHAGHF-HZPDHXFCSA-N	428.493	1.249	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)[C@H]1COc2ccccc2O1)n1nnc(-c2ccc(Cl)cc2)n1	746080720	ZNUCAWSTEIOTDV-RHSMWYFYSA-N	442.863	1.932	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2cc3c(N(C)C)ncnc3n2C)c2ccccc2c1=O	747199879	ZTAHOCZPNDETKQ-UHFFFAOYSA-N	448.487	1.229	50	20	IDGD	
O=C(CCCNS(=O)(=O)c1ccc2c(c1)OCCO2)NNc1ccc([N+](=O)[O-])cc1	747986602	ULVYABXRDXBXSP-UHFFFAOYSA-N	436.446	1.568	50	20	IDGD	
CSCC[C@H](NC(=O)c1ccc([N+](=O)[O-])o1)C(=O)NNC(=O)[C@@H]1Cc2ccccc2O1	748273314	DVPZJJRNROWNKW-WFASDCNBSA-N	448.457	1.190	50	20	IDGD	
CS(=O)(=O)N1CCCC[C@H]1C(=O)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1	748522044	KRJIJAWPPIZYEZ-LBPRGKRZSA-N	429.442	1.237	50	20	IDGD	
C[C@@H](c1ccncc1)N1CCC(NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)CC1	749237492	SDCCEABGCPKXMM-HNNXBMFYSA-N	449.515	1.498	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)C1CCCC1	749334517	HWPKLAWQYZIGTD-MRXNPFEDSA-N	437.562	1.614	50	20	IDGD	
CN(C)N(C(=O)c1cc(O)nc2c(Br)cccc12)[C@H]1CCS(=O)(=O)C1	750165911	DRDYRUFNTZGCOH-JTQLQIEISA-N	428.308	1.809	50	20	IDGD	
CCS(=O)(=O)N1CCC(C(=O)NNC(=O)c2ccccc2F)(c2ccccc2)CC1	750553873	HHFLEQGWKDVEIK-UHFFFAOYSA-N	433.505	1.970	50	20	IDGD	
C[C@H](CC(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1)c1ccc(F)cc1F	751859334	OZXXFRMSUYVQFV-KZULUSFZSA-N	434.395	1.989	50	20	IDGD	
COc1cc(C(=O)NCC(=O)NNc2ccc(C(F)(F)F)nn2)ccc1OC(F)F	755294374	SMGGERNLDPTJSL-UHFFFAOYSA-N	435.309	1.979	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2cnns2)c1	755348850	JZJFWXOYHQCQMN-UHFFFAOYSA-N	448.486	1.814	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)Nc2nc(CN3CCOCC3)cs2)o1	755456720	ZIFHWKRNFGBNOR-UHFFFAOYSA-N	436.538	1.877	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2ccc(NS(C)(=O)=O)cc2)c2ccccc2c1=O	756709529	YQUZWHNYWUYOGH-UHFFFAOYSA-N	444.473	1.254	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)Nc1ccc(S(=O)(=O)NCc2ccccc2)cc1	756863608	IJGVTSARJQZHFQ-UHFFFAOYSA-N	439.497	1.956	50	20	IDGD	
CCOC(=O)c1c(NC(=O)NNC(=O)COC)sc2c1CCN(C(=O)OCC)C2	757986612	QKOSFDQQXAIYPQ-UHFFFAOYSA-N	428.467	1.239	50	20	IDGD	
CC[C@H]1CN(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)CCN1Cc1ccccc1	759211073	FPEJZHLFDFTLJQ-IBGZPJMESA-N	434.504	1.613	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3ccc(F)c(F)c3F)cc2)CC1	760123489	ZBFPWIHEVVKRAY-UHFFFAOYSA-N	428.436	1.797	50	20	IDGD	
O=C(NN=Cc1cccc(-n2cccn2)c1)C(=O)NN=Cc1cccc(-n2cccn2)c1	760220013	XERSCFFJIJAWBF-UHFFFAOYSA-N	426.440	1.658	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)[C@H]3CCNC(=O)C3)c2)c(C)c1	760224471	OAINKTQRZKSNRO-INIZCTEOSA-N	444.513	1.391	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)C(=O)Nc1cccc(OC[C@H]2CCCO2)c1	763549256	VSZVBKQBKUGORL-MRXNPFEDSA-N	427.413	1.373	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)Nc1cccc(C(=O)c2ccccc2)c1	763569779	BOTNBGYERJXVCD-HXUWFJFHSA-N	445.431	1.844	50	20	IDGD	
O=C(NNC(=O)c1ccccc1F)C(=O)Nc1ccc(CC(=O)N2CCSCC2)cc1	763574405	AOHLYZZRWFSZSB-UHFFFAOYSA-N	444.488	1.343	50	20	IDGD	
Cc1cccc(Cn2nccc2NC(=O)C(=O)NNC(=O)c2c(C)nc3ccccn23)c1	763630150	VRBLNOMJVJQRNF-UHFFFAOYSA-N	431.456	1.596	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)C(=O)Nc1cccc(F)c1F	763695392	SXVAMLHIHKRRJB-UHFFFAOYSA-N	428.189	1.892	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccnc(OCC(F)(F)F)c2)cc1	763821465	QYWCQSRFKXREIX-UHFFFAOYSA-N	426.351	1.496	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C)c(S(=O)(=O)N(C)C)c2)cc1	763832471	SWSZDDLKFOKNPW-UHFFFAOYSA-N	432.502	1.207	50	20	IDGD	
CCOC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)Cc2c[nH]c3ccccc23)cc1C#N	763860681	LVVFYLMVUCMTDR-UHFFFAOYSA-N	448.439	1.937	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cccc3c2oc(=O)n3C)cc1	763861381	OXHLFQDFGMKUMR-LBPRGKRZSA-N	442.428	1.084	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)NNC(=O)C(=O)Nc1ccc(-n2cncn2)c(Cl)c1	763865039	HQPPQMHYSSZSOK-UHFFFAOYSA-N	437.847	1.731	50	20	IDGD	
Cc1nnc(-c2cccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc3ccccc3F)c2)n1C	763866356	VQDAQMQIUYVEBK-GFCCVEGCSA-N	440.435	1.483	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)N(C)C)cc2)cc1OC	763912319	WQAALHBPQDUVIM-UHFFFAOYSA-N	442.472	1.586	50	20	IDGD	
CN(C)C(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2ccc(Br)s2)c1	763942091	TYQHOPZTGMMNLJ-UHFFFAOYSA-N	439.291	1.612	50	20	IDGD	
CN(C)C(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2cccc(Br)c2)c1	764062972	IDIJKXRRTQAPEE-UHFFFAOYSA-N	433.262	1.551	50	20	IDGD	
CCCOC(=O)c1cc(Br)ccc1NC(=O)C(=O)NNC(=O)CC1CC1	764142537	QOEYZIABXMVDTF-UHFFFAOYSA-N	426.267	1.902	50	20	IDGD	
COC(=O)c1cc(OC)c(OC)cc1NC(=O)C(=O)NNC(=O)CCC1CCCCC1	764215467	TZAUSIBCNZDLRC-UHFFFAOYSA-N	435.477	1.937	50	20	IDGD	
Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)C(=O)NNC(=O)Cc1cccnc1	764266476	KANMQEGVUBQJKI-UHFFFAOYSA-N	430.424	1.778	50	20	IDGD	
O=C(CCCc1cccs1)NNC(=O)C(=O)Nc1ccn(CCc2ccncc2)n1	764340818	IBXXDTNXNYTRGL-UHFFFAOYSA-N	426.502	1.691	50	20	IDGD	
COC(=O)[C@H](C)Cc1ccc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1	764350403	FGLAPJDIIHMEND-OAHLLOKOSA-N	449.467	1.624	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)C(=O)Nc2ccc(Cl)cc2I)cn1	764358949	KZVKSGOEVCLBPX-UHFFFAOYSA-N	447.620	1.078	50	20	IDGD	
CCN(CC)C(=O)c1ccccc1NC(=O)C(=O)NNC(=O)COCc1ccccc1	764362270	CWKDCGPJNVXFOI-UHFFFAOYSA-N	426.473	1.471	50	20	IDGD	
CCOC(=O)c1ccsc1NC(=O)C(=O)NNC(=O)c1cc(-c2cccs2)[nH]n1	764376725	GGUNGZSJBJDWCI-UHFFFAOYSA-N	433.471	1.776	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2cccs2)[nH]n1)C(=O)Nc1ncn(C2CCCCC2)n1	764383025	URHCVEMAZDIJOQ-UHFFFAOYSA-N	428.478	1.635	50	20	IDGD	
CCCN1Cc2cccc(NC(=O)C(=O)NNC(=O)CSc3ccccc3O)c2C1	764401821	SBOAXYWWNBYQIF-UHFFFAOYSA-N	428.514	1.996	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)c1cc(Br)c(C)n(C)c1=O	764750031	UUIAKCFJBFPPKU-UHFFFAOYSA-N	438.278	1.695	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)NCc1ccc(N2CCCS2(=O)=O)cc1	764772809	MQSRLFLICQHTCX-UHFFFAOYSA-N	443.485	1.008	50	20	IDGD	
Cc1ccc(-n2c(C)cc(C=NNC(=O)Cn3cnc4c3c(=O)n(C)c(=O)n4C)c2C)cc1	764812330	JGVBLUJXSKCZPA-UHFFFAOYSA-N	447.499	1.300	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)CCc3ccc(S(N)(=O)=O)cc3)n[nH]2)cc1C	765568893	ZRSJJFIFHMWHFO-UHFFFAOYSA-N	441.513	1.735	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1ccc(I)cc1C	766270527	IYGUQWZITZQFKN-UHFFFAOYSA-N	427.202	1.480	50	20	IDGD	
CCC(=O)N1CCC[C@H](C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)C1	766659280	AAWQWJQBBJJEPD-SFHVURJKSA-N	449.983	1.254	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@@H](C)c2cccc(F)c2F)cc1	766847894	HSGBTWATLNEOMX-ZDUSSCGKSA-N	440.472	1.985	50	20	IDGD	
O=C(NNC(=O)N1CCO[C@H](c2cccc(Cl)c2)C1)c1ccc(-n2cnnn2)cc1	767297109	OCOHEYHWOCVTIR-KRWDZBQOSA-N	427.852	1.744	50	20	IDGD	
Cc1ccc(C)c(N2CCN(C(=O)NNC(=O)c3csc(N4CCOCC4)n3)CC2)c1	767929327	WHRUDKLWHCPLFH-UHFFFAOYSA-N	444.561	1.773	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCc4sccc4C3)c2)n[nH]1	768273661	IAWUNKYMJZRCTJ-UHFFFAOYSA-N	445.526	1.601	50	20	IDGD	
COc1ccc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1C1CC1	769475162	CPRROPNULYSSAE-LJQANCHMSA-N	426.425	1.717	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)[nH]n1)C(=O)Nc1ccnn1-c1cccc(F)c1	770775218	XFHLOCPOTMTXCX-UHFFFAOYSA-N	433.403	1.801	50	20	IDGD	
Cc1nc2cc(O)nn2c(C)c1CC(=O)NNc1nc(O)c2cnn(C(C)(C)C)c2n1	770965391	BASQMFARVOBQBO-UHFFFAOYSA-N	425.453	1.338	50	20	IDGD	
Cc1c(C(=O)NNc2nc(O)c3cnn(C)c3n2)sc2nc3n(c(=O)c12)CCCCC3	770979791	JQIWTOZEMVHMOV-UHFFFAOYSA-N	440.489	1.632	50	20	IDGD	
CN1CCN(c2ccc(C=NNC(=O)CN3CCN(C(=O)c4ccccc4)CC3)cc2)CC1	771557369	DACIMHAGZDCILF-UHFFFAOYSA-N	448.571	1.347	50	20	IDGD	
Nc1nc(Cl)c(C=NNC(=O)C(=O)NCc2ccc(Cl)cc2)c(N2CCCC2)n1	771567152	GICHYRLWCDVEQE-UHFFFAOYSA-N	436.303	1.732	50	20	IDGD	
N#CCC(=O)NNC(=O)COc1c(I)cc(Cl)c2cccnc12	771883475	JNDVPFBFCHJNDB-UHFFFAOYSA-N	444.616	1.933	50	20	IDGD	
Cc1cc(C)nc(-n2nc(C)c(CC(=O)O[C@H](C)C(=O)NNC(=O)CC(C)C)c2C)n1	771996274	WJUCLPFGTLNUAS-MRXNPFEDSA-N	430.509	1.564	50	20	IDGD	
CC(C)c1nccnc1NNC(=O)c1ccc2c(c1)S(=O)(=O)N(C[C@@H]1CCCO1)C2=O	772847024	GGZIFYHZXJHONP-AWEZNQCLSA-N	445.501	1.680	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)[C@H]2CC(=O)N(CC(F)(F)F)C2)C1	773412881	XSHJZGVTUUVQJA-RYUDHWBXSA-N	436.431	1.192	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2)cc1S(=O)(=O)NC1CC1	773640101	WQQHFCQJUFAKGS-UHFFFAOYSA-N	449.445	1.126	50	20	IDGD	
CN1CCN(C(=O)Cc2ccc(NC(=O)C(=O)NNc3ccc4ccccc4n3)cc2)CC1	773661030	DDVPKVLPYOSAIL-UHFFFAOYSA-N	446.511	1.633	50	20	IDGD	
CNS(=O)(=O)c1ccc(C)c(NC(=O)C(=O)NNc2ccc(C(F)(F)F)cn2)c1	773665875	HZLGWYDQCBRERS-UHFFFAOYSA-N	431.396	1.399	50	20	IDGD	
CNC(=O)c1ccc(OC)c(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)c1	774002063	LYMXMLNZKWMASR-LLVKDONJSA-N	448.863	1.262	50	20	IDGD	
COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1cccc(Cl)c1	774003155	URKRWGRDVGAENW-JTQLQIEISA-N	436.808	1.810	50	20	IDGD	
C[C@H](NCC(=O)NNC(=O)c1ccc(C#N)cc1)c1ccc(OCC(=O)NC2CC2)cc1	774968598	VSBRYODYRTUTTN-HNNXBMFYSA-N	435.484	1.327	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1ccc(NC(=O)NNC(=O)CN(C)C)cc1)[C@@H]1C[C@H]2CC[C@H]1C2	775460097	PCQHJEOGGCXDDC-LLDVTBCESA-N	437.566	1.504	50	20	IDGD	
CSc1cccc(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)c1[N+](=O)[O-]	777092477	XZFJUJPBXXSOGW-UHFFFAOYSA-N	444.878	1.692	50	20	IDGD	
Cc1nn(CC(F)(F)F)c(C)c1[C@H](C)C(=O)NNC(=O)CNC(=O)c1cccs1	777976138	MZXNTYCZUMSCQI-VIFPVBQESA-N	431.440	1.805	50	20	IDGD	
CCOC(=O)N1CCC([C@H](C)NCC(=O)NNC(=O)c2cc(Cl)ccc2OC)CC1	778226114	JJZMCJCGMYYHBE-ZDUSSCGKSA-N	440.928	1.956	50	20	IDGD	
COc1ccc(Cn2ccc(NC(=O)C(=O)NNC(=O)c3ccc(C)c(F)c3)n2)cc1	778727274	XDNUQPPGHVOGJR-UHFFFAOYSA-N	425.420	1.787	50	20	IDGD	
O=C(NNc1ccc([N+](=O)[O-])cc1Br)C1=CC=CN2CCS(=O)(=O)N=C12	779146535	TXEGKIKMMJOAHO-UHFFFAOYSA-N	442.251	1.298	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)CN2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)c1	780792522	XZTCYZARTBCMGW-UHFFFAOYSA-N	446.529	1.231	50	20	IDGD	
COc1cccc(NNC(=O)C2CCN(S(=O)(=O)c3cccc(C(C)=O)c3)CC2)n1	781023869	LNRQAHMWTXPENT-UHFFFAOYSA-N	432.502	1.837	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)C1=CCN(C)CC1	781394903	LYFDERJBOTVIMR-OAHLLOKOSA-N	435.550	1.066	50	20	IDGD	
CC(=O)N1CCN(c2cccc(NC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)c2)CC1	782081296	HYVJNPFWPJYZPU-UHFFFAOYSA-N	426.433	1.730	50	20	IDGD	
COCC(=O)N1CCc2cc(NC(=O)C(=O)NNc3ncnc4ccsc34)ccc21	783253136	IVUCQUQLHWDJOV-UHFFFAOYSA-N	426.458	1.309	50	20	IDGD	
O=C(NNc1cncc(Cl)n1)C(=O)Nc1cccc(F)c1I	783258254	DZEOYNXSPXWJPD-UHFFFAOYSA-N	435.584	1.956	50	20	IDGD	
CN(C)C(=O)C[C@H]1CN(C(=O)C(=O)NNc2cncc(Cl)n2)c2ccc(Cl)cc21	783259588	FWZHYNOSOPZXCE-JTQLQIEISA-N	437.287	1.835	50	20	IDGD	
CN(c1ccccc1NC(=O)C(=O)NNc1ccc(Cl)cc1[N+](=O)[O-])S(C)(=O)=O	783289617	OJLAAXPIYYGMSY-UHFFFAOYSA-N	441.853	1.726	50	20	IDGD	
Cc1cccc(Oc2ccccc2NC(=O)C(=O)NNC(=O)CNC(=O)c2ccco2)c1	784002237	MITYFKRGGZWZTH-UHFFFAOYSA-N	436.424	1.896	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(F)c(NC(=O)C(=O)NNc2cccc([N+](=O)[O-])c2)c1	784830977	FUHREFISTPHAGO-UHFFFAOYSA-N	425.398	1.066	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)Nc1cc(Cl)cc2cccnc12	785022923	BNDVZEUBJJTGSS-UHFFFAOYSA-N	429.776	1.902	50	20	IDGD	
COc1ccc(Br)c(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)c1	785060793	MGOIDDDOCZMLMJ-UHFFFAOYSA-N	446.261	1.434	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1ccc(OCC2CC2)cc1	785330120	FCOOZMSAWMRWQL-UHFFFAOYSA-N	433.486	1.969	50	20	IDGD	
O=C(COC(=O)c1cc(F)c(Cl)cc1F)NNC(=O)[C@H]1COc2ccccc2O1	785611182	MXRZUYLCXKUZQS-OAHLLOKOSA-N	426.759	1.762	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)NCc2ccccc2)c(OC)c1	786727788	KQHDGKQYOOXIPM-UHFFFAOYSA-N	442.519	1.150	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)NNC(=O)[C@H]1CCN(c2ccc3c(c2)OCCO3)C1=O	787435822	BMEZHCWHOLMBBY-MRXNPFEDSA-N	444.875	1.995	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2F)cc1C(=O)N1CCOCC1	787541076	LKCXSOIUOYGUJH-UHFFFAOYSA-N	428.420	1.006	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNS(=O)(=O)C[C@@H]2CCCOC2)cc1	788140010	SYQNYAFCASBDHJ-CQSZACIVSA-N	425.536	1.098	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)CC(=O)NNc2nnc(-c3ccccn3)s2)cc1F	788563532	IJFKKTDNWJNTPP-UHFFFAOYSA-N	435.462	1.859	50	20	IDGD	
Cc1cc(S(=O)(=O)N2CCN(S(=O)(=O)CBr)CC2)sc1Cl	788906076	WDLGORMUKIOADW-UHFFFAOYSA-N	437.790	1.698	50	20	IDGD	
COc1cc(NNC(=O)C(=O)Nc2ncn(CC(=O)N3CCCCCC3)n2)ccc1Cl	789798034	XSICDEYRLHKZJP-UHFFFAOYSA-N	449.899	1.425	50	20	IDGD	
CC(=O)c1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)ccc1C	789867799	YIKIASUJJXOVEJ-UHFFFAOYSA-N	445.497	1.293	50	20	IDGD	
COc1ccc(S(=O)(=O)NC(C)(C)C)cc1NC(=O)C(=O)NNc1ncccc1C	792375216	FMZZBZLBPJMMNE-UHFFFAOYSA-N	435.506	1.557	50	20	IDGD	
COCCN(C)S(=O)(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(CCCl)cc2)C1	792783726	NITDJEATXLCYQA-QGZVFWFLSA-N	438.999	1.529	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)Cc2c[nH]c3ccccc23)nc1Br	793021682	IXNYUOHDXCUDNN-UHFFFAOYSA-N	430.262	1.962	50	20	IDGD	
CSSCCNC(=O)C(=O)Nc1ccc(S(=O)(=O)/N=C2/CCCN2C)cc1	793079820	VGFDEADSNCIIFP-RGEXLXHISA-N	430.577	1.565	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)NCC2(S(C)(=O)=O)CCC2)cc1Cl	793267160	APVUXGLGJLYKSD-UHFFFAOYSA-N	434.902	1.660	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)c2cc(Cn3cccn3)on2)c2ccccc2c1=O	794182706	NEQQTFFDRMROSO-UHFFFAOYSA-N	449.471	1.894	50	20	IDGD	
COC(=O)[C@]1(c2ccccc2)CCN(CC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)C1	794809445	WDHVUAQWPDLHSP-OAQYLSRUSA-N	426.429	1.173	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2ccc(OC(C)C)c(C(N)=O)c2)c1	796992034	KYGWXFSYTAAONP-UHFFFAOYSA-N	442.472	1.354	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNC(=O)C(=O)Nc1ccc(-c2cc[nH]n2)cc1	797370227	WTDAZQBHWXWDNJ-UHFFFAOYSA-N	436.428	1.089	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)CCc2ccco2)cc(Br)cc1[N+](=O)[O-]	797535718	PUYIMCSVAXYFQV-UHFFFAOYSA-N	439.222	1.977	50	20	IDGD	
COC(=O)c1cc(C(=O)NNC(=O)c2nc(-c3ccccc3)n(-c3ccccc3)n2)no1	798153849	ITVFRYFLIMUPGE-UHFFFAOYSA-N	432.396	1.784	50	20	IDGD	
C=CC[C@@H](CC)NC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	798496837	UZKGAKMFVSEQCE-QGZVFWFLSA-N	438.550	1.325	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2ccc(Cl)c(CN(C)C)c2)c1	799257785	SAFWAQQVJNKOPA-UHFFFAOYSA-N	434.880	1.819	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2c(-c3cccnc3)noc2C)cc1OC	803825306	YSSFNXZEUVWUHL-UHFFFAOYSA-N	440.412	1.680	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)N3CCN(C)CC3)c2)cc1	804025057	HZMDDXRQTARVQF-UHFFFAOYSA-N	447.517	1.098	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)Nc2ccc(F)c(S(=O)(=O)N(C)C)c2)cc1	806543434	WBVUJLDYGUEQOR-UHFFFAOYSA-N	438.481	1.870	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)C(=O)Nc1cnn(Cc2ccc(Cl)cc2)c1	807429219	PJEXMIYXYACBRP-UHFFFAOYSA-N	437.851	1.642	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NN=Cc1cc(Br)cc(Br)c1	807970648	RLKWPZODZXOJSO-ZETCQYMHSA-N	427.118	1.599	50	20	IDGD	
CC(C)OCc1nc([C@H](C)NC(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)no1	812644069	GXHOSWSLFINPKI-JTQLQIEISA-N	433.473	1.982	50	20	IDGD	
CC(C)OCc1cccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)c1	813033263	LMLSBQBDMHCRIV-UHFFFAOYSA-N	434.518	1.944	50	20	IDGD	
CC(=NNC(=O)Nc1ccc2c(c1)OCO2)c1ccc(S(=O)(=O)N2CCOCC2)cc1	814991993	DFBHFPPMPMCIKI-UHFFFAOYSA-N	446.485	1.982	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)Cn2nc(C)cc2C)cc1)[C@@H]1C[C@@H]1C	815566652	ALGMMVMEKGGAFM-KPZWWZAWSA-N	426.477	1.047	50	20	IDGD	
CCOc1ccc(NNC(=O)C(=O)Nc2ccc(NC(=O)[C@@H](C)n3cncn3)cc2)cc1	815815019	HIRRPSQWQVUFFO-CQSZACIVSA-N	437.460	1.958	50	20	IDGD	
CC(C)[C@H](C(=O)NNc1ccccc1S(=O)(=O)N(C)C)n1nnc(-c2ccccc2)n1	817054256	AUTWWRFQSKFRMH-GOSISDBHSA-N	443.533	1.931	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)c2ccc(C)c(S(N)(=O)=O)c2)c1	818745545	JMCVITUHJLZDSX-UHFFFAOYSA-N	442.291	1.948	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Cn2cnc3ccccc32)cc(Cl)c1OCC(N)=O	822211413	WYOWQCYZSCFJHY-UHFFFAOYSA-N	431.836	1.024	50	20	IDGD	
CCCCn1c(C)cc(/C=C(\C#N)C(=O)N(CC)CC(=O)N[C@H]2CCS(=O)(=O)C2)c1C	912663453	FHRMXEHTOWMOBV-RQRMZWKBSA-N	448.589	1.964	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)CN2C(=O)N[C@@]3(C[C@H](C)CC(C)(C)C3)C2=O)cc1	913429554	HZVANAOOGPMZQD-JLCFBVMHSA-N	445.520	1.391	50	20	IDGD	
C[C@H]1CN(c2ccc(C(=O)OCC(=O)NNC(=O)c3ccc(Cl)cc3)cn2)C[C@H](C)O1	915038220	SNKHINRJNXJUEH-KBPBESRZSA-N	446.891	1.967	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NN=Cc1ccc([N+](=O)[O-])cc1	915913968	LNLRMLQNZGJUJR-UHFFFAOYSA-N	446.485	1.699	50	20	IDGD	
Cn1ccnc1[C@H](NC(=O)NNC(=O)COc1ccccc1[N+](=O)[O-])c1ccc(F)cc1	916221069	MSNDMRFUZYZCBC-GOSISDBHSA-N	442.407	1.966	50	20	IDGD	
O=C(NCc1cccnc1OCC(F)(F)F)NNC(=O)[C@H]1COc2ccccc2O1	916397011	BRXUMZRMQHDWAI-CQSZACIVSA-N	426.351	1.693	50	20	IDGD	
O=C(COC(=O)[C@@H]1CCC[C@@H](C(F)(F)F)C1)NNC(=O)[C@H]1COc2ccccc2O1	917285856	OLZWWAZBIVIXBV-LALPHHSUSA-N	430.379	1.886	50	20	IDGD	
CSCC[C@@H](NC(=O)c1ccccc1)C(=O)NNC(=O)CCN1C[C@H](C)O[C@H](C)C1	917362878	PPFGXNIUCYHYLZ-SOLBZPMBSA-N	436.578	1.185	50	20	IDGD	
COc1cccc(CCNC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)c1OC	918014359	UEJZNBBRPSQGMC-UHFFFAOYSA-N	425.445	1.782	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)NCc2cccc(S(=O)(=O)NC(C)C)c2)cc1	919904298	FIVJFXUXVNTHQI-UHFFFAOYSA-N	448.545	1.845	50	20	IDGD	
COc1cccc(C(=O)NNS(=O)(=O)c2ccc(Br)c(C(=O)O)c2)c1O	919958593	RVSMGTUWFWPSKH-UHFFFAOYSA-N	445.247	1.485	50	20	IDGD	
Cn1c(=NNC(=O)c2cc(S(=O)(=O)N3CCSCC3)c[nH]2)sc2ccccc21	921025064	PLMPDQNRBPXHLV-UHFFFAOYSA-N	437.572	1.551	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCC2CCN(C)CC2)c1	1251614639	IICPLOHTOBOAFZ-UHFFFAOYSA-N	439.582	1.393	50	20	IDGD	
Cc1cc(S(C)(=O)=O)c(C)c(S(=O)(=O)NNC(=O)c2cncn2-c2ccccc2)c1	1318375239	INZLVHFXDNSQTC-UHFFFAOYSA-N	448.526	1.516	50	20	IDGD	
O=C(NNc1cncc(Br)c1)c1ccc(S(=O)(=O)N2CCOCC2)cc1	1324515612	FUCGXAYNPLATAQ-UHFFFAOYSA-N	441.307	1.622	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)[C@@H]1CC12CCS(=O)(=O)CC2	1325808879	XTVMERMAHQIUQX-RISCZKNCSA-N	445.335	1.579	50	20	IDGD	
C[C@@H](O)C(=O)NNC(=O)c1ccc(NS(=O)(=O)c2ccc(Br)cc2)cc1	1326145851	MZJZMUBIQLPVOK-SNVBAGLBSA-N	442.291	1.392	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)o1	1779024583	UUPBAQJBDSHCNH-KZULUSFZSA-N	442.310	1.713	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(Br)cn3)C2)C1	1779424863	DIRNTDHVQHLREZ-CXAGYDPISA-N	446.729	1.541	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cn(C)nc3C(F)(F)F)C2)C1	1779544848	VXCYLEYFAYCWPO-LRDDRELGSA-N	438.834	1.136	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(O)nn1)C2)[C@@H](F)Br	1780770951	MLQKGXKPBBCNRC-AXAPSJFSSA-N	431.262	1.000	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)COCCNC(=O)OC(C)(C)C)C2)C1	1781202266	ZDYGSAJKMSABBG-YWZLYKJASA-N	447.960	1.375	50	20	IDGD	
COc1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)ccc1O	1781334405	NLANWXAUPDQAHA-RHSMWYFYSA-N	431.258	1.535	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1nc(C)no1)C2	1781899595	AEYVBIYUHLOIIB-PMUMKWKESA-N	443.342	1.608	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H]1CCNC(=O)C1)C2	1781905659	SSILMHGMEJGNAO-XTDOFWJNSA-N	444.370	1.200	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cccn4nccc34)C2)C1	1782335312	CWRICBUZFKXQIU-KXBFYZLASA-N	435.322	1.951	50	20	IDGD	
C[C@H](NC(=O)c1ccccn1)C(=O)N1CC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1782667217	RRAJKJKDQRJSTL-BTYIYWSLSA-N	436.940	1.295	50	20	IDGD	
COc1ccc(CC(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](O)CCl)C3)cc1F	1782675919	SQFQGGDSFVLSBV-YRISNDGFSA-N	442.915	1.490	50	20	IDGD	
C[C@H](Cc1ccc(F)cc1)C(=O)N1CC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1	1782928606	JOQRZCVHGNUPEK-HXOBKFHXSA-N	448.539	1.207	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3[nH]nc4ccncc34)CCO2)C1	1783347274	DXTTYQKTELISRA-SCLBCKFNSA-N	436.310	1.575	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)C/N=C/c3ccco3)CCO2)C1	1783349232	KJWMFVKAJJPRAK-FRCMGPSKSA-N	426.311	1.702	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](C)n1ccccc1=O)CCO2	1783349639	PRYRTKYLVRGLDT-ZRGWGRIASA-N	440.338	1.413	50	20	IDGD	
COC(=O)C12CC(C(=O)N3CC[C@@]4(C3)CN(C(=O)[C@](C)(Cl)CCl)CCO4)(C1)C2	1783444907	KIPWJYSKTYSNSU-LWSMDNFKSA-N	433.332	1.396	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3n[nH]c4ccc(F)cc34)CCO2)C1	1783534275	RWFSGMVHQPYKPK-ZMZPIMSZSA-N	439.285	1.929	50	20	IDGD	
Cc1ccc2[nH]cc(CC(=O)N3CC[C@H]4CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]4C3)c2c1	1784086202	WOBOGFYRKIUZSN-OBZTVWKBSA-N	433.936	1.598	50	20	IDGD	
Cc1ccc(OC(C)(C)C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]3C2)nc1	1784093171	PTVNLIACUGPEQN-QAETUUGQSA-N	439.940	1.127	50	20	IDGD	
CCOC(=O)N1CCC(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](Cl)CC)CCO3)CC1	1785373804	PZUQWITUPDWAJQ-OXQOHEQNSA-N	429.945	1.702	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)c3ccccc3)[C@H]2C1	1786668693	ZAZPGWKNXFJVRU-NBZXXOOGSA-N	439.350	1.731	50	20	IDGD	
CN(C)c1ccc([N+](=O)[O-])c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Cl)C[C@@H]32)c1	1789232005	RQXYVZLMCCLPSJ-YJOCZYATSA-N	442.875	1.789	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccn(C(F)F)n3)C[C@@H]21)[C@@H](F)Br	1789924432	DAIFMFHURIWKIE-FSZOTQKASA-N	439.232	1.562	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc4ccc(F)cn34)[C@H]2C1	1790474390	HJKDMILJPVGOSJ-QEWYBTABSA-N	438.887	1.321	50	20	IDGD	
C#CCCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C[C@@H]21	1792172708	GQFWJYHAGFPMJP-QSFXBCCZSA-N	443.456	1.527	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2)C1CC1	1793064173	SPMDVQFHPNGELI-AEKWLRTRSA-N	447.935	1.804	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(C(F)(F)F)nc1	1795177397	MSLWMDUSAQGWPA-QDMKHBRRSA-N	441.454	1.725	50	20	IDGD	
O=C(COc1ccc(F)cc1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2	1795198369	XJCVJULQVQHIAV-OJXGSEEGSA-N	433.249	1.485	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2c[nH]nc2c1	1796175316	DIVDJANMDGAQBW-JYYAWHABSA-N	435.322	1.940	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cn1cncn1	1796292621	SJRAVTHCSAMBJN-MFCNVNSWSA-N	426.427	1.802	50	20	IDGD	
COc1ccc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@](C)(Cl)CCl)cn1	1799273811	JMLMHLZBLVCTID-ZDUSMZPESA-N	444.359	1.849	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](F)Br)c1cnc2c(c1)CCNCC2	1800161763	NBMIQZNBVXQKCZ-JYYAWHABSA-N	439.329	1.712	50	20	IDGD	
O=C([C@@H](F)Br)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(F)(F)c1ccco1	1800240473	GAIUFGSYQYGPLP-RBLKWDMZSA-N	425.201	1.652	50	20	IDGD	
Cc1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)ccc1F	1800449997	YQYBHKIJYHPBBB-MUJYYYPQSA-N	425.464	1.698	50	20	IDGD	
Cc1nccn1CCCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)Br	1800762865	IIXPLIVGHLVUFK-FAYQHZLMSA-N	427.343	1.345	50	20	IDGD	
CC(=O)Nc1cc(C(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)ccn1	1803139363	ONEJGDFHGWJILE-LMMKCTJWSA-N	445.907	1.354	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccn3ccnc3c2)[C@@H]1c1cccnc1)[C@H](O)CCl	1803142943	OWJHTCGRVJFGRH-YQVWRLOYSA-N	427.892	1.649	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@H](F)C[C@H]1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](O)CCl)C2	1804553569	ALMCLAASMFHBFU-KXKVQDCLSA-N	447.935	1.572	50	20	IDGD	
Cc1cc(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)c[nH]1	1808776630	VNWMMTYELGQLFG-WIYYLYMNSA-N	432.289	1.031	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)NC[C@H]1CCN(C(=O)CO[Si](C)(C)C)[C@H]1c1cccnc1	1810237554	ZVFXGFNPIWORHV-SUMDDJOVSA-N	449.628	1.647	50	20	IDGD	
Cn1cccc1C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1	1810297342	BRLTWMSGSUKRNF-OXQOHEQNSA-N	447.499	1.052	50	20	IDGD	
O=C(Cc1cn2c(nc1=O)SCC2)N1CCC2(CCCN(C(=O)[C@H](F)Cl)C2)CC1	1810907291	IPEMMIPIIIWUGE-HNNXBMFYSA-N	442.944	1.657	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)CCNC(C)=O)[C@H]1c1cccnc1	1812662736	CHHLUCJPNBMNGW-XYJFISCASA-N	439.354	1.787	50	20	IDGD	
CCOC(=O)/C=C/C(=O)N1CC[C@H](CNC(=O)[C@@H](C)Br)[C@@H]1c1cccnc1	1812864017	JLUIOMGBKOLGOM-FUSKIFQFSA-N	438.322	1.990	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H](CNC(=O)CN2CCCCC2=O)[C@H]1c1cccnc1	1812976344	YIBGRAPNZIBSKF-XMSQKQJNSA-N	446.624	1.951	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)[C@H](C)Cn2cncn2)[C@H]1c1cccnc1	1813030515	CWWAEQGEVPJESM-UBDQQSCGSA-N	434.928	1.269	50	20	IDGD	
CCc1cc(C(=O)N2CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)no1	1813074049	QMWRXQUEHPSPTC-IIBYNOLFSA-N	442.520	1.325	50	20	IDGD	
C[C@H](C(=O)NC[C@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1)n1cnnn1	1813467853	JWZMGVYJRHBDNS-XNRPHZJLSA-N	436.314	1.120	50	20	IDGD	
Cc1ccc(C(=O)NCC(=O)N2CCCC[C@H]2c2cc(NC(=O)[C@H](O)CCl)n[nH]2)cc1	1814876175	QIPIYXNTJUVKQJ-DLBZAZTESA-N	447.923	1.740	50	20	IDGD	
O=C(Cc1ccsc1)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1	1815339360	AQFPOSDOZYANGG-OAHLLOKOSA-N	441.343	1.353	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CN)n[nH]1	1817242410	SZFZPZAZYLLVFV-OAHLLOKOSA-N	430.421	1.508	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H]1CCOC1)CC2	1817282725	LCXJKSAIFKIBFW-UFOJXWSGSA-N	444.517	1.226	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnc(O)nc2O)n[nH]1	1818022087	FTUUUSOHJZWQIB-KCJUWKMLSA-N	439.270	1.700	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1)[C@H]1CC[C@H]2CCC(=O)N2C1	1820758035	VXRSSSAMTXKJEY-DARAHFNDSA-N	437.928	1.403	50	20	IDGD	
CC(C)(CCl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3nccnc3C(N)=O)sc2C1	1821033461	WQYNFVOIXPBFIA-SECBINFHSA-N	436.925	1.523	50	20	IDGD	
C[C@H](Br)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1	1822192108	OYWAPURLHGKTQO-AAEUAGOBSA-N	443.346	1.558	50	20	IDGD	
COCCn1nccc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](Cl)COC)n[nH]1	1822367707	ACINNXGPWTYQQO-DZGCQCFKSA-N	438.916	1.812	50	20	IDGD	
CC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)NC(=O)OC(C)(C)C)CC2	1822856047	SIADDAGGXUNYSG-HFBDOXOYSA-N	446.957	1.916	50	20	IDGD	
O=C(c1ccc2c(n1)OCCO2)N1CCC([C@@H]2CCCCN2C(=O)[C@H](O)CCl)CC1	1824182471	DIBCAIDEYWGZEY-DLBZAZTESA-N	437.924	1.686	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC([C@H]2CCCCN2C(=O)CN2CCOC2=O)CC1	1824336290	KYCBPMKELTWBNW-UKRRQHHQSA-N	430.343	1.842	50	20	IDGD	
Cc1nc(CC(=O)N[C@@H]2CCc3nc(NC(=O)[C@@H](C)Br)sc3C2)no1	1825637011	PLSHKLIIKQVCSZ-VXNVDRBHSA-N	428.312	1.773	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)c2cccc(O)n2)CC1	1825943644	PLTGLWVUSKTBLM-HXUWFJFHSA-N	437.305	1.014	50	20	IDGD	
Cc1nocc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1	1826042255	RCLXTHRTNWDOIQ-FQEVSTJZSA-N	425.294	1.210	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H]1CCCSC1)CC2	1826092036	JDXYEAZZBMISEU-QWHCGFSZSA-N	439.607	1.571	50	20	IDGD	
O=C(c1nccs1)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827051404	XKFRMKFIUTYLHQ-GOSISDBHSA-N	427.335	1.370	50	20	IDGD	
O=C([C@@H]1[C@@H]2C=CS[C@@H]12)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827060318	FSZSHMBBAYSHSP-UWHLTILDSA-N	440.374	1.475	50	20	IDGD	
O=C(CCBr)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)n2)CC1	1827598790	FVZCAKFBMQYKHA-AWEZNQCLSA-N	441.326	1.906	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1C1CCN(C(=O)C2CC(=O)C2)CC1	1827679771	UQYPASUGHLQPKJ-RASHHNMQSA-N	441.532	1.719	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnn4c3OCCC4)C2)C1	1830365319	CPKSRQZGPFNPHH-HXUWFJFHSA-N	440.928	1.001	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccn3C)C2)C1	1830537344	DHZBCFRXKKUCFA-RDTXWAMCSA-N	428.327	1.126	50	20	IDGD	
O=C(c1cc2ccoc2s1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1830723901	TWSSYPNEABJUSP-FZKQIMNGSA-N	428.894	1.164	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4c(c3)OCO4)C2)C1	1831645901	FEBUIXBBFOORAN-IIBYNOLFSA-N	438.908	1.893	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cccc4c[nH]nc34)CC2)CC1)[C@@H](O)CCl	1833310198	BRYZUQAWUAPHJQ-SFHVURJKSA-N	433.940	1.348	50	20	IDGD	
CCc1ncccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)Br)C2)C1	1833517812	HQSXSSSXADDLIH-IFXJQAMLSA-N	440.338	1.497	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCC(N2CCC(NC(=O)c3ccncn3)CC2)CC1	1835146714	ZEUYGCXWRGKNGP-IBGZPJMESA-N	428.364	1.898	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CN(C)C(=O)OC(C)(C)C)CCO2)C1	1835210479	QGHHENMTAPCPJH-MGPUTAFESA-N	447.960	1.327	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)c1nc2ccccc2[nH]1	1835297053	TVCNKOQZGBWWSK-GOSISDBHSA-N	433.940	1.348	50	20	IDGD	
CC(C)(C)NCC(=O)N1CCC(N2CCC(NC(=O)CO[Si](C)(C)C)CC2)CC1	1835833522	NQZNXPXXOUCBAD-UHFFFAOYSA-N	426.678	1.798	50	20	IDGD	
Cc1cc(CC(=O)N2CCC(N3CCC(NC(=O)CO[Si](C)(C)C)CC3)CC2)nn1C	1835835105	OSNLZZNKBRCNPW-UHFFFAOYSA-N	449.672	1.694	50	20	IDGD	
CCc1ccnc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)c1	1836360039	DPHFWSUPXFWWLU-LIRRHRJNSA-N	440.338	1.497	50	20	IDGD	
C=CCO[C@@H](C)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](F)Br)CC2)CC1	1836413395	FJSVQBHUFRNDSL-XJKSGUPXSA-N	434.350	1.840	50	20	IDGD	
C[C@@H](C(=O)N1CCC(N2CCC(NC(=O)[C@@H](F)Br)CC2)CC1)n1cccn1	1836414379	HGVMJYUNDOEILH-XJKSGUPXSA-N	444.349	1.706	50	20	IDGD	
Cc1nn[nH]c1C(=O)N1CCC(OC2CCN(C(=O)[C@H](C)CBr)CC2)CC1	1836671268	UDCFYTCMKPJPES-GFCCVEGCSA-N	442.358	1.756	50	20	IDGD	
C[C@@H](CC(N)=O)C(=O)N1CCC(OC2CCN(C(=O)[C@](C)(Cl)CCl)CC2)CC1	1836911104	RKQRVTCPBLPWMF-ORAYPTAESA-N	436.380	1.733	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](C)Cn3cccn3)CC2)CC1	1837222722	XEGARZDJVZGPOO-QFBILLFUSA-N	440.972	1.772	50	20	IDGD	
CC1(C(=O)N2CCC(OC3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)CC1	1837598684	GZBYHIPHQLIMIL-UHFFFAOYSA-N	429.521	1.097	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)Cc3ccccc3)CC2)CC1	1837707868	HQQYUHWRCWAETL-UHFFFAOYSA-N	444.576	1.601	50	20	IDGD	
CCSc1cccnc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1838847259	TXXRYGRKVYJBKK-QAPCUYQASA-N	431.917	1.798	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CSc3ncccn3)C2)C1	1839143672	DTOGPWNMWQDGKM-KSSFIOAISA-N	428.942	1.043	50	20	IDGD	
CC(C)(C)[C@@H](O)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2	1839150385	KYBUNEQMRGFTBE-DOPJRALCSA-N	425.353	1.086	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)c(O)c1	1839203445	LMEDHIBYRREROM-QAPCUYQASA-N	445.285	1.461	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccc(F)cn3)C2)C1	1840031914	GTGZDJDCFLAZJJ-FZKQIMNGSA-N	444.301	1.003	50	20	IDGD	
Cc1cc(F)cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)c1	1840034832	YKKMDHKHBZFSNO-LIRRHRJNSA-N	443.313	1.988	50	20	IDGD	
C/C(=C\c1cccnc1)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1840414419	LVNZTWXSXMMAEV-JNMQVBFRSA-N	428.316	1.745	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)Cc1c(C)noc1C)C2	1843415406	PEXVEQJFJLDOCR-OEAKJJBVSA-N	426.477	1.171	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)c2n[nH]c3cc(Cl)ccc23)C1	1844106592	OGHZTSHIVIJPOP-UHFFFAOYSA-N	438.680	1.027	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)[C@H](C)Cc2ccncc2)C1	1845762746	CTSLBLCEWDJMHQ-MSZQUAHTSA-N	436.516	1.598	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)Cc2ccc(F)cc2F)C1	1846081434	QYNAICRQLUHLGK-VULFUBBASA-N	443.454	1.845	50	20	IDGD	
CCOC(=O)c1ncn2c1CC[C@H](C(=O)N1CC3(CCCN3C(=O)C(Cl)Cl)C1)C2	1846388719	OJYSHXXAMJFYSL-LBPRGKRZSA-N	443.331	1.629	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@H](Cc2cccc(F)c2)NC(C)=O)C1	1847014405	LFMJNVRCBWKLTK-QZTJIDSGSA-N	439.915	1.330	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](F)Cl)[C@@H](O)C1	1847233429	AKBRWJPGYSTRBV-YYFQZIEXSA-N	433.908	1.341	50	20	IDGD	
CN(CC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H]1CC=CCC1)NC(=O)NCc1ccccc1	1847509211	MBXTXJMYPDBKDU-HKBOAZHASA-N	439.560	1.891	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)[C@H](C)Oc1ccc(C#N)cc1	10780584	GQYLXRVBWKQYMR-LBPRGKRZSA-N	431.832	1.992	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Cc2cnn(-c3ccccc3)c2)c1	24348002	HSPQTIBIEFLNDG-UHFFFAOYSA-N	427.486	1.126	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)CCNS(=O)(=O)c1ccccc1F	24627783	BJJQJNWTSGAYFF-UHFFFAOYSA-N	429.857	1.617	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccccc1	105480121	TZZGSJLVHKFUQC-GOSISDBHSA-N	446.529	1.498	50	20	IDGD	
COc1ccc(CNC(=O)NNC(=O)CNC(=O)c2cccs2)cc1Br	726191594	GDAZLMJQZFVBLO-UHFFFAOYSA-N	441.307	1.780	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)CN1C(=O)COc2ccc([N+](=O)[O-])cc21	727969042	RMLIKFNPWHNTJC-UHFFFAOYSA-N	428.401	1.109	50	20	IDGD	
CCCCC(=O)N1CSC[C@H]1C(=O)NNC(=O)c1sc(N2CCOCC2)nc1C	728018360	LVWLWLRNXCMVCS-ZDUSSCGKSA-N	441.579	1.141	50	20	IDGD	
COc1ccc(C(=O)NNc2nc(-c3ccccc3)no2)cc1S(=O)(=O)NC1CC1	728080297	DKSADDROPGGFEU-UHFFFAOYSA-N	429.458	1.943	50	20	IDGD	
COc1cc(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)cc(OC)c1C	728213226	VRIRYFLXDBYHOV-UHFFFAOYSA-N	448.545	1.705	50	20	IDGD	
O=C(COC(=O)c1cnc(-c2ccccc2)nc1)NNC(=O)[C@H]1COc2ccccc2O1	728332330	IHFZOASFZZFKCV-GOSISDBHSA-N	434.408	1.288	50	20	IDGD	
CON(C)S(=O)(=O)c1ccc(C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)cc1	728974269	KJJGQPLWTHXQBL-UHFFFAOYSA-N	449.457	1.622	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCc2ccc(CN3CCC(O)CC3)cc2)cc1OC	729495158	QWWLWZMOLKJDHI-UHFFFAOYSA-N	442.516	1.805	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)[C@@H](CC(C)C)N2C(=O)[C@H]3CC=CC[C@H]3C2=O)cn1	729692358	FVOHHNFSMSSWKO-OWCLPIDISA-N	445.545	1.774	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)[C@H]2CCCN(S(=O)(=O)Cc3ccccc3)C2)c1O	730590374	RAKZGBQAKJBVIB-INIZCTEOSA-N	447.513	1.404	50	20	IDGD	
O=C(CCCC(=O)NNC(=O)Cc1ccccc1F)NNC(=O)Cc1ccccc1F	731328745	VPKMIAGNEULHJP-UHFFFAOYSA-N	432.427	1.215	50	20	IDGD	
Cc1c(C(=O)NNC(=O)CNC(=O)c2cccs2)nnn1-c1cccc2ncccc12	731331407	QEEBRCVYZFVWDU-UHFFFAOYSA-N	435.469	1.376	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)c2nnn(-c3ccc4c(c3)OCCO4)c2C)cc1C	731453653	OTXDNWLYCYFHNS-UHFFFAOYSA-N	437.456	1.804	50	20	IDGD	
CS(=O)(=O)CCN1CCC(NC(=O)NNC(=O)CCSc2ccc(F)cc2)CC1	731760897	GQCWSZVQMYNTCV-UHFFFAOYSA-N	446.570	1.147	50	20	IDGD	
C[C@@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(S(=O)(=O)NNC(=O)C3CCC3)cc2)C1	732047924	KXXIBWMOTHGCBE-ZIAGYGMSSA-N	429.564	1.463	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)c2cc(F)ccc2I)C[C@@H](C)O1	732262128	JGSZBESZADRGIF-GHMZBOCLSA-N	449.264	1.691	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)[C@H](C)N2CCN(c3ccc(F)cc3)CC2)cc1	732264465	SDJSLLKKINBZAV-INIZCTEOSA-N	429.496	1.604	50	20	IDGD	
Cn1cc(-c2nc(C(=O)OCC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)cs2)cn1	732327524	OLBDZGVWVDEOAE-UHFFFAOYSA-N	430.402	1.070	50	20	IDGD	
COc1cc(C(=O)NNC(=O)N[C@@H]2CCN(CC(F)(F)F)C2=O)ccc1OC(C)C	732590324	NWRUDSAGKVNBDI-GFCCVEGCSA-N	432.399	1.590	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)N[C@@H]2CCN(c3ccccc3C(N)=O)C2)c1	732595685	UQLNHBKVOAHFEA-MRXNPFEDSA-N	425.489	1.390	50	20	IDGD	
O=C(NNC(=O)c1ccccc1F)N[C@H]1CCCN(c2cc(N3CCOCC3)ncn2)C1	732914116	KFWCBDMXJLOPSJ-HNNXBMFYSA-N	443.483	1.065	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)/C(=C/c1cccnc1)NC(=O)c1ccccc1	733123989	MZWTWRBRBLNGQC-USUABIMMSA-N	444.447	1.840	50	20	IDGD	
Cn1c(NNC(=O)c2cccc(S(=O)(=O)NC3CCCC3)c2)nc2ccccc2c1=O	733260937	SJKDWZXUCOMYQF-UHFFFAOYSA-N	441.513	1.911	50	20	IDGD	
Cn1c(NNC(=O)[C@@H]2CCCN2S(=O)(=O)c2cccs2)nc2ccccc2c1=O	733262372	SSMGWRZMRPLQNB-AWEZNQCLSA-N	433.515	1.291	50	20	IDGD	
Cn1nc(O)c2c(C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)cc(C3CC3)nc21	734241324	MTGMTVUVMPCWQF-UHFFFAOYSA-N	433.469	1.020	50	20	IDGD	
Cc1nc(-c2cnn(C)c2)sc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	734416731	BRDLVKIKZLDYGI-UHFFFAOYSA-N	448.530	1.177	50	20	IDGD	
CCOC(=O)N1CCC(C(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)CC1	734825351	ZDXJFBWBXDVPOT-UHFFFAOYSA-N	441.529	1.585	50	20	IDGD	
COc1ccc(S(=O)(=O)C[C@@H](C)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1	734994411	ZAJGRVAMBKIESN-CYBMUJFWSA-N	434.470	1.337	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)[C@@H]3CCCCN3C(=O)c3ccc(O)nn3)cc2C1	741740457	AIKUIXDZBFJRKO-DOMZBBRYSA-N	443.529	1.824	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)[C@H]1CCN(c2cccc(Cl)c2)C1=O	742075595	FGUZGPPQCBCSCK-CQSZACIVSA-N	439.900	1.548	50	20	IDGD	
C[C@H](CC(=O)NNC(=O)c1ccc2ccccc2n1)/N=C1/NS(=O)(=O)c2ccccc21	742463818	RAZLYGJIXSDYNA-CYBMUJFWSA-N	437.481	1.513	50	20	IDGD	
CCn1c(=O)n(CC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)c2ccccc21	743830055	LWKREAQTTUIHDM-UHFFFAOYSA-N	431.474	1.079	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)CNC(=O)c2ccc(C(F)(F)F)cc2)c1	744565429	ZVWDIQSXXMUNHB-UHFFFAOYSA-N	448.357	1.311	50	20	IDGD	
O=C(NCc1ccnc(OCC(F)(F)F)c1)NNC(=O)c1cc([N+](=O)[O-])ccc1O	745466479	AYLOOFWBACPOGS-UHFFFAOYSA-N	429.311	1.781	50	20	IDGD	
CCOC(=O)c1ccc(CNC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)cc1	745765889	WLHWOEBZMGRFMV-UHFFFAOYSA-N	434.474	1.803	50	20	IDGD	
C[C@@H](CN1C[C@H](C)C[C@@H](C)C1)NC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	745768329	VXFSITDIQKUAMK-KFWWJZLASA-N	425.555	1.792	50	20	IDGD	
COc1cc(C)nc(NNC(=O)c2cc(S(=O)(=O)N3CCCC3)ccc2Cl)n1	746623369	MLLSGPWXZKFKGN-UHFFFAOYSA-N	425.898	1.988	50	20	IDGD	
Cc1ccc(S(=O)(=O)Cc2ccc(C(=O)NNC(=O)C(=O)N3CCCC3)cc2)cc1	748238790	ACMNYGNXMREDEW-UHFFFAOYSA-N	429.498	1.352	50	20	IDGD	
O=C(CN1C(=O)[C@@H]2[C@@H](C1=O)[C@H]1C=C[C@H]2C1)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1	748523603	XCSICYATNKUSNH-CHPZLBCBSA-N	443.403	1.230	50	20	IDGD	
CCN1CCN(c2ccc(F)cc2[C@H](C)NC(=O)NNC(=O)[C@H](C)OCCOC)CC1	748628024	PCJPZICSFJSFQU-HOTGVXAUSA-N	439.532	1.411	50	20	IDGD	
Cn1cc(S(=O)(=O)N2CCOCC2)cc1C(=O)NNc1ccc([N+](=O)[O-])cc1Cl	748726606	KLENSAUCUCHXIC-UHFFFAOYSA-N	443.869	1.365	50	20	IDGD	
C[C@@H]1CCC2=S=C(C(=O)NNC(=O)c3ccc(N4CCCS4(=O)=O)cc3)C=C2C1	751443142	SJWKCLHERNHVAY-CYBMUJFWSA-N	433.555	1.826	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)C[C@H]3CSCCS3)cc2)CC1	752143123	AGUSELAACKUXHL-HNNXBMFYSA-N	430.621	1.305	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)c1cc(S(N)(=O)=O)cc(Cl)c1F	752253080	BBUYQBCLPAGJOT-MRVPVSSYSA-N	433.820	1.494	50	20	IDGD	
COc1cc(OC)cc(N2C[C@@H](C(=O)NNC(=O)[C@@H](C)Oc3ccccc3F)CC2=O)c1	752270984	NFLYUAXWPIDADQ-KGLIPLIRSA-N	445.447	1.811	50	20	IDGD	
O=C(COC(=O)Cc1cccc(C(F)(F)F)c1)NNC(=O)[C@@H]1COc2ccccc2O1	752882856	JDMDDGYLPHTXDV-INIZCTEOSA-N	438.358	1.779	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)Nc1cccc(S(=O)(=O)N2CCOCC2)c1	755354281	OSQUHNRZJWCVMD-UHFFFAOYSA-N	436.465	1.242	50	20	IDGD	
C[C@H](C(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)[C@@H](C)NC(=O)OC(C)(C)C	755365725	BLCSZFSFOPNYDL-NWDGAFQWSA-N	428.511	1.792	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)c2coc(S(=O)(=O)N(C)C)c2)cc1	755409370	GPGGTDKEUMDRSD-LBPRGKRZSA-N	425.463	1.157	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)Nc2ccc(-n3cnnn3)cc2)c2ccccc2c1=O	755435274	NYFAJTRJFAVEQV-UHFFFAOYSA-N	447.459	1.639	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NN=Cc2cnc(N3CCOCC3)s2)ccc1Cl	755552908	RBGNSRUDPUVWOF-UHFFFAOYSA-N	429.911	1.044	50	20	IDGD	
COC(=O)CCNC(=O)c1ccc(NC(=O)NNC(=O)COc2ccc(C#N)cc2)cc1	755604066	ODYBYSPDTMWRRT-UHFFFAOYSA-N	439.428	1.083	50	20	IDGD	
COCCOC(=O)Nc1cccc(NC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1	756221858	SOGPFBLUGJIMMY-KRWDZBQOSA-N	430.417	1.874	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)Cc2ccccc2F)cc1S(=O)(=O)NC1CC1	756684994	ZXXLUFXAFZUHME-UHFFFAOYSA-N	436.465	1.670	50	20	IDGD	
CC(C)(C)OC(=O)NCC(C)(C)C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	756901609	PKGLUXXQHSEYNX-UHFFFAOYSA-N	447.580	1.897	50	20	IDGD	
Cc1nn(-c2ccc(C(F)(F)F)cn2)c(C)c1CC(=O)NNc1ccc(C(N)=O)nn1	757391227	DAXNBSIWHJINOB-UHFFFAOYSA-N	434.382	1.478	50	20	IDGD	
NC(=O)c1ccc(NNC(=O)c2cnn(-c3ncccc3Cl)c2C(F)(F)Cl)nn1	757406486	BXSBXSWVQKYBFN-UHFFFAOYSA-N	443.201	1.855	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)Nc2ccc(C)c(S(=O)(=O)NC3CC3)c2)c1	757873689	JXZIIHBZBOBZOM-UHFFFAOYSA-N	432.502	1.976	50	20	IDGD	
CCS(=O)(=O)NCC(=O)NNC(=O)c1ccc(CSc2nc(C)cc(C)n2)cc1	758216131	NFCNRNWUZMSEFZ-UHFFFAOYSA-N	437.547	1.086	50	20	IDGD	
CSc1ncc(Cl)c(C(=O)N2CCN(S(=O)(=O)CBr)CC2)n1	758522079	DKOKFDNZKYKPDO-UHFFFAOYSA-N	429.749	1.292	50	20	IDGD	
C[C@H]1CN(Cc2ccc(CNC(=O)NNC(=O)C(=O)Nc3ccccn3)cc2)C[C@@H](C)O1	758687735	RDHPSDWJZXVOTF-IYBDPMFKSA-N	440.504	1.160	50	20	IDGD	
O=C(COC(=O)c1ccc(I)c(O)c1)NNC(=O)c1ccccc1	760815242	CRQLJZRSVBLJRC-UHFFFAOYSA-N	440.193	1.615	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)/C=C/c1ccccc1)C(=O)NNc1ncc(F)cn1	760921237	UBDYFZGVFTYERT-HQPKTYMTSA-N	425.511	1.771	50	20	IDGD	
O=C(NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1)c1cc2n(n1)CCCO2	761422296	VDQPWTNUNQEJOD-UHFFFAOYSA-N	447.498	1.603	50	20	IDGD	
O=C(NNc1nccc(N2CCOCC2)n1)c1ccc(F)cc1I	762856690	WHJUWMGROGMIMJ-UHFFFAOYSA-N	443.220	1.814	50	20	IDGD	
CCOC(=O)c1cnn2c(C(=O)NNC(=O)CCSc3ccc(F)cc3)ccnc12	763460821	SPCKPPDVWZHWNN-UHFFFAOYSA-N	431.449	1.989	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)N[C@H]1CCN(c2ccc(Cl)c(F)c2)C1	763487207	ZOPNCUCYYRSDFG-NSHDSACASA-N	439.900	1.880	50	20	IDGD	
Cc1ccc(C(=O)N2C[C@H](C)C[C@@H](C)C2)cc1NC(=O)C(=O)NNC(=O)c1cccnc1	763490687	BHZYCDXPHHLTLW-HUUCEWRRSA-N	437.500	1.908	50	20	IDGD	
O=C(NNC(=O)c1ccccc1O)C(=O)Nc1ccc(OCC(F)(F)C(F)F)nc1	763528796	AUTZBTHYAMMNDY-UHFFFAOYSA-N	430.314	1.466	50	20	IDGD	
CCN(CC)C(=O)c1ccccc1NC(=O)C(=O)NNC(=O)COc1cc(C)cc(C)c1	763644384	IYPWPQLJGMJWIH-UHFFFAOYSA-N	440.500	1.950	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(C)cc2Br)cc1	763662437	WETREIKJOMSPHT-UHFFFAOYSA-N	436.262	1.931	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)C(=O)Nc1ccc(OC[C@@H]2CCCO2)cc1	763681114	ZOIVWSVPLIQLPY-INIZCTEOSA-N	431.420	1.548	50	20	IDGD	
Cc1ccc(NC(=O)C(C)C)cc1NC(=O)C(=O)NNC(=O)COc1ccccc1F	763681247	NXNXLYLPNYBOLS-UHFFFAOYSA-N	430.436	1.894	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(S(C)(=O)=O)cc1C	763711412	JKSFFKZGHZCJIR-UHFFFAOYSA-N	433.486	1.126	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c2cccnc2c1C	763785022	AXRSYKWZEOOIES-UHFFFAOYSA-N	444.451	1.498	50	20	IDGD	
Cc1coc(-c2cccc(NC(=O)C(=O)NNC(=O)COc3ccccc3[N+](=O)[O-])c2)n1	763803825	OHKYJQMZZRSQFH-UHFFFAOYSA-N	439.384	1.723	50	20	IDGD	
COC(=O)NCc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)cc1	763873099	QSVALKPAOPRLOV-LBPRGKRZSA-N	432.408	1.235	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(C#N)c(Cl)c2)cc1	763878718	TTZMYELNZWABGS-GFCCVEGCSA-N	428.832	1.968	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1	764004327	CXNRYKLQZHRPQJ-UHFFFAOYSA-N	444.629	1.749	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1ccc(S(C)(=O)=O)cc1	764011854	KSVILIXICYFUGC-UHFFFAOYSA-N	425.850	1.152	50	20	IDGD	
C[C@@H]1Oc2ccc(NC(=O)C(=O)NNC(=O)c3cc(-c4ccccc4)on3)cc2NC1=O	764016106	GTNBSIDBKKMLIY-NSHDSACASA-N	435.396	1.461	50	20	IDGD	
CC1(C)CN(C(=O)C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c2cccc(Cl)c21	764077033	GRAUBFYRJQRRHN-UHFFFAOYSA-N	449.916	1.829	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(CC(=O)N(C)C)cc2)o1	764138916	LZHYKAKRQZAREZ-UHFFFAOYSA-N	443.504	1.152	50	20	IDGD	
CCc1cc(O)nc(-c2cccc(NC(=O)C(=O)NNC(=O)[C@@H]3Cc4ccccc4O3)c2)n1	764166594	DLKGTAQFGIMZMV-SFHVURJKSA-N	447.451	1.501	50	20	IDGD	
CN(C)C1CCN(c2ccc(NC(=O)C(=O)NNC(=O)CCc3ccccc3)cc2)CC1	764193061	XADXHLLIKLRLLT-UHFFFAOYSA-N	437.544	1.936	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(C#N)c2)cc1OCc1cccnc1	764235958	UIRLQSIOUYJKCL-UHFFFAOYSA-N	445.435	1.941	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)c2c[nH]nc2C)sc2c1CCSC2	764294752	AOUXRIQYIOESKU-UHFFFAOYSA-N	437.503	1.145	50	20	IDGD	
CN1CCN(Cc2cccc(NC(=O)C(=O)NNC(=O)c3cc4ccccc4o3)c2)CC1	764331084	PDFQTQGLIAWYIE-UHFFFAOYSA-N	435.484	1.580	50	20	IDGD	
CNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)cc1Cl	764382937	SUZSNHNQEHBQNN-UHFFFAOYSA-N	446.876	1.551	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cnn(CC(F)(F)F)c3)n[nH]2)cc1	764384468	ASKUAZYJQIXCCS-UHFFFAOYSA-N	449.393	1.798	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1ccccc1Nc1c(F)cccc1F	764398036	BZUBBVKZOLMFBQ-GFCCVEGCSA-N	436.415	1.846	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)NCc1ccccc1CN1CCC(O)CC1	764425271	UHGKAFRGVMBWCA-UHFFFAOYSA-N	444.557	1.972	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2cccc3nonc23)cc1Br	765081313	PAMKFEXUVYMDDB-UHFFFAOYSA-N	427.236	1.617	50	20	IDGD	
NC(=O)COc1ccc(Cl)cc1S(=O)(=O)NNC(=O)c1cccc2cccnc12	766319929	FGIBVMJLAXGJTL-UHFFFAOYSA-N	434.861	1.376	50	20	IDGD	
C[C@H]1C(=NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)CC(=O)N1C(=O)OC(C)(C)C	766432302	JTJFHYMRONICSO-VIFPVBQESA-N	444.897	1.629	50	20	IDGD	
CCOC1CC(CNC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)(N2CCOCC2)C1	767815002	NRJUTROOXZHCKW-UHFFFAOYSA-N	442.520	1.086	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1ccc(C#N)cc1)C(=O)NNC(=O)Cc1ccc2ccccc2c1	767882139	QMWSJHZQJNMDLA-OAHLLOKOSA-N	436.493	1.768	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)[C@@H](C)OC[C@H]3CCCCO3)n[nH]2)cc1OC	768275715	DUOHVHWGDHIGPX-UKRRQHHQSA-N	432.477	1.829	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)N[C@H]1CC(=O)N(Cc2ccccc2C(F)(F)F)C1	768519496	VADMYALOXBCGAK-OCCSQVGLSA-N	446.426	1.188	50	20	IDGD	
N#Cc1cc(Cl)nc(NNC(=O)[C@@H]2CCCN2C(=O)/C=C/c2ccc(C(N)=O)cc2)c1	768707263	KTQUOMSSKYXNCX-WHWKNOJMSA-N	438.875	1.853	50	20	IDGD	
C[C@H](O)CNC(=O)/C(C#N)=C/c1cn(CCC(N)=O)nc1-c1ccc(Br)cc1	769083091	NCIPFPMHZKVUOX-ACLQVGRQSA-N	446.305	1.592	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(F)(F)c2ccc(OCC(=O)N(C)C)cc2)cc1	769358171	YTYZGJDZJKGUFB-UHFFFAOYSA-N	435.427	1.780	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2coc(C3CCOCC3)n2)c2ccccc2c1=O	769674732	AXPKKJQQSHXRFD-UHFFFAOYSA-N	425.445	1.763	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(N2CCOCC2)c(NC(=O)NNc2cccc(C#N)c2)c1	770077955	YCKIJSQDXWYQEU-UHFFFAOYSA-N	444.517	1.794	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)NCCSCC(F)(F)F	770288826	PIQIETJWWSVVQI-UHFFFAOYSA-N	433.500	1.825	50	20	IDGD	
CC(=NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)c1cnccc1C	771555630	OBAZZXBMBBHSPU-UHFFFAOYSA-N	430.530	1.884	50	20	IDGD	
CCOC(=O)CON=C(C(=O)NNc1ccc(Br)c(F)c1)c1cc[nH]n1	772568068	QNAGNKFCMOFZJX-UHFFFAOYSA-N	428.218	1.738	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H]1CCC[C@@H]1C(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772888875	NIQONUYYEHCROE-GJZGRUSLSA-N	438.912	1.797	50	20	IDGD	
CCS(=O)(=O)c1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)c1ccc(C)c(F)c1	773888106	GMXGAUUYYCBEMQ-UHFFFAOYSA-N	441.868	1.981	50	20	IDGD	
Cc1cc(N2CCC[C@@H](NC(=O)NNC(=O)C(=O)Nc3ccc(C)c(C)c3)C2)n(C)n1	775139083	UMOBDKMVYQEBKA-QGZVFWFLSA-N	427.509	1.283	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CN(CC(C)C)c2c(O)nc(=O)n(CC(C)C)c2N)c1	777606219	MWEVONPTWKGTTF-UHFFFAOYSA-N	444.536	1.419	50	20	IDGD	
COC(=O)Cc1cccc(C(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)c1	777812009	BLWYOGNFTLMUCI-UHFFFAOYSA-N	438.528	1.289	50	20	IDGD	
COc1ccc(N2CCN(C(=O)/C=C\C(=O)NNC(=O)NC3CCCCC3)CC2)cc1	778217874	LLLPACRROKQKBQ-QXMHVHEDSA-N	429.521	1.563	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)nc1C	778425847	GQUYEMKLHBFSKP-UHFFFAOYSA-N	435.506	1.653	50	20	IDGD	
C[C@H](NS(=O)(=O)c1ccc(C(N)=O)cc1)C(=O)NNc1ccccc1OC(F)(F)F	779203814	KMQXSDPZYHAQMJ-JTQLQIEISA-N	446.407	1.494	50	20	IDGD	
CC1(C)C[C@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)C(C)(C)O1	779385909	WZNXHTQTLMMRIR-INIZCTEOSA-N	438.550	1.761	50	20	IDGD	
COc1cccc(NNC(=O)[C@H]2CCCN(S(=O)(=O)c3ccc([N+](=O)[O-])cc3)C2)n1	780770556	KKRMOSIQXGITBD-ZDUSSCGKSA-N	435.462	1.542	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)CN2C(=O)N[C@@](C)(c3ccc(OC)cc3)C2=O)c1	780793249	VKTAILYJFATLSR-NRFANRHFSA-N	426.429	1.392	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)CCCN(C)C2=NS(=O)(=O)c3ccccc32)c1	780796005	IPWXDQQHABLEBI-UHFFFAOYSA-N	430.486	1.777	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)[C@@H]1CCCOC1	780859831	LDRVCKHQODLRTE-DOTOQJQBSA-N	438.550	1.620	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)N[C@@H]1CCCN(c2ccc(C#N)cc2)C1=O	780893994	IHYJWMCAVJXLPT-KBXCAEBGSA-N	439.447	1.991	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)C(=O)Nc1cccc2ccsc12	782896572	KJXXYHVGTOZTIS-UHFFFAOYSA-N	445.526	1.903	50	20	IDGD	
Cc1ccc(S(C)(=O)=O)cc1NC(=O)C(=O)NNc1ccc(Br)cn1	784338530	AWXKBLULOINKCW-UHFFFAOYSA-N	427.280	1.638	50	20	IDGD	
CN(C)c1ccc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)NC(C)(C)C)cc1	784834248	ZANVGSSIYLYXBJ-UHFFFAOYSA-N	433.534	1.911	50	20	IDGD	
COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)C(F)F)cc1	784834980	FJWXUHHBACAZRM-UHFFFAOYSA-N	444.372	1.682	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)cc1OC(C)C	785024248	VEPIVUPJGVQYAI-UHFFFAOYSA-N	432.389	1.496	50	20	IDGD	
CNS(=O)(=O)CCNC(=O)C(=O)Nc1ccccc1S[C@H](Cl)C(F)(F)F	786002660	JLHRITOYJJNNHP-LBPRGKRZSA-N	433.861	1.510	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)[C@@H](CC(N)=O)NC(=O)c2ccccc2Cl)c1	786087182	SRFBYYOFBDHFFO-MRXNPFEDSA-N	446.891	1.157	50	20	IDGD	
CCOC(=O)c1cnn(C)c1NC(=O)C(=O)NNC(=O)CCSc1ccc(F)cc1	786413548	BRTAZFQNZLIMIE-UHFFFAOYSA-N	437.453	1.004	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(C(F)(F)F)n2)cc1OC	786415085	WCTYXBKYIOJDGG-UHFFFAOYSA-N	426.351	1.907	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)N2CCN(C(=O)COC(=O)/C(C#N)=C\C3CC3)CC2)cc1	786680934	OWBJODJAPCPMQG-PDGQHHTCSA-N	445.497	1.125	50	20	IDGD	
CC(C)(C(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1)N1CCOCC1	788265206	KZWSNAIUSOFCMK-UHFFFAOYSA-N	449.515	1.260	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NC[C@H](c2ccnn2C)C(C)C)nc1	788321306	VMUYSZXYWUPNIE-INIZCTEOSA-N	437.570	1.912	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)c2cccc(NN3C(=O)[C@@H]4CC=CC[C@H]4C3=O)c2)n1	788631454	XBJLCVDGVRCTGQ-QZTJIDSGSA-N	436.472	1.239	50	20	IDGD	
Cc1cccc(S(=O)(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)c1C#N	788915934	NCTNJFCAHLXOAT-UHFFFAOYSA-N	437.522	1.665	50	20	IDGD	
Cc1ccc(CN2CC[C@H](NC(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)C2=O)cc1	791076504	VOGQJCVYPAQJKU-KRWDZBQOSA-N	447.536	1.731	50	20	IDGD	
CN(C)c1cc(F)c(C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)cc1[N+](=O)[O-]	791218383	DWUGUJAPZLSYHU-UHFFFAOYSA-N	437.453	1.998	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)NC[C@H](C)NC(=O)OC(C)(C)C)c2ccccc2c1=O	792255907	GMVKRICOSFQWBZ-ZDUSSCGKSA-N	446.508	1.835	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)cc(-n2cccn2)c1	792356451	QLIUZZXMQQBTHJ-UHFFFAOYSA-N	432.440	1.622	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)[C@](C)(O)CN3C(=O)NC4(CCCC4)C3=O)cc2C1	792828774	XOVVFONBBJJXFV-MPBGBICISA-N	448.545	1.250	50	20	IDGD	
C[C@@](O)(CN1C(=O)NC2(CCCC2)C1=O)C(=O)NNc1cc(C(F)(F)F)ccc1F	793733646	VHFFEGUKBSHTLO-MRXNPFEDSA-N	432.374	1.903	50	20	IDGD	
CCCC[C@H](/N=C1/NS(=O)(=O)c2ccccc21)C(=O)NNC(=O)c1cccc(C)n1	794076319	XEFONWRDTAHDON-INIZCTEOSA-N	429.502	1.449	50	20	IDGD	
O=C(Cc1ccsc1)NNC(=O)C(=O)Nc1ccc(Cl)c(CN2CCOCC2)c1	797534919	GTGBASAPEHAHCM-UHFFFAOYSA-N	436.921	1.562	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(=O)n(C)c(S)nc3c2)cc1C	798309395	MGTNOSLMPHXONT-UHFFFAOYSA-N	425.470	1.239	50	20	IDGD	
CN(C)Cc1cc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)ccc1Cl	799259368	UXBVFPBDQFNZNG-UHFFFAOYSA-N	440.891	1.987	50	20	IDGD	
CN(C)S(=O)(=O)c1c[nH]c(C(=O)NNc2cc([N+](=O)[O-])ccc2Br)c1	800616410	LGCCPVUJSQYIRP-UHFFFAOYSA-N	432.256	1.693	50	20	IDGD	
CC(=O)N1CCN(S(=O)(=O)c2cc(C(=O)NNc3ncccc3C)ccc2F)CC1	801227199	HAYKJFKAIXXACA-UHFFFAOYSA-N	435.481	1.139	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)N[C@H]2CCN(C(=O)Nc3ccccc3)C2)nc2ccccc21	802499617	DZNHNPGYVAHIJF-INIZCTEOSA-N	435.488	1.753	50	20	IDGD	
C[C@@H](C#N)S(=O)(=O)c1ccc(NC(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1	806456850	XYWQOFQKBMKLOX-LBPRGKRZSA-N	430.442	1.610	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)Nc1cc(F)c(F)cc1N1CCOCC1	806712338	VCVWIVFKKHOTFK-GOSISDBHSA-N	434.399	1.794	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)C(=O)Nc1ccc2nccnc2c1Br	806978622	BXTTZZWHOQOLNU-UHFFFAOYSA-N	429.234	1.495	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1cccc(Cl)c1OCC(F)F	806979145	TVELNMHUURHGCP-UHFFFAOYSA-N	443.790	1.854	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc2[nH]ccc12	808934435	FJUVUXNQEMNJPJ-UHFFFAOYSA-N	438.396	1.125	50	20	IDGD	
COC(=O)c1c(F)ccc(NC(=O)C(=O)NNC(=O)c2cn(C)c3ccccc23)c1C	810384965	SQORBICQRVZPIY-UHFFFAOYSA-N	426.404	1.812	50	20	IDGD	
CCc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccc(C(C)=O)cc1	810386194	PRIPIRKPVUUPRZ-ZDUSSCGKSA-N	442.428	1.913	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)[C@@H](c2ccccc2)N2CCC(O)CC2)cc1	812729413	LPEFKFWUGVCREL-HXUWFJFHSA-N	432.546	1.578	50	20	IDGD	
Cc1cc(C(F)(F)F)ncc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	813033293	MOANNCWDPYPDEA-UHFFFAOYSA-N	445.423	1.741	50	20	IDGD	
COc1ccc(Cl)cc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	813033531	XXCDOAFLSBMNDE-UHFFFAOYSA-N	426.882	1.681	50	20	IDGD	
Cc1cccc(C=NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1O	814710418	NQEUHIDJVYZCFV-UHFFFAOYSA-N	431.514	1.804	50	20	IDGD	
CCOC(=O)c1cc(COC)cc(NC(=O)C(=O)NNC(=O)c2c[nH]c3ccccc23)c1	815563408	BDOZAPFCZAVRIK-UHFFFAOYSA-N	438.440	1.891	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2C(=O)[C@H]3CC=CC[C@H]3C2=O)cc1Br	815564668	PFUULFVCPHZZCK-TXEJJXNPSA-N	436.262	1.170	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)C(=O)Nc1nc(C(C)(C)C(=O)OC)cs1)c1ccccc1	815570140	SOFUZEDJOLPEHV-CYBMUJFWSA-N	432.502	1.873	50	20	IDGD	
O=C(NNc1cccc(Cl)n1)C(=O)Nc1ccc(F)c(S(=O)(=O)NC2CC2)c1	815729079	GTAYCVLGVIILBJ-UHFFFAOYSA-N	427.845	1.397	50	20	IDGD	
Cc1csc2ncc(C(=O)NNC(=O)[C@H]3CCCN(C(=O)OC(C)(C)C)C3)c(=O)n12	816511001	LRQWIVKBEGGFGF-LBPRGKRZSA-N	435.506	1.473	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(Br)c(C(=O)NNC(=O)CC(C)C)c1	849208576	DLSHPEAZPAFXCY-UHFFFAOYSA-N	436.328	1.181	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)CCCOc2ccc(F)cc2)cc1	871209537	UCTNEUXIOOTNGZ-UHFFFAOYSA-N	437.493	1.761	50	20	IDGD	
CC(=O)c1cccc(S(=O)(=O)NCC(=O)NNC(=O)c2cc3c(s2)CC[C@H](C)C3)c1	913162461	NPNGJXDHLHLWHA-LBPRGKRZSA-N	449.554	1.815	50	20	IDGD	
COc1ccc(/C=C(/C#N)C(=O)O[C@H](C(=O)N[C@@]2(C)CCS(=O)(=O)C2)C(C)C)cc1	913229081	FJZPVSNOHXFDJA-IQAAACGOSA-N	434.514	1.863	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1cc(C(=O)NNC(=O)COc2ccc(C#N)cc2)ccc1F	914602385	GNUBUDJJFJYXHI-UHFFFAOYSA-N	448.476	1.614	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2nnn(-c3ccc(OC)cc3)c2C)c2ccccc2c1=O	915058214	DGEVHEOEUYAROL-UHFFFAOYSA-N	447.455	1.389	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NC2CCN(C(C)C)CC2)c1	915896811	CHLQFXSWISWZGP-UHFFFAOYSA-N	439.582	1.534	50	20	IDGD	
O=C(NCCN1CCN(Cc2ccccc2)CC1)NNC(=O)c1ccc2ccccc2n1	915901946	OVEUHUVOBRSIPU-UHFFFAOYSA-N	432.528	1.997	50	20	IDGD	
O=C1Nc2cc(O)ccc2C1=NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	915934971	IDRUFHNGWFWCJB-UHFFFAOYSA-N	428.470	1.653	50	20	IDGD	
Cn1ccnc1[C@@](O)(CCNC(=O)NNC(=O)Cc1ccc(Cl)cc1)C(F)(F)F	916377702	FCSCUDOLYZPDOY-INIZCTEOSA-N	433.818	1.787	50	20	IDGD	
O=C(Cc1ccc2c(c1)CCC2)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	916556235	MKNBFFXAOUEBKT-UHFFFAOYSA-N	443.525	1.200	50	20	IDGD	
O=C(CN1CCC[C@H](C(=O)Nc2ccccn2)C1)NNC(=O)c1ccc([N+](=O)[O-])cc1	917397873	WRZNQTHLHDMJQS-HNNXBMFYSA-N	426.433	1.102	50	20	IDGD	
CN(CC(=O)NNC(=O)Cn1cnc2ccccc21)C(=O)c1ccc(Br)o1	917912150	SONVJNZMXYSARY-UHFFFAOYSA-N	434.250	1.311	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)c2ccc(F)c(S(=O)(=O)N(C)C)c2)c1C	918673944	RYWPCUFAYJVPPJ-AWEZNQCLSA-N	437.493	1.921	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)c1cc(-c2ccco2)nc2c(C(N)=O)ncn12	919743528	UYDKFUZZUKWUEY-UHFFFAOYSA-N	448.439	1.491	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)c2nc3ncc(Br)cn3n2)c1C	919808717	GEUXMFIXMIBJGI-NSHDSACASA-N	433.266	1.732	50	20	IDGD	
Cc1c(C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)oc2ccc(Br)cc12	919885011	MFXFJVXPUYRRQW-JTQLQIEISA-N	430.280	1.635	50	20	IDGD	
O=C(NNC(=O)c1nc(-c2ccccc2)n2c1CCCCC2)N[C@H]1CCS(=O)(=O)C1	919885290	KTZFVSWIPXDTJJ-HNNXBMFYSA-N	431.518	1.408	50	20	IDGD	
CC(C)n1ncc2c(C(=O)NNC(=O)N[C@H]3CCS(=O)(=O)C3)cc(-c3ccco3)nc21	919888541	FSZHYJXZMYSQQG-LBPRGKRZSA-N	446.489	1.403	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)c2ccc3c(c2)C[C@H](C)N3S(C)(=O)=O)o1	920248418	FKVDKKMVAQAQCV-AWEZNQCLSA-N	448.545	1.907	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1n[nH]c(-c2ccccc2)c1Br	920851720	KTIQNKDFUAWQLI-SNVBAGLBSA-N	427.280	1.035	50	20	IDGD	
Cc1ccc(S(=O)(=O)NNC(=O)NCc2cccc(C(F)(F)F)c2)cc1C(N)=O	921297943	JPYQALBWQBRQPZ-UHFFFAOYSA-N	430.408	1.805	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Cc2ccccc2NS(C)(=O)=O)ccc1OC(C)C	1116032940	SNFHNYKDOGELFF-UHFFFAOYSA-N	435.502	1.858	50	20	IDGD	
CCOC(=O)c1cc(S(=O)(=O)NNC(=O)c2cncn2-c2ccccc2)ccc1C	1322049236	OPQQCRYAKMECPP-UHFFFAOYSA-N	428.470	1.981	50	20	IDGD	
C[C@H](O)CNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2ccc3ccccc3c2)cc1	1337093306	DDAZDEMVSOPTIB-AWEZNQCLSA-N	427.482	1.574	50	20	IDGD	
C[C@@H]1CCCN(C(=O)CCNC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)C1	1340418542	WDXGKEYRGGZCPR-CYBMUJFWSA-N	425.511	1.074	50	20	IDGD	
O=C(c1ccc2nonc2c1)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1777718648	CZIBULUXJJCSBJ-BBRMVZONSA-N	427.230	1.357	50	20	IDGD	
O=C(c1ccc2c(c1)COC2)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1777914549	HXUACLIBHOSLEQ-QAPCUYQASA-N	427.270	1.851	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc4ncccn4n3)C2)C1	1778464923	BYNMHMRIMMHXMK-MSOLQXFVSA-N	426.304	1.409	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cccc3c2cnn3C)C1	1778715420	SMOIZDRYDRIIOD-SFGWALBWSA-N	448.951	1.955	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccnc(Br)c3)C2)C1	1779401797	ADMUYVRVEARWQS-DYVFJYSZSA-N	446.729	1.541	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H]2CC[C@@H]3CCC(=O)N3C2)C1	1780609497	IFGOZXAMWLCJSL-GKICUZSHSA-N	439.984	1.919	50	20	IDGD	
COc1cc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)ccc1O	1780751413	YGVCSCUJHBZPBV-RHSMWYFYSA-N	431.258	1.535	50	20	IDGD	
O=C(c1cccc2c1OCCO2)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781329611	HWPGPAMPEZYDOD-YJBOKZPZSA-N	443.269	1.592	50	20	IDGD	
O=C(c1cc2n(n1)CCCC2)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781331280	HTODIWKGCGMOBL-WMLDXEAASA-N	429.290	1.353	50	20	IDGD	
O=C1CCc2ccc(C(=O)N3CCO[C@@]4(CCN(C(=O)[C@H](F)Br)C4)C3)cc21	1781332544	IBQCYBDHYUHSEW-QFBILLFUSA-N	439.281	1.950	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H]1[C@H]3COC[C@H]31)C2	1781903808	DTOUSCSMTWSIJG-ROMBUNGYSA-N	429.355	1.566	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccnc(OC)c1F)C2	1782170807	ZCAHSMMWMHVDEY-BXTJHSDWSA-N	443.903	1.611	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)COc1cccnc1)C2	1782171773	DZWAETSKPDEYMZ-SQGPQFPESA-N	425.913	1.228	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccc4nncn4c3)CCO2)C1	1783349539	MXQLPAWFAXLAEL-RDTXWAMCSA-N	436.310	1.346	50	20	IDGD	
COc1ccc(CC(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](C)Br)C3)C2)cc1O	1783529319	UFWKOFCZMNFDDH-DJJJIMSYSA-N	441.322	1.557	50	20	IDGD	
Cc1cc(C)n(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]3C2)n1	1783968648	DWPNUQWWKKBVGZ-ZCPGHIKRSA-N	441.370	1.511	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)ccc3O)C[C@@H]21	1783972000	HOCVPDQICVKHMY-LMMLAZSQSA-N	441.322	1.722	50	20	IDGD	
CC(C)N1CCC[C@H]1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2	1784801844	ZKUHKKASGDBEIX-TXPKVOOTSA-N	430.387	1.720	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3c[nH]c4nccc-4c3)[C@H]2C1	1787332797	VFLKHOIYWZNMDV-MZGVZZPPSA-N	435.322	1.891	50	20	IDGD	
Cn1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](O)CCl)C[C@@H]32)c(C(F)(F)F)c1	1787711106	RVFXPSOZVRLMCN-AZHAFVHUSA-N	437.846	1.237	50	20	IDGD	
CC1=CC[C@H](C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)CC1	1788103607	XSWVUAYDNGRFQL-FVCZOJIISA-N	441.532	1.025	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Cl)C[C@@H]32)C1	1788180749	JUQRQOQRTJQTQQ-UVPYHEFZSA-N	447.935	1.758	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cn4cccnc4n3)[C@H]2C1	1788311244	OZPDNBCWQVESTJ-NGOJXBLDSA-N	440.331	1.559	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc4c3NC(=O)C4)[C@H]2C1	1790449175	PSMLGFUHGSMYDB-SZMVWBNQSA-N	445.592	1.626	50	20	IDGD	
C[C@H](Br)C(=O)Nc1ccc(C2(NC(=O)[C@H](O)N3CCOCC3)CCC2)cc1	1791435057	PPUOXFDEERNRNY-UGSOOPFHSA-N	440.338	1.555	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccnc1S	1792499970	USGQKXSHACIULD-NRWUCQMLSA-N	428.352	1.605	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccnc1Cl)C2	1792866966	PFLIDIVKJKSNNE-NRWUCQMLSA-N	430.730	1.969	50	20	IDGD	
Cc1n[nH]c(C)c1CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)CBr	1792873610	FMMPXWLKSWNPJW-MJRMRKOOSA-N	427.343	1.190	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3ccc(Cl)cc3nn1)C2)[C@@H](O)CCl	1792978521	YFUJHPSMNRQSLQ-LZDSYCOUSA-N	439.299	1.086	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](CCO)NC(=O)OC(C)(C)C	1793250844	HYSBJRXNSQOBKJ-XFIYOXNOSA-N	431.961	1.918	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C[C@H]1COc2ccccc2O1	1793269137	JGSCTOSQOBAUSI-MRNSRZSKSA-N	438.908	1.060	50	20	IDGD	
CCOC(=O)c1c(CCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](O)CCl)C3)c[nH]c1C	1793293493	UELLQSMFTURQCV-YVSFHVDLSA-N	439.940	1.670	50	20	IDGD	
COC(OC)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1793357492	UEVOXUPBQFQQTG-CRWXNKLISA-N	433.933	1.376	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1(C)CC1	1795011866	BSGVGXKVTIBMDD-ZSBFGKGUSA-N	431.445	1.523	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCS(=O)(=O)c1ccccc1	1795301156	WLAGFBVAQRTQLU-HIRMHNASSA-N	442.965	1.457	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1n[nH]c2c1CC[C@@H]2C	1796973962	QTWQAWWRSBNGIT-YLLRLKMBSA-N	439.354	1.836	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc2c(c1)OCCO2	1797313240	WVORCEUKMUILSO-BJWYYQGGSA-N	430.505	1.083	50	20	IDGD	
Cc1cc2nnc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)[C@@H](C)Br)C4)c(C)n2n1	1797441288	XZLKVPJYIMZXBF-RUZUBIRVSA-N	435.326	1.776	50	20	IDGD	
CC(=O)O[C@@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)CBr)C2)C(C)C	1797589606	AHKHIPWUQUNPCX-HVQZGBDUSA-N	433.343	1.195	50	20	IDGD	
Cc1cccc2c(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@H](F)Br)n[nH]c12	1799347275	OHCWCDRORPFUPR-VAECKANCSA-N	439.285	1.765	50	20	IDGD	
C[C@@H](Cc1ccccn1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Br	1799351842	COVZHDATHUZRDH-PLPKTUSISA-N	428.302	1.540	50	20	IDGD	
CO[C@H](C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN(C)NC(=O)NCc1ccccc1	1799869680	WJYWHZVPUBQMMC-OQIJWPOYSA-N	431.537	1.006	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1n[nH]c(C3CC3)c1F)C2	1800639196	JZZVUJAXQARHNS-OPDFLTKYSA-N	443.317	1.803	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccnc(Br)c1)C2	1800977062	QKSKQFNTRJETMG-QVHKTLOISA-N	446.729	1.301	50	20	IDGD	
COc1ccc(F)cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2	1801727960	HJLVNXUFIKVQCL-OWLDWWDNSA-N	433.249	1.728	50	20	IDGD	
COc1ccc(OCC(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)cc1	1802813008	XHXAXIUREYARIC-LDQXTDLNSA-N	447.919	1.775	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1CCN(C(=O)c2c[nH]c(=O)cn2)[C@H]1c1cccnc1	1803016462	XZBINXUKUVQCMX-IFIJOSMWSA-N	448.321	1.516	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cc3n(n2)CCCC3)[C@H]1c1cccnc1)[C@H](O)CCl	1803143180	WFXFMGROVGQVQW-IPELMVKDSA-N	431.924	1.534	50	20	IDGD	
C[C@H](CC(N)=O)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)CBr)[C@H]1c1cccnc1	1803664280	YIKDMWRKTWEWET-RMRKRWHISA-N	439.354	1.630	50	20	IDGD	
C[C@@H](C#N)c1cccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)c1	1803678448	BMBHVVHHZALYLZ-RWXMBLCBSA-N	431.301	1.559	50	20	IDGD	
CCS(=O)(=O)CC(=O)N1CCCC2(CCN(C(=O)[C@](C)(Cl)CCl)CC2)C1	1805969751	UJVIJFSJBCQGJX-MRXNPFEDSA-N	427.394	1.889	50	20	IDGD	
O=C(CCBr)NC[C@@H]1CCN(C(=O)CN2CCOC2=O)[C@H]1c1cccnc1	1806341888	HWJAUYALENAZRG-YOEHRIQHSA-N	439.310	1.325	50	20	IDGD	
COCCC(=O)NC[C@@H]1CCN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@H]1c1cccnc1	1806743055	WQTWICFVPBLKHY-QGJUGNDFSA-N	440.504	1.258	50	20	IDGD	
C[C@]1(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)CC=CCC1	1807368688	XCANPKAYKUFCMY-LFAGZIFBSA-N	447.344	1.827	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@H]1CCN(C(=O)c2c[nH]c(=O)cn2)[C@@H]1c1cccnc1	1808304580	INSWGCNTFGQLIN-NRXGSXMXSA-N	438.315	1.721	50	20	IDGD	
COCCOCC(=O)N1CCCC2(CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CC2)C1	1809415847	QVPGZWCHHPITOJ-JJIBRWJFSA-N	447.536	1.015	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)c3cc4cnccc4[nH]3)CC2)C1	1809972421	OKSIUMRDFXHRLX-UHFFFAOYSA-N	446.316	1.401	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)[C@]3(F)CCCC=C3F)CC2)C1	1809977579	DGEKQGUKLQVXLB-QHCPKHFHSA-N	446.303	1.957	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)[C@@H](OC(C)=O)C(C)C)[C@@H]1c1cccnc1	1810108993	QLDYWFQXVUNYJX-XWSJACJDSA-N	439.940	1.929	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC2(CCCN(C(=O)c3cc(C(F)F)no3)C2)CC1	1810238953	LGHFWZAMVYITLW-UHFFFAOYSA-N	441.479	1.830	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)c2ccccc2)[C@H]1c1cccnc1	1810303558	VGIGOTGFQLGPTE-NQIIRXRSSA-N	444.495	1.714	50	20	IDGD	
C#CC(=O)N1CC[C@H](CNC(=O)c2cc([N+](=O)[O-])ccc2OC(C)=O)[C@H]1c1cccnc1	1811358840	KUHQBBOOTWQMEW-IIBYNOLFSA-N	436.424	1.868	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)c1cc(O)cc([N+](=O)[O-])c1	1811677509	VITTZZOTLNSNBF-KKXDTOCCSA-N	448.863	1.615	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2cccc(F)c2)[C@H]1c1cccnc1	1811807686	SGQNOTPWIOOPDR-XMSQKQJNSA-N	441.507	1.913	50	20	IDGD	
O=C1CC[C@H](C(=O)Nc2cc([C@H]3CCCCN3C(=O)[C@H](F)Br)[nH]n2)CN1	1814524133	BSSJRMIVRFSIAU-PXWWUCIGSA-N	430.278	1.619	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CSCC(=O)OC)n[nH]1	1815224207	CXJAKXITEXXWLW-WCQYABFASA-N	432.930	1.562	50	20	IDGD	
Cc1ccc(CC(=O)N[C@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)o1	1815347708	LLAFDCQOUIBZSB-HNNXBMFYSA-N	439.302	1.193	50	20	IDGD	
O=C(CC1CCOCC1)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1817164415	LIWKAKQWGFVVOJ-LJQANCHMSA-N	440.309	1.212	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)C2=CCCS2)[nH]n1)c1ccc(B(O)O)cc1	1817469772	DWYPMDHYCGBWKU-MRXNPFEDSA-N	426.307	1.416	50	20	IDGD	
COc1cccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)c1	1820515058	XWHBKOSUZGUWAB-HXUWFJFHSA-N	448.288	1.718	50	20	IDGD	
CC[C@@H](Br)C(=O)Nc1cc([C@H]2CCCCN2C(=O)C2=NNC(=O)C2)[nH]n1	1822085786	DXZWHCWOZAVFBL-BXKDBHETSA-N	425.287	1.451	50	20	IDGD	
C[C@H](Br)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](C)n2cnnn2)[nH]n1	1822192722	VWHJGVXFZVKCPM-JBLDHEPKSA-N	425.291	1.433	50	20	IDGD	
CCn1nc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)cc1C	1822414351	CCKUJTDTMHGHEE-KRWDZBQOSA-N	444.540	1.613	50	20	IDGD	
O=C1CC[C@H](C(=O)N2CCCC[C@H]2C2CCN(C(=O)[C@H](F)Br)CC2)CN1	1823842096	XUSOVXLVJLJRFJ-DZKIICNBSA-N	432.334	1.823	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCSC(=N)N)CC2	1825642975	XMCLNIDPCSJQRI-HTQZYQBOSA-N	434.385	1.855	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(O)nc2)CC1	1829722786	AQKDFENLQBUGTI-FQEVSTJZSA-N	437.305	1.014	50	20	IDGD	
C[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1)c1ccc(Cl)cc1	1830259680	XWMQJNJTIQWFFG-NQYLQCIDSA-N	445.343	1.500	50	20	IDGD	
Cc1c(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)nc2ccccn12	1830362576	ZCORUBUMAJOGQN-QFIPXVFZSA-N	448.951	1.978	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(CN(C(=O)COC3CCCCC3)CCO2)C1	1830378872	JTABZCIEEMRJFY-OAQYLSRUSA-N	442.629	1.644	50	20	IDGD	
C=CCOCCCC(=O)N1CCO[C@]2(COCCN(C(=O)CCBr)C2)C1	1831406379	KFZIMEBBKBUOOX-SFHVURJKSA-N	433.343	1.211	50	20	IDGD	
Cc1cccnc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1	1831835357	UUCYEJCZIARKCR-MOPGFXCFSA-N	430.332	1.696	50	20	IDGD	
CCc1cc(C(=O)N2CCC([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)no1	1831873102	AGWZFOVLHVMKAH-LJQANCHMSA-N	433.553	1.843	50	20	IDGD	
CC(C)(CCl)C(=O)NC1CCN(C2CCN(C(=O)[C@H](N)c3ccccn3)CC2)CC1	1833214124	DDOWBNXRLNGFHM-LJQANCHMSA-N	436.000	1.918	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)CS(=O)(=O)CC)CC2)CC1	1833530166	NNICEQLHPCTALH-KRWDZBQOSA-N	436.018	1.400	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)c1nc2ccccc2[nH]1	1835297054	TVCNKOQZGBWWSK-SFHVURJKSA-N	433.940	1.348	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3ccc(F)nc3)CC2)CC1	1835886886	YZNMTQZPXOKUDN-QGZVFWFLSA-N	426.920	1.660	50	20	IDGD	
COc1cnc(C(=O)N2CCC(OC3CCN(C(=O)C(Cl)Cl)CC3)CC2)cn1	1837572452	NZXWZOUSCPFCOF-UHFFFAOYSA-N	431.320	1.901	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3c[nH]c4cnccc34)C2)C1	1837713108	HRCBVLGWRGOUHS-NRFANRHFSA-N	446.580	1.484	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(F)cnc3Cl)CCO2)C1	1837859520	HMSLOSSQBSRWAV-KBXCAEBGSA-N	434.295	1.962	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3cnc4[nH]ccc4c3)C2)C1	1839148955	OVTJVIUOSJGKHN-XMSQKQJNSA-N	448.951	1.969	50	20	IDGD	
O=C(c1ccc(O)c(F)c1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839201811	KBXJNSQEZPVDOB-RHSMWYFYSA-N	449.248	1.292	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)nc2nccn12	1839546642	BATHBUOCSBCSES-OAQYLSRUSA-N	449.939	1.373	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccnc(F)c3)C2)C1	1839962918	VHYQNMWHJJGBBX-KDOFPFPSSA-N	444.301	1.464	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(F)n3)C2)C1	1839965185	PWKRLFYLTKAZNA-ACJLOTCBSA-N	444.301	1.464	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)C(Cl)Cl)CCO2)C1	1840187350	VAZAWNJCAXAFSH-IINYFYTJSA-N	432.142	1.278	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](CCO)C(=O)N1CCCC12CN(C(=O)CCBr)C2	1841430100	RFPZOOCUVRAQAY-CYBMUJFWSA-N	448.358	1.251	50	20	IDGD	
Cc1ocnc1C(=O)N1CC2(CCCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C1	1841924622	IGZPDFFIXHAWOI-ZDUSSCGKSA-N	426.901	1.932	50	20	IDGD	
O=C(c1ccccc1N1CCCCC1)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843014771	ZMUNGQWNOWUNPJ-UHFFFAOYSA-N	447.344	1.488	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1ccc(Cl)nc1)C2	1843415156	RBQIEAUWWPWEOE-ZMOGYAJESA-N	428.880	1.686	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)C1(c3ccc(O)cc3)CC1)C2	1843415255	DTNQMQUIFDLPNV-WGOQTCKBSA-N	449.511	1.761	50	20	IDGD	
Cn1c(=O)n(CC(=O)N2CC3(CCCN3C(=O)[C@@](C)(Cl)CCl)C2)c2ccccc21	1845170909	WFZSERQTLDCOTR-IBGZPJMESA-N	439.343	1.780	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2ccc(O)c(F)c2)C1	1845350486	XJVNOTPVCGJBCL-ZMOGYAJESA-N	427.436	1.482	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC12CN(C(=O)/C=C/C(=O)NCc1ccccc1)C2	1846175458	ZMLKXMOPGWPSEW-XVJNWHFHSA-N	434.334	1.846	50	20	IDGD	
CN(CC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](F)Br)C(=O)c1ccccc1	1847730485	PCYUDQKMJSGRGK-OFQRWUPVSA-N	426.286	1.651	50	20	IDGD	
CON(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)CCSc2ccc(F)cc2)cc1	12682753	UWGBCPHXTPNARQ-UHFFFAOYSA-N	441.506	1.951	50	20	IDGD	
C=CCn1c(=O)c2ccccc2n2c(SCC(=O)NNc3nc(C)cc(C)n3)nnc12	14514463	BVUZDIGAUVYTMC-UHFFFAOYSA-N	436.501	1.872	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(C)c(C(=O)NNC(=O)COc2ccc(C#N)cc2)c1	15888781	SNZPLRODIYYOSX-UHFFFAOYSA-N	444.513	1.737	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)[C@H]1CC(=O)N(Cc2ccccc2Cl)C1	26692461	JYSLUCNWYFBQBQ-KSSFIOAISA-N	429.860	1.676	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)cc1OC	28970900	ORIZIIPLAVRAQJ-UHFFFAOYSA-N	446.935	1.936	50	20	IDGD	
Cc1ccccc1-n1nc(C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c2c1CCC2	60106522	BCZCZIWMUQUWSR-UHFFFAOYSA-N	442.479	1.991	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)c2csc(-c3cnn(C)c3)n2)c2ccccc2c1=O	107909342	QZUWHQCNUXFDOG-UHFFFAOYSA-N	437.485	1.909	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)c2cn(-c3ccc(C(F)(F)F)cn3)nn2)cc1	726058932	OGINLPWPIUUUSA-UHFFFAOYSA-N	448.361	1.608	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)[C@@H](C)NC(=O)c1n[nH]c2ccccc12	726379894	UYJSQQUADXQLDZ-CYBMUJFWSA-N	425.445	1.306	50	20	IDGD	
CCOc1ccc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)C(=O)NC(C)C)cc2)cc1	726613214	OTUWEHNZQMYVSO-UHFFFAOYSA-N	448.501	1.172	50	20	IDGD	
Cc1c(C=NNC(=O)[C@H](C)NS(C)(=O)=O)c2ccccn2c1C(=O)c1ccccc1	728435037	UBPCEWQETYOWQV-HNNXBMFYSA-N	426.498	1.867	50	20	IDGD	
O=C(CN1C(=O)[C@@H]2CCCC[C@H]2C1=O)NNC(=O)c1cc(F)ccc1Br	728550903	NFZQUIUXMBENHG-GHMZBOCLSA-N	426.242	1.524	50	20	IDGD	
CCC[C@@H](C)NC(=O)[C@@H]1CCCN(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)C1	728961323	GGYGHLFWUCMBJJ-SJLPKXTDSA-N	445.568	1.451	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)CCC(=O)N(CCC#N)c2ccccc2)c1	731223642	JBYUOHJNJAPEAW-UHFFFAOYSA-N	442.497	1.578	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(Br)cc2)C1)C1CCC1	732142549	DRABJOFIXHXRSJ-ZDUSSCGKSA-N	444.351	1.797	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CNC(=O)NCc2ccco2)cc1Br	732175376	LAWJOUPHTSKUNX-UHFFFAOYSA-N	425.239	1.311	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N[C@H](C)C(=O)NCc2ccco2)cc1Br	732244189	DPVAEZRXSNCQJY-SNVBAGLBSA-N	439.266	1.700	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NNc2ccccc2S(C)(=O)=O)s1	732303129	FEPQPOBTAKKTTI-AWEZNQCLSA-N	443.572	1.756	50	20	IDGD	
CC[C@H]1Nc2ccc(C(=O)OCC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)cc2NC1=O	732340353	ZXFPYOREDSSSLV-CQSZACIVSA-N	441.400	1.355	50	20	IDGD	
O=C(COC(=O)CCCc1ccc2nc(O)[nH]c2c1)NNC(=O)c1cccc([N+](=O)[O-])c1	732342898	ZAGGGGGDFQZZRF-UHFFFAOYSA-N	441.400	1.504	50	20	IDGD	
CCCS(=O)(=O)N1CCC(NC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)CC1	733339035	GXUFSOFBCCPVKZ-UHFFFAOYSA-N	434.522	1.021	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCC(C(=O)NNc3cc(C)ncn3)CC2)cc1OC	734255632	PSBFHOBVCDMUES-UHFFFAOYSA-N	435.506	1.346	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2ccc(C(F)(F)F)cn2)CC1	735118356	SZTNDCZAIPHMPI-UHFFFAOYSA-N	444.439	1.188	50	20	IDGD	
CN(C)c1ccc(C(=O)c2ccccc2C(=O)NNC(=O)c2cnn(C)c2)cc1[N+](=O)[O-]	735472734	BJDJMTHFDRWWNU-UHFFFAOYSA-N	436.428	1.700	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)c2cnc3cc(C)ccn3c2=O)cc1C	736784489	MLIUOVUQXXYNCS-UHFFFAOYSA-N	428.470	1.553	50	20	IDGD	
O=C(NN=Cc1ccc(CO)o1)c1cc(S(=O)(=O)NCc2ccccc2)ccc1O	739414393	YHQSOKRDKSKHJU-UHFFFAOYSA-N	429.454	1.720	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)[C@H]1CC(=O)N(Cc2cccc(C(F)(F)F)c2)C1	740851262	WVIQBXSOXPBZTB-ZDUSSCGKSA-N	442.438	1.506	50	20	IDGD	
O=C(C[C@H](C(=O)NN=C/C=C\c1ccco1)N1CCOCC1)NN=C/C=C/c1ccco1	741767187	RPYGMPFOANMKKB-DIJSZAIOSA-N	439.472	1.894	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)N[C@@H]1CCCN(c2ccc(C)cc2)C1=O	743509588	HQIGXUUVYKQURK-QGZVFWFLSA-N	426.473	1.908	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccc(F)cc2)ccc1=O)c1cc(Br)ccc1O	743732102	KSKKWBFNKBOOMI-UHFFFAOYSA-N	447.220	1.915	50	20	IDGD	
O=C(NCc1ccccc1OCCN1CCOCC1)NNc1ccc(-n2cccn2)nn1	744868628	CCAPJBRHSVRCNB-UHFFFAOYSA-N	438.492	1.200	50	20	IDGD	
Cc1c(Br)ccc(C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)c1N	745452959	RXAHEUUILBMSEN-UHFFFAOYSA-N	431.246	1.829	50	20	IDGD	
Cc1cc(N2CC[C@@H](NC(=O)NNC(=O)CSc3ccc(Cl)cc3)C2=O)n(C)n1	745904777	DDRIKQJMTCOUSB-CQSZACIVSA-N	436.925	1.610	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCc2nccn2C1)c1ccccc1NS(=O)(=O)c1cccs1	746347039	PGYIYHPLEFVEDD-CYBMUJFWSA-N	445.526	1.769	50	20	IDGD	
COCCOc1cc([N+](=O)[O-])c(C(=O)NNC(=O)Cc2cn3ccccc3n2)cc1OC	746554091	WDMCPXZMEXYLCA-UHFFFAOYSA-N	443.416	1.280	50	20	IDGD	
COCCn1cc(S(=O)(=O)NNC(=O)c2nc(Cl)c(Cl)c(N)c2Cl)cn1	747777549	OZXQMFRWMBECFH-UHFFFAOYSA-N	443.700	1.090	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)OCC(=O)N2CCCC[C@@H]2C(N)=O)c(C)n1C[C@@H]1CCCO1	749221605	RQYFJYUJTHKBQD-FPZBBQJASA-N	442.516	1.601	50	20	IDGD	
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC[C@H](C(=O)NNC(=O)c2cc3ccccc3o2)C1	749468293	UMNBRGMFCMZFQH-HNNXBMFYSA-N	445.501	1.635	50	20	IDGD	
CCN(CC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1)C1CC1	749568759	TVBAQVMLSLFRJR-UHFFFAOYSA-N	430.530	1.410	50	20	IDGD	
COc1cc([N+](=O)[O-])ccc1OC(=O)Cc1ccc(S(=O)(=O)N2CCOCC2)s1	751179276	DABKUOAOSIQZTN-UHFFFAOYSA-N	442.471	1.834	50	20	IDGD	
C[C@H](NC(=S)NNC(=O)c1cccc(NC(=O)CSc2nncn2C)c1)C1CC1	751617533	BRGXYJLIXSGYSP-NSHDSACASA-N	433.563	1.453	50	20	IDGD	
Cn1c(=NNC(=O)NC2CCN(S(=O)(=O)C(F)(F)F)CC2)sc2ccccc21	755305382	ZJQNTSVNEIORIM-UHFFFAOYSA-N	437.469	1.669	50	20	IDGD	
CC(C)C(=O)Nc1cccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1	755638178	PQXZQVRAAKQSIB-UHFFFAOYSA-N	447.517	1.998	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)N1CCN(CC(=O)Nc2ccc(Cl)cc2)CC1	756061640	HYHSDQGQTRZENL-UHFFFAOYSA-N	430.896	1.275	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccc(N3CCOC3=O)cc2)c1	756159023	HWLOICGBXCPQJT-UHFFFAOYSA-N	447.473	1.360	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccc(-c3ncon3)cc2)c1	756317503	YUPYIDKIRKWBDN-UHFFFAOYSA-N	430.446	1.453	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCC[C@H]2CN2C[C@H](C)O[C@H](C)C2)cc1OC	756502296	SBADYQDYYSGAGR-JZXOWHBKSA-N	434.537	1.038	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)Nc1ccc(C[C@H]2CC(=O)NC2=O)cc1	756815511	LMFAEKQUGWMQKR-AWEZNQCLSA-N	442.497	1.845	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)Nc1cnn(CC(=O)N2C[C@H](C)O[C@H](C)C2)c1)c1ccccc1	756839711	SCQOTNMQKLEZFK-FCEWJHQRSA-N	442.520	1.865	50	20	IDGD	
O=C(CCc1ccccc1)NNC(=O)Nc1cc(C2CC2)nn1[C@@H]1CCS(=O)(=O)C1	756854126	CGRUBQWOMNIPCK-MRXNPFEDSA-N	431.518	1.906	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2cc(C(=O)O)cc(F)c2F)cc(OC)c1OC	756927362	CPQLHGOPKFDQFD-UHFFFAOYSA-N	446.384	1.312	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)NNC(=O)c2ccc(C)cc2O)cc(S(C)(=O)=O)c1	757609155	PHCOWTPAEWAKAR-UHFFFAOYSA-N	435.458	1.747	50	20	IDGD	
O=C(NNC(=O)c1cccc(NC(=O)c2ccc3nc[nH]c3c2)c1)C(=O)Nc1ccccn1	758834427	OTYNEFLXRPMWDS-UHFFFAOYSA-N	443.423	1.610	50	20	IDGD	
CCC(CC)CC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	759111929	MVLIXIUNLLFALM-UHFFFAOYSA-N	425.551	1.614	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)cc1	761788088	RVQRUOUNAFCQMT-LJQANCHMSA-N	426.473	1.596	50	20	IDGD	
C[C@@H](C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1)c1cccc([N+](=O)[O-])c1	762143685	QGJGWRSWBJHSOX-OAHLLOKOSA-N	447.517	1.778	50	20	IDGD	
O=C(NNC(=O)c1ccccn1)C(=O)Nc1cccc(COCC(F)(F)C(F)F)c1	763464895	XAAFLXSOFSXDOX-UHFFFAOYSA-N	428.342	1.898	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)c2ccccn2)sc2c1CC[C@@H](C)C2	763465999	CGPFXHCVZDTSRT-LLVKDONJSA-N	430.486	1.844	50	20	IDGD	
O=C(NNC(=O)c1ccccc1Br)C(=O)Nc1ccc(-n2cncn2)c(F)c1	763482659	JYFHYIYBVANFKY-UHFFFAOYSA-N	447.224	1.569	50	20	IDGD	
CC(=O)NNC(=O)C(=O)Nc1ccc(F)cc1-c1nc(CCOc2ccccc2)no1	763517276	VMCBREGYVVOERK-UHFFFAOYSA-N	427.392	1.603	50	20	IDGD	
CCNC(=O)N1CCc2ccc(NC(=O)C(=O)NNC(=O)COc3cccc(C)c3)cc21	763631264	XHALGXFLIMFXED-UHFFFAOYSA-N	439.472	1.252	50	20	IDGD	
Cc1cc(C)n(-c2cccc(NC(=O)C(=O)NNC(=O)COc3ccccc3F)c2)n1	763679858	PQNMFOHYVYZXEI-UHFFFAOYSA-N	425.420	1.793	50	20	IDGD	
O=C(CSc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1nc2c(s1)COCC2	763732133	AIJPHTPGWWXFKR-UHFFFAOYSA-N	426.907	1.747	50	20	IDGD	
CNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2ccc(OCCC(C)C)cc2)c1	763768431	PHIUEBXYESMKTR-UHFFFAOYSA-N	426.473	1.871	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2cccc(C)c2Cl)c2ccccc2c1=O	763785541	HLOSPCRRQAVTHM-UHFFFAOYSA-N	427.848	1.778	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(OCCS(C)(=O)=O)c2)cc1	763832646	ZZEPJRLPOVDZBE-UHFFFAOYSA-N	433.486	1.072	50	20	IDGD	
Cc1cccc(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)c1C(=O)N1CCCC1	763839218	FZFPSMBXWNFZLZ-UHFFFAOYSA-N	442.447	1.535	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)cc1NC(C)=O	763849141	HXYIIIJJGOONCS-NSHDSACASA-N	432.408	1.346	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1cccc(-c2nncn2C)c1	763850423	NEBDRTSCPJZZJE-GFCCVEGCSA-N	426.408	1.175	50	20	IDGD	
CC(=O)N(C)c1ccccc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1cccc(C)c1C	763852010	UAVZADGDRJICGC-OAHLLOKOSA-N	426.473	1.840	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)S(=O)(=O)CC3)c1C	763855207	VDDYHNGZGSPKIN-CQSZACIVSA-N	445.497	1.187	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)ccc1N1CCOCC1	763856352	HKEJISOOTHEZCC-HNNXBMFYSA-N	444.463	1.524	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)NNC(=O)C(=O)Nc1ccn(CCc2ccncc2)n1	763865343	ONSVGNWSFHEBHV-UHFFFAOYSA-N	431.456	1.331	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1cc(C(F)(F)F)cnc1O	763866632	XEXLPTVPNIFDQY-QMMMGPOBSA-N	430.314	1.499	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(N3CCCC3=O)c2)cc1OC	763901998	LTHLMZXWOVGEBE-UHFFFAOYSA-N	440.456	1.620	50	20	IDGD	
CNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2ccc(OC(C)C)c(OC)c2)c1	763915681	DJBKFXANJGVAOM-UHFFFAOYSA-N	428.445	1.242	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)OCC(=O)N3)ccc1OC(C)C	763916249	KGUZQXABUATSEF-UHFFFAOYSA-N	442.428	1.213	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccnn1Cc1cnn(-c2ccccc2)c1	763960630	RPWBGPOLYOVJMA-UHFFFAOYSA-N	443.467	1.825	50	20	IDGD	
O=C(NNC(=O)c1cccc(Br)c1)C(=O)Nc1ccn(Cc2ccccn2)n1	764058921	KNGOEGCEPJUJRQ-UHFFFAOYSA-N	443.261	1.489	50	20	IDGD	
CCOc1cc2c(cc1NC(=O)C(=O)NNC(=O)c1cccc(OC)c1O)O[C@@H](C)C2	764131089	GDCXORSCKBYWKS-NSHDSACASA-N	429.429	1.523	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(N3CCOC3=O)c2)o1	764138609	GHIIDTPEOWFHOB-UHFFFAOYSA-N	443.460	1.478	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccc(N2CCCN(C)CC2)cc1	764139754	ZQRMWGFFDNXZRO-UHFFFAOYSA-N	439.516	1.166	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2cccc3cccnc23)cc1	764151155	GJSDDTJSZFWMDD-UHFFFAOYSA-N	441.469	1.396	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CCc2ccccc2)cc1N1CCCS1(=O)=O	764191784	HEXANCIDCMVJTG-UHFFFAOYSA-N	444.513	1.254	50	20	IDGD	
CC(C)(C)OC(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)COc2ccccc2O)c1	764276978	FUXNZJDMPNROLV-UHFFFAOYSA-N	443.456	1.441	50	20	IDGD	
CCCCn1nccc1NC(=O)C(=O)NNC(=O)c1ccc(OC)c(Br)c1	764325968	CMJYMAIALGAHHQ-UHFFFAOYSA-N	438.282	1.854	50	20	IDGD	
Cc1c(CS(C)(=O)=O)cccc1NC(=O)C(=O)NNC(=O)c1cc2ccccc2o1	764331132	NIDQPIUJRXPGJY-UHFFFAOYSA-N	429.454	1.686	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)c1cc(-c2ccccn2)nc2ccccc12	764342063	CMBJKNUINWKUHP-UHFFFAOYSA-N	426.436	1.883	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3sccc3C(=O)OC)n[nH]2)cc1	764385319	XCEMPMRJXWVIKD-UHFFFAOYSA-N	441.469	1.887	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1cccc([C@@H]2CNC(=O)C2)c1	764394312	YXDZGQYUXSEDMB-AWEZNQCLSA-N	442.497	1.177	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1ccc(Br)nc1	764398689	VURRWSYIKVATID-UHFFFAOYSA-N	439.291	1.731	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)NCCCN2CCCO[C@@H](C)C2)c1	764585021	RJWSWUDFRSJMJJ-ZDUSSCGKSA-N	443.342	1.903	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)c1ncc(Br)s1	765186109	QIFOGOPCPUMKTN-UHFFFAOYSA-N	438.351	1.879	50	20	IDGD	
COc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NNC(=O)CSc2ccccc2O)cc1	765250481	UTTHVMNTQCVXGZ-LBPRGKRZSA-N	439.515	1.007	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)CCn1c(S)nc2ccccc2c1=O	765319378	WPJVQJKBDFFNPO-UHFFFAOYSA-N	449.533	1.528	50	20	IDGD	
O=C(CCCOc1cccc(F)c1)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765739555	YBPDVGMPZQUFDA-UHFFFAOYSA-N	442.491	1.590	50	20	IDGD	
COC(=O)c1nccc2c(S(=O)(=O)NNC(=O)[C@@H]3COc4ccccc4O3)cccc12	766308946	TYKPJIWJTZGSAZ-INIZCTEOSA-N	443.437	1.171	50	20	IDGD	
O=C(CSc1ccccc1O)NNS(=O)(=O)c1ccc([N+](=O)[O-])c2cccnc12	766532222	WTJHDIRNLMFXMD-UHFFFAOYSA-N	434.455	1.950	50	20	IDGD	
CC[S@@](=O)c1ccccc1C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	766644704	BICUTMVSNJMPAR-WJOKGBTCSA-N	442.541	1.033	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)CCS(=O)(=O)c1ccc2c(c1)OCCO2	766661407	BSQSMSWOKLGITM-UHFFFAOYSA-N	440.499	1.168	50	20	IDGD	
COc1ccc(CN2CCCN(CC(=O)NNC(=O)c3ccccc3Cl)CC2=O)cc1	767930972	NJAIZIJTFJHDCS-UHFFFAOYSA-N	444.919	1.844	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)c1ccc(S(=O)(=O)N(C)C)cc1	768645139	NHZVGIQKMUOBHQ-UHFFFAOYSA-N	427.504	1.106	50	20	IDGD	
CN(C)C(=O)COc1ccc(C(F)(F)C(=O)NNc2nc(-c3cccnc3)no2)cc1	769574253	NLYBNDJDBPSSBW-UHFFFAOYSA-N	432.387	1.834	50	20	IDGD	
COC(=O)c1ccc(S(=O)(=O)NNC(=O)c2ccc(OC)c(Br)c2)cn1	769634279	UVITVRZVDYSCMA-UHFFFAOYSA-N	444.263	1.263	50	20	IDGD	
O=C(CN1CCC(CO)(Cc2ccccc2)CC1)NNC(=O)c1cccc([N+](=O)[O-])c1	769993293	ZDFMAISQSYYUDN-UHFFFAOYSA-N	426.473	1.673	50	20	IDGD	
CN1CCN([C@@H](C(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)c2ccccc2)CC1	770955777	OVSSAVJXMXJYOM-QGZVFWFLSA-N	438.536	1.719	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)NCc2nc(COc3ccccc3)n[nH]2)nc2ccccc21	771376425	LYVNHUAZATVGPO-UHFFFAOYSA-N	434.460	1.344	50	20	IDGD	
CC(=O)NC[C@@H]1CCn2ncc(C(=O)NNC(=O)[C@H](C)Oc3cccc(Cl)c3)c2C1	772994304	KCMBWYAPLGUVPU-GXTWGEPZSA-N	433.896	1.464	50	20	IDGD	
O=C(NNC(=O)c1ccc2cc(Br)ccc2c1)N[C@@H]1CCS(=O)(=O)C1	773057850	BPVVZGSAEXMDDV-CQSZACIVSA-N	426.292	1.733	50	20	IDGD	
O=C(NNc1ccccc1[N+](=O)[O-])C(=O)Nc1ccc2nc(N3CCOCC3)oc2c1	773655913	UTYAVAWEEPANMS-UHFFFAOYSA-N	426.389	1.654	50	20	IDGD	
CC(C)c1nccnc1NNC(=O)C(=O)Nc1ccc(CC(=O)N2CCOCC2)cc1	773999326	GUKABXFLBVKRDN-UHFFFAOYSA-N	426.477	1.083	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2cnc3sc(C)c(C)n3c2=O)c2ccccc2c1=O	775638525	GWFRWDLWJCXYRB-UHFFFAOYSA-N	438.469	1.177	50	20	IDGD	
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	775686100	CPIGAVYBJHOYAQ-OXJNMPFZSA-N	425.489	1.856	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)[C@H]2CC(C)C[C@@H]2C(=O)NNC(=O)c2cc(C)oc2C)c(C)o1	775764880	GYNMTCIBNQPBMN-ROUUACIJSA-N	444.488	1.991	50	20	IDGD	
COCCS(=O)(=O)c1ccc(NC(=O)NNc2cccc(S(C)(=O)=O)c2)cc1	776475522	XIZBNDKTRMORGQ-UHFFFAOYSA-N	427.504	1.659	50	20	IDGD	
Cc1ccc2[nH]c3c(c2c1)CC(=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O)CC3	778539960	IQXDQPYMJCPSHE-UHFFFAOYSA-N	426.502	1.022	50	20	IDGD	
COc1ccc(Cn2ccc(NC(=O)C(=O)NNC(=O)[C@H]3Cc4ccccc4O3)n2)cc1	778712801	ITLBNGDMCBBBPB-GOSISDBHSA-N	435.440	1.030	50	20	IDGD	
NS(=O)(=O)Cc1ccc(C(=O)NNc2ccc([N+](=O)[O-])cc2Br)cc1	779147966	JITNUYCPDAJTIT-UHFFFAOYSA-N	429.252	1.903	50	20	IDGD	
O=C(NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12)N[C@@H]1CCC[C@@H]1CCO	779710319	CHKUTMVYQKQYPZ-YLJYHZDGSA-N	449.511	1.940	50	20	IDGD	
CCO[C@@H]1C[C@@](NC(=O)OC(C)(C)C)(C(=O)NNC(=S)NCCSC)C1(C)C	780988190	WBWPBNHPJWLKAF-KZULUSFZSA-N	434.628	1.943	50	20	IDGD	
COc1ccc(C(=O)OCC(=O)NNC(=O)Cc2ccccc2C)nc1Br	781753530	CYHAWXICRCSFEU-UHFFFAOYSA-N	436.262	1.708	50	20	IDGD	
CCCS(=O)(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(O)cc2)c1C	782837258	HAYPRBHSUZAGQU-UHFFFAOYSA-N	434.474	1.252	50	20	IDGD	
O=C(NN=c1cc[nH]cc1)C(=O)Nc1ccc(CCn2nnc(-c3ccccc3)n2)cc1	783376112	GAYZRSIPCNDNMH-UHFFFAOYSA-N	428.456	1.482	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2ccc(C(C)(C)C)cc2)n([C@@H]2CCS(=O)(=O)C2)n1	784805932	WAQDAIDJAGRUTQ-MRXNPFEDSA-N	433.534	1.930	50	20	IDGD	
CC(=O)N1CCN(Cc2ccccc2NC(=O)C(=O)NNc2cc(F)c(F)cc2F)CC1	784887023	ZVJJOQLDGBYKDX-UHFFFAOYSA-N	449.433	1.850	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1ccccc1CCN(C)C	785340195	XZRPPZYYGSPXGY-UHFFFAOYSA-N	434.518	1.285	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)N[C@@H]3CCN(c4cccc(Br)c4)C3)nc21	787370045	OBAXMYDIGOONOZ-LLVKDONJSA-N	447.297	1.736	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)c1cccc(S(=O)(=O)NCc2ccccc2)c1	788174714	JOOIGNZMHRJCBS-UHFFFAOYSA-N	449.496	1.898	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)c1cccc(NN2C(=O)[C@@H]3CC=CC[C@H]3C2=O)c1	788619493	RFLGMGINOYKUSV-QZTJIDSGSA-N	449.423	1.948	50	20	IDGD	
Nc1nc(Cl)cc(NNC(=O)Nc2ccc(S(=O)(=O)NCC(F)(F)F)cc2)n1	789110507	NTKYSWSETHUJCQ-UHFFFAOYSA-N	439.807	1.701	50	20	IDGD	
CC(C)n1nc(C(=O)NNS(=O)(=O)c2cnn(CC(F)F)c2)c2ccccc2c1=O	790005358	PNBPSEQZPLMPHN-UHFFFAOYSA-N	440.432	1.062	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)c1cc(S(=O)(=O)N(C)C(C)C)ccc1Cl	790064830	DNZJSKHHYAYXCY-UHFFFAOYSA-N	449.957	1.919	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NC[C@@H]2N(C)CCCC2(C)C)cc1	790893399	WBUSSPKJTONMOR-KRWDZBQOSA-N	439.582	1.066	50	20	IDGD	
O=C(NNc1nc2ccccn2n1)C1CCN(S(=O)(=O)c2ccc3c(c2)CCC3)CC1	791245052	PSUZEQNGULRUJJ-UHFFFAOYSA-N	440.529	1.762	50	20	IDGD	
CCOc1cccc([N+](=O)[O-])c1C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	791450626	ZRBGCSFCVKEVAT-UHFFFAOYSA-N	441.488	1.967	50	20	IDGD	
CNC(=O)c1cc2cc(NC(=O)C(=O)NNC(=O)c3ccc(Cl)cc3OC)ccc2[nH]1	792355079	OPWDLIKZZAKNPJ-UHFFFAOYSA-N	443.847	1.589	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNc2ncccc2C)ccc1S(=O)(=O)N1CCCC1	792380429	TZWSRALCFGOEQM-UHFFFAOYSA-N	433.490	1.265	50	20	IDGD	
C[C@@]1(CCC(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)CCC(=O)N1	792803498	AFDIQJZYFLKCPB-DEOSSOPVSA-N	447.495	1.655	50	20	IDGD	
C[C@@H]1CN(C(=O)CCC(=O)C(C#N)=C2N(C)c3ccccc3N2C)C[C@@H](C)S1(=O)=O	794157749	NEJCXKJGUCHSKB-HUUCEWRRSA-N	430.530	1.691	50	20	IDGD	
CCOC(=O)c1ccc(OC)c(S(=O)(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1	795281502	YMDMQUDWXCFDNI-MRXNPFEDSA-N	436.442	1.021	50	20	IDGD	
CCNC(=O)N(C)c1cccc(NC(=O)C(=O)NNC(=O)c2c(C)nc3ccccn23)c1	796991443	DQJYUOQMGZCXNY-UHFFFAOYSA-N	437.460	1.208	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)Nc2cccc(NC(=O)NCC(N)=O)c2)c1C	798060108	YINJBOMBGANQBF-YVLHZVERSA-N	438.488	1.904	50	20	IDGD	
CCOc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NNC(=O)c1cc(-c2cccs2)[nH]n1	799259185	QRBDXNZLJUUALR-UHFFFAOYSA-N	444.429	1.845	50	20	IDGD	
Cc1nn(C)c(Br)c1C(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	801502207	CAMQQKAQMJXXMM-UHFFFAOYSA-N	440.210	1.017	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(CC(=O)NNC(=O)Nc2ccc(Cl)cc2)C(=O)C1	802018497	JUCJTIUFRWFVET-UHFFFAOYSA-N	425.873	1.572	50	20	IDGD	
CCN1C(=O)c2ccc(C(=O)NNC(=O)Nc3ccc4c(c3)OCO4)cc2S1(=O)=O	802099084	BXRXUZVFXNSXRG-UHFFFAOYSA-N	432.414	1.046	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)NC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1	802338367	VWKHSWUHWGKEEI-HNNXBMFYSA-N	428.420	1.663	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)[C@@H](O)c2cccc(C(F)(F)F)c2)n1	803813313	SHBXEBSRROWPPQ-HNNXBMFYSA-N	431.392	1.437	50	20	IDGD	
COC(=O)c1c(C)csc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccccc2)on1	806976900	NXRGWNHYYGHXQL-UHFFFAOYSA-N	428.426	1.898	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)c1cccc(NN2C(=O)[C@H]3CC=CC[C@H]3C2=O)c1	807370620	OUTCLXFQDGWPAH-CALCHBBNSA-N	444.488	1.515	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNc2cccc(F)n2)c(Br)cc1F	807392680	GSHDQKSUPWSQSJ-UHFFFAOYSA-N	429.177	1.991	50	20	IDGD	
O=C(NNc1ccc(-n2cccn2)nn1)C(=O)Nc1ccc(Br)c(C2CC2)n1	815590391	UWYCOCYMVHGPED-UHFFFAOYSA-N	443.265	1.779	50	20	IDGD	
CCN(Cc1ccccc1NC(=O)C(=O)NNC(=O)[C@H]1CCCO1)C(=O)OC(C)(C)C	815779680	QUKXYAXDTPUWBG-MRXNPFEDSA-N	434.493	1.709	50	20	IDGD	
C[C@@H]1Cc2ccccc2N1S(=O)(=O)c1ccc(F)c(C(=O)N2CC[C@H](B(O)O)C2)c1	864231252	LIZAEPOVCVTZGC-HIFRSBDPSA-N	432.282	1.655	50	20	IDGD	
CCn1c(SCC(=O)NNC(=O)c2csc(N3CCOCC3)n2)nc2ccccc21	912852132	OMJIEVVMPUZPMU-UHFFFAOYSA-N	446.558	1.903	50	20	IDGD	
O=C(Cn1c(COc2ccc(Cl)cc2)nc2ccccc21)NNC(=O)[C@@H]1CCC(=O)N1	913055111	HGYKCJIMOHDSBK-INIZCTEOSA-N	441.875	1.695	50	20	IDGD	
CC(=O)c1cccc(S(=O)(=O)NCC(=O)NNC(=O)COc2ccc(C)c(C)c2)c1	913450211	BFGLASWLNCJVRF-UHFFFAOYSA-N	433.486	1.011	50	20	IDGD	
CC(=O)N[C@H](CC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)c1ccc(Cl)cc1	915164911	SMGYWRZIJDRJSO-QGZVFWFLSA-N	437.905	1.772	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(-n3ccnc3S)cc2)c1	916093870	ANFHXWSAZVNGRE-UHFFFAOYSA-N	445.526	1.486	50	20	IDGD	
CCCC(=O)NCC(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2OC)c1	916142290	ILPXFVRKJQOMML-UHFFFAOYSA-N	448.501	1.173	50	20	IDGD	
CSCC[C@H](NC(=O)c1ccco1)C(=O)NNC(=O)C(=O)Nc1ccc(C)c(C)c1	916561681	DDYJITPEYLZJIZ-HNNXBMFYSA-N	432.502	1.534	50	20	IDGD	
COc1cc(CNC(=O)NNC(=O)COc2ccccc2F)ccc1OCC(=O)N(C)C	916641401	COAPRDRIYVKKMF-UHFFFAOYSA-N	448.451	1.211	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2ccc(Cl)nc2)cc1S(=O)(=O)NC(C)C	917253678	VSHVTLWSJWUHPK-UHFFFAOYSA-N	426.882	1.505	50	20	IDGD	
CCCn1nc(C(=O)NNS(=O)(=O)c2cccc3c2COC3=O)c2ccccc2c1=O	918724839	FHHDNROUHXLRNJ-UHFFFAOYSA-N	442.453	1.100	50	20	IDGD	
Cc1ccc(C)c(-n2ccnc2SCC(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)c1	919884288	HSQGEVBAQBPAEY-AWEZNQCLSA-N	437.547	1.099	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)NCc1cccc(NC(=O)[C@@H]2CCCO2)c1	920237810	NELSJDMXWVAPRA-IBGZPJMESA-N	426.473	1.886	50	20	IDGD	
CCN(c1ccccc1)S(=O)(=O)c1cccc(C(=O)NNC(=O)CN2CCCC2=O)c1	920825429	AVONCQZLVZIQTP-UHFFFAOYSA-N	444.513	1.285	50	20	IDGD	
COCCCNC(=O)NNC(=O)c1cc(S(=O)(=O)N2CCCC[C@@H]2C)ccc1C	920862444	FZKRYKDTYUOPIM-HNNXBMFYSA-N	426.539	1.539	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)Nc1nc2c(s1)CCC2	920929442	QVDLHXKQVKRVFU-UHFFFAOYSA-N	435.531	1.883	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCN(c3ccc(Cl)cc3)CC2)cc1OC	921062497	KUPCLJQHWOXDFX-UHFFFAOYSA-N	432.908	1.940	50	20	IDGD	
COc1ccc(C=NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)cc1OCC(N)=O	1317706876	WJBHDFKUEFXWNH-UHFFFAOYSA-N	437.456	1.614	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN1C(=O)OCC(F)(F)F)c1cncn1-c1ccccc1	1318213324	ALKAOEZVWFCHLC-ZDUSSCGKSA-N	425.367	1.797	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)c2cnc(C3OCCO3)s2)CC1	1323646602	ZOOZLJQSNHFRCU-UHFFFAOYSA-N	426.495	1.597	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCCOc2ccc3c(c2)CCC3)nc1	1323675297	ODIZTHNLTRKSMN-UHFFFAOYSA-N	433.534	1.962	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)NCCOCC(F)(F)C(F)F)CC1	1326396218	FLWNPTQTJVOPLD-UHFFFAOYSA-N	444.426	1.881	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@]2(CN(C(=O)/C=N/O[C@@H]3CCCCO3)CCO2)C1	1779297254	YUVAXKQQCUKPJP-RQGFIMDQSA-N	427.574	1.197	50	20	IDGD	
CCCC(=O)N[C@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCBr)C2	1779514154	LEOKCHFWMWOJMG-SPYBWZPUSA-N	446.386	1.590	50	20	IDGD	
C[C@H](Cn1cncn1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CO[Si](C)(C)C)C1	1779545372	HDHUBUJVRARNSG-MBOZVWFJSA-N	437.617	1.280	50	20	IDGD	
C[C@@H]1Oc2ccc(C(=O)N3CC[C@@]4(C3)CN(C(=O)[C@@H](F)Cl)CCO4)cc2NC1=O	1780177961	XCVMMGANGIFWSF-SVBQJQNYSA-N	425.844	1.384	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)Cc3ccc(C(=O)OC)s3)C2)C1	1780899273	UZEPIIXVQKEBSF-IFXJQAMLSA-N	444.937	1.161	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)Cc3ccc4ncnn4c3)C2)C1	1780951799	DMHZUAJWCUKMKM-OALUTQOASA-N	440.331	1.338	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)c3nc4ccc(F)cn4n3)CCO2)C1	1781232598	LRDTZMMYPJKJJO-MSOLQXFVSA-N	444.294	1.548	50	20	IDGD	
Cc1nc[nH]c1CSCC(=O)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781331413	JWWAENQOIHSITH-GOEBONIOSA-N	449.346	1.472	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H]1CCCCN1C)C2	1781997445	WRFIAPZSIGBZHH-YIOZNXECSA-N	430.387	1.768	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cn4cc(F)ccc4n3)CCO2)C1	1783533611	BMKRHJRSMFNMQK-KZULUSFZSA-N	439.285	1.700	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3C[C@@]3(F)Cl)C[C@@H]21	1783974128	JHISRZYQLFIDQD-IQXDSVOMSA-N	425.726	1.922	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(=O)C3CC3)[C@H]2C1	1784010439	TXVGIMOCAJCNPQ-TYDTZWSASA-N	443.450	1.831	50	20	IDGD	
COC(=O)[C@@H]1CC[C@@H](C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)Br)C[C@@H]32)C1	1784081722	BOLNZZWPABTNCT-XFHWEBQZSA-N	445.354	1.339	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3cnccn3)[C@H]2C1	1784242394	FSKWGMAJLNRNMP-VRKREXBASA-N	425.327	1.030	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cn3cc([N+](=O)[O-])cn3)[C@H]2C1	1785213981	FEHWEIZFLTWDLZ-HNKHHVNMSA-N	427.889	1.179	50	20	IDGD	
CCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1785578495	MUCPBPOQQJKGBU-AUSJPIAWSA-N	447.960	1.109	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)c1cc2cnccc2[nH]1	1788419057	LCNPXWBCJARTQS-UDNPPVAFSA-N	439.285	1.847	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C=N/O[C@H]3CCCCO3)[C@H]2C1	1788652371	CIKZGBZKHRPAFO-SESMADOESA-N	429.945	1.903	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4c(c3)OCCO4)C[C@@H]21	1788762507	CZTJWLKPRUSSTA-ZWOKBUDYSA-N	448.592	1.903	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CC34CCCN3CCC4)C[C@@H]21	1788763615	WERCHJXCAQQFDL-FHWLQOOXSA-N	437.657	1.836	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CC34CCCN3CCC4)[C@H]2C1	1789823057	QEFIWRWDKSTMLC-FJIDUMEYSA-N	427.973	1.238	50	20	IDGD	
CC[C@@H](NC)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C(C#N)=C/c3ccc(F)cc3F)[C@H]2C1	1790694080	CHULBQXBAZDYNF-OXMINKDBSA-N	446.498	1.849	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccnc(OC)c3)C[C@@H]21	1790960695	QFDILICZZXHRPK-JONQDZQNSA-N	440.338	1.857	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc4c3cnn4C)C[C@@H]21	1791055698	FCAIWHICCBMZMD-YFPWBOGZSA-N	449.349	1.950	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnnc(Cl)c3)C[C@@H]21	1791056930	IDIDLYLUDPEACG-URBCHYCLSA-N	431.718	1.507	50	20	IDGD	
CCOC(=O)C1(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](C)Br)[C@H]3C2)CC1	1791063953	YHUVWBOBDWGWLA-XUXIUFHCSA-N	431.327	1.093	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4nn[nH]c4c3)C[C@@H]21	1791063993	ZRXSDSCILIXOFZ-LESCFKLSSA-N	436.310	1.335	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cn4c(F)cccc4n3)C[C@@H]21	1791257185	SHBAAOHHZHBESB-YXWQFLTLSA-N	438.887	1.321	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3cnc4[nH]ccc4c3)C[C@@H]21	1791257343	AXERGQDVKONUIV-VJANTYMQSA-N	448.951	1.729	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CC[C@H]3CCOC3)[C@H]2C1	1791818474	RUEZYRPSIUCKIW-WOYTXXSLSA-N	431.371	1.956	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)c1ccc(CO)c(F)c1	1792091306	BFQQLVVNAFXPKB-SDADXPQNSA-N	447.276	1.602	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)CNC(=O)OC(C)(C)C	1792988188	NFAFPZUYCNUKSN-RBZJEDDUSA-N	431.961	1.754	50	20	IDGD	
CC(C)c1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2ccc(B(O)O)cc2)cc1	1795735005	HWKIYFABMMDTGE-VTYHHJSWSA-N	436.317	1.007	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1(c3cccc(F)c3)CC1)C2	1796187965	PZACWJLWLYSIOP-WKCHPHFGSA-N	436.292	1.489	50	20	IDGD	
Cn1c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)cc2ccccc21	1797274222	PFXTZFQHNKKTFU-BJWYYQGGSA-N	446.511	1.742	50	20	IDGD	
Cc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CO[Si](C)(C)C)ncc1[N+](=O)[O-]	1797955983	STPANPZGKPIZGW-ZSBFGKGUSA-N	436.541	1.353	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccnc2ncccc12	1799974672	OHUTZRRJLDPPAY-ZJOBFFGXSA-N	447.333	1.864	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C[C@H](O)CNC(=O)OC(C)(C)C	1800180032	OGUYDYDQAWPQQR-XFIYOXNOSA-N	431.961	1.918	50	20	IDGD	
C[C@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)Br	1800754019	CMNLZTMAYYJMHW-XHJNMGKDSA-N	448.358	1.273	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CO[Si](C)(C)C)C2	1800955806	UHUDLTWPFRIYMU-KMOPNRPKSA-N	438.597	1.183	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Sc1ccccn1)C2	1800980931	HMUZDXUSYDFIPR-OWVAZHOYSA-N	427.954	1.406	50	20	IDGD	
CCOC(=O)N(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2)Cc1ccco1	1801236412	GZHKVKRMAZXEDH-RMHZUWNSSA-N	445.875	1.362	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C[C@H](O)CNC(=O)OC(C)(C)C)C2	1802282836	IMUQVBQIIMFPRS-XFIYOXNOSA-N	447.960	1.154	50	20	IDGD	
CC(=O)Nc1ccccc1C(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]1c1cccnc1	1803145554	FCRZISDYNKARFZ-AHRSYUTCSA-N	444.919	1.959	50	20	IDGD	
COc1ncc(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)cc1F	1804958664	WUTXNTFRCQOGQT-JQFCIGGWSA-N	436.871	1.544	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@H](CNC(=O)CS(C)(=O)=O)[C@H]1c1cccnc1	1806768619	JUYTZZSEWGCKJY-LXZKKBNFSA-N	436.361	1.368	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1CCN(C(=O)CN2CCOCC2)[C@@H]1c1cccnc1	1808295409	HTKYXNBDKAZISC-HQRMLTQVSA-N	443.375	1.656	50	20	IDGD	
CN1CCN(CC(=O)N2CCC3(CCCN(C(=O)CCBr)C3)CC2)CC1	1809065720	OJITUQVCMDOEBN-UHFFFAOYSA-N	429.403	1.250	50	20	IDGD	
Cc1ccc(=O)n(C(C)(C)C(=O)NC[C@@H]2CCN(C(=O)[C@H](F)Cl)[C@@H]2c2cccnc2)n1	1810492565	YMOQDEQWYPBHPQ-JQHSSLGASA-N	449.914	1.922	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)c1ccnc2c1OCO2	1811309944	VFGIOKYONOFLRG-NUEKZKHPSA-N	432.864	1.125	50	20	IDGD	
CCNC(=S)NCC(=O)NC[C@H]1CCN(C(=O)C(Cl)Cl)[C@H]1c1cccnc1	1812333414	OGOXXMDDWPAADD-OCCSQVGLSA-N	432.377	1.375	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)c2cccc(=O)n2C)[C@H]1c1cccnc1	1812865211	SWOSEYNRDRUMFQ-YEWWUXTCSA-N	447.333	1.883	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)Cc2cnn(C)c2)[C@@H]1c1cccnc1	1812867752	MMTOWCQTEGGDDH-FDQGKXFDSA-N	434.338	1.847	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2ccc(C(N)=O)cc2)[C@@H]1c1cccnc1	1813739029	CJCRVVJHPFNHJU-QYZOEREBSA-N	444.919	1.754	50	20	IDGD	
O=C(CN1CCOC1=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](F)Br)[nH]n1	1815028599	VHKQTXNINMBPFX-GWCFXTLKSA-N	432.250	1.545	50	20	IDGD	
CCCNC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1	1815114148	TVTFCFVQFLJIGB-INIZCTEOSA-N	449.556	1.081	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CN2CC(=O)NC2=O)n[nH]1	1815668369	YCGBSWUBPZAQLD-PIGZYNQJSA-N	445.307	1.190	50	20	IDGD	
Cn1ccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)[nH]n2)c1	1816307568	OSKUJMYYSVLVCF-QGZVFWFLSA-N	436.476	1.366	50	20	IDGD	
CNc1ccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)cc1	1817274437	UIQXGASYENBMKO-HXUWFJFHSA-N	447.304	1.751	50	20	IDGD	
C[C@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)CCN3CCOC3=O)sc2C1	1818696914	BBRZCRCTKQXQAQ-UWVGGRQHSA-N	445.339	1.681	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H]2CCCOC2)[nH]n1	1819404220	DVRHYSLZDLKGEK-CXAGYDPISA-N	441.492	1.141	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)c3cnc(O)[nH]3)sc2C1	1820669813	GOYRZXBHOJLOBY-YUMQZZPRSA-N	428.312	1.971	50	20	IDGD	
NC(=O)c1nccnc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)C(Cl)Cl)CC2	1821042458	IXHLAAPPQKQUCJ-LURJTMIESA-N	429.289	1.062	50	20	IDGD	
C[C@H](NC(=O)c1ccccc1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1	1823503643	WASFVFRNVZYTFW-XKQJLSEDSA-N	447.923	1.820	50	20	IDGD	
Cc1cnc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)cn1	1825874501	OVFZXOMNGXLSCS-LJQANCHMSA-N	430.553	1.391	50	20	IDGD	
O=C(C1=CCCS1)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827050315	MIYHVWJJTCSQNX-LJQANCHMSA-N	428.363	1.621	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)[C@@H]2CCC=CO2)CC1	1828891906	BAWHHVDINJXQAI-RTWAWAEBSA-N	426.322	1.292	50	20	IDGD	
CCN(C)[C@@H](C)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1	1828924416	QRADGWWAFKUIGC-OXJNMPFZSA-N	444.580	1.259	50	20	IDGD	
O=C([C@H](O)CCl)N1CCO[C@@]2(COCCN(C(=O)C34CC(c5ccccc5)(C3)C4)C2)C1	1830737278	CVVVGOICBGVPBF-AULURCSPSA-N	448.947	1.164	50	20	IDGD	
CC(C)[C@H](S)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1831492904	OKGINIFPCPYJTI-ZOWXZIJZSA-N	427.336	1.088	50	20	IDGD	
CN1CCC(CC(=O)N2CCC([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)CC1	1831869575	KDHCIZDWCLPDEQ-OAQYLSRUSA-N	449.640	1.711	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)C3(F)CCCCC3)C2)C1	1834821739	WDSWEXZIBRXYRA-QGZVFWFLSA-N	435.334	1.900	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC(OC2CCN(C(=O)c3ncnn3C)CC2)CC1	1836669721	ARMSNSFGXNLUNF-ZDUSSCGKSA-N	442.358	1.458	50	20	IDGD	
CC(=O)NC(C)(C)C(=O)N1CCC(OC2CCN(C(=O)CCBr)CC2)CC1	1836877534	QDBJEODAOGHNLA-UHFFFAOYSA-N	446.386	1.685	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CS[C@H]3CCCCO3)CCO2)C1	1837507349	BNHAGDPHBBBPAR-IEZWGBDMSA-N	434.986	1.720	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(F)nc3)CCO2)C1	1837851012	CMGZCJBGRKOYOC-PXAZEXFGSA-N	430.274	1.074	50	20	IDGD	
O=C(CNC(=O)C(F)(F)F)N1CCC(OC2CCN(C(=O)[C@@H](F)Cl)CC2)CC1	1838085737	BBZADNXDOZIJBC-CYBMUJFWSA-N	431.814	1.198	50	20	IDGD	
CC(=O)N[C@H](C)C(=O)N1CCC(OC2CCN(C(=O)[C@](C)(Cl)CCl)CC2)CC1	1838638855	NWBFIDKIQDYCIQ-BFUOFWGJSA-N	436.380	1.746	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(O)cc3)CCO2)C1	1838971138	DHSZPLQLUCEREX-OALUTQOASA-N	431.316	1.699	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)COc3ccccc3OC)C2)C1	1839141515	KJKVWEXMMOWESX-IERDGZPVSA-N	440.924	1.548	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)Oc3ccccn3)C2)C1	1839149247	ZBWDNMMQLZJHIM-TWOQFEAHSA-N	425.913	1.323	50	20	IDGD	
CN1CCC(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)CC1	1839150107	ZIRNJGXYKJCLBX-RBUKOAKNSA-N	436.380	1.021	50	20	IDGD	
C=C[C@H](O)C(C)(C)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2	1839153978	XGYHEPURMNYFKW-GDIGMMSISA-N	437.364	1.252	50	20	IDGD	
Cc1ncccc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839197651	DQQSREAGSITSKC-YOEHRIQHSA-N	430.274	1.151	50	20	IDGD	
O=C([C@@H](F)Br)N1CCO[C@]2(COCCN(C(=O)C(F)(F)C(F)F)C2)C1	1839199581	YCHKRQPOPSTVBZ-PRHODGIISA-N	439.175	1.034	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)cc1O	1839202274	YYOXLRPEAKQEBS-CRAIPNDOSA-N	445.285	1.461	50	20	IDGD	
C/C=C/C(=O)N1CCOC[C@]2(C1)CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)CCO2	1839744208	UXPNIVMHMOJFML-JZUVUIKZSA-N	431.439	1.904	50	20	IDGD	
Cc1cc(CCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)ccn1	1840186621	LPUVWKFDEZAXTJ-LJQANCHMSA-N	430.332	1.583	50	20	IDGD	
C[C@@H](C(=O)N1CCOC[C@]2(CN(C(=O)C(Cl)Cl)CCO2)C1)c1ccc(O)cc1	1840189315	KUIOJYBWIWNLMU-BFUOFWGJSA-N	431.316	1.756	50	20	IDGD	
Cc1cc(C)c(OCC(=O)N2CC3(CCCN3C(=O)c3ccc(B(O)O)cc3)C2)c(C)c1	1843010530	YJMPKHDJPOSBOA-UHFFFAOYSA-N	436.317	1.188	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1ccnc3ncccc13)C2	1843416573	AGNUEMZZSUQBHC-JFLMPSFJSA-N	445.483	1.581	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCCC12CN(C(=O)c1ccc([N+](=O)[O-])c3c1OCO3)C2	1844378691	VGPWJGMMXYEJGN-UHFFFAOYSA-N	435.509	1.992	50	20	IDGD	
CC(C)(C)OC(=O)NC1(C(=O)N2CC3(CCCN3C(=O)[C@H](F)Br)C2)CC1	1845220840	QJNKQNHSPPMSKB-NSHDSACASA-N	434.306	1.938	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)C13CC(NC(=O)OC(C)(C)C)(C1)C3)C2	1846364907	QGJZPOVFNIAYMI-WPUWVODUSA-N	441.956	1.891	50	20	IDGD	
O=C(CCCOc1ccc2c(c1)CCC(=O)N2)NNC(=O)c1ccc(-n2cnnn2)cc1	105868760	WMLUPNLVQXRWLL-UHFFFAOYSA-N	435.444	1.167	50	20	IDGD	
O=C(CCc1nc(-c2nnc[nH]2)no1)NNC(=O)COc1ccccc1Cc1ccccc1	109711877	FILQBQIAWGYVNC-UHFFFAOYSA-N	447.455	1.605	50	20	IDGD	
CN1C(=C(C#N)C(=O)COC(=O)CN2C(=O)[C@H]3CC=CC[C@H]3C2=O)N(C)c2ccccc21	139214917	YENAZBDWXDKENA-GASCZTMLSA-N	434.452	1.371	50	20	IDGD	
CC1(C)COCCN1CCNC(=O)NNC(=O)COc1ccc(Br)cc1	728399764	HKWBPUXJXFNRRF-UHFFFAOYSA-N	429.315	1.269	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)C2CCN(S(=O)(=O)c3ccc(F)c(F)c3)CC2)c1	728828433	QVLRNLUXOMHYEA-UHFFFAOYSA-N	448.451	1.698	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Cn2ccc3ccccc32)cc1S(=O)(=O)NC1CC1	729449834	FBHACFWNTKVARV-UHFFFAOYSA-N	442.497	1.552	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)NC[C@H]1CN2CCC[C@H]2CO1	729507774	VTUUIZWZZSWAHS-ZFWWWQNUSA-N	427.299	1.022	50	20	IDGD	
Cc1c(C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)nnn1-c1ccc(-c2ccccc2)cc1	731163323	DWXUYNRNXOQTAR-KRWDZBQOSA-N	439.497	1.438	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1cc(Cl)nc(N2CCCC2)c1	732936084	DAMRMGGNNPPZMR-UHFFFAOYSA-N	429.912	1.803	50	20	IDGD	
COc1ccc(-n2cnnc2SCC(=O)NNc2nc3ccccc3c(=O)n2C)cc1	733263199	NRNPBCVRFLXADU-UHFFFAOYSA-N	437.485	1.758	50	20	IDGD	
CN1CCN(c2ncccc2CNC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)CC1	733345015	JAYJZRUILOPVHG-UHFFFAOYSA-N	434.504	1.163	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)CCC(=O)c1ccc2c(c1)OCCO2	734240384	PVCVLXMGPPNWMG-UHFFFAOYSA-N	436.465	1.276	50	20	IDGD	
CN(CC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)[C@H]1CCCN(c2ccccc2)C1=O	734488709	JGDXKUOPBXMRHO-SFHVURJKSA-N	425.445	1.483	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)cn1	735511246	WELZXCGEYCNYTH-UHFFFAOYSA-N	426.399	1.420	50	20	IDGD	
C/C=C/C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCN(Cc3ccccc3)CC2)cc1	737771656	CWEWEEOJHVRUKR-QHHAFSJGSA-N	442.541	1.530	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)N1CCN(C(=O)Cc2ccccc2Cl)CC1	738496772	XONAZURROXKNOO-UHFFFAOYSA-N	444.919	1.984	50	20	IDGD	
CC(C)[C@@H](C(=O)OCC(=O)NNC(=O)c1cccc(Cl)c1)N1C[C@@H](C)O[C@H](C)C1	741019274	DTOUGWZVOINLDF-LBTNJELSSA-N	425.913	1.778	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)[C@H]2CCCCN2C(=O)c2ccccc2)c1	741812696	ATGZUNNUIMLBNC-LJQANCHMSA-N	434.452	1.557	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(OCC(F)F)c2ccccc12)[C@@H]1CCS(=O)(=O)C1	742026302	APDURNLKWZZSLN-LLVKDONJSA-N	448.469	1.228	50	20	IDGD	
O=C(CCC(=O)N1CC(=O)Nc2ccccc21)NNC(=O)c1cccc(Br)c1	742769342	KLMYHSYUCKKRSR-UHFFFAOYSA-N	445.273	1.976	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@@H](C)Oc2ccc(F)c(F)c2)cc1	743738025	QGSUEGGKESJGMN-CYBMUJFWSA-N	441.456	1.509	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)c1C	744456481	FSGORPSQUQWOIH-RGVLZGJSSA-N	449.467	1.534	50	20	IDGD	
C[C@H]1Oc2ccccc2O[C@H]1C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	744620375	CITMHDRZUDNWQO-AUUYWEPGSA-N	433.486	1.379	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)c2cc([N+](=O)[O-])ccc2Br)c1	744914673	FERAJGYQHNGEMW-UHFFFAOYSA-N	447.201	1.847	50	20	IDGD	
CCOc1ccc(NC(=O)CNC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)cc1	745778287	CGKHUYSYLWIZKC-UHFFFAOYSA-N	449.489	1.463	50	20	IDGD	
Cc1ccc(S(=O)(=O)Nc2ccc(C(=O)NNc3nccn(C)c3=O)cc2)cc1C	747942213	ZPIKGZXAMTYBCV-UHFFFAOYSA-N	427.486	1.955	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)CN2CCN(C(=O)OCc3ccccc3)CC2)cc1	748021324	APCNSRQLKRLFQL-UHFFFAOYSA-N	439.516	1.509	50	20	IDGD	
NC(=O)CS(=O)(=O)c1ccc(C(=O)NNc2ccc(Br)cc2F)cc1	748202394	WTTNRQMXTNDYSO-UHFFFAOYSA-N	430.255	1.604	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCC(=O)N(Cc2ccccc2)[C@@H]1c1ccccc1)C(=O)N1CCCC1	748239981	OSCWIJHAEHVMTA-IFMALSPDSA-N	448.523	1.936	50	20	IDGD	
O=C(NNC(=O)c1cc(S(=O)(=O)N2CCC2)ccc1Cl)c1cccc([N+](=O)[O-])c1	748689846	IADSJYIRGFGFIC-UHFFFAOYSA-N	438.849	1.717	50	20	IDGD	
CC[C@@H](C)Oc1ccc(C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)cc1	750240985	BSCUUAFRGRBXAJ-MRXNPFEDSA-N	447.561	1.952	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)NCCNC(=O)c1cccc(Br)c1	750330940	NZDUIQZCWKAKPQ-UHFFFAOYSA-N	437.269	1.891	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)c2cc(Cn3cc(Br)cn3)on2)c1	751562267	QUMLLYJCJIJWNV-UHFFFAOYSA-N	433.266	1.823	50	20	IDGD	
C[C@H]1C[C@H](CNC(=O)OC(C)(C)C)CN1C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	752126318	GTZPMMBGRKNTRZ-UONOGXRCSA-N	444.496	1.252	50	20	IDGD	
CCn1cc([C@@H]2C[S@@](=O)CCN2C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cn1	753134493	FQTHQNYTMDPEPJ-DRKIFQHWSA-N	441.517	1.249	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)N[C@@H]2CCN(Cc3ccc(C#N)cc3)C2=O)cc1	753292833	VHDOCDASWHTRTA-LJQANCHMSA-N	435.488	1.761	50	20	IDGD	
C[C@]1(CCC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)CCC(=O)N1	753378805	KORVKVUSOXPMJX-HXUWFJFHSA-N	436.534	1.071	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCS(=O)(=O)[C@H]2CCCC[C@H]21	753852011	SQHJAIWGZWCGNI-ZBFHGGJFSA-N	429.926	1.151	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1)S(C)(=O)=O	754098809	BFBWPDUSNCQLSS-OXJNMPFZSA-N	444.557	1.377	50	20	IDGD	
Cn1cc([N+](=O)[O-])cc1C(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	754809293	NEFUNWDUNIUHRB-UHFFFAOYSA-N	446.427	1.710	50	20	IDGD	
CCC(=NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)c1nccn1C	755490392	OUHGXNVEYVAQEH-UHFFFAOYSA-N	433.534	1.304	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NN=Cc3cccc4[nH]ccc34)CC2)cc1	755789979	LXXXMYQQMPQAEH-UHFFFAOYSA-N	439.541	1.933	50	20	IDGD	
CCOCCCNC(=O)c1cccc(NC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1	755956249	KFBPSQGWCBLWAM-LJQANCHMSA-N	442.472	1.836	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)Nc1ccc(F)c(-n2nnnc2C2CC2)c1	756777614	JVTWYEOTPZTERJ-QGZVFWFLSA-N	439.407	1.672	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2cc(C)cnc2OC)c1	756846995	AWBKEIXMCXAJME-UHFFFAOYSA-N	435.506	1.896	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccn(CC(F)(F)F)n2)c1	757747344	HVMRCKGZMBPDHL-UHFFFAOYSA-N	434.400	1.162	50	20	IDGD	
Cc1ccnc(-n2nccc2NC(=O)C(=O)NNC(=O)CSc2ccccc2O)c1	760290458	IRNPVXXHIXEUFC-UHFFFAOYSA-N	426.458	1.160	50	20	IDGD	
CSc1cccc(N2C[C@@H](C(=O)NNC(=O)CCNC(=O)OC(C)(C)C)CC2=O)c1	760439860	MKMLVSIPGBCUGK-ZDUSSCGKSA-N	436.534	1.824	50	20	IDGD	
CC[C@@H]1CN(C(=O)/C(C#N)=C/c2cn(CCC(N)=O)nc2-c2ccc(OC)cc2)C[C@@H]1O	762209688	XLZZMCIWSCCQGZ-VEOQNBNRSA-N	437.500	1.570	50	20	IDGD	
O=C(NNC(=O)c1ccncc1)C(=O)Nc1ccc(CC(=O)N2CCc3ccccc32)cc1	763463034	UUOOLEWVIMXFOB-UHFFFAOYSA-N	443.463	1.613	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccn(-c3ccccc3Cl)n2)cc1OC	763550333	DFNGQIVBWGKCQW-UHFFFAOYSA-N	443.847	1.943	50	20	IDGD	
CC(C)(C)c1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(C(N)=O)cc2F)cc1	763599595	JPOZTSCXTLNXIH-UHFFFAOYSA-N	430.436	1.387	50	20	IDGD	
Cc1nc(-c2cccc(NC(=O)C(=O)NNC(=O)c3cc(-c4ccccc4)[nH]n3)c2)n[nH]1	763601695	UCNXBFLYWAQKIO-UHFFFAOYSA-N	430.428	1.570	50	20	IDGD	
CCOc1cc2c(cc1NC(=O)C(=O)NNC(=O)c1c(C)nc3ccccn13)O[C@H](C)C2	763625972	ZYNKJAXIWZGOQQ-GFCCVEGCSA-N	437.456	1.765	50	20	IDGD	
CCOC(=O)c1c(F)cccc1NC(=O)C(=O)NNC(=O)COc1ccc(OC)cc1	763660859	IIOMSGUNEDOTCB-UHFFFAOYSA-N	433.392	1.176	50	20	IDGD	
Cc1cc(C(=O)NC(C)C)ccc1NC(=O)C(=O)NNC(=O)COc1ccccc1F	763681041	YVFZXADLEVXLRT-UHFFFAOYSA-N	430.436	1.437	50	20	IDGD	
COCCn1ccc2ccc(NC(=O)C(=O)NNC(=O)COc3ccccc3F)cc21	763681123	ZYZSNXUBAZXXTH-UHFFFAOYSA-N	428.420	1.592	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(-n3cnc4ccccc43)nc2)c1	763754011	KAPDZQCURUEPPS-UHFFFAOYSA-N	443.467	1.886	50	20	IDGD	
CCOC(=O)c1cc(CC)sc1NC(=O)C(=O)NNC(=O)c1cccc(N(C)C)c1	763754062	LEVAKMMIRMELLH-UHFFFAOYSA-N	432.502	1.953	50	20	IDGD	
CO[C@@H](C)C(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2cccc(N(C)C)c2)c1	763758061	MZWKSPYKRSWZSN-ZDUSSCGKSA-N	427.461	1.126	50	20	IDGD	
O=C(NNC(=O)c1cc2c(s1)CCC2)C(=O)Nc1ccccc1C(=O)N1CCCC1	763782801	VUQGYYFBHFUQEV-UHFFFAOYSA-N	426.498	1.873	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)cc(OC)c1C(C)C	763808101	UVGRKEQLTJZJFA-UHFFFAOYSA-N	440.456	1.864	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)cn1C	763849319	KXFXSYATVMBADX-CQSZACIVSA-N	430.461	1.372	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)NNC(=O)C(=O)Nc1cc(N2CCCC2=O)ccc1F	763860593	JUZUPWATLFRKNC-UHFFFAOYSA-N	437.431	1.762	50	20	IDGD	
CC(C)CNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)cc1	763870556	AFQKKZTWVZJOSW-AWEZNQCLSA-N	444.463	1.765	50	20	IDGD	
Cc1cc(=O)n(C)cc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1c(C)cc(Cl)cc1C	763883803	QUNQLRVUEJRZIK-ZDUSSCGKSA-N	434.880	1.517	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)CN(C)C3)cc1OC	763911011	JPJSODGRCAXXHG-UHFFFAOYSA-N	426.473	1.829	50	20	IDGD	
O=C(Cc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1cccc(-c2nnnn2C2CC2)c1	763936387	ITBJPVVNDYIBOL-UHFFFAOYSA-N	439.863	1.657	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3ccc4c(c3)C(=O)NCC4)cc2C1	763939340	DAPYZKMABMAMDT-LLVKDONJSA-N	426.498	1.559	50	20	IDGD	
NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(COc3ccccc3)o2)cc1F	763955160	IOHLXBHRDXRXTC-UHFFFAOYSA-N	440.387	1.496	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cccc(-c3nnc4n3CCCCC4)c2C)n[nH]1	764108113	CMUGZNNNYJASKM-UHFFFAOYSA-N	436.476	1.411	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)nn1-c1ccccc1Cl	764154404	QITSPINIGREJFJ-KRWDZBQOSA-N	439.859	1.924	50	20	IDGD	
CC(C)n1cnnc1-c1ccccc1NC(=O)C(=O)NNC(=O)[C@@H]1Cc2ccccc2O1	764155311	YBZJLKUXJBTIRH-SFHVURJKSA-N	434.456	1.616	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1OC(F)F	764260253	NLKDMYHXVSIWKP-UHFFFAOYSA-N	448.430	1.389	50	20	IDGD	
COc1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	764266521	LQISSAXUQHTUOR-UHFFFAOYSA-N	432.868	1.141	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2cc(Br)ccc2O)cc1OC	764276331	CFGMFQFUGOUYFI-UHFFFAOYSA-N	438.234	1.572	50	20	IDGD	
Cc1cc(CSc2ncccc2C(=O)NNC(=O)CNC(=O)c2cccnc2)no1	764345576	SQGKXSXQAZKJRH-UHFFFAOYSA-N	426.458	1.256	50	20	IDGD	
C#Cc1cccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(OC)c(OC)c3)[nH]n2)c1	764379504	ZQZUYVCPQRWJOX-UHFFFAOYSA-N	433.424	1.475	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cnn(-c4ccccc4)n3)n[nH]2)cc1	764388319	QQMZOCUSSZFEBY-UHFFFAOYSA-N	444.455	1.620	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)C(=O)Nc1ccn(-c2ncccc2C(F)(F)F)n1	764389736	WEYSHTQLZARAPG-UHFFFAOYSA-N	433.350	1.389	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)C(=O)Nc2nn(C3CCCCC3)cc2C)c1	764434310	ULPNLXLOOCNZKQ-UHFFFAOYSA-N	427.465	1.450	50	20	IDGD	
C[C@H](C(=O)NNC(=O)Cc1nc(-c2ccccc2)cs1)S(=O)(=O)C1CCOCC1	764706893	GSDOFIGYXQGLBY-CYBMUJFWSA-N	437.543	1.482	50	20	IDGD	
COc1cc(OC)cc(C(=O)NCC(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)c1	765570196	WOMGKKPSRULONQ-UHFFFAOYSA-N	429.458	1.346	50	20	IDGD	
CNC(=O)COc1ccc(C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)cc1OC	765572122	VEEKXLZWBQYHIO-UHFFFAOYSA-N	429.458	1.346	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)CNC(=O)CCc2ccc(C)cc2)n[nH]1	765600865	OYCJJYFUGQKFSB-UHFFFAOYSA-N	435.484	1.904	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)c3cc(F)ccc3C)CC2)cc1	765729480	SQQIYGSZDSWVPX-UHFFFAOYSA-N	448.520	1.210	50	20	IDGD	
COc1ccc(SCC(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cc1	765736382	QHKZTTNZWULPMH-UHFFFAOYSA-N	442.541	1.393	50	20	IDGD	
CNC(=O)[C@@H]1CCC[C@@H]1NC(=O)NNC(=O)COc1ccc(OCc2ccccc2)cc1	766277090	CTEGAIVIZMKPLK-UXHICEINSA-N	440.500	1.890	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)C1(c2ccc(Cl)cc2)CC1	766644231	SOTNWYJNTMKMSP-UHFFFAOYSA-N	440.931	1.977	50	20	IDGD	
COc1cccc(OCCN2CCN(CC(=O)NNC(=O)c3cccc(C#N)c3)CC2)c1	767048409	LHLIDFLNVJRKDM-UHFFFAOYSA-N	437.500	1.024	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN(C(=O)N2CCCC2)C1)c1cc(-c2ccc(F)cc2)[nH]n1	768277751	VQHACMSCHIBJED-OAHLLOKOSA-N	428.468	1.905	50	20	IDGD	
C[C@H](C(=O)NNc1ccc(Br)c(F)c1)N1C(=O)[C@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O	771691158	PVUXXVJIPSSEHL-QXVRGBBPSA-N	426.242	1.582	50	20	IDGD	
CCOC(=O)CNC(=O)C1CCN(C(=O)NNC(=O)c2cccc3ccccc23)CC1	771988224	UXSZSTXEDAYDIF-UHFFFAOYSA-N	426.473	1.586	50	20	IDGD	
COc1ccc(/C=C/C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)cc1O	773458341	FMAOAKYMXVKCMY-ONNFQVAWSA-N	446.529	1.493	50	20	IDGD	
COc1cccc(C)c1NC(=O)C(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12	773522806	CKMAOVUGCFVAGM-UHFFFAOYSA-N	437.456	1.694	50	20	IDGD	
Cc1cc(S(N)(=O)=O)ccc1CNC(=O)NNC(=O)c1cccc(OC(F)F)c1	775204194	YBVGGOFDRQEPKY-UHFFFAOYSA-N	428.417	1.388	50	20	IDGD	
C=CCOc1cccnc1C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	775545586	XWOKPZPSWUTDJX-UHFFFAOYSA-N	431.518	1.339	50	20	IDGD	
CN(NC(=O)c1ccc2nc(O)n(C)c2c1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776205039	IESLWZDFXYEOTO-UHFFFAOYSA-N	432.481	1.528	50	20	IDGD	
CN(NC(=O)c1cnn(-c2cccnc2)c1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776206136	PINNZLKNIGWZOQ-UHFFFAOYSA-N	429.481	1.517	50	20	IDGD	
O=C(NCc1cc(Br)ccc1Br)NNC(=O)C(=O)NC1CC1	776240860	XIIAFPFMXWHZQX-UHFFFAOYSA-N	434.088	1.321	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)[C@H](Cc2cccc(F)c2)n2nnnc2C)nc1C	778429269	JNLMDNVAELIEHV-INIZCTEOSA-N	428.428	1.323	50	20	IDGD	
Cc1nn(CC(F)(F)F)c(C)c1[C@H](C)C(=O)NNC(=O)CCN1C[C@H](C)O[C@H](C)C1	778503137	JGAAQPKMFDZEEK-XQQFMLRXSA-N	433.475	1.812	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(C(=O)NNC(=O)NCc2cccc(C(F)(F)F)c2)n(C)c1	778665202	HQDSGFRPOXWENH-UHFFFAOYSA-N	447.439	1.438	50	20	IDGD	
CCC(CC)[C@H]1C[C@@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)CCO1	779394145	AMXMKSITJVORKR-FUHWJXTLSA-N	440.566	1.865	50	20	IDGD	
CN(C)N(C(=O)COc1cccc(I)c1)[C@H]1CCS(=O)(=O)C1	782005578	ADYVPROZNYXABG-LBPRGKRZSA-N	438.287	1.162	50	20	IDGD	
COc1ccccc1[C@@](N)(C(=O)NNC(=O)c1ccc2c(c1)OCCO2)C(F)(F)F	782164867	WNCFDEVVAWDJPX-GOSISDBHSA-N	425.363	1.644	50	20	IDGD	
CC(C)Oc1c(F)cc(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)cc1F	782892587	DTFFAUHJGYHNAL-UHFFFAOYSA-N	445.426	1.967	50	20	IDGD	
COC(=O)[C@@H]1CN(C(=O)C(=O)NN=c2sc3ccccc3n2C)c2ccccc2O1	783351982	RCPGHGXIEUFNCD-HNNXBMFYSA-N	426.454	1.139	50	20	IDGD	
CCOc1cc(C(=O)N(C)C)ccc1NC(=O)C(=O)NNC(=O)Nc1ccccc1C	783415378	BAODGZNLZABPLA-UHFFFAOYSA-N	427.461	1.887	50	20	IDGD	
CCCOc1ccccc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	784210500	RFNLSLOFIAOJFA-UHFFFAOYSA-N	432.502	1.998	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)C(=O)Nc1ccc(-c2ncon2)cc1	784216669	OUKLSCCWAYTFPG-UHFFFAOYSA-N	442.457	1.259	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)C(=O)Nc1ccc(F)c(Br)c1	785068144	USOWIRFYLWEIGW-UHFFFAOYSA-N	434.225	1.565	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2cccc3c2OCC[C@@H]3N(C)C)cc1	789733797	VGVOJEUYHJNCEJ-IBGZPJMESA-N	440.500	1.799	50	20	IDGD	
O=C(NNc1nc2ccccn2n1)[C@@H]1CCC[C@@H](C(=O)NNc2nc3ccccn3n2)C1	791242853	LHAXAOKFWFZRBU-ZIAGYGMSSA-N	434.464	1.165	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)[C@](C)(O)Cn1cc(C(F)(F)F)ccc1=O)c1ccccc1	792155543	AKIZHVGJOPBVOU-DNVCBOLYSA-N	425.407	1.959	50	20	IDGD	
CN(C)N(C(=O)c1cccc(NN2C(=O)[C@H]3CC=CC[C@H]3C2=O)c1)[C@@H]1CCS(=O)(=O)C1	792851210	UJIIEMBOSAAJKK-KURKYZTESA-N	446.529	1.071	50	20	IDGD	
COc1ccc(Cn2cc(NC(=O)C(=O)NNC(=O)Cc3ccccc3OC)cn2)cc1	793025306	JYCGGIXBFFOIBK-UHFFFAOYSA-N	437.456	1.277	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cscc2Br)cc1	794766409	HLBGGHLVJXQMTA-UHFFFAOYSA-N	446.348	1.901	50	20	IDGD	
CCSc1cccc(NC(=O)C(=O)NNC(=O)CNC(=O)OCc2ccccc2)c1	797369228	QQUUHBACLAKWFC-UHFFFAOYSA-N	430.486	1.811	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)n1	797371160	PQZKEIRMFNIXGP-OKILXGFUSA-N	429.452	1.542	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2ccc(C(=O)N(C)C)cc2)cc(OC)c1OC	799519165	DTWPZFFKQFQAFC-UHFFFAOYSA-N	437.474	1.038	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)CNC(=O)OCc2ccccc2)cc(C)c1Cl	799836278	FJGLHCWBCYLBQQ-UHFFFAOYSA-N	432.864	1.969	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)N[C@H]2COc3cc(F)c(Br)cc32)n1	800746917	BOCAEUIYYBYKIX-ZDUSSCGKSA-N	426.246	1.866	50	20	IDGD	
COc1ccc(-n2cc(O)c(C(=O)OCC(=O)NNC(=O)c3ccc(Cl)cc3)n2)cc1	801364470	VPFQLSGTWICZJT-UHFFFAOYSA-N	444.831	1.858	50	20	IDGD	
CC(=O)[C@H]1CC(C(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)=NN1c1ccccc1	802067133	MTEKJAIXNWOJRW-GOSISDBHSA-N	443.485	1.467	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)c1sccc1S(=O)(=O)N1CCCCC1	804952538	QAIPQDKHWYSCHO-UHFFFAOYSA-N	433.519	1.655	50	20	IDGD	
COCCOc1ccc(S(C)(=O)=O)cc1NC(=O)NNC(=O)CCc1ccccc1	806737439	SPXUJSKBZJIBGZ-UHFFFAOYSA-N	435.502	1.901	50	20	IDGD	
O=C(COc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1nc(C2CCOCC2)cs1	806973705	JLUZYDCVTDCHOC-UHFFFAOYSA-N	438.893	1.855	50	20	IDGD	
Cc1cccn(Cc2c(F)cccc2NC(=O)C(=O)NNC(=O)CC(F)(F)F)c1=O	806977239	AQAQWFXGLJCMQR-UHFFFAOYSA-N	428.342	1.382	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2cccc(F)c2Cl)nc1	806998319	VGRABXRIAGKGCQ-UHFFFAOYSA-N	429.861	1.643	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)[C@@H]2CC(=O)N(c3ccccc3F)C2)C1	808011058	OISCNRAIZKAGIO-LSDHHAIUSA-N	448.495	1.973	50	20	IDGD	
CC(C)(C)C[C@@H](CC(=O)NNC(=O)c1cccnc1)C(=O)NNC(=O)c1cccnc1	809545695	OYDGQKNDVNXJMJ-MRXNPFEDSA-N	426.477	1.141	50	20	IDGD	
COC(=O)c1c(F)ccc(NC(=O)C(=O)NNC(=O)Cc2ccc(Cl)cc2)c1F	810384453	KZVJAVPFOFFTIM-UHFFFAOYSA-N	425.775	1.733	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)CC(F)(F)F)c(C(=O)NCC(F)(F)F)cc1F	810386494	CLAXZDKJXQWTSW-UHFFFAOYSA-N	446.279	1.465	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2ccc(-n3ccc(C(F)(F)F)n3)cc2)CCS(=O)(=O)C1	810393435	NGYWFXGNOSSLKA-INIZCTEOSA-N	445.423	1.028	50	20	IDGD	
O=C(Cc1nc(-c2ccccc2)cs1)NNC(=O)C(=O)N1CCN(c2ccccc2)CC1	812454993	TVFOPOWVOJJPNT-UHFFFAOYSA-N	449.536	1.849	50	20	IDGD	
CCOc1ccc([C@H](O)C2CCN(C(=O)NNC(=O)CNC(=O)c3ccco3)CC2)cc1	812882936	WPEFLIIMMNOYIL-FQEVSTJZSA-N	444.488	1.595	50	20	IDGD	
Cc1cnc(Br)c(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1	812980637	YIVQNUQZXLYHNT-ZDUSSCGKSA-N	435.234	1.078	50	20	IDGD	
CCCc1nnc(SCC(=O)NNC(=O)[C@@H](C)Oc2c(C)cc(Cl)cc2C)n1N	813366546	SZCYSNFETNJQJE-GFCCVEGCSA-N	440.957	1.922	50	20	IDGD	
O=C(COC(=O)Cc1c[nH]c2cccc(Cl)c12)NNC(=O)[C@H]1COc2ccccc2O1	814526254	JJJJITMACBUCLC-QGZVFWFLSA-N	443.843	1.894	50	20	IDGD	
O=C(NNc1nc2ccccn2n1)C(=O)Nc1ccn(-c2ccc(Br)cc2)n1	815619472	OGELVUHJNGGFAE-UHFFFAOYSA-N	441.249	1.759	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)CCN/C(O)=C2\N=CC=CC2=O)c1	818757164	QUPKYTRGFUPRGQ-FOCLMDBBSA-N	437.250	1.595	50	20	IDGD	
O=C(CC1CC1)NNC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O	819140402	IDZCGAQXXUBKBC-UHFFFAOYSA-N	434.430	1.662	50	20	IDGD	
CS(=O)(=O)CC[C@H](NS(=O)(=O)/C=C/c1ccccc1)C(=O)NNc1ccccc1	821694143	XCLQENQKLMISJZ-XOVFHRFOSA-N	437.543	1.523	50	20	IDGD	
Cc1ccc2nc(COc3cccc(C(=O)NNC(=O)[C@H]4CCS(=O)(=O)C4)c3)cn2c1	841342217	JDVQIPGJYHCHAF-INIZCTEOSA-N	442.497	1.417	50	20	IDGD	
O=C(CSCc1cc(=O)n2ccsc2n1)NNC(=O)c1ccc2c(c1)OCCO2	895902404	ZLXUIISYYNAINT-UHFFFAOYSA-N	432.483	1.222	50	20	IDGD	
CN1/C(=C(\C#N)C(=O)Cn2cc(S(=O)(=O)N3CCCC3)ccc2=O)Nc2ccccc21	913589489	SZFZLUYOVIYOMQ-LTGZKZEYSA-N	439.497	1.499	50	20	IDGD	
COc1cccc(C[C@@H](C(=O)NNC(=O)c2ccc(OC)c(OC)c2)n2nnnc2C)c1	915685850	OJFMNJZYXBRAKA-KRWDZBQOSA-N	440.460	1.252	50	20	IDGD	
Cc1nnnn1[C@H](Cc1ccc(F)cc1)C(=O)NNC(=O)[C@H](C)Oc1ccccc1F	915697802	YHBVUZTXOBYFKI-YVEFUNNKSA-N	430.415	1.658	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NN=Cc1ccc(C(=O)O)cc1	915914984	JCMXPIFKQNRWFV-UHFFFAOYSA-N	445.497	1.489	50	20	IDGD	
Cc1cccc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c1	916375835	WOGUQZUFZKOGCO-UHFFFAOYSA-N	432.502	1.160	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1	918217389	CAVGIIOIQNJGMN-UHFFFAOYSA-N	432.452	1.824	50	20	IDGD	
COc1cc([C@@H](C)NC(=O)NNC(=O)C(=O)NC2CC2)ccc1OCc1ccncc1	918227602	HEBSMGFXKAZBSR-CYBMUJFWSA-N	427.461	1.339	50	20	IDGD	
CC(C)(C)C(=O)NNC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1	919783254	IAOKIVYHPSEBHR-UHFFFAOYSA-N	429.500	1.819	50	20	IDGD	
O=C(CN1CCCC1=O)NNC(=O)[C@H]1CCCN(C(=O)c2ccc(Cl)c(Cl)c2)C1	920436112	VPLGKSSLOPOVGM-ZDUSSCGKSA-N	441.315	1.615	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1ccc2c(c1)nc(O)n2C	920697833	IYQUPZCZUJNOMO-UHFFFAOYSA-N	432.820	1.559	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)c1cc([N+](=O)[O-])ccc1N1CCOCC1	920813440	VRQHKKLTRPEXCH-ZDUSSCGKSA-N	432.408	1.799	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)/C=C\c1ccccc1)C(=O)NNC(=O)NCC1CC1	920859259	RSWVJPJRTRMTIW-DMIOIOJGSA-N	426.564	1.439	50	20	IDGD	
CN(NC(=O)[C@H]1CC(=O)N(C)c2ccccc21)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	1116724117	JYFSHISXQJWSGX-INIZCTEOSA-N	445.520	1.772	50	20	IDGD	
Cc1noc(C(F)(F)F)c1C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	1318955914	KSUJIWUHYMKACP-UHFFFAOYSA-N	448.427	1.090	50	20	IDGD	
CC(C)NC(=O)N1CCC[C@H]1C(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1	1319218850	RKEUQUYGBKGVPI-HNNXBMFYSA-N	425.530	1.363	50	20	IDGD	
CCOc1ccc(N2CCN(CC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)CC2)cc1	1319715188	RBPOSDIYJJOGNY-UHFFFAOYSA-N	427.461	1.577	50	20	IDGD	
O=C(NNC(=O)N[C@H]1CCO[C@@]2(CCS(=O)(=O)C2)C1)Nc1ccc(OC(F)F)cc1	1319952179	YXBVCMIVWPQZLG-SJCJKPOMSA-N	448.448	1.360	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)[C@H]2COc3ccccc3O2)ccc1N1CCN(C)CC1	1321010106	KVZLPDXSUFMJJU-HXUWFJFHSA-N	425.489	1.740	50	20	IDGD	
COc1cc(CNC(=O)NNC(=O)c2ccc(Br)cc2)ccc1OCCO	1321844883	NYVQQPCGOKJYOD-UHFFFAOYSA-N	438.278	1.973	50	20	IDGD	
Cc1c([C@@H](C)NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cnn1C	1337489741	LWYFZKFAYZSSHJ-CYBMUJFWSA-N	434.522	1.218	50	20	IDGD	
Cc1ccc(=O)n(C(C)(C)C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](F)Cl)C2)n1	1778031211	SJPFQDJJGKSTNY-PTSWNOGYSA-N	442.919	1.335	50	20	IDGD	
Cc1nnsc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)Br)C2	1778241300	VKOJAMTUWLEAJU-KANYHAFZSA-N	431.356	1.757	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccn(CCOC)n2)C1	1778245109	QEMPXMPXTQBFTO-WRWLIDTKSA-N	426.945	1.674	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)c1ccc(Cl)o1	1778409585	KTXJZGJWGNHHSC-DYESRHJHSA-N	446.696	1.054	50	20	IDGD	
CC(=O)O[C@@H](C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCBr)C2)C(C)C	1779205871	NIVIEURLPBZPLV-SZVBFZGTSA-N	447.370	1.873	50	20	IDGD	
C=CC[C@@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1	1779374545	OBUHUHJNMKBQCV-YBOAYWMSSA-N	429.521	1.025	50	20	IDGD	
O=C(c1cc([N+](=O)[O-])cc2c1OCC2)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Cl)CCO2	1780093583	NULOHNFWGHPCFN-YJBOKZPZSA-N	427.816	1.508	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3cn(C(C)(C)C)nn3)C2)C1	1780351058	HUFBGFZQZMYHMG-UGSOOPFHSA-N	442.358	1.508	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CN1CCCC1=O)C2	1780713027	KQMYJNPKKLEXHQ-MDASCCDHSA-N	434.364	1.359	50	20	IDGD	
C=C(CC(=O)OCC)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)Br)C2	1780741056	JLAVXBXIRZEDSV-QMTMVMCOSA-N	445.354	1.793	50	20	IDGD	
Cc1nccn1[C@@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Br)C1	1780777305	QNSYWHIBQGXUKZ-WLLUSJSYSA-N	445.333	1.957	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H]3C[C@H]3F)C2)C1	1781085620	CFWJAZJEAKUOHN-YYFZDKIDSA-N	435.408	1.322	50	20	IDGD	
Cc1ccccc1NCC(=O)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781331268	NJYHVXPBBOPNDG-FUHWJXTLSA-N	428.302	1.927	50	20	IDGD	
C[C@@H](Oc1ccccc1)C(=O)N1CC[C@@]2(CN(C(=O)[C@H](F)Br)CCO2)C1	1781378593	KATLOJPJSPDBCY-XUWXXGDYSA-N	429.286	1.974	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)n(C)n1)C2	1781996457	KGCXXFUWNJABAL-XTQGRXLLSA-N	429.315	1.037	50	20	IDGD	
O=C(c1nc2cc([N+](=O)[O-])ccc2[nH]1)N1CC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1782183773	LCRISHYPRLUHHW-KRWDZBQOSA-N	442.259	1.718	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)c3nc4ccc(F)cn4n3)C2)C1	1782569216	GTRZTZCIGQVOHU-ROUUACIJSA-N	444.294	1.548	50	20	IDGD	
Cn1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)/C(C#N)=C/c4ccc(F)cc4F)C3)C2)n1	1782863531	FPWFFQLBIRAABT-VROYLXGSSA-N	441.438	1.749	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)CSc3ncccn3)CCO2)C1	1783341275	CMXWRFNXUIIKSU-DYVFJYSZSA-N	443.367	1.572	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ncc(F)cc3F)CCO2)C1	1783342508	JGYILXGBEQNBHV-YVEFUNNKSA-N	432.265	1.977	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cccn(C)c3=O)CCO2)C1	1783344354	STXUSJBFTFSPSS-KDOFPFPSSA-N	426.311	1.002	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc4c(c3)OCCO4)CCO2)C1	1783534877	QMRVTIBLBWVIKW-DJJJIMSYSA-N	439.306	1.685	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3nc(O)n4c3CCCC4)CCO2)C1	1783537622	PMYFMLMHUMXMRP-KPZWWZAWSA-N	441.326	1.152	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3n[nH]c4ccc(C#N)cc34)CCO2)C1	1783882845	QZOWFCBNECRLIN-FOIQADDNSA-N	431.880	1.132	50	20	IDGD	
Cc1cc(C(N)=O)cc(C)c1C(=O)N1CCO[C@@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783946573	PTGHJKOBWUQSLM-LJQANCHMSA-N	428.316	1.650	50	20	IDGD	
Cc1ccn(C)c1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]2C1	1783969902	LRURXLDYHNGYPE-VGWMRTNUSA-N	426.355	1.958	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)ccc3O)C[C@@H]21	1783971997	HOCVPDQICVKHMY-HJXMPXNTSA-N	441.322	1.722	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3ncc[nH]3)C[C@@H]21	1783974475	OUNUHEZRCMYBCA-QPSCCSFWSA-N	427.343	1.353	50	20	IDGD	
CCC(=O)N[C@@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](Br)CC)C[C@@H]21	1784369278	BQISKJLZZKKMBE-YTFOTSKYSA-N	432.359	1.054	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)[C@H]3CC[C@H](O)CC3)CCC2)cc1)c1cccc(B(O)O)c1	1788149434	RGKFFSQHWBWKBT-OQIWPSSASA-N	436.317	1.665	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)c1cnc2[nH]ncc2c1	1788274426	KVDUKOWCTKWYIW-HBEIAFGSSA-N	440.273	1.242	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Cl)C[C@@H]21)[C@H]1ON=C(c2ccccc2)O1	1788519813	AGIPOJCPIHFNDP-LADRPBIPSA-N	425.844	1.235	50	20	IDGD	
C[C@H](Cn1cncn1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]21	1788725996	DIQIUIYNDGVVRF-ZVZLPEGASA-N	432.352	1.130	50	20	IDGD	
CC(C)n1cnc(C(=O)Nc2ccc(C3(NC(=O)c4ccc(B(O)O)cc4)CCC3)cc2)n1	1788790776	INMOQQKGHCYWFF-UHFFFAOYSA-N	447.304	1.600	50	20	IDGD	
CC(=O)N[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Cl)C[C@@H]21)c1ccc(F)cc1	1789699491	HNELCQCVXJWLTA-OGCZYDBJSA-N	443.878	1.517	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)c3ccccc3)C[C@@H]21)[C@@H](F)Br	1789922987	VTDCGAYYBIWCTO-RFBLXINOSA-N	429.286	1.390	50	20	IDGD	
C[C@H](Cc1ccccn1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]2C1	1789926650	DZSZRRFSNLTRPZ-ZAZJUGBXSA-N	442.329	1.930	50	20	IDGD	
CN[C@H](CC(=O)NC1(c2ccc(NC(=O)[C@H](F)Br)cc2)CCC1)C(=O)O	1790534948	XSXSTMPEJKDRFO-OCCSQVGLSA-N	430.274	1.874	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3n[nH]c(C4CC4)c3F)C[C@@H]21	1791056941	IOIAEPQYLRIAQT-IXOXFDKPSA-N	443.317	1.803	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1ccc(C2(NC(=O)c3cccc(=O)n3O)CCC2)cc1	1791599761	UTYNKEGTLQLVQQ-UHFFFAOYSA-N	441.488	1.206	50	20	IDGD	
C[C@@H](Cn1ccnc1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21	1791628057	IOWYLCQDDVZHOB-YTFOTSKYSA-N	431.306	1.189	50	20	IDGD	
C=C1CC(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CN(C)NC(=O)NCc2ccccc2)C3)C1	1792502814	PGQXGPGXDJWWJT-WKCHPHFGSA-N	439.560	1.937	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)[C@@H]1CCc2ccoc2C1	1793121150	TUSJSGOZKMZLIX-CNRIWFPOSA-N	429.286	1.665	50	20	IDGD	
CCOC(=O)c1c(CCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](O)CCl)C3)c[nH]c1C	1793293497	UELLQSMFTURQCV-YYIAUSFCSA-N	439.940	1.670	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1ON=C(c3ccccc3)O1)C2	1793448318	ADEVEWRPTOTDDU-JUEKAOKDSA-N	435.908	1.718	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](C)CC(N)=O	1793663786	MCEOPIRBPUBOTR-MHEUCROKSA-N	446.460	1.283	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C(=O)C1CC1)C2	1794141675	ZCYWUTHKIDUEFG-XGUBFFRZSA-N	427.929	1.736	50	20	IDGD	
C[C@H](Cn1cccn1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)CBr)C2	1794203108	DDGKALGGZUESGI-NPJQDHAYSA-N	427.343	1.140	50	20	IDGD	
CC(C)(C)n1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCBr)C3)cn1	1794349986	UXRVIAAWWQBRQK-MIFYACCESA-N	427.343	1.626	50	20	IDGD	
Cn1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)/C(C#N)=C/c2ccc(F)cc2F)C3)n1	1794791881	PRWBONYTOJIRIG-AOWDBCOTSA-N	441.438	1.509	50	20	IDGD	
COc1ccc(F)c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)c1	1796190515	HJWAUHWNLHSGDJ-BJWYYQGGSA-N	426.253	1.080	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cn[nH]c1	1797040015	TXDJDWRLKGKNLR-QDMKHBRRSA-N	427.417	1.809	50	20	IDGD	
Cn1ccc2c(O)ncc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)C(C)(C)CCl)C4)c21	1798428219	KYGIZSATOFJFPX-YWVIFJGQSA-N	434.924	1.747	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CC12CCCN1CCC2	1799211564	OFSCFFZQYOFMCG-CUSZFKRNSA-N	442.398	1.626	50	20	IDGD	
O=C1Cc2cccc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@@H](F)Br)c2N1	1799347565	SAUXISFXONKSNJ-YHYOWMERSA-N	440.269	1.075	50	20	IDGD	
Cc1cccc(C)c1NC(=O)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCC(=O)NN(C)C)C2	1800089622	BJFZVUISYDBMBJ-BCDXTJNWSA-N	443.548	1.253	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)c1ccccc1)C2	1800640188	YEKWMFVYMUHINK-QEOTZNIISA-N	425.323	1.483	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3sccn3c1)C2	1800757171	VQMUGIUOKSGCAX-DNVSUFBTSA-N	426.336	1.987	50	20	IDGD	
CC(=O)Nc1ccccc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2	1801777198	ZDINVTYGVNEXFT-ZSBFGKGUSA-N	438.322	1.633	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1CCN(C(=O)[C@H](C)n2ccnn2)[C@H]1c1cccnc1	1803013825	AOALTCDYNDRERF-OHFALNGGSA-N	449.353	1.971	50	20	IDGD	
CCOc1cnc(C(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)cn1	1803139983	AICZUQFOGULKKT-KYJSFNMBSA-N	433.896	1.190	50	20	IDGD	
C[C@H](CC(N)=O)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)CBr)[C@@H]1c1cccnc1	1803664284	YIKDMWRKTWEWET-RPCCPQHDSA-N	439.354	1.630	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC2(CCCN(C(=O)c3ccc(Cl)nc3)C2)CC1	1804663570	RGCOOZBNMBBIIL-UHFFFAOYSA-N	441.724	1.573	50	20	IDGD	
Cn1nc(C(=O)NC[C@H]2CCN(C(=O)CO[Si](C)(C)C)[C@@H]2c2cccnc2)cc1O	1804895267	IJPDYPUJFRGIAQ-DNVCBOLYSA-N	431.569	1.692	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC2(CCCN(C(=O)CCc3cc(F)ccn3)C2)CC1	1806968749	KRZNHCAFBVVSQY-UHFFFAOYSA-N	447.555	1.758	50	20	IDGD	
Cc1cc(C(=O)N2CCCC3(CCN(C(=O)c4cnccc4C(=O)NN)CC3)C2)no1	1808561660	VUTBRNFCDMLAJU-UHFFFAOYSA-N	426.477	1.140	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)c3ccn(C(F)F)n3)CC2)C1	1809978044	QFKRVADQCBPFMC-UHFFFAOYSA-N	446.263	1.117	50	20	IDGD	
O=C(c1ccn2nccc2c1)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1	1809978788	RCSIFWDNVOUFIQ-UHFFFAOYSA-N	446.316	1.173	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)Cc2c(C)n[nH]c2C)[C@H]1c1cccnc1	1810414773	UQYLMTWRCGPEMY-XKGZKEIXSA-N	433.940	1.924	50	20	IDGD	
O=C(Cn1cccc([N+](=O)[O-])c1=O)N1CCC2(CCCN(C(=O)[C@@H](F)Cl)C2)CC1	1810913151	LJFPYJPCBRHZAC-OAHLLOKOSA-N	428.848	1.522	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2ccc([N+](=O)[O-])[nH]2)[C@H]1c1cccnc1	1811619160	PNNVKDMEGSFMGV-GRDNDAEWSA-N	435.868	1.891	50	20	IDGD	
C#CCCCCC(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1813073719	LVJMVTRPFLFBDS-CVDCTZTESA-N	427.549	1.654	50	20	IDGD	
C[C@@H](CBr)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H]2CCC(=O)N2)[nH]n1	1814780328	MBAAHPSAFUUWCZ-GMXVVIOVSA-N	426.315	1.711	50	20	IDGD	
CCOC(=O)c1cc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)[C@@H](O)CCl)n[nH]2)ccn1	1814873531	PCVGFAOYJFJSBT-HOTGVXAUSA-N	449.895	1.887	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](N)CCC(N)=O)n[nH]1	1817248837	FFJATBQHYRAIJO-QAGHZCBJSA-N	433.340	1.231	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2C[C@]2(F)Cl)[nH]n1)c1cccc(B(O)O)c1	1817479347	LCLVIDHWAWFTQV-ZUEVXXBESA-N	434.664	1.320	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](F)Br)CC2	1820148870	XBKKUOGGSLIFHT-RGNHYFCHSA-N	433.303	1.436	50	20	IDGD	
CN(CC(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@](C)(Cl)CCl)n[nH]1)C(=O)C(=O)O	1820869497	WFLNWLYYTXUJCW-GTNSWQLSSA-N	448.307	1.181	50	20	IDGD	
O=C(CCN1CCOCC1)N[C@@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1	1823002803	GJFOZCMPDUMOBG-YGRLFVJLSA-N	449.346	1.468	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC[C@H]1C1CCN(C(=O)Cn2nccn2)CC1	1824093795	DEYHBMQSPVDKHH-ZBFHGGJFSA-N	426.359	1.929	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)C[C@@H]2CCCCO2)CC1	1824912393	BJBRFUXLYKCFNL-PMACEKPBSA-N	436.597	1.938	50	20	IDGD	
COc1cc(C(=O)N[C@H]2CCc3nc(NC(=O)[C@H](C)Br)sc3C2)n(C)n1	1825636122	AQFPNARLHYPHCE-IUCAKERBSA-N	442.339	1.894	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(=O)n1C)CC2	1825636418	FUHMCBWSPKEJHT-NXEZZACHSA-N	439.335	1.851	50	20	IDGD	
CC(C)(CCl)C(=O)N[C@H]1CCc2nc(NC(=O)C[C@@](C)(O)CC(=O)O)sc2C1	1826067840	KUEKVBFCUAZGCI-XTZNXHDOSA-N	431.942	1.936	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccncc1F)CC2	1826086494	WZORZNPRYWKGKR-LLVKDONJSA-N	434.497	1.276	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)c2cnccc2F)CC1	1827320444	DKDUJOTWZKMAFW-NRFANRHFSA-N	439.296	1.448	50	20	IDGD	
COCc1oncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1	1827918979	JQMJALNVECXWIU-GOSISDBHSA-N	449.552	1.427	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(O)nc(Cl)c3)C2)C1	1831643930	LSISIWLNJRUVHH-IFXJQAMLSA-N	446.331	1.918	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C)nn3CC)C2)C1	1831647262	SXGIVNYJGKCETP-JXFKEZNVSA-N	426.945	1.689	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cn(C(C)(C)C)nn3)C2)C1	1831654373	KOCRQQQSHVCTSM-MGPUTAFESA-N	441.960	1.511	50	20	IDGD	
CC[C@@H](NC(C)=O)C(=O)NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1	1833096916	LJHUXCAYQFZJSH-CVEARBPZSA-N	449.365	1.163	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](C)NC(=O)CC)CC2)CC1	1833418145	RPKSVAZARIORLZ-QAPCUYQASA-N	429.005	1.880	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccccc3O)CCO2)C1	1833758147	OOHVDXFXCGFRCR-MOPGFXCFSA-N	431.316	1.699	50	20	IDGD	
Cc1noc(C)c1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)CBr)C2)C1	1834061922	AOZIUELHFWKHEC-KZULUSFZSA-N	444.326	1.392	50	20	IDGD	
Cc1nc(C)c(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)s1	1834156550	CIORAMQSMYRTKO-INIZCTEOSA-N	428.986	1.545	50	20	IDGD	
O=C(C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1)c1ccccc1	1834706377	IBMOSRPEWOATDV-QAPCUYQASA-N	443.269	1.016	50	20	IDGD	
C[C@H](C(=O)NC1CCN(C2CCN(C(=O)[C@H](F)Cl)CC2)CC1)n1cccc1C=O	1834806934	VGKQYWFETAMBFI-KDOFPFPSSA-N	426.920	1.968	50	20	IDGD	
Cc1noc(CC(=O)NC2CCN(C3CCN(C(=O)[C@@H](C)Br)CC3)CC2)n1	1834851508	FPEHCMDCLMEQJQ-GFCCVEGCSA-N	442.358	1.276	50	20	IDGD	
Cc1nn[nH]c1C(=O)NC1CCN(C2CCN(C(=O)[C@H](C)Br)CC2)CC1	1834935431	GUBWZEBCELVAJL-NSHDSACASA-N	427.347	1.082	50	20	IDGD	
COCCOCC(=O)N1CCC(N2CCC(NC(=O)[C@@](C)(Cl)CCl)CC2)CC1	1836398573	NITXBBGOGCJEIK-IBGZPJMESA-N	438.396	1.457	50	20	IDGD	
O=C(c1ccc2ccnn2c1)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836718743	CDGMBRYTTOWULZ-IBGZPJMESA-N	434.924	1.546	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccn4ccnc4c3)CCO2)C1	1836979865	DWDOVOFCQAPRPL-NRFANRHFSA-N	434.924	1.669	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cccc(=O)n3C)CC2)CC1	1837380664	ZMJKJBIHQSSISU-QGZVFWFLSA-N	439.940	1.251	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)n1ccccc1=O)CCO2	1837681994	LJMGEQRNBUKDJD-FIKGOQFSSA-N	439.940	1.273	50	20	IDGD	
CC(C)c1cc(C(=O)N2CCOC[C@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)n[nH]1	1837715229	DBKRATLNBVPXOF-FQEVSTJZSA-N	438.601	1.455	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)CCSC(=N)N)CC2)CC1	1837865027	KGBZNGMLDYFYNW-HNNXBMFYSA-N	434.990	1.256	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccnc3S)C2)C1	1839149511	JJMKJNWPTCQYFV-ROUUACIJSA-N	448.372	1.677	50	20	IDGD	
Cc1cccnc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2	1839150438	MPDCSGZFJLEWCE-RBUKOAKNSA-N	430.332	1.696	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CCCCN3C)C2)C1	1839961874	LQOWFKDNTUNWQT-TXPKVOOTSA-N	446.386	1.101	50	20	IDGD	
Cc1ccccc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)Br)CCO2	1840034273	GQPKAOCLWBUEHJ-HNAYVOBHSA-N	425.323	1.848	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)/C(C)=C/c3cccs3)C2)C1	1840149771	ZQCHULTVZUGTFF-CLLWQVOUSA-N	442.965	1.862	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3cccc(C)c3)C2)C1	1840149995	DKXDOHRKINSAPH-DENIHFKCSA-N	438.952	1.638	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)c3ccc(O)cc3)C2)C1	1840154731	FCEKPCSWKRRAJL-FYINFDKHSA-N	440.924	1.206	50	20	IDGD	
O=C(Cc1cccc(Cl)n1)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840186610	RKRAAFRCJCOSSD-QGZVFWFLSA-N	436.723	1.538	50	20	IDGD	
C[C@H](Cc1ccncc1)C(=O)N1CCOC[C@@]2(CN(C(=O)C(Cl)Cl)CCO2)C1	1840189833	OASLNMSTGNIGLM-KUHUBIRLSA-N	430.332	1.520	50	20	IDGD	
CCCN1CCN(c2ccc(C(=O)N3CC4(CCCN4C(=O)[C@@H](O)CCl)C3)cc2)CC1	1841353166	IEZZHIXDUZEHSJ-FQEVSTJZSA-N	448.995	1.635	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)c2cnn(C(C)(C)C)c2Cl)C1	1842259338	XKXBNUNDGVTTBE-UHFFFAOYSA-N	438.960	1.482	50	20	IDGD	
O=C([C@@H](O)CCl)N1CC2(CCCN2C(=O)c2cnn3c(-c4ccsc4)ccnc23)C1	1843217001	RBFRKCVCAHPSOD-INIZCTEOSA-N	445.932	1.875	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@](C)(C(=O)N2CCCC23CN(C(=O)[C@H](F)Cl)C3)[C@H](O)C1	1843982869	XEYVQPJRMDLXRG-TYILLQQXSA-N	447.935	1.732	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC12CN(C(=O)[C@@H](O)NC(=O)OC(C)(C)C)C2	1846071933	WCQXJODHEDBIQA-NWDGAFQWSA-N	434.331	1.206	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCc2ccc(S(N)(=O)=O)cc2)ccc1OC(C)C	10577624	GLGRCGBDPMVPAM-UHFFFAOYSA-N	436.490	1.274	50	20	IDGD	
O=C(COC(=O)COc1ccc2ccc(=O)oc2c1)NNC(=O)c1ccc(Cl)cc1	10988451	BJCUPUZDMTXZSO-UHFFFAOYSA-N	430.800	1.830	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(C)nc3onc(C)c23)c1	22006488	BOHAUDZTFBZCJS-UHFFFAOYSA-N	445.501	1.945	50	20	IDGD	
Cc1ccc(S(=O)(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)c(Cl)c1	22514008	OLTIEGZUNLFFMY-UHFFFAOYSA-N	430.939	1.873	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCN(Cc3ccccc3C)CC2)cc1OC	29053222	RNJNDQIKLRMBBR-UHFFFAOYSA-N	426.517	1.591	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)Cc2cnn(-c3ccccc3)c2)ccc1Cl	29227650	KNXYQEBDXZLALN-UHFFFAOYSA-N	433.877	1.177	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CCN2C(=O)c3ccccc3C2=O)ccc1OC(C)C	104740590	HDDWGRSNXJTEQY-UHFFFAOYSA-N	425.441	1.930	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)C[C@@H]2C(=O)Nc3ccccc32)c1	116343642	BRHBXZOVILOHCB-KRWDZBQOSA-N	444.513	1.604	50	20	IDGD	
CC[C@H](C)C(=O)N1Cc2ccccc2C[C@@H]1C(=O)NNC(=O)CNC(=O)c1cccs1	725739866	NUHLHBUTWGLEBH-WMLDXEAASA-N	442.541	1.625	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)CNC(=O)c1cccs1)c1ccc(N2CCOC2=O)cc1	726244180	LCFHZDIHGJGIOV-LBPRGKRZSA-N	431.474	1.526	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)c2cc(C)nc3c2c(O)nn3C)c1	728527946	UKYYUKXCXIVOPH-UHFFFAOYSA-N	434.250	1.828	50	20	IDGD	
O=C(NNC(=O)[C@H](c1ccccc1)N1CCSCC1)C1CCN(c2ncccn2)CC1	728889641	DNUGHXRDUJTRDA-IBGZPJMESA-N	440.573	1.631	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)Cc2c(C)nc(-c3ncccn3)nc2O)c1C	729283110	OMOUDQHYWBHROV-OAHLLOKOSA-N	436.472	1.722	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)NCCN2CCOC[C@@H]2C)c2ccccc2c1=O	729613749	HGQNMLADGWKAQN-INIZCTEOSA-N	444.536	1.251	50	20	IDGD	
COc1ccc(CN2C(=O)c3ccccc3C2=O)cc1C(=O)NNC(=O)Cc1cc[nH]n1	730091783	VVRKTQCIOHGVND-UHFFFAOYSA-N	433.424	1.218	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1ccc(C(=O)NNC(=O)c2c[nH]nc2C)cc1	731853291	ZMFUHYVHMBFZCM-UHFFFAOYSA-N	429.458	1.602	50	20	IDGD	
Cc1c(NC(=O)CSCC(=O)NNC(=O)C2CCC2)c(=O)n(-c2ccccc2)n1C	732141706	NJTDUODXIJJZGW-UHFFFAOYSA-N	431.518	1.104	50	20	IDGD	
CN(C)[C@H](CNC(=O)NNC(=O)COc1ccccc1[N+](=O)[O-])c1c(F)cccc1F	734675958	RFQIJOGQOUSIJI-OAHLLOKOSA-N	437.403	1.885	50	20	IDGD	
CCn1c(NNC(=O)[C@H](C)CS(=O)(=O)c2ccc(OC)cc2)nc2ccccc2c1=O	735032546	RQNPCIIHVCJDAE-CQSZACIVSA-N	444.513	1.978	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NNC(=O)COCc2ccccc2)cc1	737636318	JMQFQIZSRPQYSZ-IBGZPJMESA-N	431.514	1.512	50	20	IDGD	
O=C(NCCNc1nccc(C(F)(F)F)n1)NNC(=O)c1cc(Br)c[nH]1	738450653	PEPSUEQYIFKTFF-UHFFFAOYSA-N	436.192	1.642	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)N1CCN(CC(=O)Nc2ccc(F)cc2)CC1	738495101	DPSQHOZYFVKYGF-UHFFFAOYSA-N	443.479	1.339	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)c2ccc(C[C@@H]3CC(=O)NC3=O)cc2)cc1	741144113	FNMNKEHBZRZDDP-WMLDXEAASA-N	439.468	1.519	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)[C@H]2CCCN(C(=O)COc3ccccc3)C2)c1O	741279457	SOLYTHHINFVSBP-HNNXBMFYSA-N	427.457	1.479	50	20	IDGD	
CC(=O)N[C@H](CC(=O)NNC(=O)Cc1nc2ccccc2n1C)c1ccc(F)cc1F	741659706	DNNNPWJSJVTNOS-QGZVFWFLSA-N	429.427	1.809	50	20	IDGD	
Cc1ccc(F)c(NC(=S)NNC(=O)CCNS(=O)(=O)c2ccc(F)cc2)c1	745204836	LZRHOBIYEQKGQN-UHFFFAOYSA-N	428.486	1.959	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@H]2C(=O)NNC(=O)CCOc2ccccc2)c(OC)c1	747177853	XYUBFTGOFLSSHQ-IBGZPJMESA-N	441.484	1.925	50	20	IDGD	
Cc1cc(C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)c(F)cc1F	748850269	RYXVQFYVOYZONH-UHFFFAOYSA-N	425.461	1.361	50	20	IDGD	
CS(=O)(=O)N1CCN(CCNC(=O)NNc2nc(Cl)c(Cl)cc2Cl)CC1	749354012	RYRPEGRJDFDZAO-UHFFFAOYSA-N	445.760	1.245	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)COc1ccc(S(N)(=O)=O)cc1	749403250	GYOYXSCPTFZJGA-UHFFFAOYSA-N	446.510	1.606	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)c2ccc3nc(O)n(C)c3c2)cc1	751540088	FCCPLEOJFLFTNT-UHFFFAOYSA-N	437.485	1.775	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NCc1nccn1CCc1ccccc1	751607855	QKDHQPUVUPKKHU-UHFFFAOYSA-N	426.502	1.448	50	20	IDGD	
COc1ccc(-c2nn(Cc3ccccc3)cc2C(=O)NNC(=O)CN2CCCC2=O)cc1	751618475	QDAUWCMPMFKRAH-UHFFFAOYSA-N	447.495	1.990	50	20	IDGD	
C[C@H]1C[C@@H](CCNC(=O)NNC(=O)CNC(=O)c2ccco2)CN1Cc1ccccc1	753046573	MAQVVLIGLVOGNO-FUHWJXTLSA-N	427.505	1.641	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N[C@H]2CC[C@H](O)CC2)cc1	753728368	LYUITHDQKBHDBZ-OMOURIDESA-N	437.500	1.761	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)NC1CCN(S(=O)(=O)C(F)(F)F)CC1)c1ccccc1	755305348	YXUKDOUEEOQUHP-CQSZACIVSA-N	436.456	1.825	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)Nc1ccc(C(=O)N2CCOCC2)cc1	755934337	SOIXFEJYNPPOGC-UHFFFAOYSA-N	426.429	1.397	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)Nc1nnc(SCc2ccc(C#N)cc2)s1	756025076	GFLKEYNHEACSHX-NSHDSACASA-N	436.519	1.906	50	20	IDGD	
CN1CCCCC/C1=N/S(=O)(=O)c1cccc(NC(=O)NNC(=O)c2cnccn2)c1	756166495	PIVOAPYTABOYPA-UQQQWYQISA-N	445.505	1.536	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)Nc1cccnc1-n1cncn1	756292041	OMRMOCMZOVNNDH-UHFFFAOYSA-N	432.238	1.657	50	20	IDGD	
COC(=O)CN1CCN(c2ccc(NC(=O)NNC(=O)c3ccccc3O)cc2)CC1	756394757	XBJZNTWZCTXUSX-UHFFFAOYSA-N	427.461	1.154	50	20	IDGD	
CC[C@@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(CC)CC)c1)[C@H]1CCCO1	756730513	UJUOTQYTAHCAJW-IAGOWNOFSA-N	426.539	1.619	50	20	IDGD	
COC(=O)c1cc(NC(=O)NNC(=O)COc2ccc(OC)cc2)c(OC)c(OC)c1	756741407	DQRJVHUKFGTJSD-UHFFFAOYSA-N	433.417	1.731	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)Nc1cc(F)c(F)cc1I	756820497	XLLRVBACRHXOQX-SSDOTTSWSA-N	443.188	1.774	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)Nc2cnc(OC)c(C(N)=O)c2)cc1OC	757693248	TYULPLHVESVIBW-UHFFFAOYSA-N	431.449	1.843	50	20	IDGD	
Cc1ccc(CNC(=O)NNC(=O)CNC(=O)c2ccco2)c(OC[C@H]2CCCO2)c1	757733882	RPHUCHHOIGNJAM-MRXNPFEDSA-N	430.461	1.406	50	20	IDGD	
O=C(Cc1ccccn1)NNC(=O)Nc1cccc(S(=O)(=O)NCc2ccco2)c1	757863104	NQFQZTGOZCUASS-UHFFFAOYSA-N	429.458	1.549	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)N[C@@H]2CN(C(=O)OC(C)(C)C)C[C@H]2C#N)c1	758755167	SKNSTDZISOXBFI-CZUORRHYSA-N	433.465	1.407	50	20	IDGD	
C[C@@H](O)C[C@@H](CNC(=O)NNC(=O)c1csc(N2CCOCC2)n1)c1ccccc1	759608785	CSWBKLUYWSWPQF-ZBFHGGJFSA-N	433.534	1.478	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)c2cn(CCOc3ccc(C=O)cc3Cl)nn2)nc1	759728749	IKDMOWJPVYEXIK-UHFFFAOYSA-N	444.835	1.762	50	20	IDGD	
COCCC(C)(C)CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	760165955	NBBJJSCDXSCZDJ-UHFFFAOYSA-N	440.566	1.868	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNS(=O)(=O)c2cccc([N+](=O)[O-])c2C#N)cc1	760336078	WTUZGTZTSADYKP-GFCCVEGCSA-N	434.430	1.642	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)CCNC(=O)OC(C)(C)C)c(-c2ccc([N+](=O)[O-])cc2)n1	760443196	ROXZCVLCQDGHLX-UHFFFAOYSA-N	432.437	1.671	50	20	IDGD	
CCn1c(=O)n(CC)c2nc(NC(=O)CCC(=O)NNC(=O)c3ccccc3F)ccc21	761135347	JBJIPILRMOTEDH-UHFFFAOYSA-N	442.451	1.557	50	20	IDGD	
COC(=O)CCSc1ccc([N+](=O)[O-])cc1C(=O)NNC(=O)C(=O)Nc1ccccn1	763007468	DXWHDEYADJNAFT-UHFFFAOYSA-N	447.429	1.045	50	20	IDGD	
CNS(=O)(=O)c1ccc(-c2ccc(C=NNC(=O)CNC(=O)c3cccnc3)o2)cc1	763204966	VOZLVOVUDRKGRN-UHFFFAOYSA-N	441.469	1.130	50	20	IDGD	
O=C(NNC(=O)c1ccccc1F)C(=O)Nc1ccc(F)c(-n2nnnc2C2CC2)c1	763561979	QTJBHRBCNXMHMZ-UHFFFAOYSA-N	427.371	1.218	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2cc(C)nn2C2CCOCC2)c1	763649988	PCKPUXXQZCYPQI-UHFFFAOYSA-N	429.477	1.325	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cnn(-c3ccccc3F)c2)cc1	763658794	CBDOQHJUAUJIIE-UHFFFAOYSA-N	427.392	1.185	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(SC(F)F)nc2)cc1	763662101	UMDQZTQMAVSZOO-UHFFFAOYSA-N	426.401	1.570	50	20	IDGD	
O=C(COc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1ccccc1CN1CCOCC1	763684254	HYJCUEZXZHKKAG-UHFFFAOYSA-N	446.891	1.337	50	20	IDGD	
C[S@@](=O)c1cccc(NC(=O)C(=O)NNC(=O)CSc2ccc(Cl)cc2)c1	763736458	UVSIBWJATAJDEH-HHHXNRCGSA-N	425.919	1.956	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)C(=O)Nc2cccc(F)c2)c2ccccc2c1=O	763801393	QQQYQLSLZYSUHF-UHFFFAOYSA-N	425.420	1.735	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])cnn1-c1ccccc1	763802934	CUAPLYTXGRMSTK-UHFFFAOYSA-N	438.400	1.254	50	20	IDGD	
Cc1nc(COc2ccc(NC(=O)C(=O)NNC(=O)COc3ccc(F)cc3)cc2)no1	763838188	PNJONIOREJAUIP-UHFFFAOYSA-N	443.391	1.261	50	20	IDGD	
CC(=O)N1CCCc2cc(NC(=O)C(=O)NNC(=O)c3cc(Br)c[nH]3)ccc21	763997113	VVYWFRYWGOSXBI-UHFFFAOYSA-N	448.277	1.476	50	20	IDGD	
O=C(NNC(=O)c1cccc(Br)c1)C(=O)Nc1cccc(-n2ccnn2)c1	764062928	GJWYVJAWXMTSKE-UHFFFAOYSA-N	429.234	1.430	50	20	IDGD	
COC(=O)c1c(F)cccc1NC(=O)C(=O)NNC(=O)c1cccc(Br)c1	764063567	RZFCEGHQIAUGHQ-UHFFFAOYSA-N	438.209	1.775	50	20	IDGD	
CC[C@@H](C)C(=O)NNC(=O)C(=O)Nc1cc(Br)cnc1OCC(F)(F)F	764081959	LJAHIPXYTGLKPR-SSDOTTSWSA-N	441.204	1.917	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)CCc2ccc(OC)cc2)c(F)cc1F	764127128	OKXROXWLXPNIGY-UHFFFAOYSA-N	435.383	1.479	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)C(=O)Nc1ccnn1Cc1ccc(C(F)(F)F)cc1	764269053	SDDINLDKTDDLMD-UHFFFAOYSA-N	446.389	1.674	50	20	IDGD	
COc1ccsc1C=NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1	764819171	PHYRTERTTPRGCZ-UHFFFAOYSA-N	436.559	1.522	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)c1nc(N2CCCC2)ncc1Cl	765317640	RUJHSTNUVSUSPO-UHFFFAOYSA-N	426.905	1.796	50	20	IDGD	
CN(CC(=O)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1)S(=O)(=O)c1ccccc1	765607105	JNRMMZCHMWLDJC-UHFFFAOYSA-N	431.449	1.298	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1cccn1Cc1ccncc1	766653302	SGEQALWABDSJOC-UHFFFAOYSA-N	446.511	1.150	50	20	IDGD	
O=C(NCCOc1ccc(S(=O)(=O)C(F)(F)F)cc1)NNC(=O)c1ccccc1O	766826644	FLRZNOYICSSINX-UHFFFAOYSA-N	447.391	1.709	50	20	IDGD	
CCn1c(=O)oc2cc(S(=O)(=O)NNC(=O)c3cccc(OC(F)F)c3)ccc21	767464366	WTHICVAPUSAIGB-UHFFFAOYSA-N	427.385	1.839	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)N[C@@H]1CCOC2(CCOCC2)C1	769208321	WANXLOOBPOTZPY-CQSZACIVSA-N	442.310	1.887	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)[C@@H](C)N2C(=O)c3ccc(Br)cc3C2=O)c(O)c1	769650393	IVFJNOGWXXMMJC-SNVBAGLBSA-N	446.257	1.909	50	20	IDGD	
CNS(=O)(=O)c1ccc(C(=O)NNC(=O)[C@@H](C)Oc2c(C)cc(Cl)cc2C)cn1	770219821	NARPXVNTQKYHHX-GFCCVEGCSA-N	440.909	1.488	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)NCc2nc(COc3ccccc3)n[nH]2)c1	771376914	KNJRUGXUBNVRPN-UHFFFAOYSA-N	426.433	1.545	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1ccccc1S(=O)(=O)N(C)c1ccccc1	771861439	XXGFJHMIVYZWOI-CQSZACIVSA-N	433.486	1.614	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)[C@@H]1CC(=O)N(c2ccc(Cl)c(F)c2)C1	772235769	NRWZBEAIQRNFRK-VXGBXAGGSA-N	427.860	1.957	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)c1ccc(CSc2nc[nH]n2)cc1	772898832	SRLKNYJPENHZKI-UHFFFAOYSA-N	444.904	1.828	50	20	IDGD	
Cc1sc(=O)n(CCC(=O)NNC(=O)[C@H]2CCCN(C(=O)OC(C)(C)C)C2)c1C	773416510	BTHUMNUBVDGGRY-AWEZNQCLSA-N	426.539	1.711	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)C(=O)Nc2ccc3nc(N4CCOCC4)sc3c2)n1	773478686	KRHUDKFZKVVVAE-UHFFFAOYSA-N	427.490	1.622	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2cc3c(cc2Br)CCC3)CCS(=O)(=O)C1	773642880	AMNIZHVVBJJJLG-INIZCTEOSA-N	430.324	1.074	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@H]2CCCO[C@H]2CC(C)C)cc1	776259902	SYWUZKSLEXZPFP-ROUUACIJSA-N	440.566	1.540	50	20	IDGD	
CN1CCN([C@H](CNC(=O)NNc2cccc(S(C)(=O)=O)c2)c2cccs2)CC1	776609024	WZDFSMZMAZEFHY-QGZVFWFLSA-N	437.591	1.766	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])o2)nc1C	778425348	RAIAJWHOBJTESM-LBPRGKRZSA-N	432.393	1.211	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N[C@@H](CO)c1cnn(C)c1	778589749	RNRGTEFUIJNZEA-HZMBPMFUSA-N	426.271	1.014	50	20	IDGD	
COc1cc(OC)cc(N2CC[C@@H](NC(=O)NNC(=O)CNC(=O)OC(C)(C)C)C2)c1	778687843	FQNMINZMTLLDLG-CYBMUJFWSA-N	437.497	1.138	50	20	IDGD	
CC[C@H](C)[C@@H](C)C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	779719196	LEJTXBHXBYBZLD-JKSUJKDBSA-N	425.551	1.470	50	20	IDGD	
CC(=NNC(=O)CCNC(=O)OC(C)(C)C)c1c(C)nn(CCS(C)(=O)=O)c1C	779806151	DRYQTZPOGWEHHO-UHFFFAOYSA-N	429.543	1.300	50	20	IDGD	
O=C(NNc1ncc(Cl)cc1Cl)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(F)cc1	781032796	QYIBJIYHYPHDLK-RISCZKNCSA-N	449.291	1.795	50	20	IDGD	
CN(C)CCc1ccccc1NC(=O)C(=O)NNC(=O)c1cccc(Br)c1	782702111	FZMKIDGBINRTBQ-UHFFFAOYSA-N	433.306	1.953	50	20	IDGD	
COc1cc(Br)c(NC(=O)C(=O)NNC(=O)c2ccc(O)cc2)cc1OC	782831298	CZTIPUVEXBPGGR-UHFFFAOYSA-N	438.234	1.572	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C(=O)Nc2cccc(N3CCCC3=O)c2)nc2ccccc21	782894613	QMWCLEAAQUNAKM-UHFFFAOYSA-N	434.456	1.029	50	20	IDGD	
CN1CCN(C(=O)c2ccc(NC(=O)C(=O)NNc3nccc4sccc34)cc2)CC1	783438098	MSTVIAQDRQTCCP-UHFFFAOYSA-N	438.513	1.766	50	20	IDGD	
O=C(COC(=O)c1ccc(C(F)(F)F)c(F)c1)NNC(=O)[C@@H]1COc2ccccc2O1	784252327	NPZGANJWSNYLFI-HNNXBMFYSA-N	442.321	1.989	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](n2cc(C(=O)NNC(=O)Cc3cccnc3)cn2)C1	784647717	UVTYSPCDAOAMRI-KRWDZBQOSA-N	428.493	1.854	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNc2ccccc2Cl)ccc1S(=O)(=O)N(C)C	784779115	AZWDETAITPUDJX-UHFFFAOYSA-N	426.882	1.681	50	20	IDGD	
COc1cc(OC)c(OC)cc1NC(=O)C(=O)NNc1ccnc(Br)c1	784837292	LJLUTRWQKPWTCH-UHFFFAOYSA-N	425.239	1.952	50	20	IDGD	
Cn1nccc1COCC(=O)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1	786026312	BEMSNPCGBMTMRC-QFIPXVFZSA-N	433.512	1.711	50	20	IDGD	
Cn1nc([C@@H]2CCCO2)cc1NC(=O)C(=O)NNC(=O)C1=S=C2CCCCCC2=C1	789731146	DHQDZKOYNZXXLT-AWEZNQCLSA-N	431.518	1.340	50	20	IDGD	
CC(C)Oc1cc(NC(=O)C(=O)NNC(=O)c2cccc3cccnc23)ccc1C(N)=O	789734018	YVEBHKMCPPZDOO-UHFFFAOYSA-N	435.440	1.521	50	20	IDGD	
COc1cc(NNC(=O)C(=O)Nc2cccc3c2CCN3S(C)(=O)=O)ccc1Cl	789804404	BTSVNBOLPBKTKZ-UHFFFAOYSA-N	438.893	1.753	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC(C(=O)NNc3nc4ccccn4n3)CC2)cc1C	791247825	BHUICYNWYXVJJV-UHFFFAOYSA-N	428.518	1.890	50	20	IDGD	
CNC(=O)c1cc2cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc3ccccc3F)ccc2[nH]1	792352762	JIWIYTZIRQFLCZ-NSHDSACASA-N	441.419	1.220	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNc3ccc4c(=O)[nH]ccc4c3)cn2)C[C@@H](C)O1	793064447	AONPXYRNDHHNJY-OKILXGFUSA-N	436.472	1.619	50	20	IDGD	
Cc1c(C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)sc2nc3n(c(=O)c12)CCC3	794720064	KFZJMSAKOSJAIX-UHFFFAOYSA-N	447.542	1.720	50	20	IDGD	
CNC(=O)COc1ccc(NC(=O)C(=O)NNc2ccc(C(F)(F)F)cn2)c(C)c1	797017267	QUHUAAWASWKBFS-UHFFFAOYSA-N	425.367	1.615	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@@H](C(=O)NNC(=O)c3ccc(C)c(O)c3)C2)cc1	797358552	RFJIECCMNLLVGO-QGZVFWFLSA-N	431.514	1.871	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(C)cc2)ccc1OCC(=O)NC(C)C	801109525	RJYBQUIALOQBON-UHFFFAOYSA-N	442.472	1.307	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)NCc1cc(F)c(F)cc1Br	805044461	SYLFFFXYVLUWGW-UHFFFAOYSA-N	431.193	1.581	50	20	IDGD	
COc1ccc(-n2c(C)cc(/C=C(/C#N)C(=O)OCCn3cc(C(N)=O)nn3)c2C)cc1	805944155	GXDNNPHFRNOTNZ-BOPFTXTBSA-N	434.456	1.944	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(NC(=O)NNC(=O)Cc2c[nH]c3ccccc23)ccc1F	806543282	POPWCJLLLWEJIR-UHFFFAOYSA-N	433.465	1.953	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(F)c(N3CCCNC3=O)c2)cc1	806974633	PYOLQOHYLGDXQR-UHFFFAOYSA-N	427.436	1.708	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccccc2O[C@H](C)C(F)(F)F)n1	806974808	HCESEIRCJBTLCV-GFCCVEGCSA-N	427.383	1.616	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)C(=O)N=c1ccnc2n(C)[nH]cc1-2	806975303	TUTXCTZCBCFZAP-CYBMUJFWSA-N	432.440	1.048	50	20	IDGD	
COC(=O)c1c(C)csc1NC(=O)C(=O)NNC(=O)c1cc(Br)cn1C	806977008	RMTXUGFJIXJZAR-UHFFFAOYSA-N	443.279	1.344	50	20	IDGD	
CCOC(=O)c1ccc(C(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)cc1	810593784	IPNRBIAJQOWSGK-UHFFFAOYSA-N	438.528	1.751	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)CNS(=O)(=O)c1ccc(Cl)cc1	810813115	KDVPYJUYDXKZPT-UHFFFAOYSA-N	448.929	1.071	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)[C@@](N)(c2cccc(F)c2)C(F)(F)F)cc1	812730590	OFFPHXWXQLHYBF-INIZCTEOSA-N	434.415	1.936	50	20	IDGD	
NS(=O)(=O)c1ccc(NC(=O)NN=Cc2cc3c(cc2OC(F)F)OCO3)cc1	814969112	GPFOYGHIGZFXTG-UHFFFAOYSA-N	428.373	1.820	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])cc(OC)c1C	815566319	PUYSUYVTTCBIOO-UHFFFAOYSA-N	432.389	1.085	50	20	IDGD	
Cc1cccc(N2CCN(CCC(=O)NNc3ccccc3S(=O)(=O)N(C)C)CC2)c1	817055043	JIQJOQDTEXBIRZ-UHFFFAOYSA-N	445.589	1.901	50	20	IDGD	
C[C@H](CN1CCCCC1)C(=O)NN=Cc1c(N2CCOCC2)nc2ccccn2c1=O	874091581	SBZPWKUMBJXPJM-QGZVFWFLSA-N	426.521	1.103	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)[C@H](C)Oc2cccc(Br)c2)ccc1-n1cnnn1	914749306	MYOUYNCBOWVNDD-LBPRGKRZSA-N	445.277	1.962	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1ccc(Cl)cc1)C(=O)NNC(=O)Cc1c[nH]c2ccccc12	915788445	JGLBKYLCBJJQCL-GFCCVEGCSA-N	434.905	1.878	50	20	IDGD	
Cc1ccc(C)n1-c1nc(CC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cs1	915857433	DSWXQDFOQDRVRN-UHFFFAOYSA-N	432.527	1.958	50	20	IDGD	
Cn1ccnc1[C@H](NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)c1ccccc1F	916223807	DPNSNSNQMUPHGX-QGZVFWFLSA-N	449.446	1.540	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CC(=O)N(c2ccc(Cl)cc2)C1)c1nnc(O)c2ccccc12	916720348	RFQDSQZNRSOMQV-LLVKDONJSA-N	425.832	1.803	50	20	IDGD	
CCC[C@H](C)N1C[C@@H](C(=O)NNC(=O)c2nn(CCC)c(=O)c3ccccc23)CC1=O	917519033	HDZTYSTWQMYJPE-GJZGRUSLSA-N	427.505	1.605	50	20	IDGD	
CCC(CC)C(=O)N1CCC(NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)CC1	918232484	XILDHHLIPIKMPS-UHFFFAOYSA-N	428.497	1.034	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)c1cc(S(=O)(=O)N2CCCCC2)cn1C	919822935	VMANEZHITLLCOC-UHFFFAOYSA-N	434.518	1.212	50	20	IDGD	
N#Cc1ccccc1Sc1ccccc1C(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1	919889357	LKSDSLLSMYHZAM-CQSZACIVSA-N	430.511	1.841	50	20	IDGD	
COCCN1CCC(NC(=O)NNC(=O)[C@H](C)Oc2cccc(Br)c2)CC1	920814226	ILTSCMWPWBPSSV-ZDUSSCGKSA-N	443.342	1.658	50	20	IDGD	
O=C(NCCS(=O)(=O)Cc1ccccc1)NNC(=O)c1cncn1-c1ccccc1	1115890715	NQZCOQMHIWORJI-UHFFFAOYSA-N	427.486	1.431	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)Nc1ccnn1C[C@H]1CCOC1	1116654665	KDTXADDNMOAAAY-GOSISDBHSA-N	441.536	1.285	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCCN1Cc1ccncc1)c1csc(N2CCOCC2)n1	1318332985	HGZGXKAAEWSQNI-QGZVFWFLSA-N	430.534	1.190	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)NNC(=O)N[C@H]1CCO[C@@]2(CCS(=O)(=O)C2)C1	1319836001	ISVRWBJYGBKOCS-YOEHRIQHSA-N	430.914	1.090	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccnc(Cl)n3)C2)C1	1779505569	WHOHSBWCBLUEBB-MEDUHNTESA-N	431.718	1.747	50	20	IDGD	
COc1cc(C(=O)N2CC[C@@]3(CN(C(=O)CCBr)CCO3)C2)ccc1O	1780747598	JNOJBBFHCLTUMX-GOSISDBHSA-N	427.295	1.629	50	20	IDGD	
C=C[C@@H](O)C(C)(C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Br)C1	1780774706	IVOVNMZNJUQEES-ZUMXRPEOSA-N	435.334	1.764	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@](C)(Cl)CCl)C2)C1	1781233246	ROFXFONXCSGUKU-OAUYIBNBSA-N	425.309	1.614	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc3cccnn3c2)C1	1781328992	UMEYIXRMZLFKLW-WAOWUJCRSA-N	434.924	1.716	50	20	IDGD	
O=C([C@@H](F)Br)N1CCO[C@@]2(CCN(C(=O)C3(Br)CC3)C2)C1	1781347411	UEDLGCNSLYIOPZ-SKDRFNHKSA-N	428.096	1.434	50	20	IDGD	
COc1cc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)c(F)c(OC)c1F	1781946263	FZRPRFKMTDFBFJ-BUXKBTBVSA-N	448.850	1.025	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccnc4c3OCO4)CCO2)C1	1783352816	SWTVTKBNCNJVTJ-UGSOOPFHSA-N	440.294	1.427	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1783399852	JCIKXMSPWMRFEN-WBMJQRKESA-N	438.294	1.032	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)Cc3ccc4c(c3)OCO4)CCO2)C1	1783532576	KOZSDVNBVDSJAA-DJJJIMSYSA-N	439.306	1.571	50	20	IDGD	
COc1ccc(CC(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](C)Br)C3)C2)cc1F	1783540106	RSWXVWITQPMSDO-BFUOFWGJSA-N	443.313	1.990	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3csc4c3CCCO4)CCO2)C1	1783874235	AYJBGOKRIYDXAW-DNVCBOLYSA-N	428.938	1.770	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]3C2)nc2ccccc12	1784093176	QZFDKCODFQXVCP-UQOODKLHSA-N	431.920	1.736	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc4nc[nH]c34)C[C@@H]21	1786405771	BBTVRMYJGSNFIT-NOLJZWGESA-N	435.322	1.941	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc([N+](=O)[O-])[nH]3)C[C@@H]21	1791058815	GXMIJUUFQAEPKL-ZPFDUUQYSA-N	429.271	1.300	50	20	IDGD	
COc1nc(C)ccc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]2C1	1791059327	UDRQYPYZUQDUDK-VRKREXBASA-N	440.338	1.775	50	20	IDGD	
C[C@H](C(=O)NC1(c2ccc(NC(=O)CCC(=O)NN(C)C)cc2)CCC1)n1cncn1	1791603224	LIVYACBMRFNMTD-OAHLLOKOSA-N	427.509	1.346	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(F)nc1F	1792376776	OJQXFMGOMOYTNW-IQOUGMIPSA-N	432.265	1.737	50	20	IDGD	
C[C@H](Nc1ccccn1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)CBr	1792870680	IIVNRSPCDJWAGF-JGFGOLAASA-N	439.354	1.503	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CC13CCCN1CCC3)C2	1792874059	KEXUXLDMXUXRJF-CUSZFKRNSA-N	442.398	1.626	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ncon1)C2	1794142438	MNKWUDXQBVSDHO-RNJOBUHISA-N	427.889	1.454	50	20	IDGD	
COc1ccc(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)cc1C	1796188083	ZWDSDMCKSYCYMK-WKCHPHFGSA-N	436.317	1.178	50	20	IDGD	
C[C@H](Nc1nccs1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2	1796414727	DTXSFBIZWVPQAW-SVNGYHJRSA-N	435.319	1.224	50	20	IDGD	
COc1nc(C)ccc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@](C)(Cl)CCl)C2	1798249778	TUVUTXVOFCMNKG-FCIKYMEBSA-N	430.332	1.838	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](C)NC(=O)c1cnccn1	1798554010	RRWCEZBAIGDHHO-YHQUGGNUSA-N	438.326	1.017	50	20	IDGD	
C[C@H](NC(=O)c1ccccn1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CO[Si](C)(C)C	1798628954	RXOAVZXNHDGRLM-NXOAAHMSSA-N	432.597	1.690	50	20	IDGD	
C[C@@H](NNc1ccccc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@](C)(Cl)CCl	1799273707	OMKAJOJDZDKLSK-YKORFQDJSA-N	443.375	1.818	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc3ccnn13)C2	1799279562	RCZYQKJMZGHRSA-AODNKKSCSA-N	425.316	1.774	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccnc1CS(C)(=O)=O)C2	1800069321	DCYSVUDIJZADEI-HLPPOEQASA-N	427.954	1.895	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccccc1O)C2	1800644453	UNEFKUDFOBJMMQ-BASYENTBSA-N	425.323	1.698	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@]1(F)CCCCC1(F)F)C2	1800978076	LDKZAPDVQIDCOF-WLZFUECHSA-N	426.863	1.747	50	20	IDGD	
COC(=O)NCC(=O)N1CC[C@H](CNC(=O)[C@@H](C)CBr)[C@@H]1c1cccnc1	1803018194	YLMPZGNXORJWSH-BJJXKVORSA-N	441.326	1.474	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cc(O)cc([N+](=O)[O-])c2)[C@H]1c1cccnc1)[C@@H](O)CCl	1803141274	NWBNZZOKTOAQSC-KKXDTOCCSA-N	448.863	1.615	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cn3c(F)cccc3n2)[C@H]1c1cccnc1)[C@H](O)CCl	1803148968	ZFCVELZPZXKVGL-GMBSWORKSA-N	445.882	1.788	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCC2(CCCN(C(=O)[C@H](C)NS(=O)(=O)CC)C2)CC1	1805954218	RRTAWSXGFXKYHI-JKSUJKDBSA-N	436.018	1.953	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)C#Cc2ccccc2)[C@H]1c1cccnc1	1806621514	ADBACZSLBQBLCO-PXDATVDWSA-N	447.539	1.512	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)[C@@H](O)Cc1ccccc1	1812769415	XXIPGRPBBKJYBO-VNTMZGSJSA-N	431.920	1.291	50	20	IDGD	
C[C@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)CN3CCOCC3)sc2C1	1814572674	VMORZOSNDULJFK-QWRGUYRKSA-N	431.356	1.171	50	20	IDGD	
C[C@@]1(C(=O)N[C@@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)CC1(F)F	1815347883	VJKXOCZWLKXXKK-XIKOKIGWSA-N	435.261	1.094	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccn3c(O)nnc23)[nH]n1	1822369487	OLRDTVDJYLYUQA-GXTWGEPZSA-N	447.883	1.718	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCCC[C@H]1c1cc(NC(=O)CN2C(=O)C=CC2=O)n[nH]1	1822529976	PQYIALJDKIXLHG-AWEZNQCLSA-N	433.541	1.178	50	20	IDGD	
CC(=O)N(C)CCC(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1	1823003335	YJFDIRZFJMDTAB-TVQRCGJNSA-N	435.319	1.614	50	20	IDGD	
COc1ccc([C@H](O)C(=O)N2CCCC[C@@H]2C2CCN(C(=O)[C@H](O)CCl)CC2)cc1	1823948785	CSWBQYAFRRIMSR-AQNXPRMDSA-N	438.952	1.948	50	20	IDGD	
O=C([C@@H]1CC(c2ccccc2)=NN1)N1CCC([C@H]2CCCCN2C(=O)[C@H](O)CCl)CC1	1824187918	LJTJPDAOYTZQOL-PWRODBHTSA-N	446.979	1.972	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(CO)on1)CC2	1825645753	JETBXAMJZKBFTQ-SFYZADRCSA-N	429.296	1.633	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cncnc2)CC1	1826021156	GZCMAKFZLWALTJ-IBGZPJMESA-N	437.504	1.022	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)CN2CCCCC2)CC1	1826704319	NCUYCELDTPROQQ-FQEVSTJZSA-N	435.613	1.465	50	20	IDGD	
O=C(c1ccc(O)nc1)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827056658	PVYUAOVQEXLJPH-FQEVSTJZSA-N	437.305	1.014	50	20	IDGD	
C[C@]1(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2ccc(B(O)O)cc2)CC3)CC=CCC1	1827221562	SDAIHAYQTUYPPT-AOMKIAJQSA-N	439.346	1.795	50	20	IDGD	
CN1CCN(C2(C(=O)N3CCC([C@H]4CCCCN4C(=O)[C@H](F)Cl)CC3)CC2)CC1	1827611191	ODCIHUCGMVDHIT-MSOLQXFVSA-N	428.980	1.921	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)c2ccncc2F)CC1	1827953122	ZVMFXNIAZMKBGH-NRFANRHFSA-N	439.296	1.448	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)[C@H]3CCCSC3)sc2C1	1828160811	NJMBRZQYQZUHJJ-STQMWFEESA-N	439.607	1.571	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)[C@H]2CCC=CO2)CC1	1828892135	FZSBFWCHZBIIGF-LEWJYISDSA-N	426.322	1.292	50	20	IDGD	
CCn1nc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)cc1C	1829397489	IELINFLMQRHCIN-FQEVSTJZSA-N	446.596	1.818	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(C4CC4)on3)C2)C1	1830353904	MFQHMHOBWHVZCC-FQEVSTJZSA-N	425.913	1.887	50	20	IDGD	
CCc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)nn1C	1830365273	WDMGKWVHAYNNRM-HXUWFJFHSA-N	426.945	1.318	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)C34CC(F)(C3)C4)C2)C1	1830535606	QSJAKNVKQDOFMR-RXOFBLNVSA-N	433.318	1.366	50	20	IDGD	
C/C(=C\c1cccs1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1830719829	LVZVTEFSSSSFSP-SNEZHOGFSA-N	428.938	1.208	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3nsnc3NC)C2)C1	1831638203	BWQCHEXQUGSUBU-YVEFUNNKSA-N	431.946	1.057	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC([C@H]2CCCCN2C(=O)C2CC(=O)C2)CC1	1832810547	XXFLFAVVIVAPER-PXMCARDJSA-N	441.532	1.719	50	20	IDGD	
O=C(CCc1ccccn1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1833188329	LEVBEMKPGGTFQT-FUHWJXTLSA-N	444.301	1.161	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3ccc4occc4c3O)CC2)CC1)[C@H](O)CCl	1833312030	IVPGZKLBMPIOJZ-GOSISDBHSA-N	449.935	1.923	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)[C@H](C)Cn3cncn3)CC2)CC1	1833534064	ZYJVAGNVYUWWIV-APWZRJJASA-N	439.004	1.893	50	20	IDGD	
Cn1cncc1C(=O)NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1	1834245079	USIMDYTUFRURGP-HNNXBMFYSA-N	430.322	1.296	50	20	IDGD	
O=C(/C=C/c1ccccc1)N1CCOC[C@@]2(C1)CN(C(=O)CCBr)CCO2	1834822563	VXANMBSIQZWGPY-ROUKRRSUSA-N	437.334	1.941	50	20	IDGD	
CC(=O)N[C@@H](C(=O)N1CCC(N2CCC(NC(=O)[C@H](F)Cl)CC2)CC1)C(C)(C)C	1835079381	VIHKNXMPABQZER-IRXDYDNUSA-N	432.968	1.643	50	20	IDGD	
Cc1nn(C)c(C)c1CC(=O)N1CCC(N2CCC(NC(=O)[C@@H](F)Cl)CC2)CC1	1835083840	WBFBHHYSDUWXSN-LJQANCHMSA-N	427.952	1.685	50	20	IDGD	
C[C@H]1CCC[C@@H]1C(=O)NC1CCN(C2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1	1835511410	RRJLVGSPHYWDPB-PXNSSMCTSA-N	435.613	1.367	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccsc3)CCO2)C1	1836101811	OKVUFIAILVCHJA-GUYCJALGSA-N	431.352	1.530	50	20	IDGD	
O=C(c1cn2ccccc2n1)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836718326	VLSXXFVNKRGZKZ-SFHVURJKSA-N	434.924	1.546	50	20	IDGD	
C=CC[C@H](C(=C)C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)Br)C2)C1	1837312146	VALNWGQEGPYOCY-MDZRGWNJSA-N	429.355	1.995	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(F)n3)CCO2)C1	1837908045	PFTLBAAJKXJMQF-ZWKOTPCHSA-N	434.295	1.527	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(OC2CCN(C(=O)[C@H]3C[C@@H]3F)CC2)CC1	1838102809	ANWREUAPZBTPAE-YKLHELRZSA-N	447.511	1.477	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)C(=O)c3ccc(Cl)cc3)C2)C1	1839141793	SQRUYONXRPLECI-OXJNMPFZSA-N	443.327	1.997	50	20	IDGD	
O=C(C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2)c1ccccc1	1839197620	CFSWTWIZQPIDOB-CRAIPNDOSA-N	443.269	1.016	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1Cc3ccccc3N1)CCO2	1839735937	LLSMJUWGZWYOLY-SIKLNZKXSA-N	447.608	1.331	50	20	IDGD	
C=CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)CCO2	1839744239	WEDBPRPTRRDEBB-IHSQGBLNSA-N	431.439	1.904	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H](O)Cc3ccccc3)CCO2)C1	1839956600	VUJCFXARIZMHGO-CNNODRBYSA-N	438.952	1.454	50	20	IDGD	
C=CCSCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](Br)CC)CCO2	1839962780	QTESHQUKBYTRAO-YOEHRIQHSA-N	435.384	1.536	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(OC)s3)C2)C1	1840150592	NSWXMODLIJALDE-FZKQIMNGSA-N	432.926	1.081	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3Cl)C2)C1	1840153581	UPMPTOYQOPKCNL-CRAIPNDOSA-N	432.304	1.059	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)/C(C)=C/c3cccnc3)CCO2)C1	1840414488	NTUCJDUDOLCAQC-QCXXREMRSA-N	437.924	1.195	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)c(O)c1	1840669533	ATHQECLBMDQMQA-LIRRHRJNSA-N	441.322	1.554	50	20	IDGD	
CC(C)(C)OC(=O)CCCC(=O)N1CCCC12CN(C(=O)c1cnccc1C(=O)NN)C2	1841378610	JSGPXPADZRZEII-UHFFFAOYSA-N	445.520	1.014	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)CCN(C)C(C)=O)C1	1841837159	ZRXSHGHPUDPPJP-UHFFFAOYSA-N	446.460	1.206	50	20	IDGD	
O=C([C@@H]1[C@H]2Sc3ccccc3[C@H]21)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843014281	TVYIDGHMSZUTFQ-UFYCRDLUSA-N	434.326	1.071	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)Cn1cccn1)C2	1844692348	NGVQCEVYRSITRV-UHFFFAOYSA-N	427.417	1.234	50	20	IDGD	
C[C@@H](CNC(=O)OCc1ccccc1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl	1847565758	XANZXUIMPGIGOO-LEUOFYLZSA-N	437.924	1.350	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1ccc(Cl)c(NC(=O)c2cccs2)c1	9930890	ZYWSPIMOCDOPND-LLVKDONJSA-N	441.918	1.850	50	20	IDGD	
COc1ccc2cc(C(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)c(C)nc2c1	16594312	FWHWYKWEYVWGFP-UHFFFAOYSA-N	442.497	1.877	50	20	IDGD	
CCN(CC)C(=O)CCCC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	60364073	DFZWJEJFVSTGME-UHFFFAOYSA-N	438.550	1.271	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NCc1nn(-c2ccccc2)c2c1CCC2	725872188	BSEXBBSUZUVBAY-UHFFFAOYSA-N	438.513	1.683	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1OCC	728854121	MMCYSLFJFIDJIP-UHFFFAOYSA-N	449.533	1.500	50	20	IDGD	
COc1ccc(OCCN(C)C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1	728958671	DUTGGWWQMVQRHJ-UHFFFAOYSA-N	428.493	1.453	50	20	IDGD	
COC(=O)c1c(CC(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)[nH]c(C(C)=O)c1C	730035344	DAQQQSOYXOMZHH-UHFFFAOYSA-N	449.847	1.513	50	20	IDGD	
CCC(=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O)c1cccc(Br)c1	730569005	IWAUHAZIKNFPKW-UHFFFAOYSA-N	440.323	1.264	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)c1cccnc1	731119944	TZAZQWZLGRCERD-HNNXBMFYSA-N	431.518	1.961	50	20	IDGD	
CC(=O)N1CCN(c2ccccc2CNC(=O)NNC(=O)Cc2ccccc2F)CC1	731405848	PHUZMHCISNGSAF-UHFFFAOYSA-N	427.480	1.567	50	20	IDGD	
CSCC[C@@H](NC(=O)c1ccc2ccccc2n1)C(=O)NNC(=O)c1c[nH]nc1C	732084045	HPXKRIJLFNRUBP-QGZVFWFLSA-N	426.502	1.579	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)c1cc(S(=O)(=O)NCCOC)ccc1C)c1ccccc1	732134151	NNIJUDSKSRTTNN-SFHVURJKSA-N	433.530	1.875	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCc2ccc(Cl)cc2)cc1S(=O)(=O)N(C)C	733003672	WYRQQQWQHJSWTQ-UHFFFAOYSA-N	440.909	1.743	50	20	IDGD	
O=C(CC/N=C1/NS(=O)(=O)c2ccccc21)NNC(=O)NCc1ccc(Cl)cc1	733003914	SPTDXHGKFUYGLR-UHFFFAOYSA-N	435.893	1.299	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)NC[C@H]1OCCc2ccccc21	733652115	VJLOZDOVXFEJGQ-JOCHJYFZSA-N	437.544	1.843	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)c1cc(Cl)nc(N2CCCC2)c1	734239022	DMMGKUVSJYSTBV-UHFFFAOYSA-N	426.905	1.804	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)[C@@H]1CCN(c2ccc(Cl)cc2)C1=O	734241736	TVTNZPDLHJZNDO-AWEZNQCLSA-N	439.900	1.548	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)NCc2cc(S(N)(=O)=O)ccc2F)cc1	734674358	UAWRIXWVEWGVCO-UHFFFAOYSA-N	426.495	1.404	50	20	IDGD	
C[C@H](CN1CCN(c2ccccn2)CC1)NC(=O)NNC(=O)c1ccc2c(c1)OCCO2	735517286	BFYLNKFAPVEIBL-MRXNPFEDSA-N	440.504	1.008	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)[C@H]1CCN(c2ccc(Cl)c(Cl)c2)C1=O	740850042	RIOYPHFUKLPKQO-GFCCVEGCSA-N	429.304	1.799	50	20	IDGD	
CSc1ccc(O[C@H](C)C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1	740996152	QKZGRCYFRZKTMA-FZKQIMNGSA-N	446.481	1.706	50	20	IDGD	
C[C@H](C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)n1nnc(-c2ccccc2)n1	742468126	BSKAOENDRGEUEE-GOSISDBHSA-N	448.531	1.261	50	20	IDGD	
CCCCCCOc1ccc(C(=O)NNC(=O)CN2C(=O)[C@H]3[C@H](C2=O)[C@H]2CC[C@H]3O2)cc1	742516727	HZUKGFSJBFLTKX-HNBVOPMISA-N	443.500	1.569	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NC[C@@H](C)Oc1ccc(F)cc1	743509961	OCHVHHHTLNXZLO-GFCCVEGCSA-N	437.497	1.839	50	20	IDGD	
COc1ccccc1O[C@@H](C)CNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1	743588792	JIKGYQSAGANNSY-HNNXBMFYSA-N	428.493	1.500	50	20	IDGD	
Cc1cccc(-n2nnc(C(=O)NNC(=O)Nc3ccc(S(C)(=O)=O)cc3)c2C)c1	743829457	QKHUPWJUNIRNGD-UHFFFAOYSA-N	428.474	1.754	50	20	IDGD	
O=C(CN1CCC(n2c(O)nc3ccccc32)CC1)NNC(=O)c1cccc([N+](=O)[O-])c1	744427465	WXWRPECSIKQAOT-UHFFFAOYSA-N	438.444	1.748	50	20	IDGD	
O=C(COC(=O)[C@H]1CCCN(c2ncnc3sccc23)C1)NNC(=O)c1ccccc1	745533553	ISBQAPNTRVTZGC-HNNXBMFYSA-N	439.497	1.912	50	20	IDGD	
O=C(CNc1ccccc1Cl)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	745835602	QTMDABHYILJKQC-UHFFFAOYSA-N	436.921	1.998	50	20	IDGD	
Cc1cc(S(=O)(=O)Nc2ccccc2C(=O)NNC(=O)N(C)C)cc([N+](=O)[O-])c1C	746003047	AHQWCBPGWSDOKR-UHFFFAOYSA-N	435.462	1.928	50	20	IDGD	
CN(C)C(=O)NNC(=O)c1ccc(NS(=O)(=O)c2ccc3c(c2)OCCCO3)cc1	746003996	YAEFRUPCPUUCSM-UHFFFAOYSA-N	434.474	1.565	50	20	IDGD	
O=C(NNC(=O)N1CCC(CN2CCOCC2)CC1)c1ccc(Br)s1	746512049	FGUKVMHMYQBFGB-UHFFFAOYSA-N	431.356	1.909	50	20	IDGD	
CS(=O)(=O)c1ccc(OCCCC(=O)NNC(=O)Cc2cn3ccccc3n2)cc1	746545151	HSUYHHRXPUFMDW-UHFFFAOYSA-N	430.486	1.287	50	20	IDGD	
COc1cc(C)nc(NNC(=O)c2cc(Br)cc(S(C)(=O)=O)c2F)n1	746623099	DHGCDRHHEKBNOW-UHFFFAOYSA-N	433.259	1.856	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)c1ccccc1S(=O)(=O)C(F)(F)F	751206394	KOAPDVFFIMNBRB-UHFFFAOYSA-N	435.405	1.233	50	20	IDGD	
CCC1(C(=O)NNC(=O)c2cccc(S(=O)(=O)Nc3ccccc3OC)c2)COC1	755036883	KZNPUOSYLCYDMH-UHFFFAOYSA-N	433.486	1.684	50	20	IDGD	
CC(C)c1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)Cc3cc[nH]n3)CC2)cc1	755282248	OKVNDDVMGOEXHD-UHFFFAOYSA-N	433.534	1.324	50	20	IDGD	
Cc1ccc(C(=O)NC2CC2)cc1NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	755829489	CKFPHYNGAITVRX-UHFFFAOYSA-N	434.456	1.601	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)Nc1cc(N2CCCS2(=O)=O)ccc1F	756154224	DDUACXCGFPMHDF-UHFFFAOYSA-N	436.465	1.735	50	20	IDGD	
C[C@@H]1C[C@@H](C)CC2(C1)NC(=O)N(CC(=O)NNC(=O)c1cccc(OC(F)F)c1)C2=O	756978170	QZXUGLDUYKMYER-VXGBXAGGSA-N	438.431	1.796	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NCCCO[C@H]2CCOC2)c2ccccc2c1=O	757251318	BZGPANVCYVNEHZ-HNNXBMFYSA-N	431.493	1.336	50	20	IDGD	
COc1cc(Br)cc(NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c1	757797215	COLIQJLDGSBIIF-UHFFFAOYSA-N	432.238	1.900	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)[C@H](Sc1ccccc1F)c1ccccc1	758028173	ZHNKCKLBJJCFNP-BLLLJJGKSA-N	425.507	1.744	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)c1cccnc1Br	758150427	LDGVJKPPEXPAEK-UHFFFAOYSA-N	432.322	1.817	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1ccc(Br)c(Cl)c1Cl	758291896	WPOLGHXIZHSTKS-RXMQYKEDSA-N	448.126	1.846	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)sc1Br	759113637	MKBPRHJDVPLCCM-UHFFFAOYSA-N	437.316	1.988	50	20	IDGD	
CCCC[C@H](/N=C1/NS(=O)(=O)c2ccccc21)C(=O)NNc1ncccc1[N+](=O)[O-]	759301810	DTWINFZASZYSCQ-ZDUSSCGKSA-N	432.462	1.730	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)[C@@H]2CCCN2S(=O)(=O)c2cccc([N+](=O)[O-])c2)nc1	759740657	ZOYZTNLHCIOBNS-HNNXBMFYSA-N	449.445	1.073	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)c1cccc([N+](=O)[O-])c1	761390952	MGJUUXCRLMOXQM-CQSZACIVSA-N	446.485	1.944	50	20	IDGD	
COc1ccc2c(c1)[C@H](C(=O)NNC(=O)c1ccc(S(=O)(=O)N3CCCC3)cc1)CC2	761398223	BCPALKNAGQDCKM-LJQANCHMSA-N	443.525	1.971	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)[C@@H]1CCCN(C(=O)c2ccncc2)C1	761632280	AUWALUXCVWVNBL-MRXNPFEDSA-N	428.514	1.882	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)N[C@@H]1CCN(C(=O)C2CCCC2)C1	762092392	SRXGHRZINSFGTP-OAHLLOKOSA-N	426.477	1.313	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H]2CCCN(c3ccccc3F)C2)c1	763086184	NBCVXJDCVLUFNP-OAHLLOKOSA-N	434.493	1.842	50	20	IDGD	
O=C(NNC(=O)c1ccc2ccccc2n1)C(=O)Nc1ccc(CCN2CCOCC2)cc1	763449281	DDRUXNITZWZSIN-UHFFFAOYSA-N	447.495	1.509	50	20	IDGD	
Cc1ccc(S(C)(=O)=O)cc1NC(=O)C(=O)NNC(=O)c1ccc2ccccc2n1	763451332	ZLQDAYNUUYADNA-UHFFFAOYSA-N	426.454	1.346	50	20	IDGD	
C[C@H]1CN(C(=O)c2ccc(NC(=O)C(=O)NNC(=O)c3ccccc3O)cc2)C[C@H](C)O1	763527244	OGOGUSVWOYQSIH-KBPBESRZSA-N	440.456	1.041	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cccc(N3CCNC3=O)c2)c2ccccc2n1	763616043	SPYBUQLIEUBKTO-UHFFFAOYSA-N	432.440	1.473	50	20	IDGD	
CCOC(=O)c1cc(CC)sc1NC(=O)C(=O)NNC(=O)COc1cccc(C)c1	763619484	XFVJZTWFUAKHPU-UHFFFAOYSA-N	433.486	1.961	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1cccn(Cc2ccccc2)c1=O	763628605	CCEDEXZBFOEHEE-UHFFFAOYSA-N	444.451	1.252	50	20	IDGD	
COCCOc1cc(C)ccc1NC(=O)C(=O)NNC(=O)COc1cc(C)ccc1C	763664337	AKKAQOWWDPZQSI-UHFFFAOYSA-N	429.473	1.802	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)cc1OC(C)C	763674074	KQBYYYFXBDPBJM-UHFFFAOYSA-N	426.429	1.519	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)cnn1-c1ccccc1F	763682646	YMUZMAXDUHFHCM-UHFFFAOYSA-N	436.403	1.356	50	20	IDGD	
COC(=O)c1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)COc1ccc(Cl)cc1	763686691	PVVFKNGDHFVBGB-UHFFFAOYSA-N	440.239	1.945	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)NC(=O)CO3)cc1	763766792	DBMCMNWOFLKOLH-UHFFFAOYSA-N	440.456	1.842	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)cc1NC(C)=O	763841986	VXYKFYVCSWRBPV-CQSZACIVSA-N	442.472	1.824	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccccc2C(=O)N(C)C)c1C	763842017	WEZGOFNTXWXVAH-OAHLLOKOSA-N	426.473	1.559	50	20	IDGD	
CCOc1cc2c(cc1NC(=O)C(=O)NNC(=O)COc1ccc(F)cc1)O[C@@H](C)C2	763842694	IXYPLHSZSHODNE-LBPRGKRZSA-N	431.420	1.713	50	20	IDGD	
C#CCOc1cc(F)ccc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccc(OCC)cc1	763861333	OISRNMMZYAKBII-CQSZACIVSA-N	443.431	1.790	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2cccc(NC(=O)c3ccccc3)c2)n1	763881042	LBTORMJWDLAEDM-UHFFFAOYSA-N	434.456	1.538	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cnn(-c3ccccc3F)c2)cc1OC	763902119	QPSTXISQZWGZMA-UHFFFAOYSA-N	441.419	1.818	50	20	IDGD	
C[C@@H](C#N)Oc1ccccc1NC(=O)C(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	763944795	QCLDXGLLVLYGNR-ZDUSSCGKSA-N	434.412	1.268	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1C(=O)NC(C)C	764004459	WUNWOMRTNCDDMS-UHFFFAOYSA-N	440.456	1.304	50	20	IDGD	
CN1C(=O)c2ccc(NC(=O)C(=O)NNC(=O)c3cccc(C(F)(F)F)c3)cc2C1=O	764041120	ULJCWVPBCJXYQQ-UHFFFAOYSA-N	434.330	1.331	50	20	IDGD	
CC(C)N(C)c1cccc(NC(=O)C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c1	764085787	OOXUMGADJRRQDD-UHFFFAOYSA-N	432.502	1.334	50	20	IDGD	
CCOCCOc1ccc(Br)cc1NC(=O)C(=O)NNC(=O)c1ccoc1	764159039	PRIJIRLJURJROD-UHFFFAOYSA-N	440.250	1.857	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)CCc2ccco2)cc1N1CCCCC1=O	764177343	NUBCKSHPXYPVBN-UHFFFAOYSA-N	428.445	1.524	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)C(=O)Nc1c2c(nn1-c1ccccc1)CCC2	764366947	FXBJXCABFZIVOA-UHFFFAOYSA-N	433.468	1.664	50	20	IDGD	
CCOc1ccc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)[C@@H](CC)N(C)C)cc2)cc1	764499549	CJTUHFNJIMQVLM-LJQANCHMSA-N	448.545	1.987	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)Cn1cnc2c(oc3ccccc32)c1=O	765318870	AGEUDYBCURMPEX-UHFFFAOYSA-N	443.460	1.595	50	20	IDGD	
COC(=O)NNC(=O)C(=O)Nc1cc(C(=O)OC)ccc1Sc1ccc(Cl)cn1	765373099	WGXXRGJITAZZDP-UHFFFAOYSA-N	438.849	1.999	50	20	IDGD	
N#CCCNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)cc1	765569412	IKSTZJYZJDBYQQ-UHFFFAOYSA-N	444.498	1.405	50	20	IDGD	
Cc1nc(CCCC(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cs1	765737352	DUFHSCHNTFCFJT-UHFFFAOYSA-N	429.546	1.380	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)c1ccnc(CNC(=O)OC(C)(C)C)c1	766134008	RUEHIQIMSDWPMV-UHFFFAOYSA-N	430.461	1.955	50	20	IDGD	
COC(=O)c1ccccc1CC(=O)OCC(=O)NNC(=O)c1cc(Cl)ccc1OC	767774362	HPRPDFCCASLEAR-UHFFFAOYSA-N	434.832	1.682	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)CO[C@H]2CCCN(C(=O)OC(C)(C)C)C2)C[C@@H](C)O1	767822655	MOIYRKYGBBINPI-BBWFWOEESA-N	442.557	1.049	50	20	IDGD	
O=C(CCC(=O)N1CCN(c2ncccn2)CC1)NNc1nc(C(F)(F)F)cs1	768230141	GSAXSLRVCKEZJZ-UHFFFAOYSA-N	429.428	1.524	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2ccc(OC(C)C)c(OC)c2)c1	768236309	AJTCZEJNYDBZDA-UHFFFAOYSA-N	431.445	1.899	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)CCCS(=O)(=O)N3CCCC3)n[nH]2)cc1	768267685	AOARCYQBODKTBQ-UHFFFAOYSA-N	433.534	1.606	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H]2CCOC3(CCC3)C2)c1	769193509	KFFRIMVVNZVYEG-MRXNPFEDSA-N	438.550	1.763	50	20	IDGD	
COc1ccc(NC(=O)NNc2cccc(C#N)c2)cc1S(=O)(=O)N1CCOCC1	769925632	JNZZIYBOAGDVAL-UHFFFAOYSA-N	431.474	1.736	50	20	IDGD	
CNC(=O)c1cccc(CCNC(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)c1	770397674	NUUZCFKQPFILOL-UHFFFAOYSA-N	426.481	1.515	50	20	IDGD	
Cc1ccc(C(=O)NCCC(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)c(O)c1	771007750	FJTKNFIZYAQJAD-UHFFFAOYSA-N	427.465	1.564	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)Cc1cccc(I)c1	772181941	DVHZJZSUPUHJTO-NSHDSACASA-N	432.258	1.959	50	20	IDGD	
Cc1cnccc1OC1CCN(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)CC1	772359575	VIHSYTNLXGRPSA-UHFFFAOYSA-N	439.520	1.681	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1cccnc1-n1cccn1	774009378	OOBANIYJUHFHKP-LBPRGKRZSA-N	428.836	1.474	50	20	IDGD	
COc1cc([C@@H](C)NCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc(OC)c1OC	774961055	GRPUKZMATJJFFB-GFCCVEGCSA-N	432.433	1.732	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)N[C@H]1CCc2cc(O)ccc2C1	775069578	FLXKWPZTXMLBRD-HNNXBMFYSA-N	431.518	1.495	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc(OC)c1	775378160	VJQKOSASAYSKDI-UHFFFAOYSA-N	428.854	1.471	50	20	IDGD	
COc1ccccc1[C@@](N)(C(=O)NNC(=O)CNC(=O)c1cccs1)C(F)(F)F	776133882	APURZEWWGMMDGW-MRXNPFEDSA-N	430.408	1.050	50	20	IDGD	
COCCO[C@@H]1COCC[C@H]1NC(=O)NNC(=O)c1ccc(COc2ccccc2)o1	776845248	UMMCLLGNVDAEJI-IEBWSBKVSA-N	433.461	1.623	50	20	IDGD	
CC(C)(C)OC(=O)N1CCc2cc(C(=O)NNC(=O)C(=O)Nc3ccccn3)ccc21	776982696	GLMQQSIODZZEMO-UHFFFAOYSA-N	425.445	1.779	50	20	IDGD	
COc1nc(C)c(Br)cc1C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C	777254410	JMZCDHIECHMGLH-UHFFFAOYSA-N	446.302	1.630	50	20	IDGD	
C[C@H]1CCN(C(=O)OC(C)(C)C)[C@H](C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)C1	778296255	VCKCHTMPEBKDQX-BBRMVZONSA-N	443.504	1.730	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)CN2C(=O)N[C@]3(C[C@@H](C)CC(C)(C)C3)C2=O)nc1C	778423487	DEGPPCQLABBSMG-QKVFXAPYSA-N	446.508	1.542	50	20	IDGD	
COC(=O)[C@@H]1C[C@H](OC)CCN1C(=O)CCC(=O)C(C#N)=C1N(C)c2ccccc2N1C	778456012	IBXGIPHNBVTKMY-BEFAXECRSA-N	440.500	1.836	50	20	IDGD	
CN(CC(=O)NNC(=O)c1cccc(Cl)c1)C[C@@]1(O)CCN(Cc2ccccc2)C1	778498560	UBHKJWPUEVSHGT-QFIPXVFZSA-N	430.936	1.670	50	20	IDGD	
CN(C)[C@H](C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1)c1cccc(Cl)c1	780105406	VXRKTJBAOTXSIC-MJGOQNOKSA-N	447.875	1.473	50	20	IDGD	
CC(=O)N1CCN(c2cccc(NC(=O)C(=O)NNc3ccc(F)c(F)c3F)c2)CC1	782118750	WHCUFGKJQDEFLC-UHFFFAOYSA-N	435.406	1.854	50	20	IDGD	
CCOC(=O)c1ccn(-c2ccccc2NC(=O)C(=O)NNC(=O)c2ccc(O)cc2)n1	782837257	GZINAWOJGSPJET-UHFFFAOYSA-N	437.412	1.154	50	20	IDGD	
Cc1ccc(NNC(=O)C(=O)Nc2ccc(S(=O)(=O)N3C[C@H](C)O[C@@H](C)C3)cc2)cc1	783348412	DTLBCJBLSYBRHN-HOTGVXAUSA-N	446.529	1.875	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)C(=O)Nc1cccc(CCCc2ccccc2)c1	784004361	MAFCZRYTGAFOGV-UHFFFAOYSA-N	448.479	1.971	50	20	IDGD	
C[C@@H](C(=O)Nc1ccc(NC(=O)C(=O)NNc2ccc(F)c(F)c2F)cc1)n1cncn1	784807148	QLNOKNQSNZLTHL-JTQLQIEISA-N	447.377	1.977	50	20	IDGD	
Cc1cnn(-c2ccc(NC(=O)C(=O)NNc3cccc(S(C)(=O)=O)c3)cc2F)c1	784839313	JPEKDHVYOLTZQJ-UHFFFAOYSA-N	431.449	1.805	50	20	IDGD	
CCN1CCN(c2cccc(NC(=O)C(=O)NNc3ccc(C(F)(F)F)nn3)c2)CC1	784886516	UEFQQPJENKSNSE-UHFFFAOYSA-N	437.426	1.719	50	20	IDGD	
N#Cc1ccc(OC(F)F)c(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)c1	785068650	YYWNFEHHCYKNER-UHFFFAOYSA-N	428.355	1.136	50	20	IDGD	
CCc1cc(Br)ccc1NNC(=O)C(=O)Nc1ccc(S(C)(=O)=O)nc1	785103017	DKAUMCLMTUPCNQ-UHFFFAOYSA-N	441.307	1.892	50	20	IDGD	
CS(=O)(=O)c1cc(C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)ccc1F	786049834	IXXFDSISBSVIPS-UHFFFAOYSA-N	427.479	1.427	50	20	IDGD	
Cn1nc(-c2ccc(Cl)s2)cc1NC(=O)C(=O)NNC(=O)c1ccc2c(c1)OCO2	787541217	OGTFHHXFQMMWHW-UHFFFAOYSA-N	447.860	1.930	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)NCCC(=O)Nc2cccc(NC(=O)NN(C)C)c2)cc1	788252819	BQYJHWNKOJJUGA-UHFFFAOYSA-N	447.517	1.794	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)COc2ccc(C)c(C)c2)c(C)cc1C	788330873	MNWUKZQZAVBYIQ-UHFFFAOYSA-N	427.457	1.872	50	20	IDGD	
N#Cc1ccc(S(=O)(=O)NNC(=O)COc2ccccc2O)cc1Br	788626534	TYKRTWCVCWDURP-UHFFFAOYSA-N	426.248	1.415	50	20	IDGD	
Cc1ccc(S(=O)(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)c(F)c1	788914865	HFDAVKDFPHVLGP-UHFFFAOYSA-N	430.502	1.932	50	20	IDGD	
COc1cccc(C2=NO[C@H](C(=O)NNc3nc(O)c4cnn(C(C)(C)C)c4n3)C2)c1	792164133	GBDQZUYJKZNRTN-HNNXBMFYSA-N	425.449	1.932	50	20	IDGD	
O=C(Cc1ccc2c[nH]nc2c1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	792773755	KDPKYVNJPYKMLF-UHFFFAOYSA-N	427.486	1.351	50	20	IDGD	
CN(C)Cc1cc(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)ccc1Cl	799257360	JSVBKIABQLLVTR-QGZVFWFLSA-N	432.864	1.328	50	20	IDGD	
COc1ccc(Cl)c(NC(=O)NNC(=O)C2CCN(c3ccc4nnnn4n3)CC2)c1	802111958	SGQCNPRLWOEHLU-UHFFFAOYSA-N	445.871	1.251	50	20	IDGD	
Cc1nc2c3cccnc3nn2c(C)c1CCC(=O)NNC(=O)CNC(=O)OC(C)(C)C	803053856	HOFMJAQSRCZLTH-UHFFFAOYSA-N	441.492	1.499	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)cc1)C(=O)Nc1ccc2nccnc2c1Br	806991779	WMHBPBPKZGHGBE-UHFFFAOYSA-N	430.218	1.498	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)(F)F)cc1)C(=O)Nc1cccc2c1CNC2=O	807001435	ZZOTVDVPRCBFBS-UHFFFAOYSA-N	442.375	1.305	50	20	IDGD	
CCc1c(C(=O)NNC(=O)N2CCN(C)CC2)cnn1-c1ccc(Br)cc1	807379640	AHQPCQGETAORKQ-UHFFFAOYSA-N	435.326	1.799	50	20	IDGD	
COc1cc(C)nc(NNC(=O)NCCNS(=O)(=O)c2cccc(Cl)c2Cl)n1	807455243	IUBYQCMAJJCEGG-UHFFFAOYSA-N	449.320	1.705	50	20	IDGD	
O=C(NCc1ccncc1OC[C@@H]1CCOC1)NNC(=O)c1cc([N+](=O)[O-])ccc1O	807616726	WKXRSAGLXHNAIO-GFCCVEGCSA-N	431.405	1.255	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)c1csc(S(=O)(=O)N2CCc3ccccc3C2)c1	810549248	MMCTXYTVDPBDIA-UHFFFAOYSA-N	444.538	1.908	50	20	IDGD	
CCOC(=O)Nc1scnc1C(=O)N1CCN(S(=O)(=O)CBr)CC1	813510320	VPMQFJHNYFSCCQ-UHFFFAOYSA-N	441.329	1.152	50	20	IDGD	
CC(=NNC(=O)Cc1cc(O)nc(O)n1)c1cc(Br)ccc1OCC(=O)O	814859849	CPIQRBKBSDWYSW-UHFFFAOYSA-N	439.222	1.197	50	20	IDGD	
CCOC(=O)CN1C(=O)C(F)(F)c2cc(NC(=O)C(=O)NNc3ccccn3)ccc21	815557697	BEYAOBWRSKNOLM-UHFFFAOYSA-N	433.371	1.165	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cc(C)c3nccn3c2)cc1	815565897	DBNQTYLZOLRRLP-AWEZNQCLSA-N	425.445	1.595	50	20	IDGD	
Cc1ccc(-c2ncccc2NC(=O)C(=O)NNC(=O)[C@@H]2CCc3nncn3C2)s1	815692024	HSSWPBKHHKFKEX-GFCCVEGCSA-N	425.474	1.059	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCc2nncn2C1)C(=O)Nc1ccc(OC2CCCC2)c(Cl)c1	815692737	ZUNPIJOLFFUHMS-GFCCVEGCSA-N	446.895	1.601	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1OC(F)F	873773091	NOXOVAHGAXFSLQ-UHFFFAOYSA-N	443.428	1.622	50	20	IDGD	
Cc1nn(CCC#N)c(C)c1CCC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	883990587	RZTRDRDAAGHQGX-UHFFFAOYSA-N	446.533	1.058	50	20	IDGD	
CC[C@@H](C)NC(=O)CN1CCN(C(=O)/C(C#N)=C\c2cc(C)n(CCOC)c2C)CC1	913017805	YDWSFUAMIGOSPJ-RHTHQAGFSA-N	429.565	1.717	50	20	IDGD	
O=C(CC12CC3CC(CC(C3)C1)C2)NCC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	913156164	XZJBTVYJBNEMAK-UHFFFAOYSA-N	437.504	1.146	50	20	IDGD	
CC(C)NC(=O)CSc1ccccc1C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	915163769	BITKLXNYUNJCBM-UHFFFAOYSA-N	449.554	1.782	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1OC(F)F	916133370	JRBLNUJXIMWCTD-UHFFFAOYSA-N	449.819	1.672	50	20	IDGD	
COc1ccc(C)cc1CCNC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1	916195496	ROIISTNMMTUEEA-UHFFFAOYSA-N	448.545	1.506	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)N[C@H](C)c2nnc3ccccn23)c2ccccc2c1=O	916222225	XKYJMKUPRHMOTQ-CQSZACIVSA-N	448.487	1.945	50	20	IDGD	
CCNC(=O)COc1ccc(C=NNC(=O)[C@H](C)CN2C[C@H](C)O[C@H](C)C2)cc1OC	916365861	LYRPASFLNXAPTK-ZACQAIPSSA-N	434.537	1.406	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)N[C@H](C)CN2CCOCC2)c2ccccc2c1=O	916471070	ZRMJMIODMMDSJF-MRXNPFEDSA-N	444.536	1.251	50	20	IDGD	
C=CCNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cc(-c3ccc(C)cc3)[nH]n2)cc1	917178073	IVVRZWBFUBWGOA-UHFFFAOYSA-N	439.497	1.924	50	20	IDGD	
Cc1nc2c(C(N)=O)cnn2c(C)c1CCC(=O)NNC(=O)Cc1ccc2ccccc2c1	917197589	FDJATPVDZWRUJC-UHFFFAOYSA-N	444.495	1.921	50	20	IDGD	
NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NNc3ccc(-n4cccn4)nn3)cc2)C1	918121149	DQPHVTISJSYOCF-INIZCTEOSA-N	435.492	1.190	50	20	IDGD	
O=C(CS[C@@H]1CCS(=O)(=O)C1)NNC(=O)c1ccc(F)cc1Br	918641498	CTKDEYSRBRVRRH-SECBINFHSA-N	425.301	1.270	50	20	IDGD	
Cc1sc(=O)n(CC(=O)NNC(=O)[C@@H](C)Oc2cccc(Br)c2)c1C	919810515	IOHVJZFNLPHPAV-SNVBAGLBSA-N	428.308	1.904	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cccn2Cc2ccccc2)cc1	935285867	BVRRXXSSYGLNSV-UHFFFAOYSA-N	440.525	1.927	50	20	IDGD	
O=C(Cn1cnc2ccccc21)NNC(=O)CC1(CC(=O)N2CCOCC2)CCCC1	1115824417	HDEZBGJBJHVZTC-UHFFFAOYSA-N	427.505	1.383	50	20	IDGD	
CN(CCNC(=O)NNC(=O)c1ccccc1Cl)S(=O)(=O)c1ccc(F)cc1	1116907038	CMCAJIDHIVHVBJ-UHFFFAOYSA-N	428.873	1.744	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)NCc1cccc(CN2CCN(C)CC2)c1	1321513545	TUTRIOIDMDZDMG-UHFFFAOYSA-N	439.560	1.906	50	20	IDGD	
N#CCCn1cc(/C=C(\C#N)C(=O)N2CCC(OCC(N)=O)CC2)c(-c2ccccc2)n1	1323314090	IHSNBZRODOVADA-QGOAFFKASA-N	432.484	1.864	50	20	IDGD	
COc1cc(OC)cc(N2C[C@@H](C(=O)NNC(=O)c3cncn3-c3ccccc3)CC2=O)c1	1323632488	YWMVHEPLVPSJKU-HNNXBMFYSA-N	449.467	1.704	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1cncc(OCC(F)F)c1	1334112045	SSXAKJGRODDXFX-UHFFFAOYSA-N	442.444	1.503	50	20	IDGD	
O=C(CCCc1nc(O)c2ccccc2n1)NNC(=O)C1CCN(c2ncccn2)CC1	1338558721	VNGHXPPXESSCOS-UHFFFAOYSA-N	435.488	1.512	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc4n(n3)CCCC4)C2)C1	1778562316	ZTRDZCFBISJQSE-OALUTQOASA-N	429.348	1.899	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)c3ccc(Cl)s3)CCO2)C1	1779028304	IRDODUDOQMBSNQ-LJQANCHMSA-N	449.920	1.157	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)nn1C(F)F	1780306857	PQOWIXKCWQOHMZ-ZBEGNZNMSA-N	435.269	1.814	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccncc1O)C2)[C@@H](F)Br	1780774663	HGAYQIDMAYGZHG-CKEIUWERSA-N	430.274	1.605	50	20	IDGD	
C[C@H](NNc1ccccc1)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781326620	ZDAANVAMZKJQAL-YEWWUXTCSA-N	443.317	1.512	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CN1CCC(C)CC1)C2	1782172002	JNHYSGQOHMJUGB-WAOWUJCRSA-N	429.989	1.486	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)nc2nccn12	1782354344	JEHSRCJIFDSMGA-RTBURBONSA-N	440.331	1.718	50	20	IDGD	
C[C@@H](C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@](C)(Cl)CCl)C2)n1cncn1	1782532367	YDQNNRZVCFORLG-IHETXDGRSA-N	432.352	1.589	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3nc4ccc(F)cn4n3)C2)C1	1782570229	FIKIZFAGXRBCDR-PIGZYNQJSA-N	440.273	1.095	50	20	IDGD	
Cn1cc(C(=O)N2CCO[C@]3(CCN(C(=O)/C(C#N)=C/c4ccc(F)cc4F)C3)C2)cn1	1782864328	SYFQMVQZHYIDGG-AGBQBWRISA-N	441.438	1.749	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cnc(OC)c(F)c3)CCO2)C1	1783344946	UUYXNMJEUNNUBC-FZKQIMNGSA-N	444.301	1.846	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cccc4c3OCCO4)CCO2)C1	1783534112	FEHCLFNNZQHUBG-DJJJIMSYSA-N	439.306	1.685	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(N(C)C)nc3)CCO2)C1	1783536701	ILFFIAROJYLNET-SCLBCKFNSA-N	425.327	1.375	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)CC(=O)Nc3ccc(F)cc3)CCO2)C1	1783880842	GCNFIWNSUNPKQZ-JXFKEZNVSA-N	441.887	1.238	50	20	IDGD	
Cn1c(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](O)CCl)C[C@@H]32)cc2ccccc21	1783894338	CATRTKVBVAYOHQ-UUXHPUJUSA-N	433.936	1.300	50	20	IDGD	
Cc1cc(O)c([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783949891	OBBGVSKZEWVXLN-QGZVFWFLSA-N	432.260	1.856	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCC(=O)N3CCCC3)[C@H]2C1	1785002456	YPLJWCBYHGXWCU-UGUYLWEFSA-N	444.370	1.152	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(=O)n3C)[C@H]2C1	1785872844	LJXLAIIFQPKFAF-YXWQFLTLSA-N	440.338	1.152	50	20	IDGD	
COC(=O)c1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CO[Si](C)(C)C)C[C@@H]32)cn1	1787604590	DEINLLHMMUBUBI-BQFCYCMXSA-N	449.580	1.313	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]3C2)o1	1788764613	ORDQNBOLLSPGNY-ZOBUZTSGSA-N	437.569	1.683	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3cc(F)ccn3)C[C@@H]21	1788765130	ICBPEPMOXBFVJZ-SNRMKQJTSA-N	437.588	1.985	50	20	IDGD	
CCc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](Br)CC)C[C@@H]32)nn1C	1789068920	CWZSIJYKKJLPPF-QEWYBTABSA-N	441.370	1.749	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCOCCOCCOC)C[C@@H]21	1789865180	PQOFJQXMTXVZGQ-XSLAGTTESA-N	434.961	1.053	50	20	IDGD	
CCOC(=O)O[C@@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]2C1	1789924701	BIXCNLUBCXAVAE-VLJOUNFMSA-N	439.278	1.218	50	20	IDGD	
CCS(=O)(=O)N[C@@H](C)C(=O)NC1(c2ccc(NC(=O)[C@H](Cl)COC)cc2)CCC1	1791565621	SMQBHBLQNSDRCN-XJKSGUPXSA-N	445.969	1.702	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCCn3ccnc3C)[C@H]2C1	1791572419	MCKAWCSAPUGIJM-XSLAGTTESA-N	426.945	1.205	50	20	IDGD	
Cc1ncc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)Br)C[C@@H]32)s1	1791590507	ADQJQLZHAZZUMS-WCUVEOEZSA-N	430.368	1.757	50	20	IDGD	
COc1ncc(Cl)cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2	1792402239	SGIQCFWOLPDZGT-QHBPRCKVSA-N	446.729	1.732	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)CBr)C2	1792866553	FZUMVQCFQDGZSR-NWBUJAPZSA-N	440.176	1.638	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc3nc[nH]c13)C2	1792867425	AIKLBWNJIQJCDD-JFILPPLUSA-N	435.322	1.797	50	20	IDGD	
Cc1nnc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)CBr)s1	1792868492	YRRZLWGSAVORDG-BTABJRDXSA-N	431.356	1.010	50	20	IDGD	
COC(=O)[C@@H]1CC[C@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@](C)(Cl)CCl)C3)C1	1792974126	XLCIJZMJSXAUES-MPDLIOFISA-N	435.348	1.402	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](O)CCl)C1	1793116854	XHYUSRMFCGHMMD-UUAJXVIYSA-N	443.972	1.871	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1(c2ccc(F)cc2)CC1)c1ccc(B(O)O)cc1	1794041514	FXYKUOKKZSAJRX-WKCHPHFGSA-N	436.292	1.489	50	20	IDGD	
COc1cc(F)c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCBr)c(F)c1	1795115177	OAWWOSBQLFIZLU-YQYWCBKUSA-N	447.276	1.962	50	20	IDGD	
CCc1oncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2	1795319375	VOCOQIWLOQHOQR-JWBKOJIWSA-N	426.477	1.623	50	20	IDGD	
COc1cc(C)c(C)cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1	1796189495	VCBUFOMVOJPCKP-ACDBMABISA-N	436.317	1.557	50	20	IDGD	
Cc1cccc2cc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3cccc(B(O)O)c3)[nH]c12	1796191413	IPJNPFRXJRRJGB-ACDBMABISA-N	431.301	1.722	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)[C@H](O)c1ccccc1Cl	1796192094	HYKHLUJQIHAHHE-AXVVYFOYSA-N	442.708	1.005	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](F)Cl)CC1	1796811025	LHONDWXEQLHFPJ-IVSAIRAKSA-N	446.951	1.712	50	20	IDGD	
COc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CO[Si](C)(C)C)c(OC)c1	1797957579	OMEJWYHWJYONGV-YVWYUNDQSA-N	436.581	1.759	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)Nc1ccccn1	1797972089	XEZVWDIFJVUVDQ-SVZOTFJBSA-N	439.354	1.503	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1nccc(Cl)c1OC	1798690659	LEUNKALKWMLXMC-XCCSTKFXSA-N	432.304	1.201	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(OC)c(OC)c1	1798895545	XDMDZTRKRWFITN-BASYENTBSA-N	426.897	1.161	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CS[C@H]1CCCCO1)C2)[C@@H](F)Br	1799350383	XYTDNERIDFPGAR-FONWIUJUSA-N	439.347	1.526	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCNC(=O)OC(C)(C)C	1800169130	MNPKEXOEIXRLHE-JKJDWNRSSA-N	447.960	1.154	50	20	IDGD	
Cn1cnc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)/C(C#N)=C/c2ccc(F)cc2F)c1	1800332426	KLBVGRXOHCWQKU-QYFXKUKHSA-N	441.438	1.509	50	20	IDGD	
CC(C)NCCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C#N)=C/c1ccc(F)cc1F	1800333134	OTPHKHMNCFDQMR-BDCURPAKSA-N	446.498	1.849	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C[C@@H](C)NC(=O)OC(C)(C)C)C2	1800975942	YRZNHBSAAAZLEQ-LFYQSXPISA-N	447.960	1.133	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c(OC)cccc1OC)C2	1800979025	OFFGVSQXENOXJR-KYZVSKTDSA-N	426.897	1.161	50	20	IDGD	
COC[C@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(S(C)(=O)=O)ccc1F)C2	1802280461	QOVCNSCAMGKOPB-ZWUHOBOKSA-N	446.928	1.735	50	20	IDGD	
COC(=O)Nc1cccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CCC(=O)NN(C)C)c1	1802338016	LWSZSPKQSFRMSR-BCDXTJNWSA-N	445.520	1.490	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1	1803012090	WCAHDGDZPOXFOP-BEAPCOKYSA-N	432.746	1.718	50	20	IDGD	
CCOc1cnc(C(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)cn1	1803139990	AICZUQFOGULKKT-UWWQBHOKSA-N	433.896	1.190	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cc3ncccn3n2)[C@@H]1c1cccnc1)[C@H](O)CCl	1803142842	KQPVHAKFACRJED-YXJHDRRASA-N	428.880	1.044	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccnc3ncccc23)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803147824	MEEFBHUDOASWTR-ZYSHUDEJSA-N	439.903	1.944	50	20	IDGD	
CC(=O)N[C@H](C(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)C(C)(C)C	1803377700	JTKKUSRDCIERAU-XLAORIBOSA-N	438.956	1.238	50	20	IDGD	
CN(C)c1cncc(C(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@H]2c2cccnc2)c1	1804848831	VEMGQQMAVBZKGV-IPELMVKDSA-N	431.924	1.462	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2ccccc2O)[C@H]1c1cccnc1	1805205726	FASZSKXYJBWLLK-HTAPYJJXSA-N	439.516	1.480	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC2(CCN(C(=O)[C@@H]3CCNC(=O)C3)CC2)C1	1805390058	ZMQXLLPCXVNTTO-LSDHHAIUSA-N	428.371	1.775	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)cn1	1807361232	FHXKRDUETYCYGD-KNQAVFIVSA-N	444.300	1.098	50	20	IDGD	
C[C@@H](C(=O)N1CC[C@H](CNC(=O)[C@@H](F)Cl)[C@H]1c1cccnc1)N1CCN(C)CC1	1808316233	WWGWHPPDBHXFIH-DZOHQFGASA-N	425.936	1.258	50	20	IDGD	
N#Cc1cccc(C(=O)N2CCC3(CCCN(C(=O)c4cccc(B(O)O)c4)C3)CC2)c1	1809977624	LDQQYBPXHYTMPQ-UHFFFAOYSA-N	431.301	1.397	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)c1c(F)ccc(O)c1F	1811655707	GSAHWEUQBWHPQS-QITLCBANSA-N	439.846	1.985	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)Cc2c(C)nn(C)c2C)[C@@H]1c1cccnc1	1813421929	SVCBFMYZTITXIE-CUWPLCDZSA-N	447.967	1.934	50	20	IDGD	
Cc1ccc(C(=O)N[C@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)o1	1815336751	BTRQPAHEFURFEN-AWEZNQCLSA-N	425.275	1.264	50	20	IDGD	
Cc1cc(C(=O)NCC(=O)Nc2nc3c(s2)C[C@H](NC(=O)C(Cl)Cl)CC3)no1	1819933021	IORIGPXWSGYOQY-MRVPVSSYSA-N	446.316	1.585	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)C3(N4CCN(C)CC4)CC3)sc2C1	1822719924	ZNEUVRXPOBKXFJ-KGLIPLIRSA-N	440.013	1.853	50	20	IDGD	
COc1cnc(C(=O)N[C@H]2CCc3nc(NC(=O)[C@@H](F)Br)sc3C2)cn1	1823003128	IUBXFDXVZRTDCI-JVXZTZIISA-N	444.286	1.858	50	20	IDGD	
O=C(c1c(O)cc(O)cc1O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)CC1	1824188073	MTRVJICJELGHAX-YOEHRIQHSA-N	426.897	1.636	50	20	IDGD	
O=C(COc1ccc(O)nn1)Nc1nc2c(s1)C[C@H](NC(=O)C(Cl)Cl)CC2	1824562801	YFGBHNAAMNFTSZ-SSDOTTSWSA-N	432.289	1.433	50	20	IDGD	
CC(C)c1cc(C(=O)N[C@@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)no1	1826080442	KYZXHMXUKMTGLO-GFCCVEGCSA-N	448.549	1.853	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)Cc1cccnc1)CC2	1826085391	QHQYCZDVYUQYQR-AWEZNQCLSA-N	430.534	1.066	50	20	IDGD	
CC(C)[C@@H](S)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827050008	DGRMZELHKBDHFP-WOJBJXKFSA-N	432.395	1.554	50	20	IDGD	
O=C(Cc1ccccc1)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827054810	LFQCCOCNJWTQQN-HSZRJFAPSA-N	434.345	1.842	50	20	IDGD	
O=C(CN1C(=O)CSC1=S)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](F)Cl)CC2	1828244592	KXYSQHXXGBWUPG-KBUNVGBDSA-N	436.943	1.450	50	20	IDGD	
Cn1cccc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1	1828925180	GXRKRQISIIKBDA-LJQANCHMSA-N	438.532	1.571	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(O)cc3)C2)C1	1830543561	URKXRYQEFOMOSF-AUUYWEPGSA-N	441.322	1.493	50	20	IDGD	
C=CCC(CC=C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)Br)C2)C1	1830644897	ZPRZHMQTCFTYCQ-KXBFYZLASA-N	429.355	1.995	50	20	IDGD	
CCNC(=S)NCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCBr)CC1	1831090403	FESJETYDNRVBBJ-OAHLLOKOSA-N	447.443	1.875	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)C/N=C/c3ccco3)C2)C1	1831649857	CFFWAWYJXHWHOO-WRJCRLLZSA-N	425.913	1.562	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)C(=O)c2ccccc2)CC1	1831872475	ZAAFBMUVLPDCAE-HXUWFJFHSA-N	442.560	1.862	50	20	IDGD	
CCOCCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1	1832357636	FBHMAWIBECJKEF-IBGZPJMESA-N	431.537	1.345	50	20	IDGD	
Cc1cc(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@](C)(Cl)CCl)C3)C2)on1	1832571708	ZXTSEOMEQLPOMA-QZTJIDSGSA-N	434.320	1.218	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3cc(C)cs3)CCO2)C1	1832985861	XJEUEHKYRMYDSH-FXAWDEMLSA-N	444.981	1.699	50	20	IDGD	
COC[C@H](C)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](C)CBr)CC2)CC1	1833265500	ZBYLDFRFRYJPOO-GJZGRUSLSA-N	432.403	1.872	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H]3CCc4ccccc4C3)CC2)CC1)[C@@H](O)CCl	1833312597	ZCXDFQLIZZWVHR-UGKGYDQZSA-N	448.007	1.963	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cc(OC)nn3C)CC2)CC1	1833953607	JXGGHWDDEZTQNB-MRXNPFEDSA-N	425.961	1.631	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccncc3)CCO2)C1	1834020156	NVLOWLPUPQUHAI-MAUKXSAKSA-N	426.311	1.325	50	20	IDGD	
Cc1nc[nH]c1C(=O)N1CCC(N2CCC(NC(=O)CCBr)CC2)CC1	1834421844	OTJXQXCSGZETAF-UHFFFAOYSA-N	426.359	1.688	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3c(C)noc3N)CC2)CC1	1834703016	REOMOZLYDBOKFW-OAHLLOKOSA-N	427.933	1.004	50	20	IDGD	
C[C@]1(C(=O)N2CCOC[C@@]3(CN(C(=O)CCBr)CCO3)C2)CC=CCC1	1834826325	LIKJPZIMJLYLAY-RBUKOAKNSA-N	429.355	1.974	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)c1cnc2ccoc2c1	1835025036	DQPMWGFXHIDMRA-GOSISDBHSA-N	434.924	1.613	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)c1cc(Cl)ccn1	1835888826	SXAINWBPSAIFFJ-KRWDZBQOSA-N	429.348	1.520	50	20	IDGD	
C[C@@H](C(=O)N1CCC(N2CCC(NC(=O)[C@H](F)Br)CC2)CC1)n1ccnn1	1836413518	GDQFWYYBSTZTSP-WFASDCNBSA-N	445.337	1.101	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)Nc1ccccc1)CCO2	1837341740	LAEKNSGLVSMCSP-MMOPVJDHSA-N	439.940	1.197	50	20	IDGD	
O=C(c1nnc(-c2ccccc2)o1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1837537095	MXRCSEYMTUBIME-KUHUBIRLSA-N	438.843	1.341	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ncc(Cl)cn3)C2)C1	1837712452	SHEJQOQSAZCIFI-GOSISDBHSA-N	442.976	1.052	50	20	IDGD	
CC(C)n1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)n1	1838787282	NGQHYMCYRFBFRZ-HXUWFJFHSA-N	438.601	1.386	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnn(-c4cccnc4)c3)C2)C1	1839143096	LEVNMALOTCXUPX-RXVVDRJESA-N	447.923	1.355	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)n3cccc3C=O)C2)C1	1839143720	GMSQJNWNIRXWIC-RIFZZMRRSA-N	425.913	1.335	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc4ccccc4n3)C2)C1	1839144737	JUCKJRFSTMKKTH-QVKFZJNVSA-N	432.908	1.717	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CCN3CCCC3)C2)C1	1839967543	PYCPLXKHFIAJDT-APWZRJJASA-N	446.386	1.102	50	20	IDGD	
COc1cccc(/C=C/C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)c1	1839994770	FBSUNWZBCIKQPX-OANMOWAGSA-N	426.872	1.699	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1840030434	MKEZLKYPZGYSRA-LRDDRELGSA-N	425.751	1.491	50	20	IDGD	
O=C(c1n[nH]c2ccccc12)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840188563	PODJFCQEKKCEAV-GOSISDBHSA-N	427.288	1.437	50	20	IDGD	
CC(C)c1nn2ccccc2c1C(=O)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843011079	NNGGVYQLZXMXAH-UHFFFAOYSA-N	446.316	1.268	50	20	IDGD	
CC(C)(C)OC(=O)CCCC(=O)N1CC2(CCCN2C(=O)c2cnccc2C(=O)NN)C1	1844263159	ADDGKOFZSGFNNT-UHFFFAOYSA-N	445.520	1.014	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)[C@H]1C[C@H]1c1ccc(F)cc1)C2	1844263177	BPHFVWLQUVQJEU-ROUUACIJSA-N	437.475	1.445	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H](C(=O)N2CCCC23CN(C(=O)[C@@H](O)CCl)C3)C1	1846355773	GWBYXPKVHKHQHA-OAGGEKHMSA-N	443.972	1.873	50	20	IDGD	
O=C(NCc1ccc(OC(F)F)cc1)NNC(=O)c1csc(N2CCOCC2)n1	9790458	BYOLAMYIDSJOAZ-UHFFFAOYSA-N	427.433	1.725	50	20	IDGD	
COc1ccccc1-n1nnnc1SCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	16485387	SHAYMRAZINXVPE-UHFFFAOYSA-N	429.418	1.132	50	20	IDGD	
O=C(C[C@@H]1Sc2ccc(Cl)cc2NC1=O)NNC(=O)c1n[nH]c(=O)c2ccccc12	21039415	SRLOGYHYNWIEPK-AWEZNQCLSA-N	443.872	1.841	50	20	IDGD	
CC(C)[C@H](NC(=O)COc1ccccc1)C(=O)NNC(=O)c1cc(Br)c[nH]1	28717899	FXTBIECWMFTPLT-INIZCTEOSA-N	437.294	1.758	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(C)c(C(=O)NNC(=O)CNc2ccc(OC)cc2)c1	68976194	WOPSRCQIDXINBK-UHFFFAOYSA-N	448.545	1.907	50	20	IDGD	
Cc1cc(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)nn1C(C)(C)C	728214564	AITLSXXTDGQZMT-UHFFFAOYSA-N	434.566	1.640	50	20	IDGD	
COc1cc(C=NNC(=O)C2CCN(c3ncccn3)CC2)cc(Cl)c1OCC(N)=O	728783634	YNYUFGNGAOGGHD-UHFFFAOYSA-N	446.895	1.369	50	20	IDGD	
CCc1ccc(N2C[C@H](C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)CC2=O)cc1	728846085	UWVMCIBJRCKJPG-GOSISDBHSA-N	436.516	1.456	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCC(C)CC3)s2)n1	730204723	JLXKWENVRCZNLR-UHFFFAOYSA-N	439.563	1.443	50	20	IDGD	
COc1cccc(-n2ccnc2SCC(=O)NNC(=O)COc2ccccc2O)c1	730777703	AMPVGBCJSAOOKE-UHFFFAOYSA-N	428.470	1.905	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)N2CCN(CC(=O)N3CCCc4ccccc43)CC2)cc1	731361774	WWJSPNOPZKTNSZ-UHFFFAOYSA-N	446.511	1.510	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2nn(-c3ccc(F)c(F)c3)c3c2CCC3)C[C@@H](C)O1	732259758	JSLWEGKZSWQQJU-OKILXGFUSA-N	447.486	1.900	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CNC(=O)COc2ccccc2)cc1Br	732305539	NEJPXNOWWDVWMX-UHFFFAOYSA-N	436.262	1.414	50	20	IDGD	
CN1CCN(C)[C@@H](CNC(=O)NNC(=O)c2cn(-c3ccccc3)nc2-c2ccccc2)C1	732475028	QEMPRWIIPPKHNK-FQEVSTJZSA-N	447.543	1.729	50	20	IDGD	
C[C@@H](CC(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1)C(=O)c1ccccc1	732861801	QMDIOKKANQPMML-KBXCAEBGSA-N	426.425	1.426	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNC(=O)N[C@H]2CCN(CCN3CCOCC3)C2)cc1	734686707	SMQIKGJSQABHLJ-FQEVSTJZSA-N	447.580	1.462	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)[C@H](Cc1ccccc1)n1nnnc1C	735647155	JAXFKUOZKPCDIZ-IBGZPJMESA-N	432.488	1.525	50	20	IDGD	
CC(=O)NCC(=O)N1CCc2cc(C(=O)NNc3ccc(Br)nc3)ccc21	735686236	NSRQQPJWCLGPGE-UHFFFAOYSA-N	432.278	1.626	50	20	IDGD	
O=C(NNc1ccc(Cl)nn1)C1CCN(S(=O)(=O)c2cc(F)ccc2F)CC1	735689388	VMNWQBVEBNJKKG-UHFFFAOYSA-N	431.852	1.952	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)N[C@H]2CCC[C@@H](S(C)(=O)=O)C2)cc1OC	741093633	AZTJGYCCOGCIGY-LSDHHAIUSA-N	427.523	1.784	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NCc2ccc(N3CCCC3)nc2)cc1	743530068	DISWQNKVTUUWBD-UHFFFAOYSA-N	432.506	1.621	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CN2CCN([C@H](C)C(=O)Nc3cccc(F)c3)CC2)c1	744387629	VYAUSBFMYVZMNV-QGZVFWFLSA-N	441.507	1.540	50	20	IDGD	
COC(=O)c1ccc(N2CCN(CC(=O)NNC(=O)c3ccc(C#N)cc3)[C@H](C)C2)cc1	744393956	VXLRUAXHACJVSQ-MRXNPFEDSA-N	435.484	1.317	50	20	IDGD	
COc1ccccc1N1C[C@@H](C(=O)OCC(=O)NNC(=O)c2cccc(C)c2)CC1=O	744500099	UWWYJTNIXLCMSE-INIZCTEOSA-N	425.441	1.361	50	20	IDGD	
CC[C@H](NC(=O)OC(C)(C)C)C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	744621544	SIWATXYOROPNTQ-AWEZNQCLSA-N	442.538	1.454	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)CC2(O)CCCC2)c1	746094066	ZCVCNVILCGNFAH-UHFFFAOYSA-N	447.513	1.952	50	20	IDGD	
Cc1ccc([C@H](CNC(=O)NNC(=O)Cc2cn3ccccc3n2)N2CCOCC2)o1	746739965	FVZSRSLGNADPGF-KRWDZBQOSA-N	426.477	1.182	50	20	IDGD	
Cc1c(/C=C(\C#N)C(=O)N2CCN(S(=O)(=O)CCOC(C)C)CC2)cc(C#N)n1C	746873115	YVAUVGKBLPPIQR-WOJGMQOQSA-N	433.534	1.011	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cnc3c(cnn3C)c2)c1	747348857	TVLLBXPPQIHRPH-UHFFFAOYSA-N	430.490	1.074	50	20	IDGD	
CCCC[C@H](/N=C1/NS(=O)(=O)c2ccccc21)C(=O)NNC(=O)Cc1ccncc1	747428706	SROMQZIVQHXSHL-INIZCTEOSA-N	429.502	1.069	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)N2CCN(/C(=C\C#N)c3cccc([N+](=O)[O-])c3)CC2)C[C@@H](C)O1	750037021	UHNUTMDOKXJLQF-DQSGABEHSA-N	435.506	1.431	50	20	IDGD	
CCOC(=O)c1ccc(N2CC(NC(=O)NNC(=O)CCc3ccc(OC)cc3)C2)nc1	753278830	IEYPQGNXMHSSEV-UHFFFAOYSA-N	441.488	1.419	50	20	IDGD	
N#C/C(=C/c1ccc(O)cc1)C(=O)OCC(=O)N1CCc2cc(S(N)(=O)=O)ccc21	754548051	BJSVPOUXCOFNDJ-DHDCSXOGSA-N	427.438	1.079	50	20	IDGD	
O=C1CN(c2ccc(NC(=O)NNC(=O)c3ccc4c(c3)OCCO4)cc2Cl)CCN1	755937628	JYULKHADQCSTOJ-UHFFFAOYSA-N	445.863	1.514	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)N[C@@H]2CCN(c3c(F)cccc3F)C2=O)nc2ccccc21	756213333	UBNKOCDPGJPZLQ-OAHLLOKOSA-N	442.426	1.530	50	20	IDGD	
O=C(COC(=O)c1csc([C@H]2CCCO2)n1)NNC(=O)[C@H]1COc2ccccc2O1	756459939	NPAIAGJSKYYOEA-HUUCEWRRSA-N	433.442	1.139	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)Nc1ccc(F)c(-n2nnnc2C2CC2)c1	756777765	KWFBBOFSANILLM-UHFFFAOYSA-N	449.410	1.121	50	20	IDGD	
COc1cc(OC)c(OC)cc1NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1	757716335	WXEMCOABSRVMER-UHFFFAOYSA-N	430.465	1.572	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N2CC[C@H](NC(=O)NC3CC3)C2)cc1Br	760679275	VCXHXIAZWCDGIY-LBPRGKRZSA-N	440.298	1.348	50	20	IDGD	
CCC(=O)N1CC[C@H](NC(=O)NNC(=O)[C@H](C)Oc2cccc(Br)c2)C1	762081712	HZRLIWPIZXTDEU-AAEUAGOBSA-N	427.299	1.558	50	20	IDGD	
CCOc1ccc(OCc2ccc(C(=O)NNC(=O)Cn3cc([C@H](C)O)nn3)cc2)cc1	763015261	YCWSBYSQRLZKMG-HNNXBMFYSA-N	439.472	1.770	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2cc(C)ccc2C)c1	763507745	CHVDGNBAYBKBJU-UHFFFAOYSA-N	446.529	1.734	50	20	IDGD	
Cc1cccc(NC(=O)C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1	763509338	SCIQYNQBVMGYMW-UHFFFAOYSA-N	430.486	1.179	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2ccn(-c3ncccc3F)n2)c1	763651238	YOGGZXJXVOWCTB-UHFFFAOYSA-N	426.408	1.188	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(C(=O)OC)ccc1Cl	763683172	VLGSDYCCMJEOMR-UHFFFAOYSA-N	449.847	1.690	50	20	IDGD	
O=C(CSc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1ccn(CC(F)(F)F)n1	763733883	JUSCAKVARCVJIR-UHFFFAOYSA-N	435.815	1.977	50	20	IDGD	
O=C(Cc1ccsc1)NNC(=O)C(=O)Nc1ccc(Cl)c(-n2nnnc2C2CC2)c1	764025186	ORXGZWVAVZGGSC-UHFFFAOYSA-N	445.892	1.583	50	20	IDGD	
CS(=O)(=O)Cc1cc(F)ccc1NC(=O)C(=O)NNC(=O)c1cccc2ccccc12	764051089	KVJNNSRTWQVORT-UHFFFAOYSA-N	443.456	1.923	50	20	IDGD	
CC(C)(C)OC(=O)N1CCc2c(NC(=O)C(=O)NNC(=O)Cc3ccccn3)cccc21	764263313	DXYUXROGXYCOOE-UHFFFAOYSA-N	439.472	1.708	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ccc(C)o2)ccc1C	764372933	YMUXMDBQUBSASH-UHFFFAOYSA-N	436.490	1.327	50	20	IDGD	
C[C@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1NC(=O)NNC(=O)c1cc([N+](=O)[O-])ccc1O	764541711	VXPQLQUCUPOCKV-FZMZJTMJSA-N	437.453	1.890	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)Nc2cnn(-c3ncccc3C#N)c2)cc1	764737477	BOLBIKBJUPLZRI-CQSZACIVSA-N	433.428	1.962	50	20	IDGD	
COC(=O)NNC(=O)C(=O)Nc1ccc(CN2CCN(c3cccc(C)c3)CC2)cc1	765374494	TYKPMMXIYNLRCB-UHFFFAOYSA-N	425.489	1.643	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1ccc(C#N)cc1)C(=O)NNC(=O)Cn1ccc2ccccc21	765428050	PVMUJRPYTRRFDS-CQSZACIVSA-N	425.470	1.027	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1ccc(C(F)(F)F)cn1	765738439	KHGIKVBHPQYMQG-UHFFFAOYSA-N	435.406	1.319	50	20	IDGD	
CNc1cc(C(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)cc(Cl)n1	766648948	YRJIKMLDJADEGK-UHFFFAOYSA-N	430.940	1.664	50	20	IDGD	
COCCOCCS(=O)(=O)NC(=O)/C(C#N)=C\c1cc(C)n(C[C@H]2CCCO2)c1C	768220445	RAYSFMSRQQUWMY-XLXASQRYSA-N	439.534	1.300	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(OC(C)C)c(OC)c2)cc1	768234286	RSVXLIUFBIUTNI-UHFFFAOYSA-N	431.445	1.656	50	20	IDGD	
COCCOc1ncccc1C(=O)NNC(=O)c1cc(-c2ccc(OC)c(OC)c2)[nH]n1	768277047	PKSOTSYQRBSLNM-UHFFFAOYSA-N	441.444	1.589	50	20	IDGD	
Cc1ccc(-c2cc(-c3nnc(SCC(=O)NNC(=O)c4ccccc4)n3N)n[nH]2)cc1	768453741	VEDKTMNELCISFS-UHFFFAOYSA-N	448.512	1.911	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CN2C(=O)N[C@]3(CCCC(C)(C)C3)C2=O)cc1C	768571917	YMIOZEAOCLPDSQ-QFIPXVFZSA-N	443.504	1.280	50	20	IDGD	
CN(CCCC(=O)NNC(=S)Nc1ccccn1)C1=NS(=O)(=O)c2ccccc21	768578011	JFAITEXNSZNYLA-UHFFFAOYSA-N	432.531	1.260	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C3=NN(c4ccccc4)C(=O)[C@H](C)N3)n[nH]2)cc1	768848023	MAPBFLSAGDBZME-AWEZNQCLSA-N	431.456	1.485	50	20	IDGD	
C[C@@]1(c2cccc(C(=O)NNC(=O)CCSc3ccc(F)cc3)c2)NC(=O)NC1=O	768929878	JHLKNRBAIIFVEE-FQEVSTJZSA-N	430.461	1.824	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)c1cccc([C@]2(C)NC(=O)NC2=O)c1	769048811	MRQGODOCYKQGJM-QFIPXVFZSA-N	434.456	1.115	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)N[C@@H](C)[C@@H]2CN(C)CCO2)cc(OCC)c1OCC	770124829	SSAVTSPQJICCMI-KSSFIOAISA-N	438.525	1.546	50	20	IDGD	
CC[C@@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	770208069	GENYXHJJBFVHCJ-GOSISDBHSA-N	433.553	1.649	50	20	IDGD	
CS(=O)(=O)c1cc(S(=O)(=O)NNC(=O)c2cccc3ncccc23)c(Cl)s1	770634556	HVDPWUGCOAMLGO-UHFFFAOYSA-N	445.931	1.977	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)CNC(=O)c3ccc(Oc4ccccc4)cc3)nc21	771019953	HSKWFOSJNPFXDD-UHFFFAOYSA-N	433.428	1.734	50	20	IDGD	
CC[C@@H](NC(=O)OC(C)(C)C)C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	771392682	SIWATXYOROPNTQ-CQSZACIVSA-N	442.538	1.454	50	20	IDGD	
Cc1ccc(CN2C[C@H](C(=O)NNC(=O)C(=O)NCc3ccc(Cl)cc3)CC2=O)cc1	772197836	ZGRIQNQLHFGFOE-QGZVFWFLSA-N	442.903	1.461	50	20	IDGD	
Cc1cc(S(=O)(=O)NCCNC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c(C)s1	772624575	LBDDVLPOCGUFHL-UHFFFAOYSA-N	441.491	1.196	50	20	IDGD	
Cc1cccc(N2CCN(S(=O)(=O)CC(=O)NNc3nccnc3C(C)C)CC2)c1	772849399	VOSCADYHRWMOOL-UHFFFAOYSA-N	432.550	1.504	50	20	IDGD	
C[C@@H]1CN(C(=O)Cn2cc(NC(=O)C(=O)NNc3cccc(Cl)c3)cn2)C[C@@H](C)O1	773745123	VHGXLBOAZVKGGJ-CHWSQXEVSA-N	434.884	1.254	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3oc(=O)n(CCN(C)C)c3c2)cc1F	773890158	SVWPOBJMMONYPF-UHFFFAOYSA-N	443.435	1.003	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1cc(N(C)C)c2ccccc2n1	774328801	ZKDBANNSWZDMRC-UHFFFAOYSA-N	440.529	1.977	50	20	IDGD	
O=C(NNc1ccc(C(F)(F)F)cn1)c1ccccc1S(=O)(=O)N1CCOCC1	775249476	SUQABPONSIOXFG-UHFFFAOYSA-N	430.408	1.878	50	20	IDGD	
C[C@H](Oc1ccc(C#N)cc1)C(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776206600	WACZGWQRPMWUOM-HNNXBMFYSA-N	431.493	1.961	50	20	IDGD	
COC(=O)Nc1ccc(S(=O)(=O)NNC(=O)NCCc2cccs2)cc1[N+](=O)[O-]	777616041	BWEPSIVEDYIMEO-UHFFFAOYSA-N	443.463	1.570	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNS(=O)(=O)c1ccc(OCC(F)(F)F)nc1	777906801	HCTVHZHLQQQWRN-UHFFFAOYSA-N	429.380	1.602	50	20	IDGD	
CC(C)(C)OC(=O)N1CCCc2c(C(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)cccc21	778318633	QVJLQOSDLCSCQW-ZDUSSCGKSA-N	437.518	1.570	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)c1cc([N+](=O)[O-])c2nsnc2c1	778420647	ZZHUXSUYFIBASK-UHFFFAOYSA-N	434.821	1.330	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)NNC(=O)c1ccc(Br)s1	778589537	CAGSOPHJDKDVPX-UHFFFAOYSA-N	436.288	1.011	50	20	IDGD	
CCN1CCN(Cc2ccccc2CNC(=O)NNC(=O)CNC(=O)OC(C)(C)C)CC1	778615244	GQMUIHYQIAVGLQ-UHFFFAOYSA-N	448.568	1.179	50	20	IDGD	
COc1cccc2[nH]cc(CC(=O)NNC(=O)CN3CCN(Cc4ccc(C)cc4)CC3)c12	778688725	NIRKTFNXJBQMPT-UHFFFAOYSA-N	449.555	1.993	50	20	IDGD	
CCOc1cc(Cl)ccc1C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	778894057	SUYZPOMVHBZFJV-KRWDZBQOSA-N	434.832	1.883	50	20	IDGD	
CC(C)Oc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)C(=O)NNc1ccccc1F	782702771	NBSACRCPDGLUMC-UHFFFAOYSA-N	438.481	1.945	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)c(C(F)(F)F)c1	782887309	SCRVJPGKPAKCNA-UHFFFAOYSA-N	449.389	1.929	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2ccccc2S(=O)(=O)N2CCCCC2)cc1	783039577	SRTOGVJMDFTXGY-UHFFFAOYSA-N	432.502	1.952	50	20	IDGD	
CCOCCCNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)Nc2ccccc2C)c1	783416188	PGXZTZSNKAZRRD-UHFFFAOYSA-N	441.488	1.943	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2ccc(-n3cccn3)nn2)ccc1OCC(F)(F)F	783435955	DLDJDTQSQOIRCX-UHFFFAOYSA-N	435.366	1.994	50	20	IDGD	
Cc1cc(Br)ccc1NNC(=O)C(=O)Nc1cnn(CC(=O)NC2CC2)c1	784415559	YPPUODUOWWOSOZ-UHFFFAOYSA-N	435.282	1.314	50	20	IDGD	
CN1CCN(CCOc2ccc(NC(=O)C(=O)NNc3cc(Cl)ccn3)cc2)CC1	784856442	KWBHVSHBVMDMRA-UHFFFAOYSA-N	432.912	1.443	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccc(C#N)c(Cl)c2)cc1	785091545	GYLWNQKNLGAUGG-UHFFFAOYSA-N	435.893	1.980	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2ccc(S(=O)(=O)NC3CC3)cc2)cc1Cl	785117846	WODPYZJYHSJNDW-UHFFFAOYSA-N	438.893	1.871	50	20	IDGD	
COCCOCC(=O)NC1CCC(C(=O)NNC(=O)NCc2ccc(Cl)cc2)CC1	787427807	GDGNNONACOBZAT-UHFFFAOYSA-N	440.928	1.508	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2cc(C)cnc2Cl)cc1	787449279	URXQPWCOJNVGII-UHFFFAOYSA-N	425.898	1.825	50	20	IDGD	
CSCC[C@@H](O)C(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	788624941	NOSDMGUUTQSGNP-QGZVFWFLSA-N	426.502	1.263	50	20	IDGD	
O=C(NNC(=O)[C@H]1COCCO1)C(=O)Nc1ccc(-c2ccc(Cl)cc2Cl)nc1	789586552	PVAJBKOGSFRWBT-OAHLLOKOSA-N	439.255	1.557	50	20	IDGD	
CC[C@@H]1CCc2nc(NC(=O)C(=O)NNC(=O)c3cncc(NC(C)=O)c3)sc2C1	789739455	OMYBCWSSGDPALO-LLVKDONJSA-N	430.490	1.411	50	20	IDGD	
Cc1ccc(S(C)(=O)=O)cc1NC(=O)C(=O)NNC(=O)[C@H]1OCC[C@H]1c1ccccc1	789810874	SAWGWXDFWGCRAQ-WMZOPIPTSA-N	445.497	1.057	50	20	IDGD	
O=C(CCC(=O)c1ccc2c(c1)OCCO2)NNC(=O)c1nn(-c2ccccc2)cc1O	789852779	JDXZQBWKQJSYND-UHFFFAOYSA-N	436.424	1.773	50	20	IDGD	
COC(=O)c1cc(C=NNC(=O)CN2c3cccc4cccc(c34)S2(=O)=O)cn1C	790148860	FRYRIORHHJOSTD-UHFFFAOYSA-N	426.454	1.624	50	20	IDGD	
COc1cc(C(F)(F)F)ncc1NC(=O)C(=O)NNC(=O)[C@@H]1COc2ccccc2O1	792268725	PSPTUPDBRZUJOD-ZDUSSCGKSA-N	440.334	1.035	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2c3c(nn2-c2ccc(Cl)cc2)CCC3)n[nH]1	792269416	SMKMAAHGXWNCSI-UHFFFAOYSA-N	427.852	1.446	50	20	IDGD	
CCOc1ccc(-c2nc(CC)c(C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)s2)cc1	792642060	NCWXROIQTPFWOS-NSHDSACASA-N	440.547	1.470	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)nc1Br	793027158	YDTLZJZVASOERM-UHFFFAOYSA-N	435.234	1.323	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)Cc2ccc(S(=O)(=O)N(C)C)cc2)o1	793187592	XUWAOAFJKWHQLH-UHFFFAOYSA-N	436.534	1.375	50	20	IDGD	
CCn1ncnc1CNC(=O)/C(C#N)=C\c1cn(CCC(N)=O)nc1-c1ccc(OC)cc1	794232930	OGNGVXJSPXONDP-YBEGLDIGSA-N	448.487	1.269	50	20	IDGD	
C[C@H](CN1CCOCC1)C(=O)NN=Cc1c(F)ccc(I)c1F	794477751	GKJAMSJQYVMEGO-SNVBAGLBSA-N	437.228	1.988	50	20	IDGD	
CN(C)c1cc(F)c(C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)cc1[N+](=O)[O-]	794716189	BWVUYFBCGYCFBX-UHFFFAOYSA-N	425.442	1.807	50	20	IDGD	
COc1cc(C)c(NC(=O)C(=O)NNC(=O)CNC(=O)OCc2ccccc2)cc1C	797368495	BLSBGRGCUAKBLX-UHFFFAOYSA-N	428.445	1.324	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccc(NC(=O)OC)c1C	798042292	PRIYEBUXAVUQMU-UHFFFAOYSA-N	444.444	1.737	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)c2cc([N+](=O)[O-])cnc2O)c2ccccc2c1=O	798355586	ZYWYEUOUMIZKLR-UHFFFAOYSA-N	440.416	1.670	50	20	IDGD	
CCn1ncc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1C(F)(F)F	799241194	QNGDGEDHHQEPRS-UHFFFAOYSA-N	448.427	1.639	50	20	IDGD	
O=C(N=c1cc[nH]cc1)NNC(=O)C1CCN(S(=O)(=O)/C=C\c2ccccc2)CC1	802030751	QOLFOYDDHCMQMA-GDNBJRDFSA-N	429.502	1.369	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)C1CC1	802069132	XINGISUSVMNMTC-HNNXBMFYSA-N	440.522	1.936	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@H](C(=O)NNc2ccc3c(=O)[nH]ccc3c2)[C@@H](C)O)cc1	803433190	KNIOYRQHPSEURT-ACJLOTCBSA-N	430.486	1.008	50	20	IDGD	
CCN(CC)CC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)Cc2ccsc2)c1	806977166	YBBMZWDQKSMSER-UHFFFAOYSA-N	431.518	1.357	50	20	IDGD	
CCOC(=O)C1CCN(S(=O)(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)CC1	808112440	UZKKPESXPFROGQ-LBPRGKRZSA-N	433.914	1.248	50	20	IDGD	
CN(NC(=O)[C@@H]1C[C@@H](c2ccccc2)OC1=O)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	809763123	KALXNPFHIRLNJF-IRXDYDNUSA-N	446.504	1.927	50	20	IDGD	
C[C@@H]1Oc2ccccc2N(CC(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)C1=O	811791621	YLDHLHMOKQGOBX-LBPRGKRZSA-N	431.832	1.458	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)NCc2cccc(N3C(=O)NC4(CCCC4)C3=O)c2)n1	811913078	LATABOUGAPGLSZ-UHFFFAOYSA-N	436.472	1.903	50	20	IDGD	
O=C(CCc1ncccn1)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	812452086	BVXTXGZMPBKYFC-UHFFFAOYSA-N	431.499	1.733	50	20	IDGD	
CCCn1c(=O)n(CCC(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)c2ccccc21	812728473	MEIBVMGOSKKANF-UHFFFAOYSA-N	445.545	1.997	50	20	IDGD	
CC(=NNC(=O)Cc1cc[nH]n1)c1ccc(S(=O)(=O)N2CCCC[C@H]2C(=O)O)cc1	814957658	MHJUQFRHCQGWEE-KRWDZBQOSA-N	433.490	1.120	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NNC(=O)[C@@H]2CCN(c3ccc(F)cc3)C2=O)C1	816510236	PWDCRLMABHRLDF-PBHICJAKSA-N	448.495	1.973	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2CCN(C(C)C)C[C@H]2c2cnn(C)c2)cc1	849487539	OWNZXXWJGVZUIH-MOPGFXCFSA-N	426.521	1.329	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@@H](CSC)N2C(=O)[C@H]3CCCC[C@H]3C2=O)cc1OC	859323315	ZOHAWGKDMGGMAI-QLFBSQMISA-N	449.529	1.372	50	20	IDGD	
Cc1ccc(C(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)cc1NS(C)(=O)=O	907574276	AANZHVHSLGDIEC-UHFFFAOYSA-N	439.877	1.638	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)c2cc(C3CC3)nc3c2c(O)nc(=O)n3C)c1	914125629	FHEXGAWZOBTZCK-UHFFFAOYSA-N	437.456	1.368	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cnn1-c1ccc(F)cc1F	915190919	SJNHFYYPVNUKOM-UHFFFAOYSA-N	438.394	1.781	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1csc(NC(C)=O)n1	915387602	FRXLDHCLPMSWSY-UHFFFAOYSA-N	426.838	1.382	50	20	IDGD	
COc1cccc(C[C@@H](C(=O)NNC(=O)c2cc(OC)cc(OC)c2)n2nnnc2C)c1	915691267	SNKKARIRMMQWGJ-IBGZPJMESA-N	440.460	1.252	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)NC1CCCCCCC1	915884549	DPECQLOMZLOWKY-UHFFFAOYSA-N	438.550	1.764	50	20	IDGD	
CC(=NNC(=O)CN1CCCC1=O)c1ccc(S(=O)(=O)NCc2ccccc2)cc1	916357850	ONQKVZNIUMQYNY-UHFFFAOYSA-N	428.514	1.628	50	20	IDGD	
O=C(NCCc1ccc(N2CCCCC2)cc1)NNC(=O)c1ccc(-n2cnnn2)cc1	916636938	QHSUCBYJSODHDG-UHFFFAOYSA-N	434.504	1.839	50	20	IDGD	
CCOc1ccccc1C(=O)N1CCN(CC(=O)NNC(=O)c2ccc(F)cc2)CC1	917141661	LWVPPYCTQJORBJ-UHFFFAOYSA-N	428.464	1.443	50	20	IDGD	
C[C@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1)n1cccn1	918199374	YAELPYWHXLELRA-OAHLLOKOSA-N	427.486	1.384	50	20	IDGD	
CC[C@@H](NC(=O)NNC(=O)Cc1ccccc1OC)c1ccccc1OCC(=O)NC	919907716	KLTGPPQUNUOSNW-QGZVFWFLSA-N	428.489	1.844	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)c1ccn(-c2cccc(F)c2)n1	920273443	HQVWDSXNWDBDBX-UHFFFAOYSA-N	436.491	1.985	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNS(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])cc1C	920309479	ISJHLXCNRPMGLC-UHFFFAOYSA-N	426.838	1.813	50	20	IDGD	
O=C(CN1CCCC1=O)NN=C1CCCOc2ccc(I)cc21	920371110	PYKHQLIOIHSDIW-UHFFFAOYSA-N	427.242	1.907	50	20	IDGD	
CC(C)c1ccc(-c2noc(CCC(=O)NNC(=O)CNC(=O)c3ccco3)n2)cc1	1115941085	ZDSWFZXJBMQISK-UHFFFAOYSA-N	425.445	1.963	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)c2c(O)nn(C)c2n1	1116085804	QTHIBZJILBDCRN-UHFFFAOYSA-N	432.481	1.390	50	20	IDGD	
COc1ccc(S(=O)(=O)CCC(=O)OCC(=O)NNC(=O)c2cccc(C)c2)cc1	1116167112	VFRFLIIATOSFHU-UHFFFAOYSA-N	434.470	1.172	50	20	IDGD	
CN(C)C(=O)COc1ccccc1C(F)(F)C(=O)NNC(=O)c1n[nH]c2c1CCCC2	1254294651	TZLDQBFPMUEWGR-UHFFFAOYSA-N	435.431	1.309	50	20	IDGD	
O=C(NNc1cccnn1)[C@H]1Cc2ccccc2CN1S(=O)(=O)c1ccc(F)cc1	1254616125	STXXAXNMJNKFSH-GOSISDBHSA-N	427.461	1.875	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2ccccc2CN2CCN(C(C)=O)CC2)cc1	1320525455	WUTZYDDNTHFRLM-UHFFFAOYSA-N	425.489	1.826	50	20	IDGD	
O=C(NNc1cncc(Br)c1)c1cccc(CN2CCS(=O)(=O)CC2)c1	1324494265	QUNMDUXWSHSMAC-UHFFFAOYSA-N	439.335	1.831	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)c1ccc(S(=O)(=O)NC[C@H](C)O)cc1	1338721951	VNQYBNMXFKIHHX-NSHDSACASA-N	441.893	1.083	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CO[Si](C)(C)C)C2	1778106513	YSLZFFHJDQXZGE-WRWLIDTKSA-N	427.618	1.219	50	20	IDGD	
Cc1c(C(=O)N2CCO[C@@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)nc2ccccn12	1779295963	YKBZSGVDRSWVBR-OAQYLSRUSA-N	430.581	1.938	50	20	IDGD	
CN(CC(=O)N1CCO[C@]2(CCN(C(=O)CO[Si](C)(C)C)C2)C1)C(=O)OC(C)(C)C	1779296415	ROOLAMMIEWRUTM-FQEVSTJZSA-N	443.617	1.535	50	20	IDGD	
COc1ccnc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)c1	1779535098	NGMILNKEWSJFAK-ACJLOTCBSA-N	426.311	1.565	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnn(C)c3Cl)C2)C1	1779857218	ZGHXRMORZSGXIT-MEDUHNTESA-N	433.734	1.548	50	20	IDGD	
C=C1CC(C(=O)N2CCO[C@@]3(CCN(C(=O)c4cc([N+](=O)[O-])ccc4OC(C)=O)C3)C2)C1	1780095644	VPVALBBPKOQLAK-JOCHJYFZSA-N	443.456	1.930	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(OC)cc3OC)C2)C1	1780536858	PTORVUADVJQCGD-OXJNMPFZSA-N	426.897	1.401	50	20	IDGD	
COc1cccc(CC(=O)N2CCO[C@]3(CCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)n1	1781224100	HLSCDEGWCORTTR-RBUKOAKNSA-N	430.332	1.699	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)CNC(=O)c3cccs3)CCO2)C1	1781225254	UTVRRRHXPSATPD-ZWKOTPCHSA-N	448.372	1.544	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)C3(Br)CC3)C2)C1	1781340634	MVJZJYBOPFAAJQ-RISCZKNCSA-N	438.160	1.775	50	20	IDGD	
O=C(c1ccc(OC(F)(F)F)cc1)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1781556916	QSMVIIXCDFNTKR-RHSMWYFYSA-N	436.814	1.628	50	20	IDGD	
COC(=O)C1(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@](C)(Cl)CCl)C3)CC1	1781811993	GFLOFMBLHXZGND-FSPWUOQZSA-N	435.348	1.690	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3c(F)ccc(OC)c3OC)C2)C1	1781820809	DYZCDYVTVWUTGP-RBZFPXEDSA-N	444.887	1.540	50	20	IDGD	
CC(C)n1cnc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](C)Br)C2)n1	1781999405	XWXVBXIVWNHMDG-HBUWYVDXSA-N	442.358	1.770	50	20	IDGD	
O=C(NCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C(Cl)Cl)C1)c1cccnc1	1782215072	WGJWYKPYIHPPDC-AUUYWEPGSA-N	443.331	1.129	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(CCN(C(=O)c3cccc4c3NC(=O)C4)C2)C1	1782412517	GJJNBHKABGPTCE-OAQYLSRUSA-N	431.565	1.476	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cnc(Cl)nc3)CCO2)C1	1783338299	GFCOCDGPHLMOOS-BLLLJJGKSA-N	431.718	1.747	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)CCc3cnn(C)c3)CCO2)C1	1783342803	OREOYWJIVPRZCT-YJBOKZPZSA-N	427.343	1.356	50	20	IDGD	
CC(C)Oc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]3C2)cc1C#N	1784095338	BHNFALIZYHDFSR-BOLBYERCSA-N	449.935	1.538	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](C)Cn3ccnc3)C2)C1	1784506040	LSCAHGCTNXJJKT-VKJFTORMSA-N	427.343	1.523	50	20	IDGD	
C[C@@](O)(C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)C(F)(F)F	1784871634	YWSONYBSUKEVIW-AYGWYOGXSA-N	431.249	1.064	50	20	IDGD	
COc1ccc(F)c(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)c1	1785017318	AWFRQQKIUIJDSG-YOEHRIQHSA-N	433.249	1.968	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)c1ncc(Cl)cn1	1785821046	NQUXSQRMYUGWNV-PDEGPIFNSA-N	435.681	1.414	50	20	IDGD	
N#CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](Br)Cc3ccccc3)C[C@@H]21	1786369119	LHFDLXDUBBLJQL-XSLAGTTESA-N	434.334	1.886	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(C)(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]3C2)C1	1787446886	XYPNHVPRPNQLHW-AJNGGQMLSA-N	447.935	1.758	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccn4ccnc34)[C@H]2C1	1788366579	FEKPLUCFBZNUAC-SZMVWBNQSA-N	430.581	1.779	50	20	IDGD	
O=C(C#CC1(O)CCCCC1)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21	1788628595	VWKDNRHTKBTZIR-ULQDDVLXSA-N	441.366	1.450	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)COc3ccc(O)cc3)C[C@@H]21	1788762270	RHVVYCNEKWSHEH-SNRMKQJTSA-N	436.581	1.602	50	20	IDGD	
COc1nc(C)ccc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CO[Si](C)(C)C)C[C@@H]21	1789014201	JJAWSEZFUDLYOY-SZMVWBNQSA-N	435.597	1.843	50	20	IDGD	
NC(=O)c1ccccc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]2C1	1789923412	LRANZSQGCJARRT-FBUXBERBSA-N	442.285	1.069	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)c1cc2ncccc2[nH]1	1790336011	MJDQIWIYIOCEEM-KUDNYVPYSA-N	439.285	1.847	50	20	IDGD	
CC[C@H](Cl)C(=O)Nc1ccc(C2(NC(=O)c3cc(=O)n4[nH]nnc4n3)CCC2)cc1	1790485622	BIPHNYFTNOTPFN-ZDUSSCGKSA-N	429.868	1.578	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3C[C@@]3(F)Cl)[C@H]2C1	1791367673	RLWGVWVJVSHMRE-IQXDSVOMSA-N	425.726	1.922	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1=NN(c3ccccc3)C(=O)C1)C2	1793446831	NWTCGRQTILYGRJ-DOHHPOSVSA-N	446.935	1.776	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1Cc2ccccc2CN1C	1794082011	YWKOTJFRRDQBIV-WOZUAGRISA-N	441.576	1.054	50	20	IDGD	
O=C1CC[C@@H](C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](Br)Cc2ccccc2)C3)N1	1795703478	QYOSNKSZLZHRAI-ILOCAZANSA-N	448.361	1.909	50	20	IDGD	
CCc1[nH]nc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCBr)C3)c1Cl	1795905545	BNKDGAUJOBWCJX-WDAIWFPHSA-N	433.734	1.614	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc3cnccc3c1)C2	1798440743	ZDOWSPVFLNFDNB-REPLKXPHSA-N	444.495	1.799	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ncn(-c3cccc(F)c3)n1)C2	1799264349	KMFQSOUIRHCQST-RMHZUWNSSA-N	435.887	1.627	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CC(=O)Nc1ccc(F)cc1)C2	1799269319	XGCJBEVVLVQNCD-UESRRSCYSA-N	425.888	1.761	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CCC[C@H]3CCCC[C@@H]31)C2	1801011453	MAVGCRMVFCLXKB-TYUQVFQOSA-N	448.608	1.556	50	20	IDGD	
COc1ccc(F)cc1CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CO[Si](C)(C)C)C2	1801098025	DQKZOHWZVYHCSG-VPTLXERWSA-N	438.572	1.818	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC2(CCCN(C(=O)CNC(=O)N(C)C)C2)CC1	1805040153	PTIQZLLDIPKGQG-AWEZNQCLSA-N	431.375	1.662	50	20	IDGD	
CCOC(=O)/C=C/C(=O)NC[C@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1	1806294061	LRBUSVFGOWGQBU-XWMIQMMGSA-N	438.322	1.992	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@H](CNC(=O)CCBr)[C@@H]2c2cccnc2)nn1	1806343342	PPJBUIQMAGXEPM-KDOFPFPSSA-N	448.321	1.985	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)C2CCCCC2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1	1807371756	ZOUNXEKZWVGLMP-RBBKRZOGSA-N	435.333	1.661	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)Cc2cccnc2)[C@@H]1c1cccnc1	1807626768	JKAZURHXUNIBDA-CVDCTZTESA-N	438.532	1.098	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)[C@@H]2C[C@H]2C2CC2)[C@@H]1c1cccnc1	1810293277	BSWJHRYRVQLMSC-XFIJJGBISA-N	448.527	1.446	50	20	IDGD	
Cn1cccc1C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1	1810297333	BRLTWMSGSUKRNF-JXFKEZNVSA-N	447.499	1.052	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)c2ccncc2)[C@@H]1c1cccnc1	1810299187	NXFKWJNDXRGWRY-YLJYHZDGSA-N	445.483	1.109	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](F)Cl)[C@H]1c1cccnc1)c1cc(=O)nc2cccnn12	1811336180	PKVWTYRDEUXXLQ-KKXDTOCCSA-N	444.854	1.339	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2cn3cccnc3n2)[C@H]1c1cccnc1	1813029897	ALGZYWVUTLEAOB-RYRKJORJSA-N	442.907	1.698	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)C(=O)c2cccn2C)[C@@H]1c1cccnc1	1813033827	SXDDVNSMIPCUMZ-SOLBZPMBSA-N	432.908	1.563	50	20	IDGD	
Cc1ncc(C(=O)N2CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)s1	1813070216	HFWBZESMRJWAKS-JXFKEZNVSA-N	444.561	1.539	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1CCc2nc(NC(=O)CN3CCOCC3)sc2C1	1814557313	BFDQRZSTOMTFDP-NWDGAFQWSA-N	445.383	1.418	50	20	IDGD	
C[C@H](CBr)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CN2CCNC2=N)[nH]n1	1814779988	CLRYJJXHAZTOQV-DGCLKSJQSA-N	440.346	1.273	50	20	IDGD	
C[C@H](CBr)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](N)CCC(N)=O)[nH]n1	1814780874	UAFRAVQXKGFLTK-NTZNESFSSA-N	443.346	1.026	50	20	IDGD	
CC(C)(C)[C@@H](O)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1814822858	PAWXQOPIUJJVSI-WBVHZDCISA-N	443.508	1.121	50	20	IDGD	
CCS(=O)(=O)N[C@H](C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)C(Cl)Cl)[nH]n1	1815167870	KNZSCRSLNHAWEC-MWLCHTKSSA-N	440.353	1.533	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)C(=O)c2ccco2)n[nH]1	1815757882	KJQOKNPRXXANHR-AWEZNQCLSA-N	430.465	1.251	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccnc2C(N)=O)n[nH]1	1816077004	APTSUHNRXZKJMT-TZMCWYRMSA-N	434.884	1.463	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC[C@H]1c1cc(NC(=O)C[C@@H](NC)C(=O)O)n[nH]1	1817368076	GWACFLNQPCOARC-UHTWSYAYSA-N	444.330	1.638	50	20	IDGD	
CCc1ccnc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)c1	1817475553	SVBWWABNFSHBTE-HXUWFJFHSA-N	447.304	1.667	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CNC(=O)c2ccco2)n[nH]1	1817606655	LFHJLYSIABCOBK-JSGCOSHPSA-N	437.884	1.679	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](N)Cc2cccnc2)n[nH]1	1818073708	YNYVPIBWFSVFDM-YQQAZPJKSA-N	434.928	1.621	50	20	IDGD	
CC(=O)Nc1cc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)[C@@H](O)CCl)[nH]n2)ccn1	1818416590	TYNVLJLEGFEFJH-GJZGRUSLSA-N	434.884	1.669	50	20	IDGD	
C[C@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1)n1cccc1	1822678471	YLFMMICIJSTHAD-WBVHZDCISA-N	429.525	1.838	50	20	IDGD	
Nc1n[nH]c(CCC(=O)N[C@@H]2CCc3nc(NC(=O)[C@H](F)Br)sc3C2)n1	1823007113	JEMSCRZJRGVMLR-KBUNVGBDSA-N	446.306	1.079	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCN2CCCC2)n[nH]1	1823575276	SNMRLKAHIFNHGR-QGZVFWFLSA-N	433.557	1.261	50	20	IDGD	
COCCn1ccc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)[C@H](O)CCl)CC2)n1	1824182758	JECFBWCZTCIPAP-ZWKOTPCHSA-N	426.945	1.363	50	20	IDGD	
CC(C)(C)OCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1	1824893683	NLLPTLMKXPZBHA-FQEVSTJZSA-N	430.354	1.415	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(C(C)=O)[nH]n1)CC2	1825994657	WWKMXAPVLXCBTB-VHSXEESVSA-N	425.898	1.548	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccoc1Cl)CC2	1826088663	IJYKQJUTQBQSNF-SNVBAGLBSA-N	439.925	1.988	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)CC(F)(F)F)CC1	1826674974	WUNOECTVWKMOAA-QGZVFWFLSA-N	426.244	1.552	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)Cc2ccsc2)CC1	1827161704	RBICRQOHZUJKHV-OAQYLSRUSA-N	440.374	1.904	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(O)nc(O)n2)CC1	1829102061	LAUPSBRHBIUPKA-INIZCTEOSA-N	436.585	1.973	50	20	IDGD	
CC[C@@H](O)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1	1830526777	LUDBUFGQEFBOPB-UNHHPSKZSA-N	449.454	1.099	50	20	IDGD	
Cc1ncc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)s1	1830538542	IRKZIBOFOUNTFG-YVEFUNNKSA-N	446.367	1.553	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CNC(=O)C(F)(F)F)CC1	1831834367	COPHBCOEEWGEOT-KGLIPLIRSA-N	441.878	1.538	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2cnc[nH]2)CC1	1832096517	FVGRMTKUEJYEHS-SHBDEGQCSA-N	436.321	1.036	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC([C@H]2CCCCN2C(=O)CCS(C)(=O)=O)CC1	1832399040	HBRXPZJSQFCLEJ-DZGCQCFKSA-N	437.400	1.824	50	20	IDGD	
C[C@@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)CC3(O)CCC3)CC2)CC1	1833266209	UZVSCBKKCDAPBF-HNNXBMFYSA-N	444.414	1.894	50	20	IDGD	
C[C@H](Nc1ccccn1)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)CCl)CC2)CC1	1833312189	JLXSRFKALUJBCX-YJBOKZPZSA-N	437.972	1.053	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(C)n3)CCO2)C1	1834049867	FSWVTJPLPOASNG-DNVCBOLYSA-N	440.338	1.634	50	20	IDGD	
Cc1cc(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](C)Br)CC3)CC2)n(C)n1	1834189854	JCMXCVDQWXRLGZ-CQSZACIVSA-N	440.386	1.697	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1834502361	CGJFJPXECGUSCI-LJQANCHMSA-N	425.932	1.540	50	20	IDGD	
C[C@@H](C(=O)NC1CCN(C2CCN(C(=O)C(Cl)Cl)CC2)CC1)N1C[C@H]2C[C@H]2C1	1835676658	IYJXOEVIOUELIC-SOUVJXGZSA-N	431.408	1.702	50	20	IDGD	
CCc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](Br)CC)C3)C2)n[nH]1	1836281845	HLSBZOFQIQGFFJ-KDOFPFPSSA-N	443.342	1.216	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc4cncn4c3)CCO2)C1	1837118622	XPOHKJJMUNARNT-NQIIRXRSSA-N	434.924	1.812	50	20	IDGD	
O=C(CC1CCCC1)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1	1837609045	IWLBJUNDGQXOFW-UHFFFAOYSA-N	442.365	1.559	50	20	IDGD	
COCc1c[nH]c(C(=O)N2CCOC[C@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)c1	1837715223	CVJNVSBODDSIHF-FQEVSTJZSA-N	439.585	1.083	50	20	IDGD	
CC(C)c1cc(C(=O)N2CCOC[C@@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)n[nH]1	1837715230	DBKRATLNBVPXOF-HXUWFJFHSA-N	438.601	1.455	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)C3CCSCC3)C2)C1	1837717661	LNQWBLGVHORHNM-LJQANCHMSA-N	430.643	1.438	50	20	IDGD	
C[C@@H](C(=O)N1CCC(OC2CCN(C(=O)CO[Si](C)(C)C)CC2)CC1)n1ccnn1	1838431964	GUTHTUOHEUWJCL-INIZCTEOSA-N	437.617	1.689	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](COC)NC(C)=O)CC2)CC1	1838435055	MNZHAHGEYAETTJ-ZWKOTPCHSA-N	431.961	1.154	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)c3ccc(O)cc3)CC2)CC1	1838596886	FFMOWBPZZIAHFE-UHFFFAOYSA-N	446.548	1.377	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccccc3)CCO2)C1	1838852442	LTJSMHXOXPSHQI-QFBILLFUSA-N	425.323	1.930	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc4snnc4c3)C2)C1	1839146765	VPMHDYGGWIDARI-FZKQIMNGSA-N	439.925	1.174	50	20	IDGD	
C=C(CC(=O)OCC)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1839173172	CSHBPWRGHBOXCQ-FQEVSTJZSA-N	430.929	1.217	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(O)c(O)c(Cl)c3)CCO2)C1	1839433622	MHPIDFUNTGRWSW-ORAYPTAESA-N	447.315	1.839	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(C)cn3)C2)C1	1839963506	MNTOKSNISSXZLH-KXBFYZLASA-N	440.338	1.634	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)nc1	1840031594	VZQVIDPDHAFJSY-KDOFPFPSSA-N	426.311	1.243	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C1CC1)CCO2	1840637714	RZAAFGRCGXWPEC-CQTHNFAISA-N	431.439	1.738	50	20	IDGD	
O=C(/C=C/c1ccc(O)cc1Cl)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843015195	RYRCPDGKYVPVKR-SOFGYWHQSA-N	440.692	1.256	50	20	IDGD	
Cc1nc[nH]c1C(=O)N1CCCC12CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1843521598	KBSBFCGJOVORHX-ZDUSSCGKSA-N	425.917	1.667	50	20	IDGD	
Cc1ccn2c(=O)c(C(=O)N3CCCC34CN(C(=O)[C@@H](C)CBr)C4)cnc2c1	1843786334	AAQYJVOXUNSKBA-AWEZNQCLSA-N	447.333	1.851	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)c2cc3cc(F)ccc3s2)C1	1844064010	XWDXPVHUDZBHCH-UHFFFAOYSA-N	438.289	1.851	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2c[nH]c3cnccc23)C1	1844142824	ZTXCCLZSPMVGAF-VULFUBBASA-N	433.472	1.514	50	20	IDGD	
O=C([C@@H](O)CCl)N1CC2(CCCN2C(=O)c2cc3c[nH]nc3cc2Br)C1	1844685560	YVEOSLDOGPAZOT-AWEZNQCLSA-N	441.713	1.742	50	20	IDGD	
C#CCCC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)[C@@H](O)CCl)C2	1845131527	LPQKWBULIYGUBI-CVEARBPZSA-N	441.956	1.486	50	20	IDGD	
O=C(Cn1ccc2sccc2c1=O)N1CC2(CCCN2C(=O)[C@@H](F)Br)C1	1845216226	CQMCAKXDJWZPGT-CQSZACIVSA-N	442.310	1.957	50	20	IDGD	
O=C(COCCO)N1CC2(CCCN2C(=O)[C@@H](Br)Cc2ccccc2)C1	1845942190	QMERQQOQDKRFKN-INIZCTEOSA-N	425.323	1.205	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC12CN(C(=O)c1cccc3c1NC(=O)C3=O)C2	1846070979	OQXGKXXMMQIUFW-ZDUSSCGKSA-N	434.290	1.812	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@H]2C[C@@](C)(O)CN2C(=O)OC(C)(C)C)C1	1846231265	KCVXDMSFJLSJJC-QEEYODRMSA-N	443.972	1.968	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@H]1CCN(C(=O)OC(C)(C)C)C1)C2	1846362749	UFROZGXTLKSNDY-HUUCEWRRSA-N	429.945	1.701	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC2(CCCN2C(=O)CSCC(=O)O)C1	1846389973	TZEGMTYDZPNLIO-LBPRGKRZSA-N	449.957	1.140	50	20	IDGD	
O=C(COC(=O)c1ccc(S(=O)(=O)C(F)F)cc1)NNC(=O)c1ccc(Cl)cc1	9788280	HEDYSQLUVFHZRD-UHFFFAOYSA-N	446.815	1.954	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)[C@H](C)NC(=O)c1ccccc1	14761576	IVXKZWASKYCHRT-LBPRGKRZSA-N	433.848	1.471	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)CCN2C(=O)NC3(CCCC3)C2=O)cc1	18071398	MNJUPUXWYKHDHO-CQSZACIVSA-N	432.477	1.255	50	20	IDGD	
CC(C)N1CCN(c2ccc(C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)cc2)CC1	109901657	PCFUVXHEPGWNLI-UHFFFAOYSA-N	434.504	1.268	50	20	IDGD	
O=C(CNC(=O)c1ccc(Cl)c(Cl)c1)NNC(=O)CNC(=O)c1cccs1	725902163	HYIYITXRFWWSJP-UHFFFAOYSA-N	429.285	1.362	50	20	IDGD	
COC(=O)N1CCC[C@H](NC(=O)NNC(=O)[C@H](C)Oc2cccc(Br)c2)C1	726610553	LNYJMCBGJPNTMR-AAEUAGOBSA-N	443.298	1.778	50	20	IDGD	
COc1ccc(CN2C[C@H](C(=O)NNC(=S)NCCc3cccs3)CC2=O)cc1	726631300	XUCJDPKFCDPJLN-OAHLLOKOSA-N	432.571	1.843	50	20	IDGD	
COc1ccc(CN2C[C@@H](C(=O)OCC(=O)NNC(=O)c3ccc(C)cc3)CC2=O)cc1	726684186	ZOWFBENAVVVRKS-SFHVURJKSA-N	439.468	1.357	50	20	IDGD	
CCn1c(=O)c2ccccc2n(CC(=O)NNC(=S)Nc2ccc(OC)c(F)c2)c1=O	727498862	GDGMNUHZYCRSIX-UHFFFAOYSA-N	445.476	1.349	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@@H]2C(=O)NNc2nc(-c3cccnc3)no2)s1	728077260	UTGVSKXAZLEYQX-CYBMUJFWSA-N	434.503	1.798	50	20	IDGD	
CS(=O)(=O)N1CCC[C@@H]1C(=O)NNc1ccc(S(=O)(=O)Nc2ccccc2)cc1	728217957	WEQRCAUMXQJKAW-QGZVFWFLSA-N	438.531	1.355	50	20	IDGD	
O=C(COC(=O)[C@H](c1ccccc1)n1cccn1)NNC(=O)[C@H]1COc2ccccc2O1	728332725	NPFVBLNYWNGKQA-QUCCMNQESA-N	436.424	1.003	50	20	IDGD	
COc1cccc2c1OC[C@H](NC(=O)NNC(=O)c1sc(N3CCOCC3)nc1C)C2	728398871	KSIUWTARWFUMOU-CQSZACIVSA-N	447.517	1.244	50	20	IDGD	
O=C(Cc1cc[nH]n1)NNC(=O)c1ccc(S(=O)(=O)Nc2ccc(Cl)cc2)cc1	730103046	VNPOCLVIKYXWBW-UHFFFAOYSA-N	433.877	1.868	50	20	IDGD	
Cc1noc(C)c1S(=O)(=O)N1CCC(C(=O)NN=c2cc[nH]c3ccccc23)CC1	730289083	UAMYCRNHMSUZAC-UHFFFAOYSA-N	429.502	1.806	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)Nc1ccc(CC(=O)N2CCOCC2)cc1	730895969	MRHPIJUDLPHWFX-UHFFFAOYSA-N	428.445	1.025	50	20	IDGD	
COC(=O)c1sc2ccccc2c1S(=O)(=O)NNC(=O)[C@@H]1COc2ccccc2O1	731595633	XITWFNJUUUARSO-AWEZNQCLSA-N	448.478	1.837	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCCCCC2)cc1	731851664	LZBVIFYJJHPNOS-UHFFFAOYSA-N	433.534	1.677	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2ccc(C(N)=O)cc2)cc1Br	732048586	PKGAHRKOGJAFJO-UHFFFAOYSA-N	428.264	1.180	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NC[C@H]2CN(CC(C)C)CCO2)cc1Br	732255680	KAROWPSUKSUTNY-AWEZNQCLSA-N	443.342	1.759	50	20	IDGD	
COC(=O)c1cc(OC(=O)C2CCN(c3ccc4nnnn4n3)CC2)ccc1[N+](=O)[O-]	732651220	ADMHPYHYGOKEAM-UHFFFAOYSA-N	427.377	1.036	50	20	IDGD	
Cc1ccc(C(=O)N2CCC[C@H](C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)C2)cc1	734241348	NCOIDHTWYAKASJ-KRWDZBQOSA-N	447.536	1.702	50	20	IDGD	
CCCCOc1ccc(C(=O)NNS(=O)(=O)c2ccc3c(c2)C(=O)NCC3)cc1OC	734806825	LBDDKQBSLSMALE-UHFFFAOYSA-N	447.513	1.783	50	20	IDGD	
COCCOc1ccc(-n2nc(C)c(C(=O)NNC(=O)NCCc3cccs3)n2)cc1	735039520	YOSNKQOVYHQNGW-UHFFFAOYSA-N	444.517	1.849	50	20	IDGD	
COCCOc1ccc(-n2nc(C)c(C(=O)NNC(=O)c3ccc(C)cc3O)n2)cc1	735115305	XHZURIWNOCEXRN-UHFFFAOYSA-N	425.445	1.690	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2cc(O)nc3ccc([N+](=O)[O-])cc23)n1	735354687	XTMYSEMKASDQDF-UHFFFAOYSA-N	445.413	1.160	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)Cc2ccccc2OC(F)F)ccc1Cl	735647649	XNKUUFBXUUKCIB-UHFFFAOYSA-N	433.820	1.593	50	20	IDGD	
O=C(NNC(=O)N[C@@H]1CCS(=O)(=O)C1)Nc1ccc(Br)cc1Cl	742710493	GNGPVNPJLWVTFY-MRVPVSSYSA-N	425.692	1.625	50	20	IDGD	
Cc1ccc([C@H](CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)N(C)C)cc1	743334145	OULIDFGSQQXPCC-IBGZPJMESA-N	447.561	1.492	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NCc2ccc(-n3cccn3)cc2)cc1	743552407	ZPOBPMSZPVSWCR-UHFFFAOYSA-N	428.474	1.812	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)N[C@@H]1CCCN(c2ccccc2Cl)C1=O	743577139	MOWBOEHBQNONDO-CYBMUJFWSA-N	433.852	1.189	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)[C@H]2CCCN(C(=O)Cc3ccccc3)C2)c1	744701118	OHKDYFDSBGNODK-FQEVSTJZSA-N	448.479	1.344	50	20	IDGD	
CCCS(=O)(=O)Nc1ccc(C(=O)OCC(=O)NNC(=O)c2cccc(C)c2)cc1	744943223	IKGKCFVQPYRDPV-UHFFFAOYSA-N	433.486	1.765	50	20	IDGD	
O=C(CNC(=O)[C@H]1c2ccccc2C(=O)N1Cc1ccccc1)NNC(=O)c1ccncc1	745835300	BSEPXHOZGCGOSV-OAQYLSRUSA-N	443.463	1.356	50	20	IDGD	
Cc1ccc(N2CCC[C@H](NC(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)C2=O)cc1	745884164	HDULTUHBBROURI-SFHVURJKSA-N	448.483	1.382	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H](C)c2c(C)nn(C)c2C)c1	746820100	QLUDNHXYGDLOQG-CYBMUJFWSA-N	435.550	1.632	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)[C@H]2CCCN2C(=O)CC(C)(C)C)c2ccccc2c1=O	748165989	FSSYLHSFCKQHHQ-QGZVFWFLSA-N	441.532	1.995	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)c1csc(S(N)(=O)=O)c1	748593795	LYWXJOZFYFTGBZ-UHFFFAOYSA-N	432.549	1.229	50	20	IDGD	
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC[C@@H](C(=O)NNC(=O)c2cc3ccccc3o2)C1	749468298	UMNBRGMFCMZFQH-OAHLLOKOSA-N	445.501	1.635	50	20	IDGD	
COc1ccc([C@@H](C)CC(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)cc1	750243075	WQZALIXZYMKFBT-INIZCTEOSA-N	447.561	1.663	50	20	IDGD	
Cc1ccc(C)c(-n2c(C)nnc2SCC(=O)NNC(=O)CNC(=O)c2ccco2)c1	751207504	YILJDXANTTWVLQ-UHFFFAOYSA-N	442.501	1.455	50	20	IDGD	
COc1cc(OC)cc(-n2nnnc2CN(C)C(=O)NNC(=O)c2cccc(C#N)c2)c1	752006909	NIMHPVSONBZMEI-UHFFFAOYSA-N	436.432	1.038	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)c2ccc(C)c(S(=O)(=O)NC3CCCC3)c2)n1	752504066	WONPNLXHWUUGDS-UHFFFAOYSA-N	433.534	1.490	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2ccnc(O[C@@H]3CCOC3)c2)c2ccccc2c1=O	754011082	AYCRDCCMCRVLOJ-OAHLLOKOSA-N	437.456	1.444	50	20	IDGD	
COC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(NC(=O)NNC(=O)c3ccc[nH]3)cc2)C1	755557610	KESRMNGICVTWHM-ZDUSSCGKSA-N	449.489	1.055	50	20	IDGD	
CCNC(=O)COc1cccc(NC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])c1	755656943	QPSANEFMGKXRRT-UHFFFAOYSA-N	431.405	1.341	50	20	IDGD	
O=C(CSc1ccc(Cl)cc1)NNC(=O)NCCN1C(=O)[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O	756092101	CVDIFEAGXBWNQD-MWDDYTRKSA-N	448.932	1.570	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1cccc(COCCc2ccccc2)c1	756227834	GKGXJQNEDUJFCM-HNNXBMFYSA-N	434.518	1.536	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Nc2ccc(C)c(S(N)(=O)=O)c2)cc(OC)c1OC	756638359	OQDJABVYDGPLRB-UHFFFAOYSA-N	438.462	1.135	50	20	IDGD	
CCOC(=O)[C@@H](C)NC(=O)c1ccc(NC(=O)NNC(=O)Cc2ccncc2)cc1F	756819159	QVQOGIZFNOVCFL-GFCCVEGCSA-N	431.424	1.298	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)Nc2ccccc2OCC(=O)N2CCOCC2)c(O)c1	756876286	ZZOFXAJORAXADF-UHFFFAOYSA-N	428.445	1.405	50	20	IDGD	
NC(=O)c1ccc(NNC(=O)Cn2cnc3scc(-c4cccs4)c3c2=O)nn1	757402826	PXKLNIPOJJNLKA-UHFFFAOYSA-N	427.471	1.219	50	20	IDGD	
O=C(NC[C@@H](O)c1cc2ccccc2s1)NNC(=O)C1CCN(c2ncccn2)CC1	757739115	XJFFIHYHFDPDIM-MRXNPFEDSA-N	440.529	1.972	50	20	IDGD	
Cc1oc(-c2ccc(Cl)c(Cl)c2)nc1C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O	758050289	ANJOKDMBQYJNOK-SSDOTTSWSA-N	435.289	1.656	50	20	IDGD	
N#Cc1cc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)ccc1Cl	758359437	AKMGUOQMOHBLMM-UHFFFAOYSA-N	425.876	1.431	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NC[C@@H]2CC(=O)N(Cc3ccccc3)C2)cc1	759684629	VNQFATKCRQADSH-KRWDZBQOSA-N	426.473	1.453	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1cnc([C@@H]2CCCO2)s1	760407323	ZQCKUVVRBVLIOO-INIZCTEOSA-N	443.529	1.214	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)c1cc(I)ccc1F	762169386	VKHNTMROXAUDSC-UHFFFAOYSA-N	431.161	1.214	50	20	IDGD	
CCc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(S(=O)(=O)N(CC)CC)c2)cc1	763509311	RFJTZZRIRASCMP-UHFFFAOYSA-N	446.529	1.679	50	20	IDGD	
Cc1ccc(C)c(-n2ncc(NC(=O)C(=O)NNC(=O)[C@@H]3COc4ccccc4O3)c2C)c1	763572586	SJRPLDVAVOUCJG-FQEVSTJZSA-N	449.467	1.723	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccccc2SCCC(N)=O)cc1C	763666274	DVTOTAGOWNYUPF-UHFFFAOYSA-N	444.513	1.436	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2ccc(S(C)(=O)=O)cc2C)c1	763666425	ZYONOQXAZZTUJQ-UHFFFAOYSA-N	433.486	1.180	50	20	IDGD	
O=C(COc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1ccccc1CN1CCNC1=O	763695805	YAGCCBVPVPDEKL-UHFFFAOYSA-N	445.863	1.030	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCC3)cc1C(=O)OC	763784654	FXOJHWXFLVVKLX-UHFFFAOYSA-N	445.453	1.210	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)C(=O)Nc2ccc(F)cc2F)c2ccccc2c1=O	763791454	SBSVQUHFSZKYEH-UHFFFAOYSA-N	429.383	1.655	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)C(=O)Nc2ccc(F)nc2)c2ccccc2c1=O	763801575	YVUBMSFVVMPKNT-UHFFFAOYSA-N	426.408	1.130	50	20	IDGD	
CN(C)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])cc1Cl	763805006	QMHGSSAHRQHZED-UHFFFAOYSA-N	435.824	1.479	50	20	IDGD	
Cc1cc(Br)ccc1NC(=O)C(=O)NNC(=O)COc1ccccc1C#N	763806870	GKQUNFFQYOJKOS-UHFFFAOYSA-N	431.246	1.794	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cc(F)ccc2OC[C@H]2CCCO2)cc1	763812116	PUNXITXQPSZOTD-QGZVFWFLSA-N	445.447	1.857	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2c3c(nn2-c2ccccc2)CCC3)cc1	763819699	AOCMCAJABKGDGL-UHFFFAOYSA-N	433.468	1.834	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)COc3ccc(F)cc3)cc2)CCO1	763838194	PTCWDBRJHTYSSB-AWEZNQCLSA-N	430.436	1.216	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)C(=O)Nc1ccc(CC(N)=O)cc1	763851857	FWPHIAKFDFLKJD-CQSZACIVSA-N	434.452	1.421	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)C(=O)Nc1nc2c(s1)COCC2	763852409	INQCSRXTWFOSLP-GFCCVEGCSA-N	440.481	1.922	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1cccc(CN2CCOC2=O)c1	763852515	YFTCHMDNWKJVHQ-CYBMUJFWSA-N	444.419	1.331	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)c(C)c1	763866601	WSKVVNFSLBREAB-AWEZNQCLSA-N	433.436	1.713	50	20	IDGD	
Cc1nc(C)n(-c2ccccc2NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)n1	763867987	ZOEGWWNJOTWNKX-GFCCVEGCSA-N	440.435	1.577	50	20	IDGD	
CN(C)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)C2=S=C3CCCCCCC3=C2)cc1	763912696	ZXUULTISNAIXFG-UHFFFAOYSA-N	442.541	1.847	50	20	IDGD	
Cc1cn(-c2ccc(C#N)cn2)nc1NC(=O)C(=O)NNC(=O)Cc1ccc(Cl)cc1	763940623	LDXJFISLOKTJAH-UHFFFAOYSA-N	437.847	1.429	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CC[C@@H](C)C3)cc1	763940910	VFBBTUUYPPIWDT-GFCCVEGCSA-N	445.497	1.824	50	20	IDGD	
C[C@@H]1COCCN1c1ccc(NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)cc1	763979563	YENQYFFXYGLQMF-GFCCVEGCSA-N	432.864	1.670	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)C(=O)N1C[C@@H]2CCCN2c2ccccc21	763994203	BGOSNOMNJVSUTR-LBPRGKRZSA-N	432.278	1.554	50	20	IDGD	
O=C(NNC(=O)c1cccc(C(F)(F)F)c1)C(=O)Nc1cccc(Cn2cncn2)c1	764037622	QIHBIQLTOQCIJG-UHFFFAOYSA-N	432.362	1.745	50	20	IDGD	
O=C(NNC(=O)c1cccc(C(F)(F)F)c1)C(=O)Nc1ccc(Cn2cncn2)cc1	764040495	KKQPXIDTXZKRKB-UHFFFAOYSA-N	432.362	1.745	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(S(=O)(=O)C3CCCC3)cc2)c(O)c1	764105216	MVGWFXYAACKNCR-UHFFFAOYSA-N	445.497	1.817	50	20	IDGD	
Cc1cc(Br)c(NC(=O)C(=O)NNC(=O)CCc2ccco2)cc1[N+](=O)[O-]	764177814	RXTXARNCZPRBGP-UHFFFAOYSA-N	439.222	1.977	50	20	IDGD	
Cc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NNC(=O)c1cccc(OC(F)F)c1	764250792	NHQGKLVRIQGDBQ-UHFFFAOYSA-N	434.399	1.698	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CCCc2cccs2)c(OCC(=O)N(C)C)c1	764339338	KIXYJXCCYOQPGB-UHFFFAOYSA-N	446.529	1.632	50	20	IDGD	
O=C(CCC(=O)N1CCN(c2ccccc2)CC1)NNC(=O)Cc1c[nH]c2ccccc12	764557767	AFASCMIROYWBBD-UHFFFAOYSA-N	433.512	1.987	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)CCC(C)C)cc(Br)c1F	764663496	PEAPVGZFWNDNJO-UHFFFAOYSA-N	432.246	1.897	50	20	IDGD	
CC(C)N1C(=O)c2ccc(C(=O)NNC(=O)CSc3ccccc3O)cc2S1(=O)=O	765250460	SUZGQFAJKWWEGI-UHFFFAOYSA-N	449.510	1.498	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)[C@@H](c1cccc(F)c1)N1CCOCC1	765311356	VVXWKNIKZYYVKE-GOSISDBHSA-N	438.500	1.651	50	20	IDGD	
COc1ccccc1N1C[C@@H](C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)CC1=O	765564614	GQXWVZGYDZNCGV-LBPRGKRZSA-N	425.470	1.961	50	20	IDGD	
Cc1cc(C)n(CCC(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)n1	765752998	UEOSNJAYIRWLSG-UHFFFAOYSA-N	432.956	1.509	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N2CCN(S(=O)(=O)CBr)CC2)cc1C	767849441	FCGPQSDPUNPASJ-UHFFFAOYSA-N	441.369	1.382	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccccc2O)n(-c2ccc(C(F)(F)F)cn2)n1	768234558	UOVJFNLPEQPXPN-UHFFFAOYSA-N	448.361	1.700	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)c2ncccc12	768236948	HFJPRFHBPXWPST-UHFFFAOYSA-N	426.404	1.938	50	20	IDGD	
COc1ccc(CN2C[C@H](C(=O)NNc3c(OC)cccc3S(C)(=O)=O)CC2=O)cc1	768639604	RRLCIUQWSSCIDU-OAHLLOKOSA-N	447.513	1.599	50	20	IDGD	
CC1CCN(C(=O)C(=O)NNC(=O)c2nc(-c3ccccc3)n(-c3ccccc3)n2)CC1	769674797	FBAPQZVCMXUPSW-UHFFFAOYSA-N	432.484	1.954	50	20	IDGD	
CC(C)(C)[C@H](NS(C)(=O)=O)C(=O)NNC(=O)COc1ccccc1-c1ccccc1	770447026	JBTZQVHCQKWAAR-LJQANCHMSA-N	433.530	1.844	50	20	IDGD	
C[C@H](NS(=O)(=O)c1cccc(C(F)(F)F)c1)C(=O)NNC(=O)c1ccc(C#N)cc1	770947741	JTYYLMDJNQUIIS-NSHDSACASA-N	440.403	1.705	50	20	IDGD	
COc1ccccc1C(=O)NCC(=O)NNc1ccccc1S(=O)(=O)NC(C)(C)C	771431600	JZPMVKJVWBCQOR-UHFFFAOYSA-N	434.518	1.645	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)Cc1csc(-c2cccnc2)n1	771806798	DDPFXQRGXWTXLE-UHFFFAOYSA-N	444.542	1.810	50	20	IDGD	
CNC(=O)COc1cccc(CC(=O)NNc2ccccc2S(=O)(=O)NC(C)(C)C)c1	772453496	FBZZUNGICKAPHB-UHFFFAOYSA-N	448.545	1.574	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NNC(=O)CCCNC(=O)c2ccccc2)C1	773419151	MDGWRQJOZNDMGG-QGZVFWFLSA-N	432.521	1.991	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)[C@H]3C[C@]3(C)C(C)C)CC2)cc1	773857797	NZDKREKQXUSLQI-WIYYLYMNSA-N	436.578	1.131	50	20	IDGD	
CS(=O)(=O)Cc1ccc(Cl)cc1S(=O)(=O)NNC(=O)c1ccc2c(c1)OCO2	774611863	SIZVTXMWXPIQTM-UHFFFAOYSA-N	446.890	1.237	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN[C@@H](CN2CCCC2=O)c2ccccc2)cc1OC	774915630	VHQOJPMWSMHHFC-SFHVURJKSA-N	440.500	1.418	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2ccc3c(c2)OCCO3)nc1	776061004	BWXJMUJGJKHXPT-UHFFFAOYSA-N	449.489	1.396	50	20	IDGD	
C[C@H](CC(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1)NC(=O)c1ccccc1	776210664	BYHWSJZTGYVCEY-MRXNPFEDSA-N	447.536	1.831	50	20	IDGD	
CN(C)N(C(=O)[C@@]1(F)CCN(C(=O)OCc2ccccc2)C1)[C@@H]1CCS(=O)(=O)C1	776750272	OWFJOSZAQIUPSP-VQIMIIECSA-N	427.498	1.230	50	20	IDGD	
Cc1cc2ccccc2nc1NNC(=O)Cn1cnc2c(c(Br)nn2C)c1=O	777481620	DLGQNMKPNNWHFB-UHFFFAOYSA-N	442.277	1.892	50	20	IDGD	
CC(C)(C)n1nc(C(=O)N2CCN(S(=O)(=O)CBr)CC2)cc1C1CC1	777779628	OVNCRSDKVXWLBR-UHFFFAOYSA-N	433.372	1.956	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cc(OCC(F)F)ccn2)cc1	777959014	WMUSDWORZDIROE-UHFFFAOYSA-N	442.444	1.116	50	20	IDGD	
CN(C)[C@@H](C(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)c1cccc(Cl)c1	780102461	HGYNMJBKYYTFSC-QGZVFWFLSA-N	434.836	1.855	50	20	IDGD	
COc1cccc(NNC(=O)CCc2nc3cc(S(=O)(=O)N(C)C)ccc3n2C)n1	780768287	KVZNDBABKFXLCG-UHFFFAOYSA-N	432.506	1.303	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)c2c(N)ccc(Br)c2F)c1	781228045	WUHITHRWRQXCPI-UHFFFAOYSA-N	435.209	1.660	50	20	IDGD	
C[C@]1(C(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)CCCOC1	781237721	JUQFNUUHMAWHSC-NRFANRHFSA-N	431.514	1.743	50	20	IDGD	
CNC(=O)[C@H]1CN(C(=O)C(=O)Nc2ccccc2S[C@@H](Cl)C(F)(F)F)CCO1	782005839	YADYUTQKEKNZPE-MEBBXXQBSA-N	439.843	1.818	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNc2ccc(F)cc2F)ccc1S(=O)(=O)N(C)C	783342820	MTCZCVKICQVXTI-UHFFFAOYSA-N	428.417	1.306	50	20	IDGD	
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)NNC(=O)c1ccc(OC)c(OC)c1	783803794	GFYVCLFZTMFTNK-UHFFFAOYSA-N	439.402	1.022	50	20	IDGD	
COCc1cccc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)NC(C)(C)C)c1	784832910	GNGLVKOTDLFFRK-UHFFFAOYSA-N	434.518	1.992	50	20	IDGD	
COc1cccc(NNC(=O)C(=O)N2C[C@H](C(=O)N3CCCCC3)Oc3ccccc32)n1	784843304	LNBIUFFAQGLBCU-QGZVFWFLSA-N	439.472	1.340	50	20	IDGD	
COc1ccc(I)c(NC(=O)C(=O)NNc2ncc(F)cn2)c1	784950519	SQBBOAHLFPSGQI-UHFFFAOYSA-N	431.165	1.311	50	20	IDGD	
COC(=O)C(C)(C)c1ccc(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)cc1	785061365	WUFFLHCVSWRIRC-UHFFFAOYSA-N	437.456	1.114	50	20	IDGD	
CCc1ccc(NC(=O)C(=O)NNc2ccc(OC)c(Cl)c2)cc1S(N)(=O)=O	785120079	FWSZKLVCFLMHHH-UHFFFAOYSA-N	426.882	1.640	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccccn2)c(OCc2ccccc2)c1	785992256	YCJQTSJROXDGPE-UHFFFAOYSA-N	434.452	1.998	50	20	IDGD	
Cc1c(NC(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)cccc1N1CCNC1=O	786300170	SKWPBCXLSITONL-UHFFFAOYSA-N	434.497	1.982	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N2CCN(C(=O)COC(=O)/C(C#N)=C/C3CC3)CC2)cc1	786679789	RFMQEDHYTACYRC-GHRIWEEISA-N	447.513	1.321	50	20	IDGD	
O=C(CN1C(=O)Cn2c(cc3ccccc32)C1=O)NNC(=O)NCc1ccc(Cl)cc1	787424029	GOICOMGQDNMNET-UHFFFAOYSA-N	439.859	1.808	50	20	IDGD	
Cc1nc2cc(C(=O)NNC(=O)c3ccc(S(=O)(=O)N4CCCC4)cc3)ccc2o1	792015830	GMZVFZWEDXBCOM-UHFFFAOYSA-N	428.470	1.996	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)C(=O)Nc1cccc(N2C(=O)CCCC2=O)c1	792355060	ODTOXAJUCQDJRQ-UHFFFAOYSA-N	442.403	1.034	50	20	IDGD	
CC(C)c1c(NC(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)cnn1-c1ccc(Cl)cc1	792494704	FVVOUFFHHHLBEU-LLVKDONJSA-N	442.929	1.740	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cc(Br)cc([N+](=O)[O-])c2)c(C)o1	793023092	HJSNVRJDMJOYME-UHFFFAOYSA-N	425.195	1.967	50	20	IDGD	
COC[C@@H](CO)NC(=O)/C(C#N)=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	794144329	DUTZUEUJQUNEBE-LEHPZIBWSA-N	431.880	1.109	50	20	IDGD	
COC(=O)Cn1ncc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCCCCC3)c1C	797001218	ZMHIUUDRESLTRV-UHFFFAOYSA-N	447.517	1.485	50	20	IDGD	
NS(=O)(=O)c1ccc(F)c(C(=O)NNc2ccc([N+](=O)[O-])cc2Br)c1	798340486	LCZRPNNFQRATHX-UHFFFAOYSA-N	433.215	1.901	50	20	IDGD	
CCC(CC)[C@H](C(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)N1CCOCC1	802063904	SLCXWFZQWYXALG-QGZVFWFLSA-N	426.539	1.380	50	20	IDGD	
CC1CCC(N2C[C@H](C(=O)NNC(=O)Nc3ccc(S(C)(=O)=O)cc3)CC2=O)CC1	802067978	UDTYBISMCSNPKS-NPCAHTBFSA-N	436.534	1.670	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1cc(-c2ccc(OC)nc2)ccc1C	802567283	MERHVFMPMXLCAH-CQSZACIVSA-N	430.461	1.203	50	20	IDGD	
CN(CCc1nc(-c2ccccc2)no1)C(=O)NNC(=O)CNC(=O)c1cccs1	805044074	FIZKDSJKJCFWRP-UHFFFAOYSA-N	428.474	1.443	50	20	IDGD	
O=C1COc2c(cc(Cl)cc2NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)N1	806757071	QZFZEOSNCHWNSB-UHFFFAOYSA-N	428.796	1.113	50	20	IDGD	
C#CC[C@]1(C(=O)NNC(=O)CCNC(=O)OC(C)(C)C)CCCN1C(=O)OC(C)(C)C	809755201	HZWQEGYEXYAPFK-OAQYLSRUSA-N	438.525	1.842	50	20	IDGD	
Cc1cc(=O)cc(C)n1CCCC(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12	809933185	VDVADTZEFHPTJQ-UHFFFAOYSA-N	437.500	1.997	50	20	IDGD	
Cc1nc2ccc(NC(=O)C(=O)NNC(=O)COc3cccc(C(F)(F)F)c3)cn2n1	810385447	SKJBZLBLBGUUJK-UHFFFAOYSA-N	436.350	1.221	50	20	IDGD	
CCOc1cc(Br)c(F)cc1NC(=O)C(=O)NNC(=O)c1cccnc1	810385628	VYLCIUQNGDBJMT-UHFFFAOYSA-N	425.214	1.782	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)N[C@H]2CCN(c3ccccc3F)C2)nc1	813854369	ZZVSMKACXZXLRY-AWEZNQCLSA-N	436.513	1.812	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N1CC[C@@]2(CCN(C)C2)C1	814270597	AFONOCQLZWUSEF-FZKQIMNGSA-N	425.327	1.985	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NN=C1CN(C(=O)OC(C)(C)C)CC[C@H]1c1ccccc1	814835654	XMQMDWUADSYBJR-ZBFHGGJFSA-N	438.550	1.821	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)cc1)[C@@H]1C[C@@H]1C	815565599	USCPBCBTOJXGGW-VBKZILBWSA-N	449.467	1.484	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)cc1)C1CC1	815566502	WLSXPXCUKGTSGT-UHFFFAOYSA-N	428.420	1.506	50	20	IDGD	
CNC(=O)Oc1cccc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)c1	815628855	MHLBXYZDTLQOAJ-IRXDYDNUSA-N	426.429	1.063	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCc2nncn2C1)C(=O)Nc1cc(Cl)ccc1C(F)(F)F	815692599	VPFRYYSEWRSOBU-MRVPVSSYSA-N	430.774	1.299	50	20	IDGD	
COC(=O)C12CCC(C(=O)N3CCN(S(=O)(=O)CBr)CC3)(CC1)CC2	815964534	LEFRQKHEVQSGBD-UHFFFAOYSA-N	437.356	1.326	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NNC(=O)c2ccc(NS(C)(=O)=O)cc2)C1	816510026	KPLCANZTJZGZNV-CQSZACIVSA-N	440.522	1.466	50	20	IDGD	
COc1ccnc(NNC(=O)[C@@H]2CCCCN2S(=O)(=O)c2ccc([N+](=O)[O-])cc2)n1	914763501	SASSOWOZWAEZHR-AWEZNQCLSA-N	436.450	1.080	50	20	IDGD	
CS(=O)(=O)Nc1ccc(F)cc1C(=O)OCC(=O)NNC(=O)c1ccc(Cl)cc1	915009503	CZCOCXBKKOYTFX-UHFFFAOYSA-N	443.840	1.469	50	20	IDGD	
O=C(NNC(=O)[C@H]1CC(c2ccccc2)=NO1)c1cccc(S(=O)(=O)N2CCCC2)c1	915128411	ADNTWSXPRWUEML-LJQANCHMSA-N	442.497	1.425	50	20	IDGD	
O=C(CS(=O)(=O)CCCc1ccccc1)NNC(=O)c1nn(-c2ccccc2)cc1O	915293654	WBPIVFSMXXRIJK-UHFFFAOYSA-N	442.497	1.387	50	20	IDGD	
CCS(=O)(=O)N(C)CCCNC(=O)/C(C#N)=C\c1cc(C)n(C[C@H]2CCCO2)c1C	915729565	OXKYAEPCNDWRBZ-QRRJMBGHSA-N	436.578	1.979	50	20	IDGD	
COc1ccc2c(=O)c(C(=O)NNC(=O)c3cc(OC)c(OC)c(OC)c3)c[nH]c2c1	916099457	NMMHKRLMOILHCK-UHFFFAOYSA-N	427.413	1.637	50	20	IDGD	
O=C(CCCOc1ccc(Cl)cc1Cl)NNC(=O)NCCC(=O)N1CCOCC1	916252651	DKHCAOYSYKPVSM-UHFFFAOYSA-N	447.319	1.732	50	20	IDGD	
CCCS(=O)(=O)N1CCC(NC(=O)NNC(=O)CSc2ccc(C)cc2)CC1	916383525	KSZGBSVDUPMCEI-UHFFFAOYSA-N	428.580	1.622	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc2c3c(cccc13)C(=O)N2)c1ccc(-n2cnnn2)cc1	917727292	CMFUQNGCMZPHLS-UHFFFAOYSA-N	435.425	1.005	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN(c2nc3ccccc3s2)C1)c1ccc(-n2cnnn2)cc1	917926216	RTBXMMAZBJYEMO-OAHLLOKOSA-N	448.512	1.950	50	20	IDGD	
CCn1c(NNC(=O)[C@H](Cc2cccc(F)c2)n2nnnc2C)nc2ccccc2c1=O	918016179	FQXWUZZTMCFUMQ-SFHVURJKSA-N	436.451	1.778	50	20	IDGD	
CC[C@@H](NC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)c1ccccc1OCC(=O)NC	918220888	CVGGYJYNJOTYRT-MRXNPFEDSA-N	429.433	1.815	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)c1csc(N2CCOCC2)n1)COCc1ccccc1	919799490	PCXPEXPFNMJXSU-HNNXBMFYSA-N	433.534	1.777	50	20	IDGD	
Cc1cccc(N2CCN(S(=O)(=O)CC(=O)NNc3ccccc3[N+](=O)[O-])CC2)c1	919810838	LQQANNWEGJSYCY-UHFFFAOYSA-N	433.490	1.498	50	20	IDGD	
COc1cc(C=NNC(=O)N[C@H]2CCS(=O)(=O)C2)ccc1OC(=O)c1ccncc1	920381962	UTGCWFAFYVVTCN-HNNXBMFYSA-N	432.458	1.130	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)c1cccc(N2CCOC2=O)c1	920982400	KCBFELKOBKAAHZ-ZDUSSCGKSA-N	436.432	1.324	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2nc(Cc3ccccc3)no2)c1	921118986	CCLYLMULMSPWQU-UHFFFAOYSA-N	429.458	1.208	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NC[C@@H](c2cccc(F)c2)N2CCOCC2)cc1OC	921199367	IQVRDQIBPCFLEA-SFHVURJKSA-N	446.479	1.860	50	20	IDGD	
CN1C(=C(C#N)C(=O)COC(=O)CN2C(=O)N[C@](C)(C3CC3)C2=O)N(C)c2ccccc21	924226544	ZOYASPIEBBMPKH-JOCHJYFZSA-N	437.456	1.141	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)[C@H]1CC(=O)N(c2ccc(C#N)cc2)C1	1255008681	SBSVFXGKQREDAQ-AWEZNQCLSA-N	428.470	1.467	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)CBr)C2	1778099824	PKNYEYVGALCJLC-NPNMTCQASA-N	446.386	1.398	50	20	IDGD	
C[C@H]1Oc2ccc(C(=O)N3CC[C@@]4(C3)CN(C(=O)C(Cl)Cl)CCO4)cc2NC1=O	1780181614	XQMICXVHDGGBEL-NSPYISDASA-N	442.299	1.653	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H]3CCN3C(=O)OC(C)(C)C)C2)C1	1781016832	IHEBZVPARNZKHI-STXHMFSFSA-N	429.945	1.843	50	20	IDGD	
C[C@H](C(=O)N1CC[C@]2(CN(C(=O)C(Cl)Cl)CCO2)C1)N(C)C(=O)OC(C)(C)C	1781041979	YYKCZBYIQUFCDT-KZULUSFZSA-N	438.352	1.875	50	20	IDGD	
O=C(c1ccc2n[nH]cc2c1)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781331065	KIMLFWCIPUVZBZ-YOEHRIQHSA-N	425.258	1.697	50	20	IDGD	
CC(=O)N[C@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)CBr)C2	1781781908	OOIJVLRXICUZNL-YRWGSWDYSA-N	432.359	1.056	50	20	IDGD	
COC(=O)C1(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@](C)(Cl)CCl)C3)CC1	1781811994	GFLOFMBLHXZGND-JEBQAFNWSA-N	435.348	1.690	50	20	IDGD	
C[C@@H](O)C(=O)N1CCO[C@]2(CCN(C(=O)/C(C#N)=C/c3ccc(Br)cc3)C2)C1	1782870554	SZWZYUKYUHRYIJ-RWJTWEKPSA-N	448.317	1.567	50	20	IDGD	
C/C(=C/C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)CBr)C2)C(=O)O	1783154313	FDEMVBQEPUOATO-GDSDZVDBSA-N	431.327	1.562	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)c1ccccc1)CCO2	1783343935	XAOARCIYVPGEQF-TXPKVOOTSA-N	425.323	1.723	50	20	IDGD	
CCCNC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)[C@H](Br)CC)C2)C1	1783344285	SERAFESSQABEQP-RDTXWAMCSA-N	432.359	1.296	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)Cc3c(C)nn(C)c3C)CCO2)C1	1783354514	SACWCQBZUCUNKH-APWZRJJASA-N	441.370	1.583	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H]1COc3ccccc3O1)CCO2	1783530294	WLGKEXBEQVRPHD-URKNILKWSA-N	439.306	1.440	50	20	IDGD	
COC(=O)[C@@H]1CC[C@H](C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)C(C)(C)CCl)C[C@@H]32)C1	1784075614	JFJDCPVLOAPOQG-QEOTZNIISA-N	428.957	1.820	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/c3cc(F)c(F)c(F)c3)C[C@@H]21)[C@H](O)CCl	1784094125	LHAGPTLHMQPNTH-VKOIJASASA-N	446.853	1.697	50	20	IDGD	
CCOC(CC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2)OCC	1784167282	SJNQWQNCFNSGDB-ZWKOTPCHSA-N	425.353	1.842	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3ccccc3OC)[C@H]2C1	1784265732	GCSZUUGWFXLAPO-JPLJXNOCSA-N	438.952	1.861	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)C(=O)c3cccn3C)C2)C1	1784606717	LIPKHMKTSVOBBO-SCLBCKFNSA-N	426.311	1.069	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC1(c2ccc(NC(=O)c3ccc[n+]([O-])c3)cc2)CCC1	1786999766	FHKSIGXMCFIMHO-UHFFFAOYSA-N	446.467	1.380	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc[nH]c4nccc3-4)[C@H]2C1	1787325233	DUMOYJMALHRDKP-WBAXXEDZSA-N	430.581	1.959	50	20	IDGD	
COc1ccc([N+](=O)[O-])c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Cl)C[C@@H]32)n1	1787750869	URTAKRMIYLPPRG-PCVQNBPASA-N	430.820	1.126	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4cncn4c3)[C@H]2C1	1788424600	FFEOVMRAQOHZCZ-KCMWZYNZSA-N	449.349	1.959	50	20	IDGD	
CCOc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]3C2)nn1	1788763750	ZIHVQEYAFQYITO-ZOBUZTSGSA-N	436.585	1.320	50	20	IDGD	
Cc1ccc(OC(C)(C)C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](O)CCl)C[C@@H]32)nc1	1789722913	UULIKRCSPLOOLO-QAETUUGQSA-N	439.940	1.127	50	20	IDGD	
COC(=O)[C@@H]1CC[C@H](C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]3C2)C1	1789867588	GFUCWRLRAGYMAD-ZGCMRJCUSA-N	449.375	1.792	50	20	IDGD	
Cc1nnc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]3C2)s1	1789923113	YOPSWFXENCTIDU-RMIALFOJSA-N	435.319	1.059	50	20	IDGD	
C[C@H](Cc1ccncc1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21	1790579547	ZRPGNTSJWNSSMY-YYESSZKYSA-N	442.329	1.930	50	20	IDGD	
C[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21)[S@](=O)c1ccccc1	1790601275	XOGAUMAVJZATDX-NPFDEDBGSA-N	447.384	1.966	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](Br)CC)C[C@@H]21	1790609788	ILKIZGOSGXUIOO-FQKPHLNHSA-N	449.342	1.701	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)Oc3ccccn3)C[C@@H]21	1791256588	QYMBUUOZAJFHDE-VIQHNZTISA-N	425.913	1.082	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3CC[C@H](O)CC3)[C@H]2C1	1791406022	PZSWYQXHNKGDHX-JNNCMOEMSA-N	431.371	1.691	50	20	IDGD	
CC[S@](=O)CCC(=O)NC1(c2ccc(NC(=O)CCC(=O)NN(C)C)cc2)CCC1	1791601071	KFWKAZWYQBFOQV-PMERELPUSA-N	436.578	1.652	50	20	IDGD	
Cc1nn(C)c(C)c1CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]21	1791636204	GGAWBDJYDKYWQV-VERUCKTNSA-N	445.391	1.795	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCOc1ccc(F)cc1)c1ccc(B(O)O)cc1	1792813318	FUWOJKCZYQVMIB-ACDBMABISA-N	440.280	1.226	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnc(OC)c(C)c1	1794984957	AHAVIXMAVAFGLU-QKPAOTATSA-N	440.338	1.775	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1n[nH]c(C3CC3)c1F)C2	1795112790	UNFQDBBFYAIMDA-GNXNZQSNSA-N	429.290	1.414	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](N)c1cccc(Cl)c1	1795625167	IPLDFMKLXGMRIG-QXGSTGNESA-N	440.016	1.781	50	20	IDGD	
N#Cc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Cl)C3)c(C(F)(F)F)n1	1795994320	ANDAVJUVJKTIQM-XSPYEYLBSA-N	434.777	1.710	50	20	IDGD	
Cc1ccc(NCCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)c(C)c1	1796191539	VHFGXTYKTCCFSP-KOUNCHBCSA-N	449.360	1.737	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1n[nH]c2c1CC[C@H]2C	1796968230	XHEYYJRBPYHFHO-QCPCCJPKSA-N	439.354	1.694	50	20	IDGD	
O=C(C[C@@H]1CNc2ccccc2O1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2	1797679707	ZHRMPKOMLWEGDN-IPJQOSJUSA-N	428.316	1.643	50	20	IDGD	
CCC[C@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnccc1C(=O)NN)n1cccc1	1798440296	KODFEECKEYUAGQ-AXVVYFOYSA-N	438.532	1.780	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnccc1C(=O)NN	1798442101	WTRPIIPYFZQOGK-DBYGNECLSA-N	428.320	1.173	50	20	IDGD	
O=C(/C=C/c1cccc(O)c1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2	1800591399	GZRQCUFMGQOUFG-HHJHSXPOSA-N	427.270	1.686	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C[C@@H](N)c1cccnc1)C2	1800638938	DLKJUOCDVGSSNV-ORDFZIBCSA-N	439.354	1.235	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COc1ccc(O)cc1)C2	1800754642	STVICXRGEKMTDE-KOFHJDLBSA-N	427.295	1.144	50	20	IDGD	
COc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C(Cl)Cl)c(O)c1OC	1801017367	RPEPLOSZOQMYOE-DDFAGTSDSA-N	433.288	1.416	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)COCc2ccccc2)[C@H]1c1cccnc1)[C@@H](O)CCl	1803139115	STFAXJKFVWYDLY-ZJOUEHCJSA-N	431.920	1.904	50	20	IDGD	
Cn1ncc(C(=O)N2CCC3(CCCN(C(=O)[C@@H](O)CCl)C3)CC2)c1C(F)(F)F	1805517824	IGFCMHMNRWZGQN-ZDUSSCGKSA-N	436.862	1.883	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)Cc2ccccc2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807363826	OVGQNFRQUKYSNN-XUZZJYLKSA-N	443.312	1.324	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)/C=C/c2ccco2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1	1807369443	JXMDWMZLFKUNPE-GPEVBYCZSA-N	445.284	1.387	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H]2C[C@@]2(F)Cl)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1	1807373301	AWCIFHTWZYCOAB-JWVYWZTKSA-N	445.687	1.006	50	20	IDGD	
Cc1c[nH]cc1C(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1808587630	DKLOIMFXTKSADM-UTKZUKDTSA-N	426.521	1.411	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)C(Cl)Cl)[C@@H]1c1cccnc1)c1nc2ncccn2n1	1809237092	LILGXDHNDWLYQZ-CHWSQXEVSA-N	434.287	1.643	50	20	IDGD	
CC(C)N[C@@H](C(=O)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1)C(C)C	1809976849	TUUCUPBNXHNLDW-OAQYLSRUSA-N	443.397	1.234	50	20	IDGD	
Cc1cc(C(=O)NCC(=O)NC[C@@H]2CCN(C(=O)[C@H](F)Cl)[C@@H]2c2cccnc2)no1	1810375539	IZFYCEREUVMKBO-XKQJLSEDSA-N	437.859	1.348	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@@H]1c1cccnc1)c1cc(O)no1	1810983496	FWWHGSDOOXXYNQ-ZLKJLUDKSA-N	427.230	1.785	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2ncccc2F)[C@@H]1c1cccnc1	1811118761	XKGDKDNSTKZPOB-IERDGZPVSA-N	442.495	1.308	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)c2cccn(C)c2=O)[C@H]1c1cccnc1	1812864417	HMAMQFYOGVLDIJ-QRTARXTBSA-N	447.333	1.883	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)c2cc(O)n(C)n2)[C@H]1c1cccnc1	1812864442	HYBFXZQEQANGKO-GHJWDPDVSA-N	436.310	1.624	50	20	IDGD	
CN[C@H](CC(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](C)CBr)[nH]n1)C(=O)O	1817361371	HBNBJSJRIYBRAQ-UHTWSYAYSA-N	444.330	1.496	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnoc2)[nH]n1	1818111917	PHQOUXGUNVZDTJ-SOAGAIGUSA-N	438.448	1.838	50	20	IDGD	
C[Si](C)(C)OCC(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H]2CCCS2(=O)=O)[nH]n1	1819596686	OOKBELUDUGKIRT-HUUCEWRRSA-N	442.614	1.831	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](O)N3CCOCC3)sc2C1	1819878001	YMJAOOQVLDEGFA-PEBVRCNWSA-N	430.958	1.113	50	20	IDGD	
Cc1nc(F)ccc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCC(=O)NN(C)C)CC2	1820956315	RVLPIEQCWZTRAS-GFCCVEGCSA-N	448.524	1.584	50	20	IDGD	
COc1ccnc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@@H](O)CCl)CC3)c1OC	1821792967	BPOABTFJRCSFEI-ONGXEEELSA-N	440.909	1.381	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CSCC(=O)O)CC2	1825647017	HRFIARWETHAOTA-SFYZADRCSA-N	436.353	1.656	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1n[nH]cc1[N+](=O)[O-])CC2	1826003388	KSQHGBFOVOULCX-YUMQZZPRSA-N	428.858	1.254	50	20	IDGD	
C=C[C@@H](O)C(C)(C)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827057604	KZYRPQQTRIWEKN-NHCUHLMSSA-N	442.365	1.173	50	20	IDGD	
CCS(=O)(=O)N[C@H](C)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H](F)Cl)CC1	1827608264	NWIWVRZNLNRBSC-BPLDGKMQSA-N	425.954	1.468	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ncccn2)CC1	1828925224	IOGVBENHTVBOID-SFHVURJKSA-N	437.504	1.022	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H]2CCCS2)CC1	1828926108	ZBLFCTGYVLBKGO-RTBURBONSA-N	445.589	1.814	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CN3CCC(C)CC3)CCO2)C1	1831097770	BQXBWSWIVVDPPB-RXVVDRJESA-N	429.989	1.582	50	20	IDGD	
CCOc1ncccc1C(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)CCl)CC2)CC1	1833306392	CTALWVVSZKOHMX-SFHVURJKSA-N	438.956	1.265	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cnccc3Cl)CC2)CC1)[C@@H](O)CCl	1833312382	MFYLRNYLEDLMEE-KRWDZBQOSA-N	429.348	1.520	50	20	IDGD	
CCc1ncccc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)Br)C2)C1	1833517815	HQSXSSSXADDLIH-LIRRHRJNSA-N	440.338	1.497	50	20	IDGD	
Cc1cccnc1CCC(=O)NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1833780745	XCNXQJZHSFIYBR-FQEVSTJZSA-N	436.984	1.494	50	20	IDGD	
O=C(/C=C/c1ccsc1)NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1833865997	GKUNBWORDHTMGC-KROLTMCQSA-N	425.982	1.933	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)c3ccncc3Cl)C2)C1	1834823060	GZMDTWCYUCMITM-QGZVFWFLSA-N	446.729	1.590	50	20	IDGD	
O=C(Cc1cccc(F)c1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1835025514	ZNHOVZQRHMAPQV-SJLPKXTDSA-N	447.276	1.515	50	20	IDGD	
COC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)[C@](C)(Cl)CCl)CC2)CC1	1836398494	LQEYAXWFXFRADB-LJQANCHMSA-N	436.380	1.748	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)C#CC3(O)CCCCC3)CCO2)C1	1837492013	ABFQUYZAYRJWMU-DYESRHJHSA-N	426.941	1.159	50	20	IDGD	
O=C(Cn1ccnc1)N1CCC(OC2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1837534495	YJRKBXRODGTLIG-MRXNPFEDSA-N	431.306	1.572	50	20	IDGD	
CCc1cc(C(=O)N2CCOC[C@@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)cc(C)n1	1837713100	HOUQILJEAQPQAS-JOCHJYFZSA-N	449.624	1.874	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)C3(C(F)(F)F)CC3)C2)C1	1837713260	RFXAJTHZIGFDFY-INIZCTEOSA-N	438.519	1.637	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)CCc3cncnc3)CC2)CC1	1837947356	FYNDTAXLWBLQDO-LJQANCHMSA-N	438.956	1.662	50	20	IDGD	
Cc1nn[nH]c1C(=O)N1CCC(OC2CCN(C(=O)[C@H](C)Br)CC2)CC1	1838002311	SNLYJZVKDWUXTR-NSHDSACASA-N	428.331	1.509	50	20	IDGD	
Cc1ncncc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1	1838094708	HWKPVGNCGZXHIF-ZWKOTPCHSA-N	431.320	1.091	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)c(C)n1	1838360577	VDIUEINZEKSEQU-NRFANRHFSA-N	435.597	1.620	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(C#N)cc3)CCO2)C1	1838952605	CTVUFOYZSLARGU-WOJBJXKFSA-N	440.327	1.865	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cccc(F)c3F)C2)C1	1839147990	JAUQWNDHGIRIGJ-QRWLVFNGSA-N	430.879	1.981	50	20	IDGD	
Cc1nc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)ccc1F	1839197634	CMZCHYQJMQBSIS-WMLDXEAASA-N	448.264	1.290	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(C)ccn3)C2)C1	1839964239	KUCBLPYEQJKEQS-HNAYVOBHSA-N	440.338	1.634	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)C3CCC(CO)CC3)C2)C1	1840030472	NDYGAQLBNQJMBZ-YHRBYZFPSA-N	447.370	1.025	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCCc3cccnc3)C2)C1	1840156181	JMZALXNPGKJBBD-GHTZIAJQSA-N	439.940	1.115	50	20	IDGD	
C[C@H](Sc1ccccn1)C(=O)N1CCOC[C@]2(CN(C(=O)C(Cl)Cl)CCO2)C1	1840190733	KHYFUOOWTUSWTM-SCLBCKFNSA-N	448.372	1.822	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3ccoc3)CCO2)C1	1840516884	QUFZMSMIAHTGMX-KBXCAEBGSA-N	429.311	1.452	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccccc3NC(C)=O)CCO2)C1	1840724943	SHOHLYCEDSKZIQ-DYESRHJHSA-N	437.924	1.732	50	20	IDGD	
O=C(c1cc(Br)cc2[nH]ncc12)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1	1841351001	DGTIMDVGYLYJAK-CQSZACIVSA-N	441.713	1.742	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CCCC12CN(C(=O)[C@H](O)CCl)C2)C1CC1	1841409921	WEPXXMUOUYNRBC-LSDHHAIUSA-N	429.945	1.483	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)CSc2ccc(F)cc2F)C1	1841563791	GAFMPZPDAUVKQU-UHFFFAOYSA-N	446.284	1.254	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)CCc2ccccc2Cl)C1	1842753695	XYGMVIYNGYVWKU-UHFFFAOYSA-N	426.709	1.470	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)C2(c3cccc(Cl)c3)CC2)C1	1843815918	RCZKVCJYBDIICJ-UHFFFAOYSA-N	438.720	1.569	50	20	IDGD	
CCc1noc(C)c1C(=O)N1CCCC12CN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2	1844500800	YQBGELJUOWTJFC-YDZHTSKRSA-N	426.477	1.496	50	20	IDGD	
N#Cc1cccc(C(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)c1Cl	1844735512	YITKUGNAJXBNKG-UHFFFAOYSA-N	438.875	1.341	50	20	IDGD	
COC(=O)N[C@@H](C(=O)N1CC2(CCCN2C(=O)[C@@H](F)Br)C1)c1ccccc1	1845215718	ADBSOPMBLAJGQM-ZIAGYGMSSA-N	442.285	1.978	50	20	IDGD	
O=C1CC[C@@H](C(=O)N2CC3(CCCN3C(=O)[C@@H](Br)Cc3ccccc3)C2)CN1	1845939925	IAFQTZYAWCNYMH-SJORKVTESA-N	448.361	1.722	50	20	IDGD	
COc1ccc2[nH]cc(C(=O)N3CC4(CCCN4C(=O)CCC(=O)NN(C)C)C3)c2c1	1846385105	SNZNJSZGFGLSLN-UHFFFAOYSA-N	427.505	1.367	50	20	IDGD	
COc1cc(C(=O)NCC(=O)NNC(=O)c2n[nH]c3c2CCCC3)ccc1OC(F)F	13294751	SVMBWIBTDJIUGT-UHFFFAOYSA-N	437.403	1.090	50	20	IDGD	
CN(CC(=O)NNC(=O)c1cccc2ncccc12)S(=O)(=O)c1ccc(Cl)cc1	14329378	VZHIQOIYJZARNW-UHFFFAOYSA-N	432.889	1.970	50	20	IDGD	
CCOC(=O)c1c(NC(=O)/C(C#N)=C/c2cn(C)c(=O)n(C)c2=O)sc2c1CCCC2	25251523	OPJBFNXGFIYJKM-FMIVXFBMSA-N	442.497	1.747	50	20	IDGD	
CCOc1ccc(NC(=S)NNC(=O)c2cccc(CN3C(=O)CNC3=O)c2)cc1	28633797	MZZRZKFGTXRSEO-UHFFFAOYSA-N	427.486	1.769	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1C	28663396	FMQMFUNWURIBLZ-UHFFFAOYSA-N	445.541	1.718	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)C[C@](O)(c2nccn2C)C(F)(F)F)c1C	105569945	FMGVDCGCYWSLKP-UGSOOPFHSA-N	428.411	1.792	50	20	IDGD	
COc1ccc(CN2CCC(CNC(=O)NNC(=O)CNC(=O)c3ccco3)CC2)cc1	726249136	XJCOTTKPVUARCN-UHFFFAOYSA-N	443.504	1.261	50	20	IDGD	
C=CCNS(=O)(=O)c1cccc(C(=O)NNC(=O)c2cccc(OC(F)F)c2)c1	728545419	HKCNPNAFEALWIZ-UHFFFAOYSA-N	425.413	1.827	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)[C@@H]2CC(=O)N(c3ccc4c(c3)CCC4)C2)cn1	729692074	JHNKCADEJJBNOB-OAHLLOKOSA-N	425.514	1.950	50	20	IDGD	
CC(C)COc1ccc(CC(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1	730368141	RSBKVONUVNBUFF-HXUWFJFHSA-N	442.468	1.795	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)c1cc(F)ccc1N1CCOCC1	730776676	XNBNWOPBTUSHQT-UHFFFAOYSA-N	434.493	1.860	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COc2cc([N+](=O)[O-])c(C=O)cc2OC)c(OC)c1	731636290	IFMIGEBPQZEXCV-UHFFFAOYSA-N	433.373	1.273	50	20	IDGD	
COc1ccc(-c2noc(CN3CCN([C@@H](C)C(=O)NNC(=O)CC(C)C)CC3)n2)cc1	731848545	GPSLQAARRUGPQU-INIZCTEOSA-N	444.536	1.445	50	20	IDGD	
O=C(CCN1CCN(C(=O)[C@H]2CCCO2)CC1)NNC(=O)CC12CC3CC(CC(C3)C1)C2	731959413	LXTDINTXEUQRDB-LOXVZWDBSA-N	446.592	1.454	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)[C@@H]2CCCN2c2ncnc3sccc23)C[C@@H](C)O1	732261540	DGNRVNFJLOUTCC-LZWOXQAQSA-N	432.550	1.307	50	20	IDGD	
C[C@H]1CC(C)(C)C[C@]2(C1)NC(=O)N(CC(=O)NNc1ccccc1S(C)(=O)=O)C2=O	732302883	SQQBCMURRHWYHW-RBZFPXEDSA-N	436.534	1.670	50	20	IDGD	
O=C(NCCN1CCN(C(=O)C2CCCCC2)CC1)NNC(=O)c1cc2c(s1)CCC2	733351273	XGNVUDZDMUXWTK-UHFFFAOYSA-N	447.605	1.905	50	20	IDGD	
COc1ccc(NC(=O)COc2ccc(C(=O)NNC(=O)CN(C)C)cc2OC)cc1	733359884	TZJKDDPTOIXLKT-UHFFFAOYSA-N	430.461	1.044	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)Cc1ccc(-n2cnnn2)cc1	734253172	UGIMYMPCVYIYRI-UHFFFAOYSA-N	429.506	1.425	50	20	IDGD	
CN(C)C(=O)N1CCC(C(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)CC1	734825714	NBIBERFTLQUTNR-UHFFFAOYSA-N	440.545	1.110	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2sccc2-n2cccc2)CC1	735117718	GZFFBLKRJCMPCY-UHFFFAOYSA-N	446.558	1.627	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)Cn2nnc([C@H]3CN(Cc4ccccc4)CCO3)n2)cc1	735233353	SQGBOAPCGANSFD-LJQANCHMSA-N	435.488	1.016	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCc2ccc(N3CC=CC3)cc2)nc1	741091014	VGIJUKAJYNWREB-UHFFFAOYSA-N	430.534	1.971	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)c3nnn(C)c3C)c2)c(C)c1	741658886	GRUSIEQDESJTDF-UHFFFAOYSA-N	442.501	1.616	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)[C@@H](C)NC(=O)c2cc3c(C)nn(C)c3s2)c1	743295667	QOWZEGPRAZWVRH-GFCCVEGCSA-N	444.517	1.330	50	20	IDGD	
Cc1cccc(NC(=S)NNC(=O)[C@H](C)NS(=O)(=O)c2c(C)nn(C)c2C)c1C	743297453	RCHXEXQPPACVEW-ZDUSSCGKSA-N	438.579	1.338	50	20	IDGD	
O=C1C[C@@H](Cc2ccc(C(=O)NNc3ccc(S(=O)(=O)C(F)F)cc3)cc2)C(=O)N1	743334568	ASGIBWHMKFMRAV-CYBMUJFWSA-N	437.424	1.645	50	20	IDGD	
CC(C)(C)OC(=O)N(CC(=O)NNc1ccccc1S(C)(=O)=O)C[C@H]1CCCO1	743369142	ZZFOUSZHXFMGRM-CQSZACIVSA-N	427.523	1.949	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)CNC(=O)c1ccco1)c1nc(-c2ccc(Cl)cc2)no1	743578218	VYPNXTBGFWXEMC-SNVBAGLBSA-N	432.824	1.804	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)c1	744405489	SUUAOZUINMIVDD-UHFFFAOYSA-N	425.445	1.122	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)[C@H](C)Oc2ccc(F)c(F)c2)cc1OC	744596268	MFESWRIJZQMLCU-NSHDSACASA-N	438.383	1.754	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)NCCCN1CCC[C@H](C(N)=O)C1	745828906	AWHLMNDKRHQFSZ-LPHOPBHVSA-N	441.532	1.525	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNC(=O)N[C@H]2C[C@H](C)N(c3cnn(C)c3)C2=O)cc1	745916135	AYVCMDDUSYYQEB-KXBFYZLASA-N	442.520	1.983	50	20	IDGD	
Cc1cc(F)ccc1S(=O)(=O)Nc1ccc(C(=O)NNC(=O)N2CCOCC2)cc1	745992238	WXDPYWZUJPVGHU-UHFFFAOYSA-N	436.465	1.622	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CC[S@](=O)c2ccc3c(c2)OCCO3)cc1OC	746092491	SOFYVCJDXGRLKA-PMERELPUSA-N	434.470	1.434	50	20	IDGD	
COc1ccc(Cl)cc1N1C[C@H](C(=O)NNC(=O)Cc2cn3ccccc3n2)CC1=O	746549258	OKLJACWNJXLVTP-CYBMUJFWSA-N	441.875	1.739	50	20	IDGD	
Cc1ccc(C)c(NNC(=O)[C@H](CCS(C)(=O)=O)NS(=O)(=O)c2ccccc2)c1	748413237	WBZZBWFXCORPPG-KRWDZBQOSA-N	439.559	1.528	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)N1CCCN(Cc2nc([C@H](C)OC)no2)CC1	750286948	QNZDVYDYBLHEDR-AWEZNQCLSA-N	432.481	1.348	50	20	IDGD	
COC(=O)c1cc2c(cc1NC(=O)C(=O)NNC(=O)c1ccc3ccccc3n1)OCO2	753838953	DQYZHCXSILUHMF-UHFFFAOYSA-N	436.380	1.150	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCCCC2)cc1NC(=O)NNC(=O)Cc1ccncc1	755413804	ZGNAWVDRRAVJIF-UHFFFAOYSA-N	447.517	1.660	50	20	IDGD	
COC(=O)c1ccc(NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1	755828547	QMLBLTUNIHUTER-UHFFFAOYSA-N	425.489	1.838	50	20	IDGD	
COC(=O)CNC(=O)Cc1ccc(NC(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)cc1	755863846	WAJXQUFESCLCQN-ZDUSSCGKSA-N	446.435	1.278	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)Nc1cccc(S(=O)(=O)/N=C2\CCCN2C)c1	756028952	IRRCXFNCXOAJRU-HKOYGPOVSA-N	445.501	1.975	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)Nc2ccccc2OCCC(N)=O)cc1	756067997	VQZINHYQBTYXAJ-CQSZACIVSA-N	428.445	1.764	50	20	IDGD	
CN1CCCCC/C1=N\S(=O)(=O)c1ccc(NC(=O)NNC(=O)c2cnn(C)c2)cc1	756112746	FUKGSPVUJNRLIA-JJIBRWJFSA-N	447.521	1.480	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)Nc2cccc(C(=O)N3CCOCC3)c2C)c1	756184647	IYEGPBHAWVDRJV-UHFFFAOYSA-N	440.460	1.287	50	20	IDGD	
CO[C@H](C)C(=O)Nc1cccc(NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c1	756226722	FOAIVHJUGOGQMY-GFCCVEGCSA-N	438.444	1.373	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1	756565805	YSOPWGXFGVEVTM-UHFFFAOYSA-N	440.503	1.318	50	20	IDGD	
COC(=O)c1cc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cn1C	757671542	NBXLMFOCWMYWSD-UHFFFAOYSA-N	449.489	1.063	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)NCCc1ccc(S(N)(=O)=O)cc1	761640927	SEAFKMZGUUJAIZ-UHFFFAOYSA-N	438.531	1.008	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)N[C@H]1CCCN(Cc2ccccc2)C1=O	761797358	GXAOXSDERZTGQE-AWEZNQCLSA-N	434.294	1.912	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)c2nnn(-c3cccc4c3CCN(C)C4)c2C)n1	762906211	LXTIJLGFMCABGR-UHFFFAOYSA-N	435.536	1.957	50	20	IDGD	
O=C(Cc1ccc(CC(=O)NNC(=O)c2ccccc2)cc1)NNC(=O)c1ccccc1	763361901	LKBNAOMKSOIQTJ-UHFFFAOYSA-N	430.464	1.694	50	20	IDGD	
CS(=O)(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c1	763454373	JKWDPMFJKXMKTG-UHFFFAOYSA-N	440.821	1.051	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)C(=O)Nc1cc(Cl)ccc1F	763531516	OJNAGLDLMXDVKI-UHFFFAOYSA-N	447.898	1.777	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(C(F)(F)F)nc2)cc(OC)c1OC	763538344	AIHFLUUADDCGFZ-UHFFFAOYSA-N	442.350	1.526	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)nc(C2CC2)n3C)cc1OC	763543818	QQDCPQSVGSLHKW-UHFFFAOYSA-N	437.456	1.868	50	20	IDGD	
Cc1nn(-c2ccccc2)c(C)c1NC(=O)C(=O)NNC(=O)[C@@H]1COc2ccccc2O1	763578351	OSWOUEKFFIJGRY-SFHVURJKSA-N	435.440	1.415	50	20	IDGD	
CNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C(C)(C)C)cc2)cc1	763601297	XTGYTUNYNVZFTM-UHFFFAOYSA-N	426.473	1.509	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)n(Cc2ccccc2)n1	763807605	OQZPAYRJLNSMKD-UHFFFAOYSA-N	432.440	1.276	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cc(F)c(OC)cc2OC)cc1	763867592	XLWJNDYZOYHOLZ-LBPRGKRZSA-N	449.435	1.795	50	20	IDGD	
CS(=O)(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCCCC3)c1	763969473	VGAYXNAQXKCJFY-UHFFFAOYSA-N	435.527	1.820	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1ccc(OCC(=O)N(C)C)cc1	764011919	LAUCWJJPKXNDNV-UHFFFAOYSA-N	448.863	1.215	50	20	IDGD	
C[C@H]1CCCCN1CC(=O)Nc1ccc(F)c(NC(=O)C(=O)NNC(=O)C2CCCC2)c1	764068359	KGMLPTFYYAPPPV-AWEZNQCLSA-N	447.511	1.915	50	20	IDGD	
CC[C@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(C)c(S(=O)(=O)N2CCCCCC2)c1	764086094	SPZMTXXCAFEITD-AWEZNQCLSA-N	438.550	1.692	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)cc1Cl	764166570	CKLVBOKUWUWOOX-QGZVFWFLSA-N	433.848	1.455	50	20	IDGD	
COC(=O)[C@@H](C)Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)cc1	764169100	UFJIGPKPDPFZFP-UGSOOPFHSA-N	425.441	1.128	50	20	IDGD	
COc1cccc(Cn2nccc2NC(=O)C(=O)NNC(=O)c2ccc(C#N)cc2)c1OC	764182748	RTRVNEPALOQLMX-UHFFFAOYSA-N	448.439	1.220	50	20	IDGD	
Cc1cnn(Cc2cc(F)ccc2F)c1NC(=O)C(=O)NNC(=O)c1cccc(C#N)c1	764238796	XBNHFRBVWLFGCK-UHFFFAOYSA-N	438.394	1.789	50	20	IDGD	
N#CCOc1cccc(NC(=O)C(=O)NNC(=O)c2cc(F)ccc2Br)c1	764270235	JAOFQNZUWSBSMC-UHFFFAOYSA-N	435.209	1.890	50	20	IDGD	
CCOC(=O)N(C)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2O)cc1	764277808	OHKFRTGPAQLLAS-UHFFFAOYSA-N	430.417	1.150	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)ccc1O)C(=O)Nc1cccnc1-n1cccn1	764280331	MNNNKLVTKWXAGV-UHFFFAOYSA-N	445.233	1.135	50	20	IDGD	
C[C@@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)CCc3ccccc3O)cc2)CCO1	764281188	LNDFVCHXHXDNTK-OAHLLOKOSA-N	426.473	1.336	50	20	IDGD	
CCn1nnnc1-c1cccc(NC(=O)C(=O)NNC(=O)CCCc2cccs2)c1	764340885	KKSRCXWKYUXGAR-UHFFFAOYSA-N	427.490	1.530	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)c(F)c1	764378332	YHCOSOLBBJCPIM-UHFFFAOYSA-N	431.405	1.464	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cccnc3Cl)n[nH]2)cc1OC	764379266	UNLLVZYAAHUNSO-UHFFFAOYSA-N	444.835	1.542	50	20	IDGD	
CC(=O)Nc1cc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)ccc1C	764388518	SMWDLVZXAIEVHW-UHFFFAOYSA-N	438.419	1.882	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1cccc2c1OCCC2=O	764396790	BYKMZNZTHWYJMU-UHFFFAOYSA-N	429.454	1.539	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(C(=O)Nc2ccccc2)cc1	764399117	ZHODBXSBAKMUBZ-CQSZACIVSA-N	428.445	1.076	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)ccc1Cl	764404537	LAJMJVAIYGDAQX-UHFFFAOYSA-N	437.861	1.710	50	20	IDGD	
CCOC(=O)C(C)(C)n1cc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2F)cn1	764411498	YMDCZGRJPKXCRM-UHFFFAOYSA-N	439.831	1.374	50	20	IDGD	
COc1ccc(Cn2nccc2NC(=O)C(=O)NNC(=O)OC(C)(C)C)c(OC)c1OC	765390976	DCLCRHIHLGCYTP-UHFFFAOYSA-N	449.464	1.452	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2ccnc(OCCN(C)C)c2)c2ccccc2c1=O	765466544	APCKIFGTIIOFKC-UHFFFAOYSA-N	438.488	1.217	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)CCNS(=O)(=O)c3cccs3)n[nH]2)c1	765577934	YVAZIEIPSGMRRW-UHFFFAOYSA-N	447.542	1.885	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3cn(CCC(C)C)nn3)n[nH]2)cc1OC	765597568	ULNZOMHPNXGIJX-UHFFFAOYSA-N	427.465	1.806	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)[C@H]1CCc2c[nH]nc2C1	766662676	AQNDEACKCCSQKH-INIZCTEOSA-N	430.940	1.133	50	20	IDGD	
CN(C)c1ccnc(C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)c1	768292572	ZQOGZVKDMSXBNK-UHFFFAOYSA-N	430.940	1.380	50	20	IDGD	
CCNC(=O)N(C)NC(=O)c1cc(S(=O)(=O)N2CCCCC2)ccc1N1CCCC1	768411852	BNVLJXAXKLMJIG-UHFFFAOYSA-N	437.566	1.768	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(/C#N)C(=O)OCC(=O)N2CCN(C(C)=O)CC2)c1C	768747427	LECCGYWKTCENDX-VBNMEBLOSA-N	430.505	1.453	50	20	IDGD	
O=C(NNC(=O)c1cc(O)nc(C2CC2)c1)c1cccc(S(=O)(=O)N2CCCC2)c1	770208394	IKZLVTSRXOKBLU-UHFFFAOYSA-N	430.486	1.524	50	20	IDGD	
CC[C@@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	770209978	XONGBJBQXNIDNI-LLVKDONJSA-N	434.902	1.052	50	20	IDGD	
C[C@@H](NC(=O)NNc1nc(O)c2cnn(C)c2n1)c1cc(F)ccc1N1CCN(C)CC1	770373697	UQBPYCVYPIDRKX-GFCCVEGCSA-N	443.487	1.347	50	20	IDGD	
CCOC(=O)N1CC[C@@H](NC(=O)NNC(=O)COc2ccc(Br)cc2)C1	770535798	QKMATSBVGJWCFW-GFCCVEGCSA-N	429.271	1.389	50	20	IDGD	
CC(=O)N[C@H](CC(=O)NNc1nc(O)c2cnn(C)c2n1)c1ccc(Br)cc1	770983903	RUDRCZZVHGWNGJ-CYBMUJFWSA-N	448.281	1.542	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)c3ccc4c(O)nc(S)nc4c3)nc21	771008873	MBUQJLYJYKDZCQ-UHFFFAOYSA-N	426.462	1.981	50	20	IDGD	
C[C@H]1C[C@H](NC(=O)OC(C)(C)C)CCN1C(=O)NNC(=O)CNC(=O)c1cccs1	771977465	KIFSNAITRIJKMU-QWHCGFSZSA-N	439.538	1.596	50	20	IDGD	
CC[C@H](C)[C@H](NC(=O)N1CCCC1)C(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772887609	AXFVOQSGTBZOSL-BBRMVZONSA-N	437.928	1.324	50	20	IDGD	
CCCNC(=O)Nc1ccc(CC(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)cc1	772905858	QTQGFHGRTUVCKL-UHFFFAOYSA-N	445.907	1.878	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)[C@@H](Cc2cccnc2)NC(=O)c2ccccc2)c1	773071487	BQILQEXVVZLRDY-HXUWFJFHSA-N	446.467	1.237	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNc2ccc(C(F)(F)F)cn2)cc1C(=O)OC	773666382	ADIIACMLDMJBDP-UHFFFAOYSA-N	440.334	1.755	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2cc(Br)ccc2N2CCCC2)n1	773724447	RKYNUEXORWKWON-UHFFFAOYSA-N	435.282	1.930	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCN(c3cccc4cnccc34)C[C@H]2C)n1	773952963	CRRZJJKYLZAVFN-MRXNPFEDSA-N	438.557	1.900	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)NCCC(=O)NCc2ccccn2)N(C)c2ccccc21	773966812	NIRJYVLMDBYYGD-UHFFFAOYSA-N	446.511	1.875	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccc(-n2ccnc2)nc1	774009491	OXBASYVYSPRHFS-GFCCVEGCSA-N	428.836	1.474	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN[C@@H](CC(=O)N(C)C)c1ccccc1	775216800	IXXINKNNXLDRJI-KRWDZBQOSA-N	432.908	1.919	50	20	IDGD	
Cc1ccc(S(=O)(=O)C[C@H](C)NC(=O)NNC(=O)COc2ccccc2C#N)cc1	776191496	MKBXTQRKKWBKCG-HNNXBMFYSA-N	430.486	1.438	50	20	IDGD	
CC(=O)N1CCN(c2ccccc2CNC(=O)NNc2cccc(S(C)(=O)=O)c2)CC1	776619556	WKEAWVOJNSXLBR-UHFFFAOYSA-N	445.545	1.585	50	20	IDGD	
N#CCc1ccccc1CC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	776965220	WWFVXOWHLYECQD-UHFFFAOYSA-N	440.525	1.931	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1coc(-c2ccc(Br)cc2F)n1	778553319	CIFHQRAXPZYGQS-MRVPVSSYSA-N	446.254	1.439	50	20	IDGD	
Cc1nc(O)c(C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)cc1Br	779039571	HDWHCJFWNCTQLO-UHFFFAOYSA-N	431.287	1.924	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)N2CC[C@H](C(=O)OC)C[C@@H]2C(=O)OC)c1C	780138077	URXSQHZJYKXYFZ-XJPOOAEGSA-N	431.489	1.612	50	20	IDGD	
O=C(CN1CCC(CCCN2CCOCC2)CC1)NNC(=O)c1cccc([N+](=O)[O-])c1	780327713	AIQRQQJIPZQDNM-UHFFFAOYSA-N	433.509	1.180	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)[C@]1(C)CCCN(C(=O)c2ccccc2)C1	780971161	JQIARGCOLMETDQ-JOCHJYFZSA-N	432.521	1.991	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2cc(Cl)ccc2OCCS(C)(=O)=O)cc1	783034481	AEWFQMXLPOCQJT-UHFFFAOYSA-N	441.893	1.854	50	20	IDGD	
Cc1cc(Sc2ncccn2)ccc1NC(=O)C(=O)NN[C@@]1(C)CCS(=O)(=O)C1	783427305	RIEXVILIPVSWFX-SFHVURJKSA-N	435.531	1.073	50	20	IDGD	
O=C1NC(=O)c2ccccc2/C1=C\NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	783680756	YDQKKAHVKDIVGS-QGOAFFKASA-N	440.481	1.017	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNS(=O)(=O)c1ccc(OCC(F)F)cc1	783843023	RNUFORZGLNOMGL-UHFFFAOYSA-N	447.847	1.610	50	20	IDGD	
O=C(NNc1nccnc1Cl)C(=O)Nc1ccc2nc(N3CCOCC3)sc2c1	784777939	NITGDRKHWVDXJD-UHFFFAOYSA-N	433.881	1.658	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2ccc(Cl)c(C(=O)NC3CC3)c2)n1	785227025	MZAXMVXQKWLVAG-UHFFFAOYSA-N	445.911	1.950	50	20	IDGD	
CCCCNS(=O)(=O)c1cccc(NC(=O)C(=O)NNc2cc(F)cc(OC)c2)c1	785233976	FPIBQDDAZAWBNP-UHFFFAOYSA-N	438.481	1.995	50	20	IDGD	
COc1cc(F)cc(NNC(=O)C(=O)Nc2ccccc2OCC(=O)N2CCOCC2)c1	785246739	QOLPWCHINBRBDW-UHFFFAOYSA-N	446.435	1.154	50	20	IDGD	
Cc1ccc(N2CCNC2=O)cc1NC(=O)C(=O)NNC(=O)C(F)(F)Oc1ccccc1	787549346	MCNXUQRACQKHRH-UHFFFAOYSA-N	447.398	1.282	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)Nc1ccc(Cl)cc1-n1cccn1	788330096	DFSYNPHPOLADLM-KRWDZBQOSA-N	441.831	1.452	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)CN1CCc2ccccc2C1=O	788729232	URXRQCBBQZAAAG-UHFFFAOYSA-N	432.274	1.674	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCc2ccc(NC(C)=O)nc2)cc1Br	789300280	XKBIEGOPVBDFHL-UHFFFAOYSA-N	436.266	1.955	50	20	IDGD	
Cc1cc(-n2cccn2)ccc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1ccc(F)cc1	789585020	VKNNVXLHHBETCJ-CQSZACIVSA-N	425.420	1.873	50	20	IDGD	
CCOc1ccc(OC)cc1NC(=O)C(=O)NNC(=O)[C@H]1OCC[C@H]1c1ccccc1	789820414	RIYZKRPBCOSRFJ-LPHOPBHVSA-N	427.457	1.753	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)cc(-n2cccn2)c1	792354692	BICKVIDPGPZJHO-UHFFFAOYSA-N	445.382	1.639	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1cnn(CCO)c1-c1ccccc1	793426571	SJSHILAUKDXNQA-UHFFFAOYSA-N	435.488	1.010	50	20	IDGD	
C=CCNS(=O)(=O)c1cccc(C(=O)NNc2ccccc2S(=O)(=O)N(C)C)c1	795168899	WEYKGJYIAPXTLK-UHFFFAOYSA-N	438.531	1.158	50	20	IDGD	
O=C(NNC(=O)c1cccc2cccc(Br)c12)N[C@@H]1CCS(=O)(=O)C1	795527696	QRULFGXOCXZCKQ-LLVKDONJSA-N	426.292	1.733	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)c(OC)c(C)c1OC	797006276	JNBLZJHQVKNFOJ-UHFFFAOYSA-N	437.836	1.780	50	20	IDGD	
CC(C)(C)OC(=O)NCC[C@@H]1CCCN(CC(=O)NNC(=O)c2cccc(C#N)c2)C1	799358942	OXVYDYBNFIBKLA-INIZCTEOSA-N	429.521	1.946	50	20	IDGD	
CS(=O)(=O)NC1CC(NC(=O)NNC(=O)c2ccc(Br)cc2Cl)C1	801013232	NTLLIUKPOGZRRC-UHFFFAOYSA-N	439.719	1.127	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2nnn(-c3cccc4cnccc34)c2C)cc1	801109081	UPGQAKAHERRQBV-UHFFFAOYSA-N	429.440	1.832	50	20	IDGD	
C[C@H](C(=O)NNC(=O)Nc1ccc2c(c1)OCO2)N1CCN(c2ccc(F)cc2)CC1	802106325	AVUQETGORYORKU-CQSZACIVSA-N	429.452	1.918	50	20	IDGD	
COCCNC(=O)[C@@H](C)OC(=O)c1ccc(NC(=O)NNC(=O)c2ncccc2C)cc1	806750913	NRDJPGOEVISTSE-CQSZACIVSA-N	443.460	1.164	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)CNS(=O)(=O)c1ccc2ccccc2c1	810385751	YGMILGNLTRBCRS-UHFFFAOYSA-N	433.511	1.665	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3cn(C4CCOCC4)nn3)n[nH]2)cc1OC	810584082	MEICKWDARURUCM-UHFFFAOYSA-N	441.448	1.112	50	20	IDGD	
Cc1noc2nc(C3CC3)cc(C(=O)OCC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)c12	812874500	AJYNVTYYDFIVJD-UHFFFAOYSA-N	439.384	1.935	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2cccc(NC(=O)C3CC3)c2)cc1	813033426	SBOOZRSRPYCDMA-UHFFFAOYSA-N	445.501	1.367	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)N[C@H]1CCN(C(=O)OC(C)(C)C)C2(CCC2)C1	813793829	BCHWRWDSWSRIEY-GJZGRUSLSA-N	428.530	1.691	50	20	IDGD	
CC(CCCOc1ccccc1C(N)=O)=NNC(=O)Nc1ccc(S(N)(=O)=O)cc1	814964476	VIJKTJNTLLSASD-UHFFFAOYSA-N	433.490	1.790	50	20	IDGD	
Cc1cccc(Oc2ccccc2NC(=O)C(=O)NNC(=O)[C@H]2CCc3nncn3C2)c1	815692485	RVTIROGLNGHUCS-HNNXBMFYSA-N	434.456	1.727	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1ncc(C(C)(C)C)s1	815752591	YRLHLCDZWSVGNY-UHFFFAOYSA-N	425.536	1.773	50	20	IDGD	
CCCCC(=O)N1CSC[C@@H]1C(=O)NNC(=O)[C@H]1CCCN(C(=O)OC(C)(C)C)C1	819658891	QDLYMIXBAXEHBU-LSDHHAIUSA-N	442.582	1.873	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)c2ccc3c(c2)C(=O)N(C)C3=O)c2ccccc2c1=O	824253731	FGHNLTAMDYQZGD-UHFFFAOYSA-N	433.424	1.278	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)COc2cccc([N+](=O)[O-])c2)c2ccccc2c1=O	914713210	JPQOEZUXSUDBJR-UHFFFAOYSA-N	425.401	1.555	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@]23CCC(=O)N2c2ccccc2S3)c1	915165137	ZHVHHEPQNFLPKO-LJQANCHMSA-N	431.495	1.480	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCC1(N(C)C)CCCCCC1	915917038	DTSFYVGJTPPCJL-UHFFFAOYSA-N	438.598	1.887	50	20	IDGD	
O=C(NNC(=S)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1)NC1CCCCC1	916113346	JLQKUEOCDQTYQO-UHFFFAOYSA-N	441.579	1.541	50	20	IDGD	
O=C(NCc1ccccc1Cn1ccnc1)NNC(=O)c1nn(-c2ccccc2)cc1O	916230739	NKKAGOLPMWYXTO-UHFFFAOYSA-N	431.456	1.967	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCc2cccc(Cn3ccnc3)c2)c2ccccc2c1=O	916405314	CCXKSBCSDXRRQP-UHFFFAOYSA-N	445.483	1.805	50	20	IDGD	
COc1cc([C@@H](C)NC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc(OC)c1OC	916483792	XLWOEOKQGQMSDR-XIKOKIGWSA-N	431.445	1.944	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCCOc2ccc(F)cc2)nc1	916613187	SDNKCSQBXYLJSU-UHFFFAOYSA-N	425.486	1.956	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)NC[C@]1(N2CCOCC2)CCSC1	916636802	MFLXJOIWBQVZMW-AUUYWEPGSA-N	426.514	1.131	50	20	IDGD	
CCCCS(=O)(=O)N1CCC(C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)CC1	916739392	CGKIKTZLEZKUND-UHFFFAOYSA-N	449.533	1.181	50	20	IDGD	
O=C(CN1C(=O)[C@H]2CCCC[C@H]2C1=O)NNC(=O)c1ccc(F)cc1Br	918340585	UJLWZHVHNKIEEG-PHIMTYICSA-N	426.242	1.524	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)NNC(=O)c2ccc(Br)s2)c1	918778643	LBIQAIIFDUQPPC-UHFFFAOYSA-N	443.279	1.817	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)[C@H]1CCCN(CC(F)(F)F)C1	919825898	YXKOLZPQIQGSNG-KRWDZBQOSA-N	441.498	1.620	50	20	IDGD	
Cc1nccn1-c1ccc(CNC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1F	920239357	CUOBWQMXBMTTHC-LJQANCHMSA-N	425.420	1.990	50	20	IDGD	
COc1ccc(CCC(=O)NN=C(C)c2ccc(S(=O)(=O)N3CCNCC3)cc2)cc1	920379518	BHJYJZOMKNSCHK-UHFFFAOYSA-N	444.557	1.762	50	20	IDGD	
COc1cc(C=NNC(=O)NCCc2cccs2)ccc1OCC(=O)N1CCOCC1	920831610	UMPDOXDATVSXNG-UHFFFAOYSA-N	446.529	1.870	50	20	IDGD	
NC(=O)c1ccc(C(=O)NNC(=O)[C@@H]2Cc3ccccc3CN2Cc2ccccc2)cn1	1318084328	SNHNNCFMPALUQR-NRFANRHFSA-N	429.480	1.569	50	20	IDGD	
CNC(=O)COc1cccc(CNC(=O)NNC(=O)c2ccc(Br)cc2)c1	1323146667	DYNGYLPARZHZHC-UHFFFAOYSA-N	435.278	1.718	50	20	IDGD	
CN(C)c1ccc(Br)c(S(=O)(=O)NNC(=O)c2n[nH]c3c2CCCC3)c1	1341423260	DRJNLCXOZBBQAP-UHFFFAOYSA-N	442.339	1.740	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4nonc4c3)C2)C1	1777718609	BZDJFCJRJKXQIJ-ROUUACIJSA-N	427.288	1.903	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Cl)C2)c1cccn2c(O)nnc12	1777956833	BSUQLBMXPDVZKI-SNUQEOBHSA-N	425.848	1.097	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](C)N3CSCSC3)C2)C1	1779147534	CCSLMQATBPJUMC-GRDNDAEWSA-N	438.015	1.113	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cccc(C#N)c3Cl)C2)C1	1780192121	GGPUJSGUJCDAOQ-HNAYVOBHSA-N	426.300	1.909	50	20	IDGD	
COc1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@](C)(Cl)CCl)C3)nn1C	1780245028	BWIYTSZEPFLPCR-MDASCCDHSA-N	447.363	1.793	50	20	IDGD	
N#Cc1ccc2[nH]nc(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)[C@H](O)CCl)C4)c2c1	1781206612	XXXCEYOOKRACAR-CBGDNZLLSA-N	445.907	1.162	50	20	IDGD	
O=C(c1noc2c1CCCC2)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781331067	KLGGUVCPFPBIAB-RHSMWYFYSA-N	430.274	1.687	50	20	IDGD	
O=C(C1CCC2(CC1)OCCO2)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781332659	CRNDPEHRMSKFMM-YOEHRIQHSA-N	449.317	1.440	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(O)ccc3O)C2)C1	1782049521	VKSXKTFKSQSCAN-RDTXWAMCSA-N	427.295	1.715	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C[C@@H]1C[C@@H]3CC[C@H]1C3)C2	1782213232	GLQRONAJGRWNBI-PYJXJXBRSA-N	448.608	1.700	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cccc4ccnn34)C2)C1	1782221127	YRVYOYSWXAVJFG-IFXJQAMLSA-N	435.322	1.809	50	20	IDGD	
Cn1cc2cc(C(=O)N3CC[C@@]4(CN(C(=O)CO[Si](C)(C)C)CCO4)C3)ccc2n1	1782243235	KIAANNNALBVRIA-OAQYLSRUSA-N	430.581	1.868	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(CCN(C(=O)c3cnc4ccc(F)cn34)C2)C1	1782463372	HLIZWDYNAZXFEX-FQEVSTJZSA-N	434.544	1.768	50	20	IDGD	
O=C(c1cnc2cccc(Cl)c2c1)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1782497927	XZHONVDCFMOVHX-YLJYHZDGSA-N	438.311	1.931	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](O)Cc3ccccc3)C2)C1	1783344147	PJDJAMSUZFGSHX-QKLQHJQFSA-N	439.350	1.593	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cccnc3OC)CCO2)C1	1783344409	QBFPILKABDKWGJ-KBXCAEBGSA-N	426.311	1.707	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(C(F)(F)F)n3C)CCO2)C1	1783874828	LUGXNUXJFVGEFY-PXAZEXFGSA-N	437.846	1.741	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc4sc(N)nc4c3)CCO2)C1	1783876287	NSPPMAWUZBZVMQ-DJJJIMSYSA-N	438.937	1.576	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccoc1C(F)(F)F)CCO2	1783935600	WHZJNBDHJFBHOM-GOSISDBHSA-N	446.426	1.115	50	20	IDGD	
COc1ccc(F)cc1CC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1784084118	GPOCRINEBCFGCW-SJLPKXTDSA-N	447.276	1.897	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Cl)C[C@@H]21)[C@H]1CC(=O)N(C2CCCC2)C1	1784967870	PJJUNCWWKHAOID-WSLKZVHASA-N	429.920	1.292	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(C(F)(F)F)nc3)[C@H]2C1	1786099578	OZQUHSIPCDOFHD-XQLPTFJDSA-N	449.857	1.948	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC1(c2ccc(NC(=O)Cc3ncccn3)cc2)CCC1	1786954428	ZVLJSEPIPOSJHM-UHFFFAOYSA-N	445.483	1.466	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC1(c2ccc(NC(=O)c3cc(O)n(C)n3)cc2)CCC1	1787055220	SQSZWLWAXHMKCF-UHFFFAOYSA-N	428.493	1.246	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CSc3ncccn3)[C@H]2C1	1787074713	AQZGOCGDVBBZAA-WZTLGTBRSA-N	447.388	1.785	50	20	IDGD	
C[C@@H](Nc1nccs1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21	1787486289	DOYSLCAFTKVFPL-QNWJLWSRSA-N	449.346	1.614	50	20	IDGD	
Cn1ccc2c(O)ncc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)C(Cl)Cl)C[C@@H]43)c21	1789152184	NTLXLPFKDPLHMH-BPNCWPANSA-N	441.315	1.676	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)NC(=O)OC(C)(C)C)C[C@@H]21	1789864393	AOANLWJWVWXQOO-CWVYHPPDSA-N	431.961	1.897	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4nn(C)cc4c3)[C@H]2C1	1790354243	SWRIHRGWNDKLQC-XJOINEQPSA-N	449.349	1.950	50	20	IDGD	
CCN(CC)C[C@@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21	1790600545	UWDWXZFMMZLTIE-QZWWFDLISA-N	432.403	1.729	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)ON=C(C)C)C[C@@H]21	1790963308	RHLUKPBDVYXXDS-QXKUPLGCSA-N	432.359	1.941	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1C[C@H]1c1ccc(F)cc1)c1cccc(B(O)O)c1	1792910371	XDPFQTWHGHMVIJ-WIYBCGNWSA-N	436.292	1.561	50	20	IDGD	
COc1ccc([C@@H]2C[C@@H]2C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CCC(=O)NN(C)C)C3)cc1	1793523800	FBTRENSTNMZSNP-LBFCPWMRSA-N	442.560	1.810	50	20	IDGD	
C=CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](O)CCl)C2	1793830337	YLOOJVRETHCSOC-JKJDWNRSSA-N	429.945	1.694	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1CCC1)C2	1793880671	CSQFEFVCXVOSPS-FZKCQIBNSA-N	429.945	1.508	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(Cl)c(O)cc1O)C2	1795115120	KQGDQDNYJHGTDD-WRBXQSRGSA-N	447.713	1.739	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)c1ccc2ncccc2c1	1796190992	MHNNZDCVHNOAMA-WKCHPHFGSA-N	429.285	1.480	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H]1C=C[C@@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Cl)C1	1796365104	TWOGBFFKYFLKKO-OWDFPOFWSA-N	445.919	1.580	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc([N+](=O)[O-])c3c1OCO3)C2)[C@H](F)Cl	1796366459	VXVOIEYRVXIQLO-GDGVSTKUSA-N	429.788	1.061	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccnc(C(=O)OCC)c1	1798683902	UWVDWOARLPSMSD-DFGXFYAUSA-N	437.924	1.869	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(F)cc([N+](=O)[O-])c1)C2)[C@H](F)Br	1799348261	FSCDXHMIJBMPLJ-DJBIQUGXSA-N	448.220	1.628	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c(Cl)ccc3c1OCO3)C2	1800978716	ZDCHLZRXKLZUEE-DZJQYVJYSA-N	445.299	1.526	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H](CNC(=O)COCCOC)[C@H]1c1cccnc1	1806763002	XTWKWOWBSQCWJL-SOLBZPMBSA-N	442.354	1.924	50	20	IDGD	
CC1=CC[C@H](C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)CC1	1809478521	OCDXFXCRRKHKEQ-QTGUNEKASA-N	447.344	1.827	50	20	IDGD	
C#CC(=O)NC[C@@H]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2OC(C)=O)[C@@H]1c1cccnc1	1812530402	AXXPRWHMUODRBV-HRAATJIYSA-N	436.424	1.868	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)COC(C)(C)C)[C@H]1c1cccnc1	1813069160	VIIGVPNPLAHECW-UWJYYQICSA-N	433.553	1.276	50	20	IDGD	
O=C(/C=C\C(=O)N1CC[C@H](CNC(=O)C(Cl)Cl)[C@@H]1c1cccnc1)NC1CC1	1813076904	BGWYUOBDSNAWTH-FULAONPOSA-N	425.316	1.726	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cccn3c(O)nnc23)[nH]n1)[C@@H](O)CCl	1814870097	IMLHXOQFYBGRPI-OLZOCXBDSA-N	433.856	1.064	50	20	IDGD	
Cc1ncc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)cn1	1816291539	RDVUNFCHXOKGMO-INIZCTEOSA-N	428.497	1.187	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cocn2)n[nH]1	1816601975	INZJPWUAFWKQEV-SOAGAIGUSA-N	438.448	1.838	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H]2CCCO2)n[nH]1	1817655971	HKCAKZAJDMPZME-URTUHSACSA-N	441.492	1.715	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc4nncn4c3)sc2C1	1819180983	PQKQMWZFXAWUNB-NEPJUHHUSA-N	434.909	1.665	50	20	IDGD	
O=C(/C=C\C(=O)NC1CC1)Nc1cc([C@H]2CCCCN2C(=O)[C@H](F)Br)[nH]n1	1819271992	MSZSBKIFCNADFO-INIQLVOJSA-N	442.289	1.927	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccnnc2O)[nH]n1)[C@H](F)Br	1820935084	IBMFDIRYUMZGTF-PWSUYJOCSA-N	427.234	1.902	50	20	IDGD	
CC(C)=NO[C@@H](C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1820968910	HXIBTQXSGDPUSD-KSSFIOAISA-N	441.297	1.196	50	20	IDGD	
C[C@H](Br)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](C)CS(C)(=O)=O)[nH]n1	1822183676	GIOPZFDJLXOLHZ-MDZLAQPJSA-N	449.371	1.866	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](C)N2CCN(C)CC2)[nH]n1	1822374640	YLGZGVCMSNDDGA-YQQAZPJKSA-N	440.976	1.292	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)C[C@](C)(O)CC(=O)O)n[nH]1	1822413553	IXZYYRONFXXLNJ-BFCNOCSMSA-N	445.314	1.801	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CN2C(=O)C=CC2=O)n[nH]1	1822530727	ZCQLXZQLEOOPLU-KPZWWZAWSA-N	442.303	1.563	50	20	IDGD	
O=C(NCCC(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H](O)CCl)CC1)c1ccc[nH]1	1825160226	YXCMTHURHOAVCD-ROUUACIJSA-N	438.956	1.354	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)c2ccccc2O)CC1	1825662681	LGAGLTVXPULZFB-OAQYLSRUSA-N	436.317	1.619	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1[nH]nc3ccncc13)CC2	1825998616	KLPWQLGQMVDHOS-KOLCDFICSA-N	434.909	1.894	50	20	IDGD	
Cc1cc(/C=C/C(=O)N[C@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)no1	1826087420	BETIYZXBWLJCAG-IYNGYCSASA-N	446.533	1.438	50	20	IDGD	
Cc1nccnc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827058306	XWROXIGRQTUTKU-FQEVSTJZSA-N	436.321	1.012	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@H]2CCCCO2)CC1	1828922105	MEXHDNBHGUEFEH-VQTJNVASSA-N	443.548	1.488	50	20	IDGD	
Cc1nc(C)c(C(=O)N2CCCC[C@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)o1	1829297652	NJSPDTUQFLEIKB-SFHVURJKSA-N	433.553	1.898	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(Cl)cnc3OC)CCO2)C1	1829586208	DLDDUYLVTGQNHX-DNVCBOLYSA-N	446.331	1.831	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cccnc3Cl)C2)C1	1830357647	CBLFEEDYKLBTKJ-FQEVSTJZSA-N	444.359	1.999	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)CC3CCOCC3)C2)C1	1830537829	PZVMETDUBISBBF-HNAYVOBHSA-N	447.370	1.291	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3CCC[C@H]3C)C2)C1	1830539420	GQDSOJUZEBQXGU-OAFZBRQQSA-N	431.371	1.910	50	20	IDGD	
COC(OC)C(=O)N1CCC(N2CCC(NC(=O)[C@H](C)CBr)CC2)CC1	1833265314	UAMUTKAFBQOOMU-CYBMUJFWSA-N	434.375	1.208	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3ccc4c[nH]nc4c3)CC2)CC1)[C@H](O)CCl	1833310670	OEJKHYBWLCSEKZ-LJQANCHMSA-N	433.940	1.348	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)[C@H]3CCNC(=O)C3)CC2)CC1	1833534537	CPMSPOJSMMQDMG-MAUKXSAKSA-N	426.989	1.492	50	20	IDGD	
Cc1nc(C(=O)NC2CCN(C3CCN(C(=O)[C@H](F)Cl)CC3)CC2)c(=O)[nH]c1C	1833938613	HEGFCJZCDSJLJG-INIZCTEOSA-N	427.908	1.106	50	20	IDGD	
Cc1ncsc1C(=O)N1CCO[C@@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1	1834268398	MTHDOQSJNCABHE-GOSISDBHSA-N	427.599	1.373	50	20	IDGD	
Cc1ocnc1C(=O)N1CCC(N2CCC(NC(=O)CCBr)CC2)CC1	1834423212	JYWWNWSBUDVZSA-UHFFFAOYSA-N	427.343	1.953	50	20	IDGD	
CC(=O)N(C)[C@@H](C)C(=O)NC1CCN(C2CCN(C(=O)C(C)(C)CCl)CC2)CC1	1835120572	AVRQVQPPWDJFBO-HNNXBMFYSA-N	429.005	1.690	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)c1cc2ccccn2n1	1835302422	SAVUQXAOFVZGPL-IBGZPJMESA-N	433.940	1.119	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3ccc4ncnn4c3)CC2)CC1	1835633173	RTIJQWHYQFOBMN-GOSISDBHSA-N	448.955	1.168	50	20	IDGD	
CCCC(=O)N[C@H](C)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](Cl)COC)CC2)CC1	1835820665	DMNSPHLQFKPUQD-QAPCUYQASA-N	445.004	1.117	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3cncnc3)CCO2)C1	1836053175	WAEIZSFFIKUBNU-RBUKOAKNSA-N	445.347	1.102	50	20	IDGD	
O=C(Cc1cccnc1Cl)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836715341	QJTQPFPBZMJNAH-QGZVFWFLSA-N	444.359	1.876	50	20	IDGD	
Cn1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)c2cccnc21	1837186473	DPSNDNBOZTYDEL-JOCHJYFZSA-N	448.951	1.908	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccn(C(F)F)n1)CCO2	1838037003	MWNHCYLMAPYZJI-GOSISDBHSA-N	446.527	1.200	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)c3ncon3)CC2)CC1	1838508177	VFWFKLJOMBNLBQ-CQSZACIVSA-N	429.315	1.855	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)C)C2)C1	1838528291	OJHWREIEKSUATD-OAQYLSRUSA-N	449.460	1.246	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3n[nH]c4ccc(C#N)cc34)C2)C1	1839147958	ICFYTHPHSQKHNE-IIBYNOLFSA-N	445.907	1.522	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)/C=C/c3ccoc3)C2)C1	1839150265	HHUNZXKDIUPCPX-KTBRJVSMSA-N	431.316	1.986	50	20	IDGD	
O=C(Cc1ccccc1F)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839199077	IJCWLLRQDWVTQO-FUHWJXTLSA-N	447.276	1.515	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccns3)C2)C1	1839962358	BRHJUYNHLYZWRB-LRDDRELGSA-N	432.340	1.387	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(F)(F)C(F)F)C2)C1	1839962921	VKEIQRABLGVZEW-HZMBPMFUSA-N	449.239	1.517	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3CC[C@H](O)CC3)C2)C1	1839966807	QKOKKFBTHYUMNM-NNFUDEMPSA-N	447.370	1.167	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C4CC4)on3)C2)C1	1840030351	JINWJOZCLHWKLX-SGTLLEGYSA-N	442.310	1.405	50	20	IDGD	
Cc1cccnc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2	1840030526	OMVMSUFEGPCGGB-KDOFPFPSSA-N	426.311	1.243	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3[C@H]4C=CS[C@@H]43)C2)C1	1840035017	DFKDVFPWJAOYQX-GMIGGYDBSA-N	431.352	1.101	50	20	IDGD	
O=C(c1ccc2nonc2c1)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840187797	XLMSMJYCICPMTO-KRWDZBQOSA-N	429.260	1.097	50	20	IDGD	
COc1cc(F)ccc1CC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1840934094	CZARCIBZXYGPRR-MJGOQNOKSA-N	432.851	1.368	50	20	IDGD	
Cc1ccc(C(=O)NCC(=O)N2CC3(CCCN3C(=O)[C@@H](C)CBr)C2)cc1	1841290000	GGFLVFGZVOZEPV-HNNXBMFYSA-N	436.350	1.959	50	20	IDGD	
O=C([C@H](F)Br)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1	1843442309	JOONEHWBZNXMDH-HNNXBMFYSA-N	437.269	1.673	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1cc(Cl)cc(Cl)n1)C2	1844264598	MLOAXUYHGUONQP-UHFFFAOYSA-N	449.298	1.518	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H]2CC[C@@H]1[C@@H](C(=O)N1CCCC13CN(C(=O)[C@H](O)CCl)C3)C2	1847095153	LYPZXMPBUVPAOW-CAOSSQGBSA-N	441.956	1.578	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](C)[C@@H]1SC(=N)NC1=O	1847498893	UCKFEALJXPEQTD-DGORSVRFSA-N	431.356	1.022	50	20	IDGD	
Cc1nccn1CC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1848098432	AQUZNXXVEMBLQI-JYJNAYRXSA-N	439.944	1.525	50	20	IDGD	
CN1CCC[C@@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C1	1848099987	WKOBRNHMCWDUCC-QZWWFDLISA-N	442.988	1.662	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)Cc1ccc(Br)cn1	1848243956	CINRIUDJRASMFE-ILXRZTDVSA-N	430.730	1.842	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)CN3C(=O)COc4ccc([N+](=O)[O-])cc43)cc2C1	24310086	SIBNWZARZOGHGD-LLVKDONJSA-N	444.469	1.968	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(C)=O	25414046	AVUATMLUCYQGOW-IBGZPJMESA-N	438.484	1.840	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN(C)CCOc2ccc(Br)cc2)n1	26478967	GHMGOOWZOJIWDX-UHFFFAOYSA-N	441.351	1.915	50	20	IDGD	
C[C@@H]1Oc2ccccc2N(CCC(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)C1=O	110551134	JECFJDKIDGMNRW-AWEZNQCLSA-N	444.513	1.775	50	20	IDGD	
O=C(CCCCCNS(=O)(=O)c1ccc2c(c1)OCCO2)NNC(=O)c1ccc[nH]1	726629763	PYVZGMABASGKNZ-UHFFFAOYSA-N	436.490	1.086	50	20	IDGD	
CSCC[C@@H](NC(=O)c1ccc2ccccc2n1)C(=O)NNC(=O)Cc1cccnc1	728892923	CUDKFDDAICZMRB-LJQANCHMSA-N	437.525	1.871	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)C1=NN(c2ccccc2)[C@@H](c2ccccc2)C1	729276043	VZCZNHUFKRNJDA-KBXCAEBGSA-N	429.502	1.079	50	20	IDGD	
CCN1CCC[C@@H]1CN1C[C@@H](C(=O)NNC(=O)c2cc3c(s2)CC[C@H](C)C3)CC1=O	729625960	FYYOQIZMEZHOPW-BHYGNILZSA-N	432.590	1.967	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NC2CCC(C(=O)OC)CC2)nc1	730130025	GXDNXULAJLMCDO-UHFFFAOYSA-N	427.527	1.470	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)[C@@H]2CCN(c3ccc4c(c3)OCCO4)C2=O)c1	730516918	PCTIOYIKRIUIHB-KRWDZBQOSA-N	441.440	1.289	50	20	IDGD	
C[C@H]1CN(Cc2ccc(CNC(=O)NNC(=O)COc3ccccc3O)cc2)C[C@@H](C)O1	730823870	ZFOYDICHKXJMIC-CALCHBBNSA-N	442.516	1.911	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)[C@H]1CC(=O)N(c2cc(OC)c(OC)c(OC)c2)C1	731491747	ULIWDKRAIBWSQD-ZDUSSCGKSA-N	443.456	1.535	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2CN1S(=O)(=O)c1ccc(F)cc1)C1CCC1	732144625	XMNQRXPZVCVUJS-LJQANCHMSA-N	431.489	1.889	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2ccc(CSc3nc[nH]n3)cc2)n1	732354226	PMWTYNCKLVRIIA-UHFFFAOYSA-N	446.514	1.409	50	20	IDGD	
O=C(NNS(=O)(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)c1c[nH]c2ccccc12	733122316	XOWIRLJVVOSWSQ-UHFFFAOYSA-N	448.526	1.576	50	20	IDGD	
O=C(CNC(=O)c1ccccc1I)NNc1nccnc1Cl	734260738	JKCUSNGMMRMNEP-UHFFFAOYSA-N	431.621	1.608	50	20	IDGD	
CC(=O)N[C@@H](C(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1)C1CCCC1	734824976	PIWOBZIMMIJJKN-MRXNPFEDSA-N	425.530	1.411	50	20	IDGD	
Cc1ccc(S(=O)(=O)n2ccc(C(=O)OCC(=O)NNC(=O)c3cccs3)c2)cc1	735538777	BXQGSKSSTISLSL-UHFFFAOYSA-N	447.494	1.713	50	20	IDGD	
CN(CCCC(=O)NNC(=O)NCCc1cccs1)C1=NS(=O)(=O)c2ccccc21	742053309	HGWWTPUOERAVQL-UHFFFAOYSA-N	449.558	1.482	50	20	IDGD	
CCn1c(NNC(=O)CCCC[C@@H]2SC[C@H]3NC(=O)N[C@@H]32)nc2ccccc2c1=O	742275989	SYLVOAXHRQWFLC-VYDXJSESSA-N	430.534	1.585	50	20	IDGD	
O=C(NNC(=O)c1nc2ncc(Br)cn2n1)c1cccc(Br)c1	742772206	SHRIQUQUDODYPY-UHFFFAOYSA-N	440.055	1.724	50	20	IDGD	
O=C(NNc1ccc(Cl)nc1)c1ccc2c(c1)S(=O)(=O)N(C[C@@H]1CCCO1)C2=O	743816962	OKAKGUTYKUHQBY-ZDUSSCGKSA-N	436.877	1.815	50	20	IDGD	
O=C(NNC(=O)c1cc(S(=O)(=O)N2CCCC2)ccc1O)c1ccc(Cl)cc1O	745989272	OTWRNQRTPXKFFT-UHFFFAOYSA-N	439.877	1.611	50	20	IDGD	
O=C(NNC(=O)N1CCOCC1)c1ccc(NS(=O)(=O)c2ccc(F)c(F)c2)cc1	745993158	YXYQXKZSQBBCBP-UHFFFAOYSA-N	440.428	1.452	50	20	IDGD	
COc1sc(/C=C(/C#N)C(=O)c2c(N)n(C)c(=O)n(C)c2=O)cc1Br	746520130	KFZSWKUFOHBPRQ-DAXSKMNVSA-N	425.264	1.289	50	20	IDGD	
COc1ccc(CSCC(=O)NNC(=O)Cc2cn3ccccc3n2)cc1[N+](=O)[O-]	746552957	AXOLYBSYNBLVAB-UHFFFAOYSA-N	429.458	1.874	50	20	IDGD	
CN(CCCOc1cccc(S(C)(=O)=O)c1)CC(=O)NNC(=O)c1ccc(F)cc1	747088473	ITUMJNSPAZWIRH-UHFFFAOYSA-N	437.493	1.391	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@@H]2C(=O)NNC(=O)Cc2ccncc2)cc1	747318647	BYJVEYXMXXMHLY-LJQANCHMSA-N	444.513	1.218	50	20	IDGD	
Cc1c(CC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cccc1[N+](=O)[O-]	747726410	DRORLZIKNJBFSB-UHFFFAOYSA-N	446.485	1.691	50	20	IDGD	
Cn1ncc2cc(C(=O)NNc3ccc(S(=O)(=O)Nc4nccs4)cc3)cnc21	747944643	UQSYJPAVYNIGFX-UHFFFAOYSA-N	429.487	1.983	50	20	IDGD	
NS(=O)(=O)c1ccc(OCCSCC(=O)NNc2cccc([N+](=O)[O-])c2)cc1	748001700	DRTJDLFNRVBIFY-UHFFFAOYSA-N	426.476	1.498	50	20	IDGD	
Cc1nn(C)c(C)c1S(=O)(=O)N[C@H](C)C(=O)NNc1ccc(F)cc1Br	748074527	CSFUVBWVOSTGBZ-SECBINFHSA-N	448.318	1.749	50	20	IDGD	
O=C(O)COc1ccc(Br)cc1C=NNC(=O)CNC(=O)c1cccs1	750943998	PREXDIDMDIBUKV-UHFFFAOYSA-N	440.275	1.854	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)c1ccc(I)cc1	751215614	RQPHHMNUBLGHPV-UHFFFAOYSA-N	429.239	1.544	50	20	IDGD	
COc1ccc(N2CCN(CC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)CC2)cc1F	753861547	RUOFZAYPMLZXMM-UHFFFAOYSA-N	431.424	1.326	50	20	IDGD	
O=C(NNC(=O)c1cccc(Br)c1)NC1CCN(S(=O)(=O)C2CC2)CC1	753920083	ZCALABVTDXJXEX-UHFFFAOYSA-N	445.339	1.350	50	20	IDGD	
O=C(Cc1cc[nH]n1)NNC(=O)C1(NS(=O)(=O)c2ccc(Cl)cc2)CCCCC1	755282079	MOXXENISHALVAA-UHFFFAOYSA-N	439.925	1.434	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@@H](C)[C@@H](C)NC(=O)OC(C)(C)C)c2ccccc2c1=O	755312487	LAPXXSLIFZHJLA-QWHCGFSZSA-N	431.493	1.727	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)Nc1ccc(NC(=O)C2CC2)cc1C(F)(F)F	755591823	DPWSQWITPUFVPD-SNVBAGLBSA-N	448.423	1.641	50	20	IDGD	
Cn1c(=O)c2cc(NC(=O)NNC(=O)CCSc3ccc(F)cc3)cnc2n(C)c1=O	755845440	CVZYYQBJRSHBHZ-UHFFFAOYSA-N	446.464	1.106	50	20	IDGD	
COC(=O)c1nscc1S(=O)(=O)NNC(=O)c1sc(-c2ccccc2)nc1C	755954681	DKKFNLUNPLYYPT-UHFFFAOYSA-N	438.512	1.985	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccn(Cc3ccccc3)n2)c1	756076060	HNIIEAACRKRZRH-UHFFFAOYSA-N	442.501	1.648	50	20	IDGD	
NS(=O)(=O)c1cccc(NC(=O)NNC(=O)c2cc(F)ccc2Br)c1	756510638	RCMRVFHWMJUFAA-UHFFFAOYSA-N	431.243	1.702	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NC(=O)NNC(=O)c1ccc2c(c1)OCO2	756523821	FUMGZPSQKZPWAE-UHFFFAOYSA-N	434.474	1.959	50	20	IDGD	
CCC(CC)NC(=O)[C@H]1CN(CC(=O)NNC(=O)c2cccc(C#N)c2)c2ccccc2O1	756590881	RFUXXMUGFDEIFX-OAQYLSRUSA-N	449.511	1.892	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccn(Cc3ccncc3)n2)c1	756651595	WXQHAPJXDNWXME-UHFFFAOYSA-N	443.489	1.043	50	20	IDGD	
C[C@H]1CN(C(=O)Cn2cc(NC(=O)NNC(=O)c3cc4ccccc4o3)cn2)C[C@@H](C)O1	756839013	PABMUGPSDXIPES-OKILXGFUSA-N	440.460	1.732	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)c2cccc(I)c2O)c1	757736527	ILCKUTMWTOJXSH-UHFFFAOYSA-N	441.225	1.879	50	20	IDGD	
CCOCCS(=O)(=O)NCC(=O)NNC(=O)c1cc2c(s1)CC[C@H](C(C)(C)C)C2	758156738	CLKJOPLUCRGYDA-AWEZNQCLSA-N	445.607	1.616	50	20	IDGD	
CCS(=O)(=O)CCN(C)C(=O)NNC(=O)[C@H](C)Oc1cccc(Br)c1	758653554	LIUUWEVTHBCNQM-NSHDSACASA-N	436.328	1.324	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)NNC(=O)C(=O)Nc2ccccn2)c(C)n1C[C@@H]1CCCO1	758822269	PDFFMZPJNLHQKR-PNDHZVEESA-N	436.472	1.372	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)CNS(=O)(=O)c2cccc(C(F)(F)F)c2)nc1	759734435	GLXRGSCUOMUPPU-UHFFFAOYSA-N	432.380	1.309	50	20	IDGD	
O=C(NN=Cc1cccc(-n2cccn2)c1)c1cccc(S(=O)(=O)N2CCOCC2)c1	760216178	OLOAEZASDWBFBH-UHFFFAOYSA-N	439.497	1.657	50	20	IDGD	
O=C(NNC(=O)c1cc(F)c(F)cc1I)C(=O)Nc1ccccn1	760754024	ZHJXVMUILYNBJB-UHFFFAOYSA-N	446.151	1.364	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)C(=O)Nc1ccc(OC(F)F)c2ncccc12	763551297	LTZXFFBCVYCARO-UHFFFAOYSA-N	444.350	1.965	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(N3CCOCC3)nc2C)c2ccccc2n1	763615386	FDCWXGNAVOXWSC-UHFFFAOYSA-N	448.483	1.483	50	20	IDGD	
CCOC(=O)c1c(F)cccc1NC(=O)C(=O)NNC(=O)COc1ccc(Cl)cc1	763695946	ZIEJMDYQTVQXOU-UHFFFAOYSA-N	437.811	1.821	50	20	IDGD	
Cc1cc(C)c(NC(=O)C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c(Cl)c1	763790494	JDVOJBBAGSDJPJ-UHFFFAOYSA-N	427.848	1.603	50	20	IDGD	
Cc1cscc1NC(=O)C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	763797668	YXKSUCGROIBPIX-UHFFFAOYSA-N	436.515	1.241	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccc([S@](=O)C(F)(F)F)cc1	763838884	WEJZMVRJTHXJHY-PMERELPUSA-N	447.366	1.618	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1cccc(NC(=O)C2CC2)c1	763849000	GVFYWCFOICGEED-LBPRGKRZSA-N	428.420	1.728	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccsc2C(=O)OC)cc1OC	763911306	KFJIECZJEQQTPJ-UHFFFAOYSA-N	435.458	1.732	50	20	IDGD	
O=C(NNC(=O)c1cc(Cl)ccc1O)C(=O)Nc1ccn(CCc2ccncc2)n1	763974118	KYXAJFASYNNBPK-UHFFFAOYSA-N	428.836	1.280	50	20	IDGD	
Cn1ccnc1-c1cccc(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)c1	763995141	NAFVWANYZRJAOM-UHFFFAOYSA-N	431.250	1.577	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)C(=O)Nc1ccc(-c2csnn2)cc1	763997408	KYLOOKAEERJNLY-UHFFFAOYSA-N	435.263	1.695	50	20	IDGD	
CN(C)C(=O)COc1ccc(NC(=O)C(=O)NNC(=O)Cc2cccc3ccccc23)cc1	764019558	PJYSATPRFSQPMZ-UHFFFAOYSA-N	448.479	1.635	50	20	IDGD	
O=C(NNC(=O)C1CCCC1)C(=O)N1C[C@H](C(=O)N2CCCCC2)Oc2ccccc21	764066666	QUAFUZITLYZBRI-GOSISDBHSA-N	428.489	1.131	50	20	IDGD	
Cc1c(CS(C)(=O)=O)cccc1NC(=O)C(=O)NNC(=O)CCCc1ccccc1	764223658	HFGOYOBASPLAKB-UHFFFAOYSA-N	431.514	1.648	50	20	IDGD	
Cc1cn(-c2ccc(C#N)cn2)nc1NC(=O)C(=O)NNC(=O)CCCc1cccs1	764342151	BIKKNSBTVHAFAM-UHFFFAOYSA-N	437.485	1.618	50	20	IDGD	
COc1cc(OC)c(OC)cc1NC(=O)C(=O)NNC(=O)C(F)(F)Oc1ccccc1	764380388	YWBSWWHCNVIXGC-UHFFFAOYSA-N	439.371	1.470	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1nc(-c2nccn2C)cs1	764394315	ZCSSSZQDRKEJBP-UHFFFAOYSA-N	446.514	1.430	50	20	IDGD	
O=C(CCCOc1ccc2c(c1)OCO2)NNC(=O)c1csc(N2CCOCC2)n1	764558482	HXEAHMJPIMTXJH-UHFFFAOYSA-N	434.474	1.329	50	20	IDGD	
COC(=O)[C@H](NNC(=O)C1CCN(c2ncccn2)CC1)c1cc(OC)cc(OC)c1	764627758	HADJWSHJUACBQF-GOSISDBHSA-N	429.477	1.245	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNS(=O)(=O)c3ccc(C)cc3F)CC2)cc1	765125417	DPVYBOMTUNIANI-UHFFFAOYSA-N	434.537	1.570	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3ccc(Cn4cncn4)cc3)n[nH]2)cc1OC	765596945	OZMFYNBSDPVTIN-UHFFFAOYSA-N	447.455	1.809	50	20	IDGD	
COc1cc(C#N)ccc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccccc2OC)[nH]n1	766259626	BEUOWRGDTVBVGF-UHFFFAOYSA-N	434.412	1.365	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@H]3Oc4ccccc4O[C@H]3C)CC2)cc1	766647454	FEXLABPPGKKDKT-MBSDFSHPSA-N	438.528	1.489	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cnn(C(C)(C)C)c3C)CC2)cc1	766647895	GFLQESXUZLDQCX-UHFFFAOYSA-N	426.565	1.834	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CSc1nnc(CN2CCCC2=O)o1	767091626	QJXSAIFEUZJADB-UHFFFAOYSA-N	439.881	1.407	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CNC(C)(C)C(=O)NCC2CCCCC2)cc1OC	767672284	GNAOWYMHAQOGJI-UHFFFAOYSA-N	434.537	1.530	50	20	IDGD	
CN(C)C(=O)c1cc(F)ccc1NC(=O)C(=O)NNC(=O)Cn1ccc2ccccc21	768238810	FSASAUASSQUSAX-UHFFFAOYSA-N	425.420	1.268	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc([N+](=O)[O-])ccc1Br)c1ccc([N+](=O)[O-])cc1	768496467	KQYKDSGOKDMEDW-UHFFFAOYSA-N	445.207	1.889	50	20	IDGD	
COc1ccc(C(C)(C)C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)cc1	769104814	IPRKVDFFQBUYLV-UHFFFAOYSA-N	447.561	1.447	50	20	IDGD	
CN(C)C(=O)COc1ccc(C(F)(F)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1	769353643	HPJHZPHFNJXAQC-KRWDZBQOSA-N	449.410	1.233	50	20	IDGD	
O=C(CN1CCC(CO)(Cc2ccccc2)CC1)NNC(=O)c1ccc([N+](=O)[O-])cc1	769999838	ISPBXQAIACTDGV-UHFFFAOYSA-N	426.473	1.673	50	20	IDGD	
COC(=O)N1CC(NC(=O)NNC(=O)c2cc3c(C)nn(-c4ccccc4)c3s2)C1	770427568	INYQZXRONOBSKM-UHFFFAOYSA-N	428.474	1.790	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)c1cccnc1I	770466094	HYEKSZIIIUNYOX-LBPRGKRZSA-N	425.182	1.287	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)c3ccc(S(=O)(=O)N4CCCCCC4)cc3)nc21	770979185	DQYGEAYGAGUUGV-UHFFFAOYSA-N	445.505	1.391	50	20	IDGD	
O=C(CSCC(=O)N1CCOCC1)NNC(=S)Nc1cccc(Br)c1	770993897	OZYRPOHIMPNSPX-UHFFFAOYSA-N	447.380	1.359	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NCc2nc(COc3ccccc3)n[nH]2)cc1	771374651	AKLXEZIGDOQOLB-UHFFFAOYSA-N	426.433	1.302	50	20	IDGD	
CC[C@H](C)NS(=O)(=O)Cc1cccc(NC(=O)C(=O)NNc2cccc(C#N)c2)c1	773686345	VCSFRRHFNCCGTM-AWEZNQCLSA-N	429.502	1.858	50	20	IDGD	
C[C@H]1C[C@H](C)CN(S(=O)(=O)c2ccc(NC(=O)C(=O)NNc3ncccn3)cc2)C1	773723635	CIIDYTKXTQVYQV-KBPBESRZSA-N	432.506	1.225	50	20	IDGD	
CC(C)(C)c1ccc(OCC(=O)NNC(=O)Nc2ccnn2[C@@H]2CCS(=O)(=O)C2)cc1	776053467	CTJKKCSETVFOAO-OAHLLOKOSA-N	449.533	1.772	50	20	IDGD	
COCCOc1cc(C(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)ccn1	776213114	NJHNRBGRJJCKRA-UHFFFAOYSA-N	437.497	1.356	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NC2CCN(S(=O)(=O)CC(C)C)CC2)cc1OC	776884791	PRRFVFBSIDLNDR-UHFFFAOYSA-N	442.538	1.098	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cnn([C@@H](C)C3CC3)c2)cc1	778707855	QIKRBGQSSBIUDK-JSGCOSHPSA-N	427.461	1.610	50	20	IDGD	
C[C@H](NC(=O)CC(C)(C)C)C(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	779414623	SWVALHURSIPCGG-AWEZNQCLSA-N	427.546	1.563	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)[C@H](O)[C@@H](O)c2nc3ccccc3s2)cc1OC	779473181	KENAYQOKRZQAOG-IAGOWNOFSA-N	431.470	1.559	50	20	IDGD	
O=C(NNC(=O)c1noc2c1CCCCC2)c1cccc(S(=O)(=O)N2CCCC2)c1	780155103	SRVFUBXUCRKYSS-UHFFFAOYSA-N	432.502	1.803	50	20	IDGD	
O=C(NN=c1cc[nH]cc1)c1ccc(NS(=O)(=O)c2ccc3c(c2)OCCO3)cc1	780760946	GAVVWXNGESGTPZ-UHFFFAOYSA-N	426.454	1.832	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)CCNS(=O)(=O)c2ccc(OC)c(OC)c2)c1	780793156	YTVYKOFXBJFKLM-UHFFFAOYSA-N	437.474	1.302	50	20	IDGD	
COC(=O)[C@H]1[C@@H](O)CCCN1C(=O)CCC(=O)C(C#N)=C1N(C)c2ccccc2N1C	781456708	ILARKDYXBOBLQC-AZUAARDMSA-N	426.473	1.182	50	20	IDGD	
O=C(COC(=O)c1ccc(OC2CCCC2)nc1)NNC(=O)[C@@H]1COc2ccccc2O1	781769497	VPDHTTWEYHNKHV-SFHVURJKSA-N	441.440	1.547	50	20	IDGD	
CC(=O)N1CCN(c2cccc(NC(=O)C(=O)NNC(=O)c3cc4ccccc4o3)c2)CC1	782118756	ZZSMNXFLLUYHDK-UHFFFAOYSA-N	449.467	1.501	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(OC)c(NC(=O)C(=O)NNc2ccccc2F)c1	782707189	JECMHWZGNGMRIP-UHFFFAOYSA-N	438.481	1.947	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)nc2ccccc21	782893108	HVCYNLDEURBJDV-UHFFFAOYSA-N	444.373	1.792	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN[C@H](CC)c2cccc(S(N)(=O)=O)c2)cc1C	782987051	GZAIQTHWIOMGRT-OAHLLOKOSA-N	438.575	1.768	50	20	IDGD	
CCN1CCc2ccc(NC(=O)C(=O)NNc3ccc(S(=O)(=O)NC(C)C)cn3)cc21	783264365	NODZEYZZYZVXQK-UHFFFAOYSA-N	446.533	1.233	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccccc2OC(C)C)nc1	783264393	OSHDOFGOOGRODA-UHFFFAOYSA-N	435.506	1.637	50	20	IDGD	
COc1ccc(S(=O)(=O)NC2CC2)cc1NC(=O)C(=O)NNc1ccc(Cl)cc1	783337718	GDIAMZUAKSYTNS-UHFFFAOYSA-N	438.893	1.871	50	20	IDGD	
Cn1c(=NNC(=O)C(=O)Nc2ccc3c(c2)C(=O)N(CC2CC2)C3=O)sc2ccccc21	783352004	SHNLILNMPVUOMS-UHFFFAOYSA-N	449.492	1.816	50	20	IDGD	
CCN(c1ccccc1)S(=O)(=O)c1ccc(NC(=O)C(=O)NN=c2cc[nH]cc2)cc1	783378283	BXWDDBSIYKDAMK-UHFFFAOYSA-N	439.497	1.801	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1ccc(OC2CCCCC2)cc1	784003277	CVMHOHIXYWZFPX-UHFFFAOYSA-N	444.513	1.976	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)C3CN(C(=O)OC(C)(C)C)C3)n[nH]2)cc1OC	784683593	GEOPRIHWKOULAH-UHFFFAOYSA-N	445.476	1.722	50	20	IDGD	
Cc1nn(C(C)(C)C)cc1C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	784684954	VFXZFOWLUKXSJM-UHFFFAOYSA-N	426.521	1.166	50	20	IDGD	
COC(=O)[C@@H]1CN(C(=O)C(=O)NNc2ccc(Br)nc2)c2ccccc2O1	784806289	DXTDSNMFFSXQNV-ZDUSSCGKSA-N	435.234	1.254	50	20	IDGD	
CC(C)Cc1cc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)n(C)n1	784835417	OOFRYAJYWZODCN-UHFFFAOYSA-N	429.449	1.697	50	20	IDGD	
Cc1cccc(Cn2nccc2NC(=O)C(=O)NNc2cccc(S(C)(=O)=O)c2)c1	784839341	KHDDEDLQAWXYTP-UHFFFAOYSA-N	427.486	1.725	50	20	IDGD	
O=C(NNc1ncc(F)cn1)C(=O)Nc1ccnn1Cc1cccc(Br)c1	784950156	NEJFABKWHZGATH-UHFFFAOYSA-N	434.229	1.705	50	20	IDGD	
Cc1ccc(-n2nc(C(C)(C)C)cc2NC(=O)C(=O)NNc2nccn(C)c2=O)c(C)c1	785090748	XZDPBZHQZMXRTJ-UHFFFAOYSA-N	437.504	1.962	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1cccc(OC(F)F)c1	785330141	FEVXMRMKYMIPKE-UHFFFAOYSA-N	429.401	1.782	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CCc2ccco2)cc1C(=O)N1CCCCC1	787542298	JFWMFQGCKJXHMM-UHFFFAOYSA-N	426.473	1.933	50	20	IDGD	
Cn1ccc2cccc(NC(=O)C(=O)NNC(=O)CCN3CCN(c4ccccc4)CC3)c21	788331065	PHBMCOGNKNKRDV-UHFFFAOYSA-N	448.527	1.477	50	20	IDGD	
Cc1cc(F)cc(-n2cc(C(=O)NNC(=O)c3csc(N4CCOCC4)n3)nn2)c1	788733961	CZPAGDDNKHHOSF-UHFFFAOYSA-N	431.453	1.083	50	20	IDGD	
CCCc1csc(NC(=O)C(=O)NNC(=O)c2nn(CC)c(=O)c3ccccc23)n1	789731984	JKNHGCOYAMOOCG-UHFFFAOYSA-N	428.474	1.225	50	20	IDGD	
CC(C)Oc1cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)ccc1C(N)=O	789740353	FRLVVUVBKSELLS-GFCCVEGCSA-N	446.435	1.265	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1cccc2c1OCC[C@@H]2N(C)C	789740866	JWJMVQCQQBGDPR-ACJLOTCBSA-N	444.463	1.764	50	20	IDGD	
CN(C)[C@H]1CCOc2c(NC(=O)C(=O)NNC(=O)Cc3cn4ccccc4n3)cccc21	789767551	BDMBOBVHJNCIOB-KRWDZBQOSA-N	436.472	1.048	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H]2CC(c3cccnc3)=NO2)c1	790104315	RTOKVZKDVTYEHK-GOSISDBHSA-N	445.501	1.066	50	20	IDGD	
CN(NC(=O)Cn1ccc2ccccc2c1=O)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	790930943	RWPAXGHMVTZKPJ-UHFFFAOYSA-N	443.504	1.637	50	20	IDGD	
CN(CCC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)C1CCCCC1	791124783	VLXGDZBHGNWRKI-UHFFFAOYSA-N	436.578	1.887	50	20	IDGD	
Cc1cccnc1NNC(=O)[C@H](NS(=O)(=O)c1ccc2c(c1)OCCCO2)C(C)C	791216041	YZKQLOBSCYGOIE-GOSISDBHSA-N	434.518	1.998	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)CN2CCOc3c(Br)cccc3C2)cc1	791562100	AGJIUXAWBICKIO-UHFFFAOYSA-N	429.274	1.976	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNS(=O)(=O)c3ccc(S(C)(=O)=O)nc3)cc2C1	794576209	HBJKUZCRNPRIFR-JTQLQIEISA-N	429.545	1.295	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C[C@H](c1ccccc1)N1CCOC1=O	795181092	IUGVMMHPQNJEGF-QGZVFWFLSA-N	432.502	1.964	50	20	IDGD	
Cn1ncc2c1C[C@@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)N3CCCCC3)c1)CC2	798823320	KLOFDRWLKXGUIY-INIZCTEOSA-N	445.545	1.161	50	20	IDGD	
COc1ccccc1-n1ncc(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)c1C	798833651	KHOLVYXPXJAGHO-UHFFFAOYSA-N	442.501	1.557	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNS(=O)(=O)c1cc(Cl)cc(C(N)=O)c1	799123576	CEWXQLFBRLBKNH-VIFPVBQESA-N	432.285	1.869	50	20	IDGD	
Cc1cc(O[C@@H]2CCN(C)C2=O)ccc1NC(=O)NNC(=O)COc1ccccc1O	799240554	JMKLABJEILVPMA-GOSISDBHSA-N	428.445	1.542	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(O[C@H]3CCN(C)C3=O)cc2C)cc1F	799259556	BWHZKJGTWQVRIA-SFHVURJKSA-N	442.447	1.452	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)Nc2ccccc2)cc1S(=O)(=O)N1CCOCC1	801986435	LVEMMBMZYWJGCN-UHFFFAOYSA-N	432.502	1.736	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCCC[C@@H]2C)cc1C(=O)NNC(=O)N=c1cc[nH]cc1	802034201	DKQCXOTZJJULSK-HNNXBMFYSA-N	431.518	1.842	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)[C@H]2CS[C@H](Cc3ccccc3F)C(=O)N2)cc1	802061513	XRNSOZPPIAJVPO-IAGOWNOFSA-N	432.477	1.830	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)C[C@@H]2COCCN2C(=O)OC(C)(C)C)c1	803946800	FYUOHEWZJFPWDF-MRXNPFEDSA-N	435.477	1.325	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)N2CCC[C@H](CN(C)S(C)(=O)=O)C2)c1C	804184829	FSBNAXQSXCAQKX-BDBXIWDTSA-N	436.578	1.788	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(NC(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)ccc1F	806542647	WIKBAEHOSPWEST-UHFFFAOYSA-N	446.464	1.933	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)Nc2ccc(F)c(S(=O)(=O)N(C)C)c2)c1	806543032	HBYBXFBRHPJGMG-UHFFFAOYSA-N	438.481	1.925	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)Nc2ccc(F)c(N3CCCNC3=O)c2)cc1	806807908	XUDIEIGVBRXGSH-UHFFFAOYSA-N	431.424	1.986	50	20	IDGD	
COC(=O)c1cc(C)c(NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)c(Cl)c1	806977379	GQCCFFCBGISWES-OAHLLOKOSA-N	431.832	1.525	50	20	IDGD	
COc1ccc(CNC(=O)NNC(=O)c2cccc(OC(F)F)c2)cc1S(N)(=O)=O	808264600	IFHWBEIFRVDCJW-UHFFFAOYSA-N	444.416	1.088	50	20	IDGD	
CCOC(=O)N1CCC(NC(=O)COC(=O)/C(C#N)=C\c2cc(C#N)n(C)c2C)CC1	809302914	DSHRNYLOLODFDO-SXGWCWSVSA-N	427.461	1.392	50	20	IDGD	
CC1(C)CCCc2sc(NC(=O)C(=O)NNC(=O)COc3ccccc3[N+](=O)[O-])nc21	810385857	CKGUBRICKZAYMG-UHFFFAOYSA-N	447.473	1.830	50	20	IDGD	
CC(C)Nc1ccc(S(=O)(=O)NCC(=O)NNc2ncccc2F)cc1[N+](=O)[O-]	811522168	DBRLXKCCZRLSRX-UHFFFAOYSA-N	426.430	1.371	50	20	IDGD	
COC[C@@]1(CNC(=O)NNC(=O)CSc2ccccc2O)OCCc2ccccc21	811919856	CETXWPYJVXGAQW-OAQYLSRUSA-N	431.514	1.929	50	20	IDGD	
CN(C)CCCOc1cnccc1CNC(=O)NNC(=O)Cc1nc2ccccc2n1C	812401315	XSFFDFYJOPHHHK-UHFFFAOYSA-N	439.520	1.372	50	20	IDGD	
CC/C=C(/C)C(=O)N1CSC[C@@H]1C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	812730384	GUUFDZPMKIOLJZ-ORDXOSSNSA-N	426.564	1.638	50	20	IDGD	
Cc1cc(N2C[C@H](C(=O)NNc3ccc(S(=O)(=O)N(C)C)cc3)CC2=O)ccc1F	812731627	ONHRKGRGYRSTSR-CQSZACIVSA-N	434.493	1.881	50	20	IDGD	
CN(C)Cc1ccc(C(N)=O)cc1NC(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	812948451	QLNMGGQMQAHSDA-UHFFFAOYSA-N	434.522	1.246	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NCc2cccc(N3CCOCC3)c2)cc1	814466206	PIJMSPWVIJDHFA-UHFFFAOYSA-N	447.517	1.463	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2cccc(N3CCOCC3)c2)c1	814467976	TZSQJSGWPTUQJF-UHFFFAOYSA-N	432.502	1.071	50	20	IDGD	
COC(=O)c1cc(C)ccc1NC(=O)C(=O)NNc1ccccc1S(=O)(=O)N(C)C	815751276	VSJIAEOGTBEKTO-UHFFFAOYSA-N	434.474	1.114	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNc2ncncc2F)sc2c1CCCS2	815764638	OOUHNLVZWGIUQE-UHFFFAOYSA-N	425.467	1.974	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)c1cccc(N2C(=O)CCC2=O)c1	871046376	XYIZNNHCSFVSTI-UHFFFAOYSA-N	446.257	1.943	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccc(Cl)cc2)CC1)NNC(=O)c1ccc([N+](=O)[O-])cc1	897624737	WRYLJIROOLUICC-UHFFFAOYSA-N	445.863	1.467	50	20	IDGD	
Cc1nn(C)c(C)c1C(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	900863027	MPVYRNKPJKCUKP-UHFFFAOYSA-N	430.472	1.814	50	20	IDGD	
Nn1c(SCC(=O)OCC(=O)NNC(=O)c2ccccc2)nnc1C1CCCCC1	913240051	QKYDXGBSWLMOSL-UHFFFAOYSA-N	432.506	1.136	50	20	IDGD	
CCS(=O)(=O)N1CCC(NC(=O)NNC(=O)c2ccc(Br)s2)CC1	914598932	CCOVUWKSTZUJBD-UHFFFAOYSA-N	439.357	1.269	50	20	IDGD	
Cc1noc(CCCC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)n1	915618279	FAGOMVLVZWBABO-UHFFFAOYSA-N	435.506	1.337	50	20	IDGD	
Cc1cc(C)cc(C(=O)N2CCC[C@@H](C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)C2)c1	916144675	ILSXVVGOHGSTMF-GOSISDBHSA-N	447.499	1.593	50	20	IDGD	
COc1cccc(CCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1	916382006	FXQXHSYTMRRNPZ-UHFFFAOYSA-N	446.529	1.666	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)NCc2ccnc(N3CCN(C)CC3)c2)cc1OC	916390141	LVWIDYFAOWBYLE-UHFFFAOYSA-N	442.520	1.385	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCCNc1ccc(C#N)cn1	916520400	HSIXOMPGVFJBJR-GFCCVEGCSA-N	447.293	1.926	50	20	IDGD	
Nc1cc(C(F)(F)F)ccc1C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	916539935	BTBZSRVKPYAYLH-HNNXBMFYSA-N	439.346	1.432	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)N1CCc2sccc2C1	916620268	XJYIWEKXPXQNHE-CYBMUJFWSA-N	426.506	1.115	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NCC[C@@H]3C[C@H]4CC[C@H]3C4)nc2)CC1	916648566	VNSCWILSTCYRNO-YESZJQIVSA-N	436.582	1.470	50	20	IDGD	
O=C(CN1CCN(C(=O)c2cccc(C(F)(F)F)c2)CC1)NNC(=O)c1ccccc1	917124327	KQYHKKFIMZGHRD-UHFFFAOYSA-N	434.418	1.924	50	20	IDGD	
O=C(COC(=O)Cc1csc(NC(=O)c2ccco2)n1)NNC(=O)c1cccs1	917348920	RUQHIFYUWSHPSC-UHFFFAOYSA-N	434.455	1.597	50	20	IDGD	
Cc1noc(C)c1CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	920279320	SWTMOAXAOWEHCZ-UHFFFAOYSA-N	435.506	1.610	50	20	IDGD	
O=C(CCNS(=O)(=O)c1cccc([N+](=O)[O-])c1)NNC(=O)Cc1c[nH]c2ccccc12	920340899	XMQIADKVJZLIEV-UHFFFAOYSA-N	445.457	1.135	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)Nc2ccnn2C[C@@H]2CCOC2)n[nH]1	1255199470	LXRZFDPDXTXGTL-ZDUSSCGKSA-N	425.449	1.785	50	20	IDGD	
Cc1ccc(NC(=O)N(C)C)c(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1	1318858699	WZURRVMWEFWDOS-UHFFFAOYSA-N	425.493	1.556	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)NCc2nccc(C(F)F)n2)CC1	1323220792	ZBMBNBONTCLQSS-UHFFFAOYSA-N	428.440	1.892	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2cccc(OC(F)F)c2)cc1	1343517407	CKHLSIDOMDWPMD-UHFFFAOYSA-N	443.428	1.426	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)COc1ccc(OCc2ccccc2)cc1)c1nnnn1C	1346640533	OYPYCECLNYCMAS-CQSZACIVSA-N	425.449	1.260	50	20	IDGD	
CC(C)CNC(=O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)CBr)C2	1778111775	CXEFYAIVJGOLBS-SPYBWZPUSA-N	446.386	1.304	50	20	IDGD	
O=C(c1n[nH]c2ccccc12)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1778520751	XPPNBZGKICTISJ-YOEHRIQHSA-N	425.258	1.697	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3nc(OC)ccc3[N+](=O)[O-])CCO2)C1	1781218567	NUFNNZGKVJLUEG-SGTLLEGYSA-N	426.857	1.459	50	20	IDGD	
CCc1[nH]nc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)c1Cl	1781330862	IHBXHHFKOLOSCL-DOMZBBRYSA-N	437.697	1.760	50	20	IDGD	
C[C@H](CC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2)Oc1ccccc1	1781602426	WPIGHJBNSRSKNO-WGQQHEPDSA-N	438.952	1.958	50	20	IDGD	
O=C(c1cccc(C(F)(F)F)c1F)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1781624018	HUCWGAOJYBXDPE-DYVFJYSZSA-N	438.805	1.888	50	20	IDGD	
Cn1nc2c(c1C(=O)N1CC[C@]3(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO3)CCC2	1782439740	JXPKCLWNDQLYIT-MOPGFXCFSA-N	429.348	1.589	50	20	IDGD	
C/C=C(\C)C(=O)N1CC[C@@]2(C1)CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)CCO2	1783070907	SHVDXZSQTZAMIB-UQTPNQFZSA-N	431.445	1.930	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)CSc3ccncc3)CCO2)C1	1783529524	LPMGLEVVIFQMLZ-CXAGYDPISA-N	428.352	1.787	50	20	IDGD	
CC(C)(C)OC(=O)CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21	1784781097	NDWWENXAPADSKX-ASHKBJFXSA-N	437.306	1.388	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@](C)(O)C(F)(F)F)[C@H]2C1	1784872401	UMHTTWWRYSVMKK-JLPNCARGSA-N	445.276	1.310	50	20	IDGD	
Cc1cc(F)c(C(=O)N2CC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)cc1F	1785067604	ZJPWWKNGYQKYMQ-OAQYLSRUSA-N	438.475	1.090	50	20	IDGD	
C[C@H](Nc1nccs1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCBr)[C@H]2C1	1786405824	CZKBEQKYIIJJJR-XUXIUFHCSA-N	445.383	1.708	50	20	IDGD	
O=C(COCc1ccccc1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21	1786712014	YNHCXZRORWRVGR-NBOOPKSLSA-N	443.313	1.873	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C=C/C(=O)NCc3ccco3)[C@H]2C1	1788718402	BCLYINIEMNLCKA-VWCDTKFZSA-N	437.924	1.449	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc4c3OCCO4)C[C@@H]21	1788762689	MMFRDHJHUVFBRA-IEZWGBDMSA-N	448.592	1.903	50	20	IDGD	
COc1nc(C)ccc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21	1789018296	PRFRENHVTPBPMS-CYUUQNCZSA-N	444.301	1.682	50	20	IDGD	
CC(C)(C)n1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]32)nn1	1789356572	WMIYWNZCEBUOMU-NGOJXBLDSA-N	446.379	1.863	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCNC(=O)OC(C)(C)C)C[C@@H]21	1789864150	LRNAQNNYMRXBEQ-JONQDZQNSA-N	431.961	1.898	50	20	IDGD	
C[C@H]1CCc2c(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]4C3)n[nH]c21	1789925697	HLXSQHJHCPLKSH-UQMYLEDRSA-N	443.317	1.743	50	20	IDGD	
CCOc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]3C2)nn1	1791058675	BBNJWLSKXJVECF-OSFYFWSMSA-N	441.326	1.252	50	20	IDGD	
CN(CC(=O)Nc1ccc(C2(NC(=O)[C@](C)(Cl)CCl)CCC2)cc1)C(=O)C(=O)O	1791098456	OUQQGGGRPXOCLC-GOSISDBHSA-N	444.315	1.900	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1ccccc1C1CC1	1791905601	AEMSAXXWLANBEI-TZYHBYERSA-N	448.328	1.151	50	20	IDGD	
CN1Cc2ccccc2C[C@@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2	1793830465	DHGGTSSGFJYGQI-YYIAUSFCSA-N	426.344	1.436	50	20	IDGD	
Cn1c(=O)n(C)c2cc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)CCBr)ccc21	1795492371	MDCIFFVBLCKNRH-QDMKHBRRSA-N	449.349	1.914	50	20	IDGD	
CN1CCc2cc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)CO[Si](C)(C)C)C4)ccc21	1797017877	HETXYMUZIXOSRN-RMFSNUHRSA-N	431.609	1.734	50	20	IDGD	
Cn1ncc2c(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)CCBr)C4)cccc21	1797086844	RAXGUKBELWTVKN-IVWMJMPLSA-N	435.322	1.562	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CC12CCCN1CCC2	1799214637	LWRDQNJXOCUDDP-HIRMHNASSA-N	432.392	1.831	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c(c1)NC(=O)[C@@H](C)O3)C2	1799268650	BHMWAVBFDWIDBW-BWOYXGKQSA-N	435.908	1.627	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(Cl)nc1F)C2)[C@H](F)Br	1799344950	ZQYXBYLIJZDCCS-VVJJBPBLSA-N	438.656	1.768	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cccc(F)c1F)C2	1800762696	YYFWVXFONGWIRG-MMPOEDRJSA-N	431.277	1.880	50	20	IDGD	
CCn1nc(C(C)C)cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](Cl)COC	1800979253	YGOLBFHBKYTZRK-BASYENTBSA-N	426.945	1.483	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnc2ccc(F)cn12	1801113709	MLHSQFSLAFXYGE-MUJYYYPQSA-N	430.484	1.098	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cn1cccc([N+](=O)[O-])c1=O)[C@H](F)Br	1801358399	WLQRDSQDTSUNLD-MIJXAVMKSA-N	445.245	1.085	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cc(F)ccc1[N+](=O)[O-]	1802093694	FNISKCRSWLZVGD-HRJSJKBJSA-N	427.860	1.883	50	20	IDGD	
COc1cc(F)cc(/C=C/C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CCC(=O)NN(C)C)C3)c1	1802113357	YSGZTBBSCISFCR-BAKRUHSUSA-N	446.523	1.859	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H](CNC(=O)c2cc(O)ncn2)[C@H]1c1cccnc1	1803736761	JZFTVPBTKWGRBT-SUYBPPKGSA-N	448.321	1.928	50	20	IDGD	
Cc1oncc1C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1805803288	DMAJWWWEZUESSB-OXJNMPFZSA-N	428.493	1.071	50	20	IDGD	
COc1cnc(C(=O)NC[C@@H]2CCN(C(=O)CCBr)[C@@H]2c2cccnc2)cn1	1806038601	IYJPHKLWNCOSFN-KBXCAEBGSA-N	448.321	1.985	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)CS(C)(=O)=O)[C@@H]1c1cccnc1	1806772968	WUJZCKSPCAUQKL-DZKIICNBSA-N	446.367	1.306	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)cn1C	1807363426	ORHCMRPGPVDDOX-KNQAVFIVSA-N	446.316	1.042	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)CSc2ncccn2)[C@@H]1c1cccnc1	1807576504	NXCFCFWDDPFJKV-BQFCYCMXSA-N	449.964	1.924	50	20	IDGD	
Cc1ccn2ncc(C(=O)NC[C@@H]3CCN(C(=O)[C@@H](O)CCl)[C@@H]3c3cccnc3)c2c1	1808157756	BWPZTPCORMMHOB-FFZOFVMBSA-N	441.919	1.957	50	20	IDGD	
Cn1nc(C(=O)N2CC[C@H](CNC(=O)[C@H](F)Br)[C@H]2c2cccnc2)cc1O	1808651206	KHUDPXZYQOATQW-DFBGVHRSSA-N	440.273	1.531	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@H](CNC(=O)CCc2nc(N)n[nH]2)[C@@H]1c1cccnc1	1810153047	VDVWYOLMOAFYAY-KXBFYZLASA-N	445.600	1.272	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@H]1CCN(C(=O)c2c[nH]c(=O)cn2)[C@@H]1c1cccnc1	1810544404	MDJSXRUCGFQCAB-DNVCBOLYSA-N	429.553	1.336	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)c1cc2cccnn2c1	1812187123	MMJBGEXKRVDNNJ-SNRMKQJTSA-N	427.892	1.649	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2ccnc(F)c2)[C@@H]1c1cccnc1	1813069213	WDZBSUVIDHOZBE-DYESRHJHSA-N	442.495	1.308	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)C#Cc3ccccc3)sc2C1	1814021669	LJXNGEOKDCICLQ-INIZCTEOSA-N	439.541	1.480	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC[C@@H]1c1cc(NC(=O)C23CC(F)(C2)C3)n[nH]1	1815285355	DPFHFNOWDHRPFR-YMTQGWHGSA-N	426.257	1.288	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccc(=O)n2O)n[nH]1	1816148897	JLRLRMUIMXINHC-CMPLNLGQSA-N	438.282	1.898	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cncnc2)n[nH]1	1816508013	GHUKOCRUKHIOTA-FCLYZYNOSA-N	449.475	1.640	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3nc4ccccn4n3)sc2C1	1816659301	AYKAYJFCKPAPRY-QWRGUYRKSA-N	434.909	1.665	50	20	IDGD	
COc1ccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)cn1	1817474743	YQPXLMCWKFZHDN-GOSISDBHSA-N	449.276	1.113	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](O)CCl)CC2)c1ccc2nc(CO)[nH]c2c1	1818150027	FAGJUSAJLMYTIQ-HZMBPMFUSA-N	449.920	1.337	50	20	IDGD	
N#Cc1c[nH]c(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cnccc3C(=O)NN)n[nH]2)c1	1819403337	FNZBEJNXVRSOID-QGZVFWFLSA-N	447.459	1.228	50	20	IDGD	
COc1cc(C(=O)N[C@@H]2CCc3nc(NC(=O)CO[Si](C)(C)C)sc3C2)nn1C	1820166962	RRRFUFGLZFRHBF-LLVKDONJSA-N	437.598	1.963	50	20	IDGD	
COc1cccc(OC)c1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)CCl)CC2	1821941731	UGUKLEUKXYFERP-PWSUYJOCSA-N	439.921	1.986	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)C2CCC(CO)CC2)[nH]n1	1822410295	DIPXNLRXKKVBOE-LEOMRAHMSA-N	448.568	1.574	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)C(C)(C)NCCC#N)[nH]n1	1822414234	NIQIGAKTSNRWLM-INIZCTEOSA-N	446.556	1.057	50	20	IDGD	
Cc1cnn(CC(=O)N[C@H]2CCc3nc(NC(=O)[C@H](F)Br)sc3C2)c1	1823005186	XRDCANLIDKKMCO-ZANVPECISA-N	430.303	1.951	50	20	IDGD	
O=C(Cn1cc([N+](=O)[O-])cn1)N1CCC([C@@H]2CCCCN2C(=O)[C@H](O)CCl)CC1	1824179421	RLITUYLCGMBACD-JKSUJKDBSA-N	427.889	1.011	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)C1=NNC(=O)C1)CC2	1825445844	JOFAJRDXMXLIIE-SFYZADRCSA-N	428.312	1.105	50	20	IDGD	
O=C(Cc1ccc2c(c1)CCO2)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](O)CCl)CC2	1825528899	JPIMJMDGHUNGFS-UKRRQHHQSA-N	435.933	1.832	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)Cc1cnn(C)c1)CC2	1825646875	FMTPICPOORFFNV-ONGXEEELSA-N	426.340	1.815	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1c(F)c(C)nn1C)CC2	1825993577	KUIDAHLNKIRURF-VHSXEESVSA-N	429.905	1.804	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)COC(=O)C(F)(F)F)CC2	1826000126	LWEKCLMJYRMBEG-HTQZYQBOSA-N	443.831	1.414	50	20	IDGD	
O=C(C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1)c1ccccc1	1827054536	FIUYYAXSBBCTHR-QFIPXVFZSA-N	448.328	1.483	50	20	IDGD	
CCOCCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1)CC2	1827131800	PFPGIIDYBKBTPW-XIXVAHAYSA-N	446.533	1.616	50	20	IDGD	
O=C1NCCCn2nc(C(=O)N3CCC([C@H]4CCCCN4C(=O)[C@H](F)Cl)CC3)cc21	1827610003	ZXWNTEYQFSAAKF-WBVHZDCISA-N	439.919	1.784	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H](C)Cn2cncn2)CC1	1829056988	DUVSZJZPFXEDKG-NJAFHUGGSA-N	425.961	1.788	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(=O)n2O)CC1	1831829086	XYFMVTZJFHFFAI-HZPDHXFCSA-N	425.913	1.573	50	20	IDGD	
Cc1nc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)CCBr)C3)C2)cs1	1832967410	UWLXDJFHYRAVNO-QGZVFWFLSA-N	446.367	1.235	50	20	IDGD	
CC1(C(=O)NC2CCN(C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)CCCC1	1833124752	HACMDDXOHOJWIG-UHFFFAOYSA-N	441.381	1.132	50	20	IDGD	
C[C@H](Cn1cccn1)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1	1833200511	BWYHYIRKDVFMES-ATZDWAIDSA-N	447.363	1.212	50	20	IDGD	
Cc1noc(C)c1CC(=O)N1CCC(N2CCC(NC(=O)[C@H](O)CCl)CC2)CC1	1833308104	IOHYDXACYOWWQL-GOSISDBHSA-N	426.945	1.005	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)CC34CCCN3CCC4)CC2)CC1)[C@@H](O)CCl	1833313240	BQFOAIIHCAOROD-IBGZPJMESA-N	441.016	1.176	50	20	IDGD	
CCn1ccc(C(=O)NC2CCN(C3CCN(C(=O)[C@H](F)Br)CC3)CC2)n1	1834274104	WAQUAUWHFLKGME-INIZCTEOSA-N	444.349	1.779	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H]3Cc4ccccc4CN3)CC2)CC1)[C@@H](F)Cl	1835079761	QCOZWCFJYVHDPG-VQTJNVASSA-N	436.959	1.807	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(C=O)s3)CCO2)C1	1835947706	OSZCMRSAZLDBKS-SJKOYZFVSA-N	445.335	1.414	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H]3Cc4ccccc4O3)CCO2)C1	1836644840	UTYAPQWGMFMRFA-AVRDEDQJSA-N	436.936	1.712	50	20	IDGD	
Cn1ncnc1C(=O)N1CCC(OC2CCN(C(=O)[C@](C)(Cl)CCl)CC2)CC1	1837371543	FIUQTYPCMBGUBN-GOSISDBHSA-N	432.352	1.664	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CCC=CO1)CCO2	1837406188	HFXPIAUSCNEAIX-VKJFTORMSA-N	431.327	1.167	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccn(C(F)F)n3)CCO2)C1	1838034303	XCRSCPOIIQGORI-UGSOOPFHSA-N	434.871	1.756	50	20	IDGD	
CC(C)n1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)CCBr)C3)C2)n1	1838783561	DXTBIZRLXMJNAL-SFHVURJKSA-N	443.342	1.319	50	20	IDGD	
CCSc1cccnc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1838847260	TXXRYGRKVYJBKK-YJBOKZPZSA-N	431.917	1.798	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccnc(OC)c3F)C2)C1	1839144372	WOHLTTSJQGBMEW-AUUYWEPGSA-N	429.876	1.317	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(O)c(OC)c3)C2)C1	1839146734	UNIUKQXNGNKHAY-QRWLVFNGSA-N	426.897	1.488	50	20	IDGD	
Cc1ncc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)cn1	1839151365	PDMIHQOMVGGIAM-QZTJIDSGSA-N	431.320	1.091	50	20	IDGD	
Cc1ccn2c(C(=O)N3CCO[C@@]4(COCCN(C(=O)C(Cl)Cl)C4)C3)cnc2c1	1839602766	YCSNTXWNMFXXDS-IBGZPJMESA-N	441.315	1.516	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CCCSC3)C2)C1	1839967699	VACDJHICUOUTIU-VKJFTORMSA-N	449.411	1.760	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccc4c(c3)CCO4)CCO2)C1	1839998856	PTGGLUONYINFGI-PGRDOPGGSA-N	436.936	1.638	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)ccc1F	1840035005	CXDZVQHWAYRAAD-KUHUBIRLSA-N	443.313	1.988	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)COC3CCCCC3)C2)C1	1840149571	SWONRQIJRRGPCE-FXAWDEMLSA-N	432.945	1.046	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3c[nH]c(C(C)(C)C)c3)C2)C1	1840151083	VXOLVQJYXLPYLZ-KKSFZXQISA-N	441.956	1.636	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccccc3OC)C2)C1	1840153710	ACUWHRCZQUKOOT-JXFKEZNVSA-N	426.897	1.019	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C)ccc3O)C2)C1	1840154295	RITSLCYELFYYFS-OXQOHEQNSA-N	426.897	1.024	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2cncc(N(C)C)c2)C1	1842173282	RMXQLJZZNCNYFO-MFKUBSTISA-N	437.504	1.099	50	20	IDGD	
O=C(CC[C@H]1CNc2ccccc2C1)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843013301	FARJDHWYRONTKE-GOSISDBHSA-N	447.344	1.248	50	20	IDGD	
COc1cccc(CC(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)c1C	1846226263	MDFLOTCECPBJPE-UHFFFAOYSA-N	437.500	1.062	50	20	IDGD	
O=C1C[C@@H](C(=O)N2CCCC23CN(C(=O)[C@@H](Br)Cc2ccccc2)C3)CCN1	1846424581	ROZXXNHBJIMMND-IRXDYDNUSA-N	448.361	1.722	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2c(C)nn(C)c2Cl)c1	14234807	JGKHYZLMGJASLC-UHFFFAOYSA-N	427.914	1.487	50	20	IDGD	
COc1ccc(Cl)cc1N1C[C@H](C(=O)NNC(=O)Cn2cnc3ccccc32)CC1=O	17403764	UZQQZIDGMZJYCT-CYBMUJFWSA-N	441.875	1.899	50	20	IDGD	
CC(=O)N1CCN(c2ccc(C(=O)NNC(=O)c3ccccc3O)cc2[N+](=O)[O-])CC1	17575112	XHFWICBDQKYVBJ-UHFFFAOYSA-N	427.417	1.044	50	20	IDGD	
COc1ccc(-n2ccnc2SCC(=O)NNC(=O)CNC(=O)c2ccco2)cc1	725739553	ITUKHNQNABPOOS-UHFFFAOYSA-N	429.458	1.143	50	20	IDGD	
O=C(NNc1nc(-c2ccncc2)no1)c1ccc(F)c(S(=O)(=O)N2CCCC2)c1	726370266	VRPICHOZPQMMPL-UHFFFAOYSA-N	432.437	1.812	50	20	IDGD	
CS(=O)(=O)c1ccc(OCCC(=O)NNC(=O)c2cccc(OC(F)F)c2)cc1	728486269	SJWCHVDQATXZSE-UHFFFAOYSA-N	428.413	1.922	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)Cc2c(C)nn(-c3nc(C)cc(C)n3)c2C)cn1	729692447	UPUMVAVFZMIABM-UHFFFAOYSA-N	440.533	1.860	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)c2cc(S(=O)(=O)N3CCC[C@H](C)C3)cn2C)c1	730206715	ZWKGCKADCRSOEW-INIZCTEOSA-N	448.545	1.594	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)nc1	730768550	BIBXRUOJECGGTR-UHFFFAOYSA-N	435.465	1.507	50	20	IDGD	
Cc1c(C(=O)NNC(=O)Cc2c[nH]c3ccccc23)nnn1-c1ccc2c(c1)OCCO2	731453208	GQECTVPKNHIFFU-UHFFFAOYSA-N	432.440	1.832	50	20	IDGD	
C[C@H](NC(=O)CCC(=O)NNC(=O)c1ccc[nH]1)C(=O)c1ccc(Br)cc1	732053010	WACRPQZXKXMZQM-NSHDSACASA-N	435.278	1.706	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)[C@@H]2CCCN(C(=O)c3ccc(F)cc3)C2)C[C@@H](C)O1	732264803	XAICHVKMPJODRM-JFIYKMOQSA-N	434.512	1.325	50	20	IDGD	
CCc1cc(N2CCC[C@@H](NC(=O)NNC(=O)c3ccc4c(c3)OCCO4)C2)ncn1	732913876	GIMJIZBHNXYHDX-MRXNPFEDSA-N	426.477	1.423	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)NNC(=O)c1ccc(S(=O)(=O)N2CCOCC2)o1	733003604	VCQNZNGGGQMVJQ-UHFFFAOYSA-N	442.881	1.098	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCCN(C(=O)OC(C)(C)C)CC2)cc1OC	733198023	WSBDFNXOYBVTNO-UHFFFAOYSA-N	436.509	1.408	50	20	IDGD	
C[C@H]1CC(C)(C)C[C@]2(C1)NC(=O)N(CC(=O)NNc1nc3ccccc3c(=O)n1C)C2=O	733262377	SWKACRATDXCVKS-XMHCIUCPSA-N	440.504	1.513	50	20	IDGD	
CC(C)CNS(=O)(=O)c1ccc(Br)c(C(=O)NNc2cnccn2)c1	734244479	JHTIPMHEHLOHAP-UHFFFAOYSA-N	428.312	1.930	50	20	IDGD	
N#Cc1ccc(OCc2cccc(C(=O)NNC(=O)N[C@@H]3CCS(=O)(=O)C3)c2)cc1	734428584	UZVVTLQBSQZVNE-QGZVFWFLSA-N	428.470	1.268	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNS(=O)(=O)c1cccc2cccnc12	734740472	PSFXLZHFPGXJKJ-UHFFFAOYSA-N	433.515	1.460	50	20	IDGD	
CC[C@@H]1CCCCN1CCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	737066965	NOQJESYAWBFPAR-MRXNPFEDSA-N	425.555	1.145	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)N2CCN(CC[S@](C)=O)CC2)c(C)n1C[C@@H]1CCCO1	741297477	SUNSCSHTZGDNFF-WQMLQWSUSA-N	432.590	1.714	50	20	IDGD	
C[C@H]1CCC[C@@H](C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)C1	741513866	DDCRZPVBGVAXRF-FUHWJXTLSA-N	437.562	1.614	50	20	IDGD	
O=C(NNC(=O)N[C@H]1CCS(=O)(=O)C1)Nc1ccc(Br)cc1Cl	742710495	GNGPVNPJLWVTFY-QMMMGPOBSA-N	425.692	1.625	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCCc2ccccc2Cl)cc1	743348128	CBOMXTCSVBJJQS-UHFFFAOYSA-N	438.937	1.842	50	20	IDGD	
COc1ccccc1O[C@H](C)CNC(=O)NNC(=O)c1csc(N2CCOCC2)n1	743509863	MFOMXHFNRUDHMQ-CYBMUJFWSA-N	435.506	1.400	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN(C(=O)c2ccncc2)C1)c1cc(Br)ccc1O	743730103	MSMZGEGRICLKKB-ZDUSSCGKSA-N	447.289	1.863	50	20	IDGD	
CN(C)C(=O)NNC(=O)c1cc(S(=O)(=O)NCc2ccccn2)c(Cl)cc1Cl	747167395	BMEWPCMOHKGEIW-UHFFFAOYSA-N	446.316	1.783	50	20	IDGD	
N#Cc1ccc(NNC(=O)CCN2CCN(C(=O)[C@@H]3CCCO3)CC2)cc1C(F)(F)F	748628571	DSCKLFCEICFCKE-KRWDZBQOSA-N	439.438	1.733	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)N[C@@H](c1ccccc1)c1cccc(S(C)(=O)=O)c1	748636069	IRJGDBOEFPCBNP-KXBFYZLASA-N	449.529	1.561	50	20	IDGD	
CC(C)CCn1ncc(NC(=O)C(=O)NNC(=O)CNC(=O)c2cccs2)c1C(C)C	753853909	XCPXYICZBDSTKN-UHFFFAOYSA-N	448.549	1.630	50	20	IDGD	
Cc1oc(S(N)(=O)=O)cc1C(=O)NNC(=O)COc1ccccc1-c1ccccc1	754193982	XPCJLGFXRSFAIH-UHFFFAOYSA-N	429.454	1.742	50	20	IDGD	
C[C@H](C=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O)Cc1ccc(C(C)(C)C)cc1	754714520	UPABEXLUXIAXBO-AWEZNQCLSA-N	431.562	1.849	50	20	IDGD	
C[C@@H]1C[C@@H](C)CN(C(=O)c2ccccc2NC(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)C1	755669448	ZVTKZSSBCBNGIZ-RBSFLKMASA-N	436.534	1.392	50	20	IDGD	
COC(=O)CNC(=O)Cc1ccc(NC(=O)NNC(=O)c2ccc(Cl)cc2F)cc1	755863673	SHGWNVVJTVXEQF-UHFFFAOYSA-N	436.827	1.777	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@@H]2C)ccc1NC(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O	756246154	SWLXHSCUXRSLCP-UONOGXRCSA-N	439.538	1.100	50	20	IDGD	
COC(=O)CCCc1nnc(NC(=O)NNC(=O)c2nnc(O)c3ccccc23)s1	756683245	HBOVUPUMEFNVGU-UHFFFAOYSA-N	431.434	1.149	50	20	IDGD	
NC(=O)c1ccc(NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c(F)c1	756820846	MLGMCHNDEHUOBC-UHFFFAOYSA-N	428.468	1.290	50	20	IDGD	
CCOc1cc(C(=O)N(C)C)ccc1NC(=O)NNC(=O)COc1ccccc1[N+](=O)[O-]	756868207	IMEXLGUIZVOGPJ-UHFFFAOYSA-N	445.432	1.927	50	20	IDGD	
CCc1c(C(=O)NNc2ccc(C(N)=O)nn2)cnn1-c1ccc(Br)cc1	757402109	ZPIFIXBEPRPIGW-UHFFFAOYSA-N	430.266	1.843	50	20	IDGD	
O=C(NC[C@H](O)c1cc2ccccc2s1)NNC(=O)c1csc(N2CCOCC2)n1	757723686	UOADOGRXNSNECH-AWEZNQCLSA-N	447.542	1.872	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)N[C@H]2CCN(c3ncccc3Cl)C2)cc1C	757761563	FSAQRSXBTNBJCK-HNNXBMFYSA-N	430.896	1.900	50	20	IDGD	
CNC(=O)Cn1nc(NC(=O)NNC(=O)c2ccc(Br)cc2Cl)cc1C	757823591	RZWSHYMCYDTACM-UHFFFAOYSA-N	443.689	1.820	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1cc(COc2c(Cl)cccc2Cl)on1	758380771	ORSXWOMJJWSAFP-SECBINFHSA-N	448.284	1.756	50	20	IDGD	
Cc1ccc(C(=O)N2CCN(S(=O)(=O)CBr)CC2)c(Br)n1	758518149	PDBBHMVRRIQDBI-UHFFFAOYSA-N	441.145	1.593	50	20	IDGD	
C[C@H]1CCCCN1CCOc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccccn1	758829421	DKQYSGVWHZRBLM-INIZCTEOSA-N	425.489	1.735	50	20	IDGD	
CC1(C)C(=O)N(C[C@](C)(O)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c2ccccc21	760036318	GENNVHGNPPSPAR-NRFANRHFSA-N	426.429	1.431	50	20	IDGD	
CCC(=O)c1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1	760223831	IIUXIPONQKRTBE-UHFFFAOYSA-N	445.497	1.375	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)c1ccc(I)c(O)c1	760823606	JDZMHAYKFQKGKS-UHFFFAOYSA-N	440.193	1.843	50	20	IDGD	
O=Cc1ccc(OCCn2cc(C(=O)NNC(=O)NCc3ccco3)nn2)c(Cl)c1	763299586	DVOVRGRUGRXOAZ-UHFFFAOYSA-N	432.824	1.560	50	20	IDGD	
Cc1c(C(=O)O)cc(Cl)cc1S(=O)(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	763419562	CXJZFIDRVYVASH-UHFFFAOYSA-N	446.890	1.373	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1ccccc1OCC(F)(F)F	763472565	YKHJXIZWDAREKG-UHFFFAOYSA-N	426.307	1.936	50	20	IDGD	
O=C(NNC(=O)c1ccccc1O)C(=O)Nc1ccnn1Cc1cnn(-c2ccccc2)c1	763528714	SACAVQOKWVHQKR-UHFFFAOYSA-N	445.439	1.222	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)C(=O)Nc2cncc(C)c2)cc(OCC)c1OCC	763541931	CBNVTCSLDVLYGU-UHFFFAOYSA-N	430.461	1.986	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccn([C@@H](C)c3ccccc3)n2)cc1OC	763544271	UKHQBQYXKBEJCT-AWEZNQCLSA-N	437.456	1.909	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cc(Br)ccc2F)cc1	763660611	CZOVIXHVFPHWFD-UHFFFAOYSA-N	440.225	1.762	50	20	IDGD	
Cc1cc(Br)ncc1NC(=O)C(=O)NNC(=O)COc1ccc(C#N)cc1	763681532	VJDKTOQCOHGTLX-UHFFFAOYSA-N	432.234	1.189	50	20	IDGD	
Cc1ccc(Cn2nccc2NC(=O)C(=O)NNC(=O)c2cccc(N(C)C)c2)s1	763759743	YUDGSRGPKDTUPZ-UHFFFAOYSA-N	426.502	1.767	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2ccc(-n3cncn3)c(Cl)c2)c1	763775221	PGVBZSLDAWNARP-UHFFFAOYSA-N	444.835	1.338	50	20	IDGD	
CNC(=O)Cn1ccc2ccc(NC(=O)C(=O)NNC(=O)c3cc4c(s3)CCC4)cc21	763784099	UUXFLRYDVHAPIJ-UHFFFAOYSA-N	439.497	1.337	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)C(=O)Nc2ccc(-c3ccc[nH]3)cc2)c2ccccc2c1=O	763789695	AFNAENUTXVPQDJ-UHFFFAOYSA-N	430.424	1.328	50	20	IDGD	
CCN(CC)C(=O)c1ccccc1NC(=O)C(=O)NNC(=O)COc1ccc(F)cc1	763840002	OMFBCEWWEZGFAL-UHFFFAOYSA-N	430.436	1.473	50	20	IDGD	
Cc1ccc(-n2cc(C)cn2)c(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)c1	763841537	SKJFFILFXJGWBI-UHFFFAOYSA-N	425.420	1.793	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccc(N2CCOC[C@H]2C)cc1	763865177	JEEMDTLHRPVGET-CABCVRRESA-N	444.463	1.604	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)cc1S(C)(=O)=O	763873547	VNWNBONHPVUGAK-LBPRGKRZSA-N	437.449	1.091	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1cc(F)cc(N2CCOCC2)c1	763873899	XWGKIKNDPYJXLD-CYBMUJFWSA-N	448.426	1.355	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccccc2O[C@@H](C)C#N)cc1	763876535	GRFWFMSXFQLCAX-ZFWWWQNUSA-N	438.440	1.733	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)C(=O)Nc1cc(C)n(CCC#N)n1	763901338	OEVIPSLABJQEOZ-UHFFFAOYSA-N	437.485	1.937	50	20	IDGD	
COC(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)c1	764004253	NXUNRDCYOPMSKG-UHFFFAOYSA-N	433.804	1.298	50	20	IDGD	
O=C(NNC(=O)c1cccc(C(F)(F)F)c1)C(=O)Nc1ccnn1Cc1ccccn1	764040176	GKIOAULHLYIYML-UHFFFAOYSA-N	432.362	1.745	50	20	IDGD	
CCN(CC)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)Cc2ccccc2OC)cc1	764132452	OGPNQUPVBDRCOR-UHFFFAOYSA-N	426.473	1.506	50	20	IDGD	
O=C(CCc1ccco1)NNC(=O)C(=O)Nc1ccc(=O)n(Cc2ccccc2Cl)c1	764170098	UKOLOPDYUVVQAV-UHFFFAOYSA-N	442.859	1.862	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(N3CCNC3=O)ccc2Cl)cc1	764181286	APDZGWHIDWFGJL-UHFFFAOYSA-N	426.820	1.141	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)C(=O)Nc1ccn(-c2ccccc2)n1	764204713	SMXSAOIATURNSO-UHFFFAOYSA-N	430.465	1.263	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)CCCc2ccccc2)ccc1N1C(=O)CCC1=O	764223689	IXELYEKLRICHSQ-UHFFFAOYSA-N	436.468	1.757	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)c(Br)n1	764241572	AYNZDHUDRIXLHP-UHFFFAOYSA-N	430.262	1.893	50	20	IDGD	
COc1ccc(Cn2nccc2NC(=O)C(=O)NNC(=O)Cc2ccccc2F)cc1	764319519	LORAPYZTKBKTNB-UHFFFAOYSA-N	425.420	1.408	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)Cc2ccncc2)sc2c1CCSC2	764355104	ZMUWXARUHZDDQI-UHFFFAOYSA-N	448.526	1.438	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(Sc2ncccn2)cc1C	764398397	GZDOATVCBDFHLA-ZDUSSCGKSA-N	433.490	1.074	50	20	IDGD	
COc1ccc(C=NNC(=O)CN2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)cc1F	764819077	OOKKFXOZQIMKAT-UHFFFAOYSA-N	448.520	1.599	50	20	IDGD	
C[C@@]1(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)CCc2ccccc2C1	766635528	AIUPYEDEJOBWFF-RUZDIDTESA-N	434.540	1.787	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@@H](C)c3c(C)nn(C)c3C)CC2)cc1	766648291	JGVGYUWQEQWSIQ-KRWDZBQOSA-N	426.565	1.414	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)c1cccc2[nH]ncc12	766659904	IKVIZWLZUXMZLA-UHFFFAOYSA-N	426.908	1.795	50	20	IDGD	
CC(C)NC(=O)CCCC(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	766664847	WBYJPMVVTQCRMN-UHFFFAOYSA-N	437.972	1.300	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)[C@@H]1Cc2ccccc2O1	766664904	XFTXXASOGCDIKZ-FQEVSTJZSA-N	428.920	1.609	50	20	IDGD	
CCN1CCN(c2cccc(NC(=O)C(=O)NNC(=O)c3cc4c(s3)CCC4)c2)CC1	770775239	YEQFFPKXZXTOLS-UHFFFAOYSA-N	441.557	1.778	50	20	IDGD	
COc1ccccc1[C@@H](NC(=O)OC(C)(C)C)C(=O)NNc1nc(O)c2cnn(C)c2n1	770979510	GCYVSZXQZWSAOF-CQSZACIVSA-N	443.464	1.787	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc(F)ccc1Br)[C@H]1COc2ccccc2O1	771897389	DVYXYZFLIOKMFA-CYBMUJFWSA-N	431.239	1.738	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNc3nccnc3C(C)C)CC2)cc1	772889765	FEVDSMGWPPJSCI-UHFFFAOYSA-N	432.550	1.358	50	20	IDGD	
COc1ccc(CN(C)C)cc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1cccc(Cl)c1	774007348	GFQPXZRUYNBMNP-CYBMUJFWSA-N	448.907	1.964	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cccc(Br)n2)cc1	775604968	STQYYYSQULXZJV-UHFFFAOYSA-N	441.307	1.234	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCc1ccnc(N(C)C)n1	775715612	HPBPOFQERJSDKI-NSHDSACASA-N	437.298	1.603	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1Cl	777401797	AIQDCAHFEGQPMD-UHFFFAOYSA-N	448.888	1.307	50	20	IDGD	
O=C1CCc2cc(NC(=O)C(=O)NNC(=O)c3cc(-c4ccccc4)[nH]n3)c(F)cc2N1	778706203	OKUDJAXBEJWBMF-UHFFFAOYSA-N	436.403	1.500	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)CCN2C(=O)COC)c1ccccc1	778715374	VOSIYBIWASUBLK-SFHVURJKSA-N	438.484	1.502	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C(=O)Nc2csc(-c3ccccn3)n2)nc2ccccc21	782894683	SDWUKEUCWFOTOW-UHFFFAOYSA-N	435.469	1.420	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2cccc(-n3cccn3)c2)nc1	783264947	UKUZZAJTTASYMP-UHFFFAOYSA-N	443.489	1.036	50	20	IDGD	
CCn1nc(C)c(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)c1C	783408677	MLVDVQLMTCWUHG-UHFFFAOYSA-N	433.412	1.895	50	20	IDGD	
Cc1ccc(NC(=O)c2ccccc2)cc1NC(=O)C(=O)NN[C@]1(C)CCS(=O)(=O)C1	783427149	QDADRKLEFCHPFP-OAQYLSRUSA-N	444.513	1.384	50	20	IDGD	
Cc1ccc(C)c(-n2ncc(NC(=O)C(=O)NNc3ccc(-n4cccn4)nn3)c2C)c1	783436652	LSJHYBHHWOAPIG-UHFFFAOYSA-N	431.460	1.855	50	20	IDGD	
Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)C(=O)NNC(=O)C(=O)N1CCCC1	783999812	KLSOPXXGXPMLFL-UHFFFAOYSA-N	435.440	1.367	50	20	IDGD	
CCCC(=O)Nc1ccc(Cl)c(NC(=O)C(=O)NNC(=O)CNC(=O)c2ccco2)c1	784002856	VBTTXRAFMBSPFC-UHFFFAOYSA-N	449.851	1.188	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1ccc(CC(F)(F)F)cc1	784003718	MUPGQMSNTWYLDQ-UHFFFAOYSA-N	428.392	1.369	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)N1CC2(CCCC2)c2c(F)cccc21	784004557	HFQYWXCTRKBGMB-UHFFFAOYSA-N	444.488	1.623	50	20	IDGD	
O=C(NNc1ccccn1)C(=O)Nc1ccc(CN2CCN(c3ccccn3)CC2)cc1	784796255	IZROVWNBDBWEFR-UHFFFAOYSA-N	431.500	1.881	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)C(=O)Nc1ccc(F)cc1OCC(F)F	785061202	ULLXQWDQWPOEPG-UHFFFAOYSA-N	435.362	1.446	50	20	IDGD	
O=C(NNC(=O)N1CCC[C@@H](Oc2ncccc2F)C1)C1CCN(c2ncccn2)CC1	787858190	QEDPFLRLPQMUMO-MRXNPFEDSA-N	443.483	1.511	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2ccc(C(=O)NNC(=O)N3CCN(C)CC3)cc2)cc1	788166334	LOJZZEOSLDKXSH-UHFFFAOYSA-N	431.518	1.398	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2nc(Br)cs2)c1	788619821	SVEKLCCCXTVILA-UHFFFAOYSA-N	433.309	1.231	50	20	IDGD	
CC[C@H](C)n1ncc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)c1C	792282846	WXEPBRZZWZOUQU-LBPRGKRZSA-N	437.526	1.326	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1cc(Cl)cc(C(=O)N(C)C)c1OC	793025721	LVZVEVKHYKGQDQ-UHFFFAOYSA-N	448.863	1.459	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NNC(=O)CNC(=O)OCc2ccccc2)C1	794062090	SYGMVRDEKXDAFS-MRXNPFEDSA-N	434.493	1.707	50	20	IDGD	
CC(C)(C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1)c1cc(F)cc(C#N)c1	794780059	JFTPASVDEXCZOI-UHFFFAOYSA-N	438.868	1.737	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccoc1)c1cccc(S(=O)(=O)NCc2ccccc2)c1	795281199	TVOUZGHAEQMHCB-UHFFFAOYSA-N	435.483	1.381	50	20	IDGD	
CN1C(=O)COc2cc(NC(=O)C(=O)NNC(=O)Cc3ccc4ccccc4c3)ccc21	799259311	XYEPMSRWCFPWOP-UHFFFAOYSA-N	432.436	1.524	50	20	IDGD	
COc1cccc(/C=C(/C(=O)NNC(=O)Nc2ccc(N(C)C)cc2)n2nnnc2C)c1	802119398	ILPQGZORHCWROR-UYRXBGFRSA-N	436.476	1.907	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)CN2C(=O)c3cccc([N+](=O)[O-])c3C2=O)cc1	802122854	DLOIGPQQNBMVCG-UHFFFAOYSA-N	426.389	1.110	50	20	IDGD	
CCS(=O)(=O)CCn1cc(C)c(NC(=O)NNc2cc(Cl)nc(COC)n2)n1	806479322	LHUXAHQNWZLXQE-UHFFFAOYSA-N	431.906	1.365	50	20	IDGD	
CNS(=O)(=O)c1cc(NC(=O)C(=O)NNc2ccccc2C(F)(F)F)ccc1F	806967830	PQZNKCDZDFGTBO-UHFFFAOYSA-N	434.371	1.834	50	20	IDGD	
Cc1c(C(F)(F)F)nn(C)c1NC(=O)C(=O)NNC(=O)c1cc(-c2ccccc2)[nH]n1	806973608	SXBZVXDVTOXJDE-UHFFFAOYSA-N	435.366	1.537	50	20	IDGD	
CCOCC(=O)NNC(=O)C(=O)Nc1nc(Cc2ccccc2Br)cs1	806980078	NPPPYLHZLJFGLM-UHFFFAOYSA-N	441.307	1.619	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1ccc(Oc2cccnc2)cc1	808937827	DSKVFXLDISCXFO-UHFFFAOYSA-N	439.453	1.451	50	20	IDGD	
Cc1ncc2n1CC[C@@H](C(=O)NNC(=O)c1ccc(CSc3nncn3C)cc1)C2	810021908	RFZOZKKGTRLUPC-MRXNPFEDSA-N	425.518	1.636	50	20	IDGD	
COC(=O)c1c(F)ccc(NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)c1F	810386534	FPROWZLLJMBLDB-UHFFFAOYSA-N	430.367	1.492	50	20	IDGD	
NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)CCC2CCCCC2)c(OCC(F)F)c1	810386937	XYXMAQWUAOETKX-UHFFFAOYSA-N	440.447	1.876	50	20	IDGD	
COC[C@]1(C(=O)OCC(=O)NNC(=O)c2cccs2)CCN(C(=O)OC(C)(C)C)C1	811399824	QQUPXEYPKGAAAO-IBGZPJMESA-N	441.506	1.326	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)C[C@H]1CCCS(=O)(=O)C1	814739419	OJBHBEYYYOOANS-VXGBXAGGSA-N	433.324	1.579	50	20	IDGD	
CS(=O)(=O)CCOc1ccc(Cl)cc1NC(=O)C(=O)NNc1cccc(Cl)n1	815727434	YDJXZAVUVJOOFI-UHFFFAOYSA-N	447.300	1.894	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)N(C)C)n(-c2ccccc2)n1	815750560	DTIHJBOOTYGZDJ-UHFFFAOYSA-N	442.501	1.513	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(N2CCOCC2)c(C(=O)NNc2cccc(Cl)n2)c1	817005925	OYGQPFHWBOUNQF-UHFFFAOYSA-N	439.925	1.579	50	20	IDGD	
Cc1nc(-c2cccnc2)nc(O)c1CC(=O)NNc1ccccc1S(=O)(=O)N(C)C	817053582	XTGSSUNONOWLNX-UHFFFAOYSA-N	442.501	1.489	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)[C@H](O)[C@@H](O)c2nc3ccccc3s2)cc1	831306883	MKHAXLHXOSIOMD-NXOUGTEYSA-N	445.497	1.704	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2ccc(C(F)(F)F)cn2)cc1	844255405	ADASQBPWAHRFEB-UHFFFAOYSA-N	430.408	1.491	50	20	IDGD	
O=C(C1CCN(S(=O)(=O)c2cc(Cl)ccc2Cl)CC1)N1CC[C@H](B(O)O)C1	864233209	GMTIOXQRDVZOGT-LBPRGKRZSA-N	435.138	1.469	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)CCN2C[C@H](C)O[C@@H](C)C2)c2ccccc2c1=O	912920204	YDCHBPNMLJGMPE-IRXDYDNUSA-N	443.548	1.847	50	20	IDGD	
Cn1cc(S(=O)(=O)NNC(=O)c2nc(Cl)c(Cl)c(N)c2Cl)cc1C(=O)O	912979369	MKMTWJLNBOUWJY-UHFFFAOYSA-N	442.668	1.284	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)NCCCN2C(=O)NC3(CCCCC3)C2=O)c1	913638537	WZLQQYHAIZQMHT-UHFFFAOYSA-N	431.493	1.349	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN1C(=O)c1cc(Cl)ccc1Cl)[C@@H]1CCS(=O)(=O)C1	914719721	ONEDJRVFEFYDJU-YGRLFVJLSA-N	448.328	1.180	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(N2C[C@H](C(=O)O)CC2=O)cc1)c1ccc(Cl)cc1	914746182	DYKZEYXPPJXRDO-GFCCVEGCSA-N	437.861	1.401	50	20	IDGD	
O=C(COC(=O)c1ccc(=O)n(-c2ccc(F)cc2)n1)NNC(=O)c1ccc(Cl)cc1	915025514	PWYVMYGITUHLMO-UHFFFAOYSA-N	444.806	1.643	50	20	IDGD	
COCCS(=O)(=O)CC(=O)NNC(=S)Nc1cc(C(F)(F)F)ccc1Cl	915638680	TWCHKAJDGBNRDR-UHFFFAOYSA-N	433.861	1.738	50	20	IDGD	
O=C(NCCc1cccnc1)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	916262608	KDGCHDCZNXAMRW-UHFFFAOYSA-N	442.483	1.970	50	20	IDGD	
C[C@H]1CCCN(CCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)C1	916452328	JQAZWEFCLWRZLG-INIZCTEOSA-N	437.566	1.147	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)NCCNc2ccc(C#N)cn2)c2ccccc2c1=O	916521581	JLIYLGUJIYLKNK-UHFFFAOYSA-N	434.460	1.300	50	20	IDGD	
Cc1cc(NC(=O)[C@H](C)SCC(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)no1	916562119	LFTCVSZGLHBGPU-ZDUSSCGKSA-N	433.490	1.446	50	20	IDGD	
Cn1ncc2c1CCC[C@@H]2NC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	916604774	PUWZOQMMAQBGQA-IBGZPJMESA-N	425.537	1.340	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)NC[C@]1(N2CCOCC2)CCSC1	916637261	XDDXFUOVSNQOKK-HXUWFJFHSA-N	438.550	1.002	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)NCc1ccc(S(=O)(=O)N(C)C)cc1	916646664	GSLBUDWMIYZAJP-UHFFFAOYSA-N	434.518	1.409	50	20	IDGD	
O=C(NCc1cccc(O)c1)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	918125096	LSFIGIOBTDPSJV-UHFFFAOYSA-N	432.502	1.711	50	20	IDGD	
CCS(=O)(=O)N1CCC[C@@H](C(=O)NNC(=O)[C@H](C)Oc2c(C)cc(Cl)cc2C)C1	918551547	NYTOPMIDROYYOW-LSDHHAIUSA-N	445.969	1.933	50	20	IDGD	
CC1(C)NC(=O)N(CCCC(=O)NNC(=O)c2ccc(F)cc2Br)C1=O	918642425	ZPFWUCIECQKFIN-UHFFFAOYSA-N	429.246	1.460	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)[C@@H](CC(C)C)N2C(=O)[C@H]3CC=CC[C@H]3C2=O)c1O	919756922	NGVWYDAIOQOYDU-IJEWVQPXSA-N	429.473	1.528	50	20	IDGD	
Cc1nc(-c2ccc(Cl)cc2)sc1C(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1	919888244	BGNXHFHDWUZMEQ-GFCCVEGCSA-N	428.923	1.903	50	20	IDGD	
Cc1nc2ncnn2c(C)c1CCC(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1	1116085083	WPBXRQIRYDMXDC-UHFFFAOYSA-N	445.524	1.468	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)c1cn(-c2ccc(Br)cc2)nn1	1116637932	GVHDDKHXSVCNFF-NSHDSACASA-N	438.282	1.769	50	20	IDGD	
C[C@@H](O)CNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cccc(OC(F)F)c2)cc1	1262596494	HYRFZRYGPXCVQN-LLVKDONJSA-N	443.428	1.022	50	20	IDGD	
C[C@H](NS(=O)(=O)c1cccs1)C(=O)NNC(=O)c1ccc(Br)cc1	1317962307	GIFMGKRMBVUSCM-VIFPVBQESA-N	432.321	1.639	50	20	IDGD	
Nc1cnnc(NNC(=O)c2ccc([N+](=O)[O-])cc2I)c1Cl	1319406571	YTDYDKZBCUCVOD-UHFFFAOYSA-N	434.581	1.982	50	20	IDGD	
COc1ccc(C=NNC(=O)CSc2nc3ccccc3n2C)cc1OCC(N)=O	1319752531	RVZIVYWDITTWON-UHFFFAOYSA-N	427.486	1.688	50	20	IDGD	
CNS(=O)(=O)c1ccc(Br)c(C(=O)NNc2ccccc2C(=O)OC)c1	1319947546	VKAHCKGRXLJIAO-UHFFFAOYSA-N	442.291	1.901	50	20	IDGD	
CCCS(=O)(=O)N1CCCC[C@@H]1C(=O)NNC(=O)c1ccc(Br)cc1	1323784840	FMHHHNCUVHQXFN-CQSZACIVSA-N	432.340	1.804	50	20	IDGD	
Cc1nn[nH]c1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)CBr)C2	1777740658	FJEFJERTWUHAFC-XTQGRXLLSA-N	428.331	1.272	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H]3CN(Cc4ccccc4)CCO3)C2)C1	1778278503	LCDJVLHMQMEPLC-SXWKCWPCSA-N	449.979	1.735	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)o1	1779027946	TWFXWDAJTYDUMX-CZUORRHYSA-N	432.246	1.372	50	20	IDGD	
Cc1n[nH]c(C)c1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Br)C2	1779610394	XBJIJQWWUPRREE-SUYBPPKGSA-N	431.306	1.845	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](C)S)CCO2	1780098494	MWISULIDCHOEHN-CWTRNNRKSA-N	437.474	1.282	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)C(=O)Nc3c(C)cccc3C)C2)C1	1781242426	NTHPFEYGDAZQRY-IERDGZPVSA-N	437.924	1.326	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](F)Br)C3)C2)nc2nccn12	1781334130	VKENBGWXCUSBBO-SUMWQHHRSA-N	440.273	1.172	50	20	IDGD	
Cc1n[nH]c(C)c1CC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2	1781424945	AKRVQXAJLRFAOA-KPZWWZAWSA-N	427.343	1.430	50	20	IDGD	
CC(=O)O[C@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)Br)C1)C(C)C	1781997807	JEWCGUZUZYQCBZ-JNNRSPCRSA-N	447.370	1.871	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cn1ccccc1=O)C2	1781998447	VOEKGUOODHJJPD-SPYBWZPUSA-N	440.338	1.146	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc3ccnn3c1)C2	1782179715	SDILDWFSKALCJX-DBXWQHBBSA-N	434.924	1.716	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCc2ncc[nH]2)C1	1782412141	AHCFSQNVQBEDTB-PMUMKWKESA-N	427.343	1.640	50	20	IDGD	
C[C@@H](O)C(=O)N1CC[C@@]2(CN(C(=O)/C(C#N)=C/c3ccc(Br)cc3)CCO2)C1	1783527313	YCYDSPRYYUBRIP-RWJTWEKPSA-N	448.317	1.567	50	20	IDGD	
COc1cc(CCC(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](C)Br)C3)C2)ccn1	1783530263	WGTMRQQIQBKCNI-AUUYWEPGSA-N	440.338	1.636	50	20	IDGD	
COC(=O)[C@@H]1CC[C@@H](C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)C(C)(C)CCl)[C@H]3C2)C1	1783847453	OGOODZNEMIFTCO-NRKLIOEPSA-N	428.957	1.820	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)CCOc3ccc(F)cc3)CCO2)C1	1783869058	NJXWYHBOOMGSDV-PXNSSMCTSA-N	428.888	1.678	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(O)nc3)C[C@@H]21	1783970737	ZSNPEKZEUWWPLH-UNQGMJICSA-N	426.311	1.412	50	20	IDGD	
COC(=O)[C@H]1CC[C@H](C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCBr)C[C@@H]32)C1	1784081959	OSGGLQIMPYEXBY-QXKUPLGCSA-N	445.354	1.340	50	20	IDGD	
Cc1ncc(CC(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)s1	1784433274	DOZBTRSXOGBLDO-SJCJKPOMSA-N	430.368	1.855	50	20	IDGD	
CN(C)c1cncc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CO[Si](C)(C)C)C[C@@H]32)c1	1785553649	IWNDDPNMLGIMBH-SNRMKQJTSA-N	434.613	1.592	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C=C\C(=O)NC3CC3)[C@H]2C1	1788495543	QUCXZLYEZBVUPC-LAXCSOLKSA-N	432.348	1.037	50	20	IDGD	
C[C@H](Oc1ccccn1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]2C1	1788766217	XHRCWGVRWJBBKG-XSLAGTTESA-N	435.597	1.680	50	20	IDGD	
C=C[C@@H](O)C(C)(C)C(=O)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1	1789492941	OYMVOEDDNBYTAB-HXUWFJFHSA-N	436.317	1.687	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(O)ccc3O)[C@H]2C1	1790265001	GEASZLIAWNJPIJ-RMIITELYSA-N	441.322	1.865	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](Br)CC)C[C@@H]21	1790609790	ILKIZGOSGXUIOO-QTVXIADOSA-N	449.342	1.701	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)ccc3O)C[C@@H]21	1790963491	CYSQXMZOVBOZEZ-RMIITELYSA-N	441.322	1.865	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc4c[nH]nc34)C[C@@H]21	1791057105	CEAYWSANPXZKNK-XTBFLFJDSA-N	435.322	1.940	50	20	IDGD	
COc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]3C2)n1	1791294770	IQTPSCSOBSRHHO-NHCYSSNCSA-N	447.275	1.395	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)CNC(=O)OC(C)(C)C	1792993125	NFAFPZUYCNUKSN-RBGFHDKUSA-N	431.961	1.754	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)[C@H]1CCc2ccoc2C1	1793121152	TUSJSGOZKMZLIX-IGNRKKQASA-N	429.286	1.665	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1ccnc(C(F)F)c1	1794273008	UFOQWTWCJUKNQZ-LYIQGSDWSA-N	436.228	1.913	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(C)(C)F	1795486607	NRKDWOWEWWFCOJ-FVCICTRLSA-N	437.424	1.471	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C13CC(c4ccccc4)(C1)C3)C2	1796192930	YUMRGJGZIAMCEO-GPCVTYTCSA-N	444.340	1.740	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc2n[nH]cc2c1	1796612868	LSZKCQFLPVLTGL-MUJYYYPQSA-N	433.472	1.127	50	20	IDGD	
CCc1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)no1	1796891736	IFSXPYVBYKMASF-NGYDUSEUSA-N	426.477	1.623	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnc2ccccn12	1796954857	XOXUTZVVPNEGDG-LOUJCGABSA-N	435.322	1.711	50	20	IDGD	
COC(=O)[C@@H]1CC[C@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@](C)(Cl)CCl)C1	1799273264	ATSXTEWATNFJFG-MPDLIOFISA-N	435.348	1.402	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1O	1799985092	GIDQUJNKCOVZCL-IZKTWJBDSA-N	443.972	1.870	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1CC(=O)C1)C2	1800334043	DYXNKNNPPONGHD-RBCWYBIJSA-N	429.423	1.440	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CC1(O)CCC1)C2	1800334434	RBKLHOWQHZHOIW-RNCDSHHQSA-N	445.466	1.766	50	20	IDGD	
CCc1noc(C)c1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](Br)CC	1800642022	RKCHQRTZNWQNBM-OQMKEHIESA-N	428.327	1.922	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](N)c1cccc(Cl)c1)C2	1800757076	UETQQYFAZIIMJH-KKYDWHDCSA-N	444.757	1.713	50	20	IDGD	
CC(C)(C)OC(=O)N1C(=O)CC[C@@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2	1801158505	MWWQMDXJMDQSSX-OGMFBOKVSA-N	447.891	1.037	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCc1ccc(O)nn1	1801234534	XRUSYPHMJMFJAH-MHEUCROKSA-N	425.327	1.784	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(CS(C)(=O)=O)nc1)C2	1802277685	WQSXEPMMFFDYFK-YYIAUSFCSA-N	443.953	1.132	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2nc3ccccn3n2)[C@H]1c1cccnc1)[C@@H](O)CCl	1803139113	KJYCAOSPYFQRPU-ZOBUZTSGSA-N	428.880	1.044	50	20	IDGD	
O=C1NCc2cc(C(=O)N3CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]3c3cccnc3)ccc21	1803143023	RAKBVASSGPSCLH-MNEFBYGVSA-N	442.903	1.244	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)Cn2cc([N+](=O)[O-])cn2)[C@H]1c1cccnc1	1804421688	NVXPPJJAKYKJBE-QILLFSRXSA-N	434.884	1.910	50	20	IDGD	
Cc1noc(C)c1CCC(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1	1804599554	FOXWCVHFOWQLOA-ILZDJORESA-N	434.924	1.925	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)C2CCCCC2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1	1807371753	ZOUNXEKZWVGLMP-IFMALSPDSA-N	435.333	1.661	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)CCc2cncnc2)[C@@H]1c1cccnc1	1807507585	GFZYKQKDAFTULA-BJLQDIEVSA-N	431.924	1.764	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)c1cc2ncccn2n1	1809761641	WRDWYZVHEHVSAX-YXJHDRRASA-N	428.880	1.044	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)c3cc4cccnc4[nH]3)CC2)C1	1809978657	ILQYVHJUPLDLJB-UHFFFAOYSA-N	446.316	1.401	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H](CNC(=O)CCc2nc(N)n[nH]2)[C@H]1c1cccnc1	1810145893	DUJDLJUUFNONDW-RHSMWYFYSA-N	433.944	1.686	50	20	IDGD	
CN1C(=O)CC[C@H]1C(=O)N1CC[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]1c1cccnc1	1810545251	WSTUZQJPANAIIR-ABSDTBQOSA-N	432.597	1.560	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@H]1CCN(C(=O)/C=C\C(=O)NC2CC2)[C@@H]1c1cccnc1	1810546337	TYSWENNFJWVOPF-JZACPFSMSA-N	444.608	1.774	50	20	IDGD	
CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CCC2(CCCN(C(=O)[C@@H](F)Cl)C2)CC1	1810910562	YCRALBGVCKWKGK-HZPDHXFCSA-N	427.908	1.223	50	20	IDGD	
C[C@](O)(CC(=O)O)CC(=O)NC[C@H]1CCN(C(=O)C(Cl)Cl)[C@H]1c1cccnc1	1813066521	BWMOYPDJNLNTMS-HNJNHCNJSA-N	432.304	1.507	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)cc1	1813888039	JWMIRLQSXFWYBE-IHPCNDPISA-N	444.919	1.959	50	20	IDGD	
O=C(Cc1ccc2c(c1)OCO2)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)CCl)CC2	1814133477	QAGOOXNFTOYJOV-YPMHNXCESA-N	437.905	1.626	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc3nc(CO)[nH]c3c2)[nH]n1)[C@@H](O)CCl	1814871245	LLPSAQYSJFFNGV-HOTGVXAUSA-N	446.895	1.684	50	20	IDGD	
CC(C)[C@@H](S)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1815240990	XNXZQRLEJCIUFA-FUHWJXTLSA-N	430.339	1.350	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H]1CCCSC1)CC2)c1ccc(B(O)O)cc1	1815347960	ZUNSHKBXQLOFBG-UKRRQHHQSA-N	445.375	1.192	50	20	IDGD	
C=CCOCCCC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1	1817470236	NBVVQQLRSWCRIW-IBGZPJMESA-N	440.309	1.378	50	20	IDGD	
Cc1cc2nnc(C(=O)Nc3nc4c(s3)C[C@@H](NC(=O)[C@@H](O)CCl)CC4)c(C)n2n1	1818244753	JNYMHJGXBCSJHN-JQWIXIFHSA-N	449.924	1.023	50	20	IDGD	
CC(C)O[C@H](C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819403598	WMEXKIXUILGAGR-CXAGYDPISA-N	443.508	1.528	50	20	IDGD	
CN1C(=O)CC[C@H]1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](F)Br)n[nH]1	1820939399	HVRAUBGOPCLMQS-SUNKGSAMSA-N	430.278	1.713	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(B(O)O)cc1)CC2)c1ccc(O)cc1	1822229924	OFGMKTWEHTTXES-HNNXBMFYSA-N	437.286	1.068	50	20	IDGD	
COCCOCCOCCC(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H](O)CCl)CC1	1824185604	JRRXLTKQYDRRAZ-MOPGFXCFSA-N	448.988	1.276	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H]1CCC(=O)N1)CC2	1825445254	QORJBGJQLPWDAA-WCABBAIRSA-N	429.340	1.507	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)Cn1ccnn1)CC2	1825446655	HFYMPINLADANCB-UWVGGRQHSA-N	427.328	1.520	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(=O)n1O)CC2	1825637160	TUZMMKZUMVDQHK-IUCAKERBSA-N	441.307	1.551	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cn(C(C)(C)C)nn1)CC2	1826004137	XILYXOJOWCNEGY-WDEREUQCSA-N	440.957	1.969	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)n2)CC1	1827602738	UFNRKMBHRJITCT-ZFWWWQNUSA-N	426.901	1.375	50	20	IDGD	
CCOC(=O)N[C@H](O)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H](C)Br)CC1	1828763087	JPGVAVREOZFKRG-VHDGCEQUSA-N	448.358	1.454	50	20	IDGD	
CC1=C(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)CC2)CCO1	1828926248	CBHFKMFQSITCIO-FQEVSTJZSA-N	441.532	1.613	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccc(C#N)cc3)C2)C1	1831638106	AWDCTGSXNAYBQD-DENIHFKCSA-N	433.936	1.965	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)C(Cl)Cl)CC1	1831878482	HRHFFQUWJWAOFS-MRXNPFEDSA-N	427.137	1.403	50	20	IDGD	
CO[C@H](C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)CC1	1831906228	PBFLGSTVQKGSSQ-JPBTYYRWSA-N	431.537	1.775	50	20	IDGD	
C[C@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1)n1cccn1	1832237307	XYHSDYXZYGXTPO-UTKZUKDTSA-N	438.337	1.057	50	20	IDGD	
C[C@@H](C(=O)NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1)C1(O)CCC1	1833067636	SOXPHLCZBRFEON-HNNXBMFYSA-N	444.414	1.894	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)CCBr)C3)C2)nc1	1834374281	NRRUAJJPONYTRF-SFHVURJKSA-N	426.311	1.245	50	20	IDGD	
CCOC(=O)/C=C/C(=O)N1CCC(N2CCC(NC(=O)CCBr)CC2)CC1	1834421068	CHARLZMLMWAXLI-ONEGZZNKSA-N	444.370	1.462	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)[C@H]3CCCO3)CC2)CC1	1834903039	FSWFPXMKHYDXSZ-IAGOWNOFSA-N	430.387	1.911	50	20	IDGD	
COc1nccc(C(=O)NC2CCN(C3CCN(C(=O)[C@H](F)Cl)CC3)CC2)c1F	1834906091	CXJUUQZPWGHHFI-INIZCTEOSA-N	430.883	1.949	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3ccc(-n4cccn4)nc3)CC2)CC1)[C@H](F)Cl	1835083949	BJQPJGLCEMJPPE-IBGZPJMESA-N	448.930	1.987	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cnc(C)s3)CC2)CC1	1835259608	OKJCNZRGBPXXSN-INIZCTEOSA-N	428.986	1.891	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)C(Cl)Cl)CC2)CC1)c1cnn2cccnc12	1835536679	TYCXBGHANKMSID-UHFFFAOYSA-N	439.347	1.718	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@H](C)Cn3cncn3)CC2)CC1	1835805372	CQTSNTIYFFKWHK-APWZRJJASA-N	439.004	1.893	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnccc3F)CCO2)C1	1836319785	ZHDSLAPAJZFCJZ-SJCJKPOMSA-N	430.274	1.074	50	20	IDGD	
Cc1noc(CC(=O)N2CCC(N3CCC(NC(=O)[C@H](F)Br)CC3)CC2)n1	1836412421	GBAWSNVHHAUGKZ-INIZCTEOSA-N	446.321	1.183	50	20	IDGD	
Cc1nccn1[C@H](C)C(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836720572	XFVOPHOPDDPQKX-RDTXWAMCSA-N	426.945	1.351	50	20	IDGD	
Cc1ncc(CC(=O)N2CCOC[C@@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)s1	1837718187	ZXXNJIIXBSZUMM-IBGZPJMESA-N	441.626	1.302	50	20	IDGD	
CSc1ncccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1838287302	GOMFGCJCPACZJL-KRWDZBQOSA-N	434.345	1.677	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](C)N3C[C@H]4C[C@H]4C3)CC2)CC1	1838370714	SWEOUTYVMHIALC-WWNBULGVSA-N	442.000	1.579	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCC(OC2CCN(C(=O)[C@@H]3CCNC(=O)C3)CC2)CC1	1838637962	LVURUEPLKHQLPV-VLIAUNLRSA-N	448.391	1.748	50	20	IDGD	
O=C(c1ccccc1O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839197636	CQYPRRCHVLCUAB-PBHICJAKSA-N	431.258	1.153	50	20	IDGD	
COc1cncc(CCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)c1	1840186583	QPVWJTAPYWOCJD-LJQANCHMSA-N	446.331	1.283	50	20	IDGD	
Cc1cccn2ncc(C(=O)N3CCOC[C@]4(C3)CN(C(=O)C(Cl)Cl)CCO4)c12	1840189613	CGBAQPQMNTXDQO-IBGZPJMESA-N	441.315	1.516	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)cc(C)c1O	1840677197	UDRXGPDMWZBUGZ-LJQANCHMSA-N	431.316	1.883	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)CCSC(=N)N)C1	1842914255	PGIKXYRRNOMRSB-UHFFFAOYSA-N	449.489	1.354	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC2(CCCN2C(=O)c2cc3n(n2)CCCNC3=O)C1	1843999105	CFWLVRMSLXRPLB-KRWDZBQOSA-N	428.320	1.070	50	20	IDGD	
Cc1ccc(CCC(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)cc1F	1844263470	IHSBQLMJIKABES-UHFFFAOYSA-N	439.491	1.582	50	20	IDGD	
CSc1ccc(CC(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)cc1	1844265211	GFGKPKMUYMRECX-UHFFFAOYSA-N	439.541	1.467	50	20	IDGD	
CCCCn1c(CCC(=O)NNC(=O)OCC)nc2cc(S(=O)(=O)N(C)C)ccc21	21771069	VXNGMUDJNGENIE-UHFFFAOYSA-N	439.538	1.797	50	20	IDGD	
C[C@@H]1CC(C)(C)C[C@@]2(C1)NC(=O)N(CC(=O)NNC(=O)Cc1c[nH]c3ccccc13)C2=O	45591537	UWZXYNQFZITODI-QKFKETGDSA-N	439.516	1.995	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)N1CCN(C(=O)c2cccc(Cl)c2)CC1	725874265	XMTOBPQULNMUMG-UHFFFAOYSA-N	449.920	1.330	50	20	IDGD	
Cc1ccc([C@@H](CNC(=O)NNC(=O)CNC(=O)c2cccs2)N2CCOCC2)cc1	726102427	LMJNGWFJHOCGQB-QGZVFWFLSA-N	445.545	1.190	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2ccn(-c3ccccc3Cl)n2)n1	728733528	MOAARLLXHSUHDW-UHFFFAOYSA-N	433.877	1.838	50	20	IDGD	
CCc1ccc(N2C[C@@H](C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)CC2=O)cc1	728846088	UWVMCIBJRCKJPG-SFHVURJKSA-N	436.516	1.456	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2cnc(-c3ccco3)s2)ccc1Cl	728856261	WEHIRTPECLXFLS-UHFFFAOYSA-N	426.863	1.779	50	20	IDGD	
C[C@@H](CCc1ccc2c(c1)OCO2)NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1	728951207	BCHSIFNBPCWDEF-HNNXBMFYSA-N	440.504	1.773	50	20	IDGD	
CC(=O)Nc1ccc(NS(C)(=O)=O)c(C(=O)NNC(=O)c2cccc3ncccc23)c1	731441492	VMXOTIFHHRECEZ-UHFFFAOYSA-N	441.469	1.640	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)CN1C(=O)N[C@](C)(c2ccc(F)cc2)C1=O)c1ccccc1	731998180	ZEFQDDFDFLXJBR-HTAPYJJXSA-N	426.448	1.934	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2C(=O)[C@@H]3CCCC[C@H]3C2=O)cc1Br	732037121	HKVSXLFBHKGTEO-VXGBXAGGSA-N	438.278	1.394	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2cnn(-c3ccccn3)c2C(F)(F)F)C[C@@H](C)O1	732262581	UPCBSNHKKWASQD-BETUJISGSA-N	440.426	1.546	50	20	IDGD	
O=C(NNC(=O)c1cc(F)ccc1Br)N[C@@H]1CCN(CC(F)(F)F)C1=O	732589804	FMNUCGTUNIMFAP-SNVBAGLBSA-N	441.179	1.695	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=O)NCc2ccc(Cl)cc2)n(C)c1	733004465	IQFBRABAQMDGPY-UHFFFAOYSA-N	441.941	1.853	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)N[C@@H](CN1CCOCC1)c1ccccc1	733337089	HEJPRJMPIALXRK-NRFANRHFSA-N	434.500	1.890	50	20	IDGD	
CCN(CC)[C@@H](C(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1)c1cccc(C(F)(F)F)c1	733915903	ZNVIGOVJYWVHDG-DZGCQCFKSA-N	435.468	1.670	50	20	IDGD	
Cc1nn(CCCl)c(C)c1C(=O)Nc1ccc(NC(=O)CCN2C(=O)CNC2=O)cc1	733919485	KFJOYSNLHUZQIU-UHFFFAOYSA-N	446.895	1.871	50	20	IDGD	
Cc1oc2ncn(C)c(=O)c2c1C(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	734825659	LKKRZLJVZJAZHV-UHFFFAOYSA-N	448.480	1.178	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)C[C@@H]2OCCc3ccccc32)CC1	735117972	KYAXKWJKEJZHHA-SFHVURJKSA-N	445.545	1.165	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@H]2CC(c3c(F)cccc3F)=NO2)cc(OC)c1OC	735989760	MZSIGUXRTPGYTF-MRXNPFEDSA-N	435.383	1.945	50	20	IDGD	
Cc1nn(C)c2sc(C(=O)N[C@@H](C)C(=O)NNC(=O)c3ccc4c(c3)OCCO4)cc12	742041975	XTSGBHHZKFTODL-NSHDSACASA-N	443.485	1.294	50	20	IDGD	
CCO[C@@H](C)c1ncc(C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)s1	742470857	BGQZENRCRMWPAB-ZDUSSCGKSA-N	440.547	1.631	50	20	IDGD	
CS(=O)(=O)c1ccc(Sc2ccccc2C(=O)NNC(=O)C(=O)N2CCCC2)cc1	742600331	BJAMNLWKCPUORF-UHFFFAOYSA-N	447.538	1.625	50	20	IDGD	
O=C(CCc1nc2cc(Br)ccc2s1)NNC(=O)C(=O)N1CCCC1	742602219	VIJOANRRYAWNPP-UHFFFAOYSA-N	425.308	1.761	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1c(Cl)nc2ccccn12	744622287	ZKVFFNZVWYGEGY-UHFFFAOYSA-N	435.893	1.766	50	20	IDGD	
COc1cc(C=NNC(=O)C(=O)NC2CC2)ccc1OS(=O)(=O)c1cc(C)ccc1C	744824126	OROHHMJMMWYCSC-UHFFFAOYSA-N	445.497	1.808	50	20	IDGD	
N#CCCn1cc(/C=C(/C#N)C(=O)N2CCO[C@@H](C(N)=O)C2)c(-c2ccc(Cl)cc2)n1	747783018	XTHFUKFSXXAJBW-QWSHFYNQSA-N	438.875	1.737	50	20	IDGD	
Cn1ccnc(NNC(=O)CSCC(=O)Nc2cccc(Br)c2)c1=O	747945690	ORSUDVNLPXPPJT-UHFFFAOYSA-N	426.296	1.358	50	20	IDGD	
C[C@@H]1CC(C)(C)CC[C@@H]1NC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	748967249	JHLOVDVRYXPNIX-WBVHZDCISA-N	438.598	1.859	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)NCc2ccccc2CS(C)(=O)=O)cc1OC	749588620	WRHOCCZLXFELFO-UHFFFAOYSA-N	435.502	1.783	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)c1ccc(C)cc1)C(=O)NNC(=O)c1ccc(C)o1	752781719	XTRWBAMVXIUKRP-HNNXBMFYSA-N	425.532	1.758	50	20	IDGD	
Cc1nnnn1[C@@H](Cc1cccc(F)c1)C(=O)NNC(=S)NCCc1cccs1	753075661	BDADHHJLOUFGKM-INIZCTEOSA-N	433.538	1.704	50	20	IDGD	
O=C(NNC(=O)C(=O)NC1CC1)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	753261670	IRWHKLNQFYYLMC-UHFFFAOYSA-N	428.320	1.567	50	20	IDGD	
COC(=O)Cc1cc(=O)n(-c2ccc(C(=O)NNc3ccc(C(F)(F)F)nn3)cc2)[nH]1	755189906	YUPKPUBBLHJSRW-UHFFFAOYSA-N	436.350	1.447	50	20	IDGD	
CCn1ccnc1C=NNC(=O)C[C@@H]1c2cc(OC)c(OC)cc2CCN1S(C)(=O)=O	755571926	HJRPYLASPYWRDI-MRXNPFEDSA-N	449.533	1.319	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)Nc1cccc(C(=O)N2CCOCC2)c1C	756184993	WFXDEIRLJOCKDX-UHFFFAOYSA-N	442.472	1.708	50	20	IDGD	
COC(=O)CCCc1nnc(NC(=O)NNC(=O)c2cc(Br)c[nH]2)s1	756682379	BRCSGXJKUNAOJT-UHFFFAOYSA-N	431.272	1.591	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H](CCC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)C1	758404030	XMHIICAAMBMQID-CQSZACIVSA-N	439.534	1.888	50	20	IDGD	
O=C(NCC1(c2ccc3c(c2)OCO3)CCCCC1)NNC(=O)C(=O)Nc1ccccn1	758707977	CRHGGDAJXXNJEL-UHFFFAOYSA-N	439.472	1.981	50	20	IDGD	
COCCS(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2cc3ccccc3o2)cc1	759059473	QYNKOVMFXBDFOU-UHFFFAOYSA-N	431.470	1.997	50	20	IDGD	
C[C@H](c1ccccc1)[C@@](C)(O)C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	759555592	HGKGCRMVFVVESO-JVJLVOBOSA-N	428.441	1.072	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(-c3ncon3)cc2)cc(OC)c1OC	763538472	CGXAAPPRIMYNJX-UHFFFAOYSA-N	441.400	1.162	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3ccccc3F)cc2F)C[C@H](C)O1	763568243	HPGRYIFRLACUQI-STQMWFEESA-N	432.427	1.978	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)COc3ccccc3F)cc2)CCO1	763681958	SZFJQGMSVXCLIW-AWEZNQCLSA-N	430.436	1.216	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(CCN3CCOCC3)cc2)c1	763760775	RHRQKPFPVDVVGF-UHFFFAOYSA-N	439.516	1.027	50	20	IDGD	
CC(C)n1nnnc1-c1ccccc1NC(=O)C(=O)NNC(=O)c1cc2c(s1)CCC2	763782385	CGNFORJXWPMTES-UHFFFAOYSA-N	439.501	1.871	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)cc1OCC	763807683	QCWWMDUDYMFPCA-UHFFFAOYSA-N	426.429	1.521	50	20	IDGD	
Cc1ccccc1-c1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)n(C)n1	763813781	ODCBVDYQVOZRFN-UHFFFAOYSA-N	432.440	1.432	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cc(OC)ccc2OC)cc1	763859501	CXMDTGQUPPSASA-CYBMUJFWSA-N	431.445	1.656	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1cccc(N2CCCC2=O)c1	763865837	RIKCUGKXXNIOBN-CYBMUJFWSA-N	428.420	1.506	50	20	IDGD	
COc1cc(F)c(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(C(C)=O)cc2)cc1OC	763871491	FXFCWUUAERPZRC-GFCCVEGCSA-N	447.419	1.599	50	20	IDGD	
Cc1nc(-c2cccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc3ccc(F)cc3)c2)no1	763871932	ITMQNQNNHYEXMQ-NSHDSACASA-N	427.392	1.738	50	20	IDGD	
CCN(Cc1ccccc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccc(F)cc1)C(C)=O	763873766	VYDVPMZDSSVELX-AWEZNQCLSA-N	444.463	1.748	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(N(C)C(=O)OC)cc2)cc1OC	763902706	OWPZBYPXDRSIMX-UHFFFAOYSA-N	444.444	1.696	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)C(=O)Nc1cccc(C(=O)NCc2ccccn2)c1	763919381	OZODSTVJWOLUQW-UHFFFAOYSA-N	449.442	1.479	50	20	IDGD	
COCCn1nc(C)c(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CC[C@H](C)C3)c1C	763950224	VDNHDYNGVMWJHL-NSHDSACASA-N	433.534	1.732	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(F)c(NC(=O)NNC(=O)CSc2ccccc2O)c1	763960982	UHSATELSHPXRFE-UHFFFAOYSA-N	442.494	1.727	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1ccccc1C(=O)N1CCCC1	764006144	KXXNHGSCFCVUID-UHFFFAOYSA-N	438.440	1.094	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1cccc(CN2C[C@H](C)O[C@H](C)C2)c1	764042322	GEYBDZHGWRIUNS-IYBDPMFKSA-N	440.500	1.704	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccc(N2CCSCC2)cc1C	764135187	BRTMEELCCLNOES-UHFFFAOYSA-N	442.541	1.885	50	20	IDGD	
CC(C)(C)[S@@](=O)Cc1cccc(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)c1	764164635	SASWOXKMORACJW-DRKIFQHWSA-N	443.525	1.823	50	20	IDGD	
Cn1ccnc1-c1cccc(NC(=O)C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)c1	764203893	GAPIIIWYQILOFE-UHFFFAOYSA-N	444.492	1.478	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)C(=O)Nc1ccccc1C(=O)N1CCCC1	764239980	WUDLZUBBMBDXAI-UHFFFAOYSA-N	433.468	1.663	50	20	IDGD	
Cc1cc(Br)c(NC(=O)C(=O)NNC(=O)c2scnc2C)cc1[N+](=O)[O-]	764247408	WVFBBPWBJRLEOR-UHFFFAOYSA-N	442.251	1.830	50	20	IDGD	
CC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2cc(Br)ccc2O)c1C	764277341	KTMWJXNCOXHFHX-UHFFFAOYSA-N	449.261	1.821	50	20	IDGD	
CCCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2O)cc1Cl	764278132	RTEBSJKBETZVML-UHFFFAOYSA-N	448.863	1.350	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)Cc2ccncc2)sc2c1CCCS2	764355837	KAWOINIVUMTHLE-UHFFFAOYSA-N	448.526	1.687	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cccc(C(=O)NC)c3)n[nH]2)cc1	764384490	BPLBJWQUPHHYMM-UHFFFAOYSA-N	434.456	1.398	50	20	IDGD	
CS(=O)(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2F)cc1F	764413983	YNGSIPNTNSMHQB-UHFFFAOYSA-N	445.831	1.563	50	20	IDGD	
CN(C1CCCCC1)S(=O)(=O)c1cccc(NC(=O)C(=O)NNc2cnccn2)c1	766259807	AEZKDYLHGAPLPB-UHFFFAOYSA-N	432.506	1.512	50	20	IDGD	
CCC(=O)N1CCCC[C@@H]1C(=O)NNC(=O)CN1CCN(Cc2ccc(C)cc2)CC1	766642487	RNNWRSUZGUZDPL-HXUWFJFHSA-N	429.565	1.051	50	20	IDGD	
CCC(=O)N1CCCC[C@H]1C(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	766670244	VFZGSEGEYPSWRP-IBGZPJMESA-N	449.983	1.396	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)c2cc(OC(F)F)n(C)n2)cc1	767246457	GUSAAPGSWZEESO-UHFFFAOYSA-N	437.432	1.517	50	20	IDGD	
CC(C)(C)OC(=O)N1CCO[C@H](CC(=O)OCC(=O)NNC(=O)c2cccs2)C1	767491346	KBOXPYHXKTZOLO-GFCCVEGCSA-N	427.479	1.078	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cccc(-c3nc[nH]n3)c2)cc1OC	767807760	NIGRHBFWVSEQMT-UHFFFAOYSA-N	425.401	1.107	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)[C@@H](C(C)C)N3CCCC3=O)n[nH]2)cc1OC	768275524	DGROKRCDIHLHJY-LJQANCHMSA-N	429.477	1.502	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)CCn1cnc2c(C)cccc2c1=O	768640501	LFUANJBODZEELV-UHFFFAOYSA-N	430.486	1.650	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnc3ccccc32)nc1)c1ccc(-n2cnnn2)cc1	768920027	MOUQOGHJBVTRDP-UHFFFAOYSA-N	425.412	1.471	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)NC2CCN([C@@H]3CCC[C@H]3O)CC2)cc1	769155272	MUYDAHNGJLZGRE-CDHQVMDDSA-N	434.537	1.561	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)Nc1ccc(C(=O)N2CCOCC2)cc1	769227710	IPFMGYRSNQLHBO-UHFFFAOYSA-N	448.501	1.720	50	20	IDGD	
CSCCNC(=S)NNC(=O)c1ccc(Cl)c(S(=O)(=O)NC(C)(C)C)c1	769768582	NAWYOZKWMRTXSY-UHFFFAOYSA-N	439.028	1.889	50	20	IDGD	
O=C(CCCOc1ccc2c(c1)OCO2)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772195630	BIUHVWLGSVCPHO-UHFFFAOYSA-N	433.848	1.692	50	20	IDGD	
CC(C)CCn1nc(C(=O)NNC(=O)C(=O)Nc2ccc(F)cn2)c2ccccc2c1=O	773527205	IYUANADLZVLVQW-UHFFFAOYSA-N	440.435	1.376	50	20	IDGD	
O=C(NNc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(F)c(-n2nnnc2C2CC2)c1	773645364	ZKLNYGYLPCRTLF-UHFFFAOYSA-N	426.368	1.669	50	20	IDGD	
COC[C@H](C)NS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2cccc(Cl)c2)cc1	773729705	UOYAOVGKVGGPBY-LBPRGKRZSA-N	440.909	1.735	50	20	IDGD	
CC(C)c1nccnc1NNC(=O)C(=O)Nc1ccc2nc(N3CCOCC3)oc2c1	773992277	HPKRXAAVERXJFV-UHFFFAOYSA-N	425.449	1.660	50	20	IDGD	
COC(=O)c1cncc(C(=O)NNC(=O)c2ccc(CSc3nncn3C)cc2)c1	774262900	GRBIBYIERNTIND-UHFFFAOYSA-N	426.458	1.364	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNS(=O)(=O)c1ccc(OC)c(CC(=O)O)c1	774611241	LBRAAEXTCVTHLK-UHFFFAOYSA-N	438.458	1.110	50	20	IDGD	
Cc1cc(C(=O)NNc2cccc(S(C)(=O)=O)c2)cc(S(=O)(=O)N(C)C)c1C	776530592	VKNNVIMKDFRXLH-UHFFFAOYSA-N	425.532	1.714	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NN=Cc2cn(C)nc2-c2ccc(C#N)cc2)c1	777879801	YQOBDFQNOIHVAZ-UHFFFAOYSA-N	436.497	1.973	50	20	IDGD	
CCn1cc(-c2nn(C)cc2C(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)cn1	779049055	NOJRKXQURCWLLC-UHFFFAOYSA-N	429.868	1.034	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@@H](C(=O)NNC(=O)C(C)(C)c2ccccc2)[C@@H](C)O)cc1	779514888	OXUJRUNQWYAXGH-CRAIPNDOSA-N	433.530	1.148	50	20	IDGD	
O=C(COc1ccccc1O)NNS(=O)(=O)[C@H]1CCCN(C(=O)c2ccccc2)C1	779622444	ADFGBRZTZCRYGB-INIZCTEOSA-N	433.486	1.026	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)c1cc(O)cc([N+](=O)[O-])c1	780321803	FHQSRZKYKHVUMT-UHFFFAOYSA-N	434.430	1.160	50	20	IDGD	
COc1ccc(C[C@@H](C)C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1OC	781237610	DXLUAPKTWNLCPR-CQSZACIVSA-N	449.529	1.594	50	20	IDGD	
CN1CCC/C1=N/S(=O)(=O)c1cccc(NC(=O)C(=O)NNc2cccc(F)c2)c1	783040295	ITIDXBLTPAIUAG-ULJHMMPZSA-N	433.465	1.720	50	20	IDGD	
NC(=O)[C@H](Cc1ccc(F)cc1)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	784060124	HIMDFGOTDZHMQU-IBGZPJMESA-N	448.520	1.331	50	20	IDGD	
CCOC(=O)Cn1cccc(NC(=O)C(=O)NNc2ccccc2C(F)(F)F)c1=O	784821187	LBEYOIYTEPLZJM-UHFFFAOYSA-N	426.351	1.512	50	20	IDGD	
CCNC(=O)Nc1ccc(C)c(NC(=O)C(=O)NNC(=O)c2cc(OC)cc(OC)c2)c1	787541057	KGVGRQAJGOIPSQ-UHFFFAOYSA-N	443.460	1.553	50	20	IDGD	
Cn1nc(-c2ccc(Cl)s2)cc1NC(=O)C(=O)NNC(=O)COc1ccccc1O	787542124	GICLQACHPBFADY-UHFFFAOYSA-N	449.876	1.673	50	20	IDGD	
CC(C)CN1C[C@@H]2CN(C(=O)NNC(=O)[C@H](C)Oc3cccc(Cl)c3)CCN2C1=O	787872204	GMCFIVYKFSAXLF-HOCLYGCPSA-N	437.928	1.926	50	20	IDGD	
CCNc1ccc(S(=O)(=O)N2CCOCC2)cc1NS(=O)(=O)CCCCCl	788047626	RGZYOSIOGNHZGW-UHFFFAOYSA-N	439.987	1.900	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)c(C)cc1C	788331151	QRIOCSCREYDPOT-UHFFFAOYSA-N	438.484	1.629	50	20	IDGD	
O=C(Cn1c(=O)ccn(Cc2ccccc2)c1=O)NNc1nnc(-c2ccccn2)s1	788565472	SWPHNEWWCCUPSB-UHFFFAOYSA-N	435.469	1.115	50	20	IDGD	
O=C(COC(=O)c1ccc(Br)o1)NNC(=O)[C@H]1COc2ccccc2O1	790082004	UZARHYMCPWXOCG-GFCCVEGCSA-N	425.191	1.186	50	20	IDGD	
COc1cc(Cl)c(S(=O)(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1C(=O)O	790385728	IIXJZDAYZYTVCW-CQSZACIVSA-N	442.833	1.196	50	20	IDGD	
Cc1ccc(CN2CC[C@@H](NC(=O)NNC(=O)c3nn(-c4ccccc4)cc3O)C2=O)cc1	790697566	QQQSMOVVFDPCNH-GOSISDBHSA-N	448.483	1.631	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@H](C)n1ccc2ccccc2c1=O	791196226	PFKFVUCNBAZRNE-AWEZNQCLSA-N	441.513	1.625	50	20	IDGD	
C[C@]1(c2ccc3ccccc3c2)NC(=O)N(CC(=O)NNc2nc3ccccn3n2)C1=O	792513740	RVEBWFWTAUHSLL-JOCHJYFZSA-N	429.440	1.793	50	20	IDGD	
CSc1cccc(N2C[C@@H](C(=O)NNC(=O)C(=O)Nc3ccc(C)cc3)CC2=O)c1	793213665	XPMMWUJCZXBNFO-AWEZNQCLSA-N	426.498	1.856	50	20	IDGD	
CS(=O)(=O)C1(CNC(=O)NNC(=O)COc2ccccc2Cc2ccccc2)CCC1	793274663	YSWWWWMKLUUYEN-UHFFFAOYSA-N	445.541	1.954	50	20	IDGD	
COc1ccc(NCC(=O)NN=C[C@@H]2CCCN(C(=O)CNC(=O)OC(C)(C)C)C2)cc1	794464911	QBNWYPRTMGTCCT-INIZCTEOSA-N	447.536	1.972	50	20	IDGD	
CC(C)S(=O)(=O)c1cccc(C(=O)NNc2ccccc2S(=O)(=O)N(C)C)c1	795152616	VCQSHSUDMCORHZ-UHFFFAOYSA-N	425.532	1.876	50	20	IDGD	
COC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)COc2cc(C)cc(C)c2)c1C	798041969	IZBWARKMDLGFKH-UHFFFAOYSA-N	428.445	1.955	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(NC(=O)OC)c2C)cc1OC	798042382	QVSOCQKGLMEKMQ-UHFFFAOYSA-N	444.444	1.980	50	20	IDGD	
O=C(NNC(=O)N1CCC(N2CCc3ccccc32)CC1)c1ccc(-n2cnnn2)cc1	799856872	MXHAZWNSZCQZQN-UHFFFAOYSA-N	432.488	1.544	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN([C@@H](CNC(=O)NNC(=O)C(C)(C)C)C(F)(F)F)CC1	801016258	UECCJUHEHGUOIQ-LBPRGKRZSA-N	439.479	1.847	50	20	IDGD	
O=C(CCC(=O)N1CCN(c2ccccn2)CC1)NNC(=O)Nc1ccc2c(c1)OCO2	802100139	INEAKGWBHSWVQY-UHFFFAOYSA-N	440.460	1.092	50	20	IDGD	
CC(=O)N1CCCC[C@@H]1C(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	802762376	DNAJBJPXHWGESA-LJQANCHMSA-N	435.956	1.006	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C[C@@H]1COCCN1C(=O)OC(C)(C)C	803112888	JZTRVYXXSRQFPN-CYBMUJFWSA-N	443.522	1.568	50	20	IDGD	
Cc1nn(-c2ccc(S(N)(=O)=O)cc2)c(C)c1CCC(=O)NNc1cccc(F)n1	804773384	JCSMKYIILPLVPO-UHFFFAOYSA-N	432.481	1.747	50	20	IDGD	
CCc1nnc(NC(=O)[C@H](C)[C@@H](C)NC(=O)NNC(=O)c2c(C)nc3ccccn23)s1	804867890	NTEITFYIJFXZDI-GHMZBOCLSA-N	444.521	1.664	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)N1CCC[C@H](CN(C)S(C)(=O)=O)C1	805369222	PTBNHMRGVARFGU-UONOGXRCSA-N	446.957	1.452	50	20	IDGD	
COC(=O)c1cc(C)c(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c(Cl)c1	806972860	PDHRJIBQTWWZBK-HNNXBMFYSA-N	447.831	1.361	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)cc1)C(=O)Nc1cc(C(F)(F)F)cc(Br)n1	806992008	ZKQGFYGUXVKZJR-UHFFFAOYSA-N	447.167	1.968	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNc2ncc(F)cn2)c(C)cc1Br	807016289	RLAYIQAIDYDROO-UHFFFAOYSA-N	426.202	1.555	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)[C@H]1CC(c2ccc(Cl)cc2Cl)=NO1	807082396	PINSAXVKFNLEJU-OAHLLOKOSA-N	436.255	1.459	50	20	IDGD	
C[C@H]1C[C@H](C)CN(S(=O)(=O)c2ccc(NC(=O)C(=O)NNc3ncccc3F)cc2)C1	807301220	BFBWTNPWDYNIFB-KBPBESRZSA-N	449.508	1.969	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)/C(=C\c1ccco1)n1nnnc1-c1ccccc1	807370127	VTRAKKFHGAWOPT-SAPNQHFASA-N	440.460	1.868	50	20	IDGD	
CN1CCN(C(=O)NNC(=O)CNC(=O)OCC2c3ccccc3-c3ccccc32)CC1	807381052	BBKZEJSSYTVLSO-UHFFFAOYSA-N	437.500	1.513	50	20	IDGD	
COc1cc(C(=O)NNC(=O)N[C@@H]2CCC[C@H]3CN(C(C)=O)C[C@H]32)cc(OC)c1OC	808185629	BMIGYRQMIBIMBT-NUEKZKHPSA-N	434.493	1.303	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NN=C2CC(C(=O)O)(c3ccccc3)C2)cc1	814730307	NLAFSSCXUMZZRB-UHFFFAOYSA-N	429.498	1.904	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc2[nH]c(=O)cnc2c1)c1ccc(COc2ccccc2)o1	821132149	JLLCHSGJTWGXRJ-UHFFFAOYSA-N	440.437	1.718	50	20	IDGD	
CCN(CC(=O)N[C@@H]1CCS(=O)(=O)C1)C(=O)/C(C#N)=C/c1cc(C)n(CC(C)C)c1C	912663486	GSNXSYDOABMDIG-FMRZMLBXSA-N	448.589	1.820	50	20	IDGD	
Cc1ccc(/C=C(\C#N)C(=O)OCC(=O)N(C[C@@H]2CCCO2)[C@H]2CCS(=O)(=O)C2)cc1	913229209	VEUWIYHDTOZEBT-AQKLWOLUSA-N	446.525	1.640	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)NCCN1CCN(Cc2ccccc2)CC1	915901052	DDTVHJIPAKAEOY-UHFFFAOYSA-N	429.496	1.353	50	20	IDGD	
CC(=NNC(=O)C(=O)NN=C(C)c1ccc2c(c1)CC(=O)N2)c1ccc2c(c1)CC(=O)N2	915936592	VFOFBFAFIFHDFM-UHFFFAOYSA-N	432.440	1.056	50	20	IDGD	
COc1cc2c(cc1OC)C(=NNC(=O)c1sc(N3CCOCC3)nc1C)C(=O)N2	915953331	KEGLTLBBLXCOPL-UHFFFAOYSA-N	431.474	1.392	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)N[C@H](c2ccccc2OC)c2nccn2C)cc1	916228323	LYXMUDIFXOSMCY-HXUWFJFHSA-N	439.472	1.936	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)NCCCN1C(=O)NC2(CCCCC2)C1=O	916268793	SOGFHAFIHVLZHG-UHFFFAOYSA-N	447.492	1.049	50	20	IDGD	
CCCS(=O)(=O)N1CCCC[C@@H]1C(=O)OCC(=O)NNC(=O)c1ccc(Cl)cc1	919472445	HHXFEAAAIJMGKE-OAHLLOKOSA-N	445.925	1.239	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)NCc1cccc(C(=O)NC[C@H]2CCCO2)c1	920349787	ZAOMZOLJSZKWLQ-QGZVFWFLSA-N	444.463	1.644	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)[C@H](C(C)C)N2C[C@@H](C)O[C@H](C)C2)c2ccccc2c1=O	921202718	BGLDJYUGXAYEQJ-QINHECLXSA-N	443.548	1.701	50	20	IDGD	
CNS(=O)(=O)c1ccc([C@H](C)NC(=O)NNC(=O)c2cncn2-c2ccccc2)cc1	1337754182	FSEYYNFZXQOLHR-AWEZNQCLSA-N	442.501	1.486	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ncn(C(C)C)n2)C1	1778280403	WOJPYFHSVAWKLT-QMTMVMCOSA-N	427.933	1.240	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)C(C)(C)Oc3ccc(C)cn3)C2)C1	1780971397	XSCCEVWKUUSXGX-IERDGZPVSA-N	439.940	1.631	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H]1Cc3ccccc3CN1)C2	1782172527	DZVAPMMQARTVNQ-VLVHOKLOSA-N	449.979	1.469	50	20	IDGD	
O=C(c1nc2ccccc2o1)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1782235172	ACKBDZVGABJFKA-GUYCJALGSA-N	426.242	1.962	50	20	IDGD	
Cn1nc2c(c1C(=O)N1CC[C@]3(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)CCC2	1782439741	JXPKCLWNDQLYIT-OALUTQOASA-N	429.348	1.589	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CSc2nc[nH]n2)C1	1782482707	KWLUNIOOFHNQGE-XHBSWPGZSA-N	446.371	1.194	50	20	IDGD	
Cc1cc2cc(C(=O)N3CC[C@]4(CN(C(=O)CCC(=O)NN(C)C)CCO4)C3)ccc2[nH]1	1782540739	QTVLFXVDTFNQMG-QHCPKHFHSA-N	441.532	1.293	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(CCN(C(=O)c3cnn4cccc(F)c34)C2)C1	1782549692	VJPZQTUJEWSQMK-GOSISDBHSA-N	439.285	1.702	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](C)n1cccc1C=O)CCO2	1783341087	BELHVBRHBWBGND-URLQWDBASA-N	440.338	1.865	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)COc3ccccc3F)C2)C1	1783360722	NVYJPHZGTZSBHV-UGSOOPFHSA-N	429.286	1.818	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(-n4cccn4)nc3)CCO2)C1	1783538041	SAKOXLHGUGNKOM-KUHUBIRLSA-N	448.321	1.494	50	20	IDGD	
Cc1cc(C)n(CCC(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](C)Br)C3)C2)n1	1783539942	PBTWTBFDZZWKSJ-QAPCUYQASA-N	427.343	1.503	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)COc3cccc(Cl)c3)CCO2)C1	1783869362	PBHJHNZRSVSWIU-QFBILLFUSA-N	431.316	1.803	50	20	IDGD	
C[C@@H](S)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2	1783886540	RHTBGMAGRFCFQK-FHSNZYRGSA-N	435.974	1.267	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]3C2)nc1	1783965504	MNHXIMJGZNAPKC-HPZZRFSDSA-N	440.338	1.715	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(CO)o3)C[C@@H]21	1783969784	LFUFVPNGSYHYMG-DSPQJCBJSA-N	429.311	1.396	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4c(s3)CCCC4)C[C@@H]21)[C@H](O)CCl	1784092375	KVDAPIHAHSVZOX-JONQDZQNSA-N	426.966	1.820	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccn(-c4ccccc4)n3)C[C@@H]21)[C@H](O)CCl	1784092818	MPADEAIXOSXDDT-WQCNXYOZSA-N	432.908	1.065	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(C(F)(F)F)cc3)C[C@@H]21)[C@@H](O)CCl	1784093230	SCOCQEWCSFCZMB-TUUVXOQKSA-N	434.842	1.898	50	20	IDGD	
COC(=O)C12CC(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)CCBr)[C@H]4C3)(C1)C2	1786407656	FWQPMEHUIGBXKJ-HQIQFYROSA-N	443.338	1.094	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/C(C)C)C[C@@H]21	1787508051	ALNAHYUXZSNNHD-PXNAMXSLSA-N	429.521	1.312	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)c1cc2c(F)cc(F)cc2[nH]1	1787918807	HGDRPMUAPLMOPQ-KLUHQITGSA-N	441.862	1.639	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)[C@H](F)Br)CCC2)cc1)c1cccc(B(O)O)c1	1788150548	XBOBQQQLAYJFFX-INIZCTEOSA-N	449.085	1.805	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)ccc3F)C[C@@H]21)[C@@H](F)Br	1789923485	PNBHRTKHQDUTRK-MOUXYMJCSA-N	433.249	1.815	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(-n4ccnc4)ccn3)C[C@@H]21	1791253777	JLRVXNRWISVEDD-RMRDIRSESA-N	447.923	1.114	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3CC[C@H](O)CC3)[C@H]2C1	1791400852	HPKYOGXDXWBZPA-UYLCUJDWSA-N	431.371	1.548	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CNc3ccccc31)C2	1792868322	WBZAUZMBLZSHQU-FEZYCPBGSA-N	436.350	1.816	50	20	IDGD	
COC(OC)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2	1793359535	RMGKLPDXTOQLTB-BTTYYORXSA-N	435.433	1.391	50	20	IDGD	
Cn1c(=O)n(C)c2cc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)C(C)(C)CCl)C4)ccc21	1796979439	CCZNLNBGTIOKMJ-JLVBRIDZSA-N	448.951	1.345	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccn2cncc2c1	1797506466	YJPCHYSSCALUHD-QHHYFVSCSA-N	425.316	1.774	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(C(F)(F)F)n1	1798086072	HEJLWVOYSRBZKR-NWJSVONSSA-N	435.830	1.557	50	20	IDGD	
CC(=O)N[C@H](C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O	1799222018	ZNGGLBSNLMXBFM-BQDHKBFISA-N	446.460	1.297	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1cnc2ccc(F)cn12	1800063963	DYWWEWBODFMCAO-ANGCBRKESA-N	443.248	1.367	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)N1C[C@@H]3C[C@H]3C1)C2	1800641983	PIHFAEHZYRDNPK-XAMOXFFSSA-N	428.371	1.090	50	20	IDGD	
Cc1cc(C)cc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCC(=O)NN(C)C)C3)c1	1801184654	QVBOEEATNWXHCN-IRJINJETSA-N	444.576	1.199	50	20	IDGD	
CC1(C(=O)NC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)CCC1	1802422906	MEVZKMPTJLXGIC-LPHOPBHVSA-N	436.516	1.590	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cccc3[nH]ncc23)[C@H]1c1cccnc1)[C@H](O)CCl	1803139904	XGUKXSLLDHBORR-KYNGSXCRSA-N	427.892	1.877	50	20	IDGD	
COc1cnc(C(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)c(F)c1	1803141241	MEDYYYXUGVWIIP-QBIMZIAESA-N	436.871	1.544	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H](CNC(=O)[C@@H]2CNC(=O)O2)[C@@H]1c1cccnc1	1803642869	NYDQKNOYANMQPC-RZFFKMDDSA-N	439.310	1.227	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)CN2C(=O)CNC2=O)[C@@H]1c1cccnc1	1804086775	ATEVGGKLWJYCRC-VKJFTORMSA-N	435.912	1.047	50	20	IDGD	
CN1N=C(C(=O)NC[C@@H]2CCN(C(=O)C(C)(C)CCl)[C@H]2c2cccnc2)CCC1=O	1804116170	YPUSBZRSXYWUGQ-YJBOKZPZSA-N	433.940	1.961	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H](CNC(=O)CCBr)[C@H]1c1cccnc1)n1cncn1	1806346147	ALRCTZKYEGASDP-FRFSOERESA-N	435.326	1.725	50	20	IDGD	
O=C(Cc1ccccc1)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1806515825	PVCZULXKXYNEFT-XUZZJYLKSA-N	443.312	1.324	50	20	IDGD	
CCOC(=O)N[C@H](O)C(=O)N1CCC2(CCCN(C(=O)CCBr)C2)CC1	1809067228	SAFBNMPJUNZZIC-CQSZACIVSA-N	434.331	1.067	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)C2CC(F)(F)C2)[C@H]1c1cccnc1	1813068621	PEIICEFPOARRKY-KXBFYZLASA-N	437.491	1.506	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H](CNC(=O)[C@H](C)n2cncn2)[C@@H]1c1cccnc1	1813398000	ZMEUULJIQXBFPJ-WTTBNOFXSA-N	449.353	1.971	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)c1ccc(CO)c(F)c1	1813990303	GNNILVWIIBZZIM-KFKAGJAMSA-N	435.883	1.632	50	20	IDGD	
Cc1cscc1C(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1	1815340981	RMGCHXPHBBEICQ-AWEZNQCLSA-N	441.343	1.732	50	20	IDGD	
Cc1cnc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)cn1	1816414338	XLUBVGHJWJZICP-INIZCTEOSA-N	428.497	1.187	50	20	IDGD	
CC(C)[C@H](S)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819401708	PGLHCJQUJBBZEU-WBVHZDCISA-N	445.549	1.669	50	20	IDGD	
C[Si](C)(C)OCC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1819593905	XZYWXDSMWHFZCM-QGZVFWFLSA-N	444.373	1.247	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](C)Br)CC2	1820149947	WAUQVDSHPFQNJB-IVZWLZJFSA-N	429.340	1.529	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(O)cc3)sc2C1	1822239121	DPDIOKRPUKUHFC-ZDUSSCGKSA-N	431.518	1.448	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)C/N=C/c2ccco2)[nH]n1	1822414587	IDVFKXSRUOQQBO-NEIHUHTASA-N	443.508	1.487	50	20	IDGD	
O=C(CN1CCOC1=O)N[C@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1	1822999637	VRSFCMFSBZYMOD-WRWORJQWSA-N	435.275	1.198	50	20	IDGD	
COc1nn(C)cc1C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1	1823001171	BDOVWMZVRKGGLA-RDDDGLTNSA-N	446.302	1.802	50	20	IDGD	
O=C(CSc1ncccn1)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)CC1	1824182324	XXXYHYCVXXEGTH-HOTGVXAUSA-N	426.970	1.788	50	20	IDGD	
O=C(Cc1ccc2c(c1)CCO2)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)CCl)CC2	1825528896	JPIMJMDGHUNGFS-HIFRSBDPSA-N	435.933	1.832	50	20	IDGD	
CCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCN2C(=O)OCc1ccccc1	1828547899	BAKLQYMVDBGWAE-DYESRHJHSA-N	437.924	1.448	50	20	IDGD	
C[C@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1)N1C[C@H]2C[C@H]2C1	1828817183	NSFWHWJXYLTAEN-AYWYSENESA-N	447.624	1.319	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H](C)NS(=O)(=O)CC)CC1	1830302873	JXNLGYOGCPKBCC-BHYGNILZSA-N	436.018	1.951	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)/C=C/c3ccoc3)C2)C1	1830535334	MRGXSNVSBFHXAH-QIGIYGOBSA-N	441.322	1.780	50	20	IDGD	
Cc1ncccc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)CBr)CCO2	1830537450	IQAIKUBKVCYFGM-AUUYWEPGSA-N	440.338	1.491	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](C)CBr)CCO2)C1	1830543297	PGJBBKQWZOEPKP-DVOMOZLQSA-N	425.751	1.491	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)COc2ccc(O)nn2)CC1	1831116337	GXOXTJZBKWVSEV-JKSUJKDBSA-N	440.928	1.435	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc(N(C)C)o3)C2)C1	1831643939	LUZNFSHTRANTBS-KUHUBIRLSA-N	428.917	1.218	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3c(O)cc(O)cc3O)C2)C1	1831654094	QHKVZOAZAAISPJ-XOBRGWDASA-N	442.896	1.281	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)C(=O)OCC)C2)C1	1831659289	QGUODYRJIRLFGS-MGPUTAFESA-N	432.945	1.440	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCN2CCOCC2)CC1	1831830273	OGGIAWZZVCDOFU-RBUKOAKNSA-N	429.989	1.582	50	20	IDGD	
C[C@@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1)n1cccn1	1831876918	MHLVEZNQWDIJHC-HKUYNNGSSA-N	432.569	1.437	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3n[nH]c4c3CCCC4)CC2)CC1)[C@@H](O)CCl	1833310459	JGGOYTPKWJFKNO-SFHVURJKSA-N	437.972	1.073	50	20	IDGD	
Cn1ncc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)c1C(F)(F)F	1833327171	XSSFDQHYQCVANG-DOMZBBRYSA-N	442.797	1.043	50	20	IDGD	
CC(C)c1nc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCBr)CCO3)C2)co1	1834819134	HQIZLSBNDIATLM-GOSISDBHSA-N	444.326	1.653	50	20	IDGD	
CC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)CNC(=O)c3cccnc3)CC2)CC1	1836395087	RODQSOWJEIIFKI-IBGZPJMESA-N	449.983	1.400	50	20	IDGD	
CCN1CCC(C(=O)N2CCC(OC3CCN(C(=O)[C@H](O)CCl)CC3)CC2)CC1	1836721526	QETNVVAXIUEXPC-LJQANCHMSA-N	429.989	1.317	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnn4cccnc34)CCO2)C1	1836843580	QCZSCHRUZYSRBW-FQEVSTJZSA-N	435.912	1.064	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cn(C)c4ncccc34)CCO2)C1	1837190638	YLBFCWGUPRQKLH-LAUBAEHRSA-N	434.924	1.661	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)[C@H]3CCC(=O)N3)CC2)CC1	1837783437	FCESKGHSTJGTKT-SWLSCSKDSA-N	430.343	1.047	50	20	IDGD	
O=C(CCc1cccs1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839197656	DSXQBCAQWTUHHX-DOTOQJQBSA-N	449.342	1.828	50	20	IDGD	
CCc1ncccc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839197927	MTZCHBLFMHTKEF-YJBOKZPZSA-N	444.301	1.405	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnn4c3OCCC4)CCO2)C1	1839516518	XFQXJPHJVRHMRG-FQEVSTJZSA-N	440.928	1.001	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3c[nH]cc3C)C2)C1	1839964082	FVBAAQHZWMSPDR-MAUKXSAKSA-N	428.327	1.567	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C)C2)C1	1839964460	RVKQRHLSGZBUGG-VQIMIIECSA-N	440.338	1.634	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cscn3)C2)C1	1839964668	YQRHZQBLDFOXPL-YOEHRIQHSA-N	446.367	1.316	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccncc3)C2)C1	1839965833	MHDAPGJTYKBIRT-APWZRJJASA-N	440.338	1.254	50	20	IDGD	
CCC[C@H](C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H](Cl)COC)CCO2)C1)n1cccc1	1840152485	JMXGROVJJWTFMV-UEXGIBASSA-N	441.956	1.540	50	20	IDGD	
O=C([C@@H](F)Br)N1CC2(CCCN2C(=O)[C@H]2CC(=O)N(C3CCCC3)C2)C1	1841859655	XWUVYJCISCHAFD-SWLSCSKDSA-N	430.318	1.671	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)[C@H]1CCc3ccoc3C1)C2	1843415273	HKDMSHGTMXPYIJ-STPJHCLOSA-N	437.500	1.722	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CN(C(=O)OC(C)(C)C)C1CC1	1847350084	SXMZKLQKFHDFKF-JYJNAYRXSA-N	429.945	1.842	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](C)[C@H]1SC(=N)NC1=O	1847498902	UCKFEALJXPEQTD-WTPMCQDGSA-N	431.356	1.022	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(O)(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](F)Cl)CC1	1847977966	JEECFQNNWNBNDU-IHRRRGAJSA-N	433.908	1.485	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)CCc2ncc(-c3ccccc3)o2)c1	14326378	QUUJDIFWICZZNM-UHFFFAOYSA-N	442.497	1.986	50	20	IDGD	
CCCn1nc(C(=O)NNS(=O)(=O)c2ccc(OC)c(OC)c2)c2ccccc2c1=O	16095583	CVZFOXWNMDJTIZ-UHFFFAOYSA-N	446.485	1.447	50	20	IDGD	
CCn1c(S)nc2cc(C(=O)NNC(=O)c3cc(OC)cc(OC)c3)ccc2c1=O	17060810	ZBOBEBRZNJLWOQ-UHFFFAOYSA-N	428.470	1.797	50	20	IDGD	
O=C(Cc1cc(=O)[nH]c(=S)[nH]1)NNC(=S)NCCSc1ccc(Cl)cc1	18947065	PZSLNZLQFAOPDW-UHFFFAOYSA-N	429.980	1.916	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)NC3CC3)cc2)cc1OC	22976753	IJTYBPWGUIKUTD-UHFFFAOYSA-N	447.513	2.000	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CSCC(=O)Nc2cc(C)on2)cc(OC)c1OC	23712850	SPCUNAJLCRWRCM-UHFFFAOYSA-N	438.462	1.142	50	20	IDGD	
CS(=O)(=O)N1CCC(C(=O)OCC(=O)NN=C(c2ccccc2)c2ccccc2)CC1	24118886	UZARCVLAYNIQBN-UHFFFAOYSA-N	443.525	1.770	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc(F)cc1)NNC(=O)c1cc(Br)c[nH]1	28717797	LRJFUGNDEWENLB-UHFFFAOYSA-N	433.259	1.046	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCCCn1cnc2ccccc21	115385783	TWZHNTUFAXMILU-UHFFFAOYSA-N	443.533	1.672	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)c1cccc(NS(=O)(=O)c2cccs2)c1	725740253	CWYSIHPOJFUUAQ-UHFFFAOYSA-N	448.482	1.333	50	20	IDGD	
CC(C)C(=O)NNC(=O)c1cc(S(=O)(=O)N2CCCCC2)ccc1N1CCOCC1	726097799	NYWXYSHWFXHAKC-UHFFFAOYSA-N	438.550	1.115	50	20	IDGD	
O=C(CN1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1)NNC(=O)c1cccc([N+](=O)[O-])c1	726187204	OFKGXNAAHBDLGC-MRXNPFEDSA-N	444.423	1.391	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)NCc1ccc(Cn2cnc3ccccc32)cc1	726250255	URFAIEBKZLQDKQ-UHFFFAOYSA-N	446.467	1.938	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NCc2nccn2C(F)F)c2ccccc2c1=O	726710186	UGUQWBDGJZTFOS-UHFFFAOYSA-N	433.419	1.932	50	20	IDGD	
COc1ccc(CCNC(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)cc1F	728399143	KLBAXUJDRBJPBI-UHFFFAOYSA-N	425.486	1.785	50	20	IDGD	
CC(=NNC(=O)[C@H](C)NS(C)(=O)=O)c1ccc(OCC(=O)Nc2ccccc2)cc1	728437977	ZBOQEZJUBCTNAS-HNNXBMFYSA-N	432.502	1.482	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)N[C@H]2CCN(c3ccc(Br)cc3)C2)n1	728754969	GDEBCVGVILNJLS-HNNXBMFYSA-N	435.326	1.872	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)c2cc(S(=O)(=O)N3CCOCC3)ccc2Cl)c1	728828730	YHQNESZLPLIXLL-UHFFFAOYSA-N	448.888	1.307	50	20	IDGD	
CCC(=O)Nc1ccc(S(=O)(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1	728854110	LSFSSERTGGSAKO-UHFFFAOYSA-N	432.506	1.051	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccccc1C(F)(F)F)C1CCN(c2ncccn2)CC1	728856234	JXXBURUORQTDHY-UHFFFAOYSA-N	429.424	1.722	50	20	IDGD	
O=C(NC[C@H](c1cccs1)N1CCCC1)NNC(=O)C1CCN(c2ncccn2)CC1	729045220	RTHWQMHJMAITAF-QGZVFWFLSA-N	443.577	1.922	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)Cc2cccc(NS(C)(=O)=O)c2)cc1	730205712	PMTLXDHHQHGUDR-AWEZNQCLSA-N	435.502	1.614	50	20	IDGD	
Cc1c(C(=O)NNC(=O)COc2ccccc2O)nnn1-c1ccc(OC(C)C)cc1	731345083	YBRNJOGLPYOTNA-UHFFFAOYSA-N	425.445	1.909	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)NCCS(=O)(=O)NCC2CCC2)c1C	731761173	VSXPBHVEHUPWQZ-OAHLLOKOSA-N	426.539	1.121	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])o1)c1cc(-c2ccccc2)on1	732054714	DDIAKQWVNLRHQQ-CQSZACIVSA-N	439.384	1.909	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CC(c2cc(F)ccc2F)=NO1)C1CCN(c2ncccn2)CC1	732638779	AFRBRXUURUNHNV-KRWDZBQOSA-N	430.415	1.312	50	20	IDGD	
O=C(NCc1cccc(C(=O)N2CCOCC2)c1)NNC(=O)c1cnn(-c2ccccc2)c1	733342065	CEGFUFARWRBVCA-UHFFFAOYSA-N	448.483	1.489	50	20	IDGD	
N#Cc1ccc(N2C(=O)N[C@H](CCC(=O)NNC(=O)c3c[nH]c4ccccc34)C2=O)cc1	733777225	SOXHYGDYPMFVIV-GOSISDBHSA-N	430.424	1.706	50	20	IDGD	
O=C(COC(=O)C[C@H]1OCCc2ccccc21)NNC(=O)[C@@H]1COc2ccccc2O1	734604889	CZDMIBPVNLUVRQ-MOPGFXCFSA-N	426.425	1.221	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)CC(=O)NNC(=O)Cn2ccc3ccccc32)cc1F	734814022	UPEZSCSEFBCCIU-UHFFFAOYSA-N	431.445	1.604	50	20	IDGD	
COCCNS(=O)(=O)c1cccc(CNC(=O)NNC(=O)c2cccc(Cl)c2)c1	735520254	ZWHUHEGBKROHSC-UHFFFAOYSA-N	440.909	1.409	50	20	IDGD	
Cc1cccc(NC(=S)NNC(=O)CN(C)S(=O)(=O)c2cccc([N+](=O)[O-])c2)c1	738556014	QCAKLPPKIMDVDR-UHFFFAOYSA-N	437.503	1.542	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)NCc2n[nH]cc2Br)cc1	739022064	ZGIJWSHQPPOSNQ-SNVBAGLBSA-N	426.271	1.869	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)c2ccc(OC)c(N3CCNC3=O)c2)cc1	742037584	ZAGWTELMIWPURX-AWEZNQCLSA-N	442.472	1.852	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)CN1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O	742481276	RCCZNGFGNIAHDQ-XOUADPBQSA-N	440.481	1.042	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2ccc(OC3CCC3)cc2)CC1	743418393	FSQPMOWGFIBCFP-UHFFFAOYSA-N	445.545	1.706	50	20	IDGD	
CCCS(=O)(=O)N1CCC(NC(=O)NNC(=O)Nc2ccc(OC(F)F)cc2)CC1	743537074	YARPPQAUPBBZNM-UHFFFAOYSA-N	449.480	1.828	50	20	IDGD	
COC1CCN(C(C)(C)CNC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)CC1	743600940	SQRFQNIWIHDGRX-UHFFFAOYSA-N	441.554	1.315	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NC(C)C)cc1S(=O)(=O)N[C@H]1CCCC[C@H]1C	745147438	YZPHMIKMVVJGAS-HIFRSBDPSA-N	426.539	1.905	50	20	IDGD	
O=C(NCc1ccc(CN2CCC(O)CC2)cc1)NNC(=O)c1cc([N+](=O)[O-])ccc1O	745804223	FINDWFNPRSMLDI-UHFFFAOYSA-N	443.460	1.401	50	20	IDGD	
Cc1ccc(N2CC[C@@H](NC(=O)NNC(=O)Nc3ccc(S(C)(=O)=O)cc3)C2=O)cc1	745851180	DBBUPAUIPAXPCB-QGZVFWFLSA-N	445.501	1.540	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)N[C@@H]3CCCN(c4ccn(C)n4)C3=O)n[nH]2)cc1	745884300	UIUAWDBQULNCIO-OAHLLOKOSA-N	436.476	1.258	50	20	IDGD	
Cc1cc(C(=O)NNc2ccc(C#N)c(C(F)(F)F)c2)nc2c1c(=O)n(C)c(=O)n2C	746890245	WOTZBESBYUHADK-UHFFFAOYSA-N	432.362	1.588	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)c1ccccc1F)C(=O)NNC(=O)Cc1ccncc1	747428093	CUIZCRHDGTUPKC-OAHLLOKOSA-N	440.522	1.011	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccc(Cl)cc2)cc1O)c1csc(N2CCOCC2)n1	748011983	KULCIIYMCIOFIU-UHFFFAOYSA-N	448.892	1.599	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)c1ccc(-c2n[nH]c(C3CC3)n2)cc1	748527214	KKUBUPBUAOIPMU-UHFFFAOYSA-N	439.501	1.717	50	20	IDGD	
CCN(CC)CCSCC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	748619885	MVBMLQYCFXOWCA-UHFFFAOYSA-N	443.639	1.141	50	20	IDGD	
O=C(CCC(=O)N1CCN(c2ncccn2)CC1)NNc1ccc([N+](=O)[O-])cc1Cl	748722029	KSYSPROXFZRRFL-UHFFFAOYSA-N	433.856	1.610	50	20	IDGD	
Cn1cc(N2CCN(C(=O)NNC(=O)c3ccc(COc4ccccc4)o3)CC2=O)cn1	750269160	WBUZENMMZAVMNH-UHFFFAOYSA-N	438.444	1.295	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1cc(Br)cc([N+](=O)[O-])c1Cl	750830136	XYOGFEKITYQNHV-ZCFIWIBFSA-N	440.659	1.206	50	20	IDGD	
COc1ccc(OC)c(CC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)c1	751201016	YAEJGKGEVUIUMA-UHFFFAOYSA-N	435.502	1.023	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CCN2C[C@@H](C)O[C@H](C)C2)cc(OC)c1Br	751425096	DXZWEGWKISRESN-VXGBXAGGSA-N	444.326	1.727	50	20	IDGD	
CO[C@H](C)c1nc(CN2CCCN([C@H](C)C(=O)NNC(=O)CC(C)C)CC2)cs1	752355696	RVCHXHYSEUYZOH-HZPDHXFCSA-N	425.599	1.940	50	20	IDGD	
C[C@H]1CCC[C@@H](C)[C@@H]1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	754925825	FDSRSNGYNIQVEH-HWWDLCQESA-N	438.550	1.476	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)CCc2cn(C)c3ccccc23)cc1	755040605	LYKHDSOQQWNRCI-UHFFFAOYSA-N	442.541	1.887	50	20	IDGD	
CCCn1nc(C(=O)NN=Cc2cnc(N3CCOCC3)s2)c2ccccc2c1=O	755545285	IVCCVCUJFBLVPX-UHFFFAOYSA-N	426.502	1.864	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)Nc2ccc(S(=O)(=O)/N=C3/CCCN3C)cc2)n1	756074344	XZALFKXZADNCTE-ULJHMMPZSA-N	447.521	1.166	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)Nc1cccc(N2CCS(=O)(=O)CC2)c1	756206064	JILVJLGZJJGMCD-UHFFFAOYSA-N	432.458	1.117	50	20	IDGD	
COc1ccc2c(c1)C=C(C(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)CO2	756465662	KDFANNMIGWCEFZ-UHFFFAOYSA-N	427.369	1.384	50	20	IDGD	
CS(=O)(=O)NCc1ccc(NC(=O)NNC(=O)c2cc(-c3ccccc3)on2)cc1	756625829	MZOXSJKPHNVYBB-UHFFFAOYSA-N	429.458	1.857	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)Nc2ccn(CCS(C)(=O)=O)n2)c1	756759863	NBADJLUMUQRDJQ-UHFFFAOYSA-N	437.522	1.591	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)CN1C(=O)NC2(C[C@@H](C)C[C@H](C)C2)C1=O	756901244	LZWSYZRCLXHWHE-RYUDHWBXSA-N	436.896	1.856	50	20	IDGD	
COC(=O)c1ccccc1CCC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1	758068008	JRAZRHDKVJUDTM-UHFFFAOYSA-N	447.513	1.182	50	20	IDGD	
Cn1c(=O)c2c(ncn2CC(=O)NN=C2CCC[C@@H]2c2ccccc2Cl)n(C)c1=O	758125811	YNZUIFWMVDPZCN-CYBMUJFWSA-N	428.880	1.527	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)C2CCN(S(=O)(=O)c3ccc(OC)cc3)CC2)nc1	759729028	APSPFVNLLXCMNJ-UHFFFAOYSA-N	448.501	1.421	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)C1(NC(=O)OC(C)(C)C)CC1	760279281	HVNREMWFJIGKGS-UHFFFAOYSA-N	425.511	1.106	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)CN1C(=O)COc2ccc(Cl)cc21	760437566	GEJYTXAFSXHFHU-UHFFFAOYSA-N	426.857	1.128	50	20	IDGD	
CCS(=O)(=O)NCc1ccc(C(=O)NNC(=O)CSc2ccccc2OC)cc1	761637298	SBNUCJZXNQIFNB-UHFFFAOYSA-N	437.543	1.688	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H]1[C@@H]1COCCC1=NNC(=O)CNC(=O)c1cccnc1	762433869	JRIVKTIEZRBKNY-AEFFLSMTSA-N	445.520	1.720	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2cc3ccccc3cc2O)ccc1NC(C)=O	763518789	YPRAXIOPZGTJSB-UHFFFAOYSA-N	436.424	1.912	50	20	IDGD	
Cc1cc(Oc2ncccn2)ccc1NC(=O)C(=O)NNC(=O)[C@H]1COc2ccccc2O1	763571800	OTJJBRIOAFOPGC-GOSISDBHSA-N	449.423	1.503	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cc3c(cc2Br)OCCO3)c(C)o1	763581549	AATISIQQOHDZTD-UHFFFAOYSA-N	438.234	1.830	50	20	IDGD	
COC(=O)c1cc(F)c(F)cc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccccc2)[nH]n1	763604137	GYHMHZKMISORIK-UHFFFAOYSA-N	443.366	1.541	50	20	IDGD	
COC(=O)N(C)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)cc1	763606165	WBPVYERUDFWNHT-UHFFFAOYSA-N	436.428	1.679	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(N2CCOCC2)c(C)c1	763664736	ZTBNWDHRSFLOLX-UHFFFAOYSA-N	442.472	1.005	50	20	IDGD	
CC(=O)N1CCCc2cc(NC(=O)C(=O)NNC(=O)COc3cc(C)ccc3C)ccc21	763665391	HTYFHDONOYGREZ-UHFFFAOYSA-N	438.484	1.767	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNC(=O)c2nn(CC)c(=O)c3ccccc23)cc1F	763785515	HAJSUGXCQIEWIZ-UHFFFAOYSA-N	441.419	1.354	50	20	IDGD	
CC(C)CNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)cc1	763870559	AFQKKZTWVZJOSW-CQSZACIVSA-N	444.463	1.765	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(NC(C)=O)c2)cc1OC	763911350	LCSIZVSQCGWYMK-UHFFFAOYSA-N	428.445	1.842	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)[C@H]1CCCN1S(=O)(=O)c1cccs1	764043771	WGUITJKFEOKPRG-GFCCVEGCSA-N	441.556	1.547	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cccc(-n4ccnc4)c3)n[nH]2)cc1	764112103	VRSSDMRLFIPVGT-UHFFFAOYSA-N	429.440	1.971	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)cc1N1CCOC1=O	764124962	PMDPGIQRSBKCRI-UHFFFAOYSA-N	432.820	1.710	50	20	IDGD	
Cc1ncc(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3CN2Cc2ccccc2)cn1	764180223	ZMSJELKBOPPOKE-NRFANRHFSA-N	444.495	1.498	50	20	IDGD	
Cc1noc(COc2ccc(NC(=O)C(=O)NNC(=O)c3cccc4ncccc34)cc2)n1	764258002	SBPPJPNBBKXKJM-UHFFFAOYSA-N	446.423	1.905	50	20	IDGD	
Cc1cc(N2CCOCC2)ccc1NC(=O)C(=O)NNC(=O)c1cccc(OC(F)F)c1	764259417	HGUJROJXVIMRCB-UHFFFAOYSA-N	448.426	1.833	50	20	IDGD	
CCCN(CCC)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)Cc2ccccn2)cc1	764267115	NXTSVLHXXGAIEJ-UHFFFAOYSA-N	425.489	1.672	50	20	IDGD	
Cc1cnn(-c2ccc(NC(=O)C(=O)NNC(=O)COc3ccccc3O)cc2F)c1	764275702	QXFUESQCBHLEOK-UHFFFAOYSA-N	427.392	1.190	50	20	IDGD	
CC1CCN(c2cccc(NC(=O)C(=O)NNC(=O)COc3ccccc3O)c2)CC1	764277818	HYUDWLQGBXNHIQ-UHFFFAOYSA-N	426.473	1.793	50	20	IDGD	
CN1Cc2ccc(NC(=O)C(=O)NNC(=O)c3cc(Br)ccc3O)cc2C1	764281119	YWYZIQWVCAGYJI-UHFFFAOYSA-N	433.262	1.500	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(F)c(C#N)c2)cc1Br	764327184	VXQGAVLZRWZHND-UHFFFAOYSA-N	435.209	1.868	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)C(=O)Nc1ccc(OCC(=O)OC)cc1C)c1ccccc1	764332622	VSHDTEZTPVQQOB-QGZVFWFLSA-N	427.457	1.827	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)C(=O)Nc1ccc(NC(=O)[C@@H]2CCCO2)cc1	764363629	SUJHUCHCRASHRU-SFHVURJKSA-N	440.456	1.107	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(C(=O)N2CCC(C)CC2)cc1C	764397746	MKIOLNKRQALZIL-MRXNPFEDSA-N	448.520	1.005	50	20	IDGD	
COc1nccnc1NNC(=O)COc1ccc(N(C)S(=O)(=O)c2cccs2)cc1	764482266	QNCGADQNUAQKFO-UHFFFAOYSA-N	449.514	1.894	50	20	IDGD	
CN(C)c1cccc(NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)n1	764729405	VOQKJZQLRQOVDZ-UHFFFAOYSA-N	432.506	1.399	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)ccc1OCC(N)=O	765617111	SFLQCKZGXVSPGH-UHFFFAOYSA-N	427.392	1.163	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3ccc(Cn4cncn4)cc3)CC2)cc1	765748753	GWACXWYFLGPAJD-UHFFFAOYSA-N	447.543	1.214	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)c1ccc(N2C(=O)CCC2=O)c([N+](=O)[O-])c1	766454384	YFOLWNJGEOHOPX-UHFFFAOYSA-N	426.385	1.261	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)c1ccc(N2C(=O)CCC2=O)c([N+](=O)[O-])c1	767974015	UBVSVAVJGKYQJG-UHFFFAOYSA-N	444.425	1.507	50	20	IDGD	
COc1ccc(NNC(=O)CC[C@@H]2NC(=O)N(c3ccc(C#N)cc3)C2=O)c([N+](=O)[O-])c1	768339227	UQWWKXZJDSWYRY-INIZCTEOSA-N	438.400	1.823	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCC(CO)(Cc3ccccc3)CC2)cc1OC	769998832	BBFDMFNFNJQRLZ-UHFFFAOYSA-N	441.528	1.782	50	20	IDGD	
CCN1C(=O)c2ccccc2N2C(=O)CC[C@]12C(=O)O[C@H](C)C(=O)NNC(=O)CC(C)C	771965006	BQTQJHVTVDWOJT-PEBXRYMYSA-N	444.488	1.111	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)c1ccc(F)c(S(=O)(=O)NC2CC2)c1	771992882	IEPSKZKGPDJCII-LLVKDONJSA-N	429.470	1.005	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCCNC(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)s1	772630981	NEUXJIINTJOZRF-GFCCVEGCSA-N	444.510	1.272	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C)c(C)c(NC(=O)C(=O)NNc2nc(C)cc(C)n2)c1	773478161	JFUPJCKJRWNQRD-UHFFFAOYSA-N	448.549	1.823	50	20	IDGD	
COc1cc(C)c(NC(=O)C(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)cc1F	773493102	UNZNIEMVNCTDKF-UHFFFAOYSA-N	435.408	1.568	50	20	IDGD	
O=C(NNc1c(F)cccc1Cl)C(=O)Nc1cnn(Cc2nnc3n2CCCC3)c1	773581336	JCGCJTJROVTRIJ-UHFFFAOYSA-N	432.847	1.734	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NNC(=O)CNC(=O)c2cc(F)cc(F)c2)C1	774273834	ZTNNHJXKUWQBHV-GFCCVEGCSA-N	440.447	1.489	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCOCC2)cc1C(=O)NNc1cnc2ccccc2n1	774769080	BOWWQOIEIRMVCV-UHFFFAOYSA-N	443.485	1.416	50	20	IDGD	
CCOc1ccc(NC(=O)NNc2nccc(OC)n2)cc1S(=O)(=O)N1CCCC1	775455246	CHIKVLPUPVQLFF-UHFFFAOYSA-N	436.494	1.817	50	20	IDGD	
CCn1nccc1C(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccc(OC)cc2)c1	775762238	ZRWCBPDMQHCWOA-UHFFFAOYSA-N	443.485	1.787	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)c1cnc(O)c([N+](=O)[O-])c1	776323748	REZZAZYMQHXIJU-QMMMGPOBSA-N	425.195	1.686	50	20	IDGD	
O=C(NCC(=O)N1CCOCC1)C(=O)Nc1ccccc1S[C@@H](Cl)C(F)(F)F	776498497	WIIWQFNCXBTVHA-OAHLLOKOSA-N	439.843	1.819	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)c2cc(Cn3cc(Br)cn3)on2)c1	776527528	NFNXGDWVNUMGCH-UHFFFAOYSA-N	440.279	1.842	50	20	IDGD	
C[C@H]1CCN(C(=O)OC(C)(C)C)[C@@H](C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)C1	778458253	ILLZDGXCVOAPDP-XJKSGUPXSA-N	439.534	1.887	50	20	IDGD	
Cc1nc(-c2ccccn2)nc(NNC(=O)c2cc(S(=O)(=O)N(C)C)cn2C)c1C	779205745	VLVWOURQJJQXKS-UHFFFAOYSA-N	429.506	1.501	50	20	IDGD	
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)NNC(=O)c1csc(N2CCOCC2)n1	779387697	QJKVLMHRFUHYTP-GFCCVEGCSA-N	442.542	1.227	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)c1cc(F)cc2c(=O)c3cc(F)ccc3[nH]c12	780545146	MWBDZKDEOIOFCG-UHFFFAOYSA-N	440.362	1.744	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)[C@H]2CCN2C(=O)OC(C)(C)C)CC1	780726722	OEEXSZZNQKETJR-CQSZACIVSA-N	441.529	1.726	50	20	IDGD	
NS(=O)(=O)c1cccc(NC(=O)C(=O)NNc2ncc(C(F)(F)F)cc2Cl)c1	782854102	WSWGEGLJKQPLTG-UHFFFAOYSA-N	437.787	1.483	50	20	IDGD	
O=C(NNc1ccc(-n2cccn2)nn1)C(=O)Nc1ccc2c(c1)nc1n2CCCCC1	783432910	HYPBMLVMJFSAKX-UHFFFAOYSA-N	431.460	1.820	50	20	IDGD	
Cc1ccc(NNC(=O)C(=O)Nc2cc(F)c(I)c(F)c2)nn1	783954176	XZAHTYXXHVPXIS-UHFFFAOYSA-N	433.156	1.750	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)cc1	784835599	DNMULHPZGPBCTR-UHFFFAOYSA-N	443.428	1.790	50	20	IDGD	
Cc1ccc(F)c(NNC(=O)C(=O)Nc2cccc(S(=O)(=O)N3CCOCC3)c2)c1	784885225	ILUJJYHFPCBXSR-UHFFFAOYSA-N	436.465	1.237	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)ccc1C(=O)NC(C)C	785059843	BUHJEIFPWAEJQI-UHFFFAOYSA-N	436.472	1.110	50	20	IDGD	
COc1ccc(C#N)cc1NC(=O)C(=O)NNC(=O)c1cc(-c2cc(C)ccc2C)[nH]n1	785126007	JGRWPIRCIWQNMX-UHFFFAOYSA-N	432.440	1.974	50	20	IDGD	
CCN(CC)C(=O)c1ccccc1NC(=O)C(=O)NNc1nccc(N(CC)CC)n1	785227409	QOWUCRGDQDEMIH-UHFFFAOYSA-N	427.509	1.887	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2cccc(CN3CCCC3=O)c2)n1	785233632	MGTUSTICTYMBKP-UHFFFAOYSA-N	425.493	1.527	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)Nc2cnc(N3CCN(C(=O)OC(C)(C)C)CC3)nc2)o1	786186184	NAYHLUAETRYSJD-UHFFFAOYSA-N	445.480	1.902	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)c1ccc(OC)c(I)n1	788158980	QNYZFMMBSAOEAC-UHFFFAOYSA-N	437.234	1.245	50	20	IDGD	
O=C(COC(=O)[C@H]1CCCc2c(O)cccc21)NNC(=O)[C@@H]1COc2ccccc2O1	789254167	VAJSQYAVULJFIK-KXBFYZLASA-N	426.425	1.343	50	20	IDGD	
CCC[C@@H](CCCS(C)(=O)=O)C(=O)N1CCN(S(=O)(=O)CBr)CC1	790013573	FNPOWLIQZOOPBM-ZDUSSCGKSA-N	447.417	1.054	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)C1CCN(C(=O)c2ccc(F)cc2F)CC1	790064886	BMOCVYGFENTZGI-UHFFFAOYSA-N	427.448	1.754	50	20	IDGD	
Cc1nc2c(C(=O)NNc3ccc(S(=O)(=O)N4CCN(C)CC4)cc3)cccc2o1	792268719	XYRYKOOGUWNRGL-UHFFFAOYSA-N	429.502	1.829	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)[C@H]2CCC(=O)c3ccccc32)cc1OC	792662943	LVXUNIASUIYSSF-INIZCTEOSA-N	426.425	1.768	50	20	IDGD	
CN(C)N(C(=O)CSc1nnc(C2CC2)n1Cc1ccccc1)[C@@H]1CCS(=O)(=O)C1	792850050	NVMFBMSXGCVAEN-QGZVFWFLSA-N	449.602	1.788	50	20	IDGD	
Cn1cc(-c2cc(F)ccc2NC(=O)C(=O)NNC(=O)CCOc2ccccc2)cn1	797002744	SFLANAXUZXJIRU-UHFFFAOYSA-N	425.420	1.781	50	20	IDGD	
Cc1c(NC(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)cc(Br)cc1[N+](=O)[O-]	797684785	JIQZWFVXYSNGSE-MRVPVSSYSA-N	435.256	1.253	50	20	IDGD	
CCCn1c(=O)nc(O)c2c(C(=O)NNC(=O)NCC(F)(F)F)cc(C3CC3)nc21	798314460	MOVZMBOMHDTCEI-UHFFFAOYSA-N	428.371	1.291	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccn(-c3cccc(C#N)c3)n2)c1	798827662	NCIAEGJHLTUKOV-UHFFFAOYSA-N	438.469	1.069	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)c1cnn(CCO)c1-c1ccccc1	801318348	MJPSAZQKKVDBKY-UHFFFAOYSA-N	436.468	1.398	50	20	IDGD	
O=C(CN1CCN(c2cc(C(F)(F)F)ccn2)CC1)NNC(=O)c1ccc(F)cc1	801541807	LJWUCFGOVUVKPE-UHFFFAOYSA-N	425.386	1.823	50	20	IDGD	
COC(=O)c1c(F)cc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2F)cc1F	802567021	GTVRKQGXTWTIHG-UHFFFAOYSA-N	429.738	1.944	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)Nc1ccc(F)c(N2C(=O)CCC2=O)c1	806743652	UPBVSFPAEMSXQF-UHFFFAOYSA-N	438.375	1.594	50	20	IDGD	
C[C@H](Oc1ccccc1NC(=O)C(=O)NNC(=O)COc1ccccc1O)C(F)(F)F	806978958	OFQTWFSIIOWWKO-NSHDSACASA-N	441.362	1.887	50	20	IDGD	
Cc1cc(-c2csc(NC(=O)C(=O)NNC(=O)CNC(=O)c3ccco3)n2)c(C)o1	807004088	GJFOVEXAGXHQQL-UHFFFAOYSA-N	431.430	1.129	50	20	IDGD	
Cc1cc([N+](=O)[O-])ccc1NNC(=O)C(=O)Nc1ccc(S(=O)(=O)N2CCCC2)cc1	807455723	NINCHRVPVOXBFP-UHFFFAOYSA-N	447.473	1.770	50	20	IDGD	
C[C@@H]1COCC[C@@H]1CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	807508584	GWWSRQVSZJBPFO-NVXWUHKLSA-N	438.550	1.478	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)c2cncn2C)c1	809555591	AZZIJYVXIYSZMC-UHFFFAOYSA-N	429.458	1.304	50	20	IDGD	
Cc1cnc(-c2cccc(NC(=O)C(=O)NNc3ccc(S(=O)(=O)N(C)C)cc3)c2)o1	813033723	IORCSDNXQKZWBU-UHFFFAOYSA-N	443.485	1.982	50	20	IDGD	
CCc1nn(C)c(OC)c1C=NNC(=O)CN1c2cccc3cccc(c23)S1(=O)=O	814765734	QVKAVAXJIGAEEU-UHFFFAOYSA-N	427.486	1.803	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2nnn(Cc3ccccc3F)c2C)cc1	815565819	BCNPLTUWFZYWMJ-UHFFFAOYSA-N	440.435	1.247	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)cc1)[C@@H]1C[C@@H]1C	815566523	XFVANUXHGVGUOR-IFXJQAMLSA-N	449.467	1.484	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)cn2ccnc12	815595129	IIUXVBFMERFOSI-UHFFFAOYSA-N	428.474	1.165	50	20	IDGD	
O=C(NNc1cccc(Cl)n1)C(=O)Nc1cccc(S(=O)(=O)N2CCCCC2)c1	815728701	PSMNWNQZKWIISK-UHFFFAOYSA-N	437.909	1.991	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)[C@@H](NC(=O)COc1ccccc1)C(C)C	816134529	FSTYJQPFYKCVPI-IBGZPJMESA-N	449.529	1.762	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)c2ccc(CNS(C)(=O)=O)o2)c1	818764090	VBJDEXJGSIQAMA-UHFFFAOYSA-N	446.279	1.635	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2c(C)nc(C(C)(C)C)nc2O)c2ccccc2c1=O	883955310	DJYBYWLKYVKKCO-UHFFFAOYSA-N	438.488	1.983	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(\C#N)C(=O)OCC(=O)NCC(=O)N2CCCC2)c1C	913150145	NUHPTGYMQIKAQC-JJLFXSABSA-N	430.505	1.501	50	20	IDGD	
O=C1CC[C@@H](C(=O)NNC(=O)c2cccc(S(=O)(=O)Nc3cccc(Cl)c3)c2)N1	913430522	PEHGQHYFTNQDHO-HNNXBMFYSA-N	436.877	1.180	50	20	IDGD	
O=C(NCc1cccnc1N1CCOCC1)NNC(=O)c1ccc(Br)s1	913630346	NOUIRDPZGPSMKG-UHFFFAOYSA-N	440.323	1.886	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)CCNS(=O)(=O)c1cccnc1	914612730	MNKRESAKSVPEGE-HNNXBMFYSA-N	442.497	1.518	50	20	IDGD	
Cc1cc(C)nc(SCc2ccc(C(=O)NNC(=O)CN3CCCNC3=O)cc2)n1	915259962	PYNFNHWZPMBUTQ-UHFFFAOYSA-N	428.518	1.562	50	20	IDGD	
COc1ccccc1NC(=S)NNC(=O)[C@@H]1CS[C@H](Cc2ccccc2F)C(=O)N1	915599081	QKWDRPUPTJUXBX-DOTOQJQBSA-N	448.545	1.995	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)C1=NN(Cc2ccccc2)C(=O)CC1	916133126	SUZDPHRCYTXBFA-UHFFFAOYSA-N	432.484	1.925	50	20	IDGD	
O=C(NCc1ccc(C(=O)N2CCOCC2)cc1)NNC(=O)c1ccc2c(c1)OCCO2	916249018	UKZATEMQYAFBLR-UHFFFAOYSA-N	440.456	1.074	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)c2ccc3c(c2)S(=O)(=O)N(C(C)C)C3=O)c1	917546092	OAQWOJXBJTVSBP-UHFFFAOYSA-N	445.497	1.696	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)CN(C)c2ncnc3[nH]cnc23)cc1OC	917924670	GNSITZHGSQSPMK-UHFFFAOYSA-N	427.465	1.438	50	20	IDGD	
COc1ccc(CNC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)c(OC)c1	918018409	SPABWYPGGRSMSA-UHFFFAOYSA-N	435.506	1.450	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(C(=O)CNC(=O)NNC(=O)c2cccc(Cl)c2)CC1	918138735	ZMMWDWAEWWLBLS-UHFFFAOYSA-N	439.900	1.363	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCCCn2ccnc2)c1	918139109	LWNBTEWYDOGAEY-UHFFFAOYSA-N	436.538	1.338	50	20	IDGD	
COc1cc(CNC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)ccc1OCCO	918228363	ISEJHYJDAORCKB-UHFFFAOYSA-N	441.444	1.102	50	20	IDGD	
O=C(NNC(=O)c1ccnc(-n2ccnc2)c1)c1cccc(S(=O)(=O)N2CCCC2)c1	918550147	QEULDUZCLOHOMT-UHFFFAOYSA-N	440.485	1.127	50	20	IDGD	
NS(=O)(=O)c1ccc(OCCSCC(=O)NNC(=O)c2ccccc2F)cc1	918550744	ZXASAJQKQYJIBS-UHFFFAOYSA-N	427.479	1.046	50	20	IDGD	
Cc1c(/C=C(\C#N)C(=O)OCC(=O)NCc2ccc(S(C)(=O)=O)cc2)cc(C#N)n1C	919044666	VVDFIYKSUJZISU-CAOOACKPSA-N	440.481	1.375	50	20	IDGD	
CN(C(=O)C1CC1)c1ccccc1C(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	919363250	YYKFIKYEASFOHW-UHFFFAOYSA-N	440.412	1.586	50	20	IDGD	
O=C(COC(=O)[C@H]1CCN(c2ccc(F)cc2)C1=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	920568573	LFQBTOBPNXFYJL-INIZCTEOSA-N	444.375	1.091	50	20	IDGD	
N#C/C(=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)N1CCC[C@@H](O)C1	920853325	NLTZTLRJVGCJLE-QWSHFYNQSA-N	427.892	1.969	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)c1cccc(N2CCCC2=O)c1	920964489	OGCZIHKNVMATJA-AWEZNQCLSA-N	444.513	1.922	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)Cc2ccccc2NS(C)(=O)=O)cc1	1251761838	QQOFLZNHMOKOEO-CQSZACIVSA-N	435.502	1.614	50	20	IDGD	
CCn1nc(C(=O)NN=Cc2sc(N3CCOCC3)nc2C)c2ccccc2c1=O	1317700051	ZSZYFRLMLMHPNO-UHFFFAOYSA-N	426.502	1.782	50	20	IDGD	
NC(=O)[C@@H]1CCCN(c2ccc(C(=O)OCC(=O)NNC(=O)c3cccs3)cc2)C1	1318021054	MFRQBYPRVLIDAT-CQSZACIVSA-N	430.486	1.068	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)c1n[nH]cc1I	1320323469	GOQZEYUZPYNEPK-UHFFFAOYSA-N	436.231	1.183	50	20	IDGD	
O=C(NNc1cncc(Br)c1)c1sccc1S(=O)(=O)N1CCOCC1	1323066885	KKAXMEDGEJURRM-UHFFFAOYSA-N	447.336	1.683	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc4ccc(OC)cc4[nH]3)C2)C1	1777771305	YKVYOGLPAKNGON-IERDGZPVSA-N	435.908	1.874	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H]1ON=C(c3ccccc3)O1)C2)[C@@H](F)Cl	1778029543	CCLOAIXPHCWLMC-PBGAUENZSA-N	439.871	1.769	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cn(C)c4ncccc34)C2)C1	1778770935	ZFQOMCKQRLHWEC-DJJJIMSYSA-N	435.322	1.800	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@]2(CN(C(=O)/C=C/c3ccc([N+](=O)[O-])o3)CCO2)C1	1779294136	CHAGNNPGXIYXTF-FHHGHWCOSA-N	437.525	1.882	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc4cccnn4n3)C2)C1	1779961356	ARJQVLBUBPSSFU-KSSFIOAISA-N	436.310	1.346	50	20	IDGD	
COCc1c[nH]c(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)c1	1780073461	HNVABTAKIRWQIL-SCLBCKFNSA-N	428.327	1.636	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(CN(C(=O)CCC#N)CCO2)C1	1780096687	FMPCAAKLWATHEQ-FQEVSTJZSA-N	430.417	1.267	50	20	IDGD	
O=C(OCCO)c1ccccc1C(=O)N1CC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1780158544	YYAMTOYINHUOHN-IBGZPJMESA-N	445.299	1.083	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(CO)on2)C1	1780219367	DKDNSAKNILICTC-JCKWVBRZSA-N	444.326	1.468	50	20	IDGD	
COc1cc(CC(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](F)Cl)CCO3)ccc1[N+](=O)[O-]	1781190512	ZDGDUIPOYCAFOQ-WMZOPIPTSA-N	429.832	1.510	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781332779	FMBFKBGRMYDXBW-KWBADKCTSA-N	430.112	1.680	50	20	IDGD	
CC(C)(C)OC(=O)NCC1(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Cl)C[C@@H]32)CC1	1783592579	JETWOYUCVBAYGH-AJNGGQMLSA-N	447.935	1.805	50	20	IDGD	
CC(C)n1cnc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]3C2)n1	1783965853	VXCAFHNWARBBQE-QPSCCSFWSA-N	442.358	1.483	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cccc4ncccc34)C[C@@H]21)[C@H](O)CCl	1784086640	ZAJJRVJZSWZFIM-UUXHPUJUSA-N	431.920	1.357	50	20	IDGD	
COc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)CBr)C[C@@H]32)cn1	1784757625	LLILCACVZRCELD-TUUVXOQKSA-N	440.338	1.715	50	20	IDGD	
CCC(=O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)[C@H]2C1	1785079487	NXVUCXIBKXYXKQ-YXWQFLTLSA-N	445.944	1.077	50	20	IDGD	
CCOC(=O)/C=C/C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)CBr)C[C@@H]21	1786372285	PPNRHLRNIUCHKG-SLIXGAEDSA-N	431.327	1.116	50	20	IDGD	
C[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCBr)[C@H]2C1)n1cccc1C=O	1786405779	BFFVIDPVYRZQSQ-OTRWWLKZSA-N	440.338	1.626	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)[C@H]3[C@H]4SC=C[C@H]43)CCC2)cc1)c1ccc(B(O)O)cc1	1788143391	AGYUUORKQMDYJN-ZCNNSNEGSA-N	434.326	1.989	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)c1cc2cccnn2n1	1789144110	DVSJXKBCLVFTOO-LVGORTOPSA-N	440.273	1.013	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3nccc(Cl)c3OC)[C@H]2C1	1789341783	LFSCWTHOCOFYAB-VIRABCJISA-N	446.331	1.591	50	20	IDGD	
CCOC(CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]2C1)OCC	1789927337	VNQUJSFWTCIIQC-WFGGJUAMSA-N	439.322	1.446	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc([N+](=O)[O-])cc3F)[C@H]2C1	1790029565	IEKSUYYCJCHNEX-RMIITELYSA-N	443.859	1.581	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](C)Br)[C@H]3C2)c(O)c1	1791059176	QHNQNKLZFRCOJA-HJXMPXNTSA-N	441.322	1.778	50	20	IDGD	
COC(=O)[C@H]1CC=CC[C@H]1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21	1791239444	VAQIRIDKLCBYBA-AICCOOGYSA-N	433.332	1.525	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4c(c3)CCCO4)C[C@@H]21	1791256448	QRXWIMZUADPNSK-JPLJXNOCSA-N	436.936	1.859	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc(F)cc3OC)C[C@@H]21	1791258643	XQUKEFXAJDHZMT-RMRDIRSESA-N	442.915	1.610	50	20	IDGD	
COC(=O)C1(C(=O)NC2(c3ccc(NC(=O)CCC(=O)NN(C)C)cc3)CCC2)CC1	1791602677	YXEPMDOGMQCNAZ-UHFFFAOYSA-N	430.505	1.447	50	20	IDGD	
O=C(CCCn1ccnc1)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1	1791823039	ITRNYDLSFSLQTL-UHFFFAOYSA-N	446.316	1.791	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccnc3c1OCO3)C2	1792872692	WQRRPDPVNLFZGQ-NRWUCQMLSA-N	440.294	1.045	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCN1C(=O)Cc2ccccc2C1=O)[C@@H](F)Cl	1793199931	HSUIMFOODNEZPX-NXEZDXNNSA-N	435.883	1.774	50	20	IDGD	
CC(=O)N[C@H](C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1794144227	ZFGPHECEPYLJDH-JZYAIQKZSA-N	444.960	1.281	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2n(n1)CCNC2=O	1795350480	MCZZNFVGGHMOQP-QPSSLKIMSA-N	428.320	1.115	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](F)Br)C2	1796892823	WYLYGWKYTDQLDJ-UTUVCQNLSA-N	442.289	1.449	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H]1C[C@H]3CC[C@@H]1O3)C2	1796893828	XHHYYDOXPGSVOD-ASSCONEYSA-N	427.505	1.326	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(-n2cccn2)nc1	1798210229	WKJYUPHGPJCVMB-SFNKJDCFSA-N	431.924	1.878	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(C)n(CC)n1	1798232585	PCPLSERIHZOGEQ-HLPPOEQASA-N	427.343	1.588	50	20	IDGD	
Cc1cncc(CCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)c1	1798440807	UMDUYCLSKUIIGG-BCDXTJNWSA-N	436.516	1.273	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1[nH]cc2c1CCC2	1799132432	UJLYLKKIYVMMJE-AUHJYUKYSA-N	436.516	1.889	50	20	IDGD	
CN(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnco1)C2)NC(=O)NCc1ccccc1	1799865778	LFRKBFSLQVJWTI-BCDXTJNWSA-N	440.504	1.273	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc2c1NC(=O)C2	1800031387	QYJHYXBVSYZGPA-XBMZAUBUSA-N	440.327	1.621	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)COc1ccccc1F	1800645450	WEAUIUVCPPEZDE-ZUMXRPEOSA-N	443.313	1.825	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCc1cnc2[nH]ccc2c1	1800846803	XOLZTQZMKOUHNM-SFNKJDCFSA-N	434.924	1.339	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1[C@H]2SC=C[C@H]21	1801319304	DDKBEGJMOGPBSO-BXXVXSLGSA-N	427.530	1.634	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(N2C(=O)C=CC2=O)cc1	1801868909	MCOHRRAYTPJPSU-MQJTVSLUSA-N	445.903	1.337	50	20	IDGD	
O=C(CN1CCCC1)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@@H]1c1cccnc1	1802555651	LJKLNWCDGAYVEB-USXIJHARSA-N	427.318	1.874	50	20	IDGD	
COc1ncccc1CCC(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]1c1cccnc1	1803141591	PXOKHTADWBJNKR-GGPKGHCWSA-N	446.935	1.724	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC2(CCCN(C(=O)CN3CCCC3)C2)CC1	1804920138	GPGABRWSRTWPOZ-XIEYBQDHSA-N	442.564	1.447	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2cncc(F)c2)[C@H]1c1cccnc1	1805849610	LFIDMYIPGHQLCN-HRAATJIYSA-N	442.495	1.308	50	20	IDGD	
C=CC[C@H](C(=C)C)C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1807376228	TVBPIYAMXLBKJN-MDNUFGMLSA-N	447.344	1.849	50	20	IDGD	
COc1ccc(C(=O)N2CCC3(CCCN(C(=O)c4ccc(B(O)O)cc4)C3)CC2)cc1	1809969302	CENFCGBPOOSUNL-UHFFFAOYSA-N	436.317	1.534	50	20	IDGD	
CC(C)c1nc(C(=O)N2CCC3(CCCN(C(=O)c4ccc(B(O)O)cc4)C3)CC2)co1	1809969342	RCGBREZIJOQGNO-UHFFFAOYSA-N	439.321	1.636	50	20	IDGD	
O=C(Cc1ccccc1F)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1	1809976742	MRNRETWBGJXOJX-UHFFFAOYSA-N	438.308	1.593	50	20	IDGD	
O=C(COC(=O)C(F)(F)F)NC[C@@H]1CCN(C(=O)[C@@H](F)Cl)[C@H]1c1cccnc1	1810183307	PQSZTAVKXVFBKN-WCFLWFBJSA-N	425.766	1.727	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC2(CCCN(C(=O)c3ccc4c[nH]nc4c3)C2)CC1	1810613170	YGACJIDXNYLJRH-UHFFFAOYSA-N	440.548	1.781	50	20	IDGD	
Cc1ccc(C)c(C(=O)N[C@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)c1	1815347740	NEKGABLEBFSWNS-KRWDZBQOSA-N	449.341	1.979	50	20	IDGD	
Cc1ncsc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1	1816493082	QQNDYCXEHNNMIF-CQSZACIVSA-N	433.538	1.854	50	20	IDGD	
CC(C)(CCl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnc(O)nc3O)sc2C1	1817078371	XOKKQHVLIBGOQA-MRVPVSSYSA-N	425.898	1.835	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cn[nH]c2)[nH]n1	1818111698	AUOHNVRKNSQOLV-YEEYNWEUSA-N	437.464	1.573	50	20	IDGD	
C[C@@H](Cn1cncn1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCBr)CC2	1820066302	MIYGHUFLEHYNOI-WDEREUQCSA-N	441.355	1.768	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](Br)CC)CC2	1820148462	LTANEVCVEOMLDQ-OUAUKWLOSA-N	443.367	1.919	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccnnc2O)[nH]n1)[C@@H](F)Br	1820935085	IBMFDIRYUMZGTF-ZYHUDNBSSA-N	427.234	1.902	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1)c1cccc(-n2cncn2)c1	1821295723	CQKASAJOXPHWFL-IAGOWNOFSA-N	443.895	1.896	50	20	IDGD	
COCC(=O)N[C@H]1CCc2nc(NC(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)sc2C1	1821303139	UUBVBZCQXQRHRQ-NSHDSACASA-N	448.457	1.849	50	20	IDGD	
O=C(Cc1cncnc1)N[C@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1	1823001763	LQMFQRVFRYVLEV-TVQRCGJNSA-N	428.287	1.778	50	20	IDGD	
Nc1n[nH]c(CCC(=O)N[C@@H]2CCc3nc(NC(=O)[C@@H](F)Br)sc3C2)n1	1823007115	JEMSCRZJRGVMLR-KSBSHMNSSA-N	446.306	1.079	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)Cn1ccccc1=O)CC2	1825640709	CJSPYNGJONBXLR-MNOVXSKESA-N	439.335	1.700	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)[C@H](C)Cn3ccnc3)sc2C1	1826833521	AWHDUFZMHXVTMI-AGIUHOORSA-N	425.942	1.842	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1	1827428957	MNNRZBFUPIZSMU-JKSUJKDBSA-N	425.913	1.980	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)cn1C	1827869064	LKCRVXLHOXOQCU-HXUWFJFHSA-N	431.581	1.940	50	20	IDGD	
CC[C@@H](C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2)N(CC)CC	1830354451	YZNVFTBDEMHGKC-LAUBAEHRSA-N	432.005	1.828	50	20	IDGD	
O=C1CC[C@H](C(=O)N2CCC([C@H]3CCCCN3C(=O)[C@H](F)Br)CC2)CN1	1830379218	QFBPVFGAWNMDED-LZWOXQAQSA-N	432.334	1.823	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccsc3)C2)C1	1830538905	UTIYYIJECGNVRQ-KSSFIOAISA-N	445.379	1.778	50	20	IDGD	
CCc1nc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)co1	1830539494	HOPADLPLDMEDTK-ACJLOTCBSA-N	444.326	1.338	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)CN(CCO)CCO)CC1	1831483729	VEOVBMXBVUYNAF-RTBURBONSA-N	432.005	1.300	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)CNC(C)=O)CCO2	1831687332	LRTKIMTZVHOPAL-OXJNMPFZSA-N	431.961	1.013	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)C(=O)c3ccco3)CCO2)C1	1832663954	IWEUFSBBPHWTKZ-ROUUACIJSA-N	433.288	1.155	50	20	IDGD	
C[C@@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)c3ncon3)CC2)CC1	1833263061	HUPWDSMWJMNNRO-LBPRGKRZSA-N	428.331	1.286	50	20	IDGD	
Cc1nc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)ccc1F	1833467359	WGFMFKZNFKGTEO-SGTLLEGYSA-N	444.301	1.383	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)C(=O)c3ccco3)CC2)CC1	1833757053	BUBGFEUJZOVLPK-CYBMUJFWSA-N	440.338	1.817	50	20	IDGD	
O=C(c1cc2cc(F)ccc2[nH]1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1836803282	AVDVQXMGTFUPAW-QFBILLFUSA-N	427.835	1.911	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccc4c(c3)OCO4)C2)C1	1839143786	HZJBKJMHSIWIEC-IIBYNOLFSA-N	438.908	1.432	50	20	IDGD	
Cc1ccncc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2	1839152737	JLOPZQBKQBHUDO-RTBURBONSA-N	430.332	1.696	50	20	IDGD	
Cc1ccncc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839200260	FCLXOLTUXBHPHJ-WMLDXEAASA-N	430.274	1.151	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cscn3)C2)C1	1839963485	LRJHINQNYGXXOH-MLGOLLRUSA-N	432.340	1.387	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc4cc[nH]c34)C2)C1	1840152775	SSRZMQLZGOAVQP-UTKZUKDTSA-N	435.908	1.492	50	20	IDGD	
CC(C)(C)Oc1ccc(C(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)cc1	1845388919	SJIFFJSBTLTFQY-UHFFFAOYSA-N	436.317	1.675	50	20	IDGD	
O=C(Nc1ccc(C(=O)N2CCCC23CN(C(=O)[C@H](O)CCl)C3)cc1)c1ccco1	1845553380	NLRQWUMOUSMCGU-MRXNPFEDSA-N	431.876	1.949	50	20	IDGD	
C[C@@H](NC=O)C(=O)N1CC2(CCCN2C(=O)/C(C#N)=C/c2ccc(Br)cc2)C1	1845872892	MJMWLXKNWRFMLK-BRYYZUPOSA-N	445.317	1.694	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC12CN(C(=O)Cn1c(=O)n(C)c3ccccc31)C2	1846070498	MNHAZUIDTCZIPS-AWEZNQCLSA-N	449.349	1.717	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@H]1CCC(=O)N1C(=O)OC(C)(C)C)C2	1846365262	JKODSQJRJZDBOZ-ZIAGYGMSSA-N	443.928	1.370	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)[C@@H](C)Oc2ccccn2)C1	1846604559	GTIDLPXISVSKLC-FYHAJLKWSA-N	438.488	1.186	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)c2ccc3c(c2)C[C@H](C)N3S(C)(=O)=O)cc1OC	14936153	BMZFCKQDYWGZPX-ZDUSSCGKSA-N	447.513	1.879	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)/C=C/c2ccc(I)o2)cc1	15888954	GPHJQFNCPAFZKG-SOFGYWHQSA-N	437.193	1.995	50	20	IDGD	
O=C(NNC(=O)c1cc(I)ccc1O)c1cccc([N+](=O)[O-])c1	17329955	IJZRINHAOWQGOY-UHFFFAOYSA-N	427.154	1.980	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)c1ccc(CCNS(C)(=O)=O)cc1	21027983	AHNWSFZTBRUPIZ-UHFFFAOYSA-N	425.894	1.515	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)c2ccc3c(c2)S(=O)(=O)N(C(C)C)C3=O)c(C)c1	110884033	IWMTWIGWPXVMOE-UHFFFAOYSA-N	444.513	1.729	50	20	IDGD	
COCCCNC(=S)N(C)NC(=O)[C@@H](NS(=O)(=O)c1ccc(C)cc1)C(C)C	726075848	OELHAAOSRFXCPH-INIZCTEOSA-N	430.596	1.172	50	20	IDGD	
O=C(NNC(=O)N1CCOCC1)c1cc(I)cc(C(F)(F)F)c1	728024118	OWNPJJUCPVDLTO-UHFFFAOYSA-N	443.163	1.997	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(=O)n(CC(=O)NNc2nc(-c3ccccc3)no2)c1	728081307	OWHCAXBRJIOUDX-UHFFFAOYSA-N	446.489	1.072	50	20	IDGD	
CC(=O)N1CCc2cc(S(=O)(=O)NNC(=O)c3cccc(OC(F)F)c3)ccc21	728510812	VIHCSWOYCCAOQM-UHFFFAOYSA-N	425.413	1.820	50	20	IDGD	
COc1cccc(CCNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1OC	728946721	JQSRQGWLGKMQLZ-UHFFFAOYSA-N	428.493	1.283	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CNC(=O)c2ccccc2I)c1	728977395	KEPVOLYFGHIRTB-UHFFFAOYSA-N	448.220	1.354	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN(C(=O)c2ccccc2)C1)c1csc(N2CCOCC2)n1	731185090	FCCGGMJWXLSNPS-MRXNPFEDSA-N	443.529	1.293	50	20	IDGD	
O=C(NCCCN(C(=O)C1CCC1)C1CC1)NNC(=O)C1CCN(c2ncccn2)CC1	731362415	BUAMVGCZFHRUCR-UHFFFAOYSA-N	443.552	1.205	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(NC(C)=O)cc1)c1ccccc1	731998874	FUIIUNYYRKKGTN-IBGZPJMESA-N	446.529	1.607	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cc(C(N)=O)n(-c3ccccc3)n2)ccc1OC(C)C	732259645	UDGQPXNIMBBNPY-UHFFFAOYSA-N	437.456	1.842	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)C2CCN(C(=O)CCc3ccccc3)CC2)C[C@@H](C)O1	732263855	PITSYZZCBRUZNE-RTBURBONSA-N	444.576	1.505	50	20	IDGD	
Cc1nn(-c2ccccc2)c2sc(C(=O)NNC(=O)[C@H]3CCCN3S(C)(=O)=O)cc12	732920290	SUTSUFCNWOLKLO-OAHLLOKOSA-N	447.542	1.580	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](NC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)C1	734173520	LYQLYBCQLFXRJM-CQSZACIVSA-N	444.492	1.921	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](NC(=O)NNC(=O)c2nnc(O)c3ccccc23)C1	734218545	JURULFQOCFFSNH-GFCCVEGCSA-N	430.465	1.679	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)CNC(=O)COc1ccccc1	734252242	KDIWKFVFIRNIPF-UHFFFAOYSA-N	434.518	1.402	50	20	IDGD	
CC(=O)N1CCc2ccc(S(=O)(=O)NNC(=O)c3cccc(OC(F)F)c3)cc21	734415804	AJXASPQYUNXOLD-UHFFFAOYSA-N	425.413	1.820	50	20	IDGD	
C[C@@H](CN1CCN(c2ccccn2)CC1)NC(=O)NN=c1sc2ccccc2n1C	735517705	FLXSELHMJCKNAQ-INIZCTEOSA-N	425.562	1.960	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNC(=O)N[C@@H]2CCN(c3cnn(C)c3)C2=O)cc1	735584742	YQFOPFLKLQWPOD-GOSISDBHSA-N	428.493	1.595	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)c2cccc(CS(N)(=O)=O)c2)cc1C	736805592	AQXAPSGHESKBKB-UHFFFAOYSA-N	439.515	1.025	50	20	IDGD	
COc1ccc(S(=O)(=O)CCC(=O)NNC(=O)COc2ccc(C)cc2)cc1OC	740813402	GXUMTTSMSITNQI-UHFFFAOYSA-N	436.486	1.402	50	20	IDGD	
CCO[C@H]1C[C@H](O)C12CCN(CC(=O)NNC(=O)c1cc(Cl)ccc1OC)CC2	741255359	JGNAOGGNSWUFAK-IRXDYDNUSA-N	425.913	1.362	50	20	IDGD	
Cc1cc(C)nc(SCC(=O)NN=Cc2c(N3CCOCC3)nc3ccccn23)n1	741805851	UFCWZVJOUHGUJO-UHFFFAOYSA-N	425.518	1.820	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)[C@@H](c1cccc(F)c1)N1CCOCC1	742033739	BOKNSMKGNHFXHI-JOCHJYFZSA-N	439.491	1.959	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)[C@H]1CCCN(c2ncnc3sccc23)C1	742470110	OLZHIBUHWNCENW-SUMWQHHRSA-N	439.497	1.895	50	20	IDGD	
CC(=O)N[C@@H](CC(=O)NNC(=O)C(=O)Nc1ccc(C)c(C)c1)c1ccc(F)cc1F	743821719	WSSJQPZHMOKTQA-SFHVURJKSA-N	432.427	1.935	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CN2CCC(C(=O)Nc3ccc4c(c3)OCO4)CC2)c1	744384335	BHRPEAQUZANMFG-UHFFFAOYSA-N	449.467	1.399	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN2CCCN(CC(=O)N(CC)CC)CC2)cc1C	744386596	AWRCNXJPPWXGKU-UHFFFAOYSA-N	437.610	1.256	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	744620030	AJAJIJCOJOXJLB-UHFFFAOYSA-N	443.529	1.763	50	20	IDGD	
Cc1cc2c(cc1C)O[C@@H](C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1)C2	744620549	IBJYLDAHLAQNFB-LJQANCHMSA-N	431.514	1.771	50	20	IDGD	
O=C(NCc1ccccc1OCCN1CCOCC1)NNC(=O)c1cccc([N+](=O)[O-])c1	744868697	IKGQIGLVQUZXCL-UHFFFAOYSA-N	443.460	1.450	50	20	IDGD	
O=C(COC(=O)[C@@H](c1cccc(F)c1)N1CCOCC1)NNC(=O)c1cccc(Cl)c1	745425984	ZXXWEKWXMGQFLD-LJQANCHMSA-N	449.866	1.857	50	20	IDGD	
CCO[C@@H](C)c1ncc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)s1	745449682	SAZVUIFGYLZQOI-FZMZJTMJSA-N	435.458	1.385	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NCC(=O)Nc2ccc(Cl)cc2)cc1	745738064	SMJBYIYYMLLIQB-UHFFFAOYSA-N	439.881	1.718	50	20	IDGD	
COc1ccccc1O[C@@H](C)CNC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	745901525	LNMFEEKGKFBXPU-ZDUSSCGKSA-N	425.445	1.354	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)Cn2cnc3sc(C)c(C)c3c2=O)o1	746397830	VLWMZUCKHKBSDH-UHFFFAOYSA-N	431.518	1.971	50	20	IDGD	
O=C(CN1CCN(C(=O)OCc2ccccc2)CC1)NNC(=O)c1cccc2ncccc12	747384298	UNTDKADTXOGEAN-UHFFFAOYSA-N	447.495	1.950	50	20	IDGD	
Cc1c(CC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cccc1[N+](=O)[O-]	747693851	QBWFMZWJVIXPHZ-UHFFFAOYSA-N	446.485	1.691	50	20	IDGD	
COc1cc(OC)cc(N2CC[C@@H](NC(=O)NNC(=O)COc3ccccc3F)C2=O)c1	747956448	SZSPRPMHVDSGHG-QGZVFWFLSA-N	446.435	1.358	50	20	IDGD	
O=C(NCCCN1CCN(c2ccncc2)CC1)NNC(=O)c1cccc([N+](=O)[O-])c1	748464507	DIUUWQCBNHKIBT-UHFFFAOYSA-N	427.465	1.146	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc2c(c1)OCCCO2)NNc1cccc2cnccc12	749291678	KIXNTMNHOKNRIS-UHFFFAOYSA-N	428.470	1.818	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)[C@H]1OCCc2ccccc21	750422957	BTGZMPJBYOGKGG-QFIPXVFZSA-N	442.947	1.919	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)[C@H]1CCCN(c2nc3ccccc3s2)C1	751201931	NGTPVPSYPUWJQY-ZDUSSCGKSA-N	427.486	1.683	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)Cc2ccc(Br)c(F)c2)n1	751922502	AXPFCMIGFOQSGI-UHFFFAOYSA-N	444.282	1.829	50	20	IDGD	
O=C(C[C@H]1CSCCS1)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	752128187	YJTUGEJGKAGQCV-KRWDZBQOSA-N	443.038	1.844	50	20	IDGD	
O=C(CO)NNC(=O)c1cnn(-c2ncc(C(F)(F)F)cc2Cl)c1C(F)(F)F	753440220	YMOADWBTTYFSGW-UHFFFAOYSA-N	431.680	1.712	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)c2ccc(O[C@@H](C)C(=O)NNC(=O)CO)cc2)cc1C	753444342	KBULDGBWPFLWRP-HNNXBMFYSA-N	435.502	1.036	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCS(=O)(=O)C2(CCCCC2)C1	753857761	GLHQSADXWIQYPD-UHFFFAOYSA-N	443.953	1.543	50	20	IDGD	
Cc1ccc2cccc(S(=O)(=O)NNC(=O)c3sc(N4CCOCC4)nc3C)c2n1	753981809	RZYKZENHQXELAP-UHFFFAOYSA-N	447.542	1.768	50	20	IDGD	
CCCC[C@H](NC(=O)[C@H](C)NC(=O)C(C)(C)C)C(=O)NNC(=O)c1ccc2c(c1)OCO2	755038033	IPWILCRBWUMJGQ-ZFWWWQNUSA-N	448.520	1.402	50	20	IDGD	
CC(C)CNS(=O)(=O)c1cc(C(=O)NNC(=O)Cc2cc[nH]n2)c(Cl)cc1Cl	755269731	NTPBKMWBTVVWBV-UHFFFAOYSA-N	448.332	1.655	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)NC2CCN(S(=O)(=O)C(F)(F)F)CC2)c1	755307655	SOVFPFGYJZSYQM-UHFFFAOYSA-N	437.444	1.011	50	20	IDGD	
C[C@](O)(CC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1)C1CC1	755388888	DTHCCGDDBAGSDZ-NRFANRHFSA-N	431.514	1.477	50	20	IDGD	
C[C@@H]1CN(S(=O)(=O)c2ccc(NC(=O)NNC(=O)c3cccn3C)cc2)C[C@@H](C)O1	755422132	IYUXTMPPRXSCGB-ZIAGYGMSSA-N	435.506	1.290	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)Cc2ccc(Cl)cc2)n([C@@H]2CCS(=O)(=O)C2)n1	755536722	UJTPIMCAEXBJGI-CQSZACIVSA-N	425.898	1.600	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)Nc1ccc(S(=O)(=O)/N=C2/CCCCCN2C)cc1	756113210	IDCAZQIOCZJTSX-UQQQWYQISA-N	447.521	1.778	50	20	IDGD	
COc1ccccc1N1CC[C@@H](NC(=O)NNC(=O)COc2cc(C)cc(C)c2)C1=O	757295500	QEUJUNQIOHUDPX-QGZVFWFLSA-N	426.473	1.827	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)Nc2c(OC)ncnc2N(C)C)c1	757708953	LSDSIHGIHRKYQX-UHFFFAOYSA-N	439.270	1.789	50	20	IDGD	
O=C(NCc1ccc2c(c1)CCS2(=O)=O)NNC(=O)c1cccc(Br)c1	757742459	VNJKRBFAFGDCCT-UHFFFAOYSA-N	438.303	1.923	50	20	IDGD	
Cc1ccc(CNC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c(O[C@H]2CCOC2)c1	758901195	OUWCTYJSMGRVIA-OXJNMPFZSA-N	427.457	1.833	50	20	IDGD	
C[C@@H]1CC[C@@H](CC(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)C1	759111574	BPPYVHBYOJKUPM-SJLPKXTDSA-N	437.562	1.614	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)Nc2cccn(CCS(C)(=O)=O)c2=O)c1C	760774683	ZOHVPACEXORYGU-AQTBWJFISA-N	446.529	1.503	50	20	IDGD	
COc1ccccc1C(=O)C(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	760919568	ULEFYBKDHRRGJF-UHFFFAOYSA-N	444.919	1.497	50	20	IDGD	
Cc1cc(F)c(S(=O)(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1F	762600795	RTRSSYAFBSTFEU-UHFFFAOYSA-N	439.849	1.197	50	20	IDGD	
CN(NC(=O)CNC(=O)c1cccc(F)c1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	763280484	AVHOACZSZIWZGN-UHFFFAOYSA-N	437.472	1.191	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(OC[C@@H]2CCCO2)cc1	763472538	XAYOZXIGIXDZOQ-KRWDZBQOSA-N	428.401	1.552	50	20	IDGD	
Cc1cnn(Cc2cc(F)ccc2F)c1NC(=O)C(=O)NNC(=O)c1ccccc1O	763527072	NCBCEAHBUYFKON-UHFFFAOYSA-N	429.383	1.623	50	20	IDGD	
Cc1cccc(C(=O)N2CCCC2)c1NC(=O)C(=O)NNC(=O)c1ccc2c(c1)OCO2	763548050	HJJBJFVIERGZBN-UHFFFAOYSA-N	438.440	1.359	50	20	IDGD	
Cc1cccc(NC(=O)C(=O)NNC(=O)c2c(C)nc3ccccn23)c1C(=O)N1CCCC1	763628375	JEGNMSAMHDJUAB-UHFFFAOYSA-N	448.483	1.587	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2cc(N3CCNC3=O)ccc2Cl)c1	763631197	WJHPZMAMONOMOZ-UHFFFAOYSA-N	445.863	1.343	50	20	IDGD	
COc1ccc(OC(F)F)c(NC(=O)C(=O)NNC(=O)COc2ccccc2OC)c1	763657351	KTKOEIABTILDSP-UHFFFAOYSA-N	439.371	1.470	50	20	IDGD	
C=CCNC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)cc1	763684786	MZZHCRCBVRXOAA-UHFFFAOYSA-N	445.863	1.812	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccc(Br)cc2)cnc1Cl	763695749	VHIRXGBKEWVRDU-UHFFFAOYSA-N	441.669	1.971	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)ccc1F	763789787	BZSOBPFQSSPXQY-UHFFFAOYSA-N	425.420	1.825	50	20	IDGD	
CCc1ccccc1NC(=O)C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	763796806	ILEHWSDACYVDGB-UHFFFAOYSA-N	444.513	1.433	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(OC)c(-n3nnnc3C3CC3)c2)cc1	763829824	NALYIHNAIOYIOS-UHFFFAOYSA-N	449.471	1.510	50	20	IDGD	
COC(=O)c1ccc(C)c(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)c1	763854394	PZZXZFIUAFZRPE-HNNXBMFYSA-N	427.457	1.952	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1cccc(N2CCCNC2=O)c1	763863692	AWVHAHRYBFQFDE-CYBMUJFWSA-N	443.435	1.299	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccn(Cc3ccccc3)n2)cc1	763877916	MIZVFBYIRLPGEC-MRXNPFEDSA-N	449.467	1.687	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cccc(-c3nccn3C)c2)cc1	763879630	ZZYKLQYKARWPQO-OAHLLOKOSA-N	449.467	1.843	50	20	IDGD	
COc1c(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCCCC3)cccc1C(N)=O	763962556	SQWKENWSLOCQPM-UHFFFAOYSA-N	430.486	1.524	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)on1)C(=O)Nc1cccc(C(=O)NC2CC2)c1	764015999	CBSSPMPHPFQQMB-UHFFFAOYSA-N	433.424	1.634	50	20	IDGD	
Cc1nnc(-c2cccc(NC(=O)C(=O)NNC(=O)c3cc(-c4ccccc4)on3)c2)n1C	764016750	MGZJXCMSRXITMR-UHFFFAOYSA-N	445.439	1.845	50	20	IDGD	
COCCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2OC)cc1Cl	764043816	WQSCOLYZMHPHTJ-UHFFFAOYSA-N	448.863	1.125	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cccc(OCC(=O)Nc3ccccc3)c2)n[nH]1	764106705	PXABWPQZOMLVCX-UHFFFAOYSA-N	436.428	1.135	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)C(=O)Nc2ccc(OC)nc2C)c1	764229902	DRQMYFWOYXVIJN-UHFFFAOYSA-N	437.250	1.569	50	20	IDGD	
CCOCCOc1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)c1scnc1C	764247326	QUHDDPUFXITAPG-UHFFFAOYSA-N	426.882	1.920	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccccn2)c2ccccc12	764267087	MXINTQXZYYCXGJ-UHFFFAOYSA-N	436.424	1.115	50	20	IDGD	
O=C(CCCc1cccs1)NNC(=O)C(=O)Nc1ccccc1C(=O)N1CCOCC1	764342127	VNNLFCKNJQZEEA-UHFFFAOYSA-N	444.513	1.329	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)C(=O)Nc1ccc(N2CCc3sccc3C2)nc1	764385542	ARRCTLJRUWYFSH-UHFFFAOYSA-N	436.497	1.809	50	20	IDGD	
Cc1cc2c(cc1C)O[C@@H](C(=O)NNC(=O)CN1CCN(C(=O)c3ccccc3)CC1)C2	765733102	NIHDTNVMUSNCHR-OAQYLSRUSA-N	436.512	1.212	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)c1[N+](=O)[O-]	765735338	KCIQQEYXUCJINX-UHFFFAOYSA-N	425.445	1.122	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)[C@@H](Br)C(C)(C)C)cc2)CC1	768310542	DGKPBORTWWEVEI-OAHLLOKOSA-N	447.399	1.875	50	20	IDGD	
COc1ccc(-c2cc(-c3nnc(SCC(=O)NNC(=O)C(C)(C)C)n3N)n[nH]2)cc1	768451989	OEMDOQVWWBYRJB-UHFFFAOYSA-N	444.521	1.343	50	20	IDGD	
C[C@@H]1CN(S(=O)(=O)c2cccc(C(=O)NNC(=S)Nc3ccccn3)c2)C[C@@H](C)O1	768585448	MOSRABIAFISVPT-ZIAGYGMSSA-N	449.558	1.511	50	20	IDGD	
O=C(NNC(=O)c1cc(F)ccc1Br)NC1CCN([C@H]2CCC[C@@H]2O)CC1	769154476	KLPGDZPWWZQCSU-HOTGVXAUSA-N	443.317	1.910	50	20	IDGD	
Cc1cnn(Cc2ccccc2F)c1NC(=O)C(=O)NNC(=O)COc1ccccc1O	769263929	ABDQEBAVAYMZHE-UHFFFAOYSA-N	441.419	1.249	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)c1cc(N2CCOCC2)ccn1	769422677	HPPYRDNJDKTABP-CYBMUJFWSA-N	449.305	1.909	50	20	IDGD	
CCCCCCn1cc(S(=O)(=O)NNC(=O)c2ccc(Cl)nc2)c(O)nc1=O	769628193	MLGJLEIDASNSNA-UHFFFAOYSA-N	429.886	1.201	50	20	IDGD	
CCCS(=O)(=O)N1CCC(NC(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)CC1	770144540	GWKHBWSYFNUJRM-CYBMUJFWSA-N	446.957	1.642	50	20	IDGD	
C[C@H](NS(=O)(=O)c1cccc(C(F)(F)F)c1)C(=O)NNc1ncccc1[N+](=O)[O-]	771029856	CAKOWZJAMHNHGN-VIFPVBQESA-N	433.368	1.819	50	20	IDGD	
O=C(NNC(=O)c1c[nH]nc1C1CC1)c1cccc(S(=O)(=O)NCc2ccccc2)c1	771608738	MXQQZUWMSBNXGZ-UHFFFAOYSA-N	439.497	1.840	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)CCc1nc(O)c2c3c(sc2n1)C[C@H](C)CC3	771950565	ZJFXPLLBEBAJBD-MNOVXSKESA-N	434.518	1.943	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)CCc1nc(C2(NC(C)=O)CCCCCC2)no1	772047886	ZXSIAUCWUJTOBH-CYBMUJFWSA-N	437.497	1.177	50	20	IDGD	
CC(C)C(=O)Nc1nc(CC(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)cs1	772192524	MOSTUWQOITZJOA-UHFFFAOYSA-N	437.909	1.397	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ccc(C(F)(F)F)cn2)c(OCC(=O)N(C)C)c1	773667370	OPDYVICVCORTGD-UHFFFAOYSA-N	439.394	1.958	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)[C@@H](CC)N2CCO[C@@H](CC)C2)c2ccccc2c1=O	773714890	YKAYSVAHOVXJJO-MAUKXSAKSA-N	429.521	1.457	50	20	IDGD	
CC(C)c1nccnc1NNC(=O)C(=O)Nc1ccc(S(=O)(=O)N(C)C(C)C)cc1	773993649	ZHXICTDAXSUNCM-UHFFFAOYSA-N	434.522	1.711	50	20	IDGD	
CNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)c1C	774008061	ITJJSRWTULHJHT-GFCCVEGCSA-N	432.864	1.561	50	20	IDGD	
CC(C)N1CC[C@@H](NC(=O)NNC(=O)C(=O)N2CCCC2)[C@@H]1c1ccc(Cl)c(F)c1	777750907	XSBMYPDUIQIKJN-SJORKVTESA-N	439.919	1.956	50	20	IDGD	
Cc1cccc(-n2cc(C(=O)N3CCN(S(=O)(=O)CBr)CC3)nn2)c1	777836255	HIDCEDPHQIPARU-UHFFFAOYSA-N	428.312	1.016	50	20	IDGD	
O=C1CCc2cc(NC(=O)C(=O)NNC(=O)c3cnn(-c4ccccc4)c3)c(F)cc2N1	778712785	ISKQYKHWQOKRRB-UHFFFAOYSA-N	436.403	1.296	50	20	IDGD	
O=C(NNc1ccc(Cl)cc1)C(=O)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1	783339893	PUHKGVAHPPRKMK-UHFFFAOYSA-N	438.893	1.443	50	20	IDGD	
Cc1ccc(NNC(=O)C(=O)Nc2ccc(S(=O)(=O)N3C[C@H](C)O[C@H](C)C3)cc2)cc1	783348414	DTLBCJBLSYBRHN-IYBDPMFKSA-N	446.529	1.875	50	20	IDGD	
O=C(NN=Cc1ncc(Br)cc1Br)[C@@H]1CCS(=O)(=O)C1	783822704	WJTMEAJEJJYFFJ-SSDOTTSWSA-N	425.102	1.491	50	20	IDGD	
CCNC(=O)N(C)NC(=O)C(=O)Nc1ccccc1S(=O)(=O)N(C)C1CCCCC1	784916979	FWNPKASBOUOJPE-UHFFFAOYSA-N	439.538	1.271	50	20	IDGD	
CC(=O)N1CCN(Cc2cccc(NC(=O)C(=O)NNc3cc(F)c(F)c(F)c3)c2)CC1	785083301	LXUUFPSNAHDBKF-UHFFFAOYSA-N	449.433	1.850	50	20	IDGD	
O=C(NNc1c(F)cc(C(=O)NC2CC2)cc1F)C(=O)Nc1ccnn1-c1ccncc1	785100034	NKRNSMUNECLYGM-UHFFFAOYSA-N	441.398	1.520	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2ccc(NC(=O)[C@@H]3CCCO3)cc2)n1	785225353	HEVVJAWEDYVNNH-INIZCTEOSA-N	441.492	1.522	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1cccc(OCCCC#N)c1	785330367	GHTQIKCATVUTIA-UHFFFAOYSA-N	446.485	1.863	50	20	IDGD	
O=C(NCc1nc(-c2cccc(F)c2)no1)NNC(=O)c1csc(N2CCOCC2)n1	787409168	USQWECMVZHMUNR-UHFFFAOYSA-N	447.452	1.313	50	20	IDGD	
O=C(CN1C(=O)c2cccc([N+](=O)[O-])c2C1=O)NNC(=O)NCc1ccc(Cl)cc1	787430589	DGLXXOUTQQEFNK-UHFFFAOYSA-N	431.792	1.375	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ccccc2[N+](=O)[O-])cc1C(=O)N1CCOCC1	787556111	SJKLFXWWFUUOIE-UHFFFAOYSA-N	427.417	1.457	50	20	IDGD	
Cc1cc([C@@H](CC(=O)NNC(=O)C(=O)NC(C)C)NC(=O)OC(C)(C)C)cc(Cl)n1	788495896	RKSLTPBIQZSZII-CYBMUJFWSA-N	441.916	1.671	50	20	IDGD	
O=C(CN1C(=O)c2cccc([N+](=O)[O-])c2C1=O)NNc1nnc(-c2ccccn2)s1	788554870	CLOYUMSGLUWYJW-UHFFFAOYSA-N	425.386	1.248	50	20	IDGD	
CN1C(=O)Cc2cc(NC(=O)C(=O)NNC(=O)COc3ccc(C(C)(C)C)cc3)ccc21	789732747	URYXAODLVPIBON-UHFFFAOYSA-N	438.484	1.668	50	20	IDGD	
O=C(NNC(=O)C1(S(=O)(=O)c2ccc(Cl)cc2)CCCC1)[C@@H]1CCS(=O)(=O)C1	790390759	MGSGJNCMFPGSAL-GFCCVEGCSA-N	448.950	1.009	50	20	IDGD	
COCC1(C)CN(C(=O)/C(C#N)=C/c2cn(CCC(N)=O)nc2-c2ccc(OC)cc2)C1	790423598	XODOHCBFKRTIJZ-LICLKQGHSA-N	437.500	1.836	50	20	IDGD	
C[C@H](C(=O)NNC(=O)Cc1ccccc1F)[C@@H](C)C(=O)NNC(=O)Cc1ccccc1F	790607227	STZQEVLWWGOFGY-OKILXGFUSA-N	446.454	1.317	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccccc1N1C[C@H]2CC[C@H]1C2	790951718	KFKYARAONSQXTC-HOTGVXAUSA-N	438.484	1.849	50	20	IDGD	
CC(=O)Nc1ccc(NS(C)(=O)=O)c(C(=O)NNc2cccc(F)c2[N+](=O)[O-])c1	791147662	GCROSVACQWGLRB-UHFFFAOYSA-N	425.398	1.821	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cnc(CC(C)C)nc2)cc1OC	792354907	MNQXEUGZKGPCJS-UHFFFAOYSA-N	429.477	1.872	50	20	IDGD	
CCOC(=O)c1ccc(NNC(=O)[C@@H](NS(=O)(=O)c2ccc(C)cc2)[C@@H](C)O)cc1C	794657976	MGHJDFCECPOPGG-BEFAXECRSA-N	449.529	1.651	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H]2CN(CC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)CC[C@H]21	795099296	MLKJPTUGNFBULM-NVXWUHKLSA-N	447.492	1.687	50	20	IDGD	
CNC(=O)c1cc(Cl)cc(S(=O)(=O)NNC(=O)c2ccc(Cl)nc2)c1OC	795304169	RVFXJUZMTGBDJO-UHFFFAOYSA-N	433.273	1.380	50	20	IDGD	
CCCc1c(NC(=O)C(=O)NNC(=O)CC2CC2)cnn1-c1cc(F)c(OC)cc1F	797002268	PRAPCJDBDNTXFM-UHFFFAOYSA-N	435.431	1.998	50	20	IDGD	
COc1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)CNC(=O)OCc1ccccc1	797369413	VOOCLSPKFOMPOT-UHFFFAOYSA-N	434.836	1.361	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@H]1CC(C(=O)NNC(=O)c2cc(-c3ccccc3)on2)=NO1	798857346	UEWGRTPRTUPLSY-CYBMUJFWSA-N	429.433	1.772	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1ccc(OC(F)(F)F)c(C#N)c1	799835233	YFMPMQXXHJIULK-UHFFFAOYSA-N	446.345	1.813	50	20	IDGD	
Cn1c(=O)n(C)c2cc(N3CCCCC3)c(NC(=O)NNC(=O)CC(F)(F)F)cc21	800591879	FJJZWCJXGANJDU-UHFFFAOYSA-N	428.415	1.972	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc2c(cc1Cl)CCC2=O)c1ccc(-n2cnnn2)cc1	800830803	ISPJNBJZPQRSEA-UHFFFAOYSA-N	432.849	1.068	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CN2C(=O)c3ccccc3N3C(=O)CC[C@]23C)cc1	801108592	PJIPYTKFHSZWLP-HSZRJFAPSA-N	449.467	1.080	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2CC(=O)N(c3ccc(Cl)c(F)c3)C2)cc1	801109243	XJTDLTLYFPWXRT-LBPRGKRZSA-N	432.839	1.927	50	20	IDGD	
O=C(NNC(=O)C1CCN(C2=NS(=O)(=O)c3ccccc32)CC1)Nc1ccccc1	801991379	NVRZIKXOPZDVGW-UHFFFAOYSA-N	427.486	1.700	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)[C@H]2CC(=O)N(Cc3ccccn3)C2)cc1Cl	802072349	MFCLGOLRAXUZIV-LBPRGKRZSA-N	447.879	1.954	50	20	IDGD	
COc1ccc(C2=NO[C@@H](CNC(=O)NNC(=O)Cc3cn4ccccc4n3)C2)cc1C	802356027	KPILHQRGNCZYEC-QGZVFWFLSA-N	436.472	1.717	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)c1ccc(Cl)c(S(=O)(=O)N2CCCC2)c1	804952749	RSGHWZQAPLKNNL-UHFFFAOYSA-N	447.908	1.857	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1cc(Br)c[nH]1)c1cccc(S(N)(=O)=O)c1	807150599	QHJSWODKYQDEFE-MRVPVSSYSA-N	430.284	1.130	50	20	IDGD	
O=C(NNC(=O)c1ccc(F)cc1Br)NC1CCC2(CC1)NC(=O)NC2=O	807544793	CEAIQAYMSRHOGV-UHFFFAOYSA-N	442.245	1.053	50	20	IDGD	
COc1cccc2c(C(=O)NN(C)C(=O)N3CCN(C(=O)OC(C)(C)C)CC3)n[nH]c12	809763511	OHKPKDSCTGHLER-UHFFFAOYSA-N	432.481	1.821	50	20	IDGD	
Cc1nc2ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc3c(C)cc(Cl)cc3C)cn2n1	810385965	HBOYVGGMXRWCGG-LBPRGKRZSA-N	444.879	1.861	50	20	IDGD	
CCOc1cc(Br)c(F)cc1NC(=O)C(=O)NNC(=O)c1cnn(C)c1	810387371	SWFPERRZUZKILN-UHFFFAOYSA-N	428.218	1.120	50	20	IDGD	
CC(C)Nc1ccc(S(=O)(=O)NCC(=O)NN=c2cc[nH]cc2Cl)cc1[N+](=O)[O-]	810507140	HTWICULSPVWEPV-UHFFFAOYSA-N	442.885	1.307	50	20	IDGD	
COC(=O)C1(CS(=O)(=O)NNC(=O)c2ccc(F)cc2Br)CCCC1	811683702	WKXINNUDJWQWLF-UHFFFAOYSA-N	437.287	1.886	50	20	IDGD	
CC(C)(C)OC(=O)NC/C=C\CNC(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	812470857	XPLFZLIFTIJQFN-FPLPWBNLSA-N	430.465	1.603	50	20	IDGD	
Cc1cc(NC(=O)CSCC(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)no1	812726669	JIXJHXSSLMIVDN-UHFFFAOYSA-N	427.508	1.048	50	20	IDGD	
CN(CC(=O)NNC(=O)Nc1ccc2c(c1)OCO2)S(=O)(=O)c1ccc(Cl)cc1	813467360	FKXWGFRMTXRMRR-UHFFFAOYSA-N	440.865	1.542	50	20	IDGD	
CCc1ccc(NC(=O)NNc2ccccc2S(=O)(=O)N(C)C)cc1S(N)(=O)=O	814638465	QXDKZRVYPYTMAT-UHFFFAOYSA-N	441.535	1.295	50	20	IDGD	
NS(=O)(=O)c1ccc(NC(=O)NN=Cc2c[nH]nc2-c2ccc3c(c2)OCCO3)cc1	814967475	LYWLQYNSPWPRAK-UHFFFAOYSA-N	442.457	1.651	50	20	IDGD	
CC(C)OCCCn1c(NNC(=O)CCn2cnccc2=O)nc2ccccc2c1=O	815604652	WUFWOLCDXBFMHU-UHFFFAOYSA-N	426.477	1.302	50	20	IDGD	
CS(=O)(=O)c1cc(Br)ccc1NC(=O)C(=O)NNc1cccc(Cl)n1	815726555	JYKUNJPVJTXDBY-UHFFFAOYSA-N	447.698	1.983	50	20	IDGD	
COc1cc(Cl)c(C)cc1NC(=O)C(=O)NNc1ccccc1S(=O)(=O)N(C)C	815750935	NDWBNUZIFQLWPP-UHFFFAOYSA-N	440.909	1.989	50	20	IDGD	
CN(C)N(C(=O)Cc1cc2c(cc1Br)OCCO2)[C@@H]1CCS(=O)(=O)C1	849193257	AFEBWKJWCLLZTD-GFCCVEGCSA-N	433.324	1.255	50	20	IDGD	
CCOc1ccc(N2C(=O)/C(=C/NNC(=O)CN3CCCC3=O)c3ccccc3C2=O)cc1	912745457	FWYAKFFVAFHOTM-XSFVSMFZSA-N	448.479	1.856	50	20	IDGD	
COc1ccc(C(=O)NCCCC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc1	914830566	GKXCRHZNMOCRTP-UHFFFAOYSA-N	437.456	1.558	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)Cn1ncc2ccc([N+](=O)[O-])cc21	915278282	WZRNQAUSRMALMK-UHFFFAOYSA-N	448.233	1.933	50	20	IDGD	
C[C@H](Cc1ccc(Br)cc1)NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	916645365	ANUCHEOHCKQABA-GFCCVEGCSA-N	444.293	2.000	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc2c(c1)nc(CCC(=O)NNC(=O)C(C)(C)C)n2C	917180138	FJPHUPDHDRQYJB-UHFFFAOYSA-N	437.566	1.730	50	20	IDGD	
COc1ccc(C(=O)NCCNC(=O)NNC(=O)c2cc(-c3ccc(C)cc3)[nH]n2)cc1	918221754	NHUWDEJNXTZCPR-UHFFFAOYSA-N	436.472	1.768	50	20	IDGD	
O=C(CNS(=O)(=O)c1c[nH]c2ncccc12)NNC(=O)C12CC3CC(CC(C3)C1)C2	918758487	WBIDNNPTSIHTNQ-UHFFFAOYSA-N	431.518	1.205	50	20	IDGD	
C[C@@H](Sc1ccc(Br)cc1)C(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1	919886321	REHWJTFNKXULMN-MWLCHTKSSA-N	436.353	1.447	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2ccccc2CSc2nc[nH]n2)c2ccccc2c1=O	920461549	ZHGDRPNIKLQLCR-UHFFFAOYSA-N	449.496	1.902	50	20	IDGD	
CCCNC(=O)NNS(=O)(=O)c1ccc(OS(=O)(=O)c2ccc(C)cc2)cc1	921019715	BJKAMWCLBMNFKQ-UHFFFAOYSA-N	427.504	1.665	50	20	IDGD	
CN1/C(=C(\C#N)C(=O)CSc2nnc([C@H]3CCS(=O)(=O)C3)n2C)Nc2ccccc21	1317716935	DBFCIRVJGAZSEU-DHPZXVACSA-N	444.542	1.675	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N[C@H]2CCN(Cc3cc(OC)cc(OC)c3)C2)cc1	1319126192	CDRXTBAJDFSNQX-KRWDZBQOSA-N	428.489	1.931	50	20	IDGD	
CNC(=O)Cc1ccccc1NC(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12	1320125046	NXGJGZNUPOKLHH-UHFFFAOYSA-N	436.472	1.732	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)F)cc1)c1n[nH]cc1I	1320447609	NTDMFOBYFMRUAQ-UHFFFAOYSA-N	442.185	1.768	50	20	IDGD	
Cn1cc(N2CC[C@@H](NC(=O)NNC(=O)COc3ccccc3Cc3ccccc3)C2)cn1	1322975137	LORRIWPPVUHDCN-HXUWFJFHSA-N	448.527	1.999	50	20	IDGD	
CS(=O)(=O)c1ccc(NCC(=O)NNC(=O)c2ccc(Br)cc2)cc1	1332420656	OUQQAPXDQMZYGP-UHFFFAOYSA-N	426.292	1.726	50	20	IDGD	
O=C(NNc1nccc(N2CCOCC2)n1)c1cn(-c2ccc(Br)cc2)nn1	1340463850	CEPIMWCXBVUQHR-UHFFFAOYSA-N	445.281	1.413	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)Cc3ccc4c(c3)CCCO4)C2)C1	1778270093	NRLVNZSIBBYWHM-PGRDOPGGSA-N	436.936	1.638	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4ncnn4c3)C2)C1	1778735508	ARMHMTCZBLOSOD-FZKQIMNGSA-N	436.310	1.204	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)o1	1779027345	OBDLXIDMDHXGQO-MSOLQXFVSA-N	432.304	1.918	50	20	IDGD	
COc1ccc([C@@H](O)C(=O)N2CCO[C@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)cc1	1779294860	QLEROKVHFDBUFY-CTNGQTDRSA-N	436.581	1.410	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)c3nc(O)n4c3CCCC4)C2)C1	1779346960	AZDUQRSGTPWLDH-OALUTQOASA-N	445.347	1.605	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)cc1OC	1780657035	XRYMBIZPXNFXDC-OAQYLSRUSA-N	436.581	1.999	50	20	IDGD	
CCC(=O)N[C@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@](C)(Cl)CCl)C1	1780706699	NYWHSUXOCDVFRB-TWKYDXJASA-N	436.380	1.651	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)Cc3ccc(OC)cc3[N+](=O)[O-])CCO2)C1	1781216567	LRCIBEAFESQRQN-OXJNMPFZSA-N	439.896	1.993	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCSC(=N)N)C2	1781899960	IDMDWROFMOSKFN-PBFPGSCMSA-N	449.415	1.691	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc([N+](=O)[O-])o3)[C@H]2C1	1783357640	CMQOIFZLAFNCOH-UHXUPSOCSA-N	444.282	1.812	50	20	IDGD	
COc1ccc2[nH]cc(C(=O)N3CCO[C@@]4(CCN(C(=O)C(Cl)Cl)C4)C3)c2n1	1783948275	HLLGSSHOOBRWCL-GOSISDBHSA-N	427.288	1.819	50	20	IDGD	
C[C@H](Sc1ccccc1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]2C1	1784083948	IHFRKFSNSSXETH-IAVJCBSLSA-N	426.966	1.747	50	20	IDGD	
CCOC(=O)N1CCC(C(=O)N2CC[C@]3(CN(C(=O)C(Cl)Cl)CCO3)C2)CC1	1785374802	DUAWVVBUXOXBPJ-GOSISDBHSA-N	436.336	1.489	50	20	IDGD	
C#CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Cl)CCO2	1785574418	JFZPLGKQDNLIBL-NJSLBKSFSA-N	431.892	1.267	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3F)[C@H]2C1	1787196612	ZHPREGRWLDTRPR-PCBIJLKTSA-N	428.302	1.988	50	20	IDGD	
COC(=O)c1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)C(Cl)Cl)C[C@@H]32)cn1	1787607262	SHDDUMFMZCGFQZ-OBJOEFQTSA-N	430.288	1.265	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4nccn4c3)[C@H]2C1	1788055454	BDQDUOSMURZHPF-IWCQGFGOSA-N	449.349	1.959	50	20	IDGD	
Cc1nc[nH]c1CSCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21	1788541237	KPKSOGKSFZPJMF-OBJOEFQTSA-N	435.377	1.735	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)c1ccc(Cl)nc1Cl	1788828376	NYKIYLUAWIKFFU-SYEHKZFSSA-N	436.723	1.581	50	20	IDGD	
CC(C)n1nccc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)Br)C[C@@H]21	1788934008	ZETNEUVNIKYLIS-YXWQFLTLSA-N	427.343	1.841	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cn4ccccc4n3)C[C@@H]21	1791058088	YENWBFYDXPROPQ-YXWQFLTLSA-N	435.322	1.711	50	20	IDGD	
Cc1cc(C)n(CCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](C)Br)[C@H]3C2)n1	1791065381	WRVUUSNHPUHGTK-QAETUUGQSA-N	441.370	1.653	50	20	IDGD	
Cc1cnn([C@H](C)C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]32)c1	1791596917	MSXNOYFENYMOKL-CUGJGTHOSA-N	431.364	1.969	50	20	IDGD	
COC(=O)N[C@@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2)c1ccccc1	1792803670	AZKZOGURNDEXJF-LXTVHRRPSA-N	444.315	1.477	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nccc3nc[nH]c13)C2	1792868074	OKJZKNALELTEPV-NRWUCQMLSA-N	436.310	1.192	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(S(C)(=O)=O)cn1	1794749802	NXCAOGNYCXPIRO-SJBDTSRBSA-N	448.372	1.973	50	20	IDGD	
COc1cccc(OC)c1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCBr	1795114932	NZQJWDVSUXLRFC-IVWMJMPLSA-N	441.322	1.692	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnc(C(C)(C)C)cn1	1796761561	YKHPEJMLDLLEOB-JFILPPLUSA-N	439.354	1.761	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1CCC(O)CC1)C2	1796893151	LSOZLLDFJBAKCI-XSNQLHRBSA-N	429.521	1.310	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)COc1ccc(F)cc1)C2	1798439190	NHDXXYXJAYPXBK-MUJYYYPQSA-N	441.463	1.155	50	20	IDGD	
C/C(=C\c1ccc(C)o1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnccc1C(=O)NN	1798440726	XBPIWHNGCDVWHA-XYDLKOIESA-N	437.500	1.942	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1CN(C)C1)C2	1799220305	DCNRYNQVZFDRSN-MUJYYYPQSA-N	430.461	1.334	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2)c1c(F)ccc(O)c1F	1799726709	ZCIJPENQKLREKR-WRBXQSRGSA-N	433.249	1.659	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](CCO)NC(=O)OC(C)(C)C)C2	1800067680	LWEANJWTBPZFBX-JKJDWNRSSA-N	431.961	1.918	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2nn[nH]c2c1	1800139679	UCGRFWZSDWTDDT-YGSHXTJESA-N	436.310	1.192	50	20	IDGD	
C[C@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](F)Br)[C@@H]1SC(=N)NC1=O	1800159277	PKBTVPCJUHYRHF-CQZONYGUSA-N	435.319	1.118	50	20	IDGD	
O=C(Cc1cccc(F)c1F)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2	1800665246	UULOLYHRASUEMG-OXUXUCFPSA-N	435.240	1.787	50	20	IDGD	
C[C@H](Nc1nccs1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)Br	1800757811	QNYBQQWVQMFUDE-RXGFPQBGSA-N	431.356	1.317	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1n[nH]c3cc(Cl)ccc13)C2	1800977191	TWCXMIGPHBWFGT-YHYOWMERSA-N	441.315	1.673	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(NC(=O)C3CC3)cc1)C2	1800977832	YYSILGWSWHOVJN-UKBAYJJMSA-N	449.935	1.492	50	20	IDGD	
CN(C)C(=O)NCC(=O)NC[C@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1	1802675677	SVWDGQVQQCAJSQ-PBHICJAKSA-N	440.342	1.144	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H](CNC(=O)c2ncn(C)n2)[C@H]1c1cccnc1	1805317960	JSEIGDVEWCYYIT-BPLDGKMQSA-N	435.326	1.561	50	20	IDGD	
CCC(=O)N[C@H](C)C(=O)N1CC[C@H](CNC(=O)CCBr)[C@H]1c1cccnc1	1806343332	UZXDCVRLTGAORV-DDUZABMNSA-N	439.354	1.787	50	20	IDGD	
CN(C)c1cccc(OCC(=O)N2CCCC3(CCN(C(=O)[C@H](O)CCl)CC3)C2)c1	1806733520	ZLSKAXCFMMGRKV-LJQANCHMSA-N	437.968	1.962	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC2(CCCN(C(=O)c3cnc(OCF)cn3)C2)CC1	1807655740	MUSUIDVQRGNAMQ-CQSZACIVSA-N	428.892	1.881	50	20	IDGD	
C[C@H](Cc1ccncc1)C(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1	1812334163	NDMSPINHAMFBBW-NMLACTOBSA-N	430.936	1.961	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)Cc2cncnc2)[C@H]1c1cccnc1	1812864608	JDIUNKDMNGWFKY-XCRHUMRWSA-N	432.322	1.904	50	20	IDGD	
CCC[C@H](NC(C)=O)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](Cl)COC)[C@H]1c1cccnc1	1814132143	SZUBTGAODXXZER-VJANTYMQSA-N	438.956	1.646	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)C(C)(C)NCCC#N)sc2C1	1814985343	FLOROUQNWFYLAA-NWDGAFQWSA-N	427.958	1.591	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)C13CC(C1)C3)CC2	1817282533	IEWIXELLADTSKR-CLCPWWMLSA-N	440.529	1.989	50	20	IDGD	
CC[C@H](NC)C(=O)Nc1cc([C@H]2CCCCN2C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[nH]n1	1817462582	FRICTEQCTYHBBD-YIDGYCTFSA-N	442.524	1.534	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccno2)[nH]n1	1818111429	KMJUVJPELVSEGP-ZIFAQYRBSA-N	438.448	1.838	50	20	IDGD	
CC[C@@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CN2CCS(=O)(=O)CC2)[nH]n1	1820853289	HZDRCDSIJZAXPD-UKRRQHHQSA-N	445.973	1.150	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)CN2C(=O)C=CC2=O)[nH]n1)[C@@H](F)Br	1820938488	WHJIVAVUVPVYAX-MEBBXXQBSA-N	442.245	1.017	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)C/N=C/c2ccco2)[nH]n1	1822414584	IDVFKXSRUOQQBO-KOWBDXASSA-N	443.508	1.487	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)COc1cccnn1)CC2	1826009060	LLHWCODVUPABTP-GHMZBOCLSA-N	425.898	1.178	50	20	IDGD	
CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@H](F)Cl)CC1	1827615724	GWEMBIYHFRSWEN-KURKYZTESA-N	441.935	1.611	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CN(C)C)CC1	1827681218	PZMHSWQYEUNWQZ-GXDFBKAQSA-N	430.553	1.302	50	20	IDGD	
CC(C)(C#N)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1	1828922334	SPQAOMPTKNWUPU-SFHVURJKSA-N	426.521	1.468	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cn4ncccc4n3)C2)C1	1831646304	JYDGGVHLHAATLS-MGPUTAFESA-N	435.912	1.207	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)n3ccccc3=O)C2)C1	1831651517	QJSKNKZSHWJPPY-WWMYMODYSA-N	439.940	1.273	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)/C=C/c3ccoc3)CCO2)C1	1832651640	OQNCKHCGRBZNBR-KTBRJVSMSA-N	431.316	1.986	50	20	IDGD	
Cc1n[nH]cc1C(=O)N1CCC(N2CCC(NC(=O)[C@@H](C)CBr)CC2)CC1	1833263747	ZKLQUXHJQPHIOW-ZDUSSCGKSA-N	440.386	1.934	50	20	IDGD	
CC(C)(C)c1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)ccn1	1833367804	GTJPYHDDWQGECG-IERDGZPVSA-N	439.940	1.049	50	20	IDGD	
COc1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)n1	1833767128	SREVIEGCEKKTNW-HXUWFJFHSA-N	437.569	1.012	50	20	IDGD	
CC(C)c1nc(CC(=O)NC2CCN(C3CCN(C(=O)[C@H](F)Cl)CC3)CC2)no1	1833784008	VCHWANLRSQKSAO-KRWDZBQOSA-N	429.924	1.842	50	20	IDGD	
Cc1cnc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)s1	1833804445	VWHQTDXKGDYLBL-IAQYHMDHSA-N	436.303	1.212	50	20	IDGD	
Cn1nccc1C(=O)NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1	1834212356	ANESRRWWSRNMQF-UHFFFAOYSA-N	426.359	1.390	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836670321	MJJWZJCCPDEXJX-WFASDCNBSA-N	439.778	1.616	50	20	IDGD	
O=C(c1cccc(-c2cnccn2)c1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1838592231	XBUBOSXJZMJLOW-RXVVDRJESA-N	448.882	1.748	50	20	IDGD	
O=C(c1c(F)cccc1Cl)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1	1838868012	FEFHBIWTIIIIDV-KSSFIOAISA-N	435.279	1.149	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccc4c(c3)OCO4)C2)C1	1839143784	HZJBKJMHSIWIEC-HRAATJIYSA-N	438.908	1.432	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc([N+](=O)[O-])cc3F)CCO2)C1	1839278382	ONNYJJYSYHTUOQ-BEFAXECRSA-N	443.859	1.821	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(O)cc3F)CCO2)C1	1839317031	HKFRDJNNPZPIKU-OALUTQOASA-N	449.306	1.838	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc4nn[nH]c4c3)CCO2)C1	1839628172	SQOVQRRSQXIEJK-MGPUTAFESA-N	435.912	1.435	50	20	IDGD	
C[C@H](Cc1ccncc1)C(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1839656677	YKQVNCADAZEJJB-VGOFRKELSA-N	437.968	1.982	50	20	IDGD	
CC(C)=NO[C@H](C)C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](C)Br)CCO2)C1	1840034422	KVBNOWRXDXOUGX-VBQJREDUSA-N	434.331	1.027	50	20	IDGD	
C#CCCCCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)CBr)C2)C1	1840291541	USQVSQOFAKBYME-LPHOPBHVSA-N	429.355	1.667	50	20	IDGD	
C[C@H](Sc1ccccn1)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1840390669	FKFZOFRXGZRTIE-JCKWVBRZSA-N	431.917	1.553	50	20	IDGD	
CCC[C@H](NC(C)=O)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1840851898	WMBQDUWZTMOAES-JXFKEZNVSA-N	431.961	1.013	50	20	IDGD	
O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1840898847	XGOGCIILXPFHSB-UCHJRYNZSA-N	441.843	1.599	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC2(CCCN2C(=O)c2cnc(N)s2)C1	1842979827	FDLMVLALJJVHEE-NSHDSACASA-N	443.957	1.674	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H](C(=O)N2CC3(CCCN3C(=O)[C@@H](F)Cl)C2)[C@H]2OCC[C@H]21	1843366640	JJGRMRLKWMYCGD-GBJTYRQASA-N	445.919	1.749	50	20	IDGD	
COc1cscc1C(=O)N1CC2(CCCN2C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C1	1843416026	QHMLUEKAQFMMFM-LPYMAVHISA-N	429.502	1.708	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)[C@H]2[C@H]3c4ccccc4S[C@H]32)C1	1844272205	BQOQUOFRJTZTQD-CEXWTWQISA-N	449.536	1.390	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H]2C[C@@]2(C(=O)N2CCCC23CN(C(=O)[C@@H](O)CCl)C3)C1	1846126242	RAUFFPUUKQRNJC-LAPQFRIASA-N	427.929	1.047	50	20	IDGD	
CC(C)(C)OC(=O)N1CC=C(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](O)CCl)CC1	1847567950	GPEHGYQRPWUIIV-JYJNAYRXSA-N	427.929	1.355	50	20	IDGD	
C=CCNS(=O)(=O)c1ccc(C(=O)NNc2nc3ccccc3c(=O)n2CC)cc1	9857494	NEWOMRBUSLWAPG-UHFFFAOYSA-N	427.486	1.638	50	20	IDGD	
O=C(CSc1ccc2c(c1)OCCO2)NNC(=O)c1nn(-c2ccccc2)cc1O	13082303	MHBAJIQYMQNTGI-UHFFFAOYSA-N	426.454	1.902	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c1	15314725	ATOFQRSDEBJNNL-UHFFFAOYSA-N	430.530	1.063	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)CCn1c(=O)[nH]c(=O)c2ccccc21	18053449	ROIIOEFWVHGBKZ-HNNXBMFYSA-N	446.463	1.848	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)NNC(=O)c1ccc2c(c1)C(=O)N(C[C@@H]1CCCO1)C2=O	25489413	NGGBCTMNCOGZCG-INIZCTEOSA-N	446.463	1.947	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N(C)C)o2)ccc1OC(C)C	43832265	JMABCMHDHZTBAU-UHFFFAOYSA-N	425.463	1.401	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c1I	72002701	RZAIZTAXMYANGG-UHFFFAOYSA-N	448.224	1.650	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)NCCOc1cccc(Br)c1	725872350	VWFUOMVUKJSLPY-UHFFFAOYSA-N	425.239	1.181	50	20	IDGD	
O=C(CN1C(=O)Cn2c(cc3ccccc32)C1=O)NNC(=O)c1cc2ccccc2cc1O	725879920	QFFDJPBZPYHLFL-UHFFFAOYSA-N	442.431	1.944	50	20	IDGD	
O=C(NNC(=S)NC1CCOCC1)c1cccc(S(=O)(=O)NCc2ccccc2)c1	727782378	OXSPNPMBXOPOMO-UHFFFAOYSA-N	448.570	1.453	50	20	IDGD	
O=C(NNC(=S)NCC1CCC1)[C@@H]1CCCN(S(=O)(=O)c2ccc(F)cc2)C1	727866420	HHUGOYCQPJUIKN-CQSZACIVSA-N	428.555	1.522	50	20	IDGD	
CN1CCN(C[C@@H](NC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c2ccccc2)CC1	727944507	DNSARYRHUOTZCO-LJQANCHMSA-N	426.477	1.528	50	20	IDGD	
COc1cc(CC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)ccc1C	728214541	RHPAGHPJMIDBLY-UHFFFAOYSA-N	432.546	1.626	50	20	IDGD	
O=C(CCC(=O)N1CCOCC1)NNc1ccc(S(=O)(=O)Nc2ccccc2)cc1	728215932	WNKSNGJBMCZTHM-UHFFFAOYSA-N	432.502	1.570	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NN=Cc1sc(N2CCOCC2)nc1-c1ccccc1	728437981	ZDMDSJPDVWCVMH-CYBMUJFWSA-N	437.547	1.035	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)c2cccc(NS(C)(=O)=O)c2)c1	728528791	MKHVRBNEZKEFEZ-UHFFFAOYSA-N	442.291	1.904	50	20	IDGD	
CC(C)[C@H](C(=O)OCC(=O)NNC(=O)c1cccs1)S(=O)(=O)C1CCCCC1	728647556	FXMGQFFHHQUECY-MRXNPFEDSA-N	430.548	1.824	50	20	IDGD	
N#Cc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)c3cccc(C#N)c3)CC2)cc1	728828381	OJALOBDTYKRVHS-UHFFFAOYSA-N	437.481	1.292	50	20	IDGD	
CC(C)c1nc(C(=O)NNC(=O)C(=O)NC2CC2)nn1-c1c(Cl)cccc1Cl	728858650	VSKDMDSAAIONMV-UHFFFAOYSA-N	425.276	1.737	50	20	IDGD	
COc1ccc(CCNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1OC	728938974	SWDGKKKAKQZYJS-UHFFFAOYSA-N	428.493	1.283	50	20	IDGD	
C#CCN1CCC(C(=O)NNc2nc3ccccc3c(=O)n2CCCOC(C)C)CC1	729279914	VOVSMILRKKOJTG-UHFFFAOYSA-N	425.533	2.000	50	20	IDGD	
Cc1cc(S(C)(=O)=O)c(C)c(S(=O)(=O)NNC(=O)Cn2ccc3ccccc32)c1	730203942	ZQMYDPYTKNHGEX-UHFFFAOYSA-N	435.527	1.671	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)c2sccc2S(=O)(=O)N(C)C)c1C	732053400	AKBLLUSIZLKFMK-ZDUSSCGKSA-N	425.532	1.844	50	20	IDGD	
C[C@H](c1nc(-c2cccs2)no1)N1CCN(CC(=O)NNC(=O)c2ccccc2)CC1	732984439	UMPOXSAPTCTUOP-OAHLLOKOSA-N	440.529	1.938	50	20	IDGD	
CN1CCC(N2CC[C@@H](NC(=O)NNC(=O)CSc3ccc(Cl)cc3)C2)CC1	734282706	BDXWCKDFFVWWNH-OAHLLOKOSA-N	425.986	1.931	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)c1cc(I)c[nH]1	734417061	IKUKHUZPLMAMLA-UHFFFAOYSA-N	429.214	1.858	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)Cn2c(=O)cnc3ccccc32)CC1	734825398	DKGLVZDKSKXUQI-UHFFFAOYSA-N	444.492	1.126	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2ccc3ccccc3c2)CC1	735117510	VGDLCWFRTCTKHN-UHFFFAOYSA-N	425.514	1.928	50	20	IDGD	
C=CCOc1ccccc1C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	735118021	NARXLQPVTXCHMS-UHFFFAOYSA-N	431.518	1.339	50	20	IDGD	
O=C(NNC(=O)c1cc(-n2cccn2)ccn1)c1cccc(S(=O)(=O)N2CCCC2)c1	735989331	XGKHPQZROGOBMT-UHFFFAOYSA-N	440.485	1.127	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)[C@@H]1CS[C@H](Cc2ccccc2F)C(=O)N1	737923142	LZBXJCYVEITYNC-ZWKOTPCHSA-N	431.489	1.333	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)[C@H]1COc2ccccc2O1)[C@H]1CN(Cc2ccccc2)CCO1	741280949	KPFNEWKEIMAZNT-ZLGUVYLKSA-N	440.500	1.446	50	20	IDGD	
O=C(COC(=O)c1cccc(CN2CCOCC2)c1)NNC(=O)c1ccc([N+](=O)[O-])cc1	741336077	ISLHPSBFLNVDPV-UHFFFAOYSA-N	442.428	1.045	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2cc([N+](=O)[O-])c(C)cc2F)cc(OC)c1OC	742025289	LPGYZNXLHNWAOZ-UHFFFAOYSA-N	443.409	1.691	50	20	IDGD	
Cc1cc(-n2cncn2)ccc1C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	742033240	KVYDJQASXUHAIE-UHFFFAOYSA-N	433.516	1.549	50	20	IDGD	
O=C(O)COc1ccc(C=NNC(=O)CNC(=O)c2cccs2)cc1Br	743437877	IBUIGNSHFDKNCC-UHFFFAOYSA-N	440.275	1.854	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)N[C@@H]1CC(=O)N([C@H]2C[C@@H]2c2ccccc2)C1	743510501	XIRFKCKFCGCHGA-NUJGCVRESA-N	426.448	1.692	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)c2ccc(S(=O)(=O)CCCC#N)cc2)c1	744901857	ZDJBRQRJOTXBNG-UHFFFAOYSA-N	443.481	1.691	50	20	IDGD	
C[C@@H]1Cc2ccccc2N1S(=O)(=O)c1cccc(C(=O)NNC(=O)N2CCOCC2)c1	745992490	BPLAHONRCGMVMU-OAHLLOKOSA-N	444.513	1.513	50	20	IDGD	
Cc1nc(S(=O)(=O)N2CCC(C(=O)NNc3cc(F)c(F)c(F)c3)CC2)cn1C	746702755	ZVPHZSLGOODSNU-UHFFFAOYSA-N	431.440	1.690	50	20	IDGD	
N#Cc1ccc(NNC(=O)[C@@H]2CC(=O)N([C@H]3CCS(=O)(=O)C3)C2)cc1C(F)(F)F	746894714	ODBXZAZDWZMCMR-YPMHNXCESA-N	430.408	1.056	50	20	IDGD	
COC(=O)c1ccc(OC)c(S(=O)(=O)NNC(=O)c2ccc(Cl)cc2OC)c1	747602181	OHXPKJKWLPTDFJ-UHFFFAOYSA-N	428.850	1.767	50	20	IDGD	
O=C(NNc1ccccc1Br)C1=NN([C@H]2CCS(=O)(=O)C2)C(=O)CC1	748058651	SVIYEXJFHROTFC-JTQLQIEISA-N	429.296	1.058	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)C1CCN(C(=O)OCc2ccccc2)CC1	751201953	NYUMSEUZDQZTPI-UHFFFAOYSA-N	428.445	1.206	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C1CCC(NC(=O)CC2CCCC2)CC1	751211331	GEUZZFFEPVOZIP-UHFFFAOYSA-N	434.562	1.881	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CCc2c(C)nc(-c3cccnc3)nc2O)cc1OC	751291901	YWUAEUHWJQSNHZ-UHFFFAOYSA-N	437.456	1.964	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](CC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)C1CC1	752004118	NVAZJNGXHGBKJF-MRXNPFEDSA-N	432.525	1.534	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)CC[C@H](C)CC(=O)NNC(=O)c1ncccc1C	752236895	LUVBSPYQPNPJEC-ZDUSSCGKSA-N	426.477	1.122	50	20	IDGD	
C[C@H](NS(=O)(=O)c1cccc(C(F)(F)F)c1)C(=O)NNc1cc(Cl)nc(N)n1	753463237	CCJGHAHHSKBZBI-ZETCQYMHSA-N	438.819	1.541	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)Nc1nnc(SCc2ccccc2)s1	755417255	KLDHVGYYWGNYLF-LLVKDONJSA-N	427.533	1.418	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)Nc1ccc(S(=O)(=O)C(F)F)cc1	755445171	WPTUJULBVFMPHI-UHFFFAOYSA-N	444.372	1.823	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)Nc2cccc(S(=O)(=O)NC3CC3)c2)cc1	755586296	UIDPCUSVDOQKRR-UHFFFAOYSA-N	434.474	1.368	50	20	IDGD	
Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)NNC(=O)[C@H](C)NS(C)(=O)=O	756212854	RTWPKWDDAQREQE-ZDUSSCGKSA-N	431.474	1.749	50	20	IDGD	
Cc1ccc2nc(-c3cccnc3)cc(C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)c2c1	758035958	OSRHBQOIXBFLHL-ZDUSSCGKSA-N	427.486	1.304	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)c2cc(Br)ccc2n1	758046738	JQVWBCNDWDTIMI-SECBINFHSA-N	429.296	1.004	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)sc1Br	758070842	HMOQJCVZBGEHNP-UHFFFAOYSA-N	437.275	1.841	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)N[C@H]1CN(C(=O)OC(C)(C)C)C[C@H]1C#N	758751954	LPAUHXUQOXDKQO-GUTXKFCHSA-N	435.456	1.682	50	20	IDGD	
Cc1ccc(-n2cnnc2SCC(=O)NNC(=O)C(=O)Nc2ccccn2)cc1Cl	758829492	ZKHIFOLIWOLWIB-UHFFFAOYSA-N	445.892	1.502	50	20	IDGD	
CC(C)[C@@H](NC(=O)Cc1ccc2ccccc2c1)C(=O)NNC(=O)C(=O)Nc1ccccn1	758831302	FGSCFQJJHDIRNO-OAQYLSRUSA-N	447.495	1.704	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)[C@@H]1CCCN(CCI)C1	759350516	FEVNWQLXOJWQCA-GFCCVEGCSA-N	425.311	1.774	50	20	IDGD	
COc1ccc(OC)c(CCCNC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c1	759617970	HRXWVYPIPZFYEW-UHFFFAOYSA-N	439.472	1.528	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)c2ccc(S(=O)(=O)N3C[C@H](C)O[C@@H](C)C3)cc2)nc1	759738770	PZSGJQAYKLWYTQ-KBPBESRZSA-N	448.501	1.423	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)C2=CC=CN3CCS(=O)(=O)N=C23)cc1OC	761323109	HGPNGHXYZMWQRN-UHFFFAOYSA-N	448.501	1.133	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)N[C@@H]1CCCN(c2ccn(C)n2)C1=O	761717609	MFVOMVDPBUZEFW-CYBMUJFWSA-N	432.506	1.047	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)C(=O)Nc1c2c(nn1-c1ccccc1)CCC2	763454296	GPJZVBUCLJKUOT-UHFFFAOYSA-N	434.412	1.669	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccccc2OC)c1	763509940	XCZJLQIGJBHYGA-UHFFFAOYSA-N	448.501	1.125	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2ccc3c(c2)NC(=O)[C@H](C)O3)c1	763667557	BGKSWTXVSXBCEP-ZDUSSCGKSA-N	426.429	1.188	50	20	IDGD	
CN(C)C(=O)c1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2F)ccc1Cl	763678604	IHMQWRBCPMIBHF-UHFFFAOYSA-N	436.827	1.346	50	20	IDGD	
C[S@](=O)c1ccc(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)cc1F	763729329	VZFPPCZTHQAKIA-PMERELPUSA-N	432.477	1.102	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2cccc(N3CCCC3=O)c2)c1	763771678	DNAWKQOCZLZULZ-UHFFFAOYSA-N	426.429	1.230	50	20	IDGD	
Cc1cn(-c2ccccc2)nc1NC(=O)C(=O)NNC(=O)COc1ccccc1[N+](=O)[O-]	763802312	AMRRFOWTJYTOFS-UHFFFAOYSA-N	438.400	1.254	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)C(=O)Nc1nc(-c2ccccc2)cs1	763804237	QYGNUTIIKPAGHT-UHFFFAOYSA-N	441.425	1.883	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccc(Oc2ccncc2)c1	763813305	KQXPFUXVZGSHID-UHFFFAOYSA-N	431.408	1.910	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccc(F)c(C(=O)N(C)C)c1	763850915	QSBMMOXPZGPZHR-LLVKDONJSA-N	434.399	1.220	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ccc(OC(C)C)c(OC)c2)cn1C	763921704	NVMZODNLLXDZNG-UHFFFAOYSA-N	446.460	1.397	50	20	IDGD	
COC(=O)CNC(=O)Cc1ccc(NC(=O)NNC(=O)CSc2ccccc2O)cc1	763928560	CNWJVPUIJOXTGI-UHFFFAOYSA-N	446.485	1.169	50	20	IDGD	
O=C(NNC(=O)c1cc2c(s1)CCCCC2)C(=O)Nc1cccc(-n2cnnn2)c1	763962212	NOXZXSPCOBOCJE-UHFFFAOYSA-N	425.474	1.392	50	20	IDGD	
CC(C)(C)OC(=O)NCCOc1ccc(NC(=O)C(=O)NNC(=O)c2ccc[nH]2)cc1	763979762	LBLSRNMZKHFAGQ-UHFFFAOYSA-N	431.449	1.318	50	20	IDGD	
Cc1cccc(C)c1Oc1ccccc1NC(=O)C(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1	764002458	MNBFYUZBTVYXKL-HNNXBMFYSA-N	445.497	1.616	50	20	IDGD	
O=C(NNC(=O)c1cccc(Br)c1)C(=O)Nc1cnn(C[C@@H]2CCCO2)c1	764058184	DJQJFWCIXUFOJX-AWEZNQCLSA-N	436.266	1.224	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(O[C@H]3CCOC3)cc2)o1	764139036	NHFSDDZSFJKTAB-SFHVURJKSA-N	444.488	1.689	50	20	IDGD	
CCN1CCN(Cc2ccc(NC(=O)C(=O)NNC(=O)CCc3ccco3)cc2)CC1	764169135	LFIDIKGPGNXPSU-UHFFFAOYSA-N	427.505	1.136	50	20	IDGD	
C[C@@H]1CN(C(=O)c2ccc(NC(=O)C(=O)NNC(=O)c3ccc(C#N)cc3)cc2)C[C@@H](C)O1	764177518	QGMZYKYTCZKOOQ-HUUCEWRRSA-N	449.467	1.207	50	20	IDGD	
CC(C)CCC(=O)NNC(=O)C(=O)Nc1ccc(C(=O)N(C)[C@H]2CCCN(C)C2)cc1	764203134	KEFUTCRDZCSPMI-SFHVURJKSA-N	431.537	1.375	50	20	IDGD	
CCOCC(=O)NNC(=O)C(=O)Nc1c(C)c(C)nn1-c1ccc(Br)cc1	764317132	FQNWWEKPISTGSR-UHFFFAOYSA-N	438.282	1.374	50	20	IDGD	
Cc1ccnc(Oc2ccc(NC(=O)C(=O)NNC(=O)COCc3ccccc3)cc2)n1	764367800	MISKAHGGISKNAP-UHFFFAOYSA-N	435.440	1.880	50	20	IDGD	
Cc1nc(-c2cccc(NC(=O)C(=O)NNC(=O)c3cc(-c4ccc(F)cc4)[nH]n3)c2)no1	764387252	HETSDMQCTALLAN-UHFFFAOYSA-N	449.402	1.974	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)C[C@@H]2COC(=O)C2)c1	764455537	ADWZDOILKUYPNP-ZDUSSCGKSA-N	447.469	1.210	50	20	IDGD	
O=C(NNC(=O)[C@H]1C[C@H]1c1cc(F)c(F)c(F)c1)c1csc(N2CCOCC2)n1	766630116	MSYWEOUWVASBDM-QWRGUYRKSA-N	426.420	1.962	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)c1c[nH]c2ncccc12	766661848	ZMQQXWJHKUDMQG-UHFFFAOYSA-N	426.908	1.795	50	20	IDGD	
O=C(Cn1cc(Br)cc([N+](=O)[O-])c1=O)NNC(=O)c1ccccc1Cl	767209150	JVEBWLCQULJCIS-UHFFFAOYSA-N	429.614	1.634	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)c1[N+](=O)[O-]	767923807	JUBXJMNKPKQZKI-UHFFFAOYSA-N	437.453	1.947	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)CCc3nc(O)c4cnn(C)c4n3)n[nH]2)cc1C	768264339	YUCSZPIBMXUPDM-UHFFFAOYSA-N	434.460	1.470	50	20	IDGD	
O=C(Cc1ccc(S(=O)(=O)CC(F)(F)F)cc1)NNC(=S)Nc1ccccn1	768578274	FXGUBVZWSJFADO-UHFFFAOYSA-N	432.449	1.978	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)C[C@@H]2C=CS(=O)(=O)C2)c2ccccc2c1=O	769321938	IOQFPZZYKRRRHE-AWEZNQCLSA-N	432.502	1.296	50	20	IDGD	
CCN(CC)CCOc1ccc(CNC(=O)NNc2nc(O)c3cnn(C)c3n2)cc1	770342016	PPFPYXOECIEQEB-UHFFFAOYSA-N	428.497	1.616	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)N2CCN(CC(=O)NNC(=O)c3ccc(F)cc3)CC2)c1	770728761	NHGJIBLQOZLETO-UHFFFAOYSA-N	442.491	1.427	50	20	IDGD	
CCN1CCN(C(=O)c2ccc(NC(=O)C(=O)NNc3c(C)cccc3F)cc2)CC1	770822167	ZBFSEMRMKLDASS-UHFFFAOYSA-N	427.480	1.994	50	20	IDGD	
CC(C)NS(=O)(=O)c1cccc(C(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)c1	770966745	AECIGUXBUHSPJT-UHFFFAOYSA-N	447.521	1.731	50	20	IDGD	
Cc1noc(-c2ccccc2)c1NC(=O)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	773495621	DYERUMVAEQWLCA-UHFFFAOYSA-N	449.471	1.443	50	20	IDGD	
Cn1nc(-c2cc(F)cc(F)c2)cc1NC(=O)C(=O)NNC(=O)COc1ccccc1F	773526286	YEKJPFJXNSUMSC-UHFFFAOYSA-N	447.373	1.669	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1N1CCOCC1	776710742	AEEWMMKOGGNLLE-UHFFFAOYSA-N	446.485	1.993	50	20	IDGD	
COc1cc(OC)cc(N2CC[C@@H](N(C)CC(=O)NNC(=O)c3cccs3)C2=O)c1	777616903	VALSWCYRPWAZRO-MRXNPFEDSA-N	432.502	1.264	50	20	IDGD	
CC(C)CS(=O)(=O)N1CCC(NC(=O)NNc2cccc(S(C)(=O)=O)c2)CC1	777767473	KEHCCCQAIYHNJJ-UHFFFAOYSA-N	432.568	1.166	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NC[C@H]1CC(=O)N(C2CC2)C1	780887314	OXXVHKGWBBLADF-NWDGAFQWSA-N	439.310	1.558	50	20	IDGD	
O=C(NNC(=O)c1cccc2nn[nH]c12)c1ccccc1NS(=O)(=O)c1cccs1	780979128	NLASKLUVKROAIF-UHFFFAOYSA-N	442.482	1.895	50	20	IDGD	
C[C@@H](CNC(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccc(Cl)cc1)S(N)(=O)=O	782037692	LDMPEFINDRZFLY-NCPSJORJSA-N	446.920	1.817	50	20	IDGD	
CCC(=O)Nc1ccc(C)c(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)c1	782888145	SUXXCKWBEVIIIE-UHFFFAOYSA-N	436.472	1.559	50	20	IDGD	
CCCOc1ccccc1NC(=O)C(=O)NNC(=O)c1sc(N2CCOCC2)nc1C	782897510	QABKNKPCQPPABO-UHFFFAOYSA-N	447.517	1.477	50	20	IDGD	
COCCS(=O)(=O)c1ccc(NC(=O)C(=O)NN=c2sc3ccccc3n2C)cc1	783352168	ZTLOIDFQARUNPA-UHFFFAOYSA-N	448.526	1.231	50	20	IDGD	
COc1cc2nc(C)sc2cc1NC(=O)C(=O)NNC(=O)CNC(=O)c1cccs1	784004203	BYPHZSITCDHBRO-UHFFFAOYSA-N	447.498	1.191	50	20	IDGD	
CSc1c(F)cc(NC(=O)C(=O)NNC(=O)CNC(=O)c2cccs2)cc1F	784005364	XJVNLCHRSNHJCW-UHFFFAOYSA-N	428.442	1.264	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ccc(C#N)c(C(F)(F)F)c2)cc1-n1cnnn1	784239475	DWZKDKQBLFKWSQ-UHFFFAOYSA-N	430.350	1.943	50	20	IDGD	
Cn1nc2c(c1NC(=O)C(=O)NNc1ccccc1S(=O)(=O)NC(C)(C)C)CCC2	784833629	PTTNCYIBQDBZCK-UHFFFAOYSA-N	434.522	1.067	50	20	IDGD	
COc1cccc(NNC(=O)C(=O)Nc2ccccc2S(=O)(=O)N2CCCCC2)n1	784847698	MFTOJFGZLDNHSJ-UHFFFAOYSA-N	433.490	1.347	50	20	IDGD	
O=C1C[C@H](Cc2ccc(NC(=O)C(=O)NNc3cccc(C(F)(F)F)n3)cc2)C(=O)N1	784957118	FMZANJICJBGBON-NSHDSACASA-N	435.362	1.387	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)C(=O)Nc1cccc(-c2noc(C3CC3)n2)c1	785067041	GOAFNKJUMFJNEY-UHFFFAOYSA-N	445.439	1.590	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(c2ncc(NC(=O)NNC(=O)c3ccccn3)cn2)CC1	786179864	VGKILTHFWCWXCT-UHFFFAOYSA-N	442.480	1.395	50	20	IDGD	
C[C@@]1(NNC(=O)NC[C@H](C(=O)OCc2ccccc2)c2ccccc2)CCS(=O)(=O)C1	786891192	VVPXIKHPKKLHDP-SIKLNZKXSA-N	445.541	1.895	50	20	IDGD	
CCc1nc(NC(=O)C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)sc1C	789730702	YOPJKZGWZYGVLE-UHFFFAOYSA-N	444.561	1.312	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(C(N)=O)c(OC(C)C)c2)cc1	789733309	ZGTWSKUFCOCUKJ-UHFFFAOYSA-N	428.445	1.046	50	20	IDGD	
Cc1nn(C)c(C=NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1Br	790287364	FSAHNJGONUISJL-UHFFFAOYSA-N	428.312	1.505	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2cc(F)ccc2-n2cccn2)ccc1Cl	792807716	BTQGOCOZMAYCOI-UHFFFAOYSA-N	437.840	1.387	50	20	IDGD	
O=C(CC(F)(F)F)NNC(=O)C(=O)Nc1ccc2c(c1)N(CC(F)F)C(=O)CS2	793026482	SDXCOUAOKOXOTR-UHFFFAOYSA-N	440.350	1.429	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CC[C@H]3[C@@H](CCN3C(=O)OC(C)(C)C)C2)n1	795126573	DJMISOSLVHXBFM-GJZGRUSLSA-N	437.566	1.473	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)c1	796380333	CGOQZHZNRJNZGO-HSZRJFAPSA-N	435.572	1.648	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)CNC(=O)OCc2ccccc2)nn1[C@@H](C)C1CC1	797369016	LZBJGDCFIKTMTP-AWEZNQCLSA-N	442.476	1.175	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)[C@H](O)c2cccc(C(F)(F)F)c2)n1	803813314	SHBXEBSRROWPPQ-OAHLLOKOSA-N	431.392	1.437	50	20	IDGD	
Cc1onc(-c2cccnc2)c1C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	803822965	XRRNPERVFQOQIY-MRXNPFEDSA-N	438.396	1.189	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)C(=O)Nc1cc(C(F)(F)F)cc(Br)n1	806979320	XXBVUOZWQDKLHA-UHFFFAOYSA-N	446.183	1.587	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNC(=O)C(=O)Nc1nc(-c2ccco2)cs1	807069466	BWYLLFHDDDZPNP-UHFFFAOYSA-N	443.441	1.415	50	20	IDGD	
COCCS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2C)cc1	807455720	NAXOEHREVCBGCP-UHFFFAOYSA-N	436.446	1.405	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(N)=O)cc2OCC(F)F)cc1	810385839	BOEMHBDRYVASBB-UHFFFAOYSA-N	434.399	1.392	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)NCC(=O)NNc2ccc(OC(F)(F)F)cc2)cc1	810535707	KBBSUVIMHWJFRH-UHFFFAOYSA-N	446.407	1.965	50	20	IDGD	
COc1cccc(O)c1C=NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	812486983	OIAAOUUZZCOIEW-UHFFFAOYSA-N	447.513	1.505	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)C2(S(=O)(=O)c3ccccc3)CCOCC2)nc1C	813511448	KVGROKIMUPJSFC-UHFFFAOYSA-N	448.501	1.428	50	20	IDGD	
COc1ccc(-c2nn(CCC#N)cc2/C=C(/C#N)C(=O)NCc2cnnn2C)cc1OC	813797713	QPMTUUZISYUHPP-SXGWCWSVSA-N	446.471	1.833	50	20	IDGD	
Cc1c(C(=O)OCC(=O)C(C#N)=C2N(C)c3ccccc3N2C)nnn1-c1ccn(C)n1	814577812	SLZCMDDXEDTCKW-UHFFFAOYSA-N	432.444	1.357	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)c2cnn(-c3ccccn3)c2N)c2ccccc2c1=O	814731954	QNVBCMGOSDEDES-UHFFFAOYSA-N	432.444	1.215	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNc2cccc(F)c2[N+](=O)[O-])nnn1Cc1ccccc1F	815628961	PBKHVNVZNAWHIW-UHFFFAOYSA-N	431.359	1.903	50	20	IDGD	
COC(=O)c1cc(NNC(=O)c2cccc(S(=O)(=O)NC[C@@H]3CCCO3)c2)ccc1C	816690179	KGTRLBKLVARODM-KRWDZBQOSA-N	447.513	1.996	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(=O)n(CC(=O)NN=c2sc3ccccc3n2C)c1	855566450	CTDGHOYLYVOBBW-UHFFFAOYSA-N	449.558	1.064	50	20	IDGD	
Cc1cccc(C(=O)N2CCCN(C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)CC2)c1	913462868	FKYKZBRMJDFJOM-UHFFFAOYSA-N	448.487	1.173	50	20	IDGD	
CC(C)CNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1	914753401	WCONPBWRSZCQIE-UHFFFAOYSA-N	433.486	1.467	50	20	IDGD	
CCOc1ccccc1C(=O)N1CCC[C@@H]1C(=O)NNC(=O)COc1ccc(C#N)cc1	914780517	NWUMOORORVKDCM-LJQANCHMSA-N	436.468	1.788	50	20	IDGD	
O=C(COC(=O)c1cc(-c2ccc(F)cc2)[nH]n1)NNC(=O)[C@H]1COc2ccccc2O1	914826806	RHNMLVNVZQQVKN-GOSISDBHSA-N	440.387	1.360	50	20	IDGD	
O=C(Cc1nc(-c2ccccc2)cs1)NNC(=O)[C@@H]1CC(=O)N(Cc2ccccn2)C1	915259617	DZYLIELWXWBSES-MRXNPFEDSA-N	435.509	1.944	50	20	IDGD	
O=C(COC(=O)C1(c2ccccc2)CCOCC1)NNC(=O)c1ccc([N+](=O)[O-])cc1	915458711	LALBNPGCZCRYRQ-UHFFFAOYSA-N	427.413	1.647	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCc2nnc3n2CCCCC3)nc1	915915954	ZQBNXZGDWMYAGG-UHFFFAOYSA-N	436.542	1.256	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)COc1ccccc1[N+](=O)[O-])c1ccc(-n2cncn2)cc1	915922385	MWSGHDVOWSKVEG-ZDUSSCGKSA-N	425.405	1.646	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)NC1CCN(C(=O)c2ccco2)CC1	916244478	YBCWHTHASAUZLZ-UHFFFAOYSA-N	430.461	1.692	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)NCCNC(=O)c1cccs1	916568739	PKAOEUVBZBOVEM-UHFFFAOYSA-N	441.307	1.650	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H](CC(C)C)N2C(=O)[C@H]3CC=CC[C@@H]3C2=O)cc1	916830417	WRMOHPOWPTWAKV-BZSNNMDCSA-N	440.500	1.447	50	20	IDGD	
O=C(COC(=O)[C@@H]1CCC[C@H](C(F)(F)F)C1)NNC(=O)[C@H]1COc2ccccc2O1	917285858	OLZWWAZBIVIXBV-TYNCELHUSA-N	430.379	1.886	50	20	IDGD	
Cc1ccc(C(=O)NNS(=O)(=O)c2c(C)cc(C)c(NS(C)(=O)=O)c2C)c(O)c1	917753071	AFLGDRSCHKFSAG-UHFFFAOYSA-N	441.531	1.621	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCCSC(F)(F)F)cc1	918219253	HVXQRIDKZHPCIG-UHFFFAOYSA-N	428.458	1.199	50	20	IDGD	
Cc1ccn2cc(CNC(=O)NNC(=O)CCN3CCN(c4ccccc4)CC3)nc2c1	918236090	XLUFYJZXFWLZRW-UHFFFAOYSA-N	435.532	1.685	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)OCC(=O)NCc2ccc(S(C)(=O)=O)cc2)cc(C#N)n1C	919044667	VVDFIYKSUJZISU-IUXPMGMMSA-N	440.481	1.375	50	20	IDGD	
CSCC[C@H](NC(=O)c1ccc([N+](=O)[O-])o1)C(=O)NNC(=O)NC1CCCCC1	919835554	UOYNTROWKITKFP-LBPRGKRZSA-N	427.483	1.702	50	20	IDGD	
Cc1ccccc1C1(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)CCOCC1	920029656	HDKHCONKKGFXTI-UHFFFAOYSA-N	445.541	1.755	50	20	IDGD	
CC(=O)N1CCN(S(=O)(=O)c2ccc(C(=O)NNc3cc(C)cc(C)c3)cc2)CC1	920093781	GXIRNRBCYZIJER-UHFFFAOYSA-N	430.530	1.913	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnn4cccnc34)C2)C1	1778445724	JEPNEPBFEZCPDB-ZWKOTPCHSA-N	426.304	1.409	50	20	IDGD	
O=C(c1cc2n(n1)CCCC2)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1778561795	OQQCJPRRNICYTK-PBHICJAKSA-N	429.290	1.353	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccn(C(F)F)n2)C1	1779760958	ZBVRXVCVPXNRFS-RVZJWNSFSA-N	434.871	1.660	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(Cl)nc(OC)c3)C2)C1	1779794474	LQAQNCIVJVYNSN-UGSOOPFHSA-N	432.304	1.441	50	20	IDGD	
O=C(c1[nH]nc2ncccc12)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781330542	BIHCPUIKYBCZRL-LRDDRELGSA-N	426.246	1.092	50	20	IDGD	
CCOc1cccc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)c1O	1781979126	NFTDGDRBRAANGH-YJBOKZPZSA-N	445.285	1.925	50	20	IDGD	
CCOc1cccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](Cl)COC)CCO3)c1O	1781982288	KFMHUCGLRUGREV-MGPUTAFESA-N	426.897	1.488	50	20	IDGD	
C[C@@H](Nc1cnccn1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C(Cl)Cl)C1	1782218111	UNANYKDAGYSNEN-SNUQEOBHSA-N	430.336	1.595	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCCCCC(=O)OC)C1	1782277824	JDWXJGMCDZRVLN-CBGDNZLLSA-N	446.972	1.878	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(CCN(C(=O)[C@H]3CC(c4ccccc4)=NN3)C2)C1	1782602022	YHOZQDADKGXLND-YLJYHZDGSA-N	449.349	1.368	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cnc4ncccn34)CCO2)C1	1783348020	SBHMECWNEONFKY-FZKQIMNGSA-N	436.310	1.346	50	20	IDGD	
COc1nn(C)cc1C(=O)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1	1787242899	PCEUDSHDXWYHRE-UHFFFAOYSA-N	448.288	1.170	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(N4CCOCC4)cc3)C[C@@H]21)[C@H](F)Cl	1787447150	OEIPJZKLDUESQV-WNHJNPCNSA-N	439.915	1.651	50	20	IDGD	
Cc1nccc(C(=O)Nc2ccc(C3(NC(=O)c4ccc(B(O)O)cc4)CCC3)cc2)n1	1788809038	YGRJDYWANKORFI-UHFFFAOYSA-N	430.273	1.526	50	20	IDGD	
CCn1nc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)CBr)C[C@@H]32)cc1C	1788998065	MMFHQZRWZCJMLG-QEWYBTABSA-N	441.370	1.836	50	20	IDGD	
Cc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)Br)C[C@@H]32)c(O)n1	1789311480	CWBYVBLHVFXIHJ-JURCDPSOSA-N	426.311	1.472	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3nn[nH]c3C(F)(F)F)[C@H]2C1	1789358835	NYNQNFRFQLQVAR-DCAQKATOSA-N	437.850	1.682	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc4ncccn34)C[C@@H]21)[C@@H](F)Br	1789925113	AEYIHZUYJJPITL-AUZPSNTRSA-N	440.273	1.013	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3ccc(F)cc3F)[C@H]2C1	1790979621	RIIDCYGENLQHAB-MBGYTDRXSA-N	430.879	1.741	50	20	IDGD	
CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)Nc1ccc(C2(NC(=O)[C@@H](O)CCl)CCC2)cc1	1791809626	OYXASZAEXWPTBV-MSOLQXFVSA-N	447.923	1.191	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ncc(Cl)cn1)C2	1792870774	UHEIMCFUYJIDBC-HNCHTBHHSA-N	431.718	1.364	50	20	IDGD	
CC(C)[C@@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCl)N1Cc2ccccc2C1=O	1793106419	GMCPYJUCHPUEDT-DSJDWBEOSA-N	447.963	1.905	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cccc(OC)n1	1793989612	FLTKVJVCGWGZBK-ZFHGCVPZSA-N	440.338	1.396	50	20	IDGD	
CC[C@H](C)[C@@H](N)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)C2	1795558108	XGUBCHGKGNUKKG-HVWFQETQSA-N	446.498	1.835	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)c1ccc(C(F)(F)F)cc1	1796191782	WOVHQQZODXBFEA-REPLKXPHSA-N	446.234	1.951	50	20	IDGD	
O=C(CC1Cc2ccccc2C1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1	1796192596	KLQWGIAHENSVBI-NUNAXRQHSA-N	432.329	1.423	50	20	IDGD	
C[C@@H](Nc1ccccn1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@](C)(Cl)CCl)C2	1797977587	IHPVPSYBWBLLMU-TWAUDHPGSA-N	429.348	1.708	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H](CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Cl)C3)C1	1801139366	JVYUNGBRBARAIE-QZLJAVCYSA-N	447.935	1.758	50	20	IDGD	
C[C@@H](Cc1ccccn1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)CBr)C2	1801223449	ZLWFBMUZSHORQM-FDPKGLCPSA-N	438.366	1.881	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)Cc2ccc3c(c2)CCO3)[C@H]1c1cccnc1)[C@H](O)CCl	1803148062	NWODBNUAJDIGLK-JQVVWYNYSA-N	443.931	1.865	50	20	IDGD	
CC(C)[C@H](S)C(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1803607375	CNSSSTBNFYXRPL-AHRSYUTCSA-N	435.594	1.415	50	20	IDGD	
C#CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](Cl)COC)C2	1804376057	HVQFPKRGXNQXRQ-ZHCJQAHYSA-N	441.956	1.795	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)CCN2CCOCC2)[C@H]1c1cccnc1	1806957020	QVYLYFUIECTHRT-CMKODMSKSA-N	438.956	1.064	50	20	IDGD	
Cc1ccoc1C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1807364305	UBXJDGDQXLVSRR-AZUAARDMSA-N	433.273	1.296	50	20	IDGD	
Cc1c[nH]cc1C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1808580563	NJXFTBFJJXSYJJ-NQIIRXRSSA-N	432.289	1.031	50	20	IDGD	
CC(=O)OC[C@H](OC(C)=O)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Cl)[C@@H]1c1cccnc1	1810339216	WKYOEBKXKJPPJJ-MWDXBVQZSA-N	443.859	1.117	50	20	IDGD	
Cc1nc(CC(=O)N2CC[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]2c2cccnc2)no1	1810540403	MYJYYFACSGLDLU-OXJNMPFZSA-N	431.569	1.873	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)c2ccnnc2O)[C@H]1c1cccnc1	1812866447	GBVVNZXRCWRVBH-LNSITVRQSA-N	434.294	1.680	50	20	IDGD	
C[C@](O)(CC(=O)O)CC(=O)NC[C@H]1CCN(C(=O)C(Cl)Cl)[C@@H]1c1cccnc1	1813066518	BWMOYPDJNLNTMS-CDHAZOANSA-N	432.304	1.507	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)C1CC3(CCC3)C1)CC2)c1cccc(B(O)O)c1	1815361604	LDQDYXNUQLHEQV-MRXNPFEDSA-N	439.346	1.629	50	20	IDGD	
O=C(CCN1CCOCC1)Nc1cc([C@H]2CCCCN2C(=O)[C@H](F)Br)[nH]n1	1817181124	MALRQBIIMZXTSQ-CJNGLKHVSA-N	446.321	1.815	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccccc2F)[nH]n1)c1ccc(B(O)O)cc1	1817472733	URVUOJHJEQBROG-LJQANCHMSA-N	436.252	1.848	50	20	IDGD	
Cc1occc1C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1	1819795967	WOZNSDZPXXKZGS-LLVKDONJSA-N	440.485	1.583	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ncccc2F)n[nH]1	1819975884	QDWAXUPNDWKPJC-OAHLLOKOSA-N	431.472	1.623	50	20	IDGD	
C#CC(=O)N[C@@H]1CCc2nc(NC(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)sc2C1	1821304758	RPUOMRCZFRHYIC-LLVKDONJSA-N	428.426	1.836	50	20	IDGD	
C[C@H](C(=O)Nc1nc2c(s1)C[C@H](NC(=O)C(C)(C)CCl)CC2)N1CCN(C)CC1	1822685295	YAALCBCVBVHCFS-ZIAGYGMSSA-N	442.029	1.956	50	20	IDGD	
CN1C(=O)CC[C@H]1C(=O)N[C@H]1CCc2nc(NC(=O)[C@@](C)(Cl)CCl)sc2C1	1822870542	SYPDBTMHWLRQCN-NSTVUXKKSA-N	433.361	1.912	50	20	IDGD	
COc1cc(C(=O)N[C@H]2CCc3nc(NC(=O)[C@@H](C)Br)sc3C2)nn1C	1825645939	LWHMVRVXLVCKFX-BDAKNGLRSA-N	442.339	1.894	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)Cc2ccccc2)CC1	1826461793	RVEHRRMBOLTYQN-QHCPKHFHSA-N	434.345	1.842	50	20	IDGD	
Cc1nccn1[C@H](C)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCC(=O)NN(C)C)CC2	1827042396	CUPCADYQEFIDNY-TZMCWYRMSA-N	447.565	1.194	50	20	IDGD	
O=C(c1cc(-c2ccccc2)on1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1829590177	DVWMDJYNEARHPQ-YLJYHZDGSA-N	437.855	1.946	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)C3CCSCC3)C2)C1	1830545568	KWZLZYLGWKKTEZ-RDTXWAMCSA-N	449.411	1.617	50	20	IDGD	
O=C([C@H](O)CCl)N1CCC([C@H]2CCCCN2C(=O)[C@@H]2CC(c3ccccc3)=NN2)CC1	1831062196	RSJGYRSBKQLFER-PWRODBHTSA-N	446.979	1.972	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)c2cncc(O)c2)CC1	1831699147	LYICLDOPTNVXOW-NRFANRHFSA-N	437.305	1.014	50	20	IDGD	
O=C(Cc1ccc2ncccc2c1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1832031224	JVMTVAQZSXGSPG-TZIWHRDSSA-N	435.883	1.768	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccc(C)c(C)c3)CCO2)C1	1832405771	UZDKHNFCIOFHDY-DENIHFKCSA-N	438.952	1.556	50	20	IDGD	
COC1(CC(=O)N2CCCC[C@@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)CCC1	1832498962	DBJDNCKMYZZXFH-LJQANCHMSA-N	436.597	1.938	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)COc3ccccc3)CC2)CC1	1834471926	HCTMYDROLAWUHL-HXUWFJFHSA-N	437.968	1.891	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)CCCNC)CC2)CC1	1834713613	RUDZXIJKSGCULN-KRWDZBQOSA-N	431.419	1.731	50	20	IDGD	
CC[S@](=O)CCC(=O)NC1CCN(C2CCN(C(=O)C(Cl)Cl)CC2)CC1	1835659282	XBGKCQKKOXFFBB-SANMLTNESA-N	426.410	1.520	50	20	IDGD	
COCC1(C(=O)N2CCC(N3CCC(NC(=O)CO[Si](C)(C)C)CC3)CC2)CC1	1835835420	ZXPNTDQVTLIJSC-UHFFFAOYSA-N	425.646	1.836	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3cccnc3)CCO2)C1	1836158546	OTTKWSWVGRSUQJ-RBUKOAKNSA-N	430.332	1.317	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cc(OC)nn3C)CC2)CC1	1837278599	YCNCKOJYQXINIJ-INIZCTEOSA-N	442.944	1.295	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)c3cnc(O)[nH]3)CC2)CC1	1838479499	FXQKFQJTPINHFE-NSHDSACASA-N	429.315	1.511	50	20	IDGD	
Cc1ccc(O)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)c1	1838893819	RKJLDKHPCCCTGA-YJBOKZPZSA-N	445.285	1.461	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc4ccc(F)cn34)C2)C1	1839147891	FZDFZQVPIHFWBZ-YWZLYKJASA-N	438.887	1.561	50	20	IDGD	
C=CCSCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2	1839150423	MFZAMYJTAVUBDZ-SJORKVTESA-N	425.378	1.598	50	20	IDGD	
O=C(c1cccc(F)c1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839201593	BTLIQOJAPOFOAA-YOEHRIQHSA-N	433.249	1.586	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(O)cc3F)CCO2)C1	1839314950	MFZQDKJMOIBETC-FQEVSTJZSA-N	428.888	1.866	50	20	IDGD	
COc1cc(F)c(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)c(F)c1	1839333262	YGINKWBMLZGXHU-MAUKXSAKSA-N	436.814	1.578	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccnc4ncccc34)CCO2)C1	1839542630	ADSKEWJJHAZXJC-UWJYYQICSA-N	432.908	1.717	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnn4cccc(F)c34)CCO2)C1	1839619741	DFKSIKOSOZNKPS-YWZLYKJASA-N	438.887	1.561	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(C)ccn3)C2)C1	1839964238	KUCBLPYEQJKEQS-DNVCBOLYSA-N	440.338	1.634	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(CO)o3)C2)C1	1839964820	DPSTXDYXNQYFTH-RDTXWAMCSA-N	445.310	1.015	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)NC(=O)OC(C)(C)C)CCO2	1840089066	KTLXNOSLLYSMKC-SIFCLUCFSA-N	447.960	1.373	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)C(C)(F)F)C2)C1	1840150065	FBMNUVQMQRTGRP-FZKQIMNGSA-N	426.888	1.378	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)Oc1cccnc1)CCO2	1840453395	OWRQEECIINBNPH-SYNHAJSKSA-N	425.913	1.323	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@]1(C)CC1(F)F)CCO2	1840829374	BTFFRXSEDRUEML-RCBQFDQVSA-N	439.297	1.662	50	20	IDGD	
C#CCCC(=O)N1CCO[C@]2(COCCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1	1840844325	PCJXYXPGRIRGKO-JBSURENYSA-N	443.450	1.742	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@@]2(C(=O)N2CC3(CCCN3C(=O)[C@H](O)CCl)C2)C1	1841353487	ADGUHHCXJGMTTG-PDSXEYIOSA-N	441.956	1.437	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)[C@H]2C[C@H]2c2ccc(F)c(F)c2)C1	1841397395	LVEHXNAZZOKIPS-ROUUACIJSA-N	440.255	1.265	50	20	IDGD	
O=C(/C=C/c1ccc(O)cc1Cl)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843012388	KPHKDSNLKUJGGT-WEVVVXLNSA-N	440.692	1.256	50	20	IDGD	
O=C([C@@H](O)CCl)N1CC2(CCCN2C(=O)c2nn(-c3ccccc3)c3c2COC3)C1	1843227165	APCOOBZPVLKAHE-KRWDZBQOSA-N	430.892	1.319	50	20	IDGD	
Cc1cc2nnc(C(=O)N3CCCC34CN(C(=O)[C@@](C)(Cl)CCl)C4)c(C)n2n1	1843698107	FUNAOIUXCSWWRT-KRWDZBQOSA-N	425.320	1.794	50	20	IDGD	
O=C(OCCO)c1ccccc1C(=O)N1CCCC12CN(C(=O)[C@@H](F)Br)C2	1844719688	STWUHFSALHXTDB-CQSZACIVSA-N	443.269	1.343	50	20	IDGD	
Cc1oc2cc(O)ccc2c1C(=O)N1CC2(CCCN2C(=O)CCC(=O)NN(C)C)C1	1846384911	XXXRKCMYWOIHSX-UHFFFAOYSA-N	428.489	1.637	50	20	IDGD	
O=C(c1cnn2c(-c3ccsc3)ccnc12)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl	1847560619	XSRUIPGXBNFQQZ-YESZJQIVSA-N	445.932	1.873	50	20	IDGD	
CC(=O)NC(C)(C)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1847821126	OFPGTIVKXMOHFN-KKUMJFAQSA-N	444.960	1.235	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2ccc(Cn3cccn3)cc2)ccc1Cl	10414744	SLLPUAMIZVCQIU-UHFFFAOYSA-N	433.877	1.307	50	20	IDGD	
CCn1c(NNC(=O)c2ccc(CCNS(C)(=O)=O)cc2)nc2ccccc2c1=O	11163313	ZPFFTMMRMYXDNU-UHFFFAOYSA-N	429.502	1.265	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=O)c2ccc3c(c2)OCO3)ccc1C	15793460	SNRFYCRHKZTXED-UHFFFAOYSA-N	433.486	1.829	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CSc2ccc(S(=O)(=O)N3CCCC3)cn2)cc1	17226257	PSHKNXBVMUFAES-UHFFFAOYSA-N	434.543	1.728	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NCc1cccc(NC(=O)[C@@H]2CCCO2)c1	726242182	VRJKHWZAWSFUKP-HNNXBMFYSA-N	445.501	1.126	50	20	IDGD	
C[C@@]1(c2ccc(CNC(=O)NNC(=O)Cc3ccc4ccccc4c3)cc2)NC(=O)NC1=O	726281786	DCQSYZGVJVRJLJ-DEOSSOPVSA-N	445.479	1.968	50	20	IDGD	
C[C@@H](NC(=O)c1n[nH]c2ccccc12)C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	728211141	IEHAPPWOPPJXLI-GFCCVEGCSA-N	442.501	1.265	50	20	IDGD	
COc1ccccc1C(C)(C)C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	728338423	CQFQYTKYMMZBKW-SFHVURJKSA-N	428.441	1.503	50	20	IDGD	
O=C(COC(=O)Cc1cccc(Br)c1)NNC(=O)[C@@H]1COc2ccccc2O1	728344439	KVWCDLUJKAEHEL-INIZCTEOSA-N	449.257	1.522	50	20	IDGD	
Cc1c(NC(=O)CSCC(=O)NNC(=O)CC(C)(C)C)c(=O)n(-c2ccccc2)n1C	728607659	GIAHDUHTMXDXII-UHFFFAOYSA-N	447.561	1.740	50	20	IDGD	
O=C(COC(=O)c1occc1CN1C(=O)Cc2ccccc21)NNC(=O)c1ccccc1	728684141	TXNVRDISXIELNG-UHFFFAOYSA-N	433.420	1.987	50	20	IDGD	
CNS(=O)(=O)c1ccc(C)c(C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)c1	728974114	FJWNUPWXEVBFHD-UHFFFAOYSA-N	433.458	1.656	50	20	IDGD	
CC[C@@H](N=c1nn[nH]n1-c1ccccc1)C(=O)NNC(=O)[C@@H](C)Oc1cccc(C)c1C	729282720	GSUCSPQJEXCKLW-SJLPKXTDSA-N	437.504	1.506	50	20	IDGD	
CN(CC(=O)NNC(=O)Cn1ccc2ccccc21)C(=O)c1ccc(Br)o1	729454143	JBJJUSNCHUDWDQ-UHFFFAOYSA-N	433.262	1.916	50	20	IDGD	
O=C(CN1CCN(Cc2nc(-c3cccs3)no2)CC1)NNC(=O)c1ccc(F)cc1	729471447	SOHVXBVXYDVEBB-UHFFFAOYSA-N	444.492	1.516	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCc2ccco2)cc1C(=O)NNC(=O)CNc1ccccc1	729513362	MCIJQERETTWOAE-UHFFFAOYSA-N	442.497	1.940	50	20	IDGD	
CC(C)(C)C(=O)N1CSC[C@H]1C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	730074490	ZBIWGAZCVIWHNJ-SFHVURJKSA-N	447.605	1.294	50	20	IDGD	
Cc1cccc(N2C(=O)N[C@@H](CCC(=O)NNC(=O)[C@H]3COc4ccccc4O3)C2=O)c1	730740302	BVUFKHVYAHLMQV-MAUKXSAKSA-N	438.440	1.187	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)c1cc(S(=O)(=O)N2CCOCC2)cn1C)c1ccccc1	731999987	BQRPGWOCLDANOA-QGZVFWFLSA-N	434.518	1.001	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)c1cc(NC(C)=O)ccc1NS(C)(=O)=O)c1ccccc1	732133318	WSIVXETVEDUJLW-INIZCTEOSA-N	432.502	1.971	50	20	IDGD	
Cc1cccc(-c2nnc(S)n2CC(=O)NNC(=O)CCN2C[C@H](C)O[C@H](C)C2)c1	732260903	JAHCIIINKWUTDG-GASCZTMLSA-N	432.550	1.189	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)[C@@H](C)N2CCC(Cc3ccccc3)CC2)C[C@@H](C)O1	732261061	AHISNFYPMMMPNQ-VAMGGRTRSA-N	430.593	1.976	50	20	IDGD	
CCOCCCn1c(NNC(=O)[C@@H](C)NC(=O)C2CCCC2)nc2ccccc2c1=O	733268923	VDTRJXOKGZOFNO-OAHLLOKOSA-N	429.521	1.961	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)CC(=O)NNC(=O)Cc2ccc(Cl)cc2)cc1F	734810222	UOBCNJJIFLRDNJ-UHFFFAOYSA-N	426.853	1.846	50	20	IDGD	
COCCOc1ccc(-n2nc(C)c(C(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)n2)cc1	734989167	XOMGHBVNDJJWTE-UHFFFAOYSA-N	440.416	1.584	50	20	IDGD	
C[C@H](CC(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1)c1cccc(F)c1	735118350	SUXGSFAQSQUUBT-OAHLLOKOSA-N	435.525	1.794	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1cccc(-n2cccn2)n1	736935287	WLCOODXTQVKCIM-UHFFFAOYSA-N	429.820	1.547	50	20	IDGD	
COc1nn(C)c2nc(C)c(CCC(=O)NNC(=O)COCc3ccccc3)c(C)c12	737636173	CTYRADHNWIMFCP-UHFFFAOYSA-N	425.489	1.891	50	20	IDGD	
COC(=O)Nc1ccc(CCNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1	738475787	PFMOBHGUPUZQFY-UHFFFAOYSA-N	441.492	1.444	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCC(=NNC(=O)c3cc([N+](=O)[O-])ccc3O)CC2)cc1	741772248	XRZBYXYVJISZFK-UHFFFAOYSA-N	448.457	1.880	50	20	IDGD	
CCOC(=O)CCc1c(C)c(C=NNC(=O)Cc2cc(O)nc(O)n2)c2ccccn12	743447071	BHNNDSIRXPLCSY-UHFFFAOYSA-N	425.445	1.637	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)C2CCN(C(=O)Nc3ccccc3)CC2)cc1	744570830	RVQORSCYQYMQHI-UHFFFAOYSA-N	449.467	1.807	50	20	IDGD	
C[C@H]1C[C@@H](C)CN(C[C@H](C)NC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)C1	745768335	VXFSITDIQKUAMK-ZNMIVQPWSA-N	425.555	1.792	50	20	IDGD	
CCO[C@H]1C[C@H](NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)C12CCC2	745851916	XVZNKLQAHAKDMY-IRXDYDNUSA-N	438.550	1.294	50	20	IDGD	
C[C@H]1C[C@@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)CCN1C	745859291	ZZCPLWUAMVMZEO-RDJZCZTQSA-N	437.566	1.288	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)CCc2nnc(C(C)C)o2)c1	746812845	HUZHEXOHYATGHM-UHFFFAOYSA-N	437.522	1.617	50	20	IDGD	
O=C(CN1CCN(C(=O)OCc2ccccc2)CC1)NNc1nc(-c2cccnc2)no1	747386757	PZFIKVYCDNZSLH-UHFFFAOYSA-N	437.460	1.529	50	20	IDGD	
Cn1ccnc(NNC(=O)C2CCN(C(=O)c3ccc(Br)cc3)CC2)c1=O	747937418	GNIQDGDKWJFRHW-UHFFFAOYSA-N	434.294	1.538	50	20	IDGD	
NS(=O)(=O)c1ccc2c(c1)oc(=O)n2CC(=O)NNc1ccccc1Br	748066780	YBQAFYZLQKJICA-UHFFFAOYSA-N	441.263	1.148	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)CCOc3cccc(F)c3)cc2)CC1	748623288	KWLVWBUGRFNZCY-UHFFFAOYSA-N	436.509	1.674	50	20	IDGD	
CSCC[C@@H](NC(=O)c1ccc2ccccc2n1)C(=O)NNC(=O)N1CCOCC1	749220276	VEDOGTPECLDDFB-QGZVFWFLSA-N	431.518	1.159	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(Br)s1)NNc1ccccc1[N+](=O)[O-]	749835341	MPHNUZHJPSXATG-UHFFFAOYSA-N	435.281	1.840	50	20	IDGD	
CCn1c(NNC(=O)CNS(=O)(=O)c2ccc(Cl)s2)nc2ccccc2c1=O	749842632	GWOBQUGRERJICX-UHFFFAOYSA-N	441.922	1.553	50	20	IDGD	
CCOc1ccc(-c2nc(CC(=O)NNC(=O)CNC(=O)c3ccco3)cs2)cc1	751200874	BEARNQYAGCYGHG-UHFFFAOYSA-N	428.470	1.922	50	20	IDGD	
CC(C)(C(=O)NNC(=O)NC[C@H](O)CS(=O)(=O)c1cccs1)c1ccccc1	752171312	SDYIRCWYXZJPAV-AWEZNQCLSA-N	425.532	1.191	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)c2cc(S(N)(=O)=O)cc(Cl)c2F)c1C	752258234	YIMIDSHPNFBWTL-NSHDSACASA-N	443.884	1.972	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)CNC(=O)c1cccs1)c1nc(Cc2ccccc2)no1	753038466	OOBGQTBMQOZXJX-LBPRGKRZSA-N	428.474	1.543	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCOC[C@H]2C[C@H](O)c2cccs2)cc1OC	753866317	JRWOLSXZFPTGNS-CVEARBPZSA-N	449.529	1.351	50	20	IDGD	
N#C/C(=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)NCc1nc(O)n[nH]1	754355075	MZSGOWQEKZBZBO-GHXNOFRVSA-N	440.851	1.126	50	20	IDGD	
CN(C)c1ccc(S(=O)(=O)N(C)C)cc1NC(=O)NNC(=O)c1ccc(Cl)nc1	755534690	WBBKSUMAMSWNMP-UHFFFAOYSA-N	440.913	1.518	50	20	IDGD	
COC(=O)CNC(=O)c1ccc(NC(=O)NNC(=O)COc2cc(C)ccc2C)cc1	755547339	NYEZVHCMZBORIU-UHFFFAOYSA-N	428.445	1.438	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])cc1	756565083	VGSIQWMGXISJRH-UHFFFAOYSA-N	437.434	1.588	50	20	IDGD	
C[C@H]1C[C@@H](C)C[C@]2(C1)NC(=O)N(CC(=O)NNC(=O)c1cnn(-c3ccccc3)c1)C2=O	756995939	MTEKYYMIOIDDKX-YEZVWNJWSA-N	438.488	1.380	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)Cn2nc(C)cc2C)cc1-n1nnnc1C1CC1	757620665	ITZYGHYVMYFIGU-UHFFFAOYSA-N	425.453	1.215	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CCCCCC[C@H]1C(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1	758184266	OLVZIZYIKDLFNV-RBSFLKMASA-N	446.570	1.368	50	20	IDGD	
O=C(NN=Cc1ccc(N2CCCC2)nc1)C(=O)NN=Cc1ccc(N2CCCC2)nc1	758360131	VQTJBRZKXDNBTK-UHFFFAOYSA-N	434.504	1.277	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)N[C@@H]2CN(C(=O)OC(C)(C)C)C[C@H]2C#N)cc1C	758751654	KIJGGLCJWWDFPD-NVXWUHKLSA-N	431.493	1.772	50	20	IDGD	
O=C(NC[C@H]1CC(=O)N(Cc2ccccc2)C1)NNC(=O)c1cnn(-c2ccccc2)c1	758786609	OTUBUWOLJGHHOX-GOSISDBHSA-N	432.484	1.865	50	20	IDGD	
COCCS(=O)(=O)c1ccc(CNC(=O)NNc2cccc(S(C)(=O)=O)c2)cc1	759382723	DXQGOXSWMPOFJH-UHFFFAOYSA-N	441.531	1.337	50	20	IDGD	
O=C(N=c1cc[nH]cc1I)NNC(=O)c1ccc(Cl)cc1O	760035023	SDBVNVDQDWHIKY-UHFFFAOYSA-N	432.605	1.934	50	20	IDGD	
COc1ccc2c(c1)OC[C@H]2CC(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	760620637	WLSQKCDUOAJGOU-BFUOFWGJSA-N	442.424	1.092	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)CN1C(=O)N[C@]2(C[C@@H](C)C[C@@H](C)C2)C1=O	761626285	VKJJCAGWVGFYQE-GFENJXEQSA-N	448.545	1.681	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@H](C)c3cccc([N+](=O)[O-])c3)CC2)cc1	762089054	YUFYBGAELDCOEJ-GOSISDBHSA-N	439.516	1.972	50	20	IDGD	
Cc1c(C(=O)NNc2nccc(N3CCOCC3)n2)nnn1-c1ccc(OC(F)F)cc1	762865733	MXNIEHVAWHNRGG-UHFFFAOYSA-N	446.418	1.561	50	20	IDGD	
CC(C)(C)OC(=O)N1CCc2cc(NC(=O)C(=O)NNC(=O)c3ccccn3)ccc21	763466332	GFOGOBIDSOGAQH-UHFFFAOYSA-N	425.445	1.779	50	20	IDGD	
CC(C)OC(=O)NCc1ccc(NC(=O)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1	763472546	XIEIGKHYOCGTAX-UHFFFAOYSA-N	443.416	1.629	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)Nc1ccc2nc(C(F)F)[nH]c2c1	763574857	KJPOQUZEVVPUBX-CQSZACIVSA-N	431.355	1.426	50	20	IDGD	
Cc1ccc(Br)cc1NC(=O)C(=O)NNC(=O)[C@@H]1COc2ccccc2O1	763578760	PXPFIXFXNJPFBA-HNNXBMFYSA-N	434.246	1.683	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)C(=O)Nc2ccc(-n3cccn3)nc2)c1	763600314	FNMUWWBNSPXAHI-UHFFFAOYSA-N	436.472	1.864	50	20	IDGD	
O=C(COc1cccc(C(F)(F)F)c1)NNC(=O)C(=O)Nc1ccc(-n2ccnc2)nc1	763639059	AAOUQABCELDLIO-UHFFFAOYSA-N	448.361	1.451	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)COc2cc(C)cc(C)c2)c(C)c1	763648913	HEEMKPXFLPXOHD-UHFFFAOYSA-N	429.473	1.802	50	20	IDGD	
O=C(COc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1ccnn1Cc1ccccn1	763683786	AEYVHRRFOUOZHW-UHFFFAOYSA-N	428.836	1.145	50	20	IDGD	
CN(C)C(=O)c1cccc(NC(=O)C(=O)NNC(=O)CSc2ccc(Cl)cc2)c1	763732355	BYBUZKWLJZMCIV-UHFFFAOYSA-N	434.905	1.920	50	20	IDGD	
COC(=O)CCOc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(N(C)C)c2)cc1	763757105	CCOSDXZSLONMSA-UHFFFAOYSA-N	428.445	1.094	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2ccc(-c3nnc(C)o3)cc2)c1	763775409	QUWUPWSPRHYNBL-UHFFFAOYSA-N	425.401	1.462	50	20	IDGD	
Cc1c(Cl)cc(F)c(NC(=O)C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c1F	763790314	HTQWMIXZXFXVEX-UHFFFAOYSA-N	449.801	1.573	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccccc2O[C@@H](C)C#N)cc1	763876532	GRFWFMSXFQLCAX-DZGCQCFKSA-N	438.440	1.733	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)C(=O)Nc2ccc(C)c(C(=O)N(C)C)c2)cc1	763890697	FINZXEQPRUOAIF-UHFFFAOYSA-N	428.514	1.883	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(C)cnc2OC)cc1OC	763911469	FHSVDUIFWBSYIX-UHFFFAOYSA-N	430.461	1.986	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3cccnc3N3CCOCC3)cc2C1	763943822	UWFREODBVYXJGZ-CYBMUJFWSA-N	443.529	1.504	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)C(=O)Nc1cc(F)c(F)cc1Cl	763945368	XDKSXGPXOLACCO-UHFFFAOYSA-N	435.774	1.909	50	20	IDGD	
COCc1cc(NC(=O)C(=O)NNC(=O)c2ccc(-c3ccc(F)cc3)s2)ncn1	763976079	QCPYSHNKEGETFP-UHFFFAOYSA-N	429.433	1.890	50	20	IDGD	
CC(=O)Nc1cc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)on2)ccc1F	764004433	VXPQUGCQNBRBGS-UHFFFAOYSA-N	425.376	1.839	50	20	IDGD	
CCOc1ccc(OC)cc1NC(=O)C(=O)NNC(=O)c1cc(Br)cn1C	764004862	PIMZNOYPMAJMHU-UHFFFAOYSA-N	439.266	1.595	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)c(Br)c1	764007050	YHOIVVQXWHQXGK-UHFFFAOYSA-N	434.246	1.928	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)Cc2ccsc2)cc1	764033942	PVCDKWPLHLYUBU-UHFFFAOYSA-N	438.531	1.107	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2cc(C)nn2[C@H]2C[C@H]3CC[C@H]2C3)c1O	764130941	BUFBWPSUNMRFIJ-YDHLFZDLSA-N	427.461	1.667	50	20	IDGD	
CCN(CC)C(=O)COc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(C#N)cc2)c1	764182482	NHNYRQLPZMMSIA-UHFFFAOYSA-N	437.456	1.205	50	20	IDGD	
O=C(NNC(=O)c1cccc(OC(F)F)c1)C(=O)Nc1ncn(Cc2ccccc2)n1	764250025	GYYQJUQTFLQZBV-UHFFFAOYSA-N	430.371	1.328	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)C(=O)Nc1ccnn1Cc1cccc(Br)c1	764296593	BDWFBAYYSJFUEA-UHFFFAOYSA-N	446.265	1.125	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)C(=O)Nc1ccc(F)c(NC(=O)Cc2ccccc2)c1	764298411	RHGLPWNXLDTSOR-UHFFFAOYSA-N	438.419	1.438	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(NC(=O)C(=O)NNC(=O)CCCc2cccs2)c1	764335102	LHHDRVPBNJYORS-UHFFFAOYSA-N	438.531	1.107	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ncccc2C)cc1I	764388004	WSDBBVHKBXTSNU-UHFFFAOYSA-N	438.225	1.703	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)cc1C	764388460	SHDDQUHRAVRJQN-UHFFFAOYSA-N	439.403	1.711	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)NCc2cccc(N3CCCS3(=O)=O)c2)c1	765193618	KZVQQKJQLHEYNK-UHFFFAOYSA-N	432.502	1.444	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)c3cc(C)c(C)c(S(N)(=O)=O)c3)n[nH]2)cc1	765572314	XWTRVRBKIBQPAT-UHFFFAOYSA-N	441.513	1.978	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)N1CC[C@H]2[C@@H](CCCN2Cc2ccccc2)C1	765731867	DDUNXDFOYSZQPG-OALUTQOASA-N	439.516	1.737	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cccc(-c4cnn(C)c4)c3)CC2)cc1	765749170	KEZALURJQGNOKY-UHFFFAOYSA-N	446.555	1.974	50	20	IDGD	
N#CCOc1ccccc1C(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	766664425	QIFIWYPGXKQQSR-UHFFFAOYSA-N	441.919	1.821	50	20	IDGD	
O=C(NN=Cc1cc(F)c(F)cc1F)c1cccc(S(=O)(=O)N2CCOCC2)c1	767743117	GHINGASCAKWMMC-UHFFFAOYSA-N	427.404	1.889	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCC([C@@](C)(O)C(F)(F)F)CC2)cc1OC	767908951	VWQDCAZTSYENPV-GOSISDBHSA-N	433.427	1.490	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)CCN1C(=O)[C@H](C)Oc2ccccc21	768629051	DQRRKGCFVOFVOD-ZDUSSCGKSA-N	433.486	1.746	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)CCNC(=O)c1n[nH]c2ccccc12	768634422	JTDSQLOLHXEDRF-UHFFFAOYSA-N	431.474	1.238	50	20	IDGD	
O=C(NNC(=O)c1cc(O)nc(C2CC2)c1)c1ccc(S(=O)(=O)N2CCCC2)cc1	770209625	VTWQHETXXYQHIN-UHFFFAOYSA-N	430.486	1.524	50	20	IDGD	
CSCCNC(=S)NNC(=O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])c(C)c1	770248236	UPXHZJZCSCKMJJ-AWEZNQCLSA-N	425.536	1.366	50	20	IDGD	
CON(C)S(=O)(=O)c1cccc(C(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)c1	770968394	VFLWCHZVTPGSJU-UHFFFAOYSA-N	449.493	1.226	50	20	IDGD	
O=C1CCSc2ccc(C(=O)NNC(=O)C(=O)NCc3ccc(Cl)cc3)cc2N1	772188788	XVGMQJRZQJNEAH-UHFFFAOYSA-N	432.889	1.852	50	20	IDGD	
Cc1cc(NC(=O)CSCC(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)no1	772952816	GCVNWGYFJMPROM-LLVKDONJSA-N	426.882	1.923	50	20	IDGD	
COC(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)c1	774001001	CEPPDEZYQSKHSE-GFCCVEGCSA-N	433.848	1.609	50	20	IDGD	
CO[C@@H]1[C@@H](C)[C@@H](NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)C1(C)C	776067317	QPIJVGQCDPNGLS-IAOVAPTHSA-N	426.539	1.005	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)c1cccc([N+](=O)[O-])c1N1CCOCC1	776291778	YVTDSCGMYABWQB-CYBMUJFWSA-N	432.408	1.799	50	20	IDGD	
CC[C@@H](NC(=O)NNc1cccc(S(C)(=O)=O)c1)c1cccc(S(N)(=O)=O)c1	776620207	LBXVPYCEGOZMDO-MRXNPFEDSA-N	426.520	1.515	50	20	IDGD	
COC(=O)Nc1ccc(S(=O)(=O)NNC(=O)COCc2ccccc2)cc1[N+](=O)[O-]	777630457	ZXWNVZQLQMGKQX-UHFFFAOYSA-N	438.418	1.299	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNS(=O)(=O)c2cc(C(=O)OC)oc2CC)cc1	778557263	VRBUCFZLEHGPOH-LBPRGKRZSA-N	440.474	1.804	50	20	IDGD	
COCC(=O)N1CCc2cc(NC(=O)C(=O)NNC(=O)Cc3ccc(Cl)cc3)ccc21	778709260	FMEXZEOCEYPRBQ-UHFFFAOYSA-N	444.875	1.204	50	20	IDGD	
NC(=O)CCOc1ccc(NC(=O)C(=O)NNc2ccccc2OC(F)(F)F)cc1	778802904	GVUYCPXWDPPMAK-UHFFFAOYSA-N	426.351	1.921	50	20	IDGD	
CN(C)C(=O)COc1ccccc1C(F)(F)C(=O)NNC(=O)CCc1ccccc1O	779196874	NRGQUTHPYZJSSG-UHFFFAOYSA-N	435.427	1.731	50	20	IDGD	
O=C(NNC(=O)C(=O)Nc1ccccn1)N[C@@H]1CCN(c2ccc(Cl)c(Cl)c2)C1	779378134	PSUARDHKIVXDPS-LLVKDONJSA-N	437.287	1.936	50	20	IDGD	
COc1ccc(NNC(=O)[C@@H]2C[C@H](O)CN2S(=O)(=O)c2ccc(Cl)cc2)nc1	781520916	IXVSBBGEWUYFNJ-WFASDCNBSA-N	426.882	1.011	50	20	IDGD	
Cc1ccc(-c2nnco2)cc1NC(=O)C(=O)NNC(=O)Cc1nc2ccccc2n1C	782894638	RGKJUQWBVPIBHS-UHFFFAOYSA-N	433.428	1.260	50	20	IDGD	
CCN1CCN(C(=O)Cc2ccc(NC(=O)C(=O)NNc3cccc(F)c3)cc2)CC1	783036385	XNJGQZSJWOXKTD-UHFFFAOYSA-N	427.480	1.614	50	20	IDGD	
COCCS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)Nc2ccccc2C)cc1	783411540	SATLMCHXDANBTQ-UHFFFAOYSA-N	434.474	1.207	50	20	IDGD	
O=C(NNC(=O)[C@@H](O)C1CCCCC1)c1cccc(S(=O)(=O)NCc2ccccc2)c1	783506225	FNRAZQZWYISEIY-FQEVSTJZSA-N	445.541	1.867	50	20	IDGD	
CCOc1ccc(C(C)(C)C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)cc1OCC	783574576	MKNZAENULFLJLN-AWEZNQCLSA-N	427.523	1.279	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNc2cc(C)ncn2)c(Br)cc1F	783941113	YZZSXDCDLNAJTB-UHFFFAOYSA-N	426.202	1.555	50	20	IDGD	
Cc1ccnc(Oc2cc(NC(=O)C(=O)NNC(=O)C(=O)N3CCCC3)ccc2C)c1	784000182	PULHQOSQNXGFCI-UHFFFAOYSA-N	425.445	1.199	50	20	IDGD	
Cc1c(NNC(=O)C(=O)Nc2cccc3c2CCN3S(C)(=O)=O)cccc1[N+](=O)[O-]	784358691	XVHUXFMBCSYDOE-UHFFFAOYSA-N	433.446	1.307	50	20	IDGD	
Cc1nc(N2CCOCC2)ccc1NC(=O)C(=O)NNc1ccnc(Br)c1	784828913	QKOWEONTJFMQMZ-UHFFFAOYSA-N	435.282	1.466	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(C(=O)NCC3CC3)ccc2C)cc1F	785991286	DCAPIHUIFUMJMY-UHFFFAOYSA-N	426.448	1.982	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2ccc(C#N)cc2)cc1S(=O)(=O)N1CCCC1	786124584	HDXZINPHEUVMOO-UHFFFAOYSA-N	443.485	1.818	50	20	IDGD	
O=C(Cc1csc(Cc2cccc(Cl)c2)n1)NNC(=O)N[C@@H]1CCS(=O)(=O)C1	787164644	MQYWGUBIDVZMHV-CYBMUJFWSA-N	442.950	1.447	50	20	IDGD	
CCN(C(=O)c1cc(NC(=O)C(=O)NNC(=O)Cc2cc[nH]n2)ccc1Cl)C(C)C	787541713	CESNVJSZURSUJY-UHFFFAOYSA-N	434.884	1.262	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3n2)cccc1N1CCNC1=O	787542697	AKHZKEHPXLMMED-UHFFFAOYSA-N	432.440	1.473	50	20	IDGD	
CN1CCN(C(=O)NNC(=O)CSCC(=O)Nc2cccc(Br)c2)CC1	788165904	HVELZKWDZLBVCJ-UHFFFAOYSA-N	444.355	1.109	50	20	IDGD	
C[C@]1(C2CC2)NC(=O)N(c2cccc(CNC(=O)NNC(=O)c3ccc(C#N)cc3)c2)C1=O	790691139	HNJQTEDYNBAQMZ-HSZRJFAPSA-N	446.467	1.927	50	20	IDGD	
C[C@]12CCN(C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)C[C@H]1C2(Cl)Cl	790708966	MDFZDDZIODRVIQ-DYVFJYSZSA-N	427.336	1.950	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)NCc1nc(-c2cccc(Br)c2)no1	790894034	APROVXQFPWJKRP-UHFFFAOYSA-N	431.250	1.967	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1nc(Br)ccc1F	792021807	LQKRZDOIFMPNPK-UHFFFAOYSA-N	444.286	1.660	50	20	IDGD	
CC(C)CCNS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2nc3ccccn3n2)cc1	792392100	RJAJXJWNFQGJCC-UHFFFAOYSA-N	445.505	1.136	50	20	IDGD	
COc1ccc(N2CCN(CCCNC(=O)NNC(=O)c3cccc(C)n3)CC2)cc1	792790790	DHPVVMRNTCUVPZ-UHFFFAOYSA-N	426.521	1.555	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)[C@@H]1CCC(F)(F)C1	794863810	YSPFDYFIWOCRPS-OAHLLOKOSA-N	445.488	1.223	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)CNC(=O)OCc2ccccc2)ccc1Cl	797368781	GXHBCSSZWFNQLM-UHFFFAOYSA-N	434.836	1.361	50	20	IDGD	
CO[C@@H](C)c1cccc(NC(=O)C(=O)NNC(=O)CNC(=O)OCc2ccccc2)c1	797368998	LKXHJGFDASRPHX-AWEZNQCLSA-N	428.445	1.406	50	20	IDGD	
COC(=O)c1ccc(NC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc1OC	797672237	CFNHIEKTQCVMKD-UHFFFAOYSA-N	425.401	1.840	50	20	IDGD	
Cc1ccccc1NC(=O)NNC(=O)[C@H]1CCCN(S(=O)(=O)c2c(C)n[nH]c2C)C1	798312665	HYAXUHUIKGYJEG-HNNXBMFYSA-N	434.522	1.589	50	20	IDGD	
COCCCNC(=O)NNS(=O)(=O)c1c(Cl)nc2ccc(Br)cn12	799918227	IWIIBROWOHCEHQ-UHFFFAOYSA-N	440.707	1.279	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(S(=O)(=O)NNC(=O)NCc2ccco2)c1	800833845	JFQSHVTUAALQJG-UHFFFAOYSA-N	430.508	1.003	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)[C@@](C)(O)Cn2ccc(C)cc2=O)cc1Cl	802075458	AZRHFXDBAMSWQW-IBGZPJMESA-N	438.868	1.431	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H]2CCN(c3ccc(C#N)cc3F)C2)c1	804252824	QKIDTLUUSDWJSF-HNNXBMFYSA-N	430.461	1.388	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(\C#N)C(=O)NC2CCC3(CC2)NC(=O)NC3=O)c1C	804732851	ZBLKDLJJZLMMPY-OZOPQJEWSA-N	427.505	1.856	50	20	IDGD	
COc1ccc(-c2nn(CCC#N)cc2/C=C(\C#N)C(=O)NCC(=O)NCC#N)cc1OC	804820448	IENMLPSCLISCLH-MHWRWJLKSA-N	447.455	1.144	50	20	IDGD	
NC(=O)c1ccc(NC(=O)C(=O)NNc2cc(F)c(F)c(F)c2)c(OCC(F)F)c1	810398946	QOVGRWGBKDQIPJ-UHFFFAOYSA-N	432.305	1.929	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1cnc(C(F)(F)F)cc1C	810399996	DGFISRJIYXYQGW-UHFFFAOYSA-N	446.407	1.903	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2cccc(Br)c2)cc1	810449201	ILKCWNFYRGHDEQ-UHFFFAOYSA-N	426.292	1.497	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)CNS(=O)(=O)c2cccc(Br)c2)c1	810976675	WFPQEWDRZFYTKG-UHFFFAOYSA-N	442.291	1.657	50	20	IDGD	
COC(=O)c1ccc(Cl)c(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1	811292663	PPNUISSFLLCBEW-INIZCTEOSA-N	448.815	1.271	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@@H]2C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)cc1	812726539	HOZIVPRMIKBMMA-LJQANCHMSA-N	446.529	1.693	50	20	IDGD	
COC(=O)c1cn(-c2cccc(NC(=O)NNC(=O)c3ccc(O)c(Cl)c3)c2)nn1	812977833	SPSACHWVWZMVEK-UHFFFAOYSA-N	430.808	1.879	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)NCC[C@@]1(O)C[C@H]2CC[C@H]1C2	813785948	IKPJELBIPSBIHN-SFYKDHMMSA-N	429.565	1.470	50	20	IDGD	
CCOC(=O)c1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)nc1	814698923	VPXYEHHHVCDVHI-UHFFFAOYSA-N	446.485	1.118	50	20	IDGD	
CNC(=O)c1cc(Oc2cccc(NC(=O)C(=O)NNC(=O)c3ccccc3)c2)ccn1	815558218	VNRAVTAITHGEST-UHFFFAOYSA-N	433.424	1.633	50	20	IDGD	
CC(C)(C)c1csc(NC(=O)C(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])c1C#N	815566119	JNUXQFOKTDEEPM-UHFFFAOYSA-N	445.457	1.990	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)[C@H]2CCCO2)sc2c1CCCS2	815779298	ZGBNVOUMVRBDDQ-SNVBAGLBSA-N	427.504	1.228	50	20	IDGD	
O=C(Nc1ccc(O)c(C(=O)NNC(=O)[C@@H]2CCc3nncn3C2)c1)OCC(F)(F)F	816873403	GKIVFBRJTBIFIK-SECBINFHSA-N	442.354	1.118	50	20	IDGD	
CCOC(=O)N1CCC[C@@H](C(=O)NNC(=O)COc2ccc(Br)cc2)C1	912895903	YHPOHQOBSGZMGG-GFCCVEGCSA-N	428.283	1.844	50	20	IDGD	
CC(C)CNS(=O)(=O)c1ccc(Br)c(C(=O)NNc2ncccn2)c1	913044386	UMEHWANIZKBDON-UHFFFAOYSA-N	428.312	1.930	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(S(=O)(=O)C(F)(F)F)cc2)cc1C	913055215	KFGOVFRMYKEIDB-UHFFFAOYSA-N	443.403	1.997	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CN2C(=O)[C@@H]3[C@@H](C2=O)[C@H]2C=C[C@H]3C2)ccc1OC(C)C	913154151	NUFMYGBPDHUHBC-OYUDYFSCSA-N	427.457	1.051	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)CCNS(=O)(=O)/C=C\c2ccccc2)cc1C	913450340	YWQFVVOTWOACSK-QBFSEMIESA-N	431.514	1.810	50	20	IDGD	
CC(C)NS(=O)(=O)c1cc(C(=O)NNC(=O)COc2ccc(F)cc2)ccc1F	914750196	ZLZUGUORKAQWDD-UHFFFAOYSA-N	427.429	1.492	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1cc(C(=O)NNC(=O)c2ccc[nH]2)ccc1Br	915060954	KMOBIHCHSSMTOZ-UHFFFAOYSA-N	443.323	1.929	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@@H](C)C(=O)NNC(=O)CNS(=O)(=O)c1cccs1	915188584	BFDVZCNJZYEKQS-LBPRGKRZSA-N	445.950	1.912	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)[C@H](C)N1C(=O)[C@H]2CCCC[C@H]2C1=O	915775741	NWXYBBZXCSKOPJ-SOUVJXGZSA-N	425.489	1.310	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)ccc1Cl	916133440	PCQITOUWKZZOSC-UHFFFAOYSA-N	425.879	1.514	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)NCCNS(=O)(=O)c3ccccc3)cc2C1	916295109	JBOSDPNKTOFYRB-CYBMUJFWSA-N	436.559	1.795	50	20	IDGD	
O=C(NCc1ccnc(OCC(F)(F)F)c1)NNC(=O)c1ccc(-n2cnnn2)cc1	916396684	CFEUMBJAMIDYOC-UHFFFAOYSA-N	436.354	1.143	50	20	IDGD	
Cc1ccc(Cl)c(O[C@@H](C)C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1	917308305	ODSPZNQZSVIXDS-SCLBCKFNSA-N	448.859	1.946	50	20	IDGD	
O=C(Nc1cccc(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)c1)NC1CC1	917521267	WOKQSGMKCUPDRG-UHFFFAOYSA-N	430.490	1.338	50	20	IDGD	
CCN(CCCNC(=O)NNC(=O)[C@@H](C)Oc1ccc2ccccc2c1)S(C)(=O)=O	918119129	MHLXOSNDSFYBTD-OAHLLOKOSA-N	436.534	1.609	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2cccc(Cl)c2)cc1O)c1csc(N2CCOCC2)n1	918759358	WGBANSNVOCGKGM-UHFFFAOYSA-N	448.892	1.599	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)CCc2nc(O)c3c4c(sc3n2)CCC4)c1O	919756052	PHYVQPLZSLJWEC-UHFFFAOYSA-N	428.470	1.994	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)c1ccc(S(=O)(=O)NCc2ccco2)cc1	919822071	PMMFDZUKJFIVPS-UHFFFAOYSA-N	443.481	1.770	50	20	IDGD	
CNC(=O)NNC(=O)[C@@H](CCSC)NS(=O)(=O)c1cc(Cl)ccc1Cl	919877915	MCECZQYFXNEYGZ-SNVBAGLBSA-N	429.351	1.354	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)CCS(=O)(=O)c2ccc3c(c2)OCCO3)cc1	920011640	XEOVXHHRBVXLIV-UHFFFAOYSA-N	448.497	1.410	50	20	IDGD	
N#C/C(=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)N1CCC[C@@H](O)C1	920853327	NLTZTLRJVGCJLE-SPQRHKFCSA-N	427.892	1.969	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)NCc2cc(Br)c3c(c2)OCCO3)n1	921124522	OTGFTUUCGSBMNC-UHFFFAOYSA-N	438.282	1.564	50	20	IDGD	
CC1(C)Cc2cccc(S(=O)(=O)NNC(=O)C3CCN(c4ncccn4)CC3)c2O1	1321192630	ZIZJVDQXPHMZLY-UHFFFAOYSA-N	431.518	1.416	50	20	IDGD	
O=C(CNc1ccccc1)NNC(=O)c1cccc(NN2C(=O)[C@H]3CC=CC[C@H]3C2=O)c1	1344716699	CBYPNDHYKCIQNG-KDURUIRLSA-N	433.468	1.838	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N[C@H]2CCN(Cc3ccc(OC)cc3OC)C2=O)cc1	1346670622	QUWRSJUESYYMFD-SFHVURJKSA-N	442.472	1.458	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnc3snnc3c1)C2)[C@H](F)Cl	1778029956	JROUPFHHGABFAO-IIYDPXPESA-N	427.889	1.748	50	20	IDGD	
O=C([C@H](F)Br)N1CCO[C@]2(CCN(C(=O)[C@H]3Cc4ccccc4O3)C2)C1	1778253246	SWFXHAWJVYWHJR-VKJFTORMSA-N	427.270	1.511	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3nc4cc(C)c(C)cc4[nH]3)C2)C1	1778925872	CJRCQRJYOCHTJK-YCRPNKLZSA-N	434.924	1.877	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3coc([Si](C)(C)C)c3)C2)C1	1778999373	AILGSZPDFSPECX-HNAYVOBHSA-N	428.989	1.522	50	20	IDGD	
CC(C)(C)n1cc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)nn1	1780354218	FELHCDWECHCRIO-ZWKOTPCHSA-N	432.352	1.713	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1ccccn1)C2)[C@@H](F)Br	1780773203	GNWPBEOZSJZBTG-QGPMSJSTSA-N	428.302	1.829	50	20	IDGD	
O=C(Cc1noc2ccccc12)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781331593	SNFKQOJUVALFKV-WMZOPIPTSA-N	440.269	1.891	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)Cn1cccn1)C2	1781996944	ZNMSGFCPTAMHPM-YKTARERQSA-N	441.370	1.817	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccnnc1O)C2	1781998380	ZJPBQCWHVDAHLX-XTQGRXLLSA-N	427.299	1.093	50	20	IDGD	
O=C(c1cn[nH]c1)N1CCO[C@@]2(CCN(C(=O)[C@H](Br)Cc3ccccc3)C2)C1	1783022569	JYVXPVGESFTHPT-YLJYHZDGSA-N	447.333	1.859	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2)c1ccc(CO)c(F)c1	1783072955	RPOFGUOBPDPGJA-MBOZVWFJSA-N	428.888	1.045	50	20	IDGD	
COC(=O)c1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)C(C)(C)CCl)[C@H]3C2)cn1	1783850210	RAINXKIKUGKDDX-ZOBUZTSGSA-N	437.924	1.727	50	20	IDGD	
CC(C)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](N)Cc3cscn3)C[C@@H]21	1783850961	YQZBOIOXMKMUDX-TUUVXOQKSA-N	428.986	1.258	50	20	IDGD	
CC(C)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CC[C@@H]4CCC(=O)N4C3)C[C@@H]21	1783851740	GOFWBXMFDXOMFP-JCECYMMASA-N	439.984	1.632	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccncc3C(F)(F)F)CCO2)C1	1783874542	IOICBYIRCDUNAM-WMLDXEAASA-N	435.830	1.798	50	20	IDGD	
Cc1cc(C)n(CCC(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)n1	1784319268	NDULHPYYPDQMAU-LIRRHRJNSA-N	441.370	1.751	50	20	IDGD	
CCOC(=O)N1CCC(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](Cl)CC)CCO3)CC1	1785373805	PZUQWITUPDWAJQ-UZLBHIALSA-N	429.945	1.702	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3Cc4ccccc4N3)C[C@@H]21	1786407225	LCBTZMYIQGQDER-LAQRGFTBSA-N	436.350	1.788	50	20	IDGD	
C[C@H](CBr)C(=O)NC1(c2ccc(NC(=O)[C@@H](N)CCC(N)=O)cc2)CCC1	1787976074	ZPXYMWINZCHFPX-DOMZBBRYSA-N	439.354	1.744	50	20	IDGD	
CN1CCC[C@@H](C(=O)Nc2ccc(C3(NC(=O)c4ccc(B(O)O)cc4)CCC3)cc2)C1	1790391254	LWDPHDINIOAEOH-GOSISDBHSA-N	435.333	1.456	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)N3C[C@H]4C[C@H]4C3)C[C@@H]21	1791056391	WKLVBHVIQMUFQI-DPNXGZFNSA-N	428.371	1.090	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3ccc(O)cn3)[C@H]2C1	1791711042	GAQRWDFMWOQMKR-SJWGOKEGSA-N	440.338	1.483	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC1(c2ccc(NC(=O)CCn3cncn3)cc2)CCC1	1791794059	PTHFRLOGDZMWQP-UHFFFAOYSA-N	448.487	1.115	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC1(c2ccc(NC(=O)CCn3ccnn3)cc2)CCC1	1791887092	DOVQFZZTVVSWJY-UHFFFAOYSA-N	448.487	1.115	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(C(N)=O)cc3)[C@H]2C1	1791897849	UREVLTYSWNZFGY-ULMVMLMRSA-N	442.343	1.615	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2)[C@@H]1CCc2ccccc2[C@@H]1O	1793036557	KHBAFIYRGKOCFI-IEHFGQBSSA-N	427.328	1.676	50	20	IDGD	
O=C(Cc1cc(Br)ccc1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCl	1793115227	DZKAPYDMWXUJHZ-HLPPOEQASA-N	445.741	1.935	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](NC(C)C)C(C)C	1795718640	KGQLHUQBJZUMMX-NNXHMXCWSA-N	432.403	1.772	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1nccc2occc12	1795973627	FWQNNVCAJOUMBY-YJKIEOBBSA-N	426.242	1.722	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(N2CCOCC2)c1	1799613433	YAZFYPYJYXCXIF-HNJRGHQBSA-N	435.952	1.744	50	20	IDGD	
CC(C)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1n[nH]c2ccc(C#N)cc12	1799883264	VWJUVEBYJWPJMW-XOIINTDNSA-N	429.908	1.903	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C#CC1CC1)C2)[C@@H](Br)Cc1ccccc1	1800433437	LNAVLBXCYOCWBS-JTJHWIPRSA-N	445.357	1.996	50	20	IDGD	
COc1ccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)Br)cc1O	1800754622	SLVMEDUIAUBCCP-GNTLTTKYSA-N	441.322	1.316	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccnn1-c1ccccc1)C2	1800756749	DLRZFIVJYAOPGS-AFIMGQEJSA-N	447.333	1.859	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CCc2ccccc2C1)c1ccc(B(O)O)cc1	1801841239	ZJRXSNMXWRQJIO-XBYSBRQOSA-N	432.329	1.423	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)c1cc(F)ccc1C(F)(F)F	1801861743	WIPOZCZGHIJDFZ-OWLDWWDNSA-N	438.805	1.647	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)NC(=O)c1ccccc1	1802111360	FKUPRZRSBBDYIT-NLNMYJFZSA-N	435.952	1.802	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](COC)NC(C)=O)[C@@H]1c1cccnc1	1803692709	XBOPGZYQUGIRNA-INDMIFKZSA-N	438.956	1.646	50	20	IDGD	
Cc1ncccc1C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1805496017	OUZONPQMWPAXBK-DENIHFKCSA-N	444.300	1.098	50	20	IDGD	
COc1cnc(C(=O)NC[C@H]2CCN(C(=O)CCBr)[C@H]2c2cccnc2)cn1	1806038603	IYJPHKLWNCOSFN-KDOFPFPSSA-N	448.321	1.985	50	20	IDGD	
O=C(CCBr)NC[C@@H]1CCN(C(=O)CC(F)(F)C(=O)O)[C@@H]1c1cccnc1	1806340810	NTZVVPHDAAYZJZ-SWLSCSKDSA-N	448.264	1.982	50	20	IDGD	
COCC(=O)N1CCC2(CCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)CC1	1806757360	XWIRSTFVKZOTPJ-HNNXBMFYSA-N	431.961	1.996	50	20	IDGD	
Cc1ncccc1C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1807369945	ZJNSGZAVHKJZAU-DENIHFKCSA-N	444.300	1.098	50	20	IDGD	
Cc1nnc(CC(=O)NC[C@@H]2CCN(C(=O)[C@H](F)Br)[C@@H]2c2cccnc2)o1	1807478303	GXJZEHDFIOZHJP-MAZHCROVSA-N	440.273	1.712	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)[C@H]2C[C@H]2F)[C@@H]1c1cccnc1	1808416183	GPBFKUXVZXGEPR-AYCZLPQWSA-N	440.479	1.579	50	20	IDGD	
Cc1ccnc(C(=O)NC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)c1	1808540468	YKFOIXWCUNGGLU-PGRDOPGGSA-N	438.532	1.478	50	20	IDGD	
Cc1c[nH]cc1C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1	1808583297	FWWSTGWJPVNHJX-OXJNMPFZSA-N	447.499	1.350	50	20	IDGD	
Cc1c(C(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)nc2ccccn12	1809078727	ZBPYIXGZUXUYBG-SQGPQFPESA-N	441.919	1.957	50	20	IDGD	
O=C(CC[C@H]1CCOC1)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1	1809972119	BXCNTUARTXFHIS-SFHVURJKSA-N	428.338	1.028	50	20	IDGD	
COc1cc(C(=O)NC[C@H]2CCN(C(=O)C(Cl)Cl)[C@@H]2c2cccnc2)nn1C	1811633341	BYABGCMPGFSXJZ-IUODEOHRSA-N	426.304	1.947	50	20	IDGD	
CC(=O)NCCC(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)CBr)[C@@H]1c1cccnc1	1812654541	KTONAXNZOBFDFG-QANKJYHBSA-N	439.354	1.645	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)CCSC(=N)N)[C@@H]1c1cccnc1	1812864809	RLGOBWJYSNSZAZ-NJZAAPMLSA-N	442.383	1.888	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](O)CCl)n[nH]1	1814871229	LFYGNVTVMFJYQV-OVKBOSNOSA-N	449.899	1.136	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CN2CCOC2=O)n[nH]1	1815028876	RJYBAZYIXSCHTN-JQWIXIFHSA-N	428.287	1.637	50	20	IDGD	
CN1N=C(C(=O)N2CCCC[C@H]2c2cc(NC(=O)CCBr)n[nH]2)CCC1=O	1816782164	PSQXFPOQUVALJA-ZDUSSCGKSA-N	439.314	1.795	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)C(Cl)Cl)CC2)c1cccn2c(O)nnc12	1816968485	MOUUUEZGZXIAHC-ZETCQYMHSA-N	441.300	1.921	50	20	IDGD	
CCOCCC(=O)N[C@@H]1CCc2nc(NC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)sc2C1	1817282357	CTZHDUFXSKRGLI-CJCQAYSXSA-N	446.533	1.616	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)C2CCCC2)[nH]n1	1819402050	KOOISJUSUPADEB-QGZVFWFLSA-N	425.493	1.904	50	20	IDGD	
C[C@H](C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)C(Cl)Cl)CC2)N1CCN(C)CC1	1822697111	IXZPZZUWSHBZNA-MNOVXSKESA-N	434.393	1.495	50	20	IDGD	
O=C(CCCn1cccc1)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1822827123	LPUNJZCUQUWIID-HXUWFJFHSA-N	449.320	1.677	50	20	IDGD	
CN1CCN(CC(=O)N[C@@H]2CCc3nc(NC(=O)[C@](C)(Cl)CCl)sc3C2)CC1	1822864807	HSKXHVROGUKLRN-KZULUSFZSA-N	448.420	1.539	50	20	IDGD	
CCC[C@H](NC(C)=O)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1	1823442222	JUKOAJNOLREONN-RDJZCZTQSA-N	449.556	1.080	50	20	IDGD	
Cc1ccc(C(=O)NCC(=O)Nc2cc([C@@H]3CCCCN3C(=O)[C@@H](O)CCl)[nH]n2)cc1	1823510935	TVJHMWORMMYYJY-IRXDYDNUSA-N	447.923	1.740	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC[C@H]1C1CCN(C(=O)Cn2cnnn2)CC1	1824094248	VENZLUWBOJNMLK-HIFRSBDPSA-N	427.347	1.324	50	20	IDGD	
CC(C)(C)n1cc(C(=O)N2CCC([C@H]3CCCCN3C(=O)[C@@H](O)CCl)CC2)nn1	1824184729	DGAGNBAZEOUSRI-SJORKVTESA-N	425.961	1.866	50	20	IDGD	
COC(=O)C1(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@@H](F)Br)CC3)CC1	1825280758	PYMNYLMQUPHDGW-OIBJUYFYSA-N	434.287	1.699	50	20	IDGD	
COc1nn(C)cc1C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](C)Br)sc2C1	1825637145	SXZRWKJYXQGXNK-DTWKUNHWSA-N	442.339	1.894	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)c2nccs2)CC1	1826110774	MSFXMJAYMMPQNT-SFHVURJKSA-N	427.335	1.370	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCC([C@H]2CCCCN2C(=O)CNCP(=O)(O)O)CC1	1826801184	ZOZRWEIGDODLSS-OAHLLOKOSA-N	437.905	1.596	50	20	IDGD	
Cc1nc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)co1	1827050957	HTZUTHJYXIGVMM-HXUWFJFHSA-N	425.294	1.210	50	20	IDGD	
Cc1n[nH]c(C)c1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827058244	VIUYRUFRUKTQKQ-FQEVSTJZSA-N	438.337	1.253	50	20	IDGD	
O=C([C@H](O)CCl)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2Cc3ccccc3CN2)CC1	1827566722	XXVSFINHSJJCOD-PCCBWWKXSA-N	433.980	1.920	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cn3nnc4ccccc43)C2)C1	1830357991	JKLOHMSLSCSWLD-NRFANRHFSA-N	449.939	1.153	50	20	IDGD	
O=C([C@H]1CCc2ccccc2[C@@H]1O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1830824720	NHVVKGJRTUDLOJ-RYLXDESZSA-N	440.899	1.273	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@H]1C1CCN(C(=O)Cn2ccncc2=O)CC1	1831655959	GKHLFXWWOLVGNV-HOCLYGCPSA-N	439.354	1.646	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)C2CCC(O)CC2)CC1	1832002751	QUOPBNHGTMHSOH-MHJFOBGBSA-N	436.597	1.530	50	20	IDGD	
C[C@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)c3cn(C)cn3)CC2)CC1	1833261906	BTQQROOWFIXENK-CQSZACIVSA-N	440.386	1.636	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)[C@@H](F)c1ccccc1	1833652229	BKGONECAXPULJJ-OALUTQOASA-N	425.932	1.869	50	20	IDGD	
Cc1ccsc1C(=O)NC1CCN(C2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1	1834112743	IFRSRZKQJLYCOR-UHFFFAOYSA-N	449.621	1.615	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3cccc(O)n3)CC2)CC1	1834199335	DHNPWPDUFGBWIF-CYBMUJFWSA-N	439.354	1.756	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)Cn3cc(Cl)cn3)CC2)CC1	1834814789	GBIVKDBFYKIXGT-KRWDZBQOSA-N	446.379	1.362	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3cccs3)CCO2)C1	1836083650	OCFAZQIJCLHJJD-KDOFPFPSSA-N	445.379	1.778	50	20	IDGD	
O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)Cc1ccsc1)CCO2	1836097165	VXSQZINPDSVSRY-QGZVFWFLSA-N	431.352	1.532	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnccc3F)CCO2)C1	1836319784	ZHDSLAPAJZFCJZ-PXAZEXFGSA-N	430.274	1.074	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC(OC2CCN(C(=O)CSC(=N)N)CC2)CC1	1836671380	XAXAJRMNRLUJKX-LBPRGKRZSA-N	449.415	1.643	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc4cnccc4[nH]3)CCO2)C1	1837097481	FFYFGEWFEJCGLX-OAQYLSRUSA-N	434.924	1.898	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CSCc3[nH]cnc3C)CCO2)C1	1837330656	DCXCGQMXSINRJG-KXBFYZLASA-N	444.985	1.425	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(-c4ccncc4)[nH]n3)CCO2)C1	1838012611	QLAYJZPMKIDODN-HRAATJIYSA-N	447.923	1.559	50	20	IDGD	
CN1CCCC[C@H]1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2	1839150658	SWRXSEKCDBLYTM-IPELMVKDSA-N	436.380	1.163	50	20	IDGD	
Cc1cccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)n1	1839151111	IGIHWOXTVJWAJR-RTBURBONSA-N	430.332	1.696	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)cn1C	1839200107	BYDUMWZMRYONIM-PBHICJAKSA-N	432.290	1.094	50	20	IDGD	
O=C(C1CCSCC1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839203471	LZRQVKRARGXMKI-BBRMVZONSA-N	439.347	1.277	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CC[C@@H](C)O3)C2)C1	1839965373	WXJHPTIQRLTVOR-ADAWSYLGSA-N	433.343	1.184	50	20	IDGD	
CC(C)N[C@H](C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2)C(C)C	1840032126	OEMDIVRHGIINLV-GJYPPUQNSA-N	448.402	1.249	50	20	IDGD	
C[C@@H](Oc1ccccn1)C(=O)N1CCOC[C@@]2(CN(C(=O)C(Cl)Cl)CCO2)C1	1840190600	DFIHYXWKBPRWBP-ACJLOTCBSA-N	432.304	1.109	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3cccc(O)c3)CCO2)C1	1840268284	PJADOYUTFPAJOF-WIYYLYMNSA-N	440.924	1.035	50	20	IDGD	
O=C(c1cc(F)cc(Cl)c1)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1	1840708824	DEFLWRVZAARLNS-MAUKXSAKSA-N	435.279	1.149	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)/C=C/c2cccc(C)n2)C1	1841043125	MYFNGMWAFOUPCN-NYXNPACISA-N	434.500	1.741	50	20	IDGD	
Cc1ccc(C(=O)N2CCCC23CN(C(=O)CN(C)NC(=O)NCc2ccccc2)C3)o1	1841705984	VCASUEXNHJKQBO-UHFFFAOYSA-N	439.516	1.751	50	20	IDGD	
O=C(c1cc2c(F)cc(F)cc2[nH]1)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843011365	VVBBOCQOXMQQGY-UHFFFAOYSA-N	439.227	1.257	50	20	IDGD	
CC(C)(C)OC(=O)N1CC2(C[C@@H](C(=O)N3CC4(CCCN4C(=O)[C@H](F)Cl)C3)CO2)C1	1843366827	SIHPYMFFIVAHPZ-KGLIPLIRSA-N	445.919	1.750	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)[C@H](C)Cc1ccco1)C2	1843417348	YSGFTTSESZAJFW-DSDXLYQOSA-N	425.489	1.796	50	20	IDGD	
C#CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)[C@@H](C)Br)C1	1846180187	RZHLVMWXDGPNFE-KGLIPLIRSA-N	442.354	1.890	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@H]1CC13CN(C(=O)OC(C)(C)C)C3)C2	1846365021	WJCGUDGBLHVPTD-GJZGRUSLSA-N	441.956	1.701	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CCN1C(=O)Cc2ccccc2C1=O	1847610061	YYMGNHSFVYGUQW-BZSNNMDCSA-N	431.920	1.821	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)N3CC[C@H]4[C@@H]3CCN4C(=O)c3cccc(B(O)O)c3)c[nH]2)cc1	1848309802	JFVCRORYAZBIPB-GOTSBHOMSA-N	443.312	1.799	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2ccccc2[N+](=O)[O-])cc1Br	12579713	CZILUXWRZNFIJJ-UHFFFAOYSA-N	430.236	1.989	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)c1cc(Cl)c(OCC(N)=O)c(OC)c1	14323355	IFAHLBDDSBLQEM-UHFFFAOYSA-N	435.864	1.615	50	20	IDGD	
COc1ncccc1C(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	105755511	JCIRURBLQROXGE-UHFFFAOYSA-N	429.440	1.867	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C[C@@H]1Sc2ccc(Cl)cc2NC1=O	725740429	DPVXLPPRDNHHFQ-ZDUSSCGKSA-N	438.918	1.782	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)c2csc(-c3ccc4c(c3)OCO4)n2)c2ccccc2c1=O	726523785	YCBXLKHENGAMRV-UHFFFAOYSA-N	449.448	1.861	50	20	IDGD	
O=C(COC(=O)Cc1cc2ccccc2nc1O)NNC(=O)[C@@H]1COc2ccccc2O1	728327509	BZOWBOPMOMVUHB-SFHVURJKSA-N	437.408	1.014	50	20	IDGD	
NC(=O)[C@H]1CC(C(=O)NNC(=O)c2cc(F)ccc2Br)=NN1c1ccccc1	728549079	BSCOTYCPQCDPBR-OAHLLOKOSA-N	448.252	1.469	50	20	IDGD	
Cc1nc2nc(N)nn2c(C)c1CC(=O)NNC(=O)c1cc(F)ccc1Br	728610691	KQKHHMSJJIWSRB-UHFFFAOYSA-N	436.245	1.229	50	20	IDGD	
Cc1ccc2c(c1)C(=O)N([C@H](C)C(=O)NNc1ccc(S(=O)(=O)NC3CC3)cc1)C2=O	730077205	NXJIQSFFHFKVCW-CYBMUJFWSA-N	442.497	1.564	50	20	IDGD	
COc1cc(C=O)c([N+](=O)[O-])cc1OCC(=O)NNC(=O)[C@@H](C)Oc1ccccc1F	731596960	NJXJQXPEBIFXSV-LLVKDONJSA-N	435.364	1.549	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc(OC)c1Br	731852944	PNUMCKBNTNMFSR-UHFFFAOYSA-N	447.249	1.517	50	20	IDGD	
COc1cc(-c2noc(CCC(=O)NNC(=O)c3c[nH]nc3C)n2)cc(Cl)c1OC	732086763	HSUDYCCBWDCOKV-UHFFFAOYSA-N	434.840	1.833	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)NCCn2cnc3ccccc32)c2ccccc2c1=O	732595606	UCHUGWXAFYYKQV-UHFFFAOYSA-N	433.472	1.971	50	20	IDGD	
Cn1c(NNC(=O)[C@@H]2CCN(c3ccc4c(c3)OCCO4)C2=O)nc2ccccc2c1=O	733261455	AFTXIMOSQONHOP-HNNXBMFYSA-N	435.440	1.201	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cc(C(=O)NNC(=O)CN(C)C)ccc2Cl)cc1	733360763	QZDMKGXKXHXLPB-UHFFFAOYSA-N	440.909	1.472	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)CC[C@@H]1NC(=O)N(c2ccc(C#N)cc2)C1=O	733804804	MPXDZKCXNLKKRE-SFHVURJKSA-N	449.467	1.552	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)NC2CCCC2)c(F)cc1Br	734416666	YTGBVIKABKYDQB-UHFFFAOYSA-N	438.275	1.810	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)c2cnn(-c3ccc(F)cc3)n2)CC1	737859492	RLHVNIXBIZQMTG-UHFFFAOYSA-N	447.471	1.750	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)N1CCN(S(=O)(=O)Cc2ccccc2)CC1	738496032	KRLIVOSRSLILIY-UHFFFAOYSA-N	446.529	1.092	50	20	IDGD	
CN(CCCC(=O)NNC(=O)c1ccc(C#N)cc1)C1=NS(=O)(=O)c2ccccc21	742058261	VJZONIPWKWKAQB-UHFFFAOYSA-N	425.470	1.180	50	20	IDGD	
COCCn1c(SCC(=O)NNC(=O)C2CC2)nc2sc3c(c2c1=O)CCCC3	742446126	NDWFWFCGSCVRON-UHFFFAOYSA-N	436.559	1.633	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)NCc2cccc(OCC(N)=O)c2)N(C)c2ccccc21	742771028	XRKPNGCBPJSVKT-UHFFFAOYSA-N	447.495	1.838	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CNc2ccc(C)cc2)cc(NS(C)(=O)=O)c1OC	743293665	GVOKKCOYXZGNCQ-UHFFFAOYSA-N	436.490	1.257	50	20	IDGD	
C[C@H](CCc1ccccc1F)C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	743418931	IJQQECZNIXLILB-MRXNPFEDSA-N	449.552	1.869	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)CNC(=O)c2ccccc2OC)cc1Cl	743834272	YCHCASVBGMIZBJ-UHFFFAOYSA-N	436.852	1.949	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)CCC(=O)N2CCc3sccc3C2)cc1	744836491	LYOCYIXNINWUHJ-UHFFFAOYSA-N	440.481	1.289	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)[C@H](c2ccccc2)N2CCC(O)CC2)c1	744963250	ISZJJNJVQPAHQE-NRFANRHFSA-N	436.468	1.060	50	20	IDGD	
C[C@H]1OC(C)(C)N(C(=O)OC(C)(C)C)[C@@H]1C(=O)NNC(=O)CNC(=O)c1cccs1	746198626	XNFZWMPATRUGOP-RISCZKNCSA-N	440.522	1.386	50	20	IDGD	
COc1ccc(C(=O)NNc2oc(C(C)C)nc2C#N)cc1S(=O)(=O)N1CCOCC1	746335793	RTFNZAYXFKAMKI-UHFFFAOYSA-N	449.489	1.456	50	20	IDGD	
Cc1c(Cl)cc(C(=O)O)cc1S(=O)(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	747610020	ZOEMMXKNIWBGIL-UHFFFAOYSA-N	446.890	1.373	50	20	IDGD	
CCCC(=O)N1CCC[C@@H]1C(=O)OCC(=O)NNC(=O)c1cc(Cl)ccc1OC	748376937	LAGDLPFFIPGGLG-CQSZACIVSA-N	425.869	1.444	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)[C@H]2CCCN2C(=O)c2ccc3c(c2)OCO3)c1O	749737004	MCUCYYSSLYPWOA-CQSZACIVSA-N	427.413	1.195	50	20	IDGD	
O=C(CCc1ccccc1)NNC(=O)c1ccc2c(c1)SC1=NS(=O)(=O)CCN12	749803959	NHPFYTLTGNUFQV-UHFFFAOYSA-N	430.511	1.692	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H]2CCCOc3ccccc32)c1	750338495	MMQNHCWQKLCBGC-QGZVFWFLSA-N	432.502	1.795	50	20	IDGD	
CN1CC[C@H](C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c2ccccc21	750715161	QCAZWPJRMFJICO-IBGZPJMESA-N	442.541	1.856	50	20	IDGD	
COc1cc(OC)cc(N2C[C@@H](C(=O)NNC(=O)Nc3ccc(N(C)C)cc3)CC2=O)c1	752522013	YEUYGDFRCYITIL-AWEZNQCLSA-N	441.488	1.976	50	20	IDGD	
COC(=O)c1c(Br)ccc(NC(=O)C(=O)NNC(=O)c2ccccn2)c1C	753839628	MEXVQHSKPJUETB-UHFFFAOYSA-N	435.234	1.339	50	20	IDGD	
N#C/C(=C\c1ccc(O)cc1)C(=O)OCC(=O)NCc1ccc(C(=O)N2CCOCC2)cc1	754550023	NXGQGMFYRDEACZ-DEDYPNTBSA-N	449.463	1.631	50	20	IDGD	
CCOc1ccc(NC(=O)NNC(=O)C2CCCC2)cc1S(=O)(=O)N1CCOCC1	755546518	MFYRXYCXAOOEFJ-UHFFFAOYSA-N	440.522	1.449	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccccc2-n2cccn2)c1	755862269	QDWZLVINNWWJKB-UHFFFAOYSA-N	428.474	1.589	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)Nc2cc(S(=O)(=O)N(C)C(C)C)ccc2C)n1	755960278	JKQRXCHOAHRTNS-UHFFFAOYSA-N	436.538	1.690	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)COc2cc(C)ccc2C)cc1NS(C)(=O)=O	756785967	HFRDZBNWGZKVKD-UHFFFAOYSA-N	436.490	1.915	50	20	IDGD	
COc1ccc(OC(F)F)c(CNC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c1	757252822	OKKPACVLUIONII-UHFFFAOYSA-N	447.398	1.688	50	20	IDGD	
CCS(=O)(=O)c1ccc(CCC(=O)NNC(=O)CCN2C[C@H](C)O[C@H](C)C2)cc1	757720123	FXJZTCGCFRQSRO-IYBDPMFKSA-N	425.551	1.060	50	20	IDGD	
Cc1nn([C@@H]2CCS(=O)(=O)C2)c(C)c1NC(=O)NNC(=O)COc1ccc(F)cc1	757871949	RLYXXJZKNPCONW-CQSZACIVSA-N	439.469	1.230	50	20	IDGD	
NC(=O)[C@@H]1CC[C@@H](CNC(=O)NNC(=O)COc2ccc(OCc3ccccc3)cc2)O1	760204249	PEULQLWBXWJVRV-OALUTQOASA-N	442.472	1.008	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)CCCc2nc(O)c3ccccc3n2)n1	760930334	LAJLNVWIWMNSCH-UHFFFAOYSA-N	443.485	1.356	50	20	IDGD	
O=C(NNC(=O)c1ccccn1)C(=O)Nc1cccc(F)c1I	763463793	LPXQUBOMIGSXNE-UHFFFAOYSA-N	428.161	1.225	50	20	IDGD	
CN(C)C1CCN(c2ccc(NC(=O)C(=O)NNC(=O)c3ccccc3O)cc2)CC1	763526759	FJUWPPUYKDPYGV-UHFFFAOYSA-N	425.489	1.322	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(N3CCOC[C@@H]3C)cc2)cc1OC	763541977	CNHNGIGMCWVINH-AWEZNQCLSA-N	442.472	1.329	50	20	IDGD	
COC(=O)c1sccc1NC(=O)C(=O)NNC(=O)COc1cccc(C(F)(F)F)c1	763639002	HYUMRSYCICCSEZ-UHFFFAOYSA-N	445.375	1.718	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(N2CCOC[C@H]2C)cc1	763649081	YTJNRGRZHHGKQW-OAHLLOKOSA-N	442.472	1.085	50	20	IDGD	
C[C@@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)COc3ccccc3F)cc2)CCO1	763681959	SZFJQGMSVXCLIW-CQSZACIVSA-N	430.436	1.216	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(C(=O)NC2CC2)cc1	763682191	OZSCCUAHWOBTEW-UHFFFAOYSA-N	440.456	1.142	50	20	IDGD	
COCCOc1ccc(C#N)cc1NC(=O)C(=O)NNC(=O)COc1ccc(Cl)cc1	763694847	LKWLRLKXJXDSSQ-UHFFFAOYSA-N	446.847	1.402	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2ccc(OC(C)C)cc2)c2ccccc2c1=O	763786474	OHOWELUTKSYOEA-UHFFFAOYSA-N	437.456	1.603	50	20	IDGD	
CC(C)C[C@@H](C)n1nccc1NC(=O)C(=O)NNC(=O)COc1ccccc1[N+](=O)[O-]	763803337	LOHRJJFTIFIBFJ-CYBMUJFWSA-N	432.437	1.563	50	20	IDGD	
Cc1ccc(Cn2nccc2NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)s1	763814393	SRLNFPZRCVNYGS-UHFFFAOYSA-N	438.469	1.338	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1cccnc1OCC(F)F	763849395	JAEQGLQGQJPFKV-JTQLQIEISA-N	426.351	1.418	50	20	IDGD	
CCc1c(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(C(C)=O)cc2)cnn1CC(C)C	763875882	BMJIJFBQWUBPCB-HNNXBMFYSA-N	443.504	1.858	50	20	IDGD	
COC(=O)c1cc(C)ccc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccc(C(C)=O)cc1	763878426	QNCQBNPPXVHJPZ-AWEZNQCLSA-N	441.440	1.538	50	20	IDGD	
CCc1noc(C)c1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1cccc(Br)c1	763884845	YMPJRFFTXUMNTA-JTQLQIEISA-N	439.266	1.861	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(Cn3cccn3)c2)cc1OC	763912457	OHSMNWXUZZWNDP-UHFFFAOYSA-N	437.456	1.738	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)C(=O)Nc1ccc(C(=O)N2CCCC2)cc1	763995806	QXDKLLPSGHUQSW-UHFFFAOYSA-N	448.277	1.413	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)C(=O)Nc1cc(Cl)c(Cl)cc1Cl	764002755	RMXMZMGMBLMUPN-LURJTMIESA-N	428.681	1.167	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2cccc3ccccc23)cc1-n1nnnc1C	764047158	BOTCRMWKYHUKKD-UHFFFAOYSA-N	445.439	1.532	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1O)C(=O)Nc1ccccc1CN1C(=O)CCC1=O	764124429	GYVGAEPPXXVEMW-UHFFFAOYSA-N	444.831	1.094	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2cccc(C#Cc3ccccn3)c2)c1O	764130770	FFWMXOBKDCKBDR-UHFFFAOYSA-N	430.420	1.595	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(Cl)c(C(=O)NC)c2)o1	764138651	HBEQIUYRANAXPZ-UHFFFAOYSA-N	449.895	1.534	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2O1)C(=O)Nc1ncn(Cc2ccc(Cl)cc2)n1	764164625	RMSGFKJCJAPWKT-MRXNPFEDSA-N	440.847	1.069	50	20	IDGD	
O=C(CCc1ccccc1)NNC(=O)C(=O)Nc1ccc(CN2C(=O)CSC2=O)cc1	764191635	CYCSVHBRGLCKCJ-UHFFFAOYSA-N	440.481	1.601	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1ccc(Cl)c(OC(F)F)c1	764277354	CIMKEPLQLNXOHX-UHFFFAOYSA-N	429.763	1.812	50	20	IDGD	
C=CCN(CC=C)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)Cc2ccccc2F)cc1	764319516	LODBQQJEXDWZRV-UHFFFAOYSA-N	438.459	1.969	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1)C(=O)N1CCc2cc(F)c(F)cc21	764386795	CVRDGSKVQZPFDY-UHFFFAOYSA-N	429.358	1.844	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cccc(OCC#N)c3)n[nH]2)cc1C	764387267	IRBRCTKTZJHUPK-UHFFFAOYSA-N	432.440	1.996	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1ccc(C)c(NC(C)=O)c1	764394592	SKXSLBGYAHHBAP-UHFFFAOYSA-N	430.486	1.840	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1	764398146	PAZNNTIWRINRCF-AWEZNQCLSA-N	426.429	1.488	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(-c2ncc3n2CCCC3)cc1	764401234	URFRFMAVTKZZLZ-CQSZACIVSA-N	429.477	1.024	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)C(=O)Nc1ccc(-n2cncn2)c(Cl)c1	764405899	XZFIWIJBFIJYGP-UHFFFAOYSA-N	446.876	1.505	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)c1ccc(F)cc1Br)S(=O)(=O)C1CCOCC1	764940462	QMRKKJPNLMBMPB-VIFPVBQESA-N	437.287	1.332	50	20	IDGD	
COc1ccc(S(N)(=O)=O)cc1C(=O)NNC(=O)c1cc(-c2cc(C)ccc2C)[nH]n1	765576208	ONUICLAYDJATJI-UHFFFAOYSA-N	443.485	1.424	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C2CCN(C(=O)c3cccnc3)CC2)n[nH]1	768276551	KODHLGNQNGMNES-UHFFFAOYSA-N	448.483	1.794	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@H](C(=O)NNC(=S)Nc3ccccn3)C2)cc1	768578187	DCEWAICNEVEQKI-HNNXBMFYSA-N	433.559	1.809	50	20	IDGD	
CC(=O)N1CCc2c(NC(=O)C(=O)NNC(=O)c3cc(-c4cccs4)[nH]n3)cccc21	769267830	TYVJYXXWDIJRJC-UHFFFAOYSA-N	438.469	1.447	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2c[nH]c3cccc(F)c23)c1	769862091	IMGVQIPQHQNHKR-UHFFFAOYSA-N	440.478	1.181	50	20	IDGD	
C[C@H]1CN(C(C)(C)CNC(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)C[C@H](C)O1	770341246	MBLSIUCOVHQJGT-STQMWFEESA-N	434.545	1.801	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)NCc3ccc(OCCN4CCCC4)cc3)nc21	770395297	HQFLYGMRUJCBIN-UHFFFAOYSA-N	426.481	1.370	50	20	IDGD	
CCc1c(C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)cnn1-c1ccc(OC)cc1	771350675	NDLMILOFWSLCPZ-UHFFFAOYSA-N	446.508	1.912	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1cccc(S(=O)(=O)N2CCCCCC2)c1	771891873	VPUCJFAASGPCGQ-CQSZACIVSA-N	425.507	1.354	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)c1ccc(CN2C(=O)CCC2=O)cc1	772194873	DRTYHARAPKXAMD-UHFFFAOYSA-N	442.859	1.066	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)c1cn(-c2ccc(Cl)cc2)nn1	772195432	MCHWSAXNLNJAAW-UHFFFAOYSA-N	433.255	1.652	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNS(=O)(=O)c1ccc2c(c1)n(C)c(=O)n2C	773263203	FHBJRPXWKWQVEH-LLVKDONJSA-N	438.893	1.307	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccc(Br)cn1	773526535	CZJVLUZHYCKCLO-SECBINFHSA-N	425.214	1.537	50	20	IDGD	
CC(=O)N1CCN(Cc2ccc(NC(=O)C(=O)NNc3ccc([N+](=O)[O-])cc3)cc2)CC1	773642856	GVOHCZCRLNIMBB-UHFFFAOYSA-N	440.460	1.341	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCN(c3cccc4cnccc34)C[C@@H]2C)n1	773952958	CRRZJJKYLZAVFN-INIZCTEOSA-N	438.557	1.900	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)Nc2ccnn2[C@H]2CCS(=O)(=O)C2)c1C	776059709	QYDAYALYGKAOSR-GJZGRUSLSA-N	435.506	1.480	50	20	IDGD	
CSCCCCCNC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	776257200	COIUEWVFVLXSLH-UHFFFAOYSA-N	430.600	1.177	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNS(=O)(=O)c1ccc(OCC(F)(F)F)nc1	777932231	DPSUYMMMKJNOOL-UHFFFAOYSA-N	428.392	1.987	50	20	IDGD	
COc1cccc([C@@H]2[C@@H](C(=O)NNC(=O)CNC(=O)OC(C)(C)C)CC(=O)N2C2CC2)c1	778442790	FAQRTDRLWRRMLD-QFBILLFUSA-N	446.504	1.419	50	20	IDGD	
Cc1cc(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)nc(C(F)(F)F)n1	778940731	IXPNQFSHBJNLDC-UHFFFAOYSA-N	445.423	1.582	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)[C@H]1CC(c2ccccc2[N+](=O)[O-])=NO1	782025210	BODRKBRUVPNROV-OAHLLOKOSA-N	435.437	1.540	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNc2ncncc2Cl)cccc1C(=O)N1CCSCC1	782166727	UUCNNVNSCNQZHW-UHFFFAOYSA-N	434.909	1.709	50	20	IDGD	
Cc1nc(-c2cccc(NC(=O)C(=O)NNC(=O)CNC(=O)c3ccco3)c2)cs1	784004812	VQDFMLPEBGNPPW-UHFFFAOYSA-N	427.442	1.227	50	20	IDGD	
CNC(=O)[C@@H]1CN(C(=O)C(=O)NNc2ccc(Br)cc2C)c2ccccc2O1	784412897	KYEHZJXUDJEWHO-INIZCTEOSA-N	447.289	1.741	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)C(=O)Nc2ccc(OC)c(N3CCOC3=O)c2)c1	784852949	ZEOACNTWIYZUGA-UHFFFAOYSA-N	428.401	1.520	50	20	IDGD	
O=C(NNc1cc(F)c(F)c(F)c1)C(=O)Nc1ncn(CC(=O)N2CCCCCC2)n1	785088497	OFBFQAFTFVCLFQ-UHFFFAOYSA-N	439.398	1.180	50	20	IDGD	
COC[C@H](C)NC(=O)NC(=O)COC(=O)/C(C#N)=C\c1cc(C)n(C[C@H]2CCCO2)c1C	786384442	LRIXLLIRZKDIDA-YGFFJDEVSA-N	446.504	1.595	50	20	IDGD	
Cn1cc(-c2ncccc2NC(=O)C(=O)NNC(=O)c2cc3ccccc3cc2O)cn1	786415151	YPXSQIODAFSNAS-UHFFFAOYSA-N	430.424	1.741	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2cc(Cl)ccc2OCC2CCC2)CCS(=O)(=O)C1	786423050	BNASWDFAZLZYCX-GOSISDBHSA-N	429.926	1.655	50	20	IDGD	
COc1cc(C)c(S(=O)(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1Cl	788478606	QTVBGYZGSMUEFT-UHFFFAOYSA-N	446.938	1.573	50	20	IDGD	
COC(=O)COc1ccc(C=NNC(=O)[C@H](C)CN2C[C@@H](C)O[C@H](C)C2)cc1[N+](=O)[O-]	788702075	NUJIDKYSTXTHTR-RBSFLKMASA-N	436.465	1.342	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)c(OC(F)F)c1	789735290	LDZMNWDHWLAPMM-UHFFFAOYSA-N	449.819	1.672	50	20	IDGD	
O=C(NCc1ccccc1S(=O)(=O)N1CCCCC1)NNc1nc2ccccn2n1	790133570	DADVZUQJASIHID-UHFFFAOYSA-N	429.506	1.730	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)NC(=O)OC(C)(C)C	792265075	UQMBPWFTIZDHAC-QGZVFWFLSA-N	448.568	1.442	50	20	IDGD	
Cc1cc(Cl)ccc1OCCCC(=O)NNC(=O)CN1C(=O)N[C@](C)(C2CC2)C1=O	792550240	GFVOWUDMTOVPSK-HXUWFJFHSA-N	436.896	1.675	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C[C@@H](C)NS(=O)(=O)c1cccnc1Cl	792797272	AEJJAMVYGFOQDR-GFCCVEGCSA-N	440.909	1.191	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2ccc3c(c2)N(CC(F)F)CCS3)CCS(=O)(=O)C1	793039771	BXFNZGZLBNRYGC-KRWDZBQOSA-N	448.517	1.000	50	20	IDGD	
O=C(CN1C(=O)C(F)(F)Oc2ccccc21)NNC(=O)c1nnc(O)c2ccccc12	794208925	CDCNMBYJYOMOPZ-UHFFFAOYSA-N	429.339	1.115	50	20	IDGD	
COc1cccc(Cn2nccc2NC(=O)C(=O)NNC(=O)c2cccc(C)n2)c1OC	797370039	FGQBVVFILUPTEM-UHFFFAOYSA-N	438.444	1.052	50	20	IDGD	
CC(C)NC(=O)C(=O)NNC(=O)c1ccc2cc(I)ccc2n1	797702057	PPBUSGQGQLIRRJ-UHFFFAOYSA-N	426.214	1.125	50	20	IDGD	
Cc1nc2c(c(C)nn2C)c(C)c1CC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	802067123	MDUVSVOELFGQMW-UHFFFAOYSA-N	444.517	1.692	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)CCN/C(O)=C2\N=CC=CC2=O)c(OC)cc1Cl	802081337	LEQXVQGYXGHFDV-WUKNDPDISA-N	437.840	1.426	50	20	IDGD	
Cc1nnnn1[C@@H](Cc1cccc(F)c1)C(=O)NNC(=O)Nc1ccc(N(C)C)cc1	802120146	YZIXMZDNRAJSLW-SFHVURJKSA-N	426.456	1.823	50	20	IDGD	
COc1ccc(C2=NO[C@@H](CNC(=O)NNc3nc(O)c4cnn(C)c4n3)C2)cc1C	802351864	MAOKHGXKTMLCGQ-GFCCVEGCSA-N	426.437	1.205	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)C(=O)N1CCc2cc(F)ccc21	802565816	LYPRNHIZOZHUNE-UHFFFAOYSA-N	439.491	1.075	50	20	IDGD	
CNS(=O)(=O)c1cc(NC(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)ccc1F	806545828	FMNMOAPGLMRBJG-UHFFFAOYSA-N	438.466	1.652	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)NCc1ccccc1S(N)(=O)=O	807605900	XSQWXOGIFIVUBA-UHFFFAOYSA-N	445.526	1.910	50	20	IDGD	
Cn1nc(SCC(=O)NN=C2[C@H]3CCC[C@@H]2Cc2ccccc2C3)c(=O)n(C)c1=O	807960210	BTLJEEAKPFERAF-IYBDPMFKSA-N	427.530	1.258	50	20	IDGD	
CN(C)CCCOc1cnccc1CNC(=O)NNC(=O)c1cc(Br)c[nH]1	808188237	QOULACNGIVOLES-UHFFFAOYSA-N	439.314	1.647	50	20	IDGD	
COC[C@]1(C(=O)NNC(=O)c2ccc(OC)c(OC)c2)CCN(C(=O)OC(C)(C)C)C1	809950532	SDEWNHSVQFFNBN-NRFANRHFSA-N	437.493	1.738	50	20	IDGD	
CCOC(=O)Nc1scnc1C(=O)NNC(=O)c1sc(N2CCOCC2)nc1C	813365657	KNZLEUVAKYHJNX-UHFFFAOYSA-N	440.507	1.388	50	20	IDGD	
CCCc1nc(C)c(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)o1	813862309	DDMKZFKLHZUKPE-UHFFFAOYSA-N	449.533	1.864	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)Cc1nc(-c2ccc(S(C)(=O)=O)cc2)cs1	815457614	JEHPSQPQBUTVIA-NSHDSACASA-N	439.515	1.245	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)cc2cccnc12	815570394	BBDPZAHFEHTSRZ-UHFFFAOYSA-N	426.454	1.827	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)Nc1nc(CC(F)(F)F)cs1	815606033	LVFLRUBLQRYUTP-UHFFFAOYSA-N	433.324	1.261	50	20	IDGD	
CCOc1ccc(-n2ncc(C(=O)NNC(=O)C(=O)Nc3ccc(C)c(C)c3)c2C)nn1	818328577	SUAXLDJXUZNDLN-UHFFFAOYSA-N	437.460	1.386	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)[C@@H](O)[C@H](O)c2nc3ccccc3s2)c1C	831083186	RZUPDGHKDDQFLO-BVGQSLNGSA-N	429.498	1.922	50	20	IDGD	
Cc1nnnn1/C(=C\c1ccccc1)C(=O)OCC(=O)NNC(=O)c1cccc(Cl)c1	849196532	PFFQQYRECSCLEM-YVLHZVERSA-N	440.847	1.637	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)c1ccc(S(C)(=O)=O)c([N+](=O)[O-])c1	869723645	DJTXUQGXQIJOEP-UHFFFAOYSA-N	437.430	1.237	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)c2ccc(S(=O)(=O)NC[C@H]3CCCO3)cc2)c1	913445633	CERNVVXUQUHJEZ-GOSISDBHSA-N	447.513	1.292	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)N[C@@H](CN1CCOCC1)c1ccccc1	914598810	STIWJHBBONFPJX-SFHVURJKSA-N	428.489	1.478	50	20	IDGD	
O=C(Cc1ccc(Cl)cc1)NNC(=O)NCc1ccc(C(=O)N2CCOCC2)cc1	916248769	OWZHLMVWRNGBLR-UHFFFAOYSA-N	430.892	1.886	50	20	IDGD	
COc1cc(C=NNC(=O)C(N)=O)ccc1OCCOc1cccc(Br)c1	916272474	XFWKGFIATDGBFG-UHFFFAOYSA-N	436.262	1.851	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)N2CCN(C(=O)C(=O)N3CCCC3)CC2)c(C)n1CC(C)C	916433434	QISGCOCOFKPDIO-KGENOOAVSA-N	439.560	1.961	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)NCCS(=O)(=O)NC(C)(C)C)c1	916622512	WOMQDCJLZUVDRB-UHFFFAOYSA-N	428.555	1.546	50	20	IDGD	
O=C(Cc1ccc2ccccc2c1)NNC(=O)NCCS(=O)(=O)NCc1ccccc1	916645321	QVDHLKARRJKRJW-UHFFFAOYSA-N	440.525	1.832	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)N[C@@H](c1ccc(F)cc1)[C@@H]1CCCO1	918126038	FBCXQVYXDJCCNY-ROUUACIJSA-N	425.424	1.666	50	20	IDGD	
COc1ccc(CNC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c(OC)c1OC	918227694	WDMVAYPZFDSQMJ-UHFFFAOYSA-N	437.474	1.260	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@H]2CCCCN2C(=O)c2ccco2)c2ccccc2c1=O	918409232	HIEWGSAHDHUFSF-MRXNPFEDSA-N	437.456	1.465	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)Nc2ccc3c(c2)N(S(N)(=O)=O)CC3)c1C	918639118	CYHDYPQCRSMTOA-WQRHYEAKSA-N	443.529	1.863	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc(C(F)(F)F)ccc1Cl)N[C@H]1CCS(=O)(=O)C1	919961298	ZWIQUNIVIVSZPI-QMMMGPOBSA-N	435.833	1.038	50	20	IDGD	
Cn1c(C=NNC(=O)CSc2nc3ccccc3s2)nc2c1c(O)nc(=O)n2C	920361740	WJVFYBJZQLALPX-UHFFFAOYSA-N	429.487	1.225	50	20	IDGD	
CC[C@H]1CN(C(=O)/C(C#N)=C\c2cn(CCC(N)=O)nc2-c2ccc(OC)cc2)CCO1	920854208	WKKRASAJGYDUKU-GTVARFKMSA-N	437.500	1.978	50	20	IDGD	
Cc1nc(-c2ccc(Cl)s2)sc1C(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1	921030294	MUKDUHGOEPTGIJ-QMMMGPOBSA-N	434.952	1.965	50	20	IDGD	
C[C@@H](OC[C@@H]1CCCCO1)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	921146451	ZRVYWOCMGXURFZ-WBVHZDCISA-N	439.534	1.206	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)[C@@H]2CCCCN2S(=O)(=O)c2ccccc2)c1	929086614	ZNNNCHMKHHXZMV-IBGZPJMESA-N	447.513	1.708	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Cl)C1	1778027197	DQVRVSUORLANMP-FRIZHTMISA-N	435.924	1.950	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2nn(C)c3c2CCC3)C1	1778674627	DNUBHIHWJWSLJB-LUQKVYGDSA-N	438.956	1.290	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1CC[C@H]3CCC(=O)N3C1)CCO2	1779300729	WGZGELGNVYUZAC-WWMYMODYSA-N	437.613	1.069	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1cncnc1)C2	1780710458	VXZDSIVUALVLMU-ATZDWAIDSA-N	429.348	1.769	50	20	IDGD	
CC[S@](=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@](C)(Cl)CCl)C1	1780711792	DEERLKTWTWEOFU-OFARMESDSA-N	441.421	1.895	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2)c1cc(F)cc([N+](=O)[O-])c1	1780994306	UKGRNTQJXJNFAI-GPMSIDNRSA-N	443.859	1.461	50	20	IDGD	
Cc1nc2ncccn2c1C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781329979	OZFKPLOCRAGJSL-DYVFJYSZSA-N	440.273	1.172	50	20	IDGD	
O=C(c1nc(O)n2c1CCCC2)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781331245	HEHTWIUALIDSJO-GUYCJALGSA-N	445.289	1.059	50	20	IDGD	
O=C([C@@H](F)Br)N1CCO[C@]2(CCN(C(=O)C3(Br)CC3)C2)C1	1781347408	UEDLGCNSLYIOPZ-BXKDBHETSA-N	428.096	1.434	50	20	IDGD	
O=C(c1ccc(OC(F)(F)F)cc1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1781556918	QSMVIIXCDFNTKR-WMLDXEAASA-N	436.814	1.628	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)Cc3ccc4ncccc4c3)CCO2)C1	1783870938	JWBNWLDSEJKFNN-GCJKJVERSA-N	431.920	1.861	50	20	IDGD	
O=C(C#Cc1ccc(Cl)cc1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21	1783919012	XOTLVIOMENKIHS-OWLYRPNTSA-N	425.312	1.271	50	20	IDGD	
COC(=O)CCCCCC(=O)N1CC[C@@]2(CN(C(=O)CCBr)CCO2)C1	1784044383	UKFUDZHGTKIKHR-SFHVURJKSA-N	433.343	1.725	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)CCc3ccc(N(C)C)cc3)C2)C1	1784246807	OUWPHDYZRHFGFO-SIKLNZKXSA-N	437.968	1.769	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)NC(=O)OC(C)(C)C)C[C@@H]21	1784620053	ICZMTQARILKECG-KSXIZUIISA-N	447.960	1.217	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnoc3C3CC3)[C@H]2C1	1786289889	YKPHRAAZWASHKQ-LVGORTOPSA-N	426.311	1.929	50	20	IDGD	
O=C(CCc1cccnc1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21	1787108019	RJEPKVJLEJSFLI-JKQORVJESA-N	428.302	1.684	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(CC(C)C)nn3C)[C@H]2C1	1787213497	ZJWJHMKNZQQKMX-XPYUAMARSA-N	440.972	1.466	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC1(c2ccc(NC(=O)CC[C@H](N)C(N)=O)cc2)CCC1	1788059921	BPIZHHJSLHESBD-KSSFIOAISA-N	429.348	1.950	50	20	IDGD	
CC[S@@](=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]21	1788492592	ZRXKTJNRQQTVSX-LRRKKCTGSA-N	427.394	1.361	50	20	IDGD	
Cc1ccn(C)c1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)CBr)C[C@@H]21	1789384403	XRYMWJORMJMMFD-UGUYLWEFSA-N	426.355	1.958	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(Cl)nn3)C[C@@H]21	1789870759	UNVNNXFMSYNUMA-BTIUKSQHSA-N	435.739	1.960	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nc4ccccn4n3)C[C@@H]21)[C@@H](F)Br	1789922882	NMRFJJMRLKYQQU-ZJQBRPOHSA-N	440.273	1.013	50	20	IDGD	
COCc1c[nH]c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]3C2)c1	1789924825	XUOLPZAQPKRQMC-JURCDPSOSA-N	432.290	1.445	50	20	IDGD	
CN1CCN(C2(C(=O)Nc3ccc(C4(NC(=O)[C@@H](O)CCl)CCC4)cc3)CC2)CC1	1790445587	MJFCHENAPAPIOV-SFHVURJKSA-N	434.968	1.500	50	20	IDGD	
CCC(=O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C[C@@H]21	1790814422	WGUBYVNERDVRTB-YXWQFLTLSA-N	445.944	1.077	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CSc1ccncc1	1793950142	RWBZMGJTTQGORL-JFILPPLUSA-N	428.352	1.547	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(NC(C)=O)o1	1797749630	RMMHNRQZHWMBSY-OQMKEHIESA-N	442.310	1.615	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(OC(F)F)cn1)C2	1797954360	ATVRVHCAYJILGY-FVCICTRLSA-N	443.523	1.738	50	20	IDGD	
O=C(CCc1noc(-c2ccccc2)n1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2	1799045066	YSMXWRVHQXJLMQ-DACLVMHWSA-N	436.871	1.793	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)N(C)C(=O)OC(C)(C)C)C2	1799268791	KCRPFKMHPPCCAW-RBGFHDKUSA-N	431.961	1.849	50	20	IDGD	
Cc1cc(Br)ccc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2	1799499260	NKQAEETVGCRGKG-NOXHYTERSA-N	445.741	1.560	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CC(c2ccccc2)=NN1	1800154635	DEEWPYYGKSHNKW-NZGUISNBSA-N	444.608	1.194	50	20	IDGD	
C[C@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](F)Br)[C@H]1SC(=N)NC1=O	1800159279	PKBTVPCJUHYRHF-IMHINIOTSA-N	435.319	1.118	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCc1cnccn1	1801408829	PGVDRQUUZVMFJR-YXPYIKCWSA-N	425.327	1.172	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@H]1CCN(C(=O)c2ncnn2C)[C@@H]1c1cccnc1	1803007414	AHEAWHZDIHGNSK-BPLDGKMQSA-N	435.326	1.561	50	20	IDGD	
COC(=O)[C@@H]1CC[C@H](C(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)C1	1803130480	QSDPXOIFJUCDAP-QJESEZNXSA-N	437.924	1.276	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cnc3ccccn23)[C@H]1c1cccnc1)[C@H](O)CCl	1803138541	CFYPARKMCXVEFL-WDYCEAGBSA-N	427.892	1.649	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2nc(O)n3c2CCCC3)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803143037	RLNBMZGWAXIMOO-QILLFSRXSA-N	447.923	1.239	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)Cc2ccccc2)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803146511	BHVLIHFTDNEWJB-ZGXWSNOMSA-N	431.920	1.291	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)CCc2ccco2)[C@H]1c1cccnc1	1804590981	JGXDSEPDYFGPPJ-WZONZLPQSA-N	441.532	1.686	50	20	IDGD	
O=C(CN1CCc2sccc2C1)N1CCC2(CCCN(C(=O)[C@@H](O)CCl)C2)CC1	1805518535	TXHQYPPKKNOYSX-KRWDZBQOSA-N	440.009	1.937	50	20	IDGD	
CC[C@@H](C(=O)N1CCCC2(CCN(C(=O)c3ccc(B(O)O)cc3)CC2)C1)N(CC)CC	1806170099	WAQQPGALFJUESC-NRFANRHFSA-N	443.397	1.332	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)c2cocn2)[C@@H]1c1cccnc1	1808414833	MDUDSWSPAZXSBC-CPJWQURSSA-N	449.471	1.523	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCC2(CCCN(C(=O)[C@@H](C)CN)C2)CC1	1809649871	DCFQNPIZMINQLX-HNNXBMFYSA-N	446.504	1.960	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)c1c[nH]c2cnccc12	1810061262	JINHXUGHHYTIGO-JVPBZIDWSA-N	427.892	1.877	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC2(CCCN(C(=O)c3c[nH]c4nccc-4c3)C2)CC1	1810637434	GWKCURAEBCEBPQ-UHFFFAOYSA-N	446.316	1.353	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1ccccc1F	1811673524	PFOIPAQGIYJATK-AVRDEDQJSA-N	447.275	1.534	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@H](CNC(=O)CSCC(=O)O)[C@H]1c1cccnc1	1813086105	GPDJTOIYOPCVOS-HNAYVOBHSA-N	439.610	1.757	50	20	IDGD	
O=C(CSc1ncccn1)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](O)CCl)CC2	1815624074	YJGAHIULFYMPQY-ONGXEEELSA-N	427.939	1.237	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1cncc(F)c1	1816530997	NOFZAHXBICIFFZ-SFHVURJKSA-N	437.240	1.243	50	20	IDGD	
COC(=O)c1ccc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@H](O)CCl)CC3)cn1	1817535556	KENYRASBFDJRTL-GXFFZTMASA-N	438.893	1.150	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1)[C@H]1Cc2ccccc2CN1	1818045283	VCJXRMOOJWPYLG-SQNIBIBYSA-N	431.924	1.716	50	20	IDGD	
Cc1ccoc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819403017	SIYPBFNLFFHXAG-MRXNPFEDSA-N	437.460	1.929	50	20	IDGD	
O=C(c1ccc2nc(CO)[nH]c2c1)N1CCC([C@H]2CCCCN2C(=O)[C@@H](O)CCl)CC1	1824182803	LEQNICCHJGEIHR-MOPGFXCFSA-N	448.951	1.888	50	20	IDGD	
Cc1ccc(C(=O)NCC(=O)N2CCC([C@H]3CCCCN3C(=O)[C@@H](O)CCl)CC2)cc1	1824188215	PUQAILSPVOFYOQ-UXHICEINSA-N	449.979	1.944	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCc1cnn(C)c1)CC2	1825999927	YBNXDKXDTODGOD-OLZOCXBDSA-N	425.942	1.675	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)c2cncc(F)c2)CC1	1826056759	DHNMWZZUFMEBHQ-NRFANRHFSA-N	439.296	1.448	50	20	IDGD	
C[C@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1)C1(O)CCC1	1827049341	RMTLMEQYTJJTJP-UTKZUKDTSA-N	442.365	1.151	50	20	IDGD	
O=C(C1=COCCC1)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827054394	CJUBMISLJNSRMX-OAQYLSRUSA-N	426.322	1.294	50	20	IDGD	
C[C@@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1)n1cccc1	1827055474	YMXPDMLUOIEUDU-AVRDEDQJSA-N	437.349	1.662	50	20	IDGD	
O=C(Cc1c(F)cccc1Cl)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1	1830283928	WXAZZTQSLYQWNJ-APWZRJJASA-N	449.306	1.078	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3ccc(F)nc3)C2)C1	1830358539	OLWJBMXWFYQYPS-NRFANRHFSA-N	441.931	1.875	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C(F)F)no3)C2)C1	1830358632	YSOZYMXEATWEON-GOSISDBHSA-N	435.855	1.947	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnn4ccncc34)C2)C1	1830362408	VTWXZLQKMYTUSC-FQEVSTJZSA-N	435.912	1.064	50	20	IDGD	
COc1cc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)ccn1	1831873429	KLNXUFFNUCJIJM-IBGZPJMESA-N	445.564	1.697	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)CN3CCOCC3)CC2)CC1	1833532119	CZXSHQCJTKETAK-IBGZPJMESA-N	429.005	1.298	50	20	IDGD	
CCOC(=O)/C=C/C(=O)NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1	1834403725	SNXMMOWRKWEFTA-ONEGZZNKSA-N	444.370	1.462	50	20	IDGD	
CCc1oncc1C(=O)N1CCO[C@]2(COCCN(C(=O)CCBr)C2)C1	1834515914	HYPRCNCXBRFFIO-KRWDZBQOSA-N	430.299	1.092	50	20	IDGD	
O=C(CSc1ncccn1)NC1CCN(C2CCN(C(=O)[C@@H](F)Cl)CC2)CC1	1834864108	XGMXBBHVCNXLRW-MRXNPFEDSA-N	429.949	1.675	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4ccoc4cn3)C2)C1	1837715981	UTUNGTUJSLUSMM-NRFANRHFSA-N	447.564	1.749	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@H](C)Cn3cncn3)CC2)CC1	1838421041	MLEUVKRZMNMGPR-QAPCUYQASA-N	425.961	1.930	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3nccc(Cl)c3OC)C2)C1	1839146381	NXMJOBIOVAXOSZ-BFUOFWGJSA-N	446.331	1.831	50	20	IDGD	
CCn1nc(C)cc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2	1839152167	PSAIGWBNHLSWBS-RTBURBONSA-N	447.363	1.518	50	20	IDGD	
O=C(c1cc(O)ccc1F)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839202238	YDWUKRWUJLGVLT-PBHICJAKSA-N	449.248	1.292	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CC=CC[C@@H]1C(=O)OC)CCO2	1840143563	YAQGACDLIHOUKI-NWZZKEMCSA-N	442.940	1.216	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4[nH]ccc4s3)C2)C1	1840152550	LYRNIGLAXZKUIV-YJYMSZOUSA-N	441.937	1.553	50	20	IDGD	
C[C@@H](Cn1ccnc1)C(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1840428700	SXDIDXVSSQCNGS-OXJNMPFZSA-N	426.945	1.241	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)[C@@H](C)CBr)C1	1841286631	QBWMVZHJDUGUHJ-QVEXMKBASA-N	438.326	1.355	50	20	IDGD	
CCCCCc1ncc(C(=O)N2CC3(CCCN3C(=O)c3ccc(B(O)O)cc3)C2)s1	1843012268	WHNVZKPQXKDGCE-UHFFFAOYSA-N	441.362	1.686	50	20	IDGD	
CC(=O)N/C(=C\c1ccco1)C(=O)N1CCCC12CN(C(=O)[C@H](C)CBr)C2	1845440808	RDBDEFDIHREMFR-WPBJZHHJSA-N	438.322	1.991	50	20	IDGD	
Cc1cc(F)c(F)c(C(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)c1	1845528124	CVJJWTLOZMEDAP-UHFFFAOYSA-N	429.427	1.403	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC12CN(C(=O)[C@@H](CCN)NC(=O)OC(C)(C)C)C2	1846176434	IJVSBJLMXCTMSR-QWHCGFSZSA-N	447.374	1.215	50	20	IDGD	
CC(C)C[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)[C@@H](O)CCl)C2	1846267121	YOZYVDQEKCLUAO-CABCVRRESA-N	431.961	1.729	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)[C@H]1[C@H]3c4ccccc4S[C@H]31)C2	1846385109	TWLFVLPNRWDVBM-HSALFYBXSA-N	428.558	1.451	50	20	IDGD	
O=C(c1ccc(Br)c([N+](=O)[O-])c1)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl	1847562527	XUXJXVSMHBQBDT-SGMGOOAPSA-N	446.685	1.772	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1csnn1	1847891319	DHZHQHPBOOYRIV-DRZSPHRISA-N	429.930	1.486	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)Cc1cc(C)no1	1848103971	LFXSOPXLLDTZAN-ROUUACIJSA-N	442.428	1.875	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1OC	10665679	KNFHUXUXMJVDRQ-UHFFFAOYSA-N	437.792	1.883	50	20	IDGD	
O=C(COC(=O)COc1cccc(C(F)(F)F)c1)NNC(=O)c1cccc([N+](=O)[O-])c1	15220310	LDQKYKPMLRCLHN-UHFFFAOYSA-N	441.318	1.997	50	20	IDGD	
O=C(CCOc1cccc(F)c1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	31541899	DEWLJQBRVUDGGO-UHFFFAOYSA-N	435.477	1.840	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCN(CCc3cccs3)CC2)cc1OC	108974244	PGMBSEXHIIGFEQ-UHFFFAOYSA-N	432.546	1.387	50	20	IDGD	
CCc1ccccc1-n1cnnc1SCC(=O)NNC(=O)CNC(=O)c1cccs1	725740194	BWHZBTVMPFFVHT-UHFFFAOYSA-N	444.542	1.561	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)C2CCN(C(=O)COc3ccccc3)CC2)c1	728206035	QUDNMTPILNVUAR-UHFFFAOYSA-N	440.500	1.572	50	20	IDGD	
Cc1ccn2cc(C(=O)NNc3ccc(S(=O)(=O)N4CCN(C)CC4)cc3)nc2c1	728213220	GZCDFTWGEZCKJK-UHFFFAOYSA-N	428.518	1.336	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cccc(OC(F)F)c2)cc1	728545113	YHOYHNPCSQEDSJ-UHFFFAOYSA-N	443.428	1.288	50	20	IDGD	
O=C(NNC(=O)N1CCC(C(=O)N2CCOCC2)CC1)c1cccc(OC(F)F)c1	728599987	UXEXOXPMUMLGJF-UHFFFAOYSA-N	426.420	1.213	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2cccc(Cn3nc(C)cc3C)c2)n1	728733643	OCQPROVDKIAKFA-UHFFFAOYSA-N	441.513	1.860	50	20	IDGD	
Cc1ccc(C)n1-c1nc(CC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cs1	728845914	PRNQLDLIKYQNSV-UHFFFAOYSA-N	439.545	1.947	50	20	IDGD	
CNC(=O)COc1ccc(C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)cc1OC	728972187	GAJPTXHVQHFNOH-UHFFFAOYSA-N	443.428	1.573	50	20	IDGD	
CCCCN1C(=O)CC[C@@H](C(=O)NNC(=O)Cc2cc[nH]n2)[C@@H]1c1ccccc1OC	730102462	FCVFKFPHGPIOOC-UTKZUKDTSA-N	427.505	1.888	50	20	IDGD	
CCS(=O)(=O)N[C@@H](CCSC)C(=O)NNC(=O)c1ccc(Cl)cc1Cl	730517840	VKKLHWHYMNWQCV-LBPRGKRZSA-N	428.363	1.815	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)c1cnn(-c2ncccc2Cl)c1C(F)F	730750149	DDQYRROLXAXNTE-UHFFFAOYSA-N	438.778	1.642	50	20	IDGD	
Cn1cc(-c2cncc(C(=O)NNC(=O)CCN3CCN(c4ccccc4)CC3)c2)cn1	731164727	BUNUMNKDWZECJD-UHFFFAOYSA-N	433.516	1.455	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CN2CCN(CC(=O)N[C@@H]3CCC[C@H](C)C3)CC2)cc1	731214090	ARPGEHYOOWTAFA-AZUAARDMSA-N	429.565	1.069	50	20	IDGD	
C[C@@H]1C[C@@H](C)CN(C(=O)CN2CCN(C(=O)NNC(=O)C(C)(C)c3ccccc3)CC2)C1	731220995	CDRXVHQMRUBFAN-RTBURBONSA-N	443.592	1.827	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)Cc2ccc(C(=O)NNC(=O)c3cnc(C)[nH]3)cc2)cc1	732260427	TWRCWTGMRPKQMB-UHFFFAOYSA-N	441.513	1.922	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)CCNS(=O)(=O)c1cccc(C(C)=O)c1)c1ccccc1	732292103	RDZOASCLSFFPDZ-LJQANCHMSA-N	431.514	1.899	50	20	IDGD	
Cn1c(N)c(C(=O)/C(C#N)=C\c2ccccc2I)c(=O)n(C)c1=O	732578052	BIKOCXISVMNMSE-YFHOEESVSA-N	436.209	1.061	50	20	IDGD	
CCN1CCC[C@@H]1CN1C[C@@H](C(=O)NNc2nc3ccccc3c(=O)n2CC)CC1=O	733127770	GEZYESSJIVFSNM-JKSUJKDBSA-N	426.521	1.192	50	20	IDGD	
C[C@H]([C@@H](C)S(C)(=O)=O)N(C)C(=O)CCC(=O)C(C#N)=C1N(C)c2ccccc2N1C	733277142	YAOGNSQNCGDSEA-HUUCEWRRSA-N	432.546	1.937	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)[C@H]1CCCCN1C(=O)c1ccccc1	734240158	KDYPJNAVJSVZAX-MRXNPFEDSA-N	433.509	1.536	50	20	IDGD	
CS(=O)(=O)Cc1ccc(S(=O)(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1	734807660	ZBHVLZJMRMHAEB-UHFFFAOYSA-N	434.499	1.040	50	20	IDGD	
CC(C)c1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)c3cnn(C)c3)CC2)cc1	735445168	LJMLIFSECYAJAV-UHFFFAOYSA-N	433.534	1.405	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)NCCCN1C(=O)NC2(CCCCC2)C1=O	738450158	WMIUZGRMEJSTRY-UHFFFAOYSA-N	431.493	1.178	50	20	IDGD	
COCCNS(=O)(=O)c1c[nH]c(C(=O)NNC(=O)c2cc3c(s2)CC[C@@H](C)C3)c1	741144665	YVMCCRPANYURLF-LLVKDONJSA-N	440.547	1.201	50	20	IDGD	
CS(=O)(=O)[C@@H]1CCCCC1=NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	741452129	YOWYLXCROHLUCE-QGZVFWFLSA-N	427.548	1.544	50	20	IDGD	
Cc1ccc([N+](=O)[O-])c(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1	742035041	WKXGEDJKFGYHSS-UHFFFAOYSA-N	432.458	1.763	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNS(=O)(=O)c2ccc(C(=O)O)cc2F)cc1	743250135	BEWCTMTVJRRNOB-LLVKDONJSA-N	426.422	1.700	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)c2ncoc2-c2ccc3c(c2)OCCO3)C[C@@H](C)O1	743290547	HOQYJUFJYONZTG-ZIAGYGMSSA-N	430.461	1.373	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2cccc(F)c2Cl)CC1	743420109	VSGKJCYGZMDHLB-UHFFFAOYSA-N	427.889	1.567	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	744620543	KDXCWETZUWDHMA-UHFFFAOYSA-N	435.502	1.628	50	20	IDGD	
CC(C)(C)CC(=O)N1CSC[C@@H]1C(=O)OCC(=O)NNC(=O)c1ccc(C#N)cc1	744975959	VRFHJUTXLZCXMY-OAHLLOKOSA-N	432.502	1.200	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)c2ccc(CSc3nc[nH]n3)cc2)c1	744996715	OZUWCHGEKLHBIJ-UHFFFAOYSA-N	436.453	1.587	50	20	IDGD	
COc1nn(C)c2nc(C)c(CCC(=O)NNC(=O)c3cncc(NC(C)=O)c3)c(C)c12	746307131	OLXZBRXAEAVTNW-UHFFFAOYSA-N	439.476	1.341	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)NCCS(=O)(=O)c1ccc(Cl)cc1	746754330	AKKZXVUZQRNGRW-UHFFFAOYSA-N	435.893	1.335	50	20	IDGD	
COc1cccc(C[C@@H](C(=O)NNC(=O)c2cccc3cccnc23)n2nnnc2C)c1	747422145	FWJQGKBCJRSVSK-IBGZPJMESA-N	431.456	1.783	50	20	IDGD	
CC(=O)c1cccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)c3cccn3C)CC2)c1	747599338	SJNLIFGPUZQKTI-UHFFFAOYSA-N	432.502	1.090	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)c2cc(N3CCNC3=O)ccc2Cl)c1	747717558	RPYGLZHFRWYHKO-UHFFFAOYSA-N	441.831	1.359	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)NCCC(=O)Nc1ccc(Br)cc1	748618669	OYZHGZMGMBDGOP-LLVKDONJSA-N	431.287	1.160	50	20	IDGD	
COc1cc(F)cc(NNC(=O)CCNc2ccc(S(N)(=O)=O)cc2[N+](=O)[O-])c1	748905353	HKJYLAMQQMFDDG-UHFFFAOYSA-N	427.414	1.335	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)NCCC2CCN(CC(F)(F)F)CC2)cc1	748968260	RNHLSEOWOXJWHL-UHFFFAOYSA-N	427.427	1.932	50	20	IDGD	
CN(C)C(=O)COc1ccccc1C(=O)NNc1nc(Br)cn2ccnc12	750243691	MCNGNQSYOKJPTK-UHFFFAOYSA-N	433.266	1.716	50	20	IDGD	
Cc1ccc(CNC(=O)NNC(=O)c2ccc3c(c2)OCCO3)c(N2CCOCC2)c1	753926693	XZXWUPQNFKEMAQ-UHFFFAOYSA-N	426.473	1.747	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)N[C@@H]1[C@H]2CCO[C@@H]2C12CCC2	754677877	ZBWYTPDRYZXTMT-KURKYZTESA-N	448.545	1.373	50	20	IDGD	
Cc1c(NC(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)cccc1-n1cnnn1	755444663	QQDSFQGWVXJBAZ-UHFFFAOYSA-N	447.459	1.728	50	20	IDGD	
C[C@@H]1Oc2ccc(NC(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)cc2NC1=O	755559609	VGKLZNHGAYLODK-NSHDSACASA-N	447.473	1.123	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)NNC(=O)[C@@H]3COc4ccccc4O3)cn2)C[C@@H](C)O1	755866907	ZYYQFPOXRKATDC-IYOUNJFTSA-N	427.461	1.688	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)Nc1cccc(N2CCCS2(=O)=O)c1	755889799	MCCUJESOGZUIBN-UHFFFAOYSA-N	442.295	1.784	50	20	IDGD	
COC(=O)CCc1ccc(NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1	756432959	LMORXCANHJTJIE-UHFFFAOYSA-N	426.477	1.652	50	20	IDGD	
COCCS(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)cc1	756555671	UNKHMRXOMYQDHK-CYBMUJFWSA-N	439.465	1.866	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)Nc1ccc(S(=O)(=O)NCC2CC2)cc1	756783976	JJYAKJAAZLDHJG-UHFFFAOYSA-N	432.502	1.744	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)Nc1ccc(OC)c(-n2nnnc2C2CC2)c1	757620356	DWJFESRAVYCUBH-UHFFFAOYSA-N	437.460	1.952	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)Nc1cccc(S(=O)(=O)NCc2ccco2)c1	757862381	GVIRIBJETRSXPC-UHFFFAOYSA-N	429.458	1.549	50	20	IDGD	
COc1ccc(CCCC(=O)N2CCN(S(=O)(=O)CBr)CC2)c(OC)c1	758522344	GGYFJRYADMVPEZ-UHFFFAOYSA-N	449.367	1.853	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)c2cc(S(N)(=O)=O)ccc2Br)nc1	759734703	OEPKAVTYZDTXBT-UHFFFAOYSA-N	429.252	1.035	50	20	IDGD	
O=C(N=c1cc[nH]cc1F)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	759996533	CXQTUMINBPZLRG-UHFFFAOYSA-N	443.460	1.588	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cccnc2OCC(F)F)cc1	760264368	PAFVWORUAUUMCX-UHFFFAOYSA-N	442.444	1.116	50	20	IDGD	
C[C@H](C1CC1)n1nccc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	760303433	NNPIDUFODSHOKW-GFCCVEGCSA-N	432.506	1.377	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2c(C)nc3ccnn3c2C)c1	761137461	JAMKUKGPHLLKGM-UHFFFAOYSA-N	444.517	1.451	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)c2ccccc2c1=O	761788389	UVZMFTQQWAHRDV-SFHVURJKSA-N	448.483	1.069	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)COCc2nc3ccccc3s2)n1	762382478	HVWBNRLFKZTEAQ-UHFFFAOYSA-N	434.499	1.511	50	20	IDGD	
COC(=O)c1cn([C@H]2CCCN(C(=O)NNC(=O)c3cccc(OC(F)F)c3)C2)nn1	762569622	BIRKNJYEEWSZJJ-LBPRGKRZSA-N	438.391	1.358	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)c2cc(S(=O)(=O)N3CCSCC3)c[nH]2)n1	762905047	BITLOIZFAQXSJL-UHFFFAOYSA-N	439.567	1.145	50	20	IDGD	
Cn1nc(SCC(=O)NN=C(CC(F)(F)F)c2ccc(Cl)cc2)c(=O)n(C)c1=O	763360004	XDXWRBSABWDBGX-UHFFFAOYSA-N	449.842	1.697	50	20	IDGD	
O=C(NNC(=O)c1ccccc1)C(=O)Nc1ncn(Cc2cccc(Br)c2)n1	763430099	FGFGNQBIRVFTTR-UHFFFAOYSA-N	443.261	1.489	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNS(=O)(=O)c1cc(C(=O)O)cc2c1CCC2	763439813	UXJGXSZBHQOMHV-UHFFFAOYSA-N	441.506	1.488	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)N[C@H]1CCCC[C@H]1N1CCOCC1	763526769	PAWXOACMVIENKR-JKSUJKDBSA-N	427.546	1.265	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(Br)nc2C)cc1OC	763551434	PUIPVTFSWGPZIM-UHFFFAOYSA-N	437.250	1.569	50	20	IDGD	
CC(C)(C)c1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(-n3cncn3)nc2)cc1	763594579	KAKASWDUORGAMA-UHFFFAOYSA-N	437.460	1.125	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1ccc(Br)c(F)c1	763630078	WEHSKCXUHDNMCY-UHFFFAOYSA-N	434.225	1.944	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccc(N2CCCCC2)c1	763649102	ZFSDBVOYIYUABT-UHFFFAOYSA-N	426.473	1.850	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2nc(-c3nccn3C)cs2)cc1C	763679006	FSJLDXSFBHZAIL-UHFFFAOYSA-N	428.474	1.325	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)CC23CC4CC(CC(C4)C2)C3)cc1	763735770	LXNHIVLNOCXVAI-UHFFFAOYSA-N	443.500	1.931	50	20	IDGD	
CCC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)c1	763789820	CRVFFLJKNSLAMD-UHFFFAOYSA-N	449.467	1.970	50	20	IDGD	
CCCC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)c1C	763807703	FKSAZMFPBUGPRS-UHFFFAOYSA-N	437.456	1.770	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cc(OC)c(OC)cc2F)cc1	763862197	VLMPOJDGCYBYNE-GFCCVEGCSA-N	449.435	1.795	50	20	IDGD	
C[C@@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc3ccc(F)cc3)cc2)CCO1	763871217	FJROHSVMNFIGTN-HUUCEWRRSA-N	444.463	1.604	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1cccc(N2CCCC2=O)c1	763871517	HFJGRYNGJJVWFT-CYBMUJFWSA-N	428.420	1.506	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(-n3cncn3)c(F)c2)cc1OC	763902736	PQVZQACGVBDWMN-UHFFFAOYSA-N	442.407	1.213	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)C(=O)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1	763996257	NMJANWODAWDZIZ-QGZVFWFLSA-N	435.488	1.068	50	20	IDGD	
N#CCCSc1ccccc1NC(=O)C(=O)NNC(=O)c1ccc2c(c1)OCCO2	764003279	AYLKLTYNOJKOET-UHFFFAOYSA-N	426.454	1.863	50	20	IDGD	
Cc1ccc(C(=O)NC2CC2)cc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccccc2)on1	764015891	ARLFLRAFFKOMCL-UHFFFAOYSA-N	447.451	1.942	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cc(C(C)(C)C)nn2-c2ccc(F)cc2)n[nH]1	764106684	PDWJNWUGNGMSBA-UHFFFAOYSA-N	427.440	1.740	50	20	IDGD	
CC(C)Oc1ccc(F)cc1NC(=O)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	764266514	KXYLCHVBWREFBC-UHFFFAOYSA-N	444.467	1.405	50	20	IDGD	
Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)C(=O)NNC(=O)Cc1cc[nH]n1	764294362	WXISMECGSCNHMR-UHFFFAOYSA-N	432.440	1.497	50	20	IDGD	
CN1CC(=O)N(c2cccc(NC(=O)C(=O)NNC(=O)C(C)(C)c3ccccc3)c2)C1=O	764314881	ZVOSOBMPLGIGPJ-UHFFFAOYSA-N	437.456	1.149	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)C(=O)Nc1ccc(S(=O)(=O)C(F)F)cc1)c1ccccc1	764332434	TZQJYYGAXMRHPF-OAHLLOKOSA-N	439.440	1.963	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)c(Cl)c1)C(=O)Nc1ccc(N2CCOCC2)c(F)c1	764349195	LBBCYCFVKYBKSM-UHFFFAOYSA-N	436.827	1.421	50	20	IDGD	
NS(=O)(=O)c1ccc(CNC(=S)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)cc1	764499955	HTVQAQCFPIITAF-UHFFFAOYSA-N	448.505	1.172	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)c1ccoc1Cl	764749406	SXUUJHZZLXQSDF-UHFFFAOYSA-N	441.893	1.348	50	20	IDGD	
CS(=O)(=O)Cc1noc(NC(=O)NNC(=O)c2sc3ccccc3c2Cl)n1	765246056	XGENXPPHZAOVOS-UHFFFAOYSA-N	429.867	1.949	50	20	IDGD	
COc1ccc(N2C[C@H](C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)CC2=O)cc1	765314354	XUSRZBKKERNGBF-CQSZACIVSA-N	434.493	1.500	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1)c1cn(-c2cccc([N+](=O)[O-])c2)nn1	765619801	RTIIXDKKGFAKRW-UHFFFAOYSA-N	436.363	1.780	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN(C)[C@H](CO)c2cccc(Br)c2)n1	767045799	QYTHKIYMVXHQIP-CQSZACIVSA-N	441.351	1.569	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)CNC(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)C	768284393	GYYVXVHFRZYHQP-INIZCTEOSA-N	446.508	1.069	50	20	IDGD	
Cc1ncc(C(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)c(N)n1	769470854	QFLPGGZATJXSBJ-UHFFFAOYSA-N	429.444	1.144	50	20	IDGD	
CSCCNC(=S)NNC(=O)[C@@H]1CCN(c2cccc(Br)c2)C1=O	770240021	LLLBYAPEHNAOHI-LBPRGKRZSA-N	431.381	1.660	50	20	IDGD	
Cc1cc2c(cc1C)[C@@H](C(=O)NNC(=O)CN1CCN(C(=O)c3ccccc3)CC1)CO2	770245120	KPLOTIKALWRJOX-FQEVSTJZSA-N	436.512	1.385	50	20	IDGD	
COc1ccc([C@H](CNC(=O)NNc2nc(O)c3cnn(C)c3n2)N2CCCCC2)cc1	770337063	UFOBDIAYAKKFIE-KRWDZBQOSA-N	440.508	1.931	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)CNC(=O)N3CCc4ccccc4C3)nc21	770967237	OQLSLMPHZPXPFF-UHFFFAOYSA-N	438.492	1.498	50	20	IDGD	
Cc1ccncc1[C@@H](C)NC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	771444807	ZPUMULCPHMTMCK-OAHLLOKOSA-N	433.538	1.108	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)[C@@H](O)Cc2ccccc2Cl)c2ccccc2c1=O	771882223	NYNYQGJAPWPSPE-KRWDZBQOSA-N	428.876	1.995	50	20	IDGD	
Cc1cccc(-n2nnc(C(=O)NNC(=O)C(=O)NCc3ccc(Cl)cc3)c2C)c1	772188440	PKGXIUWVTKDVKG-UHFFFAOYSA-N	426.864	1.615	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)CCc1ccc(S(N)(=O)=O)cc1	772998874	YLDKCOXDMQTPRS-LBPRGKRZSA-N	425.894	1.535	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@@H](O)Cc3ccccc3Cl)CC2)cc1	773390958	CKFDQHVNOCSIHS-NRFANRHFSA-N	444.963	1.517	50	20	IDGD	
O=C(NNC(=O)C(=O)Nc1ccccn1)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1	776265158	OEBXZZUANSSSLX-GFCCVEGCSA-N	436.394	1.648	50	20	IDGD	
C[C@@H]1C[C@@H](C(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)CCO1	776338948	PZQSQAUJZPQUMT-QAPCUYQASA-N	431.514	1.741	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)[C@]2(F)CCN(C(=O)OCc3ccccc3)C2)cc1	776966059	GWZPCBSMKJXVBP-QFIPXVFZSA-N	440.431	1.835	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)Cc2n[nH]c3c2CCCC3)cc1	777230067	UHOURDJTOJMJOM-UHFFFAOYSA-N	425.518	1.713	50	20	IDGD	
COc1cc(OC)c(Cn2nccc2NC(=O)NNC(=O)c2cc(C)[nH]n2)c(OC)c1	779482321	ISSHRJNQICAEJJ-UHFFFAOYSA-N	429.437	1.455	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(CNC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c1	782538655	XGBIHMFYUBTXMR-UHFFFAOYSA-N	442.501	1.267	50	20	IDGD	
O=C(NNc1cc(Cl)ccc1Cl)C(=O)Nc1ccn(CCN2CCOCC2)n1	783367349	PQWDOOBIPYFVEG-UHFFFAOYSA-N	427.292	1.604	50	20	IDGD	
CC(C)(C)OC(=O)Nc1cnc(C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cn1	783644812	HVVXDUHIRVGYRU-UHFFFAOYSA-N	439.432	1.790	50	20	IDGD	
COCC(=O)N1CCc2cc(NC(=O)C(=O)NNc3ccc(Br)cn3)ccc21	784340435	YNHNDNBDWRJQBK-UHFFFAOYSA-N	448.277	1.461	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CC=CC[C@H]1C(=O)N1CCOCC1)c1cccc(Br)c1	784429856	UUSCJNRVFGSVJY-HZPDHXFCSA-N	436.306	1.651	50	20	IDGD	
CNS(=O)(=O)c1ccc(C)c(NC(=O)C(=O)NNc2ccnc(Br)c2)c1	784836992	FUBUZLSSHWHPME-UHFFFAOYSA-N	442.295	1.142	50	20	IDGD	
Cn1ncc2c(N3CCN(C(=O)COC(=O)/C(C#N)=C\c4ccccc4)CC3)ncnc21	785352027	SHTWDBXNZDOOKG-BOPFTXTBSA-N	431.456	1.162	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2ccc(C)c(N3CCNC3=O)c2)cc1	787541672	BZDNLSTUWXYYCO-UHFFFAOYSA-N	439.472	1.252	50	20	IDGD	
CCCCCn1nc(C(=O)NNc2ccccc2S(N)(=O)=O)c2ccccc2c1=O	788232631	VUVPKVSOGUNLFJ-UHFFFAOYSA-N	429.502	1.991	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)c3cccc(O)n3)c2)cc1	788266692	GQSFJNCNOPJFHM-UHFFFAOYSA-N	442.453	1.671	50	20	IDGD	
COC[C@@H](Cc1ccccc1)N(C)C(=O)NNC(=O)c1csc(N2CCOCC2)n1	788987907	AGHVRGTUJZTSRS-MRXNPFEDSA-N	433.534	1.524	50	20	IDGD	
CC(=O)N1CCc2ccccc2[C@H]1CC(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	789852698	ULDAAEVBDFUTQW-LJQANCHMSA-N	433.468	1.875	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNS(=O)(=O)c2ccc3c(c2)CCN(C(C)=O)CC3)c1	790045114	JZMIMDNYLDEZKL-UHFFFAOYSA-N	447.513	1.274	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)c1cc(S(=O)(=O)N2CCCC2)ccc1Cl	790065312	LNSXRWQHFHOOPC-UHFFFAOYSA-N	447.941	1.675	50	20	IDGD	
COc1ccc([C@@]2(C)NC(=O)N(CC(=O)NNc3cccc(F)c3[N+](=O)[O-])C2=O)cc1	790589446	ZFAWGJDGELBXLY-LJQANCHMSA-N	431.380	1.653	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)[C@](C)(O)Cn2cc(C(F)(F)F)ccc2=O)c1	792018088	PEJMJXCBAOTMAP-GOSISDBHSA-N	443.378	1.097	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)[C@@](C)(O)Cn1cc(C(F)(F)F)ccc1=O)c1ccccc1	792155545	AKIZHVGJOPBVOU-KXBFYZLASA-N	425.407	1.959	50	20	IDGD	
CCS(=O)(=O)c1ccc(CNC(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)s1	792224437	UWCIFMBEEHHXKM-LLVKDONJSA-N	429.495	1.979	50	20	IDGD	
CN(C)N(C(=O)c1cc([C@@H]2CCN(C(=O)OC(C)(C)C)C2)[nH]n1)[C@H]1CCS(=O)(=O)C1	792848315	FOGSARDXCKSWPS-KGLIPLIRSA-N	441.554	1.240	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N[C@H](C)[C@H](C)OC)cc1	794004228	IFHKAKFSQOWHEX-NIRMRBTQSA-N	425.489	1.881	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CC[C@@H](C)CC(=O)NNC(=O)c2cccc(C)n2)n1	794079883	GVACVRYCKBSMDB-CYBMUJFWSA-N	426.477	1.122	50	20	IDGD	
N#C/C(=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)N1CC(CC(N)=O)C1	794280361	DZDQWFQJCIUZAR-OVCLIPMQSA-N	440.891	1.320	50	20	IDGD	
CCOC(=O)c1ccc(NNC(=O)CN2C(=O)c3cccc([N+](=O)[O-])c3C2=O)cc1C	794658835	PIPVLEKDKUVMLG-UHFFFAOYSA-N	426.385	1.819	50	20	IDGD	
CCOc1ccc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)[C@H](O)C(C)C)cc2)cc1	794750769	HMWZSCYCGFTXGX-GOSISDBHSA-N	435.502	1.664	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)cc1OC	796990209	OUWCNIDBQZYSMZ-NSHDSACASA-N	433.392	1.174	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)c(C)cc1C	797067130	DFKSGGDXJXZDKF-UHFFFAOYSA-N	432.502	1.835	50	20	IDGD	
COC(=O)c1ccc(NC(=O)NNC(=O)CNC(=O)OCc2ccccc2)cc1OC	797672627	WFICJAIOSJQCGB-UHFFFAOYSA-N	430.417	1.561	50	20	IDGD	
C=C(C)[C@H]1OCC[C@@H]1CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(CC)CC)c1	798117512	CFOQELCWNUCMNW-SJLPKXTDSA-N	438.550	1.642	50	20	IDGD	
CCOc1cccc(S(=O)(=O)N2CCN(S(=O)(=O)CBr)CC2)c1	800107465	QRYCVOIGTIPOMI-UHFFFAOYSA-N	427.342	1.074	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2nn(-c3ccc(F)cc3)cc2O)n1	801326433	RTHAXLFVVAEZJL-UHFFFAOYSA-N	433.421	1.029	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)Nc2nnc(OC)s2)c2ccccc2c1=O	801748213	OCKICKQFSRWMCM-UHFFFAOYSA-N	431.478	1.913	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)CCC[C@]2(C)NC(=O)NC2=O)cc1Cl	802072109	KTUPICKSIJQUPB-KRWDZBQOSA-N	427.845	1.278	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)NC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1	802334222	UXAALBCRRVEPMK-OAHLLOKOSA-N	430.486	1.844	50	20	IDGD	
O=C(COC(=O)c1cscc1Br)NNC(=O)[C@H]1COc2ccccc2O1	803772250	DYDNFKMAKAQBJJ-CYBMUJFWSA-N	441.259	1.655	50	20	IDGD	
COc1ccc(S(=O)(=O)NCCC(=O)NNc2ccc([N+](=O)[O-])cc2C)cc1OC	805385551	WQQLVIQCDWOGRC-UHFFFAOYSA-N	438.462	1.732	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2ccc(S(=O)(=O)[C@@H](C)C#N)cc2)cc1OC	806458766	NTMPCFYJCPNIAA-LBPRGKRZSA-N	432.458	1.856	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(NC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)ccc1F	806541319	BMNNYFHGCCNIAH-UHFFFAOYSA-N	425.398	1.451	50	20	IDGD	
Cc1ccc([C@H](CNC(=O)NNC(=O)c2nnc(O)c3ccccc23)N2CCOCC2)o1	807023191	DVPMNEKNRQXMEC-INIZCTEOSA-N	440.460	1.254	50	20	IDGD	
CN1CCN(C(=O)NNC(=O)[C@H]2CCC(=O)N(C)[C@H]2c2ccc(C(F)(F)F)cc2)CC1	807380624	KWDSNOBXZXLQPR-RDJZCZTQSA-N	441.454	1.603	50	20	IDGD	
C[C@@H]1[C@@H](NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)CCN1Cc1ccccc1	807622170	QRNRGMPYAGBRON-BEFAXECRSA-N	430.530	1.697	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NN=Cc2ccc(S(N)(=O)=O)c(Br)c2)c1	807978960	JUOOLGWOOFNONQ-UHFFFAOYSA-N	440.279	1.214	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)N2CCC(C(=O)NCC(Cl)Cl)CC2)o1	808128828	IHKPKZHOSIKWTP-UHFFFAOYSA-N	427.306	1.777	50	20	IDGD	
COc1ccc(CNC(=O)NNC(=O)c2ccc3ccccc3c2)cc1S(N)(=O)=O	808229877	WMFADRLHRDLMGJ-UHFFFAOYSA-N	428.470	1.640	50	20	IDGD	
COC(=O)c1c(F)ccc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)c1C	810405639	HYOQSNRXPRYJIO-KSSFIOAISA-N	443.431	1.579	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)[C@@H]2CCCN2C(=O)OCC(F)(F)F)cc1	812732937	DPLWAZZHHWEHJG-ZDUSSCGKSA-N	438.428	1.543	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCc2nncn2C1)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	814266748	YPLLMQUFXKYIRP-SFHVURJKSA-N	443.471	1.004	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCc2nncn2C1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-]	816885357	XPUAXYZQZQCCCE-VIFPVBQESA-N	428.327	1.151	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)c1cc(Cl)sc1S(N)(=O)=O	817053323	MLWMIFNGSYLDOC-UHFFFAOYSA-N	438.940	1.056	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)[C@H]1CCCCN1S(C)(=O)=O	896317296	RUGJVVYYODYEEN-SMDDNHRTSA-N	448.339	1.178	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=S)Nc2ccc(S(=O)(=O)N3CCOCC3)cc2)cc1	913444420	OOAFIDKSVKCKKX-UHFFFAOYSA-N	445.526	1.211	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)c1ccccc1F)C(=O)NNC(=O)NC1CCCCC1	913451082	LPCXJRRJXSPWSE-HNNXBMFYSA-N	446.570	1.889	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)c1ccccc1)C(=O)NNC(=O)NC1CCCCC1	913451400	VWCZPPHVOVKAAR-MRXNPFEDSA-N	428.580	1.750	50	20	IDGD	
O=C(COC(=O)c1cccnc1N1CCCCC1)NNC(=O)c1ccc([N+](=O)[O-])cc1	915554617	QXRHJSKZXOEJJY-UHFFFAOYSA-N	427.417	1.598	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)NCCCN1CCCCCC1=O	915905414	FSGWEESILYUDMF-UHFFFAOYSA-N	444.580	1.322	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)c3cccc(N4CCCS4(=O)=O)c3)n[nH]2)cc1	917178333	SYSGXLDUNQMSNW-UHFFFAOYSA-N	439.497	2.000	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NC[C@H](C)CN2CCCCC2)nc1	918104594	SROKKOAOENTALG-INIZCTEOSA-N	426.587	1.860	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc([N+](=O)[O-])c(Br)c1)c1cccc([N+](=O)[O-])c1	918142421	COAIEIXSPJBAPH-UHFFFAOYSA-N	445.207	1.889	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)Nc1cccnc1N1CCCC1	920417694	QZHAEKLKYBRZHL-UHFFFAOYSA-N	431.522	1.750	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)N2CCC(C(=O)N3CCN(C)CC3)CC2)c1C	920464970	SKTUOGLZMCFWEX-JWGURIENSA-N	441.576	1.671	50	20	IDGD	
CC[C@@H]1CN(C(=O)/C(C#N)=C\c2cn(CCC(N)=O)nc2-c2ccc(OC)cc2)CCO1	920854210	WKKRASAJGYDUKU-LYPXWFNGSA-N	437.500	1.978	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)[C@@H](C)OC[C@@H]2CCCO2)c2ccccc2c1=O	921021466	IPKRTHJOQDZULE-CVEARBPZSA-N	430.505	1.932	50	20	IDGD	
O=C(CSc1nnc(O)nc1O)NN=Cc1ccc(OC(F)F)cc1OC(F)F	1317728391	AJHZDLBLUQJDDF-UHFFFAOYSA-N	437.331	1.728	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)Cc2csc(NC(=O)c3ccccc3)n2)C[C@@H](C)O1	1317782254	MDABXOIXRKVKPQ-GASCZTMLSA-N	445.545	1.585	50	20	IDGD	
Cn1ccc(NNC(=O)[C@H]2CCCN(S(=O)(=O)c3ccc(Br)cc3)C2)n1	1321389729	ZFPOLFDSOKBDPH-LBPRGKRZSA-N	442.339	1.727	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2noc3c2CCCC3)C1	1777866935	AQLNOPBTIZKVPY-LUQKVYGDSA-N	439.940	1.935	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1nn[nH]c1C(F)(F)F)C2)[C@H](F)Cl	1778024870	AVYKGZOOSVNILU-FDLBOYPASA-N	427.786	1.485	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)/C=N/N3CCCCC3)C2)C1	1779020277	MBHDRFPRYVNSNS-KUDSMGGUSA-N	429.359	1.462	50	20	IDGD	
CN(C)c1ncc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CO[Si](C)(C)C)C2)o1	1779540815	SNTMWFTYGLTSSR-OXQOHEQNSA-N	438.601	1.720	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)N2CCN(C)CC2)C1	1780641128	QJJCMHPGTZCQLX-LXGFNABISA-N	429.005	1.154	50	20	IDGD	
C[C@@H](Cn1cncn1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@](C)(Cl)CCl)C1	1780712885	XKOOMOPLRPXPLI-QGWWYQLQSA-N	446.379	1.664	50	20	IDGD	
CN1C(=O)CC[C@H]1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@](C)(Cl)CCl)C1	1780715414	RVQSJFWYWFLVCH-QABNGEJJSA-N	434.364	1.357	50	20	IDGD	
CCOc1ncccc1C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781327250	XSZBNKBWPCRNLT-DYVFJYSZSA-N	430.274	1.614	50	20	IDGD	
Cc1ccn2ncc(C(=O)N3CCO[C@@]4(CCN(C(=O)[C@H](F)Br)C4)C3)c2c1	1781330914	IRUHVWQJCZKLCT-MAUKXSAKSA-N	439.285	1.777	50	20	IDGD	
C=C(Oc1ccccc1O)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781331537	RHQSLWNMNNLVEV-QAPCUYQASA-N	443.269	1.805	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2)c1cnn2cccc(F)c12	1781424017	OWDVOXDEEAOLBI-JXXFODFXSA-N	438.887	1.201	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)n2ccnn2)C1	1781545979	BEUSFIRFEDQHFW-BASYENTBSA-N	442.358	1.384	50	20	IDGD	
CCOC(=O)C1(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](Cl)COC)C3)CC1	1781627028	LMXRYHJROUEITA-QMTMVMCOSA-N	430.929	1.097	50	20	IDGD	
CCC(C)(C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnccc1C(=O)NN)C2	1781756715	OAFXWNWHLISZRB-VGOFRKELSA-N	431.537	1.249	50	20	IDGD	
COc1cc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](F)Cl)CCO3)c(F)c(OC)c1F	1781950302	FLZQMMASBKOOFT-MAUKXSAKSA-N	436.814	1.960	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)COc1ccc(F)cc1)C2	1782170797	YSXKCBUGSUJQOB-DBXWQHBBSA-N	442.915	1.972	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc3cccnn3n1)C2	1782173554	IIZCGWVVXFAMDC-XAUMDUMWSA-N	435.912	1.111	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc3nccn13)C2	1782179986	ZNAQKTFBGDSGDI-QLVMHMETSA-N	434.924	1.716	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H]2CCNC(=O)C2)C1	1782273637	IWYVBRINUZGFFA-NXEZDXNNSA-N	444.370	1.200	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccc([N+](=O)[O-])o3)CCO2)C1	1783338201	DUNLSKJERBOLPB-BDJLRTHQSA-N	430.255	1.805	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)CCC(=O)N3CCCC3)CCO2)C1	1783342435	IUMLAIFHIZUXEB-DNVCBOLYSA-N	444.370	1.392	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cc4cn[nH]c4cn3)CCO2)C1	1783349863	USBLLVNZPJNGAB-UGSOOPFHSA-N	436.310	1.575	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccccc3C(N)=O)CCO2)C1	1783351557	BVNOIWFIGPAMMF-HNAYVOBHSA-N	438.322	1.403	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)CNC(=O)OC(C)(C)C)C2)C1	1783401304	MCZLWSVOKVRWKC-SJKOYZFVSA-N	434.331	1.124	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(C1)CN(C(=O)C1(C(=O)Nc3ccccc3)CC1)CCO2	1783871884	WZGMJBVLQIFLJF-DYESRHJHSA-N	449.935	1.489	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H](CC(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](F)Cl)CCO3)C1	1784152521	NXATUEUOHJUAEU-YYFZDKIDSA-N	447.935	1.998	50	20	IDGD	
COc1cc(F)ccc1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1784917196	MWZNWCIKMZPTAM-RHSMWYFYSA-N	433.249	1.968	50	20	IDGD	
COc1cc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)ccc1F	1785011325	XMPZQNYXFJDWER-PBHICJAKSA-N	433.249	1.968	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC1(c2ccc(NC(=O)CN3C(=O)CNC3=O)cc2)CCC1	1786640470	OHFHMBBMJYEPTC-UHFFFAOYSA-N	432.553	1.524	50	20	IDGD	
Cc1nccn1[C@H](C)C(=O)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1	1788149372	MEDSMSXYTNBIDY-MRXNPFEDSA-N	446.316	1.880	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)c1ccc2nc[nH]c2c1	1788329046	SKMPXOKFOUBXGT-ZQIUZPCESA-N	435.322	1.941	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)NC(=O)OC(C)(C)C)C[C@@H]21	1789864394	AOANLWJWVWXQOO-YXMSTPNBSA-N	431.961	1.897	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1cccc2ccoc12	1790465538	XNEYARGCEOBUJT-YYWHXJBOSA-N	448.284	1.020	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3CCC4(CC3)OCCO4)C[C@@H]21	1791257371	BZRXTTSXAALODZ-XSLAGTTESA-N	444.956	1.153	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3cnccn3)[C@H]2C1	1791659765	DRKMQQFEXWTWKG-FJXLLPKBSA-N	429.348	1.625	50	20	IDGD	
COc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Cl)C[C@@H]32)ccc1[N+](=O)[O-]	1792048856	BXJPUTJCNIZFCZ-APYUEPQZSA-N	429.832	1.731	50	20	IDGD	
CC(C)(C)c1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)cn1	1792441809	QHZUYMCNQPNFCQ-ACDBMABISA-N	435.333	1.625	50	20	IDGD	
N#Cc1cccc(CCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)c1	1792939102	FLEBPIPSNPBCHE-KOUNCHBCSA-N	431.301	1.123	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCl	1793116801	URYZRSXCXSJHMQ-JKJDWNRSSA-N	429.945	1.624	50	20	IDGD	
C[C@H](CC(N)=O)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1793659876	OHRYUZZEEGJDNF-QMIVOQANSA-N	444.960	1.268	50	20	IDGD	
COCCOCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1794142840	WWIGBIYTSLVTEN-FZKCQIBNSA-N	447.960	1.420	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1nc(Cl)ccc1F	1794234822	SIRXINRVLDXXMS-XHSYRHOGSA-N	434.693	1.861	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cn1cc([N+](=O)[O-])cn1	1794277841	FLVCLYKIVWZUFF-OPDFLTKYSA-N	428.287	1.603	50	20	IDGD	
CC(C)OC(=O)c1ncccc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2	1794314345	FBCXWGYCORWREG-FAXLKDOZSA-N	427.860	1.384	50	20	IDGD	
COc1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)cc1F	1796189718	RAKWGHJJBIJOCU-BCDXTJNWSA-N	426.253	1.080	50	20	IDGD	
C=CC[C@H](C(=C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2	1797647660	QQVSQMRKADADPR-KNTBSYDBSA-N	441.532	1.478	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NO[C@H](c2ccccc2)C1)c1ccc(B(O)O)cc1	1797752178	UGVAAPUPKKQCRY-IIZPIQPGSA-N	447.300	1.136	50	20	IDGD	
Cc1ccc(OCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)cc1	1798439351	WNPSZSFAGYSDJW-BJWYYQGGSA-N	437.500	1.324	50	20	IDGD	
COc1cccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)CBr)C3)c1	1798887362	ZLALPOIMIGJJKD-FAYQHZLMSA-N	425.323	1.929	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(S(C)(=O)=O)cn1)C2	1800077718	HKHSFVUXODEOCD-YFQWEKLQSA-N	448.372	1.973	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(F)ccc1Cl)c1cccc(B(O)O)c1	1800460751	APZFAFVJNWQHFL-BJWYYQGGSA-N	430.672	1.725	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(F)c1[N+](=O)[O-])C2	1800759626	BBSJRIJFBMTDOV-NJBDSQKTSA-N	444.257	1.721	50	20	IDGD	
O=C(Cn1cnc2ccccc21)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2	1800889788	LWVSLYHJIUFCLJ-LZDSYCOUSA-N	439.285	1.316	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@](C)(O)C[C@H]1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](F)Cl)C2	1802054677	XYVWMKSWQDGJLH-RTDPWRILSA-N	447.935	1.919	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cc[nH]c3nccc2-3)[C@H]1c1cccnc1)[C@@H](O)CCl	1803138519	BOPMQKCQRGNFKF-WBAXXEDZSA-N	427.892	1.829	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC2(CCCN(C(=O)c3cccnc3S)C2)CC1	1804867998	CHVARQAEVVJQPZ-UHFFFAOYSA-N	439.346	1.209	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC2(CCN(C(=O)CCn3ccnn3)CC2)C1	1805389552	RTLBBTUKWPRPOO-HNNXBMFYSA-N	426.359	1.930	50	20	IDGD	
C=CCO[C@H](C)C(=O)N1CCCC2(CCN(C(=O)c3cnccc3C(=O)NN)CC2)C1	1806026945	OPUZZUAFZDPWBE-MRXNPFEDSA-N	429.521	1.121	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)[C@H]3CNc4ccccc43)CC2)C1	1809966630	IOSDJWPPACWGHJ-NRFANRHFSA-N	447.344	1.421	50	20	IDGD	
O=C(CCc1cccnc1)N1CCCC2(CCN(C(=O)c3cccc(B(O)O)c3)CC2)C1	1810178983	KMVGYMOMTRVYEM-UHFFFAOYSA-N	435.333	1.239	50	20	IDGD	
CC[C@H](NC)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1)CC2	1815306646	LIWGXLJWYJNKFI-SSAQJZBFSA-N	445.549	1.187	50	20	IDGD	
O=C1C[C@H](C(=O)N2CCCC[C@@H]2c2cc(NC(=O)CCBr)n[nH]2)CCN1	1816784811	NYFKHSXXMLYLRL-DGCLKSJQSA-N	426.315	1.713	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)C[C@H]2CCCCO2)[nH]n1)c1ccc(B(O)O)cc1	1817470504	SUHCZVNQHJOUSL-IEBWSBKVSA-N	440.309	1.355	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc(=O)nc3cccnn23)[nH]n1)[C@H](F)Cl	1818041879	XKAMOSBWDVRETL-BZNIZROVSA-N	433.831	1.653	50	20	IDGD	
CC(C)(CCl)C(=O)N[C@H]1CCc2nc(NC(=O)CCc3nc(N)n[nH]3)sc2C1	1819550383	RBDZLJFQKLECHO-VIFPVBQESA-N	425.946	1.653	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1ccoc1Cl	1820390718	KBWMFKZTDQTGJQ-INIZCTEOSA-N	442.668	1.956	50	20	IDGD	
CCOC(=O)C1(C(=O)N2CCCC[C@H]2c2cc(NC(=O)[C@H](Cl)COC)n[nH]2)CC1	1822375867	HQDGLKOTMODIEO-OCCSQVGLSA-N	426.901	1.999	50	20	IDGD	
CC(C)n1cnc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)n1	1822414360	SORJUMWTCNMRPG-OAHLLOKOSA-N	445.528	1.261	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CNC(=O)OC)n[nH]1	1822625859	FPTDLQRRWWAAFY-PWSUYJOCSA-N	430.303	1.931	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)no1	1826048567	CPMZQUBORQXRDQ-HXUWFJFHSA-N	425.294	1.210	50	20	IDGD	
CCn1nc(C)cc1C(=O)N[C@@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1	1826085123	FSOMTNCOKOJTJY-CYBMUJFWSA-N	447.565	1.267	50	20	IDGD	
COc1ccc(C(=O)N[C@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)nc1	1826085838	DIIKXSXJJUHTJN-LBPRGKRZSA-N	446.533	1.146	50	20	IDGD	
Cc1cnoc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827052177	BQRJVZYWFGTCFR-LJQANCHMSA-N	425.294	1.210	50	20	IDGD	
Cc1nocc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827056223	RUYGRGXHIZICRE-FQEVSTJZSA-N	425.294	1.210	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(F)cn2C)CC1	1827947714	WZNOPVSANAPMDB-SFHVURJKSA-N	435.544	1.771	50	20	IDGD	
C[C@H](Cc1ccc(F)cc1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1830735506	HVCZTVLLBVBYPJ-FYINFDKHSA-N	442.915	1.060	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3c(C)nn(C)c3C)C2)C1	1831639837	DXRRJGRGAYKHCB-OXJNMPFZSA-N	426.945	1.514	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3c(C)noc3C)C2)C1	1831640618	OKCRLBRUWOHPKP-YLJYHZDGSA-N	427.929	1.698	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)Cn3cccn3)C2)C1	1831644459	YBODUHWXGYKIQG-ABSDTBQOSA-N	426.945	1.383	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)C[C@H](N)c3cccnc3)C2)C1	1831645684	FEODZKNXORFTAY-WFXMLNOXSA-N	438.956	1.335	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc4ncccn34)C2)C1	1831647812	YRPIDEZLVILKSD-FOIQADDNSA-N	435.912	1.207	50	20	IDGD	
Cc1cc(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](C)CBr)C3)C2)on1	1832563785	LAIMFRORITVBLX-SCLBCKFNSA-N	444.326	1.013	50	20	IDGD	
COc1ccc(CCC(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)cn1	1832581062	RPUZYJYBBRHCDR-PKOBYXMFSA-N	429.876	1.014	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)CN3CCCC3)CC2)CC1	1833098253	QMPNTSMUFVPNKF-MRXNPFEDSA-N	443.430	1.685	50	20	IDGD	
CC(C)(CCl)C(=O)NC1CCN(C2CCN(C(=O)c3cc(CO)on3)CC2)CC1	1833214577	YWKMTGJSUORSDT-UHFFFAOYSA-N	426.945	1.617	50	20	IDGD	
Cc1cccnc1CCC(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)CCl)CC2)CC1	1833308527	UXTKFSNLUFAWGZ-FQEVSTJZSA-N	436.984	1.494	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCBr)CCO3)C2)cnc1C	1834818860	DURYHMIEDGQWHR-LJQANCHMSA-N	440.338	1.553	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H]3CC(c4ccccc4)=NN3)CC2)CC1)[C@@H](F)Cl	1835081716	ZWGCSPRHJKPCGH-WOJBJXKFSA-N	449.958	1.859	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC1CCN(C2CCN(C(=O)c3c[nH]c(=O)cn3)CC2)CC1	1836399715	JTZZPHTZUHPQQT-IBGZPJMESA-N	444.363	1.191	50	20	IDGD	
Cc1cnn([C@@H](C)C(=O)N2CCC(OC3CCN(C(=O)[C@H](O)CCl)CC3)CC2)c1	1836720028	HBXYGFQMAUYVDQ-MAUKXSAKSA-N	426.945	1.351	50	20	IDGD	
CC(=O)O[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1)C(C)C	1837213611	NBNYMUGGGJEIHJ-JXFKEZNVSA-N	432.945	1.296	50	20	IDGD	
Cc1ccc(CC(=O)N2CCOC[C@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)cn1	1837710044	DTKZHELNGQKWLH-OAQYLSRUSA-N	435.597	1.240	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)CCN3CCCCC3)C2)C1	1837712460	SPKIWXOYLSZELB-NRFANRHFSA-N	441.645	1.170	50	20	IDGD	
C[C@H]1CCC[C@@H]1C(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1	1837920172	GCYNFIHHIBCFKT-JTSKRJEESA-N	442.365	1.415	50	20	IDGD	
COc1ccnc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@](C)(Cl)CCl)C3)C2)c1	1837956287	RSSUXIGDQOYYMB-MOPGFXCFSA-N	446.331	1.397	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccn(C(C)C)n3)CCO2)C1	1838780377	CSVXXEJPJYQVIX-JXFKEZNVSA-N	426.945	1.942	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)c3ccc(C)cc3)C2)C1	1840155650	GBIMKJKUQBYNRG-JLMWRMLUSA-N	438.952	1.809	50	20	IDGD	
COc1cccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)c1C	1840190801	NVZDEEGEEIBSOL-IBGZPJMESA-N	431.316	1.877	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)CCCn3ccnc3)CCO2)C1	1840383577	ULJOKIDUPXPTLG-FQEVSTJZSA-N	426.945	1.385	50	20	IDGD	
COC1(CC(=O)N2CCO[C@@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)CCC1	1840616670	IPLJBTYUSPLXRR-FQEVSTJZSA-N	428.602	1.254	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(F)c(OC)c3)CCO2)C1	1840683317	FBEPXYZXWBLPKM-MGPUTAFESA-N	444.887	1.158	50	20	IDGD	
O=C(Cc1ccc(Br)cc1F)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1	1841353731	LUTOAGRZAHMVMS-CQSZACIVSA-N	433.705	1.934	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@@H](C)C(=O)N2CCCC23CN(C(=O)[C@@H](F)Cl)C3)cc1	1841368956	PQGHBWAERMLTAH-DZGCQCFKSA-N	431.917	1.400	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)CCc2ccnc(C)c2)C1	1841944726	QAISUAHPJVEYPI-YZSQISJMSA-N	436.516	1.660	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1cc(C(C)C)on1)C2	1843415612	QUEXOQMSRMLJTK-OEAKJJBVSA-N	426.477	1.749	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)c2c[nH]c3cc(Cl)ccc23)C1	1843699651	YODMHWDJSUOTJI-UHFFFAOYSA-N	437.692	1.632	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC2(CCCN2C(=O)C2(N3CCN(C)CC3)CC2)C1	1845101564	YBBGDCQWIQNCEP-HNNXBMFYSA-N	427.387	1.001	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)[C@H]2CC[C@H](C(F)(F)F)CC2)C1	1846981859	IDLVKBQQPSLKKZ-KOMQPUFPSA-N	438.255	1.552	50	20	IDGD	
C=C1CC(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)CN(C)NC(=O)NCc2ccccc2)C1	1847226967	PDAAGQSNSUMBMY-PMACEKPBSA-N	425.533	1.501	50	20	IDGD	
O=C(/C=C/c1ccc(Cn2ccnc2)cc1)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl	1847556211	DXMUFOBMUUJZPO-GUKTUGNZSA-N	428.920	1.746	50	20	IDGD	
O=C(CCn1c(=O)oc2ccccc21)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](F)Br	1848153871	XHBMQLVILKUQGN-MQIPJXDCSA-N	440.269	1.877	50	20	IDGD	
CSCC[C@H](NC(=O)c1ccco1)C(=O)NNC(=O)Cc1nc2ccccc2n1C	15926068	AXSFFKNPXKBFNC-AWEZNQCLSA-N	429.502	1.408	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCCC(=O)NNC(=O)Cc2nc3ccccc3n2C)cc1C	22616074	QJGKLHWBORRBCW-UHFFFAOYSA-N	443.529	1.249	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)C[C@](O)(c2nccn2C)C(F)(F)F)c1C	105569947	FMGVDCGCYWSLKP-ACJLOTCBSA-N	428.411	1.792	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)N1CCCN(Cc2ccc(Cl)cc2)CC1	725871545	DFNGRIWMPRIUKW-UHFFFAOYSA-N	433.896	1.612	50	20	IDGD	
O=C(CCc1nc(O)c2c3c(sc2n1)CCC3)NNC(=O)CNC(=O)c1cccs1	725902924	XTBZMJOYQJXRPY-UHFFFAOYSA-N	445.526	1.457	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)C[C@@H](C)N3S(C)(=O)=O)cc1C	726281452	SGKICSWWHNGPMU-CQSZACIVSA-N	444.513	1.414	50	20	IDGD	
CCOc1ccc(OCC)c(NC(=S)NNC(=O)Cn2cc([N+](=O)[O-])ccc2=O)c1	727492173	KONMCTGSFRXZKT-UHFFFAOYSA-N	435.462	1.572	50	20	IDGD	
CS(=O)(=O)CC[C@@H](NS(=O)(=O)c1ccc(Cl)cc1)C(=O)NNc1ccccc1	727861396	AKLRCOHUHVGGQX-MRXNPFEDSA-N	445.950	1.565	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2cccc(C(=O)NNC(=S)NCC3CCC3)c2)C[C@@H](C)O1	727867000	KRZQLMNBFOSEDR-OKILXGFUSA-N	440.591	1.394	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C[C@H]2c3ccccc3CCN2C(C)=O)c2ccccc2c1=O	728000438	PJLAOUMDXWCEGQ-FQEVSTJZSA-N	447.495	1.713	50	20	IDGD	
O=C(COC(=O)[C@@H](c1ccccc1)n1cccn1)NNC(=O)[C@@H]1COc2ccccc2O1	728332722	NPFVBLNYWNGKQA-AZUAARDMSA-N	436.424	1.003	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2csc(-c3cnccn3)n2)cc1OC	728381143	ZACVFEDHIBUARS-UHFFFAOYSA-N	443.441	1.235	50	20	IDGD	
CC[C@H](N=c1nn[nH]n1-c1ccccc1)C(=O)NNC(=O)c1cc2c(s1)CC[C@H](C)C2	729282334	RRHHQZLSRCTYMU-BBRMVZONSA-N	439.545	1.922	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)NC[C@@H]2CN3CCC[C@H]3CO2)c1	729617606	FFZILNNALSLOGQ-WCQYABFASA-N	427.299	1.265	50	20	IDGD	
CCCn1nc(C(=O)NNS(=O)(=O)c2ccc3c(c2)C[C@H](C)O3)c2ccccc2c1=O	729964645	KAOJHXARMOLQSX-ZDUSSCGKSA-N	442.497	1.753	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@H]2CC(=O)N(c3ccc(F)cc3)C2)cc(OC)c1OC	730160299	HWUGOKBPIMONNM-ZDUSSCGKSA-N	431.420	1.666	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCN(c2ccc3c(c2)OCCO3)C1=O)c1cc(-c2ccccc2)on1	730520422	GSQUKXZJMROCMW-INIZCTEOSA-N	448.435	1.927	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C1CCN(C(=O)COc2ccccc2)CC1	730777789	CWDFPRFJVNRHRO-UHFFFAOYSA-N	427.457	1.236	50	20	IDGD	
CN1CCN([C@H](CNC(=O)NNC(=O)COc2ccccc2O)c2cccs2)CC1	730905256	QKTJDWNDFQFOOJ-OAHLLOKOSA-N	433.534	1.152	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2cnc3onc(C)c3c2)cc1Br	732048750	RQDKLQYBDPDQHI-UHFFFAOYSA-N	441.263	1.926	50	20	IDGD	
C[C@H]1CN(Cc2ccc(C(=O)NNC(=O)CCN3C[C@@H](C)O[C@H](C)C3)cc2)C[C@@H](C)O1	732262628	VBAAAIOQYTYJQG-MKXGPGLRSA-N	432.565	1.556	50	20	IDGD	
Cc1cc(C)cc(C(=O)N2CCC[C@@H](C(=O)NNC(=O)CCN3C[C@H](C)O[C@H](C)C3)C2)c1	732264729	WLVYEQQCXSDDFL-HSALFYBXSA-N	444.576	1.802	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)N[C@@H](Cc2ccccc2)CN2CCOCC2)c1	732476728	UWBPLQDCIKMZBU-FQEVSTJZSA-N	426.517	1.648	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc(F)c(F)c1)NNC(=O)c1cnn(-c2ccccc2)c1	733170044	NPHLRIZZXMPLPL-UHFFFAOYSA-N	449.439	1.280	50	20	IDGD	
CCOCCCn1c(NNC(=O)c2ccc(CNC(N)=O)cc2)nc2ccccc2c1=O	733268895	UDSZAGGRRKNJFO-UHFFFAOYSA-N	438.488	1.748	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)CC[C@@H]2NC(=O)N(c3ccc(C#N)cc3)C2=O)cc1	733774691	PXVHYTOOEZFIMH-SFHVURJKSA-N	435.440	1.298	50	20	IDGD	
C[C@H]1C[C@H]1c1ccc(CCC(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)o1	735116903	KSAFWSJCOLUROZ-DOTOQJQBSA-N	447.561	1.810	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@@H]2CCCO[C@H]2C(C)(C)C)c1	735762452	MPQNDUOGNWMXFL-DOTOQJQBSA-N	440.566	1.722	50	20	IDGD	
CS(=O)(=O)Nc1ccc(NC(=O)NNC(=O)COc2ccccc2O)cc1Cl	741071201	WMYBYHOSKUUDBA-UHFFFAOYSA-N	428.854	1.649	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN(C(=O)COc2ccccc2)C1)c1ccc2c(c1)OCCO2	741176111	LPXMBZITTPIFIL-QGZVFWFLSA-N	439.468	1.536	50	20	IDGD	
Cc1nc(-c2ccccn2)nc(NNC(=O)CCN2C(=O)[C@@H]3[C@H]4CC[C@@H](O4)[C@@H]3C2=O)c1C	743414654	XEFIXYVNNGWFNH-AHCXZYCDSA-N	436.472	1.151	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NCCc1ccn(-c2ccc(F)cc2)n1	743577852	STSJYAPTPNAYEE-UHFFFAOYSA-N	430.465	1.376	50	20	IDGD	
COc1ccc(Cl)cc1CN1CCN(CC(=O)NNC(=O)c2ccc(C#N)cc2)CC1	744388055	ZIOBGDFOJQDMRJ-UHFFFAOYSA-N	441.919	1.799	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)NCCc2ccc(S(N)(=O)=O)cc2)c(Cl)c1	745255430	UDAMPMKFKIAHOH-UHFFFAOYSA-N	425.898	1.874	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)N[C@@H]1CC(=O)N(CCOc2ccccc2)C1	745846662	IRSCNDJXTUFXSU-OAHLLOKOSA-N	427.417	1.219	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)[C@H]1CCCN1C(=O)c1ccc2c(c1)OCO2	746555912	IWOFFCDDZNETCB-MRXNPFEDSA-N	435.440	1.058	50	20	IDGD	
COC(=O)c1cc(OC)c(S(=O)(=O)NNC(=O)c2cc(Br)c[nH]2)s1	748791733	ZGZCELYGYLVZPH-UHFFFAOYSA-N	438.281	1.257	50	20	IDGD	
COC(=O)CC1(NC(=O)CCC(=O)C(C#N)=C2N(C)c3ccccc3N2C)CCOCC1	749507252	HMAYWXNOEXLZEU-UHFFFAOYSA-N	440.500	1.886	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N2CCc3c[nH]nc3C2)cc1	750794546	PJYUDFKJDPZPLG-YVLHZVERSA-N	445.483	1.649	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)c2ccc(Cl)c(S(=O)(=O)NC[C@@H]3CCCO3)c2)o1	752522614	ADKCXYAWUPCHRR-ZDUSSCGKSA-N	441.893	1.774	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)N[C@H]2CCN(Cc3ccc(C#N)cc3)C2=O)nc2ccccc21	753740147	VUFKXOMZUCKAKB-SFHVURJKSA-N	445.483	1.119	50	20	IDGD	
NC(=O)[C@H](c1ccc(Cl)cc1)N1CCN(CC(=O)NNC(=O)c2ccc(F)cc2)CC1	754236736	KDILZZFWYBNHJN-IBGZPJMESA-N	447.898	1.084	50	20	IDGD	
CC(C)(CO)CCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	754915833	INZMQXKEHNQPRP-UHFFFAOYSA-N	440.566	1.604	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)c2ccnc(O[C@@H]3CCOC3)c2)cc1C	755048970	HVYYZIJEOABIOY-CQSZACIVSA-N	433.486	1.800	50	20	IDGD	
O=C(CCC/N=C1/NS(=O)(=O)c2ccccc21)NNc1ccc(C(F)(F)F)nn1	755183230	IILYQWJCQWBXTN-UHFFFAOYSA-N	428.396	1.457	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)Nc2ccc(C(=O)NC(C)(C)C)cc2)c2ccccc2c1=O	755615419	LEGUNMVTEGPFRQ-UHFFFAOYSA-N	436.472	1.928	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)Nc1ccccc1C(=O)N1CCOCC1	755623546	QFUQBKGZQSBLCI-UHFFFAOYSA-N	428.445	1.399	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)Nc1cccc(C(=O)N2CCOCC2)c1	755934227	OKLCBRCXNYISFA-UHFFFAOYSA-N	426.473	1.953	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccc(CCN3CCOCC3)cc2)c1	756163778	JLFSFKWJGMDMRT-UHFFFAOYSA-N	446.529	1.431	50	20	IDGD	
CC(C)c1cc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)no1	756789386	GSLOHRQVTNWMOX-UHFFFAOYSA-N	437.478	1.285	50	20	IDGD	
NC(=O)c1ccc(NNC(=O)c2cc(S(=O)(=O)NC3CC3)c(Cl)cc2Cl)nn1	757393162	SYYSPGCFGWTDEC-UHFFFAOYSA-N	445.288	1.080	50	20	IDGD	
CCCCN1C(=O)CC[C@@H](C(=O)NNc2ccc(C(N)=O)nn2)[C@H]1c1ccc(OC)cc1	757408047	PAFVFFRCOKJWGE-OXQOHEQNSA-N	440.504	1.807	50	20	IDGD	
CC(=NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1cc(C(=O)O)ccc1O	757450550	DAHWANVCUAEGJJ-UHFFFAOYSA-N	447.469	1.265	50	20	IDGD	
Cn1cc(Br)cc(NC(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)c1=O	757591989	INJADMOEBPLNBQ-UHFFFAOYSA-N	446.302	1.605	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)Nc1ccccc1O[C@H]1CCOC1	757677009	DQKWHZUWQVIZLG-INIZCTEOSA-N	426.477	1.714	50	20	IDGD	
CC(C)n1ncc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)c1N	757695983	MSLFNJVMIUZWDU-UHFFFAOYSA-N	434.522	1.296	50	20	IDGD	
O=C(NNc1nc(O)c2ccccc2n1)c1cccc(S(=O)(=O)N2CCOCC2)c1	758295640	FYDYYYPYHIYBMJ-UHFFFAOYSA-N	429.458	1.113	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)NCc1ccc(S(=O)(=O)NCC(C)C)cc1	759663401	ZFFPUYHBVNIYIR-UHFFFAOYSA-N	434.518	1.774	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)c1nc2ncc(Br)cn2n1	761633964	VLCPKKHCZFGUNQ-UHFFFAOYSA-N	437.279	1.449	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2)c(OCC(F)(F)F)c1	763420342	QUZYMGZGMVEWTE-UHFFFAOYSA-N	439.346	1.814	50	20	IDGD	
Cc1cc(S(=O)(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)cc(C(=O)O)c1Cl	763439738	QANPEWISRKXFNH-UHFFFAOYSA-N	449.913	1.961	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)CC(=O)N3)c(C)n1-c1ccccc1	763603270	YUPIISOPZBQWLL-UHFFFAOYSA-N	431.452	1.988	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2ccc3nc4n(c(=O)c3c2)CCC4)c1	763666072	WNSYHILBSOORIE-UHFFFAOYSA-N	449.467	1.124	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)C(=O)Nc1ccc(F)c(Br)c1	763680864	RJUQIYNLCFDNFZ-UHFFFAOYSA-N	428.189	1.892	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cccc3c2OCCC3=O)c1C	763840080	IGJFIKOEFVUQRH-AWEZNQCLSA-N	425.441	1.822	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccccc2N2CCOC2=O)c1C	763841145	NXBNWRFVNGBMJD-HNNXBMFYSA-N	440.456	1.813	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccccc2C[S@@](C)=O)c1C	763851886	GAWHTLFFQAHORA-DHMKHTPVSA-N	431.514	1.735	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cnc3c(c2)COCC3)cc1	763859675	DWAVDZUAHGJUTM-CYBMUJFWSA-N	428.445	1.106	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cnn(C[C@H]3CCCO3)c2)cc1	763861389	PAMONMSAZOEXJI-KBXCAEBGSA-N	445.476	1.014	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cccc([S@@](C)=O)c2)cc1	763862702	ZIBQLPPDUOBKBH-BRRNQIAESA-N	433.486	1.376	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1cccc(Oc2cnccn2)c1	763870638	BFKXSESDTKAGFU-ZDUSSCGKSA-N	439.403	1.961	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)OCCCO3)cc1	763878691	SUBAACWFUIUYRV-AWEZNQCLSA-N	441.440	1.604	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cccc3c2OCCO3)cc1	763879054	VWPQENGVRXMUJW-ZDUSSCGKSA-N	427.413	1.214	50	20	IDGD	
CCCN(CCC)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)Cn2nc(C)cc2C)cc1	763892955	ORPDHBBSVJDSKF-UHFFFAOYSA-N	442.520	1.548	50	20	IDGD	
CCS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)C2=S=C3CC[C@H](C)CC3=C2)cc1	763940731	HYRFFJNIQSGEBO-LBPRGKRZSA-N	449.554	1.404	50	20	IDGD	
CN(C)c1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	763945498	YQHKDWFUYVFLGY-UHFFFAOYSA-N	442.863	1.697	50	20	IDGD	
COC(=O)c1c(NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)sc(C)c1C	763974817	XUVJIBCQAUSEFM-UHFFFAOYSA-N	425.850	1.910	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1ccc(N2CCOC2=O)cc1	764013483	YDPLEQLBIOPNMV-UHFFFAOYSA-N	432.820	1.705	50	20	IDGD	
CCCOC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1	764077837	ODUJYAYDTVJMIF-UHFFFAOYSA-N	447.469	1.057	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc(F)cc2Br)ccc1C(N)=O	764084932	KBJMJPSRHHYGAQ-UHFFFAOYSA-N	437.225	1.395	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3ccc(Cl)nc3)cc2)C[C@H](C)O1	764093313	RXPKJHOGWZJZLY-STQMWFEESA-N	431.880	1.748	50	20	IDGD	
O=C(CC1CCCC1)NNC(=O)C(=O)Nc1ccc(C(=O)N2CCOCC2)c(Cl)c1	764188724	SFAJUKBLGJKYGG-UHFFFAOYSA-N	436.896	1.479	50	20	IDGD	
COC(=O)c1ccc(C(F)(F)F)cc1NC(=O)C(=O)NNC(=O)c1cccc(C#N)c1	764236251	XEXNMVMCNXHDII-UHFFFAOYSA-N	434.330	1.763	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(NC(=O)NCc3ccco3)cc2)c1	764238500	TUKJUMNHJCCHRI-UHFFFAOYSA-N	446.423	1.873	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)Cc2ccccc2F)c(OC(F)F)c1	764313201	IBXLZYLTQYNGIU-UHFFFAOYSA-N	439.346	1.542	50	20	IDGD	
Cn1ccnc1[C@@](O)(CC(=O)NNc1c(F)cc(C(=O)NC2CC2)cc1F)C(F)(F)F	764335289	PQIVHPHRPLHSTK-KRWDZBQOSA-N	447.364	1.874	50	20	IDGD	
O=C(CCCc1cccs1)NNC(=O)C(=O)Nc1ccc(CN2CCOC2=O)cc1	764344081	YVALKGLDNXBGPV-UHFFFAOYSA-N	430.486	1.809	50	20	IDGD	
CC(C)CNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)Cc2ccncc2)cc1Cl	764355922	LZLWXBPLBQOJHH-UHFFFAOYSA-N	431.880	1.449	50	20	IDGD	
Cc1cc(Br)ncc1NC(=O)C(=O)NNC(=O)C(F)(F)Oc1ccccc1	764377288	BMOTYHBHKJDEDZ-UHFFFAOYSA-N	443.204	1.910	50	20	IDGD	
C[C@H](C(=O)NNC(=O)c1ccc(F)cc1Br)S(=O)(=O)C1CCOCC1	764940459	QMRKKJPNLMBMPB-SECBINFHSA-N	437.287	1.332	50	20	IDGD	
COc1cc(C(=O)NCC(=O)NNC(=O)CSc2ccccc2O)cc(OC)c1OC	765402781	IEVSMRWYJGDWDJ-UHFFFAOYSA-N	449.485	1.088	50	20	IDGD	
C[C@H](NS(=O)(=O)c1cccc(C#N)c1)C(=O)NNC(=O)c1cccc(OC(F)F)c1	765406551	QZDYNKYMFGBQFS-NSHDSACASA-N	438.412	1.288	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)ccc1F	765565021	KGPJILWNDFGFJP-UHFFFAOYSA-N	437.478	1.602	50	20	IDGD	
CCS[C@@H](C)c1noc(CN(C)C(=O)NNC(=O)CNC(=O)c2cccs2)n1	765732651	JNUZGWBUPGVDJV-JTQLQIEISA-N	426.524	1.548	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)CSCc3c(C)noc3C)CC2)cc1	765748282	LKYDYWJXWDYEOK-UHFFFAOYSA-N	445.589	1.798	50	20	IDGD	
Cc1cc(S(=O)(=O)NNC(=O)c2ccc(CSc3nncn3C)cc2)ccc1C#N	766551412	FYJYVRJRYNFJLH-UHFFFAOYSA-N	442.526	1.911	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NN=C(C)CCCCO)N(S(C)(=O)=O)CC2	766688856	BAIPMSYICDYSND-QGZVFWFLSA-N	441.550	1.607	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)C(=O)c1c(C)nn(-c2ccccc2)c1C	767264144	HVTMEWMOPGNJNL-UHFFFAOYSA-N	448.479	1.914	50	20	IDGD	
CCn1c(=O)c2ccccc2n(CC(=O)NNC(=S)Nc2ccccc2OC)c1=O	768275798	AQKIIEXMZGBMRX-UHFFFAOYSA-N	427.486	1.210	50	20	IDGD	
C[C@]1(c2cccc(C(=O)NNC(=O)c3ccc(Br)s3)c2)NC(=O)NC1=O	768931027	UVCIBSKZLWRFQJ-MRXNPFEDSA-N	437.275	1.640	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCOCC2)cc1C(=O)OC[C@H](C)CBr	770324923	UKJBQATYGBUADC-GFCCVEGCSA-N	436.324	1.904	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)NC3CCN(C(=O)c4ccoc4)CC3)nc21	770341408	MZAWCXFVNUYONN-UHFFFAOYSA-N	442.480	1.811	50	20	IDGD	
COc1cccc2c1OC[C@@H](NC(=O)NNc1nc(O)c3cnn(C(C)(C)C)c3n1)C2	770378493	WIZPBEIEODVPCK-LBPRGKRZSA-N	427.465	1.925	50	20	IDGD	
Cc1ccc(-c2nnc(S)n2CC(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1	770423998	FDSYDIJVTODODM-UHFFFAOYSA-N	425.470	1.775	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)CCNS(=O)(=O)c3ccccc3)nc21	770966477	RIUXBBQIQOCFLK-UHFFFAOYSA-N	433.494	1.099	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)C1CCN(S(=O)(=O)c2ccc(C)c(C)c2)CC1	771944168	QPHOWIACWBOPTE-OAHLLOKOSA-N	439.534	1.193	50	20	IDGD	
COc1ccc(C(=O)NCCCC(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)cc1	772187705	BKHWQQNVIVSCAP-UHFFFAOYSA-N	446.891	1.322	50	20	IDGD	
O=C(NNC(=O)c1cc(COc2ccc(Cl)cc2Cl)on1)C(=O)N1CCCC1	772227519	WXVKIWONSPGABB-UHFFFAOYSA-N	427.244	1.944	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1cnn(C[C@H]2CCCO2)c1	774002279	PIMZVMSQUPVKNU-MLGOLLRUSA-N	435.868	1.269	50	20	IDGD	
CC[C@H](C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1)c1ccc(OC)cc1	775946220	UJHXGKBSPNDKJK-QFBILLFUSA-N	428.441	1.719	50	20	IDGD	
CN(NC(=O)Cc1nnc(O)c2ccccc12)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776202370	SYJVTZJDDFUKFK-UHFFFAOYSA-N	444.492	1.514	50	20	IDGD	
CN(C(=O)OC(C)(C)C)[C@H](C(=O)NNC(=O)c1ccc2c(c1)OCCO2)c1cnn(C)c1	776323676	OXTYTGYDJQNBJF-KRWDZBQOSA-N	445.476	1.561	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)Nc2cc(N3CCCS3(=O)=O)ccc2F)c1	776466830	KLAFAFUUXSHFDG-UHFFFAOYSA-N	442.494	1.918	50	20	IDGD	
CC(C)N1C(=O)C[C@H](C(=O)NNC(=O)C(=O)N2CCCC2)[C@@H]1c1ccc(Cl)c(F)c1	776472946	FRKHGCLGWZWDGQ-GUYCJALGSA-N	438.887	1.547	50	20	IDGD	
CC(=O)c1cccc(S(=O)(=O)NCCC(=O)NNc2cccc(S(C)(=O)=O)c2)c1	776527761	IZLPRSPCVRQHKD-UHFFFAOYSA-N	439.515	1.104	50	20	IDGD	
COCCO[C@H]1COCC[C@@H]1NC(=O)NNC(=O)c1ccc(OC)c(Br)c1	776876176	AQCMATHRQYQAEV-ZFWWWQNUSA-N	446.298	1.222	50	20	IDGD	
COCCCNC(=O)NNS(=O)(=O)c1cc(Cl)ccc1OC[C@@H]1CCCCO1	777616035	BUSXCBMZUVKNRN-AWEZNQCLSA-N	435.930	1.817	50	20	IDGD	
O=C(CCCc1nc2ccccc2[nH]1)N1CCN(S(=O)(=O)CBr)CC1	777777777	OXNOUZJJVOIBDX-UHFFFAOYSA-N	429.340	1.712	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)Nc1ccnn1Cc1cccc(Br)c1	779473977	SADDBEPVQLMAEP-GFCCVEGCSA-N	440.298	1.898	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)NOCCC(F)(F)F	779696027	VVUXHWWBSBHBAV-UHFFFAOYSA-N	438.428	1.689	50	20	IDGD	
CS(=O)(=O)CC[C@@H](NC(=O)c1ccc(Cl)cc1)C(=O)NNc1ccnc(F)c1	781363861	OJPHUWRXJNJEFA-CQSZACIVSA-N	428.873	1.551	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2cnn(C)c2C(F)(F)F)c1	782098395	HFIHMGWHCHOLRY-UHFFFAOYSA-N	434.400	1.156	50	20	IDGD	
NC(=O)CNC(=O)c1cccc(NC(=O)C(=O)NN(c2ccccc2)c2ccccc2)c1	782822171	ROVZFBQHJZWBNI-UHFFFAOYSA-N	431.452	1.710	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)C(=O)Nc1ccc(F)c(Cl)c1	782898270	YXXLZNLYHXHAPA-UHFFFAOYSA-N	441.872	1.480	50	20	IDGD	
O=C(NNc1cncc(Cl)n1)C(=O)Nc1cccc(S(=O)(=O)N2CCCCC2)c1	783258574	KDERBGHEBFKUTD-UHFFFAOYSA-N	438.897	1.386	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NN=c2sc3ccccc3n2C)cc1C	783349682	NNEPYEGVBBCDRO-UHFFFAOYSA-N	447.542	1.880	50	20	IDGD	
Cc1cnc(O)n1-c1ccccc1NC(=O)C(=O)NNc1cccc(S(C)(=O)=O)c1	784840067	ZQZMGMZATJHLCD-UHFFFAOYSA-N	429.458	1.372	50	20	IDGD	
COc1cccc(NNC(=O)C(=O)Nc2cc(S(=O)(=O)N3CCCCC3)ccc2C)n1	784842910	BHPHQIZGRGKDRH-UHFFFAOYSA-N	447.517	1.655	50	20	IDGD	
CC[C@H](C)NS(=O)(=O)Cc1cccc(NC(=O)C(=O)NNc2cccc(OC)n2)c1	784845932	HQDXKBJXUJRFHM-ZDUSSCGKSA-N	435.506	1.390	50	20	IDGD	
COc1cc(F)cc(NNC(=O)C(=O)Nc2cc(S(=O)(=O)N(C)C)ccc2F)c1	785241527	KKFKSCYXAITGHS-UHFFFAOYSA-N	428.417	1.306	50	20	IDGD	
COCC[C@@H](NC(=O)C(=O)Nc1ccccc1S[C@H](Cl)C(F)(F)F)C(N)=O	785285892	NMKIBRIDIWANEY-OTYXRUKQSA-N	427.832	1.851	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NN=C2CCOC[C@@H]2CN2CCCCC2)cc1	787155176	QCAIXOKVTQRZJX-SFHVURJKSA-N	436.578	1.610	50	20	IDGD	
CCN1C(=O)c2ccc(C(=O)NNC(=O)NCc3ccc(Cl)cc3)cc2S1(=O)=O	787431323	KMWCBCIDUYTYSQ-UHFFFAOYSA-N	436.877	1.649	50	20	IDGD	
CS(=O)(=O)[C@@H]1CCCC(=NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)C1	788433475	BAVQAEAVCYPJCK-GOSISDBHSA-N	440.997	1.917	50	20	IDGD	
CN(NC(=O)c1cn(C)nc1-c1ccoc1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	790020951	QTFWFPGONWMWBR-UHFFFAOYSA-N	432.481	1.929	50	20	IDGD	
N#C/C(=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)N1CCC[C@H](O)C1	790102930	NLTZTLRJVGCJLE-BXBOZWQASA-N	427.892	1.969	50	20	IDGD	
O=C(CCOCC(F)(F)C(F)(F)F)NNC(=O)C(=O)NCc1ccc(Cl)cc1	790844555	ZDOBWKGCCUZJPN-UHFFFAOYSA-N	431.745	1.708	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCN(CC(F)(F)F)C1)c1ccc(S(=O)(=O)N2CCCC2)cc1	792016420	OSBJYHCFHKVACI-AWEZNQCLSA-N	448.467	1.116	50	20	IDGD	
CCc1c(NC(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)cnn1-c1cccc(Cl)c1	792486624	BGPJSOJPMPOAMZ-LLVKDONJSA-N	425.898	1.676	50	20	IDGD	
Cc1ccn(-c2ccc(NC(=O)C(=O)NNC(=O)c3nn(-c4ccccc4)cc3O)cc2)n1	793022175	QDVHUTNDGKOSQJ-UHFFFAOYSA-N	445.439	1.472	50	20	IDGD	
CSSCCNC(=O)C(=O)Nc1ccc2c(ccn2CC(=O)N2CCOCC2)c1	793078698	QGWCSITYFASANW-UHFFFAOYSA-N	436.559	1.566	50	20	IDGD	
Cc1cc(C(=O)O)c(F)c(S(=O)(=O)NNC(=O)CNC(=O)OCc2ccccc2)c1	794599035	SXSOPHMBINJKOP-UHFFFAOYSA-N	439.421	1.068	50	20	IDGD	
CCC(C)(C)C1CCC2(CC1)NC(=O)N(CC(=O)NNC(=O)NCC(F)(F)F)C2=O	798315047	LYLKLQLUFNXWHB-UHFFFAOYSA-N	435.447	1.796	50	20	IDGD	
CN(C)C(=O)c1ccc(S(=O)(=O)NNC(=O)c2ccc(F)cc2Br)cc1	799522860	VOXACIBMVSBOMX-UHFFFAOYSA-N	444.282	1.913	50	20	IDGD	
CC(C)(C)CC(=O)N1CSC[C@H]1C(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	802063645	NRJAKMNORVFDLC-AWEZNQCLSA-N	442.563	1.581	50	20	IDGD	
CCc1nnc(NC(=O)[C@@H](C)[C@@H](C)NC(=O)NNC(=O)COc2ccccc2O)s1	805880625	ICHHMJVRQVLDSA-WDEREUQCSA-N	436.494	1.179	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)Nc1ccc(S(=O)(=O)[C@H](C)C#N)cc1	806458526	KJJLLQMYCPAJSJ-CYBMUJFWSA-N	432.458	1.613	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)NNC(=O)[C@@H]3COc4ccccc4O3)cc2C1	807026177	KSMFTXHABYONPS-NHYWBVRUSA-N	430.486	1.688	50	20	IDGD	
COc1cc(OC)cc(Oc2ccc(CNC(=O)NNC(=O)C(=O)NC3CC3)cc2)c1	807225381	FHHDNJGKZFYGML-UHFFFAOYSA-N	428.445	1.605	50	20	IDGD	
CSSCCNC(=O)N1CCN([C@@H]2CCCN(c3cc(C)nn3C)C2=O)CC1	807230993	GDRLQFFWJDODMH-OAHLLOKOSA-N	426.612	1.562	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1cncnc1-c1ccccc1	810591085	AAUPWZLJDKSKGN-UHFFFAOYSA-N	444.495	1.363	50	20	IDGD	
Cn1nc(C(=O)NN=C2C(=O)Nc3cc(Br)ccc32)c2ccccc2c1=O	812420194	VDLQGNSISLRWOZ-UHFFFAOYSA-N	426.230	1.782	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)C[C@@H]2COCCN2C(=O)OC(C)(C)C)cc1	812733371	PKWHNQZVRMKTAO-OAHLLOKOSA-N	442.538	1.406	50	20	IDGD	
Cc1noc(-c2ccccc2)c1NC(=O)C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	813033140	GTLLYFMGFDOCMC-UHFFFAOYSA-N	443.485	1.982	50	20	IDGD	
C=Cc1ccc(CCNC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1	813201709	FJKRTCURGDWJKI-UHFFFAOYSA-N	430.530	1.832	50	20	IDGD	
CCC[C@@H](C)C(=O)NCCNC(=O)NNC(=O)c1ccc(OC)c(Br)c1	814300573	OUKPUMMSCDULOQ-LLVKDONJSA-N	429.315	1.954	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@@H]2CCc3nncn3C2)cc(C)c1Br	815691455	QQZXBLSUFDPOQL-LLVKDONJSA-N	435.282	1.006	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1ccn(-c2ccccc2)n1	815752231	JXDZGOYOBVMRMV-UHFFFAOYSA-N	428.474	1.204	50	20	IDGD	
CN(C)NC(=O)Nc1cccc(NC(=O)CN2CCN(C(=O)OC(C)(C)C)CC2=O)c1	816405850	YIKXVIWZTZRLFI-UHFFFAOYSA-N	434.497	1.303	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@H](NS(=O)(=O)C2CC2)C(C)C)ccc1OC(C)C	816828798	PISRDBSWCVHISR-QGZVFWFLSA-N	427.523	1.350	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)c1sccc1S(=O)(=O)C(F)F	817055084	LPYZCTQQOHBBHP-UHFFFAOYSA-N	439.487	1.752	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NN=C1C(=O)Nc2c(Br)cc(Cl)cc21	864323137	KIMCWOUFLHJBQO-UHFFFAOYSA-N	436.653	1.700	50	20	IDGD	
Cn1cc(C(=O)NN=Cc2c(N3CCOCC3)nc3ccccn3c2=O)c2ccccc21	874098276	RCRCZQUMVUDUJL-UHFFFAOYSA-N	430.468	1.787	50	20	IDGD	
CCCn1c(C)cc(/C=C(/C#N)C(=O)N(CC)CC(=O)N[C@H]2CCS(=O)(=O)C2)c1C	912663582	JUGPCUKJIVQCHC-LOHYDARVSA-N	434.562	1.574	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(N2CCC(C(=O)NNC(C)=O)CC2)c([N+](=O)[O-])c1	912694093	UGALHWZKTHASFO-UHFFFAOYSA-N	441.510	1.009	50	20	IDGD	
COc1ccnc(NNC(=O)C2CCN(S(=O)(=O)c3ccc4c(c3)CCC4)CC2)n1	914762759	HMQVYAQNIIFDFR-UHFFFAOYSA-N	431.518	1.518	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NN=Cc1cccc2c1OCO2	915937001	JZIBJYKTUXMFTC-UHFFFAOYSA-N	445.497	1.519	50	20	IDGD	
O=C(NCc1ccc(OC2CCCC2)nc1)NNC(=O)c1csc(N2CCOCC2)n1	916396398	OJHRMOAANLBXNR-UHFFFAOYSA-N	446.533	1.840	50	20	IDGD	
C[C@@]1(NNC(=O)NC[C@H](c2ccccc2Cl)N2CCOCC2)CCS(=O)(=O)C1	916437933	RCAJVGUDAQLVTM-SJLPKXTDSA-N	430.958	1.094	50	20	IDGD	
CCOC(=O)CCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	916523650	MIXMRLSRUJJKSZ-UHFFFAOYSA-N	440.522	1.149	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CN2CCN([C@@H](C)C(=O)Nc3cccc(F)c3)CC2)cc1	917124070	DLMBMVXEDLZOEH-KRWDZBQOSA-N	441.507	1.540	50	20	IDGD	
CSCC[C@H](NC(=O)COc1ccccc1)C(=O)NNC(=O)c1ccc(Cl)nc1	917252034	REAZNCLOJFYPAR-HNNXBMFYSA-N	436.921	1.813	50	20	IDGD	
COC(=O)CCOc1ccc(S(=O)(=O)NNC(=O)c2ccc(Cl)cc2OC)cc1	917730399	CRSZDMWJANLCLH-UHFFFAOYSA-N	442.877	1.914	50	20	IDGD	
CC(C)S(=O)(=O)c1ccc(C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1	919304347	RZFFSNHHHDEWGI-UHFFFAOYSA-N	449.441	1.395	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)CN1C(=O)N[C@@]2(C[C@@H](C)CC(C)(C)C2)C1=O	919822204	GIWRWCMATKPAAK-RCDICMHDSA-N	430.505	1.522	50	20	IDGD	
O=C(CCCOc1cccc(Br)c1)NNC(=O)N[C@@H]1CCS(=O)(=O)C1	919885872	OOKSMLHMBSXZBB-GFCCVEGCSA-N	434.312	1.126	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN(c2nc3ccccc3s2)C1)N[C@@H]1CCS(=O)(=O)C1	919886650	SZMBTWKNYFRZBI-CHWSQXEVSA-N	437.547	1.030	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)NNC(=O)c1ccc(Br)s1	920051106	JHOWYJBSFRJQFG-UHFFFAOYSA-N	427.280	1.737	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)c1cc([N+](=O)[O-])cc(S(C)(=O)=O)c1	920284893	IFVRHZAZPJSFNF-UHFFFAOYSA-N	427.822	1.735	50	20	IDGD	
Cc1nn(C)c2nc(Cl)c(C=NNC(=O)c3ccc(Cl)c(S(N)(=O)=O)c3)cc12	920367438	DCBAWRYGTHOJPB-UHFFFAOYSA-N	441.300	1.995	50	20	IDGD	
C[C@@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	921298876	OKIFXQPYDILUHI-CYBMUJFWSA-N	440.522	1.145	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2ccc(Cl)cc2O)cc1	1117631476	SBYIVWVJPSYZKH-UHFFFAOYSA-N	427.866	1.184	50	20	IDGD	
COCCS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cncn2-c2ccccc2)cc1	1318098684	OXWLJWDKFKQJST-UHFFFAOYSA-N	428.470	1.367	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@H](C)c2ccc(F)cc2F)cc1	1322120188	FRMMFURYEVCZME-CYBMUJFWSA-N	425.457	1.845	50	20	IDGD	
CN(CCO)S(=O)(=O)c1ccccc1CNC(=O)NNC(=O)c1ccccc1Cl	1322779230	JGDSARJILDIACV-UHFFFAOYSA-N	440.909	1.097	50	20	IDGD	
Cc1coc(C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1C	1327841811	FJDTVHAEGVGOQE-UHFFFAOYSA-N	435.502	1.311	50	20	IDGD	
CCN1CCN(c2ccc(S(=O)(=O)N3CCOCC3)cc2NC(=O)CCl)CC1	1341524518	VCYNKJWIANRCPU-UHFFFAOYSA-N	430.958	1.027	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccn4cncc4c3)C2)C1	1778653142	JHZUKZRRIPCATM-KUHUBIRLSA-N	435.322	1.809	50	20	IDGD	
Cc1nc2sccn2c1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](C)Br)CCO2	1778721616	KCWVJBPDBIVNKT-GTNSWQLSSA-N	441.351	1.931	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3coc([Si](C)(C)C)c3)C2)C1	1778999367	AILGSZPDFSPECX-BEFAXECRSA-N	428.989	1.522	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@]2(C1)CN(C(=O)Cc1ccc3c(c1)CCO3)CCO2	1779301583	SMJCAAOODPQGNP-JOCHJYFZSA-N	432.593	1.845	50	20	IDGD	
O=C(C1=C2c3ccccc3C(=O)N2CC1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Cl)CCO2	1780004327	BUZMWDYZLZQGSK-DYESRHJHSA-N	433.867	1.622	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H]1C[C@@H]1F)CCO2	1780098182	FHAINFYCAPBTHZ-DKICVRJWSA-N	435.408	1.322	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(CO)on2)C1	1780221574	ZPCSQVCUVKABIS-ZTFGCOKTSA-N	434.320	1.531	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)cc1OC	1780658155	GCWDVHGYJJYYPM-DJJJIMSYSA-N	441.322	1.931	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CN1CCCCC1=O)C2	1780714372	BNQUNUFHLSUWSM-CDHQVMDDSA-N	448.391	1.749	50	20	IDGD	
CN1CCC(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](F)Br)C2)CC1	1780770682	VSKFBXWGTANNKN-SZVBFZGTSA-N	448.377	1.923	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCc1cnc[nH]1)C2)[C@H](F)Br	1780770932	LIHFYHOLCAVUMV-UKPHBRMFSA-N	431.306	1.547	50	20	IDGD	
C[C@H](Nc1cccnc1)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@](C)(Cl)CCl)C2)C1	1781227189	IBBHIULKMGCCMD-KYNGSXCRSA-N	429.348	1.948	50	20	IDGD	
Cc1cccnc1CCC(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781326341	NNFYIVYXGYQWJR-SJLPKXTDSA-N	428.302	1.843	50	20	IDGD	
O=C([C@H](F)Br)N1CC[C@@]2(C1)CN(C(=O)[C@H]1Cc3ccccc3O1)CCO2	1781329992	PHBFGWIIZOJZRA-RVKKMQEKSA-N	427.270	1.511	50	20	IDGD	
Cc1cc(C)n(CCC(=O)N2CCO[C@]3(CCN(C(=O)[C@H](F)Br)C3)C2)n1	1781333114	CSJLMOUHZRUBEB-DOTOQJQBSA-N	431.306	1.410	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCN2CCCC2)C1	1783320146	KITONSDWGOGIIG-WIYYLYMNSA-N	425.646	1.838	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)CCC(=O)N3CCCC3)CCO2)C1	1783342437	IUMLAIFHIZUXEB-HNAYVOBHSA-N	444.370	1.392	50	20	IDGD	
CCOc1ncccc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21	1783391486	AOMFXRMMDRSHOD-MXAVVETBSA-N	444.301	1.764	50	20	IDGD	
COc1ccccc1CC(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](C)Br)C2)C1	1783540358	UQDOHSKHQULWGH-LIRRHRJNSA-N	425.323	1.851	50	20	IDGD	
Cc1c(Cl)cccc1C(=O)N1CCO[C@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1	1783933218	SAVYCKKFNKNXSM-NRFANRHFSA-N	436.940	1.465	50	20	IDGD	
Cc1n[nH]c(C)c1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]2C1	1783970483	UIPCVGJMYKTTNM-KJEVXHAQSA-N	427.343	1.651	50	20	IDGD	
CCOc1ncc(Cl)cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]2C1	1784091275	MSBQVORKXBEBRU-DDWPSWQVSA-N	446.331	1.327	50	20	IDGD	
CC1(C)Cc2cccc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)[C@@H](O)CCl)C[C@@H]43)c2O1	1787367397	RACVBSXFDSTPHL-DKIMLUQUSA-N	436.936	1.593	50	20	IDGD	
C[C@@H](C(=O)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1)n1cccn1	1788143558	NDPJNPSEVNVEDC-INIZCTEOSA-N	432.289	1.572	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc4n(n3)CCCC4)[C@H]2C1	1788355666	HYTHASGQCVVUIS-IEZWGBDMSA-N	434.613	1.664	50	20	IDGD	
C[Si](C)(C)c1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](O)CCl)C[C@@H]32)co1	1788590256	LQRNKBCYYHHWLF-TUUVXOQKSA-N	428.989	1.018	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1ccc(C2(NC(=O)[C@@H](C)NC=O)CCC2)cc1	1788645385	GUFFUNCOBMKSDZ-DIODKFOQSA-N	438.488	1.389	50	20	IDGD	
COCCn1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]3C2)n1	1789865688	BXYYASUEAYHDHM-IWKLRQMXSA-N	447.363	1.359	50	20	IDGD	
Cc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](O)CCl)C[C@@H]32)cc(C)c1C(=O)O	1790317533	PIMFOEWQAJEAKQ-LLLHUVSDSA-N	438.908	1.195	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)Nc1ccc(C2(NC(=O)CN3CC(=O)NC3=O)CCC2)cc1	1790488952	HSKNVMCXVSSDSU-GOSISDBHSA-N	441.315	1.909	50	20	IDGD	
C#CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C(C#N)=C/c3ccc(Br)cc3)[C@H]2C1	1790696214	CFJPTSWCVZGJMU-OLWHEGCOSA-N	442.313	1.969	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cc4ccccc4n3C)C[C@@H]21	1791249281	HGNJHMSIZHTRRQ-ROPHOZQPSA-N	447.963	1.954	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3n[nH]c4cccc(F)c34)C[C@@H]21	1791256920	LTMWIALUPOZBOC-QCQGSNGOSA-N	438.887	1.549	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c(c1)COC3)C2	1792867408	AXUWSKZJRNDCST-BIMQEMHKSA-N	437.334	1.951	50	20	IDGD	
Cc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](O)CCl)c2cc(O)ccc2n1	1792981148	FVDQVRSIBZALGN-JSVGYJQLSA-N	433.892	1.052	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1CCC(CO)CC1	1793852558	NOLREYILIAODPZ-XKXGBVFJSA-N	431.371	1.406	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1n[nH]c(C2CC2)c1F	1794478825	SWLXNYZIHYOOTB-SGESHTKJSA-N	443.317	1.660	50	20	IDGD	
COc1ccc(F)c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCBr)c1	1795117087	MEHZUYHOHJBYSH-DPIQGUFMSA-N	429.286	1.823	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1ccc(Cl)cc1)c1ccc(B(O)O)cc1	1795660196	NLWQIQIPDOGGTQ-ACDBMABISA-N	426.709	1.514	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc2cc(O)ccc2n1)c1ccc(B(O)O)cc1	1797377921	KLNGNLLJULVNEA-REPLKXPHSA-N	445.284	1.186	50	20	IDGD	
Cn1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCBr)C3)c2cccnc21	1797575124	LYQHTFZBANUTLA-FVCICTRLSA-N	435.322	1.562	50	20	IDGD	
CC#CC[C@@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc(B(O)O)c1)C2)c1ccccc1	1798553503	NFWXYYJKERLCTC-UEQSERJNSA-N	444.340	1.815	50	20	IDGD	
Cc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)Br)C3)nn1C(F)F	1798677285	QVAFZFYWUFLUOX-KQXIARHKSA-N	435.269	1.573	50	20	IDGD	
C[C@H](NNc1ccccc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@](C)(Cl)CCl	1799273705	OMKAJOJDZDKLSK-GUEUDTIMSA-N	443.375	1.818	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@](C)(Cl)CCl	1799279229	CQFZJEHPKMCDNW-JPVZDGGYSA-N	438.352	1.337	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1C[C@@]12C(=O)Nc1ccccc12	1800735477	OVRRTZUHHHJUIG-YEFSBHDESA-N	431.920	1.503	50	20	IDGD	
C[C@H](Cc1ccccn1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2	1801226954	XFUKTOVLBDFWKL-CNRIWFPOSA-N	428.302	1.540	50	20	IDGD	
CCC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2	1802133299	YSRAWHQIEAKYQI-AIEDFZFUSA-N	435.924	1.804	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc2c(c1)CCCO2	1803526710	UZHZVHVVTOEWGU-BCDXTJNWSA-N	449.511	1.576	50	20	IDGD	
Cn1ccc(CC(=O)N2CC[C@H](CNC(=O)CCBr)[C@@H]2c2cccnc2)n1	1806340323	BYWCWOCPTIJADZ-BEFAXECRSA-N	434.338	1.849	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)C2CC3(CCC3)C2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807366849	HPZXKBLTMHCIMP-DENIHFKCSA-N	447.344	1.661	50	20	IDGD	
O=C1NCCCn2nc(C(=O)N3CC[C@H](CNC(=O)[C@@H](F)Cl)[C@@H]3c3cccnc3)cc21	1808314560	YPVNPPTWIDJICC-XOKHGSTOSA-N	448.886	1.266	50	20	IDGD	
Cc1cccc(C(=O)N2CCC3(CCCN(C(=O)c4ccc(B(O)O)cc4)C3)CC2)c1F	1809967477	JAFUAPKMIVEDCY-UHFFFAOYSA-N	438.308	1.973	50	20	IDGD	
O=C(C[C@H]1CCCCO1)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1	1809968824	GDCHYDJUTGSNEL-HXUWFJFHSA-N	428.338	1.170	50	20	IDGD	
CCc1cc(C(=O)N2CCC3(CCCN(C(=O)c4ccc(B(O)O)cc4)C3)CC2)cc(C)n1	1809972023	IUUBLZVRSYYCOA-UHFFFAOYSA-N	449.360	1.791	50	20	IDGD	
CC1(C(=O)N2CC[C@H](CNC(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)CCC1	1810293738	GTEXMVRMINLXHP-APWZRJJASA-N	436.516	1.590	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@H]1c1cccnc1)c1ccnnc1O	1811231123	XRGOMPJTZOELJQ-UBHSHLNASA-N	438.257	1.587	50	20	IDGD	
C=CCC(F)(F)C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1812667539	FLIFRCKQNMRFMW-IEBWSBKVSA-N	443.259	1.292	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)COc2cccnn2)[C@@H]1c1cccnc1	1813391436	MPGMTBSNIXSQRM-JOQOYGCGSA-N	448.321	1.740	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)CN3CCOCC3)sc2C1	1814572318	KMDYSRZRYRUIRI-VXGBXAGGSA-N	445.383	1.561	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2Cc3ccccc3CN2)[nH]n1)[C@@H](O)CCl	1814870356	PWLSOWCHDCQQOQ-BZSNNMDCSA-N	431.924	1.716	50	20	IDGD	
CC(C)(CCl)C(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1	1815335590	GTDSCZDRQZVFTB-ZDUSSCGKSA-N	435.742	1.314	50	20	IDGD	
COCCOCCOCCC(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](F)Cl)sc2C1	1817133431	FRXBLYWENBSSRD-IAQYHMDHSA-N	437.921	1.659	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc([N+](=O)[O-])[nH]2)n[nH]1	1820368507	PFKAMKZXGBCPKI-CQSZACIVSA-N	446.468	1.325	50	20	IDGD	
CN(CC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@](C)(Cl)CCl)n[nH]1)C(=O)C(=O)O	1820869499	WFLNWLYYTXUJCW-PIGZYNQJSA-N	448.307	1.181	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](C)n2cnnn2)[nH]n1	1822092713	UEUQXGFSYJPQBY-MDZLAQPJSA-N	439.318	1.823	50	20	IDGD	
Cn1cc(CC(=O)N[C@@H]2CCc3nc(NC(=O)[C@@H](F)Br)sc3C2)cn1	1823014375	VHSVWVYGRAULLF-NOZJJQNGSA-N	430.303	1.722	50	20	IDGD	
Cc1nn(C)c(C)c1C(=O)N1CCCC[C@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1	1824695218	CXFGJSUBEPNCDA-IBGZPJMESA-N	446.596	1.643	50	20	IDGD	
O=C([C@@H](O)CCl)N1CCC([C@@H]2CCCCN2C(=O)C(F)(F)C(F)(F)C(=O)O)CC1	1824865611	GUHKOWDNCGTWKU-RYUDHWBXSA-N	446.825	1.561	50	20	IDGD	
Cc1cc(C)n(CC(=O)N2CCCC[C@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)n1	1825244625	HQFOFLRXOTWJRV-FQEVSTJZSA-N	446.596	1.493	50	20	IDGD	
CN[C@H](CC(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@](C)(Cl)CCl)CC1)C(=O)O	1826946806	ZTWFVDQRILSQLA-VCBZYWHSSA-N	436.380	1.905	50	20	IDGD	
CC(C)O[C@H](C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827057595	KQADPMAUJJAVFH-UTKZUKDTSA-N	430.354	1.413	50	20	IDGD	
O=C(c1ncccc1F)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827058262	WFYSMPWVVDCOAQ-FQEVSTJZSA-N	439.296	1.448	50	20	IDGD	
CN1CCN(CC(=O)N2CCCC[C@H]2C2CCN(C(=O)CO[Si](C)(C)C)CC2)CC1	1828442817	FHMLKIRTQNNNHM-FQEVSTJZSA-N	438.689	1.705	50	20	IDGD	
COc1cccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)n1	1830359191	WEYVLNJQCCPYNV-FQEVSTJZSA-N	425.913	1.425	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3nccs3)C2)C1	1830537085	BFNGRCBQGBSRCQ-MLGOLLRUSA-N	432.340	1.244	50	20	IDGD	
O=C(c1csc2c1CCCC2)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1830731073	HPVLYFSNQHKIDA-OXQOHEQNSA-N	442.965	1.297	50	20	IDGD	
Cc1cccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)n1	1830921202	LQOPGJSEWJEBKF-PMACEKPBSA-N	444.359	1.625	50	20	IDGD	
C[C@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H](F)Br)CC1)n1cnnn1	1832293684	LGFMSIYUUXAPND-BNOWGMLFSA-N	431.310	1.544	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](C)n3ccnc3)CC2)CC1	1833378887	WLPJVTHJVHTIQR-QAPCUYQASA-N	425.961	1.270	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)c1cc(O)nc(Cl)c1	1833991445	YKZNWNFZEAZOIF-OAHLLOKOSA-N	445.347	1.226	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)NC1CCN(C2CCN(C(=O)C(C)(C)CCl)CC2)CC1	1835120573	AVRQVQPPWDJFBO-OAHLLOKOSA-N	429.005	1.690	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3ccc4nncn4c3)CC2)CC1	1835584324	QJSGEQNVRPLOGQ-SFHVURJKSA-N	432.956	1.932	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1Cc3ccccc3CN1)CCO2	1836498932	OOSQDTKHUAOPEP-MIZPHKNDSA-N	449.979	1.565	50	20	IDGD	
C=CC[C@@H](C(=C)C)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCBr)C2)C1	1837305819	KFLCKIFAJIFDPC-QFBILLFUSA-N	429.355	1.996	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(CC)nn3C)CCO2)C1	1838038917	LKGWDIJIFSBPFR-OXJNMPFZSA-N	426.945	1.460	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)CCN3CCOC3=O)CC2)CC1	1838272513	CVASUNNLCPQFLE-KRWDZBQOSA-N	445.944	1.081	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cc(OC)ccn3)CC2)CC1	1838464637	VRVSYYILMKFTCA-SFHVURJKSA-N	439.940	1.956	50	20	IDGD	
CCOC(=O)C(C)(C)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](Cl)COC)CC2)CC1	1838787037	UMQSCHHFBDMPSU-KRWDZBQOSA-N	446.972	1.828	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc(N)s3)C2)C1	1839152136	OWDDZCKPXPLFEM-CVEARBPZSA-N	437.349	1.032	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)C3CCSCC3)C2)C1	1839156257	JWNBBJJWYQUBMV-MSOLQXFVSA-N	439.405	1.822	50	20	IDGD	
Cc1ccc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)cn1	1839197534	AHNVGLWNUNZJNI-SJLPKXTDSA-N	444.301	1.079	50	20	IDGD	
Cc1cc(C#N)cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)c1	1839452509	FSQONPMQYBXYOE-JOCHJYFZSA-N	445.592	1.788	50	20	IDGD	
O=C(c1cnn2cccc(F)c12)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1839619054	PVKCWNFINYQPJY-CRAIPNDOSA-N	428.823	1.078	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H]3C[C@H]4CC[C@@H]3O4)CCO2)C1	1840050325	FYJGGQQQYKYTDK-GVYRHCHYSA-N	435.348	1.247	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc4ncccc34)C2)C1	1840152621	NRLKXYQTSNXGAR-AVRDEDQJSA-N	447.919	1.559	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3ccc(F)cc3)C2)C1	1840155499	DMYVKUIPBXHLNX-GHTZIAJQSA-N	442.915	1.469	50	20	IDGD	
O=C(COc1ccc(O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840186646	BZVUKCXZMPRUFQ-GOSISDBHSA-N	433.288	1.031	50	20	IDGD	
Cc1cc(F)ccc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)Br)C2)C1	1840778650	FMZJUPMMJUUIGP-LIRRHRJNSA-N	443.313	1.988	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC12CN(C(=O)C(F)(F)C(F)(F)C(=O)O)C2	1841285910	XKMIZERLVBJVKF-MRVPVSSYSA-N	433.196	1.576	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)C(C)(C)C(C)=O)C1	1841512316	LLARPXPHEBIAPT-UHFFFAOYSA-N	431.445	1.952	50	20	IDGD	
O=C(c1cccc(-c2cnco2)c1)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843011864	DHWSBLOHNIODRJ-UHFFFAOYSA-N	431.257	1.152	50	20	IDGD	
O=C([C@H]1[C@H]2c3ccccc3S[C@H]21)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843014279	TVYIDGHMSZUTFQ-HSALFYBXSA-N	434.326	1.071	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1cc(C#N)ccc1F)C2	1843416692	OUOOQURENKKVQH-VULFUBBASA-N	436.447	1.648	50	20	IDGD	
COc1ccc2nc(C(=O)N3CCCC34CN(C(=O)CCC(=O)NN(C)C)C4)ccc2c1	1843747894	DGFMVCQVZNMTQS-UHFFFAOYSA-N	439.516	1.433	50	20	IDGD	
Cc1cc(Cl)ccc1C(=O)N1CC2(CCCN2C(=O)c2cnccc2C(=O)NN)C1	1844263255	KMABTULOSCFAQN-UHFFFAOYSA-N	427.892	1.778	50	20	IDGD	
Cc1cccc(Cl)c1C(=O)N1CC2(CCCN2C(=O)c2cnccc2C(=O)NN)C1	1844264880	URGNPFDWQQQQKK-UHFFFAOYSA-N	427.892	1.778	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)c1cnc(C)nc1)C2	1844692066	BUOXFUVXIOIZQE-UHFFFAOYSA-N	439.428	1.749	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)c2ccc(Cl)c(Cl)c2)C1	1844905257	GVNCJUYYBJVKRZ-UHFFFAOYSA-N	433.100	1.804	50	20	IDGD	
Cc1[nH]ccc1C(=O)N1CC2(CCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)C1	1845038821	XEKONFGVUNQOLP-UHFFFAOYSA-N	438.532	1.486	50	20	IDGD	
CC(C)(C)OC(=O)N[C@]1(C(=O)N2CC3(CCCN3C(=O)C(Cl)Cl)C2)CCOC1	1846388584	ZEGJXJJPUUNYEL-GOSISDBHSA-N	436.336	1.677	50	20	IDGD	
COc1ccc([C@@H](O)C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](C)CBr)cc1	1847392475	SFESQSJZINKDIC-ISWURRPUSA-N	425.323	1.961	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)C1CCN(c2ccccc2)CC1	1847523796	JOSBBEAABWNVLB-SFTDATJTSA-N	441.576	1.478	50	20	IDGD	
O=C(Cc1cccc2ccccc12)NNC(=O)Cn1c(=O)ccn(Cc2ccccc2)c1=O	9894600	XYJLVAKWKLLUHF-UHFFFAOYSA-N	442.475	1.602	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)C[C@H](NC(N)=O)c1ccccc1	11742001	LJGSHYYKXLHTAK-HNNXBMFYSA-N	448.863	1.453	50	20	IDGD	
C[C@H]1Cc2cc(C(=O)NNC(=O)c3cc(-c4ccccc4)n[nH]3)ccc2N1S(C)(=O)=O	14805858	NEUXCBKRHSWABQ-ZDUSSCGKSA-N	439.497	1.862	50	20	IDGD	
O=C(Cc1ccc(Cl)cc1)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	14907274	QKCQLYLXFUJNJJ-UHFFFAOYSA-N	437.905	1.365	50	20	IDGD	
CCCn1c(=O)n(CCC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c2ccccc21	16231235	ZSECJAORRDWGJA-UHFFFAOYSA-N	448.483	1.311	50	20	IDGD	
Cc1nn(Cc2ccccc2)c2sc(C(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)cc12	16785867	DADLKPFDGKHVNR-AWEZNQCLSA-N	432.527	1.650	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COc2ccc(F)cc2)cc1S(=O)(=O)NC1CC1	18101878	ZEYYKRNYRKKFIM-UHFFFAOYSA-N	437.449	1.115	50	20	IDGD	
O=C(COC(=O)c1cccc(CN2C(=O)CNC2=O)c1)NNC(=O)c1ccc(Cl)cc1	25796526	WKSUKFFXDMTZGM-UHFFFAOYSA-N	444.831	1.010	50	20	IDGD	
CSCC[C@@H](C(=O)NNC(=O)c1ccc2c(c1)OCO2)N1C(=O)c2ccccc2C1=O	26964212	ITYPSOCYIYMUMU-HNNXBMFYSA-N	441.465	1.594	50	20	IDGD	
COc1ccc(N2C[C@@H](C(=O)NNC(=O)c3ccc(OC)c(OC)c3)CC2=O)c(OC)c1	28777346	ZENWCCYEWBSVIX-AWEZNQCLSA-N	443.456	1.535	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@H]1CCCN(Cc2ccccc2)C1	108709622	BFQPPSHQKXYCKK-SFHVURJKSA-N	443.573	1.961	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)c2cn(-c3ccc(C(F)(F)F)cn3)nn2)cc1	725881641	ZXGDYJZVNSFJEO-UHFFFAOYSA-N	435.366	1.563	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)N[C@@H]2CCc3nc(C)nn3C2)cc(OCC)c1OCC	727229338	QGOGTPXWCGEQFN-OAHLLOKOSA-N	446.508	1.742	50	20	IDGD	
CCOc1ccc(C(=O)NNS(=O)(=O)c2sc(NC(C)=O)nc2C)cc1OC	727350765	AHYUFJAOSFTNGB-UHFFFAOYSA-N	428.492	1.441	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)NCc2cccc(C(=O)NCCN(C)C)c2)c2ccccc2n1	727604396	YKQKSCLCZYHJKC-UHFFFAOYSA-N	448.527	1.979	50	20	IDGD	
COc1ccccc1CCC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	728212838	HGYMMJNFTSOJBZ-UHFFFAOYSA-N	432.546	1.707	50	20	IDGD	
CCOCCOc1ccc(Br)cc1C=NNC(=O)[C@@H](C)NS(C)(=O)=O	728434910	RMQHLQXBVHPUOA-LLVKDONJSA-N	436.328	1.252	50	20	IDGD	
CC(C)[C@@H](C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)S(=O)(=O)C1CCCCC1	728463870	KCBVNKWMJMJWJV-KRWDZBQOSA-N	444.575	1.623	50	20	IDGD	
CN(C)CCCOc1ccc(CNC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1	728602614	JDZPYIJPGLPYHN-HXUWFJFHSA-N	428.489	1.688	50	20	IDGD	
COc1ccc(-n2cnnc2SCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cn1	728791931	AVWAEKYKWOFTDI-UHFFFAOYSA-N	429.418	1.132	50	20	IDGD	
CN(CCCNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)c1ccccc1F	728948538	CRSUXAMLUWOHLY-UHFFFAOYSA-N	429.500	1.689	50	20	IDGD	
C[C@H]1CN(C(=O)c2ccc(CNC(=O)NNC(=O)c3cccc(C#N)c3)cc2)C[C@@H](C)O1	728953620	SIJCSSLEFRZGMZ-IYBDPMFKSA-N	435.484	1.952	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1sc(-c2ccco2)nc1-c1ccccc1	729275131	LPPUDGNXEYQDEH-NSHDSACASA-N	434.499	1.769	50	20	IDGD	
COc1cc(C)cc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1O	730103768	JGEUCXJBTGMBQB-UHFFFAOYSA-N	433.486	1.569	50	20	IDGD	
CCCN(C)CC(=O)NNC(=O)c1ccc(CN(C)S(=O)(=O)c2ccc(C)cc2)cc1	730272314	CERZDHDCROISCF-UHFFFAOYSA-N	446.573	1.919	50	20	IDGD	
O=S(=O)(NCCS(=O)(=O)N1CCSCC1)c1ccc(CCCCl)cc1	730574632	UUUUTXCBZPJRDI-UHFFFAOYSA-N	427.013	1.515	50	20	IDGD	
NC(=O)[C@H]1CCCN(Cc2cccc(CNC(=O)NNC(=O)Cc3ccc(F)cc3)c2)C1	731118540	UKESFZZRTMTCAY-IBGZPJMESA-N	441.507	1.596	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)[C@@H](CC(C)C)/N=C1/NS(=O)(=O)c2ccccc21	731494165	RECNBMKVQHFMAP-MRXNPFEDSA-N	444.513	1.610	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)N1CCN(C(=O)Cc2c[nH]c3ccccc23)CC1	731499611	XRDLCINKUKOKGF-UHFFFAOYSA-N	435.484	1.918	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)N1CCN([C@H](C)c2nc(-c3ccccc3)no2)CC1	731848300	HTQXZNHDPUUAOD-DLBZAZTESA-N	428.537	1.997	50	20	IDGD	
CCN(CC(=O)Nc1ccc(N2CCOCC2)cc1)[C@@H](C)C(=O)NNC(=O)CC(C)C	732195113	HDSFUPJIIPPKGU-KRWDZBQOSA-N	433.553	1.366	50	20	IDGD	
Cn1cc(S(=O)(=O)N2CCCCC2)cc1C(=O)NNc1ccccc1S(C)(=O)=O	732303379	HLGNSLVXWZPVGT-UHFFFAOYSA-N	440.547	1.360	50	20	IDGD	
Cc1nn([C@H]2CCS(=O)(=O)C2)c(C)c1C=NNC(=O)NCCNC(=O)OC(C)(C)C	734303812	GSUNNUKYJRELNA-AWEZNQCLSA-N	442.542	1.017	50	20	IDGD	
O=C(COC(=O)CCN1C(=O)CCc2ccccc21)NNC(=O)c1cccc([N+](=O)[O-])c1	738871659	LOFNCGQHCMYRFH-UHFFFAOYSA-N	440.412	1.269	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCN(C(=O)c3cc4occc4s3)CC2)n1	741255819	MBRWSBJHGHETPQ-UHFFFAOYSA-N	447.542	1.407	50	20	IDGD	
CNS(=O)(=O)c1cccc([C@@H](C)NC(=O)NNC(=O)Nc2ccc(N(C)C)cc2)c1	745800819	PKDNOHQJJVRGEV-CYBMUJFWSA-N	434.522	1.758	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@@H]2C[C@@]2(C)c2ccccc2)cc1	745858140	XYOAIDZFFDRZEW-NQIIRXRSSA-N	430.530	1.676	50	20	IDGD	
CSCC[C@H](C(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)N1C(=O)[C@@H]2CCCC[C@H]2C1=O	746022142	ABTBECRFWLSMRV-BZUAXINKSA-N	448.501	1.653	50	20	IDGD	
Cc1ccc(-n2[nH]c(C(=O)NNC(=O)c3nn(C(C)C)c(=O)c4ccccc34)cc2=O)cc1	746096694	KWOFEOISKVMJNO-UHFFFAOYSA-N	446.467	1.840	50	20	IDGD	
O=C(Cn1nc(Br)nc1Br)NNC(=O)c1ccc(Cl)cc1	746138771	RFJXVCYAXGUIPV-UHFFFAOYSA-N	437.479	1.918	50	20	IDGD	
O=C(NNc1ccc(Br)cc1F)[C@@H]1CC(=O)N([C@H]2CCS(=O)(=O)C2)C1	748171494	RXWUZAJWTKSMCA-KOLCDFICSA-N	434.287	1.067	50	20	IDGD	
Cn1c(=O)n(C)c2nc(NC(=O)CCC(=O)NNc3ccc(OC(F)F)cc3)ccc21	748649177	JQJRHRSEERMGAC-UHFFFAOYSA-N	434.403	1.735	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCC[C@H](CNC(=O)c3ccccc3)C2)n1	748835830	MNUZPQHPXRDSPF-MRXNPFEDSA-N	429.546	1.283	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)CNC(=O)c2cc(-c3ccccc3)on2)nc2ccccc21	749720099	WFLVSYIFMOWJEA-UHFFFAOYSA-N	432.440	1.348	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)N[C@@H]1CCN(CCCc2ccccc2)C1=O	750269098	VAHHYKAIHZYDMK-GOSISDBHSA-N	434.500	1.820	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)c2cccc(CN3CCS(=O)(=O)CC3)c2)c1	751290507	MUBYOYGTJXRHLB-UHFFFAOYSA-N	445.541	1.374	50	20	IDGD	
O=C(NNC(=O)N1CCC(CCCN2CCCC2)CC1)c1ccc(-n2cnnn2)cc1	752127572	SIFYVPCELKXWIV-UHFFFAOYSA-N	426.525	1.605	50	20	IDGD	
CSC[C@H](C(=O)NNc1nc2ccccc2c(=O)n1C)N1C(=O)[C@@H]2CCCC[C@H]2C1=O	752906420	ITWPADVZGSVRIQ-XJKCOSOUSA-N	443.529	1.283	50	20	IDGD	
C[C@H]1C[C@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)CN1C1CC1	753942869	IDFNUQCJHGMNNF-RDJZCZTQSA-N	449.577	1.430	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN(C)CCN2C(=O)c3ccccc3C2=O)cc1C	754362345	CBKHQVKAHGYNIU-UHFFFAOYSA-N	428.514	1.608	50	20	IDGD	
CNS(=O)(=O)c1cc(NC(=O)NNC(=O)c2nnc(O)c3ccccc23)ccc1C	755514656	JDKZGXITXAXBLT-UHFFFAOYSA-N	430.446	1.018	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)Nc1ccccc1C(=O)N1CCOCC1	755622944	KYGTUURZOZMYMM-AWEZNQCLSA-N	430.436	1.918	50	20	IDGD	
CCn1c(SCC(=O)NN=Cc2cnc(N3CCN(C)CC3)nc2)nc2ccccc21	755779086	ICRNRDFVGRIJOD-UHFFFAOYSA-N	438.561	1.840	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2ccc3c(c2)OCCO3)c(Cl)cc1F	755956429	WUYDHSBUZNAWOD-UHFFFAOYSA-N	444.824	1.660	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)Nc2cc(C3CC3)nn2[C@H]2CCS(=O)(=O)C2)cc1	756857868	XEMUQACVUIESLV-HNNXBMFYSA-N	428.474	1.458	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2cc(OC)c(OC)cc2OC)c2ccccc2c1=O	757719657	BCMPUBHXHTYIEF-UHFFFAOYSA-N	441.444	1.909	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)Nc1cnn(-c2ccc(C(F)(F)F)cc2)c1	757747166	GJHSMUFFFQPQRZ-JTQLQIEISA-N	431.396	1.479	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)c1ccc(Br)cc1-n1cncn1	758054902	NPMQMFXWUCPENZ-MRXNPFEDSA-N	444.245	1.631	50	20	IDGD	
COc1ccc(C[C@H](C)CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1	758651567	OVAXEOTWBPFUPZ-AWEZNQCLSA-N	433.534	1.811	50	20	IDGD	
COc1cccc2c1CC[C@@H]2NC(=O)NNC(=O)c1sc(N2CCOCC2)nc1C	759718767	PLQOAMRLUUGXOA-HNNXBMFYSA-N	431.518	1.928	50	20	IDGD	
CN(C(=O)/C(C#N)=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)[C@H]1CCNC1=O	760118869	MPUGXAHNDZGKNK-QXSWTLKVSA-N	440.891	1.333	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(Br)c(F)c1	763468842	UWTLBLSOZXKOCK-UHFFFAOYSA-N	425.170	1.896	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)[nH]n1)C(=O)Nc1ccc(Br)nc1	763600016	COITWABHPPNCTQ-UHFFFAOYSA-N	429.234	1.634	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2cccnc2N2CCCCC2)c1	763647458	NKKQGEWIJWGYLY-UHFFFAOYSA-N	425.489	1.854	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccn(-c3ccccc3Cl)n2)c1	763761054	ZONWZSSBRASSPS-UHFFFAOYSA-N	426.864	1.991	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2ccc(O[C@H]3CCOC3)cc2)c1	763772878	PRQCBNCWNANMSC-INIZCTEOSA-N	429.429	1.271	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2cc(C(=O)NC3CC3)ccc2C)c1	763773435	XMLYZCQZIRVASX-UHFFFAOYSA-N	440.456	1.304	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1cccc(Cn2cccn2)c1	763873631	WTUFGRDXANDDNM-AWEZNQCLSA-N	425.420	1.624	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2nn(-c3ccccc3)cc2C)cc1	763878594	RPOOJKIHPPGQOD-MRXNPFEDSA-N	449.467	1.937	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@@H](C)C(=O)NNC(=O)C(=O)Nc1cnc(N(C)C)nc1	763882631	KHIPASKPCSPIOJ-LBPRGKRZSA-N	434.884	1.366	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)C(=O)Nc1ccccc1Cc1ccccc1	763916944	KZZZSOTZZWZLID-UHFFFAOYSA-N	441.451	1.653	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2cc(C(=O)N(C)C)ccc2C)cc1	764131650	LSRVNYXOPGOJRV-UHFFFAOYSA-N	426.473	1.424	50	20	IDGD	
COc1cc2nc(C)sc2cc1NC(=O)C(=O)NNC(=O)[C@@H]1Cc2ccccc2O1	764168468	PGDYASLSEXKUOC-INIZCTEOSA-N	426.454	1.703	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3CN2Cc2ccccc2)cnn1C	764178698	GPVBCUBCQRKYMW-NRFANRHFSA-N	446.511	1.442	50	20	IDGD	
CCOc1cc(N2CCN(C)CC2)ccc1NC(=O)C(=O)NNC(=O)CC1CCCC1	764187139	DHRGPAIGETUXJV-UHFFFAOYSA-N	431.537	1.503	50	20	IDGD	
COc1ccc(I)c(NC(=O)C(=O)NNC(=O)CCC(C)C)c1	764199801	WSEFTYADPOAQJX-UHFFFAOYSA-N	433.246	1.822	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)cc(OC)c1OC	764239756	SFIRDGZFHJPQLV-UHFFFAOYSA-N	426.429	1.453	50	20	IDGD	
Cc1ncsc1C(=O)NNC(=O)C(=O)Nc1ccn(-c2ccc(Cl)cc2C#N)n1	764246411	HMVWJJLMAVDTAP-UHFFFAOYSA-N	429.849	1.562	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C(=O)Nc1ccc(N2C[C@@H](C)O[C@H](C)C2)nc1)c1ccccc1	764328319	OTPOMOSQBORMBJ-MDZRGWNJSA-N	439.516	1.975	50	20	IDGD	
Cc1cc(Br)ncc1NC(=O)C(=O)NNC(=O)c1cnn(-c2ccccc2)c1	764346128	UJYOXNSNFCPGKL-UHFFFAOYSA-N	443.261	1.738	50	20	IDGD	
CCOC(=O)c1cc(C)sc1NC(=O)C(=O)NNC(=O)C(F)(F)Oc1ccccc1	764369386	DLVWUQAFEULFNZ-UHFFFAOYSA-N	441.412	1.991	50	20	IDGD	
CCOC(=O)c1c(C)csc1NC(=O)C(=O)NNC(=O)C(F)(F)Oc1ccccc1	764378059	IOBLVIRYFKTEQK-UHFFFAOYSA-N	441.412	1.991	50	20	IDGD	
N#CCCCOc1cccc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)c1	764405660	WENSFPLASJJSPM-UHFFFAOYSA-N	428.470	1.953	50	20	IDGD	
O=C(NNC(=O)[C@H]1COCCO1)C(=O)Nc1ccc(Cc2nc3ccccc3s2)cc1	764433782	NTOCUFXWSVJXKX-MRXNPFEDSA-N	440.481	1.388	50	20	IDGD	
C[C@H](Cn1ncc2ccccc2c1=O)NC(=O)NNC(=O)COc1ccccc1[N+](=O)[O-]	764459286	KUKWKFVWTHDUHP-CYBMUJFWSA-N	440.416	1.103	50	20	IDGD	
CC(=NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1)c1scnc1C	764817380	OYLOXECKFHCYPL-UHFFFAOYSA-N	435.575	1.607	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)CCN3C(=O)NC4(CCCC4)C3=O)n[nH]2)cc1	765572042	ULNVYOHHXYKWOS-UHFFFAOYSA-N	438.488	1.655	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)c1ccc2c(c1)nc(O)n2CC(F)(F)F	765757345	CXRLLIHAAWOZFF-UHFFFAOYSA-N	432.362	1.956	50	20	IDGD	
O=C(NNc1ncnc2ccsc12)[C@@H]1CCCN1S(=O)(=O)c1cccc([N+](=O)[O-])c1	766674373	SDURNHYAHGTKBI-AWEZNQCLSA-N	448.486	1.896	50	20	IDGD	
COc1ccc(NNC(=O)c2ccc(OC)c(S(=O)(=O)NC3CC3)c2)c([N+](=O)[O-])c1	768332741	SNYJFDUTGVDYCB-UHFFFAOYSA-N	436.446	1.810	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)[C@@H]1CC(=O)N(Cc2ccc(C)cc2)C1	768612554	ORGIAZDGNVINPK-MRXNPFEDSA-N	431.514	1.899	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)[C@@H](c1ccccc1)N1CCN(C)CC1	768627671	CIMQYJMZTWHGAZ-HXUWFJFHSA-N	432.546	1.531	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2ccc3c(c2)C(C)(C)C(=O)N3)cc1	768931016	UEVQRSWGWCPYOR-UHFFFAOYSA-N	444.513	1.306	50	20	IDGD	
CSCC[C@@H](NC(=O)NNc1nc(O)c2cnn(C)c2n1)c1nnc2ccccn12	770343009	XXOVHIHGTKYAKN-LLVKDONJSA-N	428.482	1.232	50	20	IDGD	
CCN1CCN(c2cccc(NC(=O)C(=O)NNC(=O)c3cccc4ncccc34)c2)CC1	770770759	BUMCKHLEXRGVGC-UHFFFAOYSA-N	446.511	1.776	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1ccc(C(N)=O)cc1)C(=O)NNc1nc(C(F)(F)F)cs1	771037044	YHDGHPPQFNGWFQ-SSDOTTSWSA-N	437.425	1.071	50	20	IDGD	
O=C(NNc1ccnc(Br)c1)C1CCN(S(=O)(=O)c2cccnc2)CC1	771534452	FYYLLANTOQJYIG-UHFFFAOYSA-N	440.323	1.783	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)c1cc([N+](=O)[O-])cc(S(C)(=O)=O)c1	772954136	PGJZLVMKMDSWIR-SNVBAGLBSA-N	441.849	1.880	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNS(=O)(=O)c1ccc(OCC(=O)O)cc1	773263813	HXZGYTIRKODDQD-NSHDSACASA-N	428.850	1.580	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(C(F)(F)F)cn2)cc1	773531319	YQVSOZZTHOFUOT-NSHDSACASA-N	438.362	1.856	50	20	IDGD	
CCCS(=O)(=O)Nc1cccc(NC(=O)C(=O)NNc2cnc3ccccc3n2)c1	773719546	VUGVZGVTMXVRLU-UHFFFAOYSA-N	428.474	1.863	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(-c3nnnn3C(C)C)c(F)c2)cc1F	773889456	RFTBSRMLSUYSTP-UHFFFAOYSA-N	443.414	1.907	50	20	IDGD	
CN(C)C(=O)[C@@H]1CC[C@@H](CNC(=O)NNC(=O)c2ccc(COc3ccccc3)o2)O1	774659299	NGEDZQCZOFKNCZ-YJBOKZPZSA-N	430.461	1.438	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)Nc1ccc(S(=O)(=O)N2CCOCC2)cn1)c1ccccc1	776061608	MMJPOHGKIMGPBZ-QGZVFWFLSA-N	447.517	1.449	50	20	IDGD	
CSC[C@H](C(=O)NNc1cccc(S(C)(=O)=O)c1)N1C(=O)[C@@H]2CCCC[C@H]2C1=O	776537353	CAGDQAFPRCWZHB-BZUAXINKSA-N	439.559	1.440	50	20	IDGD	
Cn1cc(C=NNC(=O)Cc2csc(N3CCOCC3)n2)c(-c2ccc(C#N)cc2)n1	777879036	GRPXPTHXRCBGTR-UHFFFAOYSA-N	435.513	1.945	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)c1cc(S(=O)(=O)N(C)C)cn1C	778531899	MAFSOPFRKLGYKA-AWEZNQCLSA-N	444.513	1.657	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)c2ccc(S(=O)(=O)N=c3cc[nH]cc3)cc2)c1	780795893	HDHOVDTUUUIEQL-UHFFFAOYSA-N	426.454	1.848	50	20	IDGD	
CC(C)C[C@@H](CN(C)S(=O)(=O)CBr)NS(=O)(=O)CBr	782475472	HKBSEBBAROYMOC-VIFPVBQESA-N	444.211	1.287	50	20	IDGD	
O=C(CCCc1ccsc1)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	783029188	WLVUQTLPPPRNOS-UHFFFAOYSA-N	437.543	1.553	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)C(=O)N2CCc3c(Cl)cccc32)nc1	783264983	VFPXHXWTKPSMIC-UHFFFAOYSA-N	437.909	1.454	50	20	IDGD	
COC(=O)CNC(=O)Cc1ccc(NC(=O)C(=O)NNc2c(C)cc(C)cc2C)cc1	783370209	WQUVOXUTGOEZII-UHFFFAOYSA-N	426.473	1.525	50	20	IDGD	
CCOC(=O)[C@@H](Cc1ccccc1)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1	783575211	VEGXXKFUQUQJQO-LJQANCHMSA-N	433.530	1.411	50	20	IDGD	
CCN(CC)C(=O)COc1cccc(NC(=O)C(=O)NNc2cccc([N+](=O)[O-])c2)c1	784833146	JGPONDKPPRIGSW-UHFFFAOYSA-N	429.433	1.924	50	20	IDGD	
N#Cc1ccc(NNC(=O)C(=O)Nc2ccc(N3CCNC(=O)C3)c(Cl)c2)cc1Cl	785094714	HJHFLGJQYIYHBJ-UHFFFAOYSA-N	447.282	1.883	50	20	IDGD	
COc1ccc([C@@]2(C)NC(=O)N(NC(=O)COC(=O)/C(C#N)=C\c3ccccc3)C2=O)cc1	785365828	MOQUTKZCLLCUKF-UKQURCRRSA-N	448.435	1.644	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NCc3cccc4cc[nH]c34)nc2)CC1	786259229	NEYXIAWSBHWQOD-UHFFFAOYSA-N	443.533	1.325	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)CCOc1cccc(I)c1	787247722	LGAYQWAOUJMQAV-JTQLQIEISA-N	434.230	1.549	50	20	IDGD	
CN1CCN(C(=O)NNC(=O)[C@@H](Cc2ccccc2)NC(=O)OCc2ccccc2)CC1	788166719	RCUVIOLLZGRJSD-HXUWFJFHSA-N	439.516	1.512	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)cnc1Br	788512358	IWVCNRCAIKVWDR-UHFFFAOYSA-N	432.275	1.321	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)cc1	788916484	OWSABQOVIYUNTF-UHFFFAOYSA-N	440.522	1.687	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)C(C)(C)S(=O)(=O)C1CC1	792634358	SSOXQRHLRHRMSU-UHFFFAOYSA-N	432.882	1.009	50	20	IDGD	
CCOC(=O)c1nn(C)cc1/C=C(/C#N)C(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1	792865158	BIXSCKVQHXIGIY-QINSGFPZSA-N	438.444	1.761	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)c1cnn(CCO)c1-c1ccccc1	793770318	BIBHIMVMBSJSNA-UHFFFAOYSA-N	441.875	1.273	50	20	IDGD	
COc1cc(C)nc(NNC(=O)C2(n3cccn3)CCN(C(=O)OC(C)(C)C)CC2)n1	796880926	XIPDNJNGRZHMGZ-UHFFFAOYSA-N	431.497	1.860	50	20	IDGD	
CN(CCNC(=O)NNC(=O)c1cccc(Cl)c1)S(=O)(=O)c1ccc(F)cc1	798098294	VYYSVLNZCKZYJJ-UHFFFAOYSA-N	428.873	1.744	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNc2ncncc2Cl)(S(C)(=O)=O)CC1	803152924	MIWKPKOIHKWBTH-UHFFFAOYSA-N	433.918	1.387	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)Nc2cccc(C(=O)N(C)CC(N)=O)c2)c1C	803705751	NIVUPDFJCFSTAP-ODLFYWEKSA-N	437.500	1.854	50	20	IDGD	
COc1ccccc1O[C@H]1CCCN(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)C1	804869137	URFNZMPQQHPVDG-KRWDZBQOSA-N	437.460	1.569	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)N=c3ccnc4n(C)[nH]cc3-4)n[nH]2)cc1OC	806490783	MHYATCGRHAOFSC-UHFFFAOYSA-N	436.432	1.216	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@H](C)C(=O)NNC(=O)C(=O)N=c1ccnc2n(C)[nH]cc1-2	806974506	CLYAFODPMWTPQY-GFCCVEGCSA-N	444.879	1.165	50	20	IDGD	
CCOC(=O)C(C)(C)c1csc(NC(=O)C(=O)NNC(=O)Cc2ccc(F)cc2)n1	806975818	PQQWLMFMKCCRTP-UHFFFAOYSA-N	436.465	1.452	50	20	IDGD	
O=C(Cc1cc[nH]n1)NNC(=O)C(=O)Nc1nc(CC23CC4CC(CC(C4)C2)C3)cs1	806979198	VRNANUZADPFLLP-UHFFFAOYSA-N	442.545	1.954	50	20	IDGD	
COC(=O)c1scc(-c2ccc(C)cc2)c1NC(=O)C(=O)NNC(=O)c1c[nH]nc1C	806980532	YGHIKPMKEBKCGW-UHFFFAOYSA-N	441.469	1.941	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)[C@](N)(c1cccc(F)c1)C(F)(F)F	807175909	XASFCWGHWDOREX-QGZVFWFLSA-N	436.406	1.994	50	20	IDGD	
NS(=O)(=O)c1ccccc1CNC(=O)NNC(=O)CSc1ccc(Cl)cc1	807606199	ZDRMMKOOSDVEGR-UHFFFAOYSA-N	428.923	1.610	50	20	IDGD	
Cc1nc(S(=O)(=O)NNC(=O)Cn2ccc3ccccc32)c(Br)n1C	808088664	KXJLYCBWOSBLFU-UHFFFAOYSA-N	426.296	1.455	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccccc1C(F)(F)F)NNC(=O)Cc1ccccc1F	810372817	KPKPXNYGDOHGFS-UHFFFAOYSA-N	433.383	1.513	50	20	IDGD	
Cc1nc2ccc(NC(=O)C(=O)NNC(=O)c3ccc(COc4ccccc4)o3)cn2n1	810384155	FKFCCTJEBRYIBM-UHFFFAOYSA-N	434.412	1.609	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2c(Br)nnn2C)cc1Br	810386553	GNRITMZFISVTCW-UHFFFAOYSA-N	433.060	1.424	50	20	IDGD	
CO[C@@](C)(C(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1)C1CC1	812452320	FDPGOVRJCZIMFX-OAQYLSRUSA-N	431.514	1.741	50	20	IDGD	
Cc1c(COC(C)(C)C)cccc1NC(=O)C(=O)NNC(=O)[C@@H]1CCc2nncn2C1	815691960	GPBUOUXUAWSTPC-CQSZACIVSA-N	428.493	1.250	50	20	IDGD	
Cc1nnc(-c2ccc(NC(=O)C(=O)NNc3ccccc3S(=O)(=O)N(C)C)cc2)o1	815751678	JQRMMVJLNLRHNX-UHFFFAOYSA-N	444.473	1.377	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2ncncc2F)n([C@@H]2CCN(Cc3ccccc3)C2)n1	815764805	VOHBYXXTLZJDHL-MRXNPFEDSA-N	438.467	1.649	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NNC(=O)CNC(=O)Cc2cccc(F)c2)C1	816510047	KXWAWUWZZXILKZ-OAHLLOKOSA-N	436.484	1.279	50	20	IDGD	
O=C(CCCC[C@@H]1SC[C@H]2NC(=O)N[C@@H]21)NNC(=S)NCCc1cccs1	819427711	RCVAUUGPFDTKBG-IPYPFGDCSA-N	427.621	1.512	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)NC[C@@H]2CCCO2)c1)c1ccc([N+](=O)[O-])cc1	912764977	SFQOEOCAEYVETG-INIZCTEOSA-N	448.457	1.127	50	20	IDGD	
CCN1CCC(NC(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)CC1	915903467	SJUHFCASMABCER-UHFFFAOYSA-N	448.531	1.817	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)NCc1ccc(C(=O)N2CCCC2)cc1	916252812	QSIRICOVZLPMOG-UHFFFAOYSA-N	441.444	1.740	50	20	IDGD	
C[C@@]1(NNC(=O)NC[C@@H](c2c(F)cccc2Cl)N2CCCC2)CCS(=O)(=O)C1	916433857	XDRUHLUFMITQMN-MAUKXSAKSA-N	432.949	1.997	50	20	IDGD	
CN(CCCNC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)C(=O)OC(C)(C)C	916580107	WGWBYYPBUONADJ-UHFFFAOYSA-N	432.481	1.135	50	20	IDGD	
Cc1nc2c(C(N)=O)cnn2c(C)c1CCC(=O)NNC(=O)c1cc2c(s1)CCC2	916736285	GNLRBYAJEYDRTD-UHFFFAOYSA-N	426.502	1.389	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)CNC(=O)c1ccc(Br)s1	916737367	YBBMPFGAVFAJPM-UHFFFAOYSA-N	436.291	1.658	50	20	IDGD	
CC(C)[C@H](NS(=O)(=O)c1ccc2c(c1)OCCCO2)C(=O)NNC(=O)C(C)(C)C	917180323	RUWBIQAPDFEODI-INIZCTEOSA-N	427.523	1.344	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1	918219941	RPVYYSVLUIDMFJ-UHFFFAOYSA-N	434.443	1.835	50	20	IDGD	
CNS(=O)(=O)c1ccc([C@@H](C)NC(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)cc1	919779402	RLKVRHBOSJSOGB-CHWSQXEVSA-N	438.481	1.593	50	20	IDGD	
CS(=O)(=O)c1ccc(F)c(S(=O)(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)c1	921295517	QNARMOLVIAMRLI-UHFFFAOYSA-N	430.523	1.755	50	20	IDGD	
CC(C)c1nccnc1NNC(=O)Nc1cccc(S(=O)(=O)N2CCN(C)CC2)c1	1116792194	JWSUAAJWYVGYIS-UHFFFAOYSA-N	433.538	1.685	50	20	IDGD	
Nc1cnnc(NNC(=O)[C@@H]2CCCN(S(=O)(=O)c3ccc(F)cc3)C2)c1Cl	1253124001	NRUJGNQAIKTHPR-SNVBAGLBSA-N	428.877	1.395	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)Cc3ccc(S(=O)(=O)CC(F)(F)F)cc3)nc21	1319881406	ZVFXKZRAMHEQFM-UHFFFAOYSA-N	444.395	1.091	50	20	IDGD	
O=C(NNC(=O)c1n[nH]cc1Br)c1cccc(S(=O)(=O)N2CCCC2)c1	1348374922	UIOXTDJNMIJELA-UHFFFAOYSA-N	442.295	1.032	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3n[nH]c4c3CC[C@@H]4C)C2)C1	1777845138	CVARCYALGIADMC-QUJCMNEKSA-N	439.354	1.934	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C(=O)Nc2cccnc2)C1	1779487937	AMOIESPMVFBHHG-CSODHUTKSA-N	436.940	1.942	50	20	IDGD	
C=CC(=O)N[C@@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)CBr)C2	1779529070	XVJVUZKUXBJCCC-XTDOFWJNSA-N	444.370	1.222	50	20	IDGD	
Cc1cc(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](F)Br)C2)on1	1780770866	HDUWXAWADUWMJG-UKPHBRMFSA-N	432.290	1.730	50	20	IDGD	
C[C@@H]1C[C@@]1(C)C(=O)N1CC[C@@]2(CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2)C1	1781064998	JSPIAJOXZFTRQV-IALDWUNLSA-N	443.972	1.995	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc4c(c3)NC(=O)[C@@H](C)O4)CCO2)C1	1781216709	BCKCVNRUGXYIPJ-CGSMKXTHSA-N	435.908	1.867	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)C#CC3(O)CCCCC3)CCO2)C1	1781230714	YDLJYNHNDHYKRQ-QUCCMNQESA-N	431.360	1.751	50	20	IDGD	
O=C(c1n[nH]c(C2CC2)c1F)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781328007	GJBNSRLKGHSAEG-XJKSGUPXSA-N	433.253	1.560	50	20	IDGD	
Cc1cc(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](C)Br)C2)on1	1781997075	BJWIJXJQCYVKCW-JCKWVBRZSA-N	428.327	1.823	50	20	IDGD	
Cc1cccn2ncc(C(=O)N3CC[C@@]4(C3)CN(C(=O)[C@@H](C)Br)CCO4)c12	1782522106	YJHXPTAUIFMNRV-AUUYWEPGSA-N	435.322	1.870	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2)c1ccc(-c2ncc[nH]2)cc1	1783020636	HLHUXEGRWYZQJC-NJNPRVFISA-N	446.935	1.804	50	20	IDGD	
C=C(C(=O)N1CC[C@@]2(C1)CN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)CCO2)C(F)(F)F	1783205173	NHDZFKHNDOXOTK-QJTDOHDFSA-N	441.410	1.069	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)/C=C3\C(=O)Nc4ccccc43)CCO2)C1	1783877609	LXHFQQGBUFNJLL-HGOAZTOHSA-N	433.892	1.106	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccn4nccc34)C[C@@H]21	1783973229	VHNGDHULAYUSRY-OAOQPFQOSA-N	449.349	1.959	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc4ccccc4c3)C[C@@H]21)[C@H](O)CCl	1784086124	GFIBLSLZOHOFHF-BURNTYAHSA-N	430.932	1.962	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(F)cc(Cl)c3)C2)C1	1785071941	GIYGVLRTIVWEEV-FQEVSTJZSA-N	440.903	1.296	50	20	IDGD	
O=C(CN1C(=O)CNC1=O)Nc1ccc(C2(NC(=O)CCBr)CCC2)cc1	1786639714	MNACNOOMGQYGBZ-UHFFFAOYSA-N	437.294	1.457	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3nc4ccccn4n3)[C@H]2C1	1787263709	QFKLTHOBJRDVMQ-WFTHSTBKSA-N	440.331	1.559	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CN3CCc4sccc4C3)C[C@@H]21)[C@H](F)Cl	1787444078	LXFRRUXPKUCSNL-XSWJXKHESA-N	429.945	1.620	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)c1ccc2nonc2c1	1787882145	NXLJDVJDQXCPTQ-GVARAGBVSA-N	441.257	1.507	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc4[nH]ncc4c3)[C@H]2C1	1788277181	MPNIAHLKYKTMDD-PKIAMQTDSA-N	436.310	1.335	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1(c2ccc(NC(=O)Cn3ccnn3)cc2)CCC1	1788291157	ZCRJTJODZQSLAM-JFLMPSFJSA-N	448.487	1.546	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(N(C)C)nc3)[C@H]2C1	1789026103	CHAFCDCHZZJQKW-OEAJRASXSA-N	439.354	1.524	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@]3(C)C[C@@H]3C)[C@H]2C1	1789778736	PKVKZDLXXVDOPY-WBJBUAFFSA-N	429.521	1.146	50	20	IDGD	
Cc1n[nH]c(C)c1CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)Br)C[C@@H]21	1789976545	CVWBTSNSKSOWPT-AFCVYNCWSA-N	427.343	1.332	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC1(c2ccc(NC(=O)C[C@@](C)(O)CC(=O)O)cc2)CCC1	1791596633	UBSKPFCPSVFBFN-DNVCBOLYSA-N	426.897	1.990	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)Oc3cccnc3)[C@H]2C1	1791654673	XANPENNCFOLAIK-XWJBARJFSA-N	425.913	1.082	50	20	IDGD	
CCN1CCC(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Br)C[C@@H]32)CC1	1792296236	QAPDRVZTRCMZAG-VGWMRTNUSA-N	434.350	1.389	50	20	IDGD	
C[C@H](NNc1ccccc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2	1792507367	VSRPUMNPOJBKMN-AFIMGQEJSA-N	439.354	1.366	50	20	IDGD	
CC(C)(C)OC(=O)CCCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CO[Si](C)(C)C)C2	1793021996	KCRVOKRHYJMAAB-CWPLJXCYSA-N	442.629	1.940	50	20	IDGD	
CCS(=O)(=O)N[C@@H](C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@](C)(Cl)CCl)C2	1793535771	DHSVQLZZNWOGSB-DJUFWWRVSA-N	428.382	1.189	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(N2CCOCC2)cn1)C(Cl)Cl	1794767959	KXFKVADRWPYCHI-BTTYYORXSA-N	427.332	1.974	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)n1cccc1C=O	1795752173	FMQBVKHMMZGMTO-QKDZRIPBSA-N	426.311	1.235	50	20	IDGD	
Cc1ccn2ncc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@@H](F)Br)C4)c2c1	1796273742	WHAKOHNVJAHTPS-NOXHYTERSA-N	439.285	1.536	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnc2ccccc2n1	1796777802	VEPPBUVLIZDSRG-YVWYUNDQSA-N	428.565	1.685	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1c[nH]c3nccc-3c1)C2	1796892207	NKZWAGVDENXLFY-MZHJKJSWSA-N	447.499	1.900	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc3ccnn3c1)C2	1796893708	MEHQFTIWFXRDBF-BECFQBPISA-N	447.499	1.720	50	20	IDGD	
Cc1nc2ncccn2c1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@](C)(Cl)CCl)C2	1797005327	VPUJCXUWNFHXCR-LJPSSGMGSA-N	440.331	1.477	50	20	IDGD	
COC(=O)C12CCC(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@@H](F)Cl)C4)(CC1)CC2	1797265222	ZKJCULXWCPHKFW-MRPNUNQFSA-N	430.904	1.624	50	20	IDGD	
Cc1ccc(SCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)cc1	1797684629	PQESKNGTOPRPMU-ACDBMABISA-N	438.358	1.719	50	20	IDGD	
CCc1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C3)n(C)n1	1798847386	CSRUKOCPTIGEKI-XTUBRDOVSA-N	439.520	1.368	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(F)c(F)cc1F)C2)[C@H](F)Br	1799348451	HEKMFMYANTVWCQ-NVIQENEESA-N	439.203	1.998	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1C[C@H](O)CN1	1799921914	OZEDYIXFUKARKG-PXOJZXEFSA-N	430.455	1.233	50	20	IDGD	
Cc1cc(C(=O)NCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](F)Br)no1	1800158308	JFNUNROGGRPWMU-FBKDDSFISA-N	431.262	1.042	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CC(c2ccccc2)=NN1	1800158718	XTUVNQVWYZROKL-QMQAMEMWSA-N	449.349	1.126	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(OC)n1)C2	1800638899	CEECWSHEZPOJSN-ZWUHOBOKSA-N	426.311	1.467	50	20	IDGD	
C[C@@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C(F)(F)C(F)(F)C(=O)O)C2	1801959751	ZISODATVMJYXNF-LURQLKTLSA-N	433.196	1.763	50	20	IDGD	
Cc1c(C(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)nc2ccccn12	1803139740	UTQXDPZHQVFGFE-UWVAXJGDSA-N	441.919	1.957	50	20	IDGD	
CN1CCC[C@H]1C(=O)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@@H]1c1cccnc1	1803944284	YKMBMHODPSFYDR-JONQDZQNSA-N	427.318	1.872	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@H]1CCN(C(=O)c2ccc[n+]([O-])c2)[C@@H]1c1cccnc1	1810541545	UVNZSBUEJPVSNA-YLJYHZDGSA-N	428.565	1.886	50	20	IDGD	
C[C@H](C(=O)N1CC[C@@H](CNC(=O)CO[Si](C)(C)C)[C@@H]1c1cccnc1)n1cnnn1	1810548646	RWWIAQKMJMMGEB-HFTRVMKXSA-N	431.573	1.187	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC2(CCCN(C(=O)c3cc[nH]c4nccc3-4)C2)CC1	1810635108	PFOLSCQJGCCVIC-UHFFFAOYSA-N	440.548	1.732	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)/C=C\C(=O)NC2CC2)[C@H]1c1cccnc1	1813030558	DEVYBKQGUVOZHY-VIUWEYCZSA-N	434.924	1.176	50	20	IDGD	
C[C@H](Nc1nccs1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](O)CCl)n[nH]1	1814871517	RJSNJTLLZUZHAX-DRZSPHRISA-N	426.930	1.959	50	20	IDGD	
Cc1cccc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)c1	1815361057	UVHQOCFPUQOBMZ-QGZVFWFLSA-N	435.314	1.671	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1sccc1F	1815427747	OTIFJCCEBBVRJI-INIZCTEOSA-N	442.281	1.910	50	20	IDGD	
Cc1ccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)cn1	1816371073	MFQCTRHWLDDTLR-IBGZPJMESA-N	433.277	1.413	50	20	IDGD	
CNC(=S)NCCC(=O)N[C@@H]1CCc2nc(NC(=O)CO[Si](C)(C)C)sc2C1	1820165673	LONNIISMXCKCLU-LLVKDONJSA-N	443.671	1.391	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](O)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](F)Cl)[nH]n1	1821218841	JFXKQQKWQQZRDH-ZKYQVNSYSA-N	433.868	1.779	50	20	IDGD	
CC[C@@H](O)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)CC1	1824080712	SWRABHCNXYXMCL-YBOOGWSUSA-N	431.537	1.511	50	20	IDGD	
CC(C)c1nc(CC(=O)N2CCCC[C@H]2C2CCN(C(=O)[C@H](O)CCl)CC2)no1	1825119011	WQXRXCCOKDABCP-JKSUJKDBSA-N	426.945	1.955	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)/C=N/O[C@H]1CCCCO1)CC2	1826000294	QVHZNVOFLYFESH-IFISONFRSA-N	444.941	1.838	50	20	IDGD	
N=C1NCCN1CC(=O)N1CCC([C@H]2CCCCN2C(=O)CCBr)CC1	1826357907	VOAWVTFYLAXIDQ-OAHLLOKOSA-N	428.375	1.231	50	20	IDGD	
C[C@H](C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCC(=O)NN(C)C)CC2)n1cccc1	1826599745	PEBUXZHBJGQIQC-KGLIPLIRSA-N	432.550	1.491	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC[C@@H]1C1CCN(C(=O)C23CC(F)(C2)C3)CC1	1827050347	NPVRBQIFXUHGBR-YUVSOPLDSA-N	428.313	1.492	50	20	IDGD	
N#Cc1c[nH]c(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)c1	1827052383	IBIXOBQTJZSFHO-NRFANRHFSA-N	434.305	1.113	50	20	IDGD	
COc1cc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)nn1C	1829847162	YYKQDNWZRSONAT-GOSISDBHSA-N	448.568	1.035	50	20	IDGD	
COc1ccc(OCC(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)cc1	1830234960	AEWOHPYNPFACBK-IEBWSBKVSA-N	430.860	1.065	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4nncn4c3)C2)C1	1830362266	PHJAKNDUHJOBOB-HXUWFJFHSA-N	435.912	1.064	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC([C@H]2CCCCN2C(=O)Cn2nccn2)CC1	1830428009	XDRRZXNKAMAELA-GOEBONIOSA-N	426.359	1.929	50	20	IDGD	
CCc1nc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)co1	1830539498	HOPADLPLDMEDTK-SCLBCKFNSA-N	444.326	1.338	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](O)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H](O)CCl)CC1	1830666436	NRNUHRNDSDDRNU-HRCADAONSA-N	447.960	1.049	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)COc3cccnc3)C2)C1	1831640580	NSPMTRNUYLLGRG-XLIONFOSSA-N	425.913	1.324	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CCc2nc(N)n[nH]2)CC1	1831655269	MZZCBIKQPNVIDE-OCCSQVGLSA-N	441.374	1.723	50	20	IDGD	
Cc1ccc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)nc1	1831872535	ZWEKVTLZFWEXHO-FQEVSTJZSA-N	429.565	1.996	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2cnccn2)CC1	1832300540	WQRHAHDMKUKWDF-VQKOGROQSA-N	448.332	1.103	50	20	IDGD	
Cc1cccc2c(C(=O)N3CCC(N4CCC(NC(=O)[C@H](O)CCl)CC4)CC3)n[nH]c12	1833311755	FGNODIUIARNBRM-GOSISDBHSA-N	447.967	1.656	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)Cc3nc(C)no3)CC2)CC1	1834848808	BPVOBVUVTNMFMA-QGZVFWFLSA-N	425.961	1.900	50	20	IDGD	
O=C(C(Cl)Cl)N1CCOC[C@]2(C1)CN(C(=O)C1(C(F)(F)F)CCC1)CCO2	1835474391	SNHWGIWBZUUPFF-AWEZNQCLSA-N	433.254	1.979	50	20	IDGD	
CC(=O)NC(C)(C)C(=O)N1CCC(N2CCC(NC(=O)[C@H](F)Br)CC2)CC1	1836413342	CMAKTDADMCDSKQ-HNNXBMFYSA-N	449.365	1.163	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccn4ccnc34)CCO2)C1	1836995383	OWHRVQCYCFLYMO-OAQYLSRUSA-N	434.924	1.669	50	20	IDGD	
O=C(c1ccc2scnc2c1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1837063317	OFDXYGXQSWKUPP-QAPCUYQASA-N	427.885	1.901	50	20	IDGD	
Cc1nc(F)ccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)Br)C2)C1	1838268632	RRAODRZBWZGHLD-KZULUSFZSA-N	444.301	1.383	50	20	IDGD	
COCc1c[nH]c(C(=O)N2CCO[C@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)c1	1838514618	IYSAYIQTJKFZAW-FQEVSTJZSA-N	439.585	1.083	50	20	IDGD	
CC(C)c1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)n[nH]1	1838697376	MOXZFRXVFIPMKI-FQEVSTJZSA-N	438.601	1.455	50	20	IDGD	
Cc1ccccc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)Br)C2)C1	1838900411	DYARJEYVFALLLV-BEFAXECRSA-N	425.323	1.848	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(-c4ccncc4)[nH]n3)C2)C1	1839145829	RDQVJKBCZUOOIC-KKSFZXQISA-N	447.923	1.559	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1	1839147571	VWYRDEPOEUOUPA-DJJJIMSYSA-N	447.315	1.839	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(C4CC4)on3)C2)C1	1839149690	OIVGLBXFMHLAOG-OALUTQOASA-N	446.331	1.858	50	20	IDGD	
Cc1nscc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2	1839151661	ZPHXZQDLFVSGKO-IAGOWNOFSA-N	436.361	1.758	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccn(C)c3)C2)C1	1839963896	ZUWYNXFFHMZJCF-YJBOKZPZSA-N	428.327	1.269	50	20	IDGD	
CC(C)c1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)on1	1840034327	HZSMLXBBCUUSKZ-ACJLOTCBSA-N	444.326	1.651	50	20	IDGD	
C[C@@H](CNC(=O)OCc1ccccc1)C(=O)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1	1841352825	OSDYTBQKMPJKPN-RDJZCZTQSA-N	437.924	1.352	50	20	IDGD	
CCn1c(-n2nc(C(=O)N3CCCC34CN(C(=O)[C@H](F)Cl)C4)cc2C)cccc1=O	1843133694	YCVCGUMGOGMYNO-KRWDZBQOSA-N	435.887	1.714	50	20	IDGD	
Cc1cc2nnc(C(=O)N3CCCC34CN(C(=O)[C@H](F)Br)C4)c(C)n2n1	1843698240	TXMFZWGSFNGVTR-ZDUSSCGKSA-N	425.262	1.249	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC2(CCCN2C(=O)c2cccc3c2NC(=O)C3=O)C1	1844127371	BGTSDTJMMJGHSQ-CYBMUJFWSA-N	434.290	1.812	50	20	IDGD	
CN(CC(=O)N1CCCC12CN(C(=O)c1cccn1C)C2)NC(=O)NCc1ccccc1	1845038420	ADGGDEZPOBJBGL-UHFFFAOYSA-N	438.532	1.188	50	20	IDGD	
Cn1cnc(C(=O)N2CC3(CCCN3C(=O)[C@@H](Br)Cc3ccccc3)C2)n1	1845940718	GBLREAKUGKYRIU-HNNXBMFYSA-N	432.322	1.638	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC12CN(C(=O)c1ccc(CS(C)(=O)=O)nc1)C2	1846176354	DRGFVJYBCBXROG-LBPRGKRZSA-N	444.351	1.227	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC12CN(C(=O)[C@@H]1C[C@@]13C(=O)Nc1ccccc13)C2	1846178972	DCRYWFQGEGQMHV-SIFORAMQSA-N	432.318	1.883	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)CCNC(=O)NC12CC3CC(CC(C3)C1)C2	15879383	CNIVTZBWNSOLSZ-UHFFFAOYSA-N	444.532	1.880	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2ccc3c(c2)OCCCO3)cc(OC)c1OC	16148422	CYCZYWNCNMBXAO-UHFFFAOYSA-N	438.458	1.497	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)[C@@H]2CCCN(S(=O)(=O)c3ccc(F)cc3)C2)c1	17252271	JNDWJWZESCRRNS-MRXNPFEDSA-N	448.520	1.754	50	20	IDGD	
COc1ccc(/C=C(/C#N)C(=O)OCC(=O)NN2C(=O)NC3(CCC(C)CC3)C2=O)cc1	205742411	DAIJBQCKCFVPHS-WJDWOHSUSA-N	440.456	1.677	50	20	IDGD	
COc1nc(C)cc(C)c1CNC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1	727605197	CBJOHEUDJQZXNM-UHFFFAOYSA-N	449.533	1.167	50	20	IDGD	
CN(C)N(C(=O)c1cc(S(=O)(=O)N2CCCC2)ccc1Cl)[C@@H]1CCS(=O)(=O)C1	728180527	WDDZFPSGEOYNSL-CYBMUJFWSA-N	449.982	1.230	50	20	IDGD	
COCCNC(=O)CN1CCN(C(=O)/C(C#N)=C\c2cc(C)n(CCC(C)C)c2C)CC1	728195563	IQOSOVSNAWOSGK-JCMHNJIXSA-N	443.592	1.965	50	20	IDGD	
O=C(CS[C@H]1CCS(=O)(=O)C1)NNC(=O)c1cc(F)ccc1Br	728549991	UGZYPJXPYCXRCY-VIFPVBQESA-N	425.301	1.270	50	20	IDGD	
COCCN(Cc1ccc(C#N)cc1)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	728961504	JFGOIMKFNZJFNZ-UHFFFAOYSA-N	437.504	1.454	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NC2CCC(C(=O)OC)CC2)c2ccccc2c1=O	730132060	ZJEUMMLVCYPHMR-UHFFFAOYSA-N	443.504	1.872	50	20	IDGD	
Cc1c(C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)nnn1-c1ccc(OC(F)F)cc1	731165420	SYROFIIWAQGZMM-INIZCTEOSA-N	445.382	1.778	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)CN1C(=O)COc2cc(Br)ccc21	731328137	UVOBHLBIGMBOKZ-UHFFFAOYSA-N	436.237	1.704	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)c1ccc2c(c1)SC1=NS(=O)(=O)CCN12	731330333	KMTILWSXPRWYOC-UHFFFAOYSA-N	434.474	1.441	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CCc2c(C)nc(O)nc2O)cc1Br	732034351	ULFMVAHVPBZSKF-UHFFFAOYSA-N	425.239	1.361	50	20	IDGD	
Cc1ccccc1-n1c(C)cc(/C=C(\C#N)C(=O)N2CCN(S(N)(=O)=O)CC2)c1C	732066029	DRXVOPMAVPYRBA-CPNJWEJPSA-N	427.530	1.657	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCCc1ccc(F)cc1F	732676700	MMMVWTMRCDOKAZ-UHFFFAOYSA-N	425.461	1.753	50	20	IDGD	
O=C(CCn1c(S)nc2ccccc2c1=O)NNC(=O)c1cnn(-c2ccccc2)c1	733170954	OTZBLTFBFJRTSG-UHFFFAOYSA-N	434.481	1.722	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)c2ccccc2S(C)(=O)=O)CC1	734824965	OZXSECHKYCPSKQ-UHFFFAOYSA-N	440.522	1.434	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2nccc3ccccc23)CC1	735117120	BSVBKYOSUPUJCW-UHFFFAOYSA-N	426.502	1.323	50	20	IDGD	
CSCC[C@@H](NC(=O)c1ccc2ccccc2n1)C(=O)NNC(=O)c1cnn(C)c1	735470569	CGKOKMXMTLYEHH-QGZVFWFLSA-N	426.502	1.281	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)N[C@@H]2[C@@H]3CCO[C@@H]3C2(C)C)c2ccccc2c1=O	741426231	QLWPUGNSVMAZGL-JQHSSLGASA-N	427.505	1.954	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)[C@H]2CCCN(C(=O)N3CCc4sccc4C3)C2)n1	741662208	LWEUVRGLQUQTII-KRWDZBQOSA-N	444.561	1.599	50	20	IDGD	
Cc1cccc(C)c1NCC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	741744905	DNZLXVRTTJBVPR-UHFFFAOYSA-N	430.530	1.961	50	20	IDGD	
CC(C)c1nn([C@H]2CCS(=O)(=O)C2)cc1C(=O)NNC(=O)c1ccc2c(c1)OCO2	742472456	OCBFASOMRPJWSQ-ZDUSSCGKSA-N	434.474	1.170	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)[C@@H](C)NC(=O)c1cc2c(C)nn(C)c2s1	743293686	HTMFCJYOHFEGLY-GFCCVEGCSA-N	444.517	1.330	50	20	IDGD	
NC(=O)c1ccccc1N1CC[C@H](NC(=O)NNC(=O)c2cccc(Br)c2)C1	743604876	HUKKVRDAENJYQS-AWEZNQCLSA-N	446.305	1.771	50	20	IDGD	
COc1ccccc1N1C[C@@H](C(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)CC1=O	743830035	KZCJFMALCNMBCQ-ZDUSSCGKSA-N	446.485	1.305	50	20	IDGD	
C=CC(=O)NCc1ccc(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)cc1	744619763	XPZLUFFBRAJBJK-UHFFFAOYSA-N	444.513	1.267	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)COc1ccccc1-c1ccccc1)CN1CCN(C)CC1	745862723	NKWLUNCCITWMDY-LJQANCHMSA-N	439.560	1.946	50	20	IDGD	
Cc1ccc(C)n1-c1ccc(C(=O)NNC(=O)NC[C@H](C)CN2CCN(C)CC2)cc1	745863762	XEQLQFGETMBIHA-KRWDZBQOSA-N	426.565	1.922	50	20	IDGD	
CO[C@H](CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)C(C)C	745927696	FIQSELBFBQFZIN-QGZVFWFLSA-N	426.539	1.476	50	20	IDGD	
Cc1nc(C)c(C(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)o1	746092793	DKAHFZGPDYNPPD-UHFFFAOYSA-N	428.470	1.845	50	20	IDGD	
CN(C)CCN1C[C@@H](C(=O)NNC(=O)c2ccc(Br)cc2Cl)CC1=O	746218304	VZDMVTFRYAEOON-JTQLQIEISA-N	431.718	1.274	50	20	IDGD	
Cc1ccc(N2C(=O)C[C@@H](C(=O)NNC(=O)C(=O)N3CCCC3)[C@@H]2c2cccs2)cc1	748246593	CXQKLMVSNMDPPH-VQIMIIECSA-N	440.525	1.921	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NC[C@@]1(N(C)C)CCSC1	748647564	PNWRLEOBIXWRFT-SJCJKPOMSA-N	445.383	1.984	50	20	IDGD	
CCCCO[C@H]1C[C@@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)C1(C)C	748970864	POAXBLFHHCYKCQ-SJORKVTESA-N	440.566	1.865	50	20	IDGD	
CCOc1cc(C=NNC(=O)CNC(=O)c2cccs2)ccc1O[C@@H](C)C(=O)N(C)C	750948446	RWEJZHCYYJZFRY-AWEZNQCLSA-N	446.529	1.882	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2sc(C)nc2C)c1	751201784	CUWGITGLLDSEMC-UHFFFAOYSA-N	446.576	1.414	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)[C@H]1CCCN(C(=O)c2cccc3ccccc23)C1	751205038	VQGMGUPXKDLNBR-KRWDZBQOSA-N	448.479	1.862	50	20	IDGD	
CCCCOc1ccc(C(=O)NNS(=O)(=O)c2cnn([C@H]3CCOC3)c2)cc1OC	751538982	UVBWTISYRLBHGE-HNNXBMFYSA-N	438.506	1.655	50	20	IDGD	
CCOc1nc2sccn2c1C=NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1	753917912	FECAIXKLXGUQAO-UHFFFAOYSA-N	435.531	1.874	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)C2(C)CCN(Cc3ccccc3)CC2)c2ccccc2c1=O	753984759	GRMCQGRKJRJADD-UHFFFAOYSA-N	433.512	1.997	50	20	IDGD	
Cn1c(=O)oc2cc(C=NNC(=O)CN3c4cccc5cccc(c45)S3(=O)=O)ccc21	754918827	VMHZLPYDLOVFKK-UHFFFAOYSA-N	436.449	1.944	50	20	IDGD	
CC(C)C[C@@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)N1CCCCC1=O	755041874	UBQNQGXGXSCKCS-KRWDZBQOSA-N	438.550	1.125	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)N[C@@H]1[C@@H]2CCO[C@H]2C12CCCC2	755091740	VOMIDHZWQNFWTR-KSEOMHKRSA-N	441.576	1.877	50	20	IDGD	
CCN(CC)C(=O)c1ccc(NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1	755446519	PAEBXWILEVQPHE-UHFFFAOYSA-N	436.472	1.882	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Nc2ncn(Cc3ccccc3)n2)cc(OC)c1OC	756238793	UVQPJOBGRCVGAP-UHFFFAOYSA-N	426.433	1.819	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)COc2cc(C)cc(C)c2)cc1-n1nnnc1C	756319679	KTMQQAJTGJYKAO-UHFFFAOYSA-N	425.449	1.828	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)c2cccc(C#N)c2)ccc1S(=O)(=O)N1CCCC1	756587080	WKXQACILEIBMFX-UHFFFAOYSA-N	443.485	1.818	50	20	IDGD	
O=C(NCc1ccco1)Nc1ccc(NC(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)cc1	756611421	VRENSQBPCPIOAW-GFCCVEGCSA-N	435.462	1.189	50	20	IDGD	
C[C@H](C(=O)N1CCN(S(=O)(=O)CBr)CC1)[C@@H](C)NC(=O)OC(C)(C)C	757592530	JZNNVNVQKQNNJE-NWDGAFQWSA-N	442.376	1.362	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2cccc(OC)c2O)cc1-n1nnnc1C1CC1	757620639	IMUATIQYUGWLPU-UHFFFAOYSA-N	439.432	1.729	50	20	IDGD	
CCOCCCn1c(NNC(=O)[C@@H](C)n2nnnc2C(C)(C)C)nc2ccccc2c1=O	758167909	IFTHRSFKTYSCGE-CQSZACIVSA-N	442.524	1.811	50	20	IDGD	
Cc1nc(-c2c[nH]c(C(=O)N3CCN(S(=O)(=O)CBr)CC3)c2)cs1	758524604	WVTDBVKOFSATCJ-UHFFFAOYSA-N	433.353	1.887	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)c2cnn(CCO[C@@H]3CCCCO3)c2C)c1	758622045	SAKXDARJOHQRTR-HXUWFJFHSA-N	444.488	1.661	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)N[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1C#N	758760781	POLDQKDKLSRWCW-XEZPLFJOSA-N	435.456	1.682	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNS(=O)(=O)c1ccc(S(C)(=O)=O)c(F)c1	760334641	KJSZIJYOXLPLQD-UHFFFAOYSA-N	446.478	1.016	50	20	IDGD	
CCCCn1ncc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)c1CC	760448657	MJLRAIYKCMUJFH-UHFFFAOYSA-N	440.548	1.465	50	20	IDGD	
CC(C)(C)C(=O)NNC(=O)C(=O)Nc1ccc(CCn2nnc(-c3ccccc3)n2)cc1	761064367	XMTKRLCNXIOCFC-UHFFFAOYSA-N	435.488	1.715	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)Cn2cnc(-c3ccccc3)n2)CC1	761761298	CXRBVHVPTDUSPP-UHFFFAOYSA-N	443.508	1.675	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C1=NN(c2ccccc2)[C@@H](C(N)=O)C1	762370046	DVAPNVBHKTZZOH-OAHLLOKOSA-N	427.486	1.055	50	20	IDGD	
Cc1ccc(-c2nnc(S)n2CC(=O)NNc2nccc(N3CCOCC3)n2)cc1	762847964	KIQOMRDVTMCVSD-UHFFFAOYSA-N	426.506	1.312	50	20	IDGD	
Cc1ccc(S(=O)(=O)n2ccc(C(=O)NNc3nccc(N4CCOCC4)n3)c2)cc1	762853768	VNRWTYBFSFLQGF-UHFFFAOYSA-N	442.501	1.417	50	20	IDGD	
Cc1c(C(=O)O)cc(Cl)cc1S(=O)(=O)NNC(=O)CCCNC(=O)OC(C)(C)C	763438663	CONKLNCQLMNNPM-UHFFFAOYSA-N	449.913	1.961	50	20	IDGD	
Cc1ccc(C(=O)NC2CC2)cc1NC(=O)C(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	763442429	QBFOEWVSYZNPDP-UHFFFAOYSA-N	425.401	1.195	50	20	IDGD	
O=C(NNC(=O)c1cccnc1)C(=O)Nc1ccnn1Cc1ccccc1Br	763490992	JXLCSWKLEVHXST-UHFFFAOYSA-N	443.261	1.489	50	20	IDGD	
O=C(NNC(=O)c1ccccc1F)C(=O)Nc1ccc(CN2C(=O)CCCC2=O)cc1	763561148	KBIQFTUGXOVOTD-UHFFFAOYSA-N	426.404	1.265	50	20	IDGD	
O=C(NNC(=O)C1CC1)C(=O)Nc1ccc(CN2CCN(Cc3ccccc3)CC2)cc1	763561475	ICDVHSPHHUGGCJ-UHFFFAOYSA-N	435.528	1.500	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1cccc(N2CCCCC2=O)c1	763628181	GUPBPZXTMHRVKV-UHFFFAOYSA-N	434.456	1.559	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cnn(CC(C)C)c1C(F)F	763647057	MKKLVXNRXPLHDF-UHFFFAOYSA-N	439.419	1.650	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(C)c(NC(C)=O)c1	763684418	LETXCCFAQGXGCV-UHFFFAOYSA-N	428.445	1.517	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(CN(C)C(=O)OC)cc1	763717240	SLTSPUBTYFXWBD-UHFFFAOYSA-N	442.472	1.612	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cccnc2OC)ccc1OCCC(C)C	763914489	NTPOQIKMVBCMED-UHFFFAOYSA-N	430.461	1.923	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)OC(C)(C)O2	764004271	BDICWFUECGZSEH-UHFFFAOYSA-N	437.250	1.695	50	20	IDGD	
O=C(NNC(=O)c1ccc(F)cc1Br)C(=O)Nc1cccc2c1OCCO2	764083825	BNDZUAXPSOGUIN-UHFFFAOYSA-N	438.209	1.759	50	20	IDGD	
CCSCc1cccc(NC(=O)C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c1	764084939	KBWBCJRDRTYNKM-UHFFFAOYSA-N	435.527	1.743	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccccc1OC[C@H]1CCCCO1	764130459	IFXNXHUMFWMRCB-QGZVFWFLSA-N	441.484	1.972	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)CC2CC2)cc1NC(=O)c1cccc(F)c1	764142838	CHMIVYUKNWWQCD-UHFFFAOYSA-N	428.420	1.973	50	20	IDGD	
COc1ccc(S(=O)(=O)C(F)(F)F)cc1NC(=O)C(=O)NNC(=O)CC(C)(C)C	764200369	ZRFPYDYSCSEJCS-UHFFFAOYSA-N	439.412	1.511	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)C(=O)Nc1ccc(N2CCCC2)nc1	764204095	IQWSGZMTYXXVRZ-UHFFFAOYSA-N	434.497	1.073	50	20	IDGD	
Cc1ncsc1C(=O)NNC(=O)C(=O)Nc1cccc(C(=O)NCc2ccccc2)c1	764247320	QOZCOELCMZXFCA-UHFFFAOYSA-N	437.481	1.781	50	20	IDGD	
COC(=O)N(C)Cc1ccc(NC(=O)C(=O)NNC(=O)c2cccc3ncccc23)cc1	764260311	QRQNALVOWOINTN-UHFFFAOYSA-N	435.440	1.833	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2cc3ccccc3o2)c1	764331312	BADWCLZZDHKAKX-UHFFFAOYSA-N	430.442	1.083	50	20	IDGD	
O=C(NNC(=O)C1CCC1)C(=O)Nc1ccnn1Cc1ccc(OC(F)(F)F)cc1	764334227	ATRWPFXIFDQGJL-UHFFFAOYSA-N	425.367	1.716	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CNC(=O)c2cccnc2)cc1NC(=O)c1ccccc1	764344523	YORMWZHQKXOMBV-UHFFFAOYSA-N	431.452	1.833	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)NCCCN2CCCO[C@@H](C)C2)c2ccccc2c1=O	764571302	AYFZPVIMFTVFDM-INIZCTEOSA-N	444.536	1.422	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)[C@@H](C)NS(=O)(=O)c1ccc(C#N)cc1	764635730	NPDYWILUZRHEGC-LLVKDONJSA-N	436.877	1.348	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNS(=O)(=O)c1ccccc1F	765120000	YFDGFCBYNLOHON-UHFFFAOYSA-N	440.928	1.606	50	20	IDGD	
Cc1c(C(=O)NNC(=O)CSc2ccccc2O)nnn1-c1cccc([N+](=O)[O-])c1	765248825	JLPVJBPTXZCIMI-UHFFFAOYSA-N	428.430	1.743	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1cccc(C#N)c1)C(=O)NNC(=O)Cn1ccc2ccccc21	765429237	ZHLRDKPFZPPMRZ-CQSZACIVSA-N	425.470	1.027	50	20	IDGD	
CC(C)(C)OC(=O)N1CCO[C@H](C(=O)NNC(=O)c2cccc(Br)c2)C1	765487140	FEKCQPDPUVPSFK-ZDUSSCGKSA-N	428.283	1.846	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)CN3C(=O)NC4(CCCCC4)C3=O)n[nH]2)cc1	765572279	XIWMAOMNMIYBKG-UHFFFAOYSA-N	438.488	1.655	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3ccc(-n4cccn4)nc3)CC2)cc1	765755576	QWYTYNWMTRVHTM-UHFFFAOYSA-N	433.516	1.155	50	20	IDGD	
CCc1ccccc1OCC(=O)NNS(=O)(=O)c1cccc2c(C(=O)OC)nccc12	766312467	SXTQVLYHNJVFGH-UHFFFAOYSA-N	443.481	1.972	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)cc1	766663010	IJNHTGQAEPNVND-UHFFFAOYSA-N	443.935	1.552	50	20	IDGD	
CCOc1ccnc(N2CCCN(CC(=O)NNC(=O)c3ccccc3Cl)CC2)n1	767912227	MMZHWJTUYQIWSJ-UHFFFAOYSA-N	432.912	1.502	50	20	IDGD	
COc1cc2c(cc1NC(=O)NNC(=O)C1CCN(c3ncccn3)CC1)NC(=O)CC2	767953034	JWGLUHNJMXORPB-UHFFFAOYSA-N	439.476	1.439	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(C2CC2)nn1-c1ncccn1	768236946	HETOTIBGCBQPEL-UHFFFAOYSA-N	449.471	1.267	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)[C@@H](C)N2C(=O)NC3(CCCC3)C2=O)n[nH]1	768274033	NYIIROMLUWQRCX-GFCCVEGCSA-N	440.460	1.099	50	20	IDGD	
CC(C)(C)C(=O)NNC(=O)CSc1nnc(-c2cc(-c3ccc(F)cc3)[nH]n2)n1N	768422254	VMFKNPLQXREQQA-UHFFFAOYSA-N	432.485	1.474	50	20	IDGD	
CSCCNC(=S)NNC(=O)C1CCN(S(=O)(=O)c2ccc(C)c(C)c2)CC1	769768134	ZKPSAHHOEJTLHA-UHFFFAOYSA-N	444.648	1.562	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)c1ccc(-n2ncc3ccccc32)cc1Cl	769927936	QDMQJSUQBKIZHA-LLVKDONJSA-N	435.893	1.378	50	20	IDGD	
COc1cc2c(c(OC)c1OC)CCN(CC(=O)NNC(=O)Cc1nc(C)cs1)CC2	770249798	BJUIAUVOLAHPHQ-UHFFFAOYSA-N	448.545	1.268	50	20	IDGD	
COC(=O)c1ccnc(NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c1	770677918	BHBNTAZHTKPVIK-UHFFFAOYSA-N	426.477	1.233	50	20	IDGD	
COc1ccc(-n2nc(C(=O)OCC(=O)NNC(=O)Cc3nc(C)cs3)cc2C)cc1	771174783	YOFMYKHXIQIRIO-UHFFFAOYSA-N	443.485	1.501	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3cnn(-c4cccnc4)c3)n[nH]2)cc1OC	771651465	ZMGHAZNVDPARAB-UHFFFAOYSA-N	433.428	1.749	50	20	IDGD	
Cc1cc(S(=O)(=O)NCCNC(=O)NNC(=O)CCCc2ccccc2)c(C)s1	771980315	PRNSWDCMDKRYSZ-UHFFFAOYSA-N	438.575	1.997	50	20	IDGD	
Cc1cc(S(=O)(=O)NCCNC(=O)/C(C#N)=C\c2cc(C#N)n(C)c2C)c(C)s1	772726591	JIMOVXFBNUCKCN-PXNMLYILSA-N	431.543	1.885	50	20	IDGD	
COc1ccccc1C(=O)N[C@@H](CCS(C)(=O)=O)C(=O)NNc1nccnc1C(C)C	772871243	STDZWTVBIYNCRC-HNNXBMFYSA-N	449.533	1.285	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)c1cnn(CC(=O)NC2CCCC2)c1	772998480	PNZDJFGPRRPYCE-ZDUSSCGKSA-N	433.896	1.824	50	20	IDGD	
Cc1ccc(I)cc1NC(=O)C(=O)NNC(=O)Cc1ccncc1	773494998	APBZQRHJBZDVCW-UHFFFAOYSA-N	438.225	1.323	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1cnn(C[C@@H]2CCCO2)c1	774002276	PIMZVMSQUPVKNU-LRDDRELGSA-N	435.868	1.269	50	20	IDGD	
CCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)c(C)c1	774008013	DMBMMVCYWDZNGG-CYBMUJFWSA-N	446.891	1.952	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)C(=O)N(C)C2=O	774009437	PPYJQRASYKTFAW-JTQLQIEISA-N	444.831	1.119	50	20	IDGD	
Cn1nc(SCC(=O)NN=Cc2cc(Cl)c3ccccc3c2O)c(=O)n(C)c1=O	774589038	GLSMSZAXAQOVCN-UHFFFAOYSA-N	433.877	1.234	50	20	IDGD	
O=C(NNC(=O)c1ccc2nsnc2c1)c1cccc(S(=O)(=O)N2CCCCC2)c1	776702917	OACLGUYABJPKDF-UHFFFAOYSA-N	445.526	1.941	50	20	IDGD	
COCCO[C@H]1COCC[C@@H]1NC(=O)NNC(=O)c1cc(C)n(-c2ccccc2)c1C	777275148	NMTKDSZQDCEVGB-PMACEKPBSA-N	430.505	1.859	50	20	IDGD	
CC(=O)NCc1ccc(S(=O)(=O)NCC(=O)NNc2ccc3ccccc3n2)s1	777463397	RPMNIJVGMWRXMX-UHFFFAOYSA-N	433.515	1.354	50	20	IDGD	
CCS(=O)(=O)c1ccc(CNC(=O)NNC(=O)Cc2nc3ccccc3n2C)cc1	777749318	TVOHHBNSFSVQJA-UHFFFAOYSA-N	429.502	1.440	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN[C@@H](c2nc(-c3nc[nH]n3)no2)C(C)C)cc1C	778139109	AQSUAOJBNBSOJO-CQSZACIVSA-N	432.510	1.535	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)N[C@@H](CO)c1ccc(C(F)(F)F)cc1	778588531	IKNNDOJNPNWOAI-HNNXBMFYSA-N	435.366	1.359	50	20	IDGD	
COC[C@@H](C)n1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Br)s2)n1	778709244	FDFKXEXRCILHST-MRVPVSSYSA-N	430.284	1.314	50	20	IDGD	
O=C(NN=c1cc[nH]cc1)C1CCN(S(=O)(=O)c2cccc(OC(F)(F)F)c2)CC1	780757611	UELVABIVNIFDCE-UHFFFAOYSA-N	444.435	1.946	50	20	IDGD	
CCOC(=O)CNC(=O)[C@@H]1COCCN1CCP(=O)(c1ccccc1)c1ccccc1	781904570	GEJVFENWXKEVBG-NRFANRHFSA-N	444.468	1.381	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(C)nc3ccccc23)c(OC)c1	782120876	HFTHGTCIXAQXPO-UHFFFAOYSA-N	436.424	1.738	50	20	IDGD	
C[C@H]1CN(C(=O)c2ccc(NC(=O)C(=O)NNC(=O)c3ccc(O)cc3)cc2)C[C@H](C)O1	782832758	SKBTUAIFFRQLBW-KBPBESRZSA-N	440.456	1.041	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2cc(C(F)(F)F)ccc2N2CCCC2)CCS(=O)(=O)C1	783424947	GUILRMQEVRQRIJ-KRWDZBQOSA-N	448.467	1.442	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2cccc(NC(=O)c3ccccc3)c2)CCS(=O)(=O)C1	783425527	IKOXXNZQEJECOU-HXUWFJFHSA-N	430.486	1.075	50	20	IDGD	
CC(C)(C)OC(=O)Nc1ccc(F)c(NC(=O)C(=O)NN[C@@]2(C)CCS(=O)(=O)C2)c1	783426110	FTQUFBWADCGAJZ-SFHVURJKSA-N	444.485	1.309	50	20	IDGD	
COC(=O)CCNC(=O)c1ccc(NC(=O)C(=O)NNc2cccc3c2CCCC3)cc1	783454687	MIYPRFPKGDBWOI-UHFFFAOYSA-N	438.484	1.940	50	20	IDGD	
Cc1c(CS(C)(=O)=O)cccc1NC(=O)C(=O)NNc1ccc(Br)nc1	784806618	LWSJFYGXJZZAIU-UHFFFAOYSA-N	441.307	1.779	50	20	IDGD	
COC(=O)CN1CCN(c2ccc(NC(=O)C(=O)NNc3ncccc3Cl)cc2)CC1	784817573	JZDSJSMKNFJICD-UHFFFAOYSA-N	446.895	1.112	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)NC(C)(C)C)ccc1C(N)=O	784834161	XJAVCXZQMZEHDG-UHFFFAOYSA-N	447.517	1.253	50	20	IDGD	
COc1ccc2nc(NNC(=O)C(=O)Nc3ccc4c(c3)C(=O)N(C)C4=O)c(C)cc2c1	785163674	HGGUHJDZGCYJNZ-UHFFFAOYSA-N	433.424	1.859	50	20	IDGD	
CN1CC(=O)N(Cc2ccc(C(N)=O)cc2NC(=O)/C(C#N)=C/c2ccc(O)cc2)C1=O	787415656	XBDOYYQZALRAGC-LZYBPNLTSA-N	433.424	1.431	50	20	IDGD	
COc1ccc(S(N)(=O)=O)c(OC)c1C(=O)NNC(=O)NCc1ccc(Cl)cc1	787436248	SKKNXUIXXAUYDN-UHFFFAOYSA-N	442.881	1.149	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)cccc1N1CCNC1=O	787543717	MBHWOINFDOZVSE-CYBMUJFWSA-N	443.435	1.217	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)cccc1N1CCNC1=O	787544523	SJGBTUDMQYXXAR-ZDUSSCGKSA-N	443.435	1.217	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2F)cccc1N1CCNC1=O	787549300	KFQDRWBBRSMOFQ-UHFFFAOYSA-N	433.827	1.717	50	20	IDGD	
Cc1nn(-c2ccccc2)c2sc(C(=O)NNC(=O)NCCOCCN(C)C)cc12	788018748	RBFSNNPRZQLEAZ-UHFFFAOYSA-N	430.534	1.918	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)C(=O)Nc2cc(Br)cc([N+](=O)[O-])c2)c1	793027139	VPFNJIQBYBFPQY-UHFFFAOYSA-N	432.190	1.629	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CN2CCNC(=O)[C@H]2c2ccc(Br)cc2)c1	796577546	XJXZZPPMSJPVGW-GOSISDBHSA-N	445.317	1.692	50	20	IDGD	
CC(C)Oc1ccc(NC(=O)C(=O)NNC(=O)Cc2c[nH]c3ccccc23)cc1C(N)=O	796990628	UMQVJEUJSNFWMB-UHFFFAOYSA-N	437.456	1.383	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1ccc(F)cc1-c1cnn(C)c1	796992659	VDAFLIDDKPJIPD-UHFFFAOYSA-N	435.419	1.582	50	20	IDGD	
CCc1occc1C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	797408518	IVEXQXJMMRYSHC-UHFFFAOYSA-N	435.502	1.257	50	20	IDGD	
CC(=O)N[C@@](C)(C(=O)NNc1cnc2ccccc2n1)c1ccc(S(C)(=O)=O)cc1	797752154	RGBFYJSQMDKVFA-HXUWFJFHSA-N	427.486	1.528	50	20	IDGD	
NS(=O)(=O)c1ccc(C(=O)NNc2nnc(-c3ccccc3)n2-c2ccccc2)nc1	798326020	IZYFKTSSDPHYGR-UHFFFAOYSA-N	435.469	1.734	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN2CCC(CNC(=O)C(F)(F)F)CC2)cc1C	799173109	NEDBEMMJQMKLAP-UHFFFAOYSA-N	434.484	1.770	50	20	IDGD	
C[C@H](c1ccccc1)N(C)C(=O)CN(C)C(=O)NNC(=O)CNC(=O)c1cccs1	799912005	NZQCGTNCHDMSTQ-CQSZACIVSA-N	431.518	1.370	50	20	IDGD	
C[C@@H](CCNS(=O)(=O)c1ccccc1)NC(=O)NNC(=O)COCc1ccccc1	801753522	WLHQZNGSICSYJQ-INIZCTEOSA-N	434.518	1.291	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCN(c2ccc3c(c2)OCCO3)C1=O)Nc1cc(F)cc(F)c1	802006891	WCDCOTXNZLMJBT-OAHLLOKOSA-N	432.383	1.942	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)OCC(=O)c2ccc(S(C)(=O)=O)nc2)c1C	803216170	KMZYFKVEGOUETQ-VCHYOVAHSA-N	445.497	1.883	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)c1c(F)ccc(S(=O)(=O)NC2CC2)c1F	804952141	FUNJLDDKDUSNKN-UHFFFAOYSA-N	435.416	1.138	50	20	IDGD	
COc1ccc(CS(C)(=O)=O)cc1NC(=O)NNC(=O)COc1ccc(F)cc1	806638278	HBYZLKILVDHTGM-UHFFFAOYSA-N	425.438	1.611	50	20	IDGD	
CNC(=O)c1cccc(NC(=O)NNC(=O)c2cncc(NC(C)=O)c2)c1Br	806738203	XOPVYSUWZAGKFY-UHFFFAOYSA-N	449.265	1.629	50	20	IDGD	
COC(=O)c1scc(-c2ccc(C)cc2)c1NC(=O)C(=O)NNC(=O)c1cnccn1	806977092	VPARQBUSLKJVPQ-UHFFFAOYSA-N	439.453	1.700	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)N[C@@H](C)c1nc2ccccc2[nH]1	807129213	KPHBJKYZUCPTBW-LBPRGKRZSA-N	429.506	1.870	50	20	IDGD	
Cc1cnn(-c2ccc(C(N)=O)cc2NC(=O)C(=O)NNc2nccnc2C2CCC2)c1	807462398	YPBXMHSYQLBCCN-UHFFFAOYSA-N	434.460	1.419	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)NCc1ccncc1OC[C@@H]1CCOC1	807614860	ALFQTNCHFKMOHP-HUUCEWRRSA-N	432.452	1.934	50	20	IDGD	
O=C(NCc1ccncc1OC[C@H]1CCOC1)NNC(=O)[C@H]1COc2ccccc2O1	807615196	OUPOHQMHMRQGCR-IFXJQAMLSA-N	428.445	1.167	50	20	IDGD	
C[C@H]1C(=O)Nc2cc(C(=O)NNC(=O)[C@H]3CCCN(C(=O)OC(C)(C)C)C3)ccc2N1C	808011263	RNRNBWMWJQPNAW-ZFWWWQNUSA-N	445.520	1.872	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)[C@@H]2C[C@H](c3ccccc3)OC2=O)c2ccccc2c1=O	809545730	IETYNPNUZIOCSY-ZWKOTPCHSA-N	434.452	1.872	50	20	IDGD	
COC[C@]1(C(=O)NNc2nccc(N3CCOCC3)n2)CCN(C(=O)OC(C)(C)C)C1	810558980	IGCMGTZQBGOGSF-FQEVSTJZSA-N	436.513	1.030	50	20	IDGD	
COC[C@@H](NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)c1cccc(Cl)c1	812453538	LUUUVVCMGOYNSL-MRXNPFEDSA-N	429.864	1.919	50	20	IDGD	
Cc1nc(-c2ccccn2)nc(NNC(=O)C(=O)N2CCN(c3ccccc3)CC2)c1C	812510350	PSQBQQFXSZTUAC-UHFFFAOYSA-N	431.500	1.947	50	20	IDGD	
CCNC(=O)[C@@H](NC(=O)NNC(=O)[C@H](C)Oc1cccc(Br)c1)C(C)C	814359602	KSPALRFISHRTDJ-FZMZJTMJSA-N	429.315	1.708	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NN=Cc3cccc(C)c3O)CC2)cc1	814877776	ZMJWCTGICGNXCV-UHFFFAOYSA-N	430.530	1.466	50	20	IDGD	
NS(=O)(=O)c1ccc(NC(=O)NN=C2C(=O)Nc3c2cccc3C(F)(F)F)cc1	814964787	AQDMBQYWEYDDDG-UHFFFAOYSA-N	427.364	1.831	50	20	IDGD	
O=C(CNC1(Cc2cccc(F)c2)CCOCC1)NNC(=O)c1ccc([N+](=O)[O-])cc1	815151626	ISAIDNOYIHCNSU-UHFFFAOYSA-N	430.436	1.876	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)C(=O)Nc2ccc(Br)c(C#N)c2)c1	815558701	LJCNBURLCOLJNK-UHFFFAOYSA-N	437.275	1.806	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)cc1)C1CC1	815565774	ZOWAYLIREGCZGK-UHFFFAOYSA-N	435.440	1.238	50	20	IDGD	
CC(C)[C@H](NC(=O)COc1ccccc1)C(=O)NNC(=O)c1cnn(-c2ccccc2)c1	815600022	JHVCTERFJUUVRM-NRFANRHFSA-N	435.484	1.853	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)cc1)[C@@H]1C[C@H]1C	815608318	XKGLWTHHFRTJHU-AUUYWEPGSA-N	448.483	1.424	50	20	IDGD	
CSCCc1ccc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)N(C)C)cc1	815752592	YRRVAERSXMTGNF-UHFFFAOYSA-N	436.559	1.924	50	20	IDGD	
O=C(NNc1ncncc1F)C(=O)Nc1ccc(I)cc1Cl	815765114	GITLYQJENLLPOB-UHFFFAOYSA-N	435.584	1.956	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)[C@H](CC(N)=O)NC(=O)CC(C)C)c1	818750034	BMVYQTCMFNTGNE-ZDUSSCGKSA-N	443.298	1.085	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)[C@@](C)(O)Cn2ccc(C)cc2=O)c1	818767886	UXRBICVIXOLULO-SFHVURJKSA-N	438.278	1.600	50	20	IDGD	
O=C(c1ccc(Cl)c(NS(=O)(=O)c2ccc(F)cc2)c1)N1CC[C@@H](B(O)O)C1	864233727	JVAKTMCBLCAZJR-GFCCVEGCSA-N	426.662	1.969	50	20	IDGD	
O=C(COC(=O)c1ccc(N2CCCCCC2)nc1)NNC(=O)c1ccc([N+](=O)[O-])cc1	914680493	HIVLEMHTLWGKAA-UHFFFAOYSA-N	441.444	1.988	50	20	IDGD	
COc1ccc([C@@H](CNC(=O)NNC(=O)COc2ccc(C)cc2)N2CCOCC2)cc1	915897058	RLOPRFAYXXXAKG-OAQYLSRUSA-N	442.516	1.786	50	20	IDGD	
C#CCNC(=O)NNC(=O)c1ccc(Cl)c(S(=O)(=O)Nc2ccccc2OC)c1	915908402	YGYBJHYORIYSQX-UHFFFAOYSA-N	436.877	1.727	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)NCc2ccnc(N3CCN(C)CC3)c2)c1C	916389752	DHASCKWEIYYMOG-SFHVURJKSA-N	440.548	1.748	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NCc2ccc(N3CCCCC3)nc2)c2ccccc2c1=O	916392364	PNAKXSXTKLBKNG-UHFFFAOYSA-N	435.488	1.463	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)NCCNC(=O)c1cccs1	916568756	SSNHVKGKGYNXQI-UHFFFAOYSA-N	444.561	1.021	50	20	IDGD	
CSc1ncc(C(=O)NNC(=O)CCN2C[C@@H](C)O[C@H](C)C2)n1-c1ccc(F)cc1	917362910	RMTMHSHMVKWMAR-ZIAGYGMSSA-N	435.525	1.994	50	20	IDGD	
O=C(Cn1c(=O)ccn(Cc2ccccc2)c1=O)NNC(=O)c1ccc2ccccc2c1	918108868	OLWZRCIREOTYSI-UHFFFAOYSA-N	428.448	1.673	50	20	IDGD	
CNC(=O)CCCNC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	918235994	UXLYFYKDWNOLFQ-UHFFFAOYSA-N	439.519	1.019	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)Cc2ccc(-n3cccn3)cc2)cc1OC	919178468	IEMIGZFPBQYKLW-UHFFFAOYSA-N	438.440	1.436	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2ccn(-c3ccc(OC)cc3)n2)c2ccccc2c1=O	919805621	BYUFZVYBLRHNHM-UHFFFAOYSA-N	432.440	1.686	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)CS(=O)(=O)N2CCN(c3cccc(C)c3)CC2)cc1	919807518	SZUKXPVTEACBNJ-UHFFFAOYSA-N	444.557	1.470	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@@H](C)CN2C[C@@H](C)C[C@@H](C)C2)c2ccccc2c1=O	919924587	OMUCUYZLUITPFA-XHSDSOJGSA-N	428.537	1.727	50	20	IDGD	
CCCCNC(=O)NNC(=O)[C@H](CCS(C)(=O)=O)NC(=O)c1ccc(Cl)cc1	920822886	DCCIYJIFLKTKFY-AWEZNQCLSA-N	432.930	1.004	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NCc2cccc(OCCN3CCOCC3)c2)cc1	920921146	YHNLZYGNZHMAEP-UHFFFAOYSA-N	442.516	1.615	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)Nc1nc(CN2CCOCC2)cs1	920930823	WCAWLDHWSYUBOG-UHFFFAOYSA-N	436.450	1.115	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)Cn2cccc(C(F)(F)F)c2=O)CC1	1116088168	QYWYVVYPWJUJMA-UHFFFAOYSA-N	446.426	1.662	50	20	IDGD	
C[C@H]1CCCN(S(=O)(=O)c2cc(C(=O)NNC(=O)c3n[nH]c4c3CCCC4)n(C)c2)C1	1318317552	TXHPTDOAFBSLEM-ZDUSSCGKSA-N	448.549	1.122	50	20	IDGD	
CCc1cc(N2CCC[C@@H](NC(=O)NNC(=O)c3cncn3-c3ccccc3)C2)ncn1	1318546027	UQAOFNRAENHMFL-QGZVFWFLSA-N	434.504	1.838	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)CNC(=O)c2cc(Cl)ccn2)CC1	1318581651	YKFSMVGQEKESDG-UHFFFAOYSA-N	439.900	1.259	50	20	IDGD	
CC(C)[C@H](NC(=O)C(F)(F)F)C(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1	1321128843	FRSCNBUMCMGLOX-LBPRGKRZSA-N	438.447	1.484	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCC(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)cc1	1321876138	UJGUVANIPPGDQG-UHFFFAOYSA-N	435.546	1.727	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)COc1ccc(Cl)cc1Br	1322264298	IFMLHZYFCJMFMR-UHFFFAOYSA-N	430.642	1.652	50	20	IDGD	
Cc1ccc(F)c(NC(=S)NNC(=O)c2ccc(S(=O)(=O)NC[C@H](C)O)cc2)c1	1337423746	FLVZTQOCNNCOQI-LBPRGKRZSA-N	440.522	1.425	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)N[C@H]2COc3c(F)cc(F)cc3C2)cc1	1527968406	FVYFDXTYAPUZRT-CYBMUJFWSA-N	440.428	1.708	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2[nH]nc3ccncc23)C1	1777908380	SYQMYQSKRRLWEN-YYFZDKIDSA-N	435.912	1.339	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](C)N3C[C@H]4C[C@@H]4C3)C2)C1	1778867015	YNVIIWQAGINHPQ-RGQDEETRSA-N	428.371	1.330	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)N2C[C@@H]3C[C@H]3C2)C1	1779264718	OTXOGQWGPGBKEE-PPQMTQGISA-N	427.973	1.094	50	20	IDGD	
C[C@@H](Cn1cncn1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCBr)C2	1779497384	FOVOCIJVCLYUAJ-HDMKZQKVSA-N	442.358	1.213	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)C3CN(C(=O)OC(C)(C)C)C3)CCO2)C1	1781218712	JOGGIYVMVPYZPD-QRWLVFNGSA-N	429.945	1.701	50	20	IDGD	
Cc1c(C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](F)Br)C3)C2)nc2ccccn12	1781330490	YAFRKOAMXJIQRW-YJBOKZPZSA-N	439.285	1.777	50	20	IDGD	
O=C(c1ccn(C(F)F)n1)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781330951	BIKMGJAGWUPIOA-HZMBPMFUSA-N	425.205	1.412	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc3ncccn3n1)C2	1782175114	FEVBXITXJXETQO-AKCHCHLHSA-N	435.912	1.111	50	20	IDGD	
Cc1ccn2c(C(=O)N3CC[C@@]4(C3)CN(C(=O)[C@@H](C)Br)CCO4)cnc2c1	1782491971	GUPVDFITCWSACH-AUUYWEPGSA-N	435.322	1.870	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)Cc3nnc(C)s3)CCO2)C1	1783341974	IDHNKTKKWGVYBC-BLLLJJGKSA-N	431.356	1.392	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(C)nc3O)CCO2)C1	1783353710	ZIDMNSDMEFATKI-RDTXWAMCSA-N	426.311	1.713	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)CCc3cccc(O)c3)CCO2)C1	1783539471	JXUQPYYZMRSOER-LIRRHRJNSA-N	425.323	1.938	50	20	IDGD	
CC(C)(C)OC(=O)N(CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Cl)C[C@@H]21)C1CC1	1783688830	NDJISNGHGYTTKS-NZUILWFCSA-N	447.935	1.900	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)COc3ccccc3OC)[C@H]2C1	1783779066	QSUVKOIKVRJHEQ-GGXPGOJBSA-N	440.924	1.308	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3coc([Si](C)(C)C)c3)CCO2)C1	1783877418	IRJNUKLMFWFCAN-KXBFYZLASA-N	428.989	1.522	50	20	IDGD	
COc1ccc2cc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]4C3)[nH]c2c1	1784090927	RDCLRYHYZQBHOT-BMIPRAEKSA-N	435.908	1.370	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(C(C)=O)[nH]n3)[C@H]2C1	1785840623	IGKSFSUUVQNZIO-QCQGSNGOSA-N	441.326	1.379	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(O)cn3)[C@H]2C1	1786277952	WAIKJGRWAIPRNW-ZIEJDFEHSA-N	426.311	1.554	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3cnn(C)c3)[C@H]2C1	1787012426	MHKNLEVIWDQDQA-NXOAAHMSSA-N	441.370	1.506	50	20	IDGD	
Cc1nnc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]32)s1	1787057988	QAIKXNVUJRWJRN-NEULZYRMSA-N	435.377	1.605	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3C[C@@]34C(=O)Nc3ccccc34)C[C@@H]21)[C@@H](F)Cl	1787448723	ACWHGFOOFVMHQL-CNVUXUMISA-N	435.883	1.411	50	20	IDGD	
C[C@@H](NC(=O)c1ccccc1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]2C1	1787451476	SMGIDMITROEFPY-YYESSZKYSA-N	425.888	1.319	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC1(c2ccc(NC(=O)/C=C\C(=O)NC3CC3)cc2)CCC1	1789429144	ANQFWJIDVZVTNB-KHPPLWFESA-N	441.532	1.328	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc4cccnc4nc3O)[C@H]2C1	1790365568	QSOMFVSTJPYDNH-LLLHUVSDSA-N	432.908	1.946	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(=O)c3cccn3C)[C@H]2C1	1791695139	KMTXDCFGGSCSED-YXWQFLTLSA-N	440.338	1.361	50	20	IDGD	
C[C@H](C(=O)Nc1ccc(C2(NC(=O)CCC(=O)NN(C)C)CCC2)cc1)n1cncn1	1791860892	GXQKBPWCCGZXBS-OAHLLOKOSA-N	427.509	1.346	50	20	IDGD	
O=C(Cc1ccc2c(c1)OCO2)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2	1795312027	SPTZWAZPOLZHLB-CZAMWMTLSA-N	443.269	1.238	50	20	IDGD	
Cc1ccc2[nH]c(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)c3cccc(B(O)O)c3)C4)cc2c1	1797410317	BBMGYNRRFIEJFX-ACDBMABISA-N	431.301	1.722	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccnc(Cl)c1)C2	1798439215	OZTNEIHBHMEJEY-BTTYYORXSA-N	428.880	1.299	50	20	IDGD	
CCSc1cccnc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](Cl)COC)C2	1798778898	NURKIZPOAHASRJ-FQLMCAECSA-N	427.954	1.651	50	20	IDGD	
COc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)Br)C3)c(OC)c1	1798824351	XHAQJRXXCOAZTP-JRATXPSKSA-N	441.322	1.690	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cncc(C(F)(F)F)c1)c1cccc(B(O)O)c1	1798942236	ZAXUBIAPATVSTP-BCDXTJNWSA-N	447.222	1.346	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ncnn1C)C2	1799220034	HGNADQXVEOUZKC-BTTYYORXSA-N	442.432	1.214	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C#Cc1ccc(Cl)cc1)C2)[C@@H](F)Br	1799343494	YHBGWEJAVDZNEP-DLTLXFJOSA-N	443.700	1.972	50	20	IDGD	
N#Cc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](O)CCl)C3)cc(C(F)(F)F)c1	1799783897	ICEFPMVXGXTQSN-OCVGTWLNSA-N	445.825	1.380	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(F)c(F)cc1F)c1ccc(B(O)O)cc1	1800377276	YJLOZHRCLYRWLM-QDMKHBRRSA-N	432.207	1.349	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCOCCOCCOC	1800836721	DGBVBDMJIYUFSL-ZMMAXQRCSA-N	434.961	1.053	50	20	IDGD	
COc1cc(CCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CCC(=O)NN(C)C)ccn1	1802332459	CXBUCXQNYLVQIP-BCDXTJNWSA-N	431.537	1.034	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2n[nH]c3ccccc23)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803143026	RDVLQJWKJFBECT-UCLAIMLFSA-N	427.892	1.877	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)Cn2cnc3ccccc32)[C@@H]1c1cccnc1)[C@H](O)CCl	1803146764	PZYHQAJJHOHIPG-LDQXTDLNSA-N	441.919	1.737	50	20	IDGD	
C[C@H](Cc1ccncc1)C(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1	1803148887	YEAFSKWJNHHQRC-XCLNPWKQSA-N	430.936	1.961	50	20	IDGD	
Cc1ccn(CC(=O)NC[C@@H]2CCN(C(=O)[C@@H](F)Br)[C@H]2c2cccnc2)n1	1804623852	RBXOOJXXJSTNBY-BHYGNILZSA-N	438.301	1.983	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)c1cc(O)nc(Cl)c1	1805031704	GQTVZABBCKYAKP-QEORTHHSSA-N	439.299	1.755	50	20	IDGD	
Cn1ncnc1C(=O)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@@H]1c1cccnc1	1805280414	ZEGYDTYAXAHBKK-XQQFMLRXSA-N	425.262	1.220	50	20	IDGD	
Cc1ccc(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)cn1	1805453570	CGYJIUZKGQKUAS-KNQAVFIVSA-N	444.300	1.098	50	20	IDGD	
O=C(CCc1ccccn1)N1CCCC2(CCN(C(=O)c3ccc(B(O)O)cc3)CC2)C1	1807253645	WZYFDTWPBDNFGQ-UHFFFAOYSA-N	435.333	1.239	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1CCN(C(=O)c2c[nH]c(=O)cn2)[C@H]1c1cccnc1	1808304574	INSWGCNTFGQLIN-AXHNFQJDSA-N	438.315	1.721	50	20	IDGD	
CC[C@H](C(=O)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1)N(CC)CC	1809978279	YRRCHPWWYXXIMB-OAQYLSRUSA-N	443.397	1.332	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCC2(CCCN(C(=O)c3cnc(O)nc3O)C2)CC1	1810869904	IGSWSRPWGYQBPA-KRWDZBQOSA-N	431.320	1.969	50	20	IDGD	
C=C[C@H](O)C(C)(C)C(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1813072415	DMCDMKDUGHTJSW-BBTUJRGHSA-N	445.564	1.034	50	20	IDGD	
C#CCCCCC(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1813073724	LVJMVTRPFLFBDS-XXBNENTESA-N	427.549	1.654	50	20	IDGD	
COc1cc(C(=O)N2CC[C@H](CNC(=O)C(Cl)Cl)[C@@H]2c2cccnc2)n(C)n1	1813077056	GFEFJBRKIWRSEH-DOMZBBRYSA-N	426.304	1.947	50	20	IDGD	
Cc1nn(C)c(C)c1CC(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1	1813415574	MMDCYBXXLZZPFC-XKGZKEIXSA-N	433.940	1.280	50	20	IDGD	
COc1nccc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@@H](O)CCl)CC3)c1F	1815813298	SWWALTMNEXNNPF-KWQFWETISA-N	428.873	1.511	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1)c1cncn1-c1ccncc1	1816220603	UWSNWUNNFBNOCD-WBVHZDCISA-N	443.895	1.896	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)CC[C@@H]2CCOC2)[nH]n1)c1cccc(B(O)O)c1	1817479526	PATWJZGHWHYVLT-DNVCBOLYSA-N	440.309	1.212	50	20	IDGD	
CC(=O)C(C)(C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819401921	XGLLPZVHIVMHRP-MRXNPFEDSA-N	441.492	1.329	50	20	IDGD	
CC[C@@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(=O)n3[nH]cnc3n2)[nH]n1	1820853083	GPBMEDDIFTZKFR-MFKMUULPSA-N	432.872	1.464	50	20	IDGD	
COc1ccc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@@H](O)CCl)CC3)c(O)c1	1821962598	CAZQZLFAPDLKBV-OTYXRUKQSA-N	425.894	1.683	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(CO)on2)[nH]n1	1822190647	SPGNPKLLPQUCRD-RNCFNFMXSA-N	426.271	1.979	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccnc(Cl)n2)[nH]n1	1822414292	AAIKUUMICCQKMC-CQSZACIVSA-N	448.915	1.532	50	20	IDGD	
C[C@H](C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)n1cccc1	1822671623	NGZPRSRJQKOXIN-DNVCBOLYSA-N	435.293	1.458	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)CCl)CC2)c1cc(O)cc([N+](=O)[O-])c1	1823640453	OQXQKTJLFJXLIJ-RNCFNFMXSA-N	440.865	1.582	50	20	IDGD	
Cc1cccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)n1	1825848506	BCQZOJNFODQINR-JOCHJYFZSA-N	435.333	1.617	50	20	IDGD	
Cc1nc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)co1	1827055944	KTYPJIIDQYRLHB-FQEVSTJZSA-N	425.294	1.210	50	20	IDGD	
CC(=O)Nc1ccccc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](O)CCl)CC2	1827717807	AAWSKVMQFDRKSA-IAQYHMDHSA-N	436.921	1.927	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H]2CCCO2)CC1	1828925101	DHKOKLBFNCUWSV-RTBURBONSA-N	429.521	1.097	50	20	IDGD	
COCc1c[nH]c(C(=O)N2CCCC[C@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)c1	1829631002	KSDRETJEYCYIMM-FQEVSTJZSA-N	447.580	1.767	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)n[nH]1	1829729723	SXQQETODRXPRSQ-IBGZPJMESA-N	439.520	1.264	50	20	IDGD	
CCNC(=S)NCC(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H](C)Br)CC1	1831092692	AJHPHHUAEFUBPU-HIFRSBDPSA-N	447.443	1.874	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C=N/N3CCCCC3)C2)C1	1831652250	XGGDBTRHJAINIV-NXOUIPOBSA-N	428.961	1.322	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(Cl)ncn3)C2)C1	1831654422	KTRKVIGAKWQZKD-ACJLOTCBSA-N	431.320	1.608	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3cccc(C)n3)CCO2)C1	1832618666	NHECSSIWOZYRAC-GHTZIAJQSA-N	439.940	1.033	50	20	IDGD	
Cc1cccc(C(=O)N2CCC(N3CCC(NC(=O)[C@@H](O)CCl)CC3)CC2)c1F	1833306682	XHKQCSBWUHJTSV-SFHVURJKSA-N	425.932	1.919	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@H](C)CS(C)(=O)=O)CC2)CC1	1833483864	AGYLPXDUPLLZJO-RHSMWYFYSA-N	436.018	1.256	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3cc[nH]n3)CC2)CC1	1833564373	FIMYLWWQHJYFSZ-HNNXBMFYSA-N	426.359	1.768	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)CBr)C3)C2)c(C)o1	1834090615	OCGCPQJJZNKDDS-BFUOFWGJSA-N	443.338	1.997	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCBr)CCO3)C2)ccc1O	1834823726	FZUDCDSKHHQVDJ-LJQANCHMSA-N	441.322	1.556	50	20	IDGD	
CCC(C)(C)C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1	1835738240	OJYSTFHWTJAVNC-UHFFFAOYSA-N	444.580	1.307	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cn4ncccc4n3)CC2)CC1	1838245167	XHDIJBARIDZJDE-QGZVFWFLSA-N	449.939	1.595	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCC(OC2CCN(C(=O)c3c[nH]c(=O)cn3)CC2)CC1	1838538889	QCNMVSYRIVCUIA-IBGZPJMESA-N	445.347	1.618	50	20	IDGD	
CCNC(=S)NCC(=O)N1CCC(OC2CCN(C(=O)[C@@H](Cl)CC)CC2)CC1	1838637362	NBYQMUCDAFLYEQ-INIZCTEOSA-N	433.018	1.486	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccc(OC)cc3C#N)CCO2)C1	1839133016	XUUZMRWZJZJKMO-KNQAVFIVSA-N	449.935	1.583	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(F)cn3)C2)C1	1839151465	SDVFXCCJGVWMGX-QZTJIDSGSA-N	434.295	1.527	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)ON=C(C)C)CCO2	1839228277	YCEADPKGTZSCBB-MPGHIAIKSA-N	448.358	1.417	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(Cl)c(F)c3)CCO2)C1	1839272491	QIQHIONVDBHNPK-KXBFYZLASA-N	449.306	1.803	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cncc(O)c3)C2)C1	1839966854	RNCHPFFLOLCXTP-MAUKXSAKSA-N	442.310	1.031	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)/C=C/c3cnc[nH]3)C2)C1	1839967247	GVBFBPRUJXALED-FDFOOHLBSA-N	441.326	1.053	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(C#N)cc3)C2)C1	1840034395	JSOHAEUOJFOEBS-AUUYWEPGSA-N	436.306	1.412	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3c(F)cccc3F)C2)C1	1840034434	LAIQXMWBRFGBMT-XIKOKIGWSA-N	447.276	1.818	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cncc(O)c3)CCO2)C1	1840064329	GBYBKBRHQSXQNK-CRAIPNDOSA-N	442.310	1.031	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccnc3Cl)C2)C1	1840149266	KETIRYRHCCYNRO-RDTXWAMCSA-N	432.304	1.059	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4cnccc4c3)C2)C1	1840152457	IZPKHLGDUMZQLS-SIKLNZKXSA-N	447.919	1.559	50	20	IDGD	
O=C(CCc1cccc(O)c1)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1840268157	KFDOFVIQCWIDPE-IBGZPJMESA-N	431.316	1.585	50	20	IDGD	
C[C@H](Oc1ccccn1)C(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1840422812	LDMGOKRNUZLQEZ-HRAATJIYSA-N	439.940	1.570	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)c(O)c1	1840668974	RJCMWCPMURPZIF-NRFANRHFSA-N	436.581	1.622	50	20	IDGD	
COc1ccc(/C=C/C(=O)N2CC3(CCCN3C(=O)[C@H](O)CCl)C2)c(OC)c1OC	1841347633	AKZQTBMMAPPUBI-PMGBHYCQSA-N	438.908	1.529	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H]1CCC(=O)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1	1841351237	JTOLEULMMUSMDJ-CVEARBPZSA-N	443.972	1.969	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)[C@@H](C)Nc2cccnc2)C1	1842924421	ZQKBSHODZHEEMA-SXJXFNOXSA-N	437.504	1.219	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1cc3cnccc3[nH]1)C2	1843416138	FCHNMKWVHUDQNO-VULFUBBASA-N	433.472	1.514	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)CCCCn1cccc1)C2	1843416348	ZMWNLRBQVIEWKQ-XIEYBQDHSA-N	438.532	1.996	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@H]2CCN(C(=O)OC(C)(C)C)C2)C1	1843905759	RFPIPEQTIYYNAA-GJZGRUSLSA-N	429.945	1.701	50	20	IDGD	
C[C@H](NC(=O)c1ccc(F)cc1)C(=O)N1CC2(CCCN2C(=O)[C@H](F)Br)C1	1845219114	VTAYDJYGNVXXNS-FZMZJTMJSA-N	444.276	1.838	50	20	IDGD	
Cc1ncc(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)[nH]1	1847908177	NAMYCTQKDGZPJS-QEJZJMRPSA-N	425.917	1.666	50	20	IDGD	
O=C(CN1CCSC1=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	17633487	YWWOKMWCRSSKOJ-UHFFFAOYSA-N	437.485	1.318	50	20	IDGD	
Cc1ccc(CC(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)cc1	26362694	IUCCXZXFCRFKHB-UHFFFAOYSA-N	445.541	1.339	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCC([C@H](O)c3ccccc3)CC2)cc1OC	109094254	ZSTZFHHHWPAYCK-JOCHJYFZSA-N	427.501	1.910	50	20	IDGD	
CC(C)(C)NC(=S)NNC(=O)CCNS(=O)(=O)c1c(Cl)cccc1Cl	726138267	MSICSFHNPOGXNX-UHFFFAOYSA-N	427.379	1.956	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NC[C@@H]1CCN(c2ccc(Cl)cc2)C1	726245436	OAVIGTFVPVBPOM-ZDUSSCGKSA-N	435.937	1.988	50	20	IDGD	
Cn1c(SCC(=O)NNC(=O)COc2ccc(C#N)cc2)nnc1-c1cccs1	726765360	KEVJNBLSYSHRJA-UHFFFAOYSA-N	428.499	1.734	50	20	IDGD	
C[C@H](CC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)NC(=O)C1CCCCC1	727293956	IHRMZGSRRMURNJ-LJQANCHMSA-N	443.592	1.821	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)NC2CCN(c3ccc(C#N)cn3)CC2)cc1OC	727481214	YIZZQTAZOVFQEJ-UHFFFAOYSA-N	438.488	1.974	50	20	IDGD	
COc1ccc(Cl)cc1N1C[C@@H](C(=O)N([C@@H]2CCS(=O)(=O)C2)N(C)C)CC1=O	728178136	CDESOZOUDXMZCZ-GXTWGEPZSA-N	429.926	1.194	50	20	IDGD	
CN(C)N(C(=O)c1cccc(CN2C(=O)c3ccccc3C2=O)c1)[C@H]1CCS(=O)(=O)C1	728179587	MKRYPMCDQBRESN-KRWDZBQOSA-N	441.509	1.589	50	20	IDGD	
CCN(C)[C@@H](C(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1)c1ccccc1	728600660	ZBUWGDMEBHPTJV-HXUWFJFHSA-N	432.546	1.456	50	20	IDGD	
O=C(NN=Cc1ccccc1OCC(=O)N1CCCC1)C1CCN(c2ncccn2)CC1	728783809	HQEFHPUCCMRQOK-UHFFFAOYSA-N	436.516	1.845	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)C[C@@H](C)S(=O)(=O)c2ccc(F)cc2)cc1	729128896	IZQFBGXUYCKQDD-CQSZACIVSA-N	436.461	1.691	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)Cn1ccc2ccccc21)c1cccc(S(=O)(=O)N(C)C)c1	729609982	RKIQXIHJYWFFCD-OAHLLOKOSA-N	443.529	1.983	50	20	IDGD	
C[C@H]1COCCN1CCNC(=O)NNC(=O)[C@@H](C)Oc1cccc(Br)c1	729614203	JQYCREMEMYARFR-QWHCGFSZSA-N	429.315	1.268	50	20	IDGD	
O=C(CCc1nc(O)c2cnn(-c3ccccc3)c2n1)NNC(=O)CCc1ccccc1O	730034381	OPMXVGHAJOATNX-UHFFFAOYSA-N	446.467	1.940	50	20	IDGD	
COc1cc(I)c(Cl)cc1C(=O)NNC(=O)Cc1cc[nH]n1	730101927	GIHNITHKAOSWDZ-UHFFFAOYSA-N	434.621	1.680	50	20	IDGD	
CN1CCN(C(=O)c2ccc(CNC(=O)NNC(=O)c3cccc4ncccc34)cc2)CC1	730115782	VGIKQGFPXVVJNV-UHFFFAOYSA-N	446.511	1.767	50	20	IDGD	
C[C@@H](NC(=O)OC(C)(C)C)C1CCN(CC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)CC1	730267404	NYXNYMYNBRJAOE-CQSZACIVSA-N	449.508	1.981	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2cccc(Br)c2O)ccc1Cl	730273357	RRPLKYCCHQVDEF-UHFFFAOYSA-N	448.682	1.530	50	20	IDGD	
C[C@H](NC(=O)c1ccc(Br)s1)C(=O)NNC(=O)COc1ccccc1O	730778900	YOMHBKIMKQHILJ-VIFPVBQESA-N	442.291	1.561	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2ccc(F)cc2Br)ccc1S(N)(=O)=O	730842203	BKBWQFNIBKQQKR-UHFFFAOYSA-N	430.255	1.619	50	20	IDGD	
CN1CCN(C[C@@H](NC(=O)NNC(=O)COc2ccccc2O)c2ccccc2)CC1	730912352	SYPOCUPKDZDTKP-GOSISDBHSA-N	427.505	1.090	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)N[C@@H](C)C(=O)N2CCS(=O)(=O)CC2)c(C)n1CCC(C)C	731477581	XVBHJGOWWVBZQB-NNIWKIFQSA-N	448.589	1.820	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)N1CCC(n2cc(Br)cn2)CC1	731683209	MWQKFTPGYYCXHD-UHFFFAOYSA-N	439.270	1.046	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2C(=O)NC3(CCCC3)C2=O)cc1Br	732035772	MMTLZVSCCBKEFN-UHFFFAOYSA-N	439.266	1.083	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)c2ccc(OCC(F)(F)C(F)F)nc2)C[C@@H](C)O1	732260755	HQFYOSDLTYQVMV-VXGBXAGGSA-N	436.406	1.621	50	20	IDGD	
CCCCN(C)CCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	732889440	PESOUVGBGWHZNH-UHFFFAOYSA-N	425.555	1.147	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)C2CCS(=O)(=O)CC2)cc(OCC)c1OCC	732948974	BVDVOURMINSKTL-UHFFFAOYSA-N	428.507	1.469	50	20	IDGD	
CSCC[C@@H](NC(=O)Cc1ccccc1)C(=O)NNc1nc2ccccc2c(=O)n1C	733261160	MBAHWEFZPPFWEL-GOSISDBHSA-N	439.541	1.857	50	20	IDGD	
C[C@H]1CC(C)(C)C[C@@]2(C1)NC(=O)N(CC(=O)NNc1nc3ccccc3c(=O)n1C)C2=O	733262376	SWKACRATDXCVKS-WHEQGISXSA-N	440.504	1.513	50	20	IDGD	
CN(CC(=O)NNC(=O)c1ccc(F)cc1)C[C@@H](O)COc1ccc(C(F)(F)F)cc1	733997074	JWYBJYZAPFBPND-MRXNPFEDSA-N	443.397	1.977	50	20	IDGD	
CN1C(=O)C[C@@H](C(=O)OCC(=O)NNC(=O)c2ccccc2)[C@@H]1c1cccc(Cl)c1	734637498	RYYFNLITGMNAAG-APWZRJJASA-N	429.860	1.864	50	20	IDGD	
C[C@@H](NC(=O)C1CCCCC1)C(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	734825442	FRSDKZYOBDAKIE-CQSZACIVSA-N	439.557	1.801	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)Cc1ccc(S(=O)(=O)C(F)F)cc1	740642264	RTORFZJCNOABBD-NSHDSACASA-N	430.404	1.979	50	20	IDGD	
COC(=O)c1ccc(-c2nnn(CC(=O)NNC(=O)c3cc(Cl)ccc3OC)n2)cc1	741855778	PLNPFWAQEGDISP-UHFFFAOYSA-N	444.835	1.250	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1ccc(OC2CCOCC2)cc1	742036159	GOBAJANDIZNIRT-UHFFFAOYSA-N	446.529	1.921	50	20	IDGD	
CS(=O)(=O)c1ccc(Sc2ccccc2C(=O)NNC(=O)N2CCOCC2)cc1	742595166	DIXOEFQGIVZTLG-UHFFFAOYSA-N	435.527	1.928	50	20	IDGD	
O=C(CCN1C(=O)[C@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O)NNc1nc(-c2ccc(Cl)cc2)no1	742668641	AUCTYRWQSUPYKS-UXOAXIEHSA-N	431.836	1.386	50	20	IDGD	
CC(=NNC(=O)Nc1ccc(C(=O)O)cc1)c1ccc(S(=O)(=O)N2CCNCC2)cc1	743443211	BUMUXNYZWFADJV-UHFFFAOYSA-N	445.501	1.524	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)N[C@@H]1CC(=O)N([C@@H]2C[C@H]2c2ccccc2)C1	743508309	NKWMFCFMYKAYKW-FGTMMUONSA-N	432.484	1.744	50	20	IDGD	
CS(=O)(=O)N1CCC(CNC(=O)NNC(=O)Nc2ccc(OC(F)F)cc2)CC1	743575591	JGHHLEZUHNUYBJ-UHFFFAOYSA-N	435.453	1.295	50	20	IDGD	
COCCCNC(=O)[C@@H](C)N1CCN(C(=O)NNC(=O)c2cccc3ccccc23)CC1	743630233	QFOVCRCNKHOMTA-QGZVFWFLSA-N	441.532	1.353	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(Cl)cc2)cc1	743827292	DGHILRNWTIVZNX-UHFFFAOYSA-N	439.925	1.879	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)CCN2C(=O)[C@H](C)Oc3ccccc32)c1	744531620	QRPFYWQCVMGPBH-HNNXBMFYSA-N	425.441	1.503	50	20	IDGD	
CCN(C)[C@@H](C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1)c1ccccc1	744621136	RKJCLXFDLNXSQQ-HXUWFJFHSA-N	432.546	1.844	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)c1nc(C(C)(C)C)no1	745917622	NHAVRWHXVRXMJJ-INIZCTEOSA-N	443.552	1.971	50	20	IDGD	
COC1(CNC(=O)NNC(=O)[C@@H](C)Oc2cccc(Br)c2)CCOCC1	746703457	HYCBFZCJJJMGPQ-GFCCVEGCSA-N	430.299	1.742	50	20	IDGD	
COc1ccc([C@]2(C)NC(=O)N(CC(=O)NNC(=O)c3cccc4cccnc34)C2=O)cc1	747429146	XSXDTSQFQSYTKJ-QHCPKHFHSA-N	447.451	1.472	50	20	IDGD	
CC[C@](C)(CNC(=O)OC(C)(C)C)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	747868432	ZIIJRAYTEXEGEI-OAQYLSRUSA-N	434.541	1.781	50	20	IDGD	
CCN(c1ccccc1)S(=O)(=O)c1ccc(C(=O)NNc2nccn(C)c2=O)cc1	747943162	PEUKGRQVDYQXBK-UHFFFAOYSA-N	427.486	1.752	50	20	IDGD	
Cc1cc(N2CCC(NC(=O)NNC(=O)c3cc([N+](=O)[O-])ccc3O)CC2)nc(C)n1	749614577	DIMABAWHYPQJJX-UHFFFAOYSA-N	429.437	1.320	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)NCCC(=O)NNC(=O)CCc2ccccc2)cc1	750093736	GMCQZFYBPLEBNB-UHFFFAOYSA-N	432.502	1.094	50	20	IDGD	
Cn1c(O)nc2ccc(C(=O)NNC(=O)NC3CCN(C(=O)OC(C)(C)C)CC3)cc21	751982045	ZZMFTXYIXOAXIT-UHFFFAOYSA-N	432.481	1.622	50	20	IDGD	
CS(=O)(=O)NCc1ccc(C(=O)NNC(=O)Cc2nc(-c3ccccc3)cs2)o1	753577861	RUHKXDYXYYXROL-UHFFFAOYSA-N	434.499	1.456	50	20	IDGD	
C[C@@H](C(=O)N1CCCC1)N1CCN(C(=O)NNC(=O)c2c(Cl)cccc2Cl)CC1	755149325	PQKLZPUMNZLAIY-ZDUSSCGKSA-N	442.347	1.976	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NN=CC1CCOCC1)N(S(C)(=O)=O)CC2	755573413	VUKKEBNNFTXGNX-KRWDZBQOSA-N	439.534	1.481	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)NCCN3C(=O)[C@@H]4[C@@H](C3=O)[C@H]3C=C[C@H]4C3)n[nH]2)cc1	756104099	XNRGEOGGWFRRIL-LNMJFAINSA-N	448.483	1.136	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)Nc2cnn(CCN3CCOCC3)c2)cc1OC	756826470	GDDSCRYYMFCAMH-UHFFFAOYSA-N	446.508	1.479	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NNc2ccc(C(N)=O)nn2)ccc1Cl	757392955	SQVANCQWFYPXAY-UHFFFAOYSA-N	426.886	1.016	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)Nc2cccc(S(=O)(=O)NC)c2C)o1	757720916	HMUAEIVBFAFQKA-UHFFFAOYSA-N	437.522	1.804	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)Nc2ccnc(OCC(F)(F)F)c2)c2ccccc2c1=O	757926371	SMPNOPORWAZKND-UHFFFAOYSA-N	436.350	1.736	50	20	IDGD	
O=C(c1cccn1Cc1ccncc1)N1CCN(S(=O)(=O)CBr)CC1	758526285	AYWLXRAAHLMMNI-UHFFFAOYSA-N	427.324	1.371	50	20	IDGD	
COC(=O)CS(=O)(=O)Cc1ccc(CNC(=O)NNC(=O)c2cc(C)oc2C)cc1	760194789	LIHOAHGARVBJCX-UHFFFAOYSA-N	437.474	1.128	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cnc([C@@H]3CCCO3)s2)cc1OC	760663778	JHUZGHLZQZQAFX-ZDUSSCGKSA-N	435.458	1.630	50	20	IDGD	
O=C(NNC(=O)c1ccc(-c2cc[nH]n2)s1)c1cccc(S(=O)(=O)N2CCCC2)c1	761389528	FUZLDJPXGONAGB-UHFFFAOYSA-N	445.526	1.998	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNc2nccc(N3CCOCC3)n2)c1	762856505	UJWXYMKUQFVIPU-UHFFFAOYSA-N	434.522	1.101	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)c3sccc3S(=O)(=O)N(C)C)n[nH]2)cc1	762952300	DHIGFKDKTJSENR-UHFFFAOYSA-N	433.515	1.772	50	20	IDGD	
Cc1n[nH]c(C)c1[C@@H](C)CC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	763272400	JGFPQLSVMIMMSL-ZDUSSCGKSA-N	433.534	1.766	50	20	IDGD	
O=C(NNC(=O)c1ccccn1)C(=O)Nc1ccc(C(=O)NCc2ccc(F)cc2)cc1	763462839	CENSGQIWXMERRM-UHFFFAOYSA-N	435.415	1.550	50	20	IDGD	
COc1ccc(NC(=O)c2ccc(NC(=O)C(=O)NNC(=O)c3ccccn3)cc2)cc1	763467536	PWXFGOHBGBYGFH-UHFFFAOYSA-N	433.424	1.742	50	20	IDGD	
CCCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1Cl	763471797	LCWTWIPSXSCNJL-UHFFFAOYSA-N	447.835	1.788	50	20	IDGD	
CN(C(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2O)cc1)c1ccccc1	763528620	CGMYFNCGMOJZDQ-UHFFFAOYSA-N	446.463	1.997	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)Nc1ccc(OC(F)F)c(F)c1	763570564	FYAAEBDNIMYYQN-AWEZNQCLSA-N	425.319	1.353	50	20	IDGD	
CCOC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1	763574452	ZKCICVQQGMKUSH-MRXNPFEDSA-N	428.401	1.181	50	20	IDGD	
CCOC(=O)N(C)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2OC)cc1	763656854	GKIMPBBDCMCWOM-UHFFFAOYSA-N	444.444	1.453	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(C)ccc1-n1cc(C)cn1	763663948	PAOWOFPAYMIMMJ-UHFFFAOYSA-N	437.456	1.663	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2cccc(CN3CCOC3=O)c2)c1	763666066	WFQYISAKXFEZDZ-UHFFFAOYSA-N	440.456	1.421	50	20	IDGD	
O=C(COc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1ccc(OCC(F)(F)F)nc1	763684404	KXPZVSDXVJNQEO-UHFFFAOYSA-N	446.769	1.841	50	20	IDGD	
O=C(CSc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1cccc(Cn2cncn2)c1	763732178	DNXUQUDRBUBYPC-UHFFFAOYSA-N	444.904	1.858	50	20	IDGD	
O=C(NNC(=O)c1cc2c(s1)CCC2)C(=O)Nc1cccc(-c2nnnn2C2CC2)c1	763784046	TZHZCXUXGLOEQT-UHFFFAOYSA-N	437.485	1.625	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(C[S@@](=O)CCOC)c2)cc1	763832393	PZPPWENUWVFNNY-PMERELPUSA-N	431.514	1.544	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)c(OC[C@H]2CCCO2)c1	763838213	QGBBSJROTHANJA-QGZVFWFLSA-N	445.447	1.857	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cccnc2N2CCOCC2)c1C	763852025	UCUZSLJCBJIDFT-MRXNPFEDSA-N	441.488	1.088	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)n(Cc2ccccc2)n1	763865281	JVWRHYFIFDTKIE-OAHLLOKOSA-N	439.447	1.932	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(C(C)=O)cc2)cc1C	763870509	ACKKXJYYRNYOBQ-AWEZNQCLSA-N	441.440	1.538	50	20	IDGD	
CCOc1cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(C(C)=O)cc2)ccc1OC	763873039	RUXBZZXJGHGGFA-AWEZNQCLSA-N	443.456	1.850	50	20	IDGD	
O=C(CCSc1ccc(F)cc1)NNC(=O)C(=O)Nc1cnn(-c2ncccn2)c1	763896050	WUDUEMDICMCEDY-UHFFFAOYSA-N	429.437	1.070	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)C(=O)Nc1cccc(CSC2CCCC2)c1	764002497	NDUPNCJXVGTDNO-CQSZACIVSA-N	439.559	1.383	50	20	IDGD	
Cc1cc(S(C)(=O)=O)ccc1NC(=O)C(=O)NNC(=O)c1cccc(C(F)(F)F)c1	764040247	IUOVTWVWKUEIIG-UHFFFAOYSA-N	443.403	1.817	50	20	IDGD	
CSc1cc2c(cc1NC(=O)C(=O)NNC(=O)[C@@H]1Cc3ccccc3O1)OCCO2	764152433	DNGNWBJBQSZFLL-INIZCTEOSA-N	429.454	1.269	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2O1)C(=O)Nc1cc(F)ccc1OC[C@H]1CCCO1	764166621	FDAAWFQJJCAALS-BEFAXECRSA-N	443.431	1.473	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2O1)C(=O)Nc1cc(F)c(Br)c(F)c1	764167561	KUGWNOCDUDNJRL-ZDUSSCGKSA-N	440.200	1.817	50	20	IDGD	
CC(C)(C)OC(=O)NCc1cccc(NC(=O)C(=O)NNC(=O)Cc2ccccn2)c1	764265017	XHJYPDDLKVLSGI-UHFFFAOYSA-N	427.461	1.435	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)C(=O)Nc1ccn(-c2ccccc2Cl)n1	764288481	HNULZFAJNUSURQ-UHFFFAOYSA-N	427.848	1.950	50	20	IDGD	
Cc1cccc(C(=O)N2CCCC2)c1NC(=O)C(=O)NNC(=O)c1ccc(O)c(Cl)c1	764349329	JDUFAEJNRAEQKF-UHFFFAOYSA-N	444.875	1.990	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)C(=O)Nc1ccc(-n2nccc2C(F)(F)F)cc1	764355970	NQQVHXZVVCQVDD-UHFFFAOYSA-N	432.362	1.615	50	20	IDGD	
CCOc1cc2c(cc1NC(=O)C(=O)NNC(=O)COCc1ccccc1)O[C@H](C)C2	764363512	QTFGXBXQJUXETQ-CQSZACIVSA-N	427.457	1.711	50	20	IDGD	
CC(C)Oc1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)cn1	764389038	VTIPDISJBNEXIA-UHFFFAOYSA-N	426.408	1.798	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNS(=O)(=O)c3ccc(C#N)cc3F)CC2)cc1	765125462	FNPOKCOHIBKLQC-UHFFFAOYSA-N	445.520	1.133	50	20	IDGD	
COC(=O)NNC(=O)C(=O)Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1	765371471	BROFAIIMOWZCKZ-UHFFFAOYSA-N	425.489	1.377	50	20	IDGD	
CCOC(=O)[C@@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)OC(C)(C)C)cc1F	765390224	KQFWNTDXHKHUCA-SNVBAGLBSA-N	440.428	1.002	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C2CCN(S(=O)(=O)c3ccc(C(C)C)cc3)CC2)n[nH]1	765587365	JMSWOQYBVQFULE-UHFFFAOYSA-N	433.534	1.703	50	20	IDGD	
CCOc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)c3cc(C)[nH]n3)c2)cc1	765587606	ZRVAUCGUQLNWAF-UHFFFAOYSA-N	443.485	1.992	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2ccc(NS(=O)(=O)c3ccc(F)c(F)c3)cc2)n[nH]1	765588045	RTXFQLIXCAKZJE-UHFFFAOYSA-N	435.412	1.872	50	20	IDGD	
CC(C)c1noc(CCC(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)n1	765754671	MTCYJDMZACWOCZ-UHFFFAOYSA-N	448.955	1.744	50	20	IDGD	
Cc1cccc([N+](=O)[O-])c1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	766063374	AEDRXZBRHPFVAJ-UHFFFAOYSA-N	432.458	1.763	50	20	IDGD	
CCOC(=O)c1cnc(C)c(C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)c1	767192197	SHXXUFNGIUSGLS-UHFFFAOYSA-N	437.456	1.932	50	20	IDGD	
N#Cc1ccc(S(=O)(=O)N2CCN(S(=O)(=O)CBr)CC2)c(Cl)c1	767850476	KSQKQHQLDLYJKI-UHFFFAOYSA-N	442.744	1.200	50	20	IDGD	
CCOC1CC(CNC(=O)NNC(=O)c2cccc3ncccc23)(N2CCOCC2)C1	767887096	BZKPPBROHQTFMH-UHFFFAOYSA-N	427.505	1.449	50	20	IDGD	
CC[C@H](N=c1nn[nH]n1-c1ccccc1)C(=O)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	768288908	HSAYWFXRGJXXES-INIZCTEOSA-N	449.450	1.265	50	20	IDGD	
CN(CCCC(=O)NNC(=S)Nc1ccccn1)S(=O)(=O)c1ccc(F)cc1	768579355	ZABDKXDOYPNKNU-UHFFFAOYSA-N	425.511	1.639	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)c3cnn(-c4ccccc4F)c3-n3cccc3)nc21	770973185	LMZPKSDRGPMKHL-UHFFFAOYSA-N	433.407	1.941	50	20	IDGD	
CCCCS(=O)(=O)N1CCC[C@@H]1C(=O)NNC(=O)[C@@H](C)Oc1cccc(Cl)c1	772969739	OQQHKOUYIWHUBG-CZUORRHYSA-N	431.942	1.849	50	20	IDGD	
CCOc1ccc2c(c1)[C@H](NC(=O)NNC(=O)c1csc(N3CCOCC3)n1)CCO2	773131770	MOJPBSJLOBIQKT-OAHLLOKOSA-N	447.517	1.846	50	20	IDGD	
COC(=O)c1cc(OC)c(S(=O)(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)s1	773251809	OMGDBLSXYTVWFP-VIFPVBQESA-N	448.906	1.974	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)[C@H]2CC(=O)N(Cc3ccco3)C2)C1	773411784	RIJVSWLTGVEIKM-GJZGRUSLSA-N	434.493	1.423	50	20	IDGD	
CCCCOc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cn1	773495595	CUHBZNLJLOPSRR-UHFFFAOYSA-N	434.474	1.064	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)oc(=O)n2C	774007915	CRBYDPRJLZXELO-SNVBAGLBSA-N	432.820	1.338	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN[C@H](C)c2cccc(N3CCCC3=O)c2)cc1OC	775281127	UGPLJKUWCLEYCG-OAHLLOKOSA-N	440.500	1.942	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)Nc1ccnn1[C@@H]1CCS(=O)(=O)C1	776053573	DCZQUXXRSDNPDJ-DGCLKSJQSA-N	425.442	1.002	50	20	IDGD	
Cc1cc(C)c2[nH]cc(C(=O)NNC(=O)c3csc(N4CCOCC4)n3)c(=O)c2c1	776102984	TZRZVNUPFHJXHP-UHFFFAOYSA-N	427.486	1.513	50	20	IDGD	
COCCO[C@@H]1COCC[C@@H]1NC(=O)CCC(=O)C(C#N)=C1N(C)c2ccccc2N1C	777395195	UYJDELJKBYMWDQ-LAUBAEHRSA-N	442.516	1.594	50	20	IDGD	
C[C@@H]1C(=O)N(C)CCN1C(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1	777485669	MRVUKCGKJARNOZ-DYESRHJHSA-N	435.528	1.517	50	20	IDGD	
COC(=O)Cc1cccc(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)c1	779011453	JGXHDEBXIONNSX-UHFFFAOYSA-N	446.529	1.095	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@H](C(=O)NNC(=O)c2ccc3ccccc3c2)[C@H](C)O)cc1	779500094	LEIULDDZNIBAJP-YWZLYKJASA-N	441.509	1.637	50	20	IDGD	
CCCCn1c(CCC(=O)NN=c2cc[nH]cc2)nc2cc(S(=O)(=O)N(C)C)ccc21	780761374	WDUQZIBPOMDVDL-UHFFFAOYSA-N	444.561	1.980	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)[C@@H]1C[C@]12CCN(C(=O)OC(C)(C)C)C2	781281968	MDHIZFRSPYQNIA-SBUREZEXSA-N	445.516	1.875	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc2c(c1)CCN2C(=O)C(=O)NNc1ccc(OC)cc1	783037621	STSAJZWQBVCGNU-UHFFFAOYSA-N	446.529	1.758	50	20	IDGD	
CC(C)(C)OC(=O)Nc1ccc(NC(=O)C(=O)NN[C@@]2(C)CCS(=O)(=O)C2)cc1	783426791	ODSHDMCIHZCSJK-SFHVURJKSA-N	426.495	1.170	50	20	IDGD	
CCOc1cc(N2CCOC(C)(C)C2)ccc1NC(=O)C(=O)NNc1cc(C)ncn1	783945347	KRQDUOAHLJAHSJ-UHFFFAOYSA-N	428.493	1.881	50	20	IDGD	
O=C(NNC(=O)C(=O)N1CCCC1)C(=O)Nc1ccccc1Oc1ccc(Cl)cc1	783999308	FGZKNSSILYXUIM-UHFFFAOYSA-N	430.848	1.841	50	20	IDGD	
CCc1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)cc1	784230372	LKUKZSRXQBEPFD-UHFFFAOYSA-N	445.545	1.267	50	20	IDGD	
COc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)C(=O)NNc1ccc(F)c(F)c1F	784820478	VQAJXSTUDHNHGM-UHFFFAOYSA-N	446.407	1.445	50	20	IDGD	
COc1cccc(NNC(=O)C(=O)Nc2ccnn2[C@@H]2CCN(Cc3ccccc3)C2)n1	784846569	TVTNKUUONKZNLK-QGZVFWFLSA-N	435.488	1.816	50	20	IDGD	
CCC[C@@H]1CCc2nc(NC(=O)C(=O)NNC(=O)c3cncc(NC(C)=O)c3)sc2C1	789740721	YTEQUSLOAHZJRF-GFCCVEGCSA-N	444.517	1.801	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@](C)(O)Cn2ccc(C)cc2=O)ccc1OCCC(C)C	790483244	KTMVOWFLWXFCHC-HSZRJFAPSA-N	445.516	1.802	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)N[C@H]1CCN(Cc2ccc(F)cc2)C1=O	790674887	ATEWAYVRYAOPMH-HNNXBMFYSA-N	445.407	1.244	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)c1ccc(C)cc1)C(=O)NNc1nc2ccccn2n1	791249435	UQEAHPWWYVEFBG-HNNXBMFYSA-N	434.547	1.581	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)Nc3ccc(S(=O)(=O)NC)cn3)n[nH]2)cc1	792401519	XHIIFMZCSYICNF-UHFFFAOYSA-N	443.489	1.409	50	20	IDGD	
CN(C)N(C(=O)c1n[nH]c(-c2ccccc2)c1Br)[C@H]1CCS(=O)(=O)C1	792851445	VUDCOLGHQSYKAX-LBPRGKRZSA-N	427.324	1.945	50	20	IDGD	
COc1c(NC(=O)C(=O)NNc2ccnc(Br)c2)cc(Cl)cc1C(N)=O	793051559	RNSNBMOBZMLFMS-UHFFFAOYSA-N	442.657	1.687	50	20	IDGD	
C[C@@]1(C(=O)NNC(=O)CNC(=O)c2ccco2)CCN(C(=O)OCc2ccccc2)C1	793338876	WQVUERCAKYESML-OAQYLSRUSA-N	428.445	1.206	50	20	IDGD	
CN(C)S(=O)(=O)CCNC(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccccc1	794233617	ZVLBBZDCOTWOFN-LGMDPLHJSA-N	426.502	1.378	50	20	IDGD	
Cc1cc(CNC(=O)NNC(=O)C(=O)N2CCCC2)ccc1I	798477816	SBVXDAMSNURJDS-UHFFFAOYSA-N	430.246	1.052	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)N[C@@H]1CCN(C(=O)Nc2ccccc2)C1	801077891	OQZFQKMMGXEMIP-QAPCUYQASA-N	425.445	1.463	50	20	IDGD	
O=C(CCC(=O)N1CCN(c2ccccn2)CC1)NNC(=O)Nc1cc(F)cc(F)c1	802003482	OPXLHDCCFNPHRR-UHFFFAOYSA-N	432.431	1.642	50	20	IDGD	
Cn1cc(S(=O)(=O)N2CCCCC2)cc1C(=O)NNC(=O)Nc1ccc2c(c1)OCO2	802098902	FPEWWSFMCXHURR-UHFFFAOYSA-N	449.489	1.395	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)c1ccc2c(c1)S(=O)(=O)c1ccccc1C2=O	804957785	UZBHPZZDPNWCMP-UHFFFAOYSA-N	446.448	1.796	50	20	IDGD	
O=C(NNc1nccnc1C1CCC1)Nc1cccc(S(=O)(=O)N2CCOCC2)c1	806096288	CYNFRUJXVMJVEB-UHFFFAOYSA-N	432.506	1.914	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)N[C@H](CS(=O)(=O)N(C)C)C(F)(F)F)cc1	806564502	DHYVODJVDGLJRF-GFCCVEGCSA-N	442.485	1.240	50	20	IDGD	
COCCOc1ccc(S(C)(=O)=O)cc1NC(=O)C(=O)NNc1ccc(Cl)cc1	806997404	NKGXGUFBXJDUPA-UHFFFAOYSA-N	441.893	1.851	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCCCN1CCCCCC1=O	807008832	FRUMXYPHOWQXAD-UHFFFAOYSA-N	438.554	1.025	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCCc2ccc3c[nH]nc3c2)cc1	807243797	HKWBTELLSXVDHP-UHFFFAOYSA-N	444.517	1.065	50	20	IDGD	
O=C(NCCNS(=O)(=O)c1cccc(Cl)c1Cl)NNc1nc2ccccn2n1	807455888	YSOZBOZQHOMPHG-UHFFFAOYSA-N	444.304	1.641	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)NC[C@@H](N2CCOCC2)C(F)(F)F)cc1	807541398	MWNWLXUZAXKTCX-CZUORRHYSA-N	448.442	1.446	50	20	IDGD	
Cc1cc(Cl)ccc1S(=O)(=O)NCCNC(=O)NNC(=O)CCc1ccccc1	807547309	ASMHDVYUIIDRQA-UHFFFAOYSA-N	438.937	1.890	50	20	IDGD	
C[C@@H]1[C@H](NC(=O)NNC(=O)c2csc(N3CCOCC3)n2)CCN1Cc1ccccc1	807619970	CWDFWZGMUPNUTD-NVXWUHKLSA-N	444.561	1.587	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CC[C@](CO)(Cc3ccc(F)cc3)C2)cc1OC	808793939	AMGFUGPKRCOEBZ-QHCPKHFHSA-N	445.491	1.531	50	20	IDGD	
O=C(CN1CCCC1=O)NN=Cc1cc2cccnc2n1S(=O)(=O)c1ccccc1	814760823	HRJYGHCOAIHDDV-UHFFFAOYSA-N	425.470	1.346	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)cc1)C1CC1	815582202	AHOPQGMFBNAKIG-UHFFFAOYSA-N	448.483	1.417	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNc2ccc(S(C)(=O)=O)cc2)cc1)[C@@H]1C[C@@H]1C	815585181	ADPKSNMRPIDWHK-ORAYPTAESA-N	444.513	1.933	50	20	IDGD	
Cc1ccc(-c2cncc(F)c2)cc1NC(=O)C(=O)NNC(=O)[C@H]1CCc2nncn2C1	815691512	SFHRJNHDZGSKRZ-AWEZNQCLSA-N	437.435	1.136	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCO1)C(=O)Nc1ccnn1Cc1ccc(Cl)cc1Cl	815778760	FFOHSEZTJZJGFU-CYBMUJFWSA-N	426.260	1.503	50	20	IDGD	
O=C(NNc1nc[nH]n1)[C@H]1CCCN(S(=O)(=O)c2ccc(Br)cc2)C1	816633151	PSIQENQMKLIXQV-JTQLQIEISA-N	429.300	1.111	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Br)cc2F)CC1)NNc1ncncc1F	817077713	OVGGWCKAHSEWKF-UHFFFAOYSA-N	441.280	1.778	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(NC(=S)NNC(=O)CCCNC(=O)C(C)(C)C)c1	825123140	FGERSNVASVFGIJ-UHFFFAOYSA-N	443.595	1.197	50	20	IDGD	
CC(C)[C@H](NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)c1ccc2c(c1)OCCO2	838617008	OJRQVUHMCZBARR-IBGZPJMESA-N	437.460	1.775	50	20	IDGD	
CC(C)c1ccc(-n2cnnc2SCC(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)cc1	913181175	FDVDRWHOEDKICX-CQSZACIVSA-N	437.547	1.065	50	20	IDGD	
CCN1C[C@H](C(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)CC1=O	914754572	CERHUWCJNZHBDB-GOSISDBHSA-N	433.472	1.018	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NNc2ccc(F)cc2)o1	915065529	DGGCZGVTZKQRJI-AWEZNQCLSA-N	425.438	1.892	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NC[C@H](c2cccc(F)c2)N(C)C)c2ccccc2c1=O	915900723	CSXASJIBYNOZOA-GOSISDBHSA-N	440.479	1.802	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)N[C@@H](c3ccccc3)C3CC3)nc2)CC1	916231136	GXIULVDXGZWOGL-FQEVSTJZSA-N	444.561	1.795	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCCc2cnn(-c3ccccc3)c2)c1	916243038	SZDYKKYHOATGAT-UHFFFAOYSA-N	427.486	1.463	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NC[C@@H](C(C)C)N2CCN(C)CC2)ccc1OC(C)C	916257996	HZQOIISXHWSENS-SFHVURJKSA-N	435.569	1.698	50	20	IDGD	
COc1cc(C=NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)ccc1OCC#N	916278199	FNFKAVVTCJPYBN-UHFFFAOYSA-N	430.486	1.677	50	20	IDGD	
COc1ccccc1OCC(=O)NN=C(C)c1ccc(S(=O)(=O)N2CCNCC2)cc1	916296310	FQZVXTRCEMISNK-UHFFFAOYSA-N	446.529	1.208	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)NCc2ccccc2CN2CCCC2=O)cc1C	916413637	IAKATUKZANLAEZ-UHFFFAOYSA-N	437.500	1.895	50	20	IDGD	
O=C(NCc1ccc(N2CCSCC2)cc1)NNC(=O)[C@@H]1COc2ccccc2O1	916626112	SKMGJABRIIMHDD-IBGZPJMESA-N	428.514	1.910	50	20	IDGD	
CCN(CC)CCOc1ccc(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1	917918459	QLTNRSMUZXLESX-UHFFFAOYSA-N	447.561	1.775	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCCC(=O)NC2CCCCC2)nc1	918125701	OIOKFUGRYDOUBY-UHFFFAOYSA-N	440.570	1.577	50	20	IDGD	
CNS(=O)(=O)c1ccc([C@H](C)NC(=O)NNC(=O)COc2ccc(OC)cc2)cc1	919778483	CVEKGSNRMJFZSI-ZDUSSCGKSA-N	436.490	1.074	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)N[C@@H]2CCCOc3ccc(F)cc32)c2ccccc2c1=O	919791398	PFGIVCQZDCEMOZ-MRXNPFEDSA-N	425.420	1.931	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)CN2C(=O)N[C@]3(CCc4ccccc43)C2=O)cc1	919836510	VGWYWSPTEVFUIB-QHCPKHFHSA-N	436.468	1.169	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCc2cccc(NC(=O)[C@H]3CCCO3)c2)cc1OC	920236357	BEWCUSFGGGVWGG-GOSISDBHSA-N	442.472	1.966	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2ccc(C(=O)NNC(=O)CN3CCCC3=O)cc2)cc1	920826495	MFEOGZRJTWAWRR-UHFFFAOYSA-N	430.486	1.179	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)c1ccc2c(=O)n3c(nc2c1)CCCCC3	921301345	WQRUCKMQAYKVOT-UHFFFAOYSA-N	429.477	1.409	50	20	IDGD	
CC(=O)NC[C@@H]1CCn2ncc(C(=O)NNc3nc(-c4ccccn4)nc(C)c3C)c2C1	1326308715	WFSSKDJHDSKDJP-MRXNPFEDSA-N	434.504	1.807	50	20	IDGD	
CC(C)(C)c1ccc(NNC(=O)c2cccc(S(=O)(=O)NC[C@H]3CCCO3)c2)nn1	1339250666	CEKNRHIZDMMUFZ-OAHLLOKOSA-N	433.534	1.988	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCCc3c2cccc3S(C)(=O)=O)cc1OC	1341155612	CYLQJPGSQZEZBR-UHFFFAOYSA-N	447.513	1.321	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnc4ccccn34)C2)C1	1777818020	SQYCJOMEPUYVNB-KUHUBIRLSA-N	435.322	1.809	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4occc4c3)C2)C1	1777944835	CYNSJIMRRYOCGD-HSZRJFAPSA-N	449.467	1.189	50	20	IDGD	
O=C(/C=C\C(=O)NC1CC1)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCBr)C2	1779227465	IYERJOFCSHVLQM-DAFSOKFYSA-N	442.354	1.120	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cn1ccccc1=O)C2	1780712632	BTUQMOBPQOFWOF-UIAACRFSSA-N	444.359	1.599	50	20	IDGD	
O=C(c1cc2n(n1)CCCC2)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781331276	HTODIWKGCGMOBL-PBHICJAKSA-N	429.290	1.353	50	20	IDGD	
O=C(c1ccc(-c2cccnc2)cc1)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1781448049	DRRRBAPJOORXGZ-KNQAVFIVSA-N	429.904	1.792	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Br)C2)c1cncc(O)c1	1782040543	KCIQCVVJTYFPGO-CKEIUWERSA-N	430.274	1.605	50	20	IDGD	
Cc1nccn1CCCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2	1782489729	PQEFSMYGRJVAGZ-MBOZVWFJSA-N	426.945	1.085	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccnc4c(O)cccc34)C2)C1	1782510886	DKTTXJIAMKPYBZ-KKSFZXQISA-N	433.892	1.638	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccc4nonc4c3)CCO2)C1	1783347153	AKIQRGWZKSNFEY-FZKQIMNGSA-N	437.294	1.840	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3nn(C)c4c3CCC4)CCO2)C1	1783347800	OWGQWMDTRCFBAQ-KUHUBIRLSA-N	439.354	1.526	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](OC(C)=O)C(C)C)CCO2	1783349850	UENLFARBPAUHTG-MPGHIAIKSA-N	433.343	1.578	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](C)Br)C3)C2)cc1OC	1783537308	NKWNKBANFYUZIZ-DJJJIMSYSA-N	441.322	1.931	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cc(-c4ccncc4)[nH]n3)CCO2)C1	1783877464	JCKDUMHUWGYDIA-MGPUTAFESA-N	433.896	1.169	50	20	IDGD	
COc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]3C2)ccn1	1783969755	KJHMDRBGXHGMPE-TUUVXOQKSA-N	440.338	1.715	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCNC(=O)c3ccc[nH]3)C[C@@H]21	1784616394	SYGRKWQJOFZITI-CUSZFKRNSA-N	438.956	1.522	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc[n+]([O-])c3)[C@H]2C1	1785501741	UYGFUIVPWDTVMD-VGWMRTNUSA-N	426.311	1.087	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3nc4ccccn4n3)[C@H]2C1	1787263708	QFKLTHOBJRDVMQ-MNUAXYBXSA-N	440.331	1.559	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnn4ccncc34)[C@H]2C1	1788033193	OBZJHXPRBWPZPK-HAHWVIBASA-N	440.331	1.559	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3ON=C(c4ccccc4)O3)[C@H]2C1	1788520015	DTQGVTKQLCMHMZ-QHXHSKPESA-N	435.908	1.718	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc[nH]c4nccc3-4)C[C@@H]21	1788764013	FHYISDCDTPMASZ-WBAXXEDZSA-N	430.581	1.959	50	20	IDGD	
COc1cnc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]3C2)cn1	1789866456	PQSXVDUVMKDYKD-MMNXLFCMSA-N	431.320	1.315	50	20	IDGD	
CC1CCN(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]3C2)CC1	1789921414	HELIKAOBPJCVAS-QBYUYEEZSA-N	434.350	1.389	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CCCN(C)C3)C[C@@H]21	1790962795	BCHJPLBWIWWQMY-VIQHNZTISA-N	430.387	1.481	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3c[nH]c4cnccc34)C[C@@H]21	1791055652	BGAUDCXPABEJFQ-LMMLAZSQSA-N	435.322	1.940	50	20	IDGD	
Cc1nc(N)sc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]2C1	1791057266	AADBBRGNHKWUMO-QTKMDUPCSA-N	431.356	1.410	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4ncccc4[nH]3)C[C@@H]21	1791060825	JLFNXMRAWBXFDO-XREXNNHRSA-N	435.322	1.940	50	20	IDGD	
CN(C)C(=O)c1cccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Cl)C[C@@H]32)c1	1792100303	NDDKHRRTMJQFOW-LUKYLMHMSA-N	425.888	1.516	50	20	IDGD	
O=C(CCOc1ccc(F)cc1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2	1792734043	RZBNUAGNQXPKIP-LZDSYCOUSA-N	447.276	1.875	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCCCCCCCBr)C2)C(O)O	1792801791	RCGBLZASORNLEH-MIFYACCESA-N	435.359	1.012	50	20	IDGD	
CC(C)(C)OC(=O)NC12CC(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)[C@@H](O)CCl)(C1)C2	1793116754	SSRTUCCHUCTBGA-BJEBVQOXSA-N	441.956	1.672	50	20	IDGD	
C=C(Oc1ccccc1O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCBr	1795112989	UASQJWLNOPHBJS-ZSBFGKGUSA-N	439.306	1.659	50	20	IDGD	
Cc1ccc2nc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)c3ccc(B(O)O)cc3)C4)sc2c1	1795354904	WKKMFVUPJXLDJB-BCDXTJNWSA-N	449.341	1.850	50	20	IDGD	
CO[C@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2)c1ccccc1	1795375264	RCFDKGOBHILUKD-MVJTYMMSSA-N	425.323	1.749	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1[nH]nc2ncccc12	1796219594	IYQFZZOLYNXEEI-XCCSTKFXSA-N	436.310	1.335	50	20	IDGD	
COc1cc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Cl)ccc1[N+](=O)[O-]	1796367889	ZBLITCGJJSUFAU-CZAMWMTLSA-N	429.832	1.270	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1csc2c1CCCC2)c1cccc(B(O)O)c1	1798046583	NJKIULUEOCVTGB-BCDXTJNWSA-N	438.358	1.872	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COCCNC(=O)OC(C)(C)C)C2	1799268513	XWVCHIFELWLPFM-IVSAIRAKSA-N	447.960	1.135	50	20	IDGD	
C[C@@H]1CCc2c(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@H](F)Br)n[nH]c21	1799347976	ZXVNIDLIXCBLAS-PVUIZZSESA-N	429.290	1.353	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(F)c1F	1799741204	PYUWIJRDCOMZJP-CLLJXQQHSA-N	429.427	1.529	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(N(C)C)nc1)C2	1800641993	PWWJDCKOJSZZLC-JYYAWHABSA-N	439.354	1.524	50	20	IDGD	
Cc1cc(C)n2ccc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@H](C)Br)c2n1	1800762127	OIFCLSOWEHEORC-MPTYRVRUSA-N	449.349	1.938	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c(F)ccc([N+](=O)[O-])c1C)C2	1800976851	AJSSIUUYRFKFPZ-IPJQOSJUSA-N	443.859	1.499	50	20	IDGD	
Cc1ncc(/C=C/C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Br)C3)s1	1801490373	XJWBDALVHZJPQA-PLADZIDJSA-N	432.315	1.745	50	20	IDGD	
CC(=O)N[C@H](C)C(=O)N1CC[C@H](CNC(=O)[C@H](C)CBr)[C@H]1c1cccnc1	1803015364	MAPHHSIUJTZDBH-BQGCOEIASA-N	439.354	1.643	50	20	IDGD	
O=C(CCBr)NC[C@@H]1CCN(C(=O)Cn2ccncc2=O)[C@H]1c1cccnc1	1806346495	ISJLSUYNIHTNOR-KXBFYZLASA-N	448.321	1.129	50	20	IDGD	
COC(=O)NCC(=O)N1CC[C@H](CNC(=O)[C@H](F)Br)[C@H]1c1cccnc1	1808680104	HVKFMUDECPPKCL-BNOWGMLFSA-N	431.262	1.134	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2cc3cn[nH]c3cn2)[C@H]1c1cccnc1	1810089065	HRMWBCWYVMPXMP-SIXWZSSISA-N	442.907	1.926	50	20	IDGD	
C#CC(=O)NC[C@@H]1CCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)[C@H]1c1cccnc1	1812525346	SFDLCZREQKZKBM-BQFCYCMXSA-N	434.924	1.853	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H](CNC(=O)[C@H](C)NC(C)=O)[C@@H]1c1cccnc1	1812651983	JIAMSDDGWDUCJK-IEAZIUSSSA-N	439.354	1.786	50	20	IDGD	
COCCOCC(=O)N1CC[C@H](CNC(=O)[C@H](C)Br)[C@@H]1c1cccnc1	1812864276	LSZYCYYHBKDGMR-LXZKKBNFSA-N	428.327	1.534	50	20	IDGD	
C[C@H](C(=O)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@H]1c1cccnc1)n1cnnn1	1813473676	NOVYBGWVVSBFSP-SAXRGWBVSA-N	440.277	1.026	50	20	IDGD	
C[C@@H](CBr)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2CNC(=O)O2)[nH]n1	1814778330	GHGBXUMODGJPCQ-DLOVCJGASA-N	428.287	1.541	50	20	IDGD	
C[C@H](NC(=O)c1ccccn1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](O)CCl)n[nH]1	1814875033	MLDACNLAIKXRAL-RCBQFDQVSA-N	448.911	1.215	50	20	IDGD	
C=CCC(F)(F)C(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1	1815348652	UWLOVEAANWGEFD-ZDUSSCGKSA-N	435.261	1.260	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@@H]2CCCSC2)[nH]n1)c1cccc(B(O)O)c1	1817479329	QGTIQZGFTVJLLS-CRAIPNDOSA-N	442.350	1.539	50	20	IDGD	
COC[C@H](NC(C)=O)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](C)Br)[nH]n1	1819612828	DZTJIMYTXOYJME-SWHYSGLUSA-N	444.330	1.336	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@H]1CCc2nc(NC(=O)c3cc(CO)on3)sc2C1	1821693783	XTPIASDADRUNTB-IUCAKERBSA-N	443.323	1.880	50	20	IDGD	
COc1ccc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@@H](O)CCl)CC3)c(OC)c1	1821931463	LNEVGHZQFBCSHX-YGRLFVJLSA-N	439.921	1.986	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@H]1CCc2nc(NC(=O)[C@H]3CC=CCC3)sc2C1	1822790662	FLFHRNSOQZFKBK-STQMWFEESA-N	440.529	1.724	50	20	IDGD	
COC(=O)C1(C(=O)N[C@H]2CCc3nc(NC(=O)[C@@H](F)Br)sc3C2)CC1	1823009017	JGDMTTODKIDWBJ-OIBJUYFYSA-N	434.287	1.699	50	20	IDGD	
Cn1cc2cc(C(=O)Nc3nc4c(s3)C[C@H](NC(=O)[C@H](O)CCl)CC4)ccc2n1	1823949498	PUJZCIOTHISCTD-IUODEOHRSA-N	433.921	1.855	50	20	IDGD	
O=C(Cn1ccncc1=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](F)Br)CC2	1824536682	QGPQVPYJJSTQQO-AMIZOPFISA-N	444.286	1.003	50	20	IDGD	
CC[S@](=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](C)Br)sc2C1	1825643057	XSCPBHCPHBLTDY-ROXXKOOQSA-N	436.397	1.997	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1sccc1F)CC2	1826083127	KCGMYWMHLYKSRF-SNVBAGLBSA-N	439.538	1.943	50	20	IDGD	
O=C(CN1CCOCC1)N1CCC([C@@H]2CCCCN2C(=O)CCBr)CC1	1826357646	FRMUXFAKZKLBLH-KRWDZBQOSA-N	430.387	1.723	50	20	IDGD	
O=C(/C=C/c1cnccn1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827055076	OUYSDNZPXHKFIP-UVIRAJKCSA-N	448.332	1.103	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)cc(O)n1	1827625307	QXIRKRJJCHPDQG-LJQANCHMSA-N	445.564	1.702	50	20	IDGD	
COc1cc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)ccn1	1829277468	FKMUQBBOOPDJDY-LJQANCHMSA-N	445.564	1.697	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3cccc([N+](=O)[O-])c3)CCO2)C1	1829626000	ZWIDUAMRRRFNIU-YLJYHZDGSA-N	439.896	1.611	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CCCCO1)CCO2	1829908312	DTZMDBPYQYAFHR-RKVPGOIHSA-N	433.343	1.043	50	20	IDGD	
O=C([C@H](O)CCl)N1CCC([C@H]2CCCCN2C(=O)c2nc3ccc(F)cn3n2)CC1	1831045558	IWYZJFNNJRQBDW-HZPDHXFCSA-N	437.903	1.701	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C/N=C/c3ccco3)C2)C1	1831649852	CFFWAWYJXHWHOO-HNNRIZOBSA-N	425.913	1.562	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)C[C@H]1CCCCO1)CCO2	1832345480	YUNSOWMAXLWJDK-XLIONFOSSA-N	428.602	1.254	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)CCl)CC2)CC1	1833312249	MSDXCGCRYWAIKV-GJZGRUSLSA-N	438.794	1.331	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3ccnc4ncccc34)CC2)CC1)[C@H](O)CCl	1833312484	VVGBCALMWLOOGA-LJQANCHMSA-N	445.951	1.415	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)c3cccc(=O)n3C)CC2)CC1	1833531188	IGZCTBYOVRBDFW-GOSISDBHSA-N	436.984	1.978	50	20	IDGD	
COC(=O)CCC(=O)NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1	1834433158	WGRTXOWLEJIUMU-UHFFFAOYSA-N	432.359	1.296	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)c1cc[nH]c2nccc1-2	1835008986	JCJSHNIREKGPRW-SFHVURJKSA-N	433.940	1.299	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3nc4ncccn4n3)CC2)CC1	1835353056	UHMWXNMHCWFKFA-INIZCTEOSA-N	433.944	1.327	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc4ncncc4c3)CCO2)C1	1837026023	PBCKJUDFPMFPOV-LAUBAEHRSA-N	432.908	1.717	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)cc1O	1837714607	LREMJFSEPNYTEM-NRFANRHFSA-N	436.581	1.622	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)C/N=C/c3ccco3)C2)C1	1837715535	VXGIDCRIJAZQLO-XACCNFBGSA-N	437.569	1.006	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(-c4cccnc4)[nH]n3)CCO2)C1	1838031042	IADGNPGFDLMQJF-IERDGZPVSA-N	447.923	1.559	50	20	IDGD	
CCc1nc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)CBr)C3)C2)co1	1838131660	LCFPMSGUWZWBFP-FZKQIMNGSA-N	444.326	1.338	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](C)n3cncn3)CC2)CC1	1838773548	NQUIDVCNXJRLAM-UONOGXRCSA-N	442.358	1.621	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)CN3CCCCC3=O)CC2)CC1	1838781275	WTZUGLQCYJQZHC-SFHVURJKSA-N	443.972	1.251	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc4ccoc4c3)CCO2)C1	1839536812	ADODQIFIJGOELC-DYESRHJHSA-N	436.892	1.757	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCCCn3cccc3)C2)C1	1840153392	MTEKOGHHRZUZJD-WIYYLYMNSA-N	441.956	1.369	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3nc(C)c(C)s3)C2)C1	1840154051	JJFDCYODJYGIID-KSSFIOAISA-N	431.942	1.084	50	20	IDGD	
COc1cccnc1CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840186168	FIQAHKAZOCINHV-LJQANCHMSA-N	446.331	1.283	50	20	IDGD	
C[C@H](Cn1ccnc1)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1840428702	SXDIDXVSSQCNGS-UZLBHIALSA-N	426.945	1.241	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(C)c(O)c(C)c3)CCO2)C1	1840677174	SNVMMFXJOCGFBH-DYESRHJHSA-N	440.924	1.333	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCCC12CN(C(=O)Cc1ccncc1)C2	1841925080	LQADSLKPUNQPBZ-INIZCTEOSA-N	436.940	1.960	50	20	IDGD	
Cc1cccc2[nH]c(C(=O)N3CCCC34CN(C(=O)c3cnccc3C(=O)NN)C4)cc12	1844048367	WHVUHAKFQIRPHQ-UHFFFAOYSA-N	432.484	1.606	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)Cc1ccccc1Cl)C2	1844264018	UWQRYVCOLIKKBH-UHFFFAOYSA-N	427.892	1.398	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)[C@]1(F)CCCCC1(F)F)C2	1844264489	YDIRLSFMDXUHPI-LJQANCHMSA-N	439.438	1.420	50	20	IDGD	
Cn1c(=O)n(CC(=O)N2CC3(CCCN3C(=O)[C@H](F)Br)C2)c2ccccc21	1845218061	KWILOZLURWFCNG-HNNXBMFYSA-N	439.285	1.234	50	20	IDGD	
C[C@H](C(=O)N1CCCC12CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)n1ccnn1	1845812147	WRIGGPFWEFXSJS-KGLIPLIRSA-N	440.932	1.175	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)[C@H]2CCCOC2)C1	1847033225	DHUNXQQWDNKHAV-HNNXBMFYSA-N	431.445	1.764	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc(OC(F)(F)F)cc1)NNC(=O)c1ccccc1	15435334	KOSNVIXJODOXIN-UHFFFAOYSA-N	431.392	1.715	50	20	IDGD	
O=C(CCn1c(=O)oc2cc(Cl)ccc21)NNC(=O)c1ccc(-n2cnnn2)cc1	23787629	XSYMBWGCIPVKEU-UHFFFAOYSA-N	427.808	1.075	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(Cn3cccn3)o2)cc1OC	108793380	RQBQQPHIQSWKSF-UHFFFAOYSA-N	428.401	1.160	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)CN2C(=O)COc3cc(Br)ccc32)cc1	110883261	ILLGMBVYXDXNHZ-UHFFFAOYSA-N	447.289	1.742	50	20	IDGD	
O=C(CCC1CCCCC1)NNC(=O)NCCNS(=O)(=O)c1cccc([N+](=O)[O-])c1	727482613	YFTSAZZJVUFASN-UHFFFAOYSA-N	441.510	1.564	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NCc1cccc(C(=O)NCCN(C)C)c1	727604369	XTWKUKKQXYYBMW-OAHLLOKOSA-N	445.495	1.415	50	20	IDGD	
O=C(Cc1cccc(Cl)c1)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	727659841	VMBWMXPRFAVDAO-UHFFFAOYSA-N	437.905	1.365	50	20	IDGD	
Cc1ccc(C(=O)N([C@H]2CCS(=O)(=O)C2)N(C)C)cc1S(=O)(=O)N1CCCCC1	728177210	ZJFLOSVMVKBYBC-KRWDZBQOSA-N	443.591	1.276	50	20	IDGD	
COc1ccccc1C(C)(C)C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	728338422	CQFQYTKYMMZBKW-GOSISDBHSA-N	428.441	1.503	50	20	IDGD	
CC(C)(C)CC(=O)NNS(=O)(=O)c1ccc(S(=O)(=O)NCC(F)(F)F)cc1	728509354	JWQSWAZVWQDLIN-UHFFFAOYSA-N	431.458	1.273	50	20	IDGD	
CN1CCN(c2cc(CNC(=O)NNC(=O)c3cccc(OC(F)F)c3)ccn2)CC1	728595554	LQFXGRSUBOGRIW-UHFFFAOYSA-N	434.447	1.579	50	20	IDGD	
O=C(NC[C@]1(N2CCOCC2)CCSC1)NNC(=O)c1cccc(OC(F)F)c1	728596643	GSTCVPFXXHYARQ-GOSISDBHSA-N	430.477	1.440	50	20	IDGD	
NS(=O)(=O)Cc1cccc(C(=O)NNC(=O)c2ccc(Br)cc2Cl)c1	728869937	JQBJICOSHBIELK-UHFFFAOYSA-N	446.710	1.966	50	20	IDGD	
COc1ccccc1OCCCNC(=O)NNC(=O)c1sc(N2CCOCC2)nc1C	729221240	LKFYCAKTUCWNEL-UHFFFAOYSA-N	449.533	1.710	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)NCc1ccc(CN2CCC(O)CC2)cc1	729494344	MSNIJGQDKNAWAA-UHFFFAOYSA-N	436.516	1.744	50	20	IDGD	
CN(C)c1ccc(NC(=S)NNC(=O)CNC(=O)c2ccc(Br)o2)cc1	729690574	DEDMTHXMNJTRJS-UHFFFAOYSA-N	440.323	1.856	50	20	IDGD	
CC[C@H](C)NS(=O)(=O)c1ccc(C(=O)NNC(=S)Nc2ccc(OC)nc2)cc1	729692946	ABGYKWIRVYAZKC-LBPRGKRZSA-N	437.547	1.798	50	20	IDGD	
NS(=O)(=O)c1ccc(Br)c(C(=O)NNC(=O)c2cccc3ncccc23)c1	730224885	DQFSZBLRGPPDFA-UHFFFAOYSA-N	449.286	1.720	50	20	IDGD	
O=C(Cn1[nH]cc2c(=O)ncnc1-2)NNC(=S)Nc1cc(C(F)(F)F)ccc1Cl	730587530	MVESTRFAIGQRNU-UHFFFAOYSA-N	445.814	1.761	50	20	IDGD	
O=C(CCN1CCN(C(=O)[C@H]2CCCO2)CC1)NNC(=O)c1ccc(Cl)cc1Cl	732053169	YDRIVORISILMBM-MRXNPFEDSA-N	443.331	1.468	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)CS(=O)(=O)C2CCCC2)CC1	734825730	NRYVEQJGDVAVFH-UHFFFAOYSA-N	432.543	1.074	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=O)COCc2ccccc2)c1	737634431	DFNRHBJVRADKCY-UHFFFAOYSA-N	425.894	1.568	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)[C@@H]1CCCN(c2ncccc2C(F)(F)F)C1	740853084	SVPATXRZDBMMNA-GFCCVEGCSA-N	429.443	1.769	50	20	IDGD	
NC(=O)[C@@H](NNC(=O)c1ccc(-n2cnnn2)cc1)c1ccc(Br)cc1F	743462934	NBWYNPNXNRXNJP-AWEZNQCLSA-N	434.229	1.025	50	20	IDGD	
C[C@H]1CCN(C(=O)NNC(=O)CNC(=O)c2cccs2)CCN1Cc1ccccc1	743578530	MCKDISULWCTDPM-INIZCTEOSA-N	429.546	1.815	50	20	IDGD	
Cc1ccc(S(C)(=O)=O)cc1C(=O)NNC(=O)c1cc(Br)ccc1O	743729728	FSXDAOBJUIEHHX-UHFFFAOYSA-N	427.276	1.941	50	20	IDGD	
COc1ccc(F)cc1CN1CCN(CC(=O)NNC(=O)c2ccc(C#N)cc2)CC1	744385872	XQNSPFXQIRPRLS-UHFFFAOYSA-N	425.464	1.285	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)N[C@@H]2C[C@H](C)N(c3cnn(C)c3)C2=O)cc1	745919327	SCZYEQNEHCIQCN-PMUMKWKESA-N	444.492	1.111	50	20	IDGD	
Cc1nnc(-c2cccc(C(=O)NNC(=O)c3sc(N4CCOCC4)nc3C)c2)o1	746098024	PFRGQJNOIRLENL-UHFFFAOYSA-N	428.474	1.721	50	20	IDGD	
Cc1nc2cc(O)nn2c(C)c1CCC(=O)OCC(=O)NNC(=O)c1cccc(Cl)c1	746935820	QJPDPALIPFXTFH-UHFFFAOYSA-N	445.863	1.642	50	20	IDGD	
Cn1cc(S(=O)(=O)NNC(=O)[C@@H]2Cc3ccccc3CN2Cc2ccccc2)cn1	747698148	XAUYYJMHDASIOH-FQEVSTJZSA-N	425.514	1.357	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)N[C@@H]2CCCN(C)C2=O)c2ccccc2c1=O	748664640	LYNBETOMBVXNGC-MRXNPFEDSA-N	428.493	1.152	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)NCC1CCN(S(C)(=O)=O)CC1	749017358	LTTWQSNWKISJEP-OAHLLOKOSA-N	448.545	1.609	50	20	IDGD	
CN1C(=C(C#N)C(=O)COC(=O)CCOc2ccccc2C(N)=O)N(C)c2ccccc21	750543851	HICWARRIQIIMDG-UHFFFAOYSA-N	434.452	1.988	50	20	IDGD	
Cc1nnc2n1C[C@@H](C(=O)NNC(=O)COc1ccc(OCc3ccccc3)cc1)CC2	750713030	BXXBJTABPRGJBW-SFHVURJKSA-N	435.484	1.954	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2ccccc2OC(F)F)c1	751261193	JDFNALJVQRNCIT-UHFFFAOYSA-N	449.457	1.162	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)c1ccc(=O)n(CCOc2ccccc2Cl)c1	752043252	ZQQWSEMMKANCSP-UHFFFAOYSA-N	426.860	1.979	50	20	IDGD	
CCOC(=O)C(F)(F)[C@H]1CCC(=NNC(=O)Cc2csc(N3CCOCC3)n2)C1	752720183	GNXOPMYFTYKHKZ-LBPRGKRZSA-N	430.477	1.993	50	20	IDGD	
Cc1noc(C)c1[C@H](C)CC(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	754081071	XVUNADTYGNMJRN-OAHLLOKOSA-N	427.505	1.390	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)N2CCC[C@@H]2C(=O)NNc2cccnc2Cl)o1	754479812	GJKLRKQFJVSZHY-GFCCVEGCSA-N	442.881	1.801	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)c2coc(S(=O)(=O)NC)c2)cc1OC	755415624	SWEVEHRUECUWTQ-UHFFFAOYSA-N	425.463	1.450	50	20	IDGD	
O=C(NNC(=O)c1ccc2ccccc2n1)Nc1cccc(N2CCS(=O)(=O)CC2)c1	756207194	PXFLVPSFAIAMOU-UHFFFAOYSA-N	439.497	1.936	50	20	IDGD	
Cc1cc(F)c(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1F	757529663	PDLMNRRAPTXKBH-UHFFFAOYSA-N	439.440	1.369	50	20	IDGD	
Cn1ccnc(NC(=O)NNC(=O)[C@@H]2Cc3ccccc3CN2Cc2ccccc2)c1=O	757907688	WRVIASPKZXBZMU-IBGZPJMESA-N	432.484	1.560	50	20	IDGD	
Cn1ncc(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c1Br	760156034	INWCESMJICBUIN-UHFFFAOYSA-N	435.326	1.156	50	20	IDGD	
CC1(C)C(=O)N(C[C@@](C)(O)C(=O)NNC(=O)Cn2ccc3ccccc32)c2ccccc21	760275193	CBKBRSVAGCUJQP-XMMPIXPASA-N	434.496	1.864	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)CCOc1ccc(S(C)(=O)=O)cc1	761628317	XHFLVPUFUPSFCO-UHFFFAOYSA-N	438.527	1.807	50	20	IDGD	
CN(NC(=O)c1c[nH]c2ccccc2c1=O)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	763282277	MRAFAOGHLZVQAF-UHFFFAOYSA-N	429.477	1.777	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(F)nc2)cc(OCC)c1OCC	763543843	RZGKAUZBCGSZSP-UHFFFAOYSA-N	434.424	1.817	50	20	IDGD	
CCS(=O)(=O)c1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)c1ccccc1F	763560412	APBHJSOZHYRFEL-UHFFFAOYSA-N	427.841	1.672	50	20	IDGD	
CC(=O)N1CCc2cc(NC(=O)C(=O)NNC(=O)c3cc(C)nc4ccccc34)ccc21	763616616	NZKWNGDCABAUMM-UHFFFAOYSA-N	431.452	1.852	50	20	IDGD	
CC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)COc2cccc(C(F)(F)F)c2)c1	763640291	VYMDQJNQKLXFQJ-UHFFFAOYSA-N	438.362	1.829	50	20	IDGD	
CO[C@]1(CNC(=O)NNC(=O)[C@H]2Cc3ccccc3CN2Cc2ccccc2)CCOC1	763646801	JYDPNBJVNGLXCG-QPPBQGQZSA-N	438.528	1.749	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(CCS(C)(=O)=O)cc1	763716537	INZPETIVCWIIND-UHFFFAOYSA-N	447.513	1.001	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)cc1-n1cnnn1	763852239	GHAQIGNRQMDPPR-OAHLLOKOSA-N	437.460	1.141	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)cc1N1CCOC1=O	763855853	BTBCAKHMRXDTHL-CYBMUJFWSA-N	444.419	1.644	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)OC)cc2)cc1	763859457	BMNAPAZMWMUFSU-ZDUSSCGKSA-N	429.429	1.425	50	20	IDGD	
CCN1CCC(n2nccc2NC(=O)C(=O)NNC(=O)Cc2c[nH]c3ccccc23)CC1	763865004	GNMWWDRPGLNGGT-UHFFFAOYSA-N	437.504	1.350	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C)c(C(=O)OC)c2)cc1OC	763901157	LPPDGEWSBLTRKQ-UHFFFAOYSA-N	429.429	1.589	50	20	IDGD	
CS(=O)(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccc(Cl)cc2)cc1F	763931682	KFDOYLNKCDFRME-UHFFFAOYSA-N	441.868	1.352	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)C(=O)Nc1cccc(COCC2CC2)c1	763945028	RWWJPCGCQYSDPW-UHFFFAOYSA-N	449.467	1.904	50	20	IDGD	
COc1ccccc1Oc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)cc1	764002084	ISPSUEYNDULLOS-ZDUSSCGKSA-N	447.469	1.008	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)c2cnccn2)sc2c1CC[C@@H](CC)C2	764025894	ZYWKZIKGZDLDMI-LLVKDONJSA-N	445.501	1.629	50	20	IDGD	
CC(C)(C)n1nccc1NC(=O)C(=O)NNC(=O)c1ccc(F)cc1Br	764084120	DSMRFYPSKBWDIH-UHFFFAOYSA-N	426.246	1.939	50	20	IDGD	
CCOC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)CCc2ccc(OC)cc2)cc1	764126223	HTXACCVYMBXFDD-UHFFFAOYSA-N	428.445	1.982	50	20	IDGD	
COC(=O)C(C)(C)c1ccc(NC(=O)C(=O)NNC(=O)Cc2ccccc2OC)cc1	764130859	ATMLJEMKMGECBI-UHFFFAOYSA-N	427.457	1.474	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2O1)C(=O)Nc1cccc(-c2n[nH]c(C3CC3)n2)c1	764152558	SNSSNIZGHUULGI-KRWDZBQOSA-N	432.440	1.439	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CCC(C)C)cc1NC(=O)CN1CCCCC1	764198134	FABWFZZQTJNQAE-UHFFFAOYSA-N	431.537	1.942	50	20	IDGD	
O=C(CCC1CCCCC1)NNC(=O)C(=O)Nc1cnn(CC(=O)NC2CCCC2)c1	764209457	BIONCEIHZBBDNQ-UHFFFAOYSA-N	432.525	1.388	50	20	IDGD	
COCCOc1ccc(F)cc1NC(=O)C(=O)NNC(=O)c1cccc2ncccc12	764253708	SVTGHBVQLSVSOY-UHFFFAOYSA-N	426.404	1.799	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)Cc2ccncc2)sc2c1CCCCC2	764356249	SDLQDQQAALNMRS-UHFFFAOYSA-N	444.513	1.917	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1cc2c(cc1F)CCC(=O)N2	764392167	BHQDGOZZJLYIGJ-UHFFFAOYSA-N	446.460	1.597	50	20	IDGD	
CCS(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2F)cc1	764409964	CWOOCQJTNXXFDH-UHFFFAOYSA-N	427.841	1.672	50	20	IDGD	
NS(=O)(=O)c1cc(Cl)c(F)c(C(=O)NNC(=O)CSc2ccccc2O)c1	765404446	VJAXSKSTZKKPSV-UHFFFAOYSA-N	433.870	1.385	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)c2cc(-c3c(C)nn(C)c3C)[nH]n2)n[nH]1	765596046	PRWZPSJGLYPGLZ-UHFFFAOYSA-N	434.460	1.901	50	20	IDGD	
COc1cc(CNC(=O)NNc2ncnc3ccsc23)ccc1OCC(=O)N(C)C	765655630	HOKSPPAHHLZBFN-UHFFFAOYSA-N	430.490	1.993	50	20	IDGD	
COC(=O)Nc1cccc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)c1	765737006	DAXHTFZRHOURRN-UHFFFAOYSA-N	439.472	1.084	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1ccnn1Cc1ccc(C(F)(F)F)cc1	766265019	VESRPCMFRDBSQO-UHFFFAOYSA-N	435.366	1.831	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2cccc(-c3cc[nH]n3)c2)cc1	767915720	JKRMMTVNVRJXQH-UHFFFAOYSA-N	442.501	1.859	50	20	IDGD	
C[C@H](NS(=O)(=O)c1cccc(C#N)c1)C(=O)NNC(=O)c1cc(-c2cccs2)[nH]n1	768260356	KRVRZCVWZUCLOZ-NSHDSACASA-N	444.498	1.138	50	20	IDGD	
CC(C)[C@H](NC(=O)OC(C)(C)C)C(=O)NCC(=O)NNC(=O)c1ccc(Cl)nc1	768334423	JXKDHNBRGXGUGY-AWEZNQCLSA-N	427.889	1.162	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNS(=O)(=O)c1ccc(C(=O)O)cc1Cl	768497806	RYTHTJPISKGZLO-UHFFFAOYSA-N	428.850	1.825	50	20	IDGD	
COc1ccc(Br)c(CC(=O)NNC(=O)CCN2C[C@@H](C)O[C@H](C)C2)c1	768930052	OFZHULRRCPCOCG-CHWSQXEVSA-N	428.327	1.647	50	20	IDGD	
C[C@@]1(c2ccc(F)c(Cl)c2)NC(=O)N(CC(=O)NNC(=O)c2ccccc2O)C1=O	770220240	BHMUHLJBYSMSFF-IBGZPJMESA-N	434.811	1.413	50	20	IDGD	
CCn1c(SCC(=O)NNc2nc(O)c3cnn(C)c3n2)nnc1-c1cccc(C)c1	770973739	PZKSACSWWWKLSC-UHFFFAOYSA-N	439.505	1.891	50	20	IDGD	
CC(C)N1CCC(N2CCN(C(=O)NNC(=O)Cn3ccc4ccccc43)CC2)CC1	771216359	PAFDHDQRUDZUQH-UHFFFAOYSA-N	426.565	1.873	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)C(=O)NCc3ccc(Cl)cc3)n[nH]2)cc1	772182341	GTAXGKDDZDLFDT-UHFFFAOYSA-N	427.848	1.816	50	20	IDGD	
Cc1cn2c(=O)c(C(=O)NNc3ccccc3S(=O)(=O)NC(C)(C)C)cnc2s1	772817616	HEBCLNPSDVLRBG-UHFFFAOYSA-N	435.531	1.898	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)c1ccc([C@@]2(C)NC(=O)NC2=O)cc1	772962484	BWOWWJHWFXFLOR-BIBXISHDSA-N	430.848	1.623	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2cc(C(=O)N3C[C@@H](C)C[C@@H](C)C3)ccc2C)n1	773724078	MKGSKRCKLBRVAY-OKILXGFUSA-N	440.504	1.994	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2ccccc2C(=O)N2C[C@H](C)C[C@@H](C)C2)n1	773726863	SIFUMDDYBDLNLX-ZIAGYGMSSA-N	426.477	1.685	50	20	IDGD	
COc1cc(SC)ccc1NC(=O)C(=O)NNc1c(OC)cccc1S(C)(=O)=O	773729732	IMFMBSCLNKRMAL-UHFFFAOYSA-N	439.515	1.911	50	20	IDGD	
Nc1nc(Cl)cc(NNC(=O)C2(NS(=O)(=O)c3cccc(F)c3)CCCCC2)n1	773862229	HFAGOATVRONVMP-UHFFFAOYSA-N	442.904	1.976	50	20	IDGD	
CNC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)cc1	774009992	TUIDHQBPMZALRF-LBPRGKRZSA-N	448.863	1.018	50	20	IDGD	
COC(=O)Cc1ccccc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1cccc(Cl)c1	774010194	VTDVBLODUIIRKL-LBPRGKRZSA-N	433.848	1.609	50	20	IDGD	
Cn1ncc(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)c1-c1ccccc1	775538705	OCXMKUODTPXZDY-UHFFFAOYSA-N	441.513	1.865	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)Nc1ccc(S(=O)(=O)NC(C)(C)C)cn1	776063880	YVECWSGJBRFJIY-UHFFFAOYSA-N	435.506	1.562	50	20	IDGD	
COc1ccc(C(=O)N2CCN(S(=O)(=O)CBr)CC2)c(OC)c1OC	777777962	UTGDRMLJFGDZPR-UHFFFAOYSA-N	437.312	1.152	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CC[C@@]2(C1)C(=O)Nc1ccccc12	778205340	AXDREPKQRVRCJY-NRFANRHFSA-N	428.876	1.705	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)c2ccc(Cl)c(NS(C)(=O)=O)c2)nc1C	778426701	QLBPMDFLKMDZPD-UHFFFAOYSA-N	427.870	1.744	50	20	IDGD	
CN(C)S(=O)(=O)c1c[nH]c(C(=O)NNc2ccc([N+](=O)[O-])cc2Br)c1	779145460	LETVTVKWURSMRC-UHFFFAOYSA-N	432.256	1.693	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@H](C(=O)NNc2ccc(OC(F)F)cc2)[C@H](C)O)cc1	779535359	SIPOXDCBLSFBGC-LRDDRELGSA-N	429.445	1.767	50	20	IDGD	
Cc1cc(N2C[C@@H](C(=O)NNC(=O)Nc3ccc(S(C)(=O)=O)cc3)CC2=O)ccc1F	779921536	UMJSJPIZWOUOOO-ZDUSSCGKSA-N	448.476	1.743	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)NCc1ccccc1CN1CC[C@H](O)C1	781949424	BXCJKGNVFFUYFS-FQEVSTJZSA-N	426.517	1.725	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNc2cncc(Cl)n2)cc(OC)c1Br	783259621	GSXAMOQXTRGLHO-UHFFFAOYSA-N	430.646	1.992	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)nn1[C@H](C)C1CC1	784214468	YCOQYGQPRFWWHP-CYBMUJFWSA-N	446.533	1.685	50	20	IDGD	
O=C(NNc1ccc(Cl)nn1)C(=O)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1	784793437	QIEZMNBUPYSPCN-UHFFFAOYSA-N	438.897	1.386	50	20	IDGD	
CCS(=O)(=O)CCn1cc(C)c(NC(=O)NNC(=O)Cc2c[nH]c3ccccc23)n1	786736240	ZXNWZFLPFSLEQA-UHFFFAOYSA-N	432.506	1.503	50	20	IDGD	
Cc1ccc(S(=O)(=O)Cc2ccc(C(=O)NNC(=O)N3CCN(C)CC3)cc2)cc1	788168733	AEBLDLIMOLJIMZ-UHFFFAOYSA-N	430.530	1.571	50	20	IDGD	
CS(=O)(=O)c1cc(NC(=O)C(=O)NNC(=O)CCCc2ccccc2)ccc1Cl	788334523	WGVUWNTUCQVQPP-UHFFFAOYSA-N	437.905	1.852	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCC2(SC)CCC2)c1	789289384	JQSKXMRHFKHBJE-UHFFFAOYSA-N	428.580	1.947	50	20	IDGD	
Cc1nc(NC(=O)C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)sc1C	789730479	SCRVKNLRLSHEKM-UHFFFAOYSA-N	430.534	1.058	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2nc3c(s2)CCCCC3)c1	789733779	VBQREBODALHERQ-UHFFFAOYSA-N	436.515	1.215	50	20	IDGD	
CC(=O)N1CCc2ccccc2[C@@H]1CC(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	789852697	ULDAAEVBDFUTQW-IBGZPJMESA-N	433.468	1.875	50	20	IDGD	
COC(=O)c1ccc(S(=O)(=O)NNC(=O)c2ccc(C#N)cc2)cc1C(F)(F)F	790053210	MJIOXWCSIMWGCY-UHFFFAOYSA-N	427.360	1.987	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)CCn2c(S)nc3ccccc3c2=O)c1	791675963	ILSAKRNWLDJIOO-UHFFFAOYSA-N	426.498	1.919	50	20	IDGD	
COCCNC(=O)Cn1cc(NC(=O)C(=O)NNc2cc(Cl)cc(Cl)c2)cn1	792441681	VZVHGYYVZARECI-UHFFFAOYSA-N	429.264	1.034	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNS(=O)(=O)c1cccc(OC(F)(F)F)c1F	793389856	YJIDNLFFIXYKJN-UHFFFAOYSA-N	425.316	1.057	50	20	IDGD	
Cc1nc2c3cccnc3nn2c(C)c1CCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	794761093	WFHIWVPPBZBFSC-LJQANCHMSA-N	446.467	1.814	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)C2CCN(c3oc(C)nc3C#N)CC2)c1	796280403	PMHZABIWZAJKKS-UHFFFAOYSA-N	425.445	1.384	50	20	IDGD	
COc1cc2c(cc1S(=O)(=O)NNC(=O)c1ccc(Cl)cc1O)OCC(=O)N2	797429676	UHXRYTYTLJYULW-UHFFFAOYSA-N	427.822	1.008	50	20	IDGD	
COC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)COc2ccc(C)c(C)c2)c1C	798042282	PJGMTHVDOQDTTH-UHFFFAOYSA-N	428.445	1.955	50	20	IDGD	
CO[C@@H](C(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1)c1cnn(C)c1	798842681	FBSKAOUDXOOCQI-MRXNPFEDSA-N	449.514	1.431	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNS(=O)(=O)c1ccc(C(=O)N(C)C)cc1	799543278	KHASADLXYZCOQK-GFCCVEGCSA-N	425.894	1.819	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)[C@@H]1CN(Cc2ccccc2)CCC1(F)F	803053903	IRGQZWQBKVCIJD-HNNXBMFYSA-N	426.464	1.816	50	20	IDGD	
Cc1c(/C=C(\C#N)C(=O)NC[C@H]2CCn3ncc(C(=O)NC(C)C)c3C2)cc(C#N)n1C	803412688	LJVRIQWNNGFAFN-YESQQZSKSA-N	433.516	1.826	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2scc(C)c2C(=O)OC)cc1	806975260	RUNWOUBPEHYGDD-LBPRGKRZSA-N	449.485	1.795	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cccnc3OC(C)C)CC2)cc1	807092608	DHZIBZWEUJHMLJ-UHFFFAOYSA-N	425.533	1.756	50	20	IDGD	
C/C=C(/CC)C(=O)NNC(=O)C[C@H]1c2cc(OC)c(OC)cc2CCN1S(C)(=O)=O	809999855	TVVSJZRWTWWGGK-DZNGUJDPSA-N	439.534	1.456	50	20	IDGD	
CC[C@@H]1[C@@H](C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)CCN1C(=O)OC(C)(C)C	810348680	QXXHIYFZKUISRR-DLBZAZTESA-N	446.552	1.876	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cccc4c3OCC(=O)N4)n[nH]2)cc1C	810387359	SKCGFHNUPHHQJC-UHFFFAOYSA-N	448.439	1.424	50	20	IDGD	
COC(C)(C)c1nc(C)c(C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)s1	811242174	JVQWQURIOSIOHB-UHFFFAOYSA-N	436.446	1.859	50	20	IDGD	
CC[C@H]1[C@@H](C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)CCN1C(=O)OC(C)(C)C	811298999	FMJLVCQBLLSXCQ-IRXDYDNUSA-N	444.488	1.898	50	20	IDGD	
CC(=NNC(=O)c1ccc(CSc2nncn2C)cc1)c1ccc2[nH]c(=O)c(=O)[nH]c2c1	811631158	MRLUMIIIJACBLL-UHFFFAOYSA-N	449.496	1.791	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)c2nn(-c3ccc(F)cc3)ccc2=O)cc1	812726757	KSXPGZODHZDVRD-UHFFFAOYSA-N	431.449	1.379	50	20	IDGD	
CSCc1cnc(C=NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)s1	814688715	JSXIGZMMPXYSCG-UHFFFAOYSA-N	440.572	1.791	50	20	IDGD	
NS(=O)(=O)c1ccc(NC(=O)NN=C2CCS(=O)(=O)c3ccc(F)cc32)cc1	814964521	XEVCPWRYDRMSPA-UHFFFAOYSA-N	426.451	1.176	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(Br)c(C#N)c1	815565775	ZUXNZMZAAPGDSV-UHFFFAOYSA-N	447.245	1.494	50	20	IDGD	
Cc1c(NC(=O)C(=O)NN=c2sc3ccccc3n2C)nnn1Cc1ccccc1F	815588537	RSMWOYRLHHSJEL-UHFFFAOYSA-N	439.476	1.898	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1ccc(-n2cccn2)cc1	815750597	FPXJWUMFMAEGMF-UHFFFAOYSA-N	428.474	1.204	50	20	IDGD	
C[C@H](Cc1cnc2ccccc2n1)C(=O)N1CCN(S(=O)(=O)CBr)CC1	815964383	GQVRAXMEUDJJBV-CYBMUJFWSA-N	441.351	1.635	50	20	IDGD	
Nc1nc(Cl)c(C=NNC(=O)Cn2nnc(-c3ccccc3)n2)c(N2CCCC2)n1	863951550	KLRRBDCRBHKCEB-UHFFFAOYSA-N	426.872	1.116	50	20	IDGD	
O=C(c1occc1CS(=O)(=O)c1ccc(Br)cc1)N1CC[C@H](B(O)O)C1	864234310	PIEJIXIFFFMMPF-LBPRGKRZSA-N	442.096	1.705	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)CCc2nnc(-c3ccsc3)o2)n1	904229355	NUQBUTSTEJONFU-UHFFFAOYSA-N	435.487	1.429	50	20	IDGD	
O=C(CCNS(=O)(=O)c1cccnc1)NNC(=O)c1cc2c(s1)CCCCCC2	914831470	MJUKFJCMZMIDSC-UHFFFAOYSA-N	436.559	1.932	50	20	IDGD	
O=C(NCc1cccc(CN2CCCC2=O)c1)NNC(=O)c1nn(-c2ccccc2)cc1O	915259911	LHDJDHNVFWLKBE-UHFFFAOYSA-N	448.483	1.845	50	20	IDGD	
CN(CC(=O)NNC(=O)CCSc1ccc(F)cc1)S(=O)(=O)c1cccnc1	915263180	ATCULZRGNIYSIW-UHFFFAOYSA-N	426.495	1.171	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)NC2CCN(C(=O)c3ccccc3)CC2)cc1C	916224281	OJBLCMQCQRCJHD-UHFFFAOYSA-N	437.500	1.877	50	20	IDGD	
CCc1ccc(CNC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)s1	916576880	WDLCXEZUAQXABM-UHFFFAOYSA-N	438.579	1.468	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)c2ccc3ccccc3c2)cc1	917749543	UCMQZTCVHMSVTH-UHFFFAOYSA-N	433.511	1.713	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)CNC(=O)c2ccc(F)c(F)c2)c2ccccc2c1=O	918280035	DOSXIUFGQWATCF-UHFFFAOYSA-N	443.410	1.447	50	20	IDGD	
Cc1nn(C)c2nc(-c3cccs3)cc(C(=O)NNC(=O)N[C@@H]3CCS(=O)(=O)C3)c12	919889885	WASVQIZFLOZQFS-LLVKDONJSA-N	448.530	1.136	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)NCc1ccc(S(=O)(=O)N(C)C(C)C)cc1	920240255	OXZPKRTUHGRPSO-UHFFFAOYSA-N	448.545	1.797	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2cn(C)nc2-c2cccnc2)c2ccccc2c1=O	920254478	NYDPSQTWRSVXSE-UHFFFAOYSA-N	431.456	1.677	50	20	IDGD	
Cc1cc(SCC(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)c(C)cc1Br	920298905	VNXHRANHOGXUNG-JTQLQIEISA-N	438.369	1.243	50	20	IDGD	
CCNC(=O)[C@H](C)NC(=O)/C(C#N)=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	920848997	KULSCEZKQJYSQZ-OJNRTJSBSA-N	442.907	1.627	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)Nc1cccc(CN2CCC[C@@H]2C(N)=O)c1	920930069	GIZMTMOOUUHJAS-GOSISDBHSA-N	436.472	1.240	50	20	IDGD	
C[C@H](OC[C@@H]1CCCO1)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	921018705	ANYZIMKJHFUDEM-RDJZCZTQSA-N	439.534	1.206	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)COc2ccc([N+](=O)[O-])c(OC)c2)c2ccccc2c1=O	921018793	CXKFWCHGVFWFOU-UHFFFAOYSA-N	441.400	1.173	50	20	IDGD	
O=C(NNC(=O)c1cc(S(=O)(=O)NC2CC2)ccc1Br)c1ccncc1	921138825	AICPYEGYXXDAQO-UHFFFAOYSA-N	439.291	1.360	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNS(=O)(=O)c1cc(S(C)(=O)=O)ccc1F	921295315	JMKSPXAFYLSFBB-UHFFFAOYSA-N	436.870	1.515	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)NCc2cc3c(nc2O)CCC3)CC1	1329957700	NSKAYZAPWVSAJI-UHFFFAOYSA-N	433.509	1.753	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnc(O)nc2O)C1	1778004464	HPTRMLVFAKNRHJ-IQUTYRLHSA-N	426.901	1.423	50	20	IDGD	
Cn1c(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](O)CCl)C3)cc2ccccc21	1778419119	WNJCYTXXXNEEKG-NNMXDRDESA-N	433.936	1.906	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)/C=N/O[C@@H]3CCCCO3)C2)C1	1779106322	OAGYJWONUPQRRW-WRIKSJFWSA-N	432.315	1.129	50	20	IDGD	
O=C(c1ccc(OC(F)F)cc1F)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1780140207	SCLSCOPWOXBAAZ-KSSFIOAISA-N	436.814	1.470	50	20	IDGD	
O=C(CCc1noc(-c2ccccc2)n1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1780894348	KTQQBRZFXRVYRR-HRAATJIYSA-N	448.907	1.099	50	20	IDGD	
N#Cc1ccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](O)CCl)C3)c(Cl)c1	1781105101	IVMIIAAYXOLHPB-SQGPQFPESA-N	440.327	1.939	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)[C@@H]3CC[C@H]4CCC(=O)N4C3)CCO2)C1	1781231065	GBUXOOMTVBSODF-QBTDHISASA-N	446.375	1.454	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCN1CCOCC1)C2	1781997663	CIQGJIQAZFUBHU-FRQCXROJSA-N	446.386	1.006	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C=C/c1cc(C)on1)C2	1782175288	GFMLXNQFVQOROL-MAEGOCJMSA-N	425.913	1.764	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](C)Nc1cccnc1)CCO2	1783341903	HOMPQUNPLDYODA-URLQWDBASA-N	439.354	1.885	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cnc4ccccn34)CCO2)C1	1783348093	UZVMRXNRWBERFY-KUHUBIRLSA-N	435.322	1.951	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3c(F)ccc(O)c3F)CCO2)C1	1783535234	AYKXGVPHXBAYNQ-BTDLBPIBSA-N	433.249	1.897	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cn(C(C)(C)C)nn3)CCO2)C1	1783537228	MYXDUDCXPXAQNS-PXAZEXFGSA-N	428.331	1.260	50	20	IDGD	
Cc1cccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]32)c1F	1783704615	JEEUHTDMSPIOHD-SZMVWBNQSA-N	434.512	1.100	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)Cc3ccc(OC)cc3Cl)CCO2)C1	1783873761	UISISQQFLJMPHC-PXNSSMCTSA-N	445.343	1.975	50	20	IDGD	
Cc1snc2sc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]4C3)cc12	1784090970	SBOBJDNWOUPWKD-DEQVHRJGSA-N	443.978	1.859	50	20	IDGD	
Cc1noc(-c2ccccc2)c1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]2C1	1784091167	WSFLNYHKNRXTCP-XSLAGTTESA-N	447.919	1.843	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Cl)C[C@@H]21)c1cccnc1OCC1CC1	1785732274	AGYINCSZINNNRT-QSPRXWTASA-N	425.888	1.998	50	20	IDGD	
CC(=O)N[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]2C1)c1ccc(F)cc1	1787448616	CJEGNPNGZQQOGR-FUJDEKNSSA-N	443.878	1.517	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3n[nH]c4ccccc34)[C@H]2C1	1788334449	LKJYZSDOQJAQDG-DUPGQFARSA-N	435.322	1.940	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc4c3NC(=O)C4=O)[C@H]2C1	1788434579	ZRSOYGDYGJYDBH-SJWGOKEGSA-N	447.919	1.822	50	20	IDGD	
CC1=CC[C@@H](C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)CC1	1788611202	ORSZMIXDNOWJLB-LPWQTFTOSA-N	441.532	1.025	50	20	IDGD	
CC(=O)OC[C@@H](OC(C)=O)C(=O)Nc1ccc(C2(NC(=O)[C@@H](O)CCl)CCC2)cc1	1789542229	GZZZIQJNRUPEHJ-DLBZAZTESA-N	440.880	1.215	50	20	IDGD	
Cc1cccc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]3C2)n1	1789921224	CCSDYAZVXXSVRM-QEWYBTABSA-N	428.302	1.603	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3ccccn3)C[C@@H]21)[C@@H](F)Br	1789922814	VARLZVKCUZDJDU-NZUILWFCSA-N	428.302	1.684	50	20	IDGD	
CN(C)c1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]3C2)cn1	1789924503	IDZAESSEUPWJJE-YXWQFLTLSA-N	443.317	1.431	50	20	IDGD	
C[C@@H](Cn1ccnc1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]2C1	1789926901	KMNBCSBRFIVLSY-YYFQZIEXSA-N	431.306	1.189	50	20	IDGD	
CCCC(=O)N[C@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)Br)[C@H]2C1	1791055731	HGCVVIQYWCASMB-AICCOOGYSA-N	432.359	1.054	50	20	IDGD	
COC(=O)[C@H]1CCC[C@@H](C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)C(Cl)Cl)C[C@@H]32)C1	1791247573	LASRWUIJWYWQIK-QTVXIADOSA-N	435.348	1.749	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4c(cnn4C)c3)C[C@@H]21	1791254958	XTKWRHPWJMPSND-XPYUAMARSA-N	434.924	1.420	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](Br)Cc1ccccc1)C2)c1cc[nH]n1	1793507556	PLZXTKLTROFZTR-KYHPRHEASA-N	447.333	1.619	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cn2nc(C)sc2n1	1793662328	ITYLOGPDUJHCGG-FAXLKDOZSA-N	425.942	1.249	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C(F)(F)C(F)F	1793946570	FNQCPXIBBTXINH-MSSISCLTSA-N	431.390	1.659	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1n[nH]c3c1CCCC3)C2	1795112612	LZYCLTHNADRUFC-DRXBFXEBSA-N	425.327	1.277	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@H]2[C@H](C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@@H](F)Cl)[C@@H]2C1	1796369342	AIMJSNWFCZKQLC-OAFXHQAOSA-N	445.919	1.223	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@]1(C)CC=CCC1)C2	1796446207	PAFNPRPDIOWNLB-MRGAGSPKSA-N	441.532	1.456	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)c1ccc(OC(F)F)cc1F	1798551848	OZKSVHYFZFMVPR-OWLDWWDNSA-N	436.814	1.230	50	20	IDGD	
C[C@H](NC(=O)c1cnccn1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](C)Br)C2	1798554007	RRWCEZBAIGDHHO-XHJNMGKDSA-N	438.326	1.017	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccn3cncc3c1)C2	1799276269	IQEIVBAMVSXBKS-MVWRLGRASA-N	425.316	1.774	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1csc(C(F)(F)F)n1)C2	1800978315	ADRAXAOLVKCSSI-WYFGTUCQSA-N	441.859	1.619	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cn1ccc3sccc3c1=O)C2)C(Cl)Cl	1801015877	NZBXBLRBLMKKNL-QHBPRCKVSA-N	444.340	1.456	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCNC(=O)OC(C)(C)C	1801958114	KLVBRWLBHODATH-GUIRCDHDSA-N	448.358	1.274	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc(S(C)(=O)=O)c1)C2	1802271555	UHHHKPUZFQSZEB-JYYAWHABSA-N	428.938	1.596	50	20	IDGD	
O=C([C@H](O)CCl)N1CCC2(CCCN(C(=O)[C@@H]3CC(=O)N(C4CCCC4)C3)C2)CC1	1806604155	MRQSKSPVSGJKPT-SJLPKXTDSA-N	439.984	1.608	50	20	IDGD	
N=C(N)SCCC(=O)NC[C@@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1	1807122237	OBOYSYCLZUWXJM-BBRMVZONSA-N	442.383	1.889	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@@H](CNC(=O)c2cc(O)n[nH]2)[C@H]1c1cccnc1	1807284015	ONSOZJLXPHCFRF-PVXIVEMSSA-N	436.310	1.861	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)c1cnc2ccccn12	1809213978	GKECPWOLQVKJFN-VDZJLULYSA-N	427.892	1.649	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@H]1c1cccnc1)c1cnc(O)[nH]1	1810949958	GSKHOQHHXLVEHB-WCFLWFBJSA-N	426.246	1.520	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)CSCC(=O)OC)[C@@H]1c1cccnc1	1813028524	RVRXEDAEEFZTRN-RLFYNMQTSA-N	443.953	1.247	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)C23CC(F)(C2)C3)[C@H]1c1cccnc1	1813068138	IVKHYUXAFJWIGJ-GCKXXRJTSA-N	431.512	1.353	50	20	IDGD	
CN1CCN(C2(C(=O)N[C@H]3CCc4nc(NC(=O)[C@H](F)Cl)sc4C3)CC2)CC1	1817128651	QCRNWDRHRDOIPG-FZMZJTMJSA-N	429.949	1.370	50	20	IDGD	
CCc1ccnc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)c1	1817768980	YJCVOEKRBRRVJZ-HXUWFJFHSA-N	447.304	1.667	50	20	IDGD	
O=C1Cc2cc(C(=O)Nc3nc4c(s3)C[C@H](NC(=O)[C@H](O)CCl)CC4)ccc2N1	1818918764	DPUGVLXWAIZDGH-BXUZGUMPSA-N	434.905	1.463	50	20	IDGD	
COc1cc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)CO[Si](C)(C)C)CC3)nn1C	1821770692	CJQCPZPKZRYHIQ-NSHDSACASA-N	437.598	1.963	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)COC(=O)C(F)(F)F)[nH]n1	1822369759	HXGCOBDSAYPILV-MWLCHTKSSA-N	440.806	1.761	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)C1CCSCC1	1823544887	NDJIIKVZSBKTAR-GOSISDBHSA-N	442.350	1.539	50	20	IDGD	
CCS(=O)(=O)N[C@@H](C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)C(Cl)Cl)CC1	1824461604	HKLJFIAJIOHVDD-JSGCOSHPSA-N	442.409	1.738	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@H](F)Cl)CC2)c1cnc2c(c1)CCNCC2	1824640222	QOAFKWZQTMKWGN-WBMJQRKESA-N	437.928	1.987	50	20	IDGD	
CN1N=C(C(=O)N2CCCC[C@H]2C2CCN(C(=O)CCBr)CC2)CCC1=O	1824923647	IYURXBFXOITMNS-INIZCTEOSA-N	441.370	1.999	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1coc(Cl)n1)CC2	1826080759	WWGSYIQSAJAPEN-VIFPVBQESA-N	440.913	1.383	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnccc1F)CC2	1826085415	RTGOAGDUVFCFON-LLVKDONJSA-N	434.497	1.276	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccccc1F)CC2	1826088377	FFQLACSTTNLHOP-LBPRGKRZSA-N	433.509	1.881	50	20	IDGD	
Cc1cc(Cl)ccc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1830719800	KSTLKLMYASJJOY-APWZRJJASA-N	431.316	1.318	50	20	IDGD	
O=C(c1cc2c(s1)CCCC2)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1830730783	DTRUVUGWWRBCFY-FOIQADDNSA-N	442.965	1.297	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccc(C#N)cc3)C2)C1	1831638110	AWDCTGSXNAYBQD-SIKLNZKXSA-N	433.936	1.965	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)C2=NN(C)C(=O)CC2)CC1	1831648453	GOQDCAULEHMUSW-CZUORRHYSA-N	441.370	1.998	50	20	IDGD	
C=C(CC(=O)OCC)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](Cl)CCC)CCO2	1831653535	HNYFQALXOYSYLL-OXQOHEQNSA-N	430.929	1.360	50	20	IDGD	
C[C@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1)n1ccnc1	1831870495	DJMDKYLULGKMKS-MJGOQNOKSA-N	432.569	1.437	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)CCN3CCCCC3)CC2)CC1)[C@@H](O)CCl	1833309018	JIMSZCVOQFJMQY-IBGZPJMESA-N	429.005	1.034	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCOc3ccccc3)CCO2)C1	1834833352	MURCYBAZSYEMQA-WIYYLYMNSA-N	440.924	1.166	50	20	IDGD	
O=C(CCc1ccccc1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1834840627	RSCGRNIKBXLQQZ-MJGOQNOKSA-N	443.313	1.766	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cnn4c3OCCC4)CC2)CC1)[C@@H](F)Cl	1835081098	HNXDFUVCHSCSHG-MRXNPFEDSA-N	427.908	1.385	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3cc(F)cc(F)c3)CCO2)C1	1836123459	UXRKKWJRGTXNGN-PXNSSMCTSA-N	446.878	1.218	50	20	IDGD	
CC(=O)N[C@@H](C)C(=O)N1CCC(OC2CCN(C(=O)CCBr)CC2)CC1	1837655048	NNEDUTRPAZBDBI-ZDUSSCGKSA-N	432.359	1.295	50	20	IDGD	
Cc1cccnc1CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)CO[Si](C)(C)C)CCO2	1837710250	QTJXXWSQOYCHJU-QFIPXVFZSA-N	449.624	1.631	50	20	IDGD	
C[C@@H]1C[C@]1(C)C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1	1837920235	SHFPMHDPVNGETI-MWTRTKDXSA-N	428.338	1.025	50	20	IDGD	
CCOc1cccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](Cl)CC)CCO3)c1O	1839146967	BYGRQKSLGVZUHW-KKSFZXQISA-N	440.924	1.878	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3[nH]cc4c3CCC4)C2)C1	1839153696	OOKKOLMGFYZDIQ-VQTJNVASSA-N	444.359	1.810	50	20	IDGD	
CC(C)[C@H](S)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839199673	ZKAGUINLIBAFFW-HUBLWGQQSA-N	427.336	1.088	50	20	IDGD	
O=C(C1CC2(CCC2)C1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839203513	NKCIYTIUUMLPES-KSSFIOAISA-N	433.318	1.714	50	20	IDGD	
O=C(c1cc(F)ccc1Cl)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1	1839325474	XATDBOFSSUJGCT-QAPCUYQASA-N	435.279	1.149	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccc(F)cc3OC)CCO2)C1	1840934564	FZHVGTICSMRBKU-UTKZUKDTSA-N	442.915	1.851	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC2(CCCN2C(=O)[C@H](O)C(C)(C)C)C1	1841312560	ZXEUQMJPIGFHDF-KBPBESRZSA-N	431.961	1.729	50	20	IDGD	
C[C@H]1CC[C@@H](C(=O)N2CC3(CCCN3C(=O)[C@@H](O)CCl)C2)N1C(=O)OC(C)(C)C	1841348788	SFIVTFSFVLYRDU-KKUMJFAQSA-N	429.945	1.578	50	20	IDGD	
CC[C@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1	1841354775	VSZXRIUBOZKWIW-ZNMIVQPWSA-N	431.961	1.729	50	20	IDGD	
Cc1ccc(S(=O)(=O)CC(=O)N2CC3(CCCN3C(=O)CO[Si](C)(C)C)C2)cc1	1844377681	HGJCLMLRSCDLOI-UHFFFAOYSA-N	438.622	1.824	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC2(CCCN2C(=O)c2ccccc2C(=O)OCCO)C1	1844719667	PVIYMZOUUZVLSO-IBGZPJMESA-N	443.327	1.889	50	20	IDGD	
Cc1ccc(C(=O)N2CC3(CCCN3C(=O)CN(C)NC(=O)NCc3ccccc3)C2)o1	1845038304	ODWPRXDJYRUJRQ-UHFFFAOYSA-N	439.516	1.751	50	20	IDGD	
COc1cc(Cl)ccc1CC(=O)N1CCCC12CN(C(=O)CCC(=O)NN(C)C)C2	1845891854	XKNTXWMLKMIQKT-UHFFFAOYSA-N	436.940	1.468	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)Cc1cc(OC)c(OC)c(OC)c1)C2	1846360909	MXOPDHITYLKESA-OAHLLOKOSA-N	440.924	1.712	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cncc(Br)c2)cc1OC	11027790	DHHSKIVTUKZLLL-UHFFFAOYSA-N	438.234	1.479	50	20	IDGD	
O=C(COC(=O)[C@H]1CC(=O)Nc2cc(F)ccc21)NNC(=O)c1cccc([N+](=O)[O-])c1	12935347	PERPQIBAFVMOOR-AWEZNQCLSA-N	430.348	1.164	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2C1)c1cccc(S(=O)(=O)N2CCCC2)c1	16960293	SHVIGLRFZIDWQA-QGZVFWFLSA-N	429.498	1.483	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2cc(C(=O)OC)cc([N+](=O)[O-])c2)c2ccccc2c1=O	17189598	NRHILPXVDUPRIK-UHFFFAOYSA-N	439.384	1.186	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)CCNC1=NS(=O)(=O)c2ccccc21	21026977	HGHHJYKRGMHSFM-UHFFFAOYSA-N	436.877	1.238	50	20	IDGD	
O=C(COc1ccc(F)cc1Br)NNC(=O)[C@H]1COc2ccccc2O1	26692448	SVCCGAUHDSNKAN-OAHLLOKOSA-N	425.210	1.954	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN(C(=O)c2ccc(F)cc2)C1)c1ccc(-n2cnnn2)cc1	27093849	YKMHUJQNLDZNBK-INIZCTEOSA-N	437.435	1.115	50	20	IDGD	
CCOc1ccc(OCc2ccc(C(=O)NNC(=O)CCN3C(=O)CCC3=O)cc2)cc1	27623035	WZURFGKOBHRCAP-UHFFFAOYSA-N	439.468	1.964	50	20	IDGD	
Cc1[nH]c(=O)[nH]c(=O)c1CCC(=O)NNC(=O)CCCOc1ccc(Cl)cc1Cl	27799719	JCQMIYULEJAQBB-UHFFFAOYSA-N	443.287	1.618	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)N2CCN(C(=O)CN3CCOCC3)CC2)c(C)n1CC(C)C	261368513	VXDJOLXTBLBMFT-HMAPJEAMSA-N	441.576	1.671	50	20	IDGD	
C[C@@H](NC(=O)c1cccc(Cl)c1Cl)C(=O)NNC(=O)CNC(=O)c1ccco1	725740004	BEXGPPXLRWFRFK-SECBINFHSA-N	427.244	1.282	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)NNC(=O)CNC(=O)c1ccco1	725873224	WOSXETNACMFAHI-UHFFFAOYSA-N	442.457	1.117	50	20	IDGD	
COc1ccc(CN(C)C(=O)NNC(=O)CNC(=O)c2ccco2)cc1OC(F)F	725873306	XLNQNWNOUFBTLS-UHFFFAOYSA-N	426.376	1.492	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)CNS(=O)(=O)c2ccc(Cl)s2)cc1	725890274	NBZQXZIZVBMIAN-UHFFFAOYSA-N	431.923	1.469	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)/C=C\c1ccccc1)C(=O)NNC(=S)NC(C)(C)C	726136500	GPLFGYZTCPVEMQ-HVCHUGMYSA-N	444.648	1.992	50	20	IDGD	
Cc1noc([C@H](C)NC(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)n1	726278273	HAKYAWHSVJKMKU-ZDUSSCGKSA-N	447.455	1.841	50	20	IDGD	
COc1ccc(C(=O)Nc2cc(F)ccc2C(=O)NNC(=O)C(=O)N2CCCC2)cc1	726533904	NVNHDBKZEDCMBN-UHFFFAOYSA-N	428.420	1.470	50	20	IDGD	
CC[C@@H](C)N(C)CCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	727229273	MEOSSXVNVYJSMT-OAHLLOKOSA-N	425.555	1.145	50	20	IDGD	
O=C(NNc1nc(-c2ccncc2)no1)C1CCN(S(=O)(=O)c2ccccc2F)CC1	728073723	QEPPDOOHVHBHOA-UHFFFAOYSA-N	446.464	1.815	50	20	IDGD	
O=C(COC(=O)c1ccn(-c2ccccc2F)n1)NNC(=O)[C@@H]1COc2ccccc2O1	728326692	FRYFZQFVQBVGOG-SFHVURJKSA-N	440.387	1.156	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@H](C(=O)NNC(=O)N3CCOCC3)C2)c2ccccc12	732063962	QFGSNCUECLOLAH-INIZCTEOSA-N	440.500	1.774	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H]2CCCCN2C)c1	732259185	NWOKZZJLKYXTIE-GOSISDBHSA-N	446.529	1.741	50	20	IDGD	
COC(=O)c1cc(OC(=O)CCc2c(C)nc3c(C(N)=O)cnn3c2C)ccc1[N+](=O)[O-]	732652469	CQLSMQOYHWBWIS-UHFFFAOYSA-N	441.400	1.678	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c(F)cc1F	733122820	BDQSQCXBIQYBLB-UHFFFAOYSA-N	436.396	1.560	50	20	IDGD	
Cn1c(NNC(=O)c2oc3ccccc3c2CS(C)(=O)=O)nc2ccccc2c1=O	733263169	LZABZHMNDPVKBB-UHFFFAOYSA-N	426.454	1.981	50	20	IDGD	
CCOCCCn1c(NNC(=O)[C@H](C)NC(=O)C2CCCC2)nc2ccccc2c1=O	733268922	VDTRJXOKGZOFNO-HNNXBMFYSA-N	429.521	1.961	50	20	IDGD	
CCC[C@@H](C)NS(=O)(=O)c1cc(C(=O)NNC(=O)CN(C)C)c(Cl)cc1Cl	733359389	GODAXIGVAZLUFI-SNVBAGLBSA-N	439.365	1.783	50	20	IDGD	
CC(C)n1c(C(F)(F)F)nc2cc(C(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)ccc21	734389696	UZZGDLHUPNIISW-LLVKDONJSA-N	432.424	1.832	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@@H]2CCc3ccccc3C2)c1	735383943	FMGCVJHGBSLNSX-OAHLLOKOSA-N	430.530	1.686	50	20	IDGD	
CCc1ccc(O[C@H](C)C(=O)N2CCN([C@H](C)C(=O)NNC(=O)CC(C)C)CC2)cc1	736620855	DSLCFNZKKKFLTI-QZTJIDSGSA-N	432.565	1.743	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)N[C@@H]1CCN(c2ccc(Cl)cc2)C1=O	740026076	PIVIETBOBIDDTQ-MRXNPFEDSA-N	440.851	1.065	50	20	IDGD	
O=C(CC[S@](=O)c1ccc2c(c1)OCCO2)NNC(=O)c1ccc2ccccc2n1	740748905	CXCIRDUIYDTVIL-PMERELPUSA-N	425.466	1.965	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)NCCCOC[C@@H]1CCOC1	740921222	YDPNHDMJVCHKTL-ZDUSSCGKSA-N	430.299	1.602	50	20	IDGD	
COc1ccc(Br)cc1C(=O)NNC(=O)c1csc(N2CCOCC2)n1	741662327	NUFWKGOZCXHSDG-UHFFFAOYSA-N	441.307	1.826	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)c2ccc(S(=O)(=O)CC(=O)N(C)C)cc2)c1	742033997	UDOYRFGJBJZIKW-UHFFFAOYSA-N	447.513	1.005	50	20	IDGD	
Cc1nn(C)c(C)c1S(=O)(=O)N[C@H](C)C(=O)NNC(=O)c1ccc(Cl)cc1Cl	742035225	CTWBRZYCVXMQHZ-SECBINFHSA-N	448.332	1.472	50	20	IDGD	
Cc1nn(C)c(C)c1S(=O)(=O)N[C@@H](C)C(=O)NNC(=O)Cc1cccc2ccccc12	742039207	AUGKCPZZCSBSSJ-AWEZNQCLSA-N	443.529	1.247	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)N1CCN(c2ncnc3ccsc23)CC1	743577965	USIMUJFEBABYNH-UHFFFAOYSA-N	445.530	1.046	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)c1cc(Br)ccc1O)S(=O)(=O)c1ccc(F)cc1	743730947	IVYBBRSNMPRCEG-VIFPVBQESA-N	445.266	1.917	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H](c2ccccc2)N(C)C)c1	744313652	FRHQKNJKHFHPOE-IBGZPJMESA-N	432.546	1.781	50	20	IDGD	
O=C(CSc1nnc(O)nc1O)NN=C1CCC[C@H](N2C(=O)c3ccccc3C2=O)C1	745201215	NKOJAUZOKHZBMG-NSHDSACASA-N	442.457	1.086	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2cc(OCc3ccccc3)ccn2)n1	745648365	KTSRKEUJWNWGRD-UHFFFAOYSA-N	440.481	1.972	50	20	IDGD	
O=C(CCNC(=O)NC12CC3CC(CC(C3)C1)C2)NNC(=O)Cc1cn2ccccc2n1	746556497	XGEVSYNNHVUGNZ-UHFFFAOYSA-N	438.532	1.682	50	20	IDGD	
COc1ccc(NNC(=O)c2ccc3c(c2)S(=O)(=O)N(C[C@@H]2CCCO2)C3=O)cc1	746883033	KTZVTZVJARFLEC-INIZCTEOSA-N	431.470	1.776	50	20	IDGD	
C[C@H]1C[C@@H](C)CN(S(=O)(=O)c2cccc(C(=O)NNC(=O)Cc3ccncc3)c2)C1	747318612	AESUEOFIXVWAAR-IYBDPMFKSA-N	430.530	1.752	50	20	IDGD	
CC(C)Cn1c(=O)nc(O)c2c(C(=O)NNC(=O)Cc3ccncc3)cc(C(C)C)nc21	747429930	WDCSQUIWTKZYAQ-UHFFFAOYSA-N	438.488	1.675	50	20	IDGD	
NC(=O)C1CCN(c2ncccc2CNC(=O)NNC(=O)c2ccc(Cl)cc2F)CC1	747501414	WJNPLUZWFZXCQA-UHFFFAOYSA-N	448.886	1.720	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2ccc[nH]2)cc1S(=O)(=O)N(C)Cc1ccccc1	747663022	HQRIIXPSVWBNGG-UHFFFAOYSA-N	442.497	1.919	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCCN1C(=O)/C=C/c1ccc(Cl)cc1)C(=O)N1CCCC1	748239188	FEWZJXXOYAEHJQ-VGMNTSGFSA-N	432.908	1.504	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@](F)(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)C1	748310535	PMCXWFBENMFQOG-FQEVSTJZSA-N	436.488	1.190	50	20	IDGD	
O=C(NNC(=O)C(F)(F)C(F)F)c1cccc(S(=O)(=O)NCc2ccccc2)c1	749332530	XKYATGYZVPDXJX-UHFFFAOYSA-N	433.383	1.827	50	20	IDGD	
COCCN1C(=O)c2ccc(C(=O)NNC(=O)c3cc4ccccc4o3)cc2S1(=O)=O	749477758	SUPVAYYJJZVMRP-UHFFFAOYSA-N	443.437	1.299	50	20	IDGD	
Cc1oc(-c2ccco2)nc1CC(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	750192090	XQTWPDICHCKDSU-UHFFFAOYSA-N	428.357	1.698	50	20	IDGD	
Cc1nc(-c2cccnc2)nc(NNC(=O)c2ccc([C@@]3(C)NC(=O)NC3=O)cc2)c1C	751066513	JAPNCNDESVMKIO-JOCHJYFZSA-N	431.456	1.967	50	20	IDGD	
CC(C)(C)NC(=O)CN1CCC(CNC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)CC1	751112391	VXMAIRLFLONPEG-UHFFFAOYSA-N	434.497	1.166	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)c1cccc(CS(=O)(=O)c2ccccc2)c1	751204222	WJNLMPSIBFYQJO-UHFFFAOYSA-N	441.465	1.445	50	20	IDGD	
O=C(NNC(=O)c1cc(Cn2cc(Br)cn2)on1)c1cccc([N+](=O)[O-])c1	751523339	KGXRNGVDRQIQPG-UHFFFAOYSA-N	435.194	1.665	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)NCc2cccc(NC(=O)CCN3CCOCC3)c2)o1	752361176	AMGNQXWQDKVJOX-UHFFFAOYSA-N	429.477	1.393	50	20	IDGD	
C[C@H]1CN(C2CC2)CC1=NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	755878946	FPHRULBZQGBETO-INIZCTEOSA-N	434.562	1.226	50	20	IDGD	
CC(C)(C)OC(=O)N1CCc2cc(NC(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)ccc21	756308732	DPTQCFHMZIKOCI-CYBMUJFWSA-N	438.506	1.572	50	20	IDGD	
COC(=O)[C@@H]1c2ccccc2CCN1CC(=O)NNC(=O)c1ccc(OC)c(OC)c1	756608821	VUPOGBNYVJGKOV-FQEVSTJZSA-N	427.457	1.237	50	20	IDGD	
CC(C)(C)OC(=O)Nc1ccc(F)c(NC(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)c1	756620415	KBTOKFPEUOBTQQ-JTQLQIEISA-N	430.458	1.760	50	20	IDGD	
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)cc1	756813747	CIXKEKDOXONCCX-NWDGAFQWSA-N	443.526	1.363	50	20	IDGD	
COCCNC(=O)Cn1cc(NC(=O)NNC(=O)c2cc3c(s2)CCCCCC3)cn1	756843721	HYCQHCNSNSKDQE-UHFFFAOYSA-N	448.549	1.833	50	20	IDGD	
CCOC(=O)Cn1cccc(NC(=O)NNC(=O)c2ccc(Br)s2)c1=O	757765624	WACAFTUBJSXQIP-UHFFFAOYSA-N	443.279	1.702	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)c1cc(C(F)(F)F)ccc1Br	758045068	BGAFJSLYGRPTLC-ZCFIWIBFSA-N	432.218	1.167	50	20	IDGD	
C[C@H]1CC(C)(C)C[C@@]2(C1)NC(=O)N(CC(=O)NNc1nc(O)c3ccccc3n1)C2=O	758296285	XJGASYDWQQVWGX-LAJNKCICSA-N	426.477	1.915	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN1C(=O)c1ccccc1OC(F)F)C(=O)Nc1ccccn1	758831081	OCKOZCUNKRFMER-CYBMUJFWSA-N	447.398	1.074	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)[C@@](C)(O)CN1C(=O)C(C)(C)c2ccccc21	758887649	SSXDWMMNOAIHEB-FPTDNZKUSA-N	433.505	1.187	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)[C@@](C)(O)CN1C(=O)C(C)(C)c2ccccc21	758887651	SSXDWMMNOAIHEB-PEBXRYMYSA-N	433.505	1.187	50	20	IDGD	
NC(=O)CC[C@@H](NC(=O)OCc1ccccc1)C(=O)NNC(=O)c1cccc2cccnc12	760138082	ALOUSYQMSBPUGO-GOSISDBHSA-N	449.467	1.556	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)c1ccc(OC)c(N2CCNC2=O)c1	762374798	YBDDNGMNZZXZLW-UHFFFAOYSA-N	430.486	1.787	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NN=Cc1ccc(OCCBr)c(Cl)c1	763172494	NWQHYBGJVXMZLE-VIFPVBQESA-N	426.720	1.502	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(=O)n(Cc2ccccc2)c1	763471811	LMNUYUMGBZRPDB-UHFFFAOYSA-N	435.396	1.205	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](CNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)C1CC1	763497580	GZVOZPOIILWXPG-MRXNPFEDSA-N	447.540	1.327	50	20	IDGD	
Cc1cn(-c2ccc(C#N)cn2)nc1NC(=O)C(=O)NNC(=O)c1c[nH]c2ccccc12	763539211	KEDTVCOCCHDJMA-UHFFFAOYSA-N	428.412	1.328	50	20	IDGD	
CC(C)(C)S(=O)(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)c2ccccc2F)c1	763574958	MNHSKFQSTIJTDB-UHFFFAOYSA-N	435.477	1.939	50	20	IDGD	
CC(C)(C)c1ncc(NC(=O)C(=O)NNC(=O)COc2cccc(C(F)(F)F)c2)cn1	763641270	SJZLEWBDRZAJKU-UHFFFAOYSA-N	439.394	1.958	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N1CCC[C@H](S(C)(=O)=O)C1	763642350	QKBZNVNEBVTFMT-FZMZJTMJSA-N	448.339	1.466	50	20	IDGD	
CCOC(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)COc2ccc(C)c(C)c2)c1	763664380	AZZGVLCQAPNTPQ-UHFFFAOYSA-N	427.457	1.574	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccnn2-c2cccc(Cl)c2)cc1	763674694	PFYYCSOKSJGJDS-UHFFFAOYSA-N	438.831	1.562	50	20	IDGD	
N#CCn1cc(NC(=O)C(=O)NNC(=O)COc2ccc(OCc3ccccc3)cc2)cn1	763679023	FUXNQSKDROTYKN-UHFFFAOYSA-N	448.439	1.151	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)ccc1Br	763682572	WPFAVZKETKOBPU-UHFFFAOYSA-N	431.246	1.794	50	20	IDGD	
C#CCOc1ccc(F)cc1NC(=O)C(=O)NNC(=O)COc1ccccc1OCC	763684466	LVVDWQCQVMSAGG-UHFFFAOYSA-N	429.404	1.401	50	20	IDGD	
Cc1ccc(N2CCOC2=O)cc1NC(=O)C(=O)NNC(=O)COc1ccc(Cl)cc1	763693620	ASYWYHHBCCFMAU-UHFFFAOYSA-N	446.847	1.770	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccccc1C(=O)N1CCCC1	763716697	KFGONEYCVYJMKU-UHFFFAOYSA-N	438.484	1.650	50	20	IDGD	
CN(C)CCOc1cccc(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)c1	763728211	JKNVLDJLFXWIMK-UHFFFAOYSA-N	439.516	1.166	50	20	IDGD	
CC1(C)Oc2ccc(NC(=O)C(=O)NNC(=O)COc3ccccc3[N+](=O)[O-])cc2O1	763809212	SOKBSLGYAOLITK-UHFFFAOYSA-N	430.373	1.267	50	20	IDGD	
CC(C)CCn1nc(C(=O)NNC(=O)C(=O)Nc2ccccc2F)c2ccccc2c1=O	763843048	MSGRYXRIXISIGI-UHFFFAOYSA-N	439.447	1.981	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)NNC(=O)C(=O)Nc1ccc(NC(=O)[C@@H]2CCCO2)cc1	763857657	NYBRTOVQOOZNSU-IBGZPJMESA-N	449.467	1.614	50	20	IDGD	
Cc1ccc(Cn2nccc2NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)s1	763871157	DYSDSWSCIVBAQG-CYBMUJFWSA-N	445.476	1.994	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccccc2O[C@H](C)C#N)cc1	763876534	GRFWFMSXFQLCAX-UKRRQHHQSA-N	438.440	1.733	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(OC)ccc2C(=O)OC)cc1OC	763901732	JQOKFYGRHGAPSP-UHFFFAOYSA-N	445.428	1.289	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)C(=O)Nc1cnn(-c2cnc3ccccc3n2)c1	763918149	BIMNKDXRBVUROM-UHFFFAOYSA-N	433.403	1.283	50	20	IDGD	
CS(=O)(=O)Cc1cc(F)ccc1NC(=O)C(=O)NNC(=O)Cc1ccc(Cl)cc1	763936712	QAUDBWVOOFEAMP-UHFFFAOYSA-N	441.868	1.352	50	20	IDGD	
O=C(NNC(=O)c1ccc(COc2ccccc2)o1)C(=O)Nc1cnn(CC(F)F)c1	763955138	HTALXIDDGXGGOA-UHFFFAOYSA-N	433.371	1.720	50	20	IDGD	
CCN(CC)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)cc1	764116878	JIPCAKIDURUPOC-UHFFFAOYSA-N	432.864	1.927	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2cccc(Cl)c2-n2cccn2)c1O	764132096	JOKQDUPVOMQOGY-UHFFFAOYSA-N	429.820	1.640	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2O1)C(=O)Nc1ccc([S@](=O)C(F)(F)F)cc1	764168256	PAANSEZGRXRILU-WYIRRWHOSA-N	441.387	1.404	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1cc(F)ccc1OC[C@@H]1CCCO1	764274677	AUGJQSBUVBRPMR-AWEZNQCLSA-N	447.419	1.254	50	20	IDGD	
CCCNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c1	764342205	DAQSXTIBLJBTOZ-UHFFFAOYSA-N	434.456	1.412	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)c(F)cc1F	764349132	JQANPEBOFYBTQV-UHFFFAOYSA-N	427.747	1.510	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2cnn(-c3ccccc3)c2)n[nH]1	764376261	ALWWGDMWPOACFN-UHFFFAOYSA-N	445.439	1.671	50	20	IDGD	
COc1cc(F)c(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)cc1OC	764387744	MWVDSFSBLVWNBV-UHFFFAOYSA-N	445.382	1.772	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)C(=O)Nc1cccc(CN2CCCC2=O)c1	764403774	AWTIJVOIKRXYPX-UHFFFAOYSA-N	442.497	1.393	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1SC1CCCC1)N[C@@H]1CCS(=O)(=O)C1	764874240	PDJANDADJUJVQF-LLVKDONJSA-N	442.519	1.761	50	20	IDGD	
CCOc1nccc(C)c1C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	765464799	MGLCSJBKXLVJNA-UHFFFAOYSA-N	433.534	1.482	50	20	IDGD	
COc1ccc(C(=O)NCC(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)cc1OC	765564733	HJDNCWCQYZGTCH-UHFFFAOYSA-N	429.458	1.346	50	20	IDGD	
COc1ccc(CN2C[C@@H](C(=O)NNC(=O)c3cc(-c4cccs4)[nH]n3)CC2=O)cc1	765570224	WZJALDBPPMSPLE-AWEZNQCLSA-N	439.497	1.957	50	20	IDGD	
Cc1nn2cccnc2c1C(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	766659932	JXSFSUFJLGQJSB-UHFFFAOYSA-N	441.923	1.270	50	20	IDGD	
Cc1ccc(C(=O)NNc2ncnc3ccsc23)cc1S(=O)(=O)N1CCOCC1	766676759	SCLUYGSZZWTMJS-UHFFFAOYSA-N	433.515	1.778	50	20	IDGD	
O=C(COC(=O)CCCC(=O)c1ccc2c(c1)OCCO2)NNC(=O)c1ccccc1	766757290	YTEKSEXDZZDRMN-UHFFFAOYSA-N	426.425	1.815	50	20	IDGD	
O=C(CCC(=O)N1CCN(c2ccccc2)CC1)NNC(=O)c1ccc(Cl)cc1O	767889601	AEPBHAKNVYPYAE-UHFFFAOYSA-N	430.892	1.936	50	20	IDGD	
Cc1ncc([N+](=O)[O-])cc1C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	768568837	IRCNJYGWEFZFAN-UHFFFAOYSA-N	433.446	1.158	50	20	IDGD	
CCOc1ccccc1N1C[C@H](C(=O)NNc2c(OC)cccc2S(C)(=O)=O)CC1=O	768640176	XSUSXIFITZLMSG-CQSZACIVSA-N	447.513	1.994	50	20	IDGD	
CS(=O)(=O)c1cc(S(=O)(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c(Cl)s1	770634230	JWQKFLPVCNPQFE-UHFFFAOYSA-N	439.880	1.337	50	20	IDGD	
O=C(NNC(=O)c1cc(C(F)(F)F)ccc1Br)N[C@@H]1CCS(=O)(=O)C1	770881690	KMNHFJRHSQXKES-MRVPVSSYSA-N	444.229	1.599	50	20	IDGD	
Cc1nn2c(=O)c3ccccc3[nH]c2c1C=NNC(=O)C(=O)NCc1ccc(Cl)cc1	771573419	WSRPSCDFXXSELO-UHFFFAOYSA-N	436.859	1.904	50	20	IDGD	
Cc1cccc(F)c1NNC(=O)CCC(=O)N1CCN(S(=O)(=O)c2ccccc2)CC1	771707302	NOOQPEFKWXLIJK-UHFFFAOYSA-N	448.520	1.891	50	20	IDGD	
N#Cc1ccc(N2CCC[C@H]2C(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)cc1	772885239	XRUBTENFEQBTPU-SFHVURJKSA-N	425.876	1.644	50	20	IDGD	
CON(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)cc1	772964155	QEDYIFKPDIORPE-GFCCVEGCSA-N	441.893	1.750	50	20	IDGD	
O=C(COC(=O)[C@@H]1CCN(C(=O)OCc2ccccc2)C1)NNC(=O)c1cccs1	773578149	QPAIUHXEIIPYED-OAHLLOKOSA-N	431.470	1.711	50	20	IDGD	
CON(C)S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccc(C(F)(F)F)cn2)cc1	773666477	DACKMUGWKINMSF-UHFFFAOYSA-N	447.395	1.364	50	20	IDGD	
CON(C)S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccc(C(F)(F)F)cc2)cc1	773768914	NJTQBARHSNFBFI-UHFFFAOYSA-N	446.407	1.969	50	20	IDGD	
COc1cc2c(cc1OC)CN(Cc1ccccc1NC(=O)NNC(=O)CN(C)C)CC2	775569579	FSVCDDLZQUONCM-UHFFFAOYSA-N	441.532	1.976	50	20	IDGD	
CN(CC(=O)NNc1cccc(S(C)(=O)=O)c1)S(=O)(=O)c1ccc(Cl)cc1	776533356	MEIQTZVXXOMBLN-UHFFFAOYSA-N	431.923	1.507	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)[C@@]2(F)CCN(C(=O)OCc3ccccc3)C2)cc1	776965975	GWZPCBSMKJXVBP-JOCHJYFZSA-N	440.431	1.835	50	20	IDGD	
Cc1cc2ccccc2nc1NNC(=O)[C@H]1CC(=O)N(c2cccc(S(N)(=O)=O)c2)C1	777481940	ZTQXSHBSQUTUDE-HNNXBMFYSA-N	439.497	1.687	50	20	IDGD	
O=C(/C=C\C(=O)Nc1ccc2n[nH]cc2c1)NNc1ccc(S(=O)(=O)NC2CC2)cc1	778689171	FYSMMZIVMJWSQL-KTKRTIGZSA-N	440.485	1.642	50	20	IDGD	
COC(=O)NNC(=O)CC(CC(=O)NNC(=O)OC)c1ccc(Br)c(C)c1	779371068	NNIGVLTUWPFECO-UHFFFAOYSA-N	445.270	1.396	50	20	IDGD	
Cc1cc(N2C[C@H](C(=O)NNC(=O)C(=O)NCc3ccc(Cl)cc3)CC2=O)ccc1F	779950432	NNXDQLMTNCYADG-CQSZACIVSA-N	446.866	1.604	50	20	IDGD	
CCOc1cc(N2CCOC(C)(C)C2)ccc1NC(=O)C(=O)NNC(=O)c1cc(C)[nH]n1	782118199	WFZMYPRHKDIBDL-UHFFFAOYSA-N	444.492	1.132	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2ccc(S(=O)(=O)N3CCCCCC3)cc2)nc1	782140249	FZINDZMYFQSIQF-UHFFFAOYSA-N	447.517	1.737	50	20	IDGD	
CC(C)(C)OC(=O)Nc1cnc(C(=O)NNC(=O)c2nnc(O)c3ccccc23)cn1	783033468	IZLVADJDMLKFHY-UHFFFAOYSA-N	425.405	1.547	50	20	IDGD	
CCN(CC)c1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)cn1	783265204	WBJWDOHHSOYCRN-UHFFFAOYSA-N	449.537	1.091	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2ccc(-n3cccn3)cc2C(F)(F)F)CCS(=O)(=O)C1	783426067	FPTCLJNHTSAUTB-MRXNPFEDSA-N	445.423	1.028	50	20	IDGD	
Cc1ccccc1-n1nc(C(C)(C)C)cc1NC(=O)C(=O)NN[C@@]1(C)CCS(=O)(=O)C1	783426599	HRNSUSPIDKHTPO-NRFANRHFSA-N	447.561	1.615	50	20	IDGD	
CCCN1C(=O)CCc2cc(NC(=O)C(=O)NNc3ccc(-n4cccn4)nn3)ccc21	783433652	WWPMQHSUCKIRHU-UHFFFAOYSA-N	434.460	1.433	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNc2cccc(C(=O)OC)c2)cc1Cl	784854204	UJQCEPZKWBYQIT-UHFFFAOYSA-N	435.820	1.760	50	20	IDGD	
C[C@@H](OC(=O)/C(C#N)=C/c1ccccc1)C(=O)NCCc1ccc(S(N)(=O)=O)cc1	785364544	QGELDEKFZMNFJW-COYFKBPASA-N	427.482	1.532	50	20	IDGD	
CCOCCCn1c(NNC(=O)C(C)(C)S(=O)(=O)C2CC2)nc2ccccc2c1=O	786169420	XLHSIQWKCQGYJO-UHFFFAOYSA-N	436.534	1.622	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)Cc2c[nH]c3ccccc23)cccc1N1CCNC1=O	787544782	XSLQNNGAZQKUBJ-UHFFFAOYSA-N	434.456	1.335	50	20	IDGD	
CC(C)n1cc(S(=O)(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)cn1	788916488	LBIWYBFQDIPUFJ-UHFFFAOYSA-N	430.531	1.262	50	20	IDGD	
CS(=O)(=O)CC[C@H](C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)c1ccccc1	789895783	GDBCKOWURKERNK-KRWDZBQOSA-N	438.527	1.070	50	20	IDGD	
Cc1ccn(C[C@](C)(O)C(=O)NNC(=O)COc2ccccc2-c2ccccc2)c(=O)c1	790462259	LMKSYCIIPJFHED-DEOSSOPVSA-N	435.480	1.801	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1cc([C@H]2CCCOC2)nn1C	790953161	XHOBEVQHRKIRND-ZDUSSCGKSA-N	447.517	1.201	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)[C@@H]2CC(c3cccc(OC)c3)=NO2)c2ccccc2c1=O	791459291	WTXRDOXGBHLVET-IBGZPJMESA-N	449.467	1.769	50	20	IDGD	
O=C(NNC(=O)c1cc2ccccc2o1)C(=O)Nc1ccc(Cc2nnc3n2CCC3)cc1	792265769	IVHRDQAXEPQCFU-UHFFFAOYSA-N	444.451	1.961	50	20	IDGD	
O=C(NNc1nc2ccccn2n1)C(=O)Nc1ccc2c(c1)N(CC(F)F)C(=O)CS2	793055374	NXTBWKOTNUTFML-UHFFFAOYSA-N	447.427	1.515	50	20	IDGD	
Cc1nn(-c2ccccc2)c2sc(C(=O)NNC(=O)NCC3(S(C)(=O)=O)CC3)cc12	793266554	OPQMQZAMUXTZIA-UHFFFAOYSA-N	447.542	1.917	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)c1cccc(NN2C(=O)[C@H]3CC=CC[C@H]3C2=O)c1	793553271	DBOZWVCVAQWKKP-CALCHBBNSA-N	441.488	1.031	50	20	IDGD	
CCOc1cc(C(=O)NNS(=O)(=O)c2ccc(OC)nc2)cc(OCC)c1OCC	795280751	LZXCUWJKZMKFCI-UHFFFAOYSA-N	439.490	1.910	50	20	IDGD	
COC(=O)c1cc(F)c(Br)cc1NC(=O)C(=O)NNc1nccnc1Cl	797082607	TWGFFNZCZBQIAW-UHFFFAOYSA-N	446.620	1.900	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)Nc2ccc(S(=O)(=O)N(C)C)cn2)cc1	797652807	QARWRIKVRJOIET-CYBMUJFWSA-N	449.489	1.155	50	20	IDGD	
Cc1c(/C=C(\C#N)C(=O)N2CCN(CC(=O)N3C[C@H](C)C[C@@H](C)C3)CC2)cc(C#N)n1C	798117152	SHIYMQQIXAZRFU-IIKUJWDSSA-N	436.560	1.761	50	20	IDGD	
Cn1cc2c(n1)CCC[C@H]2C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	798347029	XQYONAPLXYCKDO-MRXNPFEDSA-N	431.518	1.086	50	20	IDGD	
CCOc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccc(F)cc1	799258370	AHCWSZRAAIUTDJ-NSHDSACASA-N	434.380	1.686	50	20	IDGD	
C/C(C=NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C)=C/c1ccccc1C(F)(F)F	799883009	MELGAOKGSWRTBD-NIDAYPGPSA-N	448.405	1.658	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc(F)c(F)c1)NNC(=O)Nc1cc(F)cc(F)c1	802002835	DMPQXPWHYYDIPH-UHFFFAOYSA-N	434.371	1.764	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N=c2cc[nH]cc2)cc1S(=O)(=O)N1CCCCCC1	802030540	IQRJDIHJUFIGTA-UHFFFAOYSA-N	447.517	1.543	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN(C(=O)COc2ccccc2)C1)Nc1ccc2c(c1)OCO2	802097303	JFUQASIQSAZONA-HNNXBMFYSA-N	440.456	1.886	50	20	IDGD	
O=C(NNC(=O)[C@H]1CC(=O)N(c2ccc3c(c2)OCCO3)C1)Nc1ccc2c(c1)OCO2	802103516	DIUOAWRJCQKTDQ-LBPRGKRZSA-N	440.412	1.392	50	20	IDGD	
CCOC1(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(CC)CC)c2)CCOCC1	803649611	JKUYCTNFBPFQLP-UHFFFAOYSA-N	427.523	1.064	50	20	IDGD	
CC(C)Oc1ccc(NS(=O)(=O)CC(=O)NNc2ccc(-n3ccnc3)nn2)cc1	804955132	LUXJDASKNSBQSL-UHFFFAOYSA-N	431.478	1.335	50	20	IDGD	
O=C(Cc1ccc(S(=O)(=O)N2CCOCC2)s1)NNc1nccnc1C1CCC1	805466476	SBCLIMQGEJNBRE-UHFFFAOYSA-N	437.547	1.512	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)C1CN(C(=O)OC(C)(C)C)C1	806272429	GKEMFFZRBAGCMR-GFCCVEGCSA-N	429.477	1.198	50	20	IDGD	
CCOC(=O)C(C)(C)c1csc(NC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)n1	806821822	ZQNLIVWNTVMHID-ZDUSSCGKSA-N	434.474	1.977	50	20	IDGD	
O=C1COC[C@H](C[C@@H]2CN(C(=O)C(=O)NNc3cnc4ccccc4n3)c3ccccc32)N1	806984060	LLZRIFVEPCOLDH-CABCVRRESA-N	446.467	1.108	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)NC[C@@H](c1ccc(F)cc1)N1CCOCC1	807000396	RWUBZVMNHWBMBN-SFHVURJKSA-N	440.479	1.799	50	20	IDGD	
CCn1c(NNC(=O)[C@H](Cc2cnc[nH]2)NC(=O)CC(C)C)nc2ccccc2c1=O	809998806	WCAYXLCWFDFGKI-KRWDZBQOSA-N	425.493	1.356	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)c1nnc2ccccc2n1	810593817	JUCVGMYSOBMNMY-UHFFFAOYSA-N	439.907	1.257	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](C(=O)OCC(=O)NNC(=O)c1ccc(C#N)cc1)C(F)(F)F	811425337	UQUFMLGNVKCPDM-ZDUSSCGKSA-N	444.366	1.318	50	20	IDGD	
O=C(CNC(=O)NNc1ncncc1F)Nc1ccc(I)cc1	814330080	LACHLYUZVSTTGJ-UHFFFAOYSA-N	430.181	1.485	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)c1ccccc1)C(=O)NNC(=O)CNc1ccccc1	823327486	NKXDATFXIPAYBO-KRWDZBQOSA-N	436.559	1.346	50	20	IDGD	
CCCCN(CC(=O)NNC(=O)c1cccs1)c1c(O)nc(=O)n(CC(C)C)c1N	841517412	UAYKEQVJLURWBA-UHFFFAOYSA-N	436.538	1.316	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)[C@H]1CC(=O)N(c2ccc(F)c([N+](=O)[O-])c2)C1	913123289	GNMSVFPBOFDIRZ-RYUDHWBXSA-N	448.382	1.841	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CNc2ccc(C)cc2)cc1S(=O)(=O)N1CCCC1	913431535	PHJGNNSGXRQDAW-UHFFFAOYSA-N	446.529	1.661	50	20	IDGD	
CCN(CC)Cc1ccccc1CNC(=O)NNC(=O)c1csc(N2CCOCC2)n1	913638348	JHPYSXLIQKTTJJ-UHFFFAOYSA-N	446.577	1.966	50	20	IDGD	
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC(=NNC(=O)c2c(C)nc3ccccn23)CC1	914554234	FODRPDBZFHPLTA-UHFFFAOYSA-N	429.506	1.553	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(N3CCCCCC3)nc2)c1	914603867	WUPUZOSIDSGAHB-UHFFFAOYSA-N	445.545	1.787	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)CNS(=O)(=O)c2ccc(C#N)cc2)c1C	915787995	QLDBMGMZSJMNQI-HNNXBMFYSA-N	430.486	1.068	50	20	IDGD	
Cc1ccc(-n2nc(C)c(CC(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)c2C)cc1Cl	915832397	YHMYMMDEPCXQPO-CQSZACIVSA-N	438.937	1.576	50	20	IDGD	
CN(C)C1(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)CCCC1	915897832	MNHJZBDWFHUPBF-UHFFFAOYSA-N	437.566	1.290	50	20	IDGD	
COc1cc2c(cc1OC)C(=NNC(=O)Cc1csc(N3CCOCC3)n1)C(=O)N2	915954008	ISWGQNMTAMQSMK-UHFFFAOYSA-N	431.474	1.012	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NC2CCN(CC(C)C)CC2)cc1	916250628	PJANLHDGTWXLME-UHFFFAOYSA-N	439.582	1.066	50	20	IDGD	
C[C@H]1CN(c2ccc(CNC(=O)NNC(=O)[C@H](C)Oc3ccccc3F)cn2)CCO1	916392566	BOCGNZZROKHDRO-GJZGRUSLSA-N	431.468	1.744	50	20	IDGD	
O=C(NC[C@H](c1ccccc1)N1CCOCC1)NNC(=O)[C@@H]1COc2ccccc2O1	916510045	ZUPMJPTUXZIIEJ-XLIONFOSSA-N	426.473	1.230	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)c2ccc3c(c2)S(=O)(=O)N(C(C)C)C3=O)c1	916740779	AEOKIVGKRVXEFT-UHFFFAOYSA-N	445.497	1.696	50	20	IDGD	
CC(=NNC(=O)NCC(F)(F)F)c1ccc(S(=O)(=O)N(C)CCCC(=O)O)cc1	917552978	BVLPWLKGNPZRDZ-UHFFFAOYSA-N	438.428	1.757	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNS(=O)(=O)c1cccc(C(=O)NC2CC2)c1	917721467	ZOSMRQTZXWEVGD-UHFFFAOYSA-N	433.486	1.366	50	20	IDGD	
O=C(NCc1ccc(N2CCOCC2)c(F)c1)NNC(=O)[C@H]1COc2ccccc2O1	918217461	DTEMBCIPACRHLU-LJQANCHMSA-N	430.436	1.333	50	20	IDGD	
O=C(CCN1C(=O)[C@H]2CCCC[C@@H]2C1=O)NNC(=O)c1ccc(F)cc1Br	918340336	KXKMAQYITQMGIH-RYUDHWBXSA-N	440.269	1.915	50	20	IDGD	
CCCC[C@@H](NC(N)=O)C(=O)NNC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1	920884928	UCUUNBQPDBMCST-QGZVFWFLSA-N	435.488	1.922	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCCc2ccc(C)cc2C)cc1	920920742	VQJGKKGFKYYSSS-UHFFFAOYSA-N	432.546	1.805	50	20	IDGD	
COc1cc(C(=O)NNC(=O)N[C@H]2CC(=O)N(c3ccccc3)C2)cc(OC)c1OC	921077084	MVWVAWYLHGCEEC-AWEZNQCLSA-N	428.445	1.462	50	20	IDGD	
CCN(CC)C[C@H](C)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(CC)CC)c1	921121321	LXCFDQXXEFODKM-HNNXBMFYSA-N	427.571	1.391	50	20	IDGD	
COc1ccc(S(=O)(=O)CCC(=O)NNC(=O)c2cc(-c3ccccc3)on2)cc1	1115819150	KITRZQRGJBMVQU-UHFFFAOYSA-N	429.454	1.975	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1OC	1115884321	REUBHBIPGIVXRV-INIZCTEOSA-N	426.473	1.480	50	20	IDGD	
CC(=NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1)c1ccc2[nH]c(=O)c(=O)[nH]c2c1	1261207817	SFZGKGNNXQVFDP-UHFFFAOYSA-N	429.477	1.704	50	20	IDGD	
O=C(CS(=O)(=O)c1cccc(Br)c1)NNC(=O)c1n[nH]c2c1CCCC2	1317905853	GXPKJMGPVFZDAT-UHFFFAOYSA-N	441.307	1.286	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)c2cccc(N3CCNC3=O)c2)c2ccccc2c1=O	1318981336	GYWVXNUSPFJBKE-UHFFFAOYSA-N	434.456	1.582	50	20	IDGD	
CCc1cc(N2CCC(NC(=O)NNC(=O)c3cncn3-c3ccccc3)CC2)ncn1	1319068227	MTFDHWVUQJDCAY-UHFFFAOYSA-N	434.504	1.838	50	20	IDGD	
COc1cc(C(=O)NNc2cncc(Br)c2)cc(OC)c1OCC(N)=O	1320245722	HQZWAUHTWVXJSX-UHFFFAOYSA-N	425.239	1.482	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)CC1(CC(=O)N2CCOCC2)CCCC1	1321498374	ZHOXAYCXOWRMRU-UHFFFAOYSA-N	432.521	1.454	50	20	IDGD	
O=C(c1cc2cc[nH]c2cc1Cl)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1777997396	XRSPXISCVCVKPJ-QFBILLFUSA-N	426.300	1.865	50	20	IDGD	
CC[C@@H](NC(C)=O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CO[Si](C)(C)C)C1	1779538783	IABIVBQOHGCDNE-MBOZVWFJSA-N	427.618	1.267	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(Cl)Cl)C2)[C@@H]1CC[C@H]2CCC(=O)N2C1	1780613028	UBKIZFUJSSSKQK-IGMJJTELSA-N	446.375	1.705	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1ccc3ncnn3c1)C2	1780708274	RUKUSFLZWFOGMI-CSODHUTKSA-N	433.940	1.803	50	20	IDGD	
COc1cc(F)c(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](O)CCl)C3)c(F)c1	1780962110	GIDZJLUSVIDNKM-RZQQEMMASA-N	446.878	1.701	50	20	IDGD	
O=C1NCc2cc(C(=O)N3CCO[C@@]4(CCN(C(=O)[C@H](F)Br)C4)C3)ccc21	1781331310	IFVDIQQFKAUTLU-KBXCAEBGSA-N	440.269	1.064	50	20	IDGD	
CC[C@H](CC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2)NC(=O)OC(C)(C)C	1781358881	ATCZFGMDQFBGAC-SXGZJXTBSA-N	447.960	1.109	50	20	IDGD	
O=C(c1cc(F)cc([N+](=O)[O-])c1)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1781768171	CXTFPVIUHQFVGY-BBRMVZONSA-N	448.220	1.868	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@](C)(O)C(F)(F)F)C2	1782172033	LQAXKEBLXCNHJT-AVRGHOLYSA-N	430.851	1.067	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnn4c3OCCC4)C2)C1	1782273725	JVWGXKHXZPNFKL-FZKQIMNGSA-N	441.326	1.140	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCn2cncn2)C1	1782447642	RMFSHVJSYUOGHG-HDMKZQKVSA-N	442.358	1.213	50	20	IDGD	
O=C(c1cnc2c(c1)CCNCC2)N1CC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1782730376	ICKYIMKXWZSGSP-IBGZPJMESA-N	427.332	1.017	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2	1783399944	LYZMPVTTXKCZII-MSOLQXFVSA-N	438.352	1.577	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)N1CC[C@@]2(CN(C(=O)[C@H](F)Cl)CCO2)C1	1783576444	MJWXWNUTUHPYJY-TYILLQQXSA-N	433.908	1.750	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)COc3ccc(OC)cc3)CCO2)C1	1783869642	QKXRXDXNAPNSGA-FXAWDEMLSA-N	426.897	1.158	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)Cc3ccc(OC)c(F)c3)CCO2)C1	1783879867	YYRMWSGYKMYJPK-MGPUTAFESA-N	428.888	1.461	50	20	IDGD	
O=C(/C=C/c1ccc(F)cc1F)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21	1784861161	AXVLTTZUQYJJFF-FSIDXWPRSA-N	428.863	1.557	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3ON=C(c4ccccc4)O3)C[C@@H]21)[C@H](F)Cl	1787446488	MRKIANKMXWAPPZ-OSBUWBMXSA-N	425.844	1.235	50	20	IDGD	
Cn1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](O)CCl)C[C@@H]32)c(C(F)(F)F)c1	1787711111	RVFXPSOZVRLMCN-GVARAGBVSA-N	437.846	1.237	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC1(c2ccc(NC(=O)[C@H](N)c3ccccn3)cc2)CCC1	1788042509	GTWFREIPASCOGJ-OAQYLSRUSA-N	438.532	1.589	50	20	IDGD	
COc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)CBr)C[C@@H]32)nn1C	1789398990	AGRRAKYXMURWSR-OSFYFWSMSA-N	443.342	1.053	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]3C2)nn1	1789870786	VZBCVAZLCFDEQR-XBPIAWKYSA-N	431.320	1.315	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21	1790963193	OAQRZLNMTGLGJJ-HHHUOAJASA-N	444.139	1.830	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(C(F)(F)F)n3)C[C@@H]21	1791255439	QUTZCSNBWQTWJY-XPCVCDNBSA-N	449.857	1.948	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1ccc(C2(NC(=O)c3nc4ccccn4n3)CCC2)cc1	1791600240	VHIXSTOOGYDFNO-UHFFFAOYSA-N	449.515	1.850	50	20	IDGD	
C[C@@H](Cn1ccnc1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)Br)C[C@@H]21	1791630417	PBELBQSQTMTZPY-QRJUGERDSA-N	427.343	1.282	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cccc([N+](=O)[O-])c1	1792421410	HHQFWQVSKRJMNA-DPYKFYPSSA-N	440.294	1.510	50	20	IDGD	
Cc1ccn2ncc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@@H](C)CBr)c2c1	1792868083	OQJUTXIVIDTUMA-AFIMGQEJSA-N	449.349	1.877	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CNc3ccccc31)C2	1792868319	WBZAUZMBLZSHQU-BHUQQCALSA-N	436.350	1.816	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(Cl)ccn1)C2	1792871348	VWINRHFLZUPGNY-MCYUEQNJSA-N	430.730	1.969	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@](C)(Cl)CCl)C2	1792874546	QZLFVFWEKBNMBY-QKZHPOIUSA-N	430.170	1.843	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCS(=O)(=O)c1ccccc1	1795718037	GXBOGPQVJHBOOJ-DFGXFYAUSA-N	442.965	1.742	50	20	IDGD	
COc1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)c(F)c1	1796191730	SJBNNTWSGXVYCW-BJWYYQGGSA-N	426.253	1.080	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Cl)C1CC1	1796361869	WZZUAERSGJJNCQ-AUOOEQCUSA-N	447.935	1.804	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@](F)(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](O)CCl)C3)C1	1797898773	XOJMEUHLOQYVAD-YJVQVXSTSA-N	447.935	1.573	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnn(C)c1Cl	1798343127	NNWZMFGNRVIUAT-HNCHTBHHSA-N	433.734	1.308	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1[nH]nc3ccncc13)C2	1799275518	VCHNOLYDABEICZ-MSNRECKUSA-N	426.304	1.397	50	20	IDGD	
Cc1nc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Br)c(C)s1	1799344312	HPYLNJZEHBYISG-JLUCKKNBSA-N	434.331	1.583	50	20	IDGD	
CCOc1cccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Br)C3)c1O	1799755795	PJIHPWNXUKTRDH-VAECKANCSA-N	445.285	1.685	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/c1ccc([N+](=O)[O-])o1)C2	1800754645	SVURYLPTQPSWCF-GTLIUFDXSA-N	442.266	1.574	50	20	IDGD	
COc1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](O)CCl)C3)cc([N+](=O)[O-])c1OC	1800820318	RHASGLNHVDRBTC-QVHKTLOISA-N	441.868	1.464	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(OC)c(C)c(OC)c1)C2	1800983240	SICAQOSLJGRYCF-YYAJDYIMSA-N	440.924	1.469	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCCn1ccnc1	1801303830	QRKMJKMUDQMFJT-MPTYRVRUSA-N	427.343	1.284	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C=C/C(=O)NCc1ccccc1)C2	1802269054	DELJZOCCKCBNCM-PQQJDVFMSA-N	433.936	1.751	50	20	IDGD	
NC[C@H](C(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)c1ccccc1	1803138754	MKJHISWEFUXUOH-WCIQWLHISA-N	430.936	1.430	50	20	IDGD	
Cc1cnc2c(C(=O)N3CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]3c3cccnc3)cnn2c1	1803142985	QDDQRPPKSRNUGL-KBAYOESNSA-N	442.907	1.352	50	20	IDGD	
Cc1nn(C)c(C)c1CC(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]1c1cccnc1	1803145744	IADQWHDJEUGXMU-YVWKXTFCSA-N	433.940	1.280	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)Cc2ccc3c(c2)CCO3)[C@H]1c1cccnc1)[C@@H](O)CCl	1803148059	NWODBNUAJDIGLK-IPJJNNNSSA-N	443.931	1.865	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2nccnc2C(N)=O)[C@@H]1c1cccnc1	1803692317	SGXLJQXXCOKARA-RVKKMQEKSA-N	444.923	1.698	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2ccnc(F)c2)[C@@H]1c1cccnc1	1803848415	YDFNBMOCPBFENW-UWJYYQICSA-N	442.495	1.308	50	20	IDGD	
O=C(Cn1cc([N+](=O)[O-])cn1)NC[C@@H]1CCN(C(=O)C(Cl)Cl)[C@H]1c1cccnc1	1804421303	PAYOUDMFZVJDHB-WFASDCNBSA-N	441.275	1.696	50	20	IDGD	
O=C(CC1CCCC1)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1806189700	GUHTUVGHILSKHN-NFBKMPQASA-N	435.333	1.661	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H]2CC=CCC2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1	1807374072	XGUFMDRFYGLXLO-RBDMOPTHSA-N	433.317	1.437	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)[C@H](OC(C)=O)C(C)C)[C@@H]1c1cccnc1	1810108994	QLDYWFQXVUNYJX-YDZRNGNQSA-N	439.940	1.929	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC2(CCCN(C(=O)c3c[nH]c4nccc-4c3)C2)CC1	1810641407	XFRLHYULEPLXCU-UHFFFAOYSA-N	440.548	1.732	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)Cc2ccccn2)[C@@H]1c1cccnc1	1813070019	CTTINRCEPBLWDU-FDDCHVKYSA-N	438.532	1.098	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)/C=C/c2ccco2)[C@H]1c1cccnc1	1813070676	KTSPDBMNSWYMDO-JJDZSVPVSA-N	439.516	1.767	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@@H]1c1cccnc1)[C@@H]1[C@H]2COC[C@H]21	1813659496	MNXKYQHZCYFIHT-KPRKPIBOSA-N	426.286	1.670	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@H](C(=O)N2CCCC[C@H]2c2cc(NC(=O)[C@@H](O)CCl)n[nH]2)C1	1814877846	LZNWYPUISOIRKY-XRGAULLZSA-N	440.928	1.981	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(Cl)o1)CC2)c1cccc(B(O)O)c1	1815356725	NLNOWDQPUFDIIO-GFCCVEGCSA-N	445.693	1.609	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1)c1cnc(OCF)cn1	1816181461	ALJRFJJDESCYBJ-CHWSQXEVSA-N	426.836	1.411	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)Cc2ccncc2)[nH]n1)c1cccc(B(O)O)c1	1817476675	NHSSBRGJFOJUHQ-LJQANCHMSA-N	433.277	1.033	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)CCCn2cccc2)[nH]n1)c1cccc(B(O)O)c1	1817478794	BJAZNRHLRQRJLC-HXUWFJFHSA-N	449.320	1.677	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCN2CCOC2=O)n[nH]1	1818850384	TWOVKHQDQRIDAL-TZMCWYRMSA-N	427.889	1.498	50	20	IDGD	
CC(C)(C)n1cc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@@H](O)CCl)CC3)nn1	1821631018	VXDRUVHUOKFFOS-CABZTGNLSA-N	426.930	1.315	50	20	IDGD	
O=C(COc1ccc(O)nn1)Nc1cc([C@H]2CCCCN2C(=O)C(Cl)Cl)[nH]n1	1821668353	NXMOCIKEAYDBPW-SNVBAGLBSA-N	429.264	1.780	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(F)cc3)sc2C1	1822191056	MUBRZPVIIWTFPL-CQSZACIVSA-N	433.509	1.881	50	20	IDGD	
CCNC(=S)NCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)CO[Si](C)(C)C)CC2	1824502867	PFIHJDVXGRIDCS-LLVKDONJSA-N	443.671	1.391	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)C[C@H]2NC(=O)NC2=O)CC1	1825076522	ORWPULTXRBRPMU-TYILLQQXSA-N	447.363	1.441	50	20	IDGD	
COCCn1ccc(C(=O)N[C@@H]2CCc3nc(NC(=O)[C@@H](Cl)COC)sc3C2)n1	1825997849	DDVGWROIIVFEDQ-NEPJUHHUSA-N	441.941	1.466	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)C1(C(F)(F)F)CC1)CC2	1826085814	DAMYVYNBIQBOMP-SNVBAGLBSA-N	447.483	1.771	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccon2)CC1	1826147232	BQZMQISXGONQET-GOSISDBHSA-N	426.477	1.220	50	20	IDGD	
Cc1cc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)CC2)on1	1828925220	IHJGZKZLRGNLBY-SFHVURJKSA-N	440.504	1.529	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccns3)C2)C1	1830535351	MXXKNLJNMQEIOU-MLGOLLRUSA-N	432.340	1.244	50	20	IDGD	
COc1cc(Cl)cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)c1	1830738043	KWOKETCNUGAOHR-APWZRJJASA-N	447.315	1.018	50	20	IDGD	
O=C(c1cccc2c1CCCC2)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1830738279	NHDDNBFAJIHOQZ-SIKLNZKXSA-N	436.936	1.235	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCCC[C@H]1C1CCN(C(=O)C(O)O)CC1	1831223332	XNLIXMXXHGEPNE-SKTWIKFTSA-N	433.455	1.802	50	20	IDGD	
COc1cc(CCC(=O)N2CCO[C@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)ccn1	1832600483	GVALMNCDSORSJD-LJQANCHMSA-N	446.331	1.283	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3cccc(Cl)n3)CCO2)C1	1833176631	OQPNEZVSDKFOQE-KXBFYZLASA-N	430.332	1.751	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cccc(F)c3F)CC2)CC1)[C@@H](O)CCl	1833313948	VVSOZPKZGMEIHT-KRWDZBQOSA-N	429.895	1.750	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)COc3cccnn3)CC2)CC1	1833534586	GGJKENXUUYRBDQ-GOSISDBHSA-N	437.972	1.835	50	20	IDGD	
Cc1nc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)cs1	1834460347	ZZCPLAXZRZUYLD-MEDUHNTESA-N	432.340	1.305	50	20	IDGD	
C[C@@H](Nc1cnccn1)C(=O)NC1CCN(C2CCN(C(=O)[C@H](F)Cl)CC2)CC1	1835749560	VIAJLLMWPJBZOE-DYVFJYSZSA-N	426.924	1.383	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@](C)(Cl)CCl)C3)C2)ccn1	1837940474	CJTIBDOGFBHFFP-MOPGFXCFSA-N	430.332	1.696	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](Br)CC)C2)C1	1839148187	PVACYMZQOBCLDL-XEZPLFJOSA-N	425.751	1.634	50	20	IDGD	
CC(C)n1nccc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839200630	MTFPCYYXEVXOSK-PBHICJAKSA-N	447.305	1.225	50	20	IDGD	
CCC[C@H]1CC[C@H](C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)CC1	1839970555	DWOUQYKYBQWKIB-NEYJZJCJSA-N	430.973	1.649	50	20	IDGD	
CCn1nc(C)cc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2	1840032512	ASYYSUBHCPRYHT-KDOFPFPSSA-N	443.342	1.065	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1	1840034094	AEQMCKGERRIDIX-TUKIKUTGSA-N	446.169	1.463	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)cc1O	1840034231	FOXMGEWBCOIXHN-AUUYWEPGSA-N	441.322	1.554	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccnc(Cl)c3)C2)C1	1840150843	RSCSIONXXRNTRW-KBXCAEBGSA-N	432.304	1.059	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4cc[nH]c4c3)C2)C1	1840152381	GWQDOZUVQLJYOF-UTKZUKDTSA-N	435.908	1.492	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3c(F)cccc3F)C2)C1	1840153898	FGYNYHJQCNKGGY-MGPUTAFESA-N	446.878	1.218	50	20	IDGD	
C[C@H](C(=O)N1CCOC[C@@]2(CN(C(=O)C(Cl)Cl)CCO2)C1)n1cccc1C=O	1840188015	JZWYQPVQDSITFB-ACJLOTCBSA-N	432.304	1.122	50	20	IDGD	
COc1ccc(F)cc1CC(=O)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1840252585	YRTLTVHVJHQGNR-LJQANCHMSA-N	449.306	1.637	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)c2csc(Br)n2)C1	1843569432	HSRPCSJFABOVKC-UHFFFAOYSA-N	444.355	1.096	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC2(CCCN2C(=O)c2cc(O)no2)C1	1844515565	MMINIYNKCAMDRU-NSHDSACASA-N	428.873	1.329	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)[C@@H](C)n1cncn1)C2	1844693337	TYFHZCTVTKZLTF-CYBMUJFWSA-N	442.432	1.190	50	20	IDGD	
CS(=O)(=O)c1ccc(CC(=O)N2CC3(CCCN3C(=O)[C@H](F)Br)C2)cc1	1845217285	QCEGVLSOUVXMHD-HNNXBMFYSA-N	447.326	1.527	50	20	IDGD	
Cc1nn2cc(CC(=O)N3CC4(CCCN4C(=O)[C@@H](C)Br)C3)nc2s1	1846175492	BUEFGUZPTXOLNV-SNVBAGLBSA-N	426.340	1.629	50	20	IDGD	
O=C(Cc1cc(Br)ccc1O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl	1847565454	RRLBNTZUAQFPDS-YDHLFZDLSA-N	431.714	1.499	50	20	IDGD	
Cc1cccc(N2CCN(C(=O)NNC(=O)c3csc(N4CCOCC4)n3)CC2)c1C	9755790	XSYQZLBEIJDUNO-UHFFFAOYSA-N	444.561	1.773	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c(C)c1	15524848	KPHUFYGQVSKSMM-UHFFFAOYSA-N	447.513	1.164	50	20	IDGD	
O=C1NC(=O)c2ccccc2/C1=C/NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	16719945	YDQKKAHVKDIVGS-AQTBWJFISA-N	440.481	1.017	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2C1)c1ccc(S(=O)(=O)N2CCCC2)cc1	17516937	SSRPOABFWIPELN-QGZVFWFLSA-N	429.498	1.483	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)c1ccc(CCNS(C)(=O)=O)s1	21027975	AKIMHSICNPGPDM-UHFFFAOYSA-N	431.923	1.577	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)[C@H]1CC(=O)N(Cc2ccc(OC)cc2)C1	726619755	COWKMVLQQIBEME-SFHVURJKSA-N	425.485	1.833	50	20	IDGD	
C[C@H](Oc1ccccc1Cc1ccccc1)C(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1	728188826	PQRQSRYDLPKKEA-MAUKXSAKSA-N	431.514	1.562	50	20	IDGD	
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC[C@@H](C(=O)NNc2nc(-c3ccccc3)no2)C1	728216600	CKDFTUMVSIZHSV-OAHLLOKOSA-N	445.505	1.621	50	20	IDGD	
CC(=O)N(c1ccc(C)c(C)c1)c1nc(C=NNC(=O)[C@@H](C)NS(C)(=O)=O)cs1	728437379	RCGHHCGJAPSSCR-CYBMUJFWSA-N	437.547	1.832	50	20	IDGD	
CCS(=O)(=O)N(C)CCCNC(=O)NNC(=O)c1cc(F)ccc1Br	728745435	XHDCOJLMKWSOEK-UHFFFAOYSA-N	439.307	1.204	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)N2CCN(S(=O)(=O)Cc3ccccc3)CC2)c1	728954962	VHLHIQRZNMMWSS-UHFFFAOYSA-N	427.486	1.060	50	20	IDGD	
CS(=O)(=O)Nc1cc(C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)ccc1F	728972307	RFKHNZRLQHKZLN-UHFFFAOYSA-N	437.421	1.950	50	20	IDGD	
CC[C@@H](NC(=O)NNC(=O)Cc1c[nH]c2ccccc12)c1cccc(S(N)(=O)=O)c1	729612668	HFHZMXQFJDRHED-QGZVFWFLSA-N	429.502	1.840	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(CCNC(=O)NNC(=O)CC(F)(F)F)s1	729613745	HDALEIWDVIOHBI-UHFFFAOYSA-N	430.474	1.604	50	20	IDGD	
N#CCCN(C(=O)CCC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)c1ccccc1	729629592	OOUUKLUTZQTVCT-UHFFFAOYSA-N	432.444	1.150	50	20	IDGD	
Cc1ncsc1C(=O)NNC(=O)c1cccc(C(=O)NNC(=O)c2scnc2C)c1	729661722	KQGCDOLHNYNHBS-UHFFFAOYSA-N	444.498	1.366	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)c2cn(-c3ccc(C(F)(F)F)cn3)nn2)cn1	729691503	BDWQODCNHQBQME-UHFFFAOYSA-N	438.395	1.716	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N[C@H](C)CN1CCN(C)CC1	730130845	NMWRXLVXTKTPNR-KGLIPLIRSA-N	442.358	1.183	50	20	IDGD	
COC(=O)c1ccc(S(=O)(=O)NNC(=O)c2nc(Cl)c(Cl)c(N)c2Cl)o1	730766091	VFDWTHXQOQMQBR-UHFFFAOYSA-N	443.652	1.627	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)c1nnn(-c2ccc(F)cc2)c1C(F)(F)F	730778968	QQCSSODCGWMROQ-UHFFFAOYSA-N	439.325	1.971	50	20	IDGD	
CCN(C1CCN(C(=O)NNC(=O)c2cc3c(s2)CC[C@H](C)C3)CC1)S(C)(=O)=O	731358047	AVEVBWWVQKANJX-ZDUSSCGKSA-N	442.607	1.973	50	20	IDGD	
Cc1ccccc1-n1c(C)cc(/C=C(/C#N)C(=O)NCC(=O)NCCN2CCOCC2)c1C	732155335	AMKBIBYETALVBK-JCMHNJIXSA-N	449.555	1.874	50	20	IDGD	
CC(C)(C)OC(=O)NCc1nc(C(=O)NNC(=O)CNC(=O)c2cccs2)cs1	732736237	XCBJXHAFCHZVCH-UHFFFAOYSA-N	439.519	1.420	50	20	IDGD	
COCCOCC(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2Cl)c1	733123685	ZUDXCFPDANRUFW-UHFFFAOYSA-N	441.893	1.565	50	20	IDGD	
Cn1c(NNC(=O)c2cccc(S(=O)(=O)NCC3CC3)c2)nc2ccccc2c1=O	733263139	JUKZVNSHUXGXIF-UHFFFAOYSA-N	427.486	1.379	50	20	IDGD	
Cc1nn(CCCl)c(C)c1C(=O)Nc1cccc(S(=O)(=O)N2CCNC(=O)C2)c1	733888451	BZGRBLMYYAMBIK-UHFFFAOYSA-N	439.925	1.112	50	20	IDGD	
CCCCN1C(=O)c2ccc(C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)cc2C1=O	734240241	LQWZKMCQLMRVFP-UHFFFAOYSA-N	447.492	1.551	50	20	IDGD	
COc1ccc(CN2CC[C@H](NC(=O)NNC(=O)c3cc4c(s3)CCC4)C2=O)cc1	734545280	WFYCOFJJIUCUIP-INIZCTEOSA-N	428.514	1.991	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2cc(O)nc3cc(F)ccc23)ccc1Cl	739679870	FJAXMYZAMZBFAS-UHFFFAOYSA-N	438.824	1.455	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)N2CCC(C(=O)NNc3ncnc4[nH]cnc34)CC2)cc1	740746409	AMNZCEYOIGAZJL-UHFFFAOYSA-N	443.489	1.100	50	20	IDGD	
COC(=O)c1ccc(COc2ccccc2C=NNC(=O)Cc2cc(O)nc(O)n2)cc1	743448058	WNOWULUWLDLNAK-UHFFFAOYSA-N	436.424	1.946	50	20	IDGD	
CN(C)C1(CNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)Cc2ccccc2C1	743589186	PZQKVZIGGNMWNZ-UHFFFAOYSA-N	437.548	1.123	50	20	IDGD	
NS(=O)(=O)c1ccc(CCC(=O)NNC(=O)Nc2ccc(OC(F)F)cc2)cc1	743831665	DKNQYJAURPASGS-UHFFFAOYSA-N	428.417	1.721	50	20	IDGD	
NC(=O)N[C@@H](CC(=O)NNC(=O)[C@H]1COCCO1)c1cccc(Oc2ccccc2)c1	744645641	AKFIEUAEGGTDDN-ZWKOTPCHSA-N	428.445	1.141	50	20	IDGD	
COc1ccc(CN2CC[C@H](NC(=O)NNC(=O)c3cc([N+](=O)[O-])ccc3O)C2=O)cc1	745829429	ZRHKOGWOCPBCCF-INIZCTEOSA-N	443.416	1.054	50	20	IDGD	
CC[C@@H](Nc1c([N+](=O)[O-])c(C)nn1C)C(=O)NNC(=O)c1cc(-c2ccccc2)on1	746108346	PJDBTNIFFCQLSE-CYBMUJFWSA-N	427.421	1.943	50	20	IDGD	
O=C(CN[C@H](c1ccccc1)C(F)(F)F)NNC(=O)C1CCN(c2ncccn2)CC1	746218411	HKMQZLOAZDHXSB-QGZVFWFLSA-N	436.438	1.734	50	20	IDGD	
O=C(CC[S@](=O)c1ccc2c(c1)OCCO2)NNC(=O)Cn1ccc2ccccc21	746224642	QAVVFHLNCZAQRT-PMERELPUSA-N	427.482	1.758	50	20	IDGD	
COc1cc(C)nc(NNC(=O)C2CCN(S(=O)(=O)c3ccc(C)c(C)c3)CC2)n1	746626089	UWICHVUCAJVYEJ-UHFFFAOYSA-N	433.534	1.954	50	20	IDGD	
CCN=c1nc(NCC)n2c(SCC(=O)NNc3cc(F)c(F)c(F)c3)n[nH]c2n1	746703941	OWBSHJHGCQJGRG-UHFFFAOYSA-N	441.443	1.458	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1ccc(C(N)=O)cc1)C(=O)NNc1ccc(C(F)(F)F)cc1	747604870	ILVHLUFFAGHUOQ-SNVBAGLBSA-N	430.408	1.614	50	20	IDGD	
Cn1ccnc(NNC(=O)c2cccc(S(=O)(=O)N3CCCc4ccccc43)c2)c1=O	747942280	RPGYKGRYMZSCOO-UHFFFAOYSA-N	439.497	1.679	50	20	IDGD	
Cn1nc(SCC(=O)NN=C2CCOc3c(Cl)ccc(Cl)c32)c(=O)n(C)c1=O	748583551	ZUZNDMRPOKWGNR-UHFFFAOYSA-N	444.300	1.181	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)Cn2nc(Br)nc2Br)c1	748628328	WVQTYTFIADWVOC-UHFFFAOYSA-N	428.044	1.136	50	20	IDGD	
O=C(CCc1ccccc1)NNC(=O)C1CCN(C2=NS(=O)(=O)c3ccccc32)CC1	749803699	HSJGVMAINVGRLF-UHFFFAOYSA-N	440.525	1.628	50	20	IDGD	
C[C@H](NC(=O)CC1CCCCC1)C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	749838494	PICVAGCQZAXWOO-IBGZPJMESA-N	443.592	1.821	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCC(C)(C)c2ccccc2F)c1	750336526	FRMRHVYFVAVPAP-UHFFFAOYSA-N	436.509	1.998	50	20	IDGD	
CCCCN1C(=O)CC[C@@H](C(=O)NNC(=O)C(=O)NC2CC2)[C@@H]1c1ccccc1OC	750873362	NXXZUDNAKREQRC-APWZRJJASA-N	430.505	1.201	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2ccc(OC)c(Br)c2)oc1C	751142670	JXGHONPAORNSHL-UHFFFAOYSA-N	447.263	1.769	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)Cc2ccc(OCc3ccccn3)cc2)c2ccccc2c1=O	751547126	JDAYLMOPNXWQNF-UHFFFAOYSA-N	443.463	1.911	50	20	IDGD	
CCOC(=O)[C@H]1Cc2cc(S(=O)(=O)NNC(=O)CCCc3ccccc3)ccc2O1	751547884	MKKAXBXRMZQZQG-LJQANCHMSA-N	432.498	1.886	50	20	IDGD	
COc1cc(N2C[C@@H](C(=O)NNC(=S)N[C@H](C)C3CC3)CC2=O)cc(OC)c1OC	751619192	LIIYNHHENBBHPL-YPMHNXCESA-N	436.534	1.359	50	20	IDGD	
C[C@@H](NC(=S)NNC(=O)CCNS(=O)(=O)c1cccc(Br)c1)C1CC1	751620686	LIKRMOFHFXRWKY-SNVBAGLBSA-N	449.396	1.411	50	20	IDGD	
Cn1cc(S(=O)(=O)N2CCOCC2)cc1C(=O)NNc1ccc(-c2ccccc2)nn1	754472696	ZLQPXTMCEDVADI-UHFFFAOYSA-N	442.501	1.260	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)Nc2cc(C)nn2[C@@H]2CCS(=O)(=O)C2)c1	755538088	ZMSFPTLDVARYIO-OAHLLOKOSA-N	435.506	1.400	50	20	IDGD	
Cc1oc(C(=O)NNC(=S)Nc2cccc(Br)c2)cc1S(N)(=O)=O	755627446	VIHOMYYDLHJUCL-UHFFFAOYSA-N	433.309	1.629	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)Nc1ccc(CC(=O)N2CCOCC2)cc1	755861235	CMWMQCIBSSSLCA-UHFFFAOYSA-N	427.417	1.463	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)Nc1ccc(-n2nccn2)nc1	755948373	YTRCWKOCXIZVMT-UHFFFAOYSA-N	432.238	1.657	50	20	IDGD	
O=C(Cc1cccc2ccccc12)NNC(=O)NCCN1C(=O)[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O	756096397	PSFKQFQSYMZIIC-IDPBPBMLSA-N	432.480	1.520	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)N[C@H]2CCN(c3ncccc3F)C2)cc1	756156516	SLQAOBCUFHCUNW-GJZGRUSLSA-N	431.468	1.996	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)Nc2cccc(OCCS(C)(=O)=O)c2)cc1	756297522	KBXCMMTYZZFDEF-UHFFFAOYSA-N	437.474	1.350	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)Nc2cccc(C(=O)NCCC(N)=O)c2)cc1	756392128	LWLPZRPEOIQDRE-UHFFFAOYSA-N	427.461	1.086	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)Nc2ccc(CNS(C)(=O)=O)cc2)cc1	756627981	JYCWJMBYIRCPJX-AWEZNQCLSA-N	448.501	1.559	50	20	IDGD	
COc1ccccc1N1CC[C@H](NC(=O)NNC(=O)[C@H](C)Oc2ccccc2F)C1=O	757284071	BYKPCUKQZXYTSC-ZFWWWQNUSA-N	430.436	1.738	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNc2ccc(C(N)=O)nn2)c1	757408574	VSCSTIIAUUMJLB-UHFFFAOYSA-N	442.457	1.142	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)c2cccc(I)c2O)C[C@@H](C)O1	757714224	BGJOXPZFCYTPOW-GHMZBOCLSA-N	447.273	1.257	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1cccnc1OCC(F)F	760263685	QOJQZFIEPFLBHX-UHFFFAOYSA-N	427.433	1.402	50	20	IDGD	
O=C(NNc1ncc(F)cn1)c1cccc(S(=O)(=O)NCc2ccc3c(c2)OCO3)c1	760914745	URXCNFAAENZUCX-UHFFFAOYSA-N	445.432	1.580	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@H](C)c2c(F)cccc2F)cc1	763462238	IQMKQFLVVJUEKD-CYBMUJFWSA-N	425.457	1.845	50	20	IDGD	
COC(=O)c1c(NC(=O)C(=O)NNC(=O)c2ccccc2O)sc2c1CCCCC2	763530202	SUPSAZPLSAWOKZ-UHFFFAOYSA-N	431.470	1.909	50	20	IDGD	
C[C@@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3ccccc3F)cc2F)C[C@@H](C)O1	763568242	HPGRYIFRLACUQI-CHWSQXEVSA-N	432.427	1.978	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(S(C)(=O)=O)cc2C)c2ccccc2n1	763615772	PZRRINMKNMOFOJ-UHFFFAOYSA-N	440.481	1.655	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(OCCN(C)C)cc2)c2ccccc2n1	763615976	JPIRUMVJUHKVEU-UHFFFAOYSA-N	435.484	1.883	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2ccc(-n3cncn3)c(Cl)c2)c1	763651223	XVAAOAIMVMXVJF-UHFFFAOYSA-N	442.863	1.702	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2csc(-c3ccccn3)n2)cc1C	763666110	AZHLIKPTYKTPAH-UHFFFAOYSA-N	425.470	1.987	50	20	IDGD	
Cc1cc(C)n(-c2cccc(NC(=O)C(=O)NNC(=O)COc3ccc(C#N)cc3)c2)n1	763673518	FWTRNKPAUWJKFV-UHFFFAOYSA-N	432.440	1.526	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)C(=O)Nc1cc(N2CCNC2=O)ccc1Cl	763680405	HRKHKTCWQJUTMC-UHFFFAOYSA-N	449.826	1.174	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc2c(c1)C[C@@H](OC)C2	763681577	LXMKGVILWOPYBE-KRWDZBQOSA-N	427.457	1.364	50	20	IDGD	
O=C(CSc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1ccnn1-c1ccncc1	763737429	YOQWLTBFTJAKEG-UHFFFAOYSA-N	430.877	1.799	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)C(=O)Nc1cc(F)ccc1OC(F)F	763803938	PGKIUYCKAWCQAG-UHFFFAOYSA-N	442.306	1.500	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cnn(-c3ccccc3)c2)cc1	763861854	RGDGYJPUMVXXEJ-HNNXBMFYSA-N	437.456	1.824	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccc(C(F)(F)C(F)(F)F)cc2)n1	763890582	CDXBXAVATRRASM-UHFFFAOYSA-N	433.337	1.940	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccc(-c3cn4ccccc4n3)cc2)n1	763892627	GBWPXNOFZFLERC-UHFFFAOYSA-N	431.456	1.601	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)C(=O)Nc1ccccc1-n1cc(Br)cn1	763993443	QFQCDVOBGPMAGU-UHFFFAOYSA-N	431.250	1.373	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1ccc(CN2CCCC2=O)cc1	764013227	VZTIYFRUNQFACM-UHFFFAOYSA-N	444.875	1.871	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)on1)C(=O)Nc1cncc(Br)c1	764016120	HHGRZIWOOGBEJO-UHFFFAOYSA-N	430.218	1.899	50	20	IDGD	
CCc1ncc(NC(=O)C(=O)NNC(=O)c2ccc(Br)cc2Cl)cn1	764057668	GXLBECSLTBGVMN-UHFFFAOYSA-N	426.658	1.855	50	20	IDGD	
CN(C)CCOc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(Br)c2)cc1	764063297	NJBQLNWQCUTDLT-UHFFFAOYSA-N	449.305	1.789	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)nc1)C(=O)N1CCc2cc(Br)cc(F)c21	764092868	OZUYFJDVSMKEKR-UHFFFAOYSA-N	441.644	1.987	50	20	IDGD	
CCCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(C)cc3)[nH]n2)cc1	764109618	ADWYJFZBESWXCE-UHFFFAOYSA-N	448.483	1.925	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)CC(F)(F)F)cc1OCc1ccncc1	764111918	IDRWGAPTPWODHE-UHFFFAOYSA-N	426.351	1.708	50	20	IDGD	
COc1c(Br)cc(Cl)cc1NC(=O)C(=O)NNC(=O)Cc1cc[nH]n1	764297724	WOZODJQKFPTPHR-UHFFFAOYSA-N	430.646	1.163	50	20	IDGD	
CN(CC(=O)NNc1c(F)cc(C(=O)NC2CC2)cc1F)S(=O)(=O)c1cccnc1	764333607	KRZISPZXBHALIN-UHFFFAOYSA-N	439.444	1.016	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)c1ccc(F)cc1I	764343145	LQXDNFBEUIMMDB-UHFFFAOYSA-N	442.188	1.016	50	20	IDGD	
CN(C)c1c(Cl)cccc1NC(=O)C(=O)NNC(=O)c1cnn(-c2ccccc2)c1	764350908	MTCUUEOSWHVADS-UHFFFAOYSA-N	426.864	1.991	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2ncccc2C)cc1OCC(F)(F)F	764386479	YDFUTSDEZCQWCW-UHFFFAOYSA-N	426.351	1.739	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1)C(=O)Nc1ccc(-n2cccn2)cc1	764387912	ODJJKKPBTMNOCL-UHFFFAOYSA-N	433.403	1.801	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNc2ccnc(F)c2)cc(Br)c1F	764673703	RIYZNUFYJLVTKH-UHFFFAOYSA-N	429.177	1.991	50	20	IDGD	
Cn1c(=O)c2c(ncn2CC(=O)NN=Cc2c(Cl)ccc(Cl)c2Cl)n(C)c1=O	764812469	LUFJHYCFSUUYPE-UHFFFAOYSA-N	443.678	1.544	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NN=Cc3sc(C)nc3C)CC2)cc1	764816618	MERRXQWNTDOWHI-UHFFFAOYSA-N	435.575	1.525	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)NCc2cccc(N3CCCS3(=O)=O)c2)cc1	765305106	XGEPMUWSGGTRPB-UHFFFAOYSA-N	446.529	1.698	50	20	IDGD	
CCOc1ccc2cc(C(=O)NNC(=O)CN3CCN(C(=O)c4ccccc4)CC3)[nH]c2c1	765739197	QUCOHDUVCWMVIO-UHFFFAOYSA-N	449.511	1.786	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)Cc2cccc3ccccc23)n(-c2ncccn2)n1	768239702	NLVBWIDRBXZTGG-UHFFFAOYSA-N	429.440	1.453	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)NC3CCN(Cc4ccc(F)c(F)c4)CC3)nc21	770349761	MDBFQNTWKXIEHI-UHFFFAOYSA-N	432.435	1.638	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)NCc3ccc(NC(=O)c4cccnc4)cc3)nc21	770365270	BUYJOWASAWNKBZ-UHFFFAOYSA-N	433.432	1.543	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)N1CCC[C@H](CNS(C)(=O)=O)C1	770658844	PWWPQQSIAGKQGV-QWHCGFSZSA-N	432.930	1.109	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)Cc3csc(N4CCCC4=O)n3)nc21	770959775	YZGARVOYQGESGI-UHFFFAOYSA-N	430.494	1.556	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1ccc(C(N)=O)cc1)C(=O)NNc1ccc(-c2ccccc2)nn1	771027431	DVIQRCIVYNAMEW-CYBMUJFWSA-N	440.485	1.053	50	20	IDGD	
C[C@@H](CO)NC(=O)/C(C#N)=C/c1cn(CCC(N)=O)nc1-c1cccc(Br)c1	771779429	YEDMXSYAZIIBPW-FUEWVNAISA-N	446.305	1.592	50	20	IDGD	
Cc1cc(=O)c(C(=O)O[C@H](C)C(=O)NNC(=O)CC(C)C)nn1-c1ccccc1[N+](=O)[O-]	771900488	BOICXJBTDMJEKY-CYBMUJFWSA-N	445.432	1.188	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)[C@H]1CCCN1S(=O)(=O)c1cccs1	772064696	NGSMPQWFJPIYID-QWHCGFSZSA-N	431.536	1.026	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)c1cc(Br)ccc1Br	772693833	MJQNPLHLMWFJOC-UHFFFAOYSA-N	445.067	1.996	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)ncc1Br	773520577	PGNSHQAPFGIBDG-ZDUSSCGKSA-N	435.234	1.078	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2cccc(Cl)c2C)n([C@@H]2CCS(=O)(=O)C2)n1	773768037	JMSLYTNAIGOLMA-GFCCVEGCSA-N	425.898	1.595	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)CN2CCN(c3nnc(C(F)(F)F)s3)CC2)cc1	776862509	VYPNEADLQWBOFV-UHFFFAOYSA-N	439.423	1.012	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)NCc1ccc(S(=O)(=O)CC)cc1	777748989	OUNHLNYFYQMKFP-UHFFFAOYSA-N	435.502	1.788	50	20	IDGD	
Cc1nc(-c2ccc(F)c(F)c2)sc1C(=O)NNC(=O)CNC(=O)c1cccnc1	777995538	XUDROGCMPOOTMH-UHFFFAOYSA-N	431.424	1.983	50	20	IDGD	
COC[C@H](C)n1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C(C)(C)C)cc2)n1	778706496	SPMQUGZUUXXCTO-AWEZNQCLSA-N	431.493	1.553	50	20	IDGD	
O=C(NNC(=O)[C@@H](O)[C@@H](O)c1nc2ccccc2s1)c1cc(-c2cccs2)[nH]n1	779539425	DBNIMIVELRKKFJ-LSDHHAIUSA-N	429.483	1.603	50	20	IDGD	
CCNC(=O)CC(=O)NNC(=O)c1ccc(CN(C)S(=O)(=O)c2ccc(C)cc2)cc1	780848274	LDFXRUJJBOTCSU-UHFFFAOYSA-N	446.529	1.103	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccc(S(=O)(=O)C(C)C)cc2)cc1C	781436804	MSOJVNOHIWJODN-UHFFFAOYSA-N	431.514	1.814	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N2CC(C(C)(C)O)C2)cc1	781867619	RQJQQZOKBDYCLA-YBEGLDIGSA-N	437.500	1.570	50	20	IDGD	
CCSc1cccc(NC(=O)C(=O)NNC(=O)c2csc(N3CCOCC3)n2)c1	782898055	YCHVTEJTOHQWLI-UHFFFAOYSA-N	435.531	1.491	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)(F)F)cc1)C(=O)Nc1cccc2c1OCCO2	783407381	BCWIQWHQPJUOPT-UHFFFAOYSA-N	445.375	1.833	50	20	IDGD	
CN(Cc1ccccc1NC(=O)C(=O)NN[C@@]1(C)CCS(=O)(=O)C1)C1CCCCC1	783427229	NKRWFCVSOIQIQG-NRFANRHFSA-N	436.578	1.588	50	20	IDGD	
COc1ccc(Cn2nccc2NC(=O)C(=O)NNc2cccc([N+](=O)[O-])c2)c(OC)c1	784834179	YDKJKJMCVVKZGV-UHFFFAOYSA-N	440.416	1.939	50	20	IDGD	
Cc1ccc(C(=O)NCC2CC2)cc1NC(=O)C(=O)NNC(=O)Cn1ccc2ccccc21	785990505	HUISYBZWJGDOJW-UHFFFAOYSA-N	447.495	1.876	50	20	IDGD	
CN1CCC(n2ccc(NC(=O)C(=O)NNC(=O)C34CC5CC(CC(C5)C3)C4)n2)CC1	787541198	NQWNSTNEALSZFQ-UHFFFAOYSA-N	428.537	1.452	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)Cn2c(CS(C)(=O)=O)nc3ccccc32)c1	789590524	TVWVLYDKYNCWAL-UHFFFAOYSA-N	446.485	1.059	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2cc(C#N)cn2C(C)(C)C)c2ccccc2c1=O	789733280	XPBPXJJZWVTMIK-UHFFFAOYSA-N	449.471	1.244	50	20	IDGD	
CC(C)(C)n1cc(C#N)cc1NC(=O)C(=O)NNC(=O)COc1ccccc1[N+](=O)[O-]	789733287	XYEVWWWQAYEHJL-UHFFFAOYSA-N	428.405	1.188	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(OC(F)F)c(F)c1)c1ccc(-n2cnnn2)cc1	790342877	XNFKBLAYAAYGBF-UHFFFAOYSA-N	428.352	1.026	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cccc(OC)c2O)cc(Cl)c1F	792267685	JDAKUCMMTKHUKL-UHFFFAOYSA-N	439.783	1.380	50	20	IDGD	
CC[C@@H](C)n1ncc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(C(C)=O)cc2)c1C	792267840	DITFWZVZURHZOH-IUODEOHRSA-N	429.477	1.919	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(Cc3nnc4n3CCC4)cc2)c1	792268740	PZBAFGMHVVSHNJ-UHFFFAOYSA-N	447.499	1.281	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)NCc2ccc(C(=O)N3C[C@H](C)O[C@H](C)C3)cc2)n1	792919493	JKFXOTPWDBMDKM-IYBDPMFKSA-N	425.489	1.784	50	20	IDGD	
CCc1nnc(O)c(CNC(=O)NNC(=O)CNC(=O)OCc2ccccc2)c1CC	793121406	YBNWSIFRNFQSAR-UHFFFAOYSA-N	430.465	1.064	50	20	IDGD	
Cn1cc(-c2cc(F)ccc2NC(=O)C(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)cn1	797103802	NZSXRBIKTNLBNJ-UHFFFAOYSA-N	442.363	1.240	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)CNC(=O)OCc2ccccc2)ccc1NC(C)=O	797614529	KLEXZIARICCYIG-UHFFFAOYSA-N	429.433	1.733	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCC(=O)NNC(=S)NC(C)(C)C)cc1OCC	798149293	JYNWKCVNXIZONA-UHFFFAOYSA-N	432.568	1.056	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C1=NO[C@H](CNC(=O)OC(C)(C)C)C1	798992536	JLGIWLVBGLTETB-NSHDSACASA-N	442.494	1.211	50	20	IDGD	
CSC[C@@H](C)C(=O)N1CCC(C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)CC1	799337806	QRAKXRRZJPWSJR-OAHLLOKOSA-N	429.546	1.871	50	20	IDGD	
COc1c(C)cc(C)cc1S(=O)(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	800830567	BKDBHAZABJYQJZ-UHFFFAOYSA-N	447.922	1.236	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)[C@H](NS(C)(=O)=O)C(C)(C)C)c(OC)cc1Cl	802084777	JKYTXIKAZHJJJX-ZDUSSCGKSA-N	436.918	1.474	50	20	IDGD	
COc1ccc(CN2CC[C@@H](NC(=O)NNC(=O)CCc3ccccc3)C2=O)c(OC)c1	806028784	MIOXHLYLVQQYKE-LJQANCHMSA-N	440.500	1.768	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1cccc(NC(=O)NNc2ccc(-n3ccnc3)nn2)c1	806166952	ZVRNSEKGXUDZFU-UHFFFAOYSA-N	430.494	1.888	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)[C@@]1(F)CCN(C(=O)OCc2ccccc2)C1	807370457	JFQXTKIEHXTACL-HXUWFJFHSA-N	425.457	1.674	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cnc(C(F)(F)F)cc2C)cc1	810385452	STNZVTWLRTWRTJ-UHFFFAOYSA-N	426.351	1.582	50	20	IDGD	
Cc1nc(COc2cccc(C(=O)NNc3ccc(S(=O)(=O)N(C)C)cc3)c2)no1	812733203	JPMCZSSWXAYONV-UHFFFAOYSA-N	431.474	1.964	50	20	IDGD	
C[C@@H](NCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)c1ccc(N2CCCNC2=O)cc1	812900401	ZMXMZDQJMFIBJT-CQSZACIVSA-N	440.460	1.626	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)[C@@H]3CC4CCC3CC4)CC2)cc1	814316853	JIKJYXVBJYUPIG-AFMYVXGZSA-N	448.589	1.275	50	20	IDGD	
O=C(NNC(=O)C1(Cc2ccc(F)cc2Br)CCOCC1)C(=O)NC1CC1	814379142	JRLAGFCIZFQGQK-UHFFFAOYSA-N	442.285	1.354	50	20	IDGD	
COC(=O)c1cnn(C)c1NC(=O)C(=O)NNc1ccc(Br)cc1Cl	815558340	ABSBOSYFNQVFQW-UHFFFAOYSA-N	430.646	1.704	50	20	IDGD	
CCOC(=O)c1cc(COC)cc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)c1	815564346	GJSAJRBCWSORHB-UHFFFAOYSA-N	443.412	1.138	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNc2ccc(-n3cccn3)nn2)cc1)[C@@H]1C[C@H]1C	815589718	BLBFYEVHIQZFNQ-CXAGYDPISA-N	434.460	1.505	50	20	IDGD	
C[C@](O)(C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1)c1ccc(Cl)cc1	815734479	ISBZIZDJBBBIDD-LJQANCHMSA-N	439.921	1.712	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)c2cc(S(=O)(=O)NC(C)(C)C)ccc2C)c1	825781544	DSEOZAANHJIHLJ-UHFFFAOYSA-N	448.545	1.954	50	20	IDGD	
Cc1cccc(N2CCN(CCCCNC(=O)NNC(=O)Cn3nc(C)cc3C)CC2)c1	916513544	BPRWFDZNOUXUOR-UHFFFAOYSA-N	441.580	1.741	50	20	IDGD	
Cc1ccc(NCCCNC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)nc1	916521385	DQOGKOSTSUHVMS-UHFFFAOYSA-N	433.538	1.438	50	20	IDGD	
COc1cc(CNC(=O)NNC(=O)c2cc(C)nc3ccccc23)ccc1OCC(N)=O	916641110	XUDNUFHDHPSTIQ-UHFFFAOYSA-N	437.456	1.560	50	20	IDGD	
O=C(COc1ccccc1-c1ccccc1)NNC(=O)c1cnc2nc(O)nc(O)c2c1	916720620	XRLIDWGRZKNSFR-UHFFFAOYSA-N	431.408	1.943	50	20	IDGD	
O=C(COC(=O)CCc1nc2ccccc2o1)NNC(=O)[C@H]1COc2ccccc2O1	917235545	RVXNUCFVIJZAMA-QGZVFWFLSA-N	425.397	1.291	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NC[C@@H](C)CN2CCCCC2)cc1	918104088	ITFJEYNTCGMDBQ-QGZVFWFLSA-N	439.582	1.068	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)CN(C)c1nc2ccccc2s1	919745127	WEVNYSAKUXZZSF-UHFFFAOYSA-N	446.558	1.795	50	20	IDGD	
O=C(NCc1ccc(F)cc1Br)NNC(=O)c1ccc(-n2cnnn2)cc1	919786042	DYWXZZXVZRCORQ-UHFFFAOYSA-N	434.229	1.708	50	20	IDGD	
Cc1nnc(NNC(=O)CCCOc2ccc(I)cc2)nc1O	919810441	VMWWWJKMCTWXJO-UHFFFAOYSA-N	429.218	1.793	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)[C@H]1CC(=O)N(c2ccc(F)c([N+](=O)[O-])c2)C1	920008319	RQLKAJUHCJKPQN-ZDUSSCGKSA-N	430.392	1.486	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)N[C@H]1CCCN(S(C)(=O)=O)C1	920239914	IGKVMGCNDANUKN-YOEHRIQHSA-N	434.518	1.362	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CSc1nnc(N2CCOCC2)s1	920307396	BIMJGMZUTRNYRC-UHFFFAOYSA-N	443.938	1.590	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)[C@H]1COc2ccccc2O1)c1ccc(N2CCOC2=O)cc1	920972475	WHIZYFPTECGLMY-FZKQIMNGSA-N	426.429	1.875	50	20	IDGD	
CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	921295603	PSIATTQVECBQAG-UHFFFAOYSA-N	427.460	1.184	50	20	IDGD	
Cc1ccc(C(=O)NCC(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)s1	1320731626	RPKKNEQIZPKGAW-UHFFFAOYSA-N	439.538	1.422	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)CC1(CC(=O)N2CCOCC2)CCCC1	1322109326	FANUOIQJOXHCDF-UHFFFAOYSA-N	431.533	1.975	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)NCCNC(=O)c2cccs2)CC1	1323395909	GMBNGGRVFMDDTO-UHFFFAOYSA-N	439.538	1.455	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccnn2CCOC)C1	1778234616	PSZYQBCFLUZLIE-WRWLIDTKSA-N	426.945	1.674	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccnn2CCOC)C1	1778234618	PSZYQBCFLUZLIE-XAUMDUMWSA-N	426.945	1.674	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1nc[nH]c1[N+](=O)[O-])C2	1779544145	ZLCYGMIKNKIZJL-FZKQIMNGSA-N	439.545	1.297	50	20	IDGD	
CCc1[nH]nc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](F)Br)C2)c1F	1780770912	JLYUVLQJSGJAHK-JDSLSITLSA-N	449.296	1.929	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCCn1ccnc1)C2)[C@@H](F)Br	1780777500	TYTUJUQWOVZSOH-QGPMSJSTSA-N	445.333	1.868	50	20	IDGD	
C[C@@H]1C[C@]1(C)C(=O)N1CC[C@@]2(CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2)C1	1781065100	JSPIAJOXZFTRQV-UGCQDJOBSA-N	443.972	1.995	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)Cn3ccc4sccc4c3=O)CCO2)C1	1781215109	HZEQWRPGRIGEAS-QRWLVFNGSA-N	437.949	1.910	50	20	IDGD	
O=C(c1cnn2ccccc12)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781330321	WHDIPBVCQGARCP-WMLDXEAASA-N	425.258	1.468	50	20	IDGD	
O=C(c1cc[nH]c2nccc1-2)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781331758	VPCAITIQORQFCC-CXAGYDPISA-N	425.258	1.649	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)C3(Br)CC3)C2)C1	1781340629	MVJZJYBOPFAAJQ-BXUZGUMPSA-N	438.160	1.775	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](Cl)COC)C2	1781904680	AAHFJVKLNGKTEU-UMPJEAMMSA-N	439.778	1.928	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cn1ccccc1=O)C2	1781998446	VOEKGUOODHJJPD-QMTMVMCOSA-N	440.338	1.146	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)n1cc(C)cn1)C2	1782178523	NUHWHQIVEMFHLX-TVKQPGBESA-N	426.945	1.520	50	20	IDGD	
O=C(c1n[nH]c2c(Cl)cccc12)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1782215596	OPVJEDBFENMYRV-FZKQIMNGSA-N	427.288	1.260	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnn4c3OCCC4)C2)C1	1782281622	HWFWRKMLOYCARP-KDOFPFPSSA-N	441.326	1.283	50	20	IDGD	
O=C(CCBr)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H]2CC[C@H](O)CC2)C1	1782322743	QIQVRRPTYITHES-YKTARERQSA-N	431.371	1.836	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3nc4ccccn4n3)CCO2)C1	1783344157	ZLISHYCMBVQWFA-FZKQIMNGSA-N	436.310	1.346	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)CCc3ccc(N(C)C)cc3)CCO2)C1	1783879528	WPDCQLNMSWFSLS-DENIHFKCSA-N	437.968	1.769	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@]2(CN(C(=O)CCCc3ccccc3F)CCO2)C1	1783933470	ZXIFPQZSXLRMFO-QHCPKHFHSA-N	448.539	1.351	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H]3CCCN3Cc3ccccc3)C2)C1	1784241180	AAWOQKVRXDNINQ-SXWKCWPCSA-N	449.979	1.735	50	20	IDGD	
O=C(CCCc1cccnc1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1784674549	RMMBMGSPWBGEDX-SJLPKXTDSA-N	428.302	1.925	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3c(C)nn(C)c3C)[C@H]2C1	1784703399	NVLGJAPMFKUCLF-JONQDZQNSA-N	441.370	1.804	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)Cn3cccn3)[C@H]2C1	1785445243	YOHMSHLRTRBYPX-WOYTXXSLSA-N	441.370	1.672	50	20	IDGD	
C[C@H](C(=O)NC1(c2ccc(NC(=O)[C@H](O)CCl)cc2)CCC1)[C@H]1SC(=N)NC1=O	1786132372	MFYILGLSBJGANO-ZLKJLUDKSA-N	438.937	1.523	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC1(c2ccc(NC(=O)[C@](C)(O)C(F)(F)F)cc2)CCC1	1786599056	PEVUTTNQXPHUIV-SFHVURJKSA-N	444.454	1.807	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc4ccccn4n3)[C@H]2C1	1787844867	WVIHCCRHQLUKKW-DNUAJFIVSA-N	449.349	1.959	50	20	IDGD	
COc1ccc(C(=O)NC2(c3ccc(NC(=O)c4cccc(B(O)O)c4)cc3)CCC2)nn1	1788147963	RNORXHAXPRGNQH-UHFFFAOYSA-N	446.272	1.227	50	20	IDGD	
CCc1noc(C)c1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)Br)C[C@@H]21	1788951335	HUTICZWAMGWATQ-HTUGSXCWSA-N	428.327	1.922	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/c3cnccn3)C[C@@H]21)[C@@H](F)Br	1789927306	UHHGUBNOQOQOJC-UEWRTFJKSA-N	427.274	1.160	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cn3ccnc3C)[C@H]2C1	1790653180	ZECMACABWCWDSA-JONQDZQNSA-N	427.343	1.345	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN3CCCCC3)C[C@@H]21	1790961827	RYYUXGXHOJXWGC-NXOAAHMSSA-N	430.387	1.626	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cnc4ccccn34)C[C@@H]21	1791055455	VUXGIVWDUYWIAB-OTRWWLKZSA-N	449.349	1.640	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc(F)cn3)C[C@@H]21	1791058053	NZDJSWHWYBMEOH-APYUEPQZSA-N	428.302	1.526	50	20	IDGD	
N#Cc1ccc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCBr)C3)cc1	1792423307	DRBFDYHPKSPBKM-XEMDLRDOSA-N	434.334	1.865	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccn3nccc3c1)C2	1792870966	NQYYRZLJZKGZAX-FAYQHZLMSA-N	435.322	1.569	50	20	IDGD	
C[C@@H](CBr)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCN1CCN(C)CC1)C2	1792989529	MBWHSWGKVBHPFX-NXOAAHMSSA-N	429.403	1.293	50	20	IDGD	
O=C(CCc1cnc2[nH]ccc2c1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1	1796190426	WQTQQPVUIIPKRK-WKCHPHFGSA-N	446.316	1.127	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccn2nccc2c1	1797552700	GIUXDAAXPOVRKC-FAYQHZLMSA-N	435.322	1.569	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1coc([Si](C)(C)C)c1	1797727140	CDIUGSSNEOWNDC-OEYIWLLWSA-N	443.414	1.811	50	20	IDGD	
CCO/C=C/C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O	1798522930	FRPZNQIAKJGDCN-OZAHNZTQSA-N	447.444	1.274	50	20	IDGD	
CC(=O)N[C@@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2)c1ccc(F)cc1	1799055896	FIRYESBFQQJWPS-IMPMIVQMSA-N	429.851	1.127	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CC[C@H]2CCC(=O)N2C1	1799152863	PHQHRCOLNVPQME-VGTAHMJBSA-N	425.957	1.385	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cn3nc(C)sc3n1)C2	1799263743	VCJRJGNINYEALE-LMWOUKEDSA-N	425.942	1.249	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)ccc1F	1799525845	JCRUUIUJNBKGOA-LSSIXWDNSA-N	429.286	1.766	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)c1ccc(C(F)(F)F)c(F)c1	1799536365	NRSMMVQDRSSNAX-BAESOJJISA-N	438.805	1.647	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(C)c(NC(C)=O)c1	1799716495	XFWBQOZGRKYBBH-SFNKJDCFSA-N	437.924	1.410	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CC(c2ccccc2)=NN1	1800153799	UTONEIOAMMFQHT-JEIKXUOUSA-N	432.952	1.750	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)NC(=O)OC(C)(C)C	1800596942	JZTZQURYVKWIAD-BYNIDDHOSA-N	434.331	1.251	50	20	IDGD	
CC(C)c1nc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)Br)no1	1800757583	QMMVXTPQEHVWTC-MCYUEQNJSA-N	429.315	1.109	50	20	IDGD	
O=C(CCBr)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnc2c(c1)CCNCC2	1801308786	ORKJGNSYDSKANZ-BJWYYQGGSA-N	435.366	1.807	50	20	IDGD	
C[C@@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN1C(=O)CSC1=S)C2	1801968056	HHSIDNKZOCQNIV-CHWFTXMASA-N	434.381	1.268	50	20	IDGD	
C=CCNC(=O)/C=C\C(=O)N1CCCC2(CCN(C(=O)[C@H](F)Br)CC2)C1	1804856612	RQWXLHKIRIGGCA-AWFCHZOYSA-N	430.318	1.767	50	20	IDGD	
O=C1Nc2c(cccc2C(=O)N2CCC3(CCCN(C(=O)[C@H](O)CCl)C3)CC2)C1=O	1805524146	JPRQLHGQQJVWMH-OAHLLOKOSA-N	433.892	1.266	50	20	IDGD	
Cc1ccccc1C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1807360778	LXTGZNXWDMRYAS-NZQKXSOJSA-N	443.312	1.703	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)Cn2cc(Cl)cn2)[C@H]1c1cccnc1	1807414082	PWGDXXLTDCWLAA-QILLFSRXSA-N	440.331	1.891	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)COC(=O)C(F)(F)F)[C@@H]1c1cccnc1)[C@@H](F)Cl	1808313612	INDYPEPFHIVTTP-CYZMBNFOSA-N	425.766	1.727	50	20	IDGD	
CN1CCCn2nc(C(=O)N3CC[C@H](CNC(=O)[C@H](F)Cl)[C@H]3c3cccnc3)cc2C1	1808322955	ZIVAQLDZFXJHDA-LZQZEXGQSA-N	448.930	1.968	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)CCC#N)[C@@H]1c1cccnc1	1808414854	MWFRFUTZPYPCGN-YQNFXTCNSA-N	435.488	1.525	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CN2CCOC2=O)[C@@H]1c1cccnc1)[C@@H](F)Br	1808649545	SYQHFQTVHNFDTB-NWANDNLSSA-N	443.273	1.230	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)[C@@H]2CC2(F)F)[C@@H]1c1cccnc1	1809524173	ZFNRABYSISVXRT-COXVUDFISA-N	444.442	1.055	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)[C@@H](F)c3ccccc3)CC2)C1	1809968893	HEJFIFCDAWSTCZ-NRFANRHFSA-N	438.308	1.922	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)c3cccnc3Cl)CC2)C1	1809972789	QNVNFLCBFDRRRC-UHFFFAOYSA-N	441.724	1.573	50	20	IDGD	
O=C(/C=C/c1cccs1)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1	1809976649	MJWZZOWYIBCYJM-BQYQJAHWSA-N	438.358	1.986	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H](CNC(=O)[C@@H]2CCCS2(=O)=O)[C@@H]1c1cccnc1	1812494328	SYZJWIZLEHFWFO-IKGGRYGDSA-N	441.981	1.930	50	20	IDGD	
CN1CCN(CCC(=O)N2CC[C@H](CNC(=O)C(Cl)Cl)[C@H]2c2cccnc2)CC1	1813075579	FOWZTLIWLFFOOE-SJLPKXTDSA-N	442.391	1.529	50	20	IDGD	
COc1ccnc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)[C@@H](O)CCl)n[nH]2)c1OC	1814872839	GQJPDXWYDYYUGM-STQMWFEESA-N	437.884	1.728	50	20	IDGD	
CN1CCCn2nc(C(=O)N3CCCC[C@H]3c3cc(NC(=O)[C@@H](O)CCl)n[nH]3)cc2C1	1814875073	NULHBBUGBITKAX-IRXDYDNUSA-N	449.943	1.347	50	20	IDGD	
Cc1noc(C)c1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1816401707	FRZLEBMCETXYAD-QGZVFWFLSA-N	437.265	1.314	50	20	IDGD	
COC1(CC(=O)N2CCCC[C@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)CCC1	1817474671	FROUXRIKOXBGCK-SFHVURJKSA-N	440.309	1.355	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](O)CCl)CC2)c1nnsc1C1CC1	1817702206	MZNWBTMVMJAKBP-WPRPVWTQSA-N	427.939	1.698	50	20	IDGD	
COc1ccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)nc1	1818400790	OGQLYOOQGVAEMB-IBGZPJMESA-N	449.276	1.113	50	20	IDGD	
O=C1Cc2cc(C(=O)Nc3nc4c(s3)C[C@@H](NC(=O)[C@@H](O)CCl)CC4)ccc2N1	1818918765	DPUGVLXWAIZDGH-FZMZJTMJSA-N	434.905	1.463	50	20	IDGD	
Cc1n[nH]cc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819403541	SERFGBGYCCEOBU-MRXNPFEDSA-N	437.464	1.059	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)C(Cl)Cl)CC2	1819800959	VXGZNGLLEVBHJK-SSDOTTSWSA-N	443.316	1.171	50	20	IDGD	
Cc1nc(C)c(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)o1	1819803209	CPIBKRAXVBGIFY-HNNXBMFYSA-N	431.497	1.693	50	20	IDGD	
C[Si](C)(C)OCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](N)Cc1cccnc1)CC2	1820164772	IHLCQSGCLIFBGU-CABCVRRESA-N	447.637	1.872	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)C(=O)c2ccco2)[nH]n1	1822410378	IJIGYKAENKGIEV-CQSZACIVSA-N	430.465	1.251	50	20	IDGD	
CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](F)Cl)[nH]n1	1822701320	FPYPANYDWVWQPU-IIAWOOMASA-N	439.879	1.407	50	20	IDGD	
CS(=O)(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1	1823014422	WFWFWFVBZIMPNJ-WRWORJQWSA-N	442.332	1.180	50	20	IDGD	
O=C(Cn1ccncc1=O)Nc1nc2c(s1)C[C@H](NC(=O)CCBr)CC2	1824531292	AMSZFGGLJHLLPL-SNVBAGLBSA-N	440.323	1.097	50	20	IDGD	
CCOc1ccc(C(=O)N[C@@H]2CCc3nc(NC(=O)[C@@H](Cl)COC)sc3C2)nn1	1826003280	JVRFYUHIFALTHO-MNOVXSKESA-N	439.925	1.811	50	20	IDGD	
CC(C)=NO[C@@H](C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827056854	YXMKSBHDQNUWRI-UWJYYQICSA-N	443.353	1.401	50	20	IDGD	
Cc1ccc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)CCC(=O)NN(C)C)CC3)c(O)c1	1827568816	SXAYZDQPKYYHGV-CYBMUJFWSA-N	445.545	1.756	50	20	IDGD	
C[C@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H](F)Cl)CC1)[C@@H]1SC(=N)NC1=O	1827614276	YXXDYRGSOAANKR-PYJNHQTQSA-N	432.949	1.943	50	20	IDGD	
Cc1cn(CC(=O)N2CCC([C@H]3CCCCN3C(=O)[C@H](F)Cl)CC2)c(=O)nc1O	1827615229	DAALDCGCJKXADC-ZBFHGGJFSA-N	428.892	1.411	50	20	IDGD	
C=CCSCC(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1	1828923304	BWWCYVWUTHQODN-LJQANCHMSA-N	445.589	1.838	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(OC)c(F)c3)CCO2)C1	1830151116	JGPSGPSZZVPKTL-MGPUTAFESA-N	428.888	1.922	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(CO)c(F)c3)C2)C1	1830370409	LECUKMGADGAOPV-NRFANRHFSA-N	442.915	1.653	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)CCC(F)(F)F)C2)C1	1830537070	BARCVGFBQZJQBR-DOMZBBRYSA-N	445.276	1.816	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)/C=C/c3ccoc3)CCO2)C1	1832652279	FANHTBKTYYFIRM-LUODXLFYSA-N	441.322	1.923	50	20	IDGD	
CC(C)(C(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)CCl)CC2)CC1)c1ccccn1	1833313051	RSBCQYXAMHQWRP-SFHVURJKSA-N	436.984	1.531	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)c3ncn(C)n3)CC2)CC1	1834085002	NESOCWWBDXWYJK-ZDUSSCGKSA-N	441.374	1.031	50	20	IDGD	
O=C(O)c1cnncc1C(=O)NC1CCN(C2CCN(C(=O)C(Cl)Cl)CC2)CC1	1835921285	GTQNKQCZCNDYGO-UHFFFAOYSA-N	444.319	1.164	50	20	IDGD	
N#Cc1c[nH]c(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](F)Br)CC3)CC2)c1	1836170465	OTICYJDXHPTMSC-MRXNPFEDSA-N	440.317	1.762	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1Cc3ccccc3CN1)CCO2	1836485009	KZQAJQYQAUZTCK-IPJJNNNSSA-N	435.952	1.175	50	20	IDGD	
Cc1nc(C)c(C(=O)N2CCOC[C@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)s1	1837712389	OTVYFGOKQSRMFY-IBGZPJMESA-N	441.626	1.681	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cn(C)c4ncccc34)C2)C1	1839146237	WVXASCTUFLUTAF-DYESRHJHSA-N	434.924	1.661	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)c(C)n1C	1840034541	OLGAGQQNKBOZCJ-KUHUBIRLSA-N	442.354	1.495	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)C3(c4ccccc4)CC3)C2)C1	1840149414	ONHPVWNTCJQAIF-WIYYLYMNSA-N	436.936	1.428	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cscc3OC)C2)C1	1840152337	FSWHCEYAEHYNDF-KSSFIOAISA-N	432.926	1.081	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1CCCN1C(C)C)CCO2	1840581494	DFIONFCQQGEHID-BBTUJRGHSA-N	429.989	1.723	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(C(N)=O)cc3)CCO2)C1	1840646074	BLXJADSCSOBQPF-DYESRHJHSA-N	437.924	1.263	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccccc3C3CC3)CCO2)C1	1840658302	WQPWLBASYSYNJB-DENIHFKCSA-N	436.936	1.888	50	20	IDGD	
C[C@]1(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)CC1(F)F	1840828116	NJJDJNWCYKMLNO-ZLKJLUDKSA-N	429.233	1.179	50	20	IDGD	
COC(=O)N[C@@H](C(=O)N1CCCC12CN(C(=O)[C@H](F)Br)C2)c1ccccc1	1841238854	DQBBUZSEGWAOCW-KGLIPLIRSA-N	442.285	1.978	50	20	IDGD	
O=C(Nc1ccc(C(=O)N2CC3(CCCN3C(=O)[C@H](O)CCl)C2)cc1)c1ccco1	1841353311	PRPYOYYGTRBRAG-MRXNPFEDSA-N	431.876	1.949	50	20	IDGD	
Cc1cc(C(=O)N2CCCC23CN(C(=O)CN(C)NC(=O)NCc2ccccc2)C3)on1	1842461581	ZMZWQDSZDHZPCB-UHFFFAOYSA-N	440.504	1.146	50	20	IDGD	
O=C([C@H](F)Br)N1CC2(CCCN2C(=O)c2cccc(N3CCOCC3)n2)C1	1843528124	BRNSUEJAOMKCPJ-HNNXBMFYSA-N	441.301	1.426	50	20	IDGD	
CC(C)(NC(=O)c1ccc(Cl)s1)C(=O)N1CCCC12CN(C(=O)[C@H](O)CCl)C2	1845042832	UXYVKAIFWURACT-LLVKDONJSA-N	448.372	1.713	50	20	IDGD	
Cc1ccc(=O)n(C(C)(C)C(=O)N2CC3(CCCN3C(=O)[C@](C)(Cl)CCl)C2)n1	1845171191	MKJMWFSMOKGTQJ-GOSISDBHSA-N	429.348	1.727	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC12CN(C(=O)c1c(Br)cnn1C)C2	1846176971	QDROEIMBTBITEZ-SECBINFHSA-N	434.132	1.783	50	20	IDGD	
CC(C)(C)OC(=O)N1CCO[C@@H](C(=O)N2CC3(CCCN3C(=O)C(Cl)Cl)C2)C1	1846389461	QURQVAKVZORFIH-GFCCVEGCSA-N	436.336	1.629	50	20	IDGD	
CCOC(=O)N1CCC(C(=O)N2CCCC23CN(C(=O)CO[Si](C)(C)C)C3)CC1	1846976617	DKKMUPSHVRNTEJ-UHFFFAOYSA-N	425.602	1.910	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@H](C(=O)NNC(=O)Cn2cnc3ccccc32)C(C)C)cc1	17404098	VUZFTOWCXXGWOL-FQEVSTJZSA-N	443.529	1.495	50	20	IDGD	
Cc1cccc(C)c1OCc1nnc(SCC(=O)NNC(=O)c2ccc(F)cc2)n1N	24216144	LKDHAXBXSQNLRO-UHFFFAOYSA-N	444.492	1.880	50	20	IDGD	
COc1ccc(-c2nnc(S)n2CC(=O)NNC(=O)c2ccc3c(c2)OCO3)cc1	26965472	XUFRRQTTWDRRMX-UHFFFAOYSA-N	427.442	1.432	50	20	IDGD	
COC(=O)c1sccc1S(=O)(=O)NNC(=O)c1ccc(OC(C)C)c(OC)c1	28790678	WGRKUSRWBFURFJ-UHFFFAOYSA-N	428.488	1.954	50	20	IDGD	
CSCC[C@@H](NC(=O)c1ccccc1)C(=O)NNC(=O)CNC(=O)c1cccs1	725740985	KGULERCDYNFWNY-CQSZACIVSA-N	434.543	1.177	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(N2CCCS2(=O)=O)cc1)c1ccc2ccccc2n1	726765288	YKEZSXXQHYQDFA-UHFFFAOYSA-N	446.510	1.398	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CNC(=O)c2cc3c(s2)CCCC3)cc1C	726804522	YNCRYWVIFXGSMT-UHFFFAOYSA-N	428.514	1.760	50	20	IDGD	
O=C(CCc1nc(-c2ncccn2)no1)NNC(=O)COc1ccc(Br)cc1	727705594	WEOPHSIOWDXVKM-UHFFFAOYSA-N	447.249	1.448	50	20	IDGD	
CCCOc1c(Br)cc(C=NNC(=O)[C@H](C)NS(C)(=O)=O)cc1OC	728435977	BLOAOLPTBPGKGF-JTQLQIEISA-N	436.328	1.634	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)c2cnc3cc(C)ccn3c2=O)c1	728527257	FCCACJDALMZFMO-UHFFFAOYSA-N	431.246	1.849	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)NC2CCC(NC(C)=O)CC2)c1	728751482	STBGNYZQIOXPCW-UHFFFAOYSA-N	427.299	1.849	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)Cc2ccc(S(=O)(=O)N3CCCCC3)cc2)c1	728827302	LRYWFJOBYSCPKG-UHFFFAOYSA-N	426.498	1.737	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2cccc3ncccc23)cc1	730287822	ZQLWAGZPKYANRE-UHFFFAOYSA-N	426.454	1.177	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)NCc1ccc(S(=O)(=O)N2CCCC2)cc1	730821435	XZOBLLDOCGGJQT-UHFFFAOYSA-N	448.501	1.086	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CN2CCN(CC(=O)N[C@@H]3CCC[C@@H](C)C3)CC2)cc1	731214093	ARPGEHYOOWTAFA-UYAOXDASSA-N	429.565	1.069	50	20	IDGD	
O=C(CCc1ccccc1)NNC(=O)NCC1CCN(S(=O)(=O)C(F)(F)F)CC1	732675459	DHHJDFDTGDQIBL-UHFFFAOYSA-N	436.456	1.511	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)CNC(=O)NC2CCCCC2)CC1	734825724	NLDGURDHPLYOKV-UHFFFAOYSA-N	440.545	1.348	50	20	IDGD	
O=C(NNc1ccc(Cl)nn1)[C@@H]1CCCN1S(=O)(=O)c1cccc([N+](=O)[O-])c1	735687158	VCRNANHGVXLVSZ-LBPRGKRZSA-N	426.842	1.335	50	20	IDGD	
COc1ccc(COCCC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1	736066448	IYEOCMXSFURAGH-UHFFFAOYSA-N	449.529	1.378	50	20	IDGD	
CN(CCCC(=O)NNC(=O)COCc1ccccc1)S(=O)(=O)c1ccc(F)cc1	737636674	VKLDAPPXWODDIC-UHFFFAOYSA-N	437.493	1.591	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H]2Cc3cc(F)ccc3O2)c1	740812289	BJSXVHMVJVTPSH-GOSISDBHSA-N	435.477	1.621	50	20	IDGD	
CSc1ccc(O[C@@H](C)C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1	740996154	QKZGRCYFRZKTMA-UGSOOPFHSA-N	446.481	1.706	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)N[C@H](C)[C@H]1CN(Cc2ccccc2)CCO1	741266687	LXEKYSRWYOLMMQ-VQIMIIECSA-N	436.516	1.876	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)N1CCc2ccccc21	743534342	RWYIZCSBFLUQFC-AWEZNQCLSA-N	431.518	1.877	50	20	IDGD	
COc1ccccc1-c1noc([C@H](C)NC(=O)NNC(=O)CNC(=O)c2ccco2)n1	743576580	GJCWTITXPUDCLG-NSHDSACASA-N	428.405	1.160	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)c(S(=O)(=O)NC[C@H]2CCCO2)c1)NC1CCCC1	744052925	YQNLMZGLCIODLE-CQSZACIVSA-N	444.941	1.684	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)/C(=C/c2cccc(F)c2)n2nnnc2C)c1	744545103	GLOWUDZDOAWTPD-WQRHYEAKSA-N	438.419	1.432	50	20	IDGD	
COc1cc(C)nc(NNC(=O)Cc2ccc(S(=O)(=O)N3CCCCC3)s2)n1	746634869	RWPRQXDCUKOSBI-UHFFFAOYSA-N	425.536	1.716	50	20	IDGD	
CCn1nc(C(=O)NN=C(C)c2ccc(S(C)(=O)=O)c(OC)c2)c2ccccc2c1=O	747046353	YTBSFQPXKMOQRJ-UHFFFAOYSA-N	442.497	1.983	50	20	IDGD	
O=C(CSCC(=O)c1ccc(Cl)cc1)NNC(=O)c1ccc(-n2cnnn2)cc1	747199776	DCCZKKMGMQCZIC-UHFFFAOYSA-N	430.877	1.693	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)[C@H]1CCCN1C(=O)c1ccc2c(c1)OCO2	749720972	PLNZZZOTEUQVBK-MRXNPFEDSA-N	440.456	1.288	50	20	IDGD	
NC(=O)c1cc(CNC(=O)NNC(=O)c2ccccc2OCc2ccc(F)cc2)on1	752683811	DGEBZFWIYAUMLG-UHFFFAOYSA-N	427.392	1.636	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NCCNS(=O)(=O)c2ccc(Cl)s2)cc1	752689569	SYYNWBNBQBNYOG-UHFFFAOYSA-N	446.938	1.398	50	20	IDGD	
CS(=O)(=O)CC1(CNC(=O)NNC(=O)COc2ccccc2-c2ccccc2)CC1	753019283	GYBAEWSMGSKRQA-UHFFFAOYSA-N	431.514	1.888	50	20	IDGD	
C[C@@H]1C[C@@H](CCNC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)CCO1	753336939	RYMHWHVRFBNNID-CVEARBPZSA-N	438.550	1.620	50	20	IDGD	
C[C@H](OC(=O)/C(C#N)=C/c1ccc(O)cc1)C(=O)NCCc1ccc(S(N)(=O)=O)cc1	754541449	ODQIRLACYATGSV-IQGJIOQQSA-N	443.481	1.237	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)Nc1cccc(N2CCCS2(=O)=O)c1	755888269	HKIPUESFFTXHOD-UHFFFAOYSA-N	440.485	1.879	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)Nc1ccc(NC(=O)c2ccco2)c(Cl)c1	756167683	HJZCCBUMBBKKLO-JTQLQIEISA-N	440.865	1.773	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccccc2CN2C(=O)CCC2=O)c1	756220106	AQXOYWGCMKKRJC-UHFFFAOYSA-N	444.469	1.206	50	20	IDGD	
COCCn1ncc2ccc(NC(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)cc21	756268903	FOJQSXGEFONIOY-UHFFFAOYSA-N	435.444	1.396	50	20	IDGD	
Cc1nn(C)c2sc(C(=O)N[C@@H](C)C(=O)NNc3nc(O)c4ccccc4n3)cc12	758307445	JFVJNDMEQRTWDM-JTQLQIEISA-N	425.474	1.854	50	20	IDGD	
Cc1c(C(=O)OCC(=O)NNC(=O)c2cccs2)cnn1CCO[C@H]1CCCCO1	758620142	QEPJKHOPFOWMPJ-KRWDZBQOSA-N	436.490	1.414	50	20	IDGD	
CCCOc1ccc(C(=O)NNS(=O)(=O)c2cc(C(=O)OCC)n(C)c2)cc1OC	760510223	OTZUHHDIVJKYOE-UHFFFAOYSA-N	439.490	1.623	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@@H]2CCN(C(=O)C3CCCC3)C2)c2ccccc2c1=O	762383531	YIPCLIAOFTWRSR-OAHLLOKOSA-N	440.504	1.152	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)[C@H](Cc2ccccc2)n2nnnc2C)n[nH]1	763151737	DZXHSTOXXSVGCX-IBGZPJMESA-N	446.471	1.625	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2cccs2)[nH]n1)c1cnc2c(c1)c(O)nc(=O)n2C1CC1	763160248	DUSJASSJQOOLDA-UHFFFAOYSA-N	437.441	1.358	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COc2ccccc2O)cc1I	763366488	XGGZCKLCWUVRIP-UHFFFAOYSA-N	442.209	1.845	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1N1CCOC1=O	763470209	IIWVDBJTRDFBQR-UHFFFAOYSA-N	427.373	1.260	50	20	IDGD	
O=C(NNC(=O)c1ccccc1Br)C(=O)Nc1cnn(C[C@H]2CCCO2)c1	763481949	AGGFHGBIODSGLN-GFCCVEGCSA-N	436.266	1.224	50	20	IDGD	
C[S@](=O)Cc1ccccc1NC(=O)C(=O)NNC(=O)c1ccccc1Br	763483488	UXVFZQZEMPMYBO-SANMLTNESA-N	438.303	1.727	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cc(F)c(F)cc2F)cc(OC)c1OC	763540549	WMBSXTMZBHJVDP-UHFFFAOYSA-N	427.335	1.529	50	20	IDGD	
COC(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1	763575007	OKIXMDJENSZCIQ-HNNXBMFYSA-N	433.804	1.053	50	20	IDGD	
COc1ncc(NC(=O)C(=O)NNC(=O)c2sc3ccccc3c2Cl)cc1C(N)=O	763577675	JCRCYKWUPDHOOG-UHFFFAOYSA-N	447.860	1.457	50	20	IDGD	
Cc1cc(C)nc(-n2nc(C(=O)NNC(=O)Nc3ccc(S(C)(=O)=O)cc3)cc2C)n1	763579117	FLMBEWQBKFMYAX-UHFFFAOYSA-N	443.489	1.458	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc2c(cc1Cl)OCO2	763682419	OANCVIISNCAHCU-UHFFFAOYSA-N	435.820	1.632	50	20	IDGD	
CCc1cccc(C)c1NC(=O)C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	763718401	KWGRELUEQFRVPN-UHFFFAOYSA-N	432.502	1.207	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2c(F)c(F)c(F)c(F)c2F)c1	763772657	OICBLHQTVRYUDR-UHFFFAOYSA-N	433.289	1.799	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)C(=O)Nc2ccccc2CC(F)(F)F)c2ccccc2c1=O	763789763	CGCVIUNWMKECCB-UHFFFAOYSA-N	447.373	1.438	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNC(=O)COc2ccc(C)cc2)ccc1Cl	763810080	ZIECYWXJKDDXGP-UHFFFAOYSA-N	433.848	1.990	50	20	IDGD	
Cc1nn(C)c2ncc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc3ccc4ccccc4c3)cc12	763851373	CKHPBJVKVWWPMJ-CQSZACIVSA-N	446.467	1.983	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccc(O[C@@H]2CCOC2)cc1	763868012	ZQPAKNVFXREBDS-FZKQIMNGSA-N	431.420	1.547	50	20	IDGD	
COC(=O)c1cc(I)cc(NC(=O)C(=O)NNC(=O)CC(C)C)c1	763883169	URLKYYMLHGYPIH-UHFFFAOYSA-N	447.229	1.210	50	20	IDGD	
CC[C@@H](C)C(=O)NNC(=O)C(=O)Nc1ccnn1Cc1ccc(OC(F)(F)F)cc1	764082373	MTDLMIMYJNRMKE-LLVKDONJSA-N	427.383	1.962	50	20	IDGD	
O=C(CC(F)(F)F)NNC(=O)C(=O)Nc1cnn(-c2ccccc2Br)c1	764114709	FWPROYRIIGEHGM-UHFFFAOYSA-N	434.172	1.673	50	20	IDGD	
O=C(CCc1ccccc1)NNC(=O)C(=O)Nc1ccc(CCC(=O)N2CCCC2)cc1	764184699	DFNXNTGJNAOIPQ-UHFFFAOYSA-N	436.512	1.960	50	20	IDGD	
C[C@H]1CN(C(=O)c2ccc(NC(=O)C(=O)NNC(=O)c3cccc(C#N)c3)cc2)C[C@@H](C)O1	764236838	GMBXDLVJJYRBCH-GASCZTMLSA-N	449.467	1.207	50	20	IDGD	
CCOC(=O)C(C)(C)n1cc(NC(=O)C(=O)NNC(=O)c2cccc3ncccc23)cn1	764260287	OZNJQNZUYRXCOJ-UHFFFAOYSA-N	438.444	1.129	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1ccc(OCC(F)(F)F)cc1	764278319	VVVBGSGBCHIDEU-UHFFFAOYSA-N	427.335	1.498	50	20	IDGD	
CCc1cc(O)nc(-c2cccc(NC(=O)C(=O)NNC(=O)Cc3ccccc3F)c2)n1	764319394	QLYLFUSTKQYVCG-UHFFFAOYSA-N	437.431	1.879	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)C(=O)Nc1ccc(OC[C@@H]2CCCO2)cc1	764363235	MEEACGXMIZKZBT-IBGZPJMESA-N	427.457	1.547	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1ccc2oc(N(C)C)nc2c1	764398819	XESRLMJCMPMESC-UHFFFAOYSA-N	443.485	1.781	50	20	IDGD	
CS(=O)(=O)c1ccc(F)c(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2F)c1	764413081	MHFCJMAWBYFZRY-UHFFFAOYSA-N	431.804	1.421	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1F	764741725	ZXLUJKBHJGZAAD-UHFFFAOYSA-N	427.480	1.757	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)c3ccc(CN4C(=O)CNC4=O)cc3)n[nH]2)c1	765576823	UWGQSEBXBXMEPQ-UHFFFAOYSA-N	446.467	1.820	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NC[C@H]1CCCS1(=O)=O	765645954	YDYATXYSHDPZSZ-GXFFZTMASA-N	434.312	1.124	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)C1(c2cccc(Cl)c2)CC1	766639875	AVEZALKGKHWVIA-UHFFFAOYSA-N	440.931	1.977	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NCC(=O)NNC(=O)Cc1nc(-c2ccccc2)cs1	766774709	HZDDNVALWZCXTP-UHFFFAOYSA-N	447.517	1.141	50	20	IDGD	
CCC(C)(CC)C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	767046044	IONUEKQKBPLNTH-UHFFFAOYSA-N	425.551	1.614	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)c1ccc(S(=O)(=O)NC(C)C)cc1	767269418	SGOQBDRABAFQLI-UHFFFAOYSA-N	447.513	1.229	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)CNC(=O)c1c(F)cccc1Cl	767334129	BJYCYLQBLABJHX-UHFFFAOYSA-N	435.839	1.451	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2cc(Cl)c(F)c(C(=O)O)c2)cc1OC	767734088	DJUDOHIBFWZVDY-UHFFFAOYSA-N	432.813	1.818	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1C	767821660	DYNUYBQIQTVLCP-UHFFFAOYSA-N	427.866	1.144	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)c3cc(C(N)=O)n(-c4ccccc4)n3)n[nH]2)cc1	768267768	BZGYTGBCDCCZSN-UHFFFAOYSA-N	443.467	1.999	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ccc3nncn3n2)CC1)c1cc(-c2ccc(F)cc2)[nH]n1	768279791	STLORTFUXZBJSR-UHFFFAOYSA-N	449.450	1.331	50	20	IDGD	
N#Cc1cc(Cl)nc(NNC(=O)Cc2ccc(S(=O)(=O)N3CCOCC3)s2)c1	769076938	WCUMOMPUZMBEKM-UHFFFAOYSA-N	441.922	1.375	50	20	IDGD	
CSCCNC(=S)NNC(=O)CCc1c(C)nc2nc(C(F)(F)F)nn2c1C	769770098	QDGSDCJFTSJSKT-UHFFFAOYSA-N	435.501	1.551	50	20	IDGD	
CSCCNC(=S)NNC(=O)c1cn(CCOc2ccc(C=O)cc2Cl)nn1	770245455	NYZMMUVWHKLHQV-UHFFFAOYSA-N	442.954	1.295	50	20	IDGD	
Cc1nnnn1-c1cccc(NC(=O)C(=O)NNc2ccc(Br)c(F)c2)c1	770814959	CCXIZXDWIMXQHE-UHFFFAOYSA-N	434.229	1.954	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NN=Cc1cccc2nccn12	771089620	ROVFTTDCVPLNKF-UHFFFAOYSA-N	441.513	1.438	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N[C@H]1CCO[C@@]2(CCOC2)C1	771444145	NGSKCSPXDQHRIT-YEWDVWPNSA-N	442.310	1.885	50	20	IDGD	
CNC(=O)COc1cccc(CC(=O)NNC(=O)c2cc(-c3ccccc3OC)[nH]n2)c1	772228759	RNKVCXBFUSKCFC-UHFFFAOYSA-N	437.456	1.214	50	20	IDGD	
C[C@H]1CN(c2ccnc(C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)c2)C[C@@H](C)O1	772284069	PVZLMOXSBPFYRR-OKILXGFUSA-N	436.513	1.164	50	20	IDGD	
COCCS(=O)(=O)c1ccc(C(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)cc1	772965748	FNYUNEGZMHREKZ-ZDUSSCGKSA-N	440.905	1.989	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3O)n[nH]2)cc1OC	773538493	MIKCYMRYEOUREN-UHFFFAOYSA-N	427.373	1.783	50	20	IDGD	
Cn1ncc(C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c1Cc1ccccc1	773591103	ITAGLDUXARLQRN-UHFFFAOYSA-N	437.412	1.537	50	20	IDGD	
CC[C@H]1Oc2cc([C@H](C)NCC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)ccc2NC1=O	775463341	KHRQQOFPLOKEBV-YVEFUNNKSA-N	441.444	1.816	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)Nc2cccc(CN3CCC[C@@H]3C(N)=O)c2)c1	776301231	CRNAASZRAWIAOX-GOSISDBHSA-N	431.518	1.688	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)[C@@H]2CCCN(C(=O)COc3ccccc3)C2)c1	776541094	GTURULOSILLRGX-MRXNPFEDSA-N	431.514	1.851	50	20	IDGD	
O=C(c1ccc([N+](=O)[O-])cc1Cl)N1CCN(S(=O)(=O)CBr)CC1	777779241	GTRLAXWQSGAVAG-UHFFFAOYSA-N	426.676	1.688	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)c3cc(S(=O)(=O)N(C)C)cn3C)n[nH]2)cc1	778690035	VYCYLSDPOPHQPR-UHFFFAOYSA-N	444.517	1.303	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)N[C@@H]1CCN(c2ccc(Cl)c(Cl)c2)C1=O	779379350	APQUIODDSGILDA-QMTHXVAHSA-N	433.292	1.481	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN[C@H](CO)c2ccc(C(F)(F)F)cc2)cc1OC	782090162	JDONPEZNXAPFJI-OAHLLOKOSA-N	441.406	1.807	50	20	IDGD	
CC(=O)Nc1cc(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)ccc1Cl	782892427	DCZXVNMBVLMSLG-UHFFFAOYSA-N	442.863	1.514	50	20	IDGD	
O=C(NNc1cc(Cl)ccc1Cl)C(=O)Nc1cnn(CC(=O)N2CCOCC2)c1	783367491	FJURLHIRUOHEJD-UHFFFAOYSA-N	441.275	1.131	50	20	IDGD	
COc1ccc(S(=O)(=O)NC(C)(C)C)cc1NC(=O)C(=O)NNc1cc(C)ccn1	783934345	QCULXTHNKKBULY-UHFFFAOYSA-N	435.506	1.557	50	20	IDGD	
O=C(NNC(=O)N1CC[C@H](Oc2cccc(F)c2)C1)C1CCN(c2ncccn2)CC1	784291552	VKBSGDLVWTVBCL-SFHVURJKSA-N	428.468	1.726	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2cccc(C(=O)N3CCOCC3)c2)cc1Cl	785120245	OCNDIIVYMRPCNW-UHFFFAOYSA-N	432.864	1.903	50	20	IDGD	
COC(=O)c1sccc1NC(=O)C(=O)NNc1c(OC)cccc1S(C)(=O)=O	785331584	WDUIAMNCWVQAJD-UHFFFAOYSA-N	427.460	1.029	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)Nc2ccc(C)c(C(=O)N3CCOCC3)c2)c1	786122017	XZABCIXNWACQEK-UHFFFAOYSA-N	440.460	1.287	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)[C@@H]1CCCN(C(=O)NC2CCCC2)C1	786817240	FBDWXRVMKDMBHA-GOSISDBHSA-N	444.532	1.592	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)[C@H](CCS(C)(=O)=O)c2ccccc2)nc2ccccc21	789869758	XKANHLZEFXXQHH-MRXNPFEDSA-N	428.514	1.482	50	20	IDGD	
CN(CC(=O)NNC(=O)c1cc(-c2ccco2)nc2ccccc12)[C@@H]1CCS(=O)(=O)C1	789939342	LADUTOJZHKABSP-CQSZACIVSA-N	442.497	1.375	50	20	IDGD	
O=C(NNC(=O)c1ccc(COc2ccccc2)o1)C(=O)Nc1cccc(N2CCC2=O)c1	790951517	HNIZNFNIVJXETK-UHFFFAOYSA-N	448.435	1.995	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1cccc(N2CCC2=O)c1	790953235	YNDURBLVLIAETN-UHFFFAOYSA-N	428.470	1.310	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)[C@@H]2CC(c3cc(OC)ccc3OC)=NO2)nc1C	792301585	QZQKQWWGMLASKX-KRWDZBQOSA-N	429.433	1.615	50	20	IDGD	
O=C(NNc1nc2ccccn2n1)C(=O)Nc1ccc(OCc2noc(C3CC3)n2)cc1	792388070	LRJFVFQURYOAIG-UHFFFAOYSA-N	434.416	1.651	50	20	IDGD	
O=C(NNc1cc(Cl)cc(Cl)c1)C(=O)Nc1ccnn1[C@@H]1CCS(=O)(=O)C1	792438644	WLLVVZANNNBCAX-GFCCVEGCSA-N	432.289	1.631	50	20	IDGD	
C[C@@H]1CCC(=NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)[C@H](n2cncn2)C1	794453050	IDQQODVGVBJZDR-DNVCBOLYSA-N	446.533	1.446	50	20	IDGD	
Cc1sc(S(=O)(=O)NNC(=O)CNC(=O)OCc2ccccc2)cc1[N+](=O)[O-]	794596561	IPGGLWWZCLLDON-UHFFFAOYSA-N	428.448	1.201	50	20	IDGD	
CCNC(=O)N(C)c1cccc(NC(=O)C(=O)NNC(=O)CCOc2ccccc2)c1	797002707	RBESJUAKMZIFFH-UHFFFAOYSA-N	427.461	1.407	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)c1cccc(S(=O)(=O)NCc2ccco2)c1	798333834	YNCBDLHYPNPZFB-UHFFFAOYSA-N	449.510	1.919	50	20	IDGD	
O=C(NNS(=O)(=O)c1cccc(Br)c1F)c1ccc(-n2cnnn2)cc1	799119443	BJWNQGIKFIDRKR-UHFFFAOYSA-N	441.242	1.187	50	20	IDGD	
Cc1c(I)cc([N+](=O)[O-])cc1C(=O)NNC(=O)c1ccncc1	801102065	ZCEMJSCALVRZCC-UHFFFAOYSA-N	426.170	1.978	50	20	IDGD	
CCN1CCC[C@H]1CN1C[C@H](C(=O)NNC(=O)Nc2ccc(OC(F)F)cc2)CC1=O	802043592	IDZQZYWOLNDUGF-HIFRSBDPSA-N	439.463	1.774	50	20	IDGD	
CCOC(=O)Nc1scnc1C(=O)OCC(=O)NNC(=O)c1cccc(Cl)c1	808699014	QBCSHIFLMRPYNE-UHFFFAOYSA-N	426.838	1.983	50	20	IDGD	
COC[C@@]1(C(=O)NNC(=O)c2ccc(OC)cc2OC)CCN(C(=O)OC(C)(C)C)C1	810356108	NFTRVNCEVVGRNB-OAQYLSRUSA-N	437.493	1.738	50	20	IDGD	
O=C1COc2c(cccc2NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)N1	810382664	JTINVZFSVOFIPJ-UHFFFAOYSA-N	440.384	1.096	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c2c(C)noc2n1	813544131	BSYNMYOOEOSSRR-UHFFFAOYSA-N	443.485	1.699	50	20	IDGD	
O=C1CNC(=O)c2ccc(C(=O)NNC(=O)c3cc(F)ccc3Br)cc2N1	815390273	BGAKFDCSGJUKJS-UHFFFAOYSA-N	435.209	1.345	50	20	IDGD	
Cc1cc(N2CCCC[C@H]2C)ccc1NC(=O)C(=O)NNC(=O)[C@@H]1CCc2nncn2C1	815692406	QGSPOAJKENFVMZ-HZPDHXFCSA-N	439.520	1.314	50	20	IDGD	
O=C(NNc1cccc(Cl)n1)C(=O)Nc1ccccc1S(=O)(=O)N1CCCCC1	815726297	XJUSRKADPARJRZ-UHFFFAOYSA-N	437.909	1.991	50	20	IDGD	
COc1cc(OC)c(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)N(C)C)cc1F	815750442	AWPATHLWACMHHQ-UHFFFAOYSA-N	440.453	1.175	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H]2CCO[C@H](c3ccccc3)O2)c1	816810230	DXHDVFNWZDFUPO-XLIONFOSSA-N	433.486	1.202	50	20	IDGD	
CCC[C@@H](C(=O)NNC(=O)c1cn(-c2ccccc2)nc1-c1ccccc1)S(N)(=O)=O	816815047	KZLFJRMEVHZDSB-SFHVURJKSA-N	441.513	1.758	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)COc2ccc(CO)cc2)c2ccccc2c1=O	816828362	CJLVFBDKCNCBJJ-UHFFFAOYSA-N	438.484	1.919	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN1c1ncnc2ccccc12)c1nnc(O)c2ccccc12	832811179	QTZBTVSVXUGFCK-QGZVFWFLSA-N	429.440	1.709	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)CCN2C[C@H](C)O[C@H](C)C2)c2ccccc2c1=O	912920202	YDCHBPNMLJGMPE-CALCHBBNSA-N	443.548	1.847	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)NCCS(=O)(=O)NCc2ccccc2)c1C	916385883	HJRDEHSGOCUIKT-KGENOOAVSA-N	444.557	1.894	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)NCCN2CCN(c3ccccc3)CC2)c1	916514942	UYJXDQQCUAITEJ-UHFFFAOYSA-N	425.533	1.835	50	20	IDGD	
Cc1nn([C@@H]2CCS(=O)(=O)C2)c(C)c1C=NNC(=O)Cn1c(C)nc2ccccc21	917026751	RDDYRRDITOCXSW-MRXNPFEDSA-N	428.518	1.668	50	20	IDGD	
O=C(CSc1nnc(-c2ccc3ccccc3c2)o1)NNC(=O)[C@H]1CCS(=O)(=O)C1	917625874	ZQXMLLJMHZOHAF-HNNXBMFYSA-N	446.510	1.564	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1nnn(-c2ccccc2)c1C	917679843	WNFIVZJJLHFZKB-UHFFFAOYSA-N	427.490	1.252	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)CCSc1nnnn1C	917922505	UMKRQHZBUGHMBB-SECBINFHSA-N	429.300	1.070	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NCCC(=O)N[C@@H](C)CC)c2ccccc2c1=O	918085300	QVULWBIQFIWIRQ-AWEZNQCLSA-N	430.509	1.445	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)N[C@H](c2ccc(F)cc2)[C@H]2CCCO2)c2ccccc2c1=O	918126114	GNFOGXZPDJTCMZ-QZTJIDSGSA-N	439.447	1.937	50	20	IDGD	
COc1cc(CNC(=O)NNC(=O)c2cc(-c3ccc(C)cc3)[nH]n2)ccc1OCCO	918229045	VJOLYCMPMCQGRG-UHFFFAOYSA-N	439.472	1.909	50	20	IDGD	
O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)NNC(=O)c1ccc[nH]1	919783424	WDNKGXZRACUWQA-UHFFFAOYSA-N	438.467	1.415	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3ccc(Cl)c(S(N)(=O)=O)c3)n[nH]2)cc1	920212323	BJVPVVOFCQGFEV-UHFFFAOYSA-N	449.876	1.461	50	20	IDGD	
O=C(CNC(=O)[C@@H]1c2ccccc2C(=O)N1Cc1ccccc1)NNC(=O)c1ccccc1	920250234	CFBXKWSVALOPSX-QFIPXVFZSA-N	442.475	1.961	50	20	IDGD	
O=C(COC(=O)c1ccc(N2NC(=O)CCC2=O)cc1)NNC(=O)c1ccc(Cl)cc1	920694896	YHCOWCWCYYOLII-UHFFFAOYSA-N	444.831	1.116	50	20	IDGD	
COC(=O)/C=C\c1cc(OC)c(OC)c(S(=O)(=O)NNC(=O)NC2CCCCC2)c1	921017785	SJPIJOBZIKSOHE-KTKRTIGZSA-N	441.506	1.715	50	20	IDGD	
CC(C)n1cc2c(n1)[C@@H](NC(=O)NNC(=O)C1CCN(c3ncccn3)CC1)CCC2	1320267374	INSXULRPJRAFNO-KRWDZBQOSA-N	426.525	1.878	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1csc(N2CCOCC2)n1)c1ccc([S@@](C)=O)cc1	1323013857	ARTSHUOXWHHYAA-XETJZTBLSA-N	437.547	1.422	50	20	IDGD	
COC(=O)COc1ccc(S(=O)(=O)NNC(=O)c2cncn2-c2ccccc2)cc1	1323470329	WTGOMDHAUQJCGU-UHFFFAOYSA-N	430.442	1.047	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1nn[nH]c1C(F)(F)F)CCO2	1779298994	SOESEFARTHCFEM-OAHLLOKOSA-N	435.479	1.119	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H]1CC=CCC1)C2	1779371051	ABYFKVGCEVTGDP-ZDWFVDTJSA-N	441.532	1.169	50	20	IDGD	
O=C([C@@H]1Cc2ccccc2N1)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781332640	CFYPLHPMSJTXEN-RLFYNMQTSA-N	426.286	1.544	50	20	IDGD	
CC(C)Oc1ccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)c(F)c1	1782065823	UASJTHRCJMZZNN-YLJYHZDGSA-N	428.888	1.656	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccnc1S)C2	1782167403	NDAUEMVDFPUVBZ-SPYBWZPUSA-N	427.954	1.752	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3c(C)nc4ccc(F)cn34)C2)C1	1782305194	XGBPVFWMJKDJIO-FOIQADDNSA-N	438.887	1.479	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc4cccnn4c3)C2)C1	1782381173	UAXAPOCMGQMXEG-IFXJQAMLSA-N	435.322	1.809	50	20	IDGD	
Cc1c(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](C)Br)C3)C2)nc2ccccn12	1783535062	XCKVUFUOHSSENN-ORAYPTAESA-N	435.322	1.870	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cccc(-n4cncn4)c3)CCO2)C1	1783535302	BHRQYBKYPZDEQS-KUHUBIRLSA-N	448.321	1.494	50	20	IDGD	
COC(=O)c1ccc(CC(=O)N2CCO[C@]3(CCN(C(=O)C(Cl)Cl)C3)C2)cc1	1783949933	HRYJKPRKZTWHPH-LJQANCHMSA-N	429.300	1.649	50	20	IDGD	
COC(=O)CCCCCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1784051569	TWHGUUDMASXKHQ-DOTOQJQBSA-N	437.306	1.630	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)CCCNC(=O)OC(C)(C)C)C2)C1	1785570177	HPFHIRGVVNRUNC-FOIQADDNSA-N	447.960	1.375	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H](C(=O)N2CC[C@@]3(CN(C(=O)[C@@H](F)Cl)CCO3)C2)C[C@H]2C[C@H]21	1785593888	GFSKOOVBZPFDGC-AUGJRDSBSA-N	445.919	1.749	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)C3(NC(=O)OC(C)(C)C)CC3)C2)C1	1785711540	FWXMHALZGZQCJR-IFXJQAMLSA-N	429.945	1.891	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)C3(NC(=O)OC(C)(C)C)CC3)C2)C1	1785714809	FTVYWQHOQMRDFH-IFXJQAMLSA-N	445.944	1.127	50	20	IDGD	
CN(C)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]21	1785758653	ZHVTYFGQUJDYBS-GGLFYADGSA-N	443.375	1.977	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)c1ncc(Cl)cn1	1785821047	NQUXSQRMYUGWNV-VGDYDELISA-N	435.681	1.414	50	20	IDGD	
CC1CCN(CC(=O)Nc2ccc(C3(NC(=O)c4ccc(B(O)O)cc4)CCC3)cc2)CC1	1786270230	DGDOKYXUPRNHMS-UHFFFAOYSA-N	449.360	1.846	50	20	IDGD	
Cc1nc(N)sc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]21	1786918376	ZRSNZNUGSYGPDS-UWCDFFNFSA-N	435.377	1.863	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3n[nH]c4c3CCCC4)[C@H]2C1	1787316308	SOVYHHFWRRLOJD-DUPGQFARSA-N	439.354	1.665	50	20	IDGD	
NC(=O)[C@@H](N)CCC(=O)Nc1ccc(C2(NC(=O)[C@@H](F)Br)CCC2)cc1	1788059929	BPWYDPHFDYFXRI-GXTWGEPZSA-N	429.290	1.404	50	20	IDGD	
CCC(=O)N[C@H](C)C(=O)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1	1788145236	UBJIRNRYJUQNQY-OAHLLOKOSA-N	437.305	1.029	50	20	IDGD	
Cn1cccc(C(=O)NC2(c3ccc(NC(=O)c4cccc(B(O)O)c4)cc3)CCC2)c1=O	1788145321	YCYWLTGDKJTLRE-UHFFFAOYSA-N	445.284	1.127	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nnc4cc(C)nn4c3C)C[C@@H]21	1789859677	KNGARXXMJTVIST-JONQDZQNSA-N	434.928	1.352	50	20	IDGD	
CC(C)Oc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](O)CCl)C[C@@H]32)c(F)c1	1790273798	BWJFCQVSNODXAX-FDARSICLSA-N	442.915	1.806	50	20	IDGD	
CCOC(=O)C1(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)CBr)C[C@@H]32)CC1	1790719381	NMAADYZOKJJFCJ-QPSCCSFWSA-N	445.354	1.340	50	20	IDGD	
Cc1ccc(CCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]32)cc1	1790934284	JOJBGGAIJBINQG-ACRUOGEOSA-N	444.576	1.280	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CC[S@](=O)CC)C[C@@H]21	1790960733	RCFSROXRDIAOCY-YCTKJRKISA-N	437.400	1.298	50	20	IDGD	
Cc1nc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]3C2)ccc1F	1791056862	GTTBSSZWTTWDMJ-LESCFKLSSA-N	428.302	1.906	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(Cl)cnc3O)C[C@@H]21	1791250252	CCLVAGMCNAYUDW-HPEDKQMDSA-N	432.304	1.288	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(OC)ccc3F)C[C@@H]21	1791256953	ZCSSZGVPMSFBSI-PTOXDTDZSA-N	428.888	1.681	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCc1cccc(C#N)c1	1792941793	ZIXXECAMCFYDHY-ACDBMABISA-N	425.533	1.502	50	20	IDGD	
Cc1ccc2[nH]cc(CC(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)c3ccc(B(O)O)cc3)C4)c2c1	1794233940	UCAHBZOLHXZWEF-WKCHPHFGSA-N	445.328	1.651	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2)c1ccc(Br)nc1F	1794241336	NZARDMSAQXNFHQ-IWXIMVSXSA-N	438.656	1.721	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1n[nH]c(C2CC2)c1F	1794483812	XWZKAIYCFIZHOZ-MGAJZRQESA-N	429.290	1.413	50	20	IDGD	
Cc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCBr)n(C(F)F)n1	1795114857	FOFNZJLCOSHLBT-GNXNZQSNSA-N	435.269	1.575	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1n[nH]c2c1CS(=O)(=O)C2	1796384658	MISKMYSVYMVRBK-UCSBCBTLSA-N	449.360	1.326	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnccc1F	1796452508	YDMAENFPICBMSW-SSJPOKSSSA-N	426.452	1.607	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1=NN(c2ccccc2)C(=O)C1	1796480650	DCGINZXJMULGHR-MVWRLGRASA-N	432.908	1.386	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C#Cc1ccccc1)C2	1796890011	UFVHTGDCOBHQLB-WRVZLUGYSA-N	431.496	1.810	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccc(NC(C)=O)cc1	1797233154	NVDHPUHBPBONOE-WQDJSCAQSA-N	437.924	1.031	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1ccc2cncn2c1	1797529749	DARRGFGSDOEODM-AYRXBEOTSA-N	425.258	1.228	50	20	IDGD	
COC(=O)c1ccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)C(Cl)Cl)C3)s1	1799046727	VAHXNFZMGMKJAK-WDAIWFPHSA-N	435.329	1.471	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1CCC3(CC1)OCCO3)C2)[C@@H](F)Br	1799347245	NJTZRKYUZKGDPE-LXTVHRRPSA-N	449.317	1.200	50	20	IDGD	
COc1cc(F)ccc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Br	1799351991	HCJHMEPRXIJOEV-OWLDWWDNSA-N	433.249	1.728	50	20	IDGD	
Cc1n[nH]cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C#N)=C/c1ccc(F)cc1F	1800333260	ABNNAFBXICAJFW-QYFXKUKHSA-N	441.438	1.807	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1Cc3ccccc3CN1)C2	1800758386	YGHZLLOGVKRVGA-RPCVNMKUSA-N	436.350	1.074	50	20	IDGD	
CC[C@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCc1ccc(O)nn1)C2	1801806714	NIVSRYCCBBUZAF-XGUBFFRZSA-N	425.327	1.927	50	20	IDGD	
CCOC(=O)N1CCC(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)C(Cl)Cl)C3)CC1	1801989637	BBTMIDUQQCAICD-BTTYYORXSA-N	436.336	1.248	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(Cl)cc3nn[nH]c13)C2	1802337242	SWRYINYAQZIBTQ-BTTYYORXSA-N	447.927	1.236	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc3nn[nH]c3c2)[C@H]1c1cccnc1)[C@H](O)CCl	1803148502	RDFZBEWJTMVHRJ-QGTPRVQTSA-N	428.880	1.272	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)CNC(=O)c2cccnc2)[C@H]1c1cccnc1	1804368861	HOLKBLVWDUTSBA-IMFGXOCKSA-N	443.935	1.930	50	20	IDGD	
Cn1cccc1C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1	1805351689	FSSZOYLURLRIND-UZLBHIALSA-N	447.499	1.052	50	20	IDGD	
Cc1ccc(CC(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)o1	1807373960	GVHMWWOZVKJANY-WMZHIEFXSA-N	447.300	1.225	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)c3cnccc3Cl)CC2)C1	1809971277	QHNQIFZJUGUXQY-UHFFFAOYSA-N	441.724	1.573	50	20	IDGD	
O=C(c1cc(O)nc(O)n1)N1CCCC2(CCN(C(=O)[C@H](F)Br)CC2)C1	1810888635	GUOMCVFYCFKTRC-LBPRGKRZSA-N	431.262	1.423	50	20	IDGD	
O=C(COc1ccc(O)nn1)NC[C@@H]1CCN(C(=O)C(Cl)Cl)[C@@H]1c1cccnc1	1812353459	QBGRREZDYFXNDK-BLLLJJGKSA-N	440.287	1.466	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)[C@](C)(O)C(F)(F)F)[C@@H]1c1cccnc1	1813028402	PWHBMALYDZPZAY-ZJOBFFGXSA-N	437.846	1.655	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)CCN2CCOC2=O)[C@@H]1c1cccnc1	1813029954	CDRRTIDSBDANDD-SOLBZPMBSA-N	438.912	1.184	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)CC(F)(F)C(=O)O)[C@H]1c1cccnc1	1813031101	OAQKRKSPNQDLAW-YDHLFZDLSA-N	433.839	1.451	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)C2CCC(O)CC2)[C@@H]1c1cccnc1	1813196909	BKAAIJPPXKEIDI-BBLWZBATSA-N	445.564	1.012	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)Cc2cccs2)[nH]n1)c1ccc(B(O)O)cc1	1817471616	TXCXIMBPMDQCON-GOSISDBHSA-N	438.318	1.700	50	20	IDGD	
Cc1nc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)cs1	1817473146	INNYPBYBURBWQC-KRWDZBQOSA-N	439.306	1.474	50	20	IDGD	
Cc1ncc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2cccc(B(O)O)c2)CC3)s1	1817889838	TYJNKCFDGPIUNA-CYBMUJFWSA-N	442.331	1.127	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1)[C@@H]1Cc2ccccc2CN1	1817997647	VCJXRMOOJWPYLG-OKZBNKHCSA-N	431.924	1.716	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1)c1ccc2c(c1)CNC2=O	1819201782	JIRQFHXAHXVQKF-HOTGVXAUSA-N	431.880	1.559	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2c[nH]c(=O)cn2)n[nH]1	1820242059	IPHBJOXDXWVQIT-ZWNOBZJWSA-N	437.298	1.830	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)COc2cccnn2)[nH]n1)[C@@H](F)Br	1820937840	RLHIKNOQEYYUGA-IAQYHMDHSA-N	441.261	1.961	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@H]1CCc2nc(NC(=O)c3c[nH]c(=O)cn3)sc2C1	1821464137	XGZLZRXKSZUOQJ-IUCAKERBSA-N	440.323	1.483	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CN1CCCC1=O)CC2	1822863536	MYPDHOGAPPLXIO-DYZYQPBXSA-N	433.361	1.914	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)N1CCC([C@H]2CCCCN2C(=O)[C@H](O)CCl)CC1	1824186040	NTIALDLKPFQDLM-HZPDHXFCSA-N	431.961	1.731	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](C)CC(N)=O)CC2	1825441376	UMIPUFHUNHTTKQ-GUBZILKMSA-N	431.356	1.740	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CN1CCCCC1=O)CC2	1825647044	ICYCRCTYALEERX-QWRGUYRKSA-N	443.367	1.851	50	20	IDGD	
Cc1cn(CC(=O)N[C@@H]2CCc3nc(NC(=O)C(Cl)Cl)sc3C2)c(=O)nc1O	1826107300	ZTSZWYHCXXSLMJ-MRVPVSSYSA-N	446.316	1.130	50	20	IDGD	
CCc1oncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1	1826170697	HEDRYNCVJSJORS-HXUWFJFHSA-N	439.321	1.464	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc3n(n2)CCNC3=O)CC1	1826197247	HJFUKECRGZKDJX-WBVHZDCISA-N	435.956	1.877	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(Cl)cnc3OC)CCO2)C1	1829586213	DLDDUYLVTGQNHX-HNAYVOBHSA-N	446.331	1.831	50	20	IDGD	
Cc1cc(Cl)ccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1	1830117104	XCMOQTHGLRFQIB-LPHOPBHVSA-N	431.316	1.318	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CC[C@H](N)C(N)=O)CC1	1830315781	DTKMGEUIDMRAJD-KHYOSLBOSA-N	435.396	1.435	50	20	IDGD	
O=C(CN1CCOC1=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H](F)Br)CC1	1830376236	KSHTZHDFQXHMAZ-ZFWWWQNUSA-N	434.306	1.749	50	20	IDGD	
Cc1csc(CCC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)c1	1830726831	UEVDOCQKHKVBCQ-APWZRJJASA-N	430.954	1.045	50	20	IDGD	
Cc1nccn1[C@H](C)C(=O)N1CCC([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1	1831877266	VXPKESCJVDVYJA-YLJYHZDGSA-N	446.596	1.745	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3cn[nH]c3)CCO2)C1	1832942177	IVEHGUMGCKJILT-ROUUACIJSA-N	433.336	1.035	50	20	IDGD	
O=C([C@@H](O)CCl)N1CCC(N2CCC(NC(=O)C3(c4ccccc4)CC3)CC2)CC1	1833090517	KDTBLVBHUICKLH-FQEVSTJZSA-N	433.980	1.890	50	20	IDGD	
C[C@@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1833264865	MLNAYERZVFLNOD-SWLSCSKDSA-N	438.794	1.189	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3c[nH]c4nccc-4c3)CC2)CC1)[C@H](O)CCl	1833310280	GCHYTGRZYTZOIT-GOSISDBHSA-N	433.940	1.299	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3snnc3C3CC3)CC2)CC1)[C@@H](O)CCl	1833310742	ZLEOFYAMOGUFFZ-HNNXBMFYSA-N	441.985	1.200	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)c3cc(O)nc(O)n3)CC2)CC1	1833532319	KUOYRDIJGPXRNL-OAHLLOKOSA-N	439.944	1.481	50	20	IDGD	
CC(C)c1nc(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)co1	1833925442	ZWFLCTNQGKUFQV-KRWDZBQOSA-N	426.945	1.583	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3nccn3C)CC2)CC1	1834271019	OVPNFLQMQUJHNC-CYBMUJFWSA-N	426.359	1.389	50	20	IDGD	
CCc1oncc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)CBr)C2)C1	1834514383	WTJNSAKMZIJCOL-UGSOOPFHSA-N	444.326	1.338	50	20	IDGD	
O=C(CCc1ccco1)N1CCOC[C@]2(C1)CN(C(=O)CCBr)CCO2	1834819149	HXSFPMRZSFXUDV-SFHVURJKSA-N	429.311	1.454	50	20	IDGD	
CCCC(=O)N[C@@H](C)C(=O)NC1CCN(C2CCN(C(=O)C(Cl)Cl)CC2)CC1	1835820604	BHAFXDGCUKTEJC-ZDUSSCGKSA-N	435.396	1.667	50	20	IDGD	
C[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1)n1cccc1C=O	1835951455	FLHYNIROINRMHR-IERDGZPVSA-N	439.940	1.583	50	20	IDGD	
CCOC(=O)C(C)(C)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836720121	JLYHZEVXVYSCSU-INIZCTEOSA-N	432.945	1.174	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cn4ncccc4n3)CC2)CC1	1838245166	XHDIJBARIDZJDE-KRWDZBQOSA-N	449.939	1.595	50	20	IDGD	
COc1cc(C#N)cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)c1	1838581847	SEJQPCHQFRCRSV-LPHOPBHVSA-N	425.844	1.171	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(OC(F)F)cn3)C2)C1	1839142994	IDTSGVIXTLAUJJ-AUUYWEPGSA-N	447.866	1.770	50	20	IDGD	
Cc1ccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)cc1[N+](=O)[O-]	1839189296	VDJWKYCFLMGOBR-IEBWSBKVSA-N	443.859	1.437	50	20	IDGD	
CCOC(=O)c1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)cc1	1839445529	XQIOHFKAOSRUCB-OXQOHEQNSA-N	442.871	1.468	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3cnc4[nH]ccc4c3)CCO2)C1	1840081504	RJZDTKMRZOGOLS-PGRDOPGGSA-N	448.951	1.969	50	20	IDGD	
COc1cccc(OC)c1C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840188831	FUPXHAPGNJYXSI-IBGZPJMESA-N	447.315	1.578	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCCn3ccnc3)CCO2)C1	1840383265	NWWDLWLGNJIMLF-PXNSSMCTSA-N	426.945	1.527	50	20	IDGD	
O=C(CCCn1cccc1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1840461635	NJZABUPZPSCFEE-AEFFLSMTSA-N	446.317	1.415	50	20	IDGD	
CN(C)C(=O)NCC(=O)N1CCCC12CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)C2	1841135448	NCGJFETZNJUKBM-OVCLIPMQSA-N	431.443	1.346	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@H](CCN)NC(=O)OC(C)(C)C)C2	1841667440	KXLKASFQWYDWAB-HUUCEWRRSA-N	430.977	1.839	50	20	IDGD	
COc1cc(CC(=O)N2CCCC23CN(C(=O)[C@H](O)CCl)C3)cc(OC)c1OC	1841784168	XPLSSGBYTASMFJ-CQSZACIVSA-N	426.897	1.058	50	20	IDGD	
O=C(Cc1ccc(C(F)(F)F)cc1)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843010868	NYKLDPNUPPHZIH-UHFFFAOYSA-N	446.234	1.445	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1ccc3cc(O)ccc3n1)C2	1844264068	ANDNWFHGOMZTPP-UHFFFAOYSA-N	446.467	1.070	50	20	IDGD	
Cc1cc2cccc(C(=O)N3CC4(CCCN4C(=O)c4cnccc4C(=O)NN)C3)c2[nH]1	1844264412	PTHLNFXSRAFOBF-UHFFFAOYSA-N	432.484	1.606	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)[C@H](C)Oc2ccccc2)C1	1846059062	SJYZWWALBRQOPO-XUANBZSPSA-N	437.500	1.791	50	20	IDGD	
O=C(Cn1c(=O)ccn(Cc2ccccc2)c1=O)NNC(=O)c1ccc(Cl)cc1Cl	15020135	CIANVQAEQXTVJH-UHFFFAOYSA-N	447.278	1.826	50	20	IDGD	
CC(C)C[C@H](C(=O)NNC(=O)COc1ccc(C#N)cc1)N1C(=O)[C@H]2CC=CC[C@@H]2C1=O	15888882	QOAXGVSECGCQSN-GBESFXJTSA-N	438.484	1.450	50	20	IDGD	
CSCC[C@@H](C(=O)NNC(=O)COc1cccc(C)c1)N1C(=O)c2ccccc2C1=O	16005559	YJKLBLIIFFHWAV-SFHVURJKSA-N	441.509	1.939	50	20	IDGD	
COc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NNC(=O)COc2cc(C)cc(C)c2)cc1	725945680	OPBUNFONCLXOPA-HNNXBMFYSA-N	435.502	1.205	50	20	IDGD	
COc1ccccc1N1CC[C@H](CNC(=O)NNC(=O)CNC(=O)c2cccs2)C1	726252566	IRNMZCOXZVLYIT-CQSZACIVSA-N	431.518	1.343	50	20	IDGD	
CCCC(=O)N1CSC[C@@H]1C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	727294194	TWEGYJIIKNXLLP-GOSISDBHSA-N	433.578	1.048	50	20	IDGD	
CC(C)c1ncc(Cl)c(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)n1	728336299	JMVGFKMUWIHJSS-CQSZACIVSA-N	434.836	1.398	50	20	IDGD	
CC(C)(C)CC(=O)NNC(=O)CCNS(=O)(=O)c1ccc(OC(F)(F)F)cc1	728608085	SNOUOYJQEFAPIH-UHFFFAOYSA-N	425.429	1.837	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2ccccc2N(C)C(=O)C2CC2)n1	728729375	OWDNHGDLMGQKQV-UHFFFAOYSA-N	430.486	1.371	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Cc2cccnc2)cc1S(=O)(=O)Cc1cc(C)no1	728850085	IAYZAWZRJDYQKK-UHFFFAOYSA-N	444.469	1.364	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc(C(F)(F)F)ccc1F)C1CCN(c2ncccn2)CC1	728854147	NOCQUANZOXOETR-UHFFFAOYSA-N	447.414	1.861	50	20	IDGD	
CC(=NNC(=O)Cn1ccc2ccccc21)c1ccc(S(=O)(=O)NCCC(=O)O)cc1	729638372	INUUGEKWDVWIOQ-UHFFFAOYSA-N	442.497	1.935	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)NCC(=O)NCCN2CCOCC2)c(C)n1CCC(C)C	732157012	RWVRDSFWLNMKQB-KGENOOAVSA-N	429.565	1.623	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)c2csc(I)c2)C[C@@H](C)O1	732263237	LIFQPYONQZNLRC-NXEZZACHSA-N	437.303	1.613	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)NCCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1ccccc1	732453385	DBRCUPISMRHSBT-KRWDZBQOSA-N	449.489	1.397	50	20	IDGD	
CCN(CC)c1ccc(C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)cc1	735117899	ILZSACREYVGCCV-UHFFFAOYSA-N	446.577	1.621	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)c2csc(S(=O)(=O)N3CCc4ccccc4C3)c2)cn1	735444215	HEBXSXCUQQMREN-UHFFFAOYSA-N	445.526	1.303	50	20	IDGD	
CN(C)c1cccc(-c2nnc(SCC(=O)NNC(=O)c3ccc(Cl)cc3)n2N)c1	735980644	GWNUUYBIAGBUMI-UHFFFAOYSA-N	445.936	1.932	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)c1cccc(S(=O)(=O)Cc2ccccc2)c1	740852534	AQMBCBKEQBNGCY-UHFFFAOYSA-N	431.514	1.726	50	20	IDGD	
CN(CCCC(=O)NNC(=O)Cc1ccccc1F)C1=NS(=O)(=O)c2ccccc21	741924977	LMMIMXGOVXVYGC-UHFFFAOYSA-N	432.477	1.377	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)C(=O)NCc1ccc(F)cc1	742037218	UGOONTQFEKAKMW-LLVKDONJSA-N	438.253	1.819	50	20	IDGD	
CCO[C@H](C)c1noc(CN2CCN(C(=O)NNC(=O)c3ccc(C#N)cc3)CC2)n1	743567956	DBFCFPZFQXKOKW-CQSZACIVSA-N	427.465	1.211	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)CCCNC(=O)NC2CCCCC2)cc1	743830176	PFUXCBQVTARIDD-UHFFFAOYSA-N	439.538	1.655	50	20	IDGD	
CCO[C@@H](C)c1nc(CN2CCN([C@H](C)C(=O)NNC(=O)CC(C)C)CC2)cs1	744412984	LOYXHCRVQYUQQX-CVEARBPZSA-N	425.599	1.940	50	20	IDGD	
Cc1ccc(N2C[C@H](C(=O)OCC(=O)NNC(=O)c3cccc(C#N)c3)CC2=O)cc1F	744496531	BAPRYBXMNXGQHG-MRXNPFEDSA-N	438.415	1.363	50	20	IDGD	
Cc1c(/C=C(\C#N)C(=O)O[C@H](C)C(=O)N2CCN(c3ncccn3)CC2)cc(C#N)n1C	744632864	QGGCZIOIXGWPND-YCPFAOKUSA-N	433.472	1.183	50	20	IDGD	
Cc1cc(C)cc(N2CC[C@H](C(=O)OCC(=O)NNC(=O)c3cccc(C#N)c3)C2=O)c1	744848432	BZPXBZYQASJHER-IBGZPJMESA-N	434.452	1.532	50	20	IDGD	
CC(C)C(=O)Nc1cccc(F)c1C(=O)OCC(=O)NNC(=O)c1cccc(C#N)c1	745033042	CYDFANYOEHDISN-UHFFFAOYSA-N	426.404	1.910	50	20	IDGD	
CN(C)[C@H](CNC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)c1cccc(F)c1	745291526	FCJZIEJCQOAXMX-QGZVFWFLSA-N	437.497	1.868	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)c1ccc(Cl)cc1Cl)N1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O	746100303	JIWKZWCYHDYYLK-AJVHJNHVSA-N	426.256	1.305	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCN(C2=NCC(C)(C)S2)CC1	746461029	UHXQKVZWVSVIFB-UHFFFAOYSA-N	439.969	1.609	50	20	IDGD	
COC(=O)c1ccsc1N1CC[C@H](NC(=O)NNC(=O)Cc2ccccc2F)C1=O	746782940	ZQWHRYOKQWQTDZ-AWEZNQCLSA-N	434.449	1.352	50	20	IDGD	
C[C@@]1(c2ccc3ccccc3c2)NC(=O)N(CC(=O)NNC(=O)Cc2ccncc2)C1=O	747324852	MLAHWRWDAYVQMS-QHCPKHFHSA-N	431.452	1.392	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)N[C@H]2CCN(c3cc(OC)cc(OC)c3)C2)c1	748661622	MHRTZPJJMRPOKJ-HNNXBMFYSA-N	444.488	1.944	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@@H]2SCCc3ccccc32)c1	749612052	KNFUYGGCFFWTLX-SFHVURJKSA-N	448.570	1.912	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)N[C@H]2CCN(c3cccc(Cl)c3)C2=O)nc2ccccc21	750669326	AJINIOQYZMZEFS-INIZCTEOSA-N	440.891	1.905	50	20	IDGD	
CCN(CC)C(=O)[C@@H](NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)c1ccccc1	750737086	KAMQBIOOWQIZSK-IBGZPJMESA-N	432.546	1.781	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)n1	752507226	MOHIOXADWMHDQS-UHFFFAOYSA-N	429.440	1.867	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cccc(OC(C)C)n3)CC2)cc1	755180939	TUIYPXPLESGXJJ-UHFFFAOYSA-N	425.533	1.756	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)c1cccc(I)c1O	755437357	CRCYQODLUAAXPQ-UHFFFAOYSA-N	436.209	1.648	50	20	IDGD	
CNC(=O)c1cccc(NC(=O)NNC(=O)c2cc(-c3ccc(OC)c(OC)c3)[nH]n2)c1	755514451	LUHHUMBIZNYAGE-UHFFFAOYSA-N	438.444	1.920	50	20	IDGD	
C[C@H]1CCCN(CC(=O)NNC(=O)c2cccc(C#N)c2)[C@@H]1CNC(=O)OC(C)(C)C	756548640	CAKVVUZOKQDLJF-MAUKXSAKSA-N	429.521	1.944	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)Nc1cc(S(=O)(=O)N(C)C)ccc1F	756687417	ZMHCTQHGNCHPCS-UHFFFAOYSA-N	434.453	1.499	50	20	IDGD	
CS(=O)(=O)Nc1ccc(NC(=O)NNC(=O)COc2ccc(C#N)cc2)cc1Cl	756708968	VBVICFRTQWQJLA-UHFFFAOYSA-N	437.865	1.815	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2cc(-c3ccc(C)cc3)[nH]n2)cc1-n1cnnn1	756747912	SNABSKRYJMKQJO-UHFFFAOYSA-N	433.432	1.836	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)Nc2ccc(OC)c(-n3cnnn3)c2)n[nH]1	756748085	WCEMDJKRGCUKPJ-UHFFFAOYSA-N	449.431	1.536	50	20	IDGD	
COc1ccc(-c2ccccc2)cc1C=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O	756823454	MPCHVGOKBRKZEW-UHFFFAOYSA-N	439.497	1.397	50	20	IDGD	
O=C(NCCCN(C1CC1)S(=O)(=O)c1cccc(F)c1)NNC(=O)C1CCCC1	757687513	IJYZGCCEKRGJBG-UHFFFAOYSA-N	426.514	1.890	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)Cc2c(C)nn(-c3ccccc3)c2C)n1	761957041	OWDISYLQPPTEPK-UHFFFAOYSA-N	441.513	1.730	50	20	IDGD	
COc1ccc(CN2CC[C@H](NC(=O)NNC(=O)CSc3ccccc3O)C2=O)cc1	763512998	LEMLXYSLSPEKPR-INIZCTEOSA-N	444.513	1.624	50	20	IDGD	
CN1CCN(c2ccccc2NC(=O)C(=O)NNC(=O)c2cc3ccccc3cc2O)CC1	763517322	GMKASDOUSFFSJI-UHFFFAOYSA-N	447.495	1.697	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccc3nc(C)cn3c2)cc(OC)c1OC	763540135	RSINVSAQKGAVOL-UHFFFAOYSA-N	427.417	1.068	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3nc(C(F)F)[nH]c3c2)cc1OC	763543118	LNHUBVQCVAQRGY-UHFFFAOYSA-N	433.371	1.917	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)Nc1ccc(Oc2cccnc2)nc1	763569457	AAYFUMQMIFGXNE-QGZVFWFLSA-N	435.396	1.195	50	20	IDGD	
CC(=O)Nc1c(C)ccc(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1C	763575572	XPYWACDDGKWWNV-QGZVFWFLSA-N	426.429	1.188	50	20	IDGD	
CCN1CCN(Cc2ccc(NC(=O)C(=O)NNC(=O)c3cc(C)oc3C)cc2)CC1	763576352	KMOZINUGPPAAGW-UHFFFAOYSA-N	427.505	1.434	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)C(=O)Nc1cccc(Cl)c1-n1cccn1	763679787	CWQFLZDVASPAJX-UHFFFAOYSA-N	431.811	1.830	50	20	IDGD	
Cc1nnc(-c2ccc(NC(=O)C(=O)NNC(=O)COc3ccc(Cl)cc3)cc2)o1	763694381	GLSZUAKJGQTHAK-UHFFFAOYSA-N	429.820	1.863	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccccc1-n1c(C)cnc1O	763716378	FRSSPVOCROIOTA-UHFFFAOYSA-N	437.456	1.614	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H]2C[C@]23CCOC3)c1	763727301	BVCBBDQECSUNMA-IERDGZPVSA-N	445.497	1.684	50	20	IDGD	
CCN(c1ccc(NC(=O)C(=O)NNC(=O)c2nnc(O)c3ccccc23)cc1)C(C)C	763790439	JPCSNRVUVJJGKS-UHFFFAOYSA-N	436.472	1.970	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)C(=O)Nc2cccnc2-c2ccccc2)c2ccccc2c1=O	763791857	ZLPOTNUBILMUEM-UHFFFAOYSA-N	442.435	1.395	50	20	IDGD	
Cc1cc(C)cc(-n2nc(NC(=O)C(=O)NNC(=O)COc3ccccc3C#N)cc2C)c1	763806931	JHBGEOBNWPOYPP-UHFFFAOYSA-N	446.467	1.834	50	20	IDGD	
CCCN1C(=O)CCc2cc(NC(=O)C(=O)NNC(=O)COc3ccccc3C#N)ccc21	763807598	OKEYLYCTQFGIQE-UHFFFAOYSA-N	449.467	1.412	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cc3c(cc2F)CCC(=O)N3)c1C	763850729	PBOQBEJCLAFLQS-ZDUSSCGKSA-N	442.447	1.881	50	20	IDGD	
Cc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1cccc(C)c1C	763850796	ACAJPLCZMNODNT-MRXNPFEDSA-N	440.500	1.867	50	20	IDGD	
COC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)Cc2c[nH]c3ccccc23)cc1F	763865255	NDPQDTDLDZVCRE-UHFFFAOYSA-N	427.392	1.814	50	20	IDGD	
CCc1ncc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(Br)c2)cn1	763882854	MDGRCJBPRFPNDW-SNVBAGLBSA-N	436.266	1.355	50	20	IDGD	
COC(=O)c1ccc(C)c(NC(=O)C(=O)NNC(=O)c2ccc(OC(C)C)c(OC)c2)c1	763922296	UZYFHJLFALNXOY-UHFFFAOYSA-N	443.456	1.977	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)C(=O)Nc1ccc2oc(C3CC3)nc2c1	763922356	WESCRCVJQRFJMK-UHFFFAOYSA-N	432.400	1.081	50	20	IDGD	
CCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)on2)c(C)c1	764003333	GALYJVMXKPQGEF-UHFFFAOYSA-N	435.440	1.799	50	20	IDGD	
COC(=O)c1c(C2CC2)csc1NC(=O)C(=O)NNC(=O)c1ccc2c(c1)OCCO2	764004256	NXYCTCSMDAOCHP-UHFFFAOYSA-N	445.453	1.583	50	20	IDGD	
COC(=O)c1cc(C(C)C)ccc1NC(=O)C(=O)NNC(=O)Cc1ccccc1OC	764136797	TVVSGYRFNNQDGU-UHFFFAOYSA-N	427.457	1.934	50	20	IDGD	
CS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)CCc2ccccc2)cc1Cl	764193267	YKTSDJNJXDFRAG-UHFFFAOYSA-N	438.893	1.430	50	20	IDGD	
Cc1ccc(Br)c(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1	764199280	WHNLYHVIHVSUBP-MRXNPFEDSA-N	449.257	1.902	50	20	IDGD	
CCOCC(=O)NNC(=O)C(=O)Nc1c(-c2ccc(Br)cc2)c(C)nn1C	764318535	ANIUPDQSWHYQHG-UHFFFAOYSA-N	438.282	1.280	50	20	IDGD	
CCc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](CC)c2ccccc2)cc1S(N)(=O)=O	764329436	MOHWGZNGPGPIHH-INIZCTEOSA-N	432.502	1.176	50	20	IDGD	
COc1cc(F)c(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1OC	764351039	OFNHXHNYJVVCLP-UHFFFAOYSA-N	427.392	1.428	50	20	IDGD	
Cc1nc(-c2ccc(S(=O)(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)s2)cs1	765033549	JWJRUULNZQZYQX-UHFFFAOYSA-N	447.527	1.779	50	20	IDGD	
Cc1ccsc1S(=O)(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	765119009	KGHVFUPIBSRVLU-UHFFFAOYSA-N	442.994	1.837	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3ccc(Br)nc3)CC2)cc1	765747810	HJGPLYSUPYVKNW-UHFFFAOYSA-N	446.349	1.731	50	20	IDGD	
Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	766240674	FWKIWJPKLFNAMF-UHFFFAOYSA-N	435.462	1.928	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)/C(=C\c1ccccc1)n1nnnc1C	767261141	CDTKLGLFPAMFPD-XDHOZWIPSA-N	434.456	1.221	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3c[nH]nc3-c3cccnc3)n[nH]2)cc1OC	768275463	CDCRXRHEYHTEGG-UHFFFAOYSA-N	433.428	1.954	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)COc3ccc(C(N)=O)cc3)n[nH]2)cc1OC	768275721	DWZHCXHFQXFBAX-UHFFFAOYSA-N	439.428	1.033	50	20	IDGD	
COc1ccc(NNC(=O)C[C@@H](C)/N=C2/NS(=O)(=O)c3ccccc32)c([N+](=O)[O-])c1	768338122	GHSCFFMLCRABLP-LLVKDONJSA-N	433.446	1.564	50	20	IDGD	
CCn1c(=O)n(CC)c2nc(NC(=O)CCC(=O)NNc3nc4ccccc4[nH]3)ccc21	768507640	UZHNHKULYVSZPP-UHFFFAOYSA-N	436.476	1.976	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)c1sccc1S(=O)(=O)N(C)C	768612510	NVNDWLHVPFMRRP-UHFFFAOYSA-N	433.533	1.167	50	20	IDGD	
Cc1noc(C)c1S(=O)(=O)NCC(=O)NNC(=O)[C@@H](C)Oc1ccc2ccccc2c1	769104941	JWYOUIDTWCVVSI-CQSZACIVSA-N	446.485	1.338	50	20	IDGD	
C[C@@]1(c2cccc(C(=O)NNc3c(F)cc(C(=O)NC4CC4)cc3F)c2)NC(=O)NC1=O	769249608	DQAMXJIWLWEDHE-NRFANRHFSA-N	443.410	1.669	50	20	IDGD	
O=C(NCc1nc(COc2ccccc2)n[nH]1)NNC(=O)c1cc(Br)c[nH]1	771379086	UVOSWFCQOOWFET-UHFFFAOYSA-N	434.254	1.619	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)N[C@@H]2CC(=O)N(c3c(F)cccc3F)C2)cc1C	771433721	JKZBXOVOLNRUOT-CQSZACIVSA-N	445.426	1.656	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)[C@@H]2CCCc3sccc32)CC1	771579606	VVYAVQHBDFLEAL-OAHLLOKOSA-N	435.575	1.642	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2ccn(Cc3ccccc3)n2)ccc1Cl	771883547	JZFKVLRDTKZHNX-UHFFFAOYSA-N	433.877	1.307	50	20	IDGD	
O=C(CCCC(=O)c1ccc(Br)cc1)NNC(=O)N[C@@H]1CCS(=O)(=O)C1	772145044	HNRZZBRPXLZLJJ-CYBMUJFWSA-N	446.323	1.320	50	20	IDGD	
C#CCNS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)c1	772953901	KUVCYDXTEUJWJI-ZDUSSCGKSA-N	435.889	1.480	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2ccc(-c3cncnc3)cc2F)ccc1Cl	773741728	XHOURNFYLARCMB-UHFFFAOYSA-N	449.851	1.658	50	20	IDGD	
O=C(NNc1ccc(C(F)(F)F)cc1)C(=O)Nc1ccn(CCN2CCOCC2)n1	773764106	WJNANOHJJBJGRW-UHFFFAOYSA-N	426.399	1.316	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)[C@@H]1CCN(Cc2ccccc2)C1	779413644	UDXXBQIZRFRKHG-FUHWJXTLSA-N	448.527	1.788	50	20	IDGD	
CCO[C@@H]1C[C@](NC(=O)OC(C)(C)C)(C(=O)NNC(=S)NCCSC)C1(C)C	780988192	WBWPBNHPJWLKAF-XIKOKIGWSA-N	434.628	1.943	50	20	IDGD	
CSc1ccc(C)c(NC(=O)C(=O)NNC(=O)c2csc(N3CCOCC3)n2)c1	782897186	LZWMMHNAWOLHQF-UHFFFAOYSA-N	435.531	1.410	50	20	IDGD	
CCOC(=O)[C@@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNc2ccc(F)cc2F)cc1	783344512	AWEDGTSYSJERHZ-LLVKDONJSA-N	434.399	1.728	50	20	IDGD	
CCn1c2ccccc2c2cc(NC(=O)C(=O)NN[C@]3(C)CCS(=O)(=O)C3)ccc21	783426959	KUTPIIPZEPYFDJ-OAQYLSRUSA-N	428.514	1.951	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2cccc([N+](=O)[O-])c2C)c(OCC(=O)N(C)C)c1	784354058	XZJJXIHLQUWLSR-UHFFFAOYSA-N	429.433	1.760	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)Cc1cc2c(cc1Br)OCCO2	784459908	RCRLAMJZIUCXRY-UHFFFAOYSA-N	444.282	1.435	50	20	IDGD	
CNS(=O)(=O)c1cccc(NC(=O)C(=O)NNc2ccnc(Br)c2)c1C	784837199	GCDWPSJSAWWEOF-UHFFFAOYSA-N	442.295	1.142	50	20	IDGD	
CC(C)(C)NC(=O)c1ccc(NC(=O)C(=O)NNc2cccc(S(C)(=O)=O)c2)cc1	784839720	PBCOXYGKPKFXOX-UHFFFAOYSA-N	432.502	1.700	50	20	IDGD	
O=C(NNc1cc(Cl)ccn1)C(=O)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1	784855993	AANMMGCDGJFODG-UHFFFAOYSA-N	437.909	1.991	50	20	IDGD	
CS(=O)(=O)c1ccc(Oc2ccc(NC(=O)C(=O)NNc3ncc(F)cn3)cc2)cc1	784955182	DNTSAVBTKTXDLD-UHFFFAOYSA-N	445.432	1.893	50	20	IDGD	
O=C(NNc1ncc(F)cn1)C(=O)Nc1ccc(I)cc1Cl	784958454	ZLSULAKPCCUHRZ-UHFFFAOYSA-N	435.584	1.956	50	20	IDGD	
Cc1cc2ccc(Cl)cc2nc1NNC(=O)C(=O)Nc1ccn(CC(=O)N(C)C)n1	785164719	ITLOCXPAYOYYPX-UHFFFAOYSA-N	429.868	1.563	50	20	IDGD	
O=C(NNc1ccc(Cl)c(F)c1)C(=O)Nc1ccc(CC(=O)N2CCOCC2)cc1	785179869	ALDULXKRTFJIFR-UHFFFAOYSA-N	434.855	1.962	50	20	IDGD	
CCNC(=O)N1CCc2ccc(NC(=O)C(=O)NNc3nccc(N(CC)CC)n3)cc21	785226887	WSEHWSUQAGZPOY-UHFFFAOYSA-N	440.508	1.497	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNc2c(OC)cccc2S(C)(=O)=O)cc1F	785331632	XLNBLLRHUSWGJN-UHFFFAOYSA-N	425.438	1.718	50	20	IDGD	
CN(C)CCc1ccc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1	786252176	GIEMJEOBVBMICA-UHFFFAOYSA-N	447.561	1.185	50	20	IDGD	
COC(=O)CCc1cccc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)c1	786416172	DLOCFTSVDKOTBA-UHFFFAOYSA-N	431.470	1.376	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)ccc1O)C(=O)Nc1cccc(C(F)(F)F)n1	786417754	YDJTZQRASBYHGS-UHFFFAOYSA-N	447.167	1.968	50	20	IDGD	
CS(=O)(=O)CC[C@H](C(=O)NNC(=O)c1nnc(O)c2ccccc12)c1ccccc1	789869295	SELDPZUOQLXFFZ-AWEZNQCLSA-N	428.470	1.315	50	20	IDGD	
CC(=O)N1CCc2ccc(S(=O)(=O)NNC(=O)COCc3ccccc3)cc2CC1	790068577	OMDOADPDQVNDSN-UHFFFAOYSA-N	431.514	1.160	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)[C@@](C)(O)Cn1cc(C(F)(F)F)ccc1=O	792016639	RNMNWEJVZZSTKO-VOJFVSQTSA-N	445.369	1.372	50	20	IDGD	
C[C@@](O)(Cn1cc(C(F)(F)F)ccc1=O)C(=O)NNc1cccc(S(C)(=O)=O)c1	792299613	FVPHYDSUETWXIM-MRXNPFEDSA-N	433.408	1.165	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNc2nc3ccccn3n2)c2ccccc12	792392081	QDWIJQNLLAFMPW-UHFFFAOYSA-N	434.412	1.516	50	20	IDGD	
CCc1c(NC(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)cnn1-c1ccc(Cl)cc1	792489812	ZUSDIMBIEKFRIO-SNVBAGLBSA-N	428.902	1.179	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)C(=O)Nc1cccc(Br)n1	793025591	LAZDQDOFJWLGHW-UHFFFAOYSA-N	444.286	1.235	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(Br)n2)o1	793026888	UWCBNHPOVNMMRP-UHFFFAOYSA-N	438.282	1.679	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)N2CCC(NS(=O)(=O)c3ccc(F)cc3)CC2)n1	793223149	CDQRKDFRZOAARO-UHFFFAOYSA-N	435.481	1.326	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1)N(C)CC(F)(F)F	793683807	VEXKJDUHRKKEPD-AWEZNQCLSA-N	449.905	1.488	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2nnn(Cc3cc(C)no3)c2C)ccc1OC(C)C	794195281	FVJBDDRAULNFIW-UHFFFAOYSA-N	428.449	1.802	50	20	IDGD	
COCCNC(=O)c1cccc(S(=O)(=O)NNC(=O)c2ccc(Cl)cc2Cl)c1	795284609	OWTGZGOQHOVFEF-UHFFFAOYSA-N	446.312	1.993	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)c1cc(Br)cnc1OCC1CC1	795956249	WGVPOJWYETUEOU-UHFFFAOYSA-N	437.250	1.417	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)cc1OCCO	798317245	WRCOZCWNHSCSQW-UHFFFAOYSA-N	440.456	1.432	50	20	IDGD	
Cc1cc(O[C@@H]2CCN(C)C2=O)ccc1NC(=O)C(=O)NNc1ccc([N+](=O)[O-])cc1	799260427	VWGFSKVEZJDXKC-QGZVFWFLSA-N	427.417	1.595	50	20	IDGD	
COc1cnc2ccccc2c1C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	801927274	LNKYPSYADKZYPM-UHFFFAOYSA-N	447.495	1.462	50	20	IDGD	
COC(=O)N(C)NC(=O)c1cccc(S(=O)(=O)N2CCN(Cc3ccccc3)CC2)c1	804124422	QLJUPNPNUGRAET-UHFFFAOYSA-N	446.529	1.536	50	20	IDGD	
COC[C@@H](C)n1c(C)cc(/C=C(\C#N)C(=O)NC2CCC3(CC2)NC(=O)NC3=O)c1C	804732786	ZBLKDLJJZLMMPY-LMXYQAKFSA-N	427.505	1.856	50	20	IDGD	
COc1ccc(CS(C)(=O)=O)cc1NC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	806637822	WWUORECNSKYBIA-KRWDZBQOSA-N	435.458	1.233	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)c2ccccc21)c1cc(Br)ccc1O	806947443	IAYKVLKVCABRIL-GFCCVEGCSA-N	439.287	1.877	50	20	IDGD	
O=C(NNC(=O)C(F)(F)Oc1ccccc1)C(=O)Nc1nc(C2CCOCC2)cs1	806979195	NYEADDUKPUNEDQ-UHFFFAOYSA-N	440.428	1.795	50	20	IDGD	
Cc1cc(C)nc(SCc2ccc(C(=O)NN=Cc3cn(C)c(=O)n(C)c3=O)cc2)n1	807182920	KQOIXZMTHZWMQQ-UHFFFAOYSA-N	438.513	1.547	50	20	IDGD	
O=C(NCC1(c2ccc(Br)s2)CCC1)NNC(=O)C(=O)N1CCCC1	807426047	HIUUWAOCAGPWKN-UHFFFAOYSA-N	429.340	1.885	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2nccnc2C2CCC2)cc1N1CCCS1(=O)=O	807462129	KYVQCVUPQHWLFC-UHFFFAOYSA-N	444.517	1.674	50	20	IDGD	
COC[C@]1(C(=O)NNC(=O)c2nnc(O)c3ccccc23)CCN(C(=O)OC(C)(C)C)C1	809933152	UFEUBVIYPUQBNG-NRFANRHFSA-N	445.476	1.370	50	20	IDGD	
NC(=O)c1ccc(OCC(F)F)c(NC(=O)C(=O)NNc2ccc(F)c(F)c2F)c1	810383245	WQOMKXNNHCIHSV-UHFFFAOYSA-N	432.305	1.929	50	20	IDGD	
Cc1ccc(C)c(S(=O)(=O)NCC(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)c1	810812842	AWVHLUBIOSAVFC-UHFFFAOYSA-N	442.538	1.034	50	20	IDGD	
CCOC(=O)c1cc(S(=O)(=O)NNC(=O)NCC2CC2)cc(Br)c1C	811682635	BZORYLUUMZLLKR-UHFFFAOYSA-N	434.312	1.837	50	20	IDGD	
COc1ccc(CNC(=O)NNC(=O)c2cccc3ncccc23)cc1S(N)(=O)=O	812429209	GTCRTYPEOQKMMA-UHFFFAOYSA-N	429.458	1.035	50	20	IDGD	
CCc1ccccc1N1C[C@H](C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)CC1=O	812731926	NNTZLGIXHNCWPC-MRXNPFEDSA-N	430.530	1.996	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)C1(S(=O)(=O)c2ccccc2)CCCCC1	813510830	FNJIXTBKINTOFI-UHFFFAOYSA-N	439.534	1.835	50	20	IDGD	
Cn1c(=O)c(CNC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc2ccccc21	813838503	JOLIUCOPVMPBQT-UHFFFAOYSA-N	428.470	1.086	50	20	IDGD	
O=C(NNC(=O)c1c[nH]c(C(F)(F)F)c1)c1ccc(S(=O)(=O)N2CCCC2)cc1	814214457	AWKOWSUJNRGSIA-UHFFFAOYSA-N	430.408	1.893	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C23CCC(C(=O)OC)(CC2)CC3)c2ccccc2c1=O	814364510	FNPGNJFTKWBMBZ-UHFFFAOYSA-N	426.473	1.691	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCO1)C(=O)Nc1cc2c(cc1Sc1ccccc1)OCCO2	815779069	QEHCNCXTQGOWEL-OAHLLOKOSA-N	443.481	1.874	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)[C@H](CCS(C)(=O)=O)c1ccccc1	817053883	KEPOTAOELQRCND-MRXNPFEDSA-N	439.559	1.599	50	20	IDGD	
Nc1nc(Cl)c(C=NNC(=O)c2csc(N3CCOCC3)n2)c(N2CCCC2)n1	863966639	IPIUJXSUDWXSEG-UHFFFAOYSA-N	436.929	1.369	50	20	IDGD	
CNS(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)c2cc3c(s2)CC[C@H](C)C3)cc1	906443643	MBGBBVBACPQJRD-NSHDSACASA-N	443.572	1.404	50	20	IDGD	
Cc1cc(C)cc(OCCC(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1	913395885	ULAQLNWTUDQZKL-IBGZPJMESA-N	428.441	1.603	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=S)Nc2cccc(S(=O)(=O)N(C)C)c2)cc1	913445792	MWNIGBKZMHLZEM-UHFFFAOYSA-N	438.531	1.342	50	20	IDGD	
C[C@H](CO)NC(=O)/C(C#N)=C\c1cn(CCC(N)=O)nc1-c1cccc(Br)c1	914545053	YEDMXSYAZIIBPW-AISSWFOISA-N	446.305	1.592	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)c1cccc(S(=O)(=O)NCC2CC2)c1	914604854	YDUKVSFZAWDYLS-UHFFFAOYSA-N	432.502	1.257	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)c2ccc(=O)n(-c3ccc(F)cc3)n2)cc1OC	914846480	LPHPZWJZFDRPEL-UHFFFAOYSA-N	426.404	1.854	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2ccc3c(O)nc(S)nc3c2)c2ccccc2c1=O	915045156	DFHLRCKQEOELJL-UHFFFAOYSA-N	436.453	1.429	50	20	IDGD	
C[C@H](NC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)[C@@H]1C[C@H]2CC[C@H]1C2	915883186	CZOBHRWCGDVSJE-OVWQWFNUSA-N	436.582	1.469	50	20	IDGD	
CCCCS(=O)(=O)N1CCC(C(=O)NNC(=O)c2ccc(OCC)c(OC)c2)CC1	916144379	IYEWBNILVRVCBS-UHFFFAOYSA-N	441.550	1.697	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1CNC(=O)NNC(=O)c1ccc2ccccc2n1	916237595	DYHUHYAVGVXEPM-UHFFFAOYSA-N	427.486	1.629	50	20	IDGD	
CCC(CC)[C@H](CNC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)N1CCOCC1	916255686	DEWQOZSXKWQSSC-SFHVURJKSA-N	444.536	1.015	50	20	IDGD	
CC(=NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)c1ccc(OCC(=O)N(C)C)cc1	916306290	QZRLPJGEZADQLU-UHFFFAOYSA-N	446.529	1.558	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)c1ccc(OCC(=O)NC2CC2)cc1	916489327	JDLOUGRHRLCKBW-CYBMUJFWSA-N	441.444	1.957	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)NCCS(=O)(=O)NCc2ccccc2)c1	916645162	GQUWONXFTNYICR-UHFFFAOYSA-N	434.518	1.132	50	20	IDGD	
COc1cc(C(=O)N2CCN(CC(=O)NNC(=O)c3ccccc3Cl)CC2)ccc1C	917140926	AYRWFXPALMXLAM-UHFFFAOYSA-N	444.919	1.876	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)N[C@@H](C)c2ccc(S(=O)(=O)N(C)C)cc2)c1	918103164	ARYNGWCQUIKJIH-HNNXBMFYSA-N	434.518	1.716	50	20	IDGD	
O=C(NCCCCN1CCN(c2ccccc2)CC1)NNc1ccc(-n2cccn2)nn1	918231716	QQMJGPGVUBMPJM-UHFFFAOYSA-N	435.536	1.891	50	20	IDGD	
CNS(=O)(=O)c1ccc([C@H](C)NC(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1	919778735	JRMUGFGQARPGMJ-LBPRGKRZSA-N	434.474	1.071	50	20	IDGD	
O=C(C[C@H](NC(=O)c1ccccc1Cl)c1ccccc1)NNC(=O)CN1CCCC1=O	920825471	BDGCNIFUCRGVRD-SFHVURJKSA-N	442.903	1.971	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)NCCN2CCN(S(C)(=O)=O)CC2)c(C)n1CC(C)C	921164970	BSWJSXKKBHGUMX-DEDYPNTBSA-N	435.594	1.361	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN1C(=O)c1ccc2c(c1)OCO2)c1n[nH]c2c1CCCC2	1318245642	LTCVMVZRMXDUIY-HNNXBMFYSA-N	425.445	1.083	50	20	IDGD	
Cc1nccn1-c1ccc(CNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cn1	1318268271	YAEWGAQQWQHWQS-UHFFFAOYSA-N	435.492	1.113	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)[C@@H]2CC[C@H](C(F)(F)F)NC2=O)CC1	1318622987	SWZBUQRYGPGIGO-VXGBXAGGSA-N	436.431	1.238	50	20	IDGD	
CC(C)(C)c1ccc(NNC(=O)NC2CCN(S(=O)(=O)C3CCOCC3)CC2)nn1	1321969103	QHHQIMQMXSIIKK-UHFFFAOYSA-N	440.570	1.373	50	20	IDGD	
C[C@H](O)CNS(=O)(=O)c1ccc(C(=O)NNC(=S)Nc2cccc(Cl)c2)cc1	1335651160	WTDLLKGFRGQQGN-NSHDSACASA-N	442.950	1.631	50	20	IDGD	
Cn1ncc2c(C(=O)N3CC[C@]4(CN(C(=O)CCBr)CCO4)C3)cccc21	1778027400	ISSOQGHWRYJPMD-IBGZPJMESA-N	435.322	1.802	50	20	IDGD	
O=C(c1ccc2[nH]ccc2n1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1778491437	UNADJCQDVXORLO-RHSMWYFYSA-N	425.258	1.697	50	20	IDGD	
CO/C=C(\C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2	1779233905	QTWCPRRORSNTEJ-CWCDLFDWSA-N	445.520	1.185	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1CCc3ccccc3[C@H]1O)CCO2	1779294434	GCEFCMWYHLBLGT-LSWJPFSZSA-N	446.620	1.964	50	20	IDGD	
CC(C)n1nccc1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2	1779599789	IGVKREZEHAIRSP-KBXCAEBGSA-N	427.343	1.939	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(-n4c(O)nnc4O)cc3)C2)C1	1780203338	FGFGSKQJSZCIFO-QRWLVFNGSA-N	449.895	1.139	50	20	IDGD	
CN1CCC[C@H](C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](F)Br)C3)C1	1780576127	ZRPAWZKUXSOLKC-JTOWHCCKSA-N	434.350	1.533	50	20	IDGD	
CCOC(=O)/C=C/C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Br)C1	1780771088	BOWULSWZGHDAKF-WXNHJUMLSA-N	435.290	1.310	50	20	IDGD	
C[C@H](Cn1ccnc1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Br)C1	1780776641	CATWPYVXCAJTEC-ATNYBXOESA-N	445.333	1.724	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](C)NC(=O)c3ccc(F)cc3)C2)C1	1780907210	VHEACKVIZSONST-DAESXHAQSA-N	439.915	1.791	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)C3=NN(c4ccccc4)C(=O)C3)CCO2)C1	1781218518	NRJZRKQBVKIJAE-IIBYNOLFSA-N	432.908	1.627	50	20	IDGD	
C[C@H](Nc1cnccn1)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@](C)(Cl)CCl)C2)C1	1781229712	IKNSFGNVRAUHHY-VHSSKADRSA-N	430.336	1.343	50	20	IDGD	
O=C(c1ccc2c(c1)OCCO2)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781330497	YEAGTCBCZMQVTJ-QAPCUYQASA-N	443.269	1.592	50	20	IDGD	
Cc1n[nH]c(C)c1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)Br)C1	1781997954	OVPLWLWFOHNORD-UCMVZMLTSA-N	427.343	1.937	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cccc(-n4cncn4)c3)C2)C1	1782013430	SNIRDVKIYXMRFS-OAQYLSRUSA-N	431.924	1.976	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc3nn(C)cc3c1)C2	1782177920	AMWDCNGPRDOIOE-LRXVAGHRSA-N	448.951	1.955	50	20	IDGD	
O=C(c1cnc2c(F)c(F)ccc2c1)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1782467678	LQWQDIBUKKXWMQ-QRWLVFNGSA-N	439.846	1.556	50	20	IDGD	
CC(C)(C)OC(=O)N1CC2(C[C@@H]2C(=O)N2CC[C@@]3(CN(C(=O)[C@@H](F)Cl)CCO3)C2)C1	1783448920	CVHKCEZEJNIWRH-JZKQVHKSSA-N	445.919	1.608	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)/C=C/c3ccc([N+](=O)[O-])o3)CCO2)C1	1783529783	MVWNPMXHHNASSU-FYNHJILNSA-N	442.266	1.814	50	20	IDGD	
C#CCO[C@@H](C)C(=O)Nc1ccc(C2(NC(=O)c3cnccc3C(=O)NN)CCC2)cc1	1786359979	ZWZQPCJKQWDAQK-HNNXBMFYSA-N	435.484	1.471	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(-c4ccco4)no3)[C@H]2C1	1787284665	IZBYIJLTJHPICL-NUXNZHGMSA-N	437.880	1.782	50	20	IDGD	
Nc1nc(C(=O)Nc2ccc(C3(NC(=O)c4ccc(B(O)O)cc4)CCC3)cc2)cs1	1788077805	LYSSWSFJWUUQIZ-UHFFFAOYSA-N	436.302	1.467	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1ccc(C2(NC(=O)c3cnccn3)CCC2)cc1	1789521226	NSYSVAZWKHWLLS-UHFFFAOYSA-N	431.456	1.537	50	20	IDGD	
O=C(CN1C(=O)C=CC1=O)NC1(c2ccc(NC(=O)[C@@H](F)Br)cc2)CCC1	1790537250	LRDYXJGHQNKREV-MRXNPFEDSA-N	438.253	1.736	50	20	IDGD	
Cc1cc(C(=O)NC2(c3ccc(NC(=O)CCC(=O)NN(C)C)cc3)CCC2)nn1C	1791599604	NAPNMGZSKDRBAW-UHFFFAOYSA-N	426.521	1.849	50	20	IDGD	
CC(C)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(-n3cccn3)nc1)C2	1792784155	XUBYKSFLGDTNRL-ALXJQNPVSA-N	431.924	1.736	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1c(F)cccc1Cl)c1ccc(B(O)O)cc1	1792835238	ZPHUBENYXQRWDF-BJWYYQGGSA-N	444.699	1.653	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(O)c(F)c1)C2	1792874113	LDZYSHAZLWYWML-YGSHXTJESA-N	429.286	1.766	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1c(F)ccnc1Cl	1794238244	AOSHEWBPQYWSRK-ORXSELOVSA-N	434.693	1.861	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cn1ccnc1	1795242590	CMXOOXAPTXAZPY-MUJYYYPQSA-N	441.444	1.669	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1(C(F)(F)F)CCC1	1795919033	IQTWZTJLZFOZMO-CLLJXQQHSA-N	439.438	1.670	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1noc2c1CCCC2	1796154976	KIUOCUAFWCLFNY-FAXLKDOZSA-N	440.338	1.930	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](C)[C@@H]1SC(=N)NC1=O	1796874272	NNVUCDIAPZKJFZ-PDWLFKFUSA-N	445.383	1.458	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(Cl)c2nncn2c1	1797689975	TXEKUCJVFWFKKF-QVHKTLOISA-N	426.304	1.603	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(C)cc1-n1nccn1	1798631500	ZSTFNXNKGUTXRU-HIRMHNASSA-N	447.923	1.033	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc3c(c1)CCO3)C2	1799279817	UIJVDJLCHPQGSL-MNDZRTMASA-N	441.355	1.990	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)c1ccc2c(Cl)ccnc2c1	1799886416	LXZOPTSIFHAXIM-GGNLRSJOSA-N	438.311	1.691	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2	1800332442	LYVZEEFYEGNZQE-STNLWOQDSA-N	439.846	1.061	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3nc[nH]c3c1)C2	1800640649	CYHXNWQVYOFVLE-UMPJEAMMSA-N	435.322	1.940	50	20	IDGD	
CN(C)C(=O)c1cccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CO[Si](C)(C)C)C3)c1	1801913333	YBKHOJAQQHAHNR-OPVJXMOQSA-N	447.608	1.443	50	20	IDGD	
COC[C@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1nc3ccccc3n(C)c1=O)C2	1802273205	LZBAZOXBSVEQCV-XGUBFFRZSA-N	432.908	1.439	50	20	IDGD	
CCS(=O)(=O)CC(=O)NC[C@H]1CCN(C(=O)CO[Si](C)(C)C)[C@@H]1c1cccnc1	1803513214	OXKPRCWGRSJULQ-VQIMIIECSA-N	441.626	1.374	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)/C=C/c2ccoc2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1	1807369288	FBJBXFFFGOHTSG-SJUPYBQOSA-N	445.284	1.387	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](F)Cl)[C@@H]1c1cccnc1)c1cccn2c(O)nnc12	1808189665	WSJRGAVTCIAHIW-CFVMTHIKSA-N	432.843	1.684	50	20	IDGD	
COCCOCCOCCC(=O)N1CC[C@H](CNC(=O)[C@H](F)Cl)[C@@H]1c1cccnc1	1808320238	IHNZHHFLYQUZOS-NEWSRXKRSA-N	445.919	1.692	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)c3[nH]cc4c3CCC4)CC2)C1	1809971384	UONNHXOOFRJACB-UHFFFAOYSA-N	435.333	1.342	50	20	IDGD	
COc1ccc(C(=O)N2CCC3(CCCN(C(=O)c4cccc(B(O)O)c4)C3)CC2)cc1	1809978074	UXHLBIAIHYOSNV-UHFFFAOYSA-N	436.317	1.534	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)[C@@H](C)n2ccccc2=O)[C@@H]1c1cccnc1	1810518311	NJWWWPOXBALOQI-LBKNJMOBSA-N	446.935	1.764	50	20	IDGD	
NC(=O)c1nccnc1C(=O)NC[C@H]1CCN(C(=O)C(Cl)Cl)[C@@H]1c1cccnc1	1811188821	MWUGCQAXYRBLFM-BXUZGUMPSA-N	437.287	1.094	50	20	IDGD	
C=CCC(F)(F)C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1812667492	DKOIDCVSEDUOLY-MJGOQNOKSA-N	443.259	1.292	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)n2cncn2)[C@H]1c1cccnc1	1812866950	BDIWMGCINGOHKZ-XRGAULLZSA-N	435.326	1.724	50	20	IDGD	
CCc1cc(C(=O)N2CC[C@H](CNC(=O)[C@H](Cl)COC)[C@@H]2c2cccnc2)n(C)n1	1813033020	YWYDPQKYJJNBDC-SUMDDJOVSA-N	433.940	1.951	50	20	IDGD	
O=C(COc1cccnn1)NC[C@@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1	1813389494	RRFYHMGPQOAVRZ-KXBFYZLASA-N	448.321	1.741	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(Cl)o1)CC2)c1ccc(B(O)O)cc1	1815340974	RLVIBISARMMRBY-GFCCVEGCSA-N	445.693	1.609	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@H]1CCC(F)(F)C1)CC2)c1cccc(B(O)O)c1	1815347896	VXOUNGUSEMGQEK-GXTWGEPZSA-N	449.288	1.484	50	20	IDGD	
C[C@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](F)Cl)[nH]n1)[C@@H]1SC(=N)NC1=O	1818099690	YXNHQZMSDGCKGB-QZDOIJKTSA-N	430.893	1.739	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccon2)[nH]n1	1818111410	JSCNRELAVODYOS-PLVXZXGYSA-N	438.448	1.838	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H]2CCCS2(=O)=O)n[nH]1	1821834143	IBRZULGEORQOLU-CABCVRRESA-N	442.614	1.831	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H]2CNC(=O)C2)n[nH]1	1821955901	XKNGXYIESWVBPN-WZRBSPASSA-N	426.315	1.569	50	20	IDGD	
CC(C)N[C@H](C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1)C(C)C	1822413943	IYMIHPXWLMBWLJ-UWJYYQICSA-N	449.600	1.797	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])[nH]2)[nH]n1	1822414965	PEGBFTSMEDUQLR-AWEZNQCLSA-N	446.468	1.325	50	20	IDGD	
CS(=O)(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCBr)[nH]n1	1822968213	PMQJJXXIPXPGNA-LBPRGKRZSA-N	435.344	1.622	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccccc3C(N)=O)sc2C1	1823451162	QJWKFJNXVORTRQ-ZWNOBZJWSA-N	436.921	1.722	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)CCN2CCCC2)n[nH]1	1823575275	SNMRLKAHIFNHGR-KRWDZBQOSA-N	433.557	1.261	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc[n+]([O-])c1)CC2	1825637001	PITRPIINAJTKTM-KOLCDFICSA-N	425.308	1.786	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1c[nH]c(=O)cn1)CC2	1825645703	ILLPNCKERDKTOE-HTQZYQBOSA-N	426.296	1.236	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](NC(C)=O)C(C)(C)C)CC2	1825993814	FPOFPCSHZNINAC-XUJVJEKNSA-N	444.985	1.860	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)C(=O)c2ccccc2)CC1	1826289745	OINDNBOKEQPPHW-HXUWFJFHSA-N	442.560	1.862	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)Cc3cnn(C)c3)sc2C1	1826948855	JDSSAUVXHJOLQF-KOLCDFICSA-N	426.340	1.815	50	20	IDGD	
O=C(c1cc(=O)nc2cccnn12)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](F)Cl)CC1	1827610917	SDFGDKCANVYTIF-KBXCAEBGSA-N	435.887	1.857	50	20	IDGD	
O=C(c1cc(C2CC2)on1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1830198838	UCVQJRLJRJUPRC-WMLDXEAASA-N	446.273	1.313	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H]2C[C@H](O)CN2)CC1	1830202427	LPBQRBMMWWNSST-QSPRXWTASA-N	430.387	1.360	50	20	IDGD	
O=C([C@H]1C[C@@H]1c1ccc(F)cc1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1830423045	YTGMZGBTQLGBCM-NHAYFPRASA-N	428.863	1.920	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)COC(=O)C(F)(F)F)CC1	1831831460	ZEYWOHBNURACRG-KGLIPLIRSA-N	442.862	1.965	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)C(F)(F)C(F)F)CCO2)C1	1832189747	MHZUOOGWBLQMQT-KGLIPLIRSA-N	439.233	1.580	50	20	IDGD	
O=C([C@H](O)CCl)N1CCC([C@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)CC1	1832896427	HVLZEPWUSPLLBK-ZIAGYGMSSA-N	448.010	1.066	50	20	IDGD	
CO[C@H](C(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)CCl)CC2)CC1)c1ccccc1	1833309008	IVMHEALCWNWYAA-PMACEKPBSA-N	437.968	1.545	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)CCCCn3cccc3)CC2)CC1)[C@H](O)CCl	1833312215	JUBPKGHPXXJUOY-HXUWFJFHSA-N	439.000	1.830	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnn(C(C)(C)C)c3)CCO2)C1	1833450197	ABOXNDQYRQDNHI-OAQYLSRUSA-N	440.972	1.973	50	20	IDGD	
Cc1ccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)CCBr)C3)C2)cc1	1835081249	DBRYFAQTNMPCAU-FQEVSTJZSA-N	439.350	1.779	50	20	IDGD	
O=C(Nc1cccnc1)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](F)Cl)CC2)CC1	1835084074	JNQKGSHGPWARBE-MRXNPFEDSA-N	425.892	1.126	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3ccc(F)nc3)CC2)CC1	1835886884	YZNMTQZPXOKUDN-KRWDZBQOSA-N	426.920	1.660	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC(OC2CCN(C(=O)CCN(C)C)CC2)CC1	1836671290	VLSBWKBRMXWKPN-OAHLLOKOSA-N	432.403	1.968	50	20	IDGD	
O=C(c1nnc(-c2ccccc2)o1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1837537096	MXRCSEYMTUBIME-LIRRHRJNSA-N	438.843	1.341	50	20	IDGD	
N#Cc1cccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)c1	1838907936	XDJONTJMCNHMHQ-MAUKXSAKSA-N	440.269	1.319	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(O)cc3)CCO2)C1	1838968733	SOSPZEIWRACYHU-LIRRHRJNSA-N	441.322	1.493	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1	1839020773	URYXWVFEPZMSIE-DNVCBOLYSA-N	447.315	1.018	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)C2)C1	1839147027	FGHQDXQDJITSFK-VQIMIIECSA-N	441.868	1.388	50	20	IDGD	
COc1cc(C)c(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)cc1OC	1839399179	NKFPDAPZBPSOEO-FXAWDEMLSA-N	444.887	1.617	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C1(CC)COC1)CCO2	1839778728	OHAJDVRVTIFFLP-KBXCAEBGSA-N	433.343	1.043	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccn3C)C2)C1	1839963693	SDOQTZKUKNUIKJ-KSSFIOAISA-N	428.327	1.269	50	20	IDGD	
Cc1nc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)cs1	1840031223	JCOXYFJIFNZYCT-SJKOYZFVSA-N	446.367	1.234	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(C)c3Cl)C2)C1	1840156156	JKHYPHOVJWXITO-UZLBHIALSA-N	445.343	1.972	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C34CCC(CC3)CC4)C2)C1	1840156379	NIRPQKYRCOHMJH-YPTYLKSTSA-N	428.957	1.667	50	20	IDGD	
Cc1cc(F)cc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)c1	1840190560	APTKDULXVOFATQ-IBGZPJMESA-N	433.307	1.937	50	20	IDGD	
COc1cc(F)ccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1840641540	LRDUQGYHTJBMGU-SFHVURJKSA-N	435.279	1.708	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@H]2COCCN2C(=O)OC(C)(C)C)C1	1841751715	JUSGAJRDDHSAOA-LSDHHAIUSA-N	445.944	1.080	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC12CN(C(=O)C13CC(c4ccccc4)(C1)C3)C2	1843012993	XOSWSWCAMLHLIA-UHFFFAOYSA-N	430.313	1.305	50	20	IDGD	
CC1=C(C(=O)N2CCCC23CN(C(=O)CN(C)NC(=O)NCc2ccccc2)C3)CCO1	1843141924	UQSNPDKYBFOTTJ-UHFFFAOYSA-N	441.532	1.230	50	20	IDGD	
COC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)C(C)(C)CCl)C2	1843383630	UQAMCCSICGESGO-AWEZNQCLSA-N	431.961	1.995	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)Cc1ccc(C#N)cc1)C2	1843415089	IVZGINBJYGQGSW-WGOQTCKBSA-N	432.484	1.438	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1cnnc(Cl)c1)C2	1843415431	HKUCZUUNKJJVNE-FSJBWODESA-N	429.868	1.081	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2ccnn2-c2ccccc2)C1	1843597233	LALZHIOHFQFDRG-UHFFFAOYSA-N	445.483	1.002	50	20	IDGD	
Cc1ccc2nc(C(=O)N3CCCC34CN(C(=O)c3cccc(B(O)O)c3)C4)ccc2c1	1843663343	BNLRRODFAVRZTN-UHFFFAOYSA-N	429.285	1.354	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)c1cccc(O)n1)C2	1844692107	IEQHKRRDFVZPCM-UHFFFAOYSA-N	440.412	1.752	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@H]1CC(=O)N(c3cccc(OC)c3)C1)C2	1846359660	FDKFNQGSRZTMEQ-CRAIPNDOSA-N	449.935	1.505	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@H]1[C@H]3CN(C(=O)OC(C)(C)C)C[C@H]31)C2	1846364839	MLRWUQXAZWMHGE-XUWVNRHRSA-N	441.956	1.557	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CCCC[C@@H]1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl	1847567823	FFJBFYFDOMVPHP-BQJWPVKWSA-N	443.972	1.871	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)c2ccc3c(c2)OCO3)cc1S(=O)(=O)N1CCCCC1	15793699	WTANQWJSUZXNMM-UHFFFAOYSA-N	445.497	1.973	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)CCNS(=O)(=O)c1cc(C)ccc1C	15879279	SGKXFOXYERCDFU-UHFFFAOYSA-N	435.502	1.207	50	20	IDGD	
O=C(CN1C(=O)c2cc(Cl)c(Cl)cc2C1=O)NNC(=O)c1cccc([N+](=O)[O-])c1	17329579	QIAOOAYKIXSWBX-UHFFFAOYSA-N	437.195	1.959	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@H](C)NC(=O)c2n[nH]c3ccccc23)ccc1OC(C)C	726381387	BAQYBSFSKLJRHK-ZDUSSCGKSA-N	439.472	1.938	50	20	IDGD	
NC(=O)c1ccc(/C=C/C(=O)N2CCC[C@H]2C(=O)NNC(=O)CCCc2ccccc2)cc1	727715511	RANLPHSMTMEKKJ-WMJZSHNHSA-N	448.523	1.960	50	20	IDGD	
CCS(=O)(=O)N[C@@H](CCSC)C(=O)NNC(=O)c1c(Cl)cccc1Cl	727793591	UDCOCHRTIHDPQN-NSHDSACASA-N	428.363	1.815	50	20	IDGD	
Cc1nc(C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)nn1-c1c(Cl)cccc1Cl	728234299	OWNVSOWXNMEVCJ-VIFPVBQESA-N	432.289	1.078	50	20	IDGD	
COc1ccc(C(=O)NCC(=O)NNC(=O)c2cccc(OC(F)F)c2)cc1[N+](=O)[O-]	728609523	HWUCLIDRFNCBKK-UHFFFAOYSA-N	438.343	1.396	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2ccnc(OCc3ccccc3)c2)n1	728729425	MTOAIJWFIFUMHT-UHFFFAOYSA-N	440.481	1.972	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=O)c2cccc(C#N)c2)ccc1OC	728827264	KVYXDOZAQXKGKP-UHFFFAOYSA-N	430.486	1.672	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)OCCN(C)S(=O)(=O)N(C)C)c(C)n1C[C@H]1CCCO1	731143967	HQYYHSZGNDKOKW-XLXASQRYSA-N	438.550	1.472	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(Oc2cccc(Cl)c2)cc1)[C@H]1CCS(=O)(=O)C1	731177007	ARLWTPDQLVKMTL-LBPRGKRZSA-N	444.918	1.877	50	20	IDGD	
CC(C)(C(=O)NNC(=O)NCc1ccc(C(=O)N2CCNC(=O)C2)cc1)c1ccccc1	731219956	OSPKIFSNOUDRTB-UHFFFAOYSA-N	437.500	1.067	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)N1CCN(CC(=O)N2CCc3ccccc32)CC1	731500474	HHWUXLOWLTYYCY-UHFFFAOYSA-N	437.500	1.257	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)NC2CCN(CCC(=O)N(C)C)CC2)c2ccccc2n1	731543388	JQTFYXIJCAPQRE-UHFFFAOYSA-N	426.521	1.430	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(N2CCOCC2)c(C(=O)NNC(=O)C2CCC2)c1	732142190	VCQLHAGZDQWNMQ-UHFFFAOYSA-N	438.550	1.115	50	20	IDGD	
Cc1ccccc1-n1c(C)cc(/C=C(\C#N)C(=O)NCC(=O)NCCN2CCOCC2)c1C	732155336	AMKBIBYETALVBK-PXLXIMEGSA-N	449.555	1.874	50	20	IDGD	
C=CCNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1	733169840	BVNYVLYHMJYOFJ-UHFFFAOYSA-N	425.470	1.411	50	20	IDGD	
O=C(NCCNC(=O)c1ccc(Cl)cc1)NNC(=O)c1cnn(-c2ccccc2)c1	733337286	KOGUBEORJPDKMQ-UHFFFAOYSA-N	426.864	1.900	50	20	IDGD	
COc1ccc([C@H]2[C@@H](C(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)CCC(=O)N2C)cc1	734315073	GLJORRCKKILBHX-HKUYNNGSSA-N	426.429	1.974	50	20	IDGD	
COc1ccc([C@@H]2[C@H](C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)CCC(=O)N2C)cc1	734419468	SAWFKSLYPUWXMX-UYAOXDASSA-N	449.471	1.042	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	735117512	VIFZMOWMSVYWPY-AWEZNQCLSA-N	437.497	1.067	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)NC[C@H](c2ccc(C(F)(F)F)cc2)N2CCOCC2)cn1	735580221	QNMWPUKHDWRKDU-MRXNPFEDSA-N	440.426	1.456	50	20	IDGD	
C[C@H](C(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)N1CCc2ccccc2C1	740988146	ZYUBTMXNVWRLJF-CQSZACIVSA-N	426.429	1.346	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)[C@@H]2CN(Cc3ccccc3)CCO2)c2ccccc2c1=O	741173703	STXHRNFBQBASMC-FQEVSTJZSA-N	449.511	1.469	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NN[C@@H](C(N)=O)c2ccc(Br)cc2F)cc1C	743464573	KEYGKGZCKXQGTB-OAHLLOKOSA-N	437.269	1.991	50	20	IDGD	
C[C@@H](CCN(C)C)NC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	744865057	AYUNNJGJJPNYBD-ZDUSSCGKSA-N	439.563	1.833	50	20	IDGD	
COc1cc(/C=C\C(=O)OCC(=O)NNC(=O)Cc2nc(C)cs2)cc(OC)c1O	745514486	ZSZULKCPQIXZSR-PLNGDYQASA-N	435.458	1.121	50	20	IDGD	
O=C(Cn1nc(Br)nc1Br)NNC(=O)c1cccc([N+](=O)[O-])c1	746140473	ZIDRFUYEWGDIEK-UHFFFAOYSA-N	448.031	1.173	50	20	IDGD	
COc1ccc([C@@H](C)NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1	746961628	ARZUZBONROXUME-OAHLLOKOSA-N	434.518	1.716	50	20	IDGD	
C[C@H](c1ccc([S@@](C)=O)cc1)N(C)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	747500970	OINPGSUBHBWGBM-LHEBDHONSA-N	444.561	1.864	50	20	IDGD	
C[C@H](NC(=O)c1ccoc1)C(=O)NNc1ccc(S(=O)(=O)Nc2nccs2)cc1	747943994	PQCLWCUFKHXKSD-NSHDSACASA-N	435.487	1.799	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)N2CCN(CCS(N)(=O)=O)CC2)c(C)n1C1CCCCC1	748369176	DWEKSMWOIJJYBY-HKWRFOASSA-N	447.605	1.950	50	20	IDGD	
CC(C)[C@@H](C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1)N1CCCCC1	748618490	CXQNYBBSPZIOKQ-FQEVSTJZSA-N	437.610	1.576	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)N[C@@H](C)c1cc(F)ccc1N1CCN(C)CC1	748628133	PHBLYSLSMTXCAI-GJZGRUSLSA-N	425.505	1.020	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNS(=O)(=O)c2cccc3c2CCCC3)ccc1Cl	748640970	QANQYKQCYXMTKN-UHFFFAOYSA-N	443.934	1.490	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NC[C@@]2(N(C)C)CCSC2)c2ccccc2c1=O	748646404	FQKFSOXLZIFCQX-NRFANRHFSA-N	446.577	1.578	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNS(=O)(=O)c1ccc(OCC(=O)O)c(C)c1	748689514	JYOLMQWIKYCNDA-UHFFFAOYSA-N	438.458	1.246	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(/C#N)C(=O)OCC(=O)N2CCCC[C@@H]2C(N)=O)c1C	749010247	JSVHFVMACDKXBU-FHUMOJDUSA-N	430.505	1.629	50	20	IDGD	
CC(=NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1)c1ccc(O)c([N+](=O)[O-])c1	749625465	BRPVFWKJENXMCD-UHFFFAOYSA-N	425.445	1.599	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc2c(c1)CCN2CC(=O)NNC(=O)c1ccccc1Cl	749923647	VOUDXAFIASFYNP-UHFFFAOYSA-N	436.921	1.414	50	20	IDGD	
O=C(NCCNS(=O)(=O)Cc1ccon1)NNC(=O)c1cc2c(s1)CCCCC2	750289557	UCKDDJFNAOIBRA-UHFFFAOYSA-N	441.535	1.069	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)c1cccc(S(=O)(=O)N2CCCCCC2)c1	751212087	OVYPPYLSOWVVJU-UHFFFAOYSA-N	448.501	1.035	50	20	IDGD	
COc1cc(C)c(C=NNC(=O)C(=O)NN=Cc2cc(OC)c(OC)cc2C)cc1OC	751518126	YVPIATVGMQUNHH-UHFFFAOYSA-N	442.472	1.938	50	20	IDGD	
Cc1ccc2cccc(S(=O)(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)c2n1	753981635	OGUIXSBYOSDDHJ-UHFFFAOYSA-N	448.526	1.417	50	20	IDGD	
C[C@@H](C(=O)N1CCCC1)N1CCN(C(=O)NNC(=O)c2cc3c(s2)CC[C@@H](C)C3)CC1	755086043	JVTYTSUBKBNWAS-CVEARBPZSA-N	447.605	1.856	50	20	IDGD	
COC(=O)c1cc(NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)ccc1Cl	755851144	LIRVYSMCJZKGEN-UHFFFAOYSA-N	425.850	1.997	50	20	IDGD	
CN1CCC/C1=N/S(=O)(=O)c1ccc(NC(=O)NNC(=O)c2ccc(C#N)cc2)cc1	756071534	GMZNSEZOTRMDPM-BWAHOGKJSA-N	440.485	1.838	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)NCCN2C(=O)[C@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2=O)c1C	756097707	QZDCPUOMHYAGBU-AKKLJKOSSA-N	440.500	1.208	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@@H](C)c2ccc([S@@](C)=O)cc2)c2ccccc2c1=O	756736873	JFDXGSZNCTURBE-CQMWEUJXSA-N	441.513	1.859	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)Nc1ccc(S(=O)(=O)NCCOC)cc1)c1ccccc1	756782693	CYFFCHCHUUJVCK-SFHVURJKSA-N	434.518	1.958	50	20	IDGD	
COc1cc(C(=O)N(C)C)ccc1NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	756869190	QIVKCBBYKKXMNP-UHFFFAOYSA-N	438.444	1.110	50	20	IDGD	
Cc1ccc(C(=O)NNc2ccc(C(N)=O)nn2)cc1S(=O)(=O)NCc1ccccc1	757392519	OFMKVSMIKOSPNP-UHFFFAOYSA-N	440.485	1.119	50	20	IDGD	
COc1ccc(Cn2ncc3cc(C(=O)NNc4ccc(C(N)=O)nn4)cnc32)c(OC)c1	757404303	ONOPGZQRLDXDCD-UHFFFAOYSA-N	448.443	1.143	50	20	IDGD	
Cc1cc(C(=O)N2CCOCC2)ccc1NC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	757831025	PHVUWUVHBOXPMK-UHFFFAOYSA-N	427.417	1.842	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)Nc2ccc(F)c(S(=O)(=O)NC3CC3)c2)c1	757870837	ALDADBZOOGNDHC-UHFFFAOYSA-N	436.465	1.807	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1ccn(-c2ccc(Cl)cc2Cl)n1	757890484	HAXKPORMFUDRCQ-QMMMGPOBSA-N	435.293	1.270	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NCCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)cc1	758692653	BQNMLUVGXGWOKG-UHFFFAOYSA-N	436.446	1.086	50	20	IDGD	
CCOc1cc2c(cc1[C@@H]1C[C@H]1NC(=O)NNC(=O)C(=O)Nc1ccccn1)O[C@H](C)C2	758753472	QKMJMDMJHGSCTG-IVMMDQJWSA-N	439.472	1.629	50	20	IDGD	
CCO[C@@H]1C[C@H](NC(=O)NNC(=O)c2nn(CC)c(=O)c3ccccc23)[C@@]12CCCO2	760141716	HGPGRMIEZINXBH-MRUHUIDDSA-N	429.477	1.087	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1cccc(OCC(F)F)n1	760648851	OSNXOOUUIITCLY-UHFFFAOYSA-N	442.444	1.503	50	20	IDGD	
Cc1nn(C)c(C)c1S(=O)(=O)N[C@@H](C)C(=O)NNc1ccc(OC(F)(F)F)cc1	761594445	BUIABCUTDIKFKU-JTQLQIEISA-N	435.428	1.746	50	20	IDGD	
O=C(CCCc1nc(-c2ccc(F)cc2)no1)NNc1nccc(N2CCOCC2)n1	762867492	WHJNYXGVHNZPTE-UHFFFAOYSA-N	427.440	1.968	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)c3cc(S(=O)(=O)NC(C)C)c[nH]3)n[nH]2)cc1C	763178167	WLYAAUCTJIIODY-UHFFFAOYSA-N	444.517	1.783	50	20	IDGD	
CCc1ncc(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)s1	763372977	GEYQZGJFZHTRFL-UHFFFAOYSA-N	444.560	1.113	50	20	IDGD	
CCN(CC)C(=O)Cn1ccc2cc(NC(=O)C(=O)NNC(=O)c3ccccc3)ccc21	763423272	LORYROUZEKPNPA-UHFFFAOYSA-N	435.484	1.909	50	20	IDGD	
CSc1cc2c(cc1NC(=O)C(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)OCCO2	763444816	BCCCUYAYGDOMTG-UHFFFAOYSA-N	432.414	1.488	50	20	IDGD	
O=C(NNC(=O)c1ccccc1O)C(=O)Nc1cnn(-c2ccc(C(F)(F)F)cc2)c1	763526811	KYFCLWDIISELMK-UHFFFAOYSA-N	433.346	1.996	50	20	IDGD	
COCCOc1ccc(C#N)cc1NC(=O)C(=O)NNC(=O)c1cc2ccccc2cc1O	763527935	QREILSSEOLIRGX-UHFFFAOYSA-N	448.435	1.842	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)C(=O)Nc1ccccc1C(=O)N1CCCCC1	763549381	ZBOVIBSLCSAPNC-UHFFFAOYSA-N	438.440	1.441	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)Nc1cccnc1Oc1ccccc1	763574259	YBTMPDXZUNZHIE-GOSISDBHSA-N	434.408	1.800	50	20	IDGD	
N#CCCSc1ccccc1NC(=O)C(=O)NNC(=O)[C@@H]1COc2ccccc2O1	763575398	TYYVKTYVJXYDLF-INIZCTEOSA-N	426.454	1.618	50	20	IDGD	
CNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)COc2cc(C)ccc2C(C)C)cc1	763598481	ZNBOVKKMJURCIH-UHFFFAOYSA-N	426.473	1.643	50	20	IDGD	
CNC(=O)CCOc1ccc(NC(=O)C(=O)NNC(=O)c2cc(C)nc3ccccc23)cc1	763617097	SLNNUJPEPHKNSG-UHFFFAOYSA-N	449.467	1.458	50	20	IDGD	
CCc1nnc(-c2cccc(NC(=O)C(=O)NNC(=O)COc3ccccc3OC)c2)o1	763662855	BJOAJNYDTCUQQE-UHFFFAOYSA-N	439.428	1.473	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2ccc(Br)nc2C)c1	763669707	YXSVKHFPDYXJCZ-UHFFFAOYSA-N	435.278	1.934	50	20	IDGD	
N#Cc1cccc(-c2csc(NC(=O)C(=O)NNC(=O)COc3ccccc3F)n2)c1	763678279	CCPGYBFAWZPFFF-UHFFFAOYSA-N	439.428	1.986	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(-n2cccn2)c(F)c1	763712380	FWEAHBWDJFKIHH-UHFFFAOYSA-N	425.420	1.739	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)CSc2ccc(Cl)cc2)cn1	763733861	JMHHLCFYINKXLQ-UHFFFAOYSA-N	438.893	1.638	50	20	IDGD	
CCOc1cc2c(cc1NC(=O)C(=O)NNC(=O)c1cccc(N(C)C)c1)O[C@@H](C)C2	763754460	RHLVEFQJFSRNFL-ZDUSSCGKSA-N	426.473	1.874	50	20	IDGD	
COc1cc(Br)cc(NC(=O)C(=O)NNC(=O)c2cccc(N(C)C)c2)c1	763757144	DSRHEFJBVNLYBM-UHFFFAOYSA-N	435.278	1.923	50	20	IDGD	
Cc1nc(CC(C)C)c(NC(=O)C(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])s1	763803201	JGENRJCGDCTFNH-UHFFFAOYSA-N	435.462	1.723	50	20	IDGD	
CSc1cc2c(cc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccc(F)cc1)OCCO2	763864330	ATLDMEQTJGXONM-NSHDSACASA-N	449.460	1.872	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)C(=O)Nc2cc(S(C)(=O)=O)ccc2C)cc1	763898229	NVHUVCASILSSFU-UHFFFAOYSA-N	435.527	1.585	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)CC(=O)N3)ccc1OC(C)C	763915696	FCVSOWRGSLGLPS-UHFFFAOYSA-N	426.429	1.377	50	20	IDGD	
CCOC(=O)c1c(C)csc1NC(=O)C(=O)NNC(=O)c1ccc2c(c1)OCCO2	764003628	JZNSKNKJWPZMCE-UHFFFAOYSA-N	433.442	1.404	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)on1)C(=O)Nc1ccc(NC(=O)C2CC2)nc1	764015967	BIVLREGSZRXNKR-UHFFFAOYSA-N	434.412	1.485	50	20	IDGD	
C[C@H]1CN(Cc2cccc(NC(=O)C(=O)NNC(=O)Cc3ccsc3)c2)C[C@@H](C)O1	764035293	RCFLIBNUXOTQEH-GASCZTMLSA-N	430.530	1.686	50	20	IDGD	
COC(=O)c1ccsc1NC(=O)C(=O)NNC(=O)c1ccc(F)cc1Br	764086426	UABPWGKECAPADS-UHFFFAOYSA-N	444.238	1.836	50	20	IDGD	
O=C(CCc1ccccc1)NNC(=O)C(=O)Nc1cccc(N2CCN(CC3CC3)CC2)c1	764191847	GTLFDUIHFFGACI-UHFFFAOYSA-N	449.555	1.937	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(C#N)c2)cc1NC(=O)c1ccncc1	764241814	KHDBLTJFCORMJL-UHFFFAOYSA-N	442.435	1.914	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2O)c(Br)c1	764275127	JODJWKWOLNPKHX-UHFFFAOYSA-N	438.234	1.328	50	20	IDGD	
CCCN1C(=O)CCc2cc(NC(=O)C(=O)NNC(=O)CCc3ccccc3O)ccc21	764281391	WDXOGTQAPISRGT-UHFFFAOYSA-N	438.484	1.800	50	20	IDGD	
CSc1nnnn1-c1cccc(NC(=O)C(=O)NNC(=O)C(C)(C)c2ccccc2)c1	764314160	QFEKJGXPMYWXKQ-UHFFFAOYSA-N	439.501	1.448	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccncc2)cc1OCC1CCOCC1	764354104	LTDUHMWIFGLTLG-UHFFFAOYSA-N	426.473	1.524	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)c2cnn(C)c2)sc2c1CC[C@H](C)C2	764358248	HVOPWCPPLLQLGZ-JTQLQIEISA-N	433.490	1.183	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)NCCc1ccc(F)cc1	765312288	CLDSXSZKUDFGKG-UHFFFAOYSA-N	427.480	1.157	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)c1ccc(=O)n(-c2ccccc2F)n1	765877243	AGTHPIKVMKSBDP-UHFFFAOYSA-N	428.445	1.934	50	20	IDGD	
O=C(CCOC[C@@H]1CCCO1)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	766661610	XONCCYWGSGFGAY-SFHVURJKSA-N	438.956	1.191	50	20	IDGD	
CCC(=O)N1CCCC[C@H]1C(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	766661902	ZXKILIPOFHLVAT-IBGZPJMESA-N	449.983	1.396	50	20	IDGD	
NC(=O)c1ccc(/C=C\C(=O)N2CCC[C@H]2C(=O)NNc2ncnc3ccsc23)cc1	766671379	JDRVRPUDKOYFGB-SBSDFTTDSA-N	436.497	1.938	50	20	IDGD	
COc1ccc(C)cc1-n1nnnc1SCC(=O)NNC(=O)Cc1ccccc1C	767944235	XDEZDDGHXIPHKH-UHFFFAOYSA-N	426.502	1.770	50	20	IDGD	
COc1ccc(NNC(=O)CCNS(=O)(=O)c2ccc(C(C)=O)cc2)c([N+](=O)[O-])c1	768332495	UNMBVPCDXJCUKU-UHFFFAOYSA-N	436.446	1.618	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)Nc1cccc(S(=O)(=O)N(C)C)c1	769224968	HBSFXKHTVIWDLP-UHFFFAOYSA-N	442.519	1.498	50	20	IDGD	
CC(=NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)c1sccc1O	769762581	FNLAFRVHDOMDDN-UHFFFAOYSA-N	437.543	1.948	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)N1CCN(c2ccc(C(N)=O)cc2)CC1	770649048	VJVZSGGETPQJOP-CQSZACIVSA-N	445.907	1.769	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)c1ccn(Cc2ccccc2)n1	771854494	SNZVVCYLRAMQLW-UHFFFAOYSA-N	432.528	1.905	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)ncc1Br	773521421	DANRHQSKPBKMSI-UHFFFAOYSA-N	446.305	1.691	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H]2[C@H](C)[C@H](OC)C2(C)C)c1	776065827	CYSQVJUDXLWPMW-XKQJLSEDSA-N	440.566	1.721	50	20	IDGD	
COc1ccc(CN(CC(=O)NNC(=O)c2cccc(C)c2)[C@@H]2CCS(=O)(=O)C2)cc1	777542817	UXSQJIKHBLXXAW-LJQANCHMSA-N	445.541	1.454	50	20	IDGD	
COc1c(F)cc(S(=O)(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1[N+](=O)[O-]	777629973	MNSMIWPENUYZMT-UHFFFAOYSA-N	435.393	1.552	50	20	IDGD	
C[C@H]1CCN(S(=O)(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)C1	777906633	DCUDAQYVXUTZFW-LBPRGKRZSA-N	444.560	1.370	50	20	IDGD	
C[C@@H]1CCN(C(=O)OC(C)(C)C)[C@H](C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)C1	778458251	ILLZDGXCVOAPDP-CJNGLKHVSA-N	439.534	1.887	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)c1ccc(C)cc1)C(=O)NNc1cc(Cl)nc(N)n1	779373535	QDSLCULBRKIFMV-GFCCVEGCSA-N	444.970	1.564	50	20	IDGD	
COc1cc(OC)c(Cn2nccc2NC(=O)NNC(=O)c2cccn2C)c(OC)c1	779481798	AQXSQUNZFHMUKN-UHFFFAOYSA-N	428.449	1.762	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2cccc(C(F)F)c2)c1	780365537	NQMQYCRXLZZWFD-UHFFFAOYSA-N	433.458	1.498	50	20	IDGD	
O=C(NC[C@@H]1CCC=CO1)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	780735776	UZZBVPWVFAEVAO-SFHVURJKSA-N	444.513	1.802	50	20	IDGD	
C[C@H]1CN(CC(C)(C)O)CCN1C(=O)NNC(=O)c1ccc(COc2ccccc2)o1	780946081	CZAZPTZFNHHDAF-INIZCTEOSA-N	430.505	1.990	50	20	IDGD	
CCOC(=O)COc1c(Br)cc(C)cc1C=NNC(=O)C(=O)NC1CC1	781587740	JEAJNHPFFLVROY-UHFFFAOYSA-N	426.267	1.428	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)c(OC)c1	782123066	ANXJVHJIZFJZKI-UHFFFAOYSA-N	443.441	1.333	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(F)c(NC(=O)C(=O)NNc2nc3ccccc3s2)c1	782812366	KJUPVIVSHQDHIJ-UHFFFAOYSA-N	437.478	1.768	50	20	IDGD	
O=C(NNC(=O)C(=O)NC1CC1)C(=O)Nc1cccc(Sc2ccc(Cl)cc2)c1	782964311	BZEAMRFCDJAAKM-UHFFFAOYSA-N	432.889	1.856	50	20	IDGD	
CC(C)(C)OC(=O)Nc1cnc(C(=O)NNC(=O)c2cc(Br)c[nH]2)cn1	783033901	PZHSINYIEKKUAS-UHFFFAOYSA-N	425.243	1.989	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2cnn(-c3ccccc3)c2)nc1	783264469	QZYQJOZUXIMWMU-UHFFFAOYSA-N	443.489	1.036	50	20	IDGD	
Cn1c(=NNC(=O)C(=O)Nc2ccc(S(=O)(=O)NC3CC3)cc2)sc2ccccc21	783349391	ICVQSSCEUZZWLC-UHFFFAOYSA-N	445.526	1.251	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1ccc(OC2CCCC2)c(F)c1	784004315	WAOOVDNPINLRJE-UHFFFAOYSA-N	448.476	1.725	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2nnn(Cc3noc(C)n3)c2C)ccc1OC(C)C	784727043	DSIOYFZJCATBKD-UHFFFAOYSA-N	429.437	1.197	50	20	IDGD	
O=C(NNc1nccnc1Cl)C(=O)Nc1cc(N2CCCS2(=O)=O)ccc1Cl	784777653	CYSXLUVFUOYOQD-UHFFFAOYSA-N	445.288	1.405	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(N(C)C)c(NC(=O)C(=O)NNc2ccccn2)c1	784794093	GJVIWCVSRBQENE-UHFFFAOYSA-N	434.522	1.260	50	20	IDGD	
CC(=O)N1CCN(Cc2ccccc2NC(=O)C(=O)NNc2cc(Cl)ccn2)CC1	784856418	JQELIXVSTBAELK-UHFFFAOYSA-N	430.896	1.481	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccc(Cl)c(F)c2)cc1	785178955	IXPXPGQRCJWTIO-UHFFFAOYSA-N	444.872	1.486	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2ccc(OC[C@@H]3CCCO3)cc2)n1	785227866	YUTFPJUMOAKTJJ-KRWDZBQOSA-N	428.493	1.962	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)NCc2ncnn2-c2ccccc2)c2ccccc2c1=O	787348850	UBFDEUTWLCUKQG-UHFFFAOYSA-N	446.471	1.702	50	20	IDGD	
O=C(COc1ccccc1CNC(=O)NNc1nc2ccccn2n1)NC[C@@H]1CCCO1	790215568	KTEYFVNUOFNOIN-INIZCTEOSA-N	439.476	1.230	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)N[C@H]2CCN(Cc3ccc(C)cc3)C2=O)c1	790699871	YVOZYUGPRXNFPT-IBGZPJMESA-N	426.473	1.757	50	20	IDGD	
COc1cc(C)nc(NNC(=O)NCc2cccc(N3C(=O)N[C@@](C)(C4CC4)C3=O)c2)n1	790892242	BNMYSSUGAQKXRV-NRFANRHFSA-N	439.476	1.845	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)[C@H]1CCS(=O)(=O)c2ccccc21	791003643	BTDONGGWEUOIKI-HNNXBMFYSA-N	426.498	1.707	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)CCc2ccccc2C(N)=O)c1	792013384	WGYMWSUEWUYCSQ-UHFFFAOYSA-N	446.529	1.210	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccc(NC(=O)N(C)C)c1C	792352722	HPUQHRUPGHZWAK-UHFFFAOYSA-N	443.460	1.262	50	20	IDGD	
O=C(NNc1nc2ccccn2n1)C(=O)Nc1ccc(N2CCOCC2)c2ccncc12	792395494	ZRFQBUGNGPNHQS-UHFFFAOYSA-N	432.444	1.196	50	20	IDGD	
COc1ccc(Cn2cc(NC(=O)C(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)cn2)cc1	793023738	VLISDZDFCPKNOR-UHFFFAOYSA-N	438.400	1.248	50	20	IDGD	
C[C@@](O)(CSc1cccc(F)c1)C(=O)NNC(=O)c1csc(N2CCOCC2)n1	794782261	WUGQTIGATVQTFJ-GOSISDBHSA-N	440.522	1.423	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(C)(C)[C@@H]1C(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	794894311	FZJBQTSYWRVLIS-INIZCTEOSA-N	429.477	1.984	50	20	IDGD	
Cc1ccc2c(c1)CC[C@H](C(=O)OCC(=O)NNC(=O)[C@H]1COc3ccccc3O1)O2	796298658	JSMFYXFSESVWQD-RTBURBONSA-N	426.425	1.219	50	20	IDGD	
C[C@H](C(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)[C@@H]1OCCc2sccc21	796509270	UFDNTVQSCDIDMQ-GTNSWQLSSA-N	433.442	1.911	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)NCCCNS(=O)(=O)c2ccccc2Cl)c1	798494887	MDUCLFHOVSBQJN-UHFFFAOYSA-N	435.893	1.524	50	20	IDGD	
C[C@@H]1CCNC(=O)[C@H]1NC(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1	799368055	RFASNZHPKRSWGW-HBGVWJBISA-N	435.528	1.469	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ccc3nnnn3n2)CC1)Nc1ccc(OC(F)F)cc1	802045077	JHRVJYUPCGBBIM-UHFFFAOYSA-N	447.406	1.190	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)[C@@](C)(O)Cn2c(C)cccc2=O)cc1Cl	802071646	JFAAXUWOSVSXSV-IBGZPJMESA-N	438.868	1.431	50	20	IDGD	
COC(=O)N(C)NC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(Br)s2)C1	804121412	GUDQWHOHGYKPPF-SECBINFHSA-N	440.341	1.641	50	20	IDGD	
COC[C@]1(CNC(=O)NNC(=O)c2cccc(C#N)c2)CCCN1C(=O)OC(C)(C)C	805066823	ARCREDYHISQBTL-OAQYLSRUSA-N	431.493	1.918	50	20	IDGD	
Cn1ncc(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)c1-c1ccccc1	806974040	QZXPYEQRDYSERO-UHFFFAOYSA-N	432.484	1.626	50	20	IDGD	
CCN(C)C(=O)c1cccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)c1	806974709	FVHIPBKZLVPQMG-CYBMUJFWSA-N	430.436	1.471	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)c(F)cc1Br	806977357	FRJVNLGBLCQBCV-HNNXBMFYSA-N	436.237	1.986	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)NC[C@@H](c1ccc(C)o1)N1CCOCC1	807023095	ASRWOIPLYXPKLB-INIZCTEOSA-N	432.477	1.379	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)[C@H]1CCN(c2ccccc2Br)C1=O	807371612	OQTLTWGUFZITEN-GFCCVEGCSA-N	442.310	1.739	50	20	IDGD	
COC[C@@]1(CNC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])OCCc2ccccc21	812478633	ZIJUKPBTSLKKPJ-OAQYLSRUSA-N	444.444	1.419	50	20	IDGD	
O=C(COC(=O)[C@@H]1CCCN(c2ccccc2)C1=O)NNC(=O)c1cccc([N+](=O)[O-])c1	814606559	FKVFDSNRSAAEIT-QGZVFWFLSA-N	440.412	1.342	50	20	IDGD	
CC(=NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1cc(F)c(N)c(F)c1	814689339	ZGLFWKQRHYEURO-UHFFFAOYSA-N	438.456	1.722	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CC(C)(C)O[C@](C)(C(F)(F)F)C2)cc1OC	815146023	KXJSFWFZRJKENH-SFHVURJKSA-N	433.427	1.897	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)C(=O)Nc2cc(C)c3nccn3c2)c1	815569295	NSCLIMIDXHQEFK-UHFFFAOYSA-N	446.261	1.814	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCc2nncn2C1)C(=O)Nc1ccc(OC2CCCCC2)cc1	815692151	KOBZHIOOHVKICF-AWEZNQCLSA-N	426.477	1.338	50	20	IDGD	
CNS(=O)(=O)NC1CCN(C(=O)/C(C#N)=C/c2cc(C)n([C@H](C)COC)c2C)CC1	816468621	KJQOLPMOKZLJRK-CLXYIWAZSA-N	437.566	1.264	50	20	IDGD	
CCOC(=O)[C@@H](CC(=O)NNC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1)C(C)=O	816829016	XTHKCRHQZINSDL-SFHVURJKSA-N	449.467	1.854	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)c2ccc(S(=O)(=O)NC[C@H]3CCCO3)cc2)cc1	913431434	LGTRCPPWQDZDJF-GOSISDBHSA-N	446.529	1.325	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)c2ccc(F)c(S(=O)(=O)NC(C)C)c2)c1	914710855	HJDNXLWMBSVPDM-UHFFFAOYSA-N	437.493	1.969	50	20	IDGD	
C[C@@H]1CN(c2ccc(CNC(=O)NNC(=O)COc3ccccc3[N+](=O)[O-])cn2)CCO1	916392706	ISCUOQUGXDANJN-CQSZACIVSA-N	444.448	1.124	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCc2cccc(C(=O)NC)c2)nc1	916603598	UYBWWPMZXBBJCA-UHFFFAOYSA-N	434.522	1.298	50	20	IDGD	
CSc1ncc(C(=O)NNC(=O)CCN2C[C@H](C)O[C@@H](C)C2)n1-c1ccc(F)cc1	917362908	RMTMHSHMVKWMAR-KBPBESRZSA-N	435.525	1.994	50	20	IDGD	
CC(C)[C@H](Oc1ccccc1C#N)C(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	919636869	BYFNCECEVJDVAC-IBGZPJMESA-N	440.412	1.874	50	20	IDGD	
CC(=NNC(=O)N[C@@H]1CCS(=O)(=O)C1)c1ccc(S(=O)(=O)N2CCCCC2)cc1	920381786	UJJDOLZDPRNROJ-MRXNPFEDSA-N	442.563	1.072	50	20	IDGD	
Cc1cc(S(=O)(=O)NNC(=O)c2ccc(Br)cc2)ccc1OCC(=O)O	1251406232	BYOOTLHXXOCPAU-UHFFFAOYSA-N	443.275	1.844	50	20	IDGD	
COC(=O)c1cccc([C@@H](NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)C(=O)OC)c1	1319674971	DJWBEJVZQNSLLD-QGZVFWFLSA-N	449.504	1.955	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCC(O)(Cc3ccccc3F)CC2)cc1OC	1320903209	AZVIMYPOVXLHHD-UHFFFAOYSA-N	445.491	1.674	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)(C)O	1324729752	AKLGHVITLGQQDE-QGZVFWFLSA-N	433.509	1.410	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@@H](C)[C@@H](C)C(=O)NNC(=O)c2ccc(OC)cc2)cc1	1326288245	PQVRHJOIDALMSB-OKILXGFUSA-N	442.472	1.198	50	20	IDGD	
O=C(NC[C@@]1(N2CCOCC2)CCSC1)NNC(=O)c1cncn1-c1ccccc1	1337740885	HQXPZUSARGPDMH-FQEVSTJZSA-N	430.534	1.024	50	20	IDGD	
Cc1ncc(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)c(C2CC2)n1	1339845791	FTMJTIFKWIBAGF-UHFFFAOYSA-N	430.534	1.355	50	20	IDGD	
COc1cc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CO[Si](C)(C)C)C2)n(C)n1	1779540779	OPFWJTLKGVZVKV-OXQOHEQNSA-N	438.601	1.408	50	20	IDGD	
Cn1cccc1C(=O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CO[Si](C)(C)C)C1	1779545914	RLOKDCCFPBKANP-DYESRHJHSA-N	435.597	1.573	50	20	IDGD	
COc1ccc(CCC(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)cn1	1781325326	BPMICCWYRZLEFL-AEFFLSMTSA-N	444.301	1.543	50	20	IDGD	
COc1ccc(F)c(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](F)Br)C3)C2)c1	1781335641	YJZLGPAJEIEIAM-WMLDXEAASA-N	433.249	1.968	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)COc2ccc(O)nn2)C1	1781493290	WBGUUQIZKQKHEM-STXHMFSFSA-N	440.928	1.482	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCn1cncn1)C2	1781903890	GKSCCMLCOPCRRH-IIDMSEBBSA-N	442.358	1.356	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(C4CC4)cc3)C2)C1	1782022607	JYYDXGNCZDGWGA-DEOSSOPVSA-N	449.511	1.320	50	20	IDGD	
CS(=O)(=O)c1ccc(F)c(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](F)Cl)CCO3)c1	1782152403	RXZXSNFXHNVKPM-PBHICJAKSA-N	436.864	1.207	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3c(F)c(C)nn3C)CCO2)C1	1783343103	FNAZPYPJYISEFV-PXAZEXFGSA-N	431.306	1.485	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cn(C)nc3C(F)F)CCO2)C1	1783347551	LALBVWKKLICJEB-SJCJKPOMSA-N	449.296	1.975	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccn4nccc4c3)CCO2)C1	1783349575	NTZYIWLNHBLCRL-VQIMIIECSA-N	435.322	1.951	50	20	IDGD	
CCn1nc(C(C)C)cc1C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](Cl)COC)C2)C1	1783881693	MIMICIJAGFFJPQ-MGPUTAFESA-N	426.945	1.724	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)C1(NC(=O)OC(C)(C)C)CC1)CCO2	1783884000	NIWLHXOSZXUPFZ-KUHUBIRLSA-N	445.944	1.127	50	20	IDGD	
Cn1c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]3C2)ccc1C(F)(F)F	1784090361	BBAXDLPJDUUOPM-VTPLQMEGSA-N	437.846	1.237	50	20	IDGD	
CCOC(CC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2)OCC	1784167277	SJNQWQNCFNSGDB-QZTJIDSGSA-N	425.353	1.842	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ncc(F)cc3F)[C@H]2C1	1784765738	NKGOURJDXHHOGR-UHXUCMFUSA-N	446.292	1.984	50	20	IDGD	
Cn1ncc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Cl)C[C@@H]32)c1C(F)(F)F	1785526737	FKQGDVSDDGHZKH-KYVBTAMFSA-N	426.798	1.567	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(Cl)cc4nn[nH]c34)C[C@@H]21)[C@H](F)Cl	1787447903	JQOSBDBBTCQEHU-BHCNVRCUSA-N	430.267	1.739	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4c(c3)OCO4)[C@H]2C1	1787810085	DNJNRBVNBYBQMH-MJFSBKNWSA-N	439.306	1.792	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4nccn4c3)[C@H]2C1	1788057944	WGZXRWZPAPDWEC-TUUVXOQKSA-N	435.322	1.711	50	20	IDGD	
Cc1nccnc1C(=O)NC1(c2ccc(NC(=O)c3cnccc3C(=O)NN)cc2)CCC1	1789520959	BNCGXJPPKCZJJT-UHFFFAOYSA-N	445.483	1.845	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc(O)cn3)C[C@@H]21	1790963977	QNJDTVOCZSLOMQ-STECZYCISA-N	440.338	1.483	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(OC)cc(OC)c3)C[C@@H]21	1791254231	QOKHJIOWRZTKIV-VKOGCVSHSA-N	440.924	1.551	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(C(C)(C)C)n[nH]3)C[C@@H]21	1791255545	UFLRHXSKASYODG-YXWQFLTLSA-N	426.945	1.554	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](Cl)COC)[C@H]2C1	1791257363	BZFCOYWUMXRPTD-PEDHHIEDSA-N	425.751	1.393	50	20	IDGD	
O=C(NC1(c2ccc(NC(=O)C3CCC(O)CC3)cc2)CCC1)c1ccc(B(O)O)cc1	1791706200	MSJCCLITGYJQDX-UHFFFAOYSA-N	436.317	1.665	50	20	IDGD	
Cc1nc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)CBr)ccc1F	1792870440	OUSLEZITNNBSOW-VFFTVRQLSA-N	428.302	1.763	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc3cccc(Cl)c3c1)C2)[C@@H](O)CCl	1792984125	TYDHOJOYNSBNEF-GGNLRSJOSA-N	438.311	1.691	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)CNC(=O)OC(C)(C)C	1792988187	NFAFPZUYCNUKSN-QMHWVQJVSA-N	431.961	1.754	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCl)[C@H]1CN(Cc2ccccc2)CCO1	1793111295	BOELJCDAHSMPJU-USYVTKNRSA-N	435.952	1.125	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1cccc2ncccc12)c1cccc(B(O)O)c1	1793547777	ZTSHACMMPAZFTN-WKCHPHFGSA-N	443.312	1.409	50	20	IDGD	
Cc1csc(CCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)c1	1794356942	DMPYNHLBFPVBPV-MUJYYYPQSA-N	441.557	1.940	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3cccnc3n1)C2	1795115928	VSUIWCXBSHQXOZ-XOIINTDNSA-N	433.306	1.618	50	20	IDGD	
O=C(Cc1ccc2c(c1)CCC2)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1	1796188236	FBRPUJQXLNAHBH-NUNAXRQHSA-N	432.329	1.350	50	20	IDGD	
Cc1cc(F)c(F)c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)c1	1796189514	XEBOARNYZKFJMT-BJWYYQGGSA-N	428.244	1.519	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnn2ccccc12	1796839801	PTIUMKKLSMOYPS-VWPFQQQWSA-N	435.322	1.569	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2c(cnn2C)c1	1797085711	KRSSWPLKMIDRKJ-RMIITELYSA-N	435.322	1.560	50	20	IDGD	
COc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)Br)C3)ccc1O	1798953834	INHXMBUZCGDMCO-YGSHXTJESA-N	427.295	1.387	50	20	IDGD	
COc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)Br)C3)ccc1C	1798972441	LKZSKIHRJWVCOH-FAYQHZLMSA-N	425.323	1.990	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H]1[C@H]3COC[C@H]31)C2	1799220296	CMUFAJKJVRZQFI-UXAIDIRLSA-N	443.456	1.664	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(-c2ccccc2)[nH]n1)c1cccc(B(O)O)c1	1799384876	ONXLDLIFYGIODL-ACDBMABISA-N	444.300	1.322	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1cc(Br)ccc1O)[C@@H](O)CCl	1800048334	XUSZOQUCZOPQDD-FQLMCAECSA-N	445.741	1.935	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Nc1ccccn1)C2	1800759569	WKSSXXDTXORYRN-QKDZRIPBSA-N	425.327	1.255	50	20	IDGD	
Cc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)Br)cc(C)c1O	1800763225	VDGHKESLRANQRU-HNKHHVNMSA-N	425.323	1.996	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CCc2ccccc2O1	1800950006	YWIAVYPKAVTGAC-NZGUISNBSA-N	432.593	1.821	50	20	IDGD	
CCCc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCC(=O)NN(C)C)cc1	1801012506	LMWOHVAXDFQMCM-HATOLVCRSA-N	430.549	1.215	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc3c(n2)OCCO3)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803138683	DNJPYVOIEFLVCO-QILLFSRXSA-N	446.891	1.167	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)C2=CCCS2)[C@H]1c1cccnc1	1803639725	IQDVOCLSSOVCBU-OXJNMPFZSA-N	431.562	1.481	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)[C@@H]1Cc2ccccc2CN1	1808235926	WNNNOFOEODNIGE-BURNTYAHSA-N	442.947	1.402	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)CN2CCN(C(C)=O)CC2)[C@@H]1c1cccnc1	1808264732	BXIUZXIOTQGMEG-SVFBPWRDSA-N	449.983	1.269	50	20	IDGD	
Cc1nccn1CC(=O)N1CC[C@H](CNC(=O)[C@@H](F)Br)[C@H]1c1cccnc1	1808679383	XCVQZAOFHKZFGP-DJIMGWMZSA-N	438.301	1.983	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)[C@H]3CCCSC3)CC2)C1	1809977597	DYHOSSHZWVENNF-SFHVURJKSA-N	430.379	1.354	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)[C@H](N)c2ccccn2)[C@H]1c1cccnc1	1812864345	OIFWPJOHOLPCAV-PLYYQAHHSA-N	446.349	1.966	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)cn1C	1813071442	SAPQCOZTSFISKN-XMSQKQJNSA-N	440.548	1.421	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H]2CCC(=O)NC2)n[nH]1	1814524771	ADEQFJALNSRTDV-GMXVVIOVSA-N	426.315	1.711	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(O)c([N+](=O)[O-])c2)[nH]n1)[C@@H](O)CCl	1814872770	NSDBGDUFEOAMSO-WFASDCNBSA-N	437.840	1.929	50	20	IDGD	
CN[C@H](CC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@](C)(Cl)CCl)CC2)C(=O)O	1815081595	DRGFZDNRRGXJMB-GXEAXYKVSA-N	437.349	1.354	50	20	IDGD	
CCS(=O)(=O)CC(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](C)CBr)[nH]n1	1815171716	QWUIQSSBTILMPX-YPMHNXCESA-N	449.371	1.868	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3cc(=O)n4[nH]cnc4n3)sc2C1	1815330254	MIWDQGZBGPCGQY-IUCAKERBSA-N	435.897	1.117	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)CCc2cnn(C)c2)n[nH]1	1817517595	UKXQSGUHLIHMBI-KRWDZBQOSA-N	444.540	1.141	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](F)Br)[nH]n1)c1cnc(O)nc1O	1818021532	YUPXPJFBTLLTJF-GXSJLCMTSA-N	443.233	1.607	50	20	IDGD	
C[C@@H](Cn1cncn1)C(=O)N[C@H]1CCc2nc(NC(=O)CO[Si](C)(C)C)sc2C1	1820165384	FHGVIMUNXOJVKR-STQMWFEESA-N	436.614	1.834	50	20	IDGD	
O=C(Cn1ccncc1=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](F)Br)[nH]n1	1821656853	RAOXUAZKDYZMLD-ABAIWWIYSA-N	441.261	1.349	50	20	IDGD	
CN(C)C(=O)NCC(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1	1822999788	XTZOZRCSUVZUTK-RDDDGLTNSA-N	436.307	1.017	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(=O)n3[nH]cnc3n2)CC1	1824011094	MWKZVYKHAOHOAR-MRXNPFEDSA-N	448.955	1.916	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](O)C(C)C)CC1	1824254235	QGXNSALRKCZHQG-TZPGLHDLSA-N	445.564	1.757	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CN(CCO)CCO)CC1	1824619217	UUNFYJWROMAZEI-RBUKOAKNSA-N	432.005	1.300	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](C)n1ccccc1=O)CC2	1826000592	YBYYTDPPPIWHHX-AGIUHOORSA-N	438.937	1.732	50	20	IDGD	
COCCC(=O)N1CCC([C@@H]2CCCCN2C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)CC1	1827680697	DSNVAHAECQJCNC-JWGRYVKWSA-N	431.537	1.777	50	20	IDGD	
CC[S@](=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1	1828786609	UMKCIHHPOYIGPN-PBYQXAPXSA-N	442.626	1.138	50	20	IDGD	
CC(C)O[C@H](C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1	1829020680	WGHNBMCKPHZGEE-DYESRHJHSA-N	430.354	1.413	50	20	IDGD	
Cc1n[nH]c(C)c1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1	1829165870	HPMFPMZLLUTBJT-FQEVSTJZSA-N	438.337	1.253	50	20	IDGD	
O=C([C@H](O)CCl)N1CCC([C@H]2CCCCN2C(=O)c2cnc3snnc3c2)CC1	1829623872	RVBLRTBUXKRHBF-HZPDHXFCSA-N	437.953	1.919	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccc(OC)c(O)c3)CCO2)C1	1830246099	CMMGNVXDQVZEFU-HRAATJIYSA-N	440.924	1.417	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1C[C@@H]1C1CC1)CCO2	1830506337	YGQWIKVRBFQUKZ-PASDCYSWSA-N	429.355	1.662	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1830533158	GZOFBCITQUNYGR-SUMWQHHRSA-N	439.778	1.739	50	20	IDGD	
CC[C@H](C)[C@H](O)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1	1831517009	LJWKFOZMVXVBEF-USJZOSNVSA-N	425.353	1.086	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)CN3CCOC3=O)CC2)CC1	1833383984	AEDNMLHFGLDKTJ-KRWDZBQOSA-N	428.961	1.418	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@](C)(O)C(F)(F)F)CC2)CC1	1833641799	PCVNQCHRZHGXKO-PBHICJAKSA-N	443.894	1.125	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)CCc3cnc[nH]3)CC2)CC1	1833789381	FGEGZULBDBZZHI-AWEZNQCLSA-N	440.386	1.697	50	20	IDGD	
Cc1oc(C(C)(C)C)cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1	1834195641	OMWYAGHREXFBKN-KKSFZXQISA-N	442.940	1.555	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)c3cncnc3)CC2)CC1	1834234619	ITNRELDQIVSBIY-CQSZACIVSA-N	438.370	1.693	50	20	IDGD	
CC(C)N[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1)C(C)C	1835897520	DJKJDJJOECQIGK-PZJWPPBQSA-N	443.661	1.317	50	20	IDGD	
C[C@H](Cc1ccccn1)C(=O)N1CCOC[C@@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1837717807	ONJKGZAGYWFMCS-XMSQKQJNSA-N	449.624	1.568	50	20	IDGD	
C=CC(=O)N[C@@H](C)C(=O)N1CCC(OC2CCN(C(=O)CO[Si](C)(C)C)CC2)CC1	1838429212	JGGXRTZDYNZSJG-INIZCTEOSA-N	439.629	1.527	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccncc3)CCO2)C1	1839061456	VHOSCRRDVGELNN-VQIMIIECSA-N	440.338	1.254	50	20	IDGD	
O=C(CCCC(F)(F)F)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839198459	DUKXGRWHQCUQLG-TZMCWYRMSA-N	449.239	1.866	50	20	IDGD	
Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1839427925	AAMJTTMHOANJLM-MAUKXSAKSA-N	447.822	1.647	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3c(F)cncc3F)C2)C1	1840033640	MCRCVEHBWPFIAI-DIFFPNOSSA-N	448.264	1.213	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccc(F)cc3F)C2)C1	1840155544	DZHPWVZJUQEPSP-JXFKEZNVSA-N	446.878	1.218	50	20	IDGD	
CN(C)c1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)nc1	1840186340	JTDKEQJRZDBVNF-SFHVURJKSA-N	431.320	1.021	50	20	IDGD	
O=C(c1c[nH]c2ncccc12)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840187534	HRVSARNYVGJLDD-SFHVURJKSA-N	427.288	1.437	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)c2cc3ccc(Cl)cc3[nH]2)C1	1841000819	JJLLTWDBSISFAC-UHFFFAOYSA-N	437.692	1.632	50	20	IDGD	
Cc1cnoc1C(=O)N1CC2(CCCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C1	1841924699	SJEOGYUDTYDSLX-ZDUSSCGKSA-N	426.901	1.932	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC2(CCCN2C(=O)CCNC(=O)c2ccc[nH]2)C1	1842016240	OBKQWEWAKOEKOR-ZDUSSCGKSA-N	425.327	1.512	50	20	IDGD	
O=C(Cc1cc(F)ccc1Cl)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843013197	TXGWTAHWMMQWIA-UHFFFAOYSA-N	430.672	1.219	50	20	IDGD	
CN(CC(=O)N1CC2(CCCN2C(=O)[C@H]2CC2(F)F)C1)NC(=O)NCc1ccccc1	1843853656	QMQMCSITQCFMFG-MRXNPFEDSA-N	435.475	1.191	50	20	IDGD	
CC(C)(C)OC(=O)N[C@]1(C(=O)N2CCCC23CN(C(=O)C(Cl)Cl)C3)CCOC1	1845208979	IHLGXLVPYILJKT-GOSISDBHSA-N	436.336	1.677	50	20	IDGD	
CCNC(=O)N[C@@H](C)C(=O)N1CC2(CCCN2C(=O)/C(C#N)=C/c2ccc(F)cc2F)C1	1845871339	PUMNGECZJAKLTJ-FSEGOYHTSA-N	445.470	1.783	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC[C@H]2[C@@H]1CCN2C(=O)c1ccccc1OC(F)(F)F	1847366590	VDLQMTNNBUHUBA-IRXDYDNUSA-N	448.206	1.394	50	20	IDGD	
O=C(CN1CCN(C(=O)NNC(=O)c2cc(Br)c[nH]2)CC1)Nc1ccccc1	23391384	UXOXEJFQFSAKAI-UHFFFAOYSA-N	449.309	1.388	50	20	IDGD	
CC(C)(C)C(=O)NCCCC(=O)NNC(=O)c1ccc(CS(=O)(=O)c2ccccc2)o1	26907725	SQAWDLLRSRJBCA-UHFFFAOYSA-N	449.529	1.957	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@@H](c2ccccc2)N2CCCCC2=O)c2ccccc2c1=O	110938485	BTWHARQBCILCJN-OAQYLSRUSA-N	447.495	1.931	50	20	IDGD	
CC[C@H](C)C(=O)N1Cc2ccccc2C[C@H]1C(=O)NNC(=O)CNC(=O)c1cccs1	725739868	NUHLHBUTWGLEBH-YOEHRIQHSA-N	442.541	1.625	50	20	IDGD	
CNS(=O)(=O)c1cccc(S(=O)(=O)NNC(=O)c2c(Cl)cccc2Cl)c1	727796007	AOVIJVLYNYWQIT-UHFFFAOYSA-N	438.314	1.525	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1)C1CCN(c2ncccn2)CC1	728890609	XSRQNAGKADILQO-IBGZPJMESA-N	440.523	1.892	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)NCc1nnc2c(Cl)cc(C(F)(F)F)cn12	728944456	ZAPZAURROWWOCB-UHFFFAOYSA-N	427.774	1.870	50	20	IDGD	
NC(=O)CSc1ccccc1NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1	729043484	SYLGTTXBYQWAAK-UHFFFAOYSA-N	429.506	1.123	50	20	IDGD	
CS(=O)(=O)CCNC(=S)NNC(=O)c1cn(-c2ccccc2)nc1-c1ccccc1	729157591	AQKVHKHEWZFLRZ-UHFFFAOYSA-N	443.554	1.693	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)[C@H]1CCCN(S(=O)(=O)c2ccccc2)C1	729450659	KAQYWZUPMBXBAG-SFHVURJKSA-N	440.525	1.890	50	20	IDGD	
COc1cc(C(=O)NCC(=O)NNC(=O)c2cccc3ncccc23)cc(OC)c1OC	730287020	MNTHRQIFKLKKTO-UHFFFAOYSA-N	438.440	1.452	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)N1CCCN(S(=O)(=O)c2ccccc2)CC1	731499978	UPASMYAKFQOEOW-UHFFFAOYSA-N	432.502	1.446	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCCOc2ccc([N+](=O)[O-])cc2)nc1	731761666	XWVVASQIUOYAKR-UHFFFAOYSA-N	438.466	1.382	50	20	IDGD	
COc1ccc(C)cc1N1C[C@H](C(=O)NNC(=O)CCN2C[C@H](C)O[C@@H](C)C2)CC1=O	732261333	MCZIZFJZKNGQDG-YESZJQIVSA-N	432.521	1.003	50	20	IDGD	
Cn1c(N)c(C(=O)/C(C#N)=C/c2csc(-c3cccc([N+](=O)[O-])c3)n2)c(=O)n(C)c1=O	733193295	XXNIMZQKFXKVNC-IZZDOVSWSA-N	438.425	1.488	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)[C@@H]1CCCCN1C(=O)OC(C)(C)C	734240281	MPSVYPWRHCHACS-ZDUSSCGKSA-N	429.518	1.631	50	20	IDGD	
CCc1nc(COc2ccc(C(=O)NNC(=O)c3nnc(O)c4ccccc34)cc2)no1	734417280	OGCXKUJHAJIHTN-UHFFFAOYSA-N	434.412	1.935	50	20	IDGD	
COCCOc1ccc(-n2nc(C)c(C(=O)NNC(=O)c3cccc(N(C)C)c3)n2)cc1	734990305	QXYFRLJRIWGJJL-UHFFFAOYSA-N	438.488	1.742	50	20	IDGD	
CCOCCCN1CCC(=NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)[C@H](C)C1	735227662	FMJRVQCJZCGGQD-CYBMUJFWSA-N	430.958	1.842	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)c2ccc(=O)n(-c3ccccc3)n2)cc1C	736774448	DBVWFJBWJSUTKY-UHFFFAOYSA-N	440.481	1.783	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)Cc2csc(-c3ccoc3)n2)cc1OC	738851970	WOBMVDKMFNFNST-UHFFFAOYSA-N	445.453	1.967	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCN(c2cccc(Cl)c2)C1=O)C1CCN(c2ncccn2)CC1	742067646	UEMHTOYWDVTXSR-QGZVFWFLSA-N	442.907	1.547	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)c2ccc(S(=O)(=O)CC(N)=O)cc2)c1	742470639	WDNZVTHTDMBPCC-UHFFFAOYSA-N	447.513	1.217	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@@H]1CCCC[C@@H]1NC(=O)NNC(=O)CNC(=O)c1ccco1	743578249	WULCXZLVLGOXBN-KBPBESRZSA-N	437.497	1.423	50	20	IDGD	
COc1ccc(C=O)c(OCC(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)c1	744620145	FWIRYMKALOAEBU-UHFFFAOYSA-N	449.485	1.051	50	20	IDGD	
Cc1ccc(N2CC[C@H](NC(=O)NNC(=O)c3nn(-c4ccccc4)cc3O)C2=O)cc1	745852630	SYLHZYGCXHQZFQ-KRWDZBQOSA-N	434.456	1.636	50	20	IDGD	
COc1cc2c(cc1CNC(=O)NNc1ccc(S(=O)(=O)NC(C)C)cn1)O[C@H](C)C2	746345407	MNIRTBRNJUADMZ-CYBMUJFWSA-N	449.533	1.927	50	20	IDGD	
Cc1ccc([C@@H](CN2CCOCC2)NC(=O)NNC(=O)Cc2cn3ccccc3n2)cc1	746743318	URCFIIYSDIBAIQ-HXUWFJFHSA-N	436.516	1.589	50	20	IDGD	
O=C(NNC(=O)c1ccc2noc(-c3ccc(F)cc3)c2c1)N[C@@H]1CCS(=O)(=O)C1	746833751	GGMNRCKMZDSMRZ-CQSZACIVSA-N	432.433	1.765	50	20	IDGD	
O=C(CCCN1C(=O)c2ccc(Br)cc2C1=O)NNC(=O)Cc1ccncc1	747325949	AYZBMPKWFXRGRJ-UHFFFAOYSA-N	445.273	1.610	50	20	IDGD	
NS(=O)(=O)c1ccc(C(=O)NNC(=O)Cc2ccc(Cl)cc2)cc1Br	748050131	FGFDDCODUVOWOS-UHFFFAOYSA-N	446.710	1.754	50	20	IDGD	
COc1ccc(-c2nnc(S)n2CC(=O)NNC(=O)COc2ccc(C#N)cc2)cc1	751199444	AFSXTWAXJZMSPG-UHFFFAOYSA-N	438.469	1.340	50	20	IDGD	
COc1ccc(Br)cc1S(=O)(=O)NNC(=O)CNC(=O)c1cccs1	751280431	QTJMEZOLJRSHDC-UHFFFAOYSA-N	448.320	1.259	50	20	IDGD	
Cc1ccc2ncc(C=NNC(=O)c3cccc(S(=O)(=O)N4CCOCC4)c3)n2c1	755472007	LVXSYIPMBXIXKS-UHFFFAOYSA-N	427.486	1.428	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)Nc1cccc(C(=O)N2CCOCC2)c1	755926086	FXDXVDQPAVJCPT-UHFFFAOYSA-N	442.472	1.789	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2cccc(-n3cccn3)c2)cc1	755934207	ZPMNCXPTANEDRN-UHFFFAOYSA-N	442.501	1.654	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)Nc2ccc(N3CCNC(=O)C3)c(Cl)c2)cc1	755939019	ZVFJQXUXYJHJTH-UHFFFAOYSA-N	447.879	1.517	50	20	IDGD	
Cc1cccn2c(NC(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)c(-c3ccccc3)nc12	756287320	SLDHJIIZSKGESY-OAHLLOKOSA-N	427.486	1.897	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)Nc2cc(F)cc(S(N)(=O)=O)c2)n[nH]1	756517641	YKYIIBFDSLUTNB-UHFFFAOYSA-N	448.436	1.338	50	20	IDGD	
O=C(Cn1cc(NC(=O)NNC(=O)c2cc(F)ccc2Br)cn1)NC1CC1	756797359	ZKVWKUSOSHBZLK-UHFFFAOYSA-N	439.245	1.530	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CN2C(=O)N[C@]3(C[C@@H](C)C[C@@H](C)C3)C2=O)cc1C	757633254	JXYHKJVXUVXKKW-SACXKMNMSA-N	443.504	1.136	50	20	IDGD	
Cn1cnn(-c2ccc(NC(=O)NNC(=O)c3cc(F)ccc3Br)cc2)c1=O	757863737	VDHLYLSTOZQUHV-UHFFFAOYSA-N	449.240	1.939	50	20	IDGD	
Cc1c(C(=O)NNC(=O)COc2ccc(C#N)cc2)cnn1CCO[C@@H]1CCCCO1	758060187	TZIFPWYPLIXSMX-HXUWFJFHSA-N	427.461	1.446	50	20	IDGD	
CCc1nnc(O)c(C(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)c1CC	758236194	OSMDNELROWFBFI-UHFFFAOYSA-N	436.513	1.651	50	20	IDGD	
O=S(=O)(CBr)N1CCN(S(=O)(=O)c2cccc(Cl)c2F)CC1	763205967	JYJXQWRDFKCTIW-UHFFFAOYSA-N	435.724	1.468	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2Br)cc1F	763483443	SORVLNOKIBUIMJ-UHFFFAOYSA-N	438.209	1.775	50	20	IDGD	
COc1ccccc1OC[C@H](C)CNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1	763497276	DRDWGZCFPNLZPV-MRXNPFEDSA-N	442.520	1.747	50	20	IDGD	
CC(=O)NNC(=O)C(=O)Nc1cccc(C(=O)OC[C@@H]2CCCN2C(=O)OC(C)(C)C)c1	763516780	NHIPLSXBUDYWDO-INIZCTEOSA-N	448.476	1.349	50	20	IDGD	
O=C(NNC(=O)c1ccccc1O)C(=O)Nc1cccc(-c2nnc3n2CCCCC3)c1	763528161	WHUBLXHHNNDOTP-UHFFFAOYSA-N	434.456	1.777	50	20	IDGD	
CCCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2c[nH]c3ccccc23)cc1	763535553	HPKZGHHFOBCMTB-UHFFFAOYSA-N	443.485	1.719	50	20	IDGD	
O=C(NNC(=O)c1ccccc1F)C(=O)Nc1ccc(Cl)c(-n2nnnc2C2CC2)c1	763557013	SLQKWLQSCMIUPC-UHFFFAOYSA-N	443.826	1.732	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2nn(-c3ccc(C#N)cn3)cc2C)c1	763648800	WTQXZKOQAFCZEC-UHFFFAOYSA-N	447.455	1.229	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(NC(=O)C(C)C)cc1	763657781	RRJPGVBRMFUEKV-UHFFFAOYSA-N	428.445	1.455	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)n(-c2ccc(F)cc2)n1	763678587	HMVADARSLXASIE-UHFFFAOYSA-N	436.403	1.356	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccc(-c2noc(C)n2)c1	763680580	HASNRTJOKRSEJG-UHFFFAOYSA-N	439.428	1.609	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)C(=O)Nc2cc(F)ccc2OC[C@@H]2CCCO2)c1	763757662	JXHLUWXQRDPNAK-KRWDZBQOSA-N	444.463	1.849	50	20	IDGD	
Cc1cc(Cl)ncc1NC(=O)C(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12	763792003	ZVGXXYMHINDMJC-UHFFFAOYSA-N	442.863	1.734	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)C(=O)Nc1cc(F)c(N2CCCC2)c(F)c1	763839443	GWLPNVXNQIZZIG-UHFFFAOYSA-N	436.390	1.869	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(OCCN(C)C)cc2)c1C	763849285	KQKGITXFWMJRTR-QGZVFWFLSA-N	442.516	1.797	50	20	IDGD	
O=C(Cc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1ccc(C(=O)N2CCOCC2)cc1	763932735	SEVYJYFPAYJBJG-UHFFFAOYSA-N	444.875	1.141	50	20	IDGD	
CC(C)CCOc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1	764077138	HSSMVZLTZUTUEN-UHFFFAOYSA-N	447.513	1.915	50	20	IDGD	
C[C@H]1CN(Cc2ccccc2NC(=O)C(=O)NNC(=O)c2ccc(Cl)nc2)C[C@H](C)O1	764099922	DUOCPZWDKMKBBZ-KBPBESRZSA-N	445.907	1.744	50	20	IDGD	
COc1cc(OC)c(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(C)cc3)[nH]n2)cc1F	764111832	GJFLYSGAUJCLTM-UHFFFAOYSA-N	441.419	1.941	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1)C(=O)Nc1cccnc1	764180215	ZCISBDPMIKZJCD-OAQYLSRUSA-N	429.480	1.795	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2ccc(C#N)cc2)cc(OC)c1Br	764181829	HJLVLSJKROZQTQ-UHFFFAOYSA-N	447.245	1.738	50	20	IDGD	
COc1cc(Br)c(NC(=O)C(=O)NNC(=O)Cc2ccccn2)cc1OC	764271237	YVPGYPVNCFKTTQ-UHFFFAOYSA-N	437.250	1.190	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C(=O)Nc1cc(S(=O)(=O)NC)ccc1C)c1ccccc1	764328993	IVJKAVFJYYGLNG-INIZCTEOSA-N	432.502	1.183	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)C(=O)Nc1cccc(CS(C)(=O)=O)c1C)c1ccccc1	764330296	UBLBXOGTUSATHB-QGZVFWFLSA-N	431.514	1.819	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)CCCc2cccs2)cc1-n1nnnc1C	764340065	RKMIGFKEWFFTSC-UHFFFAOYSA-N	443.489	1.150	50	20	IDGD	
CCNC(=O)c1ccc(C)c(NC(=O)C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c1	764342998	LOPSYSZIEMFWED-UHFFFAOYSA-N	434.456	1.330	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccncc2)cc1OCc1cccnc1	764352673	AJECDVACWGORTL-UHFFFAOYSA-N	435.440	1.393	50	20	IDGD	
O=C(NNC(=O)C(F)(F)Oc1ccccc1)C(=O)Nc1ccc(-n2cccn2)c(F)c1	764369531	GHAQTFDSHSPUOO-UHFFFAOYSA-N	433.346	1.769	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)cc1F	764381818	AEZVANMGTJUBFH-UHFFFAOYSA-N	447.448	1.702	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3ccnc(N4CCCC4)n3)n[nH]2)cc1OC	765597526	INZUCMPMJUPGDD-UHFFFAOYSA-N	437.460	1.559	50	20	IDGD	
Cc1ccc(Br)c(S(=O)(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1	765641795	JZOMCJVAFYAJKF-AWEZNQCLSA-N	427.276	1.907	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3ccc(Br)o3)CC2)cc1	765749612	ZHNUVGKFNBKOPL-UHFFFAOYSA-N	435.322	1.929	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNS(=O)(=O)c2cc([N+](=O)[O-])c(O)cc2C)cc1	766312493	TXYZPDHQLISVCW-GFCCVEGCSA-N	439.446	1.785	50	20	IDGD	
Cc1[nH]nc2ncc(C(=O)NNC(=O)CN3CCN(Cc4ccccc4Cl)CC3)cc12	766659915	JDOJCHUHXPLSFG-UHFFFAOYSA-N	441.923	1.499	50	20	IDGD	
CC(C)NS(=O)(=O)c1cc(C(=O)NNc2ccccc2S(C)(=O)=O)ccc1F	766670348	XUXBOKCTFDAIOQ-UHFFFAOYSA-N	429.495	1.673	50	20	IDGD	
O=C(COC(=O)COc1ccc2c(c1)CCCC2)NNC(=O)c1cccc([N+](=O)[O-])c1	767527279	JWRDSQNOBMNSLY-UHFFFAOYSA-N	427.413	1.857	50	20	IDGD	
C[C@@]1(CNC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)CCO[C@@H]1C1CC1	768529561	ZSISROILKFWPQZ-GGAORHGYSA-N	429.565	1.734	50	20	IDGD	
CC1(C)CCC[C@]2(C1)NC(=O)N(CC(=O)NNC(=O)c1cc(-c3ccccc3)on1)C2=O	768570638	HGTNHLQRNXLZOO-JOCHJYFZSA-N	439.472	1.993	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)CSc2ccc(Cl)cc2)cn1	770211265	BGJNJUPRKFHEFX-UHFFFAOYSA-N	428.923	1.539	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cnc3c(c2)NC(=O)CO3)ccc1OCCC(C)C	770599653	XDJSVXOMFYGXMG-UHFFFAOYSA-N	428.445	1.921	50	20	IDGD	
CN(CC(=O)NNc1ccnc(Br)c1)S(=O)(=O)c1cccc([N+](=O)[O-])c1	771537303	KLHMOPCXCMEDGL-UHFFFAOYSA-N	444.267	1.516	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2cnc3c(c2)CN(C(=O)OC(C)(C)C)CC3)n1	773724393	PCLSZNDDPKKQNZ-UHFFFAOYSA-N	443.464	1.255	50	20	IDGD	
CC(C)c1nccnc1NNC(=O)C(=O)Nc1ccc(OCCN2CCN(C)CC2)cc1	773992973	PIRABKUHBHFRBO-UHFFFAOYSA-N	441.536	1.308	50	20	IDGD	
Cc1cc(S(N)(=O)=O)ccc1CNC(=O)NNC(=O)[C@@H](C)Oc1cccc(C)c1C	775204239	YQNTWLSRZRFHEW-OAHLLOKOSA-N	434.518	1.557	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)NCc2ccc(C(=O)NNc3cnccn3)cc2)cc1	775279481	YFLDBVJIFWSUDC-UHFFFAOYSA-N	440.485	1.670	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1)NOC1CCCC1	775485694	CZPWVHIZZVXXIS-UHFFFAOYSA-N	432.502	1.983	50	20	IDGD	
O=C(NNC(=O)c1cc2ccccc2cc1O)Nc1ccnn1[C@H]1CCS(=O)(=O)C1	776055913	JMBPNBZEZDPHPK-AWEZNQCLSA-N	429.458	1.568	50	20	IDGD	
O=C(COC(=O)c1cccc([N+](=O)[O-])c1N1CCOCC1)NNC(=O)c1ccccc1	776449157	XLFALQMCOWYONH-UHFFFAOYSA-N	428.401	1.049	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)N[C@@H]2C[C@H](OCC)[C@H]2OC)c2ccccc2c1=O	776519623	ANGYGHOOJXEQAS-RYRKJORJSA-N	431.493	1.333	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNS(=O)(=O)c2cc(F)c(OC)c([N+](=O)[O-])c2)c1	777596902	FOLNPKMZYODHOZ-UHFFFAOYSA-N	429.382	1.383	50	20	IDGD	
C=CCc1cc(C(=O)N2CCN(S(=O)(=O)CBr)CC2)cc(OC)c1OC	777778123	XNYOAFIZTXYRDN-UHFFFAOYSA-N	447.351	1.872	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)c2ccc(S(=O)(=O)N[C@@H](C)CC)cc2)nc1C	778428940	FWBGDJPJMSWXKO-LBPRGKRZSA-N	435.506	1.795	50	20	IDGD	
COC[C@@H](C)n1c(C)cc(/C=C(\C#N)C(=O)N2CC(n3cc(C(=O)OC)nn3)C2)c1C	779550929	YSPCYYARSFVCRC-BYNSURFDSA-N	426.477	1.681	50	20	IDGD	
CCC[C@@H]1CN(C(=O)OC(C)(C)C)CCN1C(=O)NNC(=O)CNC(=O)c1ccco1	781801372	UBNLLXGWNKPHOI-CQSZACIVSA-N	437.497	1.472	50	20	IDGD	
Cc1ccc(NC(=O)N2CCN(CC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)CC2)cc1	782052688	JDVPMWDLQREVCB-UHFFFAOYSA-N	440.460	1.514	50	20	IDGD	
CC(C)C(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)c1	782892321	BRUMPJQATWBENI-UHFFFAOYSA-N	436.472	1.496	50	20	IDGD	
O=C(NNc1ccc(-n2cccn2)nn1)C(=O)Nc1cnn(Cc2ccc(Cl)cc2)c1	783437027	QTWWFPGNUGHHLG-UHFFFAOYSA-N	437.851	1.642	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C)c(C)c(NC(=O)C(=O)NNc2cc(C)ncn2)c1	783945285	JTNXOCUEPDSUDO-UHFFFAOYSA-N	434.522	1.514	50	20	IDGD	
CN1CCc2ccc(NC(=O)C(=O)NNc3ccc(S(=O)(=O)NC4CC4)cc3)cc21	784210494	QTVZAPZPVIBKIZ-UHFFFAOYSA-N	429.502	1.201	50	20	IDGD	
CCCCNS(=O)(=O)c1cccc(NC(=O)C(=O)NNc2cccnc2Cl)c1	784839502	YLBKWHVLIIUQSJ-UHFFFAOYSA-N	425.898	1.895	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNc2c(F)cc(F)cc2Br)cn1C	785011357	YMZFJRJGBYYOAS-UHFFFAOYSA-N	431.193	1.934	50	20	IDGD	
Cn1c(=O)nc(O)c2c(C(=O)NNC(=O)NCc3ccc(Cl)cc3)cc(C3CC3)nc21	787433015	YCDGUNTXGHFQHM-UHFFFAOYSA-N	442.863	1.709	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNc2ccc(Br)cn2)cccc1N1CCNC1=O	787555895	QVGBEOCTKKMTLN-UHFFFAOYSA-N	433.266	1.764	50	20	IDGD	
CCc1c(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cnn1C1CCCC1	789727396	LLLBJYFVWAPYIH-UHFFFAOYSA-N	433.534	1.886	50	20	IDGD	
Cc1noc(-c2ccc(C(F)(F)F)cc2NC(=O)C(=O)NNC(=O)Cc2ccccn2)n1	789735215	VATUBBQPEBQBFB-UHFFFAOYSA-N	448.361	1.787	50	20	IDGD	
Cc1ccn(C[C@](C)(O)C(=O)NNC(=O)[C@@H](C)Oc2c(C)cc(Cl)cc2C)c(=O)c1	790483082	IBMNRBDZMKYPPO-VFNWGFHPSA-N	435.908	1.793	50	20	IDGD	
Cc1c(NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cccc1NC(=O)N(C)C	791912591	ZOMVXRHGALGCTJ-UHFFFAOYSA-N	437.460	1.802	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)cc(-n2cccn2)c1	792368912	SNDMIXXDTGDBGX-PMACEKPBSA-N	449.467	1.540	50	20	IDGD	
CN(C)N(C(=O)c1ccc(NS(=O)(=O)c2ccccc2)cc1)[C@H]1CCS(=O)(=O)C1	792850019	NKVJIGVQCVRXPP-KRWDZBQOSA-N	437.543	1.593	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N2CCO[C@]3(CCO[C@H]3C)C2)cc1Br	792930803	AZICWKYKBBEBKQ-APPDUMDISA-N	428.283	1.692	50	20	IDGD	
COc1ccccc1CC(=O)N1CCC(NC(=O)NNC(=O)c2cccc(C)n2)CC1	792953669	VSJTWERKHDBYNO-UHFFFAOYSA-N	425.489	1.576	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNc3ccc4c(=O)[nH]ccc4c3)cn2)C[C@H](C)O1	793064446	AONPXYRNDHHNJY-KBPBESRZSA-N	436.472	1.619	50	20	IDGD	
O=C(NNc1ccc2c(=O)[nH]ccc2c1)C(=O)Nc1ccc(C(=O)NCC(F)(F)F)cc1	793066096	RYCDDTLVMLVLNG-UHFFFAOYSA-N	447.373	1.902	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1	795168670	SCMVZKSURFHLNN-UHFFFAOYSA-N	430.446	1.788	50	20	IDGD	
CCOC(=O)c1cc(S(=O)(=O)NNC(=O)COc2ccccc2O)c(F)cc1C	795822381	FBACRKPMWQWGOF-UHFFFAOYSA-N	426.422	1.405	50	20	IDGD	
Cn1cc2c(n1)CCC[C@@H]2C(=O)NNC(=O)c1ccc(CSc2nncn2C)cc1	798825291	NGZCIHFHSDDQOY-HNNXBMFYSA-N	425.518	1.722	50	20	IDGD	
CCOc1ccc([N+](=O)[O-])cc1NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1	799236738	WIOCFDUBAFNXSB-UHFFFAOYSA-N	429.437	1.853	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)Nc2ccc3c(c2)OCC(=O)N3C)cc1	799244586	ICKQPFVQFPBWNT-CYBMUJFWSA-N	426.429	1.865	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)c2cccc(O)n2)c1	801600138	LVYQPOZXALMFSP-UHFFFAOYSA-N	442.453	1.671	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccc(OC(F)F)nc2)c1	801954928	AEPRGRYFVQANPH-UHFFFAOYSA-N	429.405	1.400	50	20	IDGD	
O=C(NNC(=O)[C@H]1CC(=O)N([C@H]2CCS(=O)(=O)C2)C1)Nc1ccc(Cl)cc1Cl	802088009	IHFQUWOFGYFPRO-ONGXEEELSA-N	449.316	1.182	50	20	IDGD	
COc1ccc(Cl)c(NC(=O)NNC(=O)[C@@H](C)NS(=O)(=O)c2cccs2)c1	802108238	KZQLERWIJYENSR-SECBINFHSA-N	432.911	1.930	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2ccc(Br)c3cccnc23)CCS(=O)(=O)C1	802569267	GMAZCPNYFDDQDJ-INIZCTEOSA-N	441.307	1.134	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)Nc1ccc(F)c(S(=O)(=O)N(C)C)c1	806542058	LWIALHTXSIESAY-UHFFFAOYSA-N	438.481	1.870	50	20	IDGD	
CC1(C)CC(=O)c2cc(NC(=O)C(=O)NNC(=O)CCc3ccccc3O)ccc2O1	806979249	WWPNOTOTQOIQTM-UHFFFAOYSA-N	425.441	1.855	50	20	IDGD	
O=C(NNc1ncccc1F)C(=O)Nc1ccc(Cl)c(S(=O)(=O)N2CCCC2)c1	807300940	NUQZXMLWLWGEPV-UHFFFAOYSA-N	441.872	1.740	50	20	IDGD	
CC(C)[C@@H](NS(=O)(=O)c1ccc2ccccc2c1)C(=O)NNC(=O)N1CCN(C)CC1	807382980	XIRCAZGPMPABMG-LJQANCHMSA-N	447.561	1.131	50	20	IDGD	
CC(=O)Nc1ccc(NS(C)(=O)=O)c(C(=O)Nc2cccc(NC(=O)NN(C)C)c2)c1	807951208	MCGGANIALPULKC-UHFFFAOYSA-N	448.505	1.867	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)[C@@H]1C[C@@H](c2ccccc2)OC1=O	808589273	CVIPQEGFWAAKFV-RDJZCZTQSA-N	446.843	1.957	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)COc3cc(F)cc(F)c3)cc2)CC1	810341695	PKNBCAJEADIRML-UHFFFAOYSA-N	440.472	1.423	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2cccc3ccccc23)cc1	810433310	DBRCSFSOMNHZAM-UHFFFAOYSA-N	440.481	1.538	50	20	IDGD	
N#Cc1ccc(C(=O)NNS(=O)(=O)CCCCN2C(=O)c3ccccc3C2=O)cc1	814210544	FZDBXIBQYAHJAE-UHFFFAOYSA-N	426.454	1.199	50	20	IDGD	
O=C(COC(=O)[C@@H]1CCCN(c2ccccc2)C1=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	814606788	ICPWMGHCZPFZLY-QGZVFWFLSA-N	440.412	1.342	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCO1)C(=O)Nc1cc(Br)ccc1Br	815779825	XMKFRMFGNSICKU-SNVBAGLBSA-N	435.072	1.477	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)[C@@H]2CCCCN2S(=O)(=O)c2ccccc2)cc1	864017033	KCNOWXIVGNOWIH-IBGZPJMESA-N	442.497	1.328	50	20	IDGD	
CC(C)NS(=O)(=O)c1cc(C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)ccc1F	914715446	WJHZIANGOUTPSZ-LBPRGKRZSA-N	441.456	1.880	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(Br)c(C(=O)NNC(=O)C2CCCC2)c1	914848848	DUFVQSXLNJHFKZ-UHFFFAOYSA-N	448.339	1.325	50	20	IDGD	
C[C@H]1CN(C[C@@H](C)C(=O)NN=C2C(=O)Nc3cc(N4CCOCC4)ccc32)C[C@@H](C)O1	915954406	DMTRJPGZSSEICE-OAGGEKHMSA-N	429.521	1.041	50	20	IDGD	
O=C(NCc1ccnc(Oc2ccccc2)c1)NNC(=O)c1ccc(-n2cnnn2)cc1	916402143	BIJJRYNAJIYXTA-UHFFFAOYSA-N	430.428	1.994	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)c1nnc(O)c2ccccc12)N1CCN(c2ccccc2)CC1	916515029	YDNRUPOSBPAOTN-MRXNPFEDSA-N	449.515	1.490	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)NCc1ccc(S(=O)(=O)N(C)C)cc1	916646609	CLJVKDOOHHGLIM-CYBMUJFWSA-N	438.481	1.374	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)NCCNS(=O)(=O)c2ccc([N+](=O)[O-])cc2)cc1	920050598	FAJDNWRIZWJJSY-UHFFFAOYSA-N	435.462	1.080	50	20	IDGD	
C[C@H]1CN(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)C[C@H](c2ccccc2)O1	920313934	GIESQLCZLWUQDX-WMLDXEAASA-N	431.518	1.796	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)[C@H]2CCCCN2S(=O)(=O)c2ccccc2)c1	929086615	ZNNNCHMKHHXZMV-LJQANCHMSA-N	447.513	1.708	50	20	IDGD	
CN(Cc1ccccc1)C(=O)CNC(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1	1318668511	KHFXKRLYXJYCAH-UHFFFAOYSA-N	447.536	1.623	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2[nH]nnc2C)C1	1777746462	REBIKQOETGXHSE-OGHNNQOOSA-N	428.331	1.414	50	20	IDGD	
CC(=O)N(C)[C@@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@](C)(Cl)CCl)C2	1778105622	FDTMTYPAKITNBE-LLBUTXAOSA-N	436.380	1.603	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4cccnc4n3)C2)C1	1778432421	MQZBOOOLZJCQLB-OAQYLSRUSA-N	428.565	1.925	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc3ccccn3n2)C1	1778483401	SCGYAWALRNLQLQ-YRISNDGFSA-N	434.924	1.716	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)C#CC3(O)CCCCC3)C2)C1	1779068358	YZWWCAPQBBYAEK-UYAOXDASSA-N	431.360	1.751	50	20	IDGD	
O=C(/C=C/C(=O)N1CC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2)NCc1ccco1	1779211222	LUOGEIJSQPHFTL-OAJJDEHYSA-N	430.288	1.086	50	20	IDGD	
Cc1cc(CC(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](F)Br)C3)n[nH]1	1779461874	XBXUTZYKDMCBJX-UKPHBRMFSA-N	431.306	1.465	50	20	IDGD	
O=C(CCOc1ccccc1)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781328736	XWACQOJZHROOHL-FUHWJXTLSA-N	429.286	1.976	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)N1C[C@@H]3C[C@H]3C1)C2	1781998129	UNGAABAUGNMIJY-JNPGCMDYSA-N	442.398	1.624	50	20	IDGD	
CS(=O)(=O)c1ccc(F)c(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](F)Cl)CCO3)c1	1782152407	RXZXSNFXHNVKPM-WMLDXEAASA-N	436.864	1.207	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccnc1OC)C2	1782171229	UNSDWQIIYVERMS-JXXFODFXSA-N	425.913	1.472	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C=N/O[C@@H]1CCCCO1)C2	1782175297	GFWQPULZZMQBMT-PDFMVGRJSA-N	445.944	1.283	50	20	IDGD	
C[C@H](Nc1cnccn1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C(Cl)Cl)C1	1782218112	UNANYKDAGYSNEN-VEVIJQCQSA-N	430.336	1.595	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CSc2nc[nH]n2)C1	1782476100	FEQLOOHBRZTPJP-HBUWYVDXSA-N	429.974	1.818	50	20	IDGD	
CCOC(=O)C(C)(C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)Br)C2	1783229354	ZRGQJOABWOFEMZ-IQUTYRLHSA-N	447.370	1.873	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(CCN(C(=O)[C@H]3CCc4ccccc4O3)C2)C1	1783838143	GDKDKZHIAWLLCP-XLIONFOSSA-N	437.334	1.995	50	20	IDGD	
Cc1cccc2cc(C(=O)N3CCO[C@@]4(CCN(C(=O)CCC(=O)NN(C)C)C4)C3)[nH]c12	1783936563	XJGNOFWOQXTQMO-HSZRJFAPSA-N	441.532	1.293	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3cnn(C)c3)C[C@@H]21	1783965341	JEMPNCADPKSWRH-IWCQGFGOSA-N	441.370	1.363	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3CCC(O)CC3)C[C@@H]21	1783974241	JIXDRLVPVDCRGY-PTBAZYHNSA-N	431.371	1.548	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H]3CCc4nc[nH]c4C3)C2)C1	1784353704	ZHIKGMDBRVYURB-ZJNRKIDTSA-N	425.327	1.128	50	20	IDGD	
Cc1cc(C)n(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Br)C[C@@H]32)n1	1785340575	LWYXPFNKEHAPIF-RZLSGREXSA-N	431.306	1.170	50	20	IDGD	
Cc1nn(C)c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CO[Si](C)(C)C)C[C@@H]32)c1F	1785776228	FEQAPRGKZNZUGM-KKUMJFAQSA-N	426.565	1.312	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4c(cnn4C)c3)[C@H]2C1	1788062255	AWAMLJSKVYXEHA-XPYUAMARSA-N	434.924	1.420	50	20	IDGD	
Cn1cccc1C(=O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]2C1	1789872525	IIXHHRZRBBIYTP-NGOJXBLDSA-N	430.332	1.424	50	20	IDGD	
CCOC(=O)C1(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](Br)CC)[C@H]3C2)CC1	1790963601	GALVMXDAKBTQBJ-XQLPTFJDSA-N	445.354	1.483	50	20	IDGD	
Cc1cnn([C@H](C)C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)CBr)C[C@@H]32)c1	1791592527	GUGICHDPVRTEAR-QEOTZNIISA-N	441.370	1.763	50	20	IDGD	
CN(C)C(=O)c1cccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Cl)C[C@@H]32)c1	1792100304	NDDKHRRTMJQFOW-QAETUUGQSA-N	425.888	1.516	50	20	IDGD	
C[C@@H](Cn1ccnc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)CBr	1792873323	SIVLDGAIAJXFEQ-GVRJEKJASA-N	427.343	1.140	50	20	IDGD	
O=C(Cn1ccc2ccc([N+](=O)[O-])cc21)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCl	1793106753	IXEZSUSOYKITJH-BASYENTBSA-N	434.880	1.787	50	20	IDGD	
COc1ncccc1CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCBr	1795111478	RSOYZZVEWUMIHG-JLVBRIDZSA-N	440.338	1.397	50	20	IDGD	
O=C(COCc1ccccc1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2	1795424723	DEZNRQSZFZLQLR-FSDCSDTHSA-N	429.286	1.483	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Cl)C1CC1	1796362887	KHMRFECOVZMEKT-AIEDFZFUSA-N	433.908	1.414	50	20	IDGD	
CCn1nc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)cc1C	1796892002	VQSCMHXSTFISJN-GSWMANSFSA-N	439.520	1.597	50	20	IDGD	
COc1ccsc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnccc1C(=O)NN	1798440061	YDEXQSDDXBXIHB-CLLJXQQHSA-N	429.502	1.321	50	20	IDGD	
CCOC(=O)[C@@H]1CCC[C@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](Cl)CC)C1	1799264232	DFTGARMGSAIZQL-ZKZVPCBQSA-N	428.957	1.963	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3ncnn3c1)C2	1799277076	QLZFLVXEFIOGFH-HRJSJKBJSA-N	426.304	1.169	50	20	IDGD	
C=C(CC(=O)OCC)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)CBr)C2	1799302060	VYMOPYCKMMQLKR-HGTKMLMNSA-N	431.327	1.116	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cn3ccccc3n1)C2	1800641326	YPBUKACSBKXHMN-UMPJEAMMSA-N	435.322	1.711	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cn(C)c3ncccc13)C2	1800641979	PEPQVBXYCLYJCG-RMHZUWNSSA-N	449.349	1.950	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccn3cncc13)C2	1800642005	QPMPRIUBCXFEOO-YXPYIKCWSA-N	435.322	1.711	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1803694359	HWTXZFQOVNAJKE-FUHIMQAGSA-N	437.972	1.868	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)C(F)(F)C(F)F)[C@@H]1c1cccnc1	1804012367	ARIMAZVRNPGIIH-BBRMVZONSA-N	447.433	1.361	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@H](CNC(=O)c2ccc(O)nn2)[C@H]1c1cccnc1	1805268324	KADNDJFQPDZELM-HNAYVOBHSA-N	429.553	1.748	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1cccs1	1805385229	SECKDMSBZCCDCF-XLIONFOSSA-N	435.314	1.456	50	20	IDGD	
Cc1cc(C(=O)NC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)on1	1805709727	QRWODURLNRORHK-JXFKEZNVSA-N	428.493	1.071	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)CCc2ccco2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807362596	LPZHLRMJPNWSRC-AUSIDOKSSA-N	447.300	1.307	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)C2(F)CC2)[C@@H]1c1cccnc1	1808416199	GVLCRSNEXUEXOV-AENKRZKSSA-N	440.479	1.724	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)Cn2cncn2)[C@@H]1c1cccnc1)[C@@H](F)Br	1808662164	WYPJOWCHNPOPNQ-NWANDNLSSA-N	425.262	1.070	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)c3ccncc3F)CC2)C1	1809977659	AWCHEICNPMDHIG-UHFFFAOYSA-N	425.269	1.059	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)/C=C\C(=O)NC2CC2)[C@@H]1c1cccnc1	1810137526	XCWYVOICPIKPRN-SJAYAVGHSA-N	449.349	1.706	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)/C=N/N2CCCCC2)[C@H]1c1cccnc1	1810289060	OKBYGIAQRQJQRQ-BXXXKRRVSA-N	435.956	1.813	50	20	IDGD	
CCc1cc(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](Cl)COC)[C@H]2c2cccnc2)nn1C	1811143193	HEIBZUQSIYUKLI-IEZWGBDMSA-N	433.940	1.951	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2n[nH]cc2[N+](=O)[O-])[C@@H]1c1cccnc1	1813032209	VQHHOEWDYGUKLS-DVOMOZLQSA-N	436.856	1.286	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@H]1CCc2nc(NC(=O)CN)sc2C1	1814774721	DMOANQUGHBKBSI-ONGXEEELSA-N	431.946	1.146	50	20	IDGD	
O=C(/C=C/c1ccoc1)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1815749356	LSPIGARXBKJKGT-UCFODXPJSA-N	434.261	1.702	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnoc3)sc2C1	1817449570	UZXIDFFDUNVVQI-LPUHGPTISA-N	441.473	1.491	50	20	IDGD	
CC(C)(C)OCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1	1817469663	CQIBNISKCXQQBO-QGZVFWFLSA-N	428.298	1.211	50	20	IDGD	
O=C(CCc1cccnc1)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1817631250	VHZJHESRWRKNJE-HXUWFJFHSA-N	447.304	1.423	50	20	IDGD	
C[Si](C)(C)OCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1819593904	XZYWXDSMWHFZCM-KRWDZBQOSA-N	444.373	1.247	50	20	IDGD	
N#CC1(C(=O)N[C@H]2CCc3nc(NC(=O)c4cnccc4C(=O)NN)sc3C2)CCC1	1819800911	CUQUJRCVYQGTKM-NSHDSACASA-N	439.501	1.061	50	20	IDGD	
CCOc1ccc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@@H](O)CCl)CC3)nn1	1821750196	QEQLUBFYQDTUMF-SKDRFNHKSA-N	425.898	1.157	50	20	IDGD	
C[C@H](C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1)n1ccnc1	1822411968	GELNLCUBWKZFBQ-ZBFHGGJFSA-N	430.513	1.233	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CNC(=O)C(F)(F)F)n[nH]1	1822444186	KVIHDLUVPXLKHN-MWLCHTKSSA-N	439.822	1.334	50	20	IDGD	
CNc1nsnc1C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1	1822998859	JDGIVSPLUDQIIT-ANLVUFKYSA-N	449.331	1.953	50	20	IDGD	
CN(CC(=O)N1CCC([C@H]2CCCCN2C(=O)C(C)(C)CCl)CC1)C(=O)C(=O)O	1824014769	CLKCTMQWOUCSRK-OAHLLOKOSA-N	429.945	1.414	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CN1CCOC1=O)CC2	1825635636	IZYBCEDYVQNALF-IUCAKERBSA-N	431.312	1.291	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)Cc1ccccn1)CC2	1826085529	ZITCTEPVGJNQPK-AWEZNQCLSA-N	430.534	1.066	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)c2ccc(O)cn2)CC1	1826212270	DADOJEHTZQDLHI-OAQYLSRUSA-N	437.305	1.014	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)CN2CCCCC2)CC1	1826701243	NLGKPICFWNHAKS-QFIPXVFZSA-N	441.381	1.086	50	20	IDGD	
CC(C)O[C@H](C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1	1829020185	LPPKHKYNIIKRFI-UTKZUKDTSA-N	430.354	1.413	50	20	IDGD	
Cc1cccn2ncc(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)C(C)(C)CCl)CCO4)c12	1830365733	GSFQGXCADXBAQC-JOCHJYFZSA-N	448.951	1.978	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)C(C)(C)C)CCO2	1830631834	IGCMAZYZBHXUFR-IYOUNJFTSA-N	435.359	1.023	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CC(OCC)OCC)C2)C1	1831656550	GNCPWNVUKMGGCS-JXFKEZNVSA-N	434.961	1.640	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)Cc3ccccc3)C2)C1	1831657450	OHSWJOODWRGATN-NNMXDRDESA-N	438.952	1.454	50	20	IDGD	
Cc1cc(CC(=O)N2CCC([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)n[nH]1	1831873758	WIFRQSHOFDVQII-LJQANCHMSA-N	432.569	1.253	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)C[C@@H]3C[C@@H]4CC[C@H]3C4)CC2)CC1)[C@H](O)CCl	1833311892	GRYALZLAOIPLRH-NHAYFPRASA-N	426.001	1.984	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)C3CCC(CO)CC3)CC2)CC1	1833722920	GWQARVHPOLFXND-UHYCVJNDSA-N	444.016	1.611	50	20	IDGD	
Cc1noc(N)c1C(=O)NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1	1834698453	XVFSKMKDAMNFOY-UHFFFAOYSA-N	442.358	1.535	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)CCSC(=N)N)CC2)CC1	1834707477	YRBMGJDFHCZEJP-MRXNPFEDSA-N	432.034	1.982	50	20	IDGD	
CC(C)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1	1834738587	NWKLEMHLKZXZBR-IXNCKXOBSA-N	433.455	1.984	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cnc(O)nc3O)CC2)CC1	1835072161	GYOAVUBVBGTQQY-OAHLLOKOSA-N	425.917	1.090	50	20	IDGD	
CCCc1onc(C)c1C(=O)NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1835195249	YJZODFISFHHWCH-QGZVFWFLSA-N	440.972	1.720	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccsc3)CCO2)C1	1836101727	DEEVNJZVRPOAMH-MSOLQXFVSA-N	435.373	1.983	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)c3cnnn3C)CC2)CC1	1837232511	BXRNXVAPBKEKBH-OAHLLOKOSA-N	442.358	1.601	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cccc(=O)n3O)CC2)CC1	1837285719	XNXWTWVKZXYJTR-MRXNPFEDSA-N	425.913	1.715	50	20	IDGD	
CCCC(=O)N[C@@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1837668931	BPOHLMJVBQNQPX-MGPUTAFESA-N	431.961	1.013	50	20	IDGD	
C[C@@H]1CCC[C@H]1C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1	1837919208	QDNYFOANKKRZCJ-VGOFRKELSA-N	442.365	1.415	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)c3ccnnc3O)CC2)CC1	1838516097	YUJCNIRNZNJPFT-GFCCVEGCSA-N	441.326	1.578	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)COc3cccnn3)CC2)CC1	1838785609	IYTGHUAATCDTPA-KRWDZBQOSA-N	440.928	1.108	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(F)ccc3F)CCO2)C1	1838860443	HUOCXGIXAJLXFF-DNVCBOLYSA-N	432.851	1.289	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3CCN(C(C)C)CC3)C2)C1	1839142003	BDAZWDWPCSSJDX-WIYYLYMNSA-N	429.989	1.581	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4cnccc4n3)C2)C1	1839144551	DUESOHCXALVQLM-KKSFZXQISA-N	432.908	1.717	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cn3cnc4ccccc43)C2)C1	1839148725	HXGVWMXFTQIVST-HRAATJIYSA-N	434.924	1.510	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C4CC4)on3)C2)C1	1839149691	OIVGLBXFMHLAOG-RBUKOAKNSA-N	446.331	1.858	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(CO)o3)C2)C1	1839153632	MEOWAXQJSDHRMQ-ROUUACIJSA-N	435.304	1.078	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(O)c([N+](=O)[O-])c3)CCO2)C1	1839274600	HKILQNFAIYULOG-KUHUBIRLSA-N	441.868	1.388	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(-n4cncn4)c3)CCO2)C1	1839437014	ALWHNXFRROBBHT-RXVVDRJESA-N	447.923	1.355	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)C34CC(F)(C3)C4)C2)C1	1839962481	HFZDZEWFSXCAQV-BQPQTXTPSA-N	433.318	1.509	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccs3)C2)C1	1839963196	CXTMGFIEPMKARF-SUMWQHHRSA-N	431.352	1.992	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C=C/c3cnc[nH]3)C2)C1	1839967248	GVBFBPRUJXALED-UIXCXIJASA-N	441.326	1.053	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccc(F)cc3F)CCO2)C1	1839979273	FQDSFVAQJIBCBX-JXFKEZNVSA-N	430.879	1.981	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](C)Br)CCO2)C1	1840030408	KQHLGQJNOPOGMG-XEZPLFJOSA-N	425.751	1.634	50	20	IDGD	
CCCc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](Cl)COC)CCO3)cc1	1840154449	XDARZOBXGKZTAE-DENIHFKCSA-N	438.952	1.963	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(C)cc3O)C2)C1	1840156637	RHPGGVDWOMIONI-OXQOHEQNSA-N	426.897	1.024	50	20	IDGD	
COc1cccc(Cl)c1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1	1840735940	XRPQZLJATGPKME-IFXJQAMLSA-N	447.315	1.018	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)Cc2ccc3ncccc3c2)C1	1841759989	FYROKQNQRVWSIX-UHFFFAOYSA-N	444.495	1.293	50	20	IDGD	
Cc1cccc(C)c1N1C[C@@H](C(=O)N2CCCC23CN(C(=O)[C@H](O)CCl)C3)CC1=O	1841915120	VDMZCARRHZLQCZ-DLBZAZTESA-N	433.936	1.459	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1cn3ccsc3n1)C2	1843416230	NLTZIQSCSRCOMI-YDZHTSKRSA-N	439.501	1.347	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCCC12CN(C(=O)c1ccc(S(C)(=O)=O)cn1)C2	1846069210	NWFYNXNIRFOUCP-CYBMUJFWSA-N	444.351	1.476	50	20	IDGD	
C[C@H](NS(=O)(=O)c1ccc(Cl)cc1)C(=O)OCC(=O)NNC(=O)c1ccccc1	14763825	RXBHKECTIBTOLK-LBPRGKRZSA-N	439.877	1.011	50	20	IDGD	
O=C(CCCNS(=O)(=O)c1ccc(F)cc1)NNC(=O)c1cc(-c2ccccc2)n[nH]1	15841604	VESBFXJJMGEJIZ-UHFFFAOYSA-N	445.476	1.736	50	20	IDGD	
CC(=O)N1c2ccc(S(=O)(=O)NNC(=O)c3cc(Br)c[nH]3)cc2C[C@H]1C	28680645	TWIBIHIMEMEYCI-SECBINFHSA-N	441.307	1.698	50	20	IDGD	
O=C(NCc1cc(-c2ccccc2)on1)NNC(=O)c1csc(N2CCOCC2)n1	726851530	SEWZJFXDRPARNF-UHFFFAOYSA-N	428.474	1.779	50	20	IDGD	
COc1ccc(-n2nnc(C(=O)NNc3ccc(S(=O)(=O)NC4CC4)cc3)c2C)cc1	728209827	MILCUOFVBHHUBC-UHFFFAOYSA-N	442.501	1.782	50	20	IDGD	
C[C@@H](OC[C@@H]1CCCCO1)C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	728214565	AJLSAQNGKXBTQY-AEFFLSMTSA-N	440.566	1.040	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)c1ccc(C)cc1)C(=O)NNC(=O)Cc1cccnc1	728892337	SNGVLMQTUWWIOH-QGZVFWFLSA-N	436.559	1.180	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2cccc3c2O[C@@H](C)C(=O)N3)c2ccccc2c1=O	729299346	ALPCDSICORNAGY-LBPRGKRZSA-N	435.440	1.601	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)[C@H]1CCCN(S(=O)(=O)c2ccccc2)C1	730033928	DRWNJTUGLGWVQM-KRWDZBQOSA-N	431.514	1.573	50	20	IDGD	
CC(C)(C)CC(=O)N1CSC[C@@H]1C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	730074792	BXIXXZPTZOCSSB-CQSZACIVSA-N	427.548	1.189	50	20	IDGD	
C[C@H](C(=O)NNC(=O)CNC(=O)c1cccs1)N1CCC(Cc2ccccc2)CC1	732065826	XFFFKKQRDSBTKU-MRXNPFEDSA-N	428.558	1.969	50	20	IDGD	
CC(C)(C)OC(=O)NCc1nc(C(=O)OCC(=O)NNC(=O)c2cccs2)cs1	732867966	QUYRZZBUSHIDDG-UHFFFAOYSA-N	440.503	1.847	50	20	IDGD	
CCc1cc(N2CCC[C@H](NC(=O)NNC(=O)c3cc(Br)c[nH]3)C2)ncn1	732915141	WLDDBVOMKFHYIF-ZDUSSCGKSA-N	436.314	1.743	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN(C)C2CCN(C(=O)c3ccccc3)CC2)n1	733310027	HOJRCEWSTVOIOM-UHFFFAOYSA-N	429.546	1.378	50	20	IDGD	
CC[C@H](NC(=O)NNC(=O)c1cnn(-c2ccccc2)c1)c1cccc(S(N)(=O)=O)c1	733347262	RPTBEYFTNOUWBT-SFHVURJKSA-N	442.501	1.615	50	20	IDGD	
C[C@@H](CS(C)(=O)=O)NC(=O)NNC(=O)c1cn(-c2ccccc2)nc1-c1ccccc1	733660658	JRAZURRURMSPSI-HNNXBMFYSA-N	441.513	1.916	50	20	IDGD	
NS(=O)(=O)c1ccc(F)c(CNC(=O)NNC(=O)CSc2ccc(Cl)cc2)c1	734673425	KOCQCPWTRORVKR-UHFFFAOYSA-N	446.913	1.749	50	20	IDGD	
O=C(NCCCCSc1ccccc1Br)NNC(=O)C(=O)NC1CC1	734683271	GRGPUPRWGDQAFZ-UHFFFAOYSA-N	429.340	1.930	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)Cn2cccc(C(F)(F)F)c2=O)cc1C	736752097	AHOWBJRIRHPIMS-UHFFFAOYSA-N	445.419	1.804	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)/C(C#N)=C/c1cc(C)n(C[C@@H]2CCCO2)c1C	740852834	KTHJIWKSQSTPJZ-OXRZLYTFSA-N	429.521	1.643	50	20	IDGD	
O=C(COC(=O)C[C@@H]1CN(Cc2ccccc2)CCO1)NNC(=O)c1ccc(Cl)cc1	741354993	OGIWTWLPRAGRLI-LJQANCHMSA-N	445.903	1.935	50	20	IDGD	
O=C(NNS(=O)(=O)N1CCCCC1)[C@@H]1Cc2ccccc2CN1Cc1ccccc1	742029506	GAGFOJLSFWXRPX-NRFANRHFSA-N	428.558	1.965	50	20	IDGD	
NC(=O)CS(=O)(=O)c1ccc(C(=O)NNC(=O)Cc2cccc3ccccc23)cc1	742502393	AIWZQEGSAMDRRP-UHFFFAOYSA-N	425.466	1.103	50	20	IDGD	
CC(C)Cn1c(=O)nc(O)c2c(C(=O)NNC(=O)NC3CCCC3)cc(C3CC3)nc21	744054110	QPKDNRZONGFYQW-UHFFFAOYSA-N	428.493	1.917	50	20	IDGD	
COc1cc(C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)cc(NC(C)=O)c1OC	745438371	BEGBXTTYIYUPLY-UHFFFAOYSA-N	440.412	1.152	50	20	IDGD	
COc1cc(C(=O)OCC(=O)NNC(=O)c2cccc(C)c2)cc(NC(C)=O)c1OC	745439427	RMSRYGTWOJBYQN-UHFFFAOYSA-N	429.429	1.589	50	20	IDGD	
CCN1CCN(C[C@@H](C)CNC(=O)NNC(=O)c2ccc(F)cc2Br)CC1	745863870	YPVAVTQFTQAZSE-ZDUSSCGKSA-N	444.349	1.806	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)N[C@@H]2CCCN(c3ccc(C)cc3)C2=O)cc1	745882358	VGKVKCLQIQFOEM-LJQANCHMSA-N	426.473	1.908	50	20	IDGD	
CCSCC[C@H](C)NC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	745922261	COKUNQAAYGZEOQ-AWEZNQCLSA-N	428.580	1.947	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cn(CC(=O)C(C)(C)C)nn2)cc1Br	746250094	NXCHRKJMXXZNIW-UHFFFAOYSA-N	438.282	1.739	50	20	IDGD	
O=C(N[C@@H](Cc1ccccc1)C(=O)NNC(=O)C(=O)N1CCCC1)OCc1ccccc1	748247126	URJYPMBFLPNMQJ-IBGZPJMESA-N	438.484	1.294	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NC2CCN(C3CCCC3)CC2)c2ccccc2c1=O	748981933	DIEJXSGNXREYET-UHFFFAOYSA-N	426.521	1.767	50	20	IDGD	
COC(=O)c1cc(OC)c(S(=O)(=O)NNC(=O)c2cnn(-c3ccccc3)c2)s1	749013083	YFJZHQWTDKYXGY-UHFFFAOYSA-N	436.471	1.352	50	20	IDGD	
COc1ccc(C(=O)CNC(=O)CCC(=O)NNC(=O)c2ccc3ccccc3n2)cc1	751283797	DWCCXIGOLZTVAQ-UHFFFAOYSA-N	434.452	1.784	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)c1cc(S(N)(=O)=O)cc(Cl)c1F	752253082	BBUYQBCLPAGJOT-QMMMGPOBSA-N	433.820	1.494	50	20	IDGD	
C[C@H](C[S@@](C)=O)NC(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	753357757	HVUVBRQDWXJXNA-JKGBWWFKSA-N	441.517	1.099	50	20	IDGD	
COc1ccc(CC(=O)NNc2cccnc2Cl)cc1S(=O)(=O)N1CCOCC1	754487297	FMCYKAAABPASAO-UHFFFAOYSA-N	440.909	1.450	50	20	IDGD	
O=C(CCC(=O)c1cc(Cl)sc1Cl)NNC(=O)N[C@@H]1CCS(=O)(=O)C1	755229859	FUOZPQNEAWSHSD-SSDOTTSWSA-N	428.319	1.535	50	20	IDGD	
O=C(Cc1cc[nH]n1)NNC(=O)C(=O)Nc1ccc(Br)cc1C(F)(F)F	755277273	PZDKLGOQIHTSRX-UHFFFAOYSA-N	434.172	1.520	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2cccc(N3CCCC3=O)c2)c1	755532596	BALYGMMVYCISIA-UHFFFAOYSA-N	445.501	1.530	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@@H](C)CNC(=O)OC(C)(C)C)c2ccccc2c1=O	755998284	BKAUBIFZCKKOOW-LBPRGKRZSA-N	432.481	1.274	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2cc(N3CCCC3=O)ccc2F)c1	756114896	MILXYMQDZDIACL-UHFFFAOYSA-N	434.449	1.823	50	20	IDGD	
CCN1CCN(C(=O)c2ccc(NC(=O)NNC(=O)COc3ccccc3F)cc2)CC1	756252236	BJKFBGSOLMFKPT-UHFFFAOYSA-N	443.479	1.835	50	20	IDGD	
COC(=O)C[C@H]1CN(CC(=O)NNC(=O)c2ccc(OC)c(OC)c2)c2ccccc21	756602832	ZABOYVLCDBZGTG-HNNXBMFYSA-N	427.457	1.632	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)Nc2ccc(CNS(C)(=O)=O)cc2)cc1OC	756622959	AHWICMCRUVTUEI-UHFFFAOYSA-N	436.490	1.610	50	20	IDGD	
CCCNS(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1	756774979	FPNHLFZHNDLFCD-QGZVFWFLSA-N	434.474	1.368	50	20	IDGD	
CSCC[C@@H](NC(=O)c1ccc2ccccc2n1)C(=O)NNc1ccc(C(N)=O)nn1	757405987	PPHBTRRHYWUANG-MRXNPFEDSA-N	439.501	1.119	50	20	IDGD	
C[C@H]1C[C@@H](C)C[C@]2(C1)NC(=O)N(CC(=O)NNC(=O)c1cc(-c3cccs3)[nH]n1)C2=O	757650977	QKKPQGUEXDSMMG-OYHTYJOISA-N	444.517	1.646	50	20	IDGD	
Cc1cnn(-c2ccc(C(N)=O)cc2NC(=O)NNC(=O)c2ccc3c(c2)OCCO3)c1	757872925	IMDMNRRBEOZHKF-UHFFFAOYSA-N	436.428	1.517	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)c1ccccc1)C(=O)NNc1nc(O)c2ccccc2n1	758308871	GIYKDNJJAOFIOQ-INIZCTEOSA-N	447.542	1.879	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)CCC(=O)N2CCc3cc(OC)c(OC)cc3C2)nc1	759729556	XYIWXMBRSVKXIG-UHFFFAOYSA-N	442.472	1.694	50	20	IDGD	
C[C@@H](C1CC1)n1nccc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	760289882	HDOVLKDXIJIWED-NSHDSACASA-N	425.424	1.783	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NN=C1CCC(O)CC1)N(S(C)(=O)=O)CC2	761767668	RCUSEWMTQIHVQN-OMOCHNIRSA-N	439.534	1.360	50	20	IDGD	
CCCC(=O)N1CCC[C@H]1C(=O)NNC(=O)c1cc(-c2ccc(OC)c(OC)c2)[nH]n1	763153403	ZLIJAGFMQXWBMC-INIZCTEOSA-N	429.477	1.646	50	20	IDGD	
O=C(CCN1CCN(c2ccccn2)CC1)NNC(=O)c1cc(-c2cccs2)[nH]n1	763167386	YXNDIWQLOZMIJF-UHFFFAOYSA-N	425.518	1.507	50	20	IDGD	
Cc1n[nH]c(C)c1[C@H](C)CC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	763385285	ASKKFMYIBJMYFP-CYBMUJFWSA-N	433.534	1.766	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)cc1C(=O)O	763438719	DHLXTVQFYGSWTN-UHFFFAOYSA-N	431.467	1.008	50	20	IDGD	
COc1cccc(-c2cc(NC(=O)C(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)n(C)n2)c1	763445537	JMIGMFZQFLFLDS-UHFFFAOYSA-N	438.400	1.404	50	20	IDGD	
Cc1ccnc(Oc2ccc(NC(=O)C(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)cc2)n1	763467305	BLIJYDHOJWXJLH-UHFFFAOYSA-N	436.384	1.885	50	20	IDGD	
O=C1COc2ccc(NC(=O)C(=O)NNC(=O)c3ccccc3Br)cc2N1	763483518	PQRPMGXQKOVSCP-UHFFFAOYSA-N	433.218	1.180	50	20	IDGD	
Cc1cc(C)cc(-n2nc(NC(=O)C(=O)NNC(=O)[C@H]3COc4ccccc4O3)cc2C)c1	763570569	GBLJKVNCNGCXSS-LJQANCHMSA-N	449.467	1.723	50	20	IDGD	
CN1C(=O)CCc2cc(NC(=O)C(=O)NNC(=O)c3cc(-c4ccccc4)[nH]n3)ccc21	763601126	OUPVCJHJXZQAML-UHFFFAOYSA-N	432.440	1.385	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2cccc3ccccc23)c1	763717844	BABJYXFHASNCJJ-UHFFFAOYSA-N	440.481	1.490	50	20	IDGD	
CN1C(=O)COc2ccc(NC(=O)C(=O)NNC(=O)CC34CC5CC(CC(C5)C3)C4)cc21	763737081	ODOLIJYVCKMDMZ-UHFFFAOYSA-N	440.500	1.734	50	20	IDGD	
O=C(NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12)C(=O)Nc1cccnc1	763750092	HXFZBZKJDRQPQQ-UHFFFAOYSA-N	442.435	1.240	50	20	IDGD	
CCOC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(N(C)C)c2)cc1C#N	763758103	NMXYHGRUTOHIMK-UHFFFAOYSA-N	438.444	1.592	50	20	IDGD	
CS(=O)(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)c1	763840134	IVGHTPIQQGEGHR-UHFFFAOYSA-N	443.840	1.048	50	20	IDGD	
COC(=O)Cc1ccccc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1cccc(C)c1C	763852536	WRPAVWJVZXQPIP-OAHLLOKOSA-N	427.457	1.572	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cc(F)c(OC)c(F)c2)cc1	763860636	JLAMNGZARVRPJH-LLVKDONJSA-N	437.399	1.926	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(CC(C)(C)C)nn2C)cc1OC	763900129	GAWMDOFMXWFAED-UHFFFAOYSA-N	431.493	1.816	50	20	IDGD	
Cc1cnc(O)n1-c1ccccc1NC(=O)C(=O)NNC(=O)c1ccc2c(c1)OCCO2	764006627	RNYGLVABGWOMDA-UHFFFAOYSA-N	437.412	1.057	50	20	IDGD	
CN(C)C(=O)COc1cccc(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3c2)c1	764062479	YPCVDJAVLGABNT-UHFFFAOYSA-N	434.452	1.707	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2cc(CN(C)C)ccc2OC)cc1	764126208	HHOKERYUDSGVCM-UHFFFAOYSA-N	428.489	1.484	50	20	IDGD	
O=C(NNC(=O)c1cc(F)ccc1Br)C(=O)Nc1cccc([N+](=O)[O-])c1	764270306	LCZYVCLPVGCOSO-UHFFFAOYSA-N	425.170	1.896	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(C#N)ccc2OC)cc1Br	764325901	ABUDTQQJJFSHLM-UHFFFAOYSA-N	447.245	1.738	50	20	IDGD	
CN(Cc1ccccc1)S(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)C2CCC2)cc1	764339633	VLCKMJFLMRAFSY-UHFFFAOYSA-N	444.513	1.393	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)c1ccc(F)cc1NC(=O)c1ccoc1	764345309	QHWFCRBHYPAZOS-UHFFFAOYSA-N	425.376	1.257	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)C(=O)Nc2cccc(COc3ccc4c(c3)OCO4)c2)cn1	764360062	SFKHNHBNQWQQRH-UHFFFAOYSA-N	437.412	1.128	50	20	IDGD	
CCOc1ccc(C#N)cc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	764389006	VWDUUXXJMDSNOP-UHFFFAOYSA-N	436.403	1.886	50	20	IDGD	
CCc1cc(N2CCC(NC(=O)NNC(=O)CSc3ccccc3O)CC2)ncn1	764421780	RNOUSBHBHZGPDN-UHFFFAOYSA-N	430.534	1.836	50	20	IDGD	
CC(C)(C)c1nc(CC(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cs1	765737507	FSLVIKJLTNNISR-UHFFFAOYSA-N	443.573	1.589	50	20	IDGD	
CC(C)c1nn(C)c(Cl)c1C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	766637177	ZUMCQWRFAGBLIQ-UHFFFAOYSA-N	446.939	1.416	50	20	IDGD	
Cc1nn(C)c(C)c1[C@H](C)C(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	766662761	GDNWCDNYRKWJBC-HNNXBMFYSA-N	446.983	1.759	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCN([C@@H](C)c2nccs2)CC1	767002199	CWDGTUBRHKRNBD-ZDUSSCGKSA-N	437.953	1.945	50	20	IDGD	
O=C(COC(=O)Cc1ccc(Br)cc1)NNC(=O)[C@@H]1COc2ccccc2O1	767059587	UAZDRKIWERETCG-INIZCTEOSA-N	449.257	1.522	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](OCC(=O)NNC(=O)Cn2cnc3ccccc32)C1	767825703	RSGBABKDOAVUMX-HNNXBMFYSA-N	431.493	1.600	50	20	IDGD	
O=C(NNC(=O)N1CCN(Cc2ccccc2Cl)CC1)c1ccc(-n2cnnn2)cc1	767939562	ZBPAAOXFLCIVCX-UHFFFAOYSA-N	440.895	1.488	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NN=Cc1c(C)nn(CC(=O)OC(C)C)c1C	768350648	UGMROOSKOKSWNP-UHFFFAOYSA-N	448.549	1.817	50	20	IDGD	
COc1ccccc1COC1CCN(C(=O)NNC(=O)CNC(=O)c2cccs2)CC1	769715887	ZUMAWEGHRHCYIL-UHFFFAOYSA-N	446.529	1.909	50	20	IDGD	
COc1ccc(C(=O)OC[C@@H](C)CBr)cc1S(=O)(=O)N1CCOCC1	770308638	XKDLDGMEZXMDNI-LBPRGKRZSA-N	436.324	1.904	50	20	IDGD	
COc1ccc(C(=O)NNc2ccnc(Br)c2)cc1S(=O)(=O)N(C)C	771550862	DUOCSIOXLPSQQZ-UHFFFAOYSA-N	429.296	1.860	50	20	IDGD	
O=C(NNC(=O)c1c(F)ccc(F)c1F)c1cccc(S(=O)(=O)N2CCCC2)c1	771843849	BHCLJNBEDRVWLY-UHFFFAOYSA-N	427.404	1.963	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)Nc2cnn(Cc3nnc4n3CCCC4)c2)c1	772635657	FSMRVNVGTLKLAH-UHFFFAOYSA-N	438.492	1.708	50	20	IDGD	
CN(C1CCCCC1)S(=O)(=O)c1ccccc1NC(=O)C(=O)NNc1ncccn1	773720633	GNGMHDYCIHEXCS-UHFFFAOYSA-N	432.506	1.512	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)NC[C@@H]1CC[C@H](C(=O)N(C)C)O1	774664360	VKAFQMSINVTJAV-LSDHHAIUSA-N	431.518	1.698	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2cccs2)[nH]n1)Nc1ccnn1[C@@H]1CCS(=O)(=O)C1	776052770	BBIIGSQESQJSFY-SNVBAGLBSA-N	435.491	1.161	50	20	IDGD	
COC(=O)Nc1ccc(S(=O)(=O)NNC(=O)c2cccc3cccnc23)cc1[N+](=O)[O-]	777619016	BCANOZYMQJLZPM-UHFFFAOYSA-N	445.413	1.945	50	20	IDGD	
CC(C)C[C@@H](C(=O)N1CCN(S(=O)(=O)CBr)CC1)N1CCCCC1=O	777779682	PKMFAQWUCBJXDM-AWEZNQCLSA-N	438.388	1.240	50	20	IDGD	
CC(C)N(CC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)Cc1nc(O)c2ccccc2n1	778515410	NELHFPASEXRXPI-UHFFFAOYSA-N	438.444	1.915	50	20	IDGD	
COCCc1cc(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2Br)n(C)n1	778751568	INVFHXADFWKWGM-UHFFFAOYSA-N	441.242	1.362	50	20	IDGD	
O=C(NNc1ccccn1)Nc1ccc(CC(=O)N2CCN(c3ncccn3)CC2)cc1	779016745	GFIQFGRQLUCHQR-UHFFFAOYSA-N	432.488	1.912	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)c2ccc(OC)c(-n3cnnn3)c2)cc1	781560003	NKKQPXODINGEJV-CYBMUJFWSA-N	426.433	1.298	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCC(C(=O)NNc3ncncc3Cl)CC2)cc1	781818753	IYNVYJFVZDPJRP-UHFFFAOYSA-N	425.898	1.683	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc3nn[nH]c3cc2F)c1	781883829	QXCGTGHLZWCUCD-UHFFFAOYSA-N	434.453	1.202	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)NCC(C)(C)C#N)c2)cc1	781953235	DDXABNOZWVUBAT-UHFFFAOYSA-N	445.501	1.990	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2ccc(-n3nccc3C(F)(F)F)cc2)CCS(=O)(=O)C1	783426533	MQIZPJKKAZJHOC-INIZCTEOSA-N	445.423	1.028	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NN=Cc3cn(Cc4cccnc4)nn3)CC2)cc1	783855751	MWGYULQHKLXNFC-UHFFFAOYSA-N	432.532	1.298	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)C(=O)Nc1cc(C2CC2)nn1-c1ccccc1	785067332	LAXKQTHJBKXPPF-UHFFFAOYSA-N	443.467	1.726	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCC[C@H](Oc3ncccc3F)C2)cc1OC	785841621	UGIGTLLLVNSZCN-HNNXBMFYSA-N	432.452	1.542	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)C(=O)Nc1ccc(Cl)cc1-c1ccccc1	785992030	VCWGUFGJYDQOPE-CYBMUJFWSA-N	435.889	1.528	50	20	IDGD	
CC(=O)N1CCN(C(=O)COC(=O)/C(C#N)=C/c2cc(C)n(C[C@@H]3CCCO3)c2C)CC1	786313122	MBPKLVGRAZUQSJ-HNLWVNFGSA-N	442.516	1.425	50	20	IDGD	
CN1CC(=O)N(Cc2ccc(C(N)=O)cc2NC(=O)/C(C#N)=C\c2ccc(O)cc2)C1=O	787415658	XBDOYYQZALRAGC-PXNMLYILSA-N	433.424	1.431	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1)NOC[C@@H]1CCOC1	788326957	UYMOHLDZSQEWLN-MRXNPFEDSA-N	448.501	1.077	50	20	IDGD	
O=C(NNC(=O)c1cnccn1)C(=O)Nc1ccc(Br)cc1OC(F)(F)F	789584529	MAGQDMATLXVNPR-UHFFFAOYSA-N	448.155	1.537	50	20	IDGD	
Cc1noc(-c2ccc(C(F)(F)F)cc2NC(=O)C(=O)NNC(=O)c2cccnc2)n1	789730722	ZECYNBLFZXVSDR-UHFFFAOYSA-N	434.334	1.859	50	20	IDGD	
N#CCCn1cc(/C=C(/C#N)C(=O)N2CCC[C@]3(C2)NC(=O)NC3=O)c(-c2ccccc2)n1	790237001	FDMHFXGEVJQGGU-QUDXMAFCSA-N	443.467	1.571	50	20	IDGD	
O=C(NNc1cccc(F)c1[N+](=O)[O-])c1cccc(S(=O)(=O)NC[C@H]2CCCO2)c1	790588371	VSJDMMMDFAIXMX-CYBMUJFWSA-N	438.437	1.948	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1)C(=O)c1ccccc1	792014091	FNAVGVVARBIXCJ-UHFFFAOYSA-N	437.477	1.809	50	20	IDGD	
CN(C)N(C(=O)c1cc([C@H]2CCN(C(=O)OC(C)(C)C)C2)[nH]n1)[C@@H]1CCS(=O)(=O)C1	792848316	FOGSARDXCKSWPS-UONOGXRCSA-N	441.554	1.240	50	20	IDGD	
CN(C)N(C(=O)c1n[nH]c(-c2ccccc2)c1Br)[C@@H]1CCS(=O)(=O)C1	792851444	VUDCOLGHQSYKAX-GFCCVEGCSA-N	427.324	1.945	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)N[C@H](CO)c1ccc(Cl)cc1C(F)(F)F	792886169	YXKZBWXNDAIQDL-GFCCVEGCSA-N	448.785	1.746	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)[C@@H]2CCCN2C(=O)Nc2ccc3c(c2)OCCO3)n1	794084367	CSTJTGNVFCZLHM-INIZCTEOSA-N	425.445	1.619	50	20	IDGD	
Cc1cccc(C(=O)NNS(=O)(=O)c2cc(C(=O)O)c(F)cc2Br)n1	794598172	AZDXKEVUZSJOMR-UHFFFAOYSA-N	432.227	1.613	50	20	IDGD	
CC(C)C(CS(=O)(=O)N(C)C)=NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	794878375	YRXYLMHFZXWPNS-UHFFFAOYSA-N	444.579	1.104	50	20	IDGD	
O=C(COC(=O)c1cnc2c(F)cccc2c1)NNC(=O)[C@H]1COc2ccccc2O1	795839697	NAWPDPXSZHMKFM-QGZVFWFLSA-N	425.372	1.518	50	20	IDGD	
Cc1c([N+](=O)[O-])ccc(F)c1NC(=O)C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C	800623857	YYRCZFNFAJOQTL-UHFFFAOYSA-N	441.416	1.433	50	20	IDGD	
O=C(CN1C(=O)[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)NNC(=O)Nc1ccc(Br)cc1	802000675	XIOZQVDJUDWUPE-NBLIUIFLSA-N	433.262	1.409	50	20	IDGD	
O=C(CC[S@](=O)c1ccc2c(c1)OCCO2)NNC(=O)Nc1ccc2c(c1)OCO2	802096365	NKYBLDQWZNKJRE-PMERELPUSA-N	433.442	1.537	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1cnn(C)c1-c1ccccc1	806978965	KDCOUOLOJXKWFS-UHFFFAOYSA-N	439.497	1.974	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2C)c(C(=O)N(C)C)cc1OC	807456727	GYHHRHXWRXTWMA-UHFFFAOYSA-N	445.432	1.704	50	20	IDGD	
CN(N=Cc1ccc(S(N)(=O)=O)cc1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	811647311	FURFGDLFYSYOHJ-UHFFFAOYSA-N	425.511	1.272	50	20	IDGD	
COC(=O)Cc1cccc(S(=O)(=O)NNC(=O)c2ccc(Br)s2)c1	811681088	UKKARGBMELBERL-UHFFFAOYSA-N	433.305	1.849	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N2CCC[C@@H](CNC(=O)C(F)(F)F)C2)c(OC)c1	811875457	CGVPLZODMSIUTM-NSHDSACASA-N	432.399	1.449	50	20	IDGD	
CC(C)(C)Oc1ccc(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)nc1	814223019	ZZYRXYDVAAVHJQ-UHFFFAOYSA-N	426.882	1.635	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(OC(C)(C)C)cn2)cc1OC	814518037	SCMNWNPIUYPCLX-UHFFFAOYSA-N	431.445	1.894	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)NCc2ccc(C(=O)NNC(=O)CC3CC3)cc2)cc1	819117902	IPFCFNSTSXAPPN-UHFFFAOYSA-N	444.513	1.685	50	20	IDGD	
O=C(CC1CC1)NNC(=O)c1ccc(Br)c(S(=O)(=O)N2CCOCC2)c1	819135769	DHTYSKHNAFVQTM-UHFFFAOYSA-N	446.323	1.031	50	20	IDGD	
Nc1nc(Cl)c(C=NNC(=O)c2nn(-c3ccccc3)cc2O)c(N2CCOCC2)n1	874086041	JHFSPXGTYQRJGR-UHFFFAOYSA-N	442.867	1.204	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cc(S(N)(=O)=O)ccc2F)ccc1OC(C)C	913154120	FYCWAQMTHLZUSI-UHFFFAOYSA-N	425.438	1.344	50	20	IDGD	
COc1ccc(N2C[C@H](C(=O)OCC(=O)NNC(=O)c3cccc(Cl)c3)CC2=O)cc1	913320881	DXMTZIOTQYTOAF-CQSZACIVSA-N	445.859	1.706	50	20	IDGD	
O=C(CCC(=O)N1CCOCC1)NNC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1	913623919	PNKROLADRFYMCA-UHFFFAOYSA-N	448.483	1.334	50	20	IDGD	
O=C(Cc1cccc2ccccc12)NNC(=O)c1ccc(S(=O)(=O)N2CCOCC2)o1	914722326	UQTDNGWGWAMHCP-UHFFFAOYSA-N	443.481	1.457	50	20	IDGD	
NS(=O)(=O)c1ccc(NC(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)cc1	914827020	HOBPLPWPEMEUOH-UHFFFAOYSA-N	438.409	1.776	50	20	IDGD	
O=C(NN(Cc1ccccc1)c1ccccc1)[C@@H]1CC(=O)N([C@H]2CCS(=O)(=O)C2)C1	914830003	OONAIQHBKHYKPR-QUCCMNQESA-N	427.526	1.760	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)CNS(=O)(=O)c2c(F)cccc2F)c1C	915787875	KZGIONYXPWYAPF-ZDUSSCGKSA-N	441.456	1.475	50	20	IDGD	
CC(C)(C)[C@@H]1CCc2sc(C(=O)NNC(=O)CN3CCS(=O)(=O)CC3)cc2C1	916144058	VVHQOVTYJUNBRI-CQSZACIVSA-N	427.592	1.391	50	20	IDGD	
CCN(CC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)CC(=O)Nc1ccccc1OC	916146940	PTSCRNXALBZMGO-UHFFFAOYSA-N	429.433	1.325	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCCCN2C[C@@H](C)O[C@H](C)C2)nc1	916249782	KCYSGNFGUMSQSY-HZPDHXFCSA-N	442.586	1.238	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)NCc2cccc(S(N)(=O)=O)c2)cc1	916624169	XJZWNJWIXVWOEU-ZDUSSCGKSA-N	436.490	1.031	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCN(C(=O)c2ccc(C)cc2)CC1	917108179	BJPTUGNYRZAWCZ-UHFFFAOYSA-N	444.919	1.876	50	20	IDGD	
CC(=NNC(=O)Cc1csc(C)n1)c1ccc(S(=O)(=O)NCCCN(C)C)cc1	917537476	ATJAESQVXGYIHL-UHFFFAOYSA-N	437.591	1.764	50	20	IDGD	
COC(=O)c1ccccc1S(=O)(=O)NNC(=O)c1ccc(F)cc1Br	917755360	WUOYKVNMTOEFSR-UHFFFAOYSA-N	431.239	1.998	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)CNC(=O)NC1CCCCC1	917922291	OZUWAMGCOZYDRF-LBPRGKRZSA-N	441.326	1.996	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)COc1ccccc1F)c1ccc(S(=O)(=O)N(C)C)cc1	918105062	NQXPIICCMFDSJD-CYBMUJFWSA-N	438.481	1.546	50	20	IDGD	
CC(C)(C)c1ccc(C(=O)NNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1	918779550	ZMXNUOMSJVQEAP-UHFFFAOYSA-N	446.533	1.566	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(\C#N)C(=O)OCC(=O)N2CCC[C@H](NC(C)=O)C2)c1C	918818768	YVJCMGKINFELPJ-BLTCYETNSA-N	444.532	1.890	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)CN1C(=O)N[C@]2(C[C@@H](C)CC(C)(C)C2)C1=O	919822201	GIWRWCMATKPAAK-FPTDNZKUSA-N	430.505	1.522	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)[C@H]2CCCN(CC(F)(F)F)C2)ccc1Cl	919838871	PZMMXTZKCZKZQK-JTQLQIEISA-N	442.847	1.023	50	20	IDGD	
CNC(=O)NNC(=O)[C@H](C)Oc1ccc(N(C)S(=O)(=O)c2ccc(C)c(C)c2)cc1	919879653	PMFVQVBQOXKWCY-HNNXBMFYSA-N	434.518	1.856	50	20	IDGD	
C#CCNS(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(CN(CC)CC)o2)c1	920248351	BONATTQDDFONTI-UHFFFAOYSA-N	432.502	1.108	50	20	IDGD	
CCOc1cc(C=NNC(=O)N[C@H]2CCS(=O)(=O)C2)cc(Br)c1OC	920379680	ADNSDFCPIXOIGJ-NSHDSACASA-N	434.312	1.677	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)CNc1ccccc1[N+](=O)[O-]	920603247	QDWNJXYVDGKDLY-UHFFFAOYSA-N	436.808	1.673	50	20	IDGD	
O=C(COC(=O)CNC(=O)c1cc(F)cc(F)c1)NNC(=O)c1cccc(Cl)c1	920655549	XPRXRAAAQYSFPL-UHFFFAOYSA-N	425.775	1.352	50	20	IDGD	
Cc1nc(N(C)C)sc1C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	1116493051	YJNUJRDEYNHZCM-UHFFFAOYSA-N	425.536	1.295	50	20	IDGD	
C[C@@H]1CN(Cc2csc(NC(=O)NNC(=O)COc3ccccc3O)n2)C[C@@H](C)O1	1318326000	GAVIHKAXKQFTRU-CHWSQXEVSA-N	435.506	1.690	50	20	IDGD	
C[C@H]1CN(C(=O)Cn2cc(NC(=O)NNC(=O)c3ccccc3Cl)cn2)C[C@@H](C)O1	1320132701	LAIZJPKNWBVAEU-BETUJISGSA-N	434.884	1.639	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NCc2cc(OCC(F)F)ccn2)c2ccccc2c1=O	1320740832	AXOXGOVCCQAGEO-UHFFFAOYSA-N	432.387	1.117	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H](C)n2ccnc2)c1	1324415137	ZYVZPBQCWXBTGM-AWEZNQCLSA-N	443.485	1.715	50	20	IDGD	
CCOC(=O)[C@H]1CN(C(=O)OC(C)(C)C)CCN1[C@@H](C)C(=O)NNC(=O)CC(C)C	1340800236	COMNRZLGJCKRCO-LSDHHAIUSA-N	428.530	1.053	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)(C)O)ccc1OC(C)C	1347468794	XNNQNUJAQPOBQW-MRXNPFEDSA-N	439.509	1.908	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2	1778484709	ODYYPXVPBRHKHB-GCKMJXCFSA-N	434.924	1.370	50	20	IDGD	
CC1=CC[C@@H](C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cccc(B(O)O)c2)C3)CC1	1778748525	PFYUVZTUNJKYBN-MEKIYTOJSA-N	440.349	1.240	50	20	IDGD	
CC(C)(C)c1cc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)[nH]n1	1779575746	UPOPOQWIJVLHLE-DYVFJYSZSA-N	431.306	1.841	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2nccnc2C(N)=O)C1	1779937044	MBCJZCWGIFLDLF-ARGWCVDVSA-N	437.928	1.111	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(-n4ccnc4)ccn3)C2)C1	1780388391	QVYBSFIMGVHWQS-NRFANRHFSA-N	443.580	1.562	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(CCN(C(=O)[C@H]3CC[C@@H]4CCC(=O)N4C3)C2)C1	1781055617	AIMILPTVJHPMHQ-CSODHUTKSA-N	437.613	1.069	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)c3cnc4[nH]ncc4c3)CCO2)C1	1781229614	GOVFTZFLBDQUHJ-MSOLQXFVSA-N	426.304	1.638	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781325267	LPYIZTVDTHUEHZ-GIPNMCIBSA-N	430.112	1.538	50	20	IDGD	
Cc1noc(C)c1CCC(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781325928	KBMTYDPQXBUJJX-RDJZCZTQSA-N	432.290	1.744	50	20	IDGD	
Cc1nc(CC(=O)N2CCO[C@]3(CCN(C(=O)[C@H](F)Br)C3)C2)c(C)s1	1781326155	KUZRJNDXTLPEEN-GOEBONIOSA-N	434.331	1.823	50	20	IDGD	
COc1cccc(CC(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)c1	1781328425	PTUHKXSULBZVGE-SJLPKXTDSA-N	429.286	1.758	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)NC(C)=O)C2	1781904752	BFNSQSJDXALQTP-KDQZPGIASA-N	432.359	1.198	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H]1Cc3ccccc3CN1)C2	1782172528	DZVAPMMQARTVNQ-XFGYDDDFSA-N	449.979	1.469	50	20	IDGD	
O=C(C(Cl)Cl)N1CCO[C@@]2(CCN(C(=O)[C@@H]3CC(c4ccccc4)=NN3)C2)C1	1782608997	WTGKERAMMNKDNW-HNAYVOBHSA-N	425.316	1.386	50	20	IDGD	
O=C(c1nc[nH]n1)N1CCO[C@@]2(CCN(C(=O)[C@H](Br)Cc3ccccc3)C2)C1	1783021775	BAZSQKMSLCDOPE-DNVCBOLYSA-N	448.321	1.254	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cccn(C)c3=O)CCO2)C1	1783344357	STXUSJBFTFSPSS-KSSFIOAISA-N	426.311	1.002	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](NC(C)=O)C(C)(C)C)CCO2	1783344777	WOKSAGGCUYJVQT-QMTMVMCOSA-N	446.386	1.541	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](Br)CC)C2)C1	1783354634	DHJQLDVIFBEKTI-IIYDPXPESA-N	435.315	1.551	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cncc(C(F)(F)F)c3)CCO2)C1	1783878229	WSLRJDQVKFPEEB-PBHICJAKSA-N	435.830	1.798	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cccc(C(F)(F)F)n3)CCO2)C1	1783878381	XPGJIEMXKKELMC-SJCJKPOMSA-N	435.830	1.798	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(OC)c(N(C)C)c3)CCO2)C1	1783880536	JYLCMIWLYSJQFA-HRAATJIYSA-N	439.940	1.459	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3C[C@@H]3C3CC3)[C@H]2C1	1783942428	QSZPYPRIDCAJDN-AXDINXHVSA-N	441.532	1.146	50	20	IDGD	
N#Cc1cccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]3C2)c1Cl	1784091465	VHUDNNNILWXDQN-TUUVXOQKSA-N	426.300	1.405	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)C3(NC(=O)OC(C)(C)C)CC3)C2)C1	1785714811	FTVYWQHOQMRDFH-LIRRHRJNSA-N	445.944	1.127	50	20	IDGD	
C=CCNC(=O)/C=C\C(=O)Nc1ccc(C2(NC(=O)CCC(=O)NN(C)C)CCC2)cc1	1785841528	CANCOKQLRAFEHL-KHPPLWFESA-N	441.532	1.352	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)c1cc[nH]c2nccc1-2	1787328389	QDCVAGQSKNOXQQ-HJPIBITLSA-N	439.285	1.798	50	20	IDGD	
CC(=O)O[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)CBr)C[C@@H]21)C(C)C	1788477287	QQSZIQFDQCDPLB-JVNPIMRCSA-N	447.370	1.585	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cn4c(F)cccc4n3)C[C@@H]21	1788763734	RCOQFEXHOYASNB-ZOBUZTSGSA-N	448.571	1.918	50	20	IDGD	
COc1cc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Cl)C[C@@H]32)ccc1[N+](=O)[O-]	1789848696	FNPFPXZLDFACKY-YFPWBOGZSA-N	443.859	1.660	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccnn3CC)C[C@@H]21	1790961646	SXKKJKORMTWTIZ-AYDFFVQHSA-N	427.343	1.670	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(C(F)F)no3)C[C@@H]21	1791057352	BLAUUGODHGJEHE-QYTUQVAYSA-N	436.253	1.989	50	20	IDGD	
C[C@H](Sc1ccccn1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21	1791579682	SVXXIVJYBIODHX-QXKUPLGCSA-N	427.954	1.142	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(Cl)nc1	1792363822	UMIWFXWWQLESGL-IKVITTDRSA-N	430.730	1.969	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(S(C)(=O)=O)c1	1792695062	GRRZFSDGVKAXFT-CYGHRXIMSA-N	442.965	1.701	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1cnccc1C(F)(F)F)C2)[C@@H](O)CCl	1792975618	RVRXRHOMGUMNPD-YXPYIKCWSA-N	449.857	1.222	50	20	IDGD	
CCc1c(Br)c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](O)CCl)nn1C	1793109840	GVGWNQZXNJIZAZ-NOHGZBONSA-N	447.761	1.597	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C#CC1CC1	1793256929	FFGGTQGRMRRLSL-DFGXFYAUSA-N	439.940	1.122	50	20	IDGD	
Cc1c[nH]c(C)c1CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnccc1C(=O)NN)C2	1793266759	GTBDFJJJHJFVQP-BJWYYQGGSA-N	438.532	1.515	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](Br)Cc1ccccc1)C2)c1cnc[nH]1	1794716586	JQVUEVKCZSIHHS-KYHPRHEASA-N	447.333	1.619	50	20	IDGD	
CNCCCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1796036140	OBJNLBTXBDFLKY-FZKCQIBNSA-N	430.977	1.756	50	20	IDGD	
CCS(=O)(=O)c1ccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Cl)cc1	1796370133	HYBDCKDAIZPNDY-DACLVMHWSA-N	446.928	1.147	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccnc3ncccc13)C2)[C@H](F)Br	1799347020	KCLBCCJXIDYPBL-JLUCKKNBSA-N	437.269	1.524	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@H]2[C@H](C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@H](F)Cl)C4)[C@@H]2C1	1800717995	IJBYHZBQEJNCGQ-LABKCIJJSA-N	445.919	1.223	50	20	IDGD	
CSc1ncccc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)Br	1800760641	XVNSCVKPAISOCY-NRWUCQMLSA-N	428.352	1.790	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(-c3ccccc3)on1)C2	1800973266	FKINZYZILZHZCK-RCJHGTSTSA-N	433.892	1.799	50	20	IDGD	
COC[C@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1nc3cc([N+](=O)[O-])ccc3[nH]1)C2	1802280830	VPVCBCOULDDHJK-OPDFLTKYSA-N	435.868	1.977	50	20	IDGD	
COc1ccc(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CCC(=O)NN(C)C)cc1C	1802333995	FNQVGJLTLNXSSF-REPLKXPHSA-N	430.549	1.557	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1CCN(C(=O)c2ccnnc2O)[C@H]1c1cccnc1	1803013560	DZHZMRKEWZZHHX-INWMFGNUSA-N	448.321	1.928	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)/C=N/O[C@@H]2CCCCO2)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803142755	IDTILXNXECIRQL-XMIRXOPOSA-N	438.912	1.216	50	20	IDGD	
Cc1ccn(C)c1C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1807360043	GPUXMJRDURBHOR-UGKGYDQZSA-N	446.316	1.042	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@@H](CNC(=O)Cn2ccnn2)[C@@H]1c1cccnc1	1807681896	NIBYWSOGNVYXQM-ZVZYQTTQSA-N	425.320	1.615	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)c1cccc2[nH]ncc12	1808027471	OTQSQAHTHRHXNH-JVPBZIDWSA-N	427.892	1.877	50	20	IDGD	
Cc1nn[nH]c1C(=O)N1CC[C@H](CNC(=O)[C@@H](F)Br)[C@H]1c1cccnc1	1808662756	QYKBGFXKPJTSDX-MRVWCRGKSA-N	425.262	1.518	50	20	IDGD	
Cc1ocnc1C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1	1811081020	VRIANOWELVZOID-DNVCBOLYSA-N	449.471	1.010	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)CNC(=O)c2ccco2)[C@@H]1c1cccnc1	1813031349	QOENBOKVIAQOLW-TXPKVOOTSA-N	448.907	1.364	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)n2)[C@@H]1c1cccnc1)C(Cl)Cl	1813080255	NZDMKULDCAUAMT-GXFFZTMASA-N	426.260	1.406	50	20	IDGD	
COc1ccc(CC(=O)Nc2cc([C@@H]3CCCCN3C(=O)[C@H](O)CCl)[nH]n2)cc1O	1814647621	SJFUXFITRKBAIV-GOEBONIOSA-N	436.896	1.958	50	20	IDGD	
CCC[C@@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CNCP(=O)(O)O)[nH]n1	1815317557	AHTGCMBUSHSERP-DGCLKSJQSA-N	435.849	1.534	50	20	IDGD	
O=C(CCc1ccc[nH]1)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(B(O)O)cc1)CC2	1815468795	KNWZIUFAHAFBPM-INIZCTEOSA-N	438.318	1.010	50	20	IDGD	
Cc1nc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)[nH]n2)co1	1816465705	HANYZICPAZIKSR-INIZCTEOSA-N	438.448	1.324	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnoc2C2CC2)n[nH]1	1816659659	ZCABMPYVWDHCKE-INIZCTEOSA-N	443.508	1.954	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)Cc2ccsc2)[nH]n1)c1ccc(B(O)O)cc1	1817471704	XNWCOGQDJVGNLR-GOSISDBHSA-N	438.318	1.700	50	20	IDGD	
Cc1ccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)c(O)c1	1817479410	MHUZVJJRJQJMQZ-IBGZPJMESA-N	448.288	1.723	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccn3c(O)nnc23)n[nH]1	1817967847	ANRWPHBOSQAKJR-OCCSQVGLSA-N	447.883	1.718	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](O)CCl)CC2)c1cc(-c2ccccn2)[nH]n1	1820639327	HJNZIXYWFGEVDI-ZUZCIYMTSA-N	446.920	1.754	50	20	IDGD	
O=C(N[C@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1)c1nc[nH]c1[N+](=O)[O-]	1823002177	ACGCJCMGYQBIMO-SSDLBLMSSA-N	447.246	1.691	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](C)CS(C)(=O)=O)CC1	1824529110	YZFDYNJHWQTSLX-XIRDDKMYSA-N	437.002	1.541	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)C(O)O)CC2	1824799918	CWLNDKMCEWNFRQ-SBKJXLNCSA-N	434.424	1.251	50	20	IDGD	
CC(=O)C[C@@H](C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827060526	NGCYKASSSWUJAY-IERDGZPVSA-N	428.338	1.215	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](F)Cl)CC1	1827609119	NFZMTZWMNAQDPL-JKSUJKDBSA-N	425.892	1.453	50	20	IDGD	
O=C(CCn1cncn1)N1CCC([C@H]2CCCCN2C(=O)[C@@H](F)Br)CC1	1830381096	GYCAXJUZDAQLMD-GDBMZVCRSA-N	430.322	1.978	50	20	IDGD	
O=C(c1cccc2c1CCCC2)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1830738281	NHDDNBFAJIHOQZ-UGKGYDQZSA-N	436.936	1.235	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)NCCC#N)C2)C1	1831646486	LWTXINSKQRCGCY-UZLBHIALSA-N	428.961	1.132	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cc4sccn4c3)CC2)CC1)[C@H](O)CCl	1833310188	BLGZMHKHDXDVOR-QGZVFWFLSA-N	438.981	1.786	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCC(N2CCC(NC(=O)c3cnsn3)CC2)CC1	1833979021	IADFFJNKKSUIAB-KRWDZBQOSA-N	434.393	1.960	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)c3ccnc(F)c3)C2)C1	1834819086	HSNVYZVJKWFLIV-KRWDZBQOSA-N	430.274	1.076	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CCC(N3CCC(NC(=O)[C@@H](F)Cl)CC3)CC2)o1	1835080327	JGZASHMGRCKWTB-QGZVFWFLSA-N	428.892	1.958	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](F)Cl)CC2)CC1)c1ncn(-c2ccccc2)n1	1835155871	RSNODHCCDUMVIM-GOSISDBHSA-N	448.930	1.987	50	20	IDGD	
CCc1ccnc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@](C)(Cl)CCl)C3)C2)c1	1836359985	MXTLGKJCVIDHMW-WOJBJXKFSA-N	444.359	1.950	50	20	IDGD	
C[C@@H](C(=O)N1CCC(N2CCC(NC(=O)[C@H](F)Br)CC2)CC1)n1cccn1	1836414376	HGVMJYUNDOEILH-BBRMVZONSA-N	444.349	1.706	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(NC(C)=O)o3)CCO2)C1	1837448413	LGQYDEWFDUJFNH-FOIQADDNSA-N	441.912	1.716	50	20	IDGD	
CC(C)n1ccc(C(=O)N2CCOC[C@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)n1	1837715149	ZDPQMAXHJVHIHJ-FQEVSTJZSA-N	438.601	1.386	50	20	IDGD	
Cc1nccn1[C@@H](C)C(=O)N1CCOC[C@@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1837718081	XIWYHGDKUKUMOL-OXJNMPFZSA-N	438.601	1.060	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)N1CCC(OC2CCN(C(=O)C(Cl)Cl)CC2)CC1	1838383596	LRJFHMWUFDOBCK-GFCCVEGCSA-N	437.368	1.496	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(OC)cc3O)CCO2)C1	1838889580	XNVBTTAVWXMOHL-OXJNMPFZSA-N	426.897	1.488	50	20	IDGD	
O=C(c1ccc(F)cc1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1838956732	UPKRDFWOQWXDHD-RHSMWYFYSA-N	433.249	1.586	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccncc3)CCO2)C1	1839061454	VHOSCRRDVGELNN-LPHOPBHVSA-N	440.338	1.254	50	20	IDGD	
COc1ccnc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)c1	1839153350	HGIIXLWBONMVOH-MOPGFXCFSA-N	446.331	1.397	50	20	IDGD	
Cc1cccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)n1	1839197744	HLWZYNBKCYBQHM-PBHICJAKSA-N	430.274	1.151	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc4ccnn4c3)CCO2)C1	1839569337	YJPLZVOXMLKHOH-OAQYLSRUSA-N	434.924	1.669	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)s1	1840030980	BRJOSDMTZZRPGX-SUMWQHHRSA-N	431.352	1.910	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(F)cc3F)C2)C1	1840034810	XUYXNCIWAKQFOJ-KZULUSFZSA-N	447.276	1.818	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)C3CCSCC3)C2)C1	1840035929	KYCORZLUWROFCP-CXAGYDPISA-N	435.384	1.369	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CCc4ccoc4C3)C2)C1	1840150491	LTQGBIVQORDQIG-XGHQBKJUSA-N	440.924	1.095	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)COc3ccccc3C)C2)C1	1840152158	ZJKQKQVRBPZZKR-UWJYYQICSA-N	440.924	1.084	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(C)c(OC)c3)C2)C1	1840154551	ZGIWQSITDKGQKF-DYESRHJHSA-N	440.924	1.327	50	20	IDGD	
O=C(c1ccc2nc[nH]c2c1)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840188435	JDPCUEKNYNAXIT-GOSISDBHSA-N	427.288	1.437	50	20	IDGD	
O=C(C(Cl)Cl)N1CCO[C@]2(COCCN(C(=O)[C@H]3CCc4ccccc43)C2)C1	1840190845	QJJICZFLIOPHSU-JXFKEZNVSA-N	427.328	1.977	50	20	IDGD	
Cc1cc(C)cc(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)c1	1840304670	KSOBRTNFAPOAHE-UGKGYDQZSA-N	438.952	1.292	50	20	IDGD	
Cc1ccn2c(=O)c(C(=O)N3CC4(CCCN4C(=O)[C@@H](C)CBr)C3)cnc2c1	1841287600	XLBYLYGBVGTYIE-AWEZNQCLSA-N	447.333	1.851	50	20	IDGD	
COc1ccc2c(CC(=O)N3CCCC34CN(C(=O)CCC(=O)NN(C)C)C4)c[nH]c2c1	1841383536	GVLZFAONKLAQFH-UHFFFAOYSA-N	441.532	1.295	50	20	IDGD	
CN1CCC[C@H]1C(=O)N1CC2(CCCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C1	1841923900	CQSNMQZEOFCRQV-GJZGRUSLSA-N	428.961	1.416	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](CCN)C(=O)N1CCCC12CN(C(=O)CCBr)C2	1842911275	OYJCSPDOTWHIPR-CYBMUJFWSA-N	447.374	1.217	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1ccn3nccc3c1)C2	1843416127	BIXIEMMADFIAPC-MFKUBSTISA-N	433.472	1.285	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)c2cccc(-c3ccccc3)n2)C1	1843479200	NNJFHTRTGIWXJP-UHFFFAOYSA-N	441.296	1.559	50	20	IDGD	
O=C(CCBr)N1CC2(CCCN2C(=O)c2ccc([N+](=O)[O-])c3c2OCO3)C1	1844757782	MTFXKUANNNWINH-UHFFFAOYSA-N	440.250	1.926	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)c2cnc3c(F)c(F)ccc3c2)C1	1845688645	NZNVPHJNSAOHPE-UHFFFAOYSA-N	445.470	1.703	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CNC(=O)OC(C)(C)C	1847494368	HFAZFXBFTHKXPO-ZOBORPQBSA-N	448.358	1.105	50	20	IDGD	
CCOc1ccc(OCC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1	8020934	OTEJTRKQWNCROL-UHFFFAOYSA-N	426.517	1.824	50	20	IDGD	
C#CCNS(=O)(=O)c1ccc(C(=O)NNC(=S)Nc2ccc(OCC)cc2)cc1	28633762	QASRSQHJIMOSLQ-UHFFFAOYSA-N	432.527	1.628	50	20	IDGD	
C[C@H]1CN(CCNC(=O)NNC(=O)[C@H](C)Oc2cccc(Br)c2)CCO1	726258561	XJXIZFLBIRVUHD-STQMWFEESA-N	429.315	1.268	50	20	IDGD	
O=C(CCN1C(=O)[C@@H]2CCCC[C@H]2C1=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	726867254	CBWKCHLVOAUZJJ-IAGOWNOFSA-N	434.518	1.136	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)[C@@H](C)NC(=O)c2n[nH]c3ccccc23)o1	728209274	JRYWOFOBHCTFBW-CYBMUJFWSA-N	426.477	1.577	50	20	IDGD	
COc1cccc(N2CC[C@H](NC(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)C2)c1	728221468	VEEMPMCLNWFLEX-AWEZNQCLSA-N	436.472	1.165	50	20	IDGD	
O=C(NNC(=O)c1cccc(OC(F)F)c1)Nc1ccccc1CN1C(=O)CNC1=O	728593290	SZMQEDMYOLGKJS-UHFFFAOYSA-N	433.371	1.806	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)C2CCN(S(=O)(=O)c3ccccc3F)CC2)c1	728827531	RRJFKLJAFKJKRG-UHFFFAOYSA-N	430.461	1.559	50	20	IDGD	
COC(=O)c1cn(CC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c2ccccc12	728848123	WGEAFWWUPFFMEK-UHFFFAOYSA-N	436.472	1.282	50	20	IDGD	
CCOc1ccc(/C=C(/C#N)C(=O)N2CCN([C@H](C)C(=O)NCCCOC)CC2)cc1	728889237	SBRHENQJVGBCJR-HWLQVLAGSA-N	428.533	1.678	50	20	IDGD	
O=C(NNC(=O)N1CCO[C@H](c2ccccc2F)C1)C1CCN(c2ncccn2)CC1	728961442	HYOIGYMKCHEYQS-SFHVURJKSA-N	428.468	1.646	50	20	IDGD	
COc1ccc(C(=O)NCC(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)cc1OC	728974087	CWUXBOCPGNYQKX-UHFFFAOYSA-N	443.428	1.573	50	20	IDGD	
CCCCN1C(=O)CC[C@H](C(=O)NNC(=O)Cc2cc[nH]n2)[C@H]1c1ccccc1OC	730102461	FCVFKFPHGPIOOC-LAUBAEHRSA-N	427.505	1.888	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)N[C@H]1CCOc2ccc(F)cc21	731679384	KLIKGSOMRCAKOX-AWEZNQCLSA-N	435.481	1.895	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)c1ccc2c(c1)S(=O)(=O)N=C1N=CNN12)c1ccccc1	731996878	GWRMBNXISVSGID-CQSZACIVSA-N	426.458	1.053	50	20	IDGD	
COc1ccc(C(=O)CNC(=O)CCC(=O)NNc2nc3ccccc3c(=O)n2C)cc1	733261691	HJVQRUMRVOTYGS-UHFFFAOYSA-N	437.456	1.165	50	20	IDGD	
Cn1c(=O)c2cc(C(=O)NNc3ccc(Br)cc3Cl)n(C)c2n(C)c1=O	733807407	DZTZQLVQARTWLU-UHFFFAOYSA-N	440.685	1.749	50	20	IDGD	
COc1ccc([C@@H]2[C@@H](C(=O)NNC(=O)COc3ccc(F)cc3)CCC(=O)N2C)cc1	734418705	HEVZVBAOIJBXEV-GHTZIAJQSA-N	429.448	1.970	50	20	IDGD	
COc1ccc(C)cc1CC(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	735117347	RVWUIZFMQLUNAW-UHFFFAOYSA-N	433.534	1.021	50	20	IDGD	
O=C(NNc1cccnn1)c1ccccc1NS(=O)(=O)c1ccc2c(c1)OCCO2	736697949	PUYNXGIJWNQGTH-UHFFFAOYSA-N	427.442	1.806	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC[C@H]2C)cc1	740853389	QEGCCKPTYYDJFF-CQSZACIVSA-N	438.550	1.316	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)N[C@@H](CCCO)c1ccccc1	741094567	LHRNLWZPZSVZDE-INIZCTEOSA-N	433.534	1.746	50	20	IDGD	
CN(CCCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)C1=NS(=O)(=O)c2ccccc21	742031744	MSNDNCQQEQZFSI-UHFFFAOYSA-N	445.457	1.217	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)[C@@H](c2cccc(F)c2)N2CCOCC2)nc2ccccc21	742034517	PAASHVQMSXQNDW-OAQYLSRUSA-N	425.464	1.476	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C[C@@H](C)/N=C1/NS(=O)(=O)c2ccccc21)c1ccccc1	742662221	ZEVTWYOFUVSSQW-ZBFHGGJFSA-N	428.514	1.845	50	20	IDGD	
CCOc1ccccc1C(=O)NCC(=O)NNC(=O)c1cc(Br)ccc1O	743729733	FUZUDQVIPHJNPA-UHFFFAOYSA-N	436.262	1.744	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)CN2C(=O)N[C@](C)(C3CC3)C2=O)cc1Cl	743834750	RUFNFYYRPFIVIE-GOSISDBHSA-N	439.856	1.230	50	20	IDGD	
C[C@H](C(=O)NNc1c(F)cc(F)cc1Br)N1C(=O)[C@H]2[C@H](C1=O)[C@H]1CC[C@H]2O1	744368534	ZTFLBMUEFZVRAZ-FVYJHBBRSA-N	444.232	1.721	50	20	IDGD	
COc1cc(CC(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)cc(OC)c1OC	744476333	IIABFUHPWCZHEC-UHFFFAOYSA-N	427.413	1.131	50	20	IDGD	
C[C@]1(NNC(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2=O)CCS(=O)(=O)C1	745875096	KXNIMDKDFJXMHF-KDOFPFPSSA-N	446.476	1.164	50	20	IDGD	
Cc1cccc([C@H](CNC(=O)NNC(=O)Cc2cn3ccccc3n2)N2CCOCC2)c1	746750110	LJRGCDAGZVJBRD-FQEVSTJZSA-N	436.516	1.589	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)NCC(=O)N1CCC(Cc2ccccc2)CC1	746775222	DCSUJSXXISTIAA-UHFFFAOYSA-N	440.500	1.583	50	20	IDGD	
O=C(CCCN1C(=O)CNC1=O)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1	747786947	FVYFSIMPDPGNDM-FQEVSTJZSA-N	449.511	1.093	50	20	IDGD	
COc1cc(OC)cc(N2CC[C@H](NC(=O)NNC(=O)[C@@H]3COc4ccccc4O3)C2)c1	748662998	YGSXUINYAYFNAI-XOBRGWDASA-N	442.472	1.453	50	20	IDGD	
CCC(CC)[C@H](C(=O)OCC(=O)NNC(=O)c1cccc(Cl)c1)N1CCOCC1	750514975	UQXSXAMCTBXHFH-GOSISDBHSA-N	425.913	1.781	50	20	IDGD	
Cc1nn(C)c2ncc(S(=O)(=O)NNC(=O)c3ccc(F)cc3Br)cc12	751269228	DDLWLJWTNOOVLP-UHFFFAOYSA-N	442.270	1.802	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2ccc(=O)n(-c3cccc(F)c3)c2)c2ccccc2c1=O	751297760	RYXBNCZGYPCPDM-UHFFFAOYSA-N	447.426	1.781	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)c2cc(S(N)(=O)=O)cc(C)c2C)cc1OC	751556862	VLDBXWBORSUSCZ-UHFFFAOYSA-N	435.502	1.823	50	20	IDGD	
O=C(NNC(=S)NCCc1cccs1)c1cccc([N+](=O)[O-])c1N1CCOCC1	753076096	DYNBXBOPUPJIJJ-UHFFFAOYSA-N	435.531	1.845	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)N2CC(=O)N(CC(F)(F)F)C2)N(C)c2ccccc21	754727747	ASDMJDAQSGLAND-UHFFFAOYSA-N	435.406	1.848	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNS(=O)(=O)c1cccc(Cl)c1Br	755021299	YYQJVTXZVWRSJD-UHFFFAOYSA-N	442.719	1.937	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)[C@H](C)CS(=O)(=O)c2ccc(F)cc2)cn1	755668343	NEDACTIADHKESW-LLVKDONJSA-N	426.495	1.657	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)Nc2cccc(-n3nnnc3SC)c2)cc1	755734977	PZZHBVUYVLZUIX-UHFFFAOYSA-N	429.462	1.625	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)Nc2ccc(F)c(S(=O)(=O)N3CCOCC3)c2)cc1	756034153	WOBISNCKZYQGDX-UHFFFAOYSA-N	447.448	1.185	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)c1	756206196	LHSZTAHAZMCZRG-UHFFFAOYSA-N	446.529	1.770	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)Nc1cccc(N2CCS(=O)(=O)CC2)c1	756208555	ZGGLBPGVMNHMLW-UHFFFAOYSA-N	441.513	1.729	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)Nc1ccc(OC)c(NS(C)(=O)=O)c1	756781408	DNVJGSHRRHKZMA-UHFFFAOYSA-N	436.490	1.861	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)N[C@H]2CN(C(=O)OC(C)(C)C)C[C@H]2C#N)c1	758774396	HIMCEKPEUZZDHN-CVEARBPZSA-N	431.493	1.772	50	20	IDGD	
CCCC(=O)N1CCC[C@@H](C(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)C1	758787019	RDCPVKKVXNKFIY-MRXNPFEDSA-N	439.557	1.661	50	20	IDGD	
CN(CC(=O)NNc1ncccc1[N+](=O)[O-])S(=O)(=O)c1ccc(Br)cc1	759302086	JQJBQOMALDGFFZ-UHFFFAOYSA-N	444.267	1.516	50	20	IDGD	
CCOCCCn1c(NNC(=O)c2cn(CC3(C)COC3)nn2)nc2ccccc2c1=O	759868246	UKAPOVLDYXCUCY-UHFFFAOYSA-N	441.492	1.208	50	20	IDGD	
O=C(N=c1cc[nH]cc1I)NNC(=O)c1ccc2c(c1)OCO2	760025512	UUBHQGRJUSUNDL-UHFFFAOYSA-N	426.170	1.303	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)C(C)(C)NC(=O)C(F)(F)F)n[nH]2)cc1OC	760487001	REFOTZOYOZHNKA-UHFFFAOYSA-N	443.382	1.312	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)c1ccc(OCC(F)F)nc1	761195864	YMRNMTSKZHNKOU-UHFFFAOYSA-N	433.459	1.699	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(-n2cccn2)c(Cl)c1	763470511	JHFPBLOULCKEFU-UHFFFAOYSA-N	428.792	1.834	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1cnn(-c2ccccc2Cl)c1	763471638	VPAAXAGYYOQAFN-UHFFFAOYSA-N	428.792	1.834	50	20	IDGD	
CCCc1ccc(NC(=O)C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1	763530293	HIMIFDUUQMZQNX-UHFFFAOYSA-N	437.544	1.937	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(N3CCC(N(C)C)CC3)cc2)c(C)o1	763583325	LXUWTZPMDNCEQQ-UHFFFAOYSA-N	427.505	1.827	50	20	IDGD	
COC(=O)c1cc(Cl)ccc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccccc2)[nH]n1	763611772	CUNWGICNFHGAHM-UHFFFAOYSA-N	441.831	1.916	50	20	IDGD	
CCn1cnnc1-c1ccccc1NC(=O)C(=O)NNC(=O)COc1ccc(C)c(C)c1	763666700	JTNNBVITMDDRLH-UHFFFAOYSA-N	436.472	1.747	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(F)c(NC(=O)C(=O)NNC(=O)c2cccc(Cl)c2)c1	763750519	ONTRQHZSMASEQI-UHFFFAOYSA-N	442.856	1.129	50	20	IDGD	
CC(C)C[C@@H](C)n1nccc1NC(=O)C(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	763791720	XZTJVSNWCGSTQY-CYBMUJFWSA-N	439.476	1.137	50	20	IDGD	
CC(C)OCc1cccc(NC(=O)C(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])c1	763806109	ZHFUTRDJJVMQQZ-UHFFFAOYSA-N	430.417	1.685	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N2CCCCC2)cc1NC(=O)C(=O)NNC(=O)C(C)C	763817509	MBAPCNZJYBRSCZ-UHFFFAOYSA-N	440.522	1.002	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(N3CCOCC3)c(C)c2)cc1	763820310	FLJOJBWXAUDJEU-UHFFFAOYSA-N	426.473	1.305	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(Cl)c2-n2cncn2)cc1	763820807	JBMILDCMWQDGPV-UHFFFAOYSA-N	428.836	1.394	50	20	IDGD	
COC(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)c1	763840139	IVMDJLIPDSQRAB-OAHLLOKOSA-N	427.457	1.572	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)N2C[C@H](C)Oc3ccccc32)cc1	763859442	BCLRSVIJYUZZOC-GJZGRUSLSA-N	427.457	1.814	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cccc(CN(C)C)c2)cc1	763861889	SVAHPMVTQLBSEF-OAHLLOKOSA-N	428.489	1.700	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccc(CC(=O)N(C)C)cc1	763871370	GCVOFESULFMGRI-ZDUSSCGKSA-N	430.436	1.010	50	20	IDGD	
CC(=O)Nc1cc(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)c(F)cc1F	763996019	TYMSAVLXLFMVQK-UHFFFAOYSA-N	444.192	1.414	50	20	IDGD	
C[C@H]1CN(Cc2cccc(NC(=O)C(=O)NNC(=O)Cc3ccsc3)c2)C[C@H](C)O1	764035295	RCFLIBNUXOTQEH-GJZGRUSLSA-N	430.530	1.686	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cccc(C(=O)Nc3ccc(Cl)cn3)c2)n[nH]1	764098654	PLDIIGGKUGOBHA-UHFFFAOYSA-N	441.835	1.419	50	20	IDGD	
C#CCOc1ccc(F)cc1NC(=O)C(=O)NNC(=O)c1ccc(CN(CC)CC)o1	764139406	STYHGKGJOUFANT-UHFFFAOYSA-N	430.436	1.672	50	20	IDGD	
Cc1cc(C(=O)NCC(C)C)ccc1NC(=O)C(=O)NNC(=O)[C@@H]1Cc2ccccc2O1	764163340	IUEITKOZAFAILD-IBGZPJMESA-N	438.484	1.470	50	20	IDGD	
Cc1nc2cc(NC(=O)C(=O)NNC(=O)c3cc(Br)ccc3O)ccc2n1C	764281127	ZJBJLKLSGJCZGZ-UHFFFAOYSA-N	446.261	1.750	50	20	IDGD	
CS(=O)(=O)c1c(Cl)cccc1NC(=O)C(=O)NNC(=O)CCCc1cccs1	764343033	MEAIACYMBJUFOV-UHFFFAOYSA-N	443.934	1.914	50	20	IDGD	
COc1ccc(Cn2ncc(C)c2NC(=O)C(=O)NNC(=O)c2ccc(C)o2)cc1OC	764370258	PSGODIVUWVYFFL-UHFFFAOYSA-N	441.444	1.558	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2C)n[nH]1	764377369	OHXWCYATPDEKAF-UHFFFAOYSA-N	438.400	1.702	50	20	IDGD	
CCn1c(CCC(=O)NNc2nccnc2OC)nc2cc(S(=O)(=O)N(C)C)ccc21	764482609	YWMPAAYXFQCHJL-UHFFFAOYSA-N	447.521	1.181	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)cc(OC)c1O	764753119	RVCAHDNIYXHMQD-UHFFFAOYSA-N	442.516	1.297	50	20	IDGD	
O=C(/C=C/SCc1ccco1)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765737593	GXFKIOYMHDLQFR-RIYZIHGNSA-N	428.514	1.632	50	20	IDGD	
CCC(=O)Nc1cccc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)c1	765737686	ICXCCTGPDKJOAT-UHFFFAOYSA-N	437.500	1.254	50	20	IDGD	
NC(=O)Nc1ccc(C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)cc1	765759410	UOLDUELWQZZBLI-UHFFFAOYSA-N	444.923	1.409	50	20	IDGD	
C[C@@H](CN1CCN(c2ccccc2)CC1)NC(=O)NNc1ccccc1S(C)(=O)=O	765804673	MEFQPLXAJWIWBF-KRWDZBQOSA-N	431.562	1.927	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CN2CCNC(=O)[C@H]2c2cccc(Br)c2)cc1	766251357	QKXXKSGUJSOIDZ-GOSISDBHSA-N	445.317	1.692	50	20	IDGD	
CC(C)CNS(=O)(=O)c1cc(C(=O)NNC(=O)C(C)(C)O)c(Cl)cc1Cl	768246354	YHIKLWZYJUXOOR-UHFFFAOYSA-N	426.322	1.460	50	20	IDGD	
CC(C)(O)C(=O)NNC(=O)c1ccc2c(=O)n(CCc3ccccc3)c(S)nc2c1	768261545	MRVUZLYAXSICTC-UHFFFAOYSA-N	426.498	1.460	50	20	IDGD	
CC(C)(C)[C@@H](Br)C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	768274061	CPWXLSLWFCZDOP-INIZCTEOSA-N	439.354	1.401	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)/C=C/c1ccccc1)C(=O)NNC(=O)c1cc(C)[nH]n1	768277363	JUQDKCARDVJQIO-SLZMIMFISA-N	437.547	1.191	50	20	IDGD	
CCOc1ccc(N2C(=O)c3ccc(C(=O)NNC(=O)c4cc(C)[nH]n4)cc3C2=O)cc1	768279343	WMTFYVCBAIEJHH-UHFFFAOYSA-N	433.424	1.992	50	20	IDGD	
CN(C)C(=O)COc1ccc(C(F)(F)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1	769435417	LVCNDASUMQQMMZ-UHFFFAOYSA-N	436.371	1.615	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCN(C(=O)OCc2ccccc2)C1)c1nnc(O)c2ccccc12	770073976	QWHHAKLZXYDDMJ-OAHLLOKOSA-N	435.440	1.755	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)NCc3ccc(S(C)(=O)=O)cc3)nc21	770345497	NTQDDUUXYMBVGH-UHFFFAOYSA-N	433.494	1.517	50	20	IDGD	
CC[C@@H](NC(=O)NNc1nc(O)c2cnn(C)c2n1)[C@H]1CN(Cc2ccccc2)CCO1	770410085	GYZIILTUYYEDIQ-IAGOWNOFSA-N	440.508	1.375	50	20	IDGD	
CCN1CCC[C@H]1CN1C[C@H](C(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)CC1=O	770958113	IPPDWKKYYDRDEX-KGLIPLIRSA-N	444.540	1.063	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)/C(=C\c3cccnc3)NC(=O)c3ccccc3)nc21	770973199	CGBWOAGULQKBQF-MHWRWJLKSA-N	430.428	1.378	50	20	IDGD	
COc1cc(CCC(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)cc(OC)c1OC	772188399	NBTNOLCNLZBQPV-UHFFFAOYSA-N	449.891	1.762	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)c1cccc(NS(=O)(=O)C(F)(F)F)c1	772266889	QOVJDGWIEOWZAT-JTQLQIEISA-N	439.412	1.687	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)c2cccc(CS(=O)(=O)NC(C)(C)C)c2)c1	773072001	IYKXVMHOWWGHNX-UHFFFAOYSA-N	447.517	1.333	50	20	IDGD	
Cc1nn([C@H]2CCS(=O)(=O)C2)c(C)c1NC(=O)C(=O)NNc1cccc(Cl)c1C	773771246	QHOGLGGKTAGQKD-ZDUSSCGKSA-N	439.925	1.903	50	20	IDGD	
O=C(CCSc1ccc(F)cc1)NNC(=O)Nc1ccc(C[C@@H]2NC(=O)NC2=O)cc1	775703837	ROLOSCSWJZQZMS-INIZCTEOSA-N	445.476	1.911	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)Nc1ccc(C[C@H]2NC(=O)NC2=O)cc1	775705996	LHRRIJBJOUQUIT-XHDPSFHLSA-N	429.408	1.196	50	20	IDGD	
O=C(Cc1ccc2ccccc2c1)NNC(=O)N[C@@H]1CCO[C@@]2(CCS(=O)(=O)C2)C1	776074104	WZNYOZLXVNMPCW-NQIIRXRSSA-N	431.514	1.449	50	20	IDGD	
O=C(NCc1ccc(N2CCCS2(=O)=O)c(F)c1)NNc1ccc(-n2cccn2)nn1	776242769	AJBXOSNKOMUGTF-UHFFFAOYSA-N	446.468	1.168	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)N1CCC(Oc2cncc(Cl)n2)CC1	777500588	ZQYAZKSQMPZDQC-UHFFFAOYSA-N	438.897	1.206	50	20	IDGD	
COc1ccc(Cn2cc(C(=O)NNC(=O)COc3ccccc3OC)cn2)cc1OC	778287896	AQLDFMODAOQITO-UHFFFAOYSA-N	440.456	1.797	50	20	IDGD	
COc1ccc2nc(NNC(=O)C3=NN([C@@H]4CCS(=O)(=O)C4)C(=O)CC3)c(C)cc2c1	778482201	SINMHFOWLSWBHJ-CQSZACIVSA-N	445.501	1.160	50	20	IDGD	
Cc1nn(-c2ccccc2)cc1CCCNC(=O)NNC(=O)CNC(=O)OC(C)(C)C	778625192	WTAGKQIBYVIMDA-UHFFFAOYSA-N	430.509	1.968	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@H](C(=O)NNc2nc(-c3ccccc3)no2)[C@H](C)O)cc1	779514049	JTFAPZIVNDTIEE-BBRMVZONSA-N	431.474	1.216	50	20	IDGD	
COc1cccc(NNC(=O)c2cc(I)ccc2-n2cnnn2)n1	781023611	COONEXQGVKCEFJ-UHFFFAOYSA-N	437.201	1.427	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN[C@H](CO)c2ccc(Br)cc2)n1	782075527	MBQPZUHBRVUOQR-CYBMUJFWSA-N	427.324	1.227	50	20	IDGD	
CC(=O)N1CCN(Cc2ccccc2NC(=O)NNC(=O)CCc2ccccc2O)CC1	782079352	ZYDLKXVWGDUOQA-UHFFFAOYSA-N	439.516	1.842	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(OC3COC3)cc2)o1	782117442	OILLNDBOPXDNKK-UHFFFAOYSA-N	430.461	1.299	50	20	IDGD	
COc1c(C)ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)c1C	783265186	WACWGMCQGZPLIU-UHFFFAOYSA-N	435.506	1.476	50	20	IDGD	
COc1ccc(C(=O)N2CCOCC2)cc1NC(=O)C(=O)NNc1cc(C)ccc1C	783369016	GVZJEVBQIFKDLJ-UHFFFAOYSA-N	426.473	1.866	50	20	IDGD	
CCOC(=O)c1c(C2CC2)csc1NC(=O)C(=O)NNc1ccc(-n2cccn2)nn1	783433338	PYHNWGCLVWUGKE-UHFFFAOYSA-N	441.473	1.860	50	20	IDGD	
Cc1ccnc(NNC(=O)C(=O)Nc2ccc(S(=O)(=O)NC3=NCCCCC3)cc2)c1	783928690	CRLKGKFKXQONOY-UHFFFAOYSA-N	444.517	1.723	50	20	IDGD	
Cc1ccc(NNC(=O)C(=O)Nc2cccc(NC(=O)CN3CCCCCC3)c2)nn1	783947577	FWNMUXMUEFBOQK-UHFFFAOYSA-N	425.493	1.681	50	20	IDGD	
Cc1ncc(-c2ccccc2)cc1NC(=O)C(=O)NNC(=O)CNC(=O)c1cccs1	784004252	CNALGAPCHXBPDI-UHFFFAOYSA-N	437.481	1.634	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ncccc2Cl)cc1	784816621	QKLFOWJTOROKBV-UHFFFAOYSA-N	425.898	1.847	50	20	IDGD	
Cc1ccc(C(=O)N2CCOCC2)cc1NC(=O)C(=O)NNc1cccc([N+](=O)[O-])c1	784830964	FLWWPBBOHFMIFC-UHFFFAOYSA-N	427.417	1.457	50	20	IDGD	
CN(C)c1nccc(NNC(=O)C(=O)Nc2cc(Cl)ccc2N2CCSCC2)n1	784971068	SFWSKBOHQOXXTG-UHFFFAOYSA-N	435.941	1.831	50	20	IDGD	
Cn1ccnc(NNC(=O)C(=O)Nc2ccc(I)cc2Cl)c1=O	785086037	JXXPMZJZVYUBEE-UHFFFAOYSA-N	447.620	1.120	50	20	IDGD	
CC(C)OC(=O)c1c(NC(=O)C(=O)NNc2nccn(C)c2=O)sc2c1CCCC2	785086854	STIUQVLUOHDONA-UHFFFAOYSA-N	433.490	1.368	50	20	IDGD	
Cc1cc2ccc(Cl)cc2nc1NNC(=O)C(=O)Nc1cnn(CC(=O)NC2CC2)c1	785160477	FIASRNZIMGPIBT-UHFFFAOYSA-N	441.879	1.754	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1cnn(-c2ccccc2)c1C	785329958	AUSKRLSICJZHQB-UHFFFAOYSA-N	443.485	1.675	50	20	IDGD	
Cc1ccc(NC(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)cc1C(N)=O	785848808	LXALJTVSOCLZCH-UHFFFAOYSA-N	434.497	1.735	50	20	IDGD	
Cc1ccc(N2CCNC2=O)cc1NC(=O)C(=O)NNC(=O)c1ccc(Cl)cc1O	787542611	OVKRCASYTUUVKD-UHFFFAOYSA-N	431.836	1.283	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCC(=O)c2cccn21)c1cccc(S(=O)(=O)N2CCCCC2)c1	788727091	WGGJDPMSABOAFG-GOSISDBHSA-N	444.513	1.642	50	20	IDGD	
COc1cc(CC(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)cc(OC)c1OC	790069388	AVEABTQKDWSKJZ-UHFFFAOYSA-N	436.848	1.913	50	20	IDGD	
O=C(NNc1nc2ccccn2n1)c1cc(S(=O)(=O)N2CCOCC2)ccc1Cl	791239154	DVAVQKRPTDCKHZ-UHFFFAOYSA-N	436.881	1.161	50	20	IDGD	
Cc1nn(-c2ccc(Cl)cc2)c(NC(=O)C(=O)NNC(=O)Cc2ccccn2)c1C	792266551	AFSKWTJDQSEELY-UHFFFAOYSA-N	426.864	1.866	50	20	IDGD	
O=C(CCCc1ccccc1)NNC(=O)C(=O)Nc1cccc(N2C(=O)CCCC2=O)c1	792356414	PBHHMQGRRNOAQB-UHFFFAOYSA-N	436.468	1.839	50	20	IDGD	
COc1c(NC(=O)C(=O)NNC(=O)c2c[nH]c3ccccc23)cc(Cl)cc1C(N)=O	793023521	POPDOCCCDSDNSZ-UHFFFAOYSA-N	429.820	1.329	50	20	IDGD	
CN(C)C(=O)c1ccc(Cl)cc1NC(=O)C(=O)NNc1ccc2c(=O)[nH]ccc2c1	793069423	CWZYCOLLNSZYDM-UHFFFAOYSA-N	427.848	1.965	50	20	IDGD	
CCOC(=O)c1cc(Cl)cc(S(=O)(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)c1	793401231	PMLFHNPSUXIEIJ-UHFFFAOYSA-N	443.821	1.754	50	20	IDGD	
COC(=O)[C@@H](CS(=O)(=O)NNC(=O)c1cnn(-c2ccccc2)c1)c1ccccc1	795323623	CIYWEUBUANBWIW-SFHVURJKSA-N	428.470	1.393	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)CN2CCC[C@H](NC(=O)CCCc3ccccc3)C2)cc1	796077476	HVNSYWYSKDVUNT-QFIPXVFZSA-N	447.539	1.923	50	20	IDGD	
O=C(CN[C@@H](CO)c1ccccc1OC(F)(F)F)NNC(=O)c1cccc([N+](=O)[O-])c1	796526244	SEQWCHNQRGWNFE-AWEZNQCLSA-N	442.350	1.578	50	20	IDGD	
CCNC(=O)N(C)c1cccc(NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)c1	797005223	AZFASCRFLRBEQX-UHFFFAOYSA-N	433.852	1.611	50	20	IDGD	
CSC[C@H](C)C(=O)N1CCC(C(=O)NNC(=O)c2cc(Br)c[nH]2)CC1	799409032	JODOXXUOWDANTI-JTQLQIEISA-N	431.356	1.776	50	20	IDGD	
CN(C)S(=O)(=O)CCC(=O)NNC(=O)Nc1ccc(Br)cc1Cl	802041772	DXZAOCILYGYQBB-UHFFFAOYSA-N	427.708	1.537	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)CC(=O)NNC(=O)Nc2ccc3c(c2)OCO3)cc1F	802099056	BDMCSUURSXWTRQ-UHFFFAOYSA-N	437.405	1.384	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)Nc1ccc(OC(F)F)cc1F	802566267	GWASZJPPEPPZMQ-UHFFFAOYSA-N	449.183	1.928	50	20	IDGD	
COCCN(CCOC)S(=O)(=O)c1ccc(C(=O)NNc2ncccc2F)cc1	804214478	JLJSMLZFPBPKJA-UHFFFAOYSA-N	426.470	1.261	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)C(=O)Nc1cc(F)c(N2CCOCC2)cc1F	806975717	MBDJDLYJCOBVFN-UHFFFAOYSA-N	436.390	1.269	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cc(C(F)(F)F)cc(Br)n2)n[nH]1	806976198	IHHYPDJPCYXXMO-UHFFFAOYSA-N	435.160	1.294	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NCc2cnc3n2CCCC3)c2ccccc2c1=O	807264727	PUALDLVQDFSCKJ-UHFFFAOYSA-N	437.504	1.874	50	20	IDGD	
O=C(CC(F)(F)F)NNC(=O)NCCNS(=O)(=O)c1cccc(Cl)c1Cl	807453464	AXZKKMIZKFKUSZ-UHFFFAOYSA-N	437.227	1.555	50	20	IDGD	
Cc1cc([N+](=O)[O-])ccc1NNC(=O)C(=O)Nc1ccc(C)c(S(=O)(=O)NC2CC2)c1	807455978	QTWGALXHIQLZHM-UHFFFAOYSA-N	447.473	1.734	50	20	IDGD	
O=C(COc1cccc(C(F)(F)F)c1)NNC(=O)C(=O)Nc1ccc2c(c1)C(=O)OC2	808934598	NAFUWFPZCWANBD-UHFFFAOYSA-N	437.330	1.541	50	20	IDGD	
CSc1ccc(-c2nsc(NC(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)n2)cc1	809932437	YCNKKOAVBPZHQT-MRVPVSSYSA-N	430.537	1.017	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)CNS(=O)(=O)c1ccccc1C(F)(F)F	810375164	TVXCSSWNPYPHHE-UHFFFAOYSA-N	431.392	1.454	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)C(=O)Nc2cc(C(N)=O)ccc2OCC(F)F)c1	810382793	NEVQWLTVMBPJPE-UHFFFAOYSA-N	436.371	1.298	50	20	IDGD	
CC1(C)CCCc2sc(NC(=O)C(=O)NNC(=O)c3cc([N+](=O)[O-])ccc3O)nc21	810399381	UQGWEQOHDVETMS-UHFFFAOYSA-N	433.446	1.771	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](NC(=O)NN[C@]2(C)CCS(=O)(=O)C2)CC12CCC2	813800592	VEFYXZPVHJEFPU-KBXCAEBGSA-N	430.571	1.690	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1csc(N2CCOCC2)n1)[C@H]1OCCc2sccc21	813867747	UHLMVTXIYIRRDA-XHDPSFHLSA-N	437.547	1.688	50	20	IDGD	
CNS(=O)(=O)c1ccc(C(=O)NNc2cc(C(=O)OC)ccc2Br)cc1	816718010	ZRFHDJKEAMHYKE-UHFFFAOYSA-N	442.291	1.901	50	20	IDGD	
CCOC(=O)N1CCC[C@@H](C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)C1	912988231	LLQAQAQGZQLNQT-CQSZACIVSA-N	429.477	1.607	50	20	IDGD	
O=C(CN1C(=O)[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)NNC(=O)c1ccc(COc2ccccc2)o1	913234460	OXGYHMUAJTVPKD-AFHBHXEDSA-N	435.436	1.427	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCC2(N(C)C)CCCC2)c1	915897535	FLEUGXIQZBOEOJ-UHFFFAOYSA-N	439.582	1.536	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)[C@@H]1CCCCN1S(=O)(=O)c1cccs1	916148232	NCUNEHFXXJDNRL-AWEZNQCLSA-N	447.542	1.709	50	20	IDGD	
Cc1nc2ccccc2n1CCNC(=O)NNc1ccc(S(=O)(=O)NC(C)C)cn1	916195948	TVUFMTXGCFGZNM-UHFFFAOYSA-N	431.522	1.753	50	20	IDGD	
CCOc1ccccc1N1C[C@@H](C(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)CC1=O	916562702	SYFNVPQFASHKEZ-INIZCTEOSA-N	438.484	1.841	50	20	IDGD	
COc1cc(CNC(=O)NNC(=O)Cc2cccc3ccccc23)ccc1OCC(N)=O	916641156	ZYVZRFOIUXZCDU-UHFFFAOYSA-N	436.468	1.786	50	20	IDGD	
O=C(NNS(=O)(=O)c1cccc(S(=O)(=O)NC2CC2)c1)c1ccc(Cl)cc1O	917757880	FLRCXUNTOOCRSU-UHFFFAOYSA-N	445.906	1.110	50	20	IDGD	
CN(CC(=O)NNC(=O)c1ccc(F)cc1Br)S(=O)(=O)c1ccccc1	918341821	DQBOQDWMMTZENF-UHFFFAOYSA-N	444.282	1.670	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)[C@@H]2CCCN(C(=O)CCOc3ccccc3)C2)n1	918550269	FWDZKAPWRMRYBH-GOSISDBHSA-N	427.505	1.355	50	20	IDGD	
NS(=O)(=O)c1ccc(CC(=O)NNC(=O)c2ccc(F)cc2Br)s1	918642258	WAMBFCVDUOBCHP-UHFFFAOYSA-N	436.284	1.301	50	20	IDGD	
CC(=NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)c1ccc(-n2cnnn2)cc1	918710467	QBTOVNUHCXHYRG-UHFFFAOYSA-N	439.501	1.601	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)NCC2(NS(C)(=O)=O)CCCCC2)cc1	919903529	QFAZPNWWBCMSTL-UHFFFAOYSA-N	426.539	1.210	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)NCCCN1CCN(C)C[C@@H]1c1ccccc1	919904193	AFWQZSQLRXSRFU-OAQYLSRUSA-N	439.560	1.947	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)NCCCN1CCN(Cc2ccccc2)CC1	919904849	VYLOZKJHTSOILG-UHFFFAOYSA-N	439.560	1.776	50	20	IDGD	
C[C@H]1C[C@@H](C)CN(C[C@@H](C)NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)C1	919924638	QQWUXHDUWCXCCK-QHAWAJNXSA-N	444.624	1.896	50	20	IDGD	
CCCCN1C(=O)CC[C@H](C(=O)NNC(=O)CN2CCCC2=O)[C@H]1c1ccccc1OC	920435573	JXHILNPIXQHTPD-HTAPYJJXSA-N	444.532	1.545	50	20	IDGD	
COc1ccc(C(=O)Nc2ccccc2C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)cc1	920746078	RUQNQGGUPCWSIF-CQSZACIVSA-N	446.485	1.079	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)Nc1cccc(CN2CCC[C@H]2C(N)=O)c1	920930070	GIZMTMOOUUHJAS-SFHVURJKSA-N	436.472	1.240	50	20	IDGD	
O=C(CCCOc1ccc(F)cc1F)NNC(=O)c1csc(N2CCOCC2)n1	921302258	RFOOYPPRYCHWBV-UHFFFAOYSA-N	426.445	1.878	50	20	IDGD	
O=C(c1ccn2ccnc2c1)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1778566678	BLGGWFGSWRZHAK-YOEHRIQHSA-N	425.258	1.468	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cccn4ccnc34)C2)C1	1778588456	UOICTKLTTCAQTB-HNAYVOBHSA-N	435.322	1.951	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@]2(C1)CN(C(=O)c1n[nH]c3ccc(F)cc13)CCO2	1779297095	QQLLZABEPBVIAD-FQEVSTJZSA-N	434.544	1.997	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccc3cccnc3n1)CCO2	1779297135	SNFCPCVMVVTBPI-OAQYLSRUSA-N	428.565	1.925	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cccn(C(F)F)c3=O)C2)C1	1779354338	DVOISZYXIARGLF-LJQANCHMSA-N	431.867	1.952	50	20	IDGD	
O=C(C1=C2c3ccccc3C(=O)N2CC1)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Cl)CCO2	1780004330	BUZMWDYZLZQGSK-UWJYYQICSA-N	433.867	1.622	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CN1CCOC1=O)C2	1780708001	ZQYNTFMIVXQVPV-JEBQAFNWSA-N	436.336	1.189	50	20	IDGD	
O=C(c1ccc(O)c([N+](=O)[O-])c1)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1781539966	DLAAXAVPAHMVEY-XJKSGUPXSA-N	446.229	1.434	50	20	IDGD	
O=C(c1ccc(Br)c(O)c1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1781694958	IKHOHIMKRNMNLS-WMLDXEAASA-N	447.713	1.198	50	20	IDGD	
COCCOCCOCCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Cl)C2	1782064785	AMCSZCJVZNIVME-SZVBFZGTSA-N	438.924	1.104	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C2(C)CCCCC2)C1	1782138793	KNUQZQQQDWACLC-WZONZLPQSA-N	436.597	1.844	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccn3ccnc3c1)C2	1782175412	LPLLDOXOKNXWEK-CBGDNZLLSA-N	434.924	1.716	50	20	IDGD	
COC(=O)[C@H]1CC[C@H](C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)C(Cl)Cl)C2)C1	1782214164	MMGALLAURVNWGA-WZFJYNIESA-N	435.348	1.893	50	20	IDGD	
O=C(CCc1ncc[nH]1)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Br)C2	1782412004	ORFJZIIATDJHHB-SRCQZFHVSA-N	431.306	1.547	50	20	IDGD	
Cc1ccc([C@H](C)C(=O)N2CC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)cc1	1783315806	HXMXTLXVMZLOBY-MBSDFSHPSA-N	430.549	1.301	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](N)c1ccccn1)CCO2	1783343335	TVJQQURPGIUHHP-JOQOYGCGSA-N	425.327	1.085	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cccc(F)c3[N+](=O)[O-])CCO2)C1	1783538087	SZDUODLXWZLDHE-APPDUMDISA-N	444.257	1.961	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cnc4ccc(F)cn34)CCO2)C1	1783538125	WICAOVNFNRYZBY-KZULUSFZSA-N	439.285	1.700	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)/C=C/c3ccc(OC)cc3F)C2)C1	1783660233	IIAQDOPJVAHGGV-JEYNVIPUSA-N	440.899	1.931	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cn(C)cc3C(F)(F)F)CCO2)C1	1783874990	NHACKHQVWUVNOJ-RHSMWYFYSA-N	437.846	1.741	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ncccn3)C[C@@H]21	1783969790	PVDIERPEFJEYOV-QPSCCSFWSA-N	425.327	1.030	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(-c4ccccc4)[nH]n3)C[C@@H]21)[C@H](O)CCl	1784091400	SJYKFYIVVFRLBX-SAKMYQHLSA-N	432.908	1.270	50	20	IDGD	
C[C@@H](Cc1ccccc1)C(=O)N1CC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1	1784209725	LCOJLRNFZFQNTR-MBSDFSHPSA-N	430.549	1.068	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC1(c2ccc(NC(=O)Cn3cccn3)cc2)CCC1	1788273715	DJZVQMYBZOBHGM-UHFFFAOYSA-N	433.472	1.330	50	20	IDGD	
CC(C)n1nccc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21	1788929718	LTEVXDOTUSEKRQ-DZKIICNBSA-N	427.343	1.842	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(Cl)ncn3)[C@H]2C1	1789059919	ZFPMCHALIFCNCW-FMSGJZPZSA-N	445.745	1.897	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc4snnc4c3)[C@H]2C1	1789204710	SYEIDJMCVHINDE-NOLJZWGESA-N	449.609	1.531	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)c1ccc(C(F)(F)F)cc1	1789604018	TWJRXLQDKHNYJL-HNKHHVNMSA-N	434.842	1.898	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CC3CCN(C)CC3)C[C@@H]21	1791054471	JFCSURHDTJFJAY-HJWJTTGWSA-N	430.387	1.481	50	20	IDGD	
CC(=O)O[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)Br)[C@H]2C1)C(C)C	1791055931	KSPRNEVPAZQCAB-YDMUCJKGSA-N	433.343	1.337	50	20	IDGD	
Cc1nc(N)sc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)CBr	1792867647	IOKGMMNZVQFTLH-IXLVHKGHSA-N	431.356	1.268	50	20	IDGD	
Cc1cc(C)n(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)CBr)n1	1792869946	FCQYHPWNZSFZPH-FIUQPQMISA-N	427.343	1.121	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCl)[C@H]1Cc2[nH]nc(C(F)(F)F)c2C1	1793113020	YOFZLTMRKJKYRE-QEGBUVANSA-N	434.846	1.381	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1ccccc1F	1795622059	OUYXESCEYQJWJR-MUJYYYPQSA-N	425.464	1.319	50	20	IDGD	
Cn1ccc2cccc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3cccc(B(O)O)c3)c21	1796191517	SMUVFVSYHBMNJJ-ACDBMABISA-N	431.301	1.424	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)c1ccc2c(c1)CCCO2	1796192916	YHOAEHKDCGSCPX-WKCHPHFGSA-N	434.301	1.257	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1n[nH]c3c1CCc1ncccc1-3)C2)[C@@H](F)Cl	1796366539	ZWQVWRGQGJXZHA-DEHFKTMOSA-N	433.871	1.308	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Cl)CC1	1796370818	MLQWIOOQGZVFDA-FZKCQIBNSA-N	447.935	1.758	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2)c1cn2c(Cl)cccc2n1	1796854349	BWFBOXVKTOBLHL-WDAIWFPHSA-N	431.707	1.995	50	20	IDGD	
CN1Cc2ccccc2C[C@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CO[Si](C)(C)C	1797953062	ZXWRIRHANFIKHY-IIZPIQPGSA-N	445.636	1.484	50	20	IDGD	
C[C@@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CO[Si](C)(C)C)[C@@H]1SC(=N)NC1=O	1798625928	RSRRKROTGXHWGN-VVSAWPALSA-N	426.615	1.279	50	20	IDGD	
COc1ccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CO[Si](C)(C)C)C3)c(C#N)c1	1799239961	RMPIRZCKHDLTFE-OPMZPASUSA-N	445.592	1.550	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)cc([N+](=O)[O-])c1)C2	1800759906	PDWIENCUQVWOPJ-BTABJRDXSA-N	442.266	1.287	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c(c1)CCCC3=O)C2	1800978495	SKOJUSKAQHQBGJ-YNVMFWSZSA-N	434.920	1.663	50	20	IDGD	
COC[C@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(C(=O)O)n(C(C)C)n1)C2	1802273455	LYIBKKRJDBQZRX-CRWXNKLISA-N	426.901	1.668	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2cccnc2C(N)=O)[C@H]1c1cccnc1	1808251318	QVNWZNGTISFQMU-ZVZYQTTQSA-N	429.908	1.913	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC2(CCCN(C(=O)c3nccs3)C2)CC1	1808671270	AQKRMNXWKRSDFM-UHFFFAOYSA-N	428.518	1.300	50	20	IDGD	
CN1C(=O)CC[C@H]1C(=O)NC[C@@H]1CCN(C(=O)[C@](C)(Cl)CCl)[C@@H]1c1cccnc1	1808772958	HXAWCOMWXIDWRO-JTWUUNPKSA-N	441.359	1.945	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2cnc3[nH]ncc3c2)[C@H]1c1cccnc1	1809712205	CDCHWOUMYCSVAM-FHLIZLRMSA-N	442.907	1.926	50	20	IDGD	
O=C(Cc1ccsc1)N1CCCC2(CCN(C(=O)c3cccc(B(O)O)c3)CC2)C1	1810110663	GZTSKDYMEODAOR-UHFFFAOYSA-N	426.347	1.515	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2c3c(nn2C)CCC3)[C@H]1c1cccnc1	1813034788	XTQOKWWBENUJTP-AYBZRNKSSA-N	445.951	1.877	50	20	IDGD	
C[C@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)CN3CCCC3=O)sc2C1	1814601218	GJCSABQCFGTNOO-UWVGGRQHSA-N	429.340	1.461	50	20	IDGD	
O=C(N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1)C1=CCCS1	1815350145	GJPJBOFNIZMOMC-CYBMUJFWSA-N	429.332	1.070	50	20	IDGD	
COc1nccc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@@H](O)CCl)CC3)c1F	1815813296	SWWALTMNEXNNPF-KCJUWKMLSA-N	428.873	1.511	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ncccn2)[nH]n1	1818111389	INTASEUKGOJOAZ-NLOAGFHQSA-N	449.475	1.640	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnn4cc(C)cnc34)sc2C1	1819091734	NQYVBYBRUNVYDU-YPMHNXCESA-N	448.936	1.974	50	20	IDGD	
CC(C)=NO[C@H](C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1820970351	ZPANVQKNMDMQMG-KDOFPFPSSA-N	441.297	1.196	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2CCC(=O)N2)[nH]n1	1822088616	WVQILIYRYDNZCB-GVXVVHGQSA-N	426.315	1.854	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](C)Br)n[nH]1	1822189612	WOHWDTOLQOMSFJ-LOWVWBTDSA-N	426.315	1.876	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@H](O)CCl)CC2)c1ccccc1-n1nccn1	1823546201	FLTWBBIYAAMHRR-IAQYHMDHSA-N	446.920	1.549	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2CNC(=O)O2)CC1	1824574751	FPDKFAONOUBAOU-KKUMJFAQSA-N	430.343	1.888	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CN(C)C(=O)C(=O)O)CC1	1824615308	NRJLZTHVNDDJCL-JKSUJKDBSA-N	429.945	1.557	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)/C=C\C(=O)NC1CC1)CC2	1825642503	QOYOWIUBLOHVFO-FCMDYUIFSA-N	441.351	1.673	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1[nH]nc3ncccc13)CC2	1825997940	DROYTGYGMIIPPY-GXSJLCMTSA-N	434.909	1.894	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@H](C)CN)CC1	1826792416	MUOJCUGUNIGLLG-DSOYRZJRSA-N	430.553	1.335	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)CC[C@@H]3CCOC3)sc2C1	1827329412	ORYPPIAOSXYITB-ZIAGYGMSSA-N	437.566	1.245	50	20	IDGD	
Cc1cc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)on1	1830535647	RPQITNWKGJDDDY-FZKQIMNGSA-N	444.326	1.013	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cncc(F)c3)C2)C1	1830537312	DDXZJGNADORGAS-ACJLOTCBSA-N	444.301	1.322	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)C3CCC(F)(F)CC3)CCO2)C1	1831010028	ZRJAXHVHACLDFM-YJBOKZPZSA-N	438.899	1.522	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3cccs3)CCO2)C1	1833160680	WEHDBOLBZYISHI-VQIMIIECSA-N	430.954	1.391	50	20	IDGD	
O=C(c1c(F)ccnc1Cl)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1833257565	SVXSUFYERVPEOM-MRXNPFEDSA-N	440.686	1.748	50	20	IDGD	
CC[C@@H](C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)CCl)CC2)CC1)N(CC)CC	1833306713	ZJUSSVHBCZQISA-RBUKOAKNSA-N	431.021	1.278	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)[C@H](C)CC(N)=O)CC2)CC1	1833518004	VRABNFDCJCYWPS-ZIAGYGMSSA-N	445.402	1.101	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)C[C@H]3CCCCO3)CC2)CC1	1833684115	PSFJPDXBGFBPHM-MOPGFXCFSA-N	429.989	1.771	50	20	IDGD	
Cc1cnc(C(=O)N2CCO[C@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)s1	1833802532	MOYYODDODBTIQB-SFHVURJKSA-N	427.599	1.373	50	20	IDGD	
Cc1cccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)n1	1834052113	SVQJKLMGYNUJPG-KSSFIOAISA-N	426.311	1.243	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3cncn3C)CC2)CC1	1834246327	RDHPPBCBHAMUDA-CYBMUJFWSA-N	426.359	1.389	50	20	IDGD	
Cn1ccnc1C(=O)NC1CCN(C2CCN(C(=O)[C@](C)(Cl)CCl)CC2)CC1	1834270427	ISKUQCHGOQXQFF-LJQANCHMSA-N	430.380	1.842	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnoc3C3CC3)CCO2)C1	1834616853	YDWZJZGSSVMFML-SGTLLEGYSA-N	442.310	1.405	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(F)F)CCO2	1834917623	ISTDDCUOLZIHIU-CDXDBMBRSA-N	441.381	1.593	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)NC1CCN(C2CCN(C(=O)[C@](C)(Cl)CCl)CC2)CC1	1835124060	LNFDCXDWCQOCQA-JLTOFOAXSA-N	449.423	1.661	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836718742	CDBZIFSEKDXZTG-LSDHHAIUSA-N	439.778	1.758	50	20	IDGD	
O=C(c1cncnc1)N1CCC(OC2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1837507272	KTUIOQKCLVHHGX-OAHLLOKOSA-N	429.290	1.779	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCCCn3cccc3)CCO2)C1	1837623080	CYDZWZHMRFAIGW-RXVVDRJESA-N	441.956	1.369	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(Cl)nn3)C2)C1	1837715325	KHRSJDHAZZTQDK-GOSISDBHSA-N	442.976	1.052	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1	1838031682	CLMZKZPSRRMPJZ-INIZCTEOSA-N	441.912	1.359	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](N)Cc3cccnc3)CC2)CC1	1838092711	XLIQWVDRWJVACB-PMACEKPBSA-N	436.984	1.967	50	20	IDGD	
O=C(CCn1cncn1)N1CCC(OC2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1838648500	WRSKSEQCJYZBCJ-MRXNPFEDSA-N	446.321	1.357	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1838648565	ZDGBSBCUOJPABL-UONOGXRCSA-N	443.741	1.929	50	20	IDGD	
Cc1cccnc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839198604	KGDSTTGPMQAOEJ-PBHICJAKSA-N	430.274	1.151	50	20	IDGD	
O=C(c1sccc1F)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839198881	OMQHVRYBADZPAZ-DOMZBBRYSA-N	439.278	1.648	50	20	IDGD	
O=C(Cc1ccccc1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839199901	ZARVQMXXJNSNIE-WMZOPIPTSA-N	429.286	1.376	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccccc3-n3nccn3)CCO2)C1	1839381406	RMDBNHLKEHZAQP-UWJYYQICSA-N	447.923	1.355	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@]3(C)CC3(F)F)C2)C1	1839967186	CUAKVVHOKVREFN-VBNZEHGJSA-N	439.297	1.662	50	20	IDGD	
CCn1nc(C)cc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2	1840032514	ASYYSUBHCPRYHT-RDTXWAMCSA-N	443.342	1.065	50	20	IDGD	
O=C(Cc1cnc2ccccn12)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840187261	QAFWLUVHRRJOAW-IBGZPJMESA-N	441.315	1.137	50	20	IDGD	
O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)C1CC3(CCC3)C1)CCO2	1840602810	QVKOLIOIBWKEJJ-IBGZPJMESA-N	429.355	1.808	50	20	IDGD	
O=C1NC[C@@H](C(=O)N2CCCC23CN(C(=O)[C@@H](Br)Cc2ccccc2)C3)O1	1841649985	CVKGQHLDOAOTCM-GJZGRUSLSA-N	436.306	1.304	50	20	IDGD	
Cc1ccc2oc(C(=O)N3CCCC34CN(C(=O)c3cnccc3C(=O)NN)C4)cc2n1	1843138618	MMSPBYNAOBXGKL-UHFFFAOYSA-N	434.456	1.266	50	20	IDGD	
O=C([C@H](O)CCl)N1CC2(CCCN2C(=O)c2cc(Br)cc3[nH]ncc23)C1	1844099585	RYYXIHNPNUFJLU-CQSZACIVSA-N	441.713	1.742	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)(C)O)C2	1846365557	CASSOAICKYAXLL-UONOGXRCSA-N	447.960	1.108	50	20	IDGD	
Cc1cc(O)c(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](O)CCl)cc1Br	1847561946	NOMDIMBMYURVNC-KCQAQPDRSA-N	431.714	1.878	50	20	IDGD	
COc1ccc(C(=O)NCC(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)cc1OC	10594933	LRSGREHAUINIRP-UHFFFAOYSA-N	449.847	1.091	50	20	IDGD	
O=C(COC(=O)[C@H]1CC(=O)Nc2cc(F)ccc21)NNC(=O)c1ccc([N+](=O)[O-])cc1	12935412	XWBADGUNBBAFCI-AWEZNQCLSA-N	430.348	1.164	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)CCN2C(=O)[C@H](C)Oc3ccccc32)c2ccccc2c1=O	17190778	QSNONENFTVDXFC-AWEZNQCLSA-N	449.467	1.382	50	20	IDGD	
COc1ccc(N2C[C@H](C(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)CC2=O)c(OC)c1	17329724	IOIQOWYBCUIEGB-CYBMUJFWSA-N	428.401	1.426	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CSc2nncn2-c2ccccc2OC)cc1OC	28872246	FDKXYMNLSUUGHB-UHFFFAOYSA-N	443.485	1.846	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)N[C@@H]2CCCN(C(=O)OC)C2)c2ccccc2c1=O	726717529	YZWMISRJJABZAX-CQSZACIVSA-N	444.492	1.371	50	20	IDGD	
O=C(NNc1nc(-c2ccccc2)no1)c1ccc(S(=O)(=O)NC[C@@H]2CCCO2)cc1	728081257	MBZWHOAQRDJFSF-INIZCTEOSA-N	443.485	1.951	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)[C@H]2COc3ccccc3O2)ccc1OCC(=O)OC	728454952	BXFDEMQSIVCIHG-GOSISDBHSA-N	430.413	1.238	50	20	IDGD	
O=C(CSc1nnnn1C1CC1)NNC(=O)c1ccc(Br)cc1Cl	728829102	XCVKIUDMNHHFKP-UHFFFAOYSA-N	431.703	1.977	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c(OC)c1OC	728846836	SYRMWVJWLAISME-UHFFFAOYSA-N	443.504	1.499	50	20	IDGD	
O=C(COC(=O)c1ccc(N2CCOCC2)c(F)c1)NNC(=O)c1ccc(Cl)cc1	730375610	YKFPJDMXBNOGOF-UHFFFAOYSA-N	435.839	1.934	50	20	IDGD	
COc1ccc(-c2nnc(SCC(=O)NNC(=O)COc3ccccc3O)o2)cc1	730779735	DDXUOVRHOYRORA-UHFFFAOYSA-N	430.442	1.769	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)c1ccc2c(c1)C(=O)N(C[C@H]1CCCO1)C2=O	730780643	QHCBIHLEFCMULT-CQSZACIVSA-N	439.424	1.007	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)[C@H]2CCCN(C(=O)c3ccccc3)C2)c2ccccc2c1=O	731186796	VNJVMZLNJBPUOD-INIZCTEOSA-N	433.468	1.247	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)c1nnn(-c2ccc3c(c2)OCCO3)c1C	731454881	SWNUXRAZUUIGMU-UHFFFAOYSA-N	438.444	1.229	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)c2nnn(-c3ccc4c(c3)OCCO4)c2C)cc1	731455832	RZYIKQXOPGRZHN-UHFFFAOYSA-N	437.456	1.749	50	20	IDGD	
CCCCn1c(C)cc(/C=C(/C#N)C(=O)N[C@H](C)C(=O)N2CCS(=O)(=O)CC2)c1C	731476644	GXMVOZRUBBAGKM-YZYPPFLQSA-N	434.562	1.574	50	20	IDGD	
C[C@H]1CN(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)C[C@H](C)N1C(=O)OC(C)(C)C	733335859	FNOYKFKXOCSBPK-KBPBESRZSA-N	444.496	1.346	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCN(c3cccc(F)c3F)CC2)cc1OC	734487789	YNZQSFNQJIMIGK-UHFFFAOYSA-N	434.443	1.565	50	20	IDGD	
CC(C)[C@@H](CNC(=O)NNC(=O)Cc1nc2ccccc2n1C)NC(=O)OC(C)(C)C	734689663	NMJUBAXZQGVEAD-OAHLLOKOSA-N	432.525	1.996	50	20	IDGD	
Cc1cc(C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)c2ccccc2n1	735118559	WPXBYDZGTNELQZ-UHFFFAOYSA-N	440.529	1.631	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cc(C(=O)NNC(=O)c2cnn(C)c2)ccc1C	735473027	JYNXBRVWYITWST-UHFFFAOYSA-N	443.485	1.613	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)N[C@H](C)CN2CCN(c3ccccn3)CC2)c1	735518432	JPHZEGGNAOBHTO-MRXNPFEDSA-N	442.520	1.254	50	20	IDGD	
Cc1nonc1C(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2Cl)c1	736665684	BSDURTRUXHXYPG-UHFFFAOYSA-N	435.849	1.907	50	20	IDGD	
O=C(NNc1cccnn1)[C@@H]1CCCCN1S(=O)(=O)c1ccc(Br)s1	736698902	YZVQFQPNKMEIPL-JTQLQIEISA-N	446.352	1.987	50	20	IDGD	
COc1cccc(CC(=O)N2CCN(C(=O)NNC(=O)COCc3ccccc3)CC2)c1	738497199	NWJCZELHFHIVTH-UHFFFAOYSA-N	440.500	1.340	50	20	IDGD	
C#CCSCCNC(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	740487613	BYQSWGYFJQZZAQ-UHFFFAOYSA-N	435.513	1.699	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(N3CCNC3=O)ccc2Cl)c1	742045743	GKARTRCBEWKJFF-UHFFFAOYSA-N	436.877	1.348	50	20	IDGD	
Cc1cc(Cl)ccc1OCCCC(=O)NNC(=O)CN1C(=O)[C@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O	742465109	DCJVMWZBKKAPHW-LTDCPUDJSA-N	449.891	1.117	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3ccc([S@@](C)=O)cc3)cc2)CC1	743335560	ZQIKXIUTXHHWJW-MUUNZHRXSA-N	436.559	1.117	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)NCc2ccc(-n3cncn3)nc2)cc1Cl	743548790	UQKOJQYMMRGUFD-UHFFFAOYSA-N	446.855	1.869	50	20	IDGD	
CCC1(CC)NC(=O)N(CC(=O)NNC(=O)c2cc(Br)ccc2O)C1=O	743730478	ZTPRNKWZSPLHGA-UHFFFAOYSA-N	427.255	1.026	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)NCC1(N(C)C)Cc2ccccc2C1	745843045	YBNBKYKKGFYWOG-UHFFFAOYSA-N	426.517	1.894	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)c1sccc1S(=O)(=O)N1CCCC1	746548424	HYPAJDITAWSYMP-UHFFFAOYSA-N	433.515	1.184	50	20	IDGD	
Cc1nc(C(C)C)nc(O)c1C(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	747394002	XHJNOABRMLBOQV-UHFFFAOYSA-N	436.513	1.958	50	20	IDGD	
CC(C)OCCS(=O)(=O)NCC(=O)NNC(=O)[C@@H](C)Oc1ccc2ccccc2c1	747905722	JWLJNPRUXQCXGJ-OAHLLOKOSA-N	437.518	1.099	50	20	IDGD	
Cn1ccnc(NNC(=O)c2csc(S(=O)(=O)N3CCc4ccccc4C3)c2)c1=O	747938089	PIARWPQWCKQCQV-UHFFFAOYSA-N	445.526	1.346	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)[C@H]2CCCN2C(=O)c2ccc3c(c2)OCO3)c1	749560666	DFUFGOVNCUVEQR-QGZVFWFLSA-N	425.441	1.555	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCc2ccccc2CN2CCC(O)CC2)cc1OC	749590231	MCHFTQIAVYEMIM-UHFFFAOYSA-N	442.516	1.805	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)[C@H]1CC(=O)N(c2cc(OC)cc(OC)c2)C1	752518330	DVHPQBZSJOANTG-INIZCTEOSA-N	441.484	1.846	50	20	IDGD	
CCOc1ccc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)N[C@H]3CCOC3)cc2)cc1	752699600	WKXCSFGGYQDHHQ-INIZCTEOSA-N	448.501	1.619	50	20	IDGD	
CC[C@H](NC(=O)NNC(=O)c1ccc(OC)c(Br)c1)C(=O)N1CCOCC1	753060839	XARBZTUNFHNKSI-ZDUSSCGKSA-N	443.298	1.039	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCC[C@H]2CCO[C@@H](C)C2)c1	753347620	SNDPZJQWZRYHIX-HOTGVXAUSA-N	440.566	1.866	50	20	IDGD	
CCCC[C@@H](NC(=O)[C@@H](C)NC(=O)C(C)(C)C)C(=O)NNC(=O)c1cccc(C#N)c1	755327152	PIVMRUTWWXCNNT-RHSMWYFYSA-N	429.521	1.545	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c(C)c1	755330844	YUKGKHZOLJJJHV-UHFFFAOYSA-N	432.502	1.791	50	20	IDGD	
CC(C)S(=O)(=O)c1ccccc1NC(=O)NNC(=O)c1nnc(O)c2ccccc12	756529645	VBIIFPNJQJDSIL-UHFFFAOYSA-N	429.458	1.984	50	20	IDGD	
CCOC(=O)[C@H](C)NC(=O)c1ccc(NC(=O)NNC(=O)COc2ccc(F)cc2)cc1	756789113	FAUQUAVPUIVDTP-ZDUSSCGKSA-N	446.435	1.739	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2c(C)nc3ccccn23)cc1-n1nnnc1C1CC1	757621147	NBRFXOGEWZCENY-UHFFFAOYSA-N	447.459	1.971	50	20	IDGD	
C[C@@H]1C[C@H](NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)CN1Cc1ccccc1	757737612	DZAGIHURDHVPIZ-XLIONFOSSA-N	437.548	1.686	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)[C@H](c1ccc(Br)cc1)N1CCCC1	758154973	MVCMDAULQBWTHG-ZFWWWQNUSA-N	444.351	1.168	50	20	IDGD	
O=C(NC[C@H](c1ccccc1Cl)N1CCOCC1)NNC(=O)C(=O)Nc1ccccn1	758683289	HEMKDPCUDKSIPE-MRXNPFEDSA-N	446.895	1.077	50	20	IDGD	
CC(C)[C@@H](C(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1)N1CCCC1=O	758787069	RRXSHMOPPSPNAX-INIZCTEOSA-N	425.530	1.269	50	20	IDGD	
CCNS(=O)(=O)c1ccc(CC(=O)NNC(=S)Nc2ccc(OC)c(F)c2)cc1	759380166	VSDWUNFOVPTBQK-UHFFFAOYSA-N	440.522	1.693	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)[C@H]2COc3ccc(Br)cc32)C[C@@H](C)O1	760120518	XVWTYHXAAWCQBU-ZOWXZIJZSA-N	426.311	1.572	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)NCCCS(=O)(=O)c1ccccc1	761671401	GWCIDRPMJVLLMD-UHFFFAOYSA-N	437.543	1.982	50	20	IDGD	
C[C@@H]1COCCN1c1ccc(NC(=O)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1	763471349	IWBHHDGNJUYPRJ-CYBMUJFWSA-N	427.417	1.220	50	20	IDGD	
COC(=O)[C@H]1CN(C(=O)C(=O)NNC(=O)c2cc3ccccc3cc2O)c2ccccc2O1	763523028	RUXFWQYWOGGERU-LJQANCHMSA-N	449.419	1.274	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(C(=O)NC3CC3)ccc2C)cc1OC	763550678	PRRZGBVLSXUWKW-UHFFFAOYSA-N	440.456	1.304	50	20	IDGD	
CCN1CCN(c2ccc(NC(=O)C(=O)NNC(=O)c3c(C)nc4ccccn34)cc2)CC1	763629095	OIBUIFDZGOXDSS-UHFFFAOYSA-N	449.515	1.184	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2ccc(-n3nc(C)cc3C)nc2)c1	763643875	ANOMMYORQVKDMH-UHFFFAOYSA-N	436.472	1.666	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)C(=O)Nc1ccc(-n2cnc3ccccc32)nc1	763678742	IOBUQSAMZVRZHA-UHFFFAOYSA-N	448.414	1.725	50	20	IDGD	
O=C(COc1ccc(OCc2ccccc2)cc1)NNC(=O)C(=O)Nc1ccc(F)nc1	763680453	PVUIITVZQYFPKI-UHFFFAOYSA-N	438.415	1.965	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)C(=O)Nc1cc(F)ccc1OC[C@H]1CCCO1	763681735	PZONIDBROFZIDZ-CQSZACIVSA-N	449.410	1.688	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc2oc(C(=O)OC)cc2c1	763712180	NANSWROONCMKON-UHFFFAOYSA-N	439.424	1.947	50	20	IDGD	
Cc1nccn1-c1ccc(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)cn1	763729352	WVHXLEHYHYANFZ-UHFFFAOYSA-N	433.472	1.114	50	20	IDGD	
NC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)CSc2ccc(Cl)cc2)cc1	763736830	VYLAQAVTFNVQRZ-UHFFFAOYSA-N	436.877	1.082	50	20	IDGD	
Cn1nc(C2CCCCC2)cc1NC(=O)C(=O)NNC(=O)COc1ccccc1[N+](=O)[O-]	763808287	IRZRVYJEDVUJSR-UHFFFAOYSA-N	444.448	1.541	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccccc1N1CCN(C)CC1	763867965	ZGPFYQMODBDOHM-HNNXBMFYSA-N	443.479	1.131	50	20	IDGD	
Cn1cc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CC[C@@H](C(C)(C)C)C3)ccc1=O	763939843	HLHCCLIKOQHOGH-CYBMUJFWSA-N	430.530	1.998	50	20	IDGD	
CCCCNS(=O)(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2ccccc2C)c1	763957578	FBCJVZXCGBDJCD-UHFFFAOYSA-N	432.502	1.473	50	20	IDGD	
COc1ccc(OC)c(NC(=O)C(=O)NNC(=O)c2cc(Br)cn2C)c1	764003083	XZGRAFOYXJIHKS-UHFFFAOYSA-N	425.239	1.205	50	20	IDGD	
O=C(NNC(=O)c1cccc(Br)c1)C(=O)Nc1cc(C(F)(F)F)cnc1O	764062956	HMIOLHCHSVJDBG-UHFFFAOYSA-N	447.167	1.968	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc(-n4ccnc4C)nc3)n[nH]2)cc1	764110969	NGQULAIATDCPAJ-UHFFFAOYSA-N	444.455	1.674	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2cc(C)nn2Cc2ccccc2)cc1	764127409	SUIHCUILNQBKAK-UHFFFAOYSA-N	435.484	1.967	50	20	IDGD	
O=C(CCc1ccco1)NNC(=O)C(=O)Nc1ccc(C(=O)N2CCOCC2)c(Cl)c1	764176968	IJDGCAFHRIADKG-UHFFFAOYSA-N	448.863	1.124	50	20	IDGD	
Cc1nn(-c2ccccc2)cc1NC(=O)C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C	764204452	OIPZKKYEFUZSHC-UHFFFAOYSA-N	444.492	1.572	50	20	IDGD	
Cc1nc(Br)ccc1NC(=O)C(=O)NNC(=O)Cn1ccc2ccccc21	764239506	NPPSLVGPYOILPG-UHFFFAOYSA-N	430.262	1.893	50	20	IDGD	
Cc1ncsc1C(=O)NNC(=O)C(=O)Nc1ccc(Cl)cc1C(=O)N1CCCC1	764245696	IZFFIWUWNUKNNG-UHFFFAOYSA-N	435.893	1.741	50	20	IDGD	
COCC(=O)NNC(=O)C(=O)Nc1ccc(NC(=O)c2ccco2)cc1C(F)(F)F	764300822	XPYDZAKXGNVGJF-UHFFFAOYSA-N	428.323	1.283	50	20	IDGD	
CS(=O)(=O)Cc1cc(F)ccc1NC(=O)C(=O)NNC(=O)c1cc2ccccc2o1	764331664	ZPOJRBXORVQTND-UHFFFAOYSA-N	433.417	1.516	50	20	IDGD	
O=C(NNC(=O)C(F)(F)Oc1ccccc1)C(=O)Nc1cccnc1N1CCCCC1	764379400	DIPKAMAADWQPSR-UHFFFAOYSA-N	433.415	1.830	50	20	IDGD	
CCN(CC)C(=O)COc1cccc(NC(=O)C(=O)NNC(=O)c2ncccc2C)c1	764385802	KFBPXGFBJAXQQH-UHFFFAOYSA-N	427.461	1.037	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)c2cncc(NC(C)=O)c2)sc(C)c1C	764432134	CNCXIKHNTGDMEL-UHFFFAOYSA-N	447.473	1.295	50	20	IDGD	
CC(=NNC(=O)CN1CCN(Cc2ccc(C)cc2)CC1)c1ccc(-n2cnnn2)cc1	764828919	COYAPUCBQAATOU-UHFFFAOYSA-N	432.532	1.629	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNS(=O)(=O)c3cc(C)cc(F)c3)CC2)cc1	765127927	SAOOWWUTQSMRIR-UHFFFAOYSA-N	434.537	1.570	50	20	IDGD	
CC(C)CNC(=O)N1CCC[C@H](C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)C1	765313292	KFOAJWRFYSPYJN-HNNXBMFYSA-N	427.546	1.516	50	20	IDGD	
CNS(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(-c3ccccc3OC)[nH]n2)c1	765599515	HZIKTDQPJAQHAG-UHFFFAOYSA-N	429.458	1.068	50	20	IDGD	
C[C@@H](NC(=O)OC(C)(C)C)[C@H]1COCCC1=NNC(=O)Cc1cc(O)nc(S)n1	766016532	AZGHJYCUXPWANI-ZYHUDNBSSA-N	425.511	1.435	50	20	IDGD	
COC(=O)c1nccc2c(S(=O)(=O)NNC(=O)c3ccc(OC)c(OC)c3)cccc12	766309494	ZULGMDVRNOGBCA-UHFFFAOYSA-N	445.453	1.662	50	20	IDGD	
O=C(NNc1ncnc2ccsc12)c1cc(S(=O)(=O)N2CCOCC2)ccc1F	766674923	DJHUICLIQDECTL-UHFFFAOYSA-N	437.478	1.608	50	20	IDGD	
O=S(=O)(/C=C\c1ccc(F)cc1)N1CCN(S(=O)(=O)CBr)CC1	767851600	RCZPNUXKPXOVPY-YHYXMXQVSA-N	427.317	1.426	50	20	IDGD	
CC(C)c1ccnc(N2CCN(CC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)CC2)n1	767902326	OBZCTARIDVESRF-UHFFFAOYSA-N	427.465	1.091	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cn(C)nc2-c2cccs2)c1	768267197	NKDKIQNNSAHOGB-UHFFFAOYSA-N	433.515	1.474	50	20	IDGD	
CCNC(=O)N(C)NC(=O)c1ccc(OC)c(S(=O)(=O)N2C[C@H](C)C[C@@H](C)C2)c1	770549179	MHKKCBVINSYTLT-ZIAGYGMSSA-N	426.539	1.668	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1ccc(S(=O)(=O)N2CCCC[C@@H]2C)cc1	771939414	OPYJJTYYDMNOEC-KBPBESRZSA-N	425.507	1.352	50	20	IDGD	
CCCS(=O)(=O)N1CCCC[C@H]1C(=O)NNC(=O)[C@@H](C)Oc1cccc(Cl)c1	772969649	OGWIMGXZADAPBZ-CJNGLKHVSA-N	431.942	1.849	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N(C)c2ccn(C)n2)cc1	774158964	XDIFVMSNDKOPAV-VBKFSLOCSA-N	433.472	1.738	50	20	IDGD	
COCc1nnc(-c2cccc(C(=O)OCC(=O)NNC(=O)Cc3ccccc3C)c2)o1	776455006	HHQYTURRNSLDSQ-UHFFFAOYSA-N	438.440	1.738	50	20	IDGD	
CC(C)CS(=O)(=O)N1CCC(NC(=O)NNC(=O)c2cccc(OC(F)F)c2)CC1	776907783	CLKPMZLEWNZQTQ-UHFFFAOYSA-N	448.492	1.682	50	20	IDGD	
CC(=O)c1cc(C(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)c(C)nc1C	777166534	KQJCYSATRPTCAI-UHFFFAOYSA-N	437.544	1.788	50	20	IDGD	
COCCO[C@H]1COCC[C@H]1NC(=O)NNC(=O)c1ccc(-n2c(C)ccc2C)cc1	777278979	LSDYIZLJOFRLOL-UXHICEINSA-N	430.505	1.859	50	20	IDGD	
CCc1ccc(C(=O)NNc2cc(Cl)nc(N)n2)cc1S(=O)(=O)N1CCOCC1	779373292	DUKVNTGMPQLPSJ-UHFFFAOYSA-N	440.913	1.052	50	20	IDGD	
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)CCNC(=O)OC(C)(C)C	780974299	USVRORZOQMVLAZ-KRWDZBQOSA-N	431.493	1.277	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@]2(C[C@@H]2C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)C1	781285905	NUCKSPINOXMMLX-OPAMFIHVSA-N	442.472	1.510	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccnn2-c2ccccc2)nc1	783262348	CRCBHSBXWWZRAJ-UHFFFAOYSA-N	443.489	1.036	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2ccc(N3CCc4sccc4C3)cc2)CCS(=O)(=O)C1	783425289	HRJJPXVFAFNGCU-FQEVSTJZSA-N	448.570	1.447	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)CNC(=O)c2cccs2)ccc1Br	784003997	SVPMWBCBFPDNFA-UHFFFAOYSA-N	439.291	1.335	50	20	IDGD	
Cc1ccc(-n2nc(C)cc2NC(=O)C(=O)NNc2ccc(Br)cn2)nn1	784342000	WMEMVHLBCJQCOG-UHFFFAOYSA-N	431.254	1.518	50	20	IDGD	
CCc1ccc(NC(=O)C(=O)NNc2ccccc2C(F)(F)F)cc1S(N)(=O)=O	784823433	KAKXFJDXIRVYAJ-UHFFFAOYSA-N	430.408	1.997	50	20	IDGD	
O=C(CCOc1cccc(I)c1)NNC(=O)NCC(F)(F)F	784875738	UUBHJSDJZRCSMF-UHFFFAOYSA-N	431.152	1.953	50	20	IDGD	
Cc1ccc(C(=O)N2CCOCC2)cc1NC(=O)C(=O)NNc1cc(F)c(F)cc1F	784892947	DZBKNTAZSWCCSB-UHFFFAOYSA-N	436.390	1.967	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CCCCCCC2)cn1)C(=O)Nc1cccnc1	784932856	IFCOENNIVXYHMV-UHFFFAOYSA-N	446.533	1.950	50	20	IDGD	
Cc1ccc(Cn2nccc2NC(=O)C(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)s1	785024366	XXMMRIXABPAMQH-UHFFFAOYSA-N	444.429	1.315	50	20	IDGD	
N#Cc1ccc(NNC(=O)C(=O)Nc2ccc(CN3C(=O)CCC3=O)cc2)cc1Cl	785092768	GGUUCGUMLLVNLL-UHFFFAOYSA-N	425.832	1.942	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2ccc(N3CCOC[C@H]3C)cc2)n1	785226483	HMILRXHERWTGEZ-OAHLLOKOSA-N	427.509	1.630	50	20	IDGD	
CN(C)Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2O)cc1Br	786413643	DWFHGEKLVQODDH-UHFFFAOYSA-N	435.278	1.616	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)N[C@@H]1CCN(c2cccc(Br)c2)C1	787369614	LHKNUFFNMGKXRM-TZMCWYRMSA-N	429.315	1.410	50	20	IDGD	
NC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)NNC(=O)NCc1ccc(Cl)cc1	787430522	BHERQFCLWLHAOB-INIZCTEOSA-N	447.879	1.341	50	20	IDGD	
COC[C@@H](C)Oc1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)Cn1nc(C)cc1C	787888542	BQQJGCILINSTEI-CYBMUJFWSA-N	437.884	1.353	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=S)NCCc2ccc(F)cc2)ccc1Cl	789174466	WUZQIAYWIGTAQE-UHFFFAOYSA-N	430.914	1.478	50	20	IDGD	
C[C@H]1Oc2ccc(NC(=O)C(=O)NNC(=O)[C@H]3OCC[C@H]3c3ccccc3)cc2NC1=O	789811428	ZZPDZBMRRASWGW-MRAWALMUSA-N	438.440	1.065	50	20	IDGD	
CCc1ccccc1OCC(=O)NNS(=O)(=O)c1ccc2c(c1)CCN(C(C)=O)CC2	790045744	RCYRRWWYHMCPAR-UHFFFAOYSA-N	445.541	1.585	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CN2CCOc3c(Br)cccc3C2)c1	791564096	YFCVBYDBSWWVQW-UHFFFAOYSA-N	429.274	1.976	50	20	IDGD	
O=C(COC(=O)CCn1cnc2ccccc2c1=O)NNC(=O)c1cccc(Cl)c1	792689811	DCJDSWMGTHXMQG-UHFFFAOYSA-N	428.832	1.444	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)C1CCC(NC(=O)C2CC2)CC1	792775803	BEJWAPIBCBJBAA-UHFFFAOYSA-N	441.576	1.431	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2cccc(S(C)(=O)=O)c2)nc1Br	793017639	GMWQJLCTBWXOND-UHFFFAOYSA-N	427.280	1.638	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)C(=O)Nc2cccc(Cl)n2)c2ccccc2c1=O	793021567	FEIUZDOYCRAMIR-UHFFFAOYSA-N	442.863	1.645	50	20	IDGD	
C[C@](O)(CN1C(=O)NC2(CCCC2)C1=O)C(=O)NNc1ccc(Cl)cc1[N+](=O)[O-]	793086729	XHFCWKPPSUZMLR-INIZCTEOSA-N	425.829	1.307	50	20	IDGD	
COCc1nnc(-c2cccc(C(=O)NNC(=O)CNC(=O)OCc3ccccc3)c2)o1	794074685	HLRCWLQHOKISJH-UHFFFAOYSA-N	439.428	1.570	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2cn3cc(Cl)cc(Cl)c3n2)n1	799592579	OICCHCQXWFDMOP-UHFFFAOYSA-N	442.284	1.953	50	20	IDGD	
O=C(CN1C(=O)[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)NNc1cc([N+](=O)[O-])ccc1Br	800621299	QGUQZNPBPWUHOM-PVFTVIPPSA-N	435.234	1.608	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@](C)(O)CN2C(=O)C(C)(C)c3ccccc32)cc1	801111075	KNYFTRQIVISWNN-QHCPKHFHSA-N	438.484	1.156	50	20	IDGD	
COc1ccc(C2=NO[C@@H](CNC(=O)NNC(=O)CNC(=O)c3cccs3)C2)cc1F	802346448	OZVAZHGRYQDCCR-GFCCVEGCSA-N	449.464	1.149	50	20	IDGD	
COc1ccc(S(C)(=O)=O)cc1S(=O)(=O)NNC(=O)c1cccc2ccccc12	802721804	GSNUAHBTZMWWEG-UHFFFAOYSA-N	434.495	1.875	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)N[C@@H](CO)C(N)=O)c(C)n1-c1ccc(Br)cc1	804356712	NCVQEHRLOITRPO-QHIITQONSA-N	431.290	1.726	50	20	IDGD	
O=C(NCCCN1C(=O)c2ccccc2C1=O)NNC(=O)c1nn(-c2ccccc2)cc1O	805819604	WBRRNIUIYBVEEU-UHFFFAOYSA-N	448.439	1.208	50	20	IDGD	
COC(=O)N1CCC(CNC(=O)NNC(=O)COc2ccc(Br)cc2)CC1	805833028	QRMCYGZKBAHBGY-UHFFFAOYSA-N	443.298	1.637	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c(Cl)cc1F	806974597	OETLOUHZIXDDMA-UHFFFAOYSA-N	431.811	1.434	50	20	IDGD	
CC(C)OC(=O)c1ccc(Cl)c(NC(=O)C(=O)NNc2ccc(-n3ccnc3)nn2)c1	807430007	XOOUEEBAXBTEQU-UHFFFAOYSA-N	443.851	1.963	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NNC(=O)[C@@H]2CC(=O)N(c3ccccc3F)C2)C1	808011057	OISCNRAIZKAGIO-HUUCEWRRSA-N	448.495	1.973	50	20	IDGD	
O=C(NNC(=O)c1c[nH]nc1-c1ccccn1)c1cccc(S(=O)(=O)N2CCCC2)c1	809956712	DAZFVXHPMBZMFM-UHFFFAOYSA-N	440.485	1.331	50	20	IDGD	
Cc1c(Cl)c(C(F)(F)F)nn1CC(=O)NNC(=O)CCN1C[C@H](C)O[C@H](C)C1	809981444	LEGKMHYKPPNRPX-AOOOYVTPSA-N	425.839	1.510	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCC(Oc3ccncc3C)CC2)cc1OC	809995939	ZDXFHOULFDFXJD-UHFFFAOYSA-N	428.489	1.712	50	20	IDGD	
CCn1cnc2c1c(=O)n(CC(=O)NN=C1CCS[C@@H]1C)c(=O)n2Cc1ccccc1	814745892	JVARLRQLHZKTNB-CQSZACIVSA-N	440.529	1.426	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)C(C)(F)F	814784362	KXOBSDXDXZJISO-ZDUSSCGKSA-N	433.477	1.079	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)[C@@H]1CCCN1C(=O)Cc1ccccc1	817053227	JIQIIJABGIGJNF-SFHVURJKSA-N	430.530	1.614	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)c2sccc2S(=O)(=O)N2CCCC2)cc1	823290317	FUJRRRGFMRCZGT-UHFFFAOYSA-N	438.531	1.414	50	20	IDGD	
O=C(CCNS(=O)(=O)/C=C\c1ccccc1)NNC(=O)Cn1cnc2ccccc21	913496649	RQXMQEJUPOQNDU-QBFSEMIESA-N	427.486	1.164	50	20	IDGD	
Cn1nc(C(=O)NN=C2C(=O)Nc3cc(OC(F)(F)F)ccc32)c2ccccc2c1=O	915047898	HLBIRJLDFAPYHV-UHFFFAOYSA-N	431.330	1.918	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)CCNS(=O)(=O)c1ccccc1	915775878	UKURIGHZFDSGHW-UHFFFAOYSA-N	429.502	1.115	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)NCc1ccnc(N2CCCCC2)c1	916255070	YWVRNTUABJHFKT-UHFFFAOYSA-N	428.449	1.890	50	20	IDGD	
CC(=NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1cccc([N+](=O)[O-])c1	916258936	PKYHAQKNHZGQBU-UHFFFAOYSA-N	432.458	1.770	50	20	IDGD	
CN(C)[C@@H](CNC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)c1ccsc1	916450034	YCZUZEKGJIAHAU-FQEVSTJZSA-N	444.605	1.894	50	20	IDGD	
CNS(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)c1	916562985	XJCQHPGRQRLONB-UHFFFAOYSA-N	438.893	1.265	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCCS(=O)(=O)c2ccccc2)cc(OC)c1OC	918229944	XQKJYLKHNQZULI-UHFFFAOYSA-N	437.474	1.130	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)Nc1nnc(C2CC2)s1	918540843	DIYITWHFWKKVBK-UHFFFAOYSA-N	436.519	1.667	50	20	IDGD	
C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)C1	919785951	NYPBHDBEUIFQCQ-DOTOQJQBSA-N	434.500	1.713	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCC(CC(=O)NC3CCCC3)CC2)cc1OC	920091390	VHXHNCHUGDDEBM-UHFFFAOYSA-N	446.548	1.626	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NN=Cc2cn(C)nc2-c2ccncc2)cc1	920365015	MFXFKYQYCJLGHE-UHFFFAOYSA-N	426.502	1.561	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCCC(=O)NNC(=O)NCCc2cccs2)cc1	920889414	WQUQZNBRUZZPNA-UHFFFAOYSA-N	440.547	1.388	50	20	IDGD	
CC(=O)NCCc1ccc(S(=O)(=O)NNC(=O)c2ccc(Br)cc2)s1	1115878725	ZNAXZSCXRYLUCL-UHFFFAOYSA-N	446.348	1.813	50	20	IDGD	
CCCCn1c(CCC(=O)NNc2cccnn2)nc2cc(S(=O)(=O)N(C)C)ccc21	1116545610	JTBKOCFRJQBHKM-UHFFFAOYSA-N	445.549	1.953	50	20	IDGD	
COc1ccc(OC)c(C2=NO[C@H](C(=O)NNC(=O)c3cncn3-c3ccccc3)C2)c1	1116857570	ZBPJEEDQXYQUFD-FQEVSTJZSA-N	435.440	1.844	50	20	IDGD	
CCOC(=O)COc1ccc(C=NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1	1318954189	LHENTGHJACUZBQ-UHFFFAOYSA-N	433.486	1.643	50	20	IDGD	
O=C(CCc1ccc2c(c1)CCO2)NNc1ccccc1S(=O)(=O)N1CCOCC1	1319115327	TXCROSKJOFNXPL-UHFFFAOYSA-N	431.514	1.718	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2sc(C(=O)O)cc2Br)cc1	1319719396	ZXFNKMNOSJGMTB-UHFFFAOYSA-N	435.277	1.841	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NCc2cccc(OCC(F)(F)F)n2)cc1	1320952964	QZMNNFHAHUZDKT-UHFFFAOYSA-N	428.367	1.941	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)/C=C/C3CCCCC3)CCO2)C1	1779037140	PSDMWDWMWAHEFI-BMOUEYTDSA-N	441.532	1.265	50	20	IDGD	
CCc1cc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](Br)CC)CCO3)n(C)n1	1779625736	BOVJZELXGAWJBV-KDOFPFPSSA-N	427.343	1.600	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)c3c(F)cccc3Cl)C2)C1	1780512611	VCMVQYVZNYXUKY-HXUWFJFHSA-N	440.903	1.296	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H]2CCCN(C)C2)C1	1780569007	XRYQCJBIKUQBAI-AXVVYFOYSA-N	444.414	1.873	50	20	IDGD	
COc1cc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](F)Br)C2)ccn1	1780774450	ARVIETRJANZOCV-QIIPPGSGSA-N	444.301	1.908	50	20	IDGD	
Cc1cnc2c(C(=O)N3CCO[C@]4(CCN(C(=O)[C@](C)(Cl)CCl)C4)C3)cnn2c1	1781230627	WJRARXNYJAFNGS-RTBURBONSA-N	440.331	1.718	50	20	IDGD	
CCNC(=S)NCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(C)(C)CCl)C2	1781470501	GJZRIHCKISADKC-AUUYWEPGSA-N	433.018	1.249	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)/C(=C/c3ccco3)NC(C)=O)C2)C1	1781858753	ADMCVGZTYRNXQY-MPWLMCFTSA-N	437.924	1.994	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H]1CCCCN1C)C2	1781997444	WRFIAPZSIGBZHH-WFXMFSGNSA-N	430.387	1.768	50	20	IDGD	
O=C(c1cc2ccoc2cn1)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1782191166	RSIAXXSOSHSFIG-PBHICJAKSA-N	426.242	1.962	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](C)CN(CC)CC)C2)C1	1782701722	HIXYBLUMEYIKIG-TXPKVOOTSA-N	432.403	1.968	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Cl)C2	1783104259	JGXPRRQOZSIBHT-ZXYWRSMDSA-N	435.924	1.950	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)C(C)(C)NCCC#N)CCO2	1783343350	UOKPBBUJDCNFCO-KDOFPFPSSA-N	429.359	1.272	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)c3ccco3)[C@H]2C1	1783566065	RNEDJWSFKBNASG-YOPIWALVSA-N	429.311	1.466	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(C)cc3-n3nccn3)CCO2)C1	1783880913	GUCAAFKXHRYNCP-LAUBAEHRSA-N	447.923	1.273	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(C1)CN(C(=O)C(C)(C)Oc1ccc(C)cn1)CCO2	1783883737	YFOXDJAFPXZPRT-IIBYNOLFSA-N	439.940	1.631	50	20	IDGD	
O=C(C(Cl)Cl)N1CC[C@]2(C1)CN(C(=O)[C@@H]1CC(=O)N(C3CCCC3)C1)CCO2	1783942961	QKXFUSUGNNBEOU-YJYMSZOUSA-N	432.348	1.411	50	20	IDGD	
C#CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@]2(CN(C(=O)[C@@H](Cl)CC)CCO2)C1	1785575829	GJVYBGYCPMIEJE-CKJXQJPGSA-N	441.956	1.750	50	20	IDGD	
O=C(Cc1ccc(F)cn1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21	1787034283	HEAIFILHJASCOB-CFMVVWHZSA-N	432.265	1.433	50	20	IDGD	
COc1cccc(C(=O)Nc2ccc(C3(NC(=O)c4ccc(B(O)O)cc4)CCC3)cc2)n1	1787198459	QFINGVMSAGUHMJ-UHFFFAOYSA-N	445.284	1.832	50	20	IDGD	
CN[C@@H](CC(=O)Nc1ccc(C2(NC(=O)[C@H](F)Br)CCC2)cc1)C(=O)O	1788063904	CQIDHUZTJWOLOU-JSGCOSHPSA-N	430.274	1.874	50	20	IDGD	
C[C@@H](Br)C(=O)NC1(c2ccc(NC(=O)[C@H](O)N3CCOCC3)cc2)CCC1	1789557034	OFIUFTGVQVUJQJ-ACJLOTCBSA-N	440.338	1.555	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnn4cccnc34)C[C@@H]21	1789867790	GJIFGALZBJGJCL-VFSPDHHESA-N	440.331	1.559	50	20	IDGD	
C[C@H](Cc1ccccn1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]2C1	1789926643	DZSZRRFSNLTRPZ-NOYHWAJDSA-N	442.329	1.930	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(N(C)C)cn3)C[C@@H]21	1791056855	GEDJYPYPMINIRD-RMRKRWHISA-N	439.354	1.524	50	20	IDGD	
O=C(Cn1cnc2ccccc21)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21	1791178953	LCKBJGCIQLBJTK-XEZPLFJOSA-N	425.316	1.820	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCCCCC(=O)OC)C[C@@H]21	1791257473	IVHYNTRWAWWNON-NXOAAHMSSA-N	432.945	1.343	50	20	IDGD	
C[C@@H](Cn1ccnc1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)CBr)C[C@@H]21	1791625411	SSDNRSZRWJIZQC-WOYTXXSLSA-N	441.370	1.530	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1(CNC(=O)OC(C)(C)C)CC1	1792546644	WPXCRKKGIWZUPG-FZKCQIBNSA-N	443.972	1.898	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCN1C(=O)c2ccccc2C1=O	1794120258	JXQHYDLDCRXADY-BASYENTBSA-N	447.919	1.565	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cncnc1	1795195583	WJTJXCLKDVSPFJ-MUJYYYPQSA-N	439.428	1.876	50	20	IDGD	
CCOC(=O)c1cccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Cl)c1F	1796366236	ODHKRZKXSWVISJ-OXUXUCFPSA-N	430.835	1.740	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CCC[C@@H]1C	1797292336	CNVLIGOFBOJARH-WVMZQYFNSA-N	429.521	1.146	50	20	IDGD	
CC(C)(C)OC(=O)N1CCCC[C@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2	1797737235	DDBGXLYLOABNIU-XFIYOXNOSA-N	447.935	1.900	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN(C(=O)OC(C)(C)C)C1CC1)C2	1799264397	HKDOOZPDHBEHJG-KPEUIFRASA-N	443.972	1.993	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c(c1)NC(=O)[C@H](C)O3)C2	1799268651	BHMWAVBFDWIDBW-HMZURLEKSA-N	435.908	1.627	50	20	IDGD	
Cc1cccc(Cl)c1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCC(=O)NN(C)C)C2	1799605497	SXJNRTDKTWRLPC-YVWYUNDQSA-N	436.940	1.225	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COCc1ccccc1)C2	1800640132	VSYCTFCFPSGLRF-ZMMAXQRCSA-N	439.350	1.966	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(F)nc1C)C2	1800641875	LCQYDUCPOQNTOC-LMWOUKEDSA-N	428.302	1.906	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3nncn3c1)C2	1800642031	SIVXCJVJZJZXBC-HLPPOEQASA-N	436.310	1.106	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(O)c(F)c1)C2	1800642865	AAEJEEAIBOJKGQ-OQMKEHIESA-N	429.286	1.908	50	20	IDGD	
COc1ncccc1CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)Br	1800756840	JONOIQSWJWMNCW-FAYQHZLMSA-N	440.338	1.396	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(-c3cnco3)c1)C2	1800976867	BEPBYGBSXUSOKX-SFNKJDCFSA-N	433.892	1.799	50	20	IDGD	
COC[C@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnc3sc(C)cn3c1=O)C2	1802273585	PUCJJGLIQBUAJI-XFMPKHEZSA-N	438.937	1.570	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2c[nH]c3ncccc23)[C@H]1c1cccnc1)[C@H](O)CCl	1803139655	SIJAYZSFTMIPGB-QGTPRVQTSA-N	427.892	1.877	50	20	IDGD	
O=C(CCc1ccco1)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1804584254	ILJXBZBXTYWJJF-XXBNENTESA-N	447.300	1.307	50	20	IDGD	
O=C(CCBr)NC[C@@H]1CCN(C(=O)c2ccc[n+]([O-])c2)[C@@H]1c1cccnc1	1806339094	IUIKFKJFXYAPET-MAUKXSAKSA-N	433.306	1.820	50	20	IDGD	
O=C(CCc1ccc[nH]1)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1807458837	CFVSGQIFHXJOBE-XXBNENTESA-N	446.316	1.042	50	20	IDGD	
Cn1c(C(=O)N2CCCC3(CCN(C(=O)[C@H](F)Br)CC3)C2)cccc1=O	1807992776	ODJKQUWEMRGDHF-HNNXBMFYSA-N	428.302	1.921	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1CCN(C(=O)Cn2ccnn2)[C@@H]1c1cccnc1	1808302044	ASBRYSORSMINFA-LESCRADOSA-N	425.320	1.615	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)c2cn[nH]c2)[C@H]1c1cccnc1	1808608536	XPUMXZKVDVYISK-XJYZCQQUSA-N	448.487	1.258	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)C3(F)CCCCC3)CC2)C1	1809978898	XLFMWPRJHSLDFY-UHFFFAOYSA-N	430.329	1.884	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H](CNC(=O)c2cnc(O)[nH]2)[C@@H]1c1cccnc1	1810942132	BDTPGUKPRYAHBG-KYOSRNDESA-N	436.310	1.861	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)[C@@H]2CCNC(=O)C2)[C@@H]1c1cccnc1	1812868070	RPRUHLVKMPVLQD-UICACZKSSA-N	437.338	1.397	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)Cn2ccnc2)[C@H]1c1cccnc1	1813033294	LIMHXXQQKKRWOK-WNHJNPCNSA-N	433.940	1.874	50	20	IDGD	
Cc1n[nH]c(C)c1C(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1813073320	KZJRLLBEEMTLES-UWJYYQICSA-N	441.536	1.114	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)C(F)(F)Cl)[C@H]1c1cccnc1	1813215643	ZQRADKNXLVVXTK-XJKSGUPXSA-N	431.871	1.292	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@H]1CCc2nc(NC(=O)Cn3cncn3)sc2C1	1815657538	XGXMKVAXTGHFLY-ZJUUUORDSA-N	427.328	1.378	50	20	IDGD	
Cc1ncc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)s1	1817475449	RGLHXLPISOWEMJ-MRXNPFEDSA-N	439.306	1.474	50	20	IDGD	
Cc1nc2ncccn2c1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](O)CCl)CC2	1818389249	QVPNCGVLMHOYDF-JQWIXIFHSA-N	434.909	1.320	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)C1=COCCC1)CC2	1819800491	PESVTUDRLUDJFD-LBPRGKRZSA-N	442.501	1.062	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H]1CC=CCC1)CC2	1819800808	RPAXKNGHADCQJF-QWHCGFSZSA-N	440.529	1.724	50	20	IDGD	
COC[C@@H](NC(C)=O)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CO[Si](C)(C)C)CC2	1820193527	XMYXWGOQYPHLDK-GXTWGEPZSA-N	442.614	1.058	50	20	IDGD	
COc1ccc2[nH]cc(C(=O)Nc3nc4c(s3)C[C@@H](NC(=O)[C@H](O)CCl)CC4)c2n1	1821244453	VMPCNXFYUJBDDK-TVQRCGJNSA-N	449.920	1.854	50	20	IDGD	
CN1CCCn2nc(C(=O)Nc3cc([C@H]4CCCCN4C(=O)[C@@H](O)CCl)[nH]n3)cc2C1	1821591804	OVRKUIZPQOWSHM-SJORKVTESA-N	449.943	1.347	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H]2CCCO2)n[nH]1	1822158451	HKCAKZAJDMPZME-SWORYUBOSA-N	441.492	1.715	50	20	IDGD	
COc1ccc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)CCC(=O)NN(C)C)CC3)cc1	1822226918	HGWAATVNZACDNF-AWEZNQCLSA-N	445.545	1.751	50	20	IDGD	
C[C@@H](C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1)c1ccccn1	1822417101	ZTTJACAILHAEKY-QAPCUYQASA-N	441.536	1.974	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CN1CCCC1=O)CC2	1822863534	MYPDHOGAPPLXIO-BMLIUANNSA-N	433.361	1.914	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H]1CCNC(=O)C1)CC2	1825453147	PVYQXGLTUXPBHU-MXWKQRLJSA-N	443.367	1.755	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)Cc1cccc(F)c1)CC2	1826085052	BCHBKZLTKOKDCQ-OAHLLOKOSA-N	447.536	1.810	50	20	IDGD	
Cc1cnc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)s1	1827050155	GZOMDAPVGIGUBH-IBGZPJMESA-N	441.362	1.678	50	20	IDGD	
CC(C)O[C@H](C)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1	1828924100	ISSFLIFDDFPRAT-OXQOHEQNSA-N	445.564	1.732	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccc(C#N)cc3)CCO2)C1	1829898942	OQGFYHUUUWAVBX-KNQAVFIVSA-N	433.936	1.965	50	20	IDGD	
O=C(CN1CCOCC1)N1CCC([C@@H]2CCCCN2C(=O)[C@H](F)Br)CC1	1830375457	UMCZRLGVMSEMDX-RDJZCZTQSA-N	434.350	1.629	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCc2nc(N)n[nH]2)CC1	1831655266	MZZCBIKQPNVIDE-GXTWGEPZSA-N	441.374	1.723	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnnc(Cl)c3)CCO2)C1	1833204819	HPDBYQIDAVXRHS-KBXCAEBGSA-N	431.320	1.608	50	20	IDGD	
Cc1noc(C)c1CC(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)CCl)CC2)CC1	1833308108	IOHYDXACYOWWQL-SFHVURJKSA-N	426.945	1.005	50	20	IDGD	
CN(C)c1cncc(C(=O)N2CCO[C@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)c1	1833365858	ITYQZASWCCFHOA-GOSISDBHSA-N	431.320	1.021	50	20	IDGD	
CCC(=O)N[C@@H](C)C(=O)NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1	1833421946	PUKCJCWULOBRKZ-LRDDRELGSA-N	449.365	1.163	50	20	IDGD	
CCc1[nH]nc(C(=O)N2CCO[C@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)c1F	1833737808	KQGUCRJXFYBBAG-IBGZPJMESA-N	442.564	1.033	50	20	IDGD	
Cc1cccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](C)CBr)C3)C2)n1	1834047076	VZZCBHWZXGRHEO-KUHUBIRLSA-N	440.338	1.491	50	20	IDGD	
Cc1ccc(CC(=O)N2CCOC[C@@]3(CN(C(=O)CCBr)CCO3)C2)cn1	1834819232	KWEVGGKCJSTDJQ-LJQANCHMSA-N	440.338	1.174	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CCNC(C)C)CCO2)C1	1835888918	BWLVVSZWRAOZLL-YJBOKZPZSA-N	434.375	1.004	50	20	IDGD	
Cc1ccncc1CCC(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836715068	IJBHROCEVXVNKH-FQEVSTJZSA-N	437.968	1.921	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)c3ccncc3F)CC2)CC1	1838175922	RJCWHZABGQPRQG-UHFFFAOYSA-N	449.527	1.206	50	20	IDGD	
O=C(CCn1cncn1)N1CCC(OC2CCN(C(=O)[C@H](F)Br)CC2)CC1	1838648499	WRSKSEQCJYZBCJ-INIZCTEOSA-N	446.321	1.357	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(C#N)c1)CCO2	1838907307	LAGSYOPJZSYPTJ-NRFANRHFSA-N	431.565	1.480	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3cccc(C#N)c3)C2)C1	1839141933	YJZHDYHNJGFJSQ-KNQAVFIVSA-N	433.936	1.965	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(O)cc3F)C2)C1	1839154064	AAGLVEQGABIUKZ-RBUKOAKNSA-N	449.306	1.838	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)nc1	1839198058	RLNDSIWHYOXMPJ-WMLDXEAASA-N	430.274	1.151	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccn4nccc34)CCO2)C1	1839537755	AGFBDYUWEAPILO-NRFANRHFSA-N	434.924	1.669	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cccnc3)C2)C1	1839964129	HOZYFCQBNAFWDI-APWZRJJASA-N	440.338	1.254	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(C)c(Cl)c3)C2)C1	1840149654	WNIQEJWGCNMCFY-YLJYHZDGSA-N	445.343	1.972	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCCCCC(=O)OC)CCO2)C1	1840236828	XBZYMYQHZQEECJ-JXFKEZNVSA-N	432.945	1.584	50	20	IDGD	
C[C@@H](O)[C@H](NC(=O)c1ccccc1)C(=O)N1CC2(CCCN2C(=O)CO[Si](C)(C)C)C1	1844376987	JFPYCTVJIXEMMR-APWZRJJASA-N	447.608	1.221	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)c2cnc(Cl)c(Cl)c2)C1	1844448676	QNGGPSOMBXBNIS-UHFFFAOYSA-N	434.088	1.199	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)c2cc(F)c(N(C)C)c(F)c2)C1	1845545783	PMNPFFCDHFBLCB-UHFFFAOYSA-N	437.491	1.221	50	20	IDGD	
O=C(CCBr)N1CC[C@H]2[C@@H]1CCN2C(=O)CCn1c(=O)oc2ccccc21	1848152283	DOMZSPLVEWPDGX-KBPBESRZSA-N	436.306	1.971	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Cn2c(=O)n(CC)c3ccccc32)c2ccccc2c1=O	10708460	KUGFRJPOCRLGJN-UHFFFAOYSA-N	434.456	1.014	50	20	IDGD	
CCn1c(NNC(=O)c2ccc(OC)c(S(=O)(=O)NC)c2)nc2ccccc2c1=O	11163996	CMOFLCGSMFYPAV-UHFFFAOYSA-N	431.474	1.090	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c1	15886305	FSUSZYZKNNJXEL-UHFFFAOYSA-N	447.513	1.164	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)c2c[nH]c(=S)n2-c2ccc(F)cc2)c2ccccc2c1=O	17193299	HOWBEQXQSUAZKR-UHFFFAOYSA-N	438.444	1.996	50	20	IDGD	
CCOC(=O)NNC(=O)c1ccc(S(=O)(=O)Nc2cc([N+](=O)[O-])ccc2OC)cc1	21772318	LJLSLQCGJCQVBR-UHFFFAOYSA-N	438.418	1.795	50	20	IDGD	
CNS(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(COc3ccccc3)o2)c1	24464298	MGBZDMYXGMIBIT-UHFFFAOYSA-N	429.454	1.842	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(=O)n(CC(=O)NNc2oc(C(C)C)nc2C#N)c1	116127895	BBBIMVKZUCELOA-UHFFFAOYSA-N	436.494	1.005	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)NCCN2CCOC(C)(C)C2)c2ccccc2c1=O	726262733	NCGUBHQRAFZPMW-UHFFFAOYSA-N	430.509	1.032	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)NCc2ccc([C@]3(C)NC(=O)NC3=O)cc2)cc1	726282371	MWGGHIZVEXFYMR-NRFANRHFSA-N	441.513	1.672	50	20	IDGD	
CC(C)(C)c1nc(CC(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cs1	726766978	BOHWEVVSODOQSA-UHFFFAOYSA-N	430.939	1.745	50	20	IDGD	
C[C@@H]1Oc2ccccc2N(CC(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)C1=O	726862876	GUCYMBKMRDPKAW-ZDUSSCGKSA-N	430.486	1.385	50	20	IDGD	
CN(C)CC(=O)NNC(=O)c1ccccc1OCC(=O)Nc1ccc(Br)cc1	727483434	RDVFGIVEXJSMSW-UHFFFAOYSA-N	449.305	1.789	50	20	IDGD	
CCOc1ccc(OCC)c(NC(=S)NNC(=O)CN2C(=O)NC3(CCCC3)C2=O)c1	727496087	BQVDXSIBXRALGE-UHFFFAOYSA-N	449.533	1.666	50	20	IDGD	
C#Cc1cccc(NC(=S)NNC(=O)CCNS(=O)(=O)c2cc(C)ccc2C)c1	727497750	LIBSSDFAGZTGJB-UHFFFAOYSA-N	430.555	1.971	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)N[C@H](CN1CCN(C)CC1)c1ccccc1	727946362	WZCLVEBGNVFDLR-YLJYHZDGSA-N	443.523	1.912	50	20	IDGD	
CNS(=O)(=O)c1ccc([C@H](C)NC(=O)NNC(=O)c2cccc(OC(F)F)c2)cc1	728598216	UXHMHHCEHYNYQI-NSHDSACASA-N	442.444	1.901	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NN=Cc1cccnc1C)N(S(C)(=O)=O)CC2	728779620	PDMDAHFKQVWRCP-GOSISDBHSA-N	446.529	1.806	50	20	IDGD	
CCN(CC)CCN1C(=O)C(=NNC(=O)C2CCN(c3ncccn3)CC2)c2ccccc21	728783589	XLWVALOFQPODGB-UHFFFAOYSA-N	449.559	1.902	50	20	IDGD	
Cc1ccc(N2C[C@H](C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)CC2=O)cc1F	728846011	UGWUHEHKLDQJNB-MRXNPFEDSA-N	440.479	1.341	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCCN1C(=O)c1ccccc1)c1csc(N2CCOCC2)n1	729301022	WCHWQADYNGVFEP-KRWDZBQOSA-N	443.529	1.436	50	20	IDGD	
C[C@@H]1CCCCN1S(=O)(=O)c1ccc(C(=O)NNC(=O)COc2ccccc2O)cc1	730781739	XTOOXLLOEPZGJN-OAHLLOKOSA-N	447.513	1.795	50	20	IDGD	
Cc1c(C(=O)NNC(=O)[C@H]2COc3ccccc3O2)nnn1-c1ccc(OC(C)C)cc1	731326380	FZYDKWAGQWZVMY-LJQANCHMSA-N	437.456	1.964	50	20	IDGD	
CCS(=O)(=O)N(C)C1CCN(C(=O)/C(C#N)=C/c2cc(C)n(CCOC)c2C)CC1	731347605	GBYMHBNMQVJASM-XMHGGMMESA-N	436.578	1.931	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)NCc1cccc(CN2CCC[C@H](C(N)=O)C2)c1	731499829	JTLDKIDKYSFMHK-SFHVURJKSA-N	439.516	1.537	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3cc4c(nc3O)CCCC4)cc2)CC1	731809299	AHGFZBOLUDOGAH-UHFFFAOYSA-N	445.545	1.359	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCc3ccccc32)c1	732082842	PFRJATJXHKDCJT-UHFFFAOYSA-N	425.470	1.544	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCC(=O)NCCc2ccccc2)cc1Br	732255808	NUGVEHSSZABNGF-UHFFFAOYSA-N	449.305	1.761	50	20	IDGD	
O=C(NNc1nc(-c2ccc(Cl)cc2)no1)[C@@H]1CC(=O)N(CCN2CCOCC2)C1	732975168	CEGACSRGSNWJFB-CQSZACIVSA-N	434.884	1.014	50	20	IDGD	
CC(C)OCCCn1c(NNC(=O)[C@@H](C)Sc2nncn2C)nc2ccccc2c1=O	733265771	KLVIASFBPMLIAV-CQSZACIVSA-N	445.549	1.964	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)NCc2ccnc(OC3CCOCC3)c2)c1	733352767	FYIQAHQSSVDKQX-UHFFFAOYSA-N	430.461	1.801	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(C(=O)NNc2nccnc2Cl)cc1Br	734261557	MFOFVZZMXKDBCB-UHFFFAOYSA-N	434.703	1.900	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2ccc(C(F)(F)F)cc2)CC1	735117145	OTYIRWSDDCAKLX-UHFFFAOYSA-N	443.451	1.793	50	20	IDGD	
O=C(NNc1ccc(Cl)nn1)[C@@H]1CCCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1	735689034	KBEITEKEGOMPEH-LLVKDONJSA-N	440.869	1.582	50	20	IDGD	
O=C(CCSCc1nc(O)c2ccccc2n1)NNC(=O)COc1ccccc1O	739722512	BCBPJSAZZTVOLE-UHFFFAOYSA-N	428.470	1.891	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)N[C@@H](Cn1cccn1)c1ccccc1	741266025	HPDZSFJHVGLLQC-INIZCTEOSA-N	441.517	1.562	50	20	IDGD	
Cn1cc(S(=O)(=O)N2CCC(NC(=O)NNc3ccc(OC(F)F)cc3)CC2)cn1	741427238	YBTNBFSMMGBUAK-UHFFFAOYSA-N	444.464	1.501	50	20	IDGD	
CCn1nc(C)c(S(=O)(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)c1C	741657617	UUOBPEVLSVRAAE-UHFFFAOYSA-N	444.558	1.412	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNS(=O)(=O)c1ccc(Br)c(F)c1	743256454	UPCFBZJMJILUME-UHFFFAOYSA-N	436.284	1.389	50	20	IDGD	
COc1cc(CNC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c2ccccc2n1	743670862	VNWRAOJMNMKRKM-UHFFFAOYSA-N	428.470	1.791	50	20	IDGD	
CCOC(=O)N1CCN(C(=O)[C@H](C)OC(=O)/C(C#N)=C/c2cc(C#N)n(C)c2C)CC1	744631382	DOLWOFOWPSVXCM-ADFUCPMPSA-N	427.461	1.345	50	20	IDGD	
CC(C)N1CCN(c2ccc(C(=O)OCC(=O)NNC(=O)c3cccc(C#N)c3)cc2)CC1	744900533	MSWQGSKXRKXBEW-UHFFFAOYSA-N	449.511	1.707	50	20	IDGD	
CC[C@@H](C)[C@H](NC(=O)N1CCCC1)C(=O)OCC(=O)NNC(=O)c1ccc(C#N)cc1	745060807	XICYHJOTOFFQNB-KDOFPFPSSA-N	429.477	1.083	50	20	IDGD	
O=C(NCc1nnc2ccc(C(F)(F)F)cn12)NNC(=O)c1cc([N+](=O)[O-])ccc1O	745394430	RUNGIEUDFLJTBT-UHFFFAOYSA-N	439.310	1.506	50	20	IDGD	
C[C@@H]1C[C@H](NC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])C(=O)N1c1ccccc1	745880775	BAWZBPJWHHFSRV-HIFRSBDPSA-N	427.417	1.498	50	20	IDGD	
CCO[C@H]1C[C@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)C12CCCC2	745918015	MQYQAHMUMUSGBJ-IRXDYDNUSA-N	438.550	1.619	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCCNC(=O)NNC(=O)c2ccc(Cl)cc2F)cc1	747490064	HQCIOWGEBRZHEL-UHFFFAOYSA-N	428.873	1.710	50	20	IDGD	
COc1ccc(/C=C(\C#N)C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1	747874200	UTSABPIKSCFFBQ-XATQLNLPSA-N	437.408	1.133	50	20	IDGD	
CCCCN1C(=O)C[C@H](C(=O)NNC(=O)C(=O)N2CCCC2)[C@@H]1c1ccc(OC)cc1	748246692	GALJOFJKUNIBHY-HKUYNNGSSA-N	430.505	1.155	50	20	IDGD	
NS(=O)(=O)c1ccc2c(c1)oc(=O)n2CC(=O)NNc1ccc(C(F)(F)F)cc1	748499918	CQMPYQHYQSEJOZ-UHFFFAOYSA-N	430.364	1.404	50	20	IDGD	
CC(C)[C@H](C(=O)NNc1ccccc1S(=O)(=O)NC(C)(C)C)N1CCCS1(=O)=O	748601379	BQXSWPOLLQVPOP-MRXNPFEDSA-N	446.595	1.267	50	20	IDGD	
Cc1c(Br)cc(S(=O)(=O)NNC(=O)NCc2ccco2)cc1C(=O)O	748641290	IKWLALMCAPKGIW-UHFFFAOYSA-N	432.252	1.741	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)c2cc(S(=O)(=O)N3CCC3)ccc2Cl)c1	748694136	KQBKUXCRIGXVOJ-UHFFFAOYSA-N	436.921	1.875	50	20	IDGD	
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	749583422	LVXMBHUMHOPOMB-UZLBHIALSA-N	444.557	1.945	50	20	IDGD	
NC(=O)c1ccc(/C=C/C(=O)N2CCC[C@@H]2C(=O)NNC(=O)CCc2ccccc2)cc1	749800084	JIDXUMIRHWROJM-WLEBTQASSA-N	434.496	1.570	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)N[C@H]1CCN(CCCc2ccccc2)C1=O	750269101	VAHHYKAIHZYDMK-SFHVURJKSA-N	434.500	1.820	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)N[C@H]2CCN(CCCc3ccccc3)C2=O)c1	750293056	WSQHJNKUZKLHSK-FQEVSTJZSA-N	440.500	1.882	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)NCCNC(=O)c1cccc(Br)c1	750326913	SVACSJJAOVWSBS-UHFFFAOYSA-N	449.305	1.761	50	20	IDGD	
CC(C)NC(=O)C(=O)NNC(=O)c1ccccc1SCc1nnnn1-c1ccccc1	750872666	FRFCTFLXJSDFOZ-UHFFFAOYSA-N	439.501	1.240	50	20	IDGD	
CC[C@@H](C)C(=O)N1CCC[C@@H](C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)C1	751295515	ZMWODMDVKVOYCM-UKRRQHHQSA-N	437.566	1.334	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)C34CCC(CC3)C4)CC2)cc1	752580229	YBYHFLUGTOAJRQ-UHFFFAOYSA-N	434.562	1.029	50	20	IDGD	
C[C@H](C(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)c1ccc(S(C)(=O)=O)cc1	753476931	JRYZRYROLVCCTE-LBPRGKRZSA-N	449.441	1.106	50	20	IDGD	
COC(=O)c1cc2c(cc1NC(=O)C(=O)NNC(=O)c1cccc3ccccc13)OCO2	753842095	XPHIKANNGUDYHX-UHFFFAOYSA-N	435.392	1.755	50	20	IDGD	
C[C@H]1C[C@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)CN1C1CC1	753943797	QQEAEIBAXPABRX-HOCLYGCPSA-N	435.550	1.040	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)C(C)(C)CN(C)C	754374106	RKSDGVOOABHBDR-OAHLLOKOSA-N	439.582	1.391	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)[C@H](C)n1nnnc1C(C)(C)C	754975233	NXCGQNKSNFMPLQ-JTQLQIEISA-N	438.872	1.198	50	20	IDGD	
O=C(NN=Cc1cnc(N2CCOCC2)s1)c1cccc(S(=O)(=O)N2CCCC2)c1	755467624	ROYHGBOMDGWBOV-UHFFFAOYSA-N	449.558	1.528	50	20	IDGD	
CS(=O)(=O)CCOc1cccc(NC(=O)NNC(=O)COc2ccc(C#N)cc2)c1	756298356	VACSNNGPTHOQSQ-UHFFFAOYSA-N	432.458	1.213	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)Nc2ccc(S(=O)(=O)NCC(F)(F)F)cc2)cc1	756640112	IYPVXYUHFALEIM-UHFFFAOYSA-N	441.391	1.865	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)Nc1cccc(F)c1I	757779213	APCWPBSGJUDFGL-SSDOTTSWSA-N	441.222	1.018	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(n2cc(NC(=O)NNC(=O)c3cnccn3)cn2)CC1	758197939	SMZGTDYJMXQDNH-UHFFFAOYSA-N	430.469	1.712	50	20	IDGD	
CN(NC(=O)[C@@H]1CS[C@@]2(C)CCC(=O)N12)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758786602	NVIXTLHMQPIUTP-DJJJIMSYSA-N	441.554	1.076	50	20	IDGD	
CN(CC(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1)C(=O)c1cccs1	758786863	PMNXJENTMPIRRU-UHFFFAOYSA-N	439.538	1.456	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NC[C@@H](C[C@@H](C)O)c2ccccc2)c2ccccc2c1=O	759612513	SLHMPLFVNFYZMO-NVXWUHKLSA-N	437.500	1.915	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)N2CCC(N(C)CCCO)CC2)N(C)c2ccccc21	759722247	HCPJVFVBYCZSKR-UHFFFAOYSA-N	439.560	1.962	50	20	IDGD	
Cn1cc(-n2cc(C(=O)NNC(=O)Cc3nc(-c4ccccc4)cs3)ccc2=O)cn1	760828023	QFLNGJDPTHXEOC-UHFFFAOYSA-N	434.481	1.698	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C1(C(=O)NNC(=O)c2ccccc2OC)CCC1	762211524	WDHPJALJONWQPF-UHFFFAOYSA-N	440.456	1.096	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N1CCS(=O)(=O)CC[C@@H]1C	763129884	WKRLFCIGMRJIBE-RYUDHWBXSA-N	448.339	1.466	50	20	IDGD	
Cc1cc(C)n(CC(=O)NN=Cc2ccc(OCCn3cc(C(=O)O)nn3)c(Cl)c2)n1	763140870	PFSCFBDCKVXNFZ-UHFFFAOYSA-N	445.867	1.672	50	20	IDGD	
CCOC(=O)COc1cccc(NC(=O)C(=O)NNC(=O)c2ccc3ccccc3n2)c1	763450494	OOYBXWJMYAPVSZ-UHFFFAOYSA-N	436.424	1.576	50	20	IDGD	
Cc1nn(-c2ccccc2)c2sc(C(=O)NNC(=O)C(=O)Nc3cnn(CC#N)c3)cc12	763537513	FLNAPGOHSHUDMN-UHFFFAOYSA-N	448.468	1.515	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cccc3ccc(C)nc23)cc(OC)c1OC	763539596	NWMGBPBLNYLKRA-UHFFFAOYSA-N	438.440	1.969	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)Nc1ccc(OCc2cccnc2)cc1	763572882	VFRZBTXMWYPVNO-HXUWFJFHSA-N	448.435	1.587	50	20	IDGD	
CCN1CCN(c2ccc(NC(=O)C(=O)NNC(=O)c3cccc(N(C)C)c3)cc2)CC1	763757117	CNSRTJDEJIYWKP-UHFFFAOYSA-N	438.532	1.294	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccc(CC(=O)N(C)C)cc1	763867295	ZLPLDHNJVHIOPW-CYBMUJFWSA-N	430.436	1.010	50	20	IDGD	
Cc1csc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(Br)c2)n1	763882534	JRLYNVQKGCNVEA-VIFPVBQESA-N	427.280	1.767	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3cccc(C(=O)N(C)C)c3)cc2C1	763944123	WJSSTNKBXQLIQF-LBPRGKRZSA-N	428.514	1.974	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)cc1F	763974072	KKDGRKSIMNXTKJ-UHFFFAOYSA-N	425.800	1.610	50	20	IDGD	
CC(C)n1nnnc1-c1ccccc1NC(=O)C(=O)NNC(=O)c1cc(Cl)ccc1O	763976826	FFYOKZYNWRPGMM-UHFFFAOYSA-N	443.851	1.680	50	20	IDGD	
O=C(Cc1ccc2ccccc2c1)NNC(=O)C(=O)Nc1ccc(Cn2cncn2)cc1	764084327	JQNIMDOFIQMDCI-UHFFFAOYSA-N	428.452	1.808	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cc(Br)ccc2Br)n[nH]1	764100222	XXFIMBBSDGTYNF-UHFFFAOYSA-N	445.071	1.643	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2cc(C)n(-c3cccc(F)c3)n2)c1O	764132627	OIGXPZZHKPBUIN-UHFFFAOYSA-N	427.392	1.434	50	20	IDGD	
O=C(NNC(=O)c1cccc2ncccc12)C(=O)Nc1ccc2nc3n(c(=O)c2c1)CCC3	764253988	XJAQZZBBBCTBGD-UHFFFAOYSA-N	442.435	1.291	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2O)ccc1N1CCSCC1	764275470	LTXFZWNSAKBRTH-UHFFFAOYSA-N	444.513	1.419	50	20	IDGD	
Cn1nc(CC(C)(C)C)cc1NC(=O)C(=O)NNC(=O)c1cc(-c2cccs2)[nH]n1	764377302	MZCJKPCLTFQERJ-UHFFFAOYSA-N	429.506	1.860	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)C(=O)Nc1ccc(N2CCC(CN(C)C)CC2)cc1	764388064	XNPOAIOWPCDUIF-UHFFFAOYSA-N	438.532	1.568	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)C(=O)Nc1ccnc(OCC(F)(F)C(F)F)c1	764388197	DAWCPICZWPNKFT-UHFFFAOYSA-N	429.330	1.464	50	20	IDGD	
CN(C)c1ccc(Br)c(S(=O)(=O)NNC(=O)c2ccc3c(c2)OCO3)c1	766307627	LRWWVTALVLTUNL-UHFFFAOYSA-N	442.291	1.867	50	20	IDGD	
CN(C)[C@H](C(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1)c1ccccc1	766659919	JFYROHJDZKZZHP-QFIPXVFZSA-N	443.979	1.908	50	20	IDGD	
CON(C)C(=O)[C@H](CCSC)NC(=O)NNC(=O)c1cc(-c2ccc(C)cc2)[nH]n1	767163657	KSNRNLCVONVDJC-AWEZNQCLSA-N	434.522	1.471	50	20	IDGD	
Cc1c(C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)nnn1Cc1ccc(F)cc1	767922947	DVWXNQGFQHILQU-UHFFFAOYSA-N	435.460	1.243	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@@H]2C[C@H](OC(C)C)C2(C)C)cc1	768431195	PQXBTGNBBLVLKD-SJORKVTESA-N	440.566	1.538	50	20	IDGD	
Cn1ccnc1[C@H](O)[C@@H]1CCCN(C(=O)NNC(=O)c2cc(Br)c[nH]2)C1	769950984	DKOQBOBNSWAZLG-ZWNOBZJWSA-N	425.287	1.311	50	20	IDGD	
CC(C)S(=O)(=O)c1cccc(C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c1	770445324	WYVAZQVWUPZTMU-UHFFFAOYSA-N	449.441	1.395	50	20	IDGD	
CCOC(=O)[C@]1(C(C)C)CCN(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)C1	770511723	AZOSGPBUMPBKOM-OAQYLSRUSA-N	432.525	1.345	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)[C@@H](c1ccc(Cl)cc1Cl)N1CCOCC1	772160315	CEHKKIGSTRDWMX-BDJLRTHQSA-N	432.304	1.856	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NNC(=O)c2ccccc2NS(C)(=O)=O)C1	773412800	XNVSIFGBJGVLBT-CYBMUJFWSA-N	440.522	1.466	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(C)c(Br)cn1	773523478	CLIFQQLZQLTPBT-UHFFFAOYSA-N	437.250	1.326	50	20	IDGD	
CC(C)c1c(Cl)ncnc1NNC(=O)c1ccc(S(=O)(=O)CC(=O)N(C)C)cc1	774184684	DBGGVOBVBZLTCV-UHFFFAOYSA-N	439.925	1.872	50	20	IDGD	
COCCCNC(=O)NNS(=O)(=O)c1cc(Br)c(NC(C)=O)cc1C	774614412	CESSYZRMJYPDJE-UHFFFAOYSA-N	437.316	1.245	50	20	IDGD	
CS(=O)(=O)Cc1ccc(Cl)cc1S(=O)(=O)NNC(=O)CCc1ccccc1O	774617571	AVCMZGZQXACSAS-UHFFFAOYSA-N	446.934	1.533	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2c(OC)cccc2OC)cc(OC)c1OC	775250889	ADMUNBKVFBDEKR-UHFFFAOYSA-N	426.447	1.353	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCc2cc(COC(C)(C)C)on2)c2ccccc2c1=O	777269792	UPTNPQUOGLKGIZ-UHFFFAOYSA-N	442.476	1.864	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)c1cn(-c2ccc(Br)cc2)cn1	778443418	QMDWHRDISJMBNM-UHFFFAOYSA-N	438.282	1.921	50	20	IDGD	
CCCc1ccc(S(=O)(=O)N2CCN(S(=O)(=O)CBr)CC2)cc1	782402593	RRZBMEBSLOEQML-UHFFFAOYSA-N	425.370	1.628	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)cc1)C(=O)Nc1cc(Cl)ccc1OC[C@H]1CCOC1	782838056	YQQGGBMXJGCZTP-LBPRGKRZSA-N	433.848	1.861	50	20	IDGD	
CCOc1cc(NC(=O)C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)ccc1C	782896014	BIDIXMQPICVCHB-UHFFFAOYSA-N	447.517	1.395	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2ccnn2Cc2cnn(-c3ccccc3)c2)nc(C)n1	783327170	XXZIBGDVMQEDGZ-UHFFFAOYSA-N	431.460	1.606	50	20	IDGD	
Cc1ccc(NNC(=O)C(=O)Nc2ccc(S(=O)(=O)/N=C3\CCCN3C)cc2)cc1	783344583	CFUNQELHXQSRCY-HKOYGPOVSA-N	429.502	1.890	50	20	IDGD	
Cc1cc(Br)cc(Cl)c1NC(=O)C(=O)NNC(=O)C(=O)N1CCCC1	783996136	DNVNNEGGWSBGMP-UHFFFAOYSA-N	431.674	1.119	50	20	IDGD	
COC(=O)[C@@H]1CN(C(=O)C(=O)NNc2ccc(OC(F)(F)F)cc2)c2ccccc2O1	784804139	VNAARGDHSMSYCZ-HNNXBMFYSA-N	439.346	1.996	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ccc(Br)nc2)cc1NS(C)(=O)=O	784809134	MGXZEHQCDOLWMI-UHFFFAOYSA-N	442.295	1.606	50	20	IDGD	
Cc1nn(C)c2ncc(NC(=O)C(=O)NNc3ccc(S(=O)(=O)C(F)F)cc3)cc12	784836019	NKGLIAKIIJMQHD-UHFFFAOYSA-N	438.416	1.355	50	20	IDGD	
CC(C)N(C)S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2cccnc2Cl)cc1	784839138	NTYQGESYXBQJAO-UHFFFAOYSA-N	425.898	1.846	50	20	IDGD	
C[C@@H]1CN(c2ccc(NC(=O)C(=O)NNc3cccc(S(C)(=O)=O)c3)cc2)CCO1	784841174	MOOHOEOKAGCHBV-CQSZACIVSA-N	432.502	1.397	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)C(=O)Nc2ccc(C(=O)NC3CCOCC3)cc2)c1	784854518	JIRNNKMDQSHZLR-UHFFFAOYSA-N	440.456	1.464	50	20	IDGD	
CN(c1ccccc1)S(=O)(=O)c1cccc(NC(=O)C(=O)NNc2cccnn2)c1	784862427	HZSJUYYZGOAVPZ-UHFFFAOYSA-N	426.458	1.384	50	20	IDGD	
CCNC(=O)N(C)NC(=O)C(=O)Nc1cccc(Oc2ncc(Br)cn2)c1	784917275	IAIKWIVAIIAMSV-UHFFFAOYSA-N	437.254	1.662	50	20	IDGD	
COc1cc(F)cc(NNC(=O)C(=O)Nc2ccc(NC(=O)CN3CCOCC3)cc2)c1	785237424	RZAQVQIWAPJAKF-UHFFFAOYSA-N	445.451	1.187	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1ccc(-c2cc[nH]n2)cc1	785331779	ZVTVJZLCPLIWBP-UHFFFAOYSA-N	429.458	1.571	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNS(=O)(=O)c1c(C)csc1C(=O)OC	785481435	MSKYOTZTUMPRRD-UHFFFAOYSA-N	428.488	1.630	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1C(=O)N1CCOCC1	786109703	UNQXLFLPMJKGPU-UHFFFAOYSA-N	427.417	1.842	50	20	IDGD	
COC(=O)CCc1cccc(NC(=O)C(=O)NNC(=O)COc2cc(C)cc(C)c2)c1	786415102	WUYHBZQKVJBRIM-UHFFFAOYSA-N	427.457	1.574	50	20	IDGD	
CN(NS(=O)(=O)Cc1ccc(Cl)nc1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	788916462	OUHSWWRHQPIAFY-UHFFFAOYSA-N	447.945	1.674	50	20	IDGD	
Cc1nc2nc(N)nn2c(C)c1CCC(=O)NNC(=O)c1cc2c(s1)CC[C@H](C)C2	789297985	GKXOAJPHRQCPBS-JTQLQIEISA-N	427.534	1.903	50	20	IDGD	
CCOC(=O)COc1c(Br)cc(C)cc1C=NNC(=O)N1CCN(C)CC1	790173220	DLHFZKOBTGNGMT-UHFFFAOYSA-N	441.326	1.990	50	20	IDGD	
COc1cc(NNC(=O)c2cccc(S(=O)(=O)N3CCNC(=O)C3)c2)ccc1Cl	790177947	NJFRWPYUADAVAU-UHFFFAOYSA-N	438.893	1.226	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCN(CC(F)(F)F)C1)c1cccc(S(=O)(=O)N2CCCC2)c1	791446009	LCFQCMUZBLQHKM-AWEZNQCLSA-N	448.467	1.116	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNc2nc3ccccn3n2)sc2c1CCSC2	792394816	MTFBVWPOUYUQHZ-UHFFFAOYSA-N	446.514	1.839	50	20	IDGD	
O=C(C[C@H]1CCCOC1)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	792791155	YSORUJMXXRYUQH-QGZVFWFLSA-N	431.514	1.743	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)[C@@H]3[C@H]4[C@H]5C[C@@H]6[C@@H]7[C@H]5[C@H]3[C@@H]7C[C@H]64)cc2)CC1	793711523	IESVQFLLJSKHCT-QMGOTOBTSA-N	442.585	1.460	50	20	IDGD	
CNS(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)c2cccc(OC(F)F)c2)cc1C	794587595	LYTCSCXXRJTRCQ-UHFFFAOYSA-N	449.457	1.128	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)N2C[C@@H](CC(=O)N(C)C)c3cc(Cl)ccc32)n1	797371247	RTBUEQMFOJMMLZ-CYBMUJFWSA-N	443.891	1.413	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)Nc2ccc(F)c(N3CCOC3=O)c2)c2ccccc2c1=O	797656704	PKHSZVUROUXAIT-UHFFFAOYSA-N	440.391	1.496	50	20	IDGD	
C[C@H](Oc1ccc(Br)cc1)C(=O)NNC(=O)CNC(=O)c1cccs1	798420386	RIWJAEYYQYHJPI-JTQLQIEISA-N	426.292	1.855	50	20	IDGD	
N#Cc1cc(S(=O)(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)ccc1C(F)(F)F	799920979	GRMNDWNNHXYPRU-UHFFFAOYSA-N	430.320	1.814	50	20	IDGD	
CN(CC(=O)NNC(=O)Nc1ccc(OC(F)F)cc1)S(=O)(=O)c1cccnc1	802043568	HFSKMNWSXQIVFP-UHFFFAOYSA-N	429.405	1.156	50	20	IDGD	
COc1ccc(C2=NO[C@H](CNC(=O)NNC(=O)C(=O)Nc3ccc(C)c(C)c3)C2)cc1	802368249	WLLFYSODNVFBGH-SFHVURJKSA-N	439.472	1.774	50	20	IDGD	
CN(CCc1nc(-c2ccccc2)no1)C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	804867560	FWQISKUNDKMHKB-UHFFFAOYSA-N	433.432	1.241	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(F)c(S(=O)(=O)N(C)C)c2)cc1	806974921	YUEINQDNTCMHPJ-UHFFFAOYSA-N	436.465	1.038	50	20	IDGD	
CCN(C)C(=O)c1cccc(NC(=O)C(=O)NNC(=O)CSc2ccccc2O)c1	806980589	QXMOLXVDSBEDAH-UHFFFAOYSA-N	430.486	1.362	50	20	IDGD	
CCn1c(CNC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)nc2ccccc21	807070884	ZQCTYCZUOZEQNI-UHFFFAOYSA-N	443.533	1.802	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3ccc4c(c3)N(C)CCO4)n[nH]2)cc1OC	807085730	YUPPZZZACCVLNX-UHFFFAOYSA-N	437.456	1.997	50	20	IDGD	
O=C(NNc1nccnc1C1CCC1)C(=O)Nc1ccc(S(=O)(=O)N2CCCC2)cc1	807461600	LDQIGQDOKMPTMS-UHFFFAOYSA-N	444.517	1.610	50	20	IDGD	
CCCS(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)CCOc2ccccc2)cc1	808085471	MMUNESDXFMOEPD-UHFFFAOYSA-N	426.516	1.649	50	20	IDGD	
CN(C1CCN(C(=O)OC(C)(C)C)CC1)S(=O)(=O)NNC(=O)c1cccc(C#N)c1	808089816	ZUQHWJKHSHRGGT-UHFFFAOYSA-N	437.522	1.369	50	20	IDGD	
O=C(NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)Nc1cccc2c1COC2=O	808905976	GJLZNWRROZNESU-UHFFFAOYSA-N	444.469	1.608	50	20	IDGD	
O=C(CCc1ccccc1)NNC(=O)CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1	810285000	YXSUSONDXKFVML-UHFFFAOYSA-N	445.419	1.644	50	20	IDGD	
CC(C)CC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)NNc1ccc(S(=O)(=O)C(F)F)cc1	810346364	MZGNBYOIFVLMIH-HNNXBMFYSA-N	443.476	1.623	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(F)c(C(=O)OC)c1C	810385737	ZSPLRLJJXFRMCQ-UHFFFAOYSA-N	431.420	1.648	50	20	IDGD	
CC(C)NS(=O)(=O)c1cccc(C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)c1	812726386	CAMOZFLVPOYDJC-UHFFFAOYSA-N	440.547	1.381	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)[C@@H](O)c3ccc(Cl)cc3)cc2)CC1	813495397	ZGSMXENWMVHKBA-SFHVURJKSA-N	438.937	1.453	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)c2nn(C)cc2Br)cc1C	814601158	INHRBRMPRNPGCS-UHFFFAOYSA-N	429.296	1.733	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)CN2C(=O)[C@H]3CC=CC[C@H]3C2=O)c1	815377398	TVNFHQAIKDEJKB-TXEJJXNPSA-N	436.262	1.170	50	20	IDGD	
CCOc1ccc(NC(=O)c2ccc(NC(=O)C(=O)NNC(=O)[C@H]3CCCO3)cc2)cc1	815779316	ZUEOCKLAVDYJHK-GOSISDBHSA-N	440.456	1.603	50	20	IDGD	
COC(=O)c1cc(NNC(=O)CCNS(=O)(=O)c2cccc(C(C)=O)c2)ccc1C	816688852	IVICPTHTRJFJAZ-UHFFFAOYSA-N	433.486	1.796	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNS(=O)(=O)c2cccc(S(C)(=O)=O)c2)cc1	903939355	PZABUDUIHKCYLC-CYBMUJFWSA-N	442.515	1.266	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)CCN2C(=O)[C@@H]3CCCC[C@H]3C2=O)cc1	912609559	SULPVFAUSADPCR-ZTFGCOKTSA-N	431.489	1.565	50	20	IDGD	
CCOC(=O)c1sc2[nH]c(CSCCC(=O)NNC(=O)OC)nc(=O)c2c1C	913176979	VYQMKMYAGKKTRU-UHFFFAOYSA-N	428.492	1.480	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2ccn(-c3ccccc3F)n2)ccc1Cl	915188786	RKXQJUUBNUBULJ-UHFFFAOYSA-N	437.840	1.387	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)Cc1cc(F)c(OC)c(S(N)(=O)=O)c1	915596744	ZPEGXEYUZRFIHE-UHFFFAOYSA-N	445.856	1.147	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)CC(F)(F)F)CC2)cc1	916146388	DTHIVVMMGXMGGY-UHFFFAOYSA-N	437.440	1.586	50	20	IDGD	
CNS(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2ccc(Cl)cc2OC)s1	916231976	CGRUYAUVFGIYTR-UHFFFAOYSA-N	432.911	1.462	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)NCc2ccc(N3CCN(C)CC3)nc2)c1C	916245544	HRCDRVBFXMGLEL-GOSISDBHSA-N	440.548	1.748	50	20	IDGD	
O=C(NCc1cccc(OCc2ccccn2)c1)NNC(=O)c1ccc(-n2cnnn2)cc1	916387176	GEIBOEVNXVKRLK-UHFFFAOYSA-N	444.455	1.781	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)NCc1ccc(N2CCO[C@H](C)C2)nc1	916392623	FGBLYWKHSKMUII-MRXNPFEDSA-N	427.505	1.779	50	20	IDGD	
CCOC(=O)N1CCC(NC(=O)CCCNC(=O)NNC(=O)c2ccc(CC)cc2)CC1	916638830	CAVVWSGZJBAGIO-UHFFFAOYSA-N	447.536	1.710	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2ccc3c(c2)S(=O)(=O)N(C(C)C)C3=O)cc1OC	916744730	XRITZPHGJBGNPY-UHFFFAOYSA-N	447.469	1.332	50	20	IDGD	
CN(CC(=O)NNC(=O)COc1ccccc1F)C(=O)c1ccc(Br)o1	917387553	AMYXXJWCSFSQBJ-UHFFFAOYSA-N	428.214	1.480	50	20	IDGD	
CCOCCCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	918218039	QBDBYMSFXZOHBB-UHFFFAOYSA-N	426.539	1.622	50	20	IDGD	
COc1ccc([C@H]2CCCN2C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1OC	918779493	XBATYNLPVIEJBE-QGZVFWFLSA-N	437.460	1.871	50	20	IDGD	
Cc1nc(Cc2ccc(F)cc2)sc1C(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1	919887300	ZMNFZXDEXZKCNV-ZDUSSCGKSA-N	426.495	1.313	50	20	IDGD	
CS(=O)(=O)Cc1nc2ccccc2n1CC(=O)NNC(=O)NCCc1cccs1	920861772	QZXPYMMSFVBQRR-UHFFFAOYSA-N	435.531	1.216	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)Nc2cccc(N3C(=O)CNC3=O)c2)c1C	920933572	WXUNMUCRBYWFBT-AWEZNQCLSA-N	425.445	1.980	50	20	IDGD	
O=C(Cc1ccc(S(=O)(=O)C(F)F)cc1)NNC(=O)c1cncn1-c1ccccc1	1116118224	BYXAJQYMUYDMIW-UHFFFAOYSA-N	434.424	1.872	50	20	IDGD	
NC(=O)COC1CCN(C(=O)NNC(=O)c2ccc(Br)cc2Cl)CC1	1319127603	LGITYUQZRUOCPO-UHFFFAOYSA-N	433.690	1.423	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2ccc(OC)c(S(=O)(=O)NC3CC3)c2)cc1	1320134330	WYRSGJYWWOEFDH-UHFFFAOYSA-N	434.474	1.611	50	20	IDGD	
Cn1nc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)c2c1CCC2	1777963348	QKRIRCPCIUKMCZ-RBUKOAKNSA-N	429.348	1.589	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc3nc(CO)[nH]c3c1)C2)[C@@H](F)Cl	1778025567	DUJOZIAFRCYWRM-WRWLIDTKSA-N	438.887	1.717	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)c3cc4c(s3)CCCC4)C2)C1	1778476123	JOJNWMQOZJTTIQ-QFIPXVFZSA-N	448.589	1.443	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(CCN(C(=O)c3cnc4snnc4c3)C2)C1	1780069341	QXTVOFKTMQKNMO-SFHVURJKSA-N	435.582	1.381	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)Cc3ccc(C(=O)OC)s3)CCO2)C1	1781218059	MNJHCOKQRFWEPQ-IFXJQAMLSA-N	428.938	1.925	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(S(C)(=O)=O)ccc3F)CCO2)C1	1781219939	SSMXFFHPLKZANF-BEFAXECRSA-N	446.928	1.690	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)Cc3cnc4ccccn34)CCO2)C1	1781225499	KSFUFVPGWKXCKO-WOJBJXKFSA-N	439.343	1.943	50	20	IDGD	
O=C(c1c[nH]c2nccc-2c1)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781331056	KGBDMTZUUXSTQR-GUYCJALGSA-N	425.258	1.649	50	20	IDGD	
COc1ccccc1CC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](C)Br)CCO2	1783330764	SNUFMEZSRAPQCI-IFXJQAMLSA-N	425.323	1.851	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)Cc3cccc(OC)n3)CCO2)C1	1783342080	GQIUHDLMTNHTPO-BEFAXECRSA-N	440.338	1.636	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(C)c(C(=O)O)c(C)c3)CCO2)C1	1783882836	QZIGWKSRRFKXLD-IERDGZPVSA-N	438.908	1.699	50	20	IDGD	
CCCOc1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc1	1783934589	DMXVWIIVYNYMCM-QHCPKHFHSA-N	446.548	1.292	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H]3[C@H]4COC[C@H]43)C2)C1	1784852423	QQBBXZHUTKVAGX-LTFLBFIOSA-N	443.450	1.594	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCC(=O)N3CCCC3)[C@H]2C1	1784996190	SQNNBNXMLKCZDT-FJIDUMEYSA-N	427.973	1.776	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)C2)C1	1785503723	OSYMXEUJMNOBFH-LWQICCLCSA-N	438.908	1.912	50	20	IDGD	
CN(C)c1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]32)nc1	1785749433	WLWQPEUKXPEOCS-NUADTHGBSA-N	443.375	1.977	50	20	IDGD	
Cc1cc(CC(=O)Nc2ccc(C3(NC(=O)c4ccc(B(O)O)cc4)CCC3)cc2)on1	1786722291	GGMCCNCPAKAFIR-UHFFFAOYSA-N	433.273	1.653	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cccc(Cl)n3)C[C@@H]21)[C@H](F)Br	1789922246	IVXMYYWAYTWPSQ-SDPXSBNPSA-N	448.720	1.948	50	20	IDGD	
COc1ccnc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]3C2)c1	1789924672	SGFRNEFEWRRKKG-HQRZJTNHSA-N	430.274	1.374	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccn4nccc34)[C@H]2C1	1790399366	KHBCJJWIFNZBQZ-IEZWGBDMSA-N	430.581	1.779	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C=C(\C)NC(C)=O)[C@H]2C1	1790560995	MDNYTJYHOYGBFF-XIPWXWJTSA-N	430.343	1.180	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)NC(=O)OC(C)(C)C)C[C@@H]21	1791250008	VSHXUGXMTVFPRI-QXKUPLGCSA-N	447.960	1.133	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1(c2ccccc2)CC1	1792601412	ANAJYENYTUVAHO-BCDXTJNWSA-N	433.512	1.669	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(C)(C)CCl	1792785521	BHTBDNPMDWWHQM-ZHCJQAHYSA-N	426.941	1.596	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H]1C=C[C@@H](C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](O)CCl)C1	1793111026	XZWOIURDMXKSTF-PHPOFCCKSA-N	441.956	1.694	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cn1cccn1)C2	1794142800	RVKYCSHOBAJEIA-FZKCQIBNSA-N	439.944	1.653	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(OC)n1	1794531825	YFBGCKBTHOAPAG-ZWUHOBOKSA-N	426.311	1.467	50	20	IDGD	
C=CC[C@@H](C(=C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1	1796442066	PPSVGOAMXIEQLX-NVQWDPAISA-N	441.532	1.478	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1c[nH]c2nccc-2c1Cl	1796670285	DDSLTHZABFZDLX-BTTYYORXSA-N	446.939	1.793	50	20	IDGD	
Cc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](O)CCl)C3)ccc1Br	1799026961	VLDUEYMKFXWOQN-XRGAULLZSA-N	445.741	1.560	50	20	IDGD	
CC(C)c1nc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@](C)(Cl)CCl)no1	1799273603	DAPGBHXBBKMZTJ-TYYYEBLRSA-N	433.336	1.561	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CNc1ccc(F)cc1)C2)[C@H](F)Br	1799346094	BFVAVQQZNJFSMC-OJXGSEEGSA-N	432.265	1.518	50	20	IDGD	
COC(C)(C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN(C)NC(=O)NCc1ccccc1	1799865615	DNCHYZZGTHNDLC-REPLKXPHSA-N	445.564	1.396	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2)C1CCN(c2ccc(F)cn2)CC1	1800290169	JYZLXKMEXSDCMO-DACLVMHWSA-N	442.894	1.561	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)n1cc(C)cn1)C2	1800644323	PNKJZFQYNFDGSR-IBEHDNSVSA-N	427.343	1.516	50	20	IDGD	
Cc1cc2[nH]c(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)c3cccc(B(O)O)c3)C4)cc2s1	1800955893	LDBCFJXWDSPLBD-BJWYYQGGSA-N	437.330	1.783	50	20	IDGD	
Cc1cc2nc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)CCC(=O)NN(C)C)[nH]c2cc1C	1802337088	FTXRAWDETBIBGK-BJWYYQGGSA-N	440.548	1.805	50	20	IDGD	
O=C(/C=C/c1ccco1)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1804614938	QAAWGODSWHIAEZ-GPEVBYCZSA-N	445.284	1.387	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)c1cc(O)nc(Cl)c1	1805031699	GQTVZABBCKYAKP-DXCKQFNASA-N	439.299	1.755	50	20	IDGD	
Cn1nc(C(=O)N2CC[C@H](CNC(=O)CCBr)[C@@H]2c2cccnc2)cc1O	1806338472	AIBVTOQROKIKRS-DYVFJYSZSA-N	436.310	1.625	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)CC2CCOCC2)[C@H]1c1cccnc1	1806935689	HLRXJDRZULTJKQ-WMZHIEFXSA-N	445.564	1.277	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)C(=O)N(C)C)[C@H]1c1cccnc1	1806946728	PYMQQZQZNFXXSG-SOUVJXGZSA-N	425.327	1.349	50	20	IDGD	
Cc1cncc(CCC(=O)N2CCCC3(CCN(C(=O)c4cccc(B(O)O)c4)CC3)C2)c1	1807035665	JTAHTBANXMUMGW-UHFFFAOYSA-N	449.360	1.547	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1CCN(C(=O)[C@H]2CCC(=O)N2)[C@@H]1c1cccnc1	1808296575	SCGWNIVGEBFRFR-ZDXGLAPJSA-N	427.332	1.602	50	20	IDGD	
CCOC(=O)N[C@H](O)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](Cl)CC)[C@H]1c1cccnc1	1810100424	SNZCOTQIKRONRP-QBYUYEEZSA-N	426.901	1.169	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@H]1CCN(C(=O)CCSC(=N)N)[C@@H]1c1cccnc1	1810542526	ZPRZJGNIXAMUGJ-CRAIPNDOSA-N	437.642	1.956	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)C2CCSCC2)[C@@H]1c1cccnc1	1813074517	SOMBKJAMFGPYGO-WIYYLYMNSA-N	447.605	1.604	50	20	IDGD	
O=C1NCc2cc(C(=O)N3CCCC[C@@H]3c3cc(NC(=O)[C@H](O)CCl)n[nH]3)ccc21	1814872379	HINBJRRQMHFOMC-HZPDHXFCSA-N	431.880	1.559	50	20	IDGD	
CN[C@H](CC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](C)CBr)CC2)C(=O)O	1815073851	YCOFHKACXONGCG-ATZCPNFKSA-N	447.355	1.149	50	20	IDGD	
C=CC(=O)N[C@@H](C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCBr)n[nH]1	1816782573	VGJZHBMAOXICLF-WCQYABFASA-N	426.315	1.878	50	20	IDGD	
O=C(CN1CCCC1=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](F)Br)[nH]n1	1817160021	PLYZOBHJPWWVFA-IAQYHMDHSA-N	430.278	1.715	50	20	IDGD	
O=C(N[C@H]1CCc2nc(NC(=O)c3ccc(Cl)o3)sc2C1)c1cccc(B(O)O)c1	1817918364	FUCKHBVLULXUII-LBPRGKRZSA-N	445.693	1.609	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H]2C=CCN2)n[nH]1	1817983624	HCKKFWKBFGXCOG-YIDGYCTFSA-N	438.492	1.064	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnncc2C(=O)O)n[nH]1	1819763181	GRQDRJFSKAINDE-TZMCWYRMSA-N	436.856	1.458	50	20	IDGD	
CN(C)C(=O)NCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@](C)(Cl)CCl)n[nH]1	1820863506	ZZDAYFJZEADKTL-SJKOYZFVSA-N	433.340	1.909	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN2CCOCC2)[nH]n1	1820864206	SQQLCWOCWIUZKL-KBXCAEBGSA-N	432.352	1.970	50	20	IDGD	
C[C@H](C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](F)Br)n[nH]1)n1ccnn1	1820936400	BQWFWSWKCIEROY-SUZMYJTESA-N	428.266	1.945	50	20	IDGD	
COCCn1nccc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H](O)CCl)CC1	1824183548	YYCIPGABVMTSRZ-FUHWJXTLSA-N	426.945	1.363	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@H](O)CCl)CC1	1824186008	NLZPQRQBRCGYKI-WJFTUGDTSA-N	440.968	1.961	50	20	IDGD	
Cc1nc(CC(=O)N2CCCC[C@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)cs1	1825202237	HYJWJJZTVQHTNQ-IBGZPJMESA-N	449.621	1.987	50	20	IDGD	
CCc1cc(C(=O)N[C@@H]2CCc3nc(NC(=O)[C@@H](Cl)COC)sc3C2)nn1C	1826003603	OECYWQWIDJXTCE-PWSUYJOCSA-N	425.942	1.919	50	20	IDGD	
Cc1noc(C)c1CC(=O)N[C@@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1	1826083949	VTLVEXIZLHKMJM-CYBMUJFWSA-N	448.549	1.276	50	20	IDGD	
O=C(C[C@H]1CCCCO1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827050040	FFLLEPAHROJERV-YADHBBJMSA-N	442.365	1.559	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@H]2CCCOC2)CC1	1828925579	LWMFOLAYHFQPQU-PXNSSMCTSA-N	443.548	1.345	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc4[nH]ncc4c3)C2)C1	1830362200	NZSJRNVZKZSULO-FQEVSTJZSA-N	435.912	1.293	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3F)C2)C1	1830538834	RHIKZLXLPDOKQJ-UGSOOPFHSA-N	444.301	1.322	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)n3cccc3C=O)C2)C1	1831647801	YYKNTRUOSSXMDU-PLMTUMEDSA-N	439.940	1.726	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)/C=C\C(=O)NC2CC2)CC1	1831831326	UUDAFSRVTPRKIG-OPDSQHBBSA-N	425.957	1.695	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1	1831834527	DIXVKJRFDYSOHS-SJORKVTESA-N	430.977	1.233	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3noc(C)c3C)CCO2)C1	1831984220	FKKPWCYXSAZQLT-RDTXWAMCSA-N	444.326	1.535	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CN2C(=O)C=CC2=O)CC1	1831986435	RTXXVFAFOXTGCI-YWZLYKJASA-N	444.359	1.767	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)c1ccccc1)CCO2	1832232272	OQZQWLJKNMZLRC-GMBSWORKSA-N	443.313	1.937	50	20	IDGD	
CCN(C)[C@H](C)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](C)CBr)CC2)CC1	1833265009	UXSCYMBBKGSYLP-JKSUJKDBSA-N	445.446	1.929	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnc(C)nc3)CCO2)C1	1833817057	IJDIZVGBKRDYKT-CRAIPNDOSA-N	441.326	1.029	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)[C@H]3CCC(F)(F)C3)C2)C1	1834818982	CAOZOZARENLRTK-XJKSGUPXSA-N	439.297	1.663	50	20	IDGD	
Cc1cccc(/C=C/C(=O)N2CCOC[C@]3(C2)CN(C(=O)CO[Si](C)(C)C)CCO3)n1	1837709337	YIXBEIOYLHVHIW-UVIRAJKCSA-N	447.608	1.711	50	20	IDGD	
O=C(c1cc(-c2ccccn2)[nH]n1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1838050630	VAFGZFDWSSAWFA-LPHOPBHVSA-N	437.859	1.076	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cn(C(C)(C)C)nn3)CCO2)C1	1838752831	GZJDEYKRVJHJJS-HXUWFJFHSA-N	441.960	1.368	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(C)c(OC)c3)CCO2)C1	1838988890	UITBCHLLOQSXTJ-UTKZUKDTSA-N	440.924	1.327	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3CC(c4ccccc4)=NO3)C2)C1	1839141788	SISNNWOEKHNREK-JLMWRMLUSA-N	449.935	1.653	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccc(F)c(F)c3)C2)C1	1839143216	OTUUCVCNSMQVEG-QRWLVFNGSA-N	430.879	1.981	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(C4CC4)cc3)CCO2)C1	1839441455	VRXSBCGCJJBHAC-KNQAVFIVSA-N	436.936	1.888	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccccn3)C2)C1	1839963164	BOSFHZLDKKYWIR-RDTXWAMCSA-N	426.311	1.325	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(C)n3)C2)C1	1839963573	OJVCHVBUIRMVPP-HNAYVOBHSA-N	440.338	1.634	50	20	IDGD	
COc1ncccc1CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840186198	GBLNWWGPWSYGMD-IBGZPJMESA-N	446.331	1.283	50	20	IDGD	
C[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1)c1ccccn1	1840503931	PHSIEEBNJVGJSJ-YSSFQJQWSA-N	444.359	1.878	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3ccccc3F)CCO2)C1	1840547817	WWZMGJRYIQCZPG-UWJYYQICSA-N	442.915	1.469	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)cc(C)c1O	1840677196	UDRXGPDMWZBUGZ-IBGZPJMESA-N	431.316	1.883	50	20	IDGD	
O=C(c1cn2cc(Br)ccc2n1)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1	1841351227	JLCQUOKBHXIYKQ-CYBMUJFWSA-N	441.713	1.514	50	20	IDGD	
CCOC(=O)/C=C/C(=O)N1CCCC12CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2	1842626130	WYTYTPQBHZKHTP-BQYQJAHWSA-N	445.428	1.456	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)CCOc1ccccc1)C2	1843415608	QEIVXESAAVGDOH-KOEQRZSOSA-N	437.500	1.793	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)[C@H]2CC[C@@H](C)O2)C1	1843881604	OGHVBCYYNKGXGQ-FZKQIMNGSA-N	431.445	1.905	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)Cc2c(F)cccc2F)C1	1844962714	HLRXYZIPZOINDX-UHFFFAOYSA-N	429.427	1.023	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCCC12CN(C(=O)[C@@H]1CCc3nc(O)nc(O)c3C1)C2	1845169384	FXZPIMBKXLMPFI-ZMZPIMSZSA-N	443.331	1.432	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@H]2C[C@H]3C[C@H]3N2C(=O)OC(C)(C)C)C1	1847083054	ICNZZSSOYAKESA-FPCVCCKLSA-N	441.956	1.842	50	20	IDGD	
O=C(c1csc(-n2ncc3ccccc32)n1)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl	1847556786	OCAQFIBRTJOOSL-ULQDDVLXSA-N	445.932	1.897	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](CC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](O)CCl)C1	1847568299	RHHLPIXJDPDNQO-QZWWFDLISA-N	443.972	1.825	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)C1CCN(c2cc(OC)ncn2)CC1	1847669297	CHANAISAQBWMHK-IKGGRYGDSA-N	435.956	1.921	50	20	IDGD	
CCOC(=O)c1cc(C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc([N+](=O)[O-])c1	10158747	OXSSVHOCMWCLCQ-UHFFFAOYSA-N	439.384	1.738	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)CCNC(=O)c2ccc(Br)cc2)cc1	15888629	OOMFRPAYBYIDRB-UHFFFAOYSA-N	445.273	1.667	50	20	IDGD	
O=C(CSc1nnc(N2CCOCC2)n1-c1ccccc1)NNC(=O)c1ccccc1	17277871	GTQMPTBTYYZVSP-UHFFFAOYSA-N	438.513	1.657	50	20	IDGD	
Cc1ccc([C@@]2(C)NC(=O)N(CC(=O)NNC(=O)c3cc(Br)c[nH]3)C2=O)cc1	24122609	ZYVKWBLVEFURKY-GOSISDBHSA-N	448.277	1.314	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1Cc2c(OC)ccc(OC)c2[C@@H](O)C1	26159816	AIJKMWJWNTVNJR-HNNXBMFYSA-N	449.891	1.676	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CCC(=O)c2ccc3c(c2)OCCO3)cc(OC)c1OC	26687475	FJKFURGAUZRMHP-UHFFFAOYSA-N	444.440	1.908	50	20	IDGD	
Cc1ccc(-n2nnnc2SCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c(C)c1	36640826	QHISSNDGUMMSFT-UHFFFAOYSA-N	427.446	1.741	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2ccc(OC[C@@H]3CCCO3)cc2)n1	105213218	FCELUFNWJACWQA-INIZCTEOSA-N	433.486	1.556	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)c2cc(S(=O)(=O)NC3CC3)ccc2C)o1	109008046	OQQSLPXNHNPXPX-UHFFFAOYSA-N	448.545	1.945	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NC[C@H](c1ccc(F)cc1)N1CCOCC1	726084777	UOEBFARXGFVKJN-MRXNPFEDSA-N	449.508	1.021	50	20	IDGD	
Cc1nc(C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)nn1-c1ccc(F)cc1	726862560	SZZPHBDOKHHYNX-UHFFFAOYSA-N	430.465	1.912	50	20	IDGD	
C#Cc1cccc(NC(=S)NNC(=O)c2cc(OC)c(OCC(N)=O)c(OC)c2)c1	727501293	QQTHRSGQFZJVKG-UHFFFAOYSA-N	428.470	1.181	50	20	IDGD	
CN1CCN(C[C@H](NC(=O)NNC(=O)COc2ccccc2F)c2ccccc2)CC1	727843806	UTDVMMZDGDBZPY-IBGZPJMESA-N	429.496	1.524	50	20	IDGD	
CN(CCOc1cccc(CNC(=O)NNC(=O)CC(F)(F)F)c1)C1CCOCC1	728135014	RTXSCSUAVPFYRS-UHFFFAOYSA-N	432.443	1.959	50	20	IDGD	
COc1cccc2c1OCC(C(=O)OCC(=O)NNC(=O)[C@H]1COc3ccccc3O1)=C2	728343272	DDPLZSTUIIQGKJ-GOSISDBHSA-N	440.408	1.002	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNS(=O)(=O)c1cc(Br)c(F)cc1F	728506748	FAAVERQMMFWAQU-UHFFFAOYSA-N	438.206	1.060	50	20	IDGD	
COc1ccccc1C(=O)N[C@H](CCSC)C(=O)NNC(=O)c1cccc(C#N)c1	728872846	QLQXJKAXXZBIQE-QGZVFWFLSA-N	426.498	1.880	50	20	IDGD	
CCN(C[C@@H]1COc2ccccc2O1)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	728960412	YIPNOOMVGLOUEB-QGZVFWFLSA-N	440.504	1.596	50	20	IDGD	
CCC[C@H](C)NS(=O)(=O)c1cc(C(=O)NNC(=O)c2cnn[nH]2)c(Cl)cc1Cl	729455956	ILVUSXZNKKLCMR-QMMMGPOBSA-N	449.320	1.653	50	20	IDGD	
COCCN1CCC[C@H](NC(=O)CCC(=O)C(C#N)=C2N(C)c3ccccc3N2C)C1	729982737	GRHNMLOWHBADFK-KRWDZBQOSA-N	425.533	1.884	50	20	IDGD	
CN(CCN1CCN(CC(=O)NNC(=O)c2ccc(F)cc2)CC1)Cc1ccccc1	731212626	AEYCFFOWALWAGQ-UHFFFAOYSA-N	427.524	1.336	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2nn(-c3ccc(F)cc3)ccc2=O)cc(OC)c1OC	731571210	HHBRZEDDBOQTKK-UHFFFAOYSA-N	442.403	1.472	50	20	IDGD	
CC(C)[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1cc(-c2ccco2)nc2ccccc12	733251045	OBRVTBYDBBPOPX-SFHVURJKSA-N	430.486	1.830	50	20	IDGD	
O=C(NNc1cnccn1)c1ccccc1NS(=O)(=O)c1ccc2c(c1)OCCO2	734244561	MXSXIHKVYDNHHI-UHFFFAOYSA-N	427.442	1.806	50	20	IDGD	
Cc1c(C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)cnn1C(C)(C)C	735117519	VNSIOLMJGIJFMN-UHFFFAOYSA-N	435.554	1.035	50	20	IDGD	
CN(CC(=O)NNC(=O)c1ccc(Cl)cc1O)S(=O)(=O)c1cccc([N+](=O)[O-])c1	738512666	FAWAOIDVMNWIGG-UHFFFAOYSA-N	442.837	1.036	50	20	IDGD	
O=C(CCc1ccccc1O)NNS(=O)(=O)c1cccc(I)c1	739668900	YKFGCSBXOWRTPA-UHFFFAOYSA-N	446.266	1.939	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)COc1ccccc1C#N)[C@@H]1CN(Cc2ccccc2)CCO1	741426177	QAUMINGSKNRUBG-UWJYYQICSA-N	437.500	1.557	50	20	IDGD	
CC(C)c1nn([C@H]2CCS(=O)(=O)C2)cc1C(=O)NNC(=O)NCCc1cccs1	742584275	XUKRQHVNJZJKMK-ZDUSSCGKSA-N	439.563	1.614	50	20	IDGD	
CC1(C)C(=NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)[C@@H]2CCCO[C@@H]21	743423830	XTISLISJEZOZBW-RXVVDRJESA-N	449.573	1.947	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2cccc3ccccc23)cc1	743501671	PNERROAHNCXDNH-UHFFFAOYSA-N	425.466	1.782	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)NC3CCCC3)CC2)cc1	744060716	WVGPAKWZSIRFEK-UHFFFAOYSA-N	438.550	1.759	50	20	IDGD	
COc1cccc(NC(=O)CSc2ccccc2C(=O)NNC(=O)C(=O)NC(C)C)c1	744446568	DHOWXIZYJUBMCI-UHFFFAOYSA-N	444.513	1.712	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)N[C@H](CN1CCOCC1)c1ccccc1	745359428	KTJZPDOVLGBVKX-QGZVFWFLSA-N	429.433	1.318	50	20	IDGD	
C[C@@H](CCc1cccc(F)c1)C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	745585714	SYTLABQACFDGDF-LIRRHRJNSA-N	430.432	1.925	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)N[C@@H]2CC(=O)N([C@H]3C[C@H]3c3ccccc3)C2)cc1	745914072	HQZASSXTLAQBDK-HOJAQTOUSA-N	433.468	1.424	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN1C(=O)NCc1cccc(Br)c1)c1ccccn1	746091631	GIANMXMEARVQNG-INIZCTEOSA-N	446.305	1.979	50	20	IDGD	
CCS(=O)(=O)N1CCN(C(=O)/C(C#N)=C\c2cc(C)n(C[C@@H]3CCCO3)c2C)CC1	748055255	OXNROXQSTDVMGG-DTBYZMGXSA-N	434.562	1.685	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(OCC(=O)NNC(=O)c2cccc(Br)c2)C1	748545942	CPTJSBLLIMDZSB-UHFFFAOYSA-N	428.283	1.846	50	20	IDGD	
COCCOCC(=O)NC1CCC(C(=O)NNC(=O)c2cc(Cl)ccc2O)CC1	748831360	QKLMBAQKNRBDJT-UHFFFAOYSA-N	427.885	1.145	50	20	IDGD	
O=C(NNC(=S)Nc1ccccn1)[C@H]1CC(=O)N(CCOc2ccccc2Cl)C1	752313992	FJRCOFSQPKXOKS-ZDUSSCGKSA-N	433.921	1.980	50	20	IDGD	
Cc1noc(C)c1[C@H](C)CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	752699834	IEQOPZFAOLNOFQ-CYBMUJFWSA-N	449.533	1.824	50	20	IDGD	
CC(C)(C)OC(=O)Nc1nc(Cl)ccc1C=NNC(=O)N[C@@H]1CCS(=O)(=O)C1	754941464	HFPQCZUVCBIBRE-LLVKDONJSA-N	431.902	1.902	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)NCc1cn(-c2ccccc2)nn1	755218626	HLWIRIKHPLTKPR-UHFFFAOYSA-N	445.277	1.939	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)Nc1ccc(CC(=O)N2CCOCC2)cc1	755861602	GUHRXCHRRJENBZ-UHFFFAOYSA-N	430.436	1.459	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)Nc1cccc(N2CCS(=O)(=O)CC2)c1	756205138	DMFQQPNZYYIKSK-UHFFFAOYSA-N	448.501	1.162	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)cc1	756207599	TWRNXZUYHVRVBJ-UHFFFAOYSA-N	448.501	1.162	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)NCCCN(C2CC2)S(=O)(=O)c2cccc(F)c2)o1	757048896	DZUCSVLYBBNFAY-UHFFFAOYSA-N	438.481	1.915	50	20	IDGD	
CC(C)[C@H](C(=O)NNc1nc(-c2ccccn2)nc2c1CCC2)N1CCCS1(=O)=O	758286507	VETRHWSEFUWHED-QGZVFWFLSA-N	430.534	1.531	50	20	IDGD	
O=C(NNc1nc(O)c2ccccc2n1)c1ccc2c(c1)C(=O)N(C[C@H]1CCCO1)C2=O	758299032	AGUUXZMUXUHXJY-CYBMUJFWSA-N	433.424	1.867	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)Nc2ccc(CN3C(=O)CCCC3=O)cc2)c1O	760953599	FEHPQTGZGYJPGY-UHFFFAOYSA-N	426.429	1.906	50	20	IDGD	
CCOC(=O)[C@H]1CCC(=NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)[C@H](C)C1	761267771	UJIMUFQPIXACRU-MJGOQNOKSA-N	428.533	1.916	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)N[C@@H]2CCN(C(=O)CC)C2)c2ccccc2c1=O	762374571	CJVZYUCPIZMWSU-OAHLLOKOSA-N	442.520	1.542	50	20	IDGD	
CN(C)CCOc1cc(CNC(=O)NNC(=O)c2cc(Br)c[nH]2)ccn1	762528901	PBBIGEDVJHLJBK-UHFFFAOYSA-N	425.287	1.257	50	20	IDGD	
C[C@@H]1C[C@@H](C)CN(C(=O)c2ccccc2NC(=O)C(=O)NNC(=O)c2ccccc2O)C1	763526659	DXEBRZIVQDFTTH-HUUCEWRRSA-N	438.484	1.910	50	20	IDGD	
CCOC(=O)N(C)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(OC)c(OC)c2)cc1	763550364	KVCYHFCAKRFXQV-UHFFFAOYSA-N	444.444	1.696	50	20	IDGD	
CCCCOC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1	763575632	ZYHIAYNCFBETOU-GOSISDBHSA-N	441.440	1.569	50	20	IDGD	
COc1ccc(NC(C)=O)cc1NC(=O)C(=O)NNC(=O)COc1ccc(Cl)cc1	763693591	AOALZSXRYONQQH-UHFFFAOYSA-N	434.836	1.472	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(C(=O)NC(C)C)cc1C	763713905	RGXHDIGBXOHPAA-UHFFFAOYSA-N	440.500	1.861	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2nc(-c3nccn3C)cs2)c1C	763853305	YGCIZPZPFNQBQT-ZDUSSCGKSA-N	442.501	1.714	50	20	IDGD	
COC(=O)c1c(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)sc(C)c1C	763865002	NAAAJHIQIAHWNK-SNVBAGLBSA-N	437.449	1.844	50	20	IDGD	
CO[C@H]1Cc2ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc3ccc(C(C)=O)cc3)cc2C1	763871153	DWHBXKKTCTXPHA-VLIAUNLRSA-N	439.468	1.556	50	20	IDGD	
CCOC(=O)c1c(C)csc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccc(F)cc1	763873857	ZPCDRVSIWKUZSC-NSHDSACASA-N	437.449	1.926	50	20	IDGD	
NC(=O)c1n[nH]c2ccc(NC(=O)C(=O)NNC(=O)CCSc3ccc(F)cc3)cc12	763901029	FNFUEAHUULJYPA-UHFFFAOYSA-N	444.448	1.069	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)C(=O)Nc1cccc(I)c1	763918283	AMDLSEIIZBRAKJ-UHFFFAOYSA-N	441.200	1.759	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2c(C)nn(C)c2-n2ccnc2C)c2ccccc2c1=O	763927424	IPMUAHHOQKRIFB-UHFFFAOYSA-N	448.487	1.417	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3ccc(S(C)(=O)=O)nc3)cc2C1	763941988	LJDAIYQGAIIHRP-JTQLQIEISA-N	436.515	1.071	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)C(=O)Nc1cccc(OC(F)F)c1	763943277	CGGJYXDLBQKQAS-UHFFFAOYSA-N	431.355	1.579	50	20	IDGD	
CO[C@@H]1Cc2ccc(NC(=O)C(=O)NNC(=O)c3nn(-c4ccccc4)cc3O)cc2C1	763947957	HDXOKMJCVJQRHL-QGZVFWFLSA-N	435.440	1.091	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)c[nH]1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl	763995871	AMDOUCWLOYJJBW-UHFFFAOYSA-N	430.602	1.739	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1ccc(N2CCOCC2)nc1C	764012330	OGDKTUPKFCKTOQ-UHFFFAOYSA-N	447.879	1.288	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(C)cc3)[nH]n2)ccc1C	764112344	WDWYTUWYQWWVSZ-UHFFFAOYSA-N	435.440	1.880	50	20	IDGD	
COC(=O)c1cc2cc(NC(=O)C(=O)NNC(=O)c3ccc(Cl)cc3O)ccc2o1	764116999	LYEYOFCBXAVPMN-UHFFFAOYSA-N	431.788	1.978	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2ccccc2N2CCOC2=O)cc1	764125387	WNUUFMPILZHOSJ-UHFFFAOYSA-N	426.429	1.371	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2cccc(CN3CCCCC3)c2)c1O	764131002	DBCDVBLDLMOGLZ-UHFFFAOYSA-N	426.473	1.786	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2O1)C(=O)Nc1ccc(-c2ncc3n2CCCC3)cc1	764169015	RVYQVOIMBLLORN-HXUWFJFHSA-N	445.479	1.976	50	20	IDGD	
O=C(NNC(=O)c1cccc(OC(F)F)c1)C(=O)Nc1ccn(-c2ncccc2F)n1	764253245	OAHLEURRGNSLLG-UHFFFAOYSA-N	434.334	1.408	50	20	IDGD	
O=C(Cc1ccccn1)NNC(=O)C(=O)Nc1cccc(OCC(=O)Nc2ccccc2)c1	764267344	UCFWFPWKCKWVLH-UHFFFAOYSA-N	447.451	1.428	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(Br)ccc2O)cc1	764278069	RAFOLCZNHAEALY-UHFFFAOYSA-N	436.218	1.341	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1ccc(-n2cccn2)c(Cl)c1	764278497	QPKZOEQOBTWATM-UHFFFAOYSA-N	429.820	1.396	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccccc2-n2c(C)cnc2O)c(OC)c1	764286594	NBABZYUACNIBSR-UHFFFAOYSA-N	439.428	1.303	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)C(=O)Nc1ccc(C(=O)N2CCCC[C@@H]2C)c(Cl)c1	764295759	QLUKYZHLFYVJEP-NSHDSACASA-N	446.895	1.786	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(C(=O)N3CCSCC3)c2C)o1	764371153	IDUWYAKTZCQPPI-UHFFFAOYSA-N	430.486	1.485	50	20	IDGD	
COc1cccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(OC)c(OC)c3)[nH]n2)c1	764378076	IYZXPGMHPSAMMO-UHFFFAOYSA-N	439.428	1.502	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc4c(c3)NC(=O)CC4)n[nH]2)cc1	764385100	RECRDIOYDBFCCV-UHFFFAOYSA-N	446.467	1.924	50	20	IDGD	
CCCCN(C)S(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ncccc2C)cc1	764386282	DNGKISWTJCMQEC-UHFFFAOYSA-N	447.517	1.210	50	20	IDGD	
Cc1ccc(-c2nnco2)cc1NC(=O)C(=O)NNC(=O)CSc1ccccc1O	764400803	HWKCAIGLOQLAES-UHFFFAOYSA-N	427.442	1.629	50	20	IDGD	
NC(=O)CCSc1ccccc1NC(=O)C(=O)NNC(=O)CSc1ccccc1O	764402322	YXUAFZXBNHUMPU-UHFFFAOYSA-N	448.526	1.238	50	20	IDGD	
COc1ccccc1N1C[C@H](C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)CC1=O	765564607	GQXWVZGYDZNCGV-GFCCVEGCSA-N	425.470	1.961	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)CC3(CS(C)(=O)=O)CC3)n[nH]2)cc1OC	765600271	RRBCEMUTXPWBLK-UHFFFAOYSA-N	436.490	1.070	50	20	IDGD	
CC(C)c1ncncc1C(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	766664861	WFCVGNULKOUUEU-UHFFFAOYSA-N	430.940	1.832	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)c2ccn(-c3ccc(F)cc3F)n2)c1	766826693	OEMMYKMFOAXAPO-UHFFFAOYSA-N	425.351	1.640	50	20	IDGD	
CC(C)CN1N=C(C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)CCC1=O	766967026	KMJGBZPRHJPSDD-UHFFFAOYSA-N	426.477	1.373	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(OC(F)F)n(C)n2)c1	767046915	ZKGLHFNRRQCLNP-UHFFFAOYSA-N	445.448	1.127	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)CN3C(=O)[C@@H]4[C@H]5C=C[C@@H](C5)[C@H]4C3=O)n[nH]2)cc1	768268736	UHQZHWXHBQZXBO-IQGAEYHTSA-N	433.468	1.207	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)[C@@H](C)NC(=O)C3CCCC3)n[nH]2)cc1OC	768279458	PCLDZZJXZWFEKE-GFCCVEGCSA-N	429.477	1.550	50	20	IDGD	
CC(C)Cc1nnc(NC(=O)CCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)s1	769464772	YXGTUOPZUPUVJF-CQSZACIVSA-N	433.490	1.443	50	20	IDGD	
COC(=O)c1cc(F)c(C)c(S(=O)(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)c1	769867926	COUWCWBNFGMSMD-UHFFFAOYSA-N	427.366	1.158	50	20	IDGD	
CN(NC(=O)c1cccc(NC(=O)C[C@@H]2SC(N3CCCCC3)=NC2=O)c1)C(N)=O	770537131	VZVMZBBPWOPFEX-AWEZNQCLSA-N	432.506	1.154	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)c1ccc(CS(=O)(=O)c2ccccc2)o1	771927313	HOTXRWDMSZMXTK-AWEZNQCLSA-N	436.486	1.992	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1ccc(Cl)c(S(=O)(=O)NC(C)(C)C)c1	771941740	BCFUONQRFBREPV-JTQLQIEISA-N	433.914	1.520	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)[C@@H]1CCCN1C(=O)Cc1cccs1	772893349	WBLYGTGPADFYQG-INIZCTEOSA-N	448.932	1.399	50	20	IDGD	
C[C@H]1CN(C(=O)Cn2cc(NC(=O)C(=O)NNc3cccc(Cl)c3)cn2)C[C@@H](C)O1	773745122	VHGXLBOAZVKGGJ-BETUJISGSA-N	434.884	1.254	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NN=C1C(=O)Nc2c(F)cc([N+](=O)[O-])cc21	774308242	AWZVHYDSBPPFLC-UHFFFAOYSA-N	440.435	1.719	50	20	IDGD	
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	775686106	CPIGAVYBJHOYAQ-UZLBHIALSA-N	425.489	1.856	50	20	IDGD	
CC(C)CS(=O)(=O)N1CCC(NC(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)CC1	777766847	BEMNXMHQNCLQJY-UHFFFAOYSA-N	440.610	1.983	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@H](CC(=O)NNC(=O)c2csc(N3CCOCC3)n2)C1	777775438	NIDRECCFIYUQTD-ZDUSSCGKSA-N	439.538	1.388	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)Cn2c(S)nnc2-c2ccc(C)cc2)nc1C	778427243	WMUWIMRMMQLHMW-UHFFFAOYSA-N	427.490	1.961	50	20	IDGD	
COc1ccc(Cn2cc(C(=O)OCC(=O)NNC(=O)c3cccs3)cn2)cc1OC	778464782	TTXONNGZEGXJBA-UHFFFAOYSA-N	444.469	1.628	50	20	IDGD	
COc1cc(OC)c(NC(=O)C(=O)NNC(=O)Cc2ccncc2)cc1Br	778711199	DKNYWSVMRMRBHW-UHFFFAOYSA-N	437.250	1.190	50	20	IDGD	
O=C(NCCNC(=O)c1cc[nH]n1)NNC(=O)c1ccc(Br)cc1Cl	780008027	RTFMCNZBCUIWQE-UHFFFAOYSA-N	429.662	1.200	50	20	IDGD	
Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCC(C(=O)NNc2ccnc(F)c2)CC1	781365483	QPAOYXBHPLAKBG-UHFFFAOYSA-N	437.453	1.981	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)c(OC)cc1Cl	782895042	WRRTUMYIOOXHMX-UHFFFAOYSA-N	445.863	1.573	50	20	IDGD	
CN1CCN(Cc2cccc(NC(=O)C(=O)NNc3ncccc3C(F)(F)F)c2)CC1	783121671	SKZXISFFDUAJJB-UHFFFAOYSA-N	436.438	1.930	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NN=c2sc3ccccc3n2C)ccc1N1C(=O)CCC1=O	783349698	OOJDYIPRCYZKAA-UHFFFAOYSA-N	437.481	1.772	50	20	IDGD	
O=C(NNc1ccnc(Br)c1)C(=O)Nc1cccc(-c2nnnn2C2CC2)c1	784837330	MVDSMOMJPNCSFF-UHFFFAOYSA-N	443.265	1.914	50	20	IDGD	
CN1CCN(C(=O)Cc2ccc(NC(=O)C(=O)NNc3cccnc3Cl)cc2)CC1	784839048	HPRCEAHVUDGLQV-UHFFFAOYSA-N	430.896	1.133	50	20	IDGD	
CCOc1cc(C(=O)N(C)C)ccc1NC(=O)C(=O)NNc1cccc(C(=O)OC)c1	784854802	NMXHWWQANZIPFF-UHFFFAOYSA-N	428.445	1.656	50	20	IDGD	
COC(=O)CNC(=O)c1ccc(NC(=O)C(=O)NNc2nc(C(F)(F)F)cs2)cc1	785147167	ATXADSTWEBTSIC-UHFFFAOYSA-N	445.379	1.147	50	20	IDGD	
O=C(Cc1cccc(N2CCCC2=O)c1)N1CCN(S(=O)(=O)CBr)CC1	787496561	WQCUIOORWSPZDT-UHFFFAOYSA-N	444.351	1.182	50	20	IDGD	
Cc1ccccc1NC(=O)NNC(=O)C(=O)Nc1ccc(C)c(C(=O)N2CCOCC2)c1	787557089	UODOKINJHYRBHP-UHFFFAOYSA-N	439.472	1.567	50	20	IDGD	
COc1cc(-n2cnnn2)c(Cl)cc1C(=O)NNc1nnc(-c2ccccn2)s1	788558021	GKFPWQFDCBUPOS-UHFFFAOYSA-N	429.853	1.995	50	20	IDGD	
Cn1nc(-c2ccc(F)cc2F)cc1NC(=O)C(=O)NNc1cccc(S(C)(=O)=O)c1	789726818	OGVOHVCKISUBKX-UHFFFAOYSA-N	449.439	1.851	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)[C@@H](C)NC(=O)c1ccc(Br)s1	790063305	HIVGFSGVDGBBDA-SECBINFHSA-N	436.328	1.566	50	20	IDGD	
CCS(=O)(=O)c1ccc(N2CCC(NC(=O)NNc3nc4ccccn4n3)CC2)cc1	790259433	DVZABFYKUDDRGP-UHFFFAOYSA-N	443.533	1.818	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc2c1CCN(C(=O)NNC(=O)c1ccc(C#N)cc1)C2	790691698	KSXHKYKAALGJNA-UHFFFAOYSA-N	427.486	1.221	50	20	IDGD	
Cc1ccc(N2N=C(Br)C[C@H]2C(=O)N([C@@H]2CCS(=O)(=O)C2)N(C)C)cc1	792855785	SYWPPRAGYSFPHH-CABCVRRESA-N	443.367	1.774	50	20	IDGD	
COc1ccc(Cn2cc(NC(=O)C(=O)NNC(=O)COc3ccc(C)cc3)cn2)cc1	793021233	ADENHUYQILBUKZ-UHFFFAOYSA-N	437.456	1.413	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)NC2CCCCC2)(S(C)(=O)=O)CC1	794764350	WGWRHANXEFNHSE-UHFFFAOYSA-N	446.570	1.464	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CCCS(=O)(=O)c2ccc(Cl)cc2)cc1	794804338	CUEPGYORDSCNCB-UHFFFAOYSA-N	437.905	1.988	50	20	IDGD	
CC(C)Oc1ccc(NC(=O)C(=O)NN=c2sc3ccccc3n2C)cc1C(N)=O	797047142	TWSHCZAJCVTOFJ-UHFFFAOYSA-N	427.486	1.697	50	20	IDGD	
CO[C@H](C)C(=O)Nc1cccc(NC(=O)NNC(=O)CNC(=O)OCc2ccccc2)c1	797619725	TUFCXGBFKHACCX-CQSZACIVSA-N	443.460	1.739	50	20	IDGD	
COCCc1nnc(-c2cccc(C(=O)NNC(=O)C(=O)Nc3ccc(C)c(C)c3)c2)o1	798310976	ZDATXTLAHYTWJO-UHFFFAOYSA-N	437.456	1.942	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CN(C[C@@H]2CCCO2)C(=O)OC(C)(C)C)cc1	801111507	RFYVFRXDTBUKED-INIZCTEOSA-N	434.493	1.497	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)CNC(=O)c2cccc(Br)c2)cc1	802082892	QLAGLKJNPCCLJI-UHFFFAOYSA-N	448.273	1.492	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)Cn2cc([N+](=O)[O-])ccc2=O)c(OC)cc1Cl	802085066	WQYIURLGCKDQHN-UHFFFAOYSA-N	425.785	1.280	50	20	IDGD	
Cc1cc(C)c(S(=O)(=O)NCCC(=O)NNC(=O)Nc2ccc3c(c2)OCO3)c(C)c1	802107700	XZKNNFHLKNROOB-UHFFFAOYSA-N	448.501	1.862	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)[C@@H](c2cnn(C)c2)N(C)C(=O)OC(C)(C)C)c1	806365335	SHACBHSQUBJCPX-GOSISDBHSA-N	446.508	1.596	50	20	IDGD	
COCCNC(=O)c1cccc(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2Cl)c1	807006194	SZWYBVJNCFWCCC-UHFFFAOYSA-N	435.824	1.706	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNc2cccc(F)n2)ccc1S(=O)(=O)N1CCCC1	807392600	SHQZVRHSKHVNFT-UHFFFAOYSA-N	437.453	1.096	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)NC[C@H](N3CCOCC3)C(F)(F)F)n[nH]2)cc1	807542009	XFXUYLLDETYULI-INIZCTEOSA-N	440.426	1.592	50	20	IDGD	
CCCS(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)COCc2ccccc2)cc1	808093574	QLFSLBLPFSEHNE-UHFFFAOYSA-N	426.516	1.397	50	20	IDGD	
C#CC[C@@]1(C(=O)OCC(=O)NNC(=O)c2ccccc2)CCCN1C(=O)OC(C)(C)C	808594248	FZPLSWSVQFGWSI-QFIPXVFZSA-N	429.473	1.784	50	20	IDGD	
COC(=O)c1c(F)ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)c1C	810384953	SMZOOXSBXLHJEY-UHFFFAOYSA-N	431.376	1.092	50	20	IDGD	
CSC1(CNC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)CCN(C)CC1	811850632	BCMSFPMEIOGIQG-UHFFFAOYSA-N	442.611	1.060	50	20	IDGD	
O=C(NNc1nc(Br)cn2ccnc12)C(=O)N1CCN(c2ccccc2)CC1	812529152	BGXGPBZGSCXUQU-UHFFFAOYSA-N	444.293	1.284	50	20	IDGD	
CCOC(=O)c1nc(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2C)sc1C(C)=O	815648654	SRAHKWQDVHIYLU-UHFFFAOYSA-N	435.418	1.821	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(Br)s1)NNc1cccc(Cl)n1	817004702	MSDCATDJYMFOTP-UHFFFAOYSA-N	425.717	1.981	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)Cc2cnn(-c3ccccc3)c2)c2ccccc2c1=O	818815166	DKGGYGGCAHIHRF-UHFFFAOYSA-N	430.468	1.996	50	20	IDGD	
O=S(=O)(c1c(Br)cc2nc(O)oc2c1Cl)N1CC[C@@H](B(O)O)C1	864232035	VNASCCODAPRPAS-RXMQYKEDSA-N	425.453	1.187	50	20	IDGD	
Cc1ccc(C)c(S(=O)(=O)NCC(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)c1	913423036	YMMWQSDIPABZLE-UHFFFAOYSA-N	427.486	1.433	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)NC2CC2)cc1)NNC(=O)[C@H]1COc2ccccc2O1	913465078	CSXORFZAJPXAIG-LJQANCHMSA-N	445.497	1.047	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NC[C@H](c2ccc(OC)c(OC)c2)N(C)C)cc1OC	915898107	QUIKNTWKNZJTEL-MRXNPFEDSA-N	446.504	1.968	50	20	IDGD	
CNS(=O)(=O)Cc1ccc(CNC(=O)NNC(=O)c2cc(C)nc3ccccc23)cc1	916228628	KYHULYSBKDXLOH-UHFFFAOYSA-N	441.513	1.737	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	918278529	AQBZURIIQJLGPB-UHFFFAOYSA-N	426.498	1.887	50	20	IDGD	
CC(C)NC(=O)C(=O)NNC(=O)c1ccc(NC(=O)c2cccc(Br)c2)cc1	918476888	LRNRLVLUPPSZQI-UHFFFAOYSA-N	447.289	1.987	50	20	IDGD	
CN(CC(=O)NNC(=O)c1csc(N2CCOCC2)n1)c1nc2ccccc2s1	919744580	IOQLVOKSNHCWBC-UHFFFAOYSA-N	432.531	1.487	50	20	IDGD	
CN1CCN(c2ccccc2CNC(=O)NNC(=O)c2ccc3c(c2)OCCO3)CC1	1318293092	CPBQERPJZHOYES-UHFFFAOYSA-N	425.489	1.354	50	20	IDGD	
CCOC(=O)c1cc(S(=O)(=O)NNC(=O)c2cncn2-c2ccccc2)ccc1F	1318306839	KWSWFXXYSFNVCE-UHFFFAOYSA-N	432.433	1.811	50	20	IDGD	
Cc1n[nH]c(C)c1C[C@@H](C)C(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	1319303818	UTAKFSCXLCIFIV-OAHLLOKOSA-N	446.983	1.824	50	20	IDGD	
N#Cc1ccc(N2C[C@@H](C(=O)NNC(=O)c3cc(-c4ccc(F)cc4)[nH]n3)CC2=O)cc1	1333548148	HPENDIXFJYPTSO-HNNXBMFYSA-N	432.415	1.902	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cn(C(C)(C)C)nn3)C2)C1	1780351055	HUFBGFZQZMYHMG-FZKQIMNGSA-N	442.358	1.508	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)n1	1781225484	YUPZIRKSMCPAMW-OALUTQOASA-N	443.331	1.720	50	20	IDGD	
O=C([C@H](F)Br)N1CC[C@@]2(C1)CN(C(=O)C1(c3ccc(O)cc3)CC1)CCO2	1781326431	XRUPHUODWKEIME-MAUKXSAKSA-N	441.297	1.944	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)CSCc3[nH]cnc3C)CCO2)C1	1783877925	RZRKWQDEWXZAOR-RDTXWAMCSA-N	430.958	1.035	50	20	IDGD	
CC(C)c1nn2ccccc2c1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]2C1	1784089743	HBQMZYNRTKWKGD-ONIAQPFYSA-N	448.951	1.651	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)CCc3ccc(N(C)C)cc3)C2)C1	1784246805	OUWPHDYZRHFGFO-DENIHFKCSA-N	437.968	1.769	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(CCN(C(=O)c3cccc4c3CCCC4)C2)C1	1785091756	GTJDYYURUOCZDX-VWLOTQADSA-N	448.328	1.003	50	20	IDGD	
COc1cccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)CBr)C[C@@H]32)n1	1785808412	XCHJLLIJMXUFBY-YXWQFLTLSA-N	440.338	1.715	50	20	IDGD	
C[C@H](Nc1cccnc1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21	1786866115	GHEATAMWBFEAJM-YERCRUGSSA-N	443.317	1.552	50	20	IDGD	
C/C=C/C=C\C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)[C@H]2C1	1787507772	RKWUJXNDGANIIP-IUDORELMSA-N	427.505	1.232	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnn4cccnc34)[C@H]2C1	1788293388	LKBRYHBTNXJKGJ-XPVILTJLSA-N	440.331	1.559	50	20	IDGD	
C[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21)N1CSCSC1	1788685286	ABUWEMCMOZHJBN-VOAKCMCISA-N	442.434	1.813	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnnc(Cl)c3)C[C@@H]21	1788765828	TWKQMGFQVYLSOV-QEJZJMRPSA-N	426.977	1.575	50	20	IDGD	
CCn1nc(C(=O)Nc2ccc(C3(NC(=O)c4ccc(B(O)O)cc4)CCC3)cc2)cc1C	1789856429	CQCQJPPSWWHOOS-UHFFFAOYSA-N	446.316	1.953	50	20	IDGD	
COc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]3C2)ccc1O	1789924473	FXZILCUOOSQXKO-GVAFMPQTSA-N	445.285	1.685	50	20	IDGD	
COc1cc(Cl)ccc1CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21	1790709275	RDBJZBNYIITWLE-SCNOPHJPSA-N	445.343	1.471	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CNC(=O)OC(C)(C)C)[C@H]2C1	1790990736	UQURLAZOWTUJOP-RFGFWPKPSA-N	448.358	1.274	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(N(C)C)nc3)C[C@@H]21	1791058724	CUMHKFKOUPEDGM-TUUVXOQKSA-N	439.354	1.524	50	20	IDGD	
CCC[C@@H](NC(C)=O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]2C1	1791064788	KROXJHCNEAJHMP-CHUNWDLHSA-N	432.359	1.054	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(C)n(C(F)F)n3)C[C@@H]21	1791254216	QEMXQBVXOOOHTA-XPCVCDNBSA-N	434.871	1.434	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cc(F)ccc3OC)C[C@@H]21	1791257378	CCXDBHALPOJVIP-KUZCPNRJSA-N	442.915	1.610	50	20	IDGD	
COC(=O)[C@H]1CC=CC[C@@H]1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]2C1	1791298152	DRVLZYGDMPXFNC-YTFOTSKYSA-N	433.332	1.525	50	20	IDGD	
C[C@H](Nc1cccnc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCBr	1795112527	LBQSRZPGSICVRL-ZJOBFFGXSA-N	425.327	1.257	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CC[C@H](C)CC1)C2	1796445456	ARKPSDVWCYPCTM-WQNYWJIOSA-N	443.548	1.536	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1snnc1C1CC1	1796707400	HQHGFXMBLBQYOV-IXLVHKGHSA-N	429.340	1.402	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2)c1cn2cc(Cl)ccc2n1	1796850623	ZTJLMQSBHXTQQL-WDAIWFPHSA-N	431.707	1.995	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1ccc2ncoc2c1	1797077698	QNYAGNPQGLCEAL-BAESOJJISA-N	426.242	1.722	50	20	IDGD	
CSc1ncccc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2	1798331052	PGFIZJKLGDTONC-LYIQGSDWSA-N	432.315	1.697	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2cccnc2nc1O	1799923191	VFZDKYLKPNOGOV-JLVBRIDZSA-N	444.564	1.390	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2)[C@@H]1CC(c2ccccc2)=NN1	1800157541	DNKXARPYDAXORK-XRGAULLZSA-N	425.316	1.146	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Cn1ccnc1)C2	1800644193	MUVNWBDRGFWCKT-QMHWVQJVSA-N	427.343	1.282	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c(C)oc3cc(O)ccc13)C2	1800978040	JXMJRSGVIVITFH-UESRRSCYSA-N	436.892	1.904	50	20	IDGD	
Cc1nc(CC(=O)NC[C@@H]2CCN(C(=O)[C@H](F)Br)[C@H]2c2cccnc2)no1	1804493225	OJARGBRJSCGQCX-RCBQFDQVSA-N	440.273	1.712	50	20	IDGD	
Cc1cc2nnc(C(=O)N3CCC4(CCCN(C(=O)[C@H](O)CCl)C4)CC3)c(C)n2n1	1805524558	SJTCQCGDOPMVFR-OAHLLOKOSA-N	434.928	1.186	50	20	IDGD	
C[C@@H]1C[C@]1(C)C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1	1807772274	IVTXCOZQHMOTTH-GTXMHPBVSA-N	436.516	1.446	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)[C@H]1CC=CCC1	1808125565	QQGKMBCSCAFFKT-UCNVEGJOSA-N	433.317	1.437	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](N)Cc2cccnc2)[C@@H]1c1cccnc1	1813030565	JJIBJBOFDVHESF-LWYYNNOASA-N	445.951	1.306	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)[C@@H]2CCC=CO2)[C@H]1c1cccnc1	1813074530	UCYZOAOZNHWQCT-WFXMLNOXSA-N	429.521	1.153	50	20	IDGD	
O=C(Cc1ccsc1)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2	1815606035	KIXFAZMZTISDJP-OAHLLOKOSA-N	441.343	1.353	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1)c1cnn(-c2cccnc2)c1	1816206358	STCPAEGXADKLBS-IAGOWNOFSA-N	443.895	1.896	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CN2CCCC2=O)n[nH]1	1817161772	PJIUOTJAXSWVPB-DGCLKSJQSA-N	426.315	1.808	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](N)CCC(N)=O)n[nH]1	1817246113	WFXMJEQSHJYZEG-GVXVVHGQSA-N	443.346	1.026	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2CCOC2)[nH]n1	1818114418	ZITAVTDXDYKTDB-CRRXUQMMSA-N	441.492	1.572	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cn4cccnc4n3)sc2C1	1819030112	YGRHHOCXVDYZBS-GHMZBOCLSA-N	434.909	1.665	50	20	IDGD	
O=C(COC(=O)C(F)(F)F)Nc1cc([C@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1	1819311480	AXRNCGLTKQYANV-NXEZZACHSA-N	426.779	1.107	50	20	IDGD	
C=CC[C@@H](C(=C)C)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2	1819598129	UJSUZKWPHGHIFQ-SJORKVTESA-N	439.346	1.817	50	20	IDGD	
Cc1nccn1[C@@H](C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1	1822883144	DICSSEXUEIFWMM-WMLDXEAASA-N	444.540	1.541	50	20	IDGD	
O=C([C@@H](O)CCl)N1CCCC[C@@H]1C1CCN(C(=O)C(F)(F)C(F)(F)C(=O)O)CC1	1824178018	BWNHARUAWDTUER-NEPJUHHUSA-N	446.825	1.561	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)[C@H]2CCCCN2C)CC1	1824201083	MOYPZEVYVHSWBW-WOJBJXKFSA-N	435.613	1.463	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2csnn2)CC1	1824662374	CHKGEFCXZMUCCO-KRWDZBQOSA-N	443.533	1.084	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnc3[nH]ncc3c1)CC2	1825999776	CLSWFMHFOSCPKX-VXGBXAGGSA-N	434.909	1.894	50	20	IDGD	
Cc1nnsc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827059745	USNILSNFZXBJQX-SFHVURJKSA-N	442.350	1.073	50	20	IDGD	
C[C@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](F)Cl)CC1)[C@H]1SC(=N)NC1=O	1827614279	YXXDYRGSOAANKR-SCUASFONSA-N	432.949	1.943	50	20	IDGD	
COc1ccccc1CC(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830366317	QGFACMSLFGMZHR-QFIPXVFZSA-N	438.952	1.959	50	20	IDGD	
O=C(Cn1ccncc1=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](F)Br)CC1	1830382542	KLVBHHDDVDJGII-WMLDXEAASA-N	443.317	1.554	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccccn3)C2)C1	1830538434	FTBPOOKVKOJVIK-KXBFYZLASA-N	440.338	1.112	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc[nH]c4nccc3-4)C2)C1	1831646368	KTFGXZRFPUSGDN-LAUBAEHRSA-N	434.924	1.992	50	20	IDGD	
CC[C@@H](C(=O)N1CCO[C@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1)N(CC)CC	1831669354	GYUFUDCIDLUIMI-RXVVDRJESA-N	443.661	1.415	50	20	IDGD	
Cc1ccncc1CCC(=O)N1CCO[C@@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1	1833012254	DIJWSQAOSXAEFB-QFIPXVFZSA-N	449.624	1.631	50	20	IDGD	
Cc1cccc(/C=C/C(=O)N2CCC(N3CCC(NC(=O)[C@@H](O)CCl)CC3)CC2)n1	1833306139	KNWXVDIQTSOGIU-XJDXJNMNSA-N	434.968	1.575	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3ccc4ccnn4c3)CC2)CC1)[C@H](O)CCl	1833312371	RMGFAEPSYSVGOS-LJQANCHMSA-N	433.940	1.119	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3coc(Cl)n3)CCO2)C1	1833560013	MMFZGADJBBZDRE-BMIGLBTASA-N	436.690	1.181	50	20	IDGD	
C=CCCc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)c(O)n1	1833699180	UILLOHYQGRNMAI-UZLBHIALSA-N	441.887	1.510	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3c(C)noc3C)CC2)CC1	1834156884	QQVJFBAXTRSZKJ-QGZVFWFLSA-N	426.945	1.730	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)CCBr)CCO2)C1	1834823971	OZSZMBGJMTYQIS-GJZGRUSLSA-N	446.169	1.464	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)c3ccccc3F)C2)C1	1834824163	UHBRBXNSIDPCFY-SFHVURJKSA-N	429.286	1.681	50	20	IDGD	
O=C(/C=C/c1ccccc1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1835109607	BZFJJNVWLQXEJD-XZJTZLQGSA-N	441.297	1.847	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)C3CCOCC3)CCO2)C1	1835193497	GQRDUHIXWRIUFN-QAPCUYQASA-N	433.343	1.043	50	20	IDGD	
O=C(c1cc(=O)cco1)N1CCC(OC2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1837590825	BTUNJZOWDRNLLN-MRXNPFEDSA-N	445.285	1.943	50	20	IDGD	
CC[C@H](C(=O)N1CCOC[C@@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1)N(CC)CC	1837710158	LNMKUTVNQRTQMN-WIYYLYMNSA-N	443.661	1.415	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)c3ccccc3)C2)C1	1839152344	WUPWJQYPBJMBKE-DBVUQKKJSA-N	445.343	1.413	50	20	IDGD	
O=C(c1ccc([N+](=O)[O-])cc1F)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1839278030	YOPGXFUDOLVJOZ-RHSMWYFYSA-N	433.795	1.338	50	20	IDGD	
O=C(c1cccc(F)c1[N+](=O)[O-])N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1839356795	KRVZVBARZVGBPX-YOEHRIQHSA-N	433.795	1.338	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)C(=O)c3ccco3)C2)C1	1839962351	BPIWFANFVRLGMB-SCLBCKFNSA-N	443.294	1.092	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@]3(C)CC=CCC3)C2)C1	1840036963	UKPWTTWNZZFBCD-SNRMKQJTSA-N	429.355	1.973	50	20	IDGD	
CC(=O)C[C@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)CBr)C2)C1	1840126731	KFAFVZDAFUSTTG-DEYYWGMASA-N	433.343	1.089	50	20	IDGD	
CO[C@@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1	1840211559	GTFWSWWFFFCVKW-QLBMNLSNSA-N	449.454	1.363	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccc(O)cn3)CCO2)C1	1840494863	XAYCXULENRBPMM-XLIONFOSSA-N	425.913	1.194	50	20	IDGD	
COCC1(C(=O)N2CCCC23CN(C(=O)c2cc([N+](=O)[O-])ccc2OC(C)=O)C3)CC1	1841596652	WCPRSYDFDRIZNK-UHFFFAOYSA-N	431.445	1.764	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC=C(C(=O)N2CCCC23CN(C(=O)[C@@H](O)CCl)C3)C1	1841918508	NJDOGYNWNFMQLJ-HNNXBMFYSA-N	427.929	1.357	50	20	IDGD	
CC(=O)N1CCC(N2CCC(C(=O)N3CC4(CCCN4C(=O)[C@@H](F)Cl)C3)CC2)CC1	1843364154	UYATVFKDEIYWSH-GOSISDBHSA-N	442.963	1.447	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1ccc(F)c(C)n1)C2	1843415550	NPKSTHGESNPIDW-AFUMVMLFSA-N	426.452	1.480	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)CCCn1ccnc1C)C2	1843417327	XBLPXEFPJOZYDJ-PCLIKHOPSA-N	439.520	1.309	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)Cc2cc(C)[nH]n2)C1	1844324568	QOEWHFPNFWTUAO-UHFFFAOYSA-N	441.444	1.611	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC2(CCCN2C(=O)c2cc(CO)on2)C1	1844819643	PBDBQZZRUIUVIF-AWEZNQCLSA-N	442.900	1.116	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H]2O[C@H](C[C@@H]2C(=O)N2CCCC23CN(C(=O)[C@H](F)Cl)C3)C1	1845077187	XXGPMDZIGGRIEM-BARDWOONSA-N	445.919	1.749	50	20	IDGD	
COc1ccc(C(=O)N2CCCC23CN(C(=O)[C@@H](F)Br)C3)c(O)c1OC	1845426082	IWGNEBSMXLWFRY-CQSZACIVSA-N	431.258	1.917	50	20	IDGD	
Cc1cn2c(=O)c(C(=O)N3CC4(CCCN4C(=O)[C@@H](C)Br)C3)cnc2s1	1846176865	JDUVGCUWIUBJQD-LLVKDONJSA-N	439.335	1.665	50	20	IDGD	
COc1ccc(C2(C(=O)N3CC4(CCCN4C(=O)CCC(=O)NN(C)C)C3)CCC2)cc1	1846385564	UJVNFOYYOQFVRE-UHFFFAOYSA-N	442.560	1.693	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)Cc1cc3cccnc3cc1F)C2	1846385585	WPCZBQCFOSEAHN-UHFFFAOYSA-N	441.507	1.493	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)C23CC(c4ccccc4)(C2)C3)C1	1847140841	LMFZKHQMWDQYLC-UHFFFAOYSA-N	445.523	1.624	50	20	IDGD	
O=C(Cc1ccc(Cl)c(F)c1)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cccc(B(O)O)c1	1847419151	IDMPDHQVBOEGKX-OALUTQOASA-N	430.672	1.217	50	20	IDGD	
O=C(/C=C/c1ccc(F)cc1F)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cccc(B(O)O)c1	1847985208	GELAHPZOPBEIQG-NYGCDYGISA-N	426.228	1.173	50	20	IDGD	
COc1ccccc1N1CCN(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)CC1	9755787	JMEKNIRQGIKAAG-UHFFFAOYSA-N	446.533	1.165	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)CCc2nc(-c3ccncc3)no2)c2ccccc2c1=O	14221529	BXKMRSZTJADOSY-UHFFFAOYSA-N	433.428	1.255	50	20	IDGD	
Nn1c(SCC(=O)NNC(=O)c2ccccc2)nnc1-c1cccc(Br)c1	24944384	UIMDSEYXCQUPJO-UHFFFAOYSA-N	447.318	1.975	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)CCNS(=O)(=O)c2cc(C)ccc2C)cc1	28627687	BCMBEKCDQBNHDJ-UHFFFAOYSA-N	447.513	1.285	50	20	IDGD	
COc1ccc(Cl)cc1NCC(=O)NNC(=O)c1csc(N2CCOCC2)n1	116723069	ILDPTZSKAZYKEB-UHFFFAOYSA-N	425.898	1.515	50	20	IDGD	
O=C(NNC(=O)C(=O)N1CCCC1)NC1CCN(c2ccc(OC(F)F)cc2)CC1	726718525	FVNOQTMBRIZRSU-UHFFFAOYSA-N	425.436	1.210	50	20	IDGD	
COc1ccc(Cl)cc1N1C[C@H](C(=O)N([C@@H]2CCS(=O)(=O)C2)N(C)C)CC1=O	728178142	CDESOZOUDXMZCZ-TZMCWYRMSA-N	429.926	1.194	50	20	IDGD	
C[C@@H](Oc1ccccc1Cc1ccccc1)C(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1	728188827	PQRQSRYDLPKKEA-QAPCUYQASA-N	431.514	1.562	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@@H](C)c2ccc3c(c2)CC(=O)N3C)c2ccccc2c1=O	728398613	CPHVLQMIJNWJGU-ZDUSSCGKSA-N	448.483	1.641	50	20	IDGD	
CCN(CCCNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)C(=O)OC(C)(C)C	729047422	FDRFAGJWHXJXJK-UHFFFAOYSA-N	449.556	1.671	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)NCCCS(=O)(=O)Cc1ccccc1	729496627	JTOFJHWHXVQIOJ-UHFFFAOYSA-N	428.514	1.977	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)N[C@@H]2CCN(c3ccc(F)cc3F)C2)c2ccccc2c1=O	730137549	VQWNHMMQOBIOCG-CYBMUJFWSA-N	442.426	1.435	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)[C@H]1CCN(c2cccc(Br)c2)C1=O	730779963	MSSWFTNMMNGOBE-CQSZACIVSA-N	448.273	1.734	50	20	IDGD	
COC(=O)c1ccc(Br)c(S(=O)(=O)NNC(=O)c2ccccc2OC)c1	731493567	GEBDZYHGIYNWIU-UHFFFAOYSA-N	443.275	1.868	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1	731978170	KRWQKQSIBPXPNN-CYBMUJFWSA-N	432.458	1.660	50	20	IDGD	
CCS(=O)(=O)c1ccc(F)c(C(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)c1	732581291	AQAIONVFRTWTMI-UHFFFAOYSA-N	442.852	1.891	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2C[C@H](C)N(C(=O)OC(C)(C)C)[C@@H](C)C2)n1	733202821	TYEZALWINRYBDQ-KBPBESRZSA-N	425.555	1.471	50	20	IDGD	
CC(C)N1CC[C@H](NC(=O)NNC(=O)[C@H](C)Oc2cccc(Br)c2)C1=O	734162565	MAASKHWWNLIMTH-FZMZJTMJSA-N	427.299	1.556	50	20	IDGD	
Cc1ccc(-c2ncc(C=NNC(=O)CSc3nn(C)c(=O)n(C)c3=O)s2)cc1	734299350	VIKCYEOQQVQRMR-UHFFFAOYSA-N	430.515	1.153	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN2CCN(CC(=O)N3CCCC[C@H]3C)CC2)cc1C	736308362	LQKAABRUGNQZHN-QGZVFWFLSA-N	449.621	1.399	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)c2ccc(N3C(=O)CCC3=O)cc2)cc1C	736729705	GYFINQIMIWOBNI-UHFFFAOYSA-N	443.481	1.890	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)N[C@H](C)C(=O)N2CCCC[C@H]2C)c2ccccc2c1=O	737053932	FXZKETLQCZIPKU-HUUCEWRRSA-N	442.520	1.711	50	20	IDGD	
CSCC[C@@H](C(=O)NNC(=O)COCc1ccccc1)N1C(=O)[C@H]2CCCC[C@H]2C1=O	737634835	OERVBRCYIRMYLQ-KSZLIROESA-N	447.557	1.648	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)CSc1nncn1-c1ccc(C)c(Cl)c1	740851392	CSZUXOSSEVDJMF-UHFFFAOYSA-N	438.941	1.773	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)c2cn([C@H]3CCS(=O)(=O)C3)nc2C(C)C)cc1	742477403	PKBZBXWJGPGXQG-HNNXBMFYSA-N	434.518	1.515	50	20	IDGD	
O=C(CCN1C(=O)[C@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O)NNC(=O)c1ccc(Cl)cc1Cl	742482396	JZOVQSHHKSISPI-UXOAXIEHSA-N	426.256	1.307	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)CNC(=O)c1ccco1)Oc1cccc(Br)c1	743577898	UBZTXXQXQGEURR-NSHDSACASA-N	439.266	1.570	50	20	IDGD	
CC(C)NC(=O)C(=O)NNC(=O)/C(=C/c1cccs1)n1nnnc1-c1ccccc1	744447055	UJZAGHXOKVOLPD-PTNGSMBKSA-N	425.474	1.072	50	20	IDGD	
O=C(Cc1ccc2c(c1)OCCO2)NNc1ccccc1S(=O)(=O)N1CCOCC1	744622052	UYMCYDNXQHTIPR-UHFFFAOYSA-N	433.486	1.165	50	20	IDGD	
O=C(COC(=O)c1ccc(C[C@H]2CC(=O)NC2=O)cc1)NNC(=O)c1cccc(Cl)c1	745107290	IKCLOEQZDNZDRW-HNNXBMFYSA-N	443.843	1.163	50	20	IDGD	
O=C(CNC(=O)[C@H]1c2ccccc2C(=O)N1Cc1ccccc1)NNC(=O)C1CCCC1	745843468	KRLRCLUJUHTGAQ-OAQYLSRUSA-N	434.496	1.838	50	20	IDGD	
O=C(CCc1nc(-c2cc(Br)cs2)no1)NNC(=O)N1CCOCC1	745996376	VMGXDXGBVPUPOA-UHFFFAOYSA-N	430.284	1.566	50	20	IDGD	
COc1cc(C)nc(NNC(=O)CCc2nc3cc(S(=O)(=O)N(C)C)ccc3n2C)n1	746630433	JKSLBXYDVBKCGR-UHFFFAOYSA-N	447.521	1.007	50	20	IDGD	
COc1cc(C)nc(NNC(=O)[C@H](CCSC)NC(=O)c2cccc([N+](=O)[O-])c2)n1	746634696	NNPZPBOMLWUSAM-AWEZNQCLSA-N	434.478	1.697	50	20	IDGD	
CSCC[C@@H](NC(=O)c1ccccc1)C(=O)NNC(=O)Cc1cn2ccccc2n1	746640350	BHABUMSWEHYNIV-QGZVFWFLSA-N	425.514	1.576	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2ccc(C(C)(C)C)s2)c1	747777844	TXIIAIFNQGUDCJ-UHFFFAOYSA-N	445.588	1.919	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)NCC(=O)N1CCN(c2ccccc2)CC1	749219595	DADYWHMUYBGBRJ-UHFFFAOYSA-N	445.907	1.641	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc2c(c1)OCCCO2)NNc1ccc(OC(F)F)cc1	749280518	AXHZTGGMCSLTNN-UHFFFAOYSA-N	443.428	1.871	50	20	IDGD	
CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)NNC(=O)[C@H]1COc2ccccc2O1	749330835	AZQBUEMLMHINDH-FXAWDEMLSA-N	440.431	1.342	50	20	IDGD	
COc1ccc(CCN2C[C@@H](C(=O)NNC(=O)CCc3ccccc3)CC2=O)cc1OC	749803212	CFTJKXNSFBJERO-IBGZPJMESA-N	439.512	1.875	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NN=CC2(CN3CCOCC3)CCCCC2)c1	751130252	VYJMECHEFMHVEC-UHFFFAOYSA-N	436.578	1.935	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)N(C)C[C@H](O)CN2CCOCC2)c(C)n1C[C@@H]1CCCO1	751430413	KPJJRNPDOAUJBC-DPKMYZRZSA-N	430.549	1.342	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)NC[C@@H]2CCC[C@]23NC(=O)N(C)C3=O)cc1OC	752025516	YHMWWQFCLQCTSJ-QKKBWIMNSA-N	447.492	1.149	50	20	IDGD	
COC(=O)COc1c(C)cc(C(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)cc1C	752269362	XCPXFPVHGKSNQJ-UHFFFAOYSA-N	446.456	1.956	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c1	755403505	CRLNXWYPEXPMNK-UHFFFAOYSA-N	441.853	1.965	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)Nc1ccc(-n2cccn2)nc1	755849947	AVEMGXIKYSQSQT-UHFFFAOYSA-N	434.504	1.632	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)NC1CCN(S(=O)(=O)C(C)(C)C)CC1	755899429	LRYYNIYYCJUNOA-UHFFFAOYSA-N	436.538	1.179	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)Nc2cccc(Cn3nc4ccccn4c3=O)c2)cc1	755938674	XGIKKZNNPTVDHI-UHFFFAOYSA-N	427.424	1.882	50	20	IDGD	
COC(=O)C(C)(C)c1ccc(NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1	756757103	LJFMJTZQWJYYDH-UHFFFAOYSA-N	440.504	1.997	50	20	IDGD	
C[C@](O)(CN1Cc2ccccc2C1=O)C(=O)NNC(=O)c1cc(-c2cccs2)[nH]n1	756878161	DVWFNIBZDJUKMG-FQEVSTJZSA-N	425.470	1.306	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)Nc2ccccc2N(C)S(C)(=O)=O)cc1	757661623	OILITFZARQVZKC-CQSZACIVSA-N	448.501	1.905	50	20	IDGD	
CS(=O)(=O)CCc1ccc(NC(=O)NNC(=O)c2nnc(O)c3ccccc23)cc1	757749348	QREMGPCQPIDUON-UHFFFAOYSA-N	429.458	1.389	50	20	IDGD	
COC(=O)CS(=O)(=O)Cc1ccc(CNC(=O)c2c(C)nn(CCCl)c2C)cc1	760022033	HLSPEUDMVMZLEJ-UHFFFAOYSA-N	441.937	1.757	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)Nc1cc2ccccc2nc1Br	760168010	LQRFLWVKSFVMEZ-JTQLQIEISA-N	427.280	1.585	50	20	IDGD	
O=C(CCCCCNS(=O)(=O)c1ccc2c(c1)OCCO2)NNc1ncc(F)cn1	760914126	DPZBYNJBROYOEU-UHFFFAOYSA-N	439.469	1.369	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)c1ccc(N2CCCS2(=O)=O)cc1	761636990	LZDKAXDBLLRILX-UHFFFAOYSA-N	435.527	1.788	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)NC[C@@H]2[C@@H](C)OC(C)(C)N2C(=O)OC(C)(C)C)n1	762330787	QGWZBBNXQHAAEZ-HUUCEWRRSA-N	438.529	1.591	50	20	IDGD	
C[C@H](CN1CCOCC1)C(=O)NN=C1CCOC[C@@H]1[C@H]1CCCN1C(=O)OC(C)(C)C	762416988	DRUBRXWZVLSKJS-ZIFCJYIRSA-N	438.569	1.863	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(C(C)=O)c(C)c2)cc(OC)c1OC	763540139	SBZGXDCGRGDETE-UHFFFAOYSA-N	429.429	1.623	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)cnn1-c1ccccc1F	763551178	KPKDEXGKHBGOJY-UHFFFAOYSA-N	425.376	1.448	50	20	IDGD	
CCOC(=O)c1c(C)csc1NC(=O)C(=O)NNC(=O)c1ccc(OC)c(OC)c1	763552263	XZJTYQYLTXIPPM-UHFFFAOYSA-N	435.458	1.650	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc3cnn(C(C)C)c3c2)cc1	763661341	NDYZVBWRWUGGMR-UHFFFAOYSA-N	425.445	1.791	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2ccccc2CN2CCOCC2)c1	763665328	FNGRQTICTAKIHN-UHFFFAOYSA-N	440.500	1.301	50	20	IDGD	
CCOc1ccc(C#N)cc1NC(=O)C(=O)NNC(=O)COc1ccccc1OCC	763680906	CLWXAOYXIDTNPD-UHFFFAOYSA-N	426.429	1.521	50	20	IDGD	
Cc1ccc(NC(=O)C2CC2)cc1NC(=O)C(=O)NNC(=O)COc1ccc(C#N)cc1	763681710	MNPKDELBXFWHGS-UHFFFAOYSA-N	435.440	1.380	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(Oc2cccnc2)nc1	763713366	YLVMCGAQPCMSPY-UHFFFAOYSA-N	435.440	1.996	50	20	IDGD	
CN1CCc2ccc(NC(=O)C(=O)NNC(=O)CSc3ccc(Cl)cc3)cc2C1=O	763734447	LHGNYUSWUGXTKQ-UHFFFAOYSA-N	446.916	1.846	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)C(=O)Nc2cccc(C(C)=O)c2)c2ccccc2c1=O	763801043	BJHZUSPOATWIJL-UHFFFAOYSA-N	449.467	1.799	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)oc(=O)n3C)c1C	763840175	JCWBHYKUAQNFSE-CYBMUJFWSA-N	426.429	1.302	50	20	IDGD	
COc1ccc(CN(C)C)cc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccccc1F	763848990	GMJGLHSKFTWKGH-ZDUSSCGKSA-N	432.452	1.449	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccc(Oc2cccnc2)nc1	763873416	SRQNLRDPLHPYSL-CYBMUJFWSA-N	439.403	1.961	50	20	IDGD	
CS(=O)(=O)c1cccc(NC(=O)C(=O)NNC(=O)CCSc2ccc(F)cc2)c1	763895172	LXRJOCKKQFFIAZ-UHFFFAOYSA-N	439.490	1.498	50	20	IDGD	
CN(C)C(=O)c1ccccc1NC(=O)C(=O)NNC(=O)CCSc1ccc(F)cc1	763895836	IERGNWPAJUQWFN-UHFFFAOYSA-N	432.477	1.796	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)C(=O)Nc1ccc(C(N)=O)cc1F	763899918	DTTJTYWTKJUXIG-UHFFFAOYSA-N	441.444	1.756	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cc(Br)cn2C)ccc1F	764004789	MFAXAZCRGNSVCI-UHFFFAOYSA-N	441.213	1.113	50	20	IDGD	
CCOC(=O)CCc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1	764006190	LYLXJMZMIIBFDR-UHFFFAOYSA-N	441.440	1.353	50	20	IDGD	
CNC(=O)CCOc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2OC)cc1	764013189	XQUFKNJGGRIULB-UHFFFAOYSA-N	448.863	1.263	50	20	IDGD	
O=C(CCc1ccco1)NNC(=O)C(=O)Nc1ccc(CC(=O)N2CCSCC2)cc1	764176417	BKQKYTMPIHWDHS-UHFFFAOYSA-N	444.513	1.116	50	20	IDGD	
CCCCN(C)S(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)CCC(C)C)cc1	764198706	GECBRCWIJRJYTI-UHFFFAOYSA-N	426.539	1.629	50	20	IDGD	
CN(C)CC(=O)NNC(=O)C(=O)Nc1ccc(N(C)C(=O)c2ccc(Cl)cc2)cc1	764213110	UGJDPEZBAARHTO-UHFFFAOYSA-N	431.880	1.264	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)C(=O)Nc1cccc(CN2C(=O)CNC2=O)c1)c1ccccc1	764331891	JOXDCHIQRWGSGY-QGZVFWFLSA-N	437.456	1.018	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N[C@H](C)[C@@H]2CCOC2)cc1	765097680	MTKLCKDLGFLQNI-NOPJKMJJSA-N	437.500	1.882	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cc(C)[nH]n2)cc1S(=O)(=O)N[C@H]1CCCC[C@@H]1C	765588385	ZEVMOALNFRKSKT-WFASDCNBSA-N	449.533	1.659	50	20	IDGD	
Cc1nc(C(F)(F)F)ccc1C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765739505	WDCZGWMWDAWKIX-UHFFFAOYSA-N	449.433	1.628	50	20	IDGD	
Cc1cc(N(C)C)cc(C)c1NC(=O)C(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	766259126	PXVAAJYZOJOREB-UHFFFAOYSA-N	436.472	1.660	50	20	IDGD	
Cc1onc(-c2ccccn2)c1C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	767562466	SMXFYCGVFOXLFW-INIZCTEOSA-N	438.396	1.189	50	20	IDGD	
CS(=O)(=O)c1ccc(Br)c(C(=O)NNC(=S)Nc2ccccn2)c1	768579446	NTOXLSQDVKMHMO-UHFFFAOYSA-N	429.321	1.879	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2ncoc2-c2ccc(F)cc2)cc1	770211702	IFKICZKRGWLKSY-UHFFFAOYSA-N	446.460	1.871	50	20	IDGD	
CSCCNC(=S)NNC(=O)c1ccc(S(=O)(=O)N2CCC(C)CC2)cc1	770245577	HBMPDXRNJMNEBL-UHFFFAOYSA-N	430.621	1.579	50	20	IDGD	
CN1CCN(C(=O)Cc2ccc(NC(=O)C(=O)NNc3c(F)cccc3Cl)cc2)CC1	770810886	GZQIZQUHYDQVDQ-UHFFFAOYSA-N	447.898	1.877	50	20	IDGD	
CC(C)N1CCC(N2CCN(C(=O)NNC(=O)c3cc(Br)c[nH]3)CC2)CC1	771199701	IUUQRNNSGGPKLS-UHFFFAOYSA-N	441.374	1.622	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)N[C@@H]2CCO[C@]3(CCOC3)C2)c1	771444597	YDGHWZOHLGBJKX-PIGZYNQJSA-N	428.283	1.740	50	20	IDGD	
NS(=O)(=O)c1ccc(N2CCOCC2)c(C(=O)NNc2c(F)cccc2Cl)c1	771673538	DIRZBMPWMOTLMZ-UHFFFAOYSA-N	428.873	1.720	50	20	IDGD	
CC[C@@H](C)[C@H](NC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1)C(F)(F)F	772530655	IGFGPWLDIAPHGX-DOMZBBRYSA-N	438.472	1.923	50	20	IDGD	
Cn1cc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)c(C(F)(F)F)n1	773491179	WWDUQEHCMMEDIE-UHFFFAOYSA-N	441.338	1.517	50	20	IDGD	
CCc1ccc(NC(=O)C(=O)NNc2ccc(C(F)(F)F)cc2)cc1S(N)(=O)=O	773763535	QWRZJEIRTJFSJD-UHFFFAOYSA-N	430.408	1.997	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)cccc1-n1cnnn1	774008811	LXVSNUAJNDYSAJ-LBPRGKRZSA-N	443.851	1.178	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN[C@@H](C)c2cc(F)ccc2N2CCC(O)CC2)n1	775355609	DRXUVQIMCGKOPV-AWEZNQCLSA-N	449.552	1.592	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)NCCCCCS(C)(=O)=O)N(C)c2ccccc21	775983483	NTCPDDLNBKPLTJ-UHFFFAOYSA-N	432.546	1.988	50	20	IDGD	
COc1cc(CCNC(=O)NNc2cccc(S(C)(=O)=O)c2)c([N+](=O)[O-])cc1OC	776609798	BEQTXTCZBDMPBK-UHFFFAOYSA-N	438.462	1.884	50	20	IDGD	
O=C(c1cncc(Br)c1)N1CCN(S(=O)(=O)CBr)CC1	777780194	XTBHPDCXAOPSFE-UHFFFAOYSA-N	427.118	1.284	50	20	IDGD	
CC(C)(C(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1)c1cccnc1	778380038	RTSPXCQZNOTLJJ-UHFFFAOYSA-N	429.952	1.978	50	20	IDGD	
CCOC(=O)N1CCC([C@@H](C)NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)CC1	779672931	GQUULJUTYMKZEE-CYBMUJFWSA-N	444.492	1.135	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)nn1-c1cccc(C#N)c1	779877816	RMICQRJUITUFMX-UHFFFAOYSA-N	437.485	1.420	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)NCc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1	780816194	VHGYLOKUOHLDPU-UHFFFAOYSA-N	448.501	1.320	50	20	IDGD	
Cc1ccc(-c2nnc(S)n2CCC(=O)NNC(=O)CCNC(=O)OC(C)(C)C)cc1	780971217	LJPQRNWQBYKBHW-UHFFFAOYSA-N	448.549	1.995	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)cc1)C(=O)Nc1ccc(N2CCc3sccc3C2)nc1	782834621	ZPLROFMDBMWEQA-UHFFFAOYSA-N	437.481	1.811	50	20	IDGD	
CCOC(=O)c1cn(C)nc1NC(=O)C(=O)NNc1ncc(C(F)(F)F)cc1Cl	782853542	DJTDEOUNUXHKRZ-UHFFFAOYSA-N	434.762	1.746	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)c2ncccc12	782893481	JAPLJDPAFKUOAY-UHFFFAOYSA-N	446.467	1.849	50	20	IDGD	
CN1C(=O)c2ccc(NC(=O)C(=O)NNc3ccc(Br)cc3F)cc2C1=O	783084582	OXZDFCQBJMXVPR-UHFFFAOYSA-N	435.209	1.896	50	20	IDGD	
COCCOC(=O)Nc1cccc(NC(=O)C(=O)NNc2ncnc3ccsc23)c1	783253430	OJIANRHMGLPKCJ-UHFFFAOYSA-N	430.446	1.968	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1cccc(NC(=O)C(=O)NNc2ncnc3ccsc23)c1	783253889	KZVYRQWAPFCHEY-UHFFFAOYSA-N	448.530	1.850	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CCc2ncc(NC(=O)C(=O)NN=c3cc[nH]cc3)cc2C1	783376937	UFDFPJKEGRCBTF-OAHLLOKOSA-N	426.477	1.362	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2ccc3c(c2)ncn3-c2ccccc2)CCS(=O)(=O)C1	783426661	IZNLJNBHVRFNLZ-FQEVSTJZSA-N	427.486	1.162	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1c(F)cccc1Br	784004117	BKDBEJVGLKZRCV-UHFFFAOYSA-N	443.254	1.166	50	20	IDGD	
Cc1cc(-c2ncccc2NC(=O)C(=O)NNC(=O)CNC(=O)c2cccs2)cs1	784005343	WIILUTPPCLGPKB-UHFFFAOYSA-N	443.510	1.696	50	20	IDGD	
O=C(NNc1ccc(Br)nc1)C(=O)Nc1ccc2nc3n(c(=O)c2c1)CCC3	784806788	RDCLVRXPTGYQSI-UHFFFAOYSA-N	443.261	1.582	50	20	IDGD	
CN(C)c1ccc(S(=O)(=O)N(C)C)cc1NC(=O)C(=O)NNc1cc(Cl)ccn1	784861981	UMLSYZRLKKPDLU-UHFFFAOYSA-N	440.913	1.133	50	20	IDGD	
CN1CCN(c2ccc(NC(=O)C(=O)NNc3ccnc(N(C)C)n3)cc2Cl)CC1	784969090	HVBIUHRQBNNKOF-UHFFFAOYSA-N	432.916	1.030	50	20	IDGD	
COC(=O)[C@@](C)(CNC(=O)NNC(=O)c1nn(-c2ccccc2)cc1O)c1ccccc1	787304836	HTLMCSLCMPPRFB-QFIPXVFZSA-N	437.456	1.653	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(Cl)cc2-n2cccn2)cc1	788330946	NPJVXRMTTCCXBE-UHFFFAOYSA-N	443.847	1.699	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1cccnc1C(F)(F)F	788587621	GFKVMDPXGPFZSK-UHFFFAOYSA-N	430.408	1.878	50	20	IDGD	
COc1cc(NNC(=O)Cc2c(C)nn(-c3cncc4nnnn34)c2C)ccc1Cl	790190046	XNYUJTTZZIXKIX-UHFFFAOYSA-N	427.856	1.670	50	20	IDGD	
Cc1ccn(C[C@](C)(O)C(=O)NNc2ccc([N+](=O)[O-])cc2Br)c(=O)c1	790947009	XICUHFIKQFSWNL-INIZCTEOSA-N	425.239	1.722	50	20	IDGD	
CCN1CCN(S(=O)(=O)c2cccc(NC(=O)C(=O)NCCSSC)c2)CC1	793078649	OVDJMNZWVIUBIH-UHFFFAOYSA-N	446.620	1.079	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNC(=O)c1cc([N+](=O)[O-])c2nsnc2c1	794063723	QNKCELISDDFMLX-UHFFFAOYSA-N	430.402	1.287	50	20	IDGD	
COCCNC(=O)c1cccc(S(=O)(=O)NNC(=O)c2cccc3ncccc23)c1	795317994	LAHBAMQRMGEJPD-UHFFFAOYSA-N	428.470	1.234	50	20	IDGD	
Cn1cc(-c2cc(F)ccc2NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)cn1	797005214	AVEPPQCNBZOYAE-UHFFFAOYSA-N	431.811	1.985	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2ccc(O)cc2)cc(Br)cc1[N+](=O)[O-]	797537603	UWJTUZWXMNSRBK-UHFFFAOYSA-N	437.206	1.771	50	20	IDGD	
COCCn1cc(CNC(=O)NNC(=O)Nc2cc(Cl)c(OC)cc2OC)cn1	800007128	GSYVNMLSAPKFKK-UHFFFAOYSA-N	426.861	1.736	50	20	IDGD	
CC(=O)NC1(c2noc(CCC(=O)NNC(=O)N=c3cc[nH]cc3)n2)CCCCCC1	802025295	ZUSLYTXJFJDTBS-UHFFFAOYSA-N	429.481	1.358	50	20	IDGD	
O=C(NNc1cccc(F)n1)C(=O)Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1	807392060	FICZWIJGQQBCTL-UHFFFAOYSA-N	435.481	1.867	50	20	IDGD	
COc1ccc(C=NNC(=O)C(=O)NN=Cc2ccc(OC)c(OC)c2C)c(C)c1OC	807943389	UKTRCNJHYYENAZ-UHFFFAOYSA-N	442.472	1.938	50	20	IDGD	
COC(=O)c1c(F)ccc(NC(=O)C(=O)NNC(=O)COc2cc(C)ccc2C)c1F	810385745	ZYPGEMQRFSLCAH-UHFFFAOYSA-N	435.383	1.533	50	20	IDGD	
CCOC(=O)c1ccc(NNC(=O)Cn2cc(Br)c(O)nc2=O)cc1C	812719244	HCPLQPAAXSUFSY-UHFFFAOYSA-N	425.239	1.340	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)C2(S(=O)(=O)c3ccccc3)CCOCC2)cc1	813374226	YCAMJDSXRBXLOR-UHFFFAOYSA-N	445.497	1.104	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)C3(S(=O)(=O)c4ccc(F)cc4)CCCCC3)nc21	813452126	JAQFSTIXDSNGKB-UHFFFAOYSA-N	448.480	1.828	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)N[C@H]1CCN(c2ccccc2F)C1	813854212	VBUQWTLYIOVCIO-AWEZNQCLSA-N	448.524	1.650	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@H](C)C(=O)NNC(=O)C1(S(C)(=O)=O)CCOCC1	814101286	QQDULKVQCVRJRB-CYBMUJFWSA-N	432.926	1.465	50	20	IDGD	
CCOc1ccc(S(=O)(=O)Nc2ccc(C(=O)NN=Cc3cnn(C)c3N)cc2)cc1	814696733	NTZDCHSYLGVJGL-UHFFFAOYSA-N	442.501	1.966	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNc2nccnc2C(C)C)nnn1CCOc1ccc(F)cc1	815625932	QGAXLXSEGKPGCM-UHFFFAOYSA-N	442.455	1.800	50	20	IDGD	
COc1cc(CC(=O)NNC(=O)[C@H]2CCCN(C(=O)OC(C)(C)C)C2)cc(OC)c1O	819658275	KUDJNEXPWQPWIY-AWEZNQCLSA-N	437.493	1.746	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)c1cc(S(=O)(=O)N(C)C)ccc1N1CCOCC1	849202652	IAIZTNMFMDUYMZ-UHFFFAOYSA-N	446.529	1.157	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)CN1C(=O)N[C@]2(C[C@H](C)CC(C)(C)C2)C1=O	863999671	XIFKZNGGOAIHOV-PEBXRYMYSA-N	446.504	1.358	50	20	IDGD	
COc1ccc(N2C[C@@H](C(=O)OCC(=O)NNC(=O)c3ccc(C)cc3)CC2=O)cc1	913319737	MVIHOTPNKQKORD-INIZCTEOSA-N	425.441	1.361	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCc2ccc(C(=O)N(C)C)cc2)cc(OC)c1OC	916250103	KJEIUMCXRPQWAK-UHFFFAOYSA-N	430.461	1.558	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc3c(cc2O)OCO3)c1	916726609	PGHBVGPDRNVGKC-UHFFFAOYSA-N	435.458	1.226	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2cc(S(C)(=O)=O)ccc2C)cc1OC	917718191	YQONKMKWYDYCFQ-UHFFFAOYSA-N	428.488	1.039	50	20	IDGD	
O=C(NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)NC1CCN(CC2CC2)CC1	918084106	XTYPQFOFFXBJAW-UHFFFAOYSA-N	449.577	1.290	50	20	IDGD	
CCC(=O)N1CCCC[C@H]1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	918541033	OUAYKUMERVDDBB-KRWDZBQOSA-N	436.534	1.023	50	20	IDGD	
Cc1ncc(Br)c(C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)n1	1116754039	JRSMQBPICMGQNE-UHFFFAOYSA-N	445.277	1.913	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(\C#N)C(=O)N2CCS(=O)(=O)C[C@H]2C(=O)OC)c1C	1121236915	GECAJNZTNAPZRX-FIJXSUORSA-N	437.518	1.018	50	20	IDGD	
Cc1nn([C@@H]2CCS(=O)(=O)C2)c(Cl)c1C=NNC(=O)Cc1cn2ccccc2n1	1252511745	ZNHPEVZPAGVKDN-CQSZACIVSA-N	434.909	1.545	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(/C#N)C(=O)OCC(=O)N[C@H]2CCS(=O)(=O)C2)c1C	1317697044	HYEZMUZDCRIXKK-KFPICYLRSA-N	437.518	1.066	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)CCS(=O)(=O)c2ccccc2)cc1C	1318659845	AJXKINXMWMFZPO-UHFFFAOYSA-N	438.527	1.787	50	20	IDGD	
O=C(NNC(=O)c1cncn1-c1ccccc1)N[C@H](Cc1ccccc1)CN1CCOCC1	1318719005	QFTCOGJHDKCIHO-HXUWFJFHSA-N	448.527	1.760	50	20	IDGD	
N#Cc1cccc(C2(C(=O)NNC(=O)CN3CCN(C(=O)c4ccccc4)CC3)CC2)c1	1319324326	JQLSQPLCTHRNGE-UHFFFAOYSA-N	431.496	1.195	50	20	IDGD	
CN(C)CCOc1cc(C(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)ccn1	1336099804	JVCFDOLSEVDYEJ-UHFFFAOYSA-N	435.525	1.430	50	20	IDGD	
O=C([C@H](O)CCl)N1CCO[C@]2(CCN(C(=O)[C@@H]3C[C@@H]3c3ccc(Cl)cc3)C2)C1	1778185984	APHRODUGZRNOIT-VIPLHTEESA-N	427.328	1.873	50	20	IDGD	
C=CCCC(C)(C)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1	1779029590	UUSNGLIWUCOHOJ-QFIPXVFZSA-N	429.521	1.121	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(Cl)cc3)C2)C1	1780718638	WDGZGPRWDHVLRQ-NRFANRHFSA-N	443.891	1.096	50	20	IDGD	
COc1cccc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](F)Br)C2)n1	1780770985	NOWNHTZFWSXSMR-DDUZABMNSA-N	444.301	1.908	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H]1C[C@@]13C(=O)Nc1ccccc13)CCO2	1781221368	CPVGQUXIEFBXCQ-ZXJYCPGTSA-N	431.920	1.744	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Cl)C2)C1CCC2(CC1)OCCO2	1781642501	MZXAVBBZOCZENF-GPMSIDNRSA-N	432.920	1.968	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(O)nn1)C2	1781901207	LVHYSVWSGJUMKR-RVZJWNSFSA-N	441.326	1.483	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1c3c(nn1C)CCC3)C2	1782179728	SOTBUOWPPCBBHM-LUQKVYGDSA-N	438.956	1.290	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H]2CCNC(=O)C2)C1	1782267570	HGYYIGDLEBTBSL-XTDOFWJNSA-N	444.370	1.058	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCn2ccnn2)C1	1782566532	QETBJYBKNBIODH-FHLIZLRMSA-N	432.352	1.418	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C=C/c2cnccn2)C1	1782620755	KSDVOQPKGVSZMP-ZHKIMASESA-N	437.338	1.787	50	20	IDGD	
C[C@H](O)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](Br)Cc3ccccc3)C2)C1	1783023271	VXIRPFZGRXHSJN-QOKNQOGYSA-N	425.323	1.203	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ncc(OC)cc3F)CCO2)C1	1783344556	RGIUBECHDNHGLL-FZKQIMNGSA-N	444.301	1.846	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cccc(C(=O)N(C)C)c3)CCO2)C1	1783883913	MWGLLHBBGJWKAT-DYESRHJHSA-N	437.924	1.086	50	20	IDGD	
O=C(NC1(c2ccc(NC(=O)c3ccc(O)cn3)cc2)CCC1)c1ccc(B(O)O)cc1	1787581428	IWIRWOQLCRQHKT-UHFFFAOYSA-N	431.257	1.529	50	20	IDGD	
COCCCC(=O)NC1(c2ccc(NC(=O)c3cnccc3C(=O)NN)cc2)CCC1	1789519750	IPFVCTDMPSXCQN-UHFFFAOYSA-N	425.489	1.859	50	20	IDGD	
CC[C@@H](C)[C@@H](N)C(=O)NC1(c2ccc(NC(=O)c3cnccc3C(=O)NN)cc2)CCC1	1789522887	SNYJLZOIUBQSOW-AUUYWEPGSA-N	438.532	1.806	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ncn(-c4ccccc4)n3)C[C@@H]21	1789859664	JYVKFKLQJHBSMP-OWLYRPNTSA-N	431.924	1.878	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3CCC4(CC3)OCCO4)C[C@@H]21	1789865564	YHBUDZLBEGCRHN-XSLAGTTESA-N	428.957	1.917	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)Cc3ccccc3)C[C@@H]21	1789871837	KWQHBUWMCGPGIH-SOADLSRISA-N	443.371	1.806	50	20	IDGD	
C[C@@H](CBr)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](N)Cc1cscn1)C2	1792987799	BWXYVONUOWYXJM-OPYWOCCESA-N	429.384	1.682	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CCN1C(=O)OC(C)(C)C	1793632096	SJIVYDFBHVUNNH-DGADGQDISA-N	429.945	1.603	50	20	IDGD	
Cc1nn(C)c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)CBr)C3)c1F	1794493621	XNHIJXWCNAHGOD-SGESHTKJSA-N	431.306	1.102	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnccn1	1794989608	KFDDDHMHYXLIME-XGUBFFRZSA-N	437.928	1.861	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)Nc1nccs1	1796417563	LLRCYASEBMCKHC-PEBLQZBPSA-N	445.383	1.707	50	20	IDGD	
Cc1nc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CCC(=O)NN(C)C)C3)c(C(F)(F)F)o1	1796858200	BAQUMJRPJKDCKE-CLLJXQQHSA-N	445.442	1.627	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1n[nH]c2cc(Cl)ccc12	1797510254	GZOBNDMAVDONAV-VAECKANCSA-N	441.315	1.673	50	20	IDGD	
CCc1noc(C)c1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](Br)CC)C2	1798177885	SUFINRWSHZESTM-OQMKEHIESA-N	428.327	1.922	50	20	IDGD	
CC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O	1798522408	VYTCGMKBZKQAEH-YVWYUNDQSA-N	447.444	1.093	50	20	IDGD	
COc1ccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@](C)(Cl)CCl)cc1O	1799273476	IPILVYJYRXSZIG-VLBMKZOESA-N	445.343	1.769	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCOc1ccc(F)cc1)C2)[C@H](F)Br	1799342873	KYRCFNVKLSFWAC-LZDSYCOUSA-N	447.276	1.875	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CS[C@@H]1CCCCO1)C2)[C@@H](F)Br	1799350385	XYTDNERIDFPGAR-OBRUSBNWSA-N	439.347	1.526	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(F)c(F)c1OC	1799677209	PDCWOQWGTYQHGE-DZJQYVJYSA-N	432.851	1.430	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1cc2ncccc2[nH]1	1799895990	LMRAZZALRNTJLE-OWLDWWDNSA-N	425.258	1.457	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ncc[nH]1)C2)[C@@H](Br)Cc1ccccc1	1800435361	GDHXFSVKFWNTSS-YVSFHVDLSA-N	447.333	1.619	50	20	IDGD	
C[C@H](Sc1ccccn1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)Br	1800763129	PCQYIRBXPVAJSM-YMSVYLFOSA-N	442.379	1.935	50	20	IDGD	
Cc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCC(=O)NN(C)C)cc1Cl	1801009250	VIQPEXHZGWUHLK-CWPLJXCYSA-N	436.940	1.225	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2cccnn2c1	1801037479	NIQPUZOZNJOUGS-BECFQBPISA-N	447.499	1.720	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(-n3c(O)nnc3O)cc1)C2	1802278972	GBMMDYFSDHFSTF-SLBVQIDZSA-N	449.895	1.184	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cn1cnc3ccccc31)C2	1802339673	HNRLQTINLQXYMZ-BJWYYQGGSA-N	426.521	1.048	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H](CNC(=O)c2ccc[n+]([O-])c2)[C@H]1c1cccnc1	1804783549	STIKLFVUIHUAOE-YLJYHZDGSA-N	428.565	1.886	50	20	IDGD	
Cn1cnc(C(=O)N2CC[C@H](CNC(=O)[C@H](F)Br)[C@H]2c2cccnc2)n1	1808652142	UFJPROGDNYAWLQ-UPJWGTAASA-N	425.262	1.220	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)c1cn2ncccc2n1	1809349065	CTYPBIWCWWFUPR-QILLFSRXSA-N	428.880	1.044	50	20	IDGD	
C=CC[C@H](C)C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1	1810306392	YFHAUYAQMSXJHT-KNBMTAEXSA-N	436.516	1.612	50	20	IDGD	
Cc1ocnc1C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1	1811081027	VRIANOWELVZOID-KXBFYZLASA-N	449.471	1.010	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1ccccc1	1811664497	WCUYOBARKLAAJA-IFMALSPDSA-N	429.285	1.395	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)COc2cccnn2)[C@@H]1c1cccnc1	1813033370	MGLDSJVCJRPDHJ-JTDSTZFVSA-N	433.896	1.210	50	20	IDGD	
O=C(CCBr)Nc1cc([C@H]2CCCCN2C(=O)c2nc3ncccn3n2)[nH]n1	1816780857	MKPJCHDTFHDKNL-GFCCVEGCSA-N	447.297	1.938	50	20	IDGD	
O=C(CCBr)Nc1cc([C@@H]2CCCCN2C(=O)CN2C(=O)C=CC2=O)[nH]n1	1816784556	ITEFRLXWDAOJRE-LBPRGKRZSA-N	438.282	1.112	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](O)CCl)CC2)c1cn2cc(F)ccc2n1	1819102946	VBDCRNWTPQJLJA-GWCFXTLKSA-N	437.884	1.755	50	20	IDGD	
C[C@H](Br)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1822182930	GJRXNGTUULOLLC-NHYWBVRUSA-N	449.114	1.179	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(=O)n2O)[nH]n1	1822186702	PPXSAPQDGDIUEG-ZYHUDNBSSA-N	438.282	1.898	50	20	IDGD	
CCCC(=O)N[C@H](C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](Cl)COC)n[nH]1	1822372203	DYBWQZJKJDLMJT-IPYPFGDCSA-N	427.933	1.960	50	20	IDGD	
C[C@@H](Cn1cccn1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1	1822410225	BZADUPVFBOCCHR-RDJZCZTQSA-N	444.540	1.308	50	20	IDGD	
CN1N=C(C(=O)N[C@H]2CCc3nc(NC(=O)[C@](C)(Cl)CCl)sc3C2)CCC1=O	1822861010	UEWVAKPKYZTLLU-HUTHGQBESA-N	446.360	1.900	50	20	IDGD	
O=C(N[C@@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1)c1cc(O)ncn1	1822999473	SCTVDJSJMCDTAG-KBUNVGBDSA-N	430.259	1.555	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H]2CCC(=O)N2)CC1	1824094676	XUWGCYFLWBBGRZ-FVQBIDKESA-N	428.371	1.916	50	20	IDGD	
Cc1cnc2c(C(=O)N3CCC([C@@H]4CCCCN4C(=O)[C@@H](O)CCl)CC3)cnn2c1	1824186516	NJJSLTLHMSABFG-ROUUACIJSA-N	433.940	1.871	50	20	IDGD	
C=CCOCCCC(=O)N1CCCC[C@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1	1824500851	OBPMSDLEKBPLHY-FQEVSTJZSA-N	436.597	1.962	50	20	IDGD	
Cc1ccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)nc1C	1825620364	QJAHSEGKEDDPOR-QHCPKHFHSA-N	449.360	1.925	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](C)n1cnnn1)CC2	1825648078	XVFKQAGYRDXCRU-YIZRAAEISA-N	428.316	1.086	50	20	IDGD	
O=C(c1ccns1)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827050380	QEJZJODAFOUTAP-GOSISDBHSA-N	427.335	1.370	50	20	IDGD	
O=C(NCC(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@H](O)CCl)CC1)c1ccco1	1827181848	JQIYXNGQOZVOLG-JKSUJKDBSA-N	425.913	1.229	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)nc2nccn12	1830366749	VPYCEFWHQAVVBO-NRFANRHFSA-N	449.939	1.373	50	20	IDGD	
CN[C@H](CC(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H](F)Br)CC1)C(=O)O	1830375911	WSFJOMMHEWPNGR-IPYPFGDCSA-N	436.322	1.359	50	20	IDGD	
O=C(Cc1ccc(Cl)c(F)c1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1830719932	PDOBWTZRSASTPY-APWZRJJASA-N	449.306	1.078	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)COc2ccc(O)nn2)CC1	1831116336	GXOXTJZBKWVSEV-HZPDHXFCSA-N	440.928	1.435	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)CCS(C)(=O)=O)CC2)CC1	1833534854	LMIMIFSVHJGMFX-QGZVFWFLSA-N	436.018	1.400	50	20	IDGD	
COc1nccnc1C(=O)NC1CCN(C2CCN(C(=O)CO[Si](C)(C)C)CC2)CC1	1833970143	XEVYVGNLVDNKSL-UHFFFAOYSA-N	449.628	1.522	50	20	IDGD	
O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)Cc1cccc(F)c1)CCO2	1835021381	XTDQMXVDPLWNTO-IBGZPJMESA-N	443.313	1.610	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)C(Cl)Cl)CC2)CC1)c1nc[nH]c1[N+](=O)[O-]	1835101036	GFAJQWSLZKCPGB-UHFFFAOYSA-N	433.296	1.307	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC1CCN(C2CCN(C(=O)CCN3CCCC3)CC2)CC1	1835838649	TWOBDHZCEQWGGS-UHFFFAOYSA-N	438.689	1.895	50	20	IDGD	
CCn1nc(C(=O)NC2CCN(C3CCN(C(=O)[C@H](Cl)COC)CC3)CC2)cc1C	1835992243	QBJKSXDAJZVSOH-GOSISDBHSA-N	439.988	1.650	50	20	IDGD	
CCc1cc(C(=O)NC2CCN(C3CCN(C(=O)C(Cl)Cl)CC3)CC2)nn1C	1836034439	RYJNDHVGQZGDQL-UHFFFAOYSA-N	430.380	1.971	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3cccnc3)CCO2)C1	1836182554	OVPSKPRELVJTSP-VQTJNVASSA-N	444.359	1.707	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3[nH]nc4ncccc34)CCO2)C1	1836451103	PIBGAECYEXRDJS-HXUWFJFHSA-N	435.912	1.293	50	20	IDGD	
COc1ccc(CCC(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)c(F)c1	1836692860	CGRMSWNAMAUUOU-UYAOXDASSA-N	446.878	1.758	50	20	IDGD	
O=C(c1cc2cn[nH]c2cn1)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836717391	WAENCAQZMYXMJC-GOSISDBHSA-N	435.912	1.170	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)CCS(C)(=O)=O)CC2)CC1	1836923527	TYRODRHKSNYWCM-KRWDZBQOSA-N	437.002	1.827	50	20	IDGD	
O=C(c1cc2cccnc2[nH]1)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1837011768	MSSVRSLZJXNQAD-SFHVURJKSA-N	427.288	1.437	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](OC(C)=O)C(C)C)CCO2	1837214761	ZNBUVWXOKVUBAJ-ABSDTBQOSA-N	432.945	1.438	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)CCBr)C3)C2)c(C)n1C	1838382273	SKOWPRFUDCTUQL-IBGZPJMESA-N	442.354	1.497	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)COc3ccccc3F)C2)C1	1839148119	NDRGRCXPWYKAMQ-YWZLYKJASA-N	428.888	1.678	50	20	IDGD	
O=C(CCCn1cccc1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839203247	FVLQAUNZTIUDMU-AEFFLSMTSA-N	446.317	1.415	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc4ccnn34)CCO2)C1	1839496957	LYDZYNNJAXOYQE-DYESRHJHSA-N	434.924	1.812	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc4nn(C)cc4c3)CCO2)C1	1839506082	ZKNAVXLZYBNMHB-UTKZUKDTSA-N	434.924	1.661	50	20	IDGD	
C[C@H](Cc1ccncc1)C(=O)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1839661481	ZBQOPKHCNDMWPL-AUUYWEPGSA-N	430.332	1.520	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(Cl)o3)C2)C1	1840032968	OYPMNLKZHXTDID-BZNIZROVSA-N	435.702	1.786	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3ccoc3)C2)C1	1840036890	RWEGHSVMJPTIEF-KDOFPFPSSA-N	429.311	1.452	50	20	IDGD	
C[C@H](C(=O)N1CCOC[C@]2(CN(C(=O)C(Cl)Cl)CCO2)C1)c1ccc(O)cc1	1840189317	KUIOJYBWIWNLMU-ORAYPTAESA-N	431.316	1.756	50	20	IDGD	
CC1(CC(=O)N2CC3(CCCN3C(=O)[C@@H](O)CCl)C2)CN(C(=O)OC(C)(C)C)C1	1841354657	NDIWLFDPKAWOQQ-AWEZNQCLSA-N	429.945	1.437	50	20	IDGD	
COC1(CC(=O)N2CC3(CCCN3C(=O)[C@@H](F)Cl)C2)CN(C(=O)OC(C)(C)C)C1	1843364003	LTEPJESRXJCCMU-CQSZACIVSA-N	433.908	1.750	50	20	IDGD	
O=C([C@H](O)CCl)N1CC2(CCCN2C(=O)c2cnc3ccc(Br)cn23)C1	1844146485	AQXDAMFMLSNIMI-CYBMUJFWSA-N	441.713	1.514	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)c2cc(OC)c(O)cc2[N+](=O)[O-])C1	1844738072	HAJYSPTVBGIQFT-GFCCVEGCSA-N	427.841	1.380	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)c2ccc(N3CCCCC3)cc2)C1	1845382187	ZYRNDONTTAWXFJ-UHFFFAOYSA-N	447.344	1.488	50	20	IDGD	
Cc1ccc(OC(C)(C)C(=O)N2CC3(CCCN3C(=O)CCC(=O)NN(C)C)C2)nc1	1846385588	WWZLTKWJOKHOBI-UHFFFAOYSA-N	431.537	1.124	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)Cc2cnn(C)c2)C1	1846636869	LHWHVDGTCFLSTH-UHFFFAOYSA-N	441.444	1.313	50	20	IDGD	
O=C(c1ccc(Br)c([N+](=O)[O-])c1)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl	1847562525	XUXJXVSMHBQBDT-OBJOEFQTSA-N	446.685	1.772	50	20	IDGD	
CC(C)(C)OC(=O)N1CCCC[C@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](O)CCl)C1	1847568196	FJLWTEYMGITKIT-QAETUUGQSA-N	443.972	1.825	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	14791219	PNYYUYILZVEALR-UHFFFAOYSA-N	428.470	1.183	50	20	IDGD	
CC(=O)N/C(=C\c1ccccc1)C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	14797993	YYHUUYKYPHLNLS-PYCFMQQDSA-N	435.528	1.523	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cc(Br)cn2C)cc1OC	16164847	APLKASPERZECJT-UHFFFAOYSA-N	440.250	1.423	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@@H](C)NC(=O)c2ccc(Cl)cc2)cc(OC)c1OC	26687294	KHUUOALVZQCKHY-LLVKDONJSA-N	435.864	1.945	50	20	IDGD	
COc1cc(OC)c2cc(C(=O)NNC(=O)c3n[nH]c(=O)c4ccccc34)[nH]c2c1OC	32671480	ZNVBFYJQZPRJPS-UHFFFAOYSA-N	437.412	1.505	50	20	IDGD	
O=C(CCc1ccncc1)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	117280414	FZRBDJYEDZOREU-UHFFFAOYSA-N	438.509	1.954	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NCc1ccc(F)cc1Br	725872777	GXPCRRSXZWDCEE-UHFFFAOYSA-N	429.271	1.910	50	20	IDGD	
CC[C@@H](CNC(=O)NNC(=O)CNC(=O)c1cccs1)N1CCc2ccccc2C1	725873830	RBALMNIIRYVAPG-KRWDZBQOSA-N	429.546	1.645	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)[C@@H](C)N2C(=O)NC3(CCCC3)C2=O)cc1	726498719	ZBOAWJSVPHQOHS-KGLIPLIRSA-N	432.477	1.253	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2cnc(-c3ccccn3)s2)ccc1Cl	727672081	ZLSWYDOCCUOBOR-UHFFFAOYSA-N	437.890	1.581	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN1C(=O)OCC(F)(F)F)c1cc(Br)c[nH]1	727799880	JCEMWHUXFYXLKE-VIFPVBQESA-N	427.177	1.702	50	20	IDGD	
CCCCC(=O)N1CSC[C@H]1C(=O)NNC(=O)c1nn(CCC)c(=O)c2ccccc12	727984397	NLSHDBVQYRDZMB-INIZCTEOSA-N	445.545	1.659	50	20	IDGD	
Cc1ccc(C(=O)N([C@@H]2CCS(=O)(=O)C2)N(C)C)cc1S(=O)(=O)N1CCCCC1	728177211	ZJFLOSVMVKBYBC-QGZVFWFLSA-N	443.591	1.276	50	20	IDGD	
NC(=O)[C@@H]1CC(C(=O)NNC(=O)c2cccc(OC(F)F)c2)=NN1c1ccc(F)cc1	728485275	VHKNLJAWZKWHEG-HNNXBMFYSA-N	435.362	1.308	50	20	IDGD	
O=C(CNC(=O)c1ccc2c(c1)OCO2)NNC(=O)c1cc(F)ccc1Br	728610853	NEZKIHOKCLEHIC-UHFFFAOYSA-N	438.209	1.508	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)c2ccc(C)c(S(N)(=O)=O)c2)c1	728612696	XYVSSAJEGJSPJE-UHFFFAOYSA-N	442.291	1.488	50	20	IDGD	
CCc1c(C(=O)OCC(=O)NNC(=O)Cc2nc(C)cs2)cnn1-c1ccc(F)cc1	728723331	OSFGCPASKGSGBG-UHFFFAOYSA-N	445.476	1.886	50	20	IDGD	
CC(=O)N1CCN(CCOc2ccc(CCNC(=O)NNC(=O)CC(C)(C)C)cc2)CC1	728754707	CWQODWRKVBHBOQ-UHFFFAOYSA-N	447.580	1.539	50	20	IDGD	
CCNC(=O)CN(CC)C(=O)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1	728952967	UBUWULAJQAVDRF-NRFANRHFSA-N	437.544	1.812	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2nn(-c3ccccc3F)cc2O)cc(OC)c1OC	729283101	OCKWANLGYIBQLV-UHFFFAOYSA-N	430.392	1.818	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2nc(C(C)(C)C)cs2)c1	729622540	LKXWLVQYQBVSOH-UHFFFAOYSA-N	439.563	1.835	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2ccc(Cl)nc2)nnn1-c1cccc2c1CCN(C)C2	731472333	XVUBRZVEPLHDCI-UHFFFAOYSA-N	425.880	1.687	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)[C@H](CCSC)N1C(=O)[C@H]2CCCC[C@H]2C1=O	731491151	CQHPEWVHFGCDAM-LZWOXQAQSA-N	433.530	1.753	50	20	IDGD	
CCNC(=O)COc1ccc(CNC(=O)NNC(=O)c2ccccc2OC)cc1OC	731498354	MMKTZNAKWHVBFA-UHFFFAOYSA-N	430.461	1.363	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1	732086520	YDGWJQZDWRYJEH-NSHDSACASA-N	434.430	1.193	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)N1CCN(S(=O)(=O)c2ccc3c(c2)CCC3)CC1	732197775	ZNEAFEFNYVBMGX-MRXNPFEDSA-N	436.578	1.064	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)N[C@@H](C)CN2CCN(c3ccccn3)CC2)c1	735585196	BZTBYRZOUXOEDQ-IBGZPJMESA-N	440.548	1.618	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CN2CCN(C(=O)[C@@H](C)Oc3ccccc3C)CC2)cc1	736622639	AGRPZZGRPDDNAX-LJQANCHMSA-N	438.528	1.676	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)nn1	737777991	QKSHIONGJNQNRC-UHFFFAOYSA-N	430.428	1.262	50	20	IDGD	
CN1CCN([C@@H](CNC(=O)NNC(=O)COCc2ccccc2)c2cccs2)CC1	738963178	KJIFITVHUIFKAR-SFHVURJKSA-N	431.562	1.584	50	20	IDGD	
CC(=NNC(=O)COc1ccccc1C#N)c1cccc(S(=O)(=O)N2CCOCC2)c1	739399702	IVYQGRJAHRMXES-UHFFFAOYSA-N	442.497	1.498	50	20	IDGD	
Cn1nc(Br)c2c(=O)n(CC(=O)NNc3cccc(C(F)(F)F)n3)cnc21	740132313	FJGICNCIHHCDMS-UHFFFAOYSA-N	446.187	1.450	50	20	IDGD	
Cn1cc(S(=O)(=O)N2CCC(NC(=O)NNc3ccccc3C(F)(F)F)CC2)cn1	741425248	LBPKVWHRXTUMFS-UHFFFAOYSA-N	446.455	1.918	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)[C@@H]1CCCN(c2ncnc3sccc23)C1	742612312	JHKWTKNPFZMJAI-GFCCVEGCSA-N	444.542	1.547	50	20	IDGD	
Cn1c(N)c(C(=O)/C(C#N)=C/c2cc(Cl)ccc2OC[C@H]2CCCO2)c(=O)n(C)c1=O	743248508	VTNJVDNFZVMTSJ-XETPBLJFSA-N	444.875	1.667	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)c2ccccc2I)cc1	744473919	IJYINESLNGHWCJ-UHFFFAOYSA-N	449.204	1.781	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)[C@H]2CCCN2c2ncnc3sccc23)c1	744959883	VTASFGJIBKDGBR-MRXNPFEDSA-N	439.497	1.973	50	20	IDGD	
O=C(Cn1cc(C(=O)NNC(=O)c2ccc3c(c2)OCCO3)cn1)NC1CCCCC1	746582800	JJPTYZPRRKCFML-UHFFFAOYSA-N	427.461	1.178	50	20	IDGD	
O=C1CN(C(=O)c2ccc(CNC(=O)NNC(=O)c3ccc(Cl)cc3F)cc2)CCN1	747493636	BDUQSOFPKWIEHT-UHFFFAOYSA-N	447.854	1.195	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2ccc[nH]2)cc1S(=O)(=O)N1C[C@@H](C)C[C@H](C)C1	747663404	MIJHSXFCFJFVSC-KBPBESRZSA-N	434.518	1.765	50	20	IDGD	
Cn1ccnc(NNC(=O)c2cccc(S(=O)(=O)Nc3ccc(Cl)cc3)c2)c1=O	747941932	GVSXCZBUKIFUBG-UHFFFAOYSA-N	433.877	1.991	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)N[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	748637265	ZCFGSJWKHDLSED-CZUORRHYSA-N	432.443	1.662	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(\C#N)C(=O)OCC(=O)N2CCCC[C@H]2C(N)=O)c1C	749010249	JSVHFVMACDKXBU-GAFVEGQGSA-N	430.505	1.629	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@H]1CCCN(Cc2cccnc2)C1	749160944	HNHVWJZYWDXBDI-KRWDZBQOSA-N	444.561	1.356	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN1C(=O)c1ccc2c(c1)OCO2)c1ccc([N+](=O)[O-])cc1	749562975	USOQVRPWKYSDTG-OAHLLOKOSA-N	426.385	1.389	50	20	IDGD	
C[C@@H](NC(=O)CC1CCCCC1)C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	749838499	PICVAGCQZAXWOO-LJQANCHMSA-N	443.592	1.821	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@@H]2CCC[C@H]([S@@](=O)CC)C2)c2ccccc2c1=O	750670838	NEWRFGKMOWDIOS-PWNDQGHQSA-N	433.534	1.440	50	20	IDGD	
Cc1nn(CCCl)c(C)c1C(=O)N1CCC(C(=O)NCCCN2CCOCC2)CC1	751022284	UEWQMBXADNXQQM-UHFFFAOYSA-N	439.988	1.429	50	20	IDGD	
CCOc1ccccc1C(F)(F)C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	753390976	BQASLDGRSOFTPA-UHFFFAOYSA-N	447.847	1.939	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)c2cnccn2)cc1S(=O)(=O)N1CCCCCC1	755393421	OTHMFEMALCNSKG-UHFFFAOYSA-N	432.506	1.816	50	20	IDGD	
CON(C)S(=O)(=O)c1ccc(NC(=O)NNC(=O)COc2ccc(Cl)cc2)cc1	755534581	NGRNUOBOQLXPNK-UHFFFAOYSA-N	442.881	1.754	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccc(NC(=O)NNC(=O)Cc3ccccc3F)c2)CC1	756212726	OTXIXZRGMURYIW-UHFFFAOYSA-N	449.508	1.157	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Nc2ccc(C(=O)N(C)OC)cc2)cc(OC)c1OC	756504033	OQQZLCIGBQLRJU-UHFFFAOYSA-N	432.433	1.812	50	20	IDGD	
COC(=O)c1ccc(NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1Cl	756644001	WZBMVBHVMYPOHM-UHFFFAOYSA-N	429.820	1.840	50	20	IDGD	
CS(=O)(=O)c1ccccc1-n1cc(NC(=O)NNC(=O)c2ccc(Cl)nc2)cn1	756706244	NZOJHKPJAHMYLY-UHFFFAOYSA-N	434.865	1.791	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)Nc1cnn(CC(=O)N2C[C@@H](C)O[C@H](C)C2)c1)c1ccccc1	756839713	SCQOTNMQKLEZFK-MDZRGWNJSA-N	442.520	1.865	50	20	IDGD	
NC(=O)c1ccc(NNC(=O)Cc2ccc(NS(=O)(=O)c3cccs3)cc2)nn1	757403249	ZGEPUFIFQHIYAZ-UHFFFAOYSA-N	432.487	1.124	50	20	IDGD	
COCCS(=O)(=O)c1ccc(CNC(=O)NNC(=O)Cc2ccc(Cl)cc2)cc1	759291020	RVYINFZENNASDI-UHFFFAOYSA-N	439.921	1.833	50	20	IDGD	
CCO[C@@H]1C[C@@H](NC(=O)NNC(=O)c2nn(CC)c(=O)c3ccccc23)[C@@]12CCCO2	760141720	HGPGRMIEZINXBH-ZOCZFRKYSA-N	429.477	1.087	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1O)C(=O)Nc1ccnn1Cc1ccc(F)cc1	760276902	FNEWBIOXGWBVCZ-UHFFFAOYSA-N	431.811	1.829	50	20	IDGD	
NC(=O)CC[C@H](NS(=O)(=O)c1ccccc1C(F)(F)F)C(=O)NNc1ccccn1	760489246	DYTQSOOGTJJNKF-LBPRGKRZSA-N	445.423	1.156	50	20	IDGD	
COC(=O)c1cc(Cl)cc(S(=O)(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)c1	763439925	YMNTVZKDTMORRX-UHFFFAOYSA-N	449.913	1.741	50	20	IDGD	
COc1ccc(CN(C)C)cc1NC(=O)C(=O)NNC(=O)c1ccc(OC)c(OC)c1	763550744	RCLKBMZDKJGWOH-UHFFFAOYSA-N	430.461	1.174	50	20	IDGD	
CCOC(=O)c1c(C)csc1NC(=O)C(=O)NNC(=O)c1c(C)nc2ccccn12	763630436	ZPKLHNMVXGLGRV-UHFFFAOYSA-N	429.458	1.589	50	20	IDGD	
CCNS(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2ccc(OC)c(OC)c2)cc1	763654227	BHRRCCTVAMGQMJ-UHFFFAOYSA-N	436.490	1.146	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(NC(=O)OC)c(F)c1	763716832	NAKFCJGTEBZMNI-UHFFFAOYSA-N	432.408	1.731	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)nn1-c1ccccc1	763746347	SRIUNLBLWUFFQX-UHFFFAOYSA-N	432.484	1.719	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(Oc2ccccn2)cc1	763812137	DBPBQKQYJRTNCE-UHFFFAOYSA-N	431.408	1.910	50	20	IDGD	
COC(=O)c1c(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)sc(C)c1C	763872364	NOUPETXXOYWZTF-SNVBAGLBSA-N	437.449	1.844	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2cccc(OCC(F)(F)F)c2C)n1	763886295	RYPIFPXSTJJKLB-UHFFFAOYSA-N	427.383	1.536	50	20	IDGD	
CC(C)Oc1c(F)cc(NC(=O)C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1F	763917001	NNAYEWYFAJRCRI-UHFFFAOYSA-N	445.386	1.127	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ccc(Br)s2)cn1C	763941925	ZDHUCWQEHYOBCY-UHFFFAOYSA-N	429.252	1.035	50	20	IDGD	
CS(=O)(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(C(F)(F)F)c2)cc1	764037460	LBAPDNONVGBJQH-UHFFFAOYSA-N	443.403	1.650	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)[C@@H]1CCCN1C(=O)c1ccc2c(c1)OCO2	764045783	REVTWPDOQHCKRM-AWEZNQCLSA-N	443.481	1.665	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1cccc(Cl)c1S(C)(=O)=O	764048777	UNRKROLLGWUADI-UHFFFAOYSA-N	425.850	1.152	50	20	IDGD	
CCn1ncc2ccc(NC(=O)C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)cc21	764204992	WWPZYFDHDXXLBL-UHFFFAOYSA-N	432.481	1.447	50	20	IDGD	
O=C(NNC(=O)c1cc(Br)ccc1O)C(=O)Nc1ccc(-n2ccnn2)cc1	764280406	OLAFAEONIQZALB-UHFFFAOYSA-N	445.233	1.135	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)C(=O)Nc1ccc(F)c(-n2nnnc2C)c1)c1ccccc1	764328114	LGQSAVCBGPOEDY-OAHLLOKOSA-N	425.424	1.390	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C(=O)Nc1ccc(OCCC(=O)NC)cc1)c1ccccc1	764329372	XJJSFXHRSIWAJF-SFHVURJKSA-N	426.473	1.481	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)c1cc(F)ccc1I	764342002	BSTAKUZILRTOMP-UHFFFAOYSA-N	442.188	1.016	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)C(=O)Nc2ccccc2COc2ccc(CC#N)cc2)cn1	764360495	YXPIAOZHNRILBM-UHFFFAOYSA-N	432.440	1.465	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc2ccccc2)cc1NC(C)=O	764369292	BUVZFDJCFJVWPT-UHFFFAOYSA-N	436.371	1.411	50	20	IDGD	
CCn1ncc2ccc(NC(=O)C(=O)NNC(=O)c3cc(-c4ccccc4OC)[nH]n3)cc21	764376496	DWHLMFNYYOXKGB-UHFFFAOYSA-N	447.455	1.855	50	20	IDGD	
O=C1C[C@@H](c2cccc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc3ccccc3)c2)CN1	764379696	HRCREHHNVMIJEG-CYBMUJFWSA-N	432.383	1.048	50	20	IDGD	
O=C(CCC(=O)N1CCN(c2ccccn2)CC1)NNC(=O)c1cc2c(s1)CCC2	764545392	ZPUPHBPWBWIKKH-UHFFFAOYSA-N	427.530	1.522	50	20	IDGD	
N#Cc1cccnc1-n1cc(NC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cn1	764740903	QRKKRFSAXXMHIL-UHFFFAOYSA-N	429.400	1.497	50	20	IDGD	
CCC(CSc1ccc(Cl)cc1)=NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C	764818044	QOFWULSIBLLWFF-UHFFFAOYSA-N	448.936	1.762	50	20	IDGD	
COCCCNC(=O)NNC(=O)CSc1nnc(-c2ccco2)n1-c1ccccc1	765122835	YSCWDQDQOPDHBN-UHFFFAOYSA-N	430.490	1.986	50	20	IDGD	
CNS(=O)(=O)c1ccc(CCC(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)cc1	765567660	IYQWTZVZFNKETD-UHFFFAOYSA-N	433.515	1.440	50	20	IDGD	
CC(C)(C)CC(=O)NCC(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	765758810	QIFITNBPZPNBFE-UHFFFAOYSA-N	437.972	1.157	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)N[C@H]2CCC[C@@H]2C(=O)NC)c2ccccc2c1=O	766277518	ULMUXFMOSZBUNR-IRXDYDNUSA-N	442.520	1.445	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)N[C@@H]3CC(=O)N(c4ccc(Cl)c(F)c4)C3)nc21	766865243	GIOBGYQUAPJODL-MRVPVSSYSA-N	434.819	1.293	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)COc1ccc(N2CCCC2=O)cc1	767264835	XQHQFJPCMPDMBI-UHFFFAOYSA-N	439.468	1.434	50	20	IDGD	
O=S(=O)(CBr)N1CCN(S(=O)(=O)Cc2cc(Cl)ccc2F)CC1	767849445	FFPCSWWAKMUGBO-UHFFFAOYSA-N	449.751	1.609	50	20	IDGD	
CC[C@H](N=c1nn[nH]n1-c1ccccc1)C(=O)NNC(=O)c1cc(-c2cccs2)[nH]n1	768267791	COXHNJVYEMXNHM-ZDUSSCGKSA-N	437.489	1.188	50	20	IDGD	
COCCOc1ccccc1N1CCN(CC(=O)NNC(=O)c2cccc(C)c2)CC1	768553598	XOGQLUMORQPORN-UHFFFAOYSA-N	426.517	1.603	50	20	IDGD	
COCCCNC(=S)N(C)NC(=O)c1sc2nc3n(c(=O)c2c1C)CCCCC3	768737610	JIDDKOBICSVWEN-UHFFFAOYSA-N	437.591	1.980	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)[C@H](F)c1ccccc1	768964090	BLJNXFUCHOTPFT-HXUWFJFHSA-N	449.504	1.498	50	20	IDGD	
CSCCNC(=S)NNC(=O)[C@@H](C)N1C(=O)c2ccc(Br)cc2C1=O	770240668	QGIKYUSBMWMFNR-MRVPVSSYSA-N	445.364	1.292	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)[C@H](C(C)C)N2CCCS2(=O)=O)c1	772696088	ZFLBQLPQILPSJS-AWEZNQCLSA-N	448.339	1.279	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=S)NCc1ccc(S(N)(=O)=O)cc1	773193273	NOKUOFUBJWFHLA-LLVKDONJSA-N	442.950	1.450	50	20	IDGD	
C[C@@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(NC(=O)C(=O)NNc3ncccn3)cc2)C1	773723639	CIIDYTKXTQVYQV-ZIAGYGMSSA-N	432.506	1.225	50	20	IDGD	
O=C(NNc1cccc(Cl)c1)C(=O)Nc1cccc(S(=O)(=O)NC2=NCCC2)c1	773746044	TZXOYZXKQJPKCK-UHFFFAOYSA-N	435.893	1.892	50	20	IDGD	
CCOC1CC(CNC(=O)NNC(=O)COc2ccccc2CC)(N2CCOCC2)C1	775144001	DARYVMZLDUYYAA-UHFFFAOYSA-N	434.537	1.228	50	20	IDGD	
O=C(NNS(=O)(=O)C1=Cc2ccccc2OCC1)c1csc(N2CCOCC2)n1	775252035	NRVHOLYWLCTNKP-UHFFFAOYSA-N	436.515	1.368	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@H](C(=O)NNc2ncc(Cl)cc2Cl)[C@@H](C)O)cc1	775265324	LQEKBWYAPQQOQT-YGRLFVJLSA-N	433.317	1.868	50	20	IDGD	
O=C(NNC(=O)c1cccc(Cl)c1)Nc1ccc(S(=O)(=O)N2CCOCC2)cn1	776061582	LMIOSIOKRXEVPH-UHFFFAOYSA-N	439.881	1.222	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1Cl)N[C@@H]1CCO[C@]2(CCS(=O)(=O)C2)C1	776077048	PWZDHPJFZHLZQZ-BDJLRTHQSA-N	436.317	1.674	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)NC2CCN(S(=O)(=O)CC(C)C)CC2)c1	776885689	QAIXMPQRXUKKRW-UHFFFAOYSA-N	426.539	1.154	50	20	IDGD	
CCOC(=O)N1CCC[C@@H]([C@@H](C)NC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])C1	777262392	OBJHSNYEWTUDFY-ZIAGYGMSSA-N	437.453	1.561	50	20	IDGD	
CCOC(=O)N1CCC[C@H]([C@@H](C)NC(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)C1	777263862	BPHHTVKDXZQBTH-CVEARBPZSA-N	433.509	1.829	50	20	IDGD	
Cc1cc(Br)c2c(c1)CN(C(=O)NNC(=O)CNC(=O)c1ccco1)CC2	777498117	HSHGTAITAZYMOA-UHFFFAOYSA-N	435.278	1.879	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCN(C(=O)N(C)C)CC1(C)C	777739245	FOGUCNQTNDISIV-UHFFFAOYSA-N	425.917	1.187	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)c2cccc(S(=O)(=O)NC3CCCC3)c2)nc1C	778421092	FSAXQKQGMDSYAJ-UHFFFAOYSA-N	447.517	1.940	50	20	IDGD	
COCCc1nnc(-c2cccc(C(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)c2)o1	778592933	QXZAIYMNESGJDC-UHFFFAOYSA-N	444.469	1.404	50	20	IDGD	
CC(C)(C)n1cnc(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2Br)n1	778756972	YGYWHXCUZSUWBM-UHFFFAOYSA-N	426.231	1.786	50	20	IDGD	
O=C(COC(=O)c1cc(Cl)ncc1Cl)NNC(=O)[C@H]1COc2ccccc2O1	781365663	BLCGENGICIACEP-CYBMUJFWSA-N	426.212	1.533	50	20	IDGD	
O=C(CN[C@@H](CN1CCOCC1)c1ccccc1)NNC(=O)c1ccc([N+](=O)[O-])cc1	782448208	KLDYRBPNUGVGCY-IBGZPJMESA-N	427.461	1.019	50	20	IDGD	
Cc1nc(NC(=O)OC(C)(C)C)sc1C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	782552897	LQECSBUIFLSDCK-UHFFFAOYSA-N	444.477	1.849	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ncccc2C(F)(F)F)cc1	783120439	MDXQYBQBCUIETL-UHFFFAOYSA-N	445.423	1.869	50	20	IDGD	
O=C(NNc1nccc2sccc12)C(=O)Nc1ccc(S(=O)(=O)NC2CC2)cc1	783435359	FDRGVGLBBADVFL-UHFFFAOYSA-N	431.499	1.819	50	20	IDGD	
O=C(NNc1ccc(-n2cccn2)nn1)C(=O)Nc1ccc2c(c1)CCC(=O)N2CC1CC1	783436461	LHIGLUPSHZQGAA-UHFFFAOYSA-N	446.471	1.433	50	20	IDGD	
C[C@H](C#N)CSc1ccccc1NC(=O)C(=O)NNC(=O)CNC(=O)c1ccco1	784003024	ZQODSMMOXJRRSY-GFCCVEGCSA-N	429.458	1.047	50	20	IDGD	
CNS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccc(C#N)c(C(F)(F)F)c2)cc1	784238628	RJJLBYVNYWQEPH-UHFFFAOYSA-N	441.391	1.567	50	20	IDGD	
O=C(NNc1ccc(Cl)nc1)C(=O)N1C[C@H](C(=O)N2CCCCC2)Oc2ccccc21	784870388	QAGKPFQKEQBAOQ-QGZVFWFLSA-N	443.891	1.985	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)Nc1cc(Br)ccc1F	785023597	LWJYRGQIOWLELY-UHFFFAOYSA-N	441.169	1.602	50	20	IDGD	
C[C@@H](OC(=O)/C(C#N)=C\c1ccccc1)C(=O)NCCc1ccc(S(N)(=O)=O)cc1	785364548	QGELDEKFZMNFJW-QLENYVDCSA-N	427.482	1.532	50	20	IDGD	
O=C(COC(=O)[C@H]1CC=CC[C@H]1C(=O)N1CCOCC1)NNC(=O)c1cccc(Cl)c1	785712525	IHUCLHKHPJGJFN-SJORKVTESA-N	449.891	1.085	50	20	IDGD	
COC(=O)CCc1cccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)c1	786414700	QFOGABPMCPSSKZ-ZDUSSCGKSA-N	431.420	1.485	50	20	IDGD	
CCOC(=O)c1ccc(C)c(S(=O)(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)c1	788743708	JVSCHHJUGVIGAJ-UHFFFAOYSA-N	433.486	1.737	50	20	IDGD	
CN(NS(=O)(=O)Cc1ccc(F)cc1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	788917882	XHUVHWLGQIOJMR-UHFFFAOYSA-N	430.502	1.765	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@H](C)C(=O)NNC(=O)Cc1c(C)nc2nc(N)nn2c1C	788985913	RDDODSYARJZPGB-CYBMUJFWSA-N	445.911	1.751	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccc(Br)nc1OC	789584575	OCXBWFGMRHMSSM-UHFFFAOYSA-N	437.250	1.190	50	20	IDGD	
CC(C)(C)[C@H]1CCc2nc(NC(=O)C(=O)NNC(=O)CNC(=O)c3ccco3)sc2C1	789756420	DIOLDRLNRFNRRR-NSHDSACASA-N	447.517	1.403	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2ccc(C(N)=O)c(OC(C)C)c2)n1	789768583	JIODNYPBHMYHLP-UHFFFAOYSA-N	429.481	1.291	50	20	IDGD	
COC(=O)c1cn(CCNC(=O)NNC(=O)c2ccc(Br)cc2Cl)nn1	790708431	HFZAAAURZYNOPJ-UHFFFAOYSA-N	445.661	1.125	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccccc1N1C[C@H]2CC[C@H]1C2	790952917	XSDPOIRVRZOFAX-RDJZCZTQSA-N	433.468	1.712	50	20	IDGD	
CO[C@@H]1CCOc2c(NC(=O)C(=O)NNC(=O)c3cc([N+](=O)[O-])ccc3O)cccc21	790958372	BDFLNNIYICSWJU-OAHLLOKOSA-N	430.373	1.170	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NC[C@H]2CCN(Cc3ccccc3)C2)c2ccccc2c1=O	792226511	QZZYHCOVRQCPKV-GOSISDBHSA-N	448.527	1.883	50	20	IDGD	
CCCCn1ncc(NC(=O)C(=O)NNC(=O)CNC(=O)c2cccs2)c1C(C)C	792281661	XGJXLQJLJFTZGA-UHFFFAOYSA-N	434.522	1.384	50	20	IDGD	
CNC(=O)c1cc2cc(NC(=O)C(=O)NNC(=O)CSc3ccc(C)cc3)ccc2[nH]1	792352129	BNEOUJHMFIMQQL-UHFFFAOYSA-N	439.497	1.714	50	20	IDGD	
COC(=O)CCCOc1ccc(NC(=O)C(=O)NNc2ccc3c(=O)[nH]ccc3c2)cc1	793070063	MBIIBFXTXIFACW-UHFFFAOYSA-N	438.440	1.942	50	20	IDGD	
CC(C)[C@H](C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1)n1nnc(-c2ccccc2)n1	794717272	LDRJKPRTECSNCI-GOSISDBHSA-N	443.533	1.931	50	20	IDGD	
O=C(CCCS(=O)(=O)c1ccc(Cl)cc1)NNC(=O)COc1ccccc1O	796252439	AQQSVKQTAZBVHA-UHFFFAOYSA-N	426.878	1.826	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cccc([N+](=O)[O-])c2OC)cc1OC	796305678	MBGFYCQQEXCKOC-UHFFFAOYSA-N	433.373	1.239	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NC[C@]2(C)CCN(Cc3ccccc3)C2)c2ccccc2c1=O	798483734	LIHAFBWOWRRVCB-DEOSSOPVSA-N	448.527	1.790	50	20	IDGD	
N#Cc1cc(S(=O)(=O)NNC(=O)[C@H]2COc3ccccc3O2)ccc1C(F)(F)F	799914369	LWEBOUFAVNUJBR-OAHLLOKOSA-N	427.360	1.727	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2ccc3c(c2)C(=O)N(C[C@@H]2CCCO2)C3=O)cc1	802056751	AHKGRWXLZRGJOJ-INIZCTEOSA-N	438.440	1.937	50	20	IDGD	
CC(C)(C)OC(=O)N1CCc2[nH]nc(C(=O)NNC(=O)Nc3ccc4c(c3)OCO4)c2C1	802098821	BPQNLIJPIXQUOX-UHFFFAOYSA-N	444.448	1.898	50	20	IDGD	
COc1ccc(S(=O)(=O)NCC(=O)NNc2nc(-c3ccccc3)no2)cc1OC	810338945	DOWAHORRGCXJAB-UHFFFAOYSA-N	433.446	1.175	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)C2CCCC2)c(C(=O)NCC(F)(F)F)cc1F	810384593	NHUAIKOCIDESLA-UHFFFAOYSA-N	432.374	1.702	50	20	IDGD	
COC(=O)c1c(F)ccc(NC(=O)C(=O)NNC(=O)COc2cc(C)cc(C)c2)c1C	810385613	WLWOJGLFOULPSA-UHFFFAOYSA-N	431.420	1.702	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc2ccccc2c1)NNC(=O)Cc1cn2ccccc2n1	810466639	VTUBPMDYJLNECY-UHFFFAOYSA-N	437.481	1.156	50	20	IDGD	
COc1ccc(S(=O)(=O)NCC(=O)NNc2ncc(Cl)cc2Cl)cc1OC	811164673	WTYRSRMYLWQCJW-UHFFFAOYSA-N	435.289	1.827	50	20	IDGD	
Cc1cccc2c1OC[C@@H](NC(=O)NNC(=O)CCN1CCN(c3ccccc3)CC1)C2	812637419	ZSEKNQKUCLGPPW-FQEVSTJZSA-N	437.544	1.841	50	20	IDGD	
CC(=NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)c1cc2c(cc1[N+](=O)[O-])OCO2	814725722	NHDPGPBWVQNMMJ-UHFFFAOYSA-N	434.430	1.728	50	20	IDGD	
NS(=O)(=O)c1ccc(NC(=O)NN=C2C(=O)Nc3cccc(C(F)(F)F)c32)cc1	814970259	VYNTUXBXBNKYRW-UHFFFAOYSA-N	427.364	1.831	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)C[C@@H]3CCCS(=O)(=O)C3)n[nH]2)cc1OC	815886782	JAIIOOZOYVNJAQ-LBPRGKRZSA-N	436.490	1.070	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)c1ccc(=O)n(-c2ccc(F)cc2)n1	817054340	FMFMOVNSVXHJFW-UHFFFAOYSA-N	431.449	1.379	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)N2CCC(NS(C)(=O)=O)CC2)c(C)n1C[C@@H]1CCCO1	843901584	QZZLMHRDRVOYOP-SQWSFHKJSA-N	434.562	1.731	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(\C#N)C(=O)O[C@H](C)C(=O)N2CCC[C@H](C(N)=O)C2)c1C	913150255	QQHMEDGSGSJBTA-QZTICVBNSA-N	444.532	1.875	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)[C@H]2CC(=O)N(c3ccc(F)cc3F)C2)c2ccccc2c1=O	914750405	HLLGQCSDBYBAAN-NSHDSACASA-N	441.394	1.026	50	20	IDGD	
O=C(CN1c2cccc3cccc(c23)S1(=O)=O)NN=Cc1cnc(N2CCCC2)nc1	914773608	YIWSBQTZEUQORT-UHFFFAOYSA-N	436.497	1.889	50	20	IDGD	
C[C@@H]1[C@@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)CCC[C@H]1C	915890582	WUPAHFFWSCGKDK-VKJFTORMSA-N	438.550	1.476	50	20	IDGD	
CC(=NNC(=O)c1csc(N2CCOCC2)n1)c1cccc(S(=O)(=O)N(C)C)c1	915952892	BIKYEPPAUJLAOC-UHFFFAOYSA-N	437.547	1.384	50	20	IDGD	
C[C@@H]1CN(c2ccccc2C=NNC(=O)Cc2csc(N3CCOCC3)n2)CCO1	915953772	BJGZCSMOKXUNEU-MRXNPFEDSA-N	429.546	1.898	50	20	IDGD	
CCC(=O)Nc1cccc(CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)c1	916381419	GOKAXHKNCVBWRW-UHFFFAOYSA-N	432.506	1.472	50	20	IDGD	
CCCS(=O)(=O)N1CCC(NC(=O)NNC(=O)CCSc2ccc(F)cc2)CC1	916383927	WLQAKELFBJSMGH-UHFFFAOYSA-N	446.570	1.843	50	20	IDGD	
COc1cc([C@@H](C)NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc(OC)c1OC	916482090	GTCSEDAXSDVAKD-GFCCVEGCSA-N	441.448	1.393	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)COc2ccc(OC)cc2)sc(C)c1C	916562874	MVNJWGGBYSSYHV-UHFFFAOYSA-N	449.485	1.715	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCc3c(cnn3-c3ccccc3)C2)cc1OC	917112930	ZINJHVLKVIBFFG-UHFFFAOYSA-N	435.484	1.709	50	20	IDGD	
COc1ccc(CNC(C)=O)cc1S(=O)(=O)NNC(=O)c1ccc(Cl)cc1O	917758062	MSTBZPMKIKTEKQ-UHFFFAOYSA-N	427.866	1.314	50	20	IDGD	
Cc1cc(C)cc(-n2ccnc2SCC(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)c1	919884966	LVRIEYNOASNMLJ-CQSZACIVSA-N	437.547	1.099	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)N2CCC(=NNC(=O)Cn3nc(C)cc3C)CC2)cc1	920366260	LCNPKNQFSKBLQE-UHFFFAOYSA-N	446.533	1.415	50	20	IDGD	
CC(=NNC(=O)NCc1ccco1)c1ccc(S(=O)(=O)N2CCC(C(=O)O)CC2)cc1	920825008	BDNRYFHMEOKANS-UHFFFAOYSA-N	448.501	1.988	50	20	IDGD	
C[C@@H]1CN(S(=O)(=O)c2cc(C(=O)NNC(=O)NCC3CC3)ccc2Cl)C[C@@H](C)O1	920860172	IXTIEPOFBRDBHE-VXGBXAGGSA-N	444.941	1.492	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2ccc(OC)cc2)cc1	1115850793	OOTLBYWTGKYDID-UHFFFAOYSA-N	434.518	1.870	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cc(=O)n(C)c3ccccc23)cc1OC	1115882389	DPRCLGDXQBYLHI-UHFFFAOYSA-N	439.424	1.174	50	20	IDGD	
CC(C)n1ncc2c1[C@H](NC(=O)NNC(=O)C1CCN(c3ncccn3)CC1)CCC2	1320388764	WRTCLOMHHQWCHW-QGZVFWFLSA-N	426.525	1.878	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)NCCN1C(=O)COc2ccccc21	1320730438	DDNVTTZBVYKMDA-UHFFFAOYSA-N	428.445	1.220	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCCCNS(=O)(=O)c2ccccc2Cl)cc1	1321186125	XOXVYSSSTDAABW-UHFFFAOYSA-N	440.909	1.661	50	20	IDGD	
CN(CCNS(C)(=O)=O)C(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccccc1	1321794378	ULPQKJBCTNABFP-LGMDPLHJSA-N	426.502	1.378	50	20	IDGD	
O=C(NNC(=O)[C@H]1CC(=O)N(c2ccc(F)cc2F)C1)c1cncn1-c1ccccc1	1322657187	WKNBWCUROOACMX-ZDUSSCGKSA-N	425.395	1.965	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3n[nH]c4cc(Cl)ccc34)C2)C1	1778666970	MNPQPFJLGVYACN-KUHUBIRLSA-N	441.315	1.914	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](NC(C)=O)c3ccc(F)cc3)C2)C1	1780910706	LVVHZYLMBYRFCS-LQWHRVPQSA-N	439.915	1.850	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](F)Br)C3)C2)n1	1781326495	PNKVZNFAYSKSFG-YOEHRIQHSA-N	443.273	1.174	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)C2)C1	1781765630	HBUYDKUPBMVZFD-YJBOKZPZSA-N	429.832	1.431	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1ccc3ncnn3c1)C2	1782174045	ZGPOYZRFFOXNPN-CSODHUTKSA-N	449.939	1.040	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CCC(=O)NN(C)C)C2)nc1C	1782209523	XUJJVQBZEIJUKE-AUSIDOKSSA-N	445.564	1.199	50	20	IDGD	
Cc1nn[nH]c1C(=O)N1CCO[C@@]2(CCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1	1782864822	UWWNPIVNDQDDOU-JTVVXKTLSA-N	442.426	1.442	50	20	IDGD	
CCC[C@@H](NC(C)=O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](Cl)COC)C2	1783191013	PPEFVPQKKHAPDT-WOCWXWTJSA-N	431.961	1.059	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cccn4nccc34)CCO2)C1	1783351818	DIAMHSHHOZOYOR-HNAYVOBHSA-N	435.322	1.951	50	20	IDGD	
CC(C)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4c(c3)NC(=O)CO4)C[C@@H]21	1783851537	CIVMUGSUXUOICG-MPGHIAIKSA-N	449.935	1.876	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cc(C(F)(F)F)ccn3)CCO2)C1	1783877769	PMKKBTUWLWIWRB-SUMWQHHRSA-N	435.830	1.798	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1ccc3scnc3c1)CCO2	1783934700	KXSPDTJFGLDNNR-NRFANRHFSA-N	445.545	1.113	50	20	IDGD	
COc1cc(C)c(C)cc1C(=O)N1CCO[C@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1	1783935688	XFWKABITHSQGBF-QHCPKHFHSA-N	446.548	1.129	50	20	IDGD	
CCC[C@H](NC(C)=O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]2C1	1783975406	OCTZEDQTCCLDEO-SRQBIAJPSA-N	446.386	1.302	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]3C2)cc(C)c1C(=O)O	1784092452	NVWQUADCQBSBME-LLLHUVSDSA-N	438.908	1.195	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)CCNC(=O)OC(C)(C)C)C2)C1	1785339097	YWTJVOUXPDDYHA-SCLBCKFNSA-N	448.358	1.515	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCSC(=N)N)[C@H]2C1	1786848535	LAXGOZZCFLFCJG-CENBSLRLSA-N	425.382	1.219	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)c1ncccc1-c1ccccc1	1787682740	VVURJNLZFDUQLZ-FFGOWVMKSA-N	443.931	1.942	50	20	IDGD	
CCCC(=O)N[C@@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]21	1788742390	GPGXUKSLPGJNIX-OSBUWBMXSA-N	436.380	1.507	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(Cl)ncn3)[C@H]2C1	1789059920	ZFPMCHALIFCNCW-MNXVOIDGSA-N	445.745	1.897	50	20	IDGD	
Cn1ccc(=O)cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]21	1789223136	NPCBBEOCGAEXRK-BCRCDCHUSA-N	430.332	1.215	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)[C@H](O)Cc1ccccc1	1790956235	GHWGZRKVKBJVFL-ZOFXXKQRSA-N	443.313	1.260	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3ccc4c(c3)CCO4)[C@H]2C1	1791005014	MIHRPOFIXLIZLD-GNBUJSLZSA-N	436.936	1.398	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C[C@H]3C[C@@H]4CC[C@H]3C4)C[C@@H]21	1791293293	SHFYEPJPCJTGRP-JIFZMYKYSA-N	434.581	1.165	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cc1cn3c(nc1=O)SCC3)C2	1793682552	ZPYJDJSVWFBILY-FZKCQIBNSA-N	438.981	1.937	50	20	IDGD	
COC(=O)[C@H]1CC=CC[C@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCBr	1795117076	LQKIZEIUPXXOQC-LBKYZSNHSA-N	443.338	1.116	50	20	IDGD	
Cc1ccc(CCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)c(C)n1	1796192211	SHKPCZJBMJYPBS-KOUNCHBCSA-N	435.333	1.263	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(-c2cccs2)on1	1798128722	NBAHOLAPGFRKGK-IPJQOSJUSA-N	439.921	1.860	50	20	IDGD	
Cc1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)ccc1F	1798441873	NNAXFRVKRQRAPE-MUJYYYPQSA-N	425.464	1.698	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(-c2ccccc2)[nH]n1	1798667104	WRBWAQVDAUVKKN-YYAJDYIMSA-N	432.908	1.534	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(-c2ccccc2)no1)c1ccc(B(O)O)cc1	1798815507	JUBFYJPPJWIGFO-ACDBMABISA-N	445.284	1.587	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1c(-c2ccncn2)noc1C	1799181832	HZSSWPZERNDPHH-XGUBFFRZSA-N	433.896	1.946	50	20	IDGD	
COc1cc(C#N)cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CCC(=O)NN(C)C)C3)c1	1799286616	NCTJKSFNYDQMAW-BCDXTJNWSA-N	427.505	1.192	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c(F)ccnc1Cl)C2)[C@H](F)Br	1799344283	GZUIFKMRKBSZMG-VVJJBPBLSA-N	438.656	1.768	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(Br)cn1)C2	1800977362	YLSPHFAHRIKBJX-WJNVRWDZSA-N	446.729	1.301	50	20	IDGD	
C[C@@H](Sc1ccccn1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCC(=O)NN(C)C)C2	1802898910	PVSPXOQFHXRMBV-WCXIOVBPSA-N	433.578	1.573	50	20	IDGD	
COc1cccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)c1F	1803995744	ZRRYGKPEIYAVTB-BJWYYQGGSA-N	426.253	1.080	50	20	IDGD	
O=C(Cc1ccc2c(c1)OCO2)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1	1806674271	DCXRNFMQAUESRL-CSODHUTKSA-N	445.903	1.659	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)/C=C/c2ccco2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807365459	XUJWXXXFUHFEJU-APEGBLAYSA-N	445.284	1.387	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2cc(C(=O)O)ncn2)[C@H]1c1cccnc1	1808249952	HPEBRXXLLXIXTE-ZQIUZPCESA-N	431.880	1.907	50	20	IDGD	
O=C(c1ccc2n[nH]cc2c1)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1	1809967156	XXENOOTZOAEJPW-UHFFFAOYSA-N	446.316	1.401	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2cc3n(n2)CCC3)[C@@H]1c1cccnc1	1809985028	QTBURTWWKXIGRO-AYBZRNKSSA-N	431.924	1.798	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2cc3cn[nH]c3cn2)[C@@H]1c1cccnc1	1810089058	HRMWBCWYVMPXMP-QOKNQOGYSA-N	442.907	1.926	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)Cc2cscn2)[C@H]1c1cccnc1	1813071181	ODKKADIOHOODNV-IERDGZPVSA-N	444.561	1.160	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1CCc2nc(NC(=O)C(C)(C)F)sc2C1	1814686151	SCKWWAOOEXGAQT-IVWJEFBKSA-N	434.497	1.937	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)C[C@H]2CCCCO2)n[nH]1	1815608383	FDMPDAKWTSRPKY-NVXWUHKLSA-N	434.541	1.734	50	20	IDGD	
Cc1cncc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)[nH]n2)c1	1816498594	REGPIDIGYDAOFM-GOSISDBHSA-N	448.487	1.731	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](O)c2ccccc2)n[nH]1	1817077766	CXRGUKAZWGDIHK-UWJYYQICSA-N	442.520	1.508	50	20	IDGD	
Cc1ccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)cn1	1817470791	HGDFVEDKGPTAKP-IBGZPJMESA-N	433.277	1.413	50	20	IDGD	
COc1cc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)ccn1	1817472323	QJUIPZNUKLCTQQ-GOSISDBHSA-N	449.276	1.113	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCBr)[nH]n1	1817991098	XFKHJVGUGAQCDZ-CMPLNLGQSA-N	429.319	1.634	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)ncn2)[nH]n1)[C@@H](F)Br	1820931703	SJEGMVXWQZFINW-ZWNOBZJWSA-N	427.234	1.902	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)[C@@H]1C[C@]1(F)Cl	1822502829	VLUJSGBCGVHMAD-ZUEVXXBESA-N	434.664	1.320	50	20	IDGD	
Cc1noc(CC(=O)N[C@@H]2CCc3nc(NC(=O)[C@@H](F)Br)sc3C2)n1	1823005022	XRBWZWNMLGZZRA-JMCQJSRRSA-N	432.275	1.680	50	20	IDGD	
Cc1cc(NC(=O)CC(=O)N2CCC([C@H]3CCCCN3C(=O)[C@@H](O)CCl)CC2)no1	1824182439	CEDSRXVGNNUUKL-CVEARBPZSA-N	440.928	1.531	50	20	IDGD	
CCS(=O)(=O)CC(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H](F)Br)CC1	1824468261	YICVDJRJWKVEHA-UKRRQHHQSA-N	441.363	1.731	50	20	IDGD	
O=C(CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@H](O)CCl)CC1)N1CCCC1	1824944333	ZLOWLZYSRRVHGK-ZWKOTPCHSA-N	427.973	1.608	50	20	IDGD	
O=C(Cc1ccccn1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827052883	MLNCRGLYZSZOIU-QFIPXVFZSA-N	435.333	1.237	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC([C@@H]2CCCCN2C(=O)Cn2cnnn2)CC1	1827198593	DQIBYGAOWDPHNC-GJZGRUSLSA-N	427.347	1.466	50	20	IDGD	
O=C([C@H](F)Br)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)n2)CC1	1827601731	OLMROZXDJRCGNQ-JSGCOSHPSA-N	445.289	1.812	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)COc3ccc(O)cc3)CCO2)C1	1830337964	BDXXLVJSTBLLNM-NRFANRHFSA-N	440.924	1.492	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cscn3)C2)C1	1830538112	VZIFGCOFVVEJKY-LRDDRELGSA-N	432.340	1.244	50	20	IDGD	
CC(=O)N/C(C)=C/C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1	1831081401	AGXIHNRSJPMNFK-CLHDZIPGSA-N	435.569	1.019	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3c(F)cncc3F)C2)C1	1831652005	VOPPWKZHYDTMAV-YJYMSZOUSA-N	431.867	1.837	50	20	IDGD	
CC[S@@](=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1	1831873633	QTUUJOQBNOSQQF-VPTFNQTCSA-N	442.626	1.138	50	20	IDGD	
COc1cc(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)ccn1	1832594822	QUDZCBSFWTVQPW-MJGOQNOKSA-N	429.876	1.014	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)C3(C)COC3)CC2)CC1	1833140790	COEPQZQHRFYCGD-INIZCTEOSA-N	430.387	1.768	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cc(Cl)cnc3O)CC2)CC1)[C@H](O)CCl	1833307037	LRQAAXASCYWUOE-MRXNPFEDSA-N	445.347	1.226	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cccn4cncc34)CC2)CC1)[C@H](O)CCl	1833310322	QBUGVANQPBCBPP-LJQANCHMSA-N	433.940	1.119	50	20	IDGD	
CCC(=O)N[C@H](C)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)Br)CC2)CC1	1833423133	ZGLQTUYVKQEISG-ZIAGYGMSSA-N	445.402	1.256	50	20	IDGD	
Cn1cccc(C(=O)NC2CCN(C3CCN(C(=O)C(C)(C)CCl)CC3)CC2)c1=O	1833584170	HHUANYWETQJDQM-UHFFFAOYSA-N	436.984	1.836	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cccc(=O)n3C)CC2)CC1	1834083521	XBMNKPBBFYBQPP-GOSISDBHSA-N	436.984	1.978	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cncs3)CCO2)C1	1834470219	DLEIGODEEIXAOW-LRDDRELGSA-N	432.340	1.387	50	20	IDGD	
Cc1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)CCBr)CCO2)C1	1834821412	ISOWQKMSMUOPTQ-GOSISDBHSA-N	426.311	1.245	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)[C@H]3CCCSC3)C2)C1	1834826267	IGZPRTBCACDVEF-WMLDXEAASA-N	435.384	1.371	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](CN)c1ccccc1)CCO2	1835813912	WKUFDVGOPRVULG-CNNODRBYSA-N	437.968	1.593	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC1CCN(C2CCN(C(=O)Cc3ccc(O)cn3)CC2)CC1	1835838023	XMTOJWMRFRTWLC-UHFFFAOYSA-N	448.640	1.753	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccnc(OC)c3F)CCO2)C1	1836233950	GUXVPYBPNHTACT-YWZLYKJASA-N	443.903	1.707	50	20	IDGD	
C[C@H](Cc1ccncc1)C(=O)N1CCOC[C@@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1837715640	BOEOVCDVZHMFCQ-XMSQKQJNSA-N	449.624	1.568	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccn(C(F)F)c3=O)C2)C1	1839145531	LCCWFVKWPWWROL-IFXJQAMLSA-N	447.866	1.331	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)C2)C1	1839147024	FGHQDXQDJITSFK-APWZRJJASA-N	441.868	1.388	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1	1839153657	NKNJTLSUDJMWOF-SJORKVTESA-N	441.428	1.531	50	20	IDGD	
Cc1n[nH]c(C)c1CC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2	1839154235	HXDSANLRVCBISD-OALUTQOASA-N	447.363	1.262	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)C3CCOCC3)C2)C1	1839963255	FYGWHIVBJLHCMC-QAPCUYQASA-N	433.343	1.043	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3ccsc3)C2)C1	1840032131	OFHYJSQCDLELQQ-KSSFIOAISA-N	445.379	1.921	50	20	IDGD	
Cc1ccc(F)c(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)c1	1840035655	ZMZAUJSAQIANMY-AUUYWEPGSA-N	443.313	1.988	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)NC(=O)OC(C)(C)C)CCO2	1840089068	KTLXNOSLLYSMKC-SXGZJXTBSA-N	447.960	1.373	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3cnccc3C)C2)C1	1840150897	SJTUGYFYDDAXLQ-NQIIRXRSSA-N	439.940	1.033	50	20	IDGD	
O=C(C(Cl)Cl)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CCc4ccccc4O3)C2)C1	1840191001	ZEXTYELUBXCENT-OXQOHEQNSA-N	443.327	1.640	50	20	IDGD	
C[C@H](Cc1ccco1)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1840471698	HBUQSFQSZDCLGF-SIIHOXLZSA-N	447.301	1.605	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)c1ccccn1)CCO2	1840504055	FBAGJCPKBKNSMF-VCBZYWHSSA-N	440.338	1.425	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CC[C@H]3CCOC3)CCO2)C1	1840590154	FVPWXUPJKNHZKC-TXPKVOOTSA-N	447.370	1.433	50	20	IDGD	
CC[C@H](NC(C)=O)C(=O)N1CCCC12CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1841085622	BMVCQDNCPZJIMO-GJZGRUSLSA-N	444.960	1.237	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCCC12CN(C(=O)c1cc(C#N)c[nH]1)C2	1841925025	GSGQYFZNHABSBH-HNNXBMFYSA-N	435.912	1.835	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)c2ccc(O)nc2)C1	1844766339	ZKOMEEMYCZDZTD-UHFFFAOYSA-N	440.412	1.752	50	20	IDGD	
COc1cc(C(=O)N2CC3(CCCN3C(=O)[C@@H](F)Br)C2)c([N+](=O)[O-])cc1O	1845218553	MBIUOEABYGHBTD-CYBMUJFWSA-N	446.229	1.817	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CC(N)=O)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)C(C)(C)CCl	1847439669	CEDPWOIELXTXQD-IHRRRGAJSA-N	444.960	1.222	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CCn1c(=O)oc2ccccc21	1848156130	QLINNGILMGWNOI-RDBSUJKOSA-N	436.306	1.970	50	20	IDGD	
O=C(NCCc1ccc(OC(F)F)cc1)NNC(=O)c1csc(N2CCOCC2)n1	9871512	NBHVDBFBSUCCGC-UHFFFAOYSA-N	441.460	1.768	50	20	IDGD	
COc1ccc(CC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1F	18078549	FPJYSXVESWEZDF-UHFFFAOYSA-N	435.477	1.623	50	20	IDGD	
COCCn1nc(C(=O)NNC(=O)CCCOc2ccc(Cl)cc2Cl)ccc1=O	21894473	WLWRSHUKFOXNJA-UHFFFAOYSA-N	443.287	1.817	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)CNC(=O)Cc1ccccc1	22198926	YBXDJRNOKHMXFZ-UHFFFAOYSA-N	433.848	1.012	50	20	IDGD	
CN(C)C(=O)[C@@H]1CCCN1CCCNC(=O)NNC(=O)Cc1ccc2ccccc2c1	726278564	WRXIPLRLCCMONF-FQEVSTJZSA-N	425.533	1.655	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN(Cc2nc(O)c3ccccc3n2)C(C)C)n1	727126014	AIQKXTZJQOWBOX-UHFFFAOYSA-N	428.518	1.701	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)NNC(=O)c2cccc(OC(F)F)c2)cc1OC	728598863	PJMHDIBILHVQHU-UHFFFAOYSA-N	438.387	1.984	50	20	IDGD	
Cc1noc(C)c1S(=O)(=O)N1CCC[C@H](C(=O)NNC(=O)c2cccc(C#N)c2)C1	728828356	NNUSMKQMBXVSSU-INIZCTEOSA-N	431.474	1.025	50	20	IDGD	
O=C(NNS(=O)(=O)c1c(Cl)nc2sccn12)C1CCN(c2ncccn2)CC1	728853787	BCMOJWXJLHTEEN-UHFFFAOYSA-N	441.926	1.065	50	20	IDGD	
NC(=O)C1CCN(c2ncccc2CNC(=O)NNC(=O)c2c[nH]c3ccccc23)CC1	729230589	NTTMMOHXCSNLGF-UHFFFAOYSA-N	435.488	1.409	50	20	IDGD	
CN(C)c1ccc(NC(=S)NNC(=O)CN2C(=O)COc3ccc([N+](=O)[O-])cc32)cc1	729691104	BIUFNJVITNKSFV-UHFFFAOYSA-N	444.473	1.404	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)c1ccc(C)c(S(=O)(=O)N2CCOCC2)c1	731491725	TUOPHCYIQRTAAL-UHFFFAOYSA-N	433.486	1.099	50	20	IDGD	
C[C@@H]1CN(C(=O)OC(C)(C)C)CCN1C(=O)NNC(=O)CNC(=O)c1cccs1	731682618	CVAWNABYJMCNMV-GFCCVEGCSA-N	425.511	1.160	50	20	IDGD	
Cc1nn(-c2ccccc2)c2ncc(C(=O)NNC(=O)CCN3C[C@@H](C)O[C@H](C)C3)cc12	732260026	NPVDXYBTRSODIG-HZPDHXFCSA-N	436.516	1.989	50	20	IDGD	
Cc1nc2c(c(C)nn2C)c(C)c1CCC(=O)NNC(=O)CCN1C[C@H](C)O[C@@H](C)C1	732262970	YJJYYYNPMQCDAT-KBPBESRZSA-N	430.553	1.473	50	20	IDGD	
CSC[C@H](C(=O)NNc1ccccc1S(C)(=O)=O)N1C(=O)[C@@H]2CCCC[C@H]2C1=O	732304540	ZNQMUKYSBCGMEM-UMVBOHGHSA-N	439.559	1.440	50	20	IDGD	
CC[C@H](Cc1ccccc1)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	732727040	VWUGLDVFVKARBX-GOSISDBHSA-N	445.541	1.737	50	20	IDGD	
C[C@@H]1CN(CC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)C[C@@H](C)N1C(=O)OC(C)(C)C	733199590	HZEAINLYJYYYMD-ZIAGYGMSSA-N	435.481	1.686	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)[C@@H](C)C(C)C)N(S(C)(=O)=O)CC2	733358160	PIQPGMXUTGUOQO-BBRMVZONSA-N	441.550	1.392	50	20	IDGD	
CC(C)N1CC[C@H](NC(=O)NNC(=O)COc2ccc(OCc3ccccc3)cc2)C1=O	734218586	JTCPTIPMMVUXMY-FQEVSTJZSA-N	440.500	1.984	50	20	IDGD	
NS(=O)(=O)c1ccc(F)c(CNC(=O)NNC(=O)c2cccc(OC(F)F)c2)c1	734523381	CQSIJZDALVOQMK-UHFFFAOYSA-N	432.380	1.219	50	20	IDGD	
CCc1nc(CN2CCN(CC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)CC2)cs1	738310000	SRNSUYOMLUOEIA-UHFFFAOYSA-N	432.506	1.193	50	20	IDGD	
Cc1cc(=O)c(C(=O)NNc2ncnc3[nH]cnc23)nn1-c1ccccc1C(F)(F)F	740746825	QDPWXWZMTPSWKN-UHFFFAOYSA-N	430.350	1.983	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)[C@@H]2CCCCN2C(=O)c2ccc(O)nn2)o1	742246784	BNYMRNRVABVDBZ-INIZCTEOSA-N	444.492	1.073	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(F)c(Br)c1)c1ccc(-n2cnnn2)cc1	743250928	LUOFRQRRDPCZMR-UHFFFAOYSA-N	441.242	1.187	50	20	IDGD	
O=C(CN1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O)NNc1ccc(Br)cc1Cl	743334984	KLLXEQPKAVJKER-OXHZDVMGSA-N	428.670	1.708	50	20	IDGD	
O=C(CN(CCO)Cc1cnn(Cc2ccccc2)c1)NNC(=O)c1ccccc1Cl	744400300	GYENCKNSYYNDFH-UHFFFAOYSA-N	441.919	1.840	50	20	IDGD	
COc1cc(Br)ccc1C(=O)OCC(=O)NNC(=O)c1ccc(C#N)cc1	744902870	POOJFWVFYCKSGP-UHFFFAOYSA-N	432.230	1.947	50	20	IDGD	
Cn1ncc2c(O)nc(CCC(=O)NNc3ccc(S(=O)(=O)C(F)(F)F)cc3)nc21	748522512	DHKMWZXCCUIJHI-UHFFFAOYSA-N	444.395	1.438	50	20	IDGD	
O=C(CCN1CCN(c2ccccn2)CC1)NNc1ccc(S(=O)(=O)C(F)F)cc1	748611964	VVHMINDXNXFZBC-UHFFFAOYSA-N	439.488	1.733	50	20	IDGD	
O=C(NCc1ccccc1CN1CCC(O)CC1)NNC(=O)c1ccc2c(c1)OCCO2	749589637	HUCIFYKXDDNVIE-UHFFFAOYSA-N	440.500	1.559	50	20	IDGD	
O=C(COC(=O)C[C@@H](O)c1ccc(Cl)cc1)NNC(=O)[C@H]1COc2ccccc2O1	750368910	CJZVQYJNQGTSDC-RHSMWYFYSA-N	434.832	1.294	50	20	IDGD	
O=C(NN=C1C(=O)N(Cc2ncon2)c2ccc(Br)cc21)c1cnccn1	750932946	UQJGKZZNUSKONZ-UHFFFAOYSA-N	428.206	1.303	50	20	IDGD	
COC[C@@H](C)n1c(C)cc(/C=C(/C#N)C(=O)NNC(=O)CNC(=O)c2cccs2)c1C	751209348	PFHSRJOISUZONW-KDVQLTRESA-N	443.529	1.858	50	20	IDGD	
CCOC(=O)c1ccc(N2CC(NC(=O)NNC(=O)[C@H](CC)c3ccccc3)C2)nc1	753280601	VFNNKZPTQPGUJX-GOSISDBHSA-N	425.489	1.971	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)c1ccc(O)c([N+](=O)[O-])c1	755518230	UROJDAPOSUWHQP-UHFFFAOYSA-N	447.879	1.533	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)Nc1ccc(C(=O)N2CCOCC2)cc1	755932792	DWLFOVNBBJRMSG-UHFFFAOYSA-N	442.472	1.789	50	20	IDGD	
CS(=O)(=O)Cc1ccc(NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1	756269903	SRJLXACTUPZMLV-UHFFFAOYSA-N	432.506	1.091	50	20	IDGD	
CCn1cc(S(=O)(=O)NNC(=O)c2ccc(F)cc2Br)c([N+](=O)[O-])n1	756931531	SIHAPPJPDPQPJZ-UHFFFAOYSA-N	436.219	1.336	50	20	IDGD	
CCc1ncsc1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	757755979	MRSLTWREVKFWEM-UHFFFAOYSA-N	439.519	1.193	50	20	IDGD	
Cc1cnn(-c2ccc(C(N)=O)cc2NC(=O)NNC(=O)c2cc(Br)c[nH]2)c1	757873896	DHRQCHFAVFOGTK-UHFFFAOYSA-N	446.265	1.837	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=S)NC[C@@H]1CCCCO1	758252990	TZLDDHARVJMYTO-SFHVURJKSA-N	440.013	1.522	50	20	IDGD	
O=C(COc1ccccc1Cc1ccccc1)NNC(=O)N[C@H]1CCCS(=O)(=O)C1	758647579	CGIPNRHPANHHFP-SFHVURJKSA-N	431.514	1.564	50	20	IDGD	
Cc1onc(-c2ccncc2)c1C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	759571526	PASGPAIAIZFGEM-INIZCTEOSA-N	438.396	1.189	50	20	IDGD	
CCCCn1c(=O)nc(O)c2c1nc(CCC(=O)NNc1ncc(F)cn1)n2CC(C)C	760904879	AEYHKKJKSBDTSF-UHFFFAOYSA-N	446.487	1.760	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)CCc2nnc(-c3ccc(Cl)cc3)o2)C[C@@H](C)O1	762444547	RDGPPDLIUFJGAD-OKILXGFUSA-N	435.912	1.969	50	20	IDGD	
CS(=O)(=O)c1ccc(OCCCC(=O)NNc2nccc(N3CCOCC3)n2)cc1	762852807	ZVYMDMYPPANUSE-UHFFFAOYSA-N	435.506	1.019	50	20	IDGD	
C[C@@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)cc2)C[C@@H](C)O1	763472529	WMVWBSPELYICJX-ZIAGYGMSSA-N	441.444	1.608	50	20	IDGD	
O=C(NNC(=O)c1cccnc1)C(=O)Nc1cc(I)ccc1Cl	763491006	KWOBQQYRJYMSOK-UHFFFAOYSA-N	444.616	1.739	50	20	IDGD	
O=C(NNC(=O)c1cc2ccccc2cc1O)C(=O)Nc1ccccc1CN1CCOCC1	763517400	JUQVWCZEPCCWHG-UHFFFAOYSA-N	448.479	1.777	50	20	IDGD	
CCOc1cc2c(cc1NC(=O)C(=O)NNC(=O)COc1cccc(C)c1)O[C@H](C)C2	763619356	UMRXXZRNLGYNQP-CQSZACIVSA-N	427.457	1.882	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)C(=O)Nc2ccc(C)cc2OCCN(C)C)c1	763668435	MEMCUWYYIULRBR-UHFFFAOYSA-N	442.516	1.717	50	20	IDGD	
C[C@@H](c1ccccc1)n1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2F)n1	763681664	XKVDASKHBRHACX-AWEZNQCLSA-N	425.420	1.796	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccccc1-n1nc(C)nc1C	763712376	PPQPBHGXKVMIGW-UHFFFAOYSA-N	436.472	1.611	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)c(C)n1	763790547	KQWNATVIKVLGDA-UHFFFAOYSA-N	438.444	1.089	50	20	IDGD	
CS(=O)(=O)CCc1ccc(NC(=O)C(=O)NNC(=O)Cc2c[nH]c3ccccc23)cc1	763861835	QYPYIBFTJSJPMI-UHFFFAOYSA-N	442.497	1.084	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)c(Br)n1	763866234	NVCRWDRVTOVKPB-SNVBAGLBSA-N	439.241	1.845	50	20	IDGD	
COCCn1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2c(C)cc(Cl)cc2C)n1	763876029	CFEYDHNJDTZBLJ-CYBMUJFWSA-N	437.884	1.353	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3cccnc3-n3cncn3)cc2C1	763938284	DAFXELJLSKLGDL-NSHDSACASA-N	425.474	1.248	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cccn2C)n([C@@H]2CCN(Cc3ccccc3)C2)n1	763995512	IOIIJQTWCBOZHW-GOSISDBHSA-N	449.515	1.377	50	20	IDGD	
O=C(Cc1cccc2ccccc12)NNC(=O)C(=O)Nc1ccnn1Cc1ccccn1	764020362	WGDOPJFUBZMTQI-UHFFFAOYSA-N	428.452	1.808	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2O1)C(=O)Nc1ccc(OC(F)F)c2ncccc12	764169042	SHCOYUOCKGAYNI-INIZCTEOSA-N	442.378	1.926	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)C(=O)Nc1c(F)cccc1-n1cccn1	764203360	LMFRYTAYVITQAR-UHFFFAOYSA-N	448.455	1.402	50	20	IDGD	
CCCNC(=O)[C@H]1CN(C(=O)C(=O)NNC(=O)CCC2CCCCC2)c2ccccc2O1	764209436	ARSMURZLUJEQPP-LJQANCHMSA-N	444.532	1.815	50	20	IDGD	
CN(C)CC(=O)NNC(=O)C(=O)Nc1ccnn1Cc1ccc(SC(F)(F)F)cc1	764210723	GQXDKFBYJODCHM-UHFFFAOYSA-N	444.439	1.191	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)Cc2ccc(CC(=O)NNC(=O)c3ccc(C)o3)cc2)o1	764222054	SVRMXBVNSKMHIY-UHFFFAOYSA-N	438.440	1.497	50	20	IDGD	
CCCCn1nccc1NC(=O)C(=O)NNC(=O)c1cc(OC)ccc1Br	764232035	MZBFICYFEAUXOV-UHFFFAOYSA-N	438.282	1.854	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)C(=O)Nc1ccccc1COc1ccc(CC#N)cc1	764298160	PNKFHOFIPDPSTJ-UHFFFAOYSA-N	432.440	1.763	50	20	IDGD	
COCC(=O)NNC(=O)C(=O)Nc1cc(C)nn1-c1cc(C(F)(F)F)ccc1Cl	764302562	NPDIMYLFUXVULX-UHFFFAOYSA-N	433.774	1.585	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)C(=O)Nc1cccc(OC[C@H]2CCCO2)c1	764351018	NVYVGUDCHVSEFG-HXUWFJFHSA-N	449.467	1.830	50	20	IDGD	
C[C@@H](Cn1ncc2ccccc2c1=O)NC(=O)NNC(=O)COc1ccccc1[N+](=O)[O-]	764459287	KUKWKFVWTHDUHP-ZDUSSCGKSA-N	440.416	1.103	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NN=Cc3ccc(C)c(F)c3)CC2)cc1	764818365	JZXIMGKINAFFJY-UHFFFAOYSA-N	432.521	1.899	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@@H](C)Cc3c(C)nn(C)c3C)CC2)cc1	765755450	QDYZABSQRRVRSC-SFHVURJKSA-N	440.592	1.489	50	20	IDGD	
CC(C)OC(=O)C[C@@H]1CCCN(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)C1	766086957	HUVHWNJYJTVVDI-INIZCTEOSA-N	432.525	1.488	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)N[C@@H]2CCC[C@@H]2C(=O)NC)c2ccccc2c1=O	766277514	ULMUXFMOSZBUNR-DLBZAZTESA-N	442.520	1.445	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)CN1C(=O)N[C@@]2(CCCC(C)(C)C2)C1=O	768566068	QNCAGPFNULZFNY-LRTDBIEQSA-N	434.468	1.631	50	20	IDGD	
CC[C@H](Nc1c([N+](=O)[O-])c(C)nn1C)C(=O)NNc1c(OC)cccc1S(C)(=O)=O	768627809	FBYGMEXZYAAJIE-NSHDSACASA-N	440.482	1.383	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)c2cccc([C@]3(C)NC(=O)NC3=O)c2)cc1	768915097	XSJOHEZKHIPXIT-XMHCIUCPSA-N	440.456	1.368	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)C[C@@H]3CCC[C@@H]3C)CC2)cc1	769008976	XLOLZQYCNCOROB-ROUUACIJSA-N	436.578	1.275	50	20	IDGD	
COC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(NC(=O)NNc3cnccn3)cc2)C1	769942981	OYFYKWXUVGESDW-ZDUSSCGKSA-N	434.478	1.199	50	20	IDGD	
CC(C)[C@@H](CNC(=O)NNC(=O)[C@H](C)Oc1cccc(Cl)c1)N1CCN(C)CC1	770127237	CRXJJDOWSWVMEY-MAUKXSAKSA-N	425.961	1.710	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)[C@H](c3cccc(F)c3)N3CCOCC3)nc21	770966693	NVMLNZKAPNEPLO-INIZCTEOSA-N	443.483	1.943	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)Cn1cnc2sc(-c3ccccc3)cc2c1=O	771945666	DHIWGZSCQQEZQX-LBPRGKRZSA-N	428.470	1.614	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)CCc1nc(O)c2c3c(sc2n1)C[C@H](C)CC3	771950559	ZJFXPLLBEBAJBD-GHMZBOCLSA-N	434.518	1.943	50	20	IDGD	
CCCS(=O)(=O)N1CCCC[C@@H]1C(=O)NNC(=O)[C@@H](C)Oc1cccc(Cl)c1	772969650	OGWIMGXZADAPBZ-CZUORRHYSA-N	431.942	1.849	50	20	IDGD	
CC(C)c1nccnc1NNC(=O)C(=O)Nc1ccc2oc(=O)n(CCN(C)C)c2c1	773991565	IISDTPCPYVRDAG-UHFFFAOYSA-N	427.465	1.151	50	20	IDGD	
CCOC1CC(CNC(=O)NNC(=O)[C@H](C)Oc2ccccc2F)(N2CCOCC2)C1	775145659	ICAKKJHVWHJHBS-FQWCMUAHSA-N	438.500	1.193	50	20	IDGD	
O=C(NCc1ccc(OC(F)F)cn1)NNC(=O)c1csc(N2CCOCC2)n1	775224257	ZRLCZZAPVILBHO-UHFFFAOYSA-N	428.421	1.120	50	20	IDGD	
COc1ccnc(NNC(=O)Nc2ccc3c(ccn3CC(=O)N3CCOCC3)c2)n1	775586927	VJCQEMLUUDNMLI-UHFFFAOYSA-N	425.449	1.447	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)NCCCN2CCN(Cc3ccccc3)CC2)c1	776616284	BTYWXJDJXVQBIG-UHFFFAOYSA-N	445.589	1.924	50	20	IDGD	
COC(=O)c1ccccc1NNC(=O)c1ccc(N2CCN(C(C)=O)CC2)c([N+](=O)[O-])c1	777771754	LJUCIFICAOQAOO-UHFFFAOYSA-N	441.444	1.807	50	20	IDGD	
Cc1c(C(=O)N2CCN(S(=O)(=O)CBr)CC2)cnn1-c1ccccn1	777777530	LMMHLRZLWGRDBI-UHFFFAOYSA-N	428.312	1.016	50	20	IDGD	
C[C@H]1CCN(C(=O)OC(C)(C)C)[C@@H](C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)C1	778420676	UIVFDWOTCVPVRO-WMLDXEAASA-N	444.488	1.898	50	20	IDGD	
COC[C@H](C)n1ccc(NC(=O)C(=O)NNC(=O)COc2cc(C)ccc2C(C)C)n1	778706646	XVZUUCAUVJCEAP-HNNXBMFYSA-N	431.493	1.687	50	20	IDGD	
CN(CC(=O)NNc1ccc([N+](=O)[O-])cc1Br)S(=O)(=O)c1cccnc1	779136899	SCSFAFUFIAMLTQ-UHFFFAOYSA-N	444.267	1.516	50	20	IDGD	
CCNC(=O)N(C)NC(=O)c1cc(S(=O)(=O)N2CCCCC2)ccc1Br	780711036	IOYBUUYTBMWZDG-UHFFFAOYSA-N	447.355	1.930	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)CS(=O)(=O)N2CCN(c3cccc(C)c3)CC2)c1	780796907	NJVXLLXQUSVLFN-UHFFFAOYSA-N	446.529	1.377	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)N[C@H]1CCCN(c2ccc(C#N)cc2)C1=O	780901864	JOPMGFSSCDWEEL-LIRRHRJNSA-N	439.447	1.991	50	20	IDGD	
CC(C)[C@@H]1C[C@@H](CC(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)CCO1	782118260	TWGRSVKFVMOANG-IRXDYDNUSA-N	439.582	1.302	50	20	IDGD	
COC(=O)CNC(=O)c1ccc(NC(=O)C(=O)NNc2cc(Cl)ccc2Cl)cc1	783368383	UXCOSYVAMVDQDS-UHFFFAOYSA-N	439.255	1.978	50	20	IDGD	
Cc1cc(Br)ccc1NNC(=O)C(=O)Nc1cccc(S(N)(=O)=O)c1	784414210	HMTGOQGQUKWDNU-UHFFFAOYSA-N	427.280	1.487	50	20	IDGD	
Cc1nc(Cn2nnc(C(=O)NNC(=O)[C@@H](C)Oc3c(C)cc(Cl)cc3C)c2C)no1	784725258	XVWPUEWVPHMMDQ-GFCCVEGCSA-N	447.883	1.825	50	20	IDGD	
O=C(NNc1nc(-c2ccc(Cl)cc2)no1)C(=O)Nc1ccc(-n2cnnn2)cc1	784794939	ICKUXZDGPODGDU-UHFFFAOYSA-N	425.796	1.448	50	20	IDGD	
COC[C@H](C)n1ccc(NC(=O)C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)n1	785100201	SVZANLVILKSQPT-JTQLQIEISA-N	436.419	1.343	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1nc(C(C)(C)C)ns1	785331747	ZDKQWUFKQQTOGE-UHFFFAOYSA-N	427.508	1.330	50	20	IDGD	
CCS(=O)(=O)CCn1cc(C)c(NC(=O)NNC(=O)c2cc3c(s2)CCC3)n1	786714914	BLXWXAZPTANOHG-UHFFFAOYSA-N	425.536	1.643	50	20	IDGD	
O=C(CCC/N=C1/NS(=O)(=O)c2ccccc21)NNC(=O)NCc1ccc(Cl)cc1	787430954	GQKZKVFDEVSLCV-UHFFFAOYSA-N	449.920	1.689	50	20	IDGD	
Nc1nc(Cl)cc(NNC(=O)Nc2cc(C3CC3)nn2[C@@H]2CCS(=O)(=O)C2)n1	789132789	IAALLKVEPVGDNQ-SECBINFHSA-N	426.890	1.294	50	20	IDGD	
CN(CC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)[C@H]1CCN(Cc2ccccc2)C1=O	789524256	AOKQRUXEUJIMPC-SFHVURJKSA-N	425.445	1.089	50	20	IDGD	
O=C(NNc1nc2ccccn2n1)C(=O)Nc1ccc(C(=O)NCc2ccc(F)cc2)cc1	792388056	LOPPGIJRPVOHGV-UHFFFAOYSA-N	447.430	1.880	50	20	IDGD	
Cc1cc(C(=O)N2CCC(C)CC2)ccc1NC(=O)C(=O)NNc1nc2ccccn2n1	792393841	IQMHKVAGWKICNF-UHFFFAOYSA-N	435.488	1.992	50	20	IDGD	
O=C(NNC(=O)[C@H]1[C@H]2[C@@H]3C[C@@H]4[C@@H]5C[C@@H]([C@@H]2[C@@H]53)[C@@H]41)c1cccc(S(=O)(=O)N2CCCC2)c1	792773390	HHULZLRMLZSAFO-NNZJSVBASA-N	441.553	1.626	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cc(F)ccc2-n2cccn2)cc1	792804554	SDTORVIFCOKNCC-UHFFFAOYSA-N	445.476	1.402	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)C1CCN(c2oc(C)nc2C#N)CC1	792812260	KIHFURQSGMKNHG-UHFFFAOYSA-N	435.488	1.831	50	20	IDGD	
Cc1noc(COc2ccc(NC(=O)C(=O)NNc3ccc4c(=O)[nH]ccc4c3)cc2)n1	793070367	QTDSGZYYFSWTFW-UHFFFAOYSA-N	434.412	1.880	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2cccc(Br)c2)cnc1C	793402249	XBALSHWYTFSCLW-UHFFFAOYSA-N	428.264	1.562	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(C)c(S(=O)(=O)NC(C)(C)C)c2)n1	797369901	PONFUEQBPSGUQC-UHFFFAOYSA-N	447.517	1.175	50	20	IDGD	
O=C(CCc1ccccc1)NNC(=O)C(=O)Nc1ccc(Cl)c(CN2CCOCC2)c1	797535247	JHUWZKUOAOTGQZ-UHFFFAOYSA-N	444.919	1.891	50	20	IDGD	
COc1cncc(S(=O)(=O)NNC(=O)c2nn(CCC(C)C)c(=O)c3ccccc23)c1	799120971	WFAXBRVZSPSOLK-UHFFFAOYSA-N	445.501	1.470	50	20	IDGD	
Cc1c(C(=O)OCC(=O)NNC(=O)c2ccccc2)nnn1CCOc1ccc(F)cc1	800327092	SCEOHWKBNURLBM-UHFFFAOYSA-N	441.419	1.423	50	20	IDGD	
Cn1c(=O)n(C)c2cc(N3CCCCC3)c(NC(=O)C(=O)NNC(=O)OC(C)(C)C)cc21	800626128	XYCJSUFBGOUTBV-UHFFFAOYSA-N	446.508	1.362	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)c1ccc(Br)c(OC(F)(F)F)c1	801615780	PRUKPOPHZXXBEV-ZCFIWIBFSA-N	448.217	1.046	50	20	IDGD	
Cn1nnc2c(C(=O)NNc3ccc(S(=O)(=O)Nc4nccs4)cc3)ccnc21	801629053	RLZPWIUYSPNYPH-UHFFFAOYSA-N	430.475	1.378	50	20	IDGD	
C[C@@]1(c2cccc(C(=O)NNC(=O)Nc3ccc(Br)cc3)c2)NC(=O)NC1=O	801996668	GFFNRVAHAIWTHI-SFHVURJKSA-N	446.261	1.970	50	20	IDGD	
O=C(CCc1ccccc1)NNC(=O)NCCNS(=O)(=O)c1ccc(F)cc1Cl	802432601	HIUVYSTULQYMHB-UHFFFAOYSA-N	442.900	1.721	50	20	IDGD	
CN(C)S(=O)(=O)C[C@@H](NC(=O)NNC(=O)Cc1ccc(Cl)cc1)C(F)(F)F	805769093	JTJQAVSMTFCSSO-LLVKDONJSA-N	430.836	1.035	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccc(F)c(N2CCCNC2=O)c1	806977664	UDQDUEISACVRQA-UHFFFAOYSA-N	443.435	1.083	50	20	IDGD	
O=C(NNC(=O)C(=O)NC1CC1)C(=O)Nc1cccc(-c2ccc(Br)cc2)c1	806994034	NZRJUCBCZXKDBL-UHFFFAOYSA-N	445.273	1.481	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2ccc(F)c(S(=O)(=O)N(C)C)c2)cc1Cl	807021532	QOMKBRHUKQCRHG-UHFFFAOYSA-N	444.872	1.820	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)NCCc1ccc2c[nH]nc2c1	807243363	QZSNXVSTXHKSOD-UHFFFAOYSA-N	435.532	1.648	50	20	IDGD	
COC(=O)c1cc(F)c(Br)cc1NC(=O)C(=O)NNc1cccc(F)n1	807391112	XQROJJPYUSNHNY-UHFFFAOYSA-N	429.177	1.991	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)N[C@H](C)[C@H](c1ccccc1)N(C)C	807404102	YUIGSAWWMLUUQW-RHSMWYFYSA-N	446.577	1.924	50	20	IDGD	
C[C@H]1[C@@H](NC(=O)NNC(=O)c2csc(N3CCOCC3)n2)CCN1Cc1ccccc1	807619971	CWDFWZGMUPNUTD-RDJZCZTQSA-N	444.561	1.587	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCCC[C@@H]2COC(=O)NC2CCCC2)n1	810035001	YFQAIZBQFVFHTB-MRXNPFEDSA-N	437.566	1.665	50	20	IDGD	
Cc1ccccc1NC(=O)NNC(=O)C(=O)Nc1ccc(C(N)=O)cc1OCC(F)F	810392637	CPRWPTUSPHPQDE-UHFFFAOYSA-N	435.387	1.529	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NN=C2C(=O)Nc3cc4c(cc32)OCCO4)C1	814971537	IFWDKIHZIMONFS-LBPRGKRZSA-N	430.461	1.877	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2cc([N+](=O)[O-])c(C)cc2Cl)n1	815406262	BJYDYHPIMSKSQM-UHFFFAOYSA-N	426.838	1.868	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)cc1)C1CC1	815607556	BQTRGZNLVZBNMK-UHFFFAOYSA-N	434.456	1.178	50	20	IDGD	
CN(C)CCc1ccccc1NC(=O)C(=O)NNc1ccccc1S(=O)(=O)N(C)C	815751982	XCDARABMGDRPRH-UHFFFAOYSA-N	433.534	1.123	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2cccc(C(=O)NNC(=O)CNc3ccccc3)c2)C[C@H](C)O1	823327778	FPSLKNDPCDKJTE-HOTGVXAUSA-N	446.529	1.358	50	20	IDGD	
C[C@H]1CC(C)(C)C[C@@]2(C1)NC(=O)N(CC(=O)NNC(=O)COc1ccccc1F)C2=O	864019976	WUAFJPMHFPHIQW-YEJXKQKISA-N	434.468	1.489	50	20	IDGD	
CC(C)NC(=O)C(=O)NNC(=O)c1ccccc1C(=O)c1ccc(N(C)C)c([N+](=O)[O-])c1	899893503	VKGKNIHUPRVOEW-UHFFFAOYSA-N	441.444	1.177	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)CN2C(=O)N[C@]3(CCCC[C@H]3C)C2=O)cc1OC	913069831	PWABYKRSSIDCSL-PEBXRYMYSA-N	446.504	1.746	50	20	IDGD	
O=C(NNC(=O)c1cc2cc(Br)ccc2[nH]1)c1ccc(-n2cnnn2)cc1	913082270	PNAYKPUPUZGHEO-UHFFFAOYSA-N	426.234	1.981	50	20	IDGD	
COc1ccccc1CCNC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1	915904301	UDXRWUQAVZYVTC-UHFFFAOYSA-N	434.518	1.197	50	20	IDGD	
CC(C)CN1CCO[C@@H](CNC(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)C1	915922510	SGHSPGIKIFUGEB-AWEZNQCLSA-N	438.472	1.963	50	20	IDGD	
Cn1ccnc1[C@H](NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)c1ccc(F)cc1	916220864	FNADPVJNUYENRC-QGZVFWFLSA-N	449.446	1.540	50	20	IDGD	
CC(=NNC(=O)Cc1c[nH]c2ccccc12)c1ccc(S(=O)(=O)NCC(=O)O)cc1	916337652	FOQKXUGYZWTKJE-UHFFFAOYSA-N	428.470	1.614	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NCC[C@@](O)(c1nccn1C)C(F)(F)F	916378803	UHNNRVLXALWXLY-PIGZYNQJSA-N	447.389	1.497	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NC2CCN(CCc3ccccc3)CC2)c1	916382651	MVDRGTYDFHGKNL-UHFFFAOYSA-N	444.557	1.741	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCCCOCC(F)(F)F	916458965	NTEAHJUTQCKPEQ-UHFFFAOYSA-N	425.433	1.201	50	20	IDGD	
O=C(NC[C@@H](c1ccccc1)N1CCOCC1)NNC(=O)c1cc(Br)c[nH]1	916511694	YNOJJXYFAZYJSR-INIZCTEOSA-N	436.310	1.795	50	20	IDGD	
COCCn1cc(C(=O)NNC(=O)[C@@H](C)Oc2cccc(Br)c2)ccc1=O	917391816	GQNCUHWSIAHULW-GFCCVEGCSA-N	438.278	1.486	50	20	IDGD	
CCS(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)cc1	917728897	UNELRIOTYABDDZ-UHFFFAOYSA-N	439.515	1.045	50	20	IDGD	
O=C1CCc2cc(S(=O)(=O)NNC(=O)c3cc(Br)c[nH]3)c(F)cc2N1	917730966	GDGMBWQOSKAQHE-UHFFFAOYSA-N	431.243	1.424	50	20	IDGD	
CN(C)CCN1CCC(NC(=O)NNC(=O)c2ccc(F)cc2Br)CC1	918206225	ZPGQFUDWHPVDLP-UHFFFAOYSA-N	430.322	1.558	50	20	IDGD	
C[C@H](Cc1cccc(O)c1)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	919784422	QDBKKQWAGRCQGW-OAHLLOKOSA-N	446.529	1.752	50	20	IDGD	
O=C(NNC(=O)c1cccnc1SCc1ccc(F)cc1)N[C@H]1CCS(=O)(=O)C1	919886204	QIHLKCAGMWIPOX-AWEZNQCLSA-N	438.506	1.644	50	20	IDGD	
CCN(CC)C(=O)c1ccc(S(=O)(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)cc1	920310029	QWZDHJHUDPDUPH-UHFFFAOYSA-N	446.529	1.734	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(Br)cc2)C1)NC1CC1	920766562	WRGKLANKCNLMSS-LLVKDONJSA-N	445.339	1.343	50	20	IDGD	
COc1ccc(OC)c(CC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c1	921188266	PKSQNTFBRVVZAA-UHFFFAOYSA-N	426.517	1.606	50	20	IDGD	
O=C(CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@@H]12)NNC(=O)c1cc(-c2ccccc2)on1	921304522	WQPOKXUKMUNLQH-QILLFSRXSA-N	429.502	1.828	50	20	IDGD	
O=C(NNC(=O)c1cncn1-c1ccccc1)N[C@H](CN1CCOCC1)c1ccccc1	1248696296	OEEPLPDTJAHHQR-HXUWFJFHSA-N	434.500	1.890	50	20	IDGD	
C=CCNC(=S)NNC(=O)c1cc(C2CC2)nc2c1c(C)nn2[C@H]1CCS(=O)(=O)C1	1317737738	HPBMQSCEHSZDDE-ZDUSSCGKSA-N	448.574	1.272	50	20	IDGD	
O=C(COC(=O)c1csc(-c2ccco2)n1)NNC(=O)[C@H]1COc2ccccc2O1	1318298671	FQSTVNKSYWDRRV-OAHLLOKOSA-N	429.410	1.547	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCc2ccccc2N2CCN(C)CC2)cc1OC	1318331987	IXAQJHUNIAQOOJ-UHFFFAOYSA-N	427.505	1.600	50	20	IDGD	
Cn1c(C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)cc(Br)c1C=O	1322233711	OETZJOLPOMRZRE-UHFFFAOYSA-N	432.275	1.069	50	20	IDGD	
CNS(=O)(=O)c1ccc(Br)c(C(=O)NNc2nncc(N)c2Cl)c1	1322654585	BMIALUOVARPVST-UHFFFAOYSA-N	435.691	1.140	50	20	IDGD	
COc1ccc(N2CCN(C(=O)/C=C/C(=O)NNc3nncc(N)c3Cl)CC2)cc1	1337364649	FCMYXODYHGRUKK-VOTSOKGWSA-N	431.884	1.069	50	20	IDGD	
CC[S@@](=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@](C)(Cl)CCl)C2	1779220414	JKZMMUITQCMWJZ-RYTKRTQFSA-N	441.421	1.895	50	20	IDGD	
C[C@H](C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Br)C2)N1C[C@H]2C[C@H]2C1	1779252739	GWDGZBONZBFREA-OUSZYSOSSA-N	446.361	1.531	50	20	IDGD	
COc1cccc(OC)c1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1780541617	ANJJNKRHAUGMIJ-MAUKXSAKSA-N	445.285	1.838	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CNC(=O)c1cc(C)on1)C2	1780704882	WQBPDJDFTJVACI-YYFZDKIDSA-N	440.928	1.244	50	20	IDGD	
CC(=O)NC(C)(C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Br)C1	1780770221	IMISUJKSUSEIAE-PBFPGSCMSA-N	436.322	1.106	50	20	IDGD	
O=C(Cc1ccc(Br)nc1)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Cl)CCO2	1780875053	VMOSOEKKVCWEOG-GOEBONIOSA-N	434.693	1.751	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1	1782009005	NOAIKXZCZUJKAY-UGSOOPFHSA-N	433.288	1.449	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cccc4c3NC(=O)C4)C2)C1	1782411978	MNODMKXDJXHLLB-PMACEKPBSA-N	440.327	1.861	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)Oc2ccccn2)C1	1782540716	QRIDNZWCYURQSU-ZGPJWRFFSA-N	439.940	1.617	50	20	IDGD	
Cc1ccc(F)cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]21	1783694460	ZQZZTMNCILYJGZ-SNRMKQJTSA-N	434.512	1.100	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)COc3ccc(OC)cc3)[C@H]2C1	1783779808	JVCKBBXIOFDTNK-QZHFEQFPSA-N	440.924	1.308	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)Cc3c(C)nn(C)c3C)C2)C1	1784515200	QENSJSDQBGDOEB-LPHOPBHVSA-N	441.370	1.583	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)c3ccccc3)[C@H]2C1	1786671642	OMHQXNAZVKZQFU-IECFSIQFSA-N	439.350	1.873	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(C)nc(O)c3)[C@H]2C1	1787457528	NECFXXZNZJZECZ-TUUVXOQKSA-N	440.338	1.862	50	20	IDGD	
Cc1cc(C(N)=O)cc(C)c1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21	1788596302	DNJVEPVSDGDZIN-QEWYBTABSA-N	425.888	1.530	50	20	IDGD	
Cc1nnsc1C(=O)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1	1788756922	DEAHPOADTXOCTN-UHFFFAOYSA-N	436.302	1.588	50	20	IDGD	
COc1nccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]3C2)c1F	1788763872	BECBPQYWWLGXNU-BPUTZDHNSA-N	439.560	1.674	50	20	IDGD	
COCc1c[nH]c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)Br)C[C@@H]32)c1	1789213596	WGVOWYTVDUFRSJ-PCBIJLKTSA-N	428.327	1.538	50	20	IDGD	
Cc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)CBr)C[C@@H]32)c(O)n1	1789308244	HZKTUYVSOUVBOP-XTBFLFJDSA-N	440.338	1.720	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4c(c3)n(C)c(=O)n4C)C[C@@H]21	1789860018	RPPFODLHUKJMMI-GGXPGOJBSA-N	448.951	1.488	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(O)cc3F)C[C@@H]21)[C@H](F)Br	1789923512	QYCPDCHXNDYLDA-HLHNXRDNSA-N	433.249	1.815	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cn3ccc(C)n3)C[C@@H]21	1790961894	WDQSAUICDAYSCW-VGWMRTNUSA-N	427.343	1.345	50	20	IDGD	
CO[C@@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C[C@@H]21	1791317326	LFXGVJRDHCBBOV-YWKPPDPDSA-N	449.460	1.148	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(Cl)cc1F)c1cccc(B(O)O)c1	1792719753	FOWUTCDONPJZRM-BJWYYQGGSA-N	430.672	1.725	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CC13CCCN1CCC3)C2	1792874062	KEXUXLDMXUXRJF-XLMAVXFVSA-N	442.398	1.626	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(-n3cccn3)nc1)C2	1793449182	QIMIJYMOMLEUMP-ZMMAXQRCSA-N	431.924	1.878	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(C=O)s1	1795742307	IWBUGRYHZRLNIT-MCYUEQNJSA-N	429.336	1.795	50	20	IDGD	
CC(C)(C)c1cnc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)cn1	1796190968	JUHKJOKEFZQWGP-BCDXTJNWSA-N	436.321	1.020	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@]1(C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Cl	1796365567	ZGEZZHKAWVRDHB-MTCCJSQRSA-N	447.935	1.900	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1[C@H]2Sc3ccccc3[C@@H]21)c1cccc(B(O)O)c1	1798452667	JHJXVMOLFUBSJG-JUOVRFQDSA-N	448.353	1.506	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCS(=O)(=O)c1ccccc1)C2	1799266076	TXVRPNOZHRVWNP-LORHWOILSA-N	442.965	1.457	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3nonc3c1)C2	1799275442	SFAFRFQITFLHTD-ABXQLRGKSA-N	427.288	1.662	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnc2ccc(F)cn12	1800064089	ZUJSVEQMTNFADV-HBCWATKFSA-N	434.544	1.528	50	20	IDGD	
Cc1nc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)Br)c(C)s1	1800756307	AFYIECSYYFMBPO-UYAPLQMOSA-N	430.368	1.675	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1CCc2ccccc2O1	1802234991	OUNHBCSMHWLBGC-KYFSNAEOSA-N	449.511	1.331	50	20	IDGD	
CNc1nsnc1C(=O)NC[C@@H]1CCN(C(=O)[C@H](Cl)COC)[C@H]1c1cccnc1	1802477808	LXXFKGRGUSCZHQ-GUTXKFCHSA-N	438.941	1.548	50	20	IDGD	
C=CCNC(=O)/C=C\C(=O)NC[C@@H]1CCN(C(=O)CO[Si](C)(C)C)[C@@H]1c1cccnc1	1802480690	DLISUNSGSSRZKW-IYOIXKLHSA-N	444.608	1.797	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]1c1cccnc1	1803138155	XVHWNTZYPMAXEY-NGFQHRJXSA-N	432.746	1.718	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]2c2cccnc2)ncc1[N+](=O)[O-]	1803138886	HCIBOIGYDFOXGT-ZTFGCOKTSA-N	447.879	1.613	50	20	IDGD	
COc1cc(C)ccc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnccc1C(=O)NN)C2	1803584150	HNWDSVJDDMEKDG-MUJYYYPQSA-N	437.500	1.568	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@@H](CNC(=O)CCN2C(=O)C=CC2=O)[C@@H]1c1cccnc1	1803911611	BUBXJKBFQRNALT-JXFKEZNVSA-N	446.935	1.668	50	20	IDGD	
C#CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](Cl)COC)C2	1804376052	HVQFPKRGXNQXRQ-BQJWPVKWSA-N	441.956	1.795	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@@H]1c1cccnc1)c1cc(O)n[nH]1	1807289523	OGXVRYYLNXGASM-ZLKJLUDKSA-N	426.246	1.520	50	20	IDGD	
Cc1cccc(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)n1	1807361638	GTKWAHSWCKYSKV-SIKLNZKXSA-N	444.300	1.098	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)/C=C/C2CCCC2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807363309	BRWXMRRGUCXIET-VXSCLSAESA-N	447.344	1.827	50	20	IDGD	
CN1CCC[C@H]1C(=O)N1CC[C@H](CNC(=O)[C@@H](F)Br)[C@@H]1c1cccnc1	1808652640	YWHQOSJVPHOMEL-FXUDXRNXSA-N	427.318	1.872	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@H]1CCN(C(=O)Cc2cnccn2)[C@H]1c1cccnc1	1810537746	NIUAHGXRWLKBMV-UTKZUKDTSA-N	427.581	1.972	50	20	IDGD	
CC/C=C(\C)C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1	1813703910	YWHZCJBZDYJNIG-AEJBLPPUSA-N	436.516	1.756	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc(F)nc2F)n[nH]1	1814333054	HWTCCALBJWCGQW-AWEZNQCLSA-N	449.462	1.762	50	20	IDGD	
COCCCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[nH]n1	1814748116	TULFJDBCCKHPQL-ZZQPOVDQSA-N	443.508	1.962	50	20	IDGD	
Cc1nn[nH]c1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](C)CBr)CC2	1815931650	JQJYJXYTDDBRSE-CBAPKCEASA-N	427.328	1.826	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)N[C@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1	1823003789	MEYUFSABDSGNLS-BYULHYEWSA-N	436.307	1.193	50	20	IDGD	
Cc1cc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)CCC(=O)NN(C)C)CC3)ccc1O	1823328647	ZVVJZPBLUVXJRL-AWEZNQCLSA-N	445.545	1.756	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)[C@H]3[C@H]4SC=C[C@H]43)sc2C1	1824662416	AVASULKNFJWWEQ-KRRMDGCSSA-N	435.575	1.303	50	20	IDGD	
CN[C@H](CC(=O)N1CCC([C@H]2CCCCN2C(=O)CCBr)CC1)C(=O)O	1826357596	BLAGWWQTUIRIPU-HUUCEWRRSA-N	432.359	1.454	50	20	IDGD	
CCc1ccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)cn1	1827051352	UJJKVPYNNZJTAZ-HSZRJFAPSA-N	449.360	1.871	50	20	IDGD	
C#CC(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)[C@H](Cl)COC)C2)C1	1829267655	XCHOFVFMRZFCDB-XMSQKQJNSA-N	447.919	1.326	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1	1830363960	UWCOPJQBEDLJFO-SJORKVTESA-N	429.772	1.944	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CCc3ccoc3C1)CCO2	1830940372	KWSHOYXZEQHASY-FIKGOQFSSA-N	440.924	1.095	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3cnn(C)c3)C2)C1	1831646288	KLJZOFPTINHIHD-XLIONFOSSA-N	426.945	1.217	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3ccc(O)c(F)c3)CC2)CC1)[C@@H](O)CCl	1833313259	CQTPUUOCEXYHHP-SFHVURJKSA-N	427.904	1.316	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3cnn(C)c3)CC2)CC1	1834192907	NJMXBXBJBBGLEE-QGZVFWFLSA-N	440.386	1.779	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(CN(C(=O)C/N=C/c3ccco3)CCO2)C1	1837564520	VBEBDMHBWNROLB-XACCNFBGSA-N	437.569	1.006	50	20	IDGD	
O=C(c1cnc(Cl)c(Cl)c1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1837915406	GKYDQPFZFSYYMN-LRDDRELGSA-N	440.686	1.993	50	20	IDGD	
C[C@H]1C[C@]1(C)C(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1	1837921585	RCWPCKOKHPOJJS-HJPURHCSSA-N	428.338	1.025	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(C)nc3OC)CCO2)C1	1838172300	NVQJFHUSKAMPKM-DYESRHJHSA-N	439.940	1.876	50	20	IDGD	
CC(=O)NCCC(=O)N1CCC(OC2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1838648598	ZZSRWEGFYVCOIX-MRXNPFEDSA-N	436.322	1.202	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccccc3)CCO2)C1	1838852440	LTJSMHXOXPSHQI-APWZRJJASA-N	425.323	1.930	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CC[C@H](C(=O)OC)CC3)C2)C1	1839142019	BQSSVPNMZNIADC-NWZZKEMCSA-N	444.956	1.440	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4c(c3)OCCO4)C2)C1	1839144600	FWRHNCADNSAKQB-HRAATJIYSA-N	438.908	1.545	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccnc(NC(C)=O)c3)C2)C1	1839145010	QLKOOLNJEAWKCP-OXQOHEQNSA-N	438.912	1.127	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(-c4ccccn4)[nH]n3)C2)C1	1839145891	HFNQAIVSTFQDBR-QVKFZJNVSA-N	447.923	1.559	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)c3ccccc3)C2)C1	1839152345	WUPWJQYPBJMBKE-FFZOFVMBSA-N	445.343	1.413	50	20	IDGD	
C[C@H](C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](F)Br)CCO2)C1)c1cccs1	1839203114	AIRDUYPLLLFTEM-RVSPLBMKSA-N	449.342	1.999	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1[C@H]3SC=C[C@H]31)CCO2	1839700103	FQSWEAVADVZNAQ-LHLGERLTSA-N	431.352	1.101	50	20	IDGD	
Cc1nscc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)Br)CCO2	1840031512	SBVFELMRZLGTFZ-ZBEGNZNMSA-N	432.340	1.305	50	20	IDGD	
CCOc1ccsc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](Cl)COC)CCO2	1840149361	MPJSKQNVKJXBIB-KUHUBIRLSA-N	446.953	1.471	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C=C/c3cccs3)C2)C1	1840151996	TXMRFOJBTQXFTI-CHYGHELMSA-N	428.938	1.472	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@H](NC(=O)c2ccccc2)[C@@H](C)O)C1	1841223395	CTBKOIUTSIJSSO-NJAFHUGGSA-N	435.952	1.777	50	20	IDGD	
C[C@@H]1CCCN(C(=O)OC(C)(C)C)[C@@H]1C(=O)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1	1841351627	WGVWPBDLTZUUGF-OAGGEKHMSA-N	443.972	1.825	50	20	IDGD	
O=C(c1c[nH]c2cccc(Cl)c12)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843011570	RHESFDGUBJBMSN-UHFFFAOYSA-N	437.692	1.632	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)c2ccc(-c3ccccc3)nc2)C1	1844601012	RHWRQQUUTJJLHN-UHFFFAOYSA-N	441.296	1.559	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@@]2(C(=O)N2CCCC23CN(C(=O)[C@@H](O)CCl)C3)C1	1846127749	CDGSQJQIQXOYAM-VFCRVFHLSA-N	441.956	1.437	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)[C@@H]1C[C@H]1c1ccc(F)c(F)c1)C2	1846383966	NEORUHGKIGIHAG-JKSUJKDBSA-N	434.487	1.645	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cccc(S(C)(=O)=O)c1	1847384531	HSUMVNXDDBZQBZ-CQDKDKBSSA-N	429.336	1.689	50	20	IDGD	
Cc1ccc(CCC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2cnccc2C(=O)NN)s1	1848180741	YXESIOWOHRYAAG-ROUUACIJSA-N	427.530	1.503	50	20	IDGD	
CCCn1nc(C(=O)NNS(=O)(=O)c2cccc(C(=O)O)c2)c2ccccc2c1=O	13347490	VRRZUWINTRGWQS-UHFFFAOYSA-N	430.442	1.128	50	20	IDGD	
O=C(COC(=O)[C@H]1COc2ccc(Cl)cc2C1)NNC(=O)c1ccc([N+](=O)[O-])cc1	16796755	UTSMNHGTUJJTSB-CYBMUJFWSA-N	433.804	1.804	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)Cc1cccc(F)c1	28580945	WQLDPJKHJDQDFR-UHFFFAOYSA-N	449.504	1.169	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)COc2ccccc2C(F)(F)F)c1	46588632	QEQQBYCAIYYMBT-UHFFFAOYSA-N	445.419	1.796	50	20	IDGD	
O=C(Cn1cc(Br)ccc1=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	110882568	GSCDHBYEFAZUKA-UHFFFAOYSA-N	441.307	1.195	50	20	IDGD	
COCCCNC(=S)N(C)NC(=O)c1ccc(Cn2nc(C)c([N+](=O)[O-])c2C)cc1	726076825	FVSGQIOASPEQCP-UHFFFAOYSA-N	434.522	1.944	50	20	IDGD	
CCOc1ccc(OCC)c(NC(=S)NNC(=O)CN2C(=O)N[C@@](C)(C3CC3)C2=O)c1	727492394	PBYVVAKHIQWQHZ-FQEVSTJZSA-N	449.533	1.522	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)[C@@H](c3ccccc3)N(C)C)cc2)CC1	728214632	COUHITBQQNPSHE-HXUWFJFHSA-N	431.562	1.369	50	20	IDGD	
Cc1ccc(-n2c(C)cc(/C=C(\C#N)C(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)c2C)cc1	728384415	JDQZUKQDZXMDIM-WAKXPGHKSA-N	440.525	1.892	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)N1CCN(c2c(F)c(F)c(F)c(F)c2F)CC1	728957209	MYTALXBVEZVQSZ-UHFFFAOYSA-N	429.349	1.883	50	20	IDGD	
O=C(COc1ccc(OCc2ccccc2)cc1)NNC(=O)c1ccc2c(c1)C(=O)NC2=O	729509519	SFOAOFQZDVEROO-UHFFFAOYSA-N	445.431	1.989	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)NCCn2c(=O)oc3ccccc32)cc1	730127913	PALJWEWWKYGGFZ-AWEZNQCLSA-N	428.445	1.791	50	20	IDGD	
Cc1nn(-c2ccccc2)c(C)c1C(=O)C(=O)NNC(=O)CCN1C[C@@H](C)O[C@H](C)C1	732259299	CIYQHLDUVJMIBS-HUUCEWRRSA-N	427.505	1.319	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCCCC(=O)N2Cc3ccccc3C2)c1	732474867	YAFGCDUBSRSYJX-UHFFFAOYSA-N	444.513	1.357	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)NCc2ccc(N(C)S(C)(=O)=O)cc2)c1C	732476148	ZTRRLKUQMJJMIV-MRXNPFEDSA-N	448.545	1.997	50	20	IDGD	
COc1ccc(CNC(C)=O)cc1S(=O)(=O)NNC(=O)c1cnn(-c2ccccc2)c1	733122928	IXLVUHXPWOYFGB-UHFFFAOYSA-N	443.485	1.140	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2ccccc2O)c(F)cc1Br	734414743	NNKZQNYZZVRVKT-UHFFFAOYSA-N	447.238	1.704	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)[C@@H]2CC(=O)N(c3ccccc3)C2)CC1	734821123	GYRQODOALZIOAN-OAHLLOKOSA-N	445.520	1.769	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1cc(O)nc2ccc(F)cc12	737766982	XMYOKYAEYBIUBR-UHFFFAOYSA-N	431.449	1.756	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)NCCN1CCN(C(=O)C2CCCCC2)CC1	738477236	FOGUUHDUISTODB-UHFFFAOYSA-N	445.564	1.258	50	20	IDGD	
O=C(NNc1cccc(C(F)(F)F)n1)c1cccc(S(=O)(=O)N2CCOCC2)c1	740135806	BOFKRTKPQMCUTD-UHFFFAOYSA-N	430.408	1.878	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNS(=O)(=O)c1cc(Br)cc(F)c1OC	740812329	CXJDQBLKSDCCEJ-UHFFFAOYSA-N	440.291	1.211	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)c2ccccc2)c1	740852153	NMAJIERQHKPHCW-UHFFFAOYSA-N	446.529	1.578	50	20	IDGD	
CCN1C[C@@H](CN(C)CC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)Oc2ccccc21	741609330	BZMXYZSXOWESEH-QGZVFWFLSA-N	427.461	1.575	50	20	IDGD	
CC(=O)N[C@@H](Cc1c[nH]c2ccc(Br)cc12)C(=O)NNC(=O)NCC1CC1	742053307	HEHDFTCJAKDPPW-INIZCTEOSA-N	436.310	1.718	50	20	IDGD	
O=C(CN1C(=O)[C@H]2CCCC[C@@H]2C1=O)NNC(=O)NCc1cccc(C(F)(F)F)c1	742457343	FQDQBOKXYDCKQX-KBPBESRZSA-N	426.395	1.711	50	20	IDGD	
Cc1cc2c(cc1C)O[C@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)N3CCCC3)c1)C2	742468412	UCTADRYHCWGRMH-FQEVSTJZSA-N	443.525	1.853	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1c[nH]c2cc([N+](=O)[O-])ccc12	744622395	VKKQGOPMZHIXII-UHFFFAOYSA-N	445.457	1.854	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)COc2cccc(NC(=O)C3CC3)c2)c1	744697972	KFCURFBJAFCLER-UHFFFAOYSA-N	425.441	1.727	50	20	IDGD	
C[C@@H](CCN(C)C)NC(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	744865784	LFOCSFVMKOBAFP-INIZCTEOSA-N	436.520	1.673	50	20	IDGD	
O=C(NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)N[C@H]1CCc2c(O)cccc21	745865216	FPOQVSXFHSYIQR-SFHVURJKSA-N	444.513	1.808	50	20	IDGD	
CC(C)(CNC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)NC(=O)OC(C)(C)C	745926785	KPXUOXPHPSHJQG-UHFFFAOYSA-N	443.526	1.729	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)[C@H]1CS[C@H](Cc2ccccc2F)C(=O)N1	746636758	FOTFTBPDISIYNV-IAGOWNOFSA-N	441.488	1.006	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NCC(=O)NNc2ccc(Cl)c(F)c2)c1	746699528	FKQMFUMWFLZBPJ-UHFFFAOYSA-N	428.873	1.603	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)NCCCN1CCN(Cc2ccccc2)CC1	746750800	VPGCKSBTOXKRIY-UHFFFAOYSA-N	449.559	1.415	50	20	IDGD	
CCCCN1C(=O)CC[C@@H](C(=O)NNC(=O)C(=O)N2CCCC2)[C@@H]1c1ccccc1OC	748247846	VWLAYLVLDQHWTE-XLIONFOSSA-N	444.532	1.545	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)NCC2CCN(S(C)(=O)=O)CC2)c(C)n1C[C@@H]1CCCO1	748668355	YMTDFTHMKSAPHQ-OCBOALCKSA-N	448.589	1.979	50	20	IDGD	
Cc1cc(Br)ccc1NNC(=O)c1cc(C)c2c(=O)n(C)c(=O)n(C)c2n1	748744043	MNROWOGXUNOBJU-UHFFFAOYSA-N	432.278	1.768	50	20	IDGD	
O=C(CCSc1ccnc2cc(Cl)ccc12)NNC(=O)N[C@@H]1CCS(=O)(=O)C1	751361092	RATVYECRSZSTMM-GFCCVEGCSA-N	442.950	1.888	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CN2CCCN(C(=O)CCc3ccccc3)CC2)c1	751482901	MMUCXBSDDSJZLE-UHFFFAOYSA-N	433.512	1.486	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)[C@H]2CC(=O)N(CCOc3ccccc3Cl)C2)n1	751555563	KKLBOPTWIWVYAK-HNNXBMFYSA-N	433.896	1.228	50	20	IDGD	
C[C@H](NC(=S)NNC(=O)CN(C)S(=O)(=O)c1ccc(Br)cc1)C1CC1	751618024	GMEWVQNUAJCVBH-JTQLQIEISA-N	449.396	1.363	50	20	IDGD	
O=C(NC[C@H](O)CS(=O)(=O)c1cccs1)NNC(=O)c1ccc2ccccc2c1	752143227	NPDJYTGSUQEGHK-INIZCTEOSA-N	433.511	1.680	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)N[C@@H]2CCCN(Cc3ccccn3)C2=O)c1	753290278	PGHCPSBSRSTVNF-GOSISDBHSA-N	425.489	1.599	50	20	IDGD	
COc1cc(CN2CC[C@H](NC(=O)NNC(=O)COc3ccccc3O)C2)cc(OC)c1	756103790	UKHUNXRSTTXRBO-INIZCTEOSA-N	444.488	1.393	50	20	IDGD	
Cc1nc(C)n(-c2ccccc2NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)n1	757709282	BXWMOUYZPMKDNS-UHFFFAOYSA-N	432.444	1.598	50	20	IDGD	
Cc1nn([C@@H]2CCS(=O)(=O)C2)c(C)c1NC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	757871816	NKIFYFVYYYQNAE-CQSZACIVSA-N	436.450	1.234	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1S(=O)(=O)NC1CC1	757873789	LWRSBMUDJFLLSK-UHFFFAOYSA-N	446.485	1.673	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)N[C@@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1C#N	758758499	IKCXMKNMMMPUHC-UONOGXRCSA-N	427.465	1.346	50	20	IDGD	
CCOc1cc(C(=O)NNS(=O)(=O)c2cnc(Cl)n2C)cc(OCC)c1OCC	759708859	QLNPLVMXDCSTJS-UHFFFAOYSA-N	446.913	1.893	50	20	IDGD	
COc1ccc(/C=C(/C#N)C(=O)OCC(=O)Nc2cc(S(N)(=O)=O)ccc2C)cc1	759861588	RQDUEAJROOJGFA-DHDCSXOGSA-N	429.454	1.740	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2ccnn2Cc2ccc(F)cc2)n1	760315290	SVNWJBJRNAPWKI-UHFFFAOYSA-N	426.456	1.789	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCCC(=O)NNC(=O)c1ccc(Cl)nc1	760799242	MIXUYHWSCCBBFM-ZDUSSCGKSA-N	439.900	1.402	50	20	IDGD	
CC[C@@H](NC(=O)NNC(=O)C(=O)Nc1ccccn1)[C@@H]1CN(Cc2ccccc2)CCO1	761789382	HKCJYQQBKQSCOZ-MSOLQXFVSA-N	440.504	1.030	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)N[C@H]1CCCN(c2ccccc2F)C1=O	761814593	ASRWSLHAULQSQR-ZDUSSCGKSA-N	433.465	1.143	50	20	IDGD	
CC(=NNC(=O)Cn1c(C)nc2ccccc21)c1c(C)nn(CCS(C)(=O)=O)c1C	763132490	ZSKONMILEKIKNX-UHFFFAOYSA-N	430.534	1.743	50	20	IDGD	
O=C(NNC(=O)c1ccccn1)C(=O)Nc1cccc(N2C(=O)c3ccccc3C2=O)c1	763463912	HNJWSEQEWUZRIG-UHFFFAOYSA-N	429.392	1.282	50	20	IDGD	
Cc1ccc(C(=O)N2C[C@@H](C)C[C@@H](C)C2)cc1NC(=O)C(=O)NNC(=O)c1ccncc1	763464940	REJQHHPDVRPYAL-GASCZTMLSA-N	437.500	1.908	50	20	IDGD	
CCn1cc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccncc3)nc3ccccc23)cn1	763538107	JAZGNRUWTCNYHN-UHFFFAOYSA-N	429.440	1.913	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2c(C)nc3ccccn23)c(F)cc1F	763629101	OPRDPCHQEVMNCC-UHFFFAOYSA-N	431.355	1.107	50	20	IDGD	
CN1Cc2ccc(NC(=O)C(=O)NNC(=O)COc3cccc(C(F)(F)F)c3)cc2C1	763641259	SAAXCZOMLWXYHM-UHFFFAOYSA-N	436.390	1.816	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(CN2CCCC2=O)cc1	763713337	YELXRLWFKCUTPA-UHFFFAOYSA-N	438.484	1.536	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)c2cc([N+](=O)[O-])ccc2SCCO)c1	763740890	DYTJDKMBFBOTGV-UHFFFAOYSA-N	433.442	1.606	50	20	IDGD	
COCCn1nc(C)c(NC(=O)C(=O)NNC(=O)CC23CC4CC(CC(C4)C2)C3)c1C	763752815	RPYBXPXDCKIQOQ-UHFFFAOYSA-N	431.537	1.839	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)C(=O)Nc2cc(N3CCCC3=O)ccc2Cl)c1	763755007	YYTZQQNCDWDFQD-UHFFFAOYSA-N	443.891	1.933	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)C(=O)Nc2ccccc2Br)c2ccccc2c1=O	763790597	KSZWRJUBHFDZOY-UHFFFAOYSA-N	444.245	1.096	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])cc1OC	763803358	MHEDTVUNKCDXAB-UHFFFAOYSA-N	432.389	1.167	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(C(=O)NC(C)C)cc2C)cc1	763809764	OZRHFMJFNBQULR-UHFFFAOYSA-N	426.473	1.607	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(C(=O)OC)ccc2-n2cc(C)cn2)cc1	763831834	NPTYRYIYTILVSU-UHFFFAOYSA-N	449.467	1.929	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)c1	763857752	WFDVIKGGACNUBW-UHFFFAOYSA-N	434.368	1.270	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)C(=O)Nc1ccccc1N1CCCC1	763949484	OYVCNADEGHYGJJ-UHFFFAOYSA-N	434.456	1.578	50	20	IDGD	
O=C(NNC(=O)c1ccc(COc2ccccc2)o1)C(=O)Nc1ccccc1-n1ccnn1	763950520	WKZRNWSKCIHQKE-UHFFFAOYSA-N	446.423	1.839	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)Cc2cccc3ccccc23)ccc1-n1cnnn1	764019150	GTBJIPOEIWQBRM-UHFFFAOYSA-N	429.440	1.453	50	20	IDGD	
O=C1CCc2cc(F)c(NC(=O)C(=O)NNC(=O)c3cccc(Br)c3)cc2N1	764062720	BKUSLSBHLKTOOD-UHFFFAOYSA-N	449.236	1.873	50	20	IDGD	
O=C(NNC(=O)C1CCCC1)C(=O)N1CCc2cc(S(=O)(=O)N3CCCCC3)ccc21	764070652	NYVSJVRNYSABAN-UHFFFAOYSA-N	448.545	1.088	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C)cc2OC[C@@H]2CCCO2)c(O)c1	764104905	IERXVZAAIZJQRI-HNNXBMFYSA-N	427.457	1.967	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cnn(-c4ccccc4)n3)n[nH]2)cc1	764111840	GLEUELQKLVCBNV-UHFFFAOYSA-N	430.428	1.366	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CCc2ccco2)c(C)c1S(=O)(=O)NC1CC1	764172400	WPEXGCLTTISMBW-UHFFFAOYSA-N	448.501	1.056	50	20	IDGD	
Cc1cnn(-c2ccc(C(N)=O)cc2NC(=O)C(=O)NNC(=O)CCC2CCCCC2)c1	764214826	GNICMVIVTQZGDT-UHFFFAOYSA-N	440.504	1.726	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)CCc2ccccc2O)n(-c2ccc(F)cc2)n1	764289659	XRQRFXIGBRAKCG-UHFFFAOYSA-N	425.420	1.744	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)C(=O)Nc1ccc(CN2CCCC2=O)cc1	764351409	RFPGZFMHGCOMGR-UHFFFAOYSA-N	446.467	1.394	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)N2C[C@H](C(=O)N3CCCCC3)Oc3ccccc32)o1	764371556	PCZAQWWKKZXVAW-GOSISDBHSA-N	440.456	1.156	50	20	IDGD	
CNS(=O)(=O)c1cccc([C@H](C)NC(=O)NNC(=O)CSc2ccccc2O)c1	764398072	UERWXTABFLPCAX-LBPRGKRZSA-N	438.531	1.484	50	20	IDGD	
CCOc1ccc(Oc2ccc(NC(=O)C(=O)NNC(=O)[C@@H]3COCCO3)cc2)cc1	764433330	MKIILFCRELUQBF-SFHVURJKSA-N	429.429	1.379	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)[C@@H](C)NS(=O)(=O)c2cccc(C#N)c2)c1	764523146	GDYYBMCCIBETHG-OAHLLOKOSA-N	430.486	1.068	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NN=Cc1ccc(-n2cncn2)c(F)c1	764830555	KLHLFDCAGWRKCG-UHFFFAOYSA-N	435.463	1.315	50	20	IDGD	
O=C(CCNS(=O)(=O)/C=C\c1ccccc1)NNC(=O)CSc1ccccc1O	765249047	NPSSSYMKDUSMEJ-QBFSEMIESA-N	435.527	1.612	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)[C@@H]1CN(C(=O)OC(C)(C)C)CCO1	765313210	OIKZWNTWTCJOPA-ZDUSSCGKSA-N	430.502	1.075	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)c2ccc(CS(C)(=O)=O)cc2)n[nH]1	765596037	PCLUYGFOAIFQPA-UHFFFAOYSA-N	428.470	1.705	50	20	IDGD	
Cc1ccc(Cl)c(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1	765643657	RCQSVPUDXGRWJH-UHFFFAOYSA-N	431.923	1.522	50	20	IDGD	
CC(C)(C)OC(=O)NCc1cc(C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)ccn1	766136595	MPIBOIPTDMPZBE-UHFFFAOYSA-N	448.501	1.585	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc([N+](=O)[O-])c2cccnc12)c1ccc2c(c1)OCCO2	766357103	SPWNEDPGAZOETG-UHFFFAOYSA-N	430.398	1.538	50	20	IDGD	
CCc1noc(CCCC(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)n1	766660521	NATLSNJIFKFAQY-UHFFFAOYSA-N	448.955	1.573	50	20	IDGD	
CC(C)(C)[C@H](Br)C(=O)OCC(=O)N1CCc2cc(S(N)(=O)=O)ccc21	766745988	KNSPAXNFAAMRFI-CQSZACIVSA-N	433.324	1.576	50	20	IDGD	
Cc1cccc(C)c1CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	767195856	DPELHWYNEKBYTA-UHFFFAOYSA-N	446.529	1.469	50	20	IDGD	
Cc1cc(C=NNC(=O)C[C@H](C(=O)NN=Cc2cc(C)oc2C)N2CCOCC2)c(C)o1	767901656	WCFSNTCPGBVJFB-HXUWFJFHSA-N	443.504	1.798	50	20	IDGD	
COc1cc2c(cc1NC(=O)C(=O)NNC(=O)c1cccc(OC(F)F)c1)NC(=O)CC2	768240395	WBRYHWWFWPSRIT-UHFFFAOYSA-N	448.382	1.581	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1O)C(=O)Nc1cc(C2CC2)nn1-c1ncccn1	768240571	YASVYFXYKPPTSF-UHFFFAOYSA-N	441.835	1.298	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)[C@H](C)S(=O)(=O)c2ccc(F)cc2)n[nH]1	768281850	QYIFTZZCRGUSRY-LBPRGKRZSA-N	446.460	1.848	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc2ccccc2c1)NNC(=S)Nc1ccccn1	768579638	SUUJSDNFUJBYJD-UHFFFAOYSA-N	429.527	1.921	50	20	IDGD	
CCN(C(=O)[C@H](C)OC(=O)[C@@]12CC[C@@H](C[C@H]1Br)C2)[C@H]1CCS(=O)(=O)C1	769983205	UGBLUTRROCVUAU-CKENWRIRSA-N	436.368	1.907	50	20	IDGD	
CSCCNC(=S)NNC(=O)Cc1ccc(S(=O)(=O)N2CCCCC2)s1	770248093	RQOOWJBJOUPMIU-UHFFFAOYSA-N	436.650	1.324	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)[C@@H]3CCCN3C(=O)c3ccc4ccccc4c3O)nc21	771020641	KWOJCDFGIFZWAH-INIZCTEOSA-N	447.455	1.676	50	20	IDGD	
COc1ccccc1[C@]1(C)NC(=O)N(CC(=O)NNC(=O)C(C)(C)c2ccccc2)C1=O	771268823	VZMMOKGZSQBDNO-QHCPKHFHSA-N	438.484	1.587	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1	773270196	ZTYDIWJSLRAGAB-LBPRGKRZSA-N	439.394	1.638	50	20	IDGD	
CS(=O)(=O)NCc1ccc(NC(=O)C(=O)NNc2ccc(C(F)(F)F)cn2)cc1	773670201	XSEIKVMVSOZHSQ-UHFFFAOYSA-N	431.396	1.231	50	20	IDGD	
CCOCCCNC(=O)c1cccc(NC(=O)C(=O)NNc2cnc3ccccc3n2)c1	773718585	NBVBGPFZJFNNSJ-UHFFFAOYSA-N	436.472	1.868	50	20	IDGD	
N#C/C(=C\c1ccc(O)cc1)C(=O)NCc1ccc(S(=O)(=O)N2CCOCC2)cc1	776603273	JWSGJQOWBYPQGR-QGOAFFKASA-N	427.482	1.636	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2cc(Cl)ccc2OC[C@@H]2CCOC2)n1	778707635	ONJWPBCRBRRKEG-CQSZACIVSA-N	449.895	1.355	50	20	IDGD	
COc1cc(OC)c(NC(=O)C(=O)NNC(=O)c2cccn2C)cc1Br	778709261	FNAPEJGIPGESCA-UHFFFAOYSA-N	425.239	1.205	50	20	IDGD	
CCNC(=O)CC(=O)NNC(=O)c1ccc(NS(=O)(=O)c2ccc(OCC)cc2)cc1	780847840	DBSPFOJBSZRKGZ-UHFFFAOYSA-N	448.501	1.173	50	20	IDGD	
COc1ccc(NNC(=O)[C@@H](CCS(C)(=O)=O)NC(=O)c2ccccc2Cl)nc1	781518605	HKHFSJJTMSNLRJ-OAHLLOKOSA-N	440.909	1.420	50	20	IDGD	
CSc1nnc(CNC(=O)NNC(=O)COc2ccc(Br)cc2)s1	782653704	MWPUULDNPDJSRB-UHFFFAOYSA-N	432.325	1.932	50	20	IDGD	
Cc1cnn(-c2ccc(C(N)=O)cc2NC(=O)C(=O)NNc2nc3ccccc3s2)c1	782812547	NZZCGWPMQFQTMU-UHFFFAOYSA-N	435.469	1.971	50	20	IDGD	
CCCOc1cc(F)ccc1NC(=O)C(=O)NNC(=O)Cc1nc2ccccc2n1C	782887021	NRODFAUGILDJCC-UHFFFAOYSA-N	427.436	1.830	50	20	IDGD	
O=C(NNC(=O)C(=O)NC1CC1)C(=O)Nc1ccccc1SC[C@H]1CC1(Cl)Cl	782965930	JVOPPLQXTBBBOX-SECBINFHSA-N	445.328	1.337	50	20	IDGD	
CNS(=O)(=O)c1cc(NC(=O)C(=O)NNc2ccc(Cl)cc2[N+](=O)[O-])ccc1C	783292006	ZKRLAOMMLWOZAJ-UHFFFAOYSA-N	441.853	1.547	50	20	IDGD	
Cc1ccc(NNC(=O)C(=O)Nc2ccc(S(=O)(=O)N3CCC[C@@H](C)C3)cc2)nn1	783953678	VQZMLGXPNZWIFE-CYBMUJFWSA-N	432.506	1.287	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)NC(C)(C)C)nn1CCC#N	784834230	YFMNZYITDACLDC-UHFFFAOYSA-N	447.521	1.264	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNc2ccnc(Br)c2)cc1	784837941	OZRRZVABLMNLEI-UHFFFAOYSA-N	442.295	1.688	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2ccc(NS(=O)(=O)CC)c(C)c2)n1	785226603	JSSYIBTXOFBYNQ-UHFFFAOYSA-N	449.537	1.475	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(c2ncc(NC(=O)NNc3ncc(F)cn3)cn2)CC1	786186897	PZWJBBLXGKYTRZ-UHFFFAOYSA-N	433.448	1.611	50	20	IDGD	
C[C@H]1[C@H](C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)CCN1C(=O)OC(C)(C)C	787993210	OKJBLBNWGDMTKH-DZGCQCFKSA-N	429.477	1.984	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)c1cccc(S(=O)(=O)N2CCCCCC2)c1	788178212	QIZJUQPFEIKJNQ-UHFFFAOYSA-N	441.517	1.984	50	20	IDGD	
CC(C)(C)OC(=O)N1CC2(C[C@H]2C(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)C1	789292422	ZYLSPHMUXAONTM-AWEZNQCLSA-N	437.880	1.901	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CN2CCN(C(=O)c3cc4ccccc4s3)CC2)c1	789370705	SJDXZQIXYVRERB-UHFFFAOYSA-N	447.520	1.992	50	20	IDGD	
O=C(NNc1nc2ccccn2n1)C(=O)Nc1cc(Cl)ccc1OC[C@@H]1CCOC1	792395236	QOKKYMHPRMKBAY-GFCCVEGCSA-N	430.852	1.880	50	20	IDGD	
O=C(O)c1ccc(S(=O)(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c(OC(F)(F)F)c1	792699397	UGPQQSWVOUJOTB-UHFFFAOYSA-N	449.319	1.815	50	20	IDGD	
CC(C)(C)c1cc(NC(=O)C(=O)NNC(=O)Cc2ccncc2)n(-c2ccc(C#N)cc2)n1	793025661	NHHLIEFQSIMNTM-UHFFFAOYSA-N	445.483	1.765	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)N2CCN(S(=O)(=O)c3ccc(C)c(C)c3)CC2)n1	793221525	WVHHFAWGGVAVKD-UHFFFAOYSA-N	431.518	1.368	50	20	IDGD	
C[C@H](C(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1)N(C)CC(F)(F)F	793520469	VWLRSPWLYSRSCE-LLVKDONJSA-N	425.452	1.599	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)cc1	796384885	PZKLFCXICSQXOI-QHCPKHFHSA-N	435.572	1.648	50	20	IDGD	
O=C(CN1CC[C@@]2(CCN(Cc3ccccc3)C2)C1)NNC(=O)c1ccc([N+](=O)[O-])cc1	796441379	CIIVITVTHRMXKE-HSZRJFAPSA-N	437.500	1.954	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNc2cccc(S(C)(=O)=O)c2)c(OC)c(C)c1OC	796985557	QJKRZQRFAPAWKA-UHFFFAOYSA-N	437.474	1.506	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCN(c3cncc4ccccc34)CC2)cc1OC	801948959	JPWBBKATLZGFSJ-UHFFFAOYSA-N	449.511	1.835	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2cc(S(N)(=O)=O)ccc2Br)cc1	802059262	GHNPHVRXHDSXGL-UHFFFAOYSA-N	443.279	1.572	50	20	IDGD	
Cc1nn(C)c2sc(C(=O)N[C@@H](C)C(=O)NNC(=O)Nc3ccc4c(c3)OCO4)cc12	802105730	CUFFSMPQUYFDRT-JTQLQIEISA-N	444.473	1.643	50	20	IDGD	
COC(=O)c1c(F)cc(NC(=O)C(=O)NNC(=O)Cc2c[nH]c3ccccc23)cc1F	802566339	KLQJQKXXSCLSLD-UHFFFAOYSA-N	430.367	1.561	50	20	IDGD	
CC[C@H](C)[C@H](NC(C)=O)C(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	802762346	CJQVMMYYFJJUKG-YWZLYKJASA-N	437.972	1.156	50	20	IDGD	
CNS(=O)(=O)c1cc(NC(=O)NNC(=O)c2ccc(Cl)cc2OC)ccc1F	806546097	NOGWONLSIXRKJY-UHFFFAOYSA-N	430.845	1.862	50	20	IDGD	
COC(=O)c1c(C)csc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	806978585	BCGUZDXCXRFNJR-UHFFFAOYSA-N	445.432	1.772	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCCCc2cccc(C)n2)cc1	807431041	RDZUTRCULLEVSY-UHFFFAOYSA-N	433.534	1.282	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)N[C@H]3CCCN(C(=O)N4CCCC4)C3)nc21	807459571	KXEHZDDVGCZCMX-ZDUSSCGKSA-N	445.528	1.593	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNc2nccnc2C2CCC2)c(OC)c(OC)c1	807460823	WJODJGBJTOWISA-UHFFFAOYSA-N	429.433	1.630	50	20	IDGD	
CON(C)S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2nccnc2C2CCC2)cc1	807462306	UHCHKLRCRSFISJ-UHFFFAOYSA-N	434.478	1.008	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc2c(c1)CCN2C(=O)C(=O)NNc1nccnc1C1CCC1	807462351	WMMJBIFUEGWZDC-UHFFFAOYSA-N	444.517	1.027	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNS(=O)(=O)c2cnc(NC(C)=O)s2)c1	808088286	CYKQMAKPRDJGTO-UHFFFAOYSA-N	449.308	1.496	50	20	IDGD	
O=C(COC(=O)C1(c2cccnc2)CCCC1)NNC(=O)[C@@H]1COc2ccccc2O1	808568369	KFSTYHDNSOKKIK-SFHVURJKSA-N	425.441	1.424	50	20	IDGD	
CCOc1ccc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)c3cncn3C)cc2)cc1	809559111	ZUCRNRDTKSSVPQ-UHFFFAOYSA-N	443.485	1.694	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)CNS(=O)(=O)c1ccccc1F	811462421	PGZQHDOYWKVZRG-LLVKDONJSA-N	429.857	1.372	50	20	IDGD	
CC(=NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)c1cccc(N2CCOCC2)c1	812392674	SWURPRNBCBCLSR-UHFFFAOYSA-N	430.530	1.928	50	20	IDGD	
CCCCN(C)C[C@@H](C)NC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	812508372	XPTRBJRXFTVKDF-MRXNPFEDSA-N	439.582	1.536	50	20	IDGD	
Cc1cnc(Br)c(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)c1	812979447	ULGFVQPDLVMWHQ-JTQLQIEISA-N	439.241	1.845	50	20	IDGD	
CCCOC(=O)c1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)cc1	813033198	JKHMGPLTLOCYHA-UHFFFAOYSA-N	448.501	1.586	50	20	IDGD	
O=C(CCOc1ccccc1)NNS(=O)(=O)CCCCN1C(=O)c2ccccc2C1=O	814210692	IROSNZLCCCUMTA-UHFFFAOYSA-N	445.497	1.483	50	20	IDGD	
CC(C)[C@@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	814210715	JCAQEXUFXADGBA-OAHLLOKOSA-N	442.538	1.247	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N1CC[C@]2(CCN(C)C2)C1	814270596	AFONOCQLZWUSEF-ACJLOTCBSA-N	425.327	1.985	50	20	IDGD	
COC(=O)N1CCN(c2ccc(NC(=O)C(=O)NNc3ccc(F)cc3F)cn2)CC1	815588165	FQVZQYAWVHMJGQ-UHFFFAOYSA-N	434.403	1.330	50	20	IDGD	
CCOc1ccc(C(F)(F)F)cc1NC(=O)C(=O)NNC(=O)[C@@H]1CCc2nncn2C1	815692678	YFOZHEKMDFLILN-SNVBAGLBSA-N	440.382	1.044	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)c2ccc(S(N)(=O)=O)cc2)c1	818745270	GKDWPYPKKMBZSO-UHFFFAOYSA-N	428.264	1.640	50	20	IDGD	
Cc1ccc2[nH]c(C(=O)NNC(=O)c3cccc(S(=O)(=O)N4CCOCC4)c3)cc2c1	822720437	NCYMIAIGBJMARD-UHFFFAOYSA-N	442.497	1.572	50	20	IDGD	
O=C(CNc1ccccc1)NNC(=O)C1CCN(S(=O)(=O)/C=C/c2ccccc2)CC1	823328519	GBHIZQACCQKKAX-DTQAZKPQSA-N	442.541	1.959	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)c(C)c2)c1	880229693	DKIZPIKRWDFMFR-UHFFFAOYSA-N	434.518	1.192	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NCCc3ccc(F)cc3)nc2)CC1	903952763	VEHJFIJDBVLTTG-UHFFFAOYSA-N	436.513	1.026	50	20	IDGD	
O=C(NNc1ncccn1)C1CCN(S(=O)(=O)c2cccc(OC(F)(F)F)c2)CC1	913044111	XASJLXQTOSSQGX-UHFFFAOYSA-N	445.423	1.919	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)CNS(=O)(=O)c2c(F)cccc2F)c1	913449268	RHJHQNDUZQFEGU-UHFFFAOYSA-N	427.429	1.086	50	20	IDGD	
O=C(NNC(=O)c1ccc(S(=O)(=O)N2CCOCC2)o1)c1cc(-c2ccccc2)on1	914753382	UWMVHZJFPHFARJ-UHFFFAOYSA-N	446.441	1.030	50	20	IDGD	
O=C(CSc1nnc(O)nc1O)NN=CC1=Cc2cc(Br)ccc2OC1	915270900	DZLNAEHSWXTVHJ-UHFFFAOYSA-N	438.263	1.715	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)NC[C@@H](c2cccs2)N2CCOCC2)c1	915893226	GXVRAIADAAHQME-KRWDZBQOSA-N	434.518	1.783	50	20	IDGD	
COc1cc(CNC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)ccc1OC(F)F	915932540	PZNBBVQQVHKHBL-UHFFFAOYSA-N	447.398	1.688	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)NC2CCCCC2)cc1	916110652	HLKDJNIISIERFX-UHFFFAOYSA-N	432.568	1.542	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)NCc1ccc(Cn2cncn2)cc1	916227797	LTBAASQGPSQEMA-UHFFFAOYSA-N	425.405	1.144	50	20	IDGD	
CCNC(=O)c1ccc(CNC(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)cc1	916391996	PNLCQNZOGYZMDK-UHFFFAOYSA-N	430.461	1.606	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@H](C(=O)NNC(=O)COCc3ccccc3)C2)cc1	916559976	AVCPVAJLUMCEPH-IBGZPJMESA-N	445.541	1.760	50	20	IDGD	
Cc1nc2ncnn2c(C)c1CCC(=O)OCC(=O)NNC(=O)c1cccc(Cl)c1	917243554	FNTPIFMWVFKLNU-UHFFFAOYSA-N	430.852	1.332	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NN=Cc1ccc2c(c1)CCO2	917531761	IIJLIHSCZXKXQZ-UHFFFAOYSA-N	443.525	1.725	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H](c2ccc3c(c2)OCCO3)C2CC2)c1	918139180	AVKADEXJFRHFHI-LJQANCHMSA-N	445.497	1.957	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)[C@@H]2CCCN(CC(F)(F)F)C2)ccc1Cl	919838872	PZMMXTZKCZKZQK-SNVBAGLBSA-N	442.847	1.023	50	20	IDGD	
Cc1nn(Cc2ccccc2)c(Cl)c1C(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1	919886607	XUIUEEAGZLFCQZ-CYBMUJFWSA-N	425.898	1.024	50	20	IDGD	
CCOc1ccc(C(=O)NNS(=O)(=O)c2cc(CC(=O)O)ccc2OC)cc1OC	919955923	NGMANARBWVUDFK-UHFFFAOYSA-N	438.458	1.353	50	20	IDGD	
Cn1c(O)nc2cc(C(=O)NNC(=O)c3cccc(S(=O)(=O)N4CCCC4)c3)ccc21	920287171	FYZGFKYUYFVLQZ-UHFFFAOYSA-N	443.485	1.138	50	20	IDGD	
CC/C=C(/C)C(=O)N1CSC[C@H]1C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C	1251873839	FWRZXHBRNLRHFG-OTAKNEKHSA-N	429.543	1.099	50	20	IDGD	
CNS(=O)(=O)c1ccc(Br)c(C(=O)NNC(=S)N[C@H](C)C2CC2)c1	1329290121	CMQGWEDDNNUVJF-MRVPVSSYSA-N	435.369	1.265	50	20	IDGD	
C[C@H]1CCCN(C(=O)CCNC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)C1	1519987563	KCMICLMZDNZIGO-IBGZPJMESA-N	444.580	1.178	50	20	IDGD	
O=C(c1ccc2c(c1)COC2)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1777914548	HXUACLIBHOSLEQ-MAUKXSAKSA-N	427.270	1.851	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H]1ON=C(c3ccccc3)O1)C2)[C@H](F)Cl	1778029545	CCLOAIXPHCWLMC-VVVONTASSA-N	439.871	1.769	50	20	IDGD	
Cc1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](C)CBr)C3)n[nH]1	1780131432	HGEXZABIAUKWGP-CDHAZOANSA-N	427.343	1.877	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cccc(N4CCOCC4)n3)CCO2)C1	1781219235	SSGVFHOETPXCKM-IIBYNOLFSA-N	436.940	1.379	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc4c(c3)n(C)c(=O)n4C)CCO2)C1	1781219795	VCAJBKBKHZPOEW-QVKFZJNVSA-N	434.924	1.338	50	20	IDGD	
COc1ccccc1CC(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781335375	XVFZNQDEOTWTSX-AEFFLSMTSA-N	429.286	1.758	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H]1Cc3ccccc3N1)C2	1782179652	KTQDYLZOVWIPHU-FAGZOMQFSA-N	435.952	1.791	50	20	IDGD	
O=C(c1nc2cc([N+](=O)[O-])ccc2[nH]1)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Cl)CCO2	1782181871	HCWZYEHFBCLVQL-GUYCJALGSA-N	425.804	1.449	50	20	IDGD	
O=C([C@@H](F)Br)N1CCO[C@@]2(CCN(C(=O)[C@@H]3Cc4ccccc4N3)C2)C1	1782841624	FPIXVRICEABZQC-HDMKZQKVSA-N	426.286	1.544	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cc4n(n3)CCCO4)CCO2)C1	1783349858	UIQDSVGHEVZKJR-SCLBCKFNSA-N	441.326	1.283	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cccn4nccc34)CCO2)C1	1783351812	DIAMHSHHOZOYOR-BEFAXECRSA-N	435.322	1.951	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc4c(c3)CCCC4=O)CCO2)C1	1783874070	CHOYFZQGHQYVJV-PGRDOPGGSA-N	434.920	1.903	50	20	IDGD	
CCOC(=O)c1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](Cl)COC)C3)C2)cc1	1783879717	AEEHEDQINMKLCY-DYESRHJHSA-N	438.908	1.561	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)c(F)c1F	1783938460	YVJSCTHHFHAWDG-NRFANRHFSA-N	438.475	1.090	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C3(c4ccc(F)c(F)c4)CC3)C[C@@H]21)[C@@H](O)CCl	1784092851	NDLABWHBRZHVPS-ZUXXIDCJSA-N	442.890	1.576	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ncc(F)cc3F)[C@H]2C1	1784768838	QHKCTXJRYZXGKM-NOLJZWGESA-N	427.524	1.805	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(F)cn3)[C@H]2C1	1786211682	IVMIYOFNEOKLLN-DSPQJCBJSA-N	428.302	1.845	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CC3CCOCC3)[C@H]2C1	1786739267	BBGZREXSPWAOBN-QAETUUGQSA-N	431.371	1.956	50	20	IDGD	
CCOc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)Br)C[C@@H]32)nn1	1789398754	SXNQAQKGKLBCLL-OSFYFWSMSA-N	441.326	1.252	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)Nc1ccc(C2(NC(=O)CCC(=O)NN(C)C)CCC2)cc1	1789488673	PZKJFAIZGPCQRL-OAHLLOKOSA-N	446.552	1.201	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](N)c3ccccn3)C[C@@H]21	1789866725	XBCJFJRCAQDNNF-CPJSGKAGSA-N	429.348	1.297	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnn4ccncc34)C[C@@H]21)[C@@H](F)Br	1789926461	ZARGCMHUAGICGC-HQRZJTNHSA-N	440.273	1.013	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)c1cc(O)ccc1F	1790053793	MKNXTYIHCMQKPG-MOUXYMJCSA-N	433.249	1.815	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccn4nccc34)[C@H]2C1	1790400348	PRMTWMYBEYFGFZ-RMRKRWHISA-N	435.322	1.711	50	20	IDGD	
Cc1cc(C)n2ccc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)[C@@H](O)CCl)C[C@@H]43)c2n1	1790530325	SAVSUFHSKNMMFU-DKIMLUQUSA-N	434.924	1.144	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)COc3cccnc3)C[C@@H]21	1791057199	OXLMTVJRXUNALY-SDADXPQNSA-N	426.311	1.224	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CC[C@@H]4CCC(=O)N4C3)C[C@@H]21)C(Cl)Cl	1791296771	ZVEGVOLQDINUSE-SEBNEYGDSA-N	432.348	1.171	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCc1ccc(C#N)cc1	1792425769	AGMZDDGASMFCIO-KUZCPNRJSA-N	434.334	1.864	50	20	IDGD	
COC(=O)N(CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCl)Cc1ccccc1	1793116713	RLSGGBYSKLTWPZ-MHORFTMASA-N	437.924	1.493	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C[C@H](N)c1cccnc1	1795679828	RCHWUOGFHNSDJR-BSZJXLGXSA-N	429.348	1.297	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnn2ccccc12	1796842044	UGFSFZUBHVXZRW-UESRRSCYSA-N	425.316	1.774	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnn3ncccc13)C2	1796892232	QFTLRCCFOJKFOZ-LCFLCXBCSA-N	448.487	1.115	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CC[C@@H]1CCOC1)C2	1796892961	BTDLHTPQZFIKPD-UONOVLGTSA-N	429.521	1.575	50	20	IDGD	
COc1cc(C#N)cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)Br)C3)c1	1798579750	OHHPMEHLWNHKDC-RMIITELYSA-N	436.306	1.553	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H]1CCc3nc(O)nc(O)c3C1)C2	1798625401	DIYFYOUDDSHACE-XQLPTFJDSA-N	448.596	1.482	50	20	IDGD	
CCOc1cccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CO[Si](C)(C)C)C3)c1O	1799756233	MQQXXXPQGSIVNH-CCWDJLKJSA-N	436.581	1.846	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cn3cccnc3n1)C2	1800641126	ODPKHQDIMLJAOD-QVHKTLOISA-N	436.310	1.106	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c[nH]c3ncccc13)C2	1800641281	WOVPAYJDLOSRQU-VZAMPYOESA-N	435.322	1.940	50	20	IDGD	
CC[C@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccnn1CCOC)C2	1801802536	ZUWWPTTVLMKNGV-XGUBFFRZSA-N	427.343	1.955	50	20	IDGD	
COc1cncc(CCC(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)c1	1803141389	NLHDBLUOGOPXLL-SLYNCCJLSA-N	446.935	1.724	50	20	IDGD	
Cc1ccn2c(C(=O)N3CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]3c3cccnc3)cnc2c1	1803146565	BQCUSYHFKUUDPE-POAQFYNOSA-N	441.919	1.957	50	20	IDGD	
O=C(CN1CCOC1=O)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@@H]1c1cccnc1	1803337815	ROPVXWOUEBJSPO-CFVMTHIKSA-N	443.273	1.230	50	20	IDGD	
COc1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CCC(=O)NN(C)C)C3)cc1Cl	1803736170	PRCQNPLIQBDJTN-MUJYYYPQSA-N	436.940	1.973	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@@H](CNC(=O)c2ncnn2C)[C@@H]1c1cccnc1	1805273097	LKUXALNWXZGXOG-SNPRPXQTSA-N	435.326	1.561	50	20	IDGD	
Cc1nc(C(=O)N2CCCC3(CCN(C(=O)[C@@H](F)Br)CC3)C2)c(=O)[nH]c1C	1807464946	MOXXCEJCSUFGQQ-CQSZACIVSA-N	443.317	1.922	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1	1808427743	RWLBXHVHCIOIDV-SKDZVZGDSA-N	439.354	1.739	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2cn3ncccc3n2)[C@H]1c1cccnc1	1809358301	SSVSCZVVMKPMJN-JTDSTZFVSA-N	442.907	1.698	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)CCc2nc(N)n[nH]2)[C@H]1c1cccnc1	1810150705	YPWXWODNHATFKW-RVKKMQEKSA-N	433.944	1.828	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)[C@@H](O)N2CCOCC2)[C@@H]1c1cccnc1	1810349918	VJWJQVIAXGUXTB-OEMYIYORSA-N	438.956	1.146	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC2(CCCN(C(=O)c3cccc4nc[nH]c34)C2)CC1	1810558638	GNBQMNBMPCKBFX-UHFFFAOYSA-N	446.316	1.401	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H](CNC(=O)[C@H](C)n2ccnn2)[C@H]1c1cccnc1	1812394506	AXAGOMYOMPKIAH-YALNPMBYSA-N	449.353	1.971	50	20	IDGD	
CC(=O)N[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@@H]1c1cccnc1	1812657031	DKGJNAHSLFFGCN-KAOXEZKKSA-N	429.290	1.303	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)c2cccc(=O)n2O)[C@@H]1c1cccnc1)C(Cl)Cl	1813077320	JNSSGKYFZHDKMU-IUODEOHRSA-N	425.272	1.604	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)[C@@H](C)n2cnnn2)[C@@H]1c1cccnc1	1813473609	WVYRRIDPKZCLGO-MXYBEHONSA-N	436.314	1.119	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)CCN3CCN(C)CC3)sc2C1	1814583733	VTLJFUPPIHCWBO-KGLIPLIRSA-N	428.002	1.710	50	20	IDGD	
C[C@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)Cn3ccccc3=O)sc2C1	1815451782	PKQXNGZSEQOWCI-QWRGUYRKSA-N	439.335	1.700	50	20	IDGD	
O=C(Cc1ccsc1)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2	1815606087	MCPUAIWDAAYQQU-HNNXBMFYSA-N	441.343	1.353	50	20	IDGD	
O=C(CS(=O)(=O)N1CCCC1)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](F)Cl)CC2	1817271471	DEWKMHSXGFBSTA-TVQRCGJNSA-N	438.934	1.015	50	20	IDGD	
Cc1ccncc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1	1817471618	KEIXYZXOIZZSEK-IBGZPJMESA-N	433.277	1.413	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnco2)[nH]n1	1818111017	YFSAXTRFNYTHGM-ZWGXDWAISA-N	438.448	1.838	50	20	IDGD	
O=C(C#CC1(O)CCCCC1)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](O)CCl)CC2	1819841872	SOZZTWVHPYIKMF-TZMCWYRMSA-N	425.938	1.353	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@H](F)Br)[nH]n1)c1c[nH]c(=O)cn1	1820247458	FKYOCVNEZFPGLK-MFKMUULPSA-N	427.234	1.489	50	20	IDGD	
COc1ccc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@@H](C)Br)CC3)nn1	1821073131	NDKYXZXYWCRLBI-BDAKNGLRSA-N	440.323	1.951	50	20	IDGD	
O=C1CC[C@H](C(=O)N[C@@H]2CCc3nc(NC(=O)[C@H](F)Br)sc3C2)CN1	1822999382	PVWQIGFDHPHHFH-SXMVTHIZSA-N	433.303	1.272	50	20	IDGD	
Cc1onc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)c1C	1824753266	ZXDAPTNWHDYWHQ-SFHVURJKSA-N	433.553	1.898	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CN)CC1	1826809445	SYMDTHDTTKZRSJ-HOTGVXAUSA-N	430.977	1.697	50	20	IDGD	
Cc1nc(C)c(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)o1	1827051804	GLGGKJQLXZSUPO-FQEVSTJZSA-N	439.321	1.518	50	20	IDGD	
CCC1(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)CC2)COC1	1828924680	XPDKDPQZGZERSE-LJQANCHMSA-N	443.548	1.345	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2c[nH]c(=O)cn2)CC1	1829718732	ZUIMVSMRWSHYCP-WFASDCNBSA-N	425.327	1.787	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cn(C)nc3C(F)F)C2)C1	1831645833	DVDKKOPBIAZLLN-AUUYWEPGSA-N	448.898	1.835	50	20	IDGD	
CC(=O)C[C@@H](C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1	1831798431	BVNRTTBNYLTYJG-IERDGZPVSA-N	428.338	1.215	50	20	IDGD	
O=C([C@H]1CCCS1(=O)=O)N1CCC([C@H]2CCCCN2C(=O)C(Cl)Cl)CC1	1831881062	SGKXMAWVFQEQLP-ZIAGYGMSSA-N	425.378	1.987	50	20	IDGD	
Cc1cccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@](C)(Cl)CCl)C3)C2)n1	1834050525	DMWKJCIFJPWHMC-RTBURBONSA-N	430.332	1.696	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(N2CCC(NC(=O)C3(C)CC3)CC2)CC1	1834350833	MWRDRIFXNHMPET-WGOQTCKBSA-N	442.564	1.492	50	20	IDGD	
Cc1n[nH]cc1C(=O)N1CCC(N2CCC(NC(=O)CCBr)CC2)CC1	1834423132	GVYMLZAULTWBNT-UHFFFAOYSA-N	426.359	1.688	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)NCCC#N)CCO2	1835674700	FCRPIMXXLVIOJL-OXJNMPFZSA-N	428.961	1.132	50	20	IDGD	
C[C@H](Nc1nccs1)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836717851	LXAWOLZEAYEDNZ-BBRMVZONSA-N	444.985	1.542	50	20	IDGD	
CCOc1ccc(C(=O)N2CCC(OC3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)nn1	1836718569	SYURBBCLRMMCLT-KRWDZBQOSA-N	440.928	1.087	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)[C@H](C)CC(N)=O)CC2)CC1	1836911893	DGNPGIAQVOOUHD-OLZOCXBDSA-N	432.359	1.280	50	20	IDGD	
Cc1ncc(C(=O)N2CCOC[C@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)s1	1837713345	YALOYBAMMRPGGQ-SFHVURJKSA-N	427.599	1.373	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4ncsc4[nH]3)C2)C1	1839145632	NRRUFXGHWIYHRS-KZULUSFZSA-N	426.926	1.712	50	20	IDGD	
CCOc1cccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](Cl)CC)CCO3)c1O	1839146966	BYGRQKSLGVZUHW-IIBYNOLFSA-N	440.924	1.878	50	20	IDGD	
CCc1ccnc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)c1	1839152236	RNVMSVCKGIXTJG-PMACEKPBSA-N	444.359	1.950	50	20	IDGD	
Cc1ccc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)o1	1839203175	CFSHVDLHNINACJ-DOTOQJQBSA-N	433.274	1.277	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(O)ccc3O)CCO2)C1	1839446183	HGLSYTWKRSVKNG-OXQOHEQNSA-N	426.897	1.575	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc4nn(C)cc4c3)CCO2)C1	1839506083	ZKNAVXLZYBNMHB-UWJYYQICSA-N	434.924	1.661	50	20	IDGD	
O=C(c1n[nH]c2cccc(F)c12)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1839598366	FZELCICECXXUOK-QAPCUYQASA-N	428.823	1.306	50	20	IDGD	
CCN(CC)C[C@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1839674863	LEWCFMVFQHPPFF-LAUBAEHRSA-N	432.005	1.686	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(O)n3)C2)C1	1839963711	SZLPAUAAKNUDDC-ACJLOTCBSA-N	442.310	1.031	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cccs3)C2)C1	1839963964	BFMZVLCDTRMWCY-YJBOKZPZSA-N	445.379	1.921	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)nc1C	1840031326	MKUDULJMCUANJQ-IFXJQAMLSA-N	440.338	1.552	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccc(F)cc3)C2)C1	1840032110	NZSFNGNJLTXAGQ-IFXJQAMLSA-N	443.313	1.608	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(C(C)(C)C)n[nH]3)C2)C1	1840153397	NEPBWZMWRHCJKV-JLTOFOAXSA-N	442.944	1.031	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)Oc1ccccn1)CCO2	1840426993	RBGCGHUWRCYDSN-TWOQFEAHSA-N	425.913	1.323	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)CCN2CCCCC2)C1	1842739064	UKFLAKBNUARMDB-JJIBRWJFSA-N	428.537	1.200	50	20	IDGD	
O=C([C@@H](O)CCl)N1CC2(CCCN2C(=O)c2cn3c(C(F)(F)F)cccc3n2)C1	1845589018	YBVYBUNHUJDJEM-LBPRGKRZSA-N	430.814	1.770	50	20	IDGD	
CC(=O)N[C@H](C)C(=O)N1CC2(CCCN2C(=O)[C@H](Br)Cc2ccccc2)C1	1845942421	FKKCMAIYSRMUTM-RHSMWYFYSA-N	436.350	1.721	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCCC12CN(C(=O)CNC(=O)c1cccs1)C2	1846069238	PYWOJYMYXDOAIV-GFCCVEGCSA-N	428.352	1.855	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@H]2CC23CN(C(=O)OC(C)(C)C)C3)C1	1846118497	MXWZMZSPFDWGNT-GJZGRUSLSA-N	441.956	1.701	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)CCc1c[nH]c3ccc(F)cc13)C2	1846385819	AEVICDFUWSTJSV-UHFFFAOYSA-N	443.523	1.816	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC2(CCCN2C(=O)CN2C(=O)CSC2=S)C1	1847050560	CTUJZNFNAQJBSL-SNVBAGLBSA-N	434.381	1.081	50	20	IDGD	
O=C(c1cc(-c2cc[nH]n2)n2ccccc12)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl	1847564065	SOGDTMKAIOPDTB-JENIJYKNSA-N	427.892	1.745	50	20	IDGD	
COC(=O)c1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1	15526058	WOPPFMGAVXNKHC-UHFFFAOYSA-N	431.470	1.333	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)COc2ccccc2OC)c1	15884522	AMYJKTUTQXALSW-UHFFFAOYSA-N	435.502	1.566	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1cc(Br)cn1C	16203022	QOORYSLADKUJRG-UHFFFAOYSA-N	428.312	1.464	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(Br)cc2)c1	17330702	VBNBBHYODOWUAS-UHFFFAOYSA-N	426.292	1.774	50	20	IDGD	
O=C(CCn1nnc2ccccc2c1=O)NNC(=S)Nc1cccc(Br)c1	27011941	XBYHFUPFMLPDCJ-UHFFFAOYSA-N	447.318	1.962	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)CCCc2nc3ccccc3[nH]2)cc1	29260115	WUCMATWANWEPFP-UHFFFAOYSA-N	443.529	1.662	50	20	IDGD	
COC[C@@H](C)n1c(C)cc(/C=C(\C#N)C(=O)N2CCN(CC(=O)NC3CC3)CC2)c1C	214456188	AMHUTLUZBJKTHO-XNHPLOEXSA-N	427.549	1.642	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCC(=O)N2CCc3ccccc3C2)cc(OC)c1OC	726620368	ZFDRHTOCCYBISS-UHFFFAOYSA-N	442.472	1.241	50	20	IDGD	
COc1ccc(CN2C[C@@H](C(=O)OCC(=O)NNC(=O)c3cccs3)CC2=O)cc1	726683486	UBHHNVWXXPOBMX-AWEZNQCLSA-N	431.470	1.110	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NCCCc2cnn(C)c2)c2ccccc2c1=O	726851191	JGPDBVZNAJGWNQ-UHFFFAOYSA-N	425.493	1.507	50	20	IDGD	
O=C(CCCc1ccccc1)NNC(=O)C1CCN(S(=O)(=O)c2cccnc2)CC1	727716125	APUUTMGEAUTBMY-UHFFFAOYSA-N	430.530	1.653	50	20	IDGD	
CCc1noc(-c2ccc(CCNC(=O)NNC(=O)CNC(=O)c3cccs3)cc2)n1	727844048	BSBYWXXPVICAAJ-UHFFFAOYSA-N	442.501	1.663	50	20	IDGD	
COc1ccccc1/C(C)=C\C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	728344606	XLQOAMZAHMIIFW-RNUYOQPASA-N	426.425	1.629	50	20	IDGD	
CS(=O)(=O)Nc1ccc(CNC(=O)NNC(=O)c2cccc(OC(F)F)c2)cc1	728595571	MHWDEBSBPUBBJT-UHFFFAOYSA-N	428.417	1.804	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CNS(=O)(=O)c2ccc(Br)s2)c1	728870961	LLEGCFXMFWNOJR-UHFFFAOYSA-N	443.304	1.122	50	20	IDGD	
CCCN(CCC)S(=O)(=O)c1ccc(C(=O)N([C@H]2CCS(=O)(=O)C2)N(C)C)cc1	729172222	UDQAXWBRRQSEKM-KRWDZBQOSA-N	445.607	1.603	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)Cn1ccc2ccccc21)c1ccc(S(=O)(=O)N(C)C)cc1	729597106	SBIQUUUEEYCMIR-OAHLLOKOSA-N	443.529	1.983	50	20	IDGD	
CCN1CCC[C@H]1CN1C[C@@H](C(=O)NNC(=O)COc2cc(C)ccc2C(C)C)CC1=O	729627432	LFDJWRWBUBOUQT-OALUTQOASA-N	444.576	1.977	50	20	IDGD	
O=C(NCCc1cccs1)NNC(=O)[C@H]1CCN(c2ccc3c(c2)OCCO3)C1=O	730533288	XFFDCUMKQGNPHI-OAHLLOKOSA-N	430.486	1.445	50	20	IDGD	
O=C(CNC(=O)c1c(F)cccc1Cl)NNc1ccc(S(=O)(=O)NC2CC2)cc1	730589676	OGKNVMZLYIJIRL-UHFFFAOYSA-N	440.884	1.793	50	20	IDGD	
CSCC[C@@H](NC(=O)c1cccc(C)c1)C(=O)NNC(=O)COc1ccccc1O	730781217	HWRPWMYQWNUJGE-MRXNPFEDSA-N	431.514	1.779	50	20	IDGD	
CC(C)(C)C(=O)NNC(=O)N1CCN(CC(=O)Nc2ccc(OC(F)(F)F)cc2)CC1	731499043	IDGCTMJGCKYPMN-UHFFFAOYSA-N	445.442	1.928	50	20	IDGD	
O=C(NN=Cc1cccc(OCc2ccccc2C(=O)O)c1)N[C@@H]1CCS(=O)(=O)C1	731557944	DTNANOAFZDWUKJ-MRXNPFEDSA-N	431.470	1.784	50	20	IDGD	
Cn1nc(C(=O)NN=C2CCS(=O)(=O)c3cc(F)c(F)cc32)c2ccccc2c1=O	731923938	KWCWVXXHQCTSTF-UHFFFAOYSA-N	432.408	1.523	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)cc1OC	731957662	VONFPIULFIXMEU-GFCCVEGCSA-N	448.457	1.739	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)COc2ccc(Oc3ccccn3)cc2)C[C@@H](C)O1	732259868	KSAUNHMIGIBVNR-IAGOWNOFSA-N	428.489	1.899	50	20	IDGD	
C[C@H](C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)N1CCc2ccccc2C1	732265224	PXFRIKCIEPIWQO-HXUWFJFHSA-N	435.572	1.793	50	20	IDGD	
Cc1ccc(S(=O)(=O)NC2CC2)cc1C(=O)NNC(=O)c1cnn(-c2ccccc2)c1	733171306	MVVOAZHCGHXXLZ-UHFFFAOYSA-N	439.497	1.696	50	20	IDGD	
Cc1cccc(-c2nnc(S)n2CC(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)c1	734240592	UOLACRAFQOIBDU-UHFFFAOYSA-N	449.537	1.397	50	20	IDGD	
Cc1nc2ncnn2c(C)c1CCC(=O)NNc1ccccc1S(=O)(=O)NC(C)(C)C	734252351	PHPNIWIFQSGRIG-UHFFFAOYSA-N	445.549	1.894	50	20	IDGD	
COC(=O)c1ccccc1S(=O)(=O)N1CCC(C(=O)NNc2cc(C)ncn2)CC1	734255332	VVIKIMWHTILMFD-UHFFFAOYSA-N	433.490	1.116	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)CCc2nc3ccccc3o2)CC1	735118476	WADYGCJWIWRMBU-UHFFFAOYSA-N	444.517	1.235	50	20	IDGD	
C[C@H]1[C@@H](C)N(C(=O)NNC(=O)c2ccc(Br)cc2Cl)CCS1(=O)=O	736386380	DWMJEICEEWYMMI-BDAKNGLRSA-N	438.731	1.964	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)N[C@H]2CCC[C@H](S(C)(=O)=O)C2)cc1	741094009	VPSPGYNVGWTNPD-KEYYUXOJSA-N	427.523	1.539	50	20	IDGD	
CCNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cccc(Br)c2)cc1	742771150	DTCHJOQRFOGSIU-UHFFFAOYSA-N	426.292	1.822	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)[C@H](C)NC(=O)c2cc3c(C)nn(C)c3s2)c1O	743316696	GUMYHVKXIPBIRK-JTQLQIEISA-N	431.474	1.237	50	20	IDGD	
Cn1nc(SCC(=O)NN=Cc2ccc(Br)cc2Cl)c(=O)n(C)c1=O	743433299	BMZCZWIKLZTIPP-UHFFFAOYSA-N	446.714	1.137	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@@H]2CC(=O)N(c3ccccc3F)C2)cc1	743829752	CXGXQAJNVNYJAO-GFCCVEGCSA-N	434.449	1.435	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)c2csc(S(N)(=O)=O)c2)cc1Cl	743836266	ORYBBKOYZUFTJV-UHFFFAOYSA-N	434.883	1.533	50	20	IDGD	
CC(C)CC(=O)N[C@@H](C(=O)OCC(=O)NNC(=O)c1cccc(C#N)c1)c1ccccc1	744935554	LDVPZBNNABDIHB-OAQYLSRUSA-N	436.468	1.766	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)C[C@H]2CN(Cc3ccccc3)CCO2)c1	745101162	HFCHYNANYDINNU-FQEVSTJZSA-N	425.485	1.590	50	20	IDGD	
NC(=O)[C@@H]1CCCN(CCCNC(=O)NNC(=O)CCSc2ccc(F)cc2)C1	745830247	MYCKPFHBKDBQDS-CQSZACIVSA-N	425.530	1.226	50	20	IDGD	
CCN1CCN(C[C@@H](C)CNC(=O)NNC(=O)c2ccc(Br)s2)CC1	745863233	UEQVDBUOJOAMGX-LBPRGKRZSA-N	432.388	1.728	50	20	IDGD	
Cc1c(C)c(C)c(S(=O)(=O)NCCC(=O)NNC(=O)Cc2ccncc2)c(C)c1C	747428795	WYUXZCUTEJRLFF-UHFFFAOYSA-N	432.546	1.682	50	20	IDGD	
CCOc1ccc(NS(=O)(=O)c2cccc(C(=O)NNc3nccn(C)c3=O)c2)cc1	747946181	WMZSTPPNOXEFDJ-UHFFFAOYSA-N	443.485	1.737	50	20	IDGD	
O=C(NNC(=O)c1ccc(NS(=O)(=O)/C=C\c2ccccc2)cc1)C(=O)N1CCCC1	748245997	CANJANQAQHUTQD-QINSGFPZSA-N	442.497	1.483	50	20	IDGD	
NC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)NNc1ccc([N+](=O)[O-])cc1Cl	748716608	MLNXFXNSHVXYMM-HNNXBMFYSA-N	435.824	1.862	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)[C@H]2CCCN2S(=O)(=O)c2cccs2)c1	749161376	XUBFVQWKLQANJW-OAHLLOKOSA-N	437.543	1.744	50	20	IDGD	
CC[C@H](C(=O)N1CCC(NC(=O)NNC(=O)C(=O)N2CCCC2)CC1)c1ccccc1	749191995	VNSXFLXCAWEGRK-SFHVURJKSA-N	429.521	1.124	50	20	IDGD	
Cc1nc(CCCC(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)cs1	750242572	SKZKMDKKSSLWPE-UHFFFAOYSA-N	438.579	1.249	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)N[C@@H]2CC(=O)N(C(C)(C)C)C2)c1	750659198	BRLJNOICWSTPAP-SNVBAGLBSA-N	427.299	1.801	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNS(=O)(=O)c1cnn([C@@H]2CCOC2)c1	751537920	DVMPTNOZGGQHQH-WMLDXEAASA-N	430.486	1.775	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1	755339541	VYJBSWRSQYPUQM-UHFFFAOYSA-N	435.462	1.685	50	20	IDGD	
Cc1cc(C)nc(-n2nc(C)cc2NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)n1	755514240	FJCGSUZQVMLKPJ-UHFFFAOYSA-N	447.459	1.301	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccc(Cn3cccn3)cc2)c1	756237811	MAGRQKJCUJUSTQ-UHFFFAOYSA-N	442.501	1.648	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1ccc2nc(-c3ccc(F)cc3)oc2c1	756539181	JPZBMLCTNNDSOB-SNVBAGLBSA-N	435.437	1.724	50	20	IDGD	
CS(=O)(=O)Cc1ccc(NC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc1F	757675552	LIPNIYUJKXSYCA-UHFFFAOYSA-N	447.448	1.728	50	20	IDGD	
COc1ccc(C(F)(F)C(=O)N2CCN(S(=O)(=O)CBr)CC2)cc1	758514096	ZGHNWUXXAWTPRH-UHFFFAOYSA-N	427.267	1.613	50	20	IDGD	
CCO[C@@H](C)c1ncc(C(=O)N2CCN(S(=O)(=O)CBr)CC2)s1	758528874	YSAUVDRDUBHOAU-JTQLQIEISA-N	426.358	1.681	50	20	IDGD	
CN(NC(=O)CCOc1cccc(C(N)=O)c1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758788732	ZVVQUTHTJWPEIS-UHFFFAOYSA-N	449.508	1.190	50	20	IDGD	
N#C/C(=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)N1CC[C@@H](CO)C1	759703574	OMQIJXBKFFXZGF-SLVCOGOPSA-N	427.892	1.827	50	20	IDGD	
O=C(NCCOc1ncc(Cl)cc1Cl)NNC(=O)[C@H]1COc2ccccc2O1	762055247	CADBDWCBZWFRED-CQSZACIVSA-N	427.244	1.938	50	20	IDGD	
Cc1ccc(C(=O)N2C[C@@H](C)C[C@H](C)C2)cc1NC(=O)C(=O)NNC(=O)c1ccccn1	763464009	PVGPMJZJMGVJTR-GJZGRUSLSA-N	437.500	1.908	50	20	IDGD	
C[C@@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)cc2)CCO1	763467355	CPXKBMPSKGHNQL-CYBMUJFWSA-N	427.417	1.220	50	20	IDGD	
O=C(NNC(=O)c1ccccc1Br)C(=O)Nc1ccc(-n2cccn2)nc1	763483175	OHALNHDXEFWYDV-UHFFFAOYSA-N	429.234	1.430	50	20	IDGD	
O=C(NNC(=O)c1cccnc1)C(=O)Nc1ccc(-c2n[nH]c(-c3ccccc3)n2)cc1	763489189	VZNZYYSVBWGTHS-UHFFFAOYSA-N	427.424	1.933	50	20	IDGD	
O=C(NNC(=O)c1ccccc1F)C(=O)Nc1ccc(CCC(=O)N2CCCC2)cc1	763575148	QQHLGEAIIBTVOF-UHFFFAOYSA-N	426.448	1.780	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccn(-c3ncccc3C(F)(F)F)n2)c(C)o1	763575966	BTMPQGKGDKOFQA-UHFFFAOYSA-N	436.350	1.896	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cccc(S(=O)(=O)NC3CC3)c2C)c(C)o1	763587470	XASGFBLYPMURSP-UHFFFAOYSA-N	434.474	1.045	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccccc2S(=O)(=O)C(C)C)cc1	763660085	WPRSXOZUWPAXQB-UHFFFAOYSA-N	449.485	1.042	50	20	IDGD	
CCn1cnnc1-c1ccccc1NC(=O)C(=O)NNC(=O)COc1ccc(C#N)cc1	763681061	IPFIDQLEQZZXPP-UHFFFAOYSA-N	433.428	1.002	50	20	IDGD	
O=C(COc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1cccc(CN2CCCC2=O)c1	763687104	ZHZVQMQIZPSGAF-UHFFFAOYSA-N	444.875	1.627	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccnc1N1CCCCC1	763710625	BGHUZOSHAYEGRV-UHFFFAOYSA-N	425.489	1.799	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccccc2N2CCOC2=O)c1C	763841148	NXBNWRFVNGBMJD-OAHLLOKOSA-N	440.456	1.813	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)C(=O)Nc1cnn(-c2ccccc2Cl)c1	763841892	UXTPLZGAVHYRGZ-UHFFFAOYSA-N	431.811	1.830	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)cc1C(=O)N(C)C	763851000	SEOBHTHPVLBLSO-CYBMUJFWSA-N	430.436	1.389	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccccc1O[C@H]1CCOC1	763866622	XBJRFUFOKRHXPR-KBPBESRZSA-N	431.420	1.547	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccc(Oc3ccc(C#N)cc3)nc2)n1	763885774	NTQLCOCBAAZFGS-UHFFFAOYSA-N	433.428	1.345	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)C[C@H](OC)C3)cc1OC	763911900	QMFJCOHCNCQOKW-GOSISDBHSA-N	441.484	1.997	50	20	IDGD	
CC(C)(C)OC(=O)NCCOc1cccc(NC(=O)C(=O)NNC(=O)c2ccc[nH]2)c1	763980424	WFWZAOYYQJLPTA-UHFFFAOYSA-N	431.449	1.318	50	20	IDGD	
Cc1ccccc1-c1cc(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)n(C)n1	763998861	UGOQDHLTBSDRNV-UHFFFAOYSA-N	445.277	1.886	50	20	IDGD	
Cc1nnc(-c2cccc(NC(=O)C(=O)NNC(=O)c3cc(Br)cn3C)c2)o1	764004233	AFVACPSAGNQHLL-UHFFFAOYSA-N	447.249	1.546	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Br)cc2Cl)c(O)n1	764058945	WJGICOZLGAGIOC-UHFFFAOYSA-N	427.642	1.911	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(-c3nnc4n3CCCC4)cc2)cc1	764183513	ZJWFNHXYKLEEOT-UHFFFAOYSA-N	429.440	1.553	50	20	IDGD	
CS(=O)(=O)c1c(Cl)cccc1NC(=O)C(=O)NNC(=O)CCCc1ccccc1	764225661	BVFRNTLGJINDKO-UHFFFAOYSA-N	437.905	1.852	50	20	IDGD	
CN(C)C(=O)C[C@H]1CN(C(=O)C(=O)NNC(=O)Cc2ccccn2)c2ccc(Cl)cc21	764264589	QANANMSMWSRKDJ-ZDUSSCGKSA-N	443.891	1.034	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)C(=O)Nc1ccn(-c2cccc(C(F)(F)F)c2)n1	764268314	HABVYYCJLUNMOM-UHFFFAOYSA-N	432.362	1.615	50	20	IDGD	
COc1ccc(COCc2cccc(NC(=O)C(=O)NNC(=O)Cc3cc[nH]n3)c2)cc1	764294078	UKBHHASDHMSWTO-UHFFFAOYSA-N	437.456	1.464	50	20	IDGD	
O=C(Cc1cc[nH]n1)NNC(=O)C(=O)Nc1cc(Cl)ccc1C(=O)N1CCCCC1	764294417	YRATXZDFDJIGDO-UHFFFAOYSA-N	432.868	1.018	50	20	IDGD	
COCC(=O)NNC(=O)C(=O)Nc1cccc(C(=O)Nc2cccc(C(F)(F)F)c2)c1	764296155	VQRSOUPWQDJVID-UHFFFAOYSA-N	438.362	1.690	50	20	IDGD	
CN(C)CCC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)C(C)(C)c2ccccc2)cc1	764302594	OBLKOINFPNTXGC-UHFFFAOYSA-N	439.516	1.641	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(CN(C)C)c2)cc1Br	764326503	KVHXEJBEIUKIAX-UHFFFAOYSA-N	449.305	1.919	50	20	IDGD	
CCN1CCC(n2nccc2NC(=O)C(=O)NNC(=O)CCCc2cccs2)CC1	764343643	UMZIGSVPPPQRDP-UHFFFAOYSA-N	432.550	1.710	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)c(Cl)c1)C(=O)Nc1ccc(NC(=O)[C@H]2CCCO2)cc1	764346028	RMKPCRQULKQXLT-MRXNPFEDSA-N	446.847	1.563	50	20	IDGD	
CCOC(=O)c1cc(C(C)(C)C)sc1NC(=O)C(=O)NNC(=O)Cc1ccncc1	764355098	ZJFXQLQQDHIVQQ-UHFFFAOYSA-N	432.502	1.946	50	20	IDGD	
C[C@H]1C[C@H](C)CN(C(=O)c2ccccc2NC(=O)C(=O)NNC(=O)Cc2ccncc2)C1	764356322	UUAKKQYQTAZURZ-HOTGVXAUSA-N	437.500	1.528	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)cn1	764387256	HITKHVMVMPWRQH-UHFFFAOYSA-N	442.407	1.036	50	20	IDGD	
Cc1cc(Cl)ccc1OCCCC(=O)NNC(=O)Nc1nc(CS(C)(=O)=O)no1	765247655	UXVKTYOFMZXIKI-UHFFFAOYSA-N	445.885	1.588	50	20	IDGD	
COc1ccc(C)nc1NC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	765305455	MONGQJNJRMQPFN-UHFFFAOYSA-N	433.490	1.650	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)C(C)C)cc1NC(=O)C(=O)NNC(=O)OC(C)(C)C	765399433	XHJAWKHCDJNHIT-UHFFFAOYSA-N	428.511	1.518	50	20	IDGD	
CCNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cc(-c3ccccc3OC)[nH]n2)cc1	765602774	WTGURMXOAZGDPH-UHFFFAOYSA-N	443.485	1.458	50	20	IDGD	
CON(C)C(=O)[C@H](CCSC)NC(=O)NNC(=O)c1cc2c(s1)CC[C@H](C)C2	765632369	CYSJRMZHHYLONQ-AAEUAGOBSA-N	428.580	1.958	50	20	IDGD	
O=C(/C=C/c1ccc2c(c1)OCO2)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765739542	XSERHSXTSHKYFK-VQHVLOKHSA-N	436.468	1.034	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cc4ccccc4nc3O)CC2)cc1	765750057	XHSIZXKRKOPREZ-UHFFFAOYSA-N	433.512	1.828	50	20	IDGD	
CCc1ccc(C(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)cc1S(C)(=O)=O	766157850	MCLVQPGELLUTAE-UHFFFAOYSA-N	438.889	1.924	50	20	IDGD	
COc1cc(C#N)ccc1NC(=O)C(=O)NNc1ccccc1S(=O)(=O)NC(C)(C)C	766259211	UPGLGWPKMRAPFJ-UHFFFAOYSA-N	445.501	1.725	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)CCCn1c(=O)oc2ccccc21	767276006	HZYXELNTZYUQLJ-UHFFFAOYSA-N	425.441	1.616	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)CNC(=O)c3ccc(F)cc3)n[nH]2)cc1OC	768277803	SGLFUJBNFSURLD-UHFFFAOYSA-N	441.419	1.424	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)c1ccc(N2CCCS2(=O)=O)cc1	768638031	FDHDEPMVZMQZHD-UHFFFAOYSA-N	439.515	1.396	50	20	IDGD	
O=C(NNC(=O)N1CCC(OCc2ccccc2F)CC1)c1ccc(-n2cnnn2)cc1	768678624	STAKGOWTZMKMPZ-UHFFFAOYSA-N	439.451	1.837	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)Cc2ccc(C(=O)NNC(=O)[C@](C)(O)C(C)C)cc2)cc1	770209653	QIFANVULKFCXAB-JOCHJYFZSA-N	447.557	1.984	50	20	IDGD	
Cc1cc(C)c(C)c(S(=O)(=O)NCC(=O)NNC(=O)c2ccc3c(c2)OCCO3)c1C	770393886	UXYVOTWEPKDZKU-UHFFFAOYSA-N	447.513	1.431	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)c1cccc(S(=O)(=O)C(C)C)c1	770434535	XKQMNBFWCZCYOR-UHFFFAOYSA-N	432.498	1.724	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cncc(NC(C)=O)c2)c([N+](=O)[O-])cc1OC(F)F	773087697	KSKFNSYOPQCTOK-UHFFFAOYSA-N	439.331	1.633	50	20	IDGD	
Cc1oc2ccc(NC(=O)C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)cc2c1C	773496925	ROCOITTUVQOXIW-UHFFFAOYSA-N	436.472	1.842	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cc(C)c(Br)cn2)cc1C	773525178	LLQJMYTXKRUCOK-UHFFFAOYSA-N	435.278	1.934	50	20	IDGD	
O=C(Nc1ccc(S(F)(F)(F)(F)F)cc1)C(=O)N1CCN2C(=O)C(=O)NC[C@H]2C1	773707501	ASOYQPNRVWACSB-JTQLQIEISA-N	442.366	1.452	50	20	IDGD	
O=C(NNC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1)c1ccc2nc(O)[nH]c2n1	773714004	SHNOVFJTVMALKE-UHFFFAOYSA-N	440.423	1.986	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2cccc(Cl)c2)cc1S(=O)(=O)NC1CC1	773736697	SZCRCXPTJBMKCH-UHFFFAOYSA-N	438.893	1.871	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)c2cccc(Br)c2)cc1CC(=O)O	774620143	JJJZABRGOGGZKL-UHFFFAOYSA-N	443.275	1.708	50	20	IDGD	
CC[C@H](NCC(=O)NNC(=O)c1cccc(C#N)c1)c1ccccc1OCC(=O)N(C)C	775053196	INXJWDQKXGXHNR-IBGZPJMESA-N	437.500	1.527	50	20	IDGD	
CN(C(=O)OC(C)(C)C)[C@H](C(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)c1cnn(C)c1	776312991	VGYJADIZKGRIGI-HNNXBMFYSA-N	432.437	1.698	50	20	IDGD	
C[C@@H](O)[C@@H](NC(=O)C1CC1)C(=O)NNC(=O)c1ccc(COc2ccc(Cl)cc2)cc1	779490591	CBZPTPPJJXEBDF-BFUOFWGJSA-N	445.903	1.956	50	20	IDGD	
Cn1ncc(NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)c1C(F)(F)F	782124779	UMYGCRYHIXXFEA-UHFFFAOYSA-N	427.368	1.290	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)cc1-c1ncco1	782893877	NXZRMYJMMTZEHJ-UHFFFAOYSA-N	432.440	1.865	50	20	IDGD	
CS(=O)(=O)c1ccc(F)c(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2Cl)c1	782926046	PXWYMNLZKYZWMK-UHFFFAOYSA-N	448.259	1.936	50	20	IDGD	
O=C(NNc1ncnc2ccsc12)C(=O)Nc1ccc(NC(=O)[C@H]2CCCO2)cc1	783262812	QICXSDVKTSEWBZ-CQSZACIVSA-N	426.458	1.891	50	20	IDGD	
COC(=O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)NNC(=O)c1ccc(OC)cc1OC	783825270	BIZDPUFXTRYRFG-UHFFFAOYSA-N	439.402	1.022	50	20	IDGD	
CC(C)[C@H](C)N1Cc2cccc(NC(=O)C(=O)NNC(=O)CNC(=O)c3ccco3)c2C1	784004440	NDPTUCJGJISPPI-AWEZNQCLSA-N	441.488	1.156	50	20	IDGD	
O=C1C[C@@H](Cc2ccc(NC(=O)C(=O)NNc3ccc(OC(F)F)cc3)cc2)C(=O)N1	784318378	OJSVAQUAJQYJEA-GFCCVEGCSA-N	432.383	1.575	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNc2ccccc2)cc1S(=O)(=O)N1CCCC1	784769527	CLTRVBLVBXEJSJ-UHFFFAOYSA-N	432.502	1.952	50	20	IDGD	
O=C(NNc1ncccc1Cl)C(=O)Nc1ccc(N2CCN(C(=O)C3CC3)CC2)nc1	784821259	OUDBFFGSAPXRKO-UHFFFAOYSA-N	443.895	1.270	50	20	IDGD	
COC(=O)CCOc1ccc(NC(=O)C(=O)NNc2cccc(S(C)(=O)=O)c2)cc1	784839159	FTQWHBMSCQCTPJ-UHFFFAOYSA-N	435.458	1.114	50	20	IDGD	
NC(=O)C1CCN(c2ccc(NC(=O)C(=O)NNc3cc(F)c(F)c(F)c3)cc2)CC1	785088356	JKPXLJVFSXFIPI-UHFFFAOYSA-N	435.406	1.887	50	20	IDGD	
COc1cc(F)cc(NNC(=O)C(=O)Nc2cccc(OCC(=O)N3CCCC3)c2)c1	785236230	BEDKNDCNPGHLPU-UHFFFAOYSA-N	430.436	1.917	50	20	IDGD	
Cn1nccc1COCC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	785723121	NPZIRVGZKCRGLJ-UHFFFAOYSA-N	449.514	1.260	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2O1)C(=O)Nc1cc(F)cc(F)c1Br	785990928	METRDSLQMSUGDG-CYBMUJFWSA-N	440.200	1.817	50	20	IDGD	
Cc1ccc(-n2cc(NC(=O)C(=O)NNC(=O)c3c(C)nc4ccccn34)cn2)c(C)c1	786415031	UWGGZPHBORTMAI-UHFFFAOYSA-N	431.456	1.845	50	20	IDGD	
O=C(CCCOc1ccc2c(c1)NC(=O)CC2)NNC(=O)c1ccc(-n2cnnn2)cc1	786680860	OPZLQCQYRXIUQV-UHFFFAOYSA-N	435.444	1.167	50	20	IDGD	
O=C(NCc1ccccc1)NNS(=O)(=O)c1ccc(N2CCOC2=O)c([N+](=O)[O-])c1	786728460	XDUPKOLPKNXPHC-UHFFFAOYSA-N	435.418	1.244	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)[C@@H]2CCCN(C(=O)NC3CCCC3)C2)cc1	786821158	PVUSGWIOUMYYHO-QGZVFWFLSA-N	441.488	1.227	50	20	IDGD	
O=C(NNC(=O)C(=O)Nc1ccccn1)N[C@H]1CSc2ccc(Br)cc21	787397589	WAYPEDQHEGOFFV-NSHDSACASA-N	436.291	1.960	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(\C#N)C(=O)N2CCN([C@H]3CCS(=O)(=O)C3)CC2)c1C	790252237	LOXGHRHEZUNUNY-XXTOWBJJSA-N	448.589	1.551	50	20	IDGD	
O=C(NCc1cccc(S(=O)(=O)N2CCCCC2)c1)NNc1nc2ccccn2n1	790280313	BYRNFPMURYVJHI-UHFFFAOYSA-N	429.506	1.730	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1cccc(N2CCC2=O)c1	790965221	JNDWEQPIOKBKRB-GFCCVEGCSA-N	430.848	1.630	50	20	IDGD	
COc1c(NC(=O)C(=O)NNC(=O)Cc2ccsc2)cc(Cl)cc1C(=O)N(C)C	793025882	OFVPKOHADRLANL-UHFFFAOYSA-N	438.893	1.441	50	20	IDGD	
O=C(NNc1ccc2c(=O)[nH]ccc2c1)C(=O)Nc1ccc(=O)n(Cc2ccccc2)c1	793071063	XDRUPMZBRSOICH-UHFFFAOYSA-N	429.436	1.820	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c(C)cc1C	797009591	VJRSXHNMPTUCOI-UHFFFAOYSA-N	426.477	1.105	50	20	IDGD	
CSCc1cccc(NC(=O)C(=O)NNC(=O)CNC(=O)OCc2ccccc2)c1	797369135	OREVATYDCWEFBP-UHFFFAOYSA-N	430.486	1.562	50	20	IDGD	
CNC(=O)[C@@]1(C)CCN(C(=O)NNC(=O)[C@@H]2Cc3ccccc3CN2Cc2ccccc2)C1	797607088	AJFQECUVHJKFSR-OFVILXPXSA-N	449.555	1.812	50	20	IDGD	
O=C(Cn1nc2ccccn2c1=O)NNC(=O)Nc1ccc(Br)cc1Cl	802040527	NTMOUEQGDDYPBP-UHFFFAOYSA-N	439.657	1.765	50	20	IDGD	
Cc1nnnn1/C(=C\c1ccccc1)C(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	802063701	AUOGQXJCCINYRJ-ATVHPVEESA-N	441.473	1.236	50	20	IDGD	
C[C@@](O)(CSc1cccc(F)c1)C(=O)OCC(=O)NNC(=O)c1cccc(C#N)c1	803803853	ZGOVFCTZZUINMR-HXUWFJFHSA-N	431.445	1.545	50	20	IDGD	
O=C(CCCCCNS(=O)(=O)c1ccc2c(c1)OCCO2)NNc1cccc(F)n1	804770483	DEHPWXJYZIDDEP-UHFFFAOYSA-N	438.481	1.974	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)Nc2cc(F)c(N3CCOCC3)cc2F)cc1	806742475	KYMMDDBCBBZYAB-UHFFFAOYSA-N	431.399	1.905	50	20	IDGD	
O=C(CCOc1ccccc1)NNC(=O)C(=O)Nc1cc(Cl)cc2c1OCC(=O)N2	806977375	GNXFJIKROBSGAC-UHFFFAOYSA-N	432.820	1.226	50	20	IDGD	
O=C(CCOc1ccccc1)NNC(=O)C(=O)Nc1ccc(F)c(N2CCCNC2=O)c1	806977535	NSCAYHQNOHWOAX-UHFFFAOYSA-N	443.435	1.300	50	20	IDGD	
COc1cc(C)c(NC(=O)C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c(C)c1C	806978782	KIZOHMYWBZMMQY-UHFFFAOYSA-N	440.504	1.413	50	20	IDGD	
O=C(NNc1nccnc1C1CCC1)C(=O)Nc1ccc(S(=O)(=O)NC2CC2)cc1	807462010	GGUFDMHTMMDVCE-UHFFFAOYSA-N	430.490	1.267	50	20	IDGD	
Cc1nc(S(=O)(=O)NNC(=O)c2cn(C)c3ccccc23)c(Br)n1C	808070927	FYXDRHAWNIXVTH-UHFFFAOYSA-N	426.296	1.606	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)[C@@H]1C[C@@H](c2ccccc2)OC1=O	809539108	YRIRUDLNWBGNPR-SFTDATJTSA-N	436.512	1.651	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)Cn2c(S)nc3ccccc3c2=O)cc1	812728941	FUULPFWWDXGWPC-UHFFFAOYSA-N	433.515	1.079	50	20	IDGD	
O=C(NN=C1CCO[C@H](C(F)(F)F)C1)c1cccc(S(=O)(=O)N2CCOCC2)c1	814689064	TURYZDOFYHYZAD-HNNXBMFYSA-N	435.424	1.535	50	20	IDGD	
N#Cc1cc(NC(=O)C(=O)NNC(=O)[C@@H]2CCc3nncn3C2)ccc1Oc1ccccc1	815693370	VDCOIIJLZACQJR-CQSZACIVSA-N	445.439	1.291	50	20	IDGD	
COc1ccc(NNC(=O)C2CCN(c3ccc4nnnn4n3)CC2)c(C(F)(F)F)c1	816701644	FBOMMKBTXXRCTF-UHFFFAOYSA-N	436.398	1.906	50	20	IDGD	
Cc1cnc(S(C)(=O)=O)nc1C(=O)NNC(=O)c1ccc(COc2ccccc2)o1	816829196	FGGDIWCUPORGSL-UHFFFAOYSA-N	430.442	1.435	50	20	IDGD	
CCOc1ccc(N2C[C@H](C(=O)NNC(=O)CCN3C[C@@H](C)O[C@H](C)C3)CC2=O)cc1	912924612	BTNCGCORRSEEOB-BRWVUGGUSA-N	432.521	1.085	50	20	IDGD	
C[C@H](CO)NC(=O)/C(C#N)=C/c1cn(CCC(N)=O)nc1-c1cccc(Br)c1	914545056	YEDMXSYAZIIBPW-CWZJEYLYSA-N	446.305	1.592	50	20	IDGD	
CCOc1ccccc1C(=O)N1CCC[C@H]1C(=O)NNC(=O)COc1ccc(C#N)cc1	914780514	NWUMOORORVKDCM-IBGZPJMESA-N	436.468	1.788	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)C1CCN(c2cnccn2)CC1	914901453	SQBHYTJEPRQPCL-UHFFFAOYSA-N	447.879	1.359	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCc2nc3ccccc3n2C)cc1	915928398	SHQKPFFFTXAGRT-UHFFFAOYSA-N	444.517	1.033	50	20	IDGD	
CCCS(=O)(=O)N1CCC(NC(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)CC1	916383532	KZFYUNBQYXIWKN-ZDUSSCGKSA-N	430.502	1.128	50	20	IDGD	
CNC(=O)c1ccc(CNC(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)cc1	916392292	VGKKQOOXALZXBA-UHFFFAOYSA-N	436.472	1.481	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2cccc(Cn3cccn3)c2)c1	918133182	OMOGXKJWRWKBQD-UHFFFAOYSA-N	427.486	1.479	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)NNc1ncc(C(F)(F)F)cc1Cl	918779179	DTKGLWOUBKWJKH-UHFFFAOYSA-N	441.761	1.701	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)ccc1OCc1cccnc1	919887126	XMCILRHCRQHVML-MRXNPFEDSA-N	448.501	1.190	50	20	IDGD	
CS(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)c2ccc(Cl)cc2O)c(F)c1	919958116	ZAYUGESJFFIMRI-UHFFFAOYSA-N	437.858	1.180	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@H](C(C)C)N2C[C@@H](C)O[C@H](C)C2)c2ccccc2c1=O	920275589	FMUQDZWPQHMCTH-CLCXKQKWSA-N	429.521	1.311	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)[C@H]1CC(=O)N(c2ccccc2OC)C1	920497307	DUHWIIQJTNQJLI-HNNXBMFYSA-N	435.484	1.808	50	20	IDGD	
N#C/C(=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)NCCCC(N)=O	920853715	GGAKKEQTTBNSTP-GXDHUFHOSA-N	428.880	1.368	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)[C@@H](Cc1ccccc1)NC(=O)c1cccnc1	921302132	OIGQYBDBBCJTIP-HXUWFJFHSA-N	436.443	1.788	50	20	IDGD	
CCS(=O)(=O)N[C@H](CCSC)C(=O)NNC(=O)c1ccc(Br)cc1	1318314585	SMQQXEMDDAURDJ-GFCCVEGCSA-N	438.369	1.271	50	20	IDGD	
CC(C)NC(=S)NNC(=O)CCC(=O)N[C@@H](C)C(=O)c1ccc(Br)cc1	1318369799	HTWDZMNQWXZBNR-NSHDSACASA-N	443.367	1.820	50	20	IDGD	
O=C(O)c1cc(S(=O)(=O)NNC(=O)c2cncn2-c2ccccc2)cc(Cl)c1F	1319795402	CPCCGUSMVVDRID-UHFFFAOYSA-N	438.824	1.986	50	20	IDGD	
CCOC(=O)c1cc(F)cc(S(=O)(=O)NNC(=O)c2cncn2-c2ccccc2)c1	1320145424	LSDIFBKPLOJZTH-UHFFFAOYSA-N	432.433	1.811	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)c1ncoc1[C@H]1CCCO1	1333510781	XTKFSBZLFHTLOV-QGZVFWFLSA-N	447.923	1.758	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3n[nH]c4c3CC[C@@H]4C)C2)C1	1777845146	CVARCYALGIADMC-XEKQOVJPSA-N	439.354	1.934	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cn4ncccc4n3)C2)C1	1777954563	DLYHLPCQZYBHDW-ACJLOTCBSA-N	436.310	1.346	50	20	IDGD	
CC[S@@](=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Br)C2	1779219954	FQLOYANWPHIEPG-ZLHYLOAGSA-N	441.363	1.350	50	20	IDGD	
O=C(c1[nH]nc2ccncc12)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781332077	ZDLFKHOTSQIARF-XJKSGUPXSA-N	426.246	1.092	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3c(F)cc(OC)cc3F)C2)C1	1781709767	LACUINNGLDZUDJ-YJYMSZOUSA-N	432.851	1.671	50	20	IDGD	
CCC(=O)N[C@@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](Br)CC)C1	1781897640	NGJOYUCYPJOCGM-XTDOFWJNSA-N	446.386	1.589	50	20	IDGD	
COc1cc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](C)Br)C2)nn1C	1782002993	AKLYDQODLUQLLO-WPKBUWHJSA-N	443.342	1.340	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc3c(c1)OCO3)C2	1782173072	VYHXNCRRYUJMLU-RRMPHLOHSA-N	438.908	1.797	50	20	IDGD	
CCN(CC)C[C@H](C)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2	1782685484	DDCMKZSRPLKKGG-BXWFABGCSA-N	432.403	1.825	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(Cl)cnc3OC)[C@H]2C1	1783419151	IWTLBENVCOXGLY-DDWPSWQVSA-N	446.331	1.591	50	20	IDGD	
O=C(COc1ccc(O)cc1)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21	1783839357	XWXAFYXSCLDXSE-JQFCIGGWSA-N	441.322	1.536	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)CCc3cnccn3)C2)C1	1784552303	LCEUHNMCCNGWHM-KBXCAEBGSA-N	425.327	1.270	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)Cc3ccc(OC)c(F)c3)C2)C1	1784703822	ASWQYSOVUDMPPB-QRWLVFNGSA-N	428.888	1.461	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)C3(NC(=O)OC(C)(C)C)CC3)C2)C1	1785711539	FWXMHALZGZQCJR-AUUYWEPGSA-N	429.945	1.891	50	20	IDGD	
CC(C)c1nn2ccccc2c1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21	1787256853	INQRZTJFUBBQFO-ONIAQPFYSA-N	448.951	1.651	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccn4ccnc4c3)[C@H]2C1	1788358322	VCAGYMAMSWOQCZ-IWCQGFGOSA-N	449.349	1.959	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1ccc(C2(NC(=O)Cn3cncn3)CCC2)cc1	1788648098	IYBMZOGCBMXELH-RWPZCVJISA-N	448.487	1.546	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3n[nH]c(C4CC4)c3F)C[C@@H]21)[C@@H](F)Br	1789922784	SDBBAYXGLMFJNV-USXUVBGUSA-N	447.280	1.710	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(F)c(F)c3OC)[C@H]2C1	1790170192	GPBNGLRJLXCLPX-ZIEJDFEHSA-N	446.878	1.821	50	20	IDGD	
CCOC(=O)N[C@@H](O)C(=O)NC1(c2ccc(NC(=O)[C@@H](F)Br)cc2)CCC1	1790536338	PIAVKGRWHUTPAI-OCCSQVGLSA-N	446.273	1.876	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccn4nccc4c3)C[C@@H]21	1791056126	OMCZWTPKZJQEPS-CSFVBSKPSA-N	435.322	1.711	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1ccc(C2(NC(=O)CN3CC(=O)NC3=O)CCC2)cc1	1791431725	CTUCNBLPTDFRED-LLVKDONJSA-N	437.294	1.456	50	20	IDGD	
C[C@H](Br)C(=O)Nc1ccc(C2(NC(=O)[C@@H](O)N3CCOCC3)CCC2)cc1	1791435056	PPUOXFDEERNRNY-SCLBCKFNSA-N	440.338	1.555	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc([N+](=O)[O-])o1	1792350979	WHUYLGJUTLNQFV-NJBDSQKTSA-N	430.255	1.422	50	20	IDGD	
CCn1nc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)CBr)cc1C	1792872424	GLILAZTVMYYWQH-ZIEJDFEHSA-N	427.343	1.446	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](NC(C)=O)C(C)(C)C	1793197894	WXPYNXCBHKEMLR-XFIYOXNOSA-N	446.386	1.300	50	20	IDGD	
C#CCO[C@H](C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C	1794141361	GTDFKYCATJRGGL-UUAJXVIYSA-N	441.956	1.795	50	20	IDGD	
Cn1ncc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)C(Cl)Cl)C3)c1C(F)(F)F	1794275934	AGFLGIMBRKZBLR-DIYOJNKTSA-N	429.226	1.446	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc3snnc3c1)C2	1795114920	MHBUZGPOBUPPFJ-GNXNZQSNSA-N	440.323	1.075	50	20	IDGD	
COC(=O)CCCCCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCBr	1795116945	HMPLCQYOOWKDMN-ZSBFGKGUSA-N	433.343	1.485	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccc(S(C)(=O)=O)cc1	1795415812	AGZABFBTRFMEAD-HIRMHNASSA-N	442.965	1.240	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](NC(C)C)C(C)C	1795718638	KGQLHUQBJZUMMX-BPKGMFCQSA-N	432.403	1.772	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)c1ccc2occc2c1O	1796189422	LYLYHUUIQNJOPQ-BJWYYQGGSA-N	434.257	1.384	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(Br)cc1O)C2)[C@@H](F)Cl	1796367277	DHEYMXOOAPJBDO-HZZFPTLFSA-N	435.677	1.892	50	20	IDGD	
C[C@@H]1[C@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Cl)CCN1C(=O)OC(C)(C)C	1796370872	OJHLHBAXVJXANQ-AQGHMYMLSA-N	447.935	1.756	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnn2ccccc12	1796842699	HIVQEXBNWHIYAY-IARIHHJXSA-N	435.322	1.711	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cc1c(C)n[nH]c1C)C2	1796892648	BJWKUQWBHGNCKU-CKFWPPNZSA-N	439.520	1.341	50	20	IDGD	
CC(C)=CCCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2	1799202872	OSWITKLGVKJAIJ-ODRBZYGGSA-N	429.521	1.456	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CCc3ccccc3O1)C2	1800762919	KJPJHHKHOGSVKB-CNGORYIKSA-N	437.334	1.753	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@H]1CCN(C(=O)CCn2ccnn2)[C@H]1c1cccnc1	1803017637	MZCRHFBFBPTDQI-KYJSFNMBSA-N	449.353	1.800	50	20	IDGD	
C[C@H](Oc1ccccn1)C(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]1c1cccnc1	1803146299	NBAKLDXUTLYYIV-LKCYJCQHSA-N	432.908	1.550	50	20	IDGD	
C[C@H]1Oc2ccc(C(=O)N3CCC4(CCCN(C(=O)[C@H](O)CCl)C4)CC3)cc2NC1=O	1805525580	ZUGGQGICXMGRIY-RHSMWYFYSA-N	449.935	1.851	50	20	IDGD	
Cc1occc1C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1805615383	LCARKUCXAHWFAH-GHTZIAJQSA-N	433.273	1.296	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H](CNC(=O)CCBr)[C@@H]1c1cccnc1)n1cncn1	1806346153	ALRCTZKYEGASDP-UNEWFSDZSA-N	435.326	1.725	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)[C@@H](N)c2ccccn2)[C@@H]1c1cccnc1	1807166010	AELKPBNZCDAEBU-NEPXVJNWSA-N	431.924	1.436	50	20	IDGD	
Cc1nn[nH]c1C(=O)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@H]1c1cccnc1	1807804660	KEMAGDNJFTVREG-UBHSHLNASA-N	425.262	1.518	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2c[nH]c(=O)cn2)[C@H]1c1cccnc1)[C@@H](F)Br	1808676152	NKAXFGAZHCECLB-TUKIKUTGSA-N	438.257	1.175	50	20	IDGD	
CSCC[C@H](O)C(=O)N1CC[C@H](CNC(=O)[C@@H](F)Br)[C@H]1c1cccnc1	1808678997	SMZKUCDKDNEVNF-LXTVHRRPSA-N	448.358	1.892	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC2(CCCN(C(=O)C#Cc3ccccc3)C2)CC1	1809296063	LHVYWHXYAFSWBO-UHFFFAOYSA-N	445.523	1.582	50	20	IDGD	
COc1ccc(C(=O)N2CCC3(CCCN(C(=O)c4cccc(B(O)O)c4)C3)CC2)s1	1809975284	ZZXYBJWPWIWSKR-UHFFFAOYSA-N	442.346	1.595	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2cccc(=O)n2O)[C@@H]1c1cccnc1	1813029505	ODMGEIYPSKFOHY-RVKKMQEKSA-N	434.880	1.054	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)COC(=O)C(F)(F)F)[C@H]1c1cccnc1)C(Cl)Cl	1813077401	ICMGGZBDJOBGCF-PWSUYJOCSA-N	442.221	1.997	50	20	IDGD	
CC(=O)N(C)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](F)Br)[nH]n1	1815582897	JRNHVUVWAQCNCN-IUODEOHRSA-N	432.294	1.961	50	20	IDGD	
O=C(CCc1ccco1)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1815932048	HHACXDSUYOMFAQ-IBGZPJMESA-N	436.277	1.621	50	20	IDGD	
COc1ncccc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1	1816433246	XFQSXEWZFQIPCW-INIZCTEOSA-N	443.508	1.492	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](N)Cc3cscn3)sc2C1	1816989423	KRNPAYJPRKNXOX-USWWRNFRSA-N	443.982	1.335	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCN2CCN(C)CC2)n[nH]1	1817156161	MEOULNOYRZQMFP-WBVHZDCISA-N	440.976	1.293	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](O)CCl)CC2)c1ncn(-c2ccccc2)n1	1817487779	ZXIBREVQEUUWQA-SMDDNHRTSA-N	446.920	1.549	50	20	IDGD	
CN(C)C(=O)NCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H](F)Br)CC1	1823882385	SBSWNIARNUSCLR-UKRRQHHQSA-N	435.338	1.568	50	20	IDGD	
CC[C@H](C)[C@@H](O)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1	1824547684	IASLFZYPVKOUOD-ORYQWCPZSA-N	430.354	1.007	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](N)Cc1cccnc1)CC2	1825999266	SNRSSEGJNMGPNR-MJBXVCDLSA-N	437.953	1.274	50	20	IDGD	
Cc1ncc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)s1	1827053143	WOZSOCRUUGNMLG-LJQANCHMSA-N	441.362	1.678	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(F)nc3F)CCO2)C1	1829533728	OIIYEPNERYKPHL-DIFFPNOSSA-N	448.264	1.213	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(C)c3F)CCO2)C1	1830104128	WNQLNOCJISPFDT-OXQOHEQNSA-N	428.888	1.458	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C[C@@H](N)c3cccnc3)C2)C1	1831645679	FEODZKNXORFTAY-WAOWUJCRSA-N	438.956	1.335	50	20	IDGD	
Cc1nc(CC(=O)N2CCC(N3CCC(NC(=O)C(C)(C)CCl)CC3)CC2)no1	1833212193	PHQDBGRQJFCMDS-UHFFFAOYSA-N	425.961	1.757	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(OC(F)F)cn3)CCO2)C1	1833641821	QTYRWHXSRARASF-IFXJQAMLSA-N	447.866	1.770	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cnc(OCF)cn3)CC2)CC1	1833990973	XPVALDUBKCZPOG-MRXNPFEDSA-N	441.935	1.985	50	20	IDGD	
O=C(CCOc1ccccc1)NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1834424679	SJQGSTNLIOYCGI-FQEVSTJZSA-N	437.968	1.627	50	20	IDGD	
C[C@H](C(=O)N1CCOC[C@@]2(CN(C(=O)CCBr)CCO2)C1)c1ccccn1	1834826459	QLWOSIJKNYNPST-HNAYVOBHSA-N	440.338	1.427	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cc4n(n3)CCCC4)CC2)CC1)[C@H](F)Cl	1835080473	LRKVRZCGFCEBNJ-SFHVURJKSA-N	425.936	1.939	50	20	IDGD	
O=C(/C=C/c1ccccc1)N1CCO[C@]2(COCCN(C(=O)CCBr)C2)C1	1835105801	ZDRNNLFLRIHJEX-YJJPMGAVSA-N	437.334	1.941	50	20	IDGD	
CC(C)(C)OC(=O)CC(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836713305	CZWLBPBHVDGQEQ-MRXNPFEDSA-N	432.945	1.317	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(NC(C)=O)o3)CCO2)C1	1837448417	LGQYDEWFDUJFNH-QRWLVFNGSA-N	441.912	1.716	50	20	IDGD	
C[C@H](C(=O)N1CCC(OC2CCN(C(=O)[C@@H](F)Cl)CC2)CC1)n1ccccc1=O	1838082940	UWERUZFLZFMCOR-RDTXWAMCSA-N	427.904	1.942	50	20	IDGD	
COc1ccsc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)Br)C2)C1	1838299196	GAIZLHGKVQHLRK-SJKOYZFVSA-N	447.351	1.610	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cnn4c3CCC4)CC2)CC1	1838702950	YVIODUHXKHDXEF-GOSISDBHSA-N	438.956	1.695	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)COc3ccccc3C#N)C2)C1	1839149579	LVZFTJGSEQKWLT-UTKZUKDTSA-N	435.908	1.411	50	20	IDGD	
Cc1ccc(O)c(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)c1	1839201680	FUVPXCJTCVWBHX-QAPCUYQASA-N	445.285	1.461	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)n3cccc3)C2)C1	1839967369	KEKOEPRWEFZKMN-JTDSTZFVSA-N	442.354	1.679	50	20	IDGD	
Cc1ncc(CC(=O)N2CCO[C@]3(COCCN(C(=O)CCBr)C3)C2)s1	1840398612	RGMPAIWQNJLOKB-KRWDZBQOSA-N	446.367	1.235	50	20	IDGD	
C=CCO[C@@H](C)C(=O)N1CC2(CCCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C1	1841924054	QISXVLWZPNBCFF-GJZGRUSLSA-N	429.945	1.913	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)c2ncn3nc(N4CCOCC4)ccc23)C1	1843154142	DACGAPMLTXNLGD-OAHLLOKOSA-N	446.939	1.400	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)c2ncccc2-c2ccccc2)C1	1843543971	NGXWKPHSCUBKAJ-UHFFFAOYSA-N	441.296	1.559	50	20	IDGD	
C#CCO[C@@H](C)C(=O)N1CC2(CCCN2C(=O)c2cc([N+](=O)[O-])ccc2OC(C)=O)C1	1844692024	YTXIHFHQJLCTRH-AWEZNQCLSA-N	429.429	1.375	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)c1cnc(C)[nH]1)C2	1844692028	YXCHFFAEWKCVPV-UHFFFAOYSA-N	427.417	1.682	50	20	IDGD	
COC(=O)c1ccc(CC(=O)N2CCCC23CN(C(=O)[C@H](F)Br)C3)s1	1845000687	HRZXUSPTAXJUML-ZDUSSCGKSA-N	433.299	1.971	50	20	IDGD	
CN(CC(=O)N1CCCC12CN(C(=O)c1cc(C#N)c[nH]1)C2)NC(=O)NCc1ccccc1	1845039224	SWYFYASVSIRMLU-UHFFFAOYSA-N	449.515	1.050	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC2(CCCN2C(=O)[C@@H](O)CCNC(=O)OC(C)(C)C)C1	1845224068	WQKGQAKPEPEORC-OLZOCXBDSA-N	448.358	1.249	50	20	IDGD	
Cc1nc2c(c(C)nn2C)c(C)c1CCC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	11553400	BPRXGDHCMOEALW-UHFFFAOYSA-N	447.499	1.534	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)c2ccccc2c1=O	17193374	OXNCDFASSUTYPA-CYBMUJFWSA-N	429.477	1.342	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCCC(=O)NNC(=O)COc2cccc(C)c2)cc1	17198619	VKIPEOAICXLGKM-UHFFFAOYSA-N	435.502	1.289	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)OCC(=O)NNC(=O)c2ccc(C)cc2)c1C	22843716	JIVSQBUUPMBQRZ-UDWIEESQSA-N	438.484	1.971	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)C(=O)N2CCCC2)(c2ccccc2)CC1	727154975	ZALRUGIYGHEZOG-UHFFFAOYSA-N	444.532	1.725	50	20	IDGD	
Cc1csc(CCCCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)n1	727230628	MVRWYEDDHHDCCM-UHFFFAOYSA-N	439.563	1.669	50	20	IDGD	
CCN(CC)c1ccc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cc1	727240370	HUGNWSSKNAQNQE-UHFFFAOYSA-N	437.544	1.752	50	20	IDGD	
CN(C)N(C(=O)[C@H]1CCCN(C(=O)c2ccc(Cl)cc2)C1)[C@H]1CCS(=O)(=O)C1	728176902	OYATVDDKVBKSEA-RDJZCZTQSA-N	427.954	1.685	50	20	IDGD	
CCOc1ccccc1[C@H](CC(=O)NNC(=O)[C@H]1COc2ccccc2O1)NC(C)=O	728230007	CQHKDXVRYAPGNC-OXJNMPFZSA-N	427.457	1.640	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)cc1	728976188	JXBQMXDSQIUBJQ-UHFFFAOYSA-N	433.458	1.690	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)CS(=O)(=O)c1cccc(Br)c1	731344454	KCEGXPKUBGOQDX-UHFFFAOYSA-N	429.267	1.752	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)Cn1c(CS(C)(=O)=O)nc2ccccc21)c1ccccc1	731997608	QZSWNICUKNYRMQ-MRXNPFEDSA-N	428.514	1.922	50	20	IDGD	
O=C(C[C@H]1SC(N2CCCC2)=NC1=O)Nc1ccc(C(=O)NNC(=O)C2CCC2)cc1	732141185	PERILNHLXMWEHZ-MRXNPFEDSA-N	443.529	1.670	50	20	IDGD	
C[C@H]1C[C@@H]1C(=O)Nc1cccc(C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c1	732327833	MEVCAFHREOQYAS-SJCJKPOMSA-N	440.412	1.807	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1cccc(O)c1	732889615	RNDHFSAFNMSPCT-CQSZACIVSA-N	448.501	1.118	50	20	IDGD	
Cc1cc(NNC(=O)c2ccc(Cl)c(S(=O)(=O)NC[C@@H]3CCCO3)c2)ncn1	734256278	AYUQMXPWBSQAQF-ZDUSSCGKSA-N	425.898	1.653	50	20	IDGD	
COc1ccc([C@@H]2[C@H](C(=O)NNC(=O)COc3ccc(C#N)cc3)CCC(=O)N2C)cc1	734417084	JOKKGMGKFIVTLZ-DENIHFKCSA-N	436.468	1.703	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)Cc1csc(NC(=O)c2ccccc2F)n1	740852110	LCYVTFGZDHUQQM-UHFFFAOYSA-N	435.481	1.529	50	20	IDGD	
NC(=O)CNS(=O)(=O)c1ccc(C(=O)NN=C(c2ccccc2)c2ccccc2)o1	741144277	OUOCJEKOOLPIEO-UHFFFAOYSA-N	426.454	1.226	50	20	IDGD	
C[C@@H]1CCC[C@H](C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)C1	741513865	DDCRZPVBGVAXRF-AEFFLSMTSA-N	437.562	1.614	50	20	IDGD	
COCCNC(=O)Cn1cc(NC(=O)C(=O)NNc2ccc(Cl)cc2Cl)cn1	741735815	DJALALIPFLWPDD-UHFFFAOYSA-N	429.264	1.034	50	20	IDGD	
CN(C)c1cccc(-c2nnc(SCC(=O)NNC(=O)c3ccc(C#N)cc3)n2N)c1	742454395	PNJAKXCSAUWXDV-UHFFFAOYSA-N	436.501	1.150	50	20	IDGD	
CN(CCCNC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)CC(F)(F)F	743552695	QYIXYDDGSFICEN-UHFFFAOYSA-N	425.433	1.310	50	20	IDGD	
CNC(=O)C1CCC(NC(=O)NNC(=O)Nc2cc(Cl)c(OC)cc2OC)CC1	743568903	KNJCIKZMCHCFFQ-UHFFFAOYSA-N	427.889	1.998	50	20	IDGD	
O=C(NNC(=O)C1CCN(S(=O)(=O)c2ccc(F)c(F)c2)CC1)NC1CCCC1	744052509	FTESIAQAGMPCSP-UHFFFAOYSA-N	430.477	1.639	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)CCN2C(=O)[C@@H](C)Oc3ccccc32)c1	744531621	QRPFYWQCVMGPBH-OAHLLOKOSA-N	425.441	1.503	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)c2cn(Cc3ccccn3)nn2)cc1C	745578767	HWCYHODOCDVMQD-UHFFFAOYSA-N	428.474	1.272	50	20	IDGD	
C[C@H]1C[C@H](NC(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)CCN1C	745856234	BWMONCFWSXRLDA-OXJNMPFZSA-N	448.531	1.815	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)[C@@H]1CCCN(C(=O)N2CCc3sccc3C2)C1	747322981	VRZWKDRYCKITQJ-QGZVFWFLSA-N	427.530	1.723	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)c1ccc(S(N)(=O)=O)c(Br)c1	748080082	KFDHQXSQTDMFEP-UHFFFAOYSA-N	428.264	1.180	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCC(=O)N(Cc2ccccc2)[C@H]1c1ccccc1)C(=O)N1CCCC1	748239983	OSCWIJHAEHVMTA-IRLDBZIGSA-N	448.523	1.936	50	20	IDGD	
Cc1nc2nc(N)nn2c(C)c1CC(=O)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1	749284016	LTXPLZVSZPGKAI-UHFFFAOYSA-N	443.411	1.303	50	20	IDGD	
O=C(CCc1ccccc1)NNC(=O)CN1C(=O)c2ccc(Br)cc2C1=O	749802907	TWALZVKVZGQHDB-UHFFFAOYSA-N	430.258	1.825	50	20	IDGD	
Cc1ccc([C@@H](C)NC(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1[N+](=O)[O-]	752000825	WZWYZVNJNXKDAJ-GFCCVEGCSA-N	434.478	1.902	50	20	IDGD	
CS(=O)(=O)N1CC[C@H](CNC(=O)NNC(=O)c2ccc(COc3ccccc3)o2)C1	752998038	JJEHFDHHYPPWGE-CQSZACIVSA-N	436.490	1.084	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)N[C@@H]2CCCN(Cc3ccccn3)C2=O)c1C	753297064	FZYRFCLAQWMZCB-PKOBYXMFSA-N	439.516	1.987	50	20	IDGD	
NC(=O)[C@H](c1ccc(Cl)cc1)N1CCN(CC(=O)NNC(=O)c2cccs2)CC1	754237640	LDEZLNTVBZXBSG-KRWDZBQOSA-N	435.937	1.007	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)CNC(=O)c1ccccc1C(F)(F)F	755036617	YLCPAKKAUIHKGY-UHFFFAOYSA-N	425.363	1.670	50	20	IDGD	
CCN1CCN(c2ccc(Cl)cc2NC(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)CC1	755446850	RGZFKYLQMPDHER-CYBMUJFWSA-N	443.957	1.069	50	20	IDGD	
O=C(NNC(=O)c1cccnc1)Nc1ccc(N2CCOCC2)cc1N1CCOCC1	755453259	JKLBEEGVHNJVBI-UHFFFAOYSA-N	426.477	1.221	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@@H](C)C(=O)NNC(=O)c1cc(S(N)(=O)=O)c(C)o1	755622228	IPOYGAZDPCWOCT-NSHDSACASA-N	429.882	1.734	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)NC1CCN(S(=O)(=O)C(C)(C)C)CC1	755884436	BFRCCIKDOOOQNH-ZDUSSCGKSA-N	444.529	1.516	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1	756562092	FXVCBRQZICEXAF-UHFFFAOYSA-N	444.473	1.162	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)cc1OCC1CCOCC1	756714024	XSEYRENPNZRBHQ-HNNXBMFYSA-N	425.507	1.388	50	20	IDGD	
O=C(CN1CCN(c2ccc(F)cc2Cl)CC1)NNC(=O)c1cccc([N+](=O)[O-])c1	757162619	IGPYTCPDHKJTJJ-UHFFFAOYSA-N	435.843	1.971	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)c1cc(C2CC2)nc2onc(CC(C)(C)C)c12	758036365	QWICEXMCJOXLDX-SNVBAGLBSA-N	437.522	1.388	50	20	IDGD	
Cc1ccc(C)c(S(=O)(=O)C2(C(=O)NNC(=O)C(=O)Nc3ccccn3)CCCC2)c1	758840800	QVRQSCIAGCJVPC-UHFFFAOYSA-N	444.513	1.571	50	20	IDGD	
COc1ccc(OC)c(CCCNC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c1	758945478	XKKLYUWGOYQNNU-UHFFFAOYSA-N	435.502	1.684	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)N[C@H]1C[C@H](C)N(c2cnn(C)c2)C1=O	761722606	ZEVRJZCNGYERQH-JSGCOSHPSA-N	432.506	1.045	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C1=NN(c2ccccc2)[C@H](C(N)=O)C1	762370045	DVAPNVBHKTZZOH-HNNXBMFYSA-N	427.486	1.055	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)[C@@H]2CCCN2S(=O)(=O)c2ccc(C)cc2)n1	762912344	GYSUVZXDKGUTJO-KRWDZBQOSA-N	432.550	1.928	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)N[C@@H]2CC[C@@H]3SCCS[C@@H]32)c2ccccc2c1=O	763077144	BLXPJMRFDQYETD-IJEWVQPXSA-N	433.559	1.740	50	20	IDGD	
O=C(CCCC[C@@H]1SC[C@H]2NC(=O)N[C@H]21)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	763175078	BBAWZGDOVDJMLA-SOLBZPMBSA-N	446.508	1.703	50	20	IDGD	
O=C(NNC(=O)c1ccnc(Cl)c1F)c1ccc(S(=O)(=O)N2CCCC2)cc1	763272207	HAXAHZHVVKYDIT-UHFFFAOYSA-N	426.857	1.733	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C)c(C)c(NC(=O)C(=O)NNC(=O)c2ccccn2)c1	763464582	VFPAJJAIWPWHIH-UHFFFAOYSA-N	447.517	1.129	50	20	IDGD	
O=C(NNC(=O)c1cc2ccccc2cc1O)C(=O)Nc1cccnc1N1CCOCC1	763521670	HYEADACBPDKNEJ-UHFFFAOYSA-N	435.440	1.177	50	20	IDGD	
CC(=O)Nc1ccc(Cl)c(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1	763574777	IIMKVMWCVIWVNV-INIZCTEOSA-N	432.820	1.224	50	20	IDGD	
COCCOc1ccc(NC(=O)C(=O)NNC(=O)COc2cccc(C)c2)cc1Cl	763629749	HNLPNJAJCHYBAP-UHFFFAOYSA-N	435.864	1.839	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(F)cc2Br)cc1	763662233	WKQJAAIIUXQIOM-UHFFFAOYSA-N	440.225	1.762	50	20	IDGD	
O=C(COc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1cc2c(cc1Cl)OCCO2	763685400	UVNGYHIPMISZNZ-UHFFFAOYSA-N	440.239	1.930	50	20	IDGD	
C[C@H](CC(=O)NNC(=O)CNC(=O)c1cccnc1)[C@H]1CCCN(C(=O)OC(C)(C)C)C1	763824400	OMRYLRBKRPDCTE-WBVHZDCISA-N	447.536	1.632	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccccc2C(=O)N2CCC(C)CC2)n1	763884921	HMOVIWOTMQSPBP-UHFFFAOYSA-N	440.504	1.158	50	20	IDGD	
C[C@@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3cc(Cl)ccc3O)cc2)CCO1	763973952	IKDVRQSHVLNWHX-GFCCVEGCSA-N	432.864	1.670	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)NC(=O)[C@@H](C)O2	764012482	QXWJCYFLKKYDOH-SECBINFHSA-N	432.820	1.468	50	20	IDGD	
O=C(NNC(=O)c1cnccn1)C(=O)Nc1cc(C(F)(F)F)ccc1N1CCCCC1	764031277	JNHFLLLQIJFNSH-UHFFFAOYSA-N	436.394	1.885	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)C(=O)N(CC1CC1)C2=O	764042093	AKWXHCCHYVNHRR-UHFFFAOYSA-N	436.424	1.101	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(C(C)C)on2)cc1Br	764327313	XESPASVJGSGEJW-UHFFFAOYSA-N	425.239	1.969	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)c2cc3ccccc3o2)c(C)c1	764342412	OCZAASBGAPUGFD-UHFFFAOYSA-N	425.397	1.693	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)c1ccccc1OCc1cn2ccccc2n1	764343129	LKFCMVJCIWJAOR-UHFFFAOYSA-N	444.451	1.499	50	20	IDGD	
COc1nccnc1NNC(=O)c1ccc(Cl)c(S(=O)(=O)NC[C@@H]2CCCO2)c1	764482394	UWCAHQZXPBIYQN-LBPRGKRZSA-N	441.897	1.353	50	20	IDGD	
CC(=NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1)c1cc(F)ccc1O	764816760	ATLSJBSTZDUIQS-UHFFFAOYSA-N	448.520	1.686	50	20	IDGD	
CC(C)(C)OC(=O)CCC(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	765427010	XQPHGNDMLUJLFM-UHFFFAOYSA-N	438.956	1.727	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2cc(CN3C(=O)c4ccccc4C3=O)cc(C)c2O)n[nH]1	765587401	KIKKJWFMTXZSGY-UHFFFAOYSA-N	433.424	1.603	50	20	IDGD	
CC(C)(C)c1nc(CCNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)cs1	765642535	GYUHXVJUFNVHNQ-UHFFFAOYSA-N	438.579	1.920	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)C(C)(C)c2ccccc2)cc1F	765646715	CWSSQGLYZYQZOK-UHFFFAOYSA-N	443.522	1.875	50	20	IDGD	
O=C(/C=C/c1ccc([N+](=O)[O-])cc1)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765736152	PBZQZUKTHBNXNJ-DHZHZOJOSA-N	437.456	1.213	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)Cn3ccc(C(F)(F)F)n3)CC2)cc1	765749453	NVSSEDWPTZMWEX-UHFFFAOYSA-N	438.454	1.176	50	20	IDGD	
COC(=O)c1nccc2c(S(=O)(=O)NNC(=O)c3ccc4c(c3)OCCO4)cccc12	766313118	WUADDKZGLIKINR-UHFFFAOYSA-N	443.437	1.416	50	20	IDGD	
CC(C)(C)c1nnc2ccc(C(=O)OCC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)cn12	769208373	WXZJILGLJZKXMA-UHFFFAOYSA-N	440.416	1.553	50	20	IDGD	
Cc1oncc1C(=O)Nc1ccc(O)c(C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1	770467308	YYQIEPSQPMKQIO-SFHVURJKSA-N	438.396	1.542	50	20	IDGD	
C[C@]1(CCC(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)CCC(=O)N1	770549402	NVGWXOCVQULRKT-HSZRJFAPSA-N	447.499	1.598	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(-c3nc[nH]n3)cc2)cc1OC	770572507	BVFXENYEQZWROA-UHFFFAOYSA-N	425.401	1.107	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)[C@H]3CC(=O)N(c4ccc(F)cc4)C3)nc21	770966965	CKKDELASNUJCMC-NSHDSACASA-N	427.440	1.922	50	20	IDGD	
COC(=O)CNC(=O)Cc1ccc(NC(=O)C(=O)NNc2ccc3ccccc3n2)cc1	773662353	QFILWMBDICOIPR-UHFFFAOYSA-N	435.440	1.148	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2cnc3ccccc3n2)cc1NC(=O)CCN(C)C	773718794	OIZLCOCODZSVBA-UHFFFAOYSA-N	435.488	1.910	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(OCC(=O)N3CCCC3)c2)cc1F	773886634	ZZBNEJBTTHNRPI-UHFFFAOYSA-N	442.447	1.535	50	20	IDGD	
COC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(NC(=O)NNc3ncccn3)cc2)C1	775468538	RUFIYLFDDDZDJO-CYBMUJFWSA-N	434.478	1.199	50	20	IDGD	
Cn1ccnc1[C@@](O)(CCNC(=O)NNc1cccc(S(C)(=O)=O)c1)C(F)(F)F	776610117	RSWXJHHXUBTBQQ-HNNXBMFYSA-N	435.428	1.290	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)C1CCN(C(=O)CCOc2ccccc2)CC1	778443294	OQIIQTDTYNDVCS-UHFFFAOYSA-N	448.520	1.366	50	20	IDGD	
O=C(CCc1ccccc1)NNC(=O)C(=O)Nc1ccc(C(=O)N2CCOCC2)c(F)c1	778710569	OXJPRUZMINZOMA-UHFFFAOYSA-N	442.447	1.017	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@@H](C(=O)NNc2cccc(Br)c2)[C@H](C)O)cc1	779535800	FKYFRNMKGZKAIK-BLLLJJGKSA-N	442.335	1.929	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)NOCc1ccc(F)cc1Br	781022485	CPDLHFMTIDQKJS-UHFFFAOYSA-N	435.250	1.875	50	20	IDGD	
O=C(NNc1ncccc1C(F)(F)F)C(=O)Nc1cccc(CN2C(=O)CNC2=O)c1	783119453	GBIXCUADKQIBES-UHFFFAOYSA-N	436.350	1.234	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NN=c2sc3ccccc3n2C)cc1	783352173	OKUCXTBQVSGFQO-UHFFFAOYSA-N	433.515	1.572	50	20	IDGD	
Cc1c(NC(=O)C(=O)NN[C@]2(C)CCS(=O)(=O)C2)cccc1C(=O)Nc1ccccc1	783425539	ILUGIARZRAQZJL-OAQYLSRUSA-N	444.513	1.384	50	20	IDGD	
COCCOc1c(Cl)cccc1NC(=O)C(=O)NNc1ccc(-n2cccn2)nn1	783435917	CDHSMKFNZNKKHC-UHFFFAOYSA-N	431.840	1.423	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2cc(F)cc(S(N)(=O)=O)c2)ccc1Br	783923221	RFWRWLZSUOBSKW-UHFFFAOYSA-N	445.270	1.626	50	20	IDGD	
CC(C)n1ncc2cc(NC(=O)C(=O)NNC(=O)CNC(=O)c3cccs3)ccc21	784004267	DCBKDGRYDPPSKI-UHFFFAOYSA-N	428.474	1.195	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ccc(OC(F)F)cc2)cc1S(=O)(=O)N(C)C	784312748	OPIOLUYJMLIXMU-UHFFFAOYSA-N	442.444	1.929	50	20	IDGD	
CC[C@@H](C)NS(=O)(=O)Cc1cccc(NC(=O)C(=O)NNc2ccc(Cl)nn2)c1	784786308	PDRPBAALHNNMMO-LLVKDONJSA-N	440.913	1.430	50	20	IDGD	
NS(=O)(=O)[C@@H]1CCN(C(=O)C(=O)Nc2ccccc2S[C@@H](Cl)C(F)(F)F)C1	784793752	QQCFTBNBJQMSFK-AMIZOPFISA-N	445.872	1.734	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2cc(S(=O)(=O)N(C)C)ccc2F)cc1Cl	785117423	PLPKTONUXWYZLJ-UHFFFAOYSA-N	444.872	1.820	50	20	IDGD	
COc1ccc2nc(NNC(=O)C(=O)Nc3ccc4c(c3)N(C)C(=O)CO4)c(C)cc2c1	785166091	BTQUPUZCNBGHNE-UHFFFAOYSA-N	435.440	1.989	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCc2nccn2C1)c1cccc(S(=O)(=O)N2CCCCC2)c1	786686590	DNGFQEWDODPXBF-MRXNPFEDSA-N	431.518	1.081	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)c1cc([C@@H]2CCN(C(=O)OC(C)(C)C)C2)[nH]n1	787386011	GCCQJPDPYMPIOH-GFCCVEGCSA-N	436.513	1.200	50	20	IDGD	
COc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NNc2nnc(-c3ccccn3)s2)cc1	788562727	SSYXUJVBPPMDQK-NSHDSACASA-N	434.503	1.419	50	20	IDGD	
O=C(COC(=O)[C@H]1CCCc2c(O)cccc21)NNC(=O)[C@H]1COc2ccccc2O1	789254165	VAJSQYAVULJFIK-HNAYVOBHSA-N	426.425	1.343	50	20	IDGD	
Cc1cccc(Cn2nccc2NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)c1	789818472	LERUIVDDWYKNKH-FPOVZHCZSA-N	447.495	1.898	50	20	IDGD	
O=C(CN1CCN(Cc2ccccc2Cl)CC1)NNC(=O)c1ccnn1CC(F)F	789990137	GRNSJFIXPORDMB-UHFFFAOYSA-N	440.882	1.380	50	20	IDGD	
Cc1cccc(-c2nnc(S)n2CCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1	790091964	UVHARXPKXZLEFZ-KRWDZBQOSA-N	439.497	1.920	50	20	IDGD	
C[C@]1(NNC(=O)NCc2nc(-c3cccc(Br)c3)no2)CCS(=O)(=O)C1	790898061	TWXXONVCMALNRZ-HNNXBMFYSA-N	444.311	1.380	50	20	IDGD	
COc1cccc(C2=NO[C@@H](C(=O)NNC(=O)C(=O)NCc3ccc(Cl)cc3)C2)c1	792294227	MILIIVBRSLZCPM-QGZVFWFLSA-N	430.848	1.305	50	20	IDGD	
CNS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2cc(F)ccc2Br)nc1	792392905	GIBINOFKTIBLTF-UHFFFAOYSA-N	446.258	1.358	50	20	IDGD	
COc1c(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cccc1[N+](=O)[O-]	792806723	VHXORGCEADHJFR-UHFFFAOYSA-N	448.457	1.463	50	20	IDGD	
CN(C)N(C(=O)[C@H]1CCN(c2ccc(Cl)c(Cl)c2)C1=O)[C@@H]1CCS(=O)(=O)C1	792853964	HVUSJVFXJDFYPE-OLZOCXBDSA-N	434.345	1.839	50	20	IDGD	
COc1ccccc1NC(=S)NNC(=O)CN1C(=O)N[C@](C)(c2ccc(C)cc2)C1=O	792952113	FOGQNWCHPYESEO-OAQYLSRUSA-N	441.513	1.788	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)N(CC(F)F)C(=O)CS3)o1	793026716	UAQXDHPYBGLTRU-UHFFFAOYSA-N	438.412	1.692	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)Cc1ccc(S(=O)(=O)N(C)C)cc1	793968289	AJMBTLRXFWHOSW-ZDUSSCGKSA-N	439.921	1.748	50	20	IDGD	
CC(=NNC(=O)C(=O)Nc1ccccn1)c1cc(S(N)(=O)=O)c(Cl)cc1Cl	794516686	LQFQTBMOEQMETP-UHFFFAOYSA-N	430.273	1.515	50	20	IDGD	
CC(=NNC(=O)c1ccc(O)c(O)c1)c1ccc(S(=O)(=O)N(C)CCCC(=O)O)cc1	794557108	PUZOEEVNKREFPF-UHFFFAOYSA-N	449.485	1.737	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)c2ccc3c(c2)OCCO3)c(Br)c1	794576466	JYCVNAMYEZMQRJ-UHFFFAOYSA-N	443.275	1.852	50	20	IDGD	
Cc1cccc(C(=O)NNS(=O)(=O)c2ccc(OCCCC(=O)O)c(Cl)c2)n1	794601397	RJBMCAWZFZEVDS-UHFFFAOYSA-N	427.866	1.910	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)CNC(=O)OCc2ccccc2)c(C)c(OC)c1	800634286	GOTCICAQZCWCPA-UHFFFAOYSA-N	444.444	1.025	50	20	IDGD	
COc1ccc(OC)c(C2=NO[C@H](C(=O)NNC(=O)C(=O)Nc3ccc(C)cc3)C2)c1	801106666	XEUCIJWWSGXFRG-SFHVURJKSA-N	426.429	1.291	50	20	IDGD	
COC(=O)c1cn(CC(=O)NNc2c(Br)cccc2Br)nn1	801499728	CRRJGPMDNJLMNA-UHFFFAOYSA-N	433.060	1.733	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)[C@](C)(O)CN2C(=O)C(C)(C)c3ccccc32)cc1	802055672	QNHGMYVCMPCRPB-JOCHJYFZSA-N	426.473	1.923	50	20	IDGD	
CCOC(=O)C(C)(C)c1csc(NC(=O)C(=O)NNc2cccc(C(=O)OC)c2)n1	806968879	RIBDIKPSNISVAW-UHFFFAOYSA-N	434.474	1.852	50	20	IDGD	
COc1ccc(CS(C)(=O)=O)cc1NC(=O)C(=O)NNc1ccc(OC(F)F)cc1	807006127	RLRQGZDHTPZDEP-UHFFFAOYSA-N	443.428	1.923	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)NC[C@@H](N2CCOCC2)C(F)(F)F)cc1	807541399	MWNWLXUZAXKTCX-XJKSGUPXSA-N	448.442	1.446	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccccc1C(F)(F)F)NNc1ccc(-n2ccnc2)nn1	811455809	VMDKVMHKSZPOOE-UHFFFAOYSA-N	441.395	1.103	50	20	IDGD	
CCc1nc2ccc(Cl)cn2c1C(=O)NNC(=O)c1csc(N2CCOCC2)n1	812451306	WTWXZMIAXSFMFC-UHFFFAOYSA-N	434.909	1.918	50	20	IDGD	
O=C(COC(=O)COc1ccc(Cl)c(F)c1)NNC(=O)[C@@H]1COc2ccccc2O1	815299705	MZCJYZNAUVMFLJ-INIZCTEOSA-N	438.795	1.389	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1csc(-c2ccccn2)n1	815751494	BOICVODYBMYZMK-UHFFFAOYSA-N	446.514	1.537	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)C(=O)Nc2ccc3nc(C)nn3c2)c1	815865847	HIKRSPYYBHJPBH-UHFFFAOYSA-N	447.249	1.669	50	20	IDGD	
CC[C@H](C)C(=O)NNC(=O)C[C@@H]1c2cc(OC)c(OC)cc2CCN1S(C)(=O)=O	818038739	JNVGKFXUQIAETQ-SWLSCSKDSA-N	427.523	1.146	50	20	IDGD	
Cn1nnnc1Sc1ccc([N+](=O)[O-])cc1C(=O)NNC(=O)c1cccc(Cl)c1	904159847	GGEOGRHPDXQUKK-UHFFFAOYSA-N	433.837	1.998	50	20	IDGD	
O=C1CN(S(=O)(=O)c2cccc(C(=O)NNc3cccc(C(F)(F)F)c3)c2)CCN1	911613252	IAKJFJASPGMRJC-UHFFFAOYSA-N	442.419	1.583	50	20	IDGD	
COCCNS(=O)(=O)c1cccc(C(=O)NNC(=O)CC23CC4CC(CC(C4)C2)C3)c1	913055422	YDDZQNPIFZVBLF-UHFFFAOYSA-N	449.573	1.979	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)c2cn(-c3ccccc3)nn2)cc1	914747906	UEMAQVSQWQBEMW-UHFFFAOYSA-N	434.485	1.763	50	20	IDGD	
CC(=NNC(=O)COc1ccc(C#N)cc1)c1ccc(S(=O)(=O)NCCC(=O)O)cc1	916300197	RXPZQSHRJXBGJJ-UHFFFAOYSA-N	444.469	1.230	50	20	IDGD	
O=C(NCc1ccnc(OCC(F)(F)F)c1)NNC(=O)[C@@H]1COc2ccccc2O1	916397540	UGQYMBNVSQBYNJ-AWEZNQCLSA-N	426.351	1.693	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)NC[C@H]2CN(Cc3ccccc3)CCO2)cc1	919898112	YAACZABUEZBSKR-NRFANRHFSA-N	426.517	1.859	50	20	IDGD	
O=C(NNC(=S)NCCc1cccs1)c1nc2ncc(Br)cn2n1	920208231	GMUPCPAITFJUNN-UHFFFAOYSA-N	426.325	1.300	50	20	IDGD	
CC(CCc1cccc(C(F)(F)F)c1)=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O	920370693	MNAFITZJHQTXNQ-UHFFFAOYSA-N	443.451	1.715	50	20	IDGD	
COc1ccc(CCCNC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1OC	920920664	PSVALSWPTKCUJZ-UHFFFAOYSA-N	439.472	1.528	50	20	IDGD	
COc1cc(Cl)c(Br)cc1C(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1	1116767146	WIJALGHTMDZNPE-ZETCQYMHSA-N	440.703	1.242	50	20	IDGD	
CC/C=C(\C)C(=O)N1CSC[C@H]1C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C	1251873841	FWRZXHBRNLRHFG-WHGQRRHOSA-N	429.543	1.099	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)c1n[nH]cc1I	1320605863	CDZXFTNRWZKZEC-UHFFFAOYSA-N	447.258	1.212	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1)n1ccnc1	1337863158	XFGPCQISTJVLNF-HNNXBMFYSA-N	427.486	1.384	50	20	IDGD	
O=C(NCCNS(=O)(=O)Cc1ccccc1)NNC(=O)c1ccc2ccccc2c1	1342003675	LJIGACYRUIMMJT-UHFFFAOYSA-N	426.498	1.903	50	20	IDGD	
C[C@H]1CCC[C@H]1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnccc1C(=O)NN)C2	1778896256	CRNSMHPBOWKCOA-PMKZCDPUSA-N	443.548	1.249	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(C)(C)CCl)C2	1779315775	SDDZIPDXIOIGFE-STXHMFSFSA-N	430.977	1.473	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H]2CCCCN2C)C1	1780595215	XMGHSIRXWDQDBB-YYAJDYIMSA-N	430.387	1.768	50	20	IDGD	
Cc1ncc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](F)Br)C2)cn1	1780771053	RKSMJZMDFQQKSI-JKIFEVAISA-N	429.290	1.603	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](C)CNC(=O)OC(C)(C)C)CCO2	1781211278	OOLBDQWYKWVWEF-QEEYODRMSA-N	431.961	1.995	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)c3[nH]nc4ccncc34)CCO2)C1	1781228183	YYEQMOCEDPEANC-QZTJIDSGSA-N	426.304	1.638	50	20	IDGD	
Cc1c(F)ccc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)c1N	1781330801	GOEJCQDGRTXWDF-PBHICJAKSA-N	432.265	1.850	50	20	IDGD	
O=C(c1cc(O)cc([N+](=O)[O-])c1)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781333446	OJGLHFLICHLIMC-XJKSGUPXSA-N	446.229	1.434	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)c1ccco1)C2	1781995847	XITPSZHXHWFKOR-LJGDNWOOSA-N	429.311	1.610	50	20	IDGD	
O=C(c1ccc(-c2ccc(O)nn2)cc1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Cl)CCO2	1782115832	ODEHMXBFXMWSKV-YLJYHZDGSA-N	434.855	1.827	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H]2CCNC(=O)C2)C1	1782268958	HYZFQDUJMPUXKU-TWKYDXJASA-N	434.364	1.263	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)Cc3ccc(O)cn3)CCO2)C1	1783354278	OPYOOCZWHATCGL-QAPCUYQASA-N	426.311	1.333	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)C3(C)CCCCC3)C2)C1	1783817714	GVFRQTOAJIKYHB-QADUPLGGSA-N	443.548	1.921	50	20	IDGD	
CC#C[C@@H](CC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](Cl)COC)CCO2)c1ccc(O)cc1	1784012801	CCPHBQRMBSJCPM-LEDOBFOHSA-N	448.947	1.973	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cn4ccc(Cl)cc4n3)C[C@@H]21)[C@@H](O)CCl	1784093367	UYIUWAAOQVTVOR-MZGVZZPPSA-N	441.315	1.181	50	20	IDGD	
Cc1cc(C)n(CCC(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)n1	1784321165	KPCXRDWNIXJPQO-MAUKXSAKSA-N	427.343	1.503	50	20	IDGD	
Cc1cc(C)n(CCC(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)n1	1784321796	SRUPMENNKBTWMU-DOTOQJQBSA-N	431.306	1.410	50	20	IDGD	
Cc1nn(C)c(C)c1CC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2	1784515366	SZORMDQMSZRVSH-KZULUSFZSA-N	427.343	1.193	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(F)(F)C(F)(F)C(=O)O)[C@H]2C1	1784917121	BQVIALSDAJFPIP-MMWGEVLESA-N	432.798	1.339	50	20	IDGD	
Cc1nn(C)c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)Br)C[C@@H]32)c1F	1785779393	UVPHTTFHMVNZCX-IXOXFDKPSA-N	431.306	1.244	50	20	IDGD	
O=C(CSc1ncccn1)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21	1787073085	FOFWCDYBTNZKFA-IHRRRGAJSA-N	443.367	1.333	50	20	IDGD	
C[C@@H]1CCc2c(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)[C@H](F)Br)C[C@@H]43)n[nH]c21	1787952779	WNTJLMDJVBFJCZ-SSHPZETRSA-N	443.317	1.743	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)[C@@H]1Cc2ccccc2O1	1788184493	AQQCKSLYVKOGCD-PTTAZLHSSA-N	441.297	1.660	50	20	IDGD	
CC(=O)O[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)C(C)C	1788474541	NLIPCJFLTFAKST-QBYUYEEZSA-N	433.343	1.339	50	20	IDGD	
C[C@H](Nc1ccccn1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CO[Si](C)(C)C)C[C@@H]21	1788782829	VPFLOJUYOCETNE-XSLAGTTESA-N	434.613	1.713	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(S(C)(=O)=O)cn3)C[C@@H]21	1789858682	IVSIZXPBHAJAMV-QEWYBTABSA-N	443.953	1.096	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nc4ccccn4n3)C[C@@H]21	1789866264	MRAIHQPJKRLEBD-MNUAXYBXSA-N	440.331	1.559	50	20	IDGD	
Cc1ccc(-n2ccnn2)c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Cl)C[C@@H]32)c1	1790316464	QXXQWZIKCXMFQS-IKICRFKJSA-N	435.887	1.703	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3c(C)c[nH]c3C)C[C@@H]21	1791249561	LSWNAMZSIYZUOM-WNHJNPCNSA-N	425.957	1.798	50	20	IDGD	
CSCC[C@@H](O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]21	1791308226	WUJIPAACCANXMK-LHLGERLTSA-N	427.394	1.316	50	20	IDGD	
C[C@H](Cn1ccnc1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21	1791628055	IOWYLCQDDVZHOB-QTVXIADOSA-N	431.306	1.189	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)COc3ccccc3C#N)[C@H]2C1	1792147659	XLTHQIPPBDIBTJ-BJLQDIEVSA-N	445.592	1.768	50	20	IDGD	
CC(C)(C)OC(=O)N1C(=O)CC[C@@H]1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCl	1793116113	GLLHKBAAKHZOSM-KHMAMNHCSA-N	443.928	1.150	50	20	IDGD	
COc1cc(Cl)cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)c1	1796192753	QFLLGRBFFLHSIH-REPLKXPHSA-N	442.708	1.594	50	20	IDGD	
CC(=O)N[C@@](C)(C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Cl)c1ccccc1F	1796367275	DGTMFEPOHAACQH-RSSYPWKWSA-N	443.878	1.301	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H]2C[C@@]2(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Cl)C1	1796370829	PQKXJEIEKHBYQR-RNCJLBHCSA-N	445.919	1.367	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnc2ccccn12	1796951300	KJVGHMJJFSTRMQ-VWPFQQQWSA-N	435.322	1.569	50	20	IDGD	
Cn1ncc2cc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)CO[Si](C)(C)C)C4)ccc21	1797082918	CPACGYUETLLKGF-XEMDLRDOSA-N	430.581	1.628	50	20	IDGD	
Cc1oc2cc(O)ccc2c1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(B(O)O)cc1)C2	1797516291	XVSUAUBILGMMAL-BCDXTJNWSA-N	448.284	1.692	50	20	IDGD	
Cc1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)c(F)c1F	1798443685	WCCYHTWAWNRLKZ-BTTYYORXSA-N	443.454	1.837	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(S(C)(=O)=O)cn1)C2	1798625392	CPWNTPQOSXDAJS-QDMKHBRRSA-N	439.610	1.588	50	20	IDGD	
COc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CO[Si](C)(C)C)C3)cc1OC	1798894203	CBLUWAUKOQJSAC-CWPLJXCYSA-N	436.581	1.759	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(OC2CCOCC2)n1)[C@H](O)CCl	1799059481	NXQJOTSZHRFZJY-BASYENTBSA-N	437.924	1.491	50	20	IDGD	
C[C@H](Oc1cccnc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2	1801403930	GWSGYWYIAFCNOI-ZZVJUGKHSA-N	430.274	1.129	50	20	IDGD	
O=C(CCCc1cccnc1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2	1801479761	WPVIWTBUYBUWNA-FSDCSDTHSA-N	428.302	1.684	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1CCc2ccccc2C1)c1ccc(B(O)O)cc1	1801841237	ZJRXSNMXWRQJIO-SNJCGAMXSA-N	432.329	1.423	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Cl)C3)C1	1802060072	ICHKJRAMARTYBO-XRGAULLZSA-N	433.908	1.367	50	20	IDGD	
C#CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](Cl)COC	1802283173	PUPCNMDVEHTGLX-BQJWPVKWSA-N	441.956	1.795	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]1c1cccnc1)n1cccc1C=O	1803139344	XGNDVBURQFULEW-YCEFEEMOSA-N	432.908	1.562	50	20	IDGD	
C[C@H](CS(C)(=O)=O)C(=O)NC[C@@H]1CCN(C(=O)C(Cl)Cl)[C@@H]1c1cccnc1	1803591774	XLZIBYFJRHOPAY-KWCYVHTRSA-N	436.361	1.572	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H](CNC(=O)c2ncn(C)n2)[C@@H]1c1cccnc1	1805317963	JSEIGDVEWCYYIT-YUELXQCFSA-N	435.326	1.561	50	20	IDGD	
O=C(CCBr)NC[C@H]1CCN(C(=O)c2cc(O)ncn2)[C@@H]1c1cccnc1	1806341618	DBVQNWFLNVGPOQ-CXAGYDPISA-N	434.294	1.682	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)c2ccccc2F)[C@H]1c1cccnc1)c1cccc(B(O)O)c1	1807376204	UEWVJIQBDFAQKT-GCJKJVERSA-N	447.275	1.534	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)CSc2ncccn2)[C@@H]1c1cccnc1	1807576506	NXCFCFWDDPFJKV-RYRKJORJSA-N	449.964	1.924	50	20	IDGD	
Cn1cnc(C(=O)N2CC[C@H](CNC(=O)[C@](C)(Cl)CCl)[C@@H]2c2cccnc2)n1	1808292599	ZAEWJEDZPCPLME-QWQRMKEZSA-N	425.320	1.766	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)C(Cl)Cl)[C@H]1c1cccnc1)c1cc(O)nc(O)n1	1808305422	ZPPNNRDMHSEPKW-GWCFXTLKSA-N	426.260	1.406	50	20	IDGD	
COC(=O)c1ccc(C(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@H]2c2cccnc2)cn1	1808589470	NQVWVJILCACXJX-QGTPRVQTSA-N	446.891	1.183	50	20	IDGD	
CN[C@H](CC(=O)N1CCCC2(CCN(C(=O)[C@H](C)CBr)CC2)C1)C(=O)O	1809829313	MJQXPWGWZRMLGW-ZIAGYGMSSA-N	432.359	1.311	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@H](CNC(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)o1	1810295709	VTMYUCLZYXVFLQ-UZLBHIALSA-N	448.483	1.615	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2ccns2)[C@H]1c1cccnc1	1813071830	YHIGMUWXGMDXCY-BEFAXECRSA-N	430.534	1.231	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)CC[C@H]2CCOC2)[C@@H]1c1cccnc1	1813073454	ISGCWLVMWZUJDW-WCAVRKLYSA-N	445.564	1.277	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)C(Cl)Cl)[C@@H]1c1cccnc1	1813081778	APVXUAGWZGGKRV-BBRMVZONSA-N	430.336	1.264	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)C[C@@H](N)c3cccnc3)sc2C1	1815182602	LCGPQEDNEINHSI-HZSPNIEDSA-N	437.953	1.794	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCBr)n[nH]1	1816784517	HTBABGKOPCNWID-CYBMUJFWSA-N	443.346	1.560	50	20	IDGD	
CC(=O)N(C)[C@@H](C)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCBr)CC2	1817297069	VDLGOSCPRHVAQV-ONGXEEELSA-N	431.356	1.707	50	20	IDGD	
COc1cccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)c1	1817476910	SXDLBZJEKZPHJJ-HXUWFJFHSA-N	448.288	1.718	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccncc2F)n[nH]1	1818397570	JOJUJQMMGOLJOB-INIZCTEOSA-N	431.472	1.623	50	20	IDGD	
N#Cc1ccc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2ccc(B(O)O)cc2)CC3)cc1	1822162952	GIRUUZRWKHQNBD-KRWDZBQOSA-N	446.297	1.234	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)COc2cccnc2)[nH]n1	1822410944	SUOGKEWUDBVINA-QGZVFWFLSA-N	443.508	1.249	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H]2C[C@]2(F)Cl)[nH]n1	1822416971	UFZIYBAHUKMMFO-SUFBMKPHSA-N	428.896	1.699	50	20	IDGD	
N=C(N)SCCC(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1	1823002562	DQEZHMQYYISXAS-LHLIQPBNSA-N	438.348	1.762	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCC([C@H]2CCCCN2C(=O)CN2CC(=O)NC2=O)CC1	1824973497	STBPQMAQXMHMOS-KUHUBIRLSA-N	447.363	1.394	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)CCNC(C)=O)sc2C1	1825246956	VRWZQXISJLAHIE-MNOVXSKESA-N	431.356	1.755	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc3c(c1)CNC3=O)CC2	1826000226	OTZKQEKAFQFOHR-GXTWGEPZSA-N	448.932	1.866	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](C)Nc1cnccn1)CC2	1826000338	SHMLTLXCXDBHSV-SRVKXCTJSA-N	438.941	1.600	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCC([C@H]2CCCCN2C(=O)CN)CC1	1826814132	HENQERLROAAGKP-GOSISDBHSA-N	432.477	1.712	50	20	IDGD	
O=C([C@H](O)CCl)N1CCC([C@H]2CCCCN2C(=O)CSc2ncccn2)CC1	1827170393	JVDRUTXSHXNMAE-HZPDHXFCSA-N	426.970	1.788	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(=O)n3[nH]nnc3n2)CC1	1827400117	ZWRGVORZMQIVDK-GDBMZVCRSA-N	449.943	1.453	50	20	IDGD	
CCOC(=O)N[C@@H](O)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCBr)CC1	1828758115	DXKHIMKMXRKUNG-ZBFHGGJFSA-N	448.358	1.456	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccncc2)CC1	1828926008	XJAJYLYHOIOXRG-FQEVSTJZSA-N	436.516	1.627	50	20	IDGD	
Cc1cc(C(=O)NCC(=O)N2CCCC[C@H]2C2CCN(C(=O)[C@@H](F)Cl)CC2)no1	1828986322	LQFLCHHLTBBFIN-DOTOQJQBSA-N	428.892	1.867	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)C#CC3(O)CCCCC3)C2)C1	1830365352	WVMPGMGSWZOVJJ-QFIPXVFZSA-N	440.968	1.406	50	20	IDGD	
Cc1cc2[nH]c(C(=O)N3CCOC[C@]4(C3)CN(C(=O)[C@@H](O)CCl)CCO4)cc2s1	1830736615	VFJNKOCYKQWNKC-KXBFYZLASA-N	441.937	1.208	50	20	IDGD	
Cc1cccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)n1	1830921001	CLYFJTITEMXXFQ-SJLPKXTDSA-N	444.301	1.079	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3csc(C)n3)C2)C1	1831640970	UFLGOHUBFNFDCW-APWZRJJASA-N	429.970	1.858	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)/C=C/c3cc(C)on3)C2)C1	1831651343	ORBWSBVCWRMDKS-ZARSWLQMSA-N	425.913	1.860	50	20	IDGD	
O=C(/C=C/c1ccsc1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1833141859	QYYZLWUBPDWEPH-XGERFZHZSA-N	447.326	1.908	50	20	IDGD	
COc1ccc(CC(=O)N2CCC(N3CCC(NC(=O)[C@@H](O)CCl)CC3)CC2)cc1	1833308839	AJLZNVUHLXOOFL-FQEVSTJZSA-N	437.968	1.409	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3ccc4cc[nH]c4c3)CC2)CC1)[C@H](O)CCl	1833309975	GAEULDHCQLDCRE-HXUWFJFHSA-N	432.952	1.953	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(C(C)=O)[nH]n3)CCO2)C1	1833820979	PMNYKBDCSSINDY-AUUYWEPGSA-N	426.901	1.090	50	20	IDGD	
Cc1cnc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@](C)(Cl)CCl)C3)C2)cn1	1834084231	KASBRMCUZWWFNI-MSOLQXFVSA-N	431.320	1.091	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cncs3)CCO2)C1	1834461261	VJYNEGZGJPHVNB-WBMJQRKESA-N	432.340	1.244	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)c1cc2ncsc2[nH]1	1835849005	YDGNNHFGZHVCAU-INIZCTEOSA-N	439.969	1.409	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@H](F)Br)CC2)CC1	1836414417	JUBCAFLINTZCOP-KGLIPLIRSA-N	442.757	1.502	50	20	IDGD	
CC[C@@H](NC(C)=O)C(=O)N1CCC(OC2CCN(C(=O)[C@H](Cl)COC)CC2)CC1	1836618938	KYXPYIIVBLBESY-QZTJIDSGSA-N	431.961	1.154	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3ccc(O)nn3)CC2)CC1	1837368566	FSYBOHUBMCMQIS-HNNXBMFYSA-N	426.901	1.048	50	20	IDGD	
O=C(CCc1ccc(O)nn1)N1CCC(OC2CCN(C(=O)[C@H](F)Cl)CC2)CC1	1838085037	SQKHBSDIYLAVPU-SFHVURJKSA-N	428.892	1.648	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCC(OC2CCN(C(=O)CCn3cncn3)CC2)CC1	1838637767	CVABCNKYKWVPLQ-LJQANCHMSA-N	446.379	1.903	50	20	IDGD	
CC(C)c1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)n[nH]1	1838700239	WIJAMFDAINVDOG-FZKQIMNGSA-N	443.342	1.387	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)CSc3nc[nH]n3)CC2)CC1	1838787538	XGKMXQWDFQUOEI-OAHLLOKOSA-N	445.973	1.149	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C=C/c3cnc[nH]3)C2)C1	1839154974	FBRUXLLKAQGDHW-DJSXQKDESA-N	431.320	1.116	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnn4c3OCCC4)CCO2)C1	1839516157	CVWKMEPDOTUEHS-OXJNMPFZSA-N	440.928	1.143	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H]3[C@H]4C=CS[C@H]43)CCO2)C1	1839699815	VSHVVGBHCLSEIB-QVXTZCDOSA-N	435.373	1.554	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C1(CC)COC1)CCO2	1839778729	OHAJDVRVTIFFLP-KDOFPFPSSA-N	433.343	1.043	50	20	IDGD	
CC(C)c1nc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)co1	1840030946	AXRVHRMGTBVKCC-FZKQIMNGSA-N	444.326	1.651	50	20	IDGD	
O=C(/C=C/c1cccc(O)c1)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840189639	DHLGTXFXAMZJQW-PXPVJAHISA-N	429.300	1.666	50	20	IDGD	
C=CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)[C@H](Cl)COC)C2	1841748445	XEOHEAKRLHTRGQ-CABCVRRESA-N	429.945	1.913	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1cnn3ccccc13)C2	1843416017	OJBNXRBMJUPKGC-MFKUBSTISA-N	433.472	1.285	50	20	IDGD	
C[C@H](Br)C(=O)N1CC2(CCCN2C(=O)c2cc(Cl)c3nncn3c2)C1	1844226996	WPKUHBCLIFWOLG-JTQLQIEISA-N	426.702	1.983	50	20	IDGD	
CC#CC[C@H](C(=O)N1CCCC12CN(C(=O)c1cnccc1C(=O)NN)C2)c1ccccc1	1844336090	VHCVPLAAJAJDIE-IBGZPJMESA-N	445.523	1.699	50	20	IDGD	
CCC(C)(C)C(=O)N1CC2(CCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)C1	1845039371	IRDVWQSJXPWNBQ-UHFFFAOYSA-N	429.565	1.972	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC12CN(C(=O)c1cnc3c(c1)NC(=O)CS3)C2	1846178847	WXQGJYPMWDBFKG-JTQLQIEISA-N	439.335	1.726	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@](O)(C(=O)N2CCCC23CN(C(=O)C(C)(C)CCl)C3)C1	1846410313	MEFMPEDRPVYJQN-OAQYLSRUSA-N	443.972	1.827	50	20	IDGD	
COC(=O)c1ccc(OCC(=O)N2CCCC23CN(C(=O)[C@@H](F)Br)C3)cc1	1847148503	ZTDFEQCIAHLKKT-OAHLLOKOSA-N	443.269	1.746	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@](C)(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](O)CCl)C1	1847559486	NHGZAUORKYOVHU-KZDUYQQSSA-N	429.945	1.435	50	20	IDGD	
C[C@@H]1[C@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](O)CCl)CCN1C(=O)OC(C)(C)C	1847568693	ISZDZFIUMHVTAR-OWYFMNJBSA-N	429.945	1.433	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@@H](C)C(=O)NNC(=O)Cn1c(=O)[nH]c(=O)c2ccccc21	10403160	ADUSVZSHBGSABH-ZDUSSCGKSA-N	444.875	1.575	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)Cn2nnc(-c3ccc(Cl)cc3)n2)cc1OC	14323639	NXRZZTYWFMBZHW-UHFFFAOYSA-N	430.852	1.862	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)oc2ccccc12	15424923	QJFPWWPMIMROHU-UHFFFAOYSA-N	443.481	1.837	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=O)c2cc(OC)cc(OC)c2)n(C)c1	16229688	OVZONFQBXMEHIG-UHFFFAOYSA-N	438.506	1.148	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN(C(=O)Nc2ccccc2)C1)c1n[nH]c(=O)c2ccccc12	17195603	GNUBMXWDIHNBMR-CQSZACIVSA-N	434.456	1.628	50	20	IDGD	
C[C@]1(C2CC2)NC(=O)N(CC(=O)NNC(=O)COc2ccccc2-c2ccccc2)C1=O	17202058	ZUCBQYPXIVOVCX-HSZRJFAPSA-N	436.468	1.600	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCCC(=O)NNC(=S)NCCc2cccs2)cc1C	21124101	RKYOKLNWJOGJQM-UHFFFAOYSA-N	440.616	1.771	50	20	IDGD	
CCn1c(NNC(=O)CNC(=O)c2cnc3ccccc3c2O)nc2ccccc2c1=O	107928792	TUTHMOLLPCXUAA-UHFFFAOYSA-N	432.440	1.543	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)c1ccc(Br)s1)N1C(=O)NC2(CCCC2)C1=O	110367540	RIFLPBSZCOZMBM-QMMMGPOBSA-N	429.296	1.525	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)N2CCC(N3CCC[C@@H]3C(N)=O)CC2)c1C	726800141	GZDGJKHHWLUKIC-CKNGIZQFSA-N	427.549	1.599	50	20	IDGD	
C[C@H]1CC(C)(C)C[C@@]2(C1)NC(=O)N(CC(=O)NNc1nc(-c3cccnc3)no1)C2=O	728078898	AHXSFXDCAVIQDT-FKIZINRSSA-N	427.465	1.712	50	20	IDGD	
O=C(COC(=O)c1ccn(-c2ccc(F)cc2)n1)NNC(=O)[C@H]1COc2ccccc2O1	728326513	ZGUMKEBNFYIXLU-GOSISDBHSA-N	440.387	1.156	50	20	IDGD	
CN(CC(=O)NNC(=O)c1cc(F)ccc1Br)S(=O)(=O)c1ccccc1	728549057	BAKSCWZNJDQJTJ-UHFFFAOYSA-N	444.282	1.670	50	20	IDGD	
O=C(NCc1cnn(Cc2ccccc2)c1)NNC(=O)C1CCN(c2ncccn2)CC1	728948560	KJJJPRFGJFWKKW-UHFFFAOYSA-N	434.504	1.468	50	20	IDGD	
C[C@H](CC(=O)OCC(=O)NNC(=O)c1cccs1)S(=O)(=O)c1ccc(F)cc1	729136875	ZITKHOMZUABLQC-LLVKDONJSA-N	428.463	1.444	50	20	IDGD	
CN(C)CCOc1ccc(CCNC(=O)NNC(=O)Cc2nc3ccccc3n2C)cc1	729615593	SNWNVIGHPHHYRF-UHFFFAOYSA-N	438.532	1.629	50	20	IDGD	
O=C(CSc1nnnn1CC(F)(F)F)NNC(=O)c1cc(-c2ccccc2)on1	729965657	LLIXVWOZTIVRCI-UHFFFAOYSA-N	427.368	1.444	50	20	IDGD	
C[C@@H]1CCCN(S(=O)(=O)c2cc(C(=O)NNC(=O)CNc3ccccc3)n(C)c2)C1	730274878	QLULRTUVRLQXSZ-OAHLLOKOSA-N	433.534	1.319	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2CCCN(C(=O)c3ccccc3)C2)c1	731165637	AFHZWACUQVJNHX-QGZVFWFLSA-N	429.498	1.404	50	20	IDGD	
Cc1c(C(=O)NNC(=O)NCCc2cccs2)nnn1-c1ccc2c(c1)OCCO2	731472563	FJGOQBRJQDMTHI-UHFFFAOYSA-N	428.474	1.595	50	20	IDGD	
CCOCCCn1c(NNC(=O)CNC(=O)NC2CCCCC2)nc2ccccc2c1=O	733268324	KAECBNSXXAEPHI-UHFFFAOYSA-N	444.536	1.898	50	20	IDGD	
O=C(CN1CCN(C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)CC1)Nc1ccccc1	733350304	UQGRKZYJPRHEQT-UHFFFAOYSA-N	447.499	1.483	50	20	IDGD	
CN1C(=O)C[C@H](C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)[C@H]1c1cccc(Cl)c1	734393608	SXOMQBCGRPWREW-FUHWJXTLSA-N	449.916	1.724	50	20	IDGD	
CC(C)Oc1ccc([C@@H](O)CNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1	734862097	URWWCWOWKTUSSS-IBGZPJMESA-N	442.520	1.544	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cnn(C)c2)cc1S(=O)(=O)N1CCCCCC1	735444208	GQMXCIWJHXYCSS-UHFFFAOYSA-N	435.506	1.068	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)NCc2cccc(-n3cncn3)c2)c2ccccc2c1=O	735584777	RIKVTHVDLIIUPC-UHFFFAOYSA-N	446.471	1.702	50	20	IDGD	
CN(C)c1nccc(NNC(=O)C2CCN(S(=O)(=O)c3cccnc3Cl)CC2)n1	740112389	GJGJKJKBXDAFRA-UHFFFAOYSA-N	439.929	1.135	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CC[C@@H](NC(=O)OC(C)(C)C)[C@H](C)C2)n1	740879008	CUZFJFPIZORYNJ-TZMCWYRMSA-N	425.555	1.377	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)c2ccc(C[C@@H]3CC(=O)NC3=O)cc2)cc1	741144112	FNMNKEHBZRZDDP-RHSMWYFYSA-N	439.468	1.519	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1c(C(C)C)nn(C)c1Cl	741663031	WNKKUKPBPCWEFS-UHFFFAOYSA-N	426.930	1.873	50	20	IDGD	
Cc1nn(C)c(C)c1C[C@@H](C)C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	741880523	KSSGLLDIHRKRFI-QGZVFWFLSA-N	426.565	1.575	50	20	IDGD	
O=C1C[C@@H](Cc2ccc(C(=O)NNC(=O)c3cc(F)ccc3Br)cc2)C(=O)N1	743336413	GLTHDATZMLVUSM-GFCCVEGCSA-N	448.248	1.868	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)[C@H]2C[C@]23CCc2ccccc23)CC1	743420069	UNRQPGWYTFTCDK-GCJKJVERSA-N	441.557	1.365	50	20	IDGD	
CN(Cc1ccco1)Cc1ccccc1CNC(=O)NNC(=O)CNC(=O)c1ccco1	743576314	BXADVGOKIGZRLG-UHFFFAOYSA-N	439.472	1.765	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NCCN2C(=O)Cc3ccccc32)cc1	743577259	CGYNMYFDYRPCNC-UHFFFAOYSA-N	431.474	1.015	50	20	IDGD	
NS(=O)(=O)c1ccc(OCC(=O)NNc2c(F)cc(F)cc2Br)cc1	743701207	RPIWQJGRWVQDEQ-UHFFFAOYSA-N	436.234	1.897	50	20	IDGD	
O=C1C[C@@H](Cc2ccc(C(=O)NNC(=O)c3cc(Br)ccc3O)cc2)C(=O)N1	743732174	NKDHQGMMVGTQSZ-GFCCVEGCSA-N	446.257	1.435	50	20	IDGD	
O=C(CN1CCC(C(=O)NC2CCCCC2)CC1)NNC(=O)c1ccc([N+](=O)[O-])cc1	744220895	JEZXWDUKCSNVAT-UHFFFAOYSA-N	431.493	1.517	50	20	IDGD	
C[C@@H](CC(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1)NC(=O)C1CCCC1	744622322	RTKAJYWXKJOVBQ-HNNXBMFYSA-N	438.550	1.236	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)[C@H]2CC(=O)N(c3ccc(Cl)cc3)C2)cc1	744820461	HWSJYMLTBXQUQW-HNNXBMFYSA-N	440.843	1.569	50	20	IDGD	
COc1ccc(C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)c(Br)c1	744913151	JZUCGYIMRSZJBF-UHFFFAOYSA-N	432.230	1.947	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1cnnn1-c1ccccc1Cl	745485988	YKYTUWUBVXKAOK-UHFFFAOYSA-N	447.908	1.597	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)[C@H](c2ccccc2F)N2CCOCC2)cc1	745494935	DANSHKXQMUEGKQ-FQEVSTJZSA-N	440.431	1.075	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NC[C@@H](C)Oc2ccc(F)cc2)c2ccccc2c1=O	745892467	ZIAMAKSZZGGTHY-CYBMUJFWSA-N	427.436	1.967	50	20	IDGD	
COc1ccccc1C(=O)N[C@H](CCS(C)(=O)=O)C(=O)NNc1c(F)cccc1F	748175279	FOVKJVYUAPTKAL-OAHLLOKOSA-N	441.456	1.650	50	20	IDGD	
Cc1nn(-c2ccc(C(=O)NNC(=O)C(=O)N3CCCC3)cc2)c(C)c1Br	748241309	VKSCKMHHLPJCSC-UHFFFAOYSA-N	434.294	1.635	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)N[C@H]1CCN(c2cccc(OC(F)(F)F)c2)C1	748636852	XYOINJZLGPIAOJ-STQMWFEESA-N	434.415	1.546	50	20	IDGD	
Cc1c(Br)cc(S(=O)(=O)NNC(=O)Cc2cccnc2)cc1C(=O)O	748644493	ZYAFZJCGAZRAKJ-UHFFFAOYSA-N	428.264	1.403	50	20	IDGD	
Cc1cc(Br)ccc1NNC(=O)CCN1CCN(C(=O)[C@@H]2CCCO2)CC1	748740476	GDFMQPPXTTZOGO-KRWDZBQOSA-N	439.354	1.914	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)c2ccc(Br)c(S(C)(=O)=O)c2)c(O)c1	749265002	DXAKSPAGHSIMPN-UHFFFAOYSA-N	427.276	1.941	50	20	IDGD	
NC(=O)CC[C@@H](C(=O)NNC(=O)c1cc2ccccc2o1)N1C(=O)c2ccccc2C1=O	749480733	IXNCBUULWUNESE-HNNXBMFYSA-N	434.408	1.124	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)c1cnn(-c2ccc(F)cc2)c1C(F)(F)F	751201922	MZSFLSZBFXWRKC-UHFFFAOYSA-N	439.325	1.814	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@@H]2CSCN2C(=O)OC(C)(C)C)c2ccccc2c1=O	751294720	RVQQLMKUAUNJOH-AWEZNQCLSA-N	447.517	1.487	50	20	IDGD	
O=C(COC(=O)c1occc1Br)NNC(=O)[C@H]1COc2ccccc2O1	751699985	HSZPJJMUZQWPLN-GFCCVEGCSA-N	425.191	1.186	50	20	IDGD	
CC[C@H](CS(=O)(=O)c1ccccc1)NC(=O)NNC(=O)Cc1nc2ccccc2n1C	752704273	MJYAACHUZROPMI-OAHLLOKOSA-N	443.529	1.699	50	20	IDGD	
COc1cc(OC)cc(N2C[C@H](C(=O)NNC(=O)CNc3ccc(C)cc3)CC2=O)c1	752792800	QIZXFASYFSTCQW-OAHLLOKOSA-N	426.473	1.625	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)CNC(=O)c1ccco1)c1noc(-c2ccc(Cl)cc2)n1	753038483	LTTMWDAASISCPC-JTQLQIEISA-N	432.824	1.804	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)cccc1S(N)(=O)=O	753889763	SMPHSYMZZSGYQX-UHFFFAOYSA-N	443.485	1.008	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)[C@@H](C)CS(=O)(=O)c1ccc(F)cc1	755035843	GNBSSULXVZUNJL-AWEZNQCLSA-N	438.477	1.861	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)Nc1ccc(S(=O)(=O)N2CCC[C@@H](C)C2)cc1	755447757	RFHKACXRGPVTHQ-HUUCEWRRSA-N	442.538	1.311	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)n([C@H]2CCS(=O)(=O)C2)n1	755531782	IZHWNKHUPDYCNE-NSHDSACASA-N	449.518	1.469	50	20	IDGD	
C[C@H]1CN(c2nccnc2C#N)CCN1C(=O)NNC(=O)c1cnn(-c2ccccc2)c1	756941832	DZJYSWXJGYFBTN-HNNXBMFYSA-N	431.460	1.099	50	20	IDGD	
Cn1cc(-c2ccccc2CNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cn1	758772239	WQRIAFMSJQQRDN-UHFFFAOYSA-N	434.504	1.624	50	20	IDGD	
COCCCn1c(S)nc2cc(C(=O)NNc3ccc(C(=O)OC)cn3)ccc2c1=O	759728846	KPADRTKTNSICTO-UHFFFAOYSA-N	443.485	1.660	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)N2CCOCC2)cc1S(=O)(=O)Nc1ccc(F)cc1	760473547	CWRBSEWLVYVJKF-UHFFFAOYSA-N	436.465	1.622	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCCC(=O)NNC(=S)NCC1CCC1	760808952	NCIZPCWVINRHNZ-AWEZNQCLSA-N	427.571	1.188	50	20	IDGD	
CCCS(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)c2scnc2C)c(OC)c1	761274590	SRGLQIBWTHREKK-UHFFFAOYSA-N	448.548	1.235	50	20	IDGD	
O=C(NN=C1CCOc2c1cc(Br)cc2[N+](=O)[O-])N[C@H]1CCS(=O)(=O)C1	761811966	KNLRTUJJEHEAEN-VIFPVBQESA-N	447.267	1.330	50	20	IDGD	
CC(C)n1nnnc1-c1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2O)cc1F	763528316	XPPNMZVHLZNKEL-UHFFFAOYSA-N	427.396	1.165	50	20	IDGD	
Cn1ccnc1Sc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)cc1	763547885	GEVMFVOGMSZXAA-UHFFFAOYSA-N	439.453	1.700	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)Nc1ccc(N2CCCC2)c(Cl)c1	763572654	TZZJVDYEKPCJNS-SFHVURJKSA-N	444.875	1.866	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(=O)Nc1cc(F)ccc1OC(F)F	763572920	VVRKFGYBXPORTP-CQSZACIVSA-N	425.319	1.353	50	20	IDGD	
CN(C)C1CCN(c2ccc(NC(=O)C(=O)NNC(=O)c3ccccc3F)cc2F)CC1	763574988	NMBWNGQIHJBTMA-UHFFFAOYSA-N	445.470	1.895	50	20	IDGD	
CC(C)(C)c1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccn(CC(F)(F)F)n2)cc1	763600568	QSADKFWBYUFQRR-UHFFFAOYSA-N	441.410	1.908	50	20	IDGD	
COC(=O)c1ccc(OC(C)C)c(NC(=O)C(=O)NNC(=O)COc2cccc(C)c2)c1	763623892	PNYCLERLAANSAJ-UHFFFAOYSA-N	443.456	1.734	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1	763645751	AEKUBCXGSAIZRY-UHFFFAOYSA-N	436.346	1.751	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)c(Br)c1	763682623	XSZCTDOSVFTRGP-UHFFFAOYSA-N	447.245	1.494	50	20	IDGD	
CSc1ccncc1NC(=O)C(=O)NNC(=O)COc1ccc(Br)cc1	763692388	AXSPJSLGMMLZOW-UHFFFAOYSA-N	439.291	1.731	50	20	IDGD	
CCc1ccc(NC(=O)C(=O)NNC(=O)c2nn(CC)c(=O)c3ccccc23)cc1F	763785632	KIIXYWPBAJZOSY-UHFFFAOYSA-N	425.420	1.518	50	20	IDGD	
CC[C@@H](C)Oc1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])cc1	763803338	GRNOLHFIDDAAFX-CYBMUJFWSA-N	430.417	1.937	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)n([C@H]2C[C@H]3CC[C@H]2C3)n1	763807136	LFDVRUVUYSSNAH-ZOBUZTSGSA-N	436.472	1.589	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1cccc(OC[C@H]2CCCO2)c1	763866399	PADQMOSUGUAMFI-IFXJQAMLSA-N	445.447	1.937	50	20	IDGD	
COc1cc(OC)c(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(C(C)=O)cc2)cc1F	763878354	PDHSSGTYEABNEC-LBPRGKRZSA-N	447.419	1.599	50	20	IDGD	
COc1ccc(Oc2ccc(NC(=O)C(=O)NNC(=O)Cn3nc(C)cc3C)cn2)cc1	763880213	CVEJBMGIUVJJFB-UHFFFAOYSA-N	438.444	1.482	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)C(=O)N1CCc2c1cccc2C(F)(F)F	763916288	FXQZNESTMZPEDG-UHFFFAOYSA-N	445.361	1.031	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)C(=O)Nc3ccccc3S(C)(=O)=O)cc2C1	763939856	OLPLBTPRNLXVIA-LLVKDONJSA-N	435.527	1.676	50	20	IDGD	
CO[C@H]1Cc2ccc(NC(=O)C(=O)NNC(=O)c3nn(-c4ccccc4)cc3O)cc2C1	763947956	HDXOKMJCVJQRHL-KRWDZBQOSA-N	435.440	1.091	50	20	IDGD	
CC(=O)Nc1cc(NC(=O)C(=O)NNC(=O)c2cc(Br)cn2C)ccc1C	764004794	MSDKSJQTNVNPHF-UHFFFAOYSA-N	436.266	1.454	50	20	IDGD	
COCCOc1ccc(Br)cc1NC(=O)C(=O)NNC(=O)C1CCCC1	764065835	CWCJVUIPDSKPFY-UHFFFAOYSA-N	428.283	1.750	50	20	IDGD	
CSc1cnn(-c2ccccc2)c1NC(=O)C(=O)NNC(=O)[C@@H]1Cc2ccccc2O1	764162731	FLLMIXSHGDDLBQ-INIZCTEOSA-N	437.481	1.684	50	20	IDGD	
CN(C)C(=O)C[C@H]1CN(C(=O)C(=O)NNC(=O)CC2CCCC2)c2ccc(Cl)cc21	764178496	BHSLISLSTYXGAA-AWEZNQCLSA-N	434.924	1.976	50	20	IDGD	
O=C(CC1CCCC1)NNC(=O)C(=O)Nc1cc(N2CCCS2(=O)=O)ccc1Cl	764178697	GOLJJVUCHLPOOG-UHFFFAOYSA-N	442.925	1.546	50	20	IDGD	
CC(=O)N1CCN(Cc2ccc(NC(=O)C(=O)NNC(=O)CC3CCCC3)cc2)CC1	764179097	OJAPBFVIVAVTLF-UHFFFAOYSA-N	429.521	1.017	50	20	IDGD	
C[C@H]1CCCCN1C(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cccc(C#N)c2)cc1	764233511	ACSUBNWMFXXXDO-HNNXBMFYSA-N	433.468	1.973	50	20	IDGD	
CC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2scnc2C)c(C(F)(F)F)c1	764247517	ROMYBIVKPSRTGY-UHFFFAOYSA-N	429.380	1.828	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)C(=O)Nc1cc(C(=O)N2CCCCC2)ccc1Cl	764264115	PWRPOMBFWNFMEQ-UHFFFAOYSA-N	443.891	1.690	50	20	IDGD	
O=C(Cc1ccccn1)NNC(=O)C(=O)Nc1ccc(N2CCSCC2)c(Cl)c1	764264137	NJKYRLIIJSBMBU-UHFFFAOYSA-N	433.921	1.617	50	20	IDGD	
CNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2cc(F)ccc2Br)c1	764271261	ZNOSWHZIHBZHKG-UHFFFAOYSA-N	437.225	1.348	50	20	IDGD	
COc1cc(Br)cc(NC(=O)C(=O)NNC(=O)COc2ccccc2O)c1	764276923	FJANAPYBGJGAAE-UHFFFAOYSA-N	438.234	1.328	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)C(=O)Nc1ccccc1C(=O)N1CCCCC1	764277823	IBVMWAPXVJFEPB-UHFFFAOYSA-N	438.484	1.737	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1F)C(=O)Nc1ccc(CN2C(=O)CCC2=O)cc1	764410416	FVVNBJGOWLIEEM-UHFFFAOYSA-N	446.822	1.528	50	20	IDGD	
Cc1ccc(Sc2ccc(NC(=O)C(=O)NNC(=O)[C@@H]3COCCO3)cc2)c(C)c1	764424351	IVMZHZZEBOLNTQ-KRWDZBQOSA-N	429.498	1.956	50	20	IDGD	
CCOC(=O)NNC(=O)C(=O)Nc1cccc(CS(=O)(=O)c2ccc(F)cc2F)c1	765409279	MZAOWBAPDHKADE-UHFFFAOYSA-N	441.412	1.655	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3ccc(C(N)=S)cc3)n[nH]2)cc1OC	765596734	KVWKFZNJGRAWKT-UHFFFAOYSA-N	425.470	1.803	50	20	IDGD	
CCOc1ccc(NC(=S)NNC(=O)[C@H](C)NS(=O)(=O)c2cccc(C#N)c2)cc1	767854266	BEIOSPKOERNUMM-ZDUSSCGKSA-N	447.542	1.642	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H]2C[C@H](C)O[C@H](C)C2)c1	768120138	AHIJLXBKVGBDQO-MIFYACCESA-N	426.539	1.617	50	20	IDGD	
CCOc1cccc(-c2nnc(SCC(=O)NNC(=O)c3ccc(C)cc3)n2N)c1	768423006	IUIFTMLGTGJHBW-UHFFFAOYSA-N	426.502	1.919	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)CN1C(=O)N[C@@]2(CCCC(C)(C)C2)C1=O	768566453	RZKKDYHZEKUWIO-LRTDBIEQSA-N	434.468	1.631	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)NC2CCN(C(=O)CCOC)CC2)cc1	769163498	ABIWEYNODQUBMT-OAHLLOKOSA-N	436.509	1.211	50	20	IDGD	
CCSCc1cc(C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)no1	770245421	MFPKQBUBRLHCJP-UHFFFAOYSA-N	431.518	1.147	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)NCC(=O)Nc3ccc(F)c(F)c3)nc21	770336686	PLWVEBSXWPHOTI-UHFFFAOYSA-N	434.407	1.830	50	20	IDGD	
Cc1cc(Br)c(F)cc1NC(=O)C(=O)NNC(=O)[C@H]1Cc2ccccc2O1	770771073	GKNUWEHDJUJSGW-OAHLLOKOSA-N	436.237	1.986	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)C(C)(C)N1C(=O)c2ccccc2C1=O	771439750	MJBBPXZAQQLBLI-UHFFFAOYSA-N	432.477	1.514	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCCNC(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)s1	772630226	HJTJSWZAXXDMLT-UHFFFAOYSA-N	440.591	1.882	50	20	IDGD	
CCNS(=O)(=O)c1ccc(CC(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)cc1	772954794	RXMSZWKMKOAKOG-CYBMUJFWSA-N	439.921	1.796	50	20	IDGD	
C#CCNS(=O)(=O)c1ccc(C(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)cc1	772955633	SIANSYQKSYCJJQ-ZDUSSCGKSA-N	435.889	1.480	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)cc1CC(=O)O	773264986	PMOSQLMPIIWNLH-NSHDSACASA-N	442.877	1.753	50	20	IDGD	
O=C(Cc1n[nH]c2c1CCCC2)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	777273442	AXMNFCSYCJJCBY-UHFFFAOYSA-N	444.967	1.450	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)NCc2ccccc2CN2CC[C@H](O)C2)cc1	781835212	QYUHMXHMZCQZGU-FQEVSTJZSA-N	426.521	1.855	50	20	IDGD	
COCCCNC(=O)NNS(=O)(=O)c1cc(C(=O)O)c(Cl)cc1Br	782462958	LSPOHLKXRACCNI-UHFFFAOYSA-N	444.691	1.330	50	20	IDGD	
O=C(NNC(=O)c1ccc(O)cc1)C(=O)Nc1cccc(F)c1I	782832381	YKNJLNLGANFEGL-UHFFFAOYSA-N	443.172	1.536	50	20	IDGD	
Cc1cc(C)cc(NNC(=O)C(=O)N2C[C@@H](C(=O)N3CCOCC3)Oc3ccccc32)c1	783359255	KIOFZLPBYSLNDG-FQEVSTJZSA-N	438.484	1.400	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2ccc(-c3cn4ccsc4n3)cc2)CCS(=O)(=O)C1	783426068	FPWOTYYFTOUNQC-GOSISDBHSA-N	433.515	1.199	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(OC)c(NC(=O)C(=O)NN(C)c2ccccc2)c1	783429862	PBQIXTCINWPUPV-UHFFFAOYSA-N	434.518	1.832	50	20	IDGD	
COCCOc1cc(NC(=O)C(=O)NNc2ccc(Br)nc2)ccc1OC	784809569	SJZQSQSFIUZVSH-UHFFFAOYSA-N	439.266	1.960	50	20	IDGD	
CN(C)c1nccc(NNC(=O)C(=O)Nc2ccc(-c3nnc4n3CCCCCC4)cc2)n1	784969526	OAKIQVWFVCCMRR-UHFFFAOYSA-N	449.519	1.999	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)c(Cl)n1	785099220	BAVGSPZVQDQUNO-UHFFFAOYSA-N	439.806	1.996	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)C(=O)Nc3cnn(CC(F)F)c3)n[nH]2)c1	785127270	ZIOIQBPRUJDGMM-UHFFFAOYSA-N	431.403	1.555	50	20	IDGD	
Cc1ccc(-n2cc(NC(=O)C(=O)NNC(=O)COc3ccccc3C#N)cn2)c(C)c1	786414611	PLLPFALWLXPVFK-UHFFFAOYSA-N	432.440	1.526	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1coc(C2CCOCC2)n1	786712294	DPNUSOADTUJWQN-UHFFFAOYSA-N	437.836	1.849	50	20	IDGD	
O=C(NN=Cc1ccc(Br)cc1N1CCOCC1)N[C@H]1CCS(=O)(=O)C1	788715008	UGVAROQKIMBPCB-AWEZNQCLSA-N	445.339	1.106	50	20	IDGD	
CCNC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(OC)cc2OC)c1C	789735171	UGFXHPBWLHXUJJ-UHFFFAOYSA-N	443.460	1.553	50	20	IDGD	
CC(C)(C)CC(=O)NNC(=O)NCC(=O)Nc1ccc(I)cc1	790892214	TWVZUBFSBBZEEM-UHFFFAOYSA-N	432.262	1.996	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2cc([N+](=O)[O-])c(N(C)C)cc2F)c2ccccc2c1=O	791196071	ZDWUOMYQMVKLNZ-UHFFFAOYSA-N	442.407	1.605	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)CCc2ccco2)cc(N2CCN(C(C)C)CC2)c1	792268819	NJUHARZJRUHASX-UHFFFAOYSA-N	441.532	1.837	50	20	IDGD	
CN(C)Cc1ccc(NC(=O)C(=O)NNc2nc3ccccn3n2)cc1Br	792396154	XZHMOMUFEUNMKO-UHFFFAOYSA-N	432.282	1.635	50	20	IDGD	
COc1ccc(Cn2cc(NC(=O)C(=O)NNC(=O)c3c(C)nc4ccccn34)cn2)cc1	793023244	KBUDLULONNHZED-UHFFFAOYSA-N	447.455	1.296	50	20	IDGD	
COCc1cc(C(=O)OC)cc(S(=O)(=O)NNC(=O)c2cccc3ncccc23)c1	793391765	BSEQXBISWGARNN-UHFFFAOYSA-N	429.454	1.791	50	20	IDGD	
Cc1nc(COc2cccc(C(=O)NNC(=O)CNC(=O)OCc3ccccc3)c2)no1	794064373	YZHVNCAWSHLOQL-UHFFFAOYSA-N	439.428	1.644	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNS(=O)(=O)c1cc(C(=O)O)ccc1Cl	794599466	ZVRMNBHJPRMESG-UHFFFAOYSA-N	441.849	1.274	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@@H](C)CNC(=O)OC(C)(C)C	794780504	LMNOCFKZVOADSW-NSHDSACASA-N	427.527	1.210	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1ccc(F)cc1OCCC(F)(F)F	800592409	QWNWJNQXCUDISO-QMMMGPOBSA-N	430.380	1.247	50	20	IDGD	
C[C@@H](CCNS(=O)(=O)c1ccccc1)NC(=O)NNC(=O)COc1ccc(C#N)cc1	802528998	MZAAATNQXFPIGW-HNNXBMFYSA-N	445.501	1.025	50	20	IDGD	
CCCCc1ccc(NC(=S)NNC(=O)C2CCN(S(=O)(=O)NC)CC2)cc1	803151587	DSYJWTFLRJFJAM-UHFFFAOYSA-N	427.596	1.523	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2c(C)nn(Cc3ccccc3)c2N)n1	803934615	OLMNBMSXRCWZDS-UHFFFAOYSA-N	442.501	1.134	50	20	IDGD	
CCCN(NC(=O)c1ccc2c(c1)S(=O)(=O)N(CCOC)C2=O)C(=O)OC(C)(C)C	804593798	VAYUHGIHBIELRQ-UHFFFAOYSA-N	441.506	1.769	50	20	IDGD	
COc1ccc(CN2CC[C@H](NC(=O)NNC(=O)c3ccccc3F)C2=O)c(OC)c1	805388837	LDEUDRZKEYKYKJ-KRWDZBQOSA-N	430.436	1.588	50	20	IDGD	
CCN(CC)CC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2ncccc2C)c1	806978554	AJXOUJCIPBQXEL-UHFFFAOYSA-N	426.477	1.070	50	20	IDGD	
CN1CCN(C(=O)NNC(=O)c2c[nH]c3c(Cl)cc(Br)cc3c2=O)CC1	807383230	QLCKGCKECRKNGZ-UHFFFAOYSA-N	442.701	1.546	50	20	IDGD	
CC(C)Cc1ccc([C@@H](CNC(=O)NNC(=O)C(=O)Nc2ccccn2)N(C)C)cc1	807601935	QNFQPWAHMOGNBR-GOSISDBHSA-N	426.521	1.852	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)NCc2ccccc2S(N)(=O)=O)c1	807605023	HQZPRZNTUSWFDU-UHFFFAOYSA-N	434.518	1.675	50	20	IDGD	
Cn1nncc1NC(=O)C(=O)NNC(=O)c1ccc(COc2ccc(Cl)cc2)cc1	810385638	WWPPMRZSORLSFF-UHFFFAOYSA-N	428.836	1.447	50	20	IDGD	
N#Cc1ncn(-c2ccccc2NC(=O)C(=O)NNC(=O)c2cccc(OC(F)F)c2)n1	810387172	JAVCKADHIJFIKN-UHFFFAOYSA-N	441.354	1.140	50	20	IDGD	
CSCc1cccnc1C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	810593198	VALPHTHUVLGBDI-UHFFFAOYSA-N	427.530	1.164	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)Nc2cccc(N3C(=O)CNC3=O)c2)cc1	812313484	HNVWGUQSZGZQRE-UHFFFAOYSA-N	432.462	1.142	50	20	IDGD	
CCOC(=O)c1ccc(NNC(=O)Cn2c(=O)ccn(Cc3ccccc3)c2=O)cc1C	812721716	BISWPTIXEOKUDN-UHFFFAOYSA-N	436.468	1.687	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)[C@@]3(C(F)(F)F)CCN(C(=O)OC(C)(C)C)C3)nc21	813451905	FNHJPTBJCPZABJ-MRXNPFEDSA-N	445.402	1.702	50	20	IDGD	
CCn1nncc1C(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccc(C)cc2C)c1	814698815	UJILZGIJTLHDRS-UHFFFAOYSA-N	442.501	1.790	50	20	IDGD	
CC(=NNC(=O)c1cc(-c2ccccc2)on1)c1ccc(S(=O)(=O)CC(N)=O)cc1	814789800	CHNDYEQDSFDSFI-UHFFFAOYSA-N	426.454	1.755	50	20	IDGD	
CC(C)(C)c1csc(NC(=O)C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c1C#N	815568112	VMCPKAFMQUEMAH-UHFFFAOYSA-N	448.526	1.720	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)cc1)C1CC1	815568464	ISIMLVSDXZHYJG-UHFFFAOYSA-N	430.848	1.961	50	20	IDGD	
CC(C)c1ccc(-n2c(NNC(=O)CCn3ncn(C)c3=O)nc3ccccc3c2=O)cc1	815604275	JKQNRQLYHPFSPN-UHFFFAOYSA-N	447.499	1.938	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)C(=O)Nc2ccc(C(N)=O)c(C)c2)c1	815866211	STHVHYJSJSWQIY-UHFFFAOYSA-N	449.261	1.725	50	20	IDGD	
COC(=O)c1cc(NNC(=O)c2ccc(OC)c(S(=O)(=O)NC3CC3)c2)ccc1C	816687515	CNMYQAOPJIQGGU-UHFFFAOYSA-N	433.486	1.988	50	20	IDGD	
O=C(NNc1ncncc1F)c1cccc(S(=O)(=O)NCc2ccc3c(c2)OCO3)c1	817081882	LFWUCHLDACBBRJ-UHFFFAOYSA-N	445.432	1.580	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)[C@H]1CCCN1C(=O)c1ccccc1OC(F)F	819727551	HGCIEQPLHHIGCG-CQSZACIVSA-N	443.447	1.829	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)[C@H](CC(C)C)N2C(=O)[C@H]3CC=CC[C@@H]3C2=O)c1	825791648	ROKRNGPEHSPRQF-FHWLQOOXSA-N	442.516	1.620	50	20	IDGD	
O=C(COC(=O)C1(c2ccc(Cl)cc2)CC1)NNC(=O)[C@H]1COc2ccccc2O1	845030520	VFZCWXWOFIGLJF-QGZVFWFLSA-N	430.844	1.902	50	20	IDGD	
CNS(=O)(=O)c1ccc(CNC(=O)/C(C#N)=C\c2cc(C)n(CCOC)c2C)s1	914755569	GQJLIRFBEJHPND-YBEGLDIGSA-N	436.559	1.944	50	20	IDGD	
C[C@@H]1CN(c2ccc(C(=O)NNC(=O)c3nn(-c4ccccc4)cc3O)cn2)C[C@@H](C)O1	914865279	LVWCMEGOBIBIJN-HUUCEWRRSA-N	436.472	1.661	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)c1cc(Cl)ccc1I	915279512	LYMFBSQYERMZGN-ZETCQYMHSA-N	442.662	1.140	50	20	IDGD	
CC(C)[C@@H](CNC(=O)NNC(=O)CCSc1ccc(F)cc1)N1CCN(C)CC1	916257935	HGSBXXIECRKPCM-GOSISDBHSA-N	425.574	1.910	50	20	IDGD	
O=C(Cc1ccc(Cl)cc1)NNC(=O)NCCCN1C(=O)NC2(CCCCC2)C1=O	916268782	QSISJTWZHNDSEC-UHFFFAOYSA-N	435.912	1.858	50	20	IDGD	
N#Cc1ccccc1OCc1ccc(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)o1	917925359	KJCNWCAODCWSCR-UHFFFAOYSA-N	429.396	1.781	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CC(F)(F)F)cc1S(=O)(=O)NCc1ccccn1	918366906	YOSUQLUOSPVYSJ-UHFFFAOYSA-N	446.407	1.282	50	20	IDGD	
CNS(=O)(=O)c1ccc([C@H](C)NC(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)cc1	919779407	RLKVRHBOSJSOGB-QWHCGFSZSA-N	438.481	1.593	50	20	IDGD	
O=C(NCCS(=O)(=O)c1ccc(Cl)cc1)NNC(=O)c1ccc([N+](=O)[O-])cc1	919785624	FOIHZQZSEJWAKW-UHFFFAOYSA-N	426.838	1.666	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(OCC2CCCCC2)cc1)N[C@H]1CCS(=O)(=O)C1	919960751	GQQKVWFGLFWHNS-HNNXBMFYSA-N	445.563	1.325	50	20	IDGD	
C=CCNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2ccc(CN(CC)CC)o2)cc1	920248677	ODQYCYKMRNEWAQ-UHFFFAOYSA-N	434.518	1.661	50	20	IDGD	
CC(C)NC(=S)NNC(=O)CNC(=O)[C@H]1c2ccccc2C(=O)N1Cc1ccccc1	1318160150	GYMQINYMSCGQGW-LJQANCHMSA-N	439.541	1.404	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2cccc(S(=O)(=O)N3CCN(C)CC3)c2)cc1	1321023594	NZNNUKGPGJRBTM-UHFFFAOYSA-N	447.517	1.098	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H]2CCCC[C@H]2N(C)C)c1	1322740634	OBSHKAPNEIXPRP-ZWKOTPCHSA-N	439.582	1.534	50	20	IDGD	
NC(=O)[C@@H]1CCCN(c2ccc(C(=O)NNC(=O)c3cncn3-c3ccccc3)cc2)C1	1324034096	LYMOMILPNGTWGA-QGZVFWFLSA-N	432.484	1.649	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc[nH]c3nccc2-3)C1	1777895838	RBOZTLAIFROTMZ-CSODHUTKSA-N	434.924	1.896	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(CCN(C(=O)c3cccc4c3NC(=O)C4=O)C2)C1	1778710653	FYIDJCVOXBHNBZ-OAQYLSRUSA-N	445.548	1.116	50	20	IDGD	
CO/C=C(\C)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2	1778838640	SXJPYCNUXNSUPW-WKCQWVKWSA-N	445.944	1.499	50	20	IDGD	
CCCC(=O)N[C@H](C)C(=O)N1CC[C@]2(CN(C(=O)[C@H](C)CBr)CCO2)C1	1779250219	QLWAYXXMTJGOMN-HBUWYVDXSA-N	432.359	1.152	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@]2(C1)CN(C(=O)c1sc3nccnc3c1N)CCO2	1779295938	GQSAXNFCFZPIDO-IBGZPJMESA-N	449.609	1.569	50	20	IDGD	
CCC(=O)N[C@@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CO[Si](C)(C)C)C1	1779539899	PZJPCZZXXAJCRB-RZQQEMMASA-N	427.618	1.267	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccnc(OC)c2)C1	1779722787	WAAWPPXDNDTBSU-JXXFODFXSA-N	425.913	1.472	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cn(C(C)(C)C)nn3)C2)C1	1780355934	CJNOUQGXUYPWDQ-SJKOYZFVSA-N	428.331	1.260	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Cl)C2)c1cccc(-n2cncn2)c1	1781124969	SWYJEZLDAAPJRS-MBOZVWFJSA-N	435.887	1.929	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)CNC(=O)c3ccco3)CCO2)C1	1781226845	BASXCGVSBUKXIU-MSOLQXFVSA-N	432.304	1.076	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)CCc3ccc(O)nn3)CCO2)C1	1781233717	YRNULGCCOYFISH-ROUUACIJSA-N	431.320	1.181	50	20	IDGD	
C=C(C)CC(C)(C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCC(=O)NN(C)C)C1	1782215060	QGRJUVZUNJPSSZ-WZONZLPQSA-N	436.597	1.866	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)Cc3ccc(Cl)cc3OC)C2)C1	1782904046	NJSISZVMEJYGFM-OXJNMPFZSA-N	445.343	1.975	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cccn(C)c3=O)CCO2)C1	1783344351	STXUSJBFTFSPSS-KBXCAEBGSA-N	426.311	1.002	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)Cc3cccc(Cl)n3)CCO2)C1	1783531691	BBLSCCRKWUIZQG-SJKOYZFVSA-N	430.730	1.891	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cccnc3OCC3CC3)CCO2)C1	1783873350	NYEBBONCBRDHGK-UWJYYQICSA-N	437.924	1.568	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(C1)CN(C(=O)C(C)(C)Oc1ccc(C)cn1)CCO2	1783883731	YFOXDJAFPXZPRT-HRAATJIYSA-N	439.940	1.631	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C/N=C/c3ccco3)C[C@@H]21	1783966469	FROLDSQBAOMNIY-XZEUKZFCSA-N	440.338	1.709	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3c[nH]c4ccccc34)C[C@@H]21)[C@@H](O)CCl	1784089585	GIKZKTRHQGQUHT-UHMOLFJZSA-N	433.936	1.680	50	20	IDGD	
Cc1noc(C)c1CC(=O)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1	1786717477	MQCBEYOGFRDQTK-UHFFFAOYSA-N	447.300	1.962	50	20	IDGD	
Cc1nnc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)Br)C[C@@H]32)s1	1787058368	HBPBRIIOLQHYRA-BQUFFADESA-N	431.356	1.152	50	20	IDGD	
CCc1cc(C(=O)NC2(c3ccc(NC(=O)c4ccc(B(O)O)cc4)cc3)CCC2)nn1C	1788142105	AKCNZVIRRMFNNJ-UHFFFAOYSA-N	446.316	1.724	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4ccccn4n3)C[C@@H]21	1788762772	WJQLPLDZPAWWIH-IEZWGBDMSA-N	430.581	1.779	50	20	IDGD	
COc1cncc(CCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]3C2)c1	1788765239	KUNJQNPCCSTGFH-IHPCNDPISA-N	449.624	1.854	50	20	IDGD	
Cc1cnc(C(=O)NC2(c3ccc(NC(=O)c4cnccc4C(=O)NN)cc3)CCC2)cn1	1789521096	GAIPFTDHMYSAOI-UHFFFAOYSA-N	445.483	1.845	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)NC(=O)OC(C)(C)C)C[C@@H]21	1789859083	AOANLWJWVWXQOO-GVRJEKJASA-N	431.961	1.897	50	20	IDGD	
Cc1cc(CCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]3C2)ccn1	1789922260	JJRGPESWLOWDCD-NBOOPKSLSA-N	442.329	1.993	50	20	IDGD	
COC(=O)[C@@H]1CC[C@H](C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](C)Br)[C@H]3C2)C1	1791055195	NMZRHUMLJXYEAQ-IATJYDTKSA-N	445.354	1.339	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]21	1791060335	BNFSUOHBMXYFBT-IAGXKZSMSA-N	430.170	1.986	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4sccn4c3)C[C@@H]21	1791254812	SRNINRWIWAIXFS-TUUVXOQKSA-N	425.938	1.848	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1ccc(C2(NC(=O)CCN3CCOC3=O)CCC2)cc1	1791601760	WTKYIHNDPMXBBZ-UHFFFAOYSA-N	445.520	1.336	50	20	IDGD	
C[C@@H](Cn1ccnc1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]21	1791628392	NNQOXDQCFOCZJZ-GMHRPJKWSA-N	431.364	1.735	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)n3cccn3)[C@H]2C1	1791640559	VQZNVMOMOOJIML-YXMSTPNBSA-N	427.343	1.455	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ncc(Cl)cc1Cl	1792414493	MRRRKHYIWRHSND-DJBIQUGXSA-N	436.723	1.845	50	20	IDGD	
COC(=O)[C@@H]1CC[C@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)CBr)C1	1792868560	FFKSYDZZDGFYFQ-KLOLGFOXSA-N	445.354	1.196	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(=O)C1CC1	1792901746	MMPNLRWTSRVDKN-AONCJLBWSA-N	429.423	1.440	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)C1CCC(C(F)(F)F)CC1	1793681388	KQGINKDFVKYPQM-AUJGNRQJSA-N	426.863	1.544	50	20	IDGD	
CN(CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1CCC1)NC(=O)NCc1ccccc1	1795398375	GGQSPKVELMRRHR-ACDBMABISA-N	427.549	1.771	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1noc2c1CCCC2	1796154642	CSOLLYPUEMLDTC-CVGJEZRXSA-N	430.332	1.993	50	20	IDGD	
Cn1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)c(C(F)(F)F)c1	1796189302	VVOHGSNNXFLDHA-MUJYYYPQSA-N	449.238	1.289	50	20	IDGD	
CCOC(=O)[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](F)Cl	1796811515	RTZMEVUVBJVNBJ-XVIXHAIJSA-N	449.907	1.615	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCc1cnccn1)C2	1796893222	SSLRTXYXEKPORS-MVUGMWCJSA-N	437.504	1.181	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1=NO[C@@H](c2ccccc2)C1	1797176143	DTZDUGVPVLNGRM-SHJAMOMRSA-N	445.592	1.945	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc2nccnc2c1	1797590455	OLZUYJGNYPIFGH-MUJYYYPQSA-N	445.483	1.194	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc3ncncc3c1)C2	1798440568	QJYVKQPGCWEGNX-BJWYYQGGSA-N	445.483	1.194	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccnn1	1798735735	WYCAYMOPJVJPSD-FQLMCAECSA-N	437.928	1.861	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CC[C@@H]2CCC(=O)N2C1	1799152862	PHQHRCOLNVPQME-FJANGAQTSA-N	425.957	1.385	50	20	IDGD	
COc1cc(F)ccc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Br	1799351989	HCJHMEPRXIJOEV-ANGCBRKESA-N	433.249	1.728	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](F)Br)n1	1800157719	UHOCAVLDFNMUEN-OXIQGZBJSA-N	427.274	1.982	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](O)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](F)Br)C2	1800599648	ARCRZRMMSOTYRB-TUTUZKQUSA-N	438.294	1.158	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1(Br)CC1)C2	1800642508	MAVNMFRAEPIHAK-USZNOCQGSA-N	438.160	1.677	50	20	IDGD	
CCOC(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](Br)CC)OCC	1800644452	UMMMBCHXJSGLEZ-UMPJEAMMSA-N	435.359	1.539	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCn1nc(C)cc1C)C2	1800644532	ZLOLCCMBTIKFIC-KYHPRHEASA-N	441.370	1.653	50	20	IDGD	
CCc1[nH]nc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)Br)c1Cl	1800756983	SJTPFVRSLWYYFI-ORXSELOVSA-N	433.734	1.612	50	20	IDGD	
Cc1cc(C)n(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@](C)(Cl)CCl)C3)n1	1801247346	BGJOZIVPXFKZPM-LORHWOILSA-N	431.364	1.716	50	20	IDGD	
COc1ccc(F)cc1CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCC(=O)NN(C)C)C2	1802504416	VPLYJSOKHIZIRT-BCDXTJNWSA-N	434.512	1.388	50	20	IDGD	
C[C@H](Oc1cccnc1)C(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]1c1cccnc1	1803145848	JCATXGOKJPQKRB-RGIVZKHGSA-N	432.908	1.550	50	20	IDGD	
COc1ccc(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CCC(=O)NN(C)C)C3)cc1F	1803214180	JMXZRCJMIXWZKM-BJWYYQGGSA-N	434.512	1.388	50	20	IDGD	
Cc1ccn(CC(=O)NC[C@@H]2CCN(C(=O)[C@H](F)Br)[C@@H]2c2cccnc2)n1	1804623853	RBXOOJXXJSTNBY-UAGQMJEPSA-N	438.301	1.983	50	20	IDGD	
COC(=O)[C@H]1CC[C@H](C(=O)N2CCC3(CCCN(C(=O)[C@@H](O)CCl)C3)CC2)CC1	1805517523	JBQTYPOHOVUQST-ULQDDVLXSA-N	428.957	1.797	50	20	IDGD	
CC(=O)NC(C)(C)C(=O)N1CC[C@H](CNC(=O)CCBr)[C@H]1c1cccnc1	1806341706	FGLUAQOZZIHGIM-NVXWUHKLSA-N	439.354	1.787	50	20	IDGD	
COCCOCC(=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@H]1c1cccnc1	1806760165	ZTHWBICUOAMQSE-CWRNSKLLSA-N	432.290	1.441	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)C(C)(F)F)[C@H]1c1cccnc1	1806961710	MORFHRSPFFZUOX-PSOMGPDVSA-N	446.458	1.877	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)[C@H]1CNc2ccccc21	1807173027	WWTGRILYFVVBBX-SMMRIJLZSA-N	428.920	1.896	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)CNC(=O)c2cccnc2)[C@H]1c1cccnc1	1808252173	ZHUFPVVKNIBPRL-KPFFTGBYSA-N	443.935	1.930	50	20	IDGD	
Cc1cncc(C(=O)N2CCCC3(CCN(C(=O)c4cnccc4C(=O)NN)CC3)C2)c1	1808479947	MPBNBLDTODIHIK-UHFFFAOYSA-N	436.516	1.547	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc[n+]([O-])c2)[C@@H]1c1cccnc1)[C@H](F)Br	1808650674	BZOQRVOBQWOJBZ-IMJJTQAJSA-N	437.269	1.725	50	20	IDGD	
N#Cc1ccc(C(=O)N2CCC3(CCCN(C(=O)c4ccc(B(O)O)cc4)C3)CC2)cc1	1809969316	CNQMOHHHBCQLOP-UHFFFAOYSA-N	431.301	1.397	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)C(F)(F)c3ccco3)CC2)C1	1809979988	JPQJBUICWQRNBD-UHFFFAOYSA-N	446.259	1.596	50	20	IDGD	
Cc1cc(C)nc(C(=O)N2CCCC3(CCN(C(=O)c4ccc(B(O)O)cc4)CC3)C2)c1	1810326870	DEOFAZYPDUIMTD-UHFFFAOYSA-N	435.333	1.537	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@H]1CCN(C(=O)Cc2ncccn2)[C@H]1c1cccnc1	1810540425	NJYSGSTWPBRQGY-UTKZUKDTSA-N	427.581	1.972	50	20	IDGD	
Cn1nc2c(c1C(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)CCC2	1812223304	SZXFYNSBTLBSOZ-BMGDILEWSA-N	431.924	1.223	50	20	IDGD	
C#CCCCCC(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1	1813227812	XXOHFRDPLOGNDZ-AVRDEDQJSA-N	448.527	1.593	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)C[C@@H](NC)C(=O)O)sc2C1	1815087495	YXTRWHXUCRCSQK-WCABBAIRSA-N	447.355	1.291	50	20	IDGD	
CC(C)[C@@H](S)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1	1817470233	MYWMFPDAPLODTH-FUHWJXTLSA-N	430.339	1.350	50	20	IDGD	
C[C@@H]1CC[C@H](C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cnccc3C(=O)NN)n[nH]2)O1	1819402786	LGOGFPTUKIGYAB-OAUYIBNBSA-N	441.492	1.282	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)[C@H](O)CCl)[nH]n2)cc1O	1821355977	PUYXNQYENZFFFM-NVXWUHKLSA-N	449.895	1.979	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)c3c[nH]c(=O)cn3)sc2C1	1821474679	VEMOSNRAQHPEHM-HTQZYQBOSA-N	426.296	1.236	50	20	IDGD	
C=CCNC(=O)/C=C\C(=O)N[C@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1	1822998444	DICRASAPZYDOJE-FAYRYBEVSA-N	445.314	1.604	50	20	IDGD	
Cc1c(C(=O)N2CCC([C@@H]3CCCCN3C(=O)[C@@H](O)CCl)CC2)cn2[nH]cnc(=O)c12	1824186614	UGUKORUIZSCDAS-IRXDYDNUSA-N	449.939	1.164	50	20	IDGD	
Cc1ccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)cn1	1825813901	SKDRLVHKVUJUIN-QFIPXVFZSA-N	435.333	1.617	50	20	IDGD	
Cc1cncc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)c1	1826002932	HDDWMVLNQVTEAM-QFIPXVFZSA-N	435.333	1.617	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](C)Cn1ccnc1)CC2	1826008710	GAKSCWBCYZECDH-UPJWGTAASA-N	425.942	1.842	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CC[C@H](N)C(N)=O)CC1	1826938287	SPQZQFFOMMEKRI-JYJNAYRXSA-N	445.402	1.372	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1	1829102252	MAWBUKKAJITYQR-FQEVSTJZSA-N	446.429	1.451	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc([N+](=O)[O-])o1)CCO2	1829485714	UROAELCVOZJPML-GOSISDBHSA-N	441.513	1.109	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc([N+](=O)[O-])o1)CCO2	1829485715	UROAELCVOZJPML-SFHVURJKSA-N	441.513	1.109	50	20	IDGD	
O=C(CCBr)N1CCC([C@H]2CCCCN2C(=O)c2c[nH]c(=O)cn2)CC1	1829713739	RNYJRLGRHFKVGC-OAHLLOKOSA-N	425.327	1.788	50	20	IDGD	
CN[C@H](CC(=O)N1CCC([C@H]2CCCCN2C(=O)[C@H](C)Br)CC1)C(=O)O	1831649556	BOQJVJMAHPMCHU-NWANDNLSSA-N	432.359	1.452	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CSc2nc[nH]n2)CC1	1831838064	YOMPYYSCBVNOLB-HUUCEWRRSA-N	429.974	1.770	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H]2[C@H]3C=CS[C@@H]32)CC1	1831874575	KIBKVHSDCKIKPO-DGQTTZFYSA-N	434.606	1.854	50	20	IDGD	
Cc1cncc(CCC(=O)N2CCO[C@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)c1	1832958958	MQBVJQNVVREAOY-JOCHJYFZSA-N	449.624	1.631	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](C)C3(O)CCC3)CC2)CC1	1833069004	BKYYFMQZFUOPEF-CABCVRRESA-N	444.414	1.893	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)C(F)(F)c3ccco3)CC2)CC1)[C@@H](O)CCl	1833312558	XIWZPRUPZIGJIO-HNNXBMFYSA-N	433.883	1.543	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H]3CCc4ccccc43)CC2)CC1)[C@@H](O)CCl	1833313121	WROIXTMTMDYJRK-SFTDATJTSA-N	433.980	1.888	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3coc(C)n3)CCO2)C1	1834213985	XQTVKCSRLZJOFO-DYVFJYSZSA-N	430.299	1.227	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3scnc3C)CCO2)C1	1834269414	YKCVVYGCFPYFGE-GUYCJALGSA-N	446.367	1.695	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)c3ccc(F)cc3)C2)C1	1834824216	XPZASIOUDCLAJY-GOSISDBHSA-N	429.286	1.681	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccccc3)CCO2)C1	1834997804	NYPJUAHCJUVCEG-VQTJNVASSA-N	429.344	1.922	50	20	IDGD	
Cc1nc(F)ccc1C(=O)NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1836028261	NWGYRBIZRGMHOA-KRWDZBQOSA-N	426.920	1.314	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCC(OC2CCN(C(=O)c3cnc(O)nc3O)CC2)CC1	1836623558	RGRJWGXLYMAVMR-UHFFFAOYSA-N	440.928	1.765	50	20	IDGD	
Cc1ccn(C)c1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)Br)C2)C1	1838822086	AYSDBHIWEXJJAO-KBXCAEBGSA-N	428.327	1.187	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(N(C)C)cc3)CCO2)C1	1838964306	YRXKZEVSQYVFRZ-RXVVDRJESA-N	439.940	1.076	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccn(C(C)(C)C)n3)C2)C1	1839143144	MMLMVCAWOLNNOV-QRWLVFNGSA-N	426.945	1.726	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccs3)C2)C1	1839963194	CXTMGFIEPMKARF-DYVFJYSZSA-N	431.352	1.992	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)ccc1O	1840035559	VUZWCMVAVDMLOJ-AUUYWEPGSA-N	441.322	1.554	50	20	IDGD	
Cc1c[nH]c(C)c1CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840186775	OXGOXWQHEAERSG-IBGZPJMESA-N	432.348	1.824	50	20	IDGD	
O=C(c1cc2ccccn2n1)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840187608	NCWZIVKFYAARRF-SFHVURJKSA-N	427.288	1.208	50	20	IDGD	
COc1c(Cl)cccc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1840739588	OABSBVUAPMWTLL-MAUKXSAKSA-N	435.279	1.953	50	20	IDGD	
O=C(c1cc(Br)cc2[nH]ncc12)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1	1841350999	DGTIMDVGYLYJAK-AWEZNQCLSA-N	441.713	1.742	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)C2=CCN(C(=O)OC(C)(C)C)C2)C1	1841521415	QVHXHNIMNHGITC-HNNXBMFYSA-N	427.929	1.621	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)Cc1cccc(F)c1F)C2	1843417033	PUDXDIWYZIXKEW-VULFUBBASA-N	443.454	1.845	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)c1cnc(N)s1)C2	1844692411	UMVXXUINRVRTJN-UHFFFAOYSA-N	445.457	1.690	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)C1(CNC(=O)OC(C)(C)C)CC1	1847302397	NEVFHEZSHJJUIC-KKUMJFAQSA-N	429.945	1.747	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](O)CCl)C[C@@H]2C[C@@H]21	1847558220	JESFOQQMYHZWSY-QNILMXGZSA-N	427.929	1.186	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CSc1ccncc1	1848133912	DVPGXORTXCEGHX-LUZZDJJGSA-N	440.529	1.510	50	20	IDGD	
CCOC(=O)Nc1ccc(C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1	10702473	JWNNAMNGWFFVDT-UHFFFAOYSA-N	430.373	1.781	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=S)NCCc2cccs2)cc1	11509652	ZPPUKRXODULPQD-UHFFFAOYSA-N	426.589	1.415	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)C2CCN(S(=O)(=O)c3ccccc3)CC2)cc1	15888675	CFBQIXBTESZBCR-UHFFFAOYSA-N	442.497	1.185	50	20	IDGD	
Cc1ccc(C)c(C(=O)CCC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1	16594285	BROXFKQEXKSNOD-UHFFFAOYSA-N	431.514	1.978	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)[nH]c2c1C(=O)CC(C)(C)C2	24501649	NYZONCYSJISLJA-UHFFFAOYSA-N	446.529	1.803	50	20	IDGD	
COc1ccc2nc(C)c(C(=O)NNC(=O)c3csc(N4CCOCC4)n3)cc2c1	25955517	ACKLYCQFVQSTJY-UHFFFAOYSA-N	427.486	1.920	50	20	IDGD	
CN(C[C@@H]1OCCc2ccccc21)C(=O)NNC(=O)c1csc(N2CCOCC2)n1	725860633	SBCXFYDNNVYZDK-KRWDZBQOSA-N	431.518	1.580	50	20	IDGD	
CC(C)[C@H](NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)c1nc(C2CC2)no1	727943770	OOBOLYKFKZECLF-AWEZNQCLSA-N	425.449	1.535	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	728212721	AUKPYJASYYVMMC-HNNXBMFYSA-N	436.509	1.672	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)CN2C(=O)[C@@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2=O)c1	728528989	QMYSBZLCXRSZKN-VCXDHIOWSA-N	448.273	1.026	50	20	IDGD	
CS(=O)(=O)Cc1ccc(CNC(=O)NNC(=O)c2cccc(OC(F)F)c2)cc1	728597821	UARBEEGRRPAMGP-UHFFFAOYSA-N	427.429	1.977	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)c1	728747645	MAILKPRPVWMCEB-UHFFFAOYSA-N	431.287	1.926	50	20	IDGD	
N#Cc1ccc(CN2CCCN(C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)CC2)cc1	728944345	AGEXXJAMCZMMNK-UHFFFAOYSA-N	445.487	1.096	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)C2(C(=O)NC3CC3)CCC2)c2ccccc2c1=O	729299206	DDEJZTWGJHPSOD-UHFFFAOYSA-N	439.516	1.797	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H]1CNC(=O)NNC(=O)CNC(=O)c1cccs1	730826379	JTZHXUDYRZUAJB-LBPRGKRZSA-N	425.511	1.208	50	20	IDGD	
Cc1cc(C)cc(C(=O)N2CCC[C@H](C(=O)NNC(=O)CCN3C[C@H](C)O[C@@H](C)C3)C2)c1	732264732	WLVYEQQCXSDDFL-UFYCRDLUSA-N	444.576	1.802	50	20	IDGD	
CC[C@H]1CCCN(C(C)(C)CNC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)C1	732469767	PJDFWBMXXKHCPT-HNNXBMFYSA-N	428.537	1.778	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)NCC1CCN(S(=O)(=O)C(F)F)CC1	732995471	MWPYSGRLSRPDJU-UHFFFAOYSA-N	443.476	1.236	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)[C@@H]1CCCC[C@H]1C(=O)N1CCCC1	734241594	RIXBEQUMMKGIRA-HUUCEWRRSA-N	425.530	1.270	50	20	IDGD	
CCc1nc(COc2ccc(C(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)cc2)no1	734416927	FEBIZVCLNROEGR-UHFFFAOYSA-N	448.439	1.533	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)c1cc(C(N)=O)n(-c2ccccc2)n1	735028772	OLLUPZRIBABNCD-UHFFFAOYSA-N	431.456	1.345	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc(Br)cc1)NNc1ccc(Cl)nn1	735688624	DUSSCQNEIGKVPT-UHFFFAOYSA-N	434.703	1.704	50	20	IDGD	
CN(C)C(=O)Nc1cccc(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c1	739675517	CUILGIUAHZIHDH-UHFFFAOYSA-N	438.532	1.753	50	20	IDGD	
CC(=NNC(=O)N[C@@H]1CCS(=O)(=O)C1)c1ccc(S(=O)(=O)CC(F)(F)F)cc1	741762972	XYUVHRBHEOLDFE-GFCCVEGCSA-N	441.453	1.233	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cn(Cc3ccccn3)nn2)cc1Br	742662435	JRKYYVKVSQYXDL-UHFFFAOYSA-N	431.250	1.567	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)cc1	743831534	YZQSUQAANFAAOT-UHFFFAOYSA-N	444.429	1.651	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)N[C@H]1CC(=O)N(CCOc2ccccc2)C1	745845798	AIJZUVSKASOCJG-RDJZCZTQSA-N	444.463	1.603	50	20	IDGD	
C[C@H]1C[C@H](NC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)C(=O)N1c1ccccc1	745881705	LDMVUSPFLMXTFI-YOEHRIQHSA-N	434.456	1.716	50	20	IDGD	
C#CCCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccc(OC)cc2)c1	745900089	XCCCWLOPJZMQAP-UHFFFAOYSA-N	430.486	1.853	50	20	IDGD	
O=C(NNC(=O)[C@H]1CN(Cc2nc(O)c3ccccc3n2)CCO1)c1ccccc1F	746013503	FAGYMAFGMYBLDF-QGZVFWFLSA-N	425.420	1.137	50	20	IDGD	
NC(=O)CC[C@@H](C(=O)NNc1ccc(Cl)cc1[N+](=O)[O-])N1C(=O)c2ccccc2C1=O	746129547	JQCPDEKTVGQUAU-AWEZNQCLSA-N	445.819	1.622	50	20	IDGD	
COC(=O)[C@H]1CCC[C@H](C(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)C1	746272515	UFPXNJYOURKITR-KBPBESRZSA-N	426.514	1.696	50	20	IDGD	
CC(=NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)c1ccc(NS(C)(=O)=O)cc1	747040228	FKVNDXCPNGWXKZ-UHFFFAOYSA-N	438.531	1.462	50	20	IDGD	
COc1ccc(Br)cc1C(=O)CCC(=O)NNC(=O)C(=O)N1CCCC1	748246178	HIIQNXPDUYDLLR-UHFFFAOYSA-N	426.267	1.190	50	20	IDGD	
C[C@@H](c1ccncc1)N1CCC(NC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])CC1	749221347	GFNJXKVHSNWVBW-HNNXBMFYSA-N	442.476	1.925	50	20	IDGD	
C[C@@H](Cc1ccncc1)NC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	749617674	AMRPWVFUZDKKQN-HNNXBMFYSA-N	431.518	1.441	50	20	IDGD	
COC(=O)c1ccc(N2CCN(CC(=O)NNC(=O)c3ccc(F)cc3)[C@H](C)C2)cc1	749914710	NFXVGVGHCAGYOJ-OAHLLOKOSA-N	428.464	1.584	50	20	IDGD	
O=C(NNC(=O)c1ccc(Br)cc1[N+](=O)[O-])c1ccc(-n2cnnn2)cc1	750982801	BZPVKUUROXDJCG-UHFFFAOYSA-N	432.194	1.408	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)CNC(=O)c1cccs1)n1nnc(-c2ccc(Cl)cc2)n1	751208646	HMDCKFUQYGJQBL-ZDUSSCGKSA-N	447.908	1.584	50	20	IDGD	
Cn1cnc2cc(C(=O)NNC(=O)c3cccc(S(=O)(=O)N4CCCC4)c3)ccc21	752996572	JHHHAOCHRCEYFL-UHFFFAOYSA-N	427.486	1.433	50	20	IDGD	
Cc1ccc(C(=O)NNS(=O)(=O)c2cc(S(=O)(=O)N3CCCCC3)ccc2C)o1	753083453	ONWGMFGLCDVRLQ-UHFFFAOYSA-N	441.531	1.694	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)NC[C@H]2CCN(S(C)(=O)=O)C2)c(C)n1-c1ccccc1	753673283	YKPFOGYMAAWJDG-MRXNPFEDSA-N	433.534	1.320	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)[C@@H](C)CS(=O)(=O)c1ccc(F)cc1	755048179	DOGNUOLWMRYDGP-STQMWFEESA-N	426.441	1.990	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)Nc1ccc(C(=O)N2CCOCC2)cc1	755933382	KWFVBESQGCEOIQ-CQSZACIVSA-N	430.436	1.918	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1cccc(COCC(F)(F)C(F)F)c1	755965363	YJXXUTSPKNHDOR-SECBINFHSA-N	444.407	1.194	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)Nc1cccc(OCCS(C)(=O)=O)c1	756298398	WXIIPNNGZQXCQE-UHFFFAOYSA-N	431.474	1.533	50	20	IDGD	
COc1c(Br)cc(Cl)cc1NC(=O)NNC(=O)[C@H](C)NS(C)(=O)=O	756430222	JWJIDTAFVUMGIT-LURJTMIESA-N	443.707	1.202	50	20	IDGD	
CCc1ccc(NC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1S(N)(=O)=O	756526269	UCNQUMHISLNPOO-UHFFFAOYSA-N	428.474	1.549	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2ccc(OCC(C)C)nc2)cc1	756605479	IPBSNKUJAXRFRZ-UHFFFAOYSA-N	449.533	1.898	50	20	IDGD	
COC(=O)c1ccc(NC(=O)NNC(=O)COc2ccccc2C#N)cc1C(=O)OC	756817069	GPPFLMMUUBVVKC-UHFFFAOYSA-N	426.385	1.363	50	20	IDGD	
CCOC(=O)[C@@H](C)NC(=O)c1ccc(NC(=O)NNC(=O)c2ccccc2O)cc1F	756818238	MSTSJMMMMDNFBI-LLVKDONJSA-N	432.408	1.679	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1cccc(Oc2ccc(Cl)c(Cl)c2)n1	758026561	RIRYSLYCHNIZKG-VIFPVBQESA-N	447.300	1.879	50	20	IDGD	
O=C(NC[C@H](c1cccc(Cl)c1)N1CCOCC1)NNC(=O)C(=O)Nc1ccccn1	758748591	WIMUYTUEIDDOLJ-MRXNPFEDSA-N	446.895	1.077	50	20	IDGD	
COc1cc(OC)c2cc(CCCNC(=O)NNC(=O)C(=O)Nc3ccccn3)[nH]c2c1	758840044	RPOKKHAGYMNZBZ-UHFFFAOYSA-N	440.460	1.482	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)Nc1ccc(CN2C(=O)CCCC2=O)cc1	760957322	DMXDHJMPAACDPE-UHFFFAOYSA-N	438.440	1.963	50	20	IDGD	
CN(C)c1ccc2c(c1)NC(=O)C2=NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	761761257	XYNJQYCPNMYTNW-UHFFFAOYSA-N	441.513	1.623	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3c([N+](=O)[O-])c(C)nn3C)n[nH]2)cc1OC	763149138	OSZJGCLEEXVDFP-UHFFFAOYSA-N	429.393	1.119	50	20	IDGD	
Cc1ccc(S(=O)(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)c(C)c1C(=O)O	763439754	QSTITNVXRTWBJZ-UHFFFAOYSA-N	429.495	1.616	50	20	IDGD	
CC(C)(C)OC(=O)NCCOc1ccc(NC(=O)C(=O)NNC(=O)c2ccccn2)cc1	763466838	KZYJRQISQQIUGZ-UHFFFAOYSA-N	443.460	1.385	50	20	IDGD	
CCC(=O)Nc1ccc(Cl)c(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)c1	763674020	JZMUFIHKUFAETQ-UHFFFAOYSA-N	443.847	1.725	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccn(Cc2ccccc2)n1	763680561	GQOAIJBHCFZSNN-UHFFFAOYSA-N	437.456	1.495	50	20	IDGD	
C[C@@H](c1ccc(NC(=O)C(=O)NNC(=O)c2cccc(N(C)C)c2)cc1)N1CCOCC1	763759888	FXUOQTQFBBARGU-INIZCTEOSA-N	439.516	1.546	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)C(=O)Nc1ccc(OC2CCCC2)nc1	763790647	MHKLGTSGMOBHGM-UHFFFAOYSA-N	436.428	1.452	50	20	IDGD	
CCCNC(=O)[C@H]1CN(C(=O)C(=O)NNC(=O)c2ccc(CC)cc2)c2ccccc2O1	763831649	QRJLTMRMQZMACO-LJQANCHMSA-N	438.484	1.330	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cccc(N3CCNC3=O)c2)c1C	763841759	SSVLBWYLYYYYBW-OAHLLOKOSA-N	439.472	1.386	50	20	IDGD	
COC(=O)c1ccc(F)c(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)c1	763852259	GQHSJGRGXSQAMA-ZDUSSCGKSA-N	431.420	1.783	50	20	IDGD	
CN1CCOc2ccc(NC(=O)C(=O)NNC(=O)CCSc3ccc(F)cc3)cc21	763904362	ZCYWBYMXPNMEPC-UHFFFAOYSA-N	432.477	1.923	50	20	IDGD	
CCn1c2ccccc2c2cc(NC(=O)C(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)ccc21	764001753	FBCANUFROWRTCW-CYBMUJFWSA-N	442.497	1.335	50	20	IDGD	
Cc1ccccc1-n1nccc1NC(=O)C(=O)NNC(=O)c1cc(Br)cn1C	764004613	IYCYBQKZRLAMLJ-UHFFFAOYSA-N	445.277	1.681	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1cccc(NC(=O)[C@@H](C)OC)c1	764012566	SJJRMVDSIOZZJY-LLVKDONJSA-N	448.863	1.722	50	20	IDGD	
CCOC(=O)Cn1ccc2cc(NC(=O)C(=O)NNC(=O)c3ccccc3OC)ccc21	764041540	WSXPXXQGWPHZFC-UHFFFAOYSA-N	438.440	1.613	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)N1CCc2cc(Br)cc(F)c21	764043900	ZFMSVTKTZIJYAA-UHFFFAOYSA-N	436.237	1.947	50	20	IDGD	
C[C@@H](c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)cc1)N1CCOCC1	764127082	SUWLAKVASCYOMW-ZDUSSCGKSA-N	446.891	1.839	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C)cc2C(=O)OC)o1	764139475	UCSZSWVLSPSSTR-UHFFFAOYSA-N	430.461	1.616	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(N3CCN(CC4CC4)CC3)c2)cc1	764177214	LXKFHMKLSMMDAO-UHFFFAOYSA-N	446.511	1.490	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccnn2Cc2ccc(Cl)c(F)c2)cc1	764177421	NAQQSQKDXWXXFO-UHFFFAOYSA-N	440.822	1.995	50	20	IDGD	
COC(=O)CNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)CCC2CCCCC2)cc1	764209735	CSPMPBLCDJINDB-UHFFFAOYSA-N	432.477	1.036	50	20	IDGD	
C[S@](=O)Cc1cc(NC(=O)C(=O)NNC(=O)Cc2ccccc2F)ccc1Cl	764314372	VIOSYSSHVJNHNL-NDEPHWFRSA-N	425.869	1.686	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)C(=O)Nc1ccc(C)c(S(=O)(=O)N(C)C)c1)c1ccccc1	764330952	ZONOVJDBTCQCSZ-KRWDZBQOSA-N	446.529	1.525	50	20	IDGD	
O=C(CCn1c(=O)nc(O)c2ccccc21)NNc1c(F)cc(C(=O)NC2CC2)cc1F	764335373	URXCQSPRAIDGNB-UHFFFAOYSA-N	443.410	1.806	50	20	IDGD	
CCN1CCC[C@@H]1CNC(=S)NNC(=O)c1cc(-c2ccc(OC)c(OC)c2)[nH]n1	764500036	JIVUWOCCUVALLJ-CQSZACIVSA-N	432.550	1.687	50	20	IDGD	
CC(=NNC(=O)CSc1nnc(O)nc1O)c1ccc(N2CCOCC2)cc1Cl	764676898	VFWNSGXJQUYINZ-UHFFFAOYSA-N	438.897	1.405	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NN=Cc3ccc(-n4cncn4)c(F)c3)CC2)cc1	764828139	PPASXJANEJDDGV-UHFFFAOYSA-N	435.507	1.983	50	20	IDGD	
CS(=O)(=O)Cc1noc(NC(=O)NNC(=O)COc2ccccc2-c2ccccc2)n1	765243541	QZMGLOJLSLHDPR-UHFFFAOYSA-N	445.457	1.513	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3ccccc3-n3cccn3)CC2)cc1	766649465	PRWYGQJJJJNBJL-UHFFFAOYSA-N	432.528	1.760	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)CN1CCN([C@@H](CO)c2ccc(Cl)cc2)CC1	766892081	IIXCRQQNXUOXNT-NRFANRHFSA-N	444.963	1.690	50	20	IDGD	
C[C@@H](C(=O)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1)N1C(=O)NC2(CCCC2)C1=O	768278453	HAORYTAJPNXVCB-NSHDSACASA-N	428.424	1.230	50	20	IDGD	
CS(=O)(=O)CC[C@H](NC(=O)c1ccccc1Cl)C(=O)NN=c1cc[nH]cc1Cl	768453291	YNLIXBCOSGNZPN-HNNXBMFYSA-N	445.328	1.487	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(\C#N)C(=O)N2CCC(C(=O)NCCCO)CC2)c1C	769332460	AWYIFSMORFHAPQ-RSZPVBOMSA-N	430.549	1.957	50	20	IDGD	
CN(NC(=O)c1cccc(S(=O)(=O)Nc2ccc(Br)cc2)c1)C(N)=O	770537405	XSCDLQIYSGBVQH-UHFFFAOYSA-N	427.280	1.905	50	20	IDGD	
Cc1ccc(C(=O)NNc2nc(O)c3cnn(C)c3n2)cc1S(=O)(=O)NC1CCCC1	770990944	PQOIMYFAMLZLQZ-UHFFFAOYSA-N	445.505	1.355	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)[C@H]1CCc2[nH]nc(C(F)(F)F)c2C1	772884393	KRQDHQAPULPDBK-JTQLQIEISA-N	443.813	1.651	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)ncc1Br	773528725	PXPCFSJXRCXGTR-JTQLQIEISA-N	439.241	1.845	50	20	IDGD	
CCN1CCN(C(=O)c2ccc(NC(=O)C(=O)NNc3c(F)cccc3F)cc2)CC1	773705750	CETMHCAKVIBVIO-UHFFFAOYSA-N	431.443	1.824	50	20	IDGD	
COC(=O)c1cc(OC)c(OC)cc1NC(=O)C(=O)NNc1cnc2ccccc2n1	773717726	GDYDBBVFAYCJEG-UHFFFAOYSA-N	425.401	1.515	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)c2cccc(CN3CCS(=O)(=O)CC3)c2)c1	776538196	PGZMZJUYCPCCQH-UHFFFAOYSA-N	437.543	1.077	50	20	IDGD	
Nc1cccc([N+](=O)[O-])c1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	779491294	MSVCNMVZBNKYHY-UHFFFAOYSA-N	447.473	1.426	50	20	IDGD	
COC(=O)c1ccccc1NNC(=O)[C@@H]1CCCN1C(=O)/C=C/c1ccc(C(N)=O)cc1	780730830	DKAHQVXSHOEIIA-QHSLDKKCSA-N	436.468	1.720	50	20	IDGD	
O=C(NNc1cc(F)c(F)cc1F)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(F)cc1	780954631	BRLOVSYYXKHNMW-HWPZZCPQSA-N	433.383	1.510	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)/C=C/C(=O)N2CCN(c3ccc(OC)cc3)CC2)c1	781034605	LBYGFNKCXMXWEW-ZHACJKMWSA-N	438.484	1.830	50	20	IDGD	
O=C(NNC(=O)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(Cl)cc1)NC1CCCCC1	781929836	LOMDGWYTMRVOKK-ZBFHGGJFSA-N	444.941	1.127	50	20	IDGD	
NC(=O)c1cccc(C(=O)NNC(=O)[C@@H]2Cc3ccccc3CN2Cc2ccccc2)n1	781958854	SJGCEDVVWCBLPD-NRFANRHFSA-N	429.480	1.569	50	20	IDGD	
CN1CCCN(S(=O)(=O)c2cccc(NC(=O)NNc3ncncc3Cl)c2)CC1	782032857	BOJTTZZHDLBCBX-UHFFFAOYSA-N	439.929	1.605	50	20	IDGD	
CC(C)(C)OC(=O)NCc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(O)cc2)cc1	782831296	CYWLUZYNDIUUAR-UHFFFAOYSA-N	428.445	1.817	50	20	IDGD	
CC(C)N(C)c1ccc(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)cc1F	782893546	JKZGKZSDQAIMSR-UHFFFAOYSA-N	440.479	1.886	50	20	IDGD	
N#Cc1cccnc1-n1cc(NC(=O)C(=O)NNc2ccccc2Br)cn1	782989242	VDLGTHWLRLGJEJ-UHFFFAOYSA-N	426.234	1.983	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2ncn(Cc3cccc(Br)c3)n2)ncn1	783945870	QKKMXTXXOVUHCF-UHFFFAOYSA-N	431.254	1.269	50	20	IDGD	
CC(C)N(C)S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccc(Cl)nc2)cc1	784870430	SEFJIJHBMRQYJQ-UHFFFAOYSA-N	425.898	1.846	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)n1	785947920	JZSXLXXGVWSUOK-UHFFFAOYSA-N	426.838	1.489	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)cccc1N1CCNC1=O	787543721	MBHWOINFDOZVSE-ZDUSSCGKSA-N	443.435	1.217	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)Nc2ccc(Cl)c(S(C)(=O)=O)c2)c1	788306443	BEOYAWUDVZJEPO-UHFFFAOYSA-N	425.854	1.563	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1ccc(Cl)cc1-n1cccn1	788338681	YWTGIRGTIRTRMQ-UHFFFAOYSA-N	446.876	1.103	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2nc3c(s2)C[C@@H](C(C)(C)C)CC3)n1	789740446	HBBODSXVOIJDHA-ZDUSSCGKSA-N	432.550	1.894	50	20	IDGD	
O=C(NNC(=O)[C@H]1OCC[C@H]1c1ccccc1)C(=O)Nc1ccccc1O[C@@H]1CCOC1	789812825	ODLNHISIIHFRMS-UWVAXJGDSA-N	439.468	1.513	50	20	IDGD	
N#CCCn1cc(/C=C(\C#N)C(=O)N2CCC[C@@]3(C2)NC(=O)NC3=O)c(-c2ccccc2)n1	790236993	FDMHFXGEVJQGGU-LVJXIGIWSA-N	443.467	1.571	50	20	IDGD	
CN1CCCC(C)(C)[C@@H]1CNC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	790895154	GSOHVNGNDQBEJC-FQEVSTJZSA-N	430.597	1.650	50	20	IDGD	
COC(=O)c1nc([C@@H]2CCCN2CC(=O)NNC(=O)Cc2nc(C)cs2)sc1C	791613241	DHUIXHDIZBVWJE-LBPRGKRZSA-N	437.547	1.530	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)Cc2ccc(C(=O)NNC(=O)CC3OCCO3)cc2)cc1	792787050	JWQWXMJZURRRGD-UHFFFAOYSA-N	447.513	1.340	50	20	IDGD	
CC(=O)N[C@H](CC(=O)NNc1ccccc1S(=O)(=O)N(C)C)c1c(F)cccc1F	795160590	FAMQANKHASKCNM-MRXNPFEDSA-N	440.472	1.926	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)C(=O)Nc1ccc(F)c(N2CCOC2=O)c1	797003305	BGRWEKKANPHVMQ-UHFFFAOYSA-N	430.392	1.207	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)NCCN(C)S(=O)(=O)c2ccc(F)cc2)c1	798048413	XZIOBFCXIIZBTN-UHFFFAOYSA-N	438.481	1.164	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)C(=O)Nc1cc(F)c(Br)cc1Cl	799259463	YRZOUZGCUKZCKR-UHFFFAOYSA-N	429.633	1.965	50	20	IDGD	
CCc1cccc(C)c1NNC(=O)C(=O)Nc1cccc(S(=O)(=O)N2CCOCC2)c1	799843789	DBGWZMJKAJPFAL-UHFFFAOYSA-N	446.529	1.660	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)NCCOc1ccc(I)cc1	801062602	LJSPFKPAOCXBEO-UHFFFAOYSA-N	440.241	1.638	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2c[nH]c3ccc(Br)cc3c2=O)cc1	801105745	JXDJVCDXGUCIOT-UHFFFAOYSA-N	443.257	1.999	50	20	IDGD	
O=C(NNc1c(Br)cccc1Br)C1=NN(CCO)C(=O)CC1	801502875	BLEZLUJJBKWIIZ-UHFFFAOYSA-N	434.088	1.625	50	20	IDGD	
CNS(=O)(=O)c1ccc(C(=O)NNC(=O)Nc2ccc(Br)cc2)cn1	801998168	TZBHZHWEWFYLGR-UHFFFAOYSA-N	428.268	1.219	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)[C@@](C)(O)Cn2ccc(C)cc2=O)c(OC)cc1Cl	802082924	RVWABNGOSHEFIS-IBGZPJMESA-N	438.868	1.431	50	20	IDGD	
COc1ccc(C2=NO[C@H](CNC(=O)NNC(=O)COc3ccccc3O)C2)cc1F	802339425	KIGMFDIWUPQUDW-ZDUSSCGKSA-N	432.408	1.442	50	20	IDGD	
COc1ccc(Oc2ccc(NC(=O)C(=O)NNc3ccc(-n4ccnc4)nn3)cn2)cc1	807429629	SQQPXDJAGXZJDN-UHFFFAOYSA-N	446.427	1.940	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCC2(c3ccccn3)CCC2)c1	807533695	CKSNLDXTNNIEQA-UHFFFAOYSA-N	431.518	1.398	50	20	IDGD	
O=C(NNS(=O)(=O)c1c(F)cccc1OC(F)(F)F)[C@H]1COc2ccccc2O1	808068660	FORINGMOPOIXRJ-CYBMUJFWSA-N	436.339	1.874	50	20	IDGD	
O=C(NNC(=O)[C@@H]1C[C@@H](O)CN1C(=O)OCC1c2ccccc2-c2ccccc21)C1CC1	809949999	JANLDBXWEZWAIK-VFNWGFHPSA-N	435.480	1.928	50	20	IDGD	
COC(=O)c1c(F)ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2OC)c1C	810385233	YSMAJXCLDINZIJ-UHFFFAOYSA-N	437.811	1.982	50	20	IDGD	
CC(C)Oc1ccc(NC(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)cc1C(N)=O	812976588	GKHHVYHMUXHQCH-UHFFFAOYSA-N	435.506	1.972	50	20	IDGD	
O=C1COC[C@H](C[C@H]2CN(C(=O)C(=O)NNc3cccc(Cl)n3)c3ccccc32)N1	815729564	ZLVDPDJSJYJHRG-STQMWFEESA-N	429.864	1.214	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)NC[C@@H]2CN(Cc3ccccc3)CCO2)cc1OC	915895156	VFNRNVQACFBVBB-LJQANCHMSA-N	442.516	1.939	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NC[C@H](c2ccco2)N2CCCC2)c2ccccc2c1=O	915896911	PUUYHJUYUKGSAC-QGZVFWFLSA-N	438.488	1.791	50	20	IDGD	
O=C(NNC(=O)c1n[nH]c2c1CCC2)c1cccc(S(=O)(=O)NCc2ccccc2)c1	916105760	CSXDNGXEQNGLBQ-UHFFFAOYSA-N	439.497	1.452	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)N[C@@H](C)c1cccc(S(N)(=O)=O)c1	916197459	SSRGGAIJKNDKTO-ZDUSSCGKSA-N	436.490	1.203	50	20	IDGD	
O=C(NN=Cc1cc([N+](=O)[O-])ccc1O)c1cccc(S(=O)(=O)N2CCOCC2)c1	916258094	JOHKQAYNCRTQBQ-UHFFFAOYSA-N	434.430	1.085	50	20	IDGD	
CC(=NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1)c1ccc(S(C)(=O)=O)cc1	916541977	APGQCLATUNLHBI-UHFFFAOYSA-N	429.907	1.545	50	20	IDGD	
O=C(CCC(=O)N1CCc2sccc2C1)NNC(=O)c1nn(-c2ccccc2)cc1O	917698866	JVYYFWMGFCYIKI-UHFFFAOYSA-N	439.497	1.766	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)CCn1cc([N+](=O)[O-])cn1	919838859	PCQWAMWSPPOSRL-JTQLQIEISA-N	426.227	1.559	50	20	IDGD	
C[C@H](C(=O)NNC(=O)c1ccc(F)cc1Br)N1C(=O)[C@H]2CCCC[C@H]2C1=O	920456515	WDTSJKQDVNZFOA-JLLWLGSASA-N	440.269	1.913	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)CCCC[C@@H]1SC[C@H]2NC(=O)N[C@H]21	921303948	HGMMZPVKQVHNAS-IVMMDQJWSA-N	426.926	1.835	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCC(=O)NNC(=O)[C@@H](C)Oc2cccc(C)c2C)cc1	1115819718	URWDNNNKBGZZBC-MRXNPFEDSA-N	449.529	1.595	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2c(C)cc(C)c(NS(C)(=O)=O)c2C)cc1	1115863739	KGPFTRCTOJAIBE-UHFFFAOYSA-N	441.531	1.615	50	20	IDGD	
CN(C(=O)OC(C)(C)C)[C@H](C(=O)NNC(=O)Nc1ccc2c(c1)OCO2)c1cnn(C)c1	1116936362	FGGLUCOYCJBJCL-INIZCTEOSA-N	446.464	1.910	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](C(=O)NNC(=O)c1cccc(Br)c1)C(C)(C)O	1324089081	BVNJVZOEVGTKOW-GFCCVEGCSA-N	430.299	1.874	50	20	IDGD	
O=C(COCc1ccncc1)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	1324290586	DMBSHNBSDCCPNT-UHFFFAOYSA-N	443.463	1.818	50	20	IDGD	
CC(C)CNC(=O)CNC(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1	1325422506	HOYACQVPVQDFRJ-OAQYLSRUSA-N	437.544	1.716	50	20	IDGD	
CS(=O)(=O)c1ccc(-c2csc(CC(=O)NNc3nncc(N)c3Cl)n2)cc1	1326311874	YSTKVMLGOUUVCP-UHFFFAOYSA-N	438.922	1.925	50	20	IDGD	
CC[C@@H](NC(N)=O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@](C)(Cl)CCl)C2	1777983713	NTQWRBWGKXCRNQ-XHSVMWQWSA-N	437.368	1.184	50	20	IDGD	
Cn1c(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CO[Si](C)(C)C)C2)cccc1=O	1779540172	AKXMTCCOURLUAR-DYESRHJHSA-N	435.597	1.364	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)CC(C)(C)C(=O)OC(C)(C)C)C2)C1	1780889414	DNNIRMSTNFJZKF-BTYIYWSLSA-N	446.972	1.828	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(OC)c(OC)c3O)CCO2)C1	1781216259	BYRIHHFDHOIMKM-VBKZILBWSA-N	426.897	1.870	50	20	IDGD	
CN1CCc2cc(C(=O)N3CCO[C@@]4(CCN(C(=O)[C@H](F)Br)C4)C3)ccc21	1781330156	ROEDQMJZAIHOLD-QFBILLFUSA-N	440.313	1.813	50	20	IDGD	
O=C(c1cc(C(F)F)no1)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781330841	HLSAVWOTWTUVNL-YGRLFVJLSA-N	426.189	1.746	50	20	IDGD	
O=C(c1nc2ccccc2o1)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781331970	BRYAQQJYLUGJCW-SUMWQHHRSA-N	426.242	1.962	50	20	IDGD	
Cc1nccn1CC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Br)C2	1781557988	JRNGUXCGXNUYLK-UKPHBRMFSA-N	431.306	1.396	50	20	IDGD	
C[C@H](CC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2)Oc1ccccc1	1781602424	WPIGHJBNSRSKNO-ITBLURSFSA-N	438.952	1.958	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(OC(F)F)cc3)C2)C1	1781703306	BFFTYKNQBCXDQZ-HNAYVOBHSA-N	432.851	1.985	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(=O)c1ccco1)C2	1781997439	WHZNBLXMPRAANV-WPKBUWHJSA-N	427.295	1.760	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)n1ccnc1C)C2	1782179309	WYQMANREIRRGJZ-UJAMICLKSA-N	426.945	1.520	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CCC(=O)NN(C)C)C2)cc1O	1782213368	MRZQCUTXJZTJDZ-AUSIDOKSSA-N	446.548	1.201	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4ccnn4c3)C2)C1	1782404995	OVUMQLZBDKGWBV-QFBILLFUSA-N	435.322	1.951	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H]2[C@H]3COC[C@H]32)C1	1782796655	YJQSKWXNUIZHEK-OUSZYSOSSA-N	429.355	1.424	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)CCBr)CCO2)C1	1783342154	JHPKMKVSVRDKHG-FZMZJTMJSA-N	426.149	1.775	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)C#CC3(O)CCCCC3)CCO2)C1	1783349646	QBADVMNWOOACEJ-OXQOHEQNSA-N	441.366	1.688	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3n[nH]c4c(F)cccc34)CCO2)C1	1783533725	GFDODHSFEIYUTF-ZMZPIMSZSA-N	439.285	1.929	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(NC(=O)C4CC4)cc3)CCO2)C1	1783880064	FNTLPRAWOKJMRH-PGRDOPGGSA-N	449.935	1.732	50	20	IDGD	
C=CCSCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C[C@@H]21	1785014700	DWWKLGXNGIZYKS-VYOPWZLOSA-N	447.561	1.019	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)c3ccccc3)C[C@@H]21	1786404208	KKKBRYGZWMQSOP-OVWQWFNUSA-N	425.323	1.485	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4[nH]ccc4n3)[C@H]2C1	1788319731	GXSOPFSGPPSVDT-XREXNNHRSA-N	435.322	1.940	50	20	IDGD	
CC(C)N[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]2C1)C(C)C	1788765253	WMVXIJRHPYWNOZ-CGBFIWBNSA-N	427.662	1.840	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(F)F)C[C@@H]21	1789222331	SMIPNITVRACTJD-PJODQICGSA-N	441.387	1.379	50	20	IDGD	
Cc1nn(C)cc1C(=O)NC1(c2ccc(NC(=O)c3cnccc3C(=O)NN)cc2)CCC1	1789519711	GCSNGNGJUYKFOB-UHFFFAOYSA-N	447.499	1.789	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC1(c2ccc(NC(=O)[C@@H](O)N3CCOCC3)cc2)CCC1	1789557126	PWTHQTTXBSPYQY-VQIMIIECSA-N	425.913	1.025	50	20	IDGD	
Cn1nc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]3C2)c2c1CCC2	1789868375	TWZMKEOSUMKCNL-VOOFSGFHSA-N	443.375	1.738	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(Cl)ncn3)C[C@@H]21)[C@H](F)Br	1789924667	SCPYWCZQIWCNJR-PZEZNAACSA-N	435.681	1.414	50	20	IDGD	
Cc1ncc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Br)C[C@@H]32)s1	1791590462	CJKRDLFUNJGZNW-GZCFXPHUSA-N	434.331	1.664	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(Cl)cnc1O	1792390277	RIVOELNYPLWPSD-ZYYNGRNUSA-N	436.723	1.880	50	20	IDGD	
CN(C)[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](O)CCl)c1ccccc1Cl	1792983460	IOQYRWLYYLIRNA-BENORSOKSA-N	444.359	1.132	50	20	IDGD	
Cc1nc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)Br)C3)c(C)s1	1794181273	PIZCXJMYFIDION-UYAPLQMOSA-N	430.368	1.675	50	20	IDGD	
Cc1nnc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCBr)s1	1795111497	SOHQQRUMJRCOTP-DRXBFXEBSA-N	431.356	1.154	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)COCc1ccccc1	1795426725	HSFAXEHYVIRNEE-SCNOPHJPSA-N	425.323	1.576	50	20	IDGD	
CC(C)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(-n2cnnc2)cc1	1795491468	CRHLDJABPBWIMI-ALXJQNPVSA-N	431.924	1.736	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(C=O)s1)C2	1796892091	GPWOUFGQGYGVDU-NGYDUSEUSA-N	441.513	1.946	50	20	IDGD	
Cc1nc2cc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)c3ccc(B(O)O)cc3)C4)ccc2s1	1797558568	MSRJTROVMXAOOH-REPLKXPHSA-N	449.341	1.850	50	20	IDGD	
COc1ccccc1OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CO[Si](C)(C)C	1797953988	ZVFNMQYMTZXVPB-VPTLXERWSA-N	436.581	1.515	50	20	IDGD	
Cc1c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CO[Si](C)(C)C)nc2ccccn12	1797956072	ZOPDOEIXJKJTLE-CWPLJXCYSA-N	430.581	1.697	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(C(=O)O)n(C(C)C)n1)C2	1799264013	AFBKLHRZRWMVSA-ZWUHOBOKSA-N	426.901	1.383	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c[nH]nc3c1)C2)[C@@H](F)Br	1799346284	OGXQSKNJUJHMHF-AYRXBEOTSA-N	425.258	1.457	50	20	IDGD	
CC(C)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(-n2cncn2)c1	1799774648	RDKMAPDVEIOOOJ-ALXJQNPVSA-N	431.924	1.736	50	20	IDGD	
O=C1CCc2ccc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)C(Cl)Cl)cc2N1	1801016832	VOAGOJSIYXMHQJ-YWVIFJGQSA-N	426.300	1.578	50	20	IDGD	
O=C1CC[C@H](C(=O)NC[C@@H]2CCN(C(=O)[C@@H](F)Br)[C@H]2c2cccnc2)CN1	1802611227	SCXWGYVPORUWGY-DARAHFNDSA-N	441.301	1.304	50	20	IDGD	
Cc1ccn2ncc(C(=O)N3CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]3c3cccnc3)c2c1	1803139657	SKCDJLIPFBKEGK-AHRSYUTCSA-N	441.919	1.957	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CS[C@@H]2CCCCO2)[C@@H]1c1cccnc1)[C@H](O)CCl	1803142738	HKYVBJQLYZZZOA-QFHJOOASSA-N	441.981	1.947	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)N2CCOCC2)[C@@H]1c1cccnc1	1803691292	BMAAKIIJSVDTMB-PNYFIKQUSA-N	438.956	1.146	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC2(CCCN(C(=O)c3ncc(F)cc3F)C2)CC1	1806339429	VCVDUECIHOTAAE-UHFFFAOYSA-N	443.259	1.198	50	20	IDGD	
CC(=O)N(C)[C@H](C)C(=O)N1CC[C@@H](CNC(=O)CCBr)[C@H]1c1cccnc1	1806340670	JJOHRXDZJUDKIW-RPVQJOFSSA-N	439.354	1.739	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)C(C)(C)F)[C@H]1c1cccnc1	1808414206	GDGJIKBXCXXNLT-RMEHUUNGSA-N	442.495	1.970	50	20	IDGD	
CC(=O)N/C(C)=C/C(=O)N1CC[C@H](CNC(=O)[C@H](F)Br)[C@@H]1c1cccnc1	1808678021	FBRCYWXLKJIRLY-URYPIFHCSA-N	441.301	1.818	50	20	IDGD	
CO[C@H](C(=O)N1CCCC2(CCN(C(=O)CCC(=O)NN(C)C)CC2)C1)c1ccccc1	1809447095	LQDHOCNSKAPKJW-QFIPXVFZSA-N	444.576	1.978	50	20	IDGD	
CN[C@@H](CC(=O)N1CCCC2(CCN(C(=O)[C@H](C)CBr)CC2)C1)C(=O)O	1809829311	MJQXPWGWZRMLGW-KGLIPLIRSA-N	432.359	1.311	50	20	IDGD	
Cn1cc(CC(=O)N2CC[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]2c2cccnc2)cn1	1810547989	LAMVGRQMTMZTMT-GHTZIAJQSA-N	429.597	1.915	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H](CNC(=O)CO[Si](C)(C)C)[C@H]1c1cccnc1)n1cncn1	1810548580	RATYSWYIPQMUBI-SZVBFZGTSA-N	430.585	1.792	50	20	IDGD	
O=C(CN1CCCCC1=O)NC[C@H]1CCN(C(=O)C(Cl)Cl)[C@@H]1c1cccnc1	1812976494	GOHKOXPPOQJFGM-RHSMWYFYSA-N	427.332	1.904	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)CS(C)(=O)=O)[C@H]1c1cccnc1	1813028508	RLVDATHFAAPVLN-HJWJTTGWSA-N	445.969	1.022	50	20	IDGD	
C[C@@H]1CCC[C@@H]1C(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1813070652	LDTDWOSSEDTNAT-ONZODILHSA-N	429.565	1.897	50	20	IDGD	
CC(C)=CCCC(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1	1815343759	NOBFVOUIKQDUDK-MRXNPFEDSA-N	427.335	1.795	50	20	IDGD	
O=C(N[C@@H]1CCc2nc(NC(=O)[C@H](F)Cl)sc2C1)c1n[nH]c2c1CS(=O)(=O)C2	1817121549	MZINKFKRPXCUTN-INWYIAFRSA-N	447.901	1.055	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCN2CCOCC2)n[nH]1	1817181994	LOWDTELNVXPMNK-HOCLYGCPSA-N	427.933	1.378	50	20	IDGD	
CC[C@H](NC)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)n[nH]1	1818112185	VJOAVLLFXBJPEY-YIDGYCTFSA-N	442.524	1.534	50	20	IDGD	
C[C@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1)N1C[C@@H]2C[C@H]2C1	1819294815	ATQZLTZFXGGNLT-CVYDXHPNSA-N	445.568	1.115	50	20	IDGD	
C[C@H](Cn1cncn1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](F)Br)CC2	1820072922	VPWXYFGYGTVKCC-PTRXPTGYSA-N	445.318	1.673	50	20	IDGD	
C[Si](C)(C)OCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnc(O)nc1O)CC2	1820164909	MGVSWCCEJODRME-SECBINFHSA-N	437.554	1.422	50	20	IDGD	
C#CC(=O)N1CCCC[C@H]1c1cc(NC(=O)CN(C)NC(=O)NCc2ccccc2)n[nH]1	1820711576	SGWYCOVQEDGYOF-SFHVURJKSA-N	437.504	1.381	50	20	IDGD	
CC[C@@H](Br)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CNC(=O)N(C)C)[nH]n1	1822084379	KRMMTEOGOKZUDI-DGCLKSJQSA-N	443.346	1.847	50	20	IDGD	
Cc1cccc(CC(=O)N2CCCC[C@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)n1	1822412520	RIWJZCMAUGBLMV-SFHVURJKSA-N	441.536	1.721	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](C)n2cnnn2)n[nH]1	1822853242	YWFZUBUABBGELT-NQBHXWOUSA-N	439.318	1.681	50	20	IDGD	
CS(=O)(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)CCBr)[nH]n1	1822968211	PMQJJXXIPXPGNA-GFCCVEGCSA-N	435.344	1.622	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)/C=N/N1CCCCC1)CC2	1826000083	KLNZJVJRRLHHMQ-HVHIRKTFSA-N	427.958	1.781	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(O)ccc1O)CC2	1826088309	DDEQIHMWMMTNKZ-LLVKDONJSA-N	447.517	1.153	50	20	IDGD	
C[C@@H](C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCC(=O)NN(C)C)CC2)n1cccc1	1826599744	PEBUXZHBJGQIQC-KBPBESRZSA-N	432.550	1.491	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H]3CCCS3)sc2C1	1827290441	XLXGLOJCAVTERO-YGRLFVJLSA-N	446.558	1.263	50	20	IDGD	
C=CCC(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)[C@@H](O)CCl)C2)C1	1829350035	YISXMNLAAHDPRG-AVRDEDQJSA-N	449.935	1.614	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccnc3S)CCO2)C1	1829790103	LXUMOSYNOLVBMO-IBGZPJMESA-N	427.954	1.705	50	20	IDGD	
CCC[C@H](NC(C)=O)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830370611	NJJOFSOYNLEUEL-OXJNMPFZSA-N	431.961	1.013	50	20	IDGD	
CCCNC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](Cl)CCC)C2)C1	1831195501	DEELRCWMHMUXIN-UZLBHIALSA-N	431.961	1.157	50	20	IDGD	
COc1ccc(C(=O)N2CCC(N3CCC(NC(=O)[C@H](O)CCl)CC3)CC2)c(F)c1	1833313686	NAZXVZGMJSKMTK-LJQANCHMSA-N	441.931	1.619	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)N(C)C(C)=O)CC2)CC1	1833533089	VSDCUUHKVQBDKK-BEFAXECRSA-N	429.005	1.832	50	20	IDGD	
Cc1ncc(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](F)Br)CC3)CC2)[nH]1	1833580174	TWWQAZOMSBRZQK-OAHLLOKOSA-N	430.322	1.594	50	20	IDGD	
O=C(COCc1ccccc1)NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1834608163	AQMHSAUBTFNMMF-HXUWFJFHSA-N	437.968	1.375	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)c3c(F)cccc3F)C2)C1	1834824143	SRQNSZNTJHSPMR-SFHVURJKSA-N	447.276	1.820	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)C#Cc3ccccc3)CCO2)C1	1835096903	NXBASIIXJORIKV-LAUBAEHRSA-N	449.345	1.526	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3ccn4cncc4c3)CC2)CC1	1835606720	YVIQGKRUYNZQTN-HXUWFJFHSA-N	447.967	1.773	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCC(OC2CCN(C(=O)CCS(C)(=O)=O)CC2)CC1	1836625120	IRMMUGCWRUJDCR-UHFFFAOYSA-N	437.002	1.685	50	20	IDGD	
C[C@H](CC(N)=O)C(=O)N1CCC(OC2CCN(C(=O)[C@](C)(Cl)CCl)CC2)CC1	1836911100	RKQRVTCPBLPWMF-BFUOFWGJSA-N	436.380	1.733	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cn(C)nc3C)CC2)CC1	1836967640	CCKQSUWIAGRNFE-GOSISDBHSA-N	426.945	1.595	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4c(c3)CC(=O)N4)C2)C1	1839146458	ZHNSVGCEEGFRBQ-IERDGZPVSA-N	435.908	1.269	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(-n4cccn4)cc3)C2)C1	1839147046	FXJBXBDHUXOULE-SIKLNZKXSA-N	446.935	1.960	50	20	IDGD	
O=C(c1cc(O)ccc1F)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839202240	YDWUKRWUJLGVLT-WMLDXEAASA-N	449.248	1.292	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)C1(Br)CC1)CCO2	1839207317	PERNNMVDTZEOGO-MRXNPFEDSA-N	449.418	1.222	50	20	IDGD	
O=C(c1ccc(O)cc1F)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1839316985	CXPXTFCSEOBMAA-RHSMWYFYSA-N	449.248	1.292	50	20	IDGD	
O=C(c1cn2ccsc2n1)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840188641	VKEJLUUAVXKCBA-INIZCTEOSA-N	433.317	1.270	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)C1CC1)CCO2	1840637023	LKFYMQMCKZWSTK-OAQYLSRUSA-N	447.444	1.000	50	20	IDGD	
CC(C)(C)OC(=O)N(CC(=O)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1)C1CCCC1	1841351641	ZIIQSOZYEQVKOC-INIZCTEOSA-N	443.972	1.969	50	20	IDGD	
CS(=O)(=O)c1ccc(C(=O)N2CC3(CCCN3C(=O)CCBr)C2)nc1	1842637587	IDFUYIPLCQUJBW-UHFFFAOYSA-N	430.324	1.087	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)Cc2ccccc2F)C1	1842699119	VEUNSTYXRUWSNZ-MFKUBSTISA-N	425.464	1.706	50	20	IDGD	
O=C(c1cc2cc(F)c(F)cc2[nH]1)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843013896	ACDBSGKXAZAELU-UHFFFAOYSA-N	439.227	1.257	50	20	IDGD	
O=C1C[C@H](C(=O)N2CC3(CCCN3C(=O)[C@H](Br)Cc3ccccc3)C2)CCN1	1845942635	RWXMFQBNCNHKLD-IAGOWNOFSA-N	448.361	1.722	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@]2(C[C@H]2C(=O)N2CCCC23CN(C(=O)[C@@H](O)CCl)C3)C1	1846156515	WDQDWPPPHFKTBC-AVYPCKFXSA-N	441.956	1.437	50	20	IDGD	
COC(=O)c1ccc(OCC(=O)N2CCCC23CN(C(=O)CO[Si](C)(C)C)C3)cc1	1847147712	OZTHWYSJFKGZMU-UHFFFAOYSA-N	434.565	1.907	50	20	IDGD	
COc1cc2c(cc1OC)CN(C(=O)NNC(=O)c1csc(N3CCOCC3)n1)CC2	9790055	FWNAYQGYQLNEOH-UHFFFAOYSA-N	447.517	1.410	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)CCc2ccc(S(=O)(=O)NC)cc2)cc1OC	12696749	AVNXZMPYCZUCPH-UHFFFAOYSA-N	449.529	1.786	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)NCCC(=O)NNC(=O)COc2ccc(C)c(C)c2)cc1	17203649	VRZXNJIJQPENJF-UHFFFAOYSA-N	447.513	1.401	50	20	IDGD	
COC(=O)c1c(C)[nH]c(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1C	17457542	LRRBNXFWJFBFIN-UHFFFAOYSA-N	448.501	1.277	50	20	IDGD	
O=C(CNC(=O)c1cccc(Br)c1)NNC(=O)c1cc(Br)c[nH]1	24123826	BDPXLMOBVYAAMM-UHFFFAOYSA-N	444.083	1.731	50	20	IDGD	
Cc1ccc(S(=O)(=O)NNC(=O)c2ccc3c(c2)OCCO3)c(C)c1OCC(=O)O	726155955	SQJHYJJHRYQRFB-UHFFFAOYSA-N	436.442	1.161	50	20	IDGD	
O=C(CN1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1)NNC(=O)c1ccc([N+](=O)[O-])cc1	726187381	TVSWGAQJTIYGNR-MRXNPFEDSA-N	444.423	1.391	50	20	IDGD	
O=C(Cn1cccc(C(F)(F)F)c1=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	726867244	BUGGULLXWWKZDT-UHFFFAOYSA-N	430.408	1.451	50	20	IDGD	
CC(C)(C)[C@H]1CCc2sc(C(=O)NNC(=S)NCCNS(C)(=O)=O)cc2C1	727066210	IYCQQQOKYCZKRN-LBPRGKRZSA-N	432.637	1.557	50	20	IDGD	
CC(C)CCC(=O)NNC(=O)N1CCN(c2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])CC1	727482218	VEHBPIVCFATEKV-UHFFFAOYSA-N	441.510	1.297	50	20	IDGD	
O=C(COC(=O)[C@H](c1ccccc1)n1cccn1)NNC(=O)[C@@H]1COc2ccccc2O1	728332724	NPFVBLNYWNGKQA-ICSRJNTNSA-N	436.424	1.003	50	20	IDGD	
CC(C)COc1ncccc1C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	728511944	HMBKUXDMWMAMRR-UHFFFAOYSA-N	446.529	1.976	50	20	IDGD	
O=C(NNC(=O)c1ccsc1NC(=O)c1ccc2c(c1)CCC2)C(=O)N1CCCC1	729350646	FYWXVFMBNJWBCV-UHFFFAOYSA-N	426.498	1.873	50	20	IDGD	
CCN(CC)[C@H](C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1)c1ccccc1	729511488	IYBAZQFFHLWJIW-KRWDZBQOSA-N	438.937	1.832	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)CN2C(=O)N[C@@](C)(c3ccc(F)cc3)C2=O)cn1	729692961	ASOATMYCPBPLID-IBGZPJMESA-N	446.464	1.014	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)[C@@H]2CSCN2C(=O)C(C)(C)C)c2ccccc2c1=O	730074127	USFSRSYKIFJMHM-HNNXBMFYSA-N	445.545	1.686	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)CCCN2CCN(c3ccccc3)CC2)c1	731970461	IBBWHOXEZYZJHA-UHFFFAOYSA-N	444.557	1.454	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)CCc1c(C)nc(N2CCOCC2)nc1O)c1ccccc1	731999088	LJJFXPBMYNLYOL-QGZVFWFLSA-N	427.505	1.601	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)NCCCCN1CCN(c2ncccn2)CC1)c1ccccc1	732245933	KGJNKPOITXDPTH-HXUWFJFHSA-N	439.564	1.903	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)CCNS(=O)(=O)c1ccc(F)c(F)c1	732305158	BKJSYMDLKRBECB-UHFFFAOYSA-N	433.458	1.180	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)C1CCN(C(=O)c2cccc3ccccc23)CC1	732645140	NLYROOQXXSHVPI-KRWDZBQOSA-N	443.525	1.274	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1S(=O)(=O)NCC#N	733171727	UOLSVWKCTBBNBT-UHFFFAOYSA-N	438.469	1.057	50	20	IDGD	
Cc1c(C(=O)NNc2nc3ccccc3c(=O)n2C)nnn1-c1ccc2c(c1)OCCO2	733261384	PCIGRHDKDXSPGU-UHFFFAOYSA-N	433.428	1.351	50	20	IDGD	
C[C@]1(CNC(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)CCOC1	733654287	LGORAZYFXJAHNZ-JOCHJYFZSA-N	435.488	1.759	50	20	IDGD	
CN(CC(=O)NNC(=O)c1cccs1)C[C@H](O)COc1ccc(C(F)(F)F)cc1	733997939	WVKTWDBXFQBJGG-ZDUSSCGKSA-N	431.436	1.900	50	20	IDGD	
COc1ccc([C@@H]2[C@@H](C(=O)NNC(=O)[C@@H]3COc4ccccc4O3)CCC(=O)N2C)cc1	734313350	IFELFCNVSANBMQ-NBHGPNQESA-N	439.468	1.592	50	20	IDGD	
N#Cc1ccc([C@@H](NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)C(N)=O)cc1	734507395	XIBBRSPEPDCPTD-LJQANCHMSA-N	441.513	1.194	50	20	IDGD	
CCOC(=O)C(=O)N1CCN(C(=O)/C(C#N)=C/c2cc(C)n([C@H](C)COC)c2C)CC1	736130208	DBGGIPIDYYMKJK-PUMYGXPMSA-N	430.505	1.453	50	20	IDGD	
COc1ccc(-c2nnc(S)n2CCC(=O)NNC(=O)COCc2ccccc2)cc1	738545349	DSYRBXMUYJLQLP-UHFFFAOYSA-N	441.513	1.997	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)[C@@H]1C[C@@H](O)CN1C(=O)OCc1ccccc1	738545537	HYCQOVDQOAXNME-MOPGFXCFSA-N	427.457	1.123	50	20	IDGD	
CCC(CC)[C@@H](C(=O)NNC(=O)c1sc(N2CCOCC2)nc1C)N1CCOCC1	742037528	YENBXRVWMQSOJK-INIZCTEOSA-N	439.582	1.186	50	20	IDGD	
CC(C)(C)C(=O)Nc1nc(CC(=O)NNC(=O)c2nnc(O)c3ccccc23)cs1	742473545	CRDCWIYNMSKAHG-UHFFFAOYSA-N	428.474	1.780	50	20	IDGD	
COC(=O)/C=C\c1cc(OC)c(OC)c(S(=O)(=O)NNC(=O)NC2CCCC2)c1	743729191	AJZVCSMXYUAKLS-HJWRWDBZSA-N	427.479	1.325	50	20	IDGD	
CON(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)Nc2ccc(OC(F)F)cc2)cc1	743832176	NTEHVDWSAQOYIN-UHFFFAOYSA-N	444.416	1.936	50	20	IDGD	
N#CCCn1cc(/C=C(/C#N)C(=O)N2CCC[C@@H](S(N)(=O)=O)C2)c(-c2ccccc2)n1	744530333	HLFCGCLVVBAXAH-LYPXWFNGSA-N	438.513	1.650	50	20	IDGD	
CC(=O)N[C@@H](CC(=O)OCC(=O)NNC(=O)c1ccc(C#N)cc1)c1c(F)cccc1F	744941885	NZWMXSSGJKCTGY-KRWDZBQOSA-N	444.394	1.408	50	20	IDGD	
CN(C)c1ccc(NC(=O)NNC(=O)NC[C@H]2CN(Cc3ccccc3)CCO2)cc1	745289073	FYQWGGHGXBROQD-FQEVSTJZSA-N	426.521	1.989	50	20	IDGD	
CC(C)CN1CCC[C@@H](CNC(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)C1	746327825	FRYZGFAPMCFTMT-INIZCTEOSA-N	426.587	1.762	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2ccc(OCc3ncnn3C)cc2)cc1OC	746590734	DUCOXADRYPIHNW-UHFFFAOYSA-N	447.473	1.035	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCC(=NNC(=O)Cc3cn4ccccc4n3)CC2)cc1	747638182	JOORZRVXDMGLEX-UHFFFAOYSA-N	441.513	1.842	50	20	IDGD	
Cc1c(C(=O)NNC(=O)CCSc2ccc(F)cc2)cnc2c1c(=O)n(C)c(=O)n2C	747728035	RYALYFSDPHJXCC-UHFFFAOYSA-N	445.476	1.023	50	20	IDGD	
CC(=O)N1CCN(S(=O)(=O)c2ccc(C(=O)NNc3ccc(F)cc3C)cc2)CC1	748544701	RSCPXVMIZRRJSH-UHFFFAOYSA-N	434.493	1.744	50	20	IDGD	
C[C@H](C(=O)NNc1ccc(OCC(F)(F)F)cc1)N1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O	748703805	SWPAZSUROJKSLU-YGARTUKASA-N	427.379	1.622	50	20	IDGD	
O=C(CNS(=O)(=O)c1cccs1)NNc1c(F)cc(C(=O)NC2CC2)cc1F	748827255	DURDYSUNSLJNKQ-UHFFFAOYSA-N	430.458	1.340	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)[C@H]2CCCN2S(=O)(=O)c2cccs2)c1	749160541	LELYILYJMKJMAC-MRXNPFEDSA-N	437.543	1.744	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2CCCN2C2CCCC2)c1	749174668	CPSFXJQXAXSBQX-IBGZPJMESA-N	436.578	1.885	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2cnc(-c3ncccn3)s2)c2ccccc2c1=O	749471027	CYUQMPRCAYQPQS-UHFFFAOYSA-N	435.469	1.795	50	20	IDGD	
O=C(NNC(=O)N1CCN(S(=O)(=O)Cc2ccccc2)CC1)c1cc2ccccc2o1	750286618	FOGRBZYHEQTDEC-UHFFFAOYSA-N	442.497	1.935	50	20	IDGD	
Cc1cc(-c2noc(CCC(=O)NNC(=O)CNC(=O)c3cccs3)n2)ccc1F	751206758	SORIYURJJWFOAZ-UHFFFAOYSA-N	431.449	1.756	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)c1nc(Cc2ccccc2)no1	753041872	ZTJFQJUSFVHOTE-ZDUSSCGKSA-N	447.455	1.613	50	20	IDGD	
COc1cccc([C@H](C)CC(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)c1	753340376	PAANNACTKNAQCU-MRXNPFEDSA-N	447.561	1.663	50	20	IDGD	
CN(c1ccccc1)S(=O)(=O)c1cc(C(=O)NNC(=O)CO)ccc1Br	753444810	AYTAKKMXAUOLLQ-UHFFFAOYSA-N	442.291	1.028	50	20	IDGD	
Cc1ccc(-n2nc(Br)cc2C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)cc1	755062081	GDMRAKUAICPWEP-NSHDSACASA-N	441.307	1.139	50	20	IDGD	
CNC(=O)c1ccc(OC)c(NC(=O)NNC(=O)c2cc(-c3ccccc3OC)[nH]n2)c1	755918235	CAICLNNZTLXTJM-UHFFFAOYSA-N	438.444	1.920	50	20	IDGD	
CC(C)NC(=O)c1ccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1	756085686	SRCPGLLHAIHGAM-UHFFFAOYSA-N	447.517	1.542	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)N[C@H]2CCN(c3c(F)cccc3F)C2=O)cc1	756210129	FCLYOQHEMIPBAO-INIZCTEOSA-N	429.383	1.351	50	20	IDGD	
NC(=O)CCSc1ccccc1NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	756363261	PYLHZSMIBFIHEC-UHFFFAOYSA-N	426.462	1.096	50	20	IDGD	
C[C@H]1CN(C(=O)Cn2cc(NC(=O)NNC(=O)c3ccc(Cl)nc3)cn2)C[C@H](C)O1	756837075	FMEABXBXLJETKD-RYUDHWBXSA-N	435.872	1.034	50	20	IDGD	
NC(=O)c1ccc(NNC(=O)c2cccc(S(=O)(=O)Nc3ccccc3F)c2)nn1	757393148	SWDPPNOWOUNPNU-UHFFFAOYSA-N	430.421	1.272	50	20	IDGD	
Cc1ccnn1-c1ccccc1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	758014920	UXXDWHXPCDYGPG-UHFFFAOYSA-N	442.501	1.898	50	20	IDGD	
CCNS(=O)(=O)c1ccc(CC(=O)NNC(=O)c2cc(-c3ccccc3)on2)cc1	759355679	HVLHSLJEFKZXNB-UHFFFAOYSA-N	428.470	1.644	50	20	IDGD	
COC(=O)c1cc(I)cc(NC(=O)C(=O)NNC(=O)C(C)(C)C)c1	761071298	BJHBTPVRALVDEE-UHFFFAOYSA-N	447.229	1.210	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)c2cc(S(=O)(=O)NCCCN(C)C)ccc2C)cc1	761802153	URWLXFVKPLHSPY-UHFFFAOYSA-N	446.573	1.862	50	20	IDGD	
CC(=O)NNC(=O)C(=O)Nc1cc(I)ccc1Br	763518082	PFEPPCYICSPXDU-UHFFFAOYSA-N	426.008	1.160	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)c(Cl)n1	763539129	IYCFMCWDPXDLAT-UHFFFAOYSA-N	438.824	1.169	50	20	IDGD	
Cc1c(Br)cccc1NC(=O)C(=O)NNC(=O)[C@H]1COc2ccccc2O1	763569770	BNEDZTBNVJJQCD-OAHLLOKOSA-N	434.246	1.683	50	20	IDGD	
CC(C)(C)c1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(Cl)c(C(N)=O)c2)cc1	763599462	HKSHVAIZTPDYRL-UHFFFAOYSA-N	446.891	1.901	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(Cl)c(C(=O)N(C)C)c1	763646563	IAKFWGCQRKOKSL-UHFFFAOYSA-N	448.863	1.215	50	20	IDGD	
CO[C@@H](C)C(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)COc2ccc(C)c(C)c2)c1	763666488	GGRPGKMAEAPMSF-HNNXBMFYSA-N	442.472	1.442	50	20	IDGD	
Cc1cc(C(=O)N2CCCC2)ccc1NC(=O)C(=O)NNC(=O)C1=S=C2CCCC2=C1	763782842	WMHMLNVJRKDUIZ-UHFFFAOYSA-N	440.525	1.519	50	20	IDGD	
CC(C)C(=O)NNC(=O)C(=O)Nc1ccc(Cl)c(S(=O)(=O)N2CCCCC2)c1	763821580	UKEFLPLXABUUKM-UHFFFAOYSA-N	430.914	1.257	50	20	IDGD	
COCCn1ccc2ccc(NC(=O)C(=O)NNC(=O)COc3ccc(F)cc3)cc21	763839234	GZOLHMMPTALKQV-UHFFFAOYSA-N	428.420	1.592	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccccc2C[S@](C)=O)cc1	763878672	SLZLSNGDVQSDCC-PSKUBERUSA-N	445.497	1.321	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(F)c(NC(C)=O)c2)ccc1OC(C)C	763916286	LSVKWTMUUZNNCH-UHFFFAOYSA-N	446.435	1.980	50	20	IDGD	
Cc1nc(-c2ccc(NC(=O)C(=O)NNC(=O)c3cc(Br)cn3C)cc2)n[nH]1	764004269	BBXKRXMQAITDFU-UHFFFAOYSA-N	446.265	1.281	50	20	IDGD	
Cn1cnn(-c2ccc(NC(=O)C(=O)NNC(=O)c3cccc4ccccc34)cc2)c1=O	764049782	XPGLEPPLOJZTJV-UHFFFAOYSA-N	430.424	1.124	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2cc(F)ccc2OC(F)F)c1	764086952	YNAOUSNACVFKDC-UHFFFAOYSA-N	445.375	1.230	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)cc1O)C(=O)Nc1ccnn1Cc1ccccc1F	764117742	QNNWZTMNWUYWKW-UHFFFAOYSA-N	431.811	1.829	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(N3CCSCC3)cc2)c1O	764132965	ZEZNLWRUZARZMK-UHFFFAOYSA-N	430.486	1.354	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(C(=O)NC3CC3)c2)o1	764138282	GCQJAKAUSMECLC-UHFFFAOYSA-N	441.488	1.413	50	20	IDGD	
Cc1ccc(Cn2nccc2NC(=O)C(=O)NNC(=O)c2cccc(OC(F)F)c2)o1	764260129	PPIVFHYNRDQGOW-UHFFFAOYSA-N	433.371	1.834	50	20	IDGD	
CCCOc1ccc(NC(=O)C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1	764260278	OKQZIVGUVVLVJJ-UHFFFAOYSA-N	426.477	1.268	50	20	IDGD	
C[C@@H]1CN(Cc2cccc(NC(=O)C(=O)NNC(=O)Cc3ccccn3)c2)C[C@@H](C)O1	764263786	IXJGOYDKWBVNQY-HZPDHXFCSA-N	425.489	1.019	50	20	IDGD	
C[C@@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)COCc3ccccc3)cc2)C[C@@H](C)O1	764363135	KXUSHEPQRTZWJC-IAGOWNOFSA-N	440.500	1.603	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(C(=O)N2CCC[C@@H](C)C2)cc1C	764398606	HNEDDMAOWKXKEI-GDBMZVCRSA-N	448.520	1.005	50	20	IDGD	
CC(=O)OCCc1cccc(NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1	764702811	OMYIXCYVTDVMCQ-UHFFFAOYSA-N	426.477	1.652	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NCc2ccc(N3CCCS3(=O)=O)cc2)cc1	764764626	ATRXHZRFKBTDRP-UHFFFAOYSA-N	448.501	1.145	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)NCc1cccc(N2CCCS2(=O)=O)c1	765197354	VTBYYHBTJDNMIO-UHFFFAOYSA-N	442.501	1.327	50	20	IDGD	
O=C(CCc1ccco1)NNC(=O)c1ccc(C(=O)NNC(=O)CCc2ccco2)o1	765350833	OLQLCGNHMDZBJD-UHFFFAOYSA-N	428.401	1.253	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)CCCN3C(=O)NC(C)(C)C3=O)n[nH]2)cc1	765571640	MIYGWGHXHMMZMD-UHFFFAOYSA-N	426.477	1.511	50	20	IDGD	
COc1ccc(OC)c(C(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)c1	765749912	WBUNJGQPJGLYKT-UHFFFAOYSA-N	426.517	1.591	50	20	IDGD	
CS(=O)(=O)c1ccccc1NNC(=O)NCCCCN1CCN(c2ncccn2)CC1	765750611	ALSAICAVRCJHJH-UHFFFAOYSA-N	447.565	1.109	50	20	IDGD	
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)NNC(=O)COc1ccccc1[N+](=O)[O-]	765892881	NBZFHKGMJDTYHY-NVXWUHKLSA-N	427.461	1.825	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)N[C@H]1CCc2n[nH]cc2C1	767110905	PEKLXQQFTZLXDK-INIZCTEOSA-N	446.533	1.086	50	20	IDGD	
CC(C)(O)C(=O)NNC(=O)CSc1nnc(-c2ccc(F)cc2)n1C[C@H]1CCCO1	768248368	WUCCAJRVDHKFCS-CQSZACIVSA-N	437.497	1.274	50	20	IDGD	
CSCC[C@H](NC(=O)COc1ccccc1)C(=O)NNC(=S)Nc1ccccn1	768585969	YMLMATIUTSWLJX-HNNXBMFYSA-N	433.559	1.716	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)c1cc(NC(C)=O)cc(NC(C)=O)c1	768637367	GFMDFULQKGQOFX-UHFFFAOYSA-N	434.474	1.772	50	20	IDGD	
CC(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)c1	770239516	CIUVYYLTPSJFAA-UHFFFAOYSA-N	428.511	1.337	50	20	IDGD	
O=C(NNC(=O)c1nccn2c(Br)cnc12)c1nn(-c2ccccc2)cc1O	770379893	LOTYXECFVRPQOG-UHFFFAOYSA-N	442.233	1.458	50	20	IDGD	
Cc1cccc(F)c1NNC(=O)C(=O)Nc1ccccc1OCC(=O)N1CCOCC1	770815556	JROBGVJHRIEAIN-UHFFFAOYSA-N	430.436	1.454	50	20	IDGD	
COc1ccc([C@H](OC)[C@H](C)NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1	771966286	WVRYPFYAOPGECS-HNAYVOBHSA-N	442.520	1.808	50	20	IDGD	
Cc1cccc([N+](=O)[O-])c1C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	772426862	GVMNSBHPAFYBGH-UHFFFAOYSA-N	433.490	1.596	50	20	IDGD	
COc1cc(C)c(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(C(C)=O)cc2)cc1F	773500973	ZCHZXDOCFPIOGB-CYBMUJFWSA-N	431.420	1.899	50	20	IDGD	
C[C@@H]1CN(C(=O)c2ccc(NC(=O)C(=O)NNc3ccc([N+](=O)[O-])cc3)cc2)C[C@@H](C)O1	773643709	FGKKGQGZBPTBRI-ZIAGYGMSSA-N	441.444	1.926	50	20	IDGD	
CCN1CCN(C(=O)Cc2ccc(NC(=O)C(=O)NNc3cccc(C#N)c3)cc2)CC1	773688506	DOXARIROWVDQRO-UHFFFAOYSA-N	434.500	1.347	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCc2ccc3c(n2)CCCC3)cc1	775114182	AVMLDSHRLNNQAK-UHFFFAOYSA-N	445.545	1.420	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)[C@H]2CS[C@H](Cc3ccccc3F)C(=O)N2)c1	776714485	GWQGMWKSYSCEKH-IAGOWNOFSA-N	437.518	1.515	50	20	IDGD	
C[C@@H](NC(=O)CC(C)(C)C)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	778282796	LDUOLCAJDMEUKY-CQSZACIVSA-N	438.550	1.173	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2	778525401	UPJSUWJVALUAIX-UHFFFAOYSA-N	438.190	1.926	50	20	IDGD	
CC1(NC(=O)OC(C)(C)C)CCN(CC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)CC1	781975486	YEMVCSBCQXOQAL-UHFFFAOYSA-N	435.481	1.735	50	20	IDGD	
CCOC(=O)Cn1cccc(NC(=O)C(=O)NNc2ccccc2Br)c1=O	782988567	JRZUBGCRHBLYIB-UHFFFAOYSA-N	437.250	1.256	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)CNC(=O)c2cccs2)ccc1C(F)(F)F	784005359	XFJXKMJWPNVEQZ-UHFFFAOYSA-N	428.392	1.591	50	20	IDGD	
COc1ccc(Cn2nccc2NC(=O)C(=O)NNc2ccc(Cl)nn2)c(OC)c1	784793104	OZYZWLMSJGLXMA-UHFFFAOYSA-N	431.840	1.474	50	20	IDGD	
C#CCOc1ccc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)NC(C)(C)C)cc1	784833316	NDLGEJNIWYVALR-UHFFFAOYSA-N	444.513	1.857	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)C(=O)Nc1ccc(OCc2ccccc2)nc1	785060276	HODMKYOTCADLSX-UHFFFAOYSA-N	444.451	1.637	50	20	IDGD	
O=C(NNc1cc(F)c(F)c(F)c1)C(=O)Nc1cccc(S(=O)(=O)NC2CC2)c1	785083304	MBKJSKRTBMYLTG-UHFFFAOYSA-N	428.392	1.626	50	20	IDGD	
O=C(CNc1ccccc1)NNC(=O)COc1cccc(I)c1	787865880	GNIATDKSYNKZDV-UHFFFAOYSA-N	425.226	1.930	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2O)ccc1C(F)(F)F	790953220	YFEAXANORMJEIN-UHFFFAOYSA-N	427.335	1.585	50	20	IDGD	
CCOc1ccc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)CC3OCCO3)cc2)cc1	792776210	DXZSSVXUJBOALJ-UHFFFAOYSA-N	449.485	1.410	50	20	IDGD	
CSSCCNC(=O)C(=O)Nc1ccc(S(=O)(=O)N2C[C@H](C)O[C@@H](C)C2)cc1	793078289	DQQKZWPAJARCQC-STQMWFEESA-N	447.604	1.550	50	20	IDGD	
CC(C)(C)OC(=O)NCC1CCC(=NNC(=O)CSc2nnc(O)nc2O)CC1	794886803	OJUOLJXKOXNTIH-UHFFFAOYSA-N	426.499	1.562	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)c(OC)c(C)c1OC	796989274	CXCCAOUQJLYKAP-LBPRGKRZSA-N	449.435	1.713	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNC(=O)CNC(=O)OCc2ccccc2)c(C)c1	797369606	AWCWPAPIFURVBC-UHFFFAOYSA-N	428.445	1.406	50	20	IDGD	
CCn1c(=O)c(C(=O)/C(C#N)=C/c2ccoc2C(=O)OC)c(N)n(Cc2ccccc2)c1=O	798178699	UXXRPDGLSMWZBP-LFIBNONCSA-N	448.435	1.830	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@@H](C(=O)NNc2ccc3c(=O)[nH]ccc3c2)[C@@H](C)O)cc1	803433195	KNIOYRQHPSEURT-FZKQIMNGSA-N	430.486	1.008	50	20	IDGD	
CC[C@@H](NC(=O)NNc1ccc(-n2ccnc2)nn1)[C@@H]1CN(Cc2ccccc2)CCO1	805203700	QOUBMNNYQZQZKC-MOPGFXCFSA-N	436.520	1.968	50	20	IDGD	
COc1ccc([C@@]2(C)NC(=O)N(CC(=O)NNc3ccc([N+](=O)[O-])cc3C)C2=O)cc1	805374772	XSTUSINBBWBYMT-HXUWFJFHSA-N	427.417	1.822	50	20	IDGD	
Cc1ccccc1NC(=O)NNC(=O)C(=O)Nc1cc(F)c(N2CCOCC2)cc1F	807000564	DSOPQYMECSYTBL-UHFFFAOYSA-N	433.415	1.901	50	20	IDGD	
CC(C)(C)OC(=O)N1CCc2ncc(NC(=O)C(=O)NNc3cccc(F)n3)cc2C1	807392703	HNCMUDXFGWORGY-UHFFFAOYSA-N	430.440	1.991	50	20	IDGD	
CCCNS(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)C(C)(C)c2ccccc2)cc1	808088452	BNTPGAPSWIQCQG-UHFFFAOYSA-N	439.559	1.662	50	20	IDGD	
COc1cc(F)c(F)cc1NC(=O)C(=O)NNC(=O)c1cc(Br)cn1C	810384254	IFWOEEOZKWIMIK-UHFFFAOYSA-N	431.193	1.474	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)c1ccc(N2CCCCC2=O)cc1	811851876	WQICBXINCNPIOO-OAHLLOKOSA-N	448.487	1.884	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)[C@H]2CCCN(C(=O)c3ccncc3)C2)cc1	812730246	DJNXCBWINDULRI-INIZCTEOSA-N	431.518	1.327	50	20	IDGD	
COC(=O)c1cn(-c2cccc(NC(=O)C(=O)NNc3ccc(C#N)c(Cl)c3)c2)nn1	812986720	AMOYXEITIFVYBF-UHFFFAOYSA-N	439.819	1.661	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccncc2)cc1S(=O)(=O)C1CCCC1	815570169	UNCPSQNDOUADLA-UHFFFAOYSA-N	444.513	1.435	50	20	IDGD	
CCCN1Cc2cccc(NC(=O)C(=O)NNc3ccccc3S(=O)(=O)N(C)C)c2C1	815751574	FJKWFRAAGPKJGV-UHFFFAOYSA-N	445.545	1.744	50	20	IDGD	
Cn1ncc(C(=O)NNC(=O)CSc2ccccc2O)c1I	815889767	LGYGDTVFTRDZQY-UHFFFAOYSA-N	432.243	1.284	50	20	IDGD	
Cc1ccc(CN2C(=O)CC[C@@H]2C(=O)NNc2ccccc2S(=O)(=O)N(C)C)cc1	817052595	ICSHECXXGIHJTB-GOSISDBHSA-N	430.530	1.880	50	20	IDGD	
O=C(Cn1cnc2ccccc21)NNC(=O)[C@H]1CCCN(S(=O)(=O)c2ccccc2)C1	915188525	VJBRZKVAAUHBFS-INIZCTEOSA-N	441.513	1.285	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)NCc2ccc(S(N)(=O)=O)s2)cc1	915906138	LYKYFUOROCWBEQ-NSHDSACASA-N	442.519	1.092	50	20	IDGD	
CCCS(=O)(=O)N1CCC(NC(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)CC1	916383474	HWDYCAXWGVAFFJ-UHFFFAOYSA-N	426.583	1.737	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2[nH]c3c(c2C)C(=O)CCC3)cc1OC	916529084	SYZSGOKEQGMYBJ-UHFFFAOYSA-N	429.429	1.477	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)NCCS(=O)(=O)NCc1ccccc1	916645116	DHSWPELYMWIMCP-CQSZACIVSA-N	438.481	1.043	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NCC[C@H]3C[C@H]4CC[C@H]3C4)nc2)CC1	916648565	VNSCWILSTCYRNO-ULQDDVLXSA-N	436.582	1.470	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)C[C@@H]1Oc2ccccc2NC1=O	916787423	BUPNUJQJBPVCHF-FQEVSTJZSA-N	437.500	1.136	50	20	IDGD	
CC(=NNC(=O)c1ccc2c(c1)OCO2)c1ccc(S(=O)(=O)NCCCN(C)C)cc1	917534737	NAFCDSADFAQNKI-UHFFFAOYSA-N	446.529	1.799	50	20	IDGD	
O=C(Cn1ccc([N+](=O)[O-])n1)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	917560022	PZWDMZWAOVPBEE-UHFFFAOYSA-N	447.411	1.011	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)OCC(=O)c2ccc(S(N)(=O)=O)cc2)c1C	918808475	BTBGEZQAVPMNLN-WOJGMQOQSA-N	445.497	1.732	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCc2nc(Cc3ccccc3)no2)c2ccccc2c1=O	921119059	FWBIZFNPUSKIIF-UHFFFAOYSA-N	447.455	1.534	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)CCNC(=O)Cc2ccccc2)CC1	1116083358	HCILPWZFAZLJSO-UHFFFAOYSA-N	432.521	1.530	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NC[C@H](c2ccc(OC)cc2)N2CCOCC2)cc1	1317898984	JFQZXQBXWJSUKU-HXUWFJFHSA-N	428.489	1.721	50	20	IDGD	
CN1CCN(Cc2cccc(CNC(=O)NNC(=O)Cn3ccc4ccccc43)c2)CC1	1318294696	OUIWUVUUCCDLNU-UHFFFAOYSA-N	434.544	1.919	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)COc2ccc3ccc(=O)oc3c2)CC1	1318557507	IXGLVFWFYQFVLZ-UHFFFAOYSA-N	445.472	1.966	50	20	IDGD	
Cc1nc2ccccc2c(=O)n1CC(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1	1322950379	JULMJQSKEPVLQV-UHFFFAOYSA-N	443.504	1.499	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3sc(N(C)C)nc3C)n[nH]2)cc1OC	1323543675	KHRDXXQFIDUYDA-UHFFFAOYSA-N	430.490	2.000	50	20	IDGD	
COc1cc(CNC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc(Cl)c1OC	1347313567	RGWJXKDKPKGIBD-UHFFFAOYSA-N	441.893	1.905	50	20	IDGD	
Cc1ccn2c(=O)c(C(=O)N3CC[C@]4(C3)CN(C(=O)C(Cl)Cl)CCO4)cnc2c1	1777997474	WSTHQFCFGDNSJJ-IBGZPJMESA-N	439.299	1.250	50	20	IDGD	
Cc1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](F)Br)C3)cc(O)n1	1778037186	FRVIVDIZAZCMAQ-QIIPPGSGSA-N	444.301	1.914	50	20	IDGD	
O=C(c1n[nH]c2ccc(F)cc12)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1778624282	JPEMLYBDYLGQJT-PBHICJAKSA-N	443.248	1.836	50	20	IDGD	
O=C(Cc1c(F)cccc1F)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2	1780472296	XORLLYBQEWRNHT-SQGPQFPESA-N	430.879	1.621	50	20	IDGD	
COc1cccc(OC)c1C(=O)N1CC[C@]2(CN(C(=O)CCBr)CCO2)C1	1780538134	FMDNZDLNNQTANI-IBGZPJMESA-N	441.322	1.932	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)NC(=O)OC(C)(C)C)C2	1780707083	HCVLKCISUNITCJ-DHYLWCPWSA-N	447.960	1.361	50	20	IDGD	
COc1nccnc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@](C)(Cl)CCl)C1	1780710121	IRTMBDZWHAXPRP-ZNZDAUKMSA-N	445.347	1.849	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(N4C(=O)C=CC4=O)cc3)CCO2)C1	1781224746	ZYGDXEGMBDPWCJ-JTSKRJEESA-N	445.903	1.577	50	20	IDGD	
O=C(c1cc2cccnn2c1)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781332406	GZSBMDKOOGRLRC-YOEHRIQHSA-N	425.258	1.468	50	20	IDGD	
O=C(c1ccc(O)c([N+](=O)[O-])c1)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781332913	KKUDPYFPXQCWPE-CJNGLKHVSA-N	446.229	1.434	50	20	IDGD	
CCOC(CC(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1)OCC	1781334352	LZUJZFJRCRZKOK-HOCLYGCPSA-N	425.295	1.296	50	20	IDGD	
O=C(c1ccc([N+](=O)[O-])cc1F)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1781554067	OXSMPDIEGXFTIN-BBRMVZONSA-N	448.220	1.868	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnccn1)C2	1781901703	UAQMLLYLACBRGU-DDUZABMNSA-N	425.327	1.778	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(CO)on1)C2	1781902939	LJUMYMZETHIFKJ-DDUZABMNSA-N	444.326	1.468	50	20	IDGD	
Cc1nn(C)c(C)c1CC(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](C)Br)C2)C1	1783538402	CIMLJPKFNNKAQA-SGTLLEGYSA-N	427.343	1.193	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H]1CCCCC1(F)F)CCO2	1783933195	DVPYWIMHBDECJR-HNAYVOBHSA-N	430.496	1.015	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CCc4cccc(Cl)c43)C[C@@H]21)[C@H](O)CCl	1784094765	RBJVKSTYLCLTEI-YDRHNJASSA-N	441.355	1.949	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C=C/c3ccc([N+](=O)[O-])o3)[C@H]2C1	1784219791	KLIOYVJDBCRKNC-ODNVVZAYSA-N	441.868	1.435	50	20	IDGD	
CC(=O)N[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCBr)[C@H]2C1)C(C)(C)C	1786404742	MFGLWCUMFAUXAE-JKQORVJESA-N	446.386	1.302	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3ccsc3)[C@H]2C1	1787022374	WSSKSFMIHIVJMW-BZSNNMDCSA-N	436.578	1.033	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)N3C[C@H]4C[C@H]4C3)[C@H]2C1	1788515837	DRSCXHZJOIWBRN-DPNXGZFNSA-N	428.371	1.090	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3ON=C(c4ccccc4)O3)[C@H]2C1	1788520018	DTQGVTKQLCMHMZ-YJZCJGOMSA-N	435.908	1.718	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C#CC3(O)CCCCC3)[C@H]2C1	1788637480	VQGCDSDAGFEQNU-QAETUUGQSA-N	441.366	1.448	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1ccc(C2(NC(=O)c3ccncc3O)CCC2)cc1	1789521241	VVXORZQVAKBVSU-UHFFFAOYSA-N	446.467	1.847	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3CC[C@H]4CCC(=O)N4C3)[C@H]2C1	1789766930	RJXRLTZNZIMUNL-ATIWLJMLSA-N	439.984	1.632	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CC(c4ccccc4)=NN3)C[C@@H]21	1789865277	OVZFOJYNHLMZNA-TXTPUJOMSA-N	432.952	1.750	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnn4cccc(F)c34)[C@H]2C1	1790520631	QQBXSSBPMXUURF-FAYQHZLMSA-N	438.887	1.321	50	20	IDGD	
Cc1nn(C)c(C)c1CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]2C1	1791064761	JFPUUPQSJGINEY-UMPQAUOISA-N	441.370	1.343	50	20	IDGD	
CCNC(=S)NCC(=O)NC1(c2ccc(NC(=O)[C@@H](Cl)COC)cc2)CCC1	1791570730	CEHQIBQMEOVCRK-HNNXBMFYSA-N	426.970	1.858	50	20	IDGD	
COc1ccc([C@H](O)C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@](C)(Cl)CCl)C3)cc1	1792715638	JIFSDVOTALNITD-ACSCVQKFSA-N	445.343	1.555	50	20	IDGD	
COc1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](O)CCl)c(F)c(OC)c1F	1793114854	NHRIKUIAJPYMGK-LSCVPOLPSA-N	432.851	1.834	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1C[C@@H]1F	1793671645	VCEOYJZYUKHCQS-FETDOPKISA-N	435.408	1.081	50	20	IDGD	
C/C(=C/C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C(=O)O	1794143706	MJHPNZMYNDGIPB-SMOBVYMQSA-N	443.928	1.788	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(Cl)c1	1794734126	PJMCPSOPVZBAPZ-CLLJXQQHSA-N	444.879	1.005	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Cl)C1	1796371213	SUKMXDOTMRGDGW-LJIZCISZSA-N	447.935	1.758	50	20	IDGD	
CS(=O)(=O)Cc1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)C(Cl)Cl)C3)cn1	1796541461	QGVNYNHTMNFLJX-BTTYYORXSA-N	434.345	1.682	50	20	IDGD	
O=C(CCCCn1cccc1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2	1797885980	TXRPUQULEORQFC-FSDCSDTHSA-N	430.318	1.939	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](C)N1C[C@H]2C[C@H]2C1	1798317882	UTQYOJRRQQFBGG-LIQYNLLCSA-N	440.548	1.099	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc3occc3c1O)C2	1798442797	FWNHLLPAEIWAGU-BTTYYORXSA-N	449.467	1.703	50	20	IDGD	
CCCc1onc(C)c1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Br	1799347919	XIVZHUOBSXKHKM-BAESOJJISA-N	432.290	1.829	50	20	IDGD	
CN(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1(C)CC1)C2)NC(=O)NCc1ccccc1	1799864930	TWPVRXYUMKIATM-REPLKXPHSA-N	427.549	1.771	50	20	IDGD	
CCC(=O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](Br)Cc1ccccc1)C2	1800480687	DKWJJEFJDWIPGM-DFGXFYAUSA-N	437.334	1.561	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1c(F)cccc1F)C2	1800760219	JBXOZQSTCBTFIO-PXDYOCJYSA-N	431.277	1.880	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)c2cnco2)[C@@H]1c1cccnc1	1803858024	CNRLBZSIERHGOB-YRJCQSRDSA-N	449.471	1.523	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1ccccc1O	1805195565	CPWRBRXWJUYXMJ-XMSQKQJNSA-N	445.284	1.100	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2cnc(N(C)C)o2)[C@@H]1c1cccnc1	1805345683	IUGHZHCTAGBKEC-VYDXJSESSA-N	435.912	1.709	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC2(CCN(C(=O)[C@H]3CCNC(=O)C3)CC2)C1	1805390056	ZMQXLLPCXVNTTO-GJZGRUSLSA-N	428.371	1.775	50	20	IDGD	
Cc1ccc(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)s1	1805409427	PYONBNQOCIILOW-RXVVDRJESA-N	449.341	1.765	50	20	IDGD	
CC(=O)N/C(C)=C/C(=O)N1CC[C@@H](CNC(=O)CCBr)[C@@H]1c1cccnc1	1806346518	JXKBAXZVQMIHPC-UZLNTIBLSA-N	437.338	1.912	50	20	IDGD	
Nc1ccccc1/C=C/C(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1	1807209727	AKIFRPIYTSYFCJ-RBBWONMDSA-N	428.920	1.983	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)C(Cl)Cl)[C@@H]1c1cccnc1)c1cccn2c(O)nnc12	1808193844	GKAQVYQFPOVLFG-TZMCWYRMSA-N	449.298	1.953	50	20	IDGD	
Cc1ccc(CCC(=O)N2CCC3(CCCN(C(=O)c4ccc(B(O)O)cc4)C3)CC2)cn1	1809969445	WAZZLDBLDHASNL-UHFFFAOYSA-N	449.360	1.547	50	20	IDGD	
N#Cc1ccc(F)c(C(=O)N2CCC3(CCCN(C(=O)c4cccc(B(O)O)c4)C3)CC2)c1	1809980786	SJEBBUOPLSNIRT-UHFFFAOYSA-N	449.291	1.536	50	20	IDGD	
C=CC[C@H](C(=C)C)C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1810171176	FGJWXZFREANYMK-MDNUFGMLSA-N	447.344	1.849	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@H](CNC(=O)[C@H](O)N2CCOCC2)[C@H]1c1cccnc1	1810350320	XXGCSRGVTQLZRA-LMMKCTJWSA-N	438.956	1.003	50	20	IDGD	
COC(=O)NCC(=O)NC[C@@H]1CCN(C(=O)[C@](C)(Cl)CCl)[C@@H]1c1cccnc1	1813266386	IQDGHJHOYAZLIQ-JCKWVBRZSA-N	431.320	1.680	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](O)CCl)n[nH]1	1814874780	DUHNYVHXYMHXPX-STQMWFEESA-N	429.905	1.526	50	20	IDGD	
Cc1c(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)cnn1C	1816565119	JDTIQVCFOMZFJH-INIZCTEOSA-N	430.513	1.131	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H]2CNC(=O)C2)n[nH]1	1821955896	XKNGXYIESWVBPN-MDZLAQPJSA-N	426.315	1.569	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCn1ccnn1)CC2	1822868914	CDSGWUZGHZRARU-QFYYESIMSA-N	431.349	1.973	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)C1CCSCC1	1823544925	PLLHYUNWJYYASR-GOSISDBHSA-N	442.350	1.539	50	20	IDGD	
CN(C)C(=O)NCC(=O)N1CCCC[C@H]1C1CCN(C(=O)CO[Si](C)(C)C)CC1	1823879753	JIGXSRIJPOUMEX-KRWDZBQOSA-N	426.634	1.729	50	20	IDGD	
Cc1nn(C)c(C)c1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1	1824695220	CXFGJSUBEPNCDA-LJQANCHMSA-N	446.596	1.643	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)CN2C(=O)CNC2=O)CC1	1824899330	REYSXCLFIIJSOO-HZPDHXFCSA-N	426.945	1.565	50	20	IDGD	
CCOC(=O)C(C)(C)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](Cl)COC)sc2C1	1826009344	RZVHPAVVMVSCJQ-MNOVXSKESA-N	431.942	1.898	50	20	IDGD	
O=C([C@@H]1C[C@@]1(F)Cl)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827055277	SYIMMCVHKPXLHT-WFXMLNOXSA-N	436.720	1.524	50	20	IDGD	
O=C1Nc2c(cccc2C(=O)N2CCCC[C@H]2C2CCN(C(=O)[C@@H](O)CCl)CC2)C1=O	1828716223	CNGFRQIUCCIAFL-IRXDYDNUSA-N	447.919	1.654	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CN2CCNC2=N)CC1	1830316007	FTTAANHGLQJWSG-DNVCBOLYSA-N	432.396	1.682	50	20	IDGD	
C=CCC(F)(F)C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](C)CBr)CCO2)C1	1830544178	PNCZOWNQNWQCES-CJNGLKHVSA-N	439.297	1.685	50	20	IDGD	
CSCC(C)(C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)Br)C2)C1	1831539535	RMIBGYXSVBOGLG-GUYCJALGSA-N	437.400	1.615	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H]2CCCCN2C)CC1	1831871296	RENIPYWUCOKLQF-PMACEKPBSA-N	435.613	1.463	50	20	IDGD	
C[C@@H](Cc1ccccn1)C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)CCl)CC2)CC1	1833313153	XULYTQCDUBMULB-OXJNMPFZSA-N	436.984	1.432	50	20	IDGD	
Cc1nc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@](C)(Cl)CCl)C3)C2)ccc1F	1833466325	YJONDADDQFBGCS-MOPGFXCFSA-N	448.322	1.835	50	20	IDGD	
Cn1cc(F)cc1C(=O)N1CCOC[C@@]2(CN(C(=O)CCBr)CCO2)C1	1834821699	UMQWWWIGJFPCQT-QGZVFWFLSA-N	432.290	1.019	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3ccsc3)CCO2)C1	1836007358	INABPRWUHQTCHA-KSSFIOAISA-N	445.379	1.921	50	20	IDGD	
Cc1nn(C)cc1C(=O)N1CCC(N2CCC(NC(=O)[C@@H](F)Br)CC2)CC1	1836413725	NFMNFFKNQNGSBA-MRXNPFEDSA-N	444.349	1.604	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3n[nH]c(C)c3F)CC2)CC1	1837330998	HBZYVIFDPODNRT-OAHLLOKOSA-N	430.908	1.723	50	20	IDGD	
C[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1)n1ccccc1=O	1837680370	IQBNLGMAPJSDPS-IIBYNOLFSA-N	439.940	1.131	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(Cl)nc3)C2)C1	1837708394	FQZRBHIYIJQNOE-LJQANCHMSA-N	441.988	1.657	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](C)CBr)C3)C2)ccn1	1837934811	NLGSGPRPGLGYJD-LIRRHRJNSA-N	440.338	1.491	50	20	IDGD	
C=C(Oc1ccccc1O)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](Cl)CC)CCO2	1839144509	CORCTUXISIOLJE-IERDGZPVSA-N	438.908	1.759	50	20	IDGD	
COc1cc(C)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)c(C)c1	1839408353	PTHYZEQXPLJJKM-PXNSSMCTSA-N	428.888	1.916	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccnc4ncccc34)CCO2)C1	1839541301	YCAGMYRGPWSZEH-QFIPXVFZSA-N	446.935	1.965	50	20	IDGD	
CCN(CC)C[C@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)Br)C2)C1	1839680037	VVQTVTOFSFCYLO-FRQCXROJSA-N	448.402	1.204	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccc(C)o3)C2)C1	1839967678	UIZFBWDOSYAXMU-APWZRJJASA-N	443.338	1.760	50	20	IDGD	
Cc1ncc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)s1	1840032588	CPCUNAQLIUORMC-BZNIZROVSA-N	432.340	1.305	50	20	IDGD	
O=C(c1cncc2cnccc12)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840188979	PFJVLDJMCZIUTQ-IBGZPJMESA-N	439.299	1.504	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(F)(F)Cl)CCO2	1840283214	QEAGSQNSNORKKG-MFKMUULPSA-N	433.677	1.305	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)cc1	1840728134	MRBQJYBZZXICIO-LJQANCHMSA-N	444.315	1.519	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)COc3ccccc3C#N)CCO2)C1	1840817999	FHZQDQSANGVKAM-JOCHJYFZSA-N	449.935	1.658	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)c2ccc(N3CCN(C)CC3)cc2)C1	1841036651	RZOOEOSDEFPJKB-LJQANCHMSA-N	434.968	1.509	50	20	IDGD	
O=C1CC[C@H](C(=O)N2CCCC23CN(C(=O)[C@H](Br)Cc2ccccc2)C3)CN1	1841115049	YWRTUQABHPZCSO-DLBZAZTESA-N	448.361	1.722	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)c2conc2C)C1	1842493954	OJLSQRRYIFFMIX-UHFFFAOYSA-N	428.401	1.947	50	20	IDGD	
O=C([C@@H](O)CCl)N1CC2(CCCN2C(=O)c2cn3c(Br)cccc3n2)C1	1844149436	YLDFQPWIFQCJMT-LBPRGKRZSA-N	441.713	1.514	50	20	IDGD	
Cc1cnc(Cl)c(C(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)c1	1844263791	WDCHMVSRMXCHPF-UHFFFAOYSA-N	428.880	1.173	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCCC12CN(C(=O)[C@H]1CN(Cc3ccccc3)CCO1)C2	1844378187	PPFCIQXLZMTKKD-HXUWFJFHSA-N	445.636	1.942	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)c2c(Cl)cccc2Cl)C1	1844865223	OSHVRYKRKXDCGR-UHFFFAOYSA-N	433.100	1.804	50	20	IDGD	
O=C(c1ccc(OCCCO)cc1)N1CC2(CCCN2C(=O)[C@H](F)Br)C1	1845218547	LTTPMFUYNRHFCZ-HNNXBMFYSA-N	429.286	1.955	50	20	IDGD	
CC(=O)N/C(C)=C/C(=O)N1CCCC12CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2	1845752498	CODQLBVCVZVXFX-UKTHLTGXSA-N	444.444	1.377	50	20	IDGD	
C[C@@H]1CC[C@@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](O)CCl)CN1C(=O)OC(C)(C)C	1847240977	RXAUFWLATLPNLU-UHDSXZAQSA-N	443.972	1.824	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)CS[C@H](C)C(=O)Nc2cc(C)on2)cc1	10567821	KZFOJJLPFUEMPU-CYBMUJFWSA-N	434.474	1.356	50	20	IDGD	
Cc1c(/C=C(\C#N)C(=O)OCC(=O)Nc2ccc(S(C)(=O)=O)cc2)cc(C#N)n1C	10958149	KIKMEPXIDUPXCW-OVCLIPMQSA-N	426.454	1.698	50	20	IDGD	
O=C(COC(=O)Cc1ccc(Br)cc1)NNC(=O)c1cccc([N+](=O)[O-])c1	11445213	GKDKFUYMBHMNKA-UHFFFAOYSA-N	436.218	1.904	50	20	IDGD	
Cc1ccc(-c2n[nH]c(=S)n2CC(=O)NNC(=O)c2n[nH]c(=O)c3ccccc23)cc1	17195652	BRZDTANQUJZQJG-UHFFFAOYSA-N	435.469	1.614	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)/C(=C/c2cccc(F)c2)n2nnnc2C)cc1	23579832	UIKYEHWMUMGCHB-WQRHYEAKSA-N	438.419	1.432	50	20	IDGD	
O=C(Cn1c(S)nnc1-c1ccc(Cl)cc1)NNC(=O)[C@@H]1COc2ccccc2O1	26977028	LHRDMEAEBVIWJQ-HNNXBMFYSA-N	445.888	1.875	50	20	IDGD	
Cc1oc2ncn(C)c(=O)c2c1C(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12	28580869	CODMASWUOYEPEF-UHFFFAOYSA-N	436.428	1.201	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)CN1C(=O)N[C@](C)(c2ccc(F)cc2)C1=O	28698369	BMPZUWHBTRAYSH-OAQYLSRUSA-N	438.419	1.010	50	20	IDGD	
O=C(CCCn1cccn1)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	109388182	XVTKJVYNIMHBIK-UHFFFAOYSA-N	441.513	1.603	50	20	IDGD	
COc1ccc(/C=C\C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1OC	220821694	NVXSLYZWENWJBB-WMZJFQQLSA-N	429.385	1.630	50	20	IDGD	
COCCCNC(=S)N(C)NC(=O)c1cc(S(=O)(=O)N2CCCCC2)ccc1C	726076580	YKNPJOPXKAEHCR-UHFFFAOYSA-N	442.607	1.657	50	20	IDGD	
CC(C)NC(=O)C(=O)NNC(=O)c1cccc(S(=O)(=O)N[C@@H](C)c2ccccc2)c1	726614931	XUDCSTOJNWQCKR-AWEZNQCLSA-N	432.502	1.012	50	20	IDGD	
CC(=O)N[C@H](CC(=O)NNC(=O)Cc1nc2ccccc2n1C)c1c(F)cccc1F	727365321	PRLYXHYUHAJECX-MRXNPFEDSA-N	429.427	1.809	50	20	IDGD	
C#Cc1cccc(NC(=S)NNC(=O)c2cc(S(=O)(=O)N3CCSCC3)c[nH]2)c1	727500469	XWMKRPZRUMVKCD-UHFFFAOYSA-N	449.583	1.365	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)Cc2nc3ccccc3n2C)ccc1OCC(=O)OC	728511260	GPHMSUBVHAFNMI-UHFFFAOYSA-N	440.456	1.528	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2cc(F)ccc2Br)cc(S(N)(=O)=O)c1C	728611925	GFBJWDFFUREBBL-UHFFFAOYSA-N	444.282	1.927	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CC[C@H](NC(=O)OC(C)(C)C)C1	730262472	VANWHHDIXFMGLG-ZDUSSCGKSA-N	426.901	1.709	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCOCC2)cc1)c1ccccc1	731998198	ZQRJPMILKVRSEU-IBGZPJMESA-N	431.514	1.662	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cnc3n(c2=O)CCS3)cc1Br	732175685	NNJVJBNIBCJZPH-UHFFFAOYSA-N	425.264	1.195	50	20	IDGD	
Cc1ccccc1-n1nc(C(=O)NNC(=O)CCN2C[C@H](C)O[C@H](C)C2)c2c1CCC2	732263079	ZVGLRVUYSQYNAC-CALCHBBNSA-N	425.533	1.930	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2cn(-c3ccccc3C(F)(F)F)nn2)C[C@H](C)O1	732263138	KSAFPRDBHVUFBC-STQMWFEESA-N	440.426	1.546	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)[C@@H]1CC(=O)N(Cc2ccccn2)C1	734252421	SFKWQUHRGDWNCS-OAHLLOKOSA-N	445.545	1.650	50	20	IDGD	
C[C@@H](CN1CCN(c2ccccn2)CC1)NC(=O)NNC(=O)c1cc2c(s1)CCC2	735518357	IWRPNIOXXBCOAK-HNNXBMFYSA-N	428.562	1.787	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2cc3c(s2)CC[C@H](C)C3)nc2c1c(=O)n(C)c(=O)n2C	737767528	FDIHQRKQPACEEQ-JTQLQIEISA-N	441.513	1.202	50	20	IDGD	
C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)NNC(=O)CNC(=O)c1cccs1	740913043	MAAXRVSRYUAEDN-MRXNPFEDSA-N	429.546	1.815	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)NCc2cc(F)ccc2N2CCOCC2)nc2ccccc21	741092568	GSGIASTXSHENLI-UHFFFAOYSA-N	440.479	1.622	50	20	IDGD	
CCCn1c(C)cc(/C=C(/C#N)C(=O)Nc2cnn(CC(=O)NCCN(C)C)c2)c1C	741608897	WYDLROWIBAWBEL-ODLFYWEKSA-N	425.537	1.935	50	20	IDGD	
Cc1nn(C)c(C)c1S(=O)(=O)N[C@@H](C)C(=O)NNC(=O)c1ccc2ccccc2c1	742049007	UBHWWUNGVYGPGW-ZDUSSCGKSA-N	429.502	1.318	50	20	IDGD	
O=C(CCN1C(=O)[C@H]2[C@H](C1=O)[C@H]1CC[C@H]2O1)NNc1c(F)cc(F)cc1Br	742707662	CDFLUQBXIZIODO-HBJVGIJOSA-N	444.232	1.723	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)N[C@@H]1CCCN(c2ccccc2Cl)C1	743512195	SGTJJJBNGGSQQS-OAHLLOKOSA-N	440.895	1.929	50	20	IDGD	
C[C@H]1CCCN(CCCCNC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)C1	743547721	FFPATHJKPLOIBO-HNNXBMFYSA-N	425.555	1.938	50	20	IDGD	
CCCNC(=O)Nc1ccc(CC(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)cc1	744919071	RUOZYQJQFZVVFJ-UHFFFAOYSA-N	437.456	1.637	50	20	IDGD	
CC(=O)N[C@@H](CC(=O)OCC(=O)NNC(=O)c1cccc(C)c1)c1c(F)cccc1F	744942138	QGRJDXSASZSHPC-KRWDZBQOSA-N	433.411	1.845	50	20	IDGD	
C[C@@H](CC(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)C(=O)c1cccc(F)c1	746086906	MMITWXROXXWNND-LBPRGKRZSA-N	431.376	1.947	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)N[C@@H]1CCCN(CC(F)(F)F)C1=O	746340125	VJYHWGDPRQPVAO-GFCCVEGCSA-N	440.382	1.075	50	20	IDGD	
Cc1c(Br)cccc1S(=O)(=O)NNC(=O)CNC(=O)c1cccs1	747611184	IGJOLAZUXXVIIG-UHFFFAOYSA-N	432.321	1.559	50	20	IDGD	
Cc1nc(C)c(CC(=O)NNc2ccc(S(=O)(=O)Nc3nccs3)cc2)c(O)n1	747944028	MXVXYIOYVOQXNT-UHFFFAOYSA-N	434.503	1.742	50	20	IDGD	
CC[C@H](NC(=O)NNC(=O)C(=O)N1CCCC1)c1ccccc1OCC(=O)N1CCCC1	748458475	AAJKSRWWEJUPCI-KRWDZBQOSA-N	445.520	1.092	50	20	IDGD	
O=C(NNc1nc(Br)cn2ccnc12)[C@@H]1CC(=O)N(Cc2ccccc2)C1	750249806	KIAHFRYZAWFCEG-CYBMUJFWSA-N	429.278	1.984	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=S)N[C@H](C)C3CC3)CC2)cc1C	751620184	GTKBCZSFNYHAEN-OAHLLOKOSA-N	438.619	1.998	50	20	IDGD	
CO[C@@H](C)c1nc(CN2CCCN(CC(=O)NNC(=O)c3cccs3)CC2)cs1	752356133	USDGPHLJJOMYSQ-AWEZNQCLSA-N	437.591	1.881	50	20	IDGD	
Cn1c(NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)nc2ccccc2c1=O	752909585	XEVQOFFQHXZCLZ-UHFFFAOYSA-N	427.486	1.475	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)NCC2(CO)CCC2)cc1	753289164	AHENDNBWAGSRPQ-BOPFTXTBSA-N	437.500	1.620	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cccc(Br)c2)sc1S(N)(=O)=O	754204563	LXHWQKDMRMDSGO-UHFFFAOYSA-N	434.293	1.241	50	20	IDGD	
N#Cc1ccc(NNC(=O)c2ccc(S(=O)(=O)CC(N)=O)cc2)cc1C(F)(F)F	754430248	CDMHKVUITHPKQQ-UHFFFAOYSA-N	426.376	1.593	50	20	IDGD	
Cc1cc(NC(=O)COC(=O)/C(C#N)=C/c2ccc(O)cc2)n([C@H]2CCS(=O)(=O)C2)n1	754552010	ZOBBVOQVVVHBJZ-LRQZKABGSA-N	444.469	1.346	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)Nc1ccc(N2CCSCC2)c(Cl)c1	756279758	GWYVSJYDMBPXMX-NSHDSACASA-N	432.955	1.481	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1ccc(Oc2ccc(Cl)nn2)cc1	756561107	BIGHYQILWZUFQX-VIFPVBQESA-N	428.858	1.013	50	20	IDGD	
COCCNC(=O)Cn1cc(NC(=O)NNC(=O)c2c(Cl)cccc2Cl)cn1	756843729	HZTHFCBBFYCOHV-UHFFFAOYSA-N	429.264	1.419	50	20	IDGD	
COc1ccccc1N1CC[C@@H](NC(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)C1=O	757291904	KSXMNHCVFZBOFS-CZUORRHYSA-N	430.436	1.738	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)NNC(=O)Cc2ccc(F)cc2)cc(S(C)(=O)=O)c1	757608871	KDGYKPCCOVCQEY-UHFFFAOYSA-N	437.449	1.801	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2cnc(Cl)c(C)c2)cc1	757631360	ZKUBMLRUSFFBRY-UHFFFAOYSA-N	425.898	1.825	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)CN2C(=O)NC3(C[C@@H](C)C[C@H](C)C3)C2=O)cc1	757640318	UQEQNEPFZITDKD-GJZGRUSLSA-N	430.505	1.522	50	20	IDGD	
CCCN(C(=O)c1ccccc1NC(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)C(C)C	757738525	NXKMZQBBTHFNGT-CYBMUJFWSA-N	427.527	1.038	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc1S(C)(=O)=O	757780865	UUKQNOVNZYFIEG-UHFFFAOYSA-N	429.458	1.756	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)c1cnc(OCc2ccccc2)cn1	758011865	XFRWRGWSIRYJHS-UHFFFAOYSA-N	439.859	1.786	50	20	IDGD	
CCO[C@H](C)c1ncc(C(=O)N2CCN(S(=O)(=O)CBr)CC2)s1	758528876	YSAUVDRDUBHOAU-SNVBAGLBSA-N	426.358	1.681	50	20	IDGD	
O=C(NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)NNC(=O)c1cc2c(s1)CCC2	758693707	XUDPMLPORWEQAJ-UHFFFAOYSA-N	438.487	1.563	50	20	IDGD	
CCn1c(SCC(=O)NNC(=O)C(=O)Nc2ccccn2)nnc1-c1ccccc1C	758839014	KVQMHPSYGSBAEH-UHFFFAOYSA-N	439.501	1.547	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNS(=O)(=O)c2ccc([N+](=O)[O-])c(OC)c2)cc1	759164279	QISZUSRUNTZHIW-GFCCVEGCSA-N	439.446	1.779	50	20	IDGD	
Cc1cc(C)nc(-n2nccc2NC(=O)C(=O)NNC(=O)c2cccc3ccccc23)n1	760277543	MUABVLBVDSFIQW-UHFFFAOYSA-N	429.440	1.832	50	20	IDGD	
O=C(NNC(=O)c1cccc(-n2ccc(C(F)(F)F)n2)c1)N[C@@H]1CCS(=O)(=O)C1	760446374	NYSQMCNXDHXQIY-LLVKDONJSA-N	431.396	1.022	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NN=C1C[C@H](C)N(C)C1)N(S(C)(=O)=O)CC2	761805908	YEBRKXYVMPBJJE-SUMWQHHRSA-N	438.550	1.149	50	20	IDGD	
CCCCS(=O)(=O)N1CCC[C@H]1C(=O)NNC(=O)CSc1ccccc1OC	762408272	KIWGHHAAGOONIA-AWEZNQCLSA-N	429.564	1.529	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)C(=O)Nc1cccc(C(=O)N2CCCCC2)c1	763443739	OKQGRKYVJJYZST-UHFFFAOYSA-N	439.428	1.621	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2cc(-c3ccncc3)nc3ccccc23)cnn1C	763538116	JIJBBBKIYNZIPD-UHFFFAOYSA-N	429.440	1.738	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)C(=O)Nc1cccnc1Cl	763693901	CQGTWYXJZUCRFN-UHFFFAOYSA-N	427.642	1.662	50	20	IDGD	
CO[C@H](C)c1cccc(NC(=O)C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1	763718269	JHVSDIZRMVUVKL-CYBMUJFWSA-N	448.501	1.044	50	20	IDGD	
O=C(CN1CCCc2ccccc21)NNC(=O)C(=O)Nc1ccccc1O[C@@H]1CCOC1	763729411	YQNWEZQDQHDVHF-QGZVFWFLSA-N	438.484	1.393	50	20	IDGD	
CCC(=O)Nc1ccc(C)c(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)c1	763745968	LXLMRKFQNZVZTP-UHFFFAOYSA-N	437.500	1.882	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cnc3c(c2)COCC3)cc1	763767126	GBDFTKGCCZTNAP-UHFFFAOYSA-N	426.473	1.979	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)C(=O)Nc1cccc(Cn2cccn2)c1	763804626	UXVRSWIEZJVVIR-UHFFFAOYSA-N	438.400	1.005	50	20	IDGD	
CN(C)c1ccc(C(F)(F)F)cc1NC(=O)C(=O)NNC(=O)COc1ccccc1C#N	763809540	WLYOIWCJKLPFKD-UHFFFAOYSA-N	449.389	1.808	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)C(=O)Nc1ccc(-n2ccnc2)nc1	763849874	LPELXIVRDIXPBB-OAHLLOKOSA-N	444.451	1.974	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)C(=O)Nc1cnn(-c2ncccn2)c1	763852319	HTIKDCUYQUCMIE-CQSZACIVSA-N	445.439	1.369	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2cccc(CC(=O)OC(C)(C)C)c2)n1	763880133	BFLHIIAAHPWYJJ-UHFFFAOYSA-N	429.477	1.170	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccc(N3CCCCC3)c(Cl)c2)n1	763892965	PBHFJJILDNNVAO-UHFFFAOYSA-N	432.912	1.930	50	20	IDGD	
CC1CCN(C(=O)c2ccc(NC(=O)C(=O)NNC(=O)Cc3ccsc3)cc2)CC1	764024375	DQQDKHIZELDJNW-UHFFFAOYSA-N	428.514	1.949	50	20	IDGD	
O=C1CCc2ccc(NC(=O)C(=O)NNC(=O)c3cccc(Br)c3)cc2N1	764059781	ZAIGYWMROHQFLY-UHFFFAOYSA-N	431.246	1.734	50	20	IDGD	
O=C(NNC(=O)c1cccc(Br)c1)C(=O)Nc1cnn(Cc2ccccn2)c1	764063286	NBIMBYNUPUZHGH-UHFFFAOYSA-N	443.261	1.489	50	20	IDGD	
CN1CCCCC/C1=N\S(=O)(=O)c1cccc(NC(=O)C(=O)NNC(=O)C2CCC2)c1	764341752	JARBJGSKTHHBBY-JJIBRWJFSA-N	449.533	1.166	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)C(=O)Nc2ccc(-c3n[nH]c(-c4ccccc4)n3)cc2)cn1	764359524	UWGHNYRMUZHMRD-UHFFFAOYSA-N	430.428	1.272	50	20	IDGD	
Cc1cc(C)n(-c2ccc(C(F)(F)F)cc2NC(=O)C(=O)NNC(=O)c2cnn(C)c2)n1	764363945	XGUOKWLLZUDMEE-UHFFFAOYSA-N	449.393	1.641	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cc(F)ccc3C)n[nH]2)cc1OC	764377379	CVHSRHACHLBZGV-UHFFFAOYSA-N	441.419	1.941	50	20	IDGD	
CCOc1cc2c(cc1NC(=O)C(=O)NNC(=O)CSc1ccccc1O)O[C@@H](C)C2	764394239	QFHHXMKIGINXAI-LBPRGKRZSA-N	445.497	1.993	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)c3cc(S(=O)(=O)N(C)C)c(C)o3)n[nH]2)cc1	765575134	FNPONHKUJYIXGZ-UHFFFAOYSA-N	445.501	1.866	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)[C@@H](C)NC(=O)C3CCCCC3)n[nH]2)cc1OC	765596139	GIGXZQYYWAKYLB-CYBMUJFWSA-N	443.504	1.940	50	20	IDGD	
C[C@H]1C[C@H]1c1ccc(CCC(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)o1	766642898	OOYUMKUIOQJKRW-FXAWDEMLSA-N	438.528	1.941	50	20	IDGD	
O=C(NNc1ncnc2ccsc12)c1ccc(S(=O)(=O)NC[C@@H]2CCCO2)cc1	766674670	XLPLAOYAWYGNTG-ZDUSSCGKSA-N	433.515	1.906	50	20	IDGD	
COc1cc(/C=C/C(=O)OCC(=O)NNC(=O)Cc2ccccc2C)cc(OC)c1O	767353793	OUPWKRRLJRBGKW-CMDGGOBGSA-N	428.441	1.664	50	20	IDGD	
Cc1ccc(S(N)(=O)=O)c(C(=O)NNC(=O)c2cc(-c3cc(C)ccc3C)[nH]n2)c1	767886517	HZGLHOUJEMMWKU-UHFFFAOYSA-N	427.486	1.724	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)CN3C(=O)[C@H]4[C@H]5C=C[C@@H](C5)[C@H]4C3=O)n[nH]2)cc1	768268735	UHQZHWXHBQZXBO-HZVDNRATSA-N	433.468	1.207	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)CN2C(=O)N[C@@]3(CCCC(C)(C)C3)C2=O)cc1C	768561154	ULJAHSIJTMDZSM-JOCHJYFZSA-N	430.505	1.720	50	20	IDGD	
CSCCNC(=S)NNC(=O)c1ccc(C)c(S(=O)(=O)N2CCCCC2)c1	769765590	MQXPOJXXJNRDKE-UHFFFAOYSA-N	430.621	1.642	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1S(=O)(=O)NC(C)C	770428194	VRYGRJGIUWMCIS-UHFFFAOYSA-N	449.485	1.228	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)c2cnc(C(=O)OC)cn2)c2ccccc2c1=O	770548334	CVWBUSDMIVRBKB-UHFFFAOYSA-N	438.444	1.238	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NCCc2cn(C)c3cc(F)ccc23)c2ccccc2c1=O	771379144	WWLIOJCQVWFESA-UHFFFAOYSA-N	436.447	1.751	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)N[C@H]2CC(=O)N(C3CCCCC3)C2)nc1	772550741	UDUBSPZXIXKYMZ-AWEZNQCLSA-N	438.554	1.328	50	20	IDGD	
CC(C)(CCCO)CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	772629877	QPNGWKQPTNGTET-UHFFFAOYSA-N	426.539	1.214	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cnn(C3CCCC3)c2C)cc(OC)c1OC	773511487	NCQNGBQTYOMNJK-UHFFFAOYSA-N	445.476	1.732	50	20	IDGD	
O=C(NNc1cccc(Cl)c1)C(=O)N1C[C@@H](C(=O)N2CCOCC2)Oc2ccccc21	773741944	YFHOVQMWLBRDTK-SFHVURJKSA-N	444.875	1.436	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCC(Oc3ncccc3F)CC2)cc1OC	773980563	DCWBJABDWPUGLW-UHFFFAOYSA-N	432.452	1.542	50	20	IDGD	
CCC(=O)NNS(=O)(=O)c1cc(C(=O)O)c(Br)cc1Br	775670208	WIRFHBKHRSMMEB-UHFFFAOYSA-N	430.074	1.629	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)Nc2ccnn2[C@H]2CCS(=O)(=O)C2)c2ccccc2n1	776059790	RPNJPZLFAHWMMD-ZDUSSCGKSA-N	428.474	1.566	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2N2CCOCC2)c1	776107056	KSCLSBYDAVTNMJ-UHFFFAOYSA-N	429.433	1.313	50	20	IDGD	
COCCOc1cc(C(=O)NNC(=O)c2cc(-c3ccc(OC)c(OC)c3)[nH]n2)ccn1	777439387	GFLGQEBSOCACMD-UHFFFAOYSA-N	441.444	1.589	50	20	IDGD	
O=C(CNC(=O)c1cccc(O)c1)NNC(=O)COc1ccc(OCc2ccccc2)cc1	778290881	RKPAJZOSGJBOGA-UHFFFAOYSA-N	449.463	1.927	50	20	IDGD	
COc1ccccc1-c1noc([C@@H](C)NC(=O)NNC(=O)CNC(=O)OC(C)(C)C)n1	778681393	BKKHWNDYWOJAID-LLVKDONJSA-N	434.453	1.661	50	20	IDGD	
O=C(NNc1ncc(F)cn1)c1cc(I)ccc1N1CCOCC1	779036584	PAGQDGUDOBRFRW-UHFFFAOYSA-N	443.220	1.814	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)N1CCC[C@H](S(=O)(=O)N2CCc3ccccc32)C1	779624668	QLOZTHZRZNYOGJ-AEFFLSMTSA-N	436.578	1.425	50	20	IDGD	
O=C(CSc1ccccc1O)NNS(=O)(=O)[C@@H]1CCCN(C(=O)C2CCCC2)C1	781533036	WVFDWLHFUSIREC-OAHLLOKOSA-N	441.575	1.616	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCc2ccccc2CN2CC[C@H](O)C2)cc1OC	781780593	IBNXXYPPMWHQOA-SFHVURJKSA-N	428.489	1.415	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ccc(Br)cc2)cc1S(N)(=O)=O	783009224	JSDZOCHOCSHPOX-UHFFFAOYSA-N	427.280	1.487	50	20	IDGD	
CSc1nnc(CNC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)s1	783059001	IHNHJQVAJBPPFI-UHFFFAOYSA-N	435.579	1.303	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2cc(C#N)ccc2Cl)nc1	783264346	NCYFUVGHWHNJQC-UHFFFAOYSA-N	436.881	1.375	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ccc(F)cc2Br)cc1S(N)(=O)=O	784803280	JQPDGQIPOLLKSO-UHFFFAOYSA-N	445.270	1.626	50	20	IDGD	
CN(C)c1nccc(NNC(=O)C(=O)Nc2cc(Cl)ccc2OC[C@@H]2CCOC2)n1	784969908	CLKQXBUMEGKKGD-GFCCVEGCSA-N	434.884	1.693	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)Nc1cccc(Cl)c1-n1cccn1	785023674	NRZZPSZYNSVYOM-UHFFFAOYSA-N	444.791	1.539	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1ccc(-c2csnn2)cc1	785336915	CIQUJPPHHDFRPJ-UHFFFAOYSA-N	447.498	1.699	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)C(=O)Nc1cc(F)cc(F)c1Br	785987651	FVYFFEMWFYWOCG-UHFFFAOYSA-N	442.172	1.856	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2cccc(S(C)(=O)=O)c2)cc1C(=O)N(C)C(C)C	787541859	VQIGGAILRLSHSV-UHFFFAOYSA-N	446.529	1.961	50	20	IDGD	
C[C@@H]1CN(C2CCOCC2)CCN1C(=O)NNC(=O)c1cccc(Br)c1	787859543	RKGKTPUALVWECZ-CYBMUJFWSA-N	425.327	1.989	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])c(C)c1	788158398	HWKIPKJVYJIKJA-INIZCTEOSA-N	436.465	1.444	50	20	IDGD	
CCNC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1C	789731204	BFTVIQHXWXZKJS-KRWDZBQOSA-N	441.444	1.062	50	20	IDGD	
O=C(NNC(=O)c1ccc(F)cc1Br)C(=O)Nc1nc2c(s1)CCC2	789733385	LFKPAAQWRVXPEW-UHFFFAOYSA-N	427.255	1.933	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1ccc(O[C@H]2CCOC2)cc1	789971503	UKTUDQVONFFQBD-SFHVURJKSA-N	447.513	1.632	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)[C@@H](C#N)Cc2ccc(C#N)cc2)c2ccccc2c1=O	791457970	JDSLAVFBZACXRG-QGZVFWFLSA-N	428.452	1.822	50	20	IDGD	
O=C(NNc1cc(Cl)cc(Cl)c1)C(=O)Nc1ccn(CC(=O)N2CCOCC2)n1	792435964	ZTOVHDRFBABPER-UHFFFAOYSA-N	441.275	1.131	50	20	IDGD	
COCC1(C(=O)NNc2nc(O)c3cnn(C)c3n2)CCN(C(=O)OC(C)(C)C)CC1	793501182	NBHCLBNEZZULIP-UHFFFAOYSA-N	435.485	1.176	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)c2cccc(OC)c2O)c(Br)c1	794581355	HQFUZIHQTFEKKE-UHFFFAOYSA-N	431.264	1.795	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2c(F)c(F)cc(F)c2F)c1	795294583	URMINQMQCSRQAK-UHFFFAOYSA-N	426.369	1.270	50	20	IDGD	
O=C(CN1CCCC[C@@H]1COC(=O)N[C@H]1CCOC1)NNC(=O)c1cccc(Cl)c1	796548534	NGMVNYUIASKPMA-DLBZAZTESA-N	438.912	1.471	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)CNC(=O)OCc2ccccc2)cc1N1CCNC1=O	797650789	FDJSDWQINQBRFX-UHFFFAOYSA-N	440.460	1.604	50	20	IDGD	
CN1C(=C(C#N)C(=O)CN2C(=O)c3cc(F)ccc3S2(=O)=O)N(C)c2ccccc21	799913791	YSOQOLFQBSCPAK-UHFFFAOYSA-N	426.429	1.861	50	20	IDGD	
O=C(COC(=O)c1nn(-c2ccc(F)cc2)cc1O)NNC(=O)c1ccc([N+](=O)[O-])cc1	801326162	WNTJGCCPPKWXOD-UHFFFAOYSA-N	443.347	1.243	50	20	IDGD	
O=C(CCC(=O)c1ccc(I)cc1)NNC(=O)N=c1cc[nH]cc1	802024748	JVWLXPUIDHNERV-UHFFFAOYSA-N	438.225	1.924	50	20	IDGD	
O=C(CSc1nnnn1CC(F)(F)F)NNC(=O)Nc1ccc(OC(F)F)cc1	802045475	NGORGZATIRSEHP-UHFFFAOYSA-N	441.342	1.782	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1ccc(C(N)=O)c(Cl)n1	805574039	HDYISEMMTVUMFX-UHFFFAOYSA-N	441.227	1.114	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)CCc2ncc[nH]2)c1	806338022	KARWOFKESJUMTC-UHFFFAOYSA-N	443.485	1.613	50	20	IDGD	
COC(=O)c1cc(C)c(NC(=O)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c(Cl)c1	806972279	OLFZMZDARKCNJB-UHFFFAOYSA-N	434.792	1.743	50	20	IDGD	
COC(=O)c1c(C)csc1NC(=O)C(=O)NNC(=O)COc1ccc(Cl)cc1	806974079	SUNRNHGDGZILHM-UHFFFAOYSA-N	425.850	1.661	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)c1ccc(S(=O)(=O)Nc2nccs2)cc1	807369311	VJPBCTWKWPMJBT-UHFFFAOYSA-N	442.519	1.494	50	20	IDGD	
COc1cccc2c(C(=O)NNC(=O)c3ccc(S(=O)(=O)N4CCCC4)cc3)n[nH]c12	809558877	VTMPQDJHZIGCDU-UHFFFAOYSA-N	443.485	1.431	50	20	IDGD	
O=C(CNS(=O)(=O)c1cccnc1)NNC(=O)c1ccc(-c2ccc(F)cc2)s1	809983549	NCECHHBIFKVQHL-UHFFFAOYSA-N	434.474	1.689	50	20	IDGD	
CNC(=O)c1cc(Oc2ccc(NC(=O)NNC(=O)c3c[nH]nc3C)cc2F)ccn1	810312305	MQCGVYOFYOJMHB-UHFFFAOYSA-N	427.396	1.871	50	20	IDGD	
O=C(CCSc1ccc(F)cc1)NNC(=O)C(=O)N1CCN(c2ccccc2)CC1	812450392	GXFDKSYPYOACFP-UHFFFAOYSA-N	430.505	1.804	50	20	IDGD	
Cc1c(C(F)(F)F)nn(C)c1NC(=O)C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	813033656	DZZVYGFIYPPBCE-UHFFFAOYSA-N	448.427	1.079	50	20	IDGD	
O=C(NNC(=O)c1ccc[nH]1)C(=O)Nc1cc(Cl)ccc1I	815566863	HSNSLGFTUHMQQV-UHFFFAOYSA-N	432.605	1.672	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCO1)C(=O)Nc1ccc(C(=O)NCc2ccc(F)cc2)cc1	815779387	CVNISMLTYGQNGZ-QGZVFWFLSA-N	428.420	1.021	50	20	IDGD	
CN1C(=O)c2ccc(S(=O)(=O)NNC(=O)c3ccc(Br)s3)cc2C1=O	861653847	LRONBONZRKQPKW-UHFFFAOYSA-N	444.288	1.360	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)NC2CCCC2)c1)c1cccc([N+](=O)[O-])c1	913465523	KCJBNXQJMQITRH-UHFFFAOYSA-N	432.458	1.891	50	20	IDGD	
CC(=O)Nc1cccc([C@H](C)NC(=O)NNC(=O)c2csc(N3CCOCC3)n2)c1	913628102	VSPZDUGHKVPUAS-LBPRGKRZSA-N	432.506	1.643	50	20	IDGD	
COc1cccc([C@H](CNC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)N(C)C)c1	915902678	ZMFFIXKAUZLAJW-SFHVURJKSA-N	438.488	1.189	50	20	IDGD	
CC(C)CN1CCO[C@H](CNC(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)C1	915923000	SDXACAZTYAASCN-MRXNPFEDSA-N	444.536	1.278	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)[C@@H]2CCN(c3ccccc3Br)C2=O)n1	916140037	SZTAMPZDTRFTAY-ZDUSSCGKSA-N	434.294	1.463	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NC[C@H]2COc3ccccc3C2)nc1	916198850	FVYBIIAEAYVSHT-HNNXBMFYSA-N	433.534	1.990	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)NCC1(NS(C)(=O)=O)CCCCC1	916253856	PGKIIABPQCVLCZ-UHFFFAOYSA-N	426.539	1.210	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCCNc1ncccc1C#N	916641322	VFKZLGXDSSJJDS-LBPRGKRZSA-N	447.293	1.926	50	20	IDGD	
CCCN(C(=O)[C@H](C)OC(=O)/C(C#N)=C/c1ccc(OC)cc1)[C@H]1CCS(=O)(=O)C1	916726282	CYLLEBVULHQBLV-CEWLDGSWSA-N	434.514	1.960	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cc(C(=O)NNC(=O)[C@H](C)OC)ccc1Cl	917697664	HNDZLLMKKIVJJX-NSHDSACASA-N	441.893	1.945	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)CN2C(=O)N[C@]3(C[C@H](C)CC(C)(C)C3)C2=O)cc1	919836505	VFHSCJZIRBSWKR-CMJOXMDJSA-N	444.532	1.912	50	20	IDGD	
Cc1ccc2nc(CSCC(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)cn2c1	920276315	UXOLMMIHEQGIAX-UHFFFAOYSA-N	436.497	1.584	50	20	IDGD	
CCOCCOc1ccc(S(=O)(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)cc1	920394950	IRDFTPHLTGLHEB-UHFFFAOYSA-N	435.502	1.667	50	20	IDGD	
C#CCNC(=O)/C(C#N)=C/c1cn(CCC(N)=O)nc1-c1cccc(Br)c1	920429824	ABFMXVAYBRTWJX-NTEUORMPSA-N	426.274	1.844	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCC(=O)NNC(=O)COc2ccccc2CC)cc1	1115818954	UAAKMZWQHDQCQP-UHFFFAOYSA-N	435.502	1.152	50	20	IDGD	
COc1ccc(C(=O)NNS(=O)(=O)c2cc(Br)cc(C(=O)O)c2F)cc1	1115983780	YNWAPZRETPKQFB-UHFFFAOYSA-N	447.238	1.918	50	20	IDGD	
COc1cc(CC(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)cc(OC)c1O	1116859525	KUVFDUVMGQWXHE-UHFFFAOYSA-N	437.493	1.746	50	20	IDGD	
Cc1c(C(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)cnn1-c1ccncc1	1253769054	KJODULUXPBFBEC-UHFFFAOYSA-N	443.508	1.919	50	20	IDGD	
O=C(NNC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1)c1csc(N2CCOCC2)n1	1319036242	AJMQMJRQNSYHPE-UHFFFAOYSA-N	432.462	1.301	50	20	IDGD	
CC(=O)Nc1ccc(NS(C)(=O)=O)c(C(=O)NNc2cncc(Br)c2)c1	1323065868	FCOUMWLWWAVCDE-UHFFFAOYSA-N	442.295	1.931	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2ccc(Cl)cc2F)cc1	1343533215	QLPBWUHIYSHPAA-UHFFFAOYSA-N	429.857	1.617	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NCCc2nc(Cc3ccccc3)no2)cc1	1346883943	DLYYLJZGULICMT-UHFFFAOYSA-N	425.445	1.621	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4nncn4c3)C2)C1	1778600219	GWRQYFLSQMIVFH-KBXCAEBGSA-N	436.310	1.346	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc[nH]2)C1	1779594293	WBQKOHQXGHTDSA-GULKHOJOSA-N	440.504	1.276	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2)c1cccc2ccncc12	1781239133	DUJZBMYCDSCMDD-NNMXDRDESA-N	431.920	1.962	50	20	IDGD	
COc1cc(CCC(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](F)Br)C3)C2)ccn1	1781326759	SVAOJJYGLOGJNF-WMZOPIPTSA-N	444.301	1.543	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C[C@@H]2C[C@@H]3CC[C@H]2C3)C1	1781836508	WBJWUQFEGTZGNM-PYJXJXBRSA-N	448.608	1.700	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@@H](C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](O)CCl)C3)C1	1782161086	BMPJVGFZCBYUEZ-OVNJDOEUSA-N	444.956	1.079	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)C3CCC(CO)CC3)CCO2)C1	1783341720	DNHODZPVKFFEAT-FCJNSDPXSA-N	431.371	1.789	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(OC)nn3C)CCO2)C1	1783345048	WOELKBGYYIQWEE-SJCJKPOMSA-N	429.315	1.046	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)[C@@H](O)Cc3ccccc3)CCO2)C1	1783355850	YILOJXLBDHFEER-ZWOKBUDYSA-N	439.350	1.593	50	20	IDGD	
O=C(CCOc1ccc(F)cc1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21	1783786742	DLRLWGSMBWTOSJ-RUGDWHBFSA-N	428.888	1.174	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)CCCNC(=O)OC(C)(C)C)CCO2)C1	1783884066	OIUUILLOMIJFJT-QRWLVFNGSA-N	447.960	1.375	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc4c(c3)CCCO4)C[C@@H]21)[C@@H](O)CCl	1784093051	PFKXVUAVRMTZCK-JPLJXNOCSA-N	436.936	1.134	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3CCN3C(=O)OC(C)(C)C)[C@H]2C1	1784822603	PWPKKARIXSROJS-SIRPWMCASA-N	443.972	1.993	50	20	IDGD	
O=C(Cc1cc([N+](=O)[O-])ccc1F)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21	1785004162	XRFJFBDBFPKAJQ-MSMFTSAESA-N	431.823	1.791	50	20	IDGD	
Cc1nc(O)c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Br)C[C@@H]32)nc1C	1785575979	XFNVOZSEFITMIV-ZJQBRPOHSA-N	445.289	1.083	50	20	IDGD	
CN(CCCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Cl)CCO2)C(=O)OC(C)(C)C	1785585361	BMVXCSLTXOQWCB-DNVCBOLYSA-N	435.924	1.998	50	20	IDGD	
C=C[C@@H]1C[C@]1(NC(=O)OC(C)(C)C)C(=O)N1CC[C@]2(CN(C(=O)[C@H](F)Cl)CCO2)C1	1785596490	XCKUTXPSBQCVEB-BBNYVJOESA-N	445.919	1.820	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(C(=O)O)ncn3)[C@H]2C1	1785645432	NHZNLJACNJKAGX-DDWFUNMISA-N	445.303	1.004	50	20	IDGD	
CCCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C[C@@H]21	1786438685	RGAVWPLRWZYATP-VGWMRTNUSA-N	431.961	1.898	50	20	IDGD	
COc1ccc2cc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)[C@H](O)CCl)C[C@@H]43)[nH]c2c1	1787905390	CTUUZAHKJXMWRJ-JOQQVMPUSA-N	435.908	1.370	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)c3cncc(O)c3)CCC2)cc1)c1ccc(B(O)O)cc1	1788143716	SAYDPPAYKOTCGV-UHFFFAOYSA-N	431.257	1.529	50	20	IDGD	
CC[S@](=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)CBr)C[C@@H]21	1788485292	UGTSBUVPHOIQFI-SHNGGNKPSA-N	437.400	1.156	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1ccc(C2(NC(=O)c3cncc(O)c3)CCC2)cc1	1789521709	FWSDJLDPZWBOOL-UHFFFAOYSA-N	446.467	1.847	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21)C1CCN(c2ccccn2)CC1	1789720525	ZAYGGLUAMCPHJA-DWRORGKVSA-N	438.931	1.812	50	20	IDGD	
C=C(CC(=O)OCC)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21	1789892313	PHAQUFHIEVMJQA-ABHRYQDASA-N	435.290	1.166	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cn4ccsc4n3)C[C@@H]21)[C@H](F)Br	1789926443	YFCMJOWXGYOXDI-UKJIMTQDSA-N	445.314	1.680	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)Nc3cccnc3)C[C@@H]21	1791058051	NROJYHXFVAANOC-JBJRXJHCSA-N	439.354	1.645	50	20	IDGD	
Cc1cncc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)CBr)c1	1792870157	JJSCKDWDGKAKPE-VYCZESIESA-N	438.366	1.943	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1C[C@H]1c1ccc(F)c(F)c1)C2)[C@H](O)CCl	1792975442	RZJBVWANJIOWPF-MHVDTCSESA-N	428.863	1.258	50	20	IDGD	
CC(C)(C)n1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Br)C3)cn1	1794350232	KYUACUWFLQFRGQ-XJFOESAGSA-N	431.306	1.532	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnccc1N(C)C	1794471526	VBVOKDVKDDQHFP-VWPFQQQWSA-N	439.354	1.382	50	20	IDGD	
COC(=O)C[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](F)Cl	1796809970	BPPCOEYJFMYWRI-WHRXGGIHSA-N	449.907	1.615	50	20	IDGD	
CS(=O)(=O)N1CCC(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)C(Cl)Cl)C3)CC1	1797707489	NCYNFJYQROBPFM-CLLJXQQHSA-N	426.366	1.100	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CS[C@@H]1CCCCO1	1797800171	ODLXZXJDIKNNKP-CNBXADPUSA-N	435.384	1.619	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2)c1cc(-c2ccncc2)[nH]n1	1798143878	IVHKPKPLBRYFIY-ZSBFGKGUSA-N	448.321	1.460	50	20	IDGD	
N#Cc1ccc(CCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)cc1	1798440181	PTNTXXLTLRGLOR-REPLKXPHSA-N	446.511	1.441	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccccc1C(=O)OCCO	1798565596	RTTNDKQGONSFTB-DACLVMHWSA-N	438.908	1.056	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](CC)NC(=O)OC(C)(C)C)C2	1799271347	NIRVXBIUXYZAED-QRJUGERDSA-N	431.961	1.897	50	20	IDGD	
COc1ccc([C@@H](O)C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Br)cc1	1799343156	OQQGAXRJESKQHE-IPQWEPCOSA-N	445.285	1.009	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1n[nH]c(C3CC3)c1F)C2)[C@H](F)Br	1799347742	RYXGKWQEIJILDZ-VKZHRDFRSA-N	433.253	1.320	50	20	IDGD	
CN(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCC#N)C2)NC(=O)NCc1ccccc1	1799864685	HJJJOMVYAXOTDL-REPLKXPHSA-N	426.521	1.275	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C=C/c1cc(F)cc(OC)c1	1800856131	BSITZCZMZCHMNC-KTTQPEQKSA-N	440.899	1.691	50	20	IDGD	
COC(=O)[C@@H]1CCC[C@@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Br)C3)C1	1800967207	BVKKVTZPAYMMRZ-LACSLYJWSA-N	449.317	1.246	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ncccc1C(F)(F)F)C2	1800977011	OBCUIDRZHVIEKK-XCCSTKFXSA-N	435.830	1.557	50	20	IDGD	
O=C(CCc1c[nH]c2ncccc12)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2	1802067405	IOSSYZMLEXUTQT-YWVIFJGQSA-N	425.316	1.889	50	20	IDGD	
Cc1nc2ncccn2c1C(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]1c1cccnc1	1803142464	DOEBJDXFNYFYSL-JFIYKMOQSA-N	442.907	1.352	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc3cccnc3n2)[C@H]1c1cccnc1)[C@@H](O)CCl	1803142858	LDNQRNDJAMOKIX-WDSOQIARSA-N	439.903	1.944	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2sccc2F)[C@H]1c1cccnc1	1803858779	XPFQUXHCFLCSNH-DNVCBOLYSA-N	447.536	1.975	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CC1Cc2ccccc2C1	1804503159	RSOYEHONXDTZKE-ACDBMABISA-N	447.539	1.742	50	20	IDGD	
O=C(Cc1cncnc1)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@@H]1c1cccnc1	1804651210	QIPAOWSDQWVVRS-USXIJHARSA-N	436.285	1.811	50	20	IDGD	
COc1cnc(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)c(F)c1	1805078779	VMLUNSCVQWPAAW-QANKJYHBSA-N	436.871	1.544	50	20	IDGD	
C[C@@H](C(=O)N1CCC2(CCCN(C(=O)[C@@H](O)CCl)C2)CC1)N1CSCSC1	1805522782	LBVTZVSOXKVWSH-GJZGRUSLSA-N	436.043	1.860	50	20	IDGD	
Cn1cccc(C(=O)N2CCCC3(CCN(C(=O)[C@@H](F)Br)CC3)C2)c1=O	1806296111	PKVTZMHCPZAVOB-CQSZACIVSA-N	428.302	1.921	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)o1	1807360237	POEOIWGABAAXSQ-GHTZIAJQSA-N	433.273	1.296	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)c1ccc2nncn2c1	1809911955	WIRZOBHNMIBFNJ-YXJHDRRASA-N	428.880	1.044	50	20	IDGD	
COc1ccccc1C(=O)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1	1809978220	ZYOJPQRKEMCINE-UHFFFAOYSA-N	436.317	1.534	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC2(CCCN(C(=O)c3cccc4nc[nH]c34)C2)CC1	1810560954	FMWOJYQQCCYURJ-UHFFFAOYSA-N	440.548	1.781	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)c1nc2ccc(F)cn2n1	1812288462	KFOJKJNEQONZQU-LXZKKBNFSA-N	446.870	1.183	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)C23CC(C(=O)OC)(C2)C3)[C@H]1c1cccnc1	1812837918	NHNJVEXMYULUOL-JZIXJXCISA-N	449.935	1.685	50	20	IDGD	
COCCOCC(=O)N1CC[C@H](CNC(=O)[C@H](C)Br)[C@H]1c1cccnc1	1812864279	LSZYCYYHBKDGMR-YSVLISHTSA-N	428.327	1.534	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)c2c[nH]c(=O)cn2)[C@H]1c1cccnc1	1812868071	YLDHQAPLHDQYOU-GHJWDPDVSA-N	434.294	1.268	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(F)cc1)CC2)c1ccc(B(O)O)cc1	1815343713	KOJQEXIMPAJRAW-MRXNPFEDSA-N	439.277	1.502	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc[nH]n1)CC2	1817276502	UIGJAHAORCMJNL-DLDHGHKKSA-N	440.489	1.226	50	20	IDGD	
CCc1ccnc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)c1	1817768578	GENQNACORGNESA-HXUWFJFHSA-N	447.304	1.667	50	20	IDGD	
CCn1nc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)cc1C	1819907569	IVZDQPWUVNGAIF-KRWDZBQOSA-N	444.540	1.613	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)COc2ccc(O)nn2)n[nH]1	1821667474	AEZOEOHHZYQVEE-DGCLKSJQSA-N	438.872	1.230	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)cn1C	1822413742	AJCYZKFHRZGNQR-KRWDZBQOSA-N	429.525	1.736	50	20	IDGD	
CC(=O)c1cc(C(=O)N[C@@H]2CCc3nc(NC(=O)[C@@H](F)Br)sc3C2)n[nH]1	1823001346	CXTLNYCPIZZOHS-JMCQJSRRSA-N	444.286	1.985	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](O)CCl)CC2)c1ccc(O)c([N+](=O)[O-])c1	1823222570	KGJSDKPPAJOGJX-TVQRCGJNSA-N	440.865	1.582	50	20	IDGD	
C=CCNC(=O)/C=C\C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@H](Cl)COC)CC1	1823749407	NPEOKNGKDKGOQO-JKCVZHOFSA-N	425.957	1.718	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(F)nc1)CC2	1826087515	GGKWRMCGQHNPJP-LBPRGKRZSA-N	434.497	1.276	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)c2ncccc2F)CC1	1829458500	AHQLGNJBEHZQQO-HXUWFJFHSA-N	439.296	1.448	50	20	IDGD	
O=C(COc1ccc(O)cc1)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1830350015	QYIWMYKDDPUNHL-SFHVURJKSA-N	433.288	1.031	50	20	IDGD	
Cc1c(C(=O)N2CCC([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)cnn1C	1831871359	BCABURVHJWFVPJ-LJQANCHMSA-N	432.569	1.335	50	20	IDGD	
C[C@@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1)n1cccn1	1832237305	XYHSDYXZYGXTPO-LAUBAEHRSA-N	438.337	1.057	50	20	IDGD	
Cc1cc[nH]c1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)CBr)C2)C1	1833538533	VBKKMIVPJQNYLC-KBXCAEBGSA-N	428.327	1.424	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3n[nH]c(CC)c3F)CCO2)C1	1833734559	VVXMZEHEWATURO-ORAYPTAESA-N	430.908	1.589	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccn(C)c3)CCO2)C1	1833847755	JRSAWKLSADNZSW-RDTXWAMCSA-N	428.327	1.126	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](F)Cl)CC3)CC2)n1	1833924275	OKHOBRUIGMIOHV-GOSISDBHSA-N	439.919	1.760	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3ncccn3)CC2)CC1	1834234545	SRVPWSMHVQDHKK-MRXNPFEDSA-N	438.370	1.835	50	20	IDGD	
CCn1nccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)CBr)C2)C1	1834411173	HQHBIXSAEXONBK-RDTXWAMCSA-N	443.342	1.004	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccc(F)c(F)c3)CCO2)C1	1835140420	GUJLZQWDLYKDDC-FOIQADDNSA-N	430.879	1.981	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)CC3CCOCC3)CCO2)C1	1835416523	VWADVPDHQUEZIA-HNAYVOBHSA-N	447.370	1.291	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cccc(F)n3)CC2)CC1	1835907884	WABLVRGUHBPANZ-INIZCTEOSA-N	426.920	1.660	50	20	IDGD	
CC[C@@H](Br)C(=O)NC1CCN(C2CCN(C(=O)c3ccncn3)CC2)CC1	1836541995	RDDXCFSXTFGGCT-MRXNPFEDSA-N	438.370	1.835	50	20	IDGD	
CNc1ccc(C(=O)N2CCOC[C@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)cc1	1837711297	CHDYLCJYTFXTDY-NRFANRHFSA-N	435.597	1.650	50	20	IDGD	
O=C(c1ccc(C(F)(F)F)[nH]1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1837764503	CEERLHFOVDRXGA-IUODEOHRSA-N	427.782	1.638	50	20	IDGD	
CC(=O)N(C)[C@@H](C)C(=O)N1CCC(OC2CCN(C(=O)[C@H](C)Br)CC2)CC1	1838106780	LFMXAHKOVIKQRS-KBPBESRZSA-N	446.386	1.635	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)C3=NNC(=O)C3)CC2)CC1	1838381821	OKEOTAKOKYSKKW-AWEZNQCLSA-N	443.342	1.034	50	20	IDGD	
CC(C)n1nccc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839200631	MTFPCYYXEVXOSK-RHSMWYFYSA-N	447.305	1.225	50	20	IDGD	
O=C(c1ccc(-n2cccn2)cc1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1839336982	CCTHRKHQIUUYKY-YLJYHZDGSA-N	436.871	1.477	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(O)ccc3O)CCO2)C1	1839448847	YNHNDEWSKMYHPK-RTBURBONSA-N	447.315	1.404	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)C3CC(F)(F)C3)C2)C1	1839961632	CXLHYZFXRZSVGJ-CJNGLKHVSA-N	439.297	1.662	50	20	IDGD	
C#CCCCCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)CBr)C2)C1	1840291540	USQVSQOFAKBYME-APWZRJJASA-N	429.355	1.667	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(C)c(F)c3F)CCO2)C1	1840702175	IXMWNPCAOVRHOB-QRWLVFNGSA-N	446.878	1.597	50	20	IDGD	
C[C@@]1(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)CC1(F)F	1840827977	JIWXESGZNATSLE-HRCADAONSA-N	429.291	1.724	50	20	IDGD	
O=C(c1c[nH]c2ncc(C(F)(F)F)cc12)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1	1841351374	NKLSMERXQVCHHS-ZDUSSCGKSA-N	430.814	1.998	50	20	IDGD	
O=C1CN(c2cccc(C(=O)N3CCCC34CN(C(=O)C(Cl)Cl)C4)n2)CCCN1	1842305503	QKIYOBIJQDWUKS-UHFFFAOYSA-N	440.331	1.029	50	20	IDGD	
O=C(C1CCC(C(F)(F)F)CC1)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843013195	SYCBYIPBQUPTEO-UHFFFAOYSA-N	438.255	1.552	50	20	IDGD	
O=C1Nc2ccccc2Cn2nc(C(=O)N3CC4(CCCN4C(=O)[C@@H](F)Cl)C3)cc21	1843364973	OWXMIEMNKONKOK-MRXNPFEDSA-N	431.855	1.849	50	20	IDGD	
Cn1ncc(Br)c1C(=O)N1CCCC12CN(C(=O)[C@@H](F)Br)C2	1843605119	DCNVOSCUOPVSDA-SNVBAGLBSA-N	438.095	1.690	50	20	IDGD	
C[Si](C)(C)C#CCCCC(=O)N1CCCC12CN(C(=O)c1cccc(B(O)O)c1)C2	1844252624	OGDXOERLOQIWHA-UHFFFAOYSA-N	426.398	1.235	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)c2ccc(-n3c(O)nnc3O)cc2)C1	1844738729	CAIDYOKECGMSEM-HNNXBMFYSA-N	433.896	1.903	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)Cc2ccc(Br)nc2)C1	1844990203	HEVLCALHYFNOAC-ZDUSSCGKSA-N	430.730	1.844	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)c1n[nH]cc1I)C2	1845165985	UJUOROMDEZCFCV-SECBINFHSA-N	436.681	1.849	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@@H](O)C(=O)N1CC2(CCCN2C(=O)[C@](C)(Cl)CCl)C1	1845168915	HVWBYNWRWPOPER-SJKOYZFVSA-N	438.352	1.312	50	20	IDGD	
COc1cc(F)ccc1C(=O)N1CCCC12CN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2	1846763990	LWRUMXAIPJUVGL-AFUMVMLFSA-N	441.463	1.785	50	20	IDGD	
Cc1nnc(NNC(=O)c2ccc(NS(=O)(=O)/C=C/c3ccccc3)cc2)[nH]c1=O	10899312	NONQESWNNNHBRF-VAWYXSNFSA-N	426.458	1.643	50	20	IDGD	
O=C(NNC(=O)C12CC3CC(CC(C3)C1)C2)c1cccc(S(=O)(=O)N2CCOCC2)c1	14231696	YUONJBORPUZGKD-UHFFFAOYSA-N	447.557	1.685	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCCC3)c2)n1	15462534	CNWKBVPAUJWMSX-UHFFFAOYSA-N	433.534	1.526	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H]2COc3ccc(Cl)cc3C2)c1	16594216	ZQJJBYUBNJPVDB-CQSZACIVSA-N	437.905	1.603	50	20	IDGD	
O=C(COc1ccc(Br)cc1Cl)NNC(=O)[C@H]1CCS(=O)(=O)C1	16786187	NGPYLIIBNBWDSS-QMMMGPOBSA-N	425.688	1.063	50	20	IDGD	
CC(C)(C)C(=O)NNC(=O)CSc1nnc(-c2ccccc2Br)n1N	20830374	LTXYMFOVCQXNFA-UHFFFAOYSA-N	427.328	1.707	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)CN2C(=O)COc3ccc([N+](=O)[O-])cc32)c1	28640343	XDGGJWKLXWFYDZ-UHFFFAOYSA-N	428.401	1.163	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)c2cccc(S(=O)(=O)NC[C@H]3CCCO3)c2)cc1	104747679	RGLVPSQHQSXXPJ-GOSISDBHSA-N	446.529	1.325	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2N2CCOCC2)o1	109590333	METUQMDETLVDCX-UHFFFAOYSA-N	445.476	1.941	50	20	IDGD	
N#Cc1ccc(-c2ccc(OCC(=O)NNC(=O)CNC(=O)c3ccc(O)cc3)cc2)cc1	727493173	JBYBFMVBLYBHCI-UHFFFAOYSA-N	444.447	1.887	50	20	IDGD	
N#Cc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=S)NCC3CCC3)CC2)cc1	727869412	RFUNXIFNCFNNRK-UHFFFAOYSA-N	435.575	1.254	50	20	IDGD	
C[C@H](Sc1nnnn1C1CC1)C(=O)NNC(=O)c1cc(F)ccc1Br	728546438	SIJSXIKBUBQDCE-ZETCQYMHSA-N	429.275	1.851	50	20	IDGD	
CCN(C)[C@@H](C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1)c1ccccc1	728606981	SCWUBHCTXGFMCM-OAQYLSRUSA-N	445.589	1.759	50	20	IDGD	
CC[C@H](NC(=O)NNC(=O)[C@H](C)Oc1ccc(F)cc1)c1cccc(S(N)(=O)=O)c1	729612189	BJGBUELYVPWNIB-SJCJKPOMSA-N	438.481	1.722	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N[C@H](C)[C@H](C)N1CCOCC1	729623064	FTIRFADONNORKG-RDBSUJKOSA-N	443.342	1.656	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N2CCO[C@H](C#N)C2)cc1	729979588	LVUFDEMMDWDOEG-NXIIHZOPSA-N	434.456	1.092	50	20	IDGD	
Cn1nc(SCC(=O)NN=C/C(Br)=C/c2ccccc2)c(=O)n(C)c1=O	730568822	DAOYZEHCJNQNRP-QVCFSDILSA-N	438.307	1.109	50	20	IDGD	
COC(=O)c1ccc(COc2ccc(C=NNC(=O)[C@H]3CCS(=O)(=O)C3)cc2)cc1	730576497	QYZMDHUTYHZSFY-SFHVURJKSA-N	430.482	1.937	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)CC[C@H]2NC(=O)N(c3cccc(C)c3)C2=O)cc1	730830656	SIMXCUREWHXFND-GOSISDBHSA-N	439.472	1.468	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)NCc2cccc(CN3CCC[C@H](C(N)=O)C3)c2)cc1	731046477	JMKCXYNWAFJKPX-FQEVSTJZSA-N	434.500	1.400	50	20	IDGD	
COc1ccc(CN([C@H]2CCS(=O)(=O)C2)[C@@H](C)C(=O)NNC(=O)CC(C)C)cc1	731848715	MAGZYQVECSMIRR-RDJZCZTQSA-N	425.551	1.266	50	20	IDGD	
C[C@@H]1CN(Cc2ccccc2)CCN1C(=O)NNC(=O)c1csc(N2CCOCC2)n1	732236145	QROYHLUCBPCLNV-MRXNPFEDSA-N	444.561	1.540	50	20	IDGD	
O=C(COC(=O)c1cnn(-c2ccccc2F)c1)NNC(=O)c1cccc([N+](=O)[O-])c1	732333455	RBORLDYCFCQIAP-UHFFFAOYSA-N	427.348	1.538	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCC[C@H](CNC(=O)C(C)(C)C)C1	732990042	ZQQDLKMJBFQUQF-CQSZACIVSA-N	438.956	1.984	50	20	IDGD	
COc1cccc(C[C@@]2(C(=O)NNC(=O)N[C@H]3CCS(=O)(=O)C3)C[C@H]3CC[C@H]2C3)c1	735468085	CYVHZJXINIGKQY-NWZZKEMCSA-N	435.546	1.562	50	20	IDGD	
CC(=O)NCC(=O)N1CCc2cc(C(=O)NNC(=S)Nc3cccc(C)c3)ccc21	735703067	GNLBULHEWSVDNM-UHFFFAOYSA-N	425.514	1.652	50	20	IDGD	
Cc1ccc([C@@H](CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)N(C)C)cc1	743334347	UZVSZFDUKORMCJ-QGZVFWFLSA-N	432.550	1.535	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CN2CCN(c3c(C#N)cnc4ccccc34)CC2)c1	744393210	LDHJGCOJFZEWED-UHFFFAOYSA-N	439.479	1.561	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)COc2cccc(NC(=O)C3CC3)c2)cc1	744699290	TVSSNACZXUGHMC-UHFFFAOYSA-N	436.424	1.290	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)N[C@H]2C[C@H](C)N(c3cnn(C)c3)C2=O)c(C)n1-c1ccccc1	745916663	FGSQYHCZKFQPGN-YWZLYKJASA-N	449.515	1.966	50	20	IDGD	
CCc1c(C(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)[nH]c(C)c1C(N)=O	747887192	BSZHDNGNSRDOLY-UHFFFAOYSA-N	436.513	1.328	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)Cc2cccc(OC(F)(F)F)c2)n1	748347301	SDEGYSMCQPRIBB-UHFFFAOYSA-N	431.392	1.826	50	20	IDGD	
Cc1nc2ncnn2c(C)c1CCC(=O)NNc1nc(Br)cn2ccnc12	750244021	UZVAMIDEVJOJGM-UHFFFAOYSA-N	430.270	1.622	50	20	IDGD	
COc1ccc(C(=O)CNC(=O)CCC(=O)NNC(=O)c2c(C)nc3ccccn23)cc1	751303104	QGIKGIATXRXTNU-UHFFFAOYSA-N	437.456	1.192	50	20	IDGD	
CCOC(=O)[C@@H]1Cc2cc(S(=O)(=O)NNC(=O)Cn3ccc4ccccc43)ccc2O1	751547687	MASULLBXIKPGMB-IBGZPJMESA-N	443.481	1.518	50	20	IDGD	
C[C@H](C(=O)NNC(=O)c1nn(-c2ccccc2)cc1O)c1ccc(S(C)(=O)=O)cc1	753330371	LQMHRGAAKUZZSN-ZDUSSCGKSA-N	428.470	1.546	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@H](C)C(=O)NNC(=O)c1cc(S(N)(=O)=O)oc1C	754182104	LYEKDXSRVLKVSU-LLVKDONJSA-N	429.882	1.734	50	20	IDGD	
CCCn1nc(C(=O)NNS(=O)(=O)c2c(CC)nn(C)c2CC)c2ccccc2c1=O	754333481	HBARETLWYCQZEB-UHFFFAOYSA-N	446.533	1.288	50	20	IDGD	
CN(C)c1ccc(S(=O)(=O)N(C)C)cc1NC(=O)NNC(=O)COCc1ccccc1	755529654	FCTBLWQJJLUSIF-UHFFFAOYSA-N	449.533	1.372	50	20	IDGD	
Cc1c(NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cccc1C(=O)N1CCCC1	756276099	BIOCAMGKLGGVII-UHFFFAOYSA-N	434.460	1.673	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NC[C@H]2CCN(CC(C)C)C2)nc1	757304441	KFEDIGGCGKMAIT-MRXNPFEDSA-N	426.587	1.716	50	20	IDGD	
CC(C)CCSc1ccc(C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)cc1[N+](=O)[O-]	758030619	RNCYTYYUOQGPNC-LLVKDONJSA-N	432.524	1.432	50	20	IDGD	
C[C@@H]1Cc2ccccc2N1C(=O)[C@@H]1CCCC[C@@H]1C(=O)NNC(=O)C(=O)Nc1ccccn1	758835509	WSYHCQUKQOHABP-BPQIPLTHSA-N	449.511	1.952	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(CCC(=O)NNc2ccc(C(=O)OC)cn2)cc1	759721250	DTNWECGMHHTZJH-UHFFFAOYSA-N	434.518	1.975	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2cccnc2OCC(F)F)ccc1Cl	760265166	WCVDKXAWRACBDC-UHFFFAOYSA-N	434.808	1.101	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1ccnn1Cc1ccc(F)cc1	760278133	AMVZYXQOLXSRMQ-UHFFFAOYSA-N	435.419	1.426	50	20	IDGD	
N#C/C(=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)NN1CCCC1=O	762646876	MJDMIDKSNIMXPB-GXDHUFHOSA-N	426.864	1.639	50	20	IDGD	
Cc1cccc(-c2nnc(S)n2CC(=O)NNc2nccc(N3CCOCC3)n2)c1	762861265	MUJRHFBFLVVVGR-UHFFFAOYSA-N	426.506	1.312	50	20	IDGD	
CN1CCC[C@H](N(C)C(=O)c2ccc(NC(=O)C(=O)NNC(=O)c3ccccc3)cc2)C1	763432021	WRVLXEQNTLWNSI-IBGZPJMESA-N	437.500	1.253	50	20	IDGD	
CO[C@@H](C)C(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2cc(C)nc3ccccc23)c1	763616635	OKQJHXTVWBVIOR-AWEZNQCLSA-N	449.467	1.916	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(OCC3CCOCC3)cc2)c1	763622796	GEWIDHICHOEINN-UHFFFAOYSA-N	441.484	1.965	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2ccc(SC)cc2)c2ccccc2c1=O	763787357	YFCZKXPRXHADBM-UHFFFAOYSA-N	425.470	1.538	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)C(=O)Nc1ccc(NC(=O)C2CC2)cc1	763804405	MTFGCOCOFVRNTR-UHFFFAOYSA-N	441.400	1.108	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(N3CCSCC3)cc2)cc1	763809236	LRKKVMOXKNQCPK-UHFFFAOYSA-N	428.514	1.713	50	20	IDGD	
CCC(=O)Nc1ccc(Cl)c(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)c1	763809672	ZACMQAJQYNEKAL-UHFFFAOYSA-N	443.847	1.725	50	20	IDGD	
CCN1CCN(c2ccc(NC(=O)C(=O)NNC(=O)COc3ccc(C)cc3)cc2)CC1	763810859	CONXYUQOCRVHLK-UHFFFAOYSA-N	439.516	1.302	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(N(C)C)cc2C)cc1	763870524	AJEILJZCWCZVFK-HNNXBMFYSA-N	426.473	1.817	50	20	IDGD	
CC[C@H](C)NS(=O)(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2ccccc2C)c1	763957846	MKALHQNWXHRJPJ-AWEZNQCLSA-N	432.502	1.472	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)C2=S=C(c3ccc(F)cc3)C=C2)cc1[N+](=O)[O-]	763976131	RIJPYQQZKFCDBX-UHFFFAOYSA-N	442.428	1.824	50	20	IDGD	
Cc1ccc(Oc2ccccc2NC(=O)C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)cc1	763998857	UEZZARJQKMQXLC-CQSZACIVSA-N	431.470	1.308	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1ccn(Cc2ccccc2)n1	764011853	KSTUCEZFLRHYOU-UHFFFAOYSA-N	427.848	1.993	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cnn(-c3cnc4ccccc4n3)c2)c(O)c1	764104920	ISTAOYODSHXDFI-UHFFFAOYSA-N	431.412	1.229	50	20	IDGD	
CCOC(=O)CCc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(OC)c2O)cc1	764130405	GVVNORHWNQRIJH-UHFFFAOYSA-N	429.429	1.296	50	20	IDGD	
CC(C)OCCOCc1cccc(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)c1	764163724	LJFJDOJDSUXKMA-FQEVSTJZSA-N	441.484	1.718	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3CN2Cc2ccccc2)cnn1C	764178699	GPVBCUBCQRKYMW-OAQYLSRUSA-N	446.511	1.442	50	20	IDGD	
Cc1cc(C)nc(-n2nc(C(=O)NNc3nc(O)c4cnn(C(C)(C)C)c4n3)cc2C)n1	764216585	VJKWWWCHHRIVFC-UHFFFAOYSA-N	436.480	1.945	50	20	IDGD	
O=C(NNC(=O)c1cc(F)ccc1Br)C(=O)Nc1cccc(-n2ccnn2)c1	764270882	VGJZNTPIHDJZDG-UHFFFAOYSA-N	447.224	1.569	50	20	IDGD	
Cc1cccnc1C(=O)NNC(=O)C(=O)Nc1cccc(N2CCN(CC3CC3)CC2)c1	764389185	MFMAUQYKVUSBHF-UHFFFAOYSA-N	436.516	1.322	50	20	IDGD	
O=C(COc1ccc(F)c(Cl)c1)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765737413	ZDBUHLZGUNEPAQ-UHFFFAOYSA-N	448.882	1.463	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)[C@H](c1ccccc1)N1CCC(O)CC1	767336066	JHPOXEFMEXYTAW-QHCPKHFHSA-N	439.512	1.426	50	20	IDGD	
O=C(CCC(=O)N1CCN(S(=O)(=O)c2ccc(F)cc2)CC1)NNc1ccccc1	767855064	QTTZJIGEIPXBEY-UHFFFAOYSA-N	434.493	1.582	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)[C@@H](NS(=O)(=O)c2ccc3ccccc3c2)C(C)C)n[nH]1	768273818	KBTZLOXTXDROHL-SFHVURJKSA-N	429.502	1.635	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)CSc1nnc(-c2cccc(N(C)C)c2)n1N	768399110	NRRARWPDJLBFLF-UHFFFAOYSA-N	439.545	1.516	50	20	IDGD	
O=C(NNC(=S)Nc1ccccn1)[C@H]1CCCN(S(=O)(=O)c2ccc(F)cc2)C1	768585891	VMVQLRFYHAVUIC-ZDUSSCGKSA-N	437.522	1.639	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3ccc4c(c3)C(C)(C)C(=O)N4)CC2)cc1	769302451	OIAHKEBCVIOJCE-UHFFFAOYSA-N	449.555	1.804	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)NCc2ncccn2)cc1	770051300	JCPHOHWRQCKQRG-LFIBNONCSA-N	431.456	1.447	50	20	IDGD	
CCC[C@](C)(O)C(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccc(OC)cc2)c1	770745664	FZDDYWZKVYLYHH-FQEVSTJZSA-N	435.502	1.808	50	20	IDGD	
COc1ccc(-n2nnc(C(=O)NNc3nc(O)c4cnn(C(C)(C)C)c4n3)c2C)cc1	770965695	NBCYQZFPBPKGFH-UHFFFAOYSA-N	437.464	1.942	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)CCNC(=O)c1ccc(Br)cc1	771906511	ZKXDFJMUIMTTLI-LBPRGKRZSA-N	442.310	1.694	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)CCCS(=O)(=O)c1ccc(Br)cc1	772106985	SSYKFCNDEQDZBG-NSHDSACASA-N	449.323	1.492	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NCCNS(=O)(=O)c2cc(C)sc2C)cc1	772625570	PGHZHAKRBZSNLL-UHFFFAOYSA-N	440.547	1.361	50	20	IDGD	
O=C(NNC(=O)c1cc2c(s1)CCC2)Nc1cnn(Cc2nnc3n2CCCC3)c1	772635543	BGBVXRZJOWPPRS-UHFFFAOYSA-N	426.506	1.876	50	20	IDGD	
CC(C)(C)OC(=O)N(CC(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1)CC1CC1	772888726	LBQSMNANXCOMRQ-UHFFFAOYSA-N	438.912	1.751	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)c1cc(Br)cc(Br)c1	773288777	ABAJDGXERRSQPP-UHFFFAOYSA-N	445.067	1.996	50	20	IDGD	
COC[C@@H](C)NS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2c(F)cccc2F)cc1	773705849	JDBYJPNTFIVFEP-LLVKDONJSA-N	442.444	1.360	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(C(=O)N3CCOCC3)c2C)cc1F	773889160	PTSNWXRKGAFAEN-UHFFFAOYSA-N	442.447	1.315	50	20	IDGD	
CC(=O)N(C)c1ccccc1NC(=O)C(=O)NNC(=O)[C@@H](C)Oc1cccc(Cl)c1	774007529	BHIGBTLJPLVRPE-GFCCVEGCSA-N	432.864	1.876	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc2cc(Br)ccc2c1)[C@@H]1CCS(=O)(=O)C1	775257561	MKCMYEIGNNZRRN-GFCCVEGCSA-N	447.332	1.347	50	20	IDGD	
O=C(NNc1cnc2ccccc2n1)Nc1ccc(S(=O)(=O)N2CCOCC2)cn1	776061186	FSYYVACCJNTKSS-UHFFFAOYSA-N	429.462	1.194	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NC[C@H]2COC3(CCCCC3)O2)nc1	776069376	OPYBFMBARHJFMC-AWEZNQCLSA-N	427.527	1.470	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CC(NC(=O)/C(C#N)=C/c3cc(C#N)n(C)c3C)C2)cc1	777427301	AZPIOUMBRLBFHG-LZYBPNLTSA-N	439.497	1.310	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])nc1C	778429257	QHDAACGCUSVZMP-UHFFFAOYSA-N	436.812	1.396	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)C[C@H]1Sc2ccc(Cl)cc2NC1=O	778442574	XMLSWJCJEOUFHD-GFCCVEGCSA-N	428.898	1.815	50	20	IDGD	
Cc1cnn(-c2c(C(=O)NNc3ccc(S(=O)(=O)NC4CC4)cc3)c(C)nn2C)c1	778666757	HOYTUOCEODDKBU-UHFFFAOYSA-N	429.506	1.420	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cnn([C@H](C)C3CC3)c2)cc1	778707856	QIKRBGQSSBIUDK-OCCSQVGLSA-N	427.461	1.610	50	20	IDGD	
COCc1cccc(CC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)c1	779012668	QSOUNELCIDZVEI-UHFFFAOYSA-N	432.546	1.455	50	20	IDGD	
COC(=O)c1ccccc1NNC(=O)CNS(=O)(=O)c1ccc2c(c1)OCCCO2	780728283	CZNXWKFUUFFOAI-UHFFFAOYSA-N	435.458	1.056	50	20	IDGD	
Cc1c(Br)cccc1NC(=O)C(=O)NNC(=O)Cc1nc2ccccc2n1C	782887989	UYSUKJXZEQABIK-UHFFFAOYSA-N	444.289	1.973	50	20	IDGD	
Cn1cc(NC(=O)C(=O)NNc2ncccc2C(F)(F)F)cc(Br)c1=O	783119877	MAFHFSQGAMTMNM-UHFFFAOYSA-N	434.172	1.643	50	20	IDGD	
O=C(NNc1ccc(Cl)cc1)C(=O)Nc1cccc(S(=O)(=O)NC2=NCCC2)c1	783333235	WJDDQHAKWYUALL-UHFFFAOYSA-N	435.893	1.892	50	20	IDGD	
Cc1cc(C)cc(NNC(=O)C(=O)Nc2cnn(CC(=O)N3C[C@@H](C)O[C@H](C)C3)c2)c1	783356439	IYSNVULHMAHGTK-HZPDHXFCSA-N	428.493	1.218	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)c(Cl)n1	784210474	QEPKSUYNKMNKOO-UHFFFAOYSA-N	439.881	1.266	50	20	IDGD	
CNS(=O)(=O)c1ccc(C)c(NC(=O)C(=O)NNc2ccc(Br)cn2)c1	784342037	XKPHBPPSXHOVGQ-UHFFFAOYSA-N	442.295	1.142	50	20	IDGD	
CNS(=O)(=O)c1cccc(NC(=O)C(=O)NNc2ccc(OC(F)(F)F)cc2)c1C	784802322	XGEPTLZNIQRYHL-UHFFFAOYSA-N	446.407	1.884	50	20	IDGD	
O=C(NNc1cccc([N+](=O)[O-])c1)C(=O)Nc1ccccc1S(=O)(=O)N1CCCCC1	784834096	VJUVWXNONXUGMO-UHFFFAOYSA-N	447.473	1.851	50	20	IDGD	
CC(=O)Nc1ccc(Cl)c(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)c1	785067760	MFHITGOGJIOEMX-UHFFFAOYSA-N	428.836	1.275	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2c(OC)cccc2S(C)(=O)=O)cc1[N+](=O)[O-]	785331301	SQMVGROTCQTTIQ-UHFFFAOYSA-N	438.418	1.097	50	20	IDGD	
CCOc1ccc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)c3cnn(C)n3)cc2)cc1	785681945	GVJAVEOQGCUVDB-UHFFFAOYSA-N	444.473	1.089	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)NNC(=O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])o1	787424670	KYMOWJWBOQBJEZ-ZDUSSCGKSA-N	435.824	1.976	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2CC(=O)c3ccccc32)c1	789728001	VOQPQJDGANIHCZ-GOSISDBHSA-N	429.498	1.848	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1)C(=O)OC	790114834	WIQZKTSRNMGYTB-KRWDZBQOSA-N	433.486	1.125	50	20	IDGD	
COc1ccccc1[C@]1(C)NC(=O)N(CC(=O)NNc2cccc(F)c2[N+](=O)[O-])C1=O	790578933	IDHVQTBZCKRUPB-IBGZPJMESA-N	431.380	1.653	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)Nc2ccc(S(=O)(=O)NC)cn2)cc1	792400185	KWVNJHHEMLUCIQ-LBPRGKRZSA-N	437.478	1.009	50	20	IDGD	
CC(=NNC(=O)CNC(=O)c1cccnc1)c1cc(S(N)(=O)=O)c(Cl)cc1Cl	794520422	NROHROAGUGJGOX-UHFFFAOYSA-N	444.300	1.306	50	20	IDGD	
Cc1nc2c3cccnc3nn2c(C)c1CCC(=O)NNC(=O)COc1ccccc1O	796257117	ZONFSJNETCVXQG-UHFFFAOYSA-N	434.456	1.759	50	20	IDGD	
C=CCNC(=S)NNC(=O)c1ccccc1NS(=O)(=O)c1cc([N+](=O)[O-])ccc1C	798306908	YOGXDKLFZZTOKS-UHFFFAOYSA-N	449.514	1.999	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)NCCNS(=O)(=O)c1ccc(Cl)cc1F	799370439	LSTSCWBCGAXUCQ-UHFFFAOYSA-N	444.872	1.410	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NN=C(C)COC(C)C)N(S(C)(=O)=O)CC2	799872731	WNTHALKWTWKERD-KRWDZBQOSA-N	441.550	1.870	50	20	IDGD	
CCc1nnc(NC(=O)[C@@H](C)[C@@H](C)NC(=O)NNC(=O)Cc2cn3ccccc3n2)s1	805878302	IATIWQCWXYAFDF-NWDGAFQWSA-N	444.521	1.284	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)Nc1ccc(S(=O)(=O)[C@H](C)C#N)cc1	806459354	CPKOVLPVICIAML-GFCCVEGCSA-N	426.458	1.795	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNc3ccc(-n4ccnc4)nn3)cc2)C[C@H](C)O1	807429862	ZIXIWSDMFNKPPN-GJZGRUSLSA-N	436.476	1.358	50	20	IDGD	
COc1ccc(S(=O)(=O)NCC(=O)NNc2ccc(Br)cc2)cc1OC	810041824	DIPIQKYZBGBUEZ-UHFFFAOYSA-N	444.307	1.888	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cc(F)c(F)cc2OC)cc1	810386018	JDHOJJUVVABSQO-NSHDSACASA-N	437.399	1.926	50	20	IDGD	
NC(=O)c1ccc(NC(=O)C(=O)NNc2cccc(F)c2[N+](=O)[O-])c(OCC(F)F)c1	810407570	ISYNHJKMJYRXHM-UHFFFAOYSA-N	441.322	1.559	50	20	IDGD	
O=C(CNS(=O)(=O)c1cccc(F)c1)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	810585717	FVFCVYGNHLPFEM-UHFFFAOYSA-N	435.412	1.094	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)C2(c3cccc(Br)c3)CC(=O)C2)c1	810662274	HQQCCOUNDDEDJY-UHFFFAOYSA-N	445.273	1.864	50	20	IDGD	
CN1CCN(c2ccccc2NC(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)CC1	812313802	PXAWVSZWLUHIGW-UHFFFAOYSA-N	432.550	1.837	50	20	IDGD	
Cc1cc(NC(=O)[C@H](C)SCC(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)no1	812728832	BBMCVOQGTYRVCH-LBPRGKRZSA-N	441.535	1.437	50	20	IDGD	
COC(=O)c1cn(-c2cccc(NC(=O)NNC(=O)c3ccc(OC)c(OC)c3)c2)nn1	812980872	CXMDBEHWZLFSAC-UHFFFAOYSA-N	440.416	1.538	50	20	IDGD	
CC(C)[C@@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	814200975	NLPGNNIWKFDAME-HXUWFJFHSA-N	447.580	1.895	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N2CC[C@@H](CS(C)(=O)=O)C2)cc1Br	814299981	HESVMKPBISXGFH-SNVBAGLBSA-N	434.312	1.179	50	20	IDGD	
CC(Cc1c(Cl)cccc1Cl)=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O	814784752	IREOCTWTMOZZOD-UHFFFAOYSA-N	430.317	1.613	50	20	IDGD	
CCOC(=O)c1cc(COC)cc(NC(=O)C(=O)NNC(=O)c2ccc(CC)cc2)c1	815566026	HAVDEIOXPSJCMX-UHFFFAOYSA-N	427.457	1.972	50	20	IDGD	
Cc1cc(Oc2ccccc2)ccc1NC(=O)C(=O)NNC(=O)[C@H]1CCc2nncn2C1	815690948	APRHYHSQYDFOMA-HNNXBMFYSA-N	434.456	1.727	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCc2nncn2C1)C(=O)Nc1cc(C(F)(F)F)ccc1Cl	815693230	PNHFRJWMHZWDCO-QMMMGPOBSA-N	430.774	1.299	50	20	IDGD	
COc1cc(F)c(F)cc1NC(=O)C(=O)NNc1ccccc1S(=O)(=O)N(C)C	815751348	YAGQTHIADXAWRK-UHFFFAOYSA-N	428.417	1.306	50	20	IDGD	
O=C(Cc1ccccc1)Nc1cc(NC(=O)C(=O)NNC(=O)[C@H]2CCCO2)ccc1F	815778378	OMBQWXFKYVNWAF-QGZVFWFLSA-N	428.420	1.272	50	20	IDGD	
O=C(c1ccc(N2CCCCC2)c(S(=O)(=O)N2CCCCC2)c1)N1CC[C@@H](B(O)O)C1	864233587	JEISPBFIHAYPIU-GOSISDBHSA-N	449.382	1.540	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)[C@H]2CCCN(S(=O)(=O)c3ccc(C)cc3)C2)cc1	913484393	FDVLWAMMHUSOMB-SFHVURJKSA-N	444.557	1.964	50	20	IDGD	
O=C(NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)o1)C1=S=C2CCCCCC2=C1	914750470	XVUHWRZXPCXNSN-UHFFFAOYSA-N	437.543	1.807	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)[C@@H]2CC(=O)N(c3ccccc3)C2)c2ccccc2c1=O	914750551	LZBXNAHTUQAZOT-OAHLLOKOSA-N	433.468	1.792	50	20	IDGD	
O=C(NCc1cccc(CN2CCCC2)c1)NNC(=O)c1csc(N2CCOCC2)n1	914827793	DTZRVMGPMSUYHY-UHFFFAOYSA-N	444.561	1.720	50	20	IDGD	
Cn1ncc2c1CCCC2=NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	915937732	SXDAUVSRTQZYFU-UHFFFAOYSA-N	445.545	1.230	50	20	IDGD	
COc1ccccc1S(=O)(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	916102492	XWQSMKPKWUOZBN-UHFFFAOYSA-N	439.515	1.103	50	20	IDGD	
COc1cc(C(=O)NNC(=O)COc2ccc(C#N)cc2)ccc1OCC(=O)NC(C)C	916108024	BDAHWRMYJADKRK-UHFFFAOYSA-N	440.456	1.310	50	20	IDGD	
O=C(NCCc1cccc(F)c1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	916201387	MFUWZHKIPRYLIF-UHFFFAOYSA-N	434.493	1.797	50	20	IDGD	
O=C(NN=Cc1cc2ccccc2nc1O)C(=O)NN=Cc1cc2ccccc2nc1O	916266390	RKTVXAITXVVJOJ-UHFFFAOYSA-N	428.408	1.795	50	20	IDGD	
O=C(NCCCN1C(=O)NC2(CCCCC2)C1=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	916267872	PGGMXGLDOJECNH-UHFFFAOYSA-N	432.437	1.184	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCC[C@@](O)(c2nccn2C)C(F)(F)F)cc1OC	916377242	AMTXAQPKFZADJM-QGZVFWFLSA-N	445.398	1.222	50	20	IDGD	
CNS(=O)(=O)c1cccc(CNC(=O)NNC(=O)c2cc(-c3ccc(C)cc3)[nH]n2)c1	916486110	YABGDDQLGJFVFK-UHFFFAOYSA-N	442.501	1.437	50	20	IDGD	
Cc1ccc(CCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)o1	916507435	KLEIMFQVPPJBGR-UHFFFAOYSA-N	434.518	1.949	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H]2CCN3CCC[C@@H]3C2)c1	916573266	JTOOQHRIPJXYIZ-DLBZAZTESA-N	437.566	1.288	50	20	IDGD	
CCCn1nc(C(=O)NNS(=O)(=O)c2cccc(F)c2[N+](=O)[O-])c2ccccc2c1=O	918398655	CDFATVWGAJMGAI-UHFFFAOYSA-N	449.420	1.477	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)NC[C@H](C)N1CCN(c2ccccc2)CC1	919905466	BTHMHNCXKUFNAD-SFHVURJKSA-N	425.533	1.779	50	20	IDGD	
O=C(NC[C@@H]1CCCCO1)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	920344685	ZROSWYBSZLVLIY-IBGZPJMESA-N	435.488	1.902	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)NNC(=O)c2cccc(N(C)C)c2)cc1OC	920931652	ZSFCXGFZGPFDAT-UHFFFAOYSA-N	435.506	1.989	50	20	IDGD	
CC(C)[C@H](C(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)N1C(=O)c2ccccc2C1=O	933601811	MRZWJGQUTHRVEH-GOSISDBHSA-N	447.451	1.015	50	20	IDGD	
O=C(CC1(CC(=O)N2CCOCC2)CCCC1)NNC(=O)c1cncn1-c1ccccc1	1317768958	QSNDJOFUDJFUCJ-UHFFFAOYSA-N	439.516	1.833	50	20	IDGD	
O=C(NNC(=O)[C@@H](O)[C@@H](O)c1nc2ccccc2s1)c1ccc(Br)cc1	1320031270	OTVPOWSWNMPWCL-UONOGXRCSA-N	436.287	1.914	50	20	IDGD	
COCCn1cc(NC(=O)NNC(=O)c2ccc(OC)c(Br)c2)ccc1=O	1321020245	JVHXNCYUTXMSNL-UHFFFAOYSA-N	439.266	1.732	50	20	IDGD	
COCCc1ccc(S(=O)(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1	1321908708	DEDJWZCICQUKJD-UHFFFAOYSA-N	441.550	1.832	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCCCOCc2ccccc2)cc1	1323179627	GFGDBFJLZJQXAV-UHFFFAOYSA-N	448.545	1.553	50	20	IDGD	
CNS(=O)(=O)c1ccc(Br)c(C(=O)NNC(=O)c2cccc(C)n2)c1	1326858605	OISBBCPBZJOWEU-UHFFFAOYSA-N	427.280	1.135	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc4n(n3)CCCO4)C2)C1	1778555531	CXVZOQNXYCPUPS-ZWKOTPCHSA-N	431.320	1.345	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc3ncccn3n2)C1	1778978980	XFNYXUHEPGCQEJ-AKCHCHLHSA-N	435.912	1.111	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C=C\C(=O)NC2CC2)C1	1779224833	CUZUABJFIZUTLU-KDSKUYPASA-N	425.957	1.743	50	20	IDGD	
C[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCO[C@]2(CCN(C(=O)CO[Si](C)(C)C)C2)C1	1779294895	RDGXFUOTXGNNIN-YWZLYKJASA-N	443.617	1.581	50	20	IDGD	
O=C(c1ncon1)N1CC[C@]2(C1)CN(C(=O)[C@@H](Br)Cc1ccccc1)CCO2	1779871728	GGGOTPVPQQHUFF-KXBFYZLASA-N	449.305	1.519	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(CN(C(=O)C#CC3CC3)CCO2)C1	1780095215	KBMNSUMWHAYOJE-JOCHJYFZSA-N	441.440	1.377	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)c(OC)c1	1780535948	WYKWMMSAAAOKHI-YJBOKZPZSA-N	445.285	1.838	50	20	IDGD	
O=C([C@H](O)CCl)N1CCO[C@@]2(CCN(C(=O)[C@@H]3CCCCN3Cc3ccccc3)C2)C1	1780881399	DPIFZZNUVKODBK-MIZPHKNDSA-N	449.979	1.471	50	20	IDGD	
O=C(CC12CCCN1CCC2)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1781137557	UQDROLARYPQXKY-YJBOKZPZSA-N	432.334	1.525	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)c3cnn4ccncc34)CCO2)C1	1781230245	ROMMBXKGVZTZEP-MSOLQXFVSA-N	426.304	1.409	50	20	IDGD	
O=C(c1nc2ccccc2[nH]1)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781329265	CIHHHZRTWYWPII-DYVFJYSZSA-N	425.258	1.697	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1nc(C)no1)C2	1781899587	AEYVBIYUHLOIIB-HBUWYVDXSA-N	443.342	1.608	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccn(C)c1=O)C2	1781997122	FBNXUKVPMYEJFJ-ZBQZNYHESA-N	440.338	1.296	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cn3ccccc3n1)C2	1782172580	GTOOGJBTOBKCHR-LUQKVYGDSA-N	434.924	1.716	50	20	IDGD	
C[C@H](C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)C2)c1ccccn1	1782645700	JXOFJJGWCNNIDB-GEQKSPFYSA-N	445.564	1.072	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)CCc3nnc(C)s3)CCO2)C1	1783344113	NGLQFDBXNGWMIW-CXAGYDPISA-N	445.383	1.783	50	20	IDGD	
CCOc1ncccc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21	1783391485	AOMFXRMMDRSHOD-CYUUQNCZSA-N	444.301	1.764	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)CC(=O)Nc3ccc(F)cc3)CCO2)C1	1783880856	GCNFIWNSUNPKQZ-UZLBHIALSA-N	441.887	1.238	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)C1CCN(c2ccccc2)CC1	1784017143	VFUJLGYROLWTIH-WJMWBRGCSA-N	449.979	1.482	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCC(=O)N3CCCC3)[C@H]2C1	1785001048	ZVOVFPQLCQVCCA-ULMVMLMRSA-N	448.391	1.605	50	20	IDGD	
CCc1cc(C(=O)Nc2ccc(C3(NC(=O)c4cccc(B(O)O)c4)CCC3)cc2)n[nH]1	1788332781	OPMFFHAMMIMWBJ-UHFFFAOYSA-N	432.289	1.713	50	20	IDGD	
CC(=O)O[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)C(C)C	1788474540	NLIPCJFLTFAKST-JKQORVJESA-N	433.343	1.339	50	20	IDGD	
CC#CC[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)c1ccccc1	1788704974	KVIHSPXQDWYBDK-LUYSREMJSA-N	432.948	1.763	50	20	IDGD	
Cc1cc(CC(=O)NC2(c3ccc(NC(=O)c4cnccc4C(=O)NN)cc3)CCC2)n[nH]1	1789521333	ZOODSXHQNCXVHK-UHFFFAOYSA-N	447.499	1.707	50	20	IDGD	
C[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]2C1)n1cccc1C=O	1789922969	VLQBZWXNLHPPLU-OSZUESSQSA-N	444.301	1.532	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3CCC(O)CC3)C[C@@H]21	1790963911	OEDKQQIHLHODIK-NMUJTLPQSA-N	431.371	1.691	50	20	IDGD	
CCOC(CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CO[Si](C)(C)C)C[C@@H]21)OCC	1791422655	MFQMXZYFOLNBBC-ULQDDVLXSA-N	430.618	1.607	50	20	IDGD	
Cc1ccc(CSCCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](O)CCl)cc1	1792982823	QSTVDHGRIGKIKD-AJYBTWMASA-N	440.993	1.808	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C[C@@H]1COc2ccccc2O1	1793269139	JGSCTOSQOBAUSI-YTMVRGIBSA-N	438.908	1.060	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H]1C=CCN1)C2	1794142839	WWCKOXWEHYFGKL-QRJUGERDSA-N	426.945	1.285	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1n[nH]c(C2CC2)c1F	1794481910	VQJXSDLHKFLPDY-IMEWIIRVSA-N	433.311	1.866	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(C(=O)O)ncn1	1794676978	NCHYLOHHCYKOQK-WISYIIOYSA-N	425.283	1.458	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](O)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCBr	1795495366	KYQUMZARQUPMKV-OXIQGZBJSA-N	434.331	1.253	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCc1ccc(OC)cc1F	1797255882	SKMLLIQMYSFARA-DOHHPOSVSA-N	442.915	1.610	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)Nc1cnccn1	1797778766	CXGOZXGBWWZXSX-XYFZXANASA-N	440.342	1.040	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(N3CCCC3)ccn1)C2	1797955799	DPUIBVVEBWVAPE-UPHUGPLXSA-N	446.624	1.737	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1(NC(=O)OC(C)(C)C)CC1)C2	1799273690	MXWBWLLQKVHPJL-LXTVHRRPSA-N	429.945	1.651	50	20	IDGD	
Cc1cccc(/C=C/C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Br)n1	1799343085	MSNOSWGGUFOXQO-YBWDHYDSSA-N	426.286	1.683	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1[C@@H]2C=CS[C@@H]12	1801319312	DDKBEGJMOGPBSO-ZXFZUQOXSA-N	427.530	1.634	50	20	IDGD	
C[C@@H](Oc1ccccn1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2	1801366571	JLCGSZDWAZGCLI-AMVBZWJASA-N	430.274	1.129	50	20	IDGD	
C[C@@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCC(=O)NN(C)C)[S@](=O)c1ccccc1	1802338001	HATPZBXKVFVVEH-KIDKYUGBSA-N	448.589	1.194	50	20	IDGD	
CC(C)(CCl)C(=O)NC[C@H]1CCN(C(=O)c2nccnc2C(N)=O)[C@H]1c1cccnc1	1802905024	WXOJPIVKHPDKEV-PBHICJAKSA-N	444.923	1.555	50	20	IDGD	
COc1ncccc1CCC(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1	1804540522	KJVMBHDXSKGXGO-NSHGMRRFSA-N	446.935	1.724	50	20	IDGD	
O=C(CC1CCCC1)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1806189704	GUHTUVGHILSKHN-OFNKIYASSA-N	435.333	1.661	50	20	IDGD	
O=C(O)CSCC(=O)N1CC[C@H](CNC(=O)CCBr)[C@@H]1c1cccnc1	1806347397	WUFAAFIRIDYONA-DYVFJYSZSA-N	444.351	1.690	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)CC(F)(F)F)[C@@H]1c1cccnc1	1806840534	GIKBCEBCBXWNEK-KSSFIOAISA-N	429.443	1.413	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@H](CNC(=O)CN2CCOCC2)[C@H]1c1cccnc1	1806905408	MPVZUGCHTQELLB-GHTZIAJQSA-N	434.613	1.271	50	20	IDGD	
O=C(Cn1ccnn1)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@@H]1c1cccnc1	1807683308	ZZKXREURMUVNGJ-CFVMTHIKSA-N	425.262	1.070	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cc(O)n[nH]2)[C@@H]1c1cccnc1)[C@@H](F)Br	1808662414	ZZDSRWUAGSGFHJ-ZLKJLUDKSA-N	426.246	1.520	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)N1CC[C@H](CNC(=O)[C@H](F)Br)[C@H]1c1cccnc1	1808668954	TXSYSRNWLMFYFQ-CUBALJKWSA-N	441.301	1.469	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2cc3n(n2)CCC3)[C@H]1c1cccnc1	1809985045	QTBURTWWKXIGRO-HHXXYDBFSA-N	431.924	1.798	50	20	IDGD	
CCOC(=O)N[C@H](O)C(=O)NC[C@@H]1CCN(C(=O)C(C)(C)CCl)[C@H]1c1cccnc1	1810086747	IKPSSHAPOXGTMN-YQQAZPJKSA-N	440.928	1.417	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2ccc(OC)nn2)[C@H]1c1cccnc1	1813031868	RZCWSKSQDBBROB-VKJFTORMSA-N	433.896	1.454	50	20	IDGD	
O=C(CSc1nc[nH]n1)NC[C@@H]1CCN(C(=O)C(Cl)Cl)[C@H]1c1cccnc1	1813351852	SRWSQLZRCVIJSX-AAEUAGOBSA-N	429.333	1.802	50	20	IDGD	
O=C(/C=C/c1ccccc1)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1	1815339413	DYGZONQZPADHEI-LGWVBRRBSA-N	447.325	1.762	50	20	IDGD	
Cc1ccc(CC(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)cn1	1815976634	VOJGVABUCMYWGU-FQEVSTJZSA-N	447.304	1.342	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](O)CCl)CC2)c1snnc1C1CC1	1817831239	CWFUFQCCEPDLCV-WCBMZHEXSA-N	427.939	1.698	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](O)NC(=O)OCC)n[nH]1	1819238366	UQXSZWFBLOMFKD-DETPVDSQSA-N	429.905	1.874	50	20	IDGD	
C[C@@H](Cn1ccnc1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1	1822416417	CWNPLACZTJBCFU-RDJZCZTQSA-N	444.540	1.308	50	20	IDGD	
COC(=O)[C@@H]1CC[C@H](C(=O)N2CCCC[C@@H]2C2CCN(C(=O)[C@@H](O)CCl)CC2)C1	1824172580	QQRCYUQSZQGLQV-MLHJIOFPSA-N	428.957	1.795	50	20	IDGD	
Cc1cc2nnc(C(=O)N3CCC([C@@H]4CCCCN4C(=O)[C@@H](O)CCl)CC3)c(C)n2n1	1824187965	WGFNUGXJSVMLMY-IRXDYDNUSA-N	448.955	1.574	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)C(O)O)CC1	1825005543	HYINFANTRKHZAD-LSDHHAIUSA-N	447.960	1.049	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc3nncn3c1)CC2	1826000321	RXHOFDNBLCDWOZ-RYUDHWBXSA-N	434.909	1.665	50	20	IDGD	
Cc1ccc(C)c(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2ccc(B(O)O)cc2)CC3)c1	1827551560	QHIYTERMBFEZEI-QGZVFWFLSA-N	449.341	1.979	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)/C=C\C(=O)NC2CC2)CC1	1828794040	AEEPSPGQEZBQSU-MZIIKBMYSA-N	425.957	1.695	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(Cl)c3C)CCO2)C1	1830140202	UMQUKBBANYESFB-XLIONFOSSA-N	445.343	1.972	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CN3CCC(C)CC3)C2)C1	1831639488	ACHVNPQBPBAOFV-RXVVDRJESA-N	429.989	1.582	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(NC(C)=O)o3)C2)C1	1831651990	VKYHJWKOGJIWEN-YWZLYKJASA-N	441.912	1.716	50	20	IDGD	
CCc1cc(C(=O)N2CCC([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)nn1C	1831873233	FDPMTYXKSZACPU-HXUWFJFHSA-N	446.596	1.589	50	20	IDGD	
Cc1nccn1[C@@H](C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1	1832314741	WTABINVYSARKDJ-FXAWDEMLSA-N	446.596	1.745	50	20	IDGD	
O=C(C[C@@H]1CCCCO1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1832346041	HXJHTNOINMRVQR-JLJPHGGASA-N	437.306	1.093	50	20	IDGD	
COc1ccc(C(=O)N2CCC(N3CCC(NC(=O)[C@H](O)CCl)CC3)CC2)s1	1833308493	UEVMSEUCTQVXQZ-OAHLLOKOSA-N	429.970	1.542	50	20	IDGD	
Cc1cc(F)cc(C(=O)N2CCC(N3CCC(NC(=O)[C@@H](O)CCl)CC3)CC2)c1	1833313497	HVUOCGOZSZVDLX-IBGZPJMESA-N	425.932	1.919	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](C)NC(=O)CC)CC2)CC1	1833418143	RPKSVAZARIORLZ-CRAIPNDOSA-N	429.005	1.880	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(C(C)=O)[nH]n3)CCO2)C1	1833820981	PMNYKBDCSSINDY-IFXJQAMLSA-N	426.901	1.090	50	20	IDGD	
C#CCO[C@H](C)C(=O)N1CCC(N2CCC(NC(=O)CCBr)CC2)CC1	1834422507	QSMNBFLMVIMENX-OAHLLOKOSA-N	428.371	1.381	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccccc3)CCO2)C1	1834998933	AYANTKFBVDGVSF-DNVCBOLYSA-N	425.323	1.469	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(CN(C(=O)CCc3cccnc3)CCO2)C1	1836180815	UTCDBAQYSZMNNY-NRFANRHFSA-N	435.597	1.322	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)CN3CCCCC3=O)CC2)CC1	1836397311	DCEAZGPEEYVEBB-GOSISDBHSA-N	426.989	1.588	50	20	IDGD	
CCN(C)[C@@H](C)C(=O)N1CCC(N2CCC(NC(=O)[C@H](F)Br)CC2)CC1	1836413991	SYISFLNQFOJEJB-BBRMVZONSA-N	435.382	1.589	50	20	IDGD	
C[C@@H](Oc1ccccc1)C(=O)NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836416570	SEHBPNTVSGEFJP-OXQOHEQNSA-N	437.968	1.625	50	20	IDGD	
O=C(c1cc(C2CC2)on1)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836585323	IRFWIQAITCPDPK-QGZVFWFLSA-N	425.913	1.764	50	20	IDGD	
Cc1nc2sccn2c1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1837143303	CBLVWUUYWAWPPG-SUMWQHHRSA-N	430.889	1.309	50	20	IDGD	
CC(C)c1cc(C(=O)N2CCOC[C@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)no1	1837712270	MLJFZNMJEHQKPO-FQEVSTJZSA-N	439.585	1.720	50	20	IDGD	
O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)c1cc(Cl)ccn1)CCO2	1837863148	ZVJPZPVANMNTIN-KRWDZBQOSA-N	446.729	1.590	50	20	IDGD	
Cc1cc(NC(=O)CC(=O)N2CCC(OC3CCN(C(=O)[C@H](F)Cl)CC3)CC2)no1	1838083611	XZXBORBHWVHDCL-SFHVURJKSA-N	444.891	1.845	50	20	IDGD	
CCc1[nH]nc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](Cl)CC)CCO3)c1Cl	1839143742	HATUASJTISOHOK-KPZWWZAWSA-N	433.336	1.713	50	20	IDGD	
Cc1ncncc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2	1839153667	OABQUYPNONJPOV-QZTJIDSGSA-N	431.320	1.091	50	20	IDGD	
Cc1cc2cc(C(=O)N3CCO[C@]4(COCCN(C(=O)[C@@H](O)CCl)C4)C3)ccc2[nH]1	1839614401	DQSWXENBAMTDEK-GHTZIAJQSA-N	435.908	1.146	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3CC[C@H](O)CC3)C2)C1	1839966805	QKOKKFBTHYUMNM-FPXQBCRKSA-N	447.370	1.167	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3CCSCC3)C2)C1	1840035932	KYCORZLUWROFCP-GUYCJALGSA-N	435.384	1.369	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3csc(C)c3C)C2)C1	1840150705	PLCWAUAHWXDDKB-LPHOPBHVSA-N	430.954	1.689	50	20	IDGD	
O=C(c1cc2ncsc2[nH]1)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840188440	JVXASJOTEIUCKA-MRXNPFEDSA-N	433.317	1.498	50	20	IDGD	
CN(C)c1ccc(CCC(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)cc1	1840314961	WUSVORKBUNRZNJ-PZJWPPBQSA-N	441.931	1.676	50	20	IDGD	
C[C@H]1CC[C@@H](C(=O)N2CCCC23CN(C(=O)[C@H](O)CCl)C3)N1C(=O)OC(C)(C)C	1841010669	WSUWEZWROPQRPI-SOUVJXGZSA-N	429.945	1.578	50	20	IDGD	
O=C(c1c(Cl)ccc(Cl)c1O)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843012071	ABMHISOCSRPUGU-UHFFFAOYSA-N	449.099	1.510	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2cccc3cccnc23)C1	1843639260	ZRRVUBBCXZBUCX-UHFFFAOYSA-N	430.468	1.364	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)C2(C)CN(C(=O)OC(C)(C)C)C2)C1	1843948757	VYYLZNZSUBRKNU-CQSZACIVSA-N	429.945	1.701	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@](C)(NC(C)=O)c2ccccc2F)C1	1845262882	SWRUTEOMSWYGGP-OXJNMPFZSA-N	439.915	1.634	50	20	IDGD	
COc1ccc(/C=C/C(=O)N2CCCC23CN(C(=O)CCC(=O)NN(C)C)C3)c(F)c1	1846245631	ZYDCLPGLVZNSKE-RMKNXTFCSA-N	432.496	1.424	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)CN(C)C(C)C)C1	1846712680	QSKHUJCQLHZOJC-UHFFFAOYSA-N	432.477	1.677	50	20	IDGD	
CN(CCOc1ccccc1Cl)C(=O)NNC(=O)c1csc(N2CCOCC2)n1	9790177	WZIGTDDAYURDEJ-UHFFFAOYSA-N	439.925	1.998	50	20	IDGD	
CN(CCCC(=O)NNC(=O)c1ccc2c(c1)OCO2)S(=O)(=O)c1ccc(F)cc1	23146872	ARZJVYYILKTDAF-UHFFFAOYSA-N	437.449	1.416	50	20	IDGD	
O=C(CN1CCN(CC(=O)Nc2ccc(F)cc2)CC1)NNC(=O)c1ccccc1Cl	23302032	GMCHGLMFLOHABL-UHFFFAOYSA-N	447.898	1.496	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)NC(C)C)cc2)o1	109006538	OXPWXSWGCRHRRM-UHFFFAOYSA-N	436.534	1.883	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@H]1CCCN(C(=O)C(C)(C)C)C1	109076316	UJWLLGVFVLWYKQ-AWEZNQCLSA-N	437.566	1.334	50	20	IDGD	
O=C(NNC(=O)c1nccnc1C(=O)NCc1ccc(F)cc1)c1cccc([N+](=O)[O-])c1	726520613	HQRQMPCTYPLBCE-UHFFFAOYSA-N	438.375	1.529	50	20	IDGD	
COc1cc(F)c(S(=O)(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)c(F)c1	726765126	WHADXQWACRSJMP-UHFFFAOYSA-N	432.401	1.623	50	20	IDGD	
Cn1ncc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)c1C(F)F	727364936	XKXSEVNYMDKBEW-UHFFFAOYSA-N	441.460	1.607	50	20	IDGD	
O=C(CCCc1ccccc1)NNC(=O)NCCC(=O)N1CCN(c2ccccn2)CC1	727940949	IXGUSDDPZKVEPT-UHFFFAOYSA-N	438.532	1.474	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3cc4ccccc4nc3O)cc2)CC1	728213691	GSBWYVGORSMTQM-UHFFFAOYSA-N	441.513	1.633	50	20	IDGD	
N#Cc1cccc(C(=O)NNS(=O)(=O)c2ccc(I)cc2)c1	728853353	FZJQXUOAXGOOJB-UHFFFAOYSA-N	427.223	1.786	50	20	IDGD	
Cc1cc(C)cc(N2CC[C@@H](C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)C2=O)c1	728890553	VSYLOQWEOQLQRC-IBGZPJMESA-N	436.516	1.510	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CSCN1C(=O)c1ccc(Cl)cc1)[C@H]1COc2ccccc2O1	729166940	AXRKAXPSQFOTQI-WMLDXEAASA-N	447.900	1.843	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)C1CCN(S(=O)(=O)c2ccccc2F)CC1	731329103	XSLRBXFSHXYRRP-UHFFFAOYSA-N	437.468	1.756	50	20	IDGD	
COc1ccccc1NC(=S)NNC(=O)CN1C(=O)COc2ccc([N+](=O)[O-])cc21	731546303	OVMYLSBHXPOTAA-UHFFFAOYSA-N	431.430	1.347	50	20	IDGD	
CC[C@H](C(=O)NNC(=O)NNC(=O)c1csc(N2CCOCC2)n1)c1ccccc1	732235906	LQLVIPKVOXSRCL-AWEZNQCLSA-N	432.506	1.149	50	20	IDGD	
Cc1nn(-c2ccccc2)c2sc(C(=O)NNC(=O)NC[C@@H]3CN(C)CCN3C)cc12	732475250	ZAIBKPKMAPKMPH-MRXNPFEDSA-N	441.561	1.585	50	20	IDGD	
O=C(NNC(=O)[C@@H](Cc1cccnc1)NC(=O)c1ccccc1)c1ccc([N+](=O)[O-])cc1	733252022	BDMBLACXAMIEHZ-LJQANCHMSA-N	433.424	1.792	50	20	IDGD	
CN(C)CC(=O)NNC(=O)c1ccc(NC(=O)c2cccc(Br)c2)cc1O	733359137	BETPKYLQLQCVRH-UHFFFAOYSA-N	435.278	1.730	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)Cc1ccc(F)c(Br)c1	734241756	JTGRRRUISXNQBW-UHFFFAOYSA-N	433.278	1.986	50	20	IDGD	
CCCCn1c(=O)nc(O)c2c1nc(CCC(=O)NNc1cc(C)ncn1)n2CC(C)C	734254561	QEAKJSDHTPAJGP-UHFFFAOYSA-N	442.524	1.929	50	20	IDGD	
O=C1CCc2cc(Br)c(S(=O)(=O)NNC(=O)c3ccccn3)cc2N1	734807289	YQDMIJILJVNBQN-UHFFFAOYSA-N	425.264	1.352	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)CN(Cc2cccnc2)c2ccccc2)c2ccccc2c1=O	735647128	HLDRLTYFRHXWGM-UHFFFAOYSA-N	442.479	1.796	50	20	IDGD	
CC(C)N(C)S(=O)(=O)c1ccc(Cl)c(C(=O)NNc2ccnc(N(C)C)n2)c1	740104447	LEJQVERDOAHPBR-UHFFFAOYSA-N	426.930	1.982	50	20	IDGD	
C[C@@H]1CN(S(=O)(=O)c2cccc(C(=O)NNc3ccnc(N(C)C)n3)c2)C[C@@H](C)O1	740104691	PVXSPSDLITYNGL-ZIAGYGMSSA-N	434.522	1.097	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCCC[C@@H]2C)cc1C(=O)NNc1ncnc2[nH]cnc12	740746644	YWYVTBBXAQZBII-ZDUSSCGKSA-N	429.506	1.981	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN(C(=O)COc2ccccc2)C1)c1ccc2c(c1)OCCO2	741176110	LPXMBZITTPIFIL-KRWDZBQOSA-N	439.468	1.536	50	20	IDGD	
Cn1c(SCC(=O)NNC(=O)c2ccc(C#N)cc2)nc2sc3c(c2c1=O)CCC3	742445571	QYIOAMCAIKTGKG-UHFFFAOYSA-N	439.522	1.909	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)N[C@@H]2CC(=O)N([C@H]3C[C@H]3c3ccccc3)C2)c1	743702057	NNJKAZSGCSOZRW-UXPWSPDFSA-N	438.484	1.805	50	20	IDGD	
CC(C)(C)C(=O)NNC(=O)CN1CCN(CCCc2nc(-c3cccs3)no2)CC1	744384007	CIAXMIWWIDOGQZ-UHFFFAOYSA-N	434.566	1.542	50	20	IDGD	
C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)OCC(=O)NNC(=O)c1cccc(C#N)c1	744496847	IOBJWTTVRWZEOW-LBPRGKRZSA-N	428.426	1.951	50	20	IDGD	
C=CCNS(=O)(=O)c1ccc(C(=O)OCC(=O)NNC(=O)c2cccc(C)c2)cc1	744561724	SSPCEVONHGJBAP-UHFFFAOYSA-N	431.470	1.077	50	20	IDGD	
CCSCC[C@@H](C)NC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	745923233	PBVNWEORKIMJJX-CQSZACIVSA-N	430.600	1.176	50	20	IDGD	
O=C(Cc1csc(NC(=O)c2cccc(O)c2)n1)NNC(=O)c1ccc2c(c1)OCO2	746882019	VUCDYGDOTSKLIQ-UHFFFAOYSA-N	440.437	1.833	50	20	IDGD	
CS(=O)(=O)CC[C@H](NC(=O)c1ccccc1Cl)C(=O)NNc1ccc(C#N)cc1	748101899	PKFRTVGHGGSJNO-KRWDZBQOSA-N	434.905	1.888	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)NCc1cn(-c2ccccc2)nc1-c1ccncc1	748622089	CJFSCDDHNQRIGC-INIZCTEOSA-N	438.488	1.816	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1	748633127	HMDWJEPMRREQRV-KGLIPLIRSA-N	430.452	1.639	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNS(=O)(=O)c2ccc(CC(=O)O)cc2)c1	748644264	VKFUVVLNIGJYGY-UHFFFAOYSA-N	443.275	1.708	50	20	IDGD	
CC(C)n1nc(C(=O)NNS(=O)(=O)c2cc(C(=O)O)ccc2O)c2ccccc2c1=O	748673672	GTRQAQWXGCPWRM-UHFFFAOYSA-N	446.441	1.005	50	20	IDGD	
Cc1nc(S(=O)(=O)NNC(=O)c2nn(CCC(C)C)c(=O)c3ccccc23)cn1C	748791472	URQIWVAHDZGLDY-UHFFFAOYSA-N	432.506	1.108	50	20	IDGD	
O=C(NC1CC1)c1cc(F)c(NNC(=O)[C@@H]2Nc3ccccc3S(=O)(=O)N2)c(F)c1	748828299	WTDSONYGLOFRHL-MRXNPFEDSA-N	437.428	1.030	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)[C@H]2CCCN2C(=O)c2ccc3c(c2)OCO3)cc1	749559631	BOQDBCQOWLPDQS-QGZVFWFLSA-N	425.441	1.555	50	20	IDGD	
CS(=O)(=O)Cc1ccccc1CNC(=O)NNC(=O)c1cc(Br)c[nH]1	749585053	DPGFBCUFKIPGEM-UHFFFAOYSA-N	429.296	1.466	50	20	IDGD	
O=C(NCc1ccccc1CN1CCC(O)CC1)NNC(=O)c1cc([N+](=O)[O-])ccc1O	749590109	LGEQJMFCXGAOPW-UHFFFAOYSA-N	443.460	1.401	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CC[C@@H](N(C)C(=O)OC(C)(C)C)C2)cc1OC	749853952	VUBKSOPVOFTCQT-OAHLLOKOSA-N	436.509	1.406	50	20	IDGD	
CO[C@H](C)c1noc(CN2CCCN(C(=O)NNC(=O)COCc3ccccc3)CC2)n1	750283007	YKQNCLLIJVUJMN-MRXNPFEDSA-N	446.508	1.242	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@@H](C(=O)NNC(=S)N[C@H](C)C3CC3)C2)s1	751620634	KOPNOFIHKFCXIK-TZMCWYRMSA-N	430.621	1.751	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)N[C@@H]1CCCN(Cc2ccccn2)C1=O	753297376	IFUOASWSNSSEDC-KBXCAEBGSA-N	429.452	1.510	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@]2(C)CCOC2)c1	754828724	JWSKCANSIRVWTI-FQEVSTJZSA-N	433.486	1.684	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)[C@](C)(O)c1cccc(C(F)(F)F)c1	754847779	XHLUTDQQNCASPJ-QGZVFWFLSA-N	434.415	1.768	50	20	IDGD	
O=C(CNC(=O)c1ccccc1C(F)(F)F)NNC(=O)c1nnc(O)c2ccccc12	755046417	OZCLYVFMMVHTBY-UHFFFAOYSA-N	433.346	1.545	50	20	IDGD	
C[C@H](C(=O)N1CCCC1)N1CCN(C(=O)NNC(=O)c2c(Cl)cccc2Cl)CC1	755149324	PQKLZPUMNZLAIY-CYBMUJFWSA-N	442.347	1.976	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)Nc1ccc(N2CCCS2(=O)=O)cc1	755591986	FBUJNXOUKBWTAG-CYBMUJFWSA-N	436.465	1.986	50	20	IDGD	
O=C(CN1CCOCC1)Nc1ccc(NC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1	755599657	NLYOQKONFFORFM-UHFFFAOYSA-N	442.432	1.332	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)Nc1ncn(CC(=O)N(C)C)n1	756770747	MPJCNKJZAHLUBT-ZDUSSCGKSA-N	425.449	1.140	50	20	IDGD	
O=C(NCc1cc2c(cc1OC(F)F)OCO2)NNC(=O)c1ccc2c(c1)OCCO2	756958442	CNFLBAJFVOTRGO-UHFFFAOYSA-N	437.355	1.932	50	20	IDGD	
O=C(c1cccn1Cc1ccccc1)N1CCN(S(=O)(=O)CBr)CC1	758512322	KUQMDGKGANNSLS-UHFFFAOYSA-N	426.336	1.976	50	20	IDGD	
Cc1nc2c(cc1C(=O)N1CCN(S(=O)(=O)CBr)CC1)c(C)nn2C	758522072	DGVPFIGCFRJEAY-UHFFFAOYSA-N	430.328	1.025	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccnn1Cc1ccc(F)cc1	760280820	XSCFNEWHLCCGOA-UHFFFAOYSA-N	429.383	1.375	50	20	IDGD	
Cn1cc(-n2cc(C(=O)NNC(=O)NCc3cccc(C(F)(F)F)c3)ccc2=O)cn1	760804508	NPMNKJYZLQIBAO-UHFFFAOYSA-N	434.378	1.734	50	20	IDGD	
C#CCN1C(=O)C(=NNC(=O)CNC(=O)c2cccnc2)c2cc(Br)ccc21	763196245	RBCGDDIKNSQNFA-UHFFFAOYSA-N	440.257	1.074	50	20	IDGD	
CN1CCC[C@@H](N(C)C(=O)c2ccc(NC(=O)C(=O)NNC(=O)c3ccccc3)cc2)C1	763432023	WRVLXEQNTLWNSI-LJQANCHMSA-N	437.500	1.253	50	20	IDGD	
O=C(NNC(=O)c1ccccc1O)C(=O)Nc1ccccc1-n1cc(Br)cn1	763529817	NOQPBHKEPFTNRI-UHFFFAOYSA-N	444.245	1.740	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)cc1OC	763543103	KYNYSWYWVJBSFY-UHFFFAOYSA-N	436.346	1.994	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(N3CCCCC3=O)c2)cc1OC	763551462	XQBNUBWFSMJGMV-UHFFFAOYSA-N	440.456	1.620	50	20	IDGD	
COC(=O)c1c(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)sc(C)c1C	763569850	CLRUFHJQVVYIHZ-CYBMUJFWSA-N	433.442	1.077	50	20	IDGD	
COC(=O)c1cc2cc(NC(=O)C(=O)NNC(=O)[C@H]3COc4ccccc4O3)ccc2o1	763570366	DTXJSQJEDJUTOW-QGZVFWFLSA-N	439.380	1.145	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2c(C)cccc2C(=O)N2CCCC2)c1	763624628	XMEFIQNYIGVZGO-UHFFFAOYSA-N	438.484	1.704	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc2c(c1)NC(=O)[C@H](C)O2	763712416	QGYLFBJTXLBPGT-LBPRGKRZSA-N	426.429	1.133	50	20	IDGD	
COC(=O)c1cc(OC)ccc1NC(=O)C(=O)NNC(=O)C12CC3CC(CC(C3)C1)C2	763727272	AYCVIDQWQUJDJK-UHFFFAOYSA-N	429.473	1.784	50	20	IDGD	
CC(=O)Nc1ccc(Cl)c(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)c1	763727362	DFHOGTVHZNDAEZ-UHFFFAOYSA-N	443.891	1.837	50	20	IDGD	
CCn1cnnc1-c1cccc(NC(=O)C(=O)NNC(=O)c2cc(OC)cc(OC)c2)c1	763771982	JOBQXLQISGJGAI-UHFFFAOYSA-N	438.444	1.382	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(N3CCCS3(=O)=O)ccc2F)cc1	763831366	VNQLJCDZNRNIPD-UHFFFAOYSA-N	448.476	1.328	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)nn1-c1cccc(F)c1	763838209	QDNKQKGJTQSPSR-UHFFFAOYSA-N	429.383	1.624	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)COc2ccccc2Br)c1	763861199	MVPHBCPUVUTQKC-UHFFFAOYSA-N	432.230	1.704	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(CC(N)=O)cc1	763875767	ANJAUITXAZJXKJ-CYBMUJFWSA-N	446.891	1.538	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cccc(-n3ccnc3)c2)cc1	763879056	VXFYDJBJLYRRBH-OAHLLOKOSA-N	435.440	1.628	50	20	IDGD	
CCCNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2ccc(OCC)c(OC)c2)c1	763900301	IEVRGAGIGQQVRU-UHFFFAOYSA-N	442.472	1.633	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(-c3nnc(C)o3)cc2)cc1OC	763902116	NJPOJNJUDWWHGS-UHFFFAOYSA-N	439.428	1.852	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1ccccc1C(=O)N1CCCC1	764012417	PMKDZWYTYAIKSX-UHFFFAOYSA-N	444.875	1.984	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cccc3ccccc23)cc1S(C)(=O)=O	764050196	BVUJVFSFYPKJJC-UHFFFAOYSA-N	425.466	1.951	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc(-n4ccnn4)cc3)n[nH]2)cc1	764112170	WYIAQVBRNRGTEO-UHFFFAOYSA-N	430.428	1.366	50	20	IDGD	
CN(C)c1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C	764203974	GRTKZQPGRSOHHS-UHFFFAOYSA-N	441.916	1.797	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)C(=O)Nc2ccc(N(C)C)cc2)c1	764231182	FDPKOYYQMSYYCP-UHFFFAOYSA-N	435.278	1.923	50	20	IDGD	
COC(=O)c1cc(OC)ccc1NC(=O)C(=O)NNC(=O)c1cccc(OC(F)F)c1	764252492	GYIQVQYDFYDTGZ-UHFFFAOYSA-N	437.355	1.483	50	20	IDGD	
CC(C)n1nnnc1-c1ccccc1NC(=O)C(=O)NNC(=O)c1cccc2ncccc12	764259754	IXYFWCOVCUQHRG-UHFFFAOYSA-N	444.455	1.869	50	20	IDGD	
Cc1cc(C(=O)NC2CCCCC2)ccc1NC(=O)C(=O)NNC(=O)Cc1ccccn1	764267067	MDMOHYFVJQCCFR-UHFFFAOYSA-N	437.500	1.781	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(-c3noc(C)n3)c2)c(OC)c1	764284565	OOHUADMAAVCONS-UHFFFAOYSA-N	425.401	1.462	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(Cl)nc2)cc1Br	764326489	KJEIJZGHLXKVPF-UHFFFAOYSA-N	427.642	1.906	50	20	IDGD	
COC(=O)CCOc1ccc(NC(=O)C(=O)NNC(=O)c2cc3ccccc3o2)cc1	764331742	ZCVQTICYDORNHD-UHFFFAOYSA-N	425.397	1.774	50	20	IDGD	
Cn1c(=O)oc2c(NC(=O)C(=O)NNC(=O)c3cc(-c4ccc(F)cc4)[nH]n3)cccc21	764386596	BOMBHSLHDDRTTG-UHFFFAOYSA-N	438.375	1.060	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1ccc(C(=O)N2CCC[C@@H](C)C2)cc1C	764398609	HNEDDMAOWKXKEI-ZBFHGGJFSA-N	448.520	1.005	50	20	IDGD	
O=C(NNC(=O)C1(O)CCSCC1)c1nn(Cc2ccccc2)c(=O)c2ccccc12	764599944	WQCYERPXXHQOIY-UHFFFAOYSA-N	438.509	1.464	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)C[C@H](C)c3c(C)n[nH]c3C)CC2)cc1	764753028	QMTHPWJCVSQWJB-KRWDZBQOSA-N	426.565	1.794	50	20	IDGD	
CCn1c(=O)c(=O)[nH]c2cc(C(=O)NNC(=O)c3cc(-c4ccc(C)c(C)c4)[nH]n3)ccc21	765567559	QBLUIJBFMHRPBC-UHFFFAOYSA-N	446.467	1.791	50	20	IDGD	
Cc1cc(F)ccc1-n1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)nn1	767191820	ISRRPUAEPHVNFG-UHFFFAOYSA-N	446.464	1.040	50	20	IDGD	
CCOCCCn1c(NNC(=O)c2cc(OC(F)F)n(C)n2)nc2ccccc2c1=O	768141886	UXMLYGQTGRKNHL-UHFFFAOYSA-N	436.419	1.915	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(N2CCOCC2)c(C(=O)NNc2nc3ccccc3[nH]2)c1	768497075	ZNBWHWWBCMWULP-UHFFFAOYSA-N	444.517	1.407	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)N2CCN(S(=O)(=O)c3nc[nH]n3)CC2)c(C)n1CC(C)C	768726138	UMBPTWQHFVWDQH-ZDLGFXPLSA-N	445.549	1.319	50	20	IDGD	
CSCCNC(=S)NNC(=O)[C@@H]1CC(=O)N(CCOc2ccccc2Cl)C1	769767898	AJPWDDGJJKYNNP-GFCCVEGCSA-N	430.983	1.426	50	20	IDGD	
COc1ccccc1COC1CCN(CC(=O)NNC(=O)Cc2nc(C)cs2)CC1	769957620	LTXHGXKBEMFDRE-UHFFFAOYSA-N	432.546	1.831	50	20	IDGD	
NS(=O)(=O)c1ccc(NC(=O)COC(=O)[C@@]23CC[C@@H](C[C@H]2Br)C3)cc1	769982723	RLHRTDKBAVSDMY-OWRWGESLSA-N	431.308	1.769	50	20	IDGD	
CNS(=O)(=O)c1ccc(NC(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)cc1	770035802	WELIPPFWWMYPHM-UHFFFAOYSA-N	434.446	1.740	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)[C@@H]2CCN(C(=O)OCc3ccccc3)C2)c1	770133069	CHNXWUCRRZQCPO-QGZVFWFLSA-N	426.473	1.913	50	20	IDGD	
CCN(Cc1ccccc1)C(=O)CNC(=O)NNc1nc(O)c2cnn(C(C)(C)C)c2n1	770354605	GNQCOCMFIIRNHR-UHFFFAOYSA-N	440.508	1.962	50	20	IDGD	
CCOC(=O)N1CC[C@H](NC(=O)NNC(=O)Nc2cc(Cl)c(OC)cc2OC)C1	770530742	IJKVJPNCMJKBFD-JTQLQIEISA-N	429.861	1.924	50	20	IDGD	
C[C@@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)NNc2ccnc(Br)c2)C1=O	771548917	COKQVUPKLISJCU-KRWDZBQOSA-N	436.241	1.894	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCCNC(=O)NNC(=O)Nc2ccc(N(C)C)cc2)s1	772630198	HAJQMZCPUAVBLE-UHFFFAOYSA-N	440.551	1.437	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(NC(=O)CCN(C)C)cc2)cc1F	773885676	OMSRMCKKYGEVLR-UHFFFAOYSA-N	429.452	1.424	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)N3CCOCC3)cc2C)cc1F	773889100	KERNTTUTWGZOLX-UHFFFAOYSA-N	442.447	1.315	50	20	IDGD	
CCCNC(=O)[C@H]1CN(C(=O)C(=O)NNc2nccnc2C(C)C)c2ccccc2O1	773990602	BAQHAJBNHXREEE-MRXNPFEDSA-N	426.477	1.364	50	20	IDGD	
COCc1ccc(S(=O)(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)cc1	774622091	XBKVYQFWPVUVPD-UHFFFAOYSA-N	446.573	1.269	50	20	IDGD	
COc1cc(OC)cc(N2CC[C@@H](NC(=O)NNc3cccc(S(C)(=O)=O)c3)C2=O)c1	776623267	KPMNCWANWZPBGU-GOSISDBHSA-N	448.501	1.539	50	20	IDGD	
COc1nc(C)c(Br)cc1C(=O)NNC(=O)CNC(=O)c1cccs1	776814202	BCNHLSSDWCOJJO-UHFFFAOYSA-N	427.280	1.414	50	20	IDGD	
Cc1cc(C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)nn1-c1ccc(F)cc1	777151895	HUFFNJNYGHISDB-UHFFFAOYSA-N	441.375	1.846	50	20	IDGD	
CCOC(=O)N1CCC([C@@H](C)NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)CC1	777507236	FZRMOOQEYFEBGJ-OAHLLOKOSA-N	447.540	1.280	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)[C@]23CCC(=O)N2c2ccccc2C(=O)N3C2CC2)c1	777838955	IHDLEEHEIGLTIP-DEOSSOPVSA-N	447.495	1.655	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)NCCc1cc(Br)ccc1F	778629206	DKYYCRZVFDNTLI-UHFFFAOYSA-N	433.278	1.986	50	20	IDGD	
O=C(/C=C\c1ccc(O)c(O)c1)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	779531580	CIELBFVUCFLAGV-VURMDHGXSA-N	444.919	1.730	50	20	IDGD	
COc1cccc(NNC(=O)CN(C)S(=O)(=O)c2ccc(Br)cc2)n1	780768830	FVDGGABUSWANLC-UHFFFAOYSA-N	429.296	1.617	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)CN2C(=O)N[C@](C)(c3ccc(OC)cc3)C2=O)c1	780793250	VKTAILYJFATLSR-OAQYLSRUSA-N	426.429	1.392	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3OC)[nH]n2)ccc1F	782123642	HXLRZZOQSDHMIP-UHFFFAOYSA-N	427.392	1.633	50	20	IDGD	
CN(C)C(=O)C[C@@H]1CN(C(=O)C(=O)NNc2ncncc2Cl)c2ccc(Cl)cc21	782160406	SANRLZROPUYEQI-SNVBAGLBSA-N	437.287	1.835	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)C(=O)Nc2ccc3c(c2)CCCC(=O)N3)nc2ccccc21	782895239	YAMXVKJFKWNBCQ-UHFFFAOYSA-N	434.456	1.177	50	20	IDGD	
O=C(NNC(=O)C(=O)N1CCCC1)C(=O)Nc1cccc(OCc2ccc(F)cc2)c1	784000127	WTLULJOCZKNNLG-UHFFFAOYSA-N	428.420	1.113	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)C(=O)Nc1ccc(OC(F)F)c(Cl)c1	784004341	LFCPPEKIPAVEOD-UHFFFAOYSA-N	430.751	1.050	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cn(C(C)(C)C)nc3C)CC2)cc1	784684987	VXSQJSCLFDDYMZ-UHFFFAOYSA-N	426.565	1.834	50	20	IDGD	
C[C@@H]1CCCCN1CC(=O)Nc1ccc(F)c(NC(=O)C(=O)NNc2cccnn2)c1	784858450	MVYUNVGVLBYTKL-CYBMUJFWSA-N	429.456	1.510	50	20	IDGD	
NC(=O)C1CCN(c2ccccc2NC(=O)C(=O)NNc2cc(F)c(F)c(F)c2)CC1	785086627	BZKGLNMQYGOSRT-UHFFFAOYSA-N	435.406	1.887	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)N[C@@H]2CCCN(Cc3ccc(F)cc3F)C2=O)n1	786962687	QAPDWRPQZZXZQD-QGZVFWFLSA-N	434.447	1.300	50	20	IDGD	
CN1CCN(C(=O)NNC(=O)c2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2)CC1	788167116	VGLLMJSUPIPJPK-UHFFFAOYSA-N	435.481	1.228	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(Cl)cc2-n2cccn2)cc1	788330087	CZJLLFGRJHOBCA-UHFFFAOYSA-N	438.831	1.562	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)Cn1c(S)nc2ccccc2c1=O	788811608	GRLVIUSAZFENHQ-UHFFFAOYSA-N	428.470	1.310	50	20	IDGD	
Cc1ccc(-n2cccn2)cc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccc(F)cc1	789583971	AFJRJRNRTHBPLL-AWEZNQCLSA-N	425.420	1.873	50	20	IDGD	
CN(C)[C@@H]1CCOc2c(NC(=O)C(=O)NNC(=O)COc3ccc(Cl)cc3)cccc21	789731695	GDGLPJOBVIAZCG-QGZVFWFLSA-N	446.891	1.890	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)ccc1Cl	789813381	RYEGGEJLWNELBS-YOEHRIQHSA-N	445.859	1.785	50	20	IDGD	
O=C(NNC(=O)c1cccnc1OCc1ccccc1F)c1ccc(-n2cnnn2)cc1	790125727	SVQRZCRFRSTATF-UHFFFAOYSA-N	433.403	1.850	50	20	IDGD	
COc1ccccc1NC(=S)NNC(=O)CN1C(=O)N[C@@](C)(c2ccccc2)C1=O	792951476	AVTNMMAHZWVLAH-FQEVSTJZSA-N	427.486	1.480	50	20	IDGD	
CNS(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)C(C)(C)c2ccccc2)cc1C	794587941	RWSZBXOIFGWNHM-UHFFFAOYSA-N	425.532	1.190	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cc(Br)c(O)nc2C)cc(OC)c1OC	794756384	FVIJCPFAKIZBEE-UHFFFAOYSA-N	440.250	1.959	50	20	IDGD	
CCNC(=O)N(C)c1cccc(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)c1	796990204	OQPMKTLMUBREHZ-UHFFFAOYSA-N	431.424	1.156	50	20	IDGD	
COCCNS(=O)(=O)c1cccc(C(=O)NNc2ncnc(Cl)c2C(C)C)c1	798142695	PCJHUYQMBJKBJN-UHFFFAOYSA-N	427.914	1.935	50	20	IDGD	
CC(C)(C)OC(=O)C1=NO[C@@H](C(=O)NNC(=O)c2ccc(F)cc2Br)C1	798281030	DGXHAQLXRCQUPO-GFCCVEGCSA-N	430.230	1.836	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1ccccc1S[C@H](C)C(N)=O	801104275	HOUNDRPDKKXXEX-GFCCVEGCSA-N	449.558	1.329	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1c(C)nc2ncnn2c1C	801436038	HFTOPHNCUDCAFE-UHFFFAOYSA-N	432.824	1.021	50	20	IDGD	
CN(CCC(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1)C(=O)OC(C)(C)C	803101218	FAEKGXBNCUAXEO-UHFFFAOYSA-N	443.545	1.879	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@@H](O)c2cccc(C(F)(F)F)c2)cc1	803397429	UXOMYDCXMBWGHM-AWEZNQCLSA-N	431.392	1.995	50	20	IDGD	
CN(CCCN(C)C(=O)NNC(=O)c1csc(N2CCOCC2)n1)Cc1ccco1	804867492	CQEUEXDPBLARJM-UHFFFAOYSA-N	436.538	1.381	50	20	IDGD	
CCOC1CC(C(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)C1	805156155	JZIOBKPCKMSYFB-UHFFFAOYSA-N	431.514	1.741	50	20	IDGD	
Cc1cccn(Cc2c(F)cccc2NC(=O)C(=O)NNC(=O)c2ccccc2O)c1=O	806972710	IEHPJOKHDMLHCO-UHFFFAOYSA-N	438.415	1.449	50	20	IDGD	
CCN(C)C(=O)c1cccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)c1	806974806	HAGIJCPBHCYONM-ZDUSSCGKSA-N	430.436	1.471	50	20	IDGD	
COCCNC(=O)c1cccc(NC(=O)C(=O)NNc2ccc(Br)cn2)c1	807005412	HSINAAVABJXICU-UHFFFAOYSA-N	436.266	1.302	50	20	IDGD	
CCN(C)C(=O)c1cccc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)c1	807067843	ATLYCGDSHCXJDG-OALUTQOASA-N	438.484	1.437	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cnc(C4OCCO4)s3)CC2)cc1	807093060	IZPKDNQWQCAYQH-UHFFFAOYSA-N	445.545	1.076	50	20	IDGD	
COC(=O)c1c(F)ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)c1C	810387340	RIUNEEJNPIEKNO-UHFFFAOYSA-N	445.432	1.772	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)CNS(=O)(=O)c2c(C)c(C)cc(C)c2C)nc1C	810931435	DOTVWEMTYGSXKF-UHFFFAOYSA-N	449.533	1.617	50	20	IDGD	
CC[C@]1(CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)OCCc2ccccc21	811851698	NYEAXTDQZGJOBA-OAQYLSRUSA-N	445.545	1.802	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2C(F)(F)F)on1)N[C@@H]1CCS(=O)(=O)C1	812534263	IZQKVNUVCKNSDB-SECBINFHSA-N	432.380	1.492	50	20	IDGD	
Cc1nc2c(c(O)nn2C)c(C)c1CC(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	812729186	FVMMGJRPEGNIQR-UHFFFAOYSA-N	432.506	1.227	50	20	IDGD	
Nc1ccc2c(c1)C(=NNC(=O)c1cccc(S(=O)(=O)N3CCOCC3)c1)CCC2	814688998	RMZPVVDQVLFYJJ-UHFFFAOYSA-N	428.514	1.760	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)CC(C)C)nnn1Cc1ccc(C(F)(F)F)cc1	815567266	SIMJGVMRQBRIEM-UHFFFAOYSA-N	426.399	1.786	50	20	IDGD	
C[C@@H](C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1)c1ccc2c(c1)OCO2	815734661	SYCGZEZPFQTHKY-CQSZACIVSA-N	433.486	1.683	50	20	IDGD	
Cc1ncc(S(N)(=O)=O)cc1C(=O)NNC(=O)COc1ccccc1-c1ccccc1	816806024	PSLGFIJSMGTVBC-UHFFFAOYSA-N	440.481	1.544	50	20	IDGD	
O=C(CSc1nnc(-c2ccccc2)n1-c1ccccc1)NNC(=O)[C@H]1CCC(=O)N1	864013362	QTUOJBLHOIGOKO-MRXNPFEDSA-N	436.497	1.452	50	20	IDGD	
Cc1c(C=NNC(=O)c2csc(N3CCOCC3)n2)c(=O)n(-c2ccccc2)n1C	912797953	UIKPLPSJLMYMNY-UHFFFAOYSA-N	426.502	1.541	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)C1=NN(c2ccccc2)[C@H](c2ccccc2)C1	912995520	CJAKLVWTGNRHGC-APWZRJJASA-N	426.498	1.576	50	20	IDGD	
CN(CC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)Cc1ccc(C(=O)NC2CC2)cc1	914574054	HBNZBSHAIWLKEL-UHFFFAOYSA-N	425.445	1.380	50	20	IDGD	
CCN(CC)C(=O)Nc1ccc(C(C)=NNC(=O)CSc2nnc(O)nc2O)cc1	914773783	WKBRTAMZLXSDSC-UHFFFAOYSA-N	433.494	1.789	50	20	IDGD	
O=C(NCc1ccccc1Cn1cncn1)NNC(=O)c1nn(-c2ccccc2)cc1O	914829305	QCYOPMDKLQBUID-UHFFFAOYSA-N	432.444	1.362	50	20	IDGD	
CN(CC(=O)NNC(=O)c1ccc(COc2ccccc2)o1)S(=O)(=O)c1cccnc1	915109653	NTUIZETULQMUGN-UHFFFAOYSA-N	444.469	1.335	50	20	IDGD	
COc1cccc(C[C@@H](C(=O)NNC(=O)c2ccc3c(c2)OCCO3)n2nnnc2C)c1	915695974	GGEYCGAQPRNBRX-KRWDZBQOSA-N	438.444	1.006	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2cc(S(=O)(=O)N3CCCC3)c(C)o2)cc1OC	915806161	GXZSHAVQDNLZOL-UHFFFAOYSA-N	437.474	1.465	50	20	IDGD	
COc1ccc([C@H](CNC(=O)NNC(=O)c2ccccc2F)N2CCOCC2)cc1OC	915895429	NXGHNLXMPGMIRO-SFHVURJKSA-N	446.479	1.860	50	20	IDGD	
CCc1ccc([C@@H](CNC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)N(C)C)cc1	915901033	CQKZWIGVYNBBSI-LJQANCHMSA-N	436.516	1.743	50	20	IDGD	
COc1cccc([C@H](CNC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)N(C)C)c1	915901427	UBQCDMYUBICGLK-SFHVURJKSA-N	434.518	1.346	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)COc2cccc(C#N)c2)c1	916096318	NPRYZIPMUDEYNX-UHFFFAOYSA-N	430.486	1.429	50	20	IDGD	
O=C(CCCn1cncn1)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	916148184	JHAGIUJETPJHCG-UHFFFAOYSA-N	434.503	1.382	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)NNC(=O)NCc1ccc(C(=O)N2CCOCC2)cc1	916249082	XYQUCHVKWBIOJP-UHFFFAOYSA-N	435.484	1.713	50	20	IDGD	
CC(=NNC(=O)COc1ccc(C#N)cc1)c1ccc(OCC(=O)N2CCOCC2)cc1	916300323	ZKGKGWWFLCWOKR-UHFFFAOYSA-N	436.468	1.715	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NC[C@@H](c2ccsc2)N(C)C)c2ccccc2c1=O	916449315	BSNUIQZLJUBKMH-INIZCTEOSA-N	428.518	1.725	50	20	IDGD	
O=C(NCc1cnn(Cc2ccccc2)c1)NNC(=O)c1nn(-c2ccccc2)cc1O	916580293	ZGANGQKSSJOVFP-UHFFFAOYSA-N	431.456	1.967	50	20	IDGD	
COCCN1C(=O)c2ccc(C(=O)NNC(=O)c3ccc(Cl)cc3)cc2S1(=O)=O	916743711	ODYBTUHQZLKEDE-UHFFFAOYSA-N	437.861	1.206	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c(OC)c1OC	917664848	FWKIQBBHBBYBIL-UHFFFAOYSA-N	436.486	1.510	50	20	IDGD	
CC(C)CCOC1CCN(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)CC1	918002298	ZVKLIHWLXOXFJG-UHFFFAOYSA-N	425.555	1.861	50	20	IDGD	
Cc1c(/C=C(\C#N)C(=O)NCc2ccc(C(=O)N3CCNC(=O)C3)cc2)cc(C#N)n1C	918609886	VKWYHYGRYAUJJZ-DJKKODMXSA-N	430.468	1.001	50	20	IDGD	
CCOC(=O)c1ccc(CNC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)cc1	919919321	NSNRSMJVZWIXFG-UHFFFAOYSA-N	447.517	1.609	50	20	IDGD	
CC(=O)N(c1ccc(C)cc1)c1nc(C=NNC(=O)N[C@H]2CCS(=O)(=O)C2)cs1	920378805	CFQAKPWJUOOSCA-AWEZNQCLSA-N	435.531	1.956	50	20	IDGD	
O=C(NCCCCN1CCN(c2ncccn2)CC1)NNC(=O)c1ccccc1Cl	1115999898	HVGFXVUUBVMHFS-UHFFFAOYSA-N	431.928	1.676	50	20	IDGD	
Nc1cnnc(NNC(=O)Cc2ccc(S(=O)(=O)N3CCCCC3)s2)c1Cl	1253123291	DTPNSPKFPRQVPW-UHFFFAOYSA-N	430.943	1.634	50	20	IDGD	
C[C@@H](Sc1ncccc1C(=O)NNc1ccc(-n2ccnc2)nn1)C(=O)N1CCCC1	1258219417	CAWBVMFMLBHMGX-CQSZACIVSA-N	438.517	1.917	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCc2cccc(OCCN3CCOCC3)c2)cc1	1337858877	PROPATHHPQOASG-UHFFFAOYSA-N	428.489	1.550	50	20	IDGD	
Cc1cccc(N2N=C(C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)CCC2=O)c1	1338556180	HCVVYVUWKWNNOT-UHFFFAOYSA-N	435.488	1.332	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Br)C2)c1cc(O)nc(O)c1	1777852164	GQSQTZKTQWVFKG-HYSWKAIVSA-N	446.273	1.311	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H]1COc3ccccc3O1)C2)[C@H](F)Cl	1778023174	XWFKRWLWPDJSHA-PDOICOKGSA-N	426.872	1.875	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc(C)nc2OC)C1	1779850958	KWCMJCXJENEWJX-CSODHUTKSA-N	439.940	1.780	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)NC(C)=O)C2	1781904754	BFNSQSJDXALQTP-MJXUCMMTSA-N	432.359	1.198	50	20	IDGD	
Cc1cnc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](C)Br)C2)cn1	1781996610	ONGDSLXZUWKFLQ-DDUZABMNSA-N	425.327	1.696	50	20	IDGD	
CC(C)Oc1ccc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)c(F)c1	1782065817	UASJTHRCJMZZNN-PXNSSMCTSA-N	428.888	1.656	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)c1c(Cl)cncc1Cl	1783422570	KPBJHLLJQBQNCY-ZNIXKSQXSA-N	436.723	1.581	50	20	IDGD	
C[C@H](Oc1ccccn1)C(=O)N1CC[C@@]2(CN(C(=O)[C@@H](F)Br)CCO2)C1	1784488101	MWLOEJRENXVYKQ-QEORTHHSSA-N	430.274	1.369	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H]2C[C@H]2C[C@@H]1C(=O)N1CC[C@@]2(CN(C(=O)[C@H](F)Cl)CCO2)C1	1785591420	GFSKOOVBZPFDGC-RHUWPCCZSA-N	445.919	1.749	50	20	IDGD	
O=C1COc2ccc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)[C@@H](F)Cl)C[C@@H]43)cc2N1	1788362755	RCICUGCNHPEUCY-WXRXAMBDSA-N	425.844	1.145	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3n[nH]c4c(F)cccc34)[C@H]2C1	1788395955	OTVZIHIXTYNOSC-PCBIJLKTSA-N	438.887	1.549	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)C[C@@H]21	1789864494	UIIOLIHPKPVTFF-FBAXNIALSA-N	438.908	1.814	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CNC(=O)c3ccco3)C[C@@H]21	1789866759	YWFBPGOELKOXCB-NGOJXBLDSA-N	446.331	1.225	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)c1ccc(-n2cccn2)cc1	1790108482	KBSFUEXMORGPOQ-KANFNMMFSA-N	432.908	1.065	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccnc(Cl)n3)C[C@@H]21	1790960884	SRDTZCCDEPTUOJ-MNXVOIDGSA-N	445.745	1.897	50	20	IDGD	
CCn1nc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](C)Br)[C@H]3C2)cc1C	1791059365	WXKMFQBEFRQMCR-YXWQFLTLSA-N	427.343	1.588	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1ccc(C2(NC(=O)CC[C@H](N)C(N)=O)CCC2)cc1	1791361093	QGGOVMJUBYYUOP-GJZGRUSLSA-N	439.354	1.887	50	20	IDGD	
Cc1cc(C)n(CCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)Br)C[C@@H]32)n1	1791511246	JMFMJFMFPNCWNC-QAETUUGQSA-N	441.370	1.653	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1ccc(C2(NC(=O)c3cc(=O)n4[nH]cnc4n3)CCC2)cc1	1791568087	VIKSCGOSNPASNJ-AWEZNQCLSA-N	444.879	1.419	50	20	IDGD	
CCOc1cnc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](Br)CC)C3)cn1	1794339479	GJQXWZVXLSZIFL-OQMKEHIESA-N	441.326	1.252	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(Cl)nc1F)c1cccc(B(O)O)c1	1794535457	CZQHBDCMAMSGQE-QDMKHBRRSA-N	431.660	1.120	50	20	IDGD	
Cc1cc(Cl)cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)c1	1796190593	OOYFBYWGORHBKX-ACDBMABISA-N	426.709	1.894	50	20	IDGD	
O=C(CCN1Cc2ccccc2C1=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2	1797186726	OHBKLMAVYFONHA-XOIINTDNSA-N	440.327	1.426	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CCC[C@H]1C	1797292334	CNVLIGOFBOJARH-OAUVYZRFSA-N	429.521	1.146	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1ccc(F)nc1)C2)[C@@H](F)Br	1799344135	AKIQYSNHXTYLKN-NOXHYTERSA-N	432.265	1.433	50	20	IDGD	
COc1cccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Br)c1C	1799347473	QEDCEKJQJPBSFQ-LTCOOKNTSA-N	443.313	1.826	50	20	IDGD	
N#Cc1cc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Br)ccc1F	1799348980	RPOXZBYQDAOUCA-RMHZUWNSSA-N	442.260	1.520	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(C)n(C(F)F)n1)C2	1800642537	NQYVIKDICMGZPP-OPDFLTKYSA-N	449.296	1.963	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cn3c(F)cccc3n1)C2	1800762669	WZPCHIGKNCHFAC-OVZMXSCWSA-N	439.285	1.460	50	20	IDGD	
C[C@@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCNC(=O)c1ccc[nH]1)C2	1801958437	BMPWHIAXILBFQV-YIYPIFLZSA-N	425.327	1.556	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H]1[C@H]3Sc4ccccc4[C@H]31)C2	1802337503	MSNRWVQYJZMUEJ-YKEXBACISA-N	442.585	1.886	50	20	IDGD	
CNC(=O)CC(=O)N1CC[C@H](CNC(=O)[C@H](C)CBr)[C@H]1c1cccnc1	1803011132	NYHZICUBXSZXGW-SUYBPPKGSA-N	425.327	1.255	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc3n[nH]cc3c2)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803138454	AXSADDVUZQYXLV-ZYSHUDEJSA-N	427.892	1.877	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2c[nH]c3ncccc23)[C@H]1c1cccnc1)[C@@H](O)CCl	1803139656	SIJAYZSFTMIPGB-WBAXXEDZSA-N	427.892	1.877	50	20	IDGD	
COc1cscc1C(=O)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1	1809971946	DRSLCOQJRONSSR-UHFFFAOYSA-N	442.346	1.595	50	20	IDGD	
O=C(CS[C@@H]1CCCCO1)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1	1810343423	VSWAVTRVIOEPKA-QFHJOOASSA-N	441.981	1.947	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)CN2CCOCC2)[C@H]1c1cccnc1	1812863963	JCFAYUITXSNBCU-ZVZYQTTQSA-N	439.354	1.203	50	20	IDGD	
CC(C)CNC(=O)C(=O)N1CC[C@H](CNC(=O)[C@H](C)Br)[C@@H]1c1cccnc1	1812864869	SMYQMHWWOHBOFQ-IMJJTQAJSA-N	439.354	1.643	50	20	IDGD	
Cc1ncccc1C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1813070305	HBFGLRNWROGYTI-GCJKJVERSA-N	438.532	1.478	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2ccc(F)cc2)[C@@H]1c1cccnc1	1813072139	BVEVATKJCKYXAM-PGRDOPGGSA-N	441.507	1.913	50	20	IDGD	
COC(=O)c1ccc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@@H](O)CCl)CC3)cn1	1817535557	KENYRASBFDJRTL-MFKMUULPSA-N	438.893	1.150	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](O)N2CCOCC2)n[nH]1	1819442205	XAQVFYROBDYWIU-ZBQZNYHESA-N	427.933	1.460	50	20	IDGD	
C[C@@H](C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCBr)CC2)n1ccnn1	1824683192	MZZDOYHDMOWVKT-VHSXEESVSA-N	427.328	1.693	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccnnc1O)CC2	1825643124	ZQQXHHNPHDTZMB-JGVFFNPUSA-N	426.296	1.648	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccnnc2)CC1	1825837847	GNKFRUDDPAYCGF-LJQANCHMSA-N	437.504	1.022	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cn3cccnc3n1)CC2	1825999649	BHXNEAGPKNACPP-WDEREUQCSA-N	434.909	1.665	50	20	IDGD	
C=CCC(F)(F)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827060354	GVEHHKRIUVFPBE-LJQANCHMSA-N	434.292	1.811	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)c2cnccc2F)CC1	1827320446	DKDUJOTWZKMAFW-OAQYLSRUSA-N	439.296	1.448	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(=O)n3[nH]nnc3n2)CC1	1827398436	BQFPPPZWXWXFHI-HNNXBMFYSA-N	449.943	1.311	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H]2C=CCN2)CC1	1827680050	CPOLPCDZBVQINQ-FMEPYYHXSA-N	440.548	1.268	50	20	IDGD	
N#CC1(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cnccc2C(=O)NN)CC3)CCC1	1828012602	BKPFCYMMKVJPSN-NSHDSACASA-N	439.501	1.061	50	20	IDGD	
CCN1CCC(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)CC1	1830371020	VKCHPTYGAXTIHQ-OAQYLSRUSA-N	429.989	1.440	50	20	IDGD	
C=CCSCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2	1830535892	VXXOJRKBYVYGKN-YOEHRIQHSA-N	435.384	1.393	50	20	IDGD	
CCNC(=S)NCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H](Cl)COC)CC1	1831093346	LLTJEFGJHMUAIT-JKSUJKDBSA-N	433.018	1.344	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3N(C)C)C2)C1	1831643861	JICMWNKQJGEMDN-DYESRHJHSA-N	438.956	1.625	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnoc3COC)C2)C1	1831647069	OXIWENPILZUNMU-DNVCBOLYSA-N	429.901	1.299	50	20	IDGD	
Cc1c[nH]c(C)c1CCC(=O)NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1833352525	DRLXUYUJUZVIHP-FQEVSTJZSA-N	439.000	1.735	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccsc3)CCO2)C1	1833968888	YWBLBNVDJYNSIY-WMLDXEAASA-N	431.352	1.992	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(F)cn3)CCO2)C1	1834480912	VCZPBNUFMCAPAM-SJKOYZFVSA-N	430.274	1.074	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnc(OC)c(C)c3)CCO2)C1	1834579529	AKPQMVKYFQWWCN-UZLBHIALSA-N	425.913	1.486	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnoc3C3CC3)CCO2)C1	1834616852	YDWZJZGSSVMFML-KZULUSFZSA-N	442.310	1.405	50	20	IDGD	
C[C@@H](Nc1cccnc1)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1835695362	FGZIEWBMPDCCEV-ACJLOTCBSA-N	431.320	1.142	50	20	IDGD	
Nc1nc2cc(C(=O)N3CCO[C@@]4(COCCN(C(=O)[C@@H](F)Cl)C4)C3)ccc2s1	1835784681	KJELUJIQVHDVQH-KDOFPFPSSA-N	442.900	1.483	50	20	IDGD	
Cc1ccccc1NCC(=O)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1835867458	YBUJSOPDAHAJOW-IBGZPJMESA-N	430.332	1.667	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)CSc3ncccn3)CCO2)C1	1836109956	STGLCPCBCGQWEN-LJQANCHMSA-N	442.969	1.290	50	20	IDGD	
CC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)Nc3cnccn3)CC2)CC1	1836397212	UIRCOUDLSVKADU-QAPCUYQASA-N	436.988	1.866	50	20	IDGD	
COc1cc(C(=O)N2CCC(OC3CCN(C(=O)[C@H](O)CCl)CC3)CC2)ccc1O	1836717363	CRAHOAGCBGKUFS-GOSISDBHSA-N	440.924	1.613	50	20	IDGD	
C[C@H](C(=O)N1CCC(OC2CCN(C(=O)[C@H](F)Br)CC2)CC1)n1cncn1	1838647946	ARCYJTRHKWQEJX-DOMZBBRYSA-N	446.321	1.528	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(C#N)ccc3F)CCO2)C1	1839422098	CGZRCOONLYACHS-OXJNMPFZSA-N	439.871	1.021	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc4nccn34)CCO2)C1	1839550082	XTACEZXKTBASMJ-OAQYLSRUSA-N	434.924	1.669	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cn3cnc4ccccc43)CCO2)C1	1840102805	WMLNUMRAHHEVMV-HRAATJIYSA-N	434.924	1.510	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cc(F)ccc3F)C2)C1	1840155659	CCNXTZDAJKTKKU-OXJNMPFZSA-N	446.878	1.218	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3ccccc3F)C2)C1	1840156026	HKPAABPWRZERCT-UTKZUKDTSA-N	442.915	1.469	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CC[C@H](O)CC1)CCO2	1840271502	BDXBIRGPOUWOMT-IUVQAAGXSA-N	447.370	1.167	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3cc(F)ccc3F)CCO2)C1	1840810876	IGRBJFRCPMGXOW-OXQOHEQNSA-N	430.879	1.981	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)[C@H]3CCCSC3)CCO2)C1	1840865642	UESCPIMZUMOTIB-WBAXXEDZSA-N	439.405	1.822	50	20	IDGD	
CN(CC(=O)N1CC2(CCCN2C(=O)[C@@H]2C[C@@H]2C2CC2)C1)NC(=O)NCc1ccccc1	1841273253	SATVXAGWFSJLNM-WOJBJXKFSA-N	439.560	1.582	50	20	IDGD	
C[C@H](Br)C(=O)N1CC2(CCCN2C(=O)/C=C/C(=O)NCc2ccccc2)C1	1841329407	JJKVERAANAPZFH-HVHJFMEUSA-N	434.334	1.846	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2ccnc(C(F)F)c2)C1	1842159441	AYODGMRNICEXMX-UHFFFAOYSA-N	430.415	1.149	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1ccc3c(c1)OCO3)C2	1843416009	NSKVJHUYLYIUTP-ZVHZXABRSA-N	437.456	1.366	50	20	IDGD	
O=C(CCBr)N1CC2(CCCN2C(=O)c2cccc(N3CCOCC3)n2)C1	1843527550	MIEAIBXJAQLCPE-UHFFFAOYSA-N	437.338	1.520	50	20	IDGD	
C[C@@H](C#N)c1cccc(C(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)c1	1844265496	JJRWBJZYMGEQPP-HNNXBMFYSA-N	432.484	1.443	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2ccnc(Cl)n2)C1	1844451207	YSUVSULBJIYAFD-WYMPLXKRSA-N	429.868	1.081	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)C2=C3c4ccccc4C(=O)N3CC2)C1	1844651143	KCGFHPRCEHPMKV-KRWDZBQOSA-N	429.904	1.714	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@]1(C(=O)N2CCCC23CN(C(=O)C(Cl)Cl)C3)CCOC1	1845208980	IHLGXLVPYILJKT-SFHVURJKSA-N	436.336	1.677	50	20	IDGD	
COc1cccc(/C=C/C(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)c1	1846096063	CHRJLIJKMNRPBH-VOTSOKGWSA-N	435.484	1.224	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@H]1CN(Cc3ccccc3)CCO1)C2	1846362443	FCZPYJUPGLEBCD-RBUKOAKNSA-N	435.952	1.345	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H]1ON=C(c2ccccc2)O1	1847499321	WLSHWQNJEHJJDH-VFSPDHHESA-N	436.306	1.954	50	20	IDGD	
CCc1c(Br)c(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](O)CCl)nn1C	1847558517	BDKDCEALVJESAM-SDDRHHMPSA-N	433.734	1.160	50	20	IDGD	
O=C([C@@H](Br)Cc1ccccc1)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl	1847564334	YKQROJIZUWPFNI-VGWMRTNUSA-N	429.742	1.794	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)[C@H]2CCCN(S(=O)(=O)c3ccc(F)cc3)C2)c1	14841835	PRWXNIBXVZTFNL-INIZCTEOSA-N	449.504	1.761	50	20	IDGD	
CCOc1ccc(N2C[C@@H](C(=O)OCC(=O)NNC(=O)c3cccs3)CC2=O)cc1	21166661	DOFKXKSKPKTCOS-ZDUSSCGKSA-N	431.470	1.504	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccccc1Cl)NNC(=O)c1cc(Br)c[nH]1	28717671	BABHKQFBYSJNHO-UHFFFAOYSA-N	449.714	1.560	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)c2cccc(S(=O)(=O)NC[C@H]3CCCO3)c2)c1	104748014	TVXDTJYBGNCBDY-GOSISDBHSA-N	447.513	1.292	50	20	IDGD	
O=C(CNC(=O)[C@H]1c2ccccc2C(=O)N1C1CC1)NNc1nc(-c2cccnc2)no1	728075138	YNHLRPRLZRGZIV-QGZVFWFLSA-N	433.428	1.050	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)[C@@H]2CCCN2C(=O)/C=C\c2ccc(C(N)=O)cc2)cc1	728204288	CGTGWNSVMQOEPO-VPLQDYMCSA-N	449.511	1.358	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)NCc2nccn2C)cc1	728544503	GPFRRRLXZQPGKT-LFIBNONCSA-N	433.472	1.391	50	20	IDGD	
O=C(CCC(=O)N1CCc2sccc2C1)NNC(=O)C1CCN(c2ncccn2)CC1	728846628	QLHISSJOPAWNFW-UHFFFAOYSA-N	442.545	1.267	50	20	IDGD	
N#Cc1ccccc1CSCCNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1	728944189	OIXQIWSZIVCBQH-UHFFFAOYSA-N	439.545	1.828	50	20	IDGD	
CCCCNC(=O)[C@@H]1CCCN(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)C1	728961657	KGZABNMJLANWLN-QGZVFWFLSA-N	431.541	1.062	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)N[C@@H](C)[C@H](C)N2CCOCC2)c1	729624749	ZALBMBKIMZCKGU-RYUDHWBXSA-N	429.315	1.511	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)N2CCC[C@H](CS(N)(=O)=O)C2)c(C)n1C[C@@H]1CCCO1	732093173	SEYOYZIDFLBZJY-NFKQLHPUSA-N	434.562	1.718	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NCCCN2C[C@H](C)O[C@@H](C)C2)cc1Br	732237355	BVIQGNDTRNHPEZ-STQMWFEESA-N	443.342	1.901	50	20	IDGD	
CC(C)OCCCn1c(NNC(=O)c2ccccc2-n2cnnn2)nc2ccccc2c1=O	733265364	CDHDXQYHQOZTEM-UHFFFAOYSA-N	448.487	1.944	50	20	IDGD	
CCOc1ccc(NC(=S)NNC(=O)[C@H]2CC(=O)N(C[C@H]3CCCN3CC)C2)cc1	733358363	UBGAUSGCGNNCBN-DOTOQJQBSA-N	433.578	1.736	50	20	IDGD	
CN(C)CC(=O)NNC(=O)c1ccc2c(=O)n(CCc3ccccc3)c(S)nc2c1	733359727	YPGDMORQTMFSHR-UHFFFAOYSA-N	425.514	1.251	50	20	IDGD	
Cc1nc(CN2CCC(C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)CC2)cs1	734241748	TXXDRARHPYTSEP-UHFFFAOYSA-N	440.570	1.519	50	20	IDGD	
Cc1nc(-c2ccccn2)nc(NNC(=O)CCNS(=O)(=O)c2cn(C)c(C)n2)c1C	734255942	XZZFFKNMLXSACZ-UHFFFAOYSA-N	444.521	1.009	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNS(=O)(=O)c2ccc(OC)c(C(=O)N(C)C)c2)c1	734419222	NLDNVEVRDPSCNS-UHFFFAOYSA-N	437.474	1.038	50	20	IDGD	
Cc1[nH]nc(C(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)c1Br	734825944	RMNLXTGWPJJTFX-UHFFFAOYSA-N	445.318	1.824	50	20	IDGD	
CC(C)c1ccc(C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)c(O)c1	735117992	MAGZBDDYLNYRBW-UHFFFAOYSA-N	433.534	1.604	50	20	IDGD	
CC(=O)N1CCCc2ccc(S(=O)(=O)NNC(=O)[C@H]3COc4ccccc4O3)cc21	736064649	XDPYSYQQOPPRIB-LJQANCHMSA-N	431.470	1.135	50	20	IDGD	
COc1cc(C(=O)NNC(=O)N[C@H]2CCC[C@H](S(C)(=O)=O)C2)cc(OC)c1OC	740902938	SXRWNVOGJUIYSY-STQMWFEESA-N	429.495	1.012	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNS(=O)(=O)c1ccccc1S(N)(=O)=O	741646387	IDCCPIFDDRDKJY-CYBMUJFWSA-N	449.510	1.264	50	20	IDGD	
CNS(=O)(=O)c1ccc2c(c1)N(C(=O)C(=O)NNc1ccc(Cl)cc1Cl)CC2	741733050	DSNZLCZBRJLYBL-UHFFFAOYSA-N	443.312	1.934	50	20	IDGD	
CN(C)[C@@H](CNC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)c1ccsc1	743530082	PAHCVXMFLVBDAA-HNNXBMFYSA-N	425.536	1.790	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)CN2CCC(C(=O)Nc3ccc(Cl)cn3)CC2)cc1	744389113	JZBFTXWTZNMUGZ-UHFFFAOYSA-N	440.891	1.718	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)[C@@H](c2ccccc2)N2CCC(O)CC2)c1	744964471	SNSBAMGENBXOOL-OAQYLSRUSA-N	425.485	1.497	50	20	IDGD	
CC(C)NC(=O)NNC(=O)c1ccc(NC(=O)C[C@@H]2SC(N3CCCC3)=NC2=O)cc1	745139929	XVVFUIMZTOSEEZ-HNNXBMFYSA-N	446.533	1.461	50	20	IDGD	
CC(C)c1nn(C)c(Cl)c1C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	745191280	PVVSFKRRXPPSSP-CYBMUJFWSA-N	436.852	1.341	50	20	IDGD	
C[C@H](C(=O)NNC(=O)c1ccc(Cl)cc1Cl)N1C(=O)[C@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O	746100308	JIWKZWCYHDYYLK-QXVRGBBPSA-N	426.256	1.305	50	20	IDGD	
CCN1CCO[C@@H](C(=O)NNC(=O)c2ccc(CSc3nc(C)cc(C)n3)cc2)C1	746113208	NOUCURSDDQYVEE-GOSISDBHSA-N	429.546	1.867	50	20	IDGD	
COc1cc(C)nc(NNC(=O)c2cccc(NC(=O)CSc3nncn3C)c2)n1	746623274	JOEIZUWDEBQNPE-UHFFFAOYSA-N	428.478	1.410	50	20	IDGD	
COc1cc(C)nc(NNC(=O)CS(=O)(=O)Cc2ccc(Br)cc2)n1	746631229	VUOKFRAZIBTWPI-UHFFFAOYSA-N	429.296	1.614	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)NCc1ccc(CN2CCC(O)CC2)cc1	746758365	IQSCMGSNXXUACL-UHFFFAOYSA-N	436.516	1.364	50	20	IDGD	
COC[C@H](NC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)c1ccco1	746770329	MGUKPMJKPYKTGC-INIZCTEOSA-N	436.490	1.396	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1)N[C@H]1CCS(=O)(=O)C1	747979937	NPEVFDQJSIOECW-PMACEKPBSA-N	442.541	1.131	50	20	IDGD	
O=C(NNC(=O)c1cc(S(=O)(=O)NCc2ccccc2)ccc1O)c1ccccc1	748014862	UODMBHQGIMSQGM-UHFFFAOYSA-N	425.466	1.946	50	20	IDGD	
COc1ccccc1C(=O)N[C@H](CCS(C)(=O)=O)C(=O)NNc1cccc(C#N)c1	748037404	IQWRSFBCNKOUPO-QGZVFWFLSA-N	430.486	1.243	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)(F)F)cc1)c1cccnc1N1CCOCC1	748517974	BWMMHSVUYSCBHG-UHFFFAOYSA-N	430.408	1.969	50	20	IDGD	
CCCc1nc(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)nn1-c1ccccc1Cl	748718113	RRNILNVIQRBTAD-LLVKDONJSA-N	440.913	1.004	50	20	IDGD	
Cc1ncc([N+](=O)[O-])cc1C(=O)NNC(=O)c1ccc(CSc2nncn2C)cc1	750548039	MFIKWZNVKSXEJX-UHFFFAOYSA-N	427.446	1.794	50	20	IDGD	
Cc1sc(=O)n(CC(=O)NNC(=O)CNC(=O)c2ccco2)c1-c1ccc(F)cc1	751200968	DAMVGBKUQOGNJG-UHFFFAOYSA-N	432.433	1.195	50	20	IDGD	
Cc1nn(C)c2ncc(S(=O)(=O)NNC(=O)c3ccc(Br)s3)cc12	751263199	IFUCVWYZPYWYEM-UHFFFAOYSA-N	430.309	1.724	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC(C(=O)NNc3cc(Cl)nc(N)n3)CC2)c(C)c1	753454056	DBGPNGUIYDSKTF-UHFFFAOYSA-N	438.941	1.873	50	20	IDGD	
CCN1CCN(C(=O)c2ccc(NC(=O)NNC(=O)c3ccc(C)cc3O)cc2)CC1	756252679	IVAZKFCAQVHWJI-UHFFFAOYSA-N	425.489	1.945	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(F)c(NC(=O)NNC(=O)COc2ccc(F)cc2)c1	756681401	ATWSPLZKRFCZPX-UHFFFAOYSA-N	428.417	1.447	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)Nc2ccc(NS(C)(=O)=O)c(Cl)c2)c1O	756704508	HKFVLQKUKNGKSC-UHFFFAOYSA-N	428.854	1.892	50	20	IDGD	
CCC(=O)c1cc(C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)ccc1F	756864634	UVKMKVVMJTXDPN-UHFFFAOYSA-N	435.477	1.809	50	20	IDGD	
Cc1cc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)ncn1	757663581	NOFWUEAYMVYSTM-UHFFFAOYSA-N	432.506	1.104	50	20	IDGD	
O=C(CCc1cc(Br)ccc1F)NNC(=O)c1ccc(-n2cnnn2)cc1	758096623	XGDAUMNYERGSGF-UHFFFAOYSA-N	433.241	1.958	50	20	IDGD	
O=C(NNC(=O)C(=O)Nc1ccccn1)N[C@@H]1CCN(c2ccccc2OC(F)F)C1	758793140	MCOQBWDWHDQDDV-GFCCVEGCSA-N	434.403	1.231	50	20	IDGD	
CO[C@@](C)(C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1)c1ccccc1F	760394122	PWKOLCKEMYZDCP-HXUWFJFHSA-N	437.493	1.852	50	20	IDGD	
O=C(NNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])C1=CC=CN2CCS(=O)(=O)N=C12	761622490	PTOUIKNVFJRIMV-UHFFFAOYSA-N	431.352	1.554	50	20	IDGD	
Cc1cc(Cl)c([N+](=O)[O-])cc1S(=O)(=O)NNC(=O)[C@H]1COc2ccccc2O1	761887616	WGMCJADLSTXFOW-CQSZACIVSA-N	427.822	1.706	50	20	IDGD	
CN(NC(=O)c1cccc(C[S@@](C)=O)c1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	763282256	MLPMQAWAITYZEA-SSEXGKCCSA-N	438.550	1.814	50	20	IDGD	
O=C(NNC(=O)c1ccccc1Br)C(=O)Nc1cnn(CC(F)(F)F)c1	763483683	VXGZERMCKMMIQE-UHFFFAOYSA-N	434.172	1.608	50	20	IDGD	
O=C(NNC(=O)c1cccnc1)C(=O)Nc1cc(Cl)ccc1C(=O)N1CCCCC1	763491614	PVGDLRSNEQCHDY-UHFFFAOYSA-N	429.864	1.761	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)C(=O)Nc1ccc(Cl)c(C(=O)NC2CC2)c1	763548067	HTYOEEOXCOLJQO-UHFFFAOYSA-N	444.831	1.361	50	20	IDGD	
CC(C)N(C)c1ccc(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1F	763578782	QBXKNRBAOKKPIQ-GOSISDBHSA-N	430.436	1.596	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(OC[C@@H]3CCCO3)cc2)cc1	763675238	UHJHROASMIILAI-IBGZPJMESA-N	438.440	1.281	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1sc(C)c(C)c1C(=O)OC	763712134	LMGFTYLKLPMNMR-UHFFFAOYSA-N	433.486	1.879	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccc([S@@](=O)C(F)(F)F)cc2)c1	763760255	JEYWEFYVXBUEIL-SSEXGKCCSA-N	442.419	1.780	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccc(Br)cc1F	763838915	BILUQXWNUWMXDM-UHFFFAOYSA-N	428.189	1.892	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)N(C)C)cc2)cc1	763870741	BWIUOQQQLXHSCI-CQSZACIVSA-N	440.456	1.144	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc(Br)nc3)n[nH]2)cc1	764110685	LIFANPSLDOUTKY-UHFFFAOYSA-N	443.261	1.942	50	20	IDGD	
CCN1CCN(c2ccc(Cl)cc2NC(=O)C(=O)NNC(=O)CC(F)(F)F)CC1	764116578	KUURUFAVLHCRAU-UHFFFAOYSA-N	435.834	1.520	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccnn1-c1cccc(Cl)c1	764131509	IADQDIBPYZAOOQ-UHFFFAOYSA-N	427.848	1.863	50	20	IDGD	
Cc1ncsc1C(=O)NNC(=O)C(=O)Nc1cccc(CN2C[C@@H](C)O[C@H](C)C2)c1	764247202	ORVFYSSXGHZYRH-CHWSQXEVSA-N	431.518	1.460	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1cccc(C#Cc2ccccc2)c1	764274683	AUTKTMISVMCYHZ-UHFFFAOYSA-N	429.432	1.957	50	20	IDGD	
Cc1cc(I)ccc1NC(=O)C(=O)NNC(=O)c1c[nH]nc1C	764296659	FIGPSNGPJBUJNQ-UHFFFAOYSA-N	427.202	1.031	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)C(=O)Nc1ccc([S@@](=O)C(F)(F)F)cc1	764313821	MZHMYKDGNQAEJC-GDLZYMKVSA-N	431.367	1.782	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccccc2F)cc1C	764320000	VYSLCYWCAKHWLW-UHFFFAOYSA-N	436.465	1.224	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)C(=O)Nc1ccc(OCCC(=O)NC)cc1)c1ccccc1	764329370	XJJSFXHRSIWAJF-GOSISDBHSA-N	426.473	1.481	50	20	IDGD	
CCOC(=O)c1c(C)csc1NC(=O)C(=O)NNC(=O)c1ccc(O)c(Cl)c1	764349451	OZKGEFKYRKLQMP-UHFFFAOYSA-N	425.850	1.992	50	20	IDGD	
Cc1cnn(-c2ccc(NC(=O)C(=O)NNC(=O)c3cnn(-c4ccccc4)c3)cc2F)c1	764351221	PNEICQJUGZKVEN-UHFFFAOYSA-N	447.430	1.905	50	20	IDGD	
CO[C@@H]1Cc2ccc(NC(=O)C(=O)NNC(=O)c3cc(-c4cccs4)[nH]n3)cc2C1	764377195	LIMLURPESYMDKF-CQSZACIVSA-N	425.470	1.652	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)C(=O)Nc1ccc(CC(=O)N(C)C)cc1	764393479	ORQSBSZDHIOPLV-UHFFFAOYSA-N	444.513	1.204	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)[C@@H](C)S(=O)(=O)C2CCOCC2)c1	764519708	BLXGLMHXEABGEX-OAHLLOKOSA-N	426.535	1.627	50	20	IDGD	
C[C@H](CC(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1)C1CCN(C(=O)OC(C)(C)C)CC1	765071249	SBQLDRJAYAUFRK-UKRRQHHQSA-N	446.570	1.177	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)[C@H](C)NS(=O)(=O)c2cccc(C#N)c2)o1	765097400	FOWQHTKKQAVWHX-AWEZNQCLSA-N	447.517	1.121	50	20	IDGD	
CCOC(=O)NNC(=O)C(=O)Nc1ccccc1N1CCN(CCc2ccncc2)CC1	765394758	BTUZWIGZDYSODY-UHFFFAOYSA-N	440.504	1.162	50	20	IDGD	
COc1cc(-n2cnnn2)c(Cl)cc1C(=O)NNC(=O)c1cc(-c2cccs2)[nH]n1	765565011	JPURRFQKAGXQJZ-UHFFFAOYSA-N	444.864	1.851	50	20	IDGD	
CC(=O)NCc1ccc(C(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)cc1	765750106	ZSUQLMIIHOCGKV-UHFFFAOYSA-N	437.544	1.210	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)c1ccc(-n2ncc3ccccc32)cc1Cl	766373681	IQSJFLHWPCCHHZ-ZDUSSCGKSA-N	432.889	1.875	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)c1ccc(N2CCCS2(=O)=O)cc1	767265157	ODNBWWVBPIYTQY-UHFFFAOYSA-N	445.497	1.082	50	20	IDGD	
CC(C)C[C@H](NC(=O)OCc1ccccc1)C(=O)NNC(=O)C(=O)Nc1ccccn1	767349979	AZTCVDQEZGNPRL-INIZCTEOSA-N	427.461	1.509	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)Cc3cnn(-c4ccccc4)n3)n[nH]2)cc1OC	768278765	KBBHGHHTOZIZHA-UHFFFAOYSA-N	447.455	1.678	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(OC)c(C(=O)NNC(=S)Nc2ccccn2)c1	768577392	BXNIFHMGOUYFDP-UHFFFAOYSA-N	437.547	1.752	50	20	IDGD	
CC(C)c1[nH]nc(C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)c1Br	768627149	WZSGPNMAMRGHHQ-UHFFFAOYSA-N	434.250	1.785	50	20	IDGD	
Cc1cc(Br)ccc1S(=O)(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	769860817	XWHKEVSTJIBLBL-UHFFFAOYSA-N	437.279	1.357	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)COc1ccc(OCc2ccccc2)cc1)[C@H]1CN(C)CCO1	770435310	MLEUOVZUWWGRAC-LAUBAEHRSA-N	442.516	1.694	50	20	IDGD	
Cc1ccncc1[C@H](C)NC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	771444803	ZPUMULCPHMTMCK-HNNXBMFYSA-N	433.538	1.108	50	20	IDGD	
CC(=O)Nc1ccc(NS(C)(=O)=O)c(C(=O)NNc2ccnc(Br)c2)c1	771557540	YYIVLNXQPSRWHD-UHFFFAOYSA-N	442.295	1.931	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1cnc(C2CCCC2)nc1N	772675976	RTVJGERDTNSYQQ-UHFFFAOYSA-N	447.879	1.996	50	20	IDGD	
O=C(NNC(=O)c1c[nH]c2ccccc12)C(=O)Nc1ccc(I)cn1	773513853	ZCTRNACFMNZKFS-UHFFFAOYSA-N	449.208	1.567	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2cccc3cncc(Br)c23)n1	773530983	WTQRWPAABGKCGH-UHFFFAOYSA-N	445.277	1.597	50	20	IDGD	
CCNC(=O)COc1cccc(NC(=O)C(=O)NNc2ccc(C(F)(F)F)cn2)c1	773679904	LBKIBJJZRFUKCD-UHFFFAOYSA-N	425.367	1.697	50	20	IDGD	
CCN1CCN(C(=O)c2ccc(NC(=O)C(=O)NNc3cnc4ccccc4n3)cc2)CC1	773723150	YTYYGVVRUCTVJS-UHFFFAOYSA-N	447.499	1.489	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)NCCOc1ccc(NS(C)(=O)=O)cc1)c1ccccc1	773778112	CZRHHGSCMYARRD-GOSISDBHSA-N	434.518	1.961	50	20	IDGD	
O=C(NNC(=O)c1cc2c(s1)CCCCC2)N[C@@H]1CCO[C@@]2(CCS(=O)(=O)C2)C1	776076512	MDYXZRDTYXYLPV-KUHUBIRLSA-N	441.575	1.697	50	20	IDGD	
CN(NC(=O)Cn1cnc(-c2ccccc2)n1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776211110	DAESPHFERPCSGB-UHFFFAOYSA-N	443.508	1.581	50	20	IDGD	
CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)NNc1cccc(S(C)(=O)=O)c1	776541197	JSBBWMGTDGMCHO-LJQANCHMSA-N	432.477	1.901	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(OCC(=O)NNc2cccc(S(C)(=O)=O)c2)CC1	777174890	HNFBXMVPBDOVMF-UHFFFAOYSA-N	427.523	1.949	50	20	IDGD	
COc1cc(OC)cc(N2CC[C@H](N(C)CC(=O)NNC(=O)c3cccc(C)c3)C2=O)c1	777615827	IFXOQFLLTHIIIT-FQEVSTJZSA-N	440.500	1.511	50	20	IDGD	
COC[C@@H](C)n1c(C)cc(/C=C(\C#N)C(=O)NNC(=O)CNC(=O)OC(C)(C)C)c1C	778437213	ZETLZQUXTPWBIB-IREQLNLFSA-N	433.509	1.891	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)c1cccc(S(=O)(=O)NC2CCCC2)c1	778437865	MPAGJPAFLKDPRT-UHFFFAOYSA-N	440.522	1.193	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)N[C@H]1CCCOc2c(F)cccc21	778589412	QXFQFTXYNGIQSJ-AWEZNQCLSA-N	435.481	1.977	50	20	IDGD	
CC(C)(C)[C@@H]1CCc2sc(C(=O)NNC(=O)NCC3CN(S(C)(=O)=O)C3)cc2C1	779696143	CPWWBXOVHMUDKW-CQSZACIVSA-N	442.607	1.735	50	20	IDGD	
COC(=O)CNC(=O)NNS(=O)(=O)c1csc(-c2ccc(Br)cc2)n1	779844955	MMTOCNIWSTVZFH-UHFFFAOYSA-N	449.308	1.238	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1noc2c1CCCCC2	780925114	BEKXDIBBOAQVLU-UHFFFAOYSA-N	425.489	1.163	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cc(NC(C)=O)ccc2C)cc1OC	781429622	XOCOGYFXMIJKSV-UHFFFAOYSA-N	429.429	1.589	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)cc1-n1cnnn1	781930646	PWSIMPWFNDBGFH-UHFFFAOYSA-N	448.443	1.037	50	20	IDGD	
CCOc1cc(N2CCOC(C)(C)C2)ccc1NC(=O)NNC(=O)[C@H](C)OCCOC	782105767	IYFQSMPAZUZIGW-HNNXBMFYSA-N	438.525	1.905	50	20	IDGD	
COc1ccccc1[C@@](N)(C(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)C(F)(F)F	782163242	ZCPYBMSJRJZCRF-LJQANCHMSA-N	449.389	1.120	50	20	IDGD	
N#Cc1ccc(Cn2cnc(NC(=O)C(=O)NNc3ncccc3C(F)(F)F)n2)cc1	783125623	MHMBSGNGEZZFFW-UHFFFAOYSA-N	430.350	1.694	50	20	IDGD	
CCn1cc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)ccc1=O	783409434	UMGJLFAIHYBYOI-UHFFFAOYSA-N	432.380	1.244	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)CCn3c(C)cc(O)cc3=O)n[nH]2)cc1OC	783687203	RKSYFHLPJKBZMR-UHFFFAOYSA-N	441.444	1.121	50	20	IDGD	
CCCn1ccc2cc(NC(=O)C(=O)NNC(=O)CNC(=O)c3cccs3)ccc21	784004404	FUHFIYMKEPCPBG-UHFFFAOYSA-N	427.486	1.629	50	20	IDGD	
COc1ccc(I)c(NC(=O)C(=O)NNc2nccnc2Cl)c1	784780814	OGOPNZOGERELHH-UHFFFAOYSA-N	447.620	1.825	50	20	IDGD	
COc1ccc(Cn2ncc(C)c2NC(=O)C(=O)NNc2ccnc(F)c2)cc1OC	784847166	PNIPWEANRSRUDJ-UHFFFAOYSA-N	428.424	1.873	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)cc1OCC(F)F	785060852	PMEZUYDQBQJEOJ-UHFFFAOYSA-N	431.399	1.615	50	20	IDGD	
CCOC(=O)c1cc(CC)sc1NC(=O)C(=O)NNC(=O)Cc1cn2ccccc2n1	785061543	XKUUEOCTTVJKTG-UHFFFAOYSA-N	443.485	1.464	50	20	IDGD	
O=C(NNc1c(F)cc(C(=O)NC2CC2)cc1F)C(=O)Nc1ccc2nccnc2c1	785099632	JEWHUMRTGGQGHD-UHFFFAOYSA-N	426.383	1.882	50	20	IDGD	
O=C(NNC(=O)C(=O)Nc1ccccn1)N[C@H]1CCN(c2cccc(Br)c2)C1	787371351	VTVBIIMRAVHTBN-ZDUSSCGKSA-N	447.293	1.392	50	20	IDGD	
Cc1cc(-n2cccn2)ccc1NC(=O)C(=O)NNC(=O)C(F)(F)Oc1ccccc1	789585799	FVYQHTJFUOGDPY-UHFFFAOYSA-N	429.383	1.938	50	20	IDGD	
Cc1c(C(=O)NNc2nc3ccccn3n2)cc(Br)cc1S(N)(=O)=O	791242444	GOCASYIBFPIRPT-UHFFFAOYSA-N	425.268	1.205	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(N(C)C)c(NC(=O)NNc2nc3ccccn3n2)c1	792206550	MXOWTNSYUKLVPG-UHFFFAOYSA-N	446.537	1.974	50	20	IDGD	
O=C(CCc1cnc2ccccc2c1)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	792236747	BYNGUKSBQSKIJJ-UHFFFAOYSA-N	445.523	1.773	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2cnc(C(F)(F)F)cc2OC)cc1	792266568	AJNVIMOBHSEKKB-UHFFFAOYSA-N	440.378	1.836	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)N([C@H]2CCS(=O)(=O)C2)N(C)C)N(C)c2ccccc21	792855333	REXBISVNRWJRKC-HNNXBMFYSA-N	445.545	1.149	50	20	IDGD	
Cn1ccc2ccc(NC(=O)C(=O)NNC(=O)c3cc(-c4ccc(F)cc4)[nH]n3)cc2c1=O	793025816	OTDDSKCQJMTAEL-UHFFFAOYSA-N	448.414	1.467	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)Cn2c(C)nc3cc(F)c(F)cc32)n1	796014804	QNHNADBACPTNPA-UHFFFAOYSA-N	437.428	1.321	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)C(=O)Nc1ccc(F)c(N2CCOC2=O)c1	796992720	WQHBFZGIQNAWJE-UHFFFAOYSA-N	434.355	1.086	50	20	IDGD	
COc1cc2c(cc1S(=O)(=O)NNC(=O)c1ccc3ccccc3c1)OCC(=O)N2	797429019	IDFXFDFXDGTWSV-UHFFFAOYSA-N	427.438	1.803	50	20	IDGD	
CC(=O)N[C@@](C)(C(=O)NNc1nc(-c2ccccc2)no1)c1ccc(S(C)(=O)=O)cc1	797725871	UKDZCMQDYBRXCU-HXUWFJFHSA-N	443.485	1.635	50	20	IDGD	
CCn1cc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c(C(F)(F)F)n1	797935429	HWYYOKDQMBCJFC-ZDUSSCGKSA-N	442.350	1.066	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2CSCN2C(=O)c2ccccc2)cc1C	798308935	DSSVQGGRYRUDOX-KRWDZBQOSA-N	426.498	1.605	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2c[nH]ccc2=NC(=O)OC(C)(C)C)cc1C	798309367	LRCPNGHSKJCEDH-UHFFFAOYSA-N	427.461	1.867	50	20	IDGD	
CCn1ncc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2OC)c1C(F)(F)F	799258440	CYEBVZUNFPNZBR-UHFFFAOYSA-N	433.774	1.984	50	20	IDGD	
CC(C)(C)CC(=O)NNC(=O)C(=O)Nc1cnc(N2CCOCC2)c(Br)c1	799259428	WRBMEJVRZDDULX-UHFFFAOYSA-N	442.314	1.203	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)[C@@H](C)NC(=O)CCc2ccccc2)c2ccccc2c1=O	799295870	AWIXXQBTFLWWJU-MRXNPFEDSA-N	449.511	1.705	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)NCC2([S@](C)=O)CC2)c2ccccc2c1=O	799716199	NEGNBATUBBMTPN-PMERELPUSA-N	433.534	1.442	50	20	IDGD	
CN(CC(=O)NNc1cc([N+](=O)[O-])ccc1Br)S(=O)(=O)c1cccnc1	800615918	ABVBWCXKUWVGRK-UHFFFAOYSA-N	444.267	1.516	50	20	IDGD	
O=C(NNC(=O)c1ccc(S(=O)(=O)N2CCOCC2)o1)Nc1ccc(Cl)cc1	802015338	JQWBWGAUVFMKPD-UHFFFAOYSA-N	428.854	1.420	50	20	IDGD	
CN(C[C@@H]1CCCN(C(=O)NNC(=O)c2cccc(Br)c2)C1)S(C)(=O)=O	805159405	GHMYAKIALMXKKF-LBPRGKRZSA-N	447.355	1.407	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1nc(C2CCOCC2)cs1	806973219	FINNWFBZEMJDBO-UHFFFAOYSA-N	434.474	1.211	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)c1cccc(NN2C(=O)[C@H]3CC=CC[C@@H]3C2=O)c1	807370622	OUTCLXFQDGWPAH-IRXDYDNUSA-N	444.488	1.515	50	20	IDGD	
CCn1cc(CNC(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)cn1	807518114	PJVDMOQHTSOEKZ-UHFFFAOYSA-N	445.487	1.749	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)NCc3ccccc3S(N)(=O)=O)n[nH]2)cc1	807605485	NSEYFVIIBSUTHL-UHFFFAOYSA-N	428.474	1.177	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)Nc1nc(Sc2ccc(OC)cc2)ns1	809922717	HBQPMOWOOLWOQS-SNVBAGLBSA-N	427.508	1.902	50	20	IDGD	
COC[C@@]1(C(=O)NNC(=O)COc2ccc(C#N)cc2)CCN(C(=O)OC(C)(C)C)C1	811870129	BWSLARMCSLNCCJ-OAQYLSRUSA-N	432.477	1.358	50	20	IDGD	
CCCc1nnc(SCC(=O)NNC(=O)c2sc(-c3ccccc3)nc2C)n1N	813367678	HYVYJNMMXFLAJX-UHFFFAOYSA-N	431.547	1.930	50	20	IDGD	
Cn1c(Cl)nc(Cl)c1C=NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	814688875	OAXLYECIBAKLOK-UHFFFAOYSA-N	446.316	1.512	50	20	IDGD	
Cc1cc(C#N)cnc1C(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	814718380	UNGLPEDOLSVSKZ-UHFFFAOYSA-N	449.492	1.815	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)C1CCC(OC[C@@H]2CCCO2)CC1	815408388	HAYVVIVIPSOTLK-KVZIAJEVSA-N	431.537	1.595	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1ccc2c(c1)C(=O)CCC2	815751501	BWINFIDLFBGZHT-UHFFFAOYSA-N	430.486	1.538	50	20	IDGD	
CC(=O)N(C)c1ccccc1NC(=O)C(=O)NNc1ccccc1S(=O)(=O)N(C)C	815751652	IMWRUUFSWPILQH-UHFFFAOYSA-N	433.490	1.001	50	20	IDGD	
COc1ccc(NC(=O)c2ccc(NC(=O)C(=O)NNC(=O)[C@H]3CCCO3)cc2)cc1	815778098	BPNHFIVZCGUIHH-QGZVFWFLSA-N	426.429	1.212	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)[C@H]2CCCS(=O)(=O)C2)cc(OCC)c1OCC	816814294	NEAHAIYUOSZQDJ-ZDUSSCGKSA-N	428.507	1.469	50	20	IDGD	
Cc1c(C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cnn1-c1ccccc1F	844536247	WYVHATWWCYDZLH-UHFFFAOYSA-N	441.375	1.846	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)O[C@@H](C)C(=O)Nc2ncnc3[nH]cnc23)c1C	897563608	XKHNNQAKUYVWJH-XTIFCCNPSA-N	437.460	1.895	50	20	IDGD	
COC(=O)NNC(=O)[C@H](CCSC)NS(=O)(=O)c1cc(Cl)ccc1Cl	913176908	MADVVAKGUOVNFV-JTQLQIEISA-N	430.335	1.781	50	20	IDGD	
COc1cccc2cc(C(=O)OCC(=O)NNC(=O)[C@H]3COc4ccccc4O3)oc12	915243298	ITXHKGNOOVJNLB-QGZVFWFLSA-N	426.381	1.586	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2ccc3c(c2)CCCC(=O)N3)cc1OC	915435632	HKTXCDMFZYKPEO-UHFFFAOYSA-N	441.440	1.597	50	20	IDGD	
O=C(COc1ccccc1Cc1ccccc1)NNC(=O)NCCCN1CCOCC1	915880595	QKBDSVMSIGVTMI-UHFFFAOYSA-N	426.517	1.709	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)NCC3(NS(C)(=O)=O)CCCCC3)n[nH]2)cc1	916252092	CXMMHGLOEXPMDS-UHFFFAOYSA-N	448.549	1.581	50	20	IDGD	
Cc1ccccc1CN1CCC(NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)CC1	916382003	FSVNQWVFHOWIEU-UHFFFAOYSA-N	448.527	1.851	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NCc1ccc(CN2CCN(C)CC2)cc1	916388115	UZPORKPGUUODFA-KRWDZBQOSA-N	443.523	1.871	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)CCC(=O)N2CC(=O)Nc3ccccc32)cc1	916529280	DSHSFQLQTSJSGO-UHFFFAOYSA-N	438.440	1.065	50	20	IDGD	
CC(=O)Nc1ccc(S[C@@H](C)C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1	917387894	PVHHVMWFMZWTTI-LBPRGKRZSA-N	439.497	1.834	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)c3cnns3)c2)cc1	917392210	TZBMYSLPTRJMIW-UHFFFAOYSA-N	433.471	1.422	50	20	IDGD	
O=C(CCN1CCN(C(c2ccccc2)c2ccccc2)CC1)NNC(=O)c1cnn[nH]1	918277935	MLBRWRRVTFOMHN-UHFFFAOYSA-N	433.516	1.363	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNS(=O)(=O)c1ccc([C@@H](C)NC(C)=O)s1	918399091	JYKWAOXCYALABZ-GFCCVEGCSA-N	441.531	1.732	50	20	IDGD	
Cn1cnnc1SCc1ccc(C(=O)NNC(=O)c2ccc(C(N)=S)cc2)cc1	918678721	ODTGVXHIYJUBLT-UHFFFAOYSA-N	426.527	1.816	50	20	IDGD	
CCOC(=O)NCC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	919743436	IGLDFJDMPWLIPT-UHFFFAOYSA-N	426.476	1.056	50	20	IDGD	
O=C(Cc1csc(-c2ccccc2Cl)n1)NNC(=O)N[C@@H]1CCS(=O)(=O)C1	919886354	VTDPOWVDRLDBNO-SNVBAGLBSA-N	428.923	1.524	50	20	IDGD	
O=C(Cn1cnc2ccccc21)NNC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccccc1	920438036	JEWKDUDSIAETAX-LJQANCHMSA-N	441.513	1.427	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@@H]12	921303946	HGMMZPVKQVHNAS-DUVNUKRYSA-N	426.926	1.835	50	20	IDGD	
CC(=NNC(=O)CCN1CCC(C)CC1)c1ccc(OCC(=O)N2CCOCC2)cc1	1317712854	UGQNILCMZJSMEK-UHFFFAOYSA-N	430.549	1.886	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)NCCN2C(=O)COc3ccccc32)c1C	1320545180	KZQZUOBAMPAEFH-MRXNPFEDSA-N	426.473	1.827	50	20	IDGD	
O=C(CCO)NNC(=O)Nc1ccc(Br)c(I)c1	1323986314	RLTYYHQYRBWAGP-UHFFFAOYSA-N	428.024	1.589	50	20	IDGD	
O=C(NNC(=O)c1ccn(-c2ccccc2C(F)(F)F)n1)c1ccc(-n2cnnn2)cc1	1325317226	UVUSBSFHPGSYCI-UHFFFAOYSA-N	442.361	1.942	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)NCCCN2C(=O)NC(C)(C)C2=O)cc1OC	1343742953	IFYYDCTUBKGJTJ-UHFFFAOYSA-N	435.481	1.149	50	20	IDGD	
C[C@@H](Cn1cncn1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Br)C2	1779500501	OWICPJFKTYGXNW-QDEZUTFSSA-N	446.321	1.119	50	20	IDGD	
CCc1cc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](Br)CC)CCO3)nn1C	1779832182	CDAQERBSEMCSDM-KSSFIOAISA-N	427.343	1.600	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(OC)cc(OC)c3F)C2)C1	1780132513	JDQDEAXFWBVXTR-FOIQADDNSA-N	444.887	1.540	50	20	IDGD	
Cc1c(Br)c(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](F)Cl)CCO3)nn1C	1780367407	WZBRHECQZKEDOI-DOMZBBRYSA-N	437.697	1.469	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)CCC(=O)N3CCCC3)CCO2)C1	1781224715	NJHNOUHLMSGQJE-OALUTQOASA-N	434.364	1.455	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(O)c([N+](=O)[O-])c3)C2)C1	1781539979	FRAGCOWOWQPNHM-ROUUACIJSA-N	446.287	1.980	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3c(O)cc(O)cc3O)C2)C1	1781810078	XPUHEEIHYOVOQB-ZMZPIMSZSA-N	443.294	1.278	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1sccc1F)C2	1782209413	NPNZQQRKMDVCMG-FOIQADDNSA-N	440.541	1.388	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccn3c(O)nnc13)C2)C(Cl)Cl	1782217630	RCQHYDHDFCFRGP-KZULUSFZSA-N	442.303	1.366	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4nn[nH]c4c3)C2)C1	1782581496	PWVUYQQLMYPOTN-KPZWWZAWSA-N	436.310	1.432	50	20	IDGD	
CC(C)c1nc(CC(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](C)Br)C3)C2)no1	1783529333	IMBITAWWOSYFRK-SJKOYZFVSA-N	429.315	1.349	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(Br)cn3)CCO2)C1	1783877948	SFLRYYCTNHKBRF-CXAGYDPISA-N	446.729	1.541	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccnc(Cl)n3)C[C@@H]21	1783970590	XBRIGEVLTJCJIL-UHXUPSOCSA-N	445.745	1.754	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)CCCn3ccnc3)C2)C1	1784397673	VLNNNKSXBBFPIS-MAUKXSAKSA-N	427.343	1.524	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(F)(F)C(F)F)[C@H]2C1	1784886911	DDGJZTWKQVQUPZ-RCWTZXSCSA-N	433.240	1.898	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cn3nnc4ccccc43)[C@H]2C1	1784896223	QZLYROJHPYFBMT-GGXPGOJBSA-N	433.940	1.819	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC1(c2ccc(NC(=O)[C@@H](O)c3ccco3)cc2)CCC1	1785857221	UKUOLMHSSSEJEF-IBGZPJMESA-N	449.467	1.759	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4nncn4c3)[C@H]2C1	1788376294	HFCYRQWIOTXADX-MXAVVETBSA-N	436.310	1.106	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1ccc(C2(NC(=O)C3CN(C)C3)CCC2)cc1	1788649029	RYXKGIIFRGFNGH-JFLMPSFJSA-N	436.516	1.816	50	20	IDGD	
CCCC(=O)N[C@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]21	1788742389	GPGXUKSLPGJNIX-FACIQBDNSA-N	436.380	1.507	50	20	IDGD	
Cn1cnc(C(=O)NC2(c3ccc(NC(=O)c4cnccc4C(=O)NN)cc3)CCC2)c1	1789521098	GDLZJASGFLXNJI-UHFFFAOYSA-N	433.472	1.480	50	20	IDGD	
Cc1cc(C(=O)NCC(=O)Nc2ccc(C3(NC(=O)[C@@H](O)CCl)CCC3)cc2)no1	1789567919	QBBGGGSXRGVNOT-INIZCTEOSA-N	434.880	1.447	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=N/N3CCCCC3)C[C@@H]21	1789870807	XKXBMHJAUJNAIO-FQHAXPTKSA-N	433.380	1.674	50	20	IDGD	
C=C(CC(=O)OCC)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]21	1789892381	WKFXTELZDILBDP-XMDUPGNXSA-N	435.348	1.712	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(O)ccc3O)[C@H]2C1	1790264033	DARPDLXLKBXFQJ-HJXMPXNTSA-N	441.322	1.722	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(F)cn3)C[C@@H]21	1790961566	PRQQXSGRTCWUHM-ZIEJDFEHSA-N	428.302	1.988	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)Oc3cccnc3)C[C@@H]21	1791065490	YJZOWYSVPDXCQD-JBJRXJHCSA-N	440.338	1.612	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc(F)cc3OC)C[C@@H]21	1791258645	XQUKEFXAJDHZMT-XPYUAMARSA-N	442.915	1.610	50	20	IDGD	
Cc1nccn1[C@@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)CBr)C[C@@H]21	1791700693	MQQLMCPAHWPWOP-PTTAZLHSSA-N	441.370	1.763	50	20	IDGD	
CN1CCN(c2ccc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@H](F)Cl)C4)cc2)CC1	1792457114	ZEFWYXCNWSYVGN-NBMJBFSESA-N	438.931	1.176	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(C)(C)OC(=O)NC(C)C)C2	1793451577	CUBDRCOLCCORKS-FZKCQIBNSA-N	431.961	1.897	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)C1CCC(C(F)(F)F)CC1	1793681389	KQGINKDFVKYPQM-WWEJYDQOSA-N	426.863	1.544	50	20	IDGD	
COc1cncc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)Br)C3)c1	1794054140	QLENILPUILBLTG-FRQROOTJSA-N	440.338	1.396	50	20	IDGD	
COc1cncc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)Br)C3)c1	1794054141	QLENILPUILBLTG-LJGDNWOOSA-N	440.338	1.396	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1n[nH]c(C2CC2)c1F	1794481911	VQJXSDLHKFLPDY-ZSMOCIRGSA-N	433.311	1.866	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)Nc1cccnc1	1795603008	UPMJIAPPRSBKQQ-LBKYZSNHSA-N	439.354	1.503	50	20	IDGD	
CC(C)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCN1Cc2ccccc2C1=O	1797182467	LCPQHVSDMRBPCE-XEMDLRDOSA-N	447.963	1.887	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C=N/O[C@H]1CCCCO1	1797815258	LXDPIBNXXGHCJR-AAFDZJLISA-N	436.336	1.341	50	20	IDGD	
C[C@@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)CBr)C2)n1ccccc1=O	1797930797	BGUMUAOIFONUDC-JGFGOLAASA-N	440.338	1.030	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2c(s1)CCCC2)c1ccc(B(O)O)cc1	1798038450	SOCMDOWGQBKYGU-REPLKXPHSA-N	438.358	1.872	50	20	IDGD	
CCc1cnc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)s1	1798632986	RJGBRQSBEPCDLB-CLLJXQQHSA-N	428.518	1.270	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccn(C(F)F)n1	1798841396	KBXJODNQSDYFIE-MGGJZVGQSA-N	447.446	1.664	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(N3CCN(C)CC3)cc1)C2	1799264345	FHDLUGWGQMZQLH-KOUHRCEDSA-N	448.995	1.659	50	20	IDGD	
COc1cncc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@](C)(Cl)CCl)c1	1799273573	BQNCRAKHTKEYEW-ZDUSMZPESA-N	444.359	1.849	50	20	IDGD	
CC(C)(CCl)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)N2CCOCC2)[C@@H]1c1cccnc1	1802901527	SVOZJNYRQCCKJE-RCCFBDPRSA-N	438.956	1.003	50	20	IDGD	
C[C@@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C(C#N)=C/c1ccc(F)cc1F)C2)n1cnnn1	1803095263	ARWDSXUTEIDGGE-SFMYWWGTSA-N	441.442	1.758	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2cncs2)[C@H]1c1cccnc1	1805977193	PSXNDKVNMZDYKE-DNVCBOLYSA-N	430.534	1.231	50	20	IDGD	
Cn1ccc(=O)cc1C(=O)N1CC[C@H](CNC(=O)CCBr)[C@@H]1c1cccnc1	1806343242	OKLXZXXKZACUEL-BEFAXECRSA-N	447.333	1.885	50	20	IDGD	
C[C@H]1CC[C@H](C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)CC1	1807367862	NMJFCUCDKUNIHQ-RAKJYXHLSA-N	449.360	1.907	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC2(CCCN(C(=O)c3cscn3)C2)CC1	1808451611	HXSFCBVFKSDKNC-UHFFFAOYSA-N	428.518	1.300	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@@H](CNC(=O)COCCO)[C@H]1c1cccnc1	1808601239	IVUGZBBBROMGEL-UKPHBRMFSA-N	428.327	1.127	50	20	IDGD	
O=C(CCc1ccsc1)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1	1809966582	GXPIGQGZDJNJIC-UHFFFAOYSA-N	440.374	1.906	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)[C@@H]3[C@H]4C=CS[C@H]43)CC2)C1	1809980626	YMDAWMHKOJBOKW-GUDVDZBRSA-N	426.347	1.086	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2cccn(C)c2=O)[C@@H]1c1cccnc1	1813028952	ZBRAELSAUAZSFM-RYQLBKOJSA-N	432.908	1.354	50	20	IDGD	
Cc1onc(C(=O)N2CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)c1C	1813067804	DSHQQDJASNVPNM-UWJYYQICSA-N	442.520	1.379	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2ccns2)[C@H]1c1cccnc1	1813071836	YHIGMUWXGMDXCY-KXBFYZLASA-N	430.534	1.231	50	20	IDGD	
C[C@H](C(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1)n1cccc1	1813315859	QDCOOFXGOWPAPL-JUXOCIIHSA-N	440.548	1.523	50	20	IDGD	
CCS(=O)(=O)CC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](C)CBr)n[nH]1	1814778390	GOSHXJSBPAQXFU-DGCLKSJQSA-N	449.371	1.868	50	20	IDGD	
CSCC(C)(C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1815265698	RYLWNFBXNYDMSG-QGZVFWFLSA-N	444.366	1.785	50	20	IDGD	
O=C(CCN1C(=O)C=CC1=O)Nc1cc([C@@H]2CCCCN2C(=O)C(Cl)Cl)[nH]n1	1815476339	KDDPQRJLAFKJKZ-NSHDSACASA-N	428.276	1.521	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccccc2O)[nH]n1)c1ccc(B(O)O)cc1	1817470797	HJSBGUOMBUITOT-SFHVURJKSA-N	434.261	1.415	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2CCCSC2)[nH]n1)c1ccc(B(O)O)cc1	1817475058	KHMCWJDSBCQUSI-QAPCUYQASA-N	442.350	1.539	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](C)Nc3cnccn3)sc2C1	1819837116	RCMNFWXBLRQTBR-UTUOFQBUSA-N	438.941	1.600	50	20	IDGD	
CC[C@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN2CCN(C(C)=O)CC2)[nH]n1	1820855627	ZDVKXVFIANBHDK-RDJZCZTQSA-N	438.960	1.583	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)Cn2ccncc2=O)[nH]n1	1820868572	JOZSRCJEGLPZRN-UGSOOPFHSA-N	441.319	1.895	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](F)Br)CC2)c1cc[n+]([O-])cc1	1821053566	UBQVKIYOFZIMHH-CABZTGNLSA-N	429.271	1.693	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(=O)nc4cccnn34)sc2C1	1821268426	PRKPRXJXRIVLHV-MNOVXSKESA-N	446.920	1.789	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H]2CNC(=O)C2)n[nH]1	1821955898	XKNGXYIESWVBPN-NQBHXWOUSA-N	426.315	1.569	50	20	IDGD	
CC(C)n1ccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)n1	1822414387	DFZCMTPZAWBARU-QGZVFWFLSA-N	444.540	1.866	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)CC[C@H]2CCOC2)n[nH]1	1823035387	PXSYLWBPJYQTNH-RDJZCZTQSA-N	434.541	1.592	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](O)Cc3ccccc3)sc2C1	1825440406	ZJGHYKWASNBBTO-DZKIICNBSA-N	437.949	1.913	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(=O)n3[nH]cnc3n2)CC1	1827047021	NQNBDBZYLUXZBE-INIZCTEOSA-N	448.955	1.916	50	20	IDGD	
CC(=O)OC[C@H](OC(C)=O)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H](F)Cl)CC1	1827609617	VTLPSJHCYHYONZ-ULQDDVLXSA-N	434.892	1.635	50	20	IDGD	
CCSc1ncccc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1829578056	CUTGLVKWPXKVHY-RDTXWAMCSA-N	431.917	1.798	50	20	IDGD	
O=C(Cc1cccc([N+](=O)[O-])c1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1829622358	UGRSPKASNJMKKM-WMZOPIPTSA-N	429.832	1.128	50	20	IDGD	
C[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1)C1(O)CCC1	1829743464	JVFUFIPZRDQLGQ-ZTFGCOKTSA-N	437.364	1.230	50	20	IDGD	
O=C(Cc1ccc(Cl)s1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1830726842	UGXPRLASZJDXBP-SUMWQHHRSA-N	437.345	1.000	50	20	IDGD	
COc1ccc([C@@H]2C[C@@H]2C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)cc1	1831302636	VRYWLCLUORKJCO-NTLWEQJWSA-N	440.899	1.790	50	20	IDGD	
O=C(C(Cl)Cl)N1CCOC[C@]2(C1)CN(C(=O)C13CC(C(F)(F)F)(C1)C3)CCO2	1831704868	JSZRPMYWROXGDM-GPANFISMSA-N	445.265	1.979	50	20	IDGD	
O=C(/C=C/c1ccoc1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1832651891	ZQDLPUIIMTWSKP-CYJXPKQYSA-N	431.258	1.440	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cc(OC)n(C)n3)CC2)CC1	1836203716	LRZSWYVDCLTKIE-MRXNPFEDSA-N	425.961	1.631	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)c3nc4ncccn4n3)CC2)CC1	1836394252	PCJKTEOUKSQQBR-MRXNPFEDSA-N	433.944	1.327	50	20	IDGD	
CC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)C3=NN(C)C(=O)CC3)CC2)CC1	1836394997	NAGPKMYLYIQGBR-INIZCTEOSA-N	425.961	1.184	50	20	IDGD	
CN1CCCC[C@H]1C(=O)N1CCC(N2CCC(NC(=O)[C@H](F)Br)CC2)CC1	1836413586	KKRNEQMXXUXYPH-IRXDYDNUSA-N	447.393	1.733	50	20	IDGD	
Cn1ncnc1C(=O)N1CCC(OC2CCN(C(=O)[C@H](F)Br)CC2)CC1	1837371588	JMVRLTFYUUAILH-ZDUSSCGKSA-N	432.294	1.118	50	20	IDGD	
O=C(c1cc(F)cnc1Cl)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1837858444	HRSYNMSYZBEYHG-MRXNPFEDSA-N	440.686	1.748	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC(OC2CCN(C(=O)[C@H]3CC=CCC3)CC2)CC1	1837920036	FCHWMEGRSVZJMH-SFHVURJKSA-N	440.349	1.335	50	20	IDGD	
COc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)ccn1	1837977537	KPBAWMKEQHOPGL-FQEVSTJZSA-N	437.569	1.012	50	20	IDGD	
Cc1nc(C)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)o1	1838007436	BLZIFXVJLCSJBQ-PIGZYNQJSA-N	430.299	1.145	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)CCBr)C3)C2)c(C)n1	1838360542	ZMNHAFCSCGUWJW-IBGZPJMESA-N	440.338	1.553	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC(OC2CCN(C(=O)c3cc(O)no3)CC2)CC1	1838429763	MVLKDEZXYQSTEG-UHFFFAOYSA-N	425.558	1.844	50	20	IDGD	
CSc1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)c1O	1838564234	DRQICCIQRBAKRX-QAPCUYQASA-N	432.901	1.719	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(C)nc3O)CCO2)C1	1838667382	DEVJEXJGLXFCPX-OXQOHEQNSA-N	425.913	1.573	50	20	IDGD	
COc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)ccc1O	1838975894	XAWQCMHQOWKGCC-GOSISDBHSA-N	433.288	1.275	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)c3ccccc3)C2)C1	1839152347	WUPWJQYPBJMBKE-PWIZWCRZSA-N	445.343	1.413	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(Cl)ccn3)C2)C1	1840033966	VTFCBDMURNTCFE-YVEFUNNKSA-N	446.729	1.588	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(F)cc(F)c3)C2)C1	1840034356	ISGWOWJGTJRMAV-KZULUSFZSA-N	447.276	1.818	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)C(F)(F)c3ccco3)C2)C1	1840156037	MLMZFOPFCMFGQL-CXAGYDPISA-N	436.839	1.082	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3c(C)cccc3F)CCO2)C1	1840652255	JKQXDWXFEAYTBS-YWZLYKJASA-N	428.888	1.458	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)C3CCN(CC)CC3)CCO2)C1	1840927045	GALXCAAGYKYFLH-WIYYLYMNSA-N	429.989	1.582	50	20	IDGD	
O=C([C@H](O)c1cccc(Br)c1)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1	1841352512	SVGVBQYPLJNFRV-UONOGXRCSA-N	431.714	1.286	50	20	IDGD	
N=C1NCCN1CC(=O)N1CCCC12CN(C(=O)[C@H](Br)Cc1ccccc1)C2	1842910198	JJNMIBGNIIZKRO-MRXNPFEDSA-N	448.365	1.036	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)c2occc2Br)C1	1843484896	NLGGJSVVBCNBJK-UHFFFAOYSA-N	427.299	1.232	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCCC12CN(C(=O)/C=C/C(=O)NCc1ccco1)C2	1845171010	AXQLECCXTQYZEV-QWNKOJSDSA-N	428.316	1.892	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC12CN(C(=O)c1ccc([N+](=O)[O-])c3c1OCO3)C2	1846177787	LRHAHMKVCGNZIZ-JTQLQIEISA-N	440.250	1.924	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)C1(F)CN(C(=O)OC(C)(C)C)C1)C2	1846365542	AQNFUCBXEAKZRU-CYBMUJFWSA-N	433.908	1.403	50	20	IDGD	
CC(C)[C@@H](C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl)N1Cc2ccccc2C1=O	1847557425	YLZIZJCCTMQFDV-OKYOBFRVSA-N	433.936	1.469	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCO)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CO[Si](C)(C)C	1847641985	XAWFNNIVZYQCES-JYJNAYRXSA-N	443.617	1.315	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)n1cncn1	1848098588	KOAHMPXFULZHHG-QPSCCSFWSA-N	440.932	1.173	50	20	IDGD	
O=C(CN1CCCN(Cc2ccc(F)cc2)CC1)NNC(=O)c1cccc([N+](=O)[O-])c1	11291742	DHAFIHBWFYERBH-UHFFFAOYSA-N	429.452	1.703	50	20	IDGD	
CCOc1ccc(CN2C(=O)c3ccccc3C2=O)cc1C(=O)NNc1nnc(C)c(=O)[nH]1	11547858	BSSXNEFDKRUFFL-UHFFFAOYSA-N	448.439	1.425	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)CSc2ccc(C(N)=O)cc2[N+](=O)[O-])c1	15886059	YMVZTIOKSCWUKY-UHFFFAOYSA-N	432.458	1.629	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)CCCn2c(=O)oc3ccccc32)c2ccccc2c1=O	15939581	KNYHPVNKPKVRJI-UHFFFAOYSA-N	435.440	1.566	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)c2c(C)nn(C)c2n1	24257626	BCCZCDZALLXATD-UHFFFAOYSA-N	433.472	1.951	50	20	IDGD	
N#CCCNS(=O)(=O)c1ccc(C(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)cc1	26809528	PSRBTINGDOSQFH-UHFFFAOYSA-N	430.530	1.856	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)[C@@H]1CCCN1C(=O)Cc1ccccc1	108987246	CLQUGBMNZQCWMB-SFHVURJKSA-N	425.485	1.845	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)C[C@H](C)NC(=O)C2CCCC2)c2ccccc2c1=O	727098803	GBOYDDDRHFDYAM-AWEZNQCLSA-N	427.505	1.823	50	20	IDGD	
CC(=O)N[C@H](CC(=O)OCC(=O)NNC(=O)c1ccc(C)cc1)c1c(F)cccc1F	727570323	BITSJNQXLJWFIE-QGZVFWFLSA-N	433.411	1.845	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCc2ccc3c(c2)OCCCO3)c2ccccc2c1=O	727605629	ROEZCEILXFJHNY-UHFFFAOYSA-N	437.456	1.722	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(/C#N)C(=O)NCCCN2CCC[C@H](C(N)=O)C2)c1C	728077412	IQABOSSMGNSPHR-QNPMFQAPSA-N	429.565	1.923	50	20	IDGD	
Cc1cc(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)c2c(C)n[nH]c2n1	728214116	JNQQKDBOEABCFS-UHFFFAOYSA-N	443.533	1.268	50	20	IDGD	
CC(C)C(=O)Nc1ccc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1	728322815	MVHNYDXYEKWDMH-GOSISDBHSA-N	441.440	1.425	50	20	IDGD	
CCn1cc(CC(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c2ccccc21	728340745	PUJXLCLMBZTOHM-HXUWFJFHSA-N	437.452	1.734	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1cccc(OC[C@@H]2CCCO2)c1	728846110	VJAHJONXFWWVIG-IBGZPJMESA-N	425.489	1.712	50	20	IDGD	
O=C(Cc1ccc(F)c(Br)c1)NNC(=O)C1CCN(c2ncccn2)CC1	728846155	MHNBFYHPSHHPSK-UHFFFAOYSA-N	436.285	1.985	50	20	IDGD	
COCCS(=O)(=O)c1ccc(C(=O)NNC(=S)Nc2ccc(N(C)C)cc2)cc1	729690080	QGYXEMYXLHWIOX-UHFFFAOYSA-N	436.559	1.804	50	20	IDGD	
CC(=NNC(=O)c1ccc(Cl)nc1)c1cccc(N(S(C)(=O)=O)S(C)(=O)=O)c1	729816055	DUNIWIIEHORVHQ-UHFFFAOYSA-N	444.922	1.615	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)NCc2nnnn2-c2ccccc2)c1	730673393	SUHRJHCCYBGGGZ-UHFFFAOYSA-N	446.265	1.578	50	20	IDGD	
COC(=O)NCCCC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	730769953	STDURVRWEUCZDD-UHFFFAOYSA-N	440.503	1.446	50	20	IDGD	
Cc1ccc(S(=O)(=O)n2ccc(C(=O)NNC(=O)[C@H]3COc4ccccc4O3)c2)cc1	731865367	CMRLKYDXGFVYJA-LJQANCHMSA-N	441.465	1.635	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1	731978171	KRWQKQSIBPXPNN-ZDUSSCGKSA-N	432.458	1.660	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NNC(=O)c2ccccc2F)cc1Br	732255298	BQNOCNUTVYQIQB-UHFFFAOYSA-N	425.214	1.886	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CNC(=O)c2ccc(C#N)cc2)cc1Br	732306330	YOZPURFTBLAAES-UHFFFAOYSA-N	431.246	1.520	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)NCCN/C(O)=C2/N=CC=CC2=O)c1	732466574	PJPNEMIAIBCZAW-VXPUYCOJSA-N	429.477	1.354	50	20	IDGD	
CCOC(=O)C1=NN(c2ccccc2)[C@@H](C(=O)NNc2nc3ccccc3c(=O)n2C)C1	733260332	AGMJXGKOPQVTGQ-GOSISDBHSA-N	434.456	1.575	50	20	IDGD	
O=C(NCCN1C(=O)CCC1=O)NNC(=O)c1cn(-c2ccccc2)nc1-c1ccccc1	733848780	SUOHHHGZEPKMAE-UHFFFAOYSA-N	446.467	1.632	50	20	IDGD	
CCOc1ccc(NS(=O)(=O)c2ccc(C(=O)NNC(=O)c3cnn(C)c3)cc2)cc1	735473299	ROIUYJUTJOGCKN-UHFFFAOYSA-N	443.485	1.694	50	20	IDGD	
O=C(CC1(O)CCCC1)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	735840041	BNVMJQIYRKXUMW-UHFFFAOYSA-N	431.514	1.621	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)C2(C#N)CCC2)c1	736064461	KHVQIRCCHLVSQF-UHFFFAOYSA-N	428.470	1.951	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)c2ccc(N3CCCS3(=O)=O)cc2Cl)n1	736065970	XTOQSIVTYBMOQY-UHFFFAOYSA-N	425.898	1.154	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)c1ccc(N2CCCS2(=O)=O)cc1Cl	736066915	YALYZXYKGAAZKY-UHFFFAOYSA-N	441.868	1.859	50	20	IDGD	
CCOC(=O)C(=O)N1CCN(C(=O)/C(C#N)=C\c2cc(C)n([C@@H](C)COC)c2C)CC1	736130206	DBGGIPIDYYMKJK-JJBLJPBOSA-N	430.505	1.453	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2cc3c(s2)CCCCC3)nc2c1c(=O)n(C)c(=O)n2C	737772221	HKUQPOHOWILIAF-UHFFFAOYSA-N	441.513	1.346	50	20	IDGD	
CNC(=O)Cn1cnc(NC(=O)/C(C#N)=C/c2cc(C)n(-c3ccc(OC)cc3)c2C)n1	741995974	AEYVYPHQERNCGA-LICLKQGHSA-N	433.472	1.986	50	20	IDGD	
CCn1c(SCC(=O)NNC(=O)C2CC2)nc2ccc(Br)cc2c1=O	742449715	WGWOPBZUNOOYKJ-UHFFFAOYSA-N	425.308	1.828	50	20	IDGD	
C[C@@H]1C[C@@H](NC(=O)NNC(=O)c2ccc(Br)s2)C(=O)N1c1cnn(C)c1	743518785	UJZFPLOPIBYLDO-PSASIEDQSA-N	441.311	1.382	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2cc([N+](=O)[O-])cc3c2OCCO3)cc1	743830562	HECDKYYYXDLOPT-UHFFFAOYSA-N	436.402	1.236	50	20	IDGD	
C[C@H](NC(=O)c1ccc(Cl)cc1)C(=O)OCC(=O)NNC(=O)c1cccc(C#N)c1	744481637	IUODSZGNQLBHQD-LBPRGKRZSA-N	428.832	1.334	50	20	IDGD	
Cc1noc(Cl)c1CCC(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	744619518	RITMWRVMNCVYAL-UHFFFAOYSA-N	428.898	1.733	50	20	IDGD	
O=C(COC(=O)[C@H](c1ccccc1F)N1CCOCC1)NNC(=O)c1cccc(Cl)c1	745499809	PIXCFKFNMPURKB-IBGZPJMESA-N	449.866	1.857	50	20	IDGD	
O=C(CCn1cccc1)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	746092752	CTWZQGGPPGCDQY-UHFFFAOYSA-N	426.498	1.818	50	20	IDGD	
Cc1ccc([C@H](CN2CCOCC2)NC(=O)NNC(=O)Cc2cn3ccccc3n2)cc1	746743317	URCFIIYSDIBAIQ-FQEVSTJZSA-N	436.516	1.589	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)N2CCN(C(C)(C)C(N)=O)CC2)c(C)n1C[C@H]1CCCO1	747921612	ZFDCRGIURLOTHC-UMSHPIDHSA-N	427.549	1.599	50	20	IDGD	
COc1cc(OC)cc(N2CC[C@@H](NC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)C2=O)c1	747954086	GDHMXWVLJWGZPJ-QGZVFWFLSA-N	443.416	1.362	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)NCCCN1CCN(c2ccncc2)CC1	748465108	KFFIKDFCLKNYMW-UHFFFAOYSA-N	430.484	1.142	50	20	IDGD	
NC(=O)c1ccc(C(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)s1	749403373	KDJHCSXNAHQSJX-UHFFFAOYSA-N	447.480	1.624	50	20	IDGD	
O=C(NNC(=S)NC[C@H]1CCOC1)c1cccc(S(=O)(=O)N2CCCCC2)c1	749643480	BQXDWZNAEOJZHD-CQSZACIVSA-N	426.564	1.007	50	20	IDGD	
CC(=O)[C@H]1CC(C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)=NN1c1ccccc1	751325510	JVFRVRUGRAJKNB-GOSISDBHSA-N	428.470	1.075	50	20	IDGD	
CC(C)OCCCn1c(NNC(=O)CCC(=O)N2CCOCC2)nc2ccccc2c1=O	751892920	KMHIBQMNLDHUPP-UHFFFAOYSA-N	445.520	1.294	50	20	IDGD	
CC[C@H](CS(=O)(=O)c1ccccc1)NC(=O)NNC(=O)CNC(=O)c1cccs1	752153276	CVRQVFJBWJVYQQ-CYBMUJFWSA-N	438.531	1.061	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)[C@H]1CC(=O)N(CCOc2ccccc2Cl)C1	752286502	ONGGJLDFSHTCMN-INIZCTEOSA-N	445.903	1.966	50	20	IDGD	
C[C@]1(c2ccc(C(=O)OCC(=O)NNC(=O)c3cccc(Cl)c3)cc2)NC(=O)NC1=O	754525234	OIKAIQBCQDDIQX-HXUWFJFHSA-N	444.831	1.013	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)Nc1cccc(S(=O)(=O)NC2CC2)c1	755584579	DBLQGTYDSLKQSS-UHFFFAOYSA-N	429.458	1.231	50	20	IDGD	
N#CCc1ccc(OCc2cccc(NC(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)c2)cc1	755952062	DQKUKCTXKGYDFE-KRWDZBQOSA-N	442.497	1.919	50	20	IDGD	
COc1ccc(C(=O)N2CCN(C)CC2)cc1NC(=O)NNC(=O)CCc1ccccc1	756249097	UNKMGIUVGGTTTF-UHFFFAOYSA-N	439.516	1.868	50	20	IDGD	
COc1ccc(C(=O)N2CCOCC2)cc1NC(=O)NNC(=O)Cc1ccccc1F	756256130	FSTTZMOIXDPLOQ-UHFFFAOYSA-N	430.436	1.702	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1ccc2nc(-c3ccc(F)cc3)oc2c1	756539180	JPZBMLCTNNDSOB-JTQLQIEISA-N	435.437	1.724	50	20	IDGD	
COCC[S@@](=O)Cc1cccc(NC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1	756613943	RVGYVVYJQKBAMX-VPTFNQTCSA-N	433.486	1.574	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)Nc2cnn(CCN3CCOCC3)c2)o1	756827332	RUJVTVGMAWHQCP-UHFFFAOYSA-N	433.513	1.117	50	20	IDGD	
C[C@H]1CN(C(=O)Cn2cc(NC(=O)NNC(=O)c3c[nH]c4ccccc34)cn2)C[C@@H](C)O1	756839722	SLGICUTYWJQNMZ-OKILXGFUSA-N	439.476	1.467	50	20	IDGD	
CNC(=O)c1cc(Oc2ccccc2NC(=O)NNC(=O)Cn2nc(C)cc2C)ccn1	756865122	BYQWREFDGJVPME-UHFFFAOYSA-N	437.460	1.900	50	20	IDGD	
N#CCCn1cc(/C=C(/C#N)C(=O)NCCC(=O)NC(N)=O)c(-c2ccc(Cl)cc2)n1	758589423	RWGXQNSJJYJBNO-UVTDQMKNSA-N	439.863	1.725	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)c1nccs1	758725017	UCUHVWFQVZYBBL-ZDUSSCGKSA-N	437.547	1.675	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@H](NC(=O)NNC(=O)Cn2ccc3ccccc32)[C@H](C#N)C1	758749471	BAKZINMITAAWIS-HZPDHXFCSA-N	426.477	1.731	50	20	IDGD	
COc1ccc(-c2nn(CCC#N)cc2/C=C(\C#N)C(=O)NCCc2nc[nH]n2)cc1OC	759227607	PRSYHDVHCPFBNV-MHWRWJLKSA-N	446.471	1.865	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)ccc1Br	763469793	BLWUQXGYDKDJMO-UHFFFAOYSA-N	437.206	1.766	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccc3[nH]c(C)cc3c2)cc(OC)c1OC	763539480	LUSJHUHHGVVVEJ-UHFFFAOYSA-N	426.429	1.902	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(C)c2C(=O)N2CCCC2)c1	763623457	MMWWYMRDYLBDFO-UHFFFAOYSA-N	438.484	1.704	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2ccnn2Cc2ccccc2F)c1	763624256	UVKYSGCEJBHRQB-UHFFFAOYSA-N	425.420	1.544	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1nn(C2CCCCC2)cc1C	763647847	RGLOFNHZUKTDMQ-UHFFFAOYSA-N	429.477	1.870	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2F)ccc1N1CCSCC1	763680402	HITQFDCQROVOTK-UHFFFAOYSA-N	446.504	1.852	50	20	IDGD	
COc1ncc(C)cc1NC(=O)C(=O)NNC(=O)COc1ccc(Br)cc1	763695720	UYJWFNKOMUZFHP-UHFFFAOYSA-N	437.250	1.326	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2ccc(C#N)cc2Cl)c2ccccc2c1=O	763787112	WABURHOTZUALAK-UHFFFAOYSA-N	438.831	1.341	50	20	IDGD	
Cc1cccc(F)c1NC(=O)C(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12	763790564	LBXIBZCTKIKEBU-UHFFFAOYSA-N	425.420	1.825	50	20	IDGD	
O=C(NNC(=O)c1nnc(O)c2ccccc12)C(=O)Nc1ccc(N2CCCCC2)cc1	763791442	RPIOAPWWMBRISV-UHFFFAOYSA-N	434.456	1.725	50	20	IDGD	
CCCc1nc(C(=O)NNC(=O)CNC(=O)c2cccnc2)nn1-c1ccccc1Cl	763818805	PIDKYOBFVZQTPR-UHFFFAOYSA-N	441.879	1.459	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)C(=O)Nc1ccn(CC(F)F)n1	763851022	SWNBWCYGJXRHHL-LBPRGKRZSA-N	431.399	1.855	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2ccccc2N(C)Cc2ccccc2)n1	763886343	UREZVCZFXMFHIR-UHFFFAOYSA-N	434.500	1.922	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)C2=S=C3CC[C@H](C)CC3=C2)cc1C	763940959	JWONPIIYVSOYJB-NSHDSACASA-N	429.498	1.706	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)C(=O)Nc1cc2c(cc1Cl)OCO2	763949469	OXPWTKZGYZQICU-UHFFFAOYSA-N	443.803	1.360	50	20	IDGD	
O=C1CCCc2cc(NC(=O)C(=O)NNC(=O)c3cc(Br)c[nH]3)ccc2N1	763996201	VWIGJJAEYHTFKW-UHFFFAOYSA-N	434.250	1.452	50	20	IDGD	
CCOc1cc2c(cc1NC(=O)C(=O)NNC(=O)c1ccc3c(c1)OCCO3)O[C@H](C)C2	764003493	FFJJSLUMFSBARX-GFCCVEGCSA-N	441.440	1.580	50	20	IDGD	
CS(=O)(=O)Cc1ccccc1NC(=O)C(=O)NNC(=O)c1ccc2ccccc2c1	764061958	PJUYNCFJWMOGLE-UHFFFAOYSA-N	425.466	1.784	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccccc2OCC(F)F)c1	764078448	VEAROWRIGKEZME-UHFFFAOYSA-N	441.412	1.134	50	20	IDGD	
N#CCOc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(F)cc2Br)c1	764084927	KBHRXBYATTZUBE-UHFFFAOYSA-N	435.209	1.890	50	20	IDGD	
Cc1nc(N2CCOCC2)ccc1NC(=O)C(=O)NNC(=O)Cc1ccc2ccccc2c1	764093015	YDYREJIWDDEBFK-UHFFFAOYSA-N	447.495	1.708	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C)cc2OC[C@H]2CCCO2)c(O)c1	764104906	IERXVZAAIZJQRI-OAHLLOKOSA-N	427.457	1.967	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccccc3C[S@](C)=O)n[nH]2)cc1	764110675	AMKCAKUWINCJNN-HKBQPEDESA-N	439.497	1.663	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)C(C)C)cc1NC(=O)C(=O)NNC(=O)CC(F)(F)F	764114541	DBAATSQJTAFGOK-UHFFFAOYSA-N	438.428	1.062	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)C(=O)Nc1ccc(N2CCCC2=O)c(OC)c1	764136042	MNJVGCBVOALJTQ-UHFFFAOYSA-N	440.456	1.159	50	20	IDGD	
CS(=O)(=O)c1cccc(Oc2ccc(NC(=O)C(=O)NNC(=O)CC3CC3)cc2)c1	764143627	WTADNUJEQNYKBL-UHFFFAOYSA-N	431.470	1.768	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)CCc2ccco2)c2ccccc12	764168913	IYSBXTIQCHACKO-UHFFFAOYSA-N	439.424	1.703	50	20	IDGD	
CN(C)C(=O)c1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)[C@H]1Cc2ccccc2O1	764169063	STJTUNQITCHLJH-MRXNPFEDSA-N	430.848	1.131	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)C(=O)Nc1ccc(OCC2CCOCC2)cc1	764281340	SROJNHHWMJNLFI-UHFFFAOYSA-N	441.484	1.916	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2c(F)cc(F)cc2F)n[nH]1	764376376	CGWWLHPWMIVLFS-UHFFFAOYSA-N	433.346	1.902	50	20	IDGD	
Cc1nc(-c2ccc(NC(=O)C(=O)NNC(=O)CSc3ccccc3O)cc2)n[nH]1	764405897	XVDUTTYMXUFNKO-UHFFFAOYSA-N	426.458	1.364	50	20	IDGD	
C=CCNS(=O)(=O)c1cc(C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)ccc1F	765568216	NVLDCEARZCKSBF-UHFFFAOYSA-N	449.489	1.816	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2ccc[nH]2)c(I)c1	765697705	JPHCPQSPBJEBTA-UHFFFAOYSA-N	428.186	1.028	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)[C@@H]1CCN(c2ccc(F)cc2)C1=O	767309394	ZFACCTPSTIGTEW-GOSISDBHSA-N	427.432	1.420	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3coc(C4CCOCC4)n3)cc2)CC1	768089836	FUYVTCCZYGLWNN-UHFFFAOYSA-N	449.533	1.262	50	20	IDGD	
CC(C)[C@H](NC(=O)OC(C)(C)C)C(=O)NCC(=O)NNc1ccc(C(F)(F)F)nn1	768487395	HJJGZERQXSMWIG-ZDUSSCGKSA-N	434.419	1.604	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)N1CCC[C@@H](c2nc3c(s2)CCCC3)C1	768527557	YOEPBVFGCIZOFC-CYBMUJFWSA-N	431.518	1.965	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)[C@H](O)[C@@H](O)c1nc2ccccc2s1	768639436	QNCATICDEMAXSI-HZPDHXFCSA-N	437.499	1.246	50	20	IDGD	
N#Cc1cc(Cl)nc(NNC(=O)c2cc(S(=O)(=O)N3CCSCC3)c[nH]2)c1	768701780	LXDXVJAKKJTHEN-UHFFFAOYSA-N	426.911	1.429	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)c1cc(N2CCOCC2)ccn1	769422678	HPPYRDNJDKTABP-ZDUSSCGKSA-N	449.305	1.909	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1ccc(OCC(=O)N2[C@@H](C)CCC[C@H]2C)cc1	771853395	SSVFQOFCOLPEIQ-XHSDSOJGSA-N	433.505	1.958	50	20	IDGD	
CCCCn1ncc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1C	772375506	KCNPYMLGTSYJLC-UHFFFAOYSA-N	433.534	1.851	50	20	IDGD	
CC(C)[C@H](C(=O)NNC(=O)NCc1cccc(C(F)(F)F)c1)N1CCCS1(=O)=O	772693093	WAXVEURERGKHAN-CQSZACIVSA-N	436.456	1.596	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)C(=O)Nc2ccc(C)c(S(=O)(=O)NC3CC3)c2C)n1	773483342	VOWNYVUJCOQCPH-UHFFFAOYSA-N	432.506	1.233	50	20	IDGD	
Cc1nnnn1-c1cccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)c1	774008835	MGHKZJNAMMVXDD-LLVKDONJSA-N	443.851	1.178	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)n(-c2ncccn2)n1	774010730	YWPAVOLAGAYBJJ-LBPRGKRZSA-N	443.851	1.178	50	20	IDGD	
Cc1cc(NC(=O)NNc2cccc(S(C)(=O)=O)c2)n([C@H]2CCS(=O)(=O)C2)n1	776466373	QIXSKZCPRHMCNL-ZDUSSCGKSA-N	427.508	1.103	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)NC[C@@H]2COC3(CCOCC3)O2)c(C)n1-c1ccccc1	777755196	BNZWBRONMOTZHW-GOSISDBHSA-N	428.489	1.960	50	20	IDGD	
CC(C)(C)NS(=O)(=O)Cc1cccc(C(=O)NNC(=O)CNC(=O)OC(C)(C)C)c1	778443297	OTPMLVOUWCQHGQ-UHFFFAOYSA-N	442.538	1.190	50	20	IDGD	
O=C(NNc1ccc([N+](=O)[O-])cc1Br)C(=O)Nc1cnn(CC(F)F)c1	778759301	AIOIDPJUKAUSGJ-UHFFFAOYSA-N	433.169	1.901	50	20	IDGD	
COC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(NC(=O)NN=c3cc[nH]cc3)cc2)C1	782015860	PWQDEGDIBHBHRL-AWEZNQCLSA-N	433.490	1.226	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CN2CCNC(=O)[C@@H]2c2ccccc2C(F)(F)F)cc1	782102398	URJLQJYRPDHEOW-SFHVURJKSA-N	434.418	1.948	50	20	IDGD	
Cn1cc(-c2ccc(F)c(C(=O)OCC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)c2)cn1	782419332	OLHATHIWDCMFNW-UHFFFAOYSA-N	441.375	1.752	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(C)(OCC(=O)NNC(=O)c2nnc(O)c3ccccc23)C1	782669486	ZNDBXHBGRDXGIY-UHFFFAOYSA-N	431.449	1.122	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)Nc1ccc(-n2cccn2)c(F)c1	785024036	RBTNVCPJXMRBKG-UHFFFAOYSA-N	428.336	1.025	50	20	IDGD	
CCOC(=O)c1cc(-c2ccccc2)ccc1NC(=O)C(=O)NNc1nccn(C)c1=O	785090392	QXUXJLCZRWOIMF-UHFFFAOYSA-N	435.440	1.706	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2ccc(N3C[C@@H](C)O[C@H](C)C3)nc2)n1	785226929	XJPKYUYRHVNGKK-HUUCEWRRSA-N	442.524	1.413	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)c1ccc(S(C)(=O)=O)c([N+](=O)[O-])c1	785343764	HLOLEOJJPOTCDM-SNVBAGLBSA-N	441.849	1.880	50	20	IDGD	
COC(=O)CCc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(OC)c(OC)c2)c1	786414674	PXXNSQYOSDPANX-UHFFFAOYSA-N	429.429	1.209	50	20	IDGD	
CC(=O)OC(C)(C)C(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	788626191	VXQJZGCHUZNKKG-UHFFFAOYSA-N	433.486	1.268	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)N[C@@H](C)c2ncnn2C)c2ccccc2c1=O	788887215	RRVWULYSRHODFK-ZDUSSCGKSA-N	426.481	1.420	50	20	IDGD	
COc1ccccc1S(=O)(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	788915867	MBCJZLKZATWCHZ-UHFFFAOYSA-N	428.511	1.493	50	20	IDGD	
COCCONC(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2OC)c1	789348062	VWWSWPHVRUXVJZ-UHFFFAOYSA-N	438.462	1.018	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CC(=O)c2ccccc21)c1cccc(S(=O)(=O)N2CCCCC2)c1	789726668	DIOMKOWVPNIDNW-LJQANCHMSA-N	441.509	1.992	50	20	IDGD	
CC(C)C(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)c1	789809603	BGTJRJQGCSURCF-OALUTQOASA-N	438.484	1.940	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)c1ccc(OC)c(S(=O)(=O)N2CCCC2)c1	790062876	BSIXPTJWGPXMJJ-UHFFFAOYSA-N	443.522	1.030	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)cccc1NC(=O)N(C)C	792350278	GBDMCLXPICDMGN-UHFFFAOYSA-N	427.417	1.217	50	20	IDGD	
O=C(NNc1nc2ccccn2n1)C(=O)Nc1ccc(Cl)cc1C(=O)N1CCCC1	792392049	PIQPKLTUIACGBU-UHFFFAOYSA-N	427.852	1.701	50	20	IDGD	
COCCOc1ccc(C(F)(F)F)cc1NC(=O)C(=O)NNc1nc2ccccn2n1	792394919	SFPCCMFWOCWONR-UHFFFAOYSA-N	438.366	1.855	50	20	IDGD	
Cc1c(C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)nnn1Cc1ccncc1	795994968	UGQWUQRFBWYDOV-UHFFFAOYSA-N	427.490	1.227	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCCC[C@@H]2COC(=O)NC(C)C)cc1OC	796705194	DCBSJPRRMWGHIN-MRXNPFEDSA-N	436.509	1.454	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1cc(F)c(Br)cc1Cl	799259420	WEEIDCFJWOONNF-ZETCQYMHSA-N	440.653	1.379	50	20	IDGD	
O=C(NNC(=O)c1sccc1S(=O)(=O)N1CCOCC1)Nc1cc(F)cc(F)c1	802003536	UATJISJQLMQIDM-UHFFFAOYSA-N	446.457	1.514	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)CN(C)c1cc(Br)ccc1[N+](=O)[O-]	803723903	QSKNPIXKVUSHPM-VIFPVBQESA-N	431.243	1.283	50	20	IDGD	
CC(C)(C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1)c1cc(F)cc(C#N)c1	803926251	RMJNNFBQVXGJSU-GOSISDBHSA-N	441.415	1.506	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(F)c(N2CCCNC2=O)c1	806972360	RXWIRRSNUYSUIX-UHFFFAOYSA-N	444.379	1.053	50	20	IDGD	
O=C(COc1ccccc1-c1ccccc1)NNC(=O)C(=O)Nc1cccc2c1CNC2=O	806973324	LCWQJJONXDJXTP-UHFFFAOYSA-N	444.447	1.762	50	20	IDGD	
C[C@]1(C2CC2)NC(=O)N(c2ccc(CNC(=O)NNC(=O)c3ccccc3O)cc2)C1=O	807242129	PJWMORGEZZUFTJ-JOCHJYFZSA-N	437.456	1.761	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)c1ccc(S(C)(=O)=O)c(Br)c1	807368405	GEXQILCSJNDYGA-UHFFFAOYSA-N	437.312	1.403	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCCCC2)cc1NC(=O)C(=O)NNc1cccc(F)n1	807392085	RMAARRPESRJKCG-UHFFFAOYSA-N	435.481	1.786	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)N[C@@H]2CCN(Cc3ccc(OC)cc3OC)C2=O)c1	807577777	IADKZSWYONQVPK-GOSISDBHSA-N	442.472	1.918	50	20	IDGD	
CC(C)CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)NNc1ccc(S(=O)(=O)C(F)F)cc1	810346365	MZGNBYOIFVLMIH-OAHLLOKOSA-N	443.476	1.623	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)c2cccc(NC(=O)[C@H]3CCCO3)c2)cc1	812730208	AZIJJRFAZFGAQJ-GOSISDBHSA-N	432.502	1.811	50	20	IDGD	
CC1(C)NC(=O)N(c2cccc(NC(=O)NNC(=O)COc3ccccc3F)c2)C1=O	812973967	NPKGXWJGIBFFSM-UHFFFAOYSA-N	429.408	1.892	50	20	IDGD	
O=C(NNC(=O)c1cnn2c1OCCC2)c1ccccc1NS(=O)(=O)c1cccs1	814255486	PWUOAMSEGJQUGP-UHFFFAOYSA-N	447.498	1.603	50	20	IDGD	
CC(=O)N(c1ccc(NC(=O)C(=O)NNC(=O)Cc2ccccc2F)cc1)[C@H]1C[C@@H]1C	815569381	QYIHZFQDAVMSMB-DJJJIMSYSA-N	426.448	1.916	50	20	IDGD	
CC(C)OCCCn1c(NNC(=O)[C@@H]2CCc3nncn3C2)nc2ccccc2c1=O	815604219	HTQXFWPHSQDQPD-OAHLLOKOSA-N	425.493	1.509	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCc2nncn2C1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-]	816885356	XPUAXYZQZQCCCE-SECBINFHSA-N	428.327	1.151	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2cccc(N3C(=O)CCC3=O)c2)c2ccccc2c1=O	884856458	GTWAGIZUGRVPMZ-UHFFFAOYSA-N	447.451	1.535	50	20	IDGD	
O=C(CNS(=O)(=O)c1cccc(Br)c1)NNC(=O)Cc1ccc(F)cc1	913155394	CPKUCXDLNVMMOT-UHFFFAOYSA-N	444.282	1.257	50	20	IDGD	
CN(CC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)C(=O)c1cccs1	914707853	CFSVSXZKVWXNGR-UHFFFAOYSA-N	429.546	1.180	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)c2cc(Br)c[nH]2)c1	914751093	BZCCCMJPYZSWQQ-UHFFFAOYSA-N	447.286	1.678	50	20	IDGD	
O=C(NNC(=O)C1CCCC1)c1ccc(Cl)c(S(=O)(=O)NC[C@H]2CCCO2)c1	914849168	QMDHSEIYVZZDRF-CQSZACIVSA-N	429.926	1.749	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NCCCN1C(=O)NC2(CCCC2)C1=O	915906182	PUFBTJKAVABLMM-CYBMUJFWSA-N	435.456	1.178	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NC[C@H]2CCN(c3ccccc3)C2)c2ccccc2c1=O	916579658	JIPZEACYEYCKLT-MRXNPFEDSA-N	434.500	1.887	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)NCCS(=O)(=O)NC(C)(C)C)c(C)n1-c1ccccc1	916622251	CKTGFABCTOZXMM-UHFFFAOYSA-N	435.550	1.756	50	20	IDGD	
C[C@H]1CN(c2ccc(CNC(=O)NN[C@]3(C)CCS(=O)(=O)C3)cc2F)C[C@@H](C)O1	918219031	CACYKQBPVJITGK-BIENJYKASA-N	428.530	1.320	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)NCCC(=O)N[C@H]2CCS(=O)(=O)C2)c(C)n1CC(C)C	919715442	VWUGQKMVDXRQCO-UDKWZTAFSA-N	434.562	1.478	50	20	IDGD	
O=C(NCC(=O)N1CCCc2ccccc21)NNC(=O)c1nn(-c2ccccc2)cc1O	920045326	GWRBHCYWCBJDIC-UHFFFAOYSA-N	434.456	1.501	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)Nc2nc(CN3CCOCC3)cs2)cc1OC	920932027	QDBISUGPSRVUFS-UHFFFAOYSA-N	435.506	1.849	50	20	IDGD	
CN1C(=C(C#N)C(=O)COC(=O)[C@H]2CC23CCS(=O)(=O)CC3)N(C)c2ccccc21	1116826965	YPPCMZFQQGAJLB-OAHLLOKOSA-N	429.498	1.635	50	20	IDGD	
Cc1cc(C(=O)O)c(O)c(S(=O)(=O)NNC(=O)c2ccc(Br)cc2)c1	1318026552	MXDZJBBGXRZZFS-UHFFFAOYSA-N	429.248	1.785	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)ccc2cncn12	1320102704	ZFSMCAHYOJLNMQ-UHFFFAOYSA-N	427.486	1.502	50	20	IDGD	
CCc1cc(NNC(=O)Cc2ccc(S(=O)(=O)NC)cc2)nc(-c2ccccn2)n1	1320177590	LDISGWVUHLYIMZ-UHFFFAOYSA-N	426.502	1.695	50	20	IDGD	
O=C(NNC(=O)c1n[nH]cc1I)c1ccc(Br)s1	1320313638	QGLLSLKMDZENQC-UHFFFAOYSA-N	441.048	1.913	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)CNC(=O)OCC(F)(F)F)CC1	1328653862	PYXGJJNYMICLAS-UHFFFAOYSA-N	426.392	1.069	50	20	IDGD	
CC(=O)N[C@H](C)c1ccc(S(=O)(=O)NNC(=O)c2cncn2-c2ccccc2)s1	1337637674	IXNOBWQUOBESRI-GFCCVEGCSA-N	433.515	1.754	50	20	IDGD	
C[C@H]1CCCN(C(=O)CCNC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)C1	1340418543	WDXGKEYRGGZCPR-ZDUSSCGKSA-N	425.511	1.074	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnc4ccccn34)C2)C1	1777827232	JDEUUPYEHVRNGQ-AUUYWEPGSA-N	435.322	1.951	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(=O)nc3sccn13)C2)[C@@H](F)Cl	1778031240	SXFPHHAKHDXPAV-RVZJWNSFSA-N	442.900	1.418	50	20	IDGD	
Cc1cnc2c(C(=O)N3CC[C@]4(CN(C(=O)CCBr)CCO4)C3)cnn2c1	1778523087	QZBPFKXKDNRNKQ-SFHVURJKSA-N	436.310	1.266	50	20	IDGD	
CC(C)(C)n1cc(C(=O)N2CC[C@@]3(CN(C(=O)CCBr)CCO3)C2)nn1	1780353208	VNODFDJMQAWHJP-QGZVFWFLSA-N	428.331	1.262	50	20	IDGD	
CCOc1ccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)nn1	1780426736	HPXJCAJUXQYUFE-XJKSGUPXSA-N	431.262	1.009	50	20	IDGD	
O=C([C@H](O)CCl)N1CCO[C@]2(CCN(C(=O)[C@@H]3CCCCN3Cc3ccccc3)C2)C1	1780881400	DPIFZZNUVKODBK-MZKRTTBSSA-N	449.979	1.471	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@](C)(Cl)CCl)C3)C2)n1	1781225488	YUPZIRKSMCPAMW-RTBURBONSA-N	443.331	1.720	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](F)Br)C3)C2)c(F)c1	1781334036	USFXOHDUAJKCSM-WMLDXEAASA-N	433.249	1.968	50	20	IDGD	
C[C@H](O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1781986788	WFZKXCSRKFRJQV-UJKGCTCZSA-N	447.960	1.013	50	20	IDGD	
C[C@H](O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)C2	1781995255	AIHODKGQCCCVQY-IQAHDMLFSA-N	433.455	1.766	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2)[C@@H]1CCc2ccccc2O1	1782146548	HBGQBKNPEMWTJI-ITBLURSFSA-N	436.936	1.494	50	20	IDGD	
COc1cc(F)ccc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2	1782846280	KCYSGYFLGAQFMP-WRWLIDTKSA-N	428.888	1.562	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](C)Nc1nccs1)CCO2	1783534997	UYAUYSIVDSWUIK-MKBNYLNASA-N	431.356	1.557	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3c[nH]c4nccc-4c3Cl)CCO2)C1	1783875000	JWINHRRIRFYLME-KUHUBIRLSA-N	441.315	1.865	50	20	IDGD	
O=C(CN1CCc2sccc2C1)N1CCO[C@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783943387	IFDHTERUMLIHED-GOSISDBHSA-N	432.373	1.740	50	20	IDGD	
CN(C)c1ccc([N+](=O)[O-])c(C(=O)N2CCO[C@@]3(CCN(C(=O)C(Cl)Cl)C3)C2)c1	1783948500	PWSRPKQBBRFVSL-GOSISDBHSA-N	445.303	1.908	50	20	IDGD	
COc1ccc(COCC(=O)N2CCO[C@@]3(CCN(C(=O)C(Cl)Cl)C3)C2)cc1	1783950451	NMABXTXBJSFBNQ-IBGZPJMESA-N	431.316	1.845	50	20	IDGD	
CCCC(=O)N[C@@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]2C1	1783966962	NBCUOANYQOWGEJ-YXMSTPNBSA-N	446.386	1.302	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CC[C@H](C(F)(F)F)CC3)C[C@@H]21)[C@@H](O)CCl	1784096435	GGMHORQSRMEFOE-QNILMXGZSA-N	440.890	1.935	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(CCN(C(=O)CCc3cccc(O)c3)C2)C1	1784122696	BYVRAPWWQLWKLD-LJQANCHMSA-N	425.323	1.940	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C=C/c3ccc([N+](=O)[O-])o3)[C@H]2C1	1784219792	KLIOYVJDBCRKNC-QFYSZYJQSA-N	441.868	1.435	50	20	IDGD	
C#CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@@]2(CN(C(=O)C(Cl)Cl)CCO2)C1	1785575766	CMRJNKNYKZDGBR-DJJJIMSYSA-N	448.347	1.537	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ncn(-c4cccc(F)c4)n3)C[C@@H]21)[C@H](F)Cl	1787444358	WHBUXDZVSZBARM-DDWPSWQVSA-N	439.850	1.534	50	20	IDGD	
O=C(CCBr)Nc1ccc(C2(NC(=O)CN3C(=O)C=CC3=O)CCC2)cc1	1787673681	NVLNYSANEIXOKU-UHFFFAOYSA-N	434.290	1.831	50	20	IDGD	
O=C(NC1(c2ccc(NC(=O)c3n[nH]cc3[N+](=O)[O-])cc2)CCC1)c1ccc(B(O)O)cc1	1789690105	WPIIWZLXKVZCHU-UHFFFAOYSA-N	449.232	1.059	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN3CCSCC3)C[C@@H]21	1789868025	ORXRBXRGMIPSAD-XSWJXKHESA-N	438.421	1.251	50	20	IDGD	
CC(C)n1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]3C2)n1	1789924597	OIPLAMHSRXYIKU-NZBPQXDJSA-N	431.306	1.748	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3ccccc3O)[C@H]2C1	1790895894	DRTLSVXJMABGLL-MBGYTDRXSA-N	439.350	1.945	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(OC)nn3C)C[C@@H]21	1790961883	VVRMOPOGCIKGKO-ABHRYQDASA-N	443.342	1.196	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3(C(=O)OC)CC3)C[C@@H]21	1790963685	GQNOEJYZJRSHOH-XUXIUFHCSA-N	431.327	1.093	50	20	IDGD	
Cc1nc(F)ccc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)Br)[C@H]2C1	1791058838	IIOZSSKIFNVFGI-LVGORTOPSA-N	428.302	1.906	50	20	IDGD	
CC(C)N[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)CBr)C(C)C	1792867783	KVHSHGIEOHTLBO-SIRPWMCASA-N	432.403	1.630	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=N/O[C@@H]1CCCCO1)C2	1792870281	BECAOWXPMHYXPQ-ZOHGXAGCSA-N	446.342	1.136	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(N(C)C)cn1)C2	1792870796	VAZGZNHVPPDIAH-VWPFQQQWSA-N	439.354	1.382	50	20	IDGD	
Cc1ccccc1OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2	1795306432	ZOCWKIBTEHHGSU-RMHZUWNSSA-N	429.286	1.654	50	20	IDGD	
Cc1ccc(OCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)cc1	1795729347	GZRYIRVEAZERFV-BJWYYQGGSA-N	437.500	1.324	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C13CC(C(F)(F)F)(C1)C3)C2	1796188026	WBEDLVLROIGAIW-CVMQENGJSA-N	436.239	1.351	50	20	IDGD	
COc1ccnc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)CBr)C3)c1	1798102172	NLKKSEJEKHWNHV-NFFDBFGFSA-N	426.311	1.324	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccc(OC)cc1[N+](=O)[O-]	1799403990	OBWUOPHLOQMSHV-QHHYFVSCSA-N	439.896	1.753	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1cc(O)cc([N+](=O)[O-])c1	1799732895	SIHPRBNRQLAPNL-DJBIQUGXSA-N	446.229	1.194	50	20	IDGD	
Cc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)Br)C3)nc2nccn12	1799991938	UPQFPHJKDHSSCR-XPCVCDNBSA-N	436.310	1.024	50	20	IDGD	
CCOc1cccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)c1O	1800695537	NWZNUVGBHMVWER-BCDXTJNWSA-N	438.289	1.036	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CC(c3ccccc3)=NO1)C2	1800971255	SPCKGVKWOQBTKB-CTRAYCPCSA-N	435.908	1.023	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1c[nH]c3ccc(C)cc13)C2	1800973798	HDIQKBZZLSHRBR-HPNQWNLUSA-N	433.936	1.862	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/c1ccccc1[N+](=O)[O-])C2	1800983298	WYMGLJREYMKMJF-VZKXDKJQSA-N	437.880	1.451	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc3c(Cl)cccn13)C2)C(Cl)Cl	1801016322	YGBUDCRBJHCCGV-DDFAGTSDSA-N	431.707	1.995	50	20	IDGD	
COc1ccc(F)cc1CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2	1801100868	PEOZRDHQGOFGNJ-LZDSYCOUSA-N	447.276	1.657	50	20	IDGD	
COC[C@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccccc1C(=O)OCCO)C2	1802278951	DWASKTNXPKNYQZ-KRXQYRFLSA-N	438.908	1.341	50	20	IDGD	
CCOc1ncccc1C(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]1c1cccnc1	1803137790	RVLHBDKGZUVXJA-BPQIPLTHSA-N	432.908	1.795	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)COCc2ccccc2)[C@H]1c1cccnc1)[C@H](O)CCl	1803139116	STFAXJKFVWYDLY-ZVDOUQERSA-N	431.920	1.904	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CCCSC1	1804244155	IJOWTWIWTFCYNH-CXRKSGDCSA-N	431.562	1.902	50	20	IDGD	
O=C(CCBr)NC[C@H]1CCN(C(=O)c2cc(O)ncn2)[C@H]1c1cccnc1	1806341620	DBVQNWFLNVGPOQ-DYVFJYSZSA-N	434.294	1.682	50	20	IDGD	
O=C(CCBr)NC[C@H]1CCN(C(=O)c2cc(CO)on2)[C@@H]1c1cccnc1	1806344033	VKTFOGUAIGQHEC-CXAGYDPISA-N	437.294	1.667	50	20	IDGD	
C=CCSCC(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1807369866	XKFDZDAKZORBKI-RXVVDRJESA-N	439.346	1.000	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)c1ccc2c[nH]nc2c1	1808049990	ZAXCERLPCXHXQW-QXAKKESOSA-N	427.892	1.877	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2[nH]nc3ncccc23)[C@H]1c1cccnc1	1808116045	BCWHOIWDGYQLIY-UWWQBHOKSA-N	442.907	1.926	50	20	IDGD	
O=C(c1ccc(Cl)nc1)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1	1809967386	FXAHOCHLGIPBOH-UHFFFAOYSA-N	441.724	1.573	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@H]1CCN(C(=O)c2cccc(=O)n2O)[C@@H]1c1cccnc1	1810541226	SSBSHEGVAYXMQD-OXQOHEQNSA-N	444.564	1.652	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)[C@@H]2[C@@H]3C=CS[C@@H]23)[C@H]1c1cccnc1	1812385960	ASNJHUIIZCZBSE-CULFCCOHSA-N	443.573	1.336	50	20	IDGD	
COC(=O)C1(C(=O)N2CC[C@H](CNC(=O)[C@@H](C)Br)[C@@H]2c2cccnc2)CC1	1812868284	XEGPRJNNBWQJLM-YUELXQCFSA-N	438.322	1.824	50	20	IDGD	
COc1ccc([C@H](O)C(=O)Nc2cc([C@H]3CCCCN3C(=O)[C@@H](O)CCl)[nH]n2)cc1	1814632437	HJKSSSAYZHOMRI-RYRKJORJSA-N	436.896	1.744	50	20	IDGD	
Cn1ccc(CC(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@@H](F)Br)CC3)n1	1815550101	SSHOPISKHVLOJA-ISVAXAHUSA-N	430.303	1.722	50	20	IDGD	
COc1cc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)ccn1	1817476528	JBDWYDWXXUMOFM-SFHVURJKSA-N	449.276	1.113	50	20	IDGD	
C[C@@H]1CCC[C@@H]1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2	1818876486	MAMABNWNXHBPEY-KCXAZCMYSA-N	427.335	1.485	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1)c1nc(O)n2c1CCCC2	1819628028	JPESPLKUUSUJHT-JSGCOSHPSA-N	436.900	1.554	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](O)CCl)CC2)c1cc(-n2ccnc2)ccn1	1821683926	ORKZTGSWXGQLKG-XHDPSFHLSA-N	446.920	1.549	50	20	IDGD	
Cc1cccc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2ccc(B(O)O)cc2)CC3)c1	1822134734	QFOFJDZQCOTBAP-QGZVFWFLSA-N	435.314	1.671	50	20	IDGD	
C[C@H](Br)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H]2CCC(=O)NC2)[nH]n1	1822184230	DCOIAPUSQBDEEP-DMDPSCGWSA-N	426.315	1.711	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1cc(F)c[nH]1	1822236447	NNEHSBYQGOEANX-QGZVFWFLSA-N	425.229	1.176	50	20	IDGD	
C[C@H](C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1)n1ccnn1	1823009122	JXWGBTRQUKDSIH-SOCHQFKDSA-N	431.291	1.598	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)C34CC(C(=O)OC)(C3)C4)sc2C1	1825559145	UXIVPWOAPYUSPT-NCBVISDVSA-N	441.937	1.652	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnn3cc(C)cnc13)CC2	1826000073	JZQXKPRSNGRLAO-YPMHNXCESA-N	448.936	1.974	50	20	IDGD	
CCc1cc(C(=O)N[C@@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)n(C)n1	1826088576	YOHVGXSAHUTPMS-CYBMUJFWSA-N	447.565	1.038	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H]3[C@H]4COC[C@H]43)sc2C1	1827377658	FJSZMKCKAVDFTM-ZRDGONRFSA-N	428.352	1.979	50	20	IDGD	
Cc1nnsc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1	1827822196	YEBVUXUTOOSGRE-INIZCTEOSA-N	436.582	1.453	50	20	IDGD	
O=C(c1cc(-c2ccccc2)on1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1829590170	DVWMDJYNEARHPQ-FXAWDEMLSA-N	437.855	1.946	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@]3(C)CC3(F)F)C2)C1	1830545189	HQHPTIMDACNLSK-KCXAZCMYSA-N	439.297	1.519	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(N(C)C)nc3)C2)C1	1831652033	VQAVIDJTNLSQML-UWJYYQICSA-N	438.956	1.625	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3cccc(Cl)n3)CCO2)C1	1833176629	OQPNEZVSDKFOQE-HNAYVOBHSA-N	430.332	1.751	50	20	IDGD	
C[C@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)c3ccn(C)n3)CC2)CC1	1833262513	RMHFWRXWCJJJSO-CQSZACIVSA-N	440.386	1.636	50	20	IDGD	
CC[C@H](NC)C(=O)N1CCC(N2CCC(NC(=O)[C@H](C)CBr)CC2)CC1	1833263166	FGBWPQBIMGCOIK-PBHICJAKSA-N	431.419	1.587	50	20	IDGD	
C#CCO[C@@H](C)C(=O)NC1CCN(C2CCN(C(=O)[C@@](C)(Cl)CCl)CC2)CC1	1833466821	SDNRCOZHFBJVPM-YWZLYKJASA-N	432.392	1.833	50	20	IDGD	
Cc1nn(C)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)c1F	1833702254	PGVOZYHEPXTUBM-IBGZPJMESA-N	430.908	1.203	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ncc(Cl)cn3)CCO2)C1	1833781473	GCYXWGNAIFJYOR-RDTXWAMCSA-N	431.320	1.608	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NC1CCN(C2CCN(C(=O)C(Cl)Cl)CC2)CC1	1834869131	BQFNACFMGQONAW-UHFFFAOYSA-N	445.347	1.385	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)c1cnc2ccoc2c1	1835025040	DQPMWGFXHIDMRA-SFHVURJKSA-N	434.924	1.613	50	20	IDGD	
CN(CC(=O)N1CCC(N2CCC(NC(=O)[C@H](F)Cl)CC2)CC1)C(=O)OC(C)(C)C	1835080081	ICCSNMIZGSPJBB-KRWDZBQOSA-N	448.967	1.959	50	20	IDGD	
Cc1nn(C)c(C)c1CC(=O)N1CCC(N2CCC(NC(=O)[C@H](F)Cl)CC2)CC1	1835083837	WBFBHHYSDUWXSN-IBGZPJMESA-N	427.952	1.685	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCC(N2CCC(NC(=O)c3nc[nH]c3[N+](=O)[O-])CC2)CC1	1835099612	SYYBDEQJBLMKAS-UHFFFAOYSA-N	440.932	1.768	50	20	IDGD	
Cc1ccccc1OCC(=O)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1835155346	NXDHFBVHVOSZGK-IBGZPJMESA-N	431.316	1.634	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1)c1cccnn1	1835895593	DPLVQTQQHWUKHV-OAHLLOKOSA-N	428.306	1.352	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc4ncnn4c3)CCO2)C1	1837164633	LEYWCELGJIPZIX-HXUWFJFHSA-N	435.912	1.064	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cn(C)nc3OC)CC2)CC1	1837377777	CMVMVWGWWZJSNM-QGZVFWFLSA-N	442.944	1.295	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccnc(OC)c3)CCO2)C1	1837973997	NTGIHHCYOBAJDU-UZLBHIALSA-N	425.913	1.568	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3C[C@]3(F)Cl)C2)C1	1839155059	HKRUNHFILPYITQ-IPOQPSJVSA-N	431.719	1.604	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)cnc1C	1839197929	MZGMUVODYLNQKQ-MAUKXSAKSA-N	444.301	1.459	50	20	IDGD	
O=C(CCc1cccnc1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839198680	AHXVYFXHFPKXLS-WMZOPIPTSA-N	444.301	1.161	50	20	IDGD	
C=CC[C@H](C(=C)C)C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](F)Br)CCO2)C1	1839201160	YIYCOTHQRKRGCZ-RVKKMQEKSA-N	433.318	1.902	50	20	IDGD	
N#Cc1cccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)c1	1839201598	BVMJQYNWMQLNLE-CRAIPNDOSA-N	440.269	1.319	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccccn3)C2)C1	1839963162	BOSFHZLDKKYWIR-KDOFPFPSSA-N	426.311	1.325	50	20	IDGD	
Cc1cccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)n1	1840030938	AVHGORJFPNGAKU-KDOFPFPSSA-N	426.311	1.243	50	20	IDGD	
CCc1ncsc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)Br)CCO2	1840034874	ZTJGDWHNHHOAKZ-SJCJKPOMSA-N	446.367	1.559	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc4ccn(C)c34)C2)C1	1840152755	RZROHTDFVNSGHN-PGRDOPGGSA-N	449.935	1.502	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3cccc(O)c3)C2)C1	1840155527	DWUFMDDTUXRGSB-NQIIRXRSSA-N	440.924	1.035	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CC[C@H](O)CC1)CCO2	1840268947	GWKWGZUMURFQSP-YKTARERQSA-N	447.370	1.025	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1ccc3nccnc3c1)C2	1843415971	KCSIGVBBXPHFOU-JFLMPSFJSA-N	445.483	1.581	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)c2ccnc(C)n2)C1	1843551015	OHFUETXNZVLBIM-UHFFFAOYSA-N	439.428	1.749	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)[C@H]1CCCOC1)C2	1844693591	WRPPGWQMPKDLMY-HNNXBMFYSA-N	431.445	1.764	50	20	IDGD	
Cc1nc(C(=O)N2CC3(CCCN3C(=O)CN(C)NC(=O)NCc3ccccc3)C2)co1	1845038598	XIVXRJHWVKFAAY-UHFFFAOYSA-N	440.504	1.146	50	20	IDGD	
CCOC(=O)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)[C@H](Cl)CC)C1	1845168724	WIMMCCFQBPCVQH-KGLIPLIRSA-N	445.944	1.664	50	20	IDGD	
C=C1C[C@@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](O)CCl)N(C(=O)OC(C)(C)C)C1	1847564022	PHDCYDSNVCZGNA-YHUYYLMFSA-N	427.929	1.354	50	20	IDGD	
C[C@H](Oc1ccc(Cl)cc1)C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	16593987	MZZIDBKTCWZXPZ-LBPRGKRZSA-N	425.894	1.819	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)c2nnn(-c3cccc([N+](=O)[O-])c3)c2C)cc1OC	24489806	FBCNHIAMTRIXLO-UHFFFAOYSA-N	440.416	1.966	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)c1	27149300	OXVBIXXOLRWOOM-UHFFFAOYSA-N	429.414	1.259	50	20	IDGD	
COc1ccc(CCNC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1OC(F)F	726270718	YBGWNRRTQCHCKC-UHFFFAOYSA-N	447.402	1.459	50	20	IDGD	
O=C(NNC(=S)Nc1ccc2c(c1)OCCCO2)c1csc(N2CCOCC2)n1	727270611	KAYJWSYAPQZCNS-UHFFFAOYSA-N	435.531	1.772	50	20	IDGD	
CN(C)N(C(=O)Cn1cnc2sc(-c3ccccc3)cc2c1=O)[C@@H]1CCS(=O)(=O)C1	728177619	FZRDVKVNCKTOBF-OAHLLOKOSA-N	446.554	1.617	50	20	IDGD	
CN(C)c1cccc(C(=O)NNC(=O)[C@@H]2C[C@@H](O)CN2C(=O)OCc2ccccc2)c1	729509655	YWOLIOILBZVBDE-MOPGFXCFSA-N	426.473	1.286	50	20	IDGD	
O=C(NNC(=O)c1cccc2ncccc12)c1ccc(F)c(S(=O)(=O)NC2CC2)c1	730226149	GBZCWDKVUYURJM-UHFFFAOYSA-N	428.445	1.889	50	20	IDGD	
O=C(CSc1nnc(O)nc1O)NN=Cc1cn(-c2ccccc2)nc1-c1ccncc1	730558856	UHGWPSNEQICCFS-UHFFFAOYSA-N	448.468	1.773	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@@H]2CCCN(C(=O)c3ccccc3)C2)c2ccccc2c1=O	731186470	PGOHDEMOZXJSFM-QGZVFWFLSA-N	447.495	1.730	50	20	IDGD	
CC1CCC(N2C[C@H](C(=O)NNc3ccc(S(=O)(=O)NC4CC4)cc3)CC2=O)CC1	731344096	PGWSFEAWRNIECG-SWKXRBFHSA-N	434.562	1.998	50	20	IDGD	
O=C(NNC(=O)c1cnn2ccccc12)c1cccc(S(=O)(=O)N2CCCCC2)c1	732258409	NKNRRRRFSYBLCH-UHFFFAOYSA-N	427.486	1.584	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)N[C@H](Cc1ccccc1)CN1CCOCC1	732476313	DFTOSNFHQHAHSP-YLJYHZDGSA-N	444.507	1.867	50	20	IDGD	
CS(=O)(=O)N(CC(F)(F)F)C1CCN(C(=O)NNC(=O)c2cccc(C#N)c2)CC1	732995689	QLXCWOXXBKOGJQ-UHFFFAOYSA-N	447.439	1.201	50	20	IDGD	
C#CCNC(=O)CN1CCCN(C(=O)/C(C#N)=C/c2cc(C)n([C@@H](C)COC)c2C)CC1	733150505	LMCVYJSOZQSPQH-KWJZBXMYSA-N	439.560	1.503	50	20	IDGD	
CCOCCCn1c(NNC(=O)c2ccccc2-n2cnnn2)nc2ccccc2c1=O	733266317	UNNZILDYEPUWKP-UHFFFAOYSA-N	434.460	1.556	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc2nc(O)cc(C(=O)NNc3cc(C)ncn3)c2c1	734255165	HVLLGUBQNYNLAC-UHFFFAOYSA-N	430.490	1.826	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)NCc2cc(S(N)(=O)=O)ccc2F)c1C	734674524	XLMMWNUFQKISGS-CYBMUJFWSA-N	438.481	1.388	50	20	IDGD	
NS(=O)(=O)c1ccc(F)c(CNC(=O)NNC(=O)c2ccc(Cl)cc2Cl)c1	734675362	GCLMLSSHPMMJGO-UHFFFAOYSA-N	435.264	1.924	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)COc2ccc(Cl)cc2)CC1	735117607	ZDAVPKUQNYUXCL-UHFFFAOYSA-N	439.925	1.193	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)c3cn(CC(N)=O)nn3)c3ccccc3n2)cc1	742469486	CTCXWDXDGBJKJR-UHFFFAOYSA-N	429.440	1.362	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCc2c[nH]nc2C1)c1nn(Cc2ccccc2)c(=O)c2ccccc12	742473389	CYHDMOPDLCPJKQ-INIZCTEOSA-N	442.479	1.734	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)N[C@@H]1CC(=O)N(CCOc2ccccc2)C1	743509885	MQBBBNXCNIDRGS-MRXNPFEDSA-N	442.472	1.084	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NCc2cccc(N3CCCC3=O)c2)cc1	743537634	RSXPXEFWKSXVGY-UHFFFAOYSA-N	445.501	1.753	50	20	IDGD	
CCNS(=O)(=O)c1ccc2c(c1)N(CC(=O)NNC(=O)c1ccccc1Cl)CC2	744405887	ZBZVHMOPRPRHLZ-UHFFFAOYSA-N	436.921	1.462	50	20	IDGD	
CNS(=O)(=O)c1ccc(Cl)c(C(=O)OCC(=O)NNC(=O)c2cccc(C)c2)c1	744555340	WZVILAKWVCFNRL-UHFFFAOYSA-N	439.877	1.175	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)N[C@@H]2CCCN(c3ccn(C)n3)C2=O)c1	745884628	ZJXVFNALYQQFFO-QGZVFWFLSA-N	442.520	1.757	50	20	IDGD	
CSc1ccc(F)cc1CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	745928589	RPXGEHIYAXIDPA-UHFFFAOYSA-N	440.522	1.942	50	20	IDGD	
CC(C)C[C@H](C(=O)NNC(=O)Cc1cn2ccccc2n1)N1C(=O)[C@H]2CC=CC[C@@H]2C1=O	746553092	GBHMVCXDHSFTIU-OKZBNKHCSA-N	437.500	1.390	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)c1cnn(CC(=O)NC2CCCCC2)c1	746578542	XBSNEAUYZQALLE-CQSZACIVSA-N	431.468	1.700	50	20	IDGD	
COC(=O)NNS(=O)(=O)c1c(Br)cc(C(=O)O)cc1Br	747595201	KATHOESYFYMIRQ-UHFFFAOYSA-N	432.046	1.459	50	20	IDGD	
Cc1nc(S(=O)(=O)NCCC(=O)NNc2ccc(F)cc2Br)cn1C	748073753	XOXBLWVOFHQQBG-UHFFFAOYSA-N	434.291	1.442	50	20	IDGD	
COCCNS(=O)(=O)c1c[nH]c(C(=O)NNc2ccc(Br)cc2F)c1	748191624	PWKJPNCTRMNYGR-UHFFFAOYSA-N	435.275	1.598	50	20	IDGD	
CC[C@H](NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)c1nnc2n1CCCCC2	749579866	QFCZTVBPYXZPPK-HNNXBMFYSA-N	438.492	1.347	50	20	IDGD	
C[C@@H]1C[C@H](CNC(=O)OC(C)(C)C)CN1C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	752126319	GTZPMMBGRKNTRZ-ZIAGYGMSSA-N	444.496	1.252	50	20	IDGD	
CCn1c(=O)c(C(=O)/C(C#N)=C\c2c[nH]c(C(=O)OC)c2)c(N)n(Cc2ccccc2)c1=O	753133350	OZSHQNCXNCVTOP-SXGWCWSVSA-N	447.451	1.565	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)N[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1	754136960	WYRDPICPDROBJA-SJLPKXTDSA-N	425.424	1.666	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)c2cc(OC)c(S(N)(=O)=O)s2)cc1F	754200118	OCGJHKDITKQVDA-UHFFFAOYSA-N	434.496	1.183	50	20	IDGD	
CNS(=O)(=O)c1cc(NC(=O)COC(=O)/C(C#N)=C\c2ccc(O)cc2)ccc1C	754539055	FYHXYHJDYCYTHN-DHDCSXOGSA-N	429.454	1.698	50	20	IDGD	
COCCOCCS(=O)(=O)NNC(=O)c1cc2c(C)nn(-c3ccccc3)c2s1	754741752	ROWWKCCGJKYGNK-UHFFFAOYSA-N	438.531	1.623	50	20	IDGD	
COC[C@@H](C)n1c(SCC(=O)NNC(=O)Cc2cc[nH]n2)nnc1-c1ccccc1	755285856	WQPYGNWJWZCJHS-CYBMUJFWSA-N	429.506	1.358	50	20	IDGD	
Cc1c(NC(=O)NNC(=O)c2nnc(O)c3ccccc23)c(=O)n(-c2ccccc2)n1C	755322021	YWMIDELSJLLITK-UHFFFAOYSA-N	433.428	1.600	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2O1)Nc1ccc(S(=O)(=O)C(F)F)cc1	755443113	CYQPGIGOHYBLJR-CQSZACIVSA-N	427.385	1.676	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)Nc1ncc(Cc2ccc(F)c(F)c2)s1	755477624	LNVJTWRTMXDVQG-JTQLQIEISA-N	430.458	1.600	50	20	IDGD	
CN1CCN(c2ncc(C=NNC(=O)COc3ccc(Br)cc3)cn2)CC1	755511231	OQUFNCYVUNHFDC-UHFFFAOYSA-N	433.310	1.520	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)Nc2ccc(CC(=O)N3CCSCC3)cc2)n1	756279425	DETSQKHYYIDGND-UHFFFAOYSA-N	430.534	1.471	50	20	IDGD	
Cc1c(CS(C)(=O)=O)cccc1NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1	756597743	OVWYWVJBSAQXNY-UHFFFAOYSA-N	446.533	1.399	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2cccnc2OCC(F)F)c1	757817440	GNGDELPRDFGMGN-UHFFFAOYSA-N	443.432	1.442	50	20	IDGD	
CCOCCS(=O)(=O)NCC(=O)NNc1ccc(Br)cc1C(F)(F)F	758222262	USHXRVZNRCWLDV-UHFFFAOYSA-N	448.261	1.867	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)N(C)CC(=O)NNc2nc(O)c3ccccc3n2)cc1	758307162	CNBDAMYKQIDHTA-UHFFFAOYSA-N	444.473	1.058	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)NNC(=O)C(=O)Nc2ccccn2)c(C)n1C[C@H]1CCCO1	758822275	PDFFMZPJNLHQKR-ZKTNYTPDSA-N	436.472	1.372	50	20	IDGD	
C[C@H](c1ccccc1)[C@](C)(O)C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	759555579	HGKGCRMVFVVESO-GHNFSYLKSA-N	428.441	1.072	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)c2ccc(S(=O)(=O)Nc3nccs3)cc2)nc1	759730313	RFMWOWFEROXBDJ-UHFFFAOYSA-N	433.471	1.882	50	20	IDGD	
COc1ccc(C(=O)N([C@@H]2CCS(=O)(=O)C2)N(C)C)c(I)c1	760318854	UMBYPKPSSRONRH-SNVBAGLBSA-N	438.287	1.406	50	20	IDGD	
COc1cc(Br)cc(S(=O)(=O)NNC(=O)c2ccc3c(c2)OCCO3)c1	760508593	DOGDLOGSBDYDMP-UHFFFAOYSA-N	443.275	1.852	50	20	IDGD	
O=C(COCc1ccccc1)NNS(=O)(=O)c1ccc(C(=O)N2CCCC2)c(F)c1	763431312	KIEVGOPFIJWHCA-UHFFFAOYSA-N	435.477	1.588	50	20	IDGD	
CNC(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)c2ccc(OC)c(OC)c2)c1	763544380	XBTAZZBHLODIPL-UHFFFAOYSA-N	434.836	1.117	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)c(OC)c1OC	763601651	SMBPKCKLNJJOPH-UHFFFAOYSA-N	439.428	1.502	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1c(F)cccc1-n1cccn1	763657979	SVRBFBKXLJKMPC-UHFFFAOYSA-N	427.392	1.185	50	20	IDGD	
Cn1ncc(NC(=O)C(=O)NNC(=O)COc2ccc(Br)cc2)c1C(F)F	763692350	ACSHPQIVBXKTKD-UHFFFAOYSA-N	446.208	1.285	50	20	IDGD	
C=CCNC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCC3)cc1	763785842	UBGMIWBHTJEJJK-UHFFFAOYSA-N	427.486	1.944	50	20	IDGD	
Cc1nc(C)n(-c2ccccc2NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)n1	763839285	IXPDQYPVBKZJPB-UHFFFAOYSA-N	426.408	1.188	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cccc(-c3nnco3)c2)ccc1OC(C)C	763916893	XFQKREAUHRPJTB-UHFFFAOYSA-N	439.428	1.932	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)C(=O)Nc1cccc(NC(=O)C2CC2)c1	763950933	WZHNBPHKFYDQNO-UHFFFAOYSA-N	448.439	1.326	50	20	IDGD	
CCN(CC)C(=O)Cn1ccc2cc(NC(=O)C(=O)NNC(=O)c3cccn3C)ccc21	763992800	JAWPAUCZNDLMTK-UHFFFAOYSA-N	438.488	1.248	50	20	IDGD	
COC(=O)COc1cccc(NC(=O)C(=O)NNC(=O)Cc2cccc3ccccc23)c1	764020399	XAJDDHZYPFYZMP-UHFFFAOYSA-N	435.436	1.720	50	20	IDGD	
O=C(Cc1ccsc1)NNC(=O)C(=O)Nc1ccc(NC(=O)NC[C@@H]2CCCO2)cc1	764035741	RVDJFLLJPODWRG-INIZCTEOSA-N	445.501	1.377	50	20	IDGD	
Cn1cc(Br)cc(NC(=O)C(=O)NNC(=O)CCCc2ccccc2)c1=O	764225201	ZNDQTTLAVFJXRT-UHFFFAOYSA-N	435.278	1.257	50	20	IDGD	
Cn1ccnc1C(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cccc3ncccc23)cc1	764253768	WKUOZAVCSCFBSB-UHFFFAOYSA-N	442.435	1.599	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cc(F)ccc2Br)nn1CCC#N	764271118	VMUXEZSAIRUIPC-UHFFFAOYSA-N	437.229	1.407	50	20	IDGD	
CCn1nc(NC(=O)C(=O)NNC(=O)c2cc(Br)ccc2O)cc1C1CC1	764276309	BYLLKYZYLUULRG-UHFFFAOYSA-N	436.266	1.648	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)C(=O)Nc1cccnc1OCC(F)F	764343416	QARCNBIJHKCMLN-UHFFFAOYSA-N	430.371	1.311	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)C(=O)Nc1ccc(OCc2ccncc2)cc1	764366347	AGJXKRZHSVIYSD-UHFFFAOYSA-N	434.452	1.963	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCc2cnn(CC(F)(F)F)c2)c2ccccc2c1=O	764375776	RTVZTGGTJUWDKN-UHFFFAOYSA-N	437.382	1.319	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3OC)[nH]n2)cc(OC)c1	764378360	YRWBKPGZXSXRIO-UHFFFAOYSA-N	439.428	1.502	50	20	IDGD	
CC(=NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1)c1nnn(-c2ccccc2)c1C	764830608	NHWGQXHCVBSRCE-UHFFFAOYSA-N	445.527	1.874	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ncncc2Cl)c(I)c1	765697656	IJPGOSIMYCUUIC-UHFFFAOYSA-N	447.620	1.825	50	20	IDGD	
CC(C)(Oc1ccc(C#N)cc1)C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	765727792	ISEFTJLJXHHOEG-UHFFFAOYSA-N	444.513	1.880	50	20	IDGD	
CC(C)(C)OC(=O)NCc1cc(C(=O)NNC(=O)COc2ccc(C#N)cc2)ccn1	766133517	ITHQCUNEIGCPQE-UHFFFAOYSA-N	425.445	1.818	50	20	IDGD	
Cc1c(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)nnn1Cc1ccc(F)cc1	766602751	BMIQXNXXKPDQEL-UHFFFAOYSA-N	438.467	1.242	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1cc(F)c(F)c(F)c1F	766644338	UUOOELCHHHVUEN-UHFFFAOYSA-N	438.381	1.462	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3ccc(-n4ccnc4)cc3)CC2)cc1	766648066	IFNLUSAUWPZOPK-UHFFFAOYSA-N	432.528	1.760	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3c(Cl)nc4ccccn34)CC2)cc1	766649065	MQFIKTQURICEPO-UHFFFAOYSA-N	440.935	1.875	50	20	IDGD	
CC(C)Oc1ccc(NS(=O)(=O)CC(=O)NNc2ccccc2S(C)(=O)=O)cc1	766662097	JOLXCSWUZKQGSK-UHFFFAOYSA-N	441.531	1.762	50	20	IDGD	
CC(C)(C)OC(=O)NCc1cc(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)ccn1	766968786	HYZVIMARHCWCAS-UHFFFAOYSA-N	438.448	1.157	50	20	IDGD	
Cc1cc(S(=O)(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)ccc1C#N	767529698	MPHHOOPAOKIBST-UHFFFAOYSA-N	437.522	1.665	50	20	IDGD	
O=S(=O)(/C=C\c1ccccc1Cl)N1CCN(S(=O)(=O)CBr)CC1	767850448	KHDDELAGTVDAPM-YHYXMXQVSA-N	443.772	1.940	50	20	IDGD	
Cc1cccc(NS(=O)(=O)c2ccc(Cl)c(C(=O)NNC(=O)C(C)(C)O)c2)c1	768247332	LYSGQWGEJHOBRF-UHFFFAOYSA-N	425.894	1.981	50	20	IDGD	
CN(C)c1ccc(NC(=S)NNC(=O)CN2C(=O)N[C@@]3(CCCC(C)(C)C3)C2=O)cc1	768570829	NBIFQQBTKBZGOH-OAQYLSRUSA-N	446.577	1.961	50	20	IDGD	
Nc1ccc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c(C(F)(F)F)c1	770064034	IEEASYYDHWZBDA-OAHLLOKOSA-N	439.346	1.432	50	20	IDGD	
CSc1nnc(CCCNC(=O)NNc2nc(O)c3cnn(C)c3n2)n1C1CCCC1	770378541	WRVBRYSNRPTTQF-UHFFFAOYSA-N	446.541	1.756	50	20	IDGD	
CCC1(CC)[C@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)[C@@H](C)[C@H]1OC	771433669	IOEQXFASSMNANS-KBRIMQKVSA-N	440.566	1.721	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)CN1C(=O)c2ccccc2N2C(=O)CC[C@@]12C	771986163	VFFBGAYSOILUJQ-FPTDNZKUSA-N	444.488	1.111	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1cccc(NC(=O)[C@@H]2Cc3ccccc3O2)c1	772025710	RKFHUQZSSISNLS-ACJLOTCBSA-N	425.441	1.732	50	20	IDGD	
CCC1(O)CCC(NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)CC1	772592542	CEEAMHVPUTYKRS-UHFFFAOYSA-N	438.550	1.499	50	20	IDGD	
C[C@H]1Oc2c(cccc2C(=O)NNC(=O)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)NC1=O	773412034	TTXSWDCAVKCEAA-CHWSQXEVSA-N	432.477	1.814	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)CCNC(=O)OCC(F)(F)F)C1	773420020	WJFIPARWYJHREM-NSHDSACASA-N	440.419	1.460	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)c2ccc(CS(C)(=O)=O)o2)C1	773422294	WBYWBVZCIHRYLA-LBPRGKRZSA-N	429.495	1.232	50	20	IDGD	
O=C(NNc1ccc(C(F)(F)F)cn1)C(=O)Nc1ccccc1C(=O)N1CCOCC1	773669483	MYDJAIMBRCKFOW-UHFFFAOYSA-N	437.378	1.655	50	20	IDGD	
N#Cc1cccc(NNC(=O)C(=O)Nc2ccccc2S(=O)(=O)N2CCCCC2)c1	773686329	UQUZRQATNZEJPO-UHFFFAOYSA-N	427.486	1.815	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)cc1F	774010025	UKKXCGPFXGMVDV-SNVBAGLBSA-N	437.811	1.819	50	20	IDGD	
CCNS(=O)(=O)c1ccccc1S(=O)(=O)NNC(=O)CCCc1ccccc1	777623064	DZNZLAMROYCNFY-UHFFFAOYSA-N	425.532	1.317	50	20	IDGD	
N#Cc1c(F)cccc1C(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	777813478	QXDTXPQZCPXAKA-UHFFFAOYSA-N	429.883	1.930	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Cn2cc(-c3cccc([N+](=O)[O-])c3)cn2)cc1OC	777936650	VXSJFXGSUWMQNO-UHFFFAOYSA-N	425.401	1.937	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)[C@H]1CCN(Cc2ccccc2)C1	778806104	KWPVSIMNZYYMLP-APWZRJJASA-N	444.557	1.945	50	20	IDGD	
CC(C)(C)OC(=O)NCc1ccc(NC(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)cc1	779503587	SFUPWUVXPKAQQG-ZDUSSCGKSA-N	426.495	1.299	50	20	IDGD	
Cc1cc(N2C[C@@H](C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)CC2=O)ccc1F	779914975	JVLLSIPUVPBENG-ZDUSSCGKSA-N	437.472	1.342	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)c2coc(CNC(=O)OC(C)(C)C)c2)c2ccccc2c1=O	780171296	KGTWVTXTKGGOHX-UHFFFAOYSA-N	441.444	1.626	50	20	IDGD	
C[C@H]1CN(Cc2ccccc2NC(=O)C(=O)NNC(=O)c2ccc(O)cc2)C[C@@H](C)O1	782833038	XHDNAQVRZBYWCZ-GASCZTMLSA-N	426.473	1.401	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2cc(C(=O)N3CCSCC3)ccc2C)nc(C)n1	783325852	PVERCUMQZXAPEC-UHFFFAOYSA-N	428.518	1.673	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)C(=O)Nc1ccc(Cl)c(C(F)(F)F)c1	784001887	FVBOCCNTKSFDII-UHFFFAOYSA-N	432.742	1.468	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)C(=O)Nc1cc(F)c(N2CCCCC2)c(F)c1	784005031	XFZAYTXJKBCEDV-UHFFFAOYSA-N	449.414	1.064	50	20	IDGD	
Cc1cc(C(=O)N2CCOCC2)ccc1NC(=O)C(=O)NNc1cccc([N+](=O)[O-])c1C	784354476	LEIWHVQSQVZHSI-UHFFFAOYSA-N	441.444	1.766	50	20	IDGD	
O=C(NNc1ccc(Cl)nn1)C(=O)Nc1cccc(S(=O)(=O)N2CCCCC2)c1	784791965	CUGRWDRMJGBCOI-UHFFFAOYSA-N	438.897	1.386	50	20	IDGD	
Cc1nnnn1-c1cccc(NC(=O)C(=O)NNc2ccc(F)cc2Br)c1	784803571	OXFSGXNVIZMYLA-UHFFFAOYSA-N	434.229	1.954	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNc2cccc([N+](=O)[O-])c2)cccc1S(=O)(=O)NC1CC1	784828036	DPZIMMFGHUILOO-UHFFFAOYSA-N	433.446	1.426	50	20	IDGD	
CC[C@H](C)NS(=O)(=O)c1cccc(NC(=O)C(=O)NNc2cccnc2Cl)c1	784838808	DTXRKQXXOOGFRI-NSHDSACASA-N	425.898	1.894	50	20	IDGD	
CN(C)c1nccc(NNC(=O)C(=O)Nc2ccc(OCCN3CCCCC3)cc2)n1	784971020	QIGUSVGUJJHPHA-UHFFFAOYSA-N	427.509	1.489	50	20	IDGD	
Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)C(=O)NNc1nccn(C)c1=O	785087194	XPHLVRXOWCWFHU-UHFFFAOYSA-N	432.440	1.621	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)[C@]3(O)CCc4ccccc4C3)n[nH]2)cc1OC	786481393	CNIKCZJAFBKMFW-QHCPKHFHSA-N	436.468	1.775	50	20	IDGD	
COc1ccc(OC)c([C@H]2C[C@@H]2C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1	788085909	FKMHYHKHYRMARK-AEFFLSMTSA-N	447.513	1.519	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c(OCCOC(C)C)c1	789734395	BWBCPFUNDDJXGW-UHFFFAOYSA-N	440.460	1.550	50	20	IDGD	
CSSCCNC(=O)N1CCN(S(=O)(=O)c2ccc3c(c2)NC(=O)CO3)CC1	790878754	KMDJSUYIYONYAO-UHFFFAOYSA-N	446.576	1.045	50	20	IDGD	
CCS(=O)(=O)c1ccc([C@H](C)NC(=O)NNC(=O)Cc2cn3ccccc3n2)cc1	790986966	VLKBYWMINZIUIP-AWEZNQCLSA-N	429.502	1.762	50	20	IDGD	
CC(C)(C)OC(=O)N1CCN(CCC(=O)NNC(=O)c2nnc(O)c3ccccc23)CC1	792016033	JUQSCZDSNGWTIZ-UHFFFAOYSA-N	444.492	1.039	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1ccnn1-c1ccccc1	792238721	WNPTWHKYDQJZBK-UHFFFAOYSA-N	432.484	1.091	50	20	IDGD	
CCNC(=O)N(C)NC(=O)C(=O)Nc1ccc2c(c1F)CCN(C(=O)OC(C)(C)C)C2	793050539	XSVSJYOWFWUXBX-UHFFFAOYSA-N	437.472	1.750	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C2CCN(S(=O)(=O)/C=C/c3ccccc3)CC2)n1	794080274	JGCUOXNLDUMRSF-NTCAYCPXSA-N	428.514	1.864	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)CNC(=O)NCc1ccc(Cl)cc1	795160668	ICQRTONHVFYPAY-UHFFFAOYSA-N	439.925	1.533	50	20	IDGD	
CCOC(=O)c1cc(S(=O)(=O)NNC(=O)c2cc(Br)c[nH]2)ccc1C	795291538	XIDCNXDPZRNEJZ-UHFFFAOYSA-N	430.280	1.886	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)[C@H](C)N(C)CC(F)(F)F	796293521	KXCZIPYKAWSFJH-VIFPVBQESA-N	425.791	1.535	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)COc2ccc(C)cc2)c(OC)c(C)c1OC	796990214	OXQKCBYSKBYRJA-UHFFFAOYSA-N	431.445	1.494	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2cc(OC)c(OC)c(C)c2OC)n1	797105005	TXOIXCMAUGTAAS-UHFFFAOYSA-N	432.481	1.739	50	20	IDGD	
O=C(NCC(F)(F)F)NNC(=O)[C@@H]1CCCN1C(=O)Nc1ccc2c(c1)OCCO2	798315297	FAKLWEAWQCSXPQ-NSHDSACASA-N	431.371	1.347	50	20	IDGD	
COC(=O)c1ccc(S(=O)(=O)NNC(=O)CSc2ccccc2O)cc1OC	798446783	CNRQGGSTPPNYKP-UHFFFAOYSA-N	426.472	1.289	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N2CCN(c3nccnc3C)CC2)cc1Br	799373036	ZLGFDWZIDCKPSH-UHFFFAOYSA-N	449.309	1.733	50	20	IDGD	
CSC[C@@H](C)C(=O)N1CCC(C(=O)OCC(=O)NNC(=O)c2cccs2)CC1	799540851	QMAQCCTZOQBURI-GFCCVEGCSA-N	427.548	1.290	50	20	IDGD	
Cc1c(C(=O)NNc2ccccc2S(C)(=O)=O)nnn1CCOc1ccc(F)cc1	800516493	FGHSCSVHDYONGK-UHFFFAOYSA-N	433.465	1.965	50	20	IDGD	
CNS(=O)(=O)c1cc(NC(=O)NNC(=O)c2cnn(-c3ccccc3)c2)ccc1F	806544755	DJDKEJMWZKKZRB-UHFFFAOYSA-N	432.437	1.386	50	20	IDGD	
COC(=O)c1cc(C)c(NC(=O)C(=O)NNC(=O)c2ccc(OC)c(OC)c2)c(Cl)c1	806972769	KWLCVCXIQGYCOM-UHFFFAOYSA-N	449.847	1.852	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(NC(=O)C(=O)NNc2ccc(C(F)(F)F)cn2)ccc1F	806984628	NGISAXLLZXJXRX-UHFFFAOYSA-N	449.386	1.572	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)[C@H]1CCCCN1S(=O)(=O)c1cccs1	807372095	ZYYCIXDQEHSLCA-CYBMUJFWSA-N	433.552	1.228	50	20	IDGD	
O=C(COC(=O)[C@@H]1C[C@@H](c2ccccc2)OC1=O)NNC(=O)c1cccc([N+](=O)[O-])c1	808588028	HYBSFMZRHPRYSL-HOTGVXAUSA-N	427.369	1.203	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)cc2[nH]ccc12	808935164	LGTVLFMOYPAYEW-UHFFFAOYSA-N	430.804	1.713	50	20	IDGD	
CNC(=O)c1cc(Oc2ccc(NC(=O)C(=O)NNc3ccc(C)nn3)cc2F)ccn1	810394201	PKYFNYWDTIYEJK-UHFFFAOYSA-N	439.407	1.553	50	20	IDGD	
COC[C@@]1(CNC(=O)NNC(=O)[C@H]2COc3ccccc3O2)OCCc2ccccc21	811922123	LRDATLZCRXMBGO-DENIHFKCSA-N	427.457	1.271	50	20	IDGD	
Cc1cnc(Br)c(NC(=O)C(=O)NNC(=O)COc2ccccc2C#N)c1	812978742	BMNSTGTUCMTWNM-UHFFFAOYSA-N	432.234	1.189	50	20	IDGD	
CCCOc1cc(F)ccc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1	813033856	OGIKBKPAWCVKMY-UHFFFAOYSA-N	438.481	1.947	50	20	IDGD	
Cc1c(S(=O)(=O)NC(=O)/C(C#N)=C\c2cn(CCC#N)nc2-c2ccccc2)cnn1C	813954274	RRAJHHPJIKHOEU-BOPFTXTBSA-N	449.496	1.918	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NN=Cc1cccc(C(=O)O)c1	814711017	VZCMBMYVLOLSPA-UHFFFAOYSA-N	445.497	1.489	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccccn2)cc1S(=O)(=O)C1CCCC1	815569112	HYWMJMVEUPIRTD-UHFFFAOYSA-N	444.513	1.435	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCc2nncn2C1)C(=O)Nc1cccc(Cl)c1SC(F)F	815693075	KXDSWHXITYPVLG-MRVPVSSYSA-N	444.851	1.595	50	20	IDGD	
CCOC(=O)c1ccc(C(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)nc1	816087506	AVGKIBWLQYFWNF-UHFFFAOYSA-N	435.481	1.508	50	20	IDGD	
Cn1c(NNC(=O)c2cccc(S(=O)(=O)NC[C@@H]3CCCO3)c2)nc2ccccc21	816580106	SDSHAWQSRPPPJD-HNNXBMFYSA-N	429.502	1.788	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)CCc2nc(-c3nc[nH]n3)no2)c1	816716835	DJYCZNHCFOPQOG-UHFFFAOYSA-N	436.226	1.480	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)Cc2c(C)[nH]c3ccnn3c2=O)c1	816718042	AQSTWTCVAHTRCC-UHFFFAOYSA-N	434.250	1.566	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)CN2C(=O)N[C@](C)(c3ccc(F)cc3)C2=O)cc1C	818485682	ZZXXIRRHAUKBFG-JOCHJYFZSA-N	442.447	1.436	50	20	IDGD	
CCOC(=O)c1c[nH]nc1S(=O)(=O)NNC(=O)[C@@H](C)Oc1ccc2ccccc2c1	818787347	CCRMGEYZLPXCIC-GFCCVEGCSA-N	432.458	1.517	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)c2nnn(-c3cccc([N+](=O)[O-])c3)c2C)c1	818897834	CCGRQPFESZWZNU-UHFFFAOYSA-N	425.405	1.366	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2cccc(Nc3ncccn3)c2)ccc1Cl	914460538	BLHHOQVWBVMYTF-UHFFFAOYSA-N	446.876	1.596	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)NC1CCN(C(=O)c2ccco2)CC1	914543151	KVCAORHFQZEYFR-UHFFFAOYSA-N	438.444	1.420	50	20	IDGD	
CC(C)NS(=O)(=O)c1cc(C(=O)NNC(=O)COc2ccc(C#N)cc2)ccc1F	914748990	SFQQIBXHKYXWKS-UHFFFAOYSA-N	434.449	1.224	50	20	IDGD	
CS(=O)(=O)CC[C@@H](NC(=O)c1ccc(Cl)cc1)C(=O)NNC(=O)C1CCCC1	914849323	VXSGLJPCMKXPQK-OAHLLOKOSA-N	429.926	1.211	50	20	IDGD	
CCOC(=O)c1ccc(C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)nc1C	914881652	JANLHNJEZGTASI-UHFFFAOYSA-N	433.490	1.243	50	20	IDGD	
CC(C)CC[C@H](C)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	915885836	LZXOIFYJXIXMMC-HNNXBMFYSA-N	426.539	1.476	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NCCCc3ccccc3)nc2)CC1	915885841	MAEJMBSFZRFDHE-UHFFFAOYSA-N	432.550	1.277	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)NCc1ccc(CN2CCN(C)CC2)cc1	916387942	MYZAEENXVOFFQA-UHFFFAOYSA-N	441.532	1.352	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)NCc1ccnc(-n2cccn2)c1	916394189	GHAGIFFJLROBGC-UHFFFAOYSA-N	448.531	1.310	50	20	IDGD	
CCCNC(=O)c1cccc(CNC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])c1	916478243	BSQOWBUTBRQLLG-UHFFFAOYSA-N	429.433	1.644	50	20	IDGD	
C[C@H](SCc1ccccc1)C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	917284097	DIUDZIQCODLZKT-KSSFIOAISA-N	430.482	1.839	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)c2ccc(NS(=O)(=O)c3cccs3)cc2O)n1	917391843	JCWASSSVGOJXAM-UHFFFAOYSA-N	449.514	1.529	50	20	IDGD	
COC(=O)c1ccc(S(=O)(=O)NNC(=O)c2ccc(Cl)cc2O)c([N+](=O)[O-])c1	917758163	RJOMWMKXXLVKEI-UHFFFAOYSA-N	429.794	1.364	50	20	IDGD	
O=C(COc1ccccc1CNC(=O)NNC(=O)c1ccccc1O)NC[C@H]1CCCO1	918217526	JHERHOLXASEKDX-MRXNPFEDSA-N	442.472	1.210	50	20	IDGD	
O=C(CN1CCCC1=O)NNC(=O)[C@H]1CC(=O)N(c2ccc3c(c2)Cc2ccccc2-3)C1	920432915	JRTHOVIBSGIXEP-KRWDZBQOSA-N	432.480	1.381	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)[C@H](Cc2ccccc2)NC(=O)c2cccnc2)c1	921302260	YEYCMOMMXODGJJ-NRFANRHFSA-N	448.479	1.901	50	20	IDGD	
CN1C(=C(C#N)C(=O)COC(=O)CN2C(=O)[C@@H]3[C@@H](C2=O)[C@H]2C=C[C@H]3C2)N(C)c2ccccc21	922223166	WGHQPTUZLKWYJQ-FJAKRLOMSA-N	446.463	1.227	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)NCc1cccc(CN2CCN(C)CC2)c1	1115977543	JIAYQTRZPCTBSN-QGZVFWFLSA-N	443.523	1.871	50	20	IDGD	
CN1C(=C(C#N)C(=O)COC(=O)[C@@H]2CC23CCS(=O)(=O)CC3)N(C)c2ccccc21	1116826964	YPPCMZFQQGAJLB-HNNXBMFYSA-N	429.498	1.635	50	20	IDGD	
O=C(NNC(=O)[C@@H](O)[C@H](O)c1nc2ccccc2s1)c1ccc(Br)cc1	1320031268	OTVPOWSWNMPWCL-KBPBESRZSA-N	436.287	1.914	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)c2cccc(NS(C)(=O)=O)c2)CC1	1321905701	OYEKLUFWDZUQPC-UHFFFAOYSA-N	440.522	1.466	50	20	IDGD	
CCCN1C(=O)c2ccccc2N2C(=O)CC[C@]12C(=O)NNc1nncc(N)c1Cl	1330398965	SXKWXLMMZKUIFO-IBGZPJMESA-N	429.868	1.544	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cn4ncccc4n3)C2)C1	1777953662	QQDIFNIHCOHEMU-ZWKOTPCHSA-N	426.304	1.409	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc4ncccn4n3)C2)C1	1778462111	XTBNABHNPMKFBR-FZKQIMNGSA-N	436.310	1.204	50	20	IDGD	
COc1nc(C)ccc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2	1779847276	MUPQXEYRENSATQ-RZQQEMMASA-N	425.913	1.126	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnc(OCF)cn1)C2	1780703370	OPNLWWBVBFFZNW-ZXYWRSMDSA-N	428.892	1.927	50	20	IDGD	
CN1N=C(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@](C)(Cl)CCl)C2)CCC1=O	1780706283	HZYYDMDGNNEKQS-MDASCCDHSA-N	447.363	1.345	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@](C)(Cl)CCl)C2)nn1	1780715410	RSSGWTDBWXNVPU-NIKGAXFTSA-N	445.347	1.849	50	20	IDGD	
Cc1cccc(/C=C/C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](F)Br)C3)C2)n1	1781325054	IIJRYTXVSPTXFS-MMUANNJHSA-N	426.286	1.924	50	20	IDGD	
O=C(c1ccc2[nH]ccc2n1)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781332139	UJUPAXAGBTXZGT-YOEHRIQHSA-N	425.258	1.697	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ncnn1C)C2	1781901568	QTASDVXDYSCGKJ-OGHNNQOOSA-N	428.331	1.116	50	20	IDGD	
O=C(c1c(Cl)ccc(Cl)c1O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1781943789	IHAZAIBAXSJVGW-YVEFUNNKSA-N	437.707	1.742	50	20	IDGD	
CCC[C@H](NC(C)=O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)Br)C1	1782001246	CBCTVFCIVFJMMH-PSFFPDNBSA-N	446.386	1.589	50	20	IDGD	
CCc1noc(C)c1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](Cl)COC)C1	1782173433	AIDPDXNFZYPSKL-AKCHCHLHSA-N	427.929	1.927	50	20	IDGD	
CCOC(=O)C1(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](Cl)COC)C2)CC1	1782179646	KTQCPVLJWACTEM-QMTMVMCOSA-N	430.929	1.097	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)CC3CCN(C)CC3)CCO2)C1	1783339557	SYBGEFRAJHUZGK-LPHOPBHVSA-N	430.387	1.722	50	20	IDGD	
COc1cc(F)ccc1CC(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](C)Br)C2)C1	1783536731	GZBQPPPQZKEQJP-DJJJIMSYSA-N	443.313	1.990	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)COc3cccc(Cl)c3)[C@H]2C1	1783806429	IAQMKEZRCGVVFF-MGHWNKPDSA-N	445.343	1.952	50	20	IDGD	
O=C([C@H](F)Br)N1CCO[C@@]2(CCN(C(=O)[C@H]3CCc4ccccc4O3)C2)C1	1783845553	MIQSUXGXJGRERP-JTDSTZFVSA-N	441.297	1.901	50	20	IDGD	
O=C(C(Cl)Cl)N1CC[C@@]2(C1)CN(C(=O)[C@@H]1CC(c3ccccc3)=NO1)CCO2	1783942055	GUMOQXZBELSTQW-HNAYVOBHSA-N	426.300	1.813	50	20	IDGD	
COc1cc(OC)c(F)c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]3C2)c1	1784090974	FYJSDKUJEZQJMR-RMIITELYSA-N	444.887	1.036	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccccc3OC(F)F)C[C@@H]21)[C@H](O)CCl	1784095387	DPRLWCCTRQQDLG-ZIEJDFEHSA-N	432.851	1.481	50	20	IDGD	
COc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)Br)C[C@@H]32)cn1	1784765321	ZAEDGDRMVRAICS-MXAVVETBSA-N	426.311	1.467	50	20	IDGD	
O=C(COc1cccc2ccccc12)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21	1785010116	LENAYMMJWKSWAL-ROPHOZQPSA-N	446.931	1.798	50	20	IDGD	
O=C(c1ccc(F)c(C(F)(F)F)c1)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2	1785207879	HFUMOIPVQGVHCH-PBHICJAKSA-N	438.805	1.888	50	20	IDGD	
Cc1nn(C)c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCBr)[C@H]3C2)c1F	1786404164	FVXQFOLNSVIOGF-AVGNSLFASA-N	431.306	1.246	50	20	IDGD	
O=C(CCc1c[nH]c2ccccc12)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21	1787069988	IGFVQJXNXBLBML-UUXHPUJUSA-N	433.936	1.680	50	20	IDGD	
Cc1[nH]nc(C(=O)Nc2ccc(C3(NC(=O)c4ccc(B(O)O)cc4)CCC3)cc2)c1F	1787162061	XUAAVDGMFMTEOK-UHFFFAOYSA-N	436.252	1.599	50	20	IDGD	
Cn1ncc2cc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)CCBr)C[C@@H]43)ccc21	1788056114	KPMOADJCHUHIJQ-ZVZYQTTQSA-N	449.349	1.952	50	20	IDGD	
COc1nccnc1C(=O)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1	1788145960	KSAOWMTZYZNICL-UHFFFAOYSA-N	446.272	1.227	50	20	IDGD	
COc1ccc2[nH]cc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)[C@@H](O)CCl)C[C@@H]43)c2c1	1788324626	XGZKZCNSXZUHQS-DMBMUNPASA-N	435.908	1.370	50	20	IDGD	
CCCC(=O)N[C@@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](Br)CC)C[C@@H]21	1788743992	OSXRRXQOWVBWNB-GVRJEKJASA-N	446.386	1.444	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21	1788763839	WLTBWMNFYFOVBY-ZJQBRPOHSA-N	425.371	1.508	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1ccc(C2(NC(=O)c3ccnnc3)CCC2)cc1	1789521234	OOJMBBJYLPUXOS-UHFFFAOYSA-N	431.456	1.537	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3c(F)cc(OC)cc3F)[C@H]2C1	1790106014	SUDQQSGXUPOOFT-MJFSBKNWSA-N	446.878	1.821	50	20	IDGD	
Cc1noc(C)c1CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]2C1	1791057175	OPUCTQZEMVTAHD-UMPQAUOISA-N	442.354	1.987	50	20	IDGD	
COC[C@H](Cl)C(=O)NC1(c2ccc(NC(=O)[C@@H]3CCCS3(=O)=O)cc2)CCC1	1791177365	CDNYZPMWKBUFQL-HOTGVXAUSA-N	428.938	1.952	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cc(F)cc(F)c3)C[C@@H]21	1791253941	FUZPETPKEZVWEA-MGHWNKPDSA-N	430.879	1.741	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)Oc3cccnc3)C[C@@H]21	1791256911	YNBJUEQQHFAOFT-SRIISGBFSA-N	425.913	1.082	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc4c(c3)OCO4)C[C@@H]21)C(Cl)Cl	1791294427	XOKBODRSDMKQGY-XEZPLFJOSA-N	429.300	1.741	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1ccc(C2(NC(=O)CN3CCSCC3)CCC2)cc1	1791595588	JIXQALVELDWAHF-UHFFFAOYSA-N	447.605	1.542	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccc(F)cc1Cl	1793743343	IFUIFDKWFOSNMX-VLWCASSMSA-N	433.307	1.865	50	20	IDGD	
COc1ncc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Br)C3)cc1F	1794364716	OICJCAQHTLEGJU-LYIQGSDWSA-N	434.237	1.123	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2)c1ccc(N2CCOCC2)cc1	1796490380	GRAYUSRJNUIBLF-CYGHRXIMSA-N	425.888	1.261	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2nonc2c1	1796885097	YVXGJEODFBVFBP-TYYYEBLRSA-N	427.288	1.662	50	20	IDGD	
Cc1cc(F)cc(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)c1	1798443513	DMDVBGKXGQRNGW-BCDXTJNWSA-N	439.491	1.627	50	20	IDGD	
Cc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Br)C3)n(C(F)F)n1	1798680530	ZGEDUGCXNHSCKX-QCMRWSPLSA-N	439.232	1.480	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(C)nn1C(F)F)C2	1800642685	WRFNMHWAAMAHBR-OPDFLTKYSA-N	449.296	1.963	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCOc1ccc(F)cc1)C2	1800754664	TYOKZCNHJNERLN-FLTUCWPJSA-N	443.313	1.968	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3cnccc3n1)C2	1800756588	ATPJBXVWYMRQNG-MBMVNNNZSA-N	433.306	1.616	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(OC)ccc1Cl	1801666173	UUUCIUPXLOTOFA-CZAMWMTLSA-N	431.316	1.806	50	20	IDGD	
C[C@H](NC(=O)c1ccccc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(C)(C)CCl)C2	1802113401	WXUUMGXHNFLHDA-OWLYRPNTSA-N	435.952	1.660	50	20	IDGD	
Cn1cc(C(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)c2cccnc21	1803143265	XYRNSFWEJRGMBF-AYOQOUSVSA-N	441.919	1.888	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)Cn2nc(C)cc2C)[C@H]1c1cccnc1	1804579105	BVOZEYVWAIJASJ-CMKODMSKSA-N	433.940	1.855	50	20	IDGD	
O=C(CN1CCSCC1)N1CCCC2(CCN(C(=O)[C@H](F)Br)CC2)C1	1804820513	GWUOTJADJYAISW-HNNXBMFYSA-N	436.391	1.957	50	20	IDGD	
Cn1nncc1C(=O)N1CC[C@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]1c1cccnc1	1808291927	QWQNULQGQLYZQY-SIIHOXLZSA-N	425.320	1.766	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)CC(F)(F)C(=O)O)[C@@H]1c1cccnc1	1808294364	KFSZFHYXRWPKFS-IPYPFGDCSA-N	433.839	1.451	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CN2CCCC2)[C@@H]1c1cccnc1)[C@@H](F)Br	1808648995	HDAIKOAOZILBAN-USXIJHARSA-N	427.318	1.874	50	20	IDGD	
COC[C@H](NC(C)=O)C(=O)NC[C@@H]1CCN(C(=O)C(Cl)Cl)[C@H]1c1cccnc1	1810564228	KBHPBYXPHDKEGS-KKUMJFAQSA-N	431.320	1.042	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2n[nH]cc2[N+](=O)[O-])[C@@H]1c1cccnc1	1810638393	MCEGVFNBRAUOFQ-WWGRRREGSA-N	436.856	1.286	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)c1cccc2ccnn12	1812084452	DCYPITSGJKYIEW-SNRMKQJTSA-N	427.892	1.649	50	20	IDGD	
CC(C)=NO[C@H](C)C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1813073751	SNGMUVCDDWBSBR-HGHGUNKESA-N	446.552	1.261	50	20	IDGD	
O=C(CCn1ccnn1)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@H]1c1cccnc1	1813432529	NCDWDVFTDQZLJJ-CWRNSKLLSA-N	439.289	1.460	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)CCc2cnccn2)[C@H]1c1cccnc1	1813447815	YSTRLGUWRNLVOR-XKGZKEIXSA-N	431.924	1.764	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc(O)c([N+](=O)[O-])c2)[nH]n1)[C@@H](O)CCl	1814872764	NSDBGDUFEOAMSO-DOMZBBRYSA-N	437.840	1.929	50	20	IDGD	
COC(OC)C(=O)Nc1cc([C@H]2CCCCN2C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[nH]n1	1815033106	UXBIGYZBWMMXHN-AQXNZCSYSA-N	445.480	1.155	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H](O)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](F)Cl)sc2C1	1817128487	LXKAVIIRHSXUTQ-XBURVNOZSA-N	436.893	1.433	50	20	IDGD	
O=C(CN1CCCC1=O)Nc1cc([C@H]2CCCCN2C(=O)CCBr)[nH]n1	1817156735	NXJKWIHUYFIKAX-CYBMUJFWSA-N	426.315	1.809	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)Cc2ccccc2O)[nH]n1)c1ccc(B(O)O)cc1	1817475979	YELUZRJDXWXTBQ-IBGZPJMESA-N	448.288	1.344	50	20	IDGD	
C[C@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](F)Cl)n[nH]1)[C@H]1SC(=N)NC1=O	1818038657	ZLWGWTVBACECAG-JJMKBETCSA-N	430.893	1.739	50	20	IDGD	
Cc1cc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)cc(O)n1	1818051329	HITRRZYVBNDKNX-SFHVURJKSA-N	449.276	1.118	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](O)CCl)CC2	1818081069	JOCWVQLOOYRZED-WCQYABFASA-N	433.921	1.925	50	20	IDGD	
O=C(/C=C\C(=O)NC1CC1)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](F)Br)[nH]n1	1819271989	MSZSBKIFCNADFO-GORHOLETSA-N	442.289	1.927	50	20	IDGD	
CC(=O)OC[C@@H](OC(C)=O)C(=O)Nc1cc([C@H]2CCCCN2C(=O)C(Cl)Cl)[nH]n1	1819432301	GCEJZPVCLBDKIO-CHWSQXEVSA-N	449.291	1.700	50	20	IDGD	
CCOC(=O)N[C@H](O)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)C(C)(C)CCl)CC2	1819458904	YSDUDFHBKQYXQC-NOZJJQNGSA-N	432.930	1.385	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN2C(=O)C=CC2=O)[nH]n1	1820869097	PVAWKHINIGGYGF-SGTLLEGYSA-N	442.303	1.563	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H]2[C@H]3C=CS[C@@H]32)n[nH]1	1821710587	AZRRQOUWGPPNPN-VOQHCJDSSA-N	432.550	1.650	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3ccc([N+](=O)[O-])[nH]3)sc2C1	1821746604	BXDOMQCQVLFUAL-IUCAKERBSA-N	427.870	1.859	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(F)nc2F)[nH]n1	1822411962	GBMIBSBXIAZCIU-CQSZACIVSA-N	449.462	1.762	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCCC[C@H]1c1cc(NC(=O)CNC(=O)C(F)(F)F)n[nH]1	1822441689	PDYVQFOBCIEHQS-LBPRGKRZSA-N	449.506	1.932	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H]2CCCSC2)n[nH]1	1823458184	GZEKLVDZYMPQLB-HOCLYGCPSA-N	436.582	1.918	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CN2C(=O)CNC2=O)CC1	1824010367	OXUZXRLBJVGNLB-OAHLLOKOSA-N	426.945	1.423	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(F)n1)CC2	1826088081	RJILGBWICONICE-LLVKDONJSA-N	434.497	1.276	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H]1C[C@@]1(F)Cl)CC2	1826090137	WPQYIODXFCNAKP-YHTYYEMMSA-N	431.921	1.353	50	20	IDGD	
O=C(c1ccncc1F)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827052899	NLCPBUGNEDASOR-OAQYLSRUSA-N	439.296	1.448	50	20	IDGD	
O=C(c1cc(F)c[nH]1)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827053123	DKBNRYIURADNAB-HXUWFJFHSA-N	427.285	1.381	50	20	IDGD	
Cc1c(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)oc2ccccc12	1830728295	RKMIUYYZVFPXIP-IERDGZPVSA-N	436.892	1.411	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CS(C)(=O)=O)CC1	1831549161	MHNKATUCKMFCAX-GJZGRUSLSA-N	437.400	1.824	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)C3CCC(CO)CC3)C2)C1	1831641186	WPUNEJAWJHSXMS-XVAHUTHZSA-N	430.973	1.649	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](OC(C)=O)C(C)C)C2)C1	1831651202	NTYKEMHLIIZXQB-QKLQHJQFSA-N	432.945	1.438	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2C[C@H]3CC[C@@H]2O3)CC1	1831684507	GICIPUUOJWYELP-ZRNYENFQSA-N	434.581	1.547	50	20	IDGD	
O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)c1ccccc1)CCO2	1832215059	AOTFNFHBBMZCTN-IEBWSBKVSA-N	443.313	1.939	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)CCl)CC2)CC1	1833313268	CTRNFNPZBJALIJ-PBHICJAKSA-N	428.788	1.394	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)[C@@H]3CCNC(=O)C3)CC2)CC1	1833534538	CPMSPOJSMMQDMG-QAPCUYQASA-N	426.989	1.492	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)s1	1833957567	OFJYNYOVCYBACN-IBGZPJMESA-N	426.611	1.978	50	20	IDGD	
Cc1[nH]nc(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](C)Br)CC3)CC2)c1F	1834020286	AOMGZURUIHNFJP-LLVKDONJSA-N	444.349	1.826	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCC(N2CCC(NC(=O)C3CCOCC3)CC2)CC1	1834546694	CCPZBOCIFKRTDL-UHFFFAOYSA-N	425.646	1.836	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)[C@H]3CCC(=O)N3)CC2)CC1	1834588891	OCSZNDSAGZLYHL-JKSUJKDBSA-N	443.386	1.010	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(O)cn3)CCO2)C1	1834589196	KUPZCWFQEZNZNL-KSSFIOAISA-N	442.310	1.031	50	20	IDGD	
CC(C)N[C@@H](C(=O)NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)C(C)C	1834785413	WTEXPJBBQISFNH-RTBURBONSA-N	431.021	1.180	50	20	IDGD	
COc1nccc(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](F)Cl)CC3)CC2)c1F	1834906092	CXJUUQZPWGHHFI-MRXNPFEDSA-N	430.883	1.949	50	20	IDGD	
CN1CCc2cc(C(=O)NC3CCN(C4CCN(C(=O)[C@H](O)CCl)CC4)CC3)ccc21	1835381791	NXESQHKHXDFZDS-OAQYLSRUSA-N	448.995	1.464	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3ccc[nH]3)CCO2)C1	1836018096	VENSNQLTRWTSDC-APWZRJJASA-N	442.354	1.577	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccsc3)CCO2)C1	1836102043	ZVNUOOAFCVYJHJ-MAUKXSAKSA-N	445.379	1.921	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)Cc3ccncc3)CC2)CC1	1836348269	QMGLDJXLDPWJQD-OAHLLOKOSA-N	437.382	1.979	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)[C@H]3CC=CCC3)CC2)CC1	1836387831	DTPIAALQBUTHNN-SFHVURJKSA-N	433.597	1.287	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc4c(c3)CC(=O)N4)CCO2)C1	1836784148	HGIJNAZZUXTSPG-HTAPYJJXSA-N	449.935	1.659	50	20	IDGD	
Cc1cccc2[nH]c(C(=O)N3CCO[C@]4(COCCN(C(=O)[C@@H](O)CCl)C4)C3)cc12	1836912665	GTJBBUNMSDTMFX-GHTZIAJQSA-N	435.908	1.146	50	20	IDGD	
CN1CCC[C@H]1C(=O)N1CCC(OC2CCN(C(=O)CO[Si](C)(C)C)CC2)CC1	1837002973	QRWHOEJHFGQAPT-IBGZPJMESA-N	425.646	1.931	50	20	IDGD	
Cn1ncnc1C(=O)N1CCC(OC2CCN(C(=O)[C@@](C)(Cl)CCl)CC2)CC1	1837371544	FIUQTYPCMBGUBN-SFHVURJKSA-N	432.352	1.664	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)Cn3cncn3)CC2)CC1	1837965031	PXVBUWPBVVELAT-INIZCTEOSA-N	442.358	1.450	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3oc(C)nc3C)CCO2)C1	1838007524	GRGSFIAPJXHLEM-RDTXWAMCSA-N	444.326	1.535	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(O)nc3)CCO2)C1	1838651574	XLJNNXDMPVDOBL-ZWKOTPCHSA-N	432.304	1.094	50	20	IDGD	
Cc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)nn1C	1839150875	AHJGORHZDAJCGU-ZWKOTPCHSA-N	433.336	1.035	50	20	IDGD	
O=C(CCCn1cccc1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839203248	FVLQAUNZTIUDMU-FUHWJXTLSA-N	446.317	1.415	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1C[C@@H]1c1ccccc1)CCO2	1840121052	DZYZOLCAYYFHTP-NXWNEQKCSA-N	436.936	1.500	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)c3ccccn3)C2)C1	1840156799	ZYDQOIMJIIUSSM-HRAATJIYSA-N	439.940	1.069	50	20	IDGD	
CC(C)(C)c1cnc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)cn1	1840187836	ZQMMDJUDNAKKJW-LJQANCHMSA-N	445.347	1.648	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(CN(C(=O)CCCn3cccc3)CCO2)C1	1840461229	KGSKHORLCOTHTH-NRFANRHFSA-N	437.613	1.576	50	20	IDGD	
CCc1c(Br)c(C(=O)N2CC3(CCCN3C(=O)[C@H](O)CCl)C2)nn1C	1841350515	IGNGNULLGSWGEZ-LLVKDONJSA-N	433.734	1.162	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC2(CCCN2C(=O)C(=O)c2ccco2)C1	1841952469	USGFSDMGGZRFFQ-ZDUSSCGKSA-N	439.896	1.798	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)[C@@H]1[C@@H]3Sc4ccccc4[C@H]31)C2	1844264484	XSXFLEIFSGAOBJ-GBESFXJTSA-N	449.536	1.390	50	20	IDGD	
Cc1ccc(S(=O)(=O)CC(=O)N2CC3(CCCN3C(=O)[C@@H](C)Br)C2)cc1	1846176040	JNAPVFSCAKHFEG-CQSZACIVSA-N	443.363	1.756	50	20	IDGD	
CC(C)[C@H](C(=O)N1CCCC12CN(C(=O)c1cccc(B(O)O)c1)C2)c1ccc(F)cc1	1846283459	GZJGRJOMVBHOIE-NRFANRHFSA-N	438.308	1.762	50	20	IDGD	
C=C[C@@H]1C[C@]1(NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)[C@@H](Cl)COC)C2	1847084262	NHVWUQRUGXDVPF-LRAJWGHMSA-N	441.956	1.913	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@@H](O)[C@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)C(C)(C)CCl)C1	1847437866	APEPJRVALFLYFL-FXUDXRNXSA-N	443.972	1.681	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H]1COCCN1C(=O)OC(C)(C)C	1847945529	ONMNGUCJVXYHLX-YHUYYLMFSA-N	445.944	1.078	50	20	IDGD	
O=C(Cn1c(=O)[nH]c(=O)c2ccccc21)NNC(=O)c1ccc(COc2ccccc2)o1	10417796	MFCIVBSSGILYRD-UHFFFAOYSA-N	434.408	1.323	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)CCn2cnc3sccc3c2=O)cc1	14369110	VRWKFYZFSNXQJP-CYBMUJFWSA-N	430.486	1.862	50	20	IDGD	
C[C@H](Oc1ccc(Br)cc1)C(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	17191699	WYXHUYRYRFTVEU-NSHDSACASA-N	445.273	1.925	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)CCNS(=O)(=O)c2c(C)cc(C)cc2C)c1	104748168	WMLDDVYHXSUJJU-UHFFFAOYSA-N	433.530	1.815	50	20	IDGD	
COCCCNC(=S)N(C)NC(=O)[C@@H](Cc1ccccc1)NC(=O)c1ccccc1	726075749	FIHVLHMIFXFLMS-LJQANCHMSA-N	428.558	1.902	50	20	IDGD	
COCCS(=O)(=O)c1ccc(C(=O)NNC(=S)Nc2ccc(OC)c(F)c2)cc1	727499615	NTJLITNVYUVOPH-UHFFFAOYSA-N	441.506	1.886	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)NCCCc1nnc2n1CCCCC2	727607486	QMLZBWLQQPUIIT-UHFFFAOYSA-N	430.509	1.745	50	20	IDGD	
CN(C)N(C(=O)Cc1csc(NC(=O)c2cccs2)n1)[C@@H]1CCS(=O)(=O)C1	728179730	UWYWNTRNPQYYDA-GFCCVEGCSA-N	428.561	1.492	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNS(=O)(=O)c2ccc(F)c(C(=O)O)c2)c1	728508090	CWEOLTKWAWIDMF-UHFFFAOYSA-N	447.238	1.918	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c2cccnc12	728854335	RJLXVXSTIQNUEW-UHFFFAOYSA-N	442.501	1.260	50	20	IDGD	
O=C(Cc1cc[nH]n1)NNC(=O)c1ccccc1SCc1nnnn1-c1ccccc1	730091526	FUUFSULHPILZIG-UHFFFAOYSA-N	434.485	1.681	50	20	IDGD	
Cc1cc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)Cc3ccccc3F)c2)no1	731366159	GYKMGDSWLDAGQR-UHFFFAOYSA-N	432.433	1.927	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1	732050262	PWHXQBSITFYBOM-GFCCVEGCSA-N	436.421	1.626	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)c1ccc(NS(=O)(=O)c2ccc(F)c(F)c2)cc1	732083949	ADOZOOVCZZTLDS-UHFFFAOYSA-N	435.412	1.872	50	20	IDGD	
Cc1ccccc1C1(C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)CCOCC1	732332114	NHGCCUZDQJUUBW-UHFFFAOYSA-N	441.440	1.956	50	20	IDGD	
CN1CCN(C)[C@H](CNC(=O)NNC(=O)CCCOc2ccc(Cl)cc2Cl)C1	732475006	PKCKUSLYUSPCBM-CQSZACIVSA-N	432.352	1.729	50	20	IDGD	
CC[C@H](Nc1ccccc1)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1	733123548	RKJOFMJOPGHXEK-IBGZPJMESA-N	446.529	1.359	50	20	IDGD	
COC(=O)CCCS(=O)(=O)NC(=O)/C(C#N)=C\c1cc(C)n(C[C@@H]2CCCO2)c1C	734090614	VLCTULHJXGVZDH-PNDHZVEESA-N	437.518	1.590	50	20	IDGD	
O=C1CN(S(=O)(=O)c2ccc(C(=O)NNc3nccc4sccc34)cc2)CCN1	734249936	KESDZNVBLXPHER-UHFFFAOYSA-N	431.499	1.174	50	20	IDGD	
O=C(NNc1ccc(Cl)nn1)C1CCN(c2ccc3nnc(C(F)(F)F)n3n2)CC1	735688718	NLSIZHMTEKUGGF-UHFFFAOYSA-N	441.805	1.946	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(N=c3cc[nH]cc3)cc2)c1	735833788	BDJBZJPECFLVLV-UHFFFAOYSA-N	439.497	1.572	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)c1ccc(C)cc1)C(=O)NNc1ccnc(N(C)C)n1	740107724	MCVSNQJTLQYLKH-HNNXBMFYSA-N	438.579	1.394	50	20	IDGD	
CCOc1ccc(/C=C(/C#N)C(=O)NC2CCN(S(=O)(=O)c3cnn(C)c3)CC2)cc1	741231266	BHOLFLRGVDINDN-ATVHPVEESA-N	443.529	1.695	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)N[C@@H](C)[C@@H]1CN(Cc2ccccc2)CCO1	741284689	YEGFYWSLCAKMHQ-UWJYYQICSA-N	426.517	1.858	50	20	IDGD	
O=C(CCNC(=O)c1n[nH]c2ccccc12)NNC(=O)c1cccc(Br)c1	742768330	BNOOLAXKPCXEMK-UHFFFAOYSA-N	430.262	1.907	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(Br)s1)C1CC1	743738050	RSWAPTBKQQSUOH-JTQLQIEISA-N	436.353	1.611	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNC(=O)[C@H](C)N2C(=O)[C@H]3[C@H](C2=O)[C@H]2CC[C@H]3O2)cc1	744352681	NTXFFODPQQFSIG-HMIGGYHTSA-N	443.500	1.423	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCC(CN2CCCCC2=O)CC1	744403779	ZXRLVTYYBZDGKX-UHFFFAOYSA-N	436.940	1.834	50	20	IDGD	
Cc1ccc(C(=O)N2CCC[C@H](C(=O)OCC(=O)NNC(=O)c3ccc(C#N)cc3)C2)cc1	744706036	XFKOCDPLRMMYGA-FQEVSTJZSA-N	448.479	1.723	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNS(=O)(=O)c2ccc(C)c(C(=O)OC)c2)cc1	745976670	JANHAVVCUDFRJE-CQSZACIVSA-N	436.486	1.957	50	20	IDGD	
O=C(COC(=O)Cc1csc(-c2cccnc2)n1)NNC(=O)c1ccc([N+](=O)[O-])cc1	746211718	HQZGUEITKQRWFU-UHFFFAOYSA-N	441.425	1.660	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)N2CCN(C3CCOCC3)CC2)N(C)c2ccccc21	747430899	FAPZCSAMUYNLKT-UHFFFAOYSA-N	437.544	1.980	50	20	IDGD	
COc1cc(C=NNC(=O)C(=O)N2CCCC2)ccc1OS(=O)(=O)c1ccc(C)cc1	748137397	DFYDDHXZZGKPGJ-UHFFFAOYSA-N	445.497	1.844	50	20	IDGD	
Cc1cc(F)ccc1NNC(=O)c1cc(S(=O)(=O)N(C)C)ccc1N1CCOCC1	748570393	HABYYEMSCOFIEB-UHFFFAOYSA-N	436.509	1.978	50	20	IDGD	
O=C(COC(=O)c1cc(Br)c2c(c1)OCCO2)NNC(=O)c1ccccc1	748925063	QRDVAPDNQZTTEE-UHFFFAOYSA-N	435.230	1.838	50	20	IDGD	
O=C(NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1)c1ccc2nncn2c1	749402910	BKYACCXNGRWFPA-UHFFFAOYSA-N	442.482	1.666	50	20	IDGD	
O=C(NC[C@@H]1SCCc2ccccc21)NNC(=O)c1csc(N2CCOCC2)n1	749612037	KEAMABXWGLZZNT-INIZCTEOSA-N	433.559	1.954	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)[C@@H]2CCCCN2Cc2ccc(F)cc2)n1	750499847	XZMIIOTVDOLALM-KRWDZBQOSA-N	448.520	1.878	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)c2ccc(-n3ccnc3)nn2)cc(OCC)c1OCC	750658698	HXMPXPUETFCXOQ-UHFFFAOYSA-N	440.460	1.933	50	20	IDGD	
O=C(NCCNS(=O)(=O)Cc1ccon1)NNc1ccc(F)cc1Br	750659412	GEYVCXYQUITNNE-UHFFFAOYSA-N	436.263	1.322	50	20	IDGD	
COc1ccc(CCCC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c(OC)c1	753889808	VOZCBWBQPQZPNC-UHFFFAOYSA-N	449.529	1.738	50	20	IDGD	
COCCN(C)S(=O)(=O)[C@H]1CCCN(C(=O)/C(C#N)=C/c2cc(C#N)n(C)c2C)C1	754708556	IFGBIVNNYYEUOJ-DMVFFGLYSA-N	433.534	1.011	50	20	IDGD	
CCc1nnc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)s1	755405543	QXROQJYDCJVTTM-UHFFFAOYSA-N	438.535	1.742	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(N(C)C)c(NC(=O)NNC(=O)c2cccnc2)c1	755434615	MZASGUBYLPLDEG-UHFFFAOYSA-N	434.522	1.645	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1cccc(COCCc2ccccc2)c1	756227837	GKGXJQNEDUJFCM-OAHLLOKOSA-N	434.518	1.536	50	20	IDGD	
Cc1ccc(-c2nnco2)cc1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	756516503	LOQQHODHOPIACE-UHFFFAOYSA-N	444.473	1.762	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1ccc(C(=O)NC2CC2)cc1	757038462	AZHHIFNHWDMHEG-UHFFFAOYSA-N	444.513	1.357	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)N=c3nc[nH]n3C)c2)c(C)c1	757759916	AZVAOKYUOIPQAV-UHFFFAOYSA-N	443.489	1.121	50	20	IDGD	
COc1c(NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cccc1C(N)=O	757995563	YINZBWDHZSCMIV-UHFFFAOYSA-N	440.504	1.159	50	20	IDGD	
O=C(COc1ccc2c(c1)CCCC2)N1CCN(S(=O)(=O)CBr)CC1	758512054	GWNRZTVNBRNLIZ-UHFFFAOYSA-N	431.352	1.771	50	20	IDGD	
Cc1ccc(-c2nc(C(=O)OCC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)cs2)n1C	758579474	ZPPOSKSNOISOEL-UHFFFAOYSA-N	443.441	1.983	50	20	IDGD	
CN(NC(=O)CNC(=O)CC1CCCCC1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758781751	GRWLRCPFCBSINT-UHFFFAOYSA-N	439.557	1.709	50	20	IDGD	
C[C@@]1(CNC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)CCCS1	758862906	ZGQJIGYRVSIDOR-SFHVURJKSA-N	426.564	1.701	50	20	IDGD	
N#C/C(=C/c1cn(CC(=O)O)nn1)C(=O)Nc1cccc(S(=O)(=O)N2CCCCC2)c1	759074967	ZCVSHXPLKUFKOT-ZROIWOOFSA-N	444.473	1.083	50	20	IDGD	
CC(C)CCn1nc(C(=O)NNC(=O)Nc2nc3ccccn3n2)c2ccccc2c1=O	760032688	QJDOCUDSVMBSGO-UHFFFAOYSA-N	434.460	1.952	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)c2cnn(C)c2Br)c2ccccc2c1=O	760156074	JTJIEJMLPQVPOC-UHFFFAOYSA-N	433.266	1.548	50	20	IDGD	
CC1(C)C(=O)N(C[C@](C)(O)C(=O)NNc2cccc(S(C)(=O)=O)c2)c2ccccc21	760489020	DAKJNQLAJCRZPT-NRFANRHFSA-N	431.514	1.609	50	20	IDGD	
COC(=O)c1cn([C@@H]2CCN(C(=O)NNC(=O)c3cc4c(s3)CC[C@H](C)C4)C2)nn1	760656138	LQJKDQZJNRIEJQ-WCQYABFASA-N	432.506	1.552	50	20	IDGD	
O=C(NNC(=O)c1ccncc1)C(=O)Nc1ccc(C(=O)N2CCCCC2)c(Cl)c1	763464409	OPARBWOIIJPRKC-UHFFFAOYSA-N	429.864	1.761	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1cccc(CN2CCCCC2=O)c1	763471816	LTUKWZUAEKFJEW-UHFFFAOYSA-N	439.428	1.507	50	20	IDGD	
CCNC(=O)COc1cccc(CNC(=O)NNC(=O)CSc2ccccc2O)c1	763474453	XVGQRXLHOKCFQK-UHFFFAOYSA-N	432.502	1.530	50	20	IDGD	
COC(=O)C(C)(C)c1ccc(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1	763570743	FPYFWIBUVIOCBQ-QGZVFWFLSA-N	441.440	1.063	50	20	IDGD	
C[C@@H]1Oc2ccc(NC(=O)C(=O)NNC(=O)c3cc(-c4ccccc4)[nH]n3)cc2NC1=O	763605338	RHMPVSBIBXADAY-NSHDSACASA-N	434.412	1.196	50	20	IDGD	
Cc1noc(COc2ccc(NC(=O)C(=O)NNC(=O)COc3ccccc3F)cc2)n1	763680090	ROBCTGPLVRRCOI-UHFFFAOYSA-N	443.391	1.261	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)C(=O)Nc2c(C)noc2CC)c2ccccc2c1=O	763801308	NOLUYXMUMIMOBJ-UHFFFAOYSA-N	440.460	1.455	50	20	IDGD	
COC(=O)C(C)(C)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)cc1	763838836	BALMZSLQTMGKIX-UHFFFAOYSA-N	431.420	1.441	50	20	IDGD	
Cc1cncc(NC(=O)C(=O)NNC(=O)c2nn(CCC(C)C)c(=O)c3ccccc23)c1	763844178	WMILVOYTGAEZEM-UHFFFAOYSA-N	436.472	1.546	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)C(=O)Nc1ccc(-n2cccn2)nc1	763856288	ZEEGLAGYIWUNBF-HNNXBMFYSA-N	444.451	1.974	50	20	IDGD	
COC(=O)c1ccc(C(F)(F)F)cc1NC(=O)C(=O)NNC(=O)Cn1nc(C)cc1C	763892442	FQPZMNXWABZHTC-UHFFFAOYSA-N	441.366	1.091	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cccnc2N2CCCCC2)cc1OC	763900994	KCZPOYWIOXPGNP-UHFFFAOYSA-N	441.488	1.879	50	20	IDGD	
CCOC(=O)c1ccsc1NC(=O)C(=O)NNC(=O)c1cc(Br)cn1C	764001948	HMDKCKPCROZNCG-UHFFFAOYSA-N	443.279	1.426	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(F)cc2Br)cc1	764086889	VQKLSTAHEMJVDL-UHFFFAOYSA-N	438.209	1.775	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)nc2)cc1Br	764093262	QPAZSPMXTKWUPM-UHFFFAOYSA-N	427.642	1.906	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccn(Cc4ccncc4)n3)n[nH]2)cc1	764109767	BJLKJZCDTUJINN-UHFFFAOYSA-N	444.455	1.425	50	20	IDGD	
CCNC(=O)N1CCc2ccc(NC(=O)C(=O)NNC(=O)Cn3ccc4ccccc43)cc21	764239298	KPKUQLGANMFFJW-UHFFFAOYSA-N	448.483	1.519	50	20	IDGD	
COC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2cc(Br)ccc2O)c1	764280310	MJHWAKJQKBQCHK-UHFFFAOYSA-N	436.218	1.341	50	20	IDGD	
CCc1nnc(-c2cccc(NC(=O)C(=O)NNC(=O)c3cnn(-c4ccccc4)c3)c2)o1	764345545	GYLIUCBHDXZPKA-UHFFFAOYSA-N	445.439	1.884	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc(-n4cnnn4)cc3)n[nH]2)cc1	764385168	UOWRPYODMPWTLY-UHFFFAOYSA-N	445.443	1.015	50	20	IDGD	
COC(=O)NNC(=O)C(=O)Nc1ccc(C)c(S(=O)(=O)Nc2ccccc2OC)c1	765372921	CLIUFPAMVCRAHM-UHFFFAOYSA-N	436.446	1.130	50	20	IDGD	
C=CCOc1cc(OC)ccc1C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	766967479	NXESZFDBRQPTQK-UHFFFAOYSA-N	439.877	1.636	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1coc(C2CCOCC2)n1	767991086	OIDAVEFRKZSPHC-UHFFFAOYSA-N	436.490	1.346	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2cc3c(cc2OC)CCC(=O)N3)cc1	768238571	DENDFSPUDAYXPE-UHFFFAOYSA-N	440.456	1.307	50	20	IDGD	
C[C@H](CCN1CCN(C)CC1)NC(=O)NNC(=O)COc1ccc(Br)cc1	770580650	BHUNIZIIYLRXNT-CQSZACIVSA-N	442.358	1.184	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)CCCNS(=O)(=O)c1ccc2c(c1)CCCC2	771915552	KMQHCKQSUSQOKA-CQSZACIVSA-N	439.534	1.113	50	20	IDGD	
C[C@H]1C[C@@H](NC(=O)OC(C)(C)C)CCN1C(=O)NNC(=O)CNC(=O)c1cccs1	771977704	KIFSNAITRIJKMU-STQMWFEESA-N	439.538	1.596	50	20	IDGD	
O=C(C[C@@H]1CN(Cc2ccccc2)CCO1)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772889575	QXFCRYDRABGZJB-LJQANCHMSA-N	444.919	1.395	50	20	IDGD	
CCS(=O)(=O)N[C@H](CCSC)C(=O)NNC(=O)[C@H](C)Oc1cccc(Cl)c1	772964969	AEDWJVZMMXESQY-SMDDNHRTSA-N	437.971	1.316	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NNC(=O)c2ccc(CS(C)(=O)=O)o2)C1	773422293	WBYWBVZCIHRYLA-GFCCVEGCSA-N	429.495	1.232	50	20	IDGD	
CCN1CCN(Cc2ccc(NC(=O)C(=O)NNc3ccc([N+](=O)[O-])cc3)cc2)CC1	773643127	KPZUDOOHLFWDBQ-UHFFFAOYSA-N	426.477	1.814	50	20	IDGD	
CN(Cc1ccccc1)S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ncccn2)cc1	773720197	VQXZSJPLUIYJSL-UHFFFAOYSA-N	440.485	1.379	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(C)c(F)c2)cc1Cl	773885992	USKUGRYUQSHFEJ-UHFFFAOYSA-N	437.811	1.739	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(S(C)(=O)=O)ccc2Cl)cc1F	773889139	MYCUOGGBQZTTDL-UHFFFAOYSA-N	427.841	1.591	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cc3c(cc2F)NC(=O)CC3)cc1C	778708048	ZZPKBXMGVMVVKW-UHFFFAOYSA-N	428.420	1.492	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)C(=O)Nc1cc(Cl)ccc1OC1CCCC1	778714140	PTTQQJDUVZHRFS-GFCCVEGCSA-N	427.885	1.799	50	20	IDGD	
CS(=O)(=O)CC[C@@H](NC(=O)c1ccc(Cl)cc1)C(=O)NNc1ncncc1Cl	781804349	HJUZIEGOUKFOGY-CYBMUJFWSA-N	446.316	1.460	50	20	IDGD	
Cc1cc(Br)c(NC(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)cc1Cl	782070434	AEVBYVULRJFKEB-ZETCQYMHSA-N	427.708	1.501	50	20	IDGD	
Cn1cc(NC(=O)C(=O)NN=c2sc3ccccc3n2C)cc(Br)c1=O	783349199	CFKHVBJDSCRKQA-UHFFFAOYSA-N	436.291	1.272	50	20	IDGD	
CC(C)COC(=O)Nc1cccc(NC(=O)C(=O)NN[C@@]2(C)CCS(=O)(=O)C2)c1	783427605	PEZSOQIIGBUMFY-SFHVURJKSA-N	426.495	1.028	50	20	IDGD	
CCCOc1ccc(NC(=O)C(=O)NNC(=O)CNC(=O)c2cccs2)cc1Cl	784005346	WQXFUQVONRUBSQ-UHFFFAOYSA-N	438.893	1.706	50	20	IDGD	
O=C(NNc1ccc(Cl)nn1)C(=O)Nc1ccc2c(ccn2CCN2CCOCC2)c1	784792357	QHCNLOWWHIVZLW-UHFFFAOYSA-N	443.895	1.499	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(NC(=O)C(=O)NNc2ccc(OC(F)(F)F)cc2)c1	784802150	TVIPSFFDRPQFIW-UHFFFAOYSA-N	446.407	1.917	50	20	IDGD	
NC(=O)C1CCN(c2ccccc2NC(=O)C(=O)NNc2ccc(F)c(F)c2F)CC1	784807268	SUSBUAZPWICYKX-UHFFFAOYSA-N	435.406	1.887	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNc3ccnc(Br)c3)cn2)C[C@H](C)O1	784837264	KWSCJVIDVBYBCK-RYUDHWBXSA-N	449.309	1.935	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)n(-c2ccccc2F)n1	785023676	NTEGZGNAQULQCG-UHFFFAOYSA-N	442.363	1.333	50	20	IDGD	
CC[C@@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)cc1	785061147	UCDANLOIYBFCCV-CQSZACIVSA-N	436.472	1.191	50	20	IDGD	
CCS(=O)(=O)CCn1cc(C)c(NC(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)n1	786732932	OEUWOVDWCLELBP-CYBMUJFWSA-N	441.485	1.386	50	20	IDGD	
O=C(NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12)NOC[C@H]1CCOC1	788323264	DBYXJTVWZRJCHM-INIZCTEOSA-N	437.456	1.357	50	20	IDGD	
CCCOc1cc(OC)ccc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	789728278	ZGQZUHCHQICSHD-UHFFFAOYSA-N	435.502	1.809	50	20	IDGD	
O=C(CNC(=O)NNC(=O)C1CCCC1)Nc1ccc(I)cc1	790829709	GBQHCOSEUIEEKS-UHFFFAOYSA-N	430.246	1.750	50	20	IDGD	
CCN1CCN(c2cccc(NC(=O)C(=O)NNc3cccc(F)c3[N+](=O)[O-])c2)CC1	790997292	MRCAREIMLITMBW-UHFFFAOYSA-N	430.440	1.958	50	20	IDGD	
O=C(NNC(=O)c1cccc(Cl)c1)C(=O)Nc1ccc(Cc2nnc3n2CCC3)cc1	792267039	DPHFORYNFBVFPC-UHFFFAOYSA-N	438.875	1.868	50	20	IDGD	
CCc1ccccc1OCC(=O)NNC(=O)[C@](C)(O)Cn1cc(C(F)(F)F)ccc1=O	792629146	KZYJGIXQLRLSPT-LJQANCHMSA-N	441.406	1.407	50	20	IDGD	
Cn1ccc2ccc(NC(=O)C(=O)NNC(=O)COc3ccc(Cl)cc3)cc2c1=O	793023813	WLAMWONXILMFAC-UHFFFAOYSA-N	428.832	1.357	50	20	IDGD	
CC(C)CNC(=O)N1CCC[C@@H](CC(=O)NNc2ccccc2S(=O)(=O)N(C)C)C1	795177144	JLGHANNTKVSXGQ-INIZCTEOSA-N	439.582	1.848	50	20	IDGD	
O=C(NNS(=O)(=O)c1c(F)c(F)cc(F)c1F)C1CCN(c2ncccn2)CC1	795313632	GAHFTIDQPAWHQL-UHFFFAOYSA-N	433.387	1.259	50	20	IDGD	
Cc1cccc(N2CCN(S(=O)(=O)CC(=O)NNC(=O)Nc3ccccc3C)CC2)c1	798311443	TYJBIMXJZUTRAK-UHFFFAOYSA-N	445.545	1.608	50	20	IDGD	
N#Cc1ccc(NNC(=O)C(=O)Nc2cnc(N3CCOCC3)c(Br)c2)cc1	799259558	BWYORUYDDHXMSY-UHFFFAOYSA-N	445.277	1.634	50	20	IDGD	
CCn1c(S)nc2cc(C(=O)NNC(=O)C(=O)Nc3ccc(C)cc3)ccc2c1=O	801109420	MSXQNVDXSABXST-UHFFFAOYSA-N	425.470	1.413	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)[C@@](C)(O)CCc3ccccc3)CC2)cc1	801172625	VNXWVCIKHUXFKX-VWLOTQADSA-N	438.572	1.644	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2cc(Cl)cc3c2OCC(=O)N3)c1	806756173	FPSDLXHHZCMPOQ-UHFFFAOYSA-N	438.849	1.541	50	20	IDGD	
CCN(CC)CC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)nc2)c1	806976288	MBPRCBZDRPSHLJ-UHFFFAOYSA-N	446.895	1.415	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)[C@@H]1CCCN(S(=O)(=O)Cc2ccccc2)C1	807369855	MQRCHXLZZBQGEX-QGZVFWFLSA-N	441.550	1.165	50	20	IDGD	
CCCCN1C(=O)C[C@@H](C(=O)NNC(=O)N2CCN(C)CC2)[C@@H]1c1ccc(OC)cc1	807379314	WZUNQXMTTFRULD-QUCCMNQESA-N	431.537	1.373	50	20	IDGD	
CCc1nnc(NC(=O)[C@@H](C)[C@H](C)NC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)s1	807566615	YQHQOGLYTUXOLF-UWVGGRQHSA-N	435.466	1.616	50	20	IDGD	
COC(=O)c1c(F)ccc(NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)c1F	810384569	MUPDGDHGRDDOLA-UHFFFAOYSA-N	427.747	1.510	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)C(=O)Nc1ccc(-c2ccccn2)cc1	810386113	MLJVJNWWSBXRLQ-UHFFFAOYSA-N	428.412	1.124	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)C(=O)Nc2cc(C3CC3)n(C)n2)c1	810386843	ULRVNXKSMWRGIQ-UHFFFAOYSA-N	436.266	1.468	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)CNS(=O)(=O)c1cc(C)ccc1C	811104923	YXONJFKKIMVTDU-UHFFFAOYSA-N	441.531	1.137	50	20	IDGD	
O=C(NNS(=O)(=O)CCCN1C(=O)c2ccccc2C1=O)c1ccc(Cl)cc1O	811682618	BGMYLFHOFREHIE-UHFFFAOYSA-N	437.861	1.296	50	20	IDGD	
COC[C@@H](C)[C@@H](C)C(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1	812452094	BYXWDRLPSXKUSP-HZPDHXFCSA-N	433.530	1.845	50	20	IDGD	
O=C(NNC(=O)N1CCc2c(nnn2-c2ccccc2)C1)C1CCN(c2ncccn2)CC1	814295850	HYWJZTPRIRTMDV-UHFFFAOYSA-N	447.503	1.073	50	20	IDGD	
CC(=NNC(=O)Cc1csc(N2CCOCC2)n1)c1cccc(O[C@H](C)C(=O)O)c1	814770911	QJDUQOGVJCGRNI-CQSZACIVSA-N	432.502	1.915	50	20	IDGD	
O=C(NNC(=O)c1ccccc1NS(=O)(=O)c1cccc([N+](=O)[O-])c1)c1ccc[nH]1	871596037	XLMVZFQWAMFPRS-UHFFFAOYSA-N	429.414	1.799	50	20	IDGD	
O=C(CN1CCN(c2ncnc3sccc23)CC1)NNC(=O)c1ccc([N+](=O)[O-])cc1	913041568	ZXGKBGMMIFCJGB-UHFFFAOYSA-N	441.473	1.183	50	20	IDGD	
O=C(CCNS(=O)(=O)/C=C\c1ccccc1)NNC(=O)c1nnc(O)c2ccccc12	913584057	FQMURQFXIXRSBE-QBFSEMIESA-N	441.469	1.077	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NN=C2CCN(S(=O)(=O)c3c(C)n[nH]c3C)CC2)c1	914554846	WNADDODCURJNNY-UHFFFAOYSA-N	433.534	1.979	50	20	IDGD	
Cc1ccc(-n2ncc(C(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)c2C2CC2)cc1Cl	914720181	VNFOZNJNLJZXHJ-CYBMUJFWSA-N	436.921	1.907	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)c2cn(-c3ccccc3Br)nn2)cc1	914748924	OMXPABGYECMIPK-UHFFFAOYSA-N	441.245	1.741	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(Cn3cccn3)o2)c1	915261789	YLOXWSDFNBTTTK-UHFFFAOYSA-N	445.501	1.630	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)CNS(=O)(=O)c2c(Cl)cccc2Cl)cc1	915771456	KDGWXKVHWIOTQV-UHFFFAOYSA-N	446.312	1.807	50	20	IDGD	
CC(C)CSc1ccc(S(=O)(=O)NCC(=O)NNC(=O)C(C)C)cc1[N+](=O)[O-]	915776002	MISFCISWIMHHHM-UHFFFAOYSA-N	432.524	1.425	50	20	IDGD	
Cc1c(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)oc2c1C(=O)CCC2	915802649	QABJTDMPEJDERT-UHFFFAOYSA-N	445.497	1.966	50	20	IDGD	
O=C(CN1c2cccc3cccc(c23)S1(=O)=O)NN=C1CCN(c2cnccn2)CC1	915954504	GIJKODOWDHVOCT-UHFFFAOYSA-N	436.497	1.911	50	20	IDGD	
CCS(=O)(=O)N1CCC(NC(=O)NNC(=O)c2ccc(-n3c(C)ccc3C)cc2)CC1	916259719	GKZLJYCBYHBIMQ-UHFFFAOYSA-N	447.561	1.852	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)NCc2cccnc2OCC(F)(F)F)cc1	916397845	LYGRHTVDITXGEK-UHFFFAOYSA-N	428.367	1.941	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2ccc(OCC(F)(F)F)nc2)c1	916398475	LGSVEPDJIGLADR-UHFFFAOYSA-N	446.407	1.570	50	20	IDGD	
O=C(CN1CCC(C(=O)Nc2ccc(Cl)cn2)CC1)NNC(=O)c1ccc(F)cc1	917401737	JYQPLXWZAUAWDG-UHFFFAOYSA-N	433.871	1.986	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)N[C@H](c2ccc3c(c2)OCCO3)C2CC2)c2ccccc2c1=O	918139943	NGWSCIKQVDORBQ-IBGZPJMESA-N	449.467	1.800	50	20	IDGD	
Cc1cc(-c2noc(CCC(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)n2)ccc1F	918204740	SYUCFRFTUUGSQC-UHFFFAOYSA-N	436.407	1.554	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)[C@H](C)NS(=O)(=O)c2ccc(Cl)cc2)cc1	919833026	QJISVEJBAYZJHD-ZDUSSCGKSA-N	439.921	1.796	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccc(F)cc2)c1C(F)(F)F)N[C@H]1CCS(=O)(=O)C1	919889549	OBKBFDBYNIRNRX-JTQLQIEISA-N	449.386	1.161	50	20	IDGD	
CC(C)(C)NC(=S)NNC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1	920208139	BJVAEFZRMNMVKP-GFCCVEGCSA-N	443.551	1.289	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2cccc(CN3CCN(C)CC3)c2)c2ccccc2c1=O	920275417	BYSLIKFCMQLSEG-UHFFFAOYSA-N	448.527	1.239	50	20	IDGD	
CCOc1ccc(NC(=O)CNC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1	920343242	QFEDBBPRBZBEDV-UHFFFAOYSA-N	434.474	1.072	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)Cn1c(C)c(C)sc1=O	920627983	CJYWJTSHLUBRIN-UHFFFAOYSA-N	427.866	1.193	50	20	IDGD	
O=C(NNC(=O)C1(c2cccc(Br)c2)CCCC1)N[C@H]1CCS(=O)(=O)C1	920745760	OXWSGJHMJFYOLU-AWEZNQCLSA-N	444.351	1.778	50	20	IDGD	
CN1CCN(c2ccc(CNC(=O)NNC(=O)c3ccc(Br)cc3)cn2)CC1	1317878408	HJWTZZYKCSMYMY-UHFFFAOYSA-N	447.337	1.740	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc4n(n3)CCCC4)C2)C1	1778565364	XKCIPZZCYQVTBD-KXBFYZLASA-N	439.354	1.836	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H]1C[C@H]1F)CCO2	1780098183	FHAINFYCAPBTHZ-NBQZKYEYSA-N	435.408	1.322	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@]2(C)CCCN2)C1	1780668449	SJRFLGZIZNQYRB-OSGQAZFXSA-N	430.387	1.673	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)n1	1781326490	PNKVZNFAYSKSFG-RHSMWYFYSA-N	443.273	1.174	50	20	IDGD	
O=C(c1[nH]nc2ncccc12)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781330544	BIHCPUIKYBCZRL-MLGOLLRUSA-N	426.246	1.092	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCc1cnc[nH]1)C2	1781997502	YWUZMZOKNHERCW-DDUZABMNSA-N	427.343	1.640	50	20	IDGD	
CCOc1cnc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)C(Cl)Cl)C2)cn1	1782216502	VEAHXEIWRCFNOD-FZKQIMNGSA-N	431.320	1.807	50	20	IDGD	
COc1ccc(CCC(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)c(OC)c1	1782991784	UNNVUFUOFOPVAN-LAUBAEHRSA-N	440.924	1.066	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)C3CCC(CO)CC3)CCO2)C1	1783341733	DNHODZPVKFFEAT-IADFQQGMSA-N	431.371	1.789	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)COCc3ccccc3)CCO2)C1	1783533428	VKUVRSNZTJLSRZ-HNAYVOBHSA-N	425.323	1.817	50	20	IDGD	
Cc1ncc(CC(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)s1	1784433277	DOZBTRSXOGBLDO-YVEFUNNKSA-N	430.368	1.855	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](NC(C)=O)C(C)(C)C)C[C@@H]21	1784615114	IBFHEBKAVRVAMD-JCECYMMASA-N	429.989	1.924	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)CN3C(=O)CSC3=S)C2)C1	1785540534	YFJQRFVFIVADBY-SJCJKPOMSA-N	433.983	1.084	50	20	IDGD	
Cc1ccc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]3C2)cc1[N+](=O)[O-]	1787448584	AKBSZMYPBBEMAK-DNUAJFIVSA-N	427.860	1.960	50	20	IDGD	
N#Cc1c[nH]c(C(=O)Nc2ccc(C3(NC(=O)c4ccc(B(O)O)cc4)CCC3)cc2)c1	1790144379	GUAFDKRPTDDIOL-UHFFFAOYSA-N	428.257	1.628	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(O)cc([N+](=O)[O-])c3)[C@H]2C1	1790216408	WVJRBGAZDOHRFL-SPOWBLRKSA-N	425.869	1.911	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3c(C)noc3C)C[C@@H]21	1790958571	VIHXDGKOQUFJNI-HJWJTTGWSA-N	442.354	1.987	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccccc3O)C[C@@H]21	1791063609	MVSJQSXKYAVSMV-DYWXZXKOSA-N	425.323	1.698	50	20	IDGD	
Cc1cc(C)n(CCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]3C2)n1	1791065382	WRVUUSNHPUHGTK-QZWWFDLISA-N	441.370	1.653	50	20	IDGD	
COc1ccc(-c2cc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@H](O)CCl)no2)cc1	1792978248	MQBLPNKEYUZWCH-QOIYZWAUSA-N	449.891	1.153	50	20	IDGD	
CC#C[C@@H](CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](O)CCl)c1ccc(O)cc1	1792982652	LIZXPDUBLPCZPG-JHLLAZCVSA-N	434.920	1.079	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccco1	1794616651	XSTDCZNRINVFBX-HBCWATKFSA-N	443.412	1.630	50	20	IDGD	
C[C@@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCBr)[C@@H]1SC(=N)NC1=O	1795492349	KAEXAINRECIMKV-HMUNZLOLSA-N	431.356	1.212	50	20	IDGD	
C=C(C)CC(C)(C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1	1796441705	SRDZTDCTKOCXCD-BRTCSPBQSA-N	443.548	1.702	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(N2CCOCC2)n1	1796618566	ZASQTGZWMYEBBC-YYAJDYIMSA-N	436.940	1.139	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc2cnccc2n1	1797407514	NCQNIKLDJWTRFX-MUJYYYPQSA-N	445.483	1.194	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(N(C)C)ccc1[N+](=O)[O-])C2	1799268937	OJMSBPHDAWGDDV-VLWCASSMSA-N	438.912	1.881	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3cccnc3n1)C2)[C@H](F)Br	1799349456	GKRLWOLTPFBHOC-NEBZKDRISA-N	437.269	1.524	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CC(c2ccccc2)=NN1	1800153800	UTONEIOAMMFQHT-NDLGOLERSA-N	432.952	1.750	50	20	IDGD	
Cc1c[nH]c(C)c1CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)Br	1800754023	CPKPOZYSSIWMBO-FRQROOTJSA-N	426.355	1.937	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nnsc1C1CC1)C2	1800757729	PCHNVUFUOLFRLX-IXLVHKGHSA-N	429.340	1.402	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c[nH]c3nccc-3c1Cl)C2	1800974788	ALVBMODDCONIHL-YHYOWMERSA-N	441.315	1.625	50	20	IDGD	
CC(C)[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCC(=O)NN(C)C)c1ccccc1	1801010610	LNNBFPHGXVVUHO-IYRWYFENSA-N	444.576	1.389	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C(Cl)Cl)c1ccc(N2CCOCC2)cn1	1802341079	HMPBIZVGYOQYLZ-BTTYYORXSA-N	427.332	1.974	50	20	IDGD	
COc1ccc(CC(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]2c2cccnc2)cc1	1803138277	INFYUGGZJPGVJC-YFVAEKQCSA-N	431.920	1.938	50	20	IDGD	
O=C(CCC1CCC1)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1803370126	JQMDEYHILXQWCM-REWPJTCUSA-N	435.333	1.661	50	20	IDGD	
Cc1cc(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)c(C)o1	1805561508	LNNGZEJISVQISW-DENIHFKCSA-N	447.300	1.605	50	20	IDGD	
Cc1noc(N)c1C(=O)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@H]1c1cccnc1	1807108298	VTXVSAVKKGEXGJ-UBHSHLNASA-N	440.273	1.970	50	20	IDGD	
O=C(CSc1ncccn1)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1	1807569644	RKJQCQYMHJGUQA-UXLLHSPISA-N	435.937	1.269	50	20	IDGD	
CC(C)=CCCC(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1807972344	GQCDSIALNRXMRW-REWPJTCUSA-N	435.333	1.827	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC2(CCCN(C(=O)CCN3CCN(C)CC3)C2)CC1	1809554437	IQCJANFMWJOSKF-QGZVFWFLSA-N	443.430	1.639	50	20	IDGD	
CN1CCN(CCC(=O)N2CCCC3(CCN(C(=O)[C@H](F)Br)CC3)C2)CC1	1809556447	SDASNLVRKMCAKK-KRWDZBQOSA-N	447.393	1.546	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)c1ccc2c(c1)CNC2=O	1810035558	NAJUFPVEEIOZLU-SNRMKQJTSA-N	442.903	1.244	50	20	IDGD	
O=C(CCn1cncn1)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@@H]1c1cccnc1	1813319957	CBNKVAWQVWROSY-NUEKZKHPSA-N	439.289	1.460	50	20	IDGD	
C[C@H](NC(=O)OC(C)(C)C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1	1814674830	YHRIXSCXBMPNJB-FPMFFAJLSA-N	443.932	1.915	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2COc3ccccc3O2)[nH]n1)[C@H](O)CCl	1814867141	GOQFOECDBOVKCL-VBQJREDUSA-N	434.880	1.842	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CN2C(=O)CNC2=O)n[nH]1	1815599834	SYCAKELBNPOECM-PIGZYNQJSA-N	445.307	1.190	50	20	IDGD	
O=C(CNC(=O)c1cccs1)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1	1815919725	FWTISOWSNBNPHX-STQMWFEESA-N	439.925	1.493	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)CC2(O)CCC2)[nH]n1	1819404754	XBQWRAATQQVTKW-MRXNPFEDSA-N	441.492	1.019	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](F)Br)[nH]n1	1819583211	GLPXFSSFNUECJI-GLXFQSAKSA-N	430.278	1.783	50	20	IDGD	
Cc1cc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)[nH]n2)ccn1	1819754562	GFPARGRDJZRTNW-GOSISDBHSA-N	448.487	1.731	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)CNC(=O)c3cc(C)on3)sc2C1	1819931263	RWDQFINAFSGZST-GHMZBOCLSA-N	439.925	1.799	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1	1822374330	JGDIKJRUMBAXEV-JSGCOSHPSA-N	428.921	1.029	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CN2CCOCC2)CC1	1824092335	CKGOMFSTSBMIQC-FUHWJXTLSA-N	444.414	1.969	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H]1CNC(=O)C1)CC2	1825451791	RFQWZFCEFDLXMU-BBBLOLIVSA-N	429.340	1.365	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H]2CCCO2)CC1	1827679435	CHFAFVSRPFPMKC-MOYYENFUSA-N	443.548	1.919	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2CC2(F)F)CC1	1828376978	QQTBNRXBQJPNMP-IRXDYDNUSA-N	435.475	1.574	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(C)=O)CCN2C(=O)OCc2ccccc2)C1	1828894066	BMMRRNXSPTULBR-RXVVDRJESA-N	437.924	1.712	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@H](F)Br)CC1	1829091616	IIVFIMLHDJQNRG-INWMFGNUSA-N	432.334	1.987	50	20	IDGD	
Cc1cnc2c(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)C(C)(C)CCl)CCO4)cnn2c1	1830362131	MBQISUOGYGVSAW-OAQYLSRUSA-N	449.939	1.373	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccccc3)C2)C1	1830543132	KLQUHZZPQAISFL-BEFAXECRSA-N	425.323	1.788	50	20	IDGD	
C=CCC(CC=C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)Br)C2)C1	1830644894	ZPRZHMQTCFTYCQ-DNVCBOLYSA-N	429.355	1.995	50	20	IDGD	
O=C(/C=C/c1cc2ccccc2o1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1830730898	GMUJISIVEDSQNB-TYNOOCNWSA-N	448.903	1.502	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1831654961	ZISLLDJTZYUHFI-HUBLWGQQSA-N	429.714	1.541	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(CO)c(F)c3)C2)C1	1831658412	FHKXGVXWYADEHX-DYESRHJHSA-N	442.915	1.796	50	20	IDGD	
CC(F)(F)C(C)(C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1831683062	PRYAWTSSBLSYPQ-BDJLRTHQSA-N	445.276	1.815	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccccc2O)CC1	1831871857	HNPPHWFHQQZJEB-LJQANCHMSA-N	430.549	1.999	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1)[C@@H](O)c1ccco1	1833088724	XBGHRPAPBFGZQG-JKSUJKDBSA-N	446.317	1.575	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1)c1cnccn1	1834123235	PUNGKLCGSQHUAA-HNNXBMFYSA-N	428.306	1.352	50	20	IDGD	
Cc1c(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](C)Br)CC3)CC2)cnn1C	1834281232	ZMHBLHUZQWEHQW-CYBMUJFWSA-N	440.386	1.697	50	20	IDGD	
CC[C@H](C)[C@@H](N)C(=O)NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1	1834684783	SEMLZSPUAANUPT-KBXCAEBGSA-N	431.419	1.716	50	20	IDGD	
O=C(CCc1ccsc1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1836007690	XOZVYBBHSLYLID-RDJZCZTQSA-N	449.342	1.828	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1	1836921982	GDLVCPZTGIFNKC-GOSISDBHSA-N	445.004	1.766	50	20	IDGD	
C[C@H](Sc1cccs1)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1	1837226692	JCDSQMVRDNHWKQ-DEYYWGMASA-N	448.994	1.285	50	20	IDGD	
C[C@H](C(=O)N1CCC(OC2CCN(C(=O)CCBr)CC2)CC1)n1ccnn1	1837655150	UJGBBIFCJSNKEO-CQSZACIVSA-N	442.358	1.623	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)c(C)n1	1838363871	RENGDBOAISYZRE-QAPCUYQASA-N	444.301	1.459	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccn(-c4ccccc4)n3)CCO2)C1	1838746691	JFVUKIILWYWRHE-PGRDOPGGSA-N	446.935	1.960	50	20	IDGD	
CCOc1cccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](Cl)COC)CCO3)c1	1840154123	LWXBVZKXWYTDSW-RXVVDRJESA-N	440.924	1.409	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)C3CC(C)(C)C3)CCO2)C1	1840222733	NEFUFQZSDFQWHI-IFXJQAMLSA-N	431.371	1.910	50	20	IDGD	
COc1ccc([C@@H]2C[C@@H]2C(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)cc1	1841573397	AFAIMWQREMAYKB-OALUTQOASA-N	449.511	1.314	50	20	IDGD	
COC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)[C@H](C)Br)C2	1843384903	NTGXWPOYTMZFHX-STQMWFEESA-N	448.358	1.513	50	20	IDGD	
COc1ccc(CC(=O)N2CC3(CCCN3C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)cc1	1843415767	KDXBKIPZKIAGLH-PCLIKHOPSA-N	437.500	1.575	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1ccc3scnc3c1)C2	1844264273	AKPHDRQVUCUYKI-UHFFFAOYSA-N	436.497	1.426	50	20	IDGD	
CC[C@H](C)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)[C@@H](O)CCl)C2	1845150563	IGQAZCQGYDZJTA-SOUVJXGZSA-N	431.961	1.729	50	20	IDGD	
COc1ccc(C2(C(=O)N3CCCC34CN(C(=O)c3ccc(B(O)O)cc3)C4)CCC2)cc1	1845161371	UKBVCXUGMRDEGY-UHFFFAOYSA-N	448.328	1.314	50	20	IDGD	
C[C@@H](CNC(=O)OCc1ccccc1)C(=O)N1CCCC12CN(C(=O)[C@@H](O)CCl)C2	1845197401	QGUJTDSEWSTHPQ-RDJZCZTQSA-N	437.924	1.352	50	20	IDGD	
C=CCC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)[C@H](O)CCl)C2	1845198990	WWVMFXFBWFNLPY-HUUCEWRRSA-N	429.945	1.649	50	20	IDGD	
CC[C@@H](NC(C)=O)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)/C(C#N)=C/c1ccc(F)cc1F	1847297996	CNPQESTXMSAACB-XIPMDINQSA-N	430.455	1.988	50	20	IDGD	
CC(=O)N/C(=C\c1ccco1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](C)CBr	1847499983	BYMWVZOHJOPJAR-OSJLAJRFSA-N	438.322	1.989	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)NC(=O)OC(C)(C)C	1847500661	LEEBMABUCPHNQB-CYDGBPFRSA-N	434.331	1.062	50	20	IDGD	
CC(C)[C@H](C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cnccc1C(=O)NN)c1ccccc1	1847615064	JNHLKYFEYIQSIX-ACRUOGEOSA-N	435.528	1.940	50	20	IDGD	
CC[C@@H](C)[C@@H](O)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O	1847831231	DHEWTGDEFKOFFF-VIXHLQAQSA-N	433.461	1.743	50	20	IDGD	
CCn1c(CCC(=O)NNC(=O)c2ccccc2)nc2cc(S(=O)(=O)N(C)C)ccc21	10740978	IEWKPUMVBHTPBP-UHFFFAOYSA-N	443.529	1.700	50	20	IDGD	
O=C(CCc1nc(=O)c2cnn(-c3ccccc3)c2[nH]1)NNC(=O)c1cccc([N+](=O)[O-])c1	17330064	DWMNBCNYEPKDQX-UHFFFAOYSA-N	447.411	1.411	50	20	IDGD	
CN(CC(=O)NNC(=O)CCc1ccccc1O)S(=O)(=O)c1ccc(Cl)cc1	17407783	GMXWDOIWBAPMOL-UHFFFAOYSA-N	425.894	1.446	50	20	IDGD	
CNS(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=O)c2cc(Br)c[nH]2)c1	28717713	JIAGOBXZQLCWCU-UHFFFAOYSA-N	435.687	1.414	50	20	IDGD	
COc1ccccc1NC(=S)NNC(=O)Cn1c(=O)ccn(Cc2ccccc2)c1=O	725909649	SVNBGZIGUNWSOS-UHFFFAOYSA-N	439.497	1.085	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)N1CCC(C(=O)Nc2ccc(F)cc2)CC1	726191356	AXSOKWBUNGDLHU-UHFFFAOYSA-N	431.424	1.240	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NN=Cc1ccc(OC(F)(F)[C@H](F)C(F)(F)F)cc1	728437234	NVAMPTUBXSVXSS-PRHODGIISA-N	435.346	1.946	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)Cc2csc(Cc3ccccc3)n2)n1	728722245	NTGQFEZZWNRRMB-UHFFFAOYSA-N	444.538	1.975	50	20	IDGD	
CS(=O)(=O)Nc1ccc(O)c(C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)c1	728971996	BXCJUIGCAUHHGE-UHFFFAOYSA-N	435.430	1.517	50	20	IDGD	
CC[C@@H](NC(=O)NNC(=O)COc1cc(C)ccc1C)c1cccc(S(N)(=O)=O)c1	729612591	FUQUMKLVIIOZQW-QGZVFWFLSA-N	434.518	1.811	50	20	IDGD	
CNC(=O)COc1ccc(C(=O)NNC(=S)Nc2ccc(N(C)C)cc2)cc1OC	729689707	FUXZDLFLLTXILO-UHFFFAOYSA-N	431.518	1.517	50	20	IDGD	
NC(=O)c1ncn2c(C(=O)NNC(=O)c3cccc4ncccc34)cc(-c3ccco3)nc12	730225159	QRNHYYZNBNMUNJ-UHFFFAOYSA-N	441.407	1.711	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])cc1	731051293	YFRLWTIBPLEQEP-UHFFFAOYSA-N	435.824	1.246	50	20	IDGD	
NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NNC(=O)Cc3ccccc3F)cc2)C1	731403776	VRRVGXNWFUHDLM-KRWDZBQOSA-N	427.480	1.601	50	20	IDGD	
Cc1c(C(=O)NNC(=O)COc2ccc(F)cc2)nnn1-c1ccc2c(c1)OCCO2	731471654	VNOWMGZYHAYZQW-UHFFFAOYSA-N	427.392	1.326	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)Sc1nnc2n(CCCOC)c(=O)c3ccccc3n12	731904765	QKOZOBFTHKTDHY-GFCCVEGCSA-N	432.506	1.119	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)C(=O)Nc1ccc(Br)cc1C(F)(F)F	732084682	WVUVMBDYPKXBNV-UHFFFAOYSA-N	434.172	1.899	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2nn(-c3ccc(F)cc3)c3c2CCC3)C[C@@H](C)O1	732261653	OECKOHFXYYIMOG-GASCZTMLSA-N	429.496	1.760	50	20	IDGD	
CCOCCCn1c(NNC(=O)[C@H](C(C)C)N2CCCC2=O)nc2ccccc2c1=O	733265400	CSMOPSUCPZSLBH-IBGZPJMESA-N	429.521	1.913	50	20	IDGD	
O=C(COc1ccc(F)cc1)NNC(=O)NCCN1CCN(C(=O)C2CCCCC2)CC1	733651047	DCBNPDPGAJYEDU-UHFFFAOYSA-N	449.527	1.259	50	20	IDGD	
CC(=O)[C@H]1CC(C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)=NN1c1ccccc1	734239181	IZFGCAQXYUWPFS-MRXNPFEDSA-N	432.481	1.065	50	20	IDGD	
CC(=O)N1CCN(S(=O)(=O)c2cccc(C(=O)NNc3ncccc3Cl)c2)CC1	734246164	YZYYZJRDUOZYRT-UHFFFAOYSA-N	437.909	1.345	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)CCc2cccc(Cl)c2)CC1	735117036	LXSYMWKPWJQGPW-UHFFFAOYSA-N	437.953	1.747	50	20	IDGD	
COC(=O)[C@H](NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)c1cccc(Cl)c1	735507638	NCONHESPQZBNSP-MRXNPFEDSA-N	425.894	1.739	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)c2ccccc2OCC(=O)N(C)C)cc1C	736763422	GHLGBTBJRJCTMF-UHFFFAOYSA-N	447.513	1.704	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)c2ccc(NC(=O)OC(C)(C)C)cc2O)C[C@@H](C)O1	740922008	NJRYOKNWOKJUEP-ZIAGYGMSSA-N	436.509	2.000	50	20	IDGD	
O=C(COC(=O)Cc1ccc(S(=O)(=O)C(F)F)cc1)NNC(=O)c1cccs1	741000268	XGNPMFSDUGMGCP-UHFFFAOYSA-N	432.426	1.291	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)NNC(=O)c2ccc(C#N)cc2)cc1Cl	743568145	FZVDJAAZDUUTTM-UHFFFAOYSA-N	432.824	1.910	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)N[C@H]1CC(=O)N(CCOc2ccccc2)C1	743623325	CQKFCTNOKMOIKW-SFHVURJKSA-N	426.473	1.214	50	20	IDGD	
CCS(=O)(=O)NCc1ccc(C(=O)NNC(=S)Nc2ccc(N(C)C)cc2)cc1	743823425	MWRFXOOIJGEEKS-UHFFFAOYSA-N	435.575	1.823	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)C[C@H](NC(N)=O)c2cccs2)cc1	743831263	UOLMAPWRJZJWSA-LBPRGKRZSA-N	425.492	1.104	50	20	IDGD	
CCn1cc(C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)c(=O)c2ccc(C)nc21	744471180	OISSEEIDQQLQPV-UHFFFAOYSA-N	433.424	1.215	50	20	IDGD	
CS[C@H]1CC[C@H](NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)C1	745896835	MNRTXFBHEZDYKK-GJZGRUSLSA-N	426.564	1.699	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)c1cccc(-n2cccn2)c1	745932700	OVGFSMOPVRWHSX-AWEZNQCLSA-N	431.456	1.824	50	20	IDGD	
N#CCCCS(=O)(=O)c1ccc(C(=O)NNC(=O)Cc2cn3ccccc3n2)cc1	746548409	HSACCTIAHIAOTI-UHFFFAOYSA-N	425.470	1.415	50	20	IDGD	
COc1cc(C)nc(NNC(=O)[C@H]2CCC[C@H](C(=O)NNc3nc(C)cc(OC)n3)C2)n1	746632897	LCCSBJOVUXNDLS-KBPBESRZSA-N	444.496	1.293	50	20	IDGD	
CN1CCN(Cc2ccc(CNC(=O)NNC(=O)Cc3cn4ccccc4n3)cc2)CC1	746745319	UTCCHCRAAOQWCZ-UHFFFAOYSA-N	435.532	1.155	50	20	IDGD	
Cc1c(C(=O)NNC(=O)NCc2ccco2)cc(Br)cc1S(N)(=O)=O	747367668	YQDUFRKGJBXUTO-UHFFFAOYSA-N	431.268	1.142	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)C1CCN(S(=O)(=O)c2ccc(F)c(F)c2)CC1	747599353	TYHPSDRBANGNJN-UHFFFAOYSA-N	426.445	1.165	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)CCOc3ccc(C=O)cc3)cc2)CC1	748618876	INVNMDWJFURFCK-UHFFFAOYSA-N	446.529	1.347	50	20	IDGD	
C[C@H]1C[C@@H](C)CN(C(=O)CN2CCN(C(=O)NNC(=O)c3cc4ccccc4o3)CC2)C1	750288942	NIRDRHTWKRHIKF-CALCHBBNSA-N	441.532	1.909	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NC[C@H](C)CNC(=O)OC(C)(C)C)nc1	750437526	CEWUQOLDSKKUJQ-ZDUSSCGKSA-N	444.558	1.555	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)Cc2cccc(Br)c2)ccc1Cl	751294144	MFWVWGQBYWUXEH-UHFFFAOYSA-N	446.710	1.754	50	20	IDGD	
COC(=O)c1c(Br)ccc(NC(=O)C(=O)NNc2nccnc2OC)c1C	753841230	MPZOTJJKRJHSEU-UHFFFAOYSA-N	438.238	1.425	50	20	IDGD	
C[C@H](NCC(=O)NNC(=O)c1cccc(C#N)c1)[C@H]1CCCN(C(=O)OC(C)(C)C)C1	754322120	XHIPDPVDTKBVOF-YJBOKZPZSA-N	429.521	1.944	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1cnn(C)c1)C(=O)NNC(=O)c1cc2c(s1)CCCCCC2	755052844	XVSDDYBZLZOELJ-GFCCVEGCSA-N	439.563	1.269	50	20	IDGD	
O=C(Cc1csc(N2CCOCC2)n1)NN=Cc1c(-n2ccnc2)nc2ccccn12	755599926	VCIFEWDGMLYCFJ-UHFFFAOYSA-N	436.501	1.506	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)Nc1ccc(CC(=O)NCC(=O)OC)cc1)c1ccccc1	755863942	ZRFUYQKWNFEVHA-GOSISDBHSA-N	426.473	1.865	50	20	IDGD	
CCOCCCn1c(NNC(=O)c2coc(S(=O)(=O)NC)c2)nc2ccccc2c1=O	755895318	AJVVVMKVCAQRSB-UHFFFAOYSA-N	449.489	1.081	50	20	IDGD	
Cc1ccc(C)c(OCC(=O)NNC(=O)Nc2cccc(OCCS(C)(=O)=O)c2)c1	756298566	ZQEWQJQAKFIXAD-UHFFFAOYSA-N	435.502	1.959	50	20	IDGD	
NC(=O)CCNC(=O)c1cccc(NC(=O)NNC(=O)C(F)(F)Oc2ccccc2)c1	756391290	LMRBKGOYBGJQQD-UHFFFAOYSA-N	435.387	1.116	50	20	IDGD	
COC(=O)CCc1nnc(NC(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)s1	756676508	MFMNXSVTWNKMNI-UHFFFAOYSA-N	439.450	1.136	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)NNC(=O)c2ccccc2OC)cc(S(C)(=O)=O)c1	757609069	KVGOKIVLLNRUSO-UHFFFAOYSA-N	435.458	1.742	50	20	IDGD	
COCCOc1ccc(CC(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1	757743731	NJTDQUGCDHSLCU-UHFFFAOYSA-N	441.893	1.016	50	20	IDGD	
COc1ccc([C@H](CNC(=O)NNC(=O)C(=O)Nc2ccccn2)N2CCCC2)cc1	758462680	XAPWNKFOZPQUCU-KRWDZBQOSA-N	426.477	1.196	50	20	IDGD	
O=C(COC(=O)c1cnc2ccc(F)cc2c1)NNC(=O)[C@@H]1COc2ccccc2O1	758624782	PLZBUMTYSIKHDN-SFHVURJKSA-N	425.372	1.518	50	20	IDGD	
C[C@@H](NC(=O)OC(C)(C)C)[C@H]1CCCN(CC(=O)NNC(=O)c2cccc(C#N)c2)C1	758791712	JBRXWAVOJHYCAQ-QAPCUYQASA-N	429.521	1.944	50	20	IDGD	
Cc1c(CCC(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)cnn1C	759607500	ZLLRYOGUEARCHE-UHFFFAOYSA-N	432.956	1.280	50	20	IDGD	
O=C(NNC(=O)c1cc(F)ccc1Br)NC1CCN(c2cccnn2)CC1	759629587	VTSXPIFRHYRMOW-UHFFFAOYSA-N	437.273	1.991	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)N2CCC(n3cc(C(=O)OC)nn3)CC2)c1C	760105491	UPIGTTFNGIFLEI-LDADJPATSA-N	440.504	1.900	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)N2CCC(N3CCS(=O)(=O)CC3)CC2)c1C	760436981	XGQQCHVRCLLLAN-HMMYKYKNSA-N	448.589	1.380	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)N[C@H]1CCCN(c2ccccc2F)C1=O	761820238	YQWQAXHKTDNVJQ-HNNXBMFYSA-N	428.420	1.737	50	20	IDGD	
O=C(NNC(=O)c1cccnc1)C(=O)Nc1ccc(S(=O)(=O)c2ccc(F)cc2)cc1	763488764	PNUWJSYRAQDDNC-UHFFFAOYSA-N	442.428	1.453	50	20	IDGD	
COC(=O)c1c(C2CC2)csc1NC(=O)C(=O)NNC(=O)c1ccc2c(c1)OCO2	763551321	OGEAJPQMVHRONU-UHFFFAOYSA-N	431.426	1.541	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)Nc1nc(-c2ccccc2F)cs1	763570352	DRQMGQJPBRYHKL-INIZCTEOSA-N	442.428	1.875	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)C(=O)Nc2ccc(F)c(C(N)=O)c2)c1	763600598	GIWUGDMOEVXLIT-UHFFFAOYSA-N	430.436	1.521	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc2c(cc1SC)OCCO2	763658673	ZZSUOFYOSNUBDK-UHFFFAOYSA-N	447.469	1.353	50	20	IDGD	
CN1C(=O)CCc2cc(NC(=O)C(=O)NNC(=O)CN3CCCc4ccccc43)ccc21	763729388	YCYNFKBZEWGYSX-UHFFFAOYSA-N	435.484	1.134	50	20	IDGD	
COCCCn1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc3ccccc3c2)n1	763851589	UJRFDLYNUGJIRH-HNNXBMFYSA-N	439.472	1.626	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2cc(Br)c(F)cc2Cl)n1	763890594	CNYALALUZPYRAG-UHFFFAOYSA-N	446.664	1.841	50	20	IDGD	
COC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2ccc(OC(C)C)c(OC)c2)c1C	763916909	XWEAWLDJBORKLV-UHFFFAOYSA-N	443.456	1.977	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)n(C(C)(C)C)n1	763945060	TZDLOFRDXACDLE-UHFFFAOYSA-N	425.449	1.238	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)C(=O)Nc1ccc2nc(C3CC3)oc2c1	763947946	GMPOJILQHUNDJJ-UHFFFAOYSA-N	446.423	1.996	50	20	IDGD	
Cn1nc(CC(C)(C)C)cc1NC(=O)C(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	763949272	OFCLQQVVFIFMDX-UHFFFAOYSA-N	439.476	1.300	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)C(=O)Nc1ccc(OCC2CCCCC2)cc1	763996768	FQSBJORZSAFSAB-HNNXBMFYSA-N	437.518	1.166	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)NC(=O)CS3)o1	764138100	AZLVMEXRXUJTJN-UHFFFAOYSA-N	445.501	1.565	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2cc(-c3nnco3)ccc2C)o1	764138150	DGPNXVXDKGRZIA-UHFFFAOYSA-N	440.460	1.880	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CCC2CCCCC2)cc1S(=O)(=O)N(C)C	764209818	DPDIPYZMSHNSLW-UHFFFAOYSA-N	438.550	1.692	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)c1ccc(OCc2cn3ccccc3n2)cc1	764342221	DRXWUJJDKNGLRG-UHFFFAOYSA-N	444.451	1.499	50	20	IDGD	
Cc1ccc(Cn2nc(C)c(C(=O)NNC(=O)CNC(=O)c3cccnc3)c2Cl)cc1	764344500	DWKXDWKITFALSX-UHFFFAOYSA-N	440.891	1.788	50	20	IDGD	
CN1CCN(c2ccccc2NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)CC1	764345974	OXIWUROSNJRBBN-UHFFFAOYSA-N	431.880	1.197	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)C(=O)Nc1ccc(F)c(NC(=O)Cc2ccccc2)c1	764355846	KEPDMJAZPITXQN-UHFFFAOYSA-N	449.442	1.731	50	20	IDGD	
C[C@H]1Oc2ccc(NC(=O)C(=O)NNC(=O)C(F)(F)Oc3ccccc3)cc2NC1=O	764380139	POIDNGJBQZVUOG-SNVBAGLBSA-N	434.355	1.164	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc(-n4nccn4)nc3)n[nH]2)cc1C	764387127	MZSPJGZKMIYFOA-UHFFFAOYSA-N	445.443	1.069	50	20	IDGD	
COC(=O)c1ccccc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccc(C)c(C)c2)[nH]n1	764387211	HJNHJLBFNZDDKL-UHFFFAOYSA-N	435.440	1.880	50	20	IDGD	
CC(C)(C)OC(=O)NNC(=O)C(=O)Nc1cccc(S(=O)(=O)N2CCCCC2)c1	765388429	CVRJRHJRANLSIA-UHFFFAOYSA-N	426.495	1.356	50	20	IDGD	
Cc1noc2ncc(C(=O)NNC(=O)CN3CCN(Cc4ccc(Cl)cc4)CC3)cc12	765751049	HPEXUVSNMDKLEJ-UHFFFAOYSA-N	442.907	1.763	50	20	IDGD	
O=C(CCC(=O)N1CCN(c2ccccn2)CC1)NNC(=O)c1cc2ccccc2cc1O	767826400	DMVYAGPYQZISBU-UHFFFAOYSA-N	447.495	1.830	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)[C@H](Cc1cccc(F)c1)n1nnnc1C	768631142	ZSURIOXYWPAPPH-HNNXBMFYSA-N	448.480	1.460	50	20	IDGD	
N#Cc1cc(Cl)nc(NNC(=O)c2cccc(S(=O)(=O)NC[C@H]3CCCO3)c2)c1	768711774	DPKCHFUZQWZSHT-CQSZACIVSA-N	435.893	1.821	50	20	IDGD	
Cc1sc2ncn(CC(=O)NNc3nc(O)c4cnn(C(C)(C)C)c4n3)c(=O)c2c1C	770958833	PNCBRFDOCHSOJA-UHFFFAOYSA-N	442.505	1.818	50	20	IDGD	
COc1cccc(/C=C(\C(=O)O[C@@H](C)C(=O)NNC(=O)CC(C)C)n2nnnc2C)c1	771922857	PWLLDCZVXYJCLY-HNEYUBDGSA-N	430.465	1.113	50	20	IDGD	
CCN1C(=O)c2ccccc2N2C(=O)CC[C@@]12C(=O)O[C@H](C)C(=O)NNC(=O)CC(C)C	771965002	BQTQJHVTVDWOJT-JLCFBVMHSA-N	444.488	1.111	50	20	IDGD	
CC(C)c1nccnc1NNC(=O)c1ccc2c(c1)S(=O)(=O)N(C[C@H]1CCCO1)C2=O	772847032	GGZIFYHZXJHONP-CQSZACIVSA-N	445.501	1.680	50	20	IDGD	
COc1ccccc1-c1nn(C)cc1C(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772883776	DZSMAINBVIWVLU-UHFFFAOYSA-N	441.875	1.827	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2ccc(C)c(F)c2)ccc1N1CCCC1=O	773890277	UPWSIDGHTPXTKB-UHFFFAOYSA-N	428.420	1.669	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)CCC(=O)N2C	774002504	QMDROKOFUUUOGI-GFCCVEGCSA-N	444.875	1.802	50	20	IDGD	
CN1CC(=O)N(Cc2ccc(C(N)=O)cc2NC(=O)NNc2ccc3ccccc3n2)C1=O	775666832	PXFRSHAWHNDLAW-UHFFFAOYSA-N	447.455	1.876	50	20	IDGD	
C[C@]12CCC(=O)N1c1ccccc1C(=O)N2CC(=O)NNc1cccc(S(C)(=O)=O)c1	776533529	FEBYKYNHOQZTST-OAQYLSRUSA-N	442.497	1.532	50	20	IDGD	
CCc1c(C(=O)N2CCN(S(=O)(=O)CBr)CC2)cnn1-c1ccccn1	777779529	OEYBLQOBMLLFGT-UHFFFAOYSA-N	442.339	1.270	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)c2ccc3c(c2)CCCN3S(C)(=O)=O)nc1C	778424369	PDQHBRIUQIIWOC-UHFFFAOYSA-N	433.490	1.431	50	20	IDGD	
CCOC(=O)N1[C@H](C(=O)NNC(=O)CNC(=O)OC(C)(C)C)CC[C@H]1c1ccc(C)o1	778441524	LWLWSPJNURUWFH-KBPBESRZSA-N	438.481	1.922	50	20	IDGD	
COc1ccc(Cl)cc1N1CC[C@@H](NC(=O)NNC(=O)CNC(=O)OC(C)(C)C)C1	778646348	JFYCDRPEIIHSFL-CYBMUJFWSA-N	441.916	1.782	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)CNC(=O)OC(C)(C)C)[C@@H]1CN(Cc2ccccc2)CCO1	778673620	BKRRTCYFQAJGOM-RDJZCZTQSA-N	435.525	1.131	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(C(=O)NNC(=O)c2cc(F)ccc2Br)n(C)c1	778674459	NPKVWABMPJDUBK-UHFFFAOYSA-N	447.286	1.252	50	20	IDGD	
COc1ccc(NNC(=O)[C@H](NS(=O)(=O)c2ccc(C)cc2)[C@H](C)O)c([N+](=O)[O-])c1	779535624	KAKRWUGQMPNILG-YVEFUNNKSA-N	438.462	1.083	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2ccc(OC3COC3)cc2)cc1	782093449	QWKBNDCTUJOZQQ-UHFFFAOYSA-N	448.501	1.246	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2cccc(CS(=O)(=O)NC(C)(C)C)c2)nc1	782145449	KIALOGZUPJCMEF-UHFFFAOYSA-N	435.506	1.390	50	20	IDGD	
O=C(NNc1ncnc2ccsc12)C(=O)Nc1cccc(C(=O)N2CCSCC2)c1	783253926	MAKDFKNAQPBONX-UHFFFAOYSA-N	442.526	1.962	50	20	IDGD	
C[C@@]1(NNC(=O)C(=O)Nc2ccc(Br)c3ccccc23)CCS(=O)(=O)C1	783427119	LRBLNSPPNWYEDA-QGZVFWFLSA-N	440.319	1.739	50	20	IDGD	
CCc1noc(-c2cc(Cl)ccc2NC(=O)C(=O)NN[C@]2(C)CCS(=O)(=O)C2)n1	783427176	QOZKRXIOMSHDCP-QGZVFWFLSA-N	441.897	1.089	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ccc(Br)c(C)c2)cc1-n1cnnn1	783923539	UASFSBQTJVFLLD-UHFFFAOYSA-N	446.265	1.824	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C(=O)Nc1ccc2c(cnn2C(F)F)c1	784005141	QPURDWMEPDUWGX-UHFFFAOYSA-N	436.400	1.009	50	20	IDGD	
CCOCc1cccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)c1	784212892	GRWYYAOSBUYBHB-UHFFFAOYSA-N	432.502	1.746	50	20	IDGD	
O=C(NNc1ccc(Br)nc1)C(=O)Nc1ccccc1CN1CCNC1=O	784806054	BJDOWLVXIOSGNR-UHFFFAOYSA-N	433.266	1.451	50	20	IDGD	
C=CCN(C)S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccc(F)c(F)c2F)cc1	784811963	VRNFLBCDDNRTJA-UHFFFAOYSA-N	442.419	1.992	50	20	IDGD	
Cc1c(CS(C)(=O)=O)cccc1NC(=O)C(=O)NNc1ccnc(Br)c1	784828667	NSBYNFFRZSTMHM-UHFFFAOYSA-N	441.307	1.779	50	20	IDGD	
O=C(NNc1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(C(=O)NC2CCOCC2)cc1	784832851	CMBJZAQIAVYYEV-UHFFFAOYSA-N	427.417	1.585	50	20	IDGD	
COc1cccc(NNC(=O)C(=O)Nc2ccc(C)c(S(=O)(=O)NC(C)(C)C)c2)n1	784849586	XVTRDRQCHXRSEM-UHFFFAOYSA-N	435.506	1.557	50	20	IDGD	
CN(NC(=O)Nc1ccc(-n2cnnn2)cc1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	785835642	PDLVNEJGHTUDRA-UHFFFAOYSA-N	445.484	1.303	50	20	IDGD	
CCCCn1ncc(NC(=O)C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c1C(C)C	792267829	DFCSXVJSDNTYOI-UHFFFAOYSA-N	449.533	1.610	50	20	IDGD	
Cc1cc(S(=O)(=O)NNC(=O)CNC(=O)OCc2ccccc2)cc(C(=O)O)c1F	794598597	IKROUZUFKMIGIC-UHFFFAOYSA-N	439.421	1.068	50	20	IDGD	
CCOC(=O)c1cc(S(=O)(=O)NNC(=O)COc2ccccc2OCC)ccc1C	795281442	VREZKNAUNAUTGT-UHFFFAOYSA-N	436.486	1.959	50	20	IDGD	
COC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)c1C	798044735	LWMRLAIZHMOZFE-YJBOKZPZSA-N	440.456	1.832	50	20	IDGD	
NS(=O)(=O)Cc1cccc(C(=O)NNC(=O)Nc2ccc(Br)cc2)c1	801996500	JWDRCWKMBOXBAV-UHFFFAOYSA-N	427.280	1.704	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(C(=O)NNC(=O)Nc2ccc3c(c2)OCO3)cc1	802098798	AWCHLZXIOMCUHL-UHFFFAOYSA-N	434.474	1.912	50	20	IDGD	
COc1ccc(C2=NO[C@@H](CNC(=O)NNC(=O)c3c(C)nc4ccccn34)C2)cc1F	802348000	MLORWTOTPUKISU-CQSZACIVSA-N	440.435	1.928	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)N2CCc3c(cccc3S(=O)(=O)N(C)C)C2)cc(C#N)n1C	803535065	QMHPZLARNURHRZ-ZDLGFXPLSA-N	437.525	1.947	50	20	IDGD	
CCN(CC)CC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)c2ccccc2F)c1	806972692	HEQPNCCUHJPOQQ-UHFFFAOYSA-N	429.452	1.506	50	20	IDGD	
CC1(C)CC(=O)c2cc(NC(=O)C(=O)NNC(=O)c3ccc4c(c3)OCCO4)ccc2O1	806977140	XGVXTKKHSWRXQO-UHFFFAOYSA-N	439.424	1.601	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12	808257275	BFQVCJJGWZFJLI-UHFFFAOYSA-N	430.446	1.441	50	20	IDGD	
Cn1nncc1NC(=O)C(=O)NNC(=O)c1ccc(COc2ccc3ccccc3c2)cc1	810384644	HZWICWHAXYTTTI-UHFFFAOYSA-N	444.451	1.947	50	20	IDGD	
COC(=O)c1c(F)ccc(NC(=O)C(=O)NNC(=O)c2cccc(OC(F)F)c2)c1F	810387266	NEYKNBYMSMPOAK-UHFFFAOYSA-N	443.309	1.753	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(N)=O)cc2OCC(F)F)cc1F	810387733	FVWZBEYDIDPHLN-UHFFFAOYSA-N	438.362	1.277	50	20	IDGD	
N#Cc1ccc(S(=O)(=O)NCC(=O)NNc2ccc(OCC(F)(F)F)cc2)cc1	810686938	ONWIFPPVHYCDSC-UHFFFAOYSA-N	428.392	1.921	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNS(=O)(=O)CCc1ccccc1Br	812266630	AHUKITSGZXFZMT-UHFFFAOYSA-N	446.348	1.434	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCc2nncn2C1)C(=O)Nc1cccc(Cl)c1Br	815691601	VMCUHBATVHGDNN-MRVPVSSYSA-N	441.673	1.043	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1ccc(Br)cc1	815751811	PAEZAHHHLXXGAC-UHFFFAOYSA-N	441.307	1.781	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1ccc(-c2cc[nH]n2)cc1	815752341	OCIXKDCLQAMEKA-UHFFFAOYSA-N	428.474	1.409	50	20	IDGD	
CC[C@@H](C)C(=O)NNC(=O)C[C@H]1c2cc(OC)c(OC)cc2CCN1S(C)(=O)=O	818038737	JNVGKFXUQIAETQ-DOMZBBRYSA-N	427.523	1.146	50	20	IDGD	
COC(=O)c1c(F)cccc1NNC(=O)CCc1c(C)nc(N2CCOCC2)nc1O	819715882	KRWVCYGHJAWFIT-UHFFFAOYSA-N	433.440	1.329	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)c2cnn(C)c2C)c1	822195867	KXHVLSZUVVUPPW-UHFFFAOYSA-N	443.485	1.613	50	20	IDGD	
O=C(Cc1ccc(S(=O)(=O)N2CCCC2)s1)NNC(=O)c1cccc([N+](=O)[O-])c1	866729520	NSJWVTLEYCQHGY-UHFFFAOYSA-N	438.487	1.445	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(S(=O)(=O)NNC(=O)c2cn(C)c3ccccc23)c1	884500589	KLOLNBZQJYAFBZ-UHFFFAOYSA-N	436.515	1.052	50	20	IDGD	
O=C(CSc1ccc(Cl)cc1)NNC(=O)C1CCN(c2ccc3nncn3n2)CC1	913464981	INNZFGGGVFPYTL-UHFFFAOYSA-N	445.936	1.934	50	20	IDGD	
C#CCNC(=O)NNC(=O)Cc1csc(=NCc2ccco2)n1-c1cccc(OC)c1	915908334	PRXJQTNMQDWXDM-UHFFFAOYSA-N	439.497	1.747	50	20	IDGD	
COc1cc(C(=O)NN=C2C(=O)Nc3cc(N4CCOCC4)ccc32)cc(OC)c1OC	915940731	CCOXTFJABHXLNZ-UHFFFAOYSA-N	440.456	1.635	50	20	IDGD	
O=C(NNC(=O)c1cccc[n+]1[O-])c1cccc(S(=O)(=O)Nc2ccccc2Cl)c1	916095748	QXOYCAORELLXQF-UHFFFAOYSA-N	446.872	1.849	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCc2ccc(C(=O)N(C)C)cc2)c2ccccc2c1=O	916250808	WYXBSBMPZZTDRD-UHFFFAOYSA-N	436.472	1.262	50	20	IDGD	
O=C(NCCCN1C(=O)NC2(CCCCC2)C1=O)NNC(=O)c1ccc2ccccc2n1	916267817	IUNABCPRQBZUJW-UHFFFAOYSA-N	438.488	1.824	50	20	IDGD	
COCCn1c(C)cc(/C=C(/C#N)C(=O)NCCS(=O)(=O)NCc2ccccc2)c1C	916385885	HJRDEHSGOCUIKT-STZFKDTASA-N	444.557	1.894	50	20	IDGD	
C[C@@H](Cn1ccnc1)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	916623088	BYCIWGCHMLSJEK-HNNXBMFYSA-N	434.522	1.090	50	20	IDGD	
C[C@@H](Cn1ccnc1)NC(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	916623192	IQJSPMQOBCKZIU-INIZCTEOSA-N	445.487	1.618	50	20	IDGD	
NS(=O)(=O)c1cccc(CNC(=O)NNC(=O)CCSc2ccc(F)cc2)c1	916625746	NZFOUZQWOZXEKP-UHFFFAOYSA-N	426.495	1.486	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)CCCNC(=O)OCc2ccccc2)c2ccccc2c1=O	917387905	QJGKGXKTYZMMFM-UHFFFAOYSA-N	437.456	1.401	50	20	IDGD	
CCOc1ccc2cc(C(=O)NNC(=O)c3ccc(Cl)c(S(N)(=O)=O)c3)[nH]c2c1	917919633	UNHDTJNOCNCNNR-UHFFFAOYSA-N	436.877	1.942	50	20	IDGD	
CN(C)[C@H](CNC(=O)NNC(=O)c1nn(-c2ccccc2)cc1O)c1ccc(F)cc1	918091342	RXNIHOVSGHHRJM-QGZVFWFLSA-N	426.452	1.964	50	20	IDGD	
CCCCn1c(C)cc(/C=C(/C#N)C(=O)NCCC(=O)N[C@H]2CCS(=O)(=O)C2)c1C	918569841	LFKZVGQKXOOQNI-OVCORXIESA-N	434.562	1.622	50	20	IDGD	
COc1cc(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)ccc1OCc1ccccc1	919883914	FBXDYIDZVALZQK-MRXNPFEDSA-N	433.486	1.405	50	20	IDGD	
C[C@H](COc1ccc(F)cc1F)NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	919921910	JILKXLDAMRRIKZ-LLVKDONJSA-N	431.399	1.623	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)N2CCC(=NNC(=O)c3ccc(N)cc3)CC2)cc1	920358633	XMNZMHNTVNDPOI-UHFFFAOYSA-N	429.502	1.798	50	20	IDGD	
O=C(NN=Cc1c(N2CCOCC2)nc2ccccn2c1=O)c1nnc(-c2ccccc2)o1	920385039	KESPVNFUSBAHRL-UHFFFAOYSA-N	445.439	1.345	50	20	IDGD	
CC(C)c1ccc(OCC(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1	921178819	QYHFDAVZQNQDCS-LJQANCHMSA-N	428.441	1.719	50	20	IDGD	
O=C(NCCS(=O)(=O)c1ccccc1)NNC(=O)c1ccc(Br)cc1	1115890747	NZLZHQWKFSAYQG-UHFFFAOYSA-N	426.292	1.867	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)CC1(CC(=O)N2CCOCC2)CCCC1	1317707623	SIVJDGZPHLJTGS-UHFFFAOYSA-N	447.532	1.811	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)NCCN2Cc3ccccc3C2)CC1	1318622800	JVCIUFIXASQMIG-UHFFFAOYSA-N	431.537	1.980	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=S)Nc2cccc(F)c2F)cc1	1319432878	RKTBQFVWMYWFCL-UHFFFAOYSA-N	428.486	1.912	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2cc(N3CCOC3=O)ccc2F)c1	1320119309	ZXOZLQOPUAESBA-UHFFFAOYSA-N	436.421	1.652	50	20	IDGD	
CC(C)[C@H](C(=O)NNC(=O)c1cncn1-c1ccccc1)N1C(=O)c2ccccc2C1=O	1321994289	CWFAPDLRZYGBSH-LJQANCHMSA-N	431.452	1.954	50	20	IDGD	
COc1ccc(-c2n[nH]c(CNC(=O)NNC(=O)c3cncn3-c3ccccc3)n2)cc1	1323135343	HWVVYWAGULLWFN-UHFFFAOYSA-N	432.444	1.810	50	20	IDGD	
CN(CCO)S(=O)(=O)c1ccc(C(=O)NNC(=S)Nc2cccc(Cl)c2)cc1	1332292446	OUWRBZJZNFJQFF-UHFFFAOYSA-N	442.950	1.584	50	20	IDGD	
O=C(c1ccc2nonc2c1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1777718652	CZIBULUXJJCSBJ-CZUORRHYSA-N	427.230	1.357	50	20	IDGD	
Cc1ccc(=O)n(C(C)(C)C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](F)Cl)C2)n1	1778031209	SJPFQDJJGKSTNY-AKCHCHLHSA-N	442.919	1.335	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc4n(n3)CCCO4)C2)C1	1778553334	AKSOWVYJQIUEKK-UGSOOPFHSA-N	441.326	1.140	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnc3[nH]ncc3c2)C1	1778936247	BMZKWQXRCQYILR-DYESRHJHSA-N	445.596	1.937	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@]2(C1)CN(C(=O)c1nc(O)n3c1CCCC3)CCO2	1779297810	ALSHTIVQJWPEPT-FQEVSTJZSA-N	436.585	1.220	50	20	IDGD	
Cn1cc2cc(C(=O)N3CCO[C@]4(CCN(C(=O)CO[Si](C)(C)C)C4)C3)ccc2n1	1779298157	AYXOZGXVUFVFCC-NRFANRHFSA-N	430.581	1.868	50	20	IDGD	
CCc1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](C)Br)C3)nn1C	1779910861	FKNHNQWHLJIBTG-VVFCZOMOSA-N	441.370	1.893	50	20	IDGD	
C[C@H]1Oc2ccc(C(=O)N3CC[C@]4(C3)CN(C(=O)C(Cl)Cl)CCO4)cc2NC1=O	1780181616	XQMICXVHDGGBEL-WYRIXSBYSA-N	442.299	1.653	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)N1CCN(C)CC1)C2	1780708676	YBLKERZPLPTQGK-NEYJZJCJSA-N	429.005	1.154	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)Cc3ccc(OC)cc3[N+](=O)[O-])CCO2)C1	1781216569	LRCIBEAFESQRQN-UZLBHIALSA-N	439.896	1.993	50	20	IDGD	
CCN(CC)C[C@@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](Cl)COC)C2	1781507822	JDUSTVGYXGLEKS-NEYJZJCJSA-N	432.005	1.732	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnn4c3CCC4)C2)C1	1782322911	UYBJEYQZWNCXMZ-KDOFPFPSSA-N	425.327	1.446	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)nc2nccn12	1782357605	UVYVAKOIYOKLLK-SCLBCKFNSA-N	436.310	1.265	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CSc2nc[nH]n2)C1	1782476104	FEQLOOHBRZTPJP-PMUMKWKESA-N	429.974	1.818	50	20	IDGD	
Cc1cccc(F)c1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)C2	1782872240	YTBSNUFCHRCPQZ-WZONZLPQSA-N	448.539	1.635	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ncc(Cl)cn3)CCO2)C1	1783343374	HLKWKXNTTKFJOW-WBMJQRKESA-N	431.718	1.747	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3n[nH]c4c3CCCC4)CCO2)C1	1783347784	OSXDGQKVJKMAJH-LIRRHRJNSA-N	439.354	1.906	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cccc(F)c3[N+](=O)[O-])CCO2)C1	1783882454	YZYLOYBYMREKQY-SCLBCKFNSA-N	429.832	1.431	50	20	IDGD	
CC(=O)Nc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]3C2)ccc1C	1784091827	ADXZLGRHNAFIKV-CAMMJAKZSA-N	437.924	1.146	50	20	IDGD	
CC1CCN(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CO[Si](C)(C)C)C[C@@H]32)CC1	1784316850	UPNDUUFXGAAUFR-FHWLQOOXSA-N	425.646	1.550	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@](C)(O)C(F)(F)F)[C@H]2C1	1784877653	RKFNTXUKDPQAPO-VITBEWHZSA-N	431.249	1.063	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(C(N)=O)cc3)C2)C1	1784931189	CHEZWDRXAUUSBI-KXBFYZLASA-N	438.322	1.403	50	20	IDGD	
CCN1CCC(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)CC1	1785638919	FIQBPLQJBSQXKV-BEFAXECRSA-N	430.387	1.579	50	20	IDGD	
COC[C@H](Cl)C(=O)NC1(c2ccc(NC(=O)CCN3C(=O)C=CC3=O)cc2)CCC1	1786554179	SVYGWBMDSBDJPC-INIZCTEOSA-N	433.892	1.689	50	20	IDGD	
COCCn1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]32)n1	1787637176	PQCNDCYZFPNOHB-PWDMQXDWSA-N	447.363	1.359	50	20	IDGD	
CC1CCN(CC(=O)NC2(c3ccc(NC(=O)c4cccc(B(O)O)c4)cc3)CCC2)CC1	1788145246	VKLMJGKVWSKJHO-UHFFFAOYSA-N	449.360	1.846	50	20	IDGD	
CCCC(=O)N[C@@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)CBr)C[C@@H]21	1788738718	GLLCIZKEPBTRHB-YXMSTPNBSA-N	446.386	1.302	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ncccc3F)[C@H]2C1	1789051003	PULLCYRMROEOSC-OSFYFWSMSA-N	428.302	1.845	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(F)nc1F	1792376777	OJQXFMGOMOYTNW-QPPBUOOMSA-N	432.265	1.737	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)Nc1nccs1)C2	1792867558	CSNRZTUXUMVMPE-XHJNMGKDSA-N	445.383	1.564	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/C(=O)NCc1ccccc1	1793074640	QXYBLOWRHJLNSN-PQQJDVFMSA-N	433.936	1.751	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)NC(=O)c1ccccc1)C2	1793455173	CVRWAHYKDDUZIQ-UJCHZGTJSA-N	435.952	1.802	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)Cn1cccn1	1794210035	DJPGNZNUCNFINK-RBGFHDKUSA-N	427.343	1.282	50	20	IDGD	
Nc1ccccc1/C=C/C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2	1795652924	WPPCRXLXEKRRSC-OWOJSOJESA-N	426.286	1.562	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)c1cccc2c1CCCC2	1796192937	ZOQSNLAHCPQDNK-WKCHPHFGSA-N	432.329	1.811	50	20	IDGD	
Cc1ccn2ncc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)CO[Si](C)(C)C)C4)c2c1	1796269318	AABXNDUEQWWPGH-CWPLJXCYSA-N	430.581	1.697	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)COc1cccnc1)C2	1796891027	YBBZJEXIGVNOLH-OSSGZSMMSA-N	438.488	1.233	50	20	IDGD	
CCc1[nH]nc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)c1Cl	1798440419	OADMADBVFDKDDC-ZSBIGDGJSA-N	445.911	1.190	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccccc1-n1nccn1	1799670829	NVRSHKGHORKZOU-HIRMHNASSA-N	431.924	1.878	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1n[nH]c3cc(Cl)ccc13)C2	1800977189	TWCXMIGPHBWFGT-VAECKANCSA-N	441.315	1.673	50	20	IDGD	
C=CCC(CC=C)C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1803081770	HJZHPZSUJCLHPL-GMAHTHKFSA-N	447.344	1.849	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cnc3[nH]ncc3c2)[C@@H]1c1cccnc1)[C@H](O)CCl	1803143120	UTBVDCOWBLXWBY-IAOVAPTHSA-N	428.880	1.272	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2cc(C(=O)O)ncn2)[C@H]1c1cccnc1	1804972706	GDCNTROTAVEPSD-JKIFEVAISA-N	447.879	1.143	50	20	IDGD	
O=C([C@@H](O)CCl)N1CCCC2(CCN(C(=O)[C@H]3CC(c4ccccc4)=NN3)CC2)C1	1805525851	HDTJHWNEBHIKHF-MOPGFXCFSA-N	432.952	1.584	50	20	IDGD	
Cc1cc(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)c(C)o1	1805562246	SWAJCSDHMSPLEN-SIKLNZKXSA-N	447.300	1.605	50	20	IDGD	
Cc1cc(C(=O)NC[C@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)on1	1805706025	JDUCLDTVXQTJKA-DNVCBOLYSA-N	449.471	1.010	50	20	IDGD	
Cn1cc(CC(=O)N2CC[C@H](CNC(=O)CCBr)[C@@H]2c2cccnc2)cn1	1806346484	IBJQZXIZFFMJFB-APWZRJJASA-N	434.338	1.849	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccccc2F)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807359981	FYZZMNRCWIARIX-PGRDOPGGSA-N	447.275	1.534	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@H](CNC(=O)c2nc[nH]c2[N+](=O)[O-])[C@@H]1c1cccnc1	1808370859	FFUPKFLMIMMYRE-YOEHRIQHSA-N	446.540	1.884	50	20	IDGD	
O=C(C(=O)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1)c1ccccc1	1809968399	ZKABQEBNPVRACC-UHFFFAOYSA-N	434.301	1.094	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)c2ccc[nH]2)[C@H]1c1cccnc1	1810303552	VDAHZDCXPJJSML-KXBFYZLASA-N	433.472	1.042	50	20	IDGD	
COc1cc(C(=O)N2CC[C@@H](CNC(=O)CO[Si](C)(C)C)[C@@H]2c2cccnc2)nn1C	1810543704	DUXYDFZINYVBRD-JXFKEZNVSA-N	445.596	1.995	50	20	IDGD	
CC(=O)N/C(C)=C/C(=O)NC[C@H]1CCN(C(=O)CO[Si](C)(C)C)[C@H]1c1cccnc1	1812320067	WCTMEXMSKOEDBV-YQUMUYQISA-N	432.597	1.979	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1	1812808429	PCUNHYPWOROQRB-UXLLHSPISA-N	440.928	1.212	50	20	IDGD	
CC(=O)C[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1813011104	FUYWWLUSVVQZLU-XERREHJYSA-N	431.537	1.076	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2ncn(C(C)C)n2)[C@@H]1c1cccnc1	1813030707	LNGQERYJZGYKLI-YESZJQIVSA-N	434.928	1.827	50	20	IDGD	
C[C@H](C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)n1cccc1	1813309521	NLMDEKLYPHASGL-NQSCKRDGSA-N	446.316	1.144	50	20	IDGD	
Cc1cccc(CC(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cccc(B(O)O)c2)CC3)c1	1813906626	AALCFHZVKVYICP-SFHVURJKSA-N	449.341	1.600	50	20	IDGD	
C[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](O)CCl)n[nH]1	1814878065	SUQPDZOUJFDKIU-BNOWGMLFSA-N	443.932	1.915	50	20	IDGD	
C=CCOCCCC(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1	1815335686	KGEWVJZINBJBMD-MRXNPFEDSA-N	443.334	1.032	50	20	IDGD	
C[C@@H](C(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1)c1ccccc1	1815347749	NIAUMAASHMIPMI-KDOFPFPSSA-N	449.341	1.852	50	20	IDGD	
O=C(CNC(=O)c1cccs1)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1	1815919724	FWTISOWSNBNPHX-QWHCGFSZSA-N	439.925	1.493	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1	1817475965	XPCMIQWWEHSTTD-ABAIWWIYSA-N	449.114	1.179	50	20	IDGD	
COC[C@@H](NC(C)=O)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CO[Si](C)(C)C)n[nH]1	1819595706	YLHXGYICAXFXCP-CVEARBPZSA-N	439.589	1.404	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)CN2C(=O)C=CC2=O)[nH]n1)[C@H](F)Br	1820938486	WHJIVAVUVPVYAX-BONVTDFDSA-N	442.245	1.017	50	20	IDGD	
Cc1cnc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)cn1	1822413200	OBPDLFVYIXGALO-MRXNPFEDSA-N	428.497	1.187	50	20	IDGD	
CCC(=O)N[C@H](C)C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1	1822999033	NKEXQFMDGAOXIT-RGNHYFCHSA-N	435.319	1.660	50	20	IDGD	
Cc1cnn(CC(=O)N[C@H]2CCc3nc(NC(=O)[C@@H](F)Br)sc3C2)c1	1823005185	XRDCANLIDKKMCO-TVQRCGJNSA-N	430.303	1.951	50	20	IDGD	
CCC[C@H](NC(C)=O)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](Cl)COC)[nH]n1	1823441895	CHWIJPUIVQPIFL-OFQRWUPVSA-N	427.933	1.960	50	20	IDGD	
O=C([C@H](O)CCl)N1CCC([C@@H]2CCCCN2C(=O)Cn2cc([N+](=O)[O-])cn2)CC1	1825125826	XVQNGZVWEVYMDX-JKSUJKDBSA-N	427.889	1.011	50	20	IDGD	
CC[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CNC(=O)OC)CC2	1825453126	PEFPVMWZUAXYEM-DTWKUNHWSA-N	433.328	1.585	50	20	IDGD	
COCc1oncc1C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](Cl)COC)sc2C1	1825999161	RQXFJVQCRVCTKX-ONGXEEELSA-N	428.898	1.757	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](C)n3cnnn3)sc2C1	1826973973	WFOFOZUUUSUHGY-KXUCPTDWSA-N	442.343	1.334	50	20	IDGD	
C[C@@H]1CC[C@H](C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)O1	1828402221	GPECVVSJNXEGLC-MAODMQOUSA-N	428.338	1.167	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cnsn2)CC1	1828925125	FKHGFVIZEQZYSZ-QGZVFWFLSA-N	443.533	1.084	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1830533155	GZOFBCITQUNYGR-DYVFJYSZSA-N	439.778	1.739	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1	1830533156	GZOFBCITQUNYGR-GUYCJALGSA-N	439.778	1.739	50	20	IDGD	
O=C([C@@H](O)CCl)N1CCC([C@H]2CCCCN2C(=O)c2cnc3c(c2)CCNCC3)CC1	1831148264	UWLBHNLECSDCFP-RTWAWAEBSA-N	448.995	1.603	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3csc(C)n3)C2)C1	1831640972	UFLGOHUBFNFDCW-LPHOPBHVSA-N	429.970	1.858	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@H]2CCNC(=O)C2)CC1	1831656796	KVLSVNJOANTPSZ-BPUTZDHNSA-N	428.371	1.916	50	20	IDGD	
CC(C)[C@H](O)C(=O)NC1CCN(C2CCN(C(=O)[C@H](C)CBr)CC2)CC1	1833344042	RWHGJKIFUSUJFR-PBHICJAKSA-N	432.403	1.606	50	20	IDGD	
C[C@H](Nc1ccccn1)C(=O)N1CCC(N2CCC(NC(=O)[C@H](F)Cl)CC2)CC1	1835084163	OHSPGZHYJGPVMF-KSSFIOAISA-N	425.936	1.988	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1835305247	NHDNBKQVLVJAAZ-GOSISDBHSA-N	447.967	1.428	50	20	IDGD	
CC(C)Cc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)n(C)n1	1836337298	WVJCGXFYGWWFHU-APWZRJJASA-N	430.908	1.223	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H]3[C@H]4COC[C@H]43)CC2)CC1)[C@H](F)Br	1836414597	SVMVBIPWOMMCAQ-JJXSEGSLSA-N	432.334	1.141	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnn4cc(C)cnc34)CCO2)C1	1836949470	NBHUSQHMENRTGU-JXFKEZNVSA-N	435.912	1.125	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(Cl)nn3)CCO2)C1	1837833123	RUUUXWCTSZPDNP-UGSOOPFHSA-N	431.320	1.608	50	20	IDGD	
CCC1(C(=O)N2CCC(OC3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)CCC1	1837919319	XYORUPQPYZNDAQ-UHFFFAOYSA-N	442.365	1.559	50	20	IDGD	
CCn1nc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@](C)(Cl)CCl)C3)C2)cc1C	1838152054	BVBMVNLADLFVLT-RTBURBONSA-N	447.363	1.518	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)COCCO)CC2)CC1	1838647729	YBNBHQZLQHYRQM-MRXNPFEDSA-N	435.359	1.167	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(F)cn3)C2)C1	1839151466	SDVFXCCJGVWMGX-ROUUACIJSA-N	434.295	1.527	50	20	IDGD	
COc1cc(C)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)c(C)c1	1839408354	PTHYZEQXPLJJKM-XLIONFOSSA-N	428.888	1.916	50	20	IDGD	
O=C(c1ccnc2ncccc12)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1839543729	YUHPTFGTDRDCQH-IBGZPJMESA-N	439.299	1.504	50	20	IDGD	
CCc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](Br)CC)CCO3)no1	1839966281	ZUYBSKMAHGCBRQ-KBXCAEBGSA-N	444.326	1.481	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccccc3F)C2)C1	1840032391	XNWCYJFNGUOXRK-KUHUBIRLSA-N	443.313	1.608	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3cnccc3C)C2)C1	1840150895	SJTUGYFYDDAXLQ-GHTZIAJQSA-N	439.940	1.033	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CNc3ccccc3C)C2)C1	1840152098	XGGGJPXPGIJBCC-UWJYYQICSA-N	439.940	1.117	50	20	IDGD	
C[C@@H](Nc1ccccc1)C(=O)N1CCOC[C@]2(CN(C(=O)C(Cl)Cl)CCO2)C1	1840188349	FPFMVTOJAKKGQL-AUUYWEPGSA-N	430.332	1.747	50	20	IDGD	
O=C(c1cc2ccoc2cn1)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840189790	LWHHHUJVPGOOCE-SFHVURJKSA-N	428.272	1.702	50	20	IDGD	
O=C([C@@H]1CCCSC1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1840865305	MVYSHZKLRGUNML-WWGRRREGSA-N	439.347	1.277	50	20	IDGD	
CCC1(C(=O)N2CC3(CCCN3C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)COC1	1841925226	AHECEPLGKKXPFZ-AWEZNQCLSA-N	429.945	1.749	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)Cc2cc(C)no2)C1	1841930052	DOVHOWMPYYVYRM-UHFFFAOYSA-N	442.428	1.876	50	20	IDGD	
CC(C)(C)OC(=O)N1CC2(CC[C@@H](C(=O)N3CC4(CCCN4C(=O)[C@H](F)Cl)C3)O2)C1	1843361483	KFIFKXHHKTXPCY-KBPBESRZSA-N	445.919	1.893	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)[C@@H](C)Cc1ccncc1)C2	1843417117	YBGGRVXKLNLLPC-MQISTKKBSA-N	436.516	1.598	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1ccc(C(F)(F)F)cc1)C2	1844264725	ALOREPIFLYFSAJ-UHFFFAOYSA-N	447.417	1.835	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@H]2CC23CN(C(=O)OC(C)(C)C)C3)C1	1846118496	MXWZMZSPFDWGNT-CABCVRRESA-N	441.956	1.701	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@H](C)NC(=O)OCc1ccccc1)C2	1846365000	VNRYEFMEYLTSPS-NVXWUHKLSA-N	437.924	1.759	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H]1C[C@@H]1c1ccc(F)c(F)c1	1847608205	VGYWJMIGAAOYBP-SEONNTABSA-N	440.255	1.264	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CSc1nnc(-c2cccs2)n1N	11591865	RUDQRCIMNNSGAA-UHFFFAOYSA-N	438.922	1.936	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C1CCN(S(=O)(=O)c2ccccc2)CC1	15879414	REEPDXZMYHMIGE-UHFFFAOYSA-N	447.513	1.322	50	20	IDGD	
Cc1ccc(C)c(S(=O)(=O)NCCC(=O)NNC(=O)c2cc(-c3ccccc3)n[nH]2)c1	17518953	HASZCLSOXAZTGG-UHFFFAOYSA-N	441.513	1.823	50	20	IDGD	
N#Cc1nc(-c2ccco2)oc1N1CCN(CC(=O)NNC(=O)c2ccc(F)cc2)CC1	43754025	FPTNEDLUSNZGCX-UHFFFAOYSA-N	438.419	1.529	50	20	IDGD	
O=C(CCCNc1ccc([N+](=O)[O-])cc1)NNC(=O)c1csc(N2CCOCC2)n1	105006371	CAJISXUOOSMBQR-UHFFFAOYSA-N	434.478	1.541	50	20	IDGD	
C[C@H](OCc1ccccc1)C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	106124529	RSZHOYIPVKRAJB-INIZCTEOSA-N	431.514	1.837	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1ccc([N+](=O)[O-])c(OC)c1	725946707	BOTJTTVZHJBFSU-UHFFFAOYSA-N	437.792	1.883	50	20	IDGD	
Cn1nc(Br)c2c(=O)n(CC(=O)NN=c3sc4ccccc4n3C)cnc21	727061190	HLHXFDKUUCBHAV-UHFFFAOYSA-N	448.306	1.078	50	20	IDGD	
C[C@H]1Oc2ccccc2O[C@H]1C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	728214921	UXIAHMYJCLBADU-FOIQADDNSA-N	446.529	1.294	50	20	IDGD	
Cc1nn(-c2ccccc2)cc1C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	728341118	FJHAVNCNPWTKAP-IBGZPJMESA-N	436.424	1.325	50	20	IDGD	
CCS(=O)(=O)N1CCC[C@@H](C(=O)NNC(=O)c2cc(OC)ccc2Br)C1	728526312	QLNGVCXJHIHUTO-LLVKDONJSA-N	448.339	1.280	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)ccc1F	728798130	XVKQVDAJEHCGOF-UHFFFAOYSA-N	449.504	1.549	50	20	IDGD	
CC(C)(C)OC(=O)NC1(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)CCCC1	728889870	GRTXGJWEDAOYSZ-UHFFFAOYSA-N	432.525	1.678	50	20	IDGD	
O=C(CSCC(=O)Nc1cccc(Br)c1)NNC(=O)Cc1cccnc1	728982320	YCDXDEZSIJOVQU-UHFFFAOYSA-N	437.319	1.906	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc3ccccc3n2CC#N)c1	729298101	ROEZJCXLMLSQFM-UHFFFAOYSA-N	425.470	1.490	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNS(=O)(=O)c1ccc(S(=O)(=O)NC2CC2)cc1	729667390	NNYOYCCUJBUXLY-UHFFFAOYSA-N	448.526	1.092	50	20	IDGD	
COc1ccc(C(=O)NN=c2cc[nH]c3ccccc23)cc1S(=O)(=O)N1CCOCC1	730289157	XLBSWRHSSCJXRA-UHFFFAOYSA-N	442.497	1.443	50	20	IDGD	
CCCS(=O)(=O)c1ccccc1S[C@H](C)C(=O)N([C@@H]1CCS(=O)(=O)C1)N(C)C	730452059	VNXBFBVMDPLBOP-HUUCEWRRSA-N	448.632	1.843	50	20	IDGD	
C[C@H]1CN(Cc2cccc(CNC(=O)NNC(=O)COc3ccccc3O)c2)CCO1	730825133	RBBFTNONAMXSET-INIZCTEOSA-N	428.489	1.522	50	20	IDGD	
CCCCN(C)C(=O)c1ccccc1S(=O)(=O)NNC(=O)c1cccc(OC)c1O	731467753	WKWXRFASCXLKGP-UHFFFAOYSA-N	435.502	1.896	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)Sc1nc2cc(S(=O)(=O)N(C)C)ccc2o1	731904368	JDPOWBMOQFXWMI-NSHDSACASA-N	428.536	1.752	50	20	IDGD	
CN1C(=C(C#N)C(=O)COC(=O)C2CCC3(CC2)NC(=O)NC3=O)N(C)c2ccccc21	731907492	HUQBWLMDXYORIA-UHFFFAOYSA-N	437.456	1.188	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(/C#N)C(=O)NNC(=O)CCN2C[C@H](C)O[C@H](C)C2)c1C	732262198	RPJBQRPSGDDEHT-ZJCOYTNYSA-N	445.564	1.866	50	20	IDGD	
O=C(CCc1ccccc1)NNC(=O)[C@@H]1CCCN1S(=O)(=O)c1cccc([N+](=O)[O-])c1	732935882	JDOLZLBSDSOZDE-SFHVURJKSA-N	446.485	1.528	50	20	IDGD	
O=C(NNC(=O)c1nc2ncc(Br)cn2n1)c1cnn(-c2ccccc2)c1	733109210	WZZSZPGIZYNKJG-UHFFFAOYSA-N	427.222	1.147	50	20	IDGD	
O=C(CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@@H]12)NNC(=O)c1cnn(-c2ccccc2)c1	733170267	VUBULSFOSLWSFP-XYJFISCASA-N	428.518	1.359	50	20	IDGD	
Cc1nn(CCCl)c(C)c1C(=O)N1CCN(S(=O)(=O)c2c(C)noc2C)CC1	733887933	BNNWMKBOFHNYQL-UHFFFAOYSA-N	429.930	1.490	50	20	IDGD	
COc1ccc(OC)c(CC(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)c1	734826085	WNKCGVAWTVVMGW-UHFFFAOYSA-N	436.509	1.976	50	20	IDGD	
CC(C)c1nc(C(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)nn1-c1cccc(F)c1	735472574	UNCIMASTAZOXIA-UHFFFAOYSA-N	449.487	1.999	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2c(Cl)cccc2Cl)nc2c1c(=O)n(C)c(=O)n2C	737542989	NXXCGEQAGQJCFH-UHFFFAOYSA-N	436.255	1.322	50	20	IDGD	
CC(C)(C)OC(=O)Nc1ccc(C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)c(Cl)c1	740818142	FHOIIFAXFLDKKI-NSHDSACASA-N	446.913	1.818	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2cccc(C(F)(F)F)c2N)cc1OC	741000813	CFDHTYSAQJCOQQ-UHFFFAOYSA-N	441.362	1.923	50	20	IDGD	
Cc1nn(C)c2sc(C(=O)N[C@@H](C)C(=O)NNC(=O)[C@@H]3COc4ccccc4O3)cc12	742033986	WVDQDBOGCHPIGF-NHYWBVRUSA-N	443.485	1.049	50	20	IDGD	
O=C(COc1ccccc1-c1ccccc1)NNC(=O)CN1C(=O)[C@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O	742472888	XHCYNCSYOOBBMC-UBBRYJJRSA-N	449.463	1.042	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2cc(N3CCOC3=O)ccc2F)cc1	743830088	MMUHFLSEPJPKJE-UHFFFAOYSA-N	436.421	1.652	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)CCn2c(=O)oc3cc(Cl)ccc32)cc1	744594795	KFLSBYXVCFCHLY-UHFFFAOYSA-N	442.815	1.514	50	20	IDGD	
CNC(=O)CC1CCN(C(=O)NNC(=O)[C@H](C)Oc2cccc(Br)c2)CC1	747489984	DSIAHLIHPFOCMV-LBPRGKRZSA-N	441.326	1.805	50	20	IDGD	
CCC[C@H](C)NC(=O)[C@H]1CCCN(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)C1	747853540	XORZOLQIAMXSMW-HOCLYGCPSA-N	428.497	1.034	50	20	IDGD	
CC(C)(C)NS(=O)(=O)CC(=O)NNc1ccc(S(=O)(=O)Nc2nccs2)cc1	747942918	GANRLWVTCOIHSV-UHFFFAOYSA-N	447.564	1.105	50	20	IDGD	
COCCO[C@H](C)C(=O)NNC(=O)NCc1cc(Br)c2c(c1)OCCO2	748622088	CFSIMDFAVZEVGQ-SNVBAGLBSA-N	432.271	1.102	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)N[C@@H]1CCN(c2ccccc2Br)C1	748629263	CLNULRLAEZAADD-QWHCGFSZSA-N	429.315	1.410	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCCN(C(=O)Cc3cccc(F)c3)CC2)n1	748835933	OZZDPZATOOJDMT-UHFFFAOYSA-N	447.536	1.058	50	20	IDGD	
O=C(COC(=O)c1ccc(C(=O)c2cc[nH]c2)cc1)NNC(=O)c1ccc([N+](=O)[O-])cc1	748903609	NJVOENOTYZJDSI-UHFFFAOYSA-N	436.380	1.772	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)N2CCN(C[C@@H]3CCOC3)CC2)N(C)c2ccccc21	749511066	JTVUBPVPOCKWOI-SFHVURJKSA-N	437.544	1.838	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)CNS(=O)(=O)c1ccc(Cl)s1	749838735	WGVIRXVAULFNJS-VIFPVBQESA-N	435.886	1.434	50	20	IDGD	
O=C(NNC(=O)N1CCC(OC[C@H]2CCCCO2)CC1)c1ccc(-n2cnnn2)cc1	750268411	SEQWVVJBXCZAIK-GOSISDBHSA-N	429.481	1.067	50	20	IDGD	
CCCc1ccc(N2C[C@@H](C(=O)NNC(=O)CNC(=O)c3cccs3)CC2=O)cc1	751209540	RLZXNQIQEWBUOP-HNNXBMFYSA-N	428.514	1.631	50	20	IDGD	
O=C(NNC(=O)c1cc2c(Br)cccc2[nH]1)c1ccc(-n2cnnn2)cc1	751295705	SDXUEXIZQHPVAB-UHFFFAOYSA-N	426.234	1.981	50	20	IDGD	
CCC(=O)NCc1cc(S(=O)(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)ccc1OC	751538926	SLILWLCEYCVROJ-UHFFFAOYSA-N	436.446	1.253	50	20	IDGD	
CCc1cc(Br)ccc1NNC(=O)[C@H](C)NS(=O)(=O)c1cnn(C)c1	753185612	UMACWYUIVQZZCJ-JTQLQIEISA-N	430.328	1.555	50	20	IDGD	
CC(C)(C)OC(=O)N(CC(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1)C1CC1	753390924	AQEIPZINKGLJGN-UHFFFAOYSA-N	446.913	1.148	50	20	IDGD	
O=C(CN1CCOC[C@@H]1C[C@H](O)c1cccs1)NNC(=O)c1ccc([N+](=O)[O-])cc1	753860778	ANMHQEWCJRBGAD-HOTGVXAUSA-N	434.474	1.242	50	20	IDGD	
Cc1cc(NNC(=O)c2ccc(S(=O)(=O)CC(N)=O)cc2)ccc1Br	754420116	MVCLMGPUCXKEIF-UHFFFAOYSA-N	426.292	1.773	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)F)cc1)C(=O)Nc1cnn(-c2ccccc2)n1	755347016	AUEKZVFKWKYOBQ-UHFFFAOYSA-N	436.400	1.345	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N(C)C[C@H](O)C2CC2)cc1	755519623	XCCDNCYIUFXYLH-KDMTZKAISA-N	437.500	1.570	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@H]2CSCCS2)c1	756069192	WMDCASPVKFKFEH-AWEZNQCLSA-N	446.620	1.510	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2cccc(Cn3cncn3)c2)c2ccccc2c1=O	756150611	XPHUNBCNANJZPU-UHFFFAOYSA-N	432.444	1.523	50	20	IDGD	
O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)Nc1cc(N2CCCS2(=O)=O)ccc1F	756155599	SAEIEIIQVYAABK-UHFFFAOYSA-N	437.409	1.740	50	20	IDGD	
CNC(=O)CN(CC(=O)NNC(=O)c1cccc(C#N)c1)Cc1cccc(C(F)(F)F)c1	756593948	IZONVWKJKABISF-UHFFFAOYSA-N	447.417	1.586	50	20	IDGD	
Cc1cc(S(N)(=O)=O)cc(NC(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)c1C	756634962	PBZJVZSSGOHAMC-UHFFFAOYSA-N	446.464	1.947	50	20	IDGD	
CCc1ccc(-c2cc(C(=O)NNC(=O)Nc3ccn(CCS(C)(=O)=O)n3)n[nH]2)cc1	756757268	ADZYCGZGDBJAQI-UHFFFAOYSA-N	445.505	1.347	50	20	IDGD	
CCOc1cc(C)ccc1CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	757261421	XOCFMMGWZQEBBS-UHFFFAOYSA-N	434.518	1.788	50	20	IDGD	
Cn1cc(Br)cc(NC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)c1=O	757597143	HWCDOVWTVYTTLY-UHFFFAOYSA-N	447.249	1.506	50	20	IDGD	
CN(C)C(=O)CNC(=O)c1ccc(NC(=O)NNC(=O)c2ccc(C#N)cc2)cc1Cl	757724371	FZDOKIKQYVZXGB-UHFFFAOYSA-N	442.863	1.496	50	20	IDGD	
CCC(=O)c1cc(C(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)ccc1F	757915680	YSPGUQIULWBMJO-UHFFFAOYSA-N	449.508	1.506	50	20	IDGD	
Cn1cc(NS(=O)(=O)c2ccsc2C(=O)NNc2nc(O)c3ccccc3n2)cn1	758309516	URYDYGRUZWLKJY-UHFFFAOYSA-N	445.486	1.688	50	20	IDGD	
CC(=NNC(=O)C(=O)Nc1ccccn1)c1ccc(S(=O)(=O)CC(F)(F)F)cc1	758380500	GBEOXEMRLBYNNM-UHFFFAOYSA-N	428.392	1.897	50	20	IDGD	
O=C(NC[C@@H]1CC(=O)N(Cc2ccccc2)C1)NNC(=O)c1nn(-c2ccccc2)cc1O	758984735	OHZLGGDBBWWRBA-KRWDZBQOSA-N	448.483	1.571	50	20	IDGD	
C[C@H](Cc1ccccc1Br)NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	759717785	FVZHCZXTGJURON-GFCCVEGCSA-N	444.293	2.000	50	20	IDGD	
CNc1nnc(CC(=O)NNc2nc3ccccc3c(=O)n2CCCOC(C)C)s1	759853473	VGVLZHNSSKZVRF-UHFFFAOYSA-N	431.522	1.791	50	20	IDGD	
Cn1cc(-n2cc(C(=O)NNC(=O)COc3ccc(Br)cc3)ccc2=O)cn1	760456473	ZEVGBYUZOWEFPE-UHFFFAOYSA-N	446.261	1.174	50	20	IDGD	
O=C(COc1ccc(OCc2ccccc2)cc1)NNC(=O)c1ccc2nnc(O)n2c1	762941023	YDRGRKWCFWMWHT-UHFFFAOYSA-N	433.424	1.854	50	20	IDGD	
CCCCS(=O)(=O)N1CCC[C@@H]1C(=O)NNC(=O)c1cc(-c2ccccc2OC)[nH]n1	763154641	QGEFXKMUHPFHOA-QGZVFWFLSA-N	449.533	1.441	50	20	IDGD	
Cc1c(S(=O)(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)cnn1-c1ccccn1	763438563	CEHRPBUNXPPCIX-UHFFFAOYSA-N	438.510	1.190	50	20	IDGD	
COC(=O)c1cccc(C#Cc2cccc(NC(=O)C(=O)NNC(=O)c3ccccn3)c2)c1	763464578	OGXSXOPMBSOOEH-UHFFFAOYSA-N	442.431	1.668	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)C[C@H](OC)C3)cc(OC)c1OC	763538615	DZWYIZFDGRWISR-MRXNPFEDSA-N	443.456	1.226	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)Nc1ccn(-c2ccccc2Cl)n1	763571003	KABPINCYTMPYKV-INIZCTEOSA-N	441.831	1.452	50	20	IDGD	
COC(=O)CCc1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)cc1	763614673	VAQCCQHJDCIHEM-UHFFFAOYSA-N	435.440	1.582	50	20	IDGD	
COC(=O)COc1cccc(NC(=O)C(=O)NNC(=O)c2cc(C)nc3ccccc23)c1	763616760	YUDMRRQRKFRQAK-UHFFFAOYSA-N	436.424	1.495	50	20	IDGD	
COCCOc1ccc(F)cc1NC(=O)C(=O)NNC(=O)c1c(C)nc2ccccn12	763624983	QIAVYXRSBUALJG-UHFFFAOYSA-N	429.408	1.207	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(F)cc2OC(F)F)cc1	763662202	VSZZSBYLYCRVDQ-UHFFFAOYSA-N	427.335	1.601	50	20	IDGD	
C[C@@H](c1cccc(NC(=O)C(=O)NNC(=O)COc2ccccc2F)c1)N1CCOCC1	763678315	CMSZTUJNAHHWCQ-HNNXBMFYSA-N	444.463	1.384	50	20	IDGD	
CC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)COc2ccc(Br)cc2)c1	763696206	UHLPOABUKUJGQB-UHFFFAOYSA-N	449.261	1.572	50	20	IDGD	
CCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)CN2CCCc3ccccc32)c(C)c1	763729395	YGWXUGMTUMKGJY-UHFFFAOYSA-N	437.500	1.283	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)C(=O)Nc2cnc(C)s2)c2ccccc2c1=O	763801428	RUGKFGJEXVSPSY-UHFFFAOYSA-N	428.474	1.361	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)c1cc(-c2ccc(Br)cc2)[nH]n1	763820642	OPYACKZNRRUNLL-UHFFFAOYSA-N	443.261	1.425	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(OC)nc2Cl)cc1OC	763913054	XVNZCSPNGCSIGT-UHFFFAOYSA-N	436.852	1.941	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccc(Cl)cc2)c(OCCN(C)C)c1	763936888	RHWXPTQGIGMICI-UHFFFAOYSA-N	432.908	1.917	50	20	IDGD	
C[C@H]1CCC2=S=C(C(=O)NNC(=O)C(=O)Nc3ccc(C(=O)N(C)C)cc3)C=C2C1	763939301	CVUWEWGTOCKKNS-LBPRGKRZSA-N	428.514	1.312	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@H]2C)ccc1NC(=O)C(=O)NNC(=O)c1cccn1C	763992752	IHSMZMXCSOTTQR-OAHLLOKOSA-N	425.489	1.748	50	20	IDGD	
COc1ccccc1NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cccn2C)cc1	763993396	PIHYUZSMYMCDMA-UHFFFAOYSA-N	435.440	1.686	50	20	IDGD	
CC(=O)N1CCCc2cc(NC(=O)C(=O)NNC(=O)c3ccc4c(c3)OCCO4)ccc21	764004257	NYAWHMHPMOWNHI-UHFFFAOYSA-N	438.440	1.157	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)[C@H]1CS[C@H](Cc2ccccc2F)C(=O)N1	764049604	KQWGDWDJHMSLOP-RHSMWYFYSA-N	449.529	1.614	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2ccc(OC(F)F)cc2)c1	764077156	HWDUPQQKOPHHBG-UHFFFAOYSA-N	427.385	1.091	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc(-n4cccn4)cc3)n[nH]2)cc1	764110141	FQOXYLPXJCCQFI-UHFFFAOYSA-N	429.440	1.971	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccn(-c4ncccc4F)n3)n[nH]2)cc1	764111792	FWRIBTHSNDTAES-UHFFFAOYSA-N	448.418	1.505	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2ccc3c(c2)NC(=O)[C@@H](C)O3)cc1	764127865	TYERWRKXQJXPJJ-GFCCVEGCSA-N	426.429	1.133	50	20	IDGD	
COC(=O)c1cccc(C#Cc2cccc(NC(=O)C(=O)NNC(=O)c3ccoc3)c2)c1	764158619	IQYHGJPUGUCCBN-UHFFFAOYSA-N	431.404	1.866	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)CCC2CCCCC2)c(OC)c(OC)c1	764215528	XFPXKHVJJBAQBG-UHFFFAOYSA-N	435.477	1.937	50	20	IDGD	
Cc1ccc(C(=O)Nc2ccccc2)cc1NC(=O)C(=O)NNC(=O)Cc1ccccn1	764263178	ANJYPWSSLNNRNK-UHFFFAOYSA-N	431.452	1.971	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)N1CCOCC1	764933479	GVWNJFIFYNJVDJ-KRWDZBQOSA-N	431.493	1.677	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)C[C@H]2CN(C(=O)OC(C)(C)C)CCO2)cc1C	765384145	GWHVAXLVNZYWBY-INIZCTEOSA-N	434.493	1.415	50	20	IDGD	
CCCCN(C)S(=O)(=O)c1ccc(NC(=O)C(=O)NNC(=O)OC(C)(C)C)cc1	765389399	LGFGNXMNMPSYTI-UHFFFAOYSA-N	428.511	1.602	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)CCc2ccccc2O)cc1F	765649853	VXXQBAYYMKKLAI-UHFFFAOYSA-N	445.494	1.235	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1cccc(COCC(F)(F)C(F)F)c1	766260647	ISIGXVROKHBFDA-UHFFFAOYSA-N	431.346	1.984	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)CN1CCC(C(=O)NCc2ccc(F)cc2)CC1	766854105	PMXXWODMUUQDQW-UHFFFAOYSA-N	440.519	1.852	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccc(F)cc1C(=O)N(C)C	768238773	USDBDJMECCMQSZ-NSHDSACASA-N	434.399	1.220	50	20	IDGD	
CC(C)(C)OC(=O)N(CC(=O)NNC(=O)CNC(=O)c1cccnc1)c1ccccc1	768243817	LZJLVBMMHITMPB-UHFFFAOYSA-N	427.461	1.401	50	20	IDGD	
N#Cc1cccc(C(=O)NNS(=O)(=O)c2cc([N+](=O)[O-])ccc2Br)c1	768499312	KWRSNSQFVDNUQR-UHFFFAOYSA-N	425.220	1.852	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)[C@H]3CSCN3C(=O)c3ccc(Cl)cc3)nc21	770970638	BZUKQYWXJQBXDG-GFCCVEGCSA-N	433.881	1.381	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@@H]2CCO[C@H](C)C2)c1	771434705	QUEAPNLFYXVSDV-HUUCEWRRSA-N	426.539	1.476	50	20	IDGD	
O=C(Cc1ccccc1I)NNc1nccc(N2CCOCC2)n1	771656286	WOHDXPAQRFFCCI-UHFFFAOYSA-N	439.257	1.604	50	20	IDGD	
COc1ccc(CC(=O)NNc2c(C)cccc2F)cc1S(=O)(=O)N1CCOCC1	771697693	RLGWNXQMEXQLRJ-UHFFFAOYSA-N	437.493	1.849	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)CSc1nnc(C2CCCCC2)n1N	771900170	GKHSQAZOYPTVDK-GFCCVEGCSA-N	426.543	1.257	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)CSc1nncn1-c1ccc(C)c(Cl)c1	771923348	UEKUXKYFVMROEQ-NSHDSACASA-N	425.898	1.810	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)[C@H]1CCCN1C(=O)c1ccc(Br)cc1	772066656	ZRWCSRPDRLJWNT-SMDDNHRTSA-N	440.294	1.543	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)Cc1cccc(I)c1	772181939	DVHZJZSUPUHJTO-LLVKDONJSA-N	432.258	1.959	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2ccc(N3CCOCC3)cn2)c2ccccc2c1=O	772438738	UHPLXCYSFATTJP-UHFFFAOYSA-N	437.460	1.115	50	20	IDGD	
CNC(=O)COc1cccc(CC(=O)NNc2nc(-c3ccccn3)nc3c2CCC3)c1	772461730	RRIIVJKDIJJPNI-UHFFFAOYSA-N	432.484	1.838	50	20	IDGD	
CC(C)(C)OC(=O)NCC(C)(C)C(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772885063	UHRSGLSHPNSVDO-UHFFFAOYSA-N	426.901	1.655	50	20	IDGD	
CC[C@H](N=c1nn[nH]n1-c1ccccc1)C(=O)NNC(=O)[C@@H](C)Oc1cccc(Cl)c1	772966829	KYMQBIGSXBPWFY-DYVFJYSZSA-N	443.895	1.543	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)CCS(=O)(=O)C2CCCC2)C1	773412269	VCWMAUSCZIUBMQ-AWEZNQCLSA-N	431.555	1.528	50	20	IDGD	
Cc1nccn1-c1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(Cl)c2)cn1	774010203	VWTMAZWDWYYSIO-LBPRGKRZSA-N	442.863	1.783	50	20	IDGD	
COc1cc(C)nc(NNC(=O)N[C@H]2CCN(c3cccc(Br)c3)C2=O)n1	775222911	VEASYDKEQMZFHJ-ZDUSSCGKSA-N	435.282	1.988	50	20	IDGD	
CN1CC(=O)N(Cc2ccc(C(N)=O)cc2NC(=O)NNc2cnc3ccccc3n2)C1=O	775666894	TXLBUSSZQFLDSE-UHFFFAOYSA-N	448.443	1.271	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)Nc2ccc(S(=O)(=O)NC(C)(C)C)cn2)cc1	776061027	CQUCQHSDFIPNSK-UHFFFAOYSA-N	449.533	1.953	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)[C@H]2CC(=O)N(c3ccc(OCC)cc3)C2)nc1C	778422163	KLKAROJAFUWAFX-AWEZNQCLSA-N	427.461	1.857	50	20	IDGD	
O=C(NNc1cc(Cl)ccn1)c1ccc2c(c1)S(=O)(=O)N(C[C@@H]1CCCO1)C2=O	778446389	AEMWTYSZMQOETF-ZDUSSCGKSA-N	436.877	1.815	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)N[C@H]1CCN(c2ccc(F)c(Cl)c2)C1	778589770	UUSVPSOIKRBXKF-ZDUSSCGKSA-N	444.858	1.678	50	20	IDGD	
Cc1ncsc1C(=O)NNC(=O)C(=O)Nc1cc(Cl)ccc1OC[C@@H]1CCOC1	778711146	VNQMXBWUOKVRSZ-LLVKDONJSA-N	438.893	1.920	50	20	IDGD	
CNC(=O)c1cccc(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2Br)c1	778759949	UMSQYIYNUGPOBD-UHFFFAOYSA-N	436.222	1.799	50	20	IDGD	
CC(C)N1CCN(C(=O)NNC(=O)[C@@H](C)Oc2cccc(Br)c2)CC1=O	779969089	CIFHTUVLANYFJT-GFCCVEGCSA-N	427.299	1.510	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NC[C@H]1CC(=O)N(C2CC2)C1	780887319	OXXVHKGWBBLADF-VXGBXAGGSA-N	439.310	1.558	50	20	IDGD	
C[C@@H]1C(=O)CC[C@H](C(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)C1(C)C	780926475	LJQLISLCIWQIFS-SJLPKXTDSA-N	428.533	1.233	50	20	IDGD	
CC(=O)N1CCN(c2cccc(NC(=O)C(=O)NNc3cnc4ccccc4n3)c2)CC1	782124519	PQVRFYFJOZVTEI-UHFFFAOYSA-N	433.472	1.380	50	20	IDGD	
CCOC(=O)c1c(C)csc1NC(=O)C(=O)NNC(=O)Cc1nc2ccccc2n1C	782895015	VPUZKKPMLVVRMG-UHFFFAOYSA-N	443.485	1.449	50	20	IDGD	
O=C(NNc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1cccc(CN2C(=O)CNC2=O)c1	783290822	GVHCEIYODCGHLP-UHFFFAOYSA-N	446.807	1.382	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2cccc(NC(=O)CN3CCCCCC3)c2)nc(C)n1	783324730	BHBYRYPCBXNKPM-UHFFFAOYSA-N	439.520	1.990	50	20	IDGD	
CCOC(=O)[C@@H](C)NC(=O)c1ccc(NC(=O)C(=O)NN(C)c2ccccc2)cc1F	783434379	KFNGAJDEBWOAQP-CYBMUJFWSA-N	430.436	1.613	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)C(=O)N1CCc2cc(F)c(F)cc21	784212514	BFOPEBHVNSOHNU-UHFFFAOYSA-N	436.440	1.438	50	20	IDGD	
CC(=O)N1CCN(Cc2ccc(NC(=O)C(=O)NNc3cc(F)c(F)c(F)c3)cc2)CC1	785083015	ONXNWIDZTULJNV-UHFFFAOYSA-N	449.433	1.850	50	20	IDGD	
N#Cc1ccc(NNC(=O)C(=O)Nc2ccccc2C(=O)N2CCOCC2)cc1Cl	785093124	MEJXJMWRDHWVDI-UHFFFAOYSA-N	427.848	1.766	50	20	IDGD	
COC(=O)Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3cc(C)ccc3C)[nH]n2)cc1	785126978	WQKJMYXMLPFRDL-UHFFFAOYSA-N	449.467	1.809	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2ccc([C@@H](C)N3CCOCC3)cc2)n1	785238859	ZJECWCAORQELQP-MRXNPFEDSA-N	441.536	1.798	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2cccc(C(F)(F)F)n2)nc1	786423686	YNJOIDMFGNTFMY-UHFFFAOYSA-N	446.411	1.264	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)NCc2ccc(S(C)(=O)=O)s2)cc1	786880693	OOJZQULQDRQJAX-GFCCVEGCSA-N	441.531	1.848	50	20	IDGD	
COc1cc(C(=O)Nc2cccc(NC(=O)NN(C)C)c2)cc(OC)c1OCC(N)=O	788262996	SSJMVZPISBKKPJ-UHFFFAOYSA-N	431.449	1.418	50	20	IDGD	
CS(=O)(=O)c1cc(NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)ccc1Cl	788309304	IGTVFDLEYBLUIQ-UHFFFAOYSA-N	435.853	1.186	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNS(=O)(=O)c1sc(C(=O)OC)c(Cl)c1C	788494230	RRCWNNGMEYEGQW-UHFFFAOYSA-N	425.916	1.111	50	20	IDGD	
CN(C)C(=O)CS(=O)(=O)c1ccc(C(=O)NNc2nnc(-c3ccccn3)s2)cc1	788556338	JEDQOVPUJVXFNU-UHFFFAOYSA-N	446.514	1.219	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNS(=O)(=O)c1cccc(Br)c1Cl	790069026	RTUJYACKGHWFID-UHFFFAOYSA-N	426.720	1.717	50	20	IDGD	
O=C(CCCNS(=O)(=O)c1ccc2c(c1)OCCCO2)NNc1nc2ccccn2n1	791260828	SVECQUSRGVHHQO-UHFFFAOYSA-N	446.489	1.092	50	20	IDGD	
CN(NC(=O)[C@@H]1CCN(CC(F)(F)F)C1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	792316272	BIHQXEJOWGSMJF-CYBMUJFWSA-N	437.463	1.506	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)N1CCN(C(=O)OC(C)(C)C)C[C@@H]1c1nccn1C	792903975	FSACZXDWFUFPSK-JKSUJKDBSA-N	436.557	1.596	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)c1ccccc1F)C(=O)NNC(=O)c1cccc(C)n1	794090389	SFBOTBKLNYOZIH-OAHLLOKOSA-N	440.522	1.390	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)[C@H]2CSCN2C(=O)OC(C)(C)C)cc1	794711004	LELCWWHLJFDEKL-CQSZACIVSA-N	430.552	1.690	50	20	IDGD	
Cc1cccc(=O)n1C[C@@](C)(O)C(=O)OCC(=O)C(C#N)=C1N(C)c2ccccc2N1C	795765825	ABFVSHQNPGCZFE-HSZRJFAPSA-N	436.468	1.341	50	20	IDGD	
O=C(NNC(=O)C(=O)Nc1ccccn1)N[C@H]1CCOc2c(Br)cccc21	800735078	KCQYBQGBGQAIFB-LBPRGKRZSA-N	434.250	1.637	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNS(=O)(=O)c1cc(Br)cnc1Cl	800839848	QYSLFQGROQXCNR-UHFFFAOYSA-N	443.707	1.332	50	20	IDGD	
O=C(N=c1cc[nH]cc1)NNC(=O)[C@@H]1CCCN(C(=O)c2ccccc2OC(F)F)C1	802025121	SOSGTQVPBWHLCP-CYBMUJFWSA-N	433.415	1.810	50	20	IDGD	
C[C@H](C(=O)NNC(=O)Nc1ccc(Cl)cc1Cl)N1C(=O)[C@H]2[C@H](C1=O)[C@H]1CC[C@H]2O1	802090932	KFVDCNIVOQNEEZ-ODTJPNJJSA-N	441.271	1.697	50	20	IDGD	
C#Cc1cc(F)c(NC(=O)C(=O)NNC(=O)c2cc(Br)cn2C)c(F)c1	802566226	FGHPZGFIGPSVHJ-UHFFFAOYSA-N	425.189	1.447	50	20	IDGD	
COc1ccc2nc(NNC(=O)CNS(=O)(=O)c3c[nH]c4ncccc34)c(C)cc2c1	803058660	UYZDBWYMHIZOIY-UHFFFAOYSA-N	440.485	1.850	50	20	IDGD	
CN(CCCC(=O)NNc1ccc2c(=O)[nH]ccc2c1)C1=NS(=O)(=O)c2ccccc21	803427715	ARBRSBDGAUGZBO-UHFFFAOYSA-N	439.497	1.832	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)C1CCN(S(=O)(=O)c2ccccc2F)CC1	804953826	AIMIYQLZDZQFFX-UHFFFAOYSA-N	445.480	1.345	50	20	IDGD	
O=C(Cc1ccc(S(=O)(=O)N2CCCC2)s1)NNc1ccc(-n2ccnc2)nn1	804954819	IKKAHBCJQHWDMR-UHFFFAOYSA-N	433.519	1.194	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)C(=O)Nc1cc(F)c(Br)c(Cl)c1	806979264	XHTBYBWHRBCGCE-UHFFFAOYSA-N	429.633	1.965	50	20	IDGD	
CCCn1c(=O)nc(O)c2c(C(=O)NNC(=O)C(C)(OCC)OCC)cc(C3CC3)nc21	807371147	CMCFOMFBPGKVDI-UHFFFAOYSA-N	447.492	1.335	50	20	IDGD	
O=C(NNc1nccnc1C1CCC1)c1cccc(S(=O)(=O)NC[C@H]2CCCO2)c1	807783031	ZYMOFLMQVAUIEP-MRXNPFEDSA-N	431.518	1.958	50	20	IDGD	
C#CCn1ccnc1C=NNC(=O)c1cc(S(=O)(=O)NCc2ccccc2)ccc1O	807960664	ZAAGFMDZIMZJCK-UHFFFAOYSA-N	437.481	1.464	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)nn1-c1ccc(F)cc1F	808934830	WHYRURNDKHTEAI-QGZVFWFLSA-N	441.394	1.549	50	20	IDGD	
Cn1nc(NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc1C1CC1	810277740	PZKZQDQSDCERBT-UHFFFAOYSA-N	432.506	1.549	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2ccnc(Cl)c2C)cc1	810286258	UDDLFSAHIZRYGI-UHFFFAOYSA-N	425.898	1.825	50	20	IDGD	
CNC(=O)c1cc(Oc2ccc(NC(=O)NNC(=O)[C@H](C)OCCOC)cc2F)ccn1	810313024	ZMYGTMWOSFHYCF-LBPRGKRZSA-N	449.439	1.577	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)c2cc(Cl)ncc2Br)c1	811390626	XEIBGKSXAQBSAR-UHFFFAOYSA-N	437.637	1.987	50	20	IDGD	
Cc1cnc(Br)c(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)c1	812987464	PEOWMLUVFNGMLJ-UHFFFAOYSA-N	431.250	1.129	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)N[C@@H]2CCN(c3ccccc3F)C2)cc1	813853341	DZJGOFCRXAVYGH-CQSZACIVSA-N	435.481	1.844	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)Nc1ccc(CCS(C)(=O)=O)cc1	814677206	QZYIRNWBMCVSKY-UHFFFAOYSA-N	440.547	1.673	50	20	IDGD	
CC(C)CCC(=O)NNC(=O)C(=O)Nc1ccc([N+](=O)[O-])c(I)c1	815568261	BERLYWMDQDQXAO-UHFFFAOYSA-N	448.217	1.722	50	20	IDGD	
CCOc1ccc(NNC(=O)C(=O)Nc2cc(OC)c(OC)cc2C(=O)N(C)C)cc1	815816320	RBCHJMPHBSOYCV-UHFFFAOYSA-N	430.461	1.886	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)c2cc(S(N)(=O)=O)ccc2F)cc1OC	913069580	SGNWWPWNLTYZEN-UHFFFAOYSA-N	439.465	1.735	50	20	IDGD	
COC(=O)CCCNC(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	915894934	XYZOCYACWMMPAT-UHFFFAOYSA-N	437.456	1.342	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1csc(-c2cnn(C)c2)n1	916134180	FAENKKOCNWSUTB-UHFFFAOYSA-N	433.519	1.220	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)c1ccc(OCC(=O)NC2CC2)cc1	916489989	UNFMNGDWKFQOBF-ZDUSSCGKSA-N	441.444	1.957	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)COc2ccccc2O)sc(C)c1C	916562818	ICZQEXMIKJXSQL-UHFFFAOYSA-N	435.458	1.412	50	20	IDGD	
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12	917721975	OEYNFXXVZXRMBL-UHFFFAOYSA-N	445.457	1.817	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCC(=O)N(C)Cc2ccccc2)c2ccccc2c1=O	918091197	VSSHBLULENKIEK-UHFFFAOYSA-N	436.472	1.019	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)c1ccc(S(=O)(=O)N(C)C)cc1	918106650	YNJDTLKUDCGPIZ-GFCCVEGCSA-N	435.462	1.550	50	20	IDGD	
COc1cccc(CO[C@@H](C)C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)c1	918204137	SSKBUQFMOKKWEI-NSHDSACASA-N	441.893	1.362	50	20	IDGD	
O=C(NNC(=O)[C@H]1CC(=O)N(Cc2ccccn2)C1)c1ccc(F)cc1Br	918342485	YTSMGTXEUPHKNO-NSHDSACASA-N	435.253	1.793	50	20	IDGD	
CNS(=O)(=O)c1ccc([C@@H](C)NC(=O)NNC(=O)[C@H](C)Oc2ccccc2F)cc1	919779128	NSWQMEUXRNKCRM-OLZOCXBDSA-N	438.481	1.593	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN1C(=O)Cc1ccccc1)c1nn(-c2ccccc2)cc1O	920297408	HPWOKYOTTZURFP-GOSISDBHSA-N	433.468	1.573	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)[C@@H](C)OC[C@H]2CCCO2)c2ccccc2c1=O	921021471	IPKRTHJOQDZULE-HZPDHXFCSA-N	430.505	1.932	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)[C@H](C(C)C)N2C(=O)c3ccccc3C2=O)c1	929086526	IGMBPGXLBIKFES-SFHVURJKSA-N	425.441	1.786	50	20	IDGD	
CN(C)C(=O)Nc1cccc(CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)c1	1116146252	BAEGMTQLMFIUAE-UHFFFAOYSA-N	447.521	1.217	50	20	IDGD	
CC(C)(C=NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1)S(C)(=O)=O	1319705012	CEOZIHBMTJSCST-UHFFFAOYSA-N	437.543	1.704	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNS(=O)(=O)c2ccc(C#N)c(F)c2)CC1	1324356361	CDPSNQGXIVBJJA-UHFFFAOYSA-N	426.470	1.654	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2)c1cnc2ccccc2n1	1778427801	MMKCBROLGKRQBI-WAOWUJCRSA-N	432.908	1.357	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4nncn4c3)C2)C1	1778596993	VILHOIFLIQDNPF-MSOLQXFVSA-N	426.304	1.409	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc4n(n3)CCC4)C2)C1	1778664553	GBTGHMROTGNQJX-FZKQIMNGSA-N	425.327	1.304	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(CCN(C(=O)c3cccc4c3NC(=O)C4=O)C2)C1	1778710652	FYIDJCVOXBHNBZ-NRFANRHFSA-N	445.548	1.116	50	20	IDGD	
C[C@H](C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(Cl)Cl)C2)n1ccccc1=O	1779530117	AJXFFCZZQSDTKW-PJIJBLCYSA-N	430.332	1.727	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(-n4c(O)nnc4O)cc3)C2)C1	1780203337	FGFGSKQJSZCIFO-MGPUTAFESA-N	449.895	1.139	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H]2CCC(=O)N2C)C1	1780787043	CTNBFISGKUJFIY-NXEZDXNNSA-N	444.370	1.152	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)c3cc4n(n3)CCCO4)CCO2)C1	1781230175	OLWYLXZEWCVUMH-ROUUACIJSA-N	431.320	1.345	50	20	IDGD	
O=C(CSc1ncccn1)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781332117	ZVNDWRVUJRISRH-SWLSCSKDSA-N	433.303	1.089	50	20	IDGD	
O=C(C1Cc2ccccc2C1)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781337214	QEZPRRRBEDPQQW-LPHOPBHVSA-N	425.298	1.922	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3c(F)ccc(O)c3F)C2)C1	1781932515	FKZPRMFLQQLNRE-BMLIUANNSA-N	433.249	1.897	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)C2)C1	1781938279	AEXUHFDVEWPUAO-APPDUMDISA-N	442.266	1.527	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)Cn1cncn1)C2	1781997612	DSUORMDOOGYUOA-ATNYBXOESA-N	442.358	1.212	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)Cc2cnn(C)c2)C1	1782584348	JDVIAYQDDUMPHF-IDHHARJASA-N	441.370	1.508	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](NC(C)=O)C(C)(C)C)CCO2	1783344780	WOKSAGGCUYJVQT-YZVOILCLSA-N	446.386	1.541	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)c1cnc(Cl)nc1	1783379070	RGCGLAQKMOZXAA-PDEGPIFNSA-N	435.681	1.414	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)/C=N/O[C@@H]3CCCCO3)CCO2)C1	1783534420	UGSOMRAPAITVHG-WRIKSJFWSA-N	432.315	1.129	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)Cc3ccc(F)c(C#N)c3)CCO2)C1	1783535778	CCYWGOZPFDOMIQ-ORAYPTAESA-N	438.297	1.853	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cccc(C(F)(F)F)n3)CCO2)C1	1783878383	XPGJIEMXKKELMC-SJKOYZFVSA-N	435.830	1.798	50	20	IDGD	
CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](Cl)COC)C2)C1	1783885314	YPHWFNTZRUIARY-QEEYODRMSA-N	447.960	1.373	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)CCc3cnccn3)C2)C1	1784552305	LCEUHNMCCNGWHM-KDOFPFPSSA-N	425.327	1.270	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)C3=COCC3)C2)C1	1784762358	OWWJVFLERVEDDQ-MGPUTAFESA-N	443.928	1.253	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3CC[C@H](C(=O)OC)CC3)[C@H]2C1	1784798668	QDVGRPVSQQSAOB-FRMKIJSPSA-N	444.956	1.199	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3nnc(C)s3)[C@H]2C1	1785326528	FVYJDDRBAIEARZ-XQLPTFJDSA-N	430.958	1.013	50	20	IDGD	
O=Cc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCBr)C[C@@H]32)s1	1786987079	CGBXCWYKQRTELX-UBHSHLNASA-N	429.336	1.939	50	20	IDGD	
COC(=O)c1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]3C2)c(C)c1	1787451401	NHGXUDRBOZUPTN-HJWJTTGWSA-N	426.872	1.909	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)c1cn2c(Cl)cccc2n1	1787861165	ADZCKYLHOHDXIT-VIRABCJISA-N	441.315	1.181	50	20	IDGD	
CCc1noc(C)c1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21	1788950229	YMMJPJPEMNSUIV-YDHLFZDLSA-N	428.327	1.924	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(-n4cccn4)nc3)[C@H]2C1	1788985527	MQGPIRYGXYDTGF-XSLAGTTESA-N	447.923	1.114	50	20	IDGD	
O=C1CC(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Cl)C[C@@H]32)=Cc2ccccc2N1	1789155463	DNQMJTBNPZKMGL-YMFLFHJQSA-N	435.883	1.926	50	20	IDGD	
N#Cc1cccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](O)CCl)C[C@@H]32)c1Cl	1789267121	HGNCEPPDOYTJSY-TUUVXOQKSA-N	426.300	1.405	50	20	IDGD	
C=C[C@@H](O)C(C)(C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](Br)CC)[C@H]2C1	1790960676	PVAKXMIWMUPIOJ-ARKGTOAJSA-N	431.371	1.713	50	20	IDGD	
COc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](C)Br)[C@H]3C2)ccc1O	1791058886	LGNRIQDSOUJNSC-MJFSBKNWSA-N	441.322	1.778	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3C[C@H]3c3ccccc3)C[C@@H]21	1791293325	VOIYRUUBHVACHW-WHZJULEDSA-N	442.560	1.143	50	20	IDGD	
COc1cc(CCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]3C2)ccn1	1791294040	BTYPKZVMJDRMOU-KKUMJFAQSA-N	430.332	1.806	50	20	IDGD	
COc1ncccc1CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]2C1	1791294063	DNOUSXCLSOOIIH-KKUMJFAQSA-N	430.332	1.806	50	20	IDGD	
Cc1nccn1[C@@H](C)C(=O)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1	1791929339	DMEKXQUIDCIRNZ-INIZCTEOSA-N	446.316	1.880	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc(OCF)cn1)C2	1792870901	YFDUVNVWZQIFNN-OHTBPHCPSA-N	445.289	1.017	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCl)c1ccc(CCN2CCCC2)nc1	1793112150	GAQJJJBRIAGWNP-YRPNKDGESA-N	434.968	1.571	50	20	IDGD	
CC(C)(C)OC(=O)N1CC=C(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](O)CCl)CC1	1793117781	DPYVACWAKOUDNT-YVSFHVDLSA-N	441.956	1.792	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(S(C)(=O)=O)cn1)C2	1793445482	JTSOXKVBHSOOBQ-IARIHHJXSA-N	443.953	1.096	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cncn1-c1ccncc1)C2	1793445970	YHYVRUSTOZPXDA-HIRMHNASSA-N	431.924	1.878	50	20	IDGD	
Cn1c(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)cc2ccccc21	1796187918	LSQSVEYWCGHXKG-WKCHPHFGSA-N	445.328	1.353	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnn2cccnc12	1797367567	REEVIFISIMRDNK-AYRXBEOTSA-N	436.310	1.106	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCc1ccsc1)C2	1798439130	FXKCWAFHNSSXGL-MUJYYYPQSA-N	427.530	1.631	50	20	IDGD	
CCOc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](Br)CC)C3)nn1	1798754166	QGIPNXSOCNLCBG-ZWUHOBOKSA-N	441.326	1.252	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnn2c1CCC2	1799963099	YIDVEQQGSPUUFS-JFILPPLUSA-N	425.327	1.064	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(-n3c(O)nnc3O)cc1)C2	1800072983	IZQIIXKBGIMRES-SLBVQIDZSA-N	433.896	1.948	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COc1ccc(F)cc1)C2	1800639491	ZWYKIPONOSSRHG-VLWCASSMSA-N	443.313	1.968	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(OC(F)F)cn1)C2	1800973971	JQBGGWWUMXGUMD-NDPMZMCLSA-N	433.839	1.140	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1[C@H]2COC[C@H]21	1801605146	JWXVLKLDFXNMKZ-ALPRRHJNSA-N	443.450	1.354	50	20	IDGD	
COc1nc(C)ccc1C(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]1c1cccnc1	1803141996	VXAWXSZKPPZXTG-NXHRZFHOSA-N	432.908	1.713	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cnn3ccncc23)[C@H]1c1cccnc1)[C@H](O)CCl	1803143238	XPPIUDYEENJUHH-QGTPRVQTSA-N	428.880	1.044	50	20	IDGD	
COC(=O)CSCC(=O)NC[C@@H]1CCN(C(=O)C(Cl)Cl)[C@H]1c1cccnc1	1803580334	LRWMYMLBHNJANI-WFASDCNBSA-N	434.345	1.797	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@]1(F)CCCC=C1F	1804563591	ABFWDAKUNGOQRG-VJAMOUOBSA-N	433.459	1.683	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)N2CCC3(CCCN(C(=O)[C@@H](O)CCl)C3)CC2)c1	1805515185	MUXDQHJCLWCZFX-KRWDZBQOSA-N	442.965	1.535	50	20	IDGD	
O=C(CCn1c(=O)oc2ccccc21)N1CCC2(CCCN(C(=O)[C@H](O)CCl)C2)CC1	1805518367	RQXJSFSXZREPMA-QGZVFWFLSA-N	449.935	1.816	50	20	IDGD	
Cc1cccnc1CCC(=O)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1	1809969502	WTHWORWBMLFENE-UHFFFAOYSA-N	449.360	1.547	50	20	IDGD	
C=CC[C@H](C(=C)C)C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1810171181	FGJWXZFREANYMK-YMPZKCBVSA-N	447.344	1.849	50	20	IDGD	
C=CC[C@H](C(=C)C)C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1810173449	VMWCPSYRIRPZBB-MDNUFGMLSA-N	447.344	1.849	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2ccccc2F)[C@@H]1c1cccnc1	1811679933	AHBPUMFEZBQPDN-VGSWGCGISA-N	441.507	1.913	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)[C@@H]2CCNC(=O)C2)[C@@H]1c1cccnc1	1813136922	PWWMOXVIWSIUNS-SHFYGJNESA-N	437.338	1.397	50	20	IDGD	
Cc1ccc(CC(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)o1	1813509946	OKGRCIHSTCCPDG-AUSIDOKSSA-N	447.300	1.225	50	20	IDGD	
CC(C)(CCl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCN2C(=O)C=CC2=O)[nH]n1	1814694363	DBXAWZPMTKJKIA-CQSZACIVSA-N	435.912	1.982	50	20	IDGD	
N#Cc1ccc(C(=O)N[C@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)cc1	1815343748	MXWCKBJIKKGLIX-KRWDZBQOSA-N	446.297	1.234	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2nccs2)[nH]n1)c1cccc(B(O)O)c1	1817473530	ZBRWZPKUPACGPV-HNNXBMFYSA-N	425.279	1.166	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)/C=C/c2ccco2)[nH]n1)c1cccc(B(O)O)c1	1817473916	GUDJIGJALOLTPW-JBVUFVISSA-N	434.261	1.702	50	20	IDGD	
Cc1cc(/C=C/C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)no1	1817476317	QAEGJFWEYVESMW-CSHXORCISA-N	449.276	1.405	50	20	IDGD	
COc1ccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)nc1	1818400667	MNVHAXUESYAAGV-LJQANCHMSA-N	449.276	1.113	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@H](F)Br)CC2)c1c[nH]c(=O)cn1	1821472496	NUVWZYNHPDHPDZ-KBUNVGBDSA-N	430.259	1.143	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H]2CCCS2(=O)=O)n[nH]1	1821835349	DAJMFLQSGVYLAR-UHTWSYAYSA-N	447.355	1.762	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H]2CCC(=O)N2)[nH]n1	1822088613	WVQILIYRYDNZCB-DMDPSCGWSA-N	426.315	1.854	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)/C=C/C2CC2)CC1	1824212632	KCWFROOVXUPCHN-YJJPMGAVSA-N	425.533	1.885	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(C=O)s1)CC2	1826085495	XHYNTWYUMAUMKN-LLVKDONJSA-N	449.558	1.616	50	20	IDGD	
COc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)c(O)c1	1830363546	BHAKGGGOSGGTKD-OAQYLSRUSA-N	440.924	1.736	50	20	IDGD	
O=C(CN1CCOC1=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H](F)Br)CC1	1830376234	KSHTZHDFQXHMAZ-UKRRQHHQSA-N	434.306	1.749	50	20	IDGD	
Cc1ncccc1C(=O)N1CCC([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1	1831872041	LQMITBOBEVFMRW-HXUWFJFHSA-N	429.565	1.996	50	20	IDGD	
C[C@@]1(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1(F)F	1832801655	DKOTZRUQHOGYLO-NQIIRXRSSA-N	434.292	1.645	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3nc(C(C)C)cs3)CCO2)C1	1833287715	BDHNAEDXEVGVDX-IFXJQAMLSA-N	445.969	1.590	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](C)CS(C)(=O)=O)CC2)CC1	1833483872	AGYLPXDUPLLZJO-YOEHRIQHSA-N	436.018	1.256	50	20	IDGD	
Cc1noc(C)c1CCC(=O)NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1833846320	OVDDKJXITCXFOL-IBGZPJMESA-N	440.972	1.395	50	20	IDGD	
CCOc1cnc(C(=O)NC2CCN(C3CCN(C(=O)C(Cl)Cl)CC3)CC2)cn1	1833952548	VQKZIYGCQHJYRZ-UHFFFAOYSA-N	444.363	1.864	50	20	IDGD	
O=C(C(=O)N1CCO[C@]2(COCCN(C(=O)CCBr)C2)C1)c1ccccc1	1834702107	UJKUBIRCUSSDNG-IBGZPJMESA-N	439.306	1.111	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cncn3-c3ccncc3)CC2)CC1)[C@@H](F)Cl	1835078727	UHWFSIJZRDREKP-LJQANCHMSA-N	448.930	1.987	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cc(-n4ccnc4)ccn3)CC2)CC1)[C@@H](F)Cl	1835082364	ZOSJPRKYRFUAID-LJQANCHMSA-N	448.930	1.987	50	20	IDGD	
CC(=O)N(C)[C@@H](C)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1835123552	ACXSUFKMQQDYHO-BLLLJJGKSA-N	449.365	1.115	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)c1snnc1C1CC1	1835243076	VWTWRCYYYPGAJH-OAHLLOKOSA-N	441.985	1.200	50	20	IDGD	
COC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)CO[Si](C)(C)C)CC2)CC1	1835833339	AIOHXCJMEXLZNX-UHFFFAOYSA-N	427.618	1.363	50	20	IDGD	
C[C@@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1)n1cccc1C=O	1835957661	CSRCRLNBWOHPAG-UGSOOPFHSA-N	432.304	1.122	50	20	IDGD	
O=C(c1cc2c(s1)CCCC2)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1	1836875508	HHYIWGVJTIELCR-FOIQADDNSA-N	442.965	1.297	50	20	IDGD	
C[Si](C)(C)C#CCCCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1	1837426999	ISXNTUIYACRJQV-YLJYHZDGSA-N	445.032	1.094	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)C/N=C/c3ccco3)C2)C1	1837715536	VXGIDCRIJAZQLO-YUSOBQLHSA-N	437.569	1.006	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3nc4ncccn4n3)CC2)CC1	1838225523	HDQKRAMUUVAKFZ-INIZCTEOSA-N	434.928	1.754	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(C)nc3C)CCO2)C1	1838363628	DGHGESAAQODHKZ-YLJYHZDGSA-N	425.913	1.022	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCC(OC2CCN(C(=O)[C@@H]3CNC(=O)C3)CC2)CC1	1838639036	SOQHUWXQUAHEQI-DJJJIMSYSA-N	434.364	1.357	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(O)nc(Cl)c3)C2)C1	1839143423	WBCLFTCJGMTICI-FZKQIMNGSA-N	432.304	1.528	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(O)c(F)c3)C2)C1	1839154747	XCVAVPCHYVDGQE-OALUTQOASA-N	449.306	1.838	50	20	IDGD	
Cc1ccncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839200258	FCLXOLTUXBHPHJ-PBHICJAKSA-N	430.274	1.151	50	20	IDGD	
O=C(c1cc(O)ccc1F)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839202241	YDWUKRWUJLGVLT-YOEHRIQHSA-N	449.248	1.292	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(C#N)ccc3F)CCO2)C1	1839422100	CGZRCOONLYACHS-UZLBHIALSA-N	439.871	1.021	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2	1840030405	KQHLGQJNOPOGMG-DVOMOZLQSA-N	425.751	1.634	50	20	IDGD	
C=CCC(=O)N1CCO[C@@]2(COCCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1	1840175379	NDEOCCVYNUGFSL-BPNKPRMTSA-N	431.439	1.904	50	20	IDGD	
O=C(Cc1ccc(F)c(F)c1)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840188205	WINCWFGMHSMCMH-GOSISDBHSA-N	437.270	1.767	50	20	IDGD	
COc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)c(C)c1	1840189450	RSBLGPKYCGIUBI-LJQANCHMSA-N	431.316	1.877	50	20	IDGD	
CC(C)(C)n1ncc(C(=O)N2CC3(CCCN3C(=O)c3cccc(B(O)O)c3)C2)c1Cl	1843013611	OYAZKLRSZMZIBT-UHFFFAOYSA-N	444.728	1.102	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2cc(-c3ccco3)no2)C1	1843244557	JQBDLFBPFWUPEZ-UHFFFAOYSA-N	436.428	1.064	50	20	IDGD	
O=C(c1nc2c(Br)cc(F)cn2n1)N1CC2(CCCN2C(=O)[C@H](F)Cl)C1	1843365818	LWNSLEDGYNSOAP-JTQLQIEISA-N	448.655	1.982	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1cc(C(C)(C)C)n[nH]1)C2	1843416250	OSMNVZZXJCZIFZ-ZVHZXABRSA-N	439.520	1.658	50	20	IDGD	
Cn1ncc(Br)c1C(=O)N1CCCC12CN(C(=O)CCBr)C2	1843604417	WYHGEWPQQLPGKW-UHFFFAOYSA-N	434.132	1.785	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)c1cc(C)[nH]n1)C2	1844692842	QIIYGUBWXMTXJT-UHFFFAOYSA-N	427.417	1.682	50	20	IDGD	
COC(=O)c1ccc(OCC(=O)N2CC3(CCCN3C(=O)[C@@H](F)Br)C2)cc1	1845220700	IVVZIPCWXUNSAS-OAHLLOKOSA-N	443.269	1.746	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CNC(=O)OC(C)(C)C	1847510955	ITLYMHMBXJDGOL-XUXIUFHCSA-N	448.358	1.247	50	20	IDGD	
O=C(c1ccc2[nH]nc(C(F)(F)F)c2c1)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl	1847562365	DEDCZUWMNRDXJQ-MELADBBJSA-N	430.814	1.997	50	20	IDGD	
Cc1noc2nc(-c3ccc(F)cc3)cc(C(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)c12	12799941	OERDFVPECJAXQA-LBPRGKRZSA-N	432.433	1.533	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CCn2cnc3sccc3c2=O)cc(OC)c1OC	14074892	ALRQYVGESJKQTK-UHFFFAOYSA-N	432.458	1.335	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)cc1	15885358	ODOUBVAJRQPBGD-UHFFFAOYSA-N	447.513	1.710	50	20	IDGD	
CC(C)C[C@H](C(=O)NNC(=O)COc1ccccc1F)N1C(=O)[C@H]2CC=CC[C@@H]2C1=O	15889719	RQHPSVGFFXRUHB-YQQAZPJKSA-N	431.464	1.718	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)s1	28580967	WJNDDWMYOFIHQH-UHFFFAOYSA-N	437.543	1.471	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(C)(C)c2ccc3c(c2)OCCO3)c2ccccc2c1=O	60215087	AZWLYOOTHWFQDO-UHFFFAOYSA-N	436.468	1.926	50	20	IDGD	
CC(C)NC(=O)C(=O)NNC(=O)[C@@H]1C[C@H]2CCCC[C@H]2N1C(=O)c1ccc(Cl)cc1	726155798	BONFXNDLKIICPW-OIISXLGYSA-N	434.924	1.785	50	20	IDGD	
CS(=O)(=O)Cc1c(C(=O)NNC(=O)CNC(=O)c2cccs2)oc2ccccc12	726510542	XYQSLYHIHGKHRO-UHFFFAOYSA-N	435.483	1.230	50	20	IDGD	
Cc1cc(C(=O)N2CCC[C@@H]2C(=O)NNC(=O)COc2ccccc2F)ccc1[N+](=O)[O-]	726523158	CWADQBQZHXJSAM-QGZVFWFLSA-N	444.419	1.873	50	20	IDGD	
CC[C@H](C)N(C)CCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	727229270	MEOSSXVNVYJSMT-HNNXBMFYSA-N	425.555	1.145	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)CCc2nc(-c3ncccn3)no2)cc1OC	727723885	VFUSFTUGDTWLLT-UHFFFAOYSA-N	426.433	1.718	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)NCCC(=O)NNc2nc(-c3ccccc3)no2)cc1	728080134	GCJYVKMEWQIQOL-UHFFFAOYSA-N	429.458	1.751	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)CSCc3ccncc3)cc2)CC1	728216399	ZHNMOHCPTVKWRB-UHFFFAOYSA-N	435.575	1.394	50	20	IDGD	
COc1ccc(C)cc1-n1ccc(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)n1	728846830	SPFDADWFYOFRDB-UHFFFAOYSA-N	435.488	1.657	50	20	IDGD	
O=C(COC(=O)Cc1coc(-c2cccs2)n1)NNC(=O)c1ccc([N+](=O)[O-])cc1	730053900	CAWCHORRDABEBD-UHFFFAOYSA-N	430.398	1.858	50	20	IDGD	
CSCC[C@H](NC(=O)c1ccc(Cl)cc1Cl)C(=O)NNC(=O)Cc1cc[nH]n1	730103121	XYBGQUDVDMRGKK-AWEZNQCLSA-N	444.344	1.958	50	20	IDGD	
O=C(NCC(=O)N1CCN(c2ccccc2)CC1)NNC(=O)c1cccc2ncccc12	730124182	FKUWDGQWRXFTHF-UHFFFAOYSA-N	432.484	1.528	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccccc1	730781317	KAIMEGKLILBXFC-IBGZPJMESA-N	433.464	1.960	50	20	IDGD	
C[C@@H]1CCC[C@H](NC(=O)CN2CCN(C(=O)NNC(=O)c3ccc(C#N)cc3)CC2)C1	731223406	ZIVZQAZXXZRHSO-APWZRJJASA-N	426.521	1.225	50	20	IDGD	
O=C(Cc1ccc(S(=O)(=O)N2CCCCC2)s1)NNC(=O)Cc1ccccc1F	731330428	RAGDFYGZMCVOFM-UHFFFAOYSA-N	439.534	1.994	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)CCNC(=O)N1CCc2ccccc2C1	731866302	LACRMZMEFOWYCE-HNNXBMFYSA-N	428.464	1.898	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)c1cc(S(=O)(=O)N2CCOCC2)ccc1F)c1ccccc1	732001087	MSMJOGWYIUHRDQ-QGZVFWFLSA-N	449.504	1.801	50	20	IDGD	
O=C(Cn1ncn2nccc2c1=O)NNC(=O)c1cc(-c2ccccc2)nc2ccccc12	732726820	QSFJNPOINFTRAL-UHFFFAOYSA-N	439.435	1.567	50	20	IDGD	
Cc1cccc(-n2c(NNC(=O)CN3C(=O)CN(C)C3=O)nc3ccccc3c2=O)c1C	733263769	CFPCZMXKNGVTCV-UHFFFAOYSA-N	434.456	1.340	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)[C@H](C)C(C)C)N(S(C)(=O)=O)CC2	733358162	PIQPGMXUTGUOQO-CZUORRHYSA-N	441.550	1.392	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)[C@H](Cc2cccc(F)c2)n2nnnc2C)cc1	733517698	YQDBPNBSGXWTHF-SFHVURJKSA-N	440.435	1.217	50	20	IDGD	
Cn1c(=NNC(=O)CC[C@@H]2NC(=O)N(c3ccc(C#N)cc3)C2=O)sc2ccccc21	733754720	MDDFOXBZLNNOSG-HNNXBMFYSA-N	434.481	1.949	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)C1CCC(NC(=O)C2CCCC2)CC1	734239966	IFUDVGOHVSVJSI-UHFFFAOYSA-N	439.557	1.707	50	20	IDGD	
O=C(NNC(=O)c1cc2c(s1)CCCCC2)N[C@@H]1CCN(CCN2CCOCC2)C1	734684859	AMXIVOQHVBIHGJ-QGZVFWFLSA-N	435.594	1.368	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)C[C@H]2CCc3ccccc32)CC1	735118533	WHYMVSBBGOGWRB-QGZVFWFLSA-N	429.546	1.581	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H](C)c2cn(C)nc2C)c1	739035797	XMRSXPFZLPIDBC-CYBMUJFWSA-N	436.538	1.464	50	20	IDGD	
COCCN1CC[C@@H](NC(=O)NNC(=O)COc2ccccc2Cc2ccccc2)C1	739036971	XIAQGORCMQSHIH-HXUWFJFHSA-N	426.517	1.707	50	20	IDGD	
O=C(CCS(=O)(=O)c1ccc2c(c1)OCCCO2)NNC(=O)c1ccc([N+](=O)[O-])cc1	741207719	YIKROZMZLXSUEW-UHFFFAOYSA-N	449.441	1.381	50	20	IDGD	
CC(=NNC(=O)Cn1nnc(-c2ccccc2)n1)c1ccc(S(=O)(=O)CC(F)F)cc1	741760603	PLIUWEXDLYWOGI-UHFFFAOYSA-N	448.455	1.919	50	20	IDGD	
CC(=NNC(=O)c1cc([N+](=O)[O-])ccc1O)c1ccc(S(=O)(=O)N2CCOCC2)cc1	741773565	GLGNROVWNFLFTI-UHFFFAOYSA-N	448.457	1.475	50	20	IDGD	
O=C(Cc1cc(O)nc(O)n1)NN=C1C(=O)Nc2c(Br)cc(Cl)cc21	743445721	DQXMFPADANAOCM-UHFFFAOYSA-N	426.614	1.319	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)c2ccc(CS(C)(=O)=O)o2)cc1Cl	743833915	MAIGBZILWUPBNK-UHFFFAOYSA-N	431.854	1.961	50	20	IDGD	
Cc1cccc(N2C[C@@H](C(=O)OCC(=O)NNC(=O)c3ccc(C#N)cc3)CC2=O)c1C	744568585	XMQODURLOUNDRI-SFHVURJKSA-N	434.452	1.532	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1nnc(O)c2ccccc12	744620120	DLUSPLOGESUZKH-UHFFFAOYSA-N	429.458	1.113	50	20	IDGD	
COc1ccc2c(c1)C[C@H](C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1)CO2	744620809	OHBKRWRPHMVLKG-INIZCTEOSA-N	447.513	1.411	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)c2cc(S(=O)(=O)N3CCCC3)ccc2O)c1	745991503	WBCCDTIFGPXGRM-UHFFFAOYSA-N	433.486	1.325	50	20	IDGD	
CC(C)(C)C(=O)Cn1cc(C(=O)NNC(=O)c2cc(F)ccc2Br)nn1	746215510	JODWCCKLCQJLHT-UHFFFAOYSA-N	426.246	1.870	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)Cc1cn2ccccc2n1)n1nnc(-c2ccc(Cl)cc2)n1	746549074	NSQJGVJPJLEDGB-INIZCTEOSA-N	438.879	1.982	50	20	IDGD	
O=C(CCOc1ccccc1)NNC(=O)NNC(=O)c1ccc(Br)s1	747108297	XLOCVVADARXTTD-UHFFFAOYSA-N	427.280	1.955	50	20	IDGD	
CSCc1noc(CCC(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)n1	747420200	PFYMASIIQASIRL-UHFFFAOYSA-N	441.535	1.029	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)NOCc2cccnc2)cc1	747578436	DCQAYNXXYQNTEA-WQRHYEAKSA-N	446.467	1.984	50	20	IDGD	
COc1ccc(Br)c(S(=O)(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c1	747594928	FTEJJMIDMFMWGT-UHFFFAOYSA-N	430.236	1.989	50	20	IDGD	
CCc1cc(Br)ccc1NNC(=O)c1cnc2c(c1)c(=O)n(C)c(=O)n2C	753175585	LRHUVKOBLAGBJN-UHFFFAOYSA-N	432.278	1.714	50	20	IDGD	
COC(=O)c1cc2c(cc1NC(=O)C(=O)NNC(=O)Cc1ccc(Cl)cc1)OCO2	753840383	JMMGIBHIZUQZFB-UHFFFAOYSA-N	433.804	1.184	50	20	IDGD	
COC(=O)CCNC(=O)c1ccc(NC(=O)NNC(=O)c2ccc(OC)cc2OC)cc1	755602594	FZUUGCUGUNFWNG-UHFFFAOYSA-N	444.444	1.463	50	20	IDGD	
CCCNC(=O)c1cccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1	755799081	SYGKFWOTCLBOQY-UHFFFAOYSA-N	447.517	1.543	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)Nc1ccc(C(=O)N2CCOCC2)cc1	755933193	HHOHBIMGCMHSIS-SFHVURJKSA-N	426.429	1.152	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)Nc2ccc(S(=O)(=O)/N=C3/CCCN3C)cc2)c(O)c1	756078095	PHTQROOCLHWHBX-MOHJPFBDSA-N	445.501	1.980	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)C(=O)Nc1ncc(C2CCCCC2)s1	756155046	LDTVGGPROPLHEA-UHFFFAOYSA-N	440.489	1.566	50	20	IDGD	
C[C@H]1CN(C(=O)Cn2cc(NC(=O)NNC(=O)Cc3ccc(F)cc3)cn2)C[C@@H](C)O1	756840755	ZHJFEUZVYNBVHV-OKILXGFUSA-N	432.456	1.053	50	20	IDGD	
CCn1cc(S(=O)(=O)NNC(=O)NCc2cccc(C(F)(F)F)c2)c([N+](=O)[O-])n1	756935454	BTAISNOLYKBUJU-UHFFFAOYSA-N	436.372	1.523	50	20	IDGD	
O=C(COC(=O)c1ccccc1CN1CCOCC1)NNC(=O)c1ccc([N+](=O)[O-])cc1	758491474	BGKWLIXQRBQOCP-UHFFFAOYSA-N	442.428	1.045	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)NNC(=O)C(=O)Nc2ccccn2)c(C)n1C[C@H]1CCCO1	758822274	PDFFMZPJNLHQKR-UWKDKTGGSA-N	436.472	1.372	50	20	IDGD	
C[C@H](CO)CCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	759630346	BNTWFNMZDNRGSH-HNNXBMFYSA-N	426.539	1.214	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)Nc1ccnn1Cc1ccc(F)cc1	760316768	ZRMAXTXDDZNUNA-UHFFFAOYSA-N	442.363	1.084	50	20	IDGD	
CCn1c(=O)n(CC)c2nc(NC(=O)CCC(=O)NNC(=O)c3cccc(C#N)c3)ccc21	761155313	MINPHVMUCYEHCY-UHFFFAOYSA-N	449.471	1.289	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Cc2ccccc2F)nc1I	761159466	QPQGJZBETSUPLN-UHFFFAOYSA-N	429.189	1.838	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)NCc1ccnc(N2CCOCC2)c1	761658964	DHKMZAGUPOUACS-UHFFFAOYSA-N	431.518	1.550	50	20	IDGD	
O=C(NNc1nccc(N2CCOCC2)n1)C1CCN(C(=O)/C=C/c2ccccc2)CC1	762855067	FFECTTFBMWEWCJ-VOTSOKGWSA-N	436.516	1.708	50	20	IDGD	
O=C(NCC(F)(F)F)NN=Cc1ccc(OCCn2cc(C(=O)O)nn2)c(Cl)c1	763169250	OSMKPMLGISYEFQ-UHFFFAOYSA-N	434.762	1.904	50	20	IDGD	
CC[C@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1	763573016	PMTLCICWNZIWLF-UGSOOPFHSA-N	440.456	1.141	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccn(CCc3ccncc3)n2)c2ccccc2n1	763615133	ATLAYLWNOQHLAH-UHFFFAOYSA-N	443.467	1.777	50	20	IDGD	
COC(=O)c1cc2cc(NC(=O)C(=O)NNC(=O)COc3ccc(OC)cc3)ccc2o1	763660050	VNDCFWFKFKSNCY-UHFFFAOYSA-N	441.396	1.393	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(N2CCCCC2)cc1	763663264	PTGSLLWOGOZPCD-UHFFFAOYSA-N	426.473	1.850	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc3oc(C(F)(F)F)nc3c2)cc1	763672951	ACZSSPFHTWFTAE-UHFFFAOYSA-N	447.329	1.883	50	20	IDGD	
CC(C)N(C)c1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)cc1F	763679286	LYBHHFVYQPNQOC-UHFFFAOYSA-N	427.436	1.707	50	20	IDGD	
Cc1nc(C)c(NC(=O)C(=O)NNC(=O)COc2ccc(Br)cc2)s1	763693998	GRUIJRAPONGYPX-UHFFFAOYSA-N	427.280	1.687	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1nc(-c2cccs2)cs1	763812101	CLHDUBYTDCHOCZ-UHFFFAOYSA-N	427.467	1.908	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1cccc(Oc2cnccn2)c1	763857259	LSDOBMWAUZZCQC-ZDUSSCGKSA-N	439.403	1.961	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)CCC(=O)N2C	763866361	OUSFPTHYYRWOMK-LBPRGKRZSA-N	428.420	1.288	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccc(OCCN(C)C)cc1	763871520	HGESMCGDIHCUCD-AWEZNQCLSA-N	432.452	1.320	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)C(=O)Nc2ccc3c(c2)NC(=O)CS3)cc1	763897339	YIOPPPSWMWYRIJ-UHFFFAOYSA-N	430.511	1.917	50	20	IDGD	
COCCOc1ncccc1NC(=O)C(=O)NNC(=O)c1cc2c(s1)CC[C@@H](C)C2	763943105	RAXBYACCBLBOMJ-GFCCVEGCSA-N	432.502	1.693	50	20	IDGD	
CC(C)C[C@@H](C)n1nccc1NC(=O)C(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	763947886	DEBMOTOTUZPNAE-CQSZACIVSA-N	439.476	1.781	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)Nc1ccc(C[C@H]2CC(=O)NC2=O)cc1	763967648	LHDWWRIMMYGZMD-ZDUSSCGKSA-N	428.470	1.542	50	20	IDGD	
NC(=O)CCSc1ccccc1NC(=O)C(=O)NNC(=O)c1cc(Cl)ccc1O	763974432	POSKHWMKFYFVRE-UHFFFAOYSA-N	436.877	1.413	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)c2cc(S(N)(=O)=O)cc(Cl)c2F)o1	763997829	BJYZSLVKJFKVJG-UHFFFAOYSA-N	446.888	1.636	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)c(OCc2ccccc2)c1	764002697	QQFMHDNNVCVFMW-INIZCTEOSA-N	445.497	1.095	50	20	IDGD	
COCCn1ccc2ccc(NC(=O)C(=O)NNC(=O)c3ccc4c(c3)OCCO4)cc21	764006075	KMDOMGSGEIQAAD-UHFFFAOYSA-N	438.440	1.459	50	20	IDGD	
CN(C)CC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2cccc3ccccc23)cc1	764050205	CEMSEMGDBQNFLO-UHFFFAOYSA-N	433.468	1.740	50	20	IDGD	
COc1cccc(-c2nsc(NC(=O)C(=O)NNC(=O)c3cccc(OC)c3O)n2)c1	764132651	ZLKGZHASMQSMBV-UHFFFAOYSA-N	443.441	1.328	50	20	IDGD	
Cc1ccc(N2CCOC2=O)cc1NC(=O)C(=O)NNC(=O)c1cccc2ncccc12	764260297	PGKWXHNJSRPLQZ-UHFFFAOYSA-N	433.424	1.900	50	20	IDGD	
CC(C)(C(=O)NNC(=O)C(=O)Nc1ccc2nc3n(c(=O)c2c1)CCC3)c1ccccc1	764303737	WZRORHPLGWFMLG-UHFFFAOYSA-N	433.468	1.406	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)C(C)(C)c2ccccc2)c(OCCN(C)C)c1	764309649	SWQMOJUTSGDYSU-UHFFFAOYSA-N	426.517	1.999	50	20	IDGD	
CCN(Cc1ccccc1NC(=O)C(=O)NNC(=O)c1cnn(-c2ccccc2)c1)C(C)=O	764352003	WFRIHWCCWSWFLZ-UHFFFAOYSA-N	448.483	1.640	50	20	IDGD	
COc1cccc(COc2cccc(NC(=O)C(=O)NNC(=O)c3cnn(C)c3)c2C)c1	764358634	MDDUCBWDTNGLRN-UHFFFAOYSA-N	437.456	1.716	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)C(=O)Nc1ccc(NC(=O)[C@H]2CCCO2)cc1	764363613	SUJHUCHCRASHRU-GOSISDBHSA-N	440.456	1.107	50	20	IDGD	
CC(C)CCn1nccc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	764387294	JBIANFREWCMEGI-UHFFFAOYSA-N	427.440	1.858	50	20	IDGD	
Cc1ccc(F)c(NC(=S)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)c1	764515360	OVWQCXMHYKDBCE-UHFFFAOYSA-N	429.521	1.910	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NN=Cc1ccc(Br)cn1	764831845	VUEZFGZBSGUKRP-UHFFFAOYSA-N	430.306	1.752	50	20	IDGD	
Cn1c(N)c(C(=O)/C(C#N)=C\c2cc(Br)cc3c2OCC3)c(=O)n(C)c1=O	764883539	ACWAYIXBDIQQJK-WZUFQYTHSA-N	431.246	1.153	50	20	IDGD	
CN1CCN(Cc2cccc(C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)c2)CC1	765318794	QQUUMOTYZQCBTR-UHFFFAOYSA-N	433.553	1.500	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)c2ccc(S(N)(=O)=O)c(Cl)c2)n[nH]1	765599879	JEOXIMWUWYYXKW-UHFFFAOYSA-N	449.876	1.461	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)/C=C3/CC[C@H](C)C3)CC2)cc1	766636083	JAJIGBIKZDZFEY-SKQHNDAPSA-N	434.562	1.195	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)CSCc3cccnc3)CC2)cc1	766649605	RJGYKMOTNOSCSF-UHFFFAOYSA-N	427.574	1.588	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)c1ccc2n[nH]cc2c1	766663798	OAYXFAKKRJNYKF-UHFFFAOYSA-N	426.908	1.795	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)NCCS(=O)(=O)CC2CC2)c1	767215447	DIXBRHUJKNREPG-UHFFFAOYSA-N	434.312	1.227	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)c2n[nH]c(C3CC3)c2Br)c1	768640016	KMIPJLPCIJZAEN-UHFFFAOYSA-N	432.234	1.539	50	20	IDGD	
C[C@@H](NC(=O)NNc1nc(O)c2cnn(C(C)(C)C)c2n1)c1nnc2n1CCCCC2	770386037	OKXDSEIECWAUNK-LLVKDONJSA-N	428.501	1.992	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)[C@@H]1CC(=O)N(c2c(F)cccc2F)C1	770574842	MVLUHGFHDONEQD-CYBMUJFWSA-N	433.411	1.943	50	20	IDGD	
CCN1CCN(c2cccc(NC(=O)C(=O)NNC(=O)COCc3ccccc3)c2)CC1	770771923	PWPPWLJLPBNMRB-UHFFFAOYSA-N	439.516	1.131	50	20	IDGD	
CN1CCN(Cc2ccc(C(=O)NNc3nc(O)c4cnn(C(C)(C)C)c4n3)cc2)CC1	770954757	GVABYSZFABOEBD-UHFFFAOYSA-N	438.536	1.791	50	20	IDGD	
COc1cc(OCC(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)ccc1[N+](=O)[O-]	770966103	ROSPZATWVZTLMD-UHFFFAOYSA-N	431.409	1.726	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)/C=C\c3ccc(I)o3)nc21	770970784	DNBMGQMENBDAEE-HYXAFXHYSA-N	426.174	1.423	50	20	IDGD	
CN1C(=O)N[C@@]2(CCC[C@@H]2CNC(=O)NNc2ccc(Br)c(F)c2)C1=O	771335284	SVDJZJQJLGKMIV-JDNHERCYSA-N	428.262	1.935	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1ccc(S(=O)(=O)N2C[C@@H](C)C[C@@H](C)C2)cc1	771843918	AUDPXCJGIGGGFY-QLFBSQMISA-N	439.534	1.456	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)c(-c2ccccc2)n1	772565057	NQZPZGWEBNFAEJ-UHFFFAOYSA-N	433.877	1.463	50	20	IDGD	
CN(C)C(=O)N1CCC(C(=O)NNC(=O)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)CC1	773411854	AUWFLGHSRKDTFE-OAHLLOKOSA-N	425.530	1.175	50	20	IDGD	
O=C(NNc1ccc(C(F)(F)F)cn1)C(=O)Nc1cccc(N2CCCS2(=O)=O)c1	773665332	BLMLROBLKGKZGP-UHFFFAOYSA-N	443.407	1.722	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNS(=O)(=O)c1ccc(Br)cc1Cl	777939246	KLAIACPWOOLRON-UHFFFAOYSA-N	442.719	1.937	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@]2(C[C@H]2C(=O)NNC(=O)c2nnc(O)c3ccccc23)C1	780171281	KCOANTNUJBABLN-LHSJRXKWSA-N	427.461	1.744	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)c1c[nH]nc1-c1cnn(C)c1	780172328	UFXARRGUTXEGSI-JTQLQIEISA-N	433.266	1.801	50	20	IDGD	
O=C(NNc1ncncc1Cl)[C@H]1CCC[C@@H](C(=O)NNc2ncncc2Cl)C1	781824674	GCSFDQRQEGWBLI-AOOOYVTPSA-N	425.280	1.966	50	20	IDGD	
Cn1nc(Br)cc1C=NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	782152447	QACAOTLULHGSKI-UHFFFAOYSA-N	440.323	1.731	50	20	IDGD	
CN(c1ccc(NS(=O)(=O)CBr)cn1)S(=O)(=O)CBr	782472204	IRLIRLROXCSXRH-UHFFFAOYSA-N	437.135	1.294	50	20	IDGD	
O=C(CN1CCC[C@H](n2ccc(C(F)(F)F)n2)C1)NNC(=O)c1ccc([N+](=O)[O-])cc1	782535974	KMFOUURNDPNBAI-AWEZNQCLSA-N	440.382	1.908	50	20	IDGD	
Cc1cc(NNC(=O)C(=O)Nc2ccnn2[C@H]2CCN(Cc3ccccc3)C2)nc(C)n1	783327073	XDTBCZMYPKUZPJ-SFHVURJKSA-N	434.504	1.819	50	20	IDGD	
Cc1ccc(NNC(=O)C(=O)Nc2ccc(S(=O)(=O)N3CCC(C)CC3)cc2)nn1	783954478	XMPMROAJEVKPEX-UHFFFAOYSA-N	432.506	1.287	50	20	IDGD	
COc1c(F)cc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)cc1F	784210219	ITTIOVIEZIXNGH-UHFFFAOYSA-N	440.428	1.496	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](n2cc(C(=O)NNC(=O)NCC(F)(F)F)cn2)C1	784625964	SCZJFJQMUDCOFK-GFCCVEGCSA-N	434.419	1.961	50	20	IDGD	
CN1CCN(Cc2cccc(NC(=O)C(=O)NNc3ccnc(Br)c3)c2)CC1	784829087	WRFSJWCARNOJJQ-UHFFFAOYSA-N	447.337	1.673	50	20	IDGD	
CCNC(=O)N(C)NC(=O)C(=O)Nc1cnc2c(c1)C[C@H](NC(=O)OC(C)(C)C)CC2	784916520	YVVLDUQWEBCVRI-CYBMUJFWSA-N	434.497	1.095	50	20	IDGD	
COCCCOc1ccccc1NC(=O)C(=O)NNC(=O)c1cc([N+](=O)[O-])ccc1O	785023564	NRGXNJUIGIXHNA-UHFFFAOYSA-N	432.389	1.115	50	20	IDGD	
CC(C)Oc1c(F)cc(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)cc1F	785060671	JHKIOWRYEFEDGC-UHFFFAOYSA-N	431.399	1.728	50	20	IDGD	
Cn1ccnc(NNC(=O)C(=O)Nc2ccc(OCc3cccc(F)c3)c(F)c2)c1=O	785086046	KCIADAMZEFNIRL-UHFFFAOYSA-N	429.383	1.719	50	20	IDGD	
O=C(NNc1cc(F)c(F)c(F)c1)C(=O)Nc1ccc(CC(=O)N2CCOCC2)cc1	785088386	KYMJCSSHWCHILY-UHFFFAOYSA-N	436.390	1.587	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1cc(Cl)ccc1N(C)C	785331616	XEKJVJURFDARDX-UHFFFAOYSA-N	440.909	1.900	50	20	IDGD	
Cc1ccc(C(=O)NCC2CC2)cc1NC(=O)C(=O)NNC(=O)COc1ccc(F)cc1	785991473	RQNSUBHHRSHBDW-UHFFFAOYSA-N	442.447	1.439	50	20	IDGD	
CN(C)CCc1ccc(CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1	786103709	SOPHXWPPKXRAPE-UHFFFAOYSA-N	432.550	1.228	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1cccnc1-c1cnn(C)c1	786415094	WNLRIWXVGVUWCK-GFCCVEGCSA-N	426.408	1.175	50	20	IDGD	
COC(=O)COc1ccc(C=NNC(=O)[C@H](C)CN2C[C@H](C)O[C@@H](C)C2)cc1[N+](=O)[O-]	788702073	NUJIDKYSTXTHTR-ILXRZTDVSA-N	436.465	1.342	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)c1ccc(C)cc1)C(=O)NNc1nc2ccccn2n1	791249443	UQEAHPWWYVEFBG-OAHLLOKOSA-N	434.547	1.581	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc(C#N)cc2)cc(N2CCN(C(C)C)CC2)c1	792266720	CGQHOCNCZIJEKL-UHFFFAOYSA-N	448.527	1.797	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)c1cc([N+](=O)[O-])ccc1Sc1nc[nH]n1	792798909	RYZOPNBIZUGSOB-UHFFFAOYSA-N	428.430	1.876	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)F)cc1)C(=O)Nc1cnc(CC2CC2)nc1	793018185	OIGSIGOOZSXCQF-UHFFFAOYSA-N	425.417	1.507	50	20	IDGD	
CCCOc1ccc(C(=O)NNS(=O)(=O)c2ccc(C(=O)N(C)C)cc2)cc1OC	799520431	YYPLDQUCNIMBJB-UHFFFAOYSA-N	435.502	1.809	50	20	IDGD	
COc1ccc(-c2nc(C)c(C(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)s2)c(F)c1	799863480	DHBOOYHBJGXAIL-SNVBAGLBSA-N	427.479	1.462	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2CC(=O)N(C)[C@@H]2c2cccc(Cl)c2)cc1	801108372	MJWAMOWYQNBXFU-SJLPKXTDSA-N	428.876	1.954	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)C(=O)Nc2cc(CS(C)(=O)=O)ccc2OC)c1	806968487	JLMLFHOSPQQIKE-UHFFFAOYSA-N	435.458	1.108	50	20	IDGD	
Cc1cc(C(=O)NC2CCCC2)ccc1NC(=O)C(=O)NNc1ccc(-n2ccnc2)nn1	807429407	RESZFVXWBFVISU-UHFFFAOYSA-N	448.487	1.725	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)NC[C@H](N3CCOCC3)C(F)(F)F)nc21	807539746	KDEYMYKBFFMMET-NSHDSACASA-N	446.434	1.176	50	20	IDGD	
C#CC[C@@]1(C(=O)NNC(=O)CCNC(=O)OC(C)(C)C)CCCN1C(=O)OC(C)(C)C	809755200	HZWQEGYEXYAPFK-NRFANRHFSA-N	438.525	1.842	50	20	IDGD	
COC(=O)Cc1occ(C)c1C(=O)NNC(=O)c1ccc(CSc2nncn2C)cc1	810021455	GMHONICCVFXKHE-UHFFFAOYSA-N	443.485	1.799	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccccc1F)NNc1ccc(S(=O)(=O)C(F)F)cc1	810346358	MVJUVZKINYBRNS-UHFFFAOYSA-N	437.421	1.244	50	20	IDGD	
Cc1cc(C)c(C)c(S(=O)(=O)NCC(=O)NNc2ccccc2S(C)(=O)=O)c1C	810384966	JKFNXMHGIMDHOA-UHFFFAOYSA-N	439.559	1.745	50	20	IDGD	
Cc1nc(-c2ccccn2)nc(NNC(=O)CNS(=O)(=O)c2c(C)noc2C)c1C	810407876	OFPOMPYQGQSKSZ-UHFFFAOYSA-N	431.478	1.182	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)Nc1ccccc1CN1C(=O)CNC1=O	813837238	GEFHXIKMCAELBY-UHFFFAOYSA-N	446.489	1.137	50	20	IDGD	
N#Cc1cc(C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cnc1C(F)(F)F	815478170	KNEBNXRPXKWKIH-UHFFFAOYSA-N	437.290	1.498	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)COc2cccc(C(F)(F)F)c2)cn2ccnc12	815564610	NVDDVIMXWHMIOF-UHFFFAOYSA-N	435.362	1.826	50	20	IDGD	
CCN(CC)Cc1ccc(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)N(C)C)cc1	815751037	PPXSYTITEZTQLP-UHFFFAOYSA-N	447.561	1.861	50	20	IDGD	
Cc1nc(-c2cccc(NC(=O)C(=O)NNc3ccccc3S(=O)(=O)N(C)C)c2)no1	815751616	HDECVFFOPLEODI-UHFFFAOYSA-N	444.473	1.377	50	20	IDGD	
Cc1nc2nc(C(F)(F)F)nn2c(C)c1CCC(=O)NNC(=O)CNc1ccccc1	823328262	XBLPSEKVNOMKHO-UHFFFAOYSA-N	435.410	1.952	50	20	IDGD	
NC(=O)[C@@H]1CC(C(=O)NNC(=O)CCSc2ccc(F)cc2)=NN1c1ccc(F)cc1	913082144	NZGQEXHIEFMISK-KRWDZBQOSA-N	447.467	1.715	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)[C@H]2CC(=O)N(c3ccc4c(c3)OCCO4)C2)c(C)c1	913164417	HQABLIQAVDOXGY-INIZCTEOSA-N	438.484	1.687	50	20	IDGD	
CC(=O)c1cccc(S(=O)(=O)NCC(=O)NNC(=O)c2ccc(Cl)cc2Cl)c1	913216293	OBMZXPXTQSLWDU-UHFFFAOYSA-N	444.296	1.936	50	20	IDGD	
C[C@@H](CNC(=O)NNC(=O)c1nn(-c2ccccc2)cc1O)N1CCc2ccccc2C1	914533315	WZNYLOKZBRUVTG-INIZCTEOSA-N	434.500	1.969	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ccc3nnc(C(F)(F)F)n3n2)CC1)C1CCCC1	914843628	QGKFVDLTBVJKOB-UHFFFAOYSA-N	425.415	1.697	50	20	IDGD	
O=C(COC(=O)C1CCN(C(=O)COc2ccccc2)CC1)NNC(=O)c1cccs1	915029794	IZSDPRNSRXQRGJ-UHFFFAOYSA-N	445.497	1.370	50	20	IDGD	
CC(=NNC(=O)[C@H]1COc2ccccc2O1)c1ccc(S(=O)(=O)N2CCOCC2)cc1	916293305	IWCRORXWVPQLFV-HXUWFJFHSA-N	445.497	1.388	50	20	IDGD	
CCn1cnc2c1c(=O)n(CC(=O)NN=C(C)c1ccccn1)c(=O)n2Cc1ccccc1	916330888	DFWFEGMHEWCFKX-UHFFFAOYSA-N	445.483	1.363	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCC2(c3ccc(F)cc3)CC2)c1	916624097	NIEMJSGBWWYFAH-UHFFFAOYSA-N	434.493	1.752	50	20	IDGD	
CCCc1c(C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)[nH]c(C)c1C(C)=O	916736525	XBPMBAGEWTUCHD-UHFFFAOYSA-N	448.545	1.868	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CCCNS(=O)(=O)c2ccc(C)c(C)c2)cc1	916830480	BGBDAHAYFMXFJH-UHFFFAOYSA-N	446.529	1.456	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)c1cc2c(cc1[N+](=O)[O-])OCO2	917511742	GEKJIKLVSDAVPM-UHFFFAOYSA-N	438.190	1.926	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C2CCN(S(=O)(=O)c3c(C)noc3C)CC2)c(O)c1	918338005	ZJCALBYGIMGMQX-UHFFFAOYSA-N	436.490	1.167	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)c1nc2ncc(Br)cn2n1	919806252	SWJPODQRAQJZOM-UHFFFAOYSA-N	435.238	1.126	50	20	IDGD	
O=C(NNC(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1)N[C@H]1CCS(=O)(=O)C1	919885927	PWHFGOYFMRFPLZ-HNNXBMFYSA-N	447.473	1.338	50	20	IDGD	
C[C@H]1CCCN(C[C@H](C)NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)C1	919914731	LFFBIROXJPGBHL-PMACEKPBSA-N	430.597	1.650	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)N(C)CC(=O)N[C@H]2CCS(=O)(=O)C2)c(C)n1CCC(C)C	920291463	VKYHEFMWWGXOQV-FJZBCQJGSA-N	448.589	1.820	50	20	IDGD	
Cc1cc(C)nc(SCc2ccc(C(=O)NNC(=O)CCNS(C)(=O)=O)cc2)n1	920428167	BZHVPRMAQGCDSJ-UHFFFAOYSA-N	437.547	1.086	50	20	IDGD	
CCCS(=O)(=O)Nc1ccccc1C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	920457384	GXZVGJXNYANYBK-UHFFFAOYSA-N	439.515	1.317	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)NCc2ccccc2S(=O)(=O)NC(C)(C)C)n1	920919482	PNIGMBHDTQBHEY-UHFFFAOYSA-N	436.538	1.107	50	20	IDGD	
O=C(Cn1nc2n(c1=O)CCCCC2)NNc1cc([N+](=O)[O-])ccc1Br	1261526603	PCTRUNJWSHEXRZ-UHFFFAOYSA-N	425.243	1.585	50	20	IDGD	
O=C(CCS(=O)(=O)c1ccc2c(c1)OCCCO2)NNC(=O)c1n[nH]c2c1CCCC2	1318672815	HXKVBLCJTQCGGO-UHFFFAOYSA-N	448.501	1.075	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCC[C@@H](c2n[nH]cc2NC(C)=O)C1	1319927044	GPODICVLVSGMEN-CYBMUJFWSA-N	448.911	1.671	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1cn(-c2ccccc2)nc1-c1ccccc1)c1nnnn1C	1521196968	HDTJPOLMDHXQEM-CQSZACIVSA-N	431.460	1.768	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(Cl)Cl)C2)c1cnn2cccnc12	1778963467	WSDAYCULWQGKDB-FZKQIMNGSA-N	426.304	1.661	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H]1CCc3ccccc3[C@@H]1O)CCO2	1779294436	GCEFCMWYHLBLGT-RRPUWOKSSA-N	446.620	1.964	50	20	IDGD	
O=C(c1cc2cccnc2[nH]1)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781330978	BOZVYBIRJIRKSK-CXAGYDPISA-N	425.258	1.697	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)Nc1ccccn1)C2	1782176222	YHFJBGZGURQWHW-KYFSNAEOSA-N	438.956	1.650	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cnn4ccncc34)CCO2)C1	1783347992	RBDBWYKUCAACKE-KDOFPFPSSA-N	436.310	1.346	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3ccc(C#N)cc3)[C@H]2C1	1783604136	AGPJREWANWEUGX-MGHWNKPDSA-N	434.334	1.864	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cn4cc(Cl)ccc4n3)CCO2)C1	1783876437	XVJWFPZMGCXVIN-IFXJQAMLSA-N	441.315	1.685	50	20	IDGD	
COc1ccc([N+](=O)[O-])c(C(=O)N2CCO[C@@]3(CCN(C(=O)C(Cl)Cl)C3)C2)n1	1783947992	PYYFFJJKCULMLE-MRXNPFEDSA-N	433.248	1.246	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3cnc4ccccn34)[C@H]2C1	1784050155	XUXIVAXPHOUWNU-DKIMLUQUSA-N	434.924	1.110	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C=N/N3CCCCC3)[C@H]2C1	1788604091	OQWWWUXAUOWGKX-HDVOYPAYSA-N	433.380	1.674	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc([N+](=O)[O-])[nH]3)[C@H]2C1	1789390476	GJVLHSLGJZZZHO-NDBFUVGKSA-N	433.292	1.753	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(Cl)cc3)[C@H]2C1	1789584564	ICZBRXBPBUZATM-SZMVWBNQSA-N	436.940	1.306	50	20	IDGD	
CCc1noc(C)c1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]2C1	1789924799	WYUOZBGKSNQPSG-TZQJONAQSA-N	432.290	1.829	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)c3ccco3)C[C@@H]21	1790960540	BVTLOZDZWVTRJD-PLPKTUSISA-N	429.311	1.466	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=N/O[C@H]3CCCCO3)C[C@@H]21	1791055695	DZZMDROXROMNRB-KMUFLGAISA-N	446.342	1.279	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CNc4ccccc43)C[C@@H]21	1791057520	FAJACTOWGPRGAI-XRDYDQJJSA-N	436.350	1.959	50	20	IDGD	
COc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](C)Br)[C@H]3C2)ccn1	1791058797	FVPZSHXVCXMVBA-MXAVVETBSA-N	426.311	1.467	50	20	IDGD	
CCOC(=O)C(C)(C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)CBr)C[C@@H]21	1792222680	RYRCXYAZUXNDEC-AJNGGQMLSA-N	447.370	1.586	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(N2CCN(C)CC2)cc1	1792531540	XIXCRQPWWLNMGP-NRDMVMEKSA-N	448.995	1.944	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Nc1ccccn1)C2	1792870685	IIVNRSPCDJWAGF-SVZOTFJBSA-N	439.354	1.503	50	20	IDGD	
Cc1ncc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)CBr)s1	1792873220	PBFNVBXIKHEHIK-YGSHXTJESA-N	430.368	1.615	50	20	IDGD	
CC(C)(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2)NC(=O)OC(C)(C)C	1793013315	XSVLLIFMHIPZPU-AYRXBEOTSA-N	435.924	1.804	50	20	IDGD	
CC(C)(C)OC(=O)NCCOCCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCl	1793106776	KXSSCWLDFUUIRC-QKPAOTATSA-N	447.960	1.156	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CSc1ccncc1	1793948103	PMRYBARLQVKNAI-ZJOBFFGXSA-N	442.379	1.794	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@@H](O)CCl)C4)c[nH]2)cc1	1794289982	LGJXMKWBMZQPSD-HNJRGHQBSA-N	431.920	1.793	50	20	IDGD	
C[C@H](Nc1cccnc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2	1795606227	WBYKFCLYJJWVNS-QIRZIZBZSA-N	429.290	1.162	50	20	IDGD	
C[C@@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@](C)(Cl)CCl)C2)n1ccccc1=O	1797935499	IIOFQTWYNVSRBA-MABMQTIPSA-N	430.332	1.235	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CNC(=O)c1cccs1)C2	1799274237	SLERLHXPYFJPMH-ABXQLRGKSA-N	448.372	1.304	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cccc(F)c1F)C2)[C@@H](F)Br	1799347287	OPBMPWCOKQAITN-OXUXUCFPSA-N	435.240	1.787	50	20	IDGD	
Cc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)CBr)C3)cc1O	1799468263	ZNGQCHFSRMAFFQ-JJAZEVLHSA-N	425.323	1.935	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1ccc2c(c1)C(=O)CC2	1799959573	PYSGOSHQNNAYBB-DLTLXFJOSA-N	439.281	1.709	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN1C(=O)CSC1=S)C2	1800085184	VTYYZDIHIALRGN-BBKSZCTCSA-N	438.402	1.721	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(-c2cc[nH]n2)cc1)c1cccc(B(O)O)c1	1800612198	LQJWCEHTQHMAHI-WKCHPHFGSA-N	444.300	1.322	50	20	IDGD	
Cc1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CCC(=O)NN(C)C)C3)cc(C)c1C(=O)O	1800859281	DBOVKKAGTSSQHF-BCDXTJNWSA-N	444.532	1.626	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c(F)ccc(OC)c1OC)C2	1800977771	XTJXHEPXQYITSP-LKQDWFRTSA-N	444.887	1.300	50	20	IDGD	
CC[C@@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccn(CCOC)n1)C2	1801801192	BLUWLRWAXIGGRH-LXTVHRRPSA-N	427.343	1.955	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)n(C(F)F)n1	1803142538	ZISNQHXZSGIIMA-VNQPRFMTSA-N	441.866	1.901	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)[C@H](C)CS(C)(=O)=O)[C@@H]1c1cccnc1	1803587601	HZYORIMNCAFXEJ-SIXLDLHFSA-N	445.969	1.022	50	20	IDGD	
C[C@H](C#N)c1cccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CCC(=O)NN(C)C)C3)c1	1803683242	ABMKNLAGIAFKTF-GEALJGNFSA-N	425.533	1.938	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)CN2CC(=O)NC2=O)[C@@H]1c1cccnc1	1804183149	LJNBDWMAKZFRAL-MPGHIAIKSA-N	435.912	1.047	50	20	IDGD	
Cn1nc(C(=O)NC[C@@H]2CCN(C(=O)CO[Si](C)(C)C)[C@H]2c2cccnc2)cc1O	1804895274	IJPDYPUJFRGIAQ-KXBFYZLASA-N	431.569	1.692	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1ccsc1	1805419009	BDPDBYITYPTUPJ-YLJYHZDGSA-N	435.314	1.456	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)N2CCC3(CCCN(C(=O)[C@@H](O)CCl)C3)CC2)cc1O	1805526786	LMNOZOMHDIREAX-SFHVURJKSA-N	437.924	1.795	50	20	IDGD	
Cc1csc(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)c1	1807366670	VHAPMXKZBHXENY-WIYYLYMNSA-N	449.341	1.765	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)Cc2ccncc2)[C@H]1c1cccnc1	1807520181	AQJDGOVPVKGGNV-WMZHIEFXSA-N	438.532	1.098	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)C(Cl)Cl)[C@H]1c1cccnc1)c1nc[nH]c1[N+](=O)[O-]	1808370879	INFOFOYVJJEPAD-JQWIXIFHSA-N	427.248	1.836	50	20	IDGD	
Cc1cc(C(=O)NC[C@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)c[nH]1	1808779405	XRCCMMGTBZQBIB-OXQOHEQNSA-N	447.499	1.350	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)c1ccc2c(c1)OCCO2	1808989441	NXKKIVSKNAETEN-ZWOKBUDYSA-N	445.903	1.772	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)c2c[nH]c(=O)cn2)[C@H]1c1cccnc1	1812777233	NVLQQOKZALPLEP-ZQIUZPCESA-N	448.321	1.658	50	20	IDGD	
COC[C@H](NC(C)=O)C(=O)N1CC[C@H](CNC(=O)C(Cl)Cl)[C@@H]1c1cccnc1	1813078010	MUWCRROHMGZRJK-ILXRZTDVSA-N	431.320	1.042	50	20	IDGD	
CC(=O)NCCC(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](C)CBr)n[nH]1	1814782946	FHXJZUDBCVDNQZ-RISCZKNCSA-N	428.331	1.959	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@H]2Cc3ccccc3CN2)[nH]n1)[C@H](O)CCl	1814871478	PWLSOWCHDCQQOQ-KZNAEPCWSA-N	431.924	1.716	50	20	IDGD	
O=C1Cc2cccc(C(=O)N3CCCC[C@@H]3c3cc(NC(=O)[C@@H](O)CCl)n[nH]3)c2N1	1814874801	FJSKCEPERNAEIH-CABCVRRESA-N	431.880	1.810	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)C(=O)c1ccccc1	1816716347	YYUASXYEIFWGBM-IBGZPJMESA-N	446.272	1.278	50	20	IDGD	
N=C1NCCN1CC(=O)Nc1cc([C@H]2CCCCN2C(=O)CCBr)[nH]n1	1817292526	MUTIXCLJEABQCA-GFCCVEGCSA-N	426.319	1.027	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)Cc2ccccn2)[nH]n1)c1ccc(B(O)O)cc1	1817471435	NQPCQQKBZKUUJA-LJQANCHMSA-N	433.277	1.033	50	20	IDGD	
COC[C@H](NC(C)=O)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](C)Br)[nH]n1	1819612827	DZTJIMYTXOYJME-LEWSCRJBSA-N	444.330	1.336	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](C)O)[nH]n1	1820167064	WBJOBBPNZIMUPY-BZNIZROVSA-N	445.432	1.930	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)c3n[nH]cc3[N+](=O)[O-])sc2C1	1820302560	HHDSMCQUZDVHEA-RQJHMYQMSA-N	443.283	1.784	50	20	IDGD	
N#Cc1cccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)c1	1820484182	QSCHZWHHJHMFJI-HXUWFJFHSA-N	443.272	1.581	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccnc2S)[nH]n1	1822412192	MOSOJRHSZAOWLC-OAHLLOKOSA-N	445.549	1.772	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](F)Br)[nH]n1	1822415533	LHYANGKTRAYTBK-IAQYHMDHSA-N	447.309	1.465	50	20	IDGD	
COC1(CC(=O)N2CCCC[C@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)CCC1	1822417770	NOHMBMBZYMFRKF-INIZCTEOSA-N	434.541	1.734	50	20	IDGD	
O=C(c1cnc2c(c1)CCNCC2)N1CCC([C@@H]2CCCCN2C(=O)[C@H](O)CCl)CC1	1824188953	WUFSNWMOQLUGFI-LEWJYISDSA-N	448.995	1.603	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](O)CCl)CC2)c1cnn2cccc(F)c12	1824366790	YSRGICWIUBNESL-ZANVPECISA-N	437.884	1.755	50	20	IDGD	
COCCOCCOCCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](F)Cl)CC2	1825773097	MCEWOIUHEHJTIB-NHYWBVRUSA-N	437.921	1.659	50	20	IDGD	
O=C(O)CSCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](F)Br)CC2	1826119601	APHYPXNSUBPNJU-UPONEAKYSA-N	440.316	1.563	50	20	IDGD	
Cc1ccncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1	1827899646	ORQQHHBTJLWJJT-QFIPXVFZSA-N	435.333	1.617	50	20	IDGD	
Cc1ncoc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1	1828925038	CCYWWPKEULRWQC-GOSISDBHSA-N	440.504	1.529	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc4[nH]ncc34)C2)C1	1830358076	PELMNLHQBBVIAF-NRFANRHFSA-N	434.924	1.898	50	20	IDGD	
CCc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)n(C)n1	1830364704	QUNQXAOFGAEYIG-HXUWFJFHSA-N	426.945	1.318	50	20	IDGD	
CCOC(CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2)OCC	1830370213	MNPJLSUPOMJZQC-HXUWFJFHSA-N	434.961	1.497	50	20	IDGD	
Cc1ccncc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)CBr)CCO2	1830538471	GISVTJWRCAZTNH-BEFAXECRSA-N	440.338	1.491	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(F)c[nH]3)C2)C1	1830544388	XBVVZNGFQUANCP-YVEFUNNKSA-N	432.290	1.255	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CN2CCOCC2)CC1	1831651246	RPMQJTPPXXMRLV-NVXWUHKLSA-N	430.387	1.722	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CCS(C)(=O)=O)CC1	1831656064	DQZFQHATDCAOIM-ZFWWWQNUSA-N	437.400	1.824	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)C34CC(C(=O)OC)(C3)C4)C2)C1	1831657976	RUPCTCJGORSSGE-NUDUCMMGSA-N	442.940	1.194	50	20	IDGD	
Cc1nn(C)cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1	1831877066	SCSFVNOSTRVUNY-MSOLQXFVSA-N	433.336	1.035	50	20	IDGD	
C[C@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)c3cc(O)no3)CC2)CC1	1833263008	GCSLDFGRCGAROS-GFCCVEGCSA-N	443.342	1.596	50	20	IDGD	
Cc1nc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)ccc1F	1833466327	YJONDADDQFBGCS-OALUTQOASA-N	448.322	1.835	50	20	IDGD	
Cc1ccncc1CCC(=O)NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1833827469	OHNWLJRRJYXIJL-FQEVSTJZSA-N	436.984	1.494	50	20	IDGD	
Cc1ccn(CC(=O)NC2CCN(C3CCN(C(=O)[C@H](F)Br)CC3)CC2)n1	1833853492	CDOGFNSXTQVKAS-KRWDZBQOSA-N	444.349	1.454	50	20	IDGD	
O=C(CCBr)NC1CCN(C2CCN(C(=O)[C@H]3CCCCO3)CC2)CC1	1834421862	ZIEBLKDYRJFIBT-QGZVFWFLSA-N	430.387	1.912	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)Cc3nnc(C)s3)CC2)CC1	1834855590	YTYAIQUPPMNTEH-INIZCTEOSA-N	428.002	1.978	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)COc3ccc(C)cc3)CCO2)C1	1835166272	FATJUOPMXKRIIN-NQIIRXRSSA-N	440.924	1.084	50	20	IDGD	
C[C@@H](Nc1ccccn1)C(=O)NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1835846078	MYKAVIOGAYPJLQ-CRAIPNDOSA-N	437.972	1.053	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H]3Cc4ccccc4O3)CCO2)C1	1836644847	UTYAPQWGMFMRFA-XMSQKQJNSA-N	436.936	1.712	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)c3cnn(C)c3)CC2)CC1	1837469602	WPVDVVRJBZZHAX-CYBMUJFWSA-N	427.343	1.816	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)/C=N/O[C@@H]3CCCCO3)CCO2)C1	1837525407	NWUZCSBHBBGPDH-WRJCRLLZSA-N	445.944	1.237	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3[C@H]4C=CS[C@@H]43)C2)C1	1837715796	JUKVOPLRBOMWAC-VYCZESIESA-N	426.611	1.169	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccncc3Cl)CCO2)C1	1837890820	GKQWFCRWBVEUFW-YJBOKZPZSA-N	432.304	1.059	50	20	IDGD	
O=C1C[C@H](C(=O)N2CCC(OC3CCN(C(=O)[C@@H](F)Br)CC3)CC2)CCN1	1838648232	NIRKGFOCUIWOPB-MLGOLLRUSA-N	448.333	1.202	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cncc4cnccc34)C2)C1	1839146219	LQZADEPWCUJJFS-RXVVDRJESA-N	432.908	1.717	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ncccc3F)C2)C1	1839965772	KEJKEQTUTKEUJK-UGSOOPFHSA-N	444.301	1.464	50	20	IDGD	
CC[C@H](C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H](C)Br)CCO2)C1)N(CC)CC	1840030200	DCPHJRNDEDQTAT-MDZRGWNJSA-N	448.402	1.347	50	20	IDGD	
O=C(c1cnc(Cl)s1)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840188983	PJRCEXBUOFKZNM-AWEZNQCLSA-N	428.725	1.670	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)CCCn3cccc3)CCO2)C1	1840461821	UXQRPKKWVDINOT-UXHICEINSA-N	446.375	1.961	50	20	IDGD	
COC1(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)CCC1	1840616950	IGPAATOWYTUQMT-PBHICJAKSA-N	437.306	1.093	50	20	IDGD	
CC(C)(NC(=O)c1ccc(Cl)s1)C(=O)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1	1841352253	DLSDGXAQZOQEIM-LLVKDONJSA-N	448.372	1.713	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)CCN2C(=O)Cc3ccccc3C2=O)C1	1841402779	KUVHLIDOVJBYIC-QGZVFWFLSA-N	447.919	1.059	50	20	IDGD	
Cc1cc(C(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)c(C(F)(F)F)o1	1842457938	FBTOCBGCZMLUNH-UHFFFAOYSA-N	436.195	1.417	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1nc3ccccc3o1)C2	1843416644	IZHCUFGGJZLQPM-AFUMVMLFSA-N	434.456	1.779	50	20	IDGD	
Cc1cccc2cc(C(=O)N3CC4(CCCN4C(=O)c4cnccc4C(=O)NN)C3)[nH]c12	1844264452	UQDAGZJMRICOAV-UHFFFAOYSA-N	432.484	1.606	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@H]1CC(=O)N(c3cccc(OC)c3)C1)C2	1846359662	FDKFNQGSRZTMEQ-QAPCUYQASA-N	449.935	1.505	50	20	IDGD	
CC(=O)N[C@@H](Cc1cccc(F)c1)C(=O)N1CCCC12CN(C(=O)C(Cl)Cl)C2	1847014394	KOECHTKLQUUVBB-HNNXBMFYSA-N	430.307	1.880	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1[C@H](C(=O)N1CC[C@H]3[C@@H]1CCN3C(=O)[C@H](O)CCl)C2	1847568110	BGBBOBBLZDVLLS-FHULIHMCSA-N	441.956	1.576	50	20	IDGD	
O=C(COC(=O)[C@@H]1CCCN(C(=O)Nc2ccccc2)C1)NNC(=O)c1cccs1	11014641	JLDFIBHROBSNOM-CQSZACIVSA-N	430.486	1.996	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)c1cn(Cc2ccccc2)nc1-c1cccs1	16786057	XIFHOVUDFFDXGR-HNNXBMFYSA-N	444.538	1.856	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)CCc2nc(-c3ccc(Cl)cc3)no2)C[C@@H](C)O1	726164412	QMFYVPNPUFSHEO-ZIAGYGMSSA-N	435.912	1.969	50	20	IDGD	
C[C@H]1CN(c2ccc(C(=O)NNc3ccc(S(=O)(=O)NC4CC4)cc3)cn2)C[C@@H](C)O1	726867550	NCQJMYQRHXLHFW-GASCZTMLSA-N	445.545	1.893	50	20	IDGD	
CC(C)c1ncc(Cl)c(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)n1	728336297	JMVGFKMUWIHJSS-AWEZNQCLSA-N	434.836	1.398	50	20	IDGD	
O=C(O)COc1ccc(S(=O)(=O)NNC(=O)c2cc(F)ccc2Br)cc1	728509474	FQTPCWUKTKPFCJ-UHFFFAOYSA-N	447.238	1.675	50	20	IDGD	
COC(=O)Nc1cccc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1	728656904	NSGJMFWZZBFKTK-INIZCTEOSA-N	429.385	1.009	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(F)c(C(F)(F)F)c1)C1CCN(c2ncccn2)CC1	728854005	JORHOXWNLQWSGB-UHFFFAOYSA-N	447.414	1.861	50	20	IDGD	
COc1ccc(C(=O)CCCC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1	728890599	XFVUGNZLRXPKDG-UHFFFAOYSA-N	425.489	1.902	50	20	IDGD	
CCNC(=O)CN(CC)C(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1	728952972	UBUWULAJQAVDRF-OAQYLSRUSA-N	437.544	1.812	50	20	IDGD	
O=C(NC[C@@H](c1ccco1)N1CCCCC1)NNC(=O)C1CCN(c2ncccn2)CC1	729044190	IWPYJUDSMYESMK-SFHVURJKSA-N	441.536	1.844	50	20	IDGD	
NC(=O)[C@@H]1CCCN(CCCNC(=O)NNC(=O)c2ccc(COc3ccccc3)o2)C1	729495195	REQRRZVGHBMTLN-MRXNPFEDSA-N	443.504	1.390	50	20	IDGD	
C[C@@H]1CN(Cc2cccc(CNC(=O)NNC(=O)COc3ccccc3O)c2)CCO1	730825134	RBBFTNONAMXSET-MRXNPFEDSA-N	428.489	1.522	50	20	IDGD	
CC(C)(C(=O)NNC(=O)c1ccc2c(c1)S(=O)(=O)N(C1CC1)C2=O)c1ccccc1	731173593	WFCDMNIHKLNIHH-UHFFFAOYSA-N	427.482	1.732	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCCOC[C@@H]1CCOC1	731680448	LSCTUDDVMCXAES-QWHCGFSZSA-N	430.299	1.600	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)c2cncc(O)c2)c1	732258680	FQANFTISBJRVFA-UHFFFAOYSA-N	442.453	1.671	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)CCCc2nc(-c3ccc(F)cc3)no2)C[C@@H](C)O1	732259929	LIXOYRQXQOWTFJ-GASCZTMLSA-N	433.484	1.845	50	20	IDGD	
CCOCCCN1CC[C@H](NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)[C@H](C)C1	734544344	QZCBNBMLOKMPSH-QAPCUYQASA-N	440.566	1.171	50	20	IDGD	
CC(C)(C)OC(=O)N[C@H]1CCC[C@@H]1C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	739511819	OCRQITKZQSBPRO-GJZGRUSLSA-N	425.507	1.545	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)[C@H]1CCCN(C(=O)COc2ccccc2)C1	741283350	FQFQUHFJWJGVAX-KRWDZBQOSA-N	440.500	1.572	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)C2CCN(Cc3ccccc3)CC2)n1	741329378	FQVMVPJIUDSYCK-UHFFFAOYSA-N	430.530	1.597	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)C[C@@H]2CN(Cc3ccccc3)CCO2)cc1	741346875	MXNBNRUBKVIBTR-HXUWFJFHSA-N	425.485	1.590	50	20	IDGD	
O=C(NNC(=O)[C@H](c1cccc(F)c1)N1CCOCC1)c1nn(-c2ccccc2)cc1O	743292974	PFDXSSJFFFFSEN-FQEVSTJZSA-N	439.447	1.552	50	20	IDGD	
CC(=NNC(=O)Cc1cc(O)nc(O)n1)c1ccc(S(=O)(=O)N2CCCCC2)cc1	743445192	IRKYWZRUQSCRRM-UHFFFAOYSA-N	433.490	1.145	50	20	IDGD	
C[C@@H](NC(=O)OC(C)(C)C)C1CCN(CC(=O)NNC(=O)c2ccc(C#N)cc2)CC1	744398646	WZRWBVPRVJHZMK-OAHLLOKOSA-N	429.521	1.944	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCC(n3c(O)nc4ccccc43)CC2)n1	744427476	XIZRXQCWHDLHOA-UHFFFAOYSA-N	428.518	1.534	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(/C#N)C(=O)NC[C@@H]2CCC[C@@]23NC(=O)NC3=O)c1C	744625549	AWRWMULFTPFWAY-ORAKYITASA-N	427.505	1.714	50	20	IDGD	
CC(C)(C)[C@H]1CCc2sc(C(=O)NNC(=O)NCCOCCS(C)(=O)=O)cc2C1	745854740	LKEKGHOMGONTLQ-AWEZNQCLSA-N	445.607	1.904	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCc2nccn2C1)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	746347228	SLALGVDWHHBETB-LJQANCHMSA-N	442.483	1.609	50	20	IDGD	
CCOC(=O)C1=NN(c2ccccc2)[C@H](C(=O)NNC(=O)Cc2cn3ccccc3n2)C1	746556322	SXKXFYIILBFMPP-SFHVURJKSA-N	434.456	1.222	50	20	IDGD	
Cc1cc(C(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)ccc1S(N)(=O)=O	748522755	FLMNSDOCTBJXDG-UHFFFAOYSA-N	437.421	1.693	50	20	IDGD	
CNC(=O)Cc1noc(COC(=O)/C(C#N)=C\c2cc(C)n(C[C@@H]3CCCO3)c2C)n1	750317997	JEWJFPIJNWNGSL-KZRVJCNKSA-N	427.461	1.606	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNC(=O)[C@H]1CCO[C@@H]1c1cnn(-c2ccccc2F)c1	753131339	RVKBINOKXJPVGJ-MAUKXSAKSA-N	431.468	1.541	50	20	IDGD	
C[C@H](NCC(=O)NNC(=O)c1ccc(C#N)cc1)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	754314468	BNLXFPABZGVBRS-MAUKXSAKSA-N	429.521	1.944	50	20	IDGD	
C[C@H](OC(=O)/C(C#N)=C/c1ccc(O)cc1)C(=O)N[C@H](C)c1ccc(S(N)(=O)=O)cc1	754543156	SRPANFOXROQCMQ-PBTRJEIRSA-N	443.481	1.756	50	20	IDGD	
CCN(c1ccccc1)S(=O)(=O)c1ccc(C(=O)NNC(=O)Cc2cc[nH]n2)cc1	755270237	REKARCXOSGRMHJ-UHFFFAOYSA-N	427.486	1.629	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)NCCN2C(=O)[C@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2=O)c1C	756097729	QZDCPUOMHYAGBU-BGJMDTOESA-N	440.500	1.208	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1N1CCCS1(=O)=O	756703296	GQNOKLOHACYACN-GOSISDBHSA-N	446.485	1.528	50	20	IDGD	
C[C@@H]1CN(C(=O)Cn2cc(NC(=O)NNC(=O)c3cc4c(s3)CCC4)cn2)C[C@@H](C)O1	756836633	CHKAVYAEMJGFIT-CHWSQXEVSA-N	446.533	1.536	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2ccc(CS(C)(=O)=O)c(F)c2)cc1OC	757676569	UUZSVNMMJJLRJX-UHFFFAOYSA-N	425.438	1.854	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)Nc1ccc(Br)c([N+](=O)[O-])c1	757769519	AATPEBGBNBFZRD-UHFFFAOYSA-N	447.209	1.800	50	20	IDGD	
CCOC(=O)c1cnn2c(C(=O)NNC(=O)c3ccc(OCC)c(OC)c3)ccnc12	757988924	WLINETSPLUBCRR-UHFFFAOYSA-N	427.417	1.388	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)c(C)n1C1CCCCC1	758039140	HTTSLWUYQKIYJY-RQNDZEIBSA-N	435.550	1.602	50	20	IDGD	
Cc1nn(C)c2sc(C(=O)N[C@H](C)C(=O)NNc3nc(O)c4ccccc4n3)cc12	758307447	JFVJNDMEQRTWDM-SNVBAGLBSA-N	425.474	1.854	50	20	IDGD	
O=C(Cc1csc(-c2ccc3c(c2)OCO3)n1)NNC(=O)C(=O)Nc1ccccn1	758834174	PUIUVJRPQWPJDX-UHFFFAOYSA-N	425.426	1.262	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CSCN1C(=O)c1ccc(Cl)cc1)C(=O)Nc1ccccn1	758841666	QMTYCNAIPPLVBQ-ZDUSSCGKSA-N	433.877	1.036	50	20	IDGD	
CC(C)CNS(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1	759660503	KJMAQQXWYSDLMP-UHFFFAOYSA-N	449.489	1.673	50	20	IDGD	
O=C(N=c1cc[nH]cc1I)NNC(=O)c1cc(Cl)ccc1O	760024482	MDBMTTCXKPKGRH-UHFFFAOYSA-N	432.605	1.934	50	20	IDGD	
C[C@@H]1CCN(C(=O)CCC(=O)C(C#N)=C2N(C)c3ccccc3N2C)CCS1(=O)=O	760791583	WSDXATKELKIBRI-OAHLLOKOSA-N	430.530	1.693	50	20	IDGD	
Cc1cc(F)c(S(=O)(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)cc1[N+](=O)[O-]	763438699	DARGBOKBGFOJEB-UHFFFAOYSA-N	434.446	1.657	50	20	IDGD	
CSc1cnn(-c2ccccc2)c1NC(=O)C(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	763454046	FGKPVKBKABAENG-UHFFFAOYSA-N	440.441	1.902	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCCNC(=O)NNC(=O)CSc2ccccc2O)cc1	763461924	AYXHOAPLRMLBIG-UHFFFAOYSA-N	438.531	1.102	50	20	IDGD	
CC(C)C(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1	763573445	SBHOADNWOQACEZ-QGZVFWFLSA-N	426.429	1.207	50	20	IDGD	
COC(=O)c1ccc(-n2cc(C)cn2)c(NC(=O)C(=O)NNC(=O)c2cc(C)oc2C)c1	763576984	QVEPOPNPFOPRSR-UHFFFAOYSA-N	439.428	1.577	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2ccccc2)[nH]n1)C(=O)Nc1ccnn1Cc1ccccc1F	763603515	CKXAADQUKRVKPH-UHFFFAOYSA-N	447.430	1.860	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)C(=O)Nc2cccc(Cl)c2-n2cncn2)c1	763648214	AMHCUZOOTDJYCB-UHFFFAOYSA-N	442.863	1.702	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(OC(C)C)c(C#N)c1	763657453	MRZTYELRFIPHTI-UHFFFAOYSA-N	426.429	1.519	50	20	IDGD	
Cc1ccnn1-c1ccccc1NC(=O)C(=O)NNC(=O)CN1CCCc2ccccc21	763729331	VZUPKRYWTDLVLO-UHFFFAOYSA-N	432.484	1.719	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2cc(F)cc(N3CCOCC3)c2)c1	763775912	YJSXHAWWTGPTHP-UHFFFAOYSA-N	446.435	1.079	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2ccccc2C(F)(F)F)c2ccccc2c1=O	763787331	XMSLVHMYHXJCKK-UHFFFAOYSA-N	447.373	1.835	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)cc1F	763791551	VIFIUBAOXVXCRJ-UHFFFAOYSA-N	441.419	1.525	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)sc2c1CCC2	763842276	YLQHUCVTCHHDEI-UHFFFAOYSA-N	449.460	1.718	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)cc1S(C)(=O)=O	763864173	GNRFQVNVNGYODP-GFCCVEGCSA-N	437.449	1.091	50	20	IDGD	
CCn1cnnc1-c1cccc(NC(=O)C(=O)NNC(=O)Cc2ccc(Cl)cc2)c1	763931596	KMCXRTDUCPUROQ-UHFFFAOYSA-N	426.864	1.947	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)c2cc(Cl)ccc2O)ccc1N1CCCC1=O	763976880	HMBVJDXDYFBDGM-UHFFFAOYSA-N	446.847	1.581	50	20	IDGD	
CNC(=O)c1ccc(C)c(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(C)cc3)[nH]n2)c1	764109986	DXSCVDXOYSVDHA-UHFFFAOYSA-N	434.456	1.453	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccccc2-c2nncn2C(C)C)c1O	764132960	ZBQAUIIDCJQKNJ-UHFFFAOYSA-N	438.444	1.640	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)nc(C(C)(C)C)n3C)c1O	764133488	VTUDPAUNVKRSKT-UHFFFAOYSA-N	439.472	1.985	50	20	IDGD	
CNC(=O)c1cc(Oc2ccccc2NC(=O)C(=O)NNC(=O)CCC(C)C)ccn1	764202589	FFDCJDNUFRERRR-UHFFFAOYSA-N	427.461	1.756	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)C(=O)Nc1cccc(C(=O)N2CCc3ccccc32)c1	764268595	NDBYYKLARIYSAI-UHFFFAOYSA-N	443.463	1.613	50	20	IDGD	
CCOCC(=O)NNC(=O)C(=O)Nc1cc(C(=O)OC(C)(C)C)ccc1Br	764327026	TYOWROCWJDTPBG-UHFFFAOYSA-N	444.282	1.527	50	20	IDGD	
CCOc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NNC(=O)COCc1ccccc1	764367861	ORVMODCLKBKYNG-UHFFFAOYSA-N	442.472	1.090	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)COc2ccc3c(c2)CCCC3)c1	764526519	AIFMMCXBJXHYQO-UHFFFAOYSA-N	431.514	1.656	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNc2cc(C)nc(C)n2)cc(Br)c1F	764673757	SNIICPCVNJUISO-UHFFFAOYSA-N	440.229	1.863	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NN=C1CCN(Cc2ccccc2)C1=O	764828291	RONPTAPTHBYIBF-UHFFFAOYSA-N	433.512	1.349	50	20	IDGD	
CS(=O)(=O)Cc1noc(NC(=O)NNC(=O)c2ccc(-c3ccc(F)cc3)s2)n1	765255709	OGJZCQKVSLYJEY-UHFFFAOYSA-N	439.450	1.948	50	20	IDGD	
O=C(CCC(=O)Nc1ccc2nc(O)[nH]c2n1)NNC(=O)C12CC3CC(CC(C3)C1)C2	765467222	CLAWXZWQPDVAHZ-UHFFFAOYSA-N	426.477	1.746	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1cc(-c2cccs2)on1	765732115	GLFWKNPXTYAABD-UHFFFAOYSA-N	439.497	1.622	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)[C@@H]1COc2ccccc21	765757209	ADUHSBKTHMYHGS-LJQANCHMSA-N	428.920	1.781	50	20	IDGD	
O=C(NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)N[C@H]1CCO[C@@H](C2CC2)C1	765921071	WSVDNKYVUJRIES-FUHWJXTLSA-N	436.534	1.373	50	20	IDGD	
CN1CCO[C@@H]([C@H](NC(=O)NNC(=O)COc2ccccc2O)c2ccc(Cl)cc2)C1	766320404	NUHGCXFEZWZJEV-UYAOXDASSA-N	448.907	1.827	50	20	IDGD	
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)c1ccc2nc(O)oc2c1	766664542	RNAINGAOLFIQDB-UHFFFAOYSA-N	443.891	1.766	50	20	IDGD	
COc1ccc(NNC(=O)c2sccc2S(=O)(=O)N2CCOCC2)c([N+](=O)[O-])c1	768329365	ULGNKZFIOYAAJW-UHFFFAOYSA-N	442.475	1.443	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C[C@@H]1CN(C(=O)OC(C)(C)C)CCO1	768635976	MIPZALSPHWGFOY-CYBMUJFWSA-N	443.522	1.568	50	20	IDGD	
C[C@@H](CCN1CCN(C)CC1)NC(=O)NNC(=O)c1ccc(COc2ccccc2)o1	770306518	BIEGZQSLRCRERW-KRWDZBQOSA-N	429.521	1.829	50	20	IDGD	
Cc1cc(C)c(C)c(S(=O)(=O)NCC(=O)O[C@H](C)C(=O)NNC(=O)CC(C)C)c1C	771942424	ZXLCMBJCKDKEHR-MRXNPFEDSA-N	441.550	1.324	50	20	IDGD	
Cc1cc(C(=O)N2CCC[C@@H]2C(=O)O[C@@H](C)C(=O)NNC(=O)CC(C)C)ccc1[N+](=O)[O-]	772076653	RPKIHHUKPYMLAU-WMLDXEAASA-N	448.476	1.633	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)c1ccc(=O)n(Cc2ccccc2)n1	772195044	HNKHVJRHROZAGT-UHFFFAOYSA-N	439.859	1.022	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(I)cn2)c(O)c1	773541537	SRYPKOWQGCHXOH-UHFFFAOYSA-N	440.197	1.100	50	20	IDGD	
Cn1cc(NC(=O)C(=O)NNc2ncc(Cl)cc2Cl)cc(Br)c1=O	773675423	BKTFKIOTISCMAQ-UHFFFAOYSA-N	435.065	1.931	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2cccc(NC(=O)CN3CCCCCC3)c2)n1	773729993	CZTAZIIOBATBAF-UHFFFAOYSA-N	441.492	1.382	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1cnn(C)c1C(F)(F)F	774010004	UAVSYDBRPOHLOW-QMMMGPOBSA-N	433.774	1.646	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)NC[C@@H]2CC[C@@H](C(=O)N(C)C)O2)cc1OC	774773772	YUFQHPLFJZXUBD-RDJZCZTQSA-N	436.509	1.454	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)N[C@@H](c1ccc(OC(F)F)cc1)C(F)(F)F	776012854	KEUYFBVLAHWCRF-ONGXEEELSA-N	445.366	1.657	50	20	IDGD	
COc1ccccc1[C@](N)(C(=O)NNC(=O)c1nn(-c2ccccc2)cc1O)C(F)(F)F	776107342	WYLBFNPIRSDQKN-IBGZPJMESA-N	449.389	1.764	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)c1cn(-c2cccc(Cl)c2F)nn1	776441750	WNJALOBTAQRMTQ-UHFFFAOYSA-N	445.838	1.915	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)c2ccc(S(=O)(=O)NCc3ccco3)cc2)c1	776537889	PWABERYSIQKSGM-UHFFFAOYSA-N	449.510	1.919	50	20	IDGD	
COCCOc1cc(C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)ccn1	777276595	UXWULAOGCASFEQ-UHFFFAOYSA-N	425.445	1.472	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)Cn2c(S)nnc2-c2ccc(OC)cc2)nc1C	778424482	UTQLVFQDFHBBSX-UHFFFAOYSA-N	443.489	1.661	50	20	IDGD	
COC(=O)c1[nH]c(C)cc1NC(=O)C(=O)NNc1ccc([N+](=O)[O-])cc1Br	778760069	XXGSCWDNMLMPLM-UHFFFAOYSA-N	440.210	1.862	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNS(=O)(=O)c1ccccc1-c1ccno1	779461164	WNIIEUNOIYLBNG-UHFFFAOYSA-N	449.514	1.566	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)[C@@H]1CCCN(S(=O)(=O)CCCCCl)C1	780754208	DXUHCJZMAFDNLG-CQSZACIVSA-N	425.979	1.688	50	20	IDGD	
Cc1cc(OC(C)C)ccc1NC(=O)C(=O)NNC(=O)c1csc(N2CCOCC2)n1	782896372	HBZRADMQNOUWEK-UHFFFAOYSA-N	447.517	1.475	50	20	IDGD	
CCOC(=O)[C@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNc2cccc([N+](=O)[O-])c2)cc1	784832070	YNRXRGKQUZUZOX-LBPRGKRZSA-N	443.416	1.358	50	20	IDGD	
CN1CCN(CCOc2ccc(NC(=O)C(=O)NNc3cccc([N+](=O)[O-])c3)cc2)CC1	784833058	FAPIHUNSLPUMES-UHFFFAOYSA-N	442.476	1.303	50	20	IDGD	
O=C(NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1)NOC[C@@H]1CCOC1	788325120	GECKYZGVSVKIBZ-GFCCVEGCSA-N	440.503	1.461	50	20	IDGD	
CC[C@H]1CCc2nc(NC(=O)C(=O)NNC(=O)COc3ccccc3OC)sc2C1	789732657	SCZZDYISZLBPSX-LBPRGKRZSA-N	432.502	1.832	50	20	IDGD	
CCCc1csc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)n1	789745424	ADGYILCTFULSLL-UHFFFAOYSA-N	426.524	1.259	50	20	IDGD	
CC[C@@H]1CCc2nc(NC(=O)C(=O)NNC(=O)Cc3cn4ccccc4n3)sc2C1	789767636	BYQKINICZFORHU-GFCCVEGCSA-N	426.502	1.634	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2cccc3c2OCC[C@@H]3OC)cc1	790952324	QXWYJMUDHDIOMO-SFHVURJKSA-N	427.457	1.884	50	20	IDGD	
Cc1cc(Cl)ccc1OCCCC(=O)NNC(=O)CN1C(=O)N[C@@](C)(C2CC2)C1=O	792550238	GFVOWUDMTOVPSK-FQEVSTJZSA-N	436.896	1.675	50	20	IDGD	
CC(=NNC(=O)[C@H](C)CN1CCOCC1)c1cc(S(N)(=O)=O)c(Cl)cc1Cl	794478874	SRHUDYFAWRALHH-SNVBAGLBSA-N	437.349	1.449	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccccc1S(=O)(=O)C(F)F)c1cccc2ncccc12	794587537	KNDSNZKFJWRCDW-UHFFFAOYSA-N	441.437	1.854	50	20	IDGD	
CCOC(=O)c1cc(S(=O)(=O)NNC(=O)CNC(=O)c2cccs2)c(F)cc1C	795310669	BDUIPFFTYJIAFN-UHFFFAOYSA-N	443.478	1.112	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NC(=O)NNC(=O)COc2ccc(Cl)cc2)nc1	797652897	VIGXAFZORJEDHM-UHFFFAOYSA-N	427.870	1.217	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2ccncc2C(F)(F)F)cc1OC	800236881	PTTBQECODTZEQB-UHFFFAOYSA-N	427.335	1.736	50	20	IDGD	
Cc1nc(Cl)ccc1S(=O)(=O)N1CCN(S(=O)(=O)CBr)CC1	805060389	AFPDFOLZNRUIMG-UHFFFAOYSA-N	432.749	1.032	50	20	IDGD	
Cc1cc(I)cc(NC(=O)C(=O)NNC(=O)c2ccc(O)cc2)c1	806991762	WEHSAXOGTRJBPT-UHFFFAOYSA-N	439.209	1.705	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NC[C@@H](c1ccco1)N1CCCC1	807003676	XLUVTVMBTPWVRI-HNNXBMFYSA-N	448.549	1.662	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)c(F)cc1Br	807020465	XJHKKFBJKBZSPS-UHFFFAOYSA-N	448.252	1.873	50	20	IDGD	
O=C(NCc1ccncc1OC[C@@H]1CCOC1)NNC(=O)c1ccc2c(c1)OCCO2	807616799	XKERBHLRHOINGI-CQSZACIVSA-N	428.445	1.412	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNS(=O)(=O)c2cccc(C(=O)N(C)CC)c2)cc1	808069652	DHMLHHADHIWZET-OAHLLOKOSA-N	449.529	1.954	50	20	IDGD	
Cc1cccc(C(=O)NNS(=O)(=O)N(C)C2CCN(C(=O)OC(C)(C)C)CC2)n1	808111007	FHYLBPWUHWQHLQ-UHFFFAOYSA-N	427.527	1.201	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)C1(F)CCCCC1	809933511	JLFWSIIYAQJVDY-UHFFFAOYSA-N	441.525	1.460	50	20	IDGD	
COC(=O)c1c(F)ccc(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)c1C	810385631	WURGXLPSXOJYHW-UHFFFAOYSA-N	437.811	1.739	50	20	IDGD	
O=C(CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1)NNc1nccnc1Cl	810407488	HVAUFHMNVRXXLB-UHFFFAOYSA-N	425.776	1.450	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccccc2NC(=O)C2CC2)c1	814722381	XEYKJRKSTDIBEY-UHFFFAOYSA-N	430.486	1.360	50	20	IDGD	
N#C[C@H](c1ccccc1)c1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2CCc3nncn3C2)cc1	815691397	OXLCYHWFJPYLNI-IEBWSBKVSA-N	443.467	1.282	50	20	IDGD	
Cc1cc(SC(C)(C)C)ccc1NC(=O)C(=O)NNC(=O)[C@H]1CCc2nncn2C1	815691464	RBPROFOAJPCWMP-ZDUSSCGKSA-N	430.534	1.826	50	20	IDGD	
CCCCNS(=O)(=O)c1cccc(NC(=O)C(=O)NNc2cccc(Cl)n2)c1	815726587	LIVMRDFHFFASDJ-UHFFFAOYSA-N	425.898	1.895	50	20	IDGD	
Cn1nc(SCC(=O)NN=Cc2c(Cl)ccc(Cl)c2Cl)c(=O)n(C)c1=O	818269887	MNSQIJPUUKQPMV-UHFFFAOYSA-N	436.708	1.682	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)CCC(=O)N2CCC(O)CC2)c1	818756568	BELPSNXVTPBHDC-UHFFFAOYSA-N	428.283	1.442	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)c1nnn(-c2cccc([N+](=O)[O-])c2)c1C	818861757	GKCWXBCYKKMALJ-UHFFFAOYSA-N	448.443	1.857	50	20	IDGD	
Cc1nn(C)c(Cl)c1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	821998681	GCNCZCSGHPZDRA-UHFFFAOYSA-N	439.925	1.631	50	20	IDGD	
Cc1nn(C)c2nc(-c3ccccc3)cc(C(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)c12	836699891	KLZMTEJACJMIDJ-AWEZNQCLSA-N	427.486	1.139	50	20	IDGD	
O=C(COC(=O)c1ccc(C(F)(F)F)nc1)NNC(=O)[C@H]1COc2ccccc2O1	844260121	ZWLXCKLDKDHJJZ-CYBMUJFWSA-N	425.319	1.245	50	20	IDGD	
Cc1cc(C)nc(NNC(=O)[C@@H]2CCCCN2S(=O)(=O)c2ccc([N+](=O)[O-])cc2)n1	913001520	YKZLWUSDBJFJAI-INIZCTEOSA-N	434.478	1.688	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H]2CCCCN2C(=O)c2ccccc2)c1	915165525	HZZJQOKKJKQNDV-GOSISDBHSA-N	429.498	1.546	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)CCS(=O)(=O)c1ccc2c(c1)CCC2	915595918	OZMASEDUQSHEDM-UHFFFAOYSA-N	426.498	1.756	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCCN1C(=O)OCc1ccccc1)c1ccc(-n2cnnn2)cc1	916144923	YMYSDAKFSORPPI-IBGZPJMESA-N	449.471	1.615	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NC2CCN(C3CC3)CC2)c2ccccc2c1=O	916239825	MYDYDYDYKDJIMT-UHFFFAOYSA-N	426.521	1.767	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)NCCc2cn3ccccc3n2)c2ccccc2c1=O	916246092	ZKACQHQODAMSRR-UHFFFAOYSA-N	433.472	1.812	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCc2ccnc(N3CCCC3)c2)nc1	916254828	RWDTZJZCCNCWRQ-UHFFFAOYSA-N	433.538	1.590	50	20	IDGD	
CO[C@@H](CNC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1)c1ccccc1	916271786	CJDGRWFGFCBBRD-SFHVURJKSA-N	434.518	1.334	50	20	IDGD	
CN(CCO)c1ccc(C=NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc1	916323742	NTRODROXPQRLFJ-UHFFFAOYSA-N	430.530	1.664	50	20	IDGD	
O=C(NCc1ccc(OCC(F)(F)F)nc1)NNC(=O)c1ccc(-n2cnnn2)cc1	916399183	ZEGYBVJGDPUZNA-UHFFFAOYSA-N	436.354	1.143	50	20	IDGD	
C[C@@H](CN1CCCCC1)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	916462053	PEJRUWYEEGSXEW-INIZCTEOSA-N	437.566	1.290	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)cc1NC(=O)c1ccccc1	919884417	FOBQKBCBXHYZCF-MRXNPFEDSA-N	430.486	1.378	50	20	IDGD	
O=C(NNC(=O)C12C[C@H]3C[C@@H](CC(Br)(C3)C1)C2)N[C@H]1CCS(=O)(=O)C1	919889532	NWYFINTUIKGSMJ-TULHTLCESA-N	434.356	1.238	50	20	IDGD	
COc1ccc(-n2ccc(CNC(=O)NNC(=O)Cc3nc4ccccc4n3C)n2)cc1	919916577	LXGGREJTEOALHG-UHFFFAOYSA-N	433.472	1.841	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2ccc(C(F)(F)F)n2)cc1)N[C@H]1CCS(=O)(=O)C1	919995228	WHBRYAAGRHRSEX-NSHDSACASA-N	431.396	1.022	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=O)c2ccc(OC)cc2)c1	1317696159	AMRDKZNRXKEYFI-UHFFFAOYSA-N	441.893	1.348	50	20	IDGD	
CC(=NNC(=O)C[n+]1ccccc1)c1ccc(S(=O)(=O)N2CCCC[C@@H]2C(=O)O)cc1	1317705697	MJNJGKCVCXVZNT-LJQANCHMSA-O	445.521	1.142	50	20	IDGD	
Cc1nc(CSCC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)cs1	1317730824	PTTJJKJXRPMJHX-UHFFFAOYSA-N	427.577	1.747	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)N[C@H]2CCN(c3cnn(C)c3)C2)cc1Cl	1318889744	MPJPHDMOEKUFNA-NSHDSACASA-N	437.888	1.705	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2ccc(S(=O)(=O)NC[C@@H](C)O)cc2)c2ccccc2n1	1353754868	YYUHWIAJSVEZDB-CQSZACIVSA-N	442.497	1.277	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc4n(n3)CCCC4)C2)C1	1778557801	SKMZHCQGEXUODZ-LIRRHRJNSA-N	439.354	1.694	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)COC(=O)C(F)(F)F)C2)C1	1778894595	LZMNREYBHFWQHT-YGRLFVJLSA-N	445.232	1.095	50	20	IDGD	
Cc1cc(C(N)=O)cc(C)c1C(=O)N1CC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1779012583	YXHUAMSDQDHIQS-LJQANCHMSA-N	428.316	1.650	50	20	IDGD	
O=C(c1cnc(Cl)s1)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1779727799	HQCYZWIBDVOISC-RNCFNFMXSA-N	426.695	1.931	50	20	IDGD	
CCc1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)CO[Si](C)(C)C)C3)n(C)n1	1779763834	JPJXKCQWGXDNAG-WIYYLYMNSA-N	436.629	1.962	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](O)NC(=O)OC(C)(C)C)C1	1781050716	VISYQEGGKFTZFE-XGNBGGDFSA-N	447.960	1.361	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)Cc2cc[nH]n2)C1	1781563552	FXZRHFQLPLJMCW-JCKWVBRZSA-N	427.343	1.497	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccnc(Cl)n1)C2	1782175095	DMFUHANEHDAEKF-RVZJWNSFSA-N	431.320	1.511	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccccc1C(N)=O)C2	1782179823	VEDMUIQVGWLZMV-CSODHUTKSA-N	437.924	1.167	50	20	IDGD	
O=C(c1ccc2nn[nH]c2c1)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1782582377	BGFSQMAUCMQSEI-CJNGLKHVSA-N	426.246	1.092	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@@]2(CN(C(=O)Cn3cccn3)CCO2)C1	1782864293	JHTDNHBGXRSRMG-IHSQGBLNSA-N	441.438	1.598	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)N1CC[C@@]2(CN(C(=O)CCBr)CCO2)C1	1783396207	XNAIIWSXNCFBFQ-KRWDZBQOSA-N	434.331	1.126	50	20	IDGD	
COc1cccc(CC(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](C)Br)C3)C2)c1	1783532524	JMKATWMCXDCSKV-LIRRHRJNSA-N	425.323	1.851	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)C(=O)Nc3c(C)cccc3C)CCO2)C1	1783880582	KGZUMBKCHKQEOC-KKSFZXQISA-N	437.924	1.326	50	20	IDGD	
COc1ccc(Cl)c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]3C2)c1	1784095486	JFJGVPKIZLSJQC-GQGQLFGLSA-N	431.316	1.542	50	20	IDGD	
COc1cccc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]32)n1	1785199288	LEODEPAKBZCAOG-PEMDQYIBSA-N	444.359	1.849	50	20	IDGD	
CCOC(=O)N1CCC(C(=O)N2CC[C@@]3(CN(C(=O)C(Cl)Cl)CCO3)C2)CC1	1785374804	DUAWVVBUXOXBPJ-SFHVURJKSA-N	436.336	1.489	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(OC)n3)[C@H]2C1	1785812054	AVPTXVKULSQUOY-AYDFFVQHSA-N	440.338	1.857	50	20	IDGD	
CN1CCC(C(=O)NC2(c3ccc(NC(=O)c4cccc(B(O)O)c4)cc3)CCC2)CC1	1788145409	OVNLRXDTFSWIMF-UHFFFAOYSA-N	435.333	1.456	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)c1cccn2ccnc12	1788367092	OBKNRYRMNWPSNM-BPUTZDHNSA-N	435.322	1.713	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1ccc(C2(NC(=O)c3csnn3)CCC2)cc1	1789520006	ZRGAUHVSNPKVBO-UHFFFAOYSA-N	437.485	1.598	50	20	IDGD	
C[C@H](Nc1nccs1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]2C1	1791057057	AGCOXJXENLCBMP-QMVSFRDZSA-N	445.383	1.707	50	20	IDGD	
O=C(Cc1cnc2ccccn12)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2	1792929839	BNOXREZKISPCTQ-HBCWATKFSA-N	435.322	1.251	50	20	IDGD	
CC(C)(C)OC(=O)CCCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(B(O)O)cc1)C2	1793162215	DTOQUXQTCROKQY-REPLKXPHSA-N	444.337	1.130	50	20	IDGD	
COC[C@@H](C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)C2	1793444453	LUDXKEMSQFAFOO-GBCXSXDXSA-N	433.455	1.744	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1noc2ccccc12	1795765250	XSDJVYQGRWGWOE-USGNIVHTSA-N	431.565	1.811	50	20	IDGD	
O=C(Cc1ccc2ncccc2c1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1	1796189881	LOVDAGPCXQGAPZ-KOUNCHBCSA-N	443.312	1.409	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CO)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CO[Si](C)(C)C	1798625854	OCMJHRPMUNCMAP-FZKCQIBNSA-N	443.617	1.362	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H]1C=CCN1)C2	1799219780	PEDXVALZKIZDHI-KRXQYRFLSA-N	428.445	1.300	50	20	IDGD	
C[C@H](Nc1cnccn1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@](C)(Cl)CCl	1799275809	BYMHAYWNYYCDMO-FRTWLMODSA-N	430.336	1.103	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c(c1)OCO3)C2)[C@@H](F)Br	1799347765	RLUQYGNHYTYWIP-BAESOJJISA-N	429.242	1.309	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1cccc(O)c1)C2)[C@H](F)Br	1799352262	MZJGEMFWMUMLRO-RMHZUWNSSA-N	429.286	1.605	50	20	IDGD	
Cc1cc(F)cc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Br)c1	1799352395	UHSYOMKATAKBCG-DLTLXFJOSA-N	431.277	1.957	50	20	IDGD	
COc1cc(F)c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)Br)C3)c(F)c1	1799592911	BHJXLSZDXMUXNM-DJQAVVSRSA-N	447.276	1.960	50	20	IDGD	
COc1cc(C)c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CCC(=O)NN(C)C)C3)c(C)c1	1800651092	HJKBWOOPRSKALQ-BCDXTJNWSA-N	430.549	1.937	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CC(c3ccccc3)=NN1)C2	1800762729	ZMPUSSRDPAGJMC-CNGORYIKSA-N	449.349	1.126	50	20	IDGD	
CC[C@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1nc(C)c(C)[nH]c1=O)C2	1801799797	WWHZQVZFBJVBCG-CRWXNKLISA-N	425.327	1.812	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC2(CCN(C(=O)c3cccc(=O)n3O)CC2)C1	1805382609	GPFPYCCBZMGJFP-CQSZACIVSA-N	440.338	1.961	50	20	IDGD	
C=CCO[C@@H](C)C(=O)N1CCCC2(CCN(C(=O)c3cnccc3C(=O)NN)CC2)C1	1806026944	OPUZZUAFZDPWBE-INIZCTEOSA-N	429.521	1.121	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)Cc2ccccc2)[C@H]1c1cccnc1	1806519404	CHUOBVHBGRXHDQ-GBXCKJPGSA-N	437.544	1.703	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)CCc2ccc[nH]2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807366274	YDXVOWUTSJGUKR-XXBNENTESA-N	446.316	1.042	50	20	IDGD	
Cc1cc(C(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)nn1C(F)F	1811510150	MWDHPFPLTAVGLW-NUEKZKHPSA-N	441.866	1.901	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2cnn3c2CCC3)[C@@H]1c1cccnc1	1812143731	CWESGBNBILVOTP-AYBZRNKSSA-N	431.924	1.798	50	20	IDGD	
CC(=O)NCCC(=O)NC[C@@H]1CCN(C(=O)[C@@](C)(Cl)CCl)[C@H]1c1cccnc1	1812661420	KBWXUHATCQEWIN-IEZWGBDMSA-N	429.348	1.850	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)CN2CCOC2=O)[C@@H]1c1cccnc1	1812864952	YNVJTXLXLJCZSE-JGGQBBKZSA-N	439.310	1.323	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)/C=N/N2CCCCC2)[C@H]1c1cccnc1	1813030703	FXNMKWKDFVURPX-QAOSEWDCSA-N	435.956	1.813	50	20	IDGD	
C[C@H](C(=O)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@@H]1c1cccnc1)n1cnnn1	1813473670	NOVYBGWVVSBFSP-CABNGKKXSA-N	440.277	1.026	50	20	IDGD	
C[C@H](C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](F)Cl)CC2)[C@@H]1SC(=N)NC1=O	1817251437	VTWAQENMKZLNKN-KXOWCNOMSA-N	433.918	1.392	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)C#CC1CC1)CC2	1817275865	GADOKNGVAZPFOW-SVLFYUKMSA-N	438.513	1.603	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3cc4ncccn4n3)sc2C1	1819016047	OZWZLTBTLCLLBM-WDEREUQCSA-N	434.909	1.665	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)c3c[nH]c(=O)cn3)sc2C1	1821474680	VEMOSNRAQHPEHM-JGVFFNPUSA-N	426.296	1.236	50	20	IDGD	
C=CCC(F)(F)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1	1821986745	XHCCSRCHOSPQQP-OAHLLOKOSA-N	447.446	1.926	50	20	IDGD	
Cc1cc(CC(=O)N2CCCC[C@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)no1	1822416406	CVDZEWNSAMDCNT-INIZCTEOSA-N	431.497	1.314	50	20	IDGD	
Cn1cc(CC(=O)N[C@H]2CCc3nc(NC(=O)[C@@H](F)Br)sc3C2)cn1	1823014377	VHSVWVYGRAULLF-TVQRCGJNSA-N	430.303	1.722	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H]2CCCSC2)n[nH]1	1823458180	GZEKLVDZYMPQLB-GDBMZVCRSA-N	436.582	1.918	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC([C@@H]2CCCCN2C(=O)C(=O)C2CC2)CC1	1824121820	SURWYZGFDMLCOF-QVWJKXSPSA-N	441.532	1.719	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CN2CCNC2=N)CC1	1826868940	ATQMHRRFMCGDIP-HOCLYGCPSA-N	442.402	1.477	50	20	IDGD	
O=C(CCc1ccc[nH]1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827053037	UAKSVVHFWOHFHJ-QFIPXVFZSA-N	437.349	1.561	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H]3CCOC3)sc2C1	1827168671	DTNZWRUOYBFDIU-GNZFJNCUSA-N	444.517	1.226	50	20	IDGD	
COC[C@H](NC(C)=O)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@H](C)Br)CC1	1829119502	XNAFYYVWECBQOK-JQFCIGGWSA-N	446.386	1.541	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CCCSC3)C2)C1	1830547029	ZNQQIFQVDVJJCP-IIDMSEBBSA-N	449.411	1.617	50	20	IDGD	
Cc1cc(C)cc(CCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)c1	1830738655	RRFJSBGACVOVPW-DENIHFKCSA-N	438.952	1.292	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3c(F)cncc3F)C2)C1	1831651998	VOPPWKZHYDTMAV-DJJJIMSYSA-N	431.867	1.837	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H](Cl)COC)CC1	1831830558	DXKYUNZACMPUNJ-HYVNUMGLSA-N	430.977	1.568	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CN2CCCCC2=O)CC1	1831832328	CFYVQXKWXLZFFR-QZTJIDSGSA-N	427.973	1.872	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3cccnc3Cl)CCO2)C1	1832720720	OSGLGWXVGCJVMQ-HNAYVOBHSA-N	430.332	1.751	50	20	IDGD	
CC(C)c1nc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)co1	1833348212	MFTIDBBMEXEVKN-ACJLOTCBSA-N	444.326	1.651	50	20	IDGD	
CCOC(=O)/C=C/C(=O)NC1CCN(C2CCN(C(=O)CO[Si](C)(C)C)CC2)CC1	1834404902	WKGLUCWIGAOTFJ-VOTSOKGWSA-N	439.629	1.529	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3F)CC2)CC1	1834942705	ZZNBYFDSNHGGJU-KRWDZBQOSA-N	426.920	1.660	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)C[C@@H](N)c3cccnc3)CCO2)C1	1835824975	NDIWZALBMZUULT-UTKZUKDTSA-N	438.956	1.193	50	20	IDGD	
Cc1cnn(CC(=O)N2CCC(N3CCC(NC(=O)[C@@](C)(Cl)CCl)CC3)CC2)c1	1836398600	OPIPXDNJHPWQQX-FQEVSTJZSA-N	444.407	1.999	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cc(Cl)ccn1)CCO2	1837864594	WCYJXSONYDSIHY-IBGZPJMESA-N	441.988	1.657	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccnc3SC)CCO2)C1	1838287306	GTJACWXJAVWKDX-BEFAXECRSA-N	443.953	1.127	50	20	IDGD	
COC(=O)NCC(=O)N1CCC(OC2CCN(C(=O)CO[Si](C)(C)C)CC2)CC1	1838432058	PHSWWSOQGUPIIF-UHFFFAOYSA-N	429.590	1.193	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)CCc3cnccn3)CC2)CC1	1838784952	AFAZSVOQOZFSOH-LJQANCHMSA-N	438.956	1.662	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(NC(C)=O)cc3)C2)C1	1839148647	FIYBCHHYVQJVOH-RXVVDRJESA-N	437.924	1.732	50	20	IDGD	
O=C(c1n[nH]c2c(Cl)cccc12)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1839495758	WFHMZTLDUOQULS-YJBOKZPZSA-N	445.278	1.821	50	20	IDGD	
Cc1cncc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)c1	1840031545	UARVJTCGVLLYEY-KBXCAEBGSA-N	426.311	1.243	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)Cc3ccco3)C2)C1	1840156134	IXIQXPILGHLUIN-RIFZZMRRSA-N	428.913	1.168	50	20	IDGD	
O=C(c1ccc2ncncc2c1)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840188278	AFWHPQHMSNPNRB-LJQANCHMSA-N	439.299	1.504	50	20	IDGD	
O=C(c1nc2ccccc2o1)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840189708	HWQRQVQBFRNKMF-SFHVURJKSA-N	428.272	1.702	50	20	IDGD	
COc1cc(F)ccc1CC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1840934092	CZARCIBZXYGPRR-HKUYNNGSSA-N	432.851	1.368	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)Cc2cccnc2Cl)C1	1841966448	RLFMHBVGVNKYDC-AFUMVMLFSA-N	442.907	1.615	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2sc(C)nc2C)C1	1842414114	SXMAZOMBLXUDDP-YDZHTSKRSA-N	428.518	1.711	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)CS(=O)(=O)c2ccc(C)cc2)C1	1842758815	BKEBUPZLXQNIEU-MRXNPFEDSA-N	428.938	1.226	50	20	IDGD	
Cc1cc2nnc(C(=O)N3CCCC34CN(C(=O)[C@@H](C)CBr)C4)c(C)n2n1	1843696944	WJQOKLRZHWYZHR-NSHDSACASA-N	435.326	1.589	50	20	IDGD	
O=C([C@@H](O)CCl)N1CC2(CCCN2C(=O)c2cn3ccc(Br)cc3n2)C1	1843989620	OCYHIKARSBUWEN-ZDUSSCGKSA-N	441.713	1.514	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@H]1C=C[C@H](NC(=O)OC(C)(C)C)C1)C2	1846360775	FOCNQFZEPGDMKZ-PMPSAXMXSA-N	441.956	1.913	50	20	IDGD	
CS(=O)(=O)Nc1cc2ccccc2cc1C(=O)OCC(=O)NNC(=O)c1ccccc1	16415423	SZKSBLXBODTBDZ-UHFFFAOYSA-N	441.465	1.829	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2ccc(NNC(=O)c3cnn(C)c3)c([N+](=O)[O-])c2)cc1	725867313	WJPFZTQGLDLWJQ-UHFFFAOYSA-N	446.445	1.895	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)c3ncoc3C)c2)cc1	726521560	LRSVTJIBBKNJGR-UHFFFAOYSA-N	430.442	1.867	50	20	IDGD	
Cc1nc(O)c(C#N)c(C)c1CCC(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	726867278	CWCYKFHVEDDWRL-UHFFFAOYSA-N	429.502	1.792	50	20	IDGD	
CC/C=C(/C)C(=O)N1CSC[C@@H]1C(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	728066050	XHNAIHKJXROWDA-LPYTZGJOSA-N	429.502	1.597	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)CN2C(=O)c3ccccc3N3C(=O)CC[C@]23C)cc1	728203238	QBFQWKSOUPANTA-HSZRJFAPSA-N	435.484	1.553	50	20	IDGD	
CCOc1ccccc1[C@@H](CC(=O)NNC(=O)[C@@H]1COc2ccccc2O1)NC(C)=O	728230009	CQHKDXVRYAPGNC-UZLBHIALSA-N	427.457	1.640	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(/C#N)C(=O)N2CCN(C(=O)CN3CCCC3)CC2)c1C	728551768	MZGPHJMYMPYQMT-MAGMUUGSSA-N	441.576	1.986	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(OC)c(C(=O)NNC(=O)c2cccc(C#N)c2)c1	728825389	YOUQZUBACBJSHD-UHFFFAOYSA-N	430.486	1.672	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)Cn2cnc3ccc(Br)cc3c2=O)c1	728826739	VVZFIMOQGQQJJH-UHFFFAOYSA-N	426.230	1.492	50	20	IDGD	
CC/C=C(\C)C(=O)N1CSC[C@H]1C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	728846974	YIPAUIHTLGBFRK-RNDAEWJDSA-N	432.550	1.098	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)c1sccc1S(=O)(=O)NCc1cccs1	728893477	RDAGPWSOZNARBF-UHFFFAOYSA-N	436.540	1.687	50	20	IDGD	
O=C(COc1ccccc1Cc1ccccc1)NNC(=O)NCCCN1C(=O)CCC1=O	730068541	QQYNBEDGHLUGGA-UHFFFAOYSA-N	438.484	1.526	50	20	IDGD	
COCCOCC(=O)NC1CCC(C(=O)NNC(=O)c2cccc3ncccc23)CC1	730225195	SHMVEHNJYPQIHD-UHFFFAOYSA-N	428.489	1.334	50	20	IDGD	
CCS(=O)(=O)N[C@H](CCSC)C(=O)NNC(=O)c1cc2c(s1)CC[C@@H](C)C2	730517003	HGPMLNCJYYQMFM-DGCLKSJQSA-N	433.621	1.695	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@H]2CC[C@@H](C(F)(F)F)NC2=O)cc1Br	732175250	IFMSKRAHBIGAHK-KWQFWETISA-N	438.200	1.676	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)c2ccc(Br)cc2I)cn1	735443917	KGZNYGSLFREFSG-UHFFFAOYSA-N	449.046	1.862	50	20	IDGD	
C[C@H](CN1CCN(c2ccccn2)CC1)NC(=O)NNC(=O)COc1ccc(F)cc1	735587168	SOKSAYHXIDCGIU-MRXNPFEDSA-N	430.484	1.141	50	20	IDGD	
O=C(NCc1nc(C(F)(F)F)cs1)NNC(=O)C1CCN(c2ncccn2)CC1	740911378	MBBHPWSVMVPINP-UHFFFAOYSA-N	429.428	1.699	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCCc2cc(C)cc(C)c2)cc1	741093780	VJXVQRGOCKHSTP-UHFFFAOYSA-N	432.546	1.805	50	20	IDGD	
CS(=O)(=O)CC[C@H](Cc1cccc(Br)c1)C(=O)NNC(=O)NC1CC1	741211053	BAYBTBFXPKSKKH-GFCCVEGCSA-N	432.340	1.535	50	20	IDGD	
Cc1ccc(CN2C(=O)CC[C@@H]2C(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1	742478328	MXEBNEQQRUOYHB-QGZVFWFLSA-N	443.529	1.240	50	20	IDGD	
CCCN(C(=O)[C@H](C)OC(=O)/C(C#N)=C/c1cccc(OC)c1)[C@@H]1CCS(=O)(=O)C1	744568931	XZNPCENFVIUGIQ-KFSXAOBBSA-N	434.514	1.960	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(\C#N)C(=O)NC[C@@H]2CCC[C@]23NC(=O)NC3=O)c1C	744625548	AWRWMULFTPFWAY-LDARGBIRSA-N	427.505	1.714	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)COC(=O)[C@H](c2ccccc2)N2CCCCC2=O)c1	744989720	GYYQQMKJJYGZPO-NRFANRHFSA-N	434.452	1.616	50	20	IDGD	
COc1ccc(C(=O)CNC(=O)CCC(=O)NNC(=O)Cc2ccc(Cl)cc2)cc1	745413516	KLDJJISDSVMRAD-UHFFFAOYSA-N	431.876	1.818	50	20	IDGD	
Cc1ccc(CN2C(=O)CC[C@@H]2C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)cc1	745591610	HZUOPUDKTGWCDK-LJQANCHMSA-N	434.452	1.362	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NCCN2CCCc3ccccc32)cc1	745793638	YUMVOBMXNTXVJJ-UHFFFAOYSA-N	431.518	1.879	50	20	IDGD	
Cc1nc(CNC(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)no1	745855701	XPTFCMQRNYSZOM-UHFFFAOYSA-N	433.432	1.224	50	20	IDGD	
CO[C@@H](CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)C(C)C	745927695	FIQSELBFBQFZIN-KRWDZBQOSA-N	426.539	1.476	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)NNC(=O)c2ccoc2)cc1	747182597	QSTPRWRKBHVLDJ-YBEGLDIGSA-N	448.439	1.395	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)c1ccc(NC2=NS(=O)(=O)c3ccccc32)cc1	747429461	LYUFLNFOBCGVSK-UHFFFAOYSA-N	435.465	1.646	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(Br)c(C(=O)NNC(=O)c2ccc[nH]2)c1	747663199	CJUPSJUMNYXINH-UHFFFAOYSA-N	443.323	1.883	50	20	IDGD	
N#CCCn1cc(/C=C(\C#N)C(=O)N2CCO[C@@H](C(N)=O)C2)c(-c2ccc(Cl)cc2)n1	747783020	XTHFUKFSXXAJBW-SPQRHKFCSA-N	438.875	1.737	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)NCCC(=O)N2CCCCCC2)c2ccccc2c1=O	748463507	UCIDHFJURRZCSD-UHFFFAOYSA-N	442.520	1.714	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CC[C@@H](NC(=O)OC(C)(C)C)C[C@@H]2C)n1	749476237	WTLQICBCBNLOIO-UONOGXRCSA-N	425.555	1.519	50	20	IDGD	
COc1cccc(C(C)(C)CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)c1	749770563	XIVOJQSSDMGLIQ-UHFFFAOYSA-N	433.534	1.910	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCc1ccc([S@@](C)=O)cc1	753051482	OPOMULCBPGDSQZ-GDLZYMKVSA-N	437.547	1.170	50	20	IDGD	
COc1ccc(-c2nn(CCC#N)cc2/C=C(\C#N)C(=O)NCc2cnn[nH]2)cc1OC	754863019	IAZGQPAGLWDXOS-OVCLIPMQSA-N	432.444	1.822	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)N[C@H]1CCN(c2ncccc2F)C1	755084814	IUISDEFVDVPLKG-ZDUSSCGKSA-N	449.512	1.045	50	20	IDGD	
CC(C)N1C(=O)c2ccc(C(=O)NNc3ccc(C(F)(F)F)nn3)cc2S1(=O)=O	755191602	MUVLODLOQXNZHM-UHFFFAOYSA-N	429.380	1.805	50	20	IDGD	
CC(C)(O)C(=O)NNC(=O)CN(Cc1ccccc1)S(=O)(=O)c1ccc(Cl)cc1	756796256	HIFHGEJHWKZEAW-UHFFFAOYSA-N	439.921	1.449	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2cccc(I)c2O)C[C@@H](C)O1	757714229	BGJOXPZFCYTPOW-PHIMTYICSA-N	447.273	1.257	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)c3cn(C)cn3)c2)c(C)c1	758044599	XXHGPGRYALWUMZ-UHFFFAOYSA-N	427.486	1.913	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)Nc1nc(-c2ccc(F)cc2)ns1	758084964	QIGQOUFJUDMVHE-UHFFFAOYSA-N	425.409	1.786	50	20	IDGD	
CCOC(=O)[C@H]1CCC(=NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)C[C@@H]1C	758120199	XQZNXPVZXYWYGB-PXNSSMCTSA-N	428.533	1.916	50	20	IDGD	
Cc1ncc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c(Cl)c1Cl	758500857	YSHLXIMGOGKDJH-CYBMUJFWSA-N	440.239	1.841	50	20	IDGD	
O=C(c1csc(-c2ccc(O)cc2)n1)N1CCN(S(=O)(=O)CBr)CC1	758518173	POVXWQXLWFBTDI-UHFFFAOYSA-N	446.348	1.956	50	20	IDGD	
CCc1csc(-n2cc(C(=O)N3CCN(S(=O)(=O)CBr)CC3)cn2)n1	758524651	XDIGVKUDRBLIHB-UHFFFAOYSA-N	448.368	1.331	50	20	IDGD	
CN(NC(=O)CCCNC(=O)OC(C)(C)C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758782687	WWEQJWGTYZLRPK-UHFFFAOYSA-N	443.545	1.927	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2ccc(Br)o2)cc(OC)c1OC	758948330	BWJRQBPNVUDECT-UHFFFAOYSA-N	435.252	1.691	50	20	IDGD	
CC(C)NS(=O)(=O)NCCNC(=O)NNc1c(F)cc(F)cc1Br	759573398	PVLGVFIOHBCUEV-UHFFFAOYSA-N	430.275	1.186	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)c1ccc(-c2nnc(S)o2)cc1	760017213	NDEOFCIRTDLBJL-UHFFFAOYSA-N	431.861	1.756	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)N=c1cc[nH]cc1I	760027812	BNTPGNVJVXYWMI-SECBINFHSA-N	444.204	1.867	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)c1cnn(-c2ccccc2)c1Br	760227328	NABXABUNBXYHFX-UHFFFAOYSA-N	432.234	1.419	50	20	IDGD	
CC(=NNC(=O)N[C@H]1CCS(=O)(=O)C1)c1ccc(CNC(=O)OC(C)(C)C)nc1C	760251424	WQHDXIWCXPLWCR-HNNXBMFYSA-N	439.538	1.625	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NCCOc2ccc(Cl)cn2)cc1	760832925	VKSFHEGCMSBJIN-UHFFFAOYSA-N	427.870	1.553	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N[C@@H]2CCCN(c3ccccc3F)C2=O)cc1OC	761821556	PEVYSMYPDFYYKR-OAHLLOKOSA-N	430.436	1.983	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)CCNS(=O)(=O)c2cccc(Cl)c2)n1	762914515	QHNJGGNRNQOYQZ-UHFFFAOYSA-N	426.930	1.788	50	20	IDGD	
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)C(=O)Nc1cccc(Cl)c1-n1cccn1	763441442	DZOKSWLPSNKEMF-UHFFFAOYSA-N	428.792	1.834	50	20	IDGD	
COCCOc1ccc(F)cc1NC(=O)C(=O)NNC(=O)c1ccc2ccccc2n1	763450910	VQPPSHSUTUYGME-UHFFFAOYSA-N	426.404	1.799	50	20	IDGD	
Cc1ccc(C)c(NC(=O)C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1	763508513	NHIHUHSNKBBTEQ-UHFFFAOYSA-N	444.513	1.488	50	20	IDGD	
COc1ccc(CN2CC[C@@H](NC(=O)NNC(=O)CSc3ccccc3O)C2=O)cc1	763513000	LEMLXYSLSPEKPR-MRXNPFEDSA-N	444.513	1.624	50	20	IDGD	
CCN(CC)C(=O)COc1cccc(NC(=O)C(=O)NNC(=O)c2ccccc2O)c1	763528716	DDENWUPEAPULJH-UHFFFAOYSA-N	428.445	1.039	50	20	IDGD	
O=C(COc1cccc(NC(=O)C(=O)NNC(=O)c2ccccc2O)c1)Nc1ccccc1	763530109	PAKVUUJHWNZSQG-UHFFFAOYSA-N	448.435	1.809	50	20	IDGD	
COCc1cccc(NC(=O)C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c1	763530882	KHSBNTLMFPPVLS-UHFFFAOYSA-N	439.516	1.131	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)C(=O)Nc2c(C)noc2C)cc(OCC)c1OCC	763542419	FIJVFIZLIPAYCQ-UHFFFAOYSA-N	434.449	1.887	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc(C)nc1Br	763645858	CSQVZOIMJNHMGS-UHFFFAOYSA-N	437.250	1.326	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccc2c(c1)nc(C)n2C	763684278	IQOIKQGJLWDRCT-UHFFFAOYSA-N	425.445	1.445	50	20	IDGD	
COC(=O)c1cc(F)c(F)cc1NC(=O)C(=O)NNC(=O)CN1CCCc2ccccc21	763728044	HXZRLZATYAIJQQ-UHFFFAOYSA-N	446.410	1.290	50	20	IDGD	
O=C(NNC(=O)c1cc2c(s1)CCC2)C(=O)Nc1cccc(S(=O)(=O)NC2CC2)c1	763781167	GLAAXMYAPDYWMT-UHFFFAOYSA-N	448.526	1.077	50	20	IDGD	
CCCOc1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])c(C)c1	763803209	JRXXGTCQBZVTND-UHFFFAOYSA-N	430.417	1.857	50	20	IDGD	
Cc1ccc(-n2nc(C(=O)NNC(=O)CNC(=O)c3cccnc3)c3c2CCC3)c(F)c1	763812240	AUODFULJKNCRKM-UHFFFAOYSA-N	436.447	1.395	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)ccc1NC(C)=O	763851033	SYOQWRFUVBPSNK-NSHDSACASA-N	432.408	1.346	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1cccc(-c2nccn2C)c1	763866640	XFNXMNLMVSRGBO-ZDUSSCGKSA-N	425.420	1.780	50	20	IDGD	
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1ccccc1N1CCN(C)CC1	763867967	ZGPFYQMODBDOHM-OAHLLOKOSA-N	443.479	1.131	50	20	IDGD	
COCCn1ccc(NC(=O)C(=O)NNC(=O)c2sc(-c3ccccc3)nc2C)n1	763900844	CUOUSEVNADUZDW-UHFFFAOYSA-N	428.474	1.361	50	20	IDGD	
COC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc1	763943970	IHKXCIIMOUKFFG-UHFFFAOYSA-N	438.400	1.156	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cc(Br)cn2C)ccc1C	764001718	CXVMOVWCUOJILK-UHFFFAOYSA-N	437.250	1.282	50	20	IDGD	
O=C(NNC(=O)c1ccc(F)cc1Br)C(=O)Nc1c[nH]nc1-c1ccccn1	764084102	DPNSLZOERNGDRR-UHFFFAOYSA-N	447.224	1.773	50	20	IDGD	
COC(=O)N(C)c1ccc(NC(=O)C(=O)NNC(=O)CCc2ccc(OC)cc2)cc1	764127223	QQCHHDPAOKXFCT-UHFFFAOYSA-N	428.445	1.617	50	20	IDGD	
O=C(CCc1ccco1)NNC(=O)C(=O)Nc1ccc2c(c1)CCN2C(=O)c1cccnc1	764177903	VEQSJGINNYLSQX-UHFFFAOYSA-N	447.451	1.596	50	20	IDGD	
Cn1cc(NC(=O)C(=O)NNC(=O)CCCc2ccccc2)cc(Br)c1=O	764223435	BATSVJWNENGJKF-UHFFFAOYSA-N	435.278	1.257	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)CCCc2ccccc2)cc1NS(C)(=O)=O	764223628	FUBHKYQPTJEOTB-UHFFFAOYSA-N	432.502	1.475	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)C(=O)Nc1ccc(N2CCSCC2)c(Cl)c1	764267914	BRSWOGNPTATYEA-UHFFFAOYSA-N	433.921	1.617	50	20	IDGD	
CCOC(=O)N(C)c1ccc(NC(=O)C(=O)NNC(=O)CCc2ccccc2O)cc1	764277295	BAUGMZQXPRSJPZ-UHFFFAOYSA-N	428.445	1.704	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)C(=O)Nc1cc(NC(=O)c2ccccc2)ccc1C	764398053	CGFKTAPFJNVNKF-HNNXBMFYSA-N	442.472	1.385	50	20	IDGD	
COc1ccc(-c2n[nH]c(CNC(=O)NNC(=O)CSc3ccccc3O)n2)cc1	764412252	BBUVRZDMYCGFIH-UHFFFAOYSA-N	428.474	1.809	50	20	IDGD	
CC(C)(C)OC(=O)NCCCC(=O)NNC(=O)[C@@H]1CCCN(C(=O)c2ccncc2)C1	765320138	LSEJINUJNKRCKR-MRXNPFEDSA-N	433.509	1.386	50	20	IDGD	
CN1CCN(C(=O)c2ccc(CNC(=O)NNc3ccccc3S(C)(=O)=O)cc2)CC1	765679065	VXLUAGMNWCEXMY-UHFFFAOYSA-N	445.545	1.304	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)c2cccc(CN3CCOCC3)c2)n[nH]1	768281505	MZCLZNQDLNKEPY-UHFFFAOYSA-N	435.484	1.992	50	20	IDGD	
Nn1c(SCC(=O)NNC(=O)c2cccc(Cl)c2)nnc1-c1n[nH]c2c1CCC2	768426070	BBNBTINNMMIVAD-UHFFFAOYSA-N	432.897	1.077	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)N[C@H]3CCCC[C@H]3CNC(=O)OC(C)(C)C)nc21	770402657	UAEJEDAHZRPJTO-AAEUAGOBSA-N	434.501	1.779	50	20	IDGD	
C=CCNS(=O)(=O)c1ccc(C(=O)NNc2nc(O)c3cnn(C(C)(C)C)c3n2)cc1	770966016	PSDRCMYNOWMXJY-UHFFFAOYSA-N	445.505	1.508	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)c1cccc(S(=O)(=O)NC2CCCC2)c1	771985800	STDGPMXTTUFAMS-AWEZNQCLSA-N	439.534	1.646	50	20	IDGD	
COc1cc(Cl)ccc1NC(=O)C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	773496596	OZWXALGCMQDNDA-UHFFFAOYSA-N	425.850	1.152	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2ccc(Br)c(C)n2)cc1	773539420	AEPIDKYGCPJOTM-UHFFFAOYSA-N	435.278	1.880	50	20	IDGD	
Cc1c(NNC(=O)C(=O)Nc2ccc(I)cn2)cccc1[N+](=O)[O-]	773661133	JNCXMTMULBWDIN-UHFFFAOYSA-N	441.185	1.985	50	20	IDGD	
COc1cccc(C2(NCC(=O)NNC(=O)c3cccc(C#N)c3)CCOCC2)c1F	773990383	LLWHDSSFUWVTIH-UHFFFAOYSA-N	426.448	1.762	50	20	IDGD	
C=CCOc1cccnc1C(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	775541932	GDTKNHZGIIPWKN-UHFFFAOYSA-N	443.935	1.879	50	20	IDGD	
COC(=O)C1(c2ccc(S(=O)(=O)NNC(=O)c3cnn(-c4ccccc4)c3)cc2)CC1	776280618	JOHCPPCCSBTPJW-UHFFFAOYSA-N	440.481	1.700	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cc(C)cc(Br)c1	777141807	SSYMOZXZVZFPID-UHFFFAOYSA-N	436.262	1.931	50	20	IDGD	
O=C(COC(=O)[C@@]1(F)CCN(C(=O)OCc2ccccc2)C1)NNC(=O)c1cccs1	777233078	CFMGIZSPJJIIEJ-HXUWFJFHSA-N	449.460	1.803	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)[C@H](C)n1nnnc1C(C)(C)C	777796133	UJKMWAFWUROCQV-QWRGUYRKSA-N	439.314	1.909	50	20	IDGD	
COC[C@@H](C)C(C)=NNC(=O)C[C@H]1c2cc(OC)c(OC)cc2CCN1S(C)(=O)=O	777876669	BAJPSYYLZZNSAO-DYVFJYSZSA-N	441.550	1.727	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)[C@H]1CSCN1C(=O)c1ccc(Cl)cc1	778437904	GWTIYLAEUOIJNZ-CYBMUJFWSA-N	442.925	1.527	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)Cc1csc(NC(=O)c2ccccc2)n1	778438037	PSDDRURNIAXILR-UHFFFAOYSA-N	433.490	1.610	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)N[C@@H]1CCCN(c2ccc(C#N)cc2)C1=O	780901857	JOPMGFSSCDWEEL-IFXJQAMLSA-N	439.447	1.991	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)NCc1cccc(S(=O)(=O)N(C)C)c1	782538786	HZGZKZMWLQTXLQ-UHFFFAOYSA-N	430.490	1.037	50	20	IDGD	
CC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)Cc2nc3ccccc3n2C)cc1Cl	782885304	JASUBLHIXKXLPC-UHFFFAOYSA-N	442.863	1.514	50	20	IDGD	
O=C(NNc1cccc(F)c1)C(=O)Nc1ccc2c(ccn2CC(=O)N2CCOCC2)c1	783035739	CCZIBDHEBITZTA-UHFFFAOYSA-N	439.447	1.721	50	20	IDGD	
COc1cc(C#N)ccc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1	783408743	MZJBTLJRWWQXNT-UHFFFAOYSA-N	442.375	1.942	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)Cc3cc4c(cc3Br)OCCO4)nc21	784411134	SCBDBSUBYKTYIR-UHFFFAOYSA-N	435.238	1.288	50	20	IDGD	
COc1ccc(C(=O)CCC(=O)NNC(=O)c2cncc(NC(C)=O)c2)c(OC)c1OC	784689735	MUZPZVQPGUHMOK-UHFFFAOYSA-N	444.444	1.490	50	20	IDGD	
O=C(NNc1nccnc1Cl)C(=O)Nc1ccn(-c2ncccc2C(F)(F)F)n1	784778235	RUEYWHVOZVUDGM-UHFFFAOYSA-N	426.746	1.811	50	20	IDGD	
COc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)C(=O)NNc1ccc(Cl)nc1	784875499	UTXLJZMNPRRYTI-UHFFFAOYSA-N	427.870	1.076	50	20	IDGD	
CN(C)c1nccc(NNC(=O)C(=O)Nc2cccc(F)c2I)n1	784970454	VTFQBGUWIKEINC-UHFFFAOYSA-N	444.208	1.368	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)Nc1ccn(-c2ccccc2Cl)n1	785024084	SGLHFNLFQAHXQY-UHFFFAOYSA-N	444.791	1.539	50	20	IDGD	
C[C@@H](c1ccccc1)n1ccc(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)n1	785060831	OOMBHIRCADVOKH-HNNXBMFYSA-N	431.456	1.469	50	20	IDGD	
COc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)C(=O)NNc1cc(F)c(F)c(F)c1	785088112	AIKROGHVWALTFQ-UHFFFAOYSA-N	446.407	1.445	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)C(=O)Nc1ccnn1[C@H](C)CC(C)C	785330097	DXRXGRVHYKGFDK-CYBMUJFWSA-N	437.522	1.984	50	20	IDGD	
O=C(COC(=O)c1ccnc(OC2CCC2)c1)NNC(=O)[C@H]1COc2ccccc2O1	786643000	IHGOYDNESPDBFQ-QGZVFWFLSA-N	427.413	1.157	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)[C@H]2CCCN(C(=O)NC3CCCC3)C2)cc1	786821154	PVUSGWIOUMYYHO-KRWDZBQOSA-N	441.488	1.227	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)cccc1N1CCNC1=O	787542572	NXPAPMRDTRBZDA-UHFFFAOYSA-N	431.836	1.283	50	20	IDGD	
O=C(NNC(=O)N1CCC[C@H](Oc2ncccc2F)C1)C1CCN(c2ncccn2)CC1	787858187	QEDPFLRLPQMUMO-INIZCTEOSA-N	443.483	1.511	50	20	IDGD	
COC(=O)c1cc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c(C)cc1C	788315928	SZPFZVRRWURBPV-UHFFFAOYSA-N	448.501	1.807	50	20	IDGD	
Cc1ccc(S(=O)(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)cc1F	788916842	RLVFRMSGFPSPLT-UHFFFAOYSA-N	430.502	1.932	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N[C@@H]2CCN(Cc3ccc(C)cc3)C2=O)cc1OC	790697918	OPUUQPKHVSQWSQ-QGZVFWFLSA-N	426.473	1.757	50	20	IDGD	
COc1ccc(OC)c(C2=NO[C@H](C(=O)NNC(=O)[C@@H](C)Oc3ccc(F)cc3)C2)c1	792020004	CJBTYGNRXJYWRI-BLVKFPJESA-N	431.420	1.951	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3cc4nccnc4cc3F)cc2)CC1	792267861	NOULGTAZVSONRM-UHFFFAOYSA-N	444.492	1.462	50	20	IDGD	
Cc1cc2n[nH]cc2cc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	792284401	YGJGTKFRAXOLMU-UHFFFAOYSA-N	428.474	1.394	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NN=C[C@H]1CCCN(C(=O)CNC(=O)OC(C)(C)C)C1	794527299	XRNZMONNKZKNDM-CQSZACIVSA-N	441.529	1.376	50	20	IDGD	
COc1ccc(-n2cc(O)c(C(=O)NNc3ccc(S(=O)(=O)N(C)C)cc3)n2)cc1	794716250	CIRDCUQNWFDQMG-UHFFFAOYSA-N	431.474	1.594	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CC[C@H](C(=O)N(C)c3ccccc3)C2)cc1OC	797530848	ZLYYXQSELDPKQE-KRWDZBQOSA-N	440.500	1.450	50	20	IDGD	
Cc1ccc(-c2ccnn2C)cc1NC(=O)C(=O)NNC(=O)c1nnc(O)c2ccccc12	799258830	NCVQQGVYAKEVHP-UHFFFAOYSA-N	445.439	1.444	50	20	IDGD	
COC(=O)c1cccc(NC(=O)C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)c1OC(C)C	799259171	PXRWUXJXRUMWSS-QGZVFWFLSA-N	441.440	1.350	50	20	IDGD	
CCc1cccc(C)c1NNC(=O)C(=O)Nc1cnn(CC(=O)N2C[C@@H](C)O[C@H](C)C2)c1	799842717	VNTYLQJVRQSASB-HZPDHXFCSA-N	442.520	1.472	50	20	IDGD	
CCc1cccc(C)c1NNC(=O)C(=O)Nc1ccccc1OCC(=O)N1CCOCC1	799844285	ONVRKWZQESHSTL-UHFFFAOYSA-N	440.500	1.877	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@](C)(O)CCc2ccccc2)c1	801102152	DLWHSMBQWGIJNM-QFIPXVFZSA-N	447.557	1.862	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@](C)(O)CN2C(=O)C(C)(C)c3ccccc32)cc1	801111072	KNYFTRQIVISWNN-HSZRJFAPSA-N	438.484	1.156	50	20	IDGD	
COc1ccc(C2=NO[C@@H](CNC(=O)NNC(=O)Cc3cn4ccccc4n3)C2)cc1F	802346750	RHTHTYQRCUAZOX-OAHLLOKOSA-N	440.435	1.548	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)C(=O)N2CCc3cc(F)ccc32)c2ccccc2c1=O	802566298	IBSNOXFTEZPQON-UHFFFAOYSA-N	437.431	1.467	50	20	IDGD	
Cc1c(NC(=O)CSCC(=O)NNc2ncccc2F)c(=O)n(-c2ccccc2)n1C	804215697	BSEAKKDJMPSIQQ-UHFFFAOYSA-N	444.492	1.834	50	20	IDGD	
Cn1nc(Br)c2c(=O)n(CC(=O)NNc3nccnc3C3CCC3)cnc21	805460715	PJVWUUQLWHWTLG-UHFFFAOYSA-N	433.270	1.093	50	20	IDGD	
Cn1ncc(NC(=O)C(=O)NNC(=O)COc2ccc(Cl)cc2)c1-c1ccccc1	806973461	CFJJYTKHOHCQFU-UHFFFAOYSA-N	427.848	1.905	50	20	IDGD	
CN1CCN(C(=O)NNC(=O)c2cnn([C@H]3CCCN(C(=O)OC(C)(C)C)C3)c2)CC1	807383032	ZCMLLZQCNWPKDF-INIZCTEOSA-N	435.529	1.057	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@H]2CCOC[C@@H]2C)c1	807505411	KOPZJJPEBRXAGA-GOEBONIOSA-N	426.539	1.334	50	20	IDGD	
CCc1nnc(NC(=O)[C@@H](C)[C@H](C)NC(=O)NNC(=O)COc2ccc(C#N)cc2)s1	807566655	ZPJCFAMGWUBWSP-RYUDHWBXSA-N	445.505	1.345	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1ccc2c(c1)C(=O)OC2	808933308	KJUYUAZFGZITRU-UHFFFAOYSA-N	446.485	1.516	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)[C@@](C)(O)C3CCC3)c2)cc1	813363542	LWJPNTPHJGZMIJ-NRFANRHFSA-N	447.513	1.808	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)c1ccc2c(c1)NC(=O)CNC2=O	814222388	JDZLEBDHFKCRHG-ZDUSSCGKSA-N	432.436	1.750	50	20	IDGD	
CCOc1nc2ccc(C(=O)OCC(=O)NNC(=O)[C@H]3COc4ccccc4O3)cc2[nH]1	815441993	RAYILIJBBLWXHO-QGZVFWFLSA-N	440.412	1.106	50	20	IDGD	
Cc1ccn(-c2ccc(NC(=O)C(=O)NNc3ccccc3S(=O)(=O)N(C)C)cc2)n1	815752443	SINRYGPCYMLMMC-UHFFFAOYSA-N	442.501	1.513	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)[C@@H]1CCCN1c1ncnc2ccccc12	817054197	YHTFFLGCZTVCOX-SFHVURJKSA-N	440.529	1.992	50	20	IDGD	
C[C@H](CN1CCCCCC1)C(=O)NN=Cc1c(N2CCOCC2)nc2ccccn2c1=O	874089806	CNPPRAYRYNDRCS-GOSISDBHSA-N	440.548	1.493	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNC(=O)CN2C(=O)[C@@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2=O)cc1	909364717	AWOVSVGMMSDETF-XAMWDVODSA-N	425.485	1.680	50	20	IDGD	
NC(=O)[C@H]1CC(C(=O)NNC(=O)Cc2cccc3ccccc23)=NN1c1ccc(F)cc1	913084008	YQAGPDBJIUHERY-HXUWFJFHSA-N	433.443	1.789	50	20	IDGD	
O=C(COC(=O)COc1ccc(F)c(Cl)c1)NNC(=O)[C@@H]1COc2ccccc2O1	913391914	OSLMHCHCZQOYEY-INIZCTEOSA-N	438.795	1.389	50	20	IDGD	
O=C(CC[C@H]1NC(=O)NC1=O)NNC(=O)c1ccc(COc2ccc(Cl)cc2)cc1	913482028	ZOEHEATUXMDJNE-MRXNPFEDSA-N	430.848	1.668	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)NC2CC2)cc1)NNC(=O)Cn1cnc2ccccc21	914222025	NQQACFJBYJGEAZ-UHFFFAOYSA-N	441.513	1.257	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)[C@@H](C)Oc2cccc(Br)c2)c2c(O)nn(C)c2n1	915188763	QEEKBDGWNOOMKW-SNVBAGLBSA-N	448.277	1.973	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)CN(C)S(=O)(=O)c2cccnc2)c(C)n1-c1ccccc1	915261006	BFRGMDDTZKULSM-UHFFFAOYSA-N	441.513	1.571	50	20	IDGD	
COc1ccccc1[C@H](NC(=O)NNC(=O)COc1ccccc1C#N)c1nccn1C	916229013	RHAASYRAJSDSCQ-FQEVSTJZSA-N	434.456	1.799	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)NCc2ccc(C(=O)N3CCOCC3)cc2)cc1C	916249016	UIVFSARGEANMMI-UHFFFAOYSA-N	440.500	1.685	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)N[C@@H](CN1CCCC1=O)c1ccccc1	916459953	SCBFRMGVKMYPKM-INIZCTEOSA-N	441.444	1.668	50	20	IDGD	
CCN1C(=O)c2ccc(C(=O)NNC(=O)c3cc(-c4ccccc4)[nH]n3)cc2S1(=O)=O	917522721	LNVLDKGPZJSOBC-UHFFFAOYSA-N	439.453	1.316	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1)C(=O)Nc1ccccc1	918008756	SDIZUZYLVAJVCV-UHFFFAOYSA-N	441.451	1.788	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)CCCOc2ccccc2F)cc1	918293172	WZQKPQRLUJGQCX-UHFFFAOYSA-N	437.493	1.761	50	20	IDGD	
COc1ccc([C@]2(C)NC(=O)N(CC(=O)NNC(=O)c3ccc(Cl)cc3O)C2=O)cc1	918357705	LTTFKSZNLGDMRP-FQEVSTJZSA-N	446.847	1.282	50	20	IDGD	
COc1cccc(/C=C(\C#N)C(=O)OCc2nnnn2-c2ccc(S(C)(=O)=O)cc2)c1	918977143	RNLXHFIKEVDLPL-XNTDXEJSSA-N	439.453	1.725	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(-n3ccc(C)n3)cc2)cc1OC	919185832	RUQRPDUCPMVXKG-UHFFFAOYSA-N	438.440	1.816	50	20	IDGD	
CCC(=O)N1CCCC[C@H]1C(=O)OCC(=O)NNC(=O)c1cc(Cl)ccc1OC	919476547	WJTKSNGGALDWOV-AWEZNQCLSA-N	425.869	1.444	50	20	IDGD	
CCN(Cc1ccccc1)C(=O)CNC(=O)NNc1ccc(S(=O)(=O)NC(C)C)cn1	920051209	MFMXDZCFEGHWLP-UHFFFAOYSA-N	448.549	1.443	50	20	IDGD	
O=C(NCc1cccc(NC(=O)[C@H]2CCCO2)c1)NNC(=O)c1cccc([N+](=O)[O-])c1	920238577	YIXYZXXNJJKOGU-QGZVFWFLSA-N	427.417	1.857	50	20	IDGD	
COC(=O)c1ccc(C)c(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1	920931161	DNAHOZCKMQVTHD-UHFFFAOYSA-N	434.474	1.498	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Nc2cc(S(=O)(=O)NC3CC3)ccc2OC)cc1	1116562103	XKCWSRLTPQCIJS-UHFFFAOYSA-N	434.474	1.611	50	20	IDGD	
CN(C)c1ccc(S(=O)(=O)N(C)C)cc1NC(=O)NNC(=O)c1n[nH]c2c1CCCC2	1254705977	VHKWLPDMUZHWOK-UHFFFAOYSA-N	449.537	1.071	50	20	IDGD	
CCOC(=O)c1ncc(C(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)s1	1261083640	MLROUPKXIJJXPT-UHFFFAOYSA-N	445.545	1.207	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CCCN(C)C2=NS(=O)(=O)c3ccccc32)cc1	1319078050	FVTMZXWBGJAVMG-UHFFFAOYSA-N	430.486	1.317	50	20	IDGD	
CC(=O)N(CCc1ccccc1)CC(=O)NNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1	1319565250	MZJFMBQYHGPFRW-UHFFFAOYSA-N	446.548	1.872	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NC2CCC(O)(c3cccnc3)CC2)c2ccccc2c1=O	1320354509	DDVQIVDBKMPRSE-UHFFFAOYSA-N	436.472	1.103	50	20	IDGD	
CC1(C)C(=O)N(C[C@@](C)(O)C(=O)NNC(=O)c2n[nH]c3c2CCCC3)c2ccccc21	1321126457	FUJYICXEHNGGEZ-JOCHJYFZSA-N	425.489	1.125	50	20	IDGD	
Cc1ccc(-n2[nH]c(C(=O)NNC(=O)C3CCN(C(=O)OC(C)(C)C)CC3)cc2=O)cc1	1339786918	FEZKVLGFUIQNQI-UHFFFAOYSA-N	443.504	1.882	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)NCCN2CC=CC2)cc1	1339863233	XMRGRSGKFKQNRZ-NBVRZTHBSA-N	434.500	1.329	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cccc3nc[nH]c23)C1	1777860851	VYKCQWMNEZJDBH-LUQKVYGDSA-N	434.924	1.944	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@](C)(Cl)CCl)C2	1777983711	NTQWRBWGKXCRNQ-RUZGCFLTSA-N	437.368	1.184	50	20	IDGD	
CCCC(=O)N[C@H](C)C(=O)N1CC[C@]2(CN(C(=O)[C@@H](Br)CC)CCO2)C1	1779259079	XFPPUNXQZUQURV-QWQRMKEZSA-N	432.359	1.295	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(-n4c(O)nnc4O)cc3)C2)C1	1780203339	FGFGSKQJSZCIFO-YWZLYKJASA-N	449.895	1.139	50	20	IDGD	
C=C(CC(=O)OCC)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Br)C2	1780738209	CHSDPUJVSFNKED-DDUZABMNSA-N	449.317	1.700	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccccc2C(N)=O)C1	1780992380	FLARERJSZQYNLF-CBGDNZLLSA-N	437.924	1.167	50	20	IDGD	
CC(C)N1CCC(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)CC1	1781325496	DPUXQDHUUDDFBD-QAPCUYQASA-N	434.350	1.627	50	20	IDGD	
N[C@H](C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1)c1cccc(Cl)c1	1781331399	QATRHFKRLFUJGL-ZQIUZPCESA-N	448.720	1.860	50	20	IDGD	
CCOCC(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](Br)Cc3ccccc3)C2)C1	1783024172	VBQUDXLVBJYWBK-PXNSSMCTSA-N	439.350	1.859	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)/C=C/c3cc(C)on3)CCO2)C1	1783349935	WKMXIBDWDFAABP-WZYSVALVSA-N	426.311	2.000	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cccc4nccn34)CCO2)C1	1783354251	XBJPIOOPJCPYFK-AUUYWEPGSA-N	435.322	1.951	50	20	IDGD	
CCOc1ccc(CC(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)cc1OC	1783699067	BCUBDPGUVFBWTB-KKSFZXQISA-N	440.924	1.066	50	20	IDGD	
C=CCCc1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](Cl)COC)C3)C2)c(O)n1	1783873477	PBNXWVMUKBEACY-LAUBAEHRSA-N	437.924	1.603	50	20	IDGD	
CCc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]3C2)n(C)n1	1783969181	FLMKUVQJPOAYID-HPZZRFSDSA-N	441.370	1.607	50	20	IDGD	
CC(=O)NCC(C)(C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]21	1784644299	RXYPQPDBFRFPMC-XLPNERPQSA-N	436.380	1.365	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(N(C)C)cn3)[C@H]2C1	1785749883	LDKCEOWPRRVBQV-RMRKRWHISA-N	439.354	1.524	50	20	IDGD	
CN1CCC(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCBr)[C@H]3C2)CC1	1786404778	OLIACADMQKCWOQ-ULQDDVLXSA-N	430.387	1.483	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4c(n3)OCCO4)[C@H]2C1	1787380550	HRTBNFAANXMSET-XSWJXKHESA-N	437.924	1.854	50	20	IDGD	
Cc1n[nH]c(C)c1C(=O)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1	1788142490	ZOQMYQTYTPEDDC-UHFFFAOYSA-N	432.289	1.768	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3coc([Si](C)(C)C)c3)[C@H]2C1	1788592483	ZQYOLGROBJUAJB-HJWJTTGWSA-N	443.016	1.672	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CSc3ncccn3)C[C@@H]21	1788765300	ZHYIOZCXZQFBPC-JYJNAYRXSA-N	438.626	1.400	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(-c4ccccc4)[nH]n3)[C@H]2C1	1789320479	WSEDGTLJLAJLOM-LJCCNALRSA-N	446.935	1.924	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](N)Cc3cccnc3)C[C@@H]21	1789865792	GVTXRGAVEJINCE-LLYLOPHFSA-N	443.375	1.167	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3cc(F)ccn3)C[C@@H]21)[C@@H](F)Br	1789922655	QLLWJDUDATWFJT-JIRONKKISA-N	446.292	1.824	50	20	IDGD	
COc1ccccc1CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21	1790952818	LGSFSDSFZNOIIV-DNUAJFIVSA-N	443.313	1.908	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)N(C)C(C)=O)C[C@@H]21	1790961845	RQDNADPLYQIUMS-CHUNWDLHSA-N	432.359	1.006	50	20	IDGD	
Cc1cnn([C@H](C)C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]3C2)c1	1791064957	NRCLQSDCPLJJPK-OWYFMNJBSA-N	427.343	1.516	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1ccc(C2(NC(=O)C3=NN(C)C(=O)CC3)CCC2)cc1	1791599321	DCVFGTDSWKSYDU-UHFFFAOYSA-N	442.520	1.102	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(C#N)ccc1F)C2	1792874653	WFORYHUSKRRWFB-MBMVNNNZSA-N	438.297	1.932	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1C[C@@H]1c1ccc(F)c(F)c1	1793047734	CUXOYVZEVNNXFF-XPYFFNBCSA-N	442.890	1.912	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2)C1CC1	1793064174	SPMDVQFHPNGELI-AUOOEQCUSA-N	447.935	1.804	50	20	IDGD	
C=C[C@@H]1C[C@]1(NC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCl	1793117466	NLJOXVFBIVFMTR-ATCDCCBLSA-N	441.956	1.694	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1c(F)ccnc1Cl)c1ccc(B(O)O)cc1	1794528048	GAWZAKIZQKJFBP-QDMKHBRRSA-N	431.660	1.120	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc2nc[nH]c12	1796145610	MOWUYHWBVGWKJN-LMWOUKEDSA-N	435.322	1.940	50	20	IDGD	
Cc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CO[Si](C)(C)C)nc2nccn12	1797957441	PDWMXDRBUBFDNH-JLVBRIDZSA-N	431.569	1.092	50	20	IDGD	
O=C1Nc2c(cccc2C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](F)Br)C3)C1=O	1798209139	ZJCTULGTSJQPHK-OFYUCFFLSA-N	438.253	1.764	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1c[nH]c(=O)cn1	1799356355	MHJHVFGQYRNAFD-SELDRTEESA-N	439.422	1.907	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1cc2cccnn2c1	1800009036	QWQKFVRSTGUGSW-NEBZKDRISA-N	425.258	1.228	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1Cc2[nH]nc(C(F)(F)F)c2C1	1800320343	CTCCDJLQXJXVHN-JUFVYRIHSA-N	448.873	1.750	50	20	IDGD	
CCc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](Br)CC)nn1C	1800641883	LPRUDRLSIATRAI-LMWOUKEDSA-N	427.343	1.359	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(=O)c3ccccc3o1)C2	1800754242	KUQJAHJUWDOZDN-ZIVKBKJYSA-N	449.301	1.780	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc3cc(Cl)ccn13)C2	1800975335	MQJYBKFWMOPBOM-IFOZYUSPSA-N	441.315	1.445	50	20	IDGD	
C[C@H]1Oc2ccc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)C(Cl)Cl)cc2NC1=O	1801016401	IVWCTLUOTMFEPX-ADGXKJENSA-N	442.299	1.413	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(OC)c(Cl)c1	1801792888	APNKURYHVPDHOA-IARIHHJXSA-N	431.316	1.806	50	20	IDGD	
Cc1c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](C)Br)cn2[nH]cnc(=O)c12	1801963790	QBJFMSBIJQIIBF-FVCCEPFGSA-N	436.310	1.366	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)NC=O)[C@H]1c1cccnc1	1803016022	WGHCIQIAORITAM-VDERGJSUSA-N	425.327	1.253	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cc3cn[nH]c3cn2)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803142916	MVMWFJFASAIUSA-DOPJRALCSA-N	428.880	1.272	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)COc2ccccc2F)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803148049	NOBIATBYMKGORN-RIFZZMRRSA-N	435.883	1.905	50	20	IDGD	
COc1cc(Cl)cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)c1	1803763973	LJZMZJRRMOJINX-REPLKXPHSA-N	442.708	1.594	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)CN2C(=O)CNC2=O)[C@@H]1c1cccnc1	1804086769	ATEVGGKLWJYCRC-MPGHIAIKSA-N	435.912	1.047	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H](CNC(=O)Cc2ncccn2)[C@H]1c1cccnc1	1804693762	XCHPRTZIMRGUDU-DYESRHJHSA-N	427.581	1.972	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC2(CCN(C(=O)CCN3CCOCC3)CC2)C1	1805383817	WVQLZMLDRXGYHX-QGZVFWFLSA-N	444.414	1.971	50	20	IDGD	
Cc1oncc1C(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1805803290	DMAJWWWEZUESSB-OXQOHEQNSA-N	428.493	1.071	50	20	IDGD	
C=CC[C@H](C(=C)C)C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1807362471	VQLKMMZNKOBGFP-MDNUFGMLSA-N	447.344	1.849	50	20	IDGD	
CC[C@H](NC(C)=O)C(=O)N1CC[C@H](CNC(=O)[C@H](F)Br)[C@H]1c1cccnc1	1808649495	SIAMPOJQHKGDSD-QXSJWSMHSA-N	443.317	1.693	50	20	IDGD	
Cc1ccncc1C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1	1808785519	WGAOHSSELMAPOM-DENIHFKCSA-N	444.300	1.098	50	20	IDGD	
Cc1ccccc1OCC(=O)N1CCCC2(CCN(C(=O)CCC(=O)NN(C)C)CC2)C1	1809339316	MANZQBCRJHNBRW-UHFFFAOYSA-N	444.576	1.978	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)c1ccc2ncncc2c1	1809916034	VAZHMSDDUGCBNM-FFZOFVMBSA-N	439.903	1.944	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)c3cccnc3Cl)CC2)C1	1809968164	SAQSPZOSSBHVDV-UHFFFAOYSA-N	441.724	1.573	50	20	IDGD	
C[C@H](Cn1cncn1)C(=O)N1CC[C@@H](CNC(=O)CO[Si](C)(C)C)[C@@H]1c1cccnc1	1810545909	HMFSBKPXYOSDMT-KPFFTGBYSA-N	444.612	1.867	50	20	IDGD	
CCC(=O)C(=O)NC[C@@H]1CCN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@H]1c1cccnc1	1812565713	MRPJYROIOPCDAX-TYNUBOESSA-N	438.488	1.201	50	20	IDGD	
CC(=O)C[C@H](C)C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1	1813075242	YPYXXWBLMZFDOD-RRMPHLOHSA-N	431.537	1.076	50	20	IDGD	
COC(=O)NCC(=O)NC[C@@H]1CCN(C(=O)[C@](C)(Cl)CCl)[C@H]1c1cccnc1	1813266383	IQDGHJHOYAZLIQ-DHSIGJKJSA-N	431.320	1.680	50	20	IDGD	
C[C@H](C(=O)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@H]1c1cccnc1)n1cncn1	1813402222	ONYZJQJAWSVIBP-UNQGMJICSA-N	439.289	1.631	50	20	IDGD	
O=C(CN1C(=O)CSC1=S)NC[C@@H]1CCN(C(=O)[C@@H](F)Cl)[C@H]1c1cccnc1	1814189148	MMSHBTNOEKMCHT-TUKIKUTGSA-N	444.941	1.482	50	20	IDGD	
CC(C)(CCl)C(=O)N[C@H]1CCc2nc(NC(=O)CNCP(=O)(O)O)sc2C1	1814763373	URTJLBWIZFECEL-VIFPVBQESA-N	438.874	1.045	50	20	IDGD	
CCC[C@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](COC)NC(C)=O)[nH]n1	1815321269	RPNJKHSKUWDUQE-CWRNSKLLSA-N	427.933	1.960	50	20	IDGD	
C[C@H](C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](F)Cl)CC2)[C@H]1SC(=N)NC1=O	1817251439	VTWAQENMKZLNKN-NAXOPYRSSA-N	433.918	1.392	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](C)S)CC2	1817282313	BRWNZJOOXWNISG-VGCOHKFJSA-N	434.547	1.507	50	20	IDGD	
Cn1cc(F)cc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1	1817475630	WTSHAKVRZIZZMI-KRWDZBQOSA-N	439.256	1.187	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@H]1CCc2nc(NC(=O)CCN3CCOC3=O)sc2C1	1818693722	VEVKVPCQQPWLHY-LBPRGKRZSA-N	440.598	1.749	50	20	IDGD	
N#Cc1c[nH]c(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)[nH]n2)c1	1820307913	HZIBARNWTQGGHY-QGZVFWFLSA-N	447.459	1.228	50	20	IDGD	
COC(=O)C1(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@@H](C)Br)CC3)CC1	1825281901	LVDOJJXGYFQAMX-BDAKNGLRSA-N	430.324	1.792	50	20	IDGD	
CC(=O)NC(C)(C)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](C)Br)sc2C1	1825636470	VYOMROJDTJRSPS-WCBMZHEXSA-N	431.356	1.753	50	20	IDGD	
CNC(=S)NCCC(=O)N[C@H]1CCc2nc(NC(=O)[C@H](C)Br)sc2C1	1825640608	DEBOPWNLXAPUQB-IUCAKERBSA-N	448.412	1.323	50	20	IDGD	
O=C([C@@H]1C[C@]1(F)Cl)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827055275	SYIMMCVHKPXLHT-WAOWUJCRSA-N	436.720	1.524	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(CO)c(F)c3)C2)C1	1830370411	LECUKMGADGAOPV-OAQYLSRUSA-N	442.915	1.653	50	20	IDGD	
COc1ccccc1CCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1830991707	DNGWXAXXOMSLOL-QUCCMNQESA-N	428.888	1.619	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cnnc(Cl)c3)CC2)CC1	1833892029	BSDPFFRHDVHCPV-MRXNPFEDSA-N	444.363	1.569	50	20	IDGD	
CN1CCC[C@@H](C(=O)N2CCC(N3CCC(NC(=O)CCBr)CC3)CC2)C1	1834423373	RCTXBKVNOMBPSL-MRXNPFEDSA-N	443.430	1.685	50	20	IDGD	
Cc1noc(C)c1CC(=O)N1CCOC[C@]2(CN(C(=O)CCBr)CCO2)C1	1834819810	XKAACWSFXBTDKF-SFHVURJKSA-N	444.326	1.075	50	20	IDGD	
O=C(Cc1cnc[nH]1)NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1835063746	PBOFCTKUBUNKRD-MRXNPFEDSA-N	430.322	1.214	50	20	IDGD	
CC(=O)N(C)[C@@H](C)C(=O)NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1	1835123553	ACXSUFKMQQDYHO-LRDDRELGSA-N	449.365	1.115	50	20	IDGD	
C=C[C@H](O)C(C)(C)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)Br)CC2)CC1	1835717581	FDVSADCRIMNHHC-PBHICJAKSA-N	444.414	1.915	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC(OC2CCN(C(=O)[C@@H]3CNC(=O)C3)CC2)CC1	1836673595	HXICQZVTKVAIPQ-KBPBESRZSA-N	444.370	1.152	50	20	IDGD	
CC(=O)NC(C)(C)C(=O)N1CCC(OC2CCN(C(=O)CO[Si](C)(C)C)CC2)CC1	1836878272	DHUATRHLAIVBES-UHFFFAOYSA-N	441.645	1.751	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccc(C#N)cc3)C2)C1	1837709287	WZNBDRHZIAPMLT-QFIPXVFZSA-N	445.592	1.409	50	20	IDGD	
NC(=O)c1ccccc1C(=O)N1CCC(OC2CCN(C(=O)[C@H](F)Cl)CC2)CC1	1838084197	PCCGQGPYPZWSFA-KRWDZBQOSA-N	425.888	1.932	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ncccc3F)CCO2)C1	1838251657	GBOLFZPZEVRNBZ-SCLBCKFNSA-N	444.301	1.464	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1838427724	FACWPFCSYORFTI-MLGOLLRUSA-N	448.333	1.366	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccccc3O)C2)C1	1839151532	VQHYLBRJXFURQZ-MOPGFXCFSA-N	431.316	1.699	50	20	IDGD	
N#Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)c(Cl)c1	1839423477	DGUFELOBTUJGLC-MAUKXSAKSA-N	430.263	1.816	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccnc4ncccc34)CCO2)C1	1839542625	ADSKEWJJHAZXJC-DYESRHJHSA-N	432.908	1.717	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3=CCCS3)C2)C1	1839963043	YEJGEXYXGGBJTH-GUYCJALGSA-N	433.368	1.637	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3(C(F)(F)F)CCC3)C2)C1	1840152072	WJPMDLWLYBSIBB-CJNGLKHVSA-N	442.862	1.429	50	20	IDGD	
C[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1)c1ccccn1	1840503524	CSJKTRCUKREIQC-JCKWVBRZSA-N	444.301	1.332	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(F)ccc3OC)CCO2)C1	1840689499	MGBKHKCLCVDVGE-OXJNMPFZSA-N	428.888	1.922	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@H]2CC(=O)CN2C(=O)OC(C)(C)C)C1	1841433898	CNAOWDAXXMEMRU-CABCVRRESA-N	443.928	1.022	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)[C@@H]2[C@H]3Sc4ccccc4[C@H]32)C1	1844272206	BQOQUOFRJTZTQD-FHWLQOOXSA-N	449.536	1.390	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCCC12CN(C(=O)C1CCN(S(C)(=O)=O)CC1)C2	1845170839	RBLJLNQRMYHRQV-INIZCTEOSA-N	440.393	1.098	50	20	IDGD	
O=C([C@@H]1ON=C(c2ccccc2)O1)N1CC2(CCCN2C(=O)[C@H](F)Br)C1	1845218118	NFGVOJJVHNBYTR-LRDDRELGSA-N	426.242	1.615	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCCC12CN(C(=O)[C@H](C)NC(=O)c1ccccn1)C2	1846071996	AHSDJMJYTPGNLV-KBPBESRZSA-N	437.338	1.577	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC12CN(C(=O)C[C@H](O)CNC(=O)OC(C)(C)C)C2	1846178450	YELSNTJRFNQLGT-OLZOCXBDSA-N	448.358	1.249	50	20	IDGD	
CCN1CCN(c2ccc(C(=O)N3CC4(CCCN4C(=O)[C@H](Cl)COC)C3)cc2)CC1	1846365331	OAGMKDNYPGFTEY-HXUWFJFHSA-N	448.995	1.899	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(S(=O)(=O)C(F)F)cc2)cc1	9788284	VZNAIHWELXIGBH-UHFFFAOYSA-N	426.397	1.609	50	20	IDGD	
COc1ccc(C(=O)C2CCN(CC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)CC2)cc1	14325528	XVTPAAKRTAKEFY-UHFFFAOYSA-N	440.456	1.959	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)Nc3ccc(F)cc3F)nc2)CC1	16500606	GDWUSFAOUCTRFQ-UHFFFAOYSA-N	426.449	1.445	50	20	IDGD	
CSc1nc2nc(C)c(CC(=O)OCC(=O)NNC(=O)c3ccccc3)c(C)n2n1	19614645	UEQURCXTLREKAH-UHFFFAOYSA-N	428.474	1.010	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)[C@H]1CS[C@]2(C)CCC(=O)N12	21957794	OQCNQOWNBLABKX-KZULUSFZSA-N	441.893	1.107	50	20	IDGD	
CCCn1c(C)cc(/C=C(/C#N)C(=O)N2CCN(C(=O)CN3CCOCC3)CC2)c1C	105484686	GGADKBJMCIQSPC-QNGOZBTKSA-N	427.549	1.425	50	20	IDGD	
Cc1ccc([C@H](CNC(=O)NNC(=O)CNC(=O)c2cccs2)N2CCOCC2)cc1	726102426	LMJNGWFJHOCGQB-KRWDZBQOSA-N	445.545	1.190	50	20	IDGD	
Cc1nn(Cc2ccc(Cl)cc2)c(Cl)c1C=NNC(=O)[C@H](C)NS(C)(=O)=O	728436464	GJNYBIBGQOTLIH-NSHDSACASA-N	432.333	1.934	50	20	IDGD	
CN1CCN(c2ccc(CNC(=O)NNC(=O)c3cccc(OC(F)F)c3)cn2)CC1	728595465	HCJFLMNTJDIHTD-UHFFFAOYSA-N	434.447	1.579	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@@H]2CSCN2C(=O)CC(C)(C)C)c2ccccc2c1=O	730072937	IKZCKMHNZXGRQN-HNNXBMFYSA-N	445.545	1.515	50	20	IDGD	
CN1CCN(Cc2ccc(CNC(=O)NNC(=O)COc3ccccc3O)cc2)CC1	730821990	BTVOMZVHKBNZOA-UHFFFAOYSA-N	427.505	1.049	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)NCc1ccc(S(=O)(=O)N2CCCC2)cc1	731499474	XIJBABOADOIRDV-UHFFFAOYSA-N	432.502	1.624	50	20	IDGD	
CCn1c(NNC(=O)COc2cc([N+](=O)[O-])c(C=O)cc2OC)nc2ccccc2c1=O	731602610	MHEKSEWWYDCXJI-UHFFFAOYSA-N	441.400	1.668	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CNC(=O)OCC(F)(F)F)cc1Br	732176953	YCVVZYRWAZNUTK-UHFFFAOYSA-N	428.161	1.507	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2cc(F)ccc2I)C[C@H](C)O1	732262132	JGSZBESZADRGIF-QWRGUYRKSA-N	449.264	1.691	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CCN2C[C@@H](C)O[C@H](C)C2)ccc1OCc1cscn1	732264002	QSDOUDAMEDMWLN-HUUCEWRRSA-N	448.545	1.991	50	20	IDGD	
O=C(NCCN/C(O)=C1\N=CC=CC1=O)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1	732466048	JXDJSLIXXFDPFB-BUHFOSPRSA-N	447.395	1.133	50	20	IDGD	
C[C@@H](c1nc(-c2cccs2)no1)N1CCN(CC(=O)NNC(=O)c2ccccc2)CC1	732984438	UMPOXSAPTCTUOP-HNNXBMFYSA-N	440.529	1.938	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)[C@H]1CCN(c2ccc(Cl)cc2)C1=O	734241737	TVTNZPDLHJZNDO-CQSZACIVSA-N	439.900	1.548	50	20	IDGD	
CN(C)[C@H](CNC(=O)NNC(=O)c1nnc(O)c2ccccc12)c1c(F)cccc1F	734676128	SHTNPAZWORFYDM-OAHLLOKOSA-N	430.415	1.861	50	20	IDGD	
N#Cc1cccc(C(=O)NNS(=O)(=O)c2cc3c(cc2Br)CCC(=O)N3)c1	734807616	XKTIUFGDZQUCEK-UHFFFAOYSA-N	449.286	1.829	50	20	IDGD	
Cc1ccc(SCC(=O)NNc2ncccc2S(=O)(=O)N2CCN(C)CC2)cc1	735116665	BJRPOJKXMBWLDF-UHFFFAOYSA-N	435.575	1.562	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2cc(-c3cccs3)on2)CC1	735116755	DPMFSIYYYMDMMA-UHFFFAOYSA-N	448.530	1.491	50	20	IDGD	
C[C@H](CN1CCN(c2ccccn2)CC1)NC(=O)NNC(=O)c1ccc2ccccc2n1	735520024	XVQNZOMXPUNNOX-QGZVFWFLSA-N	433.516	1.785	50	20	IDGD	
CC(C)Nc1ncccc1C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	735840663	LQCSRKOHMLBQCS-UHFFFAOYSA-N	431.518	1.761	50	20	IDGD	
COCCN1CC[C@H](NC(=O)NNC(=O)COc2ccccc2Cc2ccccc2)C1	739036970	XIAQGORCMQSHIH-FQEVSTJZSA-N	426.517	1.707	50	20	IDGD	
O=C(Cc1ccc(S(=O)(=O)C(F)F)cc1)NNC(=O)c1cnn(-c2ccccc2)c1	740660873	HHPIPFFYBUYXMM-UHFFFAOYSA-N	434.424	1.872	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cccc3ccc(C)nc23)cc1	741206901	GMYAURVOYCANRG-UHFFFAOYSA-N	426.498	1.933	50	20	IDGD	
COc1cc(OC)c(NC(=O)NN=Cc2nc3c(c(O)nc(=O)n3C)n2C)cc1Cl	741772093	OIHJXKWWUHAOGE-UHFFFAOYSA-N	435.828	1.199	50	20	IDGD	
CCC(CC)[C@@H](C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)N1CCOCC1	742034076	XEKBTSLKIKORIX-QHCPKHFHSA-N	445.608	1.483	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)c2cccc(Br)c2)cc1C(N)=O	743263626	IHBCMWBHTWINFY-UHFFFAOYSA-N	428.264	1.180	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)cc1	744563342	BBFRIVKSNOYFAN-UHFFFAOYSA-N	437.412	1.685	50	20	IDGD	
O=C(NNc1ccccc1S(=O)(=O)N1CCOCC1)c1cnn(-c2ccccc2F)c1	744621750	PFFOAEDLYIEPKB-UHFFFAOYSA-N	445.476	1.789	50	20	IDGD	
O=C(CCCn1cccn1)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	745491827	QHSIWBKRWXGBFC-UHFFFAOYSA-N	430.472	1.826	50	20	IDGD	
CCOc1ccc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)c3ccnn3C)cc2)cc1	745492219	URLCXSSRWDQISH-UHFFFAOYSA-N	443.485	1.694	50	20	IDGD	
CN(C)C(=O)C[C@H](NC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)c1ccccc1	745771437	AJFBCXGZXURGLO-KRWDZBQOSA-N	447.517	1.645	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@H](C)C(=O)NNC(=O)CCN/C(O)=C1\N=CC=CC1=O	746098627	WJMZWYJXWYYVDN-HZDTVXMRSA-N	434.880	1.788	50	20	IDGD	
CC[C@H](Nc1c([N+](=O)[O-])c(C)nn1C)C(=O)NNC(=O)c1cnn(-c2ccccc2)c1	746258387	CKCZSUYROYYIJB-HNNXBMFYSA-N	426.437	1.474	50	20	IDGD	
COc1cc(OC)cc(C(=O)N2CCC(C(=O)NNc3nc(C)cc(OC)n3)CC2)c1	746626068	UFDCNQZZSQSZNN-UHFFFAOYSA-N	429.477	1.806	50	20	IDGD	
Cc1nn(-c2ccccc2)c(C)c1CC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	747475156	OEUZTEYCAAXGIQ-UHFFFAOYSA-N	430.468	1.740	50	20	IDGD	
COC(=O)c1ccc(S(=O)(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)c(C)c1	747697669	ITHOJUAVIZTWAM-UHFFFAOYSA-N	438.458	1.431	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1)N[C@@H]1CCS(=O)(=O)C1	747979942	NPEVFDQJSIOECW-WOJBJXKFSA-N	442.541	1.131	50	20	IDGD	
Cc1ccccc1NS(=O)(=O)c1ccc(C(=O)NNC(=O)C(=O)N2CCCC2)cc1	748246645	NDJNHJNCWLAZEO-UHFFFAOYSA-N	430.486	1.179	50	20	IDGD	
O=C(NNc1ccc(OCC(F)(F)F)cc1)[C@H]1CC(=O)N(CCN2CCOCC2)C1	748705045	WJLSXICKVFEGLM-AWEZNQCLSA-N	430.427	1.252	50	20	IDGD	
CC(C)C[C@@H](/N=C1/NS(=O)(=O)c2ccccc21)C(=O)NNC(=O)CCc1ccccc1	749851861	MLJNSRYPLGYAGW-GOSISDBHSA-N	442.541	1.920	50	20	IDGD	
O=C(COC(=O)c1cccc(Cl)c1[N+](=O)[O-])NNC(=O)[C@H]1COc2ccccc2O1	750533288	PXJYOYPTNRSULX-CQSZACIVSA-N	435.776	1.392	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2nccn2CCc2ccccc2)c1	751611992	MFLDILMKQUOUPK-UHFFFAOYSA-N	441.513	1.674	50	20	IDGD	
CC[C@@H](NC(=O)NNC(=O)c1ccc(Br)cc1Cl)C(=O)N1CCOCC1	753055309	CXPZFDZMWINCCG-CYBMUJFWSA-N	447.717	1.684	50	20	IDGD	
Cn1cnc2cc(C(=O)NNC(=O)CN3CCN(Cc4ccc(Cl)cc4)CC3)ccc21	753655460	IFGSTMWFHQFBTC-UHFFFAOYSA-N	440.935	1.806	50	20	IDGD	
CCn1c(=O)nc(O)c2c(C(=O)NNc3ccc(C(F)(F)F)nn3)cc(C3CC3)nc21	755189566	RTCWAUZDBSXGBB-UHFFFAOYSA-N	435.366	1.960	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)Cc1ccc([N+](=O)[O-])cc1Br	755369938	QUPHLXPHWSDLTQ-UHFFFAOYSA-N	432.234	1.938	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)Nc2ccc3c(c2)CCC(=O)N3C)c2ccccc2c1=O	756415983	DTMBJRFDBIARKG-UHFFFAOYSA-N	434.456	1.792	50	20	IDGD	
Cc1cc(NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)ccc1C(=O)NC(C)C	756483833	SFGPJESJEOJJGH-UHFFFAOYSA-N	436.472	1.847	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)Nc2cc(C(N)=O)ccc2CN(C)C)cc1	756827143	PCWHSWAAISCTAI-CQSZACIVSA-N	441.488	1.670	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)Nc1cc(Br)c(=O)n(C)c1	757688683	DZYSQWDWXAZRFN-UHFFFAOYSA-N	439.266	1.778	50	20	IDGD	
CNS(=O)(=O)c1ccc(-c2ccc(C=NNC(=O)C(=O)Nc3ccccn3)o2)cc1	758391117	VVWJNLZDBOONQN-UHFFFAOYSA-N	427.442	1.339	50	20	IDGD	
O=C(NCc1ccc(-n2ccc(C(F)(F)F)n2)cc1)NNC(=O)C(=O)Nc1ccccn1	758720975	PCMUHNFXTXOVSU-UHFFFAOYSA-N	447.377	1.755	50	20	IDGD	
CCc1ccc(C(=O)NNc2ncccc2[N+](=O)[O-])cc1S(=O)(=O)N1CCOCC1	759300384	CCHSQRMOXKVSLH-UHFFFAOYSA-N	435.462	1.330	50	20	IDGD	
CCNS(=O)(=O)c1ccc(CC(=O)NNC(=O)c2cc(C)nc3ccccc23)cc1	759355917	QEXPWYNQMPMUTA-UHFFFAOYSA-N	426.498	1.845	50	20	IDGD	
O=C(NNC(=O)c1cnn(-c2ccccc2)c1)C(=O)Nc1ccnn1Cc1ccc(F)cc1	760292569	WZBAXDHFMOFWCH-UHFFFAOYSA-N	447.430	1.656	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)CN1C(=O)COc2ccc([N+](=O)[O-])cc21	761625435	JEJYIXZGDQGSIZ-UHFFFAOYSA-N	446.441	1.269	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1)c1nnc(O)c2ccccc12	763125201	MFOJHEJZHRAVBG-KRWDZBQOSA-N	435.440	1.898	50	20	IDGD	
O=C(NNC(=O)c1ccccn1)C(=O)Nc1ccnn1Cc1ccc(OC(F)(F)F)cc1	763466170	HGNDGAZDHXAVQM-UHFFFAOYSA-N	448.361	1.625	50	20	IDGD	
COC(=O)NCc1ccc(NC(=O)C(=O)NNC(=O)c2ccccc2Br)cc1	763482927	OIFCSSXBMSNCRE-UHFFFAOYSA-N	449.261	1.705	50	20	IDGD	
COC(=O)CCCOc1ccc(NC(=O)C(=O)NNC(=O)c2c[nH]c3ccccc23)cc1	763535095	OVMXJTAIHCLDBE-UHFFFAOYSA-N	438.440	1.900	50	20	IDGD	
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)Nc1ccc(F)cc1OCC1CC1	763570798	IABUNIROZYXNBR-SFHVURJKSA-N	429.404	1.540	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)C(=O)Nc2cccc(-c3nccc(C)n3)c2)c1	763774880	IJDMBZWQPBXFKA-UHFFFAOYSA-N	435.440	1.869	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)C(=O)Nc1cc(F)c(F)cc1Cl	763803762	NNFBKEZZCDJINV-UHFFFAOYSA-N	428.735	1.691	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(C(C)=O)cc2)cc1[N+](=O)[O-]	763879601	ZMPLYPLRTBXRAH-LBPRGKRZSA-N	444.400	1.359	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)C(=O)Nc1cccc(OC2CCCC2)c1	763920649	BFENPNPJILQXBQ-UHFFFAOYSA-N	435.444	1.383	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1cccc([C@@H](C)N2CCOCC2)c1	764042351	HMOBCJWKTABMAN-OAHLLOKOSA-N	426.473	1.488	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)nc1)C(=O)Nc1ncn(Cc2ccc(Cl)cc2)n1	764099381	SKPLRUFWNOZBIT-UHFFFAOYSA-N	434.243	1.428	50	20	IDGD	
CC(C)S(=O)(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)c1	764170143	ZOOSUJBJUOGOLL-SFHVURJKSA-N	445.497	1.099	50	20	IDGD	
CC(C)S(=O)(=O)c1ccccc1NC(=O)C(=O)NNC(=O)CCCc1ccccc1	764226477	MREVIGJYGCSIDW-UHFFFAOYSA-N	431.514	1.978	50	20	IDGD	
CCOc1cc(NC(=O)C(=O)NNC(=O)Cc2ccccn2)c([N+](=O)[O-])cc1OCC	764267310	SHUVQUCHMCERDR-UHFFFAOYSA-N	431.405	1.116	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)Cc2ccccn2)cc(OC)c1Br	764270448	NKUKKIGWLOPAOZ-UHFFFAOYSA-N	437.250	1.190	50	20	IDGD	
CC(C)Oc1ncccc1NC(=O)C(=O)NNC(=O)c1cc(Br)ccc1O	764280654	RBKNFAJCGZIKAJ-UHFFFAOYSA-N	437.250	1.737	50	20	IDGD	
CCN(CC)C(=O)COc1cccc(NC(=O)C(=O)NNC(=O)Cc2ccccc2F)c1	764319117	KHVTUQBJFWCBSL-UHFFFAOYSA-N	444.463	1.402	50	20	IDGD	
CC[C@@H](C(=O)NNC(=O)C(=O)Nc1ccc(N2C(=O)CCC2=O)c(C)c1)c1ccccc1	764328165	BQKMJURVASZDFP-QGZVFWFLSA-N	436.468	1.928	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)[C@H](C)NS(=O)(=O)c2cccc(C#N)c2)cc1OC	764572242	LZLVKHUNQDGWBB-ZDUSSCGKSA-N	446.485	1.094	50	20	IDGD	
CC(C)c1ccc(S(=O)(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cc1	765117210	CJUFRZHSARLQAM-UHFFFAOYSA-N	444.557	1.578	50	20	IDGD	
O=C(CCCCN1CCCC1)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	766664841	VXSMJSACXFRYQX-UHFFFAOYSA-N	436.000	1.871	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)NCc1cc2cc(Br)ccc2[nH]1	767316463	CKCYRJMGUBTOOX-UHFFFAOYSA-N	434.250	1.784	50	20	IDGD	
CC(C)c1cc(NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)n(-c2ncccn2)n1	768238540	CCLOMAQZVXXDCG-UHFFFAOYSA-N	446.471	1.527	50	20	IDGD	
COCCOc1ccccc1N1CCN(CC(=O)NNC(=O)c2cccc(Cl)c2)CC1	768550590	BUCWRGABWRRMAT-UHFFFAOYSA-N	446.935	1.948	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)c1cc(C(N)=O)n(-c2ccccc2)n1	768636633	WBFOKWXPVTXKRE-UHFFFAOYSA-N	429.458	1.140	50	20	IDGD	
Cc1nc(-c2ccccn2)nc(NNC(=O)c2cccc([C@@]3(C)NC(=O)NC3=O)c2)c1C	769098226	SVZWRMGUSOMHII-JOCHJYFZSA-N	431.456	1.967	50	20	IDGD	
CSCCNC(=S)NNC(=O)[C@@H]1CC(=O)N(Cc2cccc(C(F)(F)F)c2)C1	769778865	PEMIJEWKPIBHIT-GFCCVEGCSA-N	434.509	1.912	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)NCc1ccc(Br)cc1N1CCOCC1	770417951	QNHORRFVLZJENX-UHFFFAOYSA-N	448.321	1.754	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)C1CCN(S(=O)(=O)/C=C/c2ccccc2)CC1	771930765	BUNVOQUZRTUIHC-ATGUSINASA-N	437.518	1.188	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)[C@H]1CC(=O)N(c2ccc(Br)c(C)c2)C1	771995312	QWLHFKSLZJWKHP-RYUDHWBXSA-N	440.294	1.600	50	20	IDGD	
CC(C)(C)n1ncc2c(O)nc(NNC(=O)Cc3ccnc(O)c3Br)nc21	772267073	NDUJLMMSPWZTAN-UHFFFAOYSA-N	436.270	1.836	50	20	IDGD	
CC(C)(C)OC(=O)N1CCSC[C@@H]1CC(=O)OCC(=O)NNC(=O)c1cccs1	772287105	OUPQWSZIQWTZFD-LBPRGKRZSA-N	443.547	1.795	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)C2(C)CCN(Cc3ccccc3)CC2)n1	772711456	NTRCNQUIZSLZDT-UHFFFAOYSA-N	444.557	1.987	50	20	IDGD	
COc1ccc(S(N)(=O)=O)cc1C(=O)NNC(=O)[C@H](C)Oc1cccc(Cl)c1	772953822	JIJPYPHUMNYRRY-JTQLQIEISA-N	427.866	1.225	50	20	IDGD	
Cc1cnc(N)c(S(=O)(=O)NNC(=O)c2nc(Cl)c(Cl)c(N)c2Cl)c1	773227553	VWJSDYARZHADIJ-UHFFFAOYSA-N	425.685	1.533	50	20	IDGD	
Cc1cc(S(=O)(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)ccc1OCC(=O)O	773264549	KZFIIKKBXMHAMP-GFCCVEGCSA-N	442.877	1.889	50	20	IDGD	
O=C(NNC(=O)[C@@H]1Cc2ccccc2O1)C(=O)Nc1ccc2c(c1)CCC(=O)N2CC1CC1	773497603	YVJRIGNPVCSQNY-FQEVSTJZSA-N	448.479	1.465	50	20	IDGD	
O=C(NNc1c(F)cccc1F)C(=O)Nc1cccc(S(=O)(=O)NC2=NCCC2)c1	773717984	HHMILXQGNUAVQV-UHFFFAOYSA-N	437.428	1.517	50	20	IDGD	
Nc1ccc(C(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)nc1Br	775091280	YFOAKANHPMXKCF-UHFFFAOYSA-N	427.642	1.698	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)[C@@H]2C[C@@H](O)CN2C(=O)OCc2ccccc2)c1	776533770	KBWCNMQFCVYHMI-AEFFLSMTSA-N	433.486	1.305	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNS(=O)(=O)c1cc(Cl)ccc1OC[C@H]1CCOC1	777632835	MHEBTZBVDDJZCZ-LBPRGKRZSA-N	447.941	1.370	50	20	IDGD	
CN(CC(=O)NNC(=O)c1ccccc1Cl)C[C@@]1(O)CCN(Cc2ccccc2)C1	778491340	UDGZFCKWBJEIRN-QFIPXVFZSA-N	430.936	1.670	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCOC[C@H]1CC(=O)c1ccco1	781929796	FIODBEPDTFGXPO-CQSZACIVSA-N	435.864	1.676	50	20	IDGD	
CCNC(=O)N(C)NS(=O)(=O)c1cc(S(=O)(=O)N(CC)CC)ccc1Cl	782478827	VKULSBVFAYDKOM-UHFFFAOYSA-N	426.948	1.225	50	20	IDGD	
CCCCc1ccc(NC(=O)C(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1	782897243	MLJZIIMGFUVDBA-UHFFFAOYSA-N	431.518	1.722	50	20	IDGD	
COc1ccc(S(=O)(=O)N2CCCCCC2)cc1NC(=O)C(=O)NN=c1cc[nH]cc1	783376234	KIXZRMIKPNTFAX-UHFFFAOYSA-N	447.517	1.159	50	20	IDGD	
CS(=O)(=O)c1cccc(NNC(=O)C(=O)Nc2ccc(OC[C@H]3CCCO3)cc2)c1	784839263	HNLGUUVFMJTQCS-QGZVFWFLSA-N	433.486	1.730	50	20	IDGD	
Cc1ccnc(-c2cccc(NC(=O)C(=O)NNc3cccc(S(C)(=O)=O)c3)c2)n1	784839600	MDWUXAUNNCXSKF-UHFFFAOYSA-N	425.470	1.937	50	20	IDGD	
CCC(CC)NC(=O)[C@@H]1CN(C(=O)C(=O)NNc2ccnc(F)c2)c2ccccc2O1	784847781	BWJFBWUXNUTJGI-KRWDZBQOSA-N	429.452	1.763	50	20	IDGD	
CCN(CC)c1ccnc(NNC(=O)C(=O)Nc2cccc(NC(=O)[C@H](C)OC)c2)n1	785231902	HYJKWJIHNZXSJG-ZDUSSCGKSA-N	429.481	1.378	50	20	IDGD	
C[C@@H]1CN(S(=O)(=O)c2ccc(NC(=O)COC(=O)/C(C#N)=C\C3CC3)cc2)C[C@@H](C)O1	786672255	ZWTJGDADCLJNDR-SCUCTCNRSA-N	447.513	1.826	50	20	IDGD	
Cn1ncc2c(O)nc(NNC(=O)N[C@H]3CCCN(Cc4ccc(F)cc4F)C3=O)nc21	786968860	SXUNBIIKQQBJIZ-AWEZNQCLSA-N	446.418	1.164	50	20	IDGD	
CCNC(=O)Nc1ccc(C)c(NC(=O)C(=O)NNC(=O)COc2ccc(OC)cc2)c1	787541417	ROXUXDDLGXHUOI-UHFFFAOYSA-N	443.460	1.310	50	20	IDGD	
O=C(NNC(=O)N1CCC(n2ccc([N+](=O)[O-])n2)CC1)c1cc(Br)c[nH]1	787736689	XBLFYBBXGSAZOK-UHFFFAOYSA-N	426.231	1.573	50	20	IDGD	
Cn1nc([C@H]2CCCO2)cc1NC(=O)C(=O)NNC(=O)c1c(Cl)cccc1Cl	789735514	QRPPSGISTOTACX-GFCCVEGCSA-N	426.260	1.978	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)CC(=O)N2C	789783692	YCLPQGODWABGRM-LLVKDONJSA-N	430.848	1.412	50	20	IDGD	
O=C1C[C@@H](Cc2ccc(NC(=O)C(=O)NNc3cccc(F)c3[N+](=O)[O-])cc2)C(=O)N1	790999145	YNRPGXWOGZXKTC-LLVKDONJSA-N	429.364	1.021	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2ccc3c(c2)N(CC(F)F)C(=O)CS3)n1	793030037	XAIJFBFITLWLPV-UHFFFAOYSA-N	438.416	1.271	50	20	IDGD	
O=C(CNC(=O)c1cccnc1)NNC(=O)c1cnnn1-c1c(Cl)cccc1Cl	795180664	CUSYWVZOMLFMHA-UHFFFAOYSA-N	434.243	1.160	50	20	IDGD	
Cn1cc(-c2cc(F)ccc2NC(=O)C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cn1	796991445	MIDFBUFEMXCXLV-UHFFFAOYSA-N	426.364	1.534	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)NCCN(C)S(=O)(=O)c1ccc(F)cc1	798098012	KWBJVBYFMRWCGH-UHFFFAOYSA-N	438.481	1.028	50	20	IDGD	
O=C(NCC(F)(F)F)NNC(=O)c1cc(S(=O)(=O)NCc2ccccc2)ccc1O	798314797	BDAGUDWHNLCTFD-UHFFFAOYSA-N	446.407	1.377	50	20	IDGD	
COc1ccc(C(=O)NNc2ccccc2S(=O)(=O)NC(C)(C)C)cc1OCCO	798335097	FUGLICLDKJQANQ-UHFFFAOYSA-N	437.518	1.900	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)NCc2ncnn2C(C)(C)C)c2ccccc2c1=O	800742650	ZBKROXZJOQMUCZ-UHFFFAOYSA-N	440.508	1.687	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2nn(-c3ccc(F)cc3C)cc2O)n1	801427008	JJKZTFMQKVJOAH-UHFFFAOYSA-N	447.448	1.337	50	20	IDGD	
C[C@@H]1NC(C(=O)NNC(=O)Nc2ccc(OC(F)F)cc2)=NN(c2ccccc2)C1=O	802045763	WPDOTCCYMJCBJC-NSHDSACASA-N	432.387	1.779	50	20	IDGD	
O=C(NNC(=O)c1c[nH]c2c(F)cc(F)cc2c1=O)c1csc(N2CCOCC2)n1	806337236	AYBGXYXLVWDWBI-UHFFFAOYSA-N	435.412	1.174	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)Nc1nc2c(Br)cccc2s1	806741037	PJLMJTMQKGGEDG-SSDOTTSWSA-N	433.309	1.646	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(NC(=O)C(=O)NNc2cccc(C(F)(F)F)n2)ccc1F	807016279	RDDSHLDVFDKCKE-UHFFFAOYSA-N	449.386	1.572	50	20	IDGD	
CCOC(=O)c1cc(F)c(F)cc1NC(=O)C(=O)NNc1ccc(-n2ccnc2)nn1	807428422	DFYHZVIQHBUSCN-UHFFFAOYSA-N	431.359	1.199	50	20	IDGD	
CN(NC(=O)Nc1cccc2c1OCC(=O)N2)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	810255799	QGEXJSJRPJXFEW-UHFFFAOYSA-N	448.480	1.659	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc3c2OCC(=O)N3)cc1OC	810386170	OVCYKUFOKVFNKD-UHFFFAOYSA-N	442.428	1.215	50	20	IDGD	
Cn1c(=NNC(=O)C(=O)Nc2cc(C(N)=O)ccc2OCC(F)F)sc2ccccc21	810392729	FVEMTLLIVUSVFD-UHFFFAOYSA-N	449.439	1.553	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@H]1CC[C@H](CNC(=O)NN[C@@]2(C)CCS(=O)(=O)C2)CC1	812437732	HAVQVOQCYVUCDO-DOXZYTNZSA-N	432.587	1.699	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)[C@@H]2CC(c3ccccc3[N+](=O)[O-])=NO2)cc1	812726936	ACOGWAJVKPGJBW-KRWDZBQOSA-N	433.446	1.481	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NN=Cc3c(C)nn(C)c3N)c2)cc1	814689660	XGJZKONOTJACHK-UHFFFAOYSA-N	442.501	1.884	50	20	IDGD	
CCCn1nc(C(=O)NN=Cc2ccc(Cl)c(S(N)(=O)=O)c2)c2ccccc2c1=O	814741276	UFWQEAYBPRLIMS-UHFFFAOYSA-N	447.904	1.871	50	20	IDGD	
Cn1c2c(ccc1=O)C(=NNC(=O)c1ccc(S(=O)(=O)N3CCCC3)cc1)CCC2	814741874	SIXGOWXHTNJMHF-UHFFFAOYSA-N	428.514	1.640	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NN=Cc1n[nH]cc1C)N(S(C)(=O)=O)CC2	814759226	VWIMKFNZVPRBIQ-MRXNPFEDSA-N	435.506	1.135	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)C(=O)Nc2cc(Cl)ccc2I)cn1	815569773	HIAULYRWYJEBPH-UHFFFAOYSA-N	447.620	1.078	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNc2cccnc2Cl)nnn1CCOc1ccc(F)cc1	815601030	LRDUPRNBWFFOEZ-UHFFFAOYSA-N	433.831	1.935	50	20	IDGD	
O=C(NNc1cccc(Cl)n1)C(=O)Nc1ccc(CC(=O)N2CCSCC2)cc1	815728875	YDGOCSPKTKVQEH-UHFFFAOYSA-N	433.921	1.935	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)[C@@H]2CCCS(=O)(=O)C2)cc(OCC)c1OCC	816814293	NEAHAIYUOSZQDJ-CYBMUJFWSA-N	428.507	1.469	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)[C@]2(c3ccccc3)CCC(=O)NC2)cc1	816818189	TVJMFOMJWBPXRF-QMHKHESXSA-N	425.485	1.848	50	20	IDGD	
O=C(CCn1cnc2ccc(Br)cc2c1=O)NNC(=O)CNc1ccccc1	818032506	QVSYVZFNKXQCKN-UHFFFAOYSA-N	444.289	1.809	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)N2CC(CN3CCN(C)CC3)C2)c(C)n1C[C@H]1CCCO1	820458388	DSBLSIQVVNYVOS-HIFDDZRDSA-N	425.577	1.897	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)c2cccc(N3C(=O)CCC3=O)c2)c2ccccc2c1=O	824474828	JPFVGLBYRPHHID-UHFFFAOYSA-N	447.451	1.706	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(Cl)cc1	825624073	DQXPVUBAYFGBDR-UHFFFAOYSA-N	440.909	1.229	50	20	IDGD	
CCNS(=O)(=O)c1ccc(C)c(C(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)c1	849196184	BTRMIYZBURXISJ-UHFFFAOYSA-N	432.502	1.310	50	20	IDGD	
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC(=NNC(=O)[C@H](C)Oc2ccccc2F)CC1	914559162	BAOYRCABHGUNDP-AWEZNQCLSA-N	437.497	1.890	50	20	IDGD	
O=C(CCS(=O)(=O)C1CCCC1)NNC(=O)COc1ccc(Br)cc1	915688599	RWYUCGFFTZRLRH-UHFFFAOYSA-N	433.324	1.723	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cnn(C)c2C(F)(F)F)c1	916096315	DZFQRWMKJAKHBS-UHFFFAOYSA-N	447.439	1.544	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@@H](C)CCc2ccc(O)cc2)cc1	916235316	LIASPYCBEJUWDY-INIZCTEOSA-N	448.545	1.673	50	20	IDGD	
CC(=O)Nc1cccc(CNC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)c1	916373483	FLSOIZUSMHSCNZ-UHFFFAOYSA-N	432.506	1.391	50	20	IDGD	
O=C(NCc1cccnc1OCC(F)(F)F)NNC(=O)[C@@H]1COc2ccccc2O1	916397008	BRXUMZRMQHDWAI-AWEZNQCLSA-N	426.351	1.693	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Cn2nnc(-c3ccc(C)cc3)n2)cc(OC)c1OC	916610092	GYABNVYKPIKTLA-UHFFFAOYSA-N	426.433	1.136	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)CCn2ccnc2)c1	917375270	RUNAFLYTTXLCCI-UHFFFAOYSA-N	443.485	1.544	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2F)c1	917392303	XIOYLHRQIFJCGP-UHFFFAOYSA-N	438.437	1.839	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNS(=O)(=O)c2cc(OC)c(OC)c(C(=O)O)c2)c1	917724533	VXDLOIZISKNWKU-UHFFFAOYSA-N	440.430	1.043	50	20	IDGD	
Cc1[nH]c(-c2ccncc2)nc(=O)c1CC(=O)NNC(=O)c1cc(-c2ccccc2)on1	917976957	VANXZSVTTFCXMN-UHFFFAOYSA-N	430.424	1.799	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)NCc2ccc(-n3cncn3)nc2)N(C)c2ccccc21	919843304	LACJRYMLGGJMAY-UHFFFAOYSA-N	442.483	1.949	50	20	IDGD	
O=C(NNC(=O)c1cc2ccccc2n1Cc1ccccc1F)N[C@H]1CCS(=O)(=O)C1	919884627	HEWUFGZUEKNIQY-INIZCTEOSA-N	444.488	1.960	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN(c2nc3ccccc3s2)C1)N[C@H]1CCS(=O)(=O)C1	919886653	SZMBTWKNYFRZBI-OLZOCXBDSA-N	437.547	1.030	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@H](C)C(=O)NN=Cc1nc2c(c(O)nc(=O)n2C)n1C	920364401	RHFIWSRUBLMUKQ-LLVKDONJSA-N	432.868	1.560	50	20	IDGD	
CS(=O)(=O)Nc1ccccc1CNC(=O)NNC(=O)c1cncn1-c1ccccc1	1115855200	BJUHMUCCWTYPFQ-UHFFFAOYSA-N	428.474	1.388	50	20	IDGD	
CS(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)c2ccc(Br)cc2)cc1	1248537625	FUGITABJKGCRGY-UHFFFAOYSA-N	433.305	1.476	50	20	IDGD	
Cc1nn(C)c(C)c1S(=O)(=O)N[C@H](C)C(=O)NNc1cncc(Br)c1	1335935374	SLCDWSLCAXBNRE-SECBINFHSA-N	431.316	1.005	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)c1ccc(S(=O)(=O)NC[C@@H](C)O)cc1	1338721950	VNQYBNMXFKIHHX-LLVKDONJSA-N	441.893	1.083	50	20	IDGD	
O=C(c1cccc2c1OCCO2)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1777835189	DOHBVKSWMMPZFK-CRAIPNDOSA-N	443.269	1.592	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)c1ccc(Cl)o1	1778409901	VBADZTYIKLZPQR-DYESRHJHSA-N	446.696	1.054	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@]2(C1)CN(C(=O)C(F)(F)C(F)(F)C(=O)O)CCO2	1779294418	RAHJXLRYGYFHOL-CQSZACIVSA-N	444.454	1.023	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cc(-n3ccnc3)ccn1)CCO2	1779299350	YIFPICNPXXIDKV-NRFANRHFSA-N	443.580	1.562	50	20	IDGD	
Cn1nc2c(c1C(=O)N1CC[C@H]3OCCC[C@@]3(CNC(=O)CO[Si](C)(C)C)C1)CCC2	1779546144	FFAXUCAYEBSXGC-XMSQKQJNSA-N	448.640	1.888	50	20	IDGD	
Cc1noc(N)c1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@](C)(Cl)CCl)C1	1780713487	VRYMUFPDIVBCKN-OCBCSQNSSA-N	433.336	1.929	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccccc3C(=O)OCCO)CCO2)C1	1781218441	PBLIEXCQQZEZTG-UTKZUKDTSA-N	438.908	1.297	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCc1nnc(C)s1)C2	1782171171	QFMHHWCPVYNSOF-QMTMVMCOSA-N	444.985	1.547	50	20	IDGD	
CCN(CC)C[C@@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](Cl)COC)C1	1782179549	JNUFLKGRMGDZQF-NEYJZJCJSA-N	432.005	1.732	50	20	IDGD	
CCN(CC)[C@H](C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2)c1ccccc1	1782813116	PCGWWHJCBYUNGH-CNNODRBYSA-N	437.968	1.499	50	20	IDGD	
C[C@H](CC(=O)N1CC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1)c1ccccc1	1783287420	VNGDAEJELJJXKL-JPYJTQIMSA-N	430.549	1.383	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cc4n(n3)CCCC4)CCO2)C1	1783349690	RFOFZEVTVPZKKQ-HNAYVOBHSA-N	439.354	1.836	50	20	IDGD	
CC(=O)Nc1cccc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](C)Br)C3)C2)n1	1783532987	VLKWEESYTZKNLM-SGTLLEGYSA-N	439.310	1.267	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(Br)cn3)CCO2)C1	1783877952	SFLRYYCTNHKBRF-SUMWQHHRSA-N	446.729	1.541	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CCCCN3C)C[C@@H]21	1783964518	WNXPBVDLJVTEBE-XAJHFOFHSA-N	430.387	1.481	50	20	IDGD	
C[C@H](C(=O)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1)n1cccn1	1788143559	NDPJNPSEVNVEDC-MRXNPFEDSA-N	432.289	1.572	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](OC(C)=O)C(C)C)[C@H]2C1	1788479647	LOBZBBJEGXPGLJ-ZOFXXKQRSA-N	447.370	1.727	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CC34CCCN3CCC4)[C@H]2C1	1789821038	HUOORKHWLHOMCC-FHWLQOOXSA-N	437.657	1.836	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3C[C@@H]3c3ccccc3)C[C@@H]21	1791293326	VOIYRUUBHVACHW-ZPAWYTMASA-N	442.560	1.143	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1cnc3ccccc3c1)C2)[C@H](O)CCl	1792975562	UUAMKBGFOYPFJW-SHJAMOMRSA-N	431.920	1.357	50	20	IDGD	
CC(C)(C)n1ncc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](O)CCl)c1Cl	1792976600	YIDGBYRDIKJQPE-ZMJPVWNMSA-N	433.336	1.094	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H](F)C[C@H]1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCl	1793112153	GOPMRNILQNSIPV-RDGWLKQMSA-N	447.935	1.572	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](O)CCl)C2	1794141272	DMIBRHITXBQXID-NDKCEZKHSA-N	438.352	1.356	50	20	IDGD	
COc1cccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)CBr)C3)n1	1794526482	WOFLEMAJVFRGHX-NFFDBFGFSA-N	426.311	1.324	50	20	IDGD	
CN(CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnc[nH]1)NC(=O)NCc1ccccc1	1795069467	YDEMNARPGKXOMD-BCDXTJNWSA-N	439.520	1.008	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nc3ccc(C(F)(F)F)cn3n1)C2)[C@@H](F)Cl	1796363412	RHGCXVAYDAQQTB-OTMMVIPVSA-N	449.792	1.486	50	20	IDGD	
C[C@H]1CCc2c(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)CCBr)C4)n[nH]c21	1796972418	ZDKNTBZFRGLWOM-OVZMXSCWSA-N	425.327	1.448	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C[C@H]1COc3ccccc3O1)C2	1797953989	ZYCHHMKGFOLJBC-GEYWLOKFSA-N	448.592	1.658	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2	1799124858	PNNVAAIFNDMBGS-JGTCGTHISA-N	438.297	1.991	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cn[nH]c1)C2	1799219638	AFYUDTJQPQUMJZ-QDMKHBRRSA-N	427.417	1.809	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C[C@@H](C)NC(=O)OC(C)(C)C)C2	1799269993	MNDGINGEMAXSRB-OWVAZHOYSA-N	431.961	1.897	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCCCn1cccc1)C2)[C@H](F)Br	1799349472	GSJUFISOWIZRNS-FSDCSDTHSA-N	430.318	1.939	50	20	IDGD	
Cc1ccn2c(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@H](C)Br)C4)cnc2c1	1800085762	JUMZOLJJICPCLJ-ZJOBFFGXSA-N	435.322	1.629	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3n(n1)CCCO3)C2	1800641632	GEGCUVPXRCNSQC-ZWUHOBOKSA-N	441.326	1.042	50	20	IDGD	
Cc1cccc2c(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)c3cnccc3C(=O)NN)C4)n[nH]c12	1801122283	DINBVFVVKFUWOZ-QDMKHBRRSA-N	447.499	1.435	50	20	IDGD	
C#CC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2	1802128920	VYUHAEJJNKMUJC-CRWXNKLISA-N	448.347	1.296	50	20	IDGD	
COc1ccc(CCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CCC(=O)NN(C)C)c(F)c1	1802336603	PELNAKPRQIUPSP-BCDXTJNWSA-N	448.539	1.778	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cnc3[nH]ncc3c2)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803143122	UTBVDCOWBLXWBY-RRQGHBQHSA-N	428.880	1.272	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)C1=CCCS1	1803634869	UHWJMZIXMSEFSW-YLJYHZDGSA-N	437.330	1.102	50	20	IDGD	
CCC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1	1803690846	UKKXPUWTQXNUKC-YSIASYRMSA-N	443.740	1.489	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1ccsc1	1805419008	BDPDBYITYPTUPJ-XLIONFOSSA-N	435.314	1.456	50	20	IDGD	
CCOC(=O)/C=C/C(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)Br)[C@@H]1c1cccnc1	1806299301	LCIBZGCNKSTPKJ-CLYUILODSA-N	438.322	1.990	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)COCCOC)[C@@H]1c1cccnc1	1806762998	XTWKWOWBSQCWJL-BQFCYCMXSA-N	442.354	1.924	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CN2CCCC2=O)[C@H]1c1cccnc1)[C@@H](F)Br	1808661981	UDEHRBRTCCWYLD-RRQGHBQHSA-N	441.301	1.400	50	20	IDGD	
Cc1ocnc1C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1	1810302618	LLYNFOGCTTXHEI-DNVCBOLYSA-N	449.471	1.010	50	20	IDGD	
Cc1cnoc1C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1	1810302889	NWICXSIUUBBXPS-YJBOKZPZSA-N	449.471	1.010	50	20	IDGD	
CC(=O)N(C)CCC(=O)N1CC[C@@H](CNC(=O)CO[Si](C)(C)C)[C@@H]1c1cccnc1	1810539834	JJMCMIWSIXMOIG-RXVVDRJESA-N	434.613	1.807	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)[C@H]2CCC(=O)NC2)[C@@H]1c1cccnc1	1812862708	CSYQMDZZLXNMRZ-NZUILWFCSA-N	437.338	1.397	50	20	IDGD	
CC(C)(CCl)C(=O)N[C@@H]1CCc2nc(NC(=O)CNCP(=O)(O)O)sc2C1	1814763365	URTJLBWIZFECEL-SECBINFHSA-N	438.874	1.045	50	20	IDGD	
COC(=O)[C@H]1CC[C@H](C(=O)N2CCCC[C@H]2c2cc(NC(=O)[C@@H](O)CCl)n[nH]2)CC1	1814866984	BQKPKRBYLBLMFQ-SDADXPQNSA-N	440.928	1.981	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cnn(-c3cccnc3)c2)[nH]n1)[C@@H](O)CCl	1814869482	QJNSBTBUUJBGSI-SJORKVTESA-N	443.895	1.896	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cnc3c(c2)CCNCC3)[nH]n1)[C@H](O)CCl	1814874752	CUWYXBCEAJOLAA-ZWKOTPCHSA-N	446.939	1.399	50	20	IDGD	
N[C@H](C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCBr)CC2)c1ccccn1	1815011781	HXWMHVVKQIHLIH-BONVTDFDSA-N	438.351	1.935	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1	1815349953	AFUARPSTSSVWLZ-UONOGXRCSA-N	435.742	1.456	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1CCc2nc(NC(=O)Cn3cccn3)sc2C1	1815707245	ZOQHHCYNHARWCL-GHMZBOCLSA-N	426.340	1.983	50	20	IDGD	
CC(C)Cc1cc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@@H](O)CCl)CC3)n(C)n1	1815992826	GNJSCAQRXOXQCV-ABAIWWIYSA-N	439.969	1.901	50	20	IDGD	
COc1cccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)n1	1816269044	UJOOGOMHZLEHDV-GOSISDBHSA-N	449.276	1.113	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1nccs1	1816568953	UUNSAGLUYKTMLM-OAHLLOKOSA-N	425.279	1.166	50	20	IDGD	
O=C(CN1CCOCC1)Nc1cc([C@@H]2CCCCN2C(=O)CCBr)[nH]n1	1817146397	XPWJVMCUQIRSNP-AWEZNQCLSA-N	428.331	1.519	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](N)Cc3cccnc3)sc2C1	1817188330	TXLFIQCVSVCEBT-GJZGRUSLSA-N	447.637	1.872	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ncccc2F)[nH]n1)c1ccc(B(O)O)cc1	1817472167	MHGLQSUNJYRLPZ-QGZVFWFLSA-N	437.240	1.243	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](C)Br)[nH]n1	1817996419	PVTAMFKVFCFTIB-JBLDHEPKSA-N	429.319	1.632	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@H]1CCc2nc(NC(=O)CCc3nc(N)n[nH]3)sc2C1	1819560220	UZHJCGJTWVVXIV-PWJLMRLQSA-N	446.364	1.625	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)C13CC(F)(C1)C3)CC2	1819794053	XCWRNNPSNLBBLV-HQMIKDGFSA-N	444.492	1.260	50	20	IDGD	
CN1CCC(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)CC1	1822412004	HWGOJOBZVYYBBX-QGZVFWFLSA-N	433.557	1.117	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](F)Br)[nH]n1	1822415534	LHYANGKTRAYTBK-NHYWBVRUSA-N	447.309	1.465	50	20	IDGD	
O=C(CCn1ccnn1)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](F)Br)[nH]n1	1822809735	PVHILUBHSKQKST-SMDDNHRTSA-N	428.266	1.774	50	20	IDGD	
CC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(=O)nc3cccnn13)CC2	1822850138	PETRMNFXTFVAQK-MNOVXSKESA-N	446.920	1.789	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H]3CCC(=O)N3C)sc2C1	1823054514	KGQKTMAFXZXENG-NHCYSSNCSA-N	443.367	1.849	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnnn1C)CC2	1825440798	FJDDAJHFLKUYQF-IUCAKERBSA-N	427.328	1.671	50	20	IDGD	
CC[S@](=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](C)Br)sc2C1	1825643054	XSCPBHCPHBLTDY-IGSRQBSMSA-N	436.397	1.997	50	20	IDGD	
Cc1cc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)n(C)n1	1825926554	CGXVELOIGCPEFS-SFHVURJKSA-N	432.569	1.335	50	20	IDGD	
O=C([C@H](F)Br)N1CCC([C@@H]2CCCCN2C(=O)CN2CCOCC2)CC1	1826718653	INXJRTGPRBEWKA-RDJZCZTQSA-N	434.350	1.629	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCC([C@H]2CCCCN2C(=O)C[C@H](NC)C(=O)O)CC1	1826947268	CSQVNAOFARKNSQ-HRCADAONSA-N	446.386	1.842	50	20	IDGD	
Cc1cc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)on1	1827055678	CFSBUJBJYVTKKR-IBGZPJMESA-N	425.294	1.210	50	20	IDGD	
Cn1cc2cc(C(=O)N3CCOC[C@]4(C3)CN(C(=O)C(C)(C)CCl)CCO4)ccc2n1	1830365724	GEGISUAMFLEFQV-QFIPXVFZSA-N	448.951	1.908	50	20	IDGD	
Cc1ccc(SCC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)cc1	1830731469	LRNPRRKQBDYDNY-XLIONFOSSA-N	442.965	1.143	50	20	IDGD	
C=C(C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1)C(F)(F)F	1831450871	HNYLBCBSTKRPIW-GOSISDBHSA-N	438.255	1.718	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccn4ccnc4c3)C2)C1	1831652316	YSWCUCVIRODRIP-DYESRHJHSA-N	434.924	1.812	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cn(C(C)(C)C)nn3)C2)C1	1831654379	KOCRQQQSHVCTSM-YWZLYKJASA-N	441.960	1.511	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(F)nc2)CC1	1831873547	NYDJNNDBCWJZRM-GOSISDBHSA-N	433.528	1.827	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)C1CCC(CO)CC1)CCO2	1832521964	PQLOJGDGFBFYEW-NGICGMGXSA-N	442.629	1.093	50	20	IDGD	
C/C=C/C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2	1832551329	JLPFVZSSVZUNDU-XOUUHQBZSA-N	445.944	1.151	50	20	IDGD	
Cc1noc(C)c1CC(=O)N1CCO[C@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1	1832556515	BBFIMNGPSXHHHM-HXUWFJFHSA-N	439.585	1.142	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cc(O)ccc3F)CC2)CC1)[C@@H](O)CCl	1833313546	LGLUOGZHYULNTO-SFHVURJKSA-N	427.904	1.316	50	20	IDGD	
O=C(CCc1cnc[nH]1)NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1	1833788710	YMCWBOCOTUANGZ-QGZVFWFLSA-N	444.349	1.604	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)c1nc(Cl)ccc1F	1833899970	CVRSCQZXRFBLSW-HNNXBMFYSA-N	447.338	1.659	50	20	IDGD	
CC(=O)NC(C)(C)C(=O)N1CCC(N2CCC(NC(=O)CCBr)CC2)CC1	1834422524	SUIHBHRGUKBEJP-UHFFFAOYSA-N	445.402	1.258	50	20	IDGD	
Cc1c(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@](C)(Cl)CCl)C3)C2)cnn1C	1834426423	XVUDRCQTAGDQET-QZTJIDSGSA-N	433.336	1.035	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3csc(C)c3C)CCO2)C1	1834541395	KVJMFPGLKUPKGG-QFBILLFUSA-N	430.954	1.689	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccccc3)CCO2)C1	1834990889	TXRFEZVVEWCCOV-OXJNMPFZSA-N	439.350	1.717	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3cccc(F)c3)CCO2)C1	1835027543	APJHGAWNVLARAM-KUHUBIRLSA-N	443.313	1.608	50	20	IDGD	
C[C@H](Oc1cccnc1)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](F)Cl)CC2)CC1	1835082720	DGIWOLZAQDJVDW-KBXCAEBGSA-N	426.920	1.955	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cnc4ncccn34)CC2)CC1	1835387596	XFAFLCTUHVWAIR-QGZVFWFLSA-N	432.956	1.932	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CNc3ccc(F)cc3)CCO2)C1	1835583163	JQNFHYCBLVCRQC-FXAWDEMLSA-N	427.904	1.711	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3ccncc3O)CC2)CC1	1835877031	BEXDXNRYRMBTRG-ZDUSSCGKSA-N	439.354	1.756	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3ccc[nH]3)CCO2)C1	1836018137	XBVBUZSJRYKMDP-KDOFPFPSSA-N	428.327	1.187	50	20	IDGD	
CC[C@@H](Br)C(=O)NC1CCN(C2CCN(C(=O)Cn3cncn3)CC2)CC1	1836541949	OEKWBWHTYQHNMG-MRXNPFEDSA-N	441.374	1.023	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCC(OC2CCN(C(=O)[C@@H]3CNC(=O)O3)CC2)CC1	1836903145	VJNDFVBUENHRMJ-KSSFIOAISA-N	436.336	1.330	50	20	IDGD	
O=C(c1cccc(-c2cnccn2)c1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1838592228	XBUBOSXJZMJLOW-GHTZIAJQSA-N	448.882	1.748	50	20	IDGD	
Cc1ccn(C)c1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)Br)C2)C1	1838822089	AYSDBHIWEXJJAO-KSSFIOAISA-N	428.327	1.187	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(N(C)C)c3)CCO2)C1	1838925449	UQIPEOXZDOHQSI-GHTZIAJQSA-N	439.940	1.076	50	20	IDGD	
O=C(/C=C/c1ccsc1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839198400	ZFFFBUYFCBBCCV-PHQDNCEWSA-N	447.326	1.908	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccnc(F)c3)C2)C1	1840030115	ANBIABKJNQXUAG-SJKOYZFVSA-N	430.274	1.074	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnoc3C3CC3)C2)C1	1840032020	LJHFCFYRRWZRFD-XIKOKIGWSA-N	442.310	1.405	50	20	IDGD	
C=C(C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2)C(F)(F)F	1840034957	BJXQDBSOYGBTFR-RISCZKNCSA-N	429.233	1.345	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(OC)c(F)c3)C2)C1	1840149165	GOMLGHQPBHBWOV-QRWLVFNGSA-N	444.887	1.158	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3Cl)C2)C1	1840153584	UPMPTOYQOPKCNL-YJBOKZPZSA-N	432.304	1.059	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(F)c(C)cc3F)C2)C1	1840155934	GLXAECBYNPHVPS-FOIQADDNSA-N	446.878	1.597	50	20	IDGD	
C[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1)n1cccc1	1840353646	PCVIFUJFBBXMQG-ATZDWAIDSA-N	432.348	1.742	50	20	IDGD	
O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)CCCn1cccc1)CCO2	1840460191	AIDZSUVYXVMPBQ-IBGZPJMESA-N	442.354	1.510	50	20	IDGD	
O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1840898845	XGOGCIILXPFHSB-IBMJZYDUSA-N	441.843	1.599	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)CCc2cccc(C#N)c2)C1	1841259207	CIVNZVYKFZONGJ-WPWMEQJKSA-N	446.511	1.828	50	20	IDGD	
O=C(c1cc(Br)cc2cn[nH]c12)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1	1841350894	AFRHAIIHMJKKPO-CYBMUJFWSA-N	441.713	1.742	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)Cn2cccn2)C1	1843090617	KKCRFQGSIFLGAI-UHFFFAOYSA-N	427.417	1.234	50	20	IDGD	
CCn1nc(C(=O)N2CCCC23CN(C(=O)CCC(=O)NN(C)C)C3)c2ccccc21	1843184439	QCCUMAWFNJLZGB-UHFFFAOYSA-N	426.521	1.246	50	20	IDGD	
O=C1c2ccccc2CN1CCC(=O)N1CCCC12CN(C(=O)[C@@H](F)Br)C2	1843871598	MVGTULWLBCVIIJ-MRXNPFEDSA-N	438.297	1.926	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC2(CCCN2C(=O)CCc2nc(N)n[nH]2)C1	1844184257	OHUFZXVQHVMWBZ-RIYZIHGNSA-N	441.442	1.408	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1ccc(Cl)cc1F)C2	1844263247	JXKBOBVZGVPNAO-UHFFFAOYSA-N	431.855	1.608	50	20	IDGD	
COC(=O)c1ccc(OCC(=O)N2CC3(CCCN3C(=O)[C@H](F)Br)C2)cc1	1845220699	IVVZIPCWXUNSAS-HNNXBMFYSA-N	443.269	1.746	50	20	IDGD	
CC(=O)N/C(=C\c1ccco1)C(=O)N1CCCC12CN(C(=O)[C@@H](C)CBr)C2	1845440807	RDBDEFDIHREMFR-LWLPBDFMSA-N	438.322	1.991	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@](F)(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](O)CCl)C1	1847559973	WCZAOSJFSHJOCU-WFTHSTBKSA-N	433.908	1.137	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@@H](C)C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)C(Cl)Cl)cc1	1847583305	XULIQDYPWMUZOB-QEJZJMRPSA-N	448.372	1.667	50	20	IDGD	
CCC(CC)(CC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)C(=O)O	10167763	UVAQANXLLQQZLT-UHFFFAOYSA-N	425.507	1.513	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)Cn2cnc3scc(-c4cccs4)c3c2=O)n1	12666261	MSOJLQVJHRAIID-UHFFFAOYSA-N	442.526	1.847	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)CNC(=O)c2ccc(OC)c(OC)c2)cc1OC	12693679	KMJDLYDQJYQBKZ-UHFFFAOYSA-N	431.445	1.302	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)[C@H]1CC(=O)N(c2ccc3c(c2)OCCO3)C1	15879299	KJZSDUIBLJHOSH-AWEZNQCLSA-N	441.440	1.046	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)CCNC(=O)c2ccco2)c2ccccc2c1=O	17397653	FFEKDAFWBLNSDR-UHFFFAOYSA-N	439.472	1.761	50	20	IDGD	
Cn1cc(S(N)(=O)=O)cc1C(=O)NNC(=S)Nc1cccc(Br)c1	27010920	MBKJDMXNKRSSJX-UHFFFAOYSA-N	432.325	1.066	50	20	IDGD	
CCn1c(SCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)nc2ccccc2c1=O	36788229	DEFBFMXMLAXBNZ-UHFFFAOYSA-N	427.442	1.878	50	20	IDGD	
Cc1cccc(-c2n[nH]c(=S)n2CC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1	105292899	UTEJJZVZXFKRJQ-INIZCTEOSA-N	425.470	1.904	50	20	IDGD	
Cn1ccnc1[C@@](O)(CC(=O)NNC(=O)c1ccc(Br)s1)C(F)(F)F	105567890	MQYMIWDEXQKCGM-LBPRGKRZSA-N	441.229	1.845	50	20	IDGD	
CN(CCCc1cc(-c2cccc(F)c2)n[nH]1)C(=O)NNC(=O)CNC(=O)c1ccco1	725871203	HPIOBBIKKGPXGI-UHFFFAOYSA-N	442.451	1.844	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)c1ccc(S(N)(=O)=O)c(Cl)c1	725907180	CKMRCIARFZUVON-UHFFFAOYSA-N	427.866	1.226	50	20	IDGD	
Cc1nc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)sc1C	726871526	VJSPDBSUXXSWBO-UHFFFAOYSA-N	439.519	1.247	50	20	IDGD	
O=C(COC(=O)c1cnn(-c2ccccc2F)c1)NNC(=O)[C@@H]1COc2ccccc2O1	728339357	LMSTXVQFWYQGAH-SFHVURJKSA-N	440.387	1.156	50	20	IDGD	
O=C(NCCNC(=O)c1ccccc1Cl)NNC(=O)C1CCN(c2ncccn2)CC1	728959942	STIJZPZJOQDVBZ-UHFFFAOYSA-N	445.911	1.107	50	20	IDGD	
O=C(NC[C@@H]1CN2CCC[C@@H]2CO1)NNC(=O)c1ccc(Br)cc1Cl	729500631	VAHUQJPPOLYUFJ-VXGBXAGGSA-N	431.718	1.910	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNS(=O)(=O)c1cc(F)c(F)cc1F	729837533	VSUFTBKOGGFPHB-UHFFFAOYSA-N	436.437	1.329	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)NCCOc1ccc(S(C)(=O)=O)cc1	730066717	OIIVQSWLZRWFNA-UHFFFAOYSA-N	441.893	1.775	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)NCCCC(=O)N1Cc2ccccc2C1	732236501	XSMPKOWTVHPAGK-UHFFFAOYSA-N	426.473	1.727	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)c2csc(-c3ccc4c(c3)OCCO4)n2)C[C@@H](C)O1	732260387	RZQMBWPJJHCUCL-ZIAGYGMSSA-N	446.529	1.842	50	20	IDGD	
O=C(NNC(=O)c1ccc(Br)s1)N[C@@H]1CCN(CC(F)(F)F)C1=O	732573822	ZOUSBFBBDJWLEZ-ZCFIWIBFSA-N	429.218	1.618	50	20	IDGD	
CC(C)N1C(=O)c2ccc(C(=O)NNc3nc4ccccc4c(=O)n3C)cc2S1(=O)=O	733261044	IFASUDHBRUKZHU-UHFFFAOYSA-N	441.469	1.243	50	20	IDGD	
Cn1c(NNC(=O)[C@H]2CCN(c3ccc4c(c3)OCCO4)C2=O)nc2ccccc2c1=O	733261456	AFTXIMOSQONHOP-OAHLLOKOSA-N	435.440	1.201	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)[C@@]12CCC(=O)N1c1ccccc1S2	734239274	KXOKZPCLMVKYMP-IBGZPJMESA-N	435.506	1.471	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)CN2Cc3ccccc3C2=O)CC1	734821012	DWJVVJWARWCJTP-UHFFFAOYSA-N	431.493	1.372	50	20	IDGD	
COc1cc(C(=O)NNC(=O)N[C@H]2CCC[C@H](S(C)(=O)=O)C2)ccc1OC(C)C	741093753	VBPMJFSPFZNAMF-GJZGRUSLSA-N	427.523	1.782	50	20	IDGD	
O=C(CC12CC3CC(CC(C3)C1)C2)NNC(=O)[C@@H]1CCCCN1C(=O)c1ccc(O)nn1	741742480	HGEUPHPSQZYDGY-NGOBRMJYSA-N	441.532	1.931	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)[C@H](C)NC(=O)c2cc3c(C)nn(C)c3s2)cc1C	742033926	SSXZUMAEMZWKNS-AWEZNQCLSA-N	443.529	1.905	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)[C@@H]1CCCN(C(=O)c2ccncc2)C1	742061764	JPWBNSXHTWURFM-MRXNPFEDSA-N	443.529	1.518	50	20	IDGD	
N#Cc1ccc(C(=O)NNC(=O)COC(=O)C[C@H](c2ccccc2)N2CCOC2=O)cc1	744950405	LQIMXUMJHSLISP-GOSISDBHSA-N	436.424	1.446	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)[C@@H](C)Oc2ccc3ccccc3c2)cn1C	745976147	DWBTXHOVAJCPSL-CYBMUJFWSA-N	431.470	1.742	50	20	IDGD	
Cc1ccc(NC(=O)N2CCN(CC(=O)NNC(=O)Cc3nc(C)cs3)CC2)cc1	746478508	BMCXAULHKXRHHN-UHFFFAOYSA-N	430.534	1.300	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(C(=O)N2CCOCC2)cc1)c1cccc2cccnc12	747407443	GVEGWKFGBBTPPD-UHFFFAOYSA-N	440.481	1.331	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)[C@H](C)NS(=O)(=O)c2ccc(C)cc2)o1	747715774	KMSPBTGSYSYNLW-HNNXBMFYSA-N	436.534	1.558	50	20	IDGD	
CNC(=O)c1ccc(C(=O)NNc2ccc(S(=O)(=O)Nc3nccs3)cc2)cn1	747943582	KFMBNXIENIRFCT-UHFFFAOYSA-N	432.487	1.455	50	20	IDGD	
NS(=O)(=O)c1cccc(N2C[C@H](C(=O)NNc3cccc(C(F)(F)F)c3)CC2=O)c1	747994842	AIFWOUONZAFOIW-LLVKDONJSA-N	442.419	1.849	50	20	IDGD	
CCCCN1C(=O)C[C@@H](C(=O)NNC(=O)C(=O)N2CCCC2)[C@@H]1c1ccc(OC)cc1	748246701	GALJOFJKUNIBHY-MJGOQNOKSA-N	430.505	1.155	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@H](C(=O)NNC(=O)c3cccc(Cl)n3)C2)cc1	749560167	HAAKUMNPBWPOJT-AWEZNQCLSA-N	436.921	1.905	50	20	IDGD	
CC(C)S(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)c2ccc(C#N)cc2)cc1F	749767437	AVAQPPRDRLKLLG-UHFFFAOYSA-N	440.478	1.471	50	20	IDGD	
CC(C)Cc1ccc(CC(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1	749951180	KUNLDLYJFPEWES-HXUWFJFHSA-N	426.469	1.958	50	20	IDGD	
C[C@@]1(c2ccc(C(=O)NNc3nc(-c4ccccn4)nc4c3CCC4)cc2)NC(=O)NC1=O	751069911	SCRWYBDUTROORY-QHCPKHFHSA-N	443.467	1.839	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCN(C(=O)c2ccc3n[nH]cc3c2)C1)[C@@H]1COc2ccccc2O1	751291512	VQPHJGXNDJRGFT-QRWLVFNGSA-N	449.467	1.403	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NCc1nccn1CCCc1ccccc1	751605776	AUKFIDYDPMJAOR-UHFFFAOYSA-N	440.529	1.838	50	20	IDGD	
O=C(NCCCn1ccnn1)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	753349762	IEOLWADZSFPVFQ-UHFFFAOYSA-N	446.475	1.014	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)NC2CCN(S(=O)(=O)C3CC3)CC2)c1C	753968265	UEEYQVDCIGTVJI-HNNXBMFYSA-N	438.550	1.358	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)N[C@@H]1[C@H]2CCO[C@@H]2C12CCC2	754672452	CBQLZTLSYZSFAM-NRSPTQNISA-N	427.549	1.487	50	20	IDGD	
O=C(CC12CC3CC(CC(C3)C1)C2)NNC(=O)NCCN1C(=O)[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O	755254919	DRRFMADQNYFJBH-KUGBPRMPSA-N	440.544	1.730	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2ccc(NC(=O)NNC(=O)c3cccn3C)cc2)C[C@H](C)O1	755422122	IYUXTMPPRXSCGB-KBPBESRZSA-N	435.506	1.290	50	20	IDGD	
COc1ccc(C(=O)N2CCCC2)cc1NC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	756262770	RHWUEPXDWDOBSI-IBGZPJMESA-N	440.456	1.924	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)Nc1cccc(S(=O)(=O)NC2CC2)c1C	756706949	SIDDLDBJQZYKNZ-UHFFFAOYSA-N	448.501	1.676	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1NS(C)(=O)=O	756781429	DZEVQZAMCPCBIW-MRXNPFEDSA-N	436.446	1.059	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N1CCO[C@H]([C@@H]2CCCO2)C1	756916593	RKQVTAMETXOENN-RCBQFDQVSA-N	442.310	1.837	50	20	IDGD	
C[C@H]1CCc2c(sc3nc(CCC(=O)NNc4ccc(C(N)=O)nn4)nc(O)c23)C1	757399102	MIVSAHHVDDPCBH-VIFPVBQESA-N	427.490	1.487	50	20	IDGD	
Cc1ccccc1-n1nccc1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	757892805	IHNALMVRZRTEGJ-UHFFFAOYSA-N	442.501	1.898	50	20	IDGD	
O=C(NNC(=O)/C(=C/c1ccco1)n1nnnc1-c1ccccc1)C(=O)Nc1ccccn1	758837377	ABPIALSEGPHZLQ-SSZFMOIBSA-N	444.411	1.112	50	20	IDGD	
CCOc1nc(C(F)(F)F)ccc1C(=O)OCC(=O)NNC(=O)c1cccc(C#N)c1	759296220	BMTINLQVFKADML-UHFFFAOYSA-N	436.346	1.989	50	20	IDGD	
Cc1ccnc(-n2nccc2NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)c1	760279303	KYPHYHHFOAOFKS-UHFFFAOYSA-N	430.428	1.366	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)N[C@H]2CCCN(c3ccccc3F)C2=O)cc1C	761821534	OZAYPTSKLUPMQH-KRWDZBQOSA-N	441.463	1.907	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3ccc(-c4cc[nH]n4)s3)cc2)CC1	762147357	YVWRFIXWCBAYOS-UHFFFAOYSA-N	446.558	1.831	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)CCc2c(C)nc3cc(C)nn3c2C)n1	762273079	DUHYZAKLGNICCJ-UHFFFAOYSA-N	444.517	1.285	50	20	IDGD	
CC(C)N(C)S(=O)(=O)c1cccc(C(=O)NNc2nccc(N3CCOCC3)n2)c1	762865690	LLZRFUFPQUFYRR-UHFFFAOYSA-N	434.522	1.099	50	20	IDGD	
CN(C)S(=O)(=O)c1ccsc1C(=O)NNC(=O)c1cc(-c2cccs2)[nH]n1	763162619	CBUMXOHOZVWMBO-UHFFFAOYSA-N	425.517	1.525	50	20	IDGD	
COC(=O)Nc1cc(C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)cc(C(F)(F)F)c1	763303564	QJQOMZXZWBXPHE-JTQLQIEISA-N	438.384	1.015	50	20	IDGD	
Cc1cc(Cl)ccc1OCCCC(=O)NNC(=O)C(=O)Nc1ccc(CC(N)=O)cc1	763500056	KHKOWSBAISMUIL-UHFFFAOYSA-N	446.891	1.621	50	20	IDGD	
CN(C)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2c[nH]c3ccccc23)cc1Cl	763539926	DIQPBIPETGJANO-UHFFFAOYSA-N	427.848	1.923	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(CCN3CCCC3)c2)cc1OC	763551390	PFASTASJTZZGRT-UHFFFAOYSA-N	440.500	1.742	50	20	IDGD	
CN(C)CCOc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)cc1Cl	763557828	FERBBWNQSDFIPH-UHFFFAOYSA-N	448.863	1.409	50	20	IDGD	
COC(=O)c1c(C2CC2)csc1NC(=O)C(=O)NNC(=O)[C@H]1COc2ccccc2O1	763574868	KVFFBBNCHUDIFO-CQSZACIVSA-N	445.453	1.338	50	20	IDGD	
Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)C(=O)Nc2ccc(C(=O)N(C)C)cc2)c1	763596533	IKNLZDAZXHYCCZ-UHFFFAOYSA-N	440.500	1.985	50	20	IDGD	
CCOC(=O)c1cc(C)sc1NC(=O)C(=O)NNC(=O)COc1ccccc1OC	763648804	XCHNDAJROFWNLJ-UHFFFAOYSA-N	435.458	1.407	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1ccccc1N1CCCC1	763682406	NMXFPPZUQRKNND-UHFFFAOYSA-N	426.473	1.850	50	20	IDGD	
CN(C)C(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cccc(N(C)C)c2)ccc1Cl	763752947	BMNWUFRSULIBJJ-UHFFFAOYSA-N	431.880	1.508	50	20	IDGD	
CN(C)CCC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCC3)cc1	763784620	FLNVHBHOLSJUTM-UHFFFAOYSA-N	443.529	1.527	50	20	IDGD	
O=C(Cc1c[nH]c2ccccc12)NNC(=O)C(=O)Nc1cc(F)cc(N2CCOCC2)c1	763864976	FZEMIRQCIHFRFF-UHFFFAOYSA-N	439.447	1.472	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(-n3cccn3)nc2)cc1	763871669	HABFNIQBOLFTLY-AWEZNQCLSA-N	436.428	1.023	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)C(=O)Nc2ccc3c(c2)C(=O)N(C)C3=O)cc1	763898167	MIVFYUQJOXVJQS-UHFFFAOYSA-N	426.454	1.099	50	20	IDGD	
COc1cc(C(=O)N(C)C)ccc1NC(=O)C(=O)NNC(=O)Cc1ccc(Cl)cc1	763936942	SJSDTXCQRJYDGA-UHFFFAOYSA-N	432.864	1.379	50	20	IDGD	
COC(=O)c1csc(NC(=O)C(=O)NNC(=O)c2cc(Br)cn2C)c1	764005279	XAQASWLFMFUOEA-UHFFFAOYSA-N	429.252	1.035	50	20	IDGD	
Cn1cc(NC(=O)C(=O)NNC(=O)c2ccc(Br)cc2Cl)ccc1=O	764058462	IXEMZUBTPNJFNS-UHFFFAOYSA-N	427.642	1.201	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2cccc(OC(F)F)c2)c1	764078402	SPDJNLQDSHUGHO-UHFFFAOYSA-N	427.385	1.091	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(-c3nnc4n3CCCC4)cc2)c(O)c1	764104923	IULYOFCOCDAAHV-UHFFFAOYSA-N	434.456	1.695	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccnn2Cc2c(Cl)cccc2Cl)n[nH]1	764106294	HOMRNXUQNWOIFA-UHFFFAOYSA-N	436.259	1.669	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cccc(COCCOc3ccccc3)c2)n[nH]1	764109329	SCFBMYNVKBZYIB-UHFFFAOYSA-N	437.456	1.713	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)C(=O)Nc1cc(F)ccc1OC[C@@H]1CCCO1	764281507	YJLGVHVSAROWLI-INIZCTEOSA-N	445.447	1.808	50	20	IDGD	
O=C(CCc1ccccc1O)NNC(=O)C(=O)Nc1cnn(-c2ccccc2Cl)c1	764289380	RTRYQDATYPHILU-UHFFFAOYSA-N	427.848	1.950	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)C(=O)Nc1cccc(I)c1	764320279	WJHNLTOUKCJOOT-UHFFFAOYSA-N	441.200	1.759	50	20	IDGD	
CCOCC(=O)NNC(=O)C(=O)Nc1ccc(S(=O)(=O)N(CC)c2ccccc2)cc1	764325853	UQUJBWGMANCTGD-UHFFFAOYSA-N	448.501	1.024	50	20	IDGD	
C[S@@](=O)Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)ccc1Cl	764348874	AIGSLTCWJUXJFW-MUUNZHRXSA-N	444.296	1.977	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)ccc1C	764387610	LKSZRJLJSFKVRK-UHFFFAOYSA-N	439.403	1.711	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1ccc(Cn2cccn2)cc1	765733742	REPPIUUXQNUFHX-UHFFFAOYSA-N	446.511	1.150	50	20	IDGD	
Cc1cc(S(=O)(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc([N+](=O)[O-])c1F	768272108	MPIUKRHWHOIPAV-UHFFFAOYSA-N	438.441	1.058	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)Cc1c(C)nc2c(c(C)nn2C)c1C	768645082	MBAQQPKXFZRIOO-UHFFFAOYSA-N	431.518	1.991	50	20	IDGD	
CCn1c(NNC(=O)c2nccn3c(Br)cnc23)nc2ccccc2c1=O	769649852	ARXIHQQVPLQWHQ-UHFFFAOYSA-N	428.250	1.979	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)NCCc2n[nH]c(C)n2)cc1	769775362	GXAYHAAKOAFFKB-WJDWOHSUSA-N	448.487	1.127	50	20	IDGD	
CSCCNC(=S)NNC(=O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])c(C)c1	770248240	UPXHZJZCSCKMJJ-CQSZACIVSA-N	425.536	1.366	50	20	IDGD	
Cc1cc(NNC(=O)CN2C(=O)N[C@@](C)(c3ccc(Br)cc3)C2=O)nc(C)n1	771581525	FOFJECFVEJVUDI-SFHVURJKSA-N	447.293	1.766	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)c1ccc(OC[C@@H]2CCCO2)cc1	772194630	BGNZPSJSEORRNM-SFHVURJKSA-N	431.876	1.975	50	20	IDGD	
CC(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)cc1	772883590	DLLSXMYLTFMVRX-UHFFFAOYSA-N	437.905	1.600	50	20	IDGD	
CNC(=O)Cn1ccc2ccc(NC(=O)C(=O)NNc3ccc(C(F)(F)F)cn3)cc21	773666782	RTKNFSWJSRIMEN-UHFFFAOYSA-N	434.378	1.883	50	20	IDGD	
CCOC(=O)Cn1cccc(NC(=O)C(=O)NNc2c(Cl)cccc2Cl)c1=O	773694714	OIJROIWZGGJRPS-UHFFFAOYSA-N	427.244	1.800	50	20	IDGD	
CS(=O)(=O)NCc1ccc(NC(=O)C(=O)NNc2cccc(C(F)(F)F)c2)cc1	773741993	NZMHALPROABIKP-UHFFFAOYSA-N	430.408	1.836	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2nccnc2C(C)C)cc1N1CCCS1(=O)=O	773992710	KOBOIDGOIBVOEH-UHFFFAOYSA-N	432.506	1.530	50	20	IDGD	
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	775687615	CKVUFZTVSPFXGO-OXJNMPFZSA-N	425.489	1.856	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NC[C@@H]2COC3(CCCCC3)O2)cc1	775758614	DDZYROXIVWWOFK-CQSZACIVSA-N	426.495	1.502	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1cc(OCC(F)F)ccn1	777961051	UGADBHHAEFNHCC-UHFFFAOYSA-N	427.433	1.402	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccccc2CCN(C)C)c1C	782701282	CBZPCVGLSAVKFT-KRWDZBQOSA-N	426.517	1.961	50	20	IDGD	
CC(F)(F)c1cccc(NC(=O)C(=O)NNC(=O)c2csc(N3CCOCC3)n2)c1	782898027	WRDJUXVEGLXIHE-UHFFFAOYSA-N	439.444	1.491	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNc2cccc(S(C)(=O)=O)c2)ccc1Br	784840901	HQFLFSAXUPIHLK-UHFFFAOYSA-N	442.291	1.943	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@@H]2CCN(C(=O)OC(C)(C)C)[C@H]2C)c2ccccc2c1=O	786252570	IXMYZIYCGOYASS-UONOGXRCSA-N	443.504	1.823	50	20	IDGD	
CN(CC(=O)NNC(=O)NCc1ccc(Cl)cc1)C1=NS(=O)(=O)c2ccccc21	787423652	AZFMNIGANDYVER-UHFFFAOYSA-N	435.893	1.251	50	20	IDGD	
CN1CCC(n2ccc(NC(=O)C(=O)NNC(=O)c3ccc(Cl)cc3Cl)n2)CC1	787556018	NCSGIXHSDFCDPM-UHFFFAOYSA-N	439.303	1.856	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cc([C@@H]3CCCO3)nn2C)cc1	789741676	YJHPCAATWFYVGZ-GUYCJALGSA-N	445.476	1.224	50	20	IDGD	
CC[C@H]1CCc2nc(NC(=O)C(=O)NNC(=O)Cc3nc4ccccc4n3C)sc2C1	789749477	QAFUOQQKHPRMEQ-LBPRGKRZSA-N	440.529	1.873	50	20	IDGD	
CNS(=O)(=O)c1cc(NC(=O)C(=O)NNc2ccc(Cl)c(OC)c2)ccc1C	789797793	UQBJMJQHWJHFOI-UHFFFAOYSA-N	426.882	1.647	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)ccc1C(F)(F)F	790956279	FGXCGNASEWDRBW-HNNXBMFYSA-N	439.346	1.640	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NC[C@H](C)NC(=O)OC(C)(C)C)nc1	792254806	CUMIFFDAHKARAO-ZDUSSCGKSA-N	444.558	1.651	50	20	IDGD	
Cc1cccnc1NNC(=O)C(=O)Nc1cc(S(=O)(=O)N(C)C)ccc1OC(C)C	792376629	XPKRCEJTMDSIQI-UHFFFAOYSA-N	435.506	1.509	50	20	IDGD	
CN(C)N(C(=O)[C@@H]1CCN(c2ccc(Cl)c(Cl)c2)C1=O)[C@H]1CCS(=O)(=O)C1	792853966	HVUSJVFXJDFYPE-QWHCGFSZSA-N	434.345	1.839	50	20	IDGD	
O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)C(=O)Nc1cccc(Br)n1	793021371	CVJCANRJDFGHJD-UHFFFAOYSA-N	445.233	1.135	50	20	IDGD	
C[C@](O)(CN1C(=O)NC2(CCCC2)C1=O)C(=O)NNc1ccc([N+](=O)[O-])cc1Cl	793711210	YKFBKQPWDWTENK-INIZCTEOSA-N	425.829	1.307	50	20	IDGD	
CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)NNC(=O)CNC(=O)OCc1ccccc1	794598984	QRMXHEUABHSWSH-UHFFFAOYSA-N	436.446	1.393	50	20	IDGD	
Cc1c(C(=O)NNC(=O)COc2ccc(Br)cc2)nnn1Cc1ccncc1	794764756	XEMUKNQOUIJZFI-UHFFFAOYSA-N	445.277	1.632	50	20	IDGD	
CC(=O)N1CCCC[C@H]1C(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12	794766291	DZKPMSUMPUNHDN-FQEVSTJZSA-N	447.495	1.607	50	20	IDGD	
CNS(=O)(=O)N1CCC(C(=O)NNC(=O)[C@@H](C)Oc2c(C)cc(Cl)cc2C)CC1	794791248	RMDMZXHQOAMNBY-CYBMUJFWSA-N	446.957	1.048	50	20	IDGD	
Cc1noc(C2CCC(=NNC(=O)c3cccc(S(=O)(=O)N4CCOCC4)c3)CC2)n1	797397844	LFCFUMPPTVERIV-UHFFFAOYSA-N	447.517	1.843	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H](c2ccccc2F)N2CCOCC2)cc1C	798308994	SSAPFAPLRFYHRY-IBGZPJMESA-N	428.464	1.602	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)NCC(=O)NNC(=O)Nc2ccccc2C)cc1	798311424	SLSDIPKADBPKJH-UHFFFAOYSA-N	434.474	1.303	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)C(=O)Nc1cncc(F)c1	799258634	IRXQAEMNWMMMJD-VIFPVBQESA-N	425.214	1.537	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(NC(=O)C(=O)NNc2c(F)cccc2Cl)ccc1F	806983347	ONWRFURVPDLZQP-UHFFFAOYSA-N	432.836	1.950	50	20	IDGD	
CCOC(C)(OCC)C(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2cc(C)on2)c1	807372123	YWNDLLJNQUSRRU-UHFFFAOYSA-N	440.478	1.334	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)N[C@@H]1CCCN(C(=O)CCC(F)(F)F)C1	807573898	HYDLNELXWWEJJY-CYBMUJFWSA-N	444.410	1.735	50	20	IDGD	
C[C@@H]1[C@H](NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)CCN1Cc1ccccc1	807622259	QRNRGMPYAGBRON-DNVCBOLYSA-N	430.530	1.697	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccccc2-n2cnc(C#N)n2)c2ccccc2n1	810384984	MSVDZNCLYNGDHI-UHFFFAOYSA-N	440.423	1.395	50	20	IDGD	
C[S@@](=O)Cc1cccc(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c1	810442397	RKWDFTGYXWVCCO-SSEXGKCCSA-N	428.558	1.538	50	20	IDGD	
O=C(COC(=O)c1cc(O)cc(C(F)(F)F)c1)NNC(=O)c1ccc([N+](=O)[O-])cc1	811309231	DXRFARRPGHKVID-UHFFFAOYSA-N	427.291	1.937	50	20	IDGD	
Cc1cc(=O)cc(C)n1CCCC(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	811355412	ZBCYJPQMANAQJQ-UHFFFAOYSA-N	430.417	1.158	50	20	IDGD	
CC(=O)Nc1cc(NC(C)=O)cc(C(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)c1	812479428	ZIBZBRATOORLPQ-UHFFFAOYSA-N	446.847	1.875	50	20	IDGD	
COc1c(NC(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)cc(Cl)cc1C(N)=O	812983492	TXPOQHHLEIYCQC-UHFFFAOYSA-N	441.897	1.846	50	20	IDGD	
CCc1nc2cc(NC(=O)C(=O)NNc3ccc(S(=O)(=O)N(C)C)cc3)ccc2o1	813034050	WKKWSNIAEDUGDJ-UHFFFAOYSA-N	431.474	1.722	50	20	IDGD	
Cc1cc(-c2cc(C(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)c3c(C)noc3n2)c(C)o1	813529303	YCIQGQGAVMVRRB-LBPRGKRZSA-N	432.458	1.604	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2cc([N+](=O)[O-])c(N(C)C)cc2F)n1	814483653	PXARCTZPHCAOHI-UHFFFAOYSA-N	439.425	1.112	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)c2cnn(C)c2I)cc1	814758635	DMCIZDNHMRGHPF-UHFFFAOYSA-N	430.271	1.886	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2nnn(CCOc3ccc(F)cc3)c2C)o1	815569622	AVEGAIQVPLGIML-UHFFFAOYSA-N	430.396	1.106	50	20	IDGD	
Cc1cccc(Oc2ncccc2NC(=O)C(=O)NNC(=O)[C@H]2CCc3nncn3C2)c1C	815691982	GVZDRZSGUALOMX-HNNXBMFYSA-N	449.471	1.431	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@@H](CS(C)(=O)=O)c2ccccc2)c2ccccc2c1=O	816806331	YYHAQOOYNIVHRV-KRWDZBQOSA-N	442.497	1.006	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)CCNC(=O)N1CCc2ccccc2C1	817053995	PBJCLLMQQWTHPY-UHFFFAOYSA-N	445.545	1.538	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)Cn2cnc(-c3ccccc3)n2)C1	819659311	UJVXTSKRQZTMDS-INIZCTEOSA-N	428.493	1.740	50	20	IDGD	
CC(C)NS(=O)(=O)c1cc(C(=O)OCC(=O)NNC(=O)c2ccccc2)ccc1F	914941297	VMLQIZXZGIGSLW-UHFFFAOYSA-N	437.449	1.130	50	20	IDGD	
CCCNC(=O)CN1CCC(NC(=O)NNC(=O)c2cc3c(s2)CC[C@H](C)C3)CC1	915257939	WZIOVCYQLPPRKO-AWEZNQCLSA-N	435.594	1.808	50	20	IDGD	
Cc1cc(O)cc2c1C(=O)C(=NNC(=O)c1cccc(S(=O)(=O)N3CCOCC3)c1)O2	915939943	ZHSUKXOMKMDJJM-UHFFFAOYSA-N	445.453	1.040	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2coc(-c3cccs3)n2)c1	916230543	HLWLCMRBCHTZAE-UHFFFAOYSA-N	449.514	1.798	50	20	IDGD	
O=C(NCc1ccccc1Cn1ccnc1)NNC(=O)c1csc(N2CCOCC2)n1	916230688	JUVHZSXEGCNPDC-UHFFFAOYSA-N	441.517	1.369	50	20	IDGD	
CCNC(=O)c1ccc(CNC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)cc1	916392486	ZCIJZHZQWYQHFW-UHFFFAOYSA-N	446.533	1.182	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)NCCCN2CCN(C)C[C@H]2c2ccccc2)n1	916485062	LIEXCHVHKPYBLU-FQEVSTJZSA-N	427.553	1.209	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)NC[C@H](C)N1CCN(c2ccccc2)CC1	916515009	XHRAMXLCENOFMP-KRWDZBQOSA-N	435.532	1.797	50	20	IDGD	
CCNC(=O)c1cccc(CNC(=O)NNc2ccc(S(=O)(=O)N(CC)CC)cn2)c1	916645221	YFVRSOIXCMPJJI-UHFFFAOYSA-N	448.549	1.688	50	20	IDGD	
CCC(=O)N1CCCC[C@@H]1C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	919743754	UZXHWEVLGOVNKN-QGZVFWFLSA-N	436.534	1.023	50	20	IDGD	
Cn1c2ccccc2c2cc(S(=O)(=O)NNC(=O)N[C@@H]3CCS(=O)(=O)C3)ccc21	919961000	NKONVJSHFKPJIG-GFCCVEGCSA-N	436.515	1.011	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)[C@H](C(C)C)N2C[C@H](C)O[C@H](C)C2)c2ccccc2c1=O	921202719	BGLDJYUGXAYEQJ-YRNRMSPPSA-N	443.548	1.701	50	20	IDGD	
O=C(NNC(=O)[C@H](Cc1ccccc1)NC(=O)c1cccnc1)c1ccc([N+](=O)[O-])cc1	921298206	QVMMQIOAZYVUFA-IBGZPJMESA-N	433.424	1.792	50	20	IDGD	
O=C(CC1(CC(=O)N2CCOCC2)CCCC1)NNC(=O)c1cnn(-c2ccccc2)c1	1251807949	SLEHJBCVODPMMO-UHFFFAOYSA-N	439.516	1.833	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)CNS(=O)(=O)c2ccccc2)c(C)n1-c1ccccc1	1317702921	LHXQAWWMWAYJNI-UHFFFAOYSA-N	426.498	1.834	50	20	IDGD	
Cc1c(/C=C(\C#N)C(=O)OCC(=O)N2CCN(C(=O)OC(C)(C)C)CC2)cc(C#N)n1C	1317986766	TZTDSKRMENZFMC-LICLKQGHSA-N	441.488	1.735	50	20	IDGD	
Cc1n[nH]c(C)c1C[C@H](C)C(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	1319302996	LPPZYFXLAPLKQA-HNNXBMFYSA-N	446.983	1.824	50	20	IDGD	
Cc1noc(C)c1S(=O)(=O)NC1(C(=O)NNC(=O)c2ccccc2Cl)CCCC1	1322075240	ADJFXWGSMARUKV-UHFFFAOYSA-N	440.909	1.997	50	20	IDGD	
O=C(NNC(=O)c1ncoc1[C@@H]1CCCO1)c1cccc(S(=O)(=O)N2CCCCC2)c1	1328422269	XDOGPESOZWMMBZ-INIZCTEOSA-N	448.501	1.776	50	20	IDGD	
Cn1ncc2cc(C(=O)N3CC[C@]4(CN(C(=O)CO[Si](C)(C)C)CCO4)C3)ccc21	1778021082	ISUMOLZYFUGIPG-NRFANRHFSA-N	430.581	1.868	50	20	IDGD	
O=C(C[C@H]1CNc2ccccc2O1)N1CC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1778931436	HYBZUXGWDUHWDS-DJJJIMSYSA-N	428.316	1.883	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(CN(C(=O)C3=COCC3)CCO2)C1	1780098952	LOUSVBRHEDGDBS-NRFANRHFSA-N	445.428	1.268	50	20	IDGD	
CCOC(=O)c1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](F)Cl)C3)ccn1	1780170999	NZEFHJKEIRCCJP-JXXFODFXSA-N	441.887	1.920	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@]2(C)C[C@H]2C)C1	1780617922	ITJATANZIUIZHB-QXHPIULGSA-N	443.548	1.680	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)N2CCN(C)CC2)C1	1780637214	QYPRXCWYMXVOEV-PSHVLCQKSA-N	443.032	1.544	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)C3(Br)CC3)C2)C1	1781345868	MBTRFKFOGVILCQ-KBPBESRZSA-N	428.154	1.980	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)/C(=C/c3ccco3)NC(C)=O)C2)C1	1781858760	ADMCVGZTYRNXQY-RHZPECNXSA-N	437.924	1.994	50	20	IDGD	
CCOc1cccc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](Cl)COC)CCO3)c1O	1781982292	KFMHUCGLRUGREV-YWZLYKJASA-N	426.897	1.488	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](N)c1ccccn1)C2	1781997767	GBXLEKMKLRVPLX-NQUFMGSDSA-N	439.354	1.379	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1cscn1)C2	1781998259	QAZKZBLGJAMWRQ-DXCKQFNASA-N	430.368	1.983	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc3c(cnn3C)c1)C2	1782175750	QNMMIXXZADZJAI-SFGWALBWSA-N	448.951	1.955	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C=C/c2cnc[nH]2)C1	1782428134	ALWUXYTWDAMOAO-ZHKIMASESA-N	439.354	1.968	50	20	IDGD	
CC(C)C1(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2ccc(B(O)O)cc2)C3)CCC1	1782805021	BHYMFONKTZZNDF-NFBKMPQASA-N	442.365	1.320	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H]2C[C@@]2(C(=O)N2CC[C@]3(CN(C(=O)[C@H](F)Cl)CCO3)C2)C1	1783460289	XOGSMHWYXNIUKR-BBNYVJOESA-N	445.919	1.608	50	20	IDGD	
COc1ccc(F)cc1CC(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](C)Br)C2)C1	1783540324	UEFIWPYBPFPEPM-BFUOFWGJSA-N	443.313	1.990	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CC[C@@H]3CCOC3)C[C@@H]21	1783975034	DTGZIZRXFYGENU-QEOTZNIISA-N	431.371	1.814	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)CCc3cccc(O)c3)C2)C1	1784127170	OBXASTDWFKBESW-LIRRHRJNSA-N	425.323	1.938	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CSc3ncccn3)[C@H]2C1	1787074711	AQZGOCGDVBBZAA-NUXNZHGMSA-N	447.388	1.785	50	20	IDGD	
C=CC[C@@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)[C@H]2C1	1787507781	SLXFJQKDGAVFNK-JGLFJCHSSA-N	429.521	1.312	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4c(n3)OCCO4)C[C@@H]21	1788764081	JEQDZKXLBQJPKK-MPGHIAIKSA-N	449.580	1.298	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CC#N)C[C@@H]21	1789222397	YIQPXVHCUSJOKA-OWQGQXMQSA-N	430.417	1.027	50	20	IDGD	
CCCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN(C)NC(=O)NCc3ccccc3)[C@H]2C1	1789726671	LPFJJOYDROBDJH-UFYCRDLUSA-N	445.564	1.112	50	20	IDGD	
O=C(NC1(c2ccc(NC(=O)c3ccc(CO)o3)cc2)CCC1)c1ccc(B(O)O)cc1	1789762116	FDJNAXXGNOVZEX-UHFFFAOYSA-N	434.257	1.513	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/C(=O)NCc3ccco3)C[C@@H]21	1789863413	RGDOORYDQIXEQC-XABQTDMUSA-N	437.924	1.449	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3(Br)CC3)[C@H]2C1	1789932988	BDVMVQQYYPVEIS-BJDJZHNGSA-N	438.160	1.677	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(=O)n3C)C[C@@H]21	1790960796	GHWXSFAJNRMWAG-AYDFFVQHSA-N	440.338	1.152	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]3C2)nn1C(F)F	1791059113	OBPGPTWZJDOGLD-UHXUPSOCSA-N	449.296	1.963	50	20	IDGD	
Cc1nn(C)c(C)c1CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21	1791636134	BBWHLBMNCDIBRO-NZUILWFCSA-N	445.333	1.250	50	20	IDGD	
Cc1ccc(OCCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)cc1	1792784462	KTXGHNOLTNHMEG-WKCHPHFGSA-N	436.317	1.396	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccncc1Cl)C2	1792870742	KDHFFMCJWIWRNK-OHTBPHCPSA-N	430.730	1.969	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@@H](O)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C(C)(C)CCl	1792880147	YLYKALFBACQMPU-LXTVHRRPSA-N	431.961	1.775	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(OC)nc1	1793574068	WMAHJRXGABOEQR-HLPPOEQASA-N	426.311	1.467	50	20	IDGD	
CO[C@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](O)CCl)C2	1793836363	LWSVHTIGYMSGPI-RDGWLKQMSA-N	447.960	1.153	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](Br)Cc1ccccc1)C2)c1cocn1	1794939799	UJWRJZLUGVBHDA-KYHPRHEASA-N	448.317	1.884	50	20	IDGD	
COc1ncc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)CBr)C3)cc1C	1794983196	WXLSDVHRGSSEDM-HNKHHVNMSA-N	440.338	1.633	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)c1scnc1C1CC1	1796188208	BPXPSGGYJXOUHX-BJWYYQGGSA-N	425.319	1.266	50	20	IDGD	
CCc1nn(C)c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](O)CCl)C3)c1Br	1796417959	BHFQAJPLVQTBIL-NOHGZBONSA-N	447.761	1.597	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2ncncc2c1	1797465658	HEABHJDJVVRIDD-GMLZMKKNSA-N	447.333	1.864	50	20	IDGD	
CC(=O)O[C@@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)CBr)C2)C(C)C	1797589614	AHKHIPWUQUNPCX-YMILTQATSA-N	433.343	1.195	50	20	IDGD	
C[Si](C)(C)C#CCCCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(B(O)O)cc1)C2	1798417470	JRLWOJBAUVIQMY-WKCHPHFGSA-N	440.425	1.669	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(F)cnc1Cl)c1ccc(B(O)O)cc1	1798726080	XBWSNXADGXVVPS-MUJYYYPQSA-N	431.660	1.120	50	20	IDGD	
CSc1cccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CCC(=O)NN(C)C)C3)c1O	1799267139	SJPKSDMJDCUNDZ-QDMKHBRRSA-N	434.562	1.739	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2ccnn2c1	1800023369	PTXUZFZSBXUCTO-JJAZEVLHSA-N	435.322	1.569	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](O)Cc1ccccc1	1800637873	VEFWHKPJYKNCHH-CWQOZTLDSA-N	439.350	1.353	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(OC)cc1O)C2	1800642665	VMKQCTYCVHYCMT-RBNVPPIJSA-N	441.322	1.778	50	20	IDGD	
COc1ccc([C@H](O)C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)Br)cc1	1800754004	CJIMNDRQGCNDIK-VKPHEEHNSA-N	441.322	1.102	50	20	IDGD	
Cc1ccc([C@@H](C)C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCC(=O)NN(C)C)cc1	1801013262	YWLJANDDUINVAI-NSAZKJPHSA-N	430.549	1.061	50	20	IDGD	
CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(Cl)Cl	1801016553	IMMCWWWAPSOTQF-QHBPRCKVSA-N	445.303	1.668	50	20	IDGD	
COc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C(Cl)Cl)cc1N(C)C	1801017306	KXQBQSWDZNHWAZ-YWVIFJGQSA-N	430.332	1.768	50	20	IDGD	
CC(C)(C)OC(=O)N1CC=C(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Cl)C3)CC1	1801941508	KRYNVECJIMEDSB-QKPAOTATSA-N	445.919	1.678	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cc1ccc(C(=O)OC)s1)C2	1802283596	PKCBIWPMINAOTM-QVHKTLOISA-N	428.938	1.969	50	20	IDGD	
Cc1cccnc1C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1803799673	KKBLIICTWFOXQL-UGKGYDQZSA-N	444.300	1.098	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)[C@H](C)Cn2cccn2)[C@@H]1c1cccnc1	1804724012	YWHFJTUJGMVNPA-YSHGAJCASA-N	433.940	1.874	50	20	IDGD	
O=C(CCBr)NC[C@@H]1CCN(C(=O)CN2CCOC2=O)[C@@H]1c1cccnc1	1806341885	HWJAUYALENAZRG-WMLDXEAASA-N	439.310	1.325	50	20	IDGD	
Cn1cccc(C(=O)N2CC[C@@H](CNC(=O)CCBr)[C@@H]2c2cccnc2)c1=O	1806343134	SZXFYTQRUNMVOY-YJBOKZPZSA-N	447.333	1.885	50	20	IDGD	
COCCOCC(=O)NC[C@@H]1CCN(C(=O)[C@@](C)(Cl)CCl)[C@@H]1c1cccnc1	1806758439	FZBRYGGMSBTKEU-WDYCEAGBSA-N	432.348	1.987	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)CCc2cncnc2)[C@H]1c1cccnc1	1807507588	GFZYKQKDAFTULA-WSTZPKSXSA-N	431.924	1.764	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)[C@H](C)N2CCN(C)CC2)[C@H]1c1cccnc1	1808273584	DKFBCSYVUCFNNY-LEAZDLGRSA-N	436.000	1.741	50	20	IDGD	
O=C(CCC(F)(F)F)N1CCCC2(CCN(C(=O)c3ccc(B(O)O)cc3)CC2)C1	1809481310	UXMFVANUNVGYRA-UHFFFAOYSA-N	426.244	1.554	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC2(CCCN(C(=O)c3c[nH]c4nccc-4c3)C2)CC1	1810637375	DGOKWOYVNOQBPL-UHFFFAOYSA-N	446.316	1.353	50	20	IDGD	
COc1cc(C(=O)NC[C@@H]2CCN(C(=O)C(Cl)Cl)[C@@H]2c2cccnc2)nn1C	1811633343	BYABGCMPGFSXJZ-SWLSCSKDSA-N	426.304	1.947	50	20	IDGD	
CC(=O)NC(C)(C)C(=O)N1CC[C@H](CNC(=O)[C@H](C)Br)[C@H]1c1cccnc1	1812865852	YLTNTMAKLDAKPO-APHBMKBZSA-N	439.354	1.786	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)Cc2nnc(C)s2)[C@H]1c1cccnc1	1813030801	LMMPSGVCRBSGEY-MPGHIAIKSA-N	437.953	1.744	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)CCC(F)(F)F)sc2C1	1814441740	MAQDLASOFCHPQS-SNVBAGLBSA-N	435.472	1.771	50	20	IDGD	
O=C(CN1CCOC1=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](F)Br)[nH]n1	1815028604	VHKQTXNINMBPFX-MFKMUULPSA-N	432.250	1.545	50	20	IDGD	
Cc1ccc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)o1	1815336752	BTRQPAHEFURFEN-CQSZACIVSA-N	425.275	1.264	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)Cn3ccnn3)sc2C1	1815783021	NTQIVQKXSTWABN-UWVGGRQHSA-N	427.328	1.520	50	20	IDGD	
O=C(C#Cc1ccccc1)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1	1816954558	DZZUUIXHXXPVCC-NRFANRHFSA-N	442.284	1.447	50	20	IDGD	
O=C(Cc1ccccn1)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1817637068	IGBAJKQRHKLHCX-IBGZPJMESA-N	433.277	1.033	50	20	IDGD	
Cn1cccc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819402109	NJIMVCFEUQJDAG-INIZCTEOSA-N	436.476	1.366	50	20	IDGD	
Cn1nc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)[C@H](F)Br)n[nH]2)cc1O	1820931746	QCEDTAMAKRAQJQ-MFKMUULPSA-N	429.250	1.845	50	20	IDGD	
COc1cc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@H](C)Br)CC3)nn1C	1821777175	ACMFACAZBKJZPG-IUCAKERBSA-N	442.339	1.894	50	20	IDGD	
CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](C)CC(N)=O)CC2	1825441375	UMIPUFHUNHTTKQ-BBBLOLIVSA-N	431.356	1.740	50	20	IDGD	
Cc1ccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)cn1	1825813891	SFWOVVSYLARRKE-QFIPXVFZSA-N	435.333	1.617	50	20	IDGD	
CN[C@H](CC(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H](F)Br)CC1)C(=O)O	1826946777	ZFYYDGQIFQYNQB-NFAWXSAZSA-N	436.322	1.359	50	20	IDGD	
C[C@@H](C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2)c1ccccc1	1828230761	SBCZCFMFSDZWHX-RDTXWAMCSA-N	449.341	1.852	50	20	IDGD	
CN1CCC[C@H](C(=O)N2CCCC[C@@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)C1	1830184214	IQCHHYBVLXXKDH-VQTJNVASSA-N	435.613	1.321	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3CCCS3)C2)C1	1830545421	IYHDEUOHVVEBQP-CKEIUWERSA-N	435.384	1.369	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc([N+](=O)[O-])o2)CC1	1831869232	BYCDKOTVILTOLY-INIZCTEOSA-N	449.508	1.794	50	20	IDGD	
CCS(=O)(=O)N[C@@H](C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)C(Cl)Cl)CC1	1831875186	UXJAONXUFIAIED-JSGCOSHPSA-N	442.409	1.738	50	20	IDGD	
C[C@@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)c3cnn(C)c3)CC2)CC1	1833262606	YCWRASGHWALCSC-AWEZNQCLSA-N	440.386	1.636	50	20	IDGD	
Cn1nccc1C(=O)N1CCC(N2CCC(NC(=O)CCBr)CC2)CC1	1834421215	RTEMMOJILIARAC-UHFFFAOYSA-N	426.359	1.390	50	20	IDGD	
O=C(C#CC1(O)CCCCC1)NC1CCN(C2CCN(C(=O)[C@@H](F)Cl)CC2)CC1	1835751519	VPLGIHAUJGNJJK-LJQANCHMSA-N	427.948	1.791	50	20	IDGD	
CC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)C(C)(C)NCCC#N)CC2)CC1	1836396225	ZGXDBKRPLHACIM-SFHVURJKSA-N	426.005	1.857	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cccc4ccnn34)CC2)CC1	1836480998	IURZWWKHIWHYGY-IBGZPJMESA-N	447.967	1.773	50	20	IDGD	
O=C(c1cnc2ccccc2n1)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836717896	NBWZGNQUUXUMBQ-HXUWFJFHSA-N	446.935	1.842	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CCC(F)(F)C3)C2)C1	1837708513	ITLLPDZVFYPNGR-YJBOKZPZSA-N	434.556	1.730	50	20	IDGD	
CCc1nc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](C)CBr)C3)C2)co1	1838131662	LCFPMSGUWZWBFP-UGSOOPFHSA-N	444.326	1.338	50	20	IDGD	
CCc1nc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@](C)(Cl)CCl)C3)C2)co1	1838138634	CPVWPNQXGFKUAC-MSOLQXFVSA-N	434.320	1.543	50	20	IDGD	
O=Cc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)s1	1839199500	OZLWYDYPCUFAPT-BBRMVZONSA-N	449.298	1.321	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(O)ccc3F)CCO2)C1	1839293520	MWIWMVCKFNAJJC-HXUWFJFHSA-N	428.888	1.866	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3c(O)cc(O)cc3O)CCO2)C1	1839371761	NZKYOIHCMARBRQ-XOBRGWDASA-N	442.896	1.281	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)C[C@H]3CCCCO3)C2)C1	1839962563	KLUANUNPUOKXCV-JTDSTZFVSA-N	447.370	1.576	50	20	IDGD	
Cc1cccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)c1	1840034129	AXXCPBACWHYEOC-HNAYVOBHSA-N	425.323	1.848	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccncc3Cl)C2)C1	1840153674	XLHVYQNGGDRWFR-MAUKXSAKSA-N	432.304	1.059	50	20	IDGD	
CCOc1ncccc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840186522	AGYVQGFUTRTMSP-GOSISDBHSA-N	432.304	1.354	50	20	IDGD	
O=C(c1csc(-n2ncc3ccccc32)n1)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1	1841349590	BUYYZWVCXMVHFG-MRXNPFEDSA-N	445.932	1.899	50	20	IDGD	
Cc1c(C(=O)N2CC3(CCCN3C(=O)c3ccc(B(O)O)cc3)C2)cccc1C(F)(F)F	1843012626	IRSUQWANHCDXQI-UHFFFAOYSA-N	446.234	1.824	50	20	IDGD	
CC[C@@H](C)[C@H](O)C(=O)N1CC2(CCCN2C(=O)c2cc([N+](=O)[O-])ccc2OC(C)=O)C1	1844692013	YGTJHPMDWXIYHM-ACJLOTCBSA-N	433.461	1.744	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)c1cnccn1)C2	1844692074	CVNZDONVYOTUCT-UHFFFAOYSA-N	425.401	1.441	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC2(CCCN2C(=O)[C@H]2CC[C@@H]3CCC(=O)N3C2)C1	1845068852	UDTBGSBPURDPDM-QLFBSQMISA-N	426.355	1.622	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCCC12CN(C(=O)c1cc(=O)nc3cccnn13)C2	1846071184	BTCRXWRHHRAYPY-GFCCVEGCSA-N	434.294	1.080	50	20	IDGD	
COC(=O)[C@@H](CC(=O)N1CCCC12CN(C(=O)[C@@H](F)Cl)C2)NC(=O)OC(C)(C)C	1846304626	IJPQWZJJNCRZMS-DGCLKSJQSA-N	435.880	1.181	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC[C@H]2[C@@H]1CCN2C(=O)c1ncc(Cl)cc1Cl	1847204501	FAMYYGFKQDJNCT-HOTGVXAUSA-N	434.088	1.197	50	20	IDGD	
CS(=O)(=O)c1cncc(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)CCBr)c1	1848325303	CZFZZSQBAIZCTG-KBPBESRZSA-N	430.324	1.086	50	20	IDGD	
CS(=O)(=O)Nc1cccc(CNC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)c1	10362764	LKFZLNRUNDUDNI-UHFFFAOYSA-N	444.473	1.094	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)c2nn(-c3ccccc3)cc2OC)c2ccccc2c1=O	15720970	BQWQSWYAHAFSJY-UHFFFAOYSA-N	432.440	1.686	50	20	IDGD	
C[C@@H](SCC(=O)Nc1ccc(F)cc1)C(=O)NNC(=O)COc1ccc(C#N)cc1	15888764	ORNTVUULGKMURD-CYBMUJFWSA-N	430.461	1.984	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)ccc1F	27741206	WPNCIDKVPUCSFA-UHFFFAOYSA-N	438.437	1.839	50	20	IDGD	
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	108494044	NHOIADDARSAJKE-IBGZPJMESA-N	446.467	1.568	50	20	IDGD	
NC(=O)NCCCCCC(=O)NNC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1	726095758	PNAQRCQLOOSBCH-UHFFFAOYSA-N	435.488	1.924	50	20	IDGD	
COc1ccc(C(=O)NNC(=S)NCC2CCC2)cc1S(=O)(=O)NC1CCCC1	727866440	HZXMPYOEBPBTPA-UHFFFAOYSA-N	440.591	1.825	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)c2cccc(NC(=O)CCn3ccnc3)c2)c1	728206641	YFXMTDKVRZUQKP-UHFFFAOYSA-N	436.472	1.794	50	20	IDGD	
N#Cc1ccc(C(=O)NNS(=O)(=O)c2cc(Br)cc(C(=O)O)c2F)cc1	728506709	XWYYEWWBYWINPA-UHFFFAOYSA-N	442.222	1.781	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)CN2C(=O)[C@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2=O)c1	728528991	QMYSBZLCXRSZKN-VUKUWZNJSA-N	448.273	1.026	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)[C@H]2CCCCN2C(=O)OC(C)(C)C)n1	728730644	DEBDVUZXOLNVSV-CYBMUJFWSA-N	440.522	1.474	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc2c(c1)CCCC2)NNC(=O)Cc1ccccc1F	731344538	PRROHVULZOCHFH-UHFFFAOYSA-N	433.505	1.763	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)CNC(=O)N2CCc3ccccc3C2)cc1	731866297	KVMDZZJJWFTASF-MRXNPFEDSA-N	440.500	1.768	50	20	IDGD	
C[C@H](NC(=O)CCC(=O)NNC(=O)c1ccccn1)C(=O)c1ccc(Br)cc1	732048617	AQAQAJQQENFZCW-LBPRGKRZSA-N	447.289	1.773	50	20	IDGD	
O=C(COC(=O)c1csc(-c2cnccn2)n1)NNC(=O)c1cccc([N+](=O)[O-])c1	732337915	AJUTVKBRYAXMIP-UHFFFAOYSA-N	428.386	1.126	50	20	IDGD	
O=C(NNC(=O)[C@H]1COc2ccccc2C1)c1cccc(S(=O)(=O)N2CCCCC2)c1	732911335	UCRHWSFBFWKDCT-GOSISDBHSA-N	443.525	1.874	50	20	IDGD	
CCn1c(SCC(=O)N([C@H]2CCS(=O)(=O)C2)N(C)C)nnc1-c1cccc(C)c1	733370914	QPGMFWWFQTZVNG-INIZCTEOSA-N	437.591	1.858	50	20	IDGD	
O=C(NNc1nccnc1Cl)C1CCN(S(=O)(=O)c2cccnc2Cl)CC1	734261634	QSNXRFQUCLKQCK-UHFFFAOYSA-N	431.305	1.722	50	20	IDGD	
CCc1nn(C)c(Cl)c1C=NNC(=O)C(=O)NN=Cc1c(CC)nn(C)c1Cl	734744312	LKSPGGZBQFWMHI-UHFFFAOYSA-N	427.296	1.186	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2cccc3cccnc23)CC1	735118440	VKURLSZNOZYUTN-UHFFFAOYSA-N	426.502	1.323	50	20	IDGD	
Cc1nn(-c2cccc(C(F)(F)F)c2)c(C)c1C(=O)C(=O)NNC(=O)c1cnn(C)c1	735449994	QSOOJIZTVDHKKI-UHFFFAOYSA-N	434.378	1.885	50	20	IDGD	
COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)C1CC=CC1)N(S(C)(=O)=O)CC2	740921950	LBWMDLKINUAHMN-INIZCTEOSA-N	437.518	1.066	50	20	IDGD	
COc1cc(C(=O)NNC(=O)N[C@@H]2CCC[C@@H](S(C)(=O)=O)C2)ccc1OC(C)C	741093754	VBPMJFSPFZNAMF-HUUCEWRRSA-N	427.523	1.782	50	20	IDGD	
COc1ccc(Br)cc1C(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	741661566	VTHYDKQNCIZJEH-UHFFFAOYSA-N	431.246	1.779	50	20	IDGD	
Cc1nn(C)c2sc(C(=O)N[C@@H](C)C(=O)NNC(=O)[C@@H](C)Oc3ccccc3F)cc12	742037259	VMYMEJBWKHMCFQ-NWDGAFQWSA-N	447.492	1.816	50	20	IDGD	
CCN1C(=O)C(=CNNC(=O)c2cccc(Br)c2)C(=O)N(CC)C1=S	742216283	WQGLQTRPRBDDSF-UHFFFAOYSA-N	425.308	1.563	50	20	IDGD	
Cn1ncc2c(O)nc(CCC(=O)NNC(=O)NCc3cccc(C(F)(F)F)c3)nc21	742453028	CNYNSZCLMUNQQS-UHFFFAOYSA-N	437.382	1.551	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CN(C)CC(=O)Nc2ccc(N3CCOCC3)cc2)c1	744383713	YLNGSDNWCBPHJT-UHFFFAOYSA-N	439.516	1.163	50	20	IDGD	
CCN(CC(=O)NNC(=O)c1ccc(C#N)cc1)CC(=O)Nc1ccc(NC(C)=O)cc1	744385608	YVCBPBKTGSAQIN-UHFFFAOYSA-N	436.472	1.238	50	20	IDGD	
CCOc1ccccc1C(=O)N1CCN(CC(=O)NNC(=O)c2cccc(C#N)c2)CC1	744386629	JHUKIYNFJMIVAQ-UHFFFAOYSA-N	435.484	1.176	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)CN2CCN([C@H]3CCN(c4ccccc4)C3=O)CC2)c1	744399884	YWLQESJPLOLZLU-NRFANRHFSA-N	435.528	1.179	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2ccc(Cl)cc2)sc1Br	744463331	IOYFKXIXRWQCQC-UHFFFAOYSA-N	438.712	1.886	50	20	IDGD	
CCN(C)[C@H](C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1)c1ccccc1	744621135	RKJCLXFDLNXSQQ-FQEVSTJZSA-N	432.546	1.844	50	20	IDGD	
Cc1nn(-c2ccccc2)cc1C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	744621943	JUUQFSZKCDGYHF-UHFFFAOYSA-N	441.513	1.959	50	20	IDGD	
COc1cccc(NC(=O)COc2ccc(C(=O)NNC(=O)N3CCOCC3)cc2)c1	745992889	LLIGQWASCSRIEM-UHFFFAOYSA-N	428.445	1.399	50	20	IDGD	
O=C(NNc1nc(-c2ccccc2)no1)[C@H]1CN(Cc2nc(O)c3ccccc3n2)CCO1	746240960	DPTKMTDGBMUULC-QGZVFWFLSA-N	447.455	1.730	50	20	IDGD	
COc1ccccc1C(=O)NNS(=O)(=O)c1ccc([N+](=O)[O-])cc1Br	746598601	KAHBQRXDENSVSE-UHFFFAOYSA-N	430.236	1.989	50	20	IDGD	
O=C(CNC(=O)c1c(Cl)cccc1[N+](=O)[O-])NNC(=O)Cc1cn2ccccc2n1	746642065	UUDQPLTZPGDLDQ-UHFFFAOYSA-N	430.808	1.016	50	20	IDGD	
O=C(NNC(=O)c1cc(S(=O)(=O)N2CCCC2)ccc1Br)c1ccc[nH]1	747663344	IIWNMEYCKFILRK-UHFFFAOYSA-N	441.307	1.637	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)NCCS(=O)(=O)N2CCOCC2)c(C)n1CCC(C)C	748047482	NMUJAVDICAWALM-ZHZULCJRSA-N	436.578	1.836	50	20	IDGD	
Cc1nn(C)c(C)c1S(=O)(=O)N[C@@H](C)C(=O)NNc1ccc(Br)cc1F	748191333	KDKGIROESNSDBD-VIFPVBQESA-N	448.318	1.749	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)C(F)F)cc1)[C@]1(O)CCN(Cc2ccccc2)C1	748609968	GTXLHMQFTYEYRP-IBGZPJMESA-N	425.457	1.763	50	20	IDGD	
COc1ccccc1C1(CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)CC1	749419890	GERKABIFHVJLNP-UHFFFAOYSA-N	431.518	1.664	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1)C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	752489352	MWPSZOKOSXYTHH-DTQAZKPQSA-N	430.461	1.897	50	20	IDGD	
O=C(CCOc1ccccc1)NNC(=O)NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1	754170360	QFGVBZQPXIBNRU-UHFFFAOYSA-N	436.446	1.168	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H](C)C(C)(C)CN(C)C)c1	754376534	WWVMCPYTLYUIQD-HNNXBMFYSA-N	441.598	1.637	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNS(=O)(=O)c1ccc(C(=O)O)c(C(F)(F)F)c1	754754868	OIEIOAGCWSJXSJ-UHFFFAOYSA-N	425.385	1.018	50	20	IDGD	
O=C(NNc1ccc(C(F)(F)F)nn1)[C@@H]1CN(Cc2nc(O)c3ccccc3n2)CCO1	755198209	MXKPKVFYYYUFGQ-ZDUSSCGKSA-N	449.393	1.488	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1ncc(Cc2ccccc2Cl)s1	755475580	SYDATKWQNVFDDP-SECBINFHSA-N	431.927	1.478	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)cn2)C[C@@H](C)O1	755867099	YAUQHYABDDGAQS-OKILXGFUSA-N	447.517	1.565	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=O)CCc2ccccc2O)cc1S(=O)(=O)NC1CC1	757872585	BMADODUEPJPRMJ-UHFFFAOYSA-N	432.502	1.927	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)[C@H](Sc1ccc(F)c(F)c1)c1ccccc1	758035870	ODEGYRWZVFXURB-BDJLRTHQSA-N	443.497	1.883	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1ccnn1-c1cc(C)ccn1	760277628	NYVFHXOIYYLOAY-UHFFFAOYSA-N	428.836	1.637	50	20	IDGD	
O=C(NNc1nccc(N2CCOCC2)n1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-]	762868218	MXMNQLOFGBHQCS-UHFFFAOYSA-N	442.354	1.919	50	20	IDGD	
COc1ccc(NC(C)=O)cc1S(=O)(=O)NNC(=O)CSc1ccccc1O	763410830	AJEXCEQEHCNUOL-UHFFFAOYSA-N	425.488	1.461	50	20	IDGD	
COC(=O)c1cc(Cl)ccc1NC(=O)C(=O)NNC(=O)c1ccc(OC)c(OC)c1	763550681	JRNATYJWJAOPIA-UHFFFAOYSA-N	435.820	1.544	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)C(=O)Nc1ccc([S@](=O)C(F)(F)F)cc1	763550728	GCPXBDJOUYMUTN-PMERELPUSA-N	443.359	1.442	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)C(=O)Nc1cc(F)c(Br)cc1F	763550923	IZIJNFLTIKMHBB-UHFFFAOYSA-N	442.172	1.856	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cc(NC(=O)C(=O)NNC(=O)C2CC2)ccc1C	763557029	ABUUSXQMIZWDBC-UHFFFAOYSA-N	446.485	1.300	50	20	IDGD	
COCCOc1c(Cl)cccc1NC(=O)C(=O)NNC(=O)[C@H]1COc2ccccc2O1	763570583	GJJWYQADOXJPPD-MRXNPFEDSA-N	449.847	1.291	50	20	IDGD	
CCOC(=O)/C=C/c1ccc(NC(=O)C(=O)NNC(=O)c2c(C)nc3ccccn23)cc1	763630225	WLFKEWLVFJWMEB-FMIVXFBMSA-N	435.440	1.619	50	20	IDGD	
CCOC(=O)c1c(F)cccc1NC(=O)C(=O)NNC(=O)COc1ccc(C)c(C)c1	763680618	RVQQUVMUUHLWDZ-UHFFFAOYSA-N	431.420	1.784	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)COc2ccccc2F)c(OC[C@H]2CCCO2)c1	763681786	QODGQWVAEPBELO-OAHLLOKOSA-N	445.447	1.857	50	20	IDGD	
CC(=O)N1CCCc2cc(NC(=O)C(=O)NNC(=O)COc3ccccc3F)ccc21	763681987	ZAMHNFOYLJTUKF-UHFFFAOYSA-N	428.420	1.290	50	20	IDGD	
COc1ccc(CN(C)C)cc1NC(=O)C(=O)NNC(=O)COc1ccc(Cl)cc1	763686944	XISSDXMBZHWKGE-UHFFFAOYSA-N	434.880	1.575	50	20	IDGD	
CN(C)C(=O)COc1cccc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CCC3)c1	763774797	GGHJTZIYISKMEE-UHFFFAOYSA-N	430.486	1.104	50	20	IDGD	
Cc1cnc(-c2cccc(NC(=O)C(=O)NNC(=O)COc3ccccc3[N+](=O)[O-])c2)o1	763804936	XYDQMLYZGIVTFL-UHFFFAOYSA-N	439.384	1.723	50	20	IDGD	
C[C@@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)COc3ccc(F)cc3)cc2)C[C@@H](C)O1	763840835	YMBNGQDKGMJRTC-HUUCEWRRSA-N	444.463	1.604	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ncn(C3CCCCC3)n2)cc1	763862129	UQNBOISTAPLXGI-CQSZACIVSA-N	444.492	1.735	50	20	IDGD	
Cc1nc(C)n(-c2ccccc2NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)n1	763867989	ZOEGWWNJOTWNKX-LBPRGKRZSA-N	440.435	1.577	50	20	IDGD	
Cc1cc(Cl)cc(C)c1O[C@H](C)C(=O)NNC(=O)C(=O)Nc1cccc(C(N)=O)c1	763883478	OQCSFJYUMQNZMU-GFCCVEGCSA-N	432.864	1.609	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2cccc(C(N)=O)c2)ccc1OCCC(C)C	763913899	DPHQPNYQZCJPCW-UHFFFAOYSA-N	442.472	1.619	50	20	IDGD	
CN(C)CC1CCN(c2ccc(NC(=O)C(=O)NNC(=O)Cc3ccsc3)cc2)CC1	764025942	RYZUDKPQJDVCHN-UHFFFAOYSA-N	443.573	1.855	50	20	IDGD	
O=C(NNC(=O)c1cccc(C(F)(F)F)c1)C(=O)Nc1cccnc1N1CCOCC1	764041140	USUHYVXQVJNDPO-UHFFFAOYSA-N	437.378	1.337	50	20	IDGD	
O=C(NNC(=O)c1ccc(Cl)nc1)C(=O)Nc1ccccc1C(=O)N1CCCCC1	764093983	ZWZDKGYPWLDGTN-UHFFFAOYSA-N	429.864	1.761	50	20	IDGD	
COC(=O)CCCOc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)cc1	764116172	BMWIIWCKAYAAJO-UHFFFAOYSA-N	449.847	1.777	50	20	IDGD	
CCOC(=O)c1cc(CC)sc1NC(=O)C(=O)NNC(=O)c1cccc(OC)c1O	764130917	BNYJKYWHQFTELJ-UHFFFAOYSA-N	435.458	1.601	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)Nc2ccccc2OC[C@@H]2CCCCO2)c1O	764131795	OJOBWTMKEPITFQ-AWEZNQCLSA-N	443.456	1.748	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)C(=O)N2CCc3ccc(Br)cc32)c1O	764132090	JKNBGIKEWJEOKO-UHFFFAOYSA-N	434.246	1.514	50	20	IDGD	
CCCc1c(NC(=O)C(=O)NNC(=O)c2scnc2C)cnn1-c1cc(C)ccn1	764245266	BZBOMCYZKOVOLZ-UHFFFAOYSA-N	427.490	1.693	50	20	IDGD	
C[C@@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3cccc4ncccc34)cn2)C[C@@H](C)O1	764258081	USGBCHOHYAXXLK-HUUCEWRRSA-N	448.483	1.643	50	20	IDGD	
CN1CCc2ccc(NC(=O)C(=O)NNC(=O)c3cc(Br)ccc3O)cc21	764279753	DUBPHSQHKNOMBS-UHFFFAOYSA-N	433.262	1.547	50	20	IDGD	
COC(=O)C(C)(C)c1ccc(NC(=O)C(=O)NNC(=O)CCc2ccccc2O)cc1	764281390	WCPLDCPEJRXTHO-UHFFFAOYSA-N	427.457	1.562	50	20	IDGD	
CCOC(=O)C(C)(C)n1cc(NC(=O)C(=O)NNC(=O)c2cc3ccccc3o2)cn1	764330874	LHQISZJBWJGUGO-UHFFFAOYSA-N	427.417	1.327	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)C(=O)Nc2cc(Cl)cc3cccnc23)c1	764430730	MWMVBTGEGOEOIK-UHFFFAOYSA-N	426.820	1.641	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)/C=C\c3ccc4c(c3)OCO4)CC2)cc1	765748416	DDKXTCRQZIPTQU-CLFYSBASSA-N	436.512	1.702	50	20	IDGD	
COc1cc(C#N)ccc1NC(=O)C(=O)NNC(=O)COc1ccc(Br)cc1	766258399	FSHBWTXWRJNCKB-UHFFFAOYSA-N	447.245	1.494	50	20	IDGD	
CC(C)CN1N=C(C(=O)NNC(=O)[C@H](C)Oc2cccc(Br)c2)CCC1=O	766340294	YDWKOCSYNIAVMI-LBPRGKRZSA-N	439.310	1.998	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)[C@]1(F)CCN(C(=O)OC(C)(C)C)C1	767375787	QZEAKQVAIPMRQK-NRFANRHFSA-N	437.468	1.577	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(F)(F)c2ccc(OCC(=O)N(C)C)cc2)c1	769353858	JQENTQPWRSMIQB-UHFFFAOYSA-N	435.427	1.780	50	20	IDGD	
CCOc1cc([N+](=O)[O-])c(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1OC	769596742	JHOOJPONXBNBLD-UHFFFAOYSA-N	427.377	1.053	50	20	IDGD	
CC(C)[C@H](CNC(=O)NNC(=O)[C@H](C)Oc1cccc(Cl)c1)N1CCN(C)CC1	770127241	CRXJJDOWSWVMEY-YJBOKZPZSA-N	425.961	1.710	50	20	IDGD	
CC1(C)[C@@H](OCc2ccccc2)C[C@H]1NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	770305138	DVJOETNDTKKWIG-MOPGFXCFSA-N	435.488	1.990	50	20	IDGD	
C[C@H]1CN(c2ccnc(C(=O)NNC(=O)c3csc(N4CCOCC4)n3)c2)C[C@@H](C)O1	770813541	KJZGUHDNRJHSKH-OKILXGFUSA-N	446.533	1.063	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1cccc(S(=O)(=O)N2CCCC[C@H]2C)c1	771939206	MKVQYEASPPGIMG-ZIAGYGMSSA-N	425.507	1.352	50	20	IDGD	
COc1cn(-c2ccccc2)nc1C(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772194695	CAKGCFKXWZJDSD-UHFFFAOYSA-N	427.848	1.612	50	20	IDGD	
O=C(COc1ccc(N2CCCC2=O)cc1)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772196357	YIIOWPWMPPMCNX-UHFFFAOYSA-N	444.875	1.309	50	20	IDGD	
COc1ncc(/C=C\C(=O)NNC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)cn1	773857393	JMXAYJOUBCEUSK-DAXSKMNVSA-N	444.923	1.117	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)n(C)c(=O)n2C	774008988	NMLCYPWFWQZEEX-NSHDSACASA-N	445.863	1.084	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)CNC(=O)c2cccc([N+](=O)[O-])c2)C1	774269605	FVRMJPRTEBAUJJ-AWEZNQCLSA-N	449.464	1.119	50	20	IDGD	
C[C@@H](NS(=O)(=O)c1ccc(C(N)=O)cc1)C(=O)NNc1ncc(Cl)cc1Cl	775271782	QYXPVSCRQQNOOA-MRVPVSSYSA-N	432.289	1.297	50	20	IDGD	
CN(C)N(C(=O)[C@]1(F)CCN(C(=O)OCc2ccccc2)C1)[C@H]1CCS(=O)(=O)C1	776750270	OWFJOSZAQIUPSP-LPHOPBHVSA-N	427.498	1.230	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)NC[C@H]1COC2(CCOCC2)O1	777761591	VPBHVCNYAYSTMT-KXBFYZLASA-N	429.473	1.860	50	20	IDGD	
O=C(NNC(=O)C(=O)Nc1ccccn1)N[C@H]1CCN(c2ccc(Cl)c(Cl)c2)C1	779378135	PSUARDHKIVXDPS-NSHDSACASA-N	437.287	1.936	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@H]2CC(C)(C)OC2(C)C)cc1	779384982	PVQPPJQSTHQXAK-HNNXBMFYSA-N	426.539	1.292	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@]2(C[C@H]2C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)C1	780601436	VQRQLDSLWLMOAS-AOMKIAJQSA-N	444.536	1.488	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@]2(C[C@@H]2C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)C1	781285907	NUCKSPINOXMMLX-ZHRRBRCNSA-N	442.472	1.510	50	20	IDGD	
CCOc1cc(N2CCOC(C)(C)C2)ccc1NC(=O)C(=O)NNC(=O)c1ccc[nH]1	782121105	SQRIEZAMUISEQI-UHFFFAOYSA-N	429.477	1.428	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1cc(-c2cnn(C)c2)ccc1F	782537376	IRFMWHJURFKVNT-UHFFFAOYSA-N	444.492	1.903	50	20	IDGD	
COCCS(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ncccc2C(F)(F)F)cc1	783121181	FXBKHYWCRISARR-UHFFFAOYSA-N	446.407	1.602	50	20	IDGD	
CN(C)C(=O)C[C@@H]1CN(C(=O)C(=O)NNc2cncc(Cl)n2)c2ccc(Cl)cc21	783259590	FWZHYNOSOPZXCE-SNVBAGLBSA-N	437.287	1.835	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2ccc3nc(-c4ccccn4)oc3c2)CCS(=O)(=O)C1	783426581	NSFWMUNJJKTDJK-IBGZPJMESA-N	429.458	1.026	50	20	IDGD	
COC(=O)c1sccc1NC(=O)C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	784210488	QQSIMLLIBFQGGZ-UHFFFAOYSA-N	438.487	1.057	50	20	IDGD	
CN1CCN(C(=O)c2ccc(NC(=O)C(=O)NNc3ccc(OC(F)F)cc3)cc2)CC1	784313345	KLELKEHQNXHMDC-UHFFFAOYSA-N	447.442	1.757	50	20	IDGD	
COc1cccc(NNC(=O)C(=O)Nc2ccc(S(=O)(=O)NCCC(C)C)cc2)n1	784844068	SUKRDEAWPIJRHG-UHFFFAOYSA-N	435.506	1.496	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)C(=O)Nc2cc(N3CCNC3=O)ccc2C)cc1	787544940	ZHWCUPKCICZBBG-UHFFFAOYSA-N	441.513	1.711	50	20	IDGD	
CCN(CC)Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1	787893078	FZGINDJWTDAYOL-IBGZPJMESA-N	426.473	1.454	50	20	IDGD	
CN(NS(=O)(=O)c1cc(F)ccc1F)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	788914705	DQBPIRNQLNLNMC-UHFFFAOYSA-N	434.465	1.763	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)N[C@H]2CCN(Cc3ccc(C)cc3)C2=O)cc1OC	790697917	OPUUQPKHVSQWSQ-KRWDZBQOSA-N	426.473	1.757	50	20	IDGD	
CNS(=O)(=O)c1ccc(NC(=O)NNC(=O)COc2cc(C)ccc2C(C)C)nc1	792399424	CLTCEWCOPXOULN-UHFFFAOYSA-N	435.506	1.653	50	20	IDGD	
O=C(CCc1cnccn1)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	792853170	RCLMMIZSXXYFBT-UHFFFAOYSA-N	431.499	1.733	50	20	IDGD	
O=C(NNc1ccc(-n2cccn2)nn1)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1	793042549	OGYGKKZNMIFBRF-UHFFFAOYSA-N	447.209	1.415	50	20	IDGD	
CSSCCNC(=O)C(=O)Nc1cc2c(cc1N1CCCCC1)n(C)c(=O)n2C	793080264	KDAAWBOLZCSJLK-UHFFFAOYSA-N	437.591	1.933	50	20	IDGD	
Cc1cc(NNC(=O)[C@](C)(O)CN2C(=O)NC3(CCCC3)C2=O)ccc1Br	793712491	VEPWWMJLNRPNNX-QGZVFWFLSA-N	439.310	1.816	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCN(c3cccc(F)c3)C[C@H]2C)cc1OC	795189434	QWRDMQGYFUNOBQ-OAHLLOKOSA-N	430.480	1.815	50	20	IDGD	
Cc1nc2cc(F)c(F)cc2n1CC(=O)OCC(=O)NNC(=O)c1ccc(C#N)cc1	796007362	GZTADOIZSOMDHW-UHFFFAOYSA-N	427.367	1.499	50	20	IDGD	
COc1ccccc1O[C@H]1CCCN(CC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)C1	796568122	ULETWWJFXSKMGX-KRWDZBQOSA-N	428.445	1.908	50	20	IDGD	
Cc1ccc(-c2ccc(Cl)cc2NC(=O)C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)o1	796999215	JSXFNPYBPGZJBI-LLVKDONJSA-N	439.877	1.429	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NN=C1CCCc2cccnc21	799104949	YDHKHAUPFZLCCL-UHFFFAOYSA-N	442.541	1.892	50	20	IDGD	
CCOC(=O)c1cc(C=NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)[nH]c1C	799483966	ZALZYAYLROLLKM-UHFFFAOYSA-N	425.489	1.408	50	20	IDGD	
CCOc1cccc(S(=O)(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)c1	799914291	JEUGFQGZYWGRER-UHFFFAOYSA-N	426.520	1.310	50	20	IDGD	
CN1CCC(=O)Nc2cc(C(=O)NNC(=O)Nc3ccc(S(C)(=O)=O)cc3)ccc21	802068240	GFZPSDOQZVVRSC-UHFFFAOYSA-N	431.474	1.335	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)[C@H](C(C)C)N2CCCS2(=O)=O)cc1Cl	802077026	FNIWDXPXZFQOOT-HNNXBMFYSA-N	448.929	1.570	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccc(NC(=O)CC(F)(F)F)cc1	802566989	KJCSLNKCHVHBQD-UHFFFAOYSA-N	438.362	1.986	50	20	IDGD	
CC(C)(C)OC(=O)N1CCOC[C@H]1CC(=O)NNC(=O)CSc1ccccc1O	802941494	BYZPCEFGDWETRQ-CYBMUJFWSA-N	425.507	1.658	50	20	IDGD	
Cc1ccc(C(=O)NNc2ccc(-n3ccnc3)nn2)cc1S(=O)(=O)NC1CCCC1	804955971	ZYOYANMYINUHCU-UHFFFAOYSA-N	441.517	1.949	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2cc(C)cc(I)c2)n1	806984498	WMNCDPCCYWVHIL-UHFFFAOYSA-N	427.202	1.480	50	20	IDGD	
O=C(NNc1ccc(-n2ccnc2)nn1)C(=O)Nc1cc(F)cc(F)c1Br	807429832	WVZHPAAGQQNGSJ-UHFFFAOYSA-N	438.192	1.785	50	20	IDGD	
C[C@H]1CN(c2ccc(NC(=O)C(=O)NNc3nccnc3C3CCC3)cn2)C[C@H](C)O1	807460334	OAMIPHDKCHFDKI-KBPBESRZSA-N	425.493	1.835	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@@H]2C[C@@H](c3ccccc3)OC2=O)cc1	809557826	HOSQFLQECQJYOV-ROUUACIJSA-N	445.497	1.067	50	20	IDGD	
Cn1cnc(C(=O)NNC(=O)CCN2CCN(C(c3ccccc3)c3ccccc3)CC2)n1	809946399	VATVXMCVLFKUMB-UHFFFAOYSA-N	447.543	1.373	50	20	IDGD	
Cc1ccc(CCC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)s1	809957810	ZUHXTFDYLDKYRH-UHFFFAOYSA-N	437.543	1.471	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3c[nH]nc3-c3ccccn3)cc2)CC1	810341702	PRXQMXHAZAMDIW-UHFFFAOYSA-N	441.517	1.165	50	20	IDGD	
CC(=O)c1cccc(S(=O)(=O)NCC(=O)NNC(=O)c2cccc(OC(F)F)c2)c1	810344074	DGAGOFXMSPDZKY-UHFFFAOYSA-N	441.412	1.230	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2cnc(C(F)(F)F)cc2C)cc1OC	810385686	WHVOMGRTHORWBM-UHFFFAOYSA-N	426.351	1.826	50	20	IDGD	
COCCOCc1ccc(CNC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1	812917718	FLGKNIONKMPPMZ-UHFFFAOYSA-N	435.502	1.397	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@H]2NC(=O)NNC(=O)COc1ccccc1O	813802792	SPBACJWOXLUCEK-MRXNPFEDSA-N	434.493	1.891	50	20	IDGD	
COCc1cc(NC(=O)C(=O)NNc2ccc(Br)cn2)cc(C(=O)OC)c1	815596029	IMMMZWCCKJSJNE-UHFFFAOYSA-N	437.250	1.859	50	20	IDGD	
CCOc1cc(C(=O)NNS(=O)(=O)N=S2(=O)CCCC2)cc(OCC)c1OCC	821123804	HCJHDVPBNWGAIP-UHFFFAOYSA-N	449.551	1.624	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)Cn1nnc(-c2ccccc2)n1	849202134	SWHORVBPQBOMRG-GFCCVEGCSA-N	445.277	1.718	50	20	IDGD	
COc1ccccc1NCC(=O)NNC(=O)[C@@H]1CC(=O)N(Cc2ccccc2Cl)C1	849366624	QJTJHDJQTUNPOJ-OAHLLOKOSA-N	430.892	1.957	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)CN2CCN(C(=O)c3cccc(Cl)c3)CC2)n1	893695480	XRBINOJTKKWCCU-UHFFFAOYSA-N	435.937	1.253	50	20	IDGD	
CCCCn1c(=O)nc(O)c2c1nc(CCC(=O)NNc1ncccn1)n2CC(C)C	913043908	HDMFTEIOOADDIF-UHFFFAOYSA-N	428.497	1.621	50	20	IDGD	
CSCC[C@H](NS(=O)(=O)c1ccccc1F)C(=O)NNC(=O)c1ccccc1C	913263981	SSBQAROCBGZLLM-INIZCTEOSA-N	439.534	1.995	50	20	IDGD	
O=C(NCCc1cnn(-c2ccccc2)c1)NNC(=O)c1csc(N2CCOCC2)n1	914542584	ASLDABYVLQNUFJ-UHFFFAOYSA-N	441.517	1.352	50	20	IDGD	
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC(=NNC(=O)[C@H](C)CN2CCCCCC2)CC1	914555255	MDSWCSHFNDNCIC-OAHLLOKOSA-N	438.598	1.795	50	20	IDGD	
Cn1cc(S(=O)(=O)N2CCCCC2)cc1C(=O)NNC(=O)c1cc2c(s1)CCC2	914846520	NSWINOPIHKXZPU-UHFFFAOYSA-N	436.559	1.825	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)[C@H](Cc2cccc(F)c2)n2nnnc2C)cc1OC	915685808	LWILIAZHKVFRKV-INIZCTEOSA-N	428.424	1.383	50	20	IDGD	
COCCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2OC)c1	915879691	ZOEAQCXVWATUMJ-UHFFFAOYSA-N	436.490	1.477	50	20	IDGD	
CCC(=O)N[C@@H](C)C(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2OC)c1	916142287	FYWVACZLRKUMOZ-ZDUSSCGKSA-N	448.501	1.172	50	20	IDGD	
CC(C)OC(=O)CCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	916220157	ZWROTGHNAGYYFC-UHFFFAOYSA-N	440.522	1.147	50	20	IDGD	
Cn1ccnc1[C@H](NC(=O)NNC(=O)COc1ccccc1[N+](=O)[O-])c1ccccc1F	916224853	VQRCJGPRQCTYKO-GOSISDBHSA-N	442.407	1.966	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2cccc(C(=O)NC3CC3)c2)c1	916649337	YJCIPJBDJZKZFR-UHFFFAOYSA-N	430.486	1.127	50	20	IDGD	
Cc1nc2c(C(N)=O)cnn2c(C)c1CCC(=O)NNC(=O)[C@H](C)Oc1ccccc1F	916728052	WXQVFTXONFOQQF-ZDUSSCGKSA-N	442.451	1.132	50	20	IDGD	
CCn1c(=O)c(=O)[nH]c2cc(C(=O)NNC(=O)c3cc(-c4ccc(C)cc4)[nH]n3)ccc21	917176282	ZWCJWABPKYHSTK-UHFFFAOYSA-N	432.440	1.483	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)[C@@H]2CCCN(S(=O)(=O)c3ccc(C)s3)C2)c(O)c1	918337508	OMIAVAVSTVIGHO-CQSZACIVSA-N	437.543	1.932	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)N[C@H](CN1CCOCC1)c1ccc(C)cc1	919902424	MIGNFQBALXJHQM-HXUWFJFHSA-N	426.517	1.950	50	20	IDGD	
C[C@@H](OC[C@@H]1CCCCO1)C(=O)NNC(=O)c1ccc(CSc2nncn2C)cc1	921165803	YELOQUSHRFJTAT-PBHICJAKSA-N	433.534	1.843	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)CNC(=O)c1cc(Cl)ccn1	1318527626	BPTBVOMQRIUNIE-UHFFFAOYSA-N	439.925	1.685	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)NCCCNC(=O)C2CCC2)CC1	1318989761	BJMNBGKABOCOLN-UHFFFAOYSA-N	425.530	1.270	50	20	IDGD	
COC(=O)c1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)o1	1319290119	QLXJYQASCASCBS-UHFFFAOYSA-N	435.458	1.316	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnc4[nH]ncc4c3)C2)C1	1778416950	UAAZZUGKCWHDNT-ROUUACIJSA-N	426.304	1.638	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@]2(C1)CN(C(=O)Cc1cccnc1Cl)CCO2	1779294661	WGSQPQUODXFKQT-LJQANCHMSA-N	425.989	1.959	50	20	IDGD	
COc1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](O)CCl)C3)cc(Cl)n1	1779881717	BQJQVZPFLOOITH-PJIJBLCYSA-N	446.331	1.471	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCc1cn[nH]c1)C2)[C@H](F)Br	1780771164	UJUREQJUQHDRPD-UKPHBRMFSA-N	431.306	1.547	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)Cc3ccc(C(=O)OC)s3)C2)C1	1780900275	OIKHCZTXXWDSNB-AUUYWEPGSA-N	428.938	1.925	50	20	IDGD	
Cn1cncc1C(=O)N1CCO[C@]2(CCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1	1782863478	CMWRCHZHEBJCJI-AGBQBWRISA-N	441.438	1.749	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(CCN(C(=O)C3CCC4(CC3)OCCO4)C2)C1	1782938149	GUMPMJDISQYYQP-GOSISDBHSA-N	445.354	1.535	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)/C=N/N3CCCCC3)CCO2)C1	1783348829	BIVHKBHUGLQLKO-VZCCDBLZSA-N	429.359	1.462	50	20	IDGD	
O=C(CCBr)N1CCO[C@@]2(CCN(C(=O)[C@@H]3CCc4ccccc4O3)C2)C1	1783838141	GDKDKZHIAWLLCP-PXNSSMCTSA-N	437.334	1.995	50	20	IDGD	
O=C(CCN1Cc2ccccc2C1=O)N1CCO[C@@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783948221	XWZPEPDQDZLIED-FQEVSTJZSA-N	440.327	1.666	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]3C2)cc(O)n1	1783965738	OHUUVGBZQYDVQM-MZGVZZPPSA-N	440.338	1.720	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(C(N)=O)cc3)C2)C1	1784925710	WAEVMXJTVGUHBM-YJYMSZOUSA-N	438.322	1.260	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)Cn3cccn3)[C@H]2C1	1785445214	WUEIVLJFFIRYLE-QXKUPLGCSA-N	427.343	1.282	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CNC(=O)c3ccco3)[C@H]2C1	1787080782	LCTCCSGJJKTLAJ-MPTYRVRUSA-N	425.913	1.397	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)c1ccc2n[nH]cc2c1	1787302971	VOAHNYUDGCWAAL-DLKVLKDVSA-N	439.285	1.847	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]2C1)[S@](=O)c1ccccc1	1787450675	TVZCJJVBDQJBQR-HNQNNMDFSA-N	430.929	1.697	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3Cc4ccccc4CN3)[C@H]2C1	1787453832	ZRZSRUQHHHITCP-BURNTYAHSA-N	445.636	1.532	50	20	IDGD	
Cn1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)C(Cl)Cl)C[C@@H]32)c(C(F)(F)F)n1	1788900507	YDTKOVWEEQCADJ-QXEWZRGKSA-N	443.253	1.836	50	20	IDGD	
CC[S@@](=O)CCC(=O)Nc1ccc(C2(NC(=O)CCC(=O)NN(C)C)CCC2)cc1	1789424447	KRTZZEPNRWHZLS-SSEXGKCCSA-N	436.578	1.652	50	20	IDGD	
CSCC[C@H](O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]2C1	1789872279	FVWIXYZUIFPWQF-DEEHTKSCSA-N	427.394	1.316	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)c1cnn2c1OCCC2	1790370528	QAFIWNGIVHLPIT-QEJZJMRPSA-N	441.326	1.044	50	20	IDGD	
C[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21)[S@@](=O)c1ccccc1	1790601273	XOGAUMAVJZATDX-DYFDTACBSA-N	447.384	1.966	50	20	IDGD	
CCC(C)(C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C[C@@H]21	1790840124	KSCDJQOTYWXNQS-SMKMMKTPSA-N	431.537	1.536	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ncn(C(C)C)n3)C[C@@H]21	1790961836	RLGIKBFFCFMVBY-XQLPTFJDSA-N	442.358	1.626	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CCC[C@@H](C(=O)OC)C3)C[C@@H]21	1791257389	CPYNVTLPAINZSM-ZMSHIADSSA-N	444.956	1.199	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3ccc(OC)c(F)c3)[C@H]2C1	1791746003	IJBVXHMMKIXTJB-FPXQBCRKSA-N	442.915	1.610	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](F)Cl)C3)[C@H](O)C1	1792516650	JWFNZGAILSNMQH-VNAATALASA-N	447.935	1.777	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)COc1ccc(O)cc1	1792778549	NYQBQXNYGGQENV-JRATXPSKSA-N	427.295	1.144	50	20	IDGD	
Cc1nc(F)ccc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)CBr	1792872680	WFBYWLQKHOKUEQ-YGSHXTJESA-N	428.302	1.763	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Oc1ccccn1)C2	1792873110	LWJAADFXWXQRGG-SVZOTFJBSA-N	440.338	1.470	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCCC(=O)OC(C)(C)C	1793023596	JCCAGDSPAZXEEX-KRXQYRFLSA-N	432.945	1.342	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)NC(=O)c1ccccc1)C2	1793455165	CVRWAHYKDDUZIQ-GYFISPQKSA-N	435.952	1.802	50	20	IDGD	
C[C@H](Nc1ccccn1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCBr	1795115983	ZCKNZWVIPMOJLV-ZJOBFFGXSA-N	425.327	1.257	50	20	IDGD	
Cc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCBr)C3)ncc1[N+](=O)[O-]	1796600230	QMAMDGVZLATPJZ-DRXBFXEBSA-N	441.282	1.286	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccn2c(O)nnc12)[C@H](F)Br	1796726290	QZXMGZHAGREOGU-WYFGTUCQSA-N	426.246	1.377	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1cncc2cnccc12	1798458058	BNBYHRLNGYUNRK-VZAMPYOESA-N	437.269	1.524	50	20	IDGD	
CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc3sc(C)cn3c1=O)C2	1799268309	UFVBGFGOUFSRGQ-NEBZKDRISA-N	438.937	1.285	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccccc1-n1nccn1	1799670970	CYYUFGXUVKJVIY-CWPLJXCYSA-N	443.580	1.322	50	20	IDGD	
CN1CC(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)/C(C#N)=C/c2ccc(F)cc2F)C1	1800334474	SAAUJPCFDMDUIB-HTVRTGGUSA-N	430.455	1.023	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](O)Cc1ccccc1	1800637869	VEFWHKPJYKNCHH-ADHGMGHFSA-N	439.350	1.353	50	20	IDGD	
COc1cc(F)ccc1CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)Br	1800764114	VKXVBXUDFVVOJM-NASWQRNTSA-N	443.313	1.750	50	20	IDGD	
CC(C)(CCl)C(=O)N1CC[C@@H](CNC(=O)CCN2C(=O)C=CC2=O)[C@H]1c1cccnc1	1803911613	BUBXJKBFQRNALT-OXJNMPFZSA-N	446.935	1.668	50	20	IDGD	
O=C(CSc1ccncc1)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1	1804351026	NGFPTDZYXBRZPQ-KVSKMBFKSA-N	434.949	1.874	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)c1n[nH]c(C2CC2)c1F	1805124582	WZFNCMRKHHYFIS-PMUMKWKESA-N	435.887	1.741	50	20	IDGD	
CN(C)c1cccc(OCC(=O)N2CCC3(CCCN(C(=O)[C@H](O)CCl)C3)CC2)c1	1805516811	BOEMIKAUFIITGO-LJQANCHMSA-N	437.968	1.962	50	20	IDGD	
O=C(CN1CCCC1=O)NC[C@@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1	1806921962	XUOBRFLNAJEANN-HNAYVOBHSA-N	437.338	1.495	50	20	IDGD	
O=C(O)c1cc(C(=O)N2CCC3(CCCN(C(=O)CCBr)C3)CC2)ncn1	1809065456	NOUSZKSVSJIXGY-UHFFFAOYSA-N	439.310	1.805	50	20	IDGD	
CC[S@](=O)CCC(=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@H]1c1cccnc1	1810122847	HLSBSTYLEXXMIS-AJLLYPPHSA-N	448.358	1.937	50	20	IDGD	
Cn1cccc(C(=O)N2CC[C@H](CNC(=O)CO[Si](C)(C)C)[C@@H]2c2cccnc2)c1=O	1810541964	WZTDPXZETFHQEO-XLIONFOSSA-N	442.592	1.951	50	20	IDGD	
COc1cc(C(=O)N2CC[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]2c2cccnc2)nn1C	1810543705	DUXYDFZINYVBRD-OXJNMPFZSA-N	445.596	1.995	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2cnn3c2CCC3)[C@@H]1c1cccnc1	1812143733	CWESGBNBILVOTP-IEZWGBDMSA-N	431.924	1.798	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)CNC(C)=O)[C@H]1c1cccnc1	1812779303	SCCXURWGJNJBAU-ZOBUZTSGSA-N	425.327	1.397	50	20	IDGD	
C[C@H](C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)n1cccc1	1813309519	NLMDEKLYPHASGL-AGHHOFFYSA-N	446.316	1.144	50	20	IDGD	
CSCC(C)(C)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1	1815349960	ANOFFLBUDGCMHN-CQSZACIVSA-N	447.391	1.438	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@@H](F)Br)[nH]n1)c1ccc(O)nn1	1816297869	JZGUQVQIQFULHZ-ZWNOBZJWSA-N	427.234	1.902	50	20	IDGD	
CCn1nccc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1	1816562214	RNJVKWWQSHDZKR-HNNXBMFYSA-N	430.513	1.305	50	20	IDGD	
C[C@@H](C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1)c1ccccn1	1817479999	YZJZLIVOXOZRON-QRWLVFNGSA-N	447.304	1.594	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H]2CCCCO2)[nH]n1	1819400438	KRIKIQCGUSBWNC-DLBZAZTESA-N	441.492	1.283	50	20	IDGD	
N#CC1(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cnccc3C(=O)NN)n[nH]2)CCC1	1819404714	VJQJYBPUBISAJK-MRXNPFEDSA-N	436.476	1.408	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1ccccc1F	1820409060	NAUSLCKSFJJPLA-LJQANCHMSA-N	436.252	1.848	50	20	IDGD	
COc1ccc(C(=O)N[C@@H]2CCc3nc(NC(=O)[C@@H](F)Br)sc3C2)nn1	1823006486	GIJVZJSXINWBAD-JMCQJSRRSA-N	444.286	1.858	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)C[C@](C)(O)CC(=O)O)CC2	1825647076	IMPPKNHKFJQMMI-DRTKUVKGSA-N	448.339	1.454	50	20	IDGD	
CCc1oncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1	1826170695	HEDRYNCVJSJORS-FQEVSTJZSA-N	439.321	1.464	50	20	IDGD	
CCn1nccc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827051164	OSDYIVUMGQDYRL-FQEVSTJZSA-N	438.337	1.130	50	20	IDGD	
O=C(C#Cc1ccccc1)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827054487	BLTZMHXTZCSLLY-XMMPIXPASA-N	444.340	1.651	50	20	IDGD	
O=C(c1c(Cl)cncc1Cl)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1829599132	OECKVCJGGDPRLH-CJNGLKHVSA-N	440.686	1.993	50	20	IDGD	
COc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)cn1	1830353934	MXGPJEVKNCYBMQ-FQEVSTJZSA-N	425.913	1.425	50	20	IDGD	
CCS(=O)(=O)CC(=O)N1CCC([C@H]2CCCCN2C(=O)[C@H](F)Br)CC1	1830375522	DQFFYJSFFPLPPL-HIFRSBDPSA-N	441.363	1.731	50	20	IDGD	
C=CCC(F)(F)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](C)CBr)CCO2)C1	1830544179	PNCZOWNQNWQCES-CZUORRHYSA-N	439.297	1.685	50	20	IDGD	
O=C(CCCc1ccccc1F)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1	1830692397	XWBIMFYOHIELJX-RXVVDRJESA-N	442.915	1.205	50	20	IDGD	
CC[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)Br)C2)C1)N(CC)CC	1831674128	CTHXDJJMMGMQLN-GPMSIDNRSA-N	448.402	1.347	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CSCC(=O)OC)CC1	1831828962	WGICANJPAHVKKU-CVEARBPZSA-N	434.986	1.766	50	20	IDGD	
Cc1noc(C)c1CC(=O)N1CCO[C@@]2(COCCN(C(=O)CCBr)C2)C1	1832552277	BDMJUNQIOPDSPC-GOSISDBHSA-N	444.326	1.075	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3nnc(C)s3)CCO2)C1	1833020878	QNIWHSCXMFQBLP-KSSFIOAISA-N	430.958	1.253	50	20	IDGD	
O=C(CCc1ccco1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1833051290	REZSRZONASUNSE-RDJZCZTQSA-N	433.274	1.359	50	20	IDGD	
CC1(C(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)CCCC1	1833124715	AWBFVEVJKSGCPD-UHFFFAOYSA-N	441.381	1.132	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3cnc4ccccc4n3)CC2)CC1)[C@@H](O)CCl	1833310222	LVWVMWMYZAMARZ-FQEVSTJZSA-N	445.951	1.415	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)[C@@H]3CCCN3C)CC2)CC1	1833620165	UQUJRUXMVUHZRU-YJBOKZPZSA-N	443.430	1.683	50	20	IDGD	
O=C(CCC(=O)N1CCCC1)NC1CCN(C2CCN(C(=O)C(Cl)Cl)CC2)CC1	1833700529	BVQUJFYNUHVLMA-UHFFFAOYSA-N	447.407	1.764	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccccc3O)CCO2)C1	1833759056	WFNYBVGSFMVNLT-SCLBCKFNSA-N	427.295	1.246	50	20	IDGD	
Cc1cncc(CCC(=O)NC2CCN(C3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)c1	1833814789	JADPKZUBXAJALA-FQEVSTJZSA-N	436.984	1.494	50	20	IDGD	
Cc1cnc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@](C)(Cl)CCl)C3)C2)cn1	1834084232	KASBRMCUZWWFNI-QZTJIDSGSA-N	431.320	1.091	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)c(C)o1	1834094567	BTRJIPAXJGOFNC-PBHICJAKSA-N	433.274	1.657	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)c3ccnc(Cl)c3)C2)C1	1834819163	IJOQGAAIRCAJFH-QGZVFWFLSA-N	446.729	1.590	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)C3CC4(CCC4)C3)C2)C1	1834826797	WDOFMVRSHXFSDD-LJQANCHMSA-N	429.355	1.808	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)Cc3ccc4ncnn4c3)CC2)CC1)[C@H](F)Cl	1835082061	NCBULQVAOGRXBE-IBGZPJMESA-N	436.919	1.378	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cnn4ccncc34)CC2)CC1	1835406191	IQCGFHZLNYURCY-SFHVURJKSA-N	448.955	1.168	50	20	IDGD	
C=CC(=O)N[C@@H](C)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)Br)CC2)CC1	1835830968	HZTRBWIFKUPIQA-KGLIPLIRSA-N	443.386	1.032	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(N2CCC(NC(=O)[C@H](C)S)CC2)CC1	1836559936	NGQAFGHAHZXJJI-BGHCKBSUSA-N	448.593	1.010	50	20	IDGD	
CC(=O)N[C@@H](C)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](C)CBr)CC2)CC1	1836674747	ZFFJZNLRFQFKTC-KBPBESRZSA-N	446.386	1.541	50	20	IDGD	
O=C(c1n[nH]c2c(F)cccc12)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1837058076	XIMAOBBNVMBWLU-MAUKXSAKSA-N	428.823	1.306	50	20	IDGD	
O=C(c1cccc2ncsc12)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1	1837070663	MWTDZZZSQCNMLB-CRAIPNDOSA-N	427.885	1.901	50	20	IDGD	
O=C(Cc1cncnc1)N1CCC(OC2CCN(C(=O)[C@H](F)Br)CC2)CC1	1837197751	GLILLJGBRCBRTI-KRWDZBQOSA-N	443.317	1.708	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)/C=N/N3CCCCC3)CCO2)C1	1837440646	RCGUALUPHFOOQO-CNSRZQHFSA-N	428.961	1.180	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccnc(Cl)n3)CCO2)C1	1837919929	VKJDOBHYXXVMSP-GOSISDBHSA-N	431.320	1.465	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cc(F)ccc3OC)C2)C1	1839148762	JAJRWIRKXMMLAM-LAUBAEHRSA-N	442.915	1.851	50	20	IDGD	
O=C(c1ccc(O)c(F)c1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1839305348	IWGCDNQQXQBMNU-PBHICJAKSA-N	449.248	1.292	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)CCBr)C3)C2)ccc1F	1839319263	APPZKKSIWZQVKJ-IBGZPJMESA-N	443.313	1.989	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)cc2c[nH]nc12	1839512240	RYXFHQLTIGDUMA-IBGZPJMESA-N	441.315	1.745	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCCC12CN(C(=O)c1ccncc1O)C2	1841924736	WQYBAZCPEYDILU-AWEZNQCLSA-N	438.912	1.736	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)c2cc(C)n(C)n2)C1	1842429522	FSGKAXROIKLIKR-UHFFFAOYSA-N	441.444	1.693	50	20	IDGD	
Cc1oncc1C(=O)N1CCCC12CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2	1842486773	HRIYVYKNQWRRPC-AWEZNQCLSA-N	426.901	1.932	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1cc(F)cnc1Cl)C2	1843416167	HSXSNMYKVNFOOB-BRJLIKDPSA-N	446.870	1.825	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)Cc1cc(F)cc(F)c1)C2	1844263890	GYHZABRYVFWWMN-UHFFFAOYSA-N	429.427	1.023	50	20	IDGD	
Cn1c(=O)c(C(=O)N2CC3(CCCN3C(=O)[C@H](F)Br)C2)nc2ccccc21	1845217647	NGIZZJNZJBPFBX-AWEZNQCLSA-N	437.269	1.441	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@H]2C[C@@H](O)CN2C(=O)OC(C)(C)C)C1	1846216752	XYLJBJKWUSDLEX-PMPSAXMXSA-N	443.972	1.968	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)[C@H](c1ccccc1Cl)N(C)C)C2	1846385899	IXKDPXFXVBHFKB-FQEVSTJZSA-N	449.983	1.519	50	20	IDGD	
COC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)C(C)(C)CCl	1847437786	CTGAKOHRTOVFJY-ILXRZTDVSA-N	431.961	1.993	50	20	IDGD	
CCCN1CCN(c2ccc(C(=O)N3CC[C@H]4[C@@H]3CCN4C(=O)[C@@H](O)CCl)cc2)CC1	1847561722	DEXAQGUOYCNSDL-ACRUOGEOSA-N	448.995	1.634	50	20	IDGD	
O=C(COC(=O)/C=C/c1ccc(I)o1)NNC(=O)c1ccccc1	10794996	OEERUENJHSKFLK-VQHVLOKHSA-N	440.193	1.902	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)OCc2cc(=O)n(C)c(=O)n2C)c(C)n1C[C@@H]1CCCO1	10874547	QIRGRHULQKBVHR-OJEAVSNDSA-N	426.473	1.332	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1)c1cccc(O)c1	13082109	JIWIDCVDJIEHLS-UHFFFAOYSA-N	425.466	1.946	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H]2Oc3ccccc3O[C@@H]2C)c1	14287661	WDRROOQGBDWCPJ-KUHUBIRLSA-N	447.513	1.707	50	20	IDGD	
O=C(NNC(=O)C1CCN(S(=O)(=O)c2ccccc2F)CC1)c1ccc2c(c1)OCO2	15991384	RJSUKGUXJZCXKJ-UHFFFAOYSA-N	449.460	1.416	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)[C@H](C)NS(=O)(=O)c2ccc(Cl)cc2)c1	17198900	LWXVVBLCTCQUFJ-ZDUSSCGKSA-N	425.894	1.542	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)CCn2nnc3ccccc3c2=O)cc1OC	32193099	FUWJICDMGDSVPR-UHFFFAOYSA-N	439.472	1.830	50	20	IDGD	
CC(C)Oc1ccc(NS(=O)(=O)CC(=O)NNC(=O)c2cccc(N(C)C)c2)cc1	108658312	BIWILBREHUCRTR-UHFFFAOYSA-N	434.518	1.743	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@H](c2ccccc2)n2cccn2)cc1	109764416	PZELEPQMGXDURM-FQEVSTJZSA-N	441.513	1.249	50	20	IDGD	
CC(=O)N1CCN(c2ccccc2CNC(=O)NNc2ccc(-n3cccn3)nn2)CC1	726273717	IPIFHQDTHBKPOT-UHFFFAOYSA-N	435.492	1.157	50	20	IDGD	
COc1ccc(C[C@@H](NC(=O)NNC(=O)C(=O)N2CCCC2)c2ccccc2)cc1OC	727605127	SMIJGBQTRODUHH-GOSISDBHSA-N	440.500	1.940	50	20	IDGD	
COc1ccc(C(=O)N2CCC[C@@H]2C(=O)NNC(=O)CNc2ccc(C)cc2)c(OC)c1	728204891	XHUSAWDNGMGTQA-LJQANCHMSA-N	440.500	1.876	50	20	IDGD	
C[C@@H](C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1)n1cnc2ccccc21	728213704	HHNVDWHOHAEPFB-INIZCTEOSA-N	442.545	1.677	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)CC(C)(C)C)CC2)o1	728609827	IUWLUNGXXNPYDG-UHFFFAOYSA-N	443.522	1.441	50	20	IDGD	
COc1ccc(C(=O)OCC(=O)NNC(=O)Cc2nc(C)cs2)cc1OC(F)F	728727550	IRJKDEFITJKBQY-UHFFFAOYSA-N	429.401	1.608	50	20	IDGD	
Cc1cc(C)cc(N2CC[C@H](C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)C2=O)c1	728890554	VSYLOQWEOQLQRC-LJQANCHMSA-N	436.516	1.510	50	20	IDGD	
COc1cccc([C@H](C)N2CCN(CC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)CC2)c1	728930028	FINJGZSDJFSXFS-INIZCTEOSA-N	441.488	1.743	50	20	IDGD	
O=C(COC(=O)Cc1coc(-c2cccs2)n1)NNC(=O)[C@@H]1COc2ccccc2O1	730053869	BAQIACYTSJTIQF-HNNXBMFYSA-N	443.437	1.476	50	20	IDGD	
C[C@]1(NNC(=O)NCCCN2CCN(c3cccc(Cl)c3)CC2)CCS(=O)(=O)C1	730672711	KGPNZSFYLHFPPE-IBGZPJMESA-N	444.001	1.233	50	20	IDGD	
COc1ccc([C@H](CNC(=O)NNC(=O)COc2ccccc2O)N2CCCC2)cc1	730901093	BVISTFZXSHQSAO-SFHVURJKSA-N	428.489	1.947	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NNC(=O)C(C)(C)c1ccccc1	731218712	FSDOQRKMPJXDSF-UHFFFAOYSA-N	446.533	1.241	50	20	IDGD	
Cc1cc(C)c(C)c(S(=O)(=O)N2CCC(C(=O)NNC(=O)c3c[nH]nc3C)CC2)c1C	731851894	XWADVOYYOPIXTB-UHFFFAOYSA-N	447.561	1.814	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)c2c[nH]nc2C)cc1S(=O)(=O)N1C[C@@H](C)C[C@H](C)C1	731852166	HHSUTXKCKDFVNA-STQMWFEESA-N	449.533	1.468	50	20	IDGD	
CCS(=O)(=O)c1ccc(F)c(C(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)c1	732587387	QMKJVUZKJANBSE-UHFFFAOYSA-N	442.852	1.891	50	20	IDGD	
Cn1c(NNC(=O)c2cccc(NC(=O)CCn3ccnc3)c2)nc2ccccc2c1=O	733262228	RTXBAOQXPXWVHM-UHFFFAOYSA-N	431.456	1.916	50	20	IDGD	
O=C(NCC(=O)N1CCN(c2ccccc2)CC1)NNC(=O)c1cnn(-c2ccccc2)c1	733646462	SQHHUBRNMIPBIV-UHFFFAOYSA-N	447.499	1.165	50	20	IDGD	
CC(=O)Nc1nc(C(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)cs1	734821002	DJYQDYVDDDOBNP-UHFFFAOYSA-N	426.499	1.445	50	20	IDGD	
CCOC(=O)N1[C@H](C(=O)NNC(=O)CNC(=O)c2ccco2)CC[C@H]1c1ccc(C)o1	736483285	ZBHMVQZKJZSGSC-KBPBESRZSA-N	432.433	1.420	50	20	IDGD	
Cn1cc(S(=O)(=O)N2CCC(NC(=O)NNc3cc(F)c(F)cc3F)CC2)cn1	741426474	RUUWOMYRBRWGME-UHFFFAOYSA-N	432.428	1.317	50	20	IDGD	
COc1ccc(C[C@@H]2CCCN(C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)C2)cc1	743510395	WCXXXQMFMGIREG-KRWDZBQOSA-N	435.488	1.980	50	20	IDGD	
O=C(NCc1cccc(C(F)(F)F)c1)NNS(=O)(=O)c1cccc(-n2cnnn2)c1	743730052	XMLYUUDYERVBFG-UHFFFAOYSA-N	441.395	1.374	50	20	IDGD	
CSc1nc(C)c(CCC(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)c(C)n1	744521722	XTBARDPHQDYBGJ-UHFFFAOYSA-N	427.486	1.624	50	20	IDGD	
O=C(COc1ccc([N+](=O)[O-])cc1)NNc1ccccc1S(=O)(=O)N1CCOCC1	744619950	BCYUQBOOINRVMD-UHFFFAOYSA-N	436.446	1.138	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)N[C@H]3C[C@H](C)N(c4cnn(C)c4)C3=O)n[nH]2)cc1	745919466	UEDQYANLXPWURY-UGSOOPFHSA-N	436.476	1.257	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H](CNC(=O)NNC(=O)Cc2cn3ccccc3n2)C1	746763281	ZJQVLFXSCJDMHG-HNNXBMFYSA-N	430.509	1.854	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)NCC(=O)N1CCC(Cc2ccccc2)CC1	746776762	XGZNQAMYXUYBFD-UHFFFAOYSA-N	448.527	1.689	50	20	IDGD	
N#Cc1ccc(CS(=O)(=O)CC(=O)NNc2nc(-c3ccccn3)nc3c2CCC3)cc1	747989227	YWNBPTXXVSSGEJ-UHFFFAOYSA-N	448.508	1.957	50	20	IDGD	
Cc1ccc(-c2nnn(CC(=O)NNc3ccccc3S(=O)(=O)NC(C)(C)C)n2)cc1	748594733	XLPXQTQRSDRIBP-UHFFFAOYSA-N	443.533	1.869	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NCC(=O)NNc2cccc3c2CCCC3)c1	749281275	PSBPBTZURWUJMI-UHFFFAOYSA-N	430.530	1.689	50	20	IDGD	
O=C(NNC(=O)[C@H]1CC(=O)N(c2ccc3c(c2)OCCO3)C1)c1cc(Br)c[nH]1	750841474	HLXVVZWRUSNHJZ-JTQLQIEISA-N	449.261	1.363	50	20	IDGD	
CC[C@H](C)C(=O)N1Cc2ccccc2C[C@H]1C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	751295093	KRNNRBLAZPEKCA-YWZLYKJASA-N	447.499	1.423	50	20	IDGD	
CN(Cc1ccccc1)Cc1cccc(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)c1	751360401	FCSORTYPYQQVKQ-LJQANCHMSA-N	430.530	1.450	50	20	IDGD	
COc1cc(OC)cc(N2C[C@@H](C(=O)NNC(=O)COc3ccc(C#N)cc3)CC2=O)c1	752401092	XKMRWEQDWHAWOO-HNNXBMFYSA-N	438.440	1.155	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NC[C@H]2CCCO[C@H]2C(C)C)cc1	753035963	WDXCNJMVWWZNET-APWZRJJASA-N	440.566	1.397	50	20	IDGD	
C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	755021198	OSWJSRSMAMOEAR-LVMGUKCRSA-N	441.396	1.529	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(OC)c(NC(=O)NNC(=O)c2ccccc2O)c1	755408486	DQEULBODIAMGBL-UHFFFAOYSA-N	436.490	1.898	50	20	IDGD	
CCNC(=O)c1ccc(C)c(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1	755829917	FMVLEMNTMQWGMT-UHFFFAOYSA-N	447.517	1.462	50	20	IDGD	
C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)Nc1ccc(OCc2ccccn2)c(Cl)c1	756252968	LMHJJJSPEQGWDF-NSHDSACASA-N	441.897	1.404	50	20	IDGD	
CN(C)CCCOc1ccc(NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1	756459253	ZAPADSGLPYHBQC-UHFFFAOYSA-N	441.536	1.876	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1cc(C(=O)NNc2ccc(C(N)=O)nn2)ccc1Cl	757393193	UVSQEFJQHOXWLY-UHFFFAOYSA-N	426.886	1.063	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)c1cnc(OCc2ccccc2)cn1	757834657	SNFFRZJPUIJUCH-UHFFFAOYSA-N	440.485	1.424	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1)c1ccc2nnnn2c1	758204342	WRUQLTDQANWTQS-HXUWFJFHSA-N	427.468	1.512	50	20	IDGD	
Cc1ccc(-n2ncc(C(=O)N3CCN(S(=O)(=O)CBr)CC3)c2C)cc1	758521915	AGSAOPKKJKGGLE-UHFFFAOYSA-N	441.351	1.929	50	20	IDGD	
COC(=O)c1ccc(C(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)s1	758782317	PHLMWWOQHUSPQJ-UHFFFAOYSA-N	426.495	1.784	50	20	IDGD	
CC[C@H]1Oc2cc([C@H](C)NC(=O)NNC(=O)C(=O)Nc3ccccn3)ccc2NC1=O	758821395	MTZKATHAPUFXQQ-SMDDNHRTSA-N	426.433	1.221	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2cn(Cc3cccc(F)c3)nn2)c2ccccc2c1=O	759112069	KCOOFDUSWKYBQG-UHFFFAOYSA-N	449.446	1.660	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)/C=C\c3ccc(Cl)nc3)cc2)CC1	759660800	NCFYTJYOVIVRGC-OQFOIZHKSA-N	435.937	1.828	50	20	IDGD	
CN1C(=O)C[C@@H](C(=O)NNc2nccc(N3CCOCC3)n2)[C@@H]1c1ccc(Cl)c(F)c1	760172202	DVEISODIBUIIIL-ACJLOTCBSA-N	448.886	1.768	50	20	IDGD	
O=C(NNC(=O)c1csc(N2CCOCC2)n1)NC1CCC(O)(c2ccccc2)CC1	760656665	NECLDQMUWUDHSJ-UHFFFAOYSA-N	445.545	1.754	50	20	IDGD	
COc1cc2ccccc2cc1C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	762373060	GFMKZMOSHAARAV-FQEVSTJZSA-N	436.420	1.993	50	20	IDGD	
O=C(NNC(=O)C(F)(F)C1(O)CCC1)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	763272006	ABMDHYKWTFRRAD-UHFFFAOYSA-N	442.426	1.700	50	20	IDGD	
COC(=O)c1cc2cc(NC(=O)C(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)ccc2o1	763446311	QTSGIFDJWSKUOZ-UHFFFAOYSA-N	426.341	1.527	50	20	IDGD	
O=C(NNC(=O)c1ccccc1Br)C(=O)Nc1ccc(C(=O)NC2CC2)cc1	763481960	ALYBDCTYWKDDTO-UHFFFAOYSA-N	445.273	1.741	50	20	IDGD	
O=C(NNC(=O)c1c[nH]c2ccccc12)C(=O)Nc1ncn(Cc2ccc(Cl)cc2)n1	763540024	PMVRLSJRARJMCP-UHFFFAOYSA-N	437.847	1.861	50	20	IDGD	
Cc1nn(CC(F)(F)F)c(C)c1CC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	763580990	JRFKMNFJISBVOA-UHFFFAOYSA-N	447.439	1.861	50	20	IDGD	
COc1ccc(Br)c(NC(=O)C(=O)NNC(=O)COc2cccc(C)c2)c1	763622219	AIDKWVVXHCYMNK-UHFFFAOYSA-N	436.262	1.931	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc3c(c2)CCCC(=O)N3)cc1	763662650	YPEOFSXNSJUFKT-UHFFFAOYSA-N	426.429	1.135	50	20	IDGD	
Cc1cccc(Cn2nccc2NC(=O)C(=O)NNC(=O)COc2ccc(C#N)cc2)c1	763681976	YSFFHVKECUWQHA-UHFFFAOYSA-N	432.440	1.276	50	20	IDGD	
CN1C(=O)CCc2cc(NC(=O)C(=O)NNC(=O)COc3ccc(Cl)cc3)ccc21	763684792	NFVYWXSJDVHHBQ-UHFFFAOYSA-N	430.848	1.414	50	20	IDGD	
O=C(CSc1ccc(Cl)cc1)NNC(=O)C(=O)Nc1cnn(-c2ccccn2)c1	763734551	MBXKXHZQXGTSHJ-UHFFFAOYSA-N	430.877	1.799	50	20	IDGD	
COc1c(NC(=O)C(=O)NNC(=O)c2ccc(OCCC(C)C)cc2)cccc1C(N)=O	763768932	XNKKQHRZUPYXKV-UHFFFAOYSA-N	442.472	1.619	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccccc1N1CCN(C)CC1	763850940	QYNDBIJPWJBGQM-OAHLLOKOSA-N	443.479	1.131	50	20	IDGD	
CNC(=O)c1cc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)ccc1Cl	763852656	XEKCMRAIXPYCQF-ZDUSSCGKSA-N	446.891	1.870	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)CN(C)C3)cc1	763862205	VMWKNZRTOKZYNJ-AWEZNQCLSA-N	426.473	1.584	50	20	IDGD	
CCOCc1cccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(C(C)=O)cc2)c1	763877165	ICFGDQIMVYFYPF-HNNXBMFYSA-N	427.457	1.979	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(Cl)c(C(N)=O)c2)ccc1OC(C)C	763916376	OANKBBWIMNLCOG-UHFFFAOYSA-N	448.863	1.634	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)c2cc3c(s2)CC[C@H](C)C3)cc1	763940913	VFBBTUUYPPIWDT-LBPRGKRZSA-N	445.497	1.824	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2ccc[nH]2)cc1NC(=O)C1CCCCC1	763980412	GBMFDBBGHQHEGO-UHFFFAOYSA-N	427.461	1.942	50	20	IDGD	
COC(=O)c1cccc(C#Cc2cccc(NC(=O)C(=O)NNC(=O)c3cccn3C)c2)c1	763999539	UVDCJPMHGPLQOW-UHFFFAOYSA-N	444.447	1.611	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1csc(-c2ccccn2)n1	764006896	VIDLLOSHGJFLDQ-UHFFFAOYSA-N	425.426	1.376	50	20	IDGD	
O=C(NNC(=O)c1cccc(Br)c1)C(=O)Nc1cccc(N2CCCC2=O)c1	764062700	ALFNLNRVVXKBMX-UHFFFAOYSA-N	445.273	1.976	50	20	IDGD	
COC(=O)C(C)(C)c1ccc(NC(=O)C(=O)NNC(=O)CCc2ccc(OC)cc2)cc1	764127120	ODAYNVDDGRNMRM-UHFFFAOYSA-N	441.484	1.865	50	20	IDGD	
O=C(CC1CC1)NNC(=O)C(=O)Nc1cccc(CS(=O)(=O)Cc2ccccc2)c1	764141570	CBTQEDVSXLOHFT-UHFFFAOYSA-N	429.498	1.688	50	20	IDGD	
CCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(C#N)cc2)cc1C	764176196	BLRYTFMMGDFLEG-UHFFFAOYSA-N	429.458	1.028	50	20	IDGD	
C[C@@H]1CN(C(=O)c2ccc(NC(=O)C(=O)NNC(=O)c3cccc(C#N)c3)cc2)C[C@@H](C)O1	764236842	GMBXDLVJJYRBCH-HUUCEWRRSA-N	449.467	1.207	50	20	IDGD	
O=C(Cc1ccccn1)NNC(=O)C(=O)Nc1cccc(C(=O)NCc2ccccc2)c1	764268080	ZEHBBAYFVUXAPK-UHFFFAOYSA-N	431.452	1.340	50	20	IDGD	
Cc1cccc(C(=O)N2CCCC2)c1NC(=O)C(=O)NNC(=O)Cc1ccccc1F	764318712	HVKZOELCUCZNGW-UHFFFAOYSA-N	426.448	1.699	50	20	IDGD	
CCOC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)cc1	764386807	CZFUECHDNKHDPR-UHFFFAOYSA-N	439.403	1.792	50	20	IDGD	
CCNC(=O)c1cccc(NC(=O)C(=O)NNC(=O)CSc2ccccc2OC)c1	764396882	DAWQCKBGRQOORY-UHFFFAOYSA-N	430.486	1.323	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)C[C@H]3COC(=O)C3)c2)cc1	764458197	SWTIWRLYEPFRDJ-CYBMUJFWSA-N	447.469	1.210	50	20	IDGD	
CCOc1nccc(C)c1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	764739433	IQVNJQDKCNBLJR-UHFFFAOYSA-N	432.502	1.648	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)C=C3CCCCC3)CC2)cc1	766636508	PEAUTWPTGOQGEQ-UHFFFAOYSA-N	434.562	1.339	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)c1cn(-c2ccccc2Cl)nn1	767311125	WFKJORPIWGRDSF-UHFFFAOYSA-N	427.848	1.776	50	20	IDGD	
COc1cc(C(=O)NNc2c(OC)cccc2S(C)(=O)=O)c([N+](=O)[O-])cc1OC	768611965	LDERRIAHIPOIHB-UHFFFAOYSA-N	425.419	1.781	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)[C@H](c1ccccc1F)N1CCOCC1	768634005	ADKUJJQOESFRGQ-IBGZPJMESA-N	437.493	1.754	50	20	IDGD	
Nc1cc(C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)ccc1OC(F)(F)F	770521802	RZTXXNZTUXXSPJ-UHFFFAOYSA-N	442.306	1.694	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)nn1C	771994187	TWSIGKUWCHOODW-UHFFFAOYSA-N	432.444	1.205	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)c2ccccc2N2CCOCC2)C1	773410968	GXYQLPHOCXOHMV-INIZCTEOSA-N	432.521	1.931	50	20	IDGD	
Cc1nc(NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)ccc1Br	773550403	PHFZIVBIQTWGFX-UHFFFAOYSA-N	427.642	1.911	50	20	IDGD	
CCOC1CC(CNC(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)(N2CCOCC2)C1	775148114	XZSMIGJUMGVPBJ-HGCBZUSOSA-N	448.564	1.671	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)Nc2ccc(C[C@@H]3NC(=O)NC3=O)cc2)c2ccccc2n1	775703879	SMPYSPOEBZVXPA-SFHVURJKSA-N	432.440	1.760	50	20	IDGD	
O=C(CSc1ccc(Cl)cc1)NNC(=O)N[C@@H]1CCO[C@]2(CCS(=O)(=O)C2)C1	776075725	DIHNKNGNKMBKSB-CXAGYDPISA-N	447.966	1.499	50	20	IDGD	
C[C@@H](NC(=O)CC(C)(C)C)C(=O)NNC(=O)c1ccc(CSc2nncn2C)cc1	778285840	GAQZYEZAVLRVFY-CYBMUJFWSA-N	432.550	1.809	50	20	IDGD	
CCn1cc(-c2n[nH]cc2C(=O)NNC(=O)COc2ccc(Br)cc2)cn1	778291853	ZIDLSLONSOZXGR-UHFFFAOYSA-N	433.266	1.896	50	20	IDGD	
COC[C@H](C)n1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc3ccccc3c2)n1	778707190	HVTSULUCTCTNFM-GJZGRUSLSA-N	439.472	1.797	50	20	IDGD	
COc1ccc(-n2cc(O)c(C(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)n2)cc1	779539142	APUKXHYEMAOUHZ-UHFFFAOYSA-N	433.465	1.652	50	20	IDGD	
CN(C)CC(=O)NNC(=O)c1cc(I)ccc1Br	780470879	YGTKFIIUTABAJX-UHFFFAOYSA-N	426.052	1.376	50	20	IDGD	
O=C(NNc1ncnc2ccsc12)C(=O)Nc1cccc(S(=O)(=O)NC2CC2)c1	783262136	NMEKSCRSZNKYMV-UHFFFAOYSA-N	432.487	1.214	50	20	IDGD	
Cc1ccc(C)c(NNC(=O)C(=O)Nc2cccc(S(=O)(=O)NC3=NCCC3)c2)c1	783362487	VPMOGFTVEDKEEO-UHFFFAOYSA-N	429.502	1.856	50	20	IDGD	
Cn1c(=O)c2cc(NC(=O)C(=O)NNc3cc(Cl)ccc3Cl)cnc2n(C)c1=O	783366967	INFHBIMANPTCFR-UHFFFAOYSA-N	437.243	1.021	50	20	IDGD	
N#Cc1ccc(-n2ccc(NC(=O)C(=O)NNc3ccc(-n4cccn4)nn3)n2)c(Cl)c1	783433381	SBRABUQUXRLIJJ-UHFFFAOYSA-N	448.834	1.455	50	20	IDGD	
CC(=NNC(=O)CSc1nnc(O)nc1O)c1cc(Br)cc(F)c1O	783822712	WMDGAJSMQWEKFE-UHFFFAOYSA-N	432.231	1.523	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1cnc(OCC2CC2)c(Cl)c1	783957683	MMWQBWVRUZKPRJ-UHFFFAOYSA-N	430.896	1.991	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CC=CC[C@H]1C(=O)N1CCOCC1)c1cc(-c2ccc(F)cc2)[nH]n1	784456874	PFMSQFOQUYVWKW-IAGOWNOFSA-N	441.463	1.418	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)C(=O)NNc2nc(-c3ccc(Cl)cc3)no2)cn1C	784795270	NURUAWXGASJVOU-UHFFFAOYSA-N	432.824	1.987	50	20	IDGD	
O=C(NNc1ccnc(Br)c1)C(=O)Nc1ccc(C(=O)N2CCOCC2)cc1	784829114	WZQZZODHRMOORT-UHFFFAOYSA-N	448.277	1.398	50	20	IDGD	
CN(C)c1nccc(NNC(=O)C(=O)Nc2ccc(OCC(F)(F)C(F)F)nc2)n1	784970219	UIIPQWDYCWMWHX-UHFFFAOYSA-N	431.350	1.299	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)C(=O)Nc1ccc(F)cc1Br	785068058	SEHQPAUFETUZTQ-UHFFFAOYSA-N	434.225	1.565	50	20	IDGD	
CN1C[C@@H](C(=O)NNC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)c2ccccc2C1=O	785104656	BUOXUUZKNNHVSW-QGZVFWFLSA-N	445.520	1.586	50	20	IDGD	
O=C(NNc1nc(C(F)(F)F)cs1)C(=O)Nc1cccc(N2CCCS2(=O)=O)c1	785147690	OQMMDHUBJLJHTJ-UHFFFAOYSA-N	449.436	1.784	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)c2ccc(F)c(S(C)(=O)=O)c2)c2ccccc2c1=O	785689626	OPOGNYXBXZKLRY-UHFFFAOYSA-N	446.460	1.595	50	20	IDGD	
C[C@@H]1[C@H](C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)CCN1C(=O)OC(C)(C)C	786686834	CBLZEQBYDDKHCL-CHWSQXEVSA-N	429.477	1.340	50	20	IDGD	
Cc1nc(Cl)ccc1NC(=O)C(=O)NNC(=O)COc1ccc(Br)cc1	789731364	CYWIZOAFCHTVDB-UHFFFAOYSA-N	441.669	1.971	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccc2c1OCC[C@@H]2N(C)C	789733209	ZATORNQUIYAAMV-INIZCTEOSA-N	442.472	1.245	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)cc1C(=O)N(C)C	789809976	JNPQJTHFNDJNGJ-HKUYNNGSSA-N	438.484	1.355	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)CN2CCc3ccccc3C2=O)c2ccccc2c1=O	789869719	WSXHWHDQJVQSKZ-UHFFFAOYSA-N	433.468	1.266	50	20	IDGD	
O=C(NCCCNC(=O)c1cccc(Br)c1)NNc1nc2ccccn2n1	790269836	IKICZXMJEHKEHN-UHFFFAOYSA-N	432.282	1.938	50	20	IDGD	
COc1nc(Br)ccc1NC(=O)C(=O)NNc1cccc(F)c1[N+](=O)[O-]	790994356	VJVAARSBTPXGLA-UHFFFAOYSA-N	428.174	1.982	50	20	IDGD	
CC[C@@H](C)n1ncc(NC(=O)C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)c1C	792268437	IJDKBGIHYYIBRR-GFCCVEGCSA-N	425.449	1.454	50	20	IDGD	
CC(=O)NC[C@@H]1CCn2ncc(C(=O)NNC(=O)c3ccc(Br)s3)c2C1	792736291	ITOHJJLIRUGVAB-SNVBAGLBSA-N	440.323	1.480	50	20	IDGD	
O=C(NNC(=O)c1cccc(OC(F)F)c1)C(=O)Nc1cccc(Br)n1	793024226	DFYSMWQEYXZDID-UHFFFAOYSA-N	429.177	1.845	50	20	IDGD	
O=C(NNc1ccc2c(=O)[nH]ccc2c1)C(=O)Nc1ccc(I)cn1	793065744	PEYRMQVLZOITOO-UHFFFAOYSA-N	449.208	1.610	50	20	IDGD	
Cc1ccc(S(=O)(=O)NNC(=O)Cc2cccnc2)cc1I	793392860	VNGBHSUQXMIVMZ-UHFFFAOYSA-N	431.255	1.547	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)[C@@H]2CCCN(S(=O)(=O)c3ccc([N+](=O)[O-])cc3)C2)n1	794075022	GQSLOHGADCLWHO-CQSZACIVSA-N	447.473	1.160	50	20	IDGD	
COC(=O)c1cc(F)cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)c1F	796989281	DMQZCPZHMGEYFQ-SECBINFHSA-N	439.346	1.444	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)[C@H]1CCCN1C(=O)OCc1ccccc1	797442670	FLCFWBVXPDRMFX-OAHLLOKOSA-N	430.486	1.427	50	20	IDGD	
O=C(NNC(=O)C1CCN(S(=O)(=O)c2cccnc2Cl)CC1)Nc1ccccc1	801986935	ZMXPNWSZRDEANG-UHFFFAOYSA-N	437.909	1.989	50	20	IDGD	
COc1ccccc1C(=O)N[C@@H](CCS(C)(=O)=O)C(=O)NNC(=O)Nc1ccccc1	801987138	SYARRFUBXMMGTD-INIZCTEOSA-N	448.501	1.081	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)CNS(=O)(=O)c2cccs2)c(OC)cc1Cl	802082845	PBTATVYQUYGYBZ-UHFFFAOYSA-N	448.910	1.550	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CC(=O)N([C@H]2CCS(=O)(=O)C2)C1)Nc1ccc(Cl)cc1Cl	802088005	IHFQUWOFGYFPRO-KOLCDFICSA-N	449.316	1.182	50	20	IDGD	
CC(C)N(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)Nc2ccc3c(c2)OCO3)cc1	802096197	ZDLTVIZJSPTFCB-UHFFFAOYSA-N	434.474	1.911	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)Nc2cccc(C(=O)NCCOC)c2)cc1OC	806626007	WJISHMSVGGLCFR-UHFFFAOYSA-N	430.461	1.937	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2ccc(Cl)cc2OCC(F)F)CCS(=O)(=O)C1	807000550	DMXGYMCSBNXXSU-HNNXBMFYSA-N	425.841	1.120	50	20	IDGD	
CC[C@H](C)N[C@@H](CNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)c1ccco1	807439979	BFFYVFJHRBKZOD-RDJZCZTQSA-N	429.525	1.746	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNc2nccnc2C2CCC2)ccc1S(=O)(=O)N(C)C	807462406	ZCADXFGBELUDGU-UHFFFAOYSA-N	448.505	1.085	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)c2c(C)coc2CC(=O)OC)c2ccccc2c1=O	809953932	NRJXXLKSPMTJAS-UHFFFAOYSA-N	426.429	1.498	50	20	IDGD	
COC[C@]1(CNC(=O)NNC(=O)c2cc(Br)c[nH]2)OCCc2ccccc21	811851996	ANQZNOARJBKURH-SFHVURJKSA-N	437.294	1.836	50	20	IDGD	
O=C(COc1ccc(OCc2ccccc2)cc1)NNC(=O)[C@]12CCC(=O)N1CCS2	811917034	GIOUWPGCKNGFAQ-JOCHJYFZSA-N	441.509	1.857	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)NCc2ccc(CC(N)=O)cc2)c1	812481023	HQGDLZBWYCKLMV-UHFFFAOYSA-N	435.278	1.630	50	20	IDGD	
COc1ccc(Cl)c(NC(=O)NNC(=O)[C@@H](Cc2cnc[nH]2)NC(=O)CC(C)C)c1	813574799	IQEBYZTZVLCXOO-MRXNPFEDSA-N	436.900	1.998	50	20	IDGD	
CC(C)(CC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)C1CC1	814784883	UGVVWLAAVUYDCJ-UHFFFAOYSA-N	437.562	1.614	50	20	IDGD	
N#Cc1cc(NC(=O)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)ccc1Br	815564050	VZXOKYRFTQBBIA-UHFFFAOYSA-N	432.190	1.629	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cc(C)c3nccn3c2)cc1	815565898	DBNQTYLZOLRRLP-CQSZACIVSA-N	425.445	1.595	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1cc(CC(C)(C)C)nn1C	815750465	BNRLBCIXRWNWER-UHFFFAOYSA-N	436.538	1.341	50	20	IDGD	
CNC(=O)COc1cccc(CC(=O)NNC(=O)[C@H]2CCCN(C(=O)OC(C)(C)C)C2)c1	819658507	MLUIBPASYXRRHN-INIZCTEOSA-N	448.520	1.148	50	20	IDGD	
C[C@H](CN1CCOCC1)C(=O)NN/C=C1/C(=O)N(c2ccccn2)C(=O)c2ccccc21	912745193	CEVWWHLIFKVSTL-NISQSXRWSA-N	435.484	1.199	50	20	IDGD	
COc1ccnc(NNC(=O)c2cc(S(=O)(=O)NC3CC3)c(Cl)cc2Cl)n1	914762922	CFCLZNBMOFKORT-UHFFFAOYSA-N	432.289	1.990	50	20	IDGD	
COc1ccc2c(c1)C[C@@H](C(=O)NNC(=O)c1sc(N3CCOCC3)nc1C)CO2	914781911	VVOLLIYDWVOMCO-CQSZACIVSA-N	432.502	1.309	50	20	IDGD	
O=C(NCCN1CCN(Cc2ccccc2)CC1)NNC(=O)c1cccc([N+](=O)[O-])c1	915901687	KRRFJVYXBLJAJB-UHFFFAOYSA-N	426.477	1.357	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NN=C(C)CCN(C)C)N(S(C)(=O)=O)CC2	915951726	NODKIIBOYNAQHR-QGZVFWFLSA-N	440.566	1.397	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)NCCS(=O)(=O)NCc2ccccc2)c1C	916645323	QXEFMOFMPRCCQK-KRWDZBQOSA-N	448.545	1.521	50	20	IDGD	
O=C(Cn1c(=O)ccn(Cc2ccccc2)c1=O)NNc1ccc(Cl)cc1[N+](=O)[O-]	917213548	ORJPPGHKORFRCD-UHFFFAOYSA-N	429.820	1.763	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCC(=O)N(Cc2ccccc2)[C@@H]1c1ccccc1)C(=O)NC1CC1	917622172	LORGOBAFDGNCAJ-PZJWPPBQSA-N	434.496	1.593	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)NC1CCN(CC2CC2)CC1	918084072	VVIOFINBEUYOSM-UHFFFAOYSA-N	428.581	1.404	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)N[C@@H](c1ccc(F)cc1)[C@H]1CCCO1	918126036	FBCXQVYXDJCCNY-MSOLQXFVSA-N	425.424	1.666	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@H](C)Cc2ccc(O)cc2)cc1	919911032	FYACKMYCYQTXCR-OAHLLOKOSA-N	434.518	1.283	50	20	IDGD	
COc1cc(C=NNC(=O)N[C@@H]2CCS(=O)(=O)C2)ccc1OC(=O)c1cccs1	920381034	NOHMYRNGJROVCU-CYBMUJFWSA-N	437.499	1.796	50	20	IDGD	
CC(=O)Nc1ccc(O)c(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c1	920426728	YFWLSCCYMQTFQQ-UHFFFAOYSA-N	425.489	1.324	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)CC(C)(C)C)N(S(C)(=O)=O)CC2	920596738	ZCRRCTGYXGDYOE-OAHLLOKOSA-N	441.550	1.536	50	20	IDGD	
CC(C)C(=O)NNC(=O)/C(C#N)=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1	920849990	NZUGQGKWPYVKLZ-NTEUORMPSA-N	428.880	1.789	50	20	IDGD	
O=C(CCO)NNC(=O)Nc1ccc(CC(=O)N2CCN(c3ccccc3)CC2)cc1	1116609801	KVYQYEBMCIOKNQ-UHFFFAOYSA-N	425.489	1.113	50	20	IDGD	
Cn1c(C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)cc(Br)c1C=O	1319272272	NCYJEULNUORZGX-UHFFFAOYSA-N	441.307	1.798	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Cc2c[nH]c3cnccc23)c1	1330289124	IBZOWIIWFCTSKX-UHFFFAOYSA-N	429.502	1.597	50	20	IDGD	
COc1cnc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CO[Si](C)(C)C)C2)cn1	1779540843	WAWACFCRTHGDCF-OXQOHEQNSA-N	436.585	1.464	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)nn1C(F)F	1780306852	PQOWIXKCWQOHMZ-BDJLRTHQSA-N	435.269	1.814	50	20	IDGD	
Cc1nc2sccn2c1C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781331542	MUCGIJPCPBLUMY-WBMJQRKESA-N	445.314	1.838	50	20	IDGD	
O=C(c1[nH]nc2ccncc12)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781332075	ZDLFKHOTSQIARF-CJNGLKHVSA-N	426.246	1.092	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781332882	GCROMPOQYVTXQD-AHXJXLJNSA-N	447.301	1.262	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccnnc1)C2	1781900612	FYEQPWBMOHNBRU-IIDMSEBBSA-N	425.327	1.778	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1cncnc1)C2	1781900877	HDMJTFBRASOTAO-GPMSIDNRSA-N	439.354	1.707	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CNC(=O)OC(C)(C)C)C2	1782178567	ASCPZNQAZALIKD-BXTJHSDWSA-N	447.960	1.279	50	20	IDGD	
COCC(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](Br)Cc3ccccc3)C2)C1	1783023999	SKOZINZGULLQQK-APWZRJJASA-N	425.323	1.469	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cc4cccn4cn3)CCO2)C1	1783349502	MNZZEVQPQULSJT-DNVCBOLYSA-N	435.322	1.951	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(Cl)nn3)CCO2)C1	1783349656	QOLOJDFTQRODAQ-BDJLRTHQSA-N	431.718	1.747	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cnn4cccnc34)CCO2)C1	1783350000	XZOMMNSYYDFEGU-KBXCAEBGSA-N	436.310	1.346	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3c[nH]c4nccc-4c3Cl)CCO2)C1	1783874997	JWINHRRIRFYLME-IFXJQAMLSA-N	441.315	1.865	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(OC)c(OC)c3O)CCO2)C1	1783881140	PFLQMZJSEUUFJI-JLTOFOAXSA-N	442.896	1.107	50	20	IDGD	
CCC[C@H](C(=O)N1CCO[C@@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1)n1cccc1	1783934326	DJPDSTRPFVFYAN-XMSQKQJNSA-N	433.553	1.032	50	20	IDGD	
CC1CCN(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]3C2)CC1	1783964274	OPMCVNVHVNVHAR-XSLAGTTESA-N	444.414	1.729	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(-c4cnccn4)c3)C[C@@H]21)[C@H](O)CCl	1784091566	XWJNKJBMAIXIPS-XEYPJELSSA-N	444.919	1.337	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]3C2)cc(C)c1C(=O)O	1784092445	NVWQUADCQBSBME-HJWJTTGWSA-N	438.908	1.195	50	20	IDGD	
C[C@H](Oc1cccnc1)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2	1784547603	INTSSUOAZILPMP-KYNGSXCRSA-N	430.332	1.915	50	20	IDGD	
O=C(Cc1ccc(F)cc1Cl)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21	1784926130	FJGDGTOFJVQBNQ-SDNTUTLCSA-N	433.307	1.601	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC1(c2ccc(NC(=O)CN3CC(=O)NC3=O)cc2)CCC1	1786686773	VNJQJFCIAHUMLW-GOSISDBHSA-N	441.315	1.909	50	20	IDGD	
O=C(CC[C@H]1CCOC1)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1	1788149415	PEAPXSFWBXLZGK-KRWDZBQOSA-N	436.317	1.931	50	20	IDGD	
Cc1noc(CC(=O)Nc2ccc(C3(NC(=O)c4cccc(B(O)O)c4)CCC3)cc2)n1	1788219875	XQZYBDBZHQFDAI-UHFFFAOYSA-N	434.261	1.048	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)c1n[nH]c2ccccc12	1788331252	QKKCKUCELXGTCC-NOLJZWGESA-N	435.322	1.941	50	20	IDGD	
COCc1oncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]2C1	1789868536	XMMQIUFUDNFFRV-CQEJWKIFSA-N	434.320	1.651	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(C)c([N+](=O)[O-])cn3)C[C@@H]21	1791253905	FMBOSICYMCKAAE-ZJOBFFGXSA-N	440.884	1.145	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(-c4cccnc4)[nH]n3)C[C@@H]21)C(Cl)Cl	1791298362	SDDFVAYTHDUEFU-XEZPLFJOSA-N	438.315	1.869	50	20	IDGD	
CCN1CCC(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)CBr)C[C@@H]32)CC1	1792293563	YAVOEMKJUVGPLL-DKIMLUQUSA-N	444.414	1.729	50	20	IDGD	
CO[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)CBr)c1ccccc1	1792868510	ZQGREFVPJZKRFP-LHKMKVQPSA-N	439.350	1.995	50	20	IDGD	
C=CCC(CC=C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2	1792924273	XCMVRPDMNBFXRR-WCARGJHZSA-N	441.532	1.478	50	20	IDGD	
CC#C[C@@H](CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](O)CCl)c1ccc(O)cc1	1792982648	LIZXPDUBLPCZPG-DNMVWIPKSA-N	434.920	1.079	50	20	IDGD	
N#Cc1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](O)CCl)c(C(F)(F)F)n1	1793110823	WKTRGWLMINHZNS-OPDFLTKYSA-N	430.814	1.824	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1ON=C(c3ccccc3)O1)C2	1793448323	ADEVEWRPTOTDDU-JXVINKLPSA-N	435.908	1.718	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCC(=O)N1CCCC1	1793803957	IXNVBVDSAAYTJJ-CSHUHZATSA-N	434.364	1.215	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)nc(Cl)c1	1794414371	MTCBAINQPVYGLO-KOZDUTSQSA-N	436.723	1.880	50	20	IDGD	
COc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCBr)ccc1O	1795115002	WQCOBROSJNXICO-FVCICTRLSA-N	427.295	1.389	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2c(cnn2C)c1	1797081854	UKIRZGRCZGYGOL-GMLZMKKNSA-N	449.349	1.808	50	20	IDGD	
CC(=O)O[C@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)CBr)C2)C(C)C	1797589612	AHKHIPWUQUNPCX-SLZITWOASA-N	433.343	1.195	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1coc([Si](C)(C)C)c1)C2	1797956966	SHNPSFAMRHCUDC-HGKCTWBKSA-N	438.673	1.880	50	20	IDGD	
C[C@@H](Sc1cccs1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(B(O)O)cc1)C2	1798280111	LLBMFRBEWORDDO-NKGKWGDASA-N	444.387	1.861	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1(Br)CC1	1799355346	BZJUFUYTLCYQFG-YFKTTZPYSA-N	438.160	1.535	50	20	IDGD	
CC(C)Oc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](O)CCl)C3)cc1Cl	1799461281	PZDCYUUHPODISQ-KPEUIFRASA-N	445.343	1.930	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1n[nH]c2ccc(C#N)cc12	1799884066	KDZZBMXPZRODHA-CCWDJLKJSA-N	441.564	1.489	50	20	IDGD	
COCCOCCOCCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](F)Br	1800163170	IVKGMWIHAJBFFP-HLPPOEQASA-N	439.322	1.385	50	20	IDGD	
CCOCCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C#N)=C/c1ccc(F)cc1F	1800334693	WXLFXXOKFWWUDS-JFABSOQWSA-N	433.455	1.888	50	20	IDGD	
CCOC(=O)C1(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](Br)CC)CC1	1800642868	AJLQVNBKUHMGHL-XJFOESAGSA-N	431.327	1.093	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1CNC(=O)C1	1801678073	BQUAWEDFOKIKKJ-CWUQTXRHSA-N	428.439	1.646	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(N3CCOCC3)cn1)C2	1802273445	LTDDZYOQBLPTRP-KYHPRHEASA-N	436.940	1.424	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccn(C(F)F)n2)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803141144	LJPRWQRRHHEZQZ-AEGPPILISA-N	427.839	1.593	50	20	IDGD	
CC(C)(C)n1cc(C(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]2c2cccnc2)nn1	1803141357	NKDKFIJHCGIOKO-DJIMGWMZSA-N	434.928	1.347	50	20	IDGD	
C[C@H](C(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]1c1cccnc1)n1ccccc1=O	1803142828	KEOONVVIYYVIGO-KLICCBINSA-N	432.908	1.110	50	20	IDGD	
CCS(=O)(=O)N[C@H](C)C(=O)N1CCCC2(CCN(C(=O)C(Cl)Cl)CC2)C1	1805959424	FSQIYCJGRWQASL-GFCCVEGCSA-N	428.382	1.349	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)CCc2ccc[nH]2)[C@@H]1c1cccnc1	1807464126	TWUKRICDFAVBND-JPYJTQIMSA-N	440.548	1.421	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2cc(O)ncn2)[C@H]1c1cccnc1)[C@H](F)Br	1808648870	DROJTHCJUQAUSN-CQDKDKBSSA-N	438.257	1.587	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)C3(Br)CC3)CC2)C1	1809969294	BYXGIZSTWBIUQS-UHFFFAOYSA-N	449.154	1.139	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)c3ccc(F)s3)CC2)C1	1809969357	SCRCRNBBQFQPKX-UHFFFAOYSA-N	430.310	1.726	50	20	IDGD	
Cc1cc(F)cc(C(=O)N2CCC3(CCCN(C(=O)c4cccc(B(O)O)c4)C3)CC2)c1	1809979822	BJOJKEWLDAIGHA-UHFFFAOYSA-N	438.308	1.973	50	20	IDGD	
O=C(C#CC1(O)CCCCC1)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1	1810329721	GFPIAFIVKISZFS-NSHGMRRFSA-N	433.936	1.386	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2ccc([N+](=O)[O-])[nH]2)[C@H]1c1cccnc1	1811619161	PNNVKDMEGSFMGV-JKIFEVAISA-N	435.868	1.891	50	20	IDGD	
O=C(Cn1cnc2ccccc21)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1	1812966199	KQVJVXWLWGXVGI-SCWSEQNSSA-N	441.919	1.737	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)CC[C@@H]2CCOC2)[C@@H]1c1cccnc1	1813629901	KLQPQIRYYWTKRZ-BOCKYXSRSA-N	445.564	1.277	50	20	IDGD	
CN(CC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](O)CCl)n[nH]1)C(=O)c1ccccc1	1814865005	VKEOMYASIRQVBN-SJORKVTESA-N	447.923	1.774	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1	1816727897	BGNMZTZBHYIFAE-ZJUUUORDSA-N	426.882	1.429	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cn[nH]c2)[nH]n1	1818111697	AUOHNVRKNSQOLV-KWJLSGNOSA-N	437.464	1.573	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H]2CCCO2)[nH]n1	1818111920	PIDJPMDAXGALMY-XKHFHUKESA-N	441.492	1.715	50	20	IDGD	
C[Si](C)(C)OCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1nc3ncccn3n1)CC2	1820165107	UEHBUIXXRUNYNM-NSHDSACASA-N	445.581	1.658	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccncc2F)[nH]n1	1822415791	INIJHJWANANHHC-INIZCTEOSA-N	431.472	1.623	50	20	IDGD	
O=C1C[C@@H](C(=O)Nc2cc([C@@H]3CCCCN3C(=O)CCBr)[nH]n2)CCN1	1822478024	FJWFJLKNZUBRJZ-AAEUAGOBSA-N	426.315	1.713	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CSc1nc[nH]n1)CC2	1825646715	BUEMCXJQOGHUNY-JGVFFNPUSA-N	445.368	1.749	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)COc3cccnn3)sc2C1	1826764886	AZCPOMKWGWNSIX-GHMZBOCLSA-N	425.898	1.178	50	20	IDGD	
CC[C@@H](NC)C(=O)N1CCC([C@@H]2CCCCN2C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)CC1	1827680507	MCMSRMKZHQTSTE-VURWOWCXSA-N	444.580	1.738	50	20	IDGD	
CC(=O)N1CCN(CC(=O)N2CCCC[C@H]2C2CCN(C(=O)[C@H](F)Cl)CC2)CC1	1828493025	PJOJWIMTUKIBIH-HKUYNNGSSA-N	430.952	1.305	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cn3cc(Cl)cn3)C2)C1	1830357527	FIVQANBNGBPIBB-SFHVURJKSA-N	433.336	1.258	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cccs3)C2)C1	1830538344	CFKWQLVTEQCLSH-KDOFPFPSSA-N	445.379	1.778	50	20	IDGD	
CC(C)[C@H]1CC[C@H](C(=O)N2CCOC[C@@]3(CN(C(=O)[C@H](O)CCl)CCO3)C2)CC1	1830736744	WOPYDCPBUWVSMW-IKVWTGGYSA-N	430.973	1.505	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnn4ccncc34)C2)C1	1831645520	BTNIPLWSAZIZME-OXQOHEQNSA-N	435.912	1.207	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4c(c3)CNC4=O)C2)C1	1831649727	AXLZKQAAVOSNIO-XMSQKQJNSA-N	449.935	1.408	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H](C)N2CCN(C)CC2)CC1	1831833398	NMMXEEFPKZKOLK-YSIASYRMSA-N	443.032	1.496	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H]2CCCCN2C)CC1	1831871298	RENIPYWUCOKLQF-UXHICEINSA-N	435.613	1.463	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@H]2CCCCN2C)CC1	1831871301	RENIPYWUCOKLQF-VQTJNVASSA-N	435.613	1.463	50	20	IDGD	
CN(C)c1cccc(OCC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)c1	1832526927	GVQBQONRMVXVAI-ICSRJNTNSA-N	443.903	1.122	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)Cc3cccc(F)c3F)CC2)CC1)[C@H](O)CCl	1833312372	RSEYVHTZQMCTNK-GOSISDBHSA-N	443.922	1.679	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3ccn(C)n3)CC2)CC1	1834218623	BLFWMHCFNGNTDD-MRXNPFEDSA-N	440.386	1.779	50	20	IDGD	
CC(C)(NCCC#N)C(=O)NC1CCN(C2CCN(C(=O)C(Cl)Cl)CC2)CC1	1834715942	VSKGDNZZIGHYJA-UHFFFAOYSA-N	432.396	1.644	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1)c1ccc(O)nc1	1836142846	UXODZLZKHLCMEZ-UHFFFAOYSA-N	439.354	1.757	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)CS(=O)(=O)CC)CC2)CC1	1836846335	MSWDGCFPBAZSBC-KRWDZBQOSA-N	437.002	1.827	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(OC2CCN(C(=O)CC#N)CC2)CC1	1837634859	JHMXBRRMAPLCAW-BUVRLJJBSA-N	428.493	1.033	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccnc4c3OCO4)CCO2)C1	1838474686	OZGJITBAFOCHPR-MGPUTAFESA-N	439.896	1.288	50	20	IDGD	
Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)c(O)n1	1838672163	KDNSIJOYCIMLAX-OALUTQOASA-N	446.331	1.402	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc4c3OCCO4)C2)C1	1839145110	VEVBKFXJBBTKEB-HRAATJIYSA-N	438.908	1.545	50	20	IDGD	
O=C([C@@H](F)c1ccccc1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839198625	LIGVRGROEHABJE-RLFYNMQTSA-N	447.276	1.844	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(C)cc(OC)c3)CCO2)C1	1839256791	PSPULRHCVQGYEJ-RXVVDRJESA-N	440.924	1.327	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)n3ccnc3)C2)C1	1839961852	KVHSVFHHSMEHBM-RLFYNMQTSA-N	443.342	1.074	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CCCCN3C)C2)C1	1839961873	LQOWFKDNTUNWQT-MDZRGWNJSA-N	446.386	1.101	50	20	IDGD	
Cc1nc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)sc1C	1840034576	PYMJKZMAMCKBGE-DIFFPNOSSA-N	446.367	1.613	50	20	IDGD	
C=CCNC(=O)/C=C\C(=O)N1CCCC12CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)C2	1841055389	ADBMQVDKKONUAF-CWMABMBHSA-N	440.450	1.934	50	20	IDGD	
C[C@H](C(=O)N1CC2(CCCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C1)n1ccnc1	1841924048	QEWXJPUFCBSPLW-CABCVRRESA-N	439.944	1.780	50	20	IDGD	
O=C(COc1ccc(Cl)c(F)c1)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843010312	BPIXZBLUGKHEMW-UHFFFAOYSA-N	446.671	1.055	50	20	IDGD	
Cc1nn[nH]c1C(=O)N1CCCC12CN(C(=O)[C@@H](Br)Cc1ccccc1)C2	1843161374	XQURPFFTPZGUKH-HNNXBMFYSA-N	432.322	1.936	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)Cc1ccccn1)C2	1844692381	QGJKXMVKSIRLNI-UHFFFAOYSA-N	438.440	1.975	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC2(CCCN2C(=O)c2c[nH]c(=O)cn2)C1	1844763901	KJPXEPFXLJMNPD-MKMNVTDBSA-N	425.395	1.472	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)C[C@@H](O)CNC(=O)OC(C)(C)C)C1	1845229037	YZDWDBOLKGFUNY-HUUCEWRRSA-N	431.961	1.873	50	20	IDGD	
Cc1cccc2c(C(=O)N3CCCC34CN(C(=O)c3cnccc3C(=O)NN)C4)n[nH]c12	1845691184	XWNMVGFCTZZFSE-UHFFFAOYSA-N	433.472	1.001	50	20	IDGD	
Cc1ccc(COCC(=O)N2CC3(CCCN3C(=O)CCC(=O)NN(C)C)C2)cc1C	1846384791	JCASIPWWWZNAAM-UHFFFAOYSA-N	430.549	1.396	50	20	IDGD	
COc1cccc2c1C[C@H](C(=O)N1CC3(CCCN3C(=O)CCC(=O)NN(C)C)C1)CC2	1846385955	OZWFHDKCACPHPS-GOSISDBHSA-N	442.560	1.377	50	20	IDGD	
CC(C)NS(=O)(=O)c1cccc(C(=O)OCC(=O)NNC(=O)c2cccs2)c1	9755071	OCZQJKHWUWWCAL-UHFFFAOYSA-N	425.488	1.053	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)[C@H]1Oc2ccccc2O[C@H]1C	10948639	RIXARGIGHGCMMD-VOJFVSQTSA-N	434.832	1.881	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCCC2)cc1)NNC(=O)c1ccc2c(c1)OCO2	15663154	AXHGEPGYVMWRDL-UHFFFAOYSA-N	445.497	1.594	50	20	IDGD	
CON(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)c2cc(Br)c[nH]2)cc1	24124027	QVXQIRUVVHPZTF-UHFFFAOYSA-N	431.268	1.034	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(C)c(C(=O)NNC(=O)c2ccc3c(c2)OCO3)c1	26963411	HUTVIXAPZDRRMI-UHFFFAOYSA-N	433.486	1.829	50	20	IDGD	
CN(C)CC(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2cccc(C(F)(F)F)c2)c1	727364343	SWWKESJOOZDHPM-UHFFFAOYSA-N	444.435	1.829	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NNC(=O)Cc1cccnc1	728941895	FKWFZDDXXYSIHA-LLVKDONJSA-N	436.266	1.216	50	20	IDGD	
CN(C)CCOc1ccc(CCNC(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1	729232814	RVCDGAKPFNNXLN-UHFFFAOYSA-N	428.489	1.585	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Cc2c(C)nc3c(c(O)nn3C)c2C)cc(OC)c1OC	729258415	UJJAHIIQHTWSSC-UHFFFAOYSA-N	443.460	1.320	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)[C@@H]2CSCN2C(=O)c2ccc(Cl)cc2)cc1	729297838	IKLHEFOXBLTKPS-KRWDZBQOSA-N	444.900	1.953	50	20	IDGD	
CCOc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)c3cnn[nH]3)c2)cc1	729455513	IKIDPELCCDNTKK-UHFFFAOYSA-N	430.446	1.079	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCN(C(=O)c2ccccc2)C1)c1csc(N2CCOCC2)n1	731185089	FCCGGMJWXLSNPS-INIZCTEOSA-N	443.529	1.293	50	20	IDGD	
CCN1CCN(C(=O)CC2CCN(CC(=O)NNC(=O)c3ccc(C)cc3)CC2)CC1	731214616	KRLXRTWMADNFBN-UHFFFAOYSA-N	429.565	1.022	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(\C#N)C(=O)NNC(=O)CCN2C[C@H](C)O[C@H](C)C2)c1C	732262196	RPJBQRPSGDDEHT-MXQVYXAZSA-N	445.564	1.866	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)[C@H]2CCCN2S(=O)(=O)c2cccc([N+](=O)[O-])c2)c(C)o1	732932739	WPFLFLMKGAFVRD-MRXNPFEDSA-N	436.446	1.419	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)c1	733109968	LSAIUKKEDZLCCY-UHFFFAOYSA-N	447.904	1.851	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)NCCC(=O)Nc2ccccc2)c2ccccc2c1=O	733653087	DWZOXDZGTUEFOR-UHFFFAOYSA-N	436.472	1.950	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@@]2(O)CCN(Cc3ccccc3)C2)ccc1OC(C)C	735840971	RHZCIHPMAOHEQO-HSZRJFAPSA-N	427.501	1.880	50	20	IDGD	
COc1ccc(CN2CC[C@@H](NC(=O)NNC(=O)COCc3ccccc3)C2=O)cc1	738481681	GAAHIAJTRMYPGW-LJQANCHMSA-N	426.473	1.343	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)N2CCN(CC[S@](C)=O)CC2)c(C)n1C[C@H]1CCCO1	741297466	SUNSCSHTZGDNFF-IZSDAOFUSA-N	432.590	1.714	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCC[S@](=O)Cc2ccccc2)c2ccccc2c1=O	741418538	GVJZWVFYOYBTJV-HKBQPEDESA-N	441.513	1.309	50	20	IDGD	
CCS(=O)(=O)N1CCC[C@H](C(=O)NNC(=O)NCc2cccc(C(F)(F)F)c2)C1	742448110	FWVMOWSGFQUVKE-ZDUSSCGKSA-N	436.456	1.598	50	20	IDGD	
O=C(NNC(=O)C(F)(F)C(F)(F)C(=O)NNC(=O)c1ccccc1)c1ccccc1	742466039	OUWBDQNZLPSDGY-UHFFFAOYSA-N	426.326	1.179	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNS(=O)(=O)c2cc3oc(=O)[nH]c3cc2Cl)c1	743249637	JCTSTBNUUNQVNQ-UHFFFAOYSA-N	427.822	1.415	50	20	IDGD	
N#CCCn1cc(/C=C(\C#N)C(=O)NCC(=O)NCCO)c(-c2ccc(Cl)cc2)n1	746227484	ZWZLQYDMMFSKRQ-XNTDXEJSSA-N	426.864	1.249	50	20	IDGD	
COc1ccc(N(C)S(=O)(=O)c2cccc(C(=O)NNC(=O)c3ccc[nH]3)c2)cc1	747654455	PIOMPQWMKZCDPT-UHFFFAOYSA-N	428.470	1.923	50	20	IDGD	
CN1CCC(N2CCC(NC(=O)NNC(=O)c3nn(-c4ccccc4)cc3O)CC2)CC1	747990143	AEECIJDPOQNKOL-UHFFFAOYSA-N	441.536	1.081	50	20	IDGD	
CCCn1nc(C(=O)NNS(=O)(=O)c2cc(F)cc(C(=O)O)c2)c2ccccc2c1=O	749141265	HASQFJJZEUGKOO-UHFFFAOYSA-N	448.432	1.267	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCCN1C(=O)CSC1=O	749703762	UYSWSWAASJKADJ-VIFPVBQESA-N	445.295	1.242	50	20	IDGD	
CC(C)c1nc(C#N)c(NNC(=O)CNS(=O)(=O)c2ccc(Br)s2)o1	749851073	ZMFFVEIEXBAOFD-UHFFFAOYSA-N	448.324	1.915	50	20	IDGD	
Cc1cc(C(=O)NNS(=O)(=O)c2cnn([C@H]3CCOC3)c2)c(C)n1-c1ccccc1	751538990	UZNCNDHVBGMKSF-KRWDZBQOSA-N	429.502	1.875	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCC[C@H](C(=O)NNC(=S)N[C@H](C)C3CC3)C2)s1	751620632	KOPNOFIHKFCXIK-OCCSQVGLSA-N	430.621	1.751	50	20	IDGD	
CCNC(=O)C1(CNC(=O)NNC(=O)COc2ccc(Br)cc2)CCC1	753311065	PZVMLJVXCKXVHN-UHFFFAOYSA-N	427.299	1.465	50	20	IDGD	
C[C@@H](C(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)c1ccc(S(C)(=O)=O)cc1	753476928	JRYZRYROLVCCTE-GFCCVEGCSA-N	449.441	1.106	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cc(S(=O)(=O)N(C)C)c(C)o2)ccc1OC(C)C	753566702	VSDUSXVTKMMYJW-UHFFFAOYSA-N	439.490	1.709	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)Cc1ccc(I)cc1	754285770	SUEAAFZNMDFGJE-UHFFFAOYSA-N	433.246	1.506	50	20	IDGD	
O=C(NNC(=O)N1CCC[C@H]1Cn1cnc2ccccc21)C1CCN(c2ncccn2)CC1	756060870	CLKGOIXVPUUOKY-SFHVURJKSA-N	448.531	1.948	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN(C)[C@H](C)c2ccc(S(C)(=O)=O)cc2)cc1OC	756482065	NFZXTOYCPNUVEQ-CQSZACIVSA-N	449.529	1.561	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NC(=O)NNC(=O)[C@H]1COc2ccccc2O1	756524447	JGOIPKLVJWMKFV-MRXNPFEDSA-N	448.501	1.756	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)Nc2cc(C3CC3)nn2[C@@H]2CCS(=O)(=O)C2)c1	756853960	AZIWKJMHEPRLPE-OAHLLOKOSA-N	447.517	1.660	50	20	IDGD	
Cn1cc(C#N)c(NC(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)n1	756866348	UHIUHVBLAZKSMR-UHFFFAOYSA-N	442.439	1.516	50	20	IDGD	
O=C(NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)Nc1ccn(CC(F)F)n1	756867434	JQDYKRGVNXINNH-UHFFFAOYSA-N	442.448	1.399	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)Nc3c(C)ccn(C)c3=O)n[nH]2)cc1OC	757630826	MTAXKRCVKJXTJA-UHFFFAOYSA-N	426.433	1.568	50	20	IDGD	
O=C(NNC(=O)[C@H]1CC(=O)N(Cc2cccc(C(F)(F)F)c2)C1)C(=O)Nc1ccccn1	758834178	PWTYXGLEOSZLLU-ZDUSSCGKSA-N	449.389	1.235	50	20	IDGD	
O=C(NNC(=O)c1cccc(NC(=O)[C@@H]2Cc3ccccc3O2)c1)C(=O)Nc1ccccn1	758839876	FQUZGQDMHHNKCK-SFHVURJKSA-N	445.435	1.424	50	20	IDGD	
CCO[C@@H]1C[C@@H](NC(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)[C@@]12CCCO2	759322819	QYFFVWBKKBCGIB-RKVPGOIHSA-N	426.495	1.152	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)[C@@H]2CCCN2C(=O)c2ccc(OC)cc2OC)nc1	759728706	HIQMSGNOEUKCJM-INIZCTEOSA-N	428.445	1.633	50	20	IDGD	
CCCS(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)c2cc(C)oc2C)c(OC)c1	761266996	LHBJBZSNHRCREI-UHFFFAOYSA-N	445.519	1.680	50	20	IDGD	
COc1ccccc1SCC(=O)NNC(=O)NCCNS(=O)(=O)c1ccccc1	761656051	WYKYMGSBVZHNEU-UHFFFAOYSA-N	438.531	1.096	50	20	IDGD	
C#CCOc1cc(F)ccc1NC(=O)C(=O)NNC(=O)c1cc(OC)c(OC)c(OC)c1	763539027	HPTYGISLSAYECS-UHFFFAOYSA-N	445.403	1.263	50	20	IDGD	
CCCCNS(=O)(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2ccccc2F)c1	763568984	RSNSAJBJNPJBEF-UHFFFAOYSA-N	436.465	1.304	50	20	IDGD	
COC(=O)c1cc(Cl)ccc1NC(=O)C(=O)NNC(=O)[C@H]1COc2ccccc2O1	763572926	VVZTYDLBCYALCY-OAHLLOKOSA-N	433.804	1.053	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)C(=O)NCC3)c(C)n1-c1ccccc1	763602141	PAOFRCBWJSLJBS-UHFFFAOYSA-N	445.479	1.780	50	20	IDGD	
CCN(CC)C(=O)c1ccccc1NC(=O)C(=O)NNC(=O)COc1ccc(C#N)cc1	763674112	LAZKDPVLJJCOML-UHFFFAOYSA-N	437.456	1.205	50	20	IDGD	
CCOc1ccc(NC(=O)C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1Cl	763791576	VZTVJJFTMXRPMI-UHFFFAOYSA-N	443.847	1.385	50	20	IDGD	
O=C(CNC(=O)c1ccc(Oc2ccccc2)cc1)NNC(=O)CNC(=O)c1cccnc1	763825533	RCRQIXOVVURIBP-UHFFFAOYSA-N	447.451	1.181	50	20	IDGD	
C[C@@H](c1ccccc1)n1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(F)cc2)n1	763844162	VQBBIIDJHBUQLJ-AWEZNQCLSA-N	425.420	1.796	50	20	IDGD	
C=CCNC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)cc1	763848304	BLQXRBMCNNJSMH-ZDUSSCGKSA-N	443.435	1.687	50	20	IDGD	
C[C@@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)Cc3c[nH]c4ccccc34)cc2)CCO1	763861410	QPXGWWJNWWIQJH-OAHLLOKOSA-N	435.484	1.722	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)NC(=O)CS2	763864059	FMPQTSRDBMFGQI-JTQLQIEISA-N	432.433	1.423	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(-n3cccn3)nc2)cc1	763871672	HABFNIQBOLFTLY-CQSZACIVSA-N	436.428	1.023	50	20	IDGD	
COC(=O)c1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)[C@H](C)Oc1ccc(F)cc1	763872774	ORPFASMPRBPTKL-JTQLQIEISA-N	437.811	1.819	50	20	IDGD	
COc1ccc(CN(C)C)cc1NC(=O)C(=O)NNC(=O)CSc1ccc(C)cc1	763898332	PZMJJIQBYYGNFS-UHFFFAOYSA-N	430.530	1.943	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(OC)c(OC)c2OC)cc1OC	763900388	IYLQZHHLIOWVRH-UHFFFAOYSA-N	447.444	1.519	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)C(=O)Nc1cccc(Oc2ccccn2)c1	763921834	PFRARFKPOMULCP-UHFFFAOYSA-N	444.411	1.249	50	20	IDGD	
CC(C)C(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)cc1	763994777	GGJJDZYABLJPOR-UHFFFAOYSA-N	436.266	1.771	50	20	IDGD	
CC[C@H](C)Sc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)c(C)c1	764001908	GPHOQDVGFRRWGE-STQMWFEESA-N	427.548	1.406	50	20	IDGD	
COCCOCc1cccc(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)on2)c1	764003180	BOJDELOVDPBQJT-UHFFFAOYSA-N	438.440	1.904	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1ccc(C)cc1OCCN(C)C	764013245	YOPSVYJMBUGCFK-UHFFFAOYSA-N	448.907	1.997	50	20	IDGD	
O=C(NNC(=O)c1cnccn1)C(=O)Nc1ccc(I)cc1Cl	764023698	DACJEEOZJINQJW-UHFFFAOYSA-N	445.604	1.134	50	20	IDGD	
O=C(NNC(=O)c1cnccn1)C(=O)Nc1cccc(-c2cn(Cc3ccccc3)nn2)c1	764025531	WXFVHGLVHFIJLR-UHFFFAOYSA-N	442.439	1.183	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)C(=O)Nc2cccc(-n3cccc3)c2)c1	764085518	MEDAVMZOGFEZPB-UHFFFAOYSA-N	426.454	1.281	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3cccnc3OCC(F)F)n[nH]2)cc1	764109956	DRJBUBWQWAGHRM-UHFFFAOYSA-N	444.398	1.824	50	20	IDGD	
CNC(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2O)c1	764116180	BVDHLLNIMBDZSQ-UHFFFAOYSA-N	425.228	1.458	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3oc(N(C)C)nc3c2)o1	764139576	VQYVBGMZIPFCHX-UHFFFAOYSA-N	442.476	1.728	50	20	IDGD	
O=C(NNC(=O)c1ccoc1)C(=O)Nc1ccc(CCn2nnc(-c3ccccc3)n2)cc1	764159831	IGLWMBGXCJBAOP-UHFFFAOYSA-N	445.439	1.576	50	20	IDGD	
CCOC(=O)CCc1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)cc1	764168222	ONZIRSUHEQZACR-SFHVURJKSA-N	425.441	1.272	50	20	IDGD	
CCOc1c(Br)cc(Cl)cc1NC(=O)C(=O)NNC(=O)c1c[nH]nc1C	764296821	FVTGAWWREZCCPM-UHFFFAOYSA-N	444.673	1.932	50	20	IDGD	
CC(C)(C(=O)NNC(=O)C(=O)Nc1ccc(N2CCOCC2)c(F)c1)c1ccccc1	764308917	IOOPLOHIRZIUQS-UHFFFAOYSA-N	428.464	1.726	50	20	IDGD	
Cc1noc(COc2ccc(NC(=O)C(=O)NNC(=O)c3ccc(O)c(Cl)c3)cc2)n1	764349058	DPRSFONTICTOCD-UHFFFAOYSA-N	445.819	1.716	50	20	IDGD	
CC[C@@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)cc1	764349834	RMBKTIXOEKUEHU-LLVKDONJSA-N	432.864	1.974	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)C(=O)Nc1cc(Cl)ccc1OC[C@H]1CCCO1	764355897	LFYXJQQMKCYAPO-OAHLLOKOSA-N	432.864	1.621	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)CSc2ccccc2OC)cc1C	764392704	KFDPUCPRFZTMKJ-UHFFFAOYSA-N	431.470	1.668	50	20	IDGD	
CCc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2F)cc1S(N)(=O)=O	764413512	SXYCRPKBQNGGDD-UHFFFAOYSA-N	442.856	1.089	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNS(=O)(=O)c3ccc(C#N)cc3C)CC2)cc1	765126702	MMBPSZVSJJSGKT-UHFFFAOYSA-N	441.557	1.302	50	20	IDGD	
CCOC(=O)NNC(=O)C(=O)Nc1ccc(S(=O)(=O)N2C[C@H](C)C[C@@H](C)C2)cc1	765413239	DUGIFASTLGBRNM-CHWSQXEVSA-N	426.495	1.069	50	20	IDGD	
O=C(CCC(=O)N1CCN(c2ccccc2)CC1)NNC(=O)COc1ccccc1O	765443696	HOXSPZUZUSQVAD-UHFFFAOYSA-N	426.473	1.047	50	20	IDGD	
O=C(NC[C@H]1CCCCN1C1CC1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	765663874	RRAXXBRORFAXKA-GOSISDBHSA-N	449.577	1.432	50	20	IDGD	
Cn1cc([N+](=O)[O-])cc1C(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	765753071	UYOIKQXUGAXFDN-UHFFFAOYSA-N	434.884	1.166	50	20	IDGD	
COc1ccc(S(N)(=O)=O)cc1NC(=O)COC(=O)[C@H](Br)C(C)(C)C	766751848	NOBKAQHDYDBIEV-ZDUSSCGKSA-N	437.312	1.634	50	20	IDGD	
COc1cc(NC(=O)CN(C)CC(=O)NNC(=O)Cc2ccccc2C)cc(OC)c1	766913906	SGLZBWSEZWEWBE-UHFFFAOYSA-N	428.489	1.273	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)c1ccc2c(c1)NC(=O)CCS2	767270960	NPLSNWARSSGASZ-UHFFFAOYSA-N	427.482	1.976	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1c[nH]nc1-c1c(F)cccc1F	767959008	UDVCFPVZTILGQL-UHFFFAOYSA-N	427.415	1.823	50	20	IDGD	
C[C@@H]1CN(C(=O)/C(C#N)=C\c2cn(CCC(N)=O)nc2-c2ccc(Cl)cc2)C[C@H]1O	769128114	OAFWOOIGOAQZAY-OWRIDXDPSA-N	427.892	1.825	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@](F)(C(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)C1	772195993	VRSSQSQOGPYHDC-LJQANCHMSA-N	442.875	1.453	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2cnc3ccccc3n2)cc1S(=O)(=O)NC1CC1	773719605	XLBSEFRYJPINEP-UHFFFAOYSA-N	440.485	1.461	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)N[C@H](CS(C)(=O)=O)c2ccccc2)cc1OC	774279796	NATPPEXJHHRXSW-MRXNPFEDSA-N	435.502	1.824	50	20	IDGD	
Cn1cccc1C(=O)NNC(=O)Cc1sc(N2CCOCC2)nc1-c1ccccc1	774327290	MOYOBTMONDBGSD-UHFFFAOYSA-N	425.514	1.989	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)N[C@@H]2C[C@@H](OCC)[C@H]2OC)c2ccccc2c1=O	776519622	ANGYGHOOJXEQAS-NUJGCVRESA-N	431.493	1.333	50	20	IDGD	
O=C(Cc1cccc(Br)c1)N1CCN(S(=O)(=O)CBr)CC1	777837550	NUPZGSKLPQSFCH-UHFFFAOYSA-N	440.157	1.818	50	20	IDGD	
C[C@@H]1CCN(C(=O)OC(C)(C)C)[C@H](C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)C1	778413174	POGNAEOLQVLOGB-PBHICJAKSA-N	444.488	1.898	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)c2cc(S(=O)(=O)N(C)C)cn2C)c(C)n1-c1ccccc1	778525064	SXHHCFGDAQVPFI-UHFFFAOYSA-N	443.529	1.758	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)N[C@H]1CCN(c2ccc(F)c(Cl)c2)C1	778724231	GKZWGRNEHVDSSU-NSHDSACASA-N	429.880	1.913	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@]2(C[C@H]2C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)C1	780173021	BHWYOMCFFXHKCB-YWZLYKJASA-N	427.465	1.070	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2ccc([N+](=O)[O-])cc2C)cc1	782837221	HXIWWRGRKRHUJA-UHFFFAOYSA-N	435.462	1.685	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNc2ccc(Br)cc2F)cccc1-n1cnnn1	783079926	ABNLUKGSUCLFQV-UHFFFAOYSA-N	434.229	1.954	50	20	IDGD	
CS(=O)(=O)N1CCc2c(NC(=O)C(=O)NNc3ncnc4ccsc34)cccc21	783263221	ILQKBMMRRSNVNV-UHFFFAOYSA-N	432.487	1.095	50	20	IDGD	
CN1CCN(C(=O)c2ccccc2NC(=O)C(=O)NNc2nccc3sccc23)CC1	783440208	UTGZEQXYRNOJTE-UHFFFAOYSA-N	438.513	1.766	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)c2nccc3c(S(N)(=O)=O)cccc23)c(OC)c1	783591367	LWKUCVIFASSENT-UHFFFAOYSA-N	430.442	1.434	50	20	IDGD	
CC[C@H](C)n1ncc(NC(=O)C(=O)NNC(=O)CNC(=O)c2cccs2)c1C1CC1	784003553	IGPZHJVERVDYBH-NSHDSACASA-N	432.506	1.309	50	20	IDGD	
Cc1cc(F)cc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)c1	784230768	RHLJRTJDCYFKTP-UHFFFAOYSA-N	449.508	1.152	50	20	IDGD	
Cc1c(NNC(=O)C(=O)Nc2cc(F)c(S(C)(=O)=O)c(F)c2)cccc1[N+](=O)[O-]	784351234	DAHHRHPXGPUATJ-UHFFFAOYSA-N	428.373	1.667	50	20	IDGD	
CNC(=O)COc1ccc(NC(=O)C(=O)NNc2nc(-c3ccc(Cl)cc3)no2)cc1	784799370	FDBFDMFYBBPJSY-UHFFFAOYSA-N	444.835	1.597	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)C(=O)NNc1cc(Cl)ccn1	784860419	DYMPZZGWRWFBHU-UHFFFAOYSA-N	441.897	1.466	50	20	IDGD	
COc1ccc(NNC(=O)C(=O)Nc2ccc(C)c(S(=O)(=O)N(C)C)c2)cc1Cl	785116956	IZZHEMHXAVLNKL-UHFFFAOYSA-N	440.909	1.989	50	20	IDGD	
Cc1ccc(C(=O)NCC2CC2)cc1NC(=O)C(=O)NNC(=O)c1c(C)nc2ccccn12	785990390	GAZMLCPLCPGSHI-UHFFFAOYSA-N	448.483	1.491	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)C(=O)Nc1ccn(C2CCN(C)CC2)n1	787583091	ZVJRYTKYAMLIMM-CYBMUJFWSA-N	448.911	1.357	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)CCc3cnc[nH]3)c2)cc1	788629768	BUUSICNGZQLYPI-UHFFFAOYSA-N	443.485	1.613	50	20	IDGD	
CN(C)[C@@H]1CCOc2c(NC(=O)C(=O)NNC(=O)c3cc(-c4ccccc4)[nH]n3)cccc21	789733009	WPKWISSFVBERAP-LJQANCHMSA-N	448.483	1.862	50	20	IDGD	
Cc1c(Br)ccc(NC(=O)C(=O)NNC(=O)Cc2cn3ccccc3n2)c1F	789767732	DBGLQSWQTLUKPD-UHFFFAOYSA-N	448.252	1.873	50	20	IDGD	
Cc1nn(C)c(C=NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)c1Br	790290522	PALUDUIRZBAXOK-UHFFFAOYSA-N	434.703	1.556	50	20	IDGD	
CC(C)c1c(C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)cnn1-c1ccccc1Cl	792317678	XKYSUQKCKAWEJY-LLVKDONJSA-N	427.914	1.348	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)CCC(=O)c2cnn(C)c2)c2ccccc2c1=O	792813924	ZPTZFJKAGXIORQ-UHFFFAOYSA-N	438.488	1.744	50	20	IDGD	
CCC(=NNC(=O)CNC(=O)c1cccnc1)c1ccc(Cl)c(S(=O)(=O)NC)c1	794858056	RIKKIQBNWJBRSF-UHFFFAOYSA-N	437.909	1.303	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2sccc2S(=O)(=O)C(F)F)cc1C	798309867	PRNLMGUGEVWPFO-UHFFFAOYSA-N	431.442	1.761	50	20	IDGD	
Cc1ccccc1NC(=O)NNC(=O)[C@@H]1CN(Cc2nc(O)c3ccccc3n2)CCO1	798310839	WXPZVNPTVKEFRO-SFHVURJKSA-N	436.472	1.698	50	20	IDGD	
C[C@H]1[C@@H](NC(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)CC(=O)N1Cc1ccccc1	798532284	PDNQYMFTIJTBPM-LRDDRELGSA-N	427.417	1.434	50	20	IDGD	
CSC[C@@H](C)C(=O)N1CCC(C(=O)OCC(=O)NNC(=O)Cc2ccccc2C)CC1	799542311	QIDNDNMUMLODJZ-MRXNPFEDSA-N	449.573	1.466	50	20	IDGD	
CC(C)(C(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1)c1csc(-c2cccs2)n1	800454788	YORSIYRWZZAIJJ-SNVBAGLBSA-N	428.561	1.667	50	20	IDGD	
CCc1ccccc1-n1cc(O)c(C(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)n1	801418670	SDDSAMZBGSZMMN-UHFFFAOYSA-N	433.424	1.630	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2cc(N3CCNC3=O)ccc2F)cc1	802067996	VGUMOSZWMRSLTG-UHFFFAOYSA-N	435.437	1.225	50	20	IDGD	
O=C(CCn1nnc2ccccc2c1=O)NNC(=O)Cc1nc(-c2ccccc2)cs1	802582458	IYWPXOMSUBWACZ-UHFFFAOYSA-N	434.481	1.695	50	20	IDGD	
CCCN(NC(=O)CN(C)S(=O)(=O)c1cccc([N+](=O)[O-])c1)C(=O)OC(C)(C)C	804596210	XIJFGQKRMMPJPF-UHFFFAOYSA-N	430.483	1.894	50	20	IDGD	
CCc1nnc(NC(=O)[C@H](C)[C@H](C)NC(=O)NNC(=O)c2cccc(N(C)C)c2)s1	805878239	GRRQULOZILVWPQ-NEPJUHHUSA-N	433.538	1.774	50	20	IDGD	
O=C(NCCC(=O)N1CCN(c2ccccc2)CC1)NNc1ccc2c(=O)[nH]ccc2c1	806645177	WAONAUYCMBPDQQ-UHFFFAOYSA-N	434.500	1.893	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc3c(c2)C(=O)CC(C)(C)O3)cc1	806973959	YWOSGVZHSPPQCN-UHFFFAOYSA-N	441.440	1.604	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2cccc(Br)c2)sn1	806975205	QOLVXNANRGGKBW-SECBINFHSA-N	427.280	1.767	50	20	IDGD	
O=C(NNC(=O)c1ccnc(C(F)(F)F)c1)c1cccc(S(=O)(=O)N2CCCC2)c1	807922906	ACGZGEDNILULRP-UHFFFAOYSA-N	442.419	1.960	50	20	IDGD	
Cc1ccc(S(=O)(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1C(=O)OC(C)C	808068899	LJGCWBWHAJBXOE-GOSISDBHSA-N	434.470	1.710	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)C1(S(=O)(=O)c2ccccc2)CCCCC1	808343339	FLDNOANGBWSTKM-UHFFFAOYSA-N	449.554	1.802	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)nn1-c1ccc(F)cc1F	808933124	GPHKKNMVNUOILG-UHFFFAOYSA-N	444.354	1.767	50	20	IDGD	
CCc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NNC(=O)[C@H]1OCC[C@H]1c1ccccc1	810405682	JYTDCXJYXWNVQR-WMZOPIPTSA-N	426.429	1.816	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)N2CCN(c3ccccc3)CC2)o1	812480468	AHGDMBTWNARDQT-UHFFFAOYSA-N	427.505	1.231	50	20	IDGD	
CC(=O)N[C@@H](CC(=O)NNc1ccc(S(=O)(=O)N(C)C)cc1)c1ccc(F)cc1F	812732148	UOOVKQCANZDPIB-SFHVURJKSA-N	440.472	1.926	50	20	IDGD	
CN(C)c1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)N(C)C)cc2)cc1Cl	813033423	RZOWVYJPTWLDDW-UHFFFAOYSA-N	439.925	1.738	50	20	IDGD	
O=C(NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12)c1cnn2c1OCCC2	814211900	UTUSHTZKAQYXMI-UHFFFAOYSA-N	444.451	1.499	50	20	IDGD	
COc1cc2c(cc1OC)[C@@H](CC(=O)NN=C[C@@H]1CCCOC1)N(S(C)(=O)=O)CC2	814759337	YYVWBPOPYLRUIZ-WMLDXEAASA-N	439.534	1.481	50	20	IDGD	
CN(C)c1ccc(C2(C(=O)OCC(=O)NNC(=O)[C@@H]3COc4ccccc4O3)CC2)cc1	815304116	KNLUNTLEBOOIGI-IBGZPJMESA-N	439.468	1.315	50	20	IDGD	
O=C(NNC(=O)c1ccoc1)C(=O)Nc1ccc([N+](=O)[O-])c(I)c1	815568486	JXBRVKARRBKOLM-UHFFFAOYSA-N	444.141	1.192	50	20	IDGD	
Cc1nc(-c2cccc(NC(=O)C(=O)NNc3ccccc3S(=O)(=O)N(C)C)c2)n[nH]1	815752598	YVUQWSSRDCRWKJ-UHFFFAOYSA-N	443.489	1.112	50	20	IDGD	
CCOc1ccc(NNC(=O)C(=O)Nc2ccc(F)c(N3CCCS3(=O)=O)c2)cc1	815815307	UNYHGSNJAJHVJR-UHFFFAOYSA-N	436.465	1.846	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)C(=O)Nc2cnn(C(F)F)c2)c1	815865794	GDAHBMHJTCVNTQ-UHFFFAOYSA-N	432.181	1.909	50	20	IDGD	
Cc1c(C(=O)NNC(=O)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)nnn1-c1ccccc1	819658050	HLAHDDMFRYRXEK-OAHLLOKOSA-N	428.493	1.984	50	20	IDGD	
O=C(NNC(=O)[C@H]1CC(=O)N(c2cccc(Br)c2)C1)c1ccc2c(c1)OCO2	913632797	XLZARXRAEBSGEF-LBPRGKRZSA-N	446.257	1.992	50	20	IDGD	
C[C@H](NS(=O)(=O)c1cccs1)C(=O)OCC(=O)NNC(=O)c1ccc(Cl)cc1	915022219	UXFXYLFOXLTDTK-JTQLQIEISA-N	445.906	1.073	50	20	IDGD	
CCCS(=O)(=O)NC1CCN(C(=O)/C(C#N)=C/c2cc(C)n(CCOC)c2C)CC1	915160587	OUHZRUIHUGLONT-XMHGGMMESA-N	436.578	1.979	50	20	IDGD	
COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)C2(O)CCCC2)c1	916142314	PEIMUBFIOVLVGA-UHFFFAOYSA-N	433.486	1.562	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)NCc2ccnc(N3CCCC3)c2)c2ccccc2c1=O	916256079	KZLAWQQQUBBZGX-UHFFFAOYSA-N	435.488	1.556	50	20	IDGD	
CCN(CC)[C@H](CNC(=O)NNC(=O)c1csc(N2CCOCC2)n1)CC(C)C	916258805	MDTGOSBFISYQFU-HNNXBMFYSA-N	426.587	1.680	50	20	IDGD	
Cc1cccc([C@@H](CNC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)N2CCOCC2)c1	916436252	ZMKAIYNXCPNUBY-LJQANCHMSA-N	427.461	1.921	50	20	IDGD	
CNS(=O)(=O)c1cccc(CNC(=O)NNC(=O)Cc2cccc3ccccc23)c1	916485825	HXPSJXHIZNRWOD-UHFFFAOYSA-N	426.498	1.821	50	20	IDGD	
O=C(COc1ccc(Br)cc1)NNC(=O)Cn1cc(Br)cn1	916724429	WAQXWMVYXLQLMQ-UHFFFAOYSA-N	432.072	1.635	50	20	IDGD	
CCCn1nc(C(=O)NNS(=O)(=O)c2ccc(OC)cc2C)c2ccccc2c1=O	917721728	FYTZDNZQZKBPOL-UHFFFAOYSA-N	430.486	1.747	50	20	IDGD	
CC(=O)N1CCc2cc(Br)c(S(=O)(=O)NNC(=O)c3cccn3C)cc21	917729723	SZPFAQVKZNFZQY-UHFFFAOYSA-N	441.307	1.320	50	20	IDGD	
CNS(=O)(=O)c1ccc([C@@H](C)NC(=O)NNC(=O)COc2cc(C)ccc2C)cc1	919778425	ARWMNVDDYXHHKC-OAHLLOKOSA-N	434.518	1.682	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)c2ccc(OC)c(S(=O)(=O)NC3CC3)c2)cc1	919834119	MEXHCARKLYKIJF-UHFFFAOYSA-N	447.513	1.538	50	20	IDGD	
Cc1cc(Br)c2c(c1)C(=NNC(=O)CSc1nnc(O)nc1O)CCO2	920370956	POTNMKGMCVUQBO-UHFFFAOYSA-N	440.279	1.749	50	20	IDGD	
O=C(CN1CCCC1=O)NNC(=O)C[C@@](O)(c1nc2ccccc2s1)C(F)(F)F	920435515	ISFRFDWCCAROHV-MRXNPFEDSA-N	430.408	1.206	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1cc(NC(C)=O)ccc1O	920625951	HLBNGVHKIRUAOP-UHFFFAOYSA-N	435.820	1.631	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)N2CCC(=NNC(=O)NCc3ccco3)CC2)cc1	920828745	FJTSTUPZDPJXEZ-UHFFFAOYSA-N	433.490	1.878	50	20	IDGD	
CN1CCN(C(=O)c2ccc(CNC(=O)NNc3ccc(C(C)(C)C)nn3)cc2)CC1	1116096285	HFSYAVOFQSXFQJ-UHFFFAOYSA-N	425.537	1.988	50	20	IDGD	
Cc1nn(-c2cncc3nnnn23)c(C)c1CC(=O)NNc1cncc(Br)c1	1253718075	GTEANYMHQSZRAU-UHFFFAOYSA-N	443.269	1.165	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H](O)Cc2cccc(OC)c2)c1	1338724941	XWRWDTDBQOZJQF-LJQANCHMSA-N	449.529	1.090	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2n[nH]cc2I)cc(OC)c1OC	1342749461	UKWULLZUQNBOJS-UHFFFAOYSA-N	446.201	1.115	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnc4ccccn34)C2)C1	1777827435	JDEUUPYEHVRNGQ-KUHUBIRLSA-N	435.322	1.951	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnc4sc(C)cn4c3=O)C2)C1	1777988969	FLIXNWOYXXGKGS-KUHUBIRLSA-N	438.937	1.525	50	20	IDGD	
CS(=O)(=O)c1cncc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](F)Cl)C2)c1	1778024220	SMRQLCPIHIRUQA-RVKKMQEKSA-N	447.916	1.147	50	20	IDGD	
C[C@H](C(=O)N1CCO[C@]2(CCN(C(=O)CO[Si](C)(C)C)C2)C1)N1CSCSC1	1779296840	HNIMHFWLJSOUTL-QAPCUYQASA-N	447.699	1.711	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(=O)nc4sccn34)C2)C1	1779949382	WNIJYAFCVSGZEN-YJYMSZOUSA-N	438.937	1.607	50	20	IDGD	
C=C(CC(=O)OCC)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](Br)CC)CCO2	1781271557	DSTNYOIRNAKGPS-KSSFIOAISA-N	431.327	1.499	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H]1CC[C@@H](C(=O)OC)C1)C2	1782171796	GILXNVCYUMXFBY-OVNJDOEUSA-N	444.956	1.343	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CCC(=O)NN(C)C)C2)ccc1O	1782213244	HIOJGWRIDQQUHP-AUSIDOKSSA-N	446.548	1.201	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cncc(N(C)C)c3)CCO2)C1	1783531896	FIGLMVNRJDRZEU-UGSOOPFHSA-N	425.327	1.375	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cccnc3OCC3CC3)CCO2)C1	1783873349	NYEBBONCBRDHGK-UTKZUKDTSA-N	437.924	1.568	50	20	IDGD	
O=C(CCn1c(=O)oc2ccccc21)N1CCO[C@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783943446	IUUXYJDWZWLBJZ-LJQANCHMSA-N	442.299	1.618	50	20	IDGD	
C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4cncn4c3)C[C@@H]21	1783967286	RLUOAGJUVOOLPF-IKICRFKJSA-N	449.349	1.959	50	20	IDGD	
Cc1nccnc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]2C1	1783969010	CXRHHSUFPRFMPG-MXAVVETBSA-N	425.327	1.409	50	20	IDGD	
CN1CCN(C2(C(=O)NC3(c4ccc(NC(=O)[C@@H](O)CCl)cc4)CCC3)CC2)CC1	1786135960	JEKCINJOHXELSK-SFHVURJKSA-N	434.968	1.500	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cn4cccnc4n3)C[C@@H]21	1786406843	JZLYPPXTEGKWMT-YDHLFZDLSA-N	436.310	1.108	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cn3c(=O)n(C)c4ccccc43)[C@H]2C1	1788140284	PHBQVGNXYKNHCP-GGXPGOJBSA-N	448.951	1.337	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)c3cc4n(n3)CCC4)CCC2)cc1)c1ccc(B(O)O)cc1	1788142417	XCDHTGWIJAPHIJ-UHFFFAOYSA-N	444.300	1.571	50	20	IDGD	
CCC(=O)N[C@@H](C)C(=O)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1	1788145235	UBJIRNRYJUQNQY-HNNXBMFYSA-N	437.305	1.029	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)c1ccnc2c1OCO2	1789180129	UENFKUCFFTWKSV-UBHSHLNASA-N	440.294	1.189	50	20	IDGD	
COC(=O)[C@@H]1CC[C@@H](C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]3C2)C1	1789867586	GFUCWRLRAGYMAD-SOZFZDDXSA-N	449.375	1.792	50	20	IDGD	
COc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]3C2)nn1	1789870785	VZBCVAZLCFDEQR-MMNXLFCMSA-N	431.320	1.315	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4ncsc4[nH]3)C[C@@H]21)[C@@H](F)Br	1789926381	VWWGUZWGYCTDGL-WTTBSCSTSA-N	445.314	1.908	50	20	IDGD	
O=C(Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1)c1ccc(O)nc1	1790103083	DUQXWENZBHWUDP-UHFFFAOYSA-N	431.257	1.529	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ncc[nH]3)C[C@@H]21	1790693338	GOYIKTPNHJSUOG-DKQAGWEXSA-N	441.438	1.888	50	20	IDGD	
Cc1cccc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)CBr)n1	1792868504	BVKDTYFTYVMJKV-AMVTXUCVSA-N	438.366	1.943	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COc1cccnc1)C2	1792868624	GTEXXPGJTKSCDA-VWPFQQQWSA-N	426.311	1.081	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CCN1C(=O)OC(C)(C)C)C2	1793447840	NKUQDZNHINNJAQ-QEOTZNIISA-N	443.972	1.993	50	20	IDGD	
COc1ccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)Br)C3)cc1C	1793654763	PAQFOBBOCUFITN-JNNRSPCRSA-N	439.350	1.919	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2	1793879821	FVSQSZFLYGKTOE-PPCPHDFISA-N	442.315	1.243	50	20	IDGD	
O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(=O)c1ccc(Cl)cc1)C2	1795112836	DYYVPCGRUDJMMY-YWVIFJGQSA-N	443.725	1.897	50	20	IDGD	
C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccc(F)cc1	1795249641	IRHLXMBPVBKAGU-LJGDNWOOSA-N	427.314	1.989	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2n(n1)CCCO2	1797438835	DXMPFQYANKFFTM-ZWUHOBOKSA-N	441.326	1.042	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1cccn2ccnc12	1797456103	QEPZLISLTIFWHF-XCCSTKFXSA-N	425.258	1.228	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccn(C(C)C)n1	1798726530	SACCTQGHYFDWMS-FQLMCAECSA-N	427.343	1.841	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(Cl)ccn1	1798731909	PEIYLIQHMKIJLL-BTTYYORXSA-N	428.880	1.299	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1[nH]nnc1C)C2	1799218012	SKTLVQKJKFNXCR-BTTYYORXSA-N	442.432	1.512	50	20	IDGD	
COc1ccc(F)cc1CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Br	1799351770	AISYLNMDRDPSPC-CZAMWMTLSA-N	447.276	1.657	50	20	IDGD	
CCOc1cccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](Cl)COC)C3)c1O	1799756808	YBJMAWWKACJNLO-YXPYIKCWSA-N	426.897	1.248	50	20	IDGD	
C[C@H](NC(=O)c1ccc(F)cc1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](O)CCl)C2	1799811771	QLVTXTDCPZYWAM-WZYMBKROSA-N	425.888	1.182	50	20	IDGD	
CC[C@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)COCCOCCOCCOC)C2	1800073837	AIUPSAOVCYDQPZ-MHORFTMASA-N	434.961	1.338	50	20	IDGD	
Cc1nc[nH]c1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C#N)=C/c1ccc(F)cc1F	1800333208	TVFHGEAPPUAXLF-QYFXKUKHSA-N	441.438	1.807	50	20	IDGD	
COc1ccccc1CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)Br)C2	1800630622	DKFPKDSUSXUJSW-FRQROOTJSA-N	425.323	1.611	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Nc1ccccn1)C2	1800642016	RAKJKGRGCXHMCP-OWVAZHOYSA-N	439.354	1.645	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccnc2c(O)cccc12	1801145124	YAYVFMFNVBUKBS-MUJYYYPQSA-N	439.516	1.565	50	20	IDGD	
C#CC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](Cl)COC	1802283180	PUPCNMDVEHTGLX-QEOTZNIISA-N	441.956	1.795	50	20	IDGD	
CN(C)C(=O)NCC(=O)NC[C@@H]1CCN(C(=O)[C@@](C)(Cl)CCl)[C@@H]1c1cccnc1	1802681284	PHNYSZDDDIIODT-GMBSWORKSA-N	444.363	1.595	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc(O)c([N+](=O)[O-])c2)[C@H]1c1cccnc1)[C@H](O)CCl	1803141188	MKYVAYHQBCAUSB-QGTPRVQTSA-N	448.863	1.615	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)C2(Br)CC2)[C@@H]1c1cccnc1)[C@H](O)CCl	1803141282	NYDXMTKIFTXPRX-BFHYXJOUSA-N	430.730	1.615	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C12CCC(CC1)CC2	1803244567	WFJUOOKDARGHKG-SURIZHFBSA-N	425.533	1.907	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@@H]1c1cccnc1)c1cnsn1	1804995482	IGSXRMYURQHNSJ-UHTWSYAYSA-N	428.287	1.943	50	20	IDGD	
Cc1nocc1C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1	1805823311	CONNYGSRYDQZOD-BEFAXECRSA-N	449.471	1.010	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)o1	1807364700	JUTRRLVELNZXAT-RXVVDRJESA-N	433.273	1.296	50	20	IDGD	
CC[C@H](NC(N)=O)C(=O)NC[C@@H]1CCN(C(=O)[C@H](C)Br)[C@@H]1c1cccnc1	1808233337	LJMGUOCCIURCJF-CYUUQNCZSA-N	440.342	1.318	50	20	IDGD	
COC(=O)C1(C(=O)N2CC[C@H](CNC(=O)[C@H](F)Br)[C@H]2c2cccnc2)CC1	1808677825	DFTMDLLCBIVUJL-MCIONIFRSA-N	442.285	1.731	50	20	IDGD	
Cn1cc(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)c(C(F)F)n1	1808841010	CJYCIQTYOYAANO-NOLJZWGESA-N	441.866	1.672	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)c1n[nH]c2ccccc12	1809822853	TXQVTNLAPXJXOW-FNHZYXHNSA-N	427.892	1.877	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@H]1CCN(C(=O)CSc2nc[nH]n2)[C@@H]1c1cccnc1	1810548424	QXVFEZGAKKQOEH-CRAIPNDOSA-N	448.625	1.849	50	20	IDGD	
COC(=O)C1(C(=O)NC[C@@H]2CCN(C(=O)[C@H](F)Br)[C@@H]2c2cccnc2)CC1	1812691162	DVSGRNQDJZFJBW-MJBXVCDLSA-N	442.285	1.731	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)CCN2CCOC2=O)[C@H]1c1cccnc1	1813029953	CDRRTIDSBDANDD-RYRKJORJSA-N	438.912	1.184	50	20	IDGD	
C[C@H](C(=O)NC[C@@H]1CCN(C(=O)[C@](C)(Cl)CCl)[C@@H]1c1cccnc1)n1cnnn1	1813473722	OGVKYSRLILKHIN-MJXUCMMTSA-N	440.335	1.571	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H]3CCC(=O)N3)sc2C1	1814398948	BINAQLJPWUNRPC-FXPVBKGRSA-N	429.340	1.365	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)C(O)O)n[nH]1	1814712674	VLLMCCNVVJOJPF-NYUWMOHMSA-N	431.399	1.598	50	20	IDGD	
C[C@H](CBr)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H]2CCC(=O)NC2)[nH]n1	1814776336	MMOOBUKPKFECCY-YRGRVCCFSA-N	440.342	1.959	50	20	IDGD	
O=C(N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1)C1=CCCS1	1815337176	NXMCDRJIUPVJHV-CYBMUJFWSA-N	429.332	1.070	50	20	IDGD	
Cc1cnn(CC(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@@H](F)Br)CC3)c1	1815760171	PXAHIFHGQBJHLA-NOZJJQNGSA-N	430.303	1.951	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)COC(=O)C(F)(F)F)n[nH]1	1819315884	BZJNIMJNIJVZPF-MWLCHTKSSA-N	440.806	1.761	50	20	IDGD	
Cc1cc[nH]c1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1	1819401820	BAOBCKFCJDFJAQ-MRXNPFEDSA-N	436.476	1.664	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)CCl)CC2)c1cccn(C(F)F)c1=O	1820249536	CAMCKBJSTDCJTI-KCJUWKMLSA-N	446.863	1.525	50	20	IDGD	
O=C1CC[C@H](C(=O)N2CCCC[C@@H]2c2cc(NC(=O)[C@@H](F)Br)n[nH]2)CN1	1820934699	OZOSRMWCYJEETO-DRCTWCGVSA-N	430.278	1.619	50	20	IDGD	
C[C@@H](Br)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CN2CCOCC2)[nH]n1	1822184826	WRUAYNVPUYQNSV-TZMCWYRMSA-N	428.331	1.517	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)C3(N4CCN(C)CC4)CC3)sc2C1	1822719926	ZNEUVRXPOBKXFJ-ZIAGYGMSSA-N	440.013	1.853	50	20	IDGD	
CCNC(=S)NCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](C)Br)CC2	1824509382	MDOONBDDRBQYOB-IUCAKERBSA-N	448.412	1.323	50	20	IDGD	
CC(C)[C@@H](S)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1	1824540159	HANKGCVPLPVHSH-RBUKOAKNSA-N	447.605	1.873	50	20	IDGD	
CN1CCCC[C@@H]1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827049630	YQGTYYCCBLDEST-FGZHOGPDSA-N	441.381	1.084	50	20	IDGD	
O=C(CC[C@H]1CCOC1)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1	1827054407	DKUWGIKIHZCGLB-PGRDOPGGSA-N	442.365	1.416	50	20	IDGD	
CC(C)/C=C/C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnccc1C(=O)NN)CC2	1827437525	OVXWFDHRHSDJFP-UXONFWTHSA-N	428.518	1.580	50	20	IDGD	
C#CCCCC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1	1828925858	QIIGFKOTKJUMNA-FQEVSTJZSA-N	425.533	1.722	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCCn3cccc3)C2)C1	1830369879	CUYQMMOWZWACIF-OAQYLSRUSA-N	425.957	1.990	50	20	IDGD	
Cc1nccn1CCCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830370543	TUNNPPAHSFBWMC-OAQYLSRUSA-N	440.972	1.693	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)C[C@H]3CCCCO3)C2)C1	1830535527	QCLSQFIETJIWFN-GPMSIDNRSA-N	447.370	1.433	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)C#Cc3ccccc3)C2)C1	1830537566	KMWSNEGZCSQVOI-LAUBAEHRSA-N	449.345	1.526	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cccnc3)C2)C1	1830538430	FSPKDFBIHXULHQ-KXBFYZLASA-N	440.338	1.112	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)C3=COCCC3)C2)C1	1830544461	YWWUJVFGQGODQB-KBXCAEBGSA-N	431.327	1.168	50	20	IDGD	
C=CCC(CC=C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)Br)C2)C1	1830644892	ZPRZHMQTCFTYCQ-BEFAXECRSA-N	429.355	1.995	50	20	IDGD	
Cc1ccc(/C=C/C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)s1	1830738592	QJXIOENLHAOHBT-BSCWQEJHSA-N	428.938	1.126	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3nnsc3C3CC3)C2)C1	1831645676	CZFKNCXWFPTMNN-LIRRHRJNSA-N	442.969	1.893	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnc(O)nc2O)CC1	1831652718	INPFDQSLTPYYCQ-RISCZKNCSA-N	441.326	1.905	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CNC(=O)C(F)(F)F)CC1	1831900660	TWGPFBWUBFDTAL-KGLIPLIRSA-N	441.878	1.538	50	20	IDGD	
CS(=O)(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H](F)Br)CC1	1832402160	VBPFUFSIVUQPCE-HIFRSBDPSA-N	441.363	1.731	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)C3CCC(CO)CC3)CCO2)C1	1832513779	AVCILKIBCFMFJA-XVAHUTHZSA-N	430.973	1.649	50	20	IDGD	
Cc1cn(CC(=O)N2CCCC[C@@H]2C2CCN(C(=O)[C@@H](F)Cl)CC2)c(=O)nc1O	1832772929	HBLOVFUEFYMNBY-GDBMZVCRSA-N	428.892	1.411	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccnc3)CCO2)C1	1834001112	LLZXGNQZAZPXHF-KDOFPFPSSA-N	426.311	1.183	50	20	IDGD	
Cc1noc(N)c1C(=O)NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1	1834701273	DXDKAQYIUYGCOC-AWEZNQCLSA-N	446.321	1.441	50	20	IDGD	
O=C(CC[C@H]1CCOC1)N1CCOC[C@]2(C1)CN(C(=O)CCBr)CCO2	1834826865	ZFONXPCOEYWZLS-YJBOKZPZSA-N	433.343	1.045	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCOc3ccccc3)CCO2)C1	1834833348	MURCYBAZSYEMQA-NQIIRXRSSA-N	440.924	1.166	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)C3CCC3)CC2)CC1	1835118143	AOFUUPSINVYYKY-WGOQTCKBSA-N	442.564	1.492	50	20	IDGD	
CNc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)cc1	1835609630	BOFQTPXGQDEVLD-KUHUBIRLSA-N	440.338	1.582	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cnc(N(C)C)o3)CC2)CC1	1837387936	CUEZCEDGSBWKQY-INIZCTEOSA-N	442.944	1.607	50	20	IDGD	
Cc1cnn([C@@H](C)C(=O)N2CCOC[C@@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)c1	1837718072	XDYGJIKJWRGIQC-FXAWDEMLSA-N	438.601	1.060	50	20	IDGD	
COc1ccccc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1838876803	IDTLEINSJZALPG-MAUKXSAKSA-N	445.285	1.456	50	20	IDGD	
Cc1cccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)c1	1838941509	NPIWLNUEQCNGRZ-KXBFYZLASA-N	425.323	1.848	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1	1839153654	NKNJTLSUDJMWOF-DLBZAZTESA-N	441.428	1.531	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C=C/c3cnccn3)C2)C1	1839156405	OMAZQSFNPGGXQB-WTJLDUFHSA-N	443.331	1.183	50	20	IDGD	
Cc1cccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)c1F	1839197443	WOVMWWAAHPCGKY-MAUKXSAKSA-N	447.276	1.895	50	20	IDGD	
O=C([C@@H]1[C@H]2C=CS[C@H]21)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1839699901	XJMRWGHEHXGKOU-ZRTFPUAOSA-N	435.315	1.008	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(O)n3)C2)C1	1839963713	SZLPAUAAKNUDDC-SCLBCKFNSA-N	442.310	1.031	50	20	IDGD	
Cc1ccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)CCBr)C3)C2)o1	1840506688	OWLTUCPYEYGLPG-GOSISDBHSA-N	429.311	1.372	50	20	IDGD	
O=C(C(Cl)Cl)N1CCOC[C@]2(C1)CN(C(=O)C1Cc3ccccc3C1)CCO2	1840944343	CJYYAMZNZOJLIS-HXUWFJFHSA-N	427.328	1.662	50	20	IDGD	
O=C([C@@H](O)CCl)N1CCOC[C@]2(C1)CN(C(=O)C13CC(c4ccccc4)(C1)C3)CCO2	1840952462	HZSAVUQGGBFZGC-QVYZHRQISA-N	448.947	1.164	50	20	IDGD	
Cc1nocc1C(=O)N1CC2(CCCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C1	1841924223	KUTJRAVPFJQERC-AWEZNQCLSA-N	426.901	1.932	50	20	IDGD	
C[Si](C)(C)C#CCCCC(=O)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1	1843014327	XPDSWZJEKGKTDA-UHFFFAOYSA-N	426.398	1.235	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)CCn1nc(C)cc1C)C2	1843417304	UAKGXJHDYNBIFB-JJIBRWJFSA-N	439.520	1.227	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)C2=NO[C@@H](c3ccccc3)C2)C1	1843864658	NAYYABZTWDPBEE-GOSISDBHSA-N	427.505	1.080	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)c2ccc(-c3ccc(O)nn3)cc2)C1	1845550506	FFMAKXGATMOFNK-INIZCTEOSA-N	430.892	1.920	50	20	IDGD	
C/C(=C/C(=O)N1CCCC12CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)C(=O)O	1846994574	FUIJXEIWIRCRJI-FSBNRTBOSA-N	429.901	1.353	50	20	IDGD	
CC(C)(C)OC(=O)N1[C@H]2C[C@H]2C[C@@H]1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl	1847568715	JESFOQQMYHZWSY-SBOZNWLOSA-N	427.929	1.186	50	20	IDGD	
Cc1cc(C)cc(OCC(=O)NNC(=O)CN2C(=O)N[C@]3(C[C@H](C)CC(C)(C)C3)C2=O)c1	23154006	TYYANNWSMQGJLH-MWTRTKDXSA-N	444.532	1.966	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cccc3c2OCCO3)c1	109284457	CULWBPUAXDHJAS-UHFFFAOYSA-N	433.486	1.563	50	20	IDGD	
CC(=O)N[C@H](CC(=O)NNC(=O)C(=O)Nc1ccc(C)c(C)c1)c1c(F)cccc1F	727493004	FSJJSJGXWMOUIN-QGZVFWFLSA-N	432.427	1.935	50	20	IDGD	
COc1ccc(NC(=S)NNC(=O)c2cccc(S(=O)(=O)N(C)OC)c2)cc1F	727499514	LHLWXOIWJBBLJC-UHFFFAOYSA-N	442.494	1.648	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)[C@@H](C)Oc2ccc3ccccc3c2)cc1C(N)=O	728170532	ZZHHDYJMFLLQJT-CYBMUJFWSA-N	443.481	1.724	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)cc(Cl)c1OCCC(C)C	728384630	NVKLSFDWMIJYDV-LBPRGKRZSA-N	432.926	1.969	50	20	IDGD	
O=C(NNC(=O)c1occc1CN1C(=O)Cc2ccccc21)c1ccc(-n2cnnn2)cc1	728513053	PNSOLYJRUFDOHM-UHFFFAOYSA-N	443.423	1.419	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1	728844932	AVNXRUZNFBZRKS-UHFFFAOYSA-N	436.432	1.248	50	20	IDGD	
Cc1ccc(NS(=O)(=O)c2ccc(C)c(C(=O)NNC(=O)Cc3cc[nH]n3)c2)cc1	730091542	HOHJRHLBUSCKOS-UHFFFAOYSA-N	427.486	1.831	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(n2cc(C(=O)NNC(=O)Cc3ccccc3F)nn2)CC1	731328664	SIFCRGOFVDBSCK-UHFFFAOYSA-N	446.483	1.993	50	20	IDGD	
CCCCN(C)C(=O)c1ccccc1S(=O)(=O)NNC(=O)COc1ccccc1O	731485417	PIHHWWUQXFUUAX-UHFFFAOYSA-N	435.502	1.653	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)[C@H]2CCCN(C(N)=O)C2)c2ccccc2c1=O	731808265	NNVXASOTXLDWMY-AWEZNQCLSA-N	428.493	1.138	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)N[C@H]1CCN(c2ccccc2Cl)C1=O	732236104	PCMOSRGZPYQJCP-AWEZNQCLSA-N	432.864	1.863	50	20	IDGD	
O=C(NNc1cncc(Cl)n1)N[C@H]1CCCN(c2cc(N3CCOCC3)ncn2)C1	732913602	AWZLILUPXBTZPY-ZDUSSCGKSA-N	433.904	1.052	50	20	IDGD	
O=C(NCC(=O)OCc1ccccc1Cl)NNC(=O)c1ccc(-n2cnnn2)cc1	733336349	PYWZISQIBXJMQD-UHFFFAOYSA-N	429.824	1.003	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)N[C@H]2CCC[C@@H](C(=O)N(C)C)C2)c2ccccc2c1=O	734223936	RVKDAJHVRJVELN-CABCVRRESA-N	442.520	1.568	50	20	IDGD	
CC(=O)N[C@H](CC(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)c1ccc(Cl)cc1	734241007	ZGYBUOPAOPDVLB-OAHLLOKOSA-N	441.916	1.762	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)[C@@]2(C)Cc3ccccc3C(=O)O2)CC1	734821847	NDJSZKXLOUGLCH-JOCHJYFZSA-N	446.504	1.888	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=S)Nc2ccc3c(c2)OCO3)cc1	735233911	WMWODZLSPJXXRR-UHFFFAOYSA-N	436.515	1.362	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Cc2cc(-c3ccccc3)on2)c1	735834316	PCUIPOSHEZFUFS-UHFFFAOYSA-N	428.470	1.596	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)Cn2cc(C(N)=O)c3ccccc32)cc1C	736793852	BFISGEVVRRDJBD-UHFFFAOYSA-N	442.497	1.677	50	20	IDGD	
C[C@@H](CC(=O)NNC(=O)Cc1ccc(Cl)cc1)/N=C1/NS(=O)(=O)c2ccccc21	742480760	TWBKYKGBHHZBER-LBPRGKRZSA-N	434.905	1.547	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)[C@@H](c1ccccc1F)N1CCOCC1	742677030	MVLJGUUWMNSHFI-MRXNPFEDSA-N	439.488	1.054	50	20	IDGD	
O=C(NNC(=O)c1cccc(Br)c1)NNC(=O)[C@@H]1COc2ccccc2O1	743687731	PXJQPAZJMKOPRU-AWEZNQCLSA-N	435.234	1.264	50	20	IDGD	
COC(=O)c1cn(CC(=O)OCC(=O)NNC(=O)c2cccc(C#N)c2)c2ccccc12	744586526	CFYUFLNXHNJVNT-UHFFFAOYSA-N	434.408	1.304	50	20	IDGD	
CCc1nc(COc2ccc(C(=O)OCC(=O)NNC(=O)c3ccc(C#N)cc3)cc2)no1	745038571	ITJLPSSWJOYNSE-UHFFFAOYSA-N	449.423	1.701	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccc(NNC(=O)N[C@H]3C[C@]3(C)c3ccccc3)nc2)CC1	745859450	YZUSOTKCISYERJ-GHTZIAJQSA-N	444.561	1.374	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)c1ccc(-n2cccn2)cc1	745925569	QMZYNHNKPNGOJM-AWEZNQCLSA-N	431.456	1.824	50	20	IDGD	
Cc1cc(N2C[C@@H](C(=O)NNC(=O)N3CCOCC3)CC2=O)ccc1Br	745987952	NTUKZJDSHSNFDN-LBPRGKRZSA-N	425.283	1.183	50	20	IDGD	
CSCC[C@H](NC(=O)c1ccc(Cl)cc1Cl)C(=O)NNC(=O)N1CCOCC1	745996066	LDRLDPVBJIZPGW-AWEZNQCLSA-N	449.360	1.918	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)NOCc2cccnc2)cc1	747578435	DCQAYNXXYQNTEA-WOJGMQOQSA-N	446.467	1.984	50	20	IDGD	
O=C(NNC(=O)c1cn(-c2ccccc2)nc1-c1ccccc1)C1=NN2CCCN=C2N1	748012525	KNBYJPUWAXOYEP-UHFFFAOYSA-N	428.456	1.279	50	20	IDGD	
O=C(NCCS(=O)(=O)N1CCOCC1)NNc1c(Cl)cc(Cl)cc1Cl	748111400	MIPDKVLNUFQICY-UHFFFAOYSA-N	431.729	1.935	50	20	IDGD	
C[C@@]1(c2ccc(C(=O)NNC(=O)NCc3cccc(C(F)(F)F)c3)cc2)NC(=O)NC1=O	748532052	COUMCWIIVFOYLS-IBGZPJMESA-N	449.389	1.904	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)N[C@H]2CCCN(C)C2=O)c2ccccc2c1=O	748664639	LYNBETOMBVXNGC-INIZCTEOSA-N	428.493	1.152	50	20	IDGD	
CN1C(=C(C#N)C(=O)CCC(=O)N2CCN(c3cnn(C)c3)C(=O)C2)N(C)c2ccccc21	750076396	LWAXUZGQGJOQPQ-UHFFFAOYSA-N	447.499	1.266	50	20	IDGD	
Cc1nn(-c2cncc3nnnn23)c(C)c1CC(=O)NNc1nc(-c2ccccc2)no1	750312417	OVWNZHRUBJWIEN-UHFFFAOYSA-N	431.420	1.058	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2ccccc2OC(F)F)cc(OC)c1OC	751266477	DPPAULGWDSPZPW-UHFFFAOYSA-N	432.401	1.937	50	20	IDGD	
CNS(=O)(=O)c1cc(C(=O)OCC(=O)C(C#N)=C2N(C)c3ccccc3N2C)c(C)o1	751739960	JSBSPDVVOZDCBY-UHFFFAOYSA-N	444.469	1.543	50	20	IDGD	
CC(=O)N1CCN(S(=O)(=O)c2ccc(C(=O)NNc3cccnc3Cl)cc2)CC1	754479554	CPBSBNYVYRJAKE-UHFFFAOYSA-N	437.909	1.345	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1ccnc(O[C@H]2CCOC2)c1	755051039	LCNSZRAVJOKGHJ-AWEZNQCLSA-N	449.847	1.529	50	20	IDGD	
COC(=O)N(C)c1ccc(NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1	756207930	USIXDTSLHFIILJ-UHFFFAOYSA-N	427.465	1.749	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2cc(C(N)=O)ccc2C)c1	756260374	WBVGJIUBIJTEMN-UHFFFAOYSA-N	447.517	1.591	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)CN2C(=O)N[C@]3(C[C@@H](C)C[C@@H](C)C3)C2=O)c1C	756866725	FGTHSTDKROPCMT-DOGSQSLWSA-N	444.532	1.965	50	20	IDGD	
Cc1sc2nc(CS[C@H](C)C(=O)NNc3ccc(C(N)=O)nn3)nc(O)c2c1C	757393003	TYDZTBYJHUDLGC-SECBINFHSA-N	433.519	1.668	50	20	IDGD	
CCOC(=O)c1cc(NC(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)cn1C	757595448	UHKOUANPSFHXNX-UHFFFAOYSA-N	440.460	1.959	50	20	IDGD	
C#Cc1cccc(NC(=S)NNC(=O)CN2C(=O)NC3(C[C@H](C)C[C@@H](C)C3)C2=O)c1	757642576	UBBOYDOQXVSASV-ZIAGYGMSSA-N	427.530	1.732	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNS(=O)(=O)c1c(F)cc(C#N)cc1F	757647104	XEMOLIYJOWDXSC-UHFFFAOYSA-N	443.457	1.061	50	20	IDGD	
CN(c1ccccc1NC(=O)NNC(=O)c1cc(Br)c[nH]1)S(C)(=O)=O	757661822	SLZGODXEEVLCAS-UHFFFAOYSA-N	430.284	1.640	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)c2ccn(-c3ccc(Cl)cc3)n2)n1	757865981	CEHBRVURYWYRDG-UHFFFAOYSA-N	433.877	1.838	50	20	IDGD	
O=C(NNC(=S)NC[C@@H]1CCCCO1)c1ccc(S(=O)(=O)N2CCCC2)cc1	758174953	JFSBYXLJGPXDLY-HNNXBMFYSA-N	426.564	1.149	50	20	IDGD	
CC1CCC(Oc2cc(CNC(=O)NNC(=O)C(=O)Nc3ccccn3)ccn2)CC1	758771545	ADUWZXMQQLKWKZ-UHFFFAOYSA-N	426.477	1.903	50	20	IDGD	
CC(C)C[C@@H](NC(=O)c1ccc(Cl)cc1)C(=O)NNC(=O)C(=O)Nc1ccccn1	758839263	CARNWOZURFFONV-OAHLLOKOSA-N	431.880	1.666	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)NC[C@H]1CN(Cc2ccccc2)CCCO1	759214486	OHDDKQQVWDKVQE-FQEVSTJZSA-N	426.517	1.859	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)CCn2c(S)nnc2-c2ccc(OC)cc2)nc1	759722073	WEWSYICLJJTINA-UHFFFAOYSA-N	428.474	1.957	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)c2cc(S(C)(=O)=O)ccc2Br)nc1	759725406	OWFGQQUZUGEXHZ-UHFFFAOYSA-N	428.264	1.791	50	20	IDGD	
O=C(CN1CCN(c2nc(F)c(F)cc2F)CC1)NNC(=O)c1cccc(Cl)c1	759989203	QZKRSNYSVYRSLJ-UHFFFAOYSA-N	427.814	1.736	50	20	IDGD	
O=C(Cn1ccc2ccccc21)NNC(=O)N=c1cc[nH]cc1I	760035069	SQHXHUNMURXKEG-UHFFFAOYSA-N	435.225	1.916	50	20	IDGD	
NC(=O)[C@H]1CC[C@@H](CNC(=O)NNC(=O)COc2ccc(OCc3ccccc3)cc2)O1	760204251	PEULQLWBXWJVRV-RBUKOAKNSA-N	442.472	1.008	50	20	IDGD	
CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)c1cnn(CCC#N)c1-c1ccccc1	760338348	OTOXLENPJTZDHX-UHFFFAOYSA-N	441.492	1.932	50	20	IDGD	
Cc1cccc(N2C(=O)N[C@@H](CCC(=O)NNC(=O)CCNC(=O)OC(C)(C)C)C2=O)c1	760442277	HCMOFWANTZGJLZ-HNNXBMFYSA-N	447.492	1.262	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)Nc2ccc(CN3C(=O)CCCC3=O)cc2)cc1	760953994	GGMQFTMVYBOZKE-UHFFFAOYSA-N	435.440	1.829	50	20	IDGD	
O=C(COC(=O)Cc1cccc(I)c1)NNC(=O)c1cccs1	761495977	UBWPNEDCIFMJCY-UHFFFAOYSA-N	444.250	1.900	50	20	IDGD	
CCC(=O)N1CC[C@@H](NC(=O)NNC(=O)[C@@H]2Cc3ccccc3CN2Cc2ccccc2)C1	762381697	DAGYSWYRXIJQMY-YADHBBJMSA-N	449.555	1.955	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccncc2)n([C@@H]2CCN(Cc3ccccc3)C2)n1	763465333	WOCNEVFWSLXMQM-LJQANCHMSA-N	447.499	1.433	50	20	IDGD	
COC(=O)c1ccc(OCc2ccccc2)c(NC(=O)C(=O)NNC(=O)c2ccccn2)c1	763468223	UUNWJKZFOOJFCU-UHFFFAOYSA-N	448.435	1.847	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)c2c[nH]c3ccccc23)cc1Cl	763535284	QWWHLTFTNZSARC-UHFFFAOYSA-N	444.831	1.773	50	20	IDGD	
O=C(NNC(=O)c1ccc2c(c1)OCO2)C(=O)Nc1ccc(-n2cncn2)c(Cl)c1	763550530	CMHZHZQBZHOSSI-UHFFFAOYSA-N	428.792	1.049	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)C(=O)Nc1ccnn1Cc1ccccc1F	763680927	XJKGTNSNTFYTKX-UHFFFAOYSA-N	429.383	1.375	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)C(=O)Nc2cccc(C(F)F)c2Cl)c2ccccc2c1=O	763789729	BMOYWLLDDUEPTG-UHFFFAOYSA-N	449.801	1.924	50	20	IDGD	
Cc1cccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccn(Cc3ccccn3)n2)c1C	763840245	JSWAIEIIZAFHQR-MRXNPFEDSA-N	436.472	1.497	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccnn2-c2ccncc2)cc1	763862147	UXAHFMANGXHHQZ-AWEZNQCLSA-N	438.444	1.219	50	20	IDGD	
Cc1nc(-c2ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc3ccccc3F)cc2)n[nH]1	763866292	VJDNHTKZASUSLS-NSHDSACASA-N	426.408	1.473	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)C(=O)Nc2cc(NC(=O)OC(C)(C)C)ccc2F)n1	763893217	PUSFFTKTJATILY-UHFFFAOYSA-N	448.455	1.772	50	20	IDGD	
O=C(Cc1ccc(F)cc1)NNC(=O)C(=O)Nc1ccc(Cl)c(C(=O)NC2CC2)c1	763918493	FKDWORUPMKMRDS-UHFFFAOYSA-N	432.839	1.700	50	20	IDGD	
Cn1cc(Br)cc1C(=O)NNC(=O)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl	764005038	SLANDSWWDNUWJX-UHFFFAOYSA-N	444.629	1.749	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)C(=O)Nc1ccc(N2CCO[C@H](C)C2)cc1	764012274	NICMICLVKGSPOY-CYBMUJFWSA-N	446.891	1.973	50	20	IDGD	
CC(C)OC(=O)c1c(NC(=O)C(=O)NNC(=O)c2cnccn2)sc2c1CC[C@H](C)C2	764025528	WUFVAZWCPHDYGB-NSHDSACASA-N	445.501	1.628	50	20	IDGD	
Cc1ccc(S(C)(=O)=O)cc1NC(=O)C(=O)NNC(=O)Cc1cccc2ccccc12	764035625	GMYPSCOKJMWVSO-UHFFFAOYSA-N	439.493	1.880	50	20	IDGD	
N#Cc1ccc(Oc2ccc(NC(=O)C(=O)NNC(=O)[C@H]3Cc4ccccc4O3)cn2)cc1	764151980	MSGNSSRLAPOAIK-LJQANCHMSA-N	443.419	1.835	50	20	IDGD	
CO[C@H]1Cc2ccc(NC(=O)C(=O)NNC(=O)c3cc(Br)ccc3O)cc2C1	764279117	YOEFOZHTAJRUGY-AWEZNQCLSA-N	448.273	1.668	50	20	IDGD	
O=C(NNC(=O)C1CCC1)C(=O)Nc1cccc(Oc2ncc(Br)cn2)c1	764334330	DENPUEKVNMEELZ-UHFFFAOYSA-N	434.250	1.917	50	20	IDGD	
CC(=O)Nc1cncc(C(=O)NNC(=O)C(=O)Nc2ccc(-c3csc(C)n3)cc2)c1	764432082	BTHNRPIVPUOXNA-UHFFFAOYSA-N	438.469	1.872	50	20	IDGD	
CCCCCCOc1cccc(C=NNC(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)c1	764816612	LWIQCZBSUFMMBM-UHFFFAOYSA-N	440.504	1.543	50	20	IDGD	
CC(=O)Nc1ccc(C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1F	764938796	IRGUARXCTNVZSD-UHFFFAOYSA-N	436.465	1.174	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)cc1S(C)(=O)=O	765522160	YQRQZKQCWGEVOK-UHFFFAOYSA-N	436.486	1.753	50	20	IDGD	
COCCNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cc(-c3cccs3)[nH]n2)cc1	765567336	FTYZYXWLVPISER-UHFFFAOYSA-N	449.514	1.138	50	20	IDGD	
O=C(CCn1c(=O)nc(O)c2ccccc21)NNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1	765621626	WWNQAYGBUNWBBF-UHFFFAOYSA-N	436.403	1.483	50	20	IDGD	
Cc1ccccc1OCCCC(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765732535	JBYJGQGOVLLDCG-UHFFFAOYSA-N	438.528	1.759	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)[C@@H]1C[C@@]12CCCc1ccccc12	765738801	OMKOZKXVNSFSIX-BKMJKUGQSA-N	446.551	1.886	50	20	IDGD	
COc1nccnc1NNC(=O)C(=O)Nc1ccc(C)c(S(=O)(=O)N2CCCCC2)c1	766272924	ZKZMCVZZOOZRRT-UHFFFAOYSA-N	448.505	1.050	50	20	IDGD	
COc1cc(CCNC(=O)NNc2ccccc2S(C)(=O)=O)c([N+](=O)[O-])cc1OC	766853078	HGGLSOVVQVFEIZ-UHFFFAOYSA-N	438.462	1.884	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)c1nn(-c2ccccc2)c(C)cc1=O	767264890	HOOYLRQGVVQWDV-UHFFFAOYSA-N	434.452	1.396	50	20	IDGD	
C=CCNS(=O)(=O)c1cccc(C(=O)OCC(=O)NNC(=O)Cc2ccccc2C)c1	767268500	OSSPNXNMAUSEAQ-UHFFFAOYSA-N	445.497	1.006	50	20	IDGD	
COc1ccnc(NNC(=O)NCc2ccc(Br)cc2N2CCOCC2)n1	770418701	VQZGMZHHKYHMFL-UHFFFAOYSA-N	437.298	1.911	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)C(=O)Nc1ccnn1-c1cccc(F)c1	770779890	FGNPCPLTABUFSW-UHFFFAOYSA-N	429.433	1.595	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)N[C@@H]1CC(=O)N(c2c(F)cccc2F)C1	771432376	ABXSOOKEGJQVAD-LLVKDONJSA-N	449.370	1.388	50	20	IDGD	
COc1cc(C)c(S(=O)(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)cc1C	771609228	XJAKPTZROBYVDZ-UHFFFAOYSA-N	425.894	1.591	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)[C@@H]1CCN(c2cccc(Br)c2)C1=O	772033697	VORXQEAIBHRRIH-GXFFZTMASA-N	426.267	1.291	50	20	IDGD	
COc1cccc(C)c1NC(=O)C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	773510645	GZIBHSIZVVFLDG-UHFFFAOYSA-N	439.516	1.302	50	20	IDGD	
CN1CCN(CCOc2ccc(NC(=O)C(=O)NNc3cnc4ccccc4n3)cc2)CC1	773716983	UHVRBNOTSYTSNX-UHFFFAOYSA-N	449.515	1.338	50	20	IDGD	
Cc1cc(CNC(=O)NNC(=O)[C@@H](C)Oc2cccc(Cl)c2)ccc1S(N)(=O)=O	775226154	QRQLQDCDECXQNV-GFCCVEGCSA-N	440.909	1.594	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2ccc(NC(=O)NNC(=O)c3ccccc3)cc2)C[C@@H](C)O1	775280897	ZALLAXQKDMSFIT-GASCZTMLSA-N	432.502	1.951	50	20	IDGD	
CN(NC(=O)c1ccc(F)cc1[N+](=O)[O-])C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	776205614	NBIJWXNPRXMICH-UHFFFAOYSA-N	425.417	1.983	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2cc([N+](=O)[O-])c(F)cc2C)cc(OC)c1OC	777907286	QJHFVILTDCATER-UHFFFAOYSA-N	443.409	1.691	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)CCNS(=O)(=O)c2ccccc2Cl)nc1C	778510074	CDCQDHRZINGRSQ-UHFFFAOYSA-N	441.897	1.427	50	20	IDGD	
COc1ccc(Cn2ccc(NC(=O)C(=O)NNC(=O)c3ccc4ccccc4n3)n2)cc1	778705599	DXAIMXMQNPJQQT-UHFFFAOYSA-N	444.451	1.888	50	20	IDGD	
Cc1nn(-c2ccccc2)cc1CNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1	781409782	YVMVWMQMVMRRGU-UHFFFAOYSA-N	434.504	1.718	50	20	IDGD	
COc1cccc(NNC(=O)[C@@H]2C[C@H](O)CN2S(=O)(=O)c2ccc(Cl)cc2)n1	782047365	AZJSCSDUBCEUTJ-JSGCOSHPSA-N	426.882	1.011	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ncnc3ccsc23)cc1N1CCCS1(=O)=O	783254935	NJMBJPHAVNMUOI-UHFFFAOYSA-N	446.514	1.621	50	20	IDGD	
COc1cc(NC(=O)C(=O)NN=c2cc[nH]cc2)c(C(=O)N2CCCCC2)cc1OC	783376145	IBAUHIZHKGSRRD-UHFFFAOYSA-N	427.461	1.229	50	20	IDGD	
O=C(NNc1ccc(-n2cccn2)nn1)C(=O)Nc1cccc(I)c1	783435824	AITZKYBXCOFMTD-UHFFFAOYSA-N	449.212	1.349	50	20	IDGD	
C[C@H](NC(=O)C1CCCCC1)C(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	783703899	IQGXZVXLBARVDX-HNNXBMFYSA-N	439.557	1.707	50	20	IDGD	
CC(C)c1nc2cc(NC(=O)C(=O)NNC(=O)CNC(=O)c3cccs3)ccc2o1	784003676	LNZFGPQFTIJKIT-UHFFFAOYSA-N	429.458	1.529	50	20	IDGD	
CC(C)(C)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)CNC(=O)c2cccs2)cc1	784004292	DUARRUUDXYFAHU-UHFFFAOYSA-N	430.486	1.493	50	20	IDGD	
CCCCN(C)S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2ccc(Cl)nn2)cc1	784792447	GOMKUAXNMAZKFE-UHFFFAOYSA-N	440.913	1.632	50	20	IDGD	
Cc1ccc(S(C)(=O)=O)cc1NC(=O)C(=O)NNc1ccnc(Br)c1	784836941	CWFYYJYTBNIYNW-UHFFFAOYSA-N	427.280	1.638	50	20	IDGD	
O=C(NNc1ccnc(F)c1)C(=O)Nc1ccc2c(ccn2CCN2CCOCC2)c1	784847159	PDOJCNMGVAMXCV-UHFFFAOYSA-N	426.452	1.589	50	20	IDGD	
Cc1nc2[nH]n(C)c(=O)c2c(C)c1CCC(=O)NNC(=O)NCc1ccc(Cl)cc1	787426905	SDJTXXWDHFRGSD-UHFFFAOYSA-N	430.896	1.995	50	20	IDGD	
COc1cc(NNC(=O)C(=O)Nc2ccc(C)c(S(=O)(=O)N(C)C)c2)ccc1Cl	789798890	SRSMBTLUFAZLEH-UHFFFAOYSA-N	440.909	1.989	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)c(Br)n1	789811551	DPKALVIWKIDEBQ-ZFWWWQNUSA-N	447.289	1.811	50	20	IDGD	
CCNC(=O)N1CCc2ccc(NC(=O)C(=O)NNc3cccc(F)c3[N+](=O)[O-])cc21	791000234	KTNZZHCDRKQDRP-UHFFFAOYSA-N	430.396	1.908	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNc2ncccc2C)cc1S(=O)(=O)N1CCCCC1	792375726	MFVDSABESSMZLQ-UHFFFAOYSA-N	431.518	1.955	50	20	IDGD	
CCOC(=O)[C@@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNc2ncccc2C)cc1F	792377684	AVWPCSJHIOCFDE-GFCCVEGCSA-N	431.424	1.292	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(OC(C)C)nn2)cc1	793022402	XHENHVQCEMTMFT-CYBMUJFWSA-N	429.433	1.020	50	20	IDGD	
O=C(CNC(=O)OCc1ccccc1)NNC(=O)c1ccc(-n2cnnn2)cc1Cl	794069682	JWSAIRHWMOFSJT-UHFFFAOYSA-N	429.824	1.003	50	20	IDGD	
O=C(NNC(=O)c1ccc2cc(I)ccc2n1)C(=O)N1CCCC1	795061064	JUAXWVIXVGSABY-UHFFFAOYSA-N	438.225	1.223	50	20	IDGD	
O=C(CCCCN1CCOCC1)NNc1ccc(S(=O)(=O)Nc2nccs2)cc1	795155698	BNKMSXVITJWMCP-UHFFFAOYSA-N	439.563	1.890	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)C(=O)Nc2cccc(N3CCN(CC4CC4)CC3)c2)n1	797369957	BYOVOKGPHJMETL-UHFFFAOYSA-N	436.516	1.322	50	20	IDGD	
O=C(NCc1cc(Cl)ccc1N1CCOCC1)NNC(=O)C(=O)Nc1ccccn1	798489017	KTVAVGPZRDDTHK-UHFFFAOYSA-N	432.868	1.041	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)[C@@H](C)NS(=O)(=O)c2cccc(C#N)c2)c2ccccc2n1	799009443	YJXGAUYNJVSCER-CQSZACIVSA-N	437.481	1.543	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(O[C@@H]3CCN(C)C3=O)cc2C)c(C)o1	799256949	BVHYDWFORLPYEH-QGZVFWFLSA-N	428.445	1.214	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)C(=O)Nc2cncc(F)c2)c2ccccc2c1=O	799258838	NJHWSIDDRZWZSK-UHFFFAOYSA-N	440.435	1.521	50	20	IDGD	
COc1cc(OC)cc(C(=O)NNC(=O)N[C@H]2CCN(C(=O)Nc3ccccc3)C2)c1	801077865	OBBSLBQZCFUUPS-INIZCTEOSA-N	427.461	1.954	50	20	IDGD	
Cc1c(/C=C(/C#N)C(=O)NNC(=O)Nc2ccc(S(C)(=O)=O)cc2)cc(C#N)n1C	802063807	QFPOSZDJPNAUQG-ZSOIEALJSA-N	426.458	1.369	50	20	IDGD	
Cc1c(C(=O)NNc2nc(Br)cn3ccnc23)nnn1Cc1ccncc1	807016733	VFGYXHDTDKEJHF-UHFFFAOYSA-N	428.254	1.592	50	20	IDGD	
CN(C1CC1)S(=O)(=O)c1ccc(NC(=O)C(=O)NNc2nccnc2C2CCC2)cc1	807459668	BJCRWFFCWBVPIP-UHFFFAOYSA-N	444.517	1.609	50	20	IDGD	
O=C1CN(Cc2cccc(NC(=O)C(=O)NNC(=O)c3cccc4ccccc34)c2)CCN1	812979207	LAKROVZHYUPNOG-UHFFFAOYSA-N	445.479	1.171	50	20	IDGD	
CC(C)(C)OC(=O)N1CCOc2ccc(NC(=O)C(=O)NNC(=O)C3CCC3)cc2C1	812979659	CYSFTWHIDMPOJI-UHFFFAOYSA-N	432.477	1.702	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)/C=C\CN(C)CC(F)(F)F)c2ccccc2c1=O	814364676	KVTANDMOXHAXOX-TWGQIWQCSA-N	425.411	1.789	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)Nc1cccc(CS(C)(=O)=O)c1	814627460	ZCQQAYITZPTREC-UHFFFAOYSA-N	426.520	1.630	50	20	IDGD	
Cc1ccc2cccc(NC(=O)C(=O)NNc3ccccc3S(=O)(=O)N(C)C)c2n1	815751970	WUQRRPYDRXWKEP-UHFFFAOYSA-N	427.486	1.875	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCO1)C(=O)Nc1ccc2c(c1)N(C(=O)Cc1ccccc1)CC2	815778863	IOUHMZYATQOPSQ-LJQANCHMSA-N	436.468	1.083	50	20	IDGD	
COC(=O)c1ccc(Br)c(NNC(=O)c2ccnc3c(C(N)=O)cnn23)c1	816717663	MGCSDPNEXKVVOK-UHFFFAOYSA-N	433.222	1.134	50	20	IDGD	
CC(C)[C@H]1CC[C@@H](C)C[C@@H]1OCC(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1	839163472	VEAIKKZBWSHIIN-YAJHFMINSA-N	448.516	1.994	50	20	IDGD	
O=C(NN=Cc1c(N2CCOCC2)nc2ccccn2c1=O)c1cc(-c2ccccc2)[nH]n1	873930578	QRWXTBHMRJRJNR-UHFFFAOYSA-N	443.467	1.685	50	20	IDGD	
CCCCCC(=O)NNC(=O)C[C@@H]1c2cc(OC)c(OC)cc2CCN1S(C)(=O)=O	886212272	PDWULASODAXDCY-MRXNPFEDSA-N	441.550	1.680	50	20	IDGD	
COCCn1c(C)cc(/C=C(\C#N)C(=O)O[C@H](C)C(=O)N2CCC[C@H](C(N)=O)C2)c1C	913027174	JVAYMONHKFTAOU-SGNWVPJISA-N	430.505	1.314	50	20	IDGD	
COCCNS(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(-c3ccccc3)on2)c1	913055307	PJLWWCRYRFLYKG-UHFFFAOYSA-N	444.469	1.341	50	20	IDGD	
O=C(CNS(=O)(=O)c1c(F)cccc1F)NNC(=O)c1cc(-c2ccccc2)[nH]n1	913422615	ABBBRZGMKSLTOO-UHFFFAOYSA-N	435.412	1.094	50	20	IDGD	
Cc1cccc(NC(=S)NNC(=O)CNS(=O)(=O)c2c(F)cccc2F)c1C	913424946	AFJFSAJWPYASJR-UHFFFAOYSA-N	428.486	1.878	50	20	IDGD	
CCc1ccc(C(=O)NNC(=O)c2ccccc2O)cc1S(=O)(=O)N1CCOCC1	913654803	SGWVMHPDNUTUSK-UHFFFAOYSA-N	433.486	1.050	50	20	IDGD	
C[C@@H]1NC(C(=O)NNC(=O)CSc2ccc(Cl)cc2)=NN(c2ccccc2)C1=O	915188378	INBITNZCIYZUQD-LBPRGKRZSA-N	431.905	1.918	50	20	IDGD	
COc1ccc2[nH]cc(CC(=O)NNC(=O)CN(C)S(=O)(=O)c3ccc(C)cc3)c2c1	915286162	BWDMUAGCCVEVEI-UHFFFAOYSA-N	444.513	1.496	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)[C@H](Cc2ccc(F)cc2)n2nnnc2C)cc1C	915695573	SPQFMWCXCCFNFT-IBGZPJMESA-N	426.452	1.748	50	20	IDGD	
CC(=O)NCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccc(C)cc2C)c1	915894813	QBHYOPGFCOBBRI-UHFFFAOYSA-N	447.517	1.184	50	20	IDGD	
COc1cc(OC)c(OC)cc1CNC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1	915919292	PZBDQRORBSZEBJ-UHFFFAOYSA-N	437.474	1.260	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@H]2Cc3ccccc3O2)c1	916516138	JXPLSEXBIMGHHD-QGZVFWFLSA-N	446.529	1.665	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)NCCOc2ccc3c(c2)OCO3)cc1	916647246	WJQWKRNOYPSSTR-CQSZACIVSA-N	431.445	1.991	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)CCCS(=O)(=O)N1CCCC1	917390695	XPDNBRJGUSPFKQ-MRXNPFEDSA-N	433.530	1.960	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)c1	917737941	UAUQOUJAARWSQB-UHFFFAOYSA-N	433.851	1.275	50	20	IDGD	
O=C(NNC(=O)c1ccc2ccccc2c1)NNC(=O)c1csc(N2CCOCC2)n1	918013801	XGDGNLIWIUDLPR-UHFFFAOYSA-N	440.485	1.422	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)CN1CCCCC1	918104556	RFDHBSUOMNEIQB-HXUWFJFHSA-N	430.597	1.651	50	20	IDGD	
CS(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)COc2ccc(Br)cc2)c1	918143296	SRGVGGYVXLSYBZ-UHFFFAOYSA-N	445.266	1.832	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2ccc(C)cc2O)ccc1Br	918161970	QENWOBHIRKKEPC-UHFFFAOYSA-N	443.275	1.873	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)NCc2ccc(N3CCN(C)CC3)nc2)cc1	919900546	ATYUYUDGGHGLBG-UHFFFAOYSA-N	426.521	1.305	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NC[C@H](C)c2ccc(F)cc2)cc1	920053001	BFCZCSOOSCWBBI-HNNXBMFYSA-N	436.509	1.889	50	20	IDGD	
COc1cccc(CN(CC(=O)NNC(=O)Cc2nc(C)cs2)C[C@H]2CCCO2)c1	920760622	ZCJXRWSZLBNADJ-GOSISDBHSA-N	432.546	1.831	50	20	IDGD	
CC[C@H](N=c1nn[nH]n1-c1ccccc1)C(=O)NNC(=O)CSc1ccc(C)cc1	1251649287	IXYSGVIIGHTNQZ-KRWDZBQOSA-N	425.518	1.523	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1)c1ccc([S@](C)=O)cc1	1253663495	VFKYXVSRNZACRC-YASQENCXSA-N	438.531	1.924	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnn3cccnc23)C1	1778964794	OQWJASRZEBJVIO-DYESRHJHSA-N	445.596	1.708	50	20	IDGD	
Cc1cc(/C=C/C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)no1	1779125788	OVCUBXXMWSIAOW-PLFJJOTPSA-N	426.311	1.857	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)Cn2cncn2)C1	1779494972	HFOVNVDTNQJJIC-AXVVYFOYSA-N	425.961	1.836	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc(Cl)nn2)C1	1779632771	NDEAHEDQIFSYNY-WPKBUWHJSA-N	431.320	1.511	50	20	IDGD	
CCc1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](F)Br)C3)n(C)n1	1779765405	KQQKGRVLNKFMIC-IIDMSEBBSA-N	445.333	1.801	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccnc3c2OCO3)C1	1780024522	VZEGXZGPSQCQCY-IIBYNOLFSA-N	449.580	1.789	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(-n4ccnc4)ccn3)C2)C1	1780384648	QYUGDWOHNPQNDH-OAQYLSRUSA-N	431.924	1.976	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3c(OC)cccc3OC)C2)C1	1780540674	ADXUEVZQFXKHOR-XOBRGWDASA-N	426.897	1.401	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)C1(NC(=O)OC(C)(C)C)CC1)CCO2	1781225710	OOGHMKWBVOJGFF-KUHUBIRLSA-N	429.945	1.891	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)CSc3ncccn3)CCO2)C1	1783533500	YFZREYNJOCZZIX-MLGOLLRUSA-N	429.340	1.182	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3nnc(-c4ccccc4)o3)CCO2)C1	1783877213	HIKFGRWFXZYUSN-YWZLYKJASA-N	434.880	1.434	50	20	IDGD	
C[C@@H](S)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2	1783886546	RHTBGMAGRFCFQK-VBHSOAQHSA-N	435.974	1.267	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CC[C@H]3CCOC3)C[C@@H]21	1783975041	DTGZIZRXFYGENU-XAJHFOFHSA-N	431.371	1.814	50	20	IDGD	
O=C(/C=C/C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]2C1)c1cccs1	1784090587	IVCLEHJEQNLUJG-HGHKQEFQSA-N	426.922	1.066	50	20	IDGD	
Cc1cnn([C@H](C)C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCBr)[C@H]3C2)c1	1786407843	XMCOCGDTHXUQGJ-UGUYLWEFSA-N	427.343	1.517	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3nccc4[nH]ccc34)[C@H]2C1	1787337718	BNXLRQFACFDTBT-DSPQJCBJSA-N	435.322	1.940	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)c1cn2ccsc2n1	1788391409	JKFKDNQEWGMGAH-XRRVDJEJSA-N	445.314	1.680	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/C3CCCC3)C[C@@H]21	1788610195	ONWXWDFPGDEYCJ-JIGQMWBCSA-N	441.532	1.025	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(Cl)nc(OC)c3)[C@H]2C1	1789045000	UDTGMAMEAPJHSH-MHEUCROKSA-N	446.331	1.591	50	20	IDGD	
Cc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)C(Cl)Cl)C[C@@H]32)n(C(F)F)n1	1789334915	NOBKVOCTLAUIAH-NHCYSSNCSA-N	425.263	1.984	50	20	IDGD	
COCc1c[nH]c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]3C2)c1	1789870318	DVBXPQXANVIVEV-PWDMQXDWSA-N	432.348	1.991	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]2C1	1789925831	WEUSSOZZMKATKO-HHHUOAJASA-N	444.139	1.830	50	20	IDGD	
CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=N/N3CCCCC3)C[C@@H]21	1790960357	CNPIDGQMLRSHPA-HGRLGPAASA-N	443.386	1.611	50	20	IDGD	
C=C(Oc1ccccc1O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](Cl)COC)[C@H]2C1	1791254368	LIGMAHMPENQGFL-FPXQBCRKSA-N	438.908	1.518	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)n3cccn3)[C@H]2C1	1791640557	VQZNVMOMOOJIML-QRJUGERDSA-N	427.343	1.455	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](F)Cl)C3)[C@@H](O)C1	1792516647	JWFNZGAILSNMQH-KARBZBNUSA-N	447.935	1.777	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCOc1ccc(F)cc1	1792736717	GNFJJIGFDFRWQN-CSHUHZATSA-N	428.888	1.438	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccc(Cl)c(F)c1	1792757772	MDKAIXMKZKOTSY-HRJSJKBJSA-N	433.307	1.865	50	20	IDGD	
Cc1nccn1[C@@H](C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)CBr	1792873271	RLJFZXFPMNBSJP-AMSCCUFHSA-N	427.343	1.373	50	20	IDGD	
Cc1cc(CCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)ccn1	1794180697	OOOLFCBZGBVGBU-BCDXTJNWSA-N	436.516	1.273	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1nc(Cl)ccc1F	1794233650	UNCYJJKQTOMZMU-DRXBFXEBSA-N	429.952	1.929	50	20	IDGD	
C[C@@H](NNc1ccccc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCBr	1795113171	MISFVGRLVWBZRZ-ZXFNITATSA-N	439.354	1.366	50	20	IDGD	
CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(OC)cn1	1796730541	CFADVGKVQRDWAD-FAXLKDOZSA-N	426.311	1.467	50	20	IDGD	
CC(C)(C)OC(=O)N1CC(=O)C[C@H]1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](F)Cl	1796804907	RKSIHEGMNUPZND-CUZKYEQNSA-N	431.892	1.738	50	20	IDGD	
COc1ccc2nc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@@H](O)CCl)C4)ccc2c1	1796999992	PTASGUJWFJEPNP-FTUNRGFVSA-N	433.892	1.046	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=C2c3ccccc3C(=O)N2CC1)[C@H](O)CCl	1799136561	CMYVWNOWGKWRGG-KYZVSKTDSA-N	429.904	1.495	50	20	IDGD	
CCOc1ccccc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Br	1799349346	XELAEFAHOYIGGD-NOXHYTERSA-N	429.286	1.979	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(F)cc(F)c1F)C2)[C@@H](F)Br	1799352200	LHZIHPUYDOWHKZ-QYOFDKIESA-N	439.203	1.998	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2c(c1)C(=O)CC2	1799959493	LRMLQWJENPDSAL-UPHUGPLXSA-N	430.577	1.870	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(COC)c[nH]1)C2	1800642598	RGMQPSAQJCVATC-FQLMCAECSA-N	428.327	1.538	50	20	IDGD	
C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)COc1ccccc1F	1800647337	GVOIQLNIZRBZIQ-KOFHJDLBSA-N	429.286	1.578	50	20	IDGD	
C[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(Cl)Cl)N1CSCSC1	1801017154	SRGOYMYYCFQUEA-WISYIIOYSA-N	428.407	1.423	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(CO)c(F)c1	1801903080	JIVPMLQXBFVKTE-BWPSIRRCSA-N	429.286	1.305	50	20	IDGD	
COC[C@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](CCO)NC(=O)OC(C)(C)C)C2	1802271187	ZBLOZVCJRDBFKE-QRJUGERDSA-N	447.960	1.154	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc3nscc13)C2	1802337806	BEJBVVACJPAGCK-QDMKHBRRSA-N	429.546	1.921	50	20	IDGD	
O=C(CN1CCCC1)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@@H]1c1cccnc1	1802555650	LJKLNWCDGAYVEB-UAGQMJEPSA-N	427.318	1.874	50	20	IDGD	
CC[C@@H](NC(C)=O)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)Br)[C@H]1c1cccnc1	1802884894	UNELEOQSWABRPI-ZFVVBOAOSA-N	439.354	1.786	50	20	IDGD	
O=C(COc1ccc(O)cc1)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1	1802886498	NDBHZFFOBXOBGG-ZAAXVRCTSA-N	433.892	1.472	50	20	IDGD	
O=C([C@@H](F)Cl)N1CCC2(CCCN(C(=O)[C@H]3CCc4nc(O)nc(O)c4C3)C2)CC1	1807088337	HFVWTMQOWSATAQ-SWLSCSKDSA-N	440.903	1.758	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)nc1	1807369661	RKHQVXLTIGSPJB-UGKGYDQZSA-N	444.300	1.098	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CCc2ccco2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1	1807369852	XGKJAHVNTUIVCB-CVDCTZTESA-N	447.300	1.307	50	20	IDGD	
C[C@@H](C(=O)NC[C@@H]1CCN(C(=O)C(Cl)Cl)[C@@H]1c1cccnc1)N1CCN(C)CC1	1807902777	IWXWYFXLCULJOC-BHYGNILZSA-N	442.391	1.527	50	20	IDGD	
C[C@H](C(=O)N1CC[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]1c1cccnc1)n1ccnn1	1810543909	GQVFSWNFGJQIDO-HHXXYDBFSA-N	430.585	1.792	50	20	IDGD	
C[C@H](Nc1ccccn1)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1	1810569693	QQDJRQFSUVIKDN-PCODUJHASA-N	431.924	1.583	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)COc2ccc(O)nn2)[C@@H]1c1cccnc1	1812353320	VFBBEUNWGRQLTH-DOXZYTNZSA-N	433.896	1.679	50	20	IDGD	
CC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CN(C)NC(=O)NCc1ccccc1)CC2	1814217856	QHHQCWQZDPDCLP-HNNXBMFYSA-N	430.534	1.421	50	20	IDGD	
CC(C)(C)c1cc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@H](O)CCl)CC3)[nH]n1	1820554768	ZILKOAOKXSUDQT-BXKDBHETSA-N	425.942	1.989	50	20	IDGD	
CN1N=C(C(=O)N2CCCC[C@H]2c2cc(NC(=O)[C@@H](F)Br)n[nH]2)CCC1=O	1820932211	ZIFCNSKDNIVGAO-SMDDNHRTSA-N	443.277	1.701	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)CCl)CC2)c1cnc2snnc2c1	1821273281	LTGZEDHQCNZQQF-KCJUWKMLSA-N	438.922	1.368	50	20	IDGD	
CCNC(=S)NCC(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](F)Br)[nH]n1	1821644523	OMZRUSWGZPCDDP-ZWNOBZJWSA-N	449.350	1.576	50	20	IDGD	
COc1cc(OC)cc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@@H](O)CCl)CC3)c1	1822110432	IKOUJVRBRCACCA-NHYWBVRUSA-N	439.921	1.986	50	20	IDGD	
C[C@H](Br)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)C2=NN(C)C(=O)CC2)[nH]n1	1822185576	YXLKLHDFUSRKRL-GWCFXTLKSA-N	439.314	1.793	50	20	IDGD	
CCCNC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1	1822410289	CRPIWXDCXWBFTC-MRXNPFEDSA-N	449.556	1.081	50	20	IDGD	
CC(=O)c1cc(C(=O)N[C@H]2CCc3nc(NC(=O)[C@@H](F)Br)sc3C2)n[nH]1	1823001350	CXTLNYCPIZZOHS-JVXZTZIISA-N	444.286	1.985	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](C)Br)sc2C1	1825640467	AQBWGLBBYOPHIP-IVZWLZJFSA-N	446.371	1.546	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CN1CCN(C)CC1)CC2	1825642558	XCGXAQZZTZSEPV-RYUDHWBXSA-N	444.399	1.086	50	20	IDGD	
COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnncc1C(=O)O)CC2	1826002670	ACXSQRZXFGHHOP-KWQFWETISA-N	439.881	1.111	50	20	IDGD	
O=C(C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1)c1ccccc1	1826287878	CXDOGEKGOMJWMN-JOCHJYFZSA-N	448.328	1.483	50	20	IDGD	
CNc1ccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)cc1	1827055288	XBYPNDJJTPRAPH-HSZRJFAPSA-N	449.360	1.955	50	20	IDGD	
Cc1ocnc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827057493	GGIIIOSZYLKFKZ-LJQANCHMSA-N	425.294	1.210	50	20	IDGD	
CCC(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)[C@@H](O)CCl)C2)C1	1828824083	UENHFXHYPDPXLG-UWJYYQICSA-N	437.924	1.448	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@H](C)Cn2cncn2)CC1	1829056985	DUVSZJZPFXEDKG-BPQIPLTHSA-N	425.961	1.788	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CN2C(=O)CNC2=O)CC1	1830314210	UEPVYKZRWFOGKL-KUHUBIRLSA-N	447.363	1.394	50	20	IDGD	
Cc1noc(C)c1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)CBr)CCO2	1830537459	ITHYMJLEABZPPA-KZULUSFZSA-N	444.326	1.392	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3noc(C(C)C)n3)C2)C1	1831639566	CJDJIRCOLDVFNF-MGPUTAFESA-N	442.944	1.599	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCBr)C2)C1	1831644176	QGNRGTOFIKIFCN-XJKSGUPXSA-N	425.751	1.635	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)/C=C/c3ccoc3)CCO2)C1	1832652281	FANHTBKTYYFIRM-YKTDSXCKSA-N	441.322	1.923	50	20	IDGD	
C[C@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)C3CC(=O)C3)CC2)CC1	1833266263	XGIZJNYVFUFSRT-CYBMUJFWSA-N	428.371	1.568	50	20	IDGD	
Cc1nc(C)c(C(=O)NC2CCN(C3CCN(C(=O)[C@H](O)CCl)CC3)CC2)s1	1834156551	CIORAMQSMYRTKO-MRXNPFEDSA-N	428.986	1.545	50	20	IDGD	
Cc1nccnc1C(=O)N1CCC(N2CCC(NC(=O)CCBr)CC2)CC1	1834423439	WKDGVYGPMBLRAZ-UHFFFAOYSA-N	438.370	1.755	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)CC3CCCC3)CC2)CC1)c1ccc(B(O)O)cc1	1834798078	YUOZTUWMJNGBHP-UHFFFAOYSA-N	441.381	1.132	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC(OC2CCN(C(=O)[C@@H]3CNC(=O)O3)CC2)CC1	1836669739	GGJIWOYCAZPBFK-WFASDCNBSA-N	446.342	1.124	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1	1837714839	PRVGPLHZKLPKGF-IAGOWNOFSA-N	441.428	1.531	50	20	IDGD	
COc1cc(C#N)cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)c1	1838581849	SEJQPCHQFRCRSV-VQIMIIECSA-N	425.844	1.171	50	20	IDGD	
Cc1ccc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)cn1	1839150325	JJKIHHKTTQPFRD-UXHICEINSA-N	444.359	1.625	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccsc3)C2)C1	1839151891	HQQPDGPEATYPJA-ZWKOTPCHSA-N	435.373	1.983	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(C#N)c3)C2)C1	1839154701	UPOAAUWLNJLRBX-WOJBJXKFSA-N	440.327	1.865	50	20	IDGD	
Cc1cccc(C)c1NC(=O)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1839157602	YVBQOSBZMOEORT-OXJNMPFZSA-N	441.887	1.233	50	20	IDGD	
C=C(C(=O)N1CCO[C@]2(COCCN(C(=O)CCBr)C2)C1)C(F)(F)F	1839892648	ZCAJQXAQIUOMBC-AWEZNQCLSA-N	429.233	1.346	50	20	IDGD	
CCCCC[C@@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1	1839905812	XXJDALJXVPXVGW-XMSQKQJNSA-N	440.585	1.032	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3cccc(F)c3F)CCO2)C1	1839982806	BMWVYIGNEYHUBS-YWZLYKJASA-N	446.878	1.218	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4ccsc4[nH]3)C2)C1	1840154661	BWGYJIHTMCHAPZ-KUHUBIRLSA-N	441.937	1.553	50	20	IDGD	
CO[C@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1	1840211558	GTFWSWWFFFCVKW-GDYRARJKSA-N	449.454	1.363	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC2(CCCN2C(=O)c2cccc(=O)n2O)C1	1842212236	RHDGARWSMASCAF-OQLLNIDSSA-N	440.406	1.788	50	20	IDGD	
O=C([C@@H](O)CCl)N1CC2(CCCN2C(=O)c2ccc3[nH]nc(C(F)(F)F)c3c2)C1	1845710592	JJTZXPDLPSRYNR-ZDUSSCGKSA-N	430.814	1.998	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)[C@@H](C)n2cc(C)cn2)C1	1846588376	IJPFTSCVHSROBZ-DTVDJLOLSA-N	425.493	1.090	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H]1CCCCO1	1847310210	AXOIYHFULXBDQM-YHUYYLMFSA-N	429.945	1.889	50	20	IDGD	
O=C(c1cc2c[nH]nc2cc1Br)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl	1847566111	KENRWHOPGVQNPT-KKUMJFAQSA-N	441.713	1.741	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1nc2c(=O)[nH]c3ccccc3n2n1	1847871108	YQNLYHBYMIRSIG-RCBQFDQVSA-N	442.907	1.794	50	20	IDGD	
Cc1nc(COc2ccccc2C(=O)NNC(=O)c2csc(N3CCOCC3)n2)no1	23621229	ATJQLBVXBRUKLJ-UHFFFAOYSA-N	444.473	1.325	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)CS[C@H]1CCS(=O)(=O)C1	105008361	WMBRTMRLWVMVMD-ZDUSSCGKSA-N	425.557	1.800	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)NCc1ccc(C(=O)N2CCCCC2)cc1	725870220	DJEPHMGXINXZGM-UHFFFAOYSA-N	427.461	1.166	50	20	IDGD	
C[C@H](NC(=O)c1ccc(Cl)cc1)C(=O)NNC(=O)c1csc(N2CCOCC2)n1	726089697	QZMPZEYRIOAOJU-NSHDSACASA-N	437.909	1.213	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)COc1ccccc1C#N)c1cccc(S(=O)(=O)N(C)C)c1	727610493	RFNZIHRMEOAPHX-CQSZACIVSA-N	445.501	1.279	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)NC2CCCC2)cc1NC(=O)c1ccccn1	728507188	NUDKUPHSLLHHKF-UHFFFAOYSA-N	433.490	1.778	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)Cc2cccnc2)cc1S(=O)(=O)N1CCCCCC1	728852640	KNOGWGJYOMGVEK-UHFFFAOYSA-N	446.529	1.659	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)[C@H]2CC(=O)N(C[C@H]3CCCN3CC)C2)cc1	729625933	FDUIEIWZVIDVCH-FGTMMUONSA-N	446.548	1.333	50	20	IDGD	
CC(C)C[C@@H](C(=O)NNC(=O)COc1ccccc1O)N1C(=O)[C@H]2CC=CC[C@H]2C1=O	730778498	IYGLNETWKHDVHH-XHSDSOJGSA-N	429.473	1.284	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)c2sc(-c3c(C)c(C)nn(C)c3=O)nc2C)c1O	731224872	MNWHSHLIJNENMZ-UHFFFAOYSA-N	443.485	1.618	50	20	IDGD	
CC(C)[C@H](NS(=O)(=O)c1ccc(Br)cc1)C(=O)NNC(=O)C1CCC1	732141012	MYMPINUXFJZLFK-AWEZNQCLSA-N	432.340	1.700	50	20	IDGD	
CCc1c(C(=O)NNC(=O)CCN2C[C@H](C)O[C@H](C)C2)nnn1-c1cccc(Cl)c1	732258998	JTJSIUIZYLTQOF-OKILXGFUSA-N	434.928	1.743	50	20	IDGD	
O=C(CCC[S@](=O)c1ccc(Br)cc1)NNC(=O)C(=O)N1CCCC1	732279863	QVPLLXWDQJPQRM-VWLOTQADSA-N	430.324	1.107	50	20	IDGD	
Cc1c(C(=O)NNc2ccccc2S(C)(=O)=O)nnn1-c1cccc2c1CCN(C)C2	732304681	QLVXCPVRHQQTTC-UHFFFAOYSA-N	440.529	1.724	50	20	IDGD	
CS(=O)(=O)c1cc(C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc([N+](=O)[O-])c1	733107859	AALMWYNARDSRPC-UHFFFAOYSA-N	429.414	1.259	50	20	IDGD	
Cc1cccc(-n2c(NNC(=O)CCNS(C)(=O)=O)nc3ccccc3c2=O)c1C	733264430	NWOUSAUWZGICTP-UHFFFAOYSA-N	429.502	1.385	50	20	IDGD	
CN1CCN(S(=O)(=O)c2ccccc2CNC(=O)NNc2cccc(C#N)c2)CC1	735191952	WZZGLBIBZADBKP-UHFFFAOYSA-N	428.518	1.321	50	20	IDGD	
CCC(=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O)c1cc(Cl)ccc1OC	736430246	SIWOEZGKFDGQPR-UHFFFAOYSA-N	425.898	1.164	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)COC(=O)[C@@H]2CC(=O)N(CC(F)(F)F)C2)cc1C	736779215	YCMXDQSJCMOESY-SNVBAGLBSA-N	435.424	1.334	50	20	IDGD	
CSc1ccc(O[C@H](C)C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1	740813283	BGCJGSPDTTUHPE-SNVBAGLBSA-N	443.934	1.938	50	20	IDGD	
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)NCCc2cccc(C(=O)NC)c2)cc1	741091989	NNELSEHJBYKKDM-HNNXBMFYSA-N	428.489	1.785	50	20	IDGD	
O=C(C[C@@H](C(=O)NN=Cc1ccc(F)cc1)N1CCOCC1)NN=Cc1ccc(F)cc1	741767246	SVJWGBIQKBDDHL-FQEVSTJZSA-N	443.454	1.656	50	20	IDGD	
C[S@](=O)Cc1cccc(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)c1	744619443	OXBSIIDJGBEEMQ-NDEPHWFRSA-N	437.543	1.343	50	20	IDGD	
COCCOc1cccc(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)c1	744620194	GWHPRYIIJGUFPD-UHFFFAOYSA-N	435.502	1.490	50	20	IDGD	
COc1ccc(COCCC(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)cc1	744620685	MTXAHOZOOWHIGA-UHFFFAOYSA-N	449.529	1.766	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)NCc2ccc(C(=O)NNC(=O)N(C)C)cc2)cc1	746012749	JCQCJKSPPYEOCU-UHFFFAOYSA-N	433.490	1.040	50	20	IDGD	
C[C@H]1OC(C)(C)N(C(=O)OC(C)(C)C)[C@@H]1C(=O)NNC(=O)c1nnc(O)c2ccccc12	746096463	GLUCYVMTRXCPSU-ABAIWWIYSA-N	445.476	1.857	50	20	IDGD	
Cc1cc(CN2C(=O)c3ccccc3C2=O)cc(C(=O)NNC(=O)N2CCOCC2)c1O	746519677	MGJXPBQORINZGV-UHFFFAOYSA-N	438.440	1.183	50	20	IDGD	
O=C(NNC(=O)c1cccc(NS(=O)(=O)c2ccc3nnn(O)c3c2)c1)c1ccoc1	747216869	ATBVWZJTPYPFHP-UHFFFAOYSA-N	442.413	1.137	50	20	IDGD	
O=C(CN1C(=O)c2ccccc2S1(=O)=O)NNc1ccc(Br)cc1F	748188684	DQABXPVKRJRINR-UHFFFAOYSA-N	428.239	1.876	50	20	IDGD	
O=C(NNC(=O)[C@@H]1CCCCN1C(=O)/C=C\c1ccc(Cl)cc1)C(=O)N1CCCC1	748239181	FEWZJXXOYAEHJQ-NLZINVLXSA-N	432.908	1.504	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)c2cccc(CS(N)(=O)=O)c2)cc1OC	749403344	JHZXAIMARPWIKE-UHFFFAOYSA-N	435.502	1.737	50	20	IDGD	
COc1ccccc1N1CC[C@H](CNC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)C1	749932906	ZTXJORLBTFEAFA-OAHLLOKOSA-N	446.529	1.569	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@H](C)N2C(=O)[C@H]3CCCC[C@H]3C2=O)cc(OC)c1OC	750548052	NWGWKWZKRIPSEF-FPMFFAJLSA-N	433.461	1.037	50	20	IDGD	
N#C/C=C(/c1ccccc1)N1CCN(S(=O)(=O)c2ccc(S(N)(=O)=O)cc2)CC1	750792087	ZSDCMTIRJOLEDL-GRSHGNNSSA-N	432.527	1.205	50	20	IDGD	
Cc1nc2c(c(C)nn2C)c(C)c1CCC(=O)NNC(=O)CNC(=O)c1cccs1	751209293	OHRHEHYRXVPYLU-UHFFFAOYSA-N	428.518	1.465	50	20	IDGD	
Cc1nn(-c2ccccc2)c(C)c1C(=O)C(=O)NNC(=O)CNC(=O)c1cccs1	751209839	VHNRSKBBYIJEDB-UHFFFAOYSA-N	425.470	1.311	50	20	IDGD	
O=C(CC1CCCCC1)NC1CCC(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)CC1	751362817	RFXYHWWJVZDGTN-OFLPRAFFSA-N	442.582	1.149	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CCOc2cccc(C(N)=O)c2)cc1Br	751379462	QPNBSATWAKFWOW-UHFFFAOYSA-N	436.262	1.787	50	20	IDGD	
CS(=O)(=O)N1CC[C@@H](CNC(=O)NNC(=O)c2ccc(COc3ccccc3)o2)C1	752997997	JJEHFDHHYPPWGE-AWEZNQCLSA-N	436.490	1.084	50	20	IDGD	
Cc1cc(O)cc(=O)n1CCC(=O)NNC(=O)[C@H](C)Oc1cccc(Br)c1	754241411	OODWDBDQMPYPHC-LBPRGKRZSA-N	438.278	1.630	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)Nc1cccc(S(=O)(=O)N2CCOCC2)c1	755353449	HQXYGBPNZOXGOR-UHFFFAOYSA-N	448.501	1.077	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)Nc1c(F)cccc1F	755373724	CVZFFIFFPHUPPV-UHFFFAOYSA-N	440.428	1.452	50	20	IDGD	
Cc1cccc2ncc(C=NNC(=O)c3cccc(S(=O)(=O)N4CCOCC4)c3)n12	755467783	UZLPLBHVFJDELZ-UHFFFAOYSA-N	427.486	1.428	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)Nc1cccc(N2CCCS2(=O)=O)c1	755887298	BSNURWUJCKGKNN-ZDUSSCGKSA-N	436.465	1.986	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)Nc2ccc(CN3C(=O)CNC3=O)cc2)o1	755988939	ONXKKFPRROWSDI-UHFFFAOYSA-N	442.476	1.640	50	20	IDGD	
COCCO[C@@H](C)C(=O)NNC(=O)Nc1cc(Br)ccc1-n1cccn1	756488163	LGPFSIWGJMPWLM-NSHDSACASA-N	426.271	1.839	50	20	IDGD	
O=C(NNC(=O)c1cc(-c2cccs2)[nH]n1)Nc1ccn(CCN2CCOCC2)n1	756646909	QOJYYEZUMWZQIO-UHFFFAOYSA-N	430.494	1.133	50	20	IDGD	
CCOC(=O)[C@H](C)NC(=O)c1ccc(NC(=O)NNC(=O)c2ccccc2OC)cc1F	756818243	MZUZSDMXYREPIA-LBPRGKRZSA-N	446.435	1.982	50	20	IDGD	
COc1cccc(NC(=O)COc2ccc(C(=O)NNc3ccc(C(N)=O)nn3)cc2)c1	757397967	AFYYDIWKUAMQMR-UHFFFAOYSA-N	436.428	1.359	50	20	IDGD	
NC(=O)c1cccc(NC(=O)NNC(=O)COc2ccc(OCc3ccccc3)cc2)n1	757738776	VCPPHMHXOPGMFA-UHFFFAOYSA-N	435.440	1.991	50	20	IDGD	
COCc1nc2n(n1)C[C@H](NC(=O)NNC(=O)c1ccc(OCCC(C)C)cc1)CC2	757790947	XCPJCXWKDFQUQB-MRXNPFEDSA-N	430.509	1.808	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)CCc1nc2cc(Br)ccc2s1	758047529	YAAYDYULSLNOOH-MRVPVSSYSA-N	449.352	1.077	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)NC[C@@H]2CC(=O)N(Cc3ccccc3)C2)cc1OC	758655890	VJANCYDYCSWEJV-INIZCTEOSA-N	426.473	1.697	50	20	IDGD	
CN(NC(=O)c1ccc(-n2ccnn2)cc1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758782022	LBWMKPJDKLXWQP-UHFFFAOYSA-N	429.481	1.517	50	20	IDGD	
O=C(COc1ccccc1F)NNC(=O)NC[C@H]1CN(Cc2ccccc2)CCCO1	758856843	XKXPBRYREBZFFQ-SFHVURJKSA-N	430.480	1.826	50	20	IDGD	
CCOc1ccc(S(=O)(=O)N2CCC(C(=O)NNc3ncccc3[N+](=O)[O-])CC2)cc1	759303407	KNNFMFZXMARYLK-UHFFFAOYSA-N	449.489	1.933	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)C[C@H]1CSCCN1C(=O)OC(C)(C)C	760443307	WJCKVPACCZHJDU-ZDUSSCGKSA-N	446.570	1.791	50	20	IDGD	
O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	761789093	ZXKZRHWWKFKNMB-MRXNPFEDSA-N	427.417	1.436	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)CCc2nnc(-c3ccccc3)o2)n1	762393033	GBVPLMOQSHPVFI-UHFFFAOYSA-N	429.458	1.367	50	20	IDGD	
CCOc1ccc(N2C[C@@H](C(=O)NNc3nccc(N4CCOCC4)n3)CC2=O)cc1	762869359	XGCKLCIAUQBBDC-HNNXBMFYSA-N	426.477	1.208	50	20	IDGD	
CCNC(=O)c1ccc(C)c(NC(=O)C(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)c1	763601012	MOHFJNBKRQISLQ-UHFFFAOYSA-N	434.456	1.535	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccnn2Cc2ccccc2F)cc1C	763666082	ADPVKEBHQZZMBW-UHFFFAOYSA-N	439.447	1.852	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2cccc(-c3n[nH]c(C4CC4)n3)c2)cc1	763674873	QCYNLNXKLFJBHM-UHFFFAOYSA-N	445.439	1.386	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1nn(-c2ccccc2)cc1C	763684316	JJNXYJLBNYSRMQ-UHFFFAOYSA-N	437.456	1.744	50	20	IDGD	
Cc1nc(-c2cccc(NC(=O)C(=O)NNC(=O)CN3CCCc4ccccc43)c2)n[nH]1	763727872	GUSJMKRUDZDBTL-UHFFFAOYSA-N	433.472	1.319	50	20	IDGD	
NC(=O)CCOc1ccccc1NC(=O)C(=O)NNC(=O)C12CC3CC(CC(C3)C1)C2	763736723	YKSNCDQHOLTPRZ-UHFFFAOYSA-N	428.489	1.243	50	20	IDGD	
C[C@@H]1CN(c2ccc(NC(=O)C(=O)NNC(=O)c3cccc(Cl)c3)cn2)C[C@@H](C)O1	763748608	VTAZVMWHDCZNQO-CHWSQXEVSA-N	431.880	1.748	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)C(=O)NCC2	763853342	KGWZZQLITIFQKS-CQSZACIVSA-N	446.463	1.679	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)C(=O)Nc1ccccc1-n1cncn1	763855232	VEQSSCBJSOJUML-HNNXBMFYSA-N	444.451	1.974	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1nc(-c2nccn2C)cs1	763864068	FNYPEXYZBUWCQF-SNVBAGLBSA-N	432.437	1.236	50	20	IDGD	
CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2cncc(Br)c2)cc1	763877971	NEJSBHLDFNNKNX-NSHDSACASA-N	449.261	1.600	50	20	IDGD	
Cc1nc(COc2ccc(NC(=O)C(=O)NNC(=O)Cc3ccc(Cl)cc3)cc2)no1	763936397	JHUWBZCANQBXEL-UHFFFAOYSA-N	443.847	1.939	50	20	IDGD	
Cc1ccccc1-c1cc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCCO3)n(C)n1	764004510	YCKJAXMWTGATJV-UHFFFAOYSA-N	435.440	1.566	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(C(F)(F)F)c2)cc1S(N)(=O)=O	764041248	ZFZKXKRTKJIWID-UHFFFAOYSA-N	444.391	1.061	50	20	IDGD	
Cc1ccc(-c2cc(C(=O)NNC(=O)C(=O)Nc3ccc4c(c3)OCC(=O)N4)n[nH]2)cc1	764110879	MJSYBZRLWJXWCS-UHFFFAOYSA-N	434.412	1.116	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc3c(c2)NC(=O)[C@H](C)O3)o1	764139401	SPCDRGPCJCHHRS-LBPRGKRZSA-N	443.460	1.241	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)ccc1NC(=O)c1ccco1	764164491	QNMBLGWDYUESNE-IBGZPJMESA-N	448.435	1.930	50	20	IDGD	
COC(=O)c1ccccc1NC(=O)C(=O)NNC(=O)c1cc(Br)ccc1O	764276914	IKWDIINUTWOBCI-UHFFFAOYSA-N	436.218	1.341	50	20	IDGD	
CCN(CC)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)Cc2ccncc2)cc1Cl	764353281	HGDWWBBEKUTEJI-UHFFFAOYSA-N	431.880	1.546	50	20	IDGD	
Cc1cc(I)ccc1NC(=O)C(=O)NNC(=O)Cc1ccncc1	764356295	UCIJTAMAGJPWNB-UHFFFAOYSA-N	438.225	1.323	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(F)c(S(=O)(=O)NC(C)(C)C)c2)o1	764370542	DRHDXVDMSPBBDI-UHFFFAOYSA-N	440.453	1.204	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2ccc(-n3ccnn3)cc2)n[nH]1	764376713	FZLGYAJOEYIERU-UHFFFAOYSA-N	446.427	1.066	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2ccnn2CCC(C)C)n[nH]1	764378345	YNVQREYQKXCTKH-UHFFFAOYSA-N	439.476	1.728	50	20	IDGD	
CCOC(=O)c1c(F)cccc1NC(=O)C(=O)NNC(=O)CSc1ccccc1O	764403841	CPSVCYKXCSUUQI-UHFFFAOYSA-N	435.433	1.586	50	20	IDGD	
CCc1nnc(-c2ccc(NC(=O)C(=O)NNC(=O)CSc3ccccc3O)cc2)o1	764405984	ZTXGAKOMMBCYBI-UHFFFAOYSA-N	441.469	1.883	50	20	IDGD	
COc1ccc(C=NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cc1[N+](=O)[O-]	764830542	KAQWGASVFMYUSU-UHFFFAOYSA-N	425.445	1.512	50	20	IDGD	
Cc1ccc(CN2CCN(CC(=O)NNC(=O)c3cc(C)cc([N+](=O)[O-])c3)CC2)cc1	765749650	ZWAIBQCUGYDHAD-UHFFFAOYSA-N	425.489	1.790	50	20	IDGD	
COc1cc(C(=O)NNC(=O)c2cn(-c3ccc(F)cc3C)nn2)cc(OC)c1OC	767190247	VXSMWGDDZUPFKS-UHFFFAOYSA-N	429.408	1.815	50	20	IDGD	
CC(C[C@@H]1COCCN1C(=O)OC(C)(C)C)=NNC(=O)Cc1cc(O)nc(S)n1	767358662	DIYJHODUJSSCTQ-CYBMUJFWSA-N	425.511	1.532	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(C(=O)NCC(=O)NNc2nc3ccccc3[nH]2)cc1	768514735	JROCWMBGORIASU-UHFFFAOYSA-N	444.517	1.467	50	20	IDGD	
COc1ccccc1C(=O)N[C@@H](CCSC)C(=O)NNC(=S)Nc1ccccn1	768578340	OUTBVEOMMPQASQ-AWEZNQCLSA-N	433.559	1.960	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cn(C)nc2C(C)(C)C)c1	768939031	ZXHOMKHMQNPZRC-UHFFFAOYSA-N	435.550	1.823	50	20	IDGD	
CSCCNC(=S)NNC(=O)C[C@@H](NC(C)=O)c1ccc(Br)cc1	769769157	KFHRWPMEIYZYGM-CYBMUJFWSA-N	433.397	1.875	50	20	IDGD	
CSCCNC(=S)NNC(=O)c1cccc(S(=O)(=O)N2C[C@@H](C)C[C@H](C)C2)c1	769777975	KVXOLYDTTQPXGX-KBPBESRZSA-N	444.648	1.825	50	20	IDGD	
C[C@]1(c2ccc(F)c(Cl)c2)NC(=O)N(CC(=O)NNC(=O)Cc2ccncc2)C1=O	769972961	RVWLHPOOJJDHBB-LJQANCHMSA-N	433.827	1.031	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)NNc1ccccc1S(C)(=O)=O	770656776	MMRYOPNYNDHRLI-NSHDSACASA-N	426.882	1.868	50	20	IDGD	
Cc1ccncc1[C@@H](C)NC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	771441082	PAUZKIPXGHIRJP-OAHLLOKOSA-N	431.518	1.880	50	20	IDGD	
Cc1cc(S(=O)(=O)NNC(=O)C(=O)NCc2ccc(Cl)cc2)cc(C(=O)O)c1F	771606608	IENHUQUKMQLZCG-UHFFFAOYSA-N	443.840	1.112	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)c1cccc(CS(=O)(=O)NC(C)(C)C)c1	772062729	CLIZULPEBOFLST-CQSZACIVSA-N	441.550	1.643	50	20	IDGD	
CC(C)[C@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772888370	IDPGDZULFAZBGR-AWEZNQCLSA-N	426.901	1.653	50	20	IDGD	
O=C(CN[C@H](c1ccccc1)C(F)(F)F)NNC(=O)C(=O)NCc1ccc(Cl)cc1	772897407	HJIHGACTPAGYCE-MRXNPFEDSA-N	442.825	1.997	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)[C@@H]1CCCCN1C(=O)c1ccc(O)nn1	772962378	ADYZJLFBQSGATB-LRDDRELGSA-N	447.879	1.445	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)ncc1Br	773528736	PXPCFSJXRCXGTR-SNVBAGLBSA-N	439.241	1.845	50	20	IDGD	
O=C(NNc1ccccc1[N+](=O)[O-])C(=O)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1	773655413	NVFHGHQTGYGWDU-UHFFFAOYSA-N	447.473	1.851	50	20	IDGD	
COc1ccccc1[C@](N)(C(=O)NNC(=O)c1cc(Br)c[nH]1)C(F)(F)F	776101073	URUAVJMPAUTZSE-AWEZNQCLSA-N	435.200	1.963	50	20	IDGD	
O=C(NNC(=O)N1CC[C@H](C(=O)NCC(F)(F)F)C1)c1cc(Br)c[nH]1	777412399	SEKYSFBUOIAVFV-ZETCQYMHSA-N	426.193	1.132	50	20	IDGD	
O=C(NNC(=O)N1CC[C@H](C(=O)NCC(F)(F)F)C1)c1cccc(Br)c1	777567955	VIXUJGCPQWHMEW-JTQLQIEISA-N	437.216	1.804	50	20	IDGD	
COC(=O)c1cc(C(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)on1	777791887	LWELOMCPWDBRQB-UHFFFAOYSA-N	447.411	1.238	50	20	IDGD	
O=C(COC(=O)COc1ccc2c(c1)CCC2)NNC(=O)[C@H]1COc2ccccc2O1	778246804	LJKKYGZWPXPDEM-LJQANCHMSA-N	426.425	1.085	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)[C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])o2)nc1C	778425347	RAIAJWHOBJTESM-GFCCVEGCSA-N	432.393	1.211	50	20	IDGD	
C[C@@H](NC(=O)CC(C)(C)C)C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	779012726	UYHZJAJQJHUMKM-OAHLLOKOSA-N	439.582	1.007	50	20	IDGD	
O=C(NNC(=O)c1ccccc1NC(=O)OCc1ccccc1)N[C@H]1CCS(=O)(=O)C1	781948786	FKUYAKFUVPDCDO-HNNXBMFYSA-N	446.485	1.566	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)COC(=O)c2cnc(NC(=O)OC(C)(C)C)cn2)c1	783243159	QFWSESKCLHWYDA-UHFFFAOYSA-N	429.433	1.750	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2cnc3ccccc3c2)nc1	783265685	WKGQFWSILFKSPZ-UHFFFAOYSA-N	428.474	1.398	50	20	IDGD	
COCC(=O)N1CCc2cc(NC(=O)C(=O)NNc3ccc(Cl)cc3[N+](=O)[O-])ccc21	783290733	DRKVCICQXANRKD-UHFFFAOYSA-N	447.835	1.866	50	20	IDGD	
C[C@]1(NNC(=O)C(=O)Nc2ncc(Cc3ccccc3Cl)s2)CCS(=O)(=O)C1	783428715	WSLNDWNWYNFNKE-KRWDZBQOSA-N	442.950	1.524	50	20	IDGD	
O=C(NNC(=O)C(=O)N1CCCC1)C(=O)Nc1ccc(C23CC4CC(CC(C4)C2)C3)cc1	783999861	LTGYALCIZRDGEO-UHFFFAOYSA-N	438.528	1.863	50	20	IDGD	
O=C(NNC(=O)C(=O)N1CCCC1)C(=O)Nc1ccc(-c2nc3ccccc3s2)cc1	784002443	GBQSKLCIVMYHFL-UHFFFAOYSA-N	437.481	1.672	50	20	IDGD	
O=C(NNC(=O)C(=O)N1CCCC1)C(=O)Nc1ccccc1OCc1cccc(Cl)c1	784002996	OESJQXWNFNVELR-UHFFFAOYSA-N	444.875	1.627	50	20	IDGD	
CCOc1ccccc1OCC(=O)NNC(=O)[C@H]1CC=CC[C@@H]1C(=O)N1CCOCC1	784290377	NKCSFKQPLJTPPA-IRXDYDNUSA-N	431.489	1.053	50	20	IDGD	
CNC(=O)Cc1ccc(NC(=O)C(=O)NNc2nc(-c3ccc(Cl)cc3)no2)cc1	784794389	DMHOQLFQWSFAEL-UHFFFAOYSA-N	428.836	1.760	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)ccc1C(N)=O	784836132	RFZSSJLMPZCWGQ-UHFFFAOYSA-N	426.401	1.172	50	20	IDGD	
CCOC(=O)Nc1ccc(NC(=O)C(=O)NNc2cccc(S(C)(=O)=O)c2)cc1C#N	784845153	YLTCVJUQGGIKPM-UHFFFAOYSA-N	445.457	1.612	50	20	IDGD	
O=C(NNc1ncc(F)cn1)C(=O)Nc1ccc(C(=O)NCc2ccccc2F)cc1	784949468	LFWOZUAFPFHLQO-UHFFFAOYSA-N	426.383	1.767	50	20	IDGD	
COC(=O)c1cc(Cl)ccc1NC(=O)C(=O)NNC(=O)Cc1cn2ccccc2n1	785060302	HQIOXPDEMCBAGL-UHFFFAOYSA-N	429.820	1.103	50	20	IDGD	
Cn1ccnc(NNC(=O)C(=O)Nc2cc(Cl)ccc2OC[C@H]2CCCCO2)c1=O	785089828	GUCXSNTXLFLNDW-CYBMUJFWSA-N	435.868	1.463	50	20	IDGD	
COc1cc(F)c(NC(=O)C(=O)NNc2c(OC)cccc2S(C)(=O)=O)cc1F	785330091	DTFVYQIYFHAQGX-UHFFFAOYSA-N	429.401	1.467	50	20	IDGD	
Cc1ccc(N2CCNC2=O)cc1NC(=O)C(=O)NNC(=O)c1cc2c(s1)CCC2	787541852	XJDJMKSYNIYCDB-UHFFFAOYSA-N	427.486	1.475	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)C(=O)Nc2ccc(C(N)=O)c(OC(C)C)c2)cc1	789740435	GTTGIAPCORITKF-UHFFFAOYSA-N	444.513	1.759	50	20	IDGD	
Cc1ccc(CN2CC[C@H](NC(=O)NNC(=O)C(=O)Nc3ccc(C)c(C)c3)C2=O)cc1	790695310	NAOXBYBHCWUVSF-IBGZPJMESA-N	437.500	1.682	50	20	IDGD	
COC(=O)c1cc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)cc(Cl)c1F	792264518	QEIQVTCSDPBMKY-UHFFFAOYSA-N	437.767	1.394	50	20	IDGD	
COc1cc(C(F)(F)F)ncc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccccc2)[nH]n1	792268128	MKEXGDQVRSCKBU-UHFFFAOYSA-N	448.361	1.899	50	20	IDGD	
C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)C(=O)Nc1cc(-c2ccccc2)ccc1Cl	792355322	FWZFDMJYZIWSLE-LLVKDONJSA-N	438.893	1.031	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@H]2CCc3cc(C)ccc3O2)cc1	792804145	LFWKLLUCQTUOMB-LJQANCHMSA-N	431.514	1.465	50	20	IDGD	
CC(C)(C)OC(=O)N1C[C@H]2C[C@@]2(C=NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)C1	792928573	QNVZDQNVSRBTJF-KZULUSFZSA-N	442.925	1.960	50	20	IDGD	
CC(C)(C)OC(=O)NC(C)(C)c1cc(C=NNC(=O)N[C@@H]2CCS(=O)(=O)C2)on1	792985706	KYFNCXUVVFOQLM-LLVKDONJSA-N	429.499	1.255	50	20	IDGD	
O=C(NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1)C(=O)Nc1cccc(F)n1	793027175	YZIXYSJXPFHGJU-LJQANCHMSA-N	447.470	1.934	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)nc1Br	793047040	RDCZQFVYRIBMFN-UHFFFAOYSA-N	438.194	1.166	50	20	IDGD	
O=C(NNc1ccc2c(=O)[nH]ccc2c1)C(=O)Nc1ncn(Cc2ccc(Cl)cc2)n1	793069571	NWNBLDNVOSOLMH-UHFFFAOYSA-N	437.847	1.903	50	20	IDGD	
Cc1cc(F)c(C(=O)O)cc1S(=O)(=O)NNC(=O)CNC(=O)OCc1ccccc1	793433924	WSGLXGOWPKPTRB-UHFFFAOYSA-N	439.421	1.068	50	20	IDGD	
CCC(CC)NC(=O)C(=O)NNS(=O)(=O)c1cc(Cl)ccc1Br	797430360	CFOLLQYHESRHQY-UHFFFAOYSA-N	426.720	1.717	50	20	IDGD	
Cc1cc(O[C@H]2CCN(C)C2=O)ccc1NC(=O)NNC(=O)COc1ccccc1C#N	799238715	KXBZYBGZFDECFM-IBGZPJMESA-N	437.456	1.708	50	20	IDGD	
CCn1ncc(NC(=O)C(=O)NNc2c(OC)cccc2S(C)(=O)=O)c1C(F)(F)F	799263046	OTPBLALUQOAVLA-UHFFFAOYSA-N	449.411	1.416	50	20	IDGD	
COC(=O)Cn1ncc(NS(=O)(=O)c2ccc(OCCBr)cc2)c1C	799544070	BUKVQSCXLDSIAE-UHFFFAOYSA-N	432.296	1.939	50	20	IDGD	
CCc1cccc(C)c1NNC(=O)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)COC)cc1	799844010	HXUAWAUOPMSGTN-HNNXBMFYSA-N	448.545	1.952	50	20	IDGD	
CCOC(=O)Oc1ccc(C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1	800315729	CRYDNKSXGGTNNB-UHFFFAOYSA-N	449.485	1.612	50	20	IDGD	
COc1cccc(NCC(=O)NNC(=O)c2nnn(CCOc3ccc(F)cc3)c2C)c1	800688365	VXNNHRYMUUICLH-UHFFFAOYSA-N	442.451	1.686	50	20	IDGD	
Cc1cn(-c2ccc(F)cc2)nc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1	801103320	DIHWYSKOUDQMJP-UHFFFAOYSA-N	445.476	1.645	50	20	IDGD	
COc1cc(C(=O)NNC(=O)Nc2cc(F)cc(F)c2)cc(NS(C)(=O)=O)c1OC	802006534	LANKSEXBVLBBQJ-UHFFFAOYSA-N	444.416	1.820	50	20	IDGD	
CN(c1ccccc1)S(=O)(=O)c1ccccc1C(=O)NNC(=O)N=c1cc[nH]cc1	802030720	PLWLDAVCSWBTKL-UHFFFAOYSA-N	425.470	1.795	50	20	IDGD	
O=C(NNC(=O)c1cncc(I)c1)Nc1ccc2c(c1)OCO2	802101703	SJDQGDXFKUHQOY-UHFFFAOYSA-N	426.170	1.881	50	20	IDGD	
COc1ccc(C2=NO[C@H](CNC(=O)NNC(=O)Cc3cn4ccccc4n3)C2)cc1F	802346749	RHTHTYQRCUAZOX-HNNXBMFYSA-N	440.435	1.548	50	20	IDGD	
O=C(NCc1ccc(N2CCCS2(=O)=O)cc1)NNc1ccc(-n2ccnc2)nn1	805287851	YOXNXWLNUIMQQT-UHFFFAOYSA-N	428.478	1.029	50	20	IDGD	
CC(C)(O)c1cccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)c1	807006838	VREXDZIOURWRGJ-UHFFFAOYSA-N	432.502	1.437	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNc2ccc(-n3ccnc3)nn2)sc(C)c1CC	807428949	MDXKVUMHHCFOMU-UHFFFAOYSA-N	443.489	1.853	50	20	IDGD	
Cc1cc([N+](=O)[O-])ccc1NNC(=O)C(=O)Nc1cccc(OCCS(C)(=O)=O)c1	807456216	BIAIXUZMCBPISK-UHFFFAOYSA-N	436.446	1.408	50	20	IDGD	
COC(=O)Nc1cccc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1	807493186	YOXXJVPVTXAMRY-UHFFFAOYSA-N	449.489	1.259	50	20	IDGD	
COc1cc(C(=O)NN=Cc2ccc(S(N)(=O)=O)c(Cl)c2)cc(OC)c1OC	807945945	WERMATIXHGBPJW-UHFFFAOYSA-N	427.866	1.777	50	20	IDGD	
CCCS(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)c2ccc(OC)c(OC)c2)cc1	808068790	IOHBGMZXJWOBCD-UHFFFAOYSA-N	442.515	1.511	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN(C)CCn2cc(Br)cn2)cc1C	808802402	NCFLBNMPGVYILO-UHFFFAOYSA-N	428.356	1.971	50	20	IDGD	
CON=CC(=O)NNC(=O)c1ccc(Cl)c(S(=O)(=O)Nc2ccccc2OC)c1	809556379	GCPNAJPSQYKPBL-UHFFFAOYSA-N	440.865	1.543	50	20	IDGD	
COc1ccc([C@H](O)C2CCN(CC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)CC2)cc1	812855196	HXCFCWQHOPLPMJ-NRFANRHFSA-N	442.472	1.810	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)Nc2ccc(C[C@@H]3CC(=O)NC3=O)cc2)cc1	812947173	KDHWYEONHGDRNK-CQSZACIVSA-N	445.501	1.291	50	20	IDGD	
COc1cc(CNC(=O)NNC(=O)Cc2nc3ccccc3n2C)cc(OC)c1OC	813532846	ANZXTGQTPQEQGC-UHFFFAOYSA-N	427.461	1.672	50	20	IDGD	
CC(C)(C(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1)c1csc(-c2c(F)cccc2F)n1	814101593	CZASDUAFUGGVSM-JTQLQIEISA-N	443.497	1.948	50	20	IDGD	
CS(=O)(=O)CC1CCN(C(=O)NNC(=O)c2ccc(COc3ccccc3)o2)CC1	814271172	GKOZBZWBVJTWMQ-UHFFFAOYSA-N	435.502	1.970	50	20	IDGD	
CCC(CC)NC(=O)[C@@H]1CN(C(=O)C(=O)NNc2ncncc2F)c2ccccc2O1	815765166	IADXCUHGTFCEMV-INIZCTEOSA-N	430.440	1.158	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCO1)C(=O)Nc1ccnc(Oc2ccccc2Br)c1	815778926	KGSHQWABJAJNIP-CQSZACIVSA-N	449.261	1.901	50	20	IDGD	
O=C(NNc1cccc(Cl)n1)[C@@H]1CCCN1S(=O)(=O)c1cccc([N+](=O)[O-])c1	817004917	WBSUBLWPSMNLQY-ZDUSSCGKSA-N	425.854	1.940	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)c1cnn(CC(=O)NC2CCCCC2)c1	817053286	LABFUCYYVVDWDI-UHFFFAOYSA-N	448.549	1.339	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C[C@@](O)(c2nccn2C)C(F)(F)F)ccc1OC(C)C	818653477	YTYPBGBKNIGHEW-GOSISDBHSA-N	444.410	1.817	50	20	IDGD	
CCn1c(NNC(=O)CNS(=O)(=O)c2ccc(C(C)=O)cc2)nc2ccccc2c1=O	823892894	NHNAHMIXFHDQAS-UHFFFAOYSA-N	443.485	1.041	50	20	IDGD	
Cc1ccc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1-n1cccc1	839237453	IYERWNDIZNMPIT-HXUWFJFHSA-N	435.436	1.930	50	20	IDGD	
Cc1ccc(-c2n[nH]cc2C=NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)o1	839384189	UOVUYZQEVIOSKU-UHFFFAOYSA-N	443.485	1.763	50	20	IDGD	
CC(=O)c1cccc(S(=O)(=O)NCC(=O)NNC(=O)c2ccc3ccccc3n2)c1	912766841	XUSHAUWRYBKQMD-UHFFFAOYSA-N	426.454	1.177	50	20	IDGD	
Cn1nc(SCC(=O)NN=C2CCOc3c(Cl)cc(Cl)cc32)c(=O)n(C)c1=O	912808634	IABOEJGGTAMQHQ-UHFFFAOYSA-N	444.300	1.181	50	20	IDGD	
CC(C)CNS(=O)(=O)c1ccc(C(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1	914747984	ZESSDXUEKDPUPI-GOSISDBHSA-N	433.486	1.222	50	20	IDGD	
O=C(COC(=O)CCc1nc(-c2ccccn2)no1)NNC(=O)c1cccc(Cl)c1	915395485	AXYCCJYBXPIWKN-UHFFFAOYSA-N	429.820	1.722	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)N[C@@H](CN2CCOCC2)c2ccc(C)cc2)cc1	916215450	GRDQQQSHACGOGK-NRFANRHFSA-N	442.516	1.786	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N[C@H](C(N)=O)c1ccccc1	916233424	XHTNFNJFSLCEHQ-ABAIWWIYSA-N	435.278	1.773	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)Cn2ccc(C(F)(F)F)n2)CC1	916519809	LHWYGMCKSLLZFD-UHFFFAOYSA-N	434.419	1.632	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)cc1	916562393	PRDIIQHFKFEGEB-UHFFFAOYSA-N	446.529	1.734	50	20	IDGD	
COc1cc(C)c(S(=O)(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1C	917725933	XCTXXGRXFVPEGY-UHFFFAOYSA-N	447.922	1.236	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)cc(C)c1OCc1cccnc1	919887296	ZLCGLYDCEKDZMZ-QGZVFWFLSA-N	432.502	1.409	50	20	IDGD	
CCN1CCN(C(=O)/C(C#N)=C\c2cn(CCC(N)=O)nc2-c2ccc(OC)cc2)CC1	920848798	XFZANRUGHATSGD-JXAWBTAJSA-N	436.516	1.505	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)Nc2cccc(CN3CCC[C@@H]3C(N)=O)c2)c1	920932950	WYYJRKRBFWVFCY-LJQANCHMSA-N	425.489	1.676	50	20	IDGD	
COc1nccnc1NNC(=O)Nc1ccc2c(ccn2CC(=O)N2CCOCC2)c1	1116600413	FZAMOQMCZKZKHL-UHFFFAOYSA-N	425.449	1.447	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)C23C[C@H]4C[C@@H](CC(O)(C4)C2)C3)c1	1317745670	HFPBSHACOAFTSX-KILAXVPQSA-N	449.573	1.809	50	20	IDGD	
CS(=O)(=O)c1cc(S(=O)(=O)NNC(=O)c2cncn2-c2ccccc2)ccc1F	1318008285	CMYKFYKVMMWQSG-UHFFFAOYSA-N	438.462	1.038	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)N[C@@H]1CCCN(C(=O)c2ccccc2)C1	1318155546	KBISVARBYPLZBR-OAHLLOKOSA-N	429.502	1.113	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)NC2CCN(C(=O)C3CC3)CC2)c2ccccc2c1=O	1319026150	RZUBEKTZFGPMKY-UHFFFAOYSA-N	440.504	1.322	50	20	IDGD	
O=C(NNC(=O)C12C[C@H]3C[C@@H](CC(O)(C3)C1)C2)c1cccc(S(=O)(=O)N2CCCC2)c1	1321875613	IHFVCGWBXBDEMM-KILAXVPQSA-N	447.557	1.563	50	20	IDGD	
O=C(Cc1nc(-c2ccccc2)cs1)NNC(=O)Cn1nc2n(c1=O)CCCCC2	1322437388	PYJMSHKCXLZZSP-UHFFFAOYSA-N	426.502	1.285	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNS(=O)(=O)c1c[nH]c(C(F)(F)F)c1	1324864883	SPVZRGXMERMLMF-UHFFFAOYSA-N	439.441	1.258	50	20	IDGD	
CCC(=O)NCc1cc(S(=O)(=O)NNC(=O)c2ccccc2Cl)ccc1OC	1335396198	UIANKLQGTGBFLM-UHFFFAOYSA-N	425.894	1.998	50	20	IDGD	
C/C=C(\C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C1	1778092565	IQDPFMHJZPBRSP-JAZDDDIHSA-N	429.521	1.601	50	20	IDGD	
O=C(c1cc2cccnc2[nH]1)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1778590426	ABUCQPQKHFFWSO-SUMWQHHRSA-N	425.258	1.697	50	20	IDGD	
O=C(c1n[nH]c2ccc(F)cc12)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1778624289	JPEMLYBDYLGQJT-WMLDXEAASA-N	443.248	1.836	50	20	IDGD	
O=C(c1ccc2cncn2c1)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1778692354	KZRGUJDZQCPENA-YOEHRIQHSA-N	425.258	1.468	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)Cc2cc(C)[nH]n2)C1	1779464794	OPDAMINZFKMCEL-GPMSIDNRSA-N	441.370	1.948	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(C)nn2C(F)F)C1	1780164531	JFENZLJPYUOWGW-ZXYWRSMDSA-N	448.898	1.968	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc(C#N)cc2)C1	1780412922	KMQDXODDKNYLAW-AUSIDOKSSA-N	441.532	1.059	50	20	IDGD	
O=C(c1ccc2cccnc2n1)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781330538	YWDFPYZVCYOIGV-KBXCAEBGSA-N	437.269	1.764	50	20	IDGD	
O=C(c1cccn2cncc12)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781331159	DTPPENMMPCDIOR-YOEHRIQHSA-N	425.258	1.468	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C1(C(=O)OC)CC1)C2	1781904957	HMFVVSXLCIGPBS-PMUMKWKESA-N	445.354	1.627	50	20	IDGD	
C[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](N)c1ccccn1)C2	1781997769	GBXLEKMKLRVPLX-NVQRDWNXSA-N	439.354	1.379	50	20	IDGD	
Cc1cc(F)c(F)c(C(=O)N2CC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c1	1782073093	QKWBEQSMRIPOPC-OAQYLSRUSA-N	438.475	1.090	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cncc(N(C)C)c1)C2	1782170931	HIVZFRDUSXIKPG-DBXWQHBBSA-N	438.956	1.529	50	20	IDGD	
O=C(Cn1cnc2ccccc21)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1783750787	LZBJBYYHGHOHTF-AEFFLSMTSA-N	439.285	1.557	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)/C=C/C(=O)c3cccs3)CCO2)C1	1783874719	GUXOVLRUUQLUKA-SHYBKKQSSA-N	426.922	1.571	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](C)N1CSCSC1)CCO2	1783877559	KMXSLOPIPPIHNO-ZQIUZPCESA-N	438.015	1.113	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](CC(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](F)Cl)CCO3)C1	1784149230	NXATUEUOHJUAEU-AKCHCHLHSA-N	447.935	1.998	50	20	IDGD	
CC1CCN(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)Br)C[C@@H]32)CC1	1784320798	OEUHONQSNFUVHY-QZWWFDLISA-N	430.387	1.481	50	20	IDGD	
O=C([C@H](F)Br)N1CCO[C@]2(CCN(C(=O)[C@@H]3CCc4nc[nH]c4C3)C2)C1	1784351708	NARYTIJZIJHXBG-WHCBVINPSA-N	429.290	1.035	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3c(F)ccc(F)c3F)[C@H]2C1	1784834237	UVQJCDVTRKWDGV-MJFSBKNWSA-N	448.869	1.880	50	20	IDGD	
CN(C)c1cccc(OCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)C(Cl)Cl)C[C@@H]32)c1	1785060538	MPORYYPGYCGYOR-JQFCIGGWSA-N	444.359	1.915	50	20	IDGD	
Cc1cc(C(N)=O)cc(C)c1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]2C1	1787446654	VELAFUVOECAPQW-NZUILWFCSA-N	425.888	1.530	50	20	IDGD	
CC(C)(C)OC(=O)NC1(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]3C2)CC1	1787451346	JZWXYNUZOLYUBD-XDQVBPFNSA-N	433.908	1.558	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cn(C)nc3C(F)F)[C@H]2C1	1787736110	PUEQBZMYFZLJJW-BLFANLJRSA-N	449.296	1.734	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCN3CCCCC3)C[C@@H]21)[C@@H](F)Br	1789922175	FSJIGQLNKPXSJN-QBYUYEEZSA-N	434.350	1.533	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@](C)(O)C(F)(F)F)C[C@@H]21	1790958512	RVXAULRIZGIKMR-VSBZFQJLSA-N	445.276	1.453	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1ccc(C2(NC(=O)[C@@H]3CCCS3(=O)=O)CCC2)cc1	1791571010	IPVXRHQJNWMGOK-CVEARBPZSA-N	428.938	1.952	50	20	IDGD	
COc1cc(Cl)cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](O)CCl)C[C@@H]32)c1	1792026427	DCYCXULDHATHIM-SPOWBLRKSA-N	431.316	1.542	50	20	IDGD	
C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccnc1Cl	1792359503	UTJKMHCWMNUOHJ-FMSGJZPZSA-N	430.730	1.969	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnccc1Cl)C2	1792871193	QPQSMHIWLMVZHP-MCYUEQNJSA-N	430.730	1.969	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnc(-c2ccccn2)nc1	1794261195	LJPZHNJEWIJHMR-KYHPRHEASA-N	429.908	1.759	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cncn1-c1ccncc1	1794462948	BDYLBDBJZHBREW-LORHWOILSA-N	431.924	1.878	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](Br)Cc1ccccc1)C2)c1ccon1	1794928835	ZNPYWHHHLRUVRT-KYHPRHEASA-N	448.317	1.884	50	20	IDGD	
Cc1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)c(Cl)c1	1796192795	SEBRMLYZLUXLMU-BCDXTJNWSA-N	426.709	1.894	50	20	IDGD	
Cn1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CO[Si](C)(C)C)C3)c(C(F)F)n1	1796703073	ZMKZKJMVYOWQMR-JJLQDPRZSA-N	430.528	1.412	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CCN(C(=O)OC(C)(C)C)C1	1797220336	MCVDGKMMHOVKLX-UHDSXZAQSA-N	443.972	1.850	50	20	IDGD	
C[C@@H](Nc1ccccc1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnccc1C(=O)NN)C2	1798356723	SIWQJVGBXPINFB-NRSFXHEJSA-N	436.516	1.438	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3cccn3cn1)C2	1799277552	XQRYIWRWEQMWHL-AODNKKSCSA-N	425.316	1.774	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1sc(N)nc1C)C2	1800639829	OHXWRQUSINSIIA-WRWGMCAJSA-N	431.356	1.410	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COc1cccc(Cl)c1)C2	1800971323	WFUOSAGDEHZYOP-VLWCASSMSA-N	431.316	1.562	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCNc1ccc(C)cc1C)C2	1800977381	ZECUOSRYQMIYOK-NYUBLWNDSA-N	437.968	1.949	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C13CC(c4ccccc4)(C1)C3)C2	1800982433	FQTDZBBRLGUNDB-IPKWTVIASA-N	432.948	1.952	50	20	IDGD	
CC[C@@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)COC(=O)C(F)(F)F)C2	1801802539	VUJVUJJZCUGSCU-LMLFDSFASA-N	429.233	1.904	50	20	IDGD	
COCCOCCOCCOCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C(C)(C)CCl)C2	1802096881	KNDCGMXPSCYCDA-BCDXTJNWSA-N	448.988	1.586	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)COc2ccc(O)cc2)[C@@H]1c1cccnc1)[C@@H](O)CCl	1803136563	CVAQCZFZBHRXBG-ZAAXVRCTSA-N	433.892	1.472	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)ncc1[N+](=O)[O-]	1803138878	HCIBOIGYDFOXGT-FHLIZLRMSA-N	447.879	1.613	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1[C@H]2COC[C@H]21	1803396337	FTDWNOAACQCSQT-UXAIDIRLSA-N	443.456	1.664	50	20	IDGD	
CC(=O)NC(C)(C)C(=O)NC[C@@H]1CCN(C(=O)CO[Si](C)(C)C)[C@@H]1c1cccnc1	1803592879	WGATVPKOBMAWRQ-PKOBYXMFSA-N	434.613	1.854	50	20	IDGD	
Cc1cn(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@](C)(Cl)CCl)C3)c(=O)nc1O	1804097601	OMPHCBIWJWIWDE-YFQWEKLQSA-N	431.320	1.132	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)C[C@H]2CCCCO2)[C@@H]1c1cccnc1	1804105226	YHCZGCWTUFRQKV-PWHSHALESA-N	445.564	1.420	50	20	IDGD	
Cc1cc(C(=O)NC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)on1	1805706026	JDUCLDTVXQTJKA-HNAYVOBHSA-N	449.471	1.010	50	20	IDGD	
C[C@H](CBr)C(=O)N1CC[C@@H](CNC(=O)CSC(=N)N)[C@H]1c1cccnc1	1806996862	DUCHSRKZUXJPPP-OSAQELSMSA-N	442.383	1.745	50	20	IDGD	
C=CCC(CC=C)C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1	1807365422	OWFFIWAKVGTNSN-JTHBVZDNSA-N	447.344	1.849	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1	1807998092	IHXODYMQTQKSHO-XTQGRXLLSA-N	449.305	1.991	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)C2(C#N)CC2)[C@H]1c1cccnc1	1808415400	VQMMCPYZFZRAFO-UKVGILNFSA-N	447.499	1.525	50	20	IDGD	
CCc1oncc1C(=O)N1CCCC2(CCN(C(=O)c3cccc(B(O)O)c3)CC2)C1	1808762056	IULPJXNKIQCPLR-UHFFFAOYSA-N	425.294	1.075	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2nc3ncccn3n2)[C@@H]1c1cccnc1	1809236477	JKKHAYWPCWGLCQ-JYJNAYRXSA-N	443.895	1.093	50	20	IDGD	
COc1nn(C)cc1C(=O)N1CC[C@@H](CNC(=O)CO[Si](C)(C)C)[C@@H]1c1cccnc1	1810540977	NYANZZGXBTWDET-LPHOPBHVSA-N	445.596	1.995	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)C2=COCCC2)[C@@H]1c1cccnc1	1813073366	IUZGUWDACDDYPE-LAUBAEHRSA-N	429.521	1.155	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)[C@]2(C)CC2(F)F)[C@H]1c1cccnc1	1814079217	QECNSPHHHBQWJS-ZTNFWEORSA-N	437.491	1.506	50	20	IDGD	
Cc1c(F)ccc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@@H](O)CCl)CC3)c1N	1815235125	RYRWNPXBOWDVQN-ZANVPECISA-N	426.901	1.998	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@](C)(O)C(F)(F)F)n[nH]1	1815533960	UKTKXUOEFBOALA-PXAZEXFGSA-N	448.446	1.088	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)C(Cl)Cl)[nH]n1)c1cc2n(n1)CCNC2=O	1816626330	LHTMXWJYMJXQNB-LLVKDONJSA-N	440.291	1.459	50	20	IDGD	
Cc1ccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)cn1	1817473461	VHLFGVLOKIFWJV-LJQANCHMSA-N	433.277	1.413	50	20	IDGD	
C[C@H](Br)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2nc3ncccn3n2)n[nH]1	1818621217	URZHEPWJTVDHLC-JQWIXIFHSA-N	447.297	1.937	50	20	IDGD	
CNC(=S)NCCC(=O)Nc1cc([C@H]2CCCCN2C(=O)CCBr)[nH]n1	1819406019	DRQUZTPLRZIXTH-GFCCVEGCSA-N	445.387	1.671	50	20	IDGD	
C[C@H](C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@](C)(Cl)CCl)n[nH]1)n1cnnn1	1820869622	XDFQXLYNOHUWGC-RSAASHCRSA-N	429.312	1.886	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1)c1ccc(O)c([N+](=O)[O-])c1	1821042153	ISCMWBXOLMBWKQ-DOMZBBRYSA-N	437.840	1.929	50	20	IDGD	
Cc1c(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@H](F)Cl)CC3)cn2[nH]cnc(=O)c12	1821220548	CCFUOWIOIHHPPM-SDBXPKJASA-N	438.872	1.548	50	20	IDGD	
C=CCC(F)(F)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1	1821988165	OKRRABNKYMXBCH-AWEZNQCLSA-N	426.468	1.986	50	20	IDGD	
COCc1oncc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1	1822414476	VDHXXFDWNGBWBK-HNNXBMFYSA-N	447.496	1.223	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)[C@H]1CCCS1	1823008607	IAMPKKWBZVQOAN-IAGOWNOFSA-N	428.323	1.291	50	20	IDGD	
O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)[C@H]1CCCS1	1823010393	YQBVAMKPWQLLDF-DLBZAZTESA-N	428.323	1.291	50	20	IDGD	
O=C(NCCC(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@H](O)CCl)CC1)c1ccc[nH]1	1825160228	YXCMTHURHOAVCD-ZWKOTPCHSA-N	438.956	1.354	50	20	IDGD	
C[C@H](C(=O)N[C@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1)c1ccccn1	1826092178	PUPBAYLTSWGAGI-KBPBESRZSA-N	444.561	1.627	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2nccs2)CC1	1826111732	SHEZKWVSTNPCGC-KRWDZBQOSA-N	442.545	1.689	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CS(C)(=O)=O)CC1	1826625430	IQJFCGHDQFGEJQ-ZFWWWQNUSA-N	437.400	1.682	50	20	IDGD	
O=C(C1CCC(O)CC1)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1	1827060247	CPGYUYSYTLSCGP-FQUBMZHMSA-N	442.365	1.151	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)Cc2ccccn2)CC1	1827220337	RXRHXLMLSAIZAU-JOCHJYFZSA-N	435.333	1.237	50	20	IDGD	
O=C([C@H](F)Cl)N1CCC([C@@H]2CCCCN2C(=O)c2cc(=O)nc3cccnn23)CC1	1829620908	WTUHZEBCFJDGCB-KSSFIOAISA-N	435.887	1.857	50	20	IDGD	
O=C(CCc1c[nH]c2ccccc12)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2	1830722569	DGRGBAPGRBDIPQ-UGKGYDQZSA-N	449.935	1.157	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCC(=O)N3CCCC3)C2)C1	1831639746	DRRQBLSMAHIOED-DYESRHJHSA-N	443.972	1.253	50	20	IDGD	
Cc1cccnc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)Br)C2)C1	1831840366	AREROODRMHCBKV-RDTXWAMCSA-N	426.311	1.243	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H](O)c2ccco2)CC1	1831869688	LWWDWUCEAZNXNK-UTKZUKDTSA-N	434.537	1.306	50	20	IDGD	
Cc1cccnc1CCC(=O)N1CCO[C@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1	1832778416	JXRMNPKENHKUSD-JOCHJYFZSA-N	449.624	1.631	50	20	IDGD	
CCC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)C[C@H](NC)C(=O)O)CC2)CC1	1833532484	REJGGRZFNUZKMC-SJORKVTESA-N	430.977	1.028	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccn3C)CCO2)C1	1833905417	LKZZSSDCRDAQOT-KDOFPFPSSA-N	428.327	1.126	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1)c1ccc(O)nn1	1834071176	UKNUKMSTKXTWQF-HNNXBMFYSA-N	444.305	1.058	50	20	IDGD	
Cc1ccc(F)cc1C(=O)N1CCOC[C@]2(CN(C(=O)CCBr)CCO2)C1	1834820236	RQIIAJNUYBFPDG-IBGZPJMESA-N	443.313	1.989	50	20	IDGD	
Cc1nc(F)ccc1C(=O)N1CCOC[C@]2(CN(C(=O)CCBr)CCO2)C1	1834823126	JYDNNWLNUUYJRC-SFHVURJKSA-N	444.301	1.384	50	20	IDGD	
Cn1ncc2cc(C(=O)NC3CCN(C4CCN(C(=O)[C@@H](O)CCl)CC4)CC3)ccc21	1835414703	PBFGYTOHHGNFBG-FQEVSTJZSA-N	447.967	1.358	50	20	IDGD	
C=CC(=O)N[C@@H](C)C(=O)NC1CCN(C2CCN(C(=O)C(C)(C)CCl)CC2)CC1	1835827412	SKCNWIWUMHOSKO-HNNXBMFYSA-N	426.989	1.514	50	20	IDGD	
C[C@H](Nc1ccccn1)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1	1835846084	MYKAVIOGAYPJLQ-YJBOKZPZSA-N	437.972	1.053	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)n1cccc1C=O)CCO2	1835957194	BJCJUMKHDJRXQD-OXFYSEKESA-N	425.913	1.335	50	20	IDGD	
O=C(c1csc2c1CCCO2)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1836388927	LDANVQHDZWZVSJ-KSSFIOAISA-N	432.901	1.678	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)c3nc4ccccn4n3)CC2)CC1	1836396075	RBABULQHPWUCJP-QGZVFWFLSA-N	432.956	1.932	50	20	IDGD	
C[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C1(C(F)(F)F)CC1)CCO2	1836720875	WLBCUMJPVUTYIU-SMDDNHRTSA-N	443.260	1.569	50	20	IDGD	
C[C@H](Nc1ccccn1)C(=O)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1837747208	JOXLJQWRZWHEIY-SCLBCKFNSA-N	431.320	1.142	50	20	IDGD	
COc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)ccn1	1837973852	INBLTDPLMGHEJN-FQEVSTJZSA-N	425.913	1.425	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)NNc3ccccc3)C2)C1	1839141497	KBBYGWHZVKCFJN-PLMTUMEDSA-N	438.956	1.465	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3c(C)nc4ncccn34)C2)C1	1839144515	CQRZLFUUJDWEPT-YWZLYKJASA-N	435.912	1.125	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CCc4ccccc4O3)C2)C1	1839149025	QJZPJWKPCFFAAC-KPLVRAHFSA-N	436.936	1.854	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3c[nH]c(C(C)(C)C)c3)C2)C1	1840151081	VXOLVQJYXLPYLZ-IERDGZPVSA-N	441.956	1.636	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)C3(C(F)(F)F)CCC3)C2)C1	1840152073	WJPMDLWLYBSIBB-CZUORRHYSA-N	442.862	1.429	50	20	IDGD	
C[C@@H](NNc1ccccc1)C(=O)N1CCOC[C@@]2(CN(C(=O)C(Cl)Cl)CCO2)C1	1840186572	AXCMFNGIGYYSJS-KUHUBIRLSA-N	445.347	1.252	50	20	IDGD	
O=C(C(Cl)Cl)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1CCc3ccccc31)CCO2	1840260319	KQGXXRBLGDTIKW-UZLBHIALSA-N	427.328	1.977	50	20	IDGD	
Cc1ccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)o1	1840508672	DLCUVUMYRNIYGY-RDJZCZTQSA-N	433.274	1.277	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CC2(CCCN2C(=O)[C@@H]2CCc3nc(O)nc(O)c3C2)C1	1842058365	FYUUQJMICVFFCE-ADLMAVQZSA-N	443.331	1.432	50	20	IDGD	
O=C(c1cccc(N2CCOCC2)n1)N1CC2(CCCN2C(=O)CCBr)C1	1842638227	BYUOLYRFFSYFMR-UHFFFAOYSA-N	437.338	1.520	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)CCOCCOCCOCCOC)C2	1845166793	QLQQRVBPFSYWNB-KRWDZBQOSA-N	434.961	1.294	50	20	IDGD	
C[C@H](NC=O)C(=O)N1CC2(CCCN2C(=O)/C(C#N)=C/c2ccc(Br)cc2)C1	1845872893	MJMWLXKNWRFMLK-FSEGOYHTSA-N	445.317	1.694	50	20	IDGD	
O=C([C@H](O)CCl)N1CC2(CCCN2C(=O)Cc2ccc(Br)c(F)c2)C1	1845944793	YDZXEXCZAVIGCC-CQSZACIVSA-N	433.705	1.934	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)C1(NC(=O)OCc3ccccc3)CC1)C2	1846362752	UGJRUYNRWNNXPD-QGZVFWFLSA-N	449.935	1.903	50	20	IDGD	
CCn1c(=O)c2ccccc2n(CC(=O)NNC(=S)Nc2cccc(C)c2C)c1=O	28615836	FETZLTNCEMSRKH-UHFFFAOYSA-N	425.514	1.818	50	20	IDGD	
COc1cc(C(=O)NNC(=O)CS[C@H]2CCS(=O)(=O)C2)ccc1OCCC(C)C	105007686	ALOXQCJFZFGZCD-HNNXBMFYSA-N	444.575	1.801	50	20	IDGD	
Cn1cc(S(=O)(=O)N2CCCCC2)cc1C(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	106063436	WYYYEBGUHQQBGO-UHFFFAOYSA-N	435.462	1.183	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)N1CCC(C(=O)Nc2ccccc2)CC1	725871668	KAEVIXUTXNJFSS-UHFFFAOYSA-N	429.502	1.569	50	20	IDGD	
CC(C)OC(=O)C[C@H](NC(=O)NNC(=O)CNC(=O)c1cccs1)c1ccccc1	725872522	QFZJGYDYRNYNPM-HNNXBMFYSA-N	432.502	1.891	50	20	IDGD	
COc1ccc(-c2nn(CCC#N)cc2/C=C(/C#N)C(=O)N[C@@H]2CC(=O)N(C)C2)cc1OC	726537041	IVPGYNUJMOWQJY-YZIPPPLESA-N	448.483	1.735	50	20	IDGD	
COc1ncccc1NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	726871733	ZKROCPYOXJPQNY-UHFFFAOYSA-N	433.490	1.731	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCC(=O)N(C)CCc2ccccn2)ccc1OC(C)C	727480963	KPRRYRQPLRNILQ-UHFFFAOYSA-N	443.504	1.523	50	20	IDGD	
Cc1oc(-c2ccco2)nc1CC(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1	728340132	GZBOVSMUYGETFV-KRWDZBQOSA-N	441.396	1.316	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)N1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1	728951294	FZEXPIQYZKSGAV-IUCAKERBSA-N	430.305	1.813	50	20	IDGD	
O=C(Cc1cccnc1)NNC(=O)NCc1cccc(S(=O)(=O)N2CCCCC2)c1	728952144	UXDJUUSFMZRFMX-UHFFFAOYSA-N	431.518	1.329	50	20	IDGD	
COC(=O)c1ccc(C(=O)OC)c(S(=O)(=O)NNC(=O)Cn2ccc3ccccc32)c1	729667249	LFHURHQZNPTHGC-UHFFFAOYSA-N	445.453	1.224	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(S(=O)(=O)NNC(=O)c2cccc3ncccc23)c1	730204499	YTUJFGTVHLWYTG-UHFFFAOYSA-N	434.499	1.108	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1)NNC(=O)c1cccc2ncccc12	730225866	WBDQZZFDWRISRV-UHFFFAOYSA-N	443.441	1.273	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)NCCc1ccc(Br)cc1F	731044551	ROKNFDHSYRVRAO-UHFFFAOYSA-N	443.298	1.953	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)CNC(=O)c1c(Cl)cccc1[N+](=O)[O-]	731050463	KZOSGFBXLDJFCU-SNVBAGLBSA-N	438.799	1.732	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)c1cn(-c2cccc([N+](=O)[O-])c2)nn1	731458226	WJPKQEMOLADQAR-UHFFFAOYSA-N	443.445	1.373	50	20	IDGD	
C[C@H](CC(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)NC(=O)C1CCCCC1	732336067	BTZSSWOBUJZMMG-CYBMUJFWSA-N	434.449	1.374	50	20	IDGD	
CN(c1ccc(CNC(=O)NNC(=O)Cc2c[nH]c3ccccc23)cc1)S(C)(=O)=O	732475825	PEUBJNJTEQKUJP-UHFFFAOYSA-N	429.502	1.637	50	20	IDGD	
COCCNS(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2ccc(Cl)cc2)c1	733003955	WGXPEQXJFVNDHG-UHFFFAOYSA-N	440.909	1.409	50	20	IDGD	
O=C(CCC(=O)N1CC(=O)Nc2ccccc21)NNC(=O)c1cnn(-c2ccccc2)c1	733108658	VHALDKKDAIWZDB-UHFFFAOYSA-N	432.440	1.399	50	20	IDGD	
C[C@]1(CNC(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)CCOC1	733651605	RKMNIRDFINWWDS-GOSISDBHSA-N	438.531	1.920	50	20	IDGD	
CCS(=O)(=O)N1CCC[C@H](C(=O)NNc2ccccc2S(=O)(=O)NC(C)(C)C)C1	734252070	BLRCZIVWQQUGCV-AWEZNQCLSA-N	446.595	1.268	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)CCNC(=O)Cc1ccccc1	734252175	HENKGXZGECTRQB-UHFFFAOYSA-N	432.546	1.956	50	20	IDGD	
C[C@@H]1CCc2c(C(=O)NNc3ncccc3S(=O)(=O)N3CCN(C)CC3)csc2C1	735117455	UFBPPZUQZUBGLS-CQSZACIVSA-N	449.602	1.961	50	20	IDGD	
CN(CCCNC(=O)OC(C)(C)C)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1	736387178	NRYSPHNNDOLXBV-UHFFFAOYSA-N	435.529	1.280	50	20	IDGD	
Cn1cc(NS(=O)(=O)c2ccsc2C(=O)NNC(=O)COCc2ccccc2)cn1	737922887	DTMSDRQKWLBBFY-UHFFFAOYSA-N	449.514	1.260	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H]1CCC[C@H]1C(=O)NNC(=O)c1csc(N2CCOCC2)n1	739679854	DPIKSWYHARLERO-CHWSQXEVSA-N	439.538	1.434	50	20	IDGD	
COc1ccc(S(=O)(=O)CCC(=O)NNC(=O)NCCc2cccs2)cc1OC	740819034	UBFGFULZVWGRBJ-UHFFFAOYSA-N	441.531	1.502	50	20	IDGD	
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)[C@H]1Cc2ccccc21	741882730	LMKFDSOQNVQXML-FQEVSTJZSA-N	443.525	1.127	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)N[C@@H]1CC(=O)N(CCOc2ccccc2)C1	743623319	CQKFCTNOKMOIKW-GOSISDBHSA-N	426.473	1.214	50	20	IDGD	
CCc1cccc(C)c1NC(=S)NNC(=O)CCN1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O	743820500	DOMOYVIJXVRRNJ-SRABZTEZSA-N	430.530	1.428	50	20	IDGD	
CC(=O)NCc1ccc(C(=O)NNc2ccccc2S(=O)(=O)N2CCOCC2)cc1	744619123	ITPJTTSKASLWSO-UHFFFAOYSA-N	432.502	1.101	50	20	IDGD	
CC(C)NC(=O)NNC(=O)c1ccc(Br)c(S(=O)(=O)NC(C)(C)C)c1	745139567	LQYFXUFSWXOSKX-UHFFFAOYSA-N	435.344	1.878	50	20	IDGD	
CC(C)NC(=O)NNC(=O)c1ccc(NC(=O)C[C@H]2SC(N3CCCC3)=NC2=O)cc1	745139930	XVVFUIMZTOSEEZ-OAHLLOKOSA-N	446.533	1.461	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCC(OCCN3CCCC3)CC2)cc1OC	745990907	KSXICNFYYIUCMS-UHFFFAOYSA-N	434.537	1.042	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1ccc(Br)nc1	746577539	NHVHCVSXXRFLBE-UHFFFAOYSA-N	426.296	1.520	50	20	IDGD	
Cc1csc([C@@](O)(CC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)C(F)(F)F)n1	746821177	HQBMGYROTTZMQU-HNNXBMFYSA-N	441.395	1.028	50	20	IDGD	
COC(=O)c1cn(CC(=O)NNC(=O)CCCOc2ccc(Cl)cc2Cl)nn1	747348570	NATRJYYMBTVTLW-UHFFFAOYSA-N	430.248	1.378	50	20	IDGD	
COc1cc(OC)cc(N2CC[C@@H](NC(=O)NNC(=O)CCc3ccccc3)C2=O)c1	747954200	JVNUOMKJFSLEEG-LJQANCHMSA-N	426.473	1.772	50	20	IDGD	
O=C(COC(=O)[C@@H]1CCCN1C(=O)c1ccc2c(c1)OCO2)NNC(=O)c1cccs1	750180653	QVRFEMCVEXMCRK-ZDUSSCGKSA-N	445.453	1.086	50	20	IDGD	
COCCCN1C(=O)C(=NNC(=O)C(=O)N2CCCC2)c2cc(Br)ccc21	750936462	DYQHAZSATVIKFE-UHFFFAOYSA-N	437.294	1.275	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)[C@H]2CCCN(C(=O)[C@H](C)CC)C2)c2ccccc2c1=O	751052895	BLTZADCSOINDNH-CVEARBPZSA-N	441.532	1.852	50	20	IDGD	
CCOc1ccc(NC(=S)NNC(=O)c2ccc([C@@]3(C)NC(=O)NC3=O)cc2)cc1	751059774	JAUFCKHJXWDAMJ-HXUWFJFHSA-N	427.486	1.771	50	20	IDGD	
CC(C)(C)NC(=O)CN1CCC(CNC(=O)NNC(=O)COCc2ccccc2)CC1	751112673	ZPRDWUQJTKLOQX-UHFFFAOYSA-N	433.553	1.160	50	20	IDGD	
CCC(=O)NCc1cc(S(=O)(=O)NNC(=O)c2c(C)nc3ccccn23)ccc1OC	751539350	VHEHCTKTXFGKMZ-UHFFFAOYSA-N	445.501	1.301	50	20	IDGD	
CSC[C@H](C(=O)NNc1nc2ccccc2c(=O)n1C)N1C(=O)[C@H]2CCCC[C@@H]2C1=O	752906418	ITWPADVZGSVRIQ-HEHGZKQESA-N	443.529	1.283	50	20	IDGD	
N#Cc1ccc(CN2CC[C@H](NC(=O)NNC(=O)c3ccc4c(c3)OCCO4)C2=O)cc1	753290764	GWIKCXKCKVZWHK-KRWDZBQOSA-N	435.440	1.075	50	20	IDGD	
CS(=O)(=O)NCc1ccc(C(=O)NNC(=O)c2cc(F)ccc2Br)o1	753608117	JILBSSXYEDOLBC-UHFFFAOYSA-N	434.243	1.305	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)N[C@H](C)CO[C@H]2CCOC2)c2ccccc2c1=O	753948648	PSCGLZBOBRTCKC-CVEARBPZSA-N	445.520	1.725	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(N(C)C)c(NC(=O)NNC(=O)c2cc(C)[nH]n2)c1	755435955	XELPVXZSAFYYNW-UHFFFAOYSA-N	437.526	1.281	50	20	IDGD	
COc1ccccc1CC(=O)NNC(=O)Nc1cc(S(=O)(=O)N(C)C)ccc1N(C)C	755532735	PFLMIFSUJSDHMV-UHFFFAOYSA-N	449.533	1.407	50	20	IDGD	
Cc1nn(C)c(C)c1S(=O)(=O)N[C@H](C)C(=O)NNc1nc(C(F)(F)F)cs1	755852819	OGEUGDYDZZBBJZ-SSDOTTSWSA-N	426.446	1.322	50	20	IDGD	
C[C@@H]1CN(c2ccc(NC(=O)NNC(=O)c3nnc(O)c4ccccc34)cn2)C[C@@H](C)O1	755866840	YIHPPTVCLYIXPE-CHWSQXEVSA-N	437.460	1.811	50	20	IDGD	
CO[C@@H](C)C(=O)Nc1cccc(NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c1	756226723	FOAIVHJUGOGQMY-LBPRGKRZSA-N	438.444	1.373	50	20	IDGD	
CCOC(=O)c1sc([C@@H](C)NC(=O)NNC(=O)COc2ccc(C#N)cc2)nc1C	757274832	YBSAHOUPWDOWER-GFCCVEGCSA-N	431.474	1.970	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@@H](C)c2nccs2)c1	758721580	BCDIRHFXKPGSLA-CYBMUJFWSA-N	439.563	1.921	50	20	IDGD	
CS(=O)(=O)c1ccc(CNC(=O)NNc2ccccc2S(C)(=O)=O)cc1Cl	759301321	YKTJTFNYURNVKA-UHFFFAOYSA-N	431.923	1.973	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cnc(-c3cccnc3)s2)cc1	761197377	SMUIEUILLXVYKH-UHFFFAOYSA-N	445.526	1.595	50	20	IDGD	
CCc1sc(C(=O)NNC(=O)CN2CCC[C@@H](n3cc(C(=O)OC)nn3)C2)cc1C	762621638	BYJOQMLQLQCLLP-CYBMUJFWSA-N	434.522	1.095	50	20	IDGD	
CCOC(=O)c1cnn(-c2cccc(NC(=O)C(=O)NNC(=O)c3ccncc3)c2)c1C	763463903	HIGPUXMSJQLJTA-UHFFFAOYSA-N	436.428	1.152	50	20	IDGD	
O=C(NNC(=O)c1cccnc1)C(=O)Nc1ccc(N2CCOCC2)cc1C(F)(F)F	763494752	IOOWKZWBXBHVRB-UHFFFAOYSA-N	437.378	1.337	50	20	IDGD	
CCC(=O)c1cccc(NC(=O)C(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)c1	763540639	XOIRFQQBSTZUPZ-UHFFFAOYSA-N	429.429	1.705	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)[C@H]2COc3ccccc3O2)n(-c2ccc(F)cc2)n1	763579026	SPFABEHYDYUVPL-QGZVFWFLSA-N	439.403	1.246	50	20	IDGD	
CCOC(=O)c1cn(C)nc1NC(=O)C(=O)NNC(=O)COc1cc(C)ccc1C(C)C	763602585	UOSWQAWGAFLZRI-UHFFFAOYSA-N	445.476	1.194	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1cc(F)ccc1Br	763628691	DXBYXZPUTXCKOG-UHFFFAOYSA-N	434.225	1.944	50	20	IDGD	
O=C(COc1cccc(C(F)(F)F)c1)NNC(=O)C(=O)Nc1cccnc1-n1cccn1	763639937	MLOKUCYIAHVCSN-UHFFFAOYSA-N	448.361	1.451	50	20	IDGD	
COC(=O)c1c(C2CC2)csc1NC(=O)C(=O)NNC(=O)COc1ccc(OC)cc1	763659734	PMIXUJMCINLDEE-UHFFFAOYSA-N	447.469	1.586	50	20	IDGD	
C[S@](=O)Cc1cc(NC(=O)C(=O)NNC(=O)COc2ccccc2F)ccc1Cl	763680470	IZVPAJSRDKVIPV-LJAQVGFWSA-N	441.868	1.523	50	20	IDGD	
CCN(CC)C(=O)c1ccccc1NC(=O)C(=O)NNC(=O)c1cc(OC)cc(OC)c1	763773486	XTFZSRZSUXFSKT-UHFFFAOYSA-N	442.472	1.586	50	20	IDGD	
COC(=O)N(C)Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc(OC)cc(OC)c2)cc1	763774651	FKXDGEKQGDMAKC-UHFFFAOYSA-N	444.444	1.302	50	20	IDGD	
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1ccc2c(c1)C(=O)N(C)CC2	763863731	BLLJUFLALKWOKG-GFCCVEGCSA-N	428.420	1.007	50	20	IDGD	
CCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(S(C)(=O)=O)cc2)cc1OC	763910894	GQKHSRDIZWQUBM-UHFFFAOYSA-N	449.485	1.287	50	20	IDGD	
Cc1ccc(N2CCOC2=O)cc1NC(=O)C(=O)NNC(=O)Cc1ccc(Cl)cc1	763939017	BIMPOBMQXRAJHG-UHFFFAOYSA-N	430.848	1.934	50	20	IDGD	
CON(C)C(=O)c1ccc(NC(=O)C(=O)NNC(=O)C2=S=C3CCCCCC3=C2)cc1	763968652	TYIHOFICFRAPJV-UHFFFAOYSA-N	444.513	1.388	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2ccc(-c3ccc(F)cc3)s2)cn(C)c1=O	763975741	MPKIFBJNTJKSIH-UHFFFAOYSA-N	428.445	1.961	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNC(=O)c2cccc(C(F)(F)F)c2)n(C2CCOCC2)n1	764037442	KOZSYERGWAKTOO-UHFFFAOYSA-N	439.394	1.962	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)C(=O)Nc1ccn(-c2ncccc2C(F)(F)F)n1	764040846	NTOYZIHMGDOFDP-UHFFFAOYSA-N	448.361	1.694	50	20	IDGD	
CCOC(=O)c1cnn2c(C(=O)NNc3ccc(S(=O)(=O)NC4CC4)cc3)ccnc12	764095761	YWDMUALOMUYZRM-UHFFFAOYSA-N	444.473	1.104	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2ccc(OCc3cccc(F)c3)c(F)c2)n[nH]1	764100256	YVGAMLHRUSDCOH-UHFFFAOYSA-N	429.383	1.975	50	20	IDGD	
CCOC(=O)c1cc(Br)ccc1NC(=O)C(=O)NNC(=O)CC(F)(F)F	764112493	LSXYCWGYMBMRFZ-UHFFFAOYSA-N	440.172	1.664	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1cc(NC(=O)C(=O)NNC(=O)CC2CCCC2)ccc1F	764184051	MNZNEHUDFBRKKQ-UHFFFAOYSA-N	442.513	1.569	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)c2c[nH]nc2C)sc2c1CC[C@@H](C)C2	764297210	NBONYZOVGIDJDV-SECBINFHSA-N	433.490	1.481	50	20	IDGD	
CCN(CC)C(=O)c1ccccc1NC(=O)C(=O)NNC(=O)C(F)(F)Oc1ccccc1	764371123	XUKCAOALOSUIFP-UHFFFAOYSA-N	448.426	1.926	50	20	IDGD	
Cc1cc(C(=O)N2CCC[C@@H](C)C2)ccc1NC(=O)C(=O)NNC(=O)c1ncccc1C	764386306	FCENXONRRZZZTI-CQSZACIVSA-N	437.500	1.970	50	20	IDGD	
CCCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)CSc2ccccc2OC)cc1	764397821	NTLOZMCBXOIDMP-UHFFFAOYSA-N	444.513	1.713	50	20	IDGD	
O=C(CSc1ccccc1O)NNC(=O)C(=O)Nc1ccnn1Cc1ccccc1	764405050	OSEBPAUAVYGOHG-UHFFFAOYSA-N	425.470	1.515	50	20	IDGD	
C[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@H]1NC(=O)NNC(=O)c1cc([N+](=O)[O-])ccc1O	764541709	VXPQLQUCUPOCKV-BXUZGUMPSA-N	437.453	1.890	50	20	IDGD	
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NN=Cc3cnc(C4CC4)s3)CC2)cc1	764820424	YPXOXCKUNACEHZ-UHFFFAOYSA-N	447.586	1.786	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)c2cc3c(cc2[N+](=O)[O-])OCCO3)n[nH]1	765587596	DUFXIZDLFMGWKL-UHFFFAOYSA-N	439.384	1.840	50	20	IDGD	
CCOCC(=O)NNC(=O)C(=O)Nc1ccc(NC(=O)c2cccc(Cl)c2)c(F)c1	766260917	XJNWILRMWXUPFK-UHFFFAOYSA-N	436.827	1.854	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)[C@H]2CC(=O)N(c3ccc(Cl)c(F)c3)C2)C[C@@H](C)O1	767148479	VBJOECOMKZONBY-MCIONIFRSA-N	440.903	1.479	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)CCN1C(=O)[C@@H](C)Oc2ccccc21	767266032	QMKKNYSIERXYGL-MRXNPFEDSA-N	439.468	1.432	50	20	IDGD	
CCOC1CC(CNC(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)(N2CCOCC2)C1	767895783	KILBPXNNRDOCEN-UHFFFAOYSA-N	434.581	1.803	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)c2cc(F)cc3cccnc23)CC1	768408151	WBHJNARQIJACJJ-UHFFFAOYSA-N	444.492	1.462	50	20	IDGD	
COc1ccc(Br)c(C(=O)NNC(=O)NCCc2cn3c(n2)SCC3)c1	768523741	HLNXFOKYNILGSM-UHFFFAOYSA-N	440.323	1.947	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)c1nn(-c2ccccc2F)c(C)cc1=O	768634790	PFEKUQUCSDUBGL-UHFFFAOYSA-N	446.460	1.849	50	20	IDGD	
Cc1cc(Br)ccc1S(=O)(=O)NNC(=O)[C@H]1COc2ccccc2O1	769862084	HZTWSTLSSJARQS-CQSZACIVSA-N	427.276	1.907	50	20	IDGD	
Cc1ccc(C)c(S(=O)(=O)NCCC(=O)NNC(=O)c2ccc3c(c2)OCCO3)c1	770393848	SNQFZDBWOMKHPZ-UHFFFAOYSA-N	433.486	1.204	50	20	IDGD	
COc1ccc(-n2nc(C(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)cc2C)cc1	770577724	FPJSKTJJNINNBM-UHFFFAOYSA-N	432.440	1.511	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H]2CC(=O)N(c3c(F)cccc3F)C2)c1	770645654	QGUMEPKVOHXPHE-LBPRGKRZSA-N	437.424	1.182	50	20	IDGD	
Cc1cc2c(N3CCC[C@H]3C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)ncnc2s1	770747342	FLVUZPGIDCXEDE-INIZCTEOSA-N	449.500	1.405	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)N1CC=C(c2ccc3c(c2)OCCO3)CC1	770775748	QDJHTZXKUXAWCF-UHFFFAOYSA-N	426.429	1.311	50	20	IDGD	
Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)NNC(=O)C(=O)NCc1ccc(Cl)cc1	771606801	JDCUKWZBAGDRHS-UHFFFAOYSA-N	426.838	1.183	50	20	IDGD	
CCc1c(C(=O)NNC(=O)CCN2C[C@H](C)O[C@@H](C)C2)cnn1-c1ccc(OC)cc1	771712884	IGOOUWWAIJYPBD-HOTGVXAUSA-N	429.521	1.704	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)c1ccc(F)c(S(=O)(=O)N2CCCCC2)c1	771875444	TZZSCQLSYQXNFC-LBPRGKRZSA-N	429.470	1.103	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@@H](C)OC(=O)c1ccc2c(c1)CCCN2S(C)(=O)=O	771952006	JSBPJTPILLTODG-CYBMUJFWSA-N	425.507	1.138	50	20	IDGD	
CCC(=O)NNC(=O)[C@H](C)OC(=O)CCNC(=O)c1cc(F)ccc1Br	772025000	OZNNBFZBNAKSAI-VIFPVBQESA-N	432.246	1.197	50	20	IDGD	
Cc1cc(-n2cncn2)ccc1C(=O)NNC(=O)[C@H]1CCCN(C(=O)OC(C)(C)C)C1	773412389	DUNYTIKRDXUBKJ-HNNXBMFYSA-N	428.493	1.984	50	20	IDGD	
COc1cc(SC)ccc1NC(=O)C(=O)NNC(=O)c1cc(Br)c[nH]1	773531201	WJZNNECZDWLVPE-UHFFFAOYSA-N	427.280	1.907	50	20	IDGD	
CCn1nccc1C(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2OC)c1	775760192	KXDGABONUFBDGV-UHFFFAOYSA-N	443.485	1.787	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)NCC2=CCN(C)CC2)cc1	775960931	ZZBWVNMCVINCNA-UYRXBGFRSA-N	448.527	1.719	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(F)(F)c2ccccc2OCC(=O)N(C)C)cc1	778527447	DPRKBCOCWXPUBN-UHFFFAOYSA-N	435.427	1.780	50	20	IDGD	
COc1cc(C=NNC(=O)Cc2cc(O)nc(O)n2)c([N+](=O)[O-])cc1OCC(F)F	778541204	DEVQEYYSWZNMMU-UHFFFAOYSA-N	427.320	1.141	50	20	IDGD	
Cc1ccc(S(=O)(=O)N[C@H](C(=O)NNC(=O)CCCc2ccccc2)[C@H](C)O)cc1	779515017	RRSXVLHZIZPLTD-JXFKEZNVSA-N	433.530	1.193	50	20	IDGD	
Cc1nc(Cc2nnc(SCC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)o2)cs1	779998927	AEIYJGDVWJACQI-UHFFFAOYSA-N	434.459	1.887	50	20	IDGD	
O=C(NNC(=O)C1(c2cc(C(F)(F)F)ccc2Cl)CC1)N[C@@H]1CCS(=O)(=O)C1	780460580	VOISTSPKSUFNKQ-SNVBAGLBSA-N	439.843	1.908	50	20	IDGD	
O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)NCc1ccccc1CN1CC[C@@H](O)C1	781950831	FDUYRZACVJIDHY-QGZVFWFLSA-N	443.460	1.071	50	20	IDGD	
Cc1cc(C)n(-c2cccc(NC(=O)C(=O)NNC(=O)Cc3nc4ccccc4n3C)c2)n1	782893426	ICRMQJDDQANULM-UHFFFAOYSA-N	445.483	1.704	50	20	IDGD	
NC(=O)COc1cccc(NC(=O)C(=O)NNc2ccc(Br)cc2F)c1	783082495	ZLAVQLQPHWLZAY-UHFFFAOYSA-N	425.214	1.534	50	20	IDGD	
O=C(NNc1ncnc2ccsc12)C(=O)Nc1ccc(CN2C(=O)CCCC2=O)cc1	783253043	GOSJKALSQOMVFC-UHFFFAOYSA-N	438.469	1.812	50	20	IDGD	
O=C(NNc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1cccc(C(=O)N2CCOCC2)c1	783290867	GSJUWXRPGYNHAK-UHFFFAOYSA-N	447.835	1.802	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)C(=O)Nc2cc(C(=O)N3CCCC3)ccc2OC)c1	784851390	JWZFSOHOAIVFDG-UHFFFAOYSA-N	440.456	1.800	50	20	IDGD	
O=C(NNc1cccc(C(F)(F)F)n1)C(=O)Nc1cccc(CN2C(=O)CNC2=O)c1	784957872	IZGSZPCGVCIYMH-UHFFFAOYSA-N	436.350	1.234	50	20	IDGD	
Cc1ccc(Br)c(NC(=O)C(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)c1	785022272	FAOYZCMVWMGWCC-UHFFFAOYSA-N	437.206	1.771	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)C(=O)Nc1cc(F)ccc1N1CCCCC1	785060511	IIXTUYBXGWFBKW-UHFFFAOYSA-N	438.463	1.792	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)[C@@H]2CCN(C(=O)OC(C)(C)C)[C@@H]2C)c2ccccc2c1=O	786252573	IXMYZIYCGOYASS-ZIAGYGMSSA-N	443.504	1.823	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCc2nc(-c3cccc(F)c3)no2)nc1	787409639	CYGVBUVYBYXIRQ-UHFFFAOYSA-N	449.468	1.784	50	20	IDGD	
CCNC(=O)Nc1ccc(C)c(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)c1	787543335	IGZIXVGTQFEIGX-CYBMUJFWSA-N	445.451	1.829	50	20	IDGD	
Cc1cnc(Cl)c(NC(=O)C(=O)NNC(=O)COc2ccc(Br)cc2)c1	787889638	PSMUONVCDGGWMS-UHFFFAOYSA-N	441.669	1.971	50	20	IDGD	
CN(NS(=O)(=O)c1cccc(F)c1C#N)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	788916422	OIJNQXVDIDAXID-UHFFFAOYSA-N	441.485	1.495	50	20	IDGD	
Cc1c(F)cccc1S(=O)(=O)NN(C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	788916523	LYGZGKBVCKHNHI-UHFFFAOYSA-N	430.502	1.932	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C(=O)Nc2ccc(Cl)nc2C)n[nH]1	789740348	VBBDLHHPRFKPHH-UHFFFAOYSA-N	428.836	1.842	50	20	IDGD	
CCNC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)c1C	789740990	MDZOMIRBNIVGOT-CYBMUJFWSA-N	445.451	1.829	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc3c2OCC[C@@H]3OC)cc1OC	790951922	MRTHUJMMWRTEPU-INIZCTEOSA-N	443.456	1.964	50	20	IDGD	
Cn1cc(C(=O)NNC(=O)NNC(=O)CNC(=O)OCc2ccccc2)c2ccccc21	792772392	IIFMICCKJQRKGN-UHFFFAOYSA-N	438.444	1.080	50	20	IDGD	
CC(C)c1ccccc1NC(=S)NNC(=O)[C@](C)(O)CN1C(=O)NC2(CCCC2)C1=O	793990156	WXPUWKSBMCZAPN-HXUWFJFHSA-N	447.561	1.743	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2cc(-c3ccccc3)on2)cc1	794646144	DUQMGMRWAYQADO-UHFFFAOYSA-N	442.453	1.284	50	20	IDGD	
CCCCCCOc1ccc(C(=O)NNC(=O)C2CCN(S(=O)(=O)NC)CC2)cc1	795019520	ICKGKIHEPVFNLV-UHFFFAOYSA-N	440.566	1.583	50	20	IDGD	
C[C@H]1[C@H](NCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)[C@H](C)CCN1C(=O)OC(C)(C)C	796644377	KNDHIZCOSWEBKS-QWQRMKEZSA-N	449.508	1.979	50	20	IDGD	
CNC(=O)[C@]1(C)CCN(C(=O)NNC(=O)[C@H]2Cc3ccccc3CN2Cc2ccccc2)C1	797607089	AJFQECUVHJKFSR-PXDATVDWSA-N	449.555	1.812	50	20	IDGD	
Cc1ccc([C@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)C(=O)Nc2ccccn2)cc1	797738585	GFGDEZJELIZUDG-INIZCTEOSA-N	427.461	1.742	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc(Br)cnc1Cl)c1ccc2c(c1)OCCO2	800832369	PAEXSJGOIISCJJ-UHFFFAOYSA-N	448.682	1.892	50	20	IDGD	
CC(C)Cn1c(=O)nc(O)c2c(C(=O)NNC(=O)N=c3cc[nH]cc3)cc(C3CC3)nc21	802022712	FYEJTGBLHJWGFT-UHFFFAOYSA-N	437.460	1.314	50	20	IDGD	
COc1cc(NC(=O)NNC(=O)CN(C)C(=O)[C@@H](C)n2cccn2)c(OC)cc1Cl	802080074	MXZANZCGPXECRS-LLVKDONJSA-N	438.872	1.426	50	20	IDGD	
C[C@H](NS(=O)(=O)c1ccc(Cl)cc1)C(=O)NNC(=O)Nc1ccc2c(c1)OCO2	802097561	OJLGOHIHKYQASW-JTQLQIEISA-N	440.865	1.588	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(F)c(N3CCCNC3=O)c2)cc1	806974241	BCHHVCGRXURYEZ-UHFFFAOYSA-N	443.435	1.219	50	20	IDGD	
CCc1noc(-c2ccc(C)c(NC(=O)C(=O)NNc3ccc(-n4ccnc4)nn3)c2)n1	807429538	UWLXMISWLNRAMO-UHFFFAOYSA-N	433.432	1.665	50	20	IDGD	
Cc1nc(Cl)ccc1S(=O)(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12	808069554	YUCSDENMRGAZIS-UHFFFAOYSA-N	435.893	1.958	50	20	IDGD	
CCOc1ccc(NC(=S)NNC(=O)[C@@H](Cc2cnc[nH]2)NC(=O)CC(C)C)cc1	810022416	LWOLRFRFWSBGFL-QGZVFWFLSA-N	432.550	1.900	50	20	IDGD	
COC(=O)Cc1cc(Br)ccc1S(=O)(=O)NNC(=O)NCc1ccco1	811683116	NQDHUYWSVLCLGQ-UHFFFAOYSA-N	446.279	1.450	50	20	IDGD	
CCn1cnc2c1c(=O)n(CC(=O)NN=Cc1nccs1)c(=O)n2Cc1ccccc1	814745718	FIHPJHHLVRHIGM-UHFFFAOYSA-N	437.485	1.035	50	20	IDGD	
Cn1cnn(CCC(=O)NNC(=O)c2cn(-c3ccccc3)nc2-c2ccccc2)c1=O	814815013	JFZDNFPNOZOXFE-UHFFFAOYSA-N	431.456	1.286	50	20	IDGD	
CNC(=O)c1cc(Oc2cccc(NC(=O)C(=O)NNc3ncc(F)cn3)c2)ccn1	815604233	IBMSJDFMDRXVDQ-UHFFFAOYSA-N	425.380	1.244	50	20	IDGD	
C[C@@H](C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1)c1ccc2c(c1)OCO2	815854927	WUIBSNUXWGQDLG-OAHLLOKOSA-N	446.529	1.598	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)c2cccc(CS(C)(=O)=O)c2)C1	816510303	RKAVJDJUUJXFGT-INIZCTEOSA-N	439.534	1.639	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1	817053502	UJDSDMXSOBLALO-UHFFFAOYSA-N	431.434	1.183	50	20	IDGD	
COc1cccc(/C=C(\C(=O)NNC(=O)c2ccc3c(c2)OCCO3)n2nnnc2C)c1	818091779	LVXURFYNJBVNTD-GZTJUZNOSA-N	436.428	1.221	50	20	IDGD	
COc1ccc(NCC(=O)NNC(=O)Cn2c(S)nnc2-c2ccc(OC)cc2)cc1	825549147	KWAFBGJTIJRBRO-UHFFFAOYSA-N	442.501	1.511	50	20	IDGD	
O=C(CNS(=O)(=O)c1cccc(Br)c1)NNC(=O)NC1CCCCC1	913451246	PIOTUNPNNUDLMC-UHFFFAOYSA-N	433.328	1.391	50	20	IDGD	
COc1cc(I)c(Cl)cc1C(=O)NNC(=O)C(=O)NC(C)C	914718262	AFKVVMMUXVFMLY-UHFFFAOYSA-N	439.637	1.239	50	20	IDGD	
Cn1cc(S(=O)(=O)N2CCCCC2)cc1C(=O)NNC(=O)Cc1ccc(Cl)cc1	914846597	OIZUJUYZLZSIBQ-UHFFFAOYSA-N	438.937	1.857	50	20	IDGD	
CCOC(=O)c1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NNC(=O)c2ccccc2C)o1	915062501	RRSJJWGGMOLZAN-HNNXBMFYSA-N	449.485	1.379	50	20	IDGD	
O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)Nc1ccc([N+](=O)[O-])cc1	915879976	XPHJNIGJPWCBMG-UHFFFAOYSA-N	433.446	1.846	50	20	IDGD	
Cc1ccc(OCCNC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc1	915890059	SHWUEYJIFLSMPP-UHFFFAOYSA-N	446.529	1.803	50	20	IDGD	
CCCS(=O)(=O)N1CCC(NC(=O)NNC(=O)COc2cc(C)ccc2C)CC1	916383775	RVPXCWXWWWPWSU-UHFFFAOYSA-N	426.539	1.217	50	20	IDGD	
N#Cc1ccc(S(=O)(=O)NNC(=O)[C@H]2COc3ccccc3O2)c(C(F)(F)F)c1	917716830	DVYRYXCRLZFWSK-CQSZACIVSA-N	427.360	1.727	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(CCCl)cc1)c1csc(N2CCOCC2)n1	917723929	PXXFQYTXEUWEPZ-UHFFFAOYSA-N	430.939	1.384	50	20	IDGD	
O=C(NCc1cccc(S(=O)(=O)NCc2cccc(F)c2)c1)NNc1ncccn1	918098100	AYQHFIHRLDXCNB-UHFFFAOYSA-N	430.465	1.921	50	20	IDGD	
CCN(C(=O)CCC(=O)C(C#N)=C1N(C)c2ccccc2N1C)[C@@H]1CCS(=O)(=O)C1	919706615	ORMBOHZGQAYLAF-OAHLLOKOSA-N	430.530	1.693	50	20	IDGD	
Cc1nc(-c2cccc(Cl)c2)sc1C(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1	919885224	NZPLTHZJUJFCSI-LBPRGKRZSA-N	428.923	1.903	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccc(-n3cccn3)c(F)c2)c1	920931473	URDUYSZRMXIBFW-UHFFFAOYSA-N	446.464	1.728	50	20	IDGD	
CC(C)CN1CCO[C@@H](CNC(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)C1	1251923352	OJCTUWDPPSAMGW-KRWDZBQOSA-N	441.573	1.321	50	20	IDGD	
Cc1ccc(C)c(-c2cc(C(=O)NNC(=O)CNC(=O)c3cc(Cl)ccn3)n[nH]2)c1	1319235999	FSHYXMYQHYAPGG-UHFFFAOYSA-N	426.864	1.933	50	20	IDGD	
Cc1nc2ccccc2c(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1C	1321044260	YHLBKDIUEYRFHV-LJQANCHMSA-N	435.436	1.996	50	20	IDGD	
CC1(C)CCc2nc(O)c(C(=O)N3CCN(S(=O)(=O)CBr)CC3)cc2C1	1323847503	PGTJKRSFDQHXRJ-UHFFFAOYSA-N	446.367	1.742	50	20	IDGD	
O=C(CCBr)N1CCO[C@]2(CCN(C(=O)c3n[nH]c4c(F)cccc34)C2)C1	1778633523	YRIPGCZHZLWXAD-GOSISDBHSA-N	439.285	1.931	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2)c1cccc(C(F)(F)F)n1	1779683697	WZJJXTVFNUBRPA-JCKWVBRZSA-N	449.857	1.828	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3nccc(Cl)c3OC)C2)C1	1780328442	NNAQFLZCPVEKLV-SCLBCKFNSA-N	432.304	1.441	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1n[nH]cc1[N+](=O)[O-])C2	1780712932	ZDIANJIDWFPUTG-CSMYWGQOSA-N	448.307	1.682	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H]1CCNC(=O)C1)C2	1780714388	BUISMEDNDIFEQE-TWKYDXJASA-N	434.364	1.263	50	20	IDGD	
CCOc1c(F)cc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)cc1Cl	1781848424	JUTRYPMLACXISB-BEFAXECRSA-N	449.306	1.921	50	20	IDGD	
COc1nccnc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)Br)C1	1781996122	BAXKWIZPAPAYGC-VEVIJQCQSA-N	441.326	1.396	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H]1CC[C@@H]3CCC(=O)N3C1)C2)C(Cl)Cl	1782219377	YHGWWASYUMRIEW-RDNQGFKOSA-N	446.375	1.705	50	20	IDGD	
Cn1nccc1C(=O)N1CCO[C@@]2(CCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1	1782863528	FPKCAQYHEQKXLF-JLOHOZFJSA-N	441.438	1.749	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)Cc3ccccc3O)C2)C1	1783231142	YAOLBZUXPFFYKB-IFXJQAMLSA-N	425.323	1.796	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(Cl)ncn3)CCO2)C1	1783353548	XMPZAPMEHNDZOX-BZNIZROVSA-N	431.718	1.747	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H]3CCCO3)C2)C1	1783479464	CJLGYNBUXHRVEO-AVYPCKFXSA-N	445.944	1.127	50	20	IDGD	
CN1CCC(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]32)CC1	1783656570	ILNFLXSZIUDJLG-OGNFBWPZSA-N	434.408	1.934	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(C)c(C(=O)O)c(C)c3)CCO2)C1	1783882841	QZIGWKSRRFKXLD-KKSFZXQISA-N	438.908	1.699	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccccc3OC(F)F)CCO2)C1	1783883890	MTYYVTDEIXXHQW-AUUYWEPGSA-N	432.851	1.985	50	20	IDGD	
O=C(CCS(=O)(=O)c1ccccc1)N1CCO[C@]2(CCN(C(=O)C(Cl)Cl)C2)C1	1783947587	VQBHXZLTZDAMMS-GOSISDBHSA-N	449.356	1.484	50	20	IDGD	
CCCNC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]2C1	1783963814	AAMQFJXRSBXTSO-VGWMRTNUSA-N	446.386	1.304	50	20	IDGD	
Cc1nccnc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]2C1	1783969015	CXRHHSUFPRFMPG-UNQGMJICSA-N	425.327	1.409	50	20	IDGD	
COc1cccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)c1F	1785299930	DYSBCIMBXHYMNR-WMLDXEAASA-N	433.249	1.968	50	20	IDGD	
Cc1cc(C(=O)NCC(=O)NC2(c3ccc(NC(=O)[C@H](O)CCl)cc3)CCC2)no1	1786134910	SXJWCWJISHPQHC-MRXNPFEDSA-N	434.880	1.447	50	20	IDGD	
O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc4[nH]ncc34)C[C@@H]21	1786405790	BMQUJIYKNYLJHP-NUTKFTJISA-N	435.322	1.941	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)c1cnc2cc(Cl)ccn12	1787239297	RXSYLHKYDPUNMC-MZGVZZPPSA-N	441.315	1.181	50	20	IDGD	
C[C@H](Br)C(=O)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1	1788149477	XCELMVUZKCPNTK-ZDUSSCGKSA-N	445.122	1.898	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]2C1	1788764736	ZKZDLHUUTOFOOL-XQLPTFJDSA-N	435.435	1.991	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)c1cnc(Cl)c(Cl)c1	1788871551	TWJUTHDHYCCOLJ-VMXABPDPSA-N	436.723	1.581	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)c1ncccc1C(F)(F)F	1788993696	PLDZISPLXCNGDE-VTPLQMEGSA-N	435.830	1.293	50	20	IDGD	
COCc1c[nH]c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]32)c1	1789210935	PXFHMCOSEVBXBX-PWDMQXDWSA-N	432.348	1.991	50	20	IDGD	
CN(C)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]2C1	1789868708	JOHRYKFIYIZLNU-NUADTHGBSA-N	443.375	1.977	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3nc4ccc(F)cn4n3)[C@H]2C1	1790528890	MONKBVSPDRKACP-BPUTZDHNSA-N	449.559	1.313	50	20	IDGD	
Cc1nn(C)c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](C)Br)[C@H]3C2)c1F	1791057079	OFJPTKIQAIGUKX-BQUFFADESA-N	431.306	1.244	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnn(-c4cccnc4)c3)C[C@@H]21	1791252679	RNBNFVDDIFMFLH-QZHFEQFPSA-N	447.923	1.114	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)NC(=O)c3ccccc3)[C@H]2C1	1792249738	CBPGHWRFJFDLKP-HZZCBIDNSA-N	435.952	1.802	50	20	IDGD	
COC(=O)[C@H]1CCC[C@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C(C)(C)CCl)C1	1792785654	NSBNEOGNCYVILW-VIQHNZTISA-N	428.957	1.820	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cc2ccccc2n1C	1792818582	ICLMCJLIPNTULP-HPNQWNLUSA-N	433.936	1.564	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2)c1cc(Cl)nc2n[nH]cc12	1796058237	WIPXDNRQKNNSKR-IJBDUVHLSA-N	432.695	1.618	50	20	IDGD	
COc1cc(N2CCC(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)[C@@H](F)Cl)CC2)ncn1	1796804383	KVPWAXYYWQPRFL-BASYENTBSA-N	439.919	1.874	50	20	IDGD	
Cc1c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Br)C3)nc2ccccn12	1796847137	JMYTYCCPMRHHLP-NOXHYTERSA-N	439.285	1.536	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@H](O)[C@H](C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](F)Cl)C3)C1	1797684036	MLWREEXVTNFBEH-GTDBDLECSA-N	447.935	1.777	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cc1cccc(F)c1)C2	1798439275	UJJBESWVPAGWHH-BJWYYQGGSA-N	425.464	1.319	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(C(F)(F)F)ccn1	1798880834	HJCDSTQHPSVMCL-QDMKHBRRSA-N	441.454	1.725	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1(Br)CC1)C2	1799277129	UCVBGPOZEDAAJA-MIJXAVMKSA-N	428.154	1.740	50	20	IDGD	
CCn1nc(C(C)C)cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(B(O)O)cc1)C2	1799470380	RGSDOWQTQJOLAN-REPLKXPHSA-N	438.337	1.272	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cn1nc(C)cc1C)C2	1800640058	IXXWVSCDGDONSG-JYYAWHABSA-N	427.343	1.263	50	20	IDGD	
C[C@H](C(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1)C1(O)CCC1	1802469714	VHOTWNUXSFXNEW-BLIXFSHQSA-N	445.564	1.012	50	20	IDGD	
CC(C)(CCl)C(=O)NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)n2)[C@H]1c1cccnc1	1802898998	HRVPKJBDCXEAMO-BBRMVZONSA-N	433.896	1.867	50	20	IDGD	
COC(=O)[C@@H]1CC[C@H](C(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)C1	1803137357	MMJANFMHSOZNDW-QYKUSJBESA-N	437.924	1.276	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc3n[nH]cc3c2)[C@@H]1c1cccnc1)[C@H](O)CCl	1803138451	AXSADDVUZQYXLV-KFKAGJAMSA-N	427.892	1.877	50	20	IDGD	
CC(=O)NC(C)(C)C(=O)NC[C@@H]1CCN(C(=O)CO[Si](C)(C)C)[C@H]1c1cccnc1	1803592872	WGATVPKOBMAWRQ-HKUYNNGSSA-N	434.613	1.854	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC2(CCCN(C(=O)C(F)(F)C(F)F)C2)CC1	1806497678	GYUNTKKTNQFQDZ-UHFFFAOYSA-N	430.207	1.112	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)C2CC(F)(F)C2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1	1807360156	OREOTJPPYUASOC-QFBILLFUSA-N	443.259	1.126	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)c(C)o1	1807365042	WMEVQANMRGFLHS-DENIHFKCSA-N	447.300	1.605	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)CCc2ccoc2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1	1807374156	IWNKWRDAJGMZCT-NZQKXSOJSA-N	447.300	1.307	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)c2ccon2)[C@H]1c1cccnc1	1808414899	PDNIPJDUVXEZPD-TYNUBOESSA-N	449.471	1.523	50	20	IDGD	
CC(C)CNC(=O)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@@H]1c1cccnc1	1808447801	WFWVOCKIZXELQG-RRFJBIMHSA-N	443.317	1.550	50	20	IDGD	
COCCn1nccc1C(=O)NC[C@@H]1CCN(C(=O)[C@H](Cl)COC)[C@@H]1c1cccnc1	1808638883	FTJYLIDNNMLMAK-YQVWRLOYSA-N	449.939	1.498	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCC2(CCCN(C(=O)C[C@H](NC)C(=O)O)C2)CC1	1809839107	MNTUVQUXUKBRLB-KGLIPLIRSA-N	432.359	1.454	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)n3)C2)CC1	1810888666	HARNSSVDYUQVJV-KRWDZBQOSA-N	431.320	1.969	50	20	IDGD	
CC(C)(C)n1cc(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)nn1	1811549019	OSBOTOVEQJKYQJ-XIRDDKMYSA-N	434.928	1.347	50	20	IDGD	
C#CC(=O)NC[C@H]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2OC(C)=O)[C@H]1c1cccnc1	1812530403	AXXPRWHMUODRBV-IERDGZPVSA-N	436.424	1.868	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)[C@@]2(C)CC2(F)F)[C@H]1c1cccnc1	1814079216	QECNSPHHHBQWJS-XFQXTVEOSA-N	437.491	1.506	50	20	IDGD	
C[C@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](N)c3ccccn3)sc2C1	1815022241	KHECPEKJDYESTD-IMSIIYSGSA-N	438.351	1.934	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)C1CCSCC1)CC2)c1ccc(B(O)O)cc1	1815347852	SRZQPINMPROVIY-HNNXBMFYSA-N	445.375	1.192	50	20	IDGD	
Cc1ncc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)s1	1815356761	QRGPEWNDBXYOGE-CYBMUJFWSA-N	442.331	1.127	50	20	IDGD	
O=C(COc1ccccc1)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1	1816858823	JYXHFZWOXXLAKW-HXUWFJFHSA-N	448.288	1.474	50	20	IDGD	
Cc1cc(/C=C/C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)no1	1819471492	DSRFUFXHFUDNDT-SGQUHAKNSA-N	449.276	1.405	50	20	IDGD	
CCS(=O)(=O)CC(=O)N1CCCC[C@H]1c1cc(NC(=O)CO[Si](C)(C)C)n[nH]1	1819591836	OTRNBZJBEYSBLE-AWEZNQCLSA-N	430.603	1.688	50	20	IDGD	
C[Si](C)(C)OCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2CCCS2(=O)=O)[nH]n1	1819596685	OOKBELUDUGKIRT-GJZGRUSLSA-N	442.614	1.831	50	20	IDGD	
COc1ccnc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)c1	1819765446	ATAJSFCLUFHIIS-LJQANCHMSA-N	449.276	1.113	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)CCl)CC2)c1cc2ncsc2[nH]1	1820217169	QVYNQUNGKSOKMF-HQJQHLMTSA-N	425.923	1.906	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnn3c2OCCC3)n[nH]1	1821434940	XAWPTZJFXRWXIT-UKRRQHHQSA-N	436.900	1.948	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H]1CCNC(=O)C1)CC2	1822869917	OYKOFXKIPMABBY-KEYDSSBGSA-N	433.361	1.818	50	20	IDGD	
O=C([C@H](O)CCl)N1CCC([C@@H]2CCCCN2C(=O)c2cnc(OCF)cn2)CC1	1825545327	RVNODCFODWZRQH-JKSUJKDBSA-N	428.892	1.615	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CN1CCCC1=O)CC2	1825640640	BULGDDMZICDHLJ-VHSXEESVSA-N	429.340	1.461	50	20	IDGD	
Cc1[nH]nc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)c1F	1827056225	RVBABKSKNLMYNH-GOSISDBHSA-N	442.300	1.084	50	20	IDGD	
C[C@@H]1CC[C@H](C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)O1	1828402037	BBNCMJHCFHPWCY-TYCQWZJGSA-N	428.338	1.167	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3cccc(C#N)c3)CCO2)C1	1830461676	VZMANAANRWLPQY-SIKLNZKXSA-N	433.936	1.965	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc(OCC)cn3)C2)C1	1831644138	PQLJBHUGSAHPNG-MGPUTAFESA-N	440.928	1.353	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](CN)c3ccccc3)C2)C1	1831646147	IAAUFBVPAZFPBF-XQBPLPMBSA-N	437.968	1.593	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4cccnn4c3)C2)C1	1831654874	YOBDWENNHWCZAQ-RXVVDRJESA-N	434.924	1.812	50	20	IDGD	
Cc1nccn1[C@H](C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1	1832314743	WTABINVYSARKDJ-XLIONFOSSA-N	446.596	1.745	50	20	IDGD	
C=CCNC(=O)/C=C\C(=O)NC1CCN(C2CCN(C(=O)C(Cl)Cl)CC2)CC1	1833077177	SJDHZPPQONXPDL-ARJAWSKDSA-N	431.364	1.220	50	20	IDGD	
Cn1ccc2cccc(C(=O)N3CCC(N4CCC(NC(=O)[C@H](O)CCl)CC4)CC3)c21	1833310037	GNIGIQAZWJTXMX-HXUWFJFHSA-N	446.979	1.963	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3noc4c3CCCC4)CC2)CC1)[C@H](O)CCl	1833310989	ZXSVGHWDIHPMGC-QGZVFWFLSA-N	438.956	1.338	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](C)n3ccnc3)CC2)CC1	1833378983	ZTSQERRFQJKCET-HUUCEWRRSA-N	440.386	1.799	50	20	IDGD	
Cc1noc(C)c1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1	1834068691	IHWUBTJWAQGOLM-XJKSGUPXSA-N	434.262	1.052	50	20	IDGD	
CC(C)(C)[C@@H](O)C(=O)N1CCC(N2CCC(NC(=O)CCBr)CC2)CC1	1834421704	TUYOEBJKYYOBAC-KRWDZBQOSA-N	432.403	1.750	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccccc3)CCO2)C1	1834997803	NYPJUAHCJUVCEG-UXHICEINSA-N	429.344	1.922	50	20	IDGD	
CC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)Cc3nnc(C)s3)CC2)CC1	1836396121	VATVOOBZTYCUAY-MRXNPFEDSA-N	428.002	1.978	50	20	IDGD	
CC(C)(C)NCC(=O)N1CCC(N2CCC(NC(=O)[C@H](F)Br)CC2)CC1	1836412254	AVPCLMCATSKDFJ-INIZCTEOSA-N	435.382	1.637	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)C[C@@H](NC)C(=O)O)CC2)CC1	1836918630	BAWKRVXNVHWMOU-IAGOWNOFSA-N	431.961	1.455	50	20	IDGD	
O=C(c1cccc(=O)n1O)N1CCC(OC2CCN(C(=O)C(Cl)Cl)CC2)CC1	1837288762	KDNLEVKMFHCRAJ-UHFFFAOYSA-N	432.304	1.502	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)CS[C@H]3CCCCO3)CCO2)C1	1837501242	IHMGAWLPFOQJMD-FXAWDEMLSA-N	449.013	1.968	50	20	IDGD	
CCn1nc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)cc1C	1838152052	BVBMVNLADLFVLT-OALUTQOASA-N	447.363	1.518	50	20	IDGD	
CCc1cc(C(=O)N2CCC(OC3CCN(C(=O)[C@@H](Cl)COC)CC3)CC2)n(C)n1	1838475467	NGJWQICMBYDPAL-SFHVURJKSA-N	440.972	1.849	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)COc3ccc(OC)cc3)C2)C1	1839141189	AEPFNVRHQHOVQU-WIYYLYMNSA-N	440.924	1.548	50	20	IDGD	
O=C(CCc1ccccn1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2	1839198044	RCMHXNDJBCXUQY-AEFFLSMTSA-N	444.301	1.161	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccccc3Cl)C2)C1	1840151511	FFFXLGYGAWXUMY-XLIONFOSSA-N	445.343	1.593	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc4cc[nH]c34)C2)C1	1840152776	SSRZMQLZGOAVQP-UWJYYQICSA-N	435.908	1.492	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc(Cl)s3)C2)C1	1840153039	BGPOMQLXBXAVOG-MEDUHNTESA-N	438.333	1.120	50	20	IDGD	
O=C(c1cccn2cncc12)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840188599	SKDRVTQUCNZOPG-GOSISDBHSA-N	427.288	1.208	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H](C)Cn3ccnc3)CCO2)C1	1840429526	VYTXBQOMHZPUGM-ZWOKBUDYSA-N	426.945	1.383	50	20	IDGD	
O=C(Cc1ccc(F)cc1Cl)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1	1843010652	OSLJKUMMSYXGHO-UHFFFAOYSA-N	430.672	1.219	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)c1cc(C)n(C)n1)C2	1844692150	NFIXCNOOMKCTDL-UHFFFAOYSA-N	441.444	1.693	50	20	IDGD	
N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCCC12CN(C(=O)c1cc(O)ncn1)C2	1845870380	IFOTYDDHHHLCBQ-MKMNVTDBSA-N	425.395	1.885	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)c1ccc(C(F)(F)F)cc1)C2	1846385570	USUMSYOBIPDXQD-UHFFFAOYSA-N	426.439	1.895	50	20	IDGD	
CC(C)Oc1ccc(C(=O)N2CC3(CCCN3C(=O)CCC(=O)NN(C)C)C2)c(F)c1	1846385657	FJJOHGULHAOJJY-UHFFFAOYSA-N	434.512	1.803	50	20	IDGD	
O=C1COc2ccc(S(=O)(=O)NNC(=O)c3ccc(COc4ccccc4)o3)cc2N1	24260902	VZWDITDFKBTGKJ-UHFFFAOYSA-N	443.437	1.813	50	20	IDGD	
CC(=O)N1c2ccc(S(=O)(=O)NNC(=O)c3cc(Br)c[nH]3)cc2C[C@@H]1C	28680648	TWIBIHIMEMEYCI-VIFPVBQESA-N	441.307	1.698	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)c1n[nH]c(-c2ccccc2)c1Br	725740098	BXOXUSNFIXNQNE-UHFFFAOYSA-N	432.234	1.623	50	20	IDGD	
CCC[C@H](NC(=O)NNC(=O)CNC(=O)c1ccco1)C(=O)N1CCc2sccc2C1	727230524	XRKCFODJBLRNGG-AWEZNQCLSA-N	447.517	1.155	50	20	IDGD	
CN(CC(=O)NNC(=O)c1c(Cl)cccc1Cl)C1=NS(=O)(=O)c2ccccc21	727793527	OBDQAMCYQSEOHM-UHFFFAOYSA-N	441.296	1.835	50	20	IDGD	
CCNS(=O)(=O)c1ccc(C(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)cc1	728974140	GIKTVTCKVOYIKK-UHFFFAOYSA-N	433.458	1.738	50	20	IDGD	
COc1cc(Br)cc(C=NNC(=O)CSc2nnc(O)nc2O)c1O	730558315	IDPAHVRJYLBOAY-UHFFFAOYSA-N	430.240	1.002	50	20	IDGD	
O=C(CC[C@H]1NC(=O)N(c2ccc(Cl)cc2)C1=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	730769092	XEVUXTNBGBRUAT-OAHLLOKOSA-N	445.819	1.914	50	20	IDGD	
COc1ccccc1C(=O)NNC(=O)c1ccc(S(=O)(=O)N2C[C@@H](C)O[C@H](C)C2)cc1	731491078	JZKADXLMKRVLKL-HUUCEWRRSA-N	447.513	1.568	50	20	IDGD	
CCOc1ccc(C(=O)NNS(=O)(=O)c2cc(C(=O)OC)c(F)cc2F)cc1OC	732046043	QHOOJSCEZCJNHI-UHFFFAOYSA-N	444.412	1.782	50	20	IDGD	
O=C(NNc1nc(-c2ccncc2)no1)c1c(F)ccc(S(=O)(=O)NC2CC2)c1F	732065395	DQPBCQPTGFRPPN-UHFFFAOYSA-N	436.400	1.607	50	20	IDGD	
O=C(NNC(=O)c1ccc(F)cc1Br)N[C@H]1CCN(CC(F)(F)F)C1=O	732590925	XGMAIAGCAHXWES-JTQLQIEISA-N	441.179	1.695	50	20	IDGD	
CC(C)(C)NS(=O)(=O)c1ccccc1NNC(=O)CN1C(=O)[C@@H]2CCCC[C@H]2C1=O	734251112	ZIDLWKRVQNINOK-ZIAGYGMSSA-N	436.534	1.382	50	20	IDGD	
O=C(NCCn1cccn1)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1	734279553	WKOABJPMFSYFSI-UHFFFAOYSA-N	431.460	1.229	50	20	IDGD	
Cc1ccc(NC(=O)NNC(=S)NCc2ccc(S(N)(=O)=O)cc2)c(Cl)c1	741857064	WYQAOLCSWHIINE-UHFFFAOYSA-N	427.939	1.997	50	20	IDGD	
CNS(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2cccc(C(F)(F)F)c2)c1	742458098	SNDMHMLSWNFNCH-UHFFFAOYSA-N	430.408	1.758	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNS(=O)(=O)c1ccc(F)c(Br)c1	743257079	ZYANPDKQXDWZGR-UHFFFAOYSA-N	436.284	1.389	50	20	IDGD	
CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H]2C[C@]23CCCc2ccccc23)c1	743283755	FIVLKVYYYMJFRY-KNQAVFIVSA-N	427.526	1.992	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCN(c3ccccn3)CC2)cc1Br	743381166	YXLNZBJBKFDLPN-UHFFFAOYSA-N	448.321	1.436	50	20	IDGD	
CCCNC(=O)CN1CCC(NC(=O)NNC(=O)c2cccc(Br)c2)CC1	743536992	XFNRQTAPQBMORP-UHFFFAOYSA-N	440.342	1.384	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)NCC[S@@](=O)Cc2ccccc2)cc1	743618934	UGRFRGHHMVNNAB-MUUNZHRXSA-N	438.531	1.375	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)Cn2nc(-c3ccccc3)ccc2=O)cc1	743829632	YSTYIMBZZNZQLV-UHFFFAOYSA-N	441.469	1.167	50	20	IDGD	
COc1cc(OC)c(NC(=O)NNC(=O)c2ccc(F)c(S(N)(=O)=O)c2)cc1Cl	743834149	SOBNAVUXLZDDJR-UHFFFAOYSA-N	446.844	1.610	50	20	IDGD	
Cc1csc(CC(=O)NNC(=O)COC(=O)C[C@](O)(c2ccc(C)o2)C(F)(F)F)n1	744660396	UCTKUDNGBYHWJB-INIZCTEOSA-N	449.407	1.426	50	20	IDGD	
CC(C)CC(=O)N[C@H](C(=O)OCC(=O)NNC(=O)c1ccc(C#N)cc1)c1ccccc1	744937008	SONFFCXXWHYDCR-NRFANRHFSA-N	436.468	1.766	50	20	IDGD	
C[C@@H]1Cc2ccccc2N1CCNC(=O)NNC(=O)Nc1ccc(S(C)(=O)=O)cc1	745785313	KJTDSGFFAOPFOM-CQSZACIVSA-N	431.518	1.877	50	20	IDGD	
COc1cc(C(=O)NNC(=O)N[C@@H]2C[C@@H](C)N(c3cnn(C)c3)C2=O)ccc1OC(C)C	745916138	BACARLQJOCWSGE-CZUORRHYSA-N	444.492	1.354	50	20	IDGD	
Cc1nc(C(C)(C)C)nc(O)c1C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	747414169	YRWMUKCQEPVGPQ-UHFFFAOYSA-N	449.533	1.566	50	20	IDGD	
CNC(=O)CC1CCN(C(=O)NNC(=O)c2ccc(OC)c(Br)c2)CC1	747502612	VJYKBUBMKSGBFH-UHFFFAOYSA-N	427.299	1.660	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)c2cccc(CN3C(=O)CNC3=O)c2)o1	747715479	ISWJCHOVLGNKAU-UHFFFAOYSA-N	427.461	1.248	50	20	IDGD	
CN(C)c1cccc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1	748464640	BMJCXMPZUHZRHR-UHFFFAOYSA-N	445.545	1.681	50	20	IDGD	
Cc1cccc(CCNC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1	749184883	CWVGTGQATKBSFJ-UHFFFAOYSA-N	430.530	1.966	50	20	IDGD	
CN(C[C@H](O)CN1CCOCC1)C(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccccc1	751431845	RZZJWJCQNSAIBO-FGGAIWKESA-N	448.527	1.522	50	20	IDGD	
CCOC(=O)[C@@H]1Cc2cc(S(=O)(=O)NNC(=O)c3ccc(Cl)cc3F)ccc2O1	751548716	KSFWZLAVDPVYBS-INIZCTEOSA-N	442.852	1.969	50	20	IDGD	
Cc1ccc(C(=O)NNS(=O)(=O)c2cc3c(cc2Br)n(C)c(=O)n3C)o1	753085959	NYWAUMUTAODVKW-UHFFFAOYSA-N	443.279	1.164	50	20	IDGD	
C#CCOCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccc(C)cc2C)c1	753385917	YHLOMSJTBQEJQM-UHFFFAOYSA-N	444.513	1.698	50	20	IDGD	
CCc1cccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c1	755402264	ZCMFJNHXPCONJQ-UHFFFAOYSA-N	432.502	1.736	50	20	IDGD	
COC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(NC(=O)NNC(=O)CC(C)C)cc2)C1	755557402	IVWIFHAKGMGEHJ-CQSZACIVSA-N	440.522	1.459	50	20	IDGD	
C[C@@H]1CCc2sc(C(=O)NNC(=O)Nc3cnn(CCN4CCOCC4)c3)cc2C1	756826184	BHZGYJRVSNXMNN-CQSZACIVSA-N	432.550	1.868	50	20	IDGD	
Cc1nc2ccccc2c(-c2ccccc2)c1CC(=O)NNC(=O)[C@H](C)NS(C)(=O)=O	758036625	SUJFVHFYXULNKO-HNNXBMFYSA-N	440.525	1.838	50	20	IDGD	
COc1ccc([N+](=O)[O-])c(C(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)c1	758787750	VOBSFXUKOJOTEO-UHFFFAOYSA-N	437.453	1.853	50	20	IDGD	
C[C@@H]1CCCN(c2ccc(C(=O)NNC(=O)C(=O)Nc3ccccn3)cc2[N+](=O)[O-])C1	758840488	IQOHVUHIPDUTGM-CYBMUJFWSA-N	426.433	1.626	50	20	IDGD	
N#CCCn1ncc(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c1-c1ccccc1	760068155	JKBLYLBXOCBSFP-UHFFFAOYSA-N	427.428	1.514	50	20	IDGD	
O=C(NNC(=O)c1cc(Cl)ccc1O)C(=O)Nc1ccnn1Cc1ccc(F)cc1	760277574	NLUCGFMDOHSBJA-UHFFFAOYSA-N	431.811	1.829	50	20	IDGD	
CN(NC(=O)c1cc(Br)nn1C)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	760506304	ULOYVUWZGXCELT-UHFFFAOYSA-N	445.318	1.432	50	20	IDGD	
COc1ccc2c(C)c(CCC(=O)NNc3nccc(N4CCOCC4)n3)c(=O)oc2c1	762864696	DRFKGLWUMWCELH-UHFFFAOYSA-N	439.472	1.813	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccccc2-n2c(C)cnc2O)cc1	763660510	AOZYXFKSCCTKTH-UHFFFAOYSA-N	439.428	1.060	50	20	IDGD	
COC(=O)N(C)Cc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C)c(C)c2)cc1	763679742	KWOUGQRGMCCMIG-UHFFFAOYSA-N	442.472	1.667	50	20	IDGD	
CCn1nc(C(=O)NNC(=O)C(=O)Nc2ccc(F)c(F)c2F)c2ccccc2c1=O	763787098	VRMMMUHTVOHLNE-UHFFFAOYSA-N	433.346	1.233	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)C(C)C)c(C(=O)N2[C@@H](C)CCC[C@H]2C)cc1OC	763820111	GFKICBRRLQNQJZ-OKILXGFUSA-N	448.520	1.849	50	20	IDGD	
Cc1ccc(N2CCOC2=O)cc1NC(=O)C(=O)NNC(=O)COc1ccc(F)cc1	763842379	ZQRYMGANCCELFW-UHFFFAOYSA-N	430.392	1.256	50	20	IDGD	
C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)C(=O)Nc1cnn(Cc2ccccc2)c1	763866245	NWKIPXFVOABFAV-AWEZNQCLSA-N	425.420	1.624	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cccnc2OC(C)C)cc1	763878422	QIJDVGQTPXMOQM-CQSZACIVSA-N	428.445	1.625	50	20	IDGD	
CN(C)CCOc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccc(F)cc2)cc1Cl	763919683	XDESUXOWXUUOHX-UHFFFAOYSA-N	436.871	1.748	50	20	IDGD	
CCOC(=O)c1ccc(NC(=O)C(=O)NNC(=O)C2=S=C3CC[C@H](C)CC3=C2)cc1	763938377	DQYCTRDIDKZYBS-LBPRGKRZSA-N	429.498	1.787	50	20	IDGD	
Cc1ccccc1C(=O)NNC(=O)C(=O)Nc1cccc(CN2CCC(C(N)=O)CC2)c1	763958147	QBBOTLGIIQIWAC-UHFFFAOYSA-N	437.500	1.092	50	20	IDGD	
Cc1cccc(C)c1Oc1ccccc1NC(=O)C(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1	764002461	MNBFYUZBTVYXKL-OAHLLOKOSA-N	445.497	1.616	50	20	IDGD	
CC(C)c1cc(Br)ccc1NC(=O)C(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1	764003151	ZXOIDJURYOPIKM-SNVBAGLBSA-N	446.323	1.093	50	20	IDGD	
COCCOc1ccc(C#N)cc1NC(=O)C(=O)NNC(=O)c1cc(-c2ccccc2)on1	764016040	CPZSOAITRPPXFT-UHFFFAOYSA-N	449.423	1.638	50	20	IDGD	
CCCNC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cccc(Br)c2)cc1	764059794	ZMBXYDHBSBXTOD-UHFFFAOYSA-N	447.289	1.989	50	20	IDGD	
CCCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(C)cc2O)cc1	764109975	NJYYKMUPMSDYLL-UHFFFAOYSA-N	434.474	1.252	50	20	IDGD	
CC(C)(C)CC(=O)NNC(=O)C(=O)Nc1ccc(Br)cc1S(C)(=O)=O	764199663	RBWUPFFMDXVNLJ-UHFFFAOYSA-N	434.312	1.375	50	20	IDGD	
COc1ccc(Cn2ncc(C)c2NC(=O)C(=O)NNC(=O)CCC(C)C)cc1OC	764202492	CYKCEVQDMZVQCY-UHFFFAOYSA-N	431.493	1.779	50	20	IDGD	
CNC(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)Cn2ccc3ccccc32)c1	764242070	AHAXUDPPTZJZOU-UHFFFAOYSA-N	427.848	1.440	50	20	IDGD	
O=C(NNC(=O)c1cccc(OC(F)F)c1)C(=O)Nc1ccc(C(=O)NC2CC2)cc1	764259050	BOHKSENOTYAOSQ-UHFFFAOYSA-N	432.383	1.580	50	20	IDGD	
CN(C(=O)c1ccccc1NC(=O)C(=O)NNC(=O)Cc1cccnc1)C1CCCCC1	764267326	TUVHNOQPJFCBML-UHFFFAOYSA-N	437.500	1.815	50	20	IDGD	
CCOCC(=O)NNC(=O)C(=O)Nc1ccc(=O)n(Cc2ccc(Cl)c(Cl)c2)c1	764318530	WPSZIYPJUAUYOS-UHFFFAOYSA-N	441.271	1.326	50	20	IDGD	
CS(=O)(=O)c1ccc(Cl)c(NC(=O)C(=O)NNC(=O)Cc2ccccc2F)c1	764318554	BIWQALSMXPGTMT-UHFFFAOYSA-N	427.841	1.211	50	20	IDGD	
CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)NNC(=O)CNC(=O)c2cccnc2)CC1	764345790	VZUQFVVDACGNAZ-UHFFFAOYSA-N	440.460	1.417	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)C(=O)Nc1ccnn1Cc1ccc(C(F)(F)F)cc1	764354498	UMGYFFZICOTVOB-UHFFFAOYSA-N	446.389	1.674	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)C[C@H](NC(N)=O)c2cccc(C)c2)n[nH]1	765592190	JGXSMBFTCKGRKY-INIZCTEOSA-N	436.472	1.954	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3ccc(CNC(N)=O)cc3)n[nH]2)cc1OC	765597523	IITJAZKOZYPBGA-UHFFFAOYSA-N	438.444	1.337	50	20	IDGD	
COc1cccc(C(=O)NNC(=O)CN2CCN(Cc3ccccc3Cl)CC2)c1OC	765757336	RPJNKWUGBBPJNA-UHFFFAOYSA-N	446.935	1.936	50	20	IDGD	
CC(=O)Nc1c(C)cccc1C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	766645213	ZGIHVSIEHXGKSV-UHFFFAOYSA-N	437.500	1.172	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)[C@H](c1ccccc1)n1cccn1	766647870	WYGKAYRZLSIDPG-QFIPXVFZSA-N	446.511	1.078	50	20	IDGD	
O=C(CN1CCN(C(=O)c2ccccc2)CC1)NNC(=O)c1ccc(Cn2ccnc2)cc1	766654712	VWDGGWVXOSRDBM-UHFFFAOYSA-N	446.511	1.150	50	20	IDGD	
CCC1(CC)[C@@H](OC)C[C@H]1NC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1	767162445	UZXBJYHVRIWKKU-SJORKVTESA-N	440.566	1.540	50	20	IDGD	
COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)O[C@H]2CCCNC2=O)cc1	767268588	QVYOIUYHZSZDIX-OTMARIDSSA-N	437.456	1.163	50	20	IDGD	
COc1ccccc1NC(=O)COc1ccc(C(=O)NNC(=O)C(C)(C)O)cc1OC	768245703	DSDIDGNWJDBNMD-UHFFFAOYSA-N	431.445	1.253	50	20	IDGD	
C#Cc1cccc(NC(=S)NNC(=O)CN2C(=O)N[C@]3(CCCC(C)(C)C3)C2=O)c1	768570290	BTDIWCMXPWLJQP-NRFANRHFSA-N	427.530	1.876	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)CNC(=O)c1ccc(Br)o1	768738057	XXXVCVLDXVVZCV-UHFFFAOYSA-N	446.279	1.327	50	20	IDGD	
Cc1cc(/C=C(\C#N)C(=O)NNc2nc(O)c3cnn(C)c3n2)c(C)n1C[C@@H]1CCCO1	770990162	MCLVLCCQXMPVJV-AHQMPEJBSA-N	436.476	1.717	50	20	IDGD	
C[C@@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)CCNS(=O)(=O)c1ccc(F)cc1	772962781	DPOQOVNQPLPVKV-GFCCVEGCSA-N	443.884	1.762	50	20	IDGD	
COC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2ccc(C)c(F)c2)cc1C(=O)OC	773890118	XNRQKKKPUHPQFA-UHFFFAOYSA-N	431.376	1.107	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN[C@@H](C)c1ccc2c(c1)CC(=O)N2C	775350631	JAMXCKRRPUIAFK-LBPRGKRZSA-N	430.892	1.979	50	20	IDGD	
O=C(COC(=O)c1cnn(-c2cccc(Cl)c2)n1)NNC(=O)c1cccc([N+](=O)[O-])c1	777206479	LPXOYYSEWCHJKY-UHFFFAOYSA-N	444.791	1.447	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)CS(=O)(=O)c2ccc(C(C)=O)c(F)c2)nc1C	778421403	LRXGZFMBEYNLBY-UHFFFAOYSA-N	438.437	1.220	50	20	IDGD	
C[C@@H](NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)[C@H]1CCN(Cc2ccccc2)C1	778588880	MHKVCPJMMATUMN-APWZRJJASA-N	434.504	1.517	50	20	IDGD	
C[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1NC(=O)NNC(=O)c1cc([N+](=O)[O-])ccc1O	779704496	LREZQZDMZJZMCH-BXUZGUMPSA-N	437.453	1.890	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC[C@@H]1CCNC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	780639923	OTJARIDVZGXGLU-OAHLLOKOSA-N	444.496	1.396	50	20	IDGD	
CC(=O)N1CCN(c2cccc(NC(=O)NNC(=O)[C@@H]3COc4ccccc4O3)c2)CC1	782081045	YGTAYUYLNJQXHY-FQEVSTJZSA-N	439.472	1.348	50	20	IDGD	
COC(=O)c1cc2cc(NC(=O)C(=O)NNC(=O)Cc3nc4ccccc4n3C)ccc2o1	782888877	WYMDNRATDKEAJW-UHFFFAOYSA-N	449.423	1.435	50	20	IDGD	
COCCn1nc(C)c(NC(=O)C(=O)NNC(=O)c2ccc(Cl)cc2Cl)c1C	782927356	OQUFNFQXBAYWOY-UHFFFAOYSA-N	428.276	1.853	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)C(=O)Nc2ccc(C(F)(F)F)nc2)nc1	783263114	HRZCEHKNRPMWIQ-UHFFFAOYSA-N	446.411	1.264	50	20	IDGD	
CC(C)CCn1ccc(NC(=O)C(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)n1	783263759	KXYXUVVXKSSSLN-UHFFFAOYSA-N	437.526	1.093	50	20	IDGD	
CC(C)N1C(=O)C[C@@H](NC(=O)NNC(=O)C(=O)NC2CC2)[C@@H]1c1ccc(Cl)c(F)c1	783320023	JCVKDIMSYQSDKE-ZBFHGGJFSA-N	439.875	1.139	50	20	IDGD	
CNS(=O)(=O)c1ccc(C)c(NC(=O)C(=O)NN=c2sc3ccccc3n2C)c1	783349793	QMYYTNBCSFRTQA-UHFFFAOYSA-N	433.515	1.027	50	20	IDGD	
CC(C)Oc1ccc(NC(=O)C(=O)NNC(=O)CNC(=O)c2cccs2)cc1Cl	784004195	BWIXQRIBUDYWRR-UHFFFAOYSA-N	438.893	1.705	50	20	IDGD	
Cn1c(CC(=O)NNC(=O)c2cc3c(=O)n4ccccc4nc3n2C)nc2ccccc21	784295724	UFQNZSPYRPMWPJ-UHFFFAOYSA-N	429.440	1.077	50	20	IDGD	
COC(=O)c1cccc(NNC(=O)C(=O)Nc2cccc(C(=O)NCc3ccccn3)c2)c1	784851001	DTBKGWSGROIRCZ-UHFFFAOYSA-N	447.451	1.880	50	20	IDGD	
CNC(=O)c1ccc(NC(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)cc1	785835817	YDEZQPFOXLDLJL-UHFFFAOYSA-N	434.497	1.687	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NCCc2ccccc2OC(F)F)c2ccccc2c1=O	788316984	ATFHTFHPSVJPAO-UHFFFAOYSA-N	431.399	1.722	50	20	IDGD	
COc1ccccc1OCC(=O)NNC(=O)C(=O)Nc1cccc2c1OCC[C@H]2N(C)C	789733212	ZATORNQUIYAAMV-MRXNPFEDSA-N	442.472	1.245	50	20	IDGD	
COc1cc(NNC(=O)[C@H](NS(=O)(=O)c2ccc(C)cc2)[C@@H](C)O)ccc1Cl	790179476	RHNSFDKFGYJAKX-SJKOYZFVSA-N	427.910	1.828	50	20	IDGD	
O=C(NNc1nc2ccccn2n1)c1cc(S(=O)(=O)NCc2ccccc2)ccc1O	791243179	NZTHRCXNGPJNDC-UHFFFAOYSA-N	438.469	1.670	50	20	IDGD	
CN(C)S(=O)(=O)c1cc(C(=O)NNc2nc3ccccn3n2)ccc1Br	791253301	SSBZOBSZIPSDND-UHFFFAOYSA-N	439.295	1.499	50	20	IDGD	
COc1cc(OC2CC2)ccc1C(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	791615595	PJZZYHWFJRDGGT-UHFFFAOYSA-N	429.385	1.763	50	20	IDGD	
COc1cccc(C2=NO[C@H](C(=O)NNc3ccc(S(=O)(=O)NC4CC4)cc3)C2)c1	792125726	WFLBOVMOZLATLH-IBGZPJMESA-N	430.486	1.772	50	20	IDGD	
CCCCn1ncc(NC(=O)C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1C(C)C	792268954	QOMYESXJPLRJSV-KRWDZBQOSA-N	429.477	1.733	50	20	IDGD	
CC[C@H](C)CC[C@H](O)CC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	792774054	MOMGWRHTZITSJT-RDJZCZTQSA-N	425.551	1.809	50	20	IDGD	
C[C@@H](C(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)[C@H]1OCCc2sccc21	796509271	UFDNTVQSCDIDMQ-PIGZYNQJSA-N	433.442	1.911	50	20	IDGD	
CC(=O)N[C@](C)(C(=O)NNC(=O)CCc1ccccc1)c1ccc(S(C)(=O)=O)cc1	797442476	FGGWISWDUFAQCA-NRFANRHFSA-N	431.514	1.222	50	20	IDGD	
COC(=O)c1cccc(NC(=O)C(=O)NNC(=O)COc2ccc(C)cc2)c1OC(C)C	799259133	UFOOSNQCEUXYRC-UHFFFAOYSA-N	443.456	1.734	50	20	IDGD	
CN(C)c1ncn(-c2cccc(NC(=O)NNC(=O)c3nn(-c4ccccc4)cc3O)c2)n1	799418953	IUFUHWVXVRZNBA-UHFFFAOYSA-N	447.459	1.691	50	20	IDGD	
CC[C@](O)(C(=O)OCC(=O)NNC(=O)Cc1nc(C)cs1)c1cccc(Cl)c1	800322145	PDQJPVRLZQCDAW-GOSISDBHSA-N	425.894	1.636	50	20	IDGD	
CC(C)[C@@H](NC(=O)c1ccc(Cl)s1)C(=O)NNC(=O)CNC(=O)c1cccnc1	801164792	BMAGWNHDXLYRGX-OAHLLOKOSA-N	437.909	1.128	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)c(C)c1OC	804458247	JURMQTAHYDBMEG-UHFFFAOYSA-N	440.544	1.899	50	20	IDGD	
COc1ccc(-c2cc(C(=O)NNC(=O)c3cnc(C4OCCO4)s3)n[nH]2)cc1OC	807085819	ZPMGQJZKVGUNEF-UHFFFAOYSA-N	445.457	1.671	50	20	IDGD	
CCN(C)C(=O)c1cccc(S(=O)(=O)NNC(=O)c2cc(Br)c[nH]2)c1	808070977	HYSAEUNRYSPWFL-UHFFFAOYSA-N	429.296	1.492	50	20	IDGD	
C/C(=C\c1ccc(C)cc1)C(=O)NNc1ncccc1S(=O)(=O)N1CCN(C)CC1	810414386	RWKLNTLTKPLSKZ-BMRADRMJSA-N	429.546	1.873	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)N[C@H]1c2ccccc2CC12CCOCC2	811851622	LKPNVEWEFXJZRE-IBGZPJMESA-N	433.472	1.701	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(N(C(C)=O)C3CC3)cc2)c(OC)c1	815569481	VYLMJMKNPZYYLR-UHFFFAOYSA-N	440.456	1.619	50	20	IDGD	
COc1cc(C)c(NC(=O)C(=O)NNc2ccccc2S(=O)(=O)N(C)C)cc1OC	815751577	FNSXZVSXVMGJJI-UHFFFAOYSA-N	436.490	1.344	50	20	IDGD	
Cc1cc(NC(=O)C(=O)NNc2ncncc2F)n(-c2cccc(Br)c2)n1	815763974	LDXIHRXKEJFPHU-UHFFFAOYSA-N	434.229	1.954	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCCO1)C(=O)Nc1ccnn1Cc1ccc(C(F)(F)F)cc1	815778476	SRUINKJOPAYHOV-CYBMUJFWSA-N	425.367	1.215	50	20	IDGD	
COc1cc(C(=O)NNC(=O)[C@@H](O)[C@H](O)c2nc3ccccc3s2)cc(OC)c1OC	825457258	QQXABQCJUVHILM-HOTGVXAUSA-N	447.469	1.178	50	20	IDGD	
CC(=NNC(=O)CN1c2cccc3cccc(c23)S1(=O)=O)c1c(C)nc(O)nc1O	839402251	HLONEPMLRQGQGQ-UHFFFAOYSA-N	427.442	1.399	50	20	IDGD	
CCn1c(NNC(=O)C2CCN(c3ccc4nncn4n3)CC2)nc2ccccc2c1=O	912952787	CLAXQOOBOHKWKO-UHFFFAOYSA-N	433.476	1.214	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCC(=O)NNC(=O)CCSc2ccc(F)cc2)cc1	913035329	WNCCHCFLZQOSTD-UHFFFAOYSA-N	425.507	1.742	50	20	IDGD	
Cc1ccc(NCC(=O)NNC(=O)CN2C(=O)N[C@@]3(C[C@H](C)CC(C)(C)C3)C2=O)c(C)c1	913164891	XKMPIRLBVJBPAD-IQMFZBJNSA-N	443.548	2.000	50	20	IDGD	
O=C(COc1cccc(NC(=O)c2ccco2)c1)NNC(=O)[C@H]1COc2ccccc2O1	914747676	DAOBBWXTPNFASY-LJQANCHMSA-N	437.408	1.898	50	20	IDGD	
Cc1nn(C)c2[nH]c(=O)c(CCC(=O)NNC(=O)c3nn(-c4ccccc4)cc3O)c(C)c12	914857712	UNIWYNOPBALVQB-UHFFFAOYSA-N	449.471	1.164	50	20	IDGD	
O=C(COCCOc1ccccc1)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	915357469	MXIAXSVQVBUWOI-UHFFFAOYSA-N	447.513	1.328	50	20	IDGD	
Cc1oc(C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)cc1S(=O)(=O)N1CCCC1	915813944	OIBSWCSLZWRHJS-CYBMUJFWSA-N	439.465	1.740	50	20	IDGD	
Cn1nc(C(=O)NNC(=O)NC[C@H](c2cccs2)N2CCCC2)c2ccccc2c1=O	915901800	LHTPTVGKXCHEKA-MRXNPFEDSA-N	440.529	1.776	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)NCCCOc1ccccc1	916219022	HYNAYGDHFLMXHX-UHFFFAOYSA-N	425.533	1.998	50	20	IDGD	
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)NCc2ccc(S(C)(=O)=O)cc2)cc1	916568187	NYLKUWRQSGOXGH-CQSZACIVSA-N	435.502	1.787	50	20	IDGD	
O=C(Cc1ccc2ccccc2c1)NNC(=O)C1CCN(c2ccc3nnnn3n2)CC1	917197459	ANTUPWLRUGSHAD-UHFFFAOYSA-N	430.472	1.279	50	20	IDGD	
Cc1ccc2nc(CNC(=O)NNC(=O)c3sc(N4CCOCC4)nc3C)cn2c1	918129710	RSZBFNVOZDEOPJ-UHFFFAOYSA-N	429.506	1.388	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)CCNS(=O)(=O)c2ccc(C)c(C)c2)cc1	919835660	NSGVTTMAECXWKW-UHFFFAOYSA-N	433.530	1.761	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)NCc2ccc(CN3CCN(C)CC3)cc2)cc1	919903086	MUXTYPQNFXXKOS-UHFFFAOYSA-N	439.560	1.906	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@@H]2CCc3cc(F)ccc32)cc1	919919488	FMSGTAYTZJKKQZ-GOSISDBHSA-N	434.493	1.773	50	20	IDGD	
COc1ccc(CC(=O)O)cc1S(=O)(=O)NNC(=O)c1cc(Br)c[nH]1	919955957	OZICPCUIQRWWFB-UHFFFAOYSA-N	432.252	1.036	50	20	IDGD	
CC(C)NS(=O)(=O)c1ccc(NNC(=O)N[C@@H](CC(=O)N(C)C)c2ccccc2)nc1	920046400	JFIBYUQLJKYVSL-KRWDZBQOSA-N	448.549	1.614	50	20	IDGD	
O=C(NC[C@@H]1CCN(c2ccc(Cl)cc2)C1)NNC(=O)c1ccc(-n2cnnn2)cc1	921244746	NZTOCKJLDZDHCQ-AWEZNQCLSA-N	440.895	1.786	50	20	IDGD	
O=C(CC1(CC(=O)N2CCOCC2)CCCC1)NNC(=O)[C@@H]1COc2ccccc2O1	1248521213	FFIZUAFCLIWSBS-SFHVURJKSA-N	431.489	1.173	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CS(=O)(=O)c2cccc(Br)c2)cc1	1248688153	KXZZBOWWBAFQQW-UHFFFAOYSA-N	427.276	1.693	50	20	IDGD	
O=C(Cc1cn2ccccc2n1)NNC(=O)c1cn(-c2ccc(Br)cc2)nn1	1252429848	HSSSUNYKBSVFPZ-UHFFFAOYSA-N	440.261	1.681	50	20	IDGD	
CC(C)(C)c1ccc(NNC(=O)NCCC(=O)N2CCN(c3ccccn3)CC2)nn1	1318588016	OOCQEYNXQSKQBM-UHFFFAOYSA-N	426.525	1.534	50	20	IDGD	
O=C1CCC(=O)N(c2ccc(C(=O)NNC(=O)c3ccc(Br)cc3)cc2)N1	1319968221	HVJPWMANCCSMAK-UHFFFAOYSA-N	431.246	1.682	50	20	IDGD	
C=C1c2ccccc2C(=O)N1[C@@H](C)C(=O)OCC(=O)NNC(=O)Cc1nc(C)cs1	1322067668	LPYMFWKWWRNELW-ZDUSSCGKSA-N	428.470	1.200	50	20	IDGD	
O=C(Cc1ccc(S(=O)(=O)CCO)cc1)NNC(=O)Nc1ccc(OC(F)F)cc1	1322745542	AHPADGWFBZJPBO-UHFFFAOYSA-N	443.428	1.449	50	20	IDGD	
CS(=O)(=O)c1cc(S(=O)(=O)NNC(=O)c2n[nH]c3c2CCCC3)c(Cl)s1	1337083113	SWMOWCNZGQNFDN-UHFFFAOYSA-N	438.940	1.030	50	20	IDGD	
Cc1nccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](F)Br)C3)n1	1778309854	QFNNXHLYZZGJME-JKIFEVAISA-N	429.290	1.603	50	20	IDGD	
C[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1C(=O)N1CC[C@@]2(CN(C(=O)[C@@H](F)Cl)CCO2)C1	1778348823	HHBFVKWTEYDAIQ-CJXDPKRBSA-N	447.935	1.854	50	20	IDGD	
C[C@H](C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2)n1ccccc1=O	1779266536	AEMVAYFKMGWVTA-CCKFTAQKSA-N	430.332	1.476	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@@]2(C1)CN(C(=O)CS[C@H]1CCCCO1)CCO2	1779296830	HKGKOMZXTBUYAH-RBUKOAKNSA-N	430.643	1.928	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)cc1OC	1779300671	UJELOHFIUVSOOM-NRFANRHFSA-N	436.581	1.999	50	20	IDGD	
O=C(COc1cc(Cl)ccn1)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2	1779500217	PXKCSAOPDSRAHB-QMTMVMCOSA-N	446.331	1.227	50	20	IDGD	
C[Si](C)(C)OCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc([N+](=O)[O-])[nH]1)C2	1779546731	FGZPHKLZXWTYDQ-DNVCBOLYSA-N	438.557	1.902	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnn(Cc4ccccc4)c3)C2)C1	1779599161	IHKINTZIZUVDSY-KNQAVFIVSA-N	446.935	1.629	50	20	IDGD	
Cc1cc(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](F)Br)C2)nn1C	1780770225	IRLOJHIWHRZOBV-UWWQBHOKSA-N	445.333	1.475	50	20	IDGD	
CN1CCC(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](F)Br)C2)CC1	1780770681	VSKFBXWGTANNKN-HHXXYDBFSA-N	448.377	1.923	50	20	IDGD	
O=C(c1ccc2ncncc2c1)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781332351	XQIMPSISAODGOI-YJBOKZPZSA-N	437.269	1.764	50	20	IDGD	
O=C(c1ccn2ccnc2c1)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1	1781332515	ZYZIWXGLBMDVRJ-WMLDXEAASA-N	425.258	1.468	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3c4c(nn3C)CCC4)C2)C1	1782440429	AZNUUMBKLWVHKI-XIKOKIGWSA-N	425.327	1.136	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H]3CC(c4ccccc4)=NN3)C2)C1	1782601673	BLPMJVKSGAFVDC-JLMWRMLUSA-N	432.952	1.990	50	20	IDGD	
CN(C)[C@H](C(=O)N1CC[C@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1)c1ccc(Cl)cc1	1782820623	MQYYQSFFUDNDKH-FUHIMQAGSA-N	444.359	1.372	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2	1783130748	FQUGUYMRPRARPE-YRISNDGFSA-N	435.908	1.051	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)/C=C/c3cc(F)cc(OC)c3)C2)C1	1783695153	SJSBSHVWTMWPLE-ZUNDHMPPSA-N	440.899	1.931	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H]3CCc4ccccc4O3)C2)C1	1783848411	LQOMJOBVFWPZDR-JNAXZKDPSA-N	437.334	1.994	50	20	IDGD	
CC(C)(C(=O)N1CC[C@]2(CN(C(=O)[C@@H](F)Br)CCO2)C1)c1ccccn1	1784276107	LTGBARCNNVIZDZ-KDOFPFPSSA-N	428.302	1.880	50	20	IDGD	
Cc1nc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Br)C[C@@H]32)c(C)s1	1785414115	IRSZVOYQZRNOSJ-LMRQPLJMSA-N	448.358	1.973	50	20	IDGD	
C[C@H](C(=O)NC1(c2ccc(NC(=O)[C@@H](O)CCl)cc2)CCC1)[C@@H]1SC(=N)NC1=O	1786132369	MFYILGLSBJGANO-BPNCWPANSA-N	438.937	1.523	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnn(C)c3C)[C@H]2C1	1786186189	GMISSQVIHDDXOV-HNKHHVNMSA-N	427.343	1.495	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccccc3C3CC3)C[C@@H]21)c1ccc(B(O)O)cc1	1786981834	AYXTWFZPROTLEN-TZYHBYERSA-N	448.328	1.151	50	20	IDGD	
CC(=O)N/C(=C\c1ccco1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]2C1	1787450400	XDXOUAPJLSJNIW-BGJNKCOOSA-N	427.860	1.271	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc4cccnn4n3)[C@H]2C1	1789143193	CIPJNNYKZBHHFM-ZVZYQTTQSA-N	431.569	1.174	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(-n4cccn4)cc3)[C@H]2C1	1790111462	VYBCUPDIXVCRKG-FFGOWVMKSA-N	446.935	1.719	50	20	IDGD	
COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccncc3C(F)(F)F)C[C@@H]21	1791254081	KSSUSGIPBOERQI-YUDUHTQSSA-N	449.857	1.948	50	20	IDGD	
O=C(NC1(c2ccc(NC(=O)[C@@H]3C[C@H]4CC[C@@H]3O4)cc2)CCC1)c1cccc(B(O)O)c1	1791455968	CLBZGILUIOVNGI-NJYVYQBISA-N	434.301	1.682	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(C2CC2)on1	1792709655	WTPXBUVGLLHYRY-ZWUHOBOKSA-N	426.311	1.929	50	20	IDGD	
COc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)CBr)s1	1792870430	OOFLIIUZKHDPHD-OHTBPHCPSA-N	431.352	1.991	50	20	IDGD	
C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2	1792873978	IGIVCPJDMBINED-HHKYUTTNSA-N	430.112	1.298	50	20	IDGD	
COc1ccc(Cl)cc1CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](O)CCl	1792984380	ZLGYMKIGAHMFTM-HRJSJKBJSA-N	431.316	1.080	50	20	IDGD	
CC(C)Cc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCBr)n(C)n1	1795112433	DVIZFWSQEIOCGF-ZSBFGKGUSA-N	441.370	1.607	50	20	IDGD	
Cc1ccccc1OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)Br)C2	1795303987	SGVPFRZTHFTGPJ-AFIMGQEJSA-N	425.323	1.747	50	20	IDGD	
COC(=O)C[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](F)Cl	1796809966	BPPCOEYJFMYWRI-KBRXKUPHSA-N	449.907	1.615	50	20	IDGD	
COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2cc(OC)ccc2n1	1797004211	YNGNWPUKBBQIJJ-MQJTVSLUSA-N	447.919	1.700	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1ccc(C(F)(F)F)[nH]1	1797989105	WTUDQMLIMLERNK-VVJJBPBLSA-N	442.207	1.927	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1COc3ccccc3O1)C2)[C@H](F)Br	1799344788	VROOMSMWYYPBDW-WZLNRYEVSA-N	443.269	1.107	50	20	IDGD	
CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3ncccn3n1)C2	1800641306	YDKBOGPKNASGJD-OQMKEHIESA-N	436.310	1.106	50	20	IDGD	
C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3ncncc3c1)C2	1800759116	IEVOJYRLCHBMFB-FIUQPQMISA-N	433.306	1.616	50	20	IDGD	
C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CCc2ccccc2O1	1800955020	NRMMFBJLHREVRF-IVFVNLKQSA-N	437.334	1.753	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]1c1cccnc1	1803148474	QGZPMCOEJZANSP-MIGQKNRLSA-N	427.885	1.249	50	20	IDGD	
Cn1nc(C(=O)N2CC[C@@H](CNC(=O)CCBr)[C@@H]2c2cccnc2)cc1O	1806338474	AIBVTOQROKIKRS-GUYCJALGSA-N	436.310	1.625	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)[C@@H](N)c2ccccn2)[C@@H]1c1cccnc1	1807166986	HNHQHEOEPQXLIR-DHXZDTOLSA-N	446.349	1.966	50	20	IDGD	
N[C@@H](Cc1cscn1)C(=O)NC[C@@H]1CCN(C(=O)C(Cl)Cl)[C@H]1c1cccnc1	1808209896	DXSWMDNNDPMQFV-QEJZJMRPSA-N	442.372	1.918	50	20	IDGD	
CC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)Cn2cc(C)c(O)nc2=O)[C@@H]1c1cccnc1	1808285723	SNOCZMHTKXJFDH-SOLBZPMBSA-N	447.923	1.376	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@@H]1CCN(C(=O)[C@H]2CNC(=O)C2)[C@H]1c1cccnc1	1808317795	KPSICLWJZZMDKC-MVWRLGRASA-N	427.332	1.460	50	20	IDGD	
Cc1cnc(C(=O)N2CCC3(CCCN(C(=O)c4ccc(B(O)O)cc4)C3)CC2)s1	1809967690	FKTKTXRGSDLHMR-UHFFFAOYSA-N	427.335	1.290	50	20	IDGD	
CCN(CC)C[C@@H](C)C(=O)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1	1809973307	GNONXPLHGRCLHW-LJQANCHMSA-N	443.397	1.189	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)[C@H](O)NC(=O)OCC)[C@H]1c1cccnc1	1810089504	JOFPTUBGMOPZJW-HPFXQQBRSA-N	440.928	1.559	50	20	IDGD	
CC1(C(=O)N2CC[C@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)CCC1	1810293750	GTEXMVRMINLXHP-VQIMIIECSA-N	436.516	1.590	50	20	IDGD	
CN[C@H](CC(=O)N1CC[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]1c1cccnc1)C(=O)O	1810541107	OUDBNAGYTOWMOG-FRQCXROJSA-N	436.585	1.002	50	20	IDGD	
CC(=O)N/C(C)=C/C(=O)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@@H]1c1cccnc1	1812320330	FQYOQHQNPVCVQV-NSOCIMAHSA-N	441.301	1.818	50	20	IDGD	
CC[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)[C@@H]2CNC(=O)O2)[C@H]1c1cccnc1	1812774532	XNZFJKIXKXSOTM-QPSCCSFWSA-N	439.310	1.369	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1	1813016916	IILYRIBFMKXYFZ-NTZUZEMLSA-N	449.935	1.443	50	20	IDGD	
Cc1ccc(C(=O)N2CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)cn1	1813069788	BWOZHIAHYPODNA-AVRDEDQJSA-N	438.532	1.478	50	20	IDGD	
CC(=O)C[C@H](C)C(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1	1813075244	YPYXXWBLMZFDOD-XERREHJYSA-N	431.537	1.076	50	20	IDGD	
COC(=O)NCC(=O)NC[C@@H]1CCN(C(=O)[C@@](C)(Cl)CCl)[C@H]1c1cccnc1	1813266392	IQDGHJHOYAZLIQ-YEWWUXTCSA-N	431.320	1.680	50	20	IDGD	
O=C(COC(=O)C(F)(F)F)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1	1819311483	AXRNCGLTKQYANV-ZJUUUORDSA-N	426.779	1.107	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@@H](F)Br)[nH]n1)c1cc(CO)on1	1820350451	JNKDDDPVJZLFLH-DGCLKSJQSA-N	430.234	1.886	50	20	IDGD	
CCNC(=O)N[C@H](C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](Cl)COC)n[nH]1	1822371073	RDANAKZWAZNXKD-DYEKYZERSA-N	428.921	1.363	50	20	IDGD	
COCC1(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1	1824483279	GRLJNOWTIAVPHH-IBGZPJMESA-N	443.548	1.345	50	20	IDGD	
C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc[n+]([O-])c1)CC2	1825637003	PITRPIINAJTKTM-ONGXEEELSA-N	425.308	1.786	50	20	IDGD	
CCOC(=O)O[C@H](C)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](Cl)COC)sc2C1	1826004377	HZNVPEGRBPWDTH-GMTAPVOTSA-N	433.914	1.871	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H]1CCCSC1)CC2	1826092035	JDXYEAZZBMISEU-OLZOCXBDSA-N	439.607	1.571	50	20	IDGD	
CSCC[C@H](O)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](F)Br)CC2	1826134308	ZKGGVHZGPDUCIV-OVYXKVPISA-N	440.360	1.860	50	20	IDGD	
CN[C@@H](CC(=O)N1CCC([C@@H]2CCCCN2C(=O)CCBr)CC1)C(=O)O	1826357595	BLAGWWQTUIRIPU-GJZGRUSLSA-N	432.359	1.454	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(C)c(Cl)c3)CCO2)C1	1830114845	KUBJIJKHOLIKCO-XLIONFOSSA-N	445.343	1.972	50	20	IDGD	
COc1ccc(OCC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)cc1	1830234958	AEWOHPYNPFACBK-HKUYNNGSSA-N	430.860	1.065	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C/N=C/c3ccco3)C2)C1	1830365403	XLSZMDLKTPCHOE-OJJSKHJLSA-N	425.913	1.420	50	20	IDGD	
Cc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)cn1	1830538099	VXILWQAHNONWQG-AUUYWEPGSA-N	440.338	1.491	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCBr)CC1	1831872128	PKXSVBSYJFUEGA-MRXNPFEDSA-N	445.402	1.764	50	20	IDGD	
O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2C[C@]2(F)Cl)CC1	1831959271	SFINUHIXZROCAE-BBTUJRGHSA-N	436.720	1.524	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)C2CCC(O)CC2)CC1	1832000869	GYOBBTJRDIHFBY-VTLFHKLASA-N	442.365	1.151	50	20	IDGD	
Cc1ccc2[nH]cc(CC(=O)N3CCO[C@]4(COCCN(C(=O)[C@H](O)CCl)C4)C3)c2c1	1832741325	QIOCVGBXLDLBJF-DENIHFKCSA-N	449.935	1.075	50	20	IDGD	
COc1cccc(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)n1	1832821008	LTGYOKNJYSNBNE-HKUYNNGSSA-N	429.876	1.014	50	20	IDGD	
C[C@@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)[C@H]3CCOC3)CC2)CC1	1833266256	XCFPMNFBJWYFTN-GJZGRUSLSA-N	430.387	1.626	50	20	IDGD	
COc1ncc(C(=O)N2CCO[C@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)cc1F	1833479545	QWJZXHUXQYYCGV-HXUWFJFHSA-N	443.903	1.564	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3cncs3)CCO2)C1	1834461259	VJYNEGZGJPHVNB-MLGOLLRUSA-N	432.340	1.244	50	20	IDGD	
Cc1noc(CC(=O)N2CCC(N3CCC(NC(=O)CO[Si](C)(C)C)CC3)CC2)n1	1835837577	OJMCXQNTRNHMDD-UHFFFAOYSA-N	437.617	1.344	50	20	IDGD	
C[C@H](Nc1ccccn1)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](F)Cl)CC2)CC1	1835847113	KNCVHZNJBMMLEJ-KBXCAEBGSA-N	425.936	1.988	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CC[C@@H](C)O1)CCO2	1836609371	OCBAZVYJJCDPOF-ATNYBXOESA-N	433.343	1.184	50	20	IDGD	
COCc1oncc1C(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836717571	FRZGIOUOMLQMEB-MRXNPFEDSA-N	429.901	1.033	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnc4[nH]ncc4c3)CCO2)C1	1836809231	XAPZGWVSEBLORO-FQEVSTJZSA-N	435.912	1.293	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)Cc3cscn3)CC2)CC1	1837945972	RALGQHGUPCOIBQ-KRWDZBQOSA-N	429.970	1.938	50	20	IDGD	
O=C([C@H](F)Cl)N1CCC(OC2CCN(C(=O)[C@@H]3CC[C@@H]4CCC(=O)N4C3)CC2)CC1	1838083869	CQFPGAFCVQCCFA-CLCXKQKWSA-N	443.947	1.920	50	20	IDGD	
COc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)cc1	1838967295	VWBDGBCPOYVJPN-MAUKXSAKSA-N	445.285	1.456	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(O)cn3)C2)C1	1839151124	IVNDYTNGKRNXFE-MSOLQXFVSA-N	432.304	1.094	50	20	IDGD	
Cc1ncc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)cn1	1839151364	PDMIHQOMVGGIAM-MSOLQXFVSA-N	431.320	1.091	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)/C=C/c3cnccn3)C2)C1	1839156404	OMAZQSFNPGGXQB-KTBRJVSMSA-N	443.331	1.183	50	20	IDGD	
C=CCC(CC=C)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2	1839199347	UQJGDQLVWMYMHD-YJBOKZPZSA-N	433.318	1.902	50	20	IDGD	
CC(C)c1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)on1	1839202072	UGXNGJJYDGZDJS-WMLDXEAASA-N	448.289	1.559	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3c(F)ccc(O)c3F)CCO2)C1	1839411798	KKQLKKLVGUEWQD-HXPMCKFVSA-N	432.851	1.758	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccnn3CC)C2)C1	1839963154	BICOKHCIYOZDQG-KDOFPFPSSA-N	443.342	1.147	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3(C#N)CCC3)C2)C1	1839967642	STJPNQXMKZXZFX-KSSFIOAISA-N	428.327	1.310	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)/C=C/c3ccccc3)C2)C1	1840032083	NJUNZLUEQXMUHC-IFABGAQTSA-N	437.334	1.940	50	20	IDGD	
CC[C@H](C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](Cl)COC)CCO2)c1ccccc1	1840151268	ZEEQSADZWBUSMW-JQVVWYNYSA-N	438.952	1.890	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)Oc1cccnc1)CCO2	1840453393	OWRQEECIINBNPH-RIFZZMRRSA-N	425.913	1.323	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)CCCn3cccc3)CCO2)C1	1840459417	GMAQANHILGHWCB-NRFANRHFSA-N	425.957	1.990	50	20	IDGD	
O=C1CC[C@@H](C(=O)N2CCCC23CN(C(=O)[C@@H](Br)Cc2ccccc2)C3)N1	1842737369	JZRQPOLDTUEYOS-HOTGVXAUSA-N	434.334	1.475	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1n[nH]c3c(C)cccc13)C2	1843416642	IWODKJDAKYPDSO-MFKUBSTISA-N	447.499	1.822	50	20	IDGD	
O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)c2csc(-c3ccccc3)n2)C1	1843570587	BJHAUMZOJJGVSI-UHFFFAOYSA-N	447.325	1.621	50	20	IDGD	
O=C([C@H](O)CCl)N1CC2(CCCN2C(=O)c2ccc3[nH]nc(Br)c3c2)C1	1844134420	ABGZLHJHAVPOFX-CYBMUJFWSA-N	441.713	1.742	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)[C@H]1CC[C@H](O)CC1)C2	1844693319	RLDHWVBQNUBKEX-JCNLHEQBSA-N	445.472	1.888	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)CC23CCCN2CCC3)C1	1845116860	IUHZURFWDPIIOH-KOEQRZSOSA-N	440.548	1.342	50	20	IDGD	
C[C@H](NC(=O)c1cnccn1)C(=O)N1CC2(CCCN2C(=O)[C@@](C)(Cl)CCl)C1	1845171299	RDIMPXAKKPTQLF-SJCJKPOMSA-N	428.320	1.035	50	20	IDGD	
O=C([C@@H](F)Br)N1CC2(CCCN2C(=O)c2nc3cc([N+](=O)[O-])ccc3[nH]2)C1	1845577576	QZSCKEUJWHGNOE-GFCCVEGCSA-N	440.229	1.979	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2ccnc3ncccc23)C1	1845633631	OBKDWYXTAZBIIQ-JFLMPSFJSA-N	445.483	1.581	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)C1CCN(Cc3ccccn3)CC1)C2	1846360730	CXFBJXUZXIPMFM-IBGZPJMESA-N	434.968	1.751	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)Cc1cnc2ccccn12	1847535575	UJWXZKHYNUNHTG-USFCLMKFSA-N	447.499	1.213	50	20	IDGD	
C[C@@H](c1ccc(-n2cncn2)cc1)N(C)C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1	22878064	ONAXZKWWVFQAGN-AWEZNQCLSA-N	432.448	1.290	50	20	IDGD	
C[C@H](NC(=O)c1ccccc1)C(=O)NNC(=O)c1ccc(CSc2nncn2C)cc1	26751033	GVQDOUYYQIXORE-AWEZNQCLSA-N	438.513	1.687	50	20	IDGD	
Cc1nn([C@H]2CCS(=O)(=O)C2)c(C)c1C=NNC(=O)c1cc(Br)c[nH]1	725841067	SVSOGWOVRQEMOE-LBPRGKRZSA-N	428.312	1.714	50	20	IDGD	
CC(C)(C)NC(=S)NNC(=O)CNS(=O)(=O)c1cc(C(F)(F)F)ccc1Cl	726136825	QBZJBMIJBIYSMF-UHFFFAOYSA-N	446.904	1.931	50	20	IDGD	
Cc1nc(CNC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)nc2ccccc12	726716091	ZOQYJDIDROAZSO-UHFFFAOYSA-N	447.543	1.981	50	20	IDGD	
O=C(NNC(=S)NCC1CCC1)C1CCN(S(=O)(=O)c2cccnc2Cl)CC1	727866494	KZLBIUKJSDNCHC-UHFFFAOYSA-N	445.998	1.431	50	20	IDGD	
O=C(CN1C(=O)N[C@]2(CCc3ccccc32)C1=O)NNC(=O)c1cccc(OC(F)F)c1	728486499	DKCASPFUMHMVEQ-NRFANRHFSA-N	444.394	1.443	50	20	IDGD	
CC(=O)Nc1ccc(S(=O)(=O)N2CCC(=NNC(=O)Cc3cccnc3)CC2)cc1	728786401	JFGKRJBBOIWQMY-UHFFFAOYSA-N	429.502	1.539	50	20	IDGD	
Cc1cccc2c1CC[C@@H]2NC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	729621114	DMYMAAKNZDPQLC-IBGZPJMESA-N	444.561	1.640	50	20	IDGD	
COc1cc(OC)cc(C(=O)N2CCN(C(=O)NNC(=O)c3ccccc3OC)CC2)c1	731499410	UHCPCQVXUYQSKH-UHFFFAOYSA-N	442.472	1.525	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CCCS(=O)(=O)N2CCCC2)cc1Br	732036005	QLRKVTHPICRHAW-UHFFFAOYSA-N	448.339	1.425	50	20	IDGD	
O=C(COC(=O)c1cccnc1N1CCCCC1)NNC(=O)c1cccc([N+](=O)[O-])c1	732325573	PFBPBBGFDBDHAJ-UHFFFAOYSA-N	427.417	1.598	50	20	IDGD	
O=C(COC(=O)COc1ccc(C(F)(F)F)cc1)NNC(=O)c1cccc([N+](=O)[O-])c1	732327995	WQBXRLVFEBMFCF-UHFFFAOYSA-N	441.318	1.997	50	20	IDGD	
Cc1nc2ccnn2c(C)c1CCC(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	732329597	NRLRSHGKIQYQFV-UHFFFAOYSA-N	440.416	1.191	50	20	IDGD	
N#Cc1ccccc1OCC(=O)NNC(=O)N[C@@H](Cc1ccccc1)CN1CCOCC1	732476328	FHERTJYKHPMFOZ-FQEVSTJZSA-N	437.500	1.211	50	20	IDGD	
CCS(=O)(=O)C[C@@H](C)N(C)C(=O)CCC(=O)C(C#N)=C1N(C)c2ccccc2N1C	733184779	RMGPZQKUSADLRG-OAHLLOKOSA-N	432.546	1.939	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)CC(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1F	734809717	YONFHNDIFORPFI-UHFFFAOYSA-N	436.417	1.034	50	20	IDGD	
C[C@H](NS(=O)(=O)c1cccc(C(=O)NNC(=O)c2cnn(C)c2)c1)c1ccccc1	735448947	CGCUGBJQDAKDRB-AWEZNQCLSA-N	427.486	1.534	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)N[C@H](C)CN2CCN(c3ccccn3)CC2)cc1	735585127	AODOZJLZBVMCQM-QGZVFWFLSA-N	442.520	1.010	50	20	IDGD	
CCc1nc2ccccc2n1CC(=O)NNC(=O)[C@@H](Cc1ccccc1)n1nnnc1C	735647156	JAXFKUOZKPCDIZ-LJQANCHMSA-N	432.488	1.525	50	20	IDGD	
C[C@H]1CN(S(=O)(=O)c2ccc(C(=O)NNc3ccc(Cl)nn3)cc2)C[C@H](C)O1	735688584	AZWXERPUSVAZEU-RYUDHWBXSA-N	425.898	1.685	50	20	IDGD	
CC(=O)c1ccc(S(=O)(=O)N(C)CCCC(=O)NNc2ccnc(N(C)C)n2)cc1	740102514	KXMPWDCDEMZORL-UHFFFAOYSA-N	434.522	1.289	50	20	IDGD	
Cc1nn(C)c2sc(C(=O)N[C@@H](C)C(=O)NNC(=O)Cc3c[nH]c4ccccc34)cc12	742036836	OLZLSJPBECCGPU-LBPRGKRZSA-N	438.513	1.933	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@@H](C)Oc1ccc(F)c(F)c1	743742528	XDOZSFIAJZEPPN-LLVKDONJSA-N	426.445	1.795	50	20	IDGD	
CN(C)C(=O)[C@@H]1CCCN1CCCNC(=O)NNC(=O)Nc1ccc(OC(F)F)cc1	745796360	RIAMBAFIXGHSIU-HNNXBMFYSA-N	442.467	1.566	50	20	IDGD	
C[C@H](CNC(=O)NNC(=O)COc1ccc(Br)cc1)CN1CCN(C)CC1	745860334	PLQCPTWDJYJVEF-CQSZACIVSA-N	442.358	1.042	50	20	IDGD	
CC[C@H](NC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)C1CCOCC1	746427116	YKTNFBIIQTZTFI-SFHVURJKSA-N	438.550	1.620	50	20	IDGD	
Cc1cc(N2CCCS2(=O)=O)ccc1C(=O)NNC(=O)Cc1cn2ccccc2n1	746554154	XRMAAEZPDDTCBU-UHFFFAOYSA-N	427.486	1.186	50	20	IDGD	
C[C@H]1CN(C(=O)c2ccc(CNC(=O)NNC(=O)c3ccc(C#N)cc3)cc2)C[C@@H](C)O1	747105858	RSYNGQCGIFFKIO-IYBDPMFKSA-N	435.484	1.952	50	20	IDGD	
O=C(O)c1ccc(S(=O)(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c(Br)c1	747593817	FSXXNTOTUFMXIB-UHFFFAOYSA-N	444.219	1.679	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc(C(=O)O)c(Br)c1)c1ccc([N+](=O)[O-])cc1	747595054	ZAZJFSULOQJXGC-UHFFFAOYSA-N	444.219	1.679	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)N2CCN(C(C)(C)C(N)=O)CC2)c(C)n1C[C@H]1CCCO1	747921611	ZFDCRGIURLOTHC-QRRJMBGHSA-N	427.549	1.599	50	20	IDGD	
O=C(NNC(=O)C1CCN(c2ncc(C(F)(F)F)cc2Cl)CC1)C(=O)N1CCCC1	748246464	ACOLTMZRQTZTDC-UHFFFAOYSA-N	447.845	1.740	50	20	IDGD	
CN1CCC[C@H](NC(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)C1=O	748663631	PCWPLEXZIAPFKV-SFHVURJKSA-N	448.483	1.010	50	20	IDGD	
COc1ccccc1C1(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)CC1	749420165	IZAZLBRKRVDGCO-UHFFFAOYSA-N	446.529	1.621	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)c1ccccc1)C(=O)NNC(=O)CCc1ccccc1	749851270	BVRIKVWWXRVNGC-GOSISDBHSA-N	435.571	1.867	50	20	IDGD	
C[C@@H]1CN(CCC(=O)NNC(=O)c2ccc(Br)cc2[N+](=O)[O-])C[C@@H](C)O1	751059037	RWDCRQJQYSSGJX-GHMZBOCLSA-N	429.271	1.618	50	20	IDGD	
CCC(CC)C(=O)NNC(=O)C[C@H]1c2cc(OC)c(OC)cc2CCN1S(C)(=O)=O	751363562	PIJUWVZEUMWQCK-INIZCTEOSA-N	441.550	1.536	50	20	IDGD	
Cc1oc(-n2cccc2)c(C#N)c1C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	751390379	CCGMTNNONMKJIW-UHFFFAOYSA-N	447.860	1.626	50	20	IDGD	
CC1(C)Cc2cc(S(=O)(=O)NNC(=O)c3csc(N4CCOCC4)n3)ccc2O1	753361405	MRHSDSZAHQTEJS-UHFFFAOYSA-N	438.531	1.317	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)N[C@@H](C)CO[C@@H]2CCOC2)c2ccccc2c1=O	753948663	PSCGLZBOBRTCKC-JKSUJKDBSA-N	445.520	1.725	50	20	IDGD	
Cc1nc2c(c(O)nn2C)c(C)c1CCC(=O)OCC(=O)NNC(=O)c1ccccc1	754549939	FKVVCZCJRBZLHU-UHFFFAOYSA-N	425.445	1.228	50	20	IDGD	
O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)c1cccc(OCc2cn3ccccc3n2)c1	754753572	DPTWSEJGJNBXKW-HNNXBMFYSA-N	428.470	1.109	50	20	IDGD	
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)c1coc(S(=O)(=O)N(C)C)c1	755408883	BEJDKEKNMWVBJZ-CYBMUJFWSA-N	431.470	1.912	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)c2cc(C)[nH]n2)cc1S(=O)(=O)N1CCCCC1	755413645	PNYVZGSBUPQQIX-UHFFFAOYSA-N	436.494	1.368	50	20	IDGD	
CC(C)n1nc(C(=O)NNC(=O)c2ccc(C(=O)NC3CC3)cc2)c2ccccc2c1=O	756862551	FALNOHMIQCZQLU-UHFFFAOYSA-N	433.468	1.944	50	20	IDGD	
CCOC(=O)Nc1ccc(NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1C#N	757762268	RZDBEBUUGMEHEJ-UHFFFAOYSA-N	445.457	1.997	50	20	IDGD	
NS(=O)(=O)c1cc(C(=O)OCC(=O)NN=C(c2ccccc2)c2ccccc2)co1	757766523	ALSBOOQKHOYHFQ-UHFFFAOYSA-N	427.438	1.653	50	20	IDGD	
CC(C)CC(=O)NNC(=O)[C@H](C)OC(=O)[C@](C)(O)CN1C(=O)C(C)(C)c2ccccc21	758887652	SSXDWMMNOAIHEB-RCDICMHDSA-N	433.505	1.187	50	20	IDGD	
COC(=O)c1ccc(NNC(=O)c2ccc(OC)c(S(=O)(=O)NC3CCCC3)c2)nc1	759730035	ATTQMNLYVABQIU-UHFFFAOYSA-N	448.501	1.855	50	20	IDGD	
CC(C)(C)OC(=O)NCCC(=O)NNC(=O)c1oc2ccccc2c1CS(C)(=O)=O	760439992	VANJYYCBLOKJJE-UHFFFAOYSA-N	439.490	1.653	50	20	IDGD	
COC[C@H](C)n1c(C)cc(/C=C(/C#N)C(=O)NCCNS(=O)(=O)NC(C)C)c1C	760639127	DFGFBYPDUOVZAX-PACYTGELSA-N	425.555	1.168	50	20	IDGD	
Cc1nc2ccc(C(=O)NNC(=O)CN3CCN(C(=O)c4ccccc4)CC3)cc2s1	762086504	LLLRNSBGLTXXBK-UHFFFAOYSA-N	437.525	1.824	50	20	IDGD	
CCc1noc2ncc(S(=O)(=O)NNC(=O)c3cc(OC)c(OC)c(OC)c3)cc12	762431257	KIXHUJZNOHTZII-UHFFFAOYSA-N	436.446	1.434	50	20	IDGD	
COc1cc(C(C)=O)ccc1OCCCC(=O)NNc1nccc(N2CCOCC2)n1	762857102	RKTSVTQZJWMJAJ-UHFFFAOYSA-N	429.477	1.827	50	20	IDGD	
CN(C)c1nc(C=NNC(=O)CNC(=O)c2cccnc2)c(Cl)n1-c1ccccc1	763194011	TTXAXYSOXJGGNG-UHFFFAOYSA-N	425.880	1.867	50	20	IDGD	
O=C(NNC(=O)c1ccccc1)C(=O)N1C[C@H](C(=O)N2CCCCC2)Oc2ccccc21	763424467	ABWBIOVYCJNYBM-LJQANCHMSA-N	436.468	1.254	50	20	IDGD	
O=C(NNC(=O)c1ccc2ccccc2n1)C(=O)Nc1ccc(OCC(F)(F)F)nc1	763453915	CYAKSGAAMQWHFF-UHFFFAOYSA-N	433.346	1.971	50	20	IDGD	
CN1CCCN(c2ccc(NC(=O)C(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)cc2)CC1	763455318	PFNAAQGUQZUVAW-UHFFFAOYSA-N	440.460	1.136	50	20	IDGD	
O=C(NNC(=O)c1ccccn1)C(=O)Nc1ccc(-c2nnc3n2CCCCCC3)cc1	763465154	UFLMJTYEVNCRIY-UHFFFAOYSA-N	433.472	1.856	50	20	IDGD	
CCOC(=O)c1c(NC(=O)C(=O)NNC(=O)c2cccnc2)sc2c1CCCCC2	763488914	QZJUXAGVPIRHJZ-UHFFFAOYSA-N	430.486	1.988	50	20	IDGD	
CC(C)OC(=O)NCc1ccc(NC(=O)C(=O)NNC(=O)c2ccc3c(c2)OCO3)cc1	763547514	CQNMFRDDPBDZIE-UHFFFAOYSA-N	442.428	1.450	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(-c3nccc(C)n3)cc2)cc1OC	763549831	AEZOCEMYGFKWKT-UHFFFAOYSA-N	435.440	1.869	50	20	IDGD	
Cc1cccc(OCC(=O)NNC(=O)C(=O)Nc2ccnn2-c2ccc(Cl)cc2)c1	763622926	IBLDWADULNZJGW-UHFFFAOYSA-N	427.848	1.999	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)COc2cc(C)cc(C)c2)c(OC)c1OC	763644983	PGQTUAIRFQQTEF-UHFFFAOYSA-N	431.445	1.494	50	20	IDGD	
COC(=O)CCc1ccc(NC(=O)C(=O)NNC(=O)COc2cc(C)cc(C)c2)cc1	763649796	KLLQKWLLYVKWEM-UHFFFAOYSA-N	427.457	1.574	50	20	IDGD	
COc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(C)c(N3CCOC3=O)c2)cc1	763660918	KNODBXSXRGVLIV-UHFFFAOYSA-N	442.428	1.125	50	20	IDGD	
CCOC(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)COc2cc(C)ccc2C)c1	763665824	OYNYVVXSCHENTM-UHFFFAOYSA-N	427.457	1.574	50	20	IDGD	
CN(C)c1nc2cc(NC(=O)C(=O)NNC(=O)COc3ccc(Cl)cc3)ccc2o1	763684266	IENFGAWJNXVTSN-UHFFFAOYSA-N	431.836	1.712	50	20	IDGD	
CC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])c1C	763802777	AJAQPJPZOBNKDM-UHFFFAOYSA-N	429.389	1.027	50	20	IDGD	
Cc1ccc(NC(=O)C2CC2)cc1NC(=O)C(=O)NNC(=O)COc1ccccc1C#N	763808399	VUYDMMXRDUGBTB-UHFFFAOYSA-N	435.440	1.380	50	20	IDGD	
Cc1ccc(Br)cc1NC(=O)C(=O)NNC(=O)COc1ccccc1C#N	763813714	NSQAFPVWBGIBLE-UHFFFAOYSA-N	431.246	1.794	50	20	IDGD	
CC(C)C(=O)NNC(=O)C(=O)Nc1ccc(NC(=O)[C@@H]2CCCO2)cc1C(F)(F)F	763819717	BGPGCSOEFQCEEC-ZDUSSCGKSA-N	430.383	1.565	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(OCCC(N)=O)cc2)c1C	763840369	KBUNDKXSDOCTFP-HNNXBMFYSA-N	442.472	1.111	50	20	IDGD	
CC(=O)N1CCCc2cc(NC(=O)C(=O)NNC(=O)COc3ccc(F)cc3)ccc21	763842632	GMILSLSMBLVUGT-UHFFFAOYSA-N	428.420	1.290	50	20	IDGD	
Cc1cccc(O[C@@H](C)C(=O)NNC(=O)C(=O)Nc2ccc(Cn3cncn3)cc2)c1C	763850742	PBTUGKUYPPGVLU-INIZCTEOSA-N	436.472	1.497	50	20	IDGD	
CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)C(=O)Nc2cnn(-c3ccncc3)c2)cc1	763878524	QTBCVROEADUARK-CQSZACIVSA-N	436.428	1.023	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)C(=O)Nc1cccc(-n2cnnn2)c1	763902605	OUVFDOMGCPHDEG-UHFFFAOYSA-N	448.468	1.494	50	20	IDGD	
CCCCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cnn(C)c2C(F)F)cc1OC	763911042	BJXYHYWJFZBTKE-UHFFFAOYSA-N	439.419	1.945	50	20	IDGD	
O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)C(=O)Nc1ccc2c(c1)Cc1ccccc1-2	763922262	UJNDBIVYDSDQBO-UHFFFAOYSA-N	439.435	1.633	50	20	IDGD	
O=C1CN(c2ccc(NC(=O)NNC(=O)CSc3ccccc3O)cc2Cl)CCN1	763927758	MVZNCEYTXYMVKS-UHFFFAOYSA-N	449.920	1.927	50	20	IDGD	
CN(C)CCOc1ccc(NC(=O)C(=O)NNC(=O)c2cc(Br)c[nH]2)cc1	763996574	DPGRNLVDHJBFBA-UHFFFAOYSA-N	438.282	1.117	50	20	IDGD	
CCOc1ccc(C#N)cc1NC(=O)C(=O)NNC(=O)c1cc(Br)cn1C	764001723	DGLKXQSQYMDQON-UHFFFAOYSA-N	434.250	1.458	50	20	IDGD	
Cc1nnnn1-c1cc(NC(=O)C(=O)NNC(=O)Cc2cccc3ccccc23)ccc1F	764027342	GFGHVWYBTMQKBL-UHFFFAOYSA-N	447.430	1.592	50	20	IDGD	
O=C(Cc1ccsc1)NNC(=O)C(=O)Nc1ccc(NC(=O)NC[C@H]2CCCO2)cc1	764035744	RVDJFLLJPODWRG-MRXNPFEDSA-N	445.501	1.377	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)CCc2ccccc2)c(C(=O)N(C)C)cc1OC	764184800	FDTLMFUMTXHKDQ-UHFFFAOYSA-N	442.472	1.124	50	20	IDGD	
O=C(CCC1CCCCC1)NNC(=O)C(=O)Nc1ccc(C[C@@H]2CC(=O)NC2=O)cc1	764212308	XDYLFXWQOYFKSI-MRXNPFEDSA-N	428.489	1.338	50	20	IDGD	
COCC(=O)NNC(=O)C(=O)Nc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(C(F)(F)F)c1	764303833	PJYFKWNWYUDHMT-GHMZBOCLSA-N	432.399	1.051	50	20	IDGD	
COCCOc1ccc(Br)cc1NC(=O)C(=O)NNC(=O)c1ccc(C)o1	764372006	UDXVIZUCFMVKCO-UHFFFAOYSA-N	440.250	1.775	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H](O)[C@H](C)c2ccc(C)cc2)c1	764584905	LPBWBNNPAQERPP-OXQOHEQNSA-N	447.557	1.951	50	20	IDGD	
O=C(CNC(=O)c1cccc(Br)c1)NNC(=O)CSc1ccccc1O	765248623	GZZAGJALNZJQJD-UHFFFAOYSA-N	438.303	1.824	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2nccnc2Cl)c(I)c1	765710106	SOPMCAFLLBOEEN-UHFFFAOYSA-N	447.620	1.825	50	20	IDGD	
Cc1cc2c(cc1C)O[C@H](C(=O)NNC(=O)CN1CCN(C(=O)c3ccccc3)CC1)C2	765733099	NIHDTNVMUSNCHR-NRFANRHFSA-N	436.512	1.212	50	20	IDGD	
N#Cc1ccc(SCC(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cc1	765737661	HXGZQHCYRXDKAD-UHFFFAOYSA-N	437.525	1.256	50	20	IDGD	
Cc1cc(OCC(=O)NNC(=O)CN2CCN(C(=O)c3ccccc3)CC2)ccc1Cl	765739611	ZTTOFVKCKAQPBN-UHFFFAOYSA-N	444.919	1.633	50	20	IDGD	
O=C(NCc1cccc(N2CCCS2(=O)=O)c1)NNC(=O)c1ccc([N+](=O)[O-])cc1	765894727	SCVURRUDKUWMJN-UHFFFAOYSA-N	433.446	1.279	50	20	IDGD	
CCOc1cc(C(=O)NNC(=O)NC[C@H]2CCCS2(=O)=O)cc(OCC)c1OCC	765899947	OZPXHTMIXZWXTP-CQSZACIVSA-N	443.522	1.404	50	20	IDGD	
CC(C)(O)C(=O)NNC(=O)c1cn(-c2ccc(Br)cc2C(F)(F)F)nn1	768247974	RGWHUQHYOIRDQR-UHFFFAOYSA-N	436.188	1.581	50	20	IDGD	
COCCOc1ccccc1N1CCN(CC(=O)NNC(=O)Cc2ccccc2C)CC1	768553295	XHDLOGXSUBPUTQ-UHFFFAOYSA-N	440.544	1.532	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)c1cccc(CN2CCN(C)CC2)c1	768629818	MZFNGTISDOIDCJ-UHFFFAOYSA-N	432.546	1.603	50	20	IDGD	
CC(C)Cn1ncc(C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c1C1CC1	768649042	FOFSAEJZFRCIJE-UHFFFAOYSA-N	429.433	1.943	50	20	IDGD	
CC1(C)[C@@H](NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)C[C@@H]1OCc1ccccc1	770305140	DVJOETNDTKKWIG-OALUTQOASA-N	435.488	1.990	50	20	IDGD	
Cc1ccc([C@H](CNC(=O)NNc2nc(O)c3cnn(C)c3n2)N2CCOCC2)cc1	770351696	TVIFGWIQASPOPG-INIZCTEOSA-N	426.481	1.077	50	20	IDGD	
Cc1ccc2cccc(S(=O)(=O)NNC(=O)C(=O)NCc3ccc(Cl)cc3)c2n1	771603742	FKZOIDQVWCFMJH-UHFFFAOYSA-N	432.889	1.823	50	20	IDGD	
Cc1cc(/C=C(/C#N)C(=O)N2CCC(C(=O)NCCO)CC2)c(C)n1C[C@@H]1CCCO1	771768299	HCWDVWICYLCLHQ-MSTPFNHUSA-N	428.533	1.538	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNC(=O)Nc1cnn(Cc2nnc3n2CCCC3)c1	772636827	WTUQIWDMLBUHKU-UHFFFAOYSA-N	444.883	1.988	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2cnn(-c3ccccc3Br)c2)n1	773732425	ZDACPJKIYGZAER-UHFFFAOYSA-N	432.238	1.515	50	20	IDGD	
O=C(NNC(=O)C12CC3CC(CC(C3)C1)C2)Nc1ccc(C[C@@H]2NC(=O)NC2=O)cc1	775705811	FSPLISWQZQHXBR-LEJIWSMMSA-N	425.489	1.806	50	20	IDGD	
Cc1cc(Br)cc(NC(=O)C(=O)NNC(=O)c2nnc(O)c3ccccc23)c1	777141437	KKDQMWDZFQWJRO-UHFFFAOYSA-N	444.245	1.806	50	20	IDGD	
COc1ccc(Cn2cc(C(=O)NNC(=O)COc3ccc(C#N)cc3)cn2)cc1OC	778288667	DRTFPMAIVYTXLR-UHFFFAOYSA-N	435.440	1.660	50	20	IDGD	
O=C(c1cc(OCC(F)F)ccn1)N1CCN(S(=O)(=O)CBr)CC1	778422977	IXNITTZZTHJRSN-UHFFFAOYSA-N	428.255	1.166	50	20	IDGD	
CCOC(=O)c1cnc(NNC(=O)c2cccc(NC(=O)CCn3ccnc3)c2)nc1C	778426748	RCHAWALTCSTJEQ-UHFFFAOYSA-N	437.460	1.944	50	20	IDGD	
Cc1nc(-c2cccnc2)nc(O)c1CCC(=O)NNC(=O)CNC(=O)OC(C)(C)C	778444872	ARQNWBAHXJUUIM-UHFFFAOYSA-N	430.465	1.157	50	20	IDGD	
COc1ccc2nc(NNC(=O)[C@H]3CC(=O)N(CCN4CCOCC4)C3)c(C)cc2c1	778479360	WRVJYKPYUTYJAA-KRWDZBQOSA-N	427.505	1.176	50	20	IDGD	
CC(C)(C)OC(=O)NCC(=O)NNC(=O)N[C@@H]1CCCC[C@H]1CNC(=O)OC(C)(C)C	778679567	BDRGHWIKYTXEDG-UONOGXRCSA-N	443.545	1.925	50	20	IDGD	
O=C(NNC(=O)c1cccc(Cl)c1)C(=O)Nc1ccc(C(=O)N2CCOCC2)c(F)c1	778707687	USIZNAYDJSBVPX-UHFFFAOYSA-N	448.838	1.351	50	20	IDGD	
COC[C@H](C)n1ccc(NC(=O)C(=O)NNC(=O)c2ccc(Br)s2)n1	778709245	FDFKXEXRCILHST-QMMMGPOBSA-N	430.284	1.314	50	20	IDGD	
CS(=O)(=O)Cc1noc(NC(=O)NNc2ccc([N+](=O)[O-])cc2Br)n1	779448201	IKRNOLVMWKOBRT-UHFFFAOYSA-N	435.216	1.434	50	20	IDGD	
CC(C)(C)S(=O)(=O)Cc1cccc(NC(=O)C(=O)NNC(=O)c2ccc(O)cc2)c1	782833289	FHGJLNSPQBXFIE-UHFFFAOYSA-N	433.486	1.505	50	20	IDGD	
COC(=O)COc1ccc(NC(=O)C(=O)NN=c2sc3ccccc3n2C)c(C)c1	783349973	SDNLLWKIDJMGNI-UHFFFAOYSA-N	428.470	1.671	50	20	IDGD	
O=C(NNc1ccc(-n2cccn2)nn1)C(=O)Nc1ccccc1OC[C@H]1CCCCO1	783433215	OPYVGIKUDDBQSP-OAHLLOKOSA-N	437.460	1.692	50	20	IDGD	
O=C(NNC(=O)C(=O)N1CCCC1)C(=O)Nc1cccc(CSc2ccccn2)c1	784000042	SOSXAXGCHDLKAO-UHFFFAOYSA-N	427.486	1.082	50	20	IDGD	
Cc1nc(-c2ccccc2)sc1NC(=O)C(=O)NNC(=O)CNC(=O)c1cccs1	784003700	MBUNWENBTLGWMW-UHFFFAOYSA-N	443.510	1.696	50	20	IDGD	
Cc1c(NNC(=O)C(=O)Nc2cccc(C(=O)N3CCOCC3)c2)cccc1[N+](=O)[O-]	784351256	MHJCQUDBSDIBFB-UHFFFAOYSA-N	427.417	1.457	50	20	IDGD	
CS(=O)(=O)Cc1ccc(NC(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2Cl)cc1	784393362	UUJMCEWVHDXURA-UHFFFAOYSA-N	426.838	1.875	50	20	IDGD	
C[C@H]1C[C@H](C)CN(S(=O)(=O)c2ccc(NC(=O)C(=O)NNc3cccnn3)cc2)C1	784858384	LEEQHOJGUKBLNC-KBPBESRZSA-N	432.506	1.225	50	20	IDGD	
CCOc1cc(N2CCN(C)CC2)ccc1NC(=O)C(=O)NNc1ccc(Cl)nc1	784874010	BMVINHXFEXWQPA-UHFFFAOYSA-N	432.912	1.967	50	20	IDGD	
Cc1cc(I)ccc1NC(=O)C(=O)NNc1ccnc(N(C)C)n1	784971223	WKNUZVBHBRZUKY-UHFFFAOYSA-N	440.245	1.537	50	20	IDGD	
O=C1C[C@H](Cc2ccc(NC(=O)C(=O)NNc3nc(C(F)(F)F)cs3)cc2)C(=O)N1	785145084	CTYTWTIAPWCQGT-VIFPVBQESA-N	441.391	1.449	50	20	IDGD	
COc1cc(F)cc(NNC(=O)C(=O)Nc2ccc(N3CCC(C(N)=O)CC3)cc2)c1	785245432	HROZTVVXFUYVJZ-UHFFFAOYSA-N	429.452	1.618	50	20	IDGD	
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)C(C)(C)S(=O)(=O)C1CC1	785700891	UYCIWNAODHPQOR-JTQLQIEISA-N	433.324	1.720	50	20	IDGD	
NC(=O)[C@@H]1CCC[C@@H](C(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)C1	786688868	XLRLWHPOODVTHH-IAGOWNOFSA-N	447.495	1.498	50	20	IDGD	
CCC(O)(CC)CCNC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	788324427	QWGSWOFTLJWILV-UHFFFAOYSA-N	426.539	1.356	50	20	IDGD	
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)CC3OCCO3)c2)cc1	788630799	OOFIGVJJCZQXGH-UHFFFAOYSA-N	435.458	1.020	50	20	IDGD	
O=C(NNC(=O)C(=O)NC1CC1)N[C@@H](Cc1ccccn1)c1ccc(Br)cc1	788872973	UFMJKYHZEDHRHD-INIZCTEOSA-N	446.305	1.737	50	20	IDGD	
CC(=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O)c1ccc(OC(C)C)c(Cl)c1	788974464	DBVQUFGPEHXLDB-UHFFFAOYSA-N	439.925	1.552	50	20	IDGD	
O=C(NC[C@@H]1CCCN(c2ccccc2)C1)NNC(=O)C1CCN(c2ncccn2)CC1	789316986	JGKTVHOIUUBNPY-SFHVURJKSA-N	437.548	1.940	50	20	IDGD	
O=C(NNc1cccc(F)c1[N+](=O)[O-])C(=O)Nc1cccc(-c2nnnn2C2CC2)c1	790996465	DUFBBWNRYRXZSF-UHFFFAOYSA-N	426.368	1.804	50	20	IDGD	
CCN(CC)S(=O)(=O)c1ccc(CCNC(=O)NNC(=O)c2cccc(C)n2)s1	792906348	WTQZGOKOMBRHMA-UHFFFAOYSA-N	439.563	1.669	50	20	IDGD	
O=C(NNc1ccc2c(=O)[nH]ccc2c1)C(=O)Nc1cccc(S(=O)(=O)NC2CC2)c1	793070799	UGMXAXWXPPAWPY-UHFFFAOYSA-N	441.469	1.051	50	20	IDGD	
COc1ccc(C(=O)NNC(=O)CSc2n[nH]c(Cc3ccccc3)n2)cc1OC	794559033	PJTZDRSLOOITEB-UHFFFAOYSA-N	427.486	1.966	50	20	IDGD	
COC(=O)c1cc(S(=O)(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2O)c(F)cc1Cl	795326031	HXJBDZKBDYYQTC-UHFFFAOYSA-N	447.784	1.503	50	20	IDGD	
COc1cc(NC(=O)C(=O)NNC(=O)CCOc2ccccc2)c(OC)c(C)c1OC	797001717	KFPDOWIYAKYXLM-UHFFFAOYSA-N	431.445	1.576	50	20	IDGD	
CC(C)Oc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(O)c(Cl)c2)cc1C(N)=O	797008388	YCIOVBRVUOKJBT-UHFFFAOYSA-N	434.836	1.331	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)NCC2([S@@](C)=O)CCC2)c2ccccc2c1=O	798120911	BXUGYOPQAZQWCO-WJOKGBTCSA-N	447.561	1.832	50	20	IDGD	
NC(=O)c1cc(Cl)cc(S(=O)(=O)NNC(=O)c2ccc(Br)s2)c1	799120035	HZQZYGMVHGFGBM-UHFFFAOYSA-N	438.712	1.886	50	20	IDGD	
CCOc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NNC(=O)C(F)(F)Oc1ccccc1	799259096	ODVQXNZERWANEU-UHFFFAOYSA-N	438.343	1.751	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2CS[C@H](Cc3ccccc3F)C(=O)N2)cc1	801105224	BTGBYRAVGTYDOF-DLBZAZTESA-N	444.488	1.063	50	20	IDGD	
O=C(CCCNS(=O)(=O)c1ccc(F)cc1)NNC(=O)Nc1ccc2c(c1)OCO2	802100551	UCQJZDHPXSDBRB-UHFFFAOYSA-N	438.437	1.466	50	20	IDGD	
O=C(COC(=O)c1cc(O)ccc1C(F)(F)F)NNC(=O)[C@@H]1COc2ccccc2O1	803527517	QZHKLGVOGOJXLG-HNNXBMFYSA-N	440.330	1.555	50	20	IDGD	
COc1cc(N)c(C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)cc1Br	803951971	UKFNOHPEPIEUHP-UHFFFAOYSA-N	447.245	1.530	50	20	IDGD	
CS(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@@H]2CCN(c3ccc(C#N)cc3F)C2)cc1	804655538	ADKNZZNDCYJBDO-CQSZACIVSA-N	445.476	1.780	50	20	IDGD	
N[C@@](C(=O)NNC(=O)c1nn(-c2ccccc2)cc1O)(c1cccc(F)c1)C(F)(F)F	806346064	GZTFKKBTBDZMBT-GOSISDBHSA-N	437.353	1.895	50	20	IDGD	
CNC(=O)c1cccc(NC(=O)NNc2ccc(-n3ccnc3)nn2)c1Br	806737886	YCQKVMWXPYEDRU-UHFFFAOYSA-N	431.254	1.933	50	20	IDGD	
O=C(Cc1ccncc1)NNC(=O)C(=O)Nc1cccc2cc(Br)cnc12	806979454	VPXPBDFJJIPYSG-UHFFFAOYSA-N	428.246	1.721	50	20	IDGD	
CN(C)c1ccc(C(F)(F)F)cc1NC(=O)C(=O)NNc1ccc(-n2ccnc2)nn1	807428297	CLPKGPVHLLPTKO-UHFFFAOYSA-N	434.382	1.829	50	20	IDGD	
CS(=O)(=O)C1(CNC(=O)NNc2ccc(S(=O)(=O)C(F)(F)F)cc2)CCCC1	807537766	QIASMDOFHWQMJJ-UHFFFAOYSA-N	443.469	1.964	50	20	IDGD	
CNC(=O)c1cc(Oc2ccc(NC(=O)C(=O)NNC(=O)C3CCC3)cc2F)ccn1	810387434	WFGROUMTTDUKQU-UHFFFAOYSA-N	429.408	1.259	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)Cc2cccc(Cl)c2F)CC1	810413585	HPQAFQQEFWJZIU-UHFFFAOYSA-N	441.916	1.496	50	20	IDGD	
Cn1nnc2c1C[C@@H](C(=O)NNc1ccc(S(=O)(=O)Nc3nccs3)cc1)CC2	810468599	BVPFRHWNOBHHDF-NSHDSACASA-N	433.519	1.321	50	20	IDGD	
CN(C)S(=O)(=O)c1ccc(NNC(=O)Nc2cccn(CC(F)(F)F)c2=O)cc1	812952014	LDTCYGOMOUZTSG-UHFFFAOYSA-N	433.412	1.810	50	20	IDGD	
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)c1cnn(-c2ccccn2)c1N	814739583	WKGDRBKTUJYYSU-LLVKDONJSA-N	445.277	1.841	50	20	IDGD	
O=C(COC(=O)COc1ccc(Cl)c(F)c1)NNC(=O)c1ccc([N+](=O)[O-])cc1	815300749	BQGLAVJDYAFAIM-UHFFFAOYSA-N	425.756	1.771	50	20	IDGD	
CN(C)S(=O)(=O)c1ccccc1NNC(=O)C(=O)Nc1cnn(C)c1-c1ccccc1	815751757	NIVPHLHOFAJRRU-UHFFFAOYSA-N	442.501	1.419	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NN=Cc2ccccc2N2CCOCC2)cc1	912788496	GSYIOFBTTVNPMQ-UHFFFAOYSA-N	430.530	1.602	50	20	IDGD	
COC(=O)NNC(=O)[C@H](CCSC)NS(=O)(=O)c1ccc(Br)cc1	913176970	USCCDDWNYGZEPS-NSHDSACASA-N	440.341	1.236	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)CCCOc2ccc3c(c2)CCC(=O)N3)c1	915165758	KDHHLCPLKMUEPS-UHFFFAOYSA-N	445.497	1.595	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNC(=O)NCCc2ccc(S(N)(=O)=O)cc2)cc1	915883656	BYTPFNSKRKHMBE-UHFFFAOYSA-N	448.545	1.946	50	20	IDGD	
Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCCCOC2CCCCC2)cc1	916201383	OJHHHGOYOJGUMS-UHFFFAOYSA-N	440.566	1.685	50	20	IDGD	
CC(=NNC(=O)C1=S=C2CCCC2=C1)c1ccc(S(=O)(=O)NCCCC(=O)O)cc1	916315112	HKAHDJIKFMLDJO-UHFFFAOYSA-N	449.554	1.872	50	20	IDGD	
Cn1ccnc1[C@@](O)(CCNC(=O)NNC(=O)COc1ccccc1F)C(F)(F)F	916377135	ABIHDULBQXEODV-INIZCTEOSA-N	433.362	1.109	50	20	IDGD	
Cn1cc(CCNC(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)cn1	916595259	XETFBAOVIMCCDQ-UHFFFAOYSA-N	445.487	1.309	50	20	IDGD	
CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)CSc2nncs2)c1	916726680	UJJVTTSCYNXACO-UHFFFAOYSA-N	429.549	1.122	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)c2cnn3c(-c4ccccc4)ccnc23)c1	917108609	NYPVCJSUJASDPH-UHFFFAOYSA-N	435.465	1.875	50	20	IDGD	
CCNS(=O)(=O)c1ccc(F)c(C(=O)OCC(=O)NNC(=O)c2ccc(C)cc2)c1	919413082	MULDJTTWSCCPPQ-UHFFFAOYSA-N	437.449	1.050	50	20	IDGD	
COC(=O)c1cc(NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc(C(=O)OC)c1	920934946	QSVAOPVLGKBGAB-UHFFFAOYSA-N	449.441	1.130	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnc4ccccn34)C2)C1	1777827234	JDEUUPYEHVRNGQ-IFXJQAMLSA-N	435.322	1.951	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(CCN(C(=O)c3cc(-n4ccnc4)ccn3)C2)C1	1780388392	QVYBSFIMGVHWQS-OAQYLSRUSA-N	443.580	1.562	50	20	IDGD	
COc1cc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@](C)(Cl)CCl)C2)n(C)n1	1780710483	XBNYFQXIESXFNO-NIKGAXFTSA-N	447.363	1.793	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)COCCNC(=O)OC(C)(C)C)CCO2)C1	1781216823	OYBHPBLXWJNVOE-MGPUTAFESA-N	447.960	1.375	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2)c1cccc2ccncc12	1781239136	DUJZBMYCDSCMDD-WOIUINJBSA-N	431.920	1.962	50	20	IDGD	
Cc1nc2ncccn2c1C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781329978	OZFKPLOCRAGJSL-CXAGYDPISA-N	440.273	1.172	50	20	IDGD	
Cc1ncc(/C=C/C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](F)Br)C3)C2)s1	1781334271	JUXYOICTZHWKRR-OZRQEOMLSA-N	432.315	1.985	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3c4c(nn3C)CCC4)C2)C1	1782440426	AZNUUMBKLWVHKI-KPZWWZAWSA-N	425.327	1.136	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C23CC(C2)C3)C1	1782785744	KVJLJJUBNDQETJ-HXCOPDDYSA-N	441.532	1.434	50	20	IDGD	
CC[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](C)Nc1cccnc1)CCO2	1783341898	HOMPQUNPLDYODA-SIXWZSSISA-N	439.354	1.885	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)COC(=O)C(F)(F)F)CCO2)C1	1783349655	QMRCWCFLDSYEPZ-YGRLFVJLSA-N	445.232	1.095	50	20	IDGD	
C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3snnc3C3CC3)CCO2)C1	1783534354	ICRMKDAAQZGGIJ-HWPZZCPQSA-N	429.340	1.642	50	20	IDGD	
CC(=O)O[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]2C1)C(C)C	1783967780	WUARXWGJHSKWJJ-JVNPIMRCSA-N	447.370	1.585	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3CC(c4ccccc4)=NO3)[C@H]2C1	1784406909	DRSIQBATJIUTTM-TXTPUJOMSA-N	449.935	1.413	50	20	IDGD	
C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](C)Oc3ccccn3)C2)C1	1784490826	DOGYUUQUSDVWFY-PMUMKWKESA-N	426.311	1.462	50	20	IDGD	
Cc1nc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCBr)C[C@@H]32)ccc1F	1785624507	VIURZHZFHPLFTF-XEZPLFJOSA-N	428.302	1.907	50	20	IDGD	
CCc1oncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)CBr)C[C@@H]21	1786232894	DABOWRBBMXNBGC-DSPQJCBJSA-N	428.327	1.861	50	20	IDGD	
Cc1nc(CC(=O)Nc2ccc(C3(NC(=O)CCC(=O)NN(C)C)CCC3)cc2)no1	1786847286	QTOPZFYQQYIUMA-UHFFFAOYSA-N	428.493	1.428	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3CNc4ccccc43)[C@H]2C1	1786879323	PLZOTZFOCQMAMP-IALZYPHNSA-N	436.350	1.959	50	20	IDGD	
Cc1onc(-c2ccncn2)c1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]2C1	1787447658	APJPDTDDJKRJRE-GWIFVGGISA-N	437.859	1.568	50	20	IDGD	
C[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21)N1CSCSC1	1788682941	MXEYAQBUZADWDS-PEDHHIEDSA-N	425.979	1.544	50	20	IDGD	
CC#CC[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)c1ccccc1	1788704975	KVIHSPXQDWYBDK-SSTJLMRISA-N	432.948	1.763	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cn4cccnc4n3)C[C@@H]21)[C@H](F)Br	1789925727	IFKMEZACTCCXSI-IMIFBBOLSA-N	440.273	1.013	50	20	IDGD	
CCCNC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)Br)[C@H]2C1	1791055175	MQLKICIRVXXFIK-AJNGGQMLSA-N	432.359	1.056	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(Cl)nc3F)C[C@@H]21	1791252331	HGOMSBJUIPXBHP-PYJNHQTQSA-N	434.295	1.721	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3c(C)nc4sccn34)C[C@@H]21	1791255334	MOZPVBDYUVGLGU-AJNGGQMLSA-N	440.953	1.551	50	20	IDGD	
C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1n[nH]c(C3CC3)c1F)C2	1792870610	SUCPKHXYPFQPED-SGESHTKJSA-N	443.317	1.660	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1(c2ccc(O)cc2)CC1	1793170434	SHXLSPCORANWAS-BCDXTJNWSA-N	428.533	1.435	50	20	IDGD	
CCC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CNC(=O)c1cccs1)C2	1793445463	JDEJEHJZQHSLFV-UMPJEAMMSA-N	427.954	1.475	50	20	IDGD	
COc1ccc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Br)C3)cc1	1795129740	HIGLOTYLBJAIPH-DACLVMHWSA-N	443.313	1.908	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CC(C)(C)O	1795795470	UICOALGGTYMRKL-QDMKHBRRSA-N	433.461	1.933	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cn1ccc3ccc([N+](=O)[O-])cc31)C2)[C@@H](F)Cl	1796365084	RXRRCNKKCUEKCX-JGTCGTHISA-N	438.843	1.674	50	20	IDGD	
COCCOCCOCCOCCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](F)Cl	1796812062	RGVHKRJRWPFLTN-KYHPRHEASA-N	438.924	1.245	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(C(F)(F)F)c[nH]1)c1cccc(B(O)O)c1	1797011344	HQCWHGUFUDXFKH-MUJYYYPQSA-N	435.211	1.279	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1ccn2ccnc2c1	1797446491	VYJMFQHGJXQNDU-AYRXBEOTSA-N	425.258	1.228	50	20	IDGD	
Cc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)CBr)C3)cc1O	1799468262	ZNGQCHFSRMAFFQ-FAYQHZLMSA-N	425.323	1.935	50	20	IDGD	
COc1c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)Br)C3)ccc(F)c1F	1799676418	UPDCJDBNNVGCRP-YYHMBLRTSA-N	447.276	1.960	50	20	IDGD	
CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1[C@@H](O)CCN1Cc1ccccc1	1800299116	GIRSIDIFMNJXDT-STHVQZNPSA-N	449.979	1.229	50	20	IDGD	
CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3nn(C)cc3c1)C2	1800642907	BUEFKSORRUGJPW-DFGXFYAUSA-N	449.349	1.950	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1csc(C(F)(F)F)n1)C2	1800978314	ADRAXAOLVKCSSI-DTHBNOIPSA-N	441.859	1.619	50	20	IDGD	
C[C@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(S(C)(=O)=O)cn1)C2	1801959211	GKOJKRNTHMJZNQ-RVMXOQNASA-N	444.351	1.520	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc3c(c2)OCCO3)[C@@H]1c1cccnc1)[C@H](O)CCl	1803138678	DCXDBDSDBVFZMG-SQGPQFPESA-N	445.903	1.772	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@@H]2Cc3ccccc3O2)[C@H]1c1cccnc1)[C@H](O)CCl	1803143280	YWQIOUKMBOCQCD-HNJRGHQBSA-N	429.904	1.691	50	20	IDGD	
O=C(Cc1cnccn1)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@@H]1c1cccnc1	1803301005	BDIPSONZOHJQQX-IAOVAPTHSA-N	436.285	1.811	50	20	IDGD	
C[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC2(CCN(C(=O)[C@H](O)CCl)CC2)C1	1805222248	GMSWJKRMLQQWJB-LSDHHAIUSA-N	431.961	1.731	50	20	IDGD	
O=C(CCCc1ccncc1)N1CCCC2(CCN(C(=O)c3ccc(B(O)O)cc3)CC2)C1	1807117545	ITTYRROVNXMDER-UHFFFAOYSA-N	449.360	1.629	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H](CNC(=O)CN2CCNC2=N)[C@@H]1c1cccnc1	1807119717	ZVTVHIIQXDFWCX-ALKREAHSSA-N	441.363	1.164	50	20	IDGD	
N[C@H](C(=O)NC[C@@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1)c1ccccn1	1807161518	GARITWYLNWZPGZ-SNRMKQJTSA-N	446.349	1.967	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)NC[C@H]1CCN(C(=O)CN2CCCC2=O)[C@@H]1c1cccnc1	1808295351	GUOVPOPSNRIKDU-ZTNFWEORSA-N	441.359	1.946	50	20	IDGD	
CC(C)CNC(=O)C(=O)NC[C@@H]1CCN(C(=O)[C@H](C)Br)[C@@H]1c1cccnc1	1808453374	UYQWDOOUCAUZEE-CWRNSKLLSA-N	439.354	1.643	50	20	IDGD	
COC(=O)C1(C(=O)NC[C@@H]2CCN(C(=O)[C@H](C)Br)[C@@H]2c2cccnc2)CC1	1812690283	OOUGJYFJKGIXNA-AEGPPILISA-N	438.322	1.824	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)[C@@H]2CCC(=O)NC2)[C@@H]1c1cccnc1	1812862707	CSYQMDZZLXNMRZ-MKVSYHDVSA-N	437.338	1.397	50	20	IDGD	
COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2cc3cccnn3n2)[C@@H]1c1cccnc1	1813030520	CXGOPFFERWQHAU-HHXXYDBFSA-N	442.907	1.698	50	20	IDGD	
O=C(NC[C@H]1CCN(C(=O)c2cnc(O)nc2O)[C@@H]1c1cccnc1)C(Cl)Cl	1813079787	JEMBJBFHEUIRPS-ZYHUDNBSSA-N	426.260	1.406	50	20	IDGD	
O=C1C[C@H](C(=O)NC[C@@H]2CCN(C(=O)[C@@H](F)Br)[C@@H]2c2cccnc2)CCN1	1813136425	UZVKDTZEJZISRD-WXYCVUISSA-N	441.301	1.304	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)CSc2nc[nH]n2)[C@@H]1c1cccnc1	1813349972	FCDZYKBEXXAOEG-DZKIICNBSA-N	438.941	1.252	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)C2CCSCC2)[C@@H]1c1cccnc1	1814238966	ORBBCHKCCHMQIA-NQIIRXRSSA-N	447.605	1.604	50	20	IDGD	
O=C1CCc2ccc(C(=O)N3CCCC[C@@H]3c3cc(NC(=O)[C@@H](O)CCl)n[nH]3)nc2N1	1814870496	USDZQMGYNLEBJO-CABCVRRESA-N	446.895	1.595	50	20	IDGD	
CCC[C@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CN(CCO)CCO)[nH]n1	1815323074	YSALMPHUNDAILI-GOEBONIOSA-N	429.949	1.096	50	20	IDGD	
CN(CC(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1)C(=O)OC(C)(C)C	1817026979	KBUSMSLSWYNCTA-KGLIPLIRSA-N	443.932	1.868	50	20	IDGD	
Cc1cc(NC(=O)CC(=O)N[C@@H]2CCc3nc(NC(=O)[C@@H](F)Cl)sc3C2)no1	1817121464	KARGSKJIJZZCEQ-XLKFXECMSA-N	429.861	1.915	50	20	IDGD	
CC(C)N[C@@H](C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1)C(C)C	1817456588	UUTAHGVGDNAJIO-DYESRHJHSA-N	449.600	1.797	50	20	IDGD	
Cc1ccc(CC(=O)N2CCCC[C@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)cn1	1817470424	BCFOBKVLUZMOBG-FQEVSTJZSA-N	447.304	1.342	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)C2CC(=O)C2)[nH]n1	1818113989	BPZMPXMOYCZSMB-KZKMUKRCSA-N	439.476	1.515	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H]2CC2(F)F)n[nH]1	1818839070	WJECDCHCVOMIRN-OCCSQVGLSA-N	433.419	1.369	50	20	IDGD	
COC[C@@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnn4cc(C)cnc34)sc2C1	1819091732	NQYVBYBRUNVYDU-DGCLKSJQSA-N	448.936	1.974	50	20	IDGD	
Cc1ncncc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1	1819869862	OFJCKQHNCMMQCJ-INIZCTEOSA-N	428.497	1.187	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCc2nc(N)n[nH]2)[nH]n1	1820866936	QBXRPBJPQOFTMI-DIFFPNOSSA-N	443.339	1.971	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)Cn2ccncc2=O)[nH]n1	1820868566	JOZSRCJEGLPZRN-ACJLOTCBSA-N	441.319	1.895	50	20	IDGD	
CN[C@H](CC(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](C)Br)n[nH]1)C(=O)O	1822183863	NRVVNNZGDGZTLL-WCQGTBRESA-N	430.303	1.248	50	20	IDGD	
COC[C@@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2nc(C)c(C)[nH]c2=O)[nH]n1	1822367257	JWUCKDZFUVOFAW-TZMCWYRMSA-N	436.900	1.670	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CSc2nc[nH]n2)n[nH]1	1822713610	JEODBJCUGQVPKU-JQWIXIFHSA-N	427.918	1.566	50	20	IDGD	
CC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](O)NC(=O)OC(C)(C)C)CC2	1822856040	SIADDAGGXUNYSG-AMJWSMQMSA-N	446.957	1.916	50	20	IDGD	
COC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1	1823013768	JEKBVKCWIUBFMA-FWWHASMVSA-N	428.711	1.999	50	20	IDGD	
Cc1ccn2c(C(=O)Nc3nc4c(s3)C[C@@H](NC(=O)[C@H](O)CCl)CC4)cnc2c1	1824298910	CBDRUQDXQHBRMF-SMDDNHRTSA-N	433.921	1.925	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)Cc2cncnc2)CC1	1825290662	LUZRQHXAJTWVIR-LJQANCHMSA-N	430.553	1.012	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cn(C)nc2OC)CC1	1825734512	JHBQMVSEIJLOGD-IRXDYDNUSA-N	426.945	1.916	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)C[C@H]1CCCCO1)CC2	1826082743	CBRCMVWWQCFEAM-UONOGXRCSA-N	437.566	1.387	50	20	IDGD	
CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(O)c(F)c1)CC2	1826089034	WIQFGRRZMFGAMD-GFCCVEGCSA-N	449.508	1.587	50	20	IDGD	
O=C(O)CSCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](F)Br)CC2	1826119600	APHYPXNSUBPNJU-KSBSHMNSSA-N	440.316	1.563	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)CCBr)CC1	1826360573	OTVMAVZSJIVXMP-MRXNPFEDSA-N	445.402	1.764	50	20	IDGD	
O=C1NCc2cc(C(=O)N3CCCC[C@@H]3C3CCN(C(=O)[C@@H](O)CCl)CC3)ccc21	1828722817	FZMPNYPZOBGLHA-MOPGFXCFSA-N	433.936	1.763	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H]2CCCS2)CC1	1828926105	ZBLFCTGYVLBKGO-MOPGFXCFSA-N	445.589	1.814	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc3n(n2)CCNC3=O)CC1	1830305466	QRTWBGHFDAFBNC-DOTOQJQBSA-N	435.956	1.877	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CS(C)(=O)=O)CC1	1830317734	SOWRWGQRLPKLSC-RHSMWYFYSA-N	427.394	1.887	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4cccn4cn3)C2)C1	1830361781	CQXKEMMUGQSOAG-OAQYLSRUSA-N	434.924	1.669	50	20	IDGD	
C[C@@H](Cc1ccncc1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2	1830365180	BHFFBAPFJPEVFS-HTAPYJJXSA-N	437.968	1.982	50	20	IDGD	
CCOC(=O)C1(C(=O)N2CCOC[C@]3(CN(C(=O)C(C)(C)CCl)CCO3)C2)CC1	1830365792	HSNUPJPLBUNKGJ-IBGZPJMESA-N	430.929	1.051	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1	1831833223	MNOGWINXWNBTHC-HZPDHXFCSA-N	425.913	1.980	50	20	IDGD	
CN1CCC(C(=O)N2CCC([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)CC1	1831869931	PNPXHJQSJISODE-FQEVSTJZSA-N	435.613	1.321	50	20	IDGD	
Cc1nc(CC(=O)N2CCC([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)cs1	1831871250	PTYZEZCJECIJBJ-LJQANCHMSA-N	449.621	1.987	50	20	IDGD	
Cc1noc(N)c1C(=O)N1CCC([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1	1831871262	NWQDPGLRRBPOHM-MRXNPFEDSA-N	434.541	1.172	50	20	IDGD	
O=C(c1nc(Cl)ccc1F)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1833245453	WRXBAZGFQZIWGL-INIZCTEOSA-N	440.686	1.748	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@H]3CCCCN3C)CC2)CC1	1833319077	PYBLMGJRGFQRSD-RBUKOAKNSA-N	429.005	1.296	50	20	IDGD	
Cc1cccnc1CCC(=O)NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1833780746	XCNXQJZHSFIYBR-HXUWFJFHSA-N	436.984	1.494	50	20	IDGD	
COc1ncc(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)cc1F	1833964076	OKPCKBKHAHSPOJ-KRWDZBQOSA-N	442.919	1.014	50	20	IDGD	
C#CCO[C@@H](C)C(=O)N1CCC(N2CCC(NC(=O)CCBr)CC2)CC1	1834422506	QSMNBFLMVIMENX-HNNXBMFYSA-N	428.371	1.381	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)c1snnc1C1CC1	1835243075	VWTWRCYYYPGAJH-HNNXBMFYSA-N	441.985	1.200	50	20	IDGD	
C[C@@H](CC(N)=O)C(=O)N1CCC(OC2CCN(C(=O)[C@H](F)Br)CC2)CC1	1836911151	UHKJBXFJZGREKD-NHYWBVRUSA-N	436.322	1.187	50	20	IDGD	
CC1CCN(CC(=O)N2CCOC[C@@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)CC1	1837710235	QAECIDAMDONSNQ-NRFANRHFSA-N	441.645	1.026	50	20	IDGD	
C[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)CCSC(=N)N)CC2)CC1	1837865035	KOVNAAAMVAXIMZ-LBPRGKRZSA-N	449.415	1.785	50	20	IDGD	
O=C(c1cc(-c2ccccc2)[nH]n1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1	1838688882	KRMCVMAFZPEJMC-PXNSSMCTSA-N	436.871	1.681	50	20	IDGD	
COc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)ccc1O	1838972861	YCYZAGRXZWMIDR-OAQYLSRUSA-N	440.924	1.736	50	20	IDGD	
CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3c(F)ccnc3Cl)C2)C1	1839142023	BTYNEDOBIJQLCS-XIKOKIGWSA-N	434.295	1.962	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc4ccccc4n3)C2)C1	1839144739	JUCKJRFSTMKKTH-YCRPNKLZSA-N	432.908	1.717	50	20	IDGD	
C=CCC(F)(F)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1	1839889644	HBMIICYWPWWSOT-BXUZGUMPSA-N	429.233	1.345	50	20	IDGD	
CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccnc3)C2)C1	1839963877	ZJMHZEBYAHONJK-CRAIPNDOSA-N	426.311	1.325	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(F)(F)C(F)F)C2)C1	1840030394	KMQMKTOXVVOOHO-RNCFNFMXSA-N	435.212	1.127	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C)cc(F)c3)C2)C1	1840154846	HOVIDDHRBZZPSK-YLJYHZDGSA-N	428.888	1.458	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(CC#N)cc3)C2)C1	1840154875	IMVUIPXRAMIVHE-GHTZIAJQSA-N	435.908	1.076	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3ccccc3F)C2)C1	1840156024	HKPAABPWRZERCT-LAUBAEHRSA-N	442.915	1.469	50	20	IDGD	
O=C(c1snnc1C1CC1)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2	1840187498	FNROGRPMNHFHOH-MRXNPFEDSA-N	435.333	1.289	50	20	IDGD	
Cc1cccc2c(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)C(Cl)Cl)CCO4)n[nH]c12	1840189754	KLANCAFDWYFIFV-LJQANCHMSA-N	441.315	1.745	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC12CN(C(=O)c1cccc(S(C)(=O)=O)c1)C2	1841285108	DFGBDDPQAAJNSK-CYBMUJFWSA-N	443.363	1.938	50	20	IDGD	
C=CC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1	1841352609	AOKCMSMUGMCPTO-QZTJIDSGSA-N	449.935	1.661	50	20	IDGD	
O=C(c1cccc([N+](=O)[O-])c1Br)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1	1841352954	WUQSOWBLZSLDNS-GFCCVEGCSA-N	446.685	1.774	50	20	IDGD	
C=CC[C@@H](CC(=O)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1)NC(=O)OC(C)(C)C	1841354823	YYWVXEXLNMLBLZ-GJZGRUSLSA-N	429.945	1.649	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)Cc2ccc(Br)cn2)C1	1842091350	BSDAQBIRQILLHH-CQSZACIVSA-N	430.730	1.844	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2ccn(C(F)F)n2)C1	1844492913	GCPOVAFODBKKQV-FSJBWODESA-N	433.419	1.229	50	20	IDGD	
COc1ccc(C(=O)CCC(=O)N2CC3(CCCN3C(=O)CCC(=O)NN(C)C)C2)cc1	1846384372	KPYGDWXRYASRHP-UHFFFAOYSA-N	444.532	1.235	50	20	IDGD	
CC(=O)N[C@H](Cc1cccc(F)c1)C(=O)N1CCCC12CN(C(=O)C(Cl)Cl)C2	1847014395	KOECHTKLQUUVBB-OAHLLOKOSA-N	430.307	1.880	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1ccccc1OC(F)(F)F	1847366359	KDPZUCVNYAFUBQ-GJZGRUSLSA-N	442.438	1.774	50	20	IDGD	
COc1cc(C(=O)NNC(=O)NCC(C)(C)N2C[C@@H](C)O[C@H](C)C2)cc(OC)c1OC	10368889	ZLNKSJNTJBEUCX-ZIAGYGMSSA-N	438.525	1.544	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)COc1cccc(C(C)=O)c1	21174005	VPTICPZSRWOLAX-UHFFFAOYSA-N	434.832	1.934	50	20	IDGD	
N#Cc1ccc(OCC(=O)NNC(=O)[C@@H]2CC(=O)N(Cc3ccccc3Cl)C2)cc1	26694321	VTKKGPFWOWSXGB-MRXNPFEDSA-N	426.860	1.787	50	20	IDGD	
Cc1cccc([C@@H](CNC(=O)NNC(=O)CNC(=O)c2cccs2)N2CCOCC2)c1	725874097	XHAZWYJWWBUMIA-QGZVFWFLSA-N	445.545	1.190	50	20	IDGD	
O=C(CNC(=O)c1ccc(O)cc1)NNC(=O)COc1ccc(OCc2ccccc2)cc1	727481974	KWEXNTQFXNNXKC-UHFFFAOYSA-N	449.463	1.927	50	20	IDGD	
N#Cc1cccc(C(=O)NNC(=O)CCn2cnc3ccc(Br)cc3c2=O)c1	728825033	AOZYDLRDGMCCIH-UHFFFAOYSA-N	440.257	1.882	50	20	IDGD	
CN1CC(=O)N(CCCC(=O)NNC(=O)c2ccc(Br)cc2Cl)C1=O	728870610	SSHNTCVKRXWGIA-UHFFFAOYSA-N	431.674	1.538	50	20	IDGD	
COc1cc2c(cc1OC)CN(C(=O)NNC(=O)C1CCN(c3ncccn3)CC1)CC2	728958957	HFSLEHFMIHJKQW-UHFFFAOYSA-N	440.504	1.509	50	20	IDGD	
O=C(CNC(=O)c1ccco1)NNC(=O)[C@H]1CSCN1C(=O)c1ccc(Cl)cc1	729180463	BHZCMMDKNPURHC-CYBMUJFWSA-N	436.877	1.026	50	20	IDGD	
Cc1cc(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)c(N)c([N+](=O)[O-])c1	729533767	GQEWAOCBCVELSZ-UHFFFAOYSA-N	448.505	1.178	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1cccc2c1O[C@H](C)C(=O)N2	729746741	PGCHAVBCSLJUKI-SNVBAGLBSA-N	447.831	1.686	50	20	IDGD	
COc1ccc(S(=O)(=O)NNC(=O)COc2ccccc2O)cc1Br	730812285	NKNRYLOEEWVSOF-UHFFFAOYSA-N	431.264	1.552	50	20	IDGD	
O=C(CNC(=O)c1c(Cl)cccc1[N+](=O)[O-])NNC(=O)c1cc(Br)c[nH]1	731050354	HYQNLJCCSKOSCU-UHFFFAOYSA-N	444.629	1.530	50	20	IDGD	
CC(C)(C(=O)NNC(=O)NCCNS(=O)(=O)c1cccc([N+](=O)[O-])c1)c1ccccc1	731221509	CHYQWBCNNHDBLH-UHFFFAOYSA-N	449.489	1.181	50	20	IDGD	
Cc1c(C(=O)OCC(=O)NNC(=O)c2ccccc2)nnn1-c1ccc(F)c(Cl)c1	731274371	NFXPQMWIGBVEHO-UHFFFAOYSA-N	431.811	1.986	50	20	IDGD	
O=C(NN=Cc1cccc(OCc2ccccc2C(=O)O)c1)N[C@H]1CCS(=O)(=O)C1	731557943	DTNANOAFZDWUKJ-INIZCTEOSA-N	431.470	1.784	50	20	IDGD	
O=C(Cn1cnc2ccccc21)NNC(=O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1	732051081	UDLOAXQRINEWGQ-CQSZACIVSA-N	442.457	1.458	50	20	IDGD	
C[C@H]1CN(CCC(=O)NNC(=O)c2ccc(S(=O)(=O)C3CCCC3)cc2)C[C@H](C)O1	732259887	KTCNENSJUJSMFX-HOTGVXAUSA-N	437.562	1.663	50	20	IDGD	
COc1ccc(C(=O)NNc2ccccc2S(C)(=O)=O)cc1S(=O)(=O)NC1CC1	732304032	PWMXESSCIFMFGD-UHFFFAOYSA-N	439.515	1.296	50	20	IDGD	
O=C(NCCNS(=O)(=O)c1ccccc1)NNC(=O)NCc1ccc(Cl)cc1	733036805	KDLXGGNLXWWXCO-UHFFFAOYSA-N	425.898	1.332	50	20	IDGD	
COc1ccc2[nH]cc(CCNC(=O)NNC(=O)c3csc(N4CCOCC4)n3)c2c1	733336691	ZCANTXXOZPUVTB-UHFFFAOYSA-N	444.517	1.656	50	20	IDGD	
O=C(COC(=O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1)NNC(=O)c1ccccc1	733560250	YPMQFXYCXYHMGP-ZDUSSCGKSA-N	446.441	1.265	50	20	IDGD	
C[C@@H]1CC[C@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)[C@H](C)C1	733651372	MTNQKSCPWQNAIA-RKVPGOIHSA-N	438.550	1.476	50	20	IDGD	
Cn1c(NNC(=O)CC[C@@H]2NC(=O)N(c3ccc(C#N)cc3)C2=O)nc2ccccc2c1=O	733775920	WWBTWXHWLMEICA-KRWDZBQOSA-N	445.439	1.153	50	20	IDGD	
COc1ccc(S(=O)(=O)C[C@H](C)C(=O)OCC(=O)NNC(=O)c2cccs2)cc1	735161177	OVGDYFMSLVJINV-LBPRGKRZSA-N	440.499	1.171	50	20	IDGD	
Cc1ccc([N+](=O)[O-])c(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1	741879741	MMXVPCVWWHPBTL-UHFFFAOYSA-N	432.458	1.763	50	20	IDGD	
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)Cc1ccc(NC(=O)C2CC2)cc1	742468984	LNDMDRVBSXRULZ-UHFFFAOYSA-N	449.555	1.937	50	20	IDGD	
CC(C)=CC(=O)NCc1ccc(C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1	742535736	VJVAODRJCDEQSR-UHFFFAOYSA-N	429.498	1.747	50	20	IDGD	
O=C(Cc1cc(O)nc(O)n1)NN=Cc1cn(Cc2ccccc2)nc1-c1cccnc1	743447866	QPUYFQGSJOVEHF-UHFFFAOYSA-N	429.440	1.887	50	20	IDGD	
CCS(=O)(=O)NC1CCN(C(=O)NNC(=O)c2cccc(Br)c2)CC1	743686341	ANZBXUDXZNXEDI-UHFFFAOYSA-N	433.328	1.207	50	20	IDGD	
COc1ccc(-c2noc(CCC(=O)OCC(=O)NNC(=O)c3ccc(C#N)cc3)n2)cc1	744542368	LIONVDGJDXBEES-UHFFFAOYSA-N	449.423	1.554	50	20	IDGD	
C[C@@H]1C[C@H](NC(=O)NNC(=O)c2cc3c(s2)CCCCC3)C(=O)N1c1cnn(C)c1	745916838	GJIOLGXJVRYMOE-DOMZBBRYSA-N	430.534	1.889	50	20	IDGD	
O=C(NNS(=O)(=O)c1ccc([N+](=O)[O-])cc1Br)c1ccc2c(c1)OCO2	746591109	JQWMIGYDNHYQDV-UHFFFAOYSA-N	444.219	1.709	50	20	IDGD	
C[C@H](Sc1nnnn1C1CC1)C(=O)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1	748517946	AFATZKRZMRODIG-QMMMGPOBSA-N	436.441	1.925	50	20	IDGD	
CCOc1ccc(S(=O)(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)c(C)c1	749153127	ZISNRQHAMKWTDX-UHFFFAOYSA-N	447.922	1.318	50	20	IDGD	
O=C(COCc1ccccc1)NNC(=O)NCc1ccccc1CN1CCC(O)CC1	749588068	CRALKKPDYMRODN-UHFFFAOYSA-N	426.517	1.691	50	20	IDGD	
CC(C)NS(=O)(=O)Cc1ccccc1CNC(=O)NNC(=O)CCc1ccccc1	749918526	UTYZNWLERHTHFO-UHFFFAOYSA-N	432.546	1.978	50	20	IDGD	
O=C(NCc1cccc(C(F)(F)F)c1)NNC(=O)[C@H]1Nc2ccccc2S(=O)(=O)N1	749931744	VWLCHCXNAROSHK-AWEZNQCLSA-N	443.407	1.266	50	20	IDGD	
COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCC(OC[C@H]2CCCO2)CC1	751494849	RIGBHNIKAFQWBQ-MRXNPFEDSA-N	425.913	1.770	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(NC(=O)NNC(=O)c2ccccc2-n2ccnn2)CC1	752408234	XSAMCMWNYYMVBY-UHFFFAOYSA-N	429.481	1.611	50	20	IDGD	
COc1ccccc1-c1cc(C(=O)NNC(=O)c2cc(S(N)(=O)=O)cc(C)c2C)n[nH]1	752625245	CRVVNVIVPVEVOO-UHFFFAOYSA-N	443.485	1.424	50	20	IDGD	
CN1CCN(S(=O)(=O)c2cccnc2NNC(=O)C2(Cc3ccccc3)CC2)CC1	752804309	IHPHODRPZQIYFO-UHFFFAOYSA-N	429.546	1.484	50	20	IDGD	
CC(=O)N1CC[C@@H](CN(C)C(=O)NNC(=O)[C@@H](C)Oc2cccc(Br)c2)C1	754837853	GWYMUBSOWMWJII-OCCSQVGLSA-N	441.326	1.757	50	20	IDGD	
COCCN(C)S(=O)(=O)[C@H]1CCCN(C(=O)NNC(=O)c2ccc3ccccc3c2)C1	755227212	KPYIRYOYBWGGKU-IBGZPJMESA-N	448.545	1.567	50	20	IDGD	
O=C(CNC(=O)c1cccs1)NNC(=O)c1cn(-c2ccc(Br)cc2)cn1	755833659	RBJMFAOSAYBWDM-UHFFFAOYSA-N	448.302	1.887	50	20	IDGD	
Cc1n[nH]cc1C(=O)NNC(=O)Nc1cccc(S(=O)(=O)/N=C2\CCCCCN2C)c1	756164953	IKOTXNLHVVSVKG-KOEQRZSOSA-N	447.521	1.778	50	20	IDGD	
NS(=O)(=O)c1cc(F)cc(NC(=O)NNC(=O)c2cc(Br)ccc2O)c1	756516154	QXENYTDHXXTHIQ-UHFFFAOYSA-N	447.242	1.408	50	20	IDGD	
CCCCn1nc(C(=O)NNC(=O)Nc2cnn(-c3ncccn3)c2)c2ccccc2c1=O	756762321	XOZGTOGHCBCLMZ-UHFFFAOYSA-N	447.459	1.639	50	20	IDGD	
O=C(Cc1ccccc1F)NNC(=O)Nc1cc(C2CC2)nn1[C@@H]1CCS(=O)(=O)C1	756856548	RZZJNMWQJGOLDY-CQSZACIVSA-N	435.481	1.655	50	20	IDGD	
CC(=O)N1CC[C@H](NC(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)c2ccccc21	757789278	RWTQLEZDCDBOAD-KRWDZBQOSA-N	446.533	1.892	50	20	IDGD	
Cc1cc(C(=O)N2CCOCC2)ccc1NC(=O)NNC(=O)COc1ccc(C#N)cc1	757832143	XQIXVHRMPQSRFZ-UHFFFAOYSA-N	437.456	1.571	50	20	IDGD	
COC(=O)C[C@@H](C)C(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1	758378465	NYOPWMNSSBBXRA-LLVKDONJSA-N	425.488	1.509	50	20	IDGD	
CN(NC(=O)c1cccc(OCC(F)F)n1)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	758785195	CIIVZBWQZIXLQH-UHFFFAOYSA-N	443.451	1.975	50	20	IDGD	
CC(C)(C)OC(=O)NC[C@H]1CCCC[C@@H]1NC(=O)NNC(=O)C(=O)Nc1ccccn1	758814267	YZLBAFPBELSYCM-KGLIPLIRSA-N	434.497	1.434	50	20	IDGD	
Cc1ccc(N2N=C(Br)C[C@@H]2C(=O)NNC(=O)C(=O)Nc2ccccn2)cc1	758826397	CVIUNHRYHLGZEA-CYBMUJFWSA-N	445.277	1.463	50	20	IDGD	
CC(C)(C)OC(=O)N(CCNC(=O)NNC(=O)C(=O)NC1CC1)C1CCCCCC1	758907181	YGAFFIRLKKOXLK-UHFFFAOYSA-N	425.530	1.555	50	20	IDGD	
CC(=NNC(=O)Cc1cc(O)nc(O)n1)c1ccc(CNC(=O)OC(C)(C)C)nc1C	760250283	XQZZWJRMKAPGAI-UHFFFAOYSA-N	430.465	1.699	50	20	IDGD	
Cc1nn(CC(F)F)c(C)c1C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	760797242	GPMJJWRCNQNKGB-UHFFFAOYSA-N	435.840	1.141	50	20	IDGD	
Cc1sc(Cl)nc1C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	762863967	IDYGDYKRXSZOCM-UHFFFAOYSA-N	429.955	1.798	50	20	IDGD	
C[C@H](CC(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1)[C@H]1CCCN(C(=O)OC(C)(C)C)C1	763305729	YJEZGDQTWFTGBH-QLFBSQMISA-N	446.570	1.177	50	20	IDGD	
CC[C@H](C)NC(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1	763472207	UAVVIJGNSXTBFI-LBPRGKRZSA-N	427.417	1.523	50	20	IDGD	
Cc1nnnn1-c1cccc(NC(=O)C(=O)NNC(=O)c2ccccc2Br)c1	763483114	NHONVNVQOSFMSD-UHFFFAOYSA-N	444.249	1.133	50	20	IDGD	
COc1cc(C(=O)NNC(=O)C(=O)N2CCc3c(Cl)cccc32)cc(OC)c1OC	763540744	YYIQVNUQTMPHIC-UHFFFAOYSA-N	433.848	1.716	50	20	IDGD	
Cc1nn(-c2ccccc2)c(C)c1NC(=O)C(=O)NNC(=O)[C@H]1COc2ccccc2O1	763578348	OSWOUEKFFIJGRY-GOSISDBHSA-N	435.440	1.415	50	20	IDGD	
CCNC(=O)COc1ccc(NC(=O)C(=O)NNC(=O)c2cc(C)nc3ccccc23)cc1	763619119	OQDIANLQVQFAEG-UHFFFAOYSA-N	449.467	1.458	50	20	IDGD	
Cc1nc2ccccn2c1C(=O)NNC(=O)C(=O)Nc1cccc(C#Cc2ccccn2)c1	763625531	SVTBXPGYUNFIRV-UHFFFAOYSA-N	438.447	1.837	50	20	IDGD	
COc1cccc(-c2nsc(NC(=O)C(=O)NNC(=O)COc3cccc(C)c3)n2)c1	763630499	MMIHXGXSCJYREF-UHFFFAOYSA-N	441.469	1.687	50	20	IDGD	
CCNC(=O)Nc1cccc(NC(=O)C(=O)NNC(=O)COc2cc(C)cc(C)c2)c1	763650828	QSLGFNJCZSGOGZ-UHFFFAOYSA-N	427.461	1.610	50	20	IDGD	
O=C(CN1CCCc2ccccc21)NNC(=O)C(=O)Nc1cnn(Cc2ccccc2)c1	763729006	SSQVRRKGHBERMJ-UHFFFAOYSA-N	432.484	1.470	50	20	IDGD	
Cc1ccc(OCC(=O)NNC(=O)C(=O)Nc2ccc(Cl)c(C(=O)N(C)C)c2)cc1	763814533	WFZTUPZDAMLQMC-UHFFFAOYSA-N	432.864	1.515	50	20	IDGD	
C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)C(=O)Nc1ccc(-n2cnnn2)cc1	763854235	OQXCDBUBBQJUHM-AWEZNQCLSA-N	445.439	1.369	50	20	IDGD	
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)C(=O)Nc1cccc(C(=O)NC2CC2)c1	763858704	WDWYFXYFPMRUOP-LBPRGKRZSA-N	428.420	1.271	50	20	IDGD	
CC(C)Oc1ccc(NC(=O)C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)c(F)c1	763945420	XNKIUSMHHDNFME-UHFFFAOYSA-N	441.419	1.904	50	20	IDGD	
N#Cc1cccnc1-n1cc(NC(=O)C(=O)NNC(=O)c2cccc(C(F)(F)F)c2)cn1	764041159	VLZHMQHLCWRKEZ-UHFFFAOYSA-N	443.345	1.557	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(F)cc2Br)c(OC)n1	764085816	OVUBCNXEQLTIBM-UHFFFAOYSA-N	441.213	1.400	50	20	IDGD	
CCCCS(=O)(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(C)cc2O)cc1	764104670	CPNWUSRLCNXDIU-UHFFFAOYSA-N	448.501	1.642	50	20	IDGD	
Cc1cc(C(=O)NNC(=O)C(=O)Nc2cccc(COc3ccc(CC#N)cc3)c2)n[nH]1	764107103	ZDWHEOVSRBKUMK-UHFFFAOYSA-N	432.440	1.763	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C(=O)N(C)OC)cc2)o1	764138667	HFWCXKWPGNAOHX-UHFFFAOYSA-N	445.476	1.155	50	20	IDGD	
C#CCOc1cc(F)ccc1NC(=O)C(=O)NNC(=O)c1ccc(CN(CC)CC)o1	764139051	NOYGNDHYLZIRAO-UHFFFAOYSA-N	430.436	1.672	50	20	IDGD	
CN(C)C(=O)COc1cccc(NC(=O)C(=O)NNC(=O)CCCc2ccccc2)c1	764226430	LSZDNRAKOIDGGN-UHFFFAOYSA-N	426.473	1.262	50	20	IDGD	
C[C@@H]1CCCCN1C(=O)c1ccc(NC(=O)C(=O)NNC(=O)c2cccc(C#N)c2)cc1	764233514	ACSUBNWMFXXXDO-OAHLLOKOSA-N	433.468	1.973	50	20	IDGD	
O=C(COc1ccccc1O)NNC(=O)C(=O)Nc1ccc(Br)c(F)c1	764274856	FLLVTNREJLWBLD-UHFFFAOYSA-N	426.198	1.459	50	20	IDGD	
O=C(NNC(=O)c1cc(F)ccc1Br)C(=O)Nc1c[nH]nc1-c1ccccn1	764278465	SFUXJKYISKEONZ-UHFFFAOYSA-N	447.224	1.773	50	20	IDGD	
CCC(=O)Nc1ccc(NC(=O)C(=O)NNC(=O)c2cc(Br)ccc2O)cc1	764281042	WHQAMRQUYUGEBI-UHFFFAOYSA-N	449.261	1.903	50	20	IDGD	
COc1ccc(COc2cccc(F)c2)cc1NC(=O)C(=O)NNC(=O)Cc1cc[nH]n1	764292906	ITKXRPFQNSWFJN-UHFFFAOYSA-N	441.419	1.465	50	20	IDGD	
Cc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(NC(=O)NCc3ccco3)cc2)o1	764368155	SCJVXUXFFVDELU-UHFFFAOYSA-N	425.401	1.902	50	20	IDGD	
O=C(NNC(=O)C(F)(F)Oc1ccccc1)C(=O)Nc1ccc2c(c1)OC(F)(F)O2	764371098	XGVLBWVQKMWVCL-UHFFFAOYSA-N	429.282	1.766	50	20	IDGD	
O=C(CCNS(=O)(=O)c1cccc(Cl)c1)NNC(=O)CSc1ccccc1O	765248535	IQDDBSITQQPSLM-UHFFFAOYSA-N	443.934	1.654	50	20	IDGD	
O=C(COc1ccc2ccccc2c1)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	765738661	MCXWHJWYBCXGFP-UHFFFAOYSA-N	446.507	1.824	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)[C@H]1CC(=O)N(c2ccc(F)cc2)C1	767332907	FDGAZADWTHAKJQ-INIZCTEOSA-N	427.432	1.420	50	20	IDGD	
Cc1ccccc1CC(=O)NNC(=O)COC(=O)[C@H]1CCCN(C(=O)NCC(C)C)C1	767344340	MSXIOADJAXXKPM-SFHVURJKSA-N	432.521	1.306	50	20	IDGD	
CC(C)(O)C(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)C12CC3CC(CC(C3)C1)C2	768260322	BAPUQWNHLJALIQ-PQLNIDLTSA-N	427.545	1.849	50	20	IDGD	
O=C(NNS(=O)(=O)c1cc2nc(O)[nH]c2cc1Br)c1ccc(Cl)nc1	768499096	OJKVVBFZAJZQTK-UHFFFAOYSA-N	446.670	1.703	50	20	IDGD	
COc1cccc(S(C)(=O)=O)c1NNC(=O)CCC(=O)Nc1nnc(C(C)C)s1	768629039	DJOLZUASKQJQOM-UHFFFAOYSA-N	441.535	1.936	50	20	IDGD	
N#Cc1cc(Cl)nc(NNC(=O)c2ccc(S(=O)(=O)NC[C@@H]3CCCO3)cc2)c1	768708689	ZXUKMPKMAIQFHH-AWEZNQCLSA-N	435.893	1.821	50	20	IDGD	
COc1ccc2c(c1)nc(CNC(=O)NNC(=O)C1CCN(c3ncccn3)CC1)n2C	770390667	VVBPFFMZJDQLTL-UHFFFAOYSA-N	438.492	1.119	50	20	IDGD	
CCc1c(C(=O)OCC(=O)NNC(=O)c2ccc(C#N)cc2)cnn1-c1ccc(OC)cc1	770559725	HWLHGFOSYYAOIZ-UHFFFAOYSA-N	447.451	1.933	50	20	IDGD	
COCCCS(=O)(=O)NCC(=O)NNC(=O)c1cc(-c2ccco2)nc2ccccc12	770749018	MERHAIWEAOZKMD-UHFFFAOYSA-N	446.485	1.212	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)C(=O)c1ccc(Br)cc1	772889685	SBJIZCMOSMOMPK-UHFFFAOYSA-N	438.665	1.749	50	20	IDGD	
C[C@H](Oc1cccc(Cl)c1)C(=O)NNC(=O)[C@](C)(O)CN1Cc2ccccc2C1=O	772968110	CHELTAPWLNMADH-YEJXKQKISA-N	431.876	1.662	50	20	IDGD	
COc1ccc(CCC(=O)NNC(=O)C(=O)Nc2cc(C)nn2-c2ccc(C)nn2)cc1	773497576	XRDPENBMZFYURG-UHFFFAOYSA-N	437.460	1.006	50	20	IDGD	
O=C(NCCc1ccc(OCC(F)(F)F)nc1)NNC(=O)[C@H]1COc2ccccc2O1	773613551	PFMKXPWFJKPWCQ-OAHLLOKOSA-N	440.378	1.736	50	20	IDGD	
Cc1c(NC(=O)C(=O)NNc2ccccc2[N+](=O)[O-])cccc1S(=O)(=O)NC1CC1	773650442	JWNAMBJWEKNGQU-UHFFFAOYSA-N	433.446	1.426	50	20	IDGD	
COc1ccnc(NNC(=O)C(=O)Nc2ccc(OCc3noc(C4CC4)n3)cc2)n1	773731779	VHOLSOXYLQEYPK-UHFFFAOYSA-N	425.405	1.406	50	20	IDGD	
CCOc1ccc(C(=O)NNC(=O)NCc2ccc(S(N)(=O)=O)c(C)c2)cc1OC	775222207	KEMMWPBCGVIHSN-UHFFFAOYSA-N	436.490	1.194	50	20	IDGD	
O=C(Cc1cccc2ccccc12)NNC(=O)Nc1ccc(C[C@@H]2NC(=O)NC2=O)cc1	775704450	FSLDLUVPPDEKFA-IBGZPJMESA-N	431.452	1.986	50	20	IDGD	
Cc1c(C(=O)N2CCN(S(=O)(=O)CBr)CC2)cnn1-c1ccccc1F	777779917	UEFNEQQIYSFDQM-UHFFFAOYSA-N	445.314	1.760	50	20	IDGD	
O=C1CCc2cc(NC(=O)C(=O)NNC(=O)c3cc(-c4ccccc4)on3)c(F)cc2N1	778709617	JDXYWMQPGZLTBM-UHFFFAOYSA-N	437.387	1.765	50	20	IDGD	
COc1ccc(C(=O)N2CCN(S(=O)(=O)CCCCCl)CC2)c(OC)c1OC	780806966	CXFJEKHFZJNLDC-UHFFFAOYSA-N	434.942	1.819	50	20	IDGD	
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)[C@@H]1CC(c2ccccc2[N+](=O)[O-])=NO1	781962040	KSBORFUQLNEFRP-SFHVURJKSA-N	445.457	1.672	50	20	IDGD	
COc1ccccc1[C@@](N)(C(=O)NNC(=O)[C@H]1COc2ccccc2O1)C(F)(F)F	782161550	BHRZPCGYGIFIGS-CRAIPNDOSA-N	425.363	1.399	50	20	IDGD	
CCNC(=O)N(C)NS(=O)(=O)c1ccc(S(=O)(=O)N2C[C@@H](C)C[C@H](C)C2)cc1	782478143	IBGJQBULYBTWKI-KBPBESRZSA-N	432.568	1.208	50	20	IDGD	
Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)C(=O)Nc1cccc(C(C)C)c1	782896552	KCKRHAHEHMIWQA-UHFFFAOYSA-N	431.518	1.811	50	20	IDGD	
CCC(CC)NC(=O)[C@H]1CN(C(=O)C(=O)NNc2cc(C)ncn2)c2ccccc2O1	783940388	SEYVYIXFDCGUDE-QGZVFWFLSA-N	426.477	1.327	50	20	IDGD	
O=C(NNC(=O)c1ccc(F)cn1)c1cccc(S(=O)(=O)NCc2ccccc2)c1	784591033	JTHIENBCQZNEBD-UHFFFAOYSA-N	428.445	1.774	50	20	IDGD	
CCCn1nc(C(=O)NNC(=O)C2CN(C(=O)OC(C)(C)C)C2)c2ccccc2c1=O	785012985	QCFTZIPACDXFNK-UHFFFAOYSA-N	429.477	1.434	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)Cc2ccncc2)cc1S(=O)(=O)N1CCCC1	786128562	XCFDKTBIYNSQCF-UHFFFAOYSA-N	433.490	1.270	50	20	IDGD	
CN(CCOc1ccc(C(F)(F)F)cc1)C(=O)NNC(=O)CNC(=O)c1ccco1	787263937	ZPDNECWWKRQJQP-UHFFFAOYSA-N	428.367	1.780	50	20	IDGD	
COc1ccc(-c2nnc(S)n2CC(=O)NNc2ccccc2S(N)(=O)=O)cc1	788222901	BVLPRLYELGRULA-UHFFFAOYSA-N	434.503	1.033	50	20	IDGD	
C[C@H](NC(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1)c1ncnn1C	788888648	DKTWWPHTUPHFJG-AWEZNQCLSA-N	446.475	1.222	50	20	IDGD	
COC(=O)c1c(NC(=O)C(=O)NNC(=O)[C@H]2OCC[C@H]2c2ccccc2)sc(C)c1C	789810352	MXRXBSNXZAKQIX-HOCLYGCPSA-N	445.497	1.810	50	20	IDGD	
Cc1cccc(C(=O)NNC(=O)N2CCN(S(=O)(=O)c3ccc(Cl)s3)CC2)n1	793220183	LHKDRPRZTVXDLP-UHFFFAOYSA-N	443.938	1.466	50	20	IDGD	
CSCC[C@@H](NS(=O)(=O)/C=C\c1ccccc1)C(=O)NNC(=O)c1cccc(C)n1	794081027	YTJAUZZDDWSPAA-RXXLQFRUSA-N	448.570	1.863	50	20	IDGD	
O=C(NCc1ccc(Cl)cc1)C(=O)NNS(=O)(=O)CCc1cccc(Cl)c1	795343858	QVKRTXOJOOCTMQ-UHFFFAOYSA-N	430.313	1.803	50	20	IDGD	
Cc1ccc(N2CCOCC2)cc1NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12	797687196	QARKBFBTBBWRMV-UHFFFAOYSA-N	436.472	1.545	50	20	IDGD	
CN(CCNC(=O)NNC(=O)c1cc2ccccc2o1)S(=O)(=O)c1ccc(F)cc1	798066826	HYEWEQLGUHKMPS-UHFFFAOYSA-N	434.449	1.837	50	20	IDGD	
COc1cc(C(=O)NNS(=O)(=O)c2ccc(C(=O)N(C)C)cc2)ccc1OC(C)C	799519973	BZERFGFONZOQEK-UHFFFAOYSA-N	435.502	1.808	50	20	IDGD	
O=C(Cn1cc(NS(=O)(=O)c2ccc(OCCBr)cc2)cn1)NC1CC1	799521580	APJJQXWXEVCVSH-UHFFFAOYSA-N	443.323	1.736	50	20	IDGD	
CCC(=O)NNC(=O)[C@@H](C)OC(=O)c1cc([N+](=O)[O-])cc(I)c1C	801479384	ZYQARHRCESMNNW-MRVPVSSYSA-N	449.201	1.611	50	20	IDGD	
O=C(COC(=O)c1ccc(CN2CCCC2)cc1)NNC(=O)[C@@H]1COc2ccccc2O1	801868362	QNSWBZLZKYAAMX-FQEVSTJZSA-N	439.468	1.427	50	20	IDGD	
O=C(CCNS(=O)(=O)c1ccc2c(c1)OCCCO2)NNC(=O)Nc1ccccc1	801990584	QBXPNXVXXUJBKD-UHFFFAOYSA-N	434.474	1.369	50	20	IDGD	
CSCC[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)NNC(=O)N=c1cc[nH]cc1	802032448	RPPSPMVOBJQNAD-OAHLLOKOSA-N	432.462	1.116	50	20	IDGD	
COc1ccc(NC(=O)NNC(=O)[C@H](C)NC(=O)c2cc3c(C)nn(C)c3s2)cc1	802063254	XAIIQZYGXWBVFJ-NSHDSACASA-N	430.490	1.923	50	20	IDGD	
COc1ccc(CN2CC[C@H](NC(=O)NNC(=O)c3ccccc3C)C2=O)c(OC)c1	804868757	OQGYGZUKGSJJKL-SFHVURJKSA-N	426.473	1.757	50	20	IDGD	
Cn1ncc(CNC(=O)/C(C#N)=C/c2cn(CCC(N)=O)nc2-c2ccc(Cl)cc2)n1	805204467	VSBZTPCHNITAHN-RIYZIHGNSA-N	438.879	1.431	50	20	IDGD	
CC(C)(C)OC(=O)N1CCOC[C@H]1CC(=O)NNC(=O)c1nn(-c2ccccc2)cc1O	806346223	JFBTUZITHVJFIM-OAHLLOKOSA-N	445.476	1.365	50	20	IDGD	
CC(C)n1ncc2c(C(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)cc(-c3cccs3)nc21	807299825	UYGLCCAFBKANTG-GFCCVEGCSA-N	447.542	1.936	50	20	IDGD	
COCCN(C)NC(=O)c1ccc(NC(=O)C[C@@H]2SC(N3CCCC3)=NC2=O)cc1	808073988	WIUDUKUFIISHCL-INIZCTEOSA-N	433.534	1.332	50	20	IDGD	
COCCCNC(=O)NNS(=O)(=O)c1cc(Cl)c(OCCOC)c(Cl)c1	808081634	RZRNHCBVIJQVOT-UHFFFAOYSA-N	430.310	1.548	50	20	IDGD	
Cc1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2cc(F)ccc2Br)cc1	810345370	VPHHWDURWKNHFS-UHFFFAOYSA-N	444.282	1.636	50	20	IDGD	
N#Cc1ncn(-c2ccccc2NC(=O)C(=O)NNC(=O)c2cc3ccccc3cc2O)n1	810385419	RZMOLELJUOGEPC-UHFFFAOYSA-N	441.407	1.397	50	20	IDGD	
O=C1CSc2cc(C(=O)N3CCN(S(=O)(=O)CBr)CC3)ccc2N1	810911763	MDOLUNCTGJVFDA-UHFFFAOYSA-N	434.337	1.171	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(=NNC(=O)Cc2cc(O)nc(O)n2)[C@H]([C@@H]2CCOC2)C1	812226855	VEHFWPLJZHPVAP-OCCSQVGLSA-N	435.481	1.196	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(=NNC(=O)CNC(=O)c2ccco2)[C@@H]([C@@H]2CCOC2)C1	812227252	WHQGXUPFEIOCKU-HUUCEWRRSA-N	434.493	1.775	50	20	IDGD	
COCCn1nnc2c1CCN(C(=O)NNC(=O)c1ccc(COc3ccccc3)o1)C2	814358451	OJJAMEGOVTZJQL-UHFFFAOYSA-N	440.460	1.509	50	20	IDGD	
CN(Cc1ccccc1)c1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2CCc3nncn3C2)cc1	815691918	FMXARJLDPAOLGN-QGZVFWFLSA-N	447.499	1.263	50	20	IDGD	
COc1ccc(NC(=O)C(=O)NNc2ncncc2F)c(I)c1	815765178	IJDDYJOXXISLQS-UHFFFAOYSA-N	431.165	1.311	50	20	IDGD	
Cc1ccc(NC(=O)C(=O)NNC(=O)c2c[nH]nc2-c2ccc3c(c2)OCCO3)cc1C	837297786	DIGWHRGQRPLUDT-UHFFFAOYSA-N	435.440	1.864	50	20	IDGD	
C[C@H]1CCc2sc(C(=O)NNC(=O)CNS(=O)(=O)c3ccccc3F)cc2C1	913162503	RRGGLBNCPHMQGO-NSHDSACASA-N	425.507	1.752	50	20	IDGD	
CCOc1ccc(OCc2ccc(C(=O)NNC(=O)CN(C)S(C)(=O)=O)cc2)cc1	914710915	LBQAGQCBNYXABP-UHFFFAOYSA-N	435.502	1.317	50	20	IDGD	
COc1ccnc(NNC(=O)C2CCN(S(=O)(=O)c3ccc4c(c3)CCCC4)CC2)n1	914763110	NRKHXWDJJRYVNM-UHFFFAOYSA-N	445.545	1.908	50	20	IDGD	
COC(=O)c1sc2ncc(C(C)=NNC(=O)CSc3nnc(O)nc3O)cc2c1C	914773672	QCFOWBQQPNCAPD-UHFFFAOYSA-N	448.486	1.620	50	20	IDGD	
CCN(CC)CCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1	915879102	PMDUXWVQXCGGIE-UHFFFAOYSA-N	425.555	1.147	50	20	IDGD	
CCN1CCC(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(CC)CC)c2)CC1	915903336	FUABOZLHPOMJRU-UHFFFAOYSA-N	425.555	1.145	50	20	IDGD	
O=C(CCCC(=O)NNC(=O)Cc1ccc(F)cc1)NNC(=O)Cc1ccc(F)cc1	916143410	CKWLZBUSXNEJRH-UHFFFAOYSA-N	432.427	1.215	50	20	IDGD	
Cc1cc(C)n(CC(=O)NNC(=O)NC[C@@H](c2ccccc2Cl)N2CCOCC2)n1	916437770	QHERYKFSOMFWLC-SFHVURJKSA-N	434.928	1.557	50	20	IDGD	
CC(C)CCOc1ccc(C(=O)NNC(=O)NCCCn2nc3n(c2=O)CCCC3)cc1	916650210	UDYBEUVAIGQSSR-UHFFFAOYSA-N	444.536	1.840	50	20	IDGD	
CCCc1c(C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)[nH]c(C)c1C(=O)OC	916734341	BELRQUMYFYBAPR-UHFFFAOYSA-N	449.533	1.739	50	20	IDGD	
COc1cc(Cl)ccc1C(=O)NNS(=O)(=O)c1cc2c(cc1F)NC(=O)CC2	917731698	MLSQCZNUTSFWNA-UHFFFAOYSA-N	427.841	1.996	50	20	IDGD	
CCN(CC)Cc1ccc(C(=O)NNC(=O)c2ccc3c(=O)n(CC)c(O)nc3c2)o1	920272410	TVSNYWOSYWHNRA-UHFFFAOYSA-N	427.461	1.632	50	20	IDGD	
Cc1ccc(SCC(=O)NNC(=O)Nc2ccc(CN3C(=O)CNC3=O)cc2)cc1	920932007	OKSQNJMRVVNNJU-UHFFFAOYSA-N	427.486	1.992	50	20	IDGD	
COC(=O)/C=C\c1cc(OC)c(OC)c(S(=O)(=O)NNC(=O)NCc2ccco2)c1	921020398	JAZQBMAYFSHXEN-SREVYHEPSA-N	439.446	1.176	50	20	IDGD	
O=C(COC(=O)c1ccc(Cn2cccn2)cc1)NNC(=O)[C@@H]1COc2ccccc2O1	928977172	VXEXWWPIZDJCJA-IBGZPJMESA-N	436.424	1.076	50	20	IDGD	
N#C/C(=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)NCCN1CCC1	1116362693	WTUWQDBHVJPDTO-VBKFSLOCSA-N	426.908	1.808	50	20	IDGD	
CCCCCn1nc(C(=O)NNC(=O)NCc2nnc(C)n2C)c2ccccc2c1=O	1318329802	VUVIXIVWPFZFLT-UHFFFAOYSA-N	426.481	1.168	50	20	IDGD	
CS(=O)(=O)c1cccc(C(=O)NNC(=O)NC2CCN(c3cccc(F)c3)CC2)c1	1318767371	NQNPMAWKKBAWIG-UHFFFAOYSA-N	434.493	1.842	50	20	IDGD	
COc1ccc(CCN2C[C@H](C(=O)NNc3nncc(N)c3Cl)CC2=O)cc1OC	1319217917	AKDOPZSJJODNIA-GFCCVEGCSA-N	434.884	1.264	50	20	IDGD	
Cc1nc(N2CCOCC2)nc(O)c1CCC(=O)NNc1cncc(Br)c1	1319761638	JEBOZPOMTQZYLJ-UHFFFAOYSA-N	437.298	1.561	50	20	IDGD	
CCO[C@@H]1C[C@H](NC(=O)NNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)[C@@]12CCCO2	1320453932	CUGSNVXDVBQRCB-MRUHUIDDSA-N	440.541	1.691	50	20	IDGD	
CC[C@@H](N=c1nn[nH]n1-c1ccccc1)C(=O)NNC(=O)Nc1cc(OC)ccc1Cl	1321310001	MYSQCPDZHLFANE-OAHLLOKOSA-N	444.883	1.790	50	20	IDGD	
CC(C)(C)OC(=O)N1CCC(C(=O)NNS(=O)(=O)c2cccc3c2OCCO3)CC1	1321909440	IMBFNWIKLWRWCB-UHFFFAOYSA-N	441.506	1.414	50	20	IDGD	
CN(CCO)S(=O)(=O)c1ccc(C(=O)NNc2ccc(F)cc2Br)cc1	1325107233	IACUKJWHZAEXSJ-UHFFFAOYSA-N	446.298	1.958	50	20	IDGD	
O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2)c1cn2ccsc2n1	1779089562	FTDLKYKPZQTAFK-PMUMKWKESA-N	426.926	1.123	50	20	IDGD	
Cc1cc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)nn1C(F)F	1780306856	PQOWIXKCWQOHMZ-MEDUHNTESA-N	435.269	1.814	50	20	IDGD	
O=C(c1cn2c(F)cccc2n1)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1	1781332270	FLNXXPXGFWZTAS-PBHICJAKSA-N	443.248	1.607	50	20	IDGD	
C[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)C2)C1	1781765903	LKSSJSOXOSWCMC-DIFFPNOSSA-N	444.257	1.961	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(C)c(C(=O)O)c(C)c3)C2)C1	1782174864	XRTBRDYSWUQZOC-KKSFZXQISA-N	438.908	1.699	50	20	IDGD	
COc1ccc(F)cc1CC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2	1782295177	LYSNWCWMXNVJGF-HGHGUNKESA-N	442.915	1.490	50	20	IDGD	
Cc1ccn2c(C(=O)N3CC[C@]4(C3)CN(C(=O)[C@@H](C)Br)CCO4)cnc2c1	1782491974	GUPVDFITCWSACH-KUHUBIRLSA-N	435.322	1.870	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)/C=C/C(=O)c3cccs3)CCO2)C1	1783874717	GUXOVLRUUQLUKA-FSEUQFBXSA-N	426.922	1.571	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccnc4c(O)cccc34)CCO2)C1	1783881857	NDUGDNOGMGTWIC-KKSFZXQISA-N	433.892	1.638	50	20	IDGD	
Cc1nc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]3C2)c(C(F)(F)F)o1	1784090431	GBMTYHSDMJESPS-YFKTTZPYSA-N	439.818	1.195	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(CO)c(F)c3)C2)C1	1785268693	UIVIOXQVQSXQEI-RTBURBONSA-N	433.307	1.998	50	20	IDGD	
C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)c3ccccc3)[C@H]2C1	1786669270	XDLYWPSBEHKVHX-SRQBIAJPSA-N	425.323	1.483	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CNC(=O)c3ccco3)[C@H]2C1	1787082949	PMQNSROPRJOZQD-NGOJXBLDSA-N	446.331	1.225	50	20	IDGD	
O=C(CC1CCOCC1)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1	1787918180	IJCVFAWZFGAVDG-UHFFFAOYSA-N	436.317	1.931	50	20	IDGD	
COc1cc(C(=O)NC2(c3ccc(NC(=O)c4cccc(B(O)O)c4)cc3)CCC2)nn1C	1788147875	MLJRHTHQKFMKRY-UHFFFAOYSA-N	448.288	1.170	50	20	IDGD	
COc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Br)C[C@@H]32)cc1	1789592985	KYUZMCJDTKRJIY-QCEMKRCNSA-N	429.286	1.979	50	20	IDGD	
O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=N/N3CCCCC3)C[C@@H]21)[C@H](F)Br	1789926433	XZDJWEZWDMVZFB-LOOQHYCCSA-N	433.322	1.128	50	20	IDGD	
CCOCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C(C#N)=C/c3ccc(F)cc3F)[C@H]2C1	1790693588	RZFNNCJNYBZQSM-TYDTZWSASA-N	433.455	1.888	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nc4ccccn4n3)C[C@@H]21	1791057119	CTMDYZZUWUFCCL-XUXIUFHCSA-N	436.310	1.106	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC1(c2ccc(NC(=O)CCn3ccnn3)cc2)CCC1	1791888250	FIUAWPQZUHAVML-UHFFFAOYSA-N	427.509	1.175	50	20	IDGD	
CC[C@H](NC(=O)OC(C)(C)C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21	1792128537	CYDJOXKUPSYKPF-YTFOTSKYSA-N	435.924	1.804	50	20	IDGD	
COc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](O)CCl)C3)c(Cl)c1OC	1792683186	BIJRVSRCIHWVID-DZJQYVJYSA-N	447.315	1.160	50	20	IDGD	
CC(C)(CCl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H]1CCc3nc(O)nc(O)c3C1)C2	1792879798	YUXIUSPRTDBAPB-FQUUOJAGSA-N	436.940	1.896	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccnc1-c1ccc(F)cc1)C2)[C@H](O)CCl	1792978580	HBCFWIMSJNIZTB-WTLGNFPFSA-N	447.894	1.691	50	20	IDGD	
CCC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/C(=O)NCc1ccco1)C2	1793448815	JVXCPGDNSMAGPH-WEPLXLJNSA-N	437.924	1.449	50	20	IDGD	
Cn1ncc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CO[Si](C)(C)C)C3)c1C(F)(F)F	1794276630	YRWTZROFLFZZSO-JJLQDPRZSA-N	448.518	1.494	50	20	IDGD	
N#Cc1ccc(CCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)cc1	1796185670	FHRJKOBOCWXUIQ-KOUNCHBCSA-N	431.301	1.123	50	20	IDGD	
O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1cc(F)cc(F)c1)c1ccc(B(O)O)cc1	1796280417	CHNCDKAPRMPABX-ACDBMABISA-N	428.244	1.139	50	20	IDGD	
CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnn2ccccc12	1796842701	HIVQEXBNWHIYAY-YXPYIKCWSA-N	435.322	1.711	50	20	IDGD	
COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CO[Si](C)(C)C	1797956762	YGZXFJKPTMBHBR-KMOPNRPKSA-N	438.597	1.183	50	20	IDGD	
C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CC(c3ccccc3)=NN1)C2	1797957280	KAJQPNWIJFRATC-NZGUISNBSA-N	444.608	1.194	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cncc2cnccc12	1799141491	JBZVJWGSYBTKJR-MUJYYYPQSA-N	445.483	1.194	50	20	IDGD	
CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc([N+](=O)[O-])cc3c1OCC3)C2	1799269344	XRYLRSHMZVMWDS-DLTLXFJOSA-N	437.880	1.750	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1Cc3ccccc3N1)C2)[C@@H](F)Br	1799346537	BKXXBEMORGCUJS-PTNZTPPNSA-N	426.286	1.303	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1cccn2nccc12	1799973706	FDARYIUQCOEDKT-BAESOJJISA-N	425.258	1.228	50	20	IDGD	
COCCOCCOCCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@](C)(Cl)CCl	1800084389	JZJCIXXWOQGLBG-RCJHGTSTSA-N	439.380	1.931	50	20	IDGD	
O=C(/C=C/C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](F)Br)NCc1ccco1	1800158496	NSHKSINJJMUGCR-GINROYPMSA-N	442.285	1.781	50	20	IDGD	
O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)[C@@H]1CCc2cccc(Cl)c21	1800325460	CDBYIWFAPYPTBU-HEBKJCSOSA-N	427.328	1.559	50	20	IDGD	
CCC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1CCC2(CC1)OCCO2	1800379165	COIPUIWKERZYSH-MHORFTMASA-N	428.957	1.917	50	20	IDGD	
O=C(C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](Br)Cc1ccccc1)C1CC1	1800433650	YQXUXLCWAGTEDJ-XMTFNYHQSA-N	449.345	1.561	50	20	IDGD	
COc1ccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)Br)cc1F	1800762839	GNPJUVGJYBESLZ-GNTLTTKYSA-N	443.313	1.750	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(C(N)=O)cc1	1801657063	OZKWXGFCIWCOPX-NXEZDXNNSA-N	428.316	1.225	50	20	IDGD	
C[C@H](CBr)C(=O)NC[C@@H]1CCN(C(=O)c2ncnn2C)[C@H]1c1cccnc1	1803007417	AHEAWHZDIHGNSK-SNPRPXQTSA-N	435.326	1.561	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)C1=CCCS1	1803634864	UHWJMZIXMSEFSW-PXNSSMCTSA-N	437.330	1.102	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)C(C)(C)CNC(C)=O)[C@H]1c1cccnc1	1803720281	MMGPEZPHCBCEBC-OKZBNKHCSA-N	438.956	1.504	50	20	IDGD	
O=C(Cn1cc([N+](=O)[O-])cn1)NC[C@@H]1CCN(C(=O)C(Cl)Cl)[C@@H]1c1cccnc1	1804421301	PAYOUDMFZVJDHB-SWLSCSKDSA-N	441.275	1.696	50	20	IDGD	
C[C@H](CBr)C(=O)N1CCCC2(CCN(C(=O)CN3CCCC3=O)CC2)C1	1805381896	BDRGVNOJQSZXGZ-OAHLLOKOSA-N	428.371	1.871	50	20	IDGD	
C#CCCCCC(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1	1807366873	HXVAGOMHHOSIDM-NFBKMPQASA-N	433.317	1.275	50	20	IDGD	
CCc1ncccc1C(=O)N1CCCC2(CCN(C(=O)c3cccc(B(O)O)c3)CC2)C1	1807591005	WBTGRITUJHXYBV-UHFFFAOYSA-N	435.333	1.482	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)c1n[nH]c2ccccc12	1809822855	TXQVTNLAPXJXOW-POZUXBRTSA-N	427.892	1.877	50	20	IDGD	
O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)c1cccn2cncc12	1809990707	BHLRROHENSCKBA-IPELMVKDSA-N	427.892	1.649	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CC[C@H](CNC(=O)c2cc(CO)on2)[C@H]1c1cccnc1	1811592072	FUFPDUTWVZEHJO-DNVCBOLYSA-N	432.553	1.733	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)c2cc(O)ncn2)[C@H]1c1cccnc1	1812865233	NAKZAEBRWMWEEO-GHJWDPDVSA-N	434.294	1.680	50	20	IDGD	
C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)Cc2ncccn2)[C@@H]1c1cccnc1	1812865856	YMRLJHBIAIGCRE-DHSIGJKJSA-N	432.322	1.904	50	20	IDGD	
CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2ccn(C)c2)[C@@H]1c1cccnc1	1813070789	LXFFIUGCHFSGGY-LAUBAEHRSA-N	426.521	1.113	50	20	IDGD	
CC1(C)CC(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)C1	1813125543	BDUVOQHNGYVDEJ-NQIIRXRSSA-N	435.333	1.517	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CC[C@H](CNC(=O)[C@@H]2CCNC(=O)C2)[C@H]1c1cccnc1	1813135906	MTHGAUMNWJADFT-PCFVDWANSA-N	441.359	1.850	50	20	IDGD	
COC(=O)NCC(=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@H]1c1cccnc1	1813266887	MWMGZDSQRCOGGD-FPMFFAJLSA-N	431.262	1.134	50	20	IDGD	
O=C(C[C@H]1CCCCO1)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1	1815336995	IQSGJIPPWJQIEC-HZPDHXFCSA-N	443.334	1.008	50	20	IDGD	
O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc(F)cn2)[nH]n1)c1ccc(B(O)O)cc1	1817470593	FGKOHUJDQYENJW-GOSISDBHSA-N	437.240	1.243	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](C)N2CCN(C)CC2)n[nH]1	1820792639	SLEWRZOYISJLBR-UXLLHSPISA-N	440.976	1.292	50	20	IDGD	
O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](O)CCl)CC2)c1ccnc2ncccc12	1824087109	WHBBMXXVNBNHJF-IINYFYTJSA-N	431.905	1.912	50	20	IDGD	
COC[C@@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)CCN2CCN(C)CC2)CC1	1826727012	YDSROWSWZASINW-WOJBJXKFSA-N	443.032	1.497	50	20	IDGD	
C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCC(N)=O)CC1	1827679674	OTPOUNVTDKJTJP-BFTFCADCSA-N	444.536	1.006	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H]2CCC=CO2)CC1	1828924016	GOKAZGGSHFKZGM-PMACEKPBSA-N	441.532	1.611	50	20	IDGD	
CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(C4CC4)on3)CCO2)C1	1830193527	SYCSCJQUHUTUGD-FQEVSTJZSA-N	425.913	1.887	50	20	IDGD	
C=CC(=O)N[C@H](C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](F)Br)CC1	1830381584	HVCZKYVWFVRPLV-IVMMDQJWSA-N	432.334	1.987	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3onc4ccccc34)CC2)CC1)[C@@H](O)CCl	1833311719	DNIREVXFUCXLQM-SFHVURJKSA-N	434.924	1.613	50	20	IDGD	
Cc1nc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)ccc1F	1833467356	WGFMFKZNFKGTEO-KZULUSFZSA-N	444.301	1.383	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@H](C)CS(C)(=O)=O)CC2)CC1	1833483859	AGYLPXDUPLLZJO-PBHICJAKSA-N	436.018	1.256	50	20	IDGD	
Cc1noc(C)c1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)Br)C2)C1	1834067909	AHJXYPROEHKGBY-APPDUMDISA-N	430.299	1.145	50	20	IDGD	
CCN(C)[C@H](C)C(=O)N1CCC(N2CCC(NC(=O)CCBr)CC2)CC1	1834424259	NQVUGJXBCWIGBP-OAHLLOKOSA-N	431.419	1.683	50	20	IDGD	
O=C(NC1CCN(C2CCN(C(=O)c3ncn(-c4ccccc4)n3)CC2)CC1)[C@@H](F)Cl	1835079583	HDBPBTASYHXBRS-GOSISDBHSA-N	448.930	1.987	50	20	IDGD	
O=C(c1nnsc1C1CC1)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1	1836718036	PXBHPFBPHFULEO-OAHLLOKOSA-N	442.969	1.627	50	20	IDGD	
O=C(c1cccn2ccnc12)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1	1837001521	MNLAASNQBSBAQT-SFHVURJKSA-N	427.288	1.208	50	20	IDGD	
C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4ncccc4[nH]3)C2)C1	1837715656	CLOWNNRRKYMIDB-OAQYLSRUSA-N	446.580	1.484	50	20	IDGD	
CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cncnc3C)CCO2)C1	1838098560	SFEJHZYOPOQGDF-MAUKXSAKSA-N	441.326	1.029	50	20	IDGD	
Cc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)n(C(F)F)n1	1838710312	VLPAHJOZNULXFM-LJQANCHMSA-N	448.898	1.922	50	20	IDGD	
CC(=O)N[C@@H](C)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](C)Br)CC2)CC1	1838753843	DPPYLGPKYRHTCO-OLZOCXBDSA-N	432.359	1.293	50	20	IDGD	
COc1cc(OC)cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)c1	1838933763	GHBTTZCIAOYGAR-VQIMIIECSA-N	430.860	1.308	50	20	IDGD	
CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(F)c3[N+](=O)[O-])C2)C1	1839147595	WXDTUTKXGDYFQP-IFXJQAMLSA-N	443.859	1.821	50	20	IDGD	
C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(F)cn3)C2)C1	1839151464	SDVFXCCJGVWMGX-MSOLQXFVSA-N	434.295	1.527	50	20	IDGD	
CC(C)O[C@H](C)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2	1839153172	CQFVQQLFGSMCBG-ZTFGCOKTSA-N	425.353	1.493	50	20	IDGD	
C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(C#N)c3)C2)C1	1839154700	UPOAAUWLNJLRBX-VQTJNVASSA-N	440.327	1.865	50	20	IDGD	
COCCOCCOCCC(=O)N1CC2(CCCN2C(=O)[C@@H](C)CBr)C1	1841289139	MCERAGWUHQNALG-HNNXBMFYSA-N	435.359	1.291	50	20	IDGD	
O=C(/C=C/C(=O)N1CCCC12CN(C(=O)CCBr)C2)NCc1ccccc1	1841328265	CDLRORJMOKZYQF-BQYQJAHWSA-N	434.334	1.847	50	20	IDGD	
CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC2(CCCN2C(=O)Cc2ccccn2)C1	1843094475	AZXPBSFVKVQVHD-INIZCTEOSA-N	436.940	1.960	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)CCc1ccc(F)c(F)c1)C2	1844263329	SJFAFRUKDOFLNQ-UHFFFAOYSA-N	443.454	1.413	50	20	IDGD	
NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)Cc1c[nH]c3ccccc13)C2	1844264920	YAKDCTKNQWXFSS-UHFFFAOYSA-N	432.484	1.226	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)c2nccnc2C)C1	1844558839	QCVPNYPBGZWLBX-UHFFFAOYSA-N	439.428	1.749	50	20	IDGD	
CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)[C@@H](C)N(C)C(C)=O)C2	1844692654	VFSVHEXIUBBFFE-CYBMUJFWSA-N	446.460	1.204	50	20	IDGD	
C[C@@H](CBr)C(=O)N1CC2(CCCN2C(=O)[C@H](O)NC(=O)OC(C)(C)C)C1	1845436457	JQCOQVOGGVMTQH-RYUDHWBXSA-N	434.331	1.064	50	20	IDGD	
CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)CCc1cnc3ccccc3c1)C2	1846383938	KVAOGFPUGKZYAC-UHFFFAOYSA-N	437.544	1.744	50	20	IDGD	
CCOc1c(C(=O)N2CC3(CCCN3C(=O)C(Cl)Cl)C2)cnc2c1cnn2C	1846387322	IUJPCROUNVYVLW-UHFFFAOYSA-N	426.304	1.988	50	20	IDGD	
COC[C@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H]1CC(=O)N(c2cccc(OC)c2)C1	1847218854	DFXSJEYURXTBRI-FCLVOEFKSA-N	449.935	1.504	50	20	IDGD	
CC(C)(C)OC(=O)N1CC[C@@](O)(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)C(C)(C)CCl)C1	1847437826	VLAUVFUYMWXMIG-GXZWQRSESA-N	443.972	1.825	50	20	IDGD